smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[C@@H](N[C@H](Cc1ccccc1)C(=O)N1CCCC1)c1cccc(C#N)c1	ZINC000181638601	234263456	/nfs/dbraw/zinc/26/34/56/234263456.db2.gz	OVKMYJWLIKYJPL-DYESRHJHSA-N	0	3	347.462	3.443	20	30		EGEDHN
C#CCN1CCC(C(=O)NCC2(Cc3ccccc3)CCCC2)CC1	ZINC000179962171	201030865	/nfs/dbraw/zinc/03/08/65/201030865.db2.gz	BGURWRHZIRRULD-UHFFFAOYSA-N	0	3	338.495	3.251	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN2CCC[C@H]2c2ccsc2)cc1	ZINC000247642544	201178474	/nfs/dbraw/zinc/17/84/74/201178474.db2.gz	IIFXTTHDPMJCMI-AEFFLSMTSA-N	0	3	328.437	3.197	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc(N(C)C)c(C)c2)CC1	ZINC000264384500	201210366	/nfs/dbraw/zinc/21/03/66/201210366.db2.gz	LXWAGBYXNZNOOX-UHFFFAOYSA-N	0	3	330.476	3.223	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CCCN(Cc2ccccc2)CC1)OCC	ZINC000270054920	201236084	/nfs/dbraw/zinc/23/60/84/201236084.db2.gz	SCKPRCQIOCBMRY-LJQANCHMSA-N	0	3	330.472	3.092	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN(C)[C@H]1CCO[C@H](c2ccc(F)cc2)C1	ZINC000273438242	201256031	/nfs/dbraw/zinc/25/60/31/201256031.db2.gz	MURUIXKXLOJXMQ-OALUTQOASA-N	0	3	346.446	3.178	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000275682289	201284183	/nfs/dbraw/zinc/28/41/83/201284183.db2.gz	ZIUBVVXWNBVDOB-YFVAEKQCSA-N	0	3	344.499	3.242	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ncsc2-c2ccccc2)CC1	ZINC000275825031	201285597	/nfs/dbraw/zinc/28/55/97/201285597.db2.gz	RRCQFVKUHFRISP-UHFFFAOYSA-N	0	3	327.453	3.190	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H](CN(C)Cc2scnc2C)C1	ZINC000275941874	201287734	/nfs/dbraw/zinc/28/77/34/201287734.db2.gz	DZEZWUWQSBXVMW-QAPCUYQASA-N	0	3	335.517	3.334	20	30		EGEDHN
C=CCCN(C)CC(=O)Nc1ccc2nc(C(F)(F)F)[nH]c2c1	ZINC000276488029	201294680	/nfs/dbraw/zinc/29/46/80/201294680.db2.gz	UIXLRNZUDCBUDE-UHFFFAOYSA-N	0	3	326.322	3.028	20	30		EGEDHN
Cc1nsc(N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)c1C#N	ZINC000368545549	242001732	/nfs/dbraw/zinc/00/17/32/242001732.db2.gz	NJAOLTMBJNBWOC-ZIAGYGMSSA-N	0	3	348.516	3.039	20	30		EGEDHN
Cc1cc(NC(=O)C2CCN([C@@H](C)c3ccc(C#N)cc3)CC2)no1	ZINC000118391964	204274579	/nfs/dbraw/zinc/27/45/79/204274579.db2.gz	DSJLVWLNORJOFP-AWEZNQCLSA-N	0	3	338.411	3.266	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H](C)Cc2ccc(C(C)C)cc2)CC1	ZINC000157105653	205161426	/nfs/dbraw/zinc/16/14/26/205161426.db2.gz	RJIKTQBHHWZXKW-KRWDZBQOSA-N	0	3	326.484	3.202	20	30		EGEDHN
COc1ccc(CNC[C@@H](c2cccc(F)c2)N(C)C)cc1C#N	ZINC000174237823	207003089	/nfs/dbraw/zinc/00/30/89/207003089.db2.gz	WRODHOUQYGNCEH-SFHVURJKSA-N	0	3	327.403	3.098	20	30		EGEDHN
CC1CCN([C@H](CNC(=O)c2cc(C#N)c[nH]2)c2cccs2)CC1	ZINC000175095166	207092848	/nfs/dbraw/zinc/09/28/48/207092848.db2.gz	QNVKDKSBEPIMDS-MRXNPFEDSA-N	0	3	342.468	3.151	20	30		EGEDHN
C[C@H]1C[C@@H](N(C)C(=O)c2cc(C#N)c[nH]2)CCN1Cc1ccccc1	ZINC000175731916	207153717	/nfs/dbraw/zinc/15/37/17/207153717.db2.gz	KFSSDBSEUMIDDO-YJBOKZPZSA-N	0	3	336.439	3.011	20	30		EGEDHN
C[C@@H]1C[C@@H](N(C)C(=O)c2cc(C#N)c[nH]2)CCN1Cc1ccccc1	ZINC000175731897	207154488	/nfs/dbraw/zinc/15/44/88/207154488.db2.gz	KFSSDBSEUMIDDO-QAPCUYQASA-N	0	3	336.439	3.011	20	30		EGEDHN
N#Cc1ccc(S(=O)(=O)CCN[C@@H](c2ccccc2)C2CC2)cc1	ZINC000176883903	207271763	/nfs/dbraw/zinc/27/17/63/207271763.db2.gz	CDCSWZRSDICAIY-IBGZPJMESA-N	0	3	340.448	3.073	20	30		EGEDHN
N#Cc1ccc(CNCCc2cc(Cl)c3c(c2)OCCO3)s1	ZINC000176943800	207276448	/nfs/dbraw/zinc/27/64/48/207276448.db2.gz	ORDBONCXLYEWQV-UHFFFAOYSA-N	0	3	334.828	3.377	20	30		EGEDHN
N#Cc1ccc(CNCCCC(=O)N2Cc3ccccc3C2)s1	ZINC000176968196	207279737	/nfs/dbraw/zinc/27/97/37/207279737.db2.gz	WGNKYQIVSCVUDK-UHFFFAOYSA-N	0	3	325.437	3.032	20	30		EGEDHN
C[C@H](c1ccc(C#N)cc1)N(C)CCn1cc(Br)cn1	ZINC000348059743	141236911	/nfs/dbraw/zinc/23/69/11/141236911.db2.gz	GHXONPFHMFRQEE-GFCCVEGCSA-N	0	3	333.233	3.210	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN2CCC(C(F)(F)F)CC2)c1	ZINC000173010707	144033683	/nfs/dbraw/zinc/03/36/83/144033683.db2.gz	MJXQYDUODFOLKW-UHFFFAOYSA-N	0	3	325.334	3.161	20	30		EGEDHN
CCO[C@@H]1C[C@@H](NCC(=O)Nc2sccc2C#N)C1(CC)CC	ZINC000187051057	144151251	/nfs/dbraw/zinc/15/12/51/144151251.db2.gz	MVMGXGBYNDCCNS-ZIAGYGMSSA-N	0	3	335.473	3.132	20	30		EGEDHN
N#Cc1cccc(OCCN2CCC3(CC2)OCc2ccccc23)c1	ZINC000363905652	144375701	/nfs/dbraw/zinc/37/57/01/144375701.db2.gz	ZJBVIMWDKNVWKH-UHFFFAOYSA-N	0	3	334.419	3.459	20	30		EGEDHN
C[C@H]1CC(C)(C)CC[C@H]1NCCS(=O)(=O)c1ccc(C#N)cc1	ZINC000120834415	152303633	/nfs/dbraw/zinc/30/36/33/152303633.db2.gz	UMPGSBJQEQAHBF-WMLDXEAASA-N	0	3	334.485	3.136	20	30		EGEDHN
CCN1C[C@H](C)N(Cc2ccc(Br)cc2C#N)C[C@@H]1C	ZINC000346979493	156228045	/nfs/dbraw/zinc/22/80/45/156228045.db2.gz	LQXVCACWOAVJSU-STQMWFEESA-N	0	3	336.277	3.235	20	30		EGEDHN
Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@@H]1N2C(=O)c1cccc(C#N)c1	ZINC000072673025	292354161	/nfs/dbraw/zinc/35/41/61/292354161.db2.gz	IHDKNOVCDDJDNJ-ICSRJNTNSA-N	0	3	331.419	3.315	20	30		EGEDHN
CCN(Cc1cc(=O)n2c(C)cccc2n1)[C@@H](C)c1ccc(C#N)cc1	ZINC000097153520	162047845	/nfs/dbraw/zinc/04/78/45/162047845.db2.gz	OVOQODGKXZVDRU-INIZCTEOSA-N	0	3	346.434	3.458	20	30		EGEDHN
C[C@@H](CNc1nc2c(cc1C#N)CCC2)N1CCc2ccccc2C1	ZINC000338935708	163392674	/nfs/dbraw/zinc/39/26/74/163392674.db2.gz	BVOZRAFEHWLWRB-HNNXBMFYSA-N	0	3	332.451	3.301	20	30		EGEDHN
CN(CCOCc1ccc(C#N)cc1)Cc1cc2ccccc2[nH]c1=O	ZINC000344065969	164094676	/nfs/dbraw/zinc/09/46/76/164094676.db2.gz	HCWOWZDCAJJNQB-UHFFFAOYSA-N	0	3	347.418	3.461	20	30		EGEDHN
CN(CCOCc1ccc(C#N)cc1)Cc1ccc(-n2cccn2)cc1	ZINC000344072116	164096330	/nfs/dbraw/zinc/09/63/30/164096330.db2.gz	NSQPXIMYMYFPOF-UHFFFAOYSA-N	0	3	346.434	3.393	20	30		EGEDHN
N#Cc1ccc(CNCCc2cc(F)cc3c2OCOC3)c(F)c1	ZINC000344283978	164146167	/nfs/dbraw/zinc/14/61/67/164146167.db2.gz	NNRGSDXNYOUERZ-UHFFFAOYSA-N	0	3	330.334	3.035	20	30		EGEDHN
N#Cc1ccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1F	ZINC000353542887	165797925	/nfs/dbraw/zinc/79/79/25/165797925.db2.gz	WLOWUIHMSXQTPF-QGZVFWFLSA-N	0	3	338.386	3.093	20	30		EGEDHN
CC[C@H](C)N[C@@H](CNC(=O)c1c(F)cc(C#N)cc1F)c1ccco1	ZINC000359564635	167195491	/nfs/dbraw/zinc/19/54/91/167195491.db2.gz	UEOZAKUBMIUERR-NHYWBVRUSA-N	0	3	347.365	3.289	20	30		EGEDHN
C[C@H](NC[C@H](O)Cn1cccn1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000359856020	167250507	/nfs/dbraw/zinc/25/05/07/167250507.db2.gz	CAINBJMQNALCJB-KKSFZXQISA-N	0	3	346.434	3.133	20	30		EGEDHN
N#CCSCCCN1CCC(Oc2ccc(C#N)cc2F)CC1	ZINC000285344858	270040624	/nfs/dbraw/zinc/04/06/24/270040624.db2.gz	AFRKERZMEPBPPF-UHFFFAOYSA-N	0	3	333.432	3.187	20	30		EGEDHN
CSCC1CCC(NC(=O)C(C#N)Cc2ccc(C#N)cc2)CC1	ZINC000295464513	270042507	/nfs/dbraw/zinc/04/25/07/270042507.db2.gz	MCXOGGSYXBMAMG-ADKAHSJRSA-N	0	3	341.480	3.279	20	30		EGEDHN
CCN1CCN([C@@H](C)CNc2ccc(C#N)c(C(F)(F)F)c2)CC1	ZINC000301507178	270044057	/nfs/dbraw/zinc/04/40/57/270044057.db2.gz	HHZHDUSNXYKXKZ-ZDUSSCGKSA-N	0	3	340.393	3.015	20	30		EGEDHN
N#Cc1ccc(Cl)c(C(=O)N2CCCN(CC3CCC3)CC2)c1	ZINC000412310966	270046493	/nfs/dbraw/zinc/04/64/93/270046493.db2.gz	DVSSMFBLBCJVRO-UHFFFAOYSA-N	0	3	331.847	3.160	20	30		EGEDHN
CCc1ccc(CN[C@H]2CCCN(c3ccc(C#N)cc3)C2=O)cc1	ZINC000485292947	270055596	/nfs/dbraw/zinc/05/55/96/270055596.db2.gz	WRPAJVNUQUANCO-FQEVSTJZSA-N	0	3	333.435	3.406	20	30		EGEDHN
Cc1ccc(NC(=O)[C@@H]2CCCN(Cc3ccc(C#N)c(C)c3)C2)nc1	ZINC000488235086	270056055	/nfs/dbraw/zinc/05/60/55/270056055.db2.gz	UKKDDMVEYSRAIE-LJQANCHMSA-N	0	3	348.450	3.421	20	30		EGEDHN
CCC1(CC)[C@H](OC)C[C@@H]1NCC(=O)Nc1cc(Cl)ccc1C#N	ZINC000191382679	266013059	/nfs/dbraw/zinc/01/30/59/266013059.db2.gz	OTXNQUSBYDYXIA-JKSUJKDBSA-N	0	3	349.862	3.333	20	30		EGEDHN
CCN(CCNC(=O)Nc1ccc(C#N)c(C(F)(F)F)c1)C1CC1	ZINC000174099039	266126019	/nfs/dbraw/zinc/12/60/19/266126019.db2.gz	MEHQONWWCLTLHB-UHFFFAOYSA-N	0	3	340.349	3.183	20	30		EGEDHN
CC(C)Oc1cccc([C@@H](O)CNCc2ccc(C#N)cc2F)c1	ZINC000269428552	266292598	/nfs/dbraw/zinc/29/25/98/266292598.db2.gz	OKUGEKGWLHKHCD-IBGZPJMESA-N	0	3	328.387	3.308	20	30		EGEDHN
CCO[C@H]1C[C@@H](NCC(=O)Nc2cc(Cl)ccc2C#N)C12CCC2	ZINC000296328566	266302205	/nfs/dbraw/zinc/30/22/05/266302205.db2.gz	QOXCDCXGBJZZLF-CVEARBPZSA-N	0	3	347.846	3.087	20	30		EGEDHN
CC[C@@H](NC(=O)C(C#N)Cc1ccc(C#N)cc1)c1nc(C)cs1	ZINC000279453358	266370021	/nfs/dbraw/zinc/37/00/21/266370021.db2.gz	ZOKWZKGJGPFHKO-HZPDHXFCSA-N	0	3	338.436	3.273	20	30		EGEDHN
CC[C@@H](NC(=O)C(C#N)Cc1ccc(C#N)cc1)c1nc(C)cs1	ZINC000279453361	266370672	/nfs/dbraw/zinc/37/06/72/266370672.db2.gz	ZOKWZKGJGPFHKO-JKSUJKDBSA-N	0	3	338.436	3.273	20	30		EGEDHN
CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2N[C@H]1CCc2ccc(C#N)cc21	ZINC000495876116	266858461	/nfs/dbraw/zinc/85/84/61/266858461.db2.gz	NMMMOSYVBSSICM-XWTMOSNGSA-N	0	3	339.439	3.000	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CCN(C(=O)Cc2ccc(C#N)cc2)C1	ZINC000324153953	267056497	/nfs/dbraw/zinc/05/64/97/267056497.db2.gz	OXGOGALWCHOLOG-GOSISDBHSA-N	0	3	347.462	3.081	20	30		EGEDHN
CCN(CCNC(=O)N(Cc1ccc(C#N)cc1)CC(C)C)C1CC1	ZINC000523627985	267065019	/nfs/dbraw/zinc/06/50/19/267065019.db2.gz	SOXHMYJFVVKJDH-UHFFFAOYSA-N	0	3	342.487	3.210	20	30		EGEDHN
C[C@@H]1C[C@@H](N[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)c2ccccc21	ZINC000290154910	267082083	/nfs/dbraw/zinc/08/20/83/267082083.db2.gz	CWLKSDVEUMXUCB-IPHXSNPTSA-N	0	3	345.446	3.497	20	30		EGEDHN
CCO[C@@H]1CCCC[C@H]1N[C@H](C)C(=O)Nc1oc(C)c(C)c1C#N	ZINC000452038858	267146789	/nfs/dbraw/zinc/14/67/89/267146789.db2.gz	YXTMPUMTGVHIPM-DAXOMENPSA-N	0	3	333.432	3.032	20	30		EGEDHN
C[C@H](CCCNC(=O)OC(C)(C)C)NCc1ccc(C#N)cc1F	ZINC000289538156	267149236	/nfs/dbraw/zinc/14/92/36/267149236.db2.gz	BLXCHMLMASASMG-CYBMUJFWSA-N	0	3	335.423	3.480	20	30		EGEDHN
C[C@H](CN1CCC[C@@H](C)C1)NC(=O)N[C@H](C)c1ccc(C#N)cc1	ZINC000299155653	267154820	/nfs/dbraw/zinc/15/48/20/267154820.db2.gz	BZMOXYUCTLPWKW-BZUAXINKSA-N	0	3	328.460	3.039	20	30		EGEDHN
C[C@H](CNC(=O)C(C)(C)c1cc(F)cc(C#N)c1)N1CCC(C)CC1	ZINC000285189269	267159622	/nfs/dbraw/zinc/15/96/22/267159622.db2.gz	RRPPSWFVNPXXCK-OAHLLOKOSA-N	0	3	345.462	3.212	20	30		EGEDHN
C[C@H](NC(=O)NC[C@H](c1ccccc1)N(C)C)c1ccc(C#N)cc1	ZINC000298567556	267172283	/nfs/dbraw/zinc/17/22/83/267172283.db2.gz	NNJDTDGHINLREO-HNAYVOBHSA-N	0	3	336.439	3.221	20	30		EGEDHN
CC[C@](CNCc1ccc(C#N)s1)(C(=O)OC)c1ccccc1	ZINC000414595178	267239892	/nfs/dbraw/zinc/23/98/92/267239892.db2.gz	YXLXWSVZQFJLBR-GOSISDBHSA-N	0	3	328.437	3.230	20	30		EGEDHN
CN(C)CCc1ccccc1NC(=O)CSc1ccc(C#N)cc1	ZINC000275802680	267428887	/nfs/dbraw/zinc/42/88/87/267428887.db2.gz	IKTCFTFRGNRXFP-UHFFFAOYSA-N	0	3	339.464	3.393	20	30		EGEDHN
Cc1ccc([C@@H](C)[NH2+][C@H]2CCCN(c3ccc(C#N)cc3)C2=O)c([O-])c1	ZINC000273475490	267439885	/nfs/dbraw/zinc/43/98/85/267439885.db2.gz	SSWURHJMYXCYTA-BEFAXECRSA-N	0	3	349.434	3.419	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N1CCC(C(=O)NCC(F)(F)F)CC1	ZINC000527190884	267730817	/nfs/dbraw/zinc/73/08/17/267730817.db2.gz	LTWIQDZYEYWOJC-LBPRGKRZSA-N	0	3	339.361	3.010	20	30		EGEDHN
Cc1ccc(NC(=O)c2ccc(C#N)s2)c(OCCN(C)C)c1	ZINC000487570482	268039910	/nfs/dbraw/zinc/03/99/10/268039910.db2.gz	IGVXODUADUSLKW-UHFFFAOYSA-N	0	3	329.425	3.121	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CC[C@H](c3cccc(F)c3)C2)cc1	ZINC000279263717	268083824	/nfs/dbraw/zinc/08/38/24/268083824.db2.gz	ILUCCARBIUZFLX-OALUTQOASA-N	0	3	347.393	3.396	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CCc3ccc(Cl)cc3C2)cc1	ZINC000348417740	268089680	/nfs/dbraw/zinc/08/96/80/268089680.db2.gz	HLWUZGQASLIVSV-QGZVFWFLSA-N	0	3	349.821	3.479	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CCS[C@H]3CCCC[C@@H]32)cc1	ZINC000279915385	268089797	/nfs/dbraw/zinc/08/97/97/268089797.db2.gz	FDKLZOAQMIHDCB-SQNIBIBYSA-N	0	3	339.464	3.127	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@H]2C[C@@H]2c2ccc(F)cc2)cc1	ZINC000348504418	268091967	/nfs/dbraw/zinc/09/19/67/268091967.db2.gz	CFTZNEOVOKPFTR-QRQLOZEOSA-N	0	3	333.366	3.052	20	30		EGEDHN
N#Cc1ccc(Cl)cc1NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000302034877	268101535	/nfs/dbraw/zinc/10/15/35/268101535.db2.gz	DZHHYNOMMJYZTG-GOSISDBHSA-N	0	3	341.842	3.390	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCN2CCC[C@H](c3ccncc3)C2)cc1	ZINC000289332128	268138172	/nfs/dbraw/zinc/13/81/72/268138172.db2.gz	KZKHJBAMZNEIJM-SFHVURJKSA-N	0	3	334.423	3.161	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCN(CCCOCc3ccccc3)C2)nc1	ZINC000292145789	268181762	/nfs/dbraw/zinc/18/17/62/268181762.db2.gz	JUNUBKSPTOUOTJ-LJQANCHMSA-N	0	3	337.423	3.013	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H]2[C@H]2CCC[C@@H]2O)c(OC(F)F)c1	ZINC000451426483	268219361	/nfs/dbraw/zinc/21/93/61/268219361.db2.gz	VAYOGWRFDBVPGI-OAGGEKHMSA-N	0	3	336.382	3.285	20	30		EGEDHN
N#Cc1cccc(C2(NCCCS(=O)(=O)c3ccccc3)CC2)c1	ZINC000271844569	268241751	/nfs/dbraw/zinc/24/17/51/268241751.db2.gz	WLEQCRBXFGDBBE-UHFFFAOYSA-N	0	3	340.448	3.001	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN2CCS[C@@H]3CCCC[C@H]32)c1	ZINC000333205394	268264389	/nfs/dbraw/zinc/26/43/89/268264389.db2.gz	AKTFOSUTGWGGSD-IAGOWNOFSA-N	0	3	329.469	3.247	20	30		EGEDHN
N#Cc1cccc(NCCCN2CCc3ccccc3C2)c1[N+](=O)[O-]	ZINC000450240615	268281364	/nfs/dbraw/zinc/28/13/64/268281364.db2.gz	ILTAGCRJVNICMJ-UHFFFAOYSA-N	0	3	336.395	3.327	20	30		EGEDHN
N#Cc1ccccc1OCCN1CC[C@@H](COCc2ccccc2)C1	ZINC000173987150	268282405	/nfs/dbraw/zinc/28/24/05/268282405.db2.gz	WSLFZTQCKQTCPR-LJQANCHMSA-N	0	3	336.435	3.476	20	30		EGEDHN
N#Cc1cccc([C@@H]2C[C@H]2C(=O)N2CCN(C3CCCCC3)CC2)c1	ZINC000412197360	268288138	/nfs/dbraw/zinc/28/81/38/268288138.db2.gz	SKQMKDVACGZXKD-VQTJNVASSA-N	0	3	337.467	3.139	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CN1CCC=C(c2ccccc2)C1	ZINC000528496889	268299841	/nfs/dbraw/zinc/29/98/41/268299841.db2.gz	KMTKTDJFFCXLCF-HXUWFJFHSA-N	0	3	334.419	3.087	20	30		EGEDHN
CN(C)[C@@]1(CNc2ccc(C(F)(F)F)cc2C#N)CCSC1	ZINC000343925449	276848888	/nfs/dbraw/zinc/84/88/88/276848888.db2.gz	RBWGXHYOTMYPFX-CQSZACIVSA-N	0	3	329.391	3.426	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@](C)(NCc1ccc(C#N)cc1)C1CC1	ZINC000236795507	278433053	/nfs/dbraw/zinc/43/30/53/278433053.db2.gz	PVBJRIOBIRRLBE-LJQANCHMSA-N	0	3	329.444	3.341	20	30		EGEDHN
C[C@H](CN1C[C@H](C)C[C@@H](C)C1)NC(=O)CSc1ccc(C#N)cc1	ZINC000343384702	279322184	/nfs/dbraw/zinc/32/21/84/279322184.db2.gz	ARSHERLBQJCADD-BZUAXINKSA-N	0	3	345.512	3.133	20	30		EGEDHN
CCN(CC)C(=O)C1(NCCOc2cccc(C#N)c2)CCCCC1	ZINC000118847156	307488290	/nfs/dbraw/zinc/48/82/90/307488290.db2.gz	NQZMYMJOGXCMDK-UHFFFAOYSA-N	0	3	343.471	3.098	20	30		EGEDHN
N#Cc1ccccc1CSCCNCc1ccc2c(c1)OCCO2	ZINC000170670646	307934128	/nfs/dbraw/zinc/93/41/28/307934128.db2.gz	MXKSOCSSWJILHU-UHFFFAOYSA-N	0	3	340.448	3.352	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)c2cccc(C#N)c2C)N(C)C)cc1	ZINC000512342373	312183751	/nfs/dbraw/zinc/18/37/51/312183751.db2.gz	KMOSIWYVTHXXQR-HXUWFJFHSA-N	0	3	335.451	3.462	20	30		EGEDHN
CN(C)CCN(Cc1cccs1)C(=O)c1ccc(Cl)c(C#N)c1	ZINC000537584537	314191792	/nfs/dbraw/zinc/19/17/92/314191792.db2.gz	JSEYQWNGCPKGSJ-UHFFFAOYSA-N	0	3	347.871	3.477	20	30		EGEDHN
N#Cc1ccc(NC(=O)CN2CCC[C@@H]2C2CCOCC2)cc1Cl	ZINC000539727426	314332231	/nfs/dbraw/zinc/33/22/31/314332231.db2.gz	LNSMLMURECDXEA-QGZVFWFLSA-N	0	3	347.846	3.041	20	30		EGEDHN
C[C@H]1CSC[C@H]1NCC(=O)Nc1sc2c(c1C#N)CCCCC2	ZINC000552006365	315187346	/nfs/dbraw/zinc/18/73/46/315187346.db2.gz	LLKZEDYGHPOUKD-SMDDNHRTSA-N	0	3	349.525	3.168	20	30		EGEDHN
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCc1ccc(F)c(C#N)c1	ZINC000560182621	315666429	/nfs/dbraw/zinc/66/64/29/315666429.db2.gz	NFCUZOOXMIYFTE-RDTXWAMCSA-N	0	3	340.398	3.207	20	30		EGEDHN
CN(C[C@@H]1CCCN1C)C(=O)c1cccc(Nc2ccc(C#N)cc2)c1	ZINC000564816705	316211091	/nfs/dbraw/zinc/21/10/91/316211091.db2.gz	NQLSITCXUVTDTG-FQEVSTJZSA-N	0	3	348.450	3.468	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H]2CCCC[C@H]2SCC)CC1	ZINC000176486125	454750715	/nfs/dbraw/zinc/75/07/15/454750715.db2.gz	LAJMKKXYGPQJLG-DLBZAZTESA-N	0	3	339.549	3.390	20	30		EGEDHN
N#Cc1ccc(CN2CCN(c3ccnc4ccccc43)CC2)s1	ZINC000565959874	316395476	/nfs/dbraw/zinc/39/54/76/316395476.db2.gz	VLZXLIORUCSZDV-UHFFFAOYSA-N	0	3	334.448	3.490	20	30		EGEDHN
CC(C)(C)OC1CCN(CCC(=O)Nc2sccc2C#N)CC1	ZINC000164918480	454890694	/nfs/dbraw/zinc/89/06/94/454890694.db2.gz	CSDUESWGJFKTJL-UHFFFAOYSA-N	0	3	335.473	3.228	20	30		EGEDHN
CCN1CCCC[C@@H]1CNC(=O)N[C@@H]1CCCc2cc(C#N)ccc21	ZINC000570306033	317037932	/nfs/dbraw/zinc/03/79/32/317037932.db2.gz	FBUKBSKKGITZKO-IEBWSBKVSA-N	0	3	340.471	3.109	20	30		EGEDHN
Cc1cc(NC[C@@H]2CCCN(C)[C@H]2c2cccs2)c(C#N)cn1	ZINC000571635478	317226785	/nfs/dbraw/zinc/22/67/85/317226785.db2.gz	HMJCPCFNIHCSFP-KBXCAEBGSA-N	0	3	326.469	3.240	20	30		EGEDHN
C[C@@H](NCCNC(=O)c1ccccc1Cl)c1ccc(C#N)cc1	ZINC000173909573	323299286	/nfs/dbraw/zinc/29/92/86/323299286.db2.gz	XDDJYQOOQOPQED-CYBMUJFWSA-N	0	3	327.815	3.292	20	30		EGEDHN
C[C@@H](N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)c1ccc(C#N)cc1	ZINC000181890086	323510181	/nfs/dbraw/zinc/51/01/81/323510181.db2.gz	BCDFSCFBFHPKPH-DYESRHJHSA-N	0	3	347.462	3.443	20	30		EGEDHN
CCc1nnc(NC[C@@H]2CCN(Cc3ccccc3)C2)c(C#N)c1CC	ZINC000382352078	324249895	/nfs/dbraw/zinc/24/98/95/324249895.db2.gz	JVTHEJYKWLIGHS-KRWDZBQOSA-N	0	3	349.482	3.407	20	30		EGEDHN
C[C@H]1C[C@@H]1N1CCN(C(=O)c2ccc(Cl)c(C#N)c2)C[C@@H](C)C1	ZINC000579020230	325051574	/nfs/dbraw/zinc/05/15/74/325051574.db2.gz	FMHJXXQFQFBECO-DCGLDWPTSA-N	0	3	331.847	3.014	20	30		EGEDHN
COC[C@]1(CN[C@@H]2CCc3ccc(C#N)cc32)OCCc2ccccc21	ZINC000581696491	325383038	/nfs/dbraw/zinc/38/30/38/325383038.db2.gz	MZPPMJRIZRILKK-YADHBBJMSA-N	0	3	348.446	3.250	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](NCc3cccc(C4CC4)c3)C2=O)cc1	ZINC000581878092	325395724	/nfs/dbraw/zinc/39/57/24/325395724.db2.gz	PZPDRKVSJWQBFB-OAQYLSRUSA-N	0	3	345.446	3.326	20	30		EGEDHN
CN1CCC(C(=O)N[C@@H](C#N)c2c(Cl)cccc2Cl)CC1	ZINC000345523589	456980867	/nfs/dbraw/zinc/98/08/67/456980867.db2.gz	NOBRDMBYQUUYRO-ZDUSSCGKSA-N	0	3	326.227	3.016	20	30		EGEDHN
Cc1cccc(C)c1CC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000183065719	455221213	/nfs/dbraw/zinc/22/12/13/455221213.db2.gz	WYBNDPBECDDTNM-UHFFFAOYSA-N	0	3	349.478	3.308	20	30		EGEDHN
CN(C)[C@H](CNc1ccc([N+](=O)[O-])c(C#N)c1)c1ccc(F)cc1	ZINC000157695415	455221697	/nfs/dbraw/zinc/22/16/97/455221697.db2.gz	KMNBBAQPDYIRLK-QGZVFWFLSA-N	0	3	328.347	3.320	20	30		EGEDHN
Cc1ccc(NC2CCN(Cc3ccc(C#N)cc3)CC2)cc1C(N)=O	ZINC000183118817	455232911	/nfs/dbraw/zinc/23/29/11/455232911.db2.gz	AFZTVTOTYBCUFN-UHFFFAOYSA-N	0	3	348.450	3.042	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](Cc2ccc(F)cc2)C(C)C)CC1	ZINC000173198937	455245798	/nfs/dbraw/zinc/24/57/98/455245798.db2.gz	UBDXZIZFAZRNHF-IBGZPJMESA-N	0	3	347.478	3.342	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](Cc2ccc(F)cc2)C(C)C)CC1	ZINC000173198919	455246020	/nfs/dbraw/zinc/24/60/20/455246020.db2.gz	UBDXZIZFAZRNHF-LJQANCHMSA-N	0	3	347.478	3.342	20	30		EGEDHN
CCCN(CC#Cc1ccc(OC(F)(F)F)cc1)CC(C)(C)O	ZINC000533326413	459221085	/nfs/dbraw/zinc/22/10/85/459221085.db2.gz	MOBHYQPEAATJNZ-UHFFFAOYSA-N	0	3	329.362	3.420	20	30		EGEDHN
C[C@H](NCCC(=O)N(C)CCC#N)c1ccc(-c2ccncc2)cc1	ZINC000180928294	455265052	/nfs/dbraw/zinc/26/50/52/455265052.db2.gz	FZEQZQIYWMBBLL-INIZCTEOSA-N	0	3	336.439	3.161	20	30		EGEDHN
COc1ccc(CN(C)C[C@H]2CCCC[C@@H]2O)cc1OCCCC#N	ZINC000181091408	455286258	/nfs/dbraw/zinc/28/62/58/455286258.db2.gz	UUKYQJOXUVYMNG-MSOLQXFVSA-N	0	3	346.471	3.361	20	30		EGEDHN
CC[C@]1(CO)CCCN(Cc2ccc(OC)c(OCCCC#N)c2)C1	ZINC000190228783	455289902	/nfs/dbraw/zinc/28/99/02/455289902.db2.gz	BMMWMIAHDYHECP-FQEVSTJZSA-N	0	3	346.471	3.362	20	30		EGEDHN
C[C@]1(C#N)CCCN(C(=O)c2ccc(CN3CCCCC3)cc2)C1	ZINC000612243486	460575486	/nfs/dbraw/zinc/57/54/86/460575486.db2.gz	UTKGGEJVNYQITB-HXUWFJFHSA-N	0	3	325.456	3.438	20	30		EGEDHN
C[C@]1(C#N)CCCN(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)C1	ZINC000612354992	460603276	/nfs/dbraw/zinc/60/32/76/460603276.db2.gz	DMUPQNLPZIHHLF-AZUAARDMSA-N	0	3	340.471	3.159	20	30		EGEDHN
Cc1ccccc1OCCN(C)CCC(=O)Nc1ccccc1C#N	ZINC000014079513	453503987	/nfs/dbraw/zinc/50/39/87/453503987.db2.gz	ZFDLDNVJMJUNJV-UHFFFAOYSA-N	0	3	337.423	3.206	20	30		EGEDHN
C=CCC1(NCc2cc(C)c(Br)cn2)CCOCC1	ZINC000623564405	460614829	/nfs/dbraw/zinc/61/48/29/460614829.db2.gz	BKYOBVXBKPEONN-UHFFFAOYSA-N	0	3	325.250	3.367	20	30		EGEDHN
C#Cc1cccc(NC(=O)NC2CCN(Cc3ccccc3)CC2)c1	ZINC000024690208	453742352	/nfs/dbraw/zinc/74/23/52/453742352.db2.gz	IHTWQJIETWJAQV-UHFFFAOYSA-N	0	3	333.435	3.454	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)c1cccc(C#N)c1)N1CCc2ccccc2C1	ZINC000025534794	453776980	/nfs/dbraw/zinc/77/69/80/453776980.db2.gz	NVKCOAZMVPAKLV-OAQYLSRUSA-N	0	3	347.462	3.371	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H](O)COc1ccc(Cl)cc1	ZINC000026329548	453797247	/nfs/dbraw/zinc/79/72/47/453797247.db2.gz	DBAPSVKSIWFMDV-KRWDZBQOSA-N	0	3	330.815	3.083	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)CN(C)CC12CC3CC(CC(C3)C1)C2	ZINC000027782616	453820445	/nfs/dbraw/zinc/82/04/45/453820445.db2.gz	DFJXRMYENRENMN-OFGIBPIPSA-N	0	3	331.504	3.189	20	30		EGEDHN
C[C@H](C(=O)NC1(C#N)CCCCC1)N(C)CCCc1ccccc1	ZINC000052802569	453845129	/nfs/dbraw/zinc/84/51/29/453845129.db2.gz	SWAZYBYLHKOWCE-QGZVFWFLSA-N	0	3	327.472	3.282	20	30		EGEDHN
C[C@H](CNC(=O)c1ccccc1Sc1ccccc1C#N)N(C)C	ZINC000032170530	453865504	/nfs/dbraw/zinc/86/55/04/453865504.db2.gz	NRGTXENKBHEHFC-CQSZACIVSA-N	0	3	339.464	3.389	20	30		EGEDHN
N#Cc1ccccc1N1CCCN(CCCOCC(F)(F)F)CC1	ZINC000053609384	453890286	/nfs/dbraw/zinc/89/02/86/453890286.db2.gz	FHOMRGODQCYZID-UHFFFAOYSA-N	0	3	341.377	3.039	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2cccc(CC#N)c2)C1	ZINC000054223005	453916777	/nfs/dbraw/zinc/91/67/77/453916777.db2.gz	YNXDGMHAYZHPGI-JXFKEZNVSA-N	0	3	333.435	3.318	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)c2ccc(OC[C@H]3CCCO3)cc2)n1	ZINC000041521745	453970058	/nfs/dbraw/zinc/97/00/58/453970058.db2.gz	PWJOAKGQNJKFJV-CVEARBPZSA-N	0	3	342.420	3.499	20	30		EGEDHN
N#Cc1ccc(CNC(=O)NC2CCN(Cc3ccccc3)CC2)cc1	ZINC000042929510	454032431	/nfs/dbraw/zinc/03/24/31/454032431.db2.gz	GGXGCGVIBBMTPQ-UHFFFAOYSA-N	0	3	348.450	3.022	20	30		EGEDHN
CN(C)CCOc1ccc(CNc2c(C#N)nnc3ccccc32)cc1	ZINC000077191560	454072911	/nfs/dbraw/zinc/07/29/11/454072911.db2.gz	XYCPRPQMKUOPTM-UHFFFAOYSA-N	0	3	347.422	3.054	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)cc1)C[C@H](O)COc1ccc(F)cc1	ZINC000069071179	454076945	/nfs/dbraw/zinc/07/69/45/454076945.db2.gz	JCVVFDBUCACVTB-IBGZPJMESA-N	0	3	342.414	3.348	20	30		EGEDHN
COc1ccccc1C(C)(C)NCCOc1ccc(C#N)cc1OC	ZINC000077281604	454085082	/nfs/dbraw/zinc/08/50/82/454085082.db2.gz	XDQJRDKUWUESAH-UHFFFAOYSA-N	0	3	340.423	3.479	20	30		EGEDHN
C=C(Cl)CNC(=O)Nc1ccc(CCN2CCSCC2)cc1	ZINC000077437923	454106344	/nfs/dbraw/zinc/10/63/44/454106344.db2.gz	MUSDLEYACTZZCK-UHFFFAOYSA-N	0	3	339.892	3.152	20	30		EGEDHN
Cc1csc(CON=C(N)c2ccccc2CN2CCCCC2)n1	ZINC000088519821	454109630	/nfs/dbraw/zinc/10/96/30/454109630.db2.gz	XDPBNUPASVHQFU-UHFFFAOYSA-N	0	3	344.484	3.275	20	30		EGEDHN
C=C(Cl)CNC(=O)NCC1CCN(Cc2cccs2)CC1	ZINC000077575686	454126017	/nfs/dbraw/zinc/12/60/17/454126017.db2.gz	ALYHKHBNEXVMHF-UHFFFAOYSA-N	0	3	327.881	3.012	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(F)cc2OCC2CC2)CC1	ZINC000077724327	454148274	/nfs/dbraw/zinc/14/82/74/454148274.db2.gz	QIOUKUBZPVPFNN-UHFFFAOYSA-N	0	3	347.434	3.386	20	30		EGEDHN
N#Cc1ccc(C(=O)NC[C@H]2CCCN(Cc3cccs3)C2)cc1	ZINC000058267182	454176375	/nfs/dbraw/zinc/17/63/75/454176375.db2.gz	XQAFFXBCGYBXKL-MRXNPFEDSA-N	0	3	339.464	3.262	20	30		EGEDHN
C[C@H]1C[C@@H]1c1ccc(CN(CCC(=O)N(C)CCC#N)C2CC2)o1	ZINC000130905152	454225618	/nfs/dbraw/zinc/22/56/18/454225618.db2.gz	GWXWVXIIAHJRMR-YOEHRIQHSA-N	0	3	329.444	3.130	20	30		EGEDHN
CC(C)[C@@H](NCC(=O)N[C@](C)(C#N)C1CC1)c1ccc(Cl)cc1	ZINC000078396191	454247482	/nfs/dbraw/zinc/24/74/82/454247482.db2.gz	UYPAMOLDYZXPKW-QZTJIDSGSA-N	0	3	333.863	3.435	20	30		EGEDHN
C[C@@H](NC[C@@H](O)c1ccc(C#N)cc1)c1cccc(N2CCCC2=O)c1	ZINC000095984704	454250958	/nfs/dbraw/zinc/25/09/58/454250958.db2.gz	YLWMDMVMKIGERO-FOIQADDNSA-N	0	3	349.434	3.069	20	30		EGEDHN
CN(Cc1ccccc1)[C@H]1CCN(c2c(C#N)nnc3ccccc32)C1	ZINC000078507394	454266165	/nfs/dbraw/zinc/26/61/65/454266165.db2.gz	IBJAEGMOHGTSMZ-KRWDZBQOSA-N	0	3	343.434	3.212	20	30		EGEDHN
CC(C)n1cccc1C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000120505382	454311315	/nfs/dbraw/zinc/31/13/15/454311315.db2.gz	ASLDAOSHPIRONI-UHFFFAOYSA-N	0	3	338.455	3.145	20	30		EGEDHN
C[C@@H]1C[C@H](N(C)C(=O)c2ccc(C#N)cn2)CCN1Cc1ccccc1	ZINC000132446636	454338937	/nfs/dbraw/zinc/33/89/37/454338937.db2.gz	NTXBRRILDUKMPW-VQIMIIECSA-N	0	3	348.450	3.078	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1SCc1cc(C)on1	ZINC000072850679	454351697	/nfs/dbraw/zinc/35/16/97/454351697.db2.gz	BCTSMHDSWMOENZ-UHFFFAOYSA-N	0	3	347.488	3.081	20	30		EGEDHN
C[C@@H](SCC(=O)C(C#N)c1nc(-c2ccccc2)cs1)[C@H](C)O	ZINC000079064844	454363015	/nfs/dbraw/zinc/36/30/15/454363015.db2.gz	CBPPLTXCWJGWJC-OUCADQQQSA-N	0	3	346.477	3.489	20	30		EGEDHN
CN(C)[C@@H](CNC(=O)N(C)Cc1ccc(C#N)cc1)c1ccccc1	ZINC000079121275	454371874	/nfs/dbraw/zinc/37/18/74/454371874.db2.gz	WRFRXFUULDINPL-IBGZPJMESA-N	0	3	336.439	3.003	20	30		EGEDHN
O=C(NCC#Cc1ccccc1)NC[C@@H](c1ccccc1)N1CCCC1	ZINC000047949216	454423931	/nfs/dbraw/zinc/42/39/31/454423931.db2.gz	FDWXSWSUMAMEKO-NRFANRHFSA-N	0	3	347.462	3.174	20	30		EGEDHN
CC[C@H](NCC(=O)N(CCC#N)CCC#N)c1ccc(Cl)cc1	ZINC000097258870	454429902	/nfs/dbraw/zinc/42/99/02/454429902.db2.gz	NFFHVCJYCPCABZ-INIZCTEOSA-N	0	3	332.835	3.037	20	30		EGEDHN
N#CCSc1cccc(C(=O)N2CC[C@@H](N3CCCCC3)C2)c1	ZINC000079542508	454434932	/nfs/dbraw/zinc/43/49/32/454434932.db2.gz	DDNXPNMBDFQSBU-MRXNPFEDSA-N	0	3	329.469	3.003	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)C[C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000102401458	454503024	/nfs/dbraw/zinc/50/30/24/454503024.db2.gz	MZUCKFFHRHGRJA-BXUZGUMPSA-N	0	3	340.345	3.432	20	30		EGEDHN
C=CCN(CC=C)C(=O)NC[C@H]1CCCN(Cc2cccs2)C1	ZINC000064755081	454503978	/nfs/dbraw/zinc/50/39/78/454503978.db2.gz	DZUJGGZNGUNSHO-MRXNPFEDSA-N	0	3	333.501	3.344	20	30		EGEDHN
C=CCOc1ccc(CN2CCC[C@@H](c3ncc[nH]3)C2)cc1OC	ZINC000092072806	454515760	/nfs/dbraw/zinc/51/57/60/454515760.db2.gz	WMLZRFIJZOSVRN-MRXNPFEDSA-N	0	3	327.428	3.363	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1CCC[C@@H]1c1cccc(C)c1C	ZINC000122330365	454524475	/nfs/dbraw/zinc/52/44/75/454524475.db2.gz	OYEGHWCUZBOADB-DNVCBOLYSA-N	0	3	327.472	3.449	20	30		EGEDHN
N#Cc1csc(CNCCOc2ncc(Cl)cc2Cl)c1	ZINC000134475142	454548452	/nfs/dbraw/zinc/54/84/52/454548452.db2.gz	DFWOXHUOEMWYBT-UHFFFAOYSA-N	0	3	328.224	3.490	20	30		EGEDHN
C=CCOCCCC(=O)N1c2ccc(C)cc2[C@H]2CN(C)CC[C@@H]21	ZINC000074238919	454549137	/nfs/dbraw/zinc/54/91/37/454549137.db2.gz	LSBMJZFVGQDXIY-MJGOQNOKSA-N	0	3	328.456	3.112	20	30		EGEDHN
C=CCOCCCC(=O)NC1CCN([C@H](C)c2ccccc2)CC1	ZINC000080326915	454567370	/nfs/dbraw/zinc/56/73/70/454567370.db2.gz	MKJYPPQJFNLUIV-QGZVFWFLSA-N	0	3	330.472	3.311	20	30		EGEDHN
CN(C)CCOc1ccccc1CNc1snc(Cl)c1C#N	ZINC000092627275	454596743	/nfs/dbraw/zinc/59/67/43/454596743.db2.gz	JTVRLZKCOGCPGI-UHFFFAOYSA-N	0	3	336.848	3.221	20	30		EGEDHN
COc1ccc(C#N)cc1CN1CC[C@@H]2[C@H](CCCN2C2CC2)C1	ZINC000134937605	454612692	/nfs/dbraw/zinc/61/26/92/454612692.db2.gz	RZBFHINETHNWIM-VQIMIIECSA-N	0	3	325.456	3.016	20	30		EGEDHN
CCCCNC(=O)[C@@H]1CC[C@H](C)N(Cc2ccc(OC)c(C#N)c2)C1	ZINC000135005302	454623130	/nfs/dbraw/zinc/62/31/30/454623130.db2.gz	CIBOQHCVIJVEGX-DOTOQJQBSA-N	0	3	343.471	3.084	20	30		EGEDHN
CN(CCC#N)C(=O)CCN1CC=C(c2ccc(Cl)cc2)CC1	ZINC000092805548	454636618	/nfs/dbraw/zinc/63/66/18/454636618.db2.gz	COVMPLHTUCCUQF-UHFFFAOYSA-N	0	3	331.847	3.191	20	30		EGEDHN
Cc1nc(C(C)C)sc1[C@@H](C)N(C)CCC(=O)N(C)CCC#N	ZINC000092807649	454636800	/nfs/dbraw/zinc/63/68/00/454636800.db2.gz	XKQMOKXPMIJBKQ-CQSZACIVSA-N	0	3	336.505	3.330	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)c2sccc2C#N)N(C)C)cc1	ZINC000052034146	454650455	/nfs/dbraw/zinc/65/04/55/454650455.db2.gz	HMRHBXVNEXTSRS-INIZCTEOSA-N	0	3	327.453	3.215	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cccc(N3CCCC3)c2)CC1	ZINC000106323898	454690227	/nfs/dbraw/zinc/69/02/27/454690227.db2.gz	DOKJEIFSNILFDA-UHFFFAOYSA-N	0	3	342.487	3.449	20	30		EGEDHN
C=C(C)COCCNCc1ccc(-c2ccc(C(=O)OC)cc2)o1	ZINC000152768463	454723496	/nfs/dbraw/zinc/72/34/96/454723496.db2.gz	DQTBABPOOILWHK-UHFFFAOYSA-N	0	3	329.396	3.416	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCCc2cc3ccccc3[nH]2)CC1	ZINC000136212466	454728961	/nfs/dbraw/zinc/72/89/61/454728961.db2.gz	HVMOJAVFOLUNPZ-UHFFFAOYSA-N	0	3	340.471	3.050	20	30		EGEDHN
CC(C)(CCC#N)CN1CCc2c(cccc2N2CCOC2=O)C1	ZINC000093740742	454731492	/nfs/dbraw/zinc/73/14/92/454731492.db2.gz	YPCLDLFJLHYHLZ-UHFFFAOYSA-N	0	3	327.428	3.331	20	30		EGEDHN
COc1cccc(OCCN2CCN(CC(C)(C)CCC#N)CC2)c1	ZINC000093762046	454733451	/nfs/dbraw/zinc/73/34/51/454733451.db2.gz	DWKFVIMHPRGESP-UHFFFAOYSA-N	0	3	345.487	3.022	20	30		EGEDHN
CN(CCOCC1CC1)Cc1cn(CCC#N)nc1-c1ccccc1	ZINC000093818484	454737679	/nfs/dbraw/zinc/73/76/79/454737679.db2.gz	PDYFYEBBLBUASD-UHFFFAOYSA-N	0	3	338.455	3.322	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cnn(CCC(C)C)c2C)CC1	ZINC000161949389	454739241	/nfs/dbraw/zinc/73/92/41/454739241.db2.gz	ORELEWSRICOJLB-UHFFFAOYSA-N	0	3	347.507	3.400	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C[C@H](C)Cc2ccccc2OC)CC1	ZINC000107256378	454748526	/nfs/dbraw/zinc/74/85/26/454748526.db2.gz	MGZZJCDJLRVIOA-QGZVFWFLSA-N	0	3	344.499	3.421	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H](CC)Oc2cccc(C)c2)CC1	ZINC000176523327	454755660	/nfs/dbraw/zinc/75/56/60/454755660.db2.gz	LGUWTJJXRHGNCV-IBGZPJMESA-N	0	3	330.472	3.309	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCCCSCC(C)C)CC1	ZINC000124654352	454756886	/nfs/dbraw/zinc/75/68/86/454756886.db2.gz	QTFUSXROIPZQBB-UHFFFAOYSA-N	0	3	327.538	3.105	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(C)c(Br)c2)CC1	ZINC000176780127	454781860	/nfs/dbraw/zinc/78/18/60/454781860.db2.gz	CGJLLGFYVCFRFD-UHFFFAOYSA-N	0	3	337.261	3.138	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H]2CCCc3sccc32)CC1	ZINC000163042530	454819440	/nfs/dbraw/zinc/81/94/40/454819440.db2.gz	AKFDZOZOOXRAHV-INIZCTEOSA-N	0	3	333.501	3.465	20	30		EGEDHN
CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Nc1cc(C#N)cn1C(C)(C)C	ZINC000177247538	454842361	/nfs/dbraw/zinc/84/23/61/454842361.db2.gz	YVCDTYATRXYTJA-CVEARBPZSA-N	0	3	343.475	3.205	20	30		EGEDHN
N#Cc1ccccc1N1CCCN(C[C@@H](O)CCc2ccccc2)CC1	ZINC000182238320	455468669	/nfs/dbraw/zinc/46/86/69/455468669.db2.gz	DFGRDWFAIKNUOW-NRFANRHFSA-N	0	3	349.478	3.064	20	30		EGEDHN
Cc1ccc(C[NH+](C)C)cc1[N-]S(=O)(=O)c1cc(C#N)ccc1C	ZINC000154039455	454859953	/nfs/dbraw/zinc/85/99/53/454859953.db2.gz	PHGIWUDVWPBGKI-UHFFFAOYSA-N	0	3	343.452	3.038	20	30		EGEDHN
C=CC1CCN(C(=O)NCCCN2CCc3ccccc3C2)CC1	ZINC000111452327	454865187	/nfs/dbraw/zinc/86/51/87/454865187.db2.gz	JQNZGOZHSNSWDN-UHFFFAOYSA-N	0	3	327.472	3.042	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN[C@H](C)c1ccc2c(c1)CCCC2	ZINC000154342947	454887271	/nfs/dbraw/zinc/88/72/71/454887271.db2.gz	ABKQZIZOUCFQNQ-HZPDHXFCSA-N	0	3	327.472	3.224	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN[C@@H](C)c1ccc2c(c1)CCCC2	ZINC000154342616	454887451	/nfs/dbraw/zinc/88/74/51/454887451.db2.gz	ABKQZIZOUCFQNQ-HOTGVXAUSA-N	0	3	327.472	3.224	20	30		EGEDHN
C[C@@H](NCC1(c2c(F)cccc2F)CCCC1)C(=O)N(C)CCC#N	ZINC000112539670	454888971	/nfs/dbraw/zinc/88/89/71/454888971.db2.gz	CIDLYSBPLPFIPH-CQSZACIVSA-N	0	3	349.425	3.127	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N1CCC[C@H](COC)C1	ZINC000112987991	454909819	/nfs/dbraw/zinc/90/98/19/454909819.db2.gz	HUFWVZWWGVMXDN-HOTGVXAUSA-N	0	3	336.501	3.010	20	30		EGEDHN
C=C(Cl)COc1ccc([C@@H](C)N[C@@H]2CCN(C(=O)CC)C2)cc1	ZINC000126730587	454914839	/nfs/dbraw/zinc/91/48/39/454914839.db2.gz	UBXUNAMCQJQHGY-GDBMZVCRSA-N	0	3	336.863	3.479	20	30		EGEDHN
N#CCCn1cc(CNCCc2nccs2)c(-c2ccccc2)n1	ZINC000113331378	454923363	/nfs/dbraw/zinc/92/33/63/454923363.db2.gz	QDQMVUYBXFZNKW-UHFFFAOYSA-N	0	3	337.452	3.253	20	30		EGEDHN
COc1ccc(CN(C)[C@H](C)c2ccc(-n3cncn3)cc2)cc1C#N	ZINC000127136100	454940295	/nfs/dbraw/zinc/94/02/95/454940295.db2.gz	KFVQYKVIJCLPAQ-OAHLLOKOSA-N	0	3	347.422	3.341	20	30		EGEDHN
CCOc1ccc(O)c(/C=N/C2CCN(CCOC(C)C)CC2)c1	ZINC000178298537	454946440	/nfs/dbraw/zinc/94/64/40/454946440.db2.gz	AYGHHZHDHPDLLH-XSFVSMFZSA-N	0	3	334.460	3.099	20	30		EGEDHN
CN(C(=O)c1cccc(Nc2ccc(C#N)cc2)c1)[C@@H]1CCCN(C)C1	ZINC000151200369	454952090	/nfs/dbraw/zinc/95/20/90/454952090.db2.gz	SUXYFROVOKCXJX-HXUWFJFHSA-N	0	3	348.450	3.468	20	30		EGEDHN
N#Cc1ccc(NC(=O)NC[C@H]2CCCN2Cc2ccccc2)cc1	ZINC000114778798	454977715	/nfs/dbraw/zinc/97/77/15/454977715.db2.gz	CAZSBWDIKLMHJR-LJQANCHMSA-N	0	3	334.423	3.344	20	30		EGEDHN
CN(Cc1ccccc1)CC(C)(C)NC(=O)Cc1ccc(C#N)cc1	ZINC000178920567	454990304	/nfs/dbraw/zinc/99/03/04/454990304.db2.gz	XUPWYMZOTDHKBN-UHFFFAOYSA-N	0	3	335.451	3.128	20	30		EGEDHN
CCc1nn(C)c(CC)c1CNCc1ccc(N(C)CCC#N)cc1	ZINC000179009289	454998016	/nfs/dbraw/zinc/99/80/16/454998016.db2.gz	XRAPWOMCJPZECM-UHFFFAOYSA-N	0	3	339.487	3.185	20	30		EGEDHN
C[C@H](N[C@H]1CCCN(Cc2ccccc2)C1=O)c1cccc(C#N)c1	ZINC000179244718	455023996	/nfs/dbraw/zinc/02/39/96/455023996.db2.gz	RQXNOBLQOGXRLB-JXFKEZNVSA-N	0	3	333.435	3.400	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](c2ncccc2C)C(C)C)CC1	ZINC000115678889	455025305	/nfs/dbraw/zinc/02/53/05/455025305.db2.gz	TYTSAGSUTXAFJG-SFHVURJKSA-N	0	3	344.503	3.427	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H]2C[C@@H]2c2c(F)cccc2F)CC1	ZINC000116194020	455047419	/nfs/dbraw/zinc/04/74/19/455047419.db2.gz	YDWQZSRUZKLCMA-GJZGRUSLSA-N	0	3	334.410	3.225	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H]2CCCOc3c(Cl)cccc32)CC1	ZINC000179757954	455074993	/nfs/dbraw/zinc/07/49/93/455074993.db2.gz	ZSGBJUKCZBDWQX-KRWDZBQOSA-N	0	3	346.858	3.015	20	30		EGEDHN
N#CC(C(=O)c1ccccc1COC1CCOCC1)c1ccccn1	ZINC000128699341	455078159	/nfs/dbraw/zinc/07/81/59/455078159.db2.gz	NHCCJBLURRNUQT-GOSISDBHSA-N	0	3	336.391	3.267	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(F)c(C(F)(F)F)c2)CC1	ZINC000171717375	455088277	/nfs/dbraw/zinc/08/82/77/455088277.db2.gz	KDGMJFCZECHZJD-UHFFFAOYSA-N	0	3	330.325	3.225	20	30		EGEDHN
C=CCN1CCC(NC(=O)CCCOc2ccc(Cl)cc2)CC1	ZINC000171717780	455088665	/nfs/dbraw/zinc/08/86/65/455088665.db2.gz	CMFWVHBTLYFSCB-UHFFFAOYSA-N	0	3	336.863	3.266	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCC2(c3ccc(F)cc3)CCC2)CC1	ZINC000171730257	455089082	/nfs/dbraw/zinc/08/90/82/455089082.db2.gz	MORRFSHNPXKMGQ-UHFFFAOYSA-N	0	3	345.462	3.197	20	30		EGEDHN
C=CCN1CCC(NC(=O)Cc2csc(-c3cccs3)n2)CC1	ZINC000171723290	455089384	/nfs/dbraw/zinc/08/93/84/455089384.db2.gz	PJLWILWVUUDKLO-UHFFFAOYSA-N	0	3	347.509	3.181	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(OCCC(C)C)cc2)CC1	ZINC000171724829	455089636	/nfs/dbraw/zinc/08/96/36/455089636.db2.gz	VSBASIMNLGAZAK-UHFFFAOYSA-N	0	3	330.472	3.492	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)[C@H](C)c1c(C)noc1C)C(C)C	ZINC000156179258	455090177	/nfs/dbraw/zinc/09/01/77/455090177.db2.gz	BWZNQHQWAYVQPB-RHSMWYFYSA-N	0	3	333.476	3.210	20	30		EGEDHN
C=CCCCN1CCC(C(=O)c2ccc3c(c2)NC(=O)[C@H](C)O3)CC1	ZINC000117878133	455095309	/nfs/dbraw/zinc/09/53/09/455095309.db2.gz	VAANKDHPTDXIBD-AWEZNQCLSA-N	0	3	342.439	3.267	20	30		EGEDHN
CC(C)(CCC#N)CN1CCCN(C(=O)c2ccccc2F)CC1	ZINC000180003936	455115037	/nfs/dbraw/zinc/11/50/37/455115037.db2.gz	AXOJYVMAOONVRT-UHFFFAOYSA-N	0	3	331.435	3.304	20	30		EGEDHN
C=CC[C@H](C)NC(=O)NC[C@@H](c1ccc(OC)cc1)N1CCCC1	ZINC000172077951	455118409	/nfs/dbraw/zinc/11/84/09/455118409.db2.gz	NSRWQYBDQOPXSV-YJBOKZPZSA-N	0	3	331.460	3.096	20	30		EGEDHN
Cn1cc(CNCc2cccc(C#N)c2)c(-c2ccc(C#N)cc2)n1	ZINC000180048733	455122607	/nfs/dbraw/zinc/12/26/07/455122607.db2.gz	MIRRCUHQQDNXAS-UHFFFAOYSA-N	0	3	327.391	3.120	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2C[C@H](c3ccccc3)C[C@@H]2C)CC1	ZINC000172150897	455128316	/nfs/dbraw/zinc/12/83/16/455128316.db2.gz	YGLBZVWQVVFEMV-FUHWJXTLSA-N	0	3	327.472	3.224	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCc3c(Cl)cccc3C2)CC1	ZINC000172390279	455150657	/nfs/dbraw/zinc/15/06/57/455150657.db2.gz	VEKAYZDTCYFNGM-UHFFFAOYSA-N	0	3	333.863	3.058	20	30		EGEDHN
C=C(C)CN(C)C(=O)NC[C@@H](c1cccc(OC)c1)N(CC)CC	ZINC000180405400	455164638	/nfs/dbraw/zinc/16/46/38/455164638.db2.gz	GDIVTLLULMVRNL-SFHVURJKSA-N	0	3	333.476	3.296	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN[C@@H](C)c1cccc([N+](=O)[O-])c1	ZINC000180454657	455173021	/nfs/dbraw/zinc/17/30/21/455173021.db2.gz	VUVDJWSWRQUBBT-ZDUSSCGKSA-N	0	3	341.367	3.205	20	30		EGEDHN
COc1cccc2c1OC[C@H](NCc1ccc(O[C@@H](C)C#N)cc1)C2	ZINC000237360375	455176845	/nfs/dbraw/zinc/17/68/45/455176845.db2.gz	VAULZXJJZCUXGM-WMLDXEAASA-N	0	3	338.407	3.079	20	30		EGEDHN
N#CC(C(=O)NC1CCCCC1)c1nc2ccccc2n1C(F)F	ZINC000180513793	455187162	/nfs/dbraw/zinc/18/71/62/455187162.db2.gz	ODWOXJKTLLWEHM-GFCCVEGCSA-N	0	3	332.354	3.487	20	30		EGEDHN
C[C@@H](CC(=O)Nc1cccc(F)c1)NCc1ccc(OCC#N)cc1	ZINC000180552917	455195730	/nfs/dbraw/zinc/19/57/30/455195730.db2.gz	VSEIWFLDRHRZKU-AWEZNQCLSA-N	0	3	341.386	3.235	20	30		EGEDHN
C=CCOCCCC(=O)NC[C@@H]1CCCN(Cc2cccs2)C1	ZINC000172924019	455210856	/nfs/dbraw/zinc/21/08/56/455210856.db2.gz	RZCAIIJGTUKYKS-INIZCTEOSA-N	0	3	336.501	3.059	20	30		EGEDHN
CC[C@@H](NCCOc1cccc(C#N)c1)c1ccc2c(c1)OCCO2	ZINC000180646460	455217209	/nfs/dbraw/zinc/21/72/09/455217209.db2.gz	WVHZVQDLNTXAOA-GOSISDBHSA-N	0	3	338.407	3.449	20	30		EGEDHN
C[C@H](CNC(=O)Nc1cc(C#N)cn1C(C)(C)C)N1CCC[C@@H](C)C1	ZINC000245199378	455279457	/nfs/dbraw/zinc/27/94/57/455279457.db2.gz	VVTVVHJWEGERMD-HUUCEWRRSA-N	0	3	345.491	3.357	20	30		EGEDHN
C[C@@H]1C[C@H](N(C)C(=O)c2c[nH]c(C#N)c2)CCN1Cc1ccccc1	ZINC000181306377	455315609	/nfs/dbraw/zinc/31/56/09/455315609.db2.gz	GHKIYDQAHJLRRS-DNVCBOLYSA-N	0	3	336.439	3.011	20	30		EGEDHN
C[C@@](C#N)(NC(=O)CN[C@H](CC1CCC1)c1ccccc1)C1CC1	ZINC000181348553	455321796	/nfs/dbraw/zinc/32/17/96/455321796.db2.gz	BIKBEBHWFQHZES-QUCCMNQESA-N	0	3	325.456	3.316	20	30		EGEDHN
Cc1noc([C@H]2CCCN(Cc3ccc(O[C@H](C)C#N)cc3)C2)n1	ZINC000245537878	455324380	/nfs/dbraw/zinc/32/43/80/455324380.db2.gz	JHYUNCCUFRMUPR-CJNGLKHVSA-N	0	3	326.400	3.049	20	30		EGEDHN
C[C@@H](c1ccc(C#N)cc1)N1CCC(CC(=O)N2CCCC2)CC1	ZINC000265467429	455330700	/nfs/dbraw/zinc/33/07/00/455330700.db2.gz	ICIBXXVNFAXKLM-INIZCTEOSA-N	0	3	325.456	3.344	20	30		EGEDHN
C[C@@H](N[C@@H](CN1CCOCC1)c1ccccc1)c1cccc(C#N)c1	ZINC000181421360	455332277	/nfs/dbraw/zinc/33/22/77/455332277.db2.gz	OCVSPFXVWCZIOK-UTKZUKDTSA-N	0	3	335.451	3.282	20	30		EGEDHN
Cc1ccc([C@@H](CN[C@@H](C)c2cccc(C#N)c2)N2CCOCC2)o1	ZINC000181423968	455333487	/nfs/dbraw/zinc/33/34/87/455333487.db2.gz	RABIMJPLMSACHA-QFBILLFUSA-N	0	3	339.439	3.184	20	30		EGEDHN
Cc1sc(NC(=O)CN[C@@H](CCO)C2CCCCC2)c(C#N)c1C	ZINC000181496086	455344229	/nfs/dbraw/zinc/34/42/29/455344229.db2.gz	DFHXTDVHTLACMH-INIZCTEOSA-N	0	3	349.500	3.096	20	30		EGEDHN
C[C@@H]1CN(Cc2cccc(C#N)c2)CC[C@@H]1NC(=O)OC(C)(C)C	ZINC000265849981	455392573	/nfs/dbraw/zinc/39/25/73/455392573.db2.gz	PQVBXHGQDCQOJJ-PBHICJAKSA-N	0	3	329.444	3.293	20	30		EGEDHN
N#Cc1ccccc1N1CCCN(CCC(=O)c2ccccc2)CC1	ZINC000182036751	455421072	/nfs/dbraw/zinc/42/10/72/455421072.db2.gz	ROCRDKIYQSPFIF-UHFFFAOYSA-N	0	3	333.435	3.343	20	30		EGEDHN
COCCCOc1ccc(C(=O)C(C#N)c2nc(C)cs2)cc1	ZINC000175082293	455422011	/nfs/dbraw/zinc/42/20/11/455422011.db2.gz	SIKLCVCXBVDUOJ-HNNXBMFYSA-N	0	3	330.409	3.357	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC[C@H](c2cccnc2)C(C)C)CC1	ZINC000175417289	455446839	/nfs/dbraw/zinc/44/68/39/455446839.db2.gz	SGHAZZAACHVGDF-IBGZPJMESA-N	0	3	344.503	3.161	20	30		EGEDHN
C#CCC(C)(C)C(=O)Nc1ccc(N2CCN(CC)CC2)cc1C	ZINC000184991764	455482736	/nfs/dbraw/zinc/48/27/36/455482736.db2.gz	KXFMVIFIHDDMJB-UHFFFAOYSA-N	0	3	327.472	3.125	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(c3ccnc(Cl)c3)CC2)cc1	ZINC000267099489	455500675	/nfs/dbraw/zinc/50/06/75/455500675.db2.gz	YZMRJIOSOJCUSM-UHFFFAOYSA-N	0	3	326.831	3.319	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@H](C)N1CC[C@@H](c2ccccc2OC)C1	ZINC000606452644	460677413	/nfs/dbraw/zinc/67/74/13/460677413.db2.gz	FWTDHGUIRGYHJR-DLBZAZTESA-N	0	3	330.472	3.298	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN[C@H](c1ccc2c(c1)OCCO2)C(C)C	ZINC000161473836	455573908	/nfs/dbraw/zinc/57/39/08/455573908.db2.gz	GNMHXHFKQRZCSC-FQEVSTJZSA-N	0	3	346.471	3.169	20	30		EGEDHN
C[C@H](NCC(=O)N(CCC#N)c1ccccc1)[C@H]1COc2ccccc21	ZINC000185600986	455583422	/nfs/dbraw/zinc/58/34/22/455583422.db2.gz	SOJZITFZHARKGB-QFBILLFUSA-N	0	3	349.434	3.088	20	30		EGEDHN
COC(=O)COc1ccc([C@@H](C)NCC#Cc2ccc(F)cc2)cc1	ZINC000185644777	455588517	/nfs/dbraw/zinc/58/85/17/455588517.db2.gz	QVLIBLDTBODXJX-OAHLLOKOSA-N	0	3	341.382	3.080	20	30		EGEDHN
C[C@H](c1ccc(C(F)(F)F)cc1)N(C)CCC(=O)N(C)CCC#N	ZINC000271316378	455594766	/nfs/dbraw/zinc/59/47/66/455594766.db2.gz	AHCQHHPAJVKROB-CYBMUJFWSA-N	0	3	341.377	3.460	20	30		EGEDHN
Cc1ccc2c(c1)[C@H]1CN(C)CC[C@@H]1N2C(=O)Cc1ccc(C#N)cc1	ZINC000292263310	455612417	/nfs/dbraw/zinc/61/24/17/455612417.db2.gz	KVPGCHFHMLLZOI-CTNGQTDRSA-N	0	3	345.446	3.244	20	30		EGEDHN
N#CCOc1ccc(CN2CCC[C@H]2C[C@@H](O)c2ccco2)cc1	ZINC000268310508	455647237	/nfs/dbraw/zinc/64/72/37/455647237.db2.gz	XLTZMCQWYKLCMU-FUHWJXTLSA-N	0	3	326.396	3.270	20	30		EGEDHN
CN(CCC#N)C(=O)CCNC(C)(C)c1cccc(C(F)(F)F)c1	ZINC000271542742	455678201	/nfs/dbraw/zinc/67/82/01/455678201.db2.gz	LWUGVTOWVRFUMM-UHFFFAOYSA-N	0	3	341.377	3.292	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cccc(CC#N)c1	ZINC000248803791	455731867	/nfs/dbraw/zinc/73/18/67/455731867.db2.gz	JXUJLFDZNSBIJH-OXQOHEQNSA-N	0	3	333.435	3.003	20	30		EGEDHN
C[C@@H](N[C@H](C)c1ccc(OCC#N)cc1)c1ccc(NC(N)=O)cc1	ZINC000193024445	455736005	/nfs/dbraw/zinc/73/60/05/455736005.db2.gz	NKYMJUYSPAKRND-ZIAGYGMSSA-N	0	3	338.411	3.491	20	30		EGEDHN
N#C[C@@H]1CCC[C@H](N[C@@H]2CCCN(Cc3ccc(F)cc3F)C2=O)C1	ZINC000248881143	455736674	/nfs/dbraw/zinc/73/66/74/455736674.db2.gz	KPYVOGGMXRAVQD-RPVQJOFSSA-N	0	3	347.409	3.128	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCCN1CCN(C)C[C@H]1c1ccccc1	ZINC000248931366	455739566	/nfs/dbraw/zinc/73/95/66/455739566.db2.gz	MMIREEGXEKJXKI-FPOVZHCZSA-N	0	3	343.515	3.084	20	30		EGEDHN
COC(=O)COc1ccc(CN(C)Cc2ccc(C#N)cc2C)cc1	ZINC000186336801	455745906	/nfs/dbraw/zinc/74/59/06/455745906.db2.gz	WWLGRMAUPCNHMC-UHFFFAOYSA-N	0	3	338.407	3.051	20	30		EGEDHN
C[C@H](C(=O)N(CCC#N)c1ccc(F)cc1)N1C[C@H](C)C[C@@H](C)C1	ZINC000249327259	455749300	/nfs/dbraw/zinc/74/93/00/455749300.db2.gz	OBPDZLYQEOFRFK-BZUAXINKSA-N	0	3	331.435	3.439	20	30		EGEDHN
COC(=O)N1CCC([C@@H](C)NCc2ccc(Cl)cc2C#N)CC1	ZINC000186376889	455755339	/nfs/dbraw/zinc/75/53/39/455755339.db2.gz	PLMJNBXYJPEBHZ-GFCCVEGCSA-N	0	3	335.835	3.168	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN1CCC[C@H]1CCc1ccccc1	ZINC000249687513	455766806	/nfs/dbraw/zinc/76/68/06/455766806.db2.gz	RVPYCMYHOXCINR-HKUYNNGSSA-N	0	3	327.472	3.092	20	30		EGEDHN
CC(C)c1[nH]ccc1C(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000285097730	455789360	/nfs/dbraw/zinc/78/93/60/455789360.db2.gz	KXQIMBZGIKGINA-UHFFFAOYSA-N	0	3	338.455	3.214	20	30		EGEDHN
CC[C@@H](NC[C@H](O)c1cc(OC)ccc1OC)c1ccc(C#N)cc1	ZINC000278220573	455789827	/nfs/dbraw/zinc/78/98/27/455789827.db2.gz	IZJBTNGQDRNFIH-MOPGFXCFSA-N	0	3	340.423	3.350	20	30		EGEDHN
CC[C@](C)(C#N)C(=O)N[C@H]1CC2(CCN(C)CC2)Oc2ccccc21	ZINC000285109914	455791287	/nfs/dbraw/zinc/79/12/87/455791287.db2.gz	JTAZCQWYWYNXGA-QFBILLFUSA-N	0	3	341.455	3.031	20	30		EGEDHN
COCCN(CCN[C@H](C)c1cccc(C#N)c1)C(=O)OC(C)(C)C	ZINC000271905086	455799429	/nfs/dbraw/zinc/79/94/29/455799429.db2.gz	WKTKGEMNCPVQBV-OAHLLOKOSA-N	0	3	347.459	3.092	20	30		EGEDHN
C[C@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccc(C#N)c(F)c1	ZINC000271966324	455807333	/nfs/dbraw/zinc/80/73/33/455807333.db2.gz	SPMSAKWGFYSNBI-SWLSCSKDSA-N	0	3	333.407	3.357	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCCCN1CCN(c2cccc(C)c2)CC1	ZINC000294469493	455816962	/nfs/dbraw/zinc/81/69/62/455816962.db2.gz	LZZKHXVKXGYVTQ-UHFFFAOYSA-N	0	3	343.515	3.226	20	30		EGEDHN
COc1c(C)cnc(CN(C)CCCC2(C#N)CCOCC2)c1C	ZINC000295125841	455840280	/nfs/dbraw/zinc/84/02/80/455840280.db2.gz	JGCVLMDNFDLAOZ-UHFFFAOYSA-N	0	3	331.460	3.239	20	30		EGEDHN
Cc1cccc(OC[C@@H](O)CN(Cc2ccc(C#N)cc2)C2CC2)c1	ZINC000194539964	455855873	/nfs/dbraw/zinc/85/58/73/455855873.db2.gz	NFBFQHYKWRVTMS-FQEVSTJZSA-N	0	3	336.435	3.271	20	30		EGEDHN
C[C@@H](N[C@@H](c1ccccc1)C1CC1)C(=O)NC1(C#N)CCCCC1	ZINC000194553042	455857923	/nfs/dbraw/zinc/85/79/23/455857923.db2.gz	MDLVGIGKOSHFIT-QAPCUYQASA-N	0	3	325.456	3.458	20	30		EGEDHN
C[C@@H]1CCSCCN1Cc1cn(CCC#N)nc1-c1ccncc1	ZINC000279479622	455865835	/nfs/dbraw/zinc/86/58/35/455865835.db2.gz	WPRGCWSKKABZDQ-OAHLLOKOSA-N	0	3	341.484	3.186	20	30		EGEDHN
Cc1cccc(C)c1CCNC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000279912786	455876849	/nfs/dbraw/zinc/87/68/49/455876849.db2.gz	FABVFQWCUQSQME-IBGZPJMESA-N	0	3	331.419	3.216	20	30		EGEDHN
CCOC[C@H](N[C@@H](C)C(=O)N(CCC#N)c1ccc(C)cc1)C(C)C	ZINC000285703623	455900332	/nfs/dbraw/zinc/90/03/32/455900332.db2.gz	CVQDZCPOEACMHE-HKUYNNGSSA-N	0	3	345.487	3.281	20	30		EGEDHN
CCc1nc([C@H](C)NC(=O)C(C#N)Cc2ccc(C#N)cc2)cs1	ZINC000280219575	455919764	/nfs/dbraw/zinc/91/97/64/455919764.db2.gz	AMFOUDZXLHVOCG-SWLSCSKDSA-N	0	3	338.436	3.137	20	30		EGEDHN
CO/N=C/c1ccc(C(=O)Nc2cc(C)cc(CN(C)C)c2)cc1	ZINC000270380080	455943727	/nfs/dbraw/zinc/94/37/27/455943727.db2.gz	NJFXYXSSKYAPDS-UDWIEESQSA-N	0	3	325.412	3.289	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N1CCC(CCCN2CCOCC2)CC1	ZINC000187719968	455944873	/nfs/dbraw/zinc/94/48/73/455944873.db2.gz	ZLIYIIYNKKOLRM-GOSISDBHSA-N	0	3	341.499	3.444	20	30		EGEDHN
C[C@@H](O)C[C@H]1CCCCCN1Cc1nnc(-c2ccc(C#N)cc2)o1	ZINC000286059594	455969892	/nfs/dbraw/zinc/96/98/92/455969892.db2.gz	RLJPXOAKPNCCHG-RHSMWYFYSA-N	0	3	340.427	3.124	20	30		EGEDHN
Cc1ccc(NC(=O)N2CCC(C)(C#N)CC2)c(OCCN(C)C)c1	ZINC000272571811	455997964	/nfs/dbraw/zinc/99/79/64/455997964.db2.gz	SALNCMDMYDKNOL-UHFFFAOYSA-N	0	3	344.459	3.093	20	30		EGEDHN
COc1cc2c(cc1CNC(=N)Nc1cc(F)ccc1F)O[C@@H](C)C2	ZINC000262239365	456015270	/nfs/dbraw/zinc/01/52/70/456015270.db2.gz	BDVKGTFYLVXHDJ-JTQLQIEISA-N	0	3	347.365	3.224	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1CNCc1cc2c(cc1OC(F)F)OCO2	ZINC000280678522	456029125	/nfs/dbraw/zinc/02/91/25/456029125.db2.gz	QLBVZPXQDBJQRY-ZBEGNZNMSA-N	0	3	341.354	3.088	20	30		EGEDHN
C[C@@H](C#N)Oc1ccccc1NC(=O)N1CC[C@H](N2CCCCC2)C1	ZINC000272703308	456045696	/nfs/dbraw/zinc/04/56/96/456045696.db2.gz	VDPAVYOPTPSENF-HOTGVXAUSA-N	0	3	342.443	3.070	20	30		EGEDHN
C=CC[C@H](C)NC(=O)N1CC[C@@]2(CCN(Cc3ccccc3)C2)C1	ZINC000286874567	456056005	/nfs/dbraw/zinc/05/60/05/456056005.db2.gz	YXZSOCORTOEKAW-FXAWDEMLSA-N	0	3	327.472	3.259	20	30		EGEDHN
CN(CC(=O)N(CCC#N)c1ccccc1)C1CCC(F)(F)CC1	ZINC000287056341	456060424	/nfs/dbraw/zinc/06/04/24/456060424.db2.gz	URDVKUJGVKRZFU-UHFFFAOYSA-N	0	3	335.398	3.443	20	30		EGEDHN
N#CCOc1ccc(CN[C@@H](CCO)c2ccc(Cl)cc2)cc1	ZINC000287101136	456061317	/nfs/dbraw/zinc/06/13/17/456061317.db2.gz	XTFDAZJPEWROCA-SFHVURJKSA-N	0	3	330.815	3.456	20	30		EGEDHN
C#CCN1CCC(C(=O)NC[C@@H](C)Oc2ccc(C(C)C)cc2)CC1	ZINC000287108441	456061356	/nfs/dbraw/zinc/06/13/56/456061356.db2.gz	PSLCWJAWIUZINB-QGZVFWFLSA-N	0	3	342.483	3.039	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)c1nc(Cl)c(C#N)s1	ZINC000287824049	456079302	/nfs/dbraw/zinc/07/93/02/456079302.db2.gz	LABKGRCYIKNNAO-UHFFFAOYSA-N	0	3	345.859	3.108	20	30		EGEDHN
C=C(CNC(=O)N(CCN(C)C)Cc1ccco1)c1ccccc1	ZINC000287977087	456083334	/nfs/dbraw/zinc/08/33/34/456083334.db2.gz	JMDWCYICLIXIMW-UHFFFAOYSA-N	0	3	327.428	3.066	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000188567482	456085484	/nfs/dbraw/zinc/08/54/84/456085484.db2.gz	WUDLNAIFISZXNS-NRFANRHFSA-N	0	3	344.499	3.422	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)CC2(c3ccccc3)CC2)CC1	ZINC000188570658	456087045	/nfs/dbraw/zinc/08/70/45/456087045.db2.gz	QHIXQLGMUMWABH-UHFFFAOYSA-N	0	3	327.472	3.010	20	30		EGEDHN
C[C@H](C(=O)NC1(C#N)CCCCC1)N(C)C[C@@H](C)c1ccccc1	ZINC000332625375	456100528	/nfs/dbraw/zinc/10/05/28/456100528.db2.gz	USGFCVCMJBTRGO-IAGOWNOFSA-N	0	3	327.472	3.453	20	30		EGEDHN
CCCCCN(CCO)Cc1cn(CCC#N)nc1-c1ccccc1	ZINC000271040939	456107650	/nfs/dbraw/zinc/10/76/50/456107650.db2.gz	MQMFWEUHXYUVEO-UHFFFAOYSA-N	0	3	340.471	3.448	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1c1nc(-c2cccc(OCCN(C)C)c2)no1	ZINC000289103793	456115019	/nfs/dbraw/zinc/11/50/19/456115019.db2.gz	JELMIGXZZAGCAE-IAGOWNOFSA-N	0	3	343.427	3.126	20	30		EGEDHN
C#Cc1ccc(CNCc2cccc(NC(=O)[C@H]3CCCO3)c2)cc1	ZINC000289295318	456120540	/nfs/dbraw/zinc/12/05/40/456120540.db2.gz	QDINKOLLAQOXHS-HXUWFJFHSA-N	0	3	334.419	3.075	20	30		EGEDHN
CN(C)[C@H](CNC(=O)/C=C\c1ccc(OCC#N)cc1)c1ccccc1	ZINC000229941476	456130749	/nfs/dbraw/zinc/13/07/49/456130749.db2.gz	VHYHVSJNHJQKHG-KTZABMDBSA-N	0	3	349.434	3.021	20	30		EGEDHN
CC(C)(CO)[C@@H](NCc1ccc(OCC#N)cc1)c1cccs1	ZINC000289727695	456139166	/nfs/dbraw/zinc/13/91/66/456139166.db2.gz	JYSLNBNYCCOSON-KRWDZBQOSA-N	0	3	330.453	3.500	20	30		EGEDHN
C[C@@H](N[C@@H]1[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]21)c1cccc(C#N)c1	ZINC000297214064	456151573	/nfs/dbraw/zinc/15/15/73/456151573.db2.gz	GVEFXCLIPGADGE-VZEFYGNVSA-N	0	3	327.428	3.074	20	30		EGEDHN
COC(=O)CCN(Cc1ccc(OC)c(OCCCC#N)c1)C(C)C	ZINC000271197121	456166059	/nfs/dbraw/zinc/16/60/59/456166059.db2.gz	RXXXFPKJGIODAN-UHFFFAOYSA-N	0	3	348.443	3.151	20	30		EGEDHN
C=CCOc1ccc(CN[C@H](CO)Cc2ccccc2C)cc1OC	ZINC000188941424	456177560	/nfs/dbraw/zinc/17/75/60/456177560.db2.gz	PNSISFFEFFQXJC-IBGZPJMESA-N	0	3	341.451	3.262	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H](CO)Cc2ccc(C)cc2)cc1OC	ZINC000188990163	456191108	/nfs/dbraw/zinc/19/11/08/456191108.db2.gz	NIWCIQRQAOWJDE-LJQANCHMSA-N	0	3	341.451	3.262	20	30		EGEDHN
N#CCN(C(=O)[C@@H]1CCCN(Cc2ccccc2)C1)c1ccccc1	ZINC000263720635	456202538	/nfs/dbraw/zinc/20/25/38/456202538.db2.gz	CMHUVNYYXQXPMA-LJQANCHMSA-N	0	3	333.435	3.455	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1CNC(=O)c1oc2ccccc2c1CN(C)C	ZINC000281435565	456234069	/nfs/dbraw/zinc/23/40/69/456234069.db2.gz	NXAJAZWDZYMQON-KDOFPFPSSA-N	0	3	342.439	3.205	20	30		EGEDHN
C=C(C)[C@H](CC(=O)Nc1cccc(N2CCN(CC)CC2)c1)OCC	ZINC000274507761	456259594	/nfs/dbraw/zinc/25/95/94/456259594.db2.gz	WRCKGPGGFAZGBR-IBGZPJMESA-N	0	3	345.487	3.138	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000290286776	456280219	/nfs/dbraw/zinc/28/02/19/456280219.db2.gz	DQYHOBWWTKIZQR-XMSQKQJNSA-N	0	3	346.474	3.380	20	30		EGEDHN
COc1cc(CNc2ccc(OCCN(C)C)cc2)ccc1C#N	ZINC000281657702	456284918	/nfs/dbraw/zinc/28/49/18/456284918.db2.gz	KNJVGVUJLGZRHT-UHFFFAOYSA-N	0	3	325.412	3.119	20	30		EGEDHN
C[C@H](CNc1nc2ccccn2c1C#N)N1CCc2ccccc2C1	ZINC000302110235	456289505	/nfs/dbraw/zinc/28/95/05/456289505.db2.gz	UAIOKTGJJMDJLF-OAHLLOKOSA-N	0	3	331.423	3.065	20	30		EGEDHN
C#CCC(C)(C)C(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000290386536	456312839	/nfs/dbraw/zinc/31/28/39/456312839.db2.gz	HUGRLZKFAZEZDT-SFHVURJKSA-N	0	3	330.472	3.242	20	30		EGEDHN
COc1cc(CNC[C@@H](c2cccc(F)c2)N(C)C)ccc1C#N	ZINC000281850311	456341156	/nfs/dbraw/zinc/34/11/56/456341156.db2.gz	ZDRIHDPDOCIAQD-SFHVURJKSA-N	0	3	327.403	3.098	20	30		EGEDHN
COc1ccc(CN(C)CCCn2ccnc2)cc1OCCCC#N	ZINC000290525706	456353219	/nfs/dbraw/zinc/35/32/19/456353219.db2.gz	QIDQOEUIJGUHFZ-UHFFFAOYSA-N	0	3	342.443	3.096	20	30		EGEDHN
N#Cc1cccc(COc2cccc(CN[C@H]3C=C[C@@H](CO)C3)c2)c1	ZINC000347781216	456364751	/nfs/dbraw/zinc/36/47/51/456364751.db2.gz	UHZOIVPUBOBOSK-QUCCMNQESA-N	0	3	334.419	3.164	20	30		EGEDHN
CC1(C)CN(Cc2cn(CCC#N)nc2-c2ccccc2)CC[C@H]1O	ZINC000276027705	456373977	/nfs/dbraw/zinc/37/39/77/456373977.db2.gz	RHAOKPBQNXOTBY-GOSISDBHSA-N	0	3	338.455	3.057	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@@H](C)N2CCCC[C@H]2C)cc1OC	ZINC000343065852	456381246	/nfs/dbraw/zinc/38/12/46/456381246.db2.gz	AXVGANKSELAAAK-HZPDHXFCSA-N	0	3	346.471	3.253	20	30		EGEDHN
N#Cc1ccc(NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)cc1	ZINC000337574433	456391620	/nfs/dbraw/zinc/39/16/20/456391620.db2.gz	UTCCJHZNWMXIOC-IBGZPJMESA-N	0	3	334.423	3.344	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CCN1CCCC1(C#N)CCOCC1	ZINC000282088723	456409045	/nfs/dbraw/zinc/40/90/45/456409045.db2.gz	VDLVMCVUAGJLDD-IBGZPJMESA-N	0	3	341.499	3.293	20	30		EGEDHN
N#CC1(CCCN(Cc2ccco2)C[C@H]2CCCO2)CCOCC1	ZINC000282084235	456409933	/nfs/dbraw/zinc/40/99/33/456409933.db2.gz	USLHTYMMNATOQS-GOSISDBHSA-N	0	3	332.444	3.361	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@@H](NCc1cccc(N3CCOCC3)c1)CC2	ZINC000340435418	456458637	/nfs/dbraw/zinc/45/86/37/456458637.db2.gz	RMMFGSQKGNFZKL-NRFANRHFSA-N	0	3	333.435	3.172	20	30		EGEDHN
Cc1ccccc1[C@H]1CCN([C@@H]2CCN(c3ccc(C#N)cc3)C2=O)C1	ZINC000337696849	456488136	/nfs/dbraw/zinc/48/81/36/456488136.db2.gz	TVEKJRDYCHXVTF-GHTZIAJQSA-N	0	3	345.446	3.462	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000353121874	456503679	/nfs/dbraw/zinc/50/36/79/456503679.db2.gz	DWVUOZRSMCXUDQ-UHFFFAOYSA-N	0	3	339.464	3.356	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H]2CCC(=O)N[C@@H]2C(C)(C)C)cc1OC	ZINC000353137604	456514557	/nfs/dbraw/zinc/51/45/57/456514557.db2.gz	MDEYPWHHPADXIN-BEFAXECRSA-N	0	3	346.471	3.043	20	30		EGEDHN
CCN1CCO[C@H](CNCc2cccc(C#N)c2)[C@@H]1c1ccccc1	ZINC000343391596	456585379	/nfs/dbraw/zinc/58/53/79/456585379.db2.gz	RAUJCNWXBHVCLB-RTWAWAEBSA-N	0	3	335.451	3.110	20	30		EGEDHN
CCN1CCO[C@@H](CNCc2ccc(C#N)s2)[C@H]1c1ccccc1	ZINC000343393546	456587798	/nfs/dbraw/zinc/58/77/98/456587798.db2.gz	QKZHPJNWCDEWSH-RBUKOAKNSA-N	0	3	341.480	3.171	20	30		EGEDHN
CCc1ccc([C@@H]2CCCN([C@H](C)C(=O)N(C)CCC#N)C2)cc1	ZINC000353257138	456592371	/nfs/dbraw/zinc/59/23/71/456592371.db2.gz	IEPLRSXUKSWBOF-VQIMIIECSA-N	0	3	327.472	3.189	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N(C)[C@H](C)c1ccncc1)C(C)C	ZINC000299345976	456663186	/nfs/dbraw/zinc/66/31/86/456663186.db2.gz	GTNHOVXZFVZCNQ-MJGOQNOKSA-N	0	3	344.503	3.483	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2nc(-c3ccccc3)cs2)CC1	ZINC000283075372	456704721	/nfs/dbraw/zinc/70/47/21/456704721.db2.gz	DIHHDTQEANDPQP-UHFFFAOYSA-N	0	3	327.453	3.190	20	30		EGEDHN
Cn1cc([C@H](NCCc2cccc(C#N)c2)c2cccc(F)c2)cn1	ZINC000343583251	456723296	/nfs/dbraw/zinc/72/32/96/456723296.db2.gz	AWGJLYLMDVTUCV-HXUWFJFHSA-N	0	3	334.398	3.353	20	30		EGEDHN
Cc1ccn2cc(CNC3CCN(c4ccc(C#N)cc4)CC3)nc2c1	ZINC000353513155	456726870	/nfs/dbraw/zinc/72/68/70/456726870.db2.gz	FDLCYGDONFXNRG-UHFFFAOYSA-N	0	3	345.450	3.273	20	30		EGEDHN
N#Cc1ccc(NC(=O)CN[C@@H]2CCC[C@@H]2OCc2ccccc2)cc1	ZINC000348523260	456735509	/nfs/dbraw/zinc/73/55/09/456735509.db2.gz	CNRVCMXFIADBJT-UXHICEINSA-N	0	3	349.434	3.224	20	30		EGEDHN
COc1cc(CN[C@@H](C)[C@H]2OCCc3sccc32)ccc1C#N	ZINC000291751044	456743961	/nfs/dbraw/zinc/74/39/61/456743961.db2.gz	QGPOTJJIFCITAX-KPZWWZAWSA-N	0	3	328.437	3.420	20	30		EGEDHN
Cc1cc(C(=O)CCC(=O)N(CCC#N)CCCN(C)C)c(C)s1	ZINC000299682253	456763351	/nfs/dbraw/zinc/76/33/51/456763351.db2.gz	VVLZZWCXRGFRGF-UHFFFAOYSA-N	0	3	349.500	3.022	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2sc([C@@H]3CCCOC3)nc2C)CC1	ZINC000328794646	456763259	/nfs/dbraw/zinc/76/32/59/456763259.db2.gz	BOXBPNPIQPVMJT-CQSZACIVSA-N	0	3	349.500	3.301	20	30		EGEDHN
CCc1nn(C)c(CC)c1CNC(=O)[C@@H]1CCCN1C1CCCC1	ZINC000328799796	456764262	/nfs/dbraw/zinc/76/42/62/456764262.db2.gz	XWSFQNQDJKGMHF-SFHVURJKSA-N	0	3	332.492	3.408	20	30		EGEDHN
N#Cc1cc(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)ccc1F	ZINC000340927904	456766640	/nfs/dbraw/zinc/76/66/40/456766640.db2.gz	QKUPREQXNUHXSQ-IBGZPJMESA-N	0	3	337.398	3.264	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/CC2(COC)CCOCC2)c([O-])c1	ZINC000291826616	456770143	/nfs/dbraw/zinc/77/01/43/456770143.db2.gz	FLYRGSXTSCMDQI-DEDYPNTBSA-N	0	3	334.460	3.101	20	30		EGEDHN
Cc1ccc(C)c(NC(=O)[C@H](C)N2CCC[C@@H]2[C@@H]2COCC[C@H]2O)c1	ZINC000328858324	456777738	/nfs/dbraw/zinc/77/77/38/456777738.db2.gz	YHVVRCGWDKKBJN-RNIPGJKVSA-N	0	3	346.471	3.142	20	30		EGEDHN
CN(C)[C@@H](CNC(=O)c1cc(C#N)ccc1Cl)Cc1ccccc1	ZINC000348631255	456787258	/nfs/dbraw/zinc/78/72/58/456787258.db2.gz	YUNFXVCJHFSCBF-MRXNPFEDSA-N	0	3	341.842	3.114	20	30		EGEDHN
O=C(CN[C@H]1CCC(=O)N[C@@H]1C1CC1)NC12CC3CC(CC(C3)C1)C2	ZINC000328903261	456788163	/nfs/dbraw/zinc/78/81/63/456788163.db2.gz	HQFOCVHTTSHNGH-GZGDGKOTSA-N	0	3	345.487	3.399	20	30		EGEDHN
C[C@H](C(=O)N(CCC#N)c1ccc(F)cc1)N1CC[C@H](C2CC2)C1	ZINC000344038223	456790458	/nfs/dbraw/zinc/79/04/58/456790458.db2.gz	QXLMCESACQJLRH-ZBFHGGJFSA-N	0	3	329.419	3.193	20	30		EGEDHN
CC[C@H](C)n1ncc(NC(=O)N2CC[C@H]3CC[C@@H](C2)N3C)c1C1CC1	ZINC000328924636	456792337	/nfs/dbraw/zinc/79/23/37/456792337.db2.gz	VNXRAZKXAFMGOU-IMJJTQAJSA-N	0	3	345.491	3.446	20	30		EGEDHN
O=C(CN[C@H]1CCC(=O)N[C@@H]1C1CC1)Nc1nc2c(s1)CCCC2	ZINC000328930630	456793398	/nfs/dbraw/zinc/79/33/98/456793398.db2.gz	ZDDRZRKGDASOKJ-BLLLJJGKSA-N	0	3	348.472	3.097	20	30		EGEDHN
CO[C@H](CO/N=C/c1ccc(N2CCOCC2)cc1)c1ccccc1	ZINC000283526573	456797004	/nfs/dbraw/zinc/79/70/04/456797004.db2.gz	WWWIJUFDLGOEOR-LNKKFFRNSA-N	0	3	340.423	3.261	20	30		EGEDHN
CCn1ccnc1[C@@H]1OCC[C@H]1C(=O)N[C@H](C)CN1CCC[C@@H](C)C1	ZINC000328939077	456797177	/nfs/dbraw/zinc/79/71/77/456797177.db2.gz	KHBLWFUKOISVEQ-QBPKDAKJSA-N	0	3	348.491	3.058	20	30		EGEDHN
CC#CCCCC(=O)N(Cc1ccc(O)cc1)C[C@H]1CCCN1CC	ZINC000344128166	456798725	/nfs/dbraw/zinc/79/87/25/456798725.db2.gz	JJSUXTXRFIDLHH-LJQANCHMSA-N	0	3	342.483	3.399	20	30		EGEDHN
C[C@@H](NC(=O)C(C#N)CCc1ccccc1)c1c(F)cncc1F	ZINC000344148090	456801583	/nfs/dbraw/zinc/80/15/83/456801583.db2.gz	FEYZGDTZYMBIET-TZMCWYRMSA-N	0	3	329.350	3.310	20	30		EGEDHN
Cc1c(NC(=O)N2CCN(C3CCCCC3)CC2)cnn1CC(C)C	ZINC000329139670	456841476	/nfs/dbraw/zinc/84/14/76/456841476.db2.gz	SODVDLAHLONTBF-UHFFFAOYSA-N	0	3	347.507	3.343	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)NCC#Cc2ccccc2)CN1Cc1ccccc1	ZINC000341318474	456844812	/nfs/dbraw/zinc/84/48/12/456844812.db2.gz	FWZRXDJLQALJMA-NQIIRXRSSA-N	0	3	347.462	3.000	20	30		EGEDHN
C=CC[C@@H](CO)CNCc1cc2ccccc2nc1N1CCCCC1	ZINC000341319926	456846021	/nfs/dbraw/zinc/84/60/21/456846021.db2.gz	ZKWIPCLGVRJDKB-QGZVFWFLSA-N	0	3	339.483	3.499	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2ccnc(-c3ccccc3)c2N)CN1C1CC1	ZINC000329221082	456856079	/nfs/dbraw/zinc/85/60/79/456856079.db2.gz	UHWVVMFQVKRSRE-UKRRQHHQSA-N	0	3	336.439	3.261	20	30		EGEDHN
CN(CCNC(=O)c1cccc(Nc2ccc(C#N)cc2)c1)C1CC1	ZINC000348805624	456863505	/nfs/dbraw/zinc/86/35/05/456863505.db2.gz	GBXYXFSEKYFDGQ-UHFFFAOYSA-N	0	3	334.423	3.126	20	30		EGEDHN
CN(C[C@H]1CCCN(C)C1)C(=O)Nc1csc(-c2ccccn2)n1	ZINC000329297878	456868417	/nfs/dbraw/zinc/86/84/17/456868417.db2.gz	UJBUMNYSFOWBQY-ZDUSSCGKSA-N	0	3	345.472	3.024	20	30		EGEDHN
CC(=O)N[C@H](CC(=O)N1CC[C@H](N2CCCCC2)C1)c1cccs1	ZINC000329331237	456873856	/nfs/dbraw/zinc/87/38/56/456873856.db2.gz	VZYKBGHZNMQWJU-JKSUJKDBSA-N	0	3	349.500	3.243	20	30		EGEDHN
COc1ccc(C2(NCCC(=O)Nc3ccc(C#N)cc3)CC2)cc1	ZINC000341653201	456884804	/nfs/dbraw/zinc/88/48/04/456884804.db2.gz	DPRKTJJZPGOQEK-UHFFFAOYSA-N	0	3	335.407	3.174	20	30		EGEDHN
O=C(CN1CCC[C@@H]1C1CCOCC1)NC(=O)NC1CCCCC1	ZINC000329410097	456886843	/nfs/dbraw/zinc/88/68/43/456886843.db2.gz	BKXOYVMZCSAGHH-MRXNPFEDSA-N	0	3	337.464	3.081	20	30		EGEDHN
C[C@H]1Oc2ccccc2OC1C(=O)Nc1cc(C#N)c2ccccc2n1	ZINC000345015081	456898082	/nfs/dbraw/zinc/89/80/82/456898082.db2.gz	HAZLREJMLRHSNT-CWTRNNRKSA-N	0	3	345.358	3.273	20	30		EGEDHN
C[C@H](NC(=O)N[C@H]1CCCOc2ccc(F)cc21)C1=CCN(C)CC1	ZINC000329515632	456903259	/nfs/dbraw/zinc/90/32/59/456903259.db2.gz	OPEUYWBWQLHYPY-GUYCJALGSA-N	0	3	347.434	3.193	20	30		EGEDHN
Cc1cc(NCCCCN2CCN(c3ccccc3)CC2)cc(C#N)n1	ZINC000341722050	456914883	/nfs/dbraw/zinc/91/48/83/456914883.db2.gz	NGUIDDLUKCCEJH-UHFFFAOYSA-N	0	3	349.482	3.276	20	30		EGEDHN
[O-]C(N[C@@H]1CCSc2c(F)cccc21)=[NH+][C@@H]1CCc2nc[nH]c2C1	ZINC000329611857	456915321	/nfs/dbraw/zinc/91/53/21/456915321.db2.gz	OFRJMBGENHNBBY-ZWNOBZJWSA-N	0	3	346.431	3.147	20	30		EGEDHN
[O-]C(N[C@@H]1CCSc2c(F)cccc21)=[NH+][C@@H]1CCc2[nH]cnc2C1	ZINC000329611857	456915323	/nfs/dbraw/zinc/91/53/23/456915323.db2.gz	OFRJMBGENHNBBY-ZWNOBZJWSA-N	0	3	346.431	3.147	20	30		EGEDHN
CC(C#N)C(=O)N(CCCn1ccnc1)Cc1c(F)cccc1Cl	ZINC000345156508	456946170	/nfs/dbraw/zinc/94/61/70/456946170.db2.gz	DWLFNSMFIQAJQN-ZDUSSCGKSA-N	0	3	348.809	3.254	20	30		EGEDHN
Cc1ccc(CNC(=O)CN2[C@H](C)CC[C@@H]2C)c(O[C@@H]2CCOC2)c1	ZINC000329862108	456952427	/nfs/dbraw/zinc/95/24/27/456952427.db2.gz	QUEQTVOPXBPXSW-SOLBZPMBSA-N	0	3	346.471	3.492	20	30		EGEDHN
CC1(C)CCCN(CCNC(=O)CCc2ccc3c(c2)OCCO3)C1	ZINC000329893520	456957191	/nfs/dbraw/zinc/95/71/91/456957191.db2.gz	AVWRKLHFXFTLFY-UHFFFAOYSA-N	0	3	346.471	3.469	20	30		EGEDHN
CO[C@@H]1CC[C@H](NC(=O)NC[C@]2(C)CCCN2Cc2ccccc2)C1	ZINC000329911041	456959734	/nfs/dbraw/zinc/95/97/34/456959734.db2.gz	NPARIXBKZCLJRC-NSHGMRRFSA-N	0	3	345.487	3.112	20	30		EGEDHN
CC[C@@H]1CCCCN1CCNC(=O)c1coc(C2CCOCC2)n1	ZINC000329924741	456961669	/nfs/dbraw/zinc/96/16/69/456961669.db2.gz	HTVCMQNNQJUVKZ-OAHLLOKOSA-N	0	3	335.448	3.138	20	30		EGEDHN
C[C@H](NCc1cccc(F)c1C#N)C1CCN(CC(F)(F)F)CC1	ZINC000339162243	456971827	/nfs/dbraw/zinc/97/18/27/456971827.db2.gz	WLRNDFVMWZOZOH-LBPRGKRZSA-N	0	3	343.368	3.450	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(-c3ccccc3)ns2)CC1	ZINC000345282391	456972768	/nfs/dbraw/zinc/97/27/68/456972768.db2.gz	NYHCRINIXOPFTN-UHFFFAOYSA-N	0	3	327.453	3.190	20	30		EGEDHN
O=C(Nc1ccnc(OCC(F)(F)F)c1)C1CCN(C2CC2)CC1	ZINC000330138392	456989964	/nfs/dbraw/zinc/98/99/64/456989964.db2.gz	OJKHMOZRCBVUJV-UHFFFAOYSA-N	0	3	343.349	3.485	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1)OCC	ZINC000339203946	456991169	/nfs/dbraw/zinc/99/11/69/456991169.db2.gz	NODXLAXMZCZNRR-NEWSRXKRSA-N	0	3	330.472	3.309	20	30		EGEDHN
C[C@H](C(=O)NCCNC(=O)NC1CCCCC1)N1CCCCCC1	ZINC000330270564	457017563	/nfs/dbraw/zinc/01/75/63/457017563.db2.gz	UKSWFHPRICYGDS-OAHLLOKOSA-N	0	3	338.496	3.044	20	30		EGEDHN
C[C@H](CN(C)C)NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1	ZINC000346135264	457020239	/nfs/dbraw/zinc/02/02/39/457020239.db2.gz	CZUMCSWKWWUOQP-OAHLLOKOSA-N	0	3	337.423	3.225	20	30		EGEDHN
O=C(Nc1cccc(CN2CCCCC2)c1)c1cc2n(n1)CCCO2	ZINC000330312807	457025106	/nfs/dbraw/zinc/02/51/06/457025106.db2.gz	WSYZDHCOEHREJH-UHFFFAOYSA-N	0	3	340.427	3.288	20	30		EGEDHN
COCCN(C)CC[C@@H](Nc1cc(C#N)cc(C)n1)c1ccccc1	ZINC000341987625	457044206	/nfs/dbraw/zinc/04/42/06/457044206.db2.gz	YVYLFDMTCYXQBJ-LJQANCHMSA-N	0	3	338.455	3.383	20	30		EGEDHN
CCCN(CC(=O)N(CC)C[C@H](C)C#N)[C@@H]1CCc2ccccc21	ZINC000346569575	457051474	/nfs/dbraw/zinc/05/14/74/457051474.db2.gz	BOEJPSWONHZULE-VQIMIIECSA-N	0	3	327.472	3.394	20	30		EGEDHN
C[C@H](CN1CCC[C@@H](C)C1)NC(=O)Nc1ccc([N+](=O)[O-])cc1F	ZINC000330840268	457093480	/nfs/dbraw/zinc/09/34/80/457093480.db2.gz	JNLJIXJZEIRUTC-VXGBXAGGSA-N	0	3	338.383	3.180	20	30		EGEDHN
CC(C)Cc1ccc([C@H](CNC(=O)c2cc(C#N)c[nH]2)N(C)C)cc1	ZINC000359919474	457148039	/nfs/dbraw/zinc/14/80/39/457148039.db2.gz	DSHGNGKHTUKJIZ-IBGZPJMESA-N	0	3	338.455	3.118	20	30		EGEDHN
CC(C)(C)[C@H](C#N)NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000331222961	457148968	/nfs/dbraw/zinc/14/89/68/457148968.db2.gz	YYPKVNUVXLICLU-WBVHZDCISA-N	0	3	331.435	3.092	20	30		EGEDHN
C[C@H](CN1C[C@H](C)C[C@H](C)C1)NC(=O)c1cc(C#N)ccc1Cl	ZINC000350074201	457162411	/nfs/dbraw/zinc/16/24/11/457162411.db2.gz	KXDXCRFDTXBHBK-HZSPNIEDSA-N	0	3	333.863	3.308	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)c1ccc(C#N)s1)c1ccsc1	ZINC000362964950	457178669	/nfs/dbraw/zinc/17/86/69/457178669.db2.gz	YGUIXGZFUULMSV-AWEZNQCLSA-N	0	3	333.482	3.494	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CCC[C@H]1c1cccnc1	ZINC000347001472	457194118	/nfs/dbraw/zinc/19/41/18/457194118.db2.gz	AJWOOFSXMFRFJB-PMACEKPBSA-N	0	3	338.451	3.387	20	30		EGEDHN
CC(C#N)C(=O)N(Cc1cc(Br)ccc1F)C1CC1	ZINC000347074569	457217531	/nfs/dbraw/zinc/21/75/31/457217531.db2.gz	RQRNMTCWLCEPCX-VIFPVBQESA-N	0	3	325.181	3.239	20	30		EGEDHN
C=CCOc1ccc(CNCCN2CCc3ccccc3C2=O)cc1	ZINC000342329355	457240229	/nfs/dbraw/zinc/24/02/29/457240229.db2.gz	JEHCXAFJSLDOFJ-UHFFFAOYSA-N	0	3	336.435	3.040	20	30		EGEDHN
COc1ccc(C[C@@H](NC(=O)C(C)C#N)c2ccccc2)cc1OC	ZINC000347131292	457246751	/nfs/dbraw/zinc/24/67/51/457246751.db2.gz	IXWXFSVQDZVRBH-RHSMWYFYSA-N	0	3	338.407	3.263	20	30		EGEDHN
N#CC(C(=O)c1ccc(Br)c(Cl)c1)c1ccncn1	ZINC000354476569	457248158	/nfs/dbraw/zinc/24/81/58/457248158.db2.gz	ZGPFBJBTVQDVBH-VIFPVBQESA-N	0	3	336.576	3.383	20	30		EGEDHN
C[C@H](O)C[C@@H]1CCCCCN1C(=O)C(C#N)CCc1ccccc1	ZINC000331995156	457286374	/nfs/dbraw/zinc/28/63/74/457286374.db2.gz	NDCAWCHOOQTHRU-UHOSZYNNSA-N	0	3	328.456	3.301	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@H]1CCC[C@@]1(C)CO	ZINC000351516102	457302257	/nfs/dbraw/zinc/30/22/57/457302257.db2.gz	IBCFNEGXSZRPAL-WMZOPIPTSA-N	0	3	334.485	3.044	20	30		EGEDHN
CO[C@@]1(C)CCCN([C@H](C)C(=O)N(CCC#N)c2ccccc2)CC1	ZINC000332350508	457353116	/nfs/dbraw/zinc/35/31/16/457353116.db2.gz	URPXOTHSWFHZPC-XLIONFOSSA-N	0	3	343.471	3.213	20	30		EGEDHN
COC[C@@H]1CCCCN([C@H](C)C(=O)N(CCC#N)c2ccccc2)C1	ZINC000342575357	457374219	/nfs/dbraw/zinc/37/42/19/457374219.db2.gz	XVOBBJIQNZICOR-QZTJIDSGSA-N	0	3	343.471	3.070	20	30		EGEDHN
C=CCc1cc(CN2CCC[C@@H](c3ccnn3C)C2)cc(OC)c1O	ZINC000378338541	457392199	/nfs/dbraw/zinc/39/21/99/457392199.db2.gz	YUCTUKDBMHGZHV-QGZVFWFLSA-N	0	3	341.455	3.242	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1	ZINC000352474333	457395643	/nfs/dbraw/zinc/39/56/43/457395643.db2.gz	GCJISQVURHHKPT-IMFGXOCKSA-N	0	3	330.472	3.167	20	30		EGEDHN
CCC(C#N)(CC)C(=O)N1CCCN(Cc2ccccc2)C[C@H]1C	ZINC000383086770	457423301	/nfs/dbraw/zinc/42/33/01/457423301.db2.gz	MDVPHJVNDRVGRV-QGZVFWFLSA-N	0	3	327.472	3.439	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1CCC[C@]1(C)Cc1ccccc1	ZINC000342682787	457453666	/nfs/dbraw/zinc/45/36/66/457453666.db2.gz	ZUJPWERJCHJEQW-YLJYHZDGSA-N	0	3	327.472	3.092	20	30		EGEDHN
CCO[C@@H]1C[C@H](NCc2cccc(OCCCC#N)c2)[C@@]12CCCO2	ZINC000363979899	457470940	/nfs/dbraw/zinc/47/09/40/457470940.db2.gz	OWKJGAZSGHDZEH-ZCNNSNEGSA-N	0	3	344.455	3.185	20	30		EGEDHN
CCC(C#N)(CC)C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000398187771	457496513	/nfs/dbraw/zinc/49/65/13/457496513.db2.gz	VTBOYKXFCUCOJF-WMZOPIPTSA-N	0	3	327.472	3.343	20	30		EGEDHN
COc1ccc(C#N)cc1CN1CCC[C@@H]1[C@@H]1C[C@@H](C)CC[C@@H]1O	ZINC000374150408	457497953	/nfs/dbraw/zinc/49/79/53/457497953.db2.gz	FMWVPMLFEGQKJF-FZDIXFNVSA-N	0	3	328.456	3.328	20	30		EGEDHN
N#CC(C(=O)c1cnn2ccccc12)c1ccc(C(F)(F)F)cn1	ZINC000342758736	457504658	/nfs/dbraw/zinc/50/46/58/457504658.db2.gz	WUMONCVZIGQEFO-NSHDSACASA-N	0	3	330.269	3.238	20	30		EGEDHN
COc1cc(CN2CCC[C@H](C(=O)Nc3ccccc3)C2)ccc1C#N	ZINC000374214507	457526685	/nfs/dbraw/zinc/52/66/85/457526685.db2.gz	ZWFKGAWLGDZYRX-SFHVURJKSA-N	0	3	349.434	3.418	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)N[C@@H]1CC[C@H](C#N)C1)c1ccsc1	ZINC000425402538	457536085	/nfs/dbraw/zinc/53/60/85/457536085.db2.gz	INZHENKNHKKYRQ-NUEKZKHPSA-N	0	3	334.489	3.122	20	30		EGEDHN
C[C@]1(CNC(=O)C2(C#N)CCCC2)CCN(Cc2ccccc2)C1	ZINC000374276818	457561752	/nfs/dbraw/zinc/56/17/52/457561752.db2.gz	FOZSEQHMZUJMOV-LJQANCHMSA-N	0	3	325.456	3.099	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)C(=O)NC[C@H](C)N1CCC(C)CC1	ZINC000425471296	457567450	/nfs/dbraw/zinc/56/74/50/457567450.db2.gz	HVZJCWGIWSEKME-DLBZAZTESA-N	0	3	342.487	3.381	20	30		EGEDHN
C=CCN1CC[C@@H](N2CCCCC[C@@H]2c2ccc(OC)cc2)C1=O	ZINC000410309681	457637388	/nfs/dbraw/zinc/63/73/88/457637388.db2.gz	ATIXTHPQNDFKDK-RTBURBONSA-N	0	3	328.456	3.399	20	30		EGEDHN
C=CCN1CC[C@@H](N(CCc2ccc(OC)cc2)CC(C)(C)C)C1=O	ZINC000410382988	457639277	/nfs/dbraw/zinc/63/92/77/457639277.db2.gz	MXCKLWAPWMFUCB-LJQANCHMSA-N	0	3	344.499	3.373	20	30		EGEDHN
CC(C)c1cnc(CNC2CCN(c3ccc(C#N)cn3)CC2)s1	ZINC000374597469	457668894	/nfs/dbraw/zinc/66/88/94/457668894.db2.gz	VEVKXXUQCSAHLL-UHFFFAOYSA-N	0	3	341.484	3.292	20	30		EGEDHN
CCO[C@@H]1C[C@@H](N(C)CCOc2ccc(C#N)cc2OC)C12CCC2	ZINC000357779740	457686954	/nfs/dbraw/zinc/68/69/54/457686954.db2.gz	NAHGRKKIBLILMY-RTBURBONSA-N	0	3	344.455	3.225	20	30		EGEDHN
CCO[C@H]1C[C@@H](N(C)CCOc2ccc(C#N)cc2OC)C12CCC2	ZINC000357779730	457687120	/nfs/dbraw/zinc/68/71/20/457687120.db2.gz	NAHGRKKIBLILMY-MOPGFXCFSA-N	0	3	344.455	3.225	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)c1ccc(C#N)cc1	ZINC000361390498	457714970	/nfs/dbraw/zinc/71/49/70/457714970.db2.gz	GDZWEKUFFWHJKO-JXFKEZNVSA-N	0	3	333.435	3.199	20	30		EGEDHN
C=CCOc1ccc(CN2CCC[C@H](c3nccn3C)C2)cc1OC	ZINC000365821702	457778246	/nfs/dbraw/zinc/77/82/46/457778246.db2.gz	QWKOIPXOCNRMIR-KRWDZBQOSA-N	0	3	341.455	3.373	20	30		EGEDHN
C#CCOc1ccc(CN[C@@H]2CCN(C(C)=O)c3ccccc32)cc1	ZINC000371084365	457783829	/nfs/dbraw/zinc/78/38/29/457783829.db2.gz	DBIUHAKPWPDRGL-HXUWFJFHSA-N	0	3	334.419	3.286	20	30		EGEDHN
COCCN(Cc1ccco1)C(=O)C(C#N)CCc1ccccc1	ZINC000433229873	457786315	/nfs/dbraw/zinc/78/63/15/457786315.db2.gz	SPVCMMXIRIGKFE-KRWDZBQOSA-N	0	3	326.396	3.027	20	30		EGEDHN
CN(CCNC(=O)[C@H](C#N)CCc1ccccc1)Cc1ccccc1	ZINC000433305004	457803579	/nfs/dbraw/zinc/80/35/79/457803579.db2.gz	OTFYAJLZKTTYCE-FQEVSTJZSA-N	0	3	335.451	3.007	20	30		EGEDHN
Cc1ccc([C@@H]2COCCN2C(=O)C(C#N)CCc2ccccc2)o1	ZINC000433347059	457817470	/nfs/dbraw/zinc/81/74/70/457817470.db2.gz	KJILMIVZAHCEBE-MSOLQXFVSA-N	0	3	338.407	3.261	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCc1ccccc1-n1ccnc1	ZINC000433376473	457824659	/nfs/dbraw/zinc/82/46/59/457824659.db2.gz	JTWDHJIAISVDBJ-GOSISDBHSA-N	0	3	344.418	3.261	20	30		EGEDHN
CCC1(CC)[C@H](NC(=O)C(C#N)CCc2ccccc2)C[C@@H]1OC	ZINC000433381717	457826477	/nfs/dbraw/zinc/82/64/77/457826477.db2.gz	LHUFUNTZEOELNB-KSZLIROESA-N	0	3	328.456	3.469	20	30		EGEDHN
Cc1cc(CN[C@@H]2CC(=O)N([C@@H]3C[C@@H]3c3ccccc3)C2)ccc1C#N	ZINC000443981748	457833102	/nfs/dbraw/zinc/83/31/02/457833102.db2.gz	BNNDJYKLBLQYRU-NJDAHSKKSA-N	0	3	345.446	3.113	20	30		EGEDHN
Cc1cc(CN[C@@H]2CC(=O)N([C@@H]3C[C@H]3c3ccccc3)C2)ccc1C#N	ZINC000443981753	457833227	/nfs/dbraw/zinc/83/32/27/457833227.db2.gz	BNNDJYKLBLQYRU-QHAWAJNXSA-N	0	3	345.446	3.113	20	30		EGEDHN
Cc1ccccc1[C@@H](CC(F)(F)F)NCCC(=O)N(C)CCC#N	ZINC000444777360	457975667	/nfs/dbraw/zinc/97/56/67/457975667.db2.gz	FMWUWYXPQSZVOU-OAHLLOKOSA-N	0	3	341.377	3.340	20	30		EGEDHN
C=CCCCNC(=O)N1C[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C1	ZINC000367906946	457995329	/nfs/dbraw/zinc/99/53/29/457995329.db2.gz	LZWNMQSLHOJNEE-RBUKOAKNSA-N	0	3	327.472	3.116	20	30		EGEDHN
CC[C@H]([NH2+]C1CCN(c2ccc(C#N)cn2)CC1)c1ccccc1[O-]	ZINC000375654993	458007757	/nfs/dbraw/zinc/00/77/57/458007757.db2.gz	KYBZSUUDDKIWBT-SFHVURJKSA-N	0	3	336.439	3.369	20	30		EGEDHN
N#CC(C(=O)c1ccc(NC(N)=O)cc1)c1cc(C(F)(F)F)ccn1	ZINC000362117497	458031600	/nfs/dbraw/zinc/03/16/00/458031600.db2.gz	KDUIWUIDNNNOGL-LBPRGKRZSA-N	0	3	348.284	3.081	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@H](C)C1(OC)CCC1	ZINC000412017291	458047215	/nfs/dbraw/zinc/04/72/15/458047215.db2.gz	CVXGYIBOSCNBKR-CQSZACIVSA-N	0	3	334.485	3.450	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN(C)[C@@H]2CCN(CC)[C@@H](C)C2)c1C	ZINC000362252381	458056502	/nfs/dbraw/zinc/05/65/02/458056502.db2.gz	PLAVQZTYVFQJJP-MAUKXSAKSA-N	0	3	331.504	3.278	20	30		EGEDHN
CC(C#N)C(=O)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000358557744	458075692	/nfs/dbraw/zinc/07/56/92/458075692.db2.gz	DDOIPRMVBFURRB-GFCCVEGCSA-N	0	3	340.345	3.482	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N(C)CC(C)(C)C#N	ZINC000458523568	458080784	/nfs/dbraw/zinc/08/07/84/458080784.db2.gz	YSTSOUCSMUCIAA-FUHWJXTLSA-N	0	3	342.487	3.088	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN2CCC3(CC2)OCc2ccccc23)cc1	ZINC000372010224	458159427	/nfs/dbraw/zinc/15/94/27/458159427.db2.gz	NEHGNGGFNUMQGD-HXUWFJFHSA-N	0	3	334.419	3.113	20	30		EGEDHN
Cn1ccnc1[C@@H]1CCCN(Cc2cccc(OCCCC#N)c2)C1	ZINC000376042200	458174431	/nfs/dbraw/zinc/17/44/31/458174431.db2.gz	CKPWOTSTCXRSTH-GOSISDBHSA-N	0	3	338.455	3.482	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN(C)[C@@H]1C[C@](C)(OC)C1(C)C	ZINC000362439866	458177295	/nfs/dbraw/zinc/17/72/95/458177295.db2.gz	PUMXXSJXVMNMDI-MJGOQNOKSA-N	0	3	332.444	3.081	20	30		EGEDHN
C=CCC(C)(C)CNC(=O)N[C@@H](CN(C)C)c1ccc(OC)cc1	ZINC000458807838	458180129	/nfs/dbraw/zinc/18/01/29/458180129.db2.gz	GTAXLMKTZMGKIX-KRWDZBQOSA-N	0	3	333.476	3.199	20	30		EGEDHN
Cc1cc(C#N)ccc1Oc1ccc(C(=O)NC[C@H](C)N(C)C)cc1	ZINC000362466465	458199216	/nfs/dbraw/zinc/19/92/16/458199216.db2.gz	RFHAKNCSGBXGBW-HNNXBMFYSA-N	0	3	337.423	3.339	20	30		EGEDHN
CSc1ccccc1CN1CC[C@H](Oc2ccc(C#N)cn2)C1	ZINC000428794212	458212246	/nfs/dbraw/zinc/21/22/46/458212246.db2.gz	RFISJGBQXCPJOQ-INIZCTEOSA-N	0	3	325.437	3.328	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N(C)C1CCN(Cc2ccccc2)CC1)OCC	ZINC000372304081	458271978	/nfs/dbraw/zinc/27/19/78/458271978.db2.gz	BDRXAFAYXAQQOM-HXUWFJFHSA-N	0	3	344.499	3.481	20	30		EGEDHN
Cc1ccc(C#N)c(NCc2ccc(OC3CCN(C)CC3)cc2)n1	ZINC000376469075	458309554	/nfs/dbraw/zinc/30/95/54/458309554.db2.gz	YKKKFXSXWMZALP-UHFFFAOYSA-N	0	3	336.439	3.347	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)NC(=O)N1CCN(C2CC2)C[C@@H](C)C1	ZINC000413836165	458309539	/nfs/dbraw/zinc/30/95/39/458309539.db2.gz	ORGVWSIVWNYPIG-MJGOQNOKSA-N	0	3	341.499	3.300	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1C[C@H](O)C[C@@H]1c1ccccc1	ZINC000413928560	458311831	/nfs/dbraw/zinc/31/18/31/458311831.db2.gz	ALVYPTPSIKOVBE-XUVXKRRUSA-N	0	3	334.419	3.093	20	30		EGEDHN
CN(C)CCOc1ccc(NC(=O)c2ccc(CC#N)cc2)c(F)c1	ZINC000413897426	458311989	/nfs/dbraw/zinc/31/19/89/458311989.db2.gz	DSAWSUQYGAJZCY-UHFFFAOYSA-N	0	3	341.386	3.084	20	30		EGEDHN
CCS(=O)(=O)c1cc(Cl)cc(CN[C@H]2CCC[C@H](C#N)C2)c1	ZINC000414206511	458316347	/nfs/dbraw/zinc/31/63/47/458316347.db2.gz	FPFJNLKKBQRJNP-WFASDCNBSA-N	0	3	340.876	3.306	20	30		EGEDHN
COc1ccc(CN[C@@H](C)C2(OC)CCC2)cc1OCCCC#N	ZINC000414520449	458321295	/nfs/dbraw/zinc/32/12/95/458321295.db2.gz	CYMZJKVSFCRKKE-HNNXBMFYSA-N	0	3	332.444	3.425	20	30		EGEDHN
CN(Cc1ccccc1)[C@H]1CCN(C(=O)c2cccc(CC#N)c2)C1	ZINC000369710891	458323923	/nfs/dbraw/zinc/32/39/23/458323923.db2.gz	UHSITOFDCVHXND-FQEVSTJZSA-N	0	3	333.435	3.099	20	30		EGEDHN
CN(C)C1(CNC(=O)c2ccccc2Oc2ccccc2C#N)CC1	ZINC000416310359	458342129	/nfs/dbraw/zinc/34/21/29/458342129.db2.gz	ZNMGYWWQEUAMCV-UHFFFAOYSA-N	0	3	335.407	3.175	20	30		EGEDHN
COC(=O)CC1(NCC#Cc2ccc(OC(F)(F)F)cc2)CCC1	ZINC000459392349	458356796	/nfs/dbraw/zinc/35/67/96/458356796.db2.gz	SXOCTBXBGZYMTA-UHFFFAOYSA-N	0	3	341.329	3.012	20	30		EGEDHN
C=CCN(C)CCN(CC)[C@@H](C)C(=O)Nc1cc(Cl)ccc1C	ZINC000429716186	458361824	/nfs/dbraw/zinc/36/18/24/458361824.db2.gz	KADPRCJEBDOKNU-HNNXBMFYSA-N	0	3	337.895	3.415	20	30		EGEDHN
CC1(C)[C@@H](CN[C@@H](C(N)=O)c2ccc(C#N)cc2)[C@@H]1c1ccccc1	ZINC000419296640	458380702	/nfs/dbraw/zinc/38/07/02/458380702.db2.gz	DROKECDGIQVYRF-GBESFXJTSA-N	0	3	333.435	3.114	20	30		EGEDHN
N#CCCCOc1cccc(CNC[C@H]2COC3(CCCC3)O2)c1	ZINC000376804520	458393432	/nfs/dbraw/zinc/39/34/32/458393432.db2.gz	NQADNUCLMXDTOL-SFHVURJKSA-N	0	3	330.428	3.144	20	30		EGEDHN
C=CCC[C@@H]1NC(=O)N(CC(C)(C)N[C@H](C)c2ccccc2)C1=O	ZINC000419994622	458395329	/nfs/dbraw/zinc/39/53/29/458395329.db2.gz	HLHRHPNEZHJLRP-ZBFHGGJFSA-N	0	3	329.444	3.002	20	30		EGEDHN
CN(C[C@@H]1CCCN1C)c1c(C#N)cnc2c(F)c(F)c(F)cc21	ZINC000420636357	458399511	/nfs/dbraw/zinc/39/95/11/458399511.db2.gz	NDEYPTSIIKHMHV-NSHDSACASA-N	0	3	334.345	3.054	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCC[C@H](CC(F)(F)F)C2)CC1	ZINC000420784675	458401126	/nfs/dbraw/zinc/40/11/26/458401126.db2.gz	HJGWJMOLUXVOHK-CQSZACIVSA-N	0	3	347.425	3.401	20	30		EGEDHN
C=CCN(CCc1ccco1)Cc1ccc(CN2CCOCC2)cc1	ZINC000420953240	458404285	/nfs/dbraw/zinc/40/42/85/458404285.db2.gz	UWFVZSYCHLGSBW-UHFFFAOYSA-N	0	3	340.467	3.343	20	30		EGEDHN
COc1ccc([C@H](C)CN2CC[C@H](Oc3ccc(C#N)cn3)C2)cc1	ZINC000430153554	458411811	/nfs/dbraw/zinc/41/18/11/458411811.db2.gz	FAXZFKMJJCAADC-BEFAXECRSA-N	0	3	337.423	3.219	20	30		EGEDHN
COc1ccc([C@@H](C)CN2CC[C@@H](Oc3ccc(C#N)cn3)C2)cc1	ZINC000430153556	458412230	/nfs/dbraw/zinc/41/22/30/458412230.db2.gz	FAXZFKMJJCAADC-HNAYVOBHSA-N	0	3	337.423	3.219	20	30		EGEDHN
CN(CCC#N)C(=O)CCN1CC2(CCCC2)[C@@H]1c1ccccc1	ZINC000459574135	458415760	/nfs/dbraw/zinc/41/57/60/458415760.db2.gz	JHKFSOWSLLBFCU-IBGZPJMESA-N	0	3	325.456	3.366	20	30		EGEDHN
C=CCOc1cccc(CN2CC[C@@H](Oc3ccc(C#N)cn3)C2)c1	ZINC000430183897	458416724	/nfs/dbraw/zinc/41/67/24/458416724.db2.gz	BRICZYREIWBDKM-LJQANCHMSA-N	0	3	335.407	3.171	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCN(Cc3ccc(OCC4CC4)cc3)C2)nc1	ZINC000430185584	458417239	/nfs/dbraw/zinc/41/72/39/458417239.db2.gz	JSVLQDQPIXUTIJ-FQEVSTJZSA-N	0	3	349.434	3.395	20	30		EGEDHN
C=CCN1CCC(NC(=O)C2(c3c(F)cccc3F)CCC2)CC1	ZINC000421769837	458421981	/nfs/dbraw/zinc/42/19/81/458421981.db2.gz	SXBFPRZDTHLLNU-UHFFFAOYSA-N	0	3	334.410	3.153	20	30		EGEDHN
C=CCC[C@H](CO)N[C@H](C)c1ccc(OC)cc1Br	ZINC000449696342	458429657	/nfs/dbraw/zinc/42/96/57/458429657.db2.gz	HUVYVUQHGRXNJW-VXGBXAGGSA-N	0	3	328.250	3.435	20	30		EGEDHN
C[C@@H](NCC(=O)NCc1cccc(C#N)c1)c1cccc(C2CC2)c1	ZINC000451115350	458465898	/nfs/dbraw/zinc/46/58/98/458465898.db2.gz	OOHVVCIZRQPFHI-OAHLLOKOSA-N	0	3	333.435	3.403	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@H]1C[C@H](OC)C12CCC2	ZINC000459745820	458466275	/nfs/dbraw/zinc/46/62/75/458466275.db2.gz	FIKGGUIZYKKJFT-IRXDYDNUSA-N	0	3	346.496	3.450	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N[C@@H]1C[C@H](OC)C12CCC2	ZINC000459746646	458467380	/nfs/dbraw/zinc/46/73/80/458467380.db2.gz	FWEGECBOCXLIMQ-UAGQMJEPSA-N	0	3	348.512	3.198	20	30		EGEDHN
N#Cc1ccc(Br)c(CN[C@@H]([C@H](CO)C2CC2)C2CC2)c1	ZINC000451618205	458483099	/nfs/dbraw/zinc/48/30/99/458483099.db2.gz	VQNQKZKRLHCYBG-NVXWUHKLSA-N	0	3	349.272	3.207	20	30		EGEDHN
CO[C@@H]1CCC[C@H]1NCC(=O)Nc1ccccc1SC[C@H](C)C#N	ZINC000451633248	458484374	/nfs/dbraw/zinc/48/43/74/458484374.db2.gz	QQCDQLVSNLURLW-IIAWOOMASA-N	0	3	347.484	3.034	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC(=O)N[C@H](CC(C)C)c1ccccc1	ZINC000451676678	458485350	/nfs/dbraw/zinc/48/53/50/458485350.db2.gz	FSGOLVSEDUYGOB-QRVBRYPASA-N	0	3	330.472	3.213	20	30		EGEDHN
Cc1cc(CN(CCC(N)=O)[C@@H]2CCOc3ccccc32)ccc1C#N	ZINC000451704075	458486168	/nfs/dbraw/zinc/48/61/68/458486168.db2.gz	CBGKQPLBSNPPHX-LJQANCHMSA-N	0	3	349.434	3.068	20	30		EGEDHN
COc1ccc(Cl)cc1NC(=O)C[C@H](C)NCC1(CC#N)CC1	ZINC000430751028	458486756	/nfs/dbraw/zinc/48/67/56/458486756.db2.gz	ROXQTVSXJOHXDM-LBPRGKRZSA-N	0	3	335.835	3.349	20	30		EGEDHN
CC(C)Cc1ccc([C@H](CNC(=O)[C@@]2(C#N)C[C@@H]2C)N(C)C)cc1	ZINC000451773889	458487257	/nfs/dbraw/zinc/48/72/57/458487257.db2.gz	NMNPZLZOYOYOOB-ZAAXVRCTSA-N	0	3	327.472	3.154	20	30		EGEDHN
C[C@H](NCCS(=O)(=O)c1ccc(C#N)cc1)[C@@H]1CCC[C@@H](C)C1	ZINC000452073286	458494400	/nfs/dbraw/zinc/49/44/00/458494400.db2.gz	VCBDESYOWLHCCB-HLLBOEOZSA-N	0	3	334.485	3.136	20	30		EGEDHN
C=CCOc1ccc(CN[C@H]2CCN(c3cnn(C)c3)C2)cc1Cl	ZINC000377723455	458512939	/nfs/dbraw/zinc/51/29/39/458512939.db2.gz	NGOVILWKXXKLPT-HNNXBMFYSA-N	0	3	346.862	3.007	20	30		EGEDHN
C[C@@H](c1ccc(C#N)cc1F)N1CCC[C@@H](CC(C)(C)C(N)=O)C1	ZINC000453271979	458523265	/nfs/dbraw/zinc/52/32/65/458523265.db2.gz	DJTUSDBIBQHSAO-ZFWWWQNUSA-N	0	3	331.435	3.372	20	30		EGEDHN
C=CCC[C@@H](CO)N[C@@H](C)c1ccccc1I	ZINC000453346462	458524864	/nfs/dbraw/zinc/52/48/64/458524864.db2.gz	IDSDZBFOXOIPIH-RYUDHWBXSA-N	0	3	345.224	3.269	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1N[C@@H]1CCCc2oc(C(=O)OCC)c(C)c21	ZINC000453362617	458525026	/nfs/dbraw/zinc/52/50/26/458525026.db2.gz	RAJLSQHDEWVIRB-KFWWJZLASA-N	0	3	333.428	3.465	20	30		EGEDHN
C=CCn1c(CC(C)(C)C)nnc1N1CCN([C@@H]2C[C@@H]2C)C[C@H](C)C1	ZINC000453428111	458528916	/nfs/dbraw/zinc/52/89/16/458528916.db2.gz	ZMXOYCZSGYAHKB-YESZJQIVSA-N	0	3	345.535	3.219	20	30		EGEDHN
CCOc1cccc2cc([C@H](C)NC(=O)[C@@H](N)CCCC#N)oc21	ZINC000424063840	458548893	/nfs/dbraw/zinc/54/88/93/458548893.db2.gz	JGAMQANIZOXDPG-JSGCOSHPSA-N	0	3	329.400	3.030	20	30		EGEDHN
C=CCN1CC[C@@H](NCC2(c3ccc(OC)cc3)CCCCC2)C1=O	ZINC000493769122	458560456	/nfs/dbraw/zinc/56/04/56/458560456.db2.gz	ZZLFVDPNFNIHHY-LJQANCHMSA-N	0	3	342.483	3.274	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N[C@@H]1CCOc2c(-c3ccccc3)cccc21	ZINC000424116178	458562308	/nfs/dbraw/zinc/56/23/08/458562308.db2.gz	XAOYFEJFBSLBNV-RBUKOAKNSA-N	0	3	349.434	3.315	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)NC1(c2c(Cl)cccc2Cl)CC1	ZINC000424127173	458565437	/nfs/dbraw/zinc/56/54/37/458565437.db2.gz	AVGJOHVKWSHLOA-LBPRGKRZSA-N	0	3	326.227	3.120	20	30		EGEDHN
CCOc1ccccc1[C@H](CC(C)C)NC(=O)[C@H](N)CCCC#N	ZINC000424126462	458565713	/nfs/dbraw/zinc/56/57/13/458565713.db2.gz	PAGCASOBMJWLBX-SJORKVTESA-N	0	3	331.460	3.310	20	30		EGEDHN
CC(C)n1nc(-c2ccccc2)cc1NC(=O)[C@H](N)CCCC#N	ZINC000424136625	458568241	/nfs/dbraw/zinc/56/82/41/458568241.db2.gz	NWXADPAWDYEIKZ-OAHLLOKOSA-N	0	3	325.416	3.091	20	30		EGEDHN
COc1ccc(-c2csc(CNC(=O)[C@@H](N)CCCC#N)c2)cc1	ZINC000424149968	458571365	/nfs/dbraw/zinc/57/13/65/458571365.db2.gz	IFCIIJSUCJHBGY-KRWDZBQOSA-N	0	3	343.452	3.061	20	30		EGEDHN
CC(C)[C@H](NC(=O)[C@@H](N)CCCC#N)c1ccc(Cl)cc1F	ZINC000424169770	458576368	/nfs/dbraw/zinc/57/63/68/458576368.db2.gz	KFAHMRGXGRJJKT-GJZGRUSLSA-N	0	3	325.815	3.314	20	30		EGEDHN
C=C(CC)CNC(=O)NC[C@@H](c1ccc(OC)cc1)N1CCCC1	ZINC000455563511	458604546	/nfs/dbraw/zinc/60/45/46/458604546.db2.gz	UDFIGVUGETVUMH-SFHVURJKSA-N	0	3	331.460	3.098	20	30		EGEDHN
C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000455728882	458609981	/nfs/dbraw/zinc/60/99/81/458609981.db2.gz	IEKHXYSNUFAWBA-HIFRSBDPSA-N	0	3	346.862	3.497	20	30		EGEDHN
C[C@@H]1[C@H](NC(=O)Nc2ccc(OC(C)(C)C)c(C#N)c2)CCCN1C	ZINC000455768894	458613446	/nfs/dbraw/zinc/61/34/46/458613446.db2.gz	LEKVQKNVRVCPFZ-CZUORRHYSA-N	0	3	344.459	3.340	20	30		EGEDHN
CCN1CCC(NC(=O)Nc2ccc(OC(C)(C)C)c(C#N)c2)CC1	ZINC000455786728	458614994	/nfs/dbraw/zinc/61/49/94/458614994.db2.gz	FGXOMVNVBWDVGP-UHFFFAOYSA-N	0	3	344.459	3.341	20	30		EGEDHN
CN(C)C[C@H](NC(=O)Nc1cccc(CC#N)c1)c1ccc(F)cc1	ZINC000455905237	458618838	/nfs/dbraw/zinc/61/88/38/458618838.db2.gz	LKCNKZJMAMWIML-SFHVURJKSA-N	0	3	340.402	3.316	20	30		EGEDHN
C[C@@H]1CCN(CC(=O)NCc2cccc(C#N)c2)CC12CCCCC2	ZINC000462455423	458622507	/nfs/dbraw/zinc/62/25/07/458622507.db2.gz	ROLBBZYFGWDVBS-QGZVFWFLSA-N	0	3	339.483	3.467	20	30		EGEDHN
C[C@H](CC#N)Sc1ccccc1NC(=O)CN[C@@]1(C)CCO[C@@H]1C	ZINC000494214667	458642209	/nfs/dbraw/zinc/64/22/09/458642209.db2.gz	CBTWJENNVLYLGE-LBTNJELSSA-N	0	3	347.484	3.176	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000424505770	458651831	/nfs/dbraw/zinc/65/18/31/458651831.db2.gz	DOOPDRSTRHPYHH-ZCNNSNEGSA-N	0	3	342.483	3.091	20	30		EGEDHN
C=C(C)CN(Cc1ccccc1)C[C@@H](O)COc1ccc(C#N)cc1	ZINC000470909190	458662129	/nfs/dbraw/zinc/66/21/29/458662129.db2.gz	OQWWGYZTWBBTEB-HXUWFJFHSA-N	0	3	336.435	3.376	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H](CCN(C)CCOC)c1ccccc1	ZINC000424648000	458694548	/nfs/dbraw/zinc/69/45/48/458694548.db2.gz	QZRVVAMCCIQLOR-GOSISDBHSA-N	0	3	332.488	3.415	20	30		EGEDHN
C[C@H](C(=O)N(CCN(C)C)C1CCCCC1)c1cccc(C#N)c1	ZINC000463677247	458713845	/nfs/dbraw/zinc/71/38/45/458713845.db2.gz	GJFGLZVZSYCTGR-INIZCTEOSA-N	0	3	327.472	3.385	20	30		EGEDHN
C=C[C@H]1CCCCN1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000494704260	458732998	/nfs/dbraw/zinc/73/29/98/458732998.db2.gz	SVAULXVWRWYFNA-MOPGFXCFSA-N	0	3	327.472	3.401	20	30		EGEDHN
C=CCOc1ccc(C(=O)N(CC)C[C@@H]2CCCN2CC)cc1OC	ZINC000547476360	458746837	/nfs/dbraw/zinc/74/68/37/458746837.db2.gz	ROBKDHJVAWBHLG-KRWDZBQOSA-N	0	3	346.471	3.206	20	30		EGEDHN
C=CCn1c(CC2CCCC2)nnc1N1CC[C@H](N2CCCCC2)C1	ZINC000508880955	458765832	/nfs/dbraw/zinc/76/58/32/458765832.db2.gz	NRRWWVOKWDWENE-SFHVURJKSA-N	0	3	343.519	3.261	20	30		EGEDHN
C=CCN(C/C=C/c1ccncc1)[C@@H](C)c1cccc(-n2cnnn2)c1	ZINC000494929677	458767820	/nfs/dbraw/zinc/76/78/20/458767820.db2.gz	JNESQHAROLIHTK-RTRPANQVSA-N	0	3	346.438	3.320	20	30		EGEDHN
C=CCSCCNC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000509201925	458770799	/nfs/dbraw/zinc/77/07/99/458770799.db2.gz	GKIRRXOTOVNXHR-GOSISDBHSA-N	0	3	347.528	3.212	20	30		EGEDHN
C=C[C@@H]1CCCCN1C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000472380357	458793031	/nfs/dbraw/zinc/79/30/31/458793031.db2.gz	HAJOCQVTZQNZIR-RBUKOAKNSA-N	0	3	327.472	3.259	20	30		EGEDHN
Cc1ccccc1C[C@H]1CCCN1CC(=O)NCc1ccc(C#N)cc1	ZINC000514170655	458796729	/nfs/dbraw/zinc/79/67/29/458796729.db2.gz	SYEBQHJEGVIVSB-OAQYLSRUSA-N	0	3	347.462	3.190	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC2(c3ccc(F)cc3)CC2)CC1	ZINC000530752887	458822464	/nfs/dbraw/zinc/82/24/64/458822464.db2.gz	QHTKDDBMGQGVPM-UHFFFAOYSA-N	0	3	331.435	3.155	20	30		EGEDHN
COc1cc(CNC[C@](C)(Cc2ccccc2)[C@H](C)O)ccc1C#N	ZINC000440643032	458837259	/nfs/dbraw/zinc/83/72/59/458837259.db2.gz	ZEFCPNVYXJPMBU-KKSFZXQISA-N	0	3	338.451	3.286	20	30		EGEDHN
C=CCCCCCN(C)C(=O)NCC1(N(C)C)Cc2ccccc2C1	ZINC000466018059	458871116	/nfs/dbraw/zinc/87/11/16/458871116.db2.gz	PYGBDLBJVREBJR-UHFFFAOYSA-N	0	3	343.515	3.473	20	30		EGEDHN
N#CCC[C@@H](C#N)CNc1cccc(N2CCN(CC3CC3)CC2)c1	ZINC000548788370	458873938	/nfs/dbraw/zinc/87/39/38/458873938.db2.gz	QISBZNDFEOLQSV-SFHVURJKSA-N	0	3	337.471	3.074	20	30		EGEDHN
C=CCN1CCC(NC(=O)CO[C@@H]2C[C@@H](C)CC[C@H]2C(C)C)CC1	ZINC000518501465	458873897	/nfs/dbraw/zinc/87/38/97/458873897.db2.gz	AZWXSCIFLGDBET-YTQUADARSA-N	0	3	336.520	3.230	20	30		EGEDHN
CC(C)(C#N)c1ccc(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000474431245	458886123	/nfs/dbraw/zinc/88/61/23/458886123.db2.gz	GWJSQDJUYJXKDP-HXUWFJFHSA-N	0	3	347.462	3.492	20	30		EGEDHN
C=CCSCCN[C@@H](C)c1cnccc1NC(=O)OC(C)(C)C	ZINC000495615786	458898405	/nfs/dbraw/zinc/89/84/05/458898405.db2.gz	CENTXOHMUNPDPA-ZDUSSCGKSA-N	0	3	337.489	3.420	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@@H]1NCc1ccc(C#N)cn1	ZINC000495707015	458925363	/nfs/dbraw/zinc/92/53/63/458925363.db2.gz	FNOPYKIQKUHLCE-RDJZCZTQSA-N	0	3	344.459	3.126	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN(C[C@@H]1CCCO1)C1CCC(C)CC1	ZINC000441478920	458951705	/nfs/dbraw/zinc/95/17/05/458951705.db2.gz	UUJCOHZNUISZPD-ACBHZAAOSA-N	0	3	336.520	3.471	20	30		EGEDHN
C[C@@]1(Cc2ccccc2)CCCN1CC(=O)NC1(C#N)CCCCC1	ZINC000467216894	458959496	/nfs/dbraw/zinc/95/94/96/458959496.db2.gz	JOROJWQOBSHIPM-FQEVSTJZSA-N	0	3	339.483	3.426	20	30		EGEDHN
C[C@@H](NCC(=O)NC1(C#N)CCC1)c1ccc(F)c2ccccc21	ZINC000566643004	458974943	/nfs/dbraw/zinc/97/49/43/458974943.db2.gz	VNLUHYQCQPAWCS-CYBMUJFWSA-N	0	3	325.387	3.192	20	30		EGEDHN
N#Cc1cnn2cc(CNCCc3cc(Cl)cc(Cl)c3)cnc12	ZINC000566669021	458978674	/nfs/dbraw/zinc/97/86/74/458978674.db2.gz	MAQAAULYVUKTTP-UHFFFAOYSA-N	0	3	346.221	3.240	20	30		EGEDHN
CCn1ncc2cc(C(=O)C(C#N)c3nc4ccccc4[nH]3)c(C)nc21	ZINC000442002018	458986621	/nfs/dbraw/zinc/98/66/21/458986621.db2.gz	NCMTZROJEHJUAG-CQSZACIVSA-N	0	3	344.378	3.126	20	30		EGEDHN
Cc1c(C(=O)C(C#N)c2cc(C)nc(C)n2)cnn1CCC(C)C	ZINC000442041379	458989123	/nfs/dbraw/zinc/98/91/23/458989123.db2.gz	HFLFDTIFKKBDJG-OAHLLOKOSA-N	0	3	325.416	3.135	20	30		EGEDHN
N#C[C@H]1CC[C@@H](NCc2ccc(OCCOc3ccccc3)nc2)C1	ZINC000442721776	459026489	/nfs/dbraw/zinc/02/64/89/459026489.db2.gz	ULVLFPSPBNHCFO-FUHWJXTLSA-N	0	3	337.423	3.321	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N[C@H]1CN(C2CC2)C[C@@H]1C)c1ccc(F)c(F)c1	ZINC000477227244	459036285	/nfs/dbraw/zinc/03/62/85/459036285.db2.gz	YQBXDYUMNYSQMR-IGNZVWTISA-N	0	3	349.425	3.364	20	30		EGEDHN
Cc1cccc(CN(C)C[C@@H](O)COc2ccc(CC#N)cc2)c1C	ZINC000589998996	459064477	/nfs/dbraw/zinc/06/44/77/459064477.db2.gz	JICYJUFDSUOMTM-HXUWFJFHSA-N	0	3	338.451	3.241	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)C[C@@H]1CN(c2ccccc2)CCO1	ZINC000577765645	459091765	/nfs/dbraw/zinc/09/17/65/459091765.db2.gz	HSRXPTSQSPIHQX-DYESRHJHSA-N	0	3	335.451	3.456	20	30		EGEDHN
COc1ccc(CN(C)C)cc1NC(=O)NCc1ccc(C#N)s1	ZINC000557672535	459098601	/nfs/dbraw/zinc/09/86/01/459098601.db2.gz	CUPPISGNYXIGIL-UHFFFAOYSA-N	0	3	344.440	3.012	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@H](C#N)CCC#N)C1	ZINC000496276133	459133697	/nfs/dbraw/zinc/13/36/97/459133697.db2.gz	QLVRVGYORLXCQY-MAUKXSAKSA-N	0	3	334.464	3.057	20	30		EGEDHN
CC(C#N)C(=O)N1CCCC[C@@H]1[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000496295784	459140439	/nfs/dbraw/zinc/14/04/39/459140439.db2.gz	QNDDPCGBOQHYGN-BZUAXINKSA-N	0	3	349.475	3.174	20	30		EGEDHN
C=CC[C@@H](C)[C@@H](C)Nc1ccc2nc(CCN3CCOCC3)[nH]c2c1	ZINC000558274280	459144170	/nfs/dbraw/zinc/14/41/70/459144170.db2.gz	QDGYSHMGJGNNCF-HZPDHXFCSA-N	0	3	342.487	3.450	20	30		EGEDHN
N#Cc1nc(N2CCCN(Cc3ccccc3)CC2)sc1Cl	ZINC000590571564	459151427	/nfs/dbraw/zinc/15/14/27/459151427.db2.gz	GAFHBTJGKPKQBX-UHFFFAOYSA-N	0	3	332.860	3.380	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)C(=O)NC[C@H]1CCCCN1C1CC1	ZINC000567728455	459156382	/nfs/dbraw/zinc/15/63/82/459156382.db2.gz	AJPPFYYGMIGDSP-DNVCBOLYSA-N	0	3	340.471	3.278	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN2Cc3ccc(O)cc3C3(CC3)C2)c1	ZINC000578291624	459175360	/nfs/dbraw/zinc/17/53/60/459175360.db2.gz	DXBORXRNPDLCSA-UHFFFAOYSA-N	0	3	347.418	3.140	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(OC3CC3)cc2OC)CC1	ZINC000480151435	459186023	/nfs/dbraw/zinc/18/60/23/459186023.db2.gz	UPXBUEDEMPXCDK-UHFFFAOYSA-N	0	3	344.455	3.007	20	30		EGEDHN
CCO[C@H]1C[C@H](NCC(=O)Nc2oc(C)c(C)c2C#N)C12CCCC2	ZINC000590739514	459201728	/nfs/dbraw/zinc/20/17/28/459201728.db2.gz	SBYJVPIOYHJOIO-HOTGVXAUSA-N	0	3	345.443	3.034	20	30		EGEDHN
CC[C@@H]1CCCN1CC(=O)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000533285618	459213773	/nfs/dbraw/zinc/21/37/73/459213773.db2.gz	HHFZOYZCMLUHCI-MRXNPFEDSA-N	0	3	338.373	3.048	20	30		EGEDHN
C=CCCS(=O)(=O)NCC1(N[C@H](C)c2ccccc2)CCCC1	ZINC000481016315	459228541	/nfs/dbraw/zinc/22/85/41/459228541.db2.gz	STZOURRRZRSMNJ-MRXNPFEDSA-N	0	3	336.501	3.146	20	30		EGEDHN
Cc1c([C@@H](C)NCCc2ccc(C#N)cc2)nnn1-c1ccc(F)cc1	ZINC000595055565	459228947	/nfs/dbraw/zinc/22/89/47/459228947.db2.gz	GKNOBAVRMPDUJH-CQSZACIVSA-N	0	3	349.413	3.480	20	30		EGEDHN
C=C(C)Cn1c(CCC(C)C)nnc1N1CCN(C)[C@H](C(C)C)C1	ZINC000558995769	459229345	/nfs/dbraw/zinc/22/93/45/459229345.db2.gz	MVWHDHDZMNVXRY-KRWDZBQOSA-N	0	3	333.524	3.219	20	30		EGEDHN
CC(C#N)C(=O)N[C@@H](CCCNC(=O)OC(C)(C)C)c1ccccc1	ZINC000496551558	459236960	/nfs/dbraw/zinc/23/69/60/459236960.db2.gz	SEUMXXQQRSXVNT-HOCLYGCPSA-N	0	3	345.443	3.308	20	30		EGEDHN
C=C(C)CN(C)CC(=O)NC[C@@H](c1ccccc1Cl)N1CCCC1	ZINC000481215150	459240096	/nfs/dbraw/zinc/24/00/96/459240096.db2.gz	XDPDQMWGJLAJCB-SFHVURJKSA-N	0	3	349.906	3.101	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](C)c2nc3c(s2)CCC3)CC1	ZINC000579563197	459248254	/nfs/dbraw/zinc/24/82/54/459248254.db2.gz	XTHJQTMAZRLQGN-ZDUSSCGKSA-N	0	3	348.516	3.033	20	30		EGEDHN
COc1cccc2c1CN(C(=O)C(C#N)CCc1ccccc1)CC2	ZINC000590876620	459255087	/nfs/dbraw/zinc/25/50/87/459255087.db2.gz	BITMMPIQAXIOHS-GOSISDBHSA-N	0	3	334.419	3.352	20	30		EGEDHN
CC1(C)CCCN1CCNC(=O)c1c(Cl)cc(C#N)cc1Cl	ZINC000590889243	459260591	/nfs/dbraw/zinc/26/05/91/459260591.db2.gz	XWPMCMLYFMYIQE-UHFFFAOYSA-N	0	3	340.254	3.469	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC(=O)N(C)[C@@H](C)c1cc2ccccc2o1	ZINC000581173134	459268643	/nfs/dbraw/zinc/26/86/43/459268643.db2.gz	RFTQIUJDKTYYAJ-UAGQMJEPSA-N	0	3	342.439	3.275	20	30		EGEDHN
CCc1ccccc1[C@@H](CNC(=O)C(C)C#N)NC(=O)OC(C)(C)C	ZINC000496638190	459268679	/nfs/dbraw/zinc/26/86/79/459268679.db2.gz	BAWDKQIGWHOPNL-XJKSGUPXSA-N	0	3	345.443	3.091	20	30		EGEDHN
Cn1nnc2cc(C(=O)C(C#N)c3ccc4ccccc4n3)ccc21	ZINC000591020050	459294417	/nfs/dbraw/zinc/29/44/17/459294417.db2.gz	HEAWFFJSDICZHN-AWEZNQCLSA-N	0	3	327.347	3.007	20	30		EGEDHN
C[C@](O)(C1CCN(CCc2ccc(C#N)cc2)CC1)C(F)(F)F	ZINC000595437056	459301890	/nfs/dbraw/zinc/30/18/90/459301890.db2.gz	CHXOWLDYBDDJRF-INIZCTEOSA-N	0	3	326.362	3.126	20	30		EGEDHN
C=CCc1ccc(OC[C@H](O)CN2CC3(C2)CCCCC3)c(OC)c1	ZINC000582092004	459304736	/nfs/dbraw/zinc/30/47/36/459304736.db2.gz	VGIWVDQYRWQUET-GOSISDBHSA-N	0	3	345.483	3.430	20	30		EGEDHN
C[C@H](NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1)c1ccc(C#N)cc1	ZINC000523668626	459321275	/nfs/dbraw/zinc/32/12/75/459321275.db2.gz	YAJKDGZRPWDASE-OXJNMPFZSA-N	0	3	348.450	3.043	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCC(F)(F)c2ccccc2)CC1	ZINC000568703754	459329373	/nfs/dbraw/zinc/32/93/73/459329373.db2.gz	SCOOJMHGBYRRIK-UHFFFAOYSA-N	0	3	337.414	3.118	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CCc2ccccc2CC1	ZINC000523861876	459335178	/nfs/dbraw/zinc/33/51/78/459335178.db2.gz	FDQMHKKHTHDYGD-OAQYLSRUSA-N	0	3	337.463	3.256	20	30		EGEDHN
C[C@H](CN1CCC(C)CC1)NC(=O)N[C@H](C)c1cccc(C#N)c1	ZINC000595541535	459338625	/nfs/dbraw/zinc/33/86/25/459338625.db2.gz	UFQSTSCMZDCAKK-HZPDHXFCSA-N	0	3	328.460	3.039	20	30		EGEDHN
Cc1cc(C#N)cc(NC(=O)[C@H]2CCCN(Cc3cccnc3)C2)c1	ZINC000560469608	459352981	/nfs/dbraw/zinc/35/29/81/459352981.db2.gz	WZLVTFVXLYNEPC-SFHVURJKSA-N	0	3	334.423	3.112	20	30		EGEDHN
N#CC1(CNC(=O)N[C@@H](CN2CCCCC2)c2ccccc2)CCC1	ZINC000591389341	459369600	/nfs/dbraw/zinc/36/96/00/459369600.db2.gz	MDHADYAZYXUJEY-SFHVURJKSA-N	0	3	340.471	3.207	20	30		EGEDHN
N#CC[C@@H]1CCCN(C[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000595619538	459372070	/nfs/dbraw/zinc/37/20/70/459372070.db2.gz	CQSOXTULDLFKHD-UONOGXRCSA-N	0	3	342.361	3.071	20	30		EGEDHN
N#Cc1ccc(CN[C@]2(Cc3ccc(Cl)cc3)CCCOC2)nc1	ZINC000595671034	459390997	/nfs/dbraw/zinc/39/09/97/459390997.db2.gz	LQUBJGCHXOTQSX-IBGZPJMESA-N	0	3	341.842	3.488	20	30		EGEDHN
N#Cc1cnn2c1NC[C@H](CN1CCC[C@H]1c1cccc(Cl)c1)C2	ZINC000569104841	459396055	/nfs/dbraw/zinc/39/60/55/459396055.db2.gz	ZVHMHXTXNNOMLV-DYVFJYSZSA-N	0	3	341.846	3.287	20	30		EGEDHN
C=CCNC(=O)CN[C@@H]1CCCC[C@H]1Oc1ccc(OCCC)cc1	ZINC000484634997	459423515	/nfs/dbraw/zinc/42/35/15/459423515.db2.gz	RTOFVCBANMIAKJ-RTBURBONSA-N	0	3	346.471	3.057	20	30		EGEDHN
C=CCCCCCN(C)CC(=O)N1CCO[C@H](c2ccc(F)cc2)C1	ZINC000525787189	459492627	/nfs/dbraw/zinc/49/26/27/459492627.db2.gz	XIIDDVPCPYDQSX-IBGZPJMESA-N	0	3	348.462	3.404	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCc2ccc([C@@H]3C[C@@H]3C)o2)CC1	ZINC000592076552	459520384	/nfs/dbraw/zinc/52/03/84/459520384.db2.gz	FGIHRJAJRXVKAR-MAUKXSAKSA-N	0	3	330.472	3.492	20	30		EGEDHN
O[C@@H](CNCC#Cc1ccccc1)Cc1ccccc1C(F)(F)F	ZINC000583316956	459520359	/nfs/dbraw/zinc/52/03/59/459520359.db2.gz	FJFORIAYEWSNEV-QGZVFWFLSA-N	0	3	333.353	3.250	20	30		EGEDHN
C[C@H](N[C@H]1CCO[C@@H](c2ccnn2C)C1)c1ccc(C#N)cc1F	ZINC000583363932	459526481	/nfs/dbraw/zinc/52/64/81/459526481.db2.gz	PUNCTZCVERWBIA-XAYKYTGQSA-N	0	3	328.391	3.002	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1Nc1nc(C#N)c(Cl)s1	ZINC000596151843	459538942	/nfs/dbraw/zinc/53/89/42/459538942.db2.gz	BLDOBBWSOZHBMS-OCCSQVGLSA-N	0	3	346.887	3.413	20	30		EGEDHN
N#CCC1CCN(C[C@@H](O)COc2ccccc2C(F)(F)F)CC1	ZINC000542257172	459540567	/nfs/dbraw/zinc/54/05/67/459540567.db2.gz	IDBNNHZAAATXHL-CQSZACIVSA-N	0	3	342.361	3.071	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)c1ccc(C#N)s1	ZINC000488482238	459544844	/nfs/dbraw/zinc/54/48/44/459544844.db2.gz	FUZVKKMXQGJFGF-RHSMWYFYSA-N	0	3	339.464	3.260	20	30		EGEDHN
N#CC1(NC(=O)c2cccc(CN3CCCCC3)c2)CCSCC1	ZINC000570614716	459558482	/nfs/dbraw/zinc/55/84/82/459558482.db2.gz	TUAVIWDOIJVPCE-UHFFFAOYSA-N	0	3	343.496	3.192	20	30		EGEDHN
Cc1cc(N(CCC#N)C(=O)CNC2(C3CC3)CC2)ccc1Cl	ZINC000542520869	459566290	/nfs/dbraw/zinc/56/62/90/459566290.db2.gz	FXRJNOPGQJWHII-UHFFFAOYSA-N	0	3	331.847	3.427	20	30		EGEDHN
C=C[C@H]1CCCCN1C[C@@H](O)COc1ccc(Br)cc1	ZINC000489487486	459566255	/nfs/dbraw/zinc/56/62/55/459566255.db2.gz	VNHNOYWDCWSTRY-LSDHHAIUSA-N	0	3	340.261	3.229	20	30		EGEDHN
C=CCN(CCc1ccco1)C(=O)NC[C@@H](C)N1CCCC[C@H]1C	ZINC000498144743	459571046	/nfs/dbraw/zinc/57/10/46/459571046.db2.gz	ISQRDAAVKYFXRC-IAGOWNOFSA-N	0	3	333.476	3.283	20	30		EGEDHN
C=C(CNC(=O)NCC1(N(C)C)Cc2ccccc2C1)c1ccccc1	ZINC000498163427	459572810	/nfs/dbraw/zinc/57/28/10/459572810.db2.gz	QRKGTSJSDREBCK-UHFFFAOYSA-N	0	3	349.478	3.098	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN2CCC[C@H]2[C@@H]2CCCOC2)c1C	ZINC000571795404	459573137	/nfs/dbraw/zinc/57/31/37/459573137.db2.gz	WZGBYKALZSBLJG-MJGOQNOKSA-N	0	3	330.472	3.365	20	30		EGEDHN
C=CCn1cccc1C(=O)N(Cc1ccco1)C1CCN(C)CC1	ZINC000490042432	459575639	/nfs/dbraw/zinc/57/56/39/459575639.db2.gz	JAANFOOXLZITIB-UHFFFAOYSA-N	0	3	327.428	3.004	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1Cc2ccccc2C1)C(C)C	ZINC000592346791	459577587	/nfs/dbraw/zinc/57/75/87/459577587.db2.gz	IKJAZHHMTQVOPF-LJQANCHMSA-N	0	3	327.472	3.410	20	30		EGEDHN
COc1ccc(CNCc2ccc(CO)cc2)cc1OCCCC#N	ZINC000592372351	459583218	/nfs/dbraw/zinc/58/32/18/459583218.db2.gz	QUIKCKHESLYGIE-UHFFFAOYSA-N	0	3	340.423	3.160	20	30		EGEDHN
CC[C@@](C)(COc1ncccc1Cl)NCc1ccc(C#N)cn1	ZINC000572852724	459586494	/nfs/dbraw/zinc/58/64/94/459586494.db2.gz	KYHVNFHOCNVGNL-KRWDZBQOSA-N	0	3	330.819	3.339	20	30		EGEDHN
CN1CC[C@@H]2CN(C(=O)c3cccc(Nc4ccc(C#N)cc4)c3)C[C@@H]21	ZINC000583913871	459616614	/nfs/dbraw/zinc/61/66/14/459616614.db2.gz	FTBYIYCVMATGBM-XLIONFOSSA-N	0	3	346.434	3.078	20	30		EGEDHN
C[C@@H](N[C@@H](C)C(=O)NC1(C#N)CCC1)c1ccc2c(c1)CCCC2	ZINC000527299506	459624725	/nfs/dbraw/zinc/62/47/25/459624725.db2.gz	SGYOBCQKVSUNQA-CABCVRRESA-N	0	3	325.456	3.167	20	30		EGEDHN
C=CCCC[C@H](C)N[C@@H](Cc1ccc(C(F)(F)F)cc1)C(N)=O	ZINC000543138727	459626898	/nfs/dbraw/zinc/62/68/98/459626898.db2.gz	LTSNOHUCMXYCGN-WFASDCNBSA-N	0	3	328.378	3.436	20	30		EGEDHN
C#CCN(C(=O)NC1CCN([C@@H](C)c2ccccc2)CC1)C1CC1	ZINC000491465276	459628719	/nfs/dbraw/zinc/62/87/19/459628719.db2.gz	VSNMEMNQWDMYEA-INIZCTEOSA-N	0	3	325.456	3.019	20	30		EGEDHN
C=CCN1CC[C@@H](N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)C1=O	ZINC000499618820	459643322	/nfs/dbraw/zinc/64/33/22/459643322.db2.gz	KVUOTERZMVLZNI-GOEBONIOSA-N	0	3	338.373	3.282	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(Cl)c3ccncc23)CC1	ZINC000491660439	459649004	/nfs/dbraw/zinc/64/90/04/459649004.db2.gz	YJXSTZAWKYEEBZ-UHFFFAOYSA-N	0	3	327.815	3.172	20	30		EGEDHN
C=CCN(Cc1ccnc(C)c1)[C@H](C)c1cccc(-n2cnnn2)c1	ZINC000527531832	459656825	/nfs/dbraw/zinc/65/68/25/459656825.db2.gz	CJHSNXZNZGNMAC-MRXNPFEDSA-N	0	3	334.427	3.115	20	30		EGEDHN
CN(C)C/C=C\C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1	ZINC000491885748	459683662	/nfs/dbraw/zinc/68/36/62/459683662.db2.gz	POHXGVLMAIDZAV-DAXSKMNVSA-N	0	3	349.434	3.388	20	30		EGEDHN
C#CCCN1CCC(NC(=O)/C=C\c2ccc(C)c(Cl)c2)CC1	ZINC000491909018	459684245	/nfs/dbraw/zinc/68/42/45/459684245.db2.gz	WAGLRPZUCLCZJK-FPLPWBNLSA-N	0	3	330.859	3.266	20	30		EGEDHN
O[C@H](CNCC#Cc1ccccc1)Cc1ccc(C(F)(F)F)cc1	ZINC000562984717	459686126	/nfs/dbraw/zinc/68/61/26/459686126.db2.gz	ICXUSDXBEAVZQY-SFHVURJKSA-N	0	3	333.353	3.250	20	30		EGEDHN
C=CCC1(NC(=O)NCC2(SC)CCN(C)CC2)CCCC1	ZINC000596606156	459695297	/nfs/dbraw/zinc/69/52/97/459695297.db2.gz	YLTSXTFSXWRFBU-UHFFFAOYSA-N	0	3	325.522	3.002	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)NC[C@@H](C)C#N)N(CC)CC)cc1	ZINC000563032345	459700636	/nfs/dbraw/zinc/70/06/36/459700636.db2.gz	WDPKOPLQRWRBTF-YJBOKZPZSA-N	0	3	330.476	3.091	20	30		EGEDHN
CN(CCN1CCCCC1)Cc1ccc(C#N)cc1Br	ZINC000593112102	459776538	/nfs/dbraw/zinc/77/65/38/459776538.db2.gz	LBYQMTWVFORQRB-UHFFFAOYSA-N	0	3	336.277	3.238	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CCC[C@H]1[C@@H]1CCCOC1	ZINC000565021262	459780810	/nfs/dbraw/zinc/78/08/10/459780810.db2.gz	SAAXGUYJDPSZKR-OTWHNJEPSA-N	0	3	326.440	3.177	20	30		EGEDHN
C[C@H](NC[C@H](O)CN(C)CCC#N)c1ccc(Cl)c2ccccc21	ZINC000565300111	459783246	/nfs/dbraw/zinc/78/32/46/459783246.db2.gz	TWWOJXHJLZPDBP-GJZGRUSLSA-N	0	3	345.874	3.350	20	30		EGEDHN
Cc1nc(NC(=O)c2ccccc2CN(C)C)sc1SCC#N	ZINC000565474274	459784528	/nfs/dbraw/zinc/78/45/28/459784528.db2.gz	WMHXHLPVMDLELY-UHFFFAOYSA-N	0	3	346.481	3.381	20	30		EGEDHN
CCC(C#N)(CC)C(=O)NCC1CCN(Cc2cccs2)CC1	ZINC000528312800	459802999	/nfs/dbraw/zinc/80/29/99/459802999.db2.gz	AHXYQMKHFLAEFG-UHFFFAOYSA-N	0	3	333.501	3.406	20	30		EGEDHN
N#CCc1cccc(NC(=O)NC[C@@H]2CCN2C2CCCCC2)c1	ZINC000529116624	459822856	/nfs/dbraw/zinc/82/28/56/459822856.db2.gz	QDHBIXDLFSSOPP-SFHVURJKSA-N	0	3	326.444	3.281	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCN(Cc3cc4ccncc4s3)C2)nc1	ZINC000597129488	459845660	/nfs/dbraw/zinc/84/56/60/459845660.db2.gz	KKCHEVRKTFZOPM-OAHLLOKOSA-N	0	3	336.420	3.216	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)CN1C[C@H](c2ccccc2)[C@H]2CCC[C@@H]21	ZINC000586776476	459870572	/nfs/dbraw/zinc/87/05/72/459870572.db2.gz	FNFMURZHKNLRLZ-BNDYYXHWSA-N	0	3	339.483	3.309	20	30		EGEDHN
CN(C)CCOc1ccc(-c2noc(-c3cc(C#N)cs3)n2)cc1	ZINC000546295531	459908030	/nfs/dbraw/zinc/90/80/30/459908030.db2.gz	XYYXJZYMPQMHNA-UHFFFAOYSA-N	0	3	340.408	3.277	20	30		EGEDHN
Cc1cc(F)ccc1N(CC#N)C(=O)C1Oc2ccccc2O[C@@H]1C	ZINC000602393717	459913850	/nfs/dbraw/zinc/91/38/50/459913850.db2.gz	HKYZIJMNICDNIH-ACJLOTCBSA-N	0	3	340.354	3.219	20	30		EGEDHN
Cc1ccc(CN2CC[C@H](NC(=O)Nc3ccc(CC#N)cc3)C2)cc1	ZINC000602405500	459919056	/nfs/dbraw/zinc/91/90/56/459919056.db2.gz	MTGNRYFOPGEVNJ-FQEVSTJZSA-N	0	3	348.450	3.457	20	30		EGEDHN
COC[C@@H](CC(C)(C)C)N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000593614866	459933920	/nfs/dbraw/zinc/93/39/20/459933920.db2.gz	XVLOJHQJCBJHTK-SJLPKXTDSA-N	0	3	343.471	3.094	20	30		EGEDHN
C[C@@H](CCC#N)CN1CCN(CCOc2ccccc2Cl)CC1	ZINC000602436782	459937284	/nfs/dbraw/zinc/93/72/84/459937284.db2.gz	ZYMJZVUJTXPXHS-INIZCTEOSA-N	0	3	335.879	3.276	20	30		EGEDHN
COc1ccc([C@H]2CCCN2C[C@@H](O)CC(C)(C)C#N)cc1OC	ZINC000598584577	459954577	/nfs/dbraw/zinc/95/45/77/459954577.db2.gz	OEWKHLUOHCWAQO-JKSUJKDBSA-N	0	3	332.444	3.141	20	30		EGEDHN
C[C@H](NC1CCN(Cc2cccc(C#N)c2)CC1)c1nccs1	ZINC000593720633	459962479	/nfs/dbraw/zinc/96/24/79/459962479.db2.gz	IUMZVCGRGYDEHN-AWEZNQCLSA-N	0	3	326.469	3.330	20	30		EGEDHN
CCCN(C[C@H](O)CC(C)(C)C#N)[C@@H](C)C(=O)Nc1ccccc1C	ZINC000598612924	459963425	/nfs/dbraw/zinc/96/34/25/459963425.db2.gz	FROHFGRLBMSVBS-DLBZAZTESA-N	0	3	345.487	3.335	20	30		EGEDHN
N#Cc1cccc(CNc2ccc(CCN3CCSCC3)cc2)n1	ZINC000602492851	459966869	/nfs/dbraw/zinc/96/68/69/459966869.db2.gz	YXESWPXHPGMQRN-UHFFFAOYSA-N	0	3	338.480	3.157	20	30		EGEDHN
C[C@@H](CC1(C#N)CCOCC1)Nc1cccc(OCCN(C)C)c1	ZINC000602493648	459968447	/nfs/dbraw/zinc/96/84/47/459968447.db2.gz	YQTUOVDHWPRGDW-INIZCTEOSA-N	0	3	331.460	3.138	20	30		EGEDHN
CN(C(=O)CCCCCC#N)C1CCN(CCc2ccccn2)CC1	ZINC000588752993	459977250	/nfs/dbraw/zinc/97/72/50/459977250.db2.gz	GBZVSWTXGJEFEV-UHFFFAOYSA-N	0	3	342.487	3.021	20	30		EGEDHN
CCC(=O)Nc1cccc(CN[C@H](C)CC2(C#N)CCOCC2)c1	ZINC000602516391	459977791	/nfs/dbraw/zinc/97/77/91/459977791.db2.gz	KNWXIDLPFBBOIY-OAHLLOKOSA-N	0	3	329.444	3.224	20	30		EGEDHN
C[C@@H](CC1(C#N)CCOCC1)NCc1ccc(OCC2CC2)nc1	ZINC000602531576	459985351	/nfs/dbraw/zinc/98/53/51/459985351.db2.gz	UWMBVWAZMKVBRS-HNNXBMFYSA-N	0	3	329.444	3.059	20	30		EGEDHN
CC[C@H]1CCCCN1CCNC(=O)c1cc2ccccc2n1CC#N	ZINC000609594370	459989884	/nfs/dbraw/zinc/98/98/84/459989884.db2.gz	DPITUVJOSAFIQM-KRWDZBQOSA-N	0	3	338.455	3.159	20	30		EGEDHN
CC(C#N)C(=O)N1CC2(CCCC2)c2cc3c(cc2[C@@H]1C)OCCO3	ZINC000609620022	459995847	/nfs/dbraw/zinc/99/58/47/459995847.db2.gz	ASPRQUVZRDQIKP-KGLIPLIRSA-N	0	3	340.423	3.332	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)c2nc3cc(F)ccc3s2)cn1	ZINC000609627619	459998757	/nfs/dbraw/zinc/99/87/57/459998757.db2.gz	VVGUMKRAIPCYRS-NSHDSACASA-N	0	3	342.355	3.085	20	30		EGEDHN
C=CCSCCNC(=O)N[C@@H](CN1CCCCC1)c1ccccc1	ZINC000609639602	460001824	/nfs/dbraw/zinc/00/18/24/460001824.db2.gz	MLMFJCFWAYCAKA-SFHVURJKSA-N	0	3	347.528	3.432	20	30		EGEDHN
COCCOc1cc(C)ccc1CN[C@H](C)CC1(C#N)CCOCC1	ZINC000602573814	460004193	/nfs/dbraw/zinc/00/41/93/460004193.db2.gz	NEBXAWXNVCBHSY-QGZVFWFLSA-N	0	3	346.471	3.209	20	30		EGEDHN
CN(C)C[C@H](NC(=O)CC1(C#N)CCCCC1)c1ccc(F)cc1	ZINC000597658238	460020420	/nfs/dbraw/zinc/02/04/20/460020420.db2.gz	VIFXCHLWXZEMSA-KRWDZBQOSA-N	0	3	331.435	3.409	20	30		EGEDHN
C[C@H](CC1(C#N)CCOCC1)NCc1cc(Cl)cc2c1OCC2	ZINC000602614193	460022829	/nfs/dbraw/zinc/02/28/29/460022829.db2.gz	MKAGMMKZVGPING-CYBMUJFWSA-N	0	3	334.847	3.463	20	30		EGEDHN
N#CC1(CC(=O)Nc2cccc(CN3CC[C@H](O)C3)c2)CCCCC1	ZINC000597687228	460027083	/nfs/dbraw/zinc/02/70/83/460027083.db2.gz	MYLQRWQIBURUPQ-SFHVURJKSA-N	0	3	341.455	3.056	20	30		EGEDHN
CN(CCc1cccc(Br)c1)Cc1cccc(C#N)n1	ZINC000602677051	460060517	/nfs/dbraw/zinc/06/05/17/460060517.db2.gz	QAEVITFKVIZPOG-UHFFFAOYSA-N	0	3	330.229	3.390	20	30		EGEDHN
CC[C@H](NCc1ccc2c(c1)CCS2(=O)=O)c1ccc(C#N)cc1	ZINC000618572105	460066970	/nfs/dbraw/zinc/06/69/70/460066970.db2.gz	ZBXDLGIDVCVJAV-SFHVURJKSA-N	0	3	340.448	3.129	20	30		EGEDHN
CSC1c2cc(-c3noc(-c4cccc(C#N)n4)n3)ccc2NC1=O	ZINC000589367215	460080318	/nfs/dbraw/zinc/08/03/18/460080318.db2.gz	UEIAXZZGDBUFIN-CQSZACIVSA-N	0	3	349.375	3.026	20	30		EGEDHN
N#Cc1cnc2c(F)ccc(F)c2c1N1CC[C@@H](N2CCCCC2)C1	ZINC000610277810	460104082	/nfs/dbraw/zinc/10/40/82/460104082.db2.gz	SWJSMZXKCOESSA-CQSZACIVSA-N	0	3	342.393	3.449	20	30		EGEDHN
C[C@H](CNC(=O)N[C@@H](C)c1cccc(C#N)c1)N1CCCC[C@H]1C	ZINC000610347629	460128186	/nfs/dbraw/zinc/12/81/86/460128186.db2.gz	XFGNRGZMXVDKKH-OAGGEKHMSA-N	0	3	328.460	3.181	20	30		EGEDHN
Cc1ccc([C@@H]2CCC[C@H]2N(C)CC(=O)N[C@](C)(C#N)C2CC2)cc1	ZINC000610370274	460138052	/nfs/dbraw/zinc/13/80/52/460138052.db2.gz	CQTFVQJFBRCBRW-QKNQBKEWSA-N	0	3	339.483	3.371	20	30		EGEDHN
CCOC(=O)c1sc(NC(=O)C(C)C(F)(F)F)c(C#N)c1C	ZINC000610387738	460139417	/nfs/dbraw/zinc/13/94/17/460139417.db2.gz	HJGVCEBLXRZTJC-SSDOTTSWSA-N	0	3	334.319	3.242	20	30		EGEDHN
CCN1CCC[C@H]1CNC(=O)N(Cc1ccc(C#N)cc1)CC(C)C	ZINC000610405503	460145627	/nfs/dbraw/zinc/14/56/27/460145627.db2.gz	PJGWITFFDFOTHO-IBGZPJMESA-N	0	3	342.487	3.210	20	30		EGEDHN
N#Cc1ccc2c(c1)CC[C@H]2NCc1ccc(C(=O)NC2CC2)cc1	ZINC000618741587	460151540	/nfs/dbraw/zinc/15/15/40/460151540.db2.gz	HEVMMDCWLZJVFG-HXUWFJFHSA-N	0	3	331.419	3.228	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)C(=O)NCC(C)(C)N1CCCCC1	ZINC000594212366	460154270	/nfs/dbraw/zinc/15/42/70/460154270.db2.gz	UNARBPKIRALYDE-INIZCTEOSA-N	0	3	327.472	3.118	20	30		EGEDHN
C=C[C@@H]1CCCCN1CCOc1ccc(OCC(=O)OCC)cc1	ZINC000618767555	460163716	/nfs/dbraw/zinc/16/37/16/460163716.db2.gz	ZURWUDZHYXJZDK-MRXNPFEDSA-N	0	3	333.428	3.048	20	30		EGEDHN
CN1CCC(N(C(=O)c2ccc(C#N)s2)c2ccccc2)CC1	ZINC000610519381	460172678	/nfs/dbraw/zinc/17/26/78/460172678.db2.gz	GYTFOEGADOYBSP-UHFFFAOYSA-N	0	3	325.437	3.361	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)C(=O)N[C@@H]1CCCN2CCCC[C@H]12	ZINC000594282880	460179449	/nfs/dbraw/zinc/17/94/49/460179449.db2.gz	AXENVRSOSUEPCM-ATZDWAIDSA-N	0	3	340.471	3.278	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CN(Cc1cccc(F)c1)C1CC1	ZINC000599265368	460209482	/nfs/dbraw/zinc/20/94/82/460209482.db2.gz	QQNAMPFCAYJMIV-IBGZPJMESA-N	0	3	340.398	3.102	20	30		EGEDHN
N#CCCCC[C@H](N)C(=O)Nc1ncc(Cc2ccccc2)s1	ZINC000594426382	460216361	/nfs/dbraw/zinc/21/63/61/460216361.db2.gz	QVGOPBBDOZVJBE-HNNXBMFYSA-N	0	3	328.441	3.084	20	30		EGEDHN
C[C@H](NC(=O)[C@@H](N)CCCCC#N)c1ccc(Br)cc1	ZINC000594431933	460216902	/nfs/dbraw/zinc/21/69/02/460216902.db2.gz	STCJXSQOWWXXRC-FZMZJTMJSA-N	0	3	338.249	3.038	20	30		EGEDHN
CC[C@H](C)[C@@H](NC(=O)[C@H](N)CCCCC#N)c1nc2ccccc2[nH]1	ZINC000594441169	460221160	/nfs/dbraw/zinc/22/11/60/460221160.db2.gz	OCMWIAYVZIRUBR-JJRVBVJISA-N	0	3	341.459	3.178	20	30		EGEDHN
CC[C@H](C)[C@@H](NC(=O)[C@@H](N)CCCCC#N)c1nc2ccccc2[nH]1	ZINC000594441168	460221645	/nfs/dbraw/zinc/22/16/45/460221645.db2.gz	OCMWIAYVZIRUBR-GRDNDAEWSA-N	0	3	341.459	3.178	20	30		EGEDHN
N#CCCCC[C@@H](N)C(=O)Nc1ccc2c(c1)ncn2-c1ccccc1	ZINC000594445820	460222970	/nfs/dbraw/zinc/22/29/70/460222970.db2.gz	KJTGIRXLNHALSM-QGZVFWFLSA-N	0	3	347.422	3.375	20	30		EGEDHN
Cc1ccc(CN2CC[C@H](NC(=O)Nc3cccc(CC#N)c3)C2)cc1	ZINC000603034670	460225081	/nfs/dbraw/zinc/22/50/81/460225081.db2.gz	YRUMYKLNPQVTSA-FQEVSTJZSA-N	0	3	348.450	3.457	20	30		EGEDHN
C[C@H](CC(=O)NCCc1ccccc1)N[C@H](C)c1cccc(C#N)c1	ZINC000610830492	460245262	/nfs/dbraw/zinc/24/52/62/460245262.db2.gz	XCSKOGISLUXLHF-IAGOWNOFSA-N	0	3	335.451	3.346	20	30		EGEDHN
CCN(C(=O)Nc1ccnc(C#N)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000603135603	460250915	/nfs/dbraw/zinc/25/09/15/460250915.db2.gz	RHDAGBQQHQQBRW-LJQANCHMSA-N	0	3	349.438	3.082	20	30		EGEDHN
N#CCc1ccc(CN[C@H](Cc2ccccc2)[C@H](O)C(F)(F)F)cc1	ZINC000603146457	460253956	/nfs/dbraw/zinc/25/39/56/460253956.db2.gz	SGJDDOFSRMZWFJ-MSOLQXFVSA-N	0	3	348.368	3.377	20	30		EGEDHN
CCC(C#N)(CC)C(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000599454969	460257144	/nfs/dbraw/zinc/25/71/44/460257144.db2.gz	DUOCRXOHGMCZLS-UHFFFAOYSA-N	0	3	337.533	3.184	20	30		EGEDHN
N#Cc1ccccc1N1CCCN(Cc2[nH]nc3ccccc32)CC1	ZINC000611259096	460320574	/nfs/dbraw/zinc/32/05/74/460320574.db2.gz	MXXWBRGECZNIKK-UHFFFAOYSA-N	0	3	331.423	3.147	20	30		EGEDHN
C[C@]1(c2ccccc2)C[C@@H]1NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000619292040	460322987	/nfs/dbraw/zinc/32/29/87/460322987.db2.gz	PVNTXHLMEXSDSJ-HFSMHLIXSA-N	0	3	329.403	3.087	20	30		EGEDHN
CC[C@@H]1CCCCN1CCNC(=O)Nc1cc(OC)c(C#N)cc1F	ZINC000599818302	460340953	/nfs/dbraw/zinc/34/09/53/460340953.db2.gz	WMPKWXPBRWRJJI-CQSZACIVSA-N	0	3	348.422	3.092	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2N[C@H]1CCN(C2CCCCC2)C1=O	ZINC000611394567	460354547	/nfs/dbraw/zinc/35/45/47/460354547.db2.gz	QEJRVFQREGNRSZ-PMACEKPBSA-N	0	3	337.467	3.459	20	30		EGEDHN
N#Cc1c(NC(=O)CCN2CC=CCC2)sc2c1CCCCC2	ZINC000611517532	460384578	/nfs/dbraw/zinc/38/45/78/460384578.db2.gz	MINFEIQOIHPUQQ-UHFFFAOYSA-N	0	3	329.469	3.479	20	30		EGEDHN
COc1ccccc1OCCCNCc1ccc(C#N)c(OC)c1	ZINC000619652612	460403602	/nfs/dbraw/zinc/40/36/02/460403602.db2.gz	PHEQDIQWKOBALT-UHFFFAOYSA-N	0	3	326.396	3.134	20	30		EGEDHN
CC(C#N)C(=O)N1CC[C@@H](Sc2ccc(Br)cc2)C1	ZINC000600216150	460446211	/nfs/dbraw/zinc/44/62/11/460446211.db2.gz	VTVJTUUMYIFILY-ZWNOBZJWSA-N	0	3	339.258	3.302	20	30		EGEDHN
C[C@H](CC(=O)N1CCCCCC1)NCc1ccc(C#N)c(Cl)c1	ZINC000619755630	460432226	/nfs/dbraw/zinc/43/22/26/460432226.db2.gz	NWLXDLYKVUFPEX-CQSZACIVSA-N	0	3	333.863	3.482	20	30		EGEDHN
C[C@H](CNC(=O)NCc1ccc(C#N)c(Cl)c1)N1CCC[C@H](C)C1	ZINC000619757460	460434009	/nfs/dbraw/zinc/43/40/09/460434009.db2.gz	BQKQULGFUJOZDG-UONOGXRCSA-N	0	3	348.878	3.131	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN(CCc1ccc(F)cc1)CC(C)C	ZINC000604493556	460435134	/nfs/dbraw/zinc/43/51/34/460435134.db2.gz	GWMZTLQNOPVLNR-KRWDZBQOSA-N	0	3	347.478	3.334	20	30		EGEDHN
CC1(C)CCCN(CCNC(=O)NCc2ccc(C#N)c(Cl)c2)C1	ZINC000619826477	460451414	/nfs/dbraw/zinc/45/14/14/460451414.db2.gz	YBXMVOAKHMYHFM-UHFFFAOYSA-N	0	3	348.878	3.133	20	30		EGEDHN
N#CCc1ccc(CN2CCC[C@@H](c3nnc4n3CCCCC4)C2)cc1	ZINC000612059114	460523765	/nfs/dbraw/zinc/52/37/65/460523765.db2.gz	SIGJCCIRUUCVEA-LJQANCHMSA-N	0	3	349.482	3.450	20	30		EGEDHN
CN(Cc1ccc(CC#N)cc1)Cc1ccc(C(=O)NC2CC2)cc1	ZINC000612093869	460537591	/nfs/dbraw/zinc/53/75/91/460537591.db2.gz	GQNCXNHDVOUXBG-UHFFFAOYSA-N	0	3	333.435	3.277	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccccc1CC#N	ZINC000601447105	460813394	/nfs/dbraw/zinc/81/33/94/460813394.db2.gz	HIZYMCMXAAHSED-JXFKEZNVSA-N	0	3	333.435	3.003	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN1CCC[C@@H](C(=O)c2ccc(F)cc2)C1	ZINC000621258662	460964621	/nfs/dbraw/zinc/96/46/21/460964621.db2.gz	UREYTFWIHNTFRI-WBVHZDCISA-N	0	3	332.419	3.021	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN(C[C@H](C)O)C2CC2)cc1OC	ZINC000628328299	461089646	/nfs/dbraw/zinc/08/96/46/461089646.db2.gz	KGGULBKBCPZXNY-LBPRGKRZSA-N	0	3	325.836	3.259	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccc3[nH]c(=O)n(C(C)C)c3c2)nc(C)n1	ZINC000659025150	461147176	/nfs/dbraw/zinc/14/71/76/461147176.db2.gz	OFUCPTXSJMFWRH-CQSZACIVSA-N	0	3	349.394	3.220	20	30		EGEDHN
N#CC(C(=O)c1ccc2cccnc2c1)c1nnc2n1CCCCC2	ZINC000633900277	461320297	/nfs/dbraw/zinc/32/02/97/461320297.db2.gz	ORXDBPLRDOFLIQ-OAHLLOKOSA-N	0	3	331.379	3.043	20	30		EGEDHN
CC#CC[C@@H](CO)NCc1cc2ccccc2nc1N1CCCCC1	ZINC000641769045	461361259	/nfs/dbraw/zinc/36/12/59/461361259.db2.gz	OPNJOXKFZWUEPH-IBGZPJMESA-N	0	3	337.467	3.089	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)c2ccc3c(c2)CCCC(=O)N3)n1	ZINC000642281947	461484938	/nfs/dbraw/zinc/48/49/38/461484938.db2.gz	UGBSONSMWVMEKT-ZDUSSCGKSA-N	0	3	325.393	3.216	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@]2(c3ccccc3)CC2(C)C)CC1	ZINC000664020396	461916335	/nfs/dbraw/zinc/91/63/35/461916335.db2.gz	SARILXYGIZMXIK-HXUWFJFHSA-N	0	3	327.472	3.261	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCC2(c3ccccc3F)CCC2)CC1	ZINC000650852486	461983477	/nfs/dbraw/zinc/98/34/77/461983477.db2.gz	GFEQDWJKCXKDJD-UHFFFAOYSA-N	0	3	345.462	3.197	20	30		EGEDHN
C=CC[C@@H]1CCCN(CC(=O)N2CCO[C@@H](c3ccc(F)cc3)C2)C1	ZINC000661381280	462224862	/nfs/dbraw/zinc/22/48/62/462224862.db2.gz	ZBQBQXAFWXHUOT-VQIMIIECSA-N	0	3	346.446	3.014	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H]2CCCc3ccc(OC)cc32)CC1	ZINC000654750017	462370675	/nfs/dbraw/zinc/37/06/75/462370675.db2.gz	XJSXJYBXNCNLEE-LJQANCHMSA-N	0	3	342.483	3.272	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cccc(SCCC)n2)CC1	ZINC000640395322	462387749	/nfs/dbraw/zinc/38/77/49/462387749.db2.gz	GWXUQLPSMMZEKQ-UHFFFAOYSA-N	0	3	334.489	3.356	20	30		EGEDHN
C=CCC1(NCC(=O)Nc2ccc(Br)cn2)CCCC1	ZINC000661866726	462446348	/nfs/dbraw/zinc/44/63/48/462446348.db2.gz	UOQQXYXOWHEVCU-UHFFFAOYSA-N	0	3	338.249	3.261	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1N[C@H](CC)c1cc(OC)c(OC)c(OC)c1	ZINC000652204972	462471702	/nfs/dbraw/zinc/47/17/02/462471702.db2.gz	IUCOBWQDTHDWRL-OAGGEKHMSA-N	0	3	335.444	3.487	20	30		EGEDHN
C[C@H](NCCNc1nccc(C(F)(F)F)n1)c1ccc(C#N)cc1	ZINC000181777747	533858682	/nfs/dbraw/zinc/85/86/82/533858682.db2.gz	JMVVTKIEVVSEMD-NSHDSACASA-N	0	3	335.333	3.130	20	30		EGEDHN
C[C@H](CN(C)CCC(=O)Nc1ccccc1C#N)c1nccs1	ZINC000184013751	534019831	/nfs/dbraw/zinc/01/98/31/534019831.db2.gz	MQWWZVCMGVVNDN-CYBMUJFWSA-N	0	3	328.441	3.079	20	30		EGEDHN
C=CCN1CCC(NC(=O)CCCOc2ccc(C)c(C)c2)CC1	ZINC000174200451	526421260	/nfs/dbraw/zinc/42/12/60/526421260.db2.gz	UCZIOWPFBZIQAA-UHFFFAOYSA-N	0	3	330.472	3.229	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCc2ccccc2OCC(C)C)CC1	ZINC000171721584	526434903	/nfs/dbraw/zinc/43/49/03/526434903.db2.gz	CUDWNGVKWXIJJN-UHFFFAOYSA-N	0	3	345.487	3.171	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCc2oc3ccc(F)cc3c2C)CC1	ZINC000171725450	526437824	/nfs/dbraw/zinc/43/78/24/526437824.db2.gz	IYDLUMUUMPZRJU-UHFFFAOYSA-N	0	3	345.418	3.330	20	30		EGEDHN
CCOC(=O)[C@@](C)(CNCc1ccc(C#N)s1)c1ccccc1	ZINC000191632679	527917679	/nfs/dbraw/zinc/91/76/79/527917679.db2.gz	KSXMGPRJRKRIJP-SFHVURJKSA-N	0	3	328.437	3.230	20	30		EGEDHN
COc1ccc([C@@H](NCC(=O)Nc2cccc(C#N)c2)C2CC2)cc1	ZINC000193343693	536890141	/nfs/dbraw/zinc/89/01/41/536890141.db2.gz	IEEQKTPEHVJBCM-FQEVSTJZSA-N	0	3	335.407	3.246	20	30		EGEDHN
C=CCc1cc(CN(CCO)CCc2ccccc2)cc(OC)c1O	ZINC000093389625	546684902	/nfs/dbraw/zinc/68/49/02/546684902.db2.gz	XLEQZRDWHOOYBX-UHFFFAOYSA-N	0	3	341.451	3.166	20	30		EGEDHN
COc1ccccc1[C@@H](CNCc1ccc(C#N)c(F)c1)N(C)C	ZINC000421335801	547879336	/nfs/dbraw/zinc/87/93/36/547879336.db2.gz	UOTOYJLLTSWHGJ-GOSISDBHSA-N	0	3	327.403	3.098	20	30		EGEDHN
CCN1CCC(N(C)C(=S)Nc2ccc(C#N)c(Cl)c2)CC1	ZINC000726455251	574556234	/nfs/dbraw/zinc/55/62/34/574556234.db2.gz	KQEGBOYJISAGEQ-UHFFFAOYSA-N	0	3	336.892	3.325	20	30		EGEDHN
C#Cc1ccc(C(=O)N(CC)[C@H]2CCN([C@@H](C)c3ccccc3)C2)cn1	ZINC000728861213	574779795	/nfs/dbraw/zinc/77/97/95/574779795.db2.gz	IONNYDCRAMEPFI-UWJYYQICSA-N	0	3	347.462	3.361	20	30		EGEDHN
CCCCNC(=O)[C@@H]1CC[C@@H](C)N(Cc2ccc(OCC#N)cc2)C1	ZINC000729268187	574834357	/nfs/dbraw/zinc/83/43/57/574834357.db2.gz	PPPXQBHMJLNGGK-SJLPKXTDSA-N	0	3	343.471	3.106	20	30		EGEDHN
N#CC(C(=O)CCCn1cccn1)c1nc2ccccc2n1C(F)F	ZINC000729892187	574894297	/nfs/dbraw/zinc/89/42/97/574894297.db2.gz	TXRYOVMVYUXLLJ-LBPRGKRZSA-N	0	3	343.337	3.285	20	30		EGEDHN
C#CCOc1cccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000731112228	575055342	/nfs/dbraw/zinc/05/53/42/575055342.db2.gz	BOQDMFXBDDYHBD-LJQANCHMSA-N	0	3	349.434	3.095	20	30		EGEDHN
C#CCOc1cccc(NC(=O)NCCN2CCCC[C@H]2CC)c1	ZINC000733634619	575376072	/nfs/dbraw/zinc/37/60/72/575376072.db2.gz	UHLSONKOYUJRKE-QGZVFWFLSA-N	0	3	329.444	3.085	20	30		EGEDHN
CCN(CC(=O)/C=C1\N(C)c2ccccc2C1(C)C)C[C@@H]1CCOC1	ZINC000734149457	575443073	/nfs/dbraw/zinc/44/30/73/575443073.db2.gz	NEKQMZXNQDGIEO-DEFALTHMSA-N	0	3	342.483	3.225	20	30		EGEDHN
C=CC[C@H](NC(=O)N[C@@H](C)CN1CCC[C@@H](C)C1)c1ccncc1	ZINC000734661783	575533429	/nfs/dbraw/zinc/53/34/29/575533429.db2.gz	QJKYHGINCKYMHW-RYRKJORJSA-N	0	3	330.476	3.118	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)cn1	ZINC000737680859	576260777	/nfs/dbraw/zinc/26/07/77/576260777.db2.gz	YIYCJUJJBCRDJK-LAUBAEHRSA-N	0	3	347.462	3.188	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2cc3c(s2)CC[C@@H](C)C3)CC1	ZINC000740737595	576621659	/nfs/dbraw/zinc/62/16/59/576621659.db2.gz	SDOKBNDOIMNUCY-CQSZACIVSA-N	0	3	330.497	3.090	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2csc(-c3ccccc3)n2)CC1	ZINC000740737119	576621831	/nfs/dbraw/zinc/62/18/31/576621831.db2.gz	BKTRWBJTNPKPCB-UHFFFAOYSA-N	0	3	339.464	3.028	20	30		EGEDHN
C#CCCN1CCC(NC(=O)[C@H](c2ccccc2)[C@@H](C)CC)CC1	ZINC000740737735	576622085	/nfs/dbraw/zinc/62/20/85/576622085.db2.gz	UWDOUGDRVQBSFK-PXNSSMCTSA-N	0	3	326.484	3.420	20	30		EGEDHN
C=C(C)CN1CCC(NC(=S)N[C@@H]2CCOc3ccccc32)CC1	ZINC000741491895	576692036	/nfs/dbraw/zinc/69/20/36/576692036.db2.gz	WEDGNLYUDLDTKQ-QGZVFWFLSA-N	0	3	345.512	3.015	20	30		EGEDHN
COc1ccc(CNCc2ccccc2Cn2ccnc2)cc1C#N	ZINC000742366478	576773812	/nfs/dbraw/zinc/77/38/12/576773812.db2.gz	HCZHPLHZJHQSJC-UHFFFAOYSA-N	0	3	332.407	3.101	20	30		EGEDHN
COc1ccc(CN[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cc1C#N	ZINC000742370380	576774703	/nfs/dbraw/zinc/77/47/03/576774703.db2.gz	PKKFNVNTDKQARQ-OXJNMPFZSA-N	0	3	335.451	3.492	20	30		EGEDHN
Cc1ccc([C@@H](C)C(=O)N(CCN(C)C)Cc2cccc(C#N)c2)o1	ZINC000742593172	576791226	/nfs/dbraw/zinc/79/12/26/576791226.db2.gz	LVXKFRPAQYOANL-MRXNPFEDSA-N	0	3	339.439	3.154	20	30		EGEDHN
C=C(C)CNC(=S)N(CC)C[C@@H]1CCN(Cc2ccccc2)C1	ZINC000743061693	576800886	/nfs/dbraw/zinc/80/08/86/576800886.db2.gz	RFNFMHPMDSLYPR-GOSISDBHSA-N	0	3	331.529	3.281	20	30		EGEDHN
C=CCN(CCc1ccccc1)C(=S)NC[C@H]1CCCN1CC	ZINC000743584797	576812658	/nfs/dbraw/zinc/81/26/58/576812658.db2.gz	KZZCVCGMKZCGSL-GOSISDBHSA-N	0	3	331.529	3.076	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)Cc2cc(F)ccc2F)cc1	ZINC000744027697	576819062	/nfs/dbraw/zinc/81/90/62/576819062.db2.gz	BJKYYRSBNKYIPX-INIZCTEOSA-N	0	3	342.345	3.417	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1)C(=O)[C@@H]1C[C@@]12CCc1ccccc12	ZINC000744028513	576819120	/nfs/dbraw/zinc/81/91/20/576819120.db2.gz	JCWVIUCPMTYIJP-DJPFJPOOSA-N	0	3	330.387	3.238	20	30		EGEDHN
CCN(CC)CCN1c2ccccc2C(=NNc2ccccc2)C1=O	ZINC000744535923	576830784	/nfs/dbraw/zinc/83/07/84/576830784.db2.gz	WRHNHZLLGSXOLW-UHFFFAOYSA-N	0	3	336.439	3.191	20	30		EGEDHN
C=CCSCCNC(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000745018997	576838630	/nfs/dbraw/zinc/83/86/30/576838630.db2.gz	ILMKRUDPYZSMMG-UHFFFAOYSA-N	0	3	349.569	3.034	20	30		EGEDHN
CC(C)[N@H+](Cc1cc(-c2nnn[n-]2)cs1)Cc1ccc(C#N)cc1	ZINC000824293483	608531068	/nfs/dbraw/zinc/53/10/68/608531068.db2.gz	NSBXWOMTXDZQIF-UHFFFAOYSA-N	0	3	338.440	3.210	20	30		EGEDHN
CC(C)[N@@H+](Cc1cc(-c2nnn[n-]2)cs1)Cc1ccc(C#N)cc1	ZINC000824293483	608531069	/nfs/dbraw/zinc/53/10/69/608531069.db2.gz	NSBXWOMTXDZQIF-UHFFFAOYSA-N	0	3	338.440	3.210	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)CCSc1ccccc1F	ZINC000069912142	1292253588	/nfs/dbraw/zinc/25/35/88/1292253588.db2.gz	LOOGQZXMJIVCID-ZDUSSCGKSA-N	0	3	336.432	3.323	20	30		EGEDHN
C[C@H](NC[C@@H]1CN(C2CCCCC2)C(=O)O1)c1ccc(C#N)cc1	ZINC000828148538	1292437301	/nfs/dbraw/zinc/43/73/01/1292437301.db2.gz	ZCLWNIPNJTUOMG-KBXCAEBGSA-N	0	3	327.428	3.362	20	30		EGEDHN
C[C@@H](NC[C@@H]1CN(C2CCCCC2)C(=O)O1)c1cccc(C#N)c1	ZINC000828155455	1292437414	/nfs/dbraw/zinc/43/74/14/1292437414.db2.gz	NIRXBPJCVPDFCI-RDTXWAMCSA-N	0	3	327.428	3.362	20	30		EGEDHN
C[C@H](NCc1ccc(CC#N)cc1)c1ccc(N2CCNC2=O)cc1	ZINC000829751154	1292614413	/nfs/dbraw/zinc/61/44/13/1292614413.db2.gz	HGIVXIZDZOLKLD-HNNXBMFYSA-N	0	3	334.423	3.133	20	30		EGEDHN
CS[C@@H](C)C(=O)C(C#N)C(=O)Nc1ccc(SC(F)F)cc1	ZINC000103329902	1293002543	/nfs/dbraw/zinc/00/25/43/1293002543.db2.gz	XBTJZMNPMUOPII-KWQFWETISA-N	0	3	344.408	3.400	20	30		EGEDHN
N#CC(C(=O)C[C@@H]1CCCCO1)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000120071091	1293302819	/nfs/dbraw/zinc/30/28/19/1293302819.db2.gz	PVPMLAGPRFDYST-NWDGAFQWSA-N	0	3	338.766	3.086	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)C(=O)NC1CC1)c1cccc(C(F)(F)F)c1	ZINC000121738668	1293386310	/nfs/dbraw/zinc/38/63/10/1293386310.db2.gz	AABXYRXAOORBQE-IINYFYTJSA-N	0	3	338.329	3.186	20	30		EGEDHN
Cc1ccc(C(C)C)c(O[C@H](C)C(=O)C(C#N)C(=O)N2CCCC2)c1	ZINC000124815813	1293486102	/nfs/dbraw/zinc/48/61/02/1293486102.db2.gz	XBFJAJVLDVUBTC-WBVHZDCISA-N	0	3	342.439	3.217	20	30		EGEDHN
COc1cc(CN(C)Cc2ccc(O[C@@H](C)C#N)cc2)ccc1O	ZINC000125963111	1293520976	/nfs/dbraw/zinc/52/09/76/1293520976.db2.gz	GRPMHYAIKSZHRZ-AWEZNQCLSA-N	0	3	326.396	3.324	20	30		EGEDHN
CN(CCNC1CC(C#N)(c2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000126624357	1293539494	/nfs/dbraw/zinc/53/94/94/1293539494.db2.gz	KXQMJBRBKVUQLL-UHFFFAOYSA-N	0	3	329.444	3.067	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/[C@H]2CCN(CC(F)(F)F)C2)c([O-])c1	ZINC000126705083	1293541456	/nfs/dbraw/zinc/54/14/56/1293541456.db2.gz	LEZKQEHEMUSDDZ-MNUWJXFPSA-N	0	3	343.393	3.294	20	30		EGEDHN
CC1(C)CN(C[C@H](O)c2ccc(C#N)cc2)CCN1Cc1ccccc1	ZINC000127412683	1293562582	/nfs/dbraw/zinc/56/25/82/1293562582.db2.gz	AXWDVTHDPXIBOX-NRFANRHFSA-N	0	3	349.478	3.188	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)COC1CCCCC1	ZINC000129032035	1293611728	/nfs/dbraw/zinc/61/17/28/1293611728.db2.gz	GYUFKOLDEZWICG-HNNXBMFYSA-N	0	3	344.411	3.082	20	30		EGEDHN
CN1CCN(c2ccc(NC3CC(C#N)(c4ccccc4)C3)cc2)CC1	ZINC000129206734	1293617603	/nfs/dbraw/zinc/61/76/03/1293617603.db2.gz	XOIUBQGKYHRFMA-UHFFFAOYSA-N	0	3	346.478	3.474	20	30		EGEDHN
C[C@H](Oc1ccc(F)c(F)c1)C(=O)C(C#N)C(=O)Nc1ccccc1	ZINC000129858107	1293636954	/nfs/dbraw/zinc/63/69/54/1293636954.db2.gz	WEBOTVMKJMFSID-SMDDNHRTSA-N	0	3	344.317	3.080	20	30		EGEDHN
N#CC(C(=O)CCc1cc(Cl)cs1)C(=O)Nc1ccccn1	ZINC000131069040	1293678345	/nfs/dbraw/zinc/67/83/45/1293678345.db2.gz	GREKTXDLXUYBSJ-GFCCVEGCSA-N	0	3	333.800	3.077	20	30		EGEDHN
C=C(Br)CN[C@](C)(CNC(=O)OC(C)(C)C)C1CC1	ZINC000133266902	1293740414	/nfs/dbraw/zinc/74/04/14/1293740414.db2.gz	JPYQWFBXZJZZAQ-CQSZACIVSA-N	0	3	333.270	3.178	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CNC(C)(C)C(=O)NCC2CCCC2)cc1	ZINC000136033974	1293807194	/nfs/dbraw/zinc/80/71/94/1293807194.db2.gz	VTQFBFSWEGLMLG-HNNXBMFYSA-N	0	3	343.471	3.152	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)C[C@@H](C)SC)cc1Cl	ZINC000156353579	1294139382	/nfs/dbraw/zinc/13/93/82/1294139382.db2.gz	MSFUIMHQGUJPEQ-MWLCHTKSSA-N	0	3	340.832	3.138	20	30		EGEDHN
CC[C@H](SC)C(=O)C(C#N)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000156512352	1294147162	/nfs/dbraw/zinc/14/71/62/1294147162.db2.gz	RJXLGYXZWXUOKA-SKDRFNHKSA-N	0	3	328.796	3.268	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)CCc1cccc(F)c1F	ZINC000159728463	1294244880	/nfs/dbraw/zinc/24/48/80/1294244880.db2.gz	IZQKILAGOSUHFW-AWEZNQCLSA-N	0	3	336.382	3.303	20	30		EGEDHN
N#CC(C(=O)CCc1nnc(C2CCCC2)o1)c1nc2ccccc2[nH]1	ZINC000161177593	1294286968	/nfs/dbraw/zinc/28/69/68/1294286968.db2.gz	DILGZHSODDFEJH-CYBMUJFWSA-N	0	3	349.394	3.413	20	30		EGEDHN
Cc1cccc2c(CCC(=O)C(C#N)C(=O)Nc3ccccn3)c[nH]c21	ZINC000174012735	1294477095	/nfs/dbraw/zinc/47/70/95/1294477095.db2.gz	YEXVVUDSDFWHSU-MRXNPFEDSA-N	0	3	346.390	3.152	20	30		EGEDHN
COc1ccc(CNCc2ccccc2Cn2cccn2)cc1C#N	ZINC000174252299	1294489906	/nfs/dbraw/zinc/48/99/06/1294489906.db2.gz	BCBQCZPOTVKBLY-UHFFFAOYSA-N	0	3	332.407	3.101	20	30		EGEDHN
C[C@H](C(=O)C(C#N)C(=O)Nc1ccccn1)c1ccc(Cl)s1	ZINC000175121525	1294540642	/nfs/dbraw/zinc/54/06/42/1294540642.db2.gz	JQENCPVMQIQJCX-VHSXEESVSA-N	0	3	333.800	3.248	20	30		EGEDHN
C[C@@H](CCc1ccc(F)cc1)C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000870162504	1295713038	/nfs/dbraw/zinc/71/30/38/1295713038.db2.gz	IVOBSVRNTFTXNV-XJKSGUPXSA-N	0	3	339.370	3.137	20	30		EGEDHN
N#CC(C(=O)Cc1c(F)cccc1Cl)C(=O)Nc1ccccc1	ZINC000193441079	1295868150	/nfs/dbraw/zinc/86/81/50/1295868150.db2.gz	IAQKWZUOEUOYKV-CYBMUJFWSA-N	0	3	330.746	3.369	20	30		EGEDHN
C[C@H](NCc1ccc(OCC#N)cc1)c1ccc(-n2cncn2)cc1	ZINC000194889592	1296018494	/nfs/dbraw/zinc/01/84/94/1296018494.db2.gz	ZDPHCVSZHXHUMC-HNNXBMFYSA-N	0	3	333.395	3.020	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)s1	ZINC000226265189	1296138710	/nfs/dbraw/zinc/13/87/10/1296138710.db2.gz	AVPKKCWUFOXUJX-CYBMUJFWSA-N	0	3	335.473	3.499	20	30		EGEDHN
CCCC(=O)NC[C@H]1CCCN(Cc2ccc(O[C@H](C)C#N)cc2)C1	ZINC000245564731	1296314979	/nfs/dbraw/zinc/31/49/79/1296314979.db2.gz	QVHWOSDGPHQIBL-SJLPKXTDSA-N	0	3	343.471	3.106	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)CC[C@H]1CC[C@@H](C)O1	ZINC000246528509	1296359108	/nfs/dbraw/zinc/35/91/08/1296359108.db2.gz	IMEPSPWGLMLFDL-RBSFLKMASA-N	0	3	344.411	3.080	20	30		EGEDHN
N#CC(C(=O)NC1CCCC1)C(=O)[C@H]1C[C@]12CCCc1ccccc12	ZINC000246661443	1296365038	/nfs/dbraw/zinc/36/50/38/1296365038.db2.gz	XRUQTPWASHTFLC-CDXJDZJCSA-N	0	3	336.435	3.048	20	30		EGEDHN
N#Cc1ccccc1/C=C\C(=O)O[C@@H]1CCN(Cc2ccccc2)C1	ZINC000254942877	1296481945	/nfs/dbraw/zinc/48/19/45/1296481945.db2.gz	UHKPMSWXQCHSLK-JPMGXVIASA-N	0	3	332.403	3.389	20	30		EGEDHN
[O-]c1ccc(Cl)cc1/C=N\C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1	ZINC000255570137	1296549998	/nfs/dbraw/zinc/54/99/98/1296549998.db2.gz	NGRDOGPAGWDGPI-WWBTZOKRSA-N	0	3	336.863	3.232	20	30		EGEDHN
C[C@@H](NC1CC(C#N)(c2ccccc2)C1)c1ccc2[nH]c(=O)[nH]c2c1	ZINC000327230448	1297246442	/nfs/dbraw/zinc/24/64/42/1297246442.db2.gz	KTRLBKDISZATFN-CETSPDHXSA-N	0	3	332.407	3.131	20	30		EGEDHN
Cc1nc(C#N)cc(N2C[C@H](C)N(Cc3ccccc3)[C@@H](C)[C@H]2C)n1	ZINC000404416491	1297750990	/nfs/dbraw/zinc/75/09/90/1297750990.db2.gz	GOYXQKLVIHDMDB-HRCADAONSA-N	0	3	335.455	3.144	20	30		EGEDHN
N#Cc1ccc(N2CCN(Cc3cccc4cccnc43)CC2)cc1	ZINC000874242586	1297828224	/nfs/dbraw/zinc/82/82/24/1297828224.db2.gz	WGLVSRAFMHTZIN-UHFFFAOYSA-N	0	3	328.419	3.429	20	30		EGEDHN
Cc1nnc(N2CCN(Cc3ccccc3)[C@@H](C(C)C)C2)c(C#N)c1C	ZINC000704716455	1298206291	/nfs/dbraw/zinc/20/62/91/1298206291.db2.gz	GAIREOGLAQZONP-HXUWFJFHSA-N	0	3	349.482	3.312	20	30		EGEDHN
CN(C)[C@H](C/N=C\c1ccc(O)c(O)c1O)c1ccc(Cl)cc1	ZINC000746815355	1298664164	/nfs/dbraw/zinc/66/41/64/1298664164.db2.gz	HRLGXEJHVZJFSK-NGMPYOPUSA-N	0	3	334.803	3.179	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](O)c2ccccc2C(F)(F)F)s1	ZINC000749110312	1299143534	/nfs/dbraw/zinc/14/35/34/1299143534.db2.gz	DABWIIXUEHEMBL-AWEZNQCLSA-N	0	3	326.343	3.462	20	30		EGEDHN
C#CCCOc1ccc(CN2CC[C@@H](OCc3ccccn3)C2)cc1	ZINC000877645680	1299452970	/nfs/dbraw/zinc/45/29/70/1299452970.db2.gz	SBZLNWQVQNNUTG-OAQYLSRUSA-N	0	3	336.435	3.275	20	30		EGEDHN
C[C@@H](NCC(=O)N(CCC#N)CCC#N)c1csc2ccccc21	ZINC000754737116	1300206342	/nfs/dbraw/zinc/20/63/42/1300206342.db2.gz	MUUVLRCKSROKOH-CQSZACIVSA-N	0	3	340.452	3.208	20	30		EGEDHN
CN(C1CCCC1)C(C)(C)C(=O)OCCOc1ccccc1C#N	ZINC000754873912	1300236388	/nfs/dbraw/zinc/23/63/88/1300236388.db2.gz	XCHWFTWVSHZYJK-UHFFFAOYSA-N	0	3	330.428	3.133	20	30		EGEDHN
C=CCOCCN1CCC(c2nc(C)c(C(=O)OCC)s2)CC1	ZINC000879676860	1300671102	/nfs/dbraw/zinc/67/11/02/1300671102.db2.gz	GDOYIKKMBXHTDP-UHFFFAOYSA-N	0	3	338.473	3.010	20	30		EGEDHN
COCCN(CC#Cc1ccc(C(F)(F)F)cc1)C1CCOCC1	ZINC000879707845	1300689547	/nfs/dbraw/zinc/68/95/47/1300689547.db2.gz	GUOJZTMILRXMPE-UHFFFAOYSA-N	0	3	341.373	3.184	20	30		EGEDHN
CCN(C(=O)C#Cc1ccccc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000760655269	1301315953	/nfs/dbraw/zinc/31/59/53/1301315953.db2.gz	QTVWBKKVPFUPEE-OAQYLSRUSA-N	0	3	332.447	3.161	20	30		EGEDHN
CCO[C@@H](CC(=O)C(C#N)C(=O)Nc1ccc(CC)cc1)C(C)C	ZINC000761037757	1301385868	/nfs/dbraw/zinc/38/58/68/1301385868.db2.gz	OEJKJQZQGXRHEU-WMZOPIPTSA-N	0	3	330.428	3.348	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN[C@H]2CCCOc3ccc(F)cc32)cc1	ZINC000763236746	1301853952	/nfs/dbraw/zinc/85/39/52/1301853952.db2.gz	SOROIYZXUWLJCZ-ROUUACIJSA-N	0	3	326.371	3.234	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN[C@H]2CCOc3c(Cl)cccc32)cc1	ZINC000763235199	1301854417	/nfs/dbraw/zinc/85/44/17/1301854417.db2.gz	JMSDTQDKFHFWBN-DLBZAZTESA-N	0	3	328.799	3.358	20	30		EGEDHN
Cc1ccc(N(CCC#N)C(=O)CN2CC[C@@H](C3CC3)C2)cc1C	ZINC000764484712	1302070458	/nfs/dbraw/zinc/07/04/58/1302070458.db2.gz	MUMULIVKVOUHLD-GOSISDBHSA-N	0	3	325.456	3.282	20	30		EGEDHN
C=CCOc1cccc(NC(=O)NC[C@H]2CCCCN2C2CC2)c1	ZINC000765665959	1302300003	/nfs/dbraw/zinc/30/00/03/1302300003.db2.gz	FGYASVSKNMXQRK-QGZVFWFLSA-N	0	3	329.444	3.390	20	30		EGEDHN
C#CCCCN1CCN(Cc2csc(-c3ccc(F)cc3)n2)CC1	ZINC000766918420	1302545858	/nfs/dbraw/zinc/54/58/58/1302545858.db2.gz	LFCHDCLLNJIPAG-UHFFFAOYSA-N	0	3	343.471	3.480	20	30		EGEDHN
Cc1cccc([C@H](NC(=O)C2CC3(C2)CNC[C@H]3C#N)C(C)(C)C)c1	ZINC000884159690	1302758688	/nfs/dbraw/zinc/75/86/88/1302758688.db2.gz	KLWRLUQBPPSMIJ-IOBOIYPZSA-N	0	3	339.483	3.338	20	30		EGEDHN
C=CCN(Cc1cc2ccccc2nc1N1CCOCC1)C(C)C	ZINC000768548146	1302931500	/nfs/dbraw/zinc/93/15/00/1302931500.db2.gz	WXARJWDAAYOKMG-UHFFFAOYSA-N	0	3	325.456	3.468	20	30		EGEDHN
C#CCOc1ccc(CN(C)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000769334344	1303094745	/nfs/dbraw/zinc/09/47/45/1303094745.db2.gz	NLLWRHWTIUEDAB-QGZVFWFLSA-N	0	3	344.455	3.140	20	30		EGEDHN
C#CCCOc1ccc(CN2CCC(N(C)CC(F)F)CC2)cc1	ZINC000769508204	1303130963	/nfs/dbraw/zinc/13/09/63/1303130963.db2.gz	FNBFNXABNVDVDR-UHFFFAOYSA-N	0	3	336.426	3.250	20	30		EGEDHN
C=CC[C@@H](CO)CNCc1c(C)nn(Cc2ccccc2)c1Cl	ZINC000774825519	1303863574	/nfs/dbraw/zinc/86/35/74/1303863574.db2.gz	DCNONKGJPUNKFL-MRXNPFEDSA-N	0	3	333.863	3.167	20	30		EGEDHN
C=CCN(CCCNC(=O)OC(C)(C)C)Cc1cccc(C#N)c1	ZINC000774855956	1303868161	/nfs/dbraw/zinc/86/81/61/1303868161.db2.gz	CHBUKJJROVKPRS-UHFFFAOYSA-N	0	3	329.444	3.461	20	30		EGEDHN
C#CCN[C@@H](C(=O)N1CCC(Cc2ccccc2)CC1)[C@@H](C)CC	ZINC000775384128	1303952855	/nfs/dbraw/zinc/95/28/55/1303952855.db2.gz	CSTINESBQGQSEJ-FXAWDEMLSA-N	0	3	326.484	3.105	20	30		EGEDHN
CCCN(CCN1CCCCC1)C(=O)Nc1cc(C#N)ccc1F	ZINC000888367622	1304135820	/nfs/dbraw/zinc/13/58/20/1304135820.db2.gz	LSHBPCITOXSYEV-UHFFFAOYSA-N	0	3	332.423	3.427	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CNCCCNc1ccccn1	ZINC000778177144	1304410762	/nfs/dbraw/zinc/41/07/62/1304410762.db2.gz	PBGFZLFMPGFOJV-UHFFFAOYSA-N	0	3	329.831	3.339	20	30		EGEDHN
C[C@H]1CCN(C(=O)Nc2ccc(C#N)cn2)CCN1Cc1ccccc1	ZINC000889226870	1304418795	/nfs/dbraw/zinc/41/87/95/1304418795.db2.gz	RLYDRUBMSBKDBL-INIZCTEOSA-N	0	3	349.438	3.082	20	30		EGEDHN
N#CC(C(=O)Nc1ccccn1)C(=O)c1cc2cccc(Cl)c2o1	ZINC000783069762	1305043925	/nfs/dbraw/zinc/04/39/25/1305043925.db2.gz	NTCJIDIIKKKYNP-NSHDSACASA-N	0	3	339.738	3.442	20	30		EGEDHN
CC(C)(C)OC(=O)NCc1ccc(CN2CCC(C#N)CC2)cc1	ZINC000891852982	1305187572	/nfs/dbraw/zinc/18/75/72/1305187572.db2.gz	YEEHITPLONAZLM-UHFFFAOYSA-N	0	3	329.444	3.447	20	30		EGEDHN
Cc1ccc(N2CCN(CCC(=O)Nc3cccc(C#N)c3)CC2)cc1	ZINC000784391110	1305240363	/nfs/dbraw/zinc/24/03/63/1305240363.db2.gz	WMFYXDXGQJAOLU-UHFFFAOYSA-N	0	3	348.450	3.018	20	30		EGEDHN
C[C@@H](CN(Cc1ccc(C#N)cc1)C1CC1)NC(=O)OC(C)(C)C	ZINC000785445321	1305352163	/nfs/dbraw/zinc/35/21/63/1305352163.db2.gz	PTPTYNNYBFPPQB-AWEZNQCLSA-N	0	3	329.444	3.436	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1Cl)C(=O)[C@H]1CCOC2(CCC2)C1	ZINC000892489452	1305401101	/nfs/dbraw/zinc/40/11/01/1305401101.db2.gz	KIZINFJAEGWMNG-STQMWFEESA-N	0	3	346.814	3.337	20	30		EGEDHN
C=CC(C)(C)CC(=O)C(C#N)C(=O)Nc1ccc(C(=O)OCC)cc1	ZINC000892498423	1305408200	/nfs/dbraw/zinc/40/82/00/1305408200.db2.gz	IJVUTXNAAVOXCN-OAHLLOKOSA-N	0	3	342.395	3.113	20	30		EGEDHN
C[C@@H](N[C@@H](C)c1ccc(C#N)cc1)c1ccc(N2CCNC2=O)cc1	ZINC000786808807	1305633299	/nfs/dbraw/zinc/63/32/99/1305633299.db2.gz	FWCPIHQDXYLHJY-LSDHHAIUSA-N	0	3	334.423	3.500	20	30		EGEDHN
CC[C@@H](NC(=O)C(C#N)C(=O)CCc1nccs1)c1ccccc1	ZINC000787040478	1305681167	/nfs/dbraw/zinc/68/11/67/1305681167.db2.gz	LRGMUYLXPCANAC-HUUCEWRRSA-N	0	3	341.436	3.052	20	30		EGEDHN
COc1ccc(C(C)N=Nc2nccn2C)cc1CN1CCCCC1	ZINC000790300346	1306293202	/nfs/dbraw/zinc/29/32/02/1306293202.db2.gz	SMMGHGXTMBKLRL-UHFFFAOYSA-N	0	3	341.459	3.251	20	30		EGEDHN
N#CC(C(=O)Cc1cccc(C(F)F)c1)C(=O)NC1CCCCC1	ZINC000790766742	1308861665	/nfs/dbraw/zinc/86/16/65/1308861665.db2.gz	FCDRIUZIKMEBID-OAHLLOKOSA-N	0	3	334.366	3.324	20	30		EGEDHN
C=CCNC(=O)C(C#N)C(=O)[C@H](C)Oc1ccc(-c2ccccc2)cc1	ZINC000793124366	1309299155	/nfs/dbraw/zinc/29/91/55/1309299155.db2.gz	LEXSRZWRMMHJMT-KXBFYZLASA-N	0	3	348.402	3.132	20	30		EGEDHN
CC(N=Nc1ncncc1F)c1ccc([O-])c(C[NH+]2CCCCC2)c1	ZINC000793217862	1309320258	/nfs/dbraw/zinc/32/02/58/1309320258.db2.gz	MLKPBQUEJAOJTI-UHFFFAOYSA-N	0	3	343.406	3.143	20	30		EGEDHN
C#Cc1ccc(C(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)cc1	ZINC000895531430	1309386180	/nfs/dbraw/zinc/38/61/80/1309386180.db2.gz	HHLFPNDHOKFWQT-UHFFFAOYSA-N	0	3	347.462	3.371	20	30		EGEDHN
C=CCC1(O)CCN(Cc2cc(Br)cc(C)c2O)CC1	ZINC000895835184	1309546173	/nfs/dbraw/zinc/54/61/73/1309546173.db2.gz	BIWJWPGWXVARKJ-UHFFFAOYSA-N	0	3	340.261	3.366	20	30		EGEDHN
C=CCC1(O)CCN(Cc2cn(CC)nc2-c2ccccc2)CC1	ZINC000895826985	1309541659	/nfs/dbraw/zinc/54/16/59/1309541659.db2.gz	GVSFMKIUMKFFOO-UHFFFAOYSA-N	0	3	325.456	3.473	20	30		EGEDHN
N#CC(C(=O)CCc1cnc2ccccc2c1)C(=O)NC1CCCCC1	ZINC000796634156	1310052540	/nfs/dbraw/zinc/05/25/40/1310052540.db2.gz	RIVIVOVGQPTKOC-GOSISDBHSA-N	0	3	349.434	3.325	20	30		EGEDHN
C#CCN(CCC(=O)N1CCc2ccccc2C1)Cc1ccccc1	ZINC000796641786	1310053727	/nfs/dbraw/zinc/05/37/27/1310053727.db2.gz	RPUIEEIPIKEZIE-UHFFFAOYSA-N	0	3	332.447	3.097	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)OCC1CCN(Cc2ccco2)CC1	ZINC000797958165	1310274900	/nfs/dbraw/zinc/27/49/00/1310274900.db2.gz	WCHWHCKXGIOJBF-UHFFFAOYSA-N	0	3	328.368	3.122	20	30		EGEDHN
C#C[C@@H](NC(=O)NC[C@@H](c1cccc(OC)c1)N(CC)CC)C(C)C	ZINC000798510175	1310374681	/nfs/dbraw/zinc/37/46/81/1310374681.db2.gz	LSJHOUFFAYAVAQ-MOPGFXCFSA-N	0	3	345.487	3.035	20	30		EGEDHN
C#C[C@@H](NC(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1)C(C)C	ZINC000798553735	1310388827	/nfs/dbraw/zinc/38/88/27/1310388827.db2.gz	XQDMJYBCVQRGLD-RTBURBONSA-N	0	3	327.472	3.089	20	30		EGEDHN
C[C@H](C(=O)C(C#N)c1ncc(C(C)(C)C)s1)N(C)CC(F)(F)F	ZINC000798865004	1310451645	/nfs/dbraw/zinc/45/16/45/1310451645.db2.gz	QAESETOVXHSRFO-ZJUUUORDSA-N	0	3	347.406	3.499	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)C23CC4CC(CC(C4)C2)C3)C1	ZINC001023717499	1319851744	/nfs/dbraw/zinc/85/17/44/1319851744.db2.gz	GXBVXZKTALMQFR-HINLZNOGSA-N	0	3	328.500	3.054	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CCC(O)(Cc2ccccn2)CC1	ZINC000826679140	1320397634	/nfs/dbraw/zinc/39/76/34/1320397634.db2.gz	CZQVVOUWTSAGQF-UHFFFAOYSA-N	0	3	349.478	3.452	20	30		EGEDHN
C#C[C@H](NCCC(=O)Nc1c(Cl)cccc1Cl)[C@@H]1CCCO1	ZINC000839562587	1320938810	/nfs/dbraw/zinc/93/88/10/1320938810.db2.gz	APTULKCJFIJVIB-KBPBESRZSA-N	0	3	341.238	3.092	20	30		EGEDHN
CC[C@H](C)[C@H](NC(C)=O)C(=O)C(C#N)c1ncc(C(C)(C)C)s1	ZINC000802833222	1317046737	/nfs/dbraw/zinc/04/67/37/1317046737.db2.gz	CPQLGCIJNBIJHM-JKOKRWQUSA-N	0	3	335.473	3.168	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](N[C@H]2CCc3c2cc(F)cc3F)C1	ZINC001019237922	1317117463	/nfs/dbraw/zinc/11/74/63/1317117463.db2.gz	DJNQMZQYGLJNGE-GUYCJALGSA-N	0	3	334.410	3.355	20	30		EGEDHN
Cc1cccc(C)c1C(=O)N1CC[C@H](NCc2ccc(C#N)s2)C1	ZINC001019423477	1317232914	/nfs/dbraw/zinc/23/29/14/1317232914.db2.gz	KUWLFYAJLVMYRL-HNNXBMFYSA-N	0	3	339.464	3.241	20	30		EGEDHN
N#CC(C(=O)C1CCN(CC(F)F)CC1)c1ccc2ccccc2n1	ZINC000805845529	1317430576	/nfs/dbraw/zinc/43/05/76/1317430576.db2.gz	WVEMXECEHXJMHD-OAHLLOKOSA-N	0	3	343.377	3.388	20	30		EGEDHN
C=CCN(CC(=O)[O-])C[C@]1(C(C)(C)C)CC[N@H+](Cc2ccccc2)C1	ZINC000901585654	1317449471	/nfs/dbraw/zinc/44/94/71/1317449471.db2.gz	GWDWUDODRGUDBH-OAQYLSRUSA-N	0	3	344.499	3.497	20	30		EGEDHN
C=CCN(CC(=O)[O-])C[C@]1(C(C)(C)C)CC[N@@H+](Cc2ccccc2)C1	ZINC000901585654	1317449476	/nfs/dbraw/zinc/44/94/76/1317449476.db2.gz	GWDWUDODRGUDBH-OAQYLSRUSA-N	0	3	344.499	3.497	20	30		EGEDHN
C=CC[N@H+](CC(=O)[O-])C[C@]1(C(C)(C)C)CCN(Cc2ccccc2)C1	ZINC000901585654	1317449481	/nfs/dbraw/zinc/44/94/81/1317449481.db2.gz	GWDWUDODRGUDBH-OAQYLSRUSA-N	0	3	344.499	3.497	20	30		EGEDHN
C=CC[N@@H+](CC(=O)[O-])C[C@]1(C(C)(C)C)CCN(Cc2ccccc2)C1	ZINC000901585654	1317449488	/nfs/dbraw/zinc/44/94/88/1317449488.db2.gz	GWDWUDODRGUDBH-OAQYLSRUSA-N	0	3	344.499	3.497	20	30		EGEDHN
C#Cc1cccc(NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)c1	ZINC000806182750	1317470239	/nfs/dbraw/zinc/47/02/39/1317470239.db2.gz	BEKYWXMLBSBEOF-SFHVURJKSA-N	0	3	325.387	3.231	20	30		EGEDHN
CC[C@H](C)N[C@@H](CNC(=O)Cc1ccccc1CC#N)c1ccco1	ZINC000807679232	1317576387	/nfs/dbraw/zinc/57/63/87/1317576387.db2.gz	GIJQJSYCWOEDGJ-YJBOKZPZSA-N	0	3	339.439	3.134	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cncc(-c3ccccc3)c2)C1	ZINC001020214454	1317595908	/nfs/dbraw/zinc/59/59/08/1317595908.db2.gz	UEVYQWOKQJZRDM-IYARVYRRSA-N	0	3	341.842	3.352	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1C[C@H](N[C@H](C)c2ccccc2F)C1	ZINC001020241510	1317605891	/nfs/dbraw/zinc/60/58/91/1317605891.db2.gz	NWHMNDBIHQMDJZ-BZUAXINKSA-N	0	3	341.430	3.425	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)c2cscc2Cl)C1	ZINC001020268127	1317616961	/nfs/dbraw/zinc/61/69/61/1317616961.db2.gz	RIVCROJBAWLIQV-KYZUINATSA-N	0	3	349.681	3.161	20	30		EGEDHN
CC[C@H](N[C@H]1CCCN(CC(F)(F)F)C1=O)c1cccc(C#N)c1	ZINC000902882156	1317627086	/nfs/dbraw/zinc/62/70/86/1317627086.db2.gz	PGRJPDRZVMKRQP-GJZGRUSLSA-N	0	3	339.361	3.152	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cccc3c(C)c(C)[nH]c32)C1	ZINC001020305839	1317638138	/nfs/dbraw/zinc/63/81/38/1317638138.db2.gz	RNIYDSKBDCOQPM-HDJSIYSDSA-N	0	3	331.847	3.388	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2[nH]c3ccccc3c2Cl)C1	ZINC001020349067	1317654654	/nfs/dbraw/zinc/65/46/54/1317654654.db2.gz	UJQMAYHLUMRTEM-XYPYZODXSA-N	0	3	338.238	3.424	20	30		EGEDHN
C#C[C@@H](NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1)C(C)(C)C	ZINC000808315859	1317659751	/nfs/dbraw/zinc/65/97/51/1317659751.db2.gz	NKWJVWBKTVOWPH-IEBWSBKVSA-N	0	3	341.499	3.340	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1)C(=O)c1cncc(C(F)(F)F)c1	ZINC000808979320	1317756000	/nfs/dbraw/zinc/75/60/00/1317756000.db2.gz	HUFZTRNHQAUZKP-CYBMUJFWSA-N	0	3	333.269	3.062	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N[C@H]1C[C@H](N[C@@H](C)c2ccccc2Cl)C1	ZINC001020605781	1317795650	/nfs/dbraw/zinc/79/56/50/1317795650.db2.gz	ZFDLQMFQUQOBTE-ALCWZJMGSA-N	0	3	348.874	3.229	20	30		EGEDHN
C[NH+](C)CCN(Cc1ccc(C#N)cc1)Cc1cc(Cl)ccc1[O-]	ZINC000809731917	1317881390	/nfs/dbraw/zinc/88/13/90/1317881390.db2.gz	XCKUEPHETWSWOX-UHFFFAOYSA-N	0	3	343.858	3.481	20	30		EGEDHN
CCCOc1ccc(/C=C2/C(=O)c3ncnn3C2C)cc1OCC	ZINC000905080930	1317921064	/nfs/dbraw/zinc/92/10/64/1317921064.db2.gz	OKNUWRBUGFMBFP-IGVUGNCQSA-N	0	3	327.384	3.307	20	30		EGEDHN
CC1/C(=C\c2cccc(C(=O)OC(C)(C)C)c2)C(=O)c2ncnn21	ZINC000905083805	1317922353	/nfs/dbraw/zinc/92/23/53/1317922353.db2.gz	FOTVPWMCQAPCRT-LUHPIMIVSA-N	0	3	325.368	3.074	20	30		EGEDHN
CC[C@H](C)Oc1cc(/C=C2\C(=O)c3ncnn3C2C)ccc1OC	ZINC000905082765	1317922369	/nfs/dbraw/zinc/92/23/69/1317922369.db2.gz	WXPZVIHBTNHJJP-KVTRFNDWSA-N	0	3	327.384	3.305	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NC[C@H](c1ccc(CC)cc1)N(C)C	ZINC000809948621	1317923219	/nfs/dbraw/zinc/92/32/19/1317923219.db2.gz	ZRQGOSOEKRHLMI-OAQYLSRUSA-N	0	3	334.463	3.192	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NC[C@H](CC)N1CCc2ccccc2C1	ZINC000810090999	1317949200	/nfs/dbraw/zinc/94/92/00/1317949200.db2.gz	FITKPFUXOUWBQA-QFIPXVFZSA-N	0	3	346.474	3.164	20	30		EGEDHN
N#Cc1ccc(OCCCN2CC3(CCC3)[C@@H]2[C@@H]2CCCO2)cc1	ZINC000810091563	1317949334	/nfs/dbraw/zinc/94/93/34/1317949334.db2.gz	BATVDNSQMDIOPS-OALUTQOASA-N	0	3	326.440	3.361	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)c2cccc(C)c2C)C1	ZINC001021003567	1318039163	/nfs/dbraw/zinc/03/91/63/1318039163.db2.gz	JSOJFYJFZORLIV-HDJSIYSDSA-N	0	3	337.261	3.062	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)C2(c3ccc(C)cc3)CCC2)C1	ZINC001021113054	1318097333	/nfs/dbraw/zinc/09/73/33/1318097333.db2.gz	MMLLZBQGUGDZHE-QAQDUYKDSA-N	0	3	332.875	3.406	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)Cc2c(C)oc3ccccc32)C1	ZINC001021151571	1318114148	/nfs/dbraw/zinc/11/41/48/1318114148.db2.gz	BOCJQMQRFGUKHZ-HDJSIYSDSA-N	0	3	332.831	3.273	20	30		EGEDHN
CO[C@H](C)[C@@H](C)N[C@@H](C)C(=O)/C=C1/N(C)c2ccccc2C1(C)C	ZINC000811637667	1318216755	/nfs/dbraw/zinc/21/67/55/1318216755.db2.gz	HHDQVZGFZNGGHX-SMHRVSJESA-N	0	3	330.472	3.269	20	30		EGEDHN
COc1ccc(C(C)=NNC[C@H]2CCSC2)cc1CN1CCCC1	ZINC000811658571	1318221265	/nfs/dbraw/zinc/22/12/65/1318221265.db2.gz	LURYEOLBJLEYNV-MRXNPFEDSA-N	0	3	347.528	3.358	20	30		EGEDHN
Cc1ccoc1C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)s1	ZINC000959876225	1318246374	/nfs/dbraw/zinc/24/63/74/1318246374.db2.gz	FQJFJUDCOJHRFT-AWEZNQCLSA-N	0	3	343.452	3.306	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC000959891119	1318253678	/nfs/dbraw/zinc/25/36/78/1318253678.db2.gz	ZATBIBJJWJMNPT-PBHICJAKSA-N	0	3	331.435	3.214	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)/C=C/C2CC2)cc1F	ZINC000959938126	1318276996	/nfs/dbraw/zinc/27/69/96/1318276996.db2.gz	RGRQUJINFFDUDQ-KOEDOTQGSA-N	0	3	341.430	3.134	20	30		EGEDHN
C#C[C@H](NC(=O)NC1CCN(CC(=C)C)CC1)c1ccc(Cl)cc1	ZINC000811876334	1318283598	/nfs/dbraw/zinc/28/35/98/1318283598.db2.gz	OBAYLYOGFOXRKY-SFHVURJKSA-N	0	3	345.874	3.354	20	30		EGEDHN
CCCC(=O)N1CCC[C@H]2CN(Cc3ccc(C#N)cc3)CC[C@@H]21	ZINC001021500540	1318311117	/nfs/dbraw/zinc/31/11/17/1318311117.db2.gz	YNYUGPGEQNCPJZ-OALUTQOASA-N	0	3	325.456	3.171	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@@H]2CN(Cc3cccc(C#N)c3)CC[C@H]21	ZINC001021505293	1318319912	/nfs/dbraw/zinc/31/99/12/1318319912.db2.gz	JSFDTUMBMBSHDM-WOJBJXKFSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=CCCC(=O)[C@H]1CCCN1C(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000908658623	1318383332	/nfs/dbraw/zinc/38/33/32/1318383332.db2.gz	FTHIELLFAKZYQC-RTBURBONSA-N	0	3	340.467	3.035	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc(C)sn1	ZINC000960264667	1318435295	/nfs/dbraw/zinc/43/52/95/1318435295.db2.gz	IULBKQLWCLBVQW-NVXWUHKLSA-N	0	3	327.453	3.013	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)C(C)(C)[C@@H]1CCCCO1	ZINC000960266879	1318436251	/nfs/dbraw/zinc/43/62/51/1318436251.db2.gz	FSCVRAFUDHDARO-CEXWTWQISA-N	0	3	342.483	3.140	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cccc3c2CCCC3)C1	ZINC001021593280	1318437809	/nfs/dbraw/zinc/43/78/09/1318437809.db2.gz	VLTUKRLQEBHUGP-NQIIRXRSSA-N	0	3	336.479	3.125	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)CC2(c3ccccc3)CC2)C1	ZINC001021601017	1318444902	/nfs/dbraw/zinc/44/49/02/1318444902.db2.gz	BKXVLGBVDMMGPB-UYAOXDASSA-N	0	3	336.479	3.054	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@H]1CCCc2cccnc21	ZINC000960300279	1318450555	/nfs/dbraw/zinc/45/05/55/1318450555.db2.gz	PKOVVEKKFXRSEC-QKNQBKEWSA-N	0	3	347.462	3.059	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCC[C@@H]2CN(C/C=C\Cl)CC[C@H]21	ZINC001021604817	1318451757	/nfs/dbraw/zinc/45/17/57/1318451757.db2.gz	GTEGTMNSXSJHOU-VANPALJFSA-N	0	3	347.890	3.353	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ocnc1C1CC1	ZINC000960306190	1318453441	/nfs/dbraw/zinc/45/34/41/1318453441.db2.gz	IMKZSFCHRXCRBV-SJLPKXTDSA-N	0	3	337.423	3.114	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)C2C3CC4CC(C3)CC2C4)C1	ZINC001021607031	1318454981	/nfs/dbraw/zinc/45/49/81/1318454981.db2.gz	TYAUKTZMPTZSOK-CQRDRXQVSA-N	0	3	340.511	3.005	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)C1CCC(F)(F)CC1	ZINC000960312233	1318455748	/nfs/dbraw/zinc/45/57/48/1318455748.db2.gz	INCOSSBUVPFGTA-IAGOWNOFSA-N	0	3	334.410	3.370	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1c[nH]c2cccnc12	ZINC000960328310	1318463887	/nfs/dbraw/zinc/46/38/87/1318463887.db2.gz	XRBCPXOVYMPVFW-RTBURBONSA-N	0	3	346.434	3.124	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc(Cl)cn1CC	ZINC000960330454	1318464859	/nfs/dbraw/zinc/46/48/59/1318464859.db2.gz	SZTMZLUETWERKB-SJLPKXTDSA-N	0	3	343.858	3.333	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cn(CC)c3ccccc23)C1	ZINC001021628014	1318480325	/nfs/dbraw/zinc/48/03/25/1318480325.db2.gz	RRKMHOKZDIVNHQ-XLIONFOSSA-N	0	3	349.478	3.221	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(-c3ccco3)o2)C1	ZINC001021629568	1318484283	/nfs/dbraw/zinc/48/42/83/1318484283.db2.gz	HLXAFQCZYIGJEM-HZPDHXFCSA-N	0	3	338.407	3.099	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)CCc2cccc(C)c2)C1	ZINC001021641670	1318499626	/nfs/dbraw/zinc/49/96/26/1318499626.db2.gz	KBTNBODHJNCUKD-NHCUHLMSSA-N	0	3	338.495	3.264	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2csc3ccccc23)C1	ZINC001021642714	1318499730	/nfs/dbraw/zinc/49/97/30/1318499730.db2.gz	RWWMXVRDQUEOFG-CRAIPNDOSA-N	0	3	338.476	3.461	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)/C=C/c1ccco1	ZINC000960377603	1318499926	/nfs/dbraw/zinc/49/99/26/1318499926.db2.gz	LACMFOQGJALTLK-GNISGLHKSA-N	0	3	349.434	3.287	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)/C=C\c1ccco1	ZINC000960377602	1318499986	/nfs/dbraw/zinc/49/99/86/1318499986.db2.gz	LACMFOQGJALTLK-GDWUOILNSA-N	0	3	349.434	3.287	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(C(C)C)cn2)C1	ZINC001021667527	1318531452	/nfs/dbraw/zinc/53/14/52/1318531452.db2.gz	INOSQJGSLONDCB-ICSRJNTNSA-N	0	3	339.483	3.155	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cccc(F)c2Cl)C1	ZINC001021677340	1318545580	/nfs/dbraw/zinc/54/55/80/1318545580.db2.gz	QAKKNEIVOTUPCT-PBHICJAKSA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)C2CCC(F)(F)CC2)C1	ZINC001021679076	1318549946	/nfs/dbraw/zinc/54/99/46/1318549946.db2.gz	LXUNQGVSAYCVMR-IRXDYDNUSA-N	0	3	338.442	3.148	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cccc3c2ccn3C)C1	ZINC001021693033	1318565720	/nfs/dbraw/zinc/56/57/20/1318565720.db2.gz	XIFANMYAUQIIAJ-XLIONFOSSA-N	0	3	349.478	3.128	20	30		EGEDHN
C[C@](C#N)(NC(=O)C1C[C@@H](c2ccccc2)OC1=O)C1CCCCC1	ZINC000813453382	1318567871	/nfs/dbraw/zinc/56/78/71/1318567871.db2.gz	IVYDLTGICYJDKF-ABSDTBQOSA-N	0	3	340.423	3.270	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cccc3ccncc32)C1	ZINC001021705453	1318578121	/nfs/dbraw/zinc/57/81/21/1318578121.db2.gz	DDSOVPQYTBIOSU-WIYYLYMNSA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc3ccncc3c2)C1	ZINC001021711496	1318588144	/nfs/dbraw/zinc/58/81/44/1318588144.db2.gz	XCPHJIJOERFNLF-FPOVZHCZSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc3c(c2)CCC=C3)C1	ZINC001021715684	1318594729	/nfs/dbraw/zinc/59/47/29/1318594729.db2.gz	IDDXTHPNJUVLCB-LEWJYISDSA-N	0	3	334.463	3.206	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)CCc2cccs2)C1	ZINC001021731208	1318634206	/nfs/dbraw/zinc/63/42/06/1318634206.db2.gz	TUYOZYLPURQAEV-FUHWJXTLSA-N	0	3	330.497	3.017	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(C(C)(F)F)cc2)C1	ZINC001021745495	1318660546	/nfs/dbraw/zinc/66/05/46/1318660546.db2.gz	BHHRFRVAFBVEFZ-WMZOPIPTSA-N	0	3	346.421	3.358	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CCC[C@@H]1CN(C)Cc1ccc(C#N)cc1	ZINC000960561778	1318691408	/nfs/dbraw/zinc/69/14/08/1318691408.db2.gz	IVDHMOHSXVUODT-QGZVFWFLSA-N	0	3	329.419	3.244	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)Cc2coc3cc(F)ccc23)C1	ZINC001022067507	1318786856	/nfs/dbraw/zinc/78/68/56/1318786856.db2.gz	HJAQNRZYTMCBTA-OKILXGFUSA-N	0	3	336.794	3.104	20	30		EGEDHN
C[C@H]1CCC[C@H]1CC(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001022122037	1318803552	/nfs/dbraw/zinc/80/35/52/1318803552.db2.gz	OPYRCVDDEAQRDA-QXRTWZOPSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)[C@@]2(C)CCC[C@H]2CC)C1	ZINC001022285826	1318877158	/nfs/dbraw/zinc/87/71/58/1318877158.db2.gz	MGHKBNKEZKVXTB-NYTXWWLZSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccc(Br)c(OC)c1	ZINC000912437622	1318886114	/nfs/dbraw/zinc/88/61/14/1318886114.db2.gz	HYQWCNBJQOMTLE-GFCCVEGCSA-N	0	3	327.222	3.080	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC[C@H]2CN(C)Cc2ccccc2)cc1	ZINC000960783700	1318886145	/nfs/dbraw/zinc/88/61/45/1318886145.db2.gz	OKUCTVYYVYUNCT-NRFANRHFSA-N	0	3	332.447	3.405	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)[C@@H]1CCC1(C)C	ZINC000960813568	1318933406	/nfs/dbraw/zinc/93/34/06/1318933406.db2.gz	GMSVHKGVIZPNMA-OALUTQOASA-N	0	3	339.483	3.417	20	30		EGEDHN
C[C@H]1CCN(Cc2ccccc2)C[C@H]1NC(=O)CCCCCC#N	ZINC000913096038	1318971740	/nfs/dbraw/zinc/97/17/40/1318971740.db2.gz	BKBLTUSEAKYJHL-PKOBYXMFSA-N	0	3	327.472	3.487	20	30		EGEDHN
CC[C@H]1CCC[C@@H]1C(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001022661184	1319049310	/nfs/dbraw/zinc/04/93/10/1319049310.db2.gz	KTTKABXABKQFDC-OWLYRPNTSA-N	0	3	343.446	3.260	20	30		EGEDHN
CC(C)(C)Oc1ccc(C(=O)C(C#N)C(=O)Nc2ccccc2)nc1	ZINC000815907797	1319071016	/nfs/dbraw/zinc/07/10/16/1319071016.db2.gz	KQZFHRFTKJJVFA-HNNXBMFYSA-N	0	3	337.379	3.220	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)[C@H]1CCC[C@@H](OC)C1)c1ccccc1	ZINC000816038850	1319092479	/nfs/dbraw/zinc/09/24/79/1319092479.db2.gz	ISAPYRMEEPOVMX-MLHJIOFPSA-N	0	3	342.439	3.168	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2)C1	ZINC001022834506	1319131146	/nfs/dbraw/zinc/13/11/46/1319131146.db2.gz	WJUHNNNDKIPLMP-XUWVNRHRSA-N	0	3	339.266	3.433	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]([C@H]3CCCN(C(=O)C4CC4)C3)C2)s1	ZINC000961082312	1319194503	/nfs/dbraw/zinc/19/45/03/1319194503.db2.gz	RRJRCWBMISQKSB-HOTGVXAUSA-N	0	3	343.496	3.090	20	30		EGEDHN
C=CCC(F)(F)C(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000816681556	1319207827	/nfs/dbraw/zinc/20/78/27/1319207827.db2.gz	ACHRCCKCWMFDDZ-INIZCTEOSA-N	0	3	340.414	3.404	20	30		EGEDHN
CCCC(=O)N1CCC[C@@H]([C@@H]2CCN(CC#Cc3ccccc3)C2)C1	ZINC000961101319	1319211039	/nfs/dbraw/zinc/21/10/39/1319211039.db2.gz	RVCXLHYSCCZAHM-NHCUHLMSSA-N	0	3	338.495	3.399	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)c2cccc(C)c2C)C1	ZINC001023044913	1319234650	/nfs/dbraw/zinc/23/46/50/1319234650.db2.gz	JSOJFYJFZORLIV-OKILXGFUSA-N	0	3	337.261	3.062	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)c2ccc(C)c(C)c2)C1	ZINC001023049234	1319237707	/nfs/dbraw/zinc/23/77/07/1319237707.db2.gz	LRWTUMOJGKPYGP-GASCZTMLSA-N	0	3	337.261	3.062	20	30		EGEDHN
Cc1occc1C(=O)NC[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001023221208	1319359481	/nfs/dbraw/zinc/35/94/81/1319359481.db2.gz	IXDCNVXOGVRMKX-SFHVURJKSA-N	0	3	337.423	3.102	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]([C@H]2CCN(Cc3cnc(C)o3)C2)C1	ZINC000961229650	1319360016	/nfs/dbraw/zinc/36/00/16/1319360016.db2.gz	NCYHDNXEJMQPJI-IRXDYDNUSA-N	0	3	345.487	3.256	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC001023372442	1319484095	/nfs/dbraw/zinc/48/40/95/1319484095.db2.gz	SPSQCSSGTTYWIS-ZDUSSCGKSA-N	0	3	338.373	3.228	20	30		EGEDHN
C#CCN(C)CCCNC(=O)[C@H](C)c1c(Cl)cccc1Cl	ZINC000818588963	1319563531	/nfs/dbraw/zinc/56/35/31/1319563531.db2.gz	KZAMOCPLHUTZOF-GFCCVEGCSA-N	0	3	327.255	3.168	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1sccc1-c1ccc(C)cc1	ZINC000818584207	1319563885	/nfs/dbraw/zinc/56/38/85/1319563885.db2.gz	HPMVZHAASDADFV-UHFFFAOYSA-N	0	3	326.465	3.408	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1cccc(N[C@@H](C)C(C)C)c1C	ZINC000818595925	1319565464	/nfs/dbraw/zinc/56/54/64/1319565464.db2.gz	UEDSPWAVWAHDAQ-KRWDZBQOSA-N	0	3	329.488	3.136	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc3ccccc3s2)C1	ZINC001023470032	1319566567	/nfs/dbraw/zinc/56/65/67/1319566567.db2.gz	QXUJQUHFNJWVKS-HNNXBMFYSA-N	0	3	326.465	3.366	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1cc2ccccc2c2cccnc12	ZINC000818611974	1319569462	/nfs/dbraw/zinc/56/94/62/1319569462.db2.gz	JOIVFAXYMOSCFO-UHFFFAOYSA-N	0	3	331.419	3.073	20	30		EGEDHN
C#CCN(C)CCCNC(=O)[C@H]1C[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000818615345	1319570355	/nfs/dbraw/zinc/57/03/55/1319570355.db2.gz	JQWWZUKMSVZAQS-KBPBESRZSA-N	0	3	339.266	3.168	20	30		EGEDHN
C#CCN(C)CCCNC(=O)[C@H](CC)c1cccc(C(F)(F)F)c1	ZINC000818612273	1319570420	/nfs/dbraw/zinc/57/04/20/1319570420.db2.gz	RUTXPHVQZDDZBE-MRXNPFEDSA-N	0	3	340.389	3.270	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)[C@@H]2CCc3c2cccc3Cl)C1	ZINC001023492739	1319596286	/nfs/dbraw/zinc/59/62/86/1319596286.db2.gz	CHNWVQCXHXIAQK-CRAIPNDOSA-N	0	3	344.886	3.221	20	30		EGEDHN
C#CCOc1ccccc1CNCCC(=O)Nc1cccc(F)c1C	ZINC000819071846	1319626003	/nfs/dbraw/zinc/62/60/03/1319626003.db2.gz	BOHXFKCSZRTQLN-UHFFFAOYSA-N	0	3	340.398	3.265	20	30		EGEDHN
Cc1cc(C)c(C(=O)NC2CC(CNCc3ccccc3C#N)C2)o1	ZINC000961680143	1319694387	/nfs/dbraw/zinc/69/43/87/1319694387.db2.gz	WTSPXMNKSGDQSD-UHFFFAOYSA-N	0	3	337.423	3.066	20	30		EGEDHN
COCCN(CC(=O)C(C#N)c1nc2ccccc2s1)CC(C)C	ZINC000917100035	1319757591	/nfs/dbraw/zinc/75/75/91/1319757591.db2.gz	AGMGTVYQHSDMMK-CQSZACIVSA-N	0	3	345.468	3.077	20	30		EGEDHN
CC[C@@H](Cc1ccccc1C)C(=O)C(C#N)C(=O)NC1CCCC1	ZINC000819947562	1319808597	/nfs/dbraw/zinc/80/85/97/1319808597.db2.gz	HHQHQGFYXAQMSX-YJBOKZPZSA-N	0	3	326.440	3.331	20	30		EGEDHN
CCc1ccccc1C(=O)NC1CC(CNCc2ccccc2C#N)C1	ZINC000962231366	1319872160	/nfs/dbraw/zinc/87/21/60/1319872160.db2.gz	AODXPUCXVBIBNC-UHFFFAOYSA-N	0	3	347.462	3.419	20	30		EGEDHN
Cc1cccc(CC(=O)NC2CC(CNCc3ccccc3C#N)C2)c1	ZINC000962250774	1319880392	/nfs/dbraw/zinc/88/03/92/1319880392.db2.gz	DOJYIHGOQMYSKL-UHFFFAOYSA-N	0	3	347.462	3.094	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc3c(s2)CC[C@@H](C)C3)C1	ZINC001023742657	1319889138	/nfs/dbraw/zinc/88/91/38/1319889138.db2.gz	JWXIOZDAWKEWGO-HZPDHXFCSA-N	0	3	344.524	3.338	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2oc3ccccc3c2CC)C1	ZINC001023770500	1319920142	/nfs/dbraw/zinc/92/01/42/1319920142.db2.gz	ACPSHCOQYURREM-MRXNPFEDSA-N	0	3	338.451	3.460	20	30		EGEDHN
Cc1ccoc1C(=O)N1CCC[C@H](CNCc2ccccc2C#N)C1	ZINC001023844277	1319983442	/nfs/dbraw/zinc/98/34/42/1319983442.db2.gz	GHPKBIYOXYQQFZ-MRXNPFEDSA-N	0	3	337.423	3.102	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001023853976	1319990041	/nfs/dbraw/zinc/99/00/41/1319990041.db2.gz	AMTBAPQXTKPJNB-LSDHHAIUSA-N	0	3	331.435	3.072	20	30		EGEDHN
C#Cc1cnc(NC[C@H](c2ccccc2OC)N2CCCCC2)nc1	ZINC000827425057	1320452119	/nfs/dbraw/zinc/45/21/19/1320452119.db2.gz	GNHYECXEUYKXLP-GOSISDBHSA-N	0	3	336.439	3.106	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N[C@H](C)c1ccc(SCC)cc1	ZINC000836278724	1320468418	/nfs/dbraw/zinc/46/84/18/1320468418.db2.gz	KTJMGXMRAHCNOE-OAHLLOKOSA-N	0	3	333.501	3.114	20	30		EGEDHN
C#Cc1cccc(CNC(=O)N2CCCN(Cc3ccccc3)CC2)c1	ZINC000836656399	1320517713	/nfs/dbraw/zinc/51/77/13/1320517713.db2.gz	JEMYSCRKQSTAHC-UHFFFAOYSA-N	0	3	347.462	3.085	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N[C@H](C)c1cc2ccccc2s1	ZINC000838350721	1320764011	/nfs/dbraw/zinc/76/40/11/1320764011.db2.gz	YOVBZGGZKOFNEX-CQSZACIVSA-N	0	3	329.469	3.217	20	30		EGEDHN
C#CCN(CCC(=O)N[C@H](c1cccs1)c1ccccc1)C1CC1	ZINC000839558146	1320937620	/nfs/dbraw/zinc/93/76/20/1320937620.db2.gz	PZBKWFRZAXYKTA-FQEVSTJZSA-N	0	3	338.476	3.441	20	30		EGEDHN
N#CC(C(=O)[C@@H]1CCc2ncncc2C1)c1ccc2ccccc2n1	ZINC000842677420	1321417620	/nfs/dbraw/zinc/41/76/20/1321417620.db2.gz	OYONUVXYFYAZEA-ZBFHGGJFSA-N	0	3	328.375	3.006	20	30		EGEDHN
C[C@@H](NCc1cc(C#N)cs1)c1ccc(N2CCNC2=O)cc1	ZINC000842743369	1321426293	/nfs/dbraw/zinc/42/62/93/1321426293.db2.gz	GRXFHZUKCVVTOU-GFCCVEGCSA-N	0	3	326.425	3.000	20	30		EGEDHN
CCCC[N@H+](Cc1cnc2c(C#N)cnn2c1)Cc1ccccc1[O-]	ZINC000843407866	1321512945	/nfs/dbraw/zinc/51/29/45/1321512945.db2.gz	MIZSKDYJYOQFLA-UHFFFAOYSA-N	0	3	335.411	3.109	20	30		EGEDHN
CCCC[N@@H+](Cc1cnc2c(C#N)cnn2c1)Cc1ccccc1[O-]	ZINC000843407866	1321512947	/nfs/dbraw/zinc/51/29/47/1321512947.db2.gz	MIZSKDYJYOQFLA-UHFFFAOYSA-N	0	3	335.411	3.109	20	30		EGEDHN
CCCCN(Cc1cnc2c(C#N)cnn2c1)Cc1ccccc1O	ZINC000843407866	1321512950	/nfs/dbraw/zinc/51/29/50/1321512950.db2.gz	MIZSKDYJYOQFLA-UHFFFAOYSA-N	0	3	335.411	3.109	20	30		EGEDHN
C#Cc1cncc(C(=O)N(C(C)C)[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000843696387	1321536778	/nfs/dbraw/zinc/53/67/78/1321536778.db2.gz	UOOJIWCNUOWDIX-OAQYLSRUSA-N	0	3	347.462	3.188	20	30		EGEDHN
CN(CCN1CCCCC1)C(=O)C#Cc1ccc(C(F)(F)F)cc1	ZINC000846614501	1321796147	/nfs/dbraw/zinc/79/61/47/1321796147.db2.gz	PULLULZVQLKZID-UHFFFAOYSA-N	0	3	338.373	3.001	20	30		EGEDHN
C#CCOc1cccc(NC(=O)N2CCN(C(C)(C)CC)CC2)c1	ZINC000847146546	1321844943	/nfs/dbraw/zinc/84/49/43/1321844943.db2.gz	FDBRLCCISKALDF-UHFFFAOYSA-N	0	3	329.444	3.037	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)CCCc1c(F)cccc1F	ZINC000847622463	1321884687	/nfs/dbraw/zinc/88/46/87/1321884687.db2.gz	LMPGXHVYJHXYDY-CQSZACIVSA-N	0	3	336.382	3.303	20	30		EGEDHN
N#CC1(COC(=O)C2=COCCC2)CCN(Cc2ccccc2)CC1	ZINC000847748802	1321900860	/nfs/dbraw/zinc/90/08/60/1321900860.db2.gz	IUJVMMANBHQGEN-UHFFFAOYSA-N	0	3	340.423	3.030	20	30		EGEDHN
CN(CC(=O)C(C#N)c1nc2ccccc2s1)Cc1ccoc1	ZINC000918739200	1321988318	/nfs/dbraw/zinc/98/83/18/1321988318.db2.gz	YFIAMCNCQSOFAW-ZDUSSCGKSA-N	0	3	325.393	3.198	20	30		EGEDHN
COc1ccc(O)c(/C=N\CC2CCN(Cc3ccncc3)CC2)c1	ZINC000849170183	1322093514	/nfs/dbraw/zinc/09/35/14/1322093514.db2.gz	MJIXHZXULONCQE-HMAPJEAMSA-N	0	3	339.439	3.127	20	30		EGEDHN
C#CCN(CC)C[C@H](O)CO[C@H](c1ccccc1)c1ccc(C)cc1	ZINC000920096487	1322137170	/nfs/dbraw/zinc/13/71/70/1322137170.db2.gz	XVTXPPWWDLGKFT-FCHUYYIVSA-N	0	3	337.463	3.417	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@H]1CCCN(C(=O)CC2CCC2)C1	ZINC001023909497	1323017449	/nfs/dbraw/zinc/01/74/49/1323017449.db2.gz	GBPBDDUMVHJVQN-MRXNPFEDSA-N	0	3	343.446	3.216	20	30		EGEDHN
C[C@H](NC[C@H]1CCCN(C(=O)C#CC2CC2)C1)c1c(F)cccc1F	ZINC001023980981	1323063333	/nfs/dbraw/zinc/06/33/33/1323063333.db2.gz	GAAGQMXUJIDTHN-GOEBONIOSA-N	0	3	346.421	3.267	20	30		EGEDHN
CCCNC(=O)OC[C@@H]1CCCCN1CCc1ccc(C#N)cc1	ZINC000852049377	1323139275	/nfs/dbraw/zinc/13/92/75/1323139275.db2.gz	VJTOEOAYSRUPAX-SFHVURJKSA-N	0	3	329.444	3.091	20	30		EGEDHN
C#C[C@@](C)(CC)N[C@H](C)C(=O)N(C)Cc1nc2ccccc2s1	ZINC000852101348	1323147107	/nfs/dbraw/zinc/14/71/07/1323147107.db2.gz	PKKGVTHNEWKHPU-ACJLOTCBSA-N	0	3	329.469	3.035	20	30		EGEDHN
C=CCCN1CCCC[C@H]1CNC(=O)c1ncsc1C(F)(F)F	ZINC001024547461	1323489019	/nfs/dbraw/zinc/48/90/19/1323489019.db2.gz	LNBUURBHRWRYRI-NSHDSACASA-N	0	3	347.406	3.322	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccc(C)nc1C(C)C	ZINC001024578973	1323514374	/nfs/dbraw/zinc/51/43/74/1323514374.db2.gz	CNNRNJVMCQGDND-QGZVFWFLSA-N	0	3	327.472	3.121	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1cc2c(cc(C)cc2C)[nH]1	ZINC001024580182	1323517184	/nfs/dbraw/zinc/51/71/84/1323517184.db2.gz	RSQVBQXEVOPMCV-QGZVFWFLSA-N	0	3	337.467	3.392	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1cc2c(ccc(C)c2C)[nH]1	ZINC001024593698	1323527471	/nfs/dbraw/zinc/52/74/71/1323527471.db2.gz	QBMMEQDBCKZOLA-QGZVFWFLSA-N	0	3	337.467	3.392	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)[C@@H]1C[C@H]1c1ccccc1CC	ZINC001024624479	1323552312	/nfs/dbraw/zinc/55/23/12/1323552312.db2.gz	SKBTYDUQONTCIU-SESVDKBCSA-N	0	3	338.495	3.347	20	30		EGEDHN
C#CCOc1ccc(C(=O)NC[C@@H]2CCCCN2CC=C(C)C)cc1	ZINC001024694258	1323611796	/nfs/dbraw/zinc/61/17/96/1323611796.db2.gz	FZIPMVYJCLAFQO-IBGZPJMESA-N	0	3	340.467	3.249	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1cc(C)n(CC2CC2)c1C	ZINC001024759193	1323660110	/nfs/dbraw/zinc/66/01/10/1323660110.db2.gz	GFTHCKAXTPBXCI-IBGZPJMESA-N	0	3	341.499	3.123	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccc(N(C)C)c(F)c1	ZINC001024818386	1323722064	/nfs/dbraw/zinc/72/20/64/1323722064.db2.gz	UQNYCSNCHFEYRX-MRXNPFEDSA-N	0	3	333.451	3.052	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1	ZINC001024819400	1323724141	/nfs/dbraw/zinc/72/41/41/1323724141.db2.gz	OMSOHDXTRHXTAF-INIZCTEOSA-N	0	3	343.431	3.009	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cc(NC(C)=O)ccc1C	ZINC001024828335	1323731571	/nfs/dbraw/zinc/73/15/71/1323731571.db2.gz	CENZTZFIPWJHNP-SFHVURJKSA-N	0	3	343.471	3.114	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@@H]1CNCc1c(C)onc1CC	ZINC001025040389	1323842020	/nfs/dbraw/zinc/84/20/20/1323842020.db2.gz	BMZOEKQQMNIOHW-OAHLLOKOSA-N	0	3	333.476	3.228	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(C)oc1C	ZINC001025202548	1323987820	/nfs/dbraw/zinc/98/78/20/1323987820.db2.gz	YZQANGGKPUGDII-RTBURBONSA-N	0	3	328.456	3.379	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(CC)ccn1	ZINC001025231589	1324018518	/nfs/dbraw/zinc/01/85/18/1324018518.db2.gz	IBKZHTUCCVLLBT-PMACEKPBSA-N	0	3	339.483	3.126	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc2occc2[nH]1	ZINC001025238624	1324029782	/nfs/dbraw/zinc/02/97/82/1324029782.db2.gz	UFMBTVLVTQNPIA-MSOLQXFVSA-N	0	3	339.439	3.243	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1nc(C)sc1C	ZINC001025239342	1324031612	/nfs/dbraw/zinc/03/16/12/1324031612.db2.gz	DDPAFBLGYDCXBV-HZPDHXFCSA-N	0	3	333.501	3.405	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cccc(CC)n1	ZINC001025239663	1324032413	/nfs/dbraw/zinc/03/24/13/1324032413.db2.gz	HPISSQURVPMAPW-WOJBJXKFSA-N	0	3	339.483	3.126	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cncc(Cl)c1C	ZINC001025240490	1324033738	/nfs/dbraw/zinc/03/37/38/1324033738.db2.gz	PETMPLJXKBOLOY-MSOLQXFVSA-N	0	3	345.874	3.136	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)Cc1cccc(CC)c1	ZINC001025243390	1324038859	/nfs/dbraw/zinc/03/88/59/1324038859.db2.gz	NXLNCGDLHNXIHB-SFTDATJTSA-N	0	3	338.495	3.270	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ncccc1CC	ZINC001025243664	1324040858	/nfs/dbraw/zinc/04/08/58/1324040858.db2.gz	DDTUMJXLJGBEKH-OALUTQOASA-N	0	3	339.483	3.126	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(C)sc1C	ZINC001025248452	1324048762	/nfs/dbraw/zinc/04/87/62/1324048762.db2.gz	ZYIJESWTKYYPPU-QZTJIDSGSA-N	0	3	330.497	3.457	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1snnc1CC	ZINC001025250625	1324052011	/nfs/dbraw/zinc/05/20/11/1324052011.db2.gz	MBXUQEAVRGZTOE-HOTGVXAUSA-N	0	3	348.516	3.136	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccnc(C2CC2)c1	ZINC001025250784	1324052809	/nfs/dbraw/zinc/05/28/09/1324052809.db2.gz	NJYXZAOWHLRNIG-VQTJNVASSA-N	0	3	337.467	3.051	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc[nH]c1C1CC1	ZINC001025259133	1324068888	/nfs/dbraw/zinc/06/88/88/1324068888.db2.gz	LPNGTAYPESYBGI-OALUTQOASA-N	0	3	339.483	3.375	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc[nH]c1C(C)C	ZINC001025262909	1324073372	/nfs/dbraw/zinc/07/33/72/1324073372.db2.gz	GYISMTRHOJMBBQ-MSOLQXFVSA-N	0	3	327.472	3.230	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc[nH]c1CCC	ZINC001025263555	1324075459	/nfs/dbraw/zinc/07/54/59/1324075459.db2.gz	NQYPVKNVYBUNAI-RTBURBONSA-N	0	3	327.472	3.060	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(C(C)C)n[nH]1	ZINC001025274153	1324089925	/nfs/dbraw/zinc/08/99/25/1324089925.db2.gz	UPJLJNZIRKJUEZ-OALUTQOASA-N	0	3	342.487	3.016	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc2ccccn2c1	ZINC001025274652	1324092766	/nfs/dbraw/zinc/09/27/66/1324092766.db2.gz	LVAXEPMNSZSEKE-RTWAWAEBSA-N	0	3	349.478	3.422	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)Cc1ccc(CC)cc1	ZINC001025275315	1324095323	/nfs/dbraw/zinc/09/53/23/1324095323.db2.gz	WBRKUOQUJXTRAW-NHCUHLMSSA-N	0	3	338.495	3.270	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)C1(C)CC(F)(F)C1	ZINC001025287826	1324110045	/nfs/dbraw/zinc/11/00/45/1324110045.db2.gz	GYNCNNPXBXVEBS-HOTGVXAUSA-N	0	3	338.442	3.291	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc2c(C)cccn2c1	ZINC001025289217	1324112241	/nfs/dbraw/zinc/11/22/41/1324112241.db2.gz	OKADLTKGTIDRMZ-WOJBJXKFSA-N	0	3	349.478	3.340	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)C(C)(C)C(F)(F)F	ZINC001025294322	1324122536	/nfs/dbraw/zinc/12/25/36/1324122536.db2.gz	ZJPSVOBHHHTBTB-KBPBESRZSA-N	0	3	330.394	3.054	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)C1(c2ccccc2)CC1	ZINC001025295452	1324125671	/nfs/dbraw/zinc/12/56/71/1324125671.db2.gz	FZUQDJFPQCIXQO-PMACEKPBSA-N	0	3	336.479	3.197	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc(F)cc1F	ZINC001025295841	1324126942	/nfs/dbraw/zinc/12/69/42/1324126942.db2.gz	HOCYCWLNNYAQPL-QZTJIDSGSA-N	0	3	332.394	3.057	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1c(C)nsc1C	ZINC001025300094	1324132722	/nfs/dbraw/zinc/13/27/22/1324132722.db2.gz	BGGVUPOQHOAIPI-SJORKVTESA-N	0	3	345.512	3.242	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cccc(C(C)C)n2)C1	ZINC001025473144	1324319082	/nfs/dbraw/zinc/31/90/82/1324319082.db2.gz	ZPCQJOVVDXMMQM-IAGOWNOFSA-N	0	3	327.472	3.059	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(CCCC)cc2)C1	ZINC001025477909	1324323063	/nfs/dbraw/zinc/32/30/63/1324323063.db2.gz	IPMPEHCOVNLGPQ-PXNSSMCTSA-N	0	3	326.484	3.493	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc3cc(C)ccc3n2)C1	ZINC001025478005	1324323605	/nfs/dbraw/zinc/32/36/05/1324323605.db2.gz	KZGXXLCIJCYVRK-IEBWSBKVSA-N	0	3	349.478	3.397	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2nc3ccccc3cc2C)C1	ZINC001025484701	1324333318	/nfs/dbraw/zinc/33/33/18/1324333318.db2.gz	HSZMRBMSGYOPCQ-IEBWSBKVSA-N	0	3	349.478	3.397	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H](C)[C@@H]2CCCN(Cc3cccnc3)C2)cc1	ZINC001025501320	1324350045	/nfs/dbraw/zinc/35/00/45/1324350045.db2.gz	CRINBKXJFKXKEN-DYESRHJHSA-N	0	3	347.462	3.093	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccccc2-n2cccc2)C1	ZINC001025521657	1324365471	/nfs/dbraw/zinc/36/54/71/1324365471.db2.gz	CUAXWBJAQXIUBB-RBUKOAKNSA-N	0	3	349.478	3.331	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(F)c3ccccc23)C1	ZINC001025538468	1324384842	/nfs/dbraw/zinc/38/48/42/1324384842.db2.gz	GOZCCNUHWHOKBE-HOTGVXAUSA-N	0	3	338.426	3.442	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(F)c3ccccc23)C1	ZINC001025538467	1324385059	/nfs/dbraw/zinc/38/50/59/1324385059.db2.gz	GOZCCNUHWHOKBE-CVEARBPZSA-N	0	3	338.426	3.442	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(F)ccc2Cl)C1	ZINC001025540611	1324387684	/nfs/dbraw/zinc/38/76/84/1324387684.db2.gz	XYEBLNUYRHLRIM-KGLIPLIRSA-N	0	3	336.838	3.333	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(C)oc2C(F)(F)F)C1	ZINC001025546673	1324394333	/nfs/dbraw/zinc/39/43/33/1324394333.db2.gz	SMWORNTUVPJUPO-CHWSQXEVSA-N	0	3	342.361	3.070	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2scnc2C(C)C)C1	ZINC001025555996	1324405141	/nfs/dbraw/zinc/40/51/41/1324405141.db2.gz	RMJQBTXCAQKHOL-LSDHHAIUSA-N	0	3	333.501	3.120	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(OC)cc2Cl)C1	ZINC001025565009	1324411617	/nfs/dbraw/zinc/41/16/17/1324411617.db2.gz	OPICYJCLNAUMJO-GJZGRUSLSA-N	0	3	348.874	3.202	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cccn2C2CCCC2)C1	ZINC001025574871	1324414255	/nfs/dbraw/zinc/41/42/55/1324414255.db2.gz	WEKFXKNYOIYYAA-QZTJIDSGSA-N	0	3	341.499	3.457	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(OC)c(C3CC3)c2)C1	ZINC001025578420	1324418190	/nfs/dbraw/zinc/41/81/90/1324418190.db2.gz	IDSATLITFJGUDT-CRAIPNDOSA-N	0	3	340.467	3.036	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cccc(C(F)F)c2)C1	ZINC001025598316	1324447708	/nfs/dbraw/zinc/44/77/08/1324447708.db2.gz	YJYQUSAUMCOSST-WMLDXEAASA-N	0	3	334.410	3.478	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)C23CC4CC(CC(C4)C2)C3)C1	ZINC001025606410	1324455980	/nfs/dbraw/zinc/45/59/80/1324455980.db2.gz	FOVCJFPAENTYEQ-AGWGEYTISA-N	0	3	328.500	3.053	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccsc2C(F)F)C1	ZINC001025607884	1324458685	/nfs/dbraw/zinc/45/86/85/1324458685.db2.gz	YDJBMOMKDQQFLQ-NEPJUHHUSA-N	0	3	326.412	3.149	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc3c(s2)CCCCC3)C1	ZINC001025613751	1324465345	/nfs/dbraw/zinc/46/53/45/1324465345.db2.gz	ZWUORDQKGNIUJO-WBVHZDCISA-N	0	3	344.524	3.481	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2c[nH]cc2-c2ccccc2)C1	ZINC001025623194	1324471553	/nfs/dbraw/zinc/47/15/53/1324471553.db2.gz	ZCRLJTAXEFZGMJ-SJLPKXTDSA-N	0	3	335.451	3.145	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2c[nH]cc2-c2ccccc2)C1	ZINC001025623192	1324471969	/nfs/dbraw/zinc/47/19/69/1324471969.db2.gz	ZCRLJTAXEFZGMJ-AEFFLSMTSA-N	0	3	335.451	3.145	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(Cl)cn2CC)C1	ZINC001025623722	1324473182	/nfs/dbraw/zinc/47/31/82/1324473182.db2.gz	HOZBGSUZVWYUBB-HUUCEWRRSA-N	0	3	335.879	3.015	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc3ccccc3n2CC)C1	ZINC001025629704	1324481150	/nfs/dbraw/zinc/48/11/50/1324481150.db2.gz	JBEZNBSEGQOIDU-SJLPKXTDSA-N	0	3	337.467	3.125	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccccc2CC(C)C)C1	ZINC001025630409	1324481902	/nfs/dbraw/zinc/48/19/02/1324481902.db2.gz	SOGKUEPJPQPTBF-MJGOQNOKSA-N	0	3	326.484	3.349	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cnc(C(C)(C)C)s2)C1	ZINC001025630244	1324482224	/nfs/dbraw/zinc/48/22/24/1324482224.db2.gz	RRKXJXIUFAFDAT-GJZGRUSLSA-N	0	3	347.528	3.294	20	30		EGEDHN
Cc1ccc(C(=O)N2C[C@@H]3CC[C@H](NCc4ccccc4C#N)[C@@H]3C2)o1	ZINC001026188721	1324653834	/nfs/dbraw/zinc/65/38/34/1324653834.db2.gz	KHSFZVZTGCZIEW-OTWHNJEPSA-N	0	3	349.434	3.100	20	30		EGEDHN
C/C(=C\C(=O)N1C[C@@H]2CC[C@H](NCc3ccccc3C#N)[C@H]2C1)C1CC1	ZINC001026207435	1324663538	/nfs/dbraw/zinc/66/35/38/1324663538.db2.gz	UNAZYSWAKFONQP-HTLOYWKSSA-N	0	3	349.478	3.241	20	30		EGEDHN
Cc1cc(C(=O)N2C[C@@H]3CC[C@H](NCc4ccccc4C#N)[C@@H]3C2)co1	ZINC001026249813	1324685705	/nfs/dbraw/zinc/68/57/05/1324685705.db2.gz	HFODHAHBHNMGET-SXLOBPIMSA-N	0	3	349.434	3.100	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H]2CC[C@@H](NCc3nc(C)cs3)[C@@H]2C1	ZINC001026325970	1324727673	/nfs/dbraw/zinc/72/76/73/1324727673.db2.gz	FVZFXWLCXBLYGV-ARFHVFGLSA-N	0	3	347.528	3.380	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H]2CC[C@@H](NCc3ncoc3C(C)C)[C@H]2C1	ZINC001026329219	1324730290	/nfs/dbraw/zinc/73/02/90/1324730290.db2.gz	AAZWYDWIKHFYRA-HRCADAONSA-N	0	3	345.487	3.337	20	30		EGEDHN
CC1(C(=O)N2C[C@@H]3CC[C@@H](NCc4ccccc4C#N)[C@@H]3C2)CC=CC1	ZINC001026348263	1324744388	/nfs/dbraw/zinc/74/43/88/1324744388.db2.gz	DSQSIACDOBDKOK-XUVXKRRUSA-N	0	3	349.478	3.241	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H]3CC[C@@H](NCc4ccccc4C#N)[C@@H]3C2)C1	ZINC001026356858	1324749709	/nfs/dbraw/zinc/74/97/09/1324749709.db2.gz	YTTUUCXXGCJRBV-XUVXKRRUSA-N	0	3	349.478	3.241	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)[C@@H](C)C2CCC2)CC1	ZINC001026514142	1324860150	/nfs/dbraw/zinc/86/01/50/1324860150.db2.gz	SRQQCODFPPWMQA-GRTSSRMGSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)C2(C)CC=CC2)CC1	ZINC001026553833	1324889899	/nfs/dbraw/zinc/88/98/99/1324889899.db2.gz	WOVXOYCSLBTOHY-UHFFFAOYSA-N	0	3	341.293	3.268	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)CC2CCCCC2)C1	ZINC001026668398	1324963387	/nfs/dbraw/zinc/96/33/87/1324963387.db2.gz	OFZUMZIRNDDDMT-SFHVURJKSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H](CNCc2csc(C)n2)C1	ZINC001026864359	1325053436	/nfs/dbraw/zinc/05/34/36/1325053436.db2.gz	FKPYSBFEINFFPQ-ZDUSSCGKSA-N	0	3	341.908	3.168	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)c2coc(C)n2)C1	ZINC000963289533	1325074255	/nfs/dbraw/zinc/07/42/55/1325074255.db2.gz	JNJSCYVBXMGOLD-GOEBONIOSA-N	0	3	337.851	3.052	20	30		EGEDHN
CN(C(=O)[C@@H]1CC1(F)F)C1CCC(NCc2ccccc2C#N)CC1	ZINC000963307180	1325088902	/nfs/dbraw/zinc/08/89/02/1325088902.db2.gz	HMQRHVRQJJHRMA-JCYILVPMSA-N	0	3	347.409	3.073	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)CC(C)(F)F)C1	ZINC000963355961	1325150766	/nfs/dbraw/zinc/15/07/66/1325150766.db2.gz	AEYCLJDCUOUKDY-KBPBESRZSA-N	0	3	334.838	3.487	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N1CC[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001027048813	1325185549	/nfs/dbraw/zinc/18/55/49/1325185549.db2.gz	UFCROFSNWYOHPY-SPYBWZPUSA-N	0	3	343.446	3.072	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@@H](CNCc2ccccc2C#N)C1)c1ccccc1	ZINC001027179138	1325277545	/nfs/dbraw/zinc/27/75/45/1325277545.db2.gz	RBXSYIJLAODAJV-MSOLQXFVSA-N	0	3	347.462	3.300	20	30		EGEDHN
CCC(C)(CC)C(=O)N1CC[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001027227179	1325320520	/nfs/dbraw/zinc/32/05/20/1325320520.db2.gz	WBTJLXRFYIWKBL-HNNXBMFYSA-N	0	3	345.462	3.462	20	30		EGEDHN
C[C@H](CC(C)(C)C#N)N[C@H](Cc1ccccc1)[C@@H](O)C(F)(F)F	ZINC000925850240	1325329332	/nfs/dbraw/zinc/32/93/32/1325329332.db2.gz	GYCUHDAOSDVLEY-BPLDGKMQSA-N	0	3	328.378	3.439	20	30		EGEDHN
C[C@@H](CC(=O)N1CC[C@@H](CNCc2cc(F)ccc2C#N)C1)C1CC1	ZINC001027237584	1325331771	/nfs/dbraw/zinc/33/17/71/1325331771.db2.gz	QOYSJQSNUQWKDG-GJZGRUSLSA-N	0	3	343.446	3.072	20	30		EGEDHN
CN(Cc1ccc(C#N)c(F)c1)[C@@H]1CCCN(C(=O)C2CCCC2)C1	ZINC001027268558	1325370847	/nfs/dbraw/zinc/37/08/47/1325370847.db2.gz	SGKMNWPRHWNRFU-GOSISDBHSA-N	0	3	343.446	3.310	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)C[C@H]2C=CCC2)C1	ZINC001027290123	1325422679	/nfs/dbraw/zinc/42/26/79/1325422679.db2.gz	PISZZDSLWUEYQX-PXNSSMCTSA-N	0	3	337.467	3.337	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)C2CCC(NCc3ccn(CC)n3)CC2)C1	ZINC000963891247	1325424258	/nfs/dbraw/zinc/42/42/58/1325424258.db2.gz	QCRULJNGCVRKJI-UHFFFAOYSA-N	0	3	344.503	3.119	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)cc2)C1)C1CC1	ZINC001027352534	1325522551	/nfs/dbraw/zinc/52/25/51/1325522551.db2.gz	XACPVAKFVBJAOH-BEFAXECRSA-N	0	3	325.456	3.027	20	30		EGEDHN
Cc1coc(C(=O)NC2CC3(CC(NCc4ccccc4C#N)C3)C2)c1	ZINC000964629667	1325588614	/nfs/dbraw/zinc/58/86/14/1325588614.db2.gz	CYWWCPMECVHSNZ-UHFFFAOYSA-N	0	3	349.434	3.291	20	30		EGEDHN
CCO[C@H](C(=O)C(C#N)C(=O)Nc1cccc2ccccc21)C1CC1	ZINC000860469312	1329321026	/nfs/dbraw/zinc/32/10/26/1329321026.db2.gz	HWANWEHWIUZEBP-LPHOPBHVSA-N	0	3	336.391	3.302	20	30		EGEDHN
CC(=O)N[C@H](CC(C)C)C(=O)C(C#N)c1nc2cc(F)ccc2s1	ZINC000860533527	1329327780	/nfs/dbraw/zinc/32/77/80/1329327780.db2.gz	SVIJEIXBGGMEAA-TZMCWYRMSA-N	0	3	347.415	3.162	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)c2cc3cccc(C)c3s2)C1	ZINC001027472158	1327728206	/nfs/dbraw/zinc/72/82/06/1327728206.db2.gz	ZQKFYTHQEYHCNI-MRXNPFEDSA-N	0	3	326.465	3.379	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](N(C)CCc2csc(C)n2)C1	ZINC001027523320	1327796683	/nfs/dbraw/zinc/79/66/83/1327796683.db2.gz	IAHNURAFLDVAFU-INIZCTEOSA-N	0	3	335.517	3.129	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)c2ccccc2O[C@H](C)CC)C1	ZINC001027596651	1327948207	/nfs/dbraw/zinc/94/82/07/1327948207.db2.gz	XZOTYALHCWETDE-SJORKVTESA-N	0	3	328.456	3.034	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001027605915	1327962643	/nfs/dbraw/zinc/96/26/43/1327962643.db2.gz	YYAVDWDEGNQMHF-QFBILLFUSA-N	0	3	327.472	3.273	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)c2cc3c(s2)CCCCC3)C1	ZINC001027671024	1328066529	/nfs/dbraw/zinc/06/65/29/1328066529.db2.gz	QWDGQOUAJWELEH-MRXNPFEDSA-N	0	3	330.497	3.187	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)[C@@H](C)Cc2cccc(Cl)c2)C1	ZINC001027704241	1328118244	/nfs/dbraw/zinc/11/82/44/1328118244.db2.gz	LZGQSMDULHXXQN-MAUKXSAKSA-N	0	3	332.875	3.075	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)c2cc3cccc(Cl)c3o2)C1	ZINC001027707378	1328121511	/nfs/dbraw/zinc/12/15/11/1328121511.db2.gz	GNZOJWJJJMNFLC-CQSZACIVSA-N	0	3	330.815	3.256	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2c(F)ccc3ccncc32)C1	ZINC000966239598	1328235200	/nfs/dbraw/zinc/23/52/00/1328235200.db2.gz	WDEOGUJBELUDFX-KDOFPFPSSA-N	0	3	341.430	3.390	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2nsc3ccccc32)C1	ZINC000966296979	1328257974	/nfs/dbraw/zinc/25/79/74/1328257974.db2.gz	KUEXELWAVXKTNA-UKRRQHHQSA-N	0	3	329.469	3.313	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2cc3ccccc3nc2C)C1	ZINC000966494450	1328324670	/nfs/dbraw/zinc/32/46/70/1328324670.db2.gz	XFEWLCHVNXLWNF-YWZLYKJASA-N	0	3	335.451	3.007	20	30		EGEDHN
C#CCCN1CCC[C@@H]1CNC(=O)c1cc(Cl)sc1Cl	ZINC001027931348	1328409901	/nfs/dbraw/zinc/40/99/01/1328409901.db2.gz	FIJQPTPYYBFVRX-SNVBAGLBSA-N	0	3	331.268	3.272	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)[C@H]2CC[C@H](C3CCC3)CC2)C1	ZINC000966874181	1328447656	/nfs/dbraw/zinc/44/76/56/1328447656.db2.gz	DCDPUDSICWAODH-LEAZDLGRSA-N	0	3	330.516	3.443	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)Cc2cncc3ccccc32)C1	ZINC000966876756	1328450699	/nfs/dbraw/zinc/45/06/99/1328450699.db2.gz	ZXEPPRSMHXWZSI-UZLBHIALSA-N	0	3	337.467	3.180	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2cnc(-c3ccccc3)o2)C1	ZINC000966884705	1328452103	/nfs/dbraw/zinc/45/21/03/1328452103.db2.gz	PYHDNUXVBRZVAG-DOTOQJQBSA-N	0	3	339.439	3.358	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2cccc3ccc(C)nc32)C1	ZINC000966899316	1328461611	/nfs/dbraw/zinc/46/16/11/1328461611.db2.gz	GGXOTWSAMWTXOL-DNVCBOLYSA-N	0	3	335.451	3.007	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC2(C1)CCN(Cc1ccc(F)cc1)CC2	ZINC001050617898	1348304365	/nfs/dbraw/zinc/30/43/65/1348304365.db2.gz	NHIWKCLAUWTMIW-UHFFFAOYSA-N	0	3	330.447	3.462	20	30		EGEDHN
Cc1ccc(C#N)cc1C(=O)N[C@H](CN(C)C)c1ccc(F)cc1	ZINC000935985888	1330101763	/nfs/dbraw/zinc/10/17/63/1330101763.db2.gz	QLOPLQPDQYNBIC-GOSISDBHSA-N	0	3	325.387	3.039	20	30		EGEDHN
C#CCOc1ccc(C(=O)Nc2ccc(CN(C)C)cc2OC)cc1	ZINC000868814871	1330351489	/nfs/dbraw/zinc/35/14/89/1330351489.db2.gz	KQAUEUMFGGFZPQ-UHFFFAOYSA-N	0	3	338.407	3.021	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](NC(=O)c2cccc3nc[nH]c32)C(C)(C)C1	ZINC000941119519	1331339999	/nfs/dbraw/zinc/33/99/99/1331339999.db2.gz	JDLVFHNXQIYKPP-OAHLLOKOSA-N	0	3	346.862	3.146	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CCN(Cc2ccsc2)C[C@@H]1C	ZINC000942128130	1331841309	/nfs/dbraw/zinc/84/13/09/1331841309.db2.gz	CDKWFYRVRMTYSO-RDJZCZTQSA-N	0	3	343.496	3.376	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)[C@H]2CC[C@H](C3CCC3)CC2)[C@H](C)C1	ZINC000942145279	1331846845	/nfs/dbraw/zinc/84/68/45/1331846845.db2.gz	YFCQNHIKLAFMGL-VBSBHUPXSA-N	0	3	330.516	3.443	20	30		EGEDHN
C[C@H]1CN(Cc2cccc(C#N)c2)CC[C@@H]1NC(=O)C1(C2CC2)CC1	ZINC000942161823	1331852804	/nfs/dbraw/zinc/85/28/04/1331852804.db2.gz	SVLUHFPWHOZGQV-KXBFYZLASA-N	0	3	337.467	3.075	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)c3ccccc3n2)[C@H](C)C1	ZINC000942181183	1331864643	/nfs/dbraw/zinc/86/46/43/1331864643.db2.gz	QRBNKHBUASGWJH-SJLPKXTDSA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(F)cc3ccoc32)[C@@H](C)C1	ZINC000942199783	1331875555	/nfs/dbraw/zinc/87/55/55/1331875555.db2.gz	HMUXMXSKNGOJCX-GUYCJALGSA-N	0	3	328.387	3.035	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc(CC(C)C)cc2)[C@H](C)C1	ZINC000942346080	1331908372	/nfs/dbraw/zinc/90/83/72/1331908372.db2.gz	XANJXAALBLXWQL-WIYYLYMNSA-N	0	3	340.511	3.278	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cn(CC)c3ccccc23)[C@H](C)C1	ZINC000942390751	1331920666	/nfs/dbraw/zinc/92/06/66/1331920666.db2.gz	BSFVURSDNHZUOK-VQIMIIECSA-N	0	3	337.467	3.125	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(-c3ccco3)o2)[C@@H](C)C1	ZINC000942442951	1331935085	/nfs/dbraw/zinc/93/50/85/1331935085.db2.gz	BNSDFPGSIQHBJC-LSDHHAIUSA-N	0	3	326.396	3.003	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnc3c(F)cccc3c2)[C@@H](C)C1	ZINC000942497701	1331947099	/nfs/dbraw/zinc/94/70/99/1331947099.db2.gz	ULOBPCWDBTUKDB-SUMWQHHRSA-N	0	3	327.403	3.000	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)c(Cl)cc2C)[C@H](C)C1	ZINC000942556273	1331971591	/nfs/dbraw/zinc/97/15/91/1331971591.db2.gz	YPTMJLAVKBKLOO-QAPCUYQASA-N	0	3	332.875	3.420	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc3cccc(OC)c3o2)[C@H](C)C1	ZINC000942581960	1331988721	/nfs/dbraw/zinc/98/87/21/1331988721.db2.gz	PXOIEPAGUGACKQ-HIFRSBDPSA-N	0	3	328.412	3.068	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(F)c(Cl)cc2F)[C@H](C)C1	ZINC000942585393	1331990851	/nfs/dbraw/zinc/99/08/51/1331990851.db2.gz	DSSRSIQRBTYLEY-MEBBXXQBSA-N	0	3	328.790	3.244	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3ccc(C)nc3C)C[C@H]2C)C1	ZINC000942603434	1332001096	/nfs/dbraw/zinc/00/10/96/1332001096.db2.gz	XNOGVLUSORTOGE-DNVCBOLYSA-N	0	3	341.499	3.381	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc(C(F)F)c(F)c2)[C@@H](C)C1	ZINC000942822405	1332043003	/nfs/dbraw/zinc/04/30/03/1332043003.db2.gz	KJSVYGUPOGYWRQ-NHYWBVRUSA-N	0	3	326.362	3.390	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(F)c3ncccc3c2)[C@@H](C)C1	ZINC000943648631	1332228819	/nfs/dbraw/zinc/22/88/19/1332228819.db2.gz	VLCQJGVIINVHNQ-GUYCJALGSA-N	0	3	327.403	3.000	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3ccccc3F)CCC2)[C@H](C)C1	ZINC000944099227	1332325962	/nfs/dbraw/zinc/32/59/62/1332325962.db2.gz	QHTYPKLJMHABJP-VQIMIIECSA-N	0	3	342.458	3.097	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](C)C1	ZINC000944303108	1332367218	/nfs/dbraw/zinc/36/72/18/1332367218.db2.gz	AWOUACGNAOYJPN-BBRMVZONSA-N	0	3	338.373	3.169	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)CC23CC4CC(CC(C4)C2)C3)[C@H](C)C1	ZINC000944306507	1332368670	/nfs/dbraw/zinc/36/86/70/1332368670.db2.gz	RUWZUXPELYJFRN-YKOJYSHRSA-N	0	3	342.527	3.443	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)CCc3ccoc3)CC[C@@H]2C1	ZINC000946545555	1332851833	/nfs/dbraw/zinc/85/18/33/1332851833.db2.gz	RNBXESGNVRTBOJ-CALCHBBNSA-N	0	3	336.863	3.135	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2CN(Cc3nocc3C)C[C@H]2CC1	ZINC000946714473	1332882640	/nfs/dbraw/zinc/88/26/40/1332882640.db2.gz	XDLOVEZZULLYKF-CALCHBBNSA-N	0	3	345.487	3.256	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3c3ccco3)CC[C@@H]2C1	ZINC000946792649	1332900432	/nfs/dbraw/zinc/90/04/32/1332900432.db2.gz	QCHJREQQBCFDBA-YYIAUSFCSA-N	0	3	348.874	3.306	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3c[nH]cc3C3CC3)CC[C@@H]2C1	ZINC000946843030	1332912023	/nfs/dbraw/zinc/91/20/23/1332912023.db2.gz	PEUONDBBOXAJFR-IYBDPMFKSA-N	0	3	347.890	3.429	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cscc2C(F)F)C[C@H]1C	ZINC000947318194	1333086955	/nfs/dbraw/zinc/08/69/55/1333086955.db2.gz	FKFOONKSTSDJEJ-VXGBXAGGSA-N	0	3	326.412	3.292	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccccc2-c2ccncc2)C[C@@H]1C	ZINC000947442132	1333128655	/nfs/dbraw/zinc/12/86/55/1333128655.db2.gz	QDRQKDSMKWQZAD-PKOBYXMFSA-N	0	3	347.462	3.355	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(C)CCC(F)(F)CC2)C[C@@H]1C	ZINC000947460847	1333137988	/nfs/dbraw/zinc/13/79/88/1333137988.db2.gz	ZXFXYXOQJFJOCL-GJZGRUSLSA-N	0	3	326.431	3.194	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cccc(C(C)C)c2)C[C@@H]1C	ZINC000947498765	1333147886	/nfs/dbraw/zinc/14/78/86/1333147886.db2.gz	YQVIVUKTGVYYQL-PXNSSMCTSA-N	0	3	326.484	3.345	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2cc3ccccc3s2)C[C@H]1C	ZINC000947540355	1333164194	/nfs/dbraw/zinc/16/41/94/1333164194.db2.gz	RZWSTEZMIQOOLH-ZBFHGGJFSA-N	0	3	326.465	3.046	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)[C@H]2C[C@H]3C[C@H]3C2)CCN1Cc1cccc(C#N)c1	ZINC000947639133	1333204542	/nfs/dbraw/zinc/20/45/42/1333204542.db2.gz	MOKVSVZJGQHWSE-JIKAWYKTSA-N	0	3	337.467	3.073	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCN(CCc3ccns3)[C@H](C)C2)CC1	ZINC000947685941	1333222516	/nfs/dbraw/zinc/22/25/16/1333222516.db2.gz	QPWZRZVPEWHTBN-NVXWUHKLSA-N	0	3	347.528	3.401	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)C2CC3(CC3)C2)CCN1Cc1ccc(C#N)cc1	ZINC000947701304	1333230390	/nfs/dbraw/zinc/23/03/90/1333230390.db2.gz	AEWGIVMTQYLDHE-HNAYVOBHSA-N	0	3	337.467	3.218	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3scnc3C)[C@@H](C)C2)C1	ZINC000947702889	1333232993	/nfs/dbraw/zinc/23/29/93/1333232993.db2.gz	UJNBSZHTJWPQKV-DZGCQCFKSA-N	0	3	333.501	3.277	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(-c3ccccc3)ccn2)C[C@@H]1C	ZINC000947857784	1333283193	/nfs/dbraw/zinc/28/31/93/1333283193.db2.gz	RQMWLLWHNSGXKX-PXNSSMCTSA-N	0	3	347.462	3.355	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(-c3ccccc3)ccn2)C[C@H]1C	ZINC000947857786	1333283222	/nfs/dbraw/zinc/28/32/22/1333283222.db2.gz	RQMWLLWHNSGXKX-YLJYHZDGSA-N	0	3	347.462	3.355	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2[nH]c3ccc(C)cc3c2C)C[C@@H]1C	ZINC000947878164	1333288835	/nfs/dbraw/zinc/28/88/35/1333288835.db2.gz	LPASXOMXSNXNPS-DOTOQJQBSA-N	0	3	337.467	3.391	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2c[nH]nc2C2CCCCC2)C[C@H]1C	ZINC000947917151	1333306699	/nfs/dbraw/zinc/30/66/99/1333306699.db2.gz	VMXUTVIXQNOELJ-GDBMZVCRSA-N	0	3	330.476	3.226	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)[C@@]2(c3ccccc3)C[C@H](F)C2)C[C@@H]1C	ZINC000947980970	1333330467	/nfs/dbraw/zinc/33/04/67/1333330467.db2.gz	SLLWDUZAEZGOCX-ROPHOZQPSA-N	0	3	342.458	3.049	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2sccc2C(F)F)C[C@H]1C	ZINC000947984207	1333331104	/nfs/dbraw/zinc/33/11/04/1333331104.db2.gz	GCORKOTUAWLEDA-NEPJUHHUSA-N	0	3	326.412	3.292	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2coc3cc(C)ccc23)C[C@@H]1C	ZINC000948002097	1333338699	/nfs/dbraw/zinc/33/86/99/1333338699.db2.gz	KMQJQAGULAUYEN-WMZOPIPTSA-N	0	3	338.451	3.276	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C23CC(c4ccccc4)(C2)C3)C[C@H]1C	ZINC000948078607	1333368139	/nfs/dbraw/zinc/36/81/39/1333368139.db2.gz	MJYOAJHRNMYSCV-AZIUHJDESA-N	0	3	336.479	3.101	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2cccc(OC(C)C)c2)C[C@@H]1C	ZINC000948083769	1333370959	/nfs/dbraw/zinc/37/09/59/1333370959.db2.gz	YQNINQOBQBSSSD-PKOBYXMFSA-N	0	3	342.483	3.009	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cccc3c2OCC3(C)C)C[C@H]1C	ZINC000948104282	1333375237	/nfs/dbraw/zinc/37/52/37/1333375237.db2.gz	KZGCSBGHFAPSME-HUUCEWRRSA-N	0	3	328.456	3.125	20	30		EGEDHN
CN(C(=O)c1ccccn1)[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948133290	1333385657	/nfs/dbraw/zinc/38/56/57/1333385657.db2.gz	WLXKOSNGXKBYRO-LJQANCHMSA-N	0	3	348.450	3.080	20	30		EGEDHN
CN(C(=O)[C@H]1CC1(F)F)[C@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948355454	1333491112	/nfs/dbraw/zinc/49/11/12/1333491112.db2.gz	ZMLKAGSKCOWKFT-DLBZAZTESA-N	0	3	347.409	3.026	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2nsc3ccccc32)CC1	ZINC000948401432	1333511654	/nfs/dbraw/zinc/51/16/54/1333511654.db2.gz	MOEZFUDSCWTHLK-HNNXBMFYSA-N	0	3	341.480	3.246	20	30		EGEDHN
C=CCn1cccc1C(=O)N(C)[C@H]1CCCN(C[C@@H](F)CC)CC1	ZINC000948439545	1333525791	/nfs/dbraw/zinc/52/57/91/1333525791.db2.gz	RHDFMOBBTGERSI-IRXDYDNUSA-N	0	3	335.467	3.349	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)[C@H]2CCCc3ccccc32)CC1	ZINC000948547250	1333568047	/nfs/dbraw/zinc/56/80/47/1333568047.db2.gz	VEEZIKRKFMCGKC-CTNGQTDRSA-N	0	3	338.495	3.443	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)Cc2cccc(C(C)C)c2)CC1	ZINC000948587277	1333586068	/nfs/dbraw/zinc/58/60/68/1333586068.db2.gz	VRUYJHDHRYMVPD-HXUWFJFHSA-N	0	3	326.484	3.299	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2ccc3cc(C)ccc3n2)CC1	ZINC000948606062	1333593499	/nfs/dbraw/zinc/59/34/99/1333593499.db2.gz	YYJUQUAVSYRTBS-LJQANCHMSA-N	0	3	349.478	3.493	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)Cc2cccc3ncccc23)CC1	ZINC000948613342	1333597168	/nfs/dbraw/zinc/59/71/68/1333597168.db2.gz	XXXSMAJENZKVND-IBGZPJMESA-N	0	3	349.478	3.114	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccc(F)cc2F)CC1	ZINC000948642810	1333608947	/nfs/dbraw/zinc/60/89/47/1333608947.db2.gz	OANDYBMMVAPUQI-RYQLBKOJSA-N	0	3	346.421	3.014	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)[C@H](C)c2ccc(Cl)cc2)CC1	ZINC000948742485	1333654857	/nfs/dbraw/zinc/65/48/57/1333654857.db2.gz	KYRBWMOSMLQDAY-QAPCUYQASA-N	0	3	332.875	3.390	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@@H]1CNC(=O)c1cscn1	ZINC000948899443	1333725534	/nfs/dbraw/zinc/72/55/34/1333725534.db2.gz	WYHZLWGLWWTPHF-SFHVURJKSA-N	0	3	341.480	3.439	20	30		EGEDHN
CCCCN1CCc2ccccc2[C@@H]1CNC(=O)c1cc(C#N)c[nH]1	ZINC000948901807	1333726182	/nfs/dbraw/zinc/72/61/82/1333726182.db2.gz	DIGBRBZKQLQNOU-IBGZPJMESA-N	0	3	336.439	3.016	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@H]1c2ccccc2CCN1CC1CC1	ZINC000948923678	1333736626	/nfs/dbraw/zinc/73/66/26/1333736626.db2.gz	PPSRLHSJGDUANP-NRFANRHFSA-N	0	3	349.478	3.413	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@H]1CNC(=O)[C@H]1CCC1(F)F	ZINC000948933058	1333738781	/nfs/dbraw/zinc/73/87/81/1333738781.db2.gz	TYDZAYWWVSYRES-IAGOWNOFSA-N	0	3	334.410	3.323	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2c3ccccc3CCN2CCCC)nc1	ZINC000948979689	1333755981	/nfs/dbraw/zinc/75/59/81/1333755981.db2.gz	ZWBPITKTKQHHGT-NRFANRHFSA-N	0	3	347.462	3.192	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@H]1CCCCC1(C)C)CCO2	ZINC000949258295	1333805492	/nfs/dbraw/zinc/80/54/92/1333805492.db2.gz	VPBRVRZCVJRWMF-GOSISDBHSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C3C(C)(C)C3(C)C)CC2)C1	ZINC000949332928	1333826075	/nfs/dbraw/zinc/82/60/75/1333826075.db2.gz	YFZUXQDZEHTUBY-UHFFFAOYSA-N	0	3	348.531	3.328	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@@H]3CCC[C@@H](C)C3)CC2)C1	ZINC000949455235	1333851552	/nfs/dbraw/zinc/85/15/52/1333851552.db2.gz	XQEGHNDCOYBUMX-RTBURBONSA-N	0	3	348.531	3.472	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2cc3c([nH]2)c(F)ccc3C)C1	ZINC000967064528	1335653045	/nfs/dbraw/zinc/65/30/45/1335653045.db2.gz	UQBZTBKBEIOXTK-KBXCAEBGSA-N	0	3	341.430	3.079	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2coc3cc(F)ccc23)C1	ZINC000967093109	1335661655	/nfs/dbraw/zinc/66/16/55/1335661655.db2.gz	YQNPGFOFRFNLHH-GUYCJALGSA-N	0	3	328.387	3.035	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)Cc2ccc3cnccc3c2)C1	ZINC000967293183	1335692676	/nfs/dbraw/zinc/69/26/76/1335692676.db2.gz	VGBRUUFRHHLBBW-OXQOHEQNSA-N	0	3	337.467	3.180	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](C)[C@@H](NC(=O)c2nc3c(s2)CCC3)C1	ZINC000967376605	1335719015	/nfs/dbraw/zinc/71/90/15/1335719015.db2.gz	INNXYECXKMNHFW-HIFRSBDPSA-N	0	3	333.501	3.038	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2cnc3ccccc3c2C)C1	ZINC000967410021	1335729521	/nfs/dbraw/zinc/72/95/21/1335729521.db2.gz	XHCIUCMCWRWFKU-YWZLYKJASA-N	0	3	335.451	3.007	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)Cc2cc(F)c(F)cc2F)C1	ZINC000968354443	1335899292	/nfs/dbraw/zinc/89/92/92/1335899292.db2.gz	SVKDJYMEELCXDW-SJCJKPOMSA-N	0	3	340.389	3.049	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)Cc2ccc(C(C)(C)C)cc2)C1	ZINC000968354465	1335899719	/nfs/dbraw/zinc/89/97/19/1335899719.db2.gz	SZOKSPGQAQDAER-YLJYHZDGSA-N	0	3	340.511	3.377	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(Cl)c(OC)c2)C1	ZINC000968389893	1335916423	/nfs/dbraw/zinc/91/64/23/1335916423.db2.gz	BWRSVPYRBOYGKO-CJNGLKHVSA-N	0	3	336.863	3.365	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)Cc2cccc3sccc32)C1	ZINC000968396256	1335918949	/nfs/dbraw/zinc/91/89/49/1335918949.db2.gz	ZTFFDTIDCLPGMG-CRAIPNDOSA-N	0	3	340.492	3.294	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)Cc2cccc3sccc32)C1	ZINC000968396257	1335918978	/nfs/dbraw/zinc/91/89/78/1335918978.db2.gz	ZTFFDTIDCLPGMG-MAUKXSAKSA-N	0	3	340.492	3.294	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2cccc3c2ccn3C)C1	ZINC000968423636	1335925645	/nfs/dbraw/zinc/92/56/45/1335925645.db2.gz	VCTSRWPYRWFKSY-CRAIPNDOSA-N	0	3	325.456	3.195	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccc3nc(C)sc3c2)C1	ZINC000968503903	1335944525	/nfs/dbraw/zinc/94/45/25/1335944525.db2.gz	CEEYUFHAEVXCQJ-CXAGYDPISA-N	0	3	341.480	3.068	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](C)[C@H](NC(=O)c2sccc2COC)C1	ZINC000968539985	1335956987	/nfs/dbraw/zinc/95/69/87/1335956987.db2.gz	RYPOHFMFPSBZLN-GDBMZVCRSA-N	0	3	336.501	3.301	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CN(Cc3cccc(C)c3)CC[C@H]2C)nc1	ZINC000968548536	1335959254	/nfs/dbraw/zinc/95/92/54/1335959254.db2.gz	GLGAEBGVLKFFFC-UTKZUKDTSA-N	0	3	347.462	3.012	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)C(C)(C)c2ccc(C)cc2)C1	ZINC000968556557	1335960643	/nfs/dbraw/zinc/96/06/43/1335960643.db2.gz	BGIYSJFGUMPZQP-PKOBYXMFSA-N	0	3	326.484	3.123	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1csc([C@@H]2CCCO2)n1	ZINC000968856111	1336069726	/nfs/dbraw/zinc/06/97/26/1336069726.db2.gz	DYSSEMBXSUKQFP-HOCLYGCPSA-N	0	3	349.500	3.155	20	30		EGEDHN
N#Cc1ccc(CN2CCCCC[C@@H]2CNC(=O)c2cc[nH]c2)cc1	ZINC000968871028	1336073902	/nfs/dbraw/zinc/07/39/02/1336073902.db2.gz	IWSVIOYDKPTOKF-LJQANCHMSA-N	0	3	336.439	3.061	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)[C@H]1CCc2cc(OC)ccc21	ZINC000968884752	1336079554	/nfs/dbraw/zinc/07/95/54/1336079554.db2.gz	BGQDTTZXRFHVCZ-XLIONFOSSA-N	0	3	342.483	3.272	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1cnc2ccccc2n1	ZINC000968887820	1336080838	/nfs/dbraw/zinc/08/08/38/1336080838.db2.gz	NFQDIGDPQRXGDK-MRXNPFEDSA-N	0	3	338.455	3.180	20	30		EGEDHN
C#CCN1CCCCC[C@H]1CNC(=O)c1cccc2c(C)c(C)[nH]c21	ZINC000968916596	1336087186	/nfs/dbraw/zinc/08/71/86/1336087186.db2.gz	DTZZURVIICQUSE-KRWDZBQOSA-N	0	3	337.467	3.392	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1c2c[nH]nc2ccc1C	ZINC000968925754	1336092479	/nfs/dbraw/zinc/09/24/79/1336092479.db2.gz	MBDIZQIQMFNUFW-OAHLLOKOSA-N	0	3	326.444	3.032	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)[C@@H]1C[C@]1(C)c1ccccc1	ZINC000968957558	1336102689	/nfs/dbraw/zinc/10/26/89/1336102689.db2.gz	LRIJIGVCWJOHNN-RZUBCFFCSA-N	0	3	338.495	3.348	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cnc2ccsc2c1	ZINC000968977247	1336107059	/nfs/dbraw/zinc/10/70/59/1336107059.db2.gz	QCVAXCVEOVJIAI-OAHLLOKOSA-N	0	3	329.469	3.457	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccc(N2CC=CC2)cc1	ZINC000969024654	1336120504	/nfs/dbraw/zinc/12/05/04/1336120504.db2.gz	CPXIQLQJBVDODF-FQEVSTJZSA-N	0	3	339.483	3.223	20	30		EGEDHN
N#Cc1cc(CN[C@@H]2CCN(C(=O)C[C@H]3C=CCCC3)C2)ccc1F	ZINC000969063674	1336135717	/nfs/dbraw/zinc/13/57/17/1336135717.db2.gz	UXMSAIBGYXXEQH-MAUKXSAKSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1	ZINC000969158165	1336165834	/nfs/dbraw/zinc/16/58/34/1336165834.db2.gz	CYOLRTWPIYDBIZ-INIZCTEOSA-N	0	3	343.431	3.009	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccc(N(C)CC)cc1	ZINC000969165538	1336169232	/nfs/dbraw/zinc/16/92/32/1336169232.db2.gz	ZYIXEOZBAFMYGY-IBGZPJMESA-N	0	3	329.488	3.303	20	30		EGEDHN
N#Cc1cc(CN[C@@H]2CCN(C(=O)C3(F)CCCCC3)C2)ccc1F	ZINC000970406585	1336304840	/nfs/dbraw/zinc/30/48/40/1336304840.db2.gz	WAMVICQVBAUHTF-MRXNPFEDSA-N	0	3	347.409	3.060	20	30		EGEDHN
CN(C(=O)[C@@H]1CCC1(C)C)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001005847039	1336408620	/nfs/dbraw/zinc/40/86/20/1336408620.db2.gz	GBGSQGXPFFMVCT-IBGZPJMESA-N	0	3	339.483	3.417	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)Cc2ccc(OC(C)C)cc2)CC1	ZINC001006436577	1336506034	/nfs/dbraw/zinc/50/60/34/1336506034.db2.gz	ZNYODZFNLJXYRJ-UHFFFAOYSA-N	0	3	330.472	3.125	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2c(Cl)cccc2OC)CC1	ZINC001006445573	1336507445	/nfs/dbraw/zinc/50/74/45/1336507445.db2.gz	JYSOMYLVPFGMAZ-UHFFFAOYSA-N	0	3	336.863	3.461	20	30		EGEDHN
C=C(C)CCN1CCC[C@H](NC(=O)c2c(C)noc2C(F)F)C1	ZINC001007594902	1336674080	/nfs/dbraw/zinc/67/40/80/1336674080.db2.gz	CHVUJQZGHAOVRX-LBPRGKRZSA-N	0	3	327.375	3.081	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CCCN(Cc3cc(C)ccc3C)C2)c1	ZINC001008469380	1336864638	/nfs/dbraw/zinc/86/46/38/1336864638.db2.gz	QFRINHXCOZVBPB-OAQYLSRUSA-N	0	3	347.462	3.074	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)Cc2csc(C(C)(C)C)n2)C1	ZINC001008874772	1336936223	/nfs/dbraw/zinc/93/62/23/1336936223.db2.gz	JTLZINSBYYFGKN-CQSZACIVSA-N	0	3	335.517	3.140	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2ccnc(O[C@@H](C)CC)c2)C1	ZINC001009135340	1336974671	/nfs/dbraw/zinc/97/46/71/1336974671.db2.gz	YQRLEALTQKQUPM-DOTOQJQBSA-N	0	3	331.460	3.029	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN([C@@H](C)c3ccccc3C)C2)cn1	ZINC001009273140	1336995204	/nfs/dbraw/zinc/99/52/04/1336995204.db2.gz	DFTNFOBXEYXSEN-FXAWDEMLSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2c(C)c(F)ccc2Cl)CC1	ZINC001016694729	1338693929	/nfs/dbraw/zinc/69/39/29/1338693929.db2.gz	GZHOSQPKNYAOLF-OAHLLOKOSA-N	0	3	334.822	3.005	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2c(C)c(F)ccc2Cl)CC1	ZINC001016696455	1338694031	/nfs/dbraw/zinc/69/40/31/1338694031.db2.gz	YGPCGGJVXFOLTI-MRXNPFEDSA-N	0	3	348.849	3.395	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(Cl)cc2C)CC1	ZINC001016803139	1338731721	/nfs/dbraw/zinc/73/17/21/1338731721.db2.gz	JLHXNAODZNDGHC-KRWDZBQOSA-N	0	3	330.859	3.256	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC23CCN(CCC(F)(F)F)CC3)C1	ZINC001016818006	1338737015	/nfs/dbraw/zinc/73/70/15/1338737015.db2.gz	QWSLYHKGWPRRNY-ZDUSSCGKSA-N	0	3	330.394	3.266	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@H]3NC(=O)[C@@H]3C[C@H]3C3CC3)CC2)c1	ZINC001016871038	1338754224	/nfs/dbraw/zinc/75/42/24/1338754224.db2.gz	VKBLMICPZHEXOV-XUVXKRRUSA-N	0	3	349.478	3.075	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2csc(C(C)(C)C)n2)CC1	ZINC001016876207	1338755943	/nfs/dbraw/zinc/75/59/43/1338755943.db2.gz	GCWBMULMDFEZDU-OAHLLOKOSA-N	0	3	345.512	3.048	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)C[C@@H]2CCCc3ccccc32)CC1	ZINC001016940633	1338777507	/nfs/dbraw/zinc/77/75/07/1338777507.db2.gz	SRGRPHRBJWXNCK-ICSRJNTNSA-N	0	3	336.479	3.101	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2cc(Cl)ccc2Cl)CC1	ZINC001016945927	1338779760	/nfs/dbraw/zinc/77/97/60/1338779760.db2.gz	FPRYGEDBCYZKGW-HNNXBMFYSA-N	0	3	337.250	3.211	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cc(C)c(F)cc2Cl)CC1	ZINC001016949110	1338781835	/nfs/dbraw/zinc/78/18/35/1338781835.db2.gz	AHOOEGYBHHEURC-QGZVFWFLSA-N	0	3	348.849	3.395	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)[C@H](C)c2ccc(F)cc2F)CC1	ZINC001016984811	1338792294	/nfs/dbraw/zinc/79/22/94/1338792294.db2.gz	GPMLMVVVENKWFD-RDTXWAMCSA-N	0	3	346.421	3.062	20	30		EGEDHN
CC(C)c1cccc(CN(C)C[C@@H]2CCCN(C(=O)[C@@H](C)C#N)C2)n1	ZINC001017076146	1338849129	/nfs/dbraw/zinc/84/91/29/1338849129.db2.gz	FLWWCAGMRUNWEG-IRXDYDNUSA-N	0	3	342.487	3.035	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCCN(C(=O)[C@@H]2CC2(C)C)C1	ZINC001017106465	1338870248	/nfs/dbraw/zinc/87/02/48/1338870248.db2.gz	HVTIASHCWFZGPG-PBHICJAKSA-N	0	3	345.512	3.336	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H](CN(C)Cc2cccnc2)C1	ZINC001017197034	1338942740	/nfs/dbraw/zinc/94/27/40/1338942740.db2.gz	MNTQVMHHRNYGCN-QUCCMNQESA-N	0	3	329.488	3.354	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H](CN(C)Cc3scnc3C)C2)C1	ZINC001017208485	1338955152	/nfs/dbraw/zinc/95/51/52/1338955152.db2.gz	SFCGYLKOGMGZOQ-INIZCTEOSA-N	0	3	347.528	3.478	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc(C)cc1Cl	ZINC001017671586	1339388239	/nfs/dbraw/zinc/38/82/39/1339388239.db2.gz	WSWLUUMODHSHBN-CALCHBBNSA-N	0	3	332.875	3.442	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1cc(F)c(C)cc1F	ZINC001017767732	1339413917	/nfs/dbraw/zinc/41/39/17/1339413917.db2.gz	RNVDGUXJXHZBLZ-IYBDPMFKSA-N	0	3	334.410	3.067	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1csc(C2CC2)n1	ZINC001018032520	1339486933	/nfs/dbraw/zinc/48/69/33/1339486933.db2.gz	HISTVNGRJJAMDK-CALCHBBNSA-N	0	3	345.512	3.204	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cn1cc(C)c2ccccc21	ZINC001018060646	1339492285	/nfs/dbraw/zinc/49/22/85/1339492285.db2.gz	XVBXPSPJVLBQRY-HDICACEKSA-N	0	3	337.467	3.201	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@H]1OCc2ccccc21	ZINC001018225204	1339539347	/nfs/dbraw/zinc/53/93/47/1339539347.db2.gz	APQPPQNQTVBPMH-WSTZPKSXSA-N	0	3	340.467	3.289	20	30		EGEDHN
C[C@H](N[C@H]1CCN(C(=O)C#CC2CC2)C1)c1ccc(F)c(Cl)c1	ZINC001018819210	1339734722	/nfs/dbraw/zinc/73/47/22/1339734722.db2.gz	QADNLVRAUHSMSZ-WFASDCNBSA-N	0	3	334.822	3.144	20	30		EGEDHN
C[C@@]1(C(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)CC=CCC1	ZINC001018906343	1339749218	/nfs/dbraw/zinc/74/92/18/1339749218.db2.gz	LLNPPCBXOJQRAV-KBXCAEBGSA-N	0	3	329.469	3.057	20	30		EGEDHN
C#CCCN1CCC[C@@H]1CNC(=O)c1ccccc1O[C@@H](C)CC	ZINC001028171314	1340466571	/nfs/dbraw/zinc/46/65/71/1340466571.db2.gz	FACLFDUWEVVKJV-DLBZAZTESA-N	0	3	328.456	3.081	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1cnn(C(C)C)c1C1CC1	ZINC001028253094	1340513945	/nfs/dbraw/zinc/51/39/45/1340513945.db2.gz	OIYURZOAWCXDSP-MRXNPFEDSA-N	0	3	330.476	3.112	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCCN2Cc2cc(C)cc(C)c2)nc1	ZINC001028268815	1340523141	/nfs/dbraw/zinc/52/31/41/1340523141.db2.gz	AXNCQNFFOBVBSN-FQEVSTJZSA-N	0	3	347.462	3.074	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1cccc(F)c1F	ZINC001028327324	1340567369	/nfs/dbraw/zinc/56/73/69/1340567369.db2.gz	YMACXYPKZPRFJR-VNQPRFMTSA-N	0	3	334.410	3.225	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)c2ccccc2CC(C)(C)C)C1	ZINC001028618188	1340726972	/nfs/dbraw/zinc/72/69/72/1340726972.db2.gz	QGSZTVHHBXXKKV-QGZVFWFLSA-N	0	3	326.484	3.350	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CCN(Cc3sc(C)nc3C)C2)CC1	ZINC001028780522	1340812950	/nfs/dbraw/zinc/81/29/50/1340812950.db2.gz	KKDVJIYRMUIGMU-MRXNPFEDSA-N	0	3	347.528	3.444	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CCN(Cc3c(C)onc3CC)C2)CC1	ZINC001028781315	1340813849	/nfs/dbraw/zinc/81/38/49/1340813849.db2.gz	UIPYZLDTOLEKPT-MRXNPFEDSA-N	0	3	345.487	3.230	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CCN(Cc3cnccc3C)C2)CC1	ZINC001028781444	1340814045	/nfs/dbraw/zinc/81/40/45/1340814045.db2.gz	WIHWVCZNCOGERQ-QGZVFWFLSA-N	0	3	327.472	3.075	20	30		EGEDHN
C=Cc1ccc(C(=O)NC[C@H]2CCN(Cc3ccc(C#N)cc3)C2)cc1	ZINC001028822026	1340836367	/nfs/dbraw/zinc/83/63/67/1340836367.db2.gz	KNXLTTQNZZDBJW-HXUWFJFHSA-N	0	3	345.446	3.453	20	30		EGEDHN
Cc1cccc(C(=O)NC[C@@H]2CCN(Cc3ccc(C#N)cc3)C2)c1C	ZINC001028964850	1340894866	/nfs/dbraw/zinc/89/48/66/1340894866.db2.gz	SEVHOEBCQVWIFB-FQEVSTJZSA-N	0	3	347.462	3.427	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)C1CCN(C(=O)CC2CC2)CC1	ZINC001029039693	1340914810	/nfs/dbraw/zinc/91/48/10/1340914810.db2.gz	FPZACFPAYLXZAR-OAHLLOKOSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC([C@@H](C)NCc2cc(C)n(C)n2)CC1	ZINC001029136919	1340940044	/nfs/dbraw/zinc/94/00/44/1340940044.db2.gz	NZILLBIXMXMUFF-UZLBHIALSA-N	0	3	346.519	3.048	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](CN(C)Cc2cncc(F)c2)C1	ZINC001029797813	1341076173	/nfs/dbraw/zinc/07/61/73/1341076173.db2.gz	BBNOXYDNEIRUDE-OAHLLOKOSA-N	0	3	333.451	3.103	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](CN(C)Cc2c(C)onc2CC)C1	ZINC001029798375	1341076576	/nfs/dbraw/zinc/07/65/76/1341076576.db2.gz	JRUCPVJAULNJSP-MRXNPFEDSA-N	0	3	347.503	3.428	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](CN(C)Cc2oc(CCC)nc2C)C1	ZINC001029801324	1341077358	/nfs/dbraw/zinc/07/73/58/1341077358.db2.gz	LDKMBWDUQPQHGE-MRXNPFEDSA-N	0	3	347.503	3.428	20	30		EGEDHN
CC(C)C1(C(=O)N2CC[C@H](CN(C)Cc3ccc(C#N)s3)C2)CC1	ZINC001029832742	1341090607	/nfs/dbraw/zinc/09/06/07/1341090607.db2.gz	VDTNDPXEONSMTD-OAHLLOKOSA-N	0	3	345.512	3.336	20	30		EGEDHN
C=C[C@@H](C(=O)N1CC[C@@H](CN(C)Cc2cccnc2)C1)c1ccccc1	ZINC001029906834	1341111809	/nfs/dbraw/zinc/11/18/09/1341111809.db2.gz	AFGSYIKOVZJZID-PZJWPPBQSA-N	0	3	349.478	3.332	20	30		EGEDHN
C=C[C@H](C(=O)N1CC[C@@H](CN(C)Cc2ccccn2)C1)c1ccccc1	ZINC001029907956	1341112495	/nfs/dbraw/zinc/11/24/95/1341112495.db2.gz	WJQIXZDPLIFHFJ-RXVVDRJESA-N	0	3	349.478	3.332	20	30		EGEDHN
C#CCCN1CCC[C@@H](N(Cc2ccccc2)C(=O)c2cc[nH]c2C)C1	ZINC001029916833	1341116778	/nfs/dbraw/zinc/11/67/78/1341116778.db2.gz	DNPHERLVKXHNRB-HXUWFJFHSA-N	0	3	349.478	3.453	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)N1CCC(CN(C)Cc2ccc(C#N)cc2F)CC1	ZINC001029931408	1341125191	/nfs/dbraw/zinc/12/51/91/1341125191.db2.gz	NXGCRJASGIHKBS-RDTXWAMCSA-N	0	3	343.446	3.024	20	30		EGEDHN
C[C@H]1C[C@H]1C(=O)N1CCC(CN(C)Cc2cc(C#N)ccc2F)CC1	ZINC001029931219	1341125303	/nfs/dbraw/zinc/12/53/03/1341125303.db2.gz	NOSNEKNFIQGHCZ-KBXCAEBGSA-N	0	3	343.446	3.024	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC(CN(C)Cc2ccc(C#N)s2)CC1	ZINC001029937472	1341128633	/nfs/dbraw/zinc/12/86/33/1341128633.db2.gz	OBGVXWRMWLMNTN-AWEZNQCLSA-N	0	3	333.501	3.336	20	30		EGEDHN
CC(C)C(=O)N1CCC(CN(C)Cc2ccc(C#N)cc2F)CC1	ZINC001029937186	1341128672	/nfs/dbraw/zinc/12/86/72/1341128672.db2.gz	GWMINXQXGOSJHD-UHFFFAOYSA-N	0	3	331.435	3.024	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)CC1CCN(C(=O)CC2CCC2)CC1	ZINC001029951229	1341132167	/nfs/dbraw/zinc/13/21/67/1341132167.db2.gz	PTGBYPZOFLOGPU-UHFFFAOYSA-N	0	3	345.512	3.480	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC(CN(C)Cc2conc2CC)CC1	ZINC001029984644	1341144391	/nfs/dbraw/zinc/14/43/91/1341144391.db2.gz	KYGGKVAYDROWPQ-UHFFFAOYSA-N	0	3	333.476	3.120	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC(CN(C)Cc2conc2C)CC1	ZINC001029991259	1341148717	/nfs/dbraw/zinc/14/87/17/1341148717.db2.gz	WJBABAFEYCUEPM-IBGZPJMESA-N	0	3	333.476	3.256	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)CC1CCN(C(=O)[C@@H]2CC23CC3)CC1	ZINC001029999764	1341152215	/nfs/dbraw/zinc/15/22/15/1341152215.db2.gz	KNUVHLJHYSZFAH-KRWDZBQOSA-N	0	3	343.496	3.090	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1c(C)cccc1Cl	ZINC001032497466	1341523103	/nfs/dbraw/zinc/52/31/03/1341523103.db2.gz	RQJGSLGIXPRFIF-HOTGVXAUSA-N	0	3	332.875	3.442	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(OC)c(C(C)C)c1	ZINC001032501691	1341524091	/nfs/dbraw/zinc/52/40/91/1341524091.db2.gz	RREONWSIXBMHBQ-IRXDYDNUSA-N	0	3	328.456	3.293	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1cccc2cccnc21	ZINC001032550232	1341538269	/nfs/dbraw/zinc/53/82/69/1341538269.db2.gz	IQQKBOIBDZQLEB-OALUTQOASA-N	0	3	335.451	3.029	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1ccc(C(C)(C)C)cc1	ZINC001032652105	1341570765	/nfs/dbraw/zinc/57/07/65/1341570765.db2.gz	NRHMLSILFRWMBJ-OALUTQOASA-N	0	3	326.484	3.388	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C1(c2ccccc2F)CC1	ZINC001032710909	1341587216	/nfs/dbraw/zinc/58/72/16/1341587216.db2.gz	WXKQKTDSNDNTBE-HOTGVXAUSA-N	0	3	328.431	3.109	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1cccc(OCCC)c1	ZINC001032721228	1341590573	/nfs/dbraw/zinc/59/05/73/1341590573.db2.gz	YTHNZAJLEWPCLV-OALUTQOASA-N	0	3	342.483	3.269	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C[C@H](C)c1cccc(OC)c1	ZINC001032809106	1341621962	/nfs/dbraw/zinc/62/19/62/1341621962.db2.gz	ARYMDAHCCFINTQ-WDSOQIARSA-N	0	3	342.483	3.440	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C[C@@H](C)c1cccc(OC)c1	ZINC001032809105	1341622053	/nfs/dbraw/zinc/62/20/53/1341622053.db2.gz	ARYMDAHCCFINTQ-NEWSRXKRSA-N	0	3	342.483	3.440	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)C1CC(c2ccc(F)cc2)C1	ZINC001032818865	1341625672	/nfs/dbraw/zinc/62/56/72/1341625672.db2.gz	WAOGPXOLFDYFCI-VHZYLWGESA-N	0	3	328.431	3.181	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)Cc2coc3ccc(C)cc23)C1	ZINC001033117641	1341730802	/nfs/dbraw/zinc/73/08/02/1341730802.db2.gz	JLGFRMRQGVZQPO-KRWDZBQOSA-N	0	3	326.440	3.393	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2cncc(-c3ccccc3)c2)C1	ZINC001033125632	1341733124	/nfs/dbraw/zinc/73/31/24/1341733124.db2.gz	GILVPSZEKLHRGW-FQEVSTJZSA-N	0	3	335.451	3.471	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2cc(C3CCCCC3)n[nH]2)C1	ZINC001033158941	1341741294	/nfs/dbraw/zinc/74/12/94/1341741294.db2.gz	NPBVPKUPEMGZGP-MRXNPFEDSA-N	0	3	330.476	3.180	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N(C)[C@H]1CCN(CC=C(C)C)C1	ZINC001033205678	1341752346	/nfs/dbraw/zinc/75/23/46/1341752346.db2.gz	ZRBOHOYXXZARLT-KRWDZBQOSA-N	0	3	328.456	3.364	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)C[C@@H]2C[C@H]2Cc2ccccc2)C1	ZINC001033287399	1341768025	/nfs/dbraw/zinc/76/80/25/1341768025.db2.gz	NQMVZBYUIXWTIW-AABGKKOBSA-N	0	3	326.484	3.364	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@H]2CCN(CCOc3ccc(C)cc3)C2)C1	ZINC001033394605	1341811327	/nfs/dbraw/zinc/81/13/27/1341811327.db2.gz	XFRYRLBVZSVCLU-SFHVURJKSA-N	0	3	342.483	3.263	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)Cc2c[nH]c3c2cccc3C)C1	ZINC001033469580	1341839110	/nfs/dbraw/zinc/83/91/10/1341839110.db2.gz	OYXOSPMEEOAVRO-QGZVFWFLSA-N	0	3	325.456	3.128	20	30		EGEDHN
C#CCCN1CC[C@@H](N(C)C(=O)[C@@H]2C[C@H]2c2cccc3ccccc32)C1	ZINC001033506279	1341850991	/nfs/dbraw/zinc/85/09/91/1341850991.db2.gz	SXNVKVZXSQTYRJ-BVYCBKJFSA-N	0	3	346.474	3.499	20	30		EGEDHN
C#CCCN1CC[C@H](N(C)C(=O)c2ccc(O[C@H](C)CC)cc2)C1	ZINC001033566913	1341876496	/nfs/dbraw/zinc/87/64/96/1341876496.db2.gz	MAIAKZCBNLCMOA-AEFFLSMTSA-N	0	3	328.456	3.034	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2cnn(C(CC)CC)c2C)C1	ZINC001033568793	1341877249	/nfs/dbraw/zinc/87/72/49/1341877249.db2.gz	NIZWEVDAONGHBF-KRWDZBQOSA-N	0	3	332.492	3.275	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2cnn(C(CC)CC)c2C)C1	ZINC001033568795	1341877300	/nfs/dbraw/zinc/87/73/00/1341877300.db2.gz	NIZWEVDAONGHBF-QGZVFWFLSA-N	0	3	332.492	3.275	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@@H]2CCN(Cc3ccc(C)cc3C)C2)cn1	ZINC001033602702	1341892801	/nfs/dbraw/zinc/89/28/01/1341892801.db2.gz	HEUSGOHQRDIVJJ-OAQYLSRUSA-N	0	3	347.462	3.026	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2ccccc2C(F)(F)F)C1	ZINC001033607121	1341898450	/nfs/dbraw/zinc/89/84/50/1341898450.db2.gz	NCGVGYBCXAZOBH-CYBMUJFWSA-N	0	3	326.362	3.428	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cccc3scnc32)C1	ZINC001033839171	1342037007	/nfs/dbraw/zinc/03/70/07/1342037007.db2.gz	ZMUBSLNFVSYTAS-AWEZNQCLSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cnn3c2ccc(C)c3C)C1	ZINC001033860223	1342048641	/nfs/dbraw/zinc/04/86/41/1342048641.db2.gz	UHYWYADKKSTHOK-QGZVFWFLSA-N	0	3	340.471	3.064	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@@H]2CCN(C)c3ccccc32)C1	ZINC001033861258	1342049510	/nfs/dbraw/zinc/04/95/10/1342049510.db2.gz	FJPJLMDFNRVXRB-IEBWSBKVSA-N	0	3	341.499	3.109	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2cn(CC)c3ccccc23)C1	ZINC001033890718	1342063780	/nfs/dbraw/zinc/06/37/80/1342063780.db2.gz	SAAALCRIMCWTMA-KRWDZBQOSA-N	0	3	337.467	3.221	20	30		EGEDHN
C=C1CCC(C(=O)N(CC)[C@H]2CCN(C[C@@H]3CCCCO3)C2)CC1	ZINC001033948954	1342108244	/nfs/dbraw/zinc/10/82/44/1342108244.db2.gz	CYKJBXUXWFHTKK-OALUTQOASA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccc(N3CC=CC3)cc2)C1	ZINC001033959525	1342113389	/nfs/dbraw/zinc/11/33/89/1342113389.db2.gz	VESXVBMDNGMSIZ-HXUWFJFHSA-N	0	3	339.483	3.175	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cc(Cl)cc(OC)c2)C1	ZINC001033999876	1342139760	/nfs/dbraw/zinc/13/97/60/1342139760.db2.gz	OOBDWUMUOBDDQT-MRXNPFEDSA-N	0	3	336.863	3.461	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2ccc(O[C@@H](C)CC)cc2)C1	ZINC001034014163	1342151151	/nfs/dbraw/zinc/15/11/51/1342151151.db2.gz	YMIDFAGLAZXRAC-PKOBYXMFSA-N	0	3	342.483	3.424	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@@H]2Cc3ccc(Cl)cc32)C1	ZINC001034037849	1342176957	/nfs/dbraw/zinc/17/69/57/1342176957.db2.gz	SGTYDNHVIWCHMU-FUHWJXTLSA-N	0	3	332.875	3.479	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2ccc(OCC(C)C)cc2)C1	ZINC001034037126	1342177052	/nfs/dbraw/zinc/17/70/52/1342177052.db2.gz	WUPBJYHHHCMSMI-LJQANCHMSA-N	0	3	342.483	3.281	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cnn(CC(C)C)c2CC)C1	ZINC001034205446	1342316120	/nfs/dbraw/zinc/31/61/20/1342316120.db2.gz	WSCNPORCTMRMMG-KRWDZBQOSA-N	0	3	346.519	3.262	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2nsc3ccccc32)C1	ZINC001034221046	1342326051	/nfs/dbraw/zinc/32/60/51/1342326051.db2.gz	JDKDNQKZXVBWJV-CQSZACIVSA-N	0	3	329.469	3.457	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc(C)c(NC(C)=O)c2)C1	ZINC001034221577	1342326617	/nfs/dbraw/zinc/32/66/17/1342326617.db2.gz	RPRDSZDRVXRHGI-SFHVURJKSA-N	0	3	343.471	3.114	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc3oc(C)nc3c2)C1	ZINC001034268132	1342359443	/nfs/dbraw/zinc/35/94/43/1342359443.db2.gz	FXCOBAFXWXXJLH-INIZCTEOSA-N	0	3	327.428	3.297	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cc(C)n([C@@H](C)C3CC3)n2)C1	ZINC001034280119	1342369801	/nfs/dbraw/zinc/36/98/01/1342369801.db2.gz	BPXDRYBDJCIEQB-WMZOPIPTSA-N	0	3	344.503	3.323	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2cc(C)nn2C(CC)CC)C1	ZINC001034281102	1342370372	/nfs/dbraw/zinc/37/03/72/1342370372.db2.gz	CJLPPFQRWSKCCN-QGZVFWFLSA-N	0	3	344.503	3.160	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)[C@@H]2C[C@H]2c2c(F)cccc2F)C1	ZINC001034384836	1342453551	/nfs/dbraw/zinc/45/35/51/1342453551.db2.gz	IYQZNSXEFPXMTK-RRFJBIMHSA-N	0	3	334.410	3.225	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@@H]2CCc3cccc(OC)c32)C1	ZINC001034432026	1342494018	/nfs/dbraw/zinc/49/40/18/1342494018.db2.gz	MZYCNAOGVRBWLL-ZWKOTPCHSA-N	0	3	342.483	3.272	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cccc3c2OCCCO3)C1	ZINC001034456514	1342514099	/nfs/dbraw/zinc/51/40/99/1342514099.db2.gz	UIIGDYRJDVGNQR-INIZCTEOSA-N	0	3	344.455	3.008	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)c2cccc(-c3cnco3)c2)C1	ZINC001034471263	1342526026	/nfs/dbraw/zinc/52/60/26/1342526026.db2.gz	BMEIDMHESFETAU-QGZVFWFLSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@@H](C)n2cnc3ccccc32)C1	ZINC001034474635	1342529914	/nfs/dbraw/zinc/52/99/14/1342529914.db2.gz	UERYXSBTFXIPHW-IAGOWNOFSA-N	0	3	340.471	3.144	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2c(F)cccc2F)C12CCC2	ZINC001078791317	1357085655	/nfs/dbraw/zinc/08/56/55/1357085655.db2.gz	HTDIHJLUPDZBHZ-KBPBESRZSA-N	0	3	340.801	3.348	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc(COC)c(F)c2)C1	ZINC001034499028	1342556633	/nfs/dbraw/zinc/55/66/33/1342556633.db2.gz	AJBFXVVIRKHMIZ-QGZVFWFLSA-N	0	3	334.435	3.133	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)c2cccc(OCC(C)C)c2)C1	ZINC001034521206	1342579863	/nfs/dbraw/zinc/57/98/63/1342579863.db2.gz	CRNDWBNCVPWPKI-GOSISDBHSA-N	0	3	330.472	3.492	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)c2ccc(N(C)CCC)cc2)C1	ZINC001034555204	1342616512	/nfs/dbraw/zinc/61/65/12/1342616512.db2.gz	XUWZWZSTIVSBQI-GOSISDBHSA-N	0	3	329.488	3.303	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1CC[C@H](NC(=O)C2(F)CCCC2)CC1	ZINC001034678800	1342688838	/nfs/dbraw/zinc/68/88/38/1342688838.db2.gz	YVRMDLFSUHWHMJ-IYARVYRRSA-N	0	3	343.446	3.358	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1CC[C@H](NC(=O)[C@H]2CC[C@H](F)C2)CC1	ZINC001034719064	1342713832	/nfs/dbraw/zinc/71/38/32/1342713832.db2.gz	PUANBKLBJWUOIS-QZHFEQFPSA-N	0	3	343.446	3.213	20	30		EGEDHN
C[C@@H]1C[C@H]1CC(=O)N[C@H]1CC[C@H](NCc2cc(F)ccc2C#N)CC1	ZINC001034724409	1342718207	/nfs/dbraw/zinc/71/82/07/1342718207.db2.gz	MABZYDYDRWZUIK-ALQDCCJHSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC[C@H](NCc3conc3CC)CC2)C1	ZINC001034726835	1342721781	/nfs/dbraw/zinc/72/17/81/1342721781.db2.gz	OFOQJXWNWPYDCY-WKILWMFISA-N	0	3	331.460	3.110	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)[C@@H]2C[C@@H]2C(C)C)CC1	ZINC001034772755	1342752607	/nfs/dbraw/zinc/75/26/07/1342752607.db2.gz	YCXWKHSJAHBLEA-KBUPBQIOSA-N	0	3	343.309	3.204	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H]1CNCc1c(C)onc1CC	ZINC001035035654	1342889524	/nfs/dbraw/zinc/88/95/24/1342889524.db2.gz	PEIUAHHIPBGPCZ-BEFAXECRSA-N	0	3	333.476	3.228	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)c(F)c1	ZINC001035066985	1342908396	/nfs/dbraw/zinc/90/83/96/1342908396.db2.gz	ITPYYDQLEJTQJK-RHSMWYFYSA-N	0	3	331.435	3.070	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC2(CCN(Cc3conc3C)C2)CC1	ZINC001035222317	1343043660	/nfs/dbraw/zinc/04/36/60/1343043660.db2.gz	FAOCOVXMTIJXCE-LJQANCHMSA-N	0	3	345.487	3.400	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC3(CCN(Cc4cnc(C)o4)C3)CC2)C1	ZINC001035227212	1343047981	/nfs/dbraw/zinc/04/79/81/1343047981.db2.gz	QGDVWJLDIXFJNI-UHFFFAOYSA-N	0	3	343.471	3.154	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cc1ccccc1CC)CC2	ZINC001035730761	1343157807	/nfs/dbraw/zinc/15/78/07/1343157807.db2.gz	UWKSTXHBMKVGOT-UHFFFAOYSA-N	0	3	326.484	3.292	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1c(F)cc(C)cc1F)CC2	ZINC001035750308	1343169857	/nfs/dbraw/zinc/16/98/57/1343169857.db2.gz	YJFJKFDOGXYWDL-UHFFFAOYSA-N	0	3	334.410	3.387	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cc1cccc(Cl)c1)CC2	ZINC001035786442	1343197521	/nfs/dbraw/zinc/19/75/21/1343197521.db2.gz	YAMZVDTUKFXZML-UHFFFAOYSA-N	0	3	332.875	3.383	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1sc(C)cc1OC)CC2	ZINC001035811644	1343211232	/nfs/dbraw/zinc/21/12/32/1343211232.db2.gz	IVJWGEANBCBETM-UHFFFAOYSA-N	0	3	334.485	3.179	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1csc(C(C)(C)C)n1)CC2	ZINC001035819655	1343214394	/nfs/dbraw/zinc/21/43/94/1343214394.db2.gz	LXIXSWYLQJTHCU-UHFFFAOYSA-N	0	3	345.512	3.002	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1c(C)csc1Cl)CC2	ZINC001035842701	1343224960	/nfs/dbraw/zinc/22/49/60/1343224960.db2.gz	APYIQNODVYBMGZ-UHFFFAOYSA-N	0	3	336.888	3.271	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccsc1C(F)F)CC2	ZINC001035844560	1343225879	/nfs/dbraw/zinc/22/58/79/1343225879.db2.gz	GSMVXCQLBCOFNX-UHFFFAOYSA-N	0	3	338.423	3.247	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)COc1ccccc1Cl)CC2	ZINC001035850163	1343229858	/nfs/dbraw/zinc/22/98/58/1343229858.db2.gz	YXPXSQALKYLQSG-UHFFFAOYSA-N	0	3	348.874	3.219	20	30		EGEDHN
C[C@H]1CN(C(=O)C=C2CCC2)CC[C@H]1NCc1cc(F)ccc1C#N	ZINC001035994858	1343305841	/nfs/dbraw/zinc/30/58/41/1343305841.db2.gz	ZNJUYGNVDHAFFB-IFXJQAMLSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](NCc3csc(C)n3)[C@@H](C)C2)C1	ZINC001036167073	1343340320	/nfs/dbraw/zinc/34/03/20/1343340320.db2.gz	CPVXYYROEXXERV-XJKSGUPXSA-N	0	3	333.501	3.134	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](NCc3ncc(C)s3)[C@H](C)C2)C1	ZINC001036168666	1343342172	/nfs/dbraw/zinc/34/21/72/1343342172.db2.gz	JJZTUDFSJLCMKN-UKRRQHHQSA-N	0	3	333.501	3.134	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3nc(C)oc3C)[C@@H](C)C2)CC1	ZINC001036176069	1343347297	/nfs/dbraw/zinc/34/72/97/1343347297.db2.gz	VOSHVKBXCSKXST-KSSFIOAISA-N	0	3	345.487	3.364	20	30		EGEDHN
C[C@H](NCc1cc(F)ccc1C#N)[C@H]1CCCN(C(=O)C(C)(C)F)C1	ZINC001036357707	1343440305	/nfs/dbraw/zinc/44/03/05/1343440305.db2.gz	OZKGUMCCBRJMOW-ZFWWWQNUSA-N	0	3	349.425	3.162	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCCN(C(=O)C=C2CCC2)C1	ZINC001036380484	1343453340	/nfs/dbraw/zinc/45/33/40/1343453340.db2.gz	CMYYCPOSYBKBNV-JXFKEZNVSA-N	0	3	337.467	3.385	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCCN(C(=O)C2(C)CC2)C1	ZINC001036408324	1343469093	/nfs/dbraw/zinc/46/90/93/1343469093.db2.gz	ILIJPMFCYHFJRG-CRAIPNDOSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]([C@H](C)NCc2cnc(C)o2)C1	ZINC001036440534	1343489082	/nfs/dbraw/zinc/48/90/82/1343489082.db2.gz	OBQSGKFHOMRHCT-GOEBONIOSA-N	0	3	333.476	3.302	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H]([C@H](C)NCc2ccn(CC)n2)C1	ZINC001036443757	1343491529	/nfs/dbraw/zinc/49/15/29/1343491529.db2.gz	WIGZUZAIONSVMW-IRXDYDNUSA-N	0	3	346.519	3.222	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)C#CC2CC2)[C@@H]1CNCc1cc(F)cc(F)c1	ZINC001036550563	1343549485	/nfs/dbraw/zinc/54/94/85/1343549485.db2.gz	XQAOMNQEWSXDMW-AUUYWEPGSA-N	0	3	346.421	3.095	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)C#CC2CC2)[C@H]1CNCc1cc(F)ccc1F	ZINC001036550437	1343549753	/nfs/dbraw/zinc/54/97/53/1343549753.db2.gz	VJKKPHGGIJLDIC-KUHUBIRLSA-N	0	3	346.421	3.095	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001036628489	1343585988	/nfs/dbraw/zinc/58/59/88/1343585988.db2.gz	BUNZQESUCVGGCT-WMLDXEAASA-N	0	3	331.485	3.089	20	30		EGEDHN
CC(C)C(=O)N1CC[C@@H]2[C@@H](CCN2CC#Cc2cccc(Cl)c2)C1	ZINC001036648966	1343599277	/nfs/dbraw/zinc/59/92/77/1343599277.db2.gz	PWAJUXZXFHORPB-PKOBYXMFSA-N	0	3	344.886	3.270	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@H]2[C@@H](CCN2CC#Cc2ccccc2)C1	ZINC001036686692	1343629242	/nfs/dbraw/zinc/62/92/42/1343629242.db2.gz	RDVDPWSRWDTLNC-OALUTQOASA-N	0	3	340.442	3.224	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccc(C#N)c(F)c2)C1	ZINC001036876352	1343815230	/nfs/dbraw/zinc/81/52/30/1343815230.db2.gz	OEUKYDUHQICXJG-FUHWJXTLSA-N	0	3	343.446	3.166	20	30		EGEDHN
CC(C)(C(=O)N[C@@H]1CCC[C@@H]1CNCc1ccccc1C#N)C1CC1	ZINC001037059972	1343954986	/nfs/dbraw/zinc/95/49/86/1343954986.db2.gz	HFUANKQCJFDCQE-IEBWSBKVSA-N	0	3	339.483	3.369	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCC[C@@H]1NC(=O)c1ccoc1	ZINC001037147377	1343997458	/nfs/dbraw/zinc/99/74/58/1343997458.db2.gz	DZSUZFFIKBUAGR-MJGOQNOKSA-N	0	3	337.423	3.230	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCCC[C@H]2CNCc2cnc(C)o2)C1	ZINC001037244546	1344064982	/nfs/dbraw/zinc/06/49/82/1344064982.db2.gz	ZPNVRFJKOLWFEO-RDJZCZTQSA-N	0	3	331.460	3.104	20	30		EGEDHN
CC[C@H]1CN(C(=O)C#CC2CC2)CC[C@@H]1NCc1c(F)cccc1F	ZINC001037839871	1344130364	/nfs/dbraw/zinc/13/03/64/1344130364.db2.gz	OMPXRJAYULBIEB-KXBFYZLASA-N	0	3	346.421	3.095	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](NCc2nc(C)cs2)[C@@H](CC)C1	ZINC001037906795	1344171316	/nfs/dbraw/zinc/17/13/16/1344171316.db2.gz	SKYWATLUFUSHQE-LSDHHAIUSA-N	0	3	335.517	3.380	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1coc2ccc(OC)cc12	ZINC001038496189	1344452463	/nfs/dbraw/zinc/45/24/63/1344452463.db2.gz	GEENOHWJFQJLQB-AWEZNQCLSA-N	0	3	328.412	3.212	20	30		EGEDHN
C=CCOc1cccnc1C(=O)NC[C@H]1CCN1CCC1CCCC1	ZINC001038905929	1344644305	/nfs/dbraw/zinc/64/43/05/1344644305.db2.gz	SSBNDPWPEVQCEW-QGZVFWFLSA-N	0	3	343.471	3.031	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)[C@@H]1C[C@H]1c1cccc(F)c1F	ZINC001039029910	1344724142	/nfs/dbraw/zinc/72/41/42/1344724142.db2.gz	QEWNAEDYGSFUKT-CWRNSKLLSA-N	0	3	334.410	3.225	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)c3cccnc3C)CC2)C1	ZINC001039154694	1344839114	/nfs/dbraw/zinc/83/91/14/1344839114.db2.gz	FGIQKBPVKCSSEX-QGZVFWFLSA-N	0	3	347.890	3.317	20	30		EGEDHN
O=C(C(F)F)N1CCCC[C@H]1[C@H]1CCN(CC#Cc2ccccc2)C1	ZINC001039183500	1344882153	/nfs/dbraw/zinc/88/21/53/1344882153.db2.gz	KSHUXVRRELKQDF-ROUUACIJSA-N	0	3	346.421	3.006	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccoc2Cl)C1	ZINC001039199011	1344908953	/nfs/dbraw/zinc/90/89/53/1344908953.db2.gz	NXXLLNUAZHSRNH-GOEBONIOSA-N	0	3	334.847	3.273	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2csc(C)c2C)C1	ZINC001039204312	1344915394	/nfs/dbraw/zinc/91/53/94/1344915394.db2.gz	ZIYXYZKKNAUXIG-WMZOPIPTSA-N	0	3	330.497	3.315	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)Cc2ccsc2)C1	ZINC001039206195	1344917576	/nfs/dbraw/zinc/91/75/76/1344917576.db2.gz	GMIOOIOQKGWSRF-MSOLQXFVSA-N	0	3	330.497	3.017	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc(F)c(C)cc2F)C1	ZINC001039215597	1344931804	/nfs/dbraw/zinc/93/18/04/1344931804.db2.gz	VOGCHCCAAMHOAZ-HNAYVOBHSA-N	0	3	346.421	3.223	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(CC)o2)C1	ZINC001039215692	1344932578	/nfs/dbraw/zinc/93/25/78/1344932578.db2.gz	YFKQQJFFVNXQTI-WMZOPIPTSA-N	0	3	328.456	3.182	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(C)c(F)c2)C1	ZINC001039216714	1344933005	/nfs/dbraw/zinc/93/30/05/1344933005.db2.gz	RGUPSWIPTAUMFQ-HKUYNNGSSA-N	0	3	328.431	3.084	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2scnc2CC)C1	ZINC001039216381	1344933212	/nfs/dbraw/zinc/93/32/12/1344933212.db2.gz	ZWWPVZBIYKRCLN-DOTOQJQBSA-N	0	3	345.512	3.045	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2c(C)oc(C)c2C)C1	ZINC001039216474	1344933423	/nfs/dbraw/zinc/93/34/23/1344933423.db2.gz	PGDHBEFWWVUWQI-QZTJIDSGSA-N	0	3	328.456	3.155	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)Cc2ccc(C)cc2)C1	ZINC001039220409	1344938007	/nfs/dbraw/zinc/93/80/07/1344938007.db2.gz	ZBIKCORBZOWTJY-SFTDATJTSA-N	0	3	338.495	3.264	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(C)c(C)n2)C1	ZINC001039228546	1344947508	/nfs/dbraw/zinc/94/75/08/1344947508.db2.gz	JDBCORUPHXERRC-UYAOXDASSA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)Cc2cccc(Cl)c2)C1	ZINC001039229820	1344949214	/nfs/dbraw/zinc/94/92/14/1344949214.db2.gz	MUVCXQQQPDQVJK-HKUYNNGSSA-N	0	3	344.886	3.219	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2occc2Cl)C1	ZINC001039233067	1344952398	/nfs/dbraw/zinc/95/23/98/1344952398.db2.gz	ZREKUNGRUJYQSF-HOCLYGCPSA-N	0	3	334.847	3.273	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc(C)ccc2F)C1	ZINC001039238795	1344963047	/nfs/dbraw/zinc/96/30/47/1344963047.db2.gz	PJYYKFPWACRPOC-QFBILLFUSA-N	0	3	328.431	3.084	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccoc2CCC)C1	ZINC001039242971	1344969328	/nfs/dbraw/zinc/96/93/28/1344969328.db2.gz	DUGXQRWQXNUUQB-WMZOPIPTSA-N	0	3	328.456	3.182	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc(OC)cs2)C1	ZINC001039245313	1344973650	/nfs/dbraw/zinc/97/36/50/1344973650.db2.gz	NTQCDLPRMMEHEB-DOTOQJQBSA-N	0	3	346.496	3.097	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccccc2Cl)C1	ZINC001039246999	1344976326	/nfs/dbraw/zinc/97/63/26/1344976326.db2.gz	SOAVLCQVGMOKBY-QAPCUYQASA-N	0	3	330.859	3.290	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc(CC)c(CC)o2)C1	ZINC001039247565	1344976977	/nfs/dbraw/zinc/97/69/77/1344976977.db2.gz	XDJDDBFAJURFJW-ZWKOTPCHSA-N	0	3	342.483	3.354	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2occ3c2CCCC3)C1	ZINC001039247372	1344977101	/nfs/dbraw/zinc/97/71/01/1344977101.db2.gz	VXRJGUKMRMSBIC-LPHOPBHVSA-N	0	3	340.467	3.108	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(C(F)F)o2)C1	ZINC001039248937	1344979349	/nfs/dbraw/zinc/97/93/49/1344979349.db2.gz	FUNQRWBEMLGTLO-KBPBESRZSA-N	0	3	336.382	3.167	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(Cl)cn2)C1	ZINC001039258692	1344986658	/nfs/dbraw/zinc/98/66/58/1344986658.db2.gz	ZCTOPPYZSRSXLV-CRAIPNDOSA-N	0	3	345.874	3.075	20	30		EGEDHN
Cc1ccc(CN2CC[C@H]3CC[C@@H](C2)N3C(=O)[C@@H](C)C#N)cc1C	ZINC001039348808	1345023635	/nfs/dbraw/zinc/02/36/35/1345023635.db2.gz	DUONASVHCYONCG-UHOSZYNNSA-N	0	3	325.456	3.028	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(C)cc(Cl)c1	ZINC001039405739	1345050684	/nfs/dbraw/zinc/05/06/84/1345050684.db2.gz	DUNUAQOBCSAGRR-MSOLQXFVSA-N	0	3	330.859	3.351	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(C)c(Cl)c1	ZINC001039429556	1345063909	/nfs/dbraw/zinc/06/39/09/1345063909.db2.gz	WMANESVEBSFBBT-SJORKVTESA-N	0	3	330.859	3.351	20	30		EGEDHN
C=CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1scnc1C1CC1	ZINC001039449167	1345073916	/nfs/dbraw/zinc/07/39/16/1345073916.db2.gz	LJOGGXYJVURDIM-CABCVRRESA-N	0	3	331.485	3.276	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2c(c1)C=CCC2	ZINC001039450732	1345074366	/nfs/dbraw/zinc/07/43/66/1345074366.db2.gz	QRAVJRPGQRWSQF-RTWAWAEBSA-N	0	3	334.463	3.348	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)c1c(C)noc1C	ZINC001039452069	1345074686	/nfs/dbraw/zinc/07/46/86/1345074686.db2.gz	DHEPIJBREHKKFW-XKQJLSEDSA-N	0	3	331.460	3.036	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1CCOc2ccccc21	ZINC001039453459	1345076005	/nfs/dbraw/zinc/07/60/05/1345076005.db2.gz	DCKRSXZSPVWSHG-AOIWGVFYSA-N	0	3	340.467	3.194	20	30		EGEDHN
C=CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cnc(C2CC2)s1	ZINC001039461451	1345080025	/nfs/dbraw/zinc/08/00/25/1345080025.db2.gz	RVMPGNUZESFCFQ-CABCVRRESA-N	0	3	331.485	3.276	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C1CCC(C(F)F)CC1	ZINC001039465310	1345082782	/nfs/dbraw/zinc/08/27/82/1345082782.db2.gz	ZEWQSBPAXHEVLF-BACDZXNISA-N	0	3	338.442	3.147	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)COc1ccccc1CC	ZINC001039465620	1345083066	/nfs/dbraw/zinc/08/30/66/1345083066.db2.gz	PZKMHBACHNZIKF-MOPGFXCFSA-N	0	3	342.483	3.269	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)COc1cc(C)ccc1C	ZINC001039468769	1345086134	/nfs/dbraw/zinc/08/61/34/1345086134.db2.gz	GLQVXJSYJYARRA-MOPGFXCFSA-N	0	3	342.483	3.324	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)COc1cccc(C)c1	ZINC001039469199	1345086603	/nfs/dbraw/zinc/08/66/03/1345086603.db2.gz	ZUTYJIHAWZYSAJ-MSOLQXFVSA-N	0	3	328.456	3.015	20	30		EGEDHN
C[C@H](C#N)C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC1CCC2(CC2)CC1	ZINC001039531401	1345131830	/nfs/dbraw/zinc/13/18/30/1345131830.db2.gz	OHYVKZKAOBFJFF-NXHRZFHOSA-N	0	3	329.488	3.182	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@]3(CCN(C(=O)c4ccc[nH]4)C3)C2)cc1	ZINC001040071134	1345322208	/nfs/dbraw/zinc/32/22/08/1345322208.db2.gz	VBEXTOKZBMGKIM-OAQYLSRUSA-N	0	3	348.450	3.015	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@]2(C1)CCCN(Cc1ccc(F)cc1)C2	ZINC001040197290	1345371999	/nfs/dbraw/zinc/37/19/99/1345371999.db2.gz	LXKRYVPVWLRNDK-OAQYLSRUSA-N	0	3	340.442	3.054	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3ccc(C(C)(C)C)cn3)C2)C1	ZINC001040210982	1345376529	/nfs/dbraw/zinc/37/65/29/1345376529.db2.gz	WSOZQHWPJYNNPW-NRFANRHFSA-N	0	3	341.499	3.493	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cccc(C)c3F)C2)C1	ZINC001040217662	1345379080	/nfs/dbraw/zinc/37/90/80/1345379080.db2.gz	WBMMHBKTUBVANR-FQEVSTJZSA-N	0	3	328.431	3.086	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)Cc3ccc(C)c(Cl)c3)C2)C1	ZINC001040262961	1345401582	/nfs/dbraw/zinc/40/15/82/1345401582.db2.gz	WVAFTHXGAPQEQN-HXUWFJFHSA-N	0	3	344.886	3.139	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cc([C@@H](C)CC)no3)C2)C1	ZINC001040436167	1345499200	/nfs/dbraw/zinc/49/92/00/1345499200.db2.gz	SFJOKJPHZBANAX-HNAYVOBHSA-N	0	3	331.460	3.302	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cc([C@H](C)CC)no3)C2)C1	ZINC001040436163	1345499294	/nfs/dbraw/zinc/49/92/94/1345499294.db2.gz	SFJOKJPHZBANAX-BEFAXECRSA-N	0	3	331.460	3.302	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3ccc(C4CC4)cn3)C2)C1	ZINC001040514535	1345528167	/nfs/dbraw/zinc/52/81/67/1345528167.db2.gz	UYANNFSFWOAMEO-FQEVSTJZSA-N	0	3	325.456	3.073	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)CCc3c[nH]c4ccccc34)C2)C1	ZINC001040514411	1345528276	/nfs/dbraw/zinc/52/82/76/1345528276.db2.gz	CCNRCINKDTZLDC-QFIPXVFZSA-N	0	3	349.478	3.048	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@@H](C)c3cccc(F)c3)C2)C1	ZINC001040538161	1345536290	/nfs/dbraw/zinc/53/62/90/1345536290.db2.gz	GUARQLGYOCMCCF-UWJYYQICSA-N	0	3	342.458	3.267	20	30		EGEDHN
CCCC(=O)N1CCC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001040576461	1345548679	/nfs/dbraw/zinc/54/86/79/1345548679.db2.gz	CUASCBSJLPJGOB-UHFFFAOYSA-N	0	3	325.456	3.173	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@H]3CCC[C@@H]3C(F)F)C2)CC1	ZINC001040730574	1345571819	/nfs/dbraw/zinc/57/18/19/1345571819.db2.gz	WOPZVGQADZOWMK-HOTGVXAUSA-N	0	3	338.442	3.006	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cc4ccc(C)cc4[nH]3)C2)CC1	ZINC001040790867	1345578509	/nfs/dbraw/zinc/57/85/09/1345578509.db2.gz	DHNQZRDGEPZNTN-UHFFFAOYSA-N	0	3	349.478	3.428	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@@H](C)c3cccs3)C2)CC1	ZINC001040847381	1345587571	/nfs/dbraw/zinc/58/75/71/1345587571.db2.gz	NIUCCMNCGMAPDN-INIZCTEOSA-N	0	3	330.497	3.189	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cc4c(C)cccn4c3)C2)CC1	ZINC001040911740	1345598913	/nfs/dbraw/zinc/59/89/13/1345598913.db2.gz	IAGMOBMUVGSJCP-UHFFFAOYSA-N	0	3	349.478	3.199	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001041196711	1345674367	/nfs/dbraw/zinc/67/43/67/1345674367.db2.gz	TZUUAXVUTAAVEY-FQEVSTJZSA-N	0	3	341.430	3.246	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3c(C)oc4ccccc43)C2)C1	ZINC001041315406	1345699803	/nfs/dbraw/zinc/69/98/03/1345699803.db2.gz	AOOTZHYBZFAPJL-OAQYLSRUSA-N	0	3	336.435	3.303	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cccc4c3CCCC4)C2)C1	ZINC001041317973	1345700928	/nfs/dbraw/zinc/70/09/28/1345700928.db2.gz	OZMWKBSPRHXYTM-QFIPXVFZSA-N	0	3	336.479	3.127	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@]3(CCN(C(=O)C4(C5CC5)CC4)C3)C2)c1	ZINC001041386596	1345714348	/nfs/dbraw/zinc/71/43/48/1345714348.db2.gz	NHRBJOVKJXGOGH-OAQYLSRUSA-N	0	3	349.478	3.173	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)Cc3cc4ccccc4s3)C2)C1	ZINC001041467692	1345736740	/nfs/dbraw/zinc/73/67/40/1345736740.db2.gz	ODNPQVXSNDQVFC-HXUWFJFHSA-N	0	3	338.476	3.001	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@]2(CCN(Cc3cccnc3)C2)C1	ZINC001041537564	1345755539	/nfs/dbraw/zinc/75/55/39/1345755539.db2.gz	ZBIDAKYCCMAYAH-HXUWFJFHSA-N	0	3	327.472	3.108	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@]2(CCN(Cc3cccnc3)C2)C1	ZINC001041627071	1345801626	/nfs/dbraw/zinc/80/16/26/1345801626.db2.gz	ZSYZZKBDGLERTJ-UXHICEINSA-N	0	3	327.472	3.108	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@]2(CCN(Cc3c(C)noc3C)C2)C1	ZINC001041626239	1345801633	/nfs/dbraw/zinc/80/16/33/1345801633.db2.gz	QIPMDBQKLYBOQT-WOJBJXKFSA-N	0	3	345.487	3.318	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@]3(CCN(Cc4scnc4C)C3)C2)C1	ZINC001041658570	1345814005	/nfs/dbraw/zinc/81/40/05/1345814005.db2.gz	YKWRICUIEJWLPC-LJQANCHMSA-N	0	3	345.512	3.232	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)C[C@H](C)c3cccc(F)c3)C2)C1	ZINC001041660309	1345814137	/nfs/dbraw/zinc/81/41/37/1345814137.db2.gz	NMJCTIKPWUNGSA-UWJYYQICSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)C[C@@H](C)c3ccc(CC)cc3)C2)C1	ZINC001041669782	1345817245	/nfs/dbraw/zinc/81/72/45/1345817245.db2.gz	XLBCIUPILIVOPZ-XMSQKQJNSA-N	0	3	338.495	3.300	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccccc3C3(C)CC3)C2)C1	ZINC001041669043	1345817495	/nfs/dbraw/zinc/81/74/95/1345817495.db2.gz	POJGRGXKOLBDFA-QFIPXVFZSA-N	0	3	336.479	3.299	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)Cc3ccc(C(C)(C)C)cc3)C2)C1	ZINC001041712685	1345827421	/nfs/dbraw/zinc/82/74/21/1345827421.db2.gz	ULNDCSLNZZXXBC-QFIPXVFZSA-N	0	3	338.495	3.084	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@]3(CCN(C(=O)[C@H]4CC45CCC5)C3)C2)c1	ZINC001041715997	1345828998	/nfs/dbraw/zinc/82/89/98/1345828998.db2.gz	YPUMXMMZEOMFEV-TZIWHRDSSA-N	0	3	349.478	3.173	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3ccccc3O[C@@H](C)CC)C2)C1	ZINC001041718160	1345829312	/nfs/dbraw/zinc/82/93/12/1345829312.db2.gz	WYSCPHPVPWCLRS-LAUBAEHRSA-N	0	3	340.467	3.035	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)[C@H](CC)Cc3cccc(C)c3)C2)C1	ZINC001041727612	1345833626	/nfs/dbraw/zinc/83/36/26/1345833626.db2.gz	KXWHGGZYGDTGCO-IFMALSPDSA-N	0	3	338.495	3.121	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)C[C@H]3CCc4ccccc43)C2)C1	ZINC001041750288	1345839844	/nfs/dbraw/zinc/83/98/44/1345839844.db2.gz	TVRVFZSRQJWROW-KNQAVFIVSA-N	0	3	336.479	3.054	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)[C@@H](C)c3cc4ccccc4o3)C2)C1	ZINC001041780627	1345847449	/nfs/dbraw/zinc/84/74/49/1345847449.db2.gz	CGZQJTKTPOQTNJ-HRAATJIYSA-N	0	3	336.435	3.094	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)Cc3cccc4ccccc43)C2)C1	ZINC001041800729	1345855141	/nfs/dbraw/zinc/85/51/41/1345855141.db2.gz	XBOBCAHWZKKBSH-HSZRJFAPSA-N	0	3	346.474	3.330	20	30		EGEDHN
C=CCN1CC[C@]2(CCN(C(=O)c3sc(Cl)nc3Cl)C2)C1	ZINC001041833674	1345866853	/nfs/dbraw/zinc/86/68/53/1345866853.db2.gz	SOLYVBQNWHDSFI-AWEZNQCLSA-N	0	3	346.283	3.174	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)C[C@H](C)c3ccc(F)cc3)C2)C1	ZINC001041842508	1345869821	/nfs/dbraw/zinc/86/98/21/1345869821.db2.gz	HROJUQSNMBYDSX-LAUBAEHRSA-N	0	3	342.458	3.267	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CCN(C(=O)C4CCCC4)C[C@@H]32)c1	ZINC001041885670	1345882516	/nfs/dbraw/zinc/88/25/16/1345882516.db2.gz	PLMJYHXFELAEIK-QUCCMNQESA-N	0	3	337.467	3.171	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CCN(C(=O)C4CCCC4)C[C@@H]32)cc1	ZINC001041886141	1345883127	/nfs/dbraw/zinc/88/31/27/1345883127.db2.gz	WEOXJZAIMWVDGT-QUCCMNQESA-N	0	3	337.467	3.171	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(-c4cnco4)cc3)C[C@H]21	ZINC001042116007	1345948394	/nfs/dbraw/zinc/94/83/94/1345948394.db2.gz	FJRBZWVGWBBTAG-CRAIPNDOSA-N	0	3	337.423	3.064	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(-n4cccc4)cc3)C[C@@H]21	ZINC001042142007	1345955036	/nfs/dbraw/zinc/95/50/36/1345955036.db2.gz	JPEULEBSFHDFIE-XLIONFOSSA-N	0	3	335.451	3.200	20	30		EGEDHN
C#CCN1CC[C@H]2CCN(C(=O)CCc3ccc(C(C)C)cc3)C[C@@H]21	ZINC001042150733	1345957142	/nfs/dbraw/zinc/95/71/42/1345957142.db2.gz	YXLHHTYOCAJLEW-SFTDATJTSA-N	0	3	338.495	3.299	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc4cc(F)ccc4[nH]3)C[C@@H]21	ZINC001042175939	1345967403	/nfs/dbraw/zinc/96/74/03/1345967403.db2.gz	GXIXGVRZSSYOBX-ACJLOTCBSA-N	0	3	327.403	3.029	20	30		EGEDHN
CCC1(C(=O)N2CC[C@H]3CCN(Cc4ccc(C#N)cc4)[C@@H]3C2)CC1	ZINC001042220330	1345991291	/nfs/dbraw/zinc/99/12/91/1345991291.db2.gz	BOKSBYZFAQLFQR-RTBURBONSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]3CCN(Cc4cccc(C#N)c4)[C@@H]3C2)C1	ZINC001042227035	1345995820	/nfs/dbraw/zinc/99/58/20/1345995820.db2.gz	HMOPMOXZJILMGS-VQTJNVASSA-N	0	3	349.478	3.337	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccccc3C3(C)CC3)C[C@H]21	ZINC001042232432	1345998900	/nfs/dbraw/zinc/99/89/00/1345998900.db2.gz	LUQHCEBTFTZBHD-YLJYHZDGSA-N	0	3	336.479	3.298	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3cnc(C)nc3C(C)C)C[C@H]21	ZINC001042254298	1346006973	/nfs/dbraw/zinc/00/69/73/1346006973.db2.gz	KGCBZWMKTKUNAB-SJLPKXTDSA-N	0	3	342.487	3.021	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(C)c(OCC)c3)C[C@@H]21	ZINC001042256817	1346007819	/nfs/dbraw/zinc/00/78/19/1346007819.db2.gz	ZZUSYTUQRXFHLP-WMZOPIPTSA-N	0	3	328.456	3.116	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3csc(-c4ccoc4)n3)C[C@H]21	ZINC001042271993	1346014509	/nfs/dbraw/zinc/01/45/09/1346014509.db2.gz	JSOFXAFXDANENQ-XJKSGUPXSA-N	0	3	343.452	3.126	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(OC)c(C4CC4)c3)C[C@H]21	ZINC001042290971	1346018801	/nfs/dbraw/zinc/01/88/01/1346018801.db2.gz	VHFFUYITDSXVLO-QFBILLFUSA-N	0	3	340.467	3.295	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3oc(CCC)nc3C)C[C@H]21	ZINC001042315001	1346029888	/nfs/dbraw/zinc/02/98/88/1346029888.db2.gz	YFCYYKPFGDBRPQ-HZPDHXFCSA-N	0	3	331.460	3.048	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3coc(-c4ccccc4)n3)C[C@@H]21	ZINC001042316185	1346030903	/nfs/dbraw/zinc/03/09/03/1346030903.db2.gz	IUWPROWONBCXII-YJBOKZPZSA-N	0	3	337.423	3.064	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cccc(C(F)F)c3)C[C@H]21	ZINC001042316403	1346031035	/nfs/dbraw/zinc/03/10/35/1346031035.db2.gz	LRHCRTPRSQUWHK-RHSMWYFYSA-N	0	3	332.394	3.184	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccccc3OC(C)C)C[C@@H]21	ZINC001042320529	1346031206	/nfs/dbraw/zinc/03/12/06/1346031206.db2.gz	RTUXTYVXYHTUJE-AEFFLSMTSA-N	0	3	328.456	3.196	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3cc4c(s3)CCCC4)C[C@H]21	ZINC001042338734	1346043652	/nfs/dbraw/zinc/04/36/52/1346043652.db2.gz	LVHMHBFUNCEERS-NVXWUHKLSA-N	0	3	342.508	3.187	20	30		EGEDHN
C#CCN1CC[C@H]2CCN(C(=O)CC(C)(C)c3ccc(C)cc3)C[C@H]21	ZINC001042345272	1346047857	/nfs/dbraw/zinc/04/78/57/1346047857.db2.gz	KNWHDKHTXCIHMD-AZUAARDMSA-N	0	3	338.495	3.219	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)CC(C)(C)c3ccc(C)cc3)C[C@H]21	ZINC001042345275	1346048041	/nfs/dbraw/zinc/04/80/41/1346048041.db2.gz	KNWHDKHTXCIHMD-UYAOXDASSA-N	0	3	338.495	3.219	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(OC4CCC4)cc3)C[C@@H]21	ZINC001042362311	1346056827	/nfs/dbraw/zinc/05/68/27/1346056827.db2.gz	JJYQUEVEZUKALE-UZLBHIALSA-N	0	3	340.467	3.340	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3coc(C4CCCCC4)n3)C[C@@H]21	ZINC001042371282	1346061568	/nfs/dbraw/zinc/06/15/68/1346061568.db2.gz	NZWSTTXOGQCSFQ-YJBOKZPZSA-N	0	3	343.471	3.445	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C3(C(F)(F)F)CCCC3)C[C@H]21	ZINC001042379282	1346064843	/nfs/dbraw/zinc/06/48/43/1346064843.db2.gz	JFOQBUGIHGRRTE-ZIAGYGMSSA-N	0	3	330.394	3.218	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc(CC)c(CC)c3)C[C@@H]21	ZINC001042378944	1346064978	/nfs/dbraw/zinc/06/49/78/1346064978.db2.gz	CHLUVEPMOLSMMZ-FPOVZHCZSA-N	0	3	338.495	3.371	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2cc(F)ccc2C#N)CCN1C(=O)c1ccco1	ZINC001044425888	1346325891	/nfs/dbraw/zinc/32/58/91/1346325891.db2.gz	PUVBCLTYHHAAFR-DYVFJYSZSA-N	0	3	341.386	3.073	20	30		EGEDHN
C[C@H]1C[C@@H]([NH2+]Cc2ccccc2C#N)CCN1C(=O)c1ccccc1[O-]	ZINC001044476186	1346343514	/nfs/dbraw/zinc/34/35/14/1346343514.db2.gz	PLCDQBYMJMWRBU-YJBOKZPZSA-N	0	3	349.434	3.047	20	30		EGEDHN
C/C(=C\C(=O)N1CC[C@H](NCc2ccccc2C#N)C[C@@H]1C)C1CC1	ZINC001044491568	1346347109	/nfs/dbraw/zinc/34/71/09/1346347109.db2.gz	SSSFOKOQQPQJBS-QWSHPKPYSA-N	0	3	337.467	3.384	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)[C@H]1C[C@H]2C[C@H]2C1	ZINC001044711766	1346408349	/nfs/dbraw/zinc/40/83/49/1346408349.db2.gz	JVLJGLUUTNATII-NSYSGPAISA-N	0	3	337.467	3.073	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3nccn3CC)C[C@H]2C)CC1	ZINC001044729887	1346414321	/nfs/dbraw/zinc/41/43/21/1346414321.db2.gz	LFMCDUMTTCFPFA-SJLPKXTDSA-N	0	3	344.503	3.119	20	30		EGEDHN
C[C@]1(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)cc2F)C=CCC1	ZINC001045156393	1346509166	/nfs/dbraw/zinc/50/91/66/1346509166.db2.gz	YRGJKVOQEDZCKP-PXNSSMCTSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@H]2CNCc2ncccc2C)CC1	ZINC001045182032	1346517510	/nfs/dbraw/zinc/51/75/10/1346517510.db2.gz	JGFGZAHGIYLCLX-SFHVURJKSA-N	0	3	327.472	3.217	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H]1CNCc1cccc(OCC)n1	ZINC001045185700	1346520384	/nfs/dbraw/zinc/52/03/84/1346520384.db2.gz	IWULYCHAOIGKAE-PXNSSMCTSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2coc3c2cccc3OC)CC1	ZINC001045441247	1346594608	/nfs/dbraw/zinc/59/46/08/1346594608.db2.gz	BQMKBJQHGWAMEB-UHFFFAOYSA-N	0	3	328.412	3.212	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2cc(-c3cccs3)on2)CC1	ZINC001045516960	1346615239	/nfs/dbraw/zinc/61/52/39/1346615239.db2.gz	RCVJWBIATZZWNM-UHFFFAOYSA-N	0	3	331.441	3.173	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2ccc(OC)c(C3CC3)c2)CC1	ZINC001045601412	1346641764	/nfs/dbraw/zinc/64/17/64/1346641764.db2.gz	OJYDVMHQPSNVQK-UHFFFAOYSA-N	0	3	340.467	3.180	20	30		EGEDHN
CC(C)[C@H]1C[C@@H]1C(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1	ZINC001045604631	1346642804	/nfs/dbraw/zinc/64/28/04/1346642804.db2.gz	TTWGPSSXUPBJSU-MOPGFXCFSA-N	0	3	339.483	3.321	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1ccc(C#N)cc1)C1CC1	ZINC001045747386	1346686767	/nfs/dbraw/zinc/68/67/67/1346686767.db2.gz	LZBSXRXXEZHHNK-YSGRDPCXSA-N	0	3	337.467	3.170	20	30		EGEDHN
Cc1[nH]ccc1C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1cccc(C#N)c1	ZINC001045750040	1346688526	/nfs/dbraw/zinc/68/85/26/1346688526.db2.gz	NIEPONYFDKNOAA-MOPGFXCFSA-N	0	3	348.450	3.074	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1CC[C@H]2CC[C@@H](C1)N2C[C@H](F)CC	ZINC001045883738	1346732210	/nfs/dbraw/zinc/73/22/10/1346732210.db2.gz	WPJDSOUHIQLSCT-AQNXPRMDSA-N	0	3	342.458	3.024	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)CCc1ccsc1)C2	ZINC001045943544	1346779560	/nfs/dbraw/zinc/77/95/60/1346779560.db2.gz	KMIMKVQKULWLOM-LJQANCHMSA-N	0	3	330.497	3.019	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)C[C@@H]1CCC(F)(F)C1)C2	ZINC001045944285	1346779972	/nfs/dbraw/zinc/77/99/72/1346779972.db2.gz	JGUPVRQIGZUMIO-WMZOPIPTSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc3ccccc3n1C)C2	ZINC001045960415	1346795740	/nfs/dbraw/zinc/79/57/40/1346795740.db2.gz	JFXSXUXVQUQJBZ-JOCHJYFZSA-N	0	3	349.478	3.130	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H]1CCCC(F)(F)C1)C2	ZINC001045965366	1346800118	/nfs/dbraw/zinc/80/01/18/1346800118.db2.gz	GNQXSAGRNIVNMW-SJLPKXTDSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)CCc1ccccc1C)C2	ZINC001045969669	1346805006	/nfs/dbraw/zinc/80/50/06/1346805006.db2.gz	WMABZXIQNFROSS-QFIPXVFZSA-N	0	3	338.495	3.265	20	30		EGEDHN
C=CCCN1CC[C@](C)(NC(=O)c2snc(Cl)c2Cl)C1	ZINC001046354039	1346947007	/nfs/dbraw/zinc/94/70/07/1346947007.db2.gz	BINHVQPRFILREE-ZDUSSCGKSA-N	0	3	334.272	3.220	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2cn(C)c3ccc(F)cc23)C1	ZINC001046377678	1346955057	/nfs/dbraw/zinc/95/50/57/1346955057.db2.gz	CSUIEXKVHYRGLX-IBGZPJMESA-N	0	3	329.419	3.088	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@@]2(C)CCN(Cc3ccccc3)C2)cc1	ZINC001046680122	1347060793	/nfs/dbraw/zinc/06/07/93/1347060793.db2.gz	XQIGWYIBWRIRKM-QFIPXVFZSA-N	0	3	348.446	3.093	20	30		EGEDHN
C#CCCN1CC[C@@](C)(NC(=O)c2ccc(Cl)c(Cl)c2)C1	ZINC001046795130	1347107082	/nfs/dbraw/zinc/10/70/82/1347107082.db2.gz	MCXIMCAEAFGCAL-MRXNPFEDSA-N	0	3	325.239	3.211	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2cc[nH]c2C(C)C)C1	ZINC001046965432	1347169167	/nfs/dbraw/zinc/16/91/67/1347169167.db2.gz	ARZMVDYMQMGCLG-CQSZACIVSA-N	0	3	339.430	3.401	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@@H](CNC(=O)[C@@H]2CCCC(C)(C)C2)C1	ZINC001046995855	1347178764	/nfs/dbraw/zinc/17/87/64/1347178764.db2.gz	LXPPGTYBEPCAMS-CVEARBPZSA-N	0	3	340.458	3.300	20	30		EGEDHN
CC1(C(=O)N[C@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2C#N)C3)CCC1	ZINC001047127096	1347213836	/nfs/dbraw/zinc/21/38/36/1347213836.db2.gz	ICCVUPWYTGYMCK-SNRMKQJTSA-N	0	3	337.467	3.218	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)N(Cc2cnoc2C)C3)CC1	ZINC001047139552	1347217895	/nfs/dbraw/zinc/21/78/95/1347217895.db2.gz	XMMCHQBXRZXVMC-IPELMVKDSA-N	0	3	343.471	3.199	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)[C@H]3[C@@H]4CCC[C@@H]43)C2)CC1	ZINC001047233043	1347261648	/nfs/dbraw/zinc/26/16/48/1347261648.db2.gz	SBFASIUHGJJVNH-VNTMZGSJSA-N	0	3	328.500	3.006	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)Cc3ccc(C)o3)C2)CC1	ZINC001047234974	1347263020	/nfs/dbraw/zinc/26/30/20/1347263020.db2.gz	UVMAJXJMZRAQTG-LJQANCHMSA-N	0	3	342.483	3.104	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3cc(C)c(C)o3)C2)CC1	ZINC001047235181	1347263043	/nfs/dbraw/zinc/26/30/43/1347263043.db2.gz	WBYNSJCSBBNPNQ-GOSISDBHSA-N	0	3	328.456	3.094	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3ccc(F)cc3C)C2)CC1	ZINC001047263511	1347284512	/nfs/dbraw/zinc/28/45/12/1347284512.db2.gz	HVEKWNFMDDTXES-GOSISDBHSA-N	0	3	342.458	3.332	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3ccc(F)cc3F)C2)CC1	ZINC001047264451	1347285660	/nfs/dbraw/zinc/28/56/60/1347285660.db2.gz	JQYJTTREKMQCMD-MRXNPFEDSA-N	0	3	346.421	3.162	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@H]3CC4CCC3CC4)C2)CC1	ZINC001047265749	1347286968	/nfs/dbraw/zinc/28/69/68/1347286968.db2.gz	MGMKKCXYOHYXTK-BOWFFMLLSA-N	0	3	342.527	3.397	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)CCc3ccc(C)o3)C2)CC1	ZINC001047266023	1347287078	/nfs/dbraw/zinc/28/70/78/1347287078.db2.gz	OCDYIZFPAQSDHF-IBGZPJMESA-N	0	3	342.483	3.104	20	30		EGEDHN
C[C@H](NCc1cc(F)ccc1C#N)[C@H]1CCN(C(=O)CCC2CC2)C1	ZINC001047766981	1347364988	/nfs/dbraw/zinc/36/49/88/1347364988.db2.gz	XZVIZVJVLGFOLD-YOEHRIQHSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]([C@H](C)NCc2nc(C)cs2)C1	ZINC001047929249	1347413489	/nfs/dbraw/zinc/41/34/89/1347413489.db2.gz	QDHXONKKIXVHGI-LSDHHAIUSA-N	0	3	335.517	3.380	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]([C@@H](C)NCc2csc(CC)n2)C1	ZINC001047932349	1347414863	/nfs/dbraw/zinc/41/48/63/1347414863.db2.gz	PCECDKCBNCJMLU-ZIAGYGMSSA-N	0	3	335.517	3.244	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H]([C@@H](C)NCc3nccs3)C2)CC1	ZINC001047958156	1347424024	/nfs/dbraw/zinc/42/40/24/1347424024.db2.gz	GUPFWMUHPWHZBT-ZBFHGGJFSA-N	0	3	333.501	3.216	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]([C@@H](C)NCc3nc(C)c(C)s3)C2)C1	ZINC001047964704	1347426477	/nfs/dbraw/zinc/42/64/77/1347426477.db2.gz	BPQSHJJSBUUYIT-ZBFHGGJFSA-N	0	3	347.528	3.443	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]([C@@H](C)NCc3ccn(C(C)C)n3)C2)C1	ZINC001047966277	1347427310	/nfs/dbraw/zinc/42/73/10/1347427310.db2.gz	QYPCZWDWYBITLG-IAGOWNOFSA-N	0	3	344.503	3.147	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]([C@H](C)NCc3ncc(C)s3)C2)C1	ZINC001047967808	1347427678	/nfs/dbraw/zinc/42/76/78/1347427678.db2.gz	YDQLWNXJKJBPMH-GJZGRUSLSA-N	0	3	333.501	3.134	20	30		EGEDHN
C[C@@H](NCc1cc(F)ccc1C#N)[C@H]1CCN(C(=O)C(C)(C)C)C1	ZINC001048039133	1347447582	/nfs/dbraw/zinc/44/75/82/1347447582.db2.gz	ZPZCNQCDCKEUFE-HIFRSBDPSA-N	0	3	331.435	3.070	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](C)[C@H](CNCc2csc(C)n2)C1	ZINC001048337706	1347522305	/nfs/dbraw/zinc/52/23/05/1347522305.db2.gz	FJGZWUVYQQFPTE-DZGCQCFKSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](C)[C@H](CNCc2ccccc2C#N)C1	ZINC001048338014	1347522456	/nfs/dbraw/zinc/52/24/56/1347522456.db2.gz	HLTILFDKFXFSFG-QFBILLFUSA-N	0	3	339.483	3.345	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)[C@@H](CNCc2csc(C3CC3)n2)C1	ZINC001048341880	1347524104	/nfs/dbraw/zinc/52/41/04/1347524104.db2.gz	FPPIEBOTHNRRQE-HIFRSBDPSA-N	0	3	347.528	3.417	20	30		EGEDHN
CCC(C)(C)C(=O)N1C[C@H](C)[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001048357929	1347529739	/nfs/dbraw/zinc/52/97/39/1347529739.db2.gz	HXWMWGRSHRCSRZ-WMLDXEAASA-N	0	3	345.462	3.318	20	30		EGEDHN
C[C@@H]1CN(C(=O)C(C)(C)C(F)F)C[C@@H]1CNCc1ccccc1C#N	ZINC001048382061	1347538044	/nfs/dbraw/zinc/53/80/44/1347538044.db2.gz	IPDXWKGVIKPJIT-CJNGLKHVSA-N	0	3	349.425	3.034	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CN(C(=O)C[C@@H]4C=CCCC4)C[C@@H]3C2)c1	ZINC001048886717	1347676222	/nfs/dbraw/zinc/67/62/22/1347676222.db2.gz	NWOFUDVFAZLMKZ-UIFIKXQLSA-N	0	3	349.478	3.195	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CN(Cc3c(C)nsc3C)C[C@H]2C1	ZINC001049024970	1347709174	/nfs/dbraw/zinc/70/91/74/1347709174.db2.gz	AVQFUCAABHMBCE-JTDSTZFVSA-N	0	3	347.528	3.252	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@@H](CC3CCCC3)C(C)C)C[C@@H]2C1	ZINC001049100338	1347726108	/nfs/dbraw/zinc/72/61/08/1347726108.db2.gz	YBDXCDCOUDOJFV-ZCNNSNEGSA-N	0	3	330.516	3.252	20	30		EGEDHN
C=C[C@H](C(=O)N1C[C@H]2CN(C[C@@H](F)CC)C[C@H]2C1)c1ccccc1	ZINC001049229822	1347751986	/nfs/dbraw/zinc/75/19/86/1347751986.db2.gz	RAFLZYITFMLTTA-RDGPPVDQSA-N	0	3	330.447	3.095	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@@H]2CCCN3C(=O)c2ccccc2)c1	ZINC001049295242	1347776870	/nfs/dbraw/zinc/77/68/70/1347776870.db2.gz	DGTXBEPIOYKGHY-SFTDATJTSA-N	0	3	345.446	3.437	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@H]2[C@@H]1CCN2CCc1ccccc1Cl	ZINC001049370966	1347808483	/nfs/dbraw/zinc/80/84/83/1347808483.db2.gz	DHSRFVYKJOQSAO-JLSDUUJJSA-N	0	3	345.874	3.107	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1cccc(C#N)c1	ZINC001049414735	1347837067	/nfs/dbraw/zinc/83/70/67/1347837067.db2.gz	FXNCQHKDNPFOEL-GUDVDZBRSA-N	0	3	337.467	3.170	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)C2=CCCC2)cc1	ZINC001049417086	1347839233	/nfs/dbraw/zinc/83/92/33/1347839233.db2.gz	ZUYMLKHZNDWFBV-VQTJNVASSA-N	0	3	335.451	3.234	20	30		EGEDHN
Cc1ccc(F)cc1CN1CC[C@@H]2[C@H]1CCCN2C(=O)C#CC1CC1	ZINC001049466597	1347862557	/nfs/dbraw/zinc/86/25/57/1347862557.db2.gz	GYYFFKZDHMDXRS-WOJBJXKFSA-N	0	3	340.442	3.113	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1coc(C(C)(C)C)n1	ZINC001049469943	1347864293	/nfs/dbraw/zinc/86/42/93/1347864293.db2.gz	PAMZKDVLYVKJGE-HZPDHXFCSA-N	0	3	331.460	3.227	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccn(C2CCCC2)n1	ZINC001049506276	1347883137	/nfs/dbraw/zinc/88/31/37/1347883137.db2.gz	WFIBHZRFRCOAGA-MOPGFXCFSA-N	0	3	342.487	3.253	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc2nccc(C)c2c1	ZINC001049506122	1347883188	/nfs/dbraw/zinc/88/31/88/1347883188.db2.gz	UJHLTONLRSAIFO-WOJBJXKFSA-N	0	3	335.451	3.408	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccsc1COC	ZINC001049552931	1347905629	/nfs/dbraw/zinc/90/56/29/1347905629.db2.gz	RDFRFRIHCRVLEN-CVEARBPZSA-N	0	3	334.485	3.150	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)CC1CC(c2ccccc2)C1	ZINC001049558188	1347908817	/nfs/dbraw/zinc/90/88/17/1347908817.db2.gz	NPAKCWXALVTAGF-CGNZLSCGSA-N	0	3	336.479	3.269	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(C)n([C@H](C)CC)n1	ZINC001049566054	1347912919	/nfs/dbraw/zinc/91/29/19/1347912919.db2.gz	ZMSDQRVGQDPGST-ATZDWAIDSA-N	0	3	344.503	3.418	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cn1c(C)cc2ccccc21	ZINC001049578988	1347919132	/nfs/dbraw/zinc/91/91/32/1347919132.db2.gz	CPWUNHPNDTUCIB-SFTDATJTSA-N	0	3	349.478	3.038	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc2cc(C)ccc2n1	ZINC001049586959	1347923622	/nfs/dbraw/zinc/92/36/22/1347923622.db2.gz	ZLRMVZLUIVOFHO-UXHICEINSA-N	0	3	335.451	3.408	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H]1COc2ccc(Cl)cc21	ZINC001049589012	1347924853	/nfs/dbraw/zinc/92/48/53/1347924853.db2.gz	JSOURJXMVAJJCM-BRWVUGGUSA-N	0	3	346.858	3.067	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1cccc(C)c1Cl	ZINC001049595101	1347928115	/nfs/dbraw/zinc/92/81/15/1347928115.db2.gz	TUSJVGVETSUJKZ-ROUUACIJSA-N	0	3	344.886	3.280	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1cccc2cccnc21	ZINC001049626748	1347941289	/nfs/dbraw/zinc/94/12/89/1347941289.db2.gz	SBEJLJSAGCYNAD-RBUKOAKNSA-N	0	3	335.451	3.029	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]2[C@@H]1CCN2CCc1csc(C)n1	ZINC001049643095	1347950555	/nfs/dbraw/zinc/95/05/55/1347950555.db2.gz	CPFTVDSJFMQUIX-SJORKVTESA-N	0	3	347.528	3.272	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccn(C(C)C)c1C	ZINC001049658920	1347959334	/nfs/dbraw/zinc/95/93/34/1347959334.db2.gz	GVVPLZRQVAQMBG-MOPGFXCFSA-N	0	3	327.472	3.080	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1csc(-c2ccco2)n1	ZINC001049677120	1347968148	/nfs/dbraw/zinc/96/81/48/1347968148.db2.gz	RSZNZLMXLVKKFT-HUUCEWRRSA-N	0	3	343.452	3.268	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1c(Cl)cncc1Cl	ZINC001049688260	1347971815	/nfs/dbraw/zinc/97/18/15/1347971815.db2.gz	TZKPVCRACUFFQY-UONOGXRCSA-N	0	3	340.254	3.253	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H]2[C@@H]1CCN2CCc1ccns1	ZINC001049699466	1347979137	/nfs/dbraw/zinc/97/91/37/1347979137.db2.gz	HVCBEEAAPZLPTO-JENIJYKNSA-N	0	3	347.528	3.353	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc2occc2s1	ZINC001049718271	1347989640	/nfs/dbraw/zinc/98/96/40/1347989640.db2.gz	LIZBECVYEHXKBN-ZIAGYGMSSA-N	0	3	328.437	3.197	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1csc(C(C)(C)C)n1	ZINC001049777467	1348016320	/nfs/dbraw/zinc/01/63/20/1348016320.db2.gz	IDLWVBJVRMTZMO-CVEARBPZSA-N	0	3	347.528	3.234	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(OC)cc1Cl	ZINC001049793855	1348024296	/nfs/dbraw/zinc/02/42/96/1348024296.db2.gz	QYIMGPDTVIFFAD-IRXDYDNUSA-N	0	3	334.847	3.214	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C[C@@H]1CCc2ccccc21	ZINC001049800955	1348026787	/nfs/dbraw/zinc/02/67/87/1348026787.db2.gz	FVNAJCNRSXNWSW-CEWLAPEOSA-N	0	3	336.479	3.195	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cnn(C(C)C)c1C1CC1	ZINC001049837756	1348050546	/nfs/dbraw/zinc/05/05/46/1348050546.db2.gz	RFYMNQKPLNINSC-ZWKOTPCHSA-N	0	3	342.487	3.206	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1coc(-c2ccccc2)n1	ZINC001049847827	1348056449	/nfs/dbraw/zinc/05/64/49/1348056449.db2.gz	FSTLWYYOMMMQEX-RTBURBONSA-N	0	3	349.434	3.044	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(C2CC2)cn1	ZINC001049872735	1348078108	/nfs/dbraw/zinc/07/81/08/1348078108.db2.gz	XYRZXEUXKZLSIX-OALUTQOASA-N	0	3	325.456	3.214	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)[C@@]1(c2ccccc2)C[C@H](F)C1	ZINC001049874947	1348079670	/nfs/dbraw/zinc/07/96/70/1348079670.db2.gz	IGOZCJLYBZILQP-WERVVEIQSA-N	0	3	342.458	3.308	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)CCc1ccccc1Cl	ZINC001049886837	1348090820	/nfs/dbraw/zinc/09/08/20/1348090820.db2.gz	VBDICQNCHUCPBF-OALUTQOASA-N	0	3	344.886	3.361	20	30		EGEDHN
Cc1c[nH]cc1C(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1cccc(C#N)c1	ZINC001049890410	1348095297	/nfs/dbraw/zinc/09/52/97/1348095297.db2.gz	MWHUWXJTODOZFD-PMACEKPBSA-N	0	3	348.450	3.074	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)CCc1ccc(Cl)s1	ZINC001049892093	1348096071	/nfs/dbraw/zinc/09/60/71/1348096071.db2.gz	ZKBLJWBJCQODLE-LSDHHAIUSA-N	0	3	336.888	3.033	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cnn(C(C)(C)C)c1CC	ZINC001049899754	1348100057	/nfs/dbraw/zinc/10/00/57/1348100057.db2.gz	GPDDEXJIPTYGBL-QZTJIDSGSA-N	0	3	344.503	3.065	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)CC(C)(C)c1ccccc1	ZINC001049915973	1348110375	/nfs/dbraw/zinc/11/03/75/1348110375.db2.gz	DJDXMPRBEZEBBX-PMACEKPBSA-N	0	3	338.495	3.443	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](C)Cc1cccc(F)c1	ZINC001049925742	1348116476	/nfs/dbraw/zinc/11/64/76/1348116476.db2.gz	FYCJTZIVDHNMRQ-PWIZWCRZSA-N	0	3	342.458	3.093	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](C)Cc1ccc(F)cc1	ZINC001049926893	1348117986	/nfs/dbraw/zinc/11/79/86/1348117986.db2.gz	SJGGXNWYZVQJCU-PWIZWCRZSA-N	0	3	342.458	3.093	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(N(C)C(C)C)cc1	ZINC001049928916	1348119215	/nfs/dbraw/zinc/11/92/15/1348119215.db2.gz	WJZLRTJZSCTRQI-VQTJNVASSA-N	0	3	341.499	3.396	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3CCCN(C(=O)C4CCCC4)[C@@H]3C2)cc1	ZINC001049950046	1348128211	/nfs/dbraw/zinc/12/82/11/1348128211.db2.gz	TYWZTYFCYVDEDR-VQTJNVASSA-N	0	3	337.467	3.171	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CCCN(C(=O)[C@H]4CC=CCC4)[C@@H]3C2)c1	ZINC001049971616	1348138982	/nfs/dbraw/zinc/13/89/82/1348138982.db2.gz	SKMJYQVVEORVKI-PCCBWWKXSA-N	0	3	349.478	3.337	20	30		EGEDHN
C#CCCN1C[C@@H]2CCCN(C(=O)c3oc(C(F)F)cc3C)[C@@H]2C1	ZINC001050068194	1348171989	/nfs/dbraw/zinc/17/19/89/1348171989.db2.gz	CUJXIUMILJUJTN-UONOGXRCSA-N	0	3	336.382	3.085	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3CCCN(C(=O)[C@H]4CC45CCC5)[C@@H]3C2)cc1	ZINC001050151549	1348197559	/nfs/dbraw/zinc/19/75/59/1348197559.db2.gz	ADFNYAFXXBUSJI-XUVXKRRUSA-N	0	3	349.478	3.171	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)C[C@H](C)c3ccccc3F)[C@@H]2C1	ZINC001050164328	1348201267	/nfs/dbraw/zinc/20/12/67/1348201267.db2.gz	CLMQUUZJSDSZHU-ABSDTBQOSA-N	0	3	342.458	3.265	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cc(F)c4ncccc4c3)[C@@H]2C1	ZINC001050165100	1348201340	/nfs/dbraw/zinc/20/13/40/1348201340.db2.gz	UKAXEAIRESRPJK-MAUKXSAKSA-N	0	3	339.414	3.096	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)CCc3ccc(C)cc3C)C2)CC1	ZINC001050608968	1348300827	/nfs/dbraw/zinc/30/08/27/1348300827.db2.gz	WDHZOMJYIMBSIO-UHFFFAOYSA-N	0	3	338.495	3.184	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC2(C1)CCN(Cc1cnccc1C)CC2	ZINC001050614266	1348302852	/nfs/dbraw/zinc/30/28/52/1348302852.db2.gz	USWLTOFABJCQOC-UHFFFAOYSA-N	0	3	341.499	3.417	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC2(C1)CCN(Cc1ocnc1C)CC2	ZINC001050616810	1348303921	/nfs/dbraw/zinc/30/39/21/1348303921.db2.gz	DFZVLRDODYSZQY-UHFFFAOYSA-N	0	3	331.460	3.010	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001050638084	1348310803	/nfs/dbraw/zinc/31/08/03/1348310803.db2.gz	ITIVKXHUQICDBO-UHFFFAOYSA-N	0	3	339.483	3.419	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1cnc(C)s1)CC2	ZINC001050645402	1348313978	/nfs/dbraw/zinc/31/39/78/1348313978.db2.gz	LEODJKYSRMCBEF-GOSISDBHSA-N	0	3	347.528	3.478	20	30		EGEDHN
C[C@@H]1C[C@@H]1CC(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001050647820	1348315452	/nfs/dbraw/zinc/31/54/52/1348315452.db2.gz	SBQVCWJEUHFCCR-VQIMIIECSA-N	0	3	337.467	3.029	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3ccc(F)c4ccccc34)C2)CC1	ZINC001050675541	1348323476	/nfs/dbraw/zinc/32/34/76/1348323476.db2.gz	SGOCYLWTPJFKRB-UHFFFAOYSA-N	0	3	336.410	3.150	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccccc3OC(C)C)C2)CC1	ZINC001050734466	1348341625	/nfs/dbraw/zinc/34/16/25/1348341625.db2.gz	PSSFFTTYMZNDBO-UHFFFAOYSA-N	0	3	340.467	3.035	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3coc4ccc(F)cc34)C2)CC1	ZINC001050742202	1348345244	/nfs/dbraw/zinc/34/52/44/1348345244.db2.gz	XMCVVMFBMRXLAJ-UHFFFAOYSA-N	0	3	340.398	3.133	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3ccc(C(C)(C)C)s3)C2)CC1	ZINC001050761391	1348351034	/nfs/dbraw/zinc/35/10/34/1348351034.db2.gz	NVYWAXWFLICBMF-UHFFFAOYSA-N	0	3	330.497	3.217	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3cnccc3C)cccc2C1	ZINC001051284142	1348417181	/nfs/dbraw/zinc/41/71/81/1348417181.db2.gz	HYYHRMAUUAUNJN-UHFFFAOYSA-N	0	3	335.451	3.254	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3ccc(F)cn3)cccc2C1	ZINC001051286021	1348419051	/nfs/dbraw/zinc/41/90/51/1348419051.db2.gz	BUVGAPOADCVSPY-UHFFFAOYSA-N	0	3	339.414	3.085	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)[C@H]3C[C@]3(C)C(C)C)cccc2C1	ZINC001051306258	1348427675	/nfs/dbraw/zinc/42/76/75/1348427675.db2.gz	QFLAGKYURGQVKL-IFMALSPDSA-N	0	3	338.495	3.366	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2sc(C)nc2CC(C)C)CC1	ZINC001052532272	1348568232	/nfs/dbraw/zinc/56/82/32/1348568232.db2.gz	BVRBXCHOIWJCNK-MRXNPFEDSA-N	0	3	347.528	3.258	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2coc3ccc(OC)cc23)CC1	ZINC001052548359	1348575648	/nfs/dbraw/zinc/57/56/48/1348575648.db2.gz	ARURRKMRFXBDEM-HNNXBMFYSA-N	0	3	340.423	3.049	20	30		EGEDHN
CC1(C)CC[C@@H]1C(=O)N[C@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC001052636717	1348605169	/nfs/dbraw/zinc/60/51/69/1348605169.db2.gz	WYGWCVJTZWCCQE-RBUKOAKNSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCCN(Cc3scnc3C)CC2)C1	ZINC001052690566	1348634287	/nfs/dbraw/zinc/63/42/87/1348634287.db2.gz	NXSWIZMAWPJKRF-HNNXBMFYSA-N	0	3	333.501	3.279	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cc3cc(F)ccc3o2)CC1	ZINC001052760475	1348667119	/nfs/dbraw/zinc/66/71/19/1348667119.db2.gz	GSQSLUSZAKXLJG-INIZCTEOSA-N	0	3	328.387	3.180	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@H]2CCCN(C[C@@H](F)CC)CC2)cc1	ZINC001052771751	1348672624	/nfs/dbraw/zinc/67/26/24/1348672624.db2.gz	OHBTXBDRURLTTA-ROUUACIJSA-N	0	3	346.446	3.031	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2oc3ccccc3c2Cl)CC1	ZINC001052859441	1348705235	/nfs/dbraw/zinc/70/52/35/1348705235.db2.gz	LRLZEVQNRIJRRQ-CYBMUJFWSA-N	0	3	330.815	3.304	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2csc3c2CC[C@@H](C)C3)CC1	ZINC001052911640	1348743899	/nfs/dbraw/zinc/74/38/99/1348743899.db2.gz	LULROTTYEKSHBY-CVEARBPZSA-N	0	3	344.524	3.481	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cc3c(s2)CCCC3)CC1	ZINC001052914867	1348746192	/nfs/dbraw/zinc/74/61/92/1348746192.db2.gz	WNXVXFQIGHXSLK-INIZCTEOSA-N	0	3	330.497	3.235	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc(N(C)CCC)cc2)CC1	ZINC001052973900	1348782484	/nfs/dbraw/zinc/78/24/84/1348782484.db2.gz	FTLHXOAKRGLYJY-LJQANCHMSA-N	0	3	341.499	3.140	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2oc(C)nc2C)C1	ZINC001053075529	1348893613	/nfs/dbraw/zinc/89/36/13/1348893613.db2.gz	HOYJZDOVAWXKHS-ZWKOTPCHSA-N	0	3	343.471	3.021	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2c(C)coc2C)C1	ZINC001053082663	1348904160	/nfs/dbraw/zinc/90/41/60/1348904160.db2.gz	GKHHZZYEZXYLRV-ROUUACIJSA-N	0	3	328.456	3.236	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2[nH]c(C)cc2C)C1	ZINC001053090305	1348916116	/nfs/dbraw/zinc/91/61/16/1348916116.db2.gz	GNQHCMLMKOTSNC-OALUTQOASA-N	0	3	341.499	3.362	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccncc2Cl)C1	ZINC001053098006	1348928937	/nfs/dbraw/zinc/92/89/37/1348928937.db2.gz	JBODSKXJRFBBFP-QAPCUYQASA-N	0	3	345.874	3.075	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)CCc2cccs2)C1	ZINC001053107584	1348946561	/nfs/dbraw/zinc/94/65/61/1348946561.db2.gz	JWBJYSDUMQQYKN-HKUYNNGSSA-N	0	3	344.524	3.407	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc(F)cc3ccoc31)C2	ZINC001054155985	1349158720	/nfs/dbraw/zinc/15/87/20/1349158720.db2.gz	GMDXGKVPWZGIAU-FQEVSTJZSA-N	0	3	340.398	3.133	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccnc3ccccc31)C2	ZINC001054162224	1349164893	/nfs/dbraw/zinc/16/48/93/1349164893.db2.gz	ZUSGFGKGCYLKKL-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc3ccsc3[nH]1)C2	ZINC001054173110	1349174703	/nfs/dbraw/zinc/17/47/03/1349174703.db2.gz	HWFFJODOLPJNFO-LJQANCHMSA-N	0	3	341.480	3.181	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@]2(CCN(Cc3oc(C)nc3C)C2)C1	ZINC001054175902	1349177624	/nfs/dbraw/zinc/17/76/24/1349177624.db2.gz	YAKACMGSOUDVRC-FQEVSTJZSA-N	0	3	345.487	3.318	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)Cc1cccc(Cl)c1)C2	ZINC001054186448	1349189054	/nfs/dbraw/zinc/18/90/54/1349189054.db2.gz	SKAFBIWAZVFUAS-FQEVSTJZSA-N	0	3	344.886	3.220	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H](C)c1cccs1)C2	ZINC001054196565	1349198415	/nfs/dbraw/zinc/19/84/15/1349198415.db2.gz	JKOOKKHOETXHQK-QFBILLFUSA-N	0	3	330.497	3.189	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cccc3cc[nH]c31)C2	ZINC001054202097	1349203618	/nfs/dbraw/zinc/20/36/18/1349203618.db2.gz	WJVIPJXVLDXNML-OAQYLSRUSA-N	0	3	335.451	3.119	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1cccc(F)c1Cl)C2	ZINC001054204284	1349206099	/nfs/dbraw/zinc/20/60/99/1349206099.db2.gz	RVDJMPCKIOUPAC-SFHVURJKSA-N	0	3	334.822	3.040	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@H](F)c1ccccc1)C2	ZINC001054204902	1349207091	/nfs/dbraw/zinc/20/70/91/1349207091.db2.gz	FTNAGZOUJUDFCQ-UYAOXDASSA-N	0	3	328.431	3.035	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1scnc1C(C)C)C2	ZINC001054210153	1349211771	/nfs/dbraw/zinc/21/17/71/1349211771.db2.gz	GUWMRDOYJKYJKF-LJQANCHMSA-N	0	3	345.512	3.218	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)C(C)(C)c1ccccc1F)C2	ZINC001054214035	1349213454	/nfs/dbraw/zinc/21/34/54/1349213454.db2.gz	PLGWALHGQPUYKS-NRFANRHFSA-N	0	3	342.458	3.051	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1cccc(C)c1Cl)C2	ZINC001054215529	1349214579	/nfs/dbraw/zinc/21/45/79/1349214579.db2.gz	XHKBKTWUDZYFAI-IBGZPJMESA-N	0	3	330.859	3.210	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1c(C)csc1Cl)C2	ZINC001054233616	1349225916	/nfs/dbraw/zinc/22/59/16/1349225916.db2.gz	ORRKFSYYGXCOHZ-KRWDZBQOSA-N	0	3	336.888	3.271	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1coc3ccc(F)cc13)C2	ZINC001054233575	1349226083	/nfs/dbraw/zinc/22/60/83/1349226083.db2.gz	NMBIVWCZEKMERK-HXUWFJFHSA-N	0	3	340.398	3.133	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cccc3ccccc31)C2	ZINC001054235911	1349228129	/nfs/dbraw/zinc/22/81/29/1349228129.db2.gz	DLHUXLWIJBAZHB-JOCHJYFZSA-N	0	3	332.447	3.401	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)C1(c3ccccc3)CC1)C2	ZINC001054235956	1349228275	/nfs/dbraw/zinc/22/82/75/1349228275.db2.gz	ATXWNFPNIYWNKC-NRFANRHFSA-N	0	3	336.479	3.056	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(F)cc1Cl)C2	ZINC001054236277	1349229427	/nfs/dbraw/zinc/22/94/27/1349229427.db2.gz	JCGRTJZUFYUONN-GOSISDBHSA-N	0	3	334.822	3.040	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc(C)c(F)c(C)c1)C2	ZINC001054242119	1349236025	/nfs/dbraw/zinc/23/60/25/1349236025.db2.gz	FRKWECMXQYOZDU-FQEVSTJZSA-N	0	3	328.431	3.004	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc3cc(C)ccc3o1)C2	ZINC001054244938	1349238796	/nfs/dbraw/zinc/23/87/96/1349238796.db2.gz	LLZBUQZYLMZALS-NRFANRHFSA-N	0	3	336.435	3.303	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(CF)cc1)C2	ZINC001054247652	1349243577	/nfs/dbraw/zinc/24/35/77/1349243577.db2.gz	ZVHHPEPZLASFFG-HXUWFJFHSA-N	0	3	328.431	3.108	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3n[nH]c(C)c3C)cc2C1	ZINC001054259744	1349256230	/nfs/dbraw/zinc/25/62/30/1349256230.db2.gz	QELZNLLQKQXJFP-UHFFFAOYSA-N	0	3	338.455	3.238	20	30		EGEDHN
CCc1occc1C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001054615065	1349415302	/nfs/dbraw/zinc/41/53/02/1349415302.db2.gz	NZZMBBCOAGDHOZ-MLGOLLRUSA-N	0	3	343.452	3.025	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001054970324	1349530698	/nfs/dbraw/zinc/53/06/98/1349530698.db2.gz	BEYAJULWWDGGKN-KBXCAEBGSA-N	0	3	343.446	3.236	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@H](NCc2cn(C(C)C)nc2C)C1	ZINC001054971374	1349531960	/nfs/dbraw/zinc/53/19/60/1349531960.db2.gz	POXKRBWOXUWGQN-CRAIPNDOSA-N	0	3	346.519	3.311	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2cc3cc(Cl)ccc3[nH]2)C1	ZINC001080239046	1357534190	/nfs/dbraw/zinc/53/41/90/1357534190.db2.gz	KDMANRLSUBTZKJ-SJKOYZFVSA-N	0	3	331.847	3.448	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C=C1CCCCC1)C[C@H](C)O2	ZINC001071144417	1354475198	/nfs/dbraw/zinc/47/51/98/1354475198.db2.gz	NCNXNMAFWSFXRX-FXAWDEMLSA-N	0	3	332.488	3.145	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1cc(F)ccc1C)C[C@H](C)O2	ZINC001071195514	1354496739	/nfs/dbraw/zinc/49/67/39/1354496739.db2.gz	YMQKTZQGEMSMBP-OXJNMPFZSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)O[C@]2(CCN(Cc3ccccc3)C2)C1	ZINC001071197488	1354499272	/nfs/dbraw/zinc/49/92/72/1354499272.db2.gz	UBQJNIZUWNVDLO-UTKZUKDTSA-N	0	3	342.483	3.091	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1cc(C)cc(F)c1)C[C@H](C)O2	ZINC001071213229	1354508952	/nfs/dbraw/zinc/50/89/52/1354508952.db2.gz	BDLHOIQGJJKHCP-JXFKEZNVSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1ccc(C)c(C)c1)C[C@@H](C)O2	ZINC001071236452	1354520698	/nfs/dbraw/zinc/52/06/98/1354520698.db2.gz	VEQJCZWNJVGGSS-WIYYLYMNSA-N	0	3	342.483	3.185	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)CN(C(=O)C1(CC)CCCCC1)C[C@H](C)O2	ZINC001071244394	1354524971	/nfs/dbraw/zinc/52/49/71/1354524971.db2.gz	UGYHTTMRWFJSLE-GHTZIAJQSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc3c(c2)OCCCO3)CC[C@@H]1C	ZINC001071568787	1354768948	/nfs/dbraw/zinc/76/89/48/1354768948.db2.gz	SUTPXZKCLDBDGN-DOTOQJQBSA-N	0	3	344.455	3.007	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2ccc(-c3cc[nH]n3)s2)CC[C@@H]1C	ZINC001071594405	1354784224	/nfs/dbraw/zinc/78/42/24/1354784224.db2.gz	QGFJRQZBVPMYAC-UONOGXRCSA-N	0	3	344.484	3.297	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N[C@@H]1CC[C@@H](C)N(CC(=C)C)C1	ZINC001071620064	1354803019	/nfs/dbraw/zinc/80/30/19/1354803019.db2.gz	ZLDPUCFIISJQMW-IAGOWNOFSA-N	0	3	328.456	3.410	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N[C@H]1CC[C@H](C)N(CC(=C)C)C1	ZINC001071620065	1354803295	/nfs/dbraw/zinc/80/32/95/1354803295.db2.gz	ZLDPUCFIISJQMW-IRXDYDNUSA-N	0	3	328.456	3.410	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc(-c3ccccc3)n[nH]2)CC[C@@H]1C	ZINC001071663525	1354835500	/nfs/dbraw/zinc/83/55/00/1354835500.db2.gz	OOVSUFZOLRLCHO-RDJZCZTQSA-N	0	3	338.455	3.236	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cnn3cccc(Cl)c23)CC[C@H]1C	ZINC001071670508	1354839980	/nfs/dbraw/zinc/83/99/80/1354839980.db2.gz	LWKZZYJGKOJUNC-KGLIPLIRSA-N	0	3	346.862	3.147	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2ncsc2C(F)(F)F)CC[C@@H]1C	ZINC001071682633	1354849801	/nfs/dbraw/zinc/84/98/01/1354849801.db2.gz	ONNJQAZNZRCATK-QWRGUYRKSA-N	0	3	347.406	3.321	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(C)nc2C2CC2)CC[C@H]1C	ZINC001071704514	1354862416	/nfs/dbraw/zinc/86/24/16/1354862416.db2.gz	AJLCCFJCDUQWCH-WBVHZDCISA-N	0	3	327.472	3.426	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(C(F)(F)F)cn2)CC[C@H]1C	ZINC001071721173	1354878910	/nfs/dbraw/zinc/87/89/10/1354878910.db2.gz	MZKHHUVNVRJXFW-OCCSQVGLSA-N	0	3	341.377	3.259	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2cn(C)c3ccccc23)CC[C@@H]1C	ZINC001071779726	1354927990	/nfs/dbraw/zinc/92/79/90/1354927990.db2.gz	ODYMRLIRHWIWMT-WMZOPIPTSA-N	0	3	339.483	3.266	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cn(C)nc2C2CCCC2)CC[C@@H]1C	ZINC001071817801	1354958082	/nfs/dbraw/zinc/95/80/82/1354958082.db2.gz	IHULGZYNJVXBHZ-RDJZCZTQSA-N	0	3	344.503	3.237	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc(-c3cccs3)n[nH]2)CC[C@@H]1C	ZINC001071831167	1354967620	/nfs/dbraw/zinc/96/76/20/1354967620.db2.gz	AOQOIRVJWDWKPU-KBPBESRZSA-N	0	3	344.484	3.297	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccccc2-n2cccn2)CC[C@@H]1C	ZINC001071851769	1354979413	/nfs/dbraw/zinc/97/94/13/1354979413.db2.gz	POKLASAEMKWCTG-IRXDYDNUSA-N	0	3	338.455	3.031	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2c[nH]c3ccc(F)cc23)CC[C@H]1C	ZINC001071851991	1354979731	/nfs/dbraw/zinc/97/97/31/1354979731.db2.gz	TUALUUVPRHPAQS-PBHICJAKSA-N	0	3	343.446	3.395	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cnc(-c3ccccc3)[nH]2)CC[C@@H]1C	ZINC001071857131	1354985928	/nfs/dbraw/zinc/98/59/28/1354985928.db2.gz	DQKKXRAIPYFWHG-DOTOQJQBSA-N	0	3	338.455	3.236	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2c[nH]c(=O)c3ccccc23)CC[C@@H]1C	ZINC001071871441	1354996126	/nfs/dbraw/zinc/99/61/26/1354996126.db2.gz	ICCMJWOSUNULOP-GJZGRUSLSA-N	0	3	339.439	3.099	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(-n3cccc3)nc2)CC[C@H]1C	ZINC001071899535	1355013773	/nfs/dbraw/zinc/01/37/73/1355013773.db2.gz	AUOXEABARLYWRU-AEFFLSMTSA-N	0	3	338.455	3.031	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(C(F)F)cc2F)CC[C@H]1C	ZINC001071920365	1355025982	/nfs/dbraw/zinc/02/59/82/1355025982.db2.gz	PXTSRFRRHVXROL-OCCSQVGLSA-N	0	3	338.373	3.369	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cccn2C2CCCC2)CC[C@@H]1C	ZINC001071937363	1355034325	/nfs/dbraw/zinc/03/43/25/1355034325.db2.gz	AMJBAVFLJXYFDI-DLBZAZTESA-N	0	3	327.472	3.209	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(OC)c(C3CC3)c2)CC[C@@H]1C	ZINC001071946600	1355037109	/nfs/dbraw/zinc/03/71/09/1355037109.db2.gz	LBTDGIYIICDLOO-MAUKXSAKSA-N	0	3	340.467	3.179	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cnn(CCC)c2C2CC2)CC[C@@H]1C	ZINC001071976581	1355055602	/nfs/dbraw/zinc/05/56/02/1355055602.db2.gz	FGVAVHOFVHMNBO-RDJZCZTQSA-N	0	3	344.503	3.329	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cnn(CCCC)c2C)CC[C@@H]1C	ZINC001071976613	1355055750	/nfs/dbraw/zinc/05/57/50/1355055750.db2.gz	FQLCEUITVNITFM-RDJZCZTQSA-N	0	3	332.492	3.150	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2[nH]ccc2-c2ccccc2)CC[C@H]1C	ZINC001071986689	1355059743	/nfs/dbraw/zinc/05/97/43/1355059743.db2.gz	XKCQSYGIGZJFCC-SJLPKXTDSA-N	0	3	335.451	3.288	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccnc(OC(C)C)c2)CC[C@H]1C	ZINC001071986320	1355059965	/nfs/dbraw/zinc/05/99/65/1355059965.db2.gz	SGHLJVXEHWLPRL-NVXWUHKLSA-N	0	3	331.460	3.028	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)Cc2ccc3c(c2)CCCC3)CC[C@@H]1C	ZINC001072065318	1355109960	/nfs/dbraw/zinc/10/99/60/1355109960.db2.gz	BYHDVWZJZWLBTG-OXJNMPFZSA-N	0	3	326.484	3.263	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc(C)n(C(C)(C)C)n2)CC[C@@H]1C	ZINC001072076569	1355115134	/nfs/dbraw/zinc/11/51/34/1355115134.db2.gz	RFFPGYYBRXQSLK-HOCLYGCPSA-N	0	3	332.492	3.105	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cccc3oc(C)nc32)CC[C@H]1C	ZINC001072101041	1355130506	/nfs/dbraw/zinc/13/05/06/1355130506.db2.gz	CJNAUVSLOULSRT-HIFRSBDPSA-N	0	3	327.428	3.295	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C23CC(C(F)(F)F)(C2)C3)CC[C@@H]1C	ZINC001072102092	1355131530	/nfs/dbraw/zinc/13/15/30/1355131530.db2.gz	MRBWVLSGJHSIDP-LOCSVTFISA-N	0	3	330.394	3.264	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(N(C)CC)cc2)CC[C@@H]1C	ZINC001072112578	1355137955	/nfs/dbraw/zinc/13/79/55/1355137955.db2.gz	BZNBWNDYSASUMR-WMZOPIPTSA-N	0	3	329.488	3.302	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(N(C)C(C)C)cc2)CC[C@H]1C	ZINC001072116229	1355140300	/nfs/dbraw/zinc/14/03/00/1355140300.db2.gz	JYJKYJSUAGDMHP-MJGOQNOKSA-N	0	3	341.499	3.137	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)Cc2c(C)oc3ccccc32)CC[C@@H]1C	ZINC001072128625	1355144339	/nfs/dbraw/zinc/14/43/39/1355144339.db2.gz	CZHUPAHDDAGKCO-RDJZCZTQSA-N	0	3	338.451	3.276	20	30		EGEDHN
C=CCN1CC[C@@H](CN(Cc2scnc2C)C(=O)c2ccoc2)C1	ZINC001072134200	1355148049	/nfs/dbraw/zinc/14/80/49/1355148049.db2.gz	HLCCKKFSIUGACT-OAHLLOKOSA-N	0	3	345.468	3.195	20	30		EGEDHN
C/C=C(/C)C(=O)N1CC[C@H](C)[C@H](CNCc2ccccc2C#N)C1	ZINC001072240546	1355200596	/nfs/dbraw/zinc/20/05/96/1355200596.db2.gz	JIUANBHWQDINFF-QNBOTTJQSA-N	0	3	325.456	3.099	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](C)[C@@H](CNCc3csc(C)n3)C2)C1	ZINC001072364128	1355258565	/nfs/dbraw/zinc/25/85/65/1355258565.db2.gz	OYONRSYDYDJQPN-ZBFHGGJFSA-N	0	3	347.528	3.382	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CN(C(=O)c4ccccc4F)C3)C2)cc1	ZINC001072406030	1355275922	/nfs/dbraw/zinc/27/59/22/1355275922.db2.gz	RXTAHKNBBKFUBD-UHFFFAOYSA-N	0	3	349.409	3.045	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H]3CC[C@H](C4CCC4)CC3)C2)C1	ZINC001072827565	1355453583	/nfs/dbraw/zinc/45/35/83/1355453583.db2.gz	OSJJJAGBPGWJMT-WGSAOQKQSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H]3C[C@H]3c3ccc(Cl)s3)C2)C1	ZINC001072916715	1355494552	/nfs/dbraw/zinc/49/45/52/1355494552.db2.gz	SPSAORAMPPKLBW-ZIAGYGMSSA-N	0	3	348.899	3.063	20	30		EGEDHN
C=C1CCC(C(=O)N2CC3(C2)CCN(Cc2cnccc2C)C3)CC1	ZINC001072946123	1355514452	/nfs/dbraw/zinc/51/44/52/1355514452.db2.gz	CFIXMNFFPQWLLZ-UHFFFAOYSA-N	0	3	339.483	3.171	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc(C)c4ccccc34)C2)C1	ZINC001073017554	1355550209	/nfs/dbraw/zinc/55/02/09/1355550209.db2.gz	OTEOKIAIAHHHGV-UHFFFAOYSA-N	0	3	332.447	3.319	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C(C)(C)c3cccc(Cl)c3)C2)C1	ZINC001073021954	1355553079	/nfs/dbraw/zinc/55/30/79/1355553079.db2.gz	USPFXSWGPXZITH-UHFFFAOYSA-N	0	3	344.886	3.175	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H](CC3CCCC3)C(C)C)C2)C1	ZINC001073029629	1355557262	/nfs/dbraw/zinc/55/72/62/1355557262.db2.gz	CLUANNWLZMPHQE-LJQANCHMSA-N	0	3	330.516	3.397	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@@H]3C[C@H]3c3cccc(Cl)c3)C2)C1	ZINC001073045129	1355568094	/nfs/dbraw/zinc/56/80/94/1355568094.db2.gz	UWWDHYNLBCYMHL-DLBZAZTESA-N	0	3	330.859	3.164	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc(Cl)c(CCC)c3)C2)C1	ZINC001073124700	1355609438	/nfs/dbraw/zinc/60/94/38/1355609438.db2.gz	ZHAXFAQADSUUPU-UHFFFAOYSA-N	0	3	344.886	3.464	20	30		EGEDHN
CCCC(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(OCC#N)cc1	ZINC001073928467	1355963507	/nfs/dbraw/zinc/96/35/07/1355963507.db2.gz	CJDUWHOSCAQDPW-GOSISDBHSA-N	0	3	343.471	3.202	20	30		EGEDHN
CN(Cc1ccc(CF)cc1)C[C@H]1CCCCN1C(=O)C#CC1CC1	ZINC001074012551	1356034762	/nfs/dbraw/zinc/03/47/62/1356034762.db2.gz	ALIHEMODJMCSNU-HXUWFJFHSA-N	0	3	342.458	3.382	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCO[C@@H]1C1CCN(C(=O)C(C)(C)C)CC1	ZINC001075416087	1356362948	/nfs/dbraw/zinc/36/29/48/1356362948.db2.gz	TWOOTQFSAVLUPM-HZPDHXFCSA-N	0	3	342.911	3.161	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@H](CC)Oc3ccccc3C)[C@@H]2C1	ZINC001076306702	1356544332	/nfs/dbraw/zinc/54/43/32/1356544332.db2.gz	AOSHEUIEUJYPOW-OTWHNJEPSA-N	0	3	342.483	3.261	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3csc4c3CC[C@@H](C)C4)[C@@H]2C1	ZINC001076530544	1356606535	/nfs/dbraw/zinc/60/65/35/1356606535.db2.gz	UBOQOILVBFASBA-RVKKMQEKSA-N	0	3	342.508	3.043	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)CCc2ccccc2C)C[C@H]1C(F)(F)F	ZINC001099315388	1363745400	/nfs/dbraw/zinc/74/54/00/1363745400.db2.gz	VAUBCOFFPXVMFF-HZPDHXFCSA-N	0	3	340.389	3.093	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCCO[C@@H](CNCc2ccsc2)C1	ZINC001078460281	1356977880	/nfs/dbraw/zinc/97/78/80/1356977880.db2.gz	PFVNKAXLUTVAFF-WMZOPIPTSA-N	0	3	336.501	3.058	20	30		EGEDHN
CC1(C(=O)N[C@@H]2C[C@H](NCc3ccc(C#N)cc3F)C23CCC3)CC1	ZINC001078628131	1357040402	/nfs/dbraw/zinc/04/04/02/1357040402.db2.gz	AYHVUNPPQCKMRR-DLBZAZTESA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccn3ccccc23)C12CCC2	ZINC001078677711	1357051143	/nfs/dbraw/zinc/05/11/43/1357051143.db2.gz	IXMMJGJLKZRDFF-IRXDYDNUSA-N	0	3	343.858	3.322	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2cc(OC)cs2)C12CCC2	ZINC001078695672	1357059386	/nfs/dbraw/zinc/05/93/86/1357059386.db2.gz	PSGNZTFODKVEGF-ZIAGYGMSSA-N	0	3	340.876	3.140	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@@H](NCc3conc3C)C23CCC3)CC1	ZINC001078716653	1357062796	/nfs/dbraw/zinc/06/27/96/1357062796.db2.gz	WGPVOSIBAAXOLO-MSOLQXFVSA-N	0	3	343.471	3.246	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@@H](NCc3cnoc3C)C23CCC3)CC1	ZINC001078716577	1357063039	/nfs/dbraw/zinc/06/30/39/1357063039.db2.gz	VGKTVVHWVBZFBQ-MSOLQXFVSA-N	0	3	343.471	3.246	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2C[C@H](NCc3conc3CC)C23CCC3)C1	ZINC001078720842	1357065674	/nfs/dbraw/zinc/06/56/74/1357065674.db2.gz	RLFWTBJKTXAGDO-DLBZAZTESA-N	0	3	343.471	3.110	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2coc(CC3CC3)n2)C12CCC2	ZINC001078766450	1357072965	/nfs/dbraw/zinc/07/29/65/1357072965.db2.gz	DPKHBKFBVQLYMS-HUUCEWRRSA-N	0	3	349.862	3.010	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc(C)cc2OC)C12CCC2	ZINC001078785327	1357080773	/nfs/dbraw/zinc/08/07/73/1357080773.db2.gz	BRHPGDLFJBQPEY-IRXDYDNUSA-N	0	3	348.874	3.387	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)Cc2cccc(CC)c2)C[C@H]1c1ccccc1	ZINC001081135191	1357844382	/nfs/dbraw/zinc/84/43/82/1357844382.db2.gz	KVOTWHBXXADGCS-FCHUYYIVSA-N	0	3	346.474	3.009	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H]2CC[C@@H]3C[C@@H]3CC2)C[C@H]1c1ccccc1	ZINC001081150775	1357845142	/nfs/dbraw/zinc/84/51/42/1357845142.db2.gz	AYPGDXIIBKCIOE-JRSUCEMESA-N	0	3	336.479	3.030	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C[C@@H](C)c2ccccc2)C[C@H]1c1ccccc1	ZINC001081222127	1357851329	/nfs/dbraw/zinc/85/13/29/1357851329.db2.gz	NLBUCRLMXSGWKH-BVYCBKJFSA-N	0	3	346.474	3.398	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)C2CC(C)(C)CC(C)(C)C2)[C@H](OC)C1	ZINC001081989723	1357911640	/nfs/dbraw/zinc/91/16/40/1357911640.db2.gz	XYHZNKUFZWHFCA-IAGOWNOFSA-N	0	3	336.520	3.230	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2cc(C(C)(C)C)oc2C)[C@H](OC)C1	ZINC001082180820	1357970782	/nfs/dbraw/zinc/97/07/82/1357970782.db2.gz	FKXYBORTHHPLMF-IAGOWNOFSA-N	0	3	348.487	3.281	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)C[C@@H]3CCCC(C)(C)C3)[C@H]2C1	ZINC001083248390	1358127231	/nfs/dbraw/zinc/12/72/31/1358127231.db2.gz	DPESQOSMVWDJJV-OKZBNKHCSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)C34CC(C(C)(C)C)(C3)C4)[C@H]2C1	ZINC001083288009	1358128958	/nfs/dbraw/zinc/12/89/58/1358128958.db2.gz	JORZWGGRKYAUAM-ZGDXVETISA-N	0	3	346.515	3.081	20	30		EGEDHN
Cc1cc(C)c(CN2CC[C@@H]3CN(C(=O)C#CC4CC4)[C@@H]3C2)c(C)c1	ZINC001084329858	1358194590	/nfs/dbraw/zinc/19/45/90/1358194590.db2.gz	NKMCVUMTZCGAHK-TZIWHRDSSA-N	0	3	336.479	3.058	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)c3coc4cc(C)c(C)cc34)[C@@H]2C1	ZINC001084548024	1358234974	/nfs/dbraw/zinc/23/49/74/1358234974.db2.gz	YACBKCRCGHWCKJ-VQIMIIECSA-N	0	3	336.435	3.219	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3c(F)ccc(F)c3F)[C@@H]2C1	ZINC001084618412	1358256422	/nfs/dbraw/zinc/25/64/22/1358256422.db2.gz	NPATUHJFWQNHJH-IUODEOHRSA-N	0	3	338.373	3.216	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)c3ccccc3-n3cccc3)[C@@H]2C1	ZINC001084629236	1358260458	/nfs/dbraw/zinc/26/04/58/1358260458.db2.gz	MGUGZZOEDLQQOW-YLJYHZDGSA-N	0	3	335.451	3.200	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3c(Cl)cncc3Cl)[C@@H]2C1	ZINC001084631571	1358261315	/nfs/dbraw/zinc/26/13/15/1358261315.db2.gz	ZKPSXOJCJZNYOF-BXUZGUMPSA-N	0	3	340.254	3.111	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)c3ccc(C)c4ccccc34)[C@@H]2C1	ZINC001084687873	1358281203	/nfs/dbraw/zinc/28/12/03/1358281203.db2.gz	YISMBTHFCWOWTI-DYESRHJHSA-N	0	3	332.447	3.318	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@@H]3C[C@H]3c3ccccc3F)[C@@H]2C1	ZINC001084711350	1358289518	/nfs/dbraw/zinc/28/95/18/1358289518.db2.gz	DHEVTMJOVPUGRC-NOCIGQNYSA-N	0	3	328.431	3.038	20	30		EGEDHN
C/C(=C/C(=O)N1CC[C@H]2CCN(Cc3ccc(C#N)cc3)[C@H]2C1)C1CC1	ZINC001084897160	1358342859	/nfs/dbraw/zinc/34/28/59/1358342859.db2.gz	QIJPCQHZWKDTNI-HEUNSUFQSA-N	0	3	349.478	3.337	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@H](C)c3ccc(F)cc3F)C[C@@H]21	ZINC001085097344	1358389476	/nfs/dbraw/zinc/38/94/76/1358389476.db2.gz	CMNJRPUSXIFNNV-CLCXKQKWSA-N	0	3	346.421	3.014	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@@H]2CCCC[C@H]2NC(=O)C=C2CCC2)c1	ZINC001085166437	1358420443	/nfs/dbraw/zinc/42/04/43/1358420443.db2.gz	AGYLTAMVXJYCMG-RTBURBONSA-N	0	3	341.430	3.325	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cc(Cl)cn1C	ZINC001085266523	1358447504	/nfs/dbraw/zinc/44/75/04/1358447504.db2.gz	DHFPSYUJYYZVPV-CHWSQXEVSA-N	0	3	330.259	3.062	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccnc2ccncc21	ZINC001085285834	1358452210	/nfs/dbraw/zinc/45/22/10/1358452210.db2.gz	IQYBKXUYWGKZPN-IAGOWNOFSA-N	0	3	344.846	3.013	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1oc(CCC)nc1C	ZINC001085393449	1358487737	/nfs/dbraw/zinc/48/77/37/1358487737.db2.gz	XTEBIBQBQKTIQJ-ZIAGYGMSSA-N	0	3	339.867	3.319	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)Cc1cc(C)ccc1F	ZINC001085400932	1358489608	/nfs/dbraw/zinc/48/96/08/1358489608.db2.gz	NAQWCFJJWDTZSS-IAGOWNOFSA-N	0	3	338.854	3.446	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccc(F)cc1F	ZINC001085411442	1358493138	/nfs/dbraw/zinc/49/31/38/1358493138.db2.gz	VHZJMQILOZAATP-HUUCEWRRSA-N	0	3	328.790	3.348	20	30		EGEDHN
Cc1ccccc1[C@@H](C)N1CC[C@@H]1CN(C)C(=O)c1ccc(C#N)[nH]1	ZINC001085553695	1358589204	/nfs/dbraw/zinc/58/92/04/1358589204.db2.gz	UNSCXYDTRRFSDJ-NVXWUHKLSA-N	0	3	336.439	3.102	20	30		EGEDHN
Cc1ccccc1[C@H](C)N1CC[C@@H]1CN(C)C(=O)c1c[nH]c(C#N)c1	ZINC001085556767	1358591988	/nfs/dbraw/zinc/59/19/88/1358591988.db2.gz	ZMKQENHCGQIFSX-MAUKXSAKSA-N	0	3	336.439	3.102	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc(F)cc2ccncc21	ZINC001085599979	1358625746	/nfs/dbraw/zinc/62/57/46/1358625746.db2.gz	HBYCRPPMSLCIEB-QGZVFWFLSA-N	0	3	341.430	3.486	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N(C)C[C@H]1CCN1CCCC1CCC1	ZINC001085601457	1358626883	/nfs/dbraw/zinc/62/68/83/1358626883.db2.gz	XKYYNSKKRWMSPE-QRVBRYPASA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1cc(C)nn1C(CC)CC	ZINC001085682543	1358684324	/nfs/dbraw/zinc/68/43/24/1358684324.db2.gz	WAQQRXNRGQOQAE-KRWDZBQOSA-N	0	3	332.492	3.275	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc2c(c1)C(C)(C)CO2	ZINC001085717441	1358708203	/nfs/dbraw/zinc/70/82/03/1358708203.db2.gz	NKENYKRPSQSHLE-KRWDZBQOSA-N	0	3	342.483	3.469	20	30		EGEDHN
CCCC[C@](C)(F)C(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C1	ZINC001183801299	1387351820	/nfs/dbraw/zinc/35/18/20/1387351820.db2.gz	UMAPGCPFMAQYSU-DYVFJYSZSA-N	0	3	337.464	3.229	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@H]1COc2cc(C)c(C)cc21	ZINC001085742947	1358725534	/nfs/dbraw/zinc/72/55/34/1358725534.db2.gz	CFJGPWVUBOYEEP-MJGOQNOKSA-N	0	3	342.483	3.278	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cn(C)nc1C1CCCC1	ZINC001085810852	1358788828	/nfs/dbraw/zinc/78/88/28/1358788828.db2.gz	PZEFRFAKJGAXEA-KRWDZBQOSA-N	0	3	344.503	3.190	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N(C)C[C@@H]1CCN1CCCC1CCCC1	ZINC001085869663	1358834923	/nfs/dbraw/zinc/83/49/23/1358834923.db2.gz	XOLAKYNOHOKGLW-UFYCRDLUSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc(Cl)cc(OC)c1	ZINC001085888231	1358847212	/nfs/dbraw/zinc/84/72/12/1358847212.db2.gz	UASYPAFCHYGWJM-MRXNPFEDSA-N	0	3	336.863	3.461	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc(-c2c[nH]cn2)cc1	ZINC001085906473	1358865246	/nfs/dbraw/zinc/86/52/46/1358865246.db2.gz	JKBUMLMGMIPKHG-GOSISDBHSA-N	0	3	338.455	3.189	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cnn([C@H](C)CC)c1C	ZINC001085916882	1358876407	/nfs/dbraw/zinc/87/64/07/1358876407.db2.gz	LHJOIUXEDAIDAV-NVXWUHKLSA-N	0	3	332.492	3.275	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1cnn(C2CCCC2)c1C	ZINC001085917913	1358877500	/nfs/dbraw/zinc/87/75/00/1358877500.db2.gz	NVSCAJDEVZCFGC-KRWDZBQOSA-N	0	3	330.476	3.029	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1ccccc1OCC1CC1	ZINC001085985744	1358938417	/nfs/dbraw/zinc/93/84/17/1358938417.db2.gz	MEWVGVSPBJREIR-QGZVFWFLSA-N	0	3	328.456	3.198	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)c2cc(C)cs2)C1	ZINC001086079646	1358990296	/nfs/dbraw/zinc/99/02/96/1358990296.db2.gz	AXUJTCKYKWAKDV-TXEJJXNPSA-N	0	3	343.290	3.063	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(C)nc2C(C)C)C1	ZINC001086159785	1359011714	/nfs/dbraw/zinc/01/17/14/1359011714.db2.gz	JOUNHTVYUWYLRO-GASCZTMLSA-N	0	3	335.879	3.364	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc3ccc(C)cc3[nH]2)C1	ZINC001086440522	1359097955	/nfs/dbraw/zinc/09/79/55/1359097955.db2.gz	CLCRHTJNGWWWSX-CTYIDZIISA-N	0	3	331.847	3.327	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc(Cl)c(Cl)[nH]2)C1	ZINC001086442193	1359098270	/nfs/dbraw/zinc/09/82/70/1359098270.db2.gz	JTURMFAAYBNEHS-KYZUINATSA-N	0	3	336.650	3.172	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc3cccc(F)c3o2)C1	ZINC001086556227	1359143902	/nfs/dbraw/zinc/14/39/02/1359143902.db2.gz	OBCSKVJXZXTSAE-AULYBMBSSA-N	0	3	336.794	3.422	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)C23CCC(CC2)C3)C1	ZINC001086595652	1359158775	/nfs/dbraw/zinc/15/87/75/1359158775.db2.gz	MJDDMNKQGCYMJB-GWFKXHKXSA-N	0	3	336.479	3.174	20	30		EGEDHN
CC/C=C(\C)C(=O)N1CC[C@H](CNCc2ccccc2C#N)[C@@H](C)C1	ZINC001184030503	1387383083	/nfs/dbraw/zinc/38/30/83/1387383083.db2.gz	DMQDYBSYLBOFAK-WAIGWNOASA-N	0	3	339.483	3.489	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2ccc(C)cc2)C1	ZINC001086621515	1359167070	/nfs/dbraw/zinc/16/70/70/1359167070.db2.gz	ZBLCAUBYKVWDKV-LEWJYISDSA-N	0	3	332.447	3.216	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](CNCc2nc3ccccc3o2)[C@H](C)C1	ZINC001184007226	1387380775	/nfs/dbraw/zinc/38/07/75/1387380775.db2.gz	BMFQBQCBYVREMU-CVEARBPZSA-N	0	3	341.455	3.368	20	30		EGEDHN
CC1(C)CCC[C@@H]1C(=O)NCC1(NCc2ccc(C#N)cc2)CC1	ZINC001323520884	1387381253	/nfs/dbraw/zinc/38/12/53/1387381253.db2.gz	WIYFCQGBTPEACM-QGZVFWFLSA-N	0	3	325.456	3.123	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cnc(C3CC3)s2)C1	ZINC001086858970	1359215730	/nfs/dbraw/zinc/21/57/30/1359215730.db2.gz	FJZZTYJXQIRJTN-WCQYABFASA-N	0	3	339.892	3.261	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](CNCc2nc(C)c(C)s2)[C@H](C)C1	ZINC001184017979	1387382358	/nfs/dbraw/zinc/38/23/58/1387382358.db2.gz	CSZRWYBOBANZRW-CZUORRHYSA-N	0	3	335.517	3.300	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc(F)cc3)C2)CC1	ZINC001086898382	1359227998	/nfs/dbraw/zinc/22/79/98/1359227998.db2.gz	HFXVFYZJYAROJJ-MRXNPFEDSA-N	0	3	328.431	3.166	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3c(C)oc(C)c3C)C2)CC1	ZINC001086931544	1359255259	/nfs/dbraw/zinc/25/52/59/1359255259.db2.gz	LGTXMWGRWDNLND-CQSZACIVSA-N	0	3	328.456	3.155	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cc(Cl)ccc3F)C2)CC1	ZINC001086932021	1359255665	/nfs/dbraw/zinc/25/56/65/1359255665.db2.gz	YDTQVPJDOTTZND-AWEZNQCLSA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccn(CC)c3C)C2)CC1	ZINC001086938581	1359261189	/nfs/dbraw/zinc/26/11/89/1359261189.db2.gz	UUXSWYLVYOWONU-QGZVFWFLSA-N	0	3	341.499	3.156	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc[nH]c3C3CC3)C2)CC1	ZINC001086939364	1359261534	/nfs/dbraw/zinc/26/15/34/1359261534.db2.gz	OUWVYFMYDSQGRS-MRXNPFEDSA-N	0	3	339.483	3.232	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc(F)c(C)c3)C2)CC1	ZINC001086939152	1359261558	/nfs/dbraw/zinc/26/15/58/1359261558.db2.gz	JMZGMUQCVFPDJZ-QGZVFWFLSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)C[C@@H]3CCCC3(F)F)C2)CC1	ZINC001086939193	1359261590	/nfs/dbraw/zinc/26/15/90/1359261590.db2.gz	KCOVCPVBPRKIKO-CVEARBPZSA-N	0	3	338.442	3.148	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3nccc4ccccc43)C2)CC1	ZINC001086940092	1359262197	/nfs/dbraw/zinc/26/21/97/1359262197.db2.gz	HWAUZCNFNOLNBA-QGZVFWFLSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)Cc3cc(C)cc(C)c3)C2)CC1	ZINC001086941449	1359263272	/nfs/dbraw/zinc/26/32/72/1359263272.db2.gz	USFJIYHQRHHIEI-IBGZPJMESA-N	0	3	338.495	3.182	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc[nH]c3C3CCC3)C2)CC1	ZINC001086942747	1359264207	/nfs/dbraw/zinc/26/42/07/1359264207.db2.gz	ZYILWQRWTMKVSI-MRXNPFEDSA-N	0	3	339.483	3.232	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cccc4cc[nH]c43)C2)CC1	ZINC001086943880	1359264842	/nfs/dbraw/zinc/26/48/42/1359264842.db2.gz	HRFKZLHQXSXCGL-MRXNPFEDSA-N	0	3	335.451	3.118	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@H](CC)OC3CCCC3)C2)CC1	ZINC001086945581	1359266415	/nfs/dbraw/zinc/26/64/15/1359266415.db2.gz	FFPCFIRVZCLEFV-MJGOQNOKSA-N	0	3	346.515	3.060	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)CCc3ccc(C)o3)C2)CC1	ZINC001086957378	1359278176	/nfs/dbraw/zinc/27/81/76/1359278176.db2.gz	LGXNPQZRZZGAME-QGZVFWFLSA-N	0	3	342.483	3.247	20	30		EGEDHN
C[C@@H]1CCN(C(=O)/C=C\C2CC2)[C@H](CNCc2ccc(C#N)s2)C1	ZINC001087141147	1359303399	/nfs/dbraw/zinc/30/33/99/1359303399.db2.gz	CQHDZYQRIJODIY-ULJGCTHBSA-N	0	3	343.496	3.303	20	30		EGEDHN
C[C@@H]1CCN(C(=O)[C@@H]2CC23CC3)[C@H](CNCc2ccc(C#N)s2)C1	ZINC001087218809	1359324593	/nfs/dbraw/zinc/32/45/93/1359324593.db2.gz	VJGMGYRETOWDCM-KEYYUXOJSA-N	0	3	343.496	3.137	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc(C)cs1	ZINC001087285420	1359364508	/nfs/dbraw/zinc/36/45/08/1359364508.db2.gz	YFFJLBWBHFVUDU-HYVNUMGLSA-N	0	3	330.497	3.299	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccsc3C)C(C)(C)[C@H]21	ZINC001087286508	1359364935	/nfs/dbraw/zinc/36/49/35/1359364935.db2.gz	RVHCYMUGGRLRKY-IKGGRYGDSA-N	0	3	330.497	3.299	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cccc(F)c1F	ZINC001087301070	1359384091	/nfs/dbraw/zinc/38/40/91/1359384091.db2.gz	VTAYMJHGZCWKEM-FHLIZLRMSA-N	0	3	346.421	3.207	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(CCC)cc3)C(C)(C)[C@H]21	ZINC001087301223	1359384546	/nfs/dbraw/zinc/38/45/46/1359384546.db2.gz	ZPESGDUORHNOKZ-AQNXPRMDSA-N	0	3	338.495	3.491	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc4cc[nH]c4c3)C(C)(C)[C@H]21	ZINC001087305988	1359392203	/nfs/dbraw/zinc/39/22/03/1359392203.db2.gz	BOURPVQSZBZNNW-HOJAQTOUSA-N	0	3	349.478	3.410	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)Cc3ccc(CC)cc3)C(C)(C)[C@H]21	ZINC001087307284	1359393616	/nfs/dbraw/zinc/39/36/16/1359393616.db2.gz	XEPDJNXDBRDZJI-GIVPXCGWSA-N	0	3	338.495	3.030	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(C(F)F)cc3)C(C)(C)[C@@H]21	ZINC001087308693	1359395884	/nfs/dbraw/zinc/39/58/84/1359395884.db2.gz	UTFFKYCTJPRUOW-BRWVUGGUSA-N	0	3	346.421	3.476	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccoc1CCC	ZINC001087312760	1359401457	/nfs/dbraw/zinc/40/14/57/1359401457.db2.gz	JWZBTKBXRMTLKP-NZSAHSFTSA-N	0	3	342.483	3.474	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc(Cl)cc1	ZINC001087313852	1359403057	/nfs/dbraw/zinc/40/30/57/1359403057.db2.gz	BAGWJUFPBJHEQD-IXDOHACOSA-N	0	3	330.859	3.192	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc4[nH]ccc4s3)C(C)(C)[C@@H]21	ZINC001087316905	1359408271	/nfs/dbraw/zinc/40/82/71/1359408271.db2.gz	ZEFRJCFBHGQHHC-CSMYWGQOSA-N	0	3	341.480	3.081	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc4ccccc4[nH]3)C(C)(C)[C@H]21	ZINC001087318285	1359409704	/nfs/dbraw/zinc/40/97/04/1359409704.db2.gz	UWPQJVVDTCNBJA-MNEFBYGVSA-N	0	3	335.451	3.020	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(C)c(F)c(C)c3)C(C)(C)[C@H]21	ZINC001087318181	1359410031	/nfs/dbraw/zinc/41/00/31/1359410031.db2.gz	SKIDMDOVGWLWDI-QRQLOZEOSA-N	0	3	342.458	3.295	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)C[C@H]2C=CCC2)C1	ZINC001087421131	1359458492	/nfs/dbraw/zinc/45/84/92/1359458492.db2.gz	OFTTXIRPOUKGPW-CEWLAPEOSA-N	0	3	336.479	3.340	20	30		EGEDHN
C=C(C)CCN1CC[C@H](c2ccccc2)[C@H](NC(=O)c2cnco2)C1	ZINC001087434077	1359463627	/nfs/dbraw/zinc/46/36/27/1359463627.db2.gz	UWKMYLRHKULOCI-QZTJIDSGSA-N	0	3	339.439	3.229	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccc(OC(C)C)nc2)[C@H]1CC	ZINC001087593381	1359546694	/nfs/dbraw/zinc/54/66/94/1359546694.db2.gz	DUSARYXCRJZUOR-DLBZAZTESA-N	0	3	331.460	3.028	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccnn2C(CC)CC)[C@H]1CC	ZINC001087601130	1359549712	/nfs/dbraw/zinc/54/97/12/1359549712.db2.gz	BSILTEPPWOHQKG-DLBZAZTESA-N	0	3	332.492	3.403	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3ccc(CO)cc3)[C@@H]2CC)C1	ZINC001087717715	1359608675	/nfs/dbraw/zinc/60/86/75/1359608675.db2.gz	NAWMGRQFOFCEEN-RBUKOAKNSA-N	0	3	342.483	3.004	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cccc(OCC(C)C)c2)[C@H]1CC	ZINC001087822897	1359665092	/nfs/dbraw/zinc/66/50/92/1359665092.db2.gz	PVHHTPWXSRNDTA-RBUKOAKNSA-N	0	3	330.472	3.490	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)CC2C3CC4CC(C3)CC2C4)[C@H]1CC	ZINC001087836268	1359671960	/nfs/dbraw/zinc/67/19/60/1359671960.db2.gz	LPNSYYGMUSMMMC-OYZZJKLHSA-N	0	3	342.527	3.441	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3cc(C)c(C)cc3Cl)C[C@@H]2C1	ZINC001088065542	1359740033	/nfs/dbraw/zinc/74/00/33/1359740033.db2.gz	YIABYDAQPRBWIX-SJORKVTESA-N	0	3	344.886	3.374	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1C[C@H]2CCN(Cc3ccc(C#N)cc3)C[C@H]2C1	ZINC001088127732	1359766052	/nfs/dbraw/zinc/76/60/52/1359766052.db2.gz	KWDPPVJCWLBAKZ-AHRSYUTCSA-N	0	3	339.483	3.131	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3cc(Cl)ccc3C)C[C@@H]2C1	ZINC001088143000	1359772134	/nfs/dbraw/zinc/77/21/34/1359772134.db2.gz	OUFXKFJVATZUFR-CVEARBPZSA-N	0	3	330.859	3.066	20	30		EGEDHN
C=CCN1CC[C@@H](OCC2CCN(C(=O)C3CCCCC3)CC2)C1	ZINC001088228461	1359808067	/nfs/dbraw/zinc/80/80/67/1359808067.db2.gz	QQEDECZJNWQKSG-LJQANCHMSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCN1CC[C@@H](OCC2CCN(C(=O)[C@H]3CCC(C)(C)C3)CC2)C1	ZINC001088238281	1359809699	/nfs/dbraw/zinc/80/96/99/1359809699.db2.gz	QHCYSJPLKXWJJB-RBUKOAKNSA-N	0	3	348.531	3.328	20	30		EGEDHN
C=C(Br)CN[C@H]1CCCCCN(C(=O)C=C(C)C)C1	ZINC001088253635	1359818861	/nfs/dbraw/zinc/81/88/61/1359818861.db2.gz	WDOVHVMYTVVWIT-AWEZNQCLSA-N	0	3	329.282	3.222	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2ccn3ccnc3c2)C1	ZINC001088346589	1359833803	/nfs/dbraw/zinc/83/38/03/1359833803.db2.gz	SZPUVEFEMKCBNI-INIZCTEOSA-N	0	3	346.862	3.061	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCCC[C@@H](NCc2n[nH]c(C(C)C)n2)C1	ZINC001088360334	1359844195	/nfs/dbraw/zinc/84/41/95/1359844195.db2.gz	WDCCXYBQOFDOOL-OAHLLOKOSA-N	0	3	347.507	3.001	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CCCCC[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001088360531	1359844509	/nfs/dbraw/zinc/84/45/09/1359844509.db2.gz	APSKMOJPDDDPBN-DLBZAZTESA-N	0	3	349.425	3.306	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)C2(c3cccnc3)CC2)C1	ZINC001088367741	1359852289	/nfs/dbraw/zinc/85/22/89/1359852289.db2.gz	SAUZITMJBKMXOM-KRWDZBQOSA-N	0	3	347.890	3.227	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)[C@H]2COc3ccccc32)C1	ZINC001088433784	1359902093	/nfs/dbraw/zinc/90/20/93/1359902093.db2.gz	FTEVTWILDPFVQP-WBVHZDCISA-N	0	3	348.874	3.276	20	30		EGEDHN
C=C(C)CCN1CC[C@H](NC(=O)c2sc(Cl)nc2C)[C@H]1C	ZINC001088593780	1359985415	/nfs/dbraw/zinc/98/54/15/1359985415.db2.gz	AGBFBSRYEJPBMQ-NEPJUHHUSA-N	0	3	327.881	3.264	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2ccc(O[C@@H](C)CC)cc2)[C@H]1C	ZINC001088963138	1360117932	/nfs/dbraw/zinc/11/79/32/1360117932.db2.gz	RIYZLKHLSWGUQH-FCEWJHQRSA-N	0	3	328.456	3.080	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cnn(C(CC)CC)c2C)[C@H]1C	ZINC001088966092	1360118256	/nfs/dbraw/zinc/11/82/56/1360118256.db2.gz	RFANUMBOJUBZNF-QAPCUYQASA-N	0	3	332.492	3.321	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)[C@H]2CCCc3sc(C)nc32)[C@H]1C	ZINC001088975710	1360121000	/nfs/dbraw/zinc/12/10/00/1360121000.db2.gz	LOBXCXYVPOJFNM-SNPRPXQTSA-N	0	3	333.501	3.027	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)Cc2coc3cc(C)ccc23)[C@H]1C	ZINC001089023411	1360140109	/nfs/dbraw/zinc/14/01/09/1360140109.db2.gz	VFLYXWQGDAQSAR-QAPCUYQASA-N	0	3	326.440	3.439	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCCN1C(=O)c1ccccn1	ZINC001089102659	1360167979	/nfs/dbraw/zinc/16/79/79/1360167979.db2.gz	DSGUOEBTAGJMEW-IBGZPJMESA-N	0	3	348.450	3.080	20	30		EGEDHN
C[C@@H]1CN(C(=O)C#CC(C)(C)C)CC[C@H]1CNC/C(Cl)=C\Cl	ZINC001184369506	1387441844	/nfs/dbraw/zinc/44/18/44/1387441844.db2.gz	FZFUYLLLCQHPLM-PWCXKOHKSA-N	0	3	345.314	3.429	20	30		EGEDHN
N#CC1(CNC(=O)[C@@H]2CCCN(Cc3ccc(Cl)cc3)C2)CCC1	ZINC001184404575	1387450688	/nfs/dbraw/zinc/45/06/88/1387450688.db2.gz	PTOARUBOIRIILY-MRXNPFEDSA-N	0	3	345.874	3.362	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2cc(F)c(C)cc2F)CC(C)(C)C1	ZINC001089448555	1360437109	/nfs/dbraw/zinc/43/71/09/1360437109.db2.gz	DYBVSBKUMYIJNW-MRXNPFEDSA-N	0	3	348.437	3.056	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)N[C@H]1CCN(CC#Cc2ccccc2)CC(C)(C)C1	ZINC001089462299	1360448055	/nfs/dbraw/zinc/44/80/55/1360448055.db2.gz	RKRGJYHBZPHPSC-YZGWKJHDSA-N	0	3	338.495	3.301	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N[C@@H]1CCN(Cc2ccc(C#N)s2)CC(C)(C)C1	ZINC001089466538	1360451158	/nfs/dbraw/zinc/45/11/58/1360451158.db2.gz	KFTIGDGRABDRRZ-VBQJREDUSA-N	0	3	345.512	3.383	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccc(F)c2F)CC(C)(C)C1	ZINC001089478858	1360461369	/nfs/dbraw/zinc/46/13/69/1360461369.db2.gz	WCNPXDGFFAFHLN-CQSZACIVSA-N	0	3	334.410	3.209	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CCN(C[C@@H](F)CC)CC(C)(C)C2)c1	ZINC001089487158	1360467822	/nfs/dbraw/zinc/46/78/22/1360467822.db2.gz	IOGKIVWOSWYYCH-ROUUACIJSA-N	0	3	345.462	3.031	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc(F)ccc2Cl)CC(C)(C)C1	ZINC001089500815	1360475085	/nfs/dbraw/zinc/47/50/85/1360475085.db2.gz	WVXWOXPYGVVBHY-CQSZACIVSA-N	0	3	336.838	3.333	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc3sccc3[nH]2)CC(C)(C)C1	ZINC001089535979	1360495329	/nfs/dbraw/zinc/49/53/29/1360495329.db2.gz	ZHOMFZKTGQUEHJ-ZDUSSCGKSA-N	0	3	329.469	3.083	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ncoc2C(C)(C)C)CC(C)(C)C1	ZINC001089538856	1360496859	/nfs/dbraw/zinc/49/68/59/1360496859.db2.gz	XZXAFAXCSIDZFQ-HNNXBMFYSA-N	0	3	345.487	3.216	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2sccc2OC)CC(C)(C)C1	ZINC001089539570	1360497446	/nfs/dbraw/zinc/49/74/46/1360497446.db2.gz	MPMVMAMPLJOWKX-AWEZNQCLSA-N	0	3	334.485	3.000	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cnc(C3CC3)s2)CC(C)(C)C1	ZINC001089539265	1360497468	/nfs/dbraw/zinc/49/74/68/1360497468.db2.gz	JTSACVHJRGWLMZ-HNNXBMFYSA-N	0	3	345.512	3.264	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@@H](C)c2ccc(C)cc2)CC(C)(C)C1	ZINC001089539891	1360497580	/nfs/dbraw/zinc/49/75/80/1360497580.db2.gz	OYHSQYKULQVMNY-PKOBYXMFSA-N	0	3	326.484	3.339	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc3c(C)cccn3c2)CC(C)(C)C1	ZINC001089542530	1360498765	/nfs/dbraw/zinc/49/87/65/1360498765.db2.gz	UTWMIVULEMJJBY-SFHVURJKSA-N	0	3	337.467	3.101	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2sc(C(C)C)nc2C)CC(C)(C)C1	ZINC001089559472	1360507081	/nfs/dbraw/zinc/50/70/81/1360507081.db2.gz	PFHUNQVFRAFOLS-OAHLLOKOSA-N	0	3	347.528	3.429	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cncc3ccccc32)CC(C)(C)C1	ZINC001089561764	1360509110	/nfs/dbraw/zinc/50/91/10/1360509110.db2.gz	TUQVNUIIRXNZKZ-QGZVFWFLSA-N	0	3	335.451	3.088	20	30		EGEDHN
CC(C)=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1c[nH]c(C#N)c1	ZINC001089626306	1360544263	/nfs/dbraw/zinc/54/42/63/1360544263.db2.gz	FPXFEGGWNSQWFY-KRWDZBQOSA-N	0	3	328.460	3.073	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1c(C)oc(C)c1C	ZINC001089668305	1360578120	/nfs/dbraw/zinc/57/81/20/1360578120.db2.gz	UKNNMOJBTMQDQA-QGZVFWFLSA-N	0	3	330.472	3.449	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(C)c(C)n1	ZINC001089671591	1360581679	/nfs/dbraw/zinc/58/16/79/1360581679.db2.gz	UCQQYMVKMDJYOS-QGZVFWFLSA-N	0	3	329.488	3.495	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(OC)cs1	ZINC001089677495	1360585987	/nfs/dbraw/zinc/58/59/87/1360585987.db2.gz	YIRROTVGLZOLPE-AWEZNQCLSA-N	0	3	334.485	3.000	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc2c(c1)C[C@H](C)O2	ZINC001089711728	1360615250	/nfs/dbraw/zinc/61/52/50/1360615250.db2.gz	ZNMZSUKPBUKCPT-MAUKXSAKSA-N	0	3	342.483	3.416	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1cccc2nccnc21	ZINC001089716271	1360617642	/nfs/dbraw/zinc/61/76/42/1360617642.db2.gz	DJMDFKJNLAREMC-HNNXBMFYSA-N	0	3	338.455	3.036	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cnn(C(C)C)c1	ZINC001089725707	1360628655	/nfs/dbraw/zinc/62/86/55/1360628655.db2.gz	KSXSEHRKPMLPHB-QGZVFWFLSA-N	0	3	332.492	3.261	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(C)c(CC)o1	ZINC001089726114	1360629567	/nfs/dbraw/zinc/62/95/67/1360629567.db2.gz	NDLXUWFAYWXUPG-INIZCTEOSA-N	0	3	330.472	3.394	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc2c(c1)N(C)CC2	ZINC001089729520	1360633033	/nfs/dbraw/zinc/63/30/33/1360633033.db2.gz	PZLJTDVKHFTBIH-SFHVURJKSA-N	0	3	341.499	3.085	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cncnc1C(C)C	ZINC001089732479	1360636889	/nfs/dbraw/zinc/63/68/89/1360636889.db2.gz	TZWFVNKEXCQZCA-MRXNPFEDSA-N	0	3	344.503	3.397	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1ccoc1C	ZINC001089771302	1360657684	/nfs/dbraw/zinc/65/76/84/1360657684.db2.gz	YKJVAHSFYSRKLR-LLLHUVSDSA-N	0	3	334.847	3.123	20	30		EGEDHN
C=C(C)CC[N@@H+]1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1ccccc1[O-]	ZINC001089776657	1360659887	/nfs/dbraw/zinc/65/98/87/1360659887.db2.gz	GMSXJQMTUPQIDW-AITUJVMLSA-N	0	3	340.467	3.141	20	30		EGEDHN
C=C(C)CC[N@H+]1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1ccccc1[O-]	ZINC001089776657	1360659891	/nfs/dbraw/zinc/65/98/91/1360659891.db2.gz	GMSXJQMTUPQIDW-AITUJVMLSA-N	0	3	340.467	3.141	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)CCc1ccoc1	ZINC001089790133	1360664436	/nfs/dbraw/zinc/66/44/36/1360664436.db2.gz	QMQYWMYRKAMUAD-MHORFTMASA-N	0	3	348.874	3.134	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1ccc(CC)o1	ZINC001089826674	1360682713	/nfs/dbraw/zinc/68/27/13/1360682713.db2.gz	JUFZTTWATXDKQX-ORQFMDKSSA-N	0	3	348.874	3.377	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)c2cocc2C)C1	ZINC001089846909	1360695362	/nfs/dbraw/zinc/69/53/62/1360695362.db2.gz	NPOLUNBFZHPTSA-JKQORVJESA-N	0	3	334.847	3.123	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1cccn1CC	ZINC001089905039	1360735499	/nfs/dbraw/zinc/73/54/99/1360735499.db2.gz	NGUCBDYKWUYTAN-NXOAAHMSSA-N	0	3	347.890	3.043	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C2CC3(CCC3)C2)CC2(CCOCC2)C1	ZINC001089950915	1360760675	/nfs/dbraw/zinc/76/06/75/1360760675.db2.gz	CYMVHORCUGAOIT-SFHVURJKSA-N	0	3	346.515	3.130	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C3[C@@H]4CCCCCC[C@@H]34)C[C@]2(C)C1	ZINC001092045568	1361281182	/nfs/dbraw/zinc/28/11/82/1361281182.db2.gz	OJVASGWLBUHWLZ-IKVWTGGYSA-N	0	3	328.500	3.006	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C(C)(C)Cc3ccccc3)C[C@]2(C)C1	ZINC001092178049	1361316328	/nfs/dbraw/zinc/31/63/28/1361316328.db2.gz	RHVVAMVVCWOXFQ-KNQAVFIVSA-N	0	3	338.495	3.059	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccccc3CC(C)C)C[C@]2(C)C1	ZINC001092311365	1361362648	/nfs/dbraw/zinc/36/26/48/1361362648.db2.gz	OGYNZBYDZPSIDR-KNQAVFIVSA-N	0	3	338.495	3.302	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@H]2CC=CCC2)CC1	ZINC001093354692	1361568278	/nfs/dbraw/zinc/56/82/78/1361568278.db2.gz	IDCDJEREPVNUKT-OALUTQOASA-N	0	3	326.484	3.069	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)CCC2CCC2)CC1	ZINC001093363075	1361574348	/nfs/dbraw/zinc/57/43/48/1361574348.db2.gz	FHOOXXNYWJOEDX-HXUWFJFHSA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C[C@H](C)C2CC2)CC1	ZINC001093383025	1361594859	/nfs/dbraw/zinc/59/48/59/1361594859.db2.gz	HMQDEWYXCWNLOX-OXJNMPFZSA-N	0	3	328.500	3.149	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1sc(Cl)nc1C)C2	ZINC001095473819	1362153354	/nfs/dbraw/zinc/15/33/54/1362153354.db2.gz	RJBIEKYVWVPLHX-AGIUHOORSA-N	0	3	339.892	3.406	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cncc3sccc31)C2	ZINC001095912167	1362285111	/nfs/dbraw/zinc/28/51/11/1362285111.db2.gz	KWKHQHJICIZHIM-KCXAZCMYSA-N	0	3	327.453	3.208	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(F)c3ccccc13)C2	ZINC001096048335	1362351183	/nfs/dbraw/zinc/35/11/83/1362351183.db2.gz	NGHCFNNUFJJPHT-UAOJZALGSA-N	0	3	336.410	3.337	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1csc(C(C)(C)C)n1)C2	ZINC001096169935	1362412614	/nfs/dbraw/zinc/41/26/14/1362412614.db2.gz	RQSSLUTXDSJMLP-IPYPFGDCSA-N	0	3	333.501	3.352	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@@H]1CCC3(CCC3)CO1)C2	ZINC001096400049	1362489560	/nfs/dbraw/zinc/48/95/60/1362489560.db2.gz	VIJROPMFRPBXMU-OWSLCNJRSA-N	0	3	332.488	3.023	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(C(F)(F)F)cc1)C2	ZINC001096409861	1362494745	/nfs/dbraw/zinc/49/47/45/1362494745.db2.gz	BSXMBXFNVYWHNF-PMPSAXMXSA-N	0	3	336.357	3.064	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](CNCc2ncc(C)s2)[C@@H](C)C1	ZINC001184970169	1387576420	/nfs/dbraw/zinc/57/64/20/1387576420.db2.gz	UEQSEWIVPXBFAS-RDJZCZTQSA-N	0	3	347.528	3.219	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1c(CC)oc3ccccc31)C2	ZINC001096618828	1362599585	/nfs/dbraw/zinc/59/95/85/1362599585.db2.gz	TXOKGEMLBPOZRI-PVAVHDDUSA-N	0	3	336.435	3.354	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H]1CCCCc3ccccc31)C2	ZINC001096621917	1362601807	/nfs/dbraw/zinc/60/18/07/1362601807.db2.gz	GXKLHOPTSGJPOF-PBASOCQRSA-N	0	3	336.479	3.241	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(CN(CC)CC)o1)C2	ZINC001096642777	1362613471	/nfs/dbraw/zinc/61/34/71/1362613471.db2.gz	BANLKPCSLGADSZ-NJAFHUGGSA-N	0	3	345.487	3.033	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc3nccc(C)c3c1)C2	ZINC001097135423	1362859774	/nfs/dbraw/zinc/85/97/74/1362859774.db2.gz	XIJKDORQBJDZNA-AHRSYUTCSA-N	0	3	335.451	3.454	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cccc(OCCC)c1)C2	ZINC001097174095	1362874040	/nfs/dbraw/zinc/87/40/40/1362874040.db2.gz	OOCSDOSBOWSEIY-QRQLOZEOSA-N	0	3	328.456	3.387	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001185061773	1387605249	/nfs/dbraw/zinc/60/52/49/1387605249.db2.gz	PMKVGAJYCIQIBG-IEBWSBKVSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@@H](NCc2cc(C)ccc2OC)C1	ZINC001185064738	1387607560	/nfs/dbraw/zinc/60/75/60/1387607560.db2.gz	WYJLOZCDXUHULR-FUHWJXTLSA-N	0	3	330.472	3.296	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1csc(-c3ccco3)n1)C2	ZINC001097735346	1363110726	/nfs/dbraw/zinc/11/07/26/1363110726.db2.gz	BDXKKPTZDKJAFO-NFAWXSAZSA-N	0	3	343.452	3.314	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](CNCc3ocnc3C)[C@H](C)C2)CCC1	ZINC001185095616	1387617755	/nfs/dbraw/zinc/61/77/55/1387617755.db2.gz	QZASOGZGSCRFES-WBVHZDCISA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1c(F)cccc1Cl)C2	ZINC001098271658	1363281626	/nfs/dbraw/zinc/28/16/26/1363281626.db2.gz	GDJCXISIYJBMKT-JLZZUVOBSA-N	0	3	336.838	3.319	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1csc(CC(C)C)n1)C2	ZINC001098488744	1363341393	/nfs/dbraw/zinc/34/13/93/1363341393.db2.gz	LYASFJDABWZVLI-FMKPAKJESA-N	0	3	333.501	3.253	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)C[C@H](NC(=O)C(C)(C)F)c1ccccc1O2	ZINC001098541242	1363362800	/nfs/dbraw/zinc/36/28/00/1363362800.db2.gz	JJSVNDHANPXAFM-OXJNMPFZSA-N	0	3	346.446	3.395	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)C[C@H](NC(=O)C1CCC1)c1ccccc1O2	ZINC001098541668	1363363434	/nfs/dbraw/zinc/36/34/34/1363363434.db2.gz	QDFPGHAMYRLQSV-RXVVDRJESA-N	0	3	340.467	3.447	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)CC1=CCCCC1)C[C@H](C)O2	ZINC001098578286	1363386369	/nfs/dbraw/zinc/38/63/69/1363386369.db2.gz	PXMCWCFQSJTCTJ-KRWDZBQOSA-N	0	3	332.488	3.145	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccc(C)c(F)c1)C[C@@H](C)O2	ZINC001098615843	1363400070	/nfs/dbraw/zinc/40/00/70/1363400070.db2.gz	CMTBHGZYZFXKDI-MRXNPFEDSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=CCC[C@H](C)NCc1cn([C@@H]2CCN(C(=O)CCCCC)C2)nn1	ZINC001098615017	1363400122	/nfs/dbraw/zinc/40/01/22/1363400122.db2.gz	GZRQEFZYWOAMJO-FUHWJXTLSA-N	0	3	347.507	3.076	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccc(C=C)cc1)C[C@@H](C)O2	ZINC001098635667	1363409161	/nfs/dbraw/zinc/40/91/61/1363409161.db2.gz	PDFNEDJAJKTVMW-QGZVFWFLSA-N	0	3	340.467	3.211	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccc(Cl)cc1)C[C@H](C)O2	ZINC001098655516	1363421169	/nfs/dbraw/zinc/42/11/69/1363421169.db2.gz	LJCKCGKRXUNJQS-HNNXBMFYSA-N	0	3	348.874	3.222	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1cc(C)c(C)s1)C[C@H](C)O2	ZINC001098660694	1363423877	/nfs/dbraw/zinc/42/38/77/1363423877.db2.gz	WNTJVNOCWQGCAK-HNNXBMFYSA-N	0	3	348.512	3.246	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1CCCC(C)(C)C1)C[C@H](C)O2	ZINC001098664751	1363426295	/nfs/dbraw/zinc/42/62/95/1363426295.db2.gz	WAAQOXPTRBTMTK-ROUUACIJSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2coc3c2cccc3OC)C1	ZINC001098840125	1363488958	/nfs/dbraw/zinc/48/89/58/1363488958.db2.gz	FTNBINNUDLGNFI-XOBRGWDASA-N	0	3	340.423	3.212	20	30		EGEDHN
C[C@H](C#N)C(=O)NC[C@H]1CCC(C)(C)CN1CCc1ccccc1F	ZINC001098981891	1363555466	/nfs/dbraw/zinc/55/54/66/1363555466.db2.gz	GTJPLOVTKWXDHP-NVXWUHKLSA-N	0	3	345.462	3.135	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)C2[C@H]3CCCCCC[C@H]23)C1	ZINC001099048951	1363594182	/nfs/dbraw/zinc/59/41/82/1363594182.db2.gz	KLZGZWFBUGGCGK-NTLWEQJWSA-N	0	3	328.500	3.197	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2cnc(C(C)C)nc2C)C1	ZINC001099066291	1363605105	/nfs/dbraw/zinc/60/51/05/1363605105.db2.gz	KHWSSOZQQZEGBG-JXFKEZNVSA-N	0	3	342.487	3.069	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2oc(C(C)C)nc2C)C1	ZINC001099069852	1363606706	/nfs/dbraw/zinc/60/67/06/1363606706.db2.gz	YVIONDWPUJTXKA-KXBFYZLASA-N	0	3	331.460	3.267	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)C1(COC)CCCCC1	ZINC001099102294	1363623145	/nfs/dbraw/zinc/62/31/45/1363623145.db2.gz	LHDDHVKUJRORTQ-QGZVFWFLSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)C[C@@H]1C[C@H]1C1CC1	ZINC001099148487	1363656263	/nfs/dbraw/zinc/65/62/63/1363656263.db2.gz	DQZJATSCRHDPDT-FHWLQOOXSA-N	0	3	348.531	3.232	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)C/C=C(\C)C=C	ZINC001099182549	1363678361	/nfs/dbraw/zinc/67/83/61/1363678361.db2.gz	MDRSFGJLYARXPT-ZUPDTJCQSA-N	0	3	334.504	3.318	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@]1(C)C=CCC1	ZINC001099183275	1363678944	/nfs/dbraw/zinc/67/89/44/1363678944.db2.gz	TVBVLKJINHPRRJ-XLIONFOSSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(C)co1	ZINC001099183220	1363679113	/nfs/dbraw/zinc/67/91/13/1363679113.db2.gz	RYWGCLQRASGHNV-MRXNPFEDSA-N	0	3	334.460	3.011	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(C)co1	ZINC001099183218	1363679265	/nfs/dbraw/zinc/67/92/65/1363679265.db2.gz	RYWGCLQRASGHNV-INIZCTEOSA-N	0	3	334.460	3.011	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2cccc(C)c2F)C[C@H]1C(F)(F)F	ZINC001099257221	1363716961	/nfs/dbraw/zinc/71/69/61/1363716961.db2.gz	WEBMRQLJEMFWHT-ZIAGYGMSSA-N	0	3	344.352	3.303	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H](C)Cc1c(C)noc1C	ZINC001099258647	1363719350	/nfs/dbraw/zinc/71/93/50/1363719350.db2.gz	SHSSHWRVHMDYOU-RHSMWYFYSA-N	0	3	347.503	3.263	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)C(C)(C)C2CCCC2)C[C@H]1C(F)(F)F	ZINC001099264339	1363722106	/nfs/dbraw/zinc/72/21/06/1363722106.db2.gz	IEZQEJYEHMLEMM-ZIAGYGMSSA-N	0	3	332.410	3.368	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2cccc3cccnc32)C[C@H]1C(F)(F)F	ZINC001099275256	1363727224	/nfs/dbraw/zinc/72/72/24/1363727224.db2.gz	CJSLMNFOGMOSBS-HUUCEWRRSA-N	0	3	349.356	3.013	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2ccc(CC)s2)C[C@H]1C(F)(F)F	ZINC001099276061	1363727250	/nfs/dbraw/zinc/72/72/50/1363727250.db2.gz	SIHQVVKUMUXSBP-VXGBXAGGSA-N	0	3	332.391	3.089	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2ccc(C)cc2F)C[C@H]1C(F)(F)F	ZINC001099312159	1363744664	/nfs/dbraw/zinc/74/46/64/1363744664.db2.gz	JTZXQLLCBHXZMA-UKRRQHHQSA-N	0	3	344.352	3.303	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)COc1ccc(C)c(C)c1	ZINC001099340618	1363760978	/nfs/dbraw/zinc/76/09/78/1363760978.db2.gz	WLKRFUSNDQXBDC-SFHVURJKSA-N	0	3	344.499	3.475	20	30		EGEDHN
N#Cc1ccccc1CNC[C@]12CCC[C@H]1CN(C(=O)C=C1CCC1)C2	ZINC001099410748	1363790524	/nfs/dbraw/zinc/79/05/24/1363790524.db2.gz	KDVYQPCKVIPZCW-UNMCSNQZSA-N	0	3	349.478	3.387	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)CCSCC)C1	ZINC001099424756	1363794520	/nfs/dbraw/zinc/79/45/20/1363794520.db2.gz	LJCYNJSYJMWSTA-VGWMRTNUSA-N	0	3	342.936	3.051	20	30		EGEDHN
CC[C@@H](F)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2ccccc2C#N)C1	ZINC001099478044	1363813189	/nfs/dbraw/zinc/81/31/89/1363813189.db2.gz	OEUHZAZPDQSFKH-NSHGMRRFSA-N	0	3	343.446	3.025	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CC(C)(C)C2CC2)CC2(CCOCC2)C1	ZINC001099579316	1363862182	/nfs/dbraw/zinc/86/21/82/1363862182.db2.gz	OUNJZMGOWIQSFB-SFHVURJKSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)[C@@H](C)CC(C)(C)C)CC2(CCOCC2)C1	ZINC001099592665	1363874787	/nfs/dbraw/zinc/87/47/87/1363874787.db2.gz	HPPVQMGGQTUMKU-DLBZAZTESA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)[C@@H](C)CC(C)C)CC2(CCOCC2)C1	ZINC001099594729	1363876968	/nfs/dbraw/zinc/87/69/68/1363876968.db2.gz	JRMBVZAXWWSPDM-ROUUACIJSA-N	0	3	336.520	3.232	20	30		EGEDHN
O=C(NCC1CC(NCC#Cc2ccccc2)C1)C1CCCCCC1	ZINC001100169275	1364034433	/nfs/dbraw/zinc/03/44/33/1364034433.db2.gz	LRBRJSWLWOJCPS-UHFFFAOYSA-N	0	3	338.495	3.493	20	30		EGEDHN
O=C(CCC1CC1)NCC1CC(NCC#Cc2cccc(Cl)c2)C1	ZINC001100203568	1364043598	/nfs/dbraw/zinc/04/35/98/1364043598.db2.gz	WHBPFDWGKJGTTE-UHFFFAOYSA-N	0	3	344.886	3.366	20	30		EGEDHN
CCC(=CC(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1)CC	ZINC001100242676	1364055292	/nfs/dbraw/zinc/05/52/92/1364055292.db2.gz	FEELUHGSTCFRTP-UHFFFAOYSA-N	0	3	343.446	3.428	20	30		EGEDHN
CC[C@H](C)CC(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1	ZINC001100282409	1364066426	/nfs/dbraw/zinc/06/64/26/1364066426.db2.gz	KTVMTCOSPTVEJV-KTAKPFMOSA-N	0	3	331.435	3.118	20	30		EGEDHN
Cc1cccc(Cl)c1CNC1CC(CNC(=O)C#CC2CC2)C1	ZINC001100314812	1364078005	/nfs/dbraw/zinc/07/80/05/1364078005.db2.gz	FDJSMYVBXYZJOY-UHFFFAOYSA-N	0	3	330.859	3.046	20	30		EGEDHN
C=C(C)CCC(=O)NCC1CC(NCc2cc(F)ccc2OC)C1	ZINC001100374189	1364095721	/nfs/dbraw/zinc/09/57/21/1364095721.db2.gz	VVEYSINSUUXNIV-UHFFFAOYSA-N	0	3	334.435	3.175	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C/C=C\c2cccc(F)c2)C1	ZINC001100417111	1364107848	/nfs/dbraw/zinc/10/78/48/1364107848.db2.gz	DXEYKXCBRVVWAM-HYXAFXHYSA-N	0	3	336.838	3.466	20	30		EGEDHN
C[C@@H](C(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1)C(C)(C)C	ZINC001100448236	1364118577	/nfs/dbraw/zinc/11/85/77/1364118577.db2.gz	MFGFNIPDNBUGBN-KTAKPFMOSA-N	0	3	345.462	3.364	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)Cc2cccc3cccnc32)C1	ZINC001100552957	1364158901	/nfs/dbraw/zinc/15/89/01/1364158901.db2.gz	WWBCIAIIDVNNPL-UHFFFAOYSA-N	0	3	343.858	3.014	20	30		EGEDHN
C#CCCCCCC(=O)NCC1CC(NCc2ccncc2Cl)C1	ZINC001100570274	1364167240	/nfs/dbraw/zinc/16/72/40/1364167240.db2.gz	MAFDNFXGSINYEN-UHFFFAOYSA-N	0	3	347.890	3.303	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCC1CC(NCc2ccncc2Cl)C1	ZINC001100587033	1364176076	/nfs/dbraw/zinc/17/60/76/1364176076.db2.gz	GORPBJDBQPZJJX-HLIUYOAVSA-N	0	3	335.879	3.322	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCC1CC(NCc2cccc(OCC)n2)C1	ZINC001100595350	1364180220	/nfs/dbraw/zinc/18/02/20/1364180220.db2.gz	URDZUSIQASOYEX-KLHKWILBSA-N	0	3	345.487	3.067	20	30		EGEDHN
C=CCC1(C(=O)NCC2CC(N[C@H](C)c3cnc(C)cn3)C2)CCC1	ZINC001100645554	1364202735	/nfs/dbraw/zinc/20/27/35/1364202735.db2.gz	IOCOTXBGXJJKPM-KLAILNCOSA-N	0	3	342.487	3.077	20	30		EGEDHN
C=CCC1(C(=O)NCC2CC(NCc3cccc(Cl)n3)C2)CCC1	ZINC001100648705	1364204656	/nfs/dbraw/zinc/20/46/56/1364204656.db2.gz	SSDZAGCYNDOFMD-UHFFFAOYSA-N	0	3	347.890	3.466	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC1CC(NCc2cccc(Cl)n2)C1	ZINC001100711352	1364230830	/nfs/dbraw/zinc/23/08/30/1364230830.db2.gz	LBZGJSVPDBMMQN-UHFFFAOYSA-N	0	3	335.879	3.322	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)CCn2ccc3ccccc32)C1	ZINC001100964533	1364349202	/nfs/dbraw/zinc/34/92/02/1364349202.db2.gz	HZMVXOADABWIHF-UHFFFAOYSA-N	0	3	345.874	3.268	20	30		EGEDHN
C#CCC1(C(=O)NCC2CC(NCc3ccns3)C2)CCCCC1	ZINC001101055215	1364394179	/nfs/dbraw/zinc/39/41/79/1364394179.db2.gz	NVKGCHFXZJILJQ-UHFFFAOYSA-N	0	3	345.512	3.101	20	30		EGEDHN
C=C(C)CN1CC[C@H](Oc2ccnc(CNC(=O)/C(C)=C/CC)c2)C1	ZINC001101092113	1364408966	/nfs/dbraw/zinc/40/89/66/1364408966.db2.gz	MGHMCNLAIWQVTO-HIZIYNLSSA-N	0	3	343.471	3.083	20	30		EGEDHN
C=C(C)CN1CC[C@H](Oc2ccnc(CNC(=O)CCCCC)c2)C1	ZINC001101091321	1364409354	/nfs/dbraw/zinc/40/93/54/1364409354.db2.gz	ZWRDXJLVLCPMHR-IBGZPJMESA-N	0	3	345.487	3.307	20	30		EGEDHN
N#Cc1cccnc1NCCNCc1cscc1C(F)(F)F	ZINC001324571312	1387680386	/nfs/dbraw/zinc/68/03/86/1387680386.db2.gz	KERKZAVYXWDFQZ-UHFFFAOYSA-N	0	3	326.347	3.235	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)[C@H](CCC=C)c3ccccc3)C[C@]2(C)C1	ZINC001101494077	1364581304	/nfs/dbraw/zinc/58/13/04/1364581304.db2.gz	ZWWPPYWOHTVEML-SJBKTWHCSA-N	0	3	336.479	3.150	20	30		EGEDHN
CC(C)CCC(=O)NC[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1C	ZINC001101709914	1364698746	/nfs/dbraw/zinc/69/87/46/1364698746.db2.gz	OWZDIVJRNJQLRU-CRAIPNDOSA-N	0	3	345.462	3.318	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CNC(=O)C[C@H]1C=CCC1	ZINC001101713402	1364699910	/nfs/dbraw/zinc/69/99/10/1364699910.db2.gz	LJVHUDHAOSZVPD-OWCLPIDISA-N	0	3	343.496	3.160	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H]1CN(Cc2ccccc2F)C[C@H]1C	ZINC001101892271	1364766005	/nfs/dbraw/zinc/76/60/05/1364766005.db2.gz	PXRHQVQOQYUBRB-SJLPKXTDSA-N	0	3	330.447	3.203	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@@H]1CN(Cc2cnc(C)s2)C[C@H]1C	ZINC001102326128	1365002529	/nfs/dbraw/zinc/00/25/29/1365002529.db2.gz	JPGKJRROWKCIFP-SIIHOXLZSA-N	0	3	335.517	3.238	20	30		EGEDHN
CC[C@H](C)C(=O)NCC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001102678301	1365166702	/nfs/dbraw/zinc/16/67/02/1365166702.db2.gz	RPKNHDGHOGXDQG-RRFJBIMHSA-N	0	3	333.501	3.240	20	30		EGEDHN
C#CCN(CC1CC1)C(=O)N[C@H](CN1CCCCC1)c1ccccc1	ZINC001324665179	1387723556	/nfs/dbraw/zinc/72/35/56/1387723556.db2.gz	YUIVIJILPSXJAL-HXUWFJFHSA-N	0	3	339.483	3.268	20	30		EGEDHN
C/C=C(\C)C(=O)NCC[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1C	ZINC001102841973	1365247113	/nfs/dbraw/zinc/24/71/13/1365247113.db2.gz	OXDSFLNCMULYHQ-UPJFGJQXSA-N	0	3	343.446	3.238	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)C[C@@H]2CC(C)(C)CO2)C1	ZINC001103222459	1365442974	/nfs/dbraw/zinc/44/29/74/1365442974.db2.gz	NWLIATTUWABXQY-FVQBIDKESA-N	0	3	342.911	3.018	20	30		EGEDHN
C=CC(C)(C)C(=O)NCC[C@@H]1CN(Cc2cncc(F)c2)C[C@H]1C	ZINC001103311812	1365487575	/nfs/dbraw/zinc/48/75/75/1365487575.db2.gz	MLBIJSQCMZZZDS-GDBMZVCRSA-N	0	3	333.451	3.007	20	30		EGEDHN
CCC1(C(=O)NCC[C@@H]2CN(Cc3ccccc3C#N)C[C@H]2C)CC1	ZINC001103406697	1365541276	/nfs/dbraw/zinc/54/12/76/1365541276.db2.gz	SFGOIJJWPHENFV-SJLPKXTDSA-N	0	3	339.483	3.323	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccccc2)C[C@H]1CCNCc1ccccc1C#N	ZINC001103833340	1365805216	/nfs/dbraw/zinc/80/52/16/1365805216.db2.gz	XUHRFUJFIGNBPW-DYESRHJHSA-N	0	3	347.462	3.446	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2nc(C)cs2)C1	ZINC001104092277	1365908564	/nfs/dbraw/zinc/90/85/64/1365908564.db2.gz	ODPRRJPRRXHAPV-NVXWUHKLSA-N	0	3	347.528	3.219	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2(C)CC2)C[C@H]1CCNCc1cc(C#N)ccc1F	ZINC001104221392	1365956817	/nfs/dbraw/zinc/95/68/17/1365956817.db2.gz	ILJDUQNLXVBTPN-GDBMZVCRSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)[C@H](CCNCc2ncc(C)s2)C1	ZINC001104245627	1365966736	/nfs/dbraw/zinc/96/67/36/1365966736.db2.gz	SSLMVTDVAQKHDL-GDBMZVCRSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@H](CCNCc2ccn(CC)n2)C1	ZINC001104485884	1366045781	/nfs/dbraw/zinc/04/57/81/1366045781.db2.gz	RTGCTZJUTLCXSC-IAGOWNOFSA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)C2CCC(OC)CC2)C[C@H]1C	ZINC001104601199	1366096475	/nfs/dbraw/zinc/09/64/75/1366096475.db2.gz	BSYOKLMUDFUYNZ-CRYBEJKASA-N	0	3	342.911	3.018	20	30		EGEDHN
C=CCCC1(C(=O)N2C[C@@H](C)[C@H](CCNCc3cc(C)no3)C2)CC1	ZINC001104631548	1366110614	/nfs/dbraw/zinc/11/06/14/1366110614.db2.gz	RKCQBGNAADEANP-NVXWUHKLSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)CC(F)(F)C(F)F)C[C@H]1C	ZINC001104681300	1366129502	/nfs/dbraw/zinc/12/95/02/1366129502.db2.gz	IENBCLPEJJNGJC-MWLCHTKSSA-N	0	3	344.780	3.104	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)C[C@@H](C)n2cccc2)C[C@H]1C	ZINC001104926834	1366226985	/nfs/dbraw/zinc/22/69/85/1366226985.db2.gz	GDRMMCAMZGXIKB-DJIMGWMZSA-N	0	3	337.895	3.266	20	30		EGEDHN
CC/C=C(/C)C(=O)N1CC(n2cc(CNCCCCCCC)nn2)C1	ZINC001105183154	1366360663	/nfs/dbraw/zinc/36/06/63/1366360663.db2.gz	DUOSPCBRSLSSBL-YBEGLDIGSA-N	0	3	347.507	3.078	20	30		EGEDHN
C=CCCCC(=O)N1CC(n2cc(CNCCCCCCC)nn2)C1	ZINC001105317365	1366420126	/nfs/dbraw/zinc/42/01/26/1366420126.db2.gz	VITNUKJZVLMPGF-UHFFFAOYSA-N	0	3	347.507	3.078	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C[C@H](C)C(C)C)CC1	ZINC001105388927	1366435864	/nfs/dbraw/zinc/43/58/64/1366435864.db2.gz	FIPNEKHFFHQHIR-PXNSSMCTSA-N	0	3	330.516	3.395	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC([C@@H]2N(C/C=C/Cl)CC23CCC3)CC1	ZINC001105392244	1366440524	/nfs/dbraw/zinc/44/05/24/1366440524.db2.gz	WJYUGRDZYNRHAL-RRPUDGLYSA-N	0	3	348.918	3.491	20	30		EGEDHN
C[C@@H]1CN(C(=O)C#CC(C)(C)C)C[C@H]1CNC/C(Cl)=C\Cl	ZINC001106109020	1366611971	/nfs/dbraw/zinc/61/19/71/1366611971.db2.gz	AOBSRHHVMBSQID-CWFACMBSSA-N	0	3	331.287	3.039	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCC(C)(F)F)C[C@H]1CNCc1ccccc1C#N	ZINC001106334642	1366659427	/nfs/dbraw/zinc/65/94/27/1366659427.db2.gz	CTBMIFDDWRXYAW-RHSMWYFYSA-N	0	3	349.425	3.178	20	30		EGEDHN
C[C@]1(CNC(=O)CCC2CC2)CCCN(Cc2cccc(C#N)c2)C1	ZINC001324921216	1387825369	/nfs/dbraw/zinc/82/53/69/1387825369.db2.gz	LVOGWFCJLJHIDB-OAQYLSRUSA-N	0	3	339.483	3.467	20	30		EGEDHN
CC(C)C(=O)NC[C@]12CCC[C@H]1N(Cc1ccc(C#N)s1)CC2	ZINC001107283991	1366915659	/nfs/dbraw/zinc/91/56/59/1366915659.db2.gz	QCSWQOKAGBIPKN-SJLPKXTDSA-N	0	3	331.485	3.137	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](N(C)Cc2cccc(OC(C)C)c2)C1	ZINC001189280760	1366976313	/nfs/dbraw/zinc/97/63/13/1366976313.db2.gz	WQYOKWALAQPBRL-GOSISDBHSA-N	0	3	330.472	3.473	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cnc([C@@H](C)OC)s1)C2	ZINC001109289195	1367040684	/nfs/dbraw/zinc/04/06/84/1367040684.db2.gz	GFONSBILFDNDID-KBXIAJHMSA-N	0	3	349.500	3.152	20	30		EGEDHN
C=CCOCCCC(=O)N1CC[C@@H](N(C)[C@H](C)c2cccc(F)c2)C1	ZINC001189539259	1367048998	/nfs/dbraw/zinc/04/89/98/1367048998.db2.gz	YSRCLCPZVJTKPY-VQIMIIECSA-N	0	3	348.462	3.402	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@H](N(C)[C@@H](C)c2ccc(F)c(F)c2)C1	ZINC001190004163	1367149804	/nfs/dbraw/zinc/14/98/04/1367149804.db2.gz	NLUJMTJFWWJEOZ-HOCLYGCPSA-N	0	3	334.410	3.218	20	30		EGEDHN
COc1ccc(CN(C)[C@H]2CCN(C(=O)C#CC(C)(C)C)C2)cc1C	ZINC001190085422	1367169722	/nfs/dbraw/zinc/16/97/22/1367169722.db2.gz	YASVQNSUCCKIFO-SFHVURJKSA-N	0	3	342.483	3.086	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2oc(C)cc2C)C1	ZINC001107853161	1367176018	/nfs/dbraw/zinc/17/60/18/1367176018.db2.gz	MTQNCLQKDGKPPE-DNVCBOLYSA-N	0	3	334.460	3.072	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCc1ccc3[nH]ccc3c1)C2	ZINC001109527792	1367178783	/nfs/dbraw/zinc/17/87/83/1367178783.db2.gz	LMPAAHQQELMVOA-HOJAQTOUSA-N	0	3	337.467	3.398	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCc1ccc(Cl)cc1)C2	ZINC001109570983	1367205553	/nfs/dbraw/zinc/20/55/53/1367205553.db2.gz	GTQAHMOADIEKIU-SQNIBIBYSA-N	0	3	330.859	3.017	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](N(C)CCOCc2ccccc2)C1	ZINC001190397840	1367253108	/nfs/dbraw/zinc/25/31/08/1367253108.db2.gz	PHOSWFTVDAQJGZ-LJQANCHMSA-N	0	3	344.499	3.338	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)[C@H](C)CCCc3ccccc3)[C@@H]2C1	ZINC001190400688	1367254780	/nfs/dbraw/zinc/25/47/80/1367254780.db2.gz	FLCFQTDMPPJNQI-YZGWKJHDSA-N	0	3	326.484	3.364	20	30		EGEDHN
C=CCC[C@@H](C)N1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1nc(Cl)cs1)C2	ZINC001109640387	1367258531	/nfs/dbraw/zinc/25/85/31/1367258531.db2.gz	DSHGPNCGVCLXAP-NDBYEHHHSA-N	0	3	339.892	3.486	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@H](C)CCOc3ccccc3)[C@@H]2C1	ZINC001190541496	1367288700	/nfs/dbraw/zinc/28/87/00/1367288700.db2.gz	AGCRVTXYBNIWAH-WSTZPKSXSA-N	0	3	342.483	3.200	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@]1(C)CN(CC2CCC3(CC3)CC2)CCO1	ZINC001108122353	1367292475	/nfs/dbraw/zinc/29/24/75/1367292475.db2.gz	RJTKGGVZLZMZLP-HXUWFJFHSA-N	0	3	348.531	3.376	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCN(C(=O)C(C)(C)CC(F)F)C1	ZINC001190603950	1367305358	/nfs/dbraw/zinc/30/53/58/1367305358.db2.gz	LOTLLGGTUJWYNM-INIZCTEOSA-N	0	3	349.425	3.272	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)CC2CC(C)(C)C2)C1	ZINC001108156757	1367315451	/nfs/dbraw/zinc/31/54/51/1367315451.db2.gz	JIQGPQNSUHXYGO-JXFKEZNVSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)Cc2cccc(C)c2)C1	ZINC001108176704	1367325158	/nfs/dbraw/zinc/32/51/58/1367325158.db2.gz	CVFPRMRJITWVMW-WIYYLYMNSA-N	0	3	344.499	3.099	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@]2(C)CN(CC3CCCC3)CCO2)CCC1	ZINC001108188783	1367332674	/nfs/dbraw/zinc/33/26/74/1367332674.db2.gz	YRFVBILHSZWPQV-IBGZPJMESA-N	0	3	334.504	3.130	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)C1(c2ccc3ncccc3c2)CC1	ZINC001186098314	1387870302	/nfs/dbraw/zinc/87/03/02/1387870302.db2.gz	URPXHPIIBZIENP-SFHVURJKSA-N	0	3	335.451	3.033	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2cccn2C(C)C)C1	ZINC001108400560	1367434288	/nfs/dbraw/zinc/43/42/88/1367434288.db2.gz	JHCRQPGFDDLMSR-PXNSSMCTSA-N	0	3	347.503	3.244	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2ccc(CF)cc2)C1	ZINC001108429003	1367453181	/nfs/dbraw/zinc/45/31/81/1367453181.db2.gz	DURMYMNQFWBQTN-UZLBHIALSA-N	0	3	348.462	3.332	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2c(C)cccc2F)C1	ZINC001108440798	1367458490	/nfs/dbraw/zinc/45/84/90/1367458490.db2.gz	FHPIPJUFDWYJDY-OXJNMPFZSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=CCC1(C(=O)NC[C@]2(C)CN(C[C@@H](C)CC)CCO2)CCCC1	ZINC001108444063	1367459510	/nfs/dbraw/zinc/45/95/10/1367459510.db2.gz	AEZHYIDSXNNVNW-PKOBYXMFSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)COC[C@H](C)c1ccccc1)C2	ZINC001110047170	1367481781	/nfs/dbraw/zinc/48/17/81/1367481781.db2.gz	QJXCSTQVYMOUNP-RNQOJCNYSA-N	0	3	342.483	3.104	20	30		EGEDHN
CCCCCCCC[C@@H](C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCCO	ZINC001110131173	1367515341	/nfs/dbraw/zinc/51/53/41/1367515341.db2.gz	VTTVEBXJBBZGNI-YRXWBPOGSA-N	0	3	338.536	3.477	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](CCC=C)c1ccccc1)C2	ZINC001110214311	1367568708	/nfs/dbraw/zinc/56/87/08/1367568708.db2.gz	DEDBPQNORNJTTK-ANULTFPQSA-N	0	3	336.479	3.481	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](N(C)CCOc2ccccc2C)C1	ZINC001191868414	1367621951	/nfs/dbraw/zinc/62/19/51/1367621951.db2.gz	SXPYFRXCYJJLAQ-IBGZPJMESA-N	0	3	342.483	3.100	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](N(C)CCOCc2ccccc2)C1	ZINC001191902876	1367631579	/nfs/dbraw/zinc/63/15/79/1367631579.db2.gz	STAHLCGGAZQGQW-ICSRJNTNSA-N	0	3	344.499	3.338	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H](N(C)CCOCc2ccccc2)C1	ZINC001191902878	1367631646	/nfs/dbraw/zinc/63/16/46/1367631646.db2.gz	STAHLCGGAZQGQW-QUCCMNQESA-N	0	3	344.499	3.338	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](N(C)CCOc2ccccc2)C1	ZINC001191911452	1367635007	/nfs/dbraw/zinc/63/50/07/1367635007.db2.gz	GDQZONZGQPXAAB-ROUUACIJSA-N	0	3	330.472	3.200	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@@H](N(C)CCOc2cccc(F)c2)C1	ZINC001191911542	1367635256	/nfs/dbraw/zinc/63/52/56/1367635256.db2.gz	HFTWJFSAWLKPFD-SJLPKXTDSA-N	0	3	348.462	3.340	20	30		EGEDHN
CC[C@H](c1ccccc1)N1[C@@H]2CC[C@H]1[C@@H](NC(=O)CSCC#N)C2	ZINC001108951666	1367680429	/nfs/dbraw/zinc/68/04/29/1367680429.db2.gz	DBPQFIRNMBMQRM-XDNAFOTISA-N	0	3	343.496	3.116	20	30		EGEDHN
C[C@@H](C#N)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCCc1ccc(Cl)cc1	ZINC001110401548	1367692945	/nfs/dbraw/zinc/69/29/45/1367692945.db2.gz	HTHLTRHYMKGHLG-LIRZEXBASA-N	0	3	345.874	3.154	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](N(C)CCOc2ccccc2)C1	ZINC001192162133	1367705547	/nfs/dbraw/zinc/70/55/47/1367705547.db2.gz	MXKUAVAOYJOPAY-YLJYHZDGSA-N	0	3	330.472	3.200	20	30		EGEDHN
C=CCOCCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccccc1C	ZINC001109120215	1367779951	/nfs/dbraw/zinc/77/99/51/1367779951.db2.gz	ILGSBMHOPULIEC-AABGKKOBSA-N	0	3	342.483	3.199	20	30		EGEDHN
CC(C)c1ccccc1CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C#CC1CC1)C2	ZINC001110540349	1367820126	/nfs/dbraw/zinc/82/01/26/1367820126.db2.gz	NXZSWYJLSXVAPQ-NRSPTQNISA-N	0	3	336.479	3.445	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](N(C)CCOc2ccccc2F)C1	ZINC001192577960	1367823121	/nfs/dbraw/zinc/82/31/21/1367823121.db2.gz	KKLHTHJTJWXLOZ-INIZCTEOSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](N(C)CCOc2ccc(F)cc2)C1	ZINC001192577156	1367823438	/nfs/dbraw/zinc/82/34/38/1367823438.db2.gz	CQXKVKIMLKTRCI-KRWDZBQOSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCCOC(C)C	ZINC001110595254	1367855091	/nfs/dbraw/zinc/85/50/91/1367855091.db2.gz	HULZIVMSRFPRET-QRVBRYPASA-N	0	3	334.504	3.291	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccccc1N(C)C	ZINC001110607430	1367869596	/nfs/dbraw/zinc/86/95/96/1367869596.db2.gz	UTUKTCPNOYTKFO-GGPKGHCWSA-N	0	3	341.499	3.330	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@H](C)c1c(C)noc1C)C2	ZINC001110736937	1367954381	/nfs/dbraw/zinc/95/43/81/1367954381.db2.gz	SZESIJUGNVGAOT-DXEWXGHRSA-N	0	3	331.460	3.083	20	30		EGEDHN
C=CCCCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1coc(OCC)n1)C2	ZINC001110770493	1367970574	/nfs/dbraw/zinc/97/05/74/1367970574.db2.gz	KXDRDPCAUYCRKH-INMHGKMJSA-N	0	3	347.459	3.155	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCN(C(=O)CCC2(C)CC2)C1	ZINC001193228160	1367971345	/nfs/dbraw/zinc/97/13/45/1367971345.db2.gz	MGSSZWBVYKFTBR-GOSISDBHSA-N	0	3	325.456	3.171	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CN([C@H](C)c2cc(C)ccc2C)C[C@H]1O	ZINC001193345596	1368004011	/nfs/dbraw/zinc/00/40/11/1368004011.db2.gz	RHNWKONJHPELQC-BHIYHBOVSA-N	0	3	344.499	3.128	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3C[C@@H]2CC(C)(C)CO2)CC1	ZINC001110988139	1368135701	/nfs/dbraw/zinc/13/57/01/1368135701.db2.gz	QZXSNLJWPGJZJY-XDNAFOTISA-N	0	3	346.515	3.269	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)[C@H](CCC)c2ccccc2)C1	ZINC001193877898	1368137574	/nfs/dbraw/zinc/13/75/74/1368137574.db2.gz	JSNVXRDIRFGQQP-WOJBJXKFSA-N	0	3	344.499	3.306	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3CC/C=C\CCC)c1	ZINC001111002055	1368140209	/nfs/dbraw/zinc/14/02/09/1368140209.db2.gz	SXQHJKUFOWFDHV-VJQBDMSCSA-N	0	3	337.467	3.144	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3C[C@@H](C)OC)CCCCC1	ZINC001111441212	1368308227	/nfs/dbraw/zinc/30/82/27/1368308227.db2.gz	BGEJJSVZPAPVLB-TVFCKZIOSA-N	0	3	334.504	3.269	20	30		EGEDHN
CCCCCCCCOC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC001194740966	1368314624	/nfs/dbraw/zinc/31/46/24/1368314624.db2.gz	WRDJQDGMQFMKSC-UHFFFAOYSA-N	0	3	339.524	3.195	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3C[C@H](CC)OC)CCCCC1	ZINC001111483450	1368317985	/nfs/dbraw/zinc/31/79/85/1368317985.db2.gz	FGPZGUIXPKEUGB-HCXYKTFWSA-N	0	3	346.515	3.107	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)C[C@H](NC(=O)CSC)c1ccccc1O2	ZINC001111529907	1368329472	/nfs/dbraw/zinc/32/94/72/1368329472.db2.gz	RMRRCZCNTAYVOP-QFBILLFUSA-N	0	3	346.496	3.010	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@](C)(F)CCCC)C[C@@H](C)O2	ZINC001111546122	1368339181	/nfs/dbraw/zinc/33/91/81/1368339181.db2.gz	XWWKZHDHLBGSII-SJLPKXTDSA-N	0	3	340.483	3.173	20	30		EGEDHN
O=C(Oc1ccccc1C(F)(F)F)N1CCC2SC(=O)C=C2C1	ZINC001195177262	1368394095	/nfs/dbraw/zinc/39/40/95/1368394095.db2.gz	YZPNUDFLWZQLEL-LBPRGKRZSA-N	0	3	343.326	3.478	20	30		EGEDHN
C=CCCC(=O)N[C@]12CCC[C@H]1CN(Cc1cc(C)ccc1OC)C2	ZINC001111648511	1368410856	/nfs/dbraw/zinc/41/08/56/1368410856.db2.gz	BOYFVLZHDKZDLG-RXVVDRJESA-N	0	3	342.483	3.441	20	30		EGEDHN
C=CCOCCCC(=O)N1CCCN([C@H]2CCc3ccccc32)CC1	ZINC001195434842	1368436054	/nfs/dbraw/zinc/43/60/54/1368436054.db2.gz	SLDJAMCBFKVGKU-FQEVSTJZSA-N	0	3	342.483	3.191	20	30		EGEDHN
C#CCCCC(=O)N1CCCN(CC[C@H]2CCCC2(F)F)CC1	ZINC001195674991	1368470174	/nfs/dbraw/zinc/47/01/74/1368470174.db2.gz	OPFFWWQCCDRGLM-MRXNPFEDSA-N	0	3	326.431	3.150	20	30		EGEDHN
CC(C)C#CC(=O)N1CCCN(CCCc2ccc(Cl)cc2)CC1	ZINC001195754448	1368482471	/nfs/dbraw/zinc/48/24/71/1368482471.db2.gz	NUGAGRIOFGDAPR-UHFFFAOYSA-N	0	3	346.902	3.466	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)C[C@H](C)c2ccccc2C)C1	ZINC001111892076	1368536849	/nfs/dbraw/zinc/53/68/49/1368536849.db2.gz	MPLJHOLLPBXPFT-IPJJNNNSSA-N	0	3	338.495	3.483	20	30		EGEDHN
C=C(C)CCC(=O)N1CCCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC001196018483	1368537273	/nfs/dbraw/zinc/53/72/73/1368537273.db2.gz	WEESOXPURNUDQN-QUCCMNQESA-N	0	3	344.499	3.042	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H](C)Cc2ccc(C)cc2)C1	ZINC001112013753	1368618305	/nfs/dbraw/zinc/61/83/05/1368618305.db2.gz	FAFLFHJMPXQNAQ-LMNJBCLMSA-N	0	3	326.484	3.330	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2ncc3ccccn32)CC1	ZINC001196492589	1368627078	/nfs/dbraw/zinc/62/70/78/1368627078.db2.gz	GUPCBZDMMODELT-UHFFFAOYSA-N	0	3	340.471	3.229	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@H](C)CC2CCCC2)C1	ZINC001196591459	1368644638	/nfs/dbraw/zinc/64/46/38/1368644638.db2.gz	YGBCYJKOPMHYLU-BHIYHBOVSA-N	0	3	338.536	3.335	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](C(F)(F)F)[C@H](NCC2=CCCCC2)C1	ZINC001112093543	1368654190	/nfs/dbraw/zinc/65/41/90/1368654190.db2.gz	BCGAISXHPDDJQY-HZPDHXFCSA-N	0	3	342.405	3.269	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)N1CCCN(CCCOc2ccccc2)CC1	ZINC001196829676	1368693047	/nfs/dbraw/zinc/69/30/47/1368693047.db2.gz	HIRIQBXBEXQJSG-MOPGFXCFSA-N	0	3	344.499	3.448	20	30		EGEDHN
CC#CCCCC(=O)N1CCCN(CCc2ccc(C)cc2)CC1	ZINC001196846537	1368697270	/nfs/dbraw/zinc/69/72/70/1368697270.db2.gz	GFBKJDJJNIJYHE-UHFFFAOYSA-N	0	3	326.484	3.265	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)C[C@H](C)CC(C)C)C[C@H]1C(F)(F)F	ZINC001112192376	1368707253	/nfs/dbraw/zinc/70/72/53/1368707253.db2.gz	WWBJMERIUPNICF-RBSFLKMASA-N	0	3	332.410	3.061	20	30		EGEDHN
C=C(C)CC[NH2+]C[C@]12CCC[C@H]1CN(C(=O)c1ccccc1[O-])C2	ZINC001112259298	1368736587	/nfs/dbraw/zinc/73/65/87/1368736587.db2.gz	CZFCQYLBFOQBLE-JXFKEZNVSA-N	0	3	328.456	3.190	20	30		EGEDHN
C=CCCC1(C(=O)N2CCCN(C[C@H](O)C3CCCCC3)CC2)CC1	ZINC001197061740	1368737439	/nfs/dbraw/zinc/73/74/39/1368737439.db2.gz	GPCAYQACBHMPLR-IBGZPJMESA-N	0	3	348.531	3.208	20	30		EGEDHN
CC[C@H](C)CCC(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001186536678	1387965293	/nfs/dbraw/zinc/96/52/93/1387965293.db2.gz	DTHLSJZEKJPQGM-WMLDXEAASA-N	0	3	331.435	3.214	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2cc(C)no2)C1	ZINC001112513356	1368908143	/nfs/dbraw/zinc/90/81/43/1368908143.db2.gz	VCILUGYIHUXADY-KNBMTAEXSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H]2CCC[C@]2(CNCc2ocnc2C)C1	ZINC001112521214	1368912523	/nfs/dbraw/zinc/91/25/23/1368912523.db2.gz	SHIBAZMYMMXPRC-LPHOPBHVSA-N	0	3	331.460	3.058	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@H]2CC[C@H](CC)CC2)C1	ZINC001197960855	1368933381	/nfs/dbraw/zinc/93/33/81/1368933381.db2.gz	NEWKYQVBYKLVIK-NCXUSEDFSA-N	0	3	336.520	3.111	20	30		EGEDHN
C=CC[C@@H](C(=O)N1CCCN(C[C@@H](CC)OC)CC1)c1ccccc1	ZINC001198197490	1368978491	/nfs/dbraw/zinc/97/84/91/1368978491.db2.gz	OPUIJDJIKAOUMD-WOJBJXKFSA-N	0	3	344.499	3.306	20	30		EGEDHN
C#CCCN1CCCN(C(=O)CCCc2cc(C)ccc2C)CC1	ZINC001198204500	1368980751	/nfs/dbraw/zinc/98/07/51/1368980751.db2.gz	IACOBFHYXLGSOP-UHFFFAOYSA-N	0	3	326.484	3.184	20	30		EGEDHN
C=CCCC(=O)N1CCN(CC2CCC(C(F)(F)F)CC2)CC1	ZINC001112687589	1368981714	/nfs/dbraw/zinc/98/17/14/1368981714.db2.gz	IIPYWMLZLZAPOZ-UHFFFAOYSA-N	0	3	332.410	3.466	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N1CCCN([C@@H]2CCCc3ccccc32)CC1	ZINC001198345064	1369012873	/nfs/dbraw/zinc/01/28/73/1369012873.db2.gz	ZOFASQJWOYXYIK-FXAWDEMLSA-N	0	3	342.483	3.189	20	30		EGEDHN
C#CC[C@H](CC(=O)N1CCCN(CC[C@H](C)F)CC1)c1ccccc1	ZINC001198394412	1369021983	/nfs/dbraw/zinc/02/19/83/1369021983.db2.gz	IWKWUXDTZKEYJL-AZUAARDMSA-N	0	3	344.474	3.466	20	30		EGEDHN
C=CCC1(C(=O)N2CCCN(C[C@H](OC)C3CCC3)CC2)CCCC1	ZINC001198422615	1369028469	/nfs/dbraw/zinc/02/84/69/1369028469.db2.gz	DWUFZZRSBROCSB-IBGZPJMESA-N	0	3	348.531	3.472	20	30		EGEDHN
CCCCCCCN[C@H](CNC(=O)COC)c1ccccc1OC	ZINC001198443122	1369033577	/nfs/dbraw/zinc/03/35/77/1369033577.db2.gz	HJXLGSFCIZDZFA-QGZVFWFLSA-N	0	3	336.476	3.059	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)c1occc1C)c1ccccc1OC	ZINC001198530343	1369054530	/nfs/dbraw/zinc/05/45/30/1369054530.db2.gz	QIYWYLWXMRQBEM-INIZCTEOSA-N	0	3	328.412	3.233	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)CCOCC(C)C)c1ccccc1OC	ZINC001198569019	1369063004	/nfs/dbraw/zinc/06/30/04/1369063004.db2.gz	YGNDQNRCANHRCQ-GOSISDBHSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CCC[C@H](C)N[C@@H](CNC(=O)COCCC)c1ccccc1OC	ZINC001198584655	1369066864	/nfs/dbraw/zinc/06/68/64/1369066864.db2.gz	LRUHKGBVYFJKSU-WMZOPIPTSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCC[C@@H](C)N[C@H](CNC(=O)COCCC)c1ccccc1OC	ZINC001198584654	1369066880	/nfs/dbraw/zinc/06/68/80/1369066880.db2.gz	LRUHKGBVYFJKSU-SJLPKXTDSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)c1cnc(C)s1)c1ccccc1OC	ZINC001198596302	1369068525	/nfs/dbraw/zinc/06/85/25/1369068525.db2.gz	PUENLAVPVZMLRD-OAHLLOKOSA-N	0	3	345.468	3.097	20	30		EGEDHN
C=CCC[C@@H](C)N[C@H](CNC(=O)c1cocn1)c1ccccc1OC	ZINC001198605053	1369070657	/nfs/dbraw/zinc/07/06/57/1369070657.db2.gz	DMTLSLGKXZFFMS-GDBMZVCRSA-N	0	3	343.427	3.099	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)C1CC(C)C1)c1ccccc1OC	ZINC001198656718	1369084066	/nfs/dbraw/zinc/08/40/66/1369084066.db2.gz	OJPWCJZGPHYAQG-HTWSVDAQSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CCN(CC2CCCCCC2)CC1)OCC	ZINC001112906462	1369084645	/nfs/dbraw/zinc/08/46/45/1369084645.db2.gz	DJCKPWVVRKMKEJ-LJQANCHMSA-N	0	3	336.520	3.472	20	30		EGEDHN
COc1ccccc1[C@H](CNC(=O)C#CC(C)(C)C)NCC1CCC1	ZINC001198723084	1369099917	/nfs/dbraw/zinc/09/99/17/1369099917.db2.gz	BZTLXYIORNRKMD-SFHVURJKSA-N	0	3	342.483	3.292	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@H](NCC1CC1)c1ccccc1OC	ZINC001198743436	1369103934	/nfs/dbraw/zinc/10/39/34/1369103934.db2.gz	ZGYPNKCYPCTPKJ-KRWDZBQOSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)[C@@H]2CCN(C)c3ccccc32)CC1	ZINC001112977233	1369120644	/nfs/dbraw/zinc/12/06/44/1369120644.db2.gz	SEXJAURQSYKCRN-PKOBYXMFSA-N	0	3	341.499	3.109	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)[C@H]2CCN(C)c3ccccc32)CC1	ZINC001112977230	1369120823	/nfs/dbraw/zinc/12/08/23/1369120823.db2.gz	SEXJAURQSYKCRN-HKUYNNGSSA-N	0	3	341.499	3.109	20	30		EGEDHN
C=CCC[C@@H](C)N[C@@H](CNC(=O)c1cnco1)c1ccccc1OC	ZINC001198819528	1369121812	/nfs/dbraw/zinc/12/18/12/1369121812.db2.gz	UJWYQWNOXHUOGR-ZBFHGGJFSA-N	0	3	343.427	3.099	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H](NC(C)C)c2ccccc2OC)cc1	ZINC001198825524	1369123035	/nfs/dbraw/zinc/12/30/35/1369123035.db2.gz	CNLZIPIYEAHAGK-IBGZPJMESA-N	0	3	336.435	3.146	20	30		EGEDHN
CC#CCCCC(=O)NC[C@H](NCC(C)C)c1ccccc1OC	ZINC001198855521	1369131061	/nfs/dbraw/zinc/13/10/61/1369131061.db2.gz	CTWATRZXPDBEPH-SFHVURJKSA-N	0	3	330.472	3.292	20	30		EGEDHN
C#CCC1(C(=O)N2CCC([C@H]3CCCN(CCF)CC3)CC2)CCC1	ZINC001186598200	1387981937	/nfs/dbraw/zinc/98/19/37/1387981937.db2.gz	REWJRWVITSMUSW-SFHVURJKSA-N	0	3	348.506	3.490	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)c1cccnc1C)c1ccccc1OC	ZINC001198875781	1369136039	/nfs/dbraw/zinc/13/60/39/1369136039.db2.gz	JBJXBAFRDHZIKO-SFHVURJKSA-N	0	3	339.439	3.035	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)C2(CC=C)CCCCC2)C1	ZINC001198944669	1369154507	/nfs/dbraw/zinc/15/45/07/1369154507.db2.gz	LEHRPGPVSQDEAU-RTBURBONSA-N	0	3	348.531	3.421	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)CCCOc2ccc(F)cc2)CC1	ZINC001113179776	1369248701	/nfs/dbraw/zinc/24/87/01/1369248701.db2.gz	NHLVYIKRHSCIQC-QGZVFWFLSA-N	0	3	348.462	3.484	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)C[C@@H]2CCOc3ccccc32)CC1	ZINC001113184664	1369250690	/nfs/dbraw/zinc/25/06/90/1369250690.db2.gz	RSPFDTJOHYUVQI-MSOLQXFVSA-N	0	3	342.483	3.442	20	30		EGEDHN
CC(C)[C@H](C)CC(=O)N1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001199733730	1369263767	/nfs/dbraw/zinc/26/37/67/1369263767.db2.gz	UOSZNIRGNVIUOZ-OAHLLOKOSA-N	0	3	345.462	3.460	20	30		EGEDHN
CCCCCCCCCCNC(=S)N1CCO[C@H](CN(C)C)C1	ZINC001200208727	1369329152	/nfs/dbraw/zinc/32/91/52/1369329152.db2.gz	OQKSPFQVJPVVJN-QGZVFWFLSA-N	0	3	343.581	3.264	20	30		EGEDHN
COc1cccc(Cl)c1CNC1CCN(C(=O)C#CC(C)C)CC1	ZINC001200448300	1369370930	/nfs/dbraw/zinc/37/09/30/1369370930.db2.gz	AGYWUWPUNVDARG-UHFFFAOYSA-N	0	3	348.874	3.089	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCCO[C@H](CNCc2cccc(F)c2)C1	ZINC001200605176	1369399160	/nfs/dbraw/zinc/39/91/60/1369399160.db2.gz	DNEZBRSGBDREGW-GOSISDBHSA-N	0	3	348.462	3.135	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC(NCC(=C)Br)CC1	ZINC001200737963	1369421123	/nfs/dbraw/zinc/42/11/23/1369421123.db2.gz	FGMSBYGNMSBAOW-UHFFFAOYSA-N	0	3	341.293	3.244	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCCO[C@@H](CNCc2ccsc2)C1	ZINC001201232397	1369501065	/nfs/dbraw/zinc/50/10/65/1369501065.db2.gz	FYUXSYWYDIDADP-RDJZCZTQSA-N	0	3	336.501	3.058	20	30		EGEDHN
CC#CCNC[C@H]1CN(C(=O)[C@@H](CCC)CC2CCCC2)CCCO1	ZINC001201546704	1369572102	/nfs/dbraw/zinc/57/21/02/1369572102.db2.gz	MHUFCCMQKGHUAN-PMACEKPBSA-N	0	3	348.531	3.213	20	30		EGEDHN
CCCCCCCCCC(=O)N1CCCO[C@@H](CNCCF)C1	ZINC001201936772	1369646899	/nfs/dbraw/zinc/64/68/99/1369646899.db2.gz	KOLHWLRVEUJRGT-KRWDZBQOSA-N	0	3	330.488	3.304	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)N1CCC(NCc2oc(CC)nc2C)CC1	ZINC001202085397	1369684057	/nfs/dbraw/zinc/68/40/57/1369684057.db2.gz	TYOZMBOBIQJXIG-KGLIPLIRSA-N	0	3	333.476	3.084	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC(NCc2nc(C)c(C)s2)CC1	ZINC001202108087	1369688524	/nfs/dbraw/zinc/68/85/24/1369688524.db2.gz	GOGNBIKILPXIPU-CYBMUJFWSA-N	0	3	335.517	3.443	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C(F)(F)F)cc3)C[C@H]21	ZINC001114025304	1369690226	/nfs/dbraw/zinc/69/02/26/1369690226.db2.gz	KEEOVZXPECEJLI-QLPKVWCKSA-N	0	3	338.373	3.218	20	30		EGEDHN
C=CCC1(C(=O)N2CCCO[C@@H](CNC/C=C/Cl)C2)CCCC1	ZINC001202250855	1369722987	/nfs/dbraw/zinc/72/29/87/1369722987.db2.gz	MFTCVVMUQJNVMN-YKXBDCQTSA-N	0	3	340.895	3.083	20	30		EGEDHN
COC(=O)CCCN1CCC(Oc2ccc(C#N)c(Cl)c2)CC1	ZINC001202253376	1369723711	/nfs/dbraw/zinc/72/37/11/1369723711.db2.gz	RVDQSUVJTJZEPW-UHFFFAOYSA-N	0	3	336.819	3.008	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC(NCc3ccccc3C#N)CC2)CC1	ZINC001202365324	1369751720	/nfs/dbraw/zinc/75/17/20/1369751720.db2.gz	MWBBBOMQJRIXBX-UHFFFAOYSA-N	0	3	337.467	3.385	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(NCc3oc(CC)nc3C)CC2)CCC1	ZINC001202373008	1369753570	/nfs/dbraw/zinc/75/35/70/1369753570.db2.gz	ZWGKJOOQILFNQO-UHFFFAOYSA-N	0	3	345.487	3.372	20	30		EGEDHN
CC(C)=CC(=O)N[C@H]1C[C@@H](NCC#Cc2ccc(F)cc2)C12CCC2	ZINC001202408308	1369764379	/nfs/dbraw/zinc/76/43/79/1369764379.db2.gz	SRHUYVVYLZLIKN-MOPGFXCFSA-N	0	3	340.442	3.160	20	30		EGEDHN
O=C(CCC1CC1)N[C@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202652406	1369838108	/nfs/dbraw/zinc/83/81/08/1369838108.db2.gz	CBSHQNHYNJRWGH-PMACEKPBSA-N	0	3	336.479	3.245	20	30		EGEDHN
Cc1ccccc1CN1CC[C@H](NC(=O)Nc2cccc(C#N)c2)C1	ZINC001202799209	1369896990	/nfs/dbraw/zinc/89/69/90/1369896990.db2.gz	JOSVYERWIQYQDU-IBGZPJMESA-N	0	3	334.423	3.263	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1C[C@@H](NCc2ccc(F)cc2F)C12CCC2	ZINC001202867764	1369912194	/nfs/dbraw/zinc/91/21/94/1369912194.db2.gz	UJKPXJKJCQEAJJ-QZTJIDSGSA-N	0	3	346.421	3.141	20	30		EGEDHN
Cc1ccc(F)c(CN[C@H]2C[C@@H](NC(=O)C#CC(C)C)C23CCC3)c1	ZINC001202877583	1369914897	/nfs/dbraw/zinc/91/48/97/1369914897.db2.gz	OKAUOCUDUZGYMM-RBUKOAKNSA-N	0	3	342.458	3.311	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1C[C@H](NCc2ncccc2C)C12CCC2	ZINC001202985265	1369946228	/nfs/dbraw/zinc/94/62/28/1369946228.db2.gz	CDBAWQZFTJSOOU-ZWKOTPCHSA-N	0	3	327.472	3.263	20	30		EGEDHN
CCCC[C@](C)(F)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001114493409	1369974398	/nfs/dbraw/zinc/97/43/98/1369974398.db2.gz	HJEZCKBOHJOEMH-XFKSJGNHSA-N	0	3	343.446	3.023	20	30		EGEDHN
CCC[C@@H](CC)C(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001203099548	1369982625	/nfs/dbraw/zinc/98/26/25/1369982625.db2.gz	LOMFCBDTNSBVHP-MRXNPFEDSA-N	0	3	327.472	3.465	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)COC2CCCCC2)C12CCC2	ZINC001203122916	1369990176	/nfs/dbraw/zinc/99/01/76/1369990176.db2.gz	LVQGJUBPINBQQJ-JKSUJKDBSA-N	0	3	340.895	3.105	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1[C@H]2CN(Cc3cccc(OCCC)c3)C[C@H]21	ZINC001114686918	1370024824	/nfs/dbraw/zinc/02/48/24/1370024824.db2.gz	UNCKQXAJIHBDGL-BWTSREIZSA-N	0	3	342.483	3.234	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C)c(OC)c3)C[C@H]21	ZINC001114729506	1370051389	/nfs/dbraw/zinc/05/13/89/1370051389.db2.gz	SQIVLWJEOCJHFH-OCQZMCQHSA-N	0	3	342.483	3.152	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1C[C@@H](NCc2ncccc2C)C12CCC2	ZINC001203273519	1370054210	/nfs/dbraw/zinc/05/42/10/1370054210.db2.gz	IWJNUXKIHCYAEP-SJORKVTESA-N	0	3	327.472	3.119	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1C[C@H](NCc2cccc(Cl)n2)C12CCC2	ZINC001203273977	1370055057	/nfs/dbraw/zinc/05/50/57/1370055057.db2.gz	LRCBUEMLEKJCMJ-GJZGRUSLSA-N	0	3	347.890	3.464	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1[C@H]2CN(CCOC3CCCCCC3)C[C@H]21	ZINC001114794370	1370084870	/nfs/dbraw/zinc/08/48/70/1370084870.db2.gz	HHNPAVNZTWQIPT-PXCRPINLSA-N	0	3	348.531	3.375	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1C[C@@H](NCc2conc2CC)C12CCC2	ZINC001203341625	1370089820	/nfs/dbraw/zinc/08/98/20/1370089820.db2.gz	RZQAIMAZXYJESG-SJORKVTESA-N	0	3	331.460	3.110	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2[C@H]3CN(CCCCC(F)(F)F)C[C@H]32)C1	ZINC001114812631	1370093757	/nfs/dbraw/zinc/09/37/57/1370093757.db2.gz	LSBVVIYKNABACR-WDNDVIMCSA-N	0	3	330.394	3.122	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@H](NC(=O)C2(CC)CC2)C12CCC2	ZINC001203359472	1370097448	/nfs/dbraw/zinc/09/74/48/1370097448.db2.gz	SPKVBFCIFUEOSQ-OLZOCXBDSA-N	0	3	341.293	3.102	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1C[C@@H](NCc2ccc(F)cn2)C12CCC2	ZINC001203454322	1370132590	/nfs/dbraw/zinc/13/25/90/1370132590.db2.gz	YOQBSQVBWDSGFI-IAGOWNOFSA-N	0	3	345.462	3.340	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(F)cc3C)C[C@H]21	ZINC001114898899	1370137615	/nfs/dbraw/zinc/13/76/15/1370137615.db2.gz	IPJTVPRCNDJPQB-PIIMJCKOSA-N	0	3	330.447	3.283	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)CCCc2ccccn2)C12CCC2	ZINC001203640235	1370196688	/nfs/dbraw/zinc/19/66/88/1370196688.db2.gz	ALENZHYAXIMEHL-IRXDYDNUSA-N	0	3	347.890	3.174	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)COCCCCCC)C12CCC2	ZINC001203659608	1370205710	/nfs/dbraw/zinc/20/57/10/1370205710.db2.gz	JWEKGZDKOINKBC-HZPDHXFCSA-N	0	3	342.911	3.353	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@]3(CC(=O)N(c4cccc(F)c4)C3)C2)c1	ZINC001203760580	1370252624	/nfs/dbraw/zinc/25/26/24/1370252624.db2.gz	MGJJEDFEDVSUGA-NRFANRHFSA-N	0	3	349.409	3.326	20	30		EGEDHN
Cc1cccc(N2C[C@@]3(CCN(Cc4cccc(C#N)c4)C3)CC2=O)c1	ZINC001203761937	1370253642	/nfs/dbraw/zinc/25/36/42/1370253642.db2.gz	IMWATZKXBXICCI-QFIPXVFZSA-N	0	3	345.446	3.496	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3O[C@@H](COc4cccnc4)CC[C@H]32)cc1	ZINC001203902295	1370306947	/nfs/dbraw/zinc/30/69/47/1370306947.db2.gz	ZFUUUUQWQCNADC-NJDAHSKKSA-N	0	3	349.434	3.154	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@]3(CC(=O)N(c4ccsc4)C3)C2)cc1	ZINC001203901882	1370307148	/nfs/dbraw/zinc/30/71/48/1370307148.db2.gz	SZVWIURCDGOTJO-LJQANCHMSA-N	0	3	337.448	3.249	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CCCN3C(=O)c3ccco3)CC2)cc1	ZINC001203903545	1370308049	/nfs/dbraw/zinc/30/80/49/1370308049.db2.gz	WVJQUMSXCKMNCG-UHFFFAOYSA-N	0	3	349.434	3.422	20	30		EGEDHN
N#Cc1cccc(N2C[C@]3(CCN(Cc4ccc(F)cc4)C3)CC2=O)c1	ZINC001203914875	1370313023	/nfs/dbraw/zinc/31/30/23/1370313023.db2.gz	TWNQKNPOMNLZCQ-OAQYLSRUSA-N	0	3	349.409	3.326	20	30		EGEDHN
CC(C)c1cccc(CNC2(CNC(=O)[C@H](C)C#N)CCCCC2)n1	ZINC001115452292	1370460465	/nfs/dbraw/zinc/46/04/65/1370460465.db2.gz	WHDYIUIWQMYVLE-MRXNPFEDSA-N	0	3	342.487	3.273	20	30		EGEDHN
C#CCCCC(=O)NCC1(NCc2c(C)noc2C)CCCCC1	ZINC001115506670	1370506167	/nfs/dbraw/zinc/50/61/67/1370506167.db2.gz	LVOSHCVKARDTCW-UHFFFAOYSA-N	0	3	331.460	3.004	20	30		EGEDHN
C#CCOc1ccc(Nc2cccc(CN3CCN(C)CC3)c2)cc1	ZINC001204564245	1370517538	/nfs/dbraw/zinc/51/75/38/1370517538.db2.gz	KSSLIAOJDPPRQF-UHFFFAOYSA-N	0	3	335.451	3.190	20	30		EGEDHN
O=C(C#CC1CC1)NCC1(NCc2ccc(F)cc2F)CCCCC1	ZINC001115527552	1370526593	/nfs/dbraw/zinc/52/65/93/1370526593.db2.gz	ZZSQUVQCMRMZKU-UHFFFAOYSA-N	0	3	346.421	3.287	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H]2CN(CCOc3cccc(Cl)c3)C[C@H]21	ZINC001187240702	1388079223	/nfs/dbraw/zinc/07/92/23/1388079223.db2.gz	XKOJSBIWAGKPNU-MAUKXSAKSA-N	0	3	348.874	3.218	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCC1(NCc2cnc(C)nc2)CCCCC1	ZINC001115679464	1370661660	/nfs/dbraw/zinc/66/16/60/1370661660.db2.gz	FMSDBKKMVFCNBI-HZPDHXFCSA-N	0	3	344.503	3.152	20	30		EGEDHN
C=CCOC(=O)N1CC2(C1)CCN(Cc1ccc(F)c(C)c1)CC2	ZINC001205162333	1370667326	/nfs/dbraw/zinc/66/73/26/1370667326.db2.gz	PVOSTNLDBNOUOL-UHFFFAOYSA-N	0	3	332.419	3.355	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C2CCCCC2)C[C@H]1c1cccc(F)c1	ZINC001205350823	1370729198	/nfs/dbraw/zinc/72/91/98/1370729198.db2.gz	UOFMTWAMYYUBBR-VQTJNVASSA-N	0	3	342.458	3.313	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H](CCC)C(C)C)C[C@H]1c1cccc(F)c1	ZINC001205439877	1370755605	/nfs/dbraw/zinc/75/56/05/1370755605.db2.gz	OUYBNKAVFPUPEF-HSALFYBXSA-N	0	3	344.474	3.415	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@H](C)CC(C)C)C[C@H]1c1cccc(F)c1	ZINC001205448906	1370758978	/nfs/dbraw/zinc/75/89/78/1370758978.db2.gz	KYFFDVUVRVTQNB-LSTHTHJFSA-N	0	3	344.474	3.415	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@H](C)CC(C)(C)C)[C@@H]3COC[C@@H]32)CC1	ZINC001205511817	1370776540	/nfs/dbraw/zinc/77/65/40/1370776540.db2.gz	INAXZUXIZFEEKS-FGTMMUONSA-N	0	3	348.531	3.184	20	30		EGEDHN
C=CCOC(=O)N1CC2(C1)CCN(Cc1cc(C)ccc1F)CC2	ZINC001205617484	1370813418	/nfs/dbraw/zinc/81/34/18/1370813418.db2.gz	YSTSVXKRUGAJNR-UHFFFAOYSA-N	0	3	332.419	3.355	20	30		EGEDHN
C[C@H](CC(F)F)C(=O)N1CCC(CNCc2ccccc2C#N)CC1	ZINC001205714755	1370850687	/nfs/dbraw/zinc/85/06/87/1370850687.db2.gz	MISQYZCSPCUBDH-CQSZACIVSA-N	0	3	349.425	3.178	20	30		EGEDHN
Cc1nc(C(=O)N[C@@H](CN2CCCCC2)c2ccccc2)ccc1C#N	ZINC001325968973	1388098711	/nfs/dbraw/zinc/09/87/11/1388098711.db2.gz	QOXQPFWMCZRGPT-FQEVSTJZSA-N	0	3	348.450	3.219	20	30		EGEDHN
C#CCN(CC1CC1)C(=O)NC[C@H](c1ccsc1)N(CC)CC	ZINC001116369930	1370897356	/nfs/dbraw/zinc/89/73/56/1370897356.db2.gz	IBFSMAMAJQBWCP-QGZVFWFLSA-N	0	3	333.501	3.186	20	30		EGEDHN
C=C(CN1CCCC1)c1nc(-c2ccc(Br)c(C)n2)no1	ZINC001206100899	1370960158	/nfs/dbraw/zinc/96/01/58/1370960158.db2.gz	XYCUIMKNXDIPTD-UHFFFAOYSA-N	0	3	349.232	3.312	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2cccc(C(F)F)c2)CC1	ZINC001116705172	1370960425	/nfs/dbraw/zinc/96/04/25/1370960425.db2.gz	YDCWXDIDENRDRH-UHFFFAOYSA-N	0	3	337.414	3.464	20	30		EGEDHN
COc1cc(CNCc2ccc(NC(=O)C3CC3)cc2)ccc1C#N	ZINC001116919521	1371000710	/nfs/dbraw/zinc/00/07/10/1371000710.db2.gz	ANFRVYIFGQHXDL-UHFFFAOYSA-N	0	3	335.407	3.205	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CN(Cc2ccc(OC)c(C)c2)C[C@H]1C	ZINC001206886161	1371207129	/nfs/dbraw/zinc/20/71/29/1371207129.db2.gz	VGHWTLVFCXJYFJ-IEBWSBKVSA-N	0	3	342.483	3.134	20	30		EGEDHN
CCCCCCCCC(=O)N1CCC(CNCc2nccn2C)CC1	ZINC001206891390	1371210413	/nfs/dbraw/zinc/21/04/13/1371210413.db2.gz	MJEZIBAMRCIZSG-UHFFFAOYSA-N	0	3	348.535	3.499	20	30		EGEDHN
Cc1ccsc1C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001207082679	1371288492	/nfs/dbraw/zinc/28/84/92/1371288492.db2.gz	TYQLZONIFAGTBC-SFHVURJKSA-N	0	3	338.476	3.302	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN(CCOc2cccc(CC)c2)C[C@H]1C	ZINC001207190830	1371325223	/nfs/dbraw/zinc/32/52/23/1371325223.db2.gz	WTRMEOIFWNXEAD-YLJYHZDGSA-N	0	3	344.499	3.421	20	30		EGEDHN
C=CCN(CCN1CC[C@@H](c2ccccn2)C1)C(=O)OC(C)(C)C	ZINC001207205764	1371329079	/nfs/dbraw/zinc/32/90/79/1371329079.db2.gz	NQDCSOBYKDEGQY-MRXNPFEDSA-N	0	3	331.460	3.294	20	30		EGEDHN
Cc1cc(C(=O)N2CCC[C@H](NCC#Cc3ccccc3)C2)c(C)o1	ZINC001207252182	1371341678	/nfs/dbraw/zinc/34/16/78/1371341678.db2.gz	YADJTSURHZUJEO-IBGZPJMESA-N	0	3	336.435	3.142	20	30		EGEDHN
CCCCC(=O)N1CCC[C@@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207372202	1371377538	/nfs/dbraw/zinc/37/75/38/1371377538.db2.gz	BWNZTOWHXVDPDI-GOSISDBHSA-N	0	3	332.875	3.462	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CN(CCCc3ccccc3F)C2)CC1	ZINC001207489982	1371411682	/nfs/dbraw/zinc/41/16/82/1371411682.db2.gz	JFQIIJQFFJNFRC-UHFFFAOYSA-N	0	3	346.446	3.479	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cc(CC)on2)CCCCC1	ZINC001120032440	1371462887	/nfs/dbraw/zinc/46/28/87/1371462887.db2.gz	IZCXXMBOUGPWSM-UHFFFAOYSA-N	0	3	325.840	3.012	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccc(OC)cc2)CCCCC1	ZINC001120050783	1371468664	/nfs/dbraw/zinc/46/86/64/1371468664.db2.gz	PRFCHLWWBPVGDU-UHFFFAOYSA-N	0	3	336.863	3.470	20	30		EGEDHN
C=CCOCCCC(=O)N1CCC[C@H](N[C@@H](C)c2ccccc2F)C1	ZINC001207741633	1371491015	/nfs/dbraw/zinc/49/10/15/1371491015.db2.gz	NXTWGXUNRSOGQR-IRXDYDNUSA-N	0	3	348.462	3.450	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H](NCC#Cc2cccc(Cl)c2)C1)C1CC1	ZINC001207754745	1371495207	/nfs/dbraw/zinc/49/52/07/1371495207.db2.gz	QXIATMDCANQXNP-BEFAXECRSA-N	0	3	344.886	3.318	20	30		EGEDHN
Cc1cscc1C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001207754817	1371495272	/nfs/dbraw/zinc/49/52/72/1371495272.db2.gz	RTVKDBUYVAFXSJ-GOSISDBHSA-N	0	3	338.476	3.302	20	30		EGEDHN
CC(C)(C)OC(=O)N1C[C@@H]2[C@@H](CN(CCC#N)C3CCCC3)[C@@H]2C1	ZINC001207776519	1371500290	/nfs/dbraw/zinc/50/02/90/1371500290.db2.gz	PIYUJGMVHCIUMO-OSYLJGHBSA-N	0	3	333.476	3.258	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CCCn2cccc2)CCCCC1	ZINC001120181373	1371500912	/nfs/dbraw/zinc/50/09/12/1371500912.db2.gz	FNNWLTIXTLEXKA-UHFFFAOYSA-N	0	3	337.895	3.430	20	30		EGEDHN
O=C(C=C1CCC1)N1CCC[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207785942	1371503404	/nfs/dbraw/zinc/50/34/04/1371503404.db2.gz	MUMBHVRQIDYMAM-IBGZPJMESA-N	0	3	342.870	3.382	20	30		EGEDHN
O=C(Nc1ccc(F)c(Cl)c1)N1CCC2SC(=O)C=C2C1	ZINC001187680034	1388141720	/nfs/dbraw/zinc/14/17/20/1388141720.db2.gz	ZFNVPAGPPCOOPO-GFCCVEGCSA-N	0	3	326.780	3.285	20	30		EGEDHN
C#CCCCCC(=O)N1CCC[C@@H](NCc2cccc(C(C)C)n2)C1	ZINC001207859576	1371521442	/nfs/dbraw/zinc/52/14/42/1371521442.db2.gz	BGVAWYNQBDNSJU-LJQANCHMSA-N	0	3	341.499	3.479	20	30		EGEDHN
C#CCCCCC(=O)N1CCC[C@@H](NCc2cn(C(C)C)nc2C)C1	ZINC001207863016	1371523804	/nfs/dbraw/zinc/52/38/04/1371523804.db2.gz	DSSAVCGIRJXBQV-LJQANCHMSA-N	0	3	344.503	3.047	20	30		EGEDHN
Cc1sccc1C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001207992596	1371561418	/nfs/dbraw/zinc/56/14/18/1371561418.db2.gz	OFTVWQGXMPHTIV-GOSISDBHSA-N	0	3	338.476	3.302	20	30		EGEDHN
C=CCCOCCCCC(=O)N1CCC[C@H](NC[C@@H](F)CC)C1	ZINC001208032709	1371575154	/nfs/dbraw/zinc/57/51/54/1371575154.db2.gz	XBWVEBQMAIWGJZ-IRXDYDNUSA-N	0	3	328.472	3.078	20	30		EGEDHN
C=CCCOCC(=O)N1CCC[C@@H]([C@H]2CCCN2CC(=C)Cl)C1	ZINC001120467754	1371586751	/nfs/dbraw/zinc/58/67/51/1371586751.db2.gz	BJKUNBBXUWPABF-IAGOWNOFSA-N	0	3	340.895	3.035	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC[C@@H](NCc2cc(C)ccc2OC)C1	ZINC001208260975	1371688746	/nfs/dbraw/zinc/68/87/46/1371688746.db2.gz	IJFHLLSHGPPKHG-GOSISDBHSA-N	0	3	330.472	3.441	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN(Cc2ccc3ncccc3c2)C[C@H]1C	ZINC001208309654	1371711051	/nfs/dbraw/zinc/71/10/51/1371711051.db2.gz	RCAAFAUSBOFCHY-DNVCBOLYSA-N	0	3	337.467	3.384	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN([C@@H]2CCc3c2cccc3F)C[C@H]1C	ZINC001208317902	1371715683	/nfs/dbraw/zinc/71/56/83/1371715683.db2.gz	APVVLGWSMZTFPP-FSPWUOQZSA-N	0	3	330.447	3.462	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CN(Cc2cccc(OC)c2C)C[C@H]1C	ZINC001208374487	1371741248	/nfs/dbraw/zinc/74/12/48/1371741248.db2.gz	KVCJLEPKBQEHLI-VQIMIIECSA-N	0	3	342.483	3.134	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CN(CCOc2ccc(C)cc2)C[C@H]1C	ZINC001208391665	1371749940	/nfs/dbraw/zinc/74/99/40/1371749940.db2.gz	SLIGAJYOPOMKJV-NLWGTHIKSA-N	0	3	344.499	3.413	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CN(CCOc2cccc(C)c2)C[C@H]1C	ZINC001208391406	1371750795	/nfs/dbraw/zinc/75/07/95/1371750795.db2.gz	MKSSLCLIVOMVCR-QWFCFKBJSA-N	0	3	344.499	3.413	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN(C[C@H](OC)c2ccccc2)C[C@H]1C	ZINC001208455647	1371772532	/nfs/dbraw/zinc/77/25/32/1371772532.db2.gz	YOPHOYOFFTYIEP-QRQLOZEOSA-N	0	3	330.472	3.167	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1CN(Cc2cccc(N(C)C)c2)C[C@H]1C	ZINC001208508889	1371792383	/nfs/dbraw/zinc/79/23/83/1371792383.db2.gz	KFDKUBRHZMPRIJ-OZOXKJRCSA-N	0	3	343.515	3.291	20	30		EGEDHN
C#CCCCCC(=O)NC1CC2(CC(NCc3nc(C)cs3)C2)C1	ZINC001120967999	1371824862	/nfs/dbraw/zinc/82/48/62/1371824862.db2.gz	BWUZUZTXXNDGAT-UHFFFAOYSA-N	0	3	345.512	3.162	20	30		EGEDHN
CC/C(C)=C/C(=O)NC1CC2(CC(NCc3ccccc3C#N)C2)C1	ZINC001121071309	1371846938	/nfs/dbraw/zinc/84/69/38/1371846938.db2.gz	BDQCLGNMWFMXGM-OVCLIPMQSA-N	0	3	337.467	3.432	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC1CC2(CC(NCc3ocnc3C)C2)C1	ZINC001121155467	1371870518	/nfs/dbraw/zinc/87/05/18/1371870518.db2.gz	HQFGEEKUGUZQOY-UHFFFAOYSA-N	0	3	343.471	3.268	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)C[C@@H](C)CCC=C(C)C)C1	ZINC001208828612	1371908215	/nfs/dbraw/zinc/90/82/15/1371908215.db2.gz	XGADCKVVUFAWJH-IPMKNSEASA-N	0	3	336.520	3.398	20	30		EGEDHN
N#Cc1cccc(CCCN2CCN3CCc4ccccc4[C@@H]3C2)c1	ZINC001208851430	1371918268	/nfs/dbraw/zinc/91/82/68/1371918268.db2.gz	YQZZARCHBIVTSG-QFIPXVFZSA-N	0	3	331.463	3.406	20	30		EGEDHN
N#Cc1cccc(CCCN2CC3(C2)CN(Cc2ccccc2)C3)c1	ZINC001208853372	1371918316	/nfs/dbraw/zinc/91/83/16/1371918316.db2.gz	JMLIJIGIKRFHTP-UHFFFAOYSA-N	0	3	331.463	3.309	20	30		EGEDHN
CCOc1cccc(N2CCN(CCc3ccc(C#N)cc3)CC2)c1	ZINC001208926903	1371948383	/nfs/dbraw/zinc/94/83/83/1371948383.db2.gz	GORJUMYMHGPMCN-UHFFFAOYSA-N	0	3	335.451	3.322	20	30		EGEDHN
N#Cc1ccc(CCN2CCC(Oc3ccc(Cl)nn3)CC2)cc1	ZINC001208929906	1371949443	/nfs/dbraw/zinc/94/94/43/1371949443.db2.gz	VEJOCRBPSSTWHL-UHFFFAOYSA-N	0	3	342.830	3.088	20	30		EGEDHN
CC1(C(=O)N2CCC[C@H](NCC#Cc3cccc(Cl)c3)C2)CCC1	ZINC001209005320	1371973090	/nfs/dbraw/zinc/97/30/90/1371973090.db2.gz	UZUCADUGBOYXDI-SFHVURJKSA-N	0	3	344.886	3.462	20	30		EGEDHN
CCOC(=O)CCN1CCC(Oc2ccc(C#N)c(Cl)c2)CC1	ZINC001209037659	1371979977	/nfs/dbraw/zinc/97/99/77/1371979977.db2.gz	ZHIZZUMVXZLSLI-UHFFFAOYSA-N	0	3	336.819	3.008	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N(C)Cc1ccccc1F	ZINC001121595409	1372019206	/nfs/dbraw/zinc/01/92/06/1372019206.db2.gz	QXGMPDCDMOCDFK-INIZCTEOSA-N	0	3	343.450	3.049	20	30		EGEDHN
C=CCCCCN1CCO[C@H]2[C@H]1CC[C@H]2COCc1cccnc1	ZINC001209202693	1372035651	/nfs/dbraw/zinc/03/56/51/1372035651.db2.gz	NJEHLYNDPLQRLN-XUVXKRRUSA-N	0	3	330.472	3.434	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)C[C@@H](C)C(F)(F)F)C2	ZINC001121687503	1372046590	/nfs/dbraw/zinc/04/65/90/1372046590.db2.gz	PKBAGFAZDMAJOU-UOIMRUQWSA-N	0	3	338.801	3.344	20	30		EGEDHN
O=C(c1ccoc1C1CC1)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001209269062	1372055915	/nfs/dbraw/zinc/05/59/15/1372055915.db2.gz	DXZADYMJOOOBJJ-LJQANCHMSA-N	0	3	348.446	3.403	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)C2(Cc3ccc(F)cc3)CC2)C1	ZINC001209292439	1372058757	/nfs/dbraw/zinc/05/87/57/1372058757.db2.gz	VJCMPGMLDIKKOD-CRAIPNDOSA-N	0	3	330.447	3.161	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)C2(Cc3ccccc3F)CC2)C1	ZINC001209298709	1372062365	/nfs/dbraw/zinc/06/23/65/1372062365.db2.gz	CCIFSOUJWUBQEX-CRAIPNDOSA-N	0	3	330.447	3.161	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001209335430	1372071438	/nfs/dbraw/zinc/07/14/38/1372071438.db2.gz	LSTBOTLWPFQYMI-KRWDZBQOSA-N	0	3	329.419	3.134	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@H](NCc2cc(C#N)ccc2OC)C1	ZINC001209335972	1372071857	/nfs/dbraw/zinc/07/18/57/1372071857.db2.gz	UHVUMSUSWQEGBB-SFHVURJKSA-N	0	3	341.455	3.004	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001209456360	1372111257	/nfs/dbraw/zinc/11/12/57/1372111257.db2.gz	ZWORHNGVGLYDDH-TZIWHRDSSA-N	0	3	342.458	3.360	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N[C@@H](Cc1ccc(C)cc1)c1ccccn1	ZINC001121923697	1372123524	/nfs/dbraw/zinc/12/35/24/1372123524.db2.gz	RDEPPBIHPWMOMU-QUCCMNQESA-N	0	3	337.467	3.474	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@H](NCc2ccc(Cl)nc2)C1	ZINC001209865135	1372217158	/nfs/dbraw/zinc/21/71/58/1372217158.db2.gz	COKNJZKHMGNFFY-HNNXBMFYSA-N	0	3	335.879	3.418	20	30		EGEDHN
C=CC1(CC(=O)N2CCC[C@@H](NCc3cncn3C)C2)CCCCC1	ZINC001210105917	1372271284	/nfs/dbraw/zinc/27/12/84/1372271284.db2.gz	DKYILYGBPLNVEO-QGZVFWFLSA-N	0	3	344.503	3.027	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)C[C@@H](CC)c2ccccc2)C1	ZINC001210243736	1372303979	/nfs/dbraw/zinc/30/39/79/1372303979.db2.gz	OVEUQAWOQVVAFT-QWFCFKBJSA-N	0	3	344.499	3.209	20	30		EGEDHN
CC(C)C[C@@H](C)C(=O)N1CCC[C@@H](NCc2ccc(C#N)s2)C1	ZINC001210358936	1372331697	/nfs/dbraw/zinc/33/16/97/1372331697.db2.gz	RGBZQHIETKICEK-HUUCEWRRSA-N	0	3	333.501	3.383	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)c2ccc3ccccc3c2)C1	ZINC001210560483	1372379489	/nfs/dbraw/zinc/37/94/89/1372379489.db2.gz	NIZYMLROCDARDF-OXQOHEQNSA-N	0	3	338.451	3.093	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCN(C(=O)[C@H](c2ccccc2)N(C)CC)C1	ZINC001210633573	1372396188	/nfs/dbraw/zinc/39/61/88/1372396188.db2.gz	FWRJIOWTQMPIIH-ROUUACIJSA-N	0	3	349.906	3.013	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)CCCOc2cccc(C)c2)C1	ZINC001210794925	1372427174	/nfs/dbraw/zinc/42/71/74/1372427174.db2.gz	BFVVFCCZYCXTFY-IEBWSBKVSA-N	0	3	330.472	3.167	20	30		EGEDHN
CCn1ccnc1C(C#N)=C([O-])c1cnn(CC)c1-c1ccccc1	ZINC001123336810	1372431037	/nfs/dbraw/zinc/43/10/37/1372431037.db2.gz	LDKPEFHMAINFKF-OAHLLOKOSA-N	0	3	333.395	3.276	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)c1cnn(CC)c1-c1ccccc1	ZINC001123336810	1372431040	/nfs/dbraw/zinc/43/10/40/1372431040.db2.gz	LDKPEFHMAINFKF-OAHLLOKOSA-N	0	3	333.395	3.276	20	30		EGEDHN
C=C(CN1CCCCC1)c1nc(-c2ccc(-n3ccnc3)cc2)no1	ZINC001211436767	1372558671	/nfs/dbraw/zinc/55/86/71/1372558671.db2.gz	WLKAPMHDKSPTJQ-UHFFFAOYSA-N	0	3	335.411	3.421	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1C[C@@H](c2ccccc2)[C@H](NC/C=C\Cl)C1	ZINC001211598912	1372588713	/nfs/dbraw/zinc/58/87/13/1372588713.db2.gz	ODHRXFOIIRDMDF-XTQWYIJYSA-N	0	3	344.886	3.373	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CN([C@@H](C)c2cc(C)ccc2C)C[C@H]1OC	ZINC001212022613	1372648933	/nfs/dbraw/zinc/64/89/33/1372648933.db2.gz	ZICUSMBFIDUGKO-QXAKKESOSA-N	0	3	330.472	3.146	20	30		EGEDHN
CCCCCCCC[C@H](C)C(=O)N1CC[C@@H](NCc2cncn2C)C1	ZINC001188015534	1388214442	/nfs/dbraw/zinc/21/44/42/1388214442.db2.gz	GTYRLAQOJZQJQW-ZWKOTPCHSA-N	0	3	348.535	3.497	20	30		EGEDHN
C=C[C@H](CC(=O)N1CC[C@@H](NCc2cccnc2C)C1)c1ccccc1	ZINC001188040532	1388224876	/nfs/dbraw/zinc/22/48/76/1388224876.db2.gz	QXDPLSAOAVVPOC-WIYYLYMNSA-N	0	3	349.478	3.440	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)C[C@@H]2C[C@H]2C2CC2)[C@H](OC)C1	ZINC001213190202	1372856508	/nfs/dbraw/zinc/85/65/08/1372856508.db2.gz	PWJRHZVGWSWHRS-INDMIFKZSA-N	0	3	336.520	3.208	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@]23C[C@H]2CCCC3)[C@H](OC)C1	ZINC001213418931	1372903929	/nfs/dbraw/zinc/90/39/29/1372903929.db2.gz	AKOXBFOORAAWJU-SOAMZJECSA-N	0	3	336.520	3.353	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@H](C)c2ccco2)[C@H](OC)C1	ZINC001213432123	1372905651	/nfs/dbraw/zinc/90/56/51/1372905651.db2.gz	CQIJJTAIYDZPAU-JFIYKMOQSA-N	0	3	336.476	3.169	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2cc(C)[nH]c2C)[C@H](OC)C1	ZINC001213491839	1372912960	/nfs/dbraw/zinc/91/29/60/1372912960.db2.gz	VLMRGGFDXKXNBZ-QZTJIDSGSA-N	0	3	335.492	3.031	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@@H](F)c2ccccc2)[C@H](OC)C1	ZINC001213491379	1372913129	/nfs/dbraw/zinc/91/31/29/1372913129.db2.gz	NCWLLLYVDHBLGD-QRVBRYPASA-N	0	3	348.462	3.259	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@H]2CC23CCCC3)[C@H](OC)C1	ZINC001213673571	1372943713	/nfs/dbraw/zinc/94/37/13/1372943713.db2.gz	IHFCZNGAEPJIEH-KZNAEPCWSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2ccc3ccccc3c2)[C@H](OC)C1	ZINC001213770775	1372959382	/nfs/dbraw/zinc/95/93/82/1372959382.db2.gz	HVKZGVNKEMVHIL-WOJBJXKFSA-N	0	3	338.451	3.235	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2cc(C)n(C(C)C)c2C)[C@H](OC)C1	ZINC001213828606	1372968115	/nfs/dbraw/zinc/96/81/15/1372968115.db2.gz	BOJVVGQKLCVNSO-RTBURBONSA-N	0	3	347.503	3.081	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)CCCn2cccc2)[C@H](OC)C1	ZINC001213909887	1372979557	/nfs/dbraw/zinc/97/95/57/1372979557.db2.gz	JVGZIPKJMKYPIV-RTBURBONSA-N	0	3	349.519	3.054	20	30		EGEDHN
CCC[C@H](C)CC(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2)C1	ZINC001214297649	1373039952	/nfs/dbraw/zinc/03/99/52/1373039952.db2.gz	ZWPPRFPSFMRQCP-NLWGTHIKSA-N	0	3	326.484	3.301	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001214364703	1373050192	/nfs/dbraw/zinc/05/01/92/1373050192.db2.gz	ZTAFSUXBZWXJSI-GPMSIDNRSA-N	0	3	330.447	3.050	20	30		EGEDHN
C[C@@H]1CN(C(=O)/C=C/C2CC2)C[C@H]1NCC#Cc1ccccc1Cl	ZINC001214391366	1373053866	/nfs/dbraw/zinc/05/38/66/1373053866.db2.gz	IMTCINHHYLQAMG-BTIBXDGFSA-N	0	3	342.870	3.094	20	30		EGEDHN
CC[C@@H](C)CC(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001214518429	1373072155	/nfs/dbraw/zinc/07/21/55/1373072155.db2.gz	RNPZZWOABSOAKX-HBUWYVDXSA-N	0	3	331.435	3.070	20	30		EGEDHN
CC/C(C)=C/C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001214575867	1373082837	/nfs/dbraw/zinc/08/28/37/1373082837.db2.gz	MDLSQDILJILWQG-FESITFKDSA-N	0	3	344.886	3.484	20	30		EGEDHN
C=CCCOCCCCC(=O)NCCN[C@@H](C)c1cccc(F)c1	ZINC001127129480	1373093077	/nfs/dbraw/zinc/09/30/77/1373093077.db2.gz	UGCAPVJWWVAOIC-INIZCTEOSA-N	0	3	336.451	3.356	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1C[C@@H](C)[C@H](NCc2ccccc2F)C1)OCC	ZINC001214752197	1373114572	/nfs/dbraw/zinc/11/45/72/1373114572.db2.gz	APDDKYNITJBRDS-ATZDWAIDSA-N	0	3	348.462	3.134	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2(C3CC3)CCC2)C[C@H]1NCC#Cc1ccccc1	ZINC001215237317	1373189528	/nfs/dbraw/zinc/18/95/28/1373189528.db2.gz	WJJFLOOMVQYWHU-YLJYHZDGSA-N	0	3	336.479	3.055	20	30		EGEDHN
CC(C)=C(C)CC(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001215332498	1373198532	/nfs/dbraw/zinc/19/85/32/1373198532.db2.gz	WGABRAUKJBXFJU-YLJYHZDGSA-N	0	3	342.458	3.360	20	30		EGEDHN
CCCC1(C(=O)N2C[C@@H](C)[C@H](NCC#Cc3ccccc3)C2)CCC1	ZINC001215353281	1373201299	/nfs/dbraw/zinc/20/12/99/1373201299.db2.gz	MYQZHMINXXEZDV-UYAOXDASSA-N	0	3	338.495	3.445	20	30		EGEDHN
CC#CCCCC(=O)N1C[C@@H](C)[C@H](NCc2cc(C)ccc2OC)C1	ZINC001215358081	1373202029	/nfs/dbraw/zinc/20/20/29/1373202029.db2.gz	SUFVKCLOGGLLGV-IEBWSBKVSA-N	0	3	342.483	3.134	20	30		EGEDHN
C=CCCC1(C(=O)N2C[C@@H](C)[C@H](NCc3scnc3C)C2)CC1	ZINC001215480802	1373207658	/nfs/dbraw/zinc/20/76/58/1373207658.db2.gz	YQRYLOKWDHLXMK-UKRRQHHQSA-N	0	3	333.501	3.134	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCNCc1ccccc1OC1CC1	ZINC001128084725	1373216265	/nfs/dbraw/zinc/21/62/65/1373216265.db2.gz	AOMLCSYKDUMJAJ-UHFFFAOYSA-N	0	3	328.456	3.202	20	30		EGEDHN
CCC[C@H](CC)C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001216104898	1373264296	/nfs/dbraw/zinc/26/42/96/1373264296.db2.gz	NUCATIJRDWEXSP-SIXWZSSISA-N	0	3	345.462	3.460	20	30		EGEDHN
CCCCCCCCC(=O)N1C[C@@H](C)[C@H](N[C@H](C)c2n[nH]c(C)n2)C1	ZINC001216530999	1373314347	/nfs/dbraw/zinc/31/43/47/1373314347.db2.gz	PXGLOGAEBLFMEE-BFYDXBDKSA-N	0	3	349.523	3.361	20	30		EGEDHN
Cc1cccc2c(C(=O)NCCNCc3ccc(C#N)s3)coc21	ZINC001129556932	1373397579	/nfs/dbraw/zinc/39/75/79/1373397579.db2.gz	ACOFRPBYMMGUIK-UHFFFAOYSA-N	0	3	339.420	3.194	20	30		EGEDHN
C=C(C)CN1CC[C@H](Oc2cnccc2CNC(=O)/C=C(/C)CC)C1	ZINC001130317131	1373491480	/nfs/dbraw/zinc/49/14/80/1373491480.db2.gz	LDVOAZHQNMRHLX-FJJYYWMZSA-N	0	3	343.471	3.083	20	30		EGEDHN
CCC1(C(=O)NCCNCc2cccc(C#N)c2)CCC(F)(F)CC1	ZINC001130409000	1373524498	/nfs/dbraw/zinc/52/44/98/1373524498.db2.gz	RTYSRWSVXGSAQT-UHFFFAOYSA-N	0	3	349.425	3.370	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)CCC[C@H](C)CCC)[C@H]2C1	ZINC001218003832	1373532818	/nfs/dbraw/zinc/53/28/18/1373532818.db2.gz	IIIHDBZISOSCPU-CEXWTWQISA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)C[C@@H](C)CC(C)C)C1	ZINC001130442187	1373541618	/nfs/dbraw/zinc/54/16/18/1373541618.db2.gz	HVVJNNICUGOQSZ-JKSUJKDBSA-N	0	3	332.492	3.074	20	30		EGEDHN
C=C(C)CCC(=O)N1CCO[C@@H]2CN([C@H](C)c3ccccc3C)C[C@@H]21	ZINC001218036803	1373545129	/nfs/dbraw/zinc/54/51/29/1373545129.db2.gz	CYGMCMQYCDONTR-YZGWKJHDSA-N	0	3	342.483	3.324	20	30		EGEDHN
O=C(/C=C/c1ccccc1)c1ccc(O[C@H]2CC[C@@H]3NCCO[C@@H]32)cc1	ZINC001218119163	1373564388	/nfs/dbraw/zinc/56/43/88/1373564388.db2.gz	IRVPCPKTKWWDIM-KCARCXILSA-N	0	3	349.430	3.481	20	30		EGEDHN
C=CCCCC(=O)N1CCO[C@@H]2CN([C@@H](C)c3ccccc3C)C[C@@H]21	ZINC001218565932	1373633912	/nfs/dbraw/zinc/63/39/12/1373633912.db2.gz	BGEIDIVUUJWFPF-YSIASYRMSA-N	0	3	342.483	3.324	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)[C@H](C)CCC(C)(C)C)[C@H]2C1	ZINC001218976900	1373673377	/nfs/dbraw/zinc/67/33/77/1373673377.db2.gz	VVXKJELPJJJOPZ-FGTMMUONSA-N	0	3	336.520	3.327	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2OCCN(C(=O)c3cc(C)ccc3C)[C@H]2C1	ZINC001219008673	1373677990	/nfs/dbraw/zinc/67/79/90/1373677990.db2.gz	UPIUHKVBTWMEKP-YSIASYRMSA-N	0	3	342.483	3.183	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2OCCN(C(=O)c3cc(C)ccc3C)[C@H]2C1	ZINC001219008674	1373678092	/nfs/dbraw/zinc/67/80/92/1373678092.db2.gz	UPIUHKVBTWMEKP-YZGWKJHDSA-N	0	3	342.483	3.183	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@H](C)O[C@@]2(CCN(Cc3ccccc3)C2)C1	ZINC001131666764	1373752109	/nfs/dbraw/zinc/75/21/09/1373752109.db2.gz	RQNOMGXRHFFNKP-GHTZIAJQSA-N	0	3	342.483	3.235	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C1(CC(C)C)CCC1)C[C@H](C)O2	ZINC001131669868	1373753711	/nfs/dbraw/zinc/75/37/11/1373753711.db2.gz	VMLCRPZTXXTYAU-GHTZIAJQSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2ccc(CCC)cc2)[C@@H](O)C1	ZINC001220234140	1373759020	/nfs/dbraw/zinc/75/90/20/1373759020.db2.gz	WIDJZTRIRFQIOX-UXHICEINSA-N	0	3	344.499	3.160	20	30		EGEDHN
C=CCOCCN1CC[C@@H]2CN(C(=O)C[C@H](CC)CCCC)[C@@H]2C1	ZINC001221701661	1373791247	/nfs/dbraw/zinc/79/12/47/1373791247.db2.gz	ZBKXZXVCRUVHOG-GUDVDZBRSA-N	0	3	336.520	3.328	20	30		EGEDHN
CCCCCCCC[C@@H](C)C(=O)N1C[C@H]2CCN(CCCO)C[C@H]21	ZINC001222037143	1373812913	/nfs/dbraw/zinc/81/29/13/1373812913.db2.gz	SSUSDNAPUFIXQS-GUDVDZBRSA-N	0	3	338.536	3.288	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@H](C)N(CCOc2ccccc2C)C1	ZINC001131894650	1375032039	/nfs/dbraw/zinc/03/20/39/1375032039.db2.gz	AXDLRUZSEDIQNG-ZWKOTPCHSA-N	0	3	330.472	3.309	20	30		EGEDHN
CC(C)(C(=O)NCC1CCN(Cc2cccc(C#N)c2)CC1)C(F)F	ZINC001224485323	1375068918	/nfs/dbraw/zinc/06/89/18/1375068918.db2.gz	FXHWUEVHIOMQCA-UHFFFAOYSA-N	0	3	349.425	3.178	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CC[C@H](C)N(CCOCCC(C)C)C1	ZINC001131975967	1375078351	/nfs/dbraw/zinc/07/83/51/1375078351.db2.gz	GVFONWJVRGBATJ-RBUKOAKNSA-N	0	3	336.520	3.212	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)CCc2cccc(Cl)c2)s1	ZINC001131991714	1375084509	/nfs/dbraw/zinc/08/45/09/1375084509.db2.gz	XFLGXAQCOZZQQO-UHFFFAOYSA-N	0	3	347.871	3.112	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@@H](C)N(Cc2ccc(OC)c(C)c2)C1	ZINC001132003248	1375093422	/nfs/dbraw/zinc/09/34/22/1375093422.db2.gz	RTUWIBNQLXIFJZ-IEBWSBKVSA-N	0	3	342.483	3.276	20	30		EGEDHN
CCc1cccc(CN2C[C@@H](NC(=O)C#CC(C)C)CC[C@@H]2C)c1	ZINC001132018284	1375101051	/nfs/dbraw/zinc/10/10/51/1375101051.db2.gz	WFRQUNAISYIIAW-PXNSSMCTSA-N	0	3	326.484	3.378	20	30		EGEDHN
Cc1ccc(CN2C[C@H](NC(=O)C#CC(C)C)CC[C@H]2C)cc1C	ZINC001132021960	1375102196	/nfs/dbraw/zinc/10/21/96/1375102196.db2.gz	SIZFNTCCCUVBJQ-UYAOXDASSA-N	0	3	326.484	3.432	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@@H]1CCCC[C@H]1NCc1ccc(Cl)cc1F	ZINC001225396134	1375108065	/nfs/dbraw/zinc/10/80/65/1375108065.db2.gz	ZLWSQGCAZLCLQO-HFBAOOFYSA-N	0	3	337.826	3.156	20	30		EGEDHN
C[C@H]1CC[C@H](NC(=O)C#CC2CC2)CN1CCCc1cccc(F)c1	ZINC001132046698	1375115858	/nfs/dbraw/zinc/11/58/58/1375115858.db2.gz	QPGGDILOTWGESA-JXFKEZNVSA-N	0	3	342.458	3.141	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCCc2csc(C)n2)CC[C@@H]1C	ZINC001132050673	1375117925	/nfs/dbraw/zinc/11/79/25/1375117925.db2.gz	QULQKMMQRHHHLI-GOEBONIOSA-N	0	3	335.517	3.319	20	30		EGEDHN
C=CCCCN1C[C@H](NC(=O)c2cn3cc(C)nc3s2)CC[C@H]1C	ZINC001132097272	1375144672	/nfs/dbraw/zinc/14/46/72/1375144672.db2.gz	HUKLASLUOUKYKZ-HUUCEWRRSA-N	0	3	346.500	3.253	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CCCC[C@H]1NCc1cnc(C)s1	ZINC001225752235	1375152525	/nfs/dbraw/zinc/15/25/25/1375152525.db2.gz	CQQVZLBOPUQBSW-IAGOWNOFSA-N	0	3	333.501	3.162	20	30		EGEDHN
C=CCCCN1C[C@H](NC(=O)c2sc3nccn3c2C)CC[C@@H]1C	ZINC001132116869	1375156933	/nfs/dbraw/zinc/15/69/33/1375156933.db2.gz	XIJFOSUTIFPKKG-DZGCQCFKSA-N	0	3	346.500	3.253	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COC/C=C\c2ccccc2)CC[C@H]1C	ZINC001132124056	1375158867	/nfs/dbraw/zinc/15/88/67/1375158867.db2.gz	LYKUCYRVWBJZBY-XHKZUWJLSA-N	0	3	342.483	3.262	20	30		EGEDHN
N#Cc1cc(OC[C@@H]2CN(Cc3ccccc3)CCCO2)ccc1F	ZINC001225820909	1375160188	/nfs/dbraw/zinc/16/01/88/1375160188.db2.gz	TWCMPRONDUYZSK-IBGZPJMESA-N	0	3	340.398	3.367	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1CC[C@@H](C)N(Cc2ccc(CO)cc2)C1	ZINC001132217901	1375215960	/nfs/dbraw/zinc/21/59/60/1375215960.db2.gz	IRJGSAKYOSQELJ-APWZRJJASA-N	0	3	344.499	3.250	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CC[C@@H](C)N(Cc2cccc(N(C)C)c2)C1	ZINC001132218551	1375217190	/nfs/dbraw/zinc/21/71/90/1375217190.db2.gz	RSIJNKJTAYPAJS-SJLPKXTDSA-N	0	3	343.515	3.434	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CCCC[C@H]1NCc1c(C)onc1CC	ZINC001226533224	1375276983	/nfs/dbraw/zinc/27/69/83/1375276983.db2.gz	RGNJHKMMWCOLBD-QZTJIDSGSA-N	0	3	333.476	3.419	20	30		EGEDHN
C=CCOCC(=O)NC1CCN([C@@H]2CCc3ccc(Cl)cc32)CC1	ZINC001226599493	1375289493	/nfs/dbraw/zinc/28/94/93/1375289493.db2.gz	XOPPLYBYXNYFTF-GOSISDBHSA-N	0	3	348.874	3.111	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCc2ccc(F)cc2F)CC[C@H]1C	ZINC001132392341	1375346700	/nfs/dbraw/zinc/34/67/00/1375346700.db2.gz	IMCXBYKAFILZEP-RHSMWYFYSA-N	0	3	336.426	3.443	20	30		EGEDHN
C#CCCCCC(=O)NC1CCN(CCOc2ccccc2C)CC1	ZINC001226962014	1375371695	/nfs/dbraw/zinc/37/16/95/1375371695.db2.gz	WPYMKVIMKLGFJM-UHFFFAOYSA-N	0	3	342.483	3.148	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COc2ccc(Cl)cc2)CC[C@@H]1C	ZINC001132457926	1375399803	/nfs/dbraw/zinc/39/98/03/1375399803.db2.gz	NKLNZUBOFUOULZ-HOCLYGCPSA-N	0	3	336.863	3.264	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCn2ccc3ccccc32)CC[C@@H]1C	ZINC001132469958	1375411972	/nfs/dbraw/zinc/41/19/72/1375411972.db2.gz	ZGHUMKDGPCBZEO-FUHWJXTLSA-N	0	3	325.456	3.187	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2cccc(C3CC3)c2)CC[C@H]1C	ZINC001132522973	1375439534	/nfs/dbraw/zinc/43/95/34/1375439534.db2.gz	VVKNWMSRFQQRNJ-UZLBHIALSA-N	0	3	342.483	3.349	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCc2cc(F)ccc2F)CC[C@H]1C	ZINC001132524832	1375440225	/nfs/dbraw/zinc/44/02/25/1375440225.db2.gz	MMMBZVQNDORPNT-RHSMWYFYSA-N	0	3	336.426	3.443	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1CC[C@@H](C)N(Cc2cccc(C)c2)C1	ZINC001132529819	1375443911	/nfs/dbraw/zinc/44/39/11/1375443911.db2.gz	RPIGDHPPMRUDLE-MJGOQNOKSA-N	0	3	330.472	3.057	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1CC[C@@H](C)N(Cc2ccc(C)c(C)c2)C1	ZINC001132533039	1375444296	/nfs/dbraw/zinc/44/42/96/1375444296.db2.gz	JCTLDTOBCBWGQI-QUCCMNQESA-N	0	3	344.499	3.365	20	30		EGEDHN
C=C(C)CCC(=O)NC1CCN(Cc2cccc(OC)c2C)CC1	ZINC001227607374	1375452791	/nfs/dbraw/zinc/45/27/91/1375452791.db2.gz	PVJFHTMKMZPHDT-UHFFFAOYSA-N	0	3	330.472	3.441	20	30		EGEDHN
C#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)CC2CCC2)CC1	ZINC001132554816	1375462288	/nfs/dbraw/zinc/46/22/88/1375462288.db2.gz	MUOIRKBBWASKGQ-HXUWFJFHSA-N	0	3	339.483	3.088	20	30		EGEDHN
CC#CCN1CC[C@@H](CN(Cc2scnc2C)C(=O)/C(C)=C/C)C1	ZINC001132557622	1375464291	/nfs/dbraw/zinc/46/42/91/1375464291.db2.gz	ACHAWGUJWNSGSK-GFGNLIMNSA-N	0	3	345.512	3.092	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCNCc1csc(Br)c1	ZINC001132577476	1375473724	/nfs/dbraw/zinc/47/37/24/1375473724.db2.gz	WFBORLRUDJXBEL-WDEREUQCSA-N	0	3	345.306	3.175	20	30		EGEDHN
CC#CCCCC(=O)NCCNCc1cccc(C(F)(F)F)c1	ZINC001132601823	1375481600	/nfs/dbraw/zinc/48/16/00/1375481600.db2.gz	OPIKHJKDSJYDAV-UHFFFAOYSA-N	0	3	326.362	3.105	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CCCC[C@H]1NCc1cncc(F)c1	ZINC001227917527	1375490753	/nfs/dbraw/zinc/49/07/53/1375490753.db2.gz	YMWWESOOSKOCBV-IAGOWNOFSA-N	0	3	333.451	3.340	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CCN(CCO[C@H]2CCCC[C@@H]2C)CC1	ZINC001228631974	1375622939	/nfs/dbraw/zinc/62/29/39/1375622939.db2.gz	ZAMQOLVIGIWIQO-WMZOPIPTSA-N	0	3	336.520	3.375	20	30		EGEDHN
C#CCCCCCC(=O)NC1CCN(Cc2ccc(OC)cc2)CC1	ZINC001228636953	1375623633	/nfs/dbraw/zinc/62/36/33/1375623633.db2.gz	FZBLLTWRBJUYRF-UHFFFAOYSA-N	0	3	342.483	3.360	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NC1CCN(CCOc2ccccc2)CC1	ZINC001228750439	1375664069	/nfs/dbraw/zinc/66/40/69/1375664069.db2.gz	YRUFMDNMKSUQDK-SJORKVTESA-N	0	3	330.472	3.104	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NC1CCN(Cc2cccc(N(C)C)c2)CC1	ZINC001228760350	1375667433	/nfs/dbraw/zinc/66/74/33/1375667433.db2.gz	LCNSFZKAQSNHHF-IAGOWNOFSA-N	0	3	343.515	3.291	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC1CCN(Cc2ccccc2N(C)C)CC1	ZINC001228786171	1375674842	/nfs/dbraw/zinc/67/48/42/1375674842.db2.gz	DMKOZOXECDQJEV-KRWDZBQOSA-N	0	3	343.515	3.436	20	30		EGEDHN
C=CCCCC(=O)NC1CCN(CCOc2ccccc2C)CC1	ZINC001228927856	1375718247	/nfs/dbraw/zinc/71/82/47/1375718247.db2.gz	NCXLMCCAOIEREG-UHFFFAOYSA-N	0	3	330.472	3.311	20	30		EGEDHN
CCCc1ccc(C(=O)NCCNCc2ccc(C#N)s2)cc1	ZINC001133089429	1375767883	/nfs/dbraw/zinc/76/78/83/1375767883.db2.gz	GWHKPUHSPMMWMZ-UHFFFAOYSA-N	0	3	327.453	3.092	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@H](C)[C@@H](CNCc3ocnc3C)C2)CC1	ZINC001133105786	1375777841	/nfs/dbraw/zinc/77/78/41/1375777841.db2.gz	XMLPJMJAIDZCDC-RDJZCZTQSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](C)[C@@H](CNCc3ocnc3C)C2)CCC1	ZINC001133105315	1375778798	/nfs/dbraw/zinc/77/87/98/1375778798.db2.gz	SBXMTWBSTJBDBB-RDJZCZTQSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](C)[C@H](CNCc2cc(C)no2)C1	ZINC001133137925	1375798746	/nfs/dbraw/zinc/79/87/46/1375798746.db2.gz	AAJRQFHKATZVQJ-GDBMZVCRSA-N	0	3	333.476	3.160	20	30		EGEDHN
Cc1cccc(Cl)c1C(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001133314973	1375918051	/nfs/dbraw/zinc/91/80/51/1375918051.db2.gz	RXOLSYCXZJJFIE-UHFFFAOYSA-N	0	3	345.805	3.179	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1ccsc1	ZINC001133376817	1375956943	/nfs/dbraw/zinc/95/69/43/1375956943.db2.gz	CKMSVNIQXSBNMO-UHFFFAOYSA-N	0	3	332.856	3.267	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@H]1C[C@]1(C)CC	ZINC001133407532	1375992705	/nfs/dbraw/zinc/99/27/05/1375992705.db2.gz	IXHVZKYBQOPGEU-MJGOQNOKSA-N	0	3	332.875	3.328	20	30		EGEDHN
C=C[C@@H](C(=O)NC1CCN(CCOC2CCC2)CC1)c1ccccc1	ZINC001230332116	1375999430	/nfs/dbraw/zinc/99/94/30/1375999430.db2.gz	SGOIRGZVQFZOBE-HXUWFJFHSA-N	0	3	342.483	3.106	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2cc3cc(C)ccc3o2)CC1	ZINC001230353238	1376006911	/nfs/dbraw/zinc/00/69/11/1376006911.db2.gz	MOHDRBOUGBPTAY-UHFFFAOYSA-N	0	3	342.439	3.138	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)/C=C\c1ccco1)NCc1ccccc1C#N	ZINC001133520109	1376053980	/nfs/dbraw/zinc/05/39/80/1376053980.db2.gz	ICWNPYBYXMMDPG-REDNKSFVSA-N	0	3	337.423	3.238	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC([C@@H]2CCCN2Cc2ccon2)CC1	ZINC001230586688	1376089184	/nfs/dbraw/zinc/08/91/84/1376089184.db2.gz	DYRNAHYBQKHJTI-LPHOPBHVSA-N	0	3	345.487	3.480	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)CC1CCCC1	ZINC001133572738	1376098647	/nfs/dbraw/zinc/09/86/47/1376098647.db2.gz	KGCFNMVYNCYBQQ-QWHCGFSZSA-N	0	3	331.298	3.348	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCCN(CC[C@H](C)F)Cc1cccnc1	ZINC001230812098	1376155847	/nfs/dbraw/zinc/15/58/47/1376155847.db2.gz	VJTFWHHLFNJDPM-INIZCTEOSA-N	0	3	335.467	3.350	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@@H]1CCN(Cc1ccc(OCC)nc1)C2	ZINC001231653417	1376294373	/nfs/dbraw/zinc/29/43/73/1376294373.db2.gz	HURYYKKQEMACMS-QUCCMNQESA-N	0	3	346.471	3.054	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)C1C(C)(C)C1(C)C	ZINC001134076359	1376352664	/nfs/dbraw/zinc/35/26/64/1376352664.db2.gz	KOBAQVXAMRTERX-NEPJUHHUSA-N	0	3	345.325	3.450	20	30		EGEDHN
C#CCCN1CCC(N(CCC)C(=O)c2ncc(Cl)s2)CC1	ZINC001752440343	1440181206	/nfs/dbraw/zinc/18/12/06/1440181206.db2.gz	UIGVTCPSLXZYIF-UHFFFAOYSA-N	0	3	339.892	3.136	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)c1sccc1F	ZINC001134273628	1376448735	/nfs/dbraw/zinc/44/87/35/1376448735.db2.gz	HVGYSPCPKWKTLL-VHSXEESVSA-N	0	3	349.269	3.282	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)c1c(C)coc1C	ZINC001134289222	1376460646	/nfs/dbraw/zinc/46/06/46/1376460646.db2.gz	SGZLEELXSQOAKC-VXGBXAGGSA-N	0	3	343.265	3.292	20	30		EGEDHN
Cc1nc(CN[C@@H](C)C[C@@H](C)NC(=O)C#CC(C)(C)C)c(C)s1	ZINC001134329244	1376479405	/nfs/dbraw/zinc/47/94/05/1376479405.db2.gz	MDFBLIVFXUQWDY-QWHCGFSZSA-N	0	3	335.517	3.182	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC([C@@H]2CCN(Cc3ccc(C#N)s3)C2)C1	ZINC001232844142	1376522919	/nfs/dbraw/zinc/52/29/19/1376522919.db2.gz	HANYBCWLROSQEA-CYBMUJFWSA-N	0	3	347.484	3.309	20	30		EGEDHN
N#Cc1cccc(CN2CCN([C@@H]3CCCc4ccccc43)CC2)n1	ZINC001232926661	1376537891	/nfs/dbraw/zinc/53/78/91/1376537891.db2.gz	ZDWSIEAKWHRJPJ-OAQYLSRUSA-N	0	3	332.451	3.148	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H](C)C[C@H](C)NCc1oc(C)nc1C	ZINC001134447565	1376542310	/nfs/dbraw/zinc/54/23/10/1376542310.db2.gz	JCXRZFVPNNBDGZ-QWRGUYRKSA-N	0	3	341.883	3.443	20	30		EGEDHN
N#Cc1cccc(O[C@@H]2CCCN(Cc3cc(Cl)ncc3O)C2)c1	ZINC001233037596	1376559073	/nfs/dbraw/zinc/55/90/73/1376559073.db2.gz	CXURBWQUQKSLLC-MRXNPFEDSA-N	0	3	343.814	3.356	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)C1C=CC=CC=C1)NCc1ccccc1C#N	ZINC001134476446	1376559967	/nfs/dbraw/zinc/55/99/67/1376559967.db2.gz	RUQMYNBWSFCINI-IAGOWNOFSA-N	0	3	335.451	3.230	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CC[C@@H]2[C@@H]1CCN2C(=O)OC(C)(C)C	ZINC001233079374	1376565600	/nfs/dbraw/zinc/56/56/00/1376565600.db2.gz	CMAKNQRPIJOFDW-ZWKOTPCHSA-N	0	3	341.455	3.450	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCC(N2c3ccccc3CC2=O)CC1	ZINC001233080859	1376566822	/nfs/dbraw/zinc/56/68/22/1376566822.db2.gz	FKLKTYZEMAJEFA-UHFFFAOYSA-N	0	3	345.446	3.420	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2cc(C3CC3)no2)CCC1	ZINC001134566500	1376598889	/nfs/dbraw/zinc/59/88/89/1376598889.db2.gz	FWIMTGBDSNMSOW-HUUCEWRRSA-N	0	3	343.471	3.119	20	30		EGEDHN
CC[C@H](Cc1ccccc1)C(=O)NCCNCc1ccc(C#N)s1	ZINC001134587898	1376611888	/nfs/dbraw/zinc/61/18/88/1376611888.db2.gz	FNKHPEFIMISTBJ-MRXNPFEDSA-N	0	3	341.480	3.094	20	30		EGEDHN
CC[C@H](Cc1ccccc1)C(=O)NCCNCc1ccc(C#N)cc1	ZINC001134589284	1376612454	/nfs/dbraw/zinc/61/24/54/1376612454.db2.gz	RFJFQSGKNXTGOK-HXUWFJFHSA-N	0	3	335.451	3.033	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2ccncc2Cl)CCC1	ZINC001134589125	1376613009	/nfs/dbraw/zinc/61/30/09/1376613009.db2.gz	PBABELJRHFRHID-HUUCEWRRSA-N	0	3	347.890	3.302	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H](C)C[C@H](C)NCc1nc(C)cs1	ZINC001134608317	1376623409	/nfs/dbraw/zinc/62/34/09/1376623409.db2.gz	UNAVSSRXGYKHDV-UONOGXRCSA-N	0	3	346.500	3.126	20	30		EGEDHN
CC(C)C#CC(=O)N(C)C[C@H]1CCN1CCCCOc1ccccc1	ZINC001234169366	1376782739	/nfs/dbraw/zinc/78/27/39/1376782739.db2.gz	DSKRHRRBPJTBGU-LJQANCHMSA-N	0	3	342.483	3.038	20	30		EGEDHN
C=CCCOCCCCC(=O)N(C)C[C@H]1CCN1CC[C@@H](C)F	ZINC001234276202	1376797868	/nfs/dbraw/zinc/79/78/68/1376797868.db2.gz	JZFQNZFITSTAJL-IAGOWNOFSA-N	0	3	328.472	3.030	20	30		EGEDHN
CCCCCCCN1CC[C@@H]1CN(C)C(=O)c1cc(C2CC2)n(C)n1	ZINC001235035653	1376834707	/nfs/dbraw/zinc/83/47/07/1376834707.db2.gz	FYGLKDSJTGSXTI-QGZVFWFLSA-N	0	3	346.519	3.414	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)NCCNCc1cc2ccccc2o1	ZINC001135058362	1376873045	/nfs/dbraw/zinc/87/30/45/1376873045.db2.gz	MZNFUNFNKNUSGW-HKUYNNGSSA-N	0	3	342.439	3.010	20	30		EGEDHN
CCCCCCCN1CC[C@H]1CN(C)C(=O)c1cc2cccn2cn1	ZINC001235725747	1376886273	/nfs/dbraw/zinc/88/62/73/1376886273.db2.gz	UHNBAMOTHASWRU-SFHVURJKSA-N	0	3	342.487	3.451	20	30		EGEDHN
COc1ccc(CNCCNC(=O)[C@H](C)[C@@H](C)C(C)(C)C)cc1C#N	ZINC001135177687	1376949744	/nfs/dbraw/zinc/94/97/44/1376949744.db2.gz	KBJJDWWCIDMFTR-HUUCEWRRSA-N	0	3	345.487	3.091	20	30		EGEDHN
C=CCOC(=O)N[C@@H]1CCCN(Cc2ccc(C(C)C)cc2O)C1	ZINC001237051640	1376972237	/nfs/dbraw/zinc/97/22/37/1376972237.db2.gz	PNHBDVIPOGYJGH-QGZVFWFLSA-N	0	3	332.444	3.392	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2ccn(CC)n2)CC1	ZINC001135381987	1377065353	/nfs/dbraw/zinc/06/53/53/1377065353.db2.gz	CABHVRGRXDQQLX-CVEARBPZSA-N	0	3	332.492	3.022	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2conc2CC)CC1	ZINC001135383803	1377065876	/nfs/dbraw/zinc/06/58/76/1377065876.db2.gz	WMUUACOXOWLYOC-GJZGRUSLSA-N	0	3	333.476	3.356	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)c1occc1CC	ZINC001135394530	1377071737	/nfs/dbraw/zinc/07/17/37/1377071737.db2.gz	IFWUOCBWCYPJAN-VXGBXAGGSA-N	0	3	343.265	3.237	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)C1CC2(CC2)C1)NCc1cc(F)ccc1C#N	ZINC001135445986	1377100379	/nfs/dbraw/zinc/10/03/79/1377100379.db2.gz	IPIMZLATXPUAHP-KGLIPLIRSA-N	0	3	343.446	3.260	20	30		EGEDHN
CCC1(C(=O)N[C@@H]2CCC[C@H](NCc3ccccc3C#N)C2)CC1	ZINC001266066681	1377180813	/nfs/dbraw/zinc/18/08/13/1377180813.db2.gz	FAZHGOOIDLJYMI-ZWKOTPCHSA-N	0	3	325.456	3.265	20	30		EGEDHN
N#Cc1ccc(N2CCCN(Cc3c[nH]c4cccc(F)c34)CC2)nc1	ZINC001136985609	1377450732	/nfs/dbraw/zinc/45/07/32/1377450732.db2.gz	NQWJKCFBKBNYOS-UHFFFAOYSA-N	0	3	349.413	3.286	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)CC(F)(F)F)CCCC[C@H]1C	ZINC001267868491	1377475857	/nfs/dbraw/zinc/47/58/57/1377475857.db2.gz	MKEAZDZDZKOXFV-ZWNOBZJWSA-N	0	3	326.790	3.346	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC[C@@H]2CNCC=C(Cl)Cl)cc1	ZINC001267960384	1377480199	/nfs/dbraw/zinc/48/01/99/1377480199.db2.gz	DDACKRHQVJXOOI-OAHLLOKOSA-N	0	3	337.250	3.181	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccn3c(C)cnc3c2)CCCC1	ZINC001268036163	1377483200	/nfs/dbraw/zinc/48/32/00/1377483200.db2.gz	MUVLWCOECCHDNF-UHFFFAOYSA-N	0	3	346.862	3.027	20	30		EGEDHN
C=CCN1C(=O)CCC12CCN(Cc1c[nH]c3ccc(F)cc13)CC2	ZINC001137336689	1377524012	/nfs/dbraw/zinc/52/40/12/1377524012.db2.gz	JXPBFZRIXJIBBZ-UHFFFAOYSA-N	0	3	341.430	3.450	20	30		EGEDHN
CN(c1ccc(C#N)cc1)c1ccc(CN2CC[C@H](F)[C@@H](O)C2)cc1	ZINC001137899634	1377640877	/nfs/dbraw/zinc/64/08/77/1377640877.db2.gz	BDDYOFSXLMJCDI-PMACEKPBSA-N	0	3	339.414	3.231	20	30		EGEDHN
C=CCOC(=O)N[C@@H]1CCCN(Cc2c(C)n(C)c3ccccc23)C1	ZINC001138260541	1377695088	/nfs/dbraw/zinc/69/50/88/1377695088.db2.gz	JJTDTJRETATMGQ-MRXNPFEDSA-N	0	3	341.455	3.363	20	30		EGEDHN
COc1cc(CN2CCC3SC(=O)C=C3C2)ccc1OC(F)F	ZINC001138554120	1377741801	/nfs/dbraw/zinc/74/18/01/1377741801.db2.gz	ZOJYQHCMMXKSQR-CQSZACIVSA-N	0	3	341.379	3.071	20	30		EGEDHN
C#CCOc1ccc(CN2CC[C@H](N3CCCCC3)[C@@H](F)C2)cc1	ZINC001138560993	1377742867	/nfs/dbraw/zinc/74/28/67/1377742867.db2.gz	UAAHEIMITBIJMW-PMACEKPBSA-N	0	3	330.447	3.097	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@](O)(C(F)(F)F)[C@H](C)C2)c1[O-]	ZINC001138626068	1377755859	/nfs/dbraw/zinc/75/58/59/1377755859.db2.gz	ZNHXWBRPVZDIKS-MLGOLLRUSA-N	0	3	329.362	3.256	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@](O)(C(F)(F)F)[C@H](C)C2)c1[O-]	ZINC001138626068	1377755864	/nfs/dbraw/zinc/75/58/64/1377755864.db2.gz	ZNHXWBRPVZDIKS-MLGOLLRUSA-N	0	3	329.362	3.256	20	30		EGEDHN
C=CCc1cccc(C[NH+]2C[C@H]3CN(Cc4ccccn4)C[C@@H]3C2)c1[O-]	ZINC001138626847	1377756023	/nfs/dbraw/zinc/75/60/23/1377756023.db2.gz	QGTDAJOIQNGNPU-PMACEKPBSA-N	0	3	349.478	3.080	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@@](O)(C(F)(F)F)[C@H](C)C2)c1[O-]	ZINC001138626069	1377756109	/nfs/dbraw/zinc/75/61/09/1377756109.db2.gz	ZNHXWBRPVZDIKS-WBMJQRKESA-N	0	3	329.362	3.256	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@@](O)(C(F)(F)F)[C@H](C)C2)c1[O-]	ZINC001138626069	1377756111	/nfs/dbraw/zinc/75/61/11/1377756111.db2.gz	ZNHXWBRPVZDIKS-WBMJQRKESA-N	0	3	329.362	3.256	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CCN(c3cccc(OC)c3)CC2)c1[O-]	ZINC001138625332	1377756195	/nfs/dbraw/zinc/75/61/95/1377756195.db2.gz	JKOWOUCCFOSXKH-UHFFFAOYSA-N	0	3	338.451	3.452	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@@H](NC(=O)C3CCC3)C2)c1[O-]	ZINC001138631276	1377757716	/nfs/dbraw/zinc/75/77/16/1377757716.db2.gz	NLCGSKRVYQWCOJ-GOSISDBHSA-N	0	3	328.456	3.001	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@@H](NC(=O)C3CCC3)C2)c1[O-]	ZINC001138631276	1377757721	/nfs/dbraw/zinc/75/77/21/1377757721.db2.gz	NLCGSKRVYQWCOJ-GOSISDBHSA-N	0	3	328.456	3.001	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CCC3(CC(=O)N(C(C)C)C3)CC2)c1[O-]	ZINC001138630761	1377758407	/nfs/dbraw/zinc/75/84/07/1377758407.db2.gz	CVAOJMYZKCSEPZ-UHFFFAOYSA-N	0	3	342.483	3.344	20	30		EGEDHN
C=CCN1C(=O)CCC[C@]12CCCN(Cc1cnn(CCC)c1C)C2	ZINC001138635847	1377758655	/nfs/dbraw/zinc/75/86/55/1377758655.db2.gz	XEFNHNFUIAORHV-HXUWFJFHSA-N	0	3	344.503	3.135	20	30		EGEDHN
C[C@H]1CN(Cc2ccc(Oc3ccc(C#N)cc3)nc2)CCC[C@@H]1O	ZINC001139426644	1377882373	/nfs/dbraw/zinc/88/23/73/1377882373.db2.gz	HRIRSLMVRBMBIU-KXBFYZLASA-N	0	3	337.423	3.338	20	30		EGEDHN
N#Cc1ccc(OC2CCN(Cc3ccc(=O)[nH]c3)CC2)cc1Cl	ZINC001139467605	1377888541	/nfs/dbraw/zinc/88/85/41/1377888541.db2.gz	ARICAJUFLUARJQ-UHFFFAOYSA-N	0	3	343.814	3.356	20	30		EGEDHN
N#Cc1ccc(CN2C[C@H]3CCC[C@@]3(COCc3cccnc3)C2)cn1	ZINC001140541850	1378081843	/nfs/dbraw/zinc/08/18/43/1378081843.db2.gz	WDLTZCXAKJETTE-CTNGQTDRSA-N	0	3	348.450	3.167	20	30		EGEDHN
C=CCOCc1ncn2c1CN(Cc1cc(C)ccc1O)CCC2	ZINC001140622213	1378100317	/nfs/dbraw/zinc/10/03/17/1378100317.db2.gz	YCEKDSSIBOTVEN-UHFFFAOYSA-N	0	3	327.428	3.006	20	30		EGEDHN
C=CCCCCN1CC[C@@H]2C[C@@]21C(=O)N1CCC[C@@H]1c1cc(C)on1	ZINC001276886130	1378192100	/nfs/dbraw/zinc/19/21/00/1378192100.db2.gz	WAKCGXKAXIVVBJ-POAQFYNOSA-N	0	3	343.471	3.467	20	30		EGEDHN
O=C1C=C2CN(Cc3cc4c5c(c3)CCCN5CCC4)CCC2S1	ZINC001141075497	1378232620	/nfs/dbraw/zinc/23/26/20/1378232620.db2.gz	RSHDSTXLHKUKIW-GOSISDBHSA-N	0	3	340.492	3.160	20	30		EGEDHN
O=C1C=C2CN(Cc3cc4c5c(c3)CCCN5CCC4)CC[C@H]2S1	ZINC001141075497	1378232624	/nfs/dbraw/zinc/23/26/24/1378232624.db2.gz	RSHDSTXLHKUKIW-GOSISDBHSA-N	0	3	340.492	3.160	20	30		EGEDHN
C=CCN1C(=O)CC[C@@]12CCCN(Cc1[nH]cnc1C(C)(C)C)CC2	ZINC001142222576	1378422219	/nfs/dbraw/zinc/42/22/19/1378422219.db2.gz	RQBBEJWHXNFEOK-HXUWFJFHSA-N	0	3	344.503	3.240	20	30		EGEDHN
N#Cc1ccc2c(CN3CCC(Oc4ccncc4)CC3)c[nH]c2c1	ZINC001142916752	1378508355	/nfs/dbraw/zinc/50/83/55/1378508355.db2.gz	YKAISSYGYIHTNB-UHFFFAOYSA-N	0	3	332.407	3.478	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3cc(C)c(F)c(F)c3)C2)C1=O	ZINC001143599602	1378623559	/nfs/dbraw/zinc/62/35/59/1378623559.db2.gz	HSYLMSBCOLRODK-IBGZPJMESA-N	0	3	334.410	3.274	20	30		EGEDHN
N#Cc1cncc(CN2CCN([C@H]3CCCc4ccccc43)CC2)c1	ZINC001144083891	1378680423	/nfs/dbraw/zinc/68/04/23/1378680423.db2.gz	WGJPXMAGIVEORG-NRFANRHFSA-N	0	3	332.451	3.148	20	30		EGEDHN
C#Cc1ccc(CN2CCC(NC(=O)c3ccc(OC)cc3)CC2)cc1	ZINC001144573978	1378747261	/nfs/dbraw/zinc/74/72/61/1378747261.db2.gz	WVAGRZDLFUOFNB-UHFFFAOYSA-N	0	3	348.446	3.071	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2nccn2C)CCCCC1	ZINC001146506256	1378855939	/nfs/dbraw/zinc/85/59/39/1378855939.db2.gz	YZDSIDIFMTYUPT-IRXDYDNUSA-N	0	3	346.519	3.320	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2conc2C)CCCCC1	ZINC001146702622	1378902538	/nfs/dbraw/zinc/90/25/38/1378902538.db2.gz	YHDOUAZPGIBKTP-CVEARBPZSA-N	0	3	345.487	3.330	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2nccn2CC)CCCC1	ZINC001146832719	1378932259	/nfs/dbraw/zinc/93/22/59/1378932259.db2.gz	XWCWAXJZOVMOMJ-SJORKVTESA-N	0	3	346.519	3.412	20	30		EGEDHN
C=C(Br)CNC[C@@H](C1CC1)N(C)C(=O)CC(C)(C)C	ZINC001283482641	1378978465	/nfs/dbraw/zinc/97/84/65/1378978465.db2.gz	KTAWCQLTEJWLLJ-ZDUSSCGKSA-N	0	3	331.298	3.158	20	30		EGEDHN
C=CCCC(=O)N1CC2(C1)CCN(CCOc1cccc(Cl)c1)C2	ZINC001147188204	1378984146	/nfs/dbraw/zinc/98/41/46/1378984146.db2.gz	UILUFPIMBWZCCK-UHFFFAOYSA-N	0	3	348.874	3.219	20	30		EGEDHN
C#CCCCCC(=O)N1CC2(C1)CCN(C/C=C\c1ccccc1)C2	ZINC001147374899	1379011085	/nfs/dbraw/zinc/01/10/85/1379011085.db2.gz	USCFTANQDSCVRX-XFXZXTDPSA-N	0	3	336.479	3.428	20	30		EGEDHN
C#CCCCC(=O)N1CC2(C1)CCN(Cc1ccc(C(F)F)cc1)C2	ZINC001147427956	1379017782	/nfs/dbraw/zinc/01/77/82/1379017782.db2.gz	FDBXYFYQKSIKLC-UHFFFAOYSA-N	0	3	346.421	3.462	20	30		EGEDHN
CC[C@@H](CC(=O)NCCNCc1ccc(C#N)cc1)c1ccccc1	ZINC001147474959	1379029400	/nfs/dbraw/zinc/02/94/00/1379029400.db2.gz	MIJJUDIOVABCSS-IBGZPJMESA-N	0	3	335.451	3.348	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC2(C1)CCN(Cc1ncccc1C)C2	ZINC001147631463	1379053072	/nfs/dbraw/zinc/05/30/72/1379053072.db2.gz	ZLCQTWRLNOMOHY-UHFFFAOYSA-N	0	3	339.483	3.193	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC2(C1)CCN(Cc1cccnc1C)C2	ZINC001148146485	1379124841	/nfs/dbraw/zinc/12/48/41/1379124841.db2.gz	DTDSDFKRKWITHC-MRXNPFEDSA-N	0	3	327.472	3.027	20	30		EGEDHN
C=CCCCC(=O)N1CC2(C1)CCN(Cc1cccc(OC)c1)C2	ZINC001148193736	1379131430	/nfs/dbraw/zinc/13/14/30/1379131430.db2.gz	GSKSIABYGXDDAG-UHFFFAOYSA-N	0	3	328.456	3.086	20	30		EGEDHN
CCCCCCCCC(=O)NCCNC[C@@H](O)c1ccccc1F	ZINC001148728052	1379254872	/nfs/dbraw/zinc/25/48/72/1379254872.db2.gz	SWQRCZZGHWPJQA-GOSISDBHSA-N	0	3	338.467	3.316	20	30		EGEDHN
CCCCCCCCCCC(=O)NCCN[C@H](CCCC)C(N)=O	ZINC001148751624	1379260594	/nfs/dbraw/zinc/26/05/94/1379260594.db2.gz	ORYUKFAIHBTSKH-QGZVFWFLSA-N	0	3	341.540	3.267	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cccc(C(F)(F)F)c2)cc1	ZINC001148796653	1379270248	/nfs/dbraw/zinc/27/02/48/1379270248.db2.gz	XJYKTFZSHJNCQP-UHFFFAOYSA-N	0	3	347.340	3.097	20	30		EGEDHN
C#CCCCCC(=O)NC[C@H]1CN([C@H](C)c2ccccc2)CCCO1	ZINC001149580826	1379407124	/nfs/dbraw/zinc/40/71/24/1379407124.db2.gz	YJBWXHDBWRZKEP-QUCCMNQESA-N	0	3	342.483	3.148	20	30		EGEDHN
C[C@H]1CCN(Cc2ccccc2)C[C@H]1NC(=O)Cc1cccc(C#N)c1	ZINC001150143985	1379503055	/nfs/dbraw/zinc/50/30/55/1379503055.db2.gz	WAAAUGCPFYIWRY-LAUBAEHRSA-N	0	3	347.462	3.128	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)CCCCc2ccccc2)C1	ZINC001150202255	1379513956	/nfs/dbraw/zinc/51/39/56/1379513956.db2.gz	CZMPULIGGOLKHD-FQEVSTJZSA-N	0	3	344.499	3.183	20	30		EGEDHN
C=CCCCC(=O)NC[C@H]1CN(Cc2ccc(C)c(C)c2)CCCO1	ZINC001150203614	1379514609	/nfs/dbraw/zinc/51/46/09/1379514609.db2.gz	UOTZSJUPEWQGIT-FQEVSTJZSA-N	0	3	344.499	3.367	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@H]2CN([C@@H](C)c3ccccc3)CCCO2)C1	ZINC001150293336	1379529851	/nfs/dbraw/zinc/52/98/51/1379529851.db2.gz	YBTFVSWKHUWVOU-HKUYNNGSSA-N	0	3	342.483	3.311	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ncc(Cc3ccccc3)o2)CC1	ZINC001327901600	1388619140	/nfs/dbraw/zinc/61/91/40/1388619140.db2.gz	OVKMPDKPIOPBSP-UHFFFAOYSA-N	0	3	339.439	3.036	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2ccc(F)cc2)CC1	ZINC001150895781	1379628797	/nfs/dbraw/zinc/62/87/97/1379628797.db2.gz	JVENRKIOLMZTMQ-UHFFFAOYSA-N	0	3	334.435	3.003	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2ccccc2C)CC1	ZINC001150919087	1379632234	/nfs/dbraw/zinc/63/22/34/1379632234.db2.gz	ZFCJFBSIVCFYMZ-UHFFFAOYSA-N	0	3	330.472	3.172	20	30		EGEDHN
Cc1cc(C)cc(C2(C(=O)NCCNCc3cccc(C#N)c3)CC2)c1	ZINC001151250655	1379688594	/nfs/dbraw/zinc/68/85/94/1379688594.db2.gz	IRHJXOXLRCUGNX-UHFFFAOYSA-N	0	3	347.462	3.113	20	30		EGEDHN
C=CC[C@H](C(=O)NCCNCc1cccc(C#N)c1)c1ccccc1	ZINC001151838498	1379795440	/nfs/dbraw/zinc/79/54/40/1379795440.db2.gz	UNCWCWVKZZGIQY-FQEVSTJZSA-N	0	3	333.435	3.124	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)c1cc(Cl)c[nH]1	ZINC001151841678	1379796419	/nfs/dbraw/zinc/79/64/19/1379796419.db2.gz	QILRBEDHNZQQBG-CYBMUJFWSA-N	0	3	344.846	3.180	20	30		EGEDHN
CC(C)(C)c1ccc(C(=O)NCCNCc2cccc(C#N)c2)s1	ZINC001151946996	1379823276	/nfs/dbraw/zinc/82/32/76/1379823276.db2.gz	QGLLERZLQHSWHT-UHFFFAOYSA-N	0	3	341.480	3.437	20	30		EGEDHN
C=CCC1(C(=O)NCCNCc2cccc([N+](=O)[O-])c2)CCCCC1	ZINC001152011163	1379838821	/nfs/dbraw/zinc/83/88/21/1379838821.db2.gz	ZCXWOYOKHNUULJ-UHFFFAOYSA-N	0	3	345.443	3.327	20	30		EGEDHN
Cc1ccccc1[C@H](C)C(=O)NCCNCc1ccc(C#N)c(F)c1	ZINC001152017566	1379841245	/nfs/dbraw/zinc/84/12/45/1379841245.db2.gz	NZFCWUATGKDUTN-HNNXBMFYSA-N	0	3	339.414	3.015	20	30		EGEDHN
C[C@H](CC(=O)NCCNCc1ccc(C#N)s1)c1ccc(F)cc1	ZINC001152115195	1379864726	/nfs/dbraw/zinc/86/47/26/1379864726.db2.gz	GPBVLUASENRBEJ-CYBMUJFWSA-N	0	3	345.443	3.158	20	30		EGEDHN
CC/C=C(\C)C(=O)NC[C@@H](C)N(CC)Cc1ccc(F)c(C#N)c1	ZINC001152188681	1379881391	/nfs/dbraw/zinc/88/13/91/1379881391.db2.gz	MWOUDOLQKQOBDS-KEQVLUGWSA-N	0	3	331.435	3.380	20	30		EGEDHN
CC/C=C(/C)C(=O)NC[C@@H](C)N(CC)Cc1ccc(F)c(C#N)c1	ZINC001152188682	1379881840	/nfs/dbraw/zinc/88/18/40/1379881840.db2.gz	MWOUDOLQKQOBDS-XIEDVDOYSA-N	0	3	331.435	3.380	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC[C@@H](C)N(CC)Cc1cccc(F)c1	ZINC001152235090	1379892238	/nfs/dbraw/zinc/89/22/38/1379892238.db2.gz	UBPJMJIZEAKWSJ-CVEARBPZSA-N	0	3	336.451	3.134	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCNCc2ccccc2OC(F)F)c1	ZINC001327975535	1388637257	/nfs/dbraw/zinc/63/72/57/1388637257.db2.gz	KNGMVSMMKAEIMX-UHFFFAOYSA-N	0	3	345.349	3.278	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)c(F)c1	ZINC001152867459	1379988043	/nfs/dbraw/zinc/98/80/43/1379988043.db2.gz	VCEFXGBRFJABRC-MRXNPFEDSA-N	0	3	343.446	3.218	20	30		EGEDHN
CC(C)(C)C12CC(C(=O)NCCNCc3ccc(C#N)s3)(C1)C2	ZINC001152969755	1380001004	/nfs/dbraw/zinc/00/10/04/1380001004.db2.gz	GYLUSCHJLAUZSN-UHFFFAOYSA-N	0	3	331.485	3.042	20	30		EGEDHN
C#CCC1(C(=O)NCCNCc2cc(F)cc(F)c2)CCCCC1	ZINC001153009161	1380007176	/nfs/dbraw/zinc/00/71/76/1380007176.db2.gz	IDTJEWPBSQKPTQ-UHFFFAOYSA-N	0	3	334.410	3.144	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NCCN[C@H](C)c1ccc(Cl)c(Cl)c1	ZINC001153148527	1380027920	/nfs/dbraw/zinc/02/79/20/1380027920.db2.gz	FTPVTYBDYMRPJL-VXGBXAGGSA-N	0	3	345.270	3.351	20	30		EGEDHN
CC/C(C)=C/C(=O)NC[C@@H](C)N(CC)Cc1ccc(F)c(C#N)c1	ZINC001153181760	1380031803	/nfs/dbraw/zinc/03/18/03/1380031803.db2.gz	VVHGQBNYYYDCHP-AAWPKVBNSA-N	0	3	331.435	3.380	20	30		EGEDHN
CCN(Cc1ccc(Cl)c(F)c1)[C@H](C)CNC(=O)C#CC(C)C	ZINC001153207627	1380035600	/nfs/dbraw/zinc/03/56/00/1380035600.db2.gz	MVYCLZCPKVVUMA-CQSZACIVSA-N	0	3	338.854	3.465	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)C(C)=C1CCC1	ZINC001153252820	1380044873	/nfs/dbraw/zinc/04/48/73/1380044873.db2.gz	KZVANNFYJFRHCX-OAHLLOKOSA-N	0	3	325.456	3.385	20	30		EGEDHN
CCN(Cc1ccc(F)c(F)c1)[C@H](C)CNC(=O)C#CC(C)(C)C	ZINC001153266556	1380046998	/nfs/dbraw/zinc/04/69/98/1380046998.db2.gz	UVUHUHAJEQPMIT-CQSZACIVSA-N	0	3	336.426	3.341	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H](C)N(CC)Cc1ccc(F)c(C#N)c1	ZINC001153642250	1380109117	/nfs/dbraw/zinc/10/91/17/1380109117.db2.gz	SMBZNVJKOGPKCT-OAHLLOKOSA-N	0	3	331.435	3.380	20	30		EGEDHN
C=CCC[C@H](C(=O)NCCNCc1cnc(C)s1)c1ccccc1	ZINC001153817523	1380135558	/nfs/dbraw/zinc/13/55/58/1380135558.db2.gz	QBBJMQCHLCWFIU-SFHVURJKSA-N	0	3	343.496	3.407	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)CCC(F)F	ZINC001154332061	1380257186	/nfs/dbraw/zinc/25/71/86/1380257186.db2.gz	CSLCARFFAUEZFT-GFCCVEGCSA-N	0	3	341.377	3.069	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)cc1	ZINC001154609510	1380315637	/nfs/dbraw/zinc/31/56/37/1380315637.db2.gz	JZJJWCFABDESEF-GOSISDBHSA-N	0	3	339.483	3.469	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)[C@@]1(C)C=CCC1	ZINC001154683028	1380331326	/nfs/dbraw/zinc/33/13/26/1380331326.db2.gz	TVTRLNDJIDNRGX-QRWLVFNGSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H](C)N(CC)CCc2ccns2)CC1	ZINC001155028164	1380394499	/nfs/dbraw/zinc/39/44/99/1380394499.db2.gz	PPFWIWCGLPFYGI-OAHLLOKOSA-N	0	3	335.517	3.259	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@@H](C)N(CC)CCc1csc(C)n1	ZINC001155067381	1380402530	/nfs/dbraw/zinc/40/25/30/1380402530.db2.gz	YKBUBAIOHXBMBE-KDOFPFPSSA-N	0	3	337.533	3.423	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)c1occc1Cl	ZINC001155085778	1380406027	/nfs/dbraw/zinc/40/60/27/1380406027.db2.gz	RZTNZGVGLRJZIA-CYBMUJFWSA-N	0	3	345.830	3.445	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)CCc1cc(Cl)cs1	ZINC001155514903	1380463119	/nfs/dbraw/zinc/46/31/19/1380463119.db2.gz	RBXGMTBBTXKCAB-CYBMUJFWSA-N	0	3	326.893	3.184	20	30		EGEDHN
CCN(CC#CCOC)[C@H](C)CNC(=O)C[C@@H]1CCCC(C)(C)C1	ZINC001156390058	1380569957	/nfs/dbraw/zinc/56/99/57/1380569957.db2.gz	GDBUWFIHUWYSGF-MSOLQXFVSA-N	0	3	336.520	3.069	20	30		EGEDHN
CC(C(=O)NCCCNCc1ccc(C#N)cc1F)=C1CCCC1	ZINC001156429889	1380575188	/nfs/dbraw/zinc/57/51/88/1380575188.db2.gz	JAXPJQIOYMDVGD-UHFFFAOYSA-N	0	3	329.419	3.184	20	30		EGEDHN
CCCCC[C@](C)(CC)C(=O)NC[C@@H](C)N(CC)CC#CCOC	ZINC001157171433	1380793612	/nfs/dbraw/zinc/79/36/12/1380793612.db2.gz	GWHOSEUSCLAHHJ-QUCCMNQESA-N	0	3	338.536	3.459	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1ccc(C(F)(F)F)s1	ZINC001157229095	1380818655	/nfs/dbraw/zinc/81/86/55/1380818655.db2.gz	KGBTUXCEOVXHDY-LLVKDONJSA-N	0	3	332.391	3.230	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C1(C(F)(F)F)CCCCC1	ZINC001157307925	1380838116	/nfs/dbraw/zinc/83/81/16/1380838116.db2.gz	XPQWHIJVKQJGGP-CQSZACIVSA-N	0	3	332.410	3.349	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C1CC(c2cccc(F)c2)C1	ZINC001157320666	1380842299	/nfs/dbraw/zinc/84/22/99/1380842299.db2.gz	WLOWZNFNRCGFLH-FAEJEUNOSA-N	0	3	330.447	3.169	20	30		EGEDHN
C=CCOCC(=O)N1CCCC[C@@H]1CN(C)C/C=C\c1ccccc1	ZINC001157701422	1381007817	/nfs/dbraw/zinc/00/78/17/1381007817.db2.gz	FOALVQDNSWJXIK-FNUUXAGOSA-N	0	3	342.483	3.215	20	30		EGEDHN
Cc1ccc2sc(CNCCCNC(=O)C#CC(C)(C)C)nc2c1	ZINC001157726924	1381016182	/nfs/dbraw/zinc/01/61/82/1381016182.db2.gz	ANZLXSWQEHWUEW-UHFFFAOYSA-N	0	3	343.496	3.250	20	30		EGEDHN
N#Cc1ccc(-c2ccncc2)nc1N1CCN[C@H](c2ccccc2)C1	ZINC001157764805	1381027341	/nfs/dbraw/zinc/02/73/41/1381027341.db2.gz	GQGOUSJSEAGKGJ-FQEVSTJZSA-N	0	3	341.418	3.166	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2CCCC[C@@H]2CN(C)CC=C)cc1	ZINC001158142741	1381139164	/nfs/dbraw/zinc/13/91/64/1381139164.db2.gz	XHCCOVQCHKCGFU-GOSISDBHSA-N	0	3	328.456	3.364	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)CCc1ccc(N(C)C)cc1	ZINC001158200270	1381157215	/nfs/dbraw/zinc/15/72/15/1381157215.db2.gz	WEBBFFBCPOAMGR-HXUWFJFHSA-N	0	3	343.515	3.184	20	30		EGEDHN
C#CCCCCCC(=O)N1CCCC[C@@H]1CN(C)C[C@@H]1CCCCO1	ZINC001158316223	1381197591	/nfs/dbraw/zinc/19/75/91/1381197591.db2.gz	DIQPGZVHUZTRQV-UXHICEINSA-N	0	3	348.531	3.452	20	30		EGEDHN
C=CCCCC(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(CO)cc1	ZINC001158418865	1381239358	/nfs/dbraw/zinc/23/93/58/1381239358.db2.gz	BVTVHZYUWRIOMZ-HXUWFJFHSA-N	0	3	344.499	3.348	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccnc(O[C@@H](C)CC)c1	ZINC001158723715	1381368804	/nfs/dbraw/zinc/36/88/04/1381368804.db2.gz	GGPUMVQYHYXGGB-FUHWJXTLSA-N	0	3	345.487	3.371	20	30		EGEDHN
C=C(C)CCC(=O)NCCCNCc1cscc1Br	ZINC001159032557	1381524383	/nfs/dbraw/zinc/52/43/83/1381524383.db2.gz	KRVNFWHHMKTOPC-UHFFFAOYSA-N	0	3	345.306	3.463	20	30		EGEDHN
C#CCC1(C(=O)NCCCNCc2cc(Cl)ccc2F)CCC1	ZINC001159637942	1381856535	/nfs/dbraw/zinc/85/65/35/1381856535.db2.gz	BCMKVYJJYIWSOQ-UHFFFAOYSA-N	0	3	336.838	3.269	20	30		EGEDHN
N#Cc1ccc(CN2CC=C(CCNC(=O)/C=C/C3CC3)CC2)cc1	ZINC001159685905	1381866340	/nfs/dbraw/zinc/86/63/40/1381866340.db2.gz	JUDDSEGSPUOUJD-BQYQJAHWSA-N	0	3	335.451	3.163	20	30		EGEDHN
C[C@H]1CC(=O)C=C(Nc2ccc(Br)c3c2CNCC3)C1	ZINC001159942184	1381943821	/nfs/dbraw/zinc/94/38/21/1381943821.db2.gz	WFHQGKFQWPQYSV-SNVBAGLBSA-N	0	3	335.245	3.390	20	30		EGEDHN
C=CCn1cccc1C(=O)NCCCN[C@@H](C)c1cc(F)ccc1F	ZINC001159988351	1381961103	/nfs/dbraw/zinc/96/11/03/1381961103.db2.gz	XMBQMWKLULBFOC-AWEZNQCLSA-N	0	3	347.409	3.423	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cccc(OCCC)c2)CC1	ZINC001160279554	1382059995	/nfs/dbraw/zinc/05/99/95/1382059995.db2.gz	VIQCDAMEAUFVFA-UHFFFAOYSA-N	0	3	328.456	3.413	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C2(c3ccc(F)cc3)CC2)CC1	ZINC001160296400	1382065222	/nfs/dbraw/zinc/06/52/22/1382065222.db2.gz	LZSGFDXBFJOZME-UHFFFAOYSA-N	0	3	340.442	3.019	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@]2(C)[C@H]3Cc4ccccc4[C@H]32)CC1	ZINC001160550438	1382139282	/nfs/dbraw/zinc/13/92/82/1382139282.db2.gz	BMIYAOWYPACLCC-TUNNFDKTSA-N	0	3	336.479	3.287	20	30		EGEDHN
C#CCCCCCC(=O)NCCC1=CCN(CCOCC2CC2)CC1	ZINC001160915254	1382232691	/nfs/dbraw/zinc/23/26/91/1382232691.db2.gz	QFOMIZKLGRJBPB-UHFFFAOYSA-N	0	3	346.515	3.135	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCC1=CCN(CCOCC(C)C)CC1	ZINC001161116204	1382303955	/nfs/dbraw/zinc/30/39/55/1382303955.db2.gz	BFTPXLWHLSLHHM-HXUWFJFHSA-N	0	3	336.520	3.400	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H](C)Cc2ccccc2F)CC1	ZINC001161200923	1382339825	/nfs/dbraw/zinc/33/98/25/1382339825.db2.gz	YDQKBVNYMDQMPJ-MRXNPFEDSA-N	0	3	330.447	3.329	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc(F)cc(Cl)c2)CC1	ZINC001161328051	1382372439	/nfs/dbraw/zinc/37/24/39/1382372439.db2.gz	HLNMZDVULCDHAO-UHFFFAOYSA-N	0	3	334.822	3.254	20	30		EGEDHN
N#Cc1ccc(CN2CC=C(CCNC(=O)[C@@H]3CC34CCC4)CC2)cc1	ZINC001161349980	1382378439	/nfs/dbraw/zinc/37/84/39/1382378439.db2.gz	XHZHUAGBYJEVEZ-FQEVSTJZSA-N	0	3	349.478	3.387	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc(F)cc3cccnc32)CC1	ZINC001161383214	1382391948	/nfs/dbraw/zinc/39/19/48/1382391948.db2.gz	MLSZUYVAWKKJDD-UHFFFAOYSA-N	0	3	339.414	3.312	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc(C(CC)CC)no2)CC1	ZINC001161427655	1382406842	/nfs/dbraw/zinc/40/68/42/1382406842.db2.gz	MGCASEASTFKKGX-UHFFFAOYSA-N	0	3	343.471	3.354	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc(C(C)C)oc2C)CC1	ZINC001161623038	1382463392	/nfs/dbraw/zinc/46/33/92/1382463392.db2.gz	YOVQSJTWGWCUEB-UHFFFAOYSA-N	0	3	328.456	3.487	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cnn(C(CC)CC)c2C)CC1	ZINC001161678795	1382478486	/nfs/dbraw/zinc/47/84/86/1382478486.db2.gz	NCHHPKQTELBEMC-UHFFFAOYSA-N	0	3	344.503	3.491	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc(OCC3CC3)cc2)CC1	ZINC001161893508	1382543236	/nfs/dbraw/zinc/54/32/36/1382543236.db2.gz	JQYDODCHKSDSLN-UHFFFAOYSA-N	0	3	340.467	3.413	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cccc3c2OCC3(C)C)CC1	ZINC001162017159	1382602331	/nfs/dbraw/zinc/60/23/31/1382602331.db2.gz	XEGSNICKFLYEPZ-UHFFFAOYSA-N	0	3	340.467	3.295	20	30		EGEDHN
Cc1ccc(C(=O)NCCCNCc2ccc(C#N)cc2F)cc1F	ZINC001162075777	1382620783	/nfs/dbraw/zinc/62/07/83/1382620783.db2.gz	QNFXQLRFNFHTBP-UHFFFAOYSA-N	0	3	343.377	3.055	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCC1(COC)CCN(C[C@@H](F)CC)CC1	ZINC001162288121	1382722581	/nfs/dbraw/zinc/72/25/81/1382722581.db2.gz	INDHSWKQSQTPQX-INIZCTEOSA-N	0	3	342.499	3.182	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)C2(CC)CCCCC2)(COC)CC1	ZINC001162617666	1382811278	/nfs/dbraw/zinc/81/12/78/1382811278.db2.gz	NEVCQOXJVHIVPU-UHFFFAOYSA-N	0	3	348.531	3.215	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)[C@H]1CCc2c1cccc2Cl	ZINC001162658416	1382824487	/nfs/dbraw/zinc/82/44/87/1382824487.db2.gz	VICHREXFDYQHBU-AWEZNQCLSA-N	0	3	327.255	3.218	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C(F)=C1CCCC1	ZINC001162769487	1382866311	/nfs/dbraw/zinc/86/63/11/1382866311.db2.gz	LOXLSJPMXWXGKB-UHFFFAOYSA-N	0	3	328.431	3.078	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C[C@H]1CCC[C@H]1C	ZINC001162822383	1382886681	/nfs/dbraw/zinc/88/66/81/1382886681.db2.gz	NJQHYKGIBHWENK-TZIWHRDSSA-N	0	3	340.511	3.497	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)N(CCNCC#CC)CCc1ccccc1	ZINC001162892046	1382906751	/nfs/dbraw/zinc/90/67/51/1382906751.db2.gz	FIAJZQMEDMUTTJ-RTBURBONSA-N	0	3	326.484	3.129	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N(CCNCC#CC)CCc1ccccc1	ZINC001162897624	1382908550	/nfs/dbraw/zinc/90/85/50/1382908550.db2.gz	DPNUVDIJQMFVMK-IBGZPJMESA-N	0	3	326.484	3.273	20	30		EGEDHN
COC(=O)c1ccc(N)c(NC(=N)c2ccc(C(F)(F)F)cc2)c1	ZINC001163680965	1383104772	/nfs/dbraw/zinc/10/47/72/1383104772.db2.gz	ZUJAYBJTPJOYJX-UHFFFAOYSA-N	0	3	337.301	3.111	20	30		EGEDHN
N=C(Nc1ccc2c(c1)OCC(=O)N2)c1ccc(C(F)(F)F)cc1	ZINC001163683775	1383105307	/nfs/dbraw/zinc/10/53/07/1383105307.db2.gz	HYIAZBBZYOIUHX-UHFFFAOYSA-N	0	3	335.285	3.073	20	30		EGEDHN
C[C@@H]1CC[C@@H](CC(=O)NCCCNCc2cc(C#N)ccc2F)C1	ZINC001164188066	1383164354	/nfs/dbraw/zinc/16/43/54/1383164354.db2.gz	RAYFFWGQUYXOAL-HUUCEWRRSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCCNCc1nc(C(C)(C)C)cs1	ZINC001164233637	1383169385	/nfs/dbraw/zinc/16/93/85/1383169385.db2.gz	INOGXOGGDCYZOW-KGLIPLIRSA-N	0	3	337.533	3.495	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)CCO[C@@H](C)CC(C)C)CC1	ZINC001164519924	1383195487	/nfs/dbraw/zinc/19/54/87/1383195487.db2.gz	WRSPTRNQIUWYTC-INIZCTEOSA-N	0	3	344.927	3.456	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc3oc(C)nc3c2)CC1	ZINC001165669391	1383322385	/nfs/dbraw/zinc/32/23/85/1383322385.db2.gz	KAZIRRUBYCUXHG-UHFFFAOYSA-N	0	3	347.846	3.378	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCC1(CNCc2conc2CC)CC1	ZINC001166694685	1383462318	/nfs/dbraw/zinc/46/23/18/1383462318.db2.gz	OBWDAGRQFBCWBF-HUUCEWRRSA-N	0	3	333.476	3.071	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCCC1(CNCc2cccnc2OC)CC1	ZINC001166746535	1383470412	/nfs/dbraw/zinc/47/04/12/1383470412.db2.gz	GRGQMKVNAIVBQT-INIZCTEOSA-N	0	3	345.487	3.069	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc3c(c2)[C@@H](C)CO3)CC1	ZINC001166765179	1383474489	/nfs/dbraw/zinc/47/44/89/1383474489.db2.gz	HHROWJPOYZRQRL-ZDUSSCGKSA-N	0	3	348.874	3.425	20	30		EGEDHN
C=CCCC1(C(=O)NCCC2(CNCc3ccccn3)CC2)CC1	ZINC001167029838	1383523270	/nfs/dbraw/zinc/52/32/70/1383523270.db2.gz	KSQOWZJOIWMHAO-UHFFFAOYSA-N	0	3	327.472	3.204	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@H](C)c2cccs2)CC1	ZINC001167200953	1383565417	/nfs/dbraw/zinc/56/54/17/1383565417.db2.gz	OGLWNVDDIFJXLX-CYBMUJFWSA-N	0	3	326.893	3.480	20	30		EGEDHN
CSc1nc(N[C@H]2CCN(C)C2)c(C#N)c(-c2ccc(C)cc2)n1	ZINC001167270202	1383580934	/nfs/dbraw/zinc/58/09/34/1383580934.db2.gz	NMSZXFVUZCONRH-AWEZNQCLSA-N	0	3	339.468	3.162	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)CC1CCCCCC1	ZINC001167357310	1383608703	/nfs/dbraw/zinc/60/87/03/1383608703.db2.gz	POQBXMJCOXTZFL-UHFFFAOYSA-N	0	3	331.298	3.351	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)[C@@H]2CC[C@H](C)C2)CC1	ZINC001167376672	1383615093	/nfs/dbraw/zinc/61/50/93/1383615093.db2.gz	DSTYMNCVKPCJGZ-GXTWGEPZSA-N	0	3	343.309	3.207	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cccc(OC)c2F)CC1	ZINC001167514986	1383656166	/nfs/dbraw/zinc/65/61/66/1383656166.db2.gz	PWAFJKXZKJYEPZ-UHFFFAOYSA-N	0	3	340.826	3.077	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@H]2CCO[C@@H](C(C)C)C2)CC1	ZINC001167652357	1383699177	/nfs/dbraw/zinc/69/91/77/1383699177.db2.gz	YFMCYOYFPKAUBB-JKSUJKDBSA-N	0	3	342.911	3.066	20	30		EGEDHN
Cc1cccc([C@@H]2C[C@H]2C(=O)NCCCNCc2ccccc2C#N)c1	ZINC001168059942	1383806736	/nfs/dbraw/zinc/80/67/36/1383806736.db2.gz	APCZEEGAEXNHPW-LEWJYISDSA-N	0	3	347.462	3.266	20	30		EGEDHN
C=CC1(CC(=O)NCCCN[C@@H](C)c2cnccn2)CCCCC1	ZINC001168182561	1383836759	/nfs/dbraw/zinc/83/67/59/1383836759.db2.gz	FGQFWKQKDIZATC-INIZCTEOSA-N	0	3	330.476	3.160	20	30		EGEDHN
Cc1cc(NC[C@@H](c2cccc(C(F)(F)F)c2)N(C)C)c(C#N)cn1	ZINC001307102094	1383940201	/nfs/dbraw/zinc/94/02/01/1383940201.db2.gz	ABOFFKAKTPYFEU-KRWDZBQOSA-N	0	3	348.372	3.417	20	30		EGEDHN
C[C@@H](CCCCNCc1cc(F)ccc1C#N)NC(=O)CC1CC1	ZINC001168739607	1383986986	/nfs/dbraw/zinc/98/69/86/1383986986.db2.gz	QDMBODXCTHIIFX-AWEZNQCLSA-N	0	3	331.435	3.262	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)[C@H]2C[C@H]2C2CCCC2)c1	ZINC001169681770	1384173112	/nfs/dbraw/zinc/17/31/12/1384173112.db2.gz	RWCQNYAKYAYVIG-ROUUACIJSA-N	0	3	343.446	3.120	20	30		EGEDHN
CCC(CC)n1ccc(CNCCCC[C@@H](C)NC(=O)[C@H](C)C#N)n1	ZINC001169849449	1384191028	/nfs/dbraw/zinc/19/10/28/1384191028.db2.gz	WQCDPVAWSULHAJ-HZPDHXFCSA-N	0	3	347.507	3.168	20	30		EGEDHN
CC(C)CC(C)(C)C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001170556035	1384341153	/nfs/dbraw/zinc/34/11/53/1384341153.db2.gz	MGQSZDDMZCINME-UHFFFAOYSA-N	0	3	333.451	3.366	20	30		EGEDHN
C[C@@H](CCCCNCc1csc(C2CC2)n1)NC(=O)C#CC1CC1	ZINC001170674709	1384362288	/nfs/dbraw/zinc/36/22/88/1384362288.db2.gz	RVCPVHBBPVSSMA-AWEZNQCLSA-N	0	3	345.512	3.199	20	30		EGEDHN
C[C@@H](C(=O)NCCCNCc1ccc(C#N)cc1F)C1CCCC1	ZINC001170755609	1384380603	/nfs/dbraw/zinc/38/06/03/1384380603.db2.gz	HJBTUDZVXWUCRX-CQSZACIVSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H](C)CCCCNCc1nnc(C(C)C)n1C	ZINC001171034674	1384433528	/nfs/dbraw/zinc/43/35/28/1384433528.db2.gz	BRDKXDFXCUHOOU-MRXNPFEDSA-N	0	3	349.523	3.059	20	30		EGEDHN
C[C@@H](Cc1cccc(C#N)c1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC001171220736	1384472236	/nfs/dbraw/zinc/47/22/36/1384472236.db2.gz	BMGQTCSBCPHCJD-SFHVURJKSA-N	0	3	331.463	3.307	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1C[C@H]2CN(C(=O)OC(C)(C)C)[C@@H]2C1	ZINC001171232461	1384475429	/nfs/dbraw/zinc/47/54/29/1384475429.db2.gz	STKVSKJSEDFSJZ-FHLIZLRMSA-N	0	3	341.455	3.040	20	30		EGEDHN
CCc1cc(C)c(C(=O)NCCCNCc2cc(C#N)ccc2F)o1	ZINC001171278735	1384483828	/nfs/dbraw/zinc/48/38/28/1384483828.db2.gz	KFMYVVMQZHBTSQ-UHFFFAOYSA-N	0	3	343.402	3.071	20	30		EGEDHN
CC[C@@H](N[C@H]1CC(=O)N(C(=O)OC(C)(C)C)C1)c1cccc(C#N)c1	ZINC001171694275	1384604376	/nfs/dbraw/zinc/60/43/76/1384604376.db2.gz	OAUQJIGPENZNMM-JKSUJKDBSA-N	0	3	343.427	3.135	20	30		EGEDHN
CCCCCCCCC(=O)NCCCNCc1cc2n(n1)CCC2	ZINC001171818565	1384650279	/nfs/dbraw/zinc/65/02/79/1384650279.db2.gz	QIDHYPMSNFUGAE-UHFFFAOYSA-N	0	3	334.508	3.176	20	30		EGEDHN
CCOC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1[C@H](C)Cc1ccc(C#N)cc1	ZINC001172311761	1384766029	/nfs/dbraw/zinc/76/60/29/1384766029.db2.gz	XOSBXCSIOKMQIF-FCLVOEFKSA-N	0	3	326.440	3.153	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)N1CC(CN(C)C(=O)OC(C)(C)C)C1	ZINC001172315042	1384768290	/nfs/dbraw/zinc/76/82/90/1384768290.db2.gz	NENAKQVVOUTXOP-HNNXBMFYSA-N	0	3	343.471	3.288	20	30		EGEDHN
Cc1cc(C(=O)NC[C@@H](NCc2ccc(C#N)s2)C2CC2)oc1C	ZINC001317016299	1384780786	/nfs/dbraw/zinc/78/07/86/1384780786.db2.gz	XQAMLVPEISICRQ-MRXNPFEDSA-N	0	3	343.452	3.128	20	30		EGEDHN
CC[C@@H](C)CCC(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001317090703	1384851896	/nfs/dbraw/zinc/85/18/96/1384851896.db2.gz	TWHUUGOHRMEBQY-KBRIMQKVSA-N	0	3	331.435	3.260	20	30		EGEDHN
C[C@@H](N[C@H]1CCN(C(=O)OC(C)(C)C)[C@H](C#N)C1)c1ccncc1	ZINC001172967660	1384892201	/nfs/dbraw/zinc/89/22/01/1384892201.db2.gz	ZHLUJXZKBDJHEU-KBMXLJTQSA-N	0	3	330.432	3.024	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H](N2CCC(C)(F)CC2)C[C@H]1C#N	ZINC001172980698	1384894622	/nfs/dbraw/zinc/89/46/22/1384894622.db2.gz	OWCIMESGCLZBMC-KGLIPLIRSA-N	0	3	325.428	3.102	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H](N2CCC[C@H](C(F)F)C2)C[C@H]1C#N	ZINC001172983845	1384895476	/nfs/dbraw/zinc/89/54/76/1384895476.db2.gz	HOOOVVXQNHYJOL-MJBXVCDLSA-N	0	3	343.418	3.255	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H](N2CC[C@@]3(CC3(F)F)C2)C[C@H]1C#N	ZINC001172985375	1384895537	/nfs/dbraw/zinc/89/55/37/1384895537.db2.gz	PIZZEHNHDVSSKQ-DVOMOZLQSA-N	0	3	341.402	3.009	20	30		EGEDHN
C=CCOC[C@H]1CCC[C@@]12CN([C@@H]1CCc3ncsc3C1)CCO2	ZINC001173137141	1384921502	/nfs/dbraw/zinc/92/15/02/1384921502.db2.gz	JDCSHBCLGILLJK-GPMSIDNRSA-N	0	3	348.512	3.074	20	30		EGEDHN
C[N@H+](Cc1ccccc1[O-])C1CCN(C(=O)c2ccc(C#N)cc2)CC1	ZINC001173435197	1384969868	/nfs/dbraw/zinc/96/98/68/1384969868.db2.gz	YNSJLFCBXJHDLZ-UHFFFAOYSA-N	0	3	349.434	3.000	20	30		EGEDHN
C[N@@H+](Cc1ccccc1[O-])C1CCN(C(=O)c2ccc(C#N)cc2)CC1	ZINC001173435197	1384969871	/nfs/dbraw/zinc/96/98/71/1384969871.db2.gz	YNSJLFCBXJHDLZ-UHFFFAOYSA-N	0	3	349.434	3.000	20	30		EGEDHN
C=CCN1C(=O)CCC12CCN(C1Cc3cc(F)c(F)cc3C1)CC2	ZINC001173478648	1384977578	/nfs/dbraw/zinc/97/75/78/1384977578.db2.gz	RFHJQFVVWPAUNZ-UHFFFAOYSA-N	0	3	346.421	3.075	20	30		EGEDHN
C[C@@H](CNC(=O)c1cc(C#N)c[nH]1)N[C@@H](C)c1ccc(F)c(Cl)c1	ZINC001317230745	1385009113	/nfs/dbraw/zinc/00/91/13/1385009113.db2.gz	BRYDWLGPLPJOQL-QWRGUYRKSA-N	0	3	348.809	3.148	20	30		EGEDHN
CN1CCN(c2ccc(Nc3ccnc4ccccc43)cc2C#N)CC1	ZINC001174038224	1385048186	/nfs/dbraw/zinc/04/81/86/1385048186.db2.gz	KCXFVGMCAXLNHY-UHFFFAOYSA-N	0	3	343.434	3.024	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H](C)CCCCNCc1nccn1CC	ZINC001174649925	1385130318	/nfs/dbraw/zinc/13/03/18/1385130318.db2.gz	LMUOUSWQGXZLIS-MRXNPFEDSA-N	0	3	334.508	3.270	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H](C)CCCCNCc2cnns2)CC1	ZINC001175081619	1385191492	/nfs/dbraw/zinc/19/14/92/1385191492.db2.gz	HNRJLPYRNQFNRC-AWEZNQCLSA-N	0	3	336.505	3.049	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)CCCCNCc2cnns2)CCC1	ZINC001175098408	1385194364	/nfs/dbraw/zinc/19/43/64/1385194364.db2.gz	RVLKSGNKNPQGCW-CQSZACIVSA-N	0	3	336.505	3.049	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)CCCCN[C@@H](C)c2nnc(C)[nH]2)CCC1	ZINC001175097385	1385194403	/nfs/dbraw/zinc/19/44/03/1385194403.db2.gz	JHWLABDHNZHVJY-GJZGRUSLSA-N	0	3	347.507	3.185	20	30		EGEDHN
Cc1ccc(C(=O)NCCCNCc2cc(C#N)ccc2F)c(C)c1	ZINC001175105365	1385195587	/nfs/dbraw/zinc/19/55/87/1385195587.db2.gz	JMMVXGLMOAYAPM-UHFFFAOYSA-N	0	3	339.414	3.224	20	30		EGEDHN
CCCN(CCNC(=O)[C@@H]1CCC(F)(F)C1)Cc1cccc(C#N)c1	ZINC001317540827	1385277937	/nfs/dbraw/zinc/27/79/37/1385277937.db2.gz	MBEUWKCNNMLIEM-QGZVFWFLSA-N	0	3	349.425	3.322	20	30		EGEDHN
CCN1CCN(c2ccc(Nc3ccc(C#N)cc3C#N)cc2)CC1	ZINC001175783122	1385404298	/nfs/dbraw/zinc/40/42/98/1385404298.db2.gz	XTWBHKDMKXIHDC-UHFFFAOYSA-N	0	3	331.423	3.315	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)C(=O)NCCCNCc1cnoc1C	ZINC001176743926	1385679364	/nfs/dbraw/zinc/67/93/64/1385679364.db2.gz	FOZXFCKSISDAMY-GOSISDBHSA-N	0	3	341.455	3.014	20	30		EGEDHN
CC[C@@H](CNC(=O)c1ccc(CF)cc1)NCc1ccc(C#N)s1	ZINC001318607582	1385791695	/nfs/dbraw/zinc/79/16/95/1385791695.db2.gz	QGJDWUMIEPBXPY-HNNXBMFYSA-N	0	3	345.443	3.387	20	30		EGEDHN
C=C(Br)CNCC1(NC(=O)c2cccs2)CCCC1	ZINC001318612520	1385794676	/nfs/dbraw/zinc/79/46/76/1385794676.db2.gz	HJURVFHOMGBZES-UHFFFAOYSA-N	0	3	343.290	3.289	20	30		EGEDHN
C[C@H]1C[C@H](C(=O)NCCCNCc2ccc(C#N)cc2F)C[C@@H](C)C1	ZINC001177137068	1385828782	/nfs/dbraw/zinc/82/87/82/1385828782.db2.gz	XQNQLAZQVBVEMG-HWWDLCQESA-N	0	3	345.462	3.366	20	30		EGEDHN
Cc1ncc(CNCCCN(CC2CCCC2)C(=O)C#CC(C)C)o1	ZINC001177311807	1385908819	/nfs/dbraw/zinc/90/88/19/1385908819.db2.gz	MPFCRQJZGHBGKP-UHFFFAOYSA-N	0	3	345.487	3.141	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)C1(COC)CC1	ZINC001177362874	1385930185	/nfs/dbraw/zinc/93/01/85/1385930185.db2.gz	SVRTZHLRVDQOJJ-UHFFFAOYSA-N	0	3	342.911	3.164	20	30		EGEDHN
C=CCC1(C(=O)NCCCNCc2ccccc2C#N)CCCC1	ZINC001177552215	1385995139	/nfs/dbraw/zinc/99/51/39/1385995139.db2.gz	BFLFZBXUAVSBHW-UHFFFAOYSA-N	0	3	325.456	3.291	20	30		EGEDHN
CO[C@@H](C)CCC(=O)NCCCCCCNCc1ccccc1C#N	ZINC001178270885	1386177549	/nfs/dbraw/zinc/17/75/49/1386177549.db2.gz	UCBDNRYWJMQEJU-KRWDZBQOSA-N	0	3	345.487	3.140	20	30		EGEDHN
CC(C)[C@H](C)CC(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@@H]1C	ZINC001178307832	1386184810	/nfs/dbraw/zinc/18/48/10/1386184810.db2.gz	CEYVKRCYQGBOOB-UWVAXJGDSA-N	0	3	344.474	3.438	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)[C@@H]1C	ZINC001178375699	1386199821	/nfs/dbraw/zinc/19/98/21/1386199821.db2.gz	NYPCGKVYBFEURN-GLJUWKHASA-N	0	3	331.435	3.213	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](NCc2ccc(Cl)cc2OC)[C@@H]1C	ZINC001178581899	1386255826	/nfs/dbraw/zinc/25/58/26/1386255826.db2.gz	FXNQDVVGWSEFIB-YOEHRIQHSA-N	0	3	348.874	3.231	20	30		EGEDHN
C#CCOCCC(=O)N1CC[C@H](N[C@@H](C)c2ccccc2Cl)[C@@H]1C	ZINC001178689207	1386279277	/nfs/dbraw/zinc/27/92/77/1386279277.db2.gz	NRCVBXCBKVIVQJ-MPGHIAIKSA-N	0	3	348.874	3.020	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cnc(C2CC2)s1)C(C)C	ZINC001319957094	1386417818	/nfs/dbraw/zinc/41/78/18/1386417818.db2.gz	OIJQLXVYXBMZIJ-GFCCVEGCSA-N	0	3	327.881	3.117	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCCCCCNCc1cc(OC)no1	ZINC001179212145	1386424574	/nfs/dbraw/zinc/42/45/74/1386424574.db2.gz	FMMZWEKQRWCGDU-UHFFFAOYSA-N	0	3	337.464	3.052	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C	ZINC001179314719	1386448541	/nfs/dbraw/zinc/44/85/41/1386448541.db2.gz	ZPGIAGBCPKUJPG-FPOVZHCZSA-N	0	3	336.479	3.201	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCCCCCCNCc1cc2n(n1)CCC2	ZINC001179339952	1386456502	/nfs/dbraw/zinc/45/65/02/1386456502.db2.gz	QEHIKWLIZLFTKX-KRWDZBQOSA-N	0	3	346.519	3.198	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@H](NCc2cccc(OCC)n2)[C@@H]1C	ZINC001179384563	1386469963	/nfs/dbraw/zinc/46/99/63/1386469963.db2.gz	QFWCIVLDHYQRKF-BQFCYCMXSA-N	0	3	345.487	3.162	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](NCc2cc(C)ccc2OC)[C@@H]1C	ZINC001179391956	1386473169	/nfs/dbraw/zinc/47/31/69/1386473169.db2.gz	AEVQCXWHOLUKCM-HKUYNNGSSA-N	0	3	342.483	3.276	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCCCCCNCc1ccn(CC)n1	ZINC001179481322	1386493287	/nfs/dbraw/zinc/49/32/87/1386493287.db2.gz	CTTKMHBBEHCBOL-LJQANCHMSA-N	0	3	334.508	3.272	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCCCCCN[C@H](C)c1nnc(C)[nH]1	ZINC001179692090	1386555280	/nfs/dbraw/zinc/55/52/80/1386555280.db2.gz	AZGSFZKAQMSGPC-CQSZACIVSA-N	0	3	335.496	3.043	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1ccc2ccn(C)c2c1)C1CC1	ZINC001698653839	1406303886	/nfs/dbraw/zinc/30/38/86/1406303886.db2.gz	WKBSFWDXKCENHM-IBGZPJMESA-N	0	3	345.874	3.419	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2nc(C)c(C)s2)C1	ZINC001181271569	1386970431	/nfs/dbraw/zinc/97/04/31/1386970431.db2.gz	HMAVABKGWGVTQI-AUUYWEPGSA-N	0	3	347.528	3.138	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@@H](C)[C@](C)(CNC/C(Cl)=C\Cl)C1	ZINC001181460676	1386998193	/nfs/dbraw/zinc/99/81/93/1386998193.db2.gz	RDGRDBNPHJKLCZ-CIDQODBBSA-N	0	3	331.287	3.039	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@@H](C)[C@](C)(CNCc2cnc(C)o2)C1	ZINC001182313661	1387146142	/nfs/dbraw/zinc/14/61/42/1387146142.db2.gz	DZLJTLYBVJQANF-SIXWZSSISA-N	0	3	333.476	3.160	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)c1ccc(CF)cc1	ZINC001322307993	1387152777	/nfs/dbraw/zinc/15/27/77/1387152777.db2.gz	VBLUCZTUWMMIJE-HNNXBMFYSA-N	0	3	339.414	3.278	20	30		EGEDHN
C[C@@H](C(=O)N1CCN(CC2CCCCC2)CC1)c1ccc(C#N)cc1	ZINC001182790790	1387224944	/nfs/dbraw/zinc/22/49/44/1387224944.db2.gz	VCXZCMFWESICOK-QGZVFWFLSA-N	0	3	339.483	3.386	20	30		EGEDHN
N#CCn1c(-c2nc([C@@H]3CN4CCC3CC4)no2)cc2ccccc21	ZINC001337930179	1389486202	/nfs/dbraw/zinc/48/62/02/1389486202.db2.gz	UNUGRGOHWOXXST-OAHLLOKOSA-N	0	3	333.395	3.024	20	30		EGEDHN
Cc1sccc1C(=O)N(C)C[C@@H](C)NCc1ccc(F)c(C#N)c1	ZINC001331440828	1389749647	/nfs/dbraw/zinc/74/96/47/1389749647.db2.gz	IYWQVZGGRKRZDI-GFCCVEGCSA-N	0	3	345.443	3.318	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2ccc(C#N)cc2F)CN1Cc1ccccc1	ZINC001338902844	1389813554	/nfs/dbraw/zinc/81/35/54/1389813554.db2.gz	QAKBFLAJVOBILS-PBHICJAKSA-N	0	3	337.398	3.090	20	30		EGEDHN
C=CCn1c([C@@H](C)CCC#N)nnc1N1CCN(C(C)(C)CC)CC1	ZINC001339500059	1390047080	/nfs/dbraw/zinc/04/70/80/1390047080.db2.gz	NIHXONUUMRLQTP-INIZCTEOSA-N	0	3	344.507	3.182	20	30		EGEDHN
CCn1c([C@H](C)CCC#N)nnc1N1CCN(CCC(C)(C)C)CC1	ZINC001339746344	1390128101	/nfs/dbraw/zinc/12/81/01/1390128101.db2.gz	QKHRJBNFJVBYNK-MRXNPFEDSA-N	0	3	346.523	3.263	20	30		EGEDHN
N#CC(C(=O)CCC(=O)c1ccc(F)cc1F)c1cccc(F)n1	ZINC001342563282	1390626889	/nfs/dbraw/zinc/62/68/89/1390626889.db2.gz	WABPMLAKVDBUQQ-LBPRGKRZSA-N	0	3	332.281	3.338	20	30		EGEDHN
COc1ccc2nccc(N3CC[C@@H](Oc4ccc(C#N)cn4)C3)c2c1	ZINC001335489641	1390692225	/nfs/dbraw/zinc/69/22/25/1390692225.db2.gz	MFBVWLSHCSVYHB-MRXNPFEDSA-N	0	3	346.390	3.168	20	30		EGEDHN
COc1ccc2nccc(N3CC[C@H](Oc4ccc(C#N)cn4)C3)c2c1	ZINC001335489636	1390692365	/nfs/dbraw/zinc/69/23/65/1390692365.db2.gz	MFBVWLSHCSVYHB-INIZCTEOSA-N	0	3	346.390	3.168	20	30		EGEDHN
C=CCNC(=O)Nc1ccc(NC(=O)[C@@H]2CCCN2CC(C)C)cc1	ZINC001335582924	1390705908	/nfs/dbraw/zinc/70/59/08/1390705908.db2.gz	CJHPYGOXKXJGEB-KRWDZBQOSA-N	0	3	344.459	3.053	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)NC[C@@H](Cc1ccccc1)c1ccccn1	ZINC001343459771	1390715525	/nfs/dbraw/zinc/71/55/25/1390715525.db2.gz	PWOJCSZEHMPZKN-RTBURBONSA-N	0	3	337.467	3.208	20	30		EGEDHN
C=C(C)Cn1c([C@H](CC)OCC)nnc1N1C[C@@H](C)N(CC)C[C@H]1C	ZINC001343690936	1390731254	/nfs/dbraw/zinc/73/12/54/1390731254.db2.gz	FMDMVVPKJYXWRC-ZACQAIPSSA-N	0	3	349.523	3.261	20	30		EGEDHN
Cc1ncncc1C(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1Cl	ZINC001344544886	1390798796	/nfs/dbraw/zinc/79/87/96/1390798796.db2.gz	WWZLHZJAAOCACJ-SNVBAGLBSA-N	0	3	349.177	3.053	20	30		EGEDHN
N#CCOc1cccc(CNCc2ccc(O[C@H]3CCOC3)cc2)c1	ZINC001346834794	1390981242	/nfs/dbraw/zinc/98/12/42/1390981242.db2.gz	NIZAIEYBWFDFLM-FQEVSTJZSA-N	0	3	338.407	3.046	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cnc(Cl)cc2C(F)(F)F)CC1	ZINC001348794451	1391268015	/nfs/dbraw/zinc/26/80/15/1391268015.db2.gz	UYCUQBHJZRQJPM-UHFFFAOYSA-N	0	3	347.768	3.134	20	30		EGEDHN
C#CC1CCN(C(=O)N[C@@H](CN2CCCCC2)c2ccccc2)CC1	ZINC001349067179	1391299916	/nfs/dbraw/zinc/29/99/16/1391299916.db2.gz	AXOIFUXLEJSWME-FQEVSTJZSA-N	0	3	339.483	3.268	20	30		EGEDHN
Cc1ccsc1C(=O)N(C)[C@@H](C)CNCc1ccc(F)c(C#N)c1	ZINC001698810467	1406496242	/nfs/dbraw/zinc/49/62/42/1406496242.db2.gz	FLBDUWJZWXFTRC-ZDUSSCGKSA-N	0	3	345.443	3.318	20	30		EGEDHN
Cc1cccc(C(=O)N(C)[C@@H](C)CNCc2ccc(C#N)s2)c1	ZINC001698812934	1406501413	/nfs/dbraw/zinc/50/14/13/1406501413.db2.gz	YXZUUVCFQDAWGR-AWEZNQCLSA-N	0	3	327.453	3.179	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)Cc2c(C)cc(C)cc2C)C1	ZINC001479393725	1392232750	/nfs/dbraw/zinc/23/27/50/1392232750.db2.gz	MFSPMAJQWXUPSN-QAQDUYKDSA-N	0	3	334.891	3.391	20	30		EGEDHN
C[C@@H](NC(=O)CCCF)[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001480384681	1392728408	/nfs/dbraw/zinc/72/84/08/1392728408.db2.gz	XJKDXCFRUBKDGT-QAPCUYQASA-N	0	3	331.435	3.025	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccccc1Cl)NCc1ccc(F)c(C#N)c1	ZINC001480577060	1392798866	/nfs/dbraw/zinc/79/88/66/1392798866.db2.gz	RZMRWTAHQUJCKM-LBPRGKRZSA-N	0	3	345.805	3.259	20	30		EGEDHN
N#Cc1ccc(CNCC2(NC(=O)c3ccoc3)CCCC2)c(F)c1	ZINC001481889027	1394580392	/nfs/dbraw/zinc/58/03/92/1394580392.db2.gz	YORHNQGSOALKFI-UHFFFAOYSA-N	0	3	341.386	3.123	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC(CCN[C@H](C)c2c(F)cccc2F)CC1	ZINC001481996408	1394655955	/nfs/dbraw/zinc/65/59/55/1394655955.db2.gz	FTVOQFGVFYKXCZ-ZIAGYGMSSA-N	0	3	349.425	3.404	20	30		EGEDHN
CCCCC(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1ccc(C#N)cc1	ZINC001484015007	1395187709	/nfs/dbraw/zinc/18/77/09/1395187709.db2.gz	XHNPTOHKEJIKPR-MOPGFXCFSA-N	0	3	325.456	3.314	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)CCc1ccccc1F)C(C)C	ZINC001698977718	1406749492	/nfs/dbraw/zinc/74/94/92/1406749492.db2.gz	TUMFAZMPIUZZST-MRXNPFEDSA-N	0	3	326.843	3.241	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1cnn(C(C)C)c1C	ZINC001485264548	1395749455	/nfs/dbraw/zinc/74/94/55/1395749455.db2.gz	PCFRJJPFAYCBED-UHFFFAOYSA-N	0	3	340.899	3.213	20	30		EGEDHN
CC(C)CC(=O)NC[C@@H]1CCCCCN1Cc1ccc(C#N)cc1	ZINC001485472847	1395948695	/nfs/dbraw/zinc/94/86/95/1395948695.db2.gz	LIPWFMMHZUJDTG-IBGZPJMESA-N	0	3	327.472	3.465	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)[C@@H](OCC)C2CC2)CC1	ZINC001505396891	1396285215	/nfs/dbraw/zinc/28/52/15/1396285215.db2.gz	UIGADXKZCGRGSU-KRWDZBQOSA-N	0	3	342.911	3.115	20	30		EGEDHN
CC[C@@H](CNC(=O)c1cscc1C)NCc1ccc(C#N)s1	ZINC001494959289	1396511245	/nfs/dbraw/zinc/51/12/45/1396511245.db2.gz	CMFWGVIBPZYKTO-LBPRGKRZSA-N	0	3	333.482	3.288	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1csnc1C	ZINC001689899866	1404194293	/nfs/dbraw/zinc/19/42/93/1404194293.db2.gz	VIFRJFDOAXPMLQ-JSGCOSHPSA-N	0	3	327.881	3.177	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)CCc1cncc(C)c1	ZINC001689905686	1404199405	/nfs/dbraw/zinc/19/94/05/1404199405.db2.gz	OYPDMOKZTYNRQR-SJLPKXTDSA-N	0	3	349.906	3.434	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@H]1CCN(CC[C@@H]2CCCC2(F)F)C1	ZINC001690090470	1404294441	/nfs/dbraw/zinc/29/44/41/1404294441.db2.gz	JWQPRJWAUZQQEJ-GJZGRUSLSA-N	0	3	326.431	3.052	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1ccc2nc(C)sc2c1	ZINC001690871758	1404787616	/nfs/dbraw/zinc/78/76/16/1404787616.db2.gz	CRHXKQODACUIIF-LLVKDONJSA-N	0	3	337.876	3.455	20	30		EGEDHN
C[C@H](CCNC(=O)CCc1cccs1)NCc1ccccc1C#N	ZINC001690877909	1404791639	/nfs/dbraw/zinc/79/16/39/1404791639.db2.gz	MDFKMHQWSYEWGM-OAHLLOKOSA-N	0	3	341.480	3.237	20	30		EGEDHN
CCN(CCNC(=O)c1ccsc1C)Cc1ccc(C#N)cc1	ZINC001691017849	1404933241	/nfs/dbraw/zinc/93/32/41/1404933241.db2.gz	WCZGRUBCODWDFV-UHFFFAOYSA-N	0	3	327.453	3.180	20	30		EGEDHN
C[C@@H](C(=O)NC[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1)C(C)(C)C	ZINC001691506297	1405309582	/nfs/dbraw/zinc/30/95/82/1405309582.db2.gz	MFGFNIPDNBUGBN-QRTARXTBSA-N	0	3	345.462	3.364	20	30		EGEDHN
CCCCCCCN1CCC[C@H](NC(=O)c2n[nH]c3c2CCCC3)C1	ZINC001692145526	1405799722	/nfs/dbraw/zinc/79/97/22/1405799722.db2.gz	PIZDDEJREOIIAA-INIZCTEOSA-N	0	3	346.519	3.453	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)C[C@H](C)c2ccc(OC)cc2)C1	ZINC001692159750	1405812065	/nfs/dbraw/zinc/81/20/65/1405812065.db2.gz	JRLOAZUKBCPMIE-WMZOPIPTSA-N	0	3	330.472	3.346	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1cc(F)ccc1F)C1CC1	ZINC001732247613	1428490923	/nfs/dbraw/zinc/49/09/23/1428490923.db2.gz	YRUSSWLQYNHCAB-INIZCTEOSA-N	0	3	328.790	3.205	20	30		EGEDHN
C=C(Br)CNC[C@@H]1[C@H](C)CCCN1C(=O)CCCC	ZINC001732535438	1428656019	/nfs/dbraw/zinc/65/60/19/1428656019.db2.gz	XODSIMWMYZMIKS-TZMCWYRMSA-N	0	3	331.298	3.302	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H](C)CNCc2ccc(C#N)s2)c(Cl)c1	ZINC001699388419	1412701530	/nfs/dbraw/zinc/70/15/30/1412701530.db2.gz	ZEEBPIOIQDFSCY-GFCCVEGCSA-N	0	3	347.871	3.490	20	30		EGEDHN
Cc1scc(C(=O)NC[C@H](C)N(C)Cc2cccc(C#N)c2)c1C	ZINC001700459726	1414055518	/nfs/dbraw/zinc/05/55/18/1414055518.db2.gz	IHVPGZPQCOCVHX-ZDUSSCGKSA-N	0	3	341.480	3.487	20	30		EGEDHN
Cc1cccc(CCC(=O)NC[C@H](C)N(C)Cc2ccc(C#N)cc2)c1	ZINC001700470562	1414087254	/nfs/dbraw/zinc/08/72/54/1414087254.db2.gz	PKJJLCDFDBRWRI-SFHVURJKSA-N	0	3	349.478	3.436	20	30		EGEDHN
Cc1ccccc1CCC(=O)NC[C@@H](C)N(C)Cc1ccc(C#N)cc1	ZINC001700476922	1414104827	/nfs/dbraw/zinc/10/48/27/1414104827.db2.gz	NBZOWQAHRJBLBT-GOSISDBHSA-N	0	3	349.478	3.436	20	30		EGEDHN
C[C@H]1C[C@H](NCc2ccc(F)c(C#N)c2)CN1C(=O)CCCC1CC1	ZINC001700841002	1414491517	/nfs/dbraw/zinc/49/15/17/1414491517.db2.gz	KNBZAIYVRQIOSX-KSSFIOAISA-N	0	3	343.446	3.357	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCc1ccc(CN[C@@H](C)c2ccccc2)cc1F	ZINC001701063557	1414720735	/nfs/dbraw/zinc/72/07/35/1414720735.db2.gz	NALUVMKXOTVBBM-GJZGRUSLSA-N	0	3	339.414	3.452	20	30		EGEDHN
COc1ccc(C#N)cc1CNC[C@H](C)NC(=O)C(C)(C)CC(C)C	ZINC001733019155	1429138179	/nfs/dbraw/zinc/13/81/79/1429138179.db2.gz	MHWPHTNCZGZZOK-HNNXBMFYSA-N	0	3	345.487	3.233	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)COC1CCCC1	ZINC001707432922	1417337404	/nfs/dbraw/zinc/33/74/04/1417337404.db2.gz	HBLCNANRBDNALK-GOEBONIOSA-N	0	3	328.884	3.057	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1ccccc1OC	ZINC001707439032	1417343026	/nfs/dbraw/zinc/34/30/26/1417343026.db2.gz	CCEHTLXDFLRMFU-GOEBONIOSA-N	0	3	336.863	3.421	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1ccccc1OC	ZINC001707439034	1417343034	/nfs/dbraw/zinc/34/30/34/1417343034.db2.gz	CCEHTLXDFLRMFU-HOCLYGCPSA-N	0	3	336.863	3.421	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1cccc2[nH]ncc21	ZINC001707443978	1417348089	/nfs/dbraw/zinc/34/80/89/1417348089.db2.gz	QJSAVGIKSDXTOK-CXAGYDPISA-N	0	3	346.862	3.288	20	30		EGEDHN
C[C@@H](CN(C)Cc1cccc(C#N)c1)NC(=O)c1cccc2cc[nH]c21	ZINC001733052855	1429193288	/nfs/dbraw/zinc/19/32/88/1429193288.db2.gz	HKDMQORARWTOKM-HNNXBMFYSA-N	0	3	346.434	3.290	20	30		EGEDHN
CCC(CC)CC(=O)NC[C@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC001713539569	1418297637	/nfs/dbraw/zinc/29/76/37/1418297637.db2.gz	ICBKRFHSAWZIMJ-LJQANCHMSA-N	0	3	327.472	3.323	20	30		EGEDHN
CC(C)Oc1cccc(CN2CCC(N(C)C(=O)[C@H](C)C#N)CC2)c1	ZINC001713777776	1418593883	/nfs/dbraw/zinc/59/38/83/1418593883.db2.gz	ZTTAWHUSRAFGGE-MRXNPFEDSA-N	0	3	343.471	3.056	20	30		EGEDHN
Cc1cc(CNCc2ccc(CNC(=O)[C@H](C)C#N)cc2)cs1	ZINC001714317818	1419096515	/nfs/dbraw/zinc/09/65/15/1419096515.db2.gz	NLWRKGKODVIGOQ-CYBMUJFWSA-N	0	3	327.453	3.122	20	30		EGEDHN
C[C@H](CCNC(=O)CCc1ccccc1)NCc1ccccc1C#N	ZINC001714498209	1419223043	/nfs/dbraw/zinc/22/30/43/1419223043.db2.gz	GLHBIKCMCFGJRM-QGZVFWFLSA-N	0	3	335.451	3.175	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2nccc3occc32)CCCC1	ZINC001714500839	1419226671	/nfs/dbraw/zinc/22/66/71/1419226671.db2.gz	VBKJCFYUNJQQOE-UHFFFAOYSA-N	0	3	333.819	3.213	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccc(F)c(OC)c2)CCCC1	ZINC001714504192	1419231704	/nfs/dbraw/zinc/23/17/04/1419231704.db2.gz	ATWYVCWAHUWMFD-UHFFFAOYSA-N	0	3	340.826	3.219	20	30		EGEDHN
COc1ccc(C#N)cc1CNC[C@H](C)N(C)C(=O)C1CCCCC1	ZINC001714529160	1419255377	/nfs/dbraw/zinc/25/53/77/1419255377.db2.gz	FATLHNCXEXEXCK-HNNXBMFYSA-N	0	3	343.471	3.084	20	30		EGEDHN
C[C@@H]1CCCC[C@]1(CNCc1ccc(C#N)cc1F)NC(=O)C1CC1	ZINC001715133728	1419883246	/nfs/dbraw/zinc/88/32/46/1419883246.db2.gz	WZKUWZOXUIYJPG-JLTOFOAXSA-N	0	3	343.446	3.262	20	30		EGEDHN
CN(CCC1CCN(C(=O)C2CCC2)CC1)Cc1ccc(C#N)s1	ZINC001715472398	1420151457	/nfs/dbraw/zinc/15/14/57/1420151457.db2.gz	IHMPSKSYHMOOEQ-UHFFFAOYSA-N	0	3	345.512	3.480	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cnc2c(F)cccc2c1)C(C)C	ZINC001715623266	1420269120	/nfs/dbraw/zinc/26/91/20/1420269120.db2.gz	MTCSWAMUVIFIKN-MRXNPFEDSA-N	0	3	349.837	3.470	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1coc(-c2ccccc2)n1)C(C)C	ZINC001715688678	1420295062	/nfs/dbraw/zinc/29/50/62/1420295062.db2.gz	BEMGVPAQKFVNAQ-OAHLLOKOSA-N	0	3	347.846	3.438	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)c1cc2ccccc2[nH]1	ZINC001716504194	1420734551	/nfs/dbraw/zinc/73/45/51/1420734551.db2.gz	HHKUURLNOOLCJR-HNNXBMFYSA-N	0	3	346.434	3.290	20	30		EGEDHN
C=C(Cl)CN(CC1CC1)C1CCN(C(=O)C[C@@H]2CCCO2)CC1	ZINC001716714407	1420868838	/nfs/dbraw/zinc/86/88/38/1420868838.db2.gz	JISZNXJYXHFAIP-KRWDZBQOSA-N	0	3	340.895	3.011	20	30		EGEDHN
CC(C)SCC(=O)N1CC[C@@H](NCc2ccccc2C#N)C[C@H]1C	ZINC001716757103	1420906499	/nfs/dbraw/zinc/90/64/99/1420906499.db2.gz	HSVRZDITTAKVED-CRAIPNDOSA-N	0	3	345.512	3.169	20	30		EGEDHN
C[C@H](C(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1)C1CC1	ZINC001716794599	1420927553	/nfs/dbraw/zinc/92/75/53/1420927553.db2.gz	OPWKEDFQOXOAQP-HNNXBMFYSA-N	0	3	325.456	3.075	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)c3ccc(F)cc3)CCC2)s1	ZINC001717145944	1421138360	/nfs/dbraw/zinc/13/83/60/1421138360.db2.gz	GHJQLEYFPBANAW-UHFFFAOYSA-N	0	3	343.427	3.201	20	30		EGEDHN
C=C(Br)CNC[C@@H](NC(=O)c1ccccc1)C(C)(C)C	ZINC001717955598	1421727090	/nfs/dbraw/zinc/72/70/90/1421727090.db2.gz	KPRUANFUVRGYNH-CQSZACIVSA-N	0	3	339.277	3.329	20	30		EGEDHN
C[C@@H](CN(C)Cc1cccc(C#N)c1)NC(=O)CC(C1CC1)C1CC1	ZINC001722917499	1424255456	/nfs/dbraw/zinc/25/54/56/1424255456.db2.gz	UXSSFQTTZMZEQY-HNNXBMFYSA-N	0	3	339.483	3.321	20	30		EGEDHN
CN(CCCN(C)C(=O)[C@]12C[C@H]1CCC2)Cc1ccc(F)c(C#N)c1	ZINC001724851168	1425214052	/nfs/dbraw/zinc/21/40/52/1425214052.db2.gz	GDUQGDWWXWBWJA-YLJYHZDGSA-N	0	3	343.446	3.168	20	30		EGEDHN
C=C(Br)CN[C@@H](C)CCNC(=O)C1CCCCCC1	ZINC001724993543	1425396856	/nfs/dbraw/zinc/39/68/56/1425396856.db2.gz	SQTJUWHNTBIGNL-ZDUSSCGKSA-N	0	3	331.298	3.350	20	30		EGEDHN
C[C@@H](CNC(=O)c1cc2ccccc2[nH]1)N(C)Cc1cccc(C#N)c1	ZINC001725193450	1425742843	/nfs/dbraw/zinc/74/28/43/1425742843.db2.gz	PRSKYKJUTCEPFQ-HNNXBMFYSA-N	0	3	346.434	3.290	20	30		EGEDHN
C[C@@H](CN(C)C(=O)[C@@H]1CC[C@@H](C)CC1)NCc1ccc(F)c(C#N)c1	ZINC001725515244	1426205531	/nfs/dbraw/zinc/20/55/31/1426205531.db2.gz	KXBWAGCHZDKZSO-ZOBUZTSGSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@H](C)CCc2cccc(F)c2)C1	ZINC001731459581	1427436307	/nfs/dbraw/zinc/43/63/07/1427436307.db2.gz	NDHNOTHOQJMXAH-CSMYWGQOSA-N	0	3	338.854	3.384	20	30		EGEDHN
CCN(CCNC(=O)c1ccc(F)c(C)c1)Cc1cccc(C#N)c1	ZINC001731808892	1427986048	/nfs/dbraw/zinc/98/60/48/1427986048.db2.gz	CKEWJMBXIZULLK-UHFFFAOYSA-N	0	3	339.414	3.258	20	30		EGEDHN
CCC1(C(=O)NC[C@@H]2CCN(Cc3ccc(C#N)cc3)C2)CCCC1	ZINC001731855633	1428089004	/nfs/dbraw/zinc/08/90/04/1428089004.db2.gz	CBIFHPFEYHUUPS-IBGZPJMESA-N	0	3	339.483	3.467	20	30		EGEDHN
N#Cc1cc(CNC2(CNC(=O)CCC3CC3)CCC2)ccc1F	ZINC001733714895	1429932694	/nfs/dbraw/zinc/93/26/94/1429932694.db2.gz	VJQVOLOGKBCDJI-UHFFFAOYSA-N	0	3	329.419	3.016	20	30		EGEDHN
CC(C)SCC(=O)N[C@H]1CCN(Cc2cccc(C#N)c2)[C@@H](C)C1	ZINC001733895242	1437713081	/nfs/dbraw/zinc/71/30/81/1437713081.db2.gz	OTPCXYRMOGSYAI-YJBOKZPZSA-N	0	3	345.512	3.169	20	30		EGEDHN
Cc1ccc(C(=O)N(C)C[C@@H](C)NCc2ccc(C#N)s2)c(F)c1	ZINC001734344798	1438064426	/nfs/dbraw/zinc/06/44/26/1438064426.db2.gz	XKLLESNHKWKKOD-CYBMUJFWSA-N	0	3	345.443	3.318	20	30		EGEDHN
CC#CCN(CCCNC(=O)c1cc2ccccc2n1CC)C1CC1	ZINC001752293401	1440166551	/nfs/dbraw/zinc/16/65/51/1440166551.db2.gz	KQMXJFVIPOHPIC-UHFFFAOYSA-N	0	3	337.467	3.269	20	30		EGEDHN
C#CCCCC(=O)N(C)C1CCN(Cc2ccc3ncccc3c2)CC1	ZINC001752300164	1440167680	/nfs/dbraw/zinc/16/76/80/1440167680.db2.gz	UYBGVKYQFORJJF-UHFFFAOYSA-N	0	3	349.478	3.461	20	30		EGEDHN
C=CCCC(=O)N(CCC)C1CCN(CCn2nc(C)cc2C)CC1	ZINC001752431147	1440178010	/nfs/dbraw/zinc/17/80/10/1440178010.db2.gz	FBWKCIWUYIZVCE-UHFFFAOYSA-N	0	3	346.519	3.169	20	30		EGEDHN
C=CCCCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)Cc1c[nH]cn1	ZINC001752567588	1440195617	/nfs/dbraw/zinc/19/56/17/1440195617.db2.gz	UFFSQMCNOOECSF-QRQLOZEOSA-N	0	3	344.503	3.010	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H]2CN(Cc3cccnc3C)CC[C@H]21	ZINC001752708359	1440203317	/nfs/dbraw/zinc/20/33/17/1440203317.db2.gz	ZZRYLOYJGZBEHV-WOJBJXKFSA-N	0	3	339.483	3.006	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1C[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001752730541	1440204125	/nfs/dbraw/zinc/20/41/25/1440204125.db2.gz	FVOCSVRMJRNSLU-HDICACEKSA-N	0	3	328.431	3.016	20	30		EGEDHN
CC1=C(C)C[C@H](C(=O)N[C@H]2C[C@@H](NCC#Cc3ccccc3)C2)CC1	ZINC001752730789	1440204138	/nfs/dbraw/zinc/20/41/38/1440204138.db2.gz	HTCVJUWIXYUWFR-NJYVYQBISA-N	0	3	336.479	3.411	20	30		EGEDHN
C=CC[C@H](C(=O)N[C@H]1C[C@@H](NCc2cncs2)C1)c1ccccc1	ZINC001752774173	1440206578	/nfs/dbraw/zinc/20/65/78/1440206578.db2.gz	NATIJQICJZZIHG-JZXOWHBKSA-N	0	3	341.480	3.240	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)CC[C@@H]2CCc3ccccc32)C1	ZINC001752775545	1440206782	/nfs/dbraw/zinc/20/67/82/1440206782.db2.gz	NOODCWNWZUEVJE-YESZJQIVSA-N	0	3	332.875	3.486	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC[C@H]1CCCN(Cc2cccc(C(F)F)c2)C1	ZINC001752780183	1440208379	/nfs/dbraw/zinc/20/83/79/1440208379.db2.gz	UCIPAQAKLKVAAT-DZGCQCFKSA-N	0	3	335.398	3.112	20	30		EGEDHN
COc1ccc(CN2CCC[C@H](CNC(=O)C#CC(C)(C)C)C2)cc1	ZINC001752780757	1440208679	/nfs/dbraw/zinc/20/86/79/1440208679.db2.gz	FMUHBNHEASNFHK-GOSISDBHSA-N	0	3	342.483	3.073	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@@H]1CCCN(Cc2ncccc2C)C1	ZINC001752785732	1440211099	/nfs/dbraw/zinc/21/10/99/1440211099.db2.gz	DFKAAHDTZGSYEG-MSOLQXFVSA-N	0	3	329.488	3.321	20	30		EGEDHN
C=CCOCCN1CCCC[C@@H]1CNC(=O)[C@H]1[C@@H]2CCCCCC[C@@H]21	ZINC001752822253	1440221191	/nfs/dbraw/zinc/22/11/91/1440221191.db2.gz	CTHNNLRNAQHEIE-ZRNYENFQSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=CCOCCN1CCCC[C@@H]1CNC(=O)c1ccc(C=C)cc1	ZINC001752822559	1440221496	/nfs/dbraw/zinc/22/14/96/1440221496.db2.gz	KAAQHVNNXAKSML-LJQANCHMSA-N	0	3	328.456	3.117	20	30		EGEDHN
C=CCOCCN1CCCC[C@@H]1CNC(=O)C12CCC(CC1)C2(C)C	ZINC001752823020	1440221621	/nfs/dbraw/zinc/22/16/21/1440221621.db2.gz	SJXTXXJJHZANRK-IDYZSHNDSA-N	0	3	348.531	3.376	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)C(C)(C)c2ccccc2Cl)C1	ZINC001752840098	1440230056	/nfs/dbraw/zinc/23/00/56/1440230056.db2.gz	GONKCWCPKHOTRV-HOTGVXAUSA-N	0	3	346.902	3.468	20	30		EGEDHN
C#CCCCCC(=O)NC1CCC(NCC(=C)Br)CC1	ZINC001752849659	1440233250	/nfs/dbraw/zinc/23/32/50/1440233250.db2.gz	RDPKTMNXCVPMBZ-UHFFFAOYSA-N	0	3	341.293	3.106	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N1CC[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001752950047	1440251991	/nfs/dbraw/zinc/25/19/91/1440251991.db2.gz	RTKSFTSBFOFEST-MRJCOXNESA-N	0	3	341.430	3.158	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1CCC[C@@H](NCc2cnc(C)o2)C1	ZINC001752975776	1440255930	/nfs/dbraw/zinc/25/59/30/1440255930.db2.gz	FYLLDSAVOPMOKZ-IAGOWNOFSA-N	0	3	331.460	3.084	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H](N(C)Cc2ccc(C)c(F)c2)C1	ZINC001752989688	1440259233	/nfs/dbraw/zinc/25/92/33/1440259233.db2.gz	JLIUCPWQYYBLJW-GOSISDBHSA-N	0	3	330.447	3.360	20	30		EGEDHN
CC#CCN(C)[C@H]1CCCN(C(=O)c2ccc(F)c(Cl)c2F)C1	ZINC001752997388	1440262761	/nfs/dbraw/zinc/26/27/61/1440262761.db2.gz	UYWCCPPXIZVNIT-LBPRGKRZSA-N	0	3	340.801	3.178	20	30		EGEDHN
CC#CCN(C)[C@H]1CCCN(C(=O)C[C@H](C)c2ccc(OC)cc2)C1	ZINC001753000010	1440264062	/nfs/dbraw/zinc/26/40/62/1440264062.db2.gz	LVCDECMMQJKLJJ-HKUYNNGSSA-N	0	3	342.483	3.135	20	30		EGEDHN
CC#CCN(C)[C@@H]1CCCN(C(=O)[C@H](C)Cc2ccc(C)cc2)C1	ZINC001753000377	1440264392	/nfs/dbraw/zinc/26/43/92/1440264392.db2.gz	RVCGTGJEJQCXJX-UYAOXDASSA-N	0	3	326.484	3.120	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)[C@@H](C)Cc1cccc(F)c1	ZINC001753020591	1440269971	/nfs/dbraw/zinc/26/99/71/1440269971.db2.gz	SOEJVORDEGTTAE-GXTWGEPZSA-N	0	3	326.843	3.241	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@H]1CCN(Cc2oc(CC)nc2C)C1	ZINC001753132305	1440317129	/nfs/dbraw/zinc/31/71/29/1440317129.db2.gz	LYDDRJMTALHALM-JKSUJKDBSA-N	0	3	333.476	3.086	20	30		EGEDHN
C=CCC(C)(C)C(=O)N(C)CCNCc1cnn(-c2ccccc2)c1	ZINC001753236424	1440341748	/nfs/dbraw/zinc/34/17/48/1440341748.db2.gz	ZUKGSJQMKVFXCZ-UHFFFAOYSA-N	0	3	340.471	3.023	20	30		EGEDHN
CC[C@@H](CC(F)(F)F)C(=O)N(C)CCNCc1cccc(C#N)c1	ZINC001753251833	1440343078	/nfs/dbraw/zinc/34/30/78/1440343078.db2.gz	BKFSPJQRLDDHQO-HNNXBMFYSA-N	0	3	341.377	3.085	20	30		EGEDHN
C[C@H](CC(=O)N(C)CCNCc1ccc(C#N)s1)c1ccccc1	ZINC001753262184	1440344423	/nfs/dbraw/zinc/34/44/23/1440344423.db2.gz	SWKGGNXWQWHVFS-OAHLLOKOSA-N	0	3	341.480	3.362	20	30		EGEDHN
C=C[C@@H](CC(=O)N(C)CCNCc1ccc(C#N)cc1)c1ccccc1	ZINC001753271050	1440345480	/nfs/dbraw/zinc/34/54/80/1440345480.db2.gz	GTLBSDRSQXTCOJ-FQEVSTJZSA-N	0	3	347.462	3.466	20	30		EGEDHN
C#CCCN[C@@H](CNC(=O)C1CC(OC)C1)c1ccc(C(C)C)cc1	ZINC001753294094	1440351358	/nfs/dbraw/zinc/35/13/58/1440351358.db2.gz	DLTBLZXOHOJQNZ-MHJFOBGBSA-N	0	3	342.483	3.005	20	30		EGEDHN
C=CCN[C@@H](CNC(=O)c1coc(Br)c1)c1ccccc1	ZINC001753299113	1440353421	/nfs/dbraw/zinc/35/34/21/1440353421.db2.gz	SUDPUPDZWNOMNC-AWEZNQCLSA-N	0	3	349.228	3.289	20	30		EGEDHN
C=CCN[C@@H](CNC(=O)c1c(C)nn(CC)c1Cl)c1ccccc1	ZINC001753302383	1440354404	/nfs/dbraw/zinc/35/44/04/1440354404.db2.gz	AIXUJJPSOILDOC-HNNXBMFYSA-N	0	3	346.862	3.112	20	30		EGEDHN
C#CCCN[C@H](CNC(=O)c1cc(CC(C)C)c[nH]1)c1ccccc1	ZINC001753303100	1440354769	/nfs/dbraw/zinc/35/47/69/1440354769.db2.gz	QBZOMRXTBMCTRG-HXUWFJFHSA-N	0	3	337.467	3.297	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CCC)C(=O)CN(C)Cc2ccccc2)C1	ZINC001753322841	1440364635	/nfs/dbraw/zinc/36/46/35/1440364635.db2.gz	KFWKGICJZDHNLJ-HXUWFJFHSA-N	0	3	343.515	3.007	20	30		EGEDHN
C=CCCC(=O)NCC[C@@H]1CCN(CCc2c(F)cccc2F)C1	ZINC001753324707	1440365845	/nfs/dbraw/zinc/36/58/45/1440365845.db2.gz	ITOFWRJIJKNBBU-OAHLLOKOSA-N	0	3	336.426	3.302	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC(CN(C)Cc2cc(C)no2)CC1	ZINC001753365347	1440384721	/nfs/dbraw/zinc/38/47/21/1440384721.db2.gz	DFXMTAPCZBVHDN-MRXNPFEDSA-N	0	3	333.476	3.256	20	30		EGEDHN
C[C@H](c1ccc2ccccc2c1)N1CC(CNC(=O)C#CC2CC2)C1	ZINC001753401483	1440391071	/nfs/dbraw/zinc/39/10/71/1440391071.db2.gz	HFTFEIRWGKHCTD-MRXNPFEDSA-N	0	3	332.447	3.362	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NCC1CN([C@H](C)c2cccc(C)c2)C1	ZINC001753407314	1440392302	/nfs/dbraw/zinc/39/23/02/1440392302.db2.gz	DDLYTTKNHIRHNV-UTKZUKDTSA-N	0	3	344.499	3.333	20	30		EGEDHN
CCCCCCCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc2cccnn21	ZINC001753424758	1440396353	/nfs/dbraw/zinc/39/63/53/1440396353.db2.gz	COXDGJIYHHSVON-ROUUACIJSA-N	0	3	340.471	3.203	20	30		EGEDHN
C[C@@H](C#N)C(=O)N(C)[C@@H]1CCN(Cc2ccc(C(C)(C)C)cc2)C1	ZINC001753434457	1440399413	/nfs/dbraw/zinc/39/94/13/1440399413.db2.gz	WBIDNWFBZLEZEZ-MAUKXSAKSA-N	0	3	327.472	3.176	20	30		EGEDHN
C=CCCCC(=O)N(C)[C@H]1CCN(Cc2ccccc2N(C)C)C1	ZINC001753441865	1440401913	/nfs/dbraw/zinc/40/19/13/1440401913.db2.gz	QIOBMNZOPZKZIR-SFHVURJKSA-N	0	3	329.488	3.142	20	30		EGEDHN
C#CCCN1CC[C@H](N(C)C(=O)C[C@H](C)c2ccc(CC)cc2)C1	ZINC001753444451	1440403128	/nfs/dbraw/zinc/40/31/28/1440403128.db2.gz	RCVLXKSCJSZUQV-PXNSSMCTSA-N	0	3	326.484	3.299	20	30		EGEDHN
C=CCOCCN1CC[C@H](N(C)C(=O)c2cccc(C3CCC3)c2)C1	ZINC001753447522	1440404598	/nfs/dbraw/zinc/40/45/98/1440404598.db2.gz	BHSBNFUWTJRMNG-FQEVSTJZSA-N	0	3	342.483	3.303	20	30		EGEDHN
C=CCCC(=O)N(CC)[C@@H]1CCN(C[C@@H](OC)c2ccccc2)C1	ZINC001753452861	1440406955	/nfs/dbraw/zinc/40/69/55/1440406955.db2.gz	GSEUIICEDKQOKA-RTBURBONSA-N	0	3	330.472	3.263	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2cncc(Cl)c2)CCCC1	ZINC001753508271	1440425103	/nfs/dbraw/zinc/42/51/03/1440425103.db2.gz	CTNQNAKWOPVWGI-UHFFFAOYSA-N	0	3	328.243	3.120	20	30		EGEDHN
C=C(Br)CNCC1(NC(=O)[C@H]2CC23CCC3)CCCC1	ZINC001753508771	1440425180	/nfs/dbraw/zinc/42/51/80/1440425180.db2.gz	BSIQJTYUWIFBMR-CYBMUJFWSA-N	0	3	341.293	3.104	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1c[nH]c2ccccc12)C1CC1	ZINC001753519302	1440428197	/nfs/dbraw/zinc/42/81/97/1440428197.db2.gz	AYCSNEPGEIGTBT-GOSISDBHSA-N	0	3	331.847	3.409	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1sc(CC)nc1C)C1CC1	ZINC001753526274	1440429736	/nfs/dbraw/zinc/42/97/36/1440429736.db2.gz	SITWRULENGCISU-INIZCTEOSA-N	0	3	341.908	3.255	20	30		EGEDHN
C=CCCC(=O)N[C@@]1(CNCc2oc(C)nc2C)CCCC[C@H]1C	ZINC001753532082	1440431277	/nfs/dbraw/zinc/43/12/77/1440431277.db2.gz	QSBNFMWAQLVFJI-AUUYWEPGSA-N	0	3	333.476	3.412	20	30		EGEDHN
C=CCCC(=O)N[C@@]1(CNCc2oc(C)nc2C)CCCC[C@@H]1C	ZINC001753532083	1440431287	/nfs/dbraw/zinc/43/12/87/1440431287.db2.gz	QSBNFMWAQLVFJI-IFXJQAMLSA-N	0	3	333.476	3.412	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H](CCNCc2ccncc2Cl)C1	ZINC001753542789	1440433730	/nfs/dbraw/zinc/43/37/30/1440433730.db2.gz	OVPNOQABGJCGRQ-HNNXBMFYSA-N	0	3	335.879	3.420	20	30		EGEDHN
Cc1nc(CNCC[C@@H]2CCCN(C(=O)C#CC(C)C)C2)sc1C	ZINC001753546152	1440434217	/nfs/dbraw/zinc/43/42/17/1440434217.db2.gz	FUDAPQLUPQMGLF-KRWDZBQOSA-N	0	3	347.528	3.138	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCCN(C(=O)c2cc(C3CC3)no2)C1	ZINC001753556980	1440436125	/nfs/dbraw/zinc/43/61/25/1440436125.db2.gz	CDKFLHJBXIOIBQ-CYBMUJFWSA-N	0	3	337.851	3.136	20	30		EGEDHN
C=CCC1(C(=O)NC[C@H](C)CNCc2ccccc2C#N)CCC1	ZINC001753630464	1440452158	/nfs/dbraw/zinc/45/21/58/1440452158.db2.gz	QCPVXPPMKNFVCS-MRXNPFEDSA-N	0	3	325.456	3.147	20	30		EGEDHN
CC#CCCCC(=O)NCC1(NCc2c(C)noc2CC)CCCC1	ZINC001753666472	1440460444	/nfs/dbraw/zinc/46/04/44/1440460444.db2.gz	DXPYDOWEEMHPIM-UHFFFAOYSA-N	0	3	345.487	3.258	20	30		EGEDHN
O=C(NCC1(NCC#Cc2ccccc2)CCCC1)[C@@H]1CC[C@@H](F)C1	ZINC001753667666	1440460794	/nfs/dbraw/zinc/46/07/94/1440460794.db2.gz	FGBRKYRDNMAZNX-RTBURBONSA-N	0	3	342.458	3.195	20	30		EGEDHN
C[C@H](CNCC#Cc1cccc(Cl)c1)N(C)C(=O)[C@H](C)C1CC1	ZINC001753687668	1440465987	/nfs/dbraw/zinc/46/59/87/1440465987.db2.gz	RKBUJBPQOUSWOY-HUUCEWRRSA-N	0	3	332.875	3.174	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@@H](C)[C@H]1CNCc1ccc(OC)nc1	ZINC001753808212	1440492252	/nfs/dbraw/zinc/49/22/52/1440492252.db2.gz	CGGYOGHMGWWUOO-SJLPKXTDSA-N	0	3	345.487	3.163	20	30		EGEDHN
CC(C)C(=O)N1CCC(CCN(C)Cc2ccc(C#N)cc2F)CC1	ZINC001753817249	1440494329	/nfs/dbraw/zinc/49/43/29/1440494329.db2.gz	ZNXSANUDXPYLLW-UHFFFAOYSA-N	0	3	345.462	3.414	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@@H](C)[C@H]1CNCc1cncs1	ZINC001753819165	1440495212	/nfs/dbraw/zinc/49/52/12/1440495212.db2.gz	PGUPGHVGOUDDDP-GDBMZVCRSA-N	0	3	335.517	3.462	20	30		EGEDHN
CC(C)[C@H](CNC(=O)C1CCC1)NCC#Cc1ccccc1Cl	ZINC001753822429	1440496923	/nfs/dbraw/zinc/49/69/23/1440496923.db2.gz	IVANFTNLSDSRHU-SFHVURJKSA-N	0	3	332.875	3.222	20	30		EGEDHN
C=C(Br)CNCC[C@H](C)NC(=O)[C@@]1(C)CC=CCC1	ZINC001753967920	1440526690	/nfs/dbraw/zinc/52/66/90/1440526690.db2.gz	BVOZCHIJOJWDLF-ZFWWWQNUSA-N	0	3	329.282	3.126	20	30		EGEDHN
C=C(Cl)CNCC[C@H](C)NC(=O)c1ncc(Cl)cc1Cl	ZINC001754022236	1440532657	/nfs/dbraw/zinc/53/26/57/1440532657.db2.gz	XQVIHNNFDLLPQY-VIFPVBQESA-N	0	3	336.650	3.239	20	30		EGEDHN
CCN(CCNCc1ccc(OC)c(C#N)c1)C(=O)/C=C\C(C)(C)C	ZINC001754038208	1440534383	/nfs/dbraw/zinc/53/43/83/1440534383.db2.gz	BMTXPBLLIPJXKO-KTKRTIGZSA-N	0	3	343.471	3.107	20	30		EGEDHN
CCN(CCNCc1cccc(C#N)c1)C(=O)[C@@]1(C)CCC[C@H]1C	ZINC001754066101	1440537387	/nfs/dbraw/zinc/53/73/87/1440537387.db2.gz	YBMMRZOEZOINEX-UZLBHIALSA-N	0	3	327.472	3.323	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H](C)CN(C)C/C=C\c2ccccc2)cc1	ZINC001754320458	1440577605	/nfs/dbraw/zinc/57/76/05/1440577605.db2.gz	WXAKBMBUOYJSHN-YFWYWMRJSA-N	0	3	332.447	3.431	20	30		EGEDHN
CC/C=C(\C)C(=O)N[C@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001754435175	1440597920	/nfs/dbraw/zinc/59/79/20/1440597920.db2.gz	XXYBTYPDLFXNFB-KVJCKPADSA-N	0	3	329.419	3.038	20	30		EGEDHN
C=Cc1ccc(C(=O)N[C@H](CNCC#Cc2ccccc2)C2CC2)cc1	ZINC001754452797	1440601549	/nfs/dbraw/zinc/60/15/49/1440601549.db2.gz	KQEAUPSTYHRDPP-JOCHJYFZSA-N	0	3	344.458	3.479	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)C[C@H]1CCc2ccccc2C1	ZINC001754499574	1440613369	/nfs/dbraw/zinc/61/33/69/1440613369.db2.gz	ATJBNXMEXSSUCL-PXNSSMCTSA-N	0	3	326.484	3.338	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)C[C@@H](C)c1ccccc1OC	ZINC001754501668	1440614596	/nfs/dbraw/zinc/61/45/96/1440614596.db2.gz	ZTPQDCVRFHQZIR-SJORKVTESA-N	0	3	330.472	3.346	20	30		EGEDHN
CC(C)C(C)(C)C(=O)NCC1(NCc2ccc(C#N)c(F)c2)CC1	ZINC001754514387	1440618245	/nfs/dbraw/zinc/61/82/45/1440618245.db2.gz	BKHMADDWAUDULF-UHFFFAOYSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=CCOCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C(C)=C1CCCC1	ZINC001754542674	1440626429	/nfs/dbraw/zinc/62/64/29/1440626429.db2.gz	ZRSUOZSEBUCWJF-MOPGFXCFSA-N	0	3	332.488	3.145	20	30		EGEDHN
C=CCCC(=O)N1CC[C@]2(C1)CCCN(CCc1csc(C)n1)C2	ZINC001754556179	1440631580	/nfs/dbraw/zinc/63/15/80/1440631580.db2.gz	WHCIFZAWFQCWIB-LJQANCHMSA-N	0	3	347.528	3.275	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC(N(C/C=C\Cl)CCOC)CC1	ZINC001754559001	1440632978	/nfs/dbraw/zinc/63/29/78/1440632978.db2.gz	JXQWHUHRKLWLPP-IEODJVTJSA-N	0	3	342.911	3.281	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC(N(CCOC)C[C@H](F)CC)CC2)C1	ZINC001754558832	1440632989	/nfs/dbraw/zinc/63/29/89/1440632989.db2.gz	DAYIQGXPQOXJJG-MRXNPFEDSA-N	0	3	340.483	3.030	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](NC/C(Cl)=C/Cl)C[C@@H]1C	ZINC001754598194	1440641915	/nfs/dbraw/zinc/64/19/15/1440641915.db2.gz	HVQXIWIEWLVZFC-LANAQNJFSA-N	0	3	331.287	3.468	20	30		EGEDHN
O=C([C@@H]1CCC(F)(F)C1)N1CCC[C@H]1CNCC#Cc1ccccc1	ZINC001754611710	1440643802	/nfs/dbraw/zinc/64/38/02/1440643802.db2.gz	PMEWCVYSAGYOGL-MSOLQXFVSA-N	0	3	346.421	3.054	20	30		EGEDHN
C#CCN(C(=O)c1ccc(F)cc1)C1CCN(CC=C(C)C)CC1	ZINC001754634459	1440648314	/nfs/dbraw/zinc/64/83/14/1440648314.db2.gz	VIGWZSJBIDBCIU-UHFFFAOYSA-N	0	3	328.431	3.332	20	30		EGEDHN
C#CCN(C(=O)/C=C(\C)CC)C1CCN(CCOCC2CCC2)CC1	ZINC001754636759	1440648683	/nfs/dbraw/zinc/64/86/83/1440648683.db2.gz	YPRVHLYMDSTOCN-FBMGVBCBSA-N	0	3	346.515	3.086	20	30		EGEDHN
C#CCCCCCC(=O)N(CC#C)C1CCN(CC=C(C)C)CC1	ZINC001754639392	1440648834	/nfs/dbraw/zinc/64/88/34/1440648834.db2.gz	GIUJOPJDUVTRPN-UHFFFAOYSA-N	0	3	328.500	3.463	20	30		EGEDHN
C#CCNC[C@@H](NC(=O)C1(C2CC2)CC1)c1ccc2ccccc2c1	ZINC001754644444	1440649755	/nfs/dbraw/zinc/64/97/55/1440649755.db2.gz	TUSUUKOHOOTSFF-HXUWFJFHSA-N	0	3	332.447	3.410	20	30		EGEDHN
C=CCCCCCN1CC[C@](C)(NC(=O)c2cc(OC)ns2)C1	ZINC001754673521	1440658932	/nfs/dbraw/zinc/65/89/32/1440658932.db2.gz	BPJXVGFDGHUEOD-KRWDZBQOSA-N	0	3	337.489	3.092	20	30		EGEDHN
C#CCCCCC(=O)NCC1(C)CCN(Cc2conc2CC)CC1	ZINC001754717520	1440672021	/nfs/dbraw/zinc/67/20/21/1440672021.db2.gz	VHRZZNXJPMQHLC-UHFFFAOYSA-N	0	3	345.487	3.149	20	30		EGEDHN
C=CCCC(=O)NC[C@@]1(C)CCCN(Cc2sc(C)nc2C)C1	ZINC001754725233	1440675477	/nfs/dbraw/zinc/67/54/77/1440675477.db2.gz	XXSFEWJWDOSHFG-GOSISDBHSA-N	0	3	335.517	3.444	20	30		EGEDHN
CC[C@@H](F)C(=O)NC[C@]1(C)CCCN(Cc2cccc(C#N)c2)C1	ZINC001754730929	1440679262	/nfs/dbraw/zinc/67/92/62/1440679262.db2.gz	ZMUKZZRCLQVRAC-MJGOQNOKSA-N	0	3	331.435	3.025	20	30		EGEDHN
C=CCN1CCC[C@@](C)(CNC(=O)c2cccc3oc(C)nc32)C1	ZINC001754734035	1440681254	/nfs/dbraw/zinc/68/12/54/1440681254.db2.gz	IHBNEBOWQSNQCF-IBGZPJMESA-N	0	3	327.428	3.154	20	30		EGEDHN
C=CCCC(=O)NCC1(NCc2cc3ccccc3o2)CCOCC1	ZINC001754734122	1440681299	/nfs/dbraw/zinc/68/12/99/1440681299.db2.gz	NDVQFPUZJPZVIJ-UHFFFAOYSA-N	0	3	342.439	3.154	20	30		EGEDHN
C=CCN1CCC[C@@](C)(CNC(=O)Cc2cccc3cccnc32)C1	ZINC001754737080	1440682608	/nfs/dbraw/zinc/68/26/08/1440682608.db2.gz	ZEFBOZVCUUMNDQ-NRFANRHFSA-N	0	3	337.467	3.182	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@]1(O)CCN([C@@H](C)c2ccc(F)cc2)C1	ZINC001754756382	1440685265	/nfs/dbraw/zinc/68/52/65/1440685265.db2.gz	MHOZYCJRXAMJDN-MGPUTAFESA-N	0	3	348.462	3.042	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)CCCCCOCC)C2)CC1	ZINC001754785662	1440687645	/nfs/dbraw/zinc/68/76/45/1440687645.db2.gz	OXVNKMHFEQZHSQ-FQEVSTJZSA-N	0	3	348.531	3.167	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H]([C@@H](C)NCc2csc(CC)n2)C1	ZINC001754801036	1440690336	/nfs/dbraw/zinc/69/03/36/1440690336.db2.gz	YFSDHEASJOSQBU-HUUCEWRRSA-N	0	3	335.517	3.388	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](C)[C@@H](CNCc3cnc(C)o3)C2)CCCC1	ZINC001754828771	1440694061	/nfs/dbraw/zinc/69/40/61/1440694061.db2.gz	QLMZBFVKHMFBNM-WBVHZDCISA-N	0	3	345.487	3.304	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC[C@@H]2[C@@H]1CCN2CCCCC(F)(F)F	ZINC001754864825	1440702354	/nfs/dbraw/zinc/70/23/54/1440702354.db2.gz	DTSHLBUIHFVLGH-CVEARBPZSA-N	0	3	344.421	3.444	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@@H](CCNCc2ccc(F)cc2Cl)C1	ZINC001754914281	1440708396	/nfs/dbraw/zinc/70/83/96/1440708396.db2.gz	CQNVUDHRYPIZBQ-OAHLLOKOSA-N	0	3	348.849	3.221	20	30		EGEDHN
C=C(C)CN(C)Cc1ccccc1CNC(=O)c1ccc(F)cn1	ZINC001754945932	1440712986	/nfs/dbraw/zinc/71/29/86/1440712986.db2.gz	NVNYVVUHNIIARP-UHFFFAOYSA-N	0	3	327.403	3.159	20	30		EGEDHN
C=CCN(C)Cc1ccccc1CNC(=O)[C@@H]1COc2ccccc21	ZINC001754952683	1440715285	/nfs/dbraw/zinc/71/52/85/1440715285.db2.gz	GAWFHPJMQXOOSB-LJQANCHMSA-N	0	3	336.435	3.097	20	30		EGEDHN
COCC#CCN[C@H](C)c1ccc(CNC(=O)CC(C)(C)C)cc1	ZINC001754952749	1440715506	/nfs/dbraw/zinc/71/55/06/1440715506.db2.gz	GRRHQVYHOGFGJS-MRXNPFEDSA-N	0	3	330.472	3.039	20	30		EGEDHN
CC#CCNC1(CNC(=O)c2cc(-c3ccccc3)ccn2)CCC1	ZINC001754989019	1440723715	/nfs/dbraw/zinc/72/37/15/1440723715.db2.gz	TZJZRECOVAUPNH-UHFFFAOYSA-N	0	3	333.435	3.014	20	30		EGEDHN
CC#CCN(C)CCCN(C)C(=O)[C@@H](CC)Cc1cccc(C)c1	ZINC001755045952	1440740715	/nfs/dbraw/zinc/74/07/15/1440740715.db2.gz	OMBNIBCWAGWBKN-FQEVSTJZSA-N	0	3	328.500	3.367	20	30		EGEDHN
CCC1(NC/C(Cl)=C\Cl)CCN(C(=O)C#CC(C)C)CC1	ZINC001755068425	1440745785	/nfs/dbraw/zinc/74/57/85/1440745785.db2.gz	DKNAZDVEVTWHJH-SDNWHVSQSA-N	0	3	331.287	3.326	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H](C)[C@@H](NCc2ccc(Cl)nc2)C1	ZINC001755124317	1440756003	/nfs/dbraw/zinc/75/60/03/1440756003.db2.gz	VSGIRRMCALDOJK-PBHICJAKSA-N	0	3	347.890	3.440	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CCN(CCn2nc(C)cc2C)CC1(C)C	ZINC001755139313	1440759491	/nfs/dbraw/zinc/75/94/91/1440759491.db2.gz	VSCWTSFHVTXBRM-GOSISDBHSA-N	0	3	346.519	3.073	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CCN(CCc2ccns2)CC1(C)C	ZINC001755142820	1440761682	/nfs/dbraw/zinc/76/16/82/1440761682.db2.gz	VIFITJAHBJBEGP-MRXNPFEDSA-N	0	3	335.517	3.259	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)CCc2cccc(Cl)c2)C[C@H]1C	ZINC001755161895	1440764983	/nfs/dbraw/zinc/76/49/83/1440764983.db2.gz	NXAWUAIKLZSZBT-CRAIPNDOSA-N	0	3	332.875	3.265	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)CCCn1cccc1	ZINC001755187282	1440773424	/nfs/dbraw/zinc/77/34/24/1440773424.db2.gz	BPNIEIKDEVMQBQ-TZIWHRDSSA-N	0	3	337.467	3.216	20	30		EGEDHN
C=C(Cl)CNCC1CC(NC(=O)c2ccc(OC)cc2Cl)C1	ZINC001755218241	1440784418	/nfs/dbraw/zinc/78/44/18/1440784418.db2.gz	XJGPMGAZNXOBGZ-UHFFFAOYSA-N	0	3	343.254	3.199	20	30		EGEDHN
CC(C)=C(C)CC(=O)N[C@H](C)[C@H](C)NCC#Cc1ccc(F)cc1	ZINC001755250234	1440791595	/nfs/dbraw/zinc/79/15/95/1440791595.db2.gz	VUAJQTYKRWOLBV-DLBZAZTESA-N	0	3	330.447	3.406	20	30		EGEDHN
C[C@H](NCC#Cc1ccccc1)[C@H](C)NC(=O)C1(c2ccccc2)CC1	ZINC001755269017	1440797112	/nfs/dbraw/zinc/79/71/12/1440797112.db2.gz	UJKNFPAVVTVKRA-OALUTQOASA-N	0	3	346.474	3.253	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H]1C(=O)NC[C@H](C)N(C)Cc1cccc(C#N)c1	ZINC001755316264	1440815702	/nfs/dbraw/zinc/81/57/02/1440815702.db2.gz	GUZDGTYLTMBJSU-KFKAGJAMSA-N	0	3	327.472	3.177	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC1(CNCc2nccnc2C)CCCCC1	ZINC001755353795	1440828769	/nfs/dbraw/zinc/82/87/69/1440828769.db2.gz	XDOHZKUPAJFGGG-KRWDZBQOSA-N	0	3	344.503	3.296	20	30		EGEDHN
CCCC[C@H](CNCc1ccc(C#N)cc1F)NC(=O)C(C)(F)F	ZINC001755356233	1440829517	/nfs/dbraw/zinc/82/95/17/1440829517.db2.gz	IAKFTQJFPIXREX-CQSZACIVSA-N	0	3	341.377	3.117	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)[C@@H](CC)Cc2cccc(C)c2)C(C)(C)C1	ZINC001755412764	1440847130	/nfs/dbraw/zinc/84/71/30/1440847130.db2.gz	XMUUKQLDCMEVTL-VQTJNVASSA-N	0	3	340.511	3.414	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@H]2CN(Cc3ccnc(Cl)c3)C[C@H]2C1	ZINC001755449239	1440852863	/nfs/dbraw/zinc/85/28/63/1440852863.db2.gz	DDNPLXHFPCPCRU-GVDBMIGSSA-N	0	3	347.890	3.418	20	30		EGEDHN
C=CCCC(=O)N1C[C@@]2(C)CN(Cc3cccc(C#N)c3)C[C@@]2(C)C1	ZINC001755461151	1440857344	/nfs/dbraw/zinc/85/73/44/1440857344.db2.gz	ZIBGIOLRBUAAEG-OYRHEFFESA-N	0	3	337.467	3.195	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1C[C@@]2(C)CN(Cc3ccsc3)C[C@@]2(C)C1	ZINC001755462192	1440857741	/nfs/dbraw/zinc/85/77/41/1440857741.db2.gz	PPNJNCQQTHMWML-BGYRXZFFSA-N	0	3	344.524	3.468	20	30		EGEDHN
C[C@@H]1CC[C@H](C(=O)N2CCC(N(C)CC#Cc3ccccc3)CC2)C1	ZINC001755534413	1440868520	/nfs/dbraw/zinc/86/85/20/1440868520.db2.gz	LYYDDMWIBLPQCJ-QUCCMNQESA-N	0	3	338.495	3.397	20	30		EGEDHN
CC#CC[NH2+]CCCN(Cc1ccccc1)C(=O)c1ccccc1[O-]	ZINC001755536731	1440869915	/nfs/dbraw/zinc/86/99/15/1440869915.db2.gz	FUFKSAYAFFXTLQ-UHFFFAOYSA-N	0	3	336.435	3.038	20	30		EGEDHN
C#Cc1ccc(C(=O)NCC[C@@H](NCc2nccs2)C(C)C)cc1	ZINC001755552205	1440872405	/nfs/dbraw/zinc/87/24/05/1440872405.db2.gz	XLWWTHWMVJFKAJ-QGZVFWFLSA-N	0	3	341.480	3.059	20	30		EGEDHN
CCCC[C@H](C)C(=O)N(C)C[C@H](C)NCc1ccc(F)c(C#N)c1	ZINC001755585766	1440880479	/nfs/dbraw/zinc/88/04/79/1440880479.db2.gz	USNJBYDMFWFIIK-GJZGRUSLSA-N	0	3	333.451	3.460	20	30		EGEDHN
C[C@@H](CN(C)C(=O)CCCC1CC1)NCc1ccc(F)c(C#N)c1	ZINC001755602529	1440884567	/nfs/dbraw/zinc/88/45/67/1440884567.db2.gz	SSCVHZCYLFRRRM-AWEZNQCLSA-N	0	3	331.435	3.214	20	30		EGEDHN
C[C@@H]1[C@H](NCC#Cc2cccc(Cl)c2)CCN1C(=O)CC1CC1	ZINC001755649260	1440891209	/nfs/dbraw/zinc/89/12/09/1440891209.db2.gz	QRCGYJOJQZWSBG-RDTXWAMCSA-N	0	3	330.859	3.071	20	30		EGEDHN
Cc1cscc1C(=O)N1CC[C@@H](NCC#Cc2ccccc2)[C@H]1C	ZINC001755650631	1440891310	/nfs/dbraw/zinc/89/13/10/1440891310.db2.gz	OYIRCDDHVCKGIR-VQIMIIECSA-N	0	3	338.476	3.301	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)[C@H]1C	ZINC001755657955	1440892286	/nfs/dbraw/zinc/89/22/86/1440892286.db2.gz	DOFJFUAVQHBYGG-KDOFPFPSSA-N	0	3	329.419	3.133	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](NCc2cnn(C(C)(C)C)c2)C[C@@H]1C	ZINC001755680257	1440895115	/nfs/dbraw/zinc/89/51/15/1440895115.db2.gz	CNISDPTXOWMFSO-RDJZCZTQSA-N	0	3	332.492	3.073	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)COc2c(C)cccc2C)[C@@H]1C	ZINC001755722145	1440907916	/nfs/dbraw/zinc/90/79/16/1440907916.db2.gz	QUDWKSJYQSOSIH-ROUUACIJSA-N	0	3	330.472	3.227	20	30		EGEDHN
C=CCN(C)CCN(C(=O)[C@H]1COc2cc(C)c(C)cc21)C(C)C	ZINC001755814090	1440922268	/nfs/dbraw/zinc/92/22/68/1440922268.db2.gz	NZRDESPYZKDMKN-SFHVURJKSA-N	0	3	330.472	3.134	20	30		EGEDHN
C=C(C)CN(CCNC(=O)c1ccc(C)c(C)c1Cl)CCOC	ZINC001755841630	1440931864	/nfs/dbraw/zinc/93/18/64/1440931864.db2.gz	RDGGKIAREBRGFZ-UHFFFAOYSA-N	0	3	338.879	3.211	20	30		EGEDHN
Cc1ncsc1CN1CCC([C@H](C)NC(=O)C#CC(C)(C)C)CC1	ZINC001755848431	1440934063	/nfs/dbraw/zinc/93/40/63/1440934063.db2.gz	HQYPHTBFDJKDIW-AWEZNQCLSA-N	0	3	347.528	3.218	20	30		EGEDHN
CN(C)CCOc1ccccc1CNc1cc(C#N)ccc1[N+](=O)[O-]	ZINC000183766307	235219511	/nfs/dbraw/zinc/21/95/11/235219511.db2.gz	OFECAPGSFFWVMZ-UHFFFAOYSA-N	0	3	340.383	3.019	20	30		EGEDHN
C=CCC(C)(C)CNC(=O)N(Cc1ccco1)C1CCN(C)CC1	ZINC000297505239	202122465	/nfs/dbraw/zinc/12/24/65/202122465.db2.gz	VORVRCIEISTMQT-UHFFFAOYSA-N	0	3	333.476	3.488	20	30		EGEDHN
C[C@H](NC(=O)NCc1cccc(CN(C)C)c1)c1ccc(C#N)cc1	ZINC000031125327	202202491	/nfs/dbraw/zinc/20/24/91/202202491.db2.gz	QQGROLIMAFDGGO-HNNXBMFYSA-N	0	3	336.439	3.180	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H](CCCC)c2ccc(OC)cc2)CC1	ZINC000264169842	201210262	/nfs/dbraw/zinc/21/02/62/201210262.db2.gz	VVMATIPFYBFLIW-FQEVSTJZSA-N	0	3	342.483	3.388	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC[C@@H](Cc3ccccc3)[C@@H]2C)CC1	ZINC000266916837	201221024	/nfs/dbraw/zinc/22/10/24/201221024.db2.gz	BDXNUCVYERLMBX-HKUYNNGSSA-N	0	3	341.499	3.300	20	30		EGEDHN
COc1cccc([C@@H](CNc2ccc(C#N)c([N+](=O)[O-])c2)N(C)C)c1	ZINC000267924027	201224260	/nfs/dbraw/zinc/22/42/60/201224260.db2.gz	JUPVIKRDJJKDKK-GOSISDBHSA-N	0	3	340.383	3.190	20	30		EGEDHN
C#CCN1CCC(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)CC1	ZINC000263789046	201208429	/nfs/dbraw/zinc/20/84/29/201208429.db2.gz	IDRPSVDUWSTIFS-UHFFFAOYSA-N	0	3	344.886	3.223	20	30		EGEDHN
C#CCCCCC(=O)N(Cc1ccc(O)cc1)C[C@@H]1CCCN1CC	ZINC000271610786	201246160	/nfs/dbraw/zinc/24/61/60/201246160.db2.gz	VHCXWYNOGYVWMJ-IBGZPJMESA-N	0	3	342.483	3.399	20	30		EGEDHN
COCCN(CCN[C@@H](C)c1ccc(C#N)cc1)C(=O)OC(C)(C)C	ZINC000271890225	201247635	/nfs/dbraw/zinc/24/76/35/201247635.db2.gz	RSDZQCRAWMEQBC-HNNXBMFYSA-N	0	3	347.459	3.092	20	30		EGEDHN
C=CCCOCCNCc1ccc(OC)c(OCc2cccnc2)c1	ZINC000270263034	201237253	/nfs/dbraw/zinc/23/72/53/201237253.db2.gz	WGOPOBPLNPOMRB-UHFFFAOYSA-N	0	3	342.439	3.352	20	30		EGEDHN
C=C(C)COc1cccc(NC(=O)N2CC[C@H]3CCN(C)C[C@@H]32)c1	ZINC000272368061	201249290	/nfs/dbraw/zinc/24/92/90/201249290.db2.gz	GGCREYKBMTVZIV-QAPCUYQASA-N	0	3	329.444	3.199	20	30		EGEDHN
C=C(C)COc1cc(CN(C)CCc2cnccn2)ccc1OC	ZINC000272835930	201257551	/nfs/dbraw/zinc/25/75/51/201257551.db2.gz	QPAXYTVCJIEWTH-UHFFFAOYSA-N	0	3	327.428	3.115	20	30		EGEDHN
C#CCOc1ccccc1CNCCCCNC(=O)OC(C)(C)C	ZINC000272718930	201258271	/nfs/dbraw/zinc/25/82/71/201258271.db2.gz	WXCWPNZQDZKOJG-UHFFFAOYSA-N	0	3	332.444	3.093	20	30		EGEDHN
C=CCCCc1nc(-c2ccc(OCCN(C)C)c(OC)c2)no1	ZINC000273705631	201261938	/nfs/dbraw/zinc/26/19/38/201261938.db2.gz	HAYHSGRSOIOTMF-UHFFFAOYSA-N	0	3	331.416	3.194	20	30		EGEDHN
C=CCN1CCC(N[C@H](C)c2cc(Br)ncc2F)CC1	ZINC000273838965	201263702	/nfs/dbraw/zinc/26/37/02/201263702.db2.gz	HMFPZIVFEMFODH-LLVKDONJSA-N	0	3	342.256	3.284	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000274541641	201269067	/nfs/dbraw/zinc/26/90/67/201269067.db2.gz	BVBHHBGBGIGUKM-INIZCTEOSA-N	0	3	348.462	3.387	20	30		EGEDHN
N#Cc1sc(N2CCCN(Cc3ccccc3)CC2)nc1Cl	ZINC000278485150	201304851	/nfs/dbraw/zinc/30/48/51/201304851.db2.gz	GGXFZUABZXQNEJ-UHFFFAOYSA-N	0	3	332.860	3.380	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H](COC)[C@H]2CCCO2)cc1Cl	ZINC000278706534	201309864	/nfs/dbraw/zinc/30/98/64/201309864.db2.gz	RJSAKFRGIBNXCY-DOTOQJQBSA-N	0	3	325.836	3.188	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C[C@H](C)c2cccc(OC)c2)CC1	ZINC000084599922	201368435	/nfs/dbraw/zinc/36/84/35/201368435.db2.gz	JATMOZGFTNZJTC-INIZCTEOSA-N	0	3	330.472	3.346	20	30		EGEDHN
N#Cc1cccc(OC2CCN(C[C@@H](O)c3ccc(F)cc3)CC2)c1	ZINC000104713503	204115417	/nfs/dbraw/zinc/11/54/17/204115417.db2.gz	UIEDGUHYHJUSJG-HXUWFJFHSA-N	0	3	340.398	3.274	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H](C)Cc2ccc(C(C)C)cc2)CC1	ZINC000157105535	205162915	/nfs/dbraw/zinc/16/29/15/205162915.db2.gz	RJIKTQBHHWZXKW-QGZVFWFLSA-N	0	3	326.484	3.202	20	30		EGEDHN
CC[C@@H](CC#N)NC(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000157729690	205243042	/nfs/dbraw/zinc/24/30/42/205243042.db2.gz	AKLJGKKOBWLUQQ-INIZCTEOSA-N	0	3	344.459	3.365	20	30		EGEDHN
C[C@@H](CNC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)N(C)C	ZINC000264217264	246196533	/nfs/dbraw/zinc/19/65/33/246196533.db2.gz	IOUIJPOKWAQVLX-AWEZNQCLSA-N	0	3	338.411	3.422	20	30		EGEDHN
CC[C@@H](NCc1ccc(OC)c(C#N)c1)[C@H](O)c1c(F)cccc1F	ZINC000266307990	248238791	/nfs/dbraw/zinc/23/87/91/248238791.db2.gz	OSXAQIAMYHLCRJ-APWZRJJASA-N	0	3	346.377	3.447	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)c2cc(C#N)cs2)CCN1Cc1ccccc1	ZINC000177510990	207347120	/nfs/dbraw/zinc/34/71/20/207347120.db2.gz	SOEUPHDWDHVICF-YOEHRIQHSA-N	0	3	339.464	3.403	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2cc(C#N)cs2)CCN1Cc1ccccc1	ZINC000177510975	207347474	/nfs/dbraw/zinc/34/74/74/207347474.db2.gz	SOEUPHDWDHVICF-PBHICJAKSA-N	0	3	339.464	3.403	20	30		EGEDHN
COC[C@H](NC1CCN(Cc2ccc(C#N)cc2)CC1)c1ccco1	ZINC000181848839	533085645	/nfs/dbraw/zinc/08/56/45/533085645.db2.gz	NRELAKWNLOSZOF-IBGZPJMESA-N	0	3	339.439	3.093	20	30		EGEDHN
CN1CCN(CCCNc2ccc(C#N)cc2)[C@@H](c2ccccc2)C1	ZINC000356852169	141354628	/nfs/dbraw/zinc/35/46/28/141354628.db2.gz	WFFZELYPYWWSGD-OAQYLSRUSA-N	0	3	334.467	3.349	20	30		EGEDHN
N#Cc1cc(NC2CCN([C@@H]3CCOC3)CC2)ccc1C(F)(F)F	ZINC000373325303	144501991	/nfs/dbraw/zinc/50/19/91/144501991.db2.gz	OWLIYSQUYYSGPZ-OAHLLOKOSA-N	0	3	339.361	3.242	20	30		EGEDHN
CCN(CC)C(=O)C1(NCc2ccc(F)c(C#N)c2)CCCCC1	ZINC000121128574	152327694	/nfs/dbraw/zinc/32/76/94/152327694.db2.gz	HOYIWGKNNLUCLE-UHFFFAOYSA-N	0	3	331.435	3.358	20	30		EGEDHN
CC(C)C[C@]1(CO)CCCN1CC(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000191664133	153214593	/nfs/dbraw/zinc/21/45/93/153214593.db2.gz	JCEIIMRNDQJQEU-SFHVURJKSA-N	0	3	349.862	3.023	20	30		EGEDHN
CCCc1cccc(CN[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)c1	ZINC000192241447	153246751	/nfs/dbraw/zinc/24/67/51/153246751.db2.gz	YNBWIMDNFTVVDE-OAQYLSRUSA-N	0	3	347.462	3.401	20	30		EGEDHN
COc1cc(CN(CC(=O)N2CCCCCC2)C(C)C)ccc1C#N	ZINC000348851369	156262862	/nfs/dbraw/zinc/26/28/62/156262862.db2.gz	ZBZKUPUUICTKCY-UHFFFAOYSA-N	0	3	343.471	3.180	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)Cc1cc(F)ccc1F	ZINC000348901892	156282140	/nfs/dbraw/zinc/28/21/40/156282140.db2.gz	ATXJJPVBPFMJKI-UHFFFAOYSA-N	0	3	329.394	3.400	20	30		EGEDHN
Cc1cccn2c(CN(CCN(C)C)Cc3ccc(C#N)cc3)cnc12	ZINC000348933644	156293122	/nfs/dbraw/zinc/29/31/22/156293122.db2.gz	JJZUPTPEPPWXNL-UHFFFAOYSA-N	0	3	347.466	3.078	20	30		EGEDHN
COc1ccc(CN(CCN(C)C)Cc2ccc(F)cc2)cc1C#N	ZINC000349041637	156329095	/nfs/dbraw/zinc/32/90/95/156329095.db2.gz	VTNHRGGFDJVFLR-UHFFFAOYSA-N	0	3	341.430	3.270	20	30		EGEDHN
Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@H]1N2C(=O)c1ccc(C#N)cc1	ZINC000024060876	292355503	/nfs/dbraw/zinc/35/55/03/292355503.db2.gz	QYMDIFHQTYTRQT-AZUAARDMSA-N	0	3	331.419	3.315	20	30		EGEDHN
C[C@@H](CN1C[C@H](C)C[C@@H](C)C1)NC(=O)CSc1ccc(C#N)cc1	ZINC000343384703	286850887	/nfs/dbraw/zinc/85/08/87/286850887.db2.gz	ARSHERLBQJCADD-OAGGEKHMSA-N	0	3	345.512	3.133	20	30		EGEDHN
Cc1cc(CN2CCC[C@@H](CNC(=O)c3ccco3)C2)ccc1C#N	ZINC000338343968	163217583	/nfs/dbraw/zinc/21/75/83/163217583.db2.gz	CPCRZZAJFCQEFZ-KRWDZBQOSA-N	0	3	337.423	3.102	20	30		EGEDHN
CNc1ccc(C#N)cc1NC(=O)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000351674892	165127686	/nfs/dbraw/zinc/12/76/86/165127686.db2.gz	RLMRCCPPDBNCPN-SFHVURJKSA-N	0	3	348.450	3.451	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)[C@@H]1CCCC1(C)C	ZINC000355368802	166176804	/nfs/dbraw/zinc/17/68/04/166176804.db2.gz	LRPBDYKVKBKPDP-SFHVURJKSA-N	0	3	327.472	3.275	20	30		EGEDHN
CN(C)C[C@@H](NC(=O)c1cc(C#N)ccc1Cl)c1ccc(F)cc1	ZINC000360206926	167270458	/nfs/dbraw/zinc/27/04/58/167270458.db2.gz	CYRNKRULYJCEEM-QGZVFWFLSA-N	0	3	345.805	3.383	20	30		EGEDHN
Cc1cc(C#N)cc(NC[C@@H]2CCCN(Cc3cccs3)C2)n1	ZINC000367662077	168256416	/nfs/dbraw/zinc/25/64/16/168256416.db2.gz	AVUBDUUGQZAPPE-HNNXBMFYSA-N	0	3	326.469	3.069	20	30		EGEDHN
C[C@@H]1CCN(C)CCN1C(=O)Nc1ccc(OC(C)(C)C)c(C#N)c1	ZINC000455761868	269855220	/nfs/dbraw/zinc/85/52/20/269855220.db2.gz	ADODNKJHLIBRSZ-CQSZACIVSA-N	0	3	344.459	3.293	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCN(CCCc3cccc(F)c3)C2)nc1	ZINC000428813934	269967025	/nfs/dbraw/zinc/96/70/25/269967025.db2.gz	QVJFWRTZQLVTHS-GOSISDBHSA-N	0	3	325.387	3.178	20	30		EGEDHN
N#Cc1ccc(CN[C@@H](c2ccccc2)C2(CO)CCOCC2)s1	ZINC000414542360	270047100	/nfs/dbraw/zinc/04/71/00/270047100.db2.gz	RGVMNPZKGGCNJQ-SFHVURJKSA-N	0	3	342.464	3.240	20	30		EGEDHN
CCc1ccccc1[C@@H](N)CNC(=O)N[C@H](C)c1ccc(C#N)cc1	ZINC000417108000	270047710	/nfs/dbraw/zinc/04/77/10/270047710.db2.gz	IDBNVHQKKOLVHX-KUHUBIRLSA-N	0	3	336.439	3.181	20	30		EGEDHN
CCOC(=O)N1CCC(N[C@@H](C)c2ccc(C#N)cc2Cl)CC1	ZINC000279182153	266257099	/nfs/dbraw/zinc/25/70/99/266257099.db2.gz	VQTXHPVNGJTDEA-LBPRGKRZSA-N	0	3	335.835	3.483	20	30		EGEDHN
COc1cc(C#N)ccc1CN[C@H](C)[C@@H]1OCCc2sccc21	ZINC000292556065	266784739	/nfs/dbraw/zinc/78/47/39/266784739.db2.gz	YYPPTZZJLLLQPW-XIKOKIGWSA-N	0	3	328.437	3.420	20	30		EGEDHN
COc1cc(C#N)ccc1CN[C@@H](C)[C@@H]1OCCc2sccc21	ZINC000292556059	266785185	/nfs/dbraw/zinc/78/51/85/266785185.db2.gz	YYPPTZZJLLLQPW-SGTLLEGYSA-N	0	3	328.437	3.420	20	30		EGEDHN
CC1(C)CN(CC(=O)NCc2ccc(C#N)cc2)C[C@@H]1c1ccccc1	ZINC000441068848	266971804	/nfs/dbraw/zinc/97/18/04/266971804.db2.gz	VUELRRPKSSFLAK-HXUWFJFHSA-N	0	3	347.462	3.300	20	30		EGEDHN
CCCOc1c(OC)cc(CCNCc2ccc(C#N)o2)cc1OC	ZINC000449484861	267026988	/nfs/dbraw/zinc/02/69/88/267026988.db2.gz	JSYXBPQMWCFPSZ-UHFFFAOYSA-N	0	3	344.411	3.290	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1Nc1nccc(C#N)c1Cl	ZINC000398014154	267055844	/nfs/dbraw/zinc/05/58/44/267055844.db2.gz	FIVHHSGKHSFXAE-RHSMWYFYSA-N	0	3	340.858	3.351	20	30		EGEDHN
C[C@H](CC(=O)c1ccccc1)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000350360667	267148397	/nfs/dbraw/zinc/14/83/97/267148397.db2.gz	BRLZMAYKAYNUTO-DNVCBOLYSA-N	0	3	345.402	3.018	20	30		EGEDHN
C[C@H](CNC(=O)c1cc(C#N)ccc1Cl)N(C)Cc1ccccc1	ZINC000286141398	267160408	/nfs/dbraw/zinc/16/04/08/267160408.db2.gz	VOAXRNOCXMCSNT-CQSZACIVSA-N	0	3	341.842	3.462	20	30		EGEDHN
C[C@H](NCCOc1cccc(C#N)c1)[C@H]1OCCc2sccc21	ZINC000292479245	267184096	/nfs/dbraw/zinc/18/40/96/267184096.db2.gz	RZSJEYRQYVEKSU-SCLBCKFNSA-N	0	3	328.437	3.291	20	30		EGEDHN
C[C@H]1c2ccccc2CCN1C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000280544557	267254251	/nfs/dbraw/zinc/25/42/51/267254251.db2.gz	TYAMPOLHHDOMQM-HNAYVOBHSA-N	0	3	329.403	3.386	20	30		EGEDHN
CN(C)C[C@@H](NC(=O)/C=C/c1ccc(C#N)cc1)c1ccc(F)cc1	ZINC000493379543	267281969	/nfs/dbraw/zinc/28/19/69/267281969.db2.gz	FLJDYNYEHNMGBK-LKQLOZHYSA-N	0	3	337.398	3.130	20	30		EGEDHN
CN(C)[C@H](CNc1ccc(C(F)(F)F)c(C#N)n1)c1ccccc1	ZINC000443408854	267287514	/nfs/dbraw/zinc/28/75/14/267287514.db2.gz	LVZOSESGAFUOQN-OAHLLOKOSA-N	0	3	334.345	3.109	20	30		EGEDHN
CN(C)[C@H](CNc1ccc(C(F)(F)F)c(C#N)n1)c1cccs1	ZINC000443407275	267288257	/nfs/dbraw/zinc/28/82/57/267288257.db2.gz	CQHLISCWWCQJJM-GFCCVEGCSA-N	0	3	340.374	3.170	20	30		EGEDHN
CN(Cc1cccc(F)c1C#N)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000428427504	267319594	/nfs/dbraw/zinc/31/95/94/267319594.db2.gz	QQKIPTVUOGPEEY-PXNSSMCTSA-N	0	3	338.430	3.217	20	30		EGEDHN
C[C@H](NC(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1)[C@H](c1ccccc1)N(C)C	ZINC000412249359	267850669	/nfs/dbraw/zinc/85/06/69/267850669.db2.gz	CDTPJYUZGNGWOX-JWOSDPRPSA-N	0	3	347.462	3.469	20	30		EGEDHN
Cc1cc(NC(=O)Nc2ccc(C#N)cc2)ccc1OCCN(C)C	ZINC000414403769	268010422	/nfs/dbraw/zinc/01/04/22/268010422.db2.gz	RURXEMDCTFCYRI-UHFFFAOYSA-N	0	3	338.411	3.451	20	30		EGEDHN
Cc1ccc(C#N)cc1S(=O)(=O)[N-]c1ccc(C[NH+](C)C)cc1C	ZINC000414459547	268030423	/nfs/dbraw/zinc/03/04/23/268030423.db2.gz	LUMPRIYLFGVXJS-UHFFFAOYSA-N	0	3	343.452	3.038	20	30		EGEDHN
Cc1ccc([C@@H]2CCCN2C[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000484588630	268043938	/nfs/dbraw/zinc/04/39/38/268043938.db2.gz	GCOUNBSLWDMUIC-CTNGQTDRSA-N	0	3	336.435	3.444	20	30		EGEDHN
N#Cc1ccc(CN(CCC(=O)Nc2ccc(C#N)cc2)C2CC2)cc1	ZINC000194967945	268062651	/nfs/dbraw/zinc/06/26/51/268062651.db2.gz	JTMITUGEQJEYEW-UHFFFAOYSA-N	0	3	344.418	3.423	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CCC=C(c3ccco3)C2)cc1	ZINC000288125464	268083349	/nfs/dbraw/zinc/08/33/49/268083349.db2.gz	BXZFVSAWILVGJJ-SFHVURJKSA-N	0	3	331.375	3.149	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@H]2CCCc3c(O)cccc32)cc1	ZINC000352084420	268092480	/nfs/dbraw/zinc/09/24/80/268092480.db2.gz	KSYTUWPFIYFAFJ-APWZRJJASA-N	0	3	345.402	3.140	20	30		EGEDHN
N#Cc1ccc(Cl)cc1NC[C@@H](O)CN1CCc2ccccc2C1	ZINC000301162099	268101924	/nfs/dbraw/zinc/10/19/24/268101924.db2.gz	CKGIVIBGUCAQCY-GOSISDBHSA-N	0	3	341.842	3.043	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCN(C[C@H]3CCC4(CCCCC4)O3)C2)nc1	ZINC000330223042	268184606	/nfs/dbraw/zinc/18/46/06/268184606.db2.gz	ACHPVOMBYUYZGV-ZWKOTPCHSA-N	0	3	341.455	3.288	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN[C@H](c2ccccc2)C2(CO)CCC2)cc1	ZINC000292553216	268213075	/nfs/dbraw/zinc/21/30/75/268213075.db2.gz	ALCMWCFAXFABKN-VQTJNVASSA-N	0	3	336.435	3.085	20	30		EGEDHN
N#Cc1ccc([N+](=O)[O-])c(NCC2(N3CCSCC3)CCCC2)c1	ZINC000302194567	268217187	/nfs/dbraw/zinc/21/71/87/268217187.db2.gz	DFPMSQHZYFHMRF-UHFFFAOYSA-N	0	3	346.456	3.240	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN2CCS[C@H]3CCCC[C@H]32)c1	ZINC000333205396	268265102	/nfs/dbraw/zinc/26/51/02/268265102.db2.gz	AKTFOSUTGWGGSD-SJORKVTESA-N	0	3	329.469	3.247	20	30		EGEDHN
COc1cc(CN2CCCN3c4ccccc4C[C@@H]3C2)ccc1C#N	ZINC000356373431	274093769	/nfs/dbraw/zinc/09/37/69/274093769.db2.gz	VPRSMUGWQQQTHQ-LJQANCHMSA-N	0	3	333.435	3.204	20	30		EGEDHN
CCC[C@H](C)C(=O)NCCN[C@H]1CCCCc2cc(C#N)ccc21	ZINC000340420917	276039669	/nfs/dbraw/zinc/03/96/69/276039669.db2.gz	SAGJCIMICMGWIT-KXBFYZLASA-N	0	3	327.472	3.468	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)NC1(CN(C)C)CCC1	ZINC000352801138	280261561	/nfs/dbraw/zinc/26/15/61/280261561.db2.gz	RGYNVZQDZKZQDG-UHFFFAOYSA-N	0	3	327.453	3.296	20	30		EGEDHN
Cc1ccccc1CN1CCC(NC(=O)Nc2cccc(C#N)n2)CC1	ZINC000516180076	312312825	/nfs/dbraw/zinc/31/28/25/312312825.db2.gz	WSXVEVCVXRPFDY-UHFFFAOYSA-N	0	3	349.438	3.048	20	30		EGEDHN
COC(=O)c1cccc(CN(C)[C@H]2CCc3ccccc3C2)c1C#N	ZINC000535205522	314032540	/nfs/dbraw/zinc/03/25/40/314032540.db2.gz	IJTINOCOHMVWIV-SFHVURJKSA-N	0	3	334.419	3.334	20	30		EGEDHN
C[C@H](NCC(=O)NCc1cccc(C#N)c1)C(C)(C)c1ccccc1	ZINC000539256170	314303470	/nfs/dbraw/zinc/30/34/70/314303470.db2.gz	WCAUZVNECUZPQX-INIZCTEOSA-N	0	3	335.451	3.130	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)N(C)[C@H]1CCN(C)C[C@H]1C	ZINC000551409245	315153009	/nfs/dbraw/zinc/15/30/09/315153009.db2.gz	MLDFVNDQTBFOSM-WBMJQRKESA-N	0	3	341.480	3.494	20	30		EGEDHN
CN(Cc1cnc2c(C#N)cnn2c1)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000565775160	316368515	/nfs/dbraw/zinc/36/85/15/316368515.db2.gz	IJYSKCPZCOBBNJ-RBUKOAKNSA-N	0	3	331.423	3.369	20	30		EGEDHN
CS[C@@H]1CN(c2c(C#N)cnc3c(Cl)cccc32)C[C@H]1N(C)C	ZINC000567749117	316669097	/nfs/dbraw/zinc/66/90/97/316669097.db2.gz	UTEIFRUBQJSQBE-HUUCEWRRSA-N	0	3	346.887	3.242	20	30		EGEDHN
COCCCCN(Cc1ccccc1)Cc1cnc2c(C#N)cnn2c1	ZINC000570570852	317075451	/nfs/dbraw/zinc/07/54/51/317075451.db2.gz	CTRXYBDYDBPZEI-UHFFFAOYSA-N	0	3	349.438	3.030	20	30		EGEDHN
N#Cc1ccccc1-c1ccc(CN[C@H]2CCC(=O)N[C@H]2C2CC2)cc1	ZINC000572003913	317277719	/nfs/dbraw/zinc/27/77/19/317277719.db2.gz	XRKAKZGVZNCVPA-UNMCSNQZSA-N	0	3	345.446	3.372	20	30		EGEDHN
COCC(C)(C)NCC(=O)Nc1ccccc1S[C@@H](C)CC#N	ZINC000178599950	454964059	/nfs/dbraw/zinc/96/40/59/454964059.db2.gz	AYYSCRKOOZHVHB-ZDUSSCGKSA-N	0	3	335.473	3.034	20	30		EGEDHN
C[C@H](NCCOc1ccccc1C#N)c1ccc(-n2cccn2)cc1	ZINC000180852764	323459767	/nfs/dbraw/zinc/45/97/67/323459767.db2.gz	YJWDWNIGUDSTJN-INIZCTEOSA-N	0	3	332.407	3.474	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CN[C@H]1CCCc2sccc21	ZINC000390722738	324283061	/nfs/dbraw/zinc/28/30/61/324283061.db2.gz	MCSFCPBGYNGJHO-ZBFHGGJFSA-N	0	3	328.437	3.027	20	30		EGEDHN
C[C@@]1(Cc2ccc(F)cc2)CCCN1Cc1cnc2c(C#N)cnn2c1	ZINC000580564654	325268126	/nfs/dbraw/zinc/26/81/26/325268126.db2.gz	CTELTJARBUULDI-FQEVSTJZSA-N	0	3	349.413	3.337	20	30		EGEDHN
N#Cc1ccc([C@H](N[C@H]2CC[C@H](c3ccc(F)cc3)C2)C(N)=O)cc1	ZINC000580987023	325317223	/nfs/dbraw/zinc/31/72/23/325317223.db2.gz	BQSBMUIDSKDECO-WDSOQIARSA-N	0	3	337.398	3.150	20	30		EGEDHN
C=CCN1CCC(NC(=O)CCc2ccc(OCCC)cc2)CC1	ZINC000173101759	455231690	/nfs/dbraw/zinc/23/16/90/455231690.db2.gz	UMTJXLOLHCMBPF-UHFFFAOYSA-N	0	3	330.472	3.175	20	30		EGEDHN
CCN(CC)C(=O)CCC1CCN(Cc2cc(C#N)cs2)CC1	ZINC000180772536	455242573	/nfs/dbraw/zinc/24/25/73/455242573.db2.gz	UCEZKYQAAKGBGO-UHFFFAOYSA-N	0	3	333.501	3.480	20	30		EGEDHN
C=C(C)CS(=O)(=O)NC[C@H](CC(C)C)N[C@H](C)c1ccccc1	ZINC000477600479	459050641	/nfs/dbraw/zinc/05/06/41/459050641.db2.gz	IFYVKKKKRLYAPA-AEFFLSMTSA-N	0	3	338.517	3.247	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCc2cc(C(CC)CC)no2)CC1	ZINC000173199111	455246646	/nfs/dbraw/zinc/24/66/46/455246646.db2.gz	LEMCHCNAGJBLEQ-UHFFFAOYSA-N	0	3	334.464	3.028	20	30		EGEDHN
C[C@@](C#N)(NC(=O)CN[C@@H](c1cccc(F)c1)C1CCCC1)C1CC1	ZINC000181000451	455274329	/nfs/dbraw/zinc/27/43/29/455274329.db2.gz	LADPLQXHAAUZQZ-UXHICEINSA-N	0	3	343.446	3.455	20	30		EGEDHN
C[C@@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccc(OCC#N)cc1	ZINC000183317585	455276360	/nfs/dbraw/zinc/27/63/60/455276360.db2.gz	XTVQICWMAHDDGL-GDBMZVCRSA-N	0	3	345.443	3.249	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@H]1CCC[C@H]1NCc1ccc(OCC#N)cc1	ZINC000183318108	455276718	/nfs/dbraw/zinc/27/67/18/455276718.db2.gz	UKVAQIZYMVFVCS-SJORKVTESA-N	0	3	345.443	3.124	20	30		EGEDHN
N#CCN1CCC(NCc2cc(Br)c(Cl)s2)CC1	ZINC000616473445	460564901	/nfs/dbraw/zinc/56/49/01/460564901.db2.gz	NRTFFPMETVDNCG-UHFFFAOYSA-N	0	3	348.697	3.242	20	30		EGEDHN
C=CCOc1c(Cl)cc(CNC[C@H](CO)C(C)C)cc1OC	ZINC000623525024	460596652	/nfs/dbraw/zinc/59/66/52/460596652.db2.gz	SSTIJPCBRVLKEX-CQSZACIVSA-N	0	3	327.852	3.268	20	30		EGEDHN
N#Cc1ccc(OCCN2CCC(C(=O)Nc3ccccc3)CC2)cc1	ZINC000015550863	453576007	/nfs/dbraw/zinc/57/60/07/453576007.db2.gz	NRUFZBAQCMOHRP-UHFFFAOYSA-N	0	3	349.434	3.288	20	30		EGEDHN
C=CCC1(NCc2ncc(Br)cc2F)CCOCC1	ZINC000623564540	460614633	/nfs/dbraw/zinc/61/46/33/460614633.db2.gz	IKNQMROMTRDWKV-UHFFFAOYSA-N	0	3	329.213	3.198	20	30		EGEDHN
CCCNC(=O)c1cccc(CN[C@@H](C)CC2(C#N)CCOCC2)c1	ZINC000600848828	460620889	/nfs/dbraw/zinc/62/08/89/460620889.db2.gz	KICWGTWREFQWDT-INIZCTEOSA-N	0	3	343.471	3.015	20	30		EGEDHN
C=CCNC(=O)[C@@H](C)N1CCC(c2c[nH]c3ccc(OC)cc32)CC1	ZINC000066436622	453844935	/nfs/dbraw/zinc/84/49/35/453844935.db2.gz	ANGOFBJDVBJKTF-CQSZACIVSA-N	0	3	341.455	3.047	20	30		EGEDHN
C[C@H](CN(C)[C@@H]1CCN(c2ccc(C#N)cc2)C1=O)c1ccccc1	ZINC000066853872	453881098	/nfs/dbraw/zinc/88/10/98/453881098.db2.gz	GFBNKTSKCLWZDV-OXQOHEQNSA-N	0	3	333.435	3.399	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(C)c(Br)c2)CC1	ZINC000067144399	453906419	/nfs/dbraw/zinc/90/64/19/453906419.db2.gz	VGXCHPWAEKJLDI-UHFFFAOYSA-N	0	3	335.245	3.041	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN(C)[C@H](CCO)c1ccccc1	ZINC000075898803	453937688	/nfs/dbraw/zinc/93/76/88/453937688.db2.gz	LPXXDGCDCUXXBN-GOSISDBHSA-N	0	3	340.423	3.001	20	30		EGEDHN
COc1ccc(CNCCc2cscn2)cc1OCCCC#N	ZINC000076331625	453989141	/nfs/dbraw/zinc/98/91/41/453989141.db2.gz	XFMGIJCLSSBBLS-UHFFFAOYSA-N	0	3	331.441	3.167	20	30		EGEDHN
Cc1cc(O)c(CN2CCN(c3cccc(F)c3C#N)CC2)cc1C	ZINC000042094753	453993565	/nfs/dbraw/zinc/99/35/65/453993565.db2.gz	XTAIWVWVRDPQDQ-UHFFFAOYSA-N	0	3	339.414	3.342	20	30		EGEDHN
CN(C)CCN(Cc1cccc(F)c1)C(=O)c1cccc(CC#N)c1	ZINC000068313489	454016280	/nfs/dbraw/zinc/01/62/80/454016280.db2.gz	HZWWCDLAYDAMSW-UHFFFAOYSA-N	0	3	339.414	3.096	20	30		EGEDHN
CCN(Cc1cc(=O)n2ccccc2n1)[C@H](C)c1ccc(C#N)cc1	ZINC000042741785	454022984	/nfs/dbraw/zinc/02/29/84/454022984.db2.gz	XWXRWWDQMYFCEB-OAHLLOKOSA-N	0	3	332.407	3.149	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N(C)[C@H](C)c1ccccn1)C(C)C	ZINC000068583914	454039817	/nfs/dbraw/zinc/03/98/17/454039817.db2.gz	CWDPCGYENCMTDM-MJGOQNOKSA-N	0	3	344.503	3.483	20	30		EGEDHN
C[C@@H](CNc1c(C#N)nnc2ccccc21)N1CCc2ccccc2C1	ZINC000077188991	454072915	/nfs/dbraw/zinc/07/29/15/454072915.db2.gz	NNEUUZNIUKUERF-HNNXBMFYSA-N	0	3	343.434	3.360	20	30		EGEDHN
C[C@H](CNC(=O)c1ccccc1-c1ccccc1C#N)N(C)C1CC1	ZINC000057715668	454143075	/nfs/dbraw/zinc/14/30/75/454143075.db2.gz	SXZJUBVNCOMHSS-OAHLLOKOSA-N	0	3	333.435	3.438	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000119570935	454204557	/nfs/dbraw/zinc/20/45/57/454204557.db2.gz	FOQBXMSSFQOXOU-UHFFFAOYSA-N	0	3	335.473	3.451	20	30		EGEDHN
CC[C@H](NC[C@@H](O)c1ccc(C#N)cc1)c1ccc2c(c1)OCCO2	ZINC000095984562	454251006	/nfs/dbraw/zinc/25/10/06/454251006.db2.gz	LNMLDUQBCZYEMI-ZWKOTPCHSA-N	0	3	338.407	3.104	20	30		EGEDHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)CCc1ccc(C#N)cc1	ZINC000182102184	455435931	/nfs/dbraw/zinc/43/59/31/455435931.db2.gz	URGNECOEXRYXIT-QGZVFWFLSA-N	0	3	335.451	3.128	20	30		EGEDHN
Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@H]1N2C(=O)c1cccc(C#N)c1	ZINC000060847987	454317558	/nfs/dbraw/zinc/31/75/58/454317558.db2.gz	IHDKNOVCDDJDNJ-AZUAARDMSA-N	0	3	331.419	3.315	20	30		EGEDHN
C=CCCOCCNCC1=Cc2cc(Br)ccc2OC1	ZINC000120843219	454354461	/nfs/dbraw/zinc/35/44/61/454354461.db2.gz	KNRLQGHXCQKWNX-UHFFFAOYSA-N	0	3	338.245	3.407	20	30		EGEDHN
CC[C@@H](N[C@H]1CCCN(c2ccc(C#N)cc2F)C1)c1cnn(C)c1	ZINC000097016869	454387328	/nfs/dbraw/zinc/38/73/28/454387328.db2.gz	PRNBPWOIAQJXHT-FUHWJXTLSA-N	0	3	341.434	3.141	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN2CCC[C@H]2C(C)C)cc1	ZINC000063618768	454430708	/nfs/dbraw/zinc/43/07/08/454430708.db2.gz	IVGIFWRRCRZHQI-IBGZPJMESA-N	0	3	343.471	3.452	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2oc(-c3ccccc3)nc2C)CC1	ZINC000073437114	454435885	/nfs/dbraw/zinc/43/58/85/454435885.db2.gz	PCKKIPSPHHPIQZ-UHFFFAOYSA-N	0	3	339.439	3.420	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN(CCc1ccccc1)C1CCCC1	ZINC000063754689	454444378	/nfs/dbraw/zinc/44/43/78/454444378.db2.gz	DNXVWYVFTNXUFS-GOSISDBHSA-N	0	3	341.499	3.482	20	30		EGEDHN
C=CCc1cc(CN2CC[C@@H](C)[C@@H](n3ccnc3)C2)cc(OC)c1O	ZINC000091960229	454495190	/nfs/dbraw/zinc/49/51/90/454495190.db2.gz	ZOORBVLCWJIVIH-QAPCUYQASA-N	0	3	341.455	3.409	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)c2ccc(NC(=O)NC(C)C)cc2)n1	ZINC000048789581	454516037	/nfs/dbraw/zinc/51/60/37/454516037.db2.gz	KGJYKUINLIBDRV-AWEZNQCLSA-N	0	3	342.424	3.472	20	30		EGEDHN
C=CCOc1ccc(CN(C)C[C@H]2CCN(C(C)=O)C2)cc1Cl	ZINC000092100353	454522889	/nfs/dbraw/zinc/52/28/89/454522889.db2.gz	JPXQAVWVLMXLJT-MRXNPFEDSA-N	0	3	336.863	3.205	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN1CCC[C@@H](Cc2ccc(C)cc2)C1	ZINC000065261220	454545528	/nfs/dbraw/zinc/54/55/28/454545528.db2.gz	SRPUPVJCYVDQKT-FQEVSTJZSA-N	0	3	326.484	3.450	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc3oc(C(C)(C)C)nc3c2)CC1	ZINC000050029415	454569558	/nfs/dbraw/zinc/56/95/58/454569558.db2.gz	WBWKMMPDQFYXKS-UHFFFAOYSA-N	0	3	339.439	3.409	20	30		EGEDHN
CC1CCN([C@H](CNC(=O)C2(C#N)CCC2)c2ccccc2)CC1	ZINC000134661632	454576583	/nfs/dbraw/zinc/57/65/83/454576583.db2.gz	BTTQHKSUWLTAPS-GOSISDBHSA-N	0	3	325.456	3.270	20	30		EGEDHN
C=CCSCCN[C@H](c1ccc(Cl)cc1)[C@@H]1CN(C)CCO1	ZINC000134767584	454586620	/nfs/dbraw/zinc/58/66/20/454586620.db2.gz	FQQLHFMIMJNJKX-DLBZAZTESA-N	0	3	340.920	3.221	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)CN[C@H](c1ccc(F)cc1)C1CCC1	ZINC000104706127	454596475	/nfs/dbraw/zinc/59/64/75/454596475.db2.gz	NCAREDPPXXZWNF-OALUTQOASA-N	0	3	331.435	3.311	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)NCc2cccc(C#N)c2)CN1Cc1ccccc1	ZINC000123090152	454600850	/nfs/dbraw/zinc/60/08/50/454600850.db2.gz	XPHVBZGGZZMZFI-OXJNMPFZSA-N	0	3	348.450	3.020	20	30		EGEDHN
C[C@@H](c1ccc(-n2cncn2)cc1)N(C)CCOc1cccc(C#N)c1	ZINC000051855673	454639060	/nfs/dbraw/zinc/63/90/60/454639060.db2.gz	CVAIYINWWFKZJF-INIZCTEOSA-N	0	3	347.422	3.211	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccccc2C(F)(F)F)CC1	ZINC000106037549	454674400	/nfs/dbraw/zinc/67/44/00/454674400.db2.gz	OMWCBCQAYFOFQD-UHFFFAOYSA-N	0	3	326.362	3.476	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(-c3ccco3)nc2C)CC1	ZINC000106035371	454674745	/nfs/dbraw/zinc/67/47/45/454674745.db2.gz	LQAYNIBFYMTLRW-UHFFFAOYSA-N	0	3	339.439	3.420	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC1CCN(Cc2cccc(C)c2)CC1	ZINC000066316639	454684043	/nfs/dbraw/zinc/68/40/43/454684043.db2.gz	FEZHHGGWXVUVKD-QGZVFWFLSA-N	0	3	330.472	3.057	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cccc(NC(C)=O)c2C)CC1	ZINC000106319155	454690632	/nfs/dbraw/zinc/69/06/32/454690632.db2.gz	BWQGYPFLAUZROO-UHFFFAOYSA-N	0	3	344.459	3.115	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Cc2ccc(OCC(C)C)cc2)CC1	ZINC000106774788	454718104	/nfs/dbraw/zinc/71/81/04/454718104.db2.gz	VUXMSSUKFZRCGT-UHFFFAOYSA-N	0	3	344.499	3.421	20	30		EGEDHN
N#CC(C(=O)c1ccnc(OCC(F)F)c1)c1nc2ccccc2[nH]1	ZINC000136106659	454720427	/nfs/dbraw/zinc/72/04/27/454720427.db2.gz	MDCNTAHZVQLGJE-LLVKDONJSA-N	0	3	342.305	3.092	20	30		EGEDHN
CN(CCC(=O)OC(C)(C)C)Cc1ccc(N(C)CCC#N)cc1	ZINC000093686718	454728926	/nfs/dbraw/zinc/72/89/26/454728926.db2.gz	IGCOCRIDOMFRGZ-UHFFFAOYSA-N	0	3	331.460	3.200	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CNC1(c2ccc(F)cc2)CCCC1	ZINC000107899473	454776349	/nfs/dbraw/zinc/77/63/49/454776349.db2.gz	YNQXFLZNALODSM-OAHLLOKOSA-N	0	3	331.435	3.193	20	30		EGEDHN
COc1ccc(CNc2ccc(OCCN(C)C)cc2)cc1C#N	ZINC000124986966	454788222	/nfs/dbraw/zinc/78/82/22/454788222.db2.gz	AWURGVAWWPVSDX-UHFFFAOYSA-N	0	3	325.412	3.119	20	30		EGEDHN
C[C@H](CC#N)Sc1ccccc1NC(=O)CN[C@@H](C)[C@@H]1CCOC1	ZINC000162755036	454798642	/nfs/dbraw/zinc/79/86/42/454798642.db2.gz	PNXSBMVFNGMXFD-QLFBSQMISA-N	0	3	347.484	3.034	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN(Cc1ccccn1)C1CC1	ZINC000177511176	454872115	/nfs/dbraw/zinc/87/21/15/454872115.db2.gz	STQIGBNIEPMCSX-UHFFFAOYSA-N	0	3	326.425	3.008	20	30		EGEDHN
CCN(CCC#N)C(=O)CN[C@H](Cc1ccccc1)c1cccs1	ZINC000184995791	455484071	/nfs/dbraw/zinc/48/40/71/455484071.db2.gz	FYHIGJDMKMDALU-QGZVFWFLSA-N	0	3	341.480	3.384	20	30		EGEDHN
C=CC[C@@H](C)[C@H](C)NCc1ccccc1S(=O)(=O)NC(C)(C)C	ZINC000155099291	454962829	/nfs/dbraw/zinc/96/28/29/454962829.db2.gz	IGBHTJNIJXQKHT-CABCVRRESA-N	0	3	338.517	3.454	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H]2c3ccccc3CC[C@H]2C)CC1	ZINC000179357234	455038076	/nfs/dbraw/zinc/03/80/76/455038076.db2.gz	OSHUVDSRYPWCMJ-BEFAXECRSA-N	0	3	327.472	3.260	20	30		EGEDHN
C=C(C)COc1cc(CN2CCC[C@H](C3OCCO3)C2)ccc1OC	ZINC000179375248	455040988	/nfs/dbraw/zinc/04/09/88/455040988.db2.gz	PFWIGHFVLLIWQM-KRWDZBQOSA-N	0	3	347.455	3.235	20	30		EGEDHN
CC[C@@H](C)CN(C)CC(=O)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000171949226	455103198	/nfs/dbraw/zinc/10/31/98/455103198.db2.gz	SJHIUBSAAUXRDQ-CQSZACIVSA-N	0	3	340.389	3.151	20	30		EGEDHN
C#CCOc1ccc(CNCc2cccc(CN3CCCC3=O)c2)cc1	ZINC000172113768	455123680	/nfs/dbraw/zinc/12/36/80/455123680.db2.gz	XTYJFXUUKIVGQW-UHFFFAOYSA-N	0	3	348.446	3.111	20	30		EGEDHN
C=CCSCCNC(=O)NC1CCN([C@@H](C)c2ccccc2)CC1	ZINC000172124868	455125460	/nfs/dbraw/zinc/12/54/60/455125460.db2.gz	MMTISEZMDJWGQW-INIZCTEOSA-N	0	3	347.528	3.430	20	30		EGEDHN
CC[C@H]1CN(Cc2cn(C)nc2-c2ccc(C#N)cc2)CCS1	ZINC000180172330	455144447	/nfs/dbraw/zinc/14/44/47/455144447.db2.gz	PPOXIQBLCNOZHT-KRWDZBQOSA-N	0	3	326.469	3.286	20	30		EGEDHN
CC1(C)[C@H](O)C[C@@H]1NCc1cccc(OCc2cccc(C#N)c2)c1	ZINC000189327742	455177412	/nfs/dbraw/zinc/17/74/12/455177412.db2.gz	KOUVYXLAFGHOBZ-VQTJNVASSA-N	0	3	336.435	3.386	20	30		EGEDHN
CC[C@@H]1CN([C@H](C)C(=O)N(C)CCC#N)CC[C@H]1c1ccccc1	ZINC000245411583	455290396	/nfs/dbraw/zinc/29/03/96/455290396.db2.gz	XNPINOIYKCZAAH-ZHALLVOQSA-N	0	3	327.472	3.263	20	30		EGEDHN
N#CC(C(=O)NC1CCCCC1)c1nc2ccccc2n1C(F)F	ZINC000180513810	455187214	/nfs/dbraw/zinc/18/72/14/455187214.db2.gz	ODWOXJKTLLWEHM-LBPRGKRZSA-N	0	3	332.354	3.487	20	30		EGEDHN
C=C(C)CN(C)Cc1cn(C)nc1-c1ccc2c(c1)OCCCO2	ZINC000181050511	455281077	/nfs/dbraw/zinc/28/10/77/455281077.db2.gz	LZBWYKZZNCFQRA-UHFFFAOYSA-N	0	3	327.428	3.256	20	30		EGEDHN
C[C@H](NCc1ccccc1CN1CCOCC1)c1cccc(C#N)c1	ZINC000181415754	455332472	/nfs/dbraw/zinc/33/24/72/455332472.db2.gz	VDHBDFGCAIPDGX-KRWDZBQOSA-N	0	3	335.451	3.241	20	30		EGEDHN
C[C@@H](NCCCS(=O)(=O)Cc1ccccc1)c1cccc(C#N)c1	ZINC000181543597	455351977	/nfs/dbraw/zinc/35/19/77/455351977.db2.gz	NSTWNFCYEOYQSI-MRXNPFEDSA-N	0	3	342.464	3.214	20	30		EGEDHN
C[C@H](NCC(=O)N(C)C1(C#N)CCCCC1)[C@@H](C)c1ccccc1	ZINC000181542836	455352205	/nfs/dbraw/zinc/35/22/05/455352205.db2.gz	SQMPFQDHTOWOHI-SJORKVTESA-N	0	3	327.472	3.453	20	30		EGEDHN
C[C@H](CNC(=O)N[C@@H](CCC#N)c1ccccc1)N1CCC[C@@H](C)C1	ZINC000245922603	455400106	/nfs/dbraw/zinc/40/01/06/455400106.db2.gz	GUIOGTZJHXKBHU-LMMKCTJWSA-N	0	3	342.487	3.451	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2scc(C)c2Br)CC1	ZINC000190925573	455406560	/nfs/dbraw/zinc/40/65/60/455406560.db2.gz	ZRAASDOSROJCOF-UHFFFAOYSA-N	0	3	343.290	3.199	20	30		EGEDHN
COc1ccc(CN(C)C[C@H]2CCCC[C@H]2O)cc1OCCCC#N	ZINC000246019534	455414707	/nfs/dbraw/zinc/41/47/07/455414707.db2.gz	UUKYQJOXUVYMNG-QZTJIDSGSA-N	0	3	346.471	3.361	20	30		EGEDHN
Cn1cc(CN[C@H]2CCc3c2cccc3Br)cc1C#N	ZINC000190966794	455416739	/nfs/dbraw/zinc/41/67/39/455416739.db2.gz	INMHCRLPJVMHQW-INIZCTEOSA-N	0	3	330.229	3.436	20	30		EGEDHN
CCCN(CC(=O)N(CCC#N)c1cccc(C)c1C)CC(C)(C)O	ZINC000266019427	455421816	/nfs/dbraw/zinc/42/18/16/455421816.db2.gz	OHZDFWOWNHQDHV-UHFFFAOYSA-N	0	3	345.487	3.033	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)C1(C)CCN(Cc2ccccc2)CC1	ZINC000184668154	455423754	/nfs/dbraw/zinc/42/37/54/455423754.db2.gz	WVRWJKJXLRNIJV-QGZVFWFLSA-N	0	3	327.472	3.297	20	30		EGEDHN
C=C(C)[C@H](NC(=O)NC[C@H]1CCCN(C)C1)c1ccc(F)c(F)c1	ZINC000184697508	455430217	/nfs/dbraw/zinc/43/02/17/455430217.db2.gz	MUQZOVXHELXVHN-DYVFJYSZSA-N	0	3	337.414	3.223	20	30		EGEDHN
C[C@H](O)CN(Cc1nnc(-c2ccc(C#N)cc2)o1)C1CCCCC1	ZINC000266533017	455431149	/nfs/dbraw/zinc/43/11/49/455431149.db2.gz	MVLDEVSEJMNESL-AWEZNQCLSA-N	0	3	340.427	3.124	20	30		EGEDHN
Cc1ccc(/N=C/c2ccccc2[O-])cc1NC(=O)CC[NH+](C)C	ZINC000184743272	455440390	/nfs/dbraw/zinc/44/03/90/455440390.db2.gz	MXOVPHDUVNCLEB-DEDYPNTBSA-N	0	3	325.412	3.341	20	30		EGEDHN
CCN(C)CCNC(=O)c1ccc(Sc2ccccc2C#N)cc1	ZINC000175652450	455477366	/nfs/dbraw/zinc/47/73/66/455477366.db2.gz	ATRMHDXIPGYLMU-UHFFFAOYSA-N	0	3	339.464	3.391	20	30		EGEDHN
CC[C@H](NCC#Cc1ccc(OC(F)(F)F)cc1)[C@@H]1CCCO1	ZINC000182371204	455500201	/nfs/dbraw/zinc/50/02/01/455500201.db2.gz	ZJPDSGSNOZCEIB-HOTGVXAUSA-N	0	3	327.346	3.484	20	30		EGEDHN
C=C(C)COc1cccc(NC(=O)N2CC[C@@H](N3CC=CC3)C2)c1	ZINC000176002728	455527368	/nfs/dbraw/zinc/52/73/68/455527368.db2.gz	XHJPYTKVAISFAS-QGZVFWFLSA-N	0	3	327.428	3.120	20	30		EGEDHN
Cc1ccc(C#N)c(N2CCCN(CCCc3ccccc3)CC2)n1	ZINC000161095589	455532885	/nfs/dbraw/zinc/53/28/85/455532885.db2.gz	PCMHOOLQSSOWLR-UHFFFAOYSA-N	0	3	334.467	3.407	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000176120909	455543240	/nfs/dbraw/zinc/54/32/40/455543240.db2.gz	ZPSWNMOSMGJDOA-ZHALLVOQSA-N	0	3	330.472	3.137	20	30		EGEDHN
C#CCOc1ccc(CN[C@H](CN(C)C)c2ccc(OC)cc2)cc1	ZINC000283872970	455605226	/nfs/dbraw/zinc/60/52/26/455605226.db2.gz	GSGXSXJTKQQQIH-OAQYLSRUSA-N	0	3	338.451	3.100	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN2CCN(C3CCC3)C[C@@H](C)C2)c1C	ZINC000292285066	455619304	/nfs/dbraw/zinc/61/93/04/455619304.db2.gz	LTDLVNJUKKCQCL-INIZCTEOSA-N	0	3	343.515	3.280	20	30		EGEDHN
N#C[C@@H]1CCC[C@H](NCc2ccc(N3CCC(CO)CC3)cc2)C1	ZINC000185795815	455624514	/nfs/dbraw/zinc/62/45/14/455624514.db2.gz	WWWXSZSMAYYHSC-MOPGFXCFSA-N	0	3	327.472	3.067	20	30		EGEDHN
N#Cc1ccc(OCCN2CCC[C@@H]2C[C@@H](O)c2ccco2)cc1	ZINC000268292127	455642617	/nfs/dbraw/zinc/64/26/17/455642617.db2.gz	RYOIKJCBPOGMAA-SJLPKXTDSA-N	0	3	326.396	3.118	20	30		EGEDHN
C[C@@H](NCCOc1ccccc1C#N)c1ccc([S@](C)=O)cc1	ZINC000271719295	455733666	/nfs/dbraw/zinc/73/36/66/455733666.db2.gz	CUSHAYZRTHSPTI-FATZIPQQSA-N	0	3	328.437	3.025	20	30		EGEDHN
COC(=O)[C@@H]1CC12CCN(Cc1ccccc1C(C)(C)C#N)CC2	ZINC000268945983	455740580	/nfs/dbraw/zinc/74/05/80/455740580.db2.gz	CRINNHQRSHENKX-KRWDZBQOSA-N	0	3	326.440	3.263	20	30		EGEDHN
CC(C)(CC(N)=O)NCCC(C#N)(c1ccccc1)c1ccccc1	ZINC000193121325	455743120	/nfs/dbraw/zinc/74/31/20/455743120.db2.gz	QWUHDGHEWZRFJA-UHFFFAOYSA-N	0	3	335.451	3.130	20	30		EGEDHN
C#CC[C@H](NC(=O)N1CCN(C2CCC2)C[C@H](C)C1)c1ccccc1	ZINC000292778976	455755490	/nfs/dbraw/zinc/75/54/90/455755490.db2.gz	XVKSCDZGUIZTEE-PXNSSMCTSA-N	0	3	339.483	3.267	20	30		EGEDHN
C=C(Br)CNC1(Cc2ccc(F)cc2)CCOCC1	ZINC000293205620	455778421	/nfs/dbraw/zinc/77/84/21/455778421.db2.gz	IZQCKZBUCURVAO-UHFFFAOYSA-N	0	3	328.225	3.416	20	30		EGEDHN
C=C(C)[C@@H](NC[C@H](O)COCC(F)(F)F)c1ccc(F)c(F)c1	ZINC000292849608	455763714	/nfs/dbraw/zinc/76/37/14/455763714.db2.gz	FXFNUAKHLRODCT-SMDDNHRTSA-N	0	3	339.304	3.111	20	30		EGEDHN
C=CCOc1ccc(CN2CCSC3(CCOCC3)C2)cc1OC	ZINC000186482759	455777647	/nfs/dbraw/zinc/77/76/47/455777647.db2.gz	QNTSWZWHUSPUQV-UHFFFAOYSA-N	0	3	349.496	3.358	20	30		EGEDHN
CCN(CC)CCOC(=O)c1cccc(NC(=O)CC(C)(C)C#N)c1	ZINC000285070037	455784479	/nfs/dbraw/zinc/78/44/79/455784479.db2.gz	WKCPEKWNVFJOJN-UHFFFAOYSA-N	0	3	345.443	3.064	20	30		EGEDHN
C#CCCOc1ccc(CN2CC3(CCOCC3)[C@@H]2C2CC2)cc1	ZINC000293543128	455789874	/nfs/dbraw/zinc/78/98/74/455789874.db2.gz	DAOWMRHJVWVXRP-FQEVSTJZSA-N	0	3	325.452	3.480	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCc3cccc(F)c3[C@@H]2C)CC1	ZINC000606511485	460690575	/nfs/dbraw/zinc/69/05/75/460690575.db2.gz	XWQKTTLSDLUCIY-AWEZNQCLSA-N	0	3	331.435	3.105	20	30		EGEDHN
COc1ccc2c(c1)OC[C@@H](N[C@H](C)c1ccc(OCC#N)cc1)C2	ZINC000271899415	455798620	/nfs/dbraw/zinc/79/86/20/455798620.db2.gz	VFXOOHWRBHEVLX-PBHICJAKSA-N	0	3	338.407	3.252	20	30		EGEDHN
CC[C@@H](CN(CC)CC(=O)N[C@@](C)(C#N)C1CC1)c1ccccc1	ZINC000186609266	455804863	/nfs/dbraw/zinc/80/48/63/455804863.db2.gz	JOWPEZYDNSXKFE-JXFKEZNVSA-N	0	3	327.472	3.311	20	30		EGEDHN
Cc1csc(C(=O)N(CCN(C)C)Cc2cccc(C#N)c2)c1	ZINC000294708333	455825513	/nfs/dbraw/zinc/82/55/13/455825513.db2.gz	LPOPHKLMFNKBSP-UHFFFAOYSA-N	0	3	327.453	3.132	20	30		EGEDHN
C=CCc1cc(CNC2(C(=O)N(C)C)CCCCC2)cc(OC)c1O	ZINC000294983487	455834191	/nfs/dbraw/zinc/83/41/91/455834191.db2.gz	KBFRULVDZGVQDM-UHFFFAOYSA-N	0	3	346.471	3.010	20	30		EGEDHN
CCn1c2ccccc2c2cc(CNCCn3cnc(C#N)n3)ccc21	ZINC000285393536	455835505	/nfs/dbraw/zinc/83/55/05/455835505.db2.gz	DQKDPGOKIDIYIR-UHFFFAOYSA-N	0	3	344.422	3.067	20	30		EGEDHN
COc1cccc(OC)c1OC1CCN([C@H]2CC[C@H](C#N)C2)CC1	ZINC000278692998	455843920	/nfs/dbraw/zinc/84/39/20/455843920.db2.gz	SHTKRYLTZWOMCI-GJZGRUSLSA-N	0	3	330.428	3.239	20	30		EGEDHN
COc1ccccc1N1CC[C@H](CNCc2ccc(C#N)cc2F)C1	ZINC000269467157	455848097	/nfs/dbraw/zinc/84/80/97/455848097.db2.gz	ZHSGRBPEDXECLX-MRXNPFEDSA-N	0	3	339.414	3.322	20	30		EGEDHN
CC[C@H](NCc1cccc(CS(C)(=O)=O)c1)c1ccc(C#N)cc1	ZINC000278888177	455850977	/nfs/dbraw/zinc/85/09/77/455850977.db2.gz	YKGJDEIYMCPEOR-IBGZPJMESA-N	0	3	342.464	3.344	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N2CCN(C3CCC3)C[C@@H](C)C2)cc1	ZINC000295557235	455853299	/nfs/dbraw/zinc/85/32/99/455853299.db2.gz	ZGGPOCRXOVGIPR-QGZVFWFLSA-N	0	3	340.467	3.035	20	30		EGEDHN
CN1CCC(N(Cc2ccco2)C(=O)c2ccc(F)c(C#N)c2)CC1	ZINC000279513610	455867048	/nfs/dbraw/zinc/86/70/48/455867048.db2.gz	UNFGHUITLPMGTK-UHFFFAOYSA-N	0	3	341.386	3.027	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cccc(C)c2Br)CC1	ZINC000187114673	455871674	/nfs/dbraw/zinc/87/16/74/455871674.db2.gz	PMYQEJDJMWTMKJ-UHFFFAOYSA-N	0	3	335.245	3.041	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN2C[C@H](N3CCCC3)C[C@H]2C)c1C	ZINC000285578526	455875164	/nfs/dbraw/zinc/87/51/64/455875164.db2.gz	OGTUVULSEZGWFI-CRAIPNDOSA-N	0	3	329.488	3.032	20	30		EGEDHN
CSCc1cccc(CNC(=O)C(C#N)Cc2ccc(C#N)cc2)c1	ZINC000279957343	455879100	/nfs/dbraw/zinc/87/91/00/455879100.db2.gz	HZKWTOBDOKRHNJ-LJQANCHMSA-N	0	3	349.459	3.420	20	30		EGEDHN
C=CC[C@H](C)N[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl	ZINC000280018552	455880671	/nfs/dbraw/zinc/88/06/71/455880671.db2.gz	HFOZZSSYMNPASY-IUCAKERBSA-N	0	3	337.272	3.256	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000187217793	455883244	/nfs/dbraw/zinc/88/32/44/455883244.db2.gz	LFLNCMTXSNHMKI-OAQYLSRUSA-N	0	3	344.499	3.304	20	30		EGEDHN
CC[C@@](C)(C#N)C(=O)N1CCCN(CCCc2ccccc2)CC1	ZINC000285709410	455901954	/nfs/dbraw/zinc/90/19/54/455901954.db2.gz	SFXBYBVSSQWPSY-FQEVSTJZSA-N	0	3	327.472	3.093	20	30		EGEDHN
N#CCc1ccc(C(=O)NC2CCN(CCc3ccccc3)CC2)cc1	ZINC000270233362	455908077	/nfs/dbraw/zinc/90/80/77/455908077.db2.gz	IXGALUOBXPHQPC-UHFFFAOYSA-N	0	3	347.462	3.190	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccc(CC#N)cc1	ZINC000270295638	455921861	/nfs/dbraw/zinc/92/18/61/455921861.db2.gz	BWVWVDXPZSVFCT-GOSISDBHSA-N	0	3	347.462	3.489	20	30		EGEDHN
CC1(C)[C@H](NCC#Cc2ccc(OC(F)(F)F)cc2)[C@@H]2CCO[C@@H]21	ZINC000296470504	455947919	/nfs/dbraw/zinc/94/79/19/455947919.db2.gz	XUJLEJIQOHNRCX-XHSDSOJGSA-N	0	3	339.357	3.340	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NCC(C)(C)N1CCc2ccccc2C1	ZINC000188147823	456008398	/nfs/dbraw/zinc/00/83/98/456008398.db2.gz	CWWNQBYITLMKHG-OAQYLSRUSA-N	0	3	344.499	3.168	20	30		EGEDHN
Cc1cc(C)c(C#N)c(SCCCN2CCN(C(C)C)CC2)n1	ZINC000188204335	456021810	/nfs/dbraw/zinc/02/18/10/456021810.db2.gz	PZLVVFCIPGEGCA-UHFFFAOYSA-N	0	3	332.517	3.078	20	30		EGEDHN
CO[C@@]1(C)CCCN(Cc2cn(CCC#N)nc2-c2ccccc2)C1	ZINC000280688990	456031739	/nfs/dbraw/zinc/03/17/39/456031739.db2.gz	VNOYJGJAXGRKSW-FQEVSTJZSA-N	0	3	338.455	3.465	20	30		EGEDHN
C=CCNC(=O)[C@@H](C)N[C@H](c1cccc(OC(F)(F)F)c1)C1CC1	ZINC000286746785	456053494	/nfs/dbraw/zinc/05/34/94/456053494.db2.gz	YNLCNEMJDNHSER-ABAIWWIYSA-N	0	3	342.361	3.317	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN2CC[C@H](N3CCCC3)[C@@H]2C)c1C	ZINC000286813611	456054351	/nfs/dbraw/zinc/05/43/51/456054351.db2.gz	JTOWRBLNFTUKLA-HKUYNNGSSA-N	0	3	329.488	3.032	20	30		EGEDHN
CC(C)Oc1ccc([C@@H](CNC(=O)NCCCCC#N)N(C)C)cc1	ZINC000287216589	456063793	/nfs/dbraw/zinc/06/37/93/456063793.db2.gz	AIINMBBVGJTDLQ-GOSISDBHSA-N	0	3	346.475	3.070	20	30		EGEDHN
C[C@@H](NC(=O)NCc1ccc(C#N)cc1)[C@H](c1ccccc1)N(C)C	ZINC000287294043	456065693	/nfs/dbraw/zinc/06/56/93/456065693.db2.gz	ZUJOHVPZDGSWLZ-DNVCBOLYSA-N	0	3	336.439	3.049	20	30		EGEDHN
CC(C)C[C@H](NCC(=O)N(CCC#N)CCC#N)c1ccccc1	ZINC000272777893	456068616	/nfs/dbraw/zinc/06/86/16/456068616.db2.gz	AUICJRFGZTZQGB-SFHVURJKSA-N	0	3	326.444	3.019	20	30		EGEDHN
C=C(Cl)COc1ccc([C@@H](C)NCC2(S(C)(=O)=O)CC2)cc1	ZINC000280908731	456079034	/nfs/dbraw/zinc/07/90/34/456079034.db2.gz	GHXHNXYADIGFQP-CYBMUJFWSA-N	0	3	343.876	3.046	20	30		EGEDHN
COC[C@H](NC[C@@H](O)c1ccc(C#N)cc1)c1cccc(Cl)c1	ZINC000288819427	456105223	/nfs/dbraw/zinc/10/52/23/456105223.db2.gz	MZSAAEHPXFCELY-ZWKOTPCHSA-N	0	3	330.815	3.222	20	30		EGEDHN
C#Cc1ccc(CN[C@@H](C)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000289044805	456113463	/nfs/dbraw/zinc/11/34/63/456113463.db2.gz	AZDKECLUHYMCLN-INIZCTEOSA-N	0	3	348.446	3.176	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)Cc1cccc([N+](=O)[O-])c1	ZINC000289141801	456116219	/nfs/dbraw/zinc/11/62/19/456116219.db2.gz	AIJPGSYIRKQEOZ-UHFFFAOYSA-N	0	3	338.411	3.030	20	30		EGEDHN
CN1CCC[C@@]2(CCN(C(=O)N[C@@H](CCC#N)c3ccccc3)C2)C1	ZINC000297095274	456116339	/nfs/dbraw/zinc/11/63/39/456116339.db2.gz	ADKDADGOXCXJOR-AZUAARDMSA-N	0	3	340.471	3.159	20	30		EGEDHN
CN1CCC[C@]2(CCN(C(=O)Nc3ccc(C#N)cc3Cl)C2)C1	ZINC000297142970	456130771	/nfs/dbraw/zinc/13/07/71/456130771.db2.gz	QLXZYKZYJRCLQD-KRWDZBQOSA-N	0	3	332.835	3.161	20	30		EGEDHN
C=C[C@@H](CO)N[C@H](C)c1cccc(OCc2cn3ccccc3n2)c1	ZINC000289703137	456138148	/nfs/dbraw/zinc/13/81/48/456138148.db2.gz	ISESDPCHQVZTOE-WBVHZDCISA-N	0	3	337.423	3.111	20	30		EGEDHN
C[C@H](C1CCN(C)CC1)N(C)C(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000281219184	456169403	/nfs/dbraw/zinc/16/94/03/456169403.db2.gz	OGMMUGARASQZQX-OAHLLOKOSA-N	0	3	327.472	3.290	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000189192865	456250909	/nfs/dbraw/zinc/25/09/09/456250909.db2.gz	SQHPZXMLNOWXBP-CTNGQTDRSA-N	0	3	344.499	3.338	20	30		EGEDHN
CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@@H]2CC[C@@H](C#N)C2)cc1	ZINC000274593880	456262647	/nfs/dbraw/zinc/26/26/47/456262647.db2.gz	FURHFENVGFQVOM-ZMSDIMECSA-N	0	3	349.500	3.060	20	30		EGEDHN
N#CC1(CCCN2CCN(CC3CCCCC3)CC2)CCOCC1	ZINC000337126844	456328478	/nfs/dbraw/zinc/32/84/78/456328478.db2.gz	GGHFLYXKTCWTEM-UHFFFAOYSA-N	0	3	333.520	3.285	20	30		EGEDHN
C=CCc1cc(CN[C@H]2CCC[C@H]2OC(F)F)cc(OC)c1O	ZINC000337318841	456346553	/nfs/dbraw/zinc/34/65/53/456346553.db2.gz	YOYIRWKEMZZDRF-UONOGXRCSA-N	0	3	327.371	3.379	20	30		EGEDHN
C[C@@H]1CC[C@H](C)N1CC(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1	ZINC000347751344	456349703	/nfs/dbraw/zinc/34/97/03/456349703.db2.gz	FJPDAHSNTTVURB-UKBAYJJMSA-N	0	3	325.456	3.158	20	30		EGEDHN
CCN(C(=O)c1ccc(C#N)[nH]1)[C@H]1CCN([C@H](C)c2ccccc2)C1	ZINC000337372016	456349787	/nfs/dbraw/zinc/34/97/87/456349787.db2.gz	WTEYOQQYTBONND-QAPCUYQASA-N	0	3	336.439	3.184	20	30		EGEDHN
CCOC1CC(N(C)Cc2cn(CCC#N)nc2-c2ccccc2)C1	ZINC000290576011	456371750	/nfs/dbraw/zinc/37/17/50/456371750.db2.gz	UEMUTXUGNCVUIW-UHFFFAOYSA-N	0	3	338.455	3.463	20	30		EGEDHN
Cc1ccccc1N1CCN(CCCC2(C#N)CCOCC2)CC1	ZINC000282079147	456407907	/nfs/dbraw/zinc/40/79/07/456407907.db2.gz	UJESRWQULZWNTF-UHFFFAOYSA-N	0	3	327.472	3.218	20	30		EGEDHN
C=CCOc1ccc(CNCc2ccc(-n3cncn3)c(C)c2)cc1	ZINC000352912344	456408031	/nfs/dbraw/zinc/40/80/31/456408031.db2.gz	BVHZDXLPPVGKBV-UHFFFAOYSA-N	0	3	334.423	3.430	20	30		EGEDHN
CSc1ccccc1[C@@H](C)NC[C@H](O)COc1ccc(C#N)cc1	ZINC000282136904	456423072	/nfs/dbraw/zinc/42/30/72/456423072.db2.gz	RRIOGZMDDWTKQT-ZBFHGGJFSA-N	0	3	342.464	3.371	20	30		EGEDHN
C=CCOCCCN1CCN(Cc2cccc(C(F)(F)F)c2)CC1	ZINC000347962400	456431517	/nfs/dbraw/zinc/43/15/17/456431517.db2.gz	BPOPCQDQMVNWBH-UHFFFAOYSA-N	0	3	342.405	3.416	20	30		EGEDHN
CCOc1ccc(CN(C)C(=O)C(C#N)Cc2ccc(C#N)cc2)cc1	ZINC000348023813	456439169	/nfs/dbraw/zinc/43/91/69/456439169.db2.gz	YKSMCZUILCDUKH-LJQANCHMSA-N	0	3	347.418	3.298	20	30		EGEDHN
C[C@@H](NCC#Cc1ccc(C(F)(F)F)cc1)C(C)(C)n1cncn1	ZINC000290826906	456439980	/nfs/dbraw/zinc/43/99/80/456439980.db2.gz	XJDXKJXDTCXSPO-CYBMUJFWSA-N	0	3	336.361	3.062	20	30		EGEDHN
C=CCOCCCN(C)[C@@H](CO)c1cccc(Br)c1	ZINC000348059676	456450031	/nfs/dbraw/zinc/45/00/31/456450031.db2.gz	WPLQWDQPOZHEKQ-HNNXBMFYSA-N	0	3	328.250	3.007	20	30		EGEDHN
CN(CCCNC(=O)Nc1ccc(F)c(C#N)c1)Cc1ccccc1	ZINC000343179744	456454639	/nfs/dbraw/zinc/45/46/39/456454639.db2.gz	ZYPRISWUTOTPPB-UHFFFAOYSA-N	0	3	340.402	3.341	20	30		EGEDHN
CCCCN(CC)[C@@H](C)C(=O)N(CCC#N)c1ccccc1OC	ZINC000343263450	456493751	/nfs/dbraw/zinc/49/37/51/456493751.db2.gz	KVHDOEKVQLSPBI-INIZCTEOSA-N	0	3	331.460	3.452	20	30		EGEDHN
CCCN(CC(=O)NC1(C#N)CCCCC1)[C@@H]1C[C@@H](OCC)C1(C)C	ZINC000303928173	456495299	/nfs/dbraw/zinc/49/52/99/456495299.db2.gz	WUSDWSNJNBUDCJ-IAGOWNOFSA-N	0	3	349.519	3.245	20	30		EGEDHN
C=CCOc1ccc(CN[C@H]2CCC(=O)N[C@@H]2C(C)(C)C)cc1OC	ZINC000353137607	456514373	/nfs/dbraw/zinc/51/43/73/456514373.db2.gz	MDEYPWHHPADXIN-KXBFYZLASA-N	0	3	346.471	3.043	20	30		EGEDHN
COc1cc(CN2CC[C@H]3[C@@H](CCCN3C3CC3)C2)ccc1C#N	ZINC000282518479	456539617	/nfs/dbraw/zinc/53/96/17/456539617.db2.gz	ZLITXYRXSZLPOF-HKUYNNGSSA-N	0	3	325.456	3.016	20	30		EGEDHN
C=CCN(CCc1ccco1)C[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000282640877	456578318	/nfs/dbraw/zinc/57/83/18/456578318.db2.gz	BPLUECCZONLUCF-GOSISDBHSA-N	0	3	338.451	3.472	20	30		EGEDHN
C=CCOc1cccc(CN[C@@H]2CCO[C@H]2c2nccn2CC)c1	ZINC000343389615	456583482	/nfs/dbraw/zinc/58/34/82/456583482.db2.gz	LHLJCYPOIVCEDG-QZTJIDSGSA-N	0	3	327.428	3.088	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@H](N[C@@H](Cc1ccccc1)[C@H](O)C(F)F)CC2	ZINC000353250728	456587373	/nfs/dbraw/zinc/58/73/73/456587373.db2.gz	GICYJRNTTNPMNV-QYZOEREBSA-N	0	3	342.389	3.372	20	30		EGEDHN
C=CCc1cc(CN[C@H]2CCO[C@H]2c2cccnc2)cc(OC)c1O	ZINC000343399594	456593564	/nfs/dbraw/zinc/59/35/64/456593564.db2.gz	KLBTYLANYABQLE-PXNSSMCTSA-N	0	3	340.423	3.144	20	30		EGEDHN
C=CCc1cc(CN[C@@H]2CCO[C@H]2c2cccnc2)cc(OC)c1O	ZINC000343399595	456594186	/nfs/dbraw/zinc/59/41/86/456594186.db2.gz	KLBTYLANYABQLE-XLIONFOSSA-N	0	3	340.423	3.144	20	30		EGEDHN
Cc1ccnc(NCc2ccc(OCCN3CCCC3)cc2)c1C#N	ZINC000343442108	456624070	/nfs/dbraw/zinc/62/40/70/456624070.db2.gz	RXQXCCANVBCUTD-UHFFFAOYSA-N	0	3	336.439	3.348	20	30		EGEDHN
Cc1ccc([C@@H](CNCc2cc(C#N)cs2)N2CCOCC2)cc1	ZINC000343470525	456645059	/nfs/dbraw/zinc/64/50/59/456645059.db2.gz	HJZACQHKCZPLND-LJQANCHMSA-N	0	3	341.480	3.091	20	30		EGEDHN
CCCN(C)[C@@H](CNC(=O)c1cc(C#N)c[nH]1)c1ccc(Cl)cc1	ZINC000353360575	456646038	/nfs/dbraw/zinc/64/60/38/456646038.db2.gz	IVSDBXRNAQWPER-KRWDZBQOSA-N	0	3	344.846	3.353	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N(C)[C@H](C)c1ccncc1)C(C)C	ZINC000299345973	456662239	/nfs/dbraw/zinc/66/22/39/456662239.db2.gz	GTNHOVXZFVZCNQ-IEBWSBKVSA-N	0	3	344.503	3.483	20	30		EGEDHN
COc1ccc(CNC2CCN(c3ccc(C#N)cc3)CC2)cc1O	ZINC000299386914	456677485	/nfs/dbraw/zinc/67/74/85/456677485.db2.gz	ZCOXVCMAKFCFBG-UHFFFAOYSA-N	0	3	337.423	3.031	20	30		EGEDHN
CCC(CC)(CNCc1ccc(C#N)cc1OC(F)F)C(=O)OC	ZINC000343527940	456685106	/nfs/dbraw/zinc/68/51/06/456685106.db2.gz	BGOWGTXWGZLZGU-UHFFFAOYSA-N	0	3	340.370	3.229	20	30		EGEDHN
C#Cc1ccccc1CC(=O)Nc1ccc(C)cc1OCCN(C)C	ZINC000291586524	456687331	/nfs/dbraw/zinc/68/73/31/456687331.db2.gz	WXZSPIJUPGESFQ-UHFFFAOYSA-N	0	3	336.435	3.098	20	30		EGEDHN
C=CCN(CC=C)C(=O)NC[C@@H]1CCCN(Cc2cccs2)C1	ZINC000299437173	456692776	/nfs/dbraw/zinc/69/27/76/456692776.db2.gz	DZUJGGZNGUNSHO-INIZCTEOSA-N	0	3	333.501	3.344	20	30		EGEDHN
CO[C@]1(C)C[C@H](N[C@@H](C)C(=O)N(CCC#N)c2ccccc2)C1(C)C	ZINC000340849517	456716514	/nfs/dbraw/zinc/71/65/14/456716514.db2.gz	KVUFDUTWHZBQIM-RIFZZMRRSA-N	0	3	343.471	3.115	20	30		EGEDHN
CN(C)[C@@H](CNC(=O)c1cc(C#N)ccc1Cl)c1ccccc1	ZINC000348506187	456719411	/nfs/dbraw/zinc/71/94/11/456719411.db2.gz	IRFADXLJPSIPHX-KRWDZBQOSA-N	0	3	327.815	3.244	20	30		EGEDHN
C=CCN(Cc1ccsc1)[C@@H](C)c1cccc(-n2cnnn2)c1	ZINC000353505021	456722036	/nfs/dbraw/zinc/72/20/36/456722036.db2.gz	UGQIZFYSWYCGDW-AWEZNQCLSA-N	0	3	325.441	3.473	20	30		EGEDHN
N#Cc1cccc(NC(=O)CN[C@H]2CCC[C@@H]2OCc2ccccc2)c1	ZINC000348520351	456732590	/nfs/dbraw/zinc/73/25/90/456732590.db2.gz	JFHKYVWUWKZUNX-PMACEKPBSA-N	0	3	349.434	3.224	20	30		EGEDHN
O=C(CN[C@@H]1CCC(=O)NC12CCC2)N[C@H]1CCOc2ccccc21	ZINC000328677335	456735711	/nfs/dbraw/zinc/73/57/11/456735711.db2.gz	AOIMNHYHQUKTEG-GOEBONIOSA-N	0	3	343.427	3.098	20	30		EGEDHN
Cc1nc(CNC2CCN(c3ccc(C#N)cc3)CC2)sc1C	ZINC000353525712	456736216	/nfs/dbraw/zinc/73/62/16/456736216.db2.gz	YJWBBZIMNOSXKI-UHFFFAOYSA-N	0	3	326.469	3.390	20	30		EGEDHN
O=C(NCCN1CCC2(CCCCC2)CC1)c1cc2n(n1)CCCO2	ZINC000328691488	456738137	/nfs/dbraw/zinc/73/81/37/456738137.db2.gz	DWHLIVBGQOODSV-UHFFFAOYSA-N	0	3	346.475	3.017	20	30		EGEDHN
C[C@H]1C[C@@H](N2CCCC2)CN1c1ccc(C#N)cc1Br	ZINC000343614764	456744689	/nfs/dbraw/zinc/74/46/89/456744689.db2.gz	SFMKNUOATVBOGZ-GXTWGEPZSA-N	0	3	334.261	3.384	20	30		EGEDHN
COc1ccc(CN[C@H](C)[C@@H]2OCCc3sccc32)cc1C#N	ZINC000291762317	456747454	/nfs/dbraw/zinc/74/74/54/456747454.db2.gz	RQDXRNGPQQQFAA-XIKOKIGWSA-N	0	3	328.437	3.420	20	30		EGEDHN
C[C@@H](N[C@@H](C)C(=O)Nc1sc2c(c1C#N)CCC2)[C@@H]1CCOC1	ZINC000328814245	456767573	/nfs/dbraw/zinc/76/75/73/456767573.db2.gz	NJVKJOWKFRETKM-GRYCIOLGSA-N	0	3	333.457	3.100	20	30		EGEDHN
CCN(CCN1CCCCCC1)C(=O)Nc1ccc(C#N)c(F)c1	ZINC000353576749	456775526	/nfs/dbraw/zinc/77/55/26/456775526.db2.gz	OPABRPQAOTUENQ-UHFFFAOYSA-N	0	3	332.423	3.427	20	30		EGEDHN
C[C@H]1CC=CC[C@H]1C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000340970540	456790822	/nfs/dbraw/zinc/79/08/22/456790822.db2.gz	IOMVXUXDRILRNQ-QFBILLFUSA-N	0	3	325.456	3.051	20	30		EGEDHN
Cc1cccc(N2CCN(CCCNc3ccc(C#N)cc3)CC2)c1	ZINC000301088997	456794100	/nfs/dbraw/zinc/79/41/00/456794100.db2.gz	MAHNUJJGQOHZBG-UHFFFAOYSA-N	0	3	334.467	3.491	20	30		EGEDHN
C[C@H](NC(=O)[C@H]1CCCN1C1CCCC1)c1nnc2n1CCCC2	ZINC000328936448	456795232	/nfs/dbraw/zinc/79/52/32/456795232.db2.gz	QVEUZBILYYJMPK-DZGCQCFKSA-N	0	3	331.464	3.039	20	30		EGEDHN
CC#CCCCC(=O)N(Cc1ccc(O)cc1)C[C@@H]1CCCN1CC	ZINC000344128165	456799371	/nfs/dbraw/zinc/79/93/71/456799371.db2.gz	JJSUXTXRFIDLHH-IBGZPJMESA-N	0	3	342.483	3.399	20	30		EGEDHN
Cc1nc([C@@H]2CCCOC2)sc1C(=O)N[C@H](C)C1=CCN(C)CC1	ZINC000328957006	456800340	/nfs/dbraw/zinc/80/03/40/456800340.db2.gz	JHLGTCHLDHXTSQ-IUODEOHRSA-N	0	3	349.500	3.301	20	30		EGEDHN
CNC(=O)c1cccc(NC(=O)N2CCCC23CCN(C)CC3)c1C	ZINC000329032136	456818343	/nfs/dbraw/zinc/81/83/43/456818343.db2.gz	BHXRDQNBNCGESD-UHFFFAOYSA-N	0	3	344.459	3.035	20	30		EGEDHN
COc1cccc([C@H](C)NCCC(=O)Nc2sccc2C#N)c1	ZINC000341216085	456822532	/nfs/dbraw/zinc/82/25/32/456822532.db2.gz	DVSKRBLTXIMFGW-LBPRGKRZSA-N	0	3	329.425	3.308	20	30		EGEDHN
C[C@@H]1CC[C@@H](C)N1CC(=O)N1CCC[C@@H](C(=O)Nc2ccccc2)C1	ZINC000329070459	456827419	/nfs/dbraw/zinc/82/74/19/456827419.db2.gz	YNQMYWJLUVUTKR-BRWVUGGUSA-N	0	3	343.471	3.386	20	30		EGEDHN
CC[C@](C)(C#N)C(=O)N1CC[C@@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000353647089	456828743	/nfs/dbraw/zinc/82/87/43/456828743.db2.gz	GDJBMGGQSUFAAJ-RTWAWAEBSA-N	0	3	339.483	3.441	20	30		EGEDHN
COc1ccc(CN[C@H]2C[C@@H](OC)C2(C)C)cc1OCCCC#N	ZINC000344700570	456849687	/nfs/dbraw/zinc/84/96/87/456849687.db2.gz	QSYFWCULIMBVIG-ZWKOTPCHSA-N	0	3	332.444	3.281	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)CCc2cc3ccccc3[nH]c2=O)CCN1C	ZINC000329201016	456852208	/nfs/dbraw/zinc/85/22/08/456852208.db2.gz	VNIVLEATDZPNBR-CJNGLKHVSA-N	0	3	327.428	3.312	20	30		EGEDHN
Cc1cc2c[nH]nc2c(C(=O)N[C@@H]2CN(C)C[C@@H]2c2ccccc2)c1	ZINC000329245774	456860084	/nfs/dbraw/zinc/86/00/84/456860084.db2.gz	QTRXJHZKMICANI-QZTJIDSGSA-N	0	3	334.423	3.274	20	30		EGEDHN
C=C(C)Cn1c(C2CC2)nnc1N1CCN(C2CCCCC2)CC1	ZINC000338851527	456863892	/nfs/dbraw/zinc/86/38/92/456863892.db2.gz	XEOCAURHRDOFMF-UHFFFAOYSA-N	0	3	329.492	3.186	20	30		EGEDHN
O=C(CCNC(=O)C1CCCCC1)N1CC[C@H](N2CCCCC2)C1	ZINC000329270722	456864070	/nfs/dbraw/zinc/86/40/70/456864070.db2.gz	HEZVCHWDKXBJIY-KRWDZBQOSA-N	0	3	335.492	3.000	20	30		EGEDHN
C=CC[C@H](CC)NC(=O)N(C)C[C@@H]1CCN(C)[C@@H]1c1cccnc1	ZINC000341485869	456868529	/nfs/dbraw/zinc/86/85/29/456868529.db2.gz	WGRKQENWPFQIGF-OKZBNKHCSA-N	0	3	330.476	3.071	20	30		EGEDHN
N#CC1(N(C(=O)[C@H]2CCCN(Cc3ccccc3)C2)C2CC2)CCC1	ZINC000341592999	456879637	/nfs/dbraw/zinc/87/96/37/456879637.db2.gz	ZGGOFLMDKGVYNN-SFHVURJKSA-N	0	3	337.467	3.336	20	30		EGEDHN
Cc1nnc([C@@H]2CCCN([C@H](C)C(=O)NCC3CCCCC3)C2)[nH]1	ZINC000329452551	456892861	/nfs/dbraw/zinc/89/28/61/456892861.db2.gz	NJBPARJTKQHHBB-CZUORRHYSA-N	0	3	333.480	3.218	20	30		EGEDHN
C=CCc1cc(CN(C)C[C@H](O)Cc2ccccc2)cc(OC)c1O	ZINC000353765568	456896841	/nfs/dbraw/zinc/89/68/41/456896841.db2.gz	DLVAQSPTBCUZSG-LJQANCHMSA-N	0	3	341.451	3.165	20	30		EGEDHN
CCO[C@@H]1C[C@H](NCC(=O)NC2(C#N)CCCCC2)C12CCCC2	ZINC000329611434	456916004	/nfs/dbraw/zinc/91/60/04/456916004.db2.gz	RJDRNUCXKIJWSH-JKSUJKDBSA-N	0	3	333.476	3.497	20	30		EGEDHN
CN(C)[C@H](CNC(=O)C[C@@H](CC#N)c1ccccc1)Cc1ccccc1	ZINC000353820337	456922458	/nfs/dbraw/zinc/92/24/58/456922458.db2.gz	YEOWPWUSTWWRNN-RTWAWAEBSA-N	0	3	349.478	3.363	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H](C)c2ccc(-n3cnnn3)cc2)cc1	ZINC000353859184	456939136	/nfs/dbraw/zinc/93/91/36/456939136.db2.gz	VVHXHFRMLOMOPP-HNNXBMFYSA-N	0	3	335.411	3.078	20	30		EGEDHN
Cc1cc(C(=O)NC[C@@H]2CCCN(C)[C@H]2c2cccs2)cnn1	ZINC000329842539	456949496	/nfs/dbraw/zinc/94/94/96/456949496.db2.gz	PBCSAGQQQTULEJ-XJKSGUPXSA-N	0	3	330.457	3.234	20	30		EGEDHN
Cc1ccc(CNC(=O)CN2[C@H](C)CC[C@@H]2C)c(O[C@H]2CCOC2)c1	ZINC000329862107	456952596	/nfs/dbraw/zinc/95/25/96/456952596.db2.gz	QUEQTVOPXBPXSW-JZXOWHBKSA-N	0	3	346.471	3.492	20	30		EGEDHN
O=C(CSc1nnc(C2CC2)s1)NC1CCN(C2CC2)CC1	ZINC000329940017	456964194	/nfs/dbraw/zinc/96/41/94/456964194.db2.gz	FZBKOMHYEKAOPE-UHFFFAOYSA-N	0	3	338.502	3.091	20	30		EGEDHN
CN1C[C@H](NC(=O)c2cc(=O)[nH]c(C3CC3)c2)[C@H](c2ccccc2)C1	ZINC000329959661	456967514	/nfs/dbraw/zinc/96/75/14/456967514.db2.gz	NJBYWJOWAYCHRW-WMZOPIPTSA-N	0	3	337.423	3.067	20	30		EGEDHN
Cc1ccc(C[C@H](C)N(C)C([O-])=[NH+]C[C@H]2CCc3nccn3C2)cc1	ZINC000329963373	456967633	/nfs/dbraw/zinc/96/76/33/456967633.db2.gz	SOPWAUVZBYXMLY-FUHWJXTLSA-N	0	3	340.471	3.231	20	30		EGEDHN
C=CC[C@H](CO)CN[C@H]1CCCOc2cc(Br)ccc21	ZINC000341885216	456986209	/nfs/dbraw/zinc/98/62/09/456986209.db2.gz	LBKQVFICASPTHC-WFASDCNBSA-N	0	3	340.261	3.437	20	30		EGEDHN
CN(CCC(C)(C)C#N)C[C@@H](O)COc1ccc(C(F)(F)F)cc1	ZINC000345718012	456989070	/nfs/dbraw/zinc/98/90/70/456989070.db2.gz	VQAHAAPXXFWUHY-CQSZACIVSA-N	0	3	344.377	3.317	20	30		EGEDHN
CC[C@@H](C)n1ncc(NC(=O)N2CC[C@@H](N3CCCCC3)C2)c1C	ZINC000330133106	456990311	/nfs/dbraw/zinc/99/03/11/456990311.db2.gz	QWWJVNRXSMTYON-GDBMZVCRSA-N	0	3	333.480	3.268	20	30		EGEDHN
C[C@@H]1CCc2c(F)cccc2[C@@H]1NC(=O)N[C@@H]1CCn2ccnc2C1	ZINC000330187981	456998555	/nfs/dbraw/zinc/99/85/55/456998555.db2.gz	KUQGWMZEAJMXKC-SNUQEOBHSA-N	0	3	342.418	3.164	20	30		EGEDHN
CN(Cc1ccccc1[N+](=O)[O-])C(=O)C(C#N)CCc1ccccc1	ZINC000346144401	457019348	/nfs/dbraw/zinc/01/93/48/457019348.db2.gz	AKTGLZRCXOEAEA-INIZCTEOSA-N	0	3	337.379	3.326	20	30		EGEDHN
CC(C)[C@H](C(=O)N[C@H]1CCOC2(CCOCC2)C1)N1CCCCC1	ZINC000330307003	457023970	/nfs/dbraw/zinc/02/39/70/457023970.db2.gz	LQKHFWOLVRQJCX-DLBZAZTESA-N	0	3	338.492	3.182	20	30		EGEDHN
CN(C)CCOc1cccc(-c2noc(C3(C#N)CCCC3)n2)c1	ZINC000356530078	457038800	/nfs/dbraw/zinc/03/88/00/457038800.db2.gz	FKYUSPXXAOJGDG-UHFFFAOYSA-N	0	3	326.400	3.012	20	30		EGEDHN
Cc1cccc(N(CCC#N)C(=O)CN2CC[C@@H](C3CC3)C2)c1C	ZINC000362702253	457053270	/nfs/dbraw/zinc/05/32/70/457053270.db2.gz	BOCDJABJJIFEJZ-GOSISDBHSA-N	0	3	325.456	3.282	20	30		EGEDHN
C=C(C)Cn1c(-c2ccc(C)o2)nnc1N1C[C@@H](C)N(CC)C[C@@H]1C	ZINC000359109421	457057063	/nfs/dbraw/zinc/05/70/63/457057063.db2.gz	OOQDZBCFWRWPOL-CABCVRRESA-N	0	3	343.475	3.342	20	30		EGEDHN
C[C@H](C1CCN(C)CC1)N(C)C(=O)C[C@@H](CC#N)c1ccccc1	ZINC000356632018	457092015	/nfs/dbraw/zinc/09/20/15/457092015.db2.gz	JCFKPSQJFGVDMT-VQIMIIECSA-N	0	3	327.472	3.263	20	30		EGEDHN
CN(C)CCN(C)C(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1	ZINC000359592620	457099329	/nfs/dbraw/zinc/09/93/29/457099329.db2.gz	OAZLNAZZGHMKML-UHFFFAOYSA-N	0	3	337.423	3.179	20	30		EGEDHN
Cc1nn(CC(F)(F)F)cc1C(=O)NCCN1CCCC(C)(C)C1	ZINC000330966936	457111265	/nfs/dbraw/zinc/11/12/65/457111265.db2.gz	LMYPWUGAXGHWSD-UHFFFAOYSA-N	0	3	346.397	3.180	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H](CC)N(C)Cc2ccccc2)CC1	ZINC000354280854	457170262	/nfs/dbraw/zinc/17/02/62/457170262.db2.gz	OXVFHSXTZLEQMK-HXUWFJFHSA-N	0	3	343.515	3.054	20	30		EGEDHN
C=CCOc1ccc(CNCC2(C(=O)NCC)CCC2)cc1Cl	ZINC000362994549	457187918	/nfs/dbraw/zinc/18/79/18/457187918.db2.gz	XNICIECLXHUNKU-UHFFFAOYSA-N	0	3	336.863	3.301	20	30		EGEDHN
CCc1cnccc1[C@@H](C)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000350824394	457208471	/nfs/dbraw/zinc/20/84/71/457208471.db2.gz	DWQPSIKLMFFYTE-KDOFPFPSSA-N	0	3	332.407	3.075	20	30		EGEDHN
N#CC1(CCCN2C[C@@H](O)C[C@@H]2c2ccc(F)cc2)CCOCC1	ZINC000331579221	457210995	/nfs/dbraw/zinc/21/09/95/457210995.db2.gz	LJSCSEMLXYZJGQ-ZWKOTPCHSA-N	0	3	332.419	3.034	20	30		EGEDHN
CC(C#N)C(=O)N[C@@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000347080133	457220008	/nfs/dbraw/zinc/22/00/08/457220008.db2.gz	WEYAATGFDCEELO-STQMWFEESA-N	0	3	339.370	3.415	20	30		EGEDHN
COc1ccc(-c2nc(C)c([C@@H](C)NC(=O)C(C)C#N)s2)cc1	ZINC000347109580	457234734	/nfs/dbraw/zinc/23/47/34/457234734.db2.gz	PWVXKUDBZBKUMS-GHMZBOCLSA-N	0	3	329.425	3.464	20	30		EGEDHN
N#CC(C(=O)c1cc(Cl)cc(Br)c1)c1ccncn1	ZINC000354471666	457244502	/nfs/dbraw/zinc/24/45/02/457244502.db2.gz	OKTSPXMFJMJVHY-NSHDSACASA-N	0	3	336.576	3.383	20	30		EGEDHN
CCC[C@@H]1CN(Cc2ccc(Cl)cc2C#N)CCN1CCOC	ZINC000360121296	457264884	/nfs/dbraw/zinc/26/48/84/457264884.db2.gz	GXPDVLFLLXVYIR-GOSISDBHSA-N	0	3	335.879	3.144	20	30		EGEDHN
CN(CCC#N)C(=O)CCN(Cc1ccc(F)cc1F)C1CCCC1	ZINC000356995194	457265129	/nfs/dbraw/zinc/26/51/29/457265129.db2.gz	GFAPFZZTCSPYAT-UHFFFAOYSA-N	0	3	349.425	3.472	20	30		EGEDHN
Cc1ccc(CNC(=O)C2CCN([C@H]3CC[C@H](C#N)C3)CC2)cc1	ZINC000331936391	457276430	/nfs/dbraw/zinc/27/64/30/457276430.db2.gz	MDJWNZSUKCUNHK-HKUYNNGSSA-N	0	3	325.456	3.016	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccnn2[C@@H](C)CC(C)C)CC1	ZINC000360501584	457316853	/nfs/dbraw/zinc/31/68/53/457316853.db2.gz	USMMKLLMGZOXND-HNNXBMFYSA-N	0	3	333.480	3.262	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]([C@@H]3CCOC3)C2)c(Br)c1	ZINC000360757899	457339889	/nfs/dbraw/zinc/33/98/89/457339889.db2.gz	VNUTWBKDPVLVLB-UKRRQHHQSA-N	0	3	335.245	3.179	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2nc3c(s2)C[C@@H](C)CC3)CC1	ZINC000332304975	457345226	/nfs/dbraw/zinc/34/52/26/457345226.db2.gz	LQUSMIMPAKKOKN-LBPRGKRZSA-N	0	3	334.489	3.040	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN1CCC[C@](C)(c2ccccc2)CC1	ZINC000352204549	457347864	/nfs/dbraw/zinc/34/78/64/457347864.db2.gz	XYUPODIFJOYYOH-RXVVDRJESA-N	0	3	341.499	3.438	20	30		EGEDHN
CN(CCNC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)C1CC1	ZINC000347314671	457347979	/nfs/dbraw/zinc/34/79/79/457347979.db2.gz	QZYOQRJEXBETHS-UHFFFAOYSA-N	0	3	349.434	3.369	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2nc3c(s2)C[C@H](C)CC3)CC1	ZINC000332358873	457355403	/nfs/dbraw/zinc/35/54/03/457355403.db2.gz	WKKIQOPULZWOOM-CYBMUJFWSA-N	0	3	348.516	3.430	20	30		EGEDHN
C=C[C@H](CO)NCc1cn(-c2ccccc2)nc1-c1ccc(C)cc1	ZINC000352448071	457376622	/nfs/dbraw/zinc/37/66/22/457376622.db2.gz	PWPHVGGTNUTSMR-LJQANCHMSA-N	0	3	333.435	3.484	20	30		EGEDHN
C=CCNC(=O)Nc1ccc(NC(=O)[C@H](C)NC(C)(C)CC)cc1	ZINC000355475924	457379933	/nfs/dbraw/zinc/37/99/33/457379933.db2.gz	SHWMQBAMWJBMSM-ZDUSSCGKSA-N	0	3	332.448	3.099	20	30		EGEDHN
C[C@H](C(=O)N[C@@H]1CC[C@H](C#N)C1)N1CCC(Cc2ccccc2)CC1	ZINC000424978915	457393954	/nfs/dbraw/zinc/39/39/54/457393954.db2.gz	QHURPWWTWQXBED-LSTHTHJFSA-N	0	3	339.483	3.138	20	30		EGEDHN
CCO[C@@H]1C[C@@H](NCC(=O)Nc2cccc(C#N)c2)C1(CC)CC	ZINC000360946529	457454214	/nfs/dbraw/zinc/45/42/14/457454214.db2.gz	KBQKILIIXMUYRD-IAGOWNOFSA-N	0	3	329.444	3.070	20	30		EGEDHN
COCC1(C#N)CCN(C[C@@H](C)Cc2ccc(OC)c(F)c2)CC1	ZINC000342841878	457551156	/nfs/dbraw/zinc/55/11/56/457551156.db2.gz	UOIBKBGYJZJYCX-HNNXBMFYSA-N	0	3	334.435	3.265	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)N[C@H](C)c1ccc(OC)c(OC)c1C	ZINC000347638433	457567271	/nfs/dbraw/zinc/56/72/71/457567271.db2.gz	JNQQARGRIGZTLD-CVEARBPZSA-N	0	3	346.471	3.252	20	30		EGEDHN
CCc1ccc2occ(C(=O)C(C#N)C(=O)Nc3ccccn3)c2c1	ZINC000408516494	457574964	/nfs/dbraw/zinc/57/49/64/457574964.db2.gz	ZWIWBWHSBHZICS-AWEZNQCLSA-N	0	3	333.347	3.351	20	30		EGEDHN
CC[C@@H](C)N[C@@H](CNC(=O)NCC(C)(C)CCC#N)c1ccco1	ZINC000357549284	457589199	/nfs/dbraw/zinc/58/91/99/457589199.db2.gz	USLGMINIMAUWPO-CABCVRRESA-N	0	3	334.464	3.338	20	30		EGEDHN
N#Cc1ccccc1-c1ccc(CN2CC[C@@H](n3cncn3)C2)cc1	ZINC000364495158	457624042	/nfs/dbraw/zinc/62/40/42/457624042.db2.gz	MAYPFOZCRFVSGR-LJQANCHMSA-N	0	3	329.407	3.264	20	30		EGEDHN
C[C@@]1(CNC(=O)c2cccc(CC#N)c2)CCN(Cc2ccccc2)C1	ZINC000370623502	457684890	/nfs/dbraw/zinc/68/48/90/457684890.db2.gz	YZGJEHHYFPRRAD-QFIPXVFZSA-N	0	3	347.462	3.395	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H]1CCN(C(=O)Nc2ccc(CC#N)cc2)C1	ZINC000365616436	457766242	/nfs/dbraw/zinc/76/62/42/457766242.db2.gz	AGVCLHOYJJMUOL-HXUWFJFHSA-N	0	3	348.450	3.491	20	30		EGEDHN
CN1CCN(C(=O)C(C#N)CCc2ccccc2)[C@@H](c2ccccc2)C1	ZINC000433231280	457785351	/nfs/dbraw/zinc/78/53/51/457785351.db2.gz	XPUIGLUFEVAETQ-LEWJYISDSA-N	0	3	347.462	3.274	20	30		EGEDHN
CN1CCN(C(=O)C(C#N)CCc2ccccc2)[C@H](c2ccccc2)C1	ZINC000433231283	457785521	/nfs/dbraw/zinc/78/55/21/457785521.db2.gz	XPUIGLUFEVAETQ-RTWAWAEBSA-N	0	3	347.462	3.274	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CCCC[C@H]1CN1CCCC1=O	ZINC000366369921	457807888	/nfs/dbraw/zinc/80/78/88/457807888.db2.gz	AQJWIWCLNAHJDO-SFHVURJKSA-N	0	3	339.483	3.465	20	30		EGEDHN
Cc1cc(CN[C@H]2CCN(C(=O)C3CCCCC3)C2)ccc1C#N	ZINC000443985324	457834939	/nfs/dbraw/zinc/83/49/39/457834939.db2.gz	GHTIAUIHKYJOKK-IBGZPJMESA-N	0	3	325.456	3.138	20	30		EGEDHN
Cc1cc(CN[C@@H]2CCN(C(=O)CCc3ccccc3)C2)ccc1C#N	ZINC000443999897	457838442	/nfs/dbraw/zinc/83/84/42/457838442.db2.gz	FIENLMHFRARSIZ-OAQYLSRUSA-N	0	3	347.462	3.190	20	30		EGEDHN
N#Cc1ccc(OCCN2CCC(F)(c3cccnc3)CC2)cc1	ZINC000375361042	457896915	/nfs/dbraw/zinc/89/69/15/457896915.db2.gz	INIXYSZQJDHVMV-UHFFFAOYSA-N	0	3	325.387	3.293	20	30		EGEDHN
C=CCN(CCC(=O)N1CCOc2ccccc21)CCc1ccco1	ZINC000411488971	457901396	/nfs/dbraw/zinc/90/13/96/457901396.db2.gz	JMSXZVMJKNQCGW-UHFFFAOYSA-N	0	3	340.423	3.126	20	30		EGEDHN
Cc1cc(NC(=O)c2cccc(F)c2C#N)ccc1OCCN(C)C	ZINC000458192781	457963389	/nfs/dbraw/zinc/96/33/89/457963389.db2.gz	CBGMDNWVGRHHFF-UHFFFAOYSA-N	0	3	341.386	3.199	20	30		EGEDHN
C=CCC[C@H](C(=O)NC[C@]1(N(C)C)CCSC1)c1ccccc1	ZINC000427251263	457967388	/nfs/dbraw/zinc/96/73/88/457967388.db2.gz	RWXDLUVOPCXRNH-PKOBYXMFSA-N	0	3	332.513	3.290	20	30		EGEDHN
CN(C)CCOc1ccc(NC(=O)[C@]2(C#N)CC23CCCC3)cc1F	ZINC000458281838	457999116	/nfs/dbraw/zinc/99/91/16/457999116.db2.gz	VCALTKXCALQDBD-LJQANCHMSA-N	0	3	345.418	3.179	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)N2CCCC23CCN(C)CC3)cc1	ZINC000367946342	458000786	/nfs/dbraw/zinc/00/07/86/458000786.db2.gz	WYIPTAYITXTVCG-UHFFFAOYSA-N	0	3	343.471	3.021	20	30		EGEDHN
C=CC[C@@H]1N(C(=O)NC[C@@]2(N(C)C)CCSC2)CCCC1(C)C	ZINC000445122493	458018120	/nfs/dbraw/zinc/01/81/20/458018120.db2.gz	YHUAHEMNAQBQJW-YJBOKZPZSA-N	0	3	339.549	3.200	20	30		EGEDHN
N#CC(C(=O)c1ccc([N+](=O)[O-])cc1)c1cc(C(F)(F)F)ccn1	ZINC000362115020	458029899	/nfs/dbraw/zinc/02/98/99/458029899.db2.gz	BFDDUDNHFIIURP-GFCCVEGCSA-N	0	3	335.241	3.499	20	30		EGEDHN
C=C(C)COc1cccc(NC(=O)NC[C@]2(N(C)C)CCSC2)c1	ZINC000362224560	458041930	/nfs/dbraw/zinc/04/19/30/458041930.db2.gz	VITMETJNRIFHKS-GOSISDBHSA-N	0	3	349.500	3.200	20	30		EGEDHN
C[C@@H](C(=O)N(C)CCC#N)N1CC[C@](C)(CCc2ccccc2)C1	ZINC000434904794	458063987	/nfs/dbraw/zinc/06/39/87/458063987.db2.gz	GWGXTHKXSBFWCZ-PXNSSMCTSA-N	0	3	327.472	3.092	20	30		EGEDHN
N#CC1(CCCN2CC[C@@]3(C2)OCc2ccccc23)CCOCC1	ZINC000369195432	458118405	/nfs/dbraw/zinc/11/84/05/458118405.db2.gz	ASKIDVPKIDSIDD-FQEVSTJZSA-N	0	3	326.440	3.218	20	30		EGEDHN
CC[C@H]1CCCCN1CCNC(=O)[C@@H](C#N)CCc1ccccc1	ZINC000435928221	458226350	/nfs/dbraw/zinc/22/63/50/458226350.db2.gz	OVDURZDKTIMNEJ-MOPGFXCFSA-N	0	3	327.472	3.140	20	30		EGEDHN
C[C@@H](Oc1ccc(C#N)cc1)C(=O)Nc1ccc(CN(C)C)cc1F	ZINC000412551449	458231078	/nfs/dbraw/zinc/23/10/78/458231078.db2.gz	RLXFRFBJMLPCSS-CYBMUJFWSA-N	0	3	341.386	3.165	20	30		EGEDHN
CC(C#N)C(=O)N[C@H]1C[C@H](c2ccc(F)c(Br)c2)C1	ZINC000435994009	458234201	/nfs/dbraw/zinc/23/42/01/458234201.db2.gz	NIHWTYPRLOUAOO-FBIMIBRVSA-N	0	3	325.181	3.110	20	30		EGEDHN
C[C@H]1CN(CCC(=O)Nc2ccc(C#N)cc2)Cc2ccccc2O1	ZINC000429150874	458281884	/nfs/dbraw/zinc/28/18/84/458281884.db2.gz	PRHABXWWDWJUMH-HNNXBMFYSA-N	0	3	335.407	3.170	20	30		EGEDHN
COc1ccc([C@H](CN2CCCC2)Nc2ncc(C#N)cc2F)cc1	ZINC000413231923	458296726	/nfs/dbraw/zinc/29/67/26/458296726.db2.gz	KAQYQHMPTSAFDO-SFHVURJKSA-N	0	3	340.402	3.350	20	30		EGEDHN
N#Cc1ccc(CN[C@H](c2ccccc2)C2(CO)CCOCC2)s1	ZINC000414542358	458323082	/nfs/dbraw/zinc/32/30/82/458323082.db2.gz	RGVMNPZKGGCNJQ-GOSISDBHSA-N	0	3	342.464	3.240	20	30		EGEDHN
C=CCc1cc(CNC[C@H]2NCCc3ccccc32)cc(OC)c1O	ZINC000414954011	458326376	/nfs/dbraw/zinc/32/63/76/458326376.db2.gz	KNRDYEJUPZIOFD-LJQANCHMSA-N	0	3	338.451	3.106	20	30		EGEDHN
C=CCOc1ccc(CNC[C@H]2NCCc3ccccc32)cc1OC	ZINC000414957032	458326684	/nfs/dbraw/zinc/32/66/84/458326684.db2.gz	PFMWPUMBGCFCNB-LJQANCHMSA-N	0	3	338.451	3.237	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Nc1cc(N)ccc1F)C(C)C	ZINC000415900978	458335296	/nfs/dbraw/zinc/33/52/96/458335296.db2.gz	JTEWIZXNIFMEFV-KRWDZBQOSA-N	0	3	334.439	3.228	20	30		EGEDHN
COc1cc(CN[C@H]2CCCc3cc(C#N)ccc32)cc2c1OCO2	ZINC000418148964	458372653	/nfs/dbraw/zinc/37/26/53/458372653.db2.gz	UQIHEAYJDXPBAM-KRWDZBQOSA-N	0	3	336.391	3.463	20	30		EGEDHN
N#Cc1cccc(NC(=O)C2CCN(CCOCC3CCC3)CC2)c1	ZINC000419256235	458380198	/nfs/dbraw/zinc/38/01/98/458380198.db2.gz	HEKUTWZBGDVPFX-UHFFFAOYSA-N	0	3	341.455	3.025	20	30		EGEDHN
CC(C)CN(CCN(C)C)C(=O)N[C@@H]1CCCc2cc(C#N)ccc21	ZINC000419612815	458386995	/nfs/dbraw/zinc/38/69/95/458386995.db2.gz	JRTHRQOOQNCTOH-LJQANCHMSA-N	0	3	342.487	3.165	20	30		EGEDHN
C=CCC[C@H]1NC(=O)N(CC(C)(C)N[C@H](C)c2ccccc2)C1=O	ZINC000419994619	458394922	/nfs/dbraw/zinc/39/49/22/458394922.db2.gz	HLHRHPNEZHJLRP-GDBMZVCRSA-N	0	3	329.444	3.002	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCc1ccc(OC)c(OCc2cccnc2)c1	ZINC000449518699	458426751	/nfs/dbraw/zinc/42/67/51/458426751.db2.gz	KLGVEYHOVCNCAT-MSOLQXFVSA-N	0	3	340.423	3.102	20	30		EGEDHN
COc1cccc(NC(=O)C[C@H](C)NCc2ccc(C#N)c(F)c2)c1	ZINC000449734290	458430019	/nfs/dbraw/zinc/43/00/19/458430019.db2.gz	BCMVZQVMBFVWJN-ZDUSSCGKSA-N	0	3	341.386	3.213	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)CCCC1	ZINC000449824900	458431988	/nfs/dbraw/zinc/43/19/88/458431988.db2.gz	FZEVTALIKBCDSW-ROUUACIJSA-N	0	3	348.531	3.471	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)cc2OC(F)F)CCN(C2CC2)C1	ZINC000451093902	458464618	/nfs/dbraw/zinc/46/46/18/458464618.db2.gz	ZNWAFXBZEDNAKW-CYBMUJFWSA-N	0	3	335.398	3.076	20	30		EGEDHN
C[C@@H](Cc1cccc(F)c1)N(C)C[C@H](O)COc1ccc(C#N)cc1	ZINC000459758373	458470633	/nfs/dbraw/zinc/47/06/33/458470633.db2.gz	QCUSKYULNJUGTR-KXBFYZLASA-N	0	3	342.414	3.000	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NC[C@@H](CC)N1CCc2ccccc2C1	ZINC000437727405	458486479	/nfs/dbraw/zinc/48/64/79/458486479.db2.gz	QBGNIOKFQFCKBW-CTNGQTDRSA-N	0	3	344.499	3.168	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@@H](C)NC1(Cc2ccccc2)CCOCC1	ZINC000451938099	458492059	/nfs/dbraw/zinc/49/20/59/458492059.db2.gz	IDIHDRLBDOTWQD-GOSISDBHSA-N	0	3	344.499	3.181	20	30		EGEDHN
C[C@@H]1CN(C(=O)C[C@@H](CC#N)c2ccccc2)CCN(C2CC2)C1	ZINC000452167212	458497106	/nfs/dbraw/zinc/49/71/06/458497106.db2.gz	BOSGLJRBWOMQPP-FUHWJXTLSA-N	0	3	325.456	3.017	20	30		EGEDHN
C=CCC[C@H](CO)N[C@H]1CCc2c1cc(Br)cc2F	ZINC000453365289	458524805	/nfs/dbraw/zinc/52/48/05/458524805.db2.gz	RKCWYVOENBQPOJ-ABAIWWIYSA-N	0	3	328.225	3.492	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)cc1F	ZINC000453383825	458526544	/nfs/dbraw/zinc/52/65/44/458526544.db2.gz	MUCMLJLDMXKLBC-HOTGVXAUSA-N	0	3	343.362	3.076	20	30		EGEDHN
C=CCn1c([C@H](C)CC)nnc1N1CCN([C@@H]2C[C@@H]2C)C[C@H](C)C1	ZINC000453423102	458527443	/nfs/dbraw/zinc/52/74/43/458527443.db2.gz	BKKWNQJBXDBLBJ-VVLHAWIVSA-N	0	3	331.508	3.144	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CCCCO2)nnc1N1CCN([C@@H](C)CC)CC1	ZINC000453464874	458533050	/nfs/dbraw/zinc/53/30/50/458533050.db2.gz	MEPLQYHDXBGCDJ-DLBZAZTESA-N	0	3	347.507	3.016	20	30		EGEDHN
COc1cc(CN2CC[C@@](C)(C(=O)OC(C)(C)C)C2)ccc1C#N	ZINC000453623778	458538708	/nfs/dbraw/zinc/53/87/08/458538708.db2.gz	PFOUFSGPGDJFPQ-LJQANCHMSA-N	0	3	330.428	3.121	20	30		EGEDHN
Cc1nc(C(C)C)ccc1C(=O)C(C#N)c1nnc2n1CCCCC2	ZINC000453630298	458539183	/nfs/dbraw/zinc/53/91/83/458539183.db2.gz	YUCBRGPHYOIEOJ-OAHLLOKOSA-N	0	3	337.427	3.321	20	30		EGEDHN
CC(C)[C@@H](CN[C@H](C(N)=O)c1ccc(C#N)cc1)Cc1ccccc1	ZINC000468851378	458539664	/nfs/dbraw/zinc/53/96/64/458539664.db2.gz	DMGKBMFBDRLBHJ-UXHICEINSA-N	0	3	335.451	3.189	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N(Cc1cccs1)Cc1cccs1	ZINC000424067176	458549116	/nfs/dbraw/zinc/54/91/16/458549116.db2.gz	OQLDWIUVYHTYQJ-OAHLLOKOSA-N	0	3	333.482	3.360	20	30		EGEDHN
Cc1ccnc(Oc2cc(NC(=O)[C@@H](N)CCCC#N)ccc2C)c1	ZINC000424142436	458569145	/nfs/dbraw/zinc/56/91/45/458569145.db2.gz	IFZDUGZZOVMACA-INIZCTEOSA-N	0	3	338.411	3.450	20	30		EGEDHN
Cc1cccc(Oc2ncccc2NC(=O)[C@@H](N)CCCC#N)c1C	ZINC000424141792	458569474	/nfs/dbraw/zinc/56/94/74/458569474.db2.gz	XKILOJWAVFZXGQ-HNNXBMFYSA-N	0	3	338.411	3.450	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1	ZINC000424170050	458576242	/nfs/dbraw/zinc/57/62/42/458576242.db2.gz	KMBPRVVZUBIMNE-LSDHHAIUSA-N	0	3	339.361	3.294	20	30		EGEDHN
C=CCN(CC=C)C[C@@H](O)COc1cc(F)cc(Br)c1	ZINC000438846511	458620722	/nfs/dbraw/zinc/62/07/22/458620722.db2.gz	KHFAKSYFCZLVBH-CQSZACIVSA-N	0	3	344.224	3.002	20	30		EGEDHN
C=CC(C)(C)CNC(=O)N1CCN(Cc2ccccc2)C[C@H](C)C1	ZINC000455386092	458595672	/nfs/dbraw/zinc/59/56/72/458595672.db2.gz	ORJZUCPGYZBQAC-KRWDZBQOSA-N	0	3	329.488	3.362	20	30		EGEDHN
C[C@H](C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(C#N)c1	ZINC000462260669	458607640	/nfs/dbraw/zinc/60/76/40/458607640.db2.gz	TVQWPZOIRPWIMK-LAUBAEHRSA-N	0	3	347.462	3.395	20	30		EGEDHN
C=CCn1cc(CN[C@@H]2CCCC[C@@H]2c2ccc(OC)c(F)c2)nn1	ZINC000424297272	458608075	/nfs/dbraw/zinc/60/80/75/458608075.db2.gz	QBFWLIKLHBTNAV-SJLPKXTDSA-N	0	3	344.434	3.428	20	30		EGEDHN
C[C@H]1[C@H](NC(=O)Nc2ccc(OC(C)(C)C)c(C#N)c2)CCCN1C	ZINC000455768895	458613493	/nfs/dbraw/zinc/61/34/93/458613493.db2.gz	LEKVQKNVRVCPFZ-XJKSGUPXSA-N	0	3	344.459	3.340	20	30		EGEDHN
C[C@@H](CNC(=O)Nc1cccc(CC#N)c1)N(C)Cc1ccccc1	ZINC000455916250	458621140	/nfs/dbraw/zinc/62/11/40/458621140.db2.gz	IDDYOPJPTPZASS-INIZCTEOSA-N	0	3	336.439	3.395	20	30		EGEDHN
C[C@H]1[C@@H](NC(=O)c2ccc(F)c(C#N)c2)CCN1Cc1ccccc1	ZINC000494052237	458621471	/nfs/dbraw/zinc/62/14/71/458621471.db2.gz	WYFHOJRHDDLXDB-LIRRHRJNSA-N	0	3	337.398	3.090	20	30		EGEDHN
C[C@H]1C[C@H](N2CCCC2)CN1C(=O)C(C)(C)Cc1ccc(C#N)cc1	ZINC000456065982	458630597	/nfs/dbraw/zinc/63/05/97/458630597.db2.gz	VEDRYKORHZVHKV-LPHOPBHVSA-N	0	3	339.483	3.212	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CCN(Cc2ccccc2)C[C@@H](C)C1)OCC	ZINC000456338926	458637935	/nfs/dbraw/zinc/63/79/35/458637935.db2.gz	OPBXRBZQIYDERG-UYAOXDASSA-N	0	3	344.499	3.338	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CCN(C(=O)c2cccc(CC#N)c2)C1	ZINC000456330968	458637959	/nfs/dbraw/zinc/63/79/59/458637959.db2.gz	JSWBCCVJFHGXEY-SFHVURJKSA-N	0	3	347.462	3.347	20	30		EGEDHN
Cc1cc(C)c(CNC(=O)C(C#N)Cc2ccc(C#N)cc2)c(C)c1	ZINC000470797363	458652291	/nfs/dbraw/zinc/65/22/91/458652291.db2.gz	SDZBJOGYRFLEGY-IBGZPJMESA-N	0	3	331.419	3.482	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CC[C@H](C(F)(F)F)[C@H]1C	ZINC000470952677	458668498	/nfs/dbraw/zinc/66/84/98/458668498.db2.gz	GQDBUOYRQWLDGB-BMFZPTHFSA-N	0	3	343.389	3.428	20	30		EGEDHN
COc1cccc([C@@H]2C[C@H]2NC(=O)C(C#N)CCc2ccccc2)c1	ZINC000456541888	458708730	/nfs/dbraw/zinc/70/87/30/458708730.db2.gz	XLFMZPKJPUXTLU-YZGWKJHDSA-N	0	3	334.419	3.440	20	30		EGEDHN
CO[C@@H]1C[C@@H](N(C)C(=O)C(C#N)CCc2ccccc2)C12CCC2	ZINC000456591219	458723108	/nfs/dbraw/zinc/72/31/08/458723108.db2.gz	QAQJUVDNGGMPPZ-KZNAEPCWSA-N	0	3	326.440	3.175	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](C)CCCC(F)(F)F)CC1	ZINC000494804711	458747567	/nfs/dbraw/zinc/74/75/67/458747567.db2.gz	NBAWJIRXSWADOI-CYBMUJFWSA-N	0	3	335.414	3.447	20	30		EGEDHN
C=CCNC(=O)C(C)S(=O)(=O)Cc1ccc(C2CCCCC2)cc1	ZINC000507833997	458755801	/nfs/dbraw/zinc/75/58/01/458755801.db2.gz	NTSYVXMAMIKDFN-HNNXBMFYSA-N	0	3	349.496	3.340	20	30		EGEDHN
C=CCn1c(CC2CCCCC2)nnc1N1CCN(CC2CC2)CC1	ZINC000508890388	458766816	/nfs/dbraw/zinc/76/68/16/458766816.db2.gz	XDFLBUJJGPLZNT-UHFFFAOYSA-N	0	3	343.519	3.119	20	30		EGEDHN
C=CCn1c(-c2ccc(C)s2)nnc1N1CCN(CC(C)C)CC1	ZINC000508910864	458767027	/nfs/dbraw/zinc/76/70/27/458767027.db2.gz	FTCFCXZIZRADQF-UHFFFAOYSA-N	0	3	345.516	3.279	20	30		EGEDHN
CC(C)CN1CCN([C@H](C#N)c2ccc(Br)cc2)CC1	ZINC000512450159	458784409	/nfs/dbraw/zinc/78/44/09/458784409.db2.gz	PALNRCQCROUZJP-MRXNPFEDSA-N	0	3	336.277	3.287	20	30		EGEDHN
Cc1nc(CNC(=O)OC(C)(C)C)ccc1[C@@H](C)NCCCC#N	ZINC000495177574	458805906	/nfs/dbraw/zinc/80/59/06/458805906.db2.gz	ZLSMVDSFYMEYSR-CYBMUJFWSA-N	0	3	332.448	3.369	20	30		EGEDHN
C=CCN(Cc1ccccc1)S(=O)(=O)c1ccc(CN(C)C)cc1	ZINC000432880756	458806976	/nfs/dbraw/zinc/80/69/76/458806976.db2.gz	ZAOXAJNGFNMEIN-UHFFFAOYSA-N	0	3	344.480	3.125	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2CCc3ccc(F)cc32)CC1	ZINC000517349497	458828881	/nfs/dbraw/zinc/82/88/81/458828881.db2.gz	OFVZOVOTFSDQJL-GOSISDBHSA-N	0	3	331.435	3.153	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cc2ccccn2c1)C(C)C	ZINC000530824624	458831039	/nfs/dbraw/zinc/83/10/39/458831039.db2.gz	WATAINBXCKIAGV-LJQANCHMSA-N	0	3	325.456	3.368	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N1CCS[C@@H](CC)C1)C(C)C	ZINC000465539316	458831992	/nfs/dbraw/zinc/83/19/92/458831992.db2.gz	CSLNLQQPSHKEMI-IRXDYDNUSA-N	0	3	339.549	3.222	20	30		EGEDHN
C=C(C)CN1CCC(Nc2nc3ccccc3cc2[N+](=O)[O-])CC1	ZINC000473531456	458833492	/nfs/dbraw/zinc/83/34/92/458833492.db2.gz	LMAIOGKHLNVJJX-UHFFFAOYSA-N	0	3	326.400	3.017	20	30		EGEDHN
COc1cc(CNc2ccc(C)cc2OCCN(C)C)ccc1C#N	ZINC000440632683	458835528	/nfs/dbraw/zinc/83/55/28/458835528.db2.gz	CQWITXZQMXGVCK-UHFFFAOYSA-N	0	3	339.439	3.428	20	30		EGEDHN
CC1(CC(F)(F)F)CN(C(=O)C(C#N)Cc2ccc(C#N)cc2)C1	ZINC000457098469	458867375	/nfs/dbraw/zinc/86/73/75/458867375.db2.gz	LVSRJPYBIUMJHO-AWEZNQCLSA-N	0	3	335.329	3.041	20	30		EGEDHN
CN(C(=O)CN[C@@H](c1cccs1)C1CC1)C1(C#N)CCCCC1	ZINC000553313758	458894525	/nfs/dbraw/zinc/89/45/25/458894525.db2.gz	ZKLOPCWPFCCTPX-QGZVFWFLSA-N	0	3	331.485	3.474	20	30		EGEDHN
C=CCOCCN1CCC(N(CC2CC2)C(=O)OC(C)(C)C)CC1	ZINC000495650235	458908646	/nfs/dbraw/zinc/90/86/46/458908646.db2.gz	HHZYPGVFAZKPBN-UHFFFAOYSA-N	0	3	338.492	3.301	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@H]1NCc1ccc(C#N)cn1	ZINC000495707013	458924930	/nfs/dbraw/zinc/92/49/30/458924930.db2.gz	FNOPYKIQKUHLCE-DOTOQJQBSA-N	0	3	344.459	3.126	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cccc(N(C)C)c1)C(C)C	ZINC000441872899	458978956	/nfs/dbraw/zinc/97/89/56/458978956.db2.gz	LTYDRPYEPZUUFS-LJQANCHMSA-N	0	3	329.488	3.181	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN[C@@H]1CCCc2occc21	ZINC000566792298	459001340	/nfs/dbraw/zinc/00/13/40/459001340.db2.gz	QAWBSSLQXGXTNF-SJLPKXTDSA-N	0	3	327.424	3.415	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(CN[C@@H]3CC[C@H](C#N)C3)cc2)C[C@@H](C)O1	ZINC000442722344	459026790	/nfs/dbraw/zinc/02/67/90/459026790.db2.gz	VDMLHHYCSIDDJX-YAJHFMINSA-N	0	3	327.472	3.078	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN1CCC[C@H](Cc2ccc(C)cc2)C1	ZINC000566991948	459032611	/nfs/dbraw/zinc/03/26/11/459032611.db2.gz	DUEBDVFZJZLAAK-AZUAARDMSA-N	0	3	341.499	3.258	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1ccn(C2CCCC2)n1)C(C)C	ZINC000477231649	459036329	/nfs/dbraw/zinc/03/63/29/459036329.db2.gz	NEYRQKBBVQBXLZ-IBGZPJMESA-N	0	3	344.503	3.427	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN(C)Cc1cccc(F)c1	ZINC000520619253	459079804	/nfs/dbraw/zinc/07/98/04/459079804.db2.gz	OVENCNCQXJEAER-IBGZPJMESA-N	0	3	329.415	3.426	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(Cc2ccccc2C)C2CC2)CC1	ZINC000520709764	459085614	/nfs/dbraw/zinc/08/56/14/459085614.db2.gz	COJZXZUDXVEAOO-UHFFFAOYSA-N	0	3	327.472	3.319	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@@H]2CN(C)C[C@H]2c2ccccc2)cc1	ZINC000478405031	459089948	/nfs/dbraw/zinc/08/99/48/459089948.db2.gz	ZKAJUBICFKIWOP-VQTJNVASSA-N	0	3	336.435	3.079	20	30		EGEDHN
Cn1cc(CNC[C@@H](c2ccccc2Cl)N2CCCC2)cc1C#N	ZINC000577802108	459096388	/nfs/dbraw/zinc/09/63/88/459096388.db2.gz	ZFYIDZQTPWMHDY-IBGZPJMESA-N	0	3	342.874	3.477	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CC2(CCOCC2)[C@H]1C1CC1	ZINC000520871298	459101717	/nfs/dbraw/zinc/10/17/17/459101717.db2.gz	FNAMHZVHCCPRCI-RBUKOAKNSA-N	0	3	338.451	3.177	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1CCN([C@@H]2C[C@@H]2C)C[C@@H](C)C1	ZINC000558023837	459126761	/nfs/dbraw/zinc/12/67/61/459126761.db2.gz	FRBTWKYMWMPTLR-SOLBZPMBSA-N	0	3	328.456	3.054	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN[C@@H]2CCC2(C)C)cc1	ZINC000521639202	459169411	/nfs/dbraw/zinc/16/94/11/459169411.db2.gz	BUYCQICFNCNYNH-QGZVFWFLSA-N	0	3	329.444	3.110	20	30		EGEDHN
C=CCCSCCNCc1cc2c(cc1OC(F)F)OCO2	ZINC000594959722	459194066	/nfs/dbraw/zinc/19/40/66/459194066.db2.gz	AWIVUEWQDDCWCP-UHFFFAOYSA-N	0	3	331.384	3.416	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN[C@@H](C)[C@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000496444570	459194999	/nfs/dbraw/zinc/19/49/99/459194999.db2.gz	SCDHZZHSCVNXMG-ILXRZTDVSA-N	0	3	347.459	3.369	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC(=O)Nc1ccc(Cl)c(Cl)c1	ZINC000578485729	459209419	/nfs/dbraw/zinc/20/94/19/459209419.db2.gz	FNEGMSHUXJHKAG-KGLIPLIRSA-N	0	3	329.227	3.255	20	30		EGEDHN
C=CC1CCN(C(=O)NC[C@H]2CCCN2Cc2ccccc2)CC1	ZINC000522277219	459234300	/nfs/dbraw/zinc/23/43/00/459234300.db2.gz	BGWZRMSDFWRBPC-LJQANCHMSA-N	0	3	327.472	3.259	20	30		EGEDHN
CN(CC#Cc1ccc(OC(F)(F)F)cc1)C[C@@H]1CCCC[C@H]1O	ZINC000481546529	459260744	/nfs/dbraw/zinc/26/07/44/459260744.db2.gz	TXADXUQKVUBOIL-DOTOQJQBSA-N	0	3	341.373	3.420	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)[C@@H]1C[C@@H]2CCCC[C@H]2NC1=O	ZINC000595290919	459267397	/nfs/dbraw/zinc/26/73/97/459267397.db2.gz	NODSVYFEMOUOQK-IPMKNSEASA-N	0	3	325.456	3.218	20	30		EGEDHN
CN(CC[C@H]1Sc2ccccc2NC1=O)Cc1ccc(C#N)cc1	ZINC000595290095	459267970	/nfs/dbraw/zinc/26/79/70/459267970.db2.gz	VCBLNNUEAIBZOJ-GOSISDBHSA-N	0	3	337.448	3.493	20	30		EGEDHN
CCO[C@@H]1C[C@H](N[C@@H](C)C(=O)NC2(C#N)CCCCC2)C1(CC)CC	ZINC000482126562	459291741	/nfs/dbraw/zinc/29/17/41/459291741.db2.gz	MLBUSZOIABTKTB-YESZJQIVSA-N	0	3	349.519	3.291	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](C2CCCCC2)C(F)(F)F)CC1	ZINC000482270525	459300072	/nfs/dbraw/zinc/30/00/72/459300072.db2.gz	FOFJADOPQCSHDD-HNNXBMFYSA-N	0	3	347.425	3.447	20	30		EGEDHN
N#CC[C@H]1CCCN(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)C1	ZINC000595438761	459301725	/nfs/dbraw/zinc/30/17/25/459301725.db2.gz	ARBUMBRVVWOVAV-MJGOQNOKSA-N	0	3	340.471	3.159	20	30		EGEDHN
CC#CCCNC(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1	ZINC000482891281	459330162	/nfs/dbraw/zinc/33/01/62/459330162.db2.gz	PSLRPELALLKXFG-LJQANCHMSA-N	0	3	327.472	3.172	20	30		EGEDHN
C[C@@H](CN1CCC(C)CC1)NC(=O)N[C@H](CCC#N)c1ccccc1	ZINC000595568551	459349317	/nfs/dbraw/zinc/34/93/17/459349317.db2.gz	VLCWKBWAIQNRIU-PKOBYXMFSA-N	0	3	342.487	3.451	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)C(=O)Nc1cnc2c(c1)CNCC2	ZINC000591310724	459351502	/nfs/dbraw/zinc/35/15/02/459351502.db2.gz	GFHQWWXZASFNRP-UHFFFAOYSA-N	0	3	349.438	3.043	20	30		EGEDHN
Cc1cc(C#N)cc(NC(=O)[C@@H]2CCCN(Cc3cccnc3)C2)c1	ZINC000560469607	459352722	/nfs/dbraw/zinc/35/27/22/459352722.db2.gz	WZLVTFVXLYNEPC-GOSISDBHSA-N	0	3	334.423	3.112	20	30		EGEDHN
C[C@H](C(=O)NC1(C#N)CCC1)N1CCC[C@](C)(c2ccccc2)CC1	ZINC000560470431	459353275	/nfs/dbraw/zinc/35/32/75/459353275.db2.gz	WDDCQMMVFHKFTL-XLIONFOSSA-N	0	3	339.483	3.381	20	30		EGEDHN
N#CC[C@H]1CCCN(C[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000595613781	459368752	/nfs/dbraw/zinc/36/87/52/459368752.db2.gz	HIZDXCLXTCTCNJ-HIFRSBDPSA-N	0	3	342.361	3.071	20	30		EGEDHN
CN(CC(=O)NC1(C#N)CCC1)[C@@H]1CCCC[C@H]1c1ccccc1	ZINC000560725218	459390223	/nfs/dbraw/zinc/39/02/23/459390223.db2.gz	XHLCYLLTGGEVJY-ZWKOTPCHSA-N	0	3	325.456	3.207	20	30		EGEDHN
C=CCN(CCOC)C[C@H](O)Cn1c2ccccc2c2ccccc21	ZINC000484581621	459421889	/nfs/dbraw/zinc/42/18/89/459421889.db2.gz	HKLDWLLWFQDZGB-KRWDZBQOSA-N	0	3	338.451	3.290	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Nc1cccc2c1OCO2)C(C)C	ZINC000541098866	459427217	/nfs/dbraw/zinc/42/72/17/459427217.db2.gz	PRNVZCIWEVLJQM-INIZCTEOSA-N	0	3	345.443	3.235	20	30		EGEDHN
CCc1cccc(OC[C@@H](O)CN[C@H]2CCc3cc(C#N)ccc32)c1	ZINC000591763702	459430341	/nfs/dbraw/zinc/43/03/41/459430341.db2.gz	CWAVXYOHYHFTDE-RXVVDRJESA-N	0	3	336.435	3.137	20	30		EGEDHN
Cc1ccc(C)c(OC[C@@H](O)CN[C@@H]2CCc3cc(C#N)ccc32)c1	ZINC000591763853	459430448	/nfs/dbraw/zinc/43/04/48/459430448.db2.gz	MYBCCKSSLXLKHI-AZUAARDMSA-N	0	3	336.435	3.192	20	30		EGEDHN
Cc1ccc(C)c(OC[C@@H](O)CNCc2ccc(C#N)c(Cl)c2)c1	ZINC000591765761	459431602	/nfs/dbraw/zinc/43/16/02/459431602.db2.gz	GGGWDMFLOPFZDQ-KRWDZBQOSA-N	0	3	344.842	3.358	20	30		EGEDHN
C[C@@H](c1ccncc1)N1CCC(Nc2nc3c(cc2C#N)CCC3)CC1	ZINC000591822212	459448589	/nfs/dbraw/zinc/44/85/89/459448589.db2.gz	GIYXEZYGKCHNDA-HNNXBMFYSA-N	0	3	347.466	3.474	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)Cc1cccc(NS(C)(=O)=O)c1	ZINC000591839083	459452661	/nfs/dbraw/zinc/45/26/61/459452661.db2.gz	DIKDCJDVXSNQQC-CQSZACIVSA-N	0	3	343.452	3.123	20	30		EGEDHN
CN(CCC(=O)Nc1ccc(C#N)c(Cl)c1)CC1=CCSC1	ZINC000595889274	459476438	/nfs/dbraw/zinc/47/64/38/459476438.db2.gz	TXTGZHHDLLKESJ-UHFFFAOYSA-N	0	3	335.860	3.145	20	30		EGEDHN
N#CC1(NC(=O)CN[C@@H](c2ccc(F)cc2)C2CCCC2)CCC1	ZINC000525886412	459511468	/nfs/dbraw/zinc/51/14/68/459511468.db2.gz	OEVRQZLEMARTMD-GOSISDBHSA-N	0	3	329.419	3.209	20	30		EGEDHN
Cc1ccc(C#N)nc1NCc1ccc(OCCN2CCCC2)cc1	ZINC000596119769	459527422	/nfs/dbraw/zinc/52/74/22/459527422.db2.gz	BIGXEGGQJDWZGH-UHFFFAOYSA-N	0	3	336.439	3.348	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cccc(F)c2C#N)C1	ZINC000488699573	459547908	/nfs/dbraw/zinc/54/79/08/459547908.db2.gz	DDLDIIKPIFHYOB-GDBMZVCRSA-N	0	3	337.398	3.263	20	30		EGEDHN
CC(C)(C)[C@H]1CCN([C@H]2CCCN(c3ccc(C#N)cc3)C2=O)C1	ZINC000542320829	459547953	/nfs/dbraw/zinc/54/79/53/459547953.db2.gz	WVCMEKUQUQMFIX-WMZOPIPTSA-N	0	3	325.456	3.422	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000488733663	459549348	/nfs/dbraw/zinc/54/93/48/459549348.db2.gz	PEUJEEXAZMJKCQ-MJGOQNOKSA-N	0	3	337.467	3.315	20	30		EGEDHN
N#CC1(NC(=O)CN(CCc2ccccc2F)C2CCCC2)CCC1	ZINC000526135218	459554818	/nfs/dbraw/zinc/55/48/18/459554818.db2.gz	HTMPXYFRZJUKPH-UHFFFAOYSA-N	0	3	343.446	3.175	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@H]1CCCN(Cc2cccs2)C1	ZINC000488985168	459556985	/nfs/dbraw/zinc/55/69/85/459556985.db2.gz	QOTCHTKDCUCJJT-MRXNPFEDSA-N	0	3	343.496	3.378	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000497794558	459558215	/nfs/dbraw/zinc/55/82/15/459558215.db2.gz	VEUQWVVEYBZGAB-UHFFFAOYSA-N	0	3	344.499	3.422	20	30		EGEDHN
COC[C@@H](NCC(=O)Nc1sc2c(c1C#N)CCCCC2)C(C)C	ZINC000542525241	459566652	/nfs/dbraw/zinc/56/66/52/459566652.db2.gz	IBIWPWPMXDYMDZ-OAHLLOKOSA-N	0	3	349.500	3.088	20	30		EGEDHN
C=CC[C@H](C(=O)Nc1ccnc(OCCN(C)C)c1)c1ccccc1	ZINC000489607276	459568642	/nfs/dbraw/zinc/56/86/42/459568642.db2.gz	RRINWXAKVTYSMO-SFHVURJKSA-N	0	3	339.439	3.320	20	30		EGEDHN
C[C@H]1[C@H](Nc2nc(C#N)c(Cl)s2)CCN1Cc1ccccc1	ZINC000596236480	459570522	/nfs/dbraw/zinc/57/05/22/459570522.db2.gz	XKDJPUQIBPKOFN-WCQYABFASA-N	0	3	332.860	3.165	20	30		EGEDHN
CCn1nc(C)c(CNC2CCN(c3ccc(C#N)cc3)CC2)c1C	ZINC000583646890	459575569	/nfs/dbraw/zinc/57/55/69/459575569.db2.gz	TWOGUKLYJPEABG-UHFFFAOYSA-N	0	3	337.471	3.150	20	30		EGEDHN
CN(C)CCN(Cc1ccsc1)c1nc(C#N)c(Cl)s1	ZINC000596271539	459581212	/nfs/dbraw/zinc/58/12/12/459581212.db2.gz	RGRYGQVXBHQOOW-UHFFFAOYSA-N	0	3	326.878	3.298	20	30		EGEDHN
N#CCC1(CNC(=O)NCCN2CCC3(CCCCC3)CC2)CC1	ZINC000572564203	459581614	/nfs/dbraw/zinc/58/16/14/459581614.db2.gz	OQPSINCCLWTFPG-UHFFFAOYSA-N	0	3	332.492	3.026	20	30		EGEDHN
N#CCC1CCN(C(=O)NC[C@H](c2ccccc2)N2CCCC2)CC1	ZINC000542892910	459607831	/nfs/dbraw/zinc/60/78/31/459607831.db2.gz	GGYDMGGPCNGRCG-LJQANCHMSA-N	0	3	340.471	3.159	20	30		EGEDHN
C#CCNC(=O)C1CCN(c2c3ccccc3nc(C)c2CC)CC1	ZINC000491646960	459645340	/nfs/dbraw/zinc/64/53/40/459645340.db2.gz	VJPGSIXOACPLMD-UHFFFAOYSA-N	0	3	335.451	3.071	20	30		EGEDHN
C#C[C@H](CC)NC(=O)Nc1cc(Cl)ccc1OC1CCN(C)CC1	ZINC000491642108	459645898	/nfs/dbraw/zinc/64/58/98/459645898.db2.gz	VOJPXUYHAMDJJW-CQSZACIVSA-N	0	3	349.862	3.346	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H]2C[C@H](c3ccccc3)C[C@H](C)C2)CC1	ZINC000491771763	459669658	/nfs/dbraw/zinc/66/96/58/459669658.db2.gz	PHWDLSLYCWRCHL-IOMROCGXSA-N	0	3	338.495	3.420	20	30		EGEDHN
C=CCC[C@@H](C)NCc1ccc(S(=O)(=O)N(CC)CC)s1	ZINC000543603838	459673956	/nfs/dbraw/zinc/67/39/56/459673956.db2.gz	XEHPAYIZNBTZCO-CYBMUJFWSA-N	0	3	330.519	3.223	20	30		EGEDHN
C=C(C)CN1CCC(NCc2ncc(Br)cc2F)CC1	ZINC000527655960	459686590	/nfs/dbraw/zinc/68/65/90/459686590.db2.gz	BZRVVFNUGGYIHH-UHFFFAOYSA-N	0	3	342.256	3.113	20	30		EGEDHN
CN(C)CCc1ccccc1NC(=O)/C=C\c1ccc(OCC#N)cc1	ZINC000491973179	459686736	/nfs/dbraw/zinc/68/67/36/459686736.db2.gz	OLCSATOWNSIUGS-XFXZXTDPSA-N	0	3	349.434	3.345	20	30		EGEDHN
CC1(C)CN(C(=O)C(C#N)Cc2ccc(C#N)cc2)[C@@H]1c1cccnc1	ZINC000592800986	459693650	/nfs/dbraw/zinc/69/36/50/459693650.db2.gz	DWDHNHDCURLZID-RTBURBONSA-N	0	3	344.418	3.245	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)N1CCC(CC#N)CC1)c1ccccc1	ZINC000543776990	459700536	/nfs/dbraw/zinc/70/05/36/459700536.db2.gz	IBAFXUSVVDLZNE-IBGZPJMESA-N	0	3	342.487	3.405	20	30		EGEDHN
CCN(Cc1ccc(C(=O)N2CCC(CC#N)CC2)cc1)C1CC1	ZINC000543835502	459705148	/nfs/dbraw/zinc/70/51/48/459705148.db2.gz	DCTNISHHSBUGSD-UHFFFAOYSA-N	0	3	325.456	3.437	20	30		EGEDHN
CC[C@@H](C)N1CCN([C@H](C#N)c2ccc(Br)cc2)CC1	ZINC000501028747	459707807	/nfs/dbraw/zinc/70/78/07/459707807.db2.gz	JRTGPUCLPQCDFD-CZUORRHYSA-N	0	3	336.277	3.430	20	30		EGEDHN
C#CCCN1CCC(NC(=O)/C=C/c2ccc3ccccc3c2)CC1	ZINC000492599586	459712880	/nfs/dbraw/zinc/71/28/80/459712880.db2.gz	XOANZLFUIJDMBG-PKNBQFBNSA-N	0	3	332.447	3.457	20	30		EGEDHN
C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)N1Cc1cnc2c(C#N)cnn2c1	ZINC000573802474	459737926	/nfs/dbraw/zinc/73/79/26/459737926.db2.gz	JRRPNEAGUUPUAR-CLCXKQKWSA-N	0	3	331.423	3.367	20	30		EGEDHN
C=CCCSCCNC(=O)N1CC[C@H](N(C)Cc2ccccc2)C1	ZINC000596722035	459740529	/nfs/dbraw/zinc/74/05/29/459740529.db2.gz	OIDHNHHUCOWRDZ-SFHVURJKSA-N	0	3	347.528	3.212	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CNC2(C3CCC3)CC2)cc1	ZINC000593085992	459768834	/nfs/dbraw/zinc/76/88/34/459768834.db2.gz	ZVVUDGKECSNXRF-UHFFFAOYSA-N	0	3	341.455	3.254	20	30		EGEDHN
COc1cc(C#N)ccc1NC(=O)C(C[C@H]1CCCO1)C(F)(F)F	ZINC000593129316	459782477	/nfs/dbraw/zinc/78/24/77/459782477.db2.gz	UOFITIAXVAXRAE-NEPJUHHUSA-N	0	3	342.317	3.253	20	30		EGEDHN
C[C@H](C(=O)NC1(C#N)CCC1)N1CCC[C@@H](c2ccc(F)cc2)CC1	ZINC000565456365	459784819	/nfs/dbraw/zinc/78/48/19/459784819.db2.gz	TUDWRFPNRQTEGG-HZPDHXFCSA-N	0	3	343.446	3.346	20	30		EGEDHN
N#Cc1cnn2cc(CN[C@H]3C[C@H](c4cccc(Cl)c4)C3)cnc12	ZINC000584721277	459790085	/nfs/dbraw/zinc/79/00/85/459790085.db2.gz	RLQXQBIVLVQYMX-CZIWCDLHSA-N	0	3	337.814	3.290	20	30		EGEDHN
CCC(C#N)(CC)C(=O)N(C)c1ccc(OCCN2CCCC2)cc1	ZINC000528867766	459815583	/nfs/dbraw/zinc/81/55/83/459815583.db2.gz	RORMOUDZQTZNRV-UHFFFAOYSA-N	0	3	343.471	3.454	20	30		EGEDHN
C[C@@H](NC[C@@H]1CNc2c(C#N)cnn2C1)c1cc2cccc(F)c2o1	ZINC000566243269	459827920	/nfs/dbraw/zinc/82/79/20/459827920.db2.gz	RSEOTPOAEGDHAX-VXGBXAGGSA-N	0	3	339.374	3.033	20	30		EGEDHN
C[C@H](CN1CCC(C)CC1)NC(=O)C[C@H](CC#N)c1ccccc1	ZINC000598261304	459841942	/nfs/dbraw/zinc/84/19/42/459841942.db2.gz	QASOSMWSCGYSSW-MJGOQNOKSA-N	0	3	327.472	3.311	20	30		EGEDHN
CCCN1CC[C@H](NC(=O)c2sc3ccc(C#N)cc3c2C)C1	ZINC000598342718	459871559	/nfs/dbraw/zinc/87/15/59/459871559.db2.gz	PLECOQZGEKXESG-AWEZNQCLSA-N	0	3	327.453	3.296	20	30		EGEDHN
COc1cc(C#N)ccc1NC(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000602309089	459891386	/nfs/dbraw/zinc/89/13/86/459891386.db2.gz	YAKLYQDYXOBEOM-QGZVFWFLSA-N	0	3	335.407	3.027	20	30		EGEDHN
N#Cc1ccc(CNC(=O)CN2CCCC[C@@H]2Cc2ccccc2)cc1	ZINC000608909305	459894146	/nfs/dbraw/zinc/89/41/46/459894146.db2.gz	BNPYHBWXVVMIRF-OAQYLSRUSA-N	0	3	347.462	3.272	20	30		EGEDHN
C[C@H](c1ccccc1)[C@H](O)CNC(=O)C(C#N)CCc1ccccc1	ZINC000598480640	459911422	/nfs/dbraw/zinc/91/14/22/459911422.db2.gz	WKIKKQPJHCSFJO-LSTHTHJFSA-N	0	3	336.435	3.040	20	30		EGEDHN
N#C[C@H]1CC[C@@H](NC[C@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000575053247	459916992	/nfs/dbraw/zinc/91/69/92/459916992.db2.gz	DDZSTVVAKZIIHD-DBVUQKKJSA-N	0	3	336.435	3.375	20	30		EGEDHN
Cc1cnc(CNC2CCN(Cc3cccc(C#N)c3)CC2)s1	ZINC000593691678	459953106	/nfs/dbraw/zinc/95/31/06/459953106.db2.gz	IEPINRYKTJIZBM-UHFFFAOYSA-N	0	3	326.469	3.077	20	30		EGEDHN
CN(Cc1ccccc1OC(F)(F)F)C[C@H](O)CC(C)(C)C#N	ZINC000598587482	459953912	/nfs/dbraw/zinc/95/39/12/459953912.db2.gz	RDGJQFNYRZHSOP-CYBMUJFWSA-N	0	3	330.350	3.318	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN1CC[C@@H](OCCCc2ccccc2)C1	ZINC000598591750	459956093	/nfs/dbraw/zinc/95/60/93/459956093.db2.gz	AZZMMYDQYJKUNN-RBUKOAKNSA-N	0	3	330.472	3.011	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN[C@H](CCO)c1cccc(C(F)(F)F)c1	ZINC000598618836	459965847	/nfs/dbraw/zinc/96/58/47/459965847.db2.gz	RMIQAMMTTBILFT-LSDHHAIUSA-N	0	3	344.377	3.019	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000598621896	459966750	/nfs/dbraw/zinc/96/67/50/459966750.db2.gz	YNAIATXDNAAARJ-WBVHZDCISA-N	0	3	331.416	3.075	20	30		EGEDHN
CCN(CC)c1ccc(CN[C@H](C)CC2(C#N)CCOCC2)cn1	ZINC000602513793	459978816	/nfs/dbraw/zinc/97/88/16/459978816.db2.gz	CZPBQUXCNPOMGI-MRXNPFEDSA-N	0	3	330.476	3.116	20	30		EGEDHN
N#Cc1cccc(CNC(=O)CN2CCCC3(CCCCC3)C2)c1	ZINC000609541422	459979901	/nfs/dbraw/zinc/97/99/01/459979901.db2.gz	QEUPNSGUQXBVRQ-UHFFFAOYSA-N	0	3	325.456	3.221	20	30		EGEDHN
C[C@H](CCC#N)CN[C@H](c1ccc(Cl)cc1)[C@@H]1CN(C)CCO1	ZINC000602579271	460005582	/nfs/dbraw/zinc/00/55/82/460005582.db2.gz	ISRPLZIFESTRGW-FHLIZLRMSA-N	0	3	335.879	3.241	20	30		EGEDHN
C[C@H](CC1(C#N)CCOCC1)NCc1ccc(OC(C)(C)C)nc1	ZINC000602586990	460012197	/nfs/dbraw/zinc/01/21/97/460012197.db2.gz	CLEHEQVPUZOHQI-OAHLLOKOSA-N	0	3	331.460	3.447	20	30		EGEDHN
CSc1ccc([C@@H](CNCc2cccc(C#N)n2)N(C)C)cc1	ZINC000602673422	460058101	/nfs/dbraw/zinc/05/81/01/460058101.db2.gz	URLBONJRTJMBGT-GOSISDBHSA-N	0	3	326.469	3.068	20	30		EGEDHN
N#Cc1cncc(N2CCN(Cc3ccccc3)C3(CCCCC3)C2)n1	ZINC000576098059	460069474	/nfs/dbraw/zinc/06/94/74/460069474.db2.gz	PTPGPLXVXXVKJG-UHFFFAOYSA-N	0	3	347.466	3.373	20	30		EGEDHN
N#C[C@H]1CC[C@@H](NCc2ccc(I)s2)C1	ZINC000602694889	460070670	/nfs/dbraw/zinc/07/06/70/460070670.db2.gz	OLZAPYYYYUXGAV-DTWKUNHWSA-N	0	3	332.210	3.135	20	30		EGEDHN
CN(C)c1cc(Cl)cc(Cl)c1CNC1CCN(CC#N)CC1	ZINC000589311560	460071236	/nfs/dbraw/zinc/07/12/36/460071236.db2.gz	RMNYCTHSVDOULV-UHFFFAOYSA-N	0	3	341.286	3.137	20	30		EGEDHN
COC(=O)CC[C@H](CC1CCCCC1)NCc1cccc(C#N)n1	ZINC000602702047	460074748	/nfs/dbraw/zinc/07/47/48/460074748.db2.gz	NANFEVSFQIVEGT-MRXNPFEDSA-N	0	3	329.444	3.335	20	30		EGEDHN
COc1cccc2c1OCC[C@@H]2N[C@H](C)CC1(C#N)CCOCC1	ZINC000602712973	460079919	/nfs/dbraw/zinc/07/99/19/460079919.db2.gz	XBHIMFGQNGWXAW-ZBFHGGJFSA-N	0	3	330.428	3.207	20	30		EGEDHN
N#CCN1CCC(NCc2cc(Cl)ccc2Br)CC1	ZINC000610294825	460111099	/nfs/dbraw/zinc/11/10/99/460111099.db2.gz	KRDBUQYPBGOTER-UHFFFAOYSA-N	0	3	342.668	3.180	20	30		EGEDHN
Cc1ccc(CNC(=O)C2CCN(CC3(CC#N)CC3)CC2)cc1F	ZINC000602763054	460112881	/nfs/dbraw/zinc/11/28/81/460112881.db2.gz	LZVRITTZESZMIS-UHFFFAOYSA-N	0	3	343.446	3.156	20	30		EGEDHN
CCO[C@@H]1C[C@@H](N[C@@H](C)C(=O)Nc2ccccc2C#N)C12CCCC2	ZINC000610345464	460127607	/nfs/dbraw/zinc/12/76/07/460127607.db2.gz	ZCLPJORTHOILLV-BMGDILEWSA-N	0	3	341.455	3.213	20	30		EGEDHN
COc1cc(N[C@@H]2CCCN(CC3(CC#N)CC3)C2)cc(OC)c1	ZINC000602796513	460130752	/nfs/dbraw/zinc/13/07/52/460130752.db2.gz	QALPWCYYJYFINO-OAHLLOKOSA-N	0	3	329.444	3.274	20	30		EGEDHN
COc1cccc(OC)c1CNC(=O)C(C#N)CCc1ccccc1	ZINC000597975311	460131895	/nfs/dbraw/zinc/13/18/95/460131895.db2.gz	IQRAKOVJJDKIBZ-MRXNPFEDSA-N	0	3	338.407	3.093	20	30		EGEDHN
CC[C@H](C)[C@H]1CN(CC2(CC#N)CC2)CCN1CC1(CC#N)CC1	ZINC000602802486	460135295	/nfs/dbraw/zinc/13/52/95/460135295.db2.gz	USKUOAUCGROPSE-ZWKOTPCHSA-N	0	3	328.504	3.406	20	30		EGEDHN
Cc1ccc([C@@H](CNC(=O)[C@H](C)Cc2ccc(C#N)cc2)N(C)C)cc1	ZINC000594254556	460174528	/nfs/dbraw/zinc/17/45/28/460174528.db2.gz	ISQUWNMJAYVNIZ-DYESRHJHSA-N	0	3	349.478	3.464	20	30		EGEDHN
Cc1csc(NC(=O)NCCN(C)Cc2ccccc2)c1C#N	ZINC000576594740	460175915	/nfs/dbraw/zinc/17/59/15/460175915.db2.gz	AWKHFCPTTBXGFY-UHFFFAOYSA-N	0	3	328.441	3.182	20	30		EGEDHN
CC[C@H]1CCCCN1CCNC(=O)[C@@H](C)Cc1ccc(C#N)cc1	ZINC000594297370	460184524	/nfs/dbraw/zinc/18/45/24/460184524.db2.gz	WSIXLYFBKUMQNW-LPHOPBHVSA-N	0	3	327.472	3.118	20	30		EGEDHN
CC(C)OC(=O)C[C@H](NC(=O)C(C#N)CCc1ccccc1)C(C)C	ZINC000594407501	460207983	/nfs/dbraw/zinc/20/79/83/460207983.db2.gz	KJALXDNUNSQSOW-ROUUACIJSA-N	0	3	344.455	3.241	20	30		EGEDHN
N#CCCCC[C@@H](N)C(=O)N[C@@H]1CCSc2ccc(Cl)cc21	ZINC000594430101	460217124	/nfs/dbraw/zinc/21/71/24/460217124.db2.gz	VRBHOIYKOFTIHD-ZIAGYGMSSA-N	0	3	337.876	3.404	20	30		EGEDHN
Cc1cccc([C@H](NC(=O)[C@H](N)CCCCC#N)C(F)(F)F)c1	ZINC000594435803	460220037	/nfs/dbraw/zinc/22/00/37/460220037.db2.gz	DYBZWZCTCKZFGV-KGLIPLIRSA-N	0	3	327.350	3.126	20	30		EGEDHN
N#CCCCC[C@H](N)C(=O)N[C@H]1CCCC[C@H]1Cc1ccccc1	ZINC000594436419	460220181	/nfs/dbraw/zinc/22/01/81/460220181.db2.gz	IZMXBWFBMXGWIX-FHWLQOOXSA-N	0	3	327.472	3.315	20	30		EGEDHN
CCN(C[C@@H](O)COc1ccccc1C#N)[C@@H](C)c1cccc(O)c1	ZINC000599308092	460223098	/nfs/dbraw/zinc/22/30/98/460223098.db2.gz	RGSFFZVSTGSQQT-HNAYVOBHSA-N	0	3	340.423	3.087	20	30		EGEDHN
CC(C)(C#N)c1ccc(C(=O)N2CCCN(c3ccncc3)CC2)cc1	ZINC000603082567	460239188	/nfs/dbraw/zinc/23/91/88/460239188.db2.gz	GFFOISJTVLPCSG-UHFFFAOYSA-N	0	3	348.450	3.235	20	30		EGEDHN
CN(C(=O)Nc1ccnc(C#N)c1)C1CCN(Cc2ccccc2)CC1	ZINC000603126695	460247737	/nfs/dbraw/zinc/24/77/37/460247737.db2.gz	ADRLCWUXOMHMSO-UHFFFAOYSA-N	0	3	349.438	3.082	20	30		EGEDHN
N#CCc1ccc(CN[C@H](Cc2ccccc2)[C@@H](O)C(F)(F)F)cc1	ZINC000603146467	460253837	/nfs/dbraw/zinc/25/38/37/460253837.db2.gz	SGJDDOFSRMZWFJ-QZTJIDSGSA-N	0	3	348.368	3.377	20	30		EGEDHN
N#Cc1ccc(CCN[C@@H](Cc2ccccc2)[C@@H](O)C(F)(F)F)cc1	ZINC000603146904	460254185	/nfs/dbraw/zinc/25/41/85/460254185.db2.gz	VQDBCNQIIFSIAN-ZWKOTPCHSA-N	0	3	348.368	3.225	20	30		EGEDHN
C[C@H](NC(=O)NC[C@@H]1N(C)CCCC1(C)C)c1cccc(C#N)c1	ZINC000619204619	460300879	/nfs/dbraw/zinc/30/08/79/460300879.db2.gz	AIDOBCFALXHGQL-YOEHRIQHSA-N	0	3	328.460	3.039	20	30		EGEDHN
CN(C(=O)CN[C@H]1CCCc2cc(C#N)ccc21)C1CCCCC1	ZINC000611393741	460353551	/nfs/dbraw/zinc/35/35/51/460353551.db2.gz	LLZPTDIMZVJWAG-IBGZPJMESA-N	0	3	325.456	3.316	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2N[C@H]1CCN(c2ccccc2F)C1=O	ZINC000611394136	460354133	/nfs/dbraw/zinc/35/41/33/460354133.db2.gz	LKYBNLPULNIGFC-MOPGFXCFSA-N	0	3	349.409	3.470	20	30		EGEDHN
CC(C)[C@H](N[C@@H]1CCCc2cc(C#N)ccc21)C(=O)N1CCCC1	ZINC000611394956	460355234	/nfs/dbraw/zinc/35/52/34/460355234.db2.gz	XSOGAKRVNKFWHM-MOPGFXCFSA-N	0	3	325.456	3.172	20	30		EGEDHN
Cc1cc(NCCc2cccc(C#N)c2)c2cc([N+](=O)[O-])ccc2n1	ZINC000619589684	460391887	/nfs/dbraw/zinc/39/18/87/460391887.db2.gz	JQXFDPNJXBHAJF-UHFFFAOYSA-N	0	3	332.363	3.400	20	30		EGEDHN
CC(C)(C#N)CNC(=O)N[C@@H](CN1CCCCC1)c1ccccc1	ZINC000611623894	460417885	/nfs/dbraw/zinc/41/78/85/460417885.db2.gz	FKHDOTFJOOWXDC-KRWDZBQOSA-N	0	3	328.460	3.063	20	30		EGEDHN
C=CCOc1c(Cl)cc(CNC[C@@H](O)[C@H](C)CC)cc1OC	ZINC000623417223	460538032	/nfs/dbraw/zinc/53/80/32/460538032.db2.gz	XHWBVLBTIREQIU-IUODEOHRSA-N	0	3	327.852	3.410	20	30		EGEDHN
Cc1ccccc1[C@H]([C@H](C)NC(=O)c1ccccc1CC#N)N(C)C	ZINC000601521799	460824842	/nfs/dbraw/zinc/82/48/42/460824842.db2.gz	XYYRUNUYDRYCPK-JXFKEZNVSA-N	0	3	335.451	3.482	20	30		EGEDHN
CN(C(=O)c1ccc(C#Cc2ccccc2)cc1)[C@H]1CCCN(C)C1	ZINC000607578597	460864793	/nfs/dbraw/zinc/86/47/93/460864793.db2.gz	YUQVFTRLUDXHJQ-NRFANRHFSA-N	0	3	332.447	3.253	20	30		EGEDHN
C[C@@H](c1ccccc1)[C@H](CO)NCc1ccc(C#N)cc1OC(F)F	ZINC000613389299	460931902	/nfs/dbraw/zinc/93/19/02/460931902.db2.gz	HWBJRYHNKYNSEE-GUYCJALGSA-N	0	3	346.377	3.414	20	30		EGEDHN
C=CCN1CCC(NC(=O)CCOc2ccc(Cl)c(F)c2)CC1	ZINC000668369441	461259707	/nfs/dbraw/zinc/25/97/07/461259707.db2.gz	XVKJAAZSLITCKI-UHFFFAOYSA-N	0	3	340.826	3.015	20	30		EGEDHN
CC#CC[C@@H](CO)NCc1ccc(OCc2ccccc2)c(OC)c1	ZINC000641768668	461361362	/nfs/dbraw/zinc/36/13/62/461361362.db2.gz	FTEWWIUZKFCOEX-IBGZPJMESA-N	0	3	339.435	3.138	20	30		EGEDHN
C=CC[C@H]1CCCN(C(=O)NCc2ccc(OCCN(C)C)cc2)C1	ZINC000660385909	461745679	/nfs/dbraw/zinc/74/56/79/461745679.db2.gz	BSCHSJVDDHSLJG-SFHVURJKSA-N	0	3	345.487	3.125	20	30		EGEDHN
CC[C@@H](C)N(CC)CC(=O)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000661108333	462105813	/nfs/dbraw/zinc/10/58/13/462105813.db2.gz	RWJRIYIZZPDUAK-CQSZACIVSA-N	0	3	340.389	3.294	20	30		EGEDHN
C=CCC1(NCc2cc(O)ccc2Br)CCOCC1	ZINC000657633767	462211939	/nfs/dbraw/zinc/21/19/39/462211939.db2.gz	WIIHRJJIIVMLTI-UHFFFAOYSA-N	0	3	326.234	3.370	20	30		EGEDHN
C=CCN(CC(=O)N(Cc1ccc(OC)cc1)C1CC1)C(C)(C)C	ZINC000661755881	462399184	/nfs/dbraw/zinc/39/91/84/462399184.db2.gz	SYNBSQRCYOWLKW-UHFFFAOYSA-N	0	3	330.472	3.473	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cc(OCC)ccc2OCC)CC1	ZINC000171736845	526440914	/nfs/dbraw/zinc/44/09/14/526440914.db2.gz	PBRUQCSQVXWQDB-UHFFFAOYSA-N	0	3	347.459	3.256	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(-c3ccc(Cl)cc3)on2)CC1	ZINC000171726337	526446199	/nfs/dbraw/zinc/44/61/99/526446199.db2.gz	HNORTOAATGEGMU-UHFFFAOYSA-N	0	3	345.830	3.375	20	30		EGEDHN
CN(C)CCOC1CCN(c2ccc(C#N)c(C(F)(F)F)c2)CC1	ZINC000356227130	535893066	/nfs/dbraw/zinc/89/30/66/535893066.db2.gz	UWZQJDIXTZIOMZ-UHFFFAOYSA-N	0	3	341.377	3.124	20	30		EGEDHN
Cc1noc(C(C)C)c1C(=O)NCC1(N2CCCC2)CCOCC1	ZINC000329099749	547490889	/nfs/dbraw/zinc/49/08/89/547490889.db2.gz	MJTLXGGTISEZAA-UHFFFAOYSA-N	0	3	335.448	3.056	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2C[C@H](C(F)(F)F)CC[C@@H]2C)CC1	ZINC000679490747	549719841	/nfs/dbraw/zinc/71/98/41/549719841.db2.gz	UZYTWMFNLCRDOZ-QWHCGFSZSA-N	0	3	333.398	3.009	20	30		EGEDHN
C[C@H]1CCCN(CCNC(=S)Nc2ccc(C#N)c(Cl)c2)C1	ZINC000726463666	574557351	/nfs/dbraw/zinc/55/73/51/574557351.db2.gz	WUUFKFBEVZWFOM-LBPRGKRZSA-N	0	3	336.892	3.230	20	30		EGEDHN
C#Cc1cccc(N(C(=S)NC[C@H]2CCCN2CC)C(C)C)c1	ZINC000728226305	574731035	/nfs/dbraw/zinc/73/10/35/574731035.db2.gz	AANMYNORIVVEEG-GOSISDBHSA-N	0	3	329.513	3.242	20	30		EGEDHN
C#Cc1ccc(C(=O)N(CC)[C@H]2CCN([C@H](C)c3ccccc3)C2)nc1	ZINC000728861815	574779857	/nfs/dbraw/zinc/77/98/57/574779857.db2.gz	PSYHQWSGGGVCNE-XLIONFOSSA-N	0	3	347.462	3.361	20	30		EGEDHN
CCCCCCC[C@H](C)CNC(=O)NC[C@@H]1CN2CCC[C@@H]2CO1	ZINC000729496532	574865987	/nfs/dbraw/zinc/86/59/87/574865987.db2.gz	BUIIVQJKIODGKG-RCCFBDPRSA-N	0	3	339.524	3.145	20	30		EGEDHN
C=CCN1CCC(NC(=S)Nc2ccc(C#N)c(Cl)c2)CC1	ZINC000729943020	574897956	/nfs/dbraw/zinc/89/79/56/574897956.db2.gz	XMKDWHHOTFAVCP-UHFFFAOYSA-N	0	3	334.876	3.148	20	30		EGEDHN
COc1ccc(C(C)N=Nc2ccc(C)nn2)cc1CN1CCCC1	ZINC000729935488	574897322	/nfs/dbraw/zinc/89/73/22/574897322.db2.gz	AVKHOJSGGPESKR-UHFFFAOYSA-N	0	3	339.443	3.226	20	30		EGEDHN
C#CCOc1ccccc1CNC[C@H](O)c1c(F)cccc1Cl	ZINC000741254713	575010139	/nfs/dbraw/zinc/01/01/39/575010139.db2.gz	CYOQHQWCYHQVBA-INIZCTEOSA-N	0	3	333.790	3.314	20	30		EGEDHN
COc1ccc(CN(C)Cc2ccc(OCC#N)cc2)cc1OC	ZINC000731210177	575060311	/nfs/dbraw/zinc/06/03/11/575060311.db2.gz	BEZGTAPYAKOPHW-UHFFFAOYSA-N	0	3	326.396	3.238	20	30		EGEDHN
C#CCOc1ccc(CNCc2ccccc2Cn2ccnc2)cc1	ZINC000733323983	575327481	/nfs/dbraw/zinc/32/74/81/575327481.db2.gz	CAPILAOBILZKIZ-UHFFFAOYSA-N	0	3	331.419	3.233	20	30		EGEDHN
C#CCOc1ccc(CNC[C@@H]2CCCN2C(=O)OC(C)(C)C)cc1	ZINC000733328362	575328215	/nfs/dbraw/zinc/32/82/15/575328215.db2.gz	SBKICGUGSGYGCX-KRWDZBQOSA-N	0	3	344.455	3.188	20	30		EGEDHN
C#Cc1cccc(NC(=O)N2CCN(C3CCC(C)CC3)CC2)c1	ZINC000734641078	575535756	/nfs/dbraw/zinc/53/57/56/575535756.db2.gz	BYEUHZLKGPTDOT-UHFFFAOYSA-N	0	3	325.456	3.396	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/Cc2cccc(-n3cncn3)c2)c([O-])c1	ZINC000735414354	575657459	/nfs/dbraw/zinc/65/74/59/575657459.db2.gz	FNMMEBPHICPBMJ-FYJGNVAPSA-N	0	3	349.438	3.438	20	30		EGEDHN
C=C(Cl)CNC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1	ZINC000736240339	575920960	/nfs/dbraw/zinc/92/09/60/575920960.db2.gz	MFBAJKZEOOFISA-HNNXBMFYSA-N	0	3	346.780	3.310	20	30		EGEDHN
CCc1cc(CNCc2cn(CCC#N)nc2-c2ccccc2)n[nH]1	ZINC000738431758	576325200	/nfs/dbraw/zinc/32/52/00/576325200.db2.gz	WWAOMBSKIVSJBA-UHFFFAOYSA-N	0	3	334.427	3.039	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@@H](C)Cc1ccccc1F	ZINC000739143378	576379638	/nfs/dbraw/zinc/37/96/38/576379638.db2.gz	KDWCBDXFPKOUIP-HOCLYGCPSA-N	0	3	332.419	3.410	20	30		EGEDHN
C#CCCN1CCC(NC(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2)CC1	ZINC000740736029	576621356	/nfs/dbraw/zinc/62/13/56/576621356.db2.gz	ASRNKIOIYBWFAA-ZWKOTPCHSA-N	0	3	330.859	3.047	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2cc(SC)ccc2Cl)CC1	ZINC000740736453	576621794	/nfs/dbraw/zinc/62/17/94/576621794.db2.gz	UVBRWXVTEUXRNL-UHFFFAOYSA-N	0	3	336.888	3.279	20	30		EGEDHN
C#CCCN1CCC(NC(=O)[C@@H](C)Oc2cccc(C(C)C)c2)CC1	ZINC000740738336	576622032	/nfs/dbraw/zinc/62/20/32/576622032.db2.gz	ADCOIVCHYVZXFN-QGZVFWFLSA-N	0	3	342.483	3.181	20	30		EGEDHN
C#Cc1cccc(NC(=O)CCN2CCN(c3cccc(C)c3)CC2)c1	ZINC000742243452	576762157	/nfs/dbraw/zinc/76/21/57/576762157.db2.gz	DGFSFYONDIMNJC-UHFFFAOYSA-N	0	3	347.462	3.127	20	30		EGEDHN
Cc1ccc([C@H](C)C(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)o1	ZINC000742550467	576789457	/nfs/dbraw/zinc/78/94/57/576789457.db2.gz	SSYFSNDGJBBGIP-INIZCTEOSA-N	0	3	339.439	3.154	20	30		EGEDHN
C#CCCN1CCC(NC(=O)[C@@H](CC)Sc2ccccc2)CC1	ZINC000743492272	576810293	/nfs/dbraw/zinc/81/02/93/576810293.db2.gz	RSLONLUZISSWHJ-GOSISDBHSA-N	0	3	330.497	3.161	20	30		EGEDHN
C[C@H](C(=O)C(C#N)C(=O)N1CCCC1)c1ccccc1C(F)(F)F	ZINC000744023434	576819041	/nfs/dbraw/zinc/81/90/41/576819041.db2.gz	JDYBQRJTTXIROA-WCQYABFASA-N	0	3	338.329	3.140	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)[C@@H](C)c1ccco1	ZINC000744031443	576819273	/nfs/dbraw/zinc/81/92/73/576819273.db2.gz	XIHWAECJOIZJBW-QWHCGFSZSA-N	0	3	326.352	3.129	20	30		EGEDHN
N#CC(C(=O)C[C@@H](Cc1ccccc1)c1ccccc1)C(=O)NC1CC1	ZINC000744031474	576819304	/nfs/dbraw/zinc/81/93/04/576819304.db2.gz	XXNFJVGWEVOOTC-UYAOXDASSA-N	0	3	346.430	3.390	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)CCCOc3cccnc3)nc21	ZINC000744162312	576821951	/nfs/dbraw/zinc/82/19/51/576821951.db2.gz	YTHHVBXKXCOXIM-HNNXBMFYSA-N	0	3	334.379	3.302	20	30		EGEDHN
Cc1cccc2nc(C(C#N)C(=O)CCCOc3cccnc3)[nH]c21	ZINC000744162312	576821952	/nfs/dbraw/zinc/82/19/52/576821952.db2.gz	YTHHVBXKXCOXIM-HNNXBMFYSA-N	0	3	334.379	3.302	20	30		EGEDHN
C#CCN(C(=O)N[C@H]1CCN(Cc2ccccc2)C1)C1CCCCC1	ZINC000744817245	576835085	/nfs/dbraw/zinc/83/50/85/576835085.db2.gz	HJBJTIJAQNAWPP-IBGZPJMESA-N	0	3	339.483	3.238	20	30		EGEDHN
C=CC[C@H](C)[C@H](C)[NH2+]CCSCc1ccccc1-c1nnn[n-]1	ZINC000819729787	607017399	/nfs/dbraw/zinc/01/73/99/607017399.db2.gz	MTIJERIPVKHGIN-KBPBESRZSA-N	0	3	331.489	3.290	20	30		EGEDHN
C=CC[C@H](C)[C@H](C)[NH2+]CCSCc1ccccc1-c1nn[n-]n1	ZINC000819729787	607017401	/nfs/dbraw/zinc/01/74/01/607017401.db2.gz	MTIJERIPVKHGIN-KBPBESRZSA-N	0	3	331.489	3.290	20	30		EGEDHN
C[C@H](NC[C@H]1CN(C2CCCCC2)C(=O)O1)c1ccc(C#N)cc1	ZINC000828148542	1292436865	/nfs/dbraw/zinc/43/68/65/1292436865.db2.gz	ZCLWNIPNJTUOMG-KSSFIOAISA-N	0	3	327.428	3.362	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@@H](C)CCc1ccccc1F	ZINC000076819039	1292444315	/nfs/dbraw/zinc/44/43/15/1292444315.db2.gz	SZPMWPZZURGMNS-GOEBONIOSA-N	0	3	332.419	3.410	20	30		EGEDHN
CC(=O)N[C@H](C(=O)C(C#N)c1nc(C(C)C)cs1)C1CCCC1	ZINC000080456648	1292604133	/nfs/dbraw/zinc/60/41/33/1292604133.db2.gz	AZCYDKUIGXNQPD-ZFWWWQNUSA-N	0	3	333.457	3.138	20	30		EGEDHN
CCN(CCSC)CC(=O)C(C#N)c1nc2ccccc2s1	ZINC000830999419	1292798780	/nfs/dbraw/zinc/79/87/80/1292798780.db2.gz	KEHYWYQVEDKDKM-GFCCVEGCSA-N	0	3	333.482	3.157	20	30		EGEDHN
CCOC(=O)[C@@H]1CCC[C@@H]1NCc1cc(Cl)ccc1OCC#N	ZINC000832071490	1292952696	/nfs/dbraw/zinc/95/26/96/1292952696.db2.gz	ITQWOVOWYGZMME-CABCVRRESA-N	0	3	336.819	3.064	20	30		EGEDHN
COc1ccccc1[C@H](C)CC(=O)C(C#N)C(=O)NC1CCCCC1	ZINC000103329978	1293001916	/nfs/dbraw/zinc/00/19/16/1293001916.db2.gz	WXUXGZVCQMNYQP-RHSMWYFYSA-N	0	3	342.439	3.347	20	30		EGEDHN
CC[C@@H](C#N)Oc1cccc(CNCc2cnc3c(c2)c(C)nn3C)c1	ZINC000113960863	1293160154	/nfs/dbraw/zinc/16/01/54/1293160154.db2.gz	MYPZYIHODOYBEJ-KRWDZBQOSA-N	0	3	349.438	3.248	20	30		EGEDHN
CC[C@@H](NC(=O)C(C#N)C(=O)COCC1CCCC1)c1ccccc1	ZINC000835340985	1293268769	/nfs/dbraw/zinc/26/87/69/1293268769.db2.gz	QUZPYNFYYVHQIJ-ZWKOTPCHSA-N	0	3	342.439	3.170	20	30		EGEDHN
N#CC(C(=O)CCSc1ccc2c(c1)OCCO2)c1ccccn1	ZINC000121644726	1293382546	/nfs/dbraw/zinc/38/25/46/1293382546.db2.gz	VGNDREWYGFPPAM-CQSZACIVSA-N	0	3	340.404	3.211	20	30		EGEDHN
N#CC(C(=O)Cc1ccoc1)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000123658357	1293450517	/nfs/dbraw/zinc/45/05/17/1293450517.db2.gz	QFYXFRBGMUDMBB-ZDUSSCGKSA-N	0	3	337.162	3.476	20	30		EGEDHN
C=C(Br)CNC1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000125163672	1293497327	/nfs/dbraw/zinc/49/73/27/1293497327.db2.gz	OGJOVECEKDRHJL-UHFFFAOYSA-N	0	3	340.221	3.062	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H](O)c1cccc(Br)c1	ZINC000125249776	1293500959	/nfs/dbraw/zinc/50/09/59/1293500959.db2.gz	QBHWBHAXAZUIHJ-QGZVFWFLSA-N	0	3	345.240	3.486	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)[C@@H](C)Oc2cccc(C)c2)c1	ZINC000127518926	1293566442	/nfs/dbraw/zinc/56/64/42/1293566442.db2.gz	FBBQIDIXVKLGEO-CRAIPNDOSA-N	0	3	336.391	3.418	20	30		EGEDHN
CCc1nccn1CC(=O)C(C#N)c1nc(-c2ccccc2)cs1	ZINC000158386226	1294203999	/nfs/dbraw/zinc/20/39/99/1294203999.db2.gz	FHNISQALWXIQHH-CQSZACIVSA-N	0	3	336.420	3.445	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)C[C@H](C)c1ccccc1OC	ZINC000171401919	1294405748	/nfs/dbraw/zinc/40/57/48/1294405748.db2.gz	FGZYERNZARYHIB-GOEBONIOSA-N	0	3	330.428	3.204	20	30		EGEDHN
C[C@@H]1CC[C@@H](CCC(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)O1	ZINC000173952306	1294474802	/nfs/dbraw/zinc/47/48/02/1294474802.db2.gz	JMMUOGWXPCQNQN-BYCMXARLSA-N	0	3	334.803	3.335	20	30		EGEDHN
CC[C@@H](NC(C)=O)C(=O)C(C#N)c1nc(-c2ccc(C)cc2)cs1	ZINC000870150025	1295704313	/nfs/dbraw/zinc/70/43/13/1295704313.db2.gz	POUMCPNDFOWWBP-HUUCEWRRSA-N	0	3	341.436	3.210	20	30		EGEDHN
CCc1ccc(C(=O)C(C#N)C(=O)Nc2ccccc2OC)s1	ZINC000193470543	1295872284	/nfs/dbraw/zinc/87/22/84/1295872284.db2.gz	YNPRMMCAFOKKAS-LBPRGKRZSA-N	0	3	328.393	3.280	20	30		EGEDHN
C#CCOc1ccccc1CN1CCC[C@H]1C[C@@H](O)c1ccco1	ZINC000245698573	1296320036	/nfs/dbraw/zinc/32/00/36/1296320036.db2.gz	BIKMKHVGQRIVCI-ZWKOTPCHSA-N	0	3	325.408	3.380	20	30		EGEDHN
COc1ccc([C@H](C/N=C\c2ccccc2O)N(C)C)cc1OC	ZINC000255416217	1296530248	/nfs/dbraw/zinc/53/02/48/1296530248.db2.gz	PDJQBQWEYKRTNA-DEFALTHMSA-N	0	3	328.412	3.131	20	30		EGEDHN
C#CCOc1ccccc1CN[C@@H]1CCC[C@@H]1NC(=O)OC(C)(C)C	ZINC000301726747	1296793536	/nfs/dbraw/zinc/79/35/36/1296793536.db2.gz	AJFMLKCAONKTMZ-SJORKVTESA-N	0	3	344.455	3.234	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)OC(C)(C)C)C1(C)C	ZINC000404746202	1297758926	/nfs/dbraw/zinc/75/89/26/1297758926.db2.gz	SQBDTCDHXFSBCO-WDEREUQCSA-N	0	3	333.270	3.176	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)Nc1cccc2c1CCN(CC(C)(C)O)C2	ZINC000443129644	1297856450	/nfs/dbraw/zinc/85/64/50/1297856450.db2.gz	NWFIKDLKNUFCEK-FQEVSTJZSA-N	0	3	330.472	3.356	20	30		EGEDHN
CN(C(=O)C#Cc1ccccc1)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000747422018	1298779542	/nfs/dbraw/zinc/77/95/42/1298779542.db2.gz	OVVZFROBKKXTGC-NRFANRHFSA-N	0	3	332.447	3.161	20	30		EGEDHN
N#Cc1cccc(C2(NCc3ccc(N4CCOCC4)cc3)CC2)c1	ZINC000747922609	1298891015	/nfs/dbraw/zinc/89/10/15/1298891015.db2.gz	DEBBJWOZLZDBDO-UHFFFAOYSA-N	0	3	333.435	3.174	20	30		EGEDHN
S=C(NN=C1CCCC[C@H]1N1CCCCC1)Nc1cccnc1	ZINC000748782151	1299078945	/nfs/dbraw/zinc/07/89/45/1299078945.db2.gz	JOJNYHJXIVTNSN-MRXNPFEDSA-N	0	3	331.489	3.153	20	30		EGEDHN
C#Cc1cccc(NC(=O)N(CCc2ccccc2)CCN(C)C)c1	ZINC000752629987	1299770092	/nfs/dbraw/zinc/77/00/92/1299770092.db2.gz	HPYDMNNGUZOVEC-UHFFFAOYSA-N	0	3	335.451	3.306	20	30		EGEDHN
CC(C)CN(Cc1nc2ccccc2c(=O)n1CC#N)CC(C)C	ZINC000753319881	1299916714	/nfs/dbraw/zinc/91/67/14/1299916714.db2.gz	SDSIVMQIBQRXDV-UHFFFAOYSA-N	0	3	326.444	3.034	20	30		EGEDHN
CC(=O)[C@](C#N)(CCN1CCCC[C@@H]1C[C@@H](C)O)c1ccccc1	ZINC000878532612	1300056030	/nfs/dbraw/zinc/05/60/30/1300056030.db2.gz	UQZLTWHFPQHOGH-NSISKUIASA-N	0	3	328.456	3.052	20	30		EGEDHN
Cc1cc(C)c(O)c(CN2CCN(c3ccc(C#N)cc3F)CC2)c1	ZINC000754729974	1300202211	/nfs/dbraw/zinc/20/22/11/1300202211.db2.gz	IXAZMYMSMOLMRP-UHFFFAOYSA-N	0	3	339.414	3.342	20	30		EGEDHN
C[C@H](NCC(=O)N[C@](C)(C#N)C1CC1)c1csc2ccccc21	ZINC000754745875	1300207718	/nfs/dbraw/zinc/20/77/18/1300207718.db2.gz	YDXZTWYSYSPKHK-KPZWWZAWSA-N	0	3	327.453	3.360	20	30		EGEDHN
COc1ccc(N2CCN(CCCC(C)(C)C#N)CC2)c(OC)c1	ZINC000879462428	1300550440	/nfs/dbraw/zinc/55/04/40/1300550440.db2.gz	OJVNGRTZQFEGOH-UHFFFAOYSA-N	0	3	331.460	3.156	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CCN(CCCC2(C#N)CCOCC2)CC1	ZINC000880250798	1301004064	/nfs/dbraw/zinc/00/40/64/1301004064.db2.gz	NGQZSVROYGAEIS-IBGZPJMESA-N	0	3	341.499	3.466	20	30		EGEDHN
COc1ccc(CN(CCO)Cc2ccccc2C(C)(C)C#N)cc1	ZINC000880571585	1301165796	/nfs/dbraw/zinc/16/57/96/1301165796.db2.gz	WYCREVPUFXEVRB-UHFFFAOYSA-N	0	3	338.451	3.491	20	30		EGEDHN
CCC(C)(C)N1CCN(C(=O)Nc2cc(C#N)c(F)cc2F)CC1	ZINC000880710652	1301236137	/nfs/dbraw/zinc/23/61/37/1301236137.db2.gz	SURCDRDCPGKLDD-UHFFFAOYSA-N	0	3	336.386	3.175	20	30		EGEDHN
N#CC(C(=O)c1cc[n+]([O-])cc1)c1nc2cc(Cl)ccc2s1	ZINC000763273962	1301862828	/nfs/dbraw/zinc/86/28/28/1301862828.db2.gz	DYSQJWGCEOECBD-LLVKDONJSA-N	0	3	329.768	3.073	20	30		EGEDHN
COc1cc(CNCc2cccc(C3(C)OCCO3)c2)ccc1C#N	ZINC000883128450	1302263411	/nfs/dbraw/zinc/26/34/11/1302263411.db2.gz	HMSZLJDZNDMVGE-UHFFFAOYSA-N	0	3	338.407	3.076	20	30		EGEDHN
COc1ccc2c(c1)nccc2N1CCN(c2ccccc2C#N)CC1	ZINC000765487540	1302271562	/nfs/dbraw/zinc/27/15/62/1302271562.db2.gz	ASLDZMBOJROCJF-UHFFFAOYSA-N	0	3	344.418	3.442	20	30		EGEDHN
C[C@@H]1CN(C[C@@H](O)c2ccc(C#N)cc2)[C@@H](C)CN1Cc1ccccc1	ZINC000766965045	1302552752	/nfs/dbraw/zinc/55/27/52/1302552752.db2.gz	WQPVAXQPQWBSBM-KGVIQGDOSA-N	0	3	349.478	3.186	20	30		EGEDHN
Cc1oc2ccccc2c1CC(=O)C(C#N)C(=O)NC1CCCCC1	ZINC000767958524	1302792574	/nfs/dbraw/zinc/79/25/74/1302792574.db2.gz	GCQVTTKURVXFNV-KRWDZBQOSA-N	0	3	338.407	3.442	20	30		EGEDHN
CC(C)[N@H+](Cc1ccc(C#N)cc1)Cc1cc2c(cc1[O-])OC[C@H]2O	ZINC000768441574	1302904239	/nfs/dbraw/zinc/90/42/39/1302904239.db2.gz	ZYNHHGOATIKYTB-LJQANCHMSA-N	0	3	338.407	3.100	20	30		EGEDHN
CC(C)[N@@H+](Cc1ccc(C#N)cc1)Cc1cc2c(cc1[O-])OC[C@H]2O	ZINC000768441574	1302904244	/nfs/dbraw/zinc/90/42/44/1302904244.db2.gz	ZYNHHGOATIKYTB-LJQANCHMSA-N	0	3	338.407	3.100	20	30		EGEDHN
C=CCC1(O)CCN(CCCC(=O)Nc2ccccc2C(C)=O)CC1	ZINC000886778723	1303595395	/nfs/dbraw/zinc/59/53/95/1303595395.db2.gz	QNNDKZXDJZBGLQ-UHFFFAOYSA-N	0	3	344.455	3.011	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](O)c2cccc(Br)c2)c(F)c1	ZINC000772929756	1303596586	/nfs/dbraw/zinc/59/65/86/1303596586.db2.gz	VYWNVNNKEGAOLQ-INIZCTEOSA-N	0	3	349.203	3.283	20	30		EGEDHN
CCN1CCCC[C@H]1C(=O)C(C#N)c1nc2cc(F)ccc2s1	ZINC000774072760	1303771839	/nfs/dbraw/zinc/77/18/39/1303771839.db2.gz	OTODIXXGSYKNNC-OCCSQVGLSA-N	0	3	331.416	3.486	20	30		EGEDHN
Cc1cc(CN2CCC[C@H](C(=O)Nc3ccccn3)C2)ccc1C#N	ZINC000774834772	1303865985	/nfs/dbraw/zinc/86/59/85/1303865985.db2.gz	XYZGOWIDKVFSFC-SFHVURJKSA-N	0	3	334.423	3.112	20	30		EGEDHN
N#Cc1ccc(C2CCN(C(=O)[C@@H]3CCN3C3CCCC3)CC2)cc1	ZINC000887699391	1303898936	/nfs/dbraw/zinc/89/89/36/1303898936.db2.gz	YAJMCBZUYPNYIL-FQEVSTJZSA-N	0	3	337.467	3.281	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2NCc1ccc(-n2ccnc2)nc1	ZINC000775365873	1303947217	/nfs/dbraw/zinc/94/72/17/1303947217.db2.gz	ZMKYWZIAUMCTBJ-IBGZPJMESA-N	0	3	329.407	3.306	20	30		EGEDHN
CC(C)(C)OC(=O)CC(C)(C)NC(=O)C(C#N)CCc1ccccc1	ZINC000888152280	1304053564	/nfs/dbraw/zinc/05/35/64/1304053564.db2.gz	NQQZNCRKCIAPCA-INIZCTEOSA-N	0	3	344.455	3.386	20	30		EGEDHN
C=CCN(Cc1cccc(C#N)c1)CC1CN(C(=O)OC(C)(C)C)C1	ZINC000779478904	1304577406	/nfs/dbraw/zinc/57/74/06/1304577406.db2.gz	VSGIPJAGFOUBJJ-UHFFFAOYSA-N	0	3	341.455	3.413	20	30		EGEDHN
N#CCC[C@@H](NC(=O)NC[C@@H]1Cc2ccccc2CN1)c1ccccc1	ZINC000891703677	1305140476	/nfs/dbraw/zinc/14/04/76/1305140476.db2.gz	DLXGCEQYNHYVBF-VQTJNVASSA-N	0	3	348.450	3.045	20	30		EGEDHN
N#CC(C(=O)COC1CCCCC1)C(=O)NCc1cccc(Cl)c1	ZINC000786531775	1305591736	/nfs/dbraw/zinc/59/17/36/1305591736.db2.gz	SUOGRPJRYLSNOX-MRXNPFEDSA-N	0	3	348.830	3.014	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/Cc2cccn(CC)c2=O)c([O-])c1	ZINC000788319748	1305920439	/nfs/dbraw/zinc/92/04/39/1305920439.db2.gz	WYNNIJLLVUEDDP-DEDYPNTBSA-N	0	3	327.428	3.039	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)c1cncc(CC)c1	ZINC000789402167	1306155355	/nfs/dbraw/zinc/15/53/55/1306155355.db2.gz	BUDCSGFTXNJIMU-OAHLLOKOSA-N	0	3	337.379	3.004	20	30		EGEDHN
Cn1ccnc1N=NCc1cccc(OCc2ccccc2C#N)c1	ZINC000790300112	1306292691	/nfs/dbraw/zinc/29/26/91/1306292691.db2.gz	RNYYXALHRWDBQB-UHFFFAOYSA-N	0	3	331.379	3.317	20	30		EGEDHN
CC(C)N1CCC[C@H](NC(=O)C#Cc2ccc(C(F)(F)F)cc2)C1	ZINC000790899006	1308882419	/nfs/dbraw/zinc/88/24/19/1308882419.db2.gz	LMMJWSFAYOTBIJ-INIZCTEOSA-N	0	3	338.373	3.046	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)Cc2cc(F)c(F)cc2F)c1	ZINC000793126588	1309301137	/nfs/dbraw/zinc/30/11/37/1309301137.db2.gz	UGYBACCZQSPNCE-CYBMUJFWSA-N	0	3	346.308	3.302	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN2CCN(C)[C@H](Cc3ccccc3)C2)cc1	ZINC000793621476	1309419452	/nfs/dbraw/zinc/41/94/52/1309419452.db2.gz	WYLTUEKVAOOPQP-WIYYLYMNSA-N	0	3	349.478	3.336	20	30		EGEDHN
C=C(C)C[N@H+](Cc1ccccc1)Cc1cc2c(cc1[O-])OC[C@@H]2O	ZINC000794651230	1309563222	/nfs/dbraw/zinc/56/32/22/1309563222.db2.gz	SWFQRQAZOSPGBZ-IBGZPJMESA-N	0	3	325.408	3.396	20	30		EGEDHN
C=C(C)C[N@@H+](Cc1ccccc1)Cc1cc2c(cc1[O-])OC[C@@H]2O	ZINC000794651230	1309563228	/nfs/dbraw/zinc/56/32/28/1309563228.db2.gz	SWFQRQAZOSPGBZ-IBGZPJMESA-N	0	3	325.408	3.396	20	30		EGEDHN
CC(C)CN(CCC#N)CCCN1CCN(c2ccccc2)CC1	ZINC000795915895	1309860737	/nfs/dbraw/zinc/86/07/37/1309860737.db2.gz	GKCJHTDZJPMIRI-UHFFFAOYSA-N	0	3	328.504	3.070	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@@H]1CCc2cc(C)ccc2O1	ZINC000796634381	1310051754	/nfs/dbraw/zinc/05/17/54/1310051754.db2.gz	YOEDGGIRSGOPAS-AEFFLSMTSA-N	0	3	342.439	3.094	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@@H]1CCc2cc(C)ccc2O1	ZINC000796634390	1310052846	/nfs/dbraw/zinc/05/28/46/1310052846.db2.gz	YOEDGGIRSGOPAS-WMZOPIPTSA-N	0	3	342.439	3.094	20	30		EGEDHN
CC[C@H](C)[C@H](NC(C)=O)C(=O)C(C#N)c1nc2cc(F)ccc2s1	ZINC000796994259	1310121239	/nfs/dbraw/zinc/12/12/39/1310121239.db2.gz	DAMIAGOIQJMSDV-UAKXVISKSA-N	0	3	347.415	3.162	20	30		EGEDHN
C#CCN1CCC[C@@H](CNC(=O)c2c(Cl)cccc2Cl)C1	ZINC001023717188	1319852030	/nfs/dbraw/zinc/85/20/30/1319852030.db2.gz	FQXCRDQTIPRMNI-LBPRGKRZSA-N	0	3	325.239	3.068	20	30		EGEDHN
C#CCOc1ccc(CNCc2cc(OC)c(OC)cc2C)cc1	ZINC000824926458	1320296965	/nfs/dbraw/zinc/29/69/65/1320296965.db2.gz	OFMMBPSTCADHJY-UHFFFAOYSA-N	0	3	325.408	3.314	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)COC(C)(C)CC)c1ccccc1	ZINC000838866456	1320825824	/nfs/dbraw/zinc/82/58/24/1320825824.db2.gz	PIOQJHFRXUVDRZ-HOTGVXAUSA-N	0	3	330.428	3.168	20	30		EGEDHN
CC(C)(CC#N)CNCc1ccc(C(=O)OCc2ccccc2)[nH]1	ZINC000839162927	1320882829	/nfs/dbraw/zinc/88/28/29/1320882829.db2.gz	FCSGDUJQTFIIQW-UHFFFAOYSA-N	0	3	325.412	3.401	20	30		EGEDHN
C#C[C@H](NCCC(=O)Nc1cc(Cl)ccc1Cl)[C@H]1CCCO1	ZINC000839565555	1320938548	/nfs/dbraw/zinc/93/85/48/1320938548.db2.gz	YRHDXVDPMCLCOJ-DZGCQCFKSA-N	0	3	341.238	3.092	20	30		EGEDHN
C[C@H](C#N)OCCN(CCc1ccccn1)Cc1ccc(F)cc1	ZINC000801931676	1316967800	/nfs/dbraw/zinc/96/78/00/1316967800.db2.gz	LSQAHCNERSGENR-MRXNPFEDSA-N	0	3	327.403	3.194	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3cc(F)cc(F)c3)C2)CC1	ZINC001019331375	1317171681	/nfs/dbraw/zinc/17/16/81/1317171681.db2.gz	WJXRRYNLJPBPAG-SFHVURJKSA-N	0	3	334.410	3.402	20	30		EGEDHN
C=Cc1ccc(C(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)cc1	ZINC001019421080	1317230309	/nfs/dbraw/zinc/23/03/09/1317230309.db2.gz	ZZJHTVSCFWIPAP-INIZCTEOSA-N	0	3	337.448	3.267	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)C3(F)CCCCC3)C2)cc1F	ZINC001019605539	1317303066	/nfs/dbraw/zinc/30/30/66/1317303066.db2.gz	GQATUHBRZWCSNB-INIZCTEOSA-N	0	3	347.409	3.060	20	30		EGEDHN
CC(C)C(=O)N1CCC2(CCN(Cc3ccc(C#N)s3)CC2)CC1	ZINC000957502262	1317410302	/nfs/dbraw/zinc/41/03/02/1317410302.db2.gz	YQFHMHIWUTZFBN-UHFFFAOYSA-N	0	3	345.512	3.480	20	30		EGEDHN
C=C[C@@H](C(=O)N1CC[C@H](NCc2cccc(F)c2)C1)c1ccccc1	ZINC001019805155	1317432547	/nfs/dbraw/zinc/43/25/47/1317432547.db2.gz	VCNOIYLOLMTAAQ-VQTJNVASSA-N	0	3	338.426	3.486	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)[C@H]2CCCC3(CC3)C2)C1	ZINC001020150438	1317564330	/nfs/dbraw/zinc/56/43/30/1317564330.db2.gz	UMIOFMUPMSHHTA-IHRRRGAJSA-N	0	3	341.293	3.102	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2snc(Cl)c2Cl)C1	ZINC001020198202	1317590271	/nfs/dbraw/zinc/59/02/71/1317590271.db2.gz	BVFMJRYVJMOSDH-LJGSYFOKSA-N	0	3	340.663	3.053	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc3ccccc3nc2C)C1	ZINC001020208600	1317595269	/nfs/dbraw/zinc/59/52/69/1317595269.db2.gz	IEBPIZRMZVUCJA-SHTZXODSSA-N	0	3	329.831	3.146	20	30		EGEDHN
C#C[C@H](NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)C(C)(C)C	ZINC000807882072	1317598839	/nfs/dbraw/zinc/59/88/39/1317598839.db2.gz	ICEYWTWNDFXDLV-WMZOPIPTSA-N	0	3	330.447	3.202	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2oc3ccc(F)cc3c2C)C1	ZINC001020240929	1317606129	/nfs/dbraw/zinc/60/61/29/1317606129.db2.gz	SHPVULPQAQGVIE-JOCQHMNTSA-N	0	3	336.794	3.483	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)Cc2cccc(C(F)F)c2)C1	ZINC001020387869	1317674300	/nfs/dbraw/zinc/67/43/00/1317674300.db2.gz	FNNBQHCLZWKBDN-HDJSIYSDSA-N	0	3	328.790	3.156	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2sccc2-n2cccc2)C1	ZINC001020450459	1317703906	/nfs/dbraw/zinc/70/39/06/1317703906.db2.gz	XNUJQXFKFMWTRY-JOCQHMNTSA-N	0	3	335.860	3.142	20	30		EGEDHN
C[C@@H]1CCCC[C@@H]1C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001020526163	1317746252	/nfs/dbraw/zinc/74/62/52/1317746252.db2.gz	SNSQTFSMLQKESA-PILAGYSTSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=Cc1ccc(C(=O)N[C@H]2C[C@H](NCC(=C)Br)C2)cc1	ZINC001020621004	1317806324	/nfs/dbraw/zinc/80/63/24/1317806324.db2.gz	CZILWHSZQXCUPT-SHTZXODSSA-N	0	3	335.245	3.089	20	30		EGEDHN
COc1ccc(/C=C2\C(=O)c3ncnn3C2C)cc1OCC(C)C	ZINC000905081280	1317921683	/nfs/dbraw/zinc/92/16/83/1317921683.db2.gz	QQVUXGQDWFMJRK-OBTCNRAFSA-N	0	3	327.384	3.162	20	30		EGEDHN
COc1ccc(/C=C2\C(=O)c3ncnn3C2C)cc1OCC(C)C	ZINC000905081273	1317922038	/nfs/dbraw/zinc/92/20/38/1317922038.db2.gz	QQVUXGQDWFMJRK-AISSWFOISA-N	0	3	327.384	3.162	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC001021014421	1318045597	/nfs/dbraw/zinc/04/55/97/1318045597.db2.gz	YNGWTKGXGUACDD-JOCQHMNTSA-N	0	3	349.228	3.192	20	30		EGEDHN
N#Cc1sccc1C(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000906703035	1318138842	/nfs/dbraw/zinc/13/88/42/1318138842.db2.gz	IPBIUYABXWWCBS-HNNXBMFYSA-N	0	3	325.437	3.014	20	30		EGEDHN
Cc1coc(C(=O)NC2C[C@H]3CC[C@@H](C2)N3Cc2cccc(C#N)c2)c1	ZINC001021355016	1318205880	/nfs/dbraw/zinc/20/58/80/1318205880.db2.gz	CVSNIQGFECNUMK-YQQQUEKLSA-N	0	3	349.434	3.385	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)c2ccco2)cc1F	ZINC000959843997	1318221336	/nfs/dbraw/zinc/22/13/36/1318221336.db2.gz	GXOYYFADTOLIDA-INIZCTEOSA-N	0	3	341.386	3.075	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1cccc(C#N)c1	ZINC001021387602	1318227086	/nfs/dbraw/zinc/22/70/86/1318227086.db2.gz	NJMVGPCJRNKHJL-DZJYIKFMSA-N	0	3	337.467	3.216	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCCC[C@H]2CNCc2cncc(C)c2)cc1	ZINC000960078974	1318342265	/nfs/dbraw/zinc/34/22/65/1318342265.db2.gz	FIXBQZKMRKEZTI-NRFANRHFSA-N	0	3	347.462	3.156	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)[C@H]2C[C@H]3C[C@H]3C2)s1	ZINC000960100872	1318356412	/nfs/dbraw/zinc/35/64/12/1318356412.db2.gz	JDPQYPNTCPMYRG-JJXSEGSLSA-N	0	3	343.496	3.137	20	30		EGEDHN
C=CCCC(=O)[C@@H]1CCCN1C(=O)c1ccc(CN2CCCC2)cc1	ZINC000908642544	1318378174	/nfs/dbraw/zinc/37/81/74/1318378174.db2.gz	AAYGKQDYVKIOQE-IBGZPJMESA-N	0	3	340.467	3.422	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@@H](CCCN3C(=O)/C=C/C3CC3)C2)cc1	ZINC001021550567	1318390918	/nfs/dbraw/zinc/39/09/18/1318390918.db2.gz	IMHLAPLSDIFZKD-XNZYIBKVSA-N	0	3	349.478	3.337	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)Cc1ccsc1	ZINC000960249414	1318428996	/nfs/dbraw/zinc/42/89/96/1318428996.db2.gz	YOWBCGBTMQJYCN-IEBWSBKVSA-N	0	3	326.465	3.239	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1nsc2ccccc21	ZINC000960267913	1318436461	/nfs/dbraw/zinc/43/64/61/1318436461.db2.gz	HHAMZEXRVPOFMN-SJLPKXTDSA-N	0	3	349.459	3.468	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc(C(C)C)nc1	ZINC000960271983	1318437357	/nfs/dbraw/zinc/43/73/57/1318437357.db2.gz	YAMQWRKTDMXWMV-WOJBJXKFSA-N	0	3	335.451	3.376	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc(C)cc(C)n1	ZINC000960276587	1318439902	/nfs/dbraw/zinc/43/99/02/1318439902.db2.gz	ZJZDFIMOXLHYAE-UYAOXDASSA-N	0	3	335.451	3.260	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc(COC)cs1	ZINC000960280083	1318442274	/nfs/dbraw/zinc/44/22/74/1318442274.db2.gz	KSRPOGBFXRIIMX-SJLPKXTDSA-N	0	3	342.464	3.066	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc3ccccc3nc2C)C1	ZINC001021599573	1318443215	/nfs/dbraw/zinc/44/32/15/1318443215.db2.gz	HVHSUOMSQRGLRD-GHTZIAJQSA-N	0	3	347.462	3.103	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccn2ccccc12	ZINC000960284511	1318444857	/nfs/dbraw/zinc/44/48/57/1318444857.db2.gz	YHOBLJQLXDZTKC-UYAOXDASSA-N	0	3	331.419	3.111	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cccc2n[nH]cc21	ZINC000960294562	1318448336	/nfs/dbraw/zinc/44/83/36/1318448336.db2.gz	ZYGOSYHMDQBBRW-WOJBJXKFSA-N	0	3	346.434	3.124	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc2cc[nH]c2c1	ZINC000960311455	1318453954	/nfs/dbraw/zinc/45/39/54/1318453954.db2.gz	AIGLKIVMNHLEEN-WOJBJXKFSA-N	0	3	331.419	3.339	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc([C@@H](C)CC)no1	ZINC000960312897	1318455389	/nfs/dbraw/zinc/45/53/89/1318455389.db2.gz	GKOYWPJOFPHYTG-BOFPYLFWSA-N	0	3	339.439	3.360	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(C)c(F)cc2F)C1	ZINC001021609895	1318456162	/nfs/dbraw/zinc/45/61/62/1318456162.db2.gz	BDKLWGUHJUUTEZ-KXBFYZLASA-N	0	3	346.421	3.223	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@H]1[C@@H]2c3ccccc3C[C@H]12	ZINC000960315321	1318458277	/nfs/dbraw/zinc/45/82/77/1318458277.db2.gz	WHBCFJUTKPFAOU-ZSYZGHEHSA-N	0	3	344.458	3.130	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)Cc2ccccc2CC)C1	ZINC001021612594	1318460283	/nfs/dbraw/zinc/46/02/83/1318460283.db2.gz	CQAXHFFGARHQQD-NHCUHLMSSA-N	0	3	338.495	3.128	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(C)c3ccccc3n2)C1	ZINC001021614035	1318461207	/nfs/dbraw/zinc/46/12/07/1318461207.db2.gz	NYQHGRFKHRSIIT-UTKZUKDTSA-N	0	3	347.462	3.103	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc2c([nH]1)CCC2	ZINC000960325255	1318462628	/nfs/dbraw/zinc/46/26/28/1318462628.db2.gz	UVVZILYHZYMZQZ-UYAOXDASSA-N	0	3	335.451	3.065	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)Cc2ccc(C)cc2Cl)C1	ZINC001021617646	1318466046	/nfs/dbraw/zinc/46/60/46/1318466046.db2.gz	WXOJPBGXPWCWHR-IEBWSBKVSA-N	0	3	344.886	3.137	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)Cc1ccccc1Cl	ZINC000960335487	1318469162	/nfs/dbraw/zinc/46/91/62/1318469162.db2.gz	VDHQOILGVIEVFB-UYAOXDASSA-N	0	3	340.854	3.440	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(CC)s2)C1	ZINC001021622265	1318472303	/nfs/dbraw/zinc/47/23/03/1318472303.db2.gz	HUFWAVGQVUHFJE-DOTOQJQBSA-N	0	3	330.497	3.260	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc3ccccc3s2)C1	ZINC001021626313	1318477314	/nfs/dbraw/zinc/47/73/14/1318477314.db2.gz	FHUYVTSWRREXHT-SJORKVTESA-N	0	3	338.476	3.461	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(-n3cccc3)cc2)C1	ZINC001021626736	1318478422	/nfs/dbraw/zinc/47/84/22/1318478422.db2.gz	HSHNNSQIHLFCAW-TZIWHRDSSA-N	0	3	347.462	3.037	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)C2CCC3(CC3)CC2)C1	ZINC001021636326	1318490560	/nfs/dbraw/zinc/49/05/60/1318490560.db2.gz	PIGNYLNCBRVOHL-RTBURBONSA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc3c(cc(C)cc3C)[nH]2)C1	ZINC001021638674	1318495323	/nfs/dbraw/zinc/49/53/23/1318495323.db2.gz	GDDCNIZJGBGDQA-UTKZUKDTSA-N	0	3	349.478	3.344	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)CCc2ccc(C)cc2C)C1	ZINC001021641924	1318499673	/nfs/dbraw/zinc/49/96/73/1318499673.db2.gz	MVWICPJKNQZWEE-RTWAWAEBSA-N	0	3	338.495	3.182	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc3ccc(C)cc3[nH]2)C1	ZINC001021642055	1318500008	/nfs/dbraw/zinc/50/00/08/1318500008.db2.gz	NUYJDTKJIOJWGD-GHTZIAJQSA-N	0	3	349.478	3.426	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc3ccsc3[nH]2)C1	ZINC001021643948	1318502184	/nfs/dbraw/zinc/50/21/84/1318502184.db2.gz	DSLKDUZIOCTUDL-DOTOQJQBSA-N	0	3	341.480	3.179	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc[nH]c2C(C)C)C1	ZINC001021654559	1318516076	/nfs/dbraw/zinc/51/60/76/1318516076.db2.gz	FVJXHJAKNXLAAA-WMZOPIPTSA-N	0	3	327.472	3.088	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2nccc3ccccc32)C1	ZINC001021661839	1318525233	/nfs/dbraw/zinc/52/52/33/1318525233.db2.gz	RYYHUISLLKQUIO-QUCCMNQESA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cccc3[nH]ccc32)C1	ZINC001021673809	1318538043	/nfs/dbraw/zinc/53/80/43/1318538043.db2.gz	MAKMBMCKGXVWQY-UZLBHIALSA-N	0	3	335.451	3.118	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(F)ccc2Cl)C1	ZINC001021674599	1318540484	/nfs/dbraw/zinc/54/04/84/1318540484.db2.gz	BVEGITCNIHXWPA-CXAGYDPISA-N	0	3	334.822	3.039	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(C(F)F)cc2)C1	ZINC001021691758	1318566554	/nfs/dbraw/zinc/56/65/54/1318566554.db2.gz	RQBFOADZYFKQRE-IRXDYDNUSA-N	0	3	332.394	3.184	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cccn2C2CCCC2)C1	ZINC001021691424	1318566761	/nfs/dbraw/zinc/56/67/61/1318566761.db2.gz	AOCAPBXUUWPRBU-PKOBYXMFSA-N	0	3	339.483	3.163	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC[C@@H]1CN(C)Cc1ccc(OCC#N)cc1	ZINC000960455047	1318577402	/nfs/dbraw/zinc/57/74/02/1318577402.db2.gz	ZSKHOHVHKZBXBD-SJLPKXTDSA-N	0	3	343.471	3.058	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(OCC)cc2)C1	ZINC001021724847	1318616417	/nfs/dbraw/zinc/61/64/17/1318616417.db2.gz	OVDDVXLWBQXIFL-ICSRJNTNSA-N	0	3	340.467	3.035	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)CC(C2CC2)C2CC2)C1	ZINC001021738960	1318645602	/nfs/dbraw/zinc/64/56/02/1318645602.db2.gz	FXBGDCWYDDMGSX-UYAOXDASSA-N	0	3	328.500	3.149	20	30		EGEDHN
C[C@@H](NCc1cc2ccccc2n(C)c1=O)c1ccc(OCC#N)cc1	ZINC000813881879	1318649579	/nfs/dbraw/zinc/64/95/79/1318649579.db2.gz	WWJUAVWEHQUGLQ-OAHLLOKOSA-N	0	3	347.418	3.292	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)C1CC(F)(F)C1	ZINC000960531472	1318650181	/nfs/dbraw/zinc/65/01/81/1318650181.db2.gz	AFPOOBAANAVLLA-QGZVFWFLSA-N	0	3	347.409	3.026	20	30		EGEDHN
Cc1ccccc1C(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001021788079	1318683978	/nfs/dbraw/zinc/68/39/78/1318683978.db2.gz	RLTMWFJOCJGIDU-CALCHBBNSA-N	0	3	337.398	3.056	20	30		EGEDHN
CCc1ccc(C#CC(=O)NC2CCN(Cc3ccccc3)CC2)cc1	ZINC000814360450	1318730146	/nfs/dbraw/zinc/73/01/46/1318730146.db2.gz	NQLJBCROALEDFO-UHFFFAOYSA-N	0	3	346.474	3.381	20	30		EGEDHN
C[C@@H](c1ccc(F)c(F)c1)N(C)C[C@@H]1CCCN1C(=O)C#CC1CC1	ZINC000960614329	1318741437	/nfs/dbraw/zinc/74/14/37/1318741437.db2.gz	QLVMTDGTKMQPSA-YOEHRIQHSA-N	0	3	346.421	3.362	20	30		EGEDHN
CC(C(=O)N1CCC[C@@H]1CN(C)Cc1ccc(C#N)cc1)=C1CCC1	ZINC000960615802	1318743347	/nfs/dbraw/zinc/74/33/47/1318743347.db2.gz	ZOPQJEBBPOLQBC-HXUWFJFHSA-N	0	3	337.467	3.481	20	30		EGEDHN
Cc1cc(CN(C)C[C@H]2CCCN2C(=O)C#CC2CC2)c(C)s1	ZINC000960624046	1318750387	/nfs/dbraw/zinc/75/03/87/1318750387.db2.gz	MPAVDAASBOYPCF-GOSISDBHSA-N	0	3	330.497	3.201	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)NCc1ccc(-c2csc(C)n2)s1	ZINC000912132723	1318829168	/nfs/dbraw/zinc/82/91/68/1318829168.db2.gz	KTMIHUMAVLOHOD-CYBMUJFWSA-N	0	3	335.498	3.480	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1C[C@@H](NCc2ccc(F)cc2F)C1	ZINC001022203257	1318841209	/nfs/dbraw/zinc/84/12/09/1318841209.db2.gz	WRVAECZPBGJDGM-IYBDPMFKSA-N	0	3	345.393	3.003	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccc(Cl)cc1C(=O)N1CCCC1	ZINC000912301681	1318865388	/nfs/dbraw/zinc/86/53/88/1318865388.db2.gz	TVPXDJXZMYDGRQ-OAHLLOKOSA-N	0	3	349.862	3.198	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N(C)Cc1cccc(Br)c1	ZINC000912343727	1318875345	/nfs/dbraw/zinc/87/53/45/1318875345.db2.gz	SLHZHYMTFGFEEH-CQSZACIVSA-N	0	3	325.250	3.091	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc3c(ccc(C)c3C)[nH]2)C1	ZINC001022547184	1318981897	/nfs/dbraw/zinc/98/18/97/1318981897.db2.gz	ZTSJVJNGIDGGIL-OKILXGFUSA-N	0	3	331.847	3.388	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@@H](NCc3ccc(F)cc3F)C2)CC1	ZINC001022649097	1319040863	/nfs/dbraw/zinc/04/08/63/1319040863.db2.gz	XKDGLJLGNZRIBR-CALCHBBNSA-N	0	3	334.410	3.448	20	30		EGEDHN
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001022666783	1319057204	/nfs/dbraw/zinc/05/72/04/1319057204.db2.gz	RGWAZDZRVZWEDY-PJKMLTEKSA-N	0	3	343.446	3.260	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)[C@@H]1CC12CCC2	ZINC000960913768	1319059601	/nfs/dbraw/zinc/05/96/01/1319059601.db2.gz	SFQNVNROJJPQJR-OALUTQOASA-N	0	3	337.467	3.171	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)[C@@H]1C[C@H]1C1CC1	ZINC000960919294	1319066350	/nfs/dbraw/zinc/06/63/50/1319066350.db2.gz	PFWYEVPDHVPQNA-HSALFYBXSA-N	0	3	337.467	3.027	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc(C(C)C)nc2CC)C1	ZINC001022730053	1319082740	/nfs/dbraw/zinc/08/27/40/1319082740.db2.gz	RSGRRZYWXUJACL-OKILXGFUSA-N	0	3	335.879	3.370	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)Cc2c[nH]c3c2cccc3C)C1	ZINC001022810177	1319120632	/nfs/dbraw/zinc/12/06/32/1319120632.db2.gz	JZZRHJRTSXBTPM-GASCZTMLSA-N	0	3	331.847	3.008	20	30		EGEDHN
CC(C)[C@@]1(C)C[C@H]1C(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001022917167	1319169696	/nfs/dbraw/zinc/16/96/96/1319169696.db2.gz	QXLFELFJVALJMN-PFRQMTDMSA-N	0	3	343.446	3.116	20	30		EGEDHN
CCC(=O)N1CCC[C@@H]([C@H]2CCN(Cc3ccc(F)c(C#N)c3)C2)C1	ZINC000961080832	1319194010	/nfs/dbraw/zinc/19/40/10/1319194010.db2.gz	SIPRCGLVHIQZLO-SJORKVTESA-N	0	3	343.446	3.168	20	30		EGEDHN
N#CCCCOc1cccc(CN2CCC3(CC2)OCCCO3)c1	ZINC000816645617	1319200521	/nfs/dbraw/zinc/20/05/21/1319200521.db2.gz	CKLLHTPAQAMRTE-UHFFFAOYSA-N	0	3	330.428	3.098	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)Cc2c[nH]c3cccc(C)c23)C1	ZINC001022987838	1319203315	/nfs/dbraw/zinc/20/33/15/1319203315.db2.gz	YXCIMEWZUKVMAG-GASCZTMLSA-N	0	3	331.847	3.008	20	30		EGEDHN
CCC(=O)N1CCC[C@@H]([C@@H]2CCN(Cc3ccc(C#N)s3)C2)C1	ZINC000961092664	1319204178	/nfs/dbraw/zinc/20/41/78/1319204178.db2.gz	SNRWKWCBNJHVSQ-HUUCEWRRSA-N	0	3	331.485	3.090	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)C2(c3ccccc3C)CCC2)C1	ZINC001023030336	1319228680	/nfs/dbraw/zinc/22/86/80/1319228680.db2.gz	ZNRPXVIUTBIPNK-IYBDPMFKSA-N	0	3	332.875	3.406	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)C2(c3cc(C)cc(C)c3)CC2)C1	ZINC001023096360	1319258447	/nfs/dbraw/zinc/25/84/47/1319258447.db2.gz	NGXFNZGIYXYMRE-CALCHBBNSA-N	0	3	332.875	3.324	20	30		EGEDHN
CN(C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1)[C@H]1CCCN(C)C1	ZINC000930250156	1328820023	/nfs/dbraw/zinc/82/00/23/1328820023.db2.gz	XRIIEZKNCYNWPM-ZDUSSCGKSA-N	0	3	340.349	3.135	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)[C@H]2CCCCC2(C)C)C1	ZINC001023144568	1319287485	/nfs/dbraw/zinc/28/74/85/1319287485.db2.gz	AFERQHVVSUBHJP-HZSPNIEDSA-N	0	3	343.309	3.348	20	30		EGEDHN
CC(C)(C)OC(=O)N(CCNCc1ccc(C#N)c(F)c1)C1CC1	ZINC000817407018	1319349083	/nfs/dbraw/zinc/34/90/83/1319349083.db2.gz	BJMUIRIJHCLHBF-UHFFFAOYSA-N	0	3	333.407	3.186	20	30		EGEDHN
CC(C)[C@H](CNCc1ccc(C#N)c(F)c1)NC(=O)OC(C)(C)C	ZINC000817407067	1319349789	/nfs/dbraw/zinc/34/97/89/1319349789.db2.gz	BWTNAUICEZCNCG-INIZCTEOSA-N	0	3	335.423	3.336	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H](CNC(=O)[C@@H]3CC=CCC3)C2)cc1	ZINC001023229650	1319368077	/nfs/dbraw/zinc/36/80/77/1319368077.db2.gz	MBMBJBLJWGCYEV-VQTJNVASSA-N	0	3	337.467	3.243	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1sccc1-c1ccc(F)cc1	ZINC000818593399	1319565127	/nfs/dbraw/zinc/56/51/27/1319565127.db2.gz	XRUMLSJDGAHZIC-UHFFFAOYSA-N	0	3	330.428	3.239	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1ccc2nc(-c3ccccc3)oc2c1	ZINC000818609412	1319570448	/nfs/dbraw/zinc/57/04/48/1319570448.db2.gz	UJISVXWHHADQIA-UHFFFAOYSA-N	0	3	347.418	3.180	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2[C@H]3CN([C@@H](C)c4ccc(F)cc4)C[C@H]32)cc1	ZINC000961427707	1319581901	/nfs/dbraw/zinc/58/19/01/1319581901.db2.gz	BSJPXUJYXKEGCY-CCARFGRDSA-N	0	3	348.421	3.228	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2occc2-c2ccccc2)C1	ZINC001023477948	1319582381	/nfs/dbraw/zinc/58/23/81/1319582381.db2.gz	KOLFBPZFZILHDK-QGZVFWFLSA-N	0	3	336.435	3.412	20	30		EGEDHN
N#Cc1ccc([C@H](O)CNCc2cccc(NC(=O)C3CCC3)c2)cc1	ZINC000818952323	1319587721	/nfs/dbraw/zinc/58/77/21/1319587721.db2.gz	JHMLCFSSUGJKGF-HXUWFJFHSA-N	0	3	349.434	3.120	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc3cc(Cl)ccc3[nH]2)C1	ZINC001023525465	1319631462	/nfs/dbraw/zinc/63/14/62/1319631462.db2.gz	VHOYGMAOZAKOQA-AWEZNQCLSA-N	0	3	343.858	3.286	20	30		EGEDHN
Cc1cocc1C(=O)NC[C@@H]1CCCN(Cc2ccc(C#N)cc2)C1	ZINC001023534466	1319638916	/nfs/dbraw/zinc/63/89/16/1319638916.db2.gz	RBZNYONZGDGRJK-SFHVURJKSA-N	0	3	337.423	3.102	20	30		EGEDHN
Cc1coc(C(=O)NC[C@H]2CCCN(Cc3ccc(C#N)cc3)C2)c1	ZINC001023547078	1319656525	/nfs/dbraw/zinc/65/65/25/1319656525.db2.gz	CDTPGPLLKPKRRY-GOSISDBHSA-N	0	3	337.423	3.102	20	30		EGEDHN
C#CCN1CCC[C@H](CNC(=O)c2c(Cl)oc3ccccc32)C1	ZINC001023552248	1319663910	/nfs/dbraw/zinc/66/39/10/1319663910.db2.gz	BSTQYSJPAFSRSJ-CYBMUJFWSA-N	0	3	330.815	3.161	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN[C@@H]2CCCOc3cc(F)ccc32)cc1	ZINC000819210792	1319669765	/nfs/dbraw/zinc/66/97/65/1319669765.db2.gz	LIDKZEUBDQAISV-MSOLQXFVSA-N	0	3	326.371	3.234	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CCCN(Cc3cnccc3C)C2)CC1	ZINC001023572799	1319691327	/nfs/dbraw/zinc/69/13/27/1319691327.db2.gz	NQIPRSBEYJKVPZ-SFHVURJKSA-N	0	3	341.499	3.465	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)COc1c(C)cc(C)cc1C	ZINC000916873652	1319717227	/nfs/dbraw/zinc/71/72/27/1319717227.db2.gz	YHIMOMDKMZPODY-QGZVFWFLSA-N	0	3	344.455	3.396	20	30		EGEDHN
CC(C)(C)n1cc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)cn1	ZINC000916911979	1319724550	/nfs/dbraw/zinc/72/45/50/1319724550.db2.gz	OMFVTQCKUVRZDQ-LBPRGKRZSA-N	0	3	344.802	3.253	20	30		EGEDHN
C#CCN(C[C@@H](O)COc1ccc(F)cc1)[C@@H]1CCc2ccccc21	ZINC000917116998	1319759254	/nfs/dbraw/zinc/75/92/54/1319759254.db2.gz	CQKJPGCPXYSVPJ-WIYYLYMNSA-N	0	3	339.410	3.188	20	30		EGEDHN
CC1(C)CCC[C@@H]1C(=O)NC1CC(CNCc2ccccc2C#N)C1	ZINC000962188031	1319851194	/nfs/dbraw/zinc/85/11/94/1319851194.db2.gz	MHMCKQZVHZLHCU-XUJQIHCRSA-N	0	3	339.483	3.369	20	30		EGEDHN
C#CCN1CCC[C@@H](CNC(=O)c2cc(Cl)ccc2Cl)C1	ZINC001023718373	1319854721	/nfs/dbraw/zinc/85/47/21/1319854721.db2.gz	ROKMUGXSDOYZPZ-LBPRGKRZSA-N	0	3	325.239	3.068	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc(C)n(C(C)C)c2C)C1	ZINC001023740323	1319886253	/nfs/dbraw/zinc/88/62/53/1319886253.db2.gz	DYLIGPDWPVXQBY-SFHVURJKSA-N	0	3	329.488	3.151	20	30		EGEDHN
C=C1CC(C)(C(=O)NC2CC(CNCc3ccncc3Cl)C2)C1	ZINC000962265749	1319891577	/nfs/dbraw/zinc/89/15/77/1319891577.db2.gz	ADRZWUJEJSDCFY-UHFFFAOYSA-N	0	3	333.863	3.076	20	30		EGEDHN
C/C(=C\C(=O)N(CCN(C)C)Cc1cccc(C#N)c1)c1ccco1	ZINC000824368772	1320251802	/nfs/dbraw/zinc/25/18/02/1320251802.db2.gz	UHSUNPIMNUBBTE-FOWTUZBSSA-N	0	3	337.423	3.145	20	30		EGEDHN
CC(C)(C)C#CC(=O)Nc1ccc(CCN2CCSCC2)cc1	ZINC000837379383	1320607338	/nfs/dbraw/zinc/60/73/38/1320607338.db2.gz	WCHZRMKYLDSPHS-UHFFFAOYSA-N	0	3	330.497	3.266	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1ccccc1N1CCCCCC1	ZINC000838624272	1320795877	/nfs/dbraw/zinc/79/58/77/1320795877.db2.gz	PIRGCQPNWRQBAQ-UHFFFAOYSA-N	0	3	342.487	3.144	20	30		EGEDHN
CNC(=O)C1(NCc2ccc(-c3ccccc3C#N)cc2)CCCC1	ZINC000839516374	1320931485	/nfs/dbraw/zinc/93/14/85/1320931485.db2.gz	HLWXAASWSGKWAQ-UHFFFAOYSA-N	0	3	333.435	3.374	20	30		EGEDHN
C=CCSc1nc2ccccc2n1CN1CCN(C)C[C@H]1CC	ZINC000840094342	1321027779	/nfs/dbraw/zinc/02/77/79/1321027779.db2.gz	SAWQXBYIMLEGMI-OAHLLOKOSA-N	0	3	330.501	3.298	20	30		EGEDHN
C=CCc1cc(C[N@@H+]2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)c([O-])c(OC)c1	ZINC000840121012	1321032150	/nfs/dbraw/zinc/03/21/50/1321032150.db2.gz	QDJHYHWYMNUYEC-KSZLIROESA-N	0	3	331.456	3.255	20	30		EGEDHN
C=CCc1cc(C[N@H+]2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)c([O-])c(OC)c1	ZINC000840121012	1321032154	/nfs/dbraw/zinc/03/21/54/1321032154.db2.gz	QDJHYHWYMNUYEC-KSZLIROESA-N	0	3	331.456	3.255	20	30		EGEDHN
C=CCC[C@@H]1NC(=O)N(C[C@H]2CCCN(C)[C@@H]2c2cccs2)C1=O	ZINC000842243692	1321364687	/nfs/dbraw/zinc/36/46/87/1321364687.db2.gz	IJOUTYLILMCIJW-YCPHGPKFSA-N	0	3	347.484	3.018	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@@H]1C[C@H]1c1ccccc1OC	ZINC000842283638	1321367173	/nfs/dbraw/zinc/36/71/73/1321367173.db2.gz	ASFGUFLESBOTEM-BBWFWOEESA-N	0	3	342.439	3.204	20	30		EGEDHN
Cc1ccc(-c2nn(C)cc2CNCc2ccc(OCC#N)cc2)o1	ZINC000842676958	1321416938	/nfs/dbraw/zinc/41/69/38/1321416938.db2.gz	SMGOFHUBHYVEBC-UHFFFAOYSA-N	0	3	336.395	3.181	20	30		EGEDHN
CC(C)SCC(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847745059	1321899948	/nfs/dbraw/zinc/89/99/48/1321899948.db2.gz	ADKFUYKRNUPJFU-UHFFFAOYSA-N	0	3	346.496	3.477	20	30		EGEDHN
CO[C@H](C(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1)C(C)C	ZINC000847747249	1321900818	/nfs/dbraw/zinc/90/08/18/1321900818.db2.gz	DMRIBOMZAXYYSQ-SFHVURJKSA-N	0	3	344.455	3.007	20	30		EGEDHN
C/C(=C\C(=O)N1CCC[C@@H](CNCc2ccccc2C#N)C1)C1CC1	ZINC001023869060	1321988715	/nfs/dbraw/zinc/98/87/15/1321988715.db2.gz	VXSOUGJBOXBTGT-YTBHAWNYSA-N	0	3	337.467	3.243	20	30		EGEDHN
N#CC(C(=O)[C@@H]1CC(=O)N[C@H]2CCCC[C@H]12)c1ccc2ccccc2n1	ZINC000850740908	1322281714	/nfs/dbraw/zinc/28/17/14/1322281714.db2.gz	ATKHFZRWHGHGOP-CBZIJGRNSA-N	0	3	347.418	3.106	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)CC2(C#N)CCCCC2)c1	ZINC000850757693	1322284918	/nfs/dbraw/zinc/28/49/18/1322284918.db2.gz	OZNFLBZJLKWABX-INIZCTEOSA-N	0	3	339.395	3.207	20	30		EGEDHN
CC[C@H](C[C@H](C)CO)NCc1cc(C#N)ccc1Br	ZINC000921807403	1322401591	/nfs/dbraw/zinc/40/15/91/1322401591.db2.gz	QAXJCNWENNVVOY-SMDDNHRTSA-N	0	3	325.250	3.207	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@@H]1CCCN(C(=O)CCC2CC2)C1	ZINC001023899524	1323012541	/nfs/dbraw/zinc/01/25/41/1323012541.db2.gz	QXWLLWTXHWYQIE-INIZCTEOSA-N	0	3	343.446	3.216	20	30		EGEDHN
C[C@@H](NC[C@@H]1CCCN(C(=O)C#CC2CC2)C1)c1c(F)cccc1F	ZINC001023980983	1323062619	/nfs/dbraw/zinc/06/26/19/1323062619.db2.gz	GAAGQMXUJIDTHN-ZBFHGGJFSA-N	0	3	346.421	3.267	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@H]1CCCN(CCc2ccc(C#N)cc2)C1	ZINC000851734636	1323075634	/nfs/dbraw/zinc/07/56/34/1323075634.db2.gz	VPOFJPPLFAWMPG-QGZVFWFLSA-N	0	3	329.444	3.090	20	30		EGEDHN
CC(=O)N[C@@H](c1ccccc1F)[C@@H](C)NCc1ccc(C#N)cc1	ZINC000924701864	1323120628	/nfs/dbraw/zinc/12/06/28/1323120628.db2.gz	SOMCMWRWULLJTF-BFUOFWGJSA-N	0	3	325.387	3.053	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H](CNCc2nc(C)cs2)C1	ZINC001024090541	1323122370	/nfs/dbraw/zinc/12/23/70/1323122370.db2.gz	KRJLNGHLLMLOQR-HNNXBMFYSA-N	0	3	335.517	3.382	20	30		EGEDHN
CC(C)[C@H](F)C(=O)N1CCC[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001024107742	1323140020	/nfs/dbraw/zinc/14/00/20/1323140020.db2.gz	WHVCRIYYPKCXTH-KSSFIOAISA-N	0	3	349.425	3.020	20	30		EGEDHN
C#C[C@@](C)(CC)NCC(=O)N[C@@H](c1cccs1)c1ccccc1	ZINC000852098194	1323145349	/nfs/dbraw/zinc/14/53/49/1323145349.db2.gz	HFKYONOAUIRPPY-MOPGFXCFSA-N	0	3	326.465	3.345	20	30		EGEDHN
C#C[C@@](C)(CC)NCC(=O)N1CCC[C@@H]1c1ccc(OCC)cc1	ZINC000852099870	1323145720	/nfs/dbraw/zinc/14/57/20/1323145720.db2.gz	CFBYJSMKKVWVTE-QUCCMNQESA-N	0	3	328.456	3.140	20	30		EGEDHN
C#C[C@@](C)(CC)NCC(=O)N[C@H](C)c1ccc(OC(F)(F)F)cc1	ZINC000852102397	1323147063	/nfs/dbraw/zinc/14/70/63/1323147063.db2.gz	MIOZVBHUXGLBJF-WBMJQRKESA-N	0	3	342.361	3.154	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@H](CN[C@@H](C)c3cnccn3)C2)CC1	ZINC001024133795	1323157328	/nfs/dbraw/zinc/15/73/28/1323157328.db2.gz	OQMNTGAHJGLZTB-DLBZAZTESA-N	0	3	342.487	3.112	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H](CNCc2nc(C)cs2)C1	ZINC001024135098	1323160784	/nfs/dbraw/zinc/16/07/84/1323160784.db2.gz	IUNYGRILVPKISH-QAPCUYQASA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H](CNCc2oc(CC)nc2C)C1	ZINC001024137967	1323162721	/nfs/dbraw/zinc/16/27/21/1323162721.db2.gz	WTCPMHSLZDLIEC-OXJNMPFZSA-N	0	3	347.503	3.476	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H](CNCc2oc(C)nc2C)C1	ZINC001024137888	1323162854	/nfs/dbraw/zinc/16/28/54/1323162854.db2.gz	VBTRDAKJGRLLGX-APWZRJJASA-N	0	3	333.476	3.222	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)c2cccn2C)C1	ZINC000963258082	1323267565	/nfs/dbraw/zinc/26/75/65/1323267565.db2.gz	CAYZLCSEZTUHHK-JKSUJKDBSA-N	0	3	335.879	3.094	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1cc(C(F)F)ccc1F	ZINC001024442855	1323403716	/nfs/dbraw/zinc/40/37/16/1323403716.db2.gz	ZRHUWBWFKSGMAE-CQSZACIVSA-N	0	3	338.373	3.371	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1cc2ccccc2nc1C	ZINC001024467413	1323422951	/nfs/dbraw/zinc/42/29/51/1323422951.db2.gz	FQKAHYGFZHOUBI-SFHVURJKSA-N	0	3	335.451	3.151	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1c(C)nn(C(C)(C)C)c1C	ZINC001024469612	1323424862	/nfs/dbraw/zinc/42/48/62/1323424862.db2.gz	UDKSYOAODAJUCR-QGZVFWFLSA-N	0	3	346.519	3.415	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NC[C@H]1CCCCN1CCCF	ZINC001024515626	1323465790	/nfs/dbraw/zinc/46/57/90/1323465790.db2.gz	XRRULUPLYPURNR-MRXNPFEDSA-N	0	3	334.435	3.195	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1c2c[nH]nc2ccc1C	ZINC001024519375	1323468471	/nfs/dbraw/zinc/46/84/71/1323468471.db2.gz	TZJUZWLWWDTORE-OAHLLOKOSA-N	0	3	326.444	3.032	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@H]1Cc2cc(Cl)ccc2O1	ZINC001024537542	1323478668	/nfs/dbraw/zinc/47/86/68/1323478668.db2.gz	HEBLOLGGFDYIGN-FUHWJXTLSA-N	0	3	348.874	3.190	20	30		EGEDHN
C=CCCN1CCCC[C@@H]1CNC(=O)c1ncsc1C(F)(F)F	ZINC001024547459	1323489298	/nfs/dbraw/zinc/48/92/98/1323489298.db2.gz	LNBUURBHRWRYRI-LLVKDONJSA-N	0	3	347.406	3.322	20	30		EGEDHN
C=CCCN1CCCC[C@@H]1CNC(=O)c1cnc(CC2CC2)s1	ZINC001024568721	1323507016	/nfs/dbraw/zinc/50/70/16/1323507016.db2.gz	VEFYYEVJDDTCEZ-OAHLLOKOSA-N	0	3	333.501	3.256	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1cc(-c2cccs2)on1	ZINC001024578739	1323514655	/nfs/dbraw/zinc/51/46/55/1323514655.db2.gz	ABFMBSSXFSCOKI-CQSZACIVSA-N	0	3	343.452	3.011	20	30		EGEDHN
C=CCN1CCCC[C@H]1CNC(=O)c1ccc(F)c2ccncc12	ZINC001024618610	1323546588	/nfs/dbraw/zinc/54/65/88/1323546588.db2.gz	WPGNQNRAOBQOEN-AWEZNQCLSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@@H]1C[C@H]1c1ccccc1OC	ZINC001024701170	1323615015	/nfs/dbraw/zinc/61/50/15/1323615015.db2.gz	LPOSKCROPHEGOF-YTQUADARSA-N	0	3	342.483	3.346	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1cccc(C(F)(F)F)c1	ZINC001024773714	1323674864	/nfs/dbraw/zinc/67/48/64/1323674864.db2.gz	KBFZFVRVIVWLQK-MRXNPFEDSA-N	0	3	338.373	3.313	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccc(N(C)C)c(F)c1	ZINC001024818385	1323722431	/nfs/dbraw/zinc/72/24/31/1323722431.db2.gz	UQNYCSNCHFEYRX-INIZCTEOSA-N	0	3	333.451	3.052	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@H]1CNCc1cn(C(C)C)nc1C	ZINC001025040925	1323843798	/nfs/dbraw/zinc/84/37/98/1323843798.db2.gz	PEOVDWAXDJKBIH-SFHVURJKSA-N	0	3	346.519	3.455	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCCC[C@H]1CNCc1n[nH]c(C(C)C)n1	ZINC001025069404	1323870384	/nfs/dbraw/zinc/87/03/84/1323870384.db2.gz	JTCPJJLMKIZBNX-HNAYVOBHSA-N	0	3	347.507	3.001	20	30		EGEDHN
CC(C)(C)C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC001025144697	1323920858	/nfs/dbraw/zinc/92/08/58/1323920858.db2.gz	BKLVQKAUIKMORR-INIZCTEOSA-N	0	3	331.435	3.214	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1c(C)coc1C	ZINC001025230655	1324016938	/nfs/dbraw/zinc/01/69/38/1324016938.db2.gz	YMUIJQUNNBZGAT-ROUUACIJSA-N	0	3	328.456	3.379	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1c(F)cccc1OC	ZINC001025233298	1324020295	/nfs/dbraw/zinc/02/02/95/1324020295.db2.gz	WWUJMVCLCIGEGB-DLBZAZTESA-N	0	3	346.446	3.479	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccnc(CCC)c1	ZINC001025240082	1324033445	/nfs/dbraw/zinc/03/34/45/1324033445.db2.gz	LAMZPIKCRSMZMU-PMACEKPBSA-N	0	3	339.483	3.126	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc2c[nH]ccc-2n1	ZINC001025243696	1324040948	/nfs/dbraw/zinc/04/09/48/1324040948.db2.gz	DMSOPZWIFBBDNT-OALUTQOASA-N	0	3	338.455	3.208	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1c[nH]nc1C(C)C	ZINC001025245481	1324043399	/nfs/dbraw/zinc/04/33/99/1324043399.db2.gz	NDICJTJRMURLKM-MSOLQXFVSA-N	0	3	342.487	3.016	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cccc(C(C)C)n1	ZINC001025250289	1324049643	/nfs/dbraw/zinc/04/96/43/1324049643.db2.gz	ILCYFIUDGVKARD-VQTJNVASSA-N	0	3	339.483	3.297	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc(C)c(OC)c1	ZINC001025250033	1324050731	/nfs/dbraw/zinc/05/07/31/1324050731.db2.gz	GNUQDCKFHBATCO-RTBURBONSA-N	0	3	340.467	3.096	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(C)ccc1OC	ZINC001025252562	1324057026	/nfs/dbraw/zinc/05/70/26/1324057026.db2.gz	XYERBQRXKHPHNE-OALUTQOASA-N	0	3	340.467	3.096	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1occ2c1CCC2	ZINC001025255956	1324062298	/nfs/dbraw/zinc/06/22/98/1324062298.db2.gz	UGZRXNXQJPIIOB-QZTJIDSGSA-N	0	3	328.456	3.413	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)C1(C2CCC2)CCC1	ZINC001025256506	1324062692	/nfs/dbraw/zinc/06/26/92/1324062692.db2.gz	YCFUAVPJINRJQA-OALUTQOASA-N	0	3	328.500	3.436	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc(C(C)C)cn1	ZINC001025269452	1324082027	/nfs/dbraw/zinc/08/20/27/1324082027.db2.gz	QIRSNOJUJMICFJ-VQTJNVASSA-N	0	3	339.483	3.297	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(C)cc(F)c1	ZINC001025272148	1324087900	/nfs/dbraw/zinc/08/79/00/1324087900.db2.gz	KJMXJEGEMFGIDD-RTBURBONSA-N	0	3	328.431	3.226	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)CCc1ccccc1C	ZINC001025273168	1324088518	/nfs/dbraw/zinc/08/85/18/1324088518.db2.gz	OFXKATIXQDZXFV-LEWJYISDSA-N	0	3	338.495	3.406	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(C(C)C)no1	ZINC001025273895	1324090570	/nfs/dbraw/zinc/09/05/70/1324090570.db2.gz	IATDDNADDLYSQG-SJORKVTESA-N	0	3	331.460	3.443	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc2ccccn2c1	ZINC001025275218	1324095625	/nfs/dbraw/zinc/09/56/25/1324095625.db2.gz	UUHXSAJVKOOQEU-PMACEKPBSA-N	0	3	335.451	3.032	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1oc(CC)nc1C	ZINC001025287546	1324109986	/nfs/dbraw/zinc/10/99/86/1324109986.db2.gz	OOTFDHFXTLCXHO-JKSUJKDBSA-N	0	3	331.460	3.191	20	30		EGEDHN
C[C@@H](NC(=O)c1ccco1)[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001025320604	1324157946	/nfs/dbraw/zinc/15/79/46/1324157946.db2.gz	NQQLDZAEFWWYJK-CRAIPNDOSA-N	0	3	337.423	3.182	20	30		EGEDHN
C[C@@H](NC(=O)c1ccco1)[C@H]1CCCN(Cc2ccc(C#N)cc2)C1	ZINC001025320823	1324158443	/nfs/dbraw/zinc/15/84/43/1324158443.db2.gz	QTDGJZIVQYJXII-QAPCUYQASA-N	0	3	337.423	3.182	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC001025426554	1324260741	/nfs/dbraw/zinc/26/07/41/1324260741.db2.gz	XDVBKJCEQKZBNM-TZMCWYRMSA-N	0	3	338.373	3.227	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc3nccc(C)c3c2)C1	ZINC001025429049	1324264308	/nfs/dbraw/zinc/26/43/08/1324264308.db2.gz	QXNJFZATEMXTAK-WMZOPIPTSA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc3ccncc3s2)C1	ZINC001025438869	1324278200	/nfs/dbraw/zinc/27/82/00/1324278200.db2.gz	JARWVFUDFNGQDT-HOCLYGCPSA-N	0	3	341.480	3.150	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cccc3c2CCCCC3)C1	ZINC001025450659	1324293811	/nfs/dbraw/zinc/29/38/11/1324293811.db2.gz	LFPAHHLHHGIIFM-MJGOQNOKSA-N	0	3	338.495	3.419	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc3sccc3s2)C1	ZINC001025458889	1324300827	/nfs/dbraw/zinc/30/08/27/1324300827.db2.gz	JUTXDCFTMVMVTA-STQMWFEESA-N	0	3	332.494	3.426	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc3sccc3s2)C1	ZINC001025458885	1324300976	/nfs/dbraw/zinc/30/09/76/1324300976.db2.gz	JUTXDCFTMVMVTA-QWHCGFSZSA-N	0	3	332.494	3.426	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(C)nn2C(CC)CC)C1	ZINC001025462063	1324307524	/nfs/dbraw/zinc/30/75/24/1324307524.db2.gz	AHZLMWJRJPBGHS-SJORKVTESA-N	0	3	344.503	3.016	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc3ccccc3s2)C1	ZINC001025471457	1324316273	/nfs/dbraw/zinc/31/62/73/1324316273.db2.gz	FAXWTKSJTQTLKE-HOCLYGCPSA-N	0	3	326.465	3.365	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(F)ccc2CC)C1	ZINC001025471976	1324317269	/nfs/dbraw/zinc/31/72/69/1324317269.db2.gz	LNVHFPIGRCVBBA-NVXWUHKLSA-N	0	3	330.447	3.242	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2nc3ccccc3cc2C)C1	ZINC001025484703	1324333041	/nfs/dbraw/zinc/33/30/41/1324333041.db2.gz	HSZMRBMSGYOPCQ-PKOBYXMFSA-N	0	3	349.478	3.397	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cnc3ccccc3c2C)C1	ZINC001025489388	1324339947	/nfs/dbraw/zinc/33/99/47/1324339947.db2.gz	OZDRHLBZXKJONR-IRXDYDNUSA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccn(C(C)C)c2C)C1	ZINC001025519053	1324362866	/nfs/dbraw/zinc/36/28/66/1324362866.db2.gz	JLDLAYLQDMKIEE-SJLPKXTDSA-N	0	3	329.488	3.231	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cccc(F)c2Cl)C1	ZINC001025538353	1324385074	/nfs/dbraw/zinc/38/50/74/1324385074.db2.gz	GJSFKZOXAWGXMX-KGLIPLIRSA-N	0	3	336.838	3.333	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(F)ccc2Cl)C1	ZINC001025540610	1324387039	/nfs/dbraw/zinc/38/70/39/1324387039.db2.gz	XYEBLNUYRHLRIM-KBPBESRZSA-N	0	3	336.838	3.333	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(C(C)(C)C)oc2C)C1	ZINC001025545597	1324393061	/nfs/dbraw/zinc/39/30/61/1324393061.db2.gz	KINKIYAXYCVGQI-GOEBONIOSA-N	0	3	330.472	3.349	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccccc2OCC(C)C)C1	ZINC001025565615	1324411740	/nfs/dbraw/zinc/41/17/40/1324411740.db2.gz	SOTQSALVFVIHEK-ROUUACIJSA-N	0	3	342.483	3.185	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(-c3ccccc3)nc2)C1	ZINC001025577840	1324418019	/nfs/dbraw/zinc/41/80/19/1324418019.db2.gz	VANRCYQMKGGSGB-XLIONFOSSA-N	0	3	347.462	3.212	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc3nc(C)sc3c2)C1	ZINC001025587424	1324431781	/nfs/dbraw/zinc/43/17/81/1324431781.db2.gz	MMSQVNKNEXVYCC-BBRMVZONSA-N	0	3	341.480	3.068	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cccc(C(F)F)c2)C1	ZINC001025598314	1324446992	/nfs/dbraw/zinc/44/69/92/1324446992.db2.gz	YJYQUSAUMCOSST-PBHICJAKSA-N	0	3	334.410	3.478	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2sccc2C(F)F)C1	ZINC001025605998	1324455119	/nfs/dbraw/zinc/45/51/19/1324455119.db2.gz	KMKWXSYSENVCHU-VXGBXAGGSA-N	0	3	326.412	3.149	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(OCC(C)C)cc2)C1	ZINC001025611597	1324463419	/nfs/dbraw/zinc/46/34/19/1324463419.db2.gz	MTRAWGUDRDHZBV-HKUYNNGSSA-N	0	3	342.483	3.185	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc3c(s2)CCCCC3)C1	ZINC001025613750	1324465484	/nfs/dbraw/zinc/46/54/84/1324465484.db2.gz	ZWUORDQKGNIUJO-RDJZCZTQSA-N	0	3	344.524	3.481	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(OC(C)C)cc2)C1	ZINC001025614720	1324467574	/nfs/dbraw/zinc/46/75/74/1324467574.db2.gz	OIEKNQHVPFRBLI-PKOBYXMFSA-N	0	3	342.483	3.327	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc3cccc(F)c3o2)C1	ZINC001025627977	1324478685	/nfs/dbraw/zinc/47/86/85/1324478685.db2.gz	MDJXATVKCRVIIO-ZBFHGGJFSA-N	0	3	342.414	3.426	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(CC)c(CC)c2)C1	ZINC001025637546	1324489694	/nfs/dbraw/zinc/48/96/94/1324489694.db2.gz	WRUCOSIXRCCVHN-OXJNMPFZSA-N	0	3	326.484	3.275	20	30		EGEDHN
CC(C)CC(=O)N1C[C@@H]2CC[C@H](NCc3cc(F)ccc3C#N)[C@@H]2C1	ZINC001026179612	1324647169	/nfs/dbraw/zinc/64/71/69/1324647169.db2.gz	ZCQUYVREDBPAAB-IPELMVKDSA-N	0	3	343.446	3.070	20	30		EGEDHN
CCC1(C(=O)N2C[C@@H]3CC[C@H](NCc4ccccc4C#N)[C@H]3C2)CC1	ZINC001026353506	1324747494	/nfs/dbraw/zinc/74/74/94/1324747494.db2.gz	GJCKIJYHEAJNJK-FHWLQOOXSA-N	0	3	337.467	3.075	20	30		EGEDHN
Cc1occc1C(=O)NC1CCC(NCc2ccccc2C#N)CC1	ZINC001026449419	1324813115	/nfs/dbraw/zinc/81/31/15/1324813115.db2.gz	NZILGYIHTQXVSJ-UHFFFAOYSA-N	0	3	337.423	3.291	20	30		EGEDHN
C[C@@H](C(=O)NC1CCC(NCc2cc(F)ccc2C#N)CC1)C1CC1	ZINC001026472145	1324830120	/nfs/dbraw/zinc/83/01/20/1324830120.db2.gz	TZAWHWJLSSRBCZ-XYJCDUHRSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)C(C)(C)C2CC2)CC1	ZINC001026542709	1324879328	/nfs/dbraw/zinc/87/93/28/1324879328.db2.gz	WYJQHMZOPKWKAN-UHFFFAOYSA-N	0	3	343.309	3.348	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@@H]1CCN(C(=O)C2CCCCC2)C1	ZINC001026653495	1324952412	/nfs/dbraw/zinc/95/24/12/1324952412.db2.gz	MFPZYJGYCAYQTE-HNNXBMFYSA-N	0	3	343.446	3.216	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)c2c(C)ccn2C)C1	ZINC000963291896	1325078009	/nfs/dbraw/zinc/07/80/09/1325078009.db2.gz	AEPKATLNSSWLLZ-IAGOWNOFSA-N	0	3	349.906	3.403	20	30		EGEDHN
CN(C(=O)[C@H]1CC1(F)F)C1CCC(NCc2ccccc2C#N)CC1	ZINC000963307182	1325088810	/nfs/dbraw/zinc/08/88/10/1325088810.db2.gz	HMQRHVRQJJHRMA-OFLPRAFFSA-N	0	3	347.409	3.073	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)c2cc(F)c[nH]2)C1	ZINC000963338546	1325127787	/nfs/dbraw/zinc/12/77/87/1325127787.db2.gz	WBPCERJUTRRHKR-CJNGLKHVSA-N	0	3	339.842	3.223	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCN(C(=O)C[C@@H]2CC=CCC2)C1	ZINC001026999312	1325137435	/nfs/dbraw/zinc/13/74/35/1325137435.db2.gz	SPANAYIIGQQQKZ-QZTJIDSGSA-N	0	3	337.467	3.243	20	30		EGEDHN
CCC(C)(C)N1CCN(c2cc(Br)cnc2C#N)CC1	ZINC000853715265	1325151929	/nfs/dbraw/zinc/15/19/29/1325151929.db2.gz	IALOZCVWIAPDOT-UHFFFAOYSA-N	0	3	337.265	3.026	20	30		EGEDHN
Cc1cc(C(=O)NC2CC3(CC(NCc4ccccc4C#N)C3)C2)co1	ZINC000963718817	1325385153	/nfs/dbraw/zinc/38/51/53/1325385153.db2.gz	FJZFSVGKTTZHLJ-UHFFFAOYSA-N	0	3	349.434	3.291	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)[C@@H]1CCC[C@@H](F)C1)C2	ZINC000963790262	1325401535	/nfs/dbraw/zinc/40/15/35/1325401535.db2.gz	ICUSKYJWIWILPW-CBTLZMEFSA-N	0	3	328.859	3.284	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N(C)C1CCC(NCc2ccccc2C#N)CC1	ZINC000963805619	1325404976	/nfs/dbraw/zinc/40/49/76/1325404976.db2.gz	BSDCPAUORNDGAR-QKHJWGRCSA-N	0	3	325.456	3.073	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)c2ccsc2)C1	ZINC001027288931	1325421166	/nfs/dbraw/zinc/42/11/66/1325421166.db2.gz	NGSHHYMTPMFFNV-GOSISDBHSA-N	0	3	339.464	3.356	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)[C@H]2CC=CCC2)C1	ZINC001027294541	1325430303	/nfs/dbraw/zinc/43/03/03/1325430303.db2.gz	WMHPEAIQEXKWJL-PMACEKPBSA-N	0	3	337.467	3.337	20	30		EGEDHN
Cc1ccccc1C[C@@H](C)C(=O)C(C#N)C(=O)NC1CCCCC1	ZINC000860468026	1329321032	/nfs/dbraw/zinc/32/10/32/1329321032.db2.gz	HWZWGKYEHMQJPC-CRAIPNDOSA-N	0	3	326.440	3.331	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)C(=O)NCc1ccc(F)c(F)c1)c1ccco1	ZINC000860692563	1329344789	/nfs/dbraw/zinc/34/47/89/1329344789.db2.gz	NKCCYGRZZDHTJW-WCQYABFASA-N	0	3	346.333	3.077	20	30		EGEDHN
C[C@H](CC(=O)C(C#N)C(=O)NCc1ccc(F)c(F)c1)c1ccco1	ZINC000860692564	1329344850	/nfs/dbraw/zinc/34/48/50/1329344850.db2.gz	NKCCYGRZZDHTJW-YPMHNXCESA-N	0	3	346.333	3.077	20	30		EGEDHN
C[C@H](c1ccc(F)c(F)c1)N(C)[C@@H]1CCCN(C(=O)C#CC2CC2)C1	ZINC001027402734	1327624976	/nfs/dbraw/zinc/62/49/76/1327624976.db2.gz	RJONVTJCCDBRFM-RHSMWYFYSA-N	0	3	346.421	3.362	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCC[C@H](N(C)Cc2ccsc2)C1	ZINC001027441592	1327682101	/nfs/dbraw/zinc/68/21/01/1327682101.db2.gz	GWYGQGQEFHRXLR-KRWDZBQOSA-N	0	3	343.496	3.472	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)C2(C3CC3)CC2)C1	ZINC001027456353	1327696992	/nfs/dbraw/zinc/69/69/92/1327696992.db2.gz	XMYNARGUGKHILX-IBGZPJMESA-N	0	3	337.467	3.171	20	30		EGEDHN
C=C1CCC(C(=O)NC2CC3(CC(NCc4nccs4)C3)C2)CC1	ZINC000964881277	1327747582	/nfs/dbraw/zinc/74/75/82/1327747582.db2.gz	PATHEQHGWJIFKQ-UHFFFAOYSA-N	0	3	345.512	3.407	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)C(C)(C)C2CC2)C1	ZINC001027539099	1327838667	/nfs/dbraw/zinc/83/86/67/1327838667.db2.gz	KRMKJPAEUZXRJY-IBGZPJMESA-N	0	3	339.483	3.417	20	30		EGEDHN
COc1ccc([C@H](NCCNc2ccc(C#N)cn2)C2CC2)c(F)c1	ZINC000927169355	1327905809	/nfs/dbraw/zinc/90/58/09/1327905809.db2.gz	YDTITWUKVFQGDE-LJQANCHMSA-N	0	3	340.402	3.254	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)[C@H](Cc2ccccc2)C(C)C)C1	ZINC001027571786	1327907158	/nfs/dbraw/zinc/90/71/58/1327907158.db2.gz	GURXNOAMUWWPOO-WOJBJXKFSA-N	0	3	326.484	3.057	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)c(F)c2)C1	ZINC001027604877	1327960736	/nfs/dbraw/zinc/96/07/36/1327960736.db2.gz	UDAOKCYKFIKIPJ-CRAIPNDOSA-N	0	3	345.462	3.412	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)C(C)(C)c2ccc(CC)cc2)C1	ZINC001027643144	1328018343	/nfs/dbraw/zinc/01/83/43/1328018343.db2.gz	GPKFRDNDEZCMCP-IBGZPJMESA-N	0	3	326.484	3.083	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1cc(F)cc(F)c1)C2	ZINC000965903369	1328093727	/nfs/dbraw/zinc/09/37/27/1328093727.db2.gz	VUWPNJVTOSXDAU-UHFFFAOYSA-N	0	3	340.801	3.348	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2c(F)c(F)cc(F)c2F)C1	ZINC000966260873	1328240375	/nfs/dbraw/zinc/24/03/75/1328240375.db2.gz	GFAOAQFSHSDTDJ-GXFFZTMASA-N	0	3	344.352	3.259	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)C2C3CC4CC(C3)CC2C4)C1	ZINC000966722868	1328392652	/nfs/dbraw/zinc/39/26/52/1328392652.db2.gz	MIVHXUMQPROGAK-PPHBOOHOSA-N	0	3	330.516	3.461	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](C)[C@H](NC(=O)c2nc3cccnc3s2)C1	ZINC000966750401	1328400425	/nfs/dbraw/zinc/40/04/25/1328400425.db2.gz	HQEVQTZASBYFPR-UKRRQHHQSA-N	0	3	344.484	3.098	20	30		EGEDHN
CN(CCCN(C)C(=O)Nc1sccc1C#N)Cc1ccco1	ZINC000931837928	1329765337	/nfs/dbraw/zinc/76/53/37/1329765337.db2.gz	RVCZAHZVSFLZLU-UHFFFAOYSA-N	0	3	332.429	3.199	20	30		EGEDHN
C[Si](C)(CCN1CCC[C@@H](C#N)C1)CCN1CCC[C@@H](C#N)C1	ZINC000932150335	1329789229	/nfs/dbraw/zinc/78/92/29/1329789229.db2.gz	BNGLUHCYPOWKCD-ROUUACIJSA-N	0	3	332.568	3.166	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@](C)(C2CC2)C(F)(F)F)CC1	ZINC000933593094	1329904616	/nfs/dbraw/zinc/90/46/16/1329904616.db2.gz	WTBCBHZPOGNNNU-HNNXBMFYSA-N	0	3	333.398	3.057	20	30		EGEDHN
C=C[C@H](CC)CC(=O)Nc1cccc2c1CCN(CC(C)(C)O)C2	ZINC000935348039	1330046630	/nfs/dbraw/zinc/04/66/30/1330046630.db2.gz	FIPGJKLMQGQHNL-OAHLLOKOSA-N	0	3	330.472	3.356	20	30		EGEDHN
C[C@@H](NCc1cc2c([nH]c1=O)CCCC2)c1ccc(OCC#N)cc1	ZINC000866640468	1330136986	/nfs/dbraw/zinc/13/69/86/1330136986.db2.gz	GRZNZSYQDXFESX-CQSZACIVSA-N	0	3	337.423	3.419	20	30		EGEDHN
CCN1CCN(c2cccc(NC(=O)c3ccccc3CC#N)c2)CC1	ZINC000867479678	1330205204	/nfs/dbraw/zinc/20/52/04/1330205204.db2.gz	ZPDZSWOIJYPKME-UHFFFAOYSA-N	0	3	348.450	3.147	20	30		EGEDHN
N#CCCCC[C@@H](N)C(=O)NCC1(c2cccc(Cl)c2)CCC1	ZINC000867992258	1330238304	/nfs/dbraw/zinc/23/83/04/1330238304.db2.gz	BRLNLERYMWBNIV-MRXNPFEDSA-N	0	3	333.863	3.289	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2occc2Cl)C[C@H]1NCc1ccc(C#N)s1	ZINC000939083234	1330372126	/nfs/dbraw/zinc/37/21/26/1330372126.db2.gz	KOQITVNKVZHATD-QMTHXVAHSA-N	0	3	349.843	3.116	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1C[C@H](NCc2ccc(C#N)c(F)c2)[C@@H](C)C1	ZINC001054699481	1349441538	/nfs/dbraw/zinc/44/15/38/1349441538.db2.gz	FYWWGYZCWQHLFP-KSSFIOAISA-N	0	3	345.462	3.316	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2coc3ccc(C)cc23)[C@H](C)C1	ZINC000942093256	1331826343	/nfs/dbraw/zinc/82/63/43/1331826343.db2.gz	ZCWPQWHTWHQVFF-VQIMIIECSA-N	0	3	338.451	3.134	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc(C)c(Cl)c2)[C@@H](C)C1	ZINC000942175674	1331861000	/nfs/dbraw/zinc/86/10/00/1331861000.db2.gz	JGZNBHOVLMYSEL-MAUKXSAKSA-N	0	3	332.875	3.041	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)cc2)CC[C@H]1NC(=O)C1(F)CCCC1	ZINC000942194381	1331873488	/nfs/dbraw/zinc/87/34/88/1331873488.db2.gz	ALZRXIKGOMEUGU-CRAIPNDOSA-N	0	3	343.446	3.167	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc(C)cc2Cl)[C@H](C)C1	ZINC000942193252	1331873495	/nfs/dbraw/zinc/87/34/95/1331873495.db2.gz	RZJZSUBFPCKYAC-CRAIPNDOSA-N	0	3	332.875	3.041	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2c(C)c(F)ccc2Cl)[C@H](C)C1	ZINC000942194172	1331873573	/nfs/dbraw/zinc/87/35/73/1331873573.db2.gz	ZSTVMXCLWYBMOI-WBMJQRKESA-N	0	3	336.838	3.251	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2CCc3ccccc3CC2)[C@@H](C)C1	ZINC000942208497	1331880309	/nfs/dbraw/zinc/88/03/09/1331880309.db2.gz	POTYJZMKGFEOOV-UWJYYQICSA-N	0	3	338.495	3.032	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2sc(C)nc2CC(C)C)[C@@H](C)C1	ZINC000942312890	1331900588	/nfs/dbraw/zinc/90/05/88/1331900588.db2.gz	CRKXCIRUZSHBMT-GOEBONIOSA-N	0	3	347.528	3.114	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(Cc3ccsc3)C[C@@H]2C)cc1	ZINC000942553064	1331970673	/nfs/dbraw/zinc/97/06/73/1331970673.db2.gz	MBMZUDBDCFKHKN-HNAYVOBHSA-N	0	3	338.476	3.370	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(Cc3cccnc3C)C[C@H]2C)cc1	ZINC000942554163	1331970797	/nfs/dbraw/zinc/97/07/97/1331970797.db2.gz	ZLIITQWVFOLPFU-IIBYNOLFSA-N	0	3	347.462	3.012	20	30		EGEDHN
Cc1coc(C(=O)N[C@@H]2CCN(Cc3cccc(C#N)c3)C[C@@H]2C)c1	ZINC000942565387	1331978399	/nfs/dbraw/zinc/97/83/99/1331978399.db2.gz	KWIOCZJTNUCFPM-MAUKXSAKSA-N	0	3	337.423	3.100	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3cccc(OC)c3)C[C@@H]2C)C1	ZINC000942608105	1332003867	/nfs/dbraw/zinc/00/38/67/1332003867.db2.gz	PNCJPMCAIFIWPA-QFBILLFUSA-N	0	3	342.483	3.378	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)oc2C(F)(F)F)[C@H](C)C1	ZINC000943207286	1332120683	/nfs/dbraw/zinc/12/06/83/1332120683.db2.gz	FYUKXRHAEFNUMK-RISCZKNCSA-N	0	3	342.361	3.070	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(F)c3ncccc3c2)[C@H](C)C1	ZINC000943648630	1332228942	/nfs/dbraw/zinc/22/89/42/1332228942.db2.gz	VLCQJGVIINVHNQ-DYVFJYSZSA-N	0	3	327.403	3.000	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2[nH]c3ccc(C)cc3c2C)[C@H](C)C1	ZINC000943813793	1332271503	/nfs/dbraw/zinc/27/15/03/1332271503.db2.gz	FKJNYNVROMZXAM-CRAIPNDOSA-N	0	3	337.467	3.248	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc3sccc3c2)[C@H](C)C1	ZINC000943818051	1332273647	/nfs/dbraw/zinc/27/36/47/1332273647.db2.gz	VKFXPZAPFKOBQB-RHSMWYFYSA-N	0	3	326.465	3.365	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)CC23CC4CC(CC(C4)C2)C3)[C@@H](C)C1	ZINC000944307284	1332369671	/nfs/dbraw/zinc/36/96/71/1332369671.db2.gz	XENPYXRRMPSAFD-VJRVKHOTSA-N	0	3	328.500	3.053	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(CC(C)C)cc2)[C@@H](C)C1	ZINC000944789215	1332424179	/nfs/dbraw/zinc/42/41/79/1332424179.db2.gz	KJLPVHGFFLVTPQ-PXNSSMCTSA-N	0	3	326.484	3.349	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3ccoc3Cl)CC[C@@H]2C1	ZINC000946565692	1332856075	/nfs/dbraw/zinc/85/60/75/1332856075.db2.gz	SRLQQGHCXDDHBW-BETUJISGSA-N	0	3	343.254	3.470	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@@H]3CCC[C@@H](F)C3)CC[C@@H]2C1	ZINC000946590908	1332859128	/nfs/dbraw/zinc/85/91/28/1332859128.db2.gz	KXYIDIAUOLGRCL-WCXIOVBPSA-N	0	3	342.886	3.438	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]3CN(Cc4ccns4)C[C@H]3CC2)C1	ZINC000946770323	1332896437	/nfs/dbraw/zinc/89/64/37/1332896437.db2.gz	LZHDDIQNKDBJMR-IYBDPMFKSA-N	0	3	345.512	3.170	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2cccs2)CCN1Cc1cccc(C#N)c1	ZINC000947018341	1332976185	/nfs/dbraw/zinc/97/61/85/1332976185.db2.gz	XDOQJEYOKUHIDQ-RHSMWYFYSA-N	0	3	339.464	3.403	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H]2CCN(Cc3cccc(C#N)c3)[C@H](C)C2)o1	ZINC000947027731	1332980898	/nfs/dbraw/zinc/98/08/98/1332980898.db2.gz	UMCVKRBDSCZKRL-KDOFPFPSSA-N	0	3	337.423	3.243	20	30		EGEDHN
Cc1ccoc1C(=O)N[C@H]1CCN(Cc2cccc(C#N)c2)[C@@H](C)C1	ZINC000947057326	1332993896	/nfs/dbraw/zinc/99/38/96/1332993896.db2.gz	QNMJBVYPAXNOIO-YJBOKZPZSA-N	0	3	337.423	3.243	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)C2CC(F)(F)C2)CCN1Cc1cccc(C#N)c1	ZINC000947169947	1333033831	/nfs/dbraw/zinc/03/38/31/1333033831.db2.gz	AQXLRSFDPORBDD-GUYCJALGSA-N	0	3	347.409	3.073	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2ccc(C#N)[nH]2)CCN1C/C=C/c1ccccc1	ZINC000947215878	1333053972	/nfs/dbraw/zinc/05/39/72/1333053972.db2.gz	BOWYACLFGNVZCM-QWYBNYMASA-N	0	3	348.450	3.182	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2c(F)c(F)cc(F)c2F)C[C@@H]1C	ZINC000947327502	1333090116	/nfs/dbraw/zinc/09/01/16/1333090116.db2.gz	DQSYZYZVRYYTSE-UWVGGRQHSA-N	0	3	330.325	3.012	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2coc3ccc(C)cc23)C[C@H]1C	ZINC000947356074	1333101154	/nfs/dbraw/zinc/10/11/54/1333101154.db2.gz	HETFOHDNYKQDEW-AEFFLSMTSA-N	0	3	338.451	3.276	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cncc(-c3ccccc3)c2)C[C@H]1C	ZINC000947371533	1333106981	/nfs/dbraw/zinc/10/69/81/1333106981.db2.gz	ZUJQBTWFLBRPND-DYESRHJHSA-N	0	3	347.462	3.355	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2C3CC4CC(C3)CC2C4)C[C@@H]1C	ZINC000947396525	1333114969	/nfs/dbraw/zinc/11/49/69/1333114969.db2.gz	WNQMILILQXOOCE-PPHBOOHOSA-N	0	3	328.500	3.051	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccnc(-c3ccco3)c2)C[C@H]1C	ZINC000947429287	1333124707	/nfs/dbraw/zinc/12/47/07/1333124707.db2.gz	GXOUWHAOZSLUIS-ZBFHGGJFSA-N	0	3	325.412	3.110	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)[C@@H](C)CC(C)(C)C)C[C@H]1C(F)(F)F	ZINC001112176200	1368701832	/nfs/dbraw/zinc/70/18/32/1368701832.db2.gz	TYXBTLYPMQPMCM-BFHYXJOUSA-N	0	3	332.410	3.061	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2c(C)cccc2Cl)C[C@H]1C	ZINC000947496453	1333146770	/nfs/dbraw/zinc/14/67/70/1333146770.db2.gz	BCQJBVUYRMNFRG-HZPDHXFCSA-N	0	3	332.875	3.183	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(CC(C)C)cc2)C[C@@H]1C	ZINC000947519821	1333155197	/nfs/dbraw/zinc/15/51/97/1333155197.db2.gz	JCAUQDBNOJSIPV-RXVVDRJESA-N	0	3	340.511	3.420	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cc3ccccc3s2)C[C@@H]1C	ZINC000947540750	1333165207	/nfs/dbraw/zinc/16/52/07/1333165207.db2.gz	YBMJXTBSUCGAEH-RDJZCZTQSA-N	0	3	340.492	3.436	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2nc3ccccc3cc2C)C[C@@H]1C	ZINC000947559121	1333172276	/nfs/dbraw/zinc/17/22/76/1333172276.db2.gz	GPIRRHQBFHJNET-FUHWJXTLSA-N	0	3	335.451	3.149	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C)c(Cl)c2F)C[C@@H]1C	ZINC000947569276	1333175183	/nfs/dbraw/zinc/17/51/83/1333175183.db2.gz	VFAIKQHVFWSARG-UONOGXRCSA-N	0	3	336.838	3.394	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(Cc3cnccc3C)[C@@H](C)C2)cc1	ZINC000947610772	1333191251	/nfs/dbraw/zinc/19/12/51/1333191251.db2.gz	CLLAVIWFVFHRQE-LAUBAEHRSA-N	0	3	347.462	3.154	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2oc3ccccc3c2OC)C[C@@H]1C	ZINC000947611885	1333192598	/nfs/dbraw/zinc/19/25/98/1333192598.db2.gz	ROOWLWSQAWLIAO-GJZGRUSLSA-N	0	3	340.423	3.047	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2c(C)[nH]c3ccccc32)C[C@@H]1C	ZINC000947669987	1333216384	/nfs/dbraw/zinc/21/63/84/1333216384.db2.gz	ASUYXVKKQYEXHA-RDJZCZTQSA-N	0	3	337.467	3.011	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)C2CC3(CC3)C2)CCN1Cc1cccc(C#N)c1	ZINC000947702290	1333231656	/nfs/dbraw/zinc/23/16/56/1333231656.db2.gz	LYRHFUGEOOZABY-DNVCBOLYSA-N	0	3	337.467	3.218	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C(F)F)c(F)c2)C[C@H]1C	ZINC000947720078	1333240207	/nfs/dbraw/zinc/24/02/07/1333240207.db2.gz	XKXHTORKWDUWMD-TZMCWYRMSA-N	0	3	338.373	3.369	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc(Cl)c(F)c2)C[C@@H]1C	ZINC000947750082	1333250356	/nfs/dbraw/zinc/25/03/56/1333250356.db2.gz	LOGOCHHVQNOUDU-DZGCQCFKSA-N	0	3	336.838	3.014	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C(C)(C)c2cccc(Cl)c2)C[C@H]1C	ZINC000947758247	1333253465	/nfs/dbraw/zinc/25/34/65/1333253465.db2.gz	KSEJTODGCQOPOD-RHSMWYFYSA-N	0	3	332.875	3.220	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C(C)(C)c2cccc(Cl)c2)C[C@H]1C	ZINC000947758246	1333253817	/nfs/dbraw/zinc/25/38/17/1333253817.db2.gz	KSEJTODGCQOPOD-PBHICJAKSA-N	0	3	332.875	3.220	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2cccc3sccc32)C[C@@H]1C	ZINC000947778408	1333258663	/nfs/dbraw/zinc/25/86/63/1333258663.db2.gz	CJVGVRQAGUPOND-DOTOQJQBSA-N	0	3	340.492	3.436	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccccc2OCC(C)C)C[C@@H]1C	ZINC000947818891	1333270269	/nfs/dbraw/zinc/27/02/69/1333270269.db2.gz	BPBXQVRDMMLTPF-DLBZAZTESA-N	0	3	330.472	3.490	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccccc2OCC(C)C)C[C@@H]1C	ZINC000947821228	1333271048	/nfs/dbraw/zinc/27/10/48/1333271048.db2.gz	RPJPXXUGJOMLCJ-ROUUACIJSA-N	0	3	342.483	3.327	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2)C[C@H]1C	ZINC000947962855	1333322687	/nfs/dbraw/zinc/32/26/87/1333322687.db2.gz	OWFBEJUYKIDYRM-IUODEOHRSA-N	0	3	326.362	3.474	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3ccccc3C)CCC2)C[C@@H]1C	ZINC000947974838	1333328566	/nfs/dbraw/zinc/32/85/66/1333328566.db2.gz	HJMJMUVDFUJRKO-RBUKOAKNSA-N	0	3	338.495	3.409	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3cc(C)cc(C)c3)CC2)C[C@H]1C	ZINC000948044382	1333351809	/nfs/dbraw/zinc/35/18/09/1333351809.db2.gz	QKGXNQQGGRJWIJ-UYAOXDASSA-N	0	3	338.495	3.327	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(OC3CCC3)cc2)C[C@H]1C	ZINC000948061817	1333360308	/nfs/dbraw/zinc/36/03/08/1333360308.db2.gz	ZPFORTUSVKQVEX-SJLPKXTDSA-N	0	3	340.467	3.224	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(Cl)cc3c2OCC3)C[C@H]1C	ZINC000948079130	1333368481	/nfs/dbraw/zinc/36/84/81/1333368481.db2.gz	UCRXKVJDYHISEL-IUODEOHRSA-N	0	3	334.847	3.044	20	30		EGEDHN
CN(C(=O)c1ccoc1)[C@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948185082	1333413692	/nfs/dbraw/zinc/41/36/92/1333413692.db2.gz	RAVXBWRMJZJRHL-IBGZPJMESA-N	0	3	337.423	3.278	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000948381174	1333503238	/nfs/dbraw/zinc/50/32/38/1333503238.db2.gz	GSIHXMBZPIRPGZ-CQSZACIVSA-N	0	3	338.373	3.323	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)[C@@H]2CCCc3ccccc32)CC1	ZINC000948547253	1333568301	/nfs/dbraw/zinc/56/83/01/1333568301.db2.gz	VEEZIKRKFMCGKC-TZIWHRDSSA-N	0	3	338.495	3.443	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2ccnc3ccccc32)CC1	ZINC000948597367	1333590216	/nfs/dbraw/zinc/59/02/16/1333590216.db2.gz	AHPYARSJBWDYPN-QGZVFWFLSA-N	0	3	335.451	3.185	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@@H]2CCCN(C[C@@H](F)CC)CC2)cc1	ZINC000948665725	1333620621	/nfs/dbraw/zinc/62/06/21/1333620621.db2.gz	QJMGLQKAAKTQSM-RBUKOAKNSA-N	0	3	330.447	3.343	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2ccc(C3CC3)nc2C)CC1	ZINC000948786219	1333678010	/nfs/dbraw/zinc/67/80/10/1333678010.db2.gz	VTSRDIMLFNRXMB-GOSISDBHSA-N	0	3	339.483	3.217	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)Cc2cccc3sccc32)CC1	ZINC000948829111	1333700988	/nfs/dbraw/zinc/70/09/88/1333700988.db2.gz	DQCXWXBFGYKIEJ-QGZVFWFLSA-N	0	3	340.492	3.390	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2ccc(-c3ccccc3)nc2)CC1	ZINC000948887145	1333719661	/nfs/dbraw/zinc/71/96/61/1333719661.db2.gz	WPWQAKKNBZOWEH-HXUWFJFHSA-N	0	3	347.462	3.308	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@@H]1CNC(=O)[C@@H]1CCCCO1	ZINC000948909947	1333729486	/nfs/dbraw/zinc/72/94/86/1333729486.db2.gz	FBDVMQCBARRYQU-PMACEKPBSA-N	0	3	342.483	3.237	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H](C)CC1CCCCC1)CCO2	ZINC000949202958	1333795365	/nfs/dbraw/zinc/79/53/65/1333795365.db2.gz	VTXICMKEOZZZHE-SFHVURJKSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H](CC)CC1CCCC1)CCO2	ZINC000949205475	1333796015	/nfs/dbraw/zinc/79/60/15/1333796015.db2.gz	URVAHWTZWIRMQS-LJQANCHMSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)c3cc(C)oc3C)CC2)C1	ZINC000949295344	1333817174	/nfs/dbraw/zinc/81/71/74/1333817174.db2.gz	DYVQZODLFDDJBG-UHFFFAOYSA-N	0	3	346.471	3.170	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)c3cscc3C)CC2)C1	ZINC000949332799	1333825573	/nfs/dbraw/zinc/82/55/73/1333825573.db2.gz	STVYGDFGVZJLRD-UHFFFAOYSA-N	0	3	348.512	3.330	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C[C@H]3C=CCCC3)CC2)C1	ZINC000949395627	1333836534	/nfs/dbraw/zinc/83/65/34/1333836534.db2.gz	XDLUMQSUMXIOGN-IBGZPJMESA-N	0	3	346.515	3.392	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@H]3CCC=CCCC3)CC2)C1	ZINC000949395658	1333836644	/nfs/dbraw/zinc/83/66/44/1333836644.db2.gz	YEGWOKWBJKWHIJ-IBGZPJMESA-N	0	3	346.515	3.392	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@]3(C)CCC[C@H]3C)CC2)C1	ZINC000949463127	1333854311	/nfs/dbraw/zinc/85/43/11/1333854311.db2.gz	KGEMQOPQRREAKF-IEBWSBKVSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@@H]3CCC(C)(C)C3)CC2)C1	ZINC000949466113	1333855393	/nfs/dbraw/zinc/85/53/93/1333855393.db2.gz	AFHKUZSBNDTPNF-QGZVFWFLSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C3(C(C)C)CC3)CC2)C1	ZINC000949468328	1333856394	/nfs/dbraw/zinc/85/63/94/1333856394.db2.gz	DZFGWTSQHHJYPB-UHFFFAOYSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@@H](C)c3cccs3)CC2)C1	ZINC000949470993	1333857373	/nfs/dbraw/zinc/85/73/73/1333857373.db2.gz	NHLHHRAGNDTFGN-INIZCTEOSA-N	0	3	348.512	3.121	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@@H](C)C3CCCC3)CC2)C1	ZINC000949509084	1333862972	/nfs/dbraw/zinc/86/29/72/1333862972.db2.gz	LARKQHMITOLETN-SFHVURJKSA-N	0	3	348.531	3.472	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2nc3ccccc3cc2C)C1	ZINC000967415977	1335731359	/nfs/dbraw/zinc/73/13/59/1335731359.db2.gz	YZJHAVWIXVQIIH-HNAYVOBHSA-N	0	3	335.451	3.007	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2cc3c(cc(C)cc3C)[nH]2)C1	ZINC000967463464	1335748486	/nfs/dbraw/zinc/74/84/86/1335748486.db2.gz	IDWVDQPCXANOAI-FOIQADDNSA-N	0	3	337.467	3.248	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2nc(Cl)sc2Cl)C1	ZINC000967720121	1335806794	/nfs/dbraw/zinc/80/67/94/1335806794.db2.gz	IQXXHJVLHUZZKN-ZJUUUORDSA-N	0	3	348.299	3.466	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC[C@@H](NC2c3ccccc3-c3ccccc32)C1	ZINC000967945307	1335832419	/nfs/dbraw/zinc/83/24/19/1335832419.db2.gz	VTIVHSBXWQXXSR-HUUCEWRRSA-N	0	3	331.419	3.107	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2ccc(F)c3ccncc23)C1	ZINC000967947798	1335832828	/nfs/dbraw/zinc/83/28/28/1335832828.db2.gz	YFDRYXIFBDSYOF-IFXJQAMLSA-N	0	3	341.430	3.390	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)Cc2c(C)cc(C)cc2C)C1	ZINC000968170976	1335865532	/nfs/dbraw/zinc/86/55/32/1335865532.db2.gz	ANGSTTGSLLWLTP-OXQOHEQNSA-N	0	3	326.484	3.004	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)C2(c3cccc(F)c3)CC2)C1	ZINC000968375047	1335909542	/nfs/dbraw/zinc/90/95/42/1335909542.db2.gz	QTBMPRBMVXAYFU-YJBOKZPZSA-N	0	3	330.447	3.260	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2cc(Cl)ccc2Cl)C1	ZINC000968584061	1335972899	/nfs/dbraw/zinc/97/28/99/1335972899.db2.gz	RWBICIQIVQGYNO-BLLLJJGKSA-N	0	3	339.266	3.457	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cn(-c2ccccc2)cn1	ZINC000968866137	1336072374	/nfs/dbraw/zinc/07/23/74/1336072374.db2.gz	BNXNEKFZYFHSRZ-SFHVURJKSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cc(C)n([C@@H](C)CC)n1	ZINC000968922887	1336090340	/nfs/dbraw/zinc/09/03/40/1336090340.db2.gz	HHFJHMUYOAZCSD-RDJZCZTQSA-N	0	3	332.492	3.323	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cc(C)n([C@H](C)CC)n1	ZINC000968922888	1336090513	/nfs/dbraw/zinc/09/05/13/1336090513.db2.gz	HHFJHMUYOAZCSD-WBVHZDCISA-N	0	3	332.492	3.323	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cnn(C(C)C)c1Cl	ZINC000968967829	1336104443	/nfs/dbraw/zinc/10/44/43/1336104443.db2.gz	BXSDNQOLHPKQSG-AWEZNQCLSA-N	0	3	338.883	3.278	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1cc2cc(C)ccc2[nH]1	ZINC000968977087	1336106967	/nfs/dbraw/zinc/10/69/67/1336106967.db2.gz	ODSZSBDDEQIARK-SFHVURJKSA-N	0	3	337.467	3.474	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cnc(C(C)C)nc1C	ZINC000969059702	1336133222	/nfs/dbraw/zinc/13/32/22/1336133222.db2.gz	QYEYIFJSWINNLA-MRXNPFEDSA-N	0	3	330.476	3.069	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1oc(C2CC2)nc1C	ZINC000969062510	1336135229	/nfs/dbraw/zinc/13/52/29/1336135229.db2.gz	NVHUEMOMHCQGSP-MRXNPFEDSA-N	0	3	331.460	3.411	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(C(=O)C[C@H]3C=CCCC3)C2)cc1F	ZINC000969063388	1336135465	/nfs/dbraw/zinc/13/54/65/1336135465.db2.gz	LMJAYOHKBHJPIX-MAUKXSAKSA-N	0	3	341.430	3.134	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)[C@H]1Cc2ccc(Cl)cc21	ZINC000969136467	1336157172	/nfs/dbraw/zinc/15/71/72/1336157172.db2.gz	NBCDTOCUAYLRNZ-HKUYNNGSSA-N	0	3	344.886	3.364	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cnn(C(C)(C)C)c1CC	ZINC000969144471	1336161331	/nfs/dbraw/zinc/16/13/31/1336161331.db2.gz	MHAZZNXWDRLGKS-MRXNPFEDSA-N	0	3	346.519	3.361	20	30		EGEDHN
C#CCCN1CCCCC[C@@H]1CNC(=O)c1cc(C2CCCC2)no1	ZINC000969147708	1336162305	/nfs/dbraw/zinc/16/23/05/1336162305.db2.gz	JRTUHICIQJBHNL-QGZVFWFLSA-N	0	3	343.471	3.330	20	30		EGEDHN
CC1(C)CCC[C@H]1C(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC000969622101	1336229760	/nfs/dbraw/zinc/22/97/60/1336229760.db2.gz	GWDIFRCNPFGRKA-SJORKVTESA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C1)c1cccs1	ZINC000969923470	1336261035	/nfs/dbraw/zinc/26/10/35/1336261035.db2.gz	KOMUVGUJFGOTJR-QWHCGFSZSA-N	0	3	345.493	3.175	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)c2cccc3c(C)c(C)[nH]c32)C1	ZINC000969986386	1336269521	/nfs/dbraw/zinc/26/95/21/1336269521.db2.gz	YSCQLHFUNTYWQT-OAHLLOKOSA-N	0	3	325.456	3.411	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)c2ccccc2OCC(C)C)C1	ZINC000970598748	1336326025	/nfs/dbraw/zinc/32/60/25/1336326025.db2.gz	ZBTLTSVIOPUMQN-INIZCTEOSA-N	0	3	330.472	3.348	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cc(C)n(C(CC)CC)n2)CC1	ZINC001005628062	1336384762	/nfs/dbraw/zinc/38/47/62/1336384762.db2.gz	AAEDTXJLTHREMK-UHFFFAOYSA-N	0	3	332.492	3.275	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cnc3c(F)cccc3c2)CC1	ZINC001005719135	1336397159	/nfs/dbraw/zinc/39/71/59/1336397159.db2.gz	MVMWDPRQDFKIIF-UHFFFAOYSA-N	0	3	341.430	3.486	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N(C)C1CCN(Cc2ccsc2)CC1	ZINC001006123124	1336455351	/nfs/dbraw/zinc/45/53/51/1336455351.db2.gz	KRHSRPGWCAIVSC-ROUUACIJSA-N	0	3	348.512	3.152	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cc3c(C)cccn3c2)CC1	ZINC001006285175	1336482637	/nfs/dbraw/zinc/48/26/37/1336482637.db2.gz	VFOFCTUWHORTEF-UHFFFAOYSA-N	0	3	325.456	3.360	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccc(COC)c(F)c2)CC1	ZINC001006336441	1336490794	/nfs/dbraw/zinc/49/07/94/1336490794.db2.gz	DPSNUMNPLHVLMD-UHFFFAOYSA-N	0	3	334.435	3.085	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CCCN(Cc2cccc(C)c2)C1	ZINC001007502442	1336659591	/nfs/dbraw/zinc/65/95/91/1336659591.db2.gz	JRDAQPVNUITSMK-IBGZPJMESA-N	0	3	337.467	3.377	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CCCN([C@@H](C)c3ccccc3C)C2)c1	ZINC001008469371	1336864514	/nfs/dbraw/zinc/86/45/14/1336864514.db2.gz	PRPXUUTTXUNBFP-FXAWDEMLSA-N	0	3	347.462	3.327	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)Cc2cccc(OCCC)c2)C1	ZINC001009124497	1336972929	/nfs/dbraw/zinc/97/29/29/1336972929.db2.gz	OTXAYPDWASQSHE-GOSISDBHSA-N	0	3	330.472	3.175	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2cnn(C3CCCC3)c2C)C1	ZINC001009140537	1336975284	/nfs/dbraw/zinc/97/52/84/1336975284.db2.gz	QHSXFORUZWLIBB-MRXNPFEDSA-N	0	3	330.476	3.077	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCN(Cc3cc(C)cc(C)c3)C2)cn1	ZINC001009267691	1336994349	/nfs/dbraw/zinc/99/43/49/1336994349.db2.gz	DKUXYEPICAMLCJ-NRFANRHFSA-N	0	3	347.462	3.074	20	30		EGEDHN
C#CCCN1CCC[C@H](NC(=O)CC23CC4CC(CC(C4)C2)C3)C1	ZINC001009319118	1337005970	/nfs/dbraw/zinc/00/59/70/1337005970.db2.gz	PRZDECNPGQUQTN-TWJKGYNYSA-N	0	3	328.500	3.197	20	30		EGEDHN
C=C(C)CN1CC[C@@H](NC(=O)[C@H]2C3CCC(CC3)[C@@H]2C(F)(F)F)C1	ZINC001014462334	1337787473	/nfs/dbraw/zinc/78/74/73/1337787473.db2.gz	RFDCGDBRJHJJOX-NCOXYXGASA-N	0	3	344.421	3.368	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CCN(Cc2c(C)cccc2C)C1	ZINC001014721617	1337883873	/nfs/dbraw/zinc/88/38/73/1337883873.db2.gz	FWWUAZSAMUGYNO-GOSISDBHSA-N	0	3	337.467	3.295	20	30		EGEDHN
C=C(C)CCN1CC[C@H](NC(=O)c2cnc(-c3ccccc3)o2)C1	ZINC001014839592	1337920143	/nfs/dbraw/zinc/92/01/43/1337920143.db2.gz	QVPGYPMLVPJNRZ-INIZCTEOSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N[C@H]1CCN(CC2=CCCCC2)C1	ZINC001015816358	1338325096	/nfs/dbraw/zinc/32/50/96/1338325096.db2.gz	KELKMFRTFHTBQB-FHWLQOOXSA-N	0	3	332.488	3.049	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@H]3NC(=O)[C@H]3[C@@H]4CCC[C@@H]43)CC2)c1	ZINC001016561648	1338646336	/nfs/dbraw/zinc/64/63/36/1338646336.db2.gz	BKIRKYOBDGHBOK-WCIQWLHISA-N	0	3	349.478	3.075	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N[C@@H]1CC12CCN(Cc1cccc(C#N)c1)CC2	ZINC001016577689	1338653887	/nfs/dbraw/zinc/65/38/87/1338653887.db2.gz	YOVNKDQHNBYXQT-QZTJIDSGSA-N	0	3	337.467	3.075	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)Cc2ccc(CCCC)cc2)CC1	ZINC001016707689	1338697459	/nfs/dbraw/zinc/69/74/59/1338697459.db2.gz	ZKBSGQAIQSEXQX-HXUWFJFHSA-N	0	3	338.495	3.176	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)[C@H](C)c2ccc(Cl)cc2)CC1	ZINC001016809063	1338733595	/nfs/dbraw/zinc/73/35/95/1338733595.db2.gz	UIAOJHYIPVNFIR-QAPCUYQASA-N	0	3	344.886	3.438	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC23CCN(Cc2oc(C)nc2C)CC3)C1	ZINC001016817995	1338736996	/nfs/dbraw/zinc/73/69/96/1338736996.db2.gz	QLOTWLXGXYKPQA-KRWDZBQOSA-N	0	3	343.471	3.118	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cccc(F)c2Cl)CC1	ZINC001016846610	1338745526	/nfs/dbraw/zinc/74/55/26/1338745526.db2.gz	DEICBFZDHZWHCB-HNNXBMFYSA-N	0	3	334.822	3.087	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)C(C)(C)c2cccc(Cl)c2)CC1	ZINC001016859108	1338749692	/nfs/dbraw/zinc/74/96/92/1338749692.db2.gz	LEQCUFNTNOKHIW-QGZVFWFLSA-N	0	3	344.886	3.222	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2cccc(-c3ccoc3)c2)CC1	ZINC001016916190	1338768838	/nfs/dbraw/zinc/76/88/38/1338768838.db2.gz	KSYHDGXBQPIMOK-IBGZPJMESA-N	0	3	334.419	3.164	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccc3c(c2)CCC=C3)CC1	ZINC001016930616	1338773416	/nfs/dbraw/zinc/77/34/16/1338773416.db2.gz	NEHLFVZINZQZIK-HXUWFJFHSA-N	0	3	334.463	3.254	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(Cl)c(Cl)c2)CC1	ZINC001016945300	1338779641	/nfs/dbraw/zinc/77/96/41/1338779641.db2.gz	XPLIWRSUMABEFK-HNNXBMFYSA-N	0	3	337.250	3.211	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2sccc2C2CC2)CC1	ZINC001016957998	1338784582	/nfs/dbraw/zinc/78/45/82/1338784582.db2.gz	GEEZOYPEUQZSQB-INIZCTEOSA-N	0	3	328.481	3.233	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC[C@@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001017055488	1338839210	/nfs/dbraw/zinc/83/92/10/1338839210.db2.gz	JWPXGGCXLYTYMI-CABCVRRESA-N	0	3	333.501	3.336	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H](CN(C)Cc2cccnc2)C1	ZINC001017177369	1338920610	/nfs/dbraw/zinc/92/06/10/1338920610.db2.gz	SFNMGXQMAUAQHO-GOSISDBHSA-N	0	3	329.488	3.354	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](CN(C)[C@@H](C)c2cnc(C)cn2)C1	ZINC001017179161	1338922553	/nfs/dbraw/zinc/92/25/53/1338922553.db2.gz	FEJQELXBMOGOCA-IRXDYDNUSA-N	0	3	344.503	3.229	20	30		EGEDHN
CC[C@H](F)C(=O)N1CCC[C@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001017183110	1338928326	/nfs/dbraw/zinc/92/83/26/1338928326.db2.gz	BIZVISXTEUURER-CJNGLKHVSA-N	0	3	337.464	3.038	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H](CN(C)Cc3ccc(F)cn3)C2)C1	ZINC001017205944	1338952287	/nfs/dbraw/zinc/95/22/87/1338952287.db2.gz	GIZFTZYSIGXLEW-MRXNPFEDSA-N	0	3	345.462	3.247	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(OC)c(F)c1	ZINC001017636434	1339379905	/nfs/dbraw/zinc/37/99/05/1339379905.db2.gz	PEDDLZZLIBGTRG-IYBDPMFKSA-N	0	3	332.419	3.089	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1n[nH]c2ccc(C)cc21	ZINC001017705617	1339395832	/nfs/dbraw/zinc/39/58/32/1339395832.db2.gz	CDIPKRYRJQRJHN-IYBDPMFKSA-N	0	3	338.455	3.126	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1csc(C(C)(C)C)n1	ZINC001018064953	1339493572	/nfs/dbraw/zinc/49/35/72/1339493572.db2.gz	MAISSTGPGMOWOE-IYBDPMFKSA-N	0	3	347.528	3.234	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H]1CCO[C@H](C(C)C)C1	ZINC001018157288	1339518132	/nfs/dbraw/zinc/51/81/32/1339518132.db2.gz	ODYACOGDVGQLNK-YRXWBPOGSA-N	0	3	334.504	3.079	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C12CC(C(F)(F)F)(C1)C2	ZINC001018309150	1339571411	/nfs/dbraw/zinc/57/14/11/1339571411.db2.gz	UBCOARVBNKIJQH-CBHXASLJSA-N	0	3	342.405	3.360	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC[C@H](NCc2ccccc2Oc2ccccc2)C1	ZINC001018617172	1339683355	/nfs/dbraw/zinc/68/33/55/1339683355.db2.gz	GAFXKUGUERQUSL-WMZOPIPTSA-N	0	3	349.434	3.329	20	30		EGEDHN
C#CCCN1CCC[C@H]1CNC(=O)c1ccccc1O[C@@H](C)CC	ZINC001028171318	1340466707	/nfs/dbraw/zinc/46/67/07/1340466707.db2.gz	FACLFDUWEVVKJV-IRXDYDNUSA-N	0	3	328.456	3.081	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NC[C@H]1CCCN1Cc1ccc(C)cc1	ZINC001028197295	1340480341	/nfs/dbraw/zinc/48/03/41/1340480341.db2.gz	DOKIQMXOONNEDQ-AABGKKOBSA-N	0	3	342.483	3.057	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1cnn(CCCC)c1CC	ZINC001028252107	1340512998	/nfs/dbraw/zinc/51/29/98/1340512998.db2.gz	DIBDYYKDZIXXKA-INIZCTEOSA-N	0	3	332.492	3.016	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCCN2[C@H](C)c2ccccc2)nc1	ZINC001028271325	1340524789	/nfs/dbraw/zinc/52/47/89/1340524789.db2.gz	FBHPNDVVYASYSS-VQIMIIECSA-N	0	3	333.435	3.018	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1cc(Cl)cc2c1OCC2	ZINC001028337043	1340574006	/nfs/dbraw/zinc/57/40/06/1340574006.db2.gz	GMEWDBJUOHYOOJ-OAHLLOKOSA-N	0	3	334.847	3.045	20	30		EGEDHN
C#CCCN1CCC[C@H]1CNC(=O)c1cc2cccc(Cl)c2o1	ZINC001028358533	1340592207	/nfs/dbraw/zinc/59/22/07/1340592207.db2.gz	XOEGYBBXSWJDRI-AWEZNQCLSA-N	0	3	330.815	3.304	20	30		EGEDHN
Cc1cc(C)c(C(=O)NC[C@@H]2CCN(Cc3ccc(C#N)cc3)C2)o1	ZINC001028461782	1340652491	/nfs/dbraw/zinc/65/24/91/1340652491.db2.gz	BTWNRQHGSYQLIR-SFHVURJKSA-N	0	3	337.423	3.020	20	30		EGEDHN
Cc1cscc1C(=O)NC[C@@H]1CCN(Cc2ccc(C#N)cc2)C1	ZINC001028469115	1340657792	/nfs/dbraw/zinc/65/77/92/1340657792.db2.gz	LGVOMZKQXVSSEU-KRWDZBQOSA-N	0	3	339.464	3.180	20	30		EGEDHN
Cc1cc(C(=O)NC[C@@H]2CCN(Cc3ccc(C#N)cc3)C2)oc1C	ZINC001028478761	1340665229	/nfs/dbraw/zinc/66/52/29/1340665229.db2.gz	SMIPTRUTQXXTJS-SFHVURJKSA-N	0	3	337.423	3.020	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H](CNC(=O)c3[nH]ccc3C3CC3)C2)c1	ZINC001028588436	1340716088	/nfs/dbraw/zinc/71/60/88/1340716088.db2.gz	FGJIVRAGZPSVIK-QGZVFWFLSA-N	0	3	348.450	3.016	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)c2ccccc2CC(C)(C)C)C1	ZINC001028618186	1340726547	/nfs/dbraw/zinc/72/65/47/1340726547.db2.gz	QGSZTVHHBXXKKV-KRWDZBQOSA-N	0	3	326.484	3.350	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CCN(Cc3c(C)noc3CC)C2)CC1	ZINC001028778213	1340810498	/nfs/dbraw/zinc/81/04/98/1340810498.db2.gz	DHRASPNRTYNYTF-MRXNPFEDSA-N	0	3	345.487	3.230	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H](CNC(=O)[C@@H]3CC34CCCC4)C2)c1	ZINC001028908432	1340881070	/nfs/dbraw/zinc/88/10/70/1340881070.db2.gz	MCCKQVNPQPCILK-OALUTQOASA-N	0	3	337.467	3.077	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)c2ccc(Cl)c(CCC)c2)C1	ZINC001028928956	1340885968	/nfs/dbraw/zinc/88/59/68/1340885968.db2.gz	USSQSTWHIXZFOE-HNNXBMFYSA-N	0	3	332.875	3.368	20	30		EGEDHN
CC(C)CC(=O)N1CCC([C@@H](C)NCc2cc(F)ccc2C#N)CC1	ZINC001029041184	1340915333	/nfs/dbraw/zinc/91/53/33/1340915333.db2.gz	JUEKDYKNQJIWGT-OAHLLOKOSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H]3CC[C@@H](C2)N3CC[C@@H]2CCCCO2)CC1	ZINC001029457568	1340994749	/nfs/dbraw/zinc/99/47/49/1340994749.db2.gz	OJDMVXSSRSCRSW-ZCNNSNEGSA-N	0	3	346.515	3.367	20	30		EGEDHN
C=C[C@@H](C(=O)N1C[C@H]2CC[C@@H](C1)N2C[C@H](CC)OC)c1ccccc1	ZINC001029594652	1341018204	/nfs/dbraw/zinc/01/82/04/1341018204.db2.gz	TUHKFJXKCFKPRP-ZGXWSNOMSA-N	0	3	342.483	3.056	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCN(C(=O)c2ccsc2)C1	ZINC001029638976	1341030019	/nfs/dbraw/zinc/03/00/19/1341030019.db2.gz	ASSJHUAEJOOMNZ-ZDUSSCGKSA-N	0	3	345.493	3.275	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](CN(C)Cc2c(C)noc2CC)C1	ZINC001029804991	1341079012	/nfs/dbraw/zinc/07/90/12/1341079012.db2.gz	XXVGANMQCNLVHB-HNNXBMFYSA-N	0	3	333.476	3.038	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCN(C(=O)C(C)(C)C2CC2)C1	ZINC001029813827	1341083635	/nfs/dbraw/zinc/08/36/35/1341083635.db2.gz	FGVNSJDTFMELEH-AWEZNQCLSA-N	0	3	345.512	3.336	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](CN(C)Cc3cnc(C)s3)C2)CC1	ZINC001029825774	1341087270	/nfs/dbraw/zinc/08/72/70/1341087270.db2.gz	HXWRTLAQZIDJCZ-MRXNPFEDSA-N	0	3	347.528	3.478	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](CN(C)Cc2ccc(F)cn2)C1	ZINC001029826303	1341087528	/nfs/dbraw/zinc/08/75/28/1341087528.db2.gz	OQHPAYOSHJUWAL-HNAYVOBHSA-N	0	3	333.451	3.103	20	30		EGEDHN
C#Cc1ccc(C(=O)NCC2CN(CCc3ccc(CC)cc3)C2)cc1	ZINC001031892354	1341417486	/nfs/dbraw/zinc/41/74/86/1341417486.db2.gz	YIOIMTTYUGDWOC-UHFFFAOYSA-N	0	3	346.474	3.135	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1c(C)nn(C(C)(C)C)c1C	ZINC001032433249	1341511001	/nfs/dbraw/zinc/51/10/01/1341511001.db2.gz	MIZJQCAPKPNOCS-IRXDYDNUSA-N	0	3	344.503	3.120	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cc2cc(F)ccc2[nH]1	ZINC001032553940	1341539067	/nfs/dbraw/zinc/53/90/67/1341539067.db2.gz	MXANHZARONLHRJ-HOTGVXAUSA-N	0	3	327.403	3.172	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H]2C[C@H]1CN2C[C@@H]1CCc2ccccc2C1	ZINC001032562229	1341540652	/nfs/dbraw/zinc/54/06/52/1341540652.db2.gz	NRNMZNLXMATEHQ-UXPWSPDFSA-N	0	3	338.495	3.289	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N1C[C@@H]2C[C@H]1CN2CCCC1CCC1	ZINC001032673334	1341578510	/nfs/dbraw/zinc/57/85/10/1341578510.db2.gz	LCEGFNFDBIVRFN-MUGJNUQGSA-N	0	3	346.515	3.223	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C[C@@H](C)c1ccccc1OC	ZINC001032737479	1341596005	/nfs/dbraw/zinc/59/60/05/1341596005.db2.gz	SHHBPXGQKAZZPF-SQNIBIBYSA-N	0	3	342.483	3.440	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)CC1C2CC3CC(C2)CC1C3	ZINC001032794210	1341615611	/nfs/dbraw/zinc/61/56/11/1341615611.db2.gz	PIFSJGODTXUOAP-LYSNUAOQSA-N	0	3	328.500	3.310	20	30		EGEDHN
CN(C(=O)c1c[nH]c(C#N)c1)[C@H]1CCN(Cc2ccc(C3CC3)cc2)C1	ZINC001033022284	1341698886	/nfs/dbraw/zinc/69/88/86/1341698886.db2.gz	HCOUTLUYVZTDNO-FQEVSTJZSA-N	0	3	348.450	3.110	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2ccc(C(C)C)nc2CC)C1	ZINC001033427410	1341822258	/nfs/dbraw/zinc/82/22/58/1341822258.db2.gz	BDDWOPJFRQCQPV-MRXNPFEDSA-N	0	3	329.488	3.490	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)Cc2csc(C(C)(C)C)n2)C1	ZINC001033515792	1341854901	/nfs/dbraw/zinc/85/49/01/1341854901.db2.gz	YRPHSDXTCTVHFH-HNNXBMFYSA-N	0	3	335.517	3.092	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)Cc2cccc(OC(C)C)c2)C1	ZINC001033698910	1341966026	/nfs/dbraw/zinc/96/60/26/1341966026.db2.gz	FRTMFAPNJHRHJP-SFHVURJKSA-N	0	3	330.472	3.125	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)C2CC(c3cccc(F)c3)C2)C1	ZINC001033714066	1341972549	/nfs/dbraw/zinc/97/25/49/1341972549.db2.gz	VDFLUBOOHBTPGQ-TVPLGVNVSA-N	0	3	330.447	3.428	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2oc3ccc(F)cc3c2C)C1	ZINC001033857145	1342047134	/nfs/dbraw/zinc/04/71/34/1342047134.db2.gz	ANDSVWGHMPSKNQ-INIZCTEOSA-N	0	3	342.414	3.440	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@H]2CCN(C)c3ccccc32)C1	ZINC001033861257	1342049548	/nfs/dbraw/zinc/04/95/48/1342049548.db2.gz	FJPJLMDFNRVXRB-HKUYNNGSSA-N	0	3	341.499	3.109	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2coc3cc(F)ccc23)C1	ZINC001033880649	1342057271	/nfs/dbraw/zinc/05/72/71/1342057271.db2.gz	YGHMNYBEJQPZLZ-OAHLLOKOSA-N	0	3	328.387	3.132	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cnc3ccsc3c2)C1	ZINC001033920743	1342089478	/nfs/dbraw/zinc/08/94/78/1342089478.db2.gz	VIODNRWKYGWHNT-OAHLLOKOSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cc3ccccc3n2C)C1	ZINC001033941424	1342103764	/nfs/dbraw/zinc/10/37/64/1342103764.db2.gz	GQZIIKPKEOJIBA-QGZVFWFLSA-N	0	3	325.456	3.291	20	30		EGEDHN
C#Cc1ccc(C(=O)N(CC)[C@H]2CCN(Cc3cccc(C)c3)C2)cn1	ZINC001034022395	1342160148	/nfs/dbraw/zinc/16/01/48/1342160148.db2.gz	HRMFFTUEVBKLAP-NRFANRHFSA-N	0	3	347.462	3.108	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@H]2Cc3cc(C)c(C)cc3O2)C1	ZINC001034047774	1342187538	/nfs/dbraw/zinc/18/75/38/1342187538.db2.gz	KHXKKQMKTWNSMJ-UYAOXDASSA-N	0	3	342.483	3.106	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cnn(CC(C)C)c2CC)C1	ZINC001034205448	1342316292	/nfs/dbraw/zinc/31/62/92/1342316292.db2.gz	WSCNPORCTMRMMG-QGZVFWFLSA-N	0	3	346.519	3.262	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2csc([C@H](C)OC)n2)C1	ZINC001034212635	1342321498	/nfs/dbraw/zinc/32/14/98/1342321498.db2.gz	ZJPAXDREXYQPIR-KBPBESRZSA-N	0	3	337.489	3.011	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@H]2CCc3cc(OC)ccc32)C1	ZINC001034233425	1342336433	/nfs/dbraw/zinc/33/64/33/1342336433.db2.gz	DICQIIMPSZRSLC-XLIONFOSSA-N	0	3	342.483	3.272	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)C2CCc3ccccc3CC2)C1	ZINC001034278358	1342368671	/nfs/dbraw/zinc/36/86/71/1342368671.db2.gz	HQGIZSXTWZAAPN-HXUWFJFHSA-N	0	3	326.484	3.338	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cc(C)n([C@@H](C)CC)n2)C1	ZINC001034281789	1342371074	/nfs/dbraw/zinc/37/10/74/1342371074.db2.gz	KIXMNMNXDUNYLN-DOTOQJQBSA-N	0	3	332.492	3.323	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)C[C@@H]2C[C@H]2Cc2ccccc2)C1	ZINC001034318584	1342395893	/nfs/dbraw/zinc/39/58/93/1342395893.db2.gz	IBIQCARTXOYHBV-AABGKKOBSA-N	0	3	326.484	3.412	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc3c(c2)[C@@H](C)CO3)C1	ZINC001034357875	1342429208	/nfs/dbraw/zinc/42/92/08/1342429208.db2.gz	FLTBPPUIGUUUME-DOTOQJQBSA-N	0	3	328.456	3.343	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cc(F)c(F)cc2F)C1	ZINC001034371006	1342440918	/nfs/dbraw/zinc/44/09/18/1342440918.db2.gz	DLNJRCSGHKFNPH-GFCCVEGCSA-N	0	3	326.362	3.264	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cn(CC)nc2C(C)C)C1	ZINC001034422668	1342484425	/nfs/dbraw/zinc/48/44/25/1342484425.db2.gz	XLGVHRGZRGAJGV-MRXNPFEDSA-N	0	3	332.492	3.187	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)C2(c3cccc(OC)c3)CC2)C1	ZINC001034423797	1342485471	/nfs/dbraw/zinc/48/54/71/1342485471.db2.gz	KZJYRGVRNOVPQP-GOSISDBHSA-N	0	3	342.483	3.274	20	30		EGEDHN
C=CCCN1CCCC[C@H](NC(=O)c2cnc([C@@H]3CCCO3)s2)C1	ZINC001034430812	1342492191	/nfs/dbraw/zinc/49/21/91/1342492191.db2.gz	AJXSZMRPCBYHSA-GJZGRUSLSA-N	0	3	349.500	3.155	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccn(C(CC)CC)n2)C1	ZINC001034430420	1342492911	/nfs/dbraw/zinc/49/29/11/1342492911.db2.gz	FAYPPPPQGSJICH-MRXNPFEDSA-N	0	3	332.492	3.405	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)Cn2cc(C)c3ccccc32)C1	ZINC001034437151	1342499448	/nfs/dbraw/zinc/49/94/48/1342499448.db2.gz	WGGYGKMZAGTXHG-GOSISDBHSA-N	0	3	339.483	3.497	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)Cc2c[nH]c3cc(C)ccc23)C1	ZINC001034439959	1342501297	/nfs/dbraw/zinc/50/12/97/1342501297.db2.gz	RXLTUOQBYBSWEC-QGZVFWFLSA-N	0	3	325.456	3.176	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc(-c3cn[nH]c3)cc2)C1	ZINC001034440224	1342502422	/nfs/dbraw/zinc/50/24/22/1342502422.db2.gz	SRCMTFXLOSFURZ-LJQANCHMSA-N	0	3	338.455	3.237	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)[C@]2(C)CCCc3ccccc32)C1	ZINC001034441660	1342503759	/nfs/dbraw/zinc/50/37/59/1342503759.db2.gz	GYDSEDLCISPYOF-WIYYLYMNSA-N	0	3	326.484	3.437	20	30		EGEDHN
C=C(C)CCN1CCCC[C@@H](NC(=O)c2snnc2C(C)C)C1	ZINC001034454135	1342512997	/nfs/dbraw/zinc/51/29/97/1342512997.db2.gz	SKDKIUZVGPDDGZ-CQSZACIVSA-N	0	3	336.505	3.212	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccnc(C(F)(F)F)c2)C1	ZINC001034471649	1342526520	/nfs/dbraw/zinc/52/65/20/1342526520.db2.gz	JNOBPQPDPHPDFD-AWEZNQCLSA-N	0	3	341.377	3.261	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)Cc2coc3cc(C)ccc23)C1	ZINC001034514147	1342573325	/nfs/dbraw/zinc/57/33/25/1342573325.db2.gz	GKLMKZVTDJEILX-QGZVFWFLSA-N	0	3	326.440	3.440	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@H]2Cc3cc(C)c(C)cc3O2)C1	ZINC001034540743	1342600291	/nfs/dbraw/zinc/60/02/91/1342600291.db2.gz	JJFSKWDDVDJLCS-UYAOXDASSA-N	0	3	342.483	3.154	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)c2ccccc2)CC1	ZINC001034584592	1342630101	/nfs/dbraw/zinc/63/01/01/1342630101.db2.gz	VJIGWIVGDAPHOH-SHTZXODSSA-N	0	3	337.261	3.226	20	30		EGEDHN
C[C@H]1C[C@H]1C(=O)NCc1ccc(CNCc2ccc(C#N)cc2)cc1	ZINC001034807298	1342772776	/nfs/dbraw/zinc/77/27/76/1342772776.db2.gz	ODLRDTFGDSJOTF-MGPUTAFESA-N	0	3	333.435	3.120	20	30		EGEDHN
N#Cc1cccc(CNCc2ccc(CNC(=O)c3cc[nH]c3)cc2)c1	ZINC001034817453	1342781373	/nfs/dbraw/zinc/78/13/73/1342781373.db2.gz	HXCKTVSCXCNNFV-UHFFFAOYSA-N	0	3	344.418	3.106	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)C2CCCCC2)cc1F	ZINC001034847058	1342800115	/nfs/dbraw/zinc/80/01/15/1342800115.db2.gz	HGPSGIPAWRHVIZ-GOSISDBHSA-N	0	3	343.446	3.358	20	30		EGEDHN
CC(C)(C)CC(=O)N1CCC[C@@H]1CNCc1ccc(C#N)c(F)c1	ZINC001034860863	1342809999	/nfs/dbraw/zinc/80/99/99/1342809999.db2.gz	CDHXSXJNGPNXLF-MRXNPFEDSA-N	0	3	331.435	3.214	20	30		EGEDHN
C/C(=C/C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)s1)C1CC1	ZINC001034873785	1342816188	/nfs/dbraw/zinc/81/61/88/1342816188.db2.gz	NVHMKCCJLJZAKX-UZGISAJGSA-N	0	3	329.469	3.057	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC[C@@H]1CNCc1scnc1C	ZINC001034947015	1342847815	/nfs/dbraw/zinc/84/78/15/1342847815.db2.gz	KEKBQMOUBJWZBO-CYBMUJFWSA-N	0	3	341.908	3.311	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)C2(F)CCCC2)cc1F	ZINC001034977824	1342862887	/nfs/dbraw/zinc/86/28/87/1342862887.db2.gz	APNDTJIBWXKQPF-MRXNPFEDSA-N	0	3	347.409	3.060	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2scnc2Cl)C12CCC2	ZINC001078812696	1357093972	/nfs/dbraw/zinc/09/39/72/1357093972.db2.gz	OKXXRUJNCCRVHI-ZJUUUORDSA-N	0	3	346.283	3.180	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2scnc2Cl)C12CCC2	ZINC001078812695	1357094017	/nfs/dbraw/zinc/09/40/17/1357094017.db2.gz	OKXXRUJNCCRVHI-VHSXEESVSA-N	0	3	346.283	3.180	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)s1	ZINC001035036205	1342889661	/nfs/dbraw/zinc/88/96/61/1342889661.db2.gz	YHQMASFUSMVIMO-KDOFPFPSSA-N	0	3	331.485	3.303	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC2(CCN(Cc3ccccc3C#N)C2)CC1	ZINC001035173339	1342990589	/nfs/dbraw/zinc/99/05/89/1342990589.db2.gz	YCROICNIBRJFJV-IJUHEHPCSA-N	0	3	337.467	3.339	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCC2(CCN(C/C=C/Cl)C2)CC1	ZINC001035194534	1343009022	/nfs/dbraw/zinc/00/90/22/1343009022.db2.gz	QMNPJUISMQCBTQ-RUDMXATFSA-N	0	3	347.890	3.355	20	30		EGEDHN
CCc1cccc(CN2CC3(C2)CCN(C(=O)C#CC2CC2)CC3)c1	ZINC001035701809	1343142558	/nfs/dbraw/zinc/14/25/58/1343142558.db2.gz	BDQCAGAJFZNBJA-UHFFFAOYSA-N	0	3	336.479	3.087	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)CO[C@@H]1CCCC[C@H]1CC)CC2	ZINC001035704188	1343143379	/nfs/dbraw/zinc/14/33/79/1343143379.db2.gz	ZDRXMNAACFGGBK-RTBURBONSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C[C@H]1CCC[C@@H](OC)C1)CC2	ZINC001035722760	1343152882	/nfs/dbraw/zinc/15/28/82/1343152882.db2.gz	OCIQDTOGCADKIQ-ZWKOTPCHSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc(Cl)cc1OC)CC2	ZINC001035778293	1343188796	/nfs/dbraw/zinc/18/87/96/1343188796.db2.gz	JSMCAMIWOAGMPN-UHFFFAOYSA-N	0	3	348.874	3.463	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC3(CN(C[C@H]4CCCCO4)C3)CC2)CC1	ZINC001035786748	1343198599	/nfs/dbraw/zinc/19/85/99/1343198599.db2.gz	IENNNOZPCIHFKZ-LJQANCHMSA-N	0	3	346.515	3.226	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC3(CN(C[C@H]4CC(C)(C)CO4)C3)CC2)C1	ZINC001035788329	1343200145	/nfs/dbraw/zinc/20/01/45/1343200145.db2.gz	DVFKNMICOIXSMF-QGZVFWFLSA-N	0	3	346.515	3.082	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc(C3CC3)nc1C)CC2	ZINC001035797934	1343203897	/nfs/dbraw/zinc/20/38/97/1343203897.db2.gz	HEDDCZZFYSOUTR-UHFFFAOYSA-N	0	3	339.483	3.382	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc(F)c(F)c(F)c1)CC2	ZINC001035802153	1343205103	/nfs/dbraw/zinc/20/51/03/1343205103.db2.gz	FJPGNGWPMZETFY-UHFFFAOYSA-N	0	3	338.373	3.218	20	30		EGEDHN
C[C@H]1CN(C(=O)C#CC2CC2)CC[C@H]1NCc1c(F)cccc1Cl	ZINC001036020240	1343308621	/nfs/dbraw/zinc/30/86/21/1343308621.db2.gz	CBJPMZJRCKAMGY-SCLBCKFNSA-N	0	3	348.849	3.219	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](NCc2csc(C)n2)[C@@H](C)C1	ZINC001036140143	1343325104	/nfs/dbraw/zinc/32/51/04/1343325104.db2.gz	BLQFVXJVEYGQET-BBRMVZONSA-N	0	3	335.517	3.380	20	30		EGEDHN
CCC1(C(=O)N2CC[C@H](NCc3ccccc3C#N)[C@H](C)C2)CCC1	ZINC001036160368	1343336313	/nfs/dbraw/zinc/33/63/13/1343336313.db2.gz	VGRAFWAXRBJKOY-APWZRJJASA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@@H]([C@H](C)NCc3cnns3)C2)CC1	ZINC001036431672	1343483360	/nfs/dbraw/zinc/48/33/60/1343483360.db2.gz	UQRNISMIKOKZJG-GOEBONIOSA-N	0	3	348.516	3.001	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]([C@@H](C)NCc3cnc(C)o3)C2)C1	ZINC001036440552	1343489131	/nfs/dbraw/zinc/48/91/31/1343489131.db2.gz	ABVVQMKKURJLGS-ZBFHGGJFSA-N	0	3	331.460	3.056	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@@H](C)[C@H]1CNCc1ccc(C#N)cc1F	ZINC001036496592	1343518007	/nfs/dbraw/zinc/51/80/07/1343518007.db2.gz	YUMFUCGDAIURHS-DNVCBOLYSA-N	0	3	345.462	3.460	20	30		EGEDHN
O=C(c1ccccc1)N1CC[C@H]2[C@@H](CCN2CC#Cc2ccccc2)C1	ZINC001036627245	1343584899	/nfs/dbraw/zinc/58/48/99/1343584899.db2.gz	JRHMFQUXYXDONN-VXKWHMMOSA-N	0	3	344.458	3.275	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccc(C#N)c(F)c2)C1	ZINC001036628180	1343585281	/nfs/dbraw/zinc/58/52/81/1343585281.db2.gz	WYPPHQZXXHFTNP-IEBWSBKVSA-N	0	3	343.446	3.166	20	30		EGEDHN
Cc1occc1C(=O)N1CC[C@@H]2[C@@H](CCN2CC#Cc2ccccc2)C1	ZINC001036639025	1343594487	/nfs/dbraw/zinc/59/44/87/1343594487.db2.gz	NKIMKXWQAAKHNP-PZJWPPBQSA-N	0	3	348.446	3.176	20	30		EGEDHN
CC(C)(C)CC(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccccc2C#N)C1	ZINC001036641857	1343595338	/nfs/dbraw/zinc/59/53/38/1343595338.db2.gz	HRDVWSYUDPGONB-RBUKOAKNSA-N	0	3	339.483	3.417	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CN(C(=O)/C=C/C4CC4)CC[C@@H]32)s1	ZINC001036677562	1343617883	/nfs/dbraw/zinc/61/78/83/1343617883.db2.gz	DJXCGCGVMGMLCI-ZPIOIWFZSA-N	0	3	341.480	3.009	20	30		EGEDHN
C/C=C(\C)C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccc(C#N)cc2F)C1	ZINC001036682870	1343625684	/nfs/dbraw/zinc/62/56/84/1343625684.db2.gz	KQTWFYKUEVDYCO-WAELIVTPSA-N	0	3	341.430	3.086	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3CN(C(=O)C4=CCCC4)CC[C@H]32)s1	ZINC001036686168	1343628778	/nfs/dbraw/zinc/62/87/78/1343628778.db2.gz	JWXTUVNEZLWIAR-MAUKXSAKSA-N	0	3	341.480	3.153	20	30		EGEDHN
CC(C(=O)N1CC[C@H]2[C@@H](CCN2CC#Cc2ccccc2)C1)=C1CCC1	ZINC001036714269	1343647561	/nfs/dbraw/zinc/64/75/61/1343647561.db2.gz	VKGZOMVCINKOAZ-VXKWHMMOSA-N	0	3	348.490	3.461	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2[C@@H](CCN2Cc2oc(C)nc2C)C1	ZINC001036793873	1343725406	/nfs/dbraw/zinc/72/54/06/1343725406.db2.gz	MIMKNKZTKYPMNV-IRXDYDNUSA-N	0	3	345.487	3.317	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2[C@H](CCN2Cc2ocnc2C)C1	ZINC001036794503	1343726551	/nfs/dbraw/zinc/72/65/51/1343726551.db2.gz	WFZTTXYVNSOCPN-CVEARBPZSA-N	0	3	331.460	3.008	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2[C@@H](CCN2Cc2conc2CC)C1	ZINC001036794266	1343726567	/nfs/dbraw/zinc/72/65/67/1343726567.db2.gz	RSTOOXWUAVOKOJ-YJBOKZPZSA-N	0	3	345.487	3.262	20	30		EGEDHN
Cc1cc(C(=O)N[C@H]2CCC[C@@H]2CNCc2ccccc2C#N)co1	ZINC001036995061	1343916771	/nfs/dbraw/zinc/91/67/71/1343916771.db2.gz	ZVZPITFCHWMPAV-MJGOQNOKSA-N	0	3	337.423	3.148	20	30		EGEDHN
CC(C)(F)C(=O)N[C@@H]1CCCC[C@H]1CNCc1cc(F)ccc1C#N	ZINC001037155430	1344006637	/nfs/dbraw/zinc/00/66/37/1344006637.db2.gz	IQTFSEQKPIXJHZ-WMLDXEAASA-N	0	3	349.425	3.210	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCCC[C@H]2CNCc2ocnc2C)C1	ZINC001037242937	1344064418	/nfs/dbraw/zinc/06/44/18/1344064418.db2.gz	SXIAGNTVPTTXFQ-HOTGVXAUSA-N	0	3	331.460	3.104	20	30		EGEDHN
CC[C@H]1CN(C(=O)C2CCC2)CC[C@H]1NCc1cc(F)ccc1C#N	ZINC001037760973	1344075509	/nfs/dbraw/zinc/07/55/09/1344075509.db2.gz	XTOQQVKUXDJBCL-IFXJQAMLSA-N	0	3	343.446	3.214	20	30		EGEDHN
CC[C@H]1CN(C(=O)C(C)(C)F)CC[C@@H]1NCc1cc(F)ccc1C#N	ZINC001037760659	1344075640	/nfs/dbraw/zinc/07/56/40/1344075640.db2.gz	HIQLMLRLGHGSND-GUYCJALGSA-N	0	3	349.425	3.162	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@@H]1CCN1CCCc1ccccc1	ZINC001038343895	1344388544	/nfs/dbraw/zinc/38/85/44/1344388544.db2.gz	CYRDINPJSFOOQT-IBGZPJMESA-N	0	3	337.467	3.111	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)[C@@H]1CCCO[C@H]1c1ccccc1	ZINC001038353657	1344394327	/nfs/dbraw/zinc/39/43/27/1344394327.db2.gz	HAXOIVFVBBGGTC-AQNXPRMDSA-N	0	3	342.483	3.311	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CCN2C[C@@H](OC)C2CCCC2)CC1	ZINC001038667859	1344532069	/nfs/dbraw/zinc/53/20/69/1344532069.db2.gz	QBWHJXJTOKBTER-RBUKOAKNSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1cnoc1-c1ccccc1	ZINC001038860998	1344616533	/nfs/dbraw/zinc/61/65/33/1344616533.db2.gz	IKBXIIUUJHYVHL-INIZCTEOSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1cnn(C(C)C)c1C1CC1	ZINC001038898284	1344639606	/nfs/dbraw/zinc/63/96/06/1344639606.db2.gz	YEMUHGHQBJWCHX-INIZCTEOSA-N	0	3	330.476	3.112	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1ccc(C(F)(F)F)cc1	ZINC001038944883	1344668381	/nfs/dbraw/zinc/66/83/81/1344668381.db2.gz	JVQFUNQEOWUIRX-OAHLLOKOSA-N	0	3	326.362	3.476	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C2(C)CC=CC2)CC[C@H]1c1ccc(F)cc1	ZINC001079157827	1357198435	/nfs/dbraw/zinc/19/84/35/1357198435.db2.gz	DAIAGNRTAJIYFT-RBUKOAKNSA-N	0	3	340.442	3.089	20	30		EGEDHN
CCC(=O)N1CCCC[C@@H]1[C@@H]1CCN(Cc2ccc(C#N)s2)C1	ZINC001039181651	1344878699	/nfs/dbraw/zinc/87/86/99/1344878699.db2.gz	YWGBZMZCYSYLMH-RHSMWYFYSA-N	0	3	331.485	3.233	20	30		EGEDHN
C=CCC[N@H+]1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001039194186	1344901297	/nfs/dbraw/zinc/90/12/97/1344901297.db2.gz	VMGYTQBNYZYGHM-WMZOPIPTSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=CCC[N@@H+]1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001039194186	1344901299	/nfs/dbraw/zinc/90/12/99/1344901299.db2.gz	VMGYTQBNYZYGHM-WMZOPIPTSA-N	0	3	328.456	3.285	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(C)c(C)o2)C1	ZINC001039197452	1344906569	/nfs/dbraw/zinc/90/65/69/1344906569.db2.gz	OKBMEIWOBRHIRY-MSOLQXFVSA-N	0	3	328.456	3.236	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cccc(F)c2)C1	ZINC001039207280	1344918891	/nfs/dbraw/zinc/91/88/91/1344918891.db2.gz	ZBOJARNLAZVILU-IEBWSBKVSA-N	0	3	328.431	3.166	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc(C)cc(C)n2)C1	ZINC001039210483	1344924370	/nfs/dbraw/zinc/92/43/70/1344924370.db2.gz	AVVKMCUUVFRJSZ-AZUAARDMSA-N	0	3	339.483	3.038	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)CCc2ccsc2)C1	ZINC001039214958	1344930660	/nfs/dbraw/zinc/93/06/60/1344930660.db2.gz	RFYACAKHLUPUFV-MOPGFXCFSA-N	0	3	344.524	3.407	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2c(C)oc(C)c2C)C1	ZINC001039216476	1344933248	/nfs/dbraw/zinc/93/32/48/1344933248.db2.gz	PGDHBEFWWVUWQI-ZWKOTPCHSA-N	0	3	328.456	3.155	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2c[nH]c3ccccc23)C1	ZINC001039217446	1344934188	/nfs/dbraw/zinc/93/41/88/1344934188.db2.gz	HBSQBFYGUQNWOP-OXQOHEQNSA-N	0	3	335.451	3.118	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2nc(C)sc2C)C1	ZINC001039219987	1344938021	/nfs/dbraw/zinc/93/80/21/1344938021.db2.gz	WKMCWVSYVSPASH-IAGOWNOFSA-N	0	3	345.512	3.100	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc3ccc(C)cc3[nH]2)C1	ZINC001039226008	1344944370	/nfs/dbraw/zinc/94/43/70/1344944370.db2.gz	RHBWSTHVVOCFLD-NQIIRXRSSA-N	0	3	349.478	3.426	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)Cc2cccc(C)c2)C1	ZINC001039225704	1344944600	/nfs/dbraw/zinc/94/46/00/1344944600.db2.gz	QMQCPQWMTZBXLI-SFTDATJTSA-N	0	3	338.495	3.264	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccc(C(C)C)cn2)C1	ZINC001039235345	1344956135	/nfs/dbraw/zinc/95/61/35/1344956135.db2.gz	WRTPEKVNAYOCEQ-AZUAARDMSA-N	0	3	339.483	3.155	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc3ccccn3c2)C1	ZINC001039235822	1344957211	/nfs/dbraw/zinc/95/72/11/1344957211.db2.gz	RGJOUCGDPDEZCZ-WIYYLYMNSA-N	0	3	349.478	3.279	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cccc3[nH]ccc32)C1	ZINC001039240869	1344966415	/nfs/dbraw/zinc/96/64/15/1344966415.db2.gz	ZZSOPPHKOZNBOE-UZLBHIALSA-N	0	3	335.451	3.118	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)Cc2ccc(F)cc2)C1	ZINC001039248285	1344978046	/nfs/dbraw/zinc/97/80/46/1344978046.db2.gz	AXXJATVSFQWXQD-ICSRJNTNSA-N	0	3	342.458	3.095	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)Cc2ccc(F)cc2)C1	ZINC001039248286	1344978069	/nfs/dbraw/zinc/97/80/69/1344978069.db2.gz	AXXJATVSFQWXQD-QUCCMNQESA-N	0	3	342.458	3.095	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)Cc2ccc(C)s2)C1	ZINC001039250407	1344981193	/nfs/dbraw/zinc/98/11/93/1344981193.db2.gz	KHNUYBPDPGLQOR-IEBWSBKVSA-N	0	3	344.524	3.325	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)Cc2cc(C)ccc2F)C1	ZINC001039256055	1344986216	/nfs/dbraw/zinc/98/62/16/1344986216.db2.gz	HPGHGHWHMVKKNQ-PXNSSMCTSA-N	0	3	342.458	3.013	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1sccc1CN(C)C	ZINC001039382880	1345037106	/nfs/dbraw/zinc/03/71/06/1345037106.db2.gz	OSQSYVINITUPPB-SJORKVTESA-N	0	3	347.528	3.065	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccc(Cl)c1F	ZINC001039426994	1345063164	/nfs/dbraw/zinc/06/31/64/1345063164.db2.gz	BJXYMZWMZXZUQH-KGLIPLIRSA-N	0	3	334.822	3.181	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)OC1CCCCCC1	ZINC001039432541	1345065266	/nfs/dbraw/zinc/06/52/66/1345065266.db2.gz	BJEGJYGLDCXUJT-QRVBRYPASA-N	0	3	346.515	3.203	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(OCC)c(C)c1	ZINC001039446680	1345071175	/nfs/dbraw/zinc/07/11/75/1345071175.db2.gz	PRZAFHSRKRPAGF-MOPGFXCFSA-N	0	3	340.467	3.096	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(Cl)ccc1C	ZINC001039454274	1345076523	/nfs/dbraw/zinc/07/65/23/1345076523.db2.gz	SYLMWWMEXYJNJE-SJORKVTESA-N	0	3	330.859	3.351	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)COc1ccc(Cl)cc1	ZINC001039465741	1345083329	/nfs/dbraw/zinc/08/33/29/1345083329.db2.gz	XUFATVKYUVHLQD-SJORKVTESA-N	0	3	348.874	3.360	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC[C@@H]1CCCCO1	ZINC001039821571	1345199297	/nfs/dbraw/zinc/19/92/97/1345199297.db2.gz	TZQCWWHQYSCXNM-KSZLIROESA-N	0	3	334.504	3.223	20	30		EGEDHN
CC(C)(F)C(=O)N1CC[C@]2(C1)CCCN(Cc1cccc(C#N)c1)C2	ZINC001040037828	1345304690	/nfs/dbraw/zinc/30/46/90/1345304690.db2.gz	IFTUBAITBBCYPZ-HXUWFJFHSA-N	0	3	343.446	3.121	20	30		EGEDHN
C/C=C(\C)C(=O)N1CC[C@]2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001040149036	1345354570	/nfs/dbraw/zinc/35/45/70/1345354570.db2.gz	FJWPCVOEKRGWID-UZTGNQCKSA-N	0	3	337.467	3.339	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cccc4scnc43)C2)C1	ZINC001040206505	1345375274	/nfs/dbraw/zinc/37/52/74/1345375274.db2.gz	XDHGIIFZGKZLJL-LJQANCHMSA-N	0	3	341.480	3.410	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)Cc3cccc(C(C)C)c3)C2)C1	ZINC001040279980	1345409008	/nfs/dbraw/zinc/40/90/08/1345409008.db2.gz	BUDHFCABADRVCY-QFIPXVFZSA-N	0	3	338.495	3.300	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cccc4cccnc43)C2)C1	ZINC001040284208	1345412204	/nfs/dbraw/zinc/41/22/04/1345412204.db2.gz	UIAJSIOYYJFMLQ-OAQYLSRUSA-N	0	3	335.451	3.349	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3c(C)[nH]c4ccccc43)C2)C1	ZINC001040285018	1345412382	/nfs/dbraw/zinc/41/23/82/1345412382.db2.gz	ZYDMAFVSZJQNJC-OAQYLSRUSA-N	0	3	335.451	3.038	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cc(C(C)(C)C)on3)C2)C1	ZINC001040292747	1345417024	/nfs/dbraw/zinc/41/70/24/1345417024.db2.gz	XOLYLPDGHAAVRO-LJQANCHMSA-N	0	3	331.460	3.086	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3cc(C)ccc3C3CC3)C2)C1	ZINC001040307803	1345424136	/nfs/dbraw/zinc/42/41/36/1345424136.db2.gz	BWLUBDDHUVKZPL-QFIPXVFZSA-N	0	3	336.479	3.434	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@@H]3CCCCC3(F)F)C2)C1	ZINC001040313967	1345425880	/nfs/dbraw/zinc/42/58/80/1345425880.db2.gz	PXHQMJKENLCVCL-FUHWJXTLSA-N	0	3	338.442	3.150	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@]2(C1)CCCN(CCC(F)(F)F)C2	ZINC001040323363	1345432392	/nfs/dbraw/zinc/43/23/92/1345432392.db2.gz	QLYFGQDPYQSGIW-INIZCTEOSA-N	0	3	332.410	3.466	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CC[C@@]3(C2)CCCN(C[C@@H](F)CC)C3)cc1	ZINC001040323370	1345432524	/nfs/dbraw/zinc/43/25/24/1345432524.db2.gz	QMMPRGJBDOPNEQ-FPOVZHCZSA-N	0	3	342.458	3.344	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)N1CC[C@]2(C1)CCCN(Cc1cccc(C#N)c1)C2	ZINC001040330141	1345436098	/nfs/dbraw/zinc/43/60/98/1345436098.db2.gz	CTXLAFVGILUADC-OZOXKJRCSA-N	0	3	337.467	3.029	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@H](C)c3ccc(Cl)cc3)C2)C1	ZINC001040371990	1345460370	/nfs/dbraw/zinc/46/03/70/1345460370.db2.gz	NOETVHFHLFWQOX-OXQOHEQNSA-N	0	3	344.886	3.391	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3ccccc3C3(C)CC3)C2)C1	ZINC001040390336	1345472586	/nfs/dbraw/zinc/47/25/86/1345472586.db2.gz	IYQKLXLUSBSDIU-QFIPXVFZSA-N	0	3	336.479	3.299	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)C3CCC(F)(F)CC3)C2)C1	ZINC001040417094	1345485119	/nfs/dbraw/zinc/48/51/19/1345485119.db2.gz	BCKPGQXCGHGOHQ-SFHVURJKSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)C3[C@H]4CCCCCC[C@H]34)C2)C1	ZINC001040418171	1345486748	/nfs/dbraw/zinc/48/67/48/1345486748.db2.gz	MJJINWXHTNAFJC-WFXMLNOXSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)C[C@H](C)c3ccccc3F)C2)C1	ZINC001040454450	1345508667	/nfs/dbraw/zinc/50/86/67/1345508667.db2.gz	VKTMBISAYNQLLN-UWJYYQICSA-N	0	3	342.458	3.267	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cnn(CCCC)c3C)C2)C1	ZINC001040491702	1345517336	/nfs/dbraw/zinc/51/73/36/1345517336.db2.gz	JWKLFXIIOJZUDL-HXUWFJFHSA-N	0	3	344.503	3.106	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cc4ccccc4o3)C2)C1	ZINC001040519570	1345530331	/nfs/dbraw/zinc/53/03/31/1345530331.db2.gz	MTKBCVWFUSWLAW-NRFANRHFSA-N	0	3	336.435	3.384	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cccc4cnccc43)C2)C1	ZINC001040532322	1345534894	/nfs/dbraw/zinc/53/48/94/1345534894.db2.gz	VWYKJXWXUFONTK-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cccc(OCCC)c3)C2)CC1	ZINC001040721187	1345570662	/nfs/dbraw/zinc/57/06/62/1345570662.db2.gz	OQMHUTFEOFEACL-UHFFFAOYSA-N	0	3	340.467	3.037	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC3(C2)CCN(Cc2cccnc2)CC3)C1	ZINC001040839586	1345586043	/nfs/dbraw/zinc/58/60/43/1345586043.db2.gz	IEIXMWLASZRWRC-UHFFFAOYSA-N	0	3	339.483	3.252	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)C3C[C@@H](C)C[C@H](C)C3)C2)CC1	ZINC001040954451	1345610313	/nfs/dbraw/zinc/61/03/13/1345610313.db2.gz	ZUDJMIJMGJXCRB-ROUUACIJSA-N	0	3	330.516	3.397	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@]3(CCN(C(=O)[C@H]4[C@@H]5CCC[C@@H]54)C3)C2)cc1	ZINC001041178759	1345667670	/nfs/dbraw/zinc/66/76/70/1345667670.db2.gz	NIHYDENZIGQUJQ-FCIYXJNOSA-N	0	3	349.478	3.029	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)[C@@H](CC)OC3CCCCC3)C2)C1	ZINC001041282297	1345693716	/nfs/dbraw/zinc/69/37/16/1345693716.db2.gz	JBYSWQWTJQXVNS-TZIWHRDSSA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3coc4ccc(CC)cc43)C2)C1	ZINC001041278932	1345693753	/nfs/dbraw/zinc/69/37/53/1345693753.db2.gz	BQBYZTIHOXETOZ-NRFANRHFSA-N	0	3	336.435	3.166	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)CC3(c4ccccc4)CC3)C2)C1	ZINC001041345973	1345707157	/nfs/dbraw/zinc/70/71/57/1345707157.db2.gz	QGHMBUHKKHANSS-OAQYLSRUSA-N	0	3	336.479	3.056	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)Cc3ccc(C)cc3Cl)C2)C1	ZINC001041417031	1345723355	/nfs/dbraw/zinc/72/33/55/1345723355.db2.gz	BXILGQKRRSBSDO-FQEVSTJZSA-N	0	3	344.886	3.139	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)CCc3ccc(C(C)C)cc3)C2)C1	ZINC001041468682	1345736788	/nfs/dbraw/zinc/73/67/88/1345736788.db2.gz	VPSPCOUGQUDBHT-JOCHJYFZSA-N	0	3	338.495	3.300	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cnc4ccccc4c3C)C2)C1	ZINC001041476107	1345739107	/nfs/dbraw/zinc/73/91/07/1345739107.db2.gz	OECTXTGXHLYLJF-QFIPXVFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@]3(CCN(C(=O)[C@]45C[C@H]4CCC5)C3)C2)cc1	ZINC001041492008	1345743761	/nfs/dbraw/zinc/74/37/61/1345743761.db2.gz	NBNIXZMTKXXRCD-CEMLEFRQSA-N	0	3	349.478	3.173	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3cc4c(o3)c(F)ccc4C)C2)C1	ZINC001041501758	1345745655	/nfs/dbraw/zinc/74/56/55/1345745655.db2.gz	BTAFMSGFMOHCAF-FQEVSTJZSA-N	0	3	340.398	3.052	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3csc4ccccc34)C2)C1	ZINC001041520730	1345752188	/nfs/dbraw/zinc/75/21/88/1345752188.db2.gz	WBLCSQJZVRZUIN-FQEVSTJZSA-N	0	3	338.476	3.463	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cc4c(ccc(C)c4C)[nH]3)C2)C1	ZINC001041532651	1345754373	/nfs/dbraw/zinc/75/43/73/1345754373.db2.gz	VVKOTDXSEPIROF-QFIPXVFZSA-N	0	3	349.478	3.346	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@]2(CCN(Cc3cncc(C)c3)C2)C1	ZINC001041537528	1345755704	/nfs/dbraw/zinc/75/57/04/1345755704.db2.gz	YMCPXXBWRRNLLC-NRFANRHFSA-N	0	3	341.499	3.417	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@]2(CCN(Cc3ccccn3)C2)C1	ZINC001041536034	1345755891	/nfs/dbraw/zinc/75/58/91/1345755891.db2.gz	LXNXVKVLZQVCIM-HXUWFJFHSA-N	0	3	327.472	3.108	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@]2(CCN(Cc3scnc3C)C2)C1	ZINC001041542546	1345757108	/nfs/dbraw/zinc/75/71/08/1345757108.db2.gz	DQYYPJJICWOPMP-GOSISDBHSA-N	0	3	333.501	3.088	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@]2(CCN(Cc3c(C)nsc3C)C2)C1	ZINC001041545329	1345759230	/nfs/dbraw/zinc/75/92/30/1345759230.db2.gz	ULWHXXXFNXHLLL-IBGZPJMESA-N	0	3	347.528	3.397	20	30		EGEDHN
CC1(C(=O)N2CC[C@@]3(CCN(Cc4ccc(C#N)cc4)C3)C2)CC=CC1	ZINC001041632587	1345802853	/nfs/dbraw/zinc/80/28/53/1345802853.db2.gz	KUJABUHQDZEROY-JOCHJYFZSA-N	0	3	349.478	3.339	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@]2(CCN(Cc3oc(C)nc3C)C2)C1	ZINC001041638084	1345805541	/nfs/dbraw/zinc/80/55/41/1345805541.db2.gz	HTSLPKMDBYXLPC-PMACEKPBSA-N	0	3	345.487	3.318	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccc4c(c3)C=CCC4)C2)C1	ZINC001041731717	1345835103	/nfs/dbraw/zinc/83/51/03/1345835103.db2.gz	AWIURPYWIFRLCS-QFIPXVFZSA-N	0	3	334.463	3.207	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3sccc3C(F)F)C2)C1	ZINC001041808767	1345858012	/nfs/dbraw/zinc/85/80/12/1345858012.db2.gz	AJDRFFTVKDLBTQ-KRWDZBQOSA-N	0	3	338.423	3.247	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3csc4c3CC[C@H](C)C4)C2)C1	ZINC001041816328	1345861175	/nfs/dbraw/zinc/86/11/75/1345861175.db2.gz	MQSDSPAIEJXDHU-YWZLYKJASA-N	0	3	342.508	3.044	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)[C@H](C)Cc3cccc(Cl)c3)C2)C1	ZINC001041856010	1345875058	/nfs/dbraw/zinc/87/50/58/1345875058.db2.gz	WAHOSPMBOHRPDL-UZLBHIALSA-N	0	3	344.886	3.076	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CCN(C(=O)C4=CCCC4)C[C@H]32)cc1	ZINC001042009227	1345923807	/nfs/dbraw/zinc/92/38/07/1345923807.db2.gz	CJTLTKYQHLEUFI-UYAOXDASSA-N	0	3	335.451	3.091	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cscc3C(F)F)C[C@@H]21	ZINC001042065630	1345934572	/nfs/dbraw/zinc/93/45/72/1345934572.db2.gz	XHVACJPDFOUQBM-FZMZJTMJSA-N	0	3	326.412	3.408	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(C)c(OC)c(C)c3)C[C@H]21	ZINC001042066310	1345934665	/nfs/dbraw/zinc/93/46/65/1345934665.db2.gz	DBPKTUYTJXUIQL-FUHWJXTLSA-N	0	3	328.456	3.034	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)COc3cccc(C(C)C)c3)C[C@@H]21	ZINC001042074856	1345938490	/nfs/dbraw/zinc/93/84/90/1345938490.db2.gz	ZKJDWFQFCUSRNN-PXNSSMCTSA-N	0	3	342.483	3.298	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc4nccc(C)c4c3)C[C@H]21	ZINC001042077892	1345939108	/nfs/dbraw/zinc/93/91/08/1345939108.db2.gz	QWUGILWPRQJYIP-LAUBAEHRSA-N	0	3	347.462	3.103	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cccc4c(C)c(C)[nH]c43)C[C@@H]21	ZINC001042114905	1345947723	/nfs/dbraw/zinc/94/77/23/1345947723.db2.gz	PSVMRWYCCSJKFW-XLIONFOSSA-N	0	3	349.478	3.344	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)COc3ccc(C(C)C)cc3)C[C@H]21	ZINC001042139572	1345953914	/nfs/dbraw/zinc/95/39/14/1345953914.db2.gz	XUIYAEHOGLRVTO-AZUAARDMSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)Cn3c(C)cc4ccccc43)C[C@H]21	ZINC001042140764	1345954115	/nfs/dbraw/zinc/95/41/15/1345954115.db2.gz	ANZUCTBUDNIJQL-YLJYHZDGSA-N	0	3	337.467	3.059	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)C3(c4ccccc4)CCC3)C[C@@H]21	ZINC001042142551	1345955146	/nfs/dbraw/zinc/95/51/46/1345955146.db2.gz	OVUJAZVNHAZYHE-ICSRJNTNSA-N	0	3	336.479	3.054	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3cc(-c4ccco4)on3)C[C@H]21	ZINC001042171614	1345965887	/nfs/dbraw/zinc/96/58/87/1345965887.db2.gz	XLJPCUOUOSUXOI-GOEBONIOSA-N	0	3	341.411	3.047	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3ccc(OC)cc3)[C@@H]2C1	ZINC001042186197	1345973339	/nfs/dbraw/zinc/97/33/39/1345973339.db2.gz	DXBMMNJHOWDTSH-IEBWSBKVSA-N	0	3	342.483	3.330	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3ncccc3C)[C@H]2C1	ZINC001042188577	1345975322	/nfs/dbraw/zinc/97/53/22/1345975322.db2.gz	UPSOHXOBZNFFFQ-WMZOPIPTSA-N	0	3	327.472	3.025	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3c(F)ccc(F)c3F)C[C@@H]21	ZINC001042207786	1345986447	/nfs/dbraw/zinc/98/64/47/1345986447.db2.gz	UHJQCLWHMQRQPW-DOMZBBRYSA-N	0	3	338.373	3.216	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3cccc(C#N)c3)[C@H]2C1	ZINC001042209063	1345986738	/nfs/dbraw/zinc/98/67/38/1345986738.db2.gz	WXLOHNIIJQCLLH-MOPGFXCFSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(C(F)F)cc3F)C[C@@H]21	ZINC001042285250	1346017091	/nfs/dbraw/zinc/01/70/91/1346017091.db2.gz	MOPHWGKKCFTDMP-WBMJQRKESA-N	0	3	338.373	3.486	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(-c4ccccc4)ccn3)C[C@H]21	ZINC001042288527	1346018273	/nfs/dbraw/zinc/01/82/73/1346018273.db2.gz	UAMWMWBCVYZNAM-WIYYLYMNSA-N	0	3	347.462	3.471	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cnoc3-c3ccccc3)C[C@H]21	ZINC001042297897	1346023029	/nfs/dbraw/zinc/02/30/29/1346023029.db2.gz	XEGAXYPFNXAXFM-CRAIPNDOSA-N	0	3	337.423	3.064	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(N(CC)CC)cc3)C[C@@H]21	ZINC001042327491	1346036788	/nfs/dbraw/zinc/03/67/88/1346036788.db2.gz	XSFMOMZVYVXNPX-XLIONFOSSA-N	0	3	341.499	3.255	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(OC(C)C)cc3)C[C@H]21	ZINC001042331242	1346039211	/nfs/dbraw/zinc/03/92/11/1346039211.db2.gz	ADPBUHHRNOVYRO-VQIMIIECSA-N	0	3	328.456	3.196	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(Cl)ccc3OC)C[C@@H]21	ZINC001042336798	1346042498	/nfs/dbraw/zinc/04/24/98/1346042498.db2.gz	AFSNZWOQCFAEEB-BBRMVZONSA-N	0	3	334.847	3.071	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3cc4cccc(F)c4o3)C[C@@H]21	ZINC001042362481	1346056334	/nfs/dbraw/zinc/05/63/34/1346056334.db2.gz	KNGNWFSCQCYKHN-PBHICJAKSA-N	0	3	340.398	3.132	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)CCc3cc(C)sc3C)C[C@H]21	ZINC001042374523	1346062748	/nfs/dbraw/zinc/06/27/48/1346062748.db2.gz	IQTFVYVHAFHNRM-PKOBYXMFSA-N	0	3	344.524	3.244	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C(C)(C)c3ccccc3C)C[C@@H]21	ZINC001042380179	1346065279	/nfs/dbraw/zinc/06/52/79/1346065279.db2.gz	RYEBPHHWPDJQNZ-HKUYNNGSSA-N	0	3	326.484	3.381	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(N(C)CCC)cc3)C[C@@H]21	ZINC001042379936	1346065604	/nfs/dbraw/zinc/06/56/04/1346065604.db2.gz	PTGQLWQERWCHFL-PXNSSMCTSA-N	0	3	341.499	3.255	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cscc3C(F)(F)F)C[C@@H]21	ZINC001042383839	1346066232	/nfs/dbraw/zinc/06/62/32/1346066232.db2.gz	YOAWPYKAWGKRJI-FZMZJTMJSA-N	0	3	344.402	3.489	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@@H](NCc2cc(F)ccc2C#N)C[C@@H]1C	ZINC001044423470	1346325000	/nfs/dbraw/zinc/32/50/00/1346325000.db2.gz	WNYINTDXSJPGHR-KBXCAEBGSA-N	0	3	331.435	3.213	20	30		EGEDHN
Cc1occc1C(=O)N1CC[C@H](NCc2ccccc2C#N)C[C@@H]1C	ZINC001044453550	1346336918	/nfs/dbraw/zinc/33/69/18/1346336918.db2.gz	VIKZBNAKBQQARJ-KSSFIOAISA-N	0	3	337.423	3.243	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)CCC2CCC2)s1	ZINC001044980786	1346473596	/nfs/dbraw/zinc/47/35/96/1346473596.db2.gz	BKZXFPSZDJGAHP-HNNXBMFYSA-N	0	3	331.485	3.281	20	30		EGEDHN
Cc1cccc(Cl)c1CNC[C@@H]1CCCN1C(=O)C#CC1CC1	ZINC001045034497	1346483829	/nfs/dbraw/zinc/48/38/29/1346483829.db2.gz	SSFIBTAOGUJPKV-INIZCTEOSA-N	0	3	330.859	3.142	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]2CNCc2cc(C)ccc2OC)C1	ZINC001045191179	1346525053	/nfs/dbraw/zinc/52/50/53/1346525053.db2.gz	QSIPVGHQLXVTFZ-SFHVURJKSA-N	0	3	342.483	3.441	20	30		EGEDHN
CC1(NC(=O)c2c[nH]c(C#N)c2)CCN(C/C=C/c2ccccc2)CC1	ZINC001045407220	1346586148	/nfs/dbraw/zinc/58/61/48/1346586148.db2.gz	TWSDBDOXOVJVJW-VMPITWQZSA-N	0	3	348.450	3.184	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1	ZINC001045410822	1346587321	/nfs/dbraw/zinc/58/73/21/1346587321.db2.gz	KRVWBDXDRIJJMW-KRWDZBQOSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2ocnc2-c2ccccc2)CC1	ZINC001045457316	1346598457	/nfs/dbraw/zinc/59/84/57/1346598457.db2.gz	XNXUMKDWZMXTSS-UHFFFAOYSA-N	0	3	325.412	3.112	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2cc3c(ccc(C)c3C)[nH]2)CC1	ZINC001045521046	1346615995	/nfs/dbraw/zinc/61/59/95/1346615995.db2.gz	JPSORQJDDYRLPE-UHFFFAOYSA-N	0	3	337.467	3.392	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1ccc(OC)cc1	ZINC001045827968	1346710574	/nfs/dbraw/zinc/71/05/74/1346710574.db2.gz	YJNFIPNFBYLGHA-MSOLQXFVSA-N	0	3	342.483	3.473	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc(C)s1)C2	ZINC001045908098	1346745103	/nfs/dbraw/zinc/74/51/03/1346745103.db2.gz	AXVBPUWKANEXDT-LJQANCHMSA-N	0	3	330.497	3.398	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@H]1CCCC13CC3)C2	ZINC001045946977	1346782715	/nfs/dbraw/zinc/78/27/15/1346782715.db2.gz	GIFAGMXVLUSTCX-UYAOXDASSA-N	0	3	328.500	3.295	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)COC1CCCCC1)C2	ZINC001045948460	1346783427	/nfs/dbraw/zinc/78/34/27/1346783427.db2.gz	JXJAJIHFVJCZGD-OAQYLSRUSA-N	0	3	346.515	3.064	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)CCc1ccc(F)cc1)C2	ZINC001045950868	1346786052	/nfs/dbraw/zinc/78/60/52/1346786052.db2.gz	NMRRGSQFGHUMRF-OAQYLSRUSA-N	0	3	342.458	3.096	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@]2(CCN(Cc3cccnc3)C2)C1	ZINC001045955375	1346790318	/nfs/dbraw/zinc/79/03/18/1346790318.db2.gz	DJPXWPIBHBVGEF-OAQYLSRUSA-N	0	3	341.499	3.498	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)C1CC3(CCC3)C1)C2	ZINC001045956942	1346791844	/nfs/dbraw/zinc/79/18/44/1346791844.db2.gz	PRNUJBNNUQNKDJ-OAQYLSRUSA-N	0	3	328.500	3.295	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)Cc1cc(C)cc(C)c1)C2	ZINC001045962252	1346797931	/nfs/dbraw/zinc/79/79/31/1346797931.db2.gz	FWXYOOYMFIBQSF-JOCHJYFZSA-N	0	3	338.495	3.184	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc(C(C)C)cn1)C2	ZINC001045966704	1346801777	/nfs/dbraw/zinc/80/17/77/1346801777.db2.gz	DEBRMOQGULQPKV-OAQYLSRUSA-N	0	3	339.483	3.156	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc(C)ccc1F)C2	ZINC001045968797	1346803704	/nfs/dbraw/zinc/80/37/04/1346803704.db2.gz	HJJAUAUECYQGBL-HXUWFJFHSA-N	0	3	328.431	3.086	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccncc1Cl)C2	ZINC001045968907	1346803809	/nfs/dbraw/zinc/80/38/09/1346803809.db2.gz	JENWPTRTHYOLBK-IBGZPJMESA-N	0	3	345.874	3.077	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccsc1Cl)C2	ZINC001045970300	1346805560	/nfs/dbraw/zinc/80/55/60/1346805560.db2.gz	DFUMIGGAPVBTGO-QGZVFWFLSA-N	0	3	336.888	3.353	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc([C@H](C)CC)no1)C2	ZINC001045972448	1346808558	/nfs/dbraw/zinc/80/85/58/1346808558.db2.gz	AXWGKBZFNUTFQX-OXQOHEQNSA-N	0	3	343.471	3.140	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@H](C)Cc1ccco1)C2	ZINC001045972372	1346808663	/nfs/dbraw/zinc/80/86/63/1346808663.db2.gz	ZHAFYRFWMIUXFK-NQIIRXRSSA-N	0	3	342.483	3.186	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc3ccn(C)c3c1)C2	ZINC001045977962	1346814649	/nfs/dbraw/zinc/81/46/49/1346814649.db2.gz	MUVYRHMGBKYDBQ-JOCHJYFZSA-N	0	3	349.478	3.130	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)Cc1cc(C)ccc1F)C2	ZINC001045981743	1346820002	/nfs/dbraw/zinc/82/00/02/1346820002.db2.gz	ZGAQLVGXHBITCV-NRFANRHFSA-N	0	3	342.458	3.014	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cccc3cnccc31)C2	ZINC001045983648	1346823686	/nfs/dbraw/zinc/82/36/86/1346823686.db2.gz	PZQJRPGFQAKSDP-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc(F)cc1Cl)C2	ZINC001045983770	1346823736	/nfs/dbraw/zinc/82/37/36/1346823736.db2.gz	RGDGARZFVBPNSM-IBGZPJMESA-N	0	3	348.849	3.431	20	30		EGEDHN
C=C(C)CCN1CC[C@@](C)(NC(=O)c2cnc([C@H]3CCCO3)s2)C1	ZINC001046685986	1347061711	/nfs/dbraw/zinc/06/17/11/1347061711.db2.gz	GKJZOWZULQZUMH-RDTXWAMCSA-N	0	3	349.500	3.155	20	30		EGEDHN
C=C(C)CCN1CC[C@](C)(NC(=O)c2cnc([C@H]3CCCO3)s2)C1	ZINC001046685984	1347061809	/nfs/dbraw/zinc/06/18/09/1347061809.db2.gz	GKJZOWZULQZUMH-KDOFPFPSSA-N	0	3	349.500	3.155	20	30		EGEDHN
C#CCCN1CC[C@@](C)(NC(=O)c2ccc(O[C@@H](C)CC)cc2)C1	ZINC001046754287	1347084923	/nfs/dbraw/zinc/08/49/23/1347084923.db2.gz	NPMAWYRRPUSSRA-OXJNMPFZSA-N	0	3	328.456	3.081	20	30		EGEDHN
C#CCCN1CC[C@@](C)(NC(=O)c2coc3ccc(Cl)cc23)C1	ZINC001046800735	1347110206	/nfs/dbraw/zinc/11/02/06/1347110206.db2.gz	AEUVDGKZZXMUGG-GOSISDBHSA-N	0	3	330.815	3.304	20	30		EGEDHN
C#CCCN1CC[C@](C)(NC(=O)c2cc3c(s2)CC[C@@H](C)C3)C1	ZINC001046826637	1347121487	/nfs/dbraw/zinc/12/14/87/1347121487.db2.gz	FLYALYRUNXZNCM-KUHUBIRLSA-N	0	3	330.497	3.090	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2c(C)coc2C)C1	ZINC001046938644	1347157784	/nfs/dbraw/zinc/15/77/84/1347157784.db2.gz	XPWKZCXOCBRBME-CQSZACIVSA-N	0	3	326.387	3.160	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2cc(C)cc(F)c2)C1	ZINC001046974662	1347172812	/nfs/dbraw/zinc/17/28/12/1347172812.db2.gz	DYYCXHUXVGULQJ-HNNXBMFYSA-N	0	3	340.389	3.397	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2cc3ccccn3c2)C1	ZINC001046979662	1347175257	/nfs/dbraw/zinc/17/52/57/1347175257.db2.gz	CZESQAROSFXVPT-MRXNPFEDSA-N	0	3	347.409	3.202	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2cc(F)cc(F)c2)C1	ZINC001046997258	1347179655	/nfs/dbraw/zinc/17/96/55/1347179655.db2.gz	YXMIRBVQOGHAHY-ZDUSSCGKSA-N	0	3	344.352	3.228	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)N(C/C=C/Cl)C3)cc1	ZINC001047122703	1347212893	/nfs/dbraw/zinc/21/28/93/1347212893.db2.gz	BEVLUNBTNJUYMC-VBCOWYAUSA-N	0	3	328.843	3.003	20	30		EGEDHN
Cc1cocc1C(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1ccccc1)C2	ZINC001047127882	1347214525	/nfs/dbraw/zinc/21/45/25/1347214525.db2.gz	VDODXAYGLFEKRY-ZCNNSNEGSA-N	0	3	348.446	3.222	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)c3ccc(F)cc3)C2)CC1	ZINC001047219712	1347251453	/nfs/dbraw/zinc/25/14/53/1347251453.db2.gz	PYVRCXYCLXIWTJ-LJQANCHMSA-N	0	3	342.458	3.413	20	30		EGEDHN
C=CC[NH+]1CCC([C@H]2CCCN(C(=O)c3ccccc3[O-])C2)CC1	ZINC001047230198	1347259170	/nfs/dbraw/zinc/25/91/70/1347259170.db2.gz	SDRJBJRTFLQQDC-KRWDZBQOSA-N	0	3	328.456	3.142	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)[C@@H](CC)SC)C2)CC1	ZINC001047238009	1347264537	/nfs/dbraw/zinc/26/45/37/1347264537.db2.gz	VXBIURZEEUVWJK-QZTJIDSGSA-N	0	3	336.545	3.102	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)c3ccoc3CC)C2)CC1	ZINC001047238084	1347265253	/nfs/dbraw/zinc/26/52/53/1347265253.db2.gz	YMFONQDGQSOJKR-SFHVURJKSA-N	0	3	342.483	3.430	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3cc(C)c(CC)o3)C2)CC1	ZINC001047264566	1347285341	/nfs/dbraw/zinc/28/53/41/1347285341.db2.gz	PGZMYXDVQXSVIN-SFHVURJKSA-N	0	3	342.483	3.348	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)Cc3ccccc3C)C2)CC1	ZINC001047264994	1347286046	/nfs/dbraw/zinc/28/60/46/1347286046.db2.gz	OLRYGLZQUJINOO-OAQYLSRUSA-N	0	3	338.495	3.121	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)CCc3ccccc3)C2)CC1	ZINC001047265312	1347286374	/nfs/dbraw/zinc/28/63/74/1347286374.db2.gz	YJVDYGDJSJDVOG-NRFANRHFSA-N	0	3	338.495	3.203	20	30		EGEDHN
C=CCCN1C[C@H](O)[C@@H](N(C)C(=O)c2cccc(C3CCCC3)c2)C1	ZINC001047595306	1347312859	/nfs/dbraw/zinc/31/28/59/1347312859.db2.gz	BCKVDZGSSBBBGA-PMACEKPBSA-N	0	3	342.483	3.037	20	30		EGEDHN
Cc1occc1C(=O)N1CC[C@@H]([C@@H](C)NCc2ccccc2C#N)C1	ZINC001047706281	1347342431	/nfs/dbraw/zinc/34/24/31/1347342431.db2.gz	TXAAIAIUTITLBH-RDTXWAMCSA-N	0	3	337.423	3.100	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]([C@H](C)NCc2nc(C)sc2C)C1	ZINC001047924920	1347411611	/nfs/dbraw/zinc/41/16/11/1347411611.db2.gz	RGPGMLCWOYHZJR-WFASDCNBSA-N	0	3	335.517	3.299	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]([C@H](C)NCc2ccccc2C#N)C1	ZINC001047927599	1347412876	/nfs/dbraw/zinc/41/28/76/1347412876.db2.gz	JMPLQXDGHDJZNJ-LPHOPBHVSA-N	0	3	339.483	3.487	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@H]([C@H](C)NCc2ccccc2C#N)C1	ZINC001047950469	1347421647	/nfs/dbraw/zinc/42/16/47/1347421647.db2.gz	LVAKXNQABBKTIJ-YJBOKZPZSA-N	0	3	327.472	3.321	20	30		EGEDHN
CCC1(C(=O)N2CC[C@@H]([C@H](C)NCc3cc(F)ccc3C#N)C2)CC1	ZINC001047969937	1347428868	/nfs/dbraw/zinc/42/88/68/1347428868.db2.gz	ICMSFTPMZOIAOS-GOEBONIOSA-N	0	3	343.446	3.214	20	30		EGEDHN
CCC1(C(=O)N2CC[C@H]([C@H](C)NCc3ccccc3C#N)C2)CC1	ZINC001047971023	1347429145	/nfs/dbraw/zinc/42/91/45/1347429145.db2.gz	MLRQAPBKVPBOMO-YJBOKZPZSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)C2(CF)CCC2)C1	ZINC001047987073	1347434970	/nfs/dbraw/zinc/43/49/70/1347434970.db2.gz	XYBCZWSGFZCBHJ-MAUKXSAKSA-N	0	3	343.446	3.025	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CCCCC2)C[C@@H]1CNCc1ccccc1C#N	ZINC001048118678	1347472747	/nfs/dbraw/zinc/47/27/47/1347472747.db2.gz	QGGUMCLQBPTVFV-UZLBHIALSA-N	0	3	339.483	3.323	20	30		EGEDHN
C[C@H]1CN(C(=O)C2CCCCC2)C[C@H]1CNCc1ccccc1C#N	ZINC001048118674	1347472784	/nfs/dbraw/zinc/47/27/84/1347472784.db2.gz	QGGUMCLQBPTVFV-OXJNMPFZSA-N	0	3	339.483	3.323	20	30		EGEDHN
C[C@@H]1CN(C(=O)C#CC2CC2)C[C@H]1CNCc1c(F)cccc1Cl	ZINC001048246112	1347501452	/nfs/dbraw/zinc/50/14/52/1347501452.db2.gz	MDZBVHVOOXZBCR-UKRRQHHQSA-N	0	3	348.849	3.077	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@@H](CNCc2ccccc2C#N)C1	ZINC001048338010	1347522254	/nfs/dbraw/zinc/52/22/54/1347522254.db2.gz	HLTILFDKFXFSFG-APWZRJJASA-N	0	3	339.483	3.345	20	30		EGEDHN
C=C(Cl)CN1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)c1ccccc1O)C2	ZINC001048505036	1347571502	/nfs/dbraw/zinc/57/15/02/1347571502.db2.gz	MWYNFXXEKDGNIH-QDMKHBRRSA-N	0	3	334.847	3.118	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)C2CC(F)(F)C2)CC1	ZINC001048626119	1347623861	/nfs/dbraw/zinc/62/38/61/1347623861.db2.gz	ZFJYXZRVKIYDBE-UHFFFAOYSA-N	0	3	349.425	3.106	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)c2c[nH]cc2C)CC1	ZINC001048629137	1347625298	/nfs/dbraw/zinc/62/52/98/1347625298.db2.gz	QLWJJLXKJUXXFM-UHFFFAOYSA-N	0	3	338.455	3.011	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CN(C(=O)C4(C5CC5)CCC4)C[C@@H]3C2)c1	ZINC001048965407	1347692947	/nfs/dbraw/zinc/69/29/47/1347692947.db2.gz	OMSHTBCJUKRGHD-KDURUIRLSA-N	0	3	349.478	3.029	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CN(Cc3c(C)nsc3C)C[C@H]2C1	ZINC001049024969	1347709150	/nfs/dbraw/zinc/70/91/50/1347709150.db2.gz	AVQFUCAABHMBCE-FCEWJHQRSA-N	0	3	347.528	3.252	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1cc2ccccc2o1	ZINC001049380757	1347811782	/nfs/dbraw/zinc/81/17/82/1347811782.db2.gz	GZIFQLVUSKMGEE-OLMNPRSZSA-N	0	3	337.423	3.158	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)C2CC=CC2)cc1	ZINC001049390700	1347816884	/nfs/dbraw/zinc/81/68/84/1347816884.db2.gz	BOZIEEIWFWMWGK-WOJBJXKFSA-N	0	3	335.451	3.090	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@@H]2CCCN3C(=O)CC2CCC2)c1	ZINC001049392374	1347817676	/nfs/dbraw/zinc/81/76/76/1347817676.db2.gz	YVVRJPAWYIRFAH-PMACEKPBSA-N	0	3	337.467	3.314	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](CC)OC1CCCCC1	ZINC001049472689	1347865807	/nfs/dbraw/zinc/86/58/07/1347865807.db2.gz	GAHJBLCFNIFDMI-QRVBRYPASA-N	0	3	334.504	3.366	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1c(F)ccc2ccncc21	ZINC001049490145	1347874110	/nfs/dbraw/zinc/87/41/10/1347874110.db2.gz	ICVOHXPGLFXKQK-ROUUACIJSA-N	0	3	339.414	3.239	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ocnc1-c1ccccc1	ZINC001049519293	1347888855	/nfs/dbraw/zinc/88/88/55/1347888855.db2.gz	RDALUFJAHYIEIK-IRXDYDNUSA-N	0	3	337.423	3.207	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)CC(C)(C)c1ccc(F)cc1	ZINC001049522590	1347890882	/nfs/dbraw/zinc/89/08/82/1347890882.db2.gz	RGWXQOYQGDVUIB-RBUKOAKNSA-N	0	3	342.458	3.192	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1cncc2ccccc21	ZINC001049528817	1347893612	/nfs/dbraw/zinc/89/36/12/1347893612.db2.gz	BBRUCFFLCZPGGQ-UXHICEINSA-N	0	3	335.451	3.029	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)C2(C3CC3)CC2)c1	ZINC001049541333	1347898913	/nfs/dbraw/zinc/89/89/13/1347898913.db2.gz	OIENYBZWABQQRZ-WOJBJXKFSA-N	0	3	349.478	3.314	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(F)cc2ccoc21	ZINC001049565855	1347913155	/nfs/dbraw/zinc/91/31/55/1347913155.db2.gz	XMUWLGXILQNSJG-IRXDYDNUSA-N	0	3	328.387	3.437	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cccc(C(C)C)n1	ZINC001049572839	1347916764	/nfs/dbraw/zinc/91/67/64/1347916764.db2.gz	OYZJVSFYAGPBII-OALUTQOASA-N	0	3	327.472	3.460	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1ccc(CCCC)cc1	ZINC001049578869	1347918963	/nfs/dbraw/zinc/91/89/63/1347918963.db2.gz	GBGUTEWZLNSHMT-LEWJYISDSA-N	0	3	338.495	3.270	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cccnc1C(F)F	ZINC001049581858	1347920900	/nfs/dbraw/zinc/92/09/00/1347920900.db2.gz	AGQVJGWZCGYFEF-LSDHHAIUSA-N	0	3	335.398	3.274	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cnc2c(F)cccc2c1	ZINC001049596915	1347929303	/nfs/dbraw/zinc/92/93/03/1347929303.db2.gz	ZZAFCYHNJPANCL-ROUUACIJSA-N	0	3	339.414	3.239	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(-c2ccco2)on1	ZINC001049620411	1347938449	/nfs/dbraw/zinc/93/84/49/1347938449.db2.gz	KLDJCRVQVFBKRR-CVEARBPZSA-N	0	3	341.411	3.190	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)C1(c2cccc(F)c2)CCC1	ZINC001049624722	1347940082	/nfs/dbraw/zinc/94/00/82/1347940082.db2.gz	AHELHQZAGVJDEC-MOPGFXCFSA-N	0	3	342.458	3.499	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(Cl)c(Cl)[nH]1	ZINC001049626818	1347941489	/nfs/dbraw/zinc/94/14/89/1347941489.db2.gz	SZXDUECYWCEWPR-CHWSQXEVSA-N	0	3	328.243	3.186	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)CCc1ccc(C)c(Cl)c1	ZINC001049627886	1347941871	/nfs/dbraw/zinc/94/18/71/1347941871.db2.gz	VFOLBGBQUQRXHK-RBUKOAKNSA-N	0	3	344.886	3.280	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]2[C@H]1CCN2CCc1ccns1	ZINC001049632694	1347944555	/nfs/dbraw/zinc/94/45/55/1347944555.db2.gz	ALKGCFLYGGNNOZ-IAGOWNOFSA-N	0	3	347.528	3.353	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc2c(c1)[C@H](C)CO2	ZINC001049665187	1347964132	/nfs/dbraw/zinc/96/41/32/1347964132.db2.gz	UJMWOFHKKPAKMN-FHLIZLRMSA-N	0	3	326.440	3.047	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cncc2sccc21	ZINC001049675489	1347967420	/nfs/dbraw/zinc/96/74/20/1347967420.db2.gz	ZRQNSGPXKBMUDG-HOTGVXAUSA-N	0	3	327.453	3.161	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](C)Cc1ccccc1F	ZINC001049713503	1347988086	/nfs/dbraw/zinc/98/80/86/1347988086.db2.gz	DPDBRZQPRQMQOT-KFKAGJAMSA-N	0	3	330.447	3.256	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(C(C)C)cn1	ZINC001049723761	1347990599	/nfs/dbraw/zinc/99/05/99/1347990599.db2.gz	OPHMMXPRFOFDPD-RBUKOAKNSA-N	0	3	327.472	3.460	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ncsc1C1CC1	ZINC001049724770	1347991473	/nfs/dbraw/zinc/99/14/73/1347991473.db2.gz	TZAIZSDFMNZHAG-GJZGRUSLSA-N	0	3	331.485	3.276	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1cccc(C#N)c1	ZINC001049734068	1347993795	/nfs/dbraw/zinc/99/37/95/1347993795.db2.gz	CWFAGCLMQVSIPS-UAFMIMERSA-N	0	3	337.467	3.170	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)[C@@H]2CC23CCC3)c1	ZINC001049750933	1348000170	/nfs/dbraw/zinc/00/01/70/1348000170.db2.gz	AHVNTAPFIAAMNL-SLFFLAALSA-N	0	3	349.478	3.314	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc2cc(F)ccc2o1	ZINC001049761207	1348006699	/nfs/dbraw/zinc/00/66/99/1348006699.db2.gz	HZUYZMLMFFGQJT-SJORKVTESA-N	0	3	340.398	3.274	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1scnc1C(C)(C)C	ZINC001049772392	1348014232	/nfs/dbraw/zinc/01/42/32/1348014232.db2.gz	GTPYEYTZTQPZQD-CABCVRRESA-N	0	3	345.512	3.143	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1sc(CC)nc1C	ZINC001049777965	1348016384	/nfs/dbraw/zinc/01/63/84/1348016384.db2.gz	LLJHGSINXQHPAO-HUUCEWRRSA-N	0	3	333.501	3.269	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1csc(C(C)(C)C)n1	ZINC001049777472	1348016689	/nfs/dbraw/zinc/01/66/89/1348016689.db2.gz	IDLWVBJVRMTZMO-HZPDHXFCSA-N	0	3	347.528	3.234	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccc(C)s1	ZINC001049779029	1348017610	/nfs/dbraw/zinc/01/76/10/1348017610.db2.gz	BBTADIRSVFKNIA-WCXIOVBPSA-N	0	3	330.497	3.411	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ncc(Cl)cc1Cl	ZINC001049807105	1348029385	/nfs/dbraw/zinc/02/93/85/1348029385.db2.gz	RDLZAVAZNNASFX-KGLIPLIRSA-N	0	3	340.254	3.253	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cccc(-c2cnco2)c1	ZINC001049818907	1348036053	/nfs/dbraw/zinc/03/60/53/1348036053.db2.gz	BGLZPRUWJAHANP-ROUUACIJSA-N	0	3	337.423	3.207	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1csc(Cl)n1	ZINC001049823445	1348039907	/nfs/dbraw/zinc/03/99/07/1348039907.db2.gz	BMDJVSVCFZYWKB-STQMWFEESA-N	0	3	325.865	3.052	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ncoc1C(C)(C)C	ZINC001049835248	1348048646	/nfs/dbraw/zinc/04/86/46/1348048646.db2.gz	PJPPFUORGSAUKE-GJZGRUSLSA-N	0	3	331.460	3.227	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C(C)(C)c1ccc(F)cc1	ZINC001049854409	1348061007	/nfs/dbraw/zinc/06/10/07/1348061007.db2.gz	LAAOHGBQNKZZJR-QZTJIDSGSA-N	0	3	330.447	3.355	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccccc1OC(C)C	ZINC001049854943	1348061671	/nfs/dbraw/zinc/06/16/71/1348061671.db2.gz	OUCVSPYDYGRIOC-ZWKOTPCHSA-N	0	3	328.456	3.339	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc2[nH]ccc2s1	ZINC001049867447	1348073135	/nfs/dbraw/zinc/07/31/35/1348073135.db2.gz	NGSYDJJLPBXABE-HUUCEWRRSA-N	0	3	329.469	3.484	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1CCC[C@@H]2[C@H]1CCN2C[C@@H](F)CC	ZINC001049868240	1348074107	/nfs/dbraw/zinc/07/41/07/1348074107.db2.gz	RTMFLFKNDUMPPX-XUVXKRRUSA-N	0	3	342.458	3.024	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](C)Oc1ccc(C)cc1	ZINC001049880183	1348085165	/nfs/dbraw/zinc/08/51/65/1348085165.db2.gz	BHSFEMCLZAFOSX-NZSAHSFTSA-N	0	3	328.456	3.014	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](C)Oc1cccc(C)c1	ZINC001049881934	1348087446	/nfs/dbraw/zinc/08/74/46/1348087446.db2.gz	UIOFOZFKFUKATL-YTQUADARSA-N	0	3	328.456	3.014	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)CC(C)(C)c1ccc(C)cc1	ZINC001049885947	1348090599	/nfs/dbraw/zinc/09/05/99/1348090599.db2.gz	QSMUBSVQVSVXKP-PMACEKPBSA-N	0	3	338.495	3.361	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1sc(CCC)nc1C	ZINC001049888852	1348093460	/nfs/dbraw/zinc/09/34/60/1348093460.db2.gz	ABNGAWNWZSSEGX-HOTGVXAUSA-N	0	3	345.512	3.106	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1ccc2ccccc2c1	ZINC001049890654	1348095135	/nfs/dbraw/zinc/09/51/35/1348095135.db2.gz	XOMMEFYJACIYBR-VXKWHMMOSA-N	0	3	346.474	3.471	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](C)Cc1ccc(C)cc1	ZINC001049916910	1348110834	/nfs/dbraw/zinc/11/08/34/1348110834.db2.gz	JMGDJXYLKABOOS-HMXCVIKNSA-N	0	3	338.495	3.262	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)C1CC(c2ccccc2)C1	ZINC001049928047	1348118345	/nfs/dbraw/zinc/11/83/45/1348118345.db2.gz	ZYAHTIJQFFXDHG-VFUGHAIPSA-N	0	3	336.479	3.269	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C1CC(c2ccccc2)C1	ZINC001049928045	1348118639	/nfs/dbraw/zinc/11/86/39/1348118639.db2.gz	ZYAHTIJQFFXDHG-TZWRJOPASA-N	0	3	336.479	3.269	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)C(C)(C)c1ccccc1OC	ZINC001049933746	1348120888	/nfs/dbraw/zinc/12/08/88/1348120888.db2.gz	SAIWJJPQVHRNOQ-ROUUACIJSA-N	0	3	342.483	3.224	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3ccsc3COC)[C@@H]2C1	ZINC001050077010	1348174443	/nfs/dbraw/zinc/17/44/43/1348174443.db2.gz	NHXAFROACLDTHT-GOEBONIOSA-N	0	3	334.485	3.007	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)[C@@H]3C[C@H]3c3ccccc3CC)[C@@H]2C1	ZINC001050128384	1348190499	/nfs/dbraw/zinc/19/04/99/1348190499.db2.gz	YNGHNUNSORYPSK-MJUUVYJYSA-N	0	3	338.495	3.461	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)[C@@H](C)c3ccc(CC)cc3)[C@@H]2C1	ZINC001050164548	1348201530	/nfs/dbraw/zinc/20/15/30/1348201530.db2.gz	IXEOWGUMFOMJTC-FFZOFVMBSA-N	0	3	326.484	3.461	20	30		EGEDHN
CC(C)(F)C(=O)N[C@H]1CC[C@H](CNCc2cc(F)ccc2C#N)CC1	ZINC001050280300	1348226137	/nfs/dbraw/zinc/22/61/37/1348226137.db2.gz	KJMSLGWTSCMCKS-WJYNOGRTSA-N	0	3	349.425	3.210	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC2(C1)CCN([C@@H](C)c1cccc(Cl)c1)CC2	ZINC001050460884	1348271574	/nfs/dbraw/zinc/27/15/74/1348271574.db2.gz	ZRBSHYSLKMZJRY-CABCVRRESA-N	0	3	345.874	3.485	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H]3C[C@H]3c3sccc3C)C2)CC1	ZINC001050518224	1348282647	/nfs/dbraw/zinc/28/26/47/1348282647.db2.gz	YIRXMLVVQGNNGE-IAGOWNOFSA-N	0	3	342.508	3.108	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H]3CCCc4ccccc43)C2)CC1	ZINC001050563159	1348290587	/nfs/dbraw/zinc/29/05/87/1348290587.db2.gz	HIAPNAYZJAGSEN-HXUWFJFHSA-N	0	3	336.479	3.054	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3cc4c(o3)c(F)ccc4C)C2)CC1	ZINC001050602195	1348297936	/nfs/dbraw/zinc/29/79/36/1348297936.db2.gz	MCMDHDZZWJRAEV-UHFFFAOYSA-N	0	3	340.398	3.052	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cc4cc(C)ccc4[nH]3)C2)CC1	ZINC001050612705	1348301933	/nfs/dbraw/zinc/30/19/33/1348301933.db2.gz	AFMRIIILHCZHIS-UHFFFAOYSA-N	0	3	335.451	3.038	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc(Cl)cc3C)C2)CC1	ZINC001050643418	1348313065	/nfs/dbraw/zinc/31/30/65/1348313065.db2.gz	BMYNMKBAYCOIRP-UHFFFAOYSA-N	0	3	330.859	3.210	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H](C)OC3CCCCCC3)C2)CC1	ZINC001050655571	1348318699	/nfs/dbraw/zinc/31/86/99/1348318699.db2.gz	OGOSCRTZJQLEGR-SFHVURJKSA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@H](Cc3ccccc3)C(C)C)C2)CC1	ZINC001050663551	1348321213	/nfs/dbraw/zinc/32/12/13/1348321213.db2.gz	SDXFSCLLMFQLDJ-HXUWFJFHSA-N	0	3	338.495	3.059	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)CCc3ccccc3Cl)C2)CC1	ZINC001050747910	1348347603	/nfs/dbraw/zinc/34/76/03/1348347603.db2.gz	BGGPMYMEFVADIV-UHFFFAOYSA-N	0	3	344.886	3.220	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3cc4cc(F)ccc4s3)C2)CC1	ZINC001050749833	1348348138	/nfs/dbraw/zinc/34/81/38/1348348138.db2.gz	UXGLXWAUMZYJHE-UHFFFAOYSA-N	0	3	342.439	3.212	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3ccc(Cl)o3)cccc2C1	ZINC001051278770	1348415014	/nfs/dbraw/zinc/41/50/14/1348415014.db2.gz	DKUKWBJZWVUVMA-UHFFFAOYSA-N	0	3	342.826	3.244	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3c(C)ccn3C)cccc2C1	ZINC001051284800	1348417826	/nfs/dbraw/zinc/41/78/26/1348417826.db2.gz	IUIYSHZAFPDLOU-UHFFFAOYSA-N	0	3	337.467	3.198	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3occc3CC)cccc2C1	ZINC001051299546	1348425028	/nfs/dbraw/zinc/42/50/28/1348425028.db2.gz	NWPRZJQXKDPPHM-UHFFFAOYSA-N	0	3	336.435	3.153	20	30		EGEDHN
Cc1cnccc1C(=O)N[C@H]1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC001052362915	1348533568	/nfs/dbraw/zinc/53/35/68/1348533568.db2.gz	RTIMMQKHDWTJRL-IBGZPJMESA-N	0	3	348.450	3.046	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cccc3c(C)c(C)[nH]c32)CC1	ZINC001052496068	1348558280	/nfs/dbraw/zinc/55/82/80/1348558280.db2.gz	CJBFYVIGEZDKGI-QGZVFWFLSA-N	0	3	337.467	3.392	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2c(C)c(F)ccc2Cl)CC1	ZINC001052502370	1348560703	/nfs/dbraw/zinc/56/07/03/1348560703.db2.gz	CXYQAAXVEQJLIX-AWEZNQCLSA-N	0	3	336.838	3.395	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2c(C)c(F)ccc2Cl)CC1	ZINC001052502372	1348560931	/nfs/dbraw/zinc/56/09/31/1348560931.db2.gz	CXYQAAXVEQJLIX-CQSZACIVSA-N	0	3	336.838	3.395	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cc3cc(Cl)ccc3[nH]2)CC1	ZINC001052614699	1348597480	/nfs/dbraw/zinc/59/74/80/1348597480.db2.gz	WLLMRFXGQAGBGO-MRXNPFEDSA-N	0	3	343.858	3.429	20	30		EGEDHN
CC1(C)CC[C@H]1C(=O)N[C@@H]1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC001052636810	1348605932	/nfs/dbraw/zinc/60/59/32/1348605932.db2.gz	YJYMQOAZWWISKU-MOPGFXCFSA-N	0	3	339.483	3.465	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@H](NC(=O)C3CC4(CC4)C3)CC2)c1	ZINC001052698078	1348639634	/nfs/dbraw/zinc/63/96/34/1348639634.db2.gz	DWLMXFHDAAINDW-IBGZPJMESA-N	0	3	337.467	3.219	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc(O[C@@H](C)CC)cc2)CC1	ZINC001052849058	1348700557	/nfs/dbraw/zinc/70/05/57/1348700557.db2.gz	LFIRRCPMGLSGTK-HKUYNNGSSA-N	0	3	342.483	3.472	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@H](C)c2cccc(Cl)c2)CC1	ZINC001052946671	1348763360	/nfs/dbraw/zinc/76/33/60/1348763360.db2.gz	BLCJRWMLAFAKRO-CRAIPNDOSA-N	0	3	332.875	3.438	20	30		EGEDHN
CC(=O)N1CCC[C@@H]([C@@H]2CCCN(CC#Cc3ccc(F)cc3)C2)C1	ZINC001052998086	1348794884	/nfs/dbraw/zinc/79/48/84/1348794884.db2.gz	VGKQKARCFCPGMV-WOJBJXKFSA-N	0	3	342.458	3.148	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC[C@H]([C@H]3CCCN(CCF)C3)C2)cc1	ZINC001053036191	1348836195	/nfs/dbraw/zinc/83/61/95/1348836195.db2.gz	IMHVJEZQSDWHBD-PMACEKPBSA-N	0	3	342.458	3.202	20	30		EGEDHN
CC#CC[N@@H+]1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001053065534	1348879527	/nfs/dbraw/zinc/87/95/27/1348879527.db2.gz	HGLAPQQXZUKDEW-PKOBYXMFSA-N	0	3	340.467	3.122	20	30		EGEDHN
CC#CC[N@H+]1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001053065534	1348879532	/nfs/dbraw/zinc/87/95/32/1348879532.db2.gz	HGLAPQQXZUKDEW-PKOBYXMFSA-N	0	3	340.467	3.122	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2oc(C)nc2C)C1	ZINC001053075527	1348893063	/nfs/dbraw/zinc/89/30/63/1348893063.db2.gz	HOYJZDOVAWXKHS-QZTJIDSGSA-N	0	3	343.471	3.021	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)C2C(C)(C)C2(C)C)C1	ZINC001053076555	1348894323	/nfs/dbraw/zinc/89/43/23/1348894323.db2.gz	PPUHJELNFKCUJV-SJORKVTESA-N	0	3	330.516	3.395	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cncc(C)c2)C1	ZINC001053078186	1348897297	/nfs/dbraw/zinc/89/72/97/1348897297.db2.gz	OPIDKLDLAQEPFB-QUCCMNQESA-N	0	3	339.483	3.120	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cc[nH]c2CC)C1	ZINC001053083341	1348904101	/nfs/dbraw/zinc/90/41/01/1348904101.db2.gz	KEXWEWHZUKJXPN-XLIONFOSSA-N	0	3	341.499	3.307	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(F)c(F)c2)C1	ZINC001053088439	1348913125	/nfs/dbraw/zinc/91/31/25/1348913125.db2.gz	VIYVMZYHRVATHZ-VQIMIIECSA-N	0	3	346.421	3.305	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cccn2CC=C)C1	ZINC001053088374	1348913467	/nfs/dbraw/zinc/91/34/67/1348913467.db2.gz	UIEKADDJXTZWRY-RBUKOAKNSA-N	0	3	339.483	3.014	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccn3ccccc23)C1	ZINC001053090882	1348916256	/nfs/dbraw/zinc/91/62/56/1348916256.db2.gz	JKHNPNYJQDFQFG-ICSRJNTNSA-N	0	3	349.478	3.279	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(C)c(C)n2)C1	ZINC001053091564	1348916862	/nfs/dbraw/zinc/91/68/62/1348916862.db2.gz	NEIJKMAJOFMQHX-UYAOXDASSA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)CC2CC(F)(F)C2)C1	ZINC001053093154	1348920680	/nfs/dbraw/zinc/92/06/80/1348920680.db2.gz	WEVZUHSQWKHFFV-IAGOWNOFSA-N	0	3	338.442	3.148	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)CCc2ccc(C)o2)C1	ZINC001053105415	1348941882	/nfs/dbraw/zinc/94/18/82/1348941882.db2.gz	OJBHQYJMJZYNBF-AZUAARDMSA-N	0	3	342.483	3.247	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccnc(C)c2)C1	ZINC001053105287	1348942503	/nfs/dbraw/zinc/94/25/03/1348942503.db2.gz	SWGJILZCQZCPKP-PMACEKPBSA-N	0	3	339.483	3.120	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cccc(OC)c2)C1	ZINC001053107025	1348945466	/nfs/dbraw/zinc/94/54/66/1348945466.db2.gz	YGIWOGGCPYUTEO-QUCCMNQESA-N	0	3	340.467	3.035	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2Cc3ccccc3CN2CC(C)C)cc1	ZINC001054049626	1349139504	/nfs/dbraw/zinc/13/95/04/1349139504.db2.gz	CZPMGOSTADCGLL-QFIPXVFZSA-N	0	3	346.474	3.481	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc(C)ccc1C1CC1)C2	ZINC001054171297	1349173233	/nfs/dbraw/zinc/17/32/33/1349173233.db2.gz	NYIQBZJIKPYZAA-JOCHJYFZSA-N	0	3	336.479	3.434	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@]2(CCN(Cc3c(C)noc3C)C2)C1	ZINC001054175285	1349176886	/nfs/dbraw/zinc/17/68/86/1349176886.db2.gz	LJCKOKOVNPLXKR-HXUWFJFHSA-N	0	3	345.487	3.318	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@]2(CCN(Cc3cccnc3)C2)C1	ZINC001054175530	1349177097	/nfs/dbraw/zinc/17/70/97/1349177097.db2.gz	PFWRAQYPBZEVOU-OAQYLSRUSA-N	0	3	341.499	3.498	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1coc(C(F)F)c1)C2	ZINC001054186596	1349189498	/nfs/dbraw/zinc/18/94/98/1349189498.db2.gz	WSSSKNULZJTZHR-GOSISDBHSA-N	0	3	336.382	3.169	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cccc3[nH]ccc31)C2	ZINC001054201421	1349203135	/nfs/dbraw/zinc/20/31/35/1349203135.db2.gz	DOUPVCUGXRHZLI-NRFANRHFSA-N	0	3	335.451	3.119	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H](C)c1cccc(C)c1)C2	ZINC001054206468	1349209006	/nfs/dbraw/zinc/20/90/06/1349209006.db2.gz	JCUJUCJQYLHYHX-UGKGYDQZSA-N	0	3	338.495	3.436	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc([C@H](C)CC)no1)C2	ZINC001054209368	1349210586	/nfs/dbraw/zinc/21/05/86/1349210586.db2.gz	PPDGAEKFTMGTLJ-OXQOHEQNSA-N	0	3	343.471	3.140	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(OCC)cc1)C2	ZINC001054235713	1349227686	/nfs/dbraw/zinc/22/76/86/1349227686.db2.gz	BBJASLQZGPAKPT-NRFANRHFSA-N	0	3	340.467	3.037	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc(C)c(C)s1)C2	ZINC001054237843	1349231817	/nfs/dbraw/zinc/23/18/17/1349231817.db2.gz	FCXQEEMDMGQBLL-IBGZPJMESA-N	0	3	330.497	3.316	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@H](C)c1ccccc1C)C2	ZINC001054243505	1349237576	/nfs/dbraw/zinc/23/75/76/1349237576.db2.gz	JBRRQAHMGGPIDJ-KNQAVFIVSA-N	0	3	338.495	3.436	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@H](C)n1c(C)ccc1C)C2	ZINC001054244244	1349237720	/nfs/dbraw/zinc/23/77/20/1349237720.db2.gz	BCMIZHFMWCHVRP-FPOVZHCZSA-N	0	3	341.499	3.004	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cc(CCC)n[nH]3)cc2C1	ZINC001054276610	1349276658	/nfs/dbraw/zinc/27/66/58/1349276658.db2.gz	LXDRJTJHMMRWAW-UHFFFAOYSA-N	0	3	338.455	3.184	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@@H]3CCOC[C@H]3C)cc2C1	ZINC001054280892	1349282092	/nfs/dbraw/zinc/28/20/92/1349282092.db2.gz	VYHCAZMDDDPZAV-OXQOHEQNSA-N	0	3	342.483	3.257	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3ncoc3C3CC3)cc2C1	ZINC001054288928	1349293316	/nfs/dbraw/zinc/29/33/16/1349293316.db2.gz	NMIOKLTUJDWBIB-UHFFFAOYSA-N	0	3	337.423	3.374	20	30		EGEDHN
Cc1ccsc1C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001054341414	1349321305	/nfs/dbraw/zinc/32/13/05/1349321305.db2.gz	ZQJMNGMEJWLYLH-IUODEOHRSA-N	0	3	345.493	3.240	20	30		EGEDHN
C[C@H]1CN(C(=O)c2sccc2F)C[C@H]1NCc1ccc(C#N)s1	ZINC001054624320	1349419571	/nfs/dbraw/zinc/41/95/71/1349419571.db2.gz	SMGLAUWUFYBXCJ-IINYFYTJSA-N	0	3	349.456	3.071	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)Cc2ccccc2OC(C)C)C1	ZINC001080614523	1357699134	/nfs/dbraw/zinc/69/91/34/1357699134.db2.gz	ULYRNHGVXQINLR-SJLPKXTDSA-N	0	3	330.472	3.029	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)[C@@H]2CCC(C)=C(C)C2)C1	ZINC001070410206	1354340368	/nfs/dbraw/zinc/34/03/68/1354340368.db2.gz	XTMWWALFQCNUQU-SJORKVTESA-N	0	3	342.487	3.138	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC001085668350	1358672709	/nfs/dbraw/zinc/67/27/09/1358672709.db2.gz	BCFHGRIDIKLTFB-AZUAARDMSA-N	0	3	341.499	3.012	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1cccc(C)c1F)C[C@@H](C)O2	ZINC001071172099	1354487307	/nfs/dbraw/zinc/48/73/07/1354487307.db2.gz	XIRMZBRLODHNGN-UZLBHIALSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1ccc(C)c(F)c1)C[C@@H](C)O2	ZINC001071185794	1354491482	/nfs/dbraw/zinc/49/14/82/1354491482.db2.gz	LYHRAZZELWPRNK-UZLBHIALSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1ccc(C)c(F)c1)C[C@H](C)O2	ZINC001071185791	1354491755	/nfs/dbraw/zinc/49/17/55/1354491755.db2.gz	LYHRAZZELWPRNK-JXFKEZNVSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1cccc(C)c1C)C[C@H](C)O2	ZINC001071238521	1354521887	/nfs/dbraw/zinc/52/18/87/1354521887.db2.gz	NSERWCUIYWKKAF-LAUBAEHRSA-N	0	3	342.483	3.185	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H]3C[C@H]3CC(C)(C)C)C2)CC1	ZINC001086923817	1359249940	/nfs/dbraw/zinc/24/99/40/1359249940.db2.gz	BSOTXIQSUWFFQK-FGTMMUONSA-N	0	3	330.516	3.395	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3cccc(C)c3F)C2)CC1	ZINC001086924008	1359250090	/nfs/dbraw/zinc/25/00/90/1359250090.db2.gz	HSPLRQLPAHQGTJ-QGZVFWFLSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)Cc2coc3ccc(C)cc23)CC[C@@H]1C	ZINC001071541559	1354755006	/nfs/dbraw/zinc/75/50/06/1354755006.db2.gz	AOZGLLXRDCGOBQ-FUHWJXTLSA-N	0	3	338.451	3.276	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(OC(C)C)nc2)CC[C@@H]1C	ZINC001071547295	1354759230	/nfs/dbraw/zinc/75/92/30/1354759230.db2.gz	SOONUSSSFXGWBZ-DOTOQJQBSA-N	0	3	331.460	3.028	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(OC(C)C)nc2)CC[C@@H]1C	ZINC001071547297	1354759880	/nfs/dbraw/zinc/75/98/80/1354759880.db2.gz	SOONUSSSFXGWBZ-RDJZCZTQSA-N	0	3	331.460	3.028	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccnn2C(CC)CC)CC[C@H]1C	ZINC001071568245	1354767728	/nfs/dbraw/zinc/76/77/28/1354767728.db2.gz	KZCJPOSNULQPPQ-HZPDHXFCSA-N	0	3	332.492	3.403	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc3c(c2)OCCCO3)CC[C@H]1C	ZINC001071568788	1354769038	/nfs/dbraw/zinc/76/90/38/1354769038.db2.gz	SUTPXZKCLDBDGN-NVXWUHKLSA-N	0	3	344.455	3.007	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2c(C)c(F)ccc2Cl)CC[C@@H]1C	ZINC001071624181	1354807009	/nfs/dbraw/zinc/80/70/09/1354807009.db2.gz	FMOSDIDPVXYZCG-GXTWGEPZSA-N	0	3	336.838	3.394	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2coc3ccc(OC)cc32)CC[C@H]1C	ZINC001071676029	1354843998	/nfs/dbraw/zinc/84/39/98/1354843998.db2.gz	JHCJCIXFEPGEMW-HUUCEWRRSA-N	0	3	340.423	3.047	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccncc2OC(C)C)CC[C@@H]1C	ZINC001071701864	1354862242	/nfs/dbraw/zinc/86/22/42/1354862242.db2.gz	PLUUSCJIEYVNGY-HOTGVXAUSA-N	0	3	331.460	3.028	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2(c3cccc(F)c3)CCC2)CC[C@H]1C	ZINC001071728266	1354883871	/nfs/dbraw/zinc/88/38/71/1354883871.db2.gz	KANCJDLSIONSBF-VQIMIIECSA-N	0	3	342.458	3.240	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(C(C)C)nc2CC)CC[C@@H]1C	ZINC001071828075	1354965930	/nfs/dbraw/zinc/96/59/30/1354965930.db2.gz	IPTYUEBUPCUPQR-DLBZAZTESA-N	0	3	341.499	3.373	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cn(CC)nc2C(C)C)CC[C@H]1C	ZINC001071854639	1354982554	/nfs/dbraw/zinc/98/25/54/1354982554.db2.gz	DASQZUBUXHAZKD-CVEARBPZSA-N	0	3	332.492	3.185	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cccc3c2ccn3C)CC[C@@H]1C	ZINC001071900581	1355014705	/nfs/dbraw/zinc/01/47/05/1355014705.db2.gz	KKQFEYOQGDXHCD-HOTGVXAUSA-N	0	3	325.456	3.337	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccccc2OCC(C)C)CC[C@@H]1C	ZINC001071904178	1355016318	/nfs/dbraw/zinc/01/63/18/1355016318.db2.gz	DNDWNYKWTDRJNV-ZWKOTPCHSA-N	0	3	342.483	3.327	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc3scnc3c2)CC[C@H]1C	ZINC001071960649	1355044554	/nfs/dbraw/zinc/04/45/54/1355044554.db2.gz	GNJNMQXLIMLYEL-UKRRQHHQSA-N	0	3	329.469	3.455	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc3nc(C)sc3c2)CC[C@@H]1C	ZINC001071960826	1355045005	/nfs/dbraw/zinc/04/50/05/1355045005.db2.gz	IHLKGYAVTHEABB-XJKSGUPXSA-N	0	3	341.480	3.211	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2(c3ccccc3F)CCC2)CC[C@@H]1C	ZINC001071990301	1355061566	/nfs/dbraw/zinc/06/15/66/1355061566.db2.gz	XTHDRVWNXJTZBY-IRXDYDNUSA-N	0	3	342.458	3.240	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CC[C@H](C)N(CC3=CCCCC3)C2)cn1	ZINC001072002007	1355067245	/nfs/dbraw/zinc/06/72/45/1355067245.db2.gz	IISWRIHLAMGHKM-JXFKEZNVSA-N	0	3	337.467	3.146	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc(C)n(CC3CC3)c2C)CC[C@@H]1C	ZINC001072002725	1355068490	/nfs/dbraw/zinc/06/84/90/1355068490.db2.gz	NYHNXJZDZYUTJW-HNAYVOBHSA-N	0	3	341.499	3.121	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2cc(C3CCCC3)no2)CC[C@@H]1C	ZINC001072087865	1355120650	/nfs/dbraw/zinc/12/06/50/1355120650.db2.gz	CJMKVGBQVHRWBO-HOCLYGCPSA-N	0	3	331.460	3.491	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)Cc2ccc(OC(C)C)cc2)CC[C@H]1C	ZINC001072088471	1355121657	/nfs/dbraw/zinc/12/16/57/1355121657.db2.gz	MARCKPYWUOGFJU-AEFFLSMTSA-N	0	3	330.472	3.171	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccccc2CC(C)C)CC[C@H]1C	ZINC001072106996	1355134823	/nfs/dbraw/zinc/13/48/23/1355134823.db2.gz	ZDIFXLTYZHHGFP-IEBWSBKVSA-N	0	3	326.484	3.491	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(CC)c(CC)c2)CC[C@@H]1C	ZINC001072124355	1355142316	/nfs/dbraw/zinc/14/23/16/1355142316.db2.gz	ZITBTMOXXROXCF-JXFKEZNVSA-N	0	3	326.484	3.417	20	30		EGEDHN
CC#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)C2CCC2)CC1	ZINC001072129316	1355144907	/nfs/dbraw/zinc/14/49/07/1355144907.db2.gz	JVSYXIQETZSVOB-FQEVSTJZSA-N	0	3	339.483	3.088	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)[C@H]1COc2ccccc21	ZINC001089735761	1360640830	/nfs/dbraw/zinc/64/08/30/1360640830.db2.gz	HSLDRYSTPFVAOX-WMZOPIPTSA-N	0	3	342.483	3.346	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2N(Cc2ccsc2)C(=O)C2CCC2)CC1	ZINC001072134080	1355148454	/nfs/dbraw/zinc/14/84/54/1355148454.db2.gz	CXDXJVMHKKDNLV-SFHVURJKSA-N	0	3	342.508	3.365	20	30		EGEDHN
C[C@@H]1CCN(C(=O)c2ccccc2)C[C@H]1CNCc1ccccc1C#N	ZINC001072174605	1355169085	/nfs/dbraw/zinc/16/90/85/1355169085.db2.gz	BAMAUPDBRJAZRA-DYESRHJHSA-N	0	3	347.462	3.446	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](C)[C@@H](CNCc2ccccc2C#N)C1	ZINC001072338523	1355246120	/nfs/dbraw/zinc/24/61/20/1355246120.db2.gz	CMSHTZOHWJZTJD-LPHOPBHVSA-N	0	3	339.483	3.345	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](C)[C@H](CNCc2nc(C)cs2)C1	ZINC001072338551	1355246210	/nfs/dbraw/zinc/24/62/10/1355246210.db2.gz	CZWCWVBEJCQXOL-UKRRQHHQSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](C)[C@@H](CNCc2nc(C)cs2)C1	ZINC001072338549	1355246405	/nfs/dbraw/zinc/24/64/05/1355246405.db2.gz	CZWCWVBEJCQXOL-HIFRSBDPSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](C)[C@@H](CNCc3csc(C)n3)C2)C1	ZINC001072364127	1355258838	/nfs/dbraw/zinc/25/88/38/1355258838.db2.gz	OYONRSYDYDJQPN-HOCLYGCPSA-N	0	3	347.528	3.382	20	30		EGEDHN
Cc1cccc(C(=O)N2CC3(C2)CCN(Cc2cccc(C#N)c2)C3)c1	ZINC001072435306	1355287129	/nfs/dbraw/zinc/28/71/29/1355287129.db2.gz	ZKPHFTBJTYANGB-UHFFFAOYSA-N	0	3	345.446	3.215	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC2(C1)CCN([C@H]1CCc3ccc(Cl)cc31)C2	ZINC001072551541	1355330586	/nfs/dbraw/zinc/33/05/86/1355330586.db2.gz	HGLSZVDXVHGZJJ-DYVFJYSZSA-N	0	3	343.858	3.021	20	30		EGEDHN
CC[C@@H](c1ccc(Cl)cc1)N1CCC2(CN(C(=O)[C@@H](C)C#N)C2)C1	ZINC001072553427	1355331015	/nfs/dbraw/zinc/33/10/15/1355331015.db2.gz	ZKJZBUGZCVFZKC-YOEHRIQHSA-N	0	3	345.874	3.485	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CN(C(=O)C[C@@H]4C=CCCC4)C3)C2)cc1	ZINC001072846093	1355462867	/nfs/dbraw/zinc/46/28/67/1355462867.db2.gz	MECBGAYFYPIBLL-GOSISDBHSA-N	0	3	349.478	3.339	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@@H](C)Cc3ccccc3Cl)C2)C1	ZINC001073021877	1355552552	/nfs/dbraw/zinc/55/25/52/1355552552.db2.gz	RFMKKKPEQZVEFL-HNNXBMFYSA-N	0	3	332.875	3.239	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)Cc3cccc4sccc43)C2)C1	ZINC001073033399	1355561802	/nfs/dbraw/zinc/56/18/02/1355561802.db2.gz	LAEHEFCXEHKRBE-UHFFFAOYSA-N	0	3	338.476	3.001	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3ccc(Cl)c4occc43)C2)C1	ZINC001073121415	1355608871	/nfs/dbraw/zinc/60/88/71/1355608871.db2.gz	XUQXTKGMNNUZDN-UHFFFAOYSA-N	0	3	330.815	3.420	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCCC[C@@H]2CN(C)Cc2ccccc2)cn1	ZINC001074093079	1356078891	/nfs/dbraw/zinc/07/88/91/1356078891.db2.gz	MAVNSLVYLIWOLI-OAQYLSRUSA-N	0	3	347.462	3.190	20	30		EGEDHN
COc1ccc(C(C)C)cc1CN[C@H]1CCN(C(=O)[C@H](C)C#N)[C@H]1C	ZINC001074568122	1356209883	/nfs/dbraw/zinc/20/98/83/1356209883.db2.gz	KLGJXDRWYUXOBT-VKJFTORMSA-N	0	3	343.471	3.057	20	30		EGEDHN
C[C@H]1[C@@H](NCc2ccc(C#N)s2)CCN1C(=O)C[C@H]1CC=CCC1	ZINC001074798527	1356245338	/nfs/dbraw/zinc/24/53/38/1356245338.db2.gz	ONYOKALGENHPME-MPGHIAIKSA-N	0	3	343.496	3.445	20	30		EGEDHN
C=CCN1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)c2ccc[nH]2)C1	ZINC001075418919	1356363222	/nfs/dbraw/zinc/36/32/22/1356363222.db2.gz	IADIJXVNBMDPAO-SJLPKXTDSA-N	0	3	341.430	3.175	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](C2CCN(C(=O)[C@@H](C)C#N)CC2)CC1	ZINC001075448228	1356380863	/nfs/dbraw/zinc/38/08/63/1356380863.db2.gz	RBSPPYSZNZOSHR-GOEBONIOSA-N	0	3	337.895	3.239	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](C2CCN(C(=O)C#CC3CC3)CC2)CC1	ZINC001075452724	1356387918	/nfs/dbraw/zinc/38/79/18/1356387918.db2.gz	ORDXQSJTPFBDCW-SFHVURJKSA-N	0	3	348.918	3.493	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cscc3C(F)F)[C@@H]2C1	ZINC001075800908	1356423380	/nfs/dbraw/zinc/42/33/80/1356423380.db2.gz	JNCWICAFLBOPCB-SMDDNHRTSA-N	0	3	326.412	3.408	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cc(F)cc4ccncc43)[C@@H]2C1	ZINC001075805088	1356423820	/nfs/dbraw/zinc/42/38/20/1356423820.db2.gz	NDACUBACKLAJMQ-HNAYVOBHSA-N	0	3	339.414	3.096	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3csc(C(F)(F)F)c3)[C@@H]2C1	ZINC001075986367	1356462107	/nfs/dbraw/zinc/46/21/07/1356462107.db2.gz	AVXAYHZXMIUWKP-WCQYABFASA-N	0	3	344.402	3.489	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)c3ccc(O[C@@H](C)CC)cc3)[C@@H]2C1	ZINC001076438598	1356578543	/nfs/dbraw/zinc/57/85/43/1356578543.db2.gz	IDSJALBSZMFJMS-VDZJLULYSA-N	0	3	328.456	3.196	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3oc4ccccc4c3CC)[C@@H]2C1	ZINC001076623098	1356637088	/nfs/dbraw/zinc/63/70/88/1356637088.db2.gz	GKPFYUPAHBGLML-MAUKXSAKSA-N	0	3	336.435	3.165	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@@H](C)Cc3ccc(F)cc3)[C@@H]2C1	ZINC001076627111	1356637903	/nfs/dbraw/zinc/63/79/03/1356637903.db2.gz	QQMYVMLOIJYKNS-VDZJLULYSA-N	0	3	330.447	3.113	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2ccc(O[C@H](C)CC)cc2)C1	ZINC001080731914	1357729566	/nfs/dbraw/zinc/72/95/66/1357729566.db2.gz	OTKCUJRLHZANSP-GPMSIDNRSA-N	0	3	330.472	3.490	20	30		EGEDHN
CCCCCCCCC(=O)N[C@@H](C)CCNC(=O)CN(C)CCC	ZINC001077665300	1356819647	/nfs/dbraw/zinc/81/96/47/1356819647.db2.gz	MSWDGTWBIBYGAB-KRWDZBQOSA-N	0	3	341.540	3.090	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)[C@H](C)Cn1ccc(C)n1	ZINC001099098071	1363620585	/nfs/dbraw/zinc/62/05/85/1363620585.db2.gz	IWCLPUKOBKANPI-AEFFLSMTSA-N	0	3	346.519	3.011	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@@H](C)c2cccs2)C[C@H]1C(F)(F)F	ZINC001099306121	1363740979	/nfs/dbraw/zinc/74/09/79/1363740979.db2.gz	OGDOGEWPFXMTMR-QJPTWQEYSA-N	0	3	332.391	3.017	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@H](NC(=O)C3CCC3)C23CCC3)c1	ZINC001078524657	1356993547	/nfs/dbraw/zinc/99/35/47/1356993547.db2.gz	VMBDEPFVELQFIS-ROUUACIJSA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@H](NC(=O)c2ccccc2)C12CCC2	ZINC001078539652	1357004560	/nfs/dbraw/zinc/00/45/60/1357004560.db2.gz	WDFTWYLMMJKMTO-CABCVRRESA-N	0	3	349.272	3.226	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2ccoc2Cl)C12CCC2	ZINC001078601704	1357030334	/nfs/dbraw/zinc/03/03/34/1357030334.db2.gz	LFINCSVZBZFNME-NEPJUHHUSA-N	0	3	329.227	3.316	20	30		EGEDHN
CC1(C(=O)N[C@H]2C[C@@H](NCc3ccc(C#N)cc3F)C23CCC3)CC1	ZINC001078628134	1357040761	/nfs/dbraw/zinc/04/07/61/1357040761.db2.gz	AYHVUNPPQCKMRR-SJORKVTESA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2c(C)noc2C2CC2)C12CCC2	ZINC001078683886	1357053610	/nfs/dbraw/zinc/05/36/10/1357053610.db2.gz	XXNSEYJQRVTZNX-ZIAGYGMSSA-N	0	3	349.862	3.244	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2cc(CCC)on2)C12CCC2	ZINC001078768691	1357074437	/nfs/dbraw/zinc/07/44/37/1357074437.db2.gz	VBSKTDWQNIOSHX-HUUCEWRRSA-N	0	3	337.851	3.010	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2cc3ccccc3n2CC)C1	ZINC001080988152	1357776200	/nfs/dbraw/zinc/77/62/00/1357776200.db2.gz	GYLQYYCVMPZMFJ-NVXWUHKLSA-N	0	3	325.456	3.287	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2ccc(Cl)c(C)c2)[C@H](OC)C1	ZINC001082093723	1357942301	/nfs/dbraw/zinc/94/23/01/1357942301.db2.gz	GMERJQIYVWSPRZ-IAGOWNOFSA-N	0	3	336.863	3.044	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)[C@@]2(C)CCC(C)=C(C)C2)[C@H](OC)C1	ZINC001082390765	1358026246	/nfs/dbraw/zinc/02/62/46/1358026246.db2.gz	CQXIHVGHVFCERK-GGPKGHCWSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)[C@H]3CCC(C)=C(C)C3)[C@H]2C1	ZINC001083091586	1358118362	/nfs/dbraw/zinc/11/83/62/1358118362.db2.gz	VOTSNLYHSHQFSI-GBESFXJTSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)c3cc(Cl)ccc3C)[C@H]2C1	ZINC001083228863	1358125858	/nfs/dbraw/zinc/12/58/58/1358125858.db2.gz	WWOABBYHNKBBCA-ZWKOTPCHSA-N	0	3	348.874	3.140	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)C[C@H]3CCCCC3(C)C)[C@H]2C1	ZINC001083292999	1358129155	/nfs/dbraw/zinc/12/91/55/1358129155.db2.gz	IPJOJIBEXNJEDQ-FGTMMUONSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)C[C@@H]3CCCCC3(C)C)[C@H]2C1	ZINC001083293318	1358129499	/nfs/dbraw/zinc/12/94/99/1358129499.db2.gz	XRHAISULIGEBGV-GBESFXJTSA-N	0	3	348.531	3.471	20	30		EGEDHN
C#Cc1ccc(C(=O)N2C[C@H]3CCN(CC4=CCCCC4)C[C@H]32)cc1	ZINC001084568037	1358240514	/nfs/dbraw/zinc/24/05/14/1358240514.db2.gz	VRQPWFQWNXYPGN-NHCUHLMSSA-N	0	3	334.463	3.315	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3csc(-c4ccco4)n3)[C@@H]2C1	ZINC001084615604	1358255251	/nfs/dbraw/zinc/25/52/51/1358255251.db2.gz	DYSAKYABELGNMG-UKRRQHHQSA-N	0	3	343.452	3.126	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)C[C@H](C)c3ccc(CC)cc3)[C@@H]2C1	ZINC001084657196	1358271306	/nfs/dbraw/zinc/27/13/06/1358271306.db2.gz	VIRLKRKKALCPCQ-IOMROCGXSA-N	0	3	338.495	3.299	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3c(Cl)cccc3OC)[C@@H]2C1	ZINC001084851745	1358328897	/nfs/dbraw/zinc/32/88/97/1358328897.db2.gz	PPKCQSZMHBXPPT-UKRRQHHQSA-N	0	3	334.847	3.071	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@@H](C)c3c(F)cccc3F)C[C@@H]21	ZINC001084989944	1358360472	/nfs/dbraw/zinc/36/04/72/1358360472.db2.gz	MUGAMRQTXNUDHR-DAYGRLMNSA-N	0	3	346.421	3.014	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CCN(C(=O)[C@]45C[C@H]4CCC5)C[C@@H]32)cc1	ZINC001084993878	1358360948	/nfs/dbraw/zinc/36/09/48/1358360948.db2.gz	HLZKEDUHCYOGMN-XWSHUIEDSA-N	0	3	349.478	3.171	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CCN(C(=O)[C@@H]4C[C@H]4C4CC4)C[C@@H]32)cc1	ZINC001085053431	1358378878	/nfs/dbraw/zinc/37/88/78/1358378878.db2.gz	UYGDFPKKJMZASL-MHTWAQMVSA-N	0	3	349.478	3.027	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3c3ccc(C)s3)C[C@@H]21	ZINC001085053041	1358378923	/nfs/dbraw/zinc/37/89/23/1358378923.db2.gz	ZWKTVDUIQOFBPL-TVFCKZIOSA-N	0	3	342.508	3.106	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@@H](C)c3ccc(F)c(F)c3)C[C@@H]21	ZINC001085097419	1358389970	/nfs/dbraw/zinc/38/99/70/1358389970.db2.gz	GQPOQDVRDILAIL-KHYOSLBOSA-N	0	3	346.421	3.014	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@@H](CC)c3ccc(F)cc3)C[C@@H]21	ZINC001085103391	1358392168	/nfs/dbraw/zinc/39/21/68/1358392168.db2.gz	OACATSQKBSGKEY-HOJAQTOUSA-N	0	3	342.458	3.265	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C3CC(c4cccc(F)c4)C3)C[C@@H]21	ZINC001085106815	1358393161	/nfs/dbraw/zinc/39/31/61/1358393161.db2.gz	ROVWMKYYYQBZHL-GIESBBMHSA-N	0	3	342.458	3.428	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H]1CCCO[C@H]1C(C)C	ZINC001085202575	1358432445	/nfs/dbraw/zinc/43/24/45/1358432445.db2.gz	KMSXTWZREYCNOI-HZMVEIRTSA-N	0	3	342.911	3.207	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cccc2c1COCC2	ZINC001085222389	1358437347	/nfs/dbraw/zinc/43/73/47/1358437347.db2.gz	SGMOANVDHVFGNL-QZTJIDSGSA-N	0	3	348.874	3.142	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1nc(Cl)cs1	ZINC001085309173	1358462469	/nfs/dbraw/zinc/46/24/69/1358462469.db2.gz	BJGABVZPWFSKBP-NXEZZACHSA-N	0	3	334.272	3.180	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1coc(C2CCC2)n1	ZINC001085386994	1358485222	/nfs/dbraw/zinc/48/52/22/1358485222.db2.gz	UHCVSHRVAHIVFX-ZIAGYGMSSA-N	0	3	337.851	3.325	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)Cc1cccc(OC)c1	ZINC001085411145	1358492561	/nfs/dbraw/zinc/49/25/61/1358492561.db2.gz	GDKPFFNVZKPDQH-IAGOWNOFSA-N	0	3	336.863	3.007	20	30		EGEDHN
Cc1ccccc1[C@@H](C)N1CC[C@@H]1CN(C)C(=O)c1cc(C#N)c[nH]1	ZINC001085534913	1358571424	/nfs/dbraw/zinc/57/14/24/1358571424.db2.gz	WASKFODKIMXWSD-NVXWUHKLSA-N	0	3	336.439	3.102	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1ccc(F)c(C(F)F)c1	ZINC001085598931	1358624280	/nfs/dbraw/zinc/62/42/80/1358624280.db2.gz	DGSMKYFLIKCKTF-ZDUSSCGKSA-N	0	3	326.362	3.486	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@H]1CCc2ccc(OC)cc21	ZINC001085644395	1358657284	/nfs/dbraw/zinc/65/72/84/1358657284.db2.gz	MVVAFMYGENZJAM-MJGOQNOKSA-N	0	3	342.483	3.224	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1cc(C2CC2)[nH]c1C1CC1	ZINC001085670605	1358675433	/nfs/dbraw/zinc/67/54/33/1358675433.db2.gz	ABZAGHRYXKLMKZ-MRXNPFEDSA-N	0	3	327.472	3.492	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N(C)C[C@H]1CCN1CCC(=C)C	ZINC001085678084	1358682062	/nfs/dbraw/zinc/68/20/62/1358682062.db2.gz	AVCUYDGKQMLXJU-QGZVFWFLSA-N	0	3	328.456	3.364	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc(C(C)C)nn1CC	ZINC001085694894	1358690605	/nfs/dbraw/zinc/69/06/05/1358690605.db2.gz	UGNATKABXGMEBL-MRXNPFEDSA-N	0	3	332.492	3.139	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1csc(C(F)(F)F)c1	ZINC001085695475	1358691625	/nfs/dbraw/zinc/69/16/25/1358691625.db2.gz	KAQZIKVRQRGJLM-GFCCVEGCSA-N	0	3	332.391	3.489	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@H]1COc2ccc(Cl)cc21	ZINC001085722578	1358711793	/nfs/dbraw/zinc/71/17/93/1358711793.db2.gz	BHDWRDRKMWTYAQ-WBVHZDCISA-N	0	3	348.874	3.315	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1c(F)ccc(F)c1OC	ZINC001085759734	1358739094	/nfs/dbraw/zinc/73/90/94/1358739094.db2.gz	OJMOWODILGKHSW-CYBMUJFWSA-N	0	3	338.398	3.086	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc(F)c(F)cc1F	ZINC001085790590	1358765049	/nfs/dbraw/zinc/76/50/49/1358765049.db2.gz	OGLFEQGNYMHBRT-GFCCVEGCSA-N	0	3	326.362	3.216	20	30		EGEDHN
C#Cc1cncc(C(=O)N(C)C[C@@H]2CCN2CCCC2CCCC2)c1	ZINC001085809894	1358788126	/nfs/dbraw/zinc/78/81/26/1358788126.db2.gz	PWNYIDVGGLTDHL-FQEVSTJZSA-N	0	3	339.483	3.180	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@@H]1C[C@H]1c1ccc(OC)cc1	ZINC001085865700	1358831846	/nfs/dbraw/zinc/83/18/46/1358831846.db2.gz	LCBPSJUKWFLVHS-YSIASYRMSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1ccc(C(F)F)cc1F	ZINC001085892915	1358853070	/nfs/dbraw/zinc/85/30/70/1358853070.db2.gz	MOQLXNFFOCSSRX-ZDUSSCGKSA-N	0	3	326.362	3.486	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cccc(-c2cnco2)c1	ZINC001085904164	1358862810	/nfs/dbraw/zinc/86/28/10/1358862810.db2.gz	YIQYEIMKQPDFPG-SFHVURJKSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cnn([C@@H](C)CC)c1C	ZINC001085916881	1358876786	/nfs/dbraw/zinc/87/67/86/1358876786.db2.gz	LHJOIUXEDAIDAV-DOTOQJQBSA-N	0	3	332.492	3.275	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cnn(CCCC)c1CC	ZINC001085917578	1358877638	/nfs/dbraw/zinc/87/76/38/1358877638.db2.gz	DGMJWIXFPXSRJQ-QGZVFWFLSA-N	0	3	346.519	3.358	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc(Cl)cc2c1OCC2	ZINC001085990771	1358942267	/nfs/dbraw/zinc/94/22/67/1358942267.db2.gz	XXBQJYKJPGDEPC-MRXNPFEDSA-N	0	3	348.874	3.387	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@@H]2CCCc3ccccc32)C1	ZINC001086121606	1359002432	/nfs/dbraw/zinc/00/24/32/1359002432.db2.gz	AYDHOFUFMAWNTA-UWWQBHOKSA-N	0	3	332.875	3.343	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(OC(C)C)cc2)C1	ZINC001086266950	1359048428	/nfs/dbraw/zinc/04/84/28/1359048428.db2.gz	DQHVKMZZCLZRON-FZNQNYSPSA-N	0	3	336.863	3.324	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@H](CNC(=O)c3ccsc3)C2)c1	ZINC001086304159	1359061594	/nfs/dbraw/zinc/06/15/94/1359061594.db2.gz	QJYXXNNGKVRKJE-SAZUREKKSA-N	0	3	343.427	3.057	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc3ccccc3n2)C1	ZINC001086539331	1359136950	/nfs/dbraw/zinc/13/69/50/1359136950.db2.gz	BDABVOCKPIRDKM-CTYIDZIISA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(OC(C)C)cc2)C1	ZINC001086546859	1359140455	/nfs/dbraw/zinc/14/04/55/1359140455.db2.gz	DQHVKMZZCLZRON-KOMQPUFPSA-N	0	3	336.863	3.324	20	30		EGEDHN
CC(C)=CCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2cc(C#N)c[nH]2)C1	ZINC001086581508	1359154776	/nfs/dbraw/zinc/15/47/76/1359154776.db2.gz	BWZXMKOOVIRBOA-AZUAARDMSA-N	0	3	348.450	3.050	20	30		EGEDHN
C=C(C)CN1C[C@@H](c2ccccc2)[C@H](NC(=O)[C@H](C)c2cccnc2)C1	ZINC001086620117	1359165970	/nfs/dbraw/zinc/16/59/70/1359165970.db2.gz	YWMFSNBQNNCHGB-JRGCBEDISA-N	0	3	349.478	3.345	20	30		EGEDHN
C=C(Br)CN[C@@H]1CC[C@H](CNC(=O)C2CC(C)(C)C2)C1	ZINC001086688614	1359185758	/nfs/dbraw/zinc/18/57/58/1359185758.db2.gz	AWAMZFQMDOGDCN-GXTWGEPZSA-N	0	3	343.309	3.206	20	30		EGEDHN
C[C@@H]1CC2(CN1C(=O)C1CC1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001086895767	1359225204	/nfs/dbraw/zinc/22/52/04/1359225204.db2.gz	SYNMJHHXODSRRY-MRXNPFEDSA-N	0	3	337.467	3.171	20	30		EGEDHN
CC1(C)CC[C@H](C(=O)NCC2(NCc3cccc(C#N)c3)CC2)C1	ZINC001323541492	1387384188	/nfs/dbraw/zinc/38/41/88/1387384188.db2.gz	UAVSCQYMABXPOJ-KRWDZBQOSA-N	0	3	325.456	3.123	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccoc3Cl)C2)CC1	ZINC001086918363	1359246268	/nfs/dbraw/zinc/24/62/68/1359246268.db2.gz	LHCZHQIYTIPVMU-CQSZACIVSA-N	0	3	334.847	3.273	20	30		EGEDHN
C[C@H]1CC2(CN1C(=O)C#CC1CC1)CCN(CCC(F)(F)F)CC2	ZINC001086922586	1359248919	/nfs/dbraw/zinc/24/89/19/1359248919.db2.gz	VDAUIYYUZMKNJX-AWEZNQCLSA-N	0	3	342.405	3.055	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc(F)ccc3CC)C2)CC1	ZINC001086930898	1359254657	/nfs/dbraw/zinc/25/46/57/1359254657.db2.gz	SUEGJVSKYVSUJS-MRXNPFEDSA-N	0	3	342.458	3.338	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cn(C)c4ccccc34)C2)CC1	ZINC001086931205	1359255326	/nfs/dbraw/zinc/25/53/26/1359255326.db2.gz	BTOAPFYYRURXHC-KRWDZBQOSA-N	0	3	349.478	3.128	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@H]3CC[C@@H]4C[C@@H]4CC3)C2)CC1	ZINC001086934247	1359257953	/nfs/dbraw/zinc/25/79/53/1359257953.db2.gz	KPIZMZCBTXOINC-OKYOBFRVSA-N	0	3	328.500	3.149	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@H](C)c3cccs3)C2)CC1	ZINC001086941964	1359263822	/nfs/dbraw/zinc/26/38/22/1359263822.db2.gz	FKHHSSHFMWFXIT-HZPDHXFCSA-N	0	3	330.497	3.188	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@H](F)c3ccccc3)C2)CC1	ZINC001086945755	1359267064	/nfs/dbraw/zinc/26/70/64/1359267064.db2.gz	IEFNWIIWEHBGLU-SJLPKXTDSA-N	0	3	328.431	3.033	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)Cc3ccc(CC)cc3)C2)CC1	ZINC001086945682	1359267159	/nfs/dbraw/zinc/26/71/59/1359267159.db2.gz	GQMNYJUQQWMJEQ-SFHVURJKSA-N	0	3	338.495	3.128	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)[C@H](C)Cc3ccco3)C2)CC1	ZINC001086947507	1359269075	/nfs/dbraw/zinc/26/90/75/1359269075.db2.gz	AARSQJREGGVZPI-QZTJIDSGSA-N	0	3	342.483	3.185	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)Cc3ccc(F)cc3)C2)CC1	ZINC001086955083	1359275464	/nfs/dbraw/zinc/27/54/64/1359275464.db2.gz	CSFZOXGSQQVSEA-KRWDZBQOSA-N	0	3	342.458	3.095	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)Cc3ccccc3Cl)C2)CC1	ZINC001086955307	1359276295	/nfs/dbraw/zinc/27/62/95/1359276295.db2.gz	KJDMTUSSQJEZLK-INIZCTEOSA-N	0	3	344.886	3.219	20	30		EGEDHN
CC1(C)[C@H](NC(=O)C2CC2)[C@H]2CCCN(Cc3ccc(C#N)cc3)[C@@H]21	ZINC001087266790	1359338401	/nfs/dbraw/zinc/33/84/01/1359338401.db2.gz	QIZGVZJXOOMWEN-QRVBRYPASA-N	0	3	337.467	3.073	20	30		EGEDHN
C=CCC[N@H+]1CCC[C@@H]2[C@H](NC(=O)c3ccccc3[O-])C(C)(C)[C@H]21	ZINC001087271537	1359345349	/nfs/dbraw/zinc/34/53/49/1359345349.db2.gz	SRXTZXAFAIRMOQ-NJAFHUGGSA-N	0	3	328.456	3.187	20	30		EGEDHN
C=CCC[N@@H+]1CCC[C@@H]2[C@H](NC(=O)c3ccccc3[O-])C(C)(C)[C@H]21	ZINC001087271537	1359345353	/nfs/dbraw/zinc/34/53/53/1359345353.db2.gz	SRXTZXAFAIRMOQ-NJAFHUGGSA-N	0	3	328.456	3.187	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc(F)c3C)C(C)(C)[C@H]21	ZINC001087288234	1359366523	/nfs/dbraw/zinc/36/65/23/1359366523.db2.gz	TXHLVLYHBVDRRM-QRQLOZEOSA-N	0	3	342.458	3.376	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc2c(o1)CCCC2	ZINC001087289680	1359368810	/nfs/dbraw/zinc/36/88/10/1359368810.db2.gz	QMHVXKFRUSOQSE-AYOQOUSVSA-N	0	3	340.467	3.010	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc4cc(C)cn4c3)C(C)(C)[C@@H]21	ZINC001087290102	1359369664	/nfs/dbraw/zinc/36/96/64/1359369664.db2.gz	XEVBRBLXWZJQED-VAMGGRTRSA-N	0	3	349.478	3.100	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3c(C)oc(C)c3C)C(C)(C)[C@H]21	ZINC001087295411	1359375891	/nfs/dbraw/zinc/37/58/91/1359375891.db2.gz	JALMGVKNUSLRGD-QRQLOZEOSA-N	0	3	342.483	3.447	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc2ccsc2[nH]1	ZINC001087296787	1359377407	/nfs/dbraw/zinc/37/74/07/1359377407.db2.gz	FWQHEYPXLBWXKP-VNQPRFMTSA-N	0	3	341.480	3.081	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccccc3CC)C(C)(C)[C@@H]21	ZINC001087301573	1359384878	/nfs/dbraw/zinc/38/48/78/1359384878.db2.gz	FHPZJRLECOPPQT-VAMGGRTRSA-N	0	3	338.495	3.491	20	30		EGEDHN
C=CCN1CCC[C@@H]2[C@H](NC(=O)c3ocnc3C(F)F)C(C)(C)[C@H]21	ZINC001087303014	1359385961	/nfs/dbraw/zinc/38/59/61/1359385961.db2.gz	FGJUJAXYLIXYSV-SWHYSGLUSA-N	0	3	339.386	3.017	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cccc4cc[nH]c43)C(C)(C)[C@H]21	ZINC001087304701	1359388312	/nfs/dbraw/zinc/38/83/12/1359388312.db2.gz	GMCIKRSRQVBKNR-NEWSRXKRSA-N	0	3	335.451	3.020	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc(F)cc(Cl)c1	ZINC001087305466	1359390289	/nfs/dbraw/zinc/39/02/89/1359390289.db2.gz	SUDDTYMQDYFOAM-IXDOHACOSA-N	0	3	348.849	3.331	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(C)c(CC)o3)C(C)(C)[C@@H]21	ZINC001087312530	1359400817	/nfs/dbraw/zinc/40/08/17/1359400817.db2.gz	GSEUHLASIZTJHQ-ATZDWAIDSA-N	0	3	342.483	3.393	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)Cc3sc(C)cc3C)C(C)(C)[C@@H]21	ZINC001087315524	1359405686	/nfs/dbraw/zinc/40/56/86/1359405686.db2.gz	DHNWJUQUCBXJRR-ATZDWAIDSA-N	0	3	344.524	3.146	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3sc(C)nc3C)C(C)(C)[C@H]21	ZINC001087315927	1359406054	/nfs/dbraw/zinc/40/60/54/1359406054.db2.gz	KHKKNDIZKBUOLW-OIISXLGYSA-N	0	3	345.512	3.002	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(F)cc3Cl)C(C)(C)[C@H]21	ZINC001087315915	1359406226	/nfs/dbraw/zinc/40/62/26/1359406226.db2.gz	KFZQSHWPOYXVBN-OIISXLGYSA-N	0	3	348.849	3.331	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)Cc3sc(C)cc3C)C(C)(C)[C@H]21	ZINC001087315526	1359406237	/nfs/dbraw/zinc/40/62/37/1359406237.db2.gz	DHNWJUQUCBXJRR-LZQZEXGQSA-N	0	3	344.524	3.146	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cnc(C(C)C)s3)C(C)(C)[C@H]21	ZINC001087320436	1359413314	/nfs/dbraw/zinc/41/33/14/1359413314.db2.gz	DUURQMCQAYFHAL-KBMXLJTQSA-N	0	3	345.512	3.119	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)C(C)=C2CCC2)C1	ZINC001087427170	1359461569	/nfs/dbraw/zinc/46/15/69/1359461569.db2.gz	OFVOWQKWZZSUKZ-NHCUHLMSSA-N	0	3	336.479	3.484	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)c2c[nH]c(C#N)c2)CCN1C/C=C/c1ccccc1	ZINC001087548676	1359526474	/nfs/dbraw/zinc/52/64/74/1359526474.db2.gz	IVCMJMCROXNKRI-XCBOUCJHSA-N	0	3	348.450	3.182	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)[C@H]2CCc3cc(C)ccc3O2)[C@H]1CC	ZINC001087658340	1359575850	/nfs/dbraw/zinc/57/58/50/1359575850.db2.gz	ZSXOHNIZNJBZDQ-NLWGTHIKSA-N	0	3	342.483	3.234	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2c(C)occ2C(F)(F)F)[C@H]1CC	ZINC001087659794	1359576274	/nfs/dbraw/zinc/57/62/74/1359576274.db2.gz	AVHSVSVKIRVBRL-UONOGXRCSA-N	0	3	342.361	3.213	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)C[C@@H]2C[C@H]2Cc2ccccc2)[C@H]1CC	ZINC001087667577	1359579927	/nfs/dbraw/zinc/57/99/27/1359579927.db2.gz	CTZQLGLJRKVGKJ-FUMNGEBKSA-N	0	3	326.484	3.410	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2oc3ccccc3c2OC)[C@H]1CC	ZINC001087683569	1359588300	/nfs/dbraw/zinc/58/83/00/1359588300.db2.gz	IXEGOCNGHYXHGC-JKSUJKDBSA-N	0	3	340.423	3.047	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)C(C)(C)c2c(C)noc2C)[C@H]1CC	ZINC001087695341	1359595487	/nfs/dbraw/zinc/59/54/87/1359595487.db2.gz	YIMLQMMYJRTQNN-JKSUJKDBSA-N	0	3	333.476	3.114	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccnc(C3CCCC3)n2)[C@H]1CC	ZINC001087779948	1359640397	/nfs/dbraw/zinc/64/03/97/1359640397.db2.gz	HCAJUJRUDIPHFD-FUHWJXTLSA-N	0	3	342.487	3.293	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccc3scnc3c2)[C@H]1CC	ZINC001087781621	1359640769	/nfs/dbraw/zinc/64/07/69/1359640769.db2.gz	VAQFTHMBDRZWEX-GOEBONIOSA-N	0	3	329.469	3.455	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CCN(Cc3sc(C)nc3C)C[C@H]2C1	ZINC001088066340	1359740222	/nfs/dbraw/zinc/74/02/22/1359740222.db2.gz	GLOLXKDSYLOONG-CVEARBPZSA-N	0	3	347.528	3.252	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3c(Cl)cccc3Cl)C[C@@H]2C1	ZINC001088180985	1359784192	/nfs/dbraw/zinc/78/41/92/1359784192.db2.gz	MUQDHVOQTAPSMF-OLZOCXBDSA-N	0	3	337.250	3.021	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](CNCc2oc(C)nc2C)[C@H](C)C1	ZINC001184231135	1387417065	/nfs/dbraw/zinc/41/70/65/1387417065.db2.gz	LHROPLGVCMHGKG-QAPCUYQASA-N	0	3	345.487	3.059	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2cccc3[nH]ncc32)C1	ZINC001088358263	1359841611	/nfs/dbraw/zinc/84/16/11/1359841611.db2.gz	YNEOGQUBVHEZFO-AWEZNQCLSA-N	0	3	346.862	3.290	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCCC[C@H](NCc2cccnc2OC)C1	ZINC001088360079	1359843810	/nfs/dbraw/zinc/84/38/10/1359843810.db2.gz	PUROYVTUMQRCCM-KRWDZBQOSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCCCN(C(=O)C2(CC)CC2)C1	ZINC001088376570	1359859026	/nfs/dbraw/zinc/85/90/26/1359859026.db2.gz	KJLLUQCBMVZAID-CQSZACIVSA-N	0	3	343.309	3.446	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2ccncc2Cl)C1	ZINC001088387887	1359866614	/nfs/dbraw/zinc/86/66/14/1359866614.db2.gz	HOTYGXVHSZKAJR-CYBMUJFWSA-N	0	3	342.270	3.462	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCCN1C(=O)C1CC=CC1	ZINC001089145263	1360200561	/nfs/dbraw/zinc/20/05/61/1360200561.db2.gz	QUKFCQBWANPZDD-FQEVSTJZSA-N	0	3	337.467	3.337	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCCN1C(=O)c1cc[nH]c1	ZINC001089181725	1360231510	/nfs/dbraw/zinc/23/15/10/1360231510.db2.gz	GNUBXTQPLUWLOL-IBGZPJMESA-N	0	3	336.439	3.013	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C[C@@H]2CCC(F)(F)C2)CC(C)(C)C1	ZINC001089403286	1360402479	/nfs/dbraw/zinc/40/24/79/1360402479.db2.gz	QGLGHXJBXPVBSS-LSDHHAIUSA-N	0	3	326.431	3.052	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(Cl)cc2OC)CC(C)(C)C1	ZINC001089472706	1360455981	/nfs/dbraw/zinc/45/59/81/1360455981.db2.gz	NPACPTSIZVPJDQ-OAHLLOKOSA-N	0	3	348.874	3.202	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc3ncccc3c2)CC(C)(C)C1	ZINC001089479021	1360461218	/nfs/dbraw/zinc/46/12/18/1360461218.db2.gz	CDBBOHAHFNZCLM-SFHVURJKSA-N	0	3	335.451	3.088	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@H]2[C@@H]3CCCCCC[C@@H]32)CC(C)(C)C1	ZINC001089502046	1360476247	/nfs/dbraw/zinc/47/62/47/1360476247.db2.gz	LDVABRCIJGSXHV-YRXWBPOGSA-N	0	3	330.516	3.443	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccn(C(CC)CC)n2)CC(C)(C)C1	ZINC001089512129	1360483939	/nfs/dbraw/zinc/48/39/39/1360483939.db2.gz	ZUNVXJXVVPSBFT-INIZCTEOSA-N	0	3	344.503	3.098	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2sc(C)cc2C)CC(C)(C)C1	ZINC001089548637	1360502075	/nfs/dbraw/zinc/50/20/75/1360502075.db2.gz	OBNUWWPOUYJIFR-MRXNPFEDSA-N	0	3	332.513	3.147	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(F)cc2Cl)CC(C)(C)C1	ZINC001089551877	1360503335	/nfs/dbraw/zinc/50/33/35/1360503335.db2.gz	KUUPMMHCIXKSDK-AWEZNQCLSA-N	0	3	336.838	3.333	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc(C3CCCC3)no2)CC(C)(C)C1	ZINC001089554673	1360505981	/nfs/dbraw/zinc/50/59/81/1360505981.db2.gz	YFMMQMWDRLGEKA-INIZCTEOSA-N	0	3	343.471	3.186	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2c[nH]c3ccc(C)cc23)CC(C)(C)C1	ZINC001089564902	1360511477	/nfs/dbraw/zinc/51/14/77/1360511477.db2.gz	KPOFEWDFWPZSDG-MRXNPFEDSA-N	0	3	337.467	3.330	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H]1CCCc2n[nH]cc21	ZINC001089641810	1360554705	/nfs/dbraw/zinc/55/47/05/1360554705.db2.gz	UEKYMTWTJGMTSQ-HZPDHXFCSA-N	0	3	344.503	3.013	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc2cc[nH]c2n1	ZINC001089652956	1360565848	/nfs/dbraw/zinc/56/58/48/1360565848.db2.gz	MJAGPFYXJBKXBO-INIZCTEOSA-N	0	3	340.471	3.359	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cnc2cc[nH]c2c1	ZINC001089656855	1360568517	/nfs/dbraw/zinc/56/85/17/1360568517.db2.gz	NFYMDQOECAGVDA-MRXNPFEDSA-N	0	3	340.471	3.359	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cccc(COC)c1	ZINC001089665816	1360575771	/nfs/dbraw/zinc/57/57/71/1360575771.db2.gz	GEPBTBAJWVXVST-LJQANCHMSA-N	0	3	342.483	3.077	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cccc(C(C)C)n1	ZINC001089666002	1360575924	/nfs/dbraw/zinc/57/59/24/1360575924.db2.gz	JDDZMWKRVYVTMS-QGZVFWFLSA-N	0	3	341.499	3.449	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1c(C)cc(C)nc1C	ZINC001089674478	1360583434	/nfs/dbraw/zinc/58/34/34/1360583434.db2.gz	AENCVHAWSJYRGE-QGZVFWFLSA-N	0	3	329.488	3.413	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccnc2ccncc21	ZINC001089676333	1360584352	/nfs/dbraw/zinc/58/43/52/1360584352.db2.gz	DVNOAYJODNQZAX-HNNXBMFYSA-N	0	3	338.455	3.036	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(F)ccc1OC	ZINC001089676300	1360584444	/nfs/dbraw/zinc/58/44/44/1360584444.db2.gz	DCOIZOVWPPDUTJ-MRXNPFEDSA-N	0	3	346.446	3.078	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(F)c(OC)c1	ZINC001089696962	1360602099	/nfs/dbraw/zinc/60/20/99/1360602099.db2.gz	KDEJERQKLJETBR-HNNXBMFYSA-N	0	3	334.435	3.241	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc2ccncc2c1	ZINC001089719511	1360621994	/nfs/dbraw/zinc/62/19/94/1360621994.db2.gz	FEYTUTSJRACVEB-FQEVSTJZSA-N	0	3	349.478	3.479	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1coc(CCC)n1	ZINC001089726092	1360629186	/nfs/dbraw/zinc/62/91/86/1360629186.db2.gz	MZACOCDPNLKZOS-OAHLLOKOSA-N	0	3	333.476	3.424	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)c2ccoc2CC)C1	ZINC001089804978	1360671178	/nfs/dbraw/zinc/67/11/78/1360671178.db2.gz	YKGCPONIAURZBI-HJWJTTGWSA-N	0	3	348.874	3.377	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)Cc2ccccc2)C1	ZINC001089825296	1360682305	/nfs/dbraw/zinc/68/23/05/1360682305.db2.gz	AXMRPLKVGTUAPG-VJANTYMQSA-N	0	3	344.886	3.150	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](CNCc2cnc(C)o2)[C@H](C)C1	ZINC001184474124	1387468406	/nfs/dbraw/zinc/46/84/06/1387468406.db2.gz	TTWBRZJZFLAGSO-GDBMZVCRSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1cc(C)co1	ZINC001089850935	1360697700	/nfs/dbraw/zinc/69/77/00/1360697700.db2.gz	RKWBGEUTRKDNAD-FZKCQIBNSA-N	0	3	334.847	3.123	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1(CC)CCC1	ZINC001089852294	1360697932	/nfs/dbraw/zinc/69/79/32/1360697932.db2.gz	ZZVPUZHJJHRUQY-HZMVEIRTSA-N	0	3	336.907	3.488	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](CNCc2ccccc2C#N)[C@@H](C)C1	ZINC001184496399	1387471820	/nfs/dbraw/zinc/47/18/20/1387471820.db2.gz	CBNYMHUZSDNGIT-PKOBYXMFSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=C(C)CN1CC[C@@H](NC(=O)c2ccccc2CC(C)(C)C)[C@H](O)C1	ZINC001090347317	1360894028	/nfs/dbraw/zinc/89/40/28/1360894028.db2.gz	POKHQRXARNSICG-RTBURBONSA-N	0	3	344.499	3.016	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cccc(C3CCCC3)c2)[C@@H](O)C1	ZINC001090722793	1360928323	/nfs/dbraw/zinc/92/83/23/1360928323.db2.gz	PYUBBBWWXCRFSB-PMACEKPBSA-N	0	3	342.483	3.085	20	30		EGEDHN
C=C(C)CN1CC[C@@H](NC(=O)c2cccc(C3CCCC3)c2)[C@H](O)C1	ZINC001090722796	1360928391	/nfs/dbraw/zinc/92/83/91/1360928391.db2.gz	PYUBBBWWXCRFSB-WOJBJXKFSA-N	0	3	342.483	3.085	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc(C)c3ccccc3n2)C1	ZINC001091103606	1360993248	/nfs/dbraw/zinc/99/32/48/1360993248.db2.gz	BLGDFZIWAVCURU-UHFFFAOYSA-N	0	3	343.858	3.394	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2coc(C3CCCC3)n2)C1	ZINC001091304930	1361037239	/nfs/dbraw/zinc/03/72/39/1361037239.db2.gz	QIDZDTLUPKDOQT-UHFFFAOYSA-N	0	3	337.851	3.183	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cccc(-c4ccoc4)c3)C[C@]2(C)C1	ZINC001092180425	1361315779	/nfs/dbraw/zinc/31/57/79/1361315779.db2.gz	USRQDRVFXVJWPL-IRLDBZIGSA-N	0	3	348.446	3.364	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)C3CCC(C(C)(C)C)CC3)C[C@]2(C)C1	ZINC001092248278	1361340468	/nfs/dbraw/zinc/34/04/68/1361340468.db2.gz	PSGALOMEPDDLJV-PKZBPHAMSA-N	0	3	330.516	3.252	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc(CC(C)C)cc3)C[C@]2(C)C1	ZINC001092263298	1361348874	/nfs/dbraw/zinc/34/88/74/1361348874.db2.gz	LYLBUUWGOFQSLT-IRLDBZIGSA-N	0	3	338.495	3.302	20	30		EGEDHN
Cc1cc(C(=O)NC[C@@H]2CN(Cc3ccc(C#N)s3)C[C@H]2C)co1	ZINC001092564248	1361411572	/nfs/dbraw/zinc/41/15/72/1361411572.db2.gz	IPKAHSGIZDQSHZ-IUODEOHRSA-N	0	3	343.452	3.019	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NC[C@@H]1CN(C[C@@H](F)CC)C[C@H]1C	ZINC001092740538	1361450733	/nfs/dbraw/zinc/45/07/33/1361450733.db2.gz	PTZMSRHSFVTTQY-ZACQAIPSSA-N	0	3	348.462	3.297	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)c2ccsc2C)CC1	ZINC001093370466	1361579939	/nfs/dbraw/zinc/57/99/39/1361579939.db2.gz	UJILKDMRVUNKHS-SFHVURJKSA-N	0	3	342.508	3.396	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)[C@@H](C)C(C)(F)F)CC1	ZINC001093380074	1361590475	/nfs/dbraw/zinc/59/04/75/1361590475.db2.gz	QAOITFDBNSOAKE-GDBMZVCRSA-N	0	3	338.442	3.004	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cc(C)cc(Cl)c3)CCC[C@@H]12	ZINC001094469048	1361816674	/nfs/dbraw/zinc/81/66/74/1361816674.db2.gz	GTFUNCGHFUHMPZ-IEBWSBKVSA-N	0	3	330.859	3.256	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cc(C(C)(C)C)oc3C)CCC[C@@H]12	ZINC001094524517	1361843582	/nfs/dbraw/zinc/84/35/82/1361843582.db2.gz	HQBSYQIRWXYYMB-DYESRHJHSA-N	0	3	342.483	3.493	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cc(C)c(F)cc3Cl)CCC[C@@H]12	ZINC001094567819	1361864217	/nfs/dbraw/zinc/86/42/17/1361864217.db2.gz	IUWXXRXGCZIDLL-IEBWSBKVSA-N	0	3	348.849	3.395	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](NCc2ccc(Cl)nc2)C1	ZINC001184889851	1387555248	/nfs/dbraw/zinc/55/52/48/1387555248.db2.gz	BOGDAGFRCMJOIN-MRXNPFEDSA-N	0	3	333.863	3.009	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](NCc2cc(C)ccc2F)C1	ZINC001184900278	1387558134	/nfs/dbraw/zinc/55/81/34/1387558134.db2.gz	NXPZYISTBRNPMP-GOSISDBHSA-N	0	3	330.447	3.408	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(-c3cc[nH]n3)s1)C2	ZINC001095578155	1362174650	/nfs/dbraw/zinc/17/46/50/1362174650.db2.gz	SJSXCDFMIGSAQP-SNPRPXQTSA-N	0	3	342.468	3.049	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](CNCc2cnc(C)o2)[C@@H](C)C1	ZINC001184943919	1387566991	/nfs/dbraw/zinc/56/69/91/1387566991.db2.gz	BKOLMJAMZKWQKF-WMZOPIPTSA-N	0	3	345.487	3.141	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(Cl)c(OC)c1)C2	ZINC001096109043	1362386314	/nfs/dbraw/zinc/38/63/14/1362386314.db2.gz	ZJQRIFMPTILXKT-KBMXLJTQSA-N	0	3	334.847	3.260	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@]1(C)CCCc3ccccc31)C2	ZINC001096173146	1362413936	/nfs/dbraw/zinc/41/39/36/1362413936.db2.gz	DLIPOQMPISZCPX-IWLVTHKOSA-N	0	3	336.479	3.025	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3[C@H](C)c2ccccc2)nc1	ZINC001096380725	1362478932	/nfs/dbraw/zinc/47/89/32/1362478932.db2.gz	QLLIJHYBLBCVDF-NXXWWENFSA-N	0	3	345.446	3.159	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccccc1	ZINC001097224635	1362892234	/nfs/dbraw/zinc/89/22/34/1362892234.db2.gz	NWUPRWNECKYKHB-QRVBRYPASA-N	0	3	335.451	3.209	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@H]1CCOc3ccccc31)C2	ZINC001097642821	1363087618	/nfs/dbraw/zinc/08/76/18/1363087618.db2.gz	PDBIQYVHEMMMAX-RWQQGDIJSA-N	0	3	340.467	3.240	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3[C@@H](C)c2ccccc2)c1	ZINC001097813077	1363128732	/nfs/dbraw/zinc/12/87/32/1363128732.db2.gz	NEZMIQIBGMQKMO-NOOVBMIQSA-N	0	3	345.446	3.159	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cccnc1OCC(C)C)C2	ZINC001098237378	1363265242	/nfs/dbraw/zinc/26/52/42/1363265242.db2.gz	PUVPXYRDDJVVIW-NXHRZFHOSA-N	0	3	343.471	3.028	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@H]1CCC3(CCC3)CO1)C2	ZINC001098258251	1363273887	/nfs/dbraw/zinc/27/38/87/1363273887.db2.gz	VIJROPMFRPBXMU-TVFCKZIOSA-N	0	3	332.488	3.023	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1cccc(OC(C)C)c1)C2	ZINC001098483477	1363339651	/nfs/dbraw/zinc/33/96/51/1363339651.db2.gz	WYZSBWZCICAMHP-RLLQIKCJSA-N	0	3	342.483	3.314	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1c(C)oc3ccccc31)C2	ZINC001098529541	1363355008	/nfs/dbraw/zinc/35/50/08/1363355008.db2.gz	FCRFLAOIKWPOOL-LZQZEXGQSA-N	0	3	336.435	3.029	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H](C)c1cccs1)C[C@H](C)O2	ZINC001098635199	1363409351	/nfs/dbraw/zinc/40/93/51/1363409351.db2.gz	DWJDHVOZNRIJGA-HOTGVXAUSA-N	0	3	348.512	3.120	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccc(F)cc1C)C[C@H](C)O2	ZINC001098654754	1363419999	/nfs/dbraw/zinc/41/99/99/1363419999.db2.gz	GHLZJZHFEMBIQD-INIZCTEOSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1cc(C)cc(C)c1)C[C@@H](C)O2	ZINC001098659642	1363423149	/nfs/dbraw/zinc/42/31/49/1363423149.db2.gz	LNEAPUTVICUQDN-GOSISDBHSA-N	0	3	342.483	3.185	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3CCC[C@]3(NC(=O)C=C3CCC3)C2)cc1	ZINC001098785538	1363467349	/nfs/dbraw/zinc/46/73/49/1363467349.db2.gz	GOOMARDNMAOQMU-FPOVZHCZSA-N	0	3	335.451	3.139	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2nc(C(C)C)oc2C)C1	ZINC001098834832	1363487631	/nfs/dbraw/zinc/48/76/31/1363487631.db2.gz	DIBVMRZLXMQDOD-KXBFYZLASA-N	0	3	331.460	3.267	20	30		EGEDHN
C=CCCC(=O)NC[C@@H]1CCC(C)(C)CN1CCc1cnn(CC)c1	ZINC001098966071	1363545207	/nfs/dbraw/zinc/54/52/07/1363545207.db2.gz	GMHRVPONWDCMOA-SFHVURJKSA-N	0	3	346.519	3.019	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2csc(-c3ccco3)n2)C1	ZINC001099002618	1363566423	/nfs/dbraw/zinc/56/64/23/1363566423.db2.gz	HMIRQNWIEHTWHU-UGSOOPFHSA-N	0	3	343.452	3.173	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)C(C)=C1CCC1	ZINC001099065141	1363604250	/nfs/dbraw/zinc/60/42/50/1363604250.db2.gz	NPWRYZOPIKAGOE-SFHVURJKSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)C[C@H](C)n1ccnc1CC	ZINC001099080123	1363611772	/nfs/dbraw/zinc/61/17/72/1363611772.db2.gz	MOVKKUUWNAPQHU-IRXDYDNUSA-N	0	3	346.519	3.189	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H](C)C(C)(C)C	ZINC001099121283	1363635587	/nfs/dbraw/zinc/63/55/87/1363635587.db2.gz	JXHJLFJDRDGQHL-IAGOWNOFSA-N	0	3	338.536	3.478	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)C1CC2(CCC2)C1	ZINC001099182259	1363677265	/nfs/dbraw/zinc/67/72/65/1363677265.db2.gz	IQMBSFQVLGKKBZ-SFHVURJKSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)CCOc1ccc(F)cc1	ZINC001099208287	1363692901	/nfs/dbraw/zinc/69/29/01/1363692901.db2.gz	PUPXVAQJFAXQKK-QGZVFWFLSA-N	0	3	348.462	3.387	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@](C)(C=C)CC	ZINC001099214172	1363694771	/nfs/dbraw/zinc/69/47/71/1363694771.db2.gz	HPLJYTBXRJGUQI-YLJYHZDGSA-N	0	3	336.520	3.398	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@]12C[C@H]1CCCC2	ZINC001099220496	1363698515	/nfs/dbraw/zinc/69/85/15/1363698515.db2.gz	OMFGINSFEVBVQF-DBXWQHBBSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H](C)C(C)(F)F	ZINC001099234864	1363705737	/nfs/dbraw/zinc/70/57/37/1363705737.db2.gz	NRRDOCVQVYURSH-HUUCEWRRSA-N	0	3	346.462	3.087	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)CCc1scnc1C	ZINC001099286332	1363733312	/nfs/dbraw/zinc/73/33/12/1363733312.db2.gz	UTGMONVEAATPBE-OAHLLOKOSA-N	0	3	335.517	3.177	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)C(C1CC1)C1CC1	ZINC001099303304	1363739058	/nfs/dbraw/zinc/73/90/58/1363739058.db2.gz	GBRFCZAGTOHSJW-SFHVURJKSA-N	0	3	348.531	3.232	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)COc1ccccc1	ZINC001099319533	1363747218	/nfs/dbraw/zinc/74/72/18/1363747218.db2.gz	AVARPNLXAVLBLA-KRWDZBQOSA-N	0	3	330.472	3.248	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2ccc3ccncc3c2)C[C@H]1C(F)(F)F	ZINC001099329345	1363753981	/nfs/dbraw/zinc/75/39/81/1363753981.db2.gz	RFISSJRFUYDZCR-HZPDHXFCSA-N	0	3	349.356	3.013	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)C(C)(C)c2ccccc2)C[C@H]1C(F)(F)F	ZINC001099339725	1363759803	/nfs/dbraw/zinc/75/98/03/1363759803.db2.gz	FQJQXKKEGCTDHW-HUUCEWRRSA-N	0	3	340.389	3.129	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)C1(CCOC)CCCC1	ZINC001099358919	1363772054	/nfs/dbraw/zinc/77/20/54/1363772054.db2.gz	LAJCSXVXLBCAMX-GOSISDBHSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=CCCOCC(=O)NC[C@@H]1CCC(C)(C)CN1Cc1ccccc1	ZINC001099364823	1363775440	/nfs/dbraw/zinc/77/54/40/1363775440.db2.gz	RUEZBJSCONRIQM-IBGZPJMESA-N	0	3	344.499	3.386	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)CCCC1CC1	ZINC001099513348	1363828476	/nfs/dbraw/zinc/82/84/76/1363828476.db2.gz	OIIKJGANARKLFF-MLHJIOFPSA-N	0	3	336.907	3.488	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CN(CC=C(C)C)CC2(CCOCC2)C1	ZINC001099578959	1363861377	/nfs/dbraw/zinc/86/13/77/1363861377.db2.gz	GOGHRXYULVISPV-IBGZPJMESA-N	0	3	346.515	3.134	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN(CC=C(C)C)CC2(CCOCC2)C1	ZINC001099583380	1363864510	/nfs/dbraw/zinc/86/45/10/1363864510.db2.gz	PVNVCKRXNRPRRY-SFHVURJKSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)[C@@H](C)C(CC)CC)CC2(CCOCC2)C1	ZINC001099583582	1363865852	/nfs/dbraw/zinc/86/58/52/1363865852.db2.gz	VLTFNLOJBWVCAP-FUHWJXTLSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C(C)(C)CCC)CC2(CCOCC2)C1	ZINC001099591135	1363873095	/nfs/dbraw/zinc/87/30/95/1363873095.db2.gz	UCPKWHAOHGIBPJ-KRWDZBQOSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN(CC=C(C)C)CC2(CCOCC2)C1	ZINC001099591028	1363873202	/nfs/dbraw/zinc/87/32/02/1363873202.db2.gz	QUVJQTZWMDIVRH-SFHVURJKSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCC2(C)CC2)CC2(CCOCC2)C1	ZINC001099595104	1363877867	/nfs/dbraw/zinc/87/78/67/1363877867.db2.gz	TUIKPXSOYFTTQG-QGZVFWFLSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=CCCC(=O)NCC1CC(NCC#Cc2ccccc2Cl)C1	ZINC001100176810	1364036487	/nfs/dbraw/zinc/03/64/87/1364036487.db2.gz	FZOKAOUNKSCKOS-UHFFFAOYSA-N	0	3	330.859	3.142	20	30		EGEDHN
O=C(NCC1CC(NCC#Cc2cccc(Cl)c2)C1)C1CC=CC1	ZINC001100210735	1364045496	/nfs/dbraw/zinc/04/54/96/1364045496.db2.gz	LFUZAWRUOPECDJ-UHFFFAOYSA-N	0	3	342.870	3.142	20	30		EGEDHN
C#CCCCC(=O)NCC1CC(N[C@@H](C)c2ccc(F)cc2F)C1	ZINC001100285881	1364067886	/nfs/dbraw/zinc/06/78/86/1364067886.db2.gz	XPYZMIKIVLOBOG-HLIUYOAVSA-N	0	3	334.410	3.314	20	30		EGEDHN
CC(C)C#CC(=O)NCC1CC(NCc2cccc(F)c2Cl)C1	ZINC001100309462	1364076680	/nfs/dbraw/zinc/07/66/80/1364076680.db2.gz	WPHZHFMJJRLVIY-UHFFFAOYSA-N	0	3	336.838	3.123	20	30		EGEDHN
C[C@@H](NC1CC(CNC(=O)C#CC2CC2)C1)c1ccccc1Cl	ZINC001100316167	1364077961	/nfs/dbraw/zinc/07/79/61/1364077961.db2.gz	WNMRRBIABIPPOD-IUDNXUCKSA-N	0	3	330.859	3.299	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCC1CC(NCc2ccncc2Cl)C1	ZINC001100364603	1364093058	/nfs/dbraw/zinc/09/30/58/1364093058.db2.gz	LXBXMRDUTJAUEO-UHFFFAOYSA-N	0	3	335.879	3.322	20	30		EGEDHN
CC(C)=C(C)CC(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100575993	1364170437	/nfs/dbraw/zinc/17/04/37/1364170437.db2.gz	HNRMWDVTSGFFIE-UHFFFAOYSA-N	0	3	342.458	3.408	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1	ZINC001100596105	1364180870	/nfs/dbraw/zinc/18/08/70/1364180870.db2.gz	KWZJNROVCPSZQW-MXWWQKGMSA-N	0	3	343.446	3.284	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)Cc2c(C)cc(C)cc2C)C1	ZINC001100633723	1364197619	/nfs/dbraw/zinc/19/76/19/1364197619.db2.gz	MFSPMAJQWXUPSN-UHFFFAOYSA-N	0	3	334.891	3.391	20	30		EGEDHN
C=CCC1(C(=O)NCC2CC(NCc3c(C)nsc3C)C2)CCC1	ZINC001100648541	1364204150	/nfs/dbraw/zinc/20/41/50/1364204150.db2.gz	GZLJMOLVPCLSOU-UHFFFAOYSA-N	0	3	347.528	3.491	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)CCCc2ccc(F)cc2)C1	ZINC001100700192	1364224461	/nfs/dbraw/zinc/22/44/61/1364224461.db2.gz	DBPASZGDMCZLKJ-UHFFFAOYSA-N	0	3	338.854	3.385	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H](CC)Cc2ccccc2)C1	ZINC001100722504	1364234966	/nfs/dbraw/zinc/23/49/66/1364234966.db2.gz	MCBVGQNQFIKFAL-ADKAHSJRSA-N	0	3	334.891	3.492	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)NCC1CC(NCC#Cc2ccccc2Cl)C1	ZINC001100723655	1364236119	/nfs/dbraw/zinc/23/61/19/1364236119.db2.gz	GMGFQQOLQIOJKX-KLHKWILBSA-N	0	3	346.902	3.468	20	30		EGEDHN
CC(C)C[C@H](C)C(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100795812	1364265102	/nfs/dbraw/zinc/26/51/02/1364265102.db2.gz	JPOBCHVPBKPHAZ-KKXNLOMOSA-N	0	3	326.484	3.205	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)C[C@H](C)CC(C)C)C1	ZINC001100855156	1364293772	/nfs/dbraw/zinc/29/37/72/1364293772.db2.gz	SMQGPURINRQKLE-LRVUVFPRSA-N	0	3	345.325	3.452	20	30		EGEDHN
CC(F)(F)C(C)(C)C(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100921441	1364332425	/nfs/dbraw/zinc/33/24/25/1364332425.db2.gz	UIHCJTOFGJELCS-UHFFFAOYSA-N	0	3	348.437	3.204	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)CC(C)(C)C(F)(F)F)C1	ZINC001100929981	1364334556	/nfs/dbraw/zinc/33/45/56/1364334556.db2.gz	GPBPUBYFWJGWMR-UHFFFAOYSA-N	0	3	326.790	3.202	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C2(C(F)(F)F)CCCC2)C1	ZINC001101073565	1364400422	/nfs/dbraw/zinc/40/04/22/1364400422.db2.gz	SYOCBTRQYQFTOM-UHFFFAOYSA-N	0	3	338.801	3.346	20	30		EGEDHN
C=C(C)CN1CC[C@H](Oc2ccnc(CNC(=O)CC(C)(C)C)c2)C1	ZINC001101090091	1364408334	/nfs/dbraw/zinc/40/83/34/1364408334.db2.gz	FYBZLBUXGCZMNE-SFHVURJKSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=CCN1CC[C@H](Oc2ccnc(CNC(=O)CC[C@@H](C)CC)c2)C1	ZINC001101097678	1364413504	/nfs/dbraw/zinc/41/35/04/1364413504.db2.gz	XXEHWEYOSHNOAL-LPHOPBHVSA-N	0	3	345.487	3.163	20	30		EGEDHN
CCC[C@@H](C)CCCC(=O)N1C[C@H]2CN(CC#CCOC)C[C@@]2(C)C1	ZINC001101250752	1364485684	/nfs/dbraw/zinc/48/56/84/1364485684.db2.gz	LCNQGUWTPRSPOX-SBHAEUEKSA-N	0	3	348.531	3.023	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C/C=C/c3cccc(F)c3)C[C@]2(C)C1	ZINC001101270446	1364493775	/nfs/dbraw/zinc/49/37/75/1364493775.db2.gz	NZMBTAYTQGCGIM-GLCUETTDSA-N	0	3	340.442	3.033	20	30		EGEDHN
C=CCCCC(=O)N1C[C@H]2CN(Cc3oc(CC)nc3C)C[C@@]2(C)C1	ZINC001101347911	1364520577	/nfs/dbraw/zinc/52/05/77/1364520577.db2.gz	OZDFPODAGDJRFO-UZLBHIALSA-N	0	3	345.487	3.182	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@H]3CN(CCC(F)(F)F)C[C@@]3(C)C2)CCC1	ZINC001101356345	1364525401	/nfs/dbraw/zinc/52/54/01/1364525401.db2.gz	QVQHJOXXDHNSBP-ZBFHGGJFSA-N	0	3	344.421	3.466	20	30		EGEDHN
C=CCC[C@H](C)N1CC2(C1)C[C@H](NC(=O)C(CC)CC)c1nccn12	ZINC001101610109	1364654848	/nfs/dbraw/zinc/65/48/48/1364654848.db2.gz	GUQZPBVYPYKUJK-RDJZCZTQSA-N	0	3	344.503	3.246	20	30		EGEDHN
C=CCC[C@H](C)N1CC2(C1)C[C@H](NC(=O)CC(C)(C)C)c1nccn12	ZINC001101610048	1364655007	/nfs/dbraw/zinc/65/50/07/1364655007.db2.gz	DVDWUZRBRJEBKJ-HOTGVXAUSA-N	0	3	344.503	3.246	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CC2(CN(C[C@H](C)CC)C2)n2ccnc21	ZINC001101630450	1364662303	/nfs/dbraw/zinc/66/23/03/1364662303.db2.gz	HOCUTZKRSMKJKK-HZPDHXFCSA-N	0	3	344.503	3.103	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CC2(CN(CC(CC)CC)C2)n2ccnc21	ZINC001101630983	1364662442	/nfs/dbraw/zinc/66/24/42/1364662442.db2.gz	PSTSGDJRXHVFJW-QGZVFWFLSA-N	0	3	344.503	3.248	20	30		EGEDHN
CC(C)CC(=O)NC[C@@H]1CN(CC#Cc2cccc(Cl)c2)C[C@H]1C	ZINC001101690333	1364689916	/nfs/dbraw/zinc/68/99/16/1364689916.db2.gz	VAPZTWIKSBHMEZ-SJLPKXTDSA-N	0	3	346.902	3.422	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1CNC(=O)CC1CCC1	ZINC001101856730	1364752053	/nfs/dbraw/zinc/75/20/53/1364752053.db2.gz	KBRQIOQPDKLZEA-RDTXWAMCSA-N	0	3	343.446	3.072	20	30		EGEDHN
CC[C@@H](C)CC(=O)NC[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1C	ZINC001101918707	1364774120	/nfs/dbraw/zinc/77/41/20/1364774120.db2.gz	ZXQQNYOCFYXYKG-IIDMSEBBSA-N	0	3	345.462	3.318	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1CNC(=O)CCCC1CC1	ZINC001102254084	1364968376	/nfs/dbraw/zinc/96/83/76/1364968376.db2.gz	PPTWICGINFXBMD-WIYYLYMNSA-N	0	3	338.495	3.303	20	30		EGEDHN
C=CCCC1(C(=O)NC[C@@H]2CN(Cc3cnc(C)s3)C[C@H]2C)CC1	ZINC001102325450	1365001626	/nfs/dbraw/zinc/00/16/26/1365001626.db2.gz	QNVCIIREGZIQML-GDBMZVCRSA-N	0	3	347.528	3.382	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@@H]1CN(Cc2cnc(C)s2)C[C@H]1C	ZINC001102409960	1365043014	/nfs/dbraw/zinc/04/30/14/1365043014.db2.gz	CYINGAXVYPLQQY-UKRRQHHQSA-N	0	3	335.517	3.238	20	30		EGEDHN
CCCCC(=O)NCC[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1C	ZINC001102670608	1365163662	/nfs/dbraw/zinc/16/36/62/1365163662.db2.gz	JHGQJWXKQNGAQS-SJLPKXTDSA-N	0	3	327.472	3.323	20	30		EGEDHN
C#CCN(CC1CC1)C(=O)N[C@@H](CN1CCCCC1)c1ccccc1	ZINC001324665177	1387723796	/nfs/dbraw/zinc/72/37/96/1387723796.db2.gz	YUIVIJILPSXJAL-FQEVSTJZSA-N	0	3	339.483	3.268	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1CCNC(=O)C1=CCCC1	ZINC001102857309	1365255572	/nfs/dbraw/zinc/25/55/72/1365255572.db2.gz	WDFOPANNIDTXSR-VQIMIIECSA-N	0	3	337.467	3.243	20	30		EGEDHN
C#CCCCC(=O)NCC[C@@H]1CN(Cc2nc(C)c(C)s2)C[C@H]1C	ZINC001102917012	1365290650	/nfs/dbraw/zinc/29/06/50/1365290650.db2.gz	IMZMLZGNIMSKGK-RHSMWYFYSA-N	0	3	347.528	3.138	20	30		EGEDHN
C#CCCCC(=O)NCC[C@@H]1CN(Cc2cc(F)ccc2F)C[C@H]1C	ZINC001102917048	1365291038	/nfs/dbraw/zinc/29/10/38/1365291038.db2.gz	JZLZFXKEGKIVPH-HZPDHXFCSA-N	0	3	348.437	3.343	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)[C@H](CC)CC(F)F)C1	ZINC001103074376	1365365533	/nfs/dbraw/zinc/36/55/33/1365365533.db2.gz	DRMFSUSZQVXSAR-MRVWCRGKSA-N	0	3	336.854	3.495	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2ccc3cc[nH]c3n2)C1	ZINC001103115107	1365390389	/nfs/dbraw/zinc/39/03/89/1365390389.db2.gz	CYOPIXIJKIHPIK-IUODEOHRSA-N	0	3	346.862	3.003	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)c2csc(C#N)c2)CN1Cc1ccccc1	ZINC001324709085	1387746737	/nfs/dbraw/zinc/74/67/37/1387746737.db2.gz	WDIOMLGIQRFLRW-XJKSGUPXSA-N	0	3	325.437	3.013	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cccc3[nH]cnc32)C1	ZINC001103562184	1365638045	/nfs/dbraw/zinc/63/80/45/1365638045.db2.gz	NVXDUVXJMSTXOH-TZMCWYRMSA-N	0	3	346.862	3.003	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)C[C@H](OCC)C(C)C)C[C@H]1C	ZINC001104287254	1365976520	/nfs/dbraw/zinc/97/65/20/1365976520.db2.gz	ZQBDVMMZHZYAAH-OIISXLGYSA-N	0	3	344.927	3.264	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)Cc2cccc(C)c2)C[C@H]1C	ZINC001104614767	1366101985	/nfs/dbraw/zinc/10/19/85/1366101985.db2.gz	QCJSIOHSJUAHIT-CRAIPNDOSA-N	0	3	334.891	3.364	20	30		EGEDHN
C=CCCC1(C(=O)N2C[C@@H](C)[C@H](CCNCc3conc3C)C2)CC1	ZINC001104631469	1366109980	/nfs/dbraw/zinc/10/99/80/1366109980.db2.gz	OMOWFOMDQJPRKB-NVXWUHKLSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001106564117	1366737145	/nfs/dbraw/zinc/73/71/45/1366737145.db2.gz	SXCMDWCGFOQISN-SQGPQFPESA-N	0	3	339.483	3.345	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](CNCc2ncc(C)s2)[C@H](C)C1	ZINC001106563961	1366737337	/nfs/dbraw/zinc/73/73/37/1366737337.db2.gz	NYRMQYWIDHZSNT-SQWLQELKSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H](CNCc2ncc(C)s2)[C@H](C)C1	ZINC001106710944	1366778276	/nfs/dbraw/zinc/77/82/76/1366778276.db2.gz	DPLQJCGTHQZNCF-UKRRQHHQSA-N	0	3	335.517	3.238	20	30		EGEDHN
C#CCCCCC(=O)NC[C@]12CCC[C@H]1N(Cc1ocnc1C)CC2	ZINC001107372909	1366945625	/nfs/dbraw/zinc/94/56/25/1366945625.db2.gz	WSAWWYRDDNKGFD-UYAOXDASSA-N	0	3	343.471	3.037	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](N(C)CCOc2cccc(CC)c2)C1	ZINC001189317798	1366986825	/nfs/dbraw/zinc/98/68/25/1366986825.db2.gz	FONIOCYNLBBQFZ-SFHVURJKSA-N	0	3	330.472	3.127	20	30		EGEDHN
CC(C)[C@@H](C)CC(=O)N1CC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001189326036	1366992290	/nfs/dbraw/zinc/99/22/90/1366992290.db2.gz	CJQCRUUIAQWCDS-LPHOPBHVSA-N	0	3	327.472	3.273	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1CC[C@H](N(C)Cc2ccc(OCC#N)cc2)C1	ZINC001189460334	1367028385	/nfs/dbraw/zinc/02/83/85/1367028385.db2.gz	LKASZWCKFXSCCL-AEFFLSMTSA-N	0	3	343.471	3.058	20	30		EGEDHN
C[C@@H](c1ccc2c(c1)CCC2)N1[C@@H]2CC[C@H]1[C@@H](NC(=O)C#CC1CC1)C2	ZINC001109257731	1367028574	/nfs/dbraw/zinc/02/85/74/1367028574.db2.gz	KRBQRQACBRCIBK-NZYDNVMFSA-N	0	3	348.490	3.371	20	30		EGEDHN
C=CCOCCCC(=O)N1CC[C@H](N(C)Cc2ccc(F)cc2C)C1	ZINC001189574628	1367058918	/nfs/dbraw/zinc/05/89/18/1367058918.db2.gz	MMIHYFHFCUFJBU-IBGZPJMESA-N	0	3	348.462	3.150	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCc1scnc1C	ZINC001109343442	1367070118	/nfs/dbraw/zinc/07/01/18/1367070118.db2.gz	YUSCPPMNDXUASO-PMPSAXMXSA-N	0	3	347.528	3.318	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2C[C@@H]1CCCCO1	ZINC001109345727	1367072639	/nfs/dbraw/zinc/07/26/39/1367072639.db2.gz	TUMYYGNFRZBZCU-UGUYLWEFSA-N	0	3	340.895	3.056	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](N(C)C[C@H](OC)c2ccccc2)C1	ZINC001189743714	1367100516	/nfs/dbraw/zinc/10/05/16/1367100516.db2.gz	IADVKZQJXCRQFP-UXHICEINSA-N	0	3	342.483	3.100	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](N(C)Cc2cccc(OCCC)c2)C1	ZINC001189911013	1367129811	/nfs/dbraw/zinc/12/98/11/1367129811.db2.gz	WMECGDPMDZYXSW-IBGZPJMESA-N	0	3	342.483	3.312	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](N(C)Cc2ccc(Cl)c(OC)c2)C1	ZINC001189925631	1367132468	/nfs/dbraw/zinc/13/24/68/1367132468.db2.gz	DEMHNJAYKCFQNY-MRXNPFEDSA-N	0	3	348.874	3.185	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](N(C)CCOc2c(C)cccc2C)C1	ZINC001189926935	1367134130	/nfs/dbraw/zinc/13/41/30/1367134130.db2.gz	USOYAMSGJZOVSP-LJQANCHMSA-N	0	3	342.483	3.018	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)C=C2CCCCC2)C1	ZINC001107786435	1367145691	/nfs/dbraw/zinc/14/56/91/1367145691.db2.gz	XYKAELVBEDFREJ-PXNSSMCTSA-N	0	3	334.504	3.439	20	30		EGEDHN
C[C@@H](c1cccc(F)c1)N(C)[C@@H]1CCN(C(=O)C#CC(C)(C)C)C1	ZINC001190084603	1367168160	/nfs/dbraw/zinc/16/81/60/1367168160.db2.gz	QAQVLNTTXDYGHK-MAUKXSAKSA-N	0	3	330.447	3.469	20	30		EGEDHN
CCC[C@H](CC1CCCCC1)C(=O)N1CC[C@@H](NCC#CCOC)C1	ZINC001186049200	1387855856	/nfs/dbraw/zinc/85/58/56/1387855856.db2.gz	NWNWRHKNESNKQM-WOJBJXKFSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)C(C)(C)CC(F)F)C1	ZINC001107988866	1367230779	/nfs/dbraw/zinc/23/07/79/1367230779.db2.gz	KYJWJHVXNDLZKQ-KBXCAEBGSA-N	0	3	346.462	3.230	20	30		EGEDHN
C#CCC1(C(=O)NC[C@@]2(C)CN(C[C@H](C)CC(C)C)CCO2)CCC1	ZINC001107990924	1367232752	/nfs/dbraw/zinc/23/27/52/1367232752.db2.gz	QWIGGBHFMJIRJT-QUCCMNQESA-N	0	3	348.531	3.069	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](N(C)C[C@H]2CC(C)(C)CO2)C1	ZINC001190353643	1367236100	/nfs/dbraw/zinc/23/61/00/1367236100.db2.gz	BBHAEANLQJCMSE-QZTJIDSGSA-N	0	3	334.504	3.103	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@H](N(C)CCOCCCC)C1	ZINC001190354541	1367237488	/nfs/dbraw/zinc/23/74/88/1367237488.db2.gz	LVZXTWKVVYMMEV-HNNXBMFYSA-N	0	3	330.900	3.115	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H](N(C)CCOCCCC)C1	ZINC001190354542	1367237504	/nfs/dbraw/zinc/23/75/04/1367237504.db2.gz	LVZXTWKVVYMMEV-OAHLLOKOSA-N	0	3	330.900	3.115	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)CCCc3cc(C)sc3C)[C@@H]2C1	ZINC001190377503	1367245620	/nfs/dbraw/zinc/24/56/20/1367245620.db2.gz	CJIKYNUOUKWQJI-ZWKOTPCHSA-N	0	3	332.513	3.406	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)C23CCC(CC2)C3)C1	ZINC001108030149	1367249482	/nfs/dbraw/zinc/24/94/82/1367249482.db2.gz	BBGQZTVWCOFSQJ-YMPIPDKKSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccccc1N(C)C	ZINC001109656037	1367266678	/nfs/dbraw/zinc/26/66/78/1367266678.db2.gz	ALXRAWAJQZFFHD-HBFSDRIKSA-N	0	3	341.499	3.330	20	30		EGEDHN
CC[C@@H](CC(F)F)C(=O)N1CC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001190614190	1367308580	/nfs/dbraw/zinc/30/85/80/1367308580.db2.gz	WNQHHWQDRUNVQF-DLBZAZTESA-N	0	3	349.425	3.272	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](C)c1cccc(C)c1)C2	ZINC001109766086	1367310207	/nfs/dbraw/zinc/31/02/07/1367310207.db2.gz	PCXBZNVMADDHAQ-RNQOJCNYSA-N	0	3	342.483	3.023	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@]2(C)CN(CC3CC(C)(C)C3)CCO2)CC1	ZINC001108185800	1367328939	/nfs/dbraw/zinc/32/89/39/1367328939.db2.gz	FLADXMGUIWKOEE-NRFANRHFSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=CCCCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(OC)o1)C2	ZINC001109876733	1367375400	/nfs/dbraw/zinc/37/54/00/1367375400.db2.gz	XQZGNFAITHFCFC-PMPSAXMXSA-N	0	3	332.444	3.370	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2c[nH]cc2C2CC2)C1	ZINC001108313646	1367386957	/nfs/dbraw/zinc/38/69/57/1367386957.db2.gz	DWUJWIMDNSHYHG-YWZLYKJASA-N	0	3	345.487	3.068	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2c[nH]cc2C2CC2)C1	ZINC001108313643	1367387442	/nfs/dbraw/zinc/38/74/42/1367387442.db2.gz	DWUJWIMDNSHYHG-FOIQADDNSA-N	0	3	345.487	3.068	20	30		EGEDHN
CC(C)(C#N)c1cccc(C(=O)NCCc2cnc3cc[nH]cc2-3)c1	ZINC001190956023	1367389758	/nfs/dbraw/zinc/38/97/58/1367389758.db2.gz	FHVUCIWTCNQKQS-UHFFFAOYSA-N	0	3	332.407	3.337	20	30		EGEDHN
CC(C)(C#N)c1cccc(C(=O)NCCc2c[nH]c3ccncc23)c1	ZINC001190956023	1367389763	/nfs/dbraw/zinc/38/97/63/1367389763.db2.gz	FHVUCIWTCNQKQS-UHFFFAOYSA-N	0	3	332.407	3.337	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1CC[C@@H](N(C)CC=C(C)C)C1	ZINC001190973067	1367392080	/nfs/dbraw/zinc/39/20/80/1367392080.db2.gz	JUXDVMAZYIUWGT-QGZVFWFLSA-N	0	3	328.456	3.364	20	30		EGEDHN
CCCCCCCNC(=O)N1C[C@H]2CN(Cc3cccnc3)C[C@H]2C1	ZINC001191091886	1367422566	/nfs/dbraw/zinc/42/25/66/1367422566.db2.gz	VVDAYXUXLXIOFT-KDURUIRLSA-N	0	3	344.503	3.125	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2ccc(F)s2)C1	ZINC001108437982	1367457534	/nfs/dbraw/zinc/45/75/34/1367457534.db2.gz	RUKHQMNOXPULBP-CXAGYDPISA-N	0	3	340.464	3.063	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cnc(C3CC3)s1)C2	ZINC001110012120	1367458460	/nfs/dbraw/zinc/45/84/60/1367458460.db2.gz	MHEMRWWEYHRPCH-ILXRZTDVSA-N	0	3	331.485	3.322	20	30		EGEDHN
C=CCN1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)C(C)(C)F)C1	ZINC001186155953	1387884570	/nfs/dbraw/zinc/88/45/70/1387884570.db2.gz	KTUHAAGLMNMVQT-NVXWUHKLSA-N	0	3	336.426	3.282	20	30		EGEDHN
C=CCN1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)CC2CC2)C1	ZINC001186156537	1387884907	/nfs/dbraw/zinc/88/49/07/1387884907.db2.gz	NHLRCFNEPYMBHK-IEBWSBKVSA-N	0	3	330.447	3.334	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H](N(C)Cc2ccc3c(c2)COC3)C1	ZINC001191868195	1367620179	/nfs/dbraw/zinc/62/01/79/1367620179.db2.gz	PUWBIMAZDJPQDE-OXJNMPFZSA-N	0	3	342.483	3.352	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@H](N(C)CCOc2ccccc2)C1	ZINC001191890699	1367627326	/nfs/dbraw/zinc/62/73/26/1367627326.db2.gz	UEMSCKYMYWLTTI-ROUUACIJSA-N	0	3	330.472	3.200	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@H](N(C)CCOc2cccc(F)c2)C1	ZINC001191891027	1367628406	/nfs/dbraw/zinc/62/84/06/1367628406.db2.gz	WDWBKXVAMGEJOL-AEFFLSMTSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@@H](N(C)Cc2ccc3c(c2)COC3)C1	ZINC001191911333	1367634986	/nfs/dbraw/zinc/63/49/86/1367634986.db2.gz	FBBZAUKZRRCRLN-OXJNMPFZSA-N	0	3	342.483	3.352	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](N(C)CCOc2ccc(F)cc2)C1	ZINC001192094341	1367685760	/nfs/dbraw/zinc/68/57/60/1367685760.db2.gz	RXXVEDQEKNQSEO-KRWDZBQOSA-N	0	3	334.435	3.094	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CC1=CCCCC1	ZINC001109038743	1367734995	/nfs/dbraw/zinc/73/49/95/1367734995.db2.gz	YIYFWVRONLEXRX-YSHGAJCASA-N	0	3	332.488	3.190	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCCOc1ccccc1C	ZINC001109043030	1367736459	/nfs/dbraw/zinc/73/64/59/1367736459.db2.gz	JHMNSUPXEXAOAA-QYZOEREBSA-N	0	3	342.483	3.452	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1cccc2cccnc21	ZINC001109046214	1367738291	/nfs/dbraw/zinc/73/82/91/1367738291.db2.gz	KLVRCPUAMJWBPV-QYZOEREBSA-N	0	3	335.451	3.423	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](N(C)Cc2ccc(COC)cc2)C1	ZINC001192585909	1367825775	/nfs/dbraw/zinc/82/57/75/1367825775.db2.gz	DRSOYKZYQSSBQD-IBGZPJMESA-N	0	3	344.499	3.468	20	30		EGEDHN
CCCCCCC[C@H](C)NC(=O)N1C[C@@H]2CN(CC)CCO[C@@H]2C1	ZINC001192927351	1367905738	/nfs/dbraw/zinc/90/57/38/1367905738.db2.gz	LHDMJGMIQUXOAE-OKZBNKHCSA-N	0	3	339.524	3.098	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2ccc(C(C)C)cc2)C1	ZINC001193662642	1368087314	/nfs/dbraw/zinc/08/73/14/1368087314.db2.gz	HZEWOGHJRNNIFQ-IBGZPJMESA-N	0	3	330.472	3.159	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2cccc3ccccc32)C1	ZINC001193816595	1368121342	/nfs/dbraw/zinc/12/13/42/1368121342.db2.gz	SSUNZDSXEZOYGG-SFHVURJKSA-N	0	3	338.451	3.189	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@H]2CCC=CCCC2)C1	ZINC001194030309	1368170123	/nfs/dbraw/zinc/17/01/23/1368170123.db2.gz	AUADUDYLTYSXOH-IPMKNSEASA-N	0	3	336.520	3.255	20	30		EGEDHN
C=C[C@H](C(=O)N1CC[C@@H](N(C)CCOCCCC)C1)c1ccccc1	ZINC001194182616	1368201299	/nfs/dbraw/zinc/20/12/99/1368201299.db2.gz	BWBUTYCVTRRCFP-UXHICEINSA-N	0	3	344.499	3.306	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)CC2(C)CCCCC2)C1	ZINC001194625516	1368299268	/nfs/dbraw/zinc/29/92/68/1368299268.db2.gz	PGQROYMFPVSSEM-QZTJIDSGSA-N	0	3	338.536	3.479	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3CCC[C@H](C)O)CCCCC1	ZINC001111442268	1368308267	/nfs/dbraw/zinc/30/82/67/1368308267.db2.gz	IRVHJESCCRFHGX-MANSERQUSA-N	0	3	348.531	3.396	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](CC)c1ccc(OC)cc1)C2	ZINC001111443852	1368308614	/nfs/dbraw/zinc/30/86/14/1368308614.db2.gz	YTJQCQIVURILAJ-AFYVEPGGSA-N	0	3	342.483	3.486	20	30		EGEDHN
CCCCCCCCOC(=O)N1CCN2C[C@H](OCC)C[C@H]2C1	ZINC001194740618	1368315052	/nfs/dbraw/zinc/31/50/52/1368315052.db2.gz	MKDAPUPBLYHFBD-DLBZAZTESA-N	0	3	326.481	3.279	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccc(C)cc1C	ZINC001111487278	1368318622	/nfs/dbraw/zinc/31/86/22/1368318622.db2.gz	GMMIDTKSTQHWLC-AQNXPRMDSA-N	0	3	342.483	3.118	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](C)Cc1cccc(Cl)c1)C2	ZINC001111516166	1368323202	/nfs/dbraw/zinc/32/32/02/1368323202.db2.gz	FJQIXYPZSRRGPL-AXUOBQJMSA-N	0	3	344.886	3.263	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H](CC)CCCC)C[C@@H](C)O2	ZINC001111535885	1368334686	/nfs/dbraw/zinc/33/46/86/1368334686.db2.gz	SSCFFLVKGRSYRU-QZTJIDSGSA-N	0	3	336.520	3.471	20	30		EGEDHN
CC[C@H](C)C(=O)N[C@]12CCC[C@H]1CN(Cc1cccc(C#N)c1)C2	ZINC001111592172	1368357315	/nfs/dbraw/zinc/35/73/15/1368357315.db2.gz	NKGCLHIAXXAEKF-QSFXBCCZSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=CCCC(=O)N1CCCN(CCCc2cccc(OC)c2)CC1	ZINC001195233506	1368405120	/nfs/dbraw/zinc/40/51/20/1368405120.db2.gz	VSMRICQHQNTCFL-UHFFFAOYSA-N	0	3	330.472	3.128	20	30		EGEDHN
C[C@@H]1CC[C@H](C(=O)OC(C)(C)C)CN1CCOc1ccccc1C#N	ZINC001195288317	1368414654	/nfs/dbraw/zinc/41/46/54/1368414654.db2.gz	FJYPKLUVXNRFQB-WBVHZDCISA-N	0	3	344.455	3.379	20	30		EGEDHN
N#Cc1ccc(C(=O)N2CCCN(CC/C=C/c3ccccc3)CC2)[nH]1	ZINC001195497820	1368446088	/nfs/dbraw/zinc/44/60/88/1368446088.db2.gz	ROTKHVUZYDVKML-RUDMXATFSA-N	0	3	348.450	3.138	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)CC2(c3ccccc3)CC2)C1	ZINC001111775953	1368455894	/nfs/dbraw/zinc/45/58/94/1368455894.db2.gz	IDWXZFVICGNNKC-UGKGYDQZSA-N	0	3	336.479	3.102	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CCCN(C[C@H]2CCCC(F)(F)C2)CC1	ZINC001195785796	1368490064	/nfs/dbraw/zinc/49/00/64/1368490064.db2.gz	VVPPONGCILYWGY-INIZCTEOSA-N	0	3	340.458	3.396	20	30		EGEDHN
C=CCCOCCCCC(=O)N1CCCN(CC[C@@H](C)F)CC1	ZINC001195839027	1368500950	/nfs/dbraw/zinc/50/09/50/1368500950.db2.gz	KBGUPHVWVPKDEZ-QGZVFWFLSA-N	0	3	328.472	3.032	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cn(C)nc2C2CC2)CC1	ZINC001195982060	1368527375	/nfs/dbraw/zinc/52/73/75/1368527375.db2.gz	MQCQSCINCBTCSH-UHFFFAOYSA-N	0	3	346.519	3.416	20	30		EGEDHN
C=CCC[C@@H](C)N1CCCN(C(=O)c2sc3nccn3c2C)CC1	ZINC001196184859	1368564348	/nfs/dbraw/zinc/56/43/48/1368564348.db2.gz	FCRKJMFRCKWGKB-CQSZACIVSA-N	0	3	346.500	3.207	20	30		EGEDHN
C=CCCN1CCCN(C(=O)[C@@H](C)OCc2ccc(C)cc2)CC1	ZINC001196690159	1368663884	/nfs/dbraw/zinc/66/38/84/1368663884.db2.gz	PCKTWEUKJSLWAB-GOSISDBHSA-N	0	3	330.472	3.011	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)CCCc2ccsc2)C[C@H]1C(F)(F)F	ZINC001112119222	1368667782	/nfs/dbraw/zinc/66/77/82/1368667782.db2.gz	KCJTYVUIDBHQDT-ZIAGYGMSSA-N	0	3	346.418	3.236	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCCN(CCc2ccc(OC)cc2)CC1	ZINC001196901006	1368710204	/nfs/dbraw/zinc/71/02/04/1368710204.db2.gz	JSUQSOJULBBTIA-SFHVURJKSA-N	0	3	344.499	3.374	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)CCCc2cccs2)C[C@H]1C(F)(F)F	ZINC001112203630	1368712711	/nfs/dbraw/zinc/71/27/11/1368712711.db2.gz	BGQZYPDENNOZGK-ZIAGYGMSSA-N	0	3	346.418	3.236	20	30		EGEDHN
CCCCC(=O)N1C[C@@H]2CCC[C@]2(CNCc2ccccc2C#N)C1	ZINC001112259105	1368736607	/nfs/dbraw/zinc/73/66/07/1368736607.db2.gz	YIRVRXPQXZZBTR-FPOVZHCZSA-N	0	3	339.483	3.467	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@@H]2CCC[C@]2(CNC/C(Cl)=C/Cl)C1	ZINC001112347788	1368782212	/nfs/dbraw/zinc/78/22/12/1368782212.db2.gz	APRLTDLRCGEVHM-XLKPZTHESA-N	0	3	343.298	3.183	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cnn(C(F)F)c2)CC1	ZINC001197560198	1368840411	/nfs/dbraw/zinc/84/04/11/1368840411.db2.gz	MDPRSMVDCFCQQG-UHFFFAOYSA-N	0	3	340.418	3.173	20	30		EGEDHN
N#Cc1cccc(NC(=S)N[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC001197671296	1368869365	/nfs/dbraw/zinc/86/93/65/1368869365.db2.gz	OHSQDYOGXODEKN-GOSISDBHSA-N	0	3	336.464	3.119	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cncnc2C2CC2)CC1	ZINC001197995971	1368938486	/nfs/dbraw/zinc/93/84/86/1368938486.db2.gz	WZTLXPASPMZLKF-UHFFFAOYSA-N	0	3	344.503	3.472	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)CCCC2CC2)C1	ZINC001325438313	1387972202	/nfs/dbraw/zinc/97/22/02/1387972202.db2.gz	NTXDUFNADHCYBE-JXFKEZNVSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=CCC1(C(=O)N2CCCN(CCC[C@H]3CCOC3)CC2)CCCC1	ZINC001198423337	1369029891	/nfs/dbraw/zinc/02/98/91/1369029891.db2.gz	NSLQMYVIJXAXOI-IBGZPJMESA-N	0	3	348.531	3.474	20	30		EGEDHN
C=CCCCCCN[C@H](CNC(=O)C(F)F)c1ccccc1OC	ZINC001198471284	1369040622	/nfs/dbraw/zinc/04/06/22/1369040622.db2.gz	ISIQASFEEIEGEO-OAHLLOKOSA-N	0	3	340.414	3.454	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)c1ccccn1)c1ccccc1OC	ZINC001198491646	1369044196	/nfs/dbraw/zinc/04/41/96/1369044196.db2.gz	KJZQNUFQMJXRJR-SFHVURJKSA-N	0	3	339.439	3.117	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)c1ccccc1F)c1ccccc1OC	ZINC001198498685	1369046758	/nfs/dbraw/zinc/04/67/58/1369046758.db2.gz	AFKZUZAMBURIAU-GOSISDBHSA-N	0	3	342.414	3.471	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@@H]1CC=CCC1)c1ccccc1OC	ZINC001198523323	1369052199	/nfs/dbraw/zinc/05/21/99/1369052199.db2.gz	VQCXNSHOZSWHRF-AEFFLSMTSA-N	0	3	328.456	3.375	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)c1ccoc1)c1ccccc1OC	ZINC001198530348	1369054180	/nfs/dbraw/zinc/05/41/80/1369054180.db2.gz	QKEFEZGCCSXKAV-KRWDZBQOSA-N	0	3	328.412	3.315	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)[C@@H](C)SC)c1ccccc1OC	ZINC001198555411	1369060059	/nfs/dbraw/zinc/06/00/59/1369060059.db2.gz	UQLCTSFTECNKRI-ZBFHGGJFSA-N	0	3	336.501	3.160	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)c1cncs1)c1ccccc1OC	ZINC001198577711	1369064430	/nfs/dbraw/zinc/06/44/30/1369064430.db2.gz	LCVZYOPTWCRRRN-HNNXBMFYSA-N	0	3	345.468	3.179	20	30		EGEDHN
C=CCC[C@H](C)N[C@H](CNC(=O)COC(C)C)c1ccccc1OC	ZINC001198584464	1369066159	/nfs/dbraw/zinc/06/61/59/1369066159.db2.gz	HRRFEKZMGBGGHM-FUHWJXTLSA-N	0	3	348.487	3.222	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)[C@H](CC)OCC)c1ccccc1OC	ZINC001198585009	1369067102	/nfs/dbraw/zinc/06/71/02/1369067102.db2.gz	PEGPJRFTOKKJMR-ROUUACIJSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)CCCCOC)c1ccccc1OC	ZINC001198595031	1369068487	/nfs/dbraw/zinc/06/84/87/1369068487.db2.gz	GDYFOANGVMBXJU-SFHVURJKSA-N	0	3	348.487	3.225	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)C1=COCCC1)c1ccccc1OC	ZINC001198606854	1369071741	/nfs/dbraw/zinc/07/17/41/1369071741.db2.gz	WFSOHJHWLYJOEP-GOSISDBHSA-N	0	3	344.455	3.103	20	30		EGEDHN
C=CCOCC(=O)NC[C@H](NCCCC(C)C)c1ccccc1OC	ZINC001198606549	1369072382	/nfs/dbraw/zinc/07/23/82/1369072382.db2.gz	UCAQZZRKDAUPJJ-SFHVURJKSA-N	0	3	348.487	3.081	20	30		EGEDHN
CCCCCCN[C@@H](CNC(=O)[C@H](C)C#N)c1ccccc1OC	ZINC001198616280	1369073975	/nfs/dbraw/zinc/07/39/75/1369073975.db2.gz	GXKMUVWPRZNFKO-WBVHZDCISA-N	0	3	331.460	3.182	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)[C@H](C)C1CC1)c1ccccc1OC	ZINC001198647884	1369081796	/nfs/dbraw/zinc/08/17/96/1369081796.db2.gz	RCYYFOZLBYSJDQ-QAPCUYQASA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)C[C@@H]1C[C@H]1C1CC1)c1ccccc1OC	ZINC001198820124	1369121425	/nfs/dbraw/zinc/12/14/25/1369121425.db2.gz	XYPLUIIBJLLFMY-YTQUADARSA-N	0	3	342.483	3.454	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)[C@H](CCC)OC)c1ccccc1OC	ZINC001198827018	1369122915	/nfs/dbraw/zinc/12/29/15/1369122915.db2.gz	PBLGAGXHBJIKPW-HKUYNNGSSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)[C@H](CCC)OC)c1ccccc1OC	ZINC001198828019	1369123814	/nfs/dbraw/zinc/12/38/14/1369123814.db2.gz	WJSMUBMEJJCTPX-MJGOQNOKSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)[C@H](F)C(C)C)c1ccccc1OC	ZINC001198843996	1369128355	/nfs/dbraw/zinc/12/83/55/1369128355.db2.gz	YWYIFWISDZUZLQ-SJLPKXTDSA-N	0	3	336.451	3.402	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@H](NCC[C@@H](C)F)c1ccccc1OC	ZINC001198854867	1369129516	/nfs/dbraw/zinc/12/95/16/1369129516.db2.gz	ANHANKDLGBYLBW-SJLPKXTDSA-N	0	3	348.462	3.384	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@H](NCC1CCC1)c1ccccc1OC	ZINC001198856166	1369130585	/nfs/dbraw/zinc/13/05/85/1369130585.db2.gz	GBTWYCPKDBYNMX-LJQANCHMSA-N	0	3	342.483	3.436	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)c1csc(C)n1)c1ccccc1OC	ZINC001198864700	1369134091	/nfs/dbraw/zinc/13/40/91/1369134091.db2.gz	FXVQVJZAODJCHF-OAHLLOKOSA-N	0	3	345.468	3.097	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)[C@H](OC)C(C)C)c1ccccc1OC	ZINC001198876291	1369137115	/nfs/dbraw/zinc/13/71/15/1369137115.db2.gz	QHQDZVUYODVTSV-IEBWSBKVSA-N	0	3	348.487	3.079	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@@H]1C[C@H]1CCC)c1ccccc1OC	ZINC001198895648	1369143092	/nfs/dbraw/zinc/14/30/92/1369143092.db2.gz	VFEYQLQTNVZIIF-KBAYOESNSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)[C@H](C)CCOC)c1ccccc1OC	ZINC001198994387	1369168499	/nfs/dbraw/zinc/16/84/99/1369168499.db2.gz	YCPPSQJXBBBADW-SJLPKXTDSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)[C@@H](C)CCOC)c1ccccc1OC	ZINC001198994126	1369168746	/nfs/dbraw/zinc/16/87/46/1369168746.db2.gz	UNKJZHWADCEXQB-WMZOPIPTSA-N	0	3	348.487	3.081	20	30		EGEDHN
C#CCCCCC(=O)N1CCC(NCc2c(F)cccc2F)CC1	ZINC001200148734	1369321151	/nfs/dbraw/zinc/32/11/51/1369321151.db2.gz	YCWUJDZOEXDPEL-UHFFFAOYSA-N	0	3	334.410	3.239	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)CCc2nc3ccccc3o2)CC1	ZINC001113623660	1369525860	/nfs/dbraw/zinc/52/58/60/1369525860.db2.gz	WPTHKUVFDCXDKA-INIZCTEOSA-N	0	3	341.455	3.259	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)CN(CC)c2ccccc2)CC1	ZINC001113674630	1369559974	/nfs/dbraw/zinc/55/99/74/1369559974.db2.gz	CHASLAVJMWMIDK-GOSISDBHSA-N	0	3	329.488	3.012	20	30		EGEDHN
CC#CCCCC(=O)N1CCC(NCc2nc(C)c(C)s2)CC1	ZINC001202076348	1369682703	/nfs/dbraw/zinc/68/27/03/1369682703.db2.gz	YDVTZVONHKRSLB-UHFFFAOYSA-N	0	3	333.501	3.034	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)N1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001202101815	1369687954	/nfs/dbraw/zinc/68/79/54/1369687954.db2.gz	SZMZKYPYUWNWJT-LSDHHAIUSA-N	0	3	343.446	3.236	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC(NCc2nc(C)sc2C)CC1	ZINC001202129897	1369695254	/nfs/dbraw/zinc/69/52/54/1369695254.db2.gz	BUYZMCULKZCRQW-OAHLLOKOSA-N	0	3	335.517	3.443	20	30		EGEDHN
C=CCC1(C(=O)N2CCCO[C@H](CNC[C@H](F)CC)C2)CCCC1	ZINC001202243625	1369721917	/nfs/dbraw/zinc/72/19/17/1369721917.db2.gz	OSTKBVVQWGSKEB-IAGOWNOFSA-N	0	3	340.483	3.078	20	30		EGEDHN
CCCC(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C12CCC2	ZINC001202337665	1369742370	/nfs/dbraw/zinc/74/23/70/1369742370.db2.gz	UMKUJHSBXAHFBG-SJORKVTESA-N	0	3	329.419	3.014	20	30		EGEDHN
Cc1occc1C(=O)N[C@@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202383973	1369756487	/nfs/dbraw/zinc/75/64/87/1369756487.db2.gz	ONDYTGBNUUKWDV-VQTJNVASSA-N	0	3	348.446	3.270	20	30		EGEDHN
CCN1CCN(c2cccc(NC(=O)CC#Cc3ccccc3)c2)CC1	ZINC001325673373	1388026343	/nfs/dbraw/zinc/02/63/43/1388026343.db2.gz	OOHYGTBXBUDSTQ-UHFFFAOYSA-N	0	3	347.462	3.209	20	30		EGEDHN
O=C(/C=C/C1CC1)N[C@@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202713329	1369862396	/nfs/dbraw/zinc/86/23/96/1369862396.db2.gz	LYWWPNUZEMHJJY-ONNIGLJISA-N	0	3	334.463	3.021	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1[C@H]2CN(Cc3cc(F)ccc3C)C[C@H]21	ZINC001114328982	1369889462	/nfs/dbraw/zinc/88/94/62/1369889462.db2.gz	SMTSSIPNSQRDHZ-DZFIZOCASA-N	0	3	330.447	3.283	20	30		EGEDHN
O=C(C#CC1CC1)N[C@@H]1C[C@@H](NCc2ccccc2Cl)C12CCC2	ZINC001202888074	1369918089	/nfs/dbraw/zinc/91/80/89/1369918089.db2.gz	OSWIQYGQVBEYKY-QZTJIDSGSA-N	0	3	342.870	3.270	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1C[C@H](NCc2c(C)onc2CC)C12CCC2	ZINC001202987691	1369946847	/nfs/dbraw/zinc/94/68/47/1369946847.db2.gz	OBFCQXAEYUMPTJ-ROUUACIJSA-N	0	3	345.487	3.419	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)CCc2ccsc2)C12CCC2	ZINC001203036294	1369962687	/nfs/dbraw/zinc/96/26/87/1369962687.db2.gz	NIIWIFHPKQYTQH-HUUCEWRRSA-N	0	3	338.904	3.450	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)CC2(C)CC2)C12CCC2	ZINC001203204490	1370023795	/nfs/dbraw/zinc/02/37/95/1370023795.db2.gz	VILNPQJBIYGCNR-STQMWFEESA-N	0	3	341.293	3.102	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1[C@H]2CN(CCOC3CCCCCC3)C[C@H]21	ZINC001114729175	1370050828	/nfs/dbraw/zinc/05/08/28/1370050828.db2.gz	NRAHIJJBELIQON-RBAQFSTRSA-N	0	3	348.531	3.375	20	30		EGEDHN
CC#CCCCC(=O)N[C@H]1C[C@@H](NCc2oc(C)nc2C)C12CCC2	ZINC001203280784	1370059697	/nfs/dbraw/zinc/05/96/97/1370059697.db2.gz	JWLTVAAJYLGCAD-MSOLQXFVSA-N	0	3	343.471	3.002	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1C[C@H](NCc2oc(C)nc2C)C12CCC2	ZINC001203282030	1370060478	/nfs/dbraw/zinc/06/04/78/1370060478.db2.gz	UUVMXPXWDXXFNX-HOTGVXAUSA-N	0	3	331.460	3.021	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1C[C@@H](NCc2c(C)onc2CC)C12CCC2	ZINC001203341129	1370089757	/nfs/dbraw/zinc/08/97/57/1370089757.db2.gz	OPFLTNPJEWCHLS-QZTJIDSGSA-N	0	3	345.487	3.419	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H]2C[C@@H](NCc3cnoc3C)C23CCC3)CC1	ZINC001203372427	1370102496	/nfs/dbraw/zinc/10/24/96/1370102496.db2.gz	FAUACKVFXJUWOY-SJORKVTESA-N	0	3	343.471	3.246	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)C2(C(C)(F)F)CC2)C12CCC2	ZINC001203419132	1370117983	/nfs/dbraw/zinc/11/79/83/1370117983.db2.gz	KMHZDYSIGCBOKL-NWDGAFQWSA-N	0	3	332.822	3.191	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1C[C@@H](NCc2cnc(C)o2)C12CCC2	ZINC001203450533	1370130647	/nfs/dbraw/zinc/13/06/47/1370130647.db2.gz	BMURUQWUXPAROF-HZPDHXFCSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)CCOc2ccccc2)C12CCC2	ZINC001203731094	1370239060	/nfs/dbraw/zinc/23/90/60/1370239060.db2.gz	NOGKQACJDMKRMA-IRXDYDNUSA-N	0	3	348.874	3.225	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CC2)CC(=O)Nc2ccccc23)c1	ZINC001203760917	1370254025	/nfs/dbraw/zinc/25/40/25/1370254025.db2.gz	STXGQORDARLFOB-UHFFFAOYSA-N	0	3	331.419	3.434	20	30		EGEDHN
N#Cc1ccc(CN2CCc3ncnc(-c4cccnc4)c3CC2)cc1	ZINC001203901264	1370306882	/nfs/dbraw/zinc/30/68/82/1370306882.db2.gz	JKINUTJYOPYIST-UHFFFAOYSA-N	0	3	341.418	3.011	20	30		EGEDHN
CC[C@@H](CC(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1)C(C)C	ZINC001187208203	1388070916	/nfs/dbraw/zinc/07/09/16/1388070916.db2.gz	NLNKKQBXEKYSLY-FUHWJXTLSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=CCOC(=O)N[C@H]1CCCN(Cc2c(C)[nH]c3ccccc32)C1	ZINC001204296905	1370435275	/nfs/dbraw/zinc/43/52/75/1370435275.db2.gz	FKDRJINMIGAZEE-HNNXBMFYSA-N	0	3	327.428	3.353	20	30		EGEDHN
O=C(NCC1(NCC#Cc2ccccc2)CCCCC1)c1ccoc1	ZINC001115406827	1370437471	/nfs/dbraw/zinc/43/74/71/1370437471.db2.gz	JFVZJWWIKBSSQA-UHFFFAOYSA-N	0	3	336.435	3.354	20	30		EGEDHN
CC(C)C(=O)NCC1(NCc2cc(C#N)ccc2F)CCCCC1	ZINC001115412123	1370441253	/nfs/dbraw/zinc/44/12/53/1370441253.db2.gz	NXIZJMQUODJBOW-UHFFFAOYSA-N	0	3	331.435	3.262	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H](C)OCCCC)CCCCC1	ZINC001115436979	1370452079	/nfs/dbraw/zinc/45/20/79/1370452079.db2.gz	XIJSBRNRAZTYTM-HNNXBMFYSA-N	0	3	330.900	3.353	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC([C@@H]2CCN(Cc3ccccc3C#N)C2)C1	ZINC001204368794	1370456018	/nfs/dbraw/zinc/45/60/18/1370456018.db2.gz	YNUDGLANYPZCTL-QGZVFWFLSA-N	0	3	341.455	3.247	20	30		EGEDHN
N#Cc1ccccc1CN1CCC2(CC1)CCN(c1ncccn1)CC2	ZINC001204370792	1370456731	/nfs/dbraw/zinc/45/67/31/1370456731.db2.gz	LQLXSDFEJSAESJ-UHFFFAOYSA-N	0	3	347.466	3.231	20	30		EGEDHN
Cc1ccc(F)c(CNC2(CNC(=O)[C@H](C)C#N)CCCCC2)c1	ZINC001115453705	1370461205	/nfs/dbraw/zinc/46/12/05/1370461205.db2.gz	YVHNAKPRTRHDAK-OAHLLOKOSA-N	0	3	331.435	3.203	20	30		EGEDHN
C#CCCCCC(=O)NCC1(NCc2ncccc2C)CCCCC1	ZINC001115490711	1370493223	/nfs/dbraw/zinc/49/32/23/1370493223.db2.gz	KEOMKVCWIQMXSP-UHFFFAOYSA-N	0	3	341.499	3.492	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H]2CN(CCc3ccccc3Cl)C[C@H]21	ZINC001187240750	1388078876	/nfs/dbraw/zinc/07/88/76/1388078876.db2.gz	ZIBAJUBBLUIMQP-FUHWJXTLSA-N	0	3	332.875	3.381	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CCC(CNC/C(Cl)=C\Cl)CC1	ZINC001204692539	1370547319	/nfs/dbraw/zinc/54/73/19/1370547319.db2.gz	MAXCMPFBZPANAT-LERPTODRSA-N	0	3	349.302	3.115	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCC1(NCc2conc2C)CCCCC1	ZINC001115554858	1370552166	/nfs/dbraw/zinc/55/21/66/1370552166.db2.gz	QINXBUXFHKJJQS-UHFFFAOYSA-N	0	3	333.476	3.494	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H]2CC[C@H](CC)O2)CCCCC1	ZINC001115559948	1370559829	/nfs/dbraw/zinc/55/98/29/1370559829.db2.gz	MJKSTMWSXACWBT-GJZGRUSLSA-N	0	3	328.884	3.105	20	30		EGEDHN
CN1CCN(Cc2ccc(Nc3cnc(C#N)c(Cl)c3)cc2)CC1	ZINC001204740344	1370560665	/nfs/dbraw/zinc/56/06/65/1370560665.db2.gz	FTGYMTNSFFEOFK-UHFFFAOYSA-N	0	3	341.846	3.098	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H]2CCO[C@H]2C(C)C)CCCCC1	ZINC001115567958	1370568630	/nfs/dbraw/zinc/56/86/30/1370568630.db2.gz	XPCQVMITSQOOMK-HOTGVXAUSA-N	0	3	342.911	3.209	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)Cc2cncc(C)c2)CCCCC1	ZINC001115650050	1370637759	/nfs/dbraw/zinc/63/77/59/1370637759.db2.gz	JZPKMJCHBISWMY-UHFFFAOYSA-N	0	3	335.879	3.094	20	30		EGEDHN
C#Cc1ccc(Nc2ccc(C3(N4CCN(C)CC4)CC3)cc2)cn1	ZINC001205107093	1370651964	/nfs/dbraw/zinc/65/19/64/1370651964.db2.gz	CJTNPSJCHJOSEY-UHFFFAOYSA-N	0	3	332.451	3.043	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H]2CCc3cccnc32)CCCCC1	ZINC001115696320	1370677666	/nfs/dbraw/zinc/67/76/66/1370677666.db2.gz	QCEQOSGCIYEBHW-MRXNPFEDSA-N	0	3	347.890	3.273	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC1(NCc2cnc(C)cn2)CCCCC1	ZINC001115749857	1370729714	/nfs/dbraw/zinc/72/97/14/1370729714.db2.gz	BANLMLNDNWTIBS-UHFFFAOYSA-N	0	3	344.503	3.296	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C[C@@H](C)C(C)C)C[C@H]1c1cccc(F)c1	ZINC001205387397	1370739309	/nfs/dbraw/zinc/73/93/09/1370739309.db2.gz	AYAOTFUNPVALOK-LSTHTHJFSA-N	0	3	344.474	3.415	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@](C)(F)CCCC)C[C@H]1c1cccc(F)c1	ZINC001205417223	1370748562	/nfs/dbraw/zinc/74/85/62/1370748562.db2.gz	VNUSIGOFJDIUFL-NLWGTHIKSA-N	0	3	348.437	3.261	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](c2cccc(F)c2)[C@H](NCC#CC)C1	ZINC001205429611	1370752734	/nfs/dbraw/zinc/75/27/34/1370752734.db2.gz	VRKQRUNNWINCGE-RBUKOAKNSA-N	0	3	328.431	3.089	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C(C)(C)CC)C[C@H]1c1cccc(F)c1	ZINC001205432580	1370753532	/nfs/dbraw/zinc/75/35/32/1370753532.db2.gz	NOCBMPYVLOTKTC-ZWKOTPCHSA-N	0	3	330.447	3.169	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C[C@H](C)CC(C)C)C[C@H]1c1cccc(F)c1	ZINC001205449418	1370759185	/nfs/dbraw/zinc/75/91/85/1370759185.db2.gz	UPIPPZDIVDFFSR-LSTHTHJFSA-N	0	3	344.474	3.415	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)CCCC(C)(C)C)[C@@H]3COC[C@@H]32)CC1	ZINC001205482689	1370768729	/nfs/dbraw/zinc/76/87/29/1370768729.db2.gz	ZAGHJNFDDSSHMJ-ZWKOTPCHSA-N	0	3	348.531	3.328	20	30		EGEDHN
CCCCCCCCCCC(=O)N1CC[C@@H](NCC#CCOC)C1	ZINC001187340722	1388096569	/nfs/dbraw/zinc/09/65/69/1388096569.db2.gz	CEDXAZFHKJWTLA-LJQANCHMSA-N	0	3	336.520	3.358	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC(CNCc2ccn(C(C)C)n2)CC1	ZINC001205988124	1370930040	/nfs/dbraw/zinc/93/00/40/1370930040.db2.gz	BAERCSWXGALEKI-QGZVFWFLSA-N	0	3	346.519	3.395	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC(CNCc2ccn(C(C)C)n2)CC1	ZINC001205988123	1370930067	/nfs/dbraw/zinc/93/00/67/1370930067.db2.gz	BAERCSWXGALEKI-KRWDZBQOSA-N	0	3	346.519	3.395	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(CN[C@@H](C)c3cnccn3)CC2)CCC1	ZINC001206181685	1370983230	/nfs/dbraw/zinc/98/32/30/1370983230.db2.gz	NJCSNDGTZRGRKN-INIZCTEOSA-N	0	3	342.487	3.112	20	30		EGEDHN
Cn1cc(-c2ccc(CNCc3cccc(OCC#N)c3)cc2)cn1	ZINC001116863007	1370989452	/nfs/dbraw/zinc/98/94/52/1370989452.db2.gz	MTKBRLWFGVYXNU-UHFFFAOYSA-N	0	3	332.407	3.279	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@@H]1CN(Cc2ccc(-c3ccccc3)cc2)C[C@H]1C	ZINC001206662330	1371125430	/nfs/dbraw/zinc/12/54/30/1371125430.db2.gz	HDQYZNGEWWOSKX-CBGDNZLLSA-N	0	3	347.462	3.450	20	30		EGEDHN
CCc1cccc(CN2C[C@@H](C)[C@H](NC(=O)C#CC(C)(C)C)C2)c1	ZINC001206950631	1371241419	/nfs/dbraw/zinc/24/14/19/1371241419.db2.gz	BNVATPIWKGSLOI-VQIMIIECSA-N	0	3	326.484	3.235	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CCN(Cc3cnc(C)s3)CC2)CC1	ZINC001207058298	1371281804	/nfs/dbraw/zinc/28/18/04/1371281804.db2.gz	HMCFRSRAQXMZTR-UHFFFAOYSA-N	0	3	349.500	3.452	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H]2CN(C/C=C/c3ccccc3)C[C@H]21	ZINC001187569315	1388126738	/nfs/dbraw/zinc/12/67/38/1388126738.db2.gz	GKLSEZYUIALOAY-QOANIYFMSA-N	0	3	336.479	3.426	20	30		EGEDHN
C[C@H]1[C@H](CNC(=O)OC(C)(C)C)CCCN1Cc1cc(C#N)n(C)c1	ZINC001207103052	1371294412	/nfs/dbraw/zinc/29/44/12/1371294412.db2.gz	KTJXQXAFISAMTI-HOCLYGCPSA-N	0	3	346.475	3.022	20	30		EGEDHN
Cc1ccccc1C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001207109741	1371296429	/nfs/dbraw/zinc/29/64/29/1371296429.db2.gz	XZUQDFHNAODMMG-FQEVSTJZSA-N	0	3	332.447	3.241	20	30		EGEDHN
O=C(CC1CCCC1)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207116179	1371298182	/nfs/dbraw/zinc/29/81/82/1371298182.db2.gz	ILNMJCZVTBFBIO-FQEVSTJZSA-N	0	3	342.458	3.338	20	30		EGEDHN
CC(C)CCC(=O)N1CCC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001207222124	1371333386	/nfs/dbraw/zinc/33/33/86/1371333386.db2.gz	NFUBYXKUNIKFLD-KRWDZBQOSA-N	0	3	331.435	3.214	20	30		EGEDHN
CCCCCC(=O)N1CCC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001207353393	1371370411	/nfs/dbraw/zinc/37/04/11/1371370411.db2.gz	SSPSVSDHRCRCEA-QGZVFWFLSA-N	0	3	331.435	3.358	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CCC[C@@H](NCc2cc(C)ccc2F)C1	ZINC001207622661	1371454829	/nfs/dbraw/zinc/45/48/29/1371454829.db2.gz	IGEFZAXGUGXCBG-FUHWJXTLSA-N	0	3	348.462	3.196	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cncnc2C2CC2)CCCCC1	ZINC001120080606	1371481114	/nfs/dbraw/zinc/48/11/14/1371481114.db2.gz	LMKFHWZPNUEDDH-UHFFFAOYSA-N	0	3	348.878	3.129	20	30		EGEDHN
CC[C@@H](C)CC(=O)N1CCC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001207915847	1371538064	/nfs/dbraw/zinc/53/80/64/1371538064.db2.gz	ZRZGSIJWSYBKGS-RHSMWYFYSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC[C@@H](NCc2ncccc2C)C1	ZINC001208194078	1371632673	/nfs/dbraw/zinc/63/26/73/1371632673.db2.gz	NCTFDBIGVRWQRF-GOSISDBHSA-N	0	3	327.472	3.239	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001208202842	1371644761	/nfs/dbraw/zinc/64/47/61/1371644761.db2.gz	JXYROGRELFYBCL-SFHVURJKSA-N	0	3	344.886	3.397	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC1CC2(C1)CC(N[C@@H](C)c1c(F)cccc1F)C2	ZINC001120859641	1371786981	/nfs/dbraw/zinc/78/69/81/1371786981.db2.gz	WUEVYIWVVWSMAD-SMKZBEIOSA-N	0	3	347.409	3.202	20	30		EGEDHN
O=C(c1occ2c1CCC2)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001208748754	1371883272	/nfs/dbraw/zinc/88/32/72/1371883272.db2.gz	LETIVCZIFLDYET-LJQANCHMSA-N	0	3	348.446	3.014	20	30		EGEDHN
COc1ccccc1N1CCN(CCCc2cccc(C#N)c2)CC1	ZINC001208844164	1371915335	/nfs/dbraw/zinc/91/53/35/1371915335.db2.gz	FLSFWXMECQMVLV-UHFFFAOYSA-N	0	3	335.451	3.322	20	30		EGEDHN
C=CCOC(=O)N[C@@H]1CCCN(CCCc2ccccc2OC)C1	ZINC001208847840	1371916072	/nfs/dbraw/zinc/91/60/72/1371916072.db2.gz	XLZGAWLIWMEMEH-QGZVFWFLSA-N	0	3	332.444	3.004	20	30		EGEDHN
O=C(C1CC2(CCC2)C1)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001209099798	1371997077	/nfs/dbraw/zinc/99/70/77/1371997077.db2.gz	ALUPNQFTVXNMGH-FQEVSTJZSA-N	0	3	336.479	3.199	20	30		EGEDHN
Cc1cc(CN2C[C@@H]3CCN(C(=O)C#CC(C)(C)C)[C@@H]3C2)c(C)s1	ZINC001187827602	1388172189	/nfs/dbraw/zinc/17/21/89/1388172189.db2.gz	JTACGOCXDSTEEG-FUHWJXTLSA-N	0	3	344.524	3.447	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NC1CC2(CC(NCc3nccs3)C2)C1	ZINC001121611489	1372023942	/nfs/dbraw/zinc/02/39/42/1372023942.db2.gz	RQHBHJDGNZNWRV-MLAAGKJSSA-N	0	3	333.501	3.118	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NC1CC2(CC(NCc3oc(C)nc3C)C2)C1	ZINC001121611062	1372024186	/nfs/dbraw/zinc/02/41/86/1372024186.db2.gz	OUPJFSCAXYKXPT-SEWIDDPNSA-N	0	3	345.487	3.267	20	30		EGEDHN
C=CCN1C(=O)CCC12CCN(CCc1ccc(F)c(F)c1)CC2	ZINC001209242078	1372048207	/nfs/dbraw/zinc/04/82/07/1372048207.db2.gz	REOCQLMMRQTCMO-UHFFFAOYSA-N	0	3	334.410	3.150	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N[C@@H](C)c1nc(-c2ccc(F)c(C)c2)no1	ZINC001121896327	1372117827	/nfs/dbraw/zinc/11/78/27/1372117827.db2.gz	LFJHVDPQYJVXNL-SWLSCSKDSA-N	0	3	346.406	3.045	20	30		EGEDHN
C=CCC1(C(=O)N2CCC[C@H](NCc3cncc(C)c3)C2)CCC1	ZINC001209504223	1372123207	/nfs/dbraw/zinc/12/32/07/1372123207.db2.gz	QUGGOMIPYDBEFE-SFHVURJKSA-N	0	3	327.472	3.217	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001209526247	1372128505	/nfs/dbraw/zinc/12/85/05/1372128505.db2.gz	YGWNCOMYJRWOKW-YZGWKJHDSA-N	0	3	342.458	3.194	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CCN(Cc3ccc(C)[nH]3)CC2)CC1	ZINC001209565861	1372137951	/nfs/dbraw/zinc/13/79/51/1372137951.db2.gz	DAIUELOCEJFHAO-UHFFFAOYSA-N	0	3	331.460	3.324	20	30		EGEDHN
CC(F)(F)C1(C(=O)N2CCC[C@H](NCC#Cc3ccccc3)C2)CC1	ZINC001209668122	1372165814	/nfs/dbraw/zinc/16/58/14/1372165814.db2.gz	BLMWRHQCHJZOQH-KRWDZBQOSA-N	0	3	346.421	3.054	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@H](NCc2ccc(C#N)s2)C1	ZINC001209866172	1372218002	/nfs/dbraw/zinc/21/80/02/1372218002.db2.gz	PDUSCJJXBRGIEO-AWEZNQCLSA-N	0	3	331.485	3.303	20	30		EGEDHN
CCOc1ccc(C([O-])=C(C#N)C(=O)Nc2ccccc2Cl)cn1	ZINC001122415558	1372244855	/nfs/dbraw/zinc/24/48/55/1372244855.db2.gz	WSPYRKNEVSRAGD-GFCCVEGCSA-N	0	3	343.770	3.095	20	30		EGEDHN
CCOc1ccc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)cn1	ZINC001122415558	1372244861	/nfs/dbraw/zinc/24/48/61/1372244861.db2.gz	WSPYRKNEVSRAGD-GFCCVEGCSA-N	0	3	343.770	3.095	20	30		EGEDHN
C=C(C)Cn1c([C@H](CC)OCC)nnc1N1CCN(CC(C)C)CC1	ZINC001122484800	1372257303	/nfs/dbraw/zinc/25/73/03/1372257303.db2.gz	BZNDQOPRZAAUIF-KRWDZBQOSA-N	0	3	349.523	3.120	20	30		EGEDHN
N#CC(C(=O)c1ccc(F)c2cccnc12)c1nnc2n1CCCCC2	ZINC001122514878	1372264713	/nfs/dbraw/zinc/26/47/13/1372264713.db2.gz	WUDAUAHYZJHCIB-CQSZACIVSA-N	0	3	349.369	3.182	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)COC(F)(F)F)cc1	ZINC001122542401	1372270260	/nfs/dbraw/zinc/27/02/60/1372270260.db2.gz	OBVOHVATERCPMP-CYBMUJFWSA-N	0	3	342.317	3.213	20	30		EGEDHN
CC(C)N1CCC[C@@H]1C(=O)C(C#N)c1nc(-c2ccncc2)cs1	ZINC001122567807	1372276552	/nfs/dbraw/zinc/27/65/52/1372276552.db2.gz	GSDWGWWXEJDPPS-GDBMZVCRSA-N	0	3	340.452	3.254	20	30		EGEDHN
C=C(C)Cn1c([C@H](C)SC)nnc1N1CCN(C2CCCC2)CC1	ZINC001122596812	1372281093	/nfs/dbraw/zinc/28/10/93/1372281093.db2.gz	XSNWRGVQODYITJ-HNNXBMFYSA-N	0	3	349.548	3.343	20	30		EGEDHN
N#CC(C(=O)C1CCSCC1)c1nccn1Cc1ccccc1	ZINC001122605735	1372282415	/nfs/dbraw/zinc/28/24/15/1372282415.db2.gz	AXCUHLKNVAVMRX-INIZCTEOSA-N	0	3	325.437	3.251	20	30		EGEDHN
CC[C@H](C)CCC(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001210263537	1372308925	/nfs/dbraw/zinc/30/89/25/1372308925.db2.gz	DNNCNFYXKUZHQB-AZUAARDMSA-N	0	3	326.484	3.445	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCC(=O)c1ccc2c(c1)CCC2	ZINC001123234497	1372403768	/nfs/dbraw/zinc/40/37/68/1372403768.db2.gz	WAEFELSQQWQPIJ-QGZVFWFLSA-N	0	3	335.407	3.231	20	30		EGEDHN
C=CCC1(C(=O)N2CCC[C@@H](NCc3ccnn3C)C2)CCCCC1	ZINC001211214237	1372504279	/nfs/dbraw/zinc/50/42/79/1372504279.db2.gz	YXRAFKVQKFNSPU-QGZVFWFLSA-N	0	3	344.503	3.027	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N2CCC[C@@H](NC[C@@H](F)CC)C2)cc1	ZINC001211321200	1372531075	/nfs/dbraw/zinc/53/10/75/1372531075.db2.gz	MLUZQLNPCVDEFY-ZWKOTPCHSA-N	0	3	348.462	3.123	20	30		EGEDHN
C[C@H](NCCNC(=O)CSCC#N)c1ccc(Cl)c(Cl)c1	ZINC001123792141	1372590636	/nfs/dbraw/zinc/59/06/36/1372590636.db2.gz	KDHDWCRTRSFGHQ-JTQLQIEISA-N	0	3	346.283	3.017	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C[C@H]2C=CCCC2)C[C@H]1c1ccccc1	ZINC001211622305	1372591889	/nfs/dbraw/zinc/59/18/89/1372591889.db2.gz	OCYWRJVZGSUTKX-SESVDKBCSA-N	0	3	336.479	3.340	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H](CCC)C(C)C)C[C@H]1c1ccccc1	ZINC001211684347	1372602509	/nfs/dbraw/zinc/60/25/09/1372602509.db2.gz	SVDBLZLXNRLGNA-SLFFLAALSA-N	0	3	326.484	3.276	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C(C)(C)CC(C)C)C[C@H]1c1ccccc1	ZINC001211705826	1372606292	/nfs/dbraw/zinc/60/62/92/1372606292.db2.gz	RCCKSZMNMPVXRV-RBUKOAKNSA-N	0	3	326.484	3.276	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C[C@H](C)n2cccc2)C[C@H]1c1ccccc1	ZINC001211711814	1372607074	/nfs/dbraw/zinc/60/70/74/1372607074.db2.gz	UHCPWSGLXNVJTP-SESVDKBCSA-N	0	3	349.478	3.047	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2cc(C)oc2C)[C@H](OC)C1	ZINC001211838415	1372619533	/nfs/dbraw/zinc/61/95/33/1372619533.db2.gz	SEPOOISUNQBKRQ-QZTJIDSGSA-N	0	3	334.460	3.072	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2c(C)coc2C)[C@H](OC)C1	ZINC001212203836	1372670590	/nfs/dbraw/zinc/67/05/90/1372670590.db2.gz	ZTNCHQBBKUHMLM-IAGOWNOFSA-N	0	3	336.476	3.296	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CN(Cc2cc(C)ccc2C)C[C@H]1OC	ZINC001212324846	1372686728	/nfs/dbraw/zinc/68/67/28/1372686728.db2.gz	JJTOOAFDJWCHKD-RTBURBONSA-N	0	3	344.499	3.221	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN([C@H](C)c2cccc(C)c2)C[C@H]1OC	ZINC001212345042	1372691805	/nfs/dbraw/zinc/69/18/05/1372691805.db2.gz	YHCKEZDFEVOCPJ-BHIYHBOVSA-N	0	3	330.472	3.228	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NCCNCc1ccc(Cl)c(Cl)c1	ZINC001124488763	1372706089	/nfs/dbraw/zinc/70/60/89/1372706089.db2.gz	UFGBFQTXOZRUPA-GFCCVEGCSA-N	0	3	345.270	3.180	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NCCN[C@@H](C)c1ccc(F)c(Cl)c1	ZINC001124496163	1372706748	/nfs/dbraw/zinc/70/67/48/1372706748.db2.gz	XCCUCZOSPNPYSY-STQMWFEESA-N	0	3	342.842	3.227	20	30		EGEDHN
Cc1cccc(CN(CCN(C)C)C(=O)c2cc(C#N)ccc2C)c1	ZINC001125782896	1372855389	/nfs/dbraw/zinc/85/53/89/1372855389.db2.gz	DGSGACCVALIIDB-UHFFFAOYSA-N	0	3	335.451	3.379	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@@H](C)c2ccco2)[C@H](OC)C1	ZINC001213432124	1372905175	/nfs/dbraw/zinc/90/51/75/1372905175.db2.gz	CQIJJTAIYDZPAU-LZLYRXPVSA-N	0	3	336.476	3.169	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)C[C@@H](CC)c2ccc(C)cc2)[C@H](OC)C1	ZINC001213442689	1372906567	/nfs/dbraw/zinc/90/65/67/1372906567.db2.gz	UGHIXMLNAJKYIB-MISYRCLQSA-N	0	3	344.499	3.270	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2ccc(OC)cc2)[C@H](OC)C1	ZINC001213769351	1372958797	/nfs/dbraw/zinc/95/87/97/1372958797.db2.gz	QWLRPPPOOILYNR-RTBURBONSA-N	0	3	348.487	3.095	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2cc3c(s2)CCCC3)[C@H](OC)C1	ZINC001213814218	1372965795	/nfs/dbraw/zinc/96/57/95/1372965795.db2.gz	ITGHCNOXAFGFPD-HZPDHXFCSA-N	0	3	348.512	3.022	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2cc(CC)c(C)s2)[C@H](OC)C1	ZINC001213825175	1372967135	/nfs/dbraw/zinc/96/71/35/1372967135.db2.gz	HXJMCNMBMCEGOF-HZPDHXFCSA-N	0	3	336.501	3.014	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2c(C)cccc2F)[C@H](OC)C1	ZINC001213985851	1372990834	/nfs/dbraw/zinc/99/08/34/1372990834.db2.gz	QDCJZDSULGIACV-QZTJIDSGSA-N	0	3	348.462	3.310	20	30		EGEDHN
CC(C)CC(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001214056470	1373001640	/nfs/dbraw/zinc/00/16/40/1373001640.db2.gz	LIBMDWGFIALSOT-CRAIPNDOSA-N	0	3	332.875	3.174	20	30		EGEDHN
CC(C)(C)C#CC(=O)NCCNCc1ccc(Cl)c(Cl)c1	ZINC001126915469	1373051479	/nfs/dbraw/zinc/05/14/79/1373051479.db2.gz	CCSRBWXAUJWDKB-UHFFFAOYSA-N	0	3	327.255	3.249	20	30		EGEDHN
CC/C(C)=C\C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001214566929	1373080892	/nfs/dbraw/zinc/08/08/92/1373080892.db2.gz	WCKBEQMMBZIBDG-MWPJJREVSA-N	0	3	344.886	3.484	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](C)[C@H](NCc2cnn(C(C)(C)C)c2)C1	ZINC001214727601	1373110270	/nfs/dbraw/zinc/11/02/70/1373110270.db2.gz	JGIHQFIOOWMKNA-NVXWUHKLSA-N	0	3	346.519	3.177	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cscc2C(F)F)s1	ZINC001127491134	1373131731	/nfs/dbraw/zinc/13/17/31/1373131731.db2.gz	GXWDUSCNEYZFDP-UHFFFAOYSA-N	0	3	341.408	3.138	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H](C)[C@H](NCc2cc(F)ccc2OC)C1	ZINC001215696690	1373233095	/nfs/dbraw/zinc/23/30/95/1373233095.db2.gz	ILXPQJAEZPOQFE-RHSMWYFYSA-N	0	3	348.462	3.373	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@@H](C)CCC)[C@@H](n2ccnn2)C1	ZINC001128851472	1373316755	/nfs/dbraw/zinc/31/67/55/1373316755.db2.gz	OTYIIJKODDHTCA-KSZLIROESA-N	0	3	349.523	3.026	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)[C@H]3CC=CCC3)[C@H]2C1	ZINC001217265067	1373414661	/nfs/dbraw/zinc/41/46/61/1373414661.db2.gz	KIYZIZQKRIEOIA-GBESFXJTSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)C(C)(C)C2CCCC2)C1	ZINC001130395935	1373518970	/nfs/dbraw/zinc/51/89/70/1373518970.db2.gz	VGZFVJPMRYRLHG-OAHLLOKOSA-N	0	3	344.503	3.218	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)[C@@H]3CCCC34CC4)[C@H]2C1	ZINC001218168792	1373572393	/nfs/dbraw/zinc/57/23/93/1373572393.db2.gz	UKKIXLJWFROZSL-GBESFXJTSA-N	0	3	348.531	3.449	20	30		EGEDHN
CCCCc1ccc(CC(=O)NCCNCc2ccc(C#N)cc2)cc1	ZINC001130911109	1373605787	/nfs/dbraw/zinc/60/57/87/1373605787.db2.gz	XTQYJHBUDBSIRS-UHFFFAOYSA-N	0	3	349.478	3.349	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2occc2-c2ccccc2)cc1	ZINC001131052812	1373633534	/nfs/dbraw/zinc/63/35/34/1373633534.db2.gz	XKYNQWBNAAGUNH-UHFFFAOYSA-N	0	3	345.402	3.338	20	30		EGEDHN
CC(C)=C[C@H]1[C@@H](C(=O)NCCNCc2cccc(C#N)c2)C1(C)C	ZINC001131070750	1373637361	/nfs/dbraw/zinc/63/73/61/1373637361.db2.gz	HDZJJZJTBYHUEO-ROUUACIJSA-N	0	3	325.456	3.002	20	30		EGEDHN
CC1(CC(=O)NCCNCc2ccc(C#N)c(F)c2)CCCCC1	ZINC001131140809	1373650617	/nfs/dbraw/zinc/65/06/17/1373650617.db2.gz	UENUXZLUDDMHNZ-UHFFFAOYSA-N	0	3	331.435	3.264	20	30		EGEDHN
Cc1ccc(C2(CC(=O)Nc3ccc([O-])c(C#N)c3)CC[NH2+]CC2)cc1	ZINC001218954144	1373670393	/nfs/dbraw/zinc/67/03/93/1373670393.db2.gz	GGAXMIBLPYAULZ-UHFFFAOYSA-N	0	3	349.434	3.222	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)Nc1ccc(C(=O)OC)cc1C(C)=O	ZINC001218982570	1373674491	/nfs/dbraw/zinc/67/44/91/1373674491.db2.gz	PWHFWSZJQVAKAK-INIZCTEOSA-N	0	3	346.427	3.078	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)[C@H](CCCC)C(C)C)[C@H]2C1	ZINC001219059149	1373684235	/nfs/dbraw/zinc/68/42/35/1373684235.db2.gz	YCSNZGVETQQBAO-CEXWTWQISA-N	0	3	336.520	3.327	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCO[C@H]1C1CCN(C(=O)/C(C)=C/CC)CC1	ZINC001131456431	1373701498	/nfs/dbraw/zinc/70/14/98/1373701498.db2.gz	PNPQYTFVHKPEBT-SHOYWMEJSA-N	0	3	340.895	3.081	20	30		EGEDHN
C#CCCN1CC[C@]2(C1)CN(C(=O)CCCCC(C)(C)C)C[C@@H](C)O2	ZINC001131661112	1373748766	/nfs/dbraw/zinc/74/87/66/1373748766.db2.gz	JPUGNHUYNNWZFT-NQIIRXRSSA-N	0	3	348.531	3.308	20	30		EGEDHN
N[C@@H](CC1CCC1)C(=O)NC1=C(c2ccccc2)C(=O)c2ccccc21	ZINC001220179610	1373756166	/nfs/dbraw/zinc/75/61/66/1373756166.db2.gz	OTASWBDLQKXVEK-SFHVURJKSA-N	0	3	346.430	3.385	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C1(CCCC)CC1)C[C@@H](C)O2	ZINC001131688668	1373764076	/nfs/dbraw/zinc/76/40/76/1373764076.db2.gz	QBEMCXCJIXTCNV-YLJYHZDGSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CCC3CCCCCC3)C[C@@H]2O)CCC1	ZINC001220295164	1373764434	/nfs/dbraw/zinc/76/44/34/1373764434.db2.gz	JBXOVNMLFXTQEW-MOPGFXCFSA-N	0	3	348.531	3.255	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@H](C)N(Cc2cccc3c2CCOC3)C1	ZINC001131896549	1375033854	/nfs/dbraw/zinc/03/38/54/1375033854.db2.gz	TYAQMTQYQZVYBG-QFBILLFUSA-N	0	3	342.483	3.195	20	30		EGEDHN
CC#CCCCC(=O)NCC1CCN(Cc2sc(C)nc2C)CC1	ZINC001224158588	1375058127	/nfs/dbraw/zinc/05/81/27/1375058127.db2.gz	WDBCSYLMSORQRB-UHFFFAOYSA-N	0	3	347.528	3.282	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCC1CCN(Cc2cccc(C#N)c2)CC1	ZINC001224165096	1375058259	/nfs/dbraw/zinc/05/82/59/1375058259.db2.gz	GIARQYJBFWAPHE-DLBZAZTESA-N	0	3	339.483	3.345	20	30		EGEDHN
C=CCOCC(=O)N[C@@H]1CC[C@@H](C)N(Cc2ccc(C3CC3)cc2)C1	ZINC001131945939	1375061940	/nfs/dbraw/zinc/06/19/40/1375061940.db2.gz	DGBFMYBVJLHLBV-OXQOHEQNSA-N	0	3	342.483	3.236	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)CCc2cccc(Cl)c2)c1	ZINC001131989926	1375084151	/nfs/dbraw/zinc/08/41/51/1375084151.db2.gz	OZDGCSAAULVCLB-UHFFFAOYSA-N	0	3	341.842	3.050	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CC[C@@H](C)N(CCOc2ccccc2C)C1	ZINC001131996285	1375089634	/nfs/dbraw/zinc/08/96/34/1375089634.db2.gz	SGGANJQIUHCPIJ-MOPGFXCFSA-N	0	3	342.483	3.146	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@@H](C)N(Cc2ccc3cc[nH]c3c2)C1	ZINC001132003598	1375093378	/nfs/dbraw/zinc/09/33/78/1375093378.db2.gz	XRFQCXXDKCCGRC-VQIMIIECSA-N	0	3	337.467	3.441	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1CC[C@H](C)N(Cc2ccc3ncccc3c2)C1	ZINC001132016473	1375099666	/nfs/dbraw/zinc/09/96/66/1375099666.db2.gz	HHBKOCRZPAJQJS-FXAWDEMLSA-N	0	3	349.478	3.363	20	30		EGEDHN
CSC[C@H](C)C(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1	ZINC001225367859	1375107105	/nfs/dbraw/zinc/10/71/05/1375107105.db2.gz	HFOGYHVYHZMHLP-QXAKKESOSA-N	0	3	344.524	3.054	20	30		EGEDHN
C[C@@H]1CC[C@H](NC(=O)C#CC2CC2)CN1Cc1cccc2cccnc21	ZINC001132047406	1375115814	/nfs/dbraw/zinc/11/58/14/1375115814.db2.gz	XBHQRCUQZZZMGM-UZLBHIALSA-N	0	3	347.462	3.117	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1CC[C@@H](C)N(Cc2ccc(CO)cc2)C1	ZINC001132060782	1375126276	/nfs/dbraw/zinc/12/62/76/1375126276.db2.gz	LAGLGTOLQMCYIJ-APWZRJJASA-N	0	3	344.499	3.250	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1CC[C@@H](C)N(CCn2nc(C)cc2C)C1	ZINC001132060842	1375126409	/nfs/dbraw/zinc/12/64/09/1375126409.db2.gz	MBXDFGXDRSNLAB-AEFFLSMTSA-N	0	3	346.519	3.071	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@H](c2ccc(F)cc2)C(C)C)CC1	ZINC001225596199	1375129971	/nfs/dbraw/zinc/12/99/71/1375129971.db2.gz	CCWKKTWUYPTDMH-FQEVSTJZSA-N	0	3	344.474	3.417	20	30		EGEDHN
C#CCN1CCC(CNC(=O)[C@@H](C)CCCc2ccccc2)CC1	ZINC001225604230	1375131157	/nfs/dbraw/zinc/13/11/57/1375131157.db2.gz	ZATYUABWBRGROE-SFHVURJKSA-N	0	3	326.484	3.107	20	30		EGEDHN
C=CCCOCC(=O)NCC1CCN([C@H](C)c2ccccc2F)CC1	ZINC001225626192	1375134676	/nfs/dbraw/zinc/13/46/76/1375134676.db2.gz	UJFFSQLXRVMCOK-MRXNPFEDSA-N	0	3	348.462	3.308	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NCC1CCN(Cc2cc(C)ccc2F)CC1	ZINC001225630640	1375135022	/nfs/dbraw/zinc/13/50/22/1375135022.db2.gz	CYPAALMPPHGGDI-MRXNPFEDSA-N	0	3	348.462	3.053	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2(Cc3ccccc3)CCC2)CC[C@H]1C	ZINC001132111609	1375154122	/nfs/dbraw/zinc/15/41/22/1375154122.db2.gz	UHBWLFJJMYUUOE-QUCCMNQESA-N	0	3	338.495	3.392	20	30		EGEDHN
Cc1cccc(C2(C(=O)NCCNCc3cccc(C#N)c3)CCC2)c1	ZINC001132162721	1375180208	/nfs/dbraw/zinc/18/02/08/1375180208.db2.gz	PJVAAVHZQRRJSR-UHFFFAOYSA-N	0	3	347.462	3.194	20	30		EGEDHN
C=CCCCN1C[C@H](NC(=O)c2nc3c(s2)CCC3)CC[C@H]1C	ZINC001132187010	1375195891	/nfs/dbraw/zinc/19/58/91/1375195891.db2.gz	GYPKHRDEMSSKNN-ZIAGYGMSSA-N	0	3	333.501	3.181	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC1CCN(C/C=C/c2ccccc2)CC1	ZINC001226455268	1375262714	/nfs/dbraw/zinc/26/27/14/1375262714.db2.gz	DOABYYHCCMECAL-VEGGFIAOSA-N	0	3	342.483	3.262	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CCCC[C@H]1N[C@H](C)c1cnc(C)cn1	ZINC001226481111	1375265395	/nfs/dbraw/zinc/26/53/95/1375265395.db2.gz	AUUBXJVABGGVNJ-BRWVUGGUSA-N	0	3	344.503	3.465	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CC[C@@H](C)N(CCOCC3CC3)C2)CC1	ZINC001132292757	1375274757	/nfs/dbraw/zinc/27/47/57/1375274757.db2.gz	UWSAPAPVTVIPBJ-APWZRJJASA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCCC(=O)NC1CCN(CCOc2cccc(Cl)c2)CC1	ZINC001226535023	1375278117	/nfs/dbraw/zinc/27/81/17/1375278117.db2.gz	PSZMJBLJTNGTBB-UHFFFAOYSA-N	0	3	336.863	3.266	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCNCc1csc(Br)c1	ZINC001132308786	1375286901	/nfs/dbraw/zinc/28/69/01/1375286901.db2.gz	SAWASELRVXAUHW-UHFFFAOYSA-N	0	3	345.306	3.319	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC1CCN(C/C=C/c2ccc(Cl)cc2)CC1	ZINC001226640783	1375298430	/nfs/dbraw/zinc/29/84/30/1375298430.db2.gz	PPIBHONWMNIYDL-HSWBROFVSA-N	0	3	331.847	3.093	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)CCc2ccccc2C)CC[C@H]1C	ZINC001132326381	1375304606	/nfs/dbraw/zinc/30/46/06/1375304606.db2.gz	DLRXSAAENGVPFD-QUCCMNQESA-N	0	3	344.499	3.099	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2snnc2C(C)C)CC[C@@H]1C	ZINC001132367947	1375331971	/nfs/dbraw/zinc/33/19/71/1375331971.db2.gz	GWGRXUINCNLCCB-KBPBESRZSA-N	0	3	336.505	3.210	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COc2ccccc2OCC)CC[C@@H]1C	ZINC001132460825	1375403182	/nfs/dbraw/zinc/40/31/82/1375403182.db2.gz	LYBVIFWTAVGHBQ-IRXDYDNUSA-N	0	3	346.471	3.009	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2cccc(C3CC3)c2)CC[C@@H]1C	ZINC001132522970	1375439155	/nfs/dbraw/zinc/43/91/55/1375439155.db2.gz	VVKNWMSRFQQRNJ-JXFKEZNVSA-N	0	3	342.483	3.349	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC1CCN(CCc2scnc2C)CC1	ZINC001227562227	1375443200	/nfs/dbraw/zinc/44/32/00/1375443200.db2.gz	LBFPCXMPFPOOQY-UHFFFAOYSA-N	0	3	335.517	3.177	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC1CCN(CCOc2cccc(F)c2)CC1	ZINC001227570943	1375445742	/nfs/dbraw/zinc/44/57/42/1375445742.db2.gz	UCCBKQLRGFNWKG-UHFFFAOYSA-N	0	3	348.462	3.387	20	30		EGEDHN
CC#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)CC(C)C)CC1	ZINC001132549601	1375455182	/nfs/dbraw/zinc/45/51/82/1375455182.db2.gz	WBGSTBNMNQDZAR-FQEVSTJZSA-N	0	3	341.499	3.334	20	30		EGEDHN
C#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)C(CC)CC)CC1	ZINC001132551553	1375457590	/nfs/dbraw/zinc/45/75/90/1375457590.db2.gz	JJXQXEXZRGHBTP-HXUWFJFHSA-N	0	3	341.499	3.334	20	30		EGEDHN
C#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)C=C2CCC2)CC1	ZINC001132554800	1375461691	/nfs/dbraw/zinc/46/16/91/1375461691.db2.gz	MMNDZRVCIDUSRZ-FQEVSTJZSA-N	0	3	337.467	3.008	20	30		EGEDHN
CC#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)[C@@H](F)CC)CC1	ZINC001132555178	1375462086	/nfs/dbraw/zinc/46/20/86/1375462086.db2.gz	QYPYZMWJSMYWFQ-OALUTQOASA-N	0	3	345.462	3.036	20	30		EGEDHN
C#CCN1CC[C@@H](CN(Cc2scnc2C)C(=O)CCC(=C)C)C1	ZINC001132559317	1375467887	/nfs/dbraw/zinc/46/78/87/1375467887.db2.gz	WSGGIBFMIOGJRV-QGZVFWFLSA-N	0	3	345.512	3.092	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CCCC[C@H]1NCc1cccnc1OC	ZINC001228112543	1375519032	/nfs/dbraw/zinc/51/90/32/1375519032.db2.gz	KWQIPVTUOUBEHE-KBAYOESNSA-N	0	3	345.487	3.210	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CCCC[C@H]1NCC(=C)Br	ZINC001228269656	1375538651	/nfs/dbraw/zinc/53/86/51/1375538651.db2.gz	HNYARNBGYDPAOZ-ZIAGYGMSSA-N	0	3	329.282	3.268	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](C)[C@@H](CNCc2ncc(C)s2)C1	ZINC001132761261	1375551709	/nfs/dbraw/zinc/55/17/09/1375551709.db2.gz	HPYZQPRGNJIRKJ-WBVHZDCISA-N	0	3	347.528	3.219	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@H](C)[C@@H](CNC/C(Cl)=C\Cl)C1	ZINC001132809268	1375575358	/nfs/dbraw/zinc/57/53/58/1375575358.db2.gz	NKNZEHKAGDHJNA-WNMQVZLMSA-N	0	3	331.287	3.039	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NC1CCN(CCc2scnc2C)CC1	ZINC001228749103	1375662320	/nfs/dbraw/zinc/66/23/20/1375662320.db2.gz	POCRAJBJXHRVCV-UONOGXRCSA-N	0	3	335.517	3.033	20	30		EGEDHN
CCc1ccccc1[C@@H]1C[C@H]1C(=O)NCCNCc1cccc(C#N)c1	ZINC001132985171	1375694089	/nfs/dbraw/zinc/69/40/89/1375694089.db2.gz	ASJMYSFEULRAGK-LEWJYISDSA-N	0	3	347.462	3.130	20	30		EGEDHN
C=CCCCC(=O)NC1CCN(Cc2ccccc2N(C)C)CC1	ZINC001228927523	1375718347	/nfs/dbraw/zinc/71/83/47/1375718347.db2.gz	DDBBRIMCOHQFIZ-UHFFFAOYSA-N	0	3	329.488	3.190	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](C)[C@H](CNCc3nccs3)C2)CCC1	ZINC001133104423	1375777043	/nfs/dbraw/zinc/77/70/43/1375777043.db2.gz	DBMSTPYQLOCXHO-JKSUJKDBSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)CC/C=C\c2ccccc2)CC1	ZINC001229178668	1375782573	/nfs/dbraw/zinc/78/25/73/1375782573.db2.gz	VULQRBPFYDOIKY-POHAHGRESA-N	0	3	342.483	3.263	20	30		EGEDHN
C=CCCCC(=O)NCCNCc1ccc(F)c(Br)c1	ZINC001133142682	1375804208	/nfs/dbraw/zinc/80/42/08/1375804208.db2.gz	HGSSYGGZRKMLHC-UHFFFAOYSA-N	0	3	343.240	3.150	20	30		EGEDHN
CCCCCC(=O)N1CC[C@H](N(C)Cc2ccc(OCC#N)cc2)C1	ZINC001188905342	1388405541	/nfs/dbraw/zinc/40/55/41/1388405541.db2.gz	CXVYFFGCWVIQDY-SFHVURJKSA-N	0	3	343.471	3.202	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)CCc1ccco1	ZINC001133377341	1375957991	/nfs/dbraw/zinc/95/79/91/1375957991.db2.gz	RSKLQCXDLQBOJG-UHFFFAOYSA-N	0	3	344.842	3.117	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C[C@H]1C=CCC1	ZINC001133382473	1375963639	/nfs/dbraw/zinc/96/36/39/1375963639.db2.gz	KNHUIXWRWCBITC-INIZCTEOSA-N	0	3	330.859	3.248	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H]1CC[C@@H]2C[C@@H]2C1	ZINC001133399575	1375984439	/nfs/dbraw/zinc/98/44/39/1375984439.db2.gz	SLGHENCKJXEUAK-KZNAEPCWSA-N	0	3	344.886	3.328	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C1(C)CCCC1	ZINC001133403619	1375986813	/nfs/dbraw/zinc/98/68/13/1375986813.db2.gz	BAMBXXOJJXNXDM-UHFFFAOYSA-N	0	3	332.875	3.472	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@H]1CC12CC2	ZINC001133405969	1375991026	/nfs/dbraw/zinc/99/10/26/1375991026.db2.gz	ZLJZBGJYUKHUEL-QGZVFWFLSA-N	0	3	330.859	3.082	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)C(=O)NC1CCN(CCOCC)CC1	ZINC001230321627	1375995908	/nfs/dbraw/zinc/99/59/08/1375995908.db2.gz	OTJOICNJAVNFHX-IBGZPJMESA-N	0	3	344.499	3.039	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1ccccc1C#N)NC(=O)CCc1ccco1	ZINC001133648746	1376135421	/nfs/dbraw/zinc/13/54/21/1376135421.db2.gz	GCXQCKXKMNXQIU-JKSUJKDBSA-N	0	3	339.439	3.157	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)[C@@H]1CC[C@@H](C)C1)Cc1cccnc1	ZINC001230861259	1376168460	/nfs/dbraw/zinc/16/84/60/1376168460.db2.gz	FRYKBSMUIKBDGB-IEBWSBKVSA-N	0	3	329.488	3.402	20	30		EGEDHN
C[C@@H](C[C@H](C)[NH2+]Cc1ccc(C#N)s1)NC(=O)c1ccccc1[O-]	ZINC001133723115	1376176394	/nfs/dbraw/zinc/17/63/94/1376176394.db2.gz	RFHGIXSOOVQLFC-STQMWFEESA-N	0	3	343.452	3.012	20	30		EGEDHN
C#CCCN(CCCNC(=O)C[C@@H](CC)C(C)C)Cc1cccnc1	ZINC001230906309	1376180840	/nfs/dbraw/zinc/18/08/40/1376180840.db2.gz	QWDHADDUXNBXLS-HXUWFJFHSA-N	0	3	343.515	3.486	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N(C)C[C@H]1CCN1CCC1=CCCCC1	ZINC001231093743	1376202431	/nfs/dbraw/zinc/20/24/31/1376202431.db2.gz	BWFXTWMXDAXGOC-PKOBYXMFSA-N	0	3	334.504	3.391	20	30		EGEDHN
C=CCOc1cccc(CN2CC[C@@]3(CCCN3C(=O)C(C)C)C2)c1	ZINC001231623812	1376285264	/nfs/dbraw/zinc/28/52/64/1376285264.db2.gz	WZRVPNYCVOHBBA-NRFANRHFSA-N	0	3	342.483	3.474	20	30		EGEDHN
C#Cc1cccc(CN2CC[C@@H]3[C@@H]2CCN3C(=O)OC(C)(C)C)c1	ZINC001231656221	1376296847	/nfs/dbraw/zinc/29/68/47/1376296847.db2.gz	GSYPXCUTAHKBAZ-ZWKOTPCHSA-N	0	3	326.440	3.252	20	30		EGEDHN
C#Cc1cccc(CN2CCC3(CN(c4cccc(F)c4)C3=O)CC2)c1	ZINC001231659022	1376298246	/nfs/dbraw/zinc/29/82/46/1376298246.db2.gz	DICRAYQCXCNLAM-UHFFFAOYSA-N	0	3	348.421	3.436	20	30		EGEDHN
CC/C(C)=C/C(=O)N[C@H](C)C[C@@H](C)NCc1cc(F)ccc1C#N	ZINC001134285407	1376458764	/nfs/dbraw/zinc/45/87/64/1376458764.db2.gz	RPJVZJDPUDFBJC-ISJXMTRFSA-N	0	3	331.435	3.427	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)C2[C@@H]3CCCCCC[C@@H]23)s1	ZINC001134315071	1376471020	/nfs/dbraw/zinc/47/10/20/1376471020.db2.gz	WGBUODPDAJPWSQ-HZPDHXFCSA-N	0	3	331.485	3.042	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)CC2CCCCCC2)cc1F	ZINC001134410313	1376516028	/nfs/dbraw/zinc/51/60/28/1376516028.db2.gz	MNQFMPKMAOEJQL-UHFFFAOYSA-N	0	3	331.435	3.264	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H](C)C[C@H](C)NCc1ccn(CC)n1	ZINC001134417975	1376522319	/nfs/dbraw/zinc/52/23/19/1376522319.db2.gz	CIURDXFEYUAXOL-JKSUJKDBSA-N	0	3	332.492	3.044	20	30		EGEDHN
CCN(Cc1cccc(C#N)n1)C[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC001232926782	1376537884	/nfs/dbraw/zinc/53/78/84/1376537884.db2.gz	BQTPRSLFIVHDRM-HNNXBMFYSA-N	0	3	344.459	3.032	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)C(C)(C)C(C)C	ZINC001134440311	1376538318	/nfs/dbraw/zinc/53/83/18/1376538318.db2.gz	UERWPCYNDBXPIA-CHWSQXEVSA-N	0	3	333.314	3.450	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCC2(CC1)C(=O)N[C@@H]2c1ccccc1	ZINC001233081474	1376567671	/nfs/dbraw/zinc/56/76/71/1376567671.db2.gz	XORKQRAYZWHWII-HXUWFJFHSA-N	0	3	345.446	3.320	20	30		EGEDHN
COc1ccc(OC2CCN(Cc3ccc(C#N)cc3C)CC2)nc1	ZINC001233083375	1376567830	/nfs/dbraw/zinc/56/78/30/1376567830.db2.gz	IIDSXTKSBAICNS-UHFFFAOYSA-N	0	3	337.423	3.314	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CCCN(Cc3cc(C)ns3)C2)CC1	ZINC001233309570	1376610047	/nfs/dbraw/zinc/61/00/47/1376610047.db2.gz	PLXVNAFIEDIGTM-UHFFFAOYSA-N	0	3	349.500	3.452	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)C[C@H](C)NCc2oc(CC)nc2C)CCC1	ZINC001134593520	1376616452	/nfs/dbraw/zinc/61/64/52/1376616452.db2.gz	NYCYNBUTODGGKO-LSDHHAIUSA-N	0	3	345.487	3.112	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H](C)C[C@@H](C)NCc1ncc(C)s1	ZINC001134637627	1376636427	/nfs/dbraw/zinc/63/64/27/1376636427.db2.gz	DNZHDUMGNIYUNM-ZIAGYGMSSA-N	0	3	346.500	3.126	20	30		EGEDHN
C[C@H](CC1CCCCC1)C(=O)NCCNCc1ccc(C#N)cc1	ZINC001134677833	1376651095	/nfs/dbraw/zinc/65/10/95/1376651095.db2.gz	KFNXXSJGVXYFIC-MRXNPFEDSA-N	0	3	327.472	3.371	20	30		EGEDHN
C[C@H](CC1CCCC1)C(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001134683546	1376656033	/nfs/dbraw/zinc/65/60/33/1376656033.db2.gz	RGMXZJOZSRDARI-CQSZACIVSA-N	0	3	331.435	3.120	20	30		EGEDHN
CC[C@@H](CC1CCCC1)C(=O)NCCNCc1ccc(C#N)cc1	ZINC001134688675	1376658976	/nfs/dbraw/zinc/65/89/76/1376658976.db2.gz	VKBPAQHVZNTHIN-IBGZPJMESA-N	0	3	327.472	3.371	20	30		EGEDHN
CCc1ccc(C(=O)N[C@@H](C)C[C@H](C)NCc2ccccc2C#N)o1	ZINC001134752684	1376699803	/nfs/dbraw/zinc/69/98/03/1376699803.db2.gz	RNUMPNHIHGFRNB-GJZGRUSLSA-N	0	3	339.439	3.400	20	30		EGEDHN
CCc1ccc(C(=O)N[C@@H](C)C[C@@H](C)NCc2ccccc2C#N)o1	ZINC001134752683	1376699833	/nfs/dbraw/zinc/69/98/33/1376699833.db2.gz	RNUMPNHIHGFRNB-CABCVRRESA-N	0	3	339.439	3.400	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)C1(F)CCCC1)NCc1cc(F)ccc1C#N	ZINC001134792151	1376725807	/nfs/dbraw/zinc/72/58/07/1376725807.db2.gz	ZBDMCRUHGITMKB-KBPBESRZSA-N	0	3	349.425	3.353	20	30		EGEDHN
CCCCCCCN1CC[C@H]1CN(C)C(=O)[C@H]1CCCc2cn[nH]c21	ZINC001234322093	1376808068	/nfs/dbraw/zinc/80/80/68/1376808068.db2.gz	FSZDKGPZPMFTSC-ROUUACIJSA-N	0	3	346.519	3.333	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)COc1cc(C)ccc1F	ZINC001234331774	1376812725	/nfs/dbraw/zinc/81/27/25/1376812725.db2.gz	CGMMYHPDFFAPGN-MRXNPFEDSA-N	0	3	334.435	3.012	20	30		EGEDHN
C=CCCCCCN1CC[C@H]1CN(C)C(=O)c1cc(C2CC2)n(C)n1	ZINC001235038844	1376837560	/nfs/dbraw/zinc/83/75/60/1376837560.db2.gz	XUHPARHYIMLLAA-KRWDZBQOSA-N	0	3	344.503	3.190	20	30		EGEDHN
C=CCCCN1CC[C@@H]1CN(C)C(=O)c1ccc(OC)c(OC)c1C	ZINC001235634037	1376881193	/nfs/dbraw/zinc/88/11/93/1376881193.db2.gz	STBYBNMWYZDDGG-MRXNPFEDSA-N	0	3	346.471	3.125	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)C1(C2CC2)CCC1	ZINC001135086853	1376887995	/nfs/dbraw/zinc/88/79/95/1376887995.db2.gz	LKMDSIDAORCBBO-OLZOCXBDSA-N	0	3	343.309	3.348	20	30		EGEDHN
C[C@@H](C(=O)NCCNCc1ccc(C#N)c(F)c1)[C@@H](C)C(C)(C)C	ZINC001135177680	1376951138	/nfs/dbraw/zinc/95/11/38/1376951138.db2.gz	KAPRVRBADYHBRF-ZIAGYGMSSA-N	0	3	333.451	3.221	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H](C)C[C@H](C)NCc1ncc(Cl)n1C	ZINC001135181085	1376953410	/nfs/dbraw/zinc/95/34/10/1376953410.db2.gz	MCUFEGOKHGFTKY-QWHCGFSZSA-N	0	3	340.899	3.049	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H](C)C[C@@H](C)NCc1csnc1OC	ZINC001135181573	1376953965	/nfs/dbraw/zinc/95/39/65/1376953965.db2.gz	RLHCVVFLRNEXBZ-CHWSQXEVSA-N	0	3	339.505	3.127	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H](C)C[C@@H](C)NCc1ccn(C(C)C)n1	ZINC001135182191	1376955063	/nfs/dbraw/zinc/95/50/63/1376955063.db2.gz	ZGYGSNNXWSAAGT-HZPDHXFCSA-N	0	3	334.508	3.439	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H](C)C[C@@H](C)NCc2ccccc2C#N)cc1	ZINC001135184315	1376957720	/nfs/dbraw/zinc/95/77/20/1376957720.db2.gz	FSRDUYPGEKXIAO-SJORKVTESA-N	0	3	345.446	3.226	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H](C)C[C@@H](C)NCc1oc(C)nc1C	ZINC001135194389	1376966493	/nfs/dbraw/zinc/96/64/93/1376966493.db2.gz	UPNSCGDUMBAVNG-HUUCEWRRSA-N	0	3	333.476	3.248	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H](C)C[C@@H](C)NCc1oc(CC)nc1C	ZINC001135224636	1376985705	/nfs/dbraw/zinc/98/57/05/1376985705.db2.gz	GSZNVBYGHADOKS-CABCVRRESA-N	0	3	333.476	3.112	20	30		EGEDHN
CC#CCCCC(=O)N[C@H](C)C[C@H](C)NCc1ccn(C(C)C)n1	ZINC001135230628	1376990120	/nfs/dbraw/zinc/99/01/20/1376990120.db2.gz	PRFWHQZKERFLAI-DLBZAZTESA-N	0	3	332.492	3.031	20	30		EGEDHN
Cc1coc(C(=O)N[C@@H](C)C[C@H](C)NCc2ccccc2C#N)c1	ZINC001135237780	1376994048	/nfs/dbraw/zinc/99/40/48/1376994048.db2.gz	FKLDEXSUPFMCKH-GJZGRUSLSA-N	0	3	325.412	3.146	20	30		EGEDHN
CCc1cc(CN2CC[C@@H](CNC(=O)OC(C)(C)C)C2)ccc1C#N	ZINC001238778566	1377002020	/nfs/dbraw/zinc/00/20/20/1377002020.db2.gz	OOALUEMSDBNWNR-INIZCTEOSA-N	0	3	343.471	3.467	20	30		EGEDHN
C=CCCCNC(=S)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC001247735955	1377063586	/nfs/dbraw/zinc/06/35/86/1377063586.db2.gz	TWUKMZVJJPRQRU-GOSISDBHSA-N	0	3	331.529	3.424	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](C)C[C@H](C)NCc2nccn2CC)CC1	ZINC001135416448	1377083195	/nfs/dbraw/zinc/08/31/95/1377083195.db2.gz	UKCDBNUPNYDABD-JKSUJKDBSA-N	0	3	332.492	3.022	20	30		EGEDHN
CC1(C)C[C@@]1(C(=O)NCCNCc1cccc(C#N)c1)c1ccccc1	ZINC001135650430	1377175502	/nfs/dbraw/zinc/17/55/02/1377175502.db2.gz	PCIDVHYJMFZSHO-QFIPXVFZSA-N	0	3	347.462	3.132	20	30		EGEDHN
CCCC(C)(C)C(=O)N1CC[C@H](CNCc2ccccc2C#N)C1	ZINC001266012980	1377175598	/nfs/dbraw/zinc/17/55/98/1377175598.db2.gz	OMFHVKMCSLFPOA-MRXNPFEDSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)c1ccccc1Cl	ZINC001266184925	1377219355	/nfs/dbraw/zinc/21/93/55/1377219355.db2.gz	UPHZUXYJCPWQSE-LLVKDONJSA-N	0	3	345.668	3.347	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CC[C@H](N(C)Cc2cc(F)ccc2C)C1	ZINC001189241952	1388493705	/nfs/dbraw/zinc/49/37/05/1388493705.db2.gz	BLAGVBSYEXILSE-LPHOPBHVSA-N	0	3	348.462	3.148	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cnn(C(C)C)c1)[C@H]2CC	ZINC001137075080	1377473501	/nfs/dbraw/zinc/47/35/01/1377473501.db2.gz	ZBECYVVEICABGR-ICSRJNTNSA-N	0	3	344.503	3.386	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@@H]1CCN(Cc1cnn(C(C)C)c1)C2	ZINC001137076572	1377474097	/nfs/dbraw/zinc/47/40/97/1377474097.db2.gz	KTSVYDWGIMFJCJ-RTBURBONSA-N	0	3	333.476	3.038	20	30		EGEDHN
C#CCOc1ccc(CN2CCN(CCc3ccccc3)CC2)cc1	ZINC001138558768	1377741888	/nfs/dbraw/zinc/74/18/88/1377741888.db2.gz	IWRWUNRHLARUGJ-UHFFFAOYSA-N	0	3	334.463	3.059	20	30		EGEDHN
C#CCOc1ccc(CN2CCC[C@]3(C[C@@H](OCC=C)CO3)C2)cc1	ZINC001138558757	1377742188	/nfs/dbraw/zinc/74/21/88/1377742188.db2.gz	IFVPYGRESKQFSR-RTWAWAEBSA-N	0	3	341.451	3.025	20	30		EGEDHN
C#CCOc1ccc(CN2CCC[C@@H](C(=O)OC(C)(C)C)C2)cc1	ZINC001138558954	1377742249	/nfs/dbraw/zinc/74/22/49/1377742249.db2.gz	LQDHASDFNUFYQF-QGZVFWFLSA-N	0	3	329.440	3.252	20	30		EGEDHN
C#CCOc1ccc(CN2CC[C@@H](N3CCCCC3)[C@@H](F)C2)cc1	ZINC001138560994	1377742798	/nfs/dbraw/zinc/74/27/98/1377742798.db2.gz	UAAHEIMITBIJMW-VQTJNVASSA-N	0	3	330.447	3.097	20	30		EGEDHN
C=CCO[C@H]1CO[C@]2(C1)CCCN(Cc1c[nH]nc1C(C)(C)C)C2	ZINC001138578947	1377746785	/nfs/dbraw/zinc/74/67/85/1377746785.db2.gz	HHSQHMIBIOUHSM-APWZRJJASA-N	0	3	333.476	3.033	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@]3(C[C@H](OCC4CC4)CO3)C2)c1[O-]	ZINC001138628660	1377756840	/nfs/dbraw/zinc/75/68/40/1377756840.db2.gz	BFLWMUVBJYWUGI-FPOVZHCZSA-N	0	3	343.467	3.281	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@]3(C[C@H](OCC4CC4)CO3)C2)c1[O-]	ZINC001138628660	1377756841	/nfs/dbraw/zinc/75/68/41/1377756841.db2.gz	BFLWMUVBJYWUGI-FPOVZHCZSA-N	0	3	343.467	3.281	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@]3(CCC(=O)N3)[C@@H]2CC)c1[O-]	ZINC001138627354	1377756874	/nfs/dbraw/zinc/75/68/74/1377756874.db2.gz	DCEHYAXHNDMSIG-PXNSSMCTSA-N	0	3	328.456	3.144	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@]3(CCC(=O)N3)[C@@H]2CC)c1[O-]	ZINC001138627354	1377756875	/nfs/dbraw/zinc/75/68/75/1377756875.db2.gz	DCEHYAXHNDMSIG-PXNSSMCTSA-N	0	3	328.456	3.144	20	30		EGEDHN
Cn1ccc2c1cccc2CN1CCN(c2ccc(C#N)cc2)CC1	ZINC001139159658	1377841920	/nfs/dbraw/zinc/84/19/20/1377841920.db2.gz	MTXDOQDPNRBIDW-UHFFFAOYSA-N	0	3	330.435	3.372	20	30		EGEDHN
N#Cc1ccnc(-c2ccc(CN3CCN(C4CCC4)CC3)cc2)c1	ZINC001139400063	1377878991	/nfs/dbraw/zinc/87/89/91/1377878991.db2.gz	DYRPISQLUULXGY-UHFFFAOYSA-N	0	3	332.451	3.290	20	30		EGEDHN
CN(Cc1c[nH]c2c1cccc2C#N)Cc1ccc2c(c1)OCCO2	ZINC001139701103	1377937803	/nfs/dbraw/zinc/93/78/03/1377937803.db2.gz	ANCCMVDUIUFFRH-UHFFFAOYSA-N	0	3	333.391	3.443	20	30		EGEDHN
N#Cc1cccc2c(CN3CCC[C@H](Oc4ccncc4)C3)c[nH]c21	ZINC001139706933	1377938179	/nfs/dbraw/zinc/93/81/79/1377938179.db2.gz	CUICESQCHAVMHB-SFHVURJKSA-N	0	3	332.407	3.478	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@@H]1CC[N@@H+](Cc1cc(F)ccc1[O-])C2	ZINC001140053948	1377996739	/nfs/dbraw/zinc/99/67/39/1377996739.db2.gz	GANFVMRSNLOPGV-MOPGFXCFSA-N	0	3	335.419	3.105	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@@H]1CC[N@H+](Cc1cc(F)ccc1[O-])C2	ZINC001140053948	1377996740	/nfs/dbraw/zinc/99/67/40/1377996740.db2.gz	GANFVMRSNLOPGV-MOPGFXCFSA-N	0	3	335.419	3.105	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3ccc(O)cc3Cl)C2)C1=O	ZINC001140082206	1378003092	/nfs/dbraw/zinc/00/30/92/1378003092.db2.gz	NQCFUVUUOYYIOO-SFHVURJKSA-N	0	3	334.847	3.046	20	30		EGEDHN
O=C1C=C2CN(Cc3cnc(-c4ccccc4F)nc3)CCC2S1	ZINC001140400775	1378057496	/nfs/dbraw/zinc/05/74/96/1378057496.db2.gz	DKYMQXAMHDTFQU-INIZCTEOSA-N	0	3	341.411	3.057	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2coc(CCC)n2)CCCC1	ZINC001753670803	1440461937	/nfs/dbraw/zinc/46/19/37/1440461937.db2.gz	FIVRVAPYZVKEFX-UHFFFAOYSA-N	0	3	325.840	3.012	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](NC(=O)c2ccoc2Cl)C2CC2)s1	ZINC001276576143	1378179968	/nfs/dbraw/zinc/17/99/68/1378179968.db2.gz	ZOGRLBTYLJJXHN-CQSZACIVSA-N	0	3	349.843	3.164	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CCN(Cc3cnccc3C)C2)C1	ZINC001141031618	1378214975	/nfs/dbraw/zinc/21/49/75/1378214975.db2.gz	VEZYGTPPXSXVIV-LJQANCHMSA-N	0	3	329.444	3.001	20	30		EGEDHN
N#CC1(NC(=O)[C@@H]2CCN(Cc3ccc[nH]3)[C@H]2c2ccccc2)CCC1	ZINC001279770046	1378321056	/nfs/dbraw/zinc/32/10/56/1378321056.db2.gz	ADKOOBALKKZBSQ-MOPGFXCFSA-N	0	3	348.450	3.140	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@@H]1CCN(Cc1[nH]cnc1C(C)(C)C)C2	ZINC001142217742	1378421955	/nfs/dbraw/zinc/42/19/55/1378421955.db2.gz	RJQFSAHJFBONPR-XLIONFOSSA-N	0	3	347.503	3.281	20	30		EGEDHN
CN(Cc1c[nH]c2cc(C#N)ccc12)Cc1ccc2c(c1)OCCO2	ZINC001142912044	1378508038	/nfs/dbraw/zinc/50/80/38/1378508038.db2.gz	SHADWKYQAAQNKN-UHFFFAOYSA-N	0	3	333.391	3.443	20	30		EGEDHN
N#Cc1ccc2c(CN3CCC(N4CCCCC4=O)CC3)c[nH]c2c1	ZINC001142922316	1378509120	/nfs/dbraw/zinc/50/91/20/1378509120.db2.gz	CCRLXAYAGKZFGP-UHFFFAOYSA-N	0	3	336.439	3.016	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@@H]1CCN(Cc1cccc(F)c1OC)C2	ZINC001143524365	1378608510	/nfs/dbraw/zinc/60/85/10/1378608510.db2.gz	QBVOGPYLDXRDIG-QUCCMNQESA-N	0	3	349.446	3.408	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3cc(F)cc(F)c3C)C2)C1=O	ZINC001143760527	1378642620	/nfs/dbraw/zinc/64/26/20/1378642620.db2.gz	AAGGBIIQZPDWMU-IBGZPJMESA-N	0	3	334.410	3.274	20	30		EGEDHN
CCN(Cc1cncc(C#N)c1)C[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC001144084926	1378680789	/nfs/dbraw/zinc/68/07/89/1378680789.db2.gz	SKNHUDGTZYWSIT-OAHLLOKOSA-N	0	3	344.459	3.032	20	30		EGEDHN
CN(Cc1ccccc1F)C1CCN(Cc2ccc(C#N)cn2)CC1	ZINC001144166671	1378690938	/nfs/dbraw/zinc/69/09/38/1378690938.db2.gz	PUXQFMTXJPJELB-UHFFFAOYSA-N	0	3	338.430	3.189	20	30		EGEDHN
C#Cc1ccc(CN2CC[C@]3(CCN3C(=O)OC(C)(C)C)C2)cc1	ZINC001144568393	1378746153	/nfs/dbraw/zinc/74/61/53/1378746153.db2.gz	UBBFQLRLIHWDKZ-FQEVSTJZSA-N	0	3	326.440	3.253	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)C[C@H](C)NCc2cnc(C)o2)CCCCC1	ZINC001146699027	1378900013	/nfs/dbraw/zinc/90/00/13/1378900013.db2.gz	BQPBUQBJOMURPW-JKSUJKDBSA-N	0	3	345.487	3.330	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2nccnc2C)CCCC1	ZINC001146821446	1378928533	/nfs/dbraw/zinc/92/85/33/1378928533.db2.gz	MEVOMRHUQPNGIF-CVEARBPZSA-N	0	3	344.503	3.294	20	30		EGEDHN
CC(C)CCC(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001146980736	1378951446	/nfs/dbraw/zinc/95/14/46/1378951446.db2.gz	HIGOZJVBFPBHRD-UHFFFAOYSA-N	0	3	325.456	3.029	20	30		EGEDHN
C[C@H](C(=O)NCCNCc1ccc(C#N)cc1)c1cc2ccccc2o1	ZINC001147201951	1378986174	/nfs/dbraw/zinc/98/61/74/1378986174.db2.gz	NRWVBYNSJCGPAK-HNNXBMFYSA-N	0	3	347.418	3.314	20	30		EGEDHN
C#CCCCC(=O)N1CC2(C1)CCN(CCc1ccccc1Cl)C2	ZINC001147428209	1379017909	/nfs/dbraw/zinc/01/79/09/1379017909.db2.gz	MLYUZZFSECOOGN-UHFFFAOYSA-N	0	3	344.886	3.220	20	30		EGEDHN
C=C(C)CCC(=O)N1CC2(C1)CCN(CCc1ccc(F)c(F)c1)C2	ZINC001147639969	1379054394	/nfs/dbraw/zinc/05/43/94/1379054394.db2.gz	JOMMIQGRYQXTAO-UHFFFAOYSA-N	0	3	348.437	3.398	20	30		EGEDHN
C=C(C)CCC(=O)N1CC2(C1)CCN(CCO[C@@H]1CCCC[C@H]1C)C2	ZINC001147657893	1379056440	/nfs/dbraw/zinc/05/64/40/1379056440.db2.gz	GRUYMIBMYNSETR-RTBURBONSA-N	0	3	348.531	3.472	20	30		EGEDHN
CC[C@@H](Cc1ccccc1C)C(=O)NCCNCc1ccc(C#N)cc1	ZINC001147857902	1379092215	/nfs/dbraw/zinc/09/22/15/1379092215.db2.gz	QXGLPVQXDOBRRD-FQEVSTJZSA-N	0	3	349.478	3.341	20	30		EGEDHN
C#CCCCCCC(=O)N1CC2(C1)CCN(Cc1ccsc1)C2	ZINC001148060108	1379110795	/nfs/dbraw/zinc/11/07/95/1379110795.db2.gz	VZFSPCCVSYOPAL-UHFFFAOYSA-N	0	3	330.497	3.366	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC2(C1)CCN(Cc1cccnc1C)C2	ZINC001148129519	1379121814	/nfs/dbraw/zinc/12/18/14/1379121814.db2.gz	GCSSUVIKXZUUML-QGZVFWFLSA-N	0	3	327.472	3.027	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC2(C1)CCN(CCc1csc(C)n1)C2	ZINC001148146567	1379124562	/nfs/dbraw/zinc/12/45/62/1379124562.db2.gz	ICARADDZHBBFOV-HNNXBMFYSA-N	0	3	347.528	3.131	20	30		EGEDHN
C=CCCCC(=O)N1CC2(C1)CCN(CCOc1ccc(C)cc1)C2	ZINC001148181041	1379128830	/nfs/dbraw/zinc/12/88/30/1379128830.db2.gz	IXRLMMLUUYBOTM-UHFFFAOYSA-N	0	3	342.483	3.264	20	30		EGEDHN
CC[C@H](C)[C@H](C)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001148500596	1379191596	/nfs/dbraw/zinc/19/15/96/1379191596.db2.gz	JLZYGSLVBJJEHW-IRXDYDNUSA-N	0	3	339.483	3.275	20	30		EGEDHN
CC1(CCC(=O)N2CC3(C2)CCN(Cc2cccc(C#N)c2)C3)CC1	ZINC001148543159	1379207344	/nfs/dbraw/zinc/20/73/44/1379207344.db2.gz	VTWJILFZORXTHI-UHFFFAOYSA-N	0	3	337.467	3.173	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)c1cccc(C(F)(F)F)c1C	ZINC001148750779	1379259633	/nfs/dbraw/zinc/25/96/33/1379259633.db2.gz	YGYWACKIJKFBGB-ZDUSSCGKSA-N	0	3	326.362	3.394	20	30		EGEDHN
C=CCCC(=O)NC[C@@H]1CN(Cc2ccc(C3CC3)cc2)CCCO1	ZINC001149361249	1379369203	/nfs/dbraw/zinc/36/92/03/1379369203.db2.gz	HNPXJOYXASRLLP-HXUWFJFHSA-N	0	3	342.483	3.237	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cccc3ccccc32)s1	ZINC001149711235	1379433914	/nfs/dbraw/zinc/43/39/14/1379433914.db2.gz	IEWHZSVNEBCVPN-UHFFFAOYSA-N	0	3	335.432	3.293	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@H]1CN(Cc2ccc(C)cc2)CCCO1	ZINC001150138527	1379501017	/nfs/dbraw/zinc/50/10/17/1379501017.db2.gz	AKQAXBWTPMLWHF-QUCCMNQESA-N	0	3	344.499	3.304	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@@H]1CN(CC2=CCCCC2)CCCO1	ZINC001150138769	1379501041	/nfs/dbraw/zinc/50/10/41/1379501041.db2.gz	DVABAEWKYCDENF-PKOBYXMFSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)C[C@@H](C)C2CCCCC2)C1	ZINC001150436304	1379552195	/nfs/dbraw/zinc/55/21/95/1379552195.db2.gz	QTBKVKSDIRQKMV-MJGOQNOKSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)C[C@@H]2CCCCC2(C)C)C1	ZINC001150829963	1379620255	/nfs/dbraw/zinc/62/02/55/1379620255.db2.gz	BGZBNHFLLOMQJV-ZWKOTPCHSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)C[C@H]2C=CCCC2)CC1	ZINC001151175001	1379672277	/nfs/dbraw/zinc/67/22/77/1379672277.db2.gz	STRJBBOAKGILIM-SFHVURJKSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@H]2CCCC[C@H]2C)CC1	ZINC001151281336	1379691898	/nfs/dbraw/zinc/69/18/98/1379691898.db2.gz	JGRLDTMDCBITFD-MSOLQXFVSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@@H]2C[C@H]2CC(C)C)CC1	ZINC001151327488	1379699706	/nfs/dbraw/zinc/69/97/06/1379699706.db2.gz	XAJIGFFMZWZLBC-QZTJIDSGSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@H](F)CCCCCC)CC1	ZINC001151392614	1379711059	/nfs/dbraw/zinc/71/10/59/1379711059.db2.gz	NLBKIMKMMXSMAC-QGZVFWFLSA-N	0	3	342.499	3.468	20	30		EGEDHN
C[C@@H](C(=O)NCCNCc1ccc(C#N)s1)c1cccc(Cl)c1	ZINC001151640109	1379752783	/nfs/dbraw/zinc/75/27/83/1379752783.db2.gz	FVZRYJDNCHLVSN-GFCCVEGCSA-N	0	3	347.871	3.283	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)c1ccccc1	ZINC001151653873	1379758324	/nfs/dbraw/zinc/75/83/24/1379758324.db2.gz	BMOJGAMUQIBPAM-OAHLLOKOSA-N	0	3	339.414	3.338	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)CC(C)(C)C	ZINC001151937962	1379819300	/nfs/dbraw/zinc/81/93/00/1379819300.db2.gz	RPWHGJPWAHDOGX-CQSZACIVSA-N	0	3	333.451	3.460	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)CC[C@H]2CCc3ccccc32)cc1	ZINC001152041538	1379848596	/nfs/dbraw/zinc/84/85/96/1379848596.db2.gz	OSZDNCWLNAOSCI-HXUWFJFHSA-N	0	3	347.462	3.274	20	30		EGEDHN
CCCCO[C@@H](C)C(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)cc1	ZINC001152227592	1379890648	/nfs/dbraw/zinc/89/06/48/1379890648.db2.gz	HIADRIZIUWVHQZ-SJORKVTESA-N	0	3	345.487	3.090	20	30		EGEDHN
CCCCO[C@H](C)C(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)cc1	ZINC001152227591	1379890848	/nfs/dbraw/zinc/89/08/48/1379890848.db2.gz	HIADRIZIUWVHQZ-IAGOWNOFSA-N	0	3	345.487	3.090	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)/C=C/C(C)(C)C	ZINC001152425781	1379931841	/nfs/dbraw/zinc/93/18/41/1379931841.db2.gz	ADSLJLHWKZPFKV-SIFUEBAJSA-N	0	3	327.472	3.487	20	30		EGEDHN
CC(C)(CC(=O)NCCNCc1ccc(C#N)cc1)c1ccccc1	ZINC001152451996	1379935735	/nfs/dbraw/zinc/93/57/35/1379935735.db2.gz	PFLKVPYWYSKNNI-UHFFFAOYSA-N	0	3	335.451	3.132	20	30		EGEDHN
CCN(C/C=C/c1ccccc1)[C@H](C)CNC(=O)c1cc(C#N)c[nH]1	ZINC001152619312	1379957766	/nfs/dbraw/zinc/95/77/66/1379957766.db2.gz	BLXGMHAFORUKJI-OJXHRBAXSA-N	0	3	336.439	3.040	20	30		EGEDHN
CCN(Cc1ccc(Cl)cc1)[C@H](C)CNC(=O)c1cc(C#N)c[nH]1	ZINC001152627389	1379958733	/nfs/dbraw/zinc/95/87/33/1379958733.db2.gz	BXKCJGSEVPOQDG-CYBMUJFWSA-N	0	3	344.846	3.180	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)C(F)=C(C)C	ZINC001152723492	1379975697	/nfs/dbraw/zinc/97/56/97/1379975697.db2.gz	FGJYNHXCOKVRHK-CYBMUJFWSA-N	0	3	335.398	3.287	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)[C@H]2CCCCc3ccccc32)cc1	ZINC001152754066	1379978730	/nfs/dbraw/zinc/97/87/30/1379978730.db2.gz	NBKOAQDPGXUVHF-NRFANRHFSA-N	0	3	347.462	3.274	20	30		EGEDHN
CC1(C)CCC(C(=O)NCCNCc2ccc(C#N)c(F)c2)CC1	ZINC001152842936	1379986346	/nfs/dbraw/zinc/98/63/46/1379986346.db2.gz	GCGZENSMKDQNER-UHFFFAOYSA-N	0	3	331.435	3.120	20	30		EGEDHN
CCN(C/C=C/c1ccccc1)[C@H](C)CNC(=O)c1c[nH]c(C#N)c1	ZINC001152854699	1379987053	/nfs/dbraw/zinc/98/70/53/1379987053.db2.gz	BDMYVNSSOBBIBB-OJXHRBAXSA-N	0	3	336.439	3.040	20	30		EGEDHN
Cc1cccc2oc(C(=O)NCCNCc3ccc(C#N)cc3)cc21	ZINC001152893451	1379991206	/nfs/dbraw/zinc/99/12/06/1379991206.db2.gz	XOGHXIDGKXEEEH-UHFFFAOYSA-N	0	3	333.391	3.133	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)c1ccoc1Cl	ZINC001153012001	1380007142	/nfs/dbraw/zinc/00/71/42/1380007142.db2.gz	AMOPRNPSOIDEFE-CYBMUJFWSA-N	0	3	345.830	3.445	20	30		EGEDHN
CCN(C[C@H](OC)c1ccccc1)[C@H](C)CNC(=O)C#CC(C)(C)C	ZINC001153260407	1380046425	/nfs/dbraw/zinc/04/64/25/1380046425.db2.gz	RIDKIOBKZWERBG-MJGOQNOKSA-N	0	3	344.499	3.250	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H](C)N(CC)C[C@H](O)c1ccc(CC)cc1	ZINC001153626011	1380106609	/nfs/dbraw/zinc/10/66/09/1380106609.db2.gz	UVIZPXGLJMXKSJ-XLIONFOSSA-N	0	3	346.515	3.465	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cc(-c3ccccc3)co2)cc1	ZINC001153848253	1380142911	/nfs/dbraw/zinc/14/29/11/1380142911.db2.gz	IXAPCSOXARJZFP-UHFFFAOYSA-N	0	3	345.402	3.338	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)Cc1ccc(CCCC)cc1	ZINC001154201316	1380225903	/nfs/dbraw/zinc/22/59/03/1380225903.db2.gz	CZEPSAWCVPNNDX-GOSISDBHSA-N	0	3	328.500	3.422	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H](C)N(CC)Cc1ccc(OC)c(C#N)c1	ZINC001154957888	1380381290	/nfs/dbraw/zinc/38/12/90/1380381290.db2.gz	RIMMPTMLDHOYLS-MRXNPFEDSA-N	0	3	343.471	3.250	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)[C@@H]1CC12CCC2	ZINC001155502754	1380461898	/nfs/dbraw/zinc/46/18/98/1380461898.db2.gz	CHXXLGGJQLAXMR-PBHICJAKSA-N	0	3	343.446	3.214	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)[C@@H](C)C(C)C	ZINC001155581317	1380470488	/nfs/dbraw/zinc/47/04/88/1380470488.db2.gz	PVJMXYSCIROOJX-CABCVRRESA-N	0	3	333.451	3.316	20	30		EGEDHN
N#Cc1c(Cl)ncnc1NC[C@@H](c1ccccc1)N1CCCC1	ZINC001156529250	1380588827	/nfs/dbraw/zinc/58/88/27/1380588827.db2.gz	FDHCMHRCASSKDQ-HNNXBMFYSA-N	0	3	327.819	3.251	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)c1cccn1CC	ZINC001156918926	1380726848	/nfs/dbraw/zinc/72/68/48/1380726848.db2.gz	ZWUVBGRCFVRLOB-MRXNPFEDSA-N	0	3	338.455	3.020	20	30		EGEDHN
C#CCCCC(=O)NCCCNCc1c(Cl)cccc1OCC	ZINC001157171557	1380793506	/nfs/dbraw/zinc/79/35/06/1380793506.db2.gz	WZFYUVHKVZRBDA-UHFFFAOYSA-N	0	3	336.863	3.138	20	30		EGEDHN
C=CCCOCC(=O)NC[C@@H](C)N(CC)Cc1ccc(C)c(F)c1	ZINC001157209873	1380810843	/nfs/dbraw/zinc/81/08/43/1380810843.db2.gz	ONYQZQWZOFFYSC-MRXNPFEDSA-N	0	3	336.451	3.053	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CCCC[C@@H]1CN(C)Cc1ccccc1	ZINC001157648240	1380989144	/nfs/dbraw/zinc/98/91/44/1380989144.db2.gz	GCFONJNRVROLTP-UYAOXDASSA-N	0	3	344.499	3.481	20	30		EGEDHN
N#Cc1c(Cl)nccc1C(F)(F)N1CCN[C@H](c2ccccc2)C1	ZINC001157758633	1381024285	/nfs/dbraw/zinc/02/42/85/1381024285.db2.gz	AGWOBOCDYHHPSJ-HNNXBMFYSA-N	0	3	348.784	3.302	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)COC/C=C\c1ccccc1	ZINC001158124185	1381134649	/nfs/dbraw/zinc/13/46/49/1381134649.db2.gz	LKDMQZWSFZRVLS-FNUUXAGOSA-N	0	3	342.483	3.215	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)C[C@@H](C)c1c(C)n[nH]c1C	ZINC001158171964	1381147664	/nfs/dbraw/zinc/14/76/64/1381147664.db2.gz	RDMHMFXFSGYWSM-RHSMWYFYSA-N	0	3	332.492	3.019	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc(C)cc(OC)c1C	ZINC001158195430	1381156190	/nfs/dbraw/zinc/15/61/90/1381156190.db2.gz	ZPPGUZQJFCMHJC-QGZVFWFLSA-N	0	3	330.472	3.425	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc2ccccc2[nH]c1=O	ZINC001158296267	1381188325	/nfs/dbraw/zinc/18/83/25/1381188325.db2.gz	IKNVLDJDWBHCAS-MRXNPFEDSA-N	0	3	339.439	3.053	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc2cc(F)ccc2[nH]1	ZINC001158305212	1381194256	/nfs/dbraw/zinc/19/42/56/1381194256.db2.gz	YNHPZRHDJUNVIR-MRXNPFEDSA-N	0	3	329.419	3.420	20	30		EGEDHN
C=CCCCC(=O)N1CCCC[C@@H]1CN(C)CCOCC1CCC1	ZINC001158419676	1381239427	/nfs/dbraw/zinc/23/94/27/1381239427.db2.gz	WGTJQEJTACALLI-LJQANCHMSA-N	0	3	336.520	3.472	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc(N2CC=CC2)cc1	ZINC001158461511	1381252361	/nfs/dbraw/zinc/25/23/61/1381252361.db2.gz	XYNJIYWPPXXVNU-HXUWFJFHSA-N	0	3	339.483	3.175	20	30		EGEDHN
CC1=C(C)C[C@H](C(=O)NCCCNCc2ccccc2C#N)CC1	ZINC001158722297	1381366403	/nfs/dbraw/zinc/36/64/03/1381366403.db2.gz	XCGXSFFMCSHYJF-QGZVFWFLSA-N	0	3	325.456	3.291	20	30		EGEDHN
N#Cc1ccc(CN2CC=C(CCNC(=O)Cc3ccoc3)CC2)cc1	ZINC001159934649	1381941774	/nfs/dbraw/zinc/94/17/74/1381941774.db2.gz	XHOLSFVQIWMXBS-UHFFFAOYSA-N	0	3	349.434	3.032	20	30		EGEDHN
C#CCCCC(=O)NCCC1=CCN(Cc2csc(C)c2)CC1	ZINC001159964609	1381952599	/nfs/dbraw/zinc/95/25/99/1381952599.db2.gz	UBDNJDGBKVAGAV-UHFFFAOYSA-N	0	3	330.497	3.498	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc([C@@H]3C[C@@H]3C)o2)CC1	ZINC001160121313	1382004304	/nfs/dbraw/zinc/00/43/04/1382004304.db2.gz	WOAMMNTVLVIXCT-DOTOQJQBSA-N	0	3	326.440	3.178	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@](C)(OC)c2ccccc2F)CC1	ZINC001160337029	1382076205	/nfs/dbraw/zinc/07/62/05/1382076205.db2.gz	FAYJSPGOPAWQIS-FQEVSTJZSA-N	0	3	346.446	3.012	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2nccc3ccsc32)CC1	ZINC001160423823	1382100220	/nfs/dbraw/zinc/10/02/20/1382100220.db2.gz	XBRXNABWLYYIJH-UHFFFAOYSA-N	0	3	339.464	3.072	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)Cc2c(C)cccc2Cl)CC1	ZINC001160600503	1382149824	/nfs/dbraw/zinc/14/98/24/1382149824.db2.gz	MBTZJPNUMGQWQC-UHFFFAOYSA-N	0	3	344.886	3.353	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C2(c3ccccc3)CCC2)CC1	ZINC001160628988	1382156422	/nfs/dbraw/zinc/15/64/22/1382156422.db2.gz	WUWZDCVEATZEJZ-UHFFFAOYSA-N	0	3	336.479	3.270	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2c(F)cc(C)cc2F)CC1	ZINC001160636242	1382157179	/nfs/dbraw/zinc/15/71/79/1382157179.db2.gz	QOSYZQAYRPLIEA-UHFFFAOYSA-N	0	3	332.394	3.049	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCC1=CCN(CCOc2ccccc2)CC1	ZINC001160915149	1382233471	/nfs/dbraw/zinc/23/34/71/1382233471.db2.gz	LROAPDILYSHCBP-UHFFFAOYSA-N	0	3	342.483	3.416	20	30		EGEDHN
C=CCCCC(=O)NCCC1=CCN(Cc2ncccc2C)CC1	ZINC001161056824	1382286029	/nfs/dbraw/zinc/28/60/29/1382286029.db2.gz	QUPZOYMFTWYKJV-UHFFFAOYSA-N	0	3	327.472	3.385	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H]2C[C@H]2c2c(F)cccc2F)CC1	ZINC001161181014	1382329301	/nfs/dbraw/zinc/32/93/01/1382329301.db2.gz	IZOGSKPOYIDELH-HZPDHXFCSA-N	0	3	346.421	3.393	20	30		EGEDHN
Cc1cnc(NCC2CCN(Cc3ccccc3F)CC2)c(C#N)n1	ZINC001161194242	1382336840	/nfs/dbraw/zinc/33/68/40/1382336840.db2.gz	PJXFWHQSARMKGX-UHFFFAOYSA-N	0	3	339.418	3.120	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)CCCc2ccc(F)cc2)CC1	ZINC001161314345	1382368579	/nfs/dbraw/zinc/36/85/79/1382368579.db2.gz	WHOKDJOBAKAPKD-UHFFFAOYSA-N	0	3	342.458	3.310	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)C(C)(C)CCOC)CC1	ZINC001328587626	1388783084	/nfs/dbraw/zinc/78/30/84/1388783084.db2.gz	MRPVBRLYQPZHKV-UHFFFAOYSA-N	0	3	344.927	3.362	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C2(CCOCC)CCCC2)CC1	ZINC001161559400	1382438953	/nfs/dbraw/zinc/43/89/53/1382438953.db2.gz	CYCLQNFECNBPIV-UHFFFAOYSA-N	0	3	346.515	3.135	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H]2C[C@@]23CCc2ccccc23)CC1	ZINC001161617812	1382461189	/nfs/dbraw/zinc/46/11/89/1382461189.db2.gz	UDXPDSYOZZBHIN-JTHBVZDNSA-N	0	3	348.490	3.052	20	30		EGEDHN
CC(C)N1CCN(c2ccc(N[C@@H](C#N)c3ccccc3)cn2)CC1	ZINC001161717616	1382488393	/nfs/dbraw/zinc/48/83/93/1382488393.db2.gz	FEUZFMQRJTZMLP-IBGZPJMESA-N	0	3	335.455	3.289	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)Cc2sc(C)cc2C)CC1	ZINC001161796635	1382508448	/nfs/dbraw/zinc/50/84/48/1382508448.db2.gz	PXKYGAFDYBZKCC-UHFFFAOYSA-N	0	3	330.497	3.069	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H]2Cc3ccc(Cl)cc32)CC1	ZINC001161805711	1382512607	/nfs/dbraw/zinc/51/26/07/1382512607.db2.gz	OSOHVZQQOZFRIC-SFHVURJKSA-N	0	3	330.859	3.304	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc(F)cc2Cl)CC1	ZINC001161808503	1382514084	/nfs/dbraw/zinc/51/40/84/1382514084.db2.gz	HKNGQQWVFLLUFJ-UHFFFAOYSA-N	0	3	334.822	3.254	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H](C)Oc2ccc(C)cc2)CC1	ZINC001161825263	1382521875	/nfs/dbraw/zinc/52/18/75/1382521875.db2.gz	YRKWEYITEWPSIK-KRWDZBQOSA-N	0	3	328.456	3.087	20	30		EGEDHN
N#Cc1nc(Cl)cnc1NC[C@@H]1CCCN1Cc1ccccc1	ZINC001161885482	1382540440	/nfs/dbraw/zinc/54/04/40/1382540440.db2.gz	SKVWWRZFSFVDNP-AWEZNQCLSA-N	0	3	327.819	3.078	20	30		EGEDHN
C=CCCC(=O)NCC1(COC)CCN(Cc2cccc(F)c2)CC1	ZINC001162150944	1382640604	/nfs/dbraw/zinc/64/06/04/1382640604.db2.gz	JHHKLLYXCYVBKY-UHFFFAOYSA-N	0	3	348.462	3.137	20	30		EGEDHN
C#CCN1CCC(CNC(=O)CCCC[C@H](C)CC)(COC)CC1	ZINC001162282946	1382720897	/nfs/dbraw/zinc/72/08/97/1382720897.db2.gz	BGBXTHSZAQBAIB-GOSISDBHSA-N	0	3	336.520	3.071	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCC1(COC)CCN(C[C@@H](F)CC)CC1	ZINC001162424990	1382755440	/nfs/dbraw/zinc/75/54/40/1382755440.db2.gz	XNAHETBMSUQKCZ-SJORKVTESA-N	0	3	342.499	3.182	20	30		EGEDHN
C#CCN1CCC(CNC(=O)C(C)(C)CCCCC)(COC)CC1	ZINC001162618080	1382812196	/nfs/dbraw/zinc/81/21/96/1382812196.db2.gz	WQWAUZYYYCOSOR-UHFFFAOYSA-N	0	3	336.520	3.071	20	30		EGEDHN
CCOC(=O)C(C)N=Nc1cc(NC(=N)C(C)(C)C)ccc1[N+](=O)[O-]	ZINC001162666995	1382826757	/nfs/dbraw/zinc/82/67/57/1382826757.db2.gz	REFHNBPRSUQNIL-GRSHGNNSSA-N	0	3	349.391	3.381	20	30		EGEDHN
C#CCCCC(=O)N(CCNC[C@H](F)CC)CCc1ccccc1	ZINC001162791225	1382874443	/nfs/dbraw/zinc/87/44/43/1382874443.db2.gz	ZCMXGWIBGOJRBK-LJQANCHMSA-N	0	3	332.463	3.199	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)CC(C)(C)CC(F)F	ZINC001162799028	1382875792	/nfs/dbraw/zinc/87/57/92/1382875792.db2.gz	QWWFODGOAHIATP-UHFFFAOYSA-N	0	3	341.240	3.062	20	30		EGEDHN
CC(C)C#CC(=O)N(CCNC/C=C/Cl)CCc1ccccc1	ZINC001162806653	1382878931	/nfs/dbraw/zinc/87/89/31/1382878931.db2.gz	GTTRMIKDJKEGBT-WUXMJOGZSA-N	0	3	332.875	3.059	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CCC(F)(F)C1	ZINC001162832207	1382889394	/nfs/dbraw/zinc/88/93/94/1382889394.db2.gz	LANDSQNVIHZCOD-GOSISDBHSA-N	0	3	348.437	3.106	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)Cc1cc(C)cc(C)c1	ZINC001162911213	1382914208	/nfs/dbraw/zinc/91/42/08/1382914208.db2.gz	HUXQUNMASKQRRE-UHFFFAOYSA-N	0	3	348.490	3.140	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CCCC(F)(F)C1	ZINC001162929194	1382918806	/nfs/dbraw/zinc/91/88/06/1382918806.db2.gz	RWPHDDXMAMXRLQ-SFHVURJKSA-N	0	3	348.437	3.106	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1C[C@]1(C)CC	ZINC001162971163	1382932937	/nfs/dbraw/zinc/93/29/37/1382932937.db2.gz	ZIROAZUOUUTCSK-FPOVZHCZSA-N	0	3	326.484	3.107	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CC12CCCC2	ZINC001162977130	1382934114	/nfs/dbraw/zinc/93/41/14/1382934114.db2.gz	GOAJEUNWTMCYLS-FQEVSTJZSA-N	0	3	338.495	3.251	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CC[C@H](C)CC1	ZINC001162986866	1382938298	/nfs/dbraw/zinc/93/82/98/1382938298.db2.gz	CFCVXIFJQWWDLU-XUTJKUGGSA-N	0	3	340.511	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1cc2ccccc2[nH]1	ZINC001162996918	1382942074	/nfs/dbraw/zinc/94/20/74/1382942074.db2.gz	GIMYRRNFGMZLGA-UHFFFAOYSA-N	0	3	345.446	3.076	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H](C=C)c1ccccc1	ZINC001163001469	1382943854	/nfs/dbraw/zinc/94/38/54/1382943854.db2.gz	FEJHJYKWESWQDR-QFIPXVFZSA-N	0	3	346.474	3.250	20	30		EGEDHN
C=CCCN1CCN(Cc2ccc(CNC(=O)[C@H](C)CC)cc2)CC1	ZINC001163018633	1382949136	/nfs/dbraw/zinc/94/91/36/1382949136.db2.gz	VTKBIPLWQSTQDI-GOSISDBHSA-N	0	3	343.515	3.043	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)[C@H]2CC=CCC2)CC1	ZINC001163388755	1383039015	/nfs/dbraw/zinc/03/90/15/1383039015.db2.gz	GQFWVTVCINXWSL-AWEZNQCLSA-N	0	3	341.293	3.127	20	30		EGEDHN
C=CCc1ccc(NC(=O)C(C)(C)C)c(N[C@H]2CN3CCC2CC3)n1	ZINC001163385591	1383037595	/nfs/dbraw/zinc/03/75/95/1383037595.db2.gz	DFJXQHJPBLKCRW-KRWDZBQOSA-N	0	3	342.487	3.301	20	30		EGEDHN
C[C@H](C(=O)NCCC1(CNCc2cc(C#N)ccc2F)CC1)C1CC1	ZINC001163965477	1383140747	/nfs/dbraw/zinc/14/07/47/1383140747.db2.gz	SGUBPXQPZNSCRF-AWEZNQCLSA-N	0	3	343.446	3.120	20	30		EGEDHN
C/C=C(\C)C(=O)NCCC1(CNCc2ccc(C#N)cc2F)CC1	ZINC001163991735	1383143724	/nfs/dbraw/zinc/14/37/24/1383143724.db2.gz	FJFHUPVFLGRWIR-LZWSPWQCSA-N	0	3	329.419	3.040	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)NCCC1(CNCc2ccc(C#N)cc2F)CC1	ZINC001164124806	1383158802	/nfs/dbraw/zinc/15/88/02/1383158802.db2.gz	DODIFBYAPAJEBL-MRXNPFEDSA-N	0	3	343.446	3.120	20	30		EGEDHN
CC1(C)CCC[C@@H]1C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001164171834	1383162550	/nfs/dbraw/zinc/16/25/50/1383162550.db2.gz	QDDVFMSEAVPQBS-MRXNPFEDSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCCNCc1cc(OC)ccc1Cl	ZINC001164223468	1383168050	/nfs/dbraw/zinc/16/80/50/1383168050.db2.gz	SSCVJSNYKOHJAR-UONOGXRCSA-N	0	3	338.879	3.403	20	30		EGEDHN
C#CCCCC(=O)NCCC1(CNCc2cc(O)ccc2Cl)CC1	ZINC001164308805	1383176442	/nfs/dbraw/zinc/17/64/42/1383176442.db2.gz	KZPRBOQUFVBRAO-UHFFFAOYSA-N	0	3	348.874	3.225	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCC1(CN[C@H](C)c2cnc(C)cn2)CC1	ZINC001165220768	1383251908	/nfs/dbraw/zinc/25/19/08/1383251908.db2.gz	AYPWIPWTTCZKDG-MRXNPFEDSA-N	0	3	344.503	3.324	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1ccc(F)c(Cl)c1	ZINC001165460165	1383298312	/nfs/dbraw/zinc/29/83/12/1383298312.db2.gz	CCPDYPXNYQGHPE-UHFFFAOYSA-N	0	3	349.631	3.097	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cn(C)c3ccccc23)CC1	ZINC001166019185	1383377937	/nfs/dbraw/zinc/37/79/37/1383377937.db2.gz	LALDXSDWYIRJIB-UHFFFAOYSA-N	0	3	345.874	3.421	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2c(C)onc2C2CC2)CC1	ZINC001166211649	1383402760	/nfs/dbraw/zinc/40/27/60/1383402760.db2.gz	ZRLMUJXWPPQTSD-UHFFFAOYSA-N	0	3	337.851	3.103	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCC1(CNCc2cc(C#N)ccc2F)CC1	ZINC001166579043	1383440601	/nfs/dbraw/zinc/44/06/01/1383440601.db2.gz	BIMKDNDKULNZLE-UHFFFAOYSA-N	0	3	343.446	3.286	20	30		EGEDHN
C[C@@H]1CCCN(c2nccnc2C(C#N)C(=O)OC(C)(C)C)[C@H]1C	ZINC001166612978	1383447100	/nfs/dbraw/zinc/44/71/00/1383447100.db2.gz	BZEHUTWVIPACDC-RDBSUJKOSA-N	0	3	330.432	3.050	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCC1(CNCc2oc(CC)nc2C)CC1	ZINC001166703974	1383463717	/nfs/dbraw/zinc/46/37/17/1383463717.db2.gz	LUEBDYQJTLZXCQ-CABCVRRESA-N	0	3	347.503	3.380	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCCC1(CN[C@@H](C)c2cnccn2)CC1	ZINC001166755884	1383472607	/nfs/dbraw/zinc/47/26/07/1383472607.db2.gz	PCUDFCVETHMYIL-CVEARBPZSA-N	0	3	330.476	3.016	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCCC1(CNCc2cccnc2OC)CC1	ZINC001166756099	1383473032	/nfs/dbraw/zinc/47/30/32/1383473032.db2.gz	SHMXMWBNLXLDBJ-INIZCTEOSA-N	0	3	345.487	3.069	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C[C@H]2CCCC2(F)F)CC1	ZINC001166836268	1383485474	/nfs/dbraw/zinc/48/54/74/1383485474.db2.gz	HHOGYHMNBFBBPL-CYBMUJFWSA-N	0	3	334.838	3.441	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCC1(CN[C@H](C)c2cnc(C)cn2)CC1	ZINC001167018447	1383519926	/nfs/dbraw/zinc/51/99/26/1383519926.db2.gz	JNUCSSZKTUOBJK-VQIMIIECSA-N	0	3	344.503	3.324	20	30		EGEDHN
C=CCC1(C(=O)NCCC2(CN[C@@H](C)c3cnccn3)CC2)CCC1	ZINC001167035396	1383524374	/nfs/dbraw/zinc/52/43/74/1383524374.db2.gz	GJDHWEFTRWRECM-INIZCTEOSA-N	0	3	342.487	3.160	20	30		EGEDHN
CN(CC1CCCCC1)c1nccnc1C(C#N)C(=O)OC(C)(C)C	ZINC001167097324	1383538437	/nfs/dbraw/zinc/53/84/37/1383538437.db2.gz	WBXBRQMOPGVSGQ-OAHLLOKOSA-N	0	3	344.459	3.442	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCC2(CNCc3ccccc3C#N)CC2)C1	ZINC001167130192	1383546866	/nfs/dbraw/zinc/54/68/66/1383546866.db2.gz	LJRXGQJQQORAOT-UHFFFAOYSA-N	0	3	337.467	3.291	20	30		EGEDHN
Cc1cccc(C)c1C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001167248717	1383574661	/nfs/dbraw/zinc/57/46/61/1383574661.db2.gz	CZEOHGJSIMGMCN-UHFFFAOYSA-N	0	3	339.414	3.224	20	30		EGEDHN
CC(C)[C@H](C)C(=O)NCCC1(CNCc2ccc(C#N)cc2F)CC1	ZINC001167366871	1383611815	/nfs/dbraw/zinc/61/18/15/1383611815.db2.gz	UHOBSLOOXGUKSK-HNNXBMFYSA-N	0	3	345.462	3.366	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cccc3oc(C)nc32)CC1	ZINC001168399265	1383896470	/nfs/dbraw/zinc/89/64/70/1383896470.db2.gz	UPFIGLDXBGYMCZ-UHFFFAOYSA-N	0	3	347.846	3.378	20	30		EGEDHN
N#Cc1ccc(N2CCN([C@@H]3CCc4cc(F)ccc4C3)CC2)cc1	ZINC001168439426	1383907311	/nfs/dbraw/zinc/90/73/11/1383907311.db2.gz	WATAVHVOHJUXGD-OAQYLSRUSA-N	0	3	335.426	3.377	20	30		EGEDHN
CC(C)OCCC(=O)N[C@@H](C)CCCCNCc1ccccc1C#N	ZINC001169266102	1384129610	/nfs/dbraw/zinc/12/96/10/1384129610.db2.gz	CSFCHFDELYQUGK-KRWDZBQOSA-N	0	3	345.487	3.138	20	30		EGEDHN
CCOCCCC(=O)N[C@@H](C)CCCCNCc1ccccc1C#N	ZINC001169331065	1384136952	/nfs/dbraw/zinc/13/69/52/1384136952.db2.gz	CKQUHAJSFGWDNU-KRWDZBQOSA-N	0	3	345.487	3.140	20	30		EGEDHN
C[Si](C)(C)C#Cc1ccc(N2CCCc3ccc(CN)nc32)nc1	ZINC001169583050	1384161598	/nfs/dbraw/zinc/16/15/98/1384161598.db2.gz	BSMUAOWEAJPETB-UHFFFAOYSA-N	0	3	336.515	3.249	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)[C@@H]2C[C@@H]2C2CCCC2)c1	ZINC001169681768	1384172993	/nfs/dbraw/zinc/17/29/93/1384172993.db2.gz	RWCQNYAKYAYVIG-QZTJIDSGSA-N	0	3	343.446	3.120	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@H]1C[C@]1(CC)C(C)C	ZINC001169729661	1384179697	/nfs/dbraw/zinc/17/96/97/1384179697.db2.gz	NRDISXMRQHQUCG-UKRRQHHQSA-N	0	3	331.298	3.063	20	30		EGEDHN
CN(C)/C=N/c1ccc(NC[C@H](CO)Cc2ccccc2)cc1C#N	ZINC001169904219	1384196868	/nfs/dbraw/zinc/19/68/68/1384196868.db2.gz	MRXCKSCLCLCBAX-HAFIMRKLSA-N	0	3	336.439	3.043	20	30		EGEDHN
C[C@@H](C(=O)N[C@@H](C)CCCCNCc1ccccc1C#N)C1CC1	ZINC001170018293	1384219096	/nfs/dbraw/zinc/21/90/96/1384219096.db2.gz	IQVINCHPEPBLTG-JKSUJKDBSA-N	0	3	327.472	3.369	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)C1=CCCC1	ZINC001170160597	1384251754	/nfs/dbraw/zinc/25/17/54/1384251754.db2.gz	DAVIRSOOXAFUFV-MRXNPFEDSA-N	0	3	325.456	3.433	20	30		EGEDHN
CCOC(=O)C1=C(Nc2cc(CC#N)cc3ccccc32)CCNC1	ZINC001170521011	1384334735	/nfs/dbraw/zinc/33/47/35/1384334735.db2.gz	DVHBXWTYTNRFOT-UHFFFAOYSA-N	0	3	335.407	3.128	20	30		EGEDHN
C[C@H](N)c1ncc(-c2ccccc2)n1-c1cnc2ccc(C#N)cc2n1	ZINC001170680492	1384364020	/nfs/dbraw/zinc/36/40/20/1384364020.db2.gz	VHBMEYHHFJEYRF-ZDUSSCGKSA-N	0	3	340.390	3.374	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H](C)CCCCNCc2nc(C)cs2)CCC1	ZINC001171196426	1384466290	/nfs/dbraw/zinc/46/62/90/1384466290.db2.gz	NVBPIRQIYJAYPS-HNNXBMFYSA-N	0	3	347.528	3.410	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)n1nc(C(F)(F)F)c2c1CCNC2	ZINC001171227814	1384474181	/nfs/dbraw/zinc/47/41/81/1384474181.db2.gz	ARDADXJWBYGMCK-LLVKDONJSA-N	0	3	334.345	3.223	20	30		EGEDHN
C[C@@H](Cc1cccc(C#N)c1)N1CC[C@H](N2CCCCC2)[C@@H](F)C1	ZINC001171234666	1384475884	/nfs/dbraw/zinc/47/58/84/1384475884.db2.gz	XPRZAYDYMDJBKF-VDGAXYAQSA-N	0	3	329.463	3.388	20	30		EGEDHN
C[C@@H](C(=O)NCCCNCc1ccc(C#N)cc1F)c1ccccc1	ZINC001171651952	1384592691	/nfs/dbraw/zinc/59/26/91/1384592691.db2.gz	VWWKPCHUVIZVBD-OAHLLOKOSA-N	0	3	339.414	3.097	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1cnc(C)s1	ZINC001316874814	1384659767	/nfs/dbraw/zinc/65/97/67/1384659767.db2.gz	UJSOYQFVUQAOFY-DGCLKSJQSA-N	0	3	327.881	3.177	20	30		EGEDHN
CC[C@@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C#N)C1)c1ccccn1	ZINC001172972542	1384893271	/nfs/dbraw/zinc/89/32/71/1384893271.db2.gz	BAVJIZAJVFMFMB-OWCLPIDISA-N	0	3	344.459	3.414	20	30		EGEDHN
C[C@@H](CNC(=O)c1sccc1C1CC1)NCc1ccc(C#N)s1	ZINC001317283141	1385054865	/nfs/dbraw/zinc/05/48/65/1385054865.db2.gz	IHMWKUFNDUDBKL-NSHDSACASA-N	0	3	345.493	3.467	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)C1=CCCCCC1	ZINC001317390006	1385110430	/nfs/dbraw/zinc/11/04/30/1385110430.db2.gz	NAZGJUUFGRTFRF-CYBMUJFWSA-N	0	3	329.282	3.270	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H](C)CCCCNCc2cnc(C)o2)cc1	ZINC001174641346	1385129090	/nfs/dbraw/zinc/12/90/90/1385129090.db2.gz	APFXRQUEMDDWFB-OAHLLOKOSA-N	0	3	339.439	3.043	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@H](C)CCCCNCc1nnc(C(C)C)[nH]1	ZINC001174848636	1385159233	/nfs/dbraw/zinc/15/92/33/1385159233.db2.gz	FJBNJOBGIANULE-HZPDHXFCSA-N	0	3	349.523	3.295	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)C1CCC(C2CC2)CC1	ZINC001174957783	1385174499	/nfs/dbraw/zinc/17/44/99/1385174499.db2.gz	MPYAUUYJZYGZSJ-UHFFFAOYSA-N	0	3	343.309	3.207	20	30		EGEDHN
C=CCCCC(=O)N[C@@H](C)CCCCNCc1csnc1OC	ZINC001174979423	1385178019	/nfs/dbraw/zinc/17/80/19/1385178019.db2.gz	ZPDMBCHGVCQWPY-AWEZNQCLSA-N	0	3	339.505	3.273	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](C)CCCCNCc2cnc(C)o2)CC1	ZINC001175074124	1385190234	/nfs/dbraw/zinc/19/02/34/1385190234.db2.gz	NVDIZFBXPURCHS-OAHLLOKOSA-N	0	3	333.476	3.494	20	30		EGEDHN
CCCN(CCNC(=O)Cc1ccccc1C)Cc1cccc(C#N)c1	ZINC001317545300	1385291510	/nfs/dbraw/zinc/29/15/10/1385291510.db2.gz	FGPBNLZRCJMEMM-UHFFFAOYSA-N	0	3	349.478	3.438	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCN(C/C=C\c1ccc(Cl)cc1)C1CC1	ZINC001317549372	1385304170	/nfs/dbraw/zinc/30/41/70/1385304170.db2.gz	RXMLJMCCEQOARV-SFAKSCPVSA-N	0	3	331.847	3.093	20	30		EGEDHN
CCN1CCN(c2ccc(Nc3ccc(OC)c(C#N)c3)cc2)CC1	ZINC001175780741	1385402898	/nfs/dbraw/zinc/40/28/98/1385402898.db2.gz	LWYIBDLTTFQQCE-UHFFFAOYSA-N	0	3	336.439	3.452	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@@H](CCNC(=O)C2CCCCC2)C1	ZINC001317773658	1385466087	/nfs/dbraw/zinc/46/60/87/1385466087.db2.gz	SWTFDGYBZMRDBW-QGZVFWFLSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=CC[C@H](C(=O)NCCCNCc1ccc(F)cn1)c1ccccc1	ZINC001176698628	1385663364	/nfs/dbraw/zinc/66/33/64/1385663364.db2.gz	UTRQTVROLNOZIB-IBGZPJMESA-N	0	3	341.430	3.177	20	30		EGEDHN
C=CC[C@@H](C(=O)NCCCNCc1oc(C)nc1C)c1ccccc1	ZINC001176698712	1385663371	/nfs/dbraw/zinc/66/33/71/1385663371.db2.gz	WUFVMMOAOWSJFU-GOSISDBHSA-N	0	3	341.455	3.247	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)C(=O)NCCCNCc1conc1C	ZINC001176744630	1385679501	/nfs/dbraw/zinc/67/95/01/1385679501.db2.gz	JSLICNXMBWGDCX-GOSISDBHSA-N	0	3	341.455	3.014	20	30		EGEDHN
C=C[C@@H](C(=O)NCCCNCc1ccccc1C#N)c1ccccc1	ZINC001176777513	1385692314	/nfs/dbraw/zinc/69/23/14/1385692314.db2.gz	CCDICXUFSNFNTC-HXUWFJFHSA-N	0	3	333.435	3.124	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)CCc1ncc(-c2ccccc2)o1	ZINC001177032677	1385780471	/nfs/dbraw/zinc/78/04/71/1385780471.db2.gz	UPYFEGUFWWHHIZ-KRWDZBQOSA-N	0	3	339.439	3.041	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)C1CCOCC1	ZINC001177192110	1385853323	/nfs/dbraw/zinc/85/33/23/1385853323.db2.gz	WQOQOYGDXRHFHF-UHFFFAOYSA-N	0	3	342.911	3.164	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)C[C@@H]1CCOC1	ZINC001177271169	1385891924	/nfs/dbraw/zinc/89/19/24/1385891924.db2.gz	XSPBNOBLGIMDJC-KRWDZBQOSA-N	0	3	342.911	3.164	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)C[C@@H]1CCCC[C@@H]1C	ZINC001177310469	1385908118	/nfs/dbraw/zinc/90/81/18/1385908118.db2.gz	XDNLUMGEZWBMQY-JSGCOSHPSA-N	0	3	331.298	3.207	20	30		EGEDHN
Cc1nocc1CNCCCN(CC1CCCC1)C(=O)C#CC(C)C	ZINC001177311633	1385908865	/nfs/dbraw/zinc/90/88/65/1385908865.db2.gz	IFFVHULKCGQWMY-UHFFFAOYSA-N	0	3	345.487	3.141	20	30		EGEDHN
CC[C@H](CNC(=O)c1ccc(C)cc1F)NCc1ccc(C#N)s1	ZINC001698622294	1406261334	/nfs/dbraw/zinc/26/13/34/1406261334.db2.gz	OBJFWMQYQGXYBZ-CYBMUJFWSA-N	0	3	345.443	3.366	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2oc(C(C)C)nc2C)CCCC1	ZINC001319379225	1386093031	/nfs/dbraw/zinc/09/30/31/1386093031.db2.gz	NJPCPYPYPXIPFA-UHFFFAOYSA-N	0	3	339.867	3.491	20	30		EGEDHN
N#Cc1ccc(C(=O)NCCCCCCNC/C(Cl)=C\Cl)[nH]1	ZINC001178227884	1386165523	/nfs/dbraw/zinc/16/55/23/1386165523.db2.gz	NRMVUFXDHMLDET-FMIVXFBMSA-N	0	3	343.258	3.085	20	30		EGEDHN
C#CCCCC(=O)NCCCCCCNCc1ccn(C(C)C)n1	ZINC001178335075	1386191281	/nfs/dbraw/zinc/19/12/81/1386191281.db2.gz	OUHMVBKZCKMLIN-UHFFFAOYSA-N	0	3	332.492	3.034	20	30		EGEDHN
Cc1nc(CNCCCCCCNC(=O)C#CC(C)C)c(C)s1	ZINC001178426773	1386213738	/nfs/dbraw/zinc/21/37/38/1386213738.db2.gz	JMEPTTXVYNUZHD-UHFFFAOYSA-N	0	3	335.517	3.186	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@H](NCC#Cc3ccccc3)[C@@H]2C)oc1C	ZINC001178477734	1386228933	/nfs/dbraw/zinc/22/89/33/1386228933.db2.gz	NACYCUPUZUQXKT-LPHOPBHVSA-N	0	3	336.435	3.141	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCCCCCNCc1cn(C(C)C)nn1	ZINC001178579619	1386254856	/nfs/dbraw/zinc/25/48/56/1386254856.db2.gz	BUCXEXSXNWUBTI-UHFFFAOYSA-N	0	3	349.523	3.228	20	30		EGEDHN
CCCC[C@H](C)C(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C	ZINC001178605171	1386260969	/nfs/dbraw/zinc/26/09/69/1386260969.db2.gz	HMULLVHVAVADSV-BJLQDIEVSA-N	0	3	326.484	3.443	20	30		EGEDHN
C#CCC1(C(=O)NCCCCCCNCc2nccs2)CCC1	ZINC001178672422	1386273559	/nfs/dbraw/zinc/27/35/59/1386273559.db2.gz	HSIFFQPEDAQFAJ-UHFFFAOYSA-N	0	3	333.501	3.103	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](NCc2ccc(C#N)s2)[C@@H]1C	ZINC001178773258	1386299732	/nfs/dbraw/zinc/29/97/32/1386299732.db2.gz	DPGZYPTYONHIOC-KSSFIOAISA-N	0	3	343.496	3.467	20	30		EGEDHN
CC[C@H](F)C(=O)N1CC[C@H](NCC#Cc2ccc(Cl)cc2)[C@@H]1C	ZINC001179314649	1386448673	/nfs/dbraw/zinc/44/86/73/1386448673.db2.gz	YSIJEZKDCXYRJC-JQFCIGGWSA-N	0	3	336.838	3.019	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCCCCCCNCc1nccn1CC	ZINC001179334965	1386453566	/nfs/dbraw/zinc/45/35/66/1386453566.db2.gz	CTIBTAQFCPVGKU-QGZVFWFLSA-N	0	3	334.508	3.272	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCCCCCCNCc1nnc(C(C)C)[nH]1	ZINC001179335242	1386453666	/nfs/dbraw/zinc/45/36/66/1386453666.db2.gz	HZRCQCQCKCIENF-INIZCTEOSA-N	0	3	349.523	3.297	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@H](NCc2cnn(C(C)(C)C)c2)[C@@H]1C	ZINC001179388701	1386471566	/nfs/dbraw/zinc/47/15/66/1386471566.db2.gz	OBUIURXZIUHXNF-JZXOWHBKSA-N	0	3	346.519	3.319	20	30		EGEDHN
C=CCCCC(=O)NCCCCCCNCc1nccn1C(F)F	ZINC001179421625	1386479718	/nfs/dbraw/zinc/47/97/18/1386479718.db2.gz	MBVWJFLRAZAMGB-UHFFFAOYSA-N	0	3	342.434	3.401	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](NCc2cc(C#N)ccc2OC)[C@@H]1C	ZINC001179452752	1386485730	/nfs/dbraw/zinc/48/57/30/1386485730.db2.gz	YYSGOIXSVITZBY-YJBOKZPZSA-N	0	3	341.455	3.002	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](NCc2cc(F)ccc2OC)[C@@H]1C	ZINC001179463129	1386487919	/nfs/dbraw/zinc/48/79/19/1386487919.db2.gz	BXWHHWZMCYQWHN-YOEHRIQHSA-N	0	3	334.435	3.270	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CC[C@H](NCC#Cc2cccc(Cl)c2)[C@@H]1C	ZINC001179565292	1386516158	/nfs/dbraw/zinc/51/61/58/1386516158.db2.gz	AQZXXBTWOHIKMM-WLWJZTKJSA-N	0	3	344.886	3.317	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CC[C@H](NCC#Cc2ccccc2Cl)[C@@H]1C	ZINC001179565802	1386516574	/nfs/dbraw/zinc/51/65/74/1386516574.db2.gz	OQLBROWPIZLSHR-MGTHKWJCSA-N	0	3	344.886	3.317	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)C1CCC=CCC1	ZINC001180142906	1386711544	/nfs/dbraw/zinc/71/15/44/1386711544.db2.gz	HAINJWLLTBWLKD-RXVVDRJESA-N	0	3	336.479	3.364	20	30		EGEDHN
CS[C@@H]1CC[C@H](N(C)[C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)C1	ZINC001321021879	1386785356	/nfs/dbraw/zinc/78/53/56/1386785356.db2.gz	MXVDGFGZNAIETM-RCCFBDPRSA-N	0	3	343.496	3.270	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccco2)C[C@@]1(C)CNCc1ccccc1C#N	ZINC001180415336	1386790744	/nfs/dbraw/zinc/79/07/44/1386790744.db2.gz	ALRHPFJPWBFYOC-FOIQADDNSA-N	0	3	337.423	3.039	20	30		EGEDHN
CC[C@@H](C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2cc(F)ccc2C#N)C1	ZINC001180631851	1386853422	/nfs/dbraw/zinc/85/34/22/1386853422.db2.gz	FAWYRSJMMKBGNJ-STXHMFSFSA-N	0	3	345.462	3.318	20	30		EGEDHN
CN(CCN(C)C(=O)CC1(C#N)CCCCC1)Cc1ccccc1	ZINC001181353438	1386980444	/nfs/dbraw/zinc/98/04/44/1386980444.db2.gz	CLQVBVPESKCWMC-UHFFFAOYSA-N	0	3	327.472	3.441	20	30		EGEDHN
Cc1nc(CNC[C@]2(C)CN(C(=O)C#CC(C)(C)C)C[C@H]2C)cs1	ZINC001181426151	1386992071	/nfs/dbraw/zinc/99/20/71/1386992071.db2.gz	NLUSWFCBRFLGMJ-AUUYWEPGSA-N	0	3	347.528	3.075	20	30		EGEDHN
C#CCCCCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2nccs2)C1	ZINC001182208534	1387120673	/nfs/dbraw/zinc/12/06/73/1387120673.db2.gz	VRLOLXJCTJIDFE-VQIMIIECSA-N	0	3	347.528	3.301	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](C)[C@](C)(CNCc3nccs3)C2)C1	ZINC001182572455	1387189120	/nfs/dbraw/zinc/18/91/20/1387189120.db2.gz	DYYVZXFEIHRVFN-RDTXWAMCSA-N	0	3	333.501	3.074	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCc1ccc(CNCc2ccc(F)c(F)c2)cc1	ZINC001698718707	1406363192	/nfs/dbraw/zinc/36/31/92/1406363192.db2.gz	VODNNJBNWUYZQV-ZDUSSCGKSA-N	0	3	343.377	3.030	20	30		EGEDHN
C=C(Cl)CNC[C@@H](C1CC1)N(C)C(=O)c1c(C)cc(C)nc1C	ZINC001331300449	1389691766	/nfs/dbraw/zinc/69/17/66/1389691766.db2.gz	ACTKELYQPQYWST-INIZCTEOSA-N	0	3	335.879	3.200	20	30		EGEDHN
C#CC[C@@H](CCOC)NCc1nc2cc(C(F)(F)F)ccc2n1C	ZINC001331676718	1389853322	/nfs/dbraw/zinc/85/33/22/1389853322.db2.gz	QZNSODYRBLCGQS-ZDUSSCGKSA-N	0	3	339.361	3.110	20	30		EGEDHN
C=CCn1c([C@H](C)OC(C)(C)C)nnc1N1CCN([C@H](C)CC)CC1	ZINC001339775577	1390139676	/nfs/dbraw/zinc/13/96/76/1390139676.db2.gz	WMBVYYXXZOXDJH-CVEARBPZSA-N	0	3	349.523	3.261	20	30		EGEDHN
N#CC[C@@H](O)CN[C@@H](CC1CC1)c1cc(F)cc(Br)c1	ZINC001332937908	1390219948	/nfs/dbraw/zinc/21/99/48/1390219948.db2.gz	PQQFQXGODWVXOM-CABCVRRESA-N	0	3	341.224	3.294	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N1CC2(CC2)c2ccccc21	ZINC001340332331	1390272454	/nfs/dbraw/zinc/27/24/54/1390272454.db2.gz	XIYAMEXVQJISOU-INIZCTEOSA-N	0	3	349.482	3.457	20	30		EGEDHN
C[C@]1(Cc2ccc(F)cc2)CCCN1C(=O)[C@@H](N)CCCCC#N	ZINC001333276614	1390275065	/nfs/dbraw/zinc/27/50/65/1390275065.db2.gz	KZXIDMYIEQGECY-PKOBYXMFSA-N	0	3	331.435	3.161	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccc(Oc2ccc(C)nn2)cc1	ZINC001340726029	1390354352	/nfs/dbraw/zinc/35/43/52/1390354352.db2.gz	JSYSMIBZSVYKIO-MRXNPFEDSA-N	0	3	326.400	3.199	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)NCCc1ccc(-c2csc(C)n2)cc1	ZINC001341510673	1390496276	/nfs/dbraw/zinc/49/62/76/1390496276.db2.gz	NTPNLVOMCRHPDR-QGZVFWFLSA-N	0	3	343.496	3.461	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1cccc(OCc2ccccn2)c1	ZINC001341644538	1390513423	/nfs/dbraw/zinc/51/34/23/1390513423.db2.gz	HMIHYUWPKCDOGB-GOSISDBHSA-N	0	3	325.412	3.283	20	30		EGEDHN
CC(C)[C@@H]1C[C@H](C(=O)C(C#N)C(=O)Nc2ccccc2Cl)CCO1	ZINC001341948486	1390553238	/nfs/dbraw/zinc/55/32/38/1390553238.db2.gz	VENMFYYCVAJYBW-IOASZLSFSA-N	0	3	348.830	3.439	20	30		EGEDHN
C[C@H](C(=O)C(C#N)C(=O)NC1CCCCC1)c1ccc(F)c(F)c1	ZINC001342580683	1390628747	/nfs/dbraw/zinc/62/87/47/1390628747.db2.gz	UAEITAWLPJYDAB-SMDDNHRTSA-N	0	3	334.366	3.226	20	30		EGEDHN
CC(C)CN(Cc1ccc(C#N)cc1)C(=O)NC[C@@H]1CCCCN1C	ZINC001342985982	1390680755	/nfs/dbraw/zinc/68/07/55/1390680755.db2.gz	ALFPNOWZCJHIDH-IBGZPJMESA-N	0	3	342.487	3.210	20	30		EGEDHN
CCOc1ccc(C(=O)C(C#N)c2nc(N)c3ccccc3n2)cc1	ZINC001343271098	1390703803	/nfs/dbraw/zinc/70/38/03/1390703803.db2.gz	AZBXORUVIFPXRT-HNNXBMFYSA-N	0	3	332.363	3.101	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)[C@H](C)OC2CCCCC2)cc1	ZINC001343337130	1390707874	/nfs/dbraw/zinc/70/78/74/1390707874.db2.gz	WZELENZNVLMSSJ-SUMWQHHRSA-N	0	3	344.411	3.080	20	30		EGEDHN
C[C@H](NC(=O)C(C#N)C(=O)[C@@H]1C[C@@H]1F)c1ccc(Cl)cc1Cl	ZINC001343442782	1390714292	/nfs/dbraw/zinc/71/42/92/1390714292.db2.gz	SFRIIIDTAKOHDV-ODDDBGHMSA-N	0	3	343.185	3.237	20	30		EGEDHN
C=C(C)Cn1c([C@@H]2C[C@H]2C)nnc1N1CCN(C2CCCC2)CC1	ZINC001343639495	1390728075	/nfs/dbraw/zinc/72/80/75/1390728075.db2.gz	RQBXWECVKQHWAK-NVXWUHKLSA-N	0	3	329.492	3.042	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)NCc1cccnc1Oc1cccc(F)c1	ZINC001353469060	1392017721	/nfs/dbraw/zinc/01/77/21/1392017721.db2.gz	MDIHVBMGOVEPBR-KRWDZBQOSA-N	0	3	343.402	3.313	20	30		EGEDHN
C=C(Br)CN[C@H](C)[C@H]1CCCCN1C(=O)C1=CCCC1	ZINC001479819431	1392410623	/nfs/dbraw/zinc/41/06/23/1392410623.db2.gz	BKAMSELSKIVITF-UKRRQHHQSA-N	0	3	341.293	3.365	20	30		EGEDHN
CCCN(C(=O)[C@H](C)C#N)C1CCN(Cc2sc(C)nc2C)CC1	ZINC001479991754	1392523293	/nfs/dbraw/zinc/52/32/93/1392523293.db2.gz	PQFAMPKLKYICMX-CYBMUJFWSA-N	0	3	348.516	3.123	20	30		EGEDHN
Cc1cccc(C(=O)NCC[C@@H](C)NCc2ccccc2C#N)c1C	ZINC001480811069	1392949263	/nfs/dbraw/zinc/94/92/63/1392949263.db2.gz	YDLUPBMXJCQVMQ-MRXNPFEDSA-N	0	3	335.451	3.473	20	30		EGEDHN
CCCN(C(=O)[C@@H](C)C#N)C1CCN(CCc2ccccc2F)CC1	ZINC001490612306	1394282263	/nfs/dbraw/zinc/28/22/63/1394282263.db2.gz	FANLANCCNIEUEA-INIZCTEOSA-N	0	3	345.462	3.231	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](CCNC(=O)C3(F)CCCC3)C2)s1	ZINC001481437656	1394291834	/nfs/dbraw/zinc/29/18/34/1394291834.db2.gz	WZYXZZNMVLXOEV-AWEZNQCLSA-N	0	3	349.475	3.230	20	30		EGEDHN
CC[C@H](CNC(=O)c1cc(C#N)c[nH]1)N[C@@H](C)c1ccc(F)cc1F	ZINC001481801738	1394536130	/nfs/dbraw/zinc/53/61/30/1394536130.db2.gz	WNBXYEYHRIVZTE-SMDDNHRTSA-N	0	3	346.381	3.024	20	30		EGEDHN
CC[C@H](C)C(=O)NC1(CNCc2ccc(C#N)cc2F)CCCC1	ZINC001481889273	1394580725	/nfs/dbraw/zinc/58/07/25/1394580725.db2.gz	HHYWCKXEGFOXDH-AWEZNQCLSA-N	0	3	331.435	3.262	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)Cc2ccc(OC)cc2)CCCC1	ZINC001482236631	1394832689	/nfs/dbraw/zinc/83/26/89/1394832689.db2.gz	MXEBKAJHSNLGCF-UHFFFAOYSA-N	0	3	336.863	3.009	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)CCc1ccc(F)cc1F)C(C)C	ZINC001482562678	1395090368	/nfs/dbraw/zinc/09/03/68/1395090368.db2.gz	APPMAIYEJLMFQJ-INIZCTEOSA-N	0	3	344.833	3.380	20	30		EGEDHN
CC(C)CCC(=O)N1CCC[C@H]1CNCc1ccc(C#N)cc1F	ZINC001483920165	1395145421	/nfs/dbraw/zinc/14/54/21/1395145421.db2.gz	NZSXYVSRQVRSNY-KRWDZBQOSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)c1ccc(CNC(=O)[C@H](CC)N(C)C)cc1	ZINC001484560462	1395443369	/nfs/dbraw/zinc/44/33/69/1395443369.db2.gz	FHXSWLFNSJJHLL-YOEHRIQHSA-N	0	3	337.895	3.046	20	30		EGEDHN
CC(C)CCC(=O)N1CC[C@H](NCc2ccccc2C#N)[C@@H](C)C1	ZINC001496329505	1396652243	/nfs/dbraw/zinc/65/22/43/1396652243.db2.gz	JBHCNWMQYDGNNA-LPHOPBHVSA-N	0	3	327.472	3.321	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H](C)CCc2ccccc2F)C1	ZINC001690289267	1404449916	/nfs/dbraw/zinc/44/99/16/1404449916.db2.gz	AETYTJQUTURIJR-RCBQFDQVSA-N	0	3	338.854	3.384	20	30		EGEDHN
C[C@@H](CNC(=O)C12CCC(CC1)CC2)NCc1ccc(F)c(C#N)c1	ZINC001690650994	1404682919	/nfs/dbraw/zinc/68/29/19/1404682919.db2.gz	WCECVVJETYVMCP-BQTBQCLESA-N	0	3	343.446	3.262	20	30		EGEDHN
C[C@@H](CCNC(=O)C(C)(C)C1CCC1)NCc1ccccc1C#N	ZINC001690856341	1404779462	/nfs/dbraw/zinc/77/94/62/1404779462.db2.gz	KFMNAMZWLBXICP-HNNXBMFYSA-N	0	3	327.472	3.369	20	30		EGEDHN
CC[C@H](C)CC(=O)NC[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001691093226	1405029243	/nfs/dbraw/zinc/02/92/43/1405029243.db2.gz	KTVMTCOSPTVEJV-JLJPHGGASA-N	0	3	331.435	3.118	20	30		EGEDHN
COc1ccc(Cl)c(CNCC2(NC(=O)[C@@H](C)C#N)CCCC2)c1	ZINC001732227553	1428475558	/nfs/dbraw/zinc/47/55/58/1428475558.db2.gz	XBPIGWUUDNVHLL-ZDUSSCGKSA-N	0	3	349.862	3.027	20	30		EGEDHN
C=C(Br)CNCC1(NC(=O)CC2CCC2)CCCC1	ZINC001732227901	1428475617	/nfs/dbraw/zinc/47/56/17/1428475617.db2.gz	SUWRNGDVHWRZPI-UHFFFAOYSA-N	0	3	329.282	3.104	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)CC2(OC)CCC2)CCCC[C@H]1C	ZINC001732255845	1428496613	/nfs/dbraw/zinc/49/66/13/1428496613.db2.gz	BKHHEENQBFMLSI-RDTXWAMCSA-N	0	3	342.911	3.353	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCc1ccc(CNCc2cccc(Cl)c2)cc1	ZINC001732315895	1428527389	/nfs/dbraw/zinc/52/73/89/1428527389.db2.gz	WEABFFHHMHBNAC-AWEZNQCLSA-N	0	3	341.842	3.406	20	30		EGEDHN
C=C(Br)CN[C@@H](CNC(=O)C1(CCC)CC1)C(C)C	ZINC001732567051	1428760417	/nfs/dbraw/zinc/76/04/17/1428760417.db2.gz	OXZULOBQHMJZMC-ZDUSSCGKSA-N	0	3	331.298	3.206	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cc(F)cc2cccnc21)C(C)C	ZINC001732568898	1428762896	/nfs/dbraw/zinc/76/28/96/1428762896.db2.gz	SRHVPFCXUHGAHA-MRXNPFEDSA-N	0	3	349.837	3.470	20	30		EGEDHN
Cc1ccccc1CCC(=O)NC[C@H](C)N(C)Cc1ccc(C#N)cc1	ZINC001700476923	1414105350	/nfs/dbraw/zinc/10/53/50/1414105350.db2.gz	NBZOWQAHRJBLBT-SFHVURJKSA-N	0	3	349.478	3.436	20	30		EGEDHN
Cc1cscc1C(=O)N(C)C[C@@H](C)NCc1ccc(F)c(C#N)c1	ZINC001700748704	1414418042	/nfs/dbraw/zinc/41/80/42/1414418042.db2.gz	YWMKOQXNUTYSRO-CYBMUJFWSA-N	0	3	345.443	3.318	20	30		EGEDHN
Cc1c(F)cccc1C(=O)N(C)C[C@H](C)NCc1ccc(C#N)s1	ZINC001700751751	1414421891	/nfs/dbraw/zinc/42/18/91/1414421891.db2.gz	JKBHGAORBIJTJR-LBPRGKRZSA-N	0	3	345.443	3.318	20	30		EGEDHN
CCc1ccccc1C(=O)N(C)C[C@@H](C)NCc1ccc(C#N)s1	ZINC001700763897	1414437418	/nfs/dbraw/zinc/43/74/18/1414437418.db2.gz	KZMOOFXDDYXUQG-CQSZACIVSA-N	0	3	341.480	3.432	20	30		EGEDHN
CCC(C)(C)C(=O)NC[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001707071226	1417183228	/nfs/dbraw/zinc/18/32/28/1417183228.db2.gz	ZBHMMPJCGDJNRJ-FZNQNYSPSA-N	0	3	331.435	3.118	20	30		EGEDHN
CC(C)(C)C(=O)NCC[C@@H]1CCN(Cc2ccc(F)c(C#N)c2)C1	ZINC001713738529	1418535854	/nfs/dbraw/zinc/53/58/54/1418535854.db2.gz	VKXNLDKKZPLLBU-CQSZACIVSA-N	0	3	331.435	3.072	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2CCCN(CCC[C@H](C)O)C2)CCCCC1	ZINC001713804831	1418617702	/nfs/dbraw/zinc/61/77/02/1418617702.db2.gz	AWEYBETWMKVOMK-ROUUACIJSA-N	0	3	336.520	3.255	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2ocnc2C)CCCC[C@@H]1C	ZINC001714179723	1418988156	/nfs/dbraw/zinc/98/81/56/1418988156.db2.gz	FUERZZUCOZZKJS-MEDUHNTESA-N	0	3	325.840	3.004	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2cc(F)c[nH]2)CCCC[C@@H]1C	ZINC001714189025	1418995874	/nfs/dbraw/zinc/99/58/74/1418995874.db2.gz	POQRFNLBEBWXOO-MEDUHNTESA-N	0	3	327.831	3.175	20	30		EGEDHN
N#Cc1ccc(F)c(CNC2(CNC(=O)C3CCC3)CCCC2)c1	ZINC001714483762	1419207010	/nfs/dbraw/zinc/20/70/10/1419207010.db2.gz	SIACECKBQIAUHH-UHFFFAOYSA-N	0	3	329.419	3.016	20	30		EGEDHN
Cc1cccc(C)c1C(=O)NCC[C@@H](C)NCc1ccccc1C#N	ZINC001714491640	1419215158	/nfs/dbraw/zinc/21/51/58/1419215158.db2.gz	KAFMKPDCGKXPCL-QGZVFWFLSA-N	0	3	335.451	3.473	20	30		EGEDHN
C[C@@H](CCNC(=O)C1(F)CCCCC1)NCc1ccccc1C#N	ZINC001714494525	1419218574	/nfs/dbraw/zinc/21/85/74/1419218574.db2.gz	FTFGRKLYWIKLDP-HNNXBMFYSA-N	0	3	331.435	3.215	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)Cc2nc(C)sc2C)CCCC1	ZINC001714496688	1419221053	/nfs/dbraw/zinc/22/10/53/1419221053.db2.gz	XJWIESGUYKAABS-UHFFFAOYSA-N	0	3	341.908	3.074	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)COc2ccccc2C)CCCC1	ZINC001714510371	1419237974	/nfs/dbraw/zinc/23/79/74/1419237974.db2.gz	JRSASLMOBBVTAR-UHFFFAOYSA-N	0	3	336.863	3.145	20	30		EGEDHN
CCN(CCNC(=O)c1oc(C)cc1C)Cc1ccc(C#N)cc1	ZINC001714580446	1419319278	/nfs/dbraw/zinc/31/92/78/1419319278.db2.gz	GZVNPPTUZQVHGS-UHFFFAOYSA-N	0	3	325.412	3.020	20	30		EGEDHN
CCN(CCNC(=O)Cc1cc(C)cc(C)c1)Cc1ccc(C#N)cc1	ZINC001714589638	1419336226	/nfs/dbraw/zinc/33/62/26/1419336226.db2.gz	ODXGSZCUMMGFIG-UHFFFAOYSA-N	0	3	349.478	3.356	20	30		EGEDHN
CC1(C)CC(C(=O)NCC[C@H]2CCN(Cc3ccccc3C#N)C2)C1	ZINC001714871002	1419600605	/nfs/dbraw/zinc/60/06/05/1419600605.db2.gz	HYFDZKSQPDTKJB-INIZCTEOSA-N	0	3	339.483	3.323	20	30		EGEDHN
CCC(C)(C)C(=O)NCC[C@H]1CCN(Cc2ccccc2C#N)C1	ZINC001714873618	1419607108	/nfs/dbraw/zinc/60/71/08/1419607108.db2.gz	BRKBMPMWAOUSNX-INIZCTEOSA-N	0	3	327.472	3.323	20	30		EGEDHN
CC1(CC(=O)NCC[C@@H]2CCN(Cc3ccc(C#N)s3)C2)CC1	ZINC001714876072	1419610063	/nfs/dbraw/zinc/61/00/63/1419610063.db2.gz	UAFFHEUCKWMKTR-CQSZACIVSA-N	0	3	331.485	3.138	20	30		EGEDHN
CC1(CC(=O)NCC[C@H]2CCN(Cc3ccc(C#N)s3)C2)CC1	ZINC001714876071	1419610174	/nfs/dbraw/zinc/61/01/74/1419610174.db2.gz	UAFFHEUCKWMKTR-AWEZNQCLSA-N	0	3	331.485	3.138	20	30		EGEDHN
N#Cc1ccc(CNCC2(NC(=O)C3CCC3)CCCC2)c(F)c1	ZINC001715083447	1419820424	/nfs/dbraw/zinc/82/04/24/1419820424.db2.gz	KLQGJUALAIRBAJ-UHFFFAOYSA-N	0	3	329.419	3.016	20	30		EGEDHN
CC(C)CC(=O)N[C@](C)(CNCc1cc(C#N)ccc1F)C1CC1	ZINC001715101728	1419842262	/nfs/dbraw/zinc/84/22/62/1419842262.db2.gz	AUKGZJGIWFKASN-LJQANCHMSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2oc(C)nc2C)CCCC[C@@H]1C	ZINC001715126638	1419872937	/nfs/dbraw/zinc/87/29/37/1419872937.db2.gz	CHLNFRPLWDMDTG-GTNSWQLSSA-N	0	3	339.867	3.312	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2csc(Cl)n2)CCCC1	ZINC001715313054	1420022078	/nfs/dbraw/zinc/02/20/78/1420022078.db2.gz	YKKOEWUAYNYTJM-UHFFFAOYSA-N	0	3	334.272	3.181	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)C(C)(C)CC)CCCC1	ZINC001715305503	1420014046	/nfs/dbraw/zinc/01/40/46/1420014046.db2.gz	YOJBCXNTFKDYNS-UHFFFAOYSA-N	0	3	331.298	3.350	20	30		EGEDHN
C=C(Br)CN[C@H](CNC(=O)c1ccccc1C)C(C)C	ZINC001715484785	1420165464	/nfs/dbraw/zinc/16/54/64/1420165464.db2.gz	BWTVESGOCBTABV-OAHLLOKOSA-N	0	3	339.277	3.248	20	30		EGEDHN
CC1(CC(=O)N[C@@H]2CCC[C@@H]2CNCc2ccccc2C#N)CC1	ZINC001715566848	1420256458	/nfs/dbraw/zinc/25/64/58/1420256458.db2.gz	KLODQOLRPJDWSX-QZTJIDSGSA-N	0	3	325.456	3.123	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)CC1CCCCC1	ZINC001716013840	1420467219	/nfs/dbraw/zinc/46/72/19/1420467219.db2.gz	JEPAJUXQFINCKX-INIZCTEOSA-N	0	3	327.472	3.465	20	30		EGEDHN
C[C@@H](NCC(C)(C)CN(C)C(=O)[C@@H](C)C#N)c1c(F)cccc1F	ZINC001717450984	1421380806	/nfs/dbraw/zinc/38/08/06/1421380806.db2.gz	FTXOGRZIKDNZPH-QWHCGFSZSA-N	0	3	337.414	3.260	20	30		EGEDHN
CN(C(=O)CCC1(C)CC1)C1CC(NCc2cc(C#N)ccc2F)C1	ZINC001717999040	1421766646	/nfs/dbraw/zinc/76/66/46/1421766646.db2.gz	UXXMUXIYBSYHST-UHFFFAOYSA-N	0	3	343.446	3.357	20	30		EGEDHN
CC1(C)CC(C(=O)N2CC[C@](C)(CNCc3ccccc3C#N)C2)C1	ZINC001733424925	1429632811	/nfs/dbraw/zinc/63/28/11/1429632811.db2.gz	ZAWDSZAEANGIJS-OAQYLSRUSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1snnc1C(C)C	ZINC001725148980	1425632696	/nfs/dbraw/zinc/63/26/96/1425632696.db2.gz	ZPJQJQLMZMHUDE-UHFFFAOYSA-N	0	3	344.912	3.102	20	30		EGEDHN
CN(C(=O)CC(C)(C)C)[C@@H](CNCc1cc(C#N)ccc1F)C1CC1	ZINC001725447539	1426111864	/nfs/dbraw/zinc/11/18/64/1426111864.db2.gz	AGLWJTCHZKPXTL-SFHVURJKSA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@@H]1[C@@H](NCc2ccc(C#N)s2)CCN1C(=O)CCC(C)(F)F	ZINC001725567827	1426228636	/nfs/dbraw/zinc/22/86/36/1426228636.db2.gz	UQFLDZOJDAKYHB-RISCZKNCSA-N	0	3	341.427	3.134	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN(CC/C=C\CCC)C2)cn1	ZINC001731354999	1427295392	/nfs/dbraw/zinc/29/53/92/1427295392.db2.gz	UXXKUOYJMZWQLZ-LIXSYLKWSA-N	0	3	325.456	3.004	20	30		EGEDHN
CC(C)CCC(=O)NC[C@@H](NCc1ccc(C#N)cc1F)C1CC1	ZINC001731397810	1427354998	/nfs/dbraw/zinc/35/49/98/1427354998.db2.gz	YAUVDLYIADYCGU-GOSISDBHSA-N	0	3	331.435	3.118	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@H](CNC(=O)CC3CCCC3)C2)c1	ZINC001731495528	1427470735	/nfs/dbraw/zinc/47/07/35/1427470735.db2.gz	VMABXMCDQICCIJ-HXUWFJFHSA-N	0	3	339.483	3.467	20	30		EGEDHN
C[C@@H](CNC(=O)[C@@H]1CC[C@@H](C)CC1)NCc1ccc(F)c(C#N)c1	ZINC001731632133	1427685827	/nfs/dbraw/zinc/68/58/27/1427685827.db2.gz	ZTCKOTFNZBWCNG-DZKIICNBSA-N	0	3	331.435	3.118	20	30		EGEDHN
CC(C)CCC(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001731706873	1427759937	/nfs/dbraw/zinc/75/99/37/1427759937.db2.gz	AHNUCAYFMXCGRI-LJQANCHMSA-N	0	3	327.472	3.417	20	30		EGEDHN
CCN(CCNC(=O)CCc1cccs1)Cc1cccc(C#N)c1	ZINC001731815321	1428009161	/nfs/dbraw/zinc/00/91/61/1428009161.db2.gz	LCLPTMXVAZUFMW-UHFFFAOYSA-N	0	3	341.480	3.191	20	30		EGEDHN
CN(CCCN(C)C(=O)[C@@H]1CC12CCC2)Cc1ccc(F)c(C#N)c1	ZINC001733778928	1430034471	/nfs/dbraw/zinc/03/44/71/1430034471.db2.gz	XTLYMSQFGWNJBU-KRWDZBQOSA-N	0	3	343.446	3.168	20	30		EGEDHN
CCCCC(=O)N[C@H]1CCN(Cc2ccc(OCC#N)cc2)[C@@H](C)C1	ZINC001733897215	1437714759	/nfs/dbraw/zinc/71/47/59/1437714759.db2.gz	ZUQURBPRDDSWTQ-WMZOPIPTSA-N	0	3	343.471	3.248	20	30		EGEDHN
Cc1cc(C(=O)NC[C@@H](C)N(C)Cc2cccc(C#N)c2)c(C)s1	ZINC001734041742	1437829916	/nfs/dbraw/zinc/82/99/16/1437829916.db2.gz	DVQKEKCLYTYAEQ-CYBMUJFWSA-N	0	3	341.480	3.487	20	30		EGEDHN
C=C(C)CCC(=O)N1CCCC[C@H]1[C@H](C)NCc1cnc(C)nc1	ZINC001752145018	1440145582	/nfs/dbraw/zinc/14/55/82/1440145582.db2.gz	FDQISYLKOZJZFV-YJBOKZPZSA-N	0	3	330.476	3.001	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N2CCCC[C@@H]2[C@H](C)NCCF)cc1	ZINC001752146455	1440146054	/nfs/dbraw/zinc/14/60/54/1440146054.db2.gz	LULGLKQDFLHMRK-QFBILLFUSA-N	0	3	346.446	3.031	20	30		EGEDHN
CCCCCCCN1CCC[C@H](NC(=O)c2cccnc2OC)C1	ZINC001752326923	1440170946	/nfs/dbraw/zinc/17/09/46/1440170946.db2.gz	LKXVOPCLFKRXKC-INIZCTEOSA-N	0	3	333.476	3.255	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@@H](CNC(=O)c2ccsc2)C2CC2)c1	ZINC001752444591	1440181771	/nfs/dbraw/zinc/18/17/71/1440181771.db2.gz	JZXXGSBSMLPCBM-KRWDZBQOSA-N	0	3	343.427	3.057	20	30		EGEDHN
C=C[C@@H](C(=O)NC[C@@H](NCc1cncs1)C1CC1)c1ccccc1	ZINC001752500666	1440188313	/nfs/dbraw/zinc/18/83/13/1440188313.db2.gz	XLNAESSJFRWWOV-QZTJIDSGSA-N	0	3	341.480	3.097	20	30		EGEDHN
C=CCC1(C(=O)N2CCC[C@@H](CN(C)Cc3ocnc3C)C2)CCC1	ZINC001752517993	1440191907	/nfs/dbraw/zinc/19/19/07/1440191907.db2.gz	LFMIWJOESYTKTK-KRWDZBQOSA-N	0	3	345.487	3.400	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1Cc2ccccc2O1	ZINC001752538043	1440194226	/nfs/dbraw/zinc/19/42/26/1440194226.db2.gz	BOWHQUFBZOQTGN-WOGUSJMUSA-N	0	3	340.467	3.020	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)c1nc(CC)oc1C	ZINC001752564722	1440195445	/nfs/dbraw/zinc/19/54/45/1440195445.db2.gz	JQIWERVODNJJHJ-CWRNSKLLSA-N	0	3	331.460	3.189	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)Cc1ccco1	ZINC001752567498	1440195549	/nfs/dbraw/zinc/19/55/49/1440195549.db2.gz	RZSDBGXQFUPVFT-XDNAFOTISA-N	0	3	330.472	3.488	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1C[C@H](NCc2ccc(Cl)cc2OC)C1	ZINC001752652073	1440198008	/nfs/dbraw/zinc/19/80/08/1440198008.db2.gz	WVMQXJKNIVIYMZ-SHTZXODSSA-N	0	3	336.863	3.298	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1C[C@H](NCc2cc(F)ccc2OC)C1	ZINC001752670564	1440198979	/nfs/dbraw/zinc/19/89/79/1440198979.db2.gz	ZRMMDKJOEAHRFL-WKILWMFISA-N	0	3	334.435	3.173	20	30		EGEDHN
CC[C@@H](C)[C@H](C)C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001752672940	1440199035	/nfs/dbraw/zinc/19/90/35/1440199035.db2.gz	ITOYGKJCXVMPTF-DLTLXFJOSA-N	0	3	331.435	3.116	20	30		EGEDHN
CC(C)[C@H]1C[C@@H]1C(=O)N[C@H]1C[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001752673543	1440199070	/nfs/dbraw/zinc/19/90/70/1440199070.db2.gz	GAOXFJHGRGHQKF-TVFCKZIOSA-N	0	3	344.886	3.220	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1cccc(C(F)F)c1	ZINC001752689767	1440200281	/nfs/dbraw/zinc/20/02/81/1440200281.db2.gz	MMWJJTFAUQSXEF-RJCAOGMDSA-N	0	3	347.409	3.395	20	30		EGEDHN
Cc1c(C(=O)N[C@H]2C[C@@H](NCC#Cc3ccccc3)C2)ccn1C(C)C	ZINC001752753878	1440205133	/nfs/dbraw/zinc/20/51/33/1440205133.db2.gz	JVMNIOBJNLYCMA-BGYRXZFFSA-N	0	3	349.478	3.280	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)CCc1ccc(F)cc1F	ZINC001752823524	1440222216	/nfs/dbraw/zinc/22/22/16/1440222216.db2.gz	DIXNVGHJIJYNOY-QGZVFWFLSA-N	0	3	336.426	3.444	20	30		EGEDHN
C=CCCC(=O)N1CCCC[C@@H]1[C@H]1CCCN1Cc1conc1C	ZINC001752832485	1440225854	/nfs/dbraw/zinc/22/58/54/1440225854.db2.gz	WQXLHRGPCTVGSF-QZTJIDSGSA-N	0	3	331.460	3.295	20	30		EGEDHN
CC[C@H](CC(C)C)C(=O)NC[C@@H](C)NCc1ccc(F)c(C#N)c1	ZINC001752909957	1440245092	/nfs/dbraw/zinc/24/50/92/1440245092.db2.gz	ABZWMPRWHSDIJN-GDBMZVCRSA-N	0	3	333.451	3.364	20	30		EGEDHN
C=C[C@@H](C(=O)NC[C@H](C)NCc1c(C)nsc1C)c1ccccc1	ZINC001752920958	1440248657	/nfs/dbraw/zinc/24/86/57/1440248657.db2.gz	JFXKNWOTNPSEBA-SUMWQHHRSA-N	0	3	343.496	3.324	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1ccc(-c2cnco2)cc1	ZINC001753009269	1440266461	/nfs/dbraw/zinc/26/64/61/1440266461.db2.gz	BWDPDZJATGSMQU-CYBMUJFWSA-N	0	3	333.819	3.192	20	30		EGEDHN
C#CCC1(C(=O)NCC[C@@H](C)NCc2oc(C)nc2C)CCCCC1	ZINC001753020492	1440269861	/nfs/dbraw/zinc/26/98/61/1440269861.db2.gz	PGBAVQASTJTCBV-OAHLLOKOSA-N	0	3	345.487	3.250	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)NCCC[C@@H]1CCCN1Cc1ccccc1C#N	ZINC001753026551	1440271457	/nfs/dbraw/zinc/27/14/57/1440271457.db2.gz	QRNJGINIUZVXKD-MOPGFXCFSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1CCCNC(=O)c1ccn(C)c1CC	ZINC001753033982	1440273958	/nfs/dbraw/zinc/27/39/58/1440273958.db2.gz	XJKRDORECLDZSW-OAHLLOKOSA-N	0	3	337.895	3.314	20	30		EGEDHN
CCC(CC)(CC)C(=O)N(C)CCNCc1ccc(C#N)c(F)c1	ZINC001753245982	1440342483	/nfs/dbraw/zinc/34/24/83/1440342483.db2.gz	MMQNCTSZIRUZCI-UHFFFAOYSA-N	0	3	333.451	3.462	20	30		EGEDHN
C=CCC1(C(=O)N(C)CCNCc2cnccc2C)CCCCC1	ZINC001753264543	1440344640	/nfs/dbraw/zinc/34/46/40/1440344640.db2.gz	VTLATIMFNGMWAM-UHFFFAOYSA-N	0	3	329.488	3.465	20	30		EGEDHN
Cc1ccc2[nH]cc(C(=O)N(C)CCNCc3cccc(C#N)c3)c2c1	ZINC001753265191	1440344824	/nfs/dbraw/zinc/34/48/24/1440344824.db2.gz	RRFSGGFNUDMJQQ-UHFFFAOYSA-N	0	3	346.434	3.210	20	30		EGEDHN
CC(C)N(CCCNC(=O)c1ccncc1)Cc1ccc(C#N)s1	ZINC001753281647	1440347539	/nfs/dbraw/zinc/34/75/39/1440347539.db2.gz	KISBVEQNUGZEBU-UHFFFAOYSA-N	0	3	342.468	3.045	20	30		EGEDHN
C#CCCN[C@@H](CNC(=O)Cc1ccoc1)c1ccc(C(C)C)cc1	ZINC001753294892	1440351989	/nfs/dbraw/zinc/35/19/89/1440351989.db2.gz	XCFUXXQDXZQGCS-FQEVSTJZSA-N	0	3	338.451	3.416	20	30		EGEDHN
C#CCCN[C@H](CNC(=O)CC(F)(F)C(F)(F)F)c1ccccc1	ZINC001753302979	1440354628	/nfs/dbraw/zinc/35/46/28/1440354628.db2.gz	MSAODERNGXVDHB-CYBMUJFWSA-N	0	3	348.315	3.045	20	30		EGEDHN
C#CCCN[C@H](CNC(=O)c1coc(C2CCC2)n1)c1ccccc1	ZINC001753311536	1440356692	/nfs/dbraw/zinc/35/66/92/1440356692.db2.gz	NWPKPQLODZRVIR-QGZVFWFLSA-N	0	3	337.423	3.026	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CCC)C(=O)c2ncnc3sccc32)C1	ZINC001753316768	1440360161	/nfs/dbraw/zinc/36/01/61/1440360161.db2.gz	ZUFOLMMFKKZTGT-AWEZNQCLSA-N	0	3	344.484	3.194	20	30		EGEDHN
C#CCCN1CC[C@H](N(CCC)C(=O)c2ccc(C(C)C)nc2)C1	ZINC001753317949	1440360886	/nfs/dbraw/zinc/36/08/86/1440360886.db2.gz	ZAWAFCRQLPPAQV-SFHVURJKSA-N	0	3	327.472	3.155	20	30		EGEDHN
CC/C=C(\C)C(=O)NCC[C@@H]1CCN(Cc2ccc(C#N)s2)C1	ZINC001753321085	1440363508	/nfs/dbraw/zinc/36/35/08/1440363508.db2.gz	BNCZWDKPXMXHEO-XUYKZZHDSA-N	0	3	331.485	3.304	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CCC)C(=O)CC(C)(C)C(F)(F)F)C1	ZINC001753321699	1440363992	/nfs/dbraw/zinc/36/39/92/1440363992.db2.gz	CALPKQUSFMBSSP-CQSZACIVSA-N	0	3	332.410	3.301	20	30		EGEDHN
CC/C=C(/C)C(=O)NCC[C@H]1CCN(Cc2ccccc2C#N)C1	ZINC001753322716	1440364713	/nfs/dbraw/zinc/36/47/13/1440364713.db2.gz	PPDFHRSORYITEZ-CVWPPMRVSA-N	0	3	325.456	3.243	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CCC)C(=O)c2cccc(F)c2Cl)C1	ZINC001753326201	1440366815	/nfs/dbraw/zinc/36/68/15/1440366815.db2.gz	GMPCZRNWPVONJL-CQSZACIVSA-N	0	3	336.838	3.429	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H]2C[C@H]1CN2C(=O)c1coc(C(C)(C)C)n1	ZINC001753420582	1440395381	/nfs/dbraw/zinc/39/53/81/1440395381.db2.gz	CJKYKMCVOWEPLH-KKUMJFAQSA-N	0	3	331.460	3.226	20	30		EGEDHN
C=CCCCN1C[C@@H]2C[C@H]1CN2C(=O)C(C)(C)c1cccc(OC)c1	ZINC001753426327	1440396794	/nfs/dbraw/zinc/39/67/94/1440396794.db2.gz	VWENCUNTPBVHCW-ROUUACIJSA-N	0	3	342.483	3.224	20	30		EGEDHN
C=CCOCC(=O)N(CC)[C@@H]1CCN(Cc2ccc(C(C)C)cc2)C1	ZINC001753452667	1440406768	/nfs/dbraw/zinc/40/67/68/1440406768.db2.gz	CLLNJPBFPMYQTA-HXUWFJFHSA-N	0	3	344.499	3.435	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)[C@@H](CC)OC2CCCCC2)C1	ZINC001753455374	1440408059	/nfs/dbraw/zinc/40/80/59/1440408059.db2.gz	JHDSNQPFOVHNAA-IEBWSBKVSA-N	0	3	334.504	3.060	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)[C@H](C)Cc2ccc(C)cc2)C1	ZINC001753463959	1440412007	/nfs/dbraw/zinc/41/20/07/1440412007.db2.gz	LETQSEHQSJFLQR-UYAOXDASSA-N	0	3	326.484	3.120	20	30		EGEDHN
CC[C@@H](CNC(=O)c1cc[nH]c1C)NCC#Cc1cccc(Cl)c1	ZINC001753470146	1440413826	/nfs/dbraw/zinc/41/38/26/1440413826.db2.gz	NQGDJRWJGBOXBS-KRWDZBQOSA-N	0	3	343.858	3.126	20	30		EGEDHN
CC[C@@H](C)CC(=O)NC1(CNCC#Cc2ccccc2)CCCC1	ZINC001753502330	1440423665	/nfs/dbraw/zinc/42/36/65/1440423665.db2.gz	NUWGKPFDQDPLKO-GOSISDBHSA-N	0	3	326.484	3.493	20	30		EGEDHN
C=C(C)CCC(=O)N[C@](C)(CN[C@@H](C)c1cnc(C)cn1)C1CC1	ZINC001753518806	1440428049	/nfs/dbraw/zinc/42/80/49/1440428049.db2.gz	QEEZDWDOYJDXSV-HNAYVOBHSA-N	0	3	330.476	3.077	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1cncc2ccccc21)C1CC1	ZINC001753528298	1440430127	/nfs/dbraw/zinc/43/01/27/1440430127.db2.gz	WGENAYFVQOEWON-IBGZPJMESA-N	0	3	343.858	3.475	20	30		EGEDHN
CC(C)=CC(=O)N1CCC(CCNCc2ccccc2C#N)CC1	ZINC001753563490	1440437315	/nfs/dbraw/zinc/43/73/15/1440437315.db2.gz	ALLTUKJEYOAICO-UHFFFAOYSA-N	0	3	325.456	3.243	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1CC[C@H](N[C@@H](C)c2cnc(C)cn2)CC1	ZINC001753584065	1440440935	/nfs/dbraw/zinc/44/09/35/1440440935.db2.gz	XOXVVYFEQPAKIZ-JYJNAYRXSA-N	0	3	330.476	3.075	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCCC1CCN(Cc2cnc(C)o2)CC1	ZINC001753597507	1440445080	/nfs/dbraw/zinc/44/50/80/1440445080.db2.gz	WKGVUFYETZXWDU-INIZCTEOSA-N	0	3	333.476	3.304	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N1CCC[C@@H]1CNCC#Cc1ccc(F)cc1	ZINC001753601303	1440446456	/nfs/dbraw/zinc/44/64/56/1440446456.db2.gz	YZRRDWFYHFPDKK-WRFQGRBFSA-N	0	3	340.442	3.280	20	30		EGEDHN
CC1(CC(=O)N2CCC[C@@H]2CNCC#Cc2ccc(Cl)cc2)CC1	ZINC001753601071	1440446484	/nfs/dbraw/zinc/44/64/84/1440446484.db2.gz	AXAJKZWLMSTLAE-GOSISDBHSA-N	0	3	344.886	3.462	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N1CCC[C@@H]1CNCC#Cc1ccc(F)cc1	ZINC001753601302	1440446495	/nfs/dbraw/zinc/44/64/95/1440446495.db2.gz	YZRRDWFYHFPDKK-CFIBSBMNSA-N	0	3	340.442	3.280	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CC2(C(F)(F)F)CC2)CCCC1	ZINC001753664406	1440459690	/nfs/dbraw/zinc/45/96/90/1440459690.db2.gz	ULRRZHGCGNNEBY-UHFFFAOYSA-N	0	3	338.801	3.490	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccccc1Cl)N(C)C(=O)C1CC=CC1	ZINC001753684022	1440465201	/nfs/dbraw/zinc/46/52/01/1440465201.db2.gz	WPLNWSRMZHDKFP-HNNXBMFYSA-N	0	3	330.859	3.094	20	30		EGEDHN
C=CCC1(C(=O)N(C)[C@H](C)CNCc2ccc(C#N)s2)CCC1	ZINC001753710342	1440470449	/nfs/dbraw/zinc/47/04/49/1440470449.db2.gz	CCCHBXKPEAOVLT-CQSZACIVSA-N	0	3	331.485	3.303	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H](CNCc1cnn(C)c1)C1CCCCC1	ZINC001753747402	1440481566	/nfs/dbraw/zinc/48/15/66/1440481566.db2.gz	PRUWWRHFZJEYRQ-GOSISDBHSA-N	0	3	346.519	3.177	20	30		EGEDHN
CC(C)[C@H](CNC(=O)[C@@H](C)C1CCC1)NCc1ccc(C#N)cc1F	ZINC001753832715	1440500214	/nfs/dbraw/zinc/50/02/14/1440500214.db2.gz	SLRAHVHFEMMNQM-LIRRHRJNSA-N	0	3	345.462	3.364	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@H]2[C@@H](CCN2Cc2ccccc2Cl)C1	ZINC001753872174	1440517786	/nfs/dbraw/zinc/51/77/86/1440517786.db2.gz	KKDKATPEPRAUNY-HKUYNNGSSA-N	0	3	344.886	3.422	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CCC[C@H]1CNCc1csc(C)n1	ZINC001753897117	1440522977	/nfs/dbraw/zinc/52/29/77/1440522977.db2.gz	ZZOIWMGECTYOHV-DOTOQJQBSA-N	0	3	333.501	3.020	20	30		EGEDHN
C=C(Br)CNCC[C@@H](C)NC(=O)c1ccc(C)cc1F	ZINC001754001761	1440530326	/nfs/dbraw/zinc/53/03/26/1440530326.db2.gz	JXNMXMPONFLQEC-GFCCVEGCSA-N	0	3	343.240	3.141	20	30		EGEDHN
CCN(CCNCc1ccc(C#N)cc1)C(=O)C[C@H]1CC=CCC1	ZINC001754062188	1440536953	/nfs/dbraw/zinc/53/69/53/1440536953.db2.gz	VXRHNGRZULZLDC-KRWDZBQOSA-N	0	3	325.456	3.243	20	30		EGEDHN
CCN(CCNCc1cccc(C#N)c1)C(=O)c1cc[nH]c1C(C)C	ZINC001754063568	1440537212	/nfs/dbraw/zinc/53/72/12/1440537212.db2.gz	PDQKBMGQYLRGQB-UHFFFAOYSA-N	0	3	338.455	3.262	20	30		EGEDHN
C=C[C@@H](C(=O)N(CC)CCNCc1ccc(C#N)cc1)c1ccccc1	ZINC001754084461	1440539923	/nfs/dbraw/zinc/53/99/23/1440539923.db2.gz	IUIVWKGYBRTIDN-OAQYLSRUSA-N	0	3	347.462	3.466	20	30		EGEDHN
CCC1(C(=O)NC/C=C/CNCc2ccc(F)c(C#N)c2)CCCC1	ZINC001754190778	1440549085	/nfs/dbraw/zinc/54/90/85/1440549085.db2.gz	HNOKTFCJTRKMFS-AATRIKPKSA-N	0	3	343.446	3.430	20	30		EGEDHN
C=C[C@@H](C(=O)NC/C=C\CNCc1ccc(C)nc1C)c1ccccc1	ZINC001754210247	1440551001	/nfs/dbraw/zinc/55/10/01/1440551001.db2.gz	SXNRHUFLMINEBO-HEDKFQSOSA-N	0	3	349.478	3.430	20	30		EGEDHN
C=C[C@@H](C(=O)NC/C=C/CNCCC(F)(F)F)c1ccccc1	ZINC001754210550	1440551155	/nfs/dbraw/zinc/55/11/55/1440551155.db2.gz	ZCKQOFYVRSWICO-LQYUOIDQSA-N	0	3	326.362	3.171	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](C)CN(C)Cc2ccccc2N(C)C)CC1	ZINC001754323060	1440579046	/nfs/dbraw/zinc/57/90/46/1440579046.db2.gz	LSYDLNHUPNBTFD-QGZVFWFLSA-N	0	3	343.515	3.436	20	30		EGEDHN
C[C@@H](CN(C)Cc1cccc(C#N)c1)NC(=O)c1cccc2c1CCC2	ZINC001754336697	1440587071	/nfs/dbraw/zinc/58/70/71/1440587071.db2.gz	OOFCFAKSXGRTMB-INIZCTEOSA-N	0	3	347.462	3.297	20	30		EGEDHN
C=C(Br)CNCCCN(C)C(=O)[C@]1(C)CC=C(C)CC1	ZINC001754416061	1440596881	/nfs/dbraw/zinc/59/68/81/1440596881.db2.gz	JHUOHQJCBRPKEV-MRXNPFEDSA-N	0	3	343.309	3.470	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NC[C@@H]1CCN1Cc1c(C)cccc1C)OCC	ZINC001754484402	1440608455	/nfs/dbraw/zinc/60/84/55/1440608455.db2.gz	AHSLPSHJBKDSNT-ICSRJNTNSA-N	0	3	344.499	3.365	20	30		EGEDHN
C=CCC[C@H](C)N1CC[C@H]1CNC(=O)c1cnoc1-c1ccco1	ZINC001754487937	1440609152	/nfs/dbraw/zinc/60/91/52/1440609152.db2.gz	SXGFNJHNGIULAL-KBPBESRZSA-N	0	3	329.400	3.093	20	30		EGEDHN
C=CCCCCCN1CC[C@H]1CNC(=O)c1cccc2c1CCOC2	ZINC001754489078	1440609550	/nfs/dbraw/zinc/60/95/50/1440609550.db2.gz	PWYZXECWEBFQRH-SFHVURJKSA-N	0	3	342.483	3.310	20	30		EGEDHN
CCCCCCCN1CC[C@@H]1CNC(=O)[C@@H]1Cc2cc(F)ccc2O1	ZINC001754495023	1440611821	/nfs/dbraw/zinc/61/18/21/1440611821.db2.gz	CVWIJCKMIHUTOT-MJGOQNOKSA-N	0	3	348.462	3.290	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC1(NCc2cccc(OC)c2C)CC1	ZINC001754523583	1440620282	/nfs/dbraw/zinc/62/02/82/1440620282.db2.gz	AMZHJIBCAPPMOR-IBGZPJMESA-N	0	3	330.472	3.344	20	30		EGEDHN
C=C(Cl)CN(CC1CC1)C1CCN(C(=O)[C@@H](CC)OCC)CC1	ZINC001754547442	1440628110	/nfs/dbraw/zinc/62/81/10/1440628110.db2.gz	DDECRWDJXIDTGP-QGZVFWFLSA-N	0	3	342.911	3.257	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@H]2CCC[C@@H](C1)N2C[C@H](OCC)C1CC1	ZINC001754553178	1440630564	/nfs/dbraw/zinc/63/05/64/1440630564.db2.gz	RUQCTYUXFHXLPP-OTWHNJEPSA-N	0	3	348.531	3.469	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](NCc2ccncc2Cl)C[C@H]1C	ZINC001754592581	1440640954	/nfs/dbraw/zinc/64/09/54/1440640954.db2.gz	DKFVLCIOVDMVIS-GDBMZVCRSA-N	0	3	333.863	3.008	20	30		EGEDHN
C#CCN(C(=O)C1=CCCC1)C1CCN(CCOCCC(C)C)CC1	ZINC001754636360	1440648641	/nfs/dbraw/zinc/64/86/41/1440648641.db2.gz	JNIWCKZZBPBXKA-UHFFFAOYSA-N	0	3	346.515	3.086	20	30		EGEDHN
C#CCN(C(=O)[C@H](C)c1ccc(CC)cc1)C1CCN(CC=C)CC1	ZINC001754641894	1440649294	/nfs/dbraw/zinc/64/92/94/1440649294.db2.gz	NIYXULACKFWOFA-GOSISDBHSA-N	0	3	338.495	3.465	20	30		EGEDHN
CC1CC(C(=O)N[C@@H](CNCc2ccc(C#N)s2)C2CCCC2)C1	ZINC001754646028	1440650303	/nfs/dbraw/zinc/65/03/03/1440650303.db2.gz	QBSOKHAJXAGSMC-RWKZGTHUSA-N	0	3	345.512	3.430	20	30		EGEDHN
CCCc1ccc(CN2CC[C@@](C)(NC(=O)C#CC(C)C)C2)cc1	ZINC001754669937	1440657527	/nfs/dbraw/zinc/65/75/27/1440657527.db2.gz	ISIAHYHTWHOHFS-OAQYLSRUSA-N	0	3	326.484	3.379	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@](C)(CN[C@H](C)c2cnc(C)cn2)C1	ZINC001754694368	1440666839	/nfs/dbraw/zinc/66/68/39/1440666839.db2.gz	BPYKIDQTEOVHCB-VQIMIIECSA-N	0	3	330.476	3.031	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@](C)(CNCc2cc(F)ccc2C#N)C1	ZINC001754710812	1440670121	/nfs/dbraw/zinc/67/01/21/1440670121.db2.gz	NEGKWIYWWVFNQR-LJQANCHMSA-N	0	3	331.435	3.072	20	30		EGEDHN
C=CCN1CCC[C@@](C)(CNC(=O)c2c(F)cc(F)cc2F)C1	ZINC001754729351	1440678279	/nfs/dbraw/zinc/67/82/79/1440678279.db2.gz	IJSRBLOFFBKGMF-KRWDZBQOSA-N	0	3	326.362	3.122	20	30		EGEDHN
C=CCN1CCC[C@@](C)(CNC(=O)c2cc(F)cc3cccnc32)C1	ZINC001754730405	1440678862	/nfs/dbraw/zinc/67/88/62/1440678862.db2.gz	HIVNNOLWMYPBAX-FQEVSTJZSA-N	0	3	341.430	3.392	20	30		EGEDHN
CC#CCNCCN(Cc1ccccc1)C(=O)c1cccc(F)c1C	ZINC001754837712	1440697182	/nfs/dbraw/zinc/69/71/82/1440697182.db2.gz	QDHYYXSOODKYMG-UHFFFAOYSA-N	0	3	338.426	3.389	20	30		EGEDHN
C=CCCN1CCC[C@@](CO)(NC(=O)c2ccc3sccc3c2)C1	ZINC001754859359	1440700633	/nfs/dbraw/zinc/70/06/33/1440700633.db2.gz	VMZBPJTXZUTJFO-LJQANCHMSA-N	0	3	344.480	3.034	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1ccc(C)nc1C	ZINC001754863970	1440701877	/nfs/dbraw/zinc/70/18/77/1440701877.db2.gz	RTIKIIMXTBLHHH-MOPGFXCFSA-N	0	3	327.472	3.230	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H]2[C@H]1CCN2CCOc1cccc(F)c1	ZINC001754864535	1440702096	/nfs/dbraw/zinc/70/20/96/1440702096.db2.gz	XHDDYNWZAUHMRQ-RTBURBONSA-N	0	3	346.446	3.236	20	30		EGEDHN
N#Cc1ccccc1CNCC[C@@H]1CCN(C(=O)CC2CCC2)C1	ZINC001754910859	1440708085	/nfs/dbraw/zinc/70/80/85/1440708085.db2.gz	VTLBDCMQDLESHD-QGZVFWFLSA-N	0	3	325.456	3.077	20	30		EGEDHN
CC/C(C)=C/C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001754960160	1440717393	/nfs/dbraw/zinc/71/73/93/1440717393.db2.gz	ZFMRDABJRSGGNZ-GZTJUZNOSA-N	0	3	337.467	3.339	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)NCC1(NCc2ccc(C#N)c(F)c2)CCC1	ZINC001754988321	1440723513	/nfs/dbraw/zinc/72/35/13/1440723513.db2.gz	ZKZWBAONYFEPFO-CQSZACIVSA-N	0	3	331.435	3.118	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)CCCC(F)(F)F)C1	ZINC001755047040	1440741686	/nfs/dbraw/zinc/74/16/86/1440741686.db2.gz	LFMFYICUIDGUBO-JKSUJKDBSA-N	0	3	344.421	3.445	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC[C@@]2(CCN(Cc3ccccn3)C2)C1	ZINC001755078039	1440749901	/nfs/dbraw/zinc/74/99/01/1440749901.db2.gz	HLJSSOHIPYVZTE-FQEVSTJZSA-N	0	3	327.472	3.252	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@@H](NCC#Cc2ccccc2Cl)C1	ZINC001755104794	1440753727	/nfs/dbraw/zinc/75/37/27/1440753727.db2.gz	KHWCFLWSWFALSU-QAPCUYQASA-N	0	3	330.859	3.094	20	30		EGEDHN
C[C@H]1CN(C(=O)C2CC=CC2)C[C@@H]1NCC#Cc1ccccc1Cl	ZINC001755107062	1440753884	/nfs/dbraw/zinc/75/38/84/1440753884.db2.gz	HLZAMTAKZZHYQI-KXBFYZLASA-N	0	3	342.870	3.094	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)[C@@H](NCc2cccc(C(C)C)n2)C1	ZINC001755120248	1440755493	/nfs/dbraw/zinc/75/54/93/1440755493.db2.gz	CWAWHDIQDDGFON-APWZRJJASA-N	0	3	329.488	3.498	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@H](NCc2ccc(Cl)nc2)[C@@H](C)C1	ZINC001755124319	1440756087	/nfs/dbraw/zinc/75/60/87/1440756087.db2.gz	VSGIRRMCALDOJK-YOEHRIQHSA-N	0	3	347.890	3.440	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)[C@H](C)OCc2cccc(C)c2)C(C)(C)C1	ZINC001755142013	1440761083	/nfs/dbraw/zinc/76/10/83/1440761083.db2.gz	RTNSINNLIDPGFO-HKUYNNGSSA-N	0	3	344.499	3.303	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)[C@@H](C)Cc2ccc(F)cc2)C(C)(C)C1	ZINC001755143718	1440762401	/nfs/dbraw/zinc/76/24/01/1440762401.db2.gz	NSVZGLSOMZZTIL-YJBOKZPZSA-N	0	3	332.463	3.407	20	30		EGEDHN
Cc1ccc(F)cc1CN(C)C[C@@H]1CCCN1C(=O)C#CC(C)C	ZINC001755192238	1440775020	/nfs/dbraw/zinc/77/50/20/1440775020.db2.gz	BIAUBUXWVAXGMK-IBGZPJMESA-N	0	3	330.447	3.216	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCN1C(=O)c1nsc2ccc(C)cc21	ZINC001755196067	1440777109	/nfs/dbraw/zinc/77/71/09/1440777109.db2.gz	DMRCDPQAOFFLSI-CQSZACIVSA-N	0	3	329.469	3.327	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCN1C(=O)c1ccc(C(F)F)cc1F	ZINC001755208855	1440782855	/nfs/dbraw/zinc/78/28/55/1440782855.db2.gz	CGUFUCMNMAHLQM-CYBMUJFWSA-N	0	3	326.362	3.486	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)s1)[C@@H](C)NC(=O)c1ccoc1Cl	ZINC001755235044	1440788014	/nfs/dbraw/zinc/78/80/14/1440788014.db2.gz	XQITXNTVDWORHD-NXEZZACHSA-N	0	3	337.832	3.163	20	30		EGEDHN
CCCc1[nH]ccc1C(=O)N[C@@H](C)[C@H](C)NCC#Cc1ccccc1	ZINC001755251122	1440792014	/nfs/dbraw/zinc/79/20/14/1440792014.db2.gz	WFTKJYIITVMTSM-IRXDYDNUSA-N	0	3	337.467	3.115	20	30		EGEDHN
CN(C(=O)C#CC1CC1)C1CCC(NC/C(Cl)=C\Cl)CC1	ZINC001755273818	1440798463	/nfs/dbraw/zinc/79/84/63/1440798463.db2.gz	DOWGNUPULKOOJZ-JLHYYAGUSA-N	0	3	329.271	3.078	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)C[C@H](C)c1ccncc1	ZINC001755281718	1440800774	/nfs/dbraw/zinc/80/07/74/1440800774.db2.gz	SJJAMJLMNNOSKK-AWEZNQCLSA-N	0	3	337.895	3.402	20	30		EGEDHN
Cc1sccc1C(=O)NC[C@@H](C)N(C)Cc1ccc(C#N)cc1	ZINC001755298137	1440807407	/nfs/dbraw/zinc/80/74/07/1440807407.db2.gz	GVHHHXVHAQFIEM-CYBMUJFWSA-N	0	3	327.453	3.179	20	30		EGEDHN
CC(C)c1ccc(CN(C)[C@H](C)CNC(=O)c2cc(C#N)c[nH]2)cc1	ZINC001755298668	1440807682	/nfs/dbraw/zinc/80/76/82/1440807682.db2.gz	VQBXZWUTBSNPRK-OAHLLOKOSA-N	0	3	338.455	3.260	20	30		EGEDHN
C[C@H](CNC(=O)CCCC(F)(F)F)N(C)Cc1ccc(C#N)cc1	ZINC001755318545	1440816890	/nfs/dbraw/zinc/81/68/90/1440816890.db2.gz	LFPPPJNDQQVLKN-CYBMUJFWSA-N	0	3	341.377	3.227	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H](C)N(C)[C@H](C)c2cccc(F)c2)nc1	ZINC001755322232	1440819203	/nfs/dbraw/zinc/81/92/03/1440819203.db2.gz	DMZBMPGBYHSMNB-LSDHHAIUSA-N	0	3	339.414	3.013	20	30		EGEDHN
CC[C@H](F)C(=O)NC1(CNCc2ccc(C#N)cc2F)CCCCC1	ZINC001755353215	1440828425	/nfs/dbraw/zinc/82/84/25/1440828425.db2.gz	DAHPETGDGQCLBA-INIZCTEOSA-N	0	3	349.425	3.354	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H](C)C1CN(Cc2ccc3ncccc3c2)C1	ZINC001755385066	1440840481	/nfs/dbraw/zinc/84/04/81/1440840481.db2.gz	YRUGFZJPACXBOZ-HNNXBMFYSA-N	0	3	337.467	3.384	20	30		EGEDHN
Cc1ccc(CN2C[C@H](NC(=O)C#CC(C)C)C(C)(C)C2)cc1C	ZINC001755407202	1440844590	/nfs/dbraw/zinc/84/45/90/1440844590.db2.gz	KLVQVFGWUAGZCR-IBGZPJMESA-N	0	3	326.484	3.289	20	30		EGEDHN
C[C@@H](CCCNCc1cc(C#N)ccc1F)NC(=O)[C@@H]1CC12CCC2	ZINC001755518952	1440864761	/nfs/dbraw/zinc/86/47/61/1440864761.db2.gz	XRFJAQGMYLHDHJ-YOEHRIQHSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=CC(C)(C)C(=O)N(C)[C@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001755563627	1440875137	/nfs/dbraw/zinc/87/51/37/1440875137.db2.gz	CEWXRXIQWWLUKL-MRXNPFEDSA-N	0	3	331.485	3.159	20	30		EGEDHN
C=CC(C)(C)CC(=O)N(C)C[C@@H](C)NCc1cnn(C(C)(C)C)c1	ZINC001755588962	1440880956	/nfs/dbraw/zinc/88/09/56/1440880956.db2.gz	KBCXDTQFPIIRSB-OAHLLOKOSA-N	0	3	334.508	3.177	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@H](CO)N[C@H](C)c1ccc2ccccc2c1	ZINC001755630979	1440890718	/nfs/dbraw/zinc/89/07/18/1440890718.db2.gz	UYSYZJRHAPSJCN-OXQOHEQNSA-N	0	3	340.467	3.324	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@H](CO)N[C@@H](C)c1cc(C)ccc1C	ZINC001755635463	1440890741	/nfs/dbraw/zinc/89/07/41/1440890741.db2.gz	YDVWTZBIQPYFGR-DLBZAZTESA-N	0	3	332.488	3.033	20	30		EGEDHN
C[C@H]1C[C@@H](NCC#Cc2ccc(F)cc2)CN1C(=O)C1(F)CCCC1	ZINC001755680164	1440895075	/nfs/dbraw/zinc/89/50/75/1440895075.db2.gz	DJLHDFBZOWXDIG-MAUKXSAKSA-N	0	3	346.421	3.039	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@]12CCC[C@H]1N(CCc1ccccc1Cl)CC2	ZINC001755696087	1440897939	/nfs/dbraw/zinc/89/79/39/1440897939.db2.gz	KTMZJTMBPRKUEG-BJZITVGISA-N	0	3	345.874	3.155	20	30		EGEDHN
C=CCN1CCC[C@@H](NC(=O)CCCOc2cccc(C)c2)[C@H]1C	ZINC001755720644	1440907235	/nfs/dbraw/zinc/90/72/35/1440907235.db2.gz	IOMOZRSDCUPUDO-IEBWSBKVSA-N	0	3	330.472	3.309	20	30		EGEDHN
C=CCOCCN1CCC[C@H](NC(=O)C2CCC(C)(C)CC2)[C@H]1C	ZINC001755724375	1440908754	/nfs/dbraw/zinc/90/87/54/1440908754.db2.gz	XAEPMEPZKFSNDU-AEFFLSMTSA-N	0	3	336.520	3.375	20	30		EGEDHN
CC1(C)CN(C(=O)/C=C/c2ccco2)C[C@H]1NCC#Cc1ccccc1	ZINC001755751482	1440913225	/nfs/dbraw/zinc/91/32/25/1440913225.db2.gz	PZBLMAXBCSDHRB-DRUFCSCSSA-N	0	3	348.446	3.171	20	30		EGEDHN
CCCCC[C@H](CC)C(=O)N1C[C@H](NCC#CCOC)C(C)(C)C1	ZINC001755765973	1440916236	/nfs/dbraw/zinc/91/62/36/1440916236.db2.gz	AEWHQRVAGZKXLU-ROUUACIJSA-N	0	3	336.520	3.069	20	30		EGEDHN
C=CCN(C)CCN(C(=O)c1cn(C)c2ccc(F)cc12)C(C)C	ZINC001755812534	1440921407	/nfs/dbraw/zinc/92/14/07/1440921407.db2.gz	ABJNOXIJBMJRBC-UHFFFAOYSA-N	0	3	331.435	3.286	20	30		EGEDHN
C=C(C)CN(C)CCN(C(=O)c1cnc(CC2CC2)s1)C(C)C	ZINC001755814242	1440922314	/nfs/dbraw/zinc/92/23/14/1440922314.db2.gz	URITZCHWACLFOR-UHFFFAOYSA-N	0	3	335.517	3.454	20	30		EGEDHN
C=C(Br)CNC[C@H](NC(=O)[C@]1(C)C=CCC1)C(C)(C)C	ZINC001755829522	1440928319	/nfs/dbraw/zinc/92/83/19/1440928319.db2.gz	DIKQCALQONULOR-XJKSGUPXSA-N	0	3	343.309	3.372	20	30		EGEDHN
C=C(Br)CNC[C@@H](NC(=O)[C@H](C)C(C)C)C(C)(C)C	ZINC001755833079	1440929302	/nfs/dbraw/zinc/92/93/02/1440929302.db2.gz	FJMGTWXPEPZHOP-CHWSQXEVSA-N	0	3	333.314	3.308	20	30		EGEDHN
C[C@H](NC(=O)C#CC1CC1)C1CCN(Cc2ccccc2Cl)CC1	ZINC001755846780	1440933480	/nfs/dbraw/zinc/93/34/80/1440933480.db2.gz	NJPSJDAHFLWMGH-HNNXBMFYSA-N	0	3	344.886	3.470	20	30		EGEDHN
CN(C(=O)c1ccoc1)C1CC(NCC#Cc2ccccc2Cl)C1	ZINC001755853395	1440935497	/nfs/dbraw/zinc/93/54/97/1440935497.db2.gz	WTWXUCKDUGEAMN-UHFFFAOYSA-N	0	3	342.826	3.177	20	30		EGEDHN
CC#CCN1CCC(C2(NC(=O)[C@H](CC)OC3CCCC3)CC2)CC1	ZINC001755869457	1440938700	/nfs/dbraw/zinc/93/87/00/1440938700.db2.gz	GVHBZCMEFATXTD-IBGZPJMESA-N	0	3	346.515	3.108	20	30		EGEDHN
C=CC(C)(C)C(=O)NCC1=CCN(Cc2cccc(OC)c2C)CC1	ZINC001755891490	1440941611	/nfs/dbraw/zinc/94/16/11/1440941611.db2.gz	GBVYLQSLQJNSAY-UHFFFAOYSA-N	0	3	342.483	3.464	20	30		EGEDHN
C=CC[C@H](C(=O)[O-])[NH+]1CCC(c2ccccc2)(N2CCCC2)CC1	ZINC001588728566	983982847	/nfs/dbraw/zinc/98/28/47/983982847.db2.gz	DCBXQMKCHAHYDO-GOSISDBHSA-N	0	3	328.456	3.103	20	30		EGEDHN
C=CC[C@H](C(=O)[O-])N1CCC(c2ccccc2)([NH+]2CCCC2)CC1	ZINC001588728566	983982855	/nfs/dbraw/zinc/98/28/55/983982855.db2.gz	DCBXQMKCHAHYDO-GOSISDBHSA-N	0	3	328.456	3.103	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](C)Cc2ccc(C)cc2C)CC1	ZINC000066704202	215070897	/nfs/dbraw/zinc/07/08/97/215070897.db2.gz	XJLZJYZNVGTRCJ-QGZVFWFLSA-N	0	3	329.488	3.184	20	30		EGEDHN
COc1ccc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)cc1	ZINC000103504390	219309733	/nfs/dbraw/zinc/30/97/33/219309733.db2.gz	BHDPERDZAFOXOR-CYBMUJFWSA-N	0	3	328.755	3.310	20	30		EGEDHN
CCCN(CCN1CCCCCC1)C(=O)c1ccc(F)c(C#N)c1	ZINC000346242855	283255721	/nfs/dbraw/zinc/25/57/21/283255721.db2.gz	VTLLKXNHXNJRBB-UHFFFAOYSA-N	0	3	331.435	3.426	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2C[C@@H]2c2cccc(F)c2)CC1	ZINC000264382466	201210668	/nfs/dbraw/zinc/21/06/68/201210668.db2.gz	LPJQJWVQPDFWSI-QZTJIDSGSA-N	0	3	331.435	3.021	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(Cc2ccc(F)cc2)C2CC2)CC1	ZINC000264370799	201211141	/nfs/dbraw/zinc/21/11/41/201211141.db2.gz	QUNBDKDZBSWQRT-UHFFFAOYSA-N	0	3	331.435	3.150	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1	ZINC000264382919	201211157	/nfs/dbraw/zinc/21/11/57/201211157.db2.gz	LRGDMTABSRCXFN-UHFFFAOYSA-N	0	3	332.404	3.065	20	30		EGEDHN
C#CCCCCC(=O)N(Cc1ccncc1)C[C@H]1CCCN1CC	ZINC000271428874	201244135	/nfs/dbraw/zinc/24/41/35/201244135.db2.gz	NPKQUFIPJYDYQO-LJQANCHMSA-N	0	3	327.472	3.088	20	30		EGEDHN
C=C(C)COc1cccc(NC(=O)N2CC[C@@H]3CCN(C)C[C@H]32)c1	ZINC000272368060	201249031	/nfs/dbraw/zinc/24/90/31/201249031.db2.gz	GGCREYKBMTVZIV-MAUKXSAKSA-N	0	3	329.444	3.199	20	30		EGEDHN
C#CC[C@H](NC(=O)N(CCN(C)C)Cc1ccco1)c1ccccc1	ZINC000270234507	201237905	/nfs/dbraw/zinc/23/79/05/201237905.db2.gz	IUQHFPHLHJEMPE-IBGZPJMESA-N	0	3	339.439	3.117	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H](c2ccc(F)c(C)c2)C2CC2)CC1	ZINC000270419929	201238821	/nfs/dbraw/zinc/23/88/21/201238821.db2.gz	OJGBQWDYSMUUND-IBGZPJMESA-N	0	3	328.431	3.047	20	30		EGEDHN
C#CCOc1ccc(F)cc1NC(=O)N(C)[C@@H](C)C1CCN(C)CC1	ZINC000272619926	201251719	/nfs/dbraw/zinc/25/17/19/201251719.db2.gz	ULEAACHWOKXVTA-AWEZNQCLSA-N	0	3	347.434	3.032	20	30		EGEDHN
C=CCS(=O)(=O)CCN[C@H](C)Cc1c(Cl)cccc1Cl	ZINC000272840358	201258212	/nfs/dbraw/zinc/25/82/12/201258212.db2.gz	JKRZVIGLCNXFSI-LLVKDONJSA-N	0	3	336.284	3.115	20	30		EGEDHN
CN(C)CCN(C(=O)CSc1ccc(C#N)cc1)c1ccccc1	ZINC000103003526	204057999	/nfs/dbraw/zinc/05/79/99/204057999.db2.gz	ZCKHISQHZQSXBN-UHFFFAOYSA-N	0	3	339.464	3.245	20	30		EGEDHN
C[C@@H]1SCCN(CCC(=O)Nc2ccc(C#N)c(Cl)c2)[C@H]1C	ZINC000118414064	204276425	/nfs/dbraw/zinc/27/64/25/204276425.db2.gz	UMHZVJTZPQSKPG-RYUDHWBXSA-N	0	3	337.876	3.366	20	30		EGEDHN
C#CCCCCNC(=O)N(Cc1ccccc1)C1CCN(C)CC1	ZINC000154861169	204977522	/nfs/dbraw/zinc/97/75/22/204977522.db2.gz	WLWMDORXPHXAOL-UHFFFAOYSA-N	0	3	327.472	3.096	20	30		EGEDHN
C[C@@H](c1ccc(C#N)cc1)N1CCC[C@H](C(=O)Nc2ccccn2)C1	ZINC000377719547	169066918	/nfs/dbraw/zinc/06/69/18/169066918.db2.gz	LQYJTKUHLFVECX-YJBOKZPZSA-N	0	3	334.423	3.365	20	30		EGEDHN
CCN(CC)[C@H](CNCc1ccc(C#N)o1)c1cccc(OC)c1	ZINC000174251906	207003739	/nfs/dbraw/zinc/00/37/39/207003739.db2.gz	PRUGWTNYZMMOTN-LJQANCHMSA-N	0	3	327.428	3.333	20	30		EGEDHN
CN(C(=O)c1cccc(C#N)c1)C1CCN(Cc2ccccc2)CC1	ZINC000113095415	207176587	/nfs/dbraw/zinc/17/65/87/207176587.db2.gz	KRHZNOQASAXUHZ-UHFFFAOYSA-N	0	3	333.435	3.295	20	30		EGEDHN
Cc1ccc(OC2CCN(C[C@H](O)c3ccc(C#N)cc3)CC2)cc1	ZINC000268667168	252120371	/nfs/dbraw/zinc/12/03/71/252120371.db2.gz	JOSWLBCSVXPKLE-NRFANRHFSA-N	0	3	336.435	3.444	20	30		EGEDHN
C[C@@H](N[C@@H]1CN(Cc2ccccc2)CC[C@@H]1CO)c1ccc(C#N)cc1	ZINC000181784522	533528848	/nfs/dbraw/zinc/52/88/48/533528848.db2.gz	GLFDUJFRQLJVEU-ZPMCFJSWSA-N	0	3	349.478	3.092	20	30		EGEDHN
Cc1cccc(NC(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)c1	ZINC000097473066	140835743	/nfs/dbraw/zinc/83/57/43/140835743.db2.gz	NVTJWLODABESKZ-UHFFFAOYSA-N	0	3	336.439	3.462	20	30		EGEDHN
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NCc1cc(C#N)cs1	ZINC000342817888	141151096	/nfs/dbraw/zinc/15/10/96/141151096.db2.gz	HYCXDZKLBJZUIY-GUYCJALGSA-N	0	3	328.437	3.130	20	30		EGEDHN
C[C@@H](NCCC(=O)NCc1ccccc1)c1ccc(C#N)c(F)c1	ZINC000346219686	141182961	/nfs/dbraw/zinc/18/29/61/141182961.db2.gz	UMPJFAMIRKWFLZ-CQSZACIVSA-N	0	3	325.387	3.054	20	30		EGEDHN
CC(C)[C@@]1(C)C[C@H]1C(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000185732471	144118359	/nfs/dbraw/zinc/11/83/59/144118359.db2.gz	LNHFIZAVXQNZMP-AZUAARDMSA-N	0	3	327.472	3.131	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCN2CC[C@@]3(C2)OCc2ccccc23)cc1	ZINC000186704590	144141552	/nfs/dbraw/zinc/14/15/52/144141552.db2.gz	YSCWGSHYWYEIFE-NRFANRHFSA-N	0	3	347.418	3.018	20	30		EGEDHN
C[C@H](CNC(=O)CSc1ccc(C#N)cc1)N1CCCC[C@@H]1C	ZINC000343206219	144194560	/nfs/dbraw/zinc/19/45/60/144194560.db2.gz	MLSFSLSBFFQIAN-LSDHHAIUSA-N	0	3	331.485	3.029	20	30		EGEDHN
CC1CCC(N2CCN(C(=O)Nc3ccc(C#N)cc3)CC2)CC1	ZINC000115639486	152025047	/nfs/dbraw/zinc/02/50/47/152025047.db2.gz	NDZCDDILWWPFTI-UHFFFAOYSA-N	0	3	326.444	3.286	20	30		EGEDHN
CCCn1cc(CN[C@H]2CCCN(c3ccc(C#N)cc3F)C2)cn1	ZINC000116917202	152081723	/nfs/dbraw/zinc/08/17/23/152081723.db2.gz	FYJNJXSDGQXXBI-KRWDZBQOSA-N	0	3	341.434	3.062	20	30		EGEDHN
CN(CCc1ccc(Br)cc1)Cc1cc(C#N)n(C)c1	ZINC000191311474	153186832	/nfs/dbraw/zinc/18/68/32/153186832.db2.gz	HFTOJBLICJYRKV-UHFFFAOYSA-N	0	3	332.245	3.334	20	30		EGEDHN
CS[C@@H]1CN(c2cc(C#N)ccc2C(F)(F)F)C[C@@H]1N(C)C	ZINC000345351307	156066565	/nfs/dbraw/zinc/06/65/65/156066565.db2.gz	ROLFHAHJGOIHRY-UONOGXRCSA-N	0	3	329.391	3.059	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)cc1	ZINC000346827750	156152728	/nfs/dbraw/zinc/15/27/28/156152728.db2.gz	MGBQUJISXBHTNB-CQSZACIVSA-N	0	3	343.789	3.246	20	30		EGEDHN
Cc1ccc(C#N)c(NCC2(N3CCSCC3)CCCCC2)n1	ZINC000346850100	156165147	/nfs/dbraw/zinc/16/51/47/156165147.db2.gz	LSOMDUKJAHEJND-UHFFFAOYSA-N	0	3	330.501	3.425	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)Cc1ccc2c(c1)CCO2	ZINC000348926865	156290320	/nfs/dbraw/zinc/29/03/20/156290320.db2.gz	YUZVFWGSMLSBKO-UHFFFAOYSA-N	0	3	335.451	3.057	20	30		EGEDHN
CNC(=O)c1ccc(CN2CC=C(c3ccc(C#N)cc3)CC2)cc1	ZINC000362106000	157026693	/nfs/dbraw/zinc/02/66/93/157026693.db2.gz	LNIOTNZBLYRSHS-UHFFFAOYSA-N	0	3	331.419	3.207	20	30		EGEDHN
Cc1ncc(CN[C@@H]2CCCN(c3ccc(C#N)cc3F)C2)s1	ZINC000109351981	162097781	/nfs/dbraw/zinc/09/77/81/162097781.db2.gz	GVLXDGIZKAJZOV-CQSZACIVSA-N	0	3	330.432	3.221	20	30		EGEDHN
C[C@]1(O)CCCN(Cc2cccc(OCc3ccccc3C#N)c2)C1	ZINC000129562239	162360616	/nfs/dbraw/zinc/36/06/16/162360616.db2.gz	SVEPCARLGMNXMG-NRFANRHFSA-N	0	3	336.435	3.484	20	30		EGEDHN
CN(C)C[C@@H](NC(=O)c1ccc(C#N)s1)c1ccc(Cl)cc1	ZINC000338754866	163338722	/nfs/dbraw/zinc/33/87/22/163338722.db2.gz	PGMFDJJXZVSSCS-CQSZACIVSA-N	0	3	333.844	3.306	20	30		EGEDHN
COCc1ccc(NC(=O)NCCN2[C@H](C)CCC[C@@H]2C)cc1C#N	ZINC000529210085	269755381	/nfs/dbraw/zinc/75/53/81/269755381.db2.gz	CMJBAUFHOQFZPE-GASCZTMLSA-N	0	3	344.459	3.089	20	30		EGEDHN
C[C@H]1CCCC[C@@H]1C(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000424610749	269889853	/nfs/dbraw/zinc/88/98/53/269889853.db2.gz	CCCFRUZCGOBMHP-LPHOPBHVSA-N	0	3	327.472	3.275	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]([C@H](CO)C2CC2)C2CC2)c(Br)c1	ZINC000451611658	270053569	/nfs/dbraw/zinc/05/35/69/270053569.db2.gz	LQERDHGXPGZBDD-NVXWUHKLSA-N	0	3	349.272	3.207	20	30		EGEDHN
C[C@H](NCc1cc(C#N)cs1)c1cccc(N2CCOC2=O)c1	ZINC000177691117	265273364	/nfs/dbraw/zinc/27/33/64/265273364.db2.gz	PZFCUAOWCBHTLG-LBPRGKRZSA-N	0	3	327.409	3.427	20	30		EGEDHN
Cc1nc(N(CCN(C)C)Cc2ccc(F)cc2F)ccc1C#N	ZINC000488078949	270056073	/nfs/dbraw/zinc/05/60/73/270056073.db2.gz	JJAFTVCGXOVRDE-UHFFFAOYSA-N	0	3	330.382	3.108	20	30		EGEDHN
CCC1(CC)[C@H](NCC(=O)Nc2cc(Cl)ccc2C#N)C[C@@H]1OC	ZINC000191382627	266012550	/nfs/dbraw/zinc/01/25/50/266012550.db2.gz	OTXNQUSBYDYXIA-CVEARBPZSA-N	0	3	349.862	3.333	20	30		EGEDHN
CCN(CCc1cccs1)C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000279598363	266131263	/nfs/dbraw/zinc/13/12/63/266131263.db2.gz	FILJUJPGBJGVOQ-QGZVFWFLSA-N	0	3	337.448	3.393	20	30		EGEDHN
C[C@@H](c1ccc(C#N)c(F)c1)N1CCC[C@@H](CC(C)(C)C(N)=O)C1	ZINC000296259382	267000400	/nfs/dbraw/zinc/00/04/00/267000400.db2.gz	DEEKLWAGTJTKNX-KBPBESRZSA-N	0	3	331.435	3.372	20	30		EGEDHN
CCCCNC(=O)[C@H]1CC[C@H](C)N(Cc2ccc(C#N)c(C)c2)C1	ZINC000486702497	267009619	/nfs/dbraw/zinc/00/96/19/267009619.db2.gz	BTMSFETWFHXZPL-LPHOPBHVSA-N	0	3	327.472	3.384	20	30		EGEDHN
CCCN(Cc1ccc(F)cc1)C[C@@H](O)COc1ccc(C#N)cc1	ZINC000519908157	267015414	/nfs/dbraw/zinc/01/54/14/267015414.db2.gz	JWTILBWWNPXAJZ-LJQANCHMSA-N	0	3	342.414	3.349	20	30		EGEDHN
C[C@@H]1CN(C(=O)C(C#N)Cc2ccc(C#N)cc2)Cc2ccccc2O1	ZINC000293962348	267041706	/nfs/dbraw/zinc/04/17/06/267041706.db2.gz	TYFSWVZBVOKFPO-BEFAXECRSA-N	0	3	345.402	3.050	20	30		EGEDHN
C[C@@H]1CN(CCCCNc2c(C#N)cnc3ccccc32)C[C@H](C)O1	ZINC000301704465	267047577	/nfs/dbraw/zinc/04/75/77/267047577.db2.gz	FVYSAJRZIUOVGC-IYBDPMFKSA-N	0	3	338.455	3.408	20	30		EGEDHN
CN(C)CCOc1ccccc1-c1noc(Cc2ccc(C#N)cc2)n1	ZINC000273761945	267101415	/nfs/dbraw/zinc/10/14/15/267101415.db2.gz	DAFKFCDDEJMKBU-UHFFFAOYSA-N	0	3	348.406	3.139	20	30		EGEDHN
CCOC(=O)Nc1ccc(NC(=O)C(C)C(F)(F)F)cc1C#N	ZINC000493989816	267127674	/nfs/dbraw/zinc/12/76/74/267127674.db2.gz	UZWYGMXGIRLHME-QMMMGPOBSA-N	0	3	329.278	3.264	20	30		EGEDHN
CCOC[C@H]1CCCCN1Cc1cn(C)nc1-c1ccc(C#N)cc1	ZINC000459682517	267140892	/nfs/dbraw/zinc/14/08/92/267140892.db2.gz	YWDODIFYYOFCRI-LJQANCHMSA-N	0	3	338.455	3.350	20	30		EGEDHN
C[C@H](NC(=O)C1C[C@@H](c2ccccc2)OC1=O)c1ccc(C#N)cc1	ZINC000289223161	267177460	/nfs/dbraw/zinc/17/74/60/267177460.db2.gz	JLORIFHVLAXIOG-VHSSKADRSA-N	0	3	334.375	3.040	20	30		EGEDHN
C[C@H]([NH2+]C1CCN(c2ccc(C#N)cn2)CC1)c1cc(F)ccc1[O-]	ZINC000371876770	267179234	/nfs/dbraw/zinc/17/92/34/267179234.db2.gz	PDTZSPMTDOCNAD-ZDUSSCGKSA-N	0	3	340.402	3.118	20	30		EGEDHN
C[C@H](NCCN1CCc2sccc2C1)c1ccc(C#N)c(F)c1	ZINC000271913898	267181369	/nfs/dbraw/zinc/18/13/69/267181369.db2.gz	FTSPLWMBBVGVHQ-ZDUSSCGKSA-N	0	3	329.444	3.468	20	30		EGEDHN
C[C@H]1CN(CCC(=O)Nc2ccccc2C#N)Cc2ccccc2O1	ZINC000292432014	267229898	/nfs/dbraw/zinc/22/98/98/267229898.db2.gz	NROHIFJBRGASFZ-HNNXBMFYSA-N	0	3	335.407	3.170	20	30		EGEDHN
C[C@H](CCN1CCN(C)CC1)Nc1ccc(C(F)(F)F)c(C#N)c1	ZINC000274467142	267243348	/nfs/dbraw/zinc/24/33/48/267243348.db2.gz	LPAXHSVCMBQGOJ-CYBMUJFWSA-N	0	3	340.393	3.015	20	30		EGEDHN
CCc1cc(CCCN(C)CCOCc2ccc(C#N)cc2)on1	ZINC000451046023	267245188	/nfs/dbraw/zinc/24/51/88/267245188.db2.gz	ZFSHCMDGYTWREN-UHFFFAOYSA-N	0	3	327.428	3.190	20	30		EGEDHN
CN(C(=O)/C=C\c1ccc(C#N)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000492130894	267269480	/nfs/dbraw/zinc/26/94/80/267269480.db2.gz	CXNJNXILQBLDOC-AXUYNXDZSA-N	0	3	345.446	3.304	20	30		EGEDHN
CN(C)CCOc1cccc(NC(=O)[C@@H]2C[C@H]2c2cccc(C#N)c2)c1	ZINC000413280833	267280303	/nfs/dbraw/zinc/28/03/03/267280303.db2.gz	LVIMWSDBFKWGGO-VQTJNVASSA-N	0	3	349.434	3.241	20	30		EGEDHN
CN(CCC(=O)Nc1ccccc1C#N)Cc1cc(F)cc(F)c1	ZINC000444713961	267303991	/nfs/dbraw/zinc/30/39/91/267303991.db2.gz	IDQRYNUQJLPXJI-UHFFFAOYSA-N	0	3	329.350	3.297	20	30		EGEDHN
CN(Cc1ccccc1)C1CN(c2ccc3cc(C#N)ccc3n2)C1	ZINC000520631147	267320126	/nfs/dbraw/zinc/32/01/26/267320126.db2.gz	PTTYDFRDLLRHRQ-UHFFFAOYSA-N	0	3	328.419	3.427	20	30		EGEDHN
Cc1ccc(C#N)c(N2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)n1	ZINC000286335845	267375963	/nfs/dbraw/zinc/37/59/63/267375963.db2.gz	LSTSNDLLCCATFL-OAQYLSRUSA-N	0	3	332.451	3.364	20	30		EGEDHN
COC(=O)N1CCC([C@H](C)NCc2ccc(C#N)cc2Cl)CC1	ZINC000492572242	267376299	/nfs/dbraw/zinc/37/62/99/267376299.db2.gz	LDLHHNQWUSKWNA-LBPRGKRZSA-N	0	3	335.835	3.168	20	30		EGEDHN
C[C@H](C(=O)N1CCN(C2CCCCC2)CC1)c1cccc(C#N)c1	ZINC000462235585	267803175	/nfs/dbraw/zinc/80/31/75/267803175.db2.gz	FMEZVPNBSBTDJS-INIZCTEOSA-N	0	3	325.456	3.139	20	30		EGEDHN
C[C@H](NC(=O)NC[C@@H]1N(C)CCCC1(C)C)c1ccc(C#N)cc1	ZINC000447977875	267846474	/nfs/dbraw/zinc/84/64/74/267846474.db2.gz	PTJKXLCIDVOPLW-YOEHRIQHSA-N	0	3	328.460	3.039	20	30		EGEDHN
Cc1cc(NC(=O)[C@H](C)Oc2ccc(C#N)cc2)ccc1CN(C)C	ZINC000458329437	268010766	/nfs/dbraw/zinc/01/07/66/268010766.db2.gz	XNNPVUIFBJIXLE-HNNXBMFYSA-N	0	3	337.423	3.334	20	30		EGEDHN
Cc1ccc(CN(CCN(C)C)C(=O)/C=C\c2ccc(C#N)cc2)o1	ZINC000491304288	268036707	/nfs/dbraw/zinc/03/67/07/268036707.db2.gz	LSPVTPWFFQKYMP-LUAWRHEFSA-N	0	3	337.423	3.063	20	30		EGEDHN
Cc1nc(CNC2CCC(Oc3ncccc3C#N)CC2)cs1	ZINC000527075039	268077034	/nfs/dbraw/zinc/07/70/34/268077034.db2.gz	XBEAWTGHKXLXBV-UHFFFAOYSA-N	0	3	328.441	3.198	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CC=C(c3ccccc3)C2)cc1	ZINC000370027337	268088263	/nfs/dbraw/zinc/08/82/63/268088263.db2.gz	AQYCZPOCDFFCAO-HXUWFJFHSA-N	0	3	327.387	3.166	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCCOC2CCCCCC2)cc1	ZINC000280277263	268091479	/nfs/dbraw/zinc/09/14/79/268091479.db2.gz	FRASBDHCRWGOHK-GOSISDBHSA-N	0	3	339.439	3.096	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCN(Cc3cccc4cccnc43)C2)nc1	ZINC000292258185	268183185	/nfs/dbraw/zinc/18/31/85/268183185.db2.gz	RGTZLYDQRZDJRP-GOSISDBHSA-N	0	3	330.391	3.155	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN2CC[C@@H](Oc3ccc(Cl)cc3)C2)cc1	ZINC000293030066	268214762	/nfs/dbraw/zinc/21/47/62/268214762.db2.gz	LFGFDBPDOISGSZ-RTBURBONSA-N	0	3	342.826	3.398	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)c(OC(F)F)c1	ZINC000451692698	268221918	/nfs/dbraw/zinc/22/19/18/268221918.db2.gz	GELSLJXBWHGGLX-FMKPAKJESA-N	0	3	336.382	3.143	20	30		EGEDHN
CC(C)C[C@@H](CN1CCCC1)NC(=O)NCc1ccc(C#N)c(F)c1	ZINC000455197767	269614691	/nfs/dbraw/zinc/61/46/91/269614691.db2.gz	SGBZQPNTXMYUKK-KRWDZBQOSA-N	0	3	346.450	3.007	20	30		EGEDHN
CN1CCC[C@H](CNC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)C1	ZINC000108339086	275175139	/nfs/dbraw/zinc/17/51/39/275175139.db2.gz	GSKMHWHPKHJVEA-QGZVFWFLSA-N	0	3	349.434	3.422	20	30		EGEDHN
Cc1c(C#N)cccc1NC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1	ZINC000350151265	280203243	/nfs/dbraw/zinc/20/32/43/280203243.db2.gz	HIPAVSRNANNPDU-SFHVURJKSA-N	0	3	340.402	3.430	20	30		EGEDHN
CC[C@@H](NCc1ccc(C#N)cc1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000153655278	307777886	/nfs/dbraw/zinc/77/78/86/307777886.db2.gz	TUFFSOYYLYGQKU-FGZHOGPDSA-N	0	3	349.478	3.327	20	30		EGEDHN
N#Cc1ccccc1CSCCNCc1cccc([N+](=O)[O-])c1	ZINC000170670626	307934041	/nfs/dbraw/zinc/93/40/41/307934041.db2.gz	NIZUNWAKKFNSAI-UHFFFAOYSA-N	0	3	327.409	3.489	20	30		EGEDHN
C[C@@H](N[C@@H](C)c1cccc(C#N)c1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000537293994	314173018	/nfs/dbraw/zinc/17/30/18/314173018.db2.gz	POVZINNLPJRJBO-NJNPRVFISA-N	0	3	349.478	3.498	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@@H](N[C@@H]3CCc4ccccc43)C2=O)cc1	ZINC000541881722	314501064	/nfs/dbraw/zinc/50/10/64/314501064.db2.gz	LYWFRIZKOYSQQN-WOJBJXKFSA-N	0	3	331.419	3.331	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](O)COc2cccc3ccccc32)s1	ZINC000561437725	315762462	/nfs/dbraw/zinc/76/24/62/315762462.db2.gz	WXDFFEZKFISJHH-OAHLLOKOSA-N	0	3	338.432	3.302	20	30		EGEDHN
CCC[C@@H]1CN(c2ccc(C#N)c(N)n2)CCN1Cc1ccccc1	ZINC000565372614	316316192	/nfs/dbraw/zinc/31/61/92/316316192.db2.gz	PPYLTJHCVXIKAS-GOSISDBHSA-N	0	3	335.455	3.026	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCCC[C@H](SCC)C2)CC1	ZINC000112138310	454880958	/nfs/dbraw/zinc/88/09/58/454880958.db2.gz	DQERFPVLMSJGNE-KRWDZBQOSA-N	0	3	339.549	3.344	20	30		EGEDHN
Cc1oc2ccccc2c1CNC[C@@H](O)COc1ccc(C#N)cc1	ZINC000569568977	316932854	/nfs/dbraw/zinc/93/28/54/316932854.db2.gz	NCKCUKBRSXTVLY-MRXNPFEDSA-N	0	3	336.391	3.142	20	30		EGEDHN
CN(Cc1cnc2c(C#N)cnn2c1)CC12CC3CC(CC(C3)C1)C2	ZINC000570280692	317033515	/nfs/dbraw/zinc/03/35/15/317033515.db2.gz	FYPNEKPMVFAUGY-UHFFFAOYSA-N	0	3	335.455	3.249	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCN(Cc3ccc(F)c4cccnc34)C2)nc1	ZINC000571976071	317272548	/nfs/dbraw/zinc/27/25/48/317272548.db2.gz	RLEZJSWWFGZKPT-INIZCTEOSA-N	0	3	348.381	3.294	20	30		EGEDHN
CC[C@@H](NCCC(=O)Nc1cccc(C#N)c1)c1c(C)noc1C	ZINC000182514515	323557648	/nfs/dbraw/zinc/55/76/48/323557648.db2.gz	MNFKWNWJSLARHD-MRXNPFEDSA-N	0	3	326.400	3.233	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)C(=O)C1CCN(C2CC2)CC1	ZINC000195341613	323884269	/nfs/dbraw/zinc/88/42/69/323884269.db2.gz	HWBJAAJQNYOMJN-UHFFFAOYSA-N	0	3	325.456	3.171	20	30		EGEDHN
C[C@H]1C[C@H](Nc2cc(Br)c(C#N)cc2F)CCN1C	ZINC000388242093	324272902	/nfs/dbraw/zinc/27/29/02/324272902.db2.gz	VPPWFSWDDQNDOE-GXSJLCMTSA-N	0	3	326.213	3.354	20	30		EGEDHN
CN(Cc1ccc(-c2ccccc2C#N)cc1)[C@H]1CCC(=O)N(C)C1	ZINC000579369375	325100762	/nfs/dbraw/zinc/10/07/62/325100762.db2.gz	AOEQQRRMAMCIAK-IBGZPJMESA-N	0	3	333.435	3.278	20	30		EGEDHN
Cc1ccc(Cl)c(OC[C@H](O)CNCc2ccc(C#N)cc2)c1	ZINC000580183041	325214483	/nfs/dbraw/zinc/21/44/83/325214483.db2.gz	PDIWZFPLJJBXIP-MRXNPFEDSA-N	0	3	330.815	3.050	20	30		EGEDHN
CC1CCC(N2CCN(C(=O)NCc3ccc(C#N)s3)CC2)CC1	ZINC000582234792	325425021	/nfs/dbraw/zinc/42/50/21/325425021.db2.gz	WUVDUTDWWAFDGW-UHFFFAOYSA-N	0	3	346.500	3.026	20	30		EGEDHN
CC(C)N(Cc1cc(Br)ccc1F)C(=O)C(C)C#N	ZINC000344958409	456877951	/nfs/dbraw/zinc/87/79/51/456877951.db2.gz	WRXLWYWFUINRJX-SNVBAGLBSA-N	0	3	327.197	3.485	20	30		EGEDHN
N#CCCCOc1cccc(CN[C@@H]2CCN(CC(F)(F)F)C2)c1	ZINC000237850411	455226176	/nfs/dbraw/zinc/22/61/76/455226176.db2.gz	PRQLIIFAOLYKMP-OAHLLOKOSA-N	0	3	341.377	3.095	20	30		EGEDHN
N#Cc1ccc(CNc2ccccc2CN2CCC(CO)CC2)cc1	ZINC000238170147	455257249	/nfs/dbraw/zinc/25/72/49/455257249.db2.gz	AHLPIEHXEVKJRH-UHFFFAOYSA-N	0	3	335.451	3.375	20	30		EGEDHN
CCN(CCC#N)C(=O)CN[C@@H](C)c1ccc(-c2ccncc2)cc1	ZINC000180885585	455260596	/nfs/dbraw/zinc/26/05/96/455260596.db2.gz	IIJPSZLZMQTRIO-INIZCTEOSA-N	0	3	336.439	3.161	20	30		EGEDHN
C=CCOc1c(Cl)cc(CNC2(CO)CCCC2)cc1OC	ZINC000623442540	460553187	/nfs/dbraw/zinc/55/31/87/460553187.db2.gz	RNMBZCLEOCLOOL-UHFFFAOYSA-N	0	3	325.836	3.308	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@@H](COC)C2CC2)cc1OC	ZINC000623470707	460567007	/nfs/dbraw/zinc/56/70/07/460567007.db2.gz	XSZJGJFRISFXLO-HNNXBMFYSA-N	0	3	325.836	3.428	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)N2CCC[C@](C)(C#N)C2)N(C)C)cc1	ZINC000612357988	460604779	/nfs/dbraw/zinc/60/47/79/460604779.db2.gz	YXALQNOFXPQWSZ-UYAOXDASSA-N	0	3	342.487	3.187	20	30		EGEDHN
Cc1ccccc1OCCN(C)CCC(=O)Nc1sccc1C#N	ZINC000021672881	453679748	/nfs/dbraw/zinc/67/97/48/453679748.db2.gz	GWLNFFZJWSBDAY-UHFFFAOYSA-N	0	3	343.452	3.268	20	30		EGEDHN
COc1ccc(C)cc1CNC1CCN(c2ccc(C#N)cn2)CC1	ZINC000067011047	453894069	/nfs/dbraw/zinc/89/40/69/453894069.db2.gz	LSYUWMIBOGLPFJ-UHFFFAOYSA-N	0	3	336.439	3.029	20	30		EGEDHN
C[C@H](NCc1cc(C#N)n(C)c1)c1ccc(NC(=O)NC2CC2)cc1	ZINC000190776146	455381190	/nfs/dbraw/zinc/38/11/90/455381190.db2.gz	FPXZCENCUCJLFW-ZDUSSCGKSA-N	0	3	337.427	3.031	20	30		EGEDHN
N#CC1(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)CCCC1	ZINC000067361617	453924990	/nfs/dbraw/zinc/92/49/90/453924990.db2.gz	FXVFMIDICVNAOH-SFHVURJKSA-N	0	3	325.456	3.099	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@](C)(NCc1cc(C#N)cs1)C1CC1	ZINC000083456037	453949091	/nfs/dbraw/zinc/94/90/91/453949091.db2.gz	CTHFSUUIJPGMEO-QGZVFWFLSA-N	0	3	335.473	3.403	20	30		EGEDHN
N#Cc1csc(C(=O)NC[C@H]2CCCN(Cc3cccs3)C2)c1	ZINC000084183882	453975888	/nfs/dbraw/zinc/97/58/88/453975888.db2.gz	OYYUUKBMMDHXNT-CYBMUJFWSA-N	0	3	345.493	3.323	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN(Cc1ccccc1)[C@@H](C)C1CC1	ZINC000076944507	454051730	/nfs/dbraw/zinc/05/17/30/454051730.db2.gz	BVONDDCSZAWGRY-SJORKVTESA-N	0	3	327.472	3.295	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](C)c2ccc(F)cc2Cl)CC1	ZINC000076978050	454055901	/nfs/dbraw/zinc/05/59/01/454055901.db2.gz	VTQZIYVJEZPVGR-GFCCVEGCSA-N	0	3	339.842	3.490	20	30		EGEDHN
COCCN(CCOc1ccc(F)cc1)Cc1cccc(C#N)c1	ZINC000069071826	454077434	/nfs/dbraw/zinc/07/74/34/454077434.db2.gz	FOLNLPYGJFTCND-UHFFFAOYSA-N	0	3	328.387	3.225	20	30		EGEDHN
N#Cc1ccc(NC(=O)NC2CCN(Cc3ccccc3)CC2)cc1	ZINC000045027081	454133620	/nfs/dbraw/zinc/13/36/20/454133620.db2.gz	BCMHVNXBJGOREQ-UHFFFAOYSA-N	0	3	334.423	3.344	20	30		EGEDHN
C#CCN1CCC(C(=O)NCC(c2ccccc2)c2ccccc2)CC1	ZINC000058226445	454173706	/nfs/dbraw/zinc/17/37/06/454173706.db2.gz	GJTOCYQXYWRWBZ-UHFFFAOYSA-N	0	3	346.474	3.280	20	30		EGEDHN
C[C@@H](N[C@H]1CC(C)(C)OC1(C)C)C(=O)N(C)C1(C#N)CCC(C)CC1	ZINC000119693276	454213106	/nfs/dbraw/zinc/21/31/06/454213106.db2.gz	IUZUCHBEMWILJW-SIRSKZSMSA-N	0	3	349.519	3.241	20	30		EGEDHN
C#CCOc1ccccc1CNC1CCN([C@@H](C)c2ccncc2)CC1	ZINC000131112761	454236769	/nfs/dbraw/zinc/23/67/69/454236769.db2.gz	ZXRDYPNZZZETIJ-SFHVURJKSA-N	0	3	349.478	3.409	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cccc(CC#N)c1	ZINC000120071847	454255113	/nfs/dbraw/zinc/25/51/13/454255113.db2.gz	JXUJLFDZNSBIJH-JXFKEZNVSA-N	0	3	333.435	3.003	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN2CCC[C@H](Cc3nccn3C)C2)cc1	ZINC000184729949	455438260	/nfs/dbraw/zinc/43/82/60/455438260.db2.gz	YHKQNHCUNXMEMP-FUHWJXTLSA-N	0	3	338.455	3.166	20	30		EGEDHN
C[C@H]1CN(CCC(=O)Nc2sc3c(c2C#N)CCC3)C[C@H](C)S1	ZINC000072770107	454337376	/nfs/dbraw/zinc/33/73/76/454337376.db2.gz	ZQPBFPGQSXLJSB-RYUDHWBXSA-N	0	3	349.525	3.263	20	30		EGEDHN
N#CCOc1cccc(NC(=O)c2ccc(CN3CCCC3)cc2)c1	ZINC000079213829	454381536	/nfs/dbraw/zinc/38/15/36/454381536.db2.gz	VTEPEOQZTPUCNY-UHFFFAOYSA-N	0	3	335.407	3.437	20	30		EGEDHN
COCCOc1ccc([C@@H](C)NCc2cccc(C#N)c2)cc1OC	ZINC000047825595	454410415	/nfs/dbraw/zinc/41/04/15/454410415.db2.gz	VVCONDAFARRVIQ-OAHLLOKOSA-N	0	3	340.423	3.443	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2cccc(C#N)c2)CCN1Cc1ccccc1	ZINC000079554893	454438526	/nfs/dbraw/zinc/43/85/26/454438526.db2.gz	OPFOTULBIJBOER-UZLBHIALSA-N	0	3	333.435	3.341	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCC[C@H]2c2cccc(C)n2)CC1	ZINC000121878911	454488842	/nfs/dbraw/zinc/48/88/42/454488842.db2.gz	OZUXUCXULFABFG-IBGZPJMESA-N	0	3	342.487	3.277	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(Oc3ccccc3)cn2)CC1	ZINC000103124037	454538893	/nfs/dbraw/zinc/53/88/93/454538893.db2.gz	NRWWIYOTWKCDHL-UHFFFAOYSA-N	0	3	335.407	3.158	20	30		EGEDHN
C=C(C)COc1cc(CN[C@@H]2CC(=O)N(C(C)(C)C)C2)ccc1OC	ZINC000080235778	454553631	/nfs/dbraw/zinc/55/36/31/454553631.db2.gz	AIQZMTIJKJCFTD-MRXNPFEDSA-N	0	3	346.471	3.139	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)c1ccc(F)cc1	ZINC000103504653	454561435	/nfs/dbraw/zinc/56/14/35/454561435.db2.gz	LXAALJMFOKJKPX-AWEZNQCLSA-N	0	3	326.327	3.186	20	30		EGEDHN
C=CCNC(=O)NC(=O)[C@@H](C)N[C@@H](C)c1ccc(SC(C)C)cc1	ZINC000103499427	454561673	/nfs/dbraw/zinc/56/16/73/454561673.db2.gz	HJNGVTAKXAPROF-UONOGXRCSA-N	0	3	349.500	3.238	20	30		EGEDHN
C=CCOCCCC(=O)Nc1ccc(OCCN(C)C)c(Cl)c1	ZINC000080345386	454569351	/nfs/dbraw/zinc/56/93/51/454569351.db2.gz	REIOYRJAEJQXOZ-UHFFFAOYSA-N	0	3	340.851	3.202	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)OC(C)(C)C)CCN1CCCSCC#N	ZINC000134646880	454574085	/nfs/dbraw/zinc/57/40/85/454574085.db2.gz	SEDRHOPGNYLGKS-KBPBESRZSA-N	0	3	327.494	3.011	20	30		EGEDHN
CC(C)c1csc(C(C#N)C(=O)c2ccc(NC(N)=O)cc2)n1	ZINC000080450965	454583596	/nfs/dbraw/zinc/58/35/96/454583596.db2.gz	VGXOGVKYOJTLIO-GFCCVEGCSA-N	0	3	328.397	3.247	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)C2(C#N)CCCCC2)CN1Cc1ccccc1	ZINC000134924388	454609183	/nfs/dbraw/zinc/60/91/83/454609183.db2.gz	VKKPRUKWGOQETM-AEFFLSMTSA-N	0	3	325.456	3.240	20	30		EGEDHN
C#CCCOc1ccc(CN2CCC[C@H](CNC(=O)C(C)C)C2)cc1	ZINC000092706344	454614480	/nfs/dbraw/zinc/61/44/80/454614480.db2.gz	MJGUALOKMJUYNW-LJQANCHMSA-N	0	3	342.483	3.073	20	30		EGEDHN
CCc1ccc(C(=O)N(CCN(C)C)Cc2cccc(C#N)c2)cc1	ZINC000065931239	454641037	/nfs/dbraw/zinc/64/10/37/454641037.db2.gz	IRZDHANMDDVJOW-UHFFFAOYSA-N	0	3	335.451	3.325	20	30		EGEDHN
CN(C)CCN(C(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1)C1CCCCC1	ZINC000080902746	454644664	/nfs/dbraw/zinc/64/46/64/454644664.db2.gz	DUAAHDLEVISKOM-VQTJNVASSA-N	0	3	339.483	3.385	20	30		EGEDHN
CCN(C[C@H](O)COc1ccc(C#N)cc1)[C@@H](C)c1cccc(O)c1	ZINC000080932387	454649580	/nfs/dbraw/zinc/64/95/80/454649580.db2.gz	MEJCUXKACUMAJP-KXBFYZLASA-N	0	3	340.423	3.087	20	30		EGEDHN
Cc1ccccc1CN1CCC(Nc2nnc(C)c(C)c2C#N)CC1	ZINC000052406935	454670672	/nfs/dbraw/zinc/67/06/72/454670672.db2.gz	BHRWLYZUHFOYKH-UHFFFAOYSA-N	0	3	335.455	3.350	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCCOc2cccc(F)c2)CC1	ZINC000106034863	454674874	/nfs/dbraw/zinc/67/48/74/454674874.db2.gz	BZIXHADNPDYBKB-UHFFFAOYSA-N	0	3	334.435	3.141	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc(OCC)c(F)c2)CC1	ZINC000106322668	454690609	/nfs/dbraw/zinc/69/06/09/454690609.db2.gz	CNUBTCHLYZMMCP-UHFFFAOYSA-N	0	3	335.423	3.386	20	30		EGEDHN
C=C(C)COc1cc(CN2CCC(OCCOC)CC2)ccc1OC	ZINC000093339744	454704606	/nfs/dbraw/zinc/70/46/06/454704606.db2.gz	KAHYBWQJSFTWKD-UHFFFAOYSA-N	0	3	349.471	3.278	20	30		EGEDHN
C=CCc1cc(CN2CCC(OCCCOC)CC2)cc(OC)c1O	ZINC000093561376	454721170	/nfs/dbraw/zinc/72/11/70/454721170.db2.gz	BGCMYSUHOJSOGC-UHFFFAOYSA-N	0	3	349.471	3.147	20	30		EGEDHN
C#CCSCCNCc1ccc(OCc2ccncc2)c(OC)c1	ZINC000152952652	454745372	/nfs/dbraw/zinc/74/53/72/454745372.db2.gz	ZOJKGKLEWJTIKA-UHFFFAOYSA-N	0	3	342.464	3.125	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC[C@@H]1CCCN(Cc2cccs2)C1	ZINC000139955310	454813942	/nfs/dbraw/zinc/81/39/42/454813942.db2.gz	FPLQYTCCQJDSBM-CVEARBPZSA-N	0	3	336.501	3.058	20	30		EGEDHN
C=CC1CCN(C(=O)CCCN2CCN(c3ccccc3)CC2)CC1	ZINC000110366717	454845239	/nfs/dbraw/zinc/84/52/39/454845239.db2.gz	XGXQBNNMLARYBZ-UHFFFAOYSA-N	0	3	341.499	3.013	20	30		EGEDHN
CCN(CCC#N)C(=O)[C@H](C)N1CCC(Cc2ccccc2)CC1	ZINC000111661790	454870856	/nfs/dbraw/zinc/87/08/56/454870856.db2.gz	XDKGNMLXBBQGGT-KRWDZBQOSA-N	0	3	327.472	3.092	20	30		EGEDHN
CCCC1(CNC(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)CC1	ZINC000154177253	454871715	/nfs/dbraw/zinc/87/17/15/454871715.db2.gz	CVPKVJXJYWLOCJ-UHFFFAOYSA-N	0	3	342.487	3.212	20	30		EGEDHN
C[C@H](NCC1(c2c(F)cccc2F)CCCC1)C(=O)N(C)CCC#N	ZINC000112539667	454889330	/nfs/dbraw/zinc/88/93/30/454889330.db2.gz	CIDLYSBPLPFIPH-AWEZNQCLSA-N	0	3	349.425	3.127	20	30		EGEDHN
C=C(Br)CNC1C[C@H]2CC[C@@H](C1)N2C(=O)OC(C)(C)C	ZINC000165890856	454905793	/nfs/dbraw/zinc/90/57/93/454905793.db2.gz	CWLQANUMSMIUOQ-YHWZYXNKSA-N	0	3	345.281	3.415	20	30		EGEDHN
CCC1(CC)[C@H](OC)C[C@@H]1N[C@@H](C)C(=O)Nc1ccccc1C#N	ZINC000178363550	454952105	/nfs/dbraw/zinc/95/21/05/454952105.db2.gz	YGECSTIFTRQMNG-RRQGHBQHSA-N	0	3	329.444	3.069	20	30		EGEDHN
CCc1nn(C)c(CC)c1CNCCSCc1ccccc1C#N	ZINC000179057084	455003317	/nfs/dbraw/zinc/00/33/17/455003317.db2.gz	YKVDVYQAUGAVFP-UHFFFAOYSA-N	0	3	342.512	3.440	20	30		EGEDHN
Cc1cc(C)n(Cc2cccc(C(=O)C(C#N)c3ccccn3)c2)n1	ZINC000155462518	455005011	/nfs/dbraw/zinc/00/50/11/455005011.db2.gz	YTUGMVJYRNLRAU-GOSISDBHSA-N	0	3	330.391	3.433	20	30		EGEDHN
CCC(CC)n1nccc1C(=O)C(C#N)c1nnc2n1CCCCC2	ZINC000151734939	455023418	/nfs/dbraw/zinc/02/34/18/455023418.db2.gz	LQHMNLGDHWKVJA-AWEZNQCLSA-N	0	3	340.431	3.052	20	30		EGEDHN
COc1ccc([C@@H](NCC(=O)Nc2ccc(C#N)cc2)C(C)C)cc1	ZINC000171124626	455033627	/nfs/dbraw/zinc/03/36/27/455033627.db2.gz	CPHKTCDLHAHBPA-FQEVSTJZSA-N	0	3	337.423	3.492	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC2(c3ccc(F)cc3F)CCC2)CC1	ZINC000179575434	455059675	/nfs/dbraw/zinc/05/96/75/455059675.db2.gz	DAKVUBRYHQDIQR-UHFFFAOYSA-N	0	3	349.425	3.294	20	30		EGEDHN
N#CC(C(=O)c1cccc2[nH]c(=O)oc21)c1ccc(C(F)(F)F)cn1	ZINC000152078035	455069792	/nfs/dbraw/zinc/06/97/92/455069792.db2.gz	RWBZJQOIMOTEPC-SNVBAGLBSA-N	0	3	347.252	3.025	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cc(C#N)ccc2OCC)CC1	ZINC000171586526	455079399	/nfs/dbraw/zinc/07/93/99/455079399.db2.gz	GGOPEFVHAHKDTL-UHFFFAOYSA-N	0	3	342.443	3.119	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2nc(-c3ccco3)sc2C)CC1	ZINC000171719891	455088754	/nfs/dbraw/zinc/08/87/54/455088754.db2.gz	IZQAGGPFGVFIEQ-UHFFFAOYSA-N	0	3	331.441	3.092	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCCCCCc2ccccc2)CC1	ZINC000171733302	455090118	/nfs/dbraw/zinc/09/01/18/455090118.db2.gz	PFPQNOYRQBWKCP-UHFFFAOYSA-N	0	3	329.488	3.349	20	30		EGEDHN
CC1CCN([C@H](CNC(=O)NCCCCC#N)c2ccccc2)CC1	ZINC000171744088	455091083	/nfs/dbraw/zinc/09/10/83/455091083.db2.gz	ARFZWJIIIZUDPY-LJQANCHMSA-N	0	3	342.487	3.453	20	30		EGEDHN
C=CCSCCNCc1cn(CCC#N)nc1-c1ccccc1	ZINC000172119190	455124702	/nfs/dbraw/zinc/12/47/02/455124702.db2.gz	RGDRRBQFGSWIKP-UHFFFAOYSA-N	0	3	326.469	3.473	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccccc2O[C@H](C)C#N)CC1	ZINC000180073714	455127486	/nfs/dbraw/zinc/12/74/86/455127486.db2.gz	XYBWBSXPVFECGT-OAHLLOKOSA-N	0	3	342.443	3.139	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cncnc1C(C)C)C(C)C	ZINC000263966901	455174147	/nfs/dbraw/zinc/17/41/47/455174147.db2.gz	SJPRQQXARPVVBF-KRWDZBQOSA-N	0	3	330.476	3.028	20	30		EGEDHN
CCC(CC)N(CCOC)CC(=O)N(CCC#N)c1ccccc1	ZINC000263985051	455177262	/nfs/dbraw/zinc/17/72/62/455177262.db2.gz	HSKYUHLBYBEOLV-UHFFFAOYSA-N	0	3	331.460	3.070	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)C[C@H](C)c2ccccc2)CC1	ZINC000264431339	455211942	/nfs/dbraw/zinc/21/19/42/455211942.db2.gz	ZTTPYTXPPXDQAZ-KRWDZBQOSA-N	0	3	329.488	3.472	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@@H](C)N[C@@H](CC)c1ccc2c(c1)OCCO2	ZINC000180642608	455216314	/nfs/dbraw/zinc/21/63/14/455216314.db2.gz	ZNYIEYFHSLQYQV-WBVHZDCISA-N	0	3	344.455	3.088	20	30		EGEDHN
CC(C)(C)[C@H](NCC(=O)N[C@@](C)(C#N)C1CC1)c1cccc(F)c1	ZINC000181057393	455281107	/nfs/dbraw/zinc/28/11/07/455281107.db2.gz	ANKJQJJBKWOBIA-MJGOQNOKSA-N	0	3	331.435	3.311	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(OC)cc2OCC(C)C)CC1	ZINC000190313795	455295572	/nfs/dbraw/zinc/29/55/72/455295572.db2.gz	ISBNTJWFYNIHTP-UHFFFAOYSA-N	0	3	346.471	3.110	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1	ZINC000173507323	455297169	/nfs/dbraw/zinc/29/71/69/455297169.db2.gz	QYNODRJOMZPDCU-QZTJIDSGSA-N	0	3	330.472	3.091	20	30		EGEDHN
Cc1ccc([C@H](CN[C@H](C)c2ccc(C#N)cc2)N2CCOCC2)o1	ZINC000181423863	455333191	/nfs/dbraw/zinc/33/31/91/455333191.db2.gz	CEQGYJHRCOSARS-APWZRJJASA-N	0	3	339.439	3.184	20	30		EGEDHN
CC[C@@H](CNC(=O)c1ccccc1CC#N)N1CCc2ccccc2C1	ZINC000600994683	460668866	/nfs/dbraw/zinc/66/88/66/460668866.db2.gz	FUKJTYWYVCOBME-FQEVSTJZSA-N	0	3	347.462	3.319	20	30		EGEDHN
CCOC(=O)CC1CCN(Cc2ccc(N(C)CCC#N)cc2)CC1	ZINC000159088064	455350866	/nfs/dbraw/zinc/35/08/66/455350866.db2.gz	WYSWELMNUTVGON-UHFFFAOYSA-N	0	3	343.471	3.202	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cc(F)c(SC)c(F)c2)CC1	ZINC000184404294	455377630	/nfs/dbraw/zinc/37/76/30/455377630.db2.gz	DCDHVBSLFCEPPG-UHFFFAOYSA-N	0	3	341.427	3.459	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC[C@@H](c3c(F)cccc3F)C2)CC1	ZINC000184459404	455384071	/nfs/dbraw/zinc/38/40/71/455384071.db2.gz	HZITWPXNNUSVNS-CQSZACIVSA-N	0	3	349.425	3.114	20	30		EGEDHN
CC[C@@H]1CN([C@@H](C)C(=O)N(C)CCC#N)CC[C@@H]1c1ccccc1	ZINC000174888462	455417216	/nfs/dbraw/zinc/41/72/16/455417216.db2.gz	XNPINOIYKCZAAH-SCTDSRPQSA-N	0	3	327.472	3.263	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN2CCSC3(CCCCC3)C2)cc1	ZINC000175968274	455521748	/nfs/dbraw/zinc/52/17/48/455521748.db2.gz	YCDXHMWWGKWSAS-QGZVFWFLSA-N	0	3	346.496	3.050	20	30		EGEDHN
C[C@@H]1CN(CC(=O)N(CCC#N)c2ccccc2)[C@H]2CCCC[C@H]12	ZINC000182489800	455524324	/nfs/dbraw/zinc/52/43/24/455524324.db2.gz	QGNFIPSTDRKGFB-QRQLOZEOSA-N	0	3	325.456	3.444	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN1CCC[C@H]1c1cccc(C)c1C	ZINC000246788665	455525458	/nfs/dbraw/zinc/52/54/58/455525458.db2.gz	OYEGHWCUZBOADB-KXBFYZLASA-N	0	3	327.472	3.449	20	30		EGEDHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)c1c(F)cc(C#N)cc1F	ZINC000182538523	455535874	/nfs/dbraw/zinc/53/58/74/455535874.db2.gz	LAYYBGJOBLPFOB-CYBMUJFWSA-N	0	3	343.377	3.087	20	30		EGEDHN
COc1ccc(CN2CCC(CNc3ccc(C#N)nc3)CC2)cc1	ZINC000267339966	455541357	/nfs/dbraw/zinc/54/13/57/455541357.db2.gz	DKWKEBXVKIYNOU-UHFFFAOYSA-N	0	3	336.439	3.286	20	30		EGEDHN
C#CCC(C)(C)C(=O)Nc1ccc(CCN2CCSCC2)cc1	ZINC000185374128	455550616	/nfs/dbraw/zinc/55/06/16/455550616.db2.gz	ANWUJASRLFDDBD-UHFFFAOYSA-N	0	3	330.497	3.266	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)c1ccoc1Cl	ZINC000192311413	455589994	/nfs/dbraw/zinc/58/99/94/455589994.db2.gz	QPNQVABHEZJIIW-UHFFFAOYSA-N	0	3	331.803	3.009	20	30		EGEDHN
C[C@@H]1CN(Cc2cccc(CN[C@@H]3CCC[C@H](C#N)C3)c2)CCO1	ZINC000185798033	455624482	/nfs/dbraw/zinc/62/44/82/455624482.db2.gz	PHJDQHIGWRDRNY-FUHIMQAGSA-N	0	3	327.472	3.079	20	30		EGEDHN
CCN1CCN(c2ccc(CN[C@@H]3CCC[C@H](C#N)C3)cc2F)CC1	ZINC000185817471	455628246	/nfs/dbraw/zinc/62/82/46/455628246.db2.gz	FIRRJMQXPVNOFG-FUHWJXTLSA-N	0	3	344.478	3.140	20	30		EGEDHN
COc1ccccc1C(=O)C(C(=S)[N-]C1CCC1)[n+]1ccccc1	ZINC000292381373	455646930	/nfs/dbraw/zinc/64/69/30/455646930.db2.gz	ULVHPZJKMFPHJM-UHFFFAOYSA-O	0	3	341.456	3.064	20	30		EGEDHN
CSC[C@@H]1CCCN([C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)C1	ZINC000292449226	455665589	/nfs/dbraw/zinc/66/55/89/455665589.db2.gz	PFOKTYDQDURTCU-SJLPKXTDSA-N	0	3	343.496	3.129	20	30		EGEDHN
C=CCC[C@@H](NC(=O)N1CC[C@]2(CCN(C)C2)C1)c1ccccc1	ZINC000292509008	455683166	/nfs/dbraw/zinc/68/31/66/455683166.db2.gz	HLZVEHFEAXKEGR-QUCCMNQESA-N	0	3	327.472	3.431	20	30		EGEDHN
N#Cc1ccnc(NC[C@@H](c2cccs2)N2CCCC2)c1[N+](=O)[O-]	ZINC000268457031	455687716	/nfs/dbraw/zinc/68/77/16/455687716.db2.gz	GYFQXDCPQJJFLG-ZDUSSCGKSA-N	0	3	343.412	3.172	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCC(C(=O)N2CCC[C@H](C)C2)CC1	ZINC000186170056	455708546	/nfs/dbraw/zinc/70/85/46/455708546.db2.gz	NQUQJSWUEISKMD-INIZCTEOSA-N	0	3	339.483	3.337	20	30		EGEDHN
COc1ccc(CN[C@H]2CCCc3cn[nH]c32)cc1OCCCC#N	ZINC000268802226	455714781	/nfs/dbraw/zinc/71/47/81/455714781.db2.gz	BKENLSSDFYAPIW-INIZCTEOSA-N	0	3	340.427	3.268	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN(C)C[C@H](C)c1nccs1	ZINC000248440672	455715882	/nfs/dbraw/zinc/71/58/82/455715882.db2.gz	DGGRHRRJRPTYPQ-DOTOQJQBSA-N	0	3	346.496	3.347	20	30		EGEDHN
C[C@@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1ccc(NC(N)=O)cc1	ZINC000193024421	455735806	/nfs/dbraw/zinc/73/58/06/455735806.db2.gz	NKYMJUYSPAKRND-KGLIPLIRSA-N	0	3	338.411	3.491	20	30		EGEDHN
COC(=O)COc1ccc([C@@H](C)NCc2ccc(C#N)cc2C)cc1	ZINC000186333506	455746380	/nfs/dbraw/zinc/74/63/80/455746380.db2.gz	UYWRHEQMZIDZPN-OAHLLOKOSA-N	0	3	338.407	3.269	20	30		EGEDHN
C=C(C)COc1cc(CN[C@@H]2CC[C@H](C(=O)OC)C2)ccc1OC	ZINC000193501571	455762698	/nfs/dbraw/zinc/76/26/98/455762698.db2.gz	XJXHYYFFJWGCHB-JKSUJKDBSA-N	0	3	333.428	3.081	20	30		EGEDHN
C=CCC(C)(C)CNCc1ncc(I)s1	ZINC000293083593	455773972	/nfs/dbraw/zinc/77/39/72/455773972.db2.gz	WKYSOSDVJHGBKC-UHFFFAOYSA-N	0	3	336.242	3.440	20	30		EGEDHN
COC(=O)[C@@H]1CN([C@H]2CC[C@H](C#N)C2)C[C@H]1c1ccc(Cl)cc1	ZINC000293567538	455791646	/nfs/dbraw/zinc/79/16/46/455791646.db2.gz	MROYVYXLOULZCZ-OSMBCOQSSA-N	0	3	332.831	3.221	20	30		EGEDHN
CC[C@@H](NC[C@@H](O)CN1CCc2ccccc2C1)c1ccc(C#N)cc1	ZINC000278281615	455805479	/nfs/dbraw/zinc/80/54/79/455805479.db2.gz	QCRMQZYSWMSVIX-FGZHOGPDSA-N	0	3	349.478	3.018	20	30		EGEDHN
N#C[C@]1(C(=O)NC[C@H]2CCCN2Cc2ccccc2)CC12CCCC2	ZINC000295062180	455837582	/nfs/dbraw/zinc/83/75/82/455837582.db2.gz	KTVXQAIRVIPFFV-NQIIRXRSSA-N	0	3	337.467	3.241	20	30		EGEDHN
COC[C@]1(C)CCN(Cc2cn(CCC#N)nc2-c2ccccc2)C1	ZINC000295135170	455839973	/nfs/dbraw/zinc/83/99/73/455839973.db2.gz	PCFCGLKGYQCJQY-HXUWFJFHSA-N	0	3	338.455	3.322	20	30		EGEDHN
CN(C[C@H](O)COc1ccccc1C(F)(F)F)[C@H]1CC[C@H](C#N)C1	ZINC000278571796	455840580	/nfs/dbraw/zinc/84/05/80/455840580.db2.gz	JHRCDEMDAGPFLW-IHRRRGAJSA-N	0	3	342.361	3.069	20	30		EGEDHN
C[C@@H]1[C@@H](NC(=O)[C@@]2(C#N)CC23CCCC3)CCN1Cc1ccccc1	ZINC000295302354	455845032	/nfs/dbraw/zinc/84/50/32/455845032.db2.gz	KHNKMOHARWHRRL-MMOPVJDHSA-N	0	3	337.467	3.240	20	30		EGEDHN
CCCCO[C@@H]1C[C@H](N[C@@H](C)C(=O)NC2(C#N)CCCCC2)C1(C)C	ZINC000253430377	455847829	/nfs/dbraw/zinc/84/78/29/455847829.db2.gz	QMAXBBCALVFHAA-YESZJQIVSA-N	0	3	349.519	3.291	20	30		EGEDHN
CC[C@H](N[C@@H]1CCN(c2ccccc2OC)C1=O)c1ccc(C#N)cc1	ZINC000278891940	455851639	/nfs/dbraw/zinc/85/16/39/455851639.db2.gz	YRIHGNDSSWLYFT-ZWKOTPCHSA-N	0	3	349.434	3.413	20	30		EGEDHN
C(=N/OCCCC1CCOCC1)\c1ccc(N2CCOCC2)cc1	ZINC000279697998	455871307	/nfs/dbraw/zinc/87/13/07/455871307.db2.gz	GQHXEMPTBSNAQX-CAPFRKAQSA-N	0	3	332.444	3.081	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC=C(CCNCc2ccc(C#N)o2)CC1	ZINC000279931708	455877774	/nfs/dbraw/zinc/87/77/74/455877774.db2.gz	YBWLCFCJJBNLJC-UHFFFAOYSA-N	0	3	331.416	3.198	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)C(C)(C)C1CCOCC1)C(C)C	ZINC000280003645	455880303	/nfs/dbraw/zinc/88/03/03/455880303.db2.gz	IBVCNRUGIKDCEH-SFHVURJKSA-N	0	3	336.520	3.254	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1ccc(CC#N)cc1)C(C)C	ZINC000270454874	455959488	/nfs/dbraw/zinc/95/94/88/455959488.db2.gz	VNASDBFNBDSQNN-IBGZPJMESA-N	0	3	325.456	3.181	20	30		EGEDHN
Cn1cc(CN[C@H](CNC(=O)OC(C)(C)C)C2CCCC2)cc1C#N	ZINC000195457955	455964163	/nfs/dbraw/zinc/96/41/63/455964163.db2.gz	SAZVMCIOQCXPTM-QGZVFWFLSA-N	0	3	346.475	3.070	20	30		EGEDHN
C[C@@H](CNC(=O)c1cc(C#N)ccc1Cl)N(C)Cc1ccccc1	ZINC000286141396	455985698	/nfs/dbraw/zinc/98/56/98/455985698.db2.gz	VOAXRNOCXMCSNT-AWEZNQCLSA-N	0	3	341.842	3.462	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@@H]1CNCc1cccc(OC)c1OC(F)F	ZINC000280724706	456039242	/nfs/dbraw/zinc/03/92/42/456039242.db2.gz	VGNPGTUSVLDGTA-UKRRQHHQSA-N	0	3	327.371	3.367	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000280736160	456041355	/nfs/dbraw/zinc/04/13/55/456041355.db2.gz	WJMPYXXSCNJTBF-KUHUBIRLSA-N	0	3	337.423	3.100	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)N(CCCc1ccccc1)CCN(C)C	ZINC000280760265	456046557	/nfs/dbraw/zinc/04/65/57/456046557.db2.gz	NFCQFFAQEXSYKJ-UHFFFAOYSA-N	0	3	339.439	3.096	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N2C[C@H](C)CC2(C)C)cc1	ZINC000287376115	456068369	/nfs/dbraw/zinc/06/83/69/456068369.db2.gz	RFKUHMLYZSQOJW-OLZOCXBDSA-N	0	3	349.456	3.025	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N(C)C2CCCCC2)cc1	ZINC000287441598	456069550	/nfs/dbraw/zinc/06/95/50/456069550.db2.gz	WGIMLIWLNHEKNB-CYBMUJFWSA-N	0	3	349.456	3.169	20	30		EGEDHN
Cc1cccc(N2CCN(CCCCNc3cccc(C#N)n3)CC2)c1	ZINC000301287246	456081707	/nfs/dbraw/zinc/08/17/07/456081707.db2.gz	RIPTZKNCSDEQMG-UHFFFAOYSA-N	0	3	349.482	3.276	20	30		EGEDHN
CC(C)(C)OC(=O)N1C[C@@H]2CCN(Cc3ccc(C#N)cc3)C[C@H]2C1	ZINC000289461463	456126245	/nfs/dbraw/zinc/12/62/45/456126245.db2.gz	GNGFWBVESIRDJJ-ROUUACIJSA-N	0	3	341.455	3.247	20	30		EGEDHN
Cc1cnccc1OC1CCN(Cc2ccc(OCC#N)cc2)CC1	ZINC000289460199	456126280	/nfs/dbraw/zinc/12/62/80/456126280.db2.gz	VVUORUIHLLEFFQ-UHFFFAOYSA-N	0	3	337.423	3.336	20	30		EGEDHN
C=CCSCCNCc1cc(OC)c(OCC(F)F)c(OC)c1	ZINC000289623161	456133363	/nfs/dbraw/zinc/13/33/63/456133363.db2.gz	FSQGXUPXBHVUMJ-UHFFFAOYSA-N	0	3	347.427	3.357	20	30		EGEDHN
COc1ccc(CN[C@]2(C)CCO[C@H]2C2CC2)cc1OCCCC#N	ZINC000273046126	456159309	/nfs/dbraw/zinc/15/93/09/456159309.db2.gz	BNGJEMBDZZZMAT-VQTJNVASSA-N	0	3	344.455	3.425	20	30		EGEDHN
CCN(CC(=O)N(CCC#N)c1ccccc1)[C@H]1CCOC(C)(C)C1	ZINC000289947066	456191468	/nfs/dbraw/zinc/19/14/68/456191468.db2.gz	VUFMDPDZFKLVFY-SFHVURJKSA-N	0	3	343.471	3.213	20	30		EGEDHN
COc1cccc([C@H](CNc2ncc(C#N)cc2Cl)N(C)C)c1	ZINC000263741649	456208940	/nfs/dbraw/zinc/20/89/40/456208940.db2.gz	FEUOCGGTEPBVGC-INIZCTEOSA-N	0	3	330.819	3.330	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc3c(C)cc(=O)[nH]c3c2)CC1	ZINC000289991708	456209669	/nfs/dbraw/zinc/20/96/69/456209669.db2.gz	TWCJEVQCIIQDDR-UHFFFAOYSA-N	0	3	339.439	3.019	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@@H]1CNC(=O)c1oc2ccccc2c1CN(C)C	ZINC000281437578	456233481	/nfs/dbraw/zinc/23/34/81/456233481.db2.gz	NXAJAZWDZYMQON-RDTXWAMCSA-N	0	3	342.439	3.205	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1CNC(=O)c1oc2ccccc2c1CN(C)C	ZINC000281435559	456233980	/nfs/dbraw/zinc/23/39/80/456233980.db2.gz	NXAJAZWDZYMQON-KBXCAEBGSA-N	0	3	342.439	3.205	20	30		EGEDHN
C=CCC1(c2nc(-c3ccnc(OCCN(C)C)c3)no2)CCC1	ZINC000290142170	456250598	/nfs/dbraw/zinc/25/05/98/456250598.db2.gz	QWPHFENRGZTQAS-UHFFFAOYSA-N	0	3	328.416	3.070	20	30		EGEDHN
COc1ccc(CN[C@H](CN(C)C)c2ccc(F)cc2)cc1C#N	ZINC000290141381	456250707	/nfs/dbraw/zinc/25/07/07/456250707.db2.gz	NWPLAAMZGAZRAQ-GOSISDBHSA-N	0	3	327.403	3.098	20	30		EGEDHN
COc1cc(CNC[C@H](c2ccco2)N2CCCCC2)ccc1C#N	ZINC000281648854	456282357	/nfs/dbraw/zinc/28/23/57/456282357.db2.gz	JQTPGOAWDVTHLM-GOSISDBHSA-N	0	3	339.439	3.477	20	30		EGEDHN
CN(C)CCc1ccccc1NC(=O)N(C)Cc1ccc(C#N)cc1	ZINC000275744418	456302210	/nfs/dbraw/zinc/30/22/10/456302210.db2.gz	ZCSIUGQOCUVROG-UHFFFAOYSA-N	0	3	336.439	3.326	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NC[C@H](c1cccs1)N1CCCC1	ZINC000275749756	456304264	/nfs/dbraw/zinc/30/42/64/456304264.db2.gz	SDGYLYVUXRWKLK-CRAIPNDOSA-N	0	3	336.501	3.230	20	30		EGEDHN
C=C(CN[C@@H]1CCCc2cc(S(N)(=O)=O)ccc21)c1ccccc1	ZINC000340207851	456315446	/nfs/dbraw/zinc/31/54/46/456315446.db2.gz	YKGNAIQQTBOONN-LJQANCHMSA-N	0	3	342.464	3.014	20	30		EGEDHN
CCCCCC(=O)NC1CCN(CCCC2(C#N)CCOCC2)CC1	ZINC000337141280	456330517	/nfs/dbraw/zinc/33/05/17/456330517.db2.gz	RYSNBLXBAALBDE-UHFFFAOYSA-N	0	3	349.519	3.248	20	30		EGEDHN
COc1cc(CNC[C@H](c2cccc(F)c2)N(C)C)ccc1C#N	ZINC000281850306	456339599	/nfs/dbraw/zinc/33/95/99/456339599.db2.gz	ZDRIHDPDOCIAQD-GOSISDBHSA-N	0	3	327.403	3.098	20	30		EGEDHN
CC[C@](C)(C#N)C(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000290493759	456343172	/nfs/dbraw/zinc/34/31/72/456343172.db2.gz	MOQMLKHCHFKULE-IEBWSBKVSA-N	0	3	331.460	3.133	20	30		EGEDHN
CC[C@](C)(C#N)C(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000290493807	456343332	/nfs/dbraw/zinc/34/33/32/456343332.db2.gz	MOQMLKHCHFKULE-PKOBYXMFSA-N	0	3	331.460	3.133	20	30		EGEDHN
C[C@H](O)C[C@H]1CCCCCN1Cc1nnc(-c2cccc(C#N)c2)o1	ZINC000352885300	456390054	/nfs/dbraw/zinc/39/00/54/456390054.db2.gz	DBEWLFLORHIIHA-WMLDXEAASA-N	0	3	340.427	3.124	20	30		EGEDHN
C=CCOc1ccc(CNCCn2cnnc2C2CC2)cc1Cl	ZINC000347833589	456392306	/nfs/dbraw/zinc/39/23/06/456392306.db2.gz	OIRNNVNRZMKZRU-UHFFFAOYSA-N	0	3	332.835	3.164	20	30		EGEDHN
CC(C)[C@H](C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)N(C)C	ZINC000290684018	456404526	/nfs/dbraw/zinc/40/45/26/456404526.db2.gz	ZZBJAJYBJVSTDR-GOSISDBHSA-N	0	3	338.411	3.270	20	30		EGEDHN
C[C@H](CCC#N)N1CCC[C@H](CNC(=O)Nc2cccc(F)c2)C1	ZINC000276296284	456438774	/nfs/dbraw/zinc/43/87/74/456438774.db2.gz	IVVPJXOTTROLRH-HUUCEWRRSA-N	0	3	332.423	3.351	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1	ZINC000353036460	456452511	/nfs/dbraw/zinc/45/25/11/456452511.db2.gz	ZDBAFIGPHZOTJW-GHTZIAJQSA-N	0	3	344.499	3.338	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1C[C@H](F)CN1Cc1nccs1	ZINC000348080271	456461647	/nfs/dbraw/zinc/46/16/47/456461647.db2.gz	HWHMFKAUUFCKTD-DLBZAZTESA-N	0	3	344.459	3.059	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@@H](C)N1CCC(n2c(C)ccc2C)CC1	ZINC000337672460	456473497	/nfs/dbraw/zinc/47/34/97/456473497.db2.gz	KGZRAMUWZVSPPM-GOSISDBHSA-N	0	3	329.488	3.331	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ncccc2Oc2ccccc2)CC1	ZINC000282407401	456503991	/nfs/dbraw/zinc/50/39/91/456503991.db2.gz	KNORALCLFXKZMW-UHFFFAOYSA-N	0	3	337.423	3.254	20	30		EGEDHN
Cc1nc2ccccc2n1C[C@@H]1CCCN1Cc1cc(C#N)n(C)c1	ZINC000276695701	456554683	/nfs/dbraw/zinc/55/46/83/456554683.db2.gz	ADMMSXIMJKWJOA-KRWDZBQOSA-N	0	3	333.439	3.220	20	30		EGEDHN
C[C@@H](C(=O)N(C)CCC#N)N1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2	ZINC000282569435	456555506	/nfs/dbraw/zinc/55/55/06/456555506.db2.gz	ZIUHHMJKUBQFDY-KANFNMMFSA-N	0	3	325.456	3.158	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N(CCN(C)C)Cc1ccccc1F	ZINC000337813232	456564454	/nfs/dbraw/zinc/56/44/54/456564454.db2.gz	NIEDQQVWDXCAQU-UHFFFAOYSA-N	0	3	339.414	3.210	20	30		EGEDHN
Cc1ccc(NC(=O)c2cccc(C#N)c2C)c(OCCN(C)C)c1	ZINC000337867550	456577180	/nfs/dbraw/zinc/57/71/80/456577180.db2.gz	OWXWKLTUCMDIMU-UHFFFAOYSA-N	0	3	337.423	3.368	20	30		EGEDHN
CCN1CCO[C@H](CNCc2cc(C#N)cs2)[C@@H]1c1ccccc1	ZINC000343389991	456583611	/nfs/dbraw/zinc/58/36/11/456583611.db2.gz	CMXMSUMLKHEJAP-MOPGFXCFSA-N	0	3	341.480	3.171	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000337903095	456593964	/nfs/dbraw/zinc/59/39/64/456593964.db2.gz	RWSXOWUWFISZKN-UHFFFAOYSA-N	0	3	333.435	3.261	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN1CC[C@H](c2ccc(C)cc2C)C1	ZINC000348306472	456611375	/nfs/dbraw/zinc/61/13/75/456611375.db2.gz	MGQMTJWWTCEJBF-WMZOPIPTSA-N	0	3	327.472	3.101	20	30		EGEDHN
COc1ccc(CN(C)CC[C@H]2CCCO2)cc1OCCCC#N	ZINC000343441891	456625138	/nfs/dbraw/zinc/62/51/38/456625138.db2.gz	LIAHOULFFQCJAJ-QGZVFWFLSA-N	0	3	332.444	3.379	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)CSCc1ccncc1)C(C)C	ZINC000299181256	456627462	/nfs/dbraw/zinc/62/74/62/456627462.db2.gz	ZKUAURDTGBBPOI-GOSISDBHSA-N	0	3	347.528	3.130	20	30		EGEDHN
C#CCN(C(=O)N[C@@H]1CCN(Cc2ccccc2)CC1(C)C)C1CC1	ZINC000282822338	456636323	/nfs/dbraw/zinc/63/63/23/456636323.db2.gz	IYBODTNSAYMXOG-LJQANCHMSA-N	0	3	339.483	3.094	20	30		EGEDHN
N#CC1(C(=O)N2CCC(N3CCc4ccccc4C3)CC2)CCCC1	ZINC000299351910	456665394	/nfs/dbraw/zinc/66/53/94/456665394.db2.gz	POONJFIWDJOUGX-UHFFFAOYSA-N	0	3	337.467	3.120	20	30		EGEDHN
C=CCOc1cccnc1-c1nc(-c2ccc(CN(C)C)cc2)no1	ZINC000340785858	456685687	/nfs/dbraw/zinc/68/56/87/456685687.db2.gz	BTWABXXQZLNREM-UHFFFAOYSA-N	0	3	336.395	3.425	20	30		EGEDHN
Cc1c([C@H](C)NCCc2cccc(C#N)c2)nnn1-c1ccccc1	ZINC000343572273	456716309	/nfs/dbraw/zinc/71/63/09/456716309.db2.gz	MIUWAEXDQWNDDR-HNNXBMFYSA-N	0	3	331.423	3.341	20	30		EGEDHN
CC1CCN(C[C@@H](O)CNC(=O)c2coc(C3CCCCC3)n2)CC1	ZINC000328715364	456743254	/nfs/dbraw/zinc/74/32/54/456743254.db2.gz	CUKANONSGRYMMJ-INIZCTEOSA-N	0	3	349.475	3.120	20	30		EGEDHN
Cc1ccc(CNC(=O)[C@H](C)N[C@H]2CCC(=O)NC23CCC3)cc1	ZINC000328726391	456746930	/nfs/dbraw/zinc/74/69/30/456746930.db2.gz	ZONCDUBEURQSEB-HOCLYGCPSA-N	0	3	329.444	3.471	20	30		EGEDHN
NC(=O)[C@H]1CCCN(Cc2ccccc2NC(=O)[C@H]2CCCO2)C1	ZINC000328796342	456762461	/nfs/dbraw/zinc/76/24/61/456762461.db2.gz	URWPVCAFBMZEOB-GOEBONIOSA-N	0	3	331.416	3.201	20	30		EGEDHN
COC(=O)C[C@@](C)(NCCCC(C)(C)C#N)c1cccc(OC)c1	ZINC000344033877	456789566	/nfs/dbraw/zinc/78/95/66/456789566.db2.gz	FZRKKGSLZYUGQM-LJQANCHMSA-N	0	3	332.444	3.393	20	30		EGEDHN
C=CCc1cc(CN[C@H](C)CC(=O)OC(C)(C)C)cc(OC)c1O	ZINC000344219837	456807809	/nfs/dbraw/zinc/80/78/09/456807809.db2.gz	NFQLABYEQKWOIN-CYBMUJFWSA-N	0	3	335.444	3.339	20	30		EGEDHN
COc1cc(CN(C)CCc2ccccc2[N+](=O)[O-])ccc1C#N	ZINC000348673666	456811445	/nfs/dbraw/zinc/81/14/45/456811445.db2.gz	NJSCOEVQKDGLGC-UHFFFAOYSA-N	0	3	325.368	3.150	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)c1cc(F)cc([N+](=O)[O-])c1	ZINC000344557100	456837592	/nfs/dbraw/zinc/83/75/92/456837592.db2.gz	VTLHETAHGIQOBL-ZDUSSCGKSA-N	0	3	338.298	3.111	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)[C@H]1CC12CCCC2	ZINC000353661122	456839342	/nfs/dbraw/zinc/83/93/42/456839342.db2.gz	OFVYJYONOLBMFJ-GOSISDBHSA-N	0	3	325.456	3.029	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2CSc3ccccc32)CC1	ZINC000344624379	456842911	/nfs/dbraw/zinc/84/29/11/456842911.db2.gz	IXELRLNJHGJEKU-MRXNPFEDSA-N	0	3	331.485	3.173	20	30		EGEDHN
CC(C#N)C(=O)N1CCC[C@H]1c1cc(F)cc(Br)c1	ZINC000345004795	456893909	/nfs/dbraw/zinc/89/39/09/456893909.db2.gz	QXSFTFFCIWGJNL-ZANVPECISA-N	0	3	325.181	3.411	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCC[C@@H]2CCCCO2)C1	ZINC000329519807	456903988	/nfs/dbraw/zinc/90/39/88/456903988.db2.gz	QDTLEYSDWDJCHI-NEWSRXKRSA-N	0	3	345.487	3.285	20	30		EGEDHN
CSC[C@@](C)(C#N)NC(=O)c1ccc(CN2CCCCC2)cc1	ZINC000345084676	456919845	/nfs/dbraw/zinc/91/98/45/456919845.db2.gz	JYLSUUJYGPURAG-GOSISDBHSA-N	0	3	331.485	3.048	20	30		EGEDHN
CCSc1ccc([C@@H](C)N[C@H](C)C(=O)NC2(C#N)CCC2)cc1	ZINC000345110333	456929622	/nfs/dbraw/zinc/92/96/22/456929622.db2.gz	IDLUOCHURMEEKD-ZIAGYGMSSA-N	0	3	331.485	3.400	20	30		EGEDHN
Cc1cccc([C@H](C)NC([O-])=[NH+]C[C@@H]2CCc3nccn3C2)c1C	ZINC000329924639	456961280	/nfs/dbraw/zinc/96/12/80/456961280.db2.gz	VBGSKLAMFPIXBW-HOTGVXAUSA-N	0	3	326.444	3.327	20	30		EGEDHN
N#C[C@@H]1CC[C@H](N2CCC[C@H](NC(=O)CCCc3ccccc3)C2)C1	ZINC000339183411	456981544	/nfs/dbraw/zinc/98/15/44/456981544.db2.gz	GBIGNUWGHCICPI-AABGKKOBSA-N	0	3	339.483	3.282	20	30		EGEDHN
Cc1ccccc1OCCCNC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000349600632	456994557	/nfs/dbraw/zinc/99/45/57/456994557.db2.gz	QIOKPOOMIDZUHM-LJQANCHMSA-N	0	3	347.418	3.134	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NC1CCN([C@@H](C)c2ccccc2)CC1	ZINC000346048726	457015363	/nfs/dbraw/zinc/01/53/63/457015363.db2.gz	CGFLUIFILAUYGN-VDGAXYAQSA-N	0	3	342.483	3.309	20	30		EGEDHN
CN(C(=O)c1cn(CCCC#N)c2ccccc12)[C@H]1CCCN(C)C1	ZINC000346057691	457015649	/nfs/dbraw/zinc/01/56/49/457015649.db2.gz	HEAMMZMKYRQBPU-INIZCTEOSA-N	0	3	338.455	3.111	20	30		EGEDHN
C[C@H]1C[C@H]1N1CCN(C(=O)c2ccc(C3(C#N)CC3)cc2)C[C@@H](C)C1	ZINC000346221313	457024040	/nfs/dbraw/zinc/02/40/40/457024040.db2.gz	VPDZGZVXQRJGCD-TXPKVOOTSA-N	0	3	337.467	3.044	20	30		EGEDHN
C[C@H](Sc1ccccc1C(=O)N[C@@H]1CCN(C)[C@H](C)C1)C(N)=O	ZINC000330397458	457037503	/nfs/dbraw/zinc/03/75/03/457037503.db2.gz	OYUFHMHBEVZMJM-FRRDWIJNSA-N	0	3	335.473	3.490	20	30		EGEDHN
COCC1(C#N)CCN(CCc2cccc(OC(F)(F)F)c2)CC1	ZINC000341984388	457041996	/nfs/dbraw/zinc/04/19/96/457041996.db2.gz	VNVFWUCLIGDJHE-UHFFFAOYSA-N	0	3	342.361	3.380	20	30		EGEDHN
CC(C)C[C@@](C)(C#N)NC(=O)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000330484764	457048263	/nfs/dbraw/zinc/04/82/63/457048263.db2.gz	YUPJBNDRKUAWHS-ICSRJNTNSA-N	0	3	327.472	3.343	20	30		EGEDHN
CC(C#N)C(=O)NCC1(c2ccc(Br)s2)CCC1	ZINC000359104169	457055687	/nfs/dbraw/zinc/05/56/87/457055687.db2.gz	GYLLSZPDBBDQKM-VIFPVBQESA-N	0	3	327.247	3.208	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1)OCC	ZINC000339378649	457077650	/nfs/dbraw/zinc/07/76/50/457077650.db2.gz	OBKRYBWQIKHXPT-ICSRJNTNSA-N	0	3	344.499	3.481	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N(CCN(C)C)Cc1ccc(F)cc1)OCC	ZINC000339398578	457094740	/nfs/dbraw/zinc/09/47/40/457094740.db2.gz	CCVSPUAXFAGXIY-GOSISDBHSA-N	0	3	336.451	3.087	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2cnn(C(C)(C)C)c2C(F)(F)F)CCN1C	ZINC000330899100	457101992	/nfs/dbraw/zinc/10/19/92/457101992.db2.gz	IVQRHDUPWGVJHA-MNOVXSKESA-N	0	3	346.397	3.444	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N[C@@H](CN1CCCC1)c1ccccc1)OCC	ZINC000339426225	457108460	/nfs/dbraw/zinc/10/84/60/457108460.db2.gz	RXRQICVJCSFTLZ-OALUTQOASA-N	0	3	330.472	3.311	20	30		EGEDHN
CC(=O)Nc1ccc(C)c(C(=O)NCCN2CCCC(C)(C)C2)c1	ZINC000330953867	457108687	/nfs/dbraw/zinc/10/86/87/457108687.db2.gz	GIXHQZPKHGZARV-UHFFFAOYSA-N	0	3	331.460	3.380	20	30		EGEDHN
CN(CCCSCC#N)CCOc1ccc(Br)cc1	ZINC000342116920	457118205	/nfs/dbraw/zinc/11/82/05/457118205.db2.gz	SJYACDSRJDYSPC-UHFFFAOYSA-N	0	3	343.290	3.407	20	30		EGEDHN
CN(C)CCc1ccccc1NC(=O)C1(c2cccc(C#N)c2)CC1	ZINC000354198695	457124652	/nfs/dbraw/zinc/12/46/52/457124652.db2.gz	KWQVTLHBUFZVQU-UHFFFAOYSA-N	0	3	333.435	3.333	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NC(C)(C)CN(C)Cc1ccccc1)OCC	ZINC000339485658	457127039	/nfs/dbraw/zinc/12/70/39/457127039.db2.gz	QNVZVDDKPWYRRV-SFHVURJKSA-N	0	3	332.488	3.385	20	30		EGEDHN
CCn1cc(C(=O)NCCN2CCCC(C)(C)C2)c(C(F)(F)F)n1	ZINC000331247905	457153026	/nfs/dbraw/zinc/15/30/26/457153026.db2.gz	UEKJWSDMIUHODT-UHFFFAOYSA-N	0	3	346.397	3.348	20	30		EGEDHN
C=C(CN[C@H](C)c1cccc(NS(C)(=O)=O)c1)c1ccccc1	ZINC000346782131	457166518	/nfs/dbraw/zinc/16/65/18/457166518.db2.gz	TVELWKVOSOCNQA-OAHLLOKOSA-N	0	3	330.453	3.422	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C(=O)NC[C@@H]1N(C)CCCC1(C)C	ZINC000331326143	457167420	/nfs/dbraw/zinc/16/74/20/457167420.db2.gz	ONSIGRXAHVXBLR-KRWDZBQOSA-N	0	3	328.460	3.024	20	30		EGEDHN
C=C(CN[C@@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)c1ccccc1	ZINC000346782942	457168444	/nfs/dbraw/zinc/16/84/44/457168444.db2.gz	UJCULFVQMMPFNE-INIZCTEOSA-N	0	3	344.480	3.301	20	30		EGEDHN
N#CC[C@H](CC(=O)N1CCN(C2CCCC2)CC1)c1ccccc1	ZINC000354319838	457184883	/nfs/dbraw/zinc/18/48/83/457184883.db2.gz	PMIWEMOXULRWIF-GOSISDBHSA-N	0	3	325.456	3.161	20	30		EGEDHN
N#C[C@@H](NC(=O)[C@@H]1CCCN(Cc2ccccc2)C1)C1CCCCC1	ZINC000331495839	457195010	/nfs/dbraw/zinc/19/50/10/457195010.db2.gz	VXWHKOMYRPXNGX-WOJBJXKFSA-N	0	3	339.483	3.487	20	30		EGEDHN
C[C@@H]1C[C@@H](N(C)C(=O)c2cnccc2C#N)CCN1Cc1ccccc1	ZINC000342269616	457201173	/nfs/dbraw/zinc/20/11/73/457201173.db2.gz	BMDNCMAGEVYYIH-APWZRJJASA-N	0	3	348.450	3.078	20	30		EGEDHN
CC(C#N)C(=O)N1CCO[C@H](c2cc(F)c(Cl)cc2Cl)C1	ZINC000347138483	457251180	/nfs/dbraw/zinc/25/11/80/457251180.db2.gz	QXKZUPDOJBNULO-OQPBUACISA-N	0	3	331.174	3.192	20	30		EGEDHN
CCS[C@@H]1CCCCN([C@H](C)C(=O)N[C@](C)(C#N)C(C)C)C1	ZINC000331936458	457276636	/nfs/dbraw/zinc/27/66/36/457276636.db2.gz	WYNUZFFMSDBIFF-BFYDXBDKSA-N	0	3	325.522	3.037	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN1CCC[C@H]1Cc1ccc(C)cc1	ZINC000354556102	457287936	/nfs/dbraw/zinc/28/79/36/457287936.db2.gz	SEVXYEIVKPWKLL-HKUYNNGSSA-N	0	3	327.472	3.010	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)[C@@H]1CC12CCCCC2	ZINC000357064473	457305520	/nfs/dbraw/zinc/30/55/20/457305520.db2.gz	BWXMOVRHYACONC-IBGZPJMESA-N	0	3	339.483	3.419	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN2CC[C@@H](C)[C@@H]2CC)cc1	ZINC000360477738	457314583	/nfs/dbraw/zinc/31/45/83/457314583.db2.gz	LOMZJOYWGJFZIK-APWZRJJASA-N	0	3	343.471	3.452	20	30		EGEDHN
C=CCOc1cccc(CN2CCC(C(=O)N(C)C(C)C)CC2)c1	ZINC000351963593	457326650	/nfs/dbraw/zinc/32/66/50/457326650.db2.gz	GFNXIEHYDXEPJA-UHFFFAOYSA-N	0	3	330.472	3.330	20	30		EGEDHN
CC(C)(C)CN(CCC#N)CCCN1CCN(c2ccccc2)CC1	ZINC000352026370	457334798	/nfs/dbraw/zinc/33/47/98/457334798.db2.gz	MNNFETFBWSQXBL-UHFFFAOYSA-N	0	3	342.531	3.460	20	30		EGEDHN
C=CCSCCNC(=O)N[C@@H](C)[C@H](c1ccccc1C)N(C)C	ZINC000352254165	457351669	/nfs/dbraw/zinc/35/16/69/457351669.db2.gz	YWWGDKFYYYSQBV-DOTOQJQBSA-N	0	3	335.517	3.205	20	30		EGEDHN
CC(C)(CCC#N)CN[C@H](Cc1ccc(C(F)(F)F)cc1)C(N)=O	ZINC000352270145	457352867	/nfs/dbraw/zinc/35/28/67/457352867.db2.gz	CNGOKOGWGXCDES-CQSZACIVSA-N	0	3	341.377	3.021	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)N[C@@H](C)CN1CCC[C@@H](C)C1	ZINC000352442237	457370704	/nfs/dbraw/zinc/37/07/04/457370704.db2.gz	MRDUXIJNOBXOCD-CABCVRRESA-N	0	3	344.459	3.199	20	30		EGEDHN
C=C[C@H](CO)NCc1ccc(OC(F)(F)[C@H](F)C(F)(F)F)cc1	ZINC000352452351	457379498	/nfs/dbraw/zinc/37/94/98/457379498.db2.gz	FDVOQOYZSIDPFF-ZYHUDNBSSA-N	0	3	343.267	3.195	20	30		EGEDHN
CN1CCC2(CCCN2C(=O)c2cccc(SCC#N)c2)CC1	ZINC000378337460	457389238	/nfs/dbraw/zinc/38/92/38/457389238.db2.gz	VLWURDHQBJECOV-UHFFFAOYSA-N	0	3	329.469	3.003	20	30		EGEDHN
N#CC1(C(=O)N2CC[C@]3(C2)CCCN(Cc2ccccc2)C3)CCC1	ZINC000363699121	457419384	/nfs/dbraw/zinc/41/93/84/457419384.db2.gz	PUJDFGRBHIKYJX-HXUWFJFHSA-N	0	3	337.467	3.195	20	30		EGEDHN
Cc1cc(N[C@H]2CCN(C3CC3)C2)n2c3ccccc3nc2c1C#N	ZINC000357306643	457435125	/nfs/dbraw/zinc/43/51/25/457435125.db2.gz	ORRBUIXUGKYKNA-AWEZNQCLSA-N	0	3	331.423	3.316	20	30		EGEDHN
COCC(C)(C)N1CCN(c2ccc(C#N)c(C(F)(F)F)c2)CC1	ZINC000425287044	457481870	/nfs/dbraw/zinc/48/18/70/457481870.db2.gz	ZEKDESKBXJMHEN-UHFFFAOYSA-N	0	3	341.377	3.124	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C1(C#N)CCCCC1	ZINC000398162629	457496670	/nfs/dbraw/zinc/49/66/70/457496670.db2.gz	LIYRTRMEWLEUTH-PKOBYXMFSA-N	0	3	339.483	3.487	20	30		EGEDHN
Cc1nsc(N(C)C[C@H]2CCN(Cc3ccccc3)C2)c1C#N	ZINC000342822963	457542322	/nfs/dbraw/zinc/54/23/22/457542322.db2.gz	GLJQJWIOMBUYGL-MRXNPFEDSA-N	0	3	326.469	3.282	20	30		EGEDHN
CSc1ccc([C@@H](CNC(=O)N[C@@H]2CC[C@H](C#N)C2)N(C)C)cc1	ZINC000425765811	457641408	/nfs/dbraw/zinc/64/14/08/457641408.db2.gz	IAYOPASYUDUMQA-YSVLISHTSA-N	0	3	346.500	3.003	20	30		EGEDHN
N#Cc1ccc(OCCN2CC[C@H](n3ncc4ccccc43)C2)cc1	ZINC000374748218	457699856	/nfs/dbraw/zinc/69/98/56/457699856.db2.gz	ACEZZOQIZMMRJI-SFHVURJKSA-N	0	3	332.407	3.234	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@H](OC2CCCC2)c2ccccc2)CC1	ZINC000357815062	457700439	/nfs/dbraw/zinc/70/04/39/457700439.db2.gz	DGTXSUSAGQVKIP-HXUWFJFHSA-N	0	3	342.483	3.454	20	30		EGEDHN
Cc1ccccc1[C@H]([C@H](C)NC(=O)c1cccc(CC#N)c1)N(C)C	ZINC000357866714	457717565	/nfs/dbraw/zinc/71/75/65/457717565.db2.gz	JXNSVBBYAZZPDF-JXFKEZNVSA-N	0	3	335.451	3.482	20	30		EGEDHN
Cc1ccccc1[C@H]([C@@H](C)NC(=O)Cc1ccc(C#N)cc1)N(C)C	ZINC000357879187	457721594	/nfs/dbraw/zinc/72/15/94/457721594.db2.gz	VJJSDRXKALGWSM-IERDGZPVSA-N	0	3	335.451	3.217	20	30		EGEDHN
COC1(CN2CCN(Cc3ccc(C#N)cc3)CC2)CCCCC1	ZINC000361509791	457761911	/nfs/dbraw/zinc/76/19/11/457761911.db2.gz	WZPUDVLVSMXWEX-UHFFFAOYSA-N	0	3	327.472	3.025	20	30		EGEDHN
N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)C1CCN(C2CC2)CC1	ZINC000365927865	457784772	/nfs/dbraw/zinc/78/47/72/457784772.db2.gz	BGMIFHSGFDKXPM-UXHICEINSA-N	0	3	337.467	3.159	20	30		EGEDHN
CC(C)CSCCNCc1cn(CCC#N)nc1-c1ccncc1	ZINC000433331485	457813311	/nfs/dbraw/zinc/81/33/11/457813311.db2.gz	MYZDPIOGRQVTJJ-UHFFFAOYSA-N	0	3	343.500	3.338	20	30		EGEDHN
Cc1ccc(CNCc2cn(CCC#N)nc2-c2ccncc2)cc1	ZINC000433335486	457813972	/nfs/dbraw/zinc/81/39/72/457813972.db2.gz	PRHONHFPOJWPNC-UHFFFAOYSA-N	0	3	331.423	3.457	20	30		EGEDHN
Cc1ccc([C@H]2COCCN2C(=O)C(C#N)CCc2ccccc2)o1	ZINC000433347060	457816998	/nfs/dbraw/zinc/81/69/98/457816998.db2.gz	KJILMIVZAHCEBE-QZTJIDSGSA-N	0	3	338.407	3.261	20	30		EGEDHN
CC(C)CCO[C@@H]1CCN(C(=O)C(C#N)CCc2ccccc2)C1	ZINC000433363836	457821500	/nfs/dbraw/zinc/82/15/00/457821500.db2.gz	MDYUXIMSFMCWGF-RBUKOAKNSA-N	0	3	328.456	3.423	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NC[C@@H](CCO)c1ccccc1	ZINC000433384455	457826151	/nfs/dbraw/zinc/82/61/51/457826151.db2.gz	KFDBWHSRPUAUNI-VQTJNVASSA-N	0	3	336.435	3.041	20	30		EGEDHN
C[C@@H](CNC(=O)C(C#N)CCc1ccccc1)Oc1ccc(F)cc1	ZINC000433380802	457826995	/nfs/dbraw/zinc/82/69/95/457826995.db2.gz	FOZKSRCZMJLZLH-DOTOQJQBSA-N	0	3	340.398	3.482	20	30		EGEDHN
FC(F)(F)Oc1ccc(C#CCN2CC[C@H]([C@H]3CCOC3)C2)cc1	ZINC000361750582	457833690	/nfs/dbraw/zinc/83/36/90/457833690.db2.gz	IYCOLNZQPRAREL-HOTGVXAUSA-N	0	3	339.357	3.295	20	30		EGEDHN
COc1cc(NCCNCc2ccc(C#N)c(C)c2)cc(OC)c1	ZINC000443999172	457837363	/nfs/dbraw/zinc/83/73/63/457837363.db2.gz	BOLMOLBXZWRBKQ-UHFFFAOYSA-N	0	3	325.412	3.086	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN[C@@H]2CCN(c3ccccc3F)C2)cc1	ZINC000366589263	457861608	/nfs/dbraw/zinc/86/16/08/457861608.db2.gz	FBMCYSYZABEKAN-DOTOQJQBSA-N	0	3	339.414	3.485	20	30		EGEDHN
CN(CCC#N)c1ccc(CN2CCC(OCC3CC3)CC2)cc1	ZINC000371336126	457871596	/nfs/dbraw/zinc/87/15/96/457871596.db2.gz	NTINSBYFYMIRTE-UHFFFAOYSA-N	0	3	327.472	3.427	20	30		EGEDHN
C=CCN(C(=O)C1CCN(C2CC2)CC1)c1nc2c(s1)CCCC2	ZINC000426699128	457880327	/nfs/dbraw/zinc/88/03/27/457880327.db2.gz	FURZLIVOZGTFIB-UHFFFAOYSA-N	0	3	345.512	3.415	20	30		EGEDHN
CC[C@H](N[C@@H](C)CCC#N)c1ccccc1OCC(=O)N1CCCC1	ZINC000411457653	457892711	/nfs/dbraw/zinc/89/27/11/457892711.db2.gz	WOOUQPMJOOHTLB-WMZOPIPTSA-N	0	3	343.471	3.421	20	30		EGEDHN
CC(C)(C)n1cc(C#N)cc1NC(=O)NCCN1CCCC(C)(C)C1	ZINC000433843242	457896840	/nfs/dbraw/zinc/89/68/40/457896840.db2.gz	MFKJUMULCNESRL-UHFFFAOYSA-N	0	3	345.491	3.358	20	30		EGEDHN
CCCN(CCc1cccs1)[C@H](C)C(=O)N[C@](C)(C#N)C(C)C	ZINC000411557903	457918845	/nfs/dbraw/zinc/91/88/45/457918845.db2.gz	VOEZUYADFXTKMU-CRAIPNDOSA-N	0	3	335.517	3.446	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cnn(CCC(C)C)c2CC)CC1	ZINC000426913573	457925241	/nfs/dbraw/zinc/92/52/41/457925241.db2.gz	HEXWHUUAZJZQOL-UHFFFAOYSA-N	0	3	346.519	3.262	20	30		EGEDHN
C=CCN(C)CCN(CC)[C@@H](C)C(=O)Nc1ccc(F)cc1Cl	ZINC000411637206	457936368	/nfs/dbraw/zinc/93/63/68/457936368.db2.gz	FQMIWTGNBVYGPZ-ZDUSSCGKSA-N	0	3	341.858	3.246	20	30		EGEDHN
C=CCN(C)CCN(CC)CCc1nc(-c2ccc(Cl)cc2)no1	ZINC000411640491	457936614	/nfs/dbraw/zinc/93/66/14/457936614.db2.gz	KRGUCJHFXYSAFA-UHFFFAOYSA-N	0	3	348.878	3.372	20	30		EGEDHN
C=CCOc1ccc(CN(C)[C@H](C)CN2CCOCC2)cc1Cl	ZINC000435052453	458087224	/nfs/dbraw/zinc/08/72/24/458087224.db2.gz	VFASNDCIPCNCBV-OAHLLOKOSA-N	0	3	338.879	3.057	20	30		EGEDHN
C[C@@H]1CN(Cc2cccc(OCc3ccccc3C#N)c2)CC[C@H]1O	ZINC000428461748	458150342	/nfs/dbraw/zinc/15/03/42/458150342.db2.gz	JCYYKOAEDRVMJF-IIBYNOLFSA-N	0	3	336.435	3.340	20	30		EGEDHN
C=CCSc1ccccc1C(=O)N1C[C@@H](SC)[C@H](N(C)C)C1	ZINC000362402510	458155553	/nfs/dbraw/zinc/15/55/53/458155553.db2.gz	MPKZWWAWUYSUSM-GDBMZVCRSA-N	0	3	336.526	3.082	20	30		EGEDHN
C#CCOc1ccc([C@H](C)NCc2cccc(-n3cncn3)c2)cc1	ZINC000372046375	458172291	/nfs/dbraw/zinc/17/22/91/458172291.db2.gz	NXLIPSNTRNZHAG-INIZCTEOSA-N	0	3	332.407	3.130	20	30		EGEDHN
C[C@@H]1CCC[C@H](CCN2CCN(c3nccnc3C#N)C[C@H]2C)C1	ZINC000362464777	458197726	/nfs/dbraw/zinc/19/77/26/458197726.db2.gz	PIGBMJVALOGTOK-BRWVUGGUSA-N	0	3	327.476	3.075	20	30		EGEDHN
C=CC(C)(C)CNC(=O)N1C[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C1	ZINC000458993738	458238506	/nfs/dbraw/zinc/23/85/06/458238506.db2.gz	XVYTVBRGSIPPQN-RBUKOAKNSA-N	0	3	341.499	3.362	20	30		EGEDHN
C=C(C)CCNC(=O)N1C[C@H]2CCN(Cc3ccccc3)C[C@H]2C1	ZINC000459007385	458242203	/nfs/dbraw/zinc/24/22/03/458242203.db2.gz	SOZOPZLPZHQTRS-MOPGFXCFSA-N	0	3	327.472	3.116	20	30		EGEDHN
C=CCC[C@@H](O)CN1CCN(c2cccc3cnccc32)C[C@@H]1C	ZINC000447380750	458289466	/nfs/dbraw/zinc/28/94/66/458289466.db2.gz	FXCKHPLZUPEDQB-FUHWJXTLSA-N	0	3	325.456	3.072	20	30		EGEDHN
C=CCOc1ccc(CN2CCC[C@@H](c3ccnn3C)C2)cc1OC	ZINC000372433323	458301731	/nfs/dbraw/zinc/30/17/31/458301731.db2.gz	FTRZQHLWVTVDGI-QGZVFWFLSA-N	0	3	341.455	3.373	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1C[C@@H](O)C[C@@H]1c1ccccc1	ZINC000413928555	458311596	/nfs/dbraw/zinc/31/15/96/458311596.db2.gz	ALVYPTPSIKOVBE-SLFFLAALSA-N	0	3	334.419	3.093	20	30		EGEDHN
CN(C)[C@H](CC(=O)N[C@H](C#N)c1ccccc1F)c1ccccc1	ZINC000416152094	458340175	/nfs/dbraw/zinc/34/01/75/458340175.db2.gz	UVAOTMXNJVLWEV-QZTJIDSGSA-N	0	3	325.387	3.200	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N[C@@H](CO)CC1CCCCC1	ZINC000416325333	458342177	/nfs/dbraw/zinc/34/21/77/458342177.db2.gz	KADPMECTOPUWBP-RTBURBONSA-N	0	3	328.456	3.206	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCCN1CCN(C)C[C@@H]1c1ccccc1	ZINC000429864214	458379068	/nfs/dbraw/zinc/37/90/68/458379068.db2.gz	VOJBLZSLDLTILA-LJQANCHMSA-N	0	3	343.515	3.084	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)NCC1(C#N)CCC1)c1ccsc1	ZINC000419414052	458381837	/nfs/dbraw/zinc/38/18/37/458381837.db2.gz	DUHZRLGKHCOYSJ-OAHLLOKOSA-N	0	3	334.489	3.124	20	30		EGEDHN
CCN1CCCN(C(=O)c2cn(CCCC#N)c3ccccc23)CC1	ZINC000373059967	458387808	/nfs/dbraw/zinc/38/78/08/458387808.db2.gz	UDBQLYYAXHCEBR-UHFFFAOYSA-N	0	3	338.455	3.113	20	30		EGEDHN
CC(=O)Nc1c[nH]nc1[C@H]1CCCN(CCCCC(C)(C)C#N)C1	ZINC000373074403	458392564	/nfs/dbraw/zinc/39/25/64/458392564.db2.gz	MMLZCNRFYYCUCN-HNNXBMFYSA-N	0	3	331.464	3.268	20	30		EGEDHN
C=CCNC(=O)[C@H](C)N1CCC(c2c[nH]c3ccc(F)cc32)CC1	ZINC000376833420	458401478	/nfs/dbraw/zinc/40/14/78/458401478.db2.gz	ILSPTJJQFXKHPE-ZDUSSCGKSA-N	0	3	329.419	3.177	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)CN1CC[C@@H](c2ccccc2)C1(C)C	ZINC000421010935	458405622	/nfs/dbraw/zinc/40/56/22/458405622.db2.gz	CZUISYHBARMOPJ-FXAWDEMLSA-N	0	3	327.472	3.309	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCN(Cc3ccc4c(c3)CCCC4)C2)nc1	ZINC000430161154	458412844	/nfs/dbraw/zinc/41/28/44/458412844.db2.gz	CBNXVBAOZKDYRN-FQEVSTJZSA-N	0	3	333.435	3.485	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCN(CCc3cccc(Cl)c3)C2)nc1	ZINC000459567033	458413001	/nfs/dbraw/zinc/41/30/01/458413001.db2.gz	ZSOHSKFWUPTQPQ-KRWDZBQOSA-N	0	3	327.815	3.302	20	30		EGEDHN
CC[C@H](CS(=O)(=O)c1ccccc1)NC1CCC(C)(C#N)CC1	ZINC000449196039	458420559	/nfs/dbraw/zinc/42/05/59/458420559.db2.gz	WLAHXXJYBTVZJI-KLHKWILBSA-N	0	3	334.485	3.301	20	30		EGEDHN
C=CCc1cc(CNC[C@@H](Cc2ccccc2)OC)cc(OC)c1O	ZINC000449392203	458423753	/nfs/dbraw/zinc/42/37/53/458423753.db2.gz	HOWNMNPIQPOVQO-LJQANCHMSA-N	0	3	341.451	3.477	20	30		EGEDHN
N#Cc1cccc(COc2cccc(CN3CC[C@@](O)(C4CC4)C3)c2)c1	ZINC000373270555	458448735	/nfs/dbraw/zinc/44/87/35/458448735.db2.gz	LSQAIIZNOIVZLE-QFIPXVFZSA-N	0	3	348.446	3.484	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC[C@H]2CCC[C@H](C(F)(F)F)C2)CC1	ZINC000437495855	458457876	/nfs/dbraw/zinc/45/78/76/458457876.db2.gz	XTCHPMQVNOFBCR-KBPBESRZSA-N	0	3	347.425	3.305	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)NCC2(CC#N)CC2)N2CCCC2)cc1	ZINC000430543931	458458689	/nfs/dbraw/zinc/45/86/89/458458689.db2.gz	SFVANXPVMJXMDD-SFHVURJKSA-N	0	3	340.471	3.125	20	30		EGEDHN
C[C@H]1CN(Cc2ccc(C#N)cc2OC(F)F)CCN(C2CC2)C1	ZINC000451093903	458465319	/nfs/dbraw/zinc/46/53/19/458465319.db2.gz	ZNWAFXBZEDNAKW-ZDUSSCGKSA-N	0	3	335.398	3.076	20	30		EGEDHN
C[C@H](Cc1cccc(F)c1)N(C)C[C@@H](O)COc1ccc(C#N)cc1	ZINC000459758371	458471073	/nfs/dbraw/zinc/47/10/73/458471073.db2.gz	QCUSKYULNJUGTR-DNVCBOLYSA-N	0	3	342.414	3.000	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NC[C@@H](c1ccc(CC)cc1)N(C)C	ZINC000437641912	458478510	/nfs/dbraw/zinc/47/85/10/458478510.db2.gz	SIGUHCASQJLRPD-AZUAARDMSA-N	0	3	332.488	3.197	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@@H]1C[C@@H](OC)C1(C)C	ZINC000451490506	458478640	/nfs/dbraw/zinc/47/86/40/458478640.db2.gz	IDAOWFWJCVSTFQ-HZPDHXFCSA-N	0	3	334.485	3.306	20	30		EGEDHN
CC(C)O[C@@H]1C[C@@H](NCC(=O)N(CCC#N)c2ccccc2)C1(C)C	ZINC000451492995	458478732	/nfs/dbraw/zinc/47/87/32/458478732.db2.gz	IVKLXYBHOFTOQR-QZTJIDSGSA-N	0	3	343.471	3.115	20	30		EGEDHN
COc1ccc(CN[C@H]2C[C@@H](OC)C23CCC3)cc1OCCCC#N	ZINC000459799204	458482305	/nfs/dbraw/zinc/48/23/05/458482305.db2.gz	YOXXJVKEFUDIBC-RBUKOAKNSA-N	0	3	344.455	3.425	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCC(=O)N(Cc1ccccc1)c1ccccc1	ZINC000451607769	458483080	/nfs/dbraw/zinc/48/30/80/458483080.db2.gz	QLXKFBCASQKZID-UXHICEINSA-N	0	3	336.435	3.153	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N[C@@H]1CCC[C@H]1OCC	ZINC000452011684	458492430	/nfs/dbraw/zinc/49/24/30/458492430.db2.gz	HDHWKGJHOWTCCH-USXIJHARSA-N	0	3	336.501	3.198	20	30		EGEDHN
CC(C)C[C@@H](CN1CCCC1)NC(=O)c1cc(C#N)ccc1Cl	ZINC000452346814	458499709	/nfs/dbraw/zinc/49/97/09/458499709.db2.gz	XFQXGLXKQPQZKD-HNNXBMFYSA-N	0	3	333.863	3.452	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CCC(F)(F)[C@H](C)C1)C(C)C	ZINC000460129948	458501658	/nfs/dbraw/zinc/50/16/58/458501658.db2.gz	WTNIPSOCVFEADG-HZPDHXFCSA-N	0	3	343.462	3.372	20	30		EGEDHN
CC(C)C[C@@H](CN1CCCC1)NC(=O)[C@H](C#N)CCc1ccccc1	ZINC000452774247	458509655	/nfs/dbraw/zinc/50/96/55/458509655.db2.gz	MRFXKBQZETUZSJ-PMACEKPBSA-N	0	3	341.499	3.386	20	30		EGEDHN
C=CCN1CC[C@@H](NCC2(c3ccc(F)cc3)CCCCC2)C1=O	ZINC000493623121	458515290	/nfs/dbraw/zinc/51/52/90/458515290.db2.gz	MVRWBQUTLVHDQR-GOSISDBHSA-N	0	3	330.447	3.404	20	30		EGEDHN
COC1([C@H](C)NCC#Cc2ccc(C(F)(F)F)cc2)CCOCC1	ZINC000453143363	458520443	/nfs/dbraw/zinc/52/04/43/458520443.db2.gz	DXLZCLSEYDPMEN-AWEZNQCLSA-N	0	3	341.373	3.231	20	30		EGEDHN
CC(C#N)C(=O)N1CCC[C@H](Nc2cccc(Br)c2)C1	ZINC000468575911	458528300	/nfs/dbraw/zinc/52/83/00/458528300.db2.gz	OQMLSIMFPDDLNO-RISCZKNCSA-N	0	3	336.233	3.012	20	30		EGEDHN
CN1CCC2(CCCN2C(=O)c2ccc(C(C)(C)C#N)cc2)CC1	ZINC000373573102	458537254	/nfs/dbraw/zinc/53/72/54/458537254.db2.gz	MEIQXIFJAFOLQP-UHFFFAOYSA-N	0	3	325.456	3.188	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1ncc(Cc2ccccc2Cl)s1	ZINC000424068938	458550703	/nfs/dbraw/zinc/55/07/03/458550703.db2.gz	OJEPSFCBYKNNAY-CQSZACIVSA-N	0	3	348.859	3.347	20	30		EGEDHN
C[C@@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)[C@@H](N)CCCC#N	ZINC000424085929	458555589	/nfs/dbraw/zinc/55/55/89/458555589.db2.gz	CYEYABQQIOZIRY-FZMZJTMJSA-N	0	3	327.350	3.246	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1cccc(COC2CCCCC2)c1	ZINC000424102200	458558845	/nfs/dbraw/zinc/55/88/45/458558845.db2.gz	AOVGZRUTIBPEQN-SFHVURJKSA-N	0	3	329.444	3.496	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1cccc(NC(=O)C2CCCCC2)c1	ZINC000424124810	458564011	/nfs/dbraw/zinc/56/40/11/458564011.db2.gz	PNIMYQLUEAOPIK-QGZVFWFLSA-N	0	3	342.443	3.165	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N1Cc2ccccc2C[C@H]1c1ccccc1	ZINC000424124186	458564488	/nfs/dbraw/zinc/56/44/88/458564488.db2.gz	MAHNLXUKAJEHEL-PMACEKPBSA-N	0	3	333.435	3.334	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCC2(c3ccc(C)cc3C)CC2)CC1	ZINC000454549119	458566454	/nfs/dbraw/zinc/56/64/54/458566454.db2.gz	QAAMHMSBXKBYFG-UHFFFAOYSA-N	0	3	341.499	3.285	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1cccc(CSC2CCOCC2)c1	ZINC000424131081	458566510	/nfs/dbraw/zinc/56/65/10/458566510.db2.gz	USVBFLQQVBJSMV-KRWDZBQOSA-N	0	3	347.484	3.058	20	30		EGEDHN
CCCNc1ccc(C(F)(F)F)cc1NC(=O)[C@@H](N)CCCC#N	ZINC000424148039	458570506	/nfs/dbraw/zinc/57/05/06/458570506.db2.gz	SVRRSZQWCQREGA-LBPRGKRZSA-N	0	3	342.365	3.487	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1ccc(CN2CCc3ccccc32)cc1	ZINC000424156102	458572918	/nfs/dbraw/zinc/57/29/18/458572918.db2.gz	NPFXYBPLNDBKPE-IBGZPJMESA-N	0	3	348.450	3.209	20	30		EGEDHN
CN(Cc1ccccc1)c1ccccc1NC(=O)[C@@H](N)CCCC#N	ZINC000424158629	458574235	/nfs/dbraw/zinc/57/42/35/458574235.db2.gz	RKSZHBNGWBCLKI-KRWDZBQOSA-N	0	3	336.439	3.283	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N1CCC(F)(c2cccc(Cl)c2)CC1	ZINC000424188659	458579628	/nfs/dbraw/zinc/57/96/28/458579628.db2.gz	YJSPSJDVKTVLCB-OAHLLOKOSA-N	0	3	337.826	3.148	20	30		EGEDHN
C=CCC1(CNC(=O)NCC2(SC)CCN(C)CC2)CCCC1	ZINC000454969321	458581461	/nfs/dbraw/zinc/58/14/61/458581461.db2.gz	JAXMQUUIHISMLR-UHFFFAOYSA-N	0	3	339.549	3.250	20	30		EGEDHN
C[C@@H](C(=O)NC[C@@H]1CCCN1Cc1ccccc1)c1cccc(C#N)c1	ZINC000462081604	458592692	/nfs/dbraw/zinc/59/26/92/458592692.db2.gz	CZETZYXFTVLIBM-UTKZUKDTSA-N	0	3	347.462	3.443	20	30		EGEDHN
C[C@@H](CN1CCCCC1)NC(=O)Nc1ccc(CC#N)cc1Cl	ZINC000455760278	458612620	/nfs/dbraw/zinc/61/26/20/458612620.db2.gz	XWQOLZRJFWHJCY-ZDUSSCGKSA-N	0	3	334.851	3.402	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)Nc2ccc(OC(C)(C)C)c(C#N)c2)CCN1C	ZINC000455806690	458615725	/nfs/dbraw/zinc/61/57/25/458615725.db2.gz	YUAXCPXUWGBTBT-CZUORRHYSA-N	0	3	344.459	3.340	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN1CCCC[C@@H]1[C@@H]1C[C@H](C)CC[C@H]1O	ZINC000439006198	458640378	/nfs/dbraw/zinc/64/03/78/458640378.db2.gz	GPWZMWXBCZLEBW-FCGDIQPGSA-N	0	3	336.520	3.063	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1ccc(N(C)C)cc1F)C(C)C	ZINC000502306365	458645376	/nfs/dbraw/zinc/64/53/76/458645376.db2.gz	ZZHVJOJQIGVJNO-IBGZPJMESA-N	0	3	347.478	3.320	20	30		EGEDHN
C=CC1CCN(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000463006004	458671339	/nfs/dbraw/zinc/67/13/39/458671339.db2.gz	FKFSSRUDNOYWSZ-APWZRJJASA-N	0	3	327.472	3.115	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)CCOCC1	ZINC000424604544	458678552	/nfs/dbraw/zinc/67/85/52/458678552.db2.gz	HHQXAKNGYQCGTR-PKOBYXMFSA-N	0	3	342.483	3.311	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N1CCc2ccccc21)C(C)C	ZINC000503430441	458708786	/nfs/dbraw/zinc/70/87/86/458708786.db2.gz	CVRPAYFWKJMFED-IBGZPJMESA-N	0	3	327.472	3.457	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N(C)CCCSC	ZINC000439487624	458715524	/nfs/dbraw/zinc/71/55/24/458715524.db2.gz	SEMSBVCQTCWLAF-AWEZNQCLSA-N	0	3	326.531	3.336	20	30		EGEDHN
CC[C@@](C)(C#N)C(=O)NC[C@@H](C(C)C)N1CCc2ccccc2C1	ZINC000505605759	458745220	/nfs/dbraw/zinc/74/52/20/458745220.db2.gz	FCHAUOWLSRVRBD-ICSRJNTNSA-N	0	3	327.472	3.125	20	30		EGEDHN
C[C@@H](N[C@@H](C)C(=O)NC1(C#N)CCC1)c1ccc(-c2ccncc2)cc1	ZINC000530337198	458750732	/nfs/dbraw/zinc/75/07/32/458750732.db2.gz	UNWFDOGZSKIQCY-CVEARBPZSA-N	0	3	348.450	3.350	20	30		EGEDHN
C=C(C)CN(Cc1ccccc1)C(=O)NC[C@@]1(N(C)C)CCSC1	ZINC000471965076	458756084	/nfs/dbraw/zinc/75/60/84/458756084.db2.gz	CDALGEOXZAXIQE-IBGZPJMESA-N	0	3	347.528	3.212	20	30		EGEDHN
C=CCn1c(-c2ccc(C)s2)nnc1N1CCN(C)[C@@H](C(C)C)C1	ZINC000508861795	458765142	/nfs/dbraw/zinc/76/51/42/458765142.db2.gz	BWGQMYLMEMGHNO-OAHLLOKOSA-N	0	3	345.516	3.277	20	30		EGEDHN
CC(C#N)C(=O)N1CCC(C)(c2cccc(Br)c2)CC1	ZINC000509295542	458771198	/nfs/dbraw/zinc/77/11/98/458771198.db2.gz	UUYDTDUGMLMBEN-LBPRGKRZSA-N	0	3	335.245	3.489	20	30		EGEDHN
CC(C)(CNC(=O)C(C#N)CCc1ccccc1)C1(O)CCCC1	ZINC000456837481	458794889	/nfs/dbraw/zinc/79/48/89/458794889.db2.gz	AEZOJTUKEQMIBM-KRWDZBQOSA-N	0	3	328.456	3.206	20	30		EGEDHN
C=CCc1ccc(OC[C@H](O)CN2CC(C)(C)[C@H]2C2CC2)c(OC)c1	ZINC000515100586	458805568	/nfs/dbraw/zinc/80/55/68/458805568.db2.gz	FNJCFHGACUITAO-YLJYHZDGSA-N	0	3	345.483	3.284	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N(C)Cc1cccc(O)c1)C(C)C	ZINC000515844778	458813595	/nfs/dbraw/zinc/81/35/95/458813595.db2.gz	KITAZLPQCQNRPL-IBGZPJMESA-N	0	3	345.487	3.232	20	30		EGEDHN
Cc1cc(CN2CC[C@H](Oc3ccc(C#N)cn3)C2)cc2cccnc12	ZINC000517478813	458829592	/nfs/dbraw/zinc/82/95/92/458829592.db2.gz	BTTMIJZTHFHOLS-IBGZPJMESA-N	0	3	344.418	3.463	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CCS[C@H](CC)C1)C(C)C	ZINC000465539315	458831504	/nfs/dbraw/zinc/83/15/04/458831504.db2.gz	CSLNLQQPSHKEMI-IAGOWNOFSA-N	0	3	339.549	3.222	20	30		EGEDHN
C=CC[C@@H](CO)N[C@H](C)c1ccc(CNC(=O)OC(C)(C)C)nc1C	ZINC000495377483	458844758	/nfs/dbraw/zinc/84/47/58/458844758.db2.gz	PSIWSJZGVWFEGT-ZBFHGGJFSA-N	0	3	349.475	3.002	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CCC=C(c2cccnc2)C1	ZINC000518394694	458864218	/nfs/dbraw/zinc/86/42/18/458864218.db2.gz	WUZURVPIOTUQKD-GOSISDBHSA-N	0	3	331.419	3.470	20	30		EGEDHN
CC(C)N1CC[C@H](N(C)C(=O)CCCCOc2cccc(C#N)c2)C1	ZINC000457102615	458868460	/nfs/dbraw/zinc/86/84/60/458868460.db2.gz	ACKOTUIRYOADQE-SFHVURJKSA-N	0	3	343.471	3.048	20	30		EGEDHN
Cc1ccc2c(c1)CC[C@@H]2NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000552226881	458891076	/nfs/dbraw/zinc/89/10/76/458891076.db2.gz	RMSDZFASQXLUJK-NQIIRXRSSA-N	0	3	336.435	3.078	20	30		EGEDHN
CCOC(=O)CCCCCN1CCC(C#N)(c2ccccn2)CC1	ZINC000554565003	458899879	/nfs/dbraw/zinc/89/98/79/458899879.db2.gz	RZKDKWLVUIXOIE-UHFFFAOYSA-N	0	3	329.444	3.062	20	30		EGEDHN
C=CC1CCN(C(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)CC1	ZINC000466523323	458904249	/nfs/dbraw/zinc/90/42/49/458904249.db2.gz	VYRDLFDBOHOKBT-QFBILLFUSA-N	0	3	327.472	3.257	20	30		EGEDHN
C[C@@H](NC[C@@H]1CN(C)C(=O)O1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000495726425	458930943	/nfs/dbraw/zinc/93/09/43/458930943.db2.gz	HFADSHGBQPSJCM-AUUYWEPGSA-N	0	3	335.407	3.326	20	30		EGEDHN
C[C@H]1CC[C@@H](CNC(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)C1	ZINC000475476058	458944731	/nfs/dbraw/zinc/94/47/31/458944731.db2.gz	DMVDQOFBQFSYKL-QFBILLFUSA-N	0	3	342.487	3.068	20	30		EGEDHN
N#CC1(CCN2CCC[C@@H](c3nnc4n3CCC4)C2)CCCCC1	ZINC000556811693	459013153	/nfs/dbraw/zinc/01/31/53/459013153.db2.gz	VAYXAHZXZOFFDY-MRXNPFEDSA-N	0	3	327.476	3.268	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N[C@@H]1CCN(C)[C@H](C)C1)c1ccc(F)c(F)c1	ZINC000477048862	459028837	/nfs/dbraw/zinc/02/88/37/459028837.db2.gz	YZJFGFOBRTUGHA-MRRJBJDNSA-N	0	3	337.414	3.364	20	30		EGEDHN
CCC(CC)N(CCOC)[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000567068682	459043146	/nfs/dbraw/zinc/04/31/46/459043146.db2.gz	BYWYGAVFYQNHGO-IBGZPJMESA-N	0	3	343.471	3.191	20	30		EGEDHN
CC(C)CN(Cc1ccc(C#N)cc1)C(=O)NC[C@@H](C)N(C)C1CC1	ZINC000520611722	459078480	/nfs/dbraw/zinc/07/84/80/459078480.db2.gz	VECUBVFFXKBUSX-MRXNPFEDSA-N	0	3	342.487	3.209	20	30		EGEDHN
O=C(NCC#Cc1ccccc1)c1ccc(CN2CCCCC2)cc1	ZINC000557560032	459084802	/nfs/dbraw/zinc/08/48/02/459084802.db2.gz	AOPUZIUJFUIRBC-UHFFFAOYSA-N	0	3	332.447	3.454	20	30		EGEDHN
N#Cc1ccnc(N2CCN(Cc3ccccc3)C3(CCCCC3)C2)n1	ZINC000577816652	459098922	/nfs/dbraw/zinc/09/89/22/459098922.db2.gz	HOAKMAMJPITKQA-UHFFFAOYSA-N	0	3	347.466	3.373	20	30		EGEDHN
Cc1ccccc1C(C)(C)NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000590192643	459099781	/nfs/dbraw/zinc/09/97/81/459099781.db2.gz	LRLFCXLUQLYZDL-GOSISDBHSA-N	0	3	338.451	3.326	20	30		EGEDHN
N#Cc1c(N[C@H]2CCCN3CCCC[C@H]23)nc2cc(Cl)ccn21	ZINC000594600006	459104541	/nfs/dbraw/zinc/10/45/41/459104541.db2.gz	KYWANCYDFJQASW-UONOGXRCSA-N	0	3	329.835	3.288	20	30		EGEDHN
O=C(N[C@@H]1CCN(C2CC2)C1)c1ccc(C#Cc2ccccc2)cc1	ZINC000521225539	459133363	/nfs/dbraw/zinc/13/33/63/459133363.db2.gz	RQOUKHKJVRURBU-HXUWFJFHSA-N	0	3	330.431	3.053	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@](C)(CNC[C@@H](C#N)CCC#N)C1	ZINC000496276131	459133942	/nfs/dbraw/zinc/13/39/42/459133942.db2.gz	QLVRVGYORLXCQY-CRAIPNDOSA-N	0	3	334.464	3.057	20	30		EGEDHN
C[C@H](C1CCN(C)CC1)N(C)C(=O)c1cccc(SCC#N)c1	ZINC000479551737	459147371	/nfs/dbraw/zinc/14/73/71/459147371.db2.gz	WIVUNXMWFULWFF-CQSZACIVSA-N	0	3	331.485	3.105	20	30		EGEDHN
C=CCN(CCc1ccccc1)C[C@H](O)COc1cccc(C)c1	ZINC000521684011	459172473	/nfs/dbraw/zinc/17/24/73/459172473.db2.gz	IDKCAGFXQBLRNC-FQEVSTJZSA-N	0	3	325.452	3.465	20	30		EGEDHN
C=CCCCNCc1nc2c(s1)CN(C(=O)OC(C)(C)C)CC2	ZINC000496429829	459190498	/nfs/dbraw/zinc/19/04/98/459190498.db2.gz	KUWDTNJEHGXEKS-UHFFFAOYSA-N	0	3	337.489	3.492	20	30		EGEDHN
C[S@](=O)[C@H]1CCC[C@H](NCc2cccc(OCCCC#N)c2)C1	ZINC000594962107	459194608	/nfs/dbraw/zinc/19/46/08/459194608.db2.gz	PSQNHNQQYXYFCE-CEXJFXJFSA-N	0	3	334.485	3.148	20	30		EGEDHN
C=CCCS(=O)(=O)NCC(CC)(CC)N[C@H](C)c1ccccc1	ZINC000480979382	459225904	/nfs/dbraw/zinc/22/59/04/459225904.db2.gz	MBHWDPPIXNCXKQ-MRXNPFEDSA-N	0	3	338.517	3.392	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN1CCC[C@H](c2ccc(F)cc2)CC1	ZINC000481426105	459253968	/nfs/dbraw/zinc/25/39/68/459253968.db2.gz	MTUDJPZAXAHPBR-IRXDYDNUSA-N	0	3	345.462	3.403	20	30		EGEDHN
CN(Cc1ccco1)Cc1ccccc1CNC[C@H](C#N)CCC#N	ZINC000559703649	459272826	/nfs/dbraw/zinc/27/28/26/459272826.db2.gz	SRMXMQKZPJYVQZ-KRWDZBQOSA-N	0	3	336.439	3.445	20	30		EGEDHN
N#Cc1ccc(CCN2CCC[C@@H](CNC(=O)c3ccccc3)C2)cc1	ZINC000595342388	459279561	/nfs/dbraw/zinc/27/95/61/459279561.db2.gz	MWKZZVZNHGXOGE-FQEVSTJZSA-N	0	3	347.462	3.243	20	30		EGEDHN
C=CC1CCN(C[C@H](O)COc2cccc(C(F)(F)F)c2)CC1	ZINC000523607677	459316082	/nfs/dbraw/zinc/31/60/82/459316082.db2.gz	PGXYTYOYKPGJJZ-HNNXBMFYSA-N	0	3	329.362	3.343	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NC[C@@H](CC)N1CCc2ccccc2C1)OCC	ZINC000534401106	459324672	/nfs/dbraw/zinc/32/46/72/459324672.db2.gz	FBEPYVOBCUSOAW-UXHICEINSA-N	0	3	344.499	3.311	20	30		EGEDHN
C[C@H](c1cccc(N2CCOC2=O)c1)N(C)Cc1cc(C#N)n(C)c1	ZINC000496832158	459340513	/nfs/dbraw/zinc/34/05/13/459340513.db2.gz	HDYHHDRJNFXNEA-CQSZACIVSA-N	0	3	338.411	3.046	20	30		EGEDHN
CC(C)(CC#N)CNC[C@H](O)COc1cc(Cl)ccc1Cl	ZINC000568873022	459358546	/nfs/dbraw/zinc/35/85/46/459358546.db2.gz	HQAPIRUQMNLJPN-LBPRGKRZSA-N	0	3	331.243	3.263	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2NCc1ccc(-n2cncn2)c(F)c1	ZINC000591357485	459361920	/nfs/dbraw/zinc/36/19/20/459361920.db2.gz	FZQZYVIYPOUOLV-IBGZPJMESA-N	0	3	347.397	3.445	20	30		EGEDHN
C=CCNC(=O)NC(=O)CN[C@@H](c1cccc(Cl)c1)C1CCCC1	ZINC000537132140	459363547	/nfs/dbraw/zinc/36/35/47/459363547.db2.gz	QBEBUZOHYUMXRG-QGZVFWFLSA-N	0	3	349.862	3.173	20	30		EGEDHN
C[C@H](OC[C@H](O)CN1CCC[C@@H](CC#N)C1)c1ccc(Cl)cc1	ZINC000595610477	459364830	/nfs/dbraw/zinc/36/48/30/459364830.db2.gz	ZLCFHEZXGAVKTR-RLFYNMQTSA-N	0	3	336.863	3.404	20	30		EGEDHN
C=CCNC(=O)NC(=O)CN[C@H](c1ccc(Cl)cc1)[C@H](C)CC	ZINC000538214727	459369949	/nfs/dbraw/zinc/36/99/49/459369949.db2.gz	JOLQJJXJQLXSAU-WBMJQRKESA-N	0	3	337.851	3.029	20	30		EGEDHN
CO[C@@H]1CCCC[C@H]1NCC#Cc1ccc(OC(F)(F)F)cc1	ZINC000483699577	459384305	/nfs/dbraw/zinc/38/43/05/459384305.db2.gz	MWCNRRPRZZSWHT-HZPDHXFCSA-N	0	3	327.346	3.484	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@H](N[C@H]3CCc4c3cccc4F)C2=O)cc1	ZINC000540953408	459410119	/nfs/dbraw/zinc/41/01/19/459410119.db2.gz	BDFYAHSMYXUCSW-PMACEKPBSA-N	0	3	349.409	3.470	20	30		EGEDHN
N#Cc1ccc(-c2cc(N3CCN(CC4CC=CC4)CC3)n[nH]2)cc1	ZINC000595730297	459416300	/nfs/dbraw/zinc/41/63/00/459416300.db2.gz	BAEYPJDLFMDCNC-UHFFFAOYSA-N	0	3	333.439	3.037	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2NC(=O)[C@@H]1CCCN1C1CCCC1	ZINC000561089204	459417771	/nfs/dbraw/zinc/41/77/71/459417771.db2.gz	AACBVRGTXSHSKK-PMACEKPBSA-N	0	3	337.467	3.459	20	30		EGEDHN
COc1cc2[nH]c(CCCNC[C@@H](C#N)CCC#N)cc2c(OC)c1	ZINC000569303873	459427041	/nfs/dbraw/zinc/42/70/41/459427041.db2.gz	FZAGJPBGLZFKJI-CQSZACIVSA-N	0	3	340.427	3.151	20	30		EGEDHN
N#Cc1ccc2c(c1)CC[C@@H]2NC[C@@H](O)COc1cccc2[nH]ccc21	ZINC000591764359	459431782	/nfs/dbraw/zinc/43/17/82/459431782.db2.gz	HBJGSKASJKZYJX-UZLBHIALSA-N	0	3	347.418	3.056	20	30		EGEDHN
Cc1cccc(C)c1OC[C@H](O)CNCc1ccc(C#N)c(Cl)c1	ZINC000591765875	459431928	/nfs/dbraw/zinc/43/19/28/459431928.db2.gz	NHKLYPMHOGMGPF-QGZVFWFLSA-N	0	3	344.842	3.358	20	30		EGEDHN
N#C[C@H]1CC[C@H](N2CCC(CNC(=O)OCc3ccccc3)CC2)C1	ZINC000497101120	459438530	/nfs/dbraw/zinc/43/85/30/459438530.db2.gz	TZADVBRXBMZPTI-OALUTQOASA-N	0	3	341.455	3.317	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1N[C@@H](C)C(=O)N[C@@H](C)c1ccc2c(c1)CCCC2	ZINC000569436903	459450255	/nfs/dbraw/zinc/45/02/55/459450255.db2.gz	ZQJISBKGHUVMAW-QPAVJXABSA-N	0	3	342.483	3.064	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]2C1	ZINC000497215257	459490236	/nfs/dbraw/zinc/49/02/36/459490236.db2.gz	QJHPBNOCVBVYLF-ROUUACIJSA-N	0	3	341.455	3.247	20	30		EGEDHN
CCC(CC)(CN[C@H](C)C(=O)NC1(C#N)CCC1)c1ccc(F)cc1	ZINC000596047771	459501354	/nfs/dbraw/zinc/50/13/54/459501354.db2.gz	AGKOHMCQPQYZJP-OAHLLOKOSA-N	0	3	345.462	3.424	20	30		EGEDHN
C[C@H](N[C@@H]1[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]21)c1ccc(C#N)cc1F	ZINC000497247116	459501452	/nfs/dbraw/zinc/50/14/52/459501452.db2.gz	ZBDXUMWXPDBQNG-ZYIUAKIQSA-N	0	3	345.418	3.213	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@@H](N[C@@H]3CCc4ccc(F)cc43)C2=O)cc1	ZINC000541881669	459504609	/nfs/dbraw/zinc/50/46/09/459504609.db2.gz	YKKGFOFOEHQMAJ-WOJBJXKFSA-N	0	3	349.409	3.470	20	30		EGEDHN
N#CCC1CCN(C(=O)NC[C@H](c2cccs2)N2CCCC2)CC1	ZINC000541967336	459514961	/nfs/dbraw/zinc/51/49/61/459514961.db2.gz	UOQQDZDWESBWLH-MRXNPFEDSA-N	0	3	346.500	3.220	20	30		EGEDHN
C[C@@H]1C[C@@H](NC2CCC(Oc3ncccc3C#N)CC2)c2nccn21	ZINC000569901447	459526853	/nfs/dbraw/zinc/52/68/53/459526853.db2.gz	SBFBIZYRBNSANR-LHUBUQBQSA-N	0	3	337.427	3.135	20	30		EGEDHN
N#Cc1cnnc(N(CCN2CCCC2)Cc2ccc(Cl)cc2)c1	ZINC000596163511	459544277	/nfs/dbraw/zinc/54/42/77/459544277.db2.gz	VZTKRUYKGVXEOL-UHFFFAOYSA-N	0	3	341.846	3.104	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H](c2ccc(Cl)cc2)N(C)C)CC1	ZINC000570983652	459562599	/nfs/dbraw/zinc/56/25/99/459562599.db2.gz	OIYTWESDDDIHEF-SFHVURJKSA-N	0	3	349.906	3.099	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1ccc([N+](=O)[O-])c(C)c1)C(C)C	ZINC000498378596	459587908	/nfs/dbraw/zinc/58/79/08/459587908.db2.gz	WAHLYLTWXHMKLP-GOSISDBHSA-N	0	3	345.443	3.332	20	30		EGEDHN
C[C@@H]1C[C@H]1c1ccc(CNC(=O)C(C#N)Cc2ccc(C#N)cc2)o1	ZINC000527159609	459599626	/nfs/dbraw/zinc/59/96/26/459599626.db2.gz	LYCNCJJLJMDDHK-MZMPZRCHSA-N	0	3	333.391	3.273	20	30		EGEDHN
CCN1C[C@H](C)N(CC#Cc2ccc(OC(F)(F)F)cc2)C[C@H]1C	ZINC000498904887	459610180	/nfs/dbraw/zinc/61/01/80/459610180.db2.gz	LNIKHHXCAFRAED-CABCVRRESA-N	0	3	340.389	3.351	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1)C(=O)/C=C\c1cccc(C#N)c1	ZINC000491333570	459616986	/nfs/dbraw/zinc/61/69/86/459616986.db2.gz	GNNPUCUYVHQLNL-QXMHVHEDSA-N	0	3	333.435	3.162	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H]2C[C@H]2c2cccc3ccccc32)CC1	ZINC000491691674	459654289	/nfs/dbraw/zinc/65/42/89/459654289.db2.gz	FWILGPYUXXZOOV-LEWJYISDSA-N	0	3	332.447	3.157	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H](c2ccc(F)c(Cl)c2)C2CC2)CC1	ZINC000491724854	459661416	/nfs/dbraw/zinc/66/14/16/459661416.db2.gz	CQSQNYDPBPEPJM-SFHVURJKSA-N	0	3	348.849	3.392	20	30		EGEDHN
C[C@@H](OC[C@@H](O)CNCC#Cc1ccccc1)c1ccc(Cl)cc1	ZINC000562987052	459687568	/nfs/dbraw/zinc/68/75/68/459687568.db2.gz	UWACKCLAKWUQGZ-UZLBHIALSA-N	0	3	343.854	3.420	20	30		EGEDHN
N#CCCCNC[C@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000563014484	459696121	/nfs/dbraw/zinc/69/61/21/459696121.db2.gz	XARYMIVYVKGSFT-INIZCTEOSA-N	0	3	326.396	3.112	20	30		EGEDHN
CCN1C[C@H](C)N(Cc2cc(C#N)ccc2Br)C[C@@H]1C	ZINC000492585130	459711828	/nfs/dbraw/zinc/71/18/28/459711828.db2.gz	WPXPNLZNLATEGM-STQMWFEESA-N	0	3	336.277	3.235	20	30		EGEDHN
C[C@H]1CN(C(=O)C(C#N)CCc2ccccc2)CC2(CCCC2)O1	ZINC000592904947	459717895	/nfs/dbraw/zinc/71/78/95/459717895.db2.gz	UNVJHMFXEWFNPQ-FUHWJXTLSA-N	0	3	326.440	3.319	20	30		EGEDHN
Cc1cccc2nc(CCNC(=O)C(C#N)CCc3ccccc3)cn21	ZINC000592937844	459720244	/nfs/dbraw/zinc/72/02/44/459720244.db2.gz	HHRCUFSVULCIAQ-GOSISDBHSA-N	0	3	346.434	3.074	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)/C=C\C1CCCC1	ZINC000493380674	459743039	/nfs/dbraw/zinc/74/30/39/459743039.db2.gz	FYJYLNPGOAHSBX-QXMHVHEDSA-N	0	3	325.456	3.195	20	30		EGEDHN
N#Cc1ccc([C@H](N[C@@H]2CCC[C@H]2Cc2ccccc2)C(N)=O)cc1	ZINC000493494764	459747058	/nfs/dbraw/zinc/74/70/58/459747058.db2.gz	AJQIALSSDGRKFT-ZCNNSNEGSA-N	0	3	333.435	3.086	20	30		EGEDHN
COc1ccc(C#N)cc1NC(=O)C(C[C@H]1CCCO1)C(F)(F)F	ZINC000593047252	459752899	/nfs/dbraw/zinc/75/28/99/459752899.db2.gz	XHGMLJNNVHBYMV-NEPJUHHUSA-N	0	3	342.317	3.253	20	30		EGEDHN
CSc1ccc([C@H](CNC(=O)C2(C#N)CC(C)C2)N(C)C)cc1	ZINC000563475507	459765706	/nfs/dbraw/zinc/76/57/06/459765706.db2.gz	TXTDSAIDQXPCNS-MNQCNDSGSA-N	0	3	331.485	3.067	20	30		EGEDHN
CC(C)(C#N)CCCN1CCN(CCCC(C)(C)C#N)[C@@H](CCO)C1	ZINC000564280529	459771899	/nfs/dbraw/zinc/77/18/99/459771899.db2.gz	FBUGJLTVBXTYDW-SFHVURJKSA-N	0	3	348.535	3.015	20	30		EGEDHN
N#CCC[C@H](C#N)CNCC1(c2ccccc2Cl)CCOCC1	ZINC000564600028	459775171	/nfs/dbraw/zinc/77/51/71/459775171.db2.gz	LHMFPMHDFYUUFE-OAHLLOKOSA-N	0	3	331.847	3.421	20	30		EGEDHN
C[C@]1(NC(=O)Nc2ccc(C#N)cc2)CCN(Cc2ccccc2)C1	ZINC000593133148	459784115	/nfs/dbraw/zinc/78/41/15/459784115.db2.gz	CVTZQECLQFESIM-FQEVSTJZSA-N	0	3	334.423	3.344	20	30		EGEDHN
N#CC1(C[C@@H](O)CN2CCC[C@@H](c3nc4ccc(F)cc4o3)C2)CC1	ZINC000528421501	459806784	/nfs/dbraw/zinc/80/67/84/459806784.db2.gz	QUQYLAANEBWDKB-UKRRQHHQSA-N	0	3	343.402	3.201	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)C1CCC2(CC2)CC1	ZINC000596972631	459807294	/nfs/dbraw/zinc/80/72/94/459807294.db2.gz	CTKSUYMUSLAAQW-UHFFFAOYSA-N	0	3	339.483	3.419	20	30		EGEDHN
Cc1ccc2occ(CC(=O)C(C#N)C(=O)NC3CCCCC3)c2c1	ZINC000528922265	459817588	/nfs/dbraw/zinc/81/75/88/459817588.db2.gz	XAVGYYISJCKVAD-QGZVFWFLSA-N	0	3	338.407	3.442	20	30		EGEDHN
CCN1CCN(c2cccc(NC(=O)C(C#N)(CC)CC)c2)CC1	ZINC000529056447	459821992	/nfs/dbraw/zinc/82/19/92/459821992.db2.gz	NDZMLUHHUVLRJS-UHFFFAOYSA-N	0	3	328.460	3.097	20	30		EGEDHN
C[C@@H](CN1CCC(C)CC1)NC(=O)C[C@H](CC#N)c1ccccc1	ZINC000598261302	459841990	/nfs/dbraw/zinc/84/19/90/459841990.db2.gz	QASOSMWSCGYSSW-HKUYNNGSSA-N	0	3	327.472	3.311	20	30		EGEDHN
CC(C)N(CCC#N)C(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000608814389	459886087	/nfs/dbraw/zinc/88/60/87/459886087.db2.gz	RUTDQEJZJZJDJK-KRWDZBQOSA-N	0	3	331.435	3.188	20	30		EGEDHN
COc1cccc([C@H](CNC(=O)CCCCCC#N)N2CCCC2)c1	ZINC000588248604	459937370	/nfs/dbraw/zinc/93/73/70/459937370.db2.gz	VUAIGWUNRPQJOE-IBGZPJMESA-N	0	3	343.471	3.422	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCc1cnccc1C(F)(F)F	ZINC000598571101	459943634	/nfs/dbraw/zinc/94/36/34/459943634.db2.gz	ZUKOPPRHANCTNH-AWEZNQCLSA-N	0	3	347.340	3.489	20	30		EGEDHN
C[C@@H](CCC#N)CN1CCCN(C(=O)CCc2ccccc2)CC1	ZINC000602450987	459945697	/nfs/dbraw/zinc/94/56/97/459945697.db2.gz	MYJLDTDFWDMGPE-SFHVURJKSA-N	0	3	327.472	3.093	20	30		EGEDHN
COc1ccc([C@H]2CCCN2C[C@H](O)CC(C)(C)C#N)cc1OC	ZINC000598584576	459954550	/nfs/dbraw/zinc/95/45/50/459954550.db2.gz	OEWKHLUOHCWAQO-HZPDHXFCSA-N	0	3	332.444	3.141	20	30		EGEDHN
CC(C)n1nccc1CNC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000593693439	459954539	/nfs/dbraw/zinc/95/45/39/459954539.db2.gz	ZMLNKBCQKRKOTN-UHFFFAOYSA-N	0	3	337.471	3.090	20	30		EGEDHN
N#Cc1nc(NC[C@H]2CCCN(Cc3ccccc3)C2)ccc1Cl	ZINC000609449136	459963892	/nfs/dbraw/zinc/96/38/92/459963892.db2.gz	IBQHLEWFKSIRQW-MRXNPFEDSA-N	0	3	340.858	3.353	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN1CCC(c2ccc3cccnc3n2)CC1	ZINC000598622208	459967141	/nfs/dbraw/zinc/96/71/41/459967141.db2.gz	GGWJLHSDLVZHQF-KRWDZBQOSA-N	0	3	338.455	3.110	20	30		EGEDHN
CC(C)[C@@H](NC[C@@H]1CNc2c(C#N)cnn2C1)c1ccc(F)cc1F	ZINC000575399358	459968580	/nfs/dbraw/zinc/96/85/80/459968580.db2.gz	QHSDJFDITIDUHY-SJKOYZFVSA-N	0	3	345.397	3.062	20	30		EGEDHN
N#CCCCCNC(=O)N[C@@H](CN1CCCCC1)c1ccccc1	ZINC000609639958	460001165	/nfs/dbraw/zinc/00/11/65/460001165.db2.gz	YWTPZIRMUQZKBQ-SFHVURJKSA-N	0	3	328.460	3.207	20	30		EGEDHN
C[C@H](CC1(C#N)CCOCC1)N[C@@H](C)c1ccc([S@@](C)=O)cc1	ZINC000602575150	460004175	/nfs/dbraw/zinc/00/41/75/460004175.db2.gz	CBDGJGWNANHKIO-HUYGQZFBSA-N	0	3	334.485	3.174	20	30		EGEDHN
CC(=O)N1CC[C@H](N[C@@H](C)CC2(C#N)CCOCC2)c2ccccc21	ZINC000602578977	460006332	/nfs/dbraw/zinc/00/63/32/460006332.db2.gz	XRJVDOSRLAURBV-YJBOKZPZSA-N	0	3	341.455	3.173	20	30		EGEDHN
Cc1ccc([C@@H](CN[C@H](C)CC2(C#N)CCOCC2)N2CCCC2)o1	ZINC000602585033	460010176	/nfs/dbraw/zinc/01/01/76/460010176.db2.gz	BNDJBLCMJXZWOT-SJLPKXTDSA-N	0	3	345.487	3.414	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N(CC1CC1)c1cccc(C(F)(F)F)c1	ZINC000602593911	460014689	/nfs/dbraw/zinc/01/46/89/460014689.db2.gz	QROQDVWLDWYJLB-HNNXBMFYSA-N	0	3	339.361	3.470	20	30		EGEDHN
C=CCn1c(CC)nnc1N(C)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000575908162	460030781	/nfs/dbraw/zinc/03/07/81/460030781.db2.gz	JXDUSPXFSHHNOG-SFHVURJKSA-N	0	3	339.487	3.127	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)C(=O)NC[C@H](C)N(C)Cc1ccccc1	ZINC000593974820	460036566	/nfs/dbraw/zinc/03/65/66/460036566.db2.gz	GTNNAELAQORXNM-ROUUACIJSA-N	0	3	349.478	3.374	20	30		EGEDHN
COCCOCc1ccc(CN[C@@H](C)CC2(C#N)CCOCC2)cc1	ZINC000602678718	460061626	/nfs/dbraw/zinc/06/16/26/460061626.db2.gz	XZRIVMUQXKJQGU-KRWDZBQOSA-N	0	3	346.471	3.038	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CNCc1cccc(N(C)C)c1	ZINC000576149486	460078935	/nfs/dbraw/zinc/07/89/35/460078935.db2.gz	YZYRHLTVPQHPIR-FQEVSTJZSA-N	0	3	340.467	3.011	20	30		EGEDHN
COc1ccc(F)c(CNC(=O)C(C#N)CCc2ccccc2)c1	ZINC000598909285	460090803	/nfs/dbraw/zinc/09/08/03/460090803.db2.gz	ICYNNIIGMDSRIE-OAHLLOKOSA-N	0	3	326.371	3.223	20	30		EGEDHN
N#Cc1cnc2c(F)ccc(F)c2c1N1CC[C@H](N2CCCCC2)C1	ZINC000610277809	460104133	/nfs/dbraw/zinc/10/41/33/460104133.db2.gz	SWJSMZXKCOESSA-AWEZNQCLSA-N	0	3	342.393	3.449	20	30		EGEDHN
CN(C)Cc1cccc(NC(=O)N[C@@H]2CCc3cc(C#N)ccc32)c1	ZINC000618667689	460119721	/nfs/dbraw/zinc/11/97/21/460119721.db2.gz	HIQLTDBFWJKKJS-LJQANCHMSA-N	0	3	334.423	3.429	20	30		EGEDHN
COc1cccc(OC)c1CNC(=O)C(C#N)CCc1ccccc1	ZINC000597975310	460131699	/nfs/dbraw/zinc/13/16/99/460131699.db2.gz	IQRAKOVJJDKIBZ-INIZCTEOSA-N	0	3	338.407	3.093	20	30		EGEDHN
CN(Cc1ccccc1)[C@H]1CCN(CCOc2ccc(C#N)cc2)C1	ZINC000610433472	460150599	/nfs/dbraw/zinc/15/05/99/460150599.db2.gz	MRCQSZHHEXBEGU-FQEVSTJZSA-N	0	3	335.451	3.143	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)C(=O)NCc1ccccc1CN(C)C	ZINC000594216619	460155366	/nfs/dbraw/zinc/15/53/66/460155366.db2.gz	UFXLFHJYFAFYJK-MRXNPFEDSA-N	0	3	335.451	3.115	20	30		EGEDHN
N#Cc1cnc(Nc2ccc(CCN3CCSCC3)cc2)c(F)c1	ZINC000576605170	460177383	/nfs/dbraw/zinc/17/73/83/460177383.db2.gz	KMAJRNFBGIFQLW-UHFFFAOYSA-N	0	3	342.443	3.427	20	30		EGEDHN
C[C@H](CC(=O)NCCc1ccccc1)N[C@@H]1CCc2cc(C#N)ccc21	ZINC000618801374	460181456	/nfs/dbraw/zinc/18/14/56/460181456.db2.gz	AMMLVTVOUXKQKA-IIBYNOLFSA-N	0	3	347.462	3.273	20	30		EGEDHN
C[C@H](CC(=O)N1CCCCCC1)N[C@H]1CCc2cc(C#N)ccc21	ZINC000618804446	460183186	/nfs/dbraw/zinc/18/31/86/460183186.db2.gz	LKWVLFAICOHWCY-BEFAXECRSA-N	0	3	325.456	3.316	20	30		EGEDHN
CC(C)N(Cc1cccc(F)c1)C[C@H](O)COc1ccccc1C#N	ZINC000599271375	460213617	/nfs/dbraw/zinc/21/36/17/460213617.db2.gz	XEMXFKAVQWWYPL-IBGZPJMESA-N	0	3	342.414	3.348	20	30		EGEDHN
N#CCCCC[C@@H](N)C(=O)N1CCC(c2cccc(F)c2F)CC1	ZINC000594450258	460225454	/nfs/dbraw/zinc/22/54/54/460225454.db2.gz	VXGMYOTZAGOGAC-MRXNPFEDSA-N	0	3	335.398	3.082	20	30		EGEDHN
C/C(=C/c1ccccc1)CN(C)C[C@@H](O)COc1ccccc1C#N	ZINC000599388289	460244383	/nfs/dbraw/zinc/24/43/83/460244383.db2.gz	GFDLQWALKWISRZ-MJLBXUHQSA-N	0	3	336.435	3.333	20	30		EGEDHN
CC(C)(C#N)CCCN[C@H](Cc1ccccc1)[C@@H](O)C(F)(F)F	ZINC000603147491	460255056	/nfs/dbraw/zinc/25/50/56/460255056.db2.gz	YRQSPGHHJKWYEB-HUUCEWRRSA-N	0	3	328.378	3.440	20	30		EGEDHN
COC(=O)[C@@H](C)Oc1ccc(CN[C@H](C)c2cccc(C#N)c2)cc1	ZINC000611442127	460366498	/nfs/dbraw/zinc/36/64/98/460366498.db2.gz	XHJVEUXYRUNPBY-HUUCEWRRSA-N	0	3	338.407	3.349	20	30		EGEDHN
C[C@@H](N[C@H]1CCN(C(=O)C2CCCC2)C1)c1ccc(C#N)c(F)c1	ZINC000611466028	460370335	/nfs/dbraw/zinc/37/03/35/460370335.db2.gz	OHUCDOKMFAWAHH-DYVFJYSZSA-N	0	3	329.419	3.139	20	30		EGEDHN
CC[C@H]1CCCCN1CCNC(=O)NCc1ccc(C#N)c(Cl)c1	ZINC000619757969	460433968	/nfs/dbraw/zinc/43/39/68/460433968.db2.gz	LISVNSHJSZJYCX-INIZCTEOSA-N	0	3	348.878	3.275	20	30		EGEDHN
CC(C)CN(CCc1ccc(F)cc1)CC(=O)N[C@](C)(C#N)C1CC1	ZINC000604493659	460435267	/nfs/dbraw/zinc/43/52/67/460435267.db2.gz	VQTICQOXEKDXBA-HXUWFJFHSA-N	0	3	345.462	3.135	20	30		EGEDHN
CC(C#N)C(=O)N1CC[C@H](Sc2ccc(Br)cc2)C1	ZINC000600216149	460447030	/nfs/dbraw/zinc/44/70/30/460447030.db2.gz	VTVJTUUMYIFILY-MFKMUULPSA-N	0	3	339.258	3.302	20	30		EGEDHN
N#CCc1ccc(CN2CCC[C@H](c3nnc4n3CCCCC4)C2)cc1	ZINC000612059113	460523624	/nfs/dbraw/zinc/52/36/24/460523624.db2.gz	SIGJCCIRUUCVEA-IBGZPJMESA-N	0	3	349.482	3.450	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CCC[C@](C)(C#N)C2)C1	ZINC000612114458	460544439	/nfs/dbraw/zinc/54/44/39/460544439.db2.gz	GKRVLUAATNYQQD-YVWKXTFCSA-N	0	3	340.471	3.157	20	30		EGEDHN
CN(Cc1ccccc1)[C@H]1CCN(C(=O)c2ccccc2CC#N)C1	ZINC000601255308	460766662	/nfs/dbraw/zinc/76/66/62/460766662.db2.gz	BINIUTPYPXZBAV-IBGZPJMESA-N	0	3	333.435	3.099	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)c1ccccc1CC#N	ZINC000601279967	460774958	/nfs/dbraw/zinc/77/49/58/460774958.db2.gz	LKYCREZTTXTGNM-UWJYYQICSA-N	0	3	347.462	3.393	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN1CCC[C@@H](C(=O)c2ccc(F)cc2)C1	ZINC000621258660	460964311	/nfs/dbraw/zinc/96/43/11/460964311.db2.gz	UREYTFWIHNTFRI-NVXWUHKLSA-N	0	3	332.419	3.021	20	30		EGEDHN
C=CCN(C(=O)N[C@H](CN1CCCC1)c1ccccc1)[C@H](C)COC	ZINC000663644519	461732096	/nfs/dbraw/zinc/73/20/96/461732096.db2.gz	XMQRYQHKGROPID-IEBWSBKVSA-N	0	3	345.487	3.056	20	30		EGEDHN
C=CCOc1cccc(NC(=O)N[C@@H]2CCCN3CCCC[C@@H]23)c1	ZINC000653953291	461958883	/nfs/dbraw/zinc/95/88/83/461958883.db2.gz	XITBUIXIYWNBRM-MSOLQXFVSA-N	0	3	329.444	3.390	20	30		EGEDHN
C=C(CNC[C@@H](O)Cn1cnc2cc(C)c(C)cc21)c1ccccc1	ZINC000644647318	462021431	/nfs/dbraw/zinc/02/14/31/462021431.db2.gz	OJTJTFWVFUMCTA-LJQANCHMSA-N	0	3	335.451	3.317	20	30		EGEDHN
CC[C@H](C)N(CC)CC(=O)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000661108332	462106490	/nfs/dbraw/zinc/10/64/90/462106490.db2.gz	RWJRIYIZZPDUAK-AWEZNQCLSA-N	0	3	340.389	3.294	20	30		EGEDHN
C=CCCCCNC(=O)N1CC[C@H](N(C)CCc2ccccc2)C1	ZINC000664699530	462153290	/nfs/dbraw/zinc/15/32/90/462153290.db2.gz	XHBBWGCPTBZSRS-IBGZPJMESA-N	0	3	329.488	3.301	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cccc(Br)c2)CC1	ZINC000171739341	526440949	/nfs/dbraw/zinc/44/09/49/526440949.db2.gz	MKWHMURVIOJNLC-UHFFFAOYSA-N	0	3	338.249	3.221	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2nc3c(s2)CCCC3)CC1	ZINC000171548247	526596383	/nfs/dbraw/zinc/59/63/83/526596383.db2.gz	HJPPMNNYWMPGDL-UHFFFAOYSA-N	0	3	334.489	3.184	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cnn(CC(C)C)c2CC)CC1	ZINC000127760681	546772744	/nfs/dbraw/zinc/77/27/44/546772744.db2.gz	VYOGTKCXXVFEMA-UHFFFAOYSA-N	0	3	347.507	3.264	20	30		EGEDHN
CN(C[C@@H]1CCN(Cc2cccc(C#N)c2)C1)C(=O)OC(C)(C)C	ZINC000170918151	546995548	/nfs/dbraw/zinc/99/55/48/546995548.db2.gz	CGNUVAAJFNWOSK-KRWDZBQOSA-N	0	3	329.444	3.247	20	30		EGEDHN
CCc1ocnc1C(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000329777101	547507011	/nfs/dbraw/zinc/50/70/11/547507011.db2.gz	KHNANUGDVXDXKV-UHFFFAOYSA-N	0	3	337.489	3.293	20	30		EGEDHN
C=CCC[C@H](C(=O)N1CCN(c2ccncc2)CC1)c1ccccc1	ZINC000681668355	550025348	/nfs/dbraw/zinc/02/53/48/550025348.db2.gz	ZMCADNTVWUKTHF-FQEVSTJZSA-N	0	3	335.451	3.480	20	30		EGEDHN
C[C@@H](CNC(=O)N(Cc1ccc(C#N)cc1)C1CC1)N1CCCCC1	ZINC000727601103	574677599	/nfs/dbraw/zinc/67/75/99/574677599.db2.gz	QHTOYDYFMWAVNK-INIZCTEOSA-N	0	3	340.471	3.107	20	30		EGEDHN
C#CCNC(=O)CNC(CC)(CC)c1ccc(Cl)c(Cl)c1	ZINC000730934140	575037488	/nfs/dbraw/zinc/03/74/88/575037488.db2.gz	SSNHYCNRZACESP-UHFFFAOYSA-N	0	3	327.255	3.348	20	30		EGEDHN
CCOCCC[N@@H+]1CC[C@H](/N=C\c2ccc(OCC)cc2[O-])[C@H](C)C1	ZINC000734366169	575474515	/nfs/dbraw/zinc/47/45/15/575474515.db2.gz	HAYACCHDYICEGX-APTOIRPBSA-N	0	3	348.487	3.347	20	30		EGEDHN
CCOCCC[N@H+]1CC[C@H](/N=C\c2ccc(OCC)cc2[O-])[C@H](C)C1	ZINC000734366169	575474516	/nfs/dbraw/zinc/47/45/16/575474516.db2.gz	HAYACCHDYICEGX-APTOIRPBSA-N	0	3	348.487	3.347	20	30		EGEDHN
COCC#CCN[C@@H](Cc1ccc(F)cc1)c1ccc(OC)cc1	ZINC000678760140	576170671	/nfs/dbraw/zinc/17/06/71/576170671.db2.gz	MFLVCYXWRQIJKR-FQEVSTJZSA-N	0	3	327.399	3.358	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cc1	ZINC000741551080	576700105	/nfs/dbraw/zinc/70/01/05/576700105.db2.gz	SPQANFZUSCZVNW-FXAWDEMLSA-N	0	3	348.446	3.264	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cc1	ZINC000741551083	576700137	/nfs/dbraw/zinc/70/01/37/576700137.db2.gz	SPQANFZUSCZVNW-YLJYHZDGSA-N	0	3	348.446	3.264	20	30		EGEDHN
CON=Cc1ccc(C(=O)NC[C@H](c2ccc(C)cc2)N(C)C)cc1	ZINC000742401244	576779647	/nfs/dbraw/zinc/77/96/47/576779647.db2.gz	AKACJBPYWVEWIS-LJQANCHMSA-N	0	3	339.439	3.008	20	30		EGEDHN
C#CCOc1cc(F)ccc1NC(=O)NC[C@@H](C)N1CCC[C@H](C)C1	ZINC000743195589	576803028	/nfs/dbraw/zinc/80/30/28/576803028.db2.gz	YJZGJLCWCNGYAN-LSDHHAIUSA-N	0	3	347.434	3.080	20	30		EGEDHN
C#CCOc1cc(F)ccc1NC(=O)NCC(C)(C)N1CCCCC1	ZINC000743199399	576803148	/nfs/dbraw/zinc/80/31/48/576803148.db2.gz	ZFIKSHLPKPRWEJ-UHFFFAOYSA-N	0	3	347.434	3.224	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)[C@H](C)c2ccc(C)o2)cc1	ZINC000744033716	576819321	/nfs/dbraw/zinc/81/93/21/576819321.db2.gz	VRGOLRILXKSZRB-IUODEOHRSA-N	0	3	326.352	3.048	20	30		EGEDHN
C#CCNC(=O)[C@@H](C)N[C@H](Cc1ccccc1Cl)c1ccccc1	ZINC000745175782	576843012	/nfs/dbraw/zinc/84/30/12/576843012.db2.gz	JNDALKLBHIZMPE-DNVCBOLYSA-N	0	3	340.854	3.351	20	30		EGEDHN
CC(=NN=C1CCN(CCc2ccc(F)cc2)CC1)c1cnccn1	ZINC000745202325	576843479	/nfs/dbraw/zinc/84/34/79/576843479.db2.gz	XALDLFVHZMJJOY-UHFFFAOYSA-N	0	3	339.418	3.119	20	30		EGEDHN
Cc1cc(C(=O)CON=C(N)CC(C)C)c(C)n1-c1nccs1	ZINC000065204257	1292075514	/nfs/dbraw/zinc/07/55/14/1292075514.db2.gz	LCFITJSCPVQVGU-UHFFFAOYSA-N	0	3	334.445	3.068	20	30		EGEDHN
N#CC(C(=O)C1CCN(c2nc3ccccc3o2)CC1)c1ccccn1	ZINC000073970726	1292330862	/nfs/dbraw/zinc/33/08/62/1292330862.db2.gz	UYGPKXLFVVWVEI-OAHLLOKOSA-N	0	3	346.390	3.316	20	30		EGEDHN
C#CC[C@@H](NC[C@H]1CN(C2CCCCC2)C(=O)O1)c1ccccc1	ZINC000828154984	1292437080	/nfs/dbraw/zinc/43/70/80/1292437080.db2.gz	IASBCSJWSHYAIU-RBUKOAKNSA-N	0	3	326.440	3.494	20	30		EGEDHN
CCCC(=O)N1CCC[C@H]1C(=O)C(C#N)c1nc(C(C)C)cs1	ZINC000080451730	1292604651	/nfs/dbraw/zinc/60/46/51/1292604651.db2.gz	KPMFLKMDHIPINZ-JSGCOSHPSA-N	0	3	333.457	3.234	20	30		EGEDHN
C#CC1CCN(CCc2nc3sc4c(c3c(N)n2)CCCC4)CC1	ZINC000830345848	1292710571	/nfs/dbraw/zinc/71/05/71/1292710571.db2.gz	VWCIFTLYWXCKLF-UHFFFAOYSA-N	0	3	340.496	3.040	20	30		EGEDHN
C#CCOc1ccc([C@H](C)NCc2ccc([S@@](C)=O)cc2)cc1	ZINC000090221439	1292791645	/nfs/dbraw/zinc/79/16/45/1292791645.db2.gz	TXTJIRVTXNKUBO-WNSKOXEYSA-N	0	3	327.449	3.287	20	30		EGEDHN
COc1ccc(CNC(=O)C(C#N)C(=O)CCCC(C)(C)C)cc1	ZINC000103640090	1293011037	/nfs/dbraw/zinc/01/10/37/1293011037.db2.gz	WNDOKWONBGSQEN-MRXNPFEDSA-N	0	3	330.428	3.237	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)CCCc2ccccc2)c1	ZINC000105261600	1293031060	/nfs/dbraw/zinc/03/10/60/1293031060.db2.gz	IXSRMJRQUVHFCM-GOSISDBHSA-N	0	3	336.391	3.365	20	30		EGEDHN
CO[C@@](C)(C(=O)C(C#N)c1nc2ccccc2n1C)c1ccccc1	ZINC000106982423	1293056025	/nfs/dbraw/zinc/05/60/25/1293056025.db2.gz	BSKIHZQJUCPCAU-FOIQADDNSA-N	0	3	333.391	3.311	20	30		EGEDHN
C#Cc1cccc(CN[C@H](CN2CCOCC2)c2ccccc2C)c1	ZINC000834904635	1293171462	/nfs/dbraw/zinc/17/14/62/1293171462.db2.gz	ZXJXTRFMBYSQAX-JOCHJYFZSA-N	0	3	334.463	3.139	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)C[C@@H]1OCCc2ccccc21	ZINC000115902595	1293196901	/nfs/dbraw/zinc/19/69/01/1293196901.db2.gz	CURATDNICYEOMM-HKUYNNGSSA-N	0	3	342.439	3.096	20	30		EGEDHN
CC(C)CN(Cc1cnn(C)c1)Cc1ccc(O[C@@H](C)C#N)cc1	ZINC000835076143	1293202343	/nfs/dbraw/zinc/20/23/43/1293202343.db2.gz	DLALQVWZHTYHDU-INIZCTEOSA-N	0	3	326.444	3.369	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)c2cc(C)cc([N+](=O)[O-])c2)c1	ZINC000121770047	1293389156	/nfs/dbraw/zinc/38/91/56/1293389156.db2.gz	XCEJPVTWEMRFEG-MRXNPFEDSA-N	0	3	337.335	3.173	20	30		EGEDHN
C=C(Br)CN[C@](C)(CNC(=O)OC(C)(C)C)C(C)C	ZINC000121857997	1293393146	/nfs/dbraw/zinc/39/31/46/1293393146.db2.gz	KARZFTQDFLLKCE-CQSZACIVSA-N	0	3	335.286	3.424	20	30		EGEDHN
COc1cc(Cl)c(C)cc1NC(=O)C(C#N)C(=O)Cc1ccoc1	ZINC000123614750	1293449831	/nfs/dbraw/zinc/44/98/31/1293449831.db2.gz	DFJBKONUNNFQGE-LBPRGKRZSA-N	0	3	346.770	3.140	20	30		EGEDHN
N#CC(C(=O)Nc1ccccn1)C(=O)c1ccc(Cl)c(Cl)c1	ZINC000125153833	1293497516	/nfs/dbraw/zinc/49/75/16/1293497516.db2.gz	RPGPHIHSNPUKSO-SNVBAGLBSA-N	0	3	334.162	3.350	20	30		EGEDHN
COc1ccc([C@H](CCO)NCc2ccc(O[C@@H](C)C#N)cc2)cc1	ZINC000128725632	1293602293	/nfs/dbraw/zinc/60/22/93/1293602293.db2.gz	KYASBIYSXVTIKZ-YWZLYKJASA-N	0	3	340.423	3.199	20	30		EGEDHN
N#CC(C(=O)CCc1ccc(-c2ccccc2F)o1)C(=O)NC1CC1	ZINC000129282700	1293619524	/nfs/dbraw/zinc/61/95/24/1293619524.db2.gz	RGOVJLNENFWWSU-HNNXBMFYSA-N	0	3	340.354	3.006	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)CCc1ccc(Cl)cc1Cl	ZINC000130951046	1293673404	/nfs/dbraw/zinc/67/34/04/1293673404.db2.gz	VXTULUFMWMINFO-GFCCVEGCSA-N	0	3	327.211	3.159	20	30		EGEDHN
N#CC(C(=O)CCc1nc(C2CCCC2)no1)c1nc2ccccc2[nH]1	ZINC000134964603	1293785305	/nfs/dbraw/zinc/78/53/05/1293785305.db2.gz	NFJJMINHTACBMF-ZDUSSCGKSA-N	0	3	349.394	3.413	20	30		EGEDHN
N#CCCCOC(=O)C1CCN(c2cc(Cl)ccc2Cl)C1=O	ZINC000149189571	1293885951	/nfs/dbraw/zinc/88/59/51/1293885951.db2.gz	RFYKKZFKMVJFBZ-LLVKDONJSA-N	0	3	341.194	3.193	20	30		EGEDHN
CC[C@@H](C)OCC(=O)C(C#N)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000152367525	1293965029	/nfs/dbraw/zinc/96/50/29/1293965029.db2.gz	ZPYMRVOZPJFVGK-RNCFNFMXSA-N	0	3	343.210	3.456	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)C[C@H](C)SC)cc1Cl	ZINC000156353459	1294139423	/nfs/dbraw/zinc/13/94/23/1294139423.db2.gz	MSFUIMHQGUJPEQ-GXSJLCMTSA-N	0	3	340.832	3.138	20	30		EGEDHN
CC[C@@H](SC)C(=O)C(C#N)C(=O)Nc1ccc(OC)c(Cl)c1	ZINC000156512997	1294147523	/nfs/dbraw/zinc/14/75/23/1294147523.db2.gz	SBKSATGFKWGXGK-ZWNOBZJWSA-N	0	3	340.832	3.138	20	30		EGEDHN
FC(F)(F)Oc1ccc(C#CCN2CC[C@@H]3OCCC[C@@H]3C2)cc1	ZINC000157286034	1294173847	/nfs/dbraw/zinc/17/38/47/1294173847.db2.gz	ZOTSCDHHSHXVAS-WBVHZDCISA-N	0	3	339.357	3.438	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@@H](C)Oc1ccc(SC)cc1	ZINC000158680100	1294210775	/nfs/dbraw/zinc/21/07/75/1294210775.db2.gz	ULRATGVGYUQHIC-CZUORRHYSA-N	0	3	348.468	3.191	20	30		EGEDHN
C#Cc1cccc(NC(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)c1	ZINC000160348740	1294266145	/nfs/dbraw/zinc/26/61/45/1294266145.db2.gz	GICTXTZJPKIALU-OXJNMPFZSA-N	0	3	333.435	3.452	20	30		EGEDHN
C#Cc1cccc(NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)c1	ZINC000161648014	1294297641	/nfs/dbraw/zinc/29/76/41/1294297641.db2.gz	ASNQIWSFOXJUHA-UZLBHIALSA-N	0	3	333.435	3.310	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(Cl)cc1Cl)C(=O)[C@H]1CCCOC1	ZINC000171036694	1294391541	/nfs/dbraw/zinc/39/15/41/1294391541.db2.gz	RQAKUCCKIHXMHH-ONGXEEELSA-N	0	3	341.194	3.067	20	30		EGEDHN
C[C@@H](CCc1cccc(F)c1)C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000174012041	1294476998	/nfs/dbraw/zinc/47/69/98/1294476998.db2.gz	UFEIKKFEDXMBSQ-XJKSGUPXSA-N	0	3	339.370	3.137	20	30		EGEDHN
COc1cc(CNCc2ccc(OC)c(C#N)c2)c2ccccc2n1	ZINC000174582278	1294508443	/nfs/dbraw/zinc/50/84/43/1294508443.db2.gz	CWCKRTXEOGQORH-UHFFFAOYSA-N	0	3	333.391	3.413	20	30		EGEDHN
COc1ccc([C@@H](C)CC(=O)C(C#N)C(=O)NC2CCCCC2)cc1	ZINC000175103617	1294539412	/nfs/dbraw/zinc/53/94/12/1294539412.db2.gz	PRYXCNZNFBKTSN-KSSFIOAISA-N	0	3	342.439	3.347	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)C[C@H](C)c1cccc(OC)c1	ZINC000175940370	1294580772	/nfs/dbraw/zinc/58/07/72/1294580772.db2.gz	BDIHWGDPFZOLBK-WMLDXEAASA-N	0	3	330.428	3.204	20	30		EGEDHN
N#CC(C(=O)CC[C@@H]1CCOC1)C(=O)Nc1cccc2ccccc21	ZINC000176092480	1294590170	/nfs/dbraw/zinc/59/01/70/1294590170.db2.gz	KALBUSSCGOSTFT-RHSMWYFYSA-N	0	3	336.391	3.304	20	30		EGEDHN
N#CC(C(=O)CC[C@H]1CCOC1)c1nc2ccccc2n1C(F)F	ZINC000176100195	1294591123	/nfs/dbraw/zinc/59/11/23/1294591123.db2.gz	QGABUFOTFUMPAO-NWDGAFQWSA-N	0	3	333.338	3.424	20	30		EGEDHN
CC(C)c1csc(C(C#N)C(=O)c2ccc(N)c([N+](=O)[O-])c2)n1	ZINC000177753011	1294691580	/nfs/dbraw/zinc/69/15/80/1294691580.db2.gz	RYCMJGZLKMWMET-JTQLQIEISA-N	0	3	330.369	3.247	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)c1cc2nc(C)ccc2o1	ZINC000179616880	1294808144	/nfs/dbraw/zinc/80/81/44/1294808144.db2.gz	UZHYYHAPIMKDAV-LBPRGKRZSA-N	0	3	349.346	3.106	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)C(=O)N1CCCC1)Cc1ccc(Cl)cc1	ZINC000179787906	1294828874	/nfs/dbraw/zinc/82/88/74/1294828874.db2.gz	NHLLIZXKHNIZQP-CZUORRHYSA-N	0	3	332.831	3.240	20	30		EGEDHN
C=CCNC(=O)CNCc1ccc(N(CC)Cc2ccccc2)cc1	ZINC000181127491	1294940160	/nfs/dbraw/zinc/94/01/60/1294940160.db2.gz	DLNQIYFOYUYGLO-UHFFFAOYSA-N	0	3	337.467	3.105	20	30		EGEDHN
COc1ccc(OC)c(CC(=O)C(C#N)c2nc3ccccc3o2)c1	ZINC000193622091	1295893959	/nfs/dbraw/zinc/89/39/59/1295893959.db2.gz	GYERBFFCMAKVKB-AWEZNQCLSA-N	0	3	336.347	3.264	20	30		EGEDHN
C=CCN(Cc1cc(Br)ccc1F)C(=O)[C@H](N)CCC	ZINC000236899450	1296211158	/nfs/dbraw/zinc/21/11/58/1296211158.db2.gz	AYIRYJVQTPECEN-CQSZACIVSA-N	0	3	343.240	3.230	20	30		EGEDHN
COc1ccc(CNCc2ccc(O[C@H](C)C#N)cc2)cc1OC	ZINC000237236559	1296229539	/nfs/dbraw/zinc/22/95/39/1296229539.db2.gz	UWQCZQVCQRUJMC-CQSZACIVSA-N	0	3	326.396	3.284	20	30		EGEDHN
C#CCN(C[C@@H](O)COCc1cccs1)[C@H]1CCc2ccccc21	ZINC000245466398	1296309061	/nfs/dbraw/zinc/30/90/61/1296309061.db2.gz	JFILJHRSDMAIJM-XLIONFOSSA-N	0	3	341.476	3.248	20	30		EGEDHN
C=CCC(C)(C)C(=O)Nc1cccc2c1CCN(CC(C)(C)O)C2	ZINC000346429815	1297340916	/nfs/dbraw/zinc/34/09/16/1297340916.db2.gz	WUWISUUUXQBAMI-UHFFFAOYSA-N	0	3	330.472	3.356	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@@H](CNC(=O)OC(C)(C)C)C1	ZINC000724068131	1298346325	/nfs/dbraw/zinc/34/63/25/1298346325.db2.gz	JYLRBFIOIVXHMT-NEPJUHHUSA-N	0	3	333.270	3.178	20	30		EGEDHN
COc1cc(Br)cc(C[NH2+]Cc2ccc(C#N)cc2)c1[O-]	ZINC000725845705	1298374504	/nfs/dbraw/zinc/37/45/04/1298374504.db2.gz	HYYGDFWJCXRVCW-UHFFFAOYSA-N	0	3	347.212	3.325	20	30		EGEDHN
C#CCN(C[C@@H](O)COCc1ccccc1)[C@@H]1CCc2ccccc21	ZINC000747528045	1298795301	/nfs/dbraw/zinc/79/53/01/1298795301.db2.gz	HVMMOESLKWZKDU-IFMALSPDSA-N	0	3	335.447	3.187	20	30		EGEDHN
C=C(Cl)C[C@@H](N)C(=O)N1CCc2nc(-c3ccccc3)sc2C1	ZINC000876963342	1299090455	/nfs/dbraw/zinc/09/04/55/1299090455.db2.gz	MLEDXAWMZXOHAR-CYBMUJFWSA-N	0	3	347.871	3.165	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@@H]2C[C@H](NCC3(C#N)CC3)CC[C@@H]21	ZINC000877493530	1299344845	/nfs/dbraw/zinc/34/48/45/1299344845.db2.gz	FDYBXNAHGMIOSL-OAGGEKHMSA-N	0	3	333.476	3.448	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)OC(C)(C)C)CN1Cc1ccc(CC#N)cc1	ZINC000879226485	1300437264	/nfs/dbraw/zinc/43/72/64/1300437264.db2.gz	PJIGCFPUYQNXST-PBHICJAKSA-N	0	3	329.444	3.240	20	30		EGEDHN
COc1ccc(NC(=O)N2CCN(C3CCCCC3)CC2)cc1C#N	ZINC000880877316	1301309653	/nfs/dbraw/zinc/30/96/53/1301309653.db2.gz	DWEHRTVLELKFNS-UHFFFAOYSA-N	0	3	342.443	3.049	20	30		EGEDHN
CCO[C@H](CC(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1)C(C)C	ZINC000761037277	1301385391	/nfs/dbraw/zinc/38/53/91/1301385391.db2.gz	FBEMJMJPYZMTER-GOEBONIOSA-N	0	3	336.819	3.439	20	30		EGEDHN
C#CCN(C(=O)NC[C@@H](c1ccccc1)N1CCC(C)CC1)C1CC1	ZINC000764685737	1302117118	/nfs/dbraw/zinc/11/71/18/1302117118.db2.gz	UDUCTOUXMHSMSH-FQEVSTJZSA-N	0	3	339.483	3.267	20	30		EGEDHN
C=CC[C@H](N[C@H](C)c1cccc(NS(C)(=O)=O)c1)c1ccncc1	ZINC000766017383	1302370748	/nfs/dbraw/zinc/37/07/48/1302370748.db2.gz	AYDLMCAQTXYUAS-KDOFPFPSSA-N	0	3	345.468	3.421	20	30		EGEDHN
N#Cc1c2c(cn(CN(CC3CC3)C3CCCCC3)c1=O)CCC2	ZINC000766619318	1302490892	/nfs/dbraw/zinc/49/08/92/1302490892.db2.gz	JFJYNXROUWDWED-UHFFFAOYSA-N	0	3	325.456	3.211	20	30		EGEDHN
C=CC[C@H](NC(=O)N1CCN(C2CCCCC2)CC1)c1ccncc1	ZINC000767020110	1302564571	/nfs/dbraw/zinc/56/45/71/1302564571.db2.gz	WMQYCOHSPJTDNB-IBGZPJMESA-N	0	3	342.487	3.359	20	30		EGEDHN
C#CCSCCNCc1ccc(OC)cc1OCc1cccnc1	ZINC000767688210	1302745822	/nfs/dbraw/zinc/74/58/22/1302745822.db2.gz	BTWYFZCCLAESHJ-UHFFFAOYSA-N	0	3	342.464	3.125	20	30		EGEDHN
Cc1oc2ccccc2c1CC(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000767956190	1302792815	/nfs/dbraw/zinc/79/28/15/1302792815.db2.gz	NIZGVXFHSOPJGJ-OAHLLOKOSA-N	0	3	333.347	3.026	20	30		EGEDHN
Cc1cccc(C)c1[C@@H]1CCCN1C(=O)C1CC2(C1)CNC[C@@H]2C#N	ZINC000884398033	1302840238	/nfs/dbraw/zinc/84/02/38/1302840238.db2.gz	UMHPAWRRXWITCJ-KQNFGGRRSA-N	0	3	337.467	3.106	20	30		EGEDHN
C[C@@H]1CN(CCCCNc2nc3ccccc3cc2C#N)C[C@@H](C)O1	ZINC000768532649	1302927707	/nfs/dbraw/zinc/92/77/07/1302927707.db2.gz	CUNSPXVFMCZWFO-HZPDHXFCSA-N	0	3	338.455	3.408	20	30		EGEDHN
N#Cc1ccccc1N1CCCN(Cc2ccc3c(c2)COC3)CC1	ZINC000768768202	1302974165	/nfs/dbraw/zinc/97/41/65/1302974165.db2.gz	IQGMPQGRFCVRBP-UHFFFAOYSA-N	0	3	333.435	3.301	20	30		EGEDHN
CN1CCN(c2ccc(C=NNCc3cccc(Cl)c3)cc2)CC1	ZINC000771558262	1303420153	/nfs/dbraw/zinc/42/01/53/1303420153.db2.gz	YUYHQKSMDVSCCW-UHFFFAOYSA-N	0	3	342.874	3.216	20	30		EGEDHN
CCCN(Cc1ccccc1O)[C@H]1CCN(c2ccc(C#N)cc2)C1=O	ZINC000772797145	1303577189	/nfs/dbraw/zinc/57/71/89/1303577189.db2.gz	DGQLHIUZNCAUQW-IBGZPJMESA-N	0	3	349.434	3.281	20	30		EGEDHN
CCC[N@H+](Cc1ccccc1[O-])[C@H]1CCN(c2ccc(C#N)cc2)C1=O	ZINC000772797145	1303577196	/nfs/dbraw/zinc/57/71/96/1303577196.db2.gz	DGQLHIUZNCAUQW-IBGZPJMESA-N	0	3	349.434	3.281	20	30		EGEDHN
CCC[N@@H+](Cc1ccccc1[O-])[C@H]1CCN(c2ccc(C#N)cc2)C1=O	ZINC000772797145	1303577201	/nfs/dbraw/zinc/57/72/01/1303577201.db2.gz	DGQLHIUZNCAUQW-IBGZPJMESA-N	0	3	349.434	3.281	20	30		EGEDHN
C#CCCCCC(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1	ZINC000773318686	1303661481	/nfs/dbraw/zinc/66/14/81/1303661481.db2.gz	DEXQXLAYUNRXPZ-UHFFFAOYSA-N	0	3	327.472	3.349	20	30		EGEDHN
C[C@@H](N[C@@H](C)c1ccc(N(C)C)cc1)C(=O)Nc1ccccc1C#N	ZINC000774482876	1303815111	/nfs/dbraw/zinc/81/51/11/1303815111.db2.gz	IHHDNJZTXKHCIS-LSDHHAIUSA-N	0	3	336.439	3.302	20	30		EGEDHN
C[C@@H](N[C@@H]1CCN(c2ccc(C#N)cc2)C1=O)c1ccc(N(C)C)cc1	ZINC000774487386	1303816588	/nfs/dbraw/zinc/81/65/88/1303816588.db2.gz	ZZNOQVLOLIKDRC-FOIQADDNSA-N	0	3	348.450	3.080	20	30		EGEDHN
N#Cc1cccc(C2(NC[C@H](O)COc3ccc(Cl)cc3)CC2)c1	ZINC000775430696	1303962598	/nfs/dbraw/zinc/96/25/98/1303962598.db2.gz	HSACUPLPZFCMDM-KRWDZBQOSA-N	0	3	342.826	3.230	20	30		EGEDHN
C#C[C@H](N[C@@H](C)CC(=O)Nc1cc(Cl)ccc1C)[C@H]1CCCO1	ZINC000775574358	1303988427	/nfs/dbraw/zinc/98/84/27/1303988427.db2.gz	PHNWIRIYBSIMRX-JLJPHGGASA-N	0	3	334.847	3.136	20	30		EGEDHN
N#Cc1ccc(F)c(NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000888351877	1304127208	/nfs/dbraw/zinc/12/72/08/1304127208.db2.gz	AWGISLHVRWSHHO-INIZCTEOSA-N	0	3	338.386	3.093	20	30		EGEDHN
N#C[C@@H](OC(=O)C1CCN(c2ccc(F)cc2)C1=O)C1CCCCC1	ZINC000776378033	1304144241	/nfs/dbraw/zinc/14/42/41/1304144241.db2.gz	HYCSMEYRDPWMPK-DLBZAZTESA-N	0	3	344.386	3.194	20	30		EGEDHN
C[C@H](NCCNC(=O)c1ccc(Cl)cc1)c1ccc(C#N)c(F)c1	ZINC000776731708	1304189631	/nfs/dbraw/zinc/18/96/31/1304189631.db2.gz	CNVFNMDVJBBFGY-LBPRGKRZSA-N	0	3	345.805	3.431	20	30		EGEDHN
COc1ccc(C(C)=NNCCOC(C)C)cc1CN1CCCCC1	ZINC000778551310	1304465065	/nfs/dbraw/zinc/46/50/65/1304465065.db2.gz	JYVGNLAXVOJTFH-UHFFFAOYSA-N	0	3	347.503	3.420	20	30		EGEDHN
CCCN(C(=O)CSCC#N)C1CCN(Cc2ccccc2)CC1	ZINC000889490691	1304501575	/nfs/dbraw/zinc/50/15/75/1304501575.db2.gz	CCULPFOWFREDSB-UHFFFAOYSA-N	0	3	345.512	3.146	20	30		EGEDHN
C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NCc1cc(C#N)ccc1F	ZINC000779121120	1304531096	/nfs/dbraw/zinc/53/10/96/1304531096.db2.gz	SQICETTUMDOFKF-GUYCJALGSA-N	0	3	347.434	3.432	20	30		EGEDHN
CC(=NNC1=N[C@@H](C)CN1)[C@H](C)Oc1ccc(Cl)cc1Cl	ZINC000779798413	1304606043	/nfs/dbraw/zinc/60/60/43/1304606043.db2.gz	CMEMYLTUORKYOY-WPRPVWTQSA-N	0	3	329.231	3.074	20	30		EGEDHN
C=CCCN(OCc1ccccc1)C(=O)N[C@@H]1C[C@H](C)N(C2CC2)C1	ZINC000782976143	1305032966	/nfs/dbraw/zinc/03/29/66/1305032966.db2.gz	GVIDPABCEBOHRE-FUHWJXTLSA-N	0	3	343.471	3.331	20	30		EGEDHN
C=CCCN(OCc1ccccc1)C(=O)N[C@H]1C[C@@H](C)N(C2CC2)C1	ZINC000782976142	1305033298	/nfs/dbraw/zinc/03/32/98/1305033298.db2.gz	GVIDPABCEBOHRE-AEFFLSMTSA-N	0	3	343.471	3.331	20	30		EGEDHN
C=CCCN(OCc1ccccc1)C(=O)N[C@@H]1CN(C2CC2)C[C@H]1C	ZINC000782975559	1305033371	/nfs/dbraw/zinc/03/33/71/1305033371.db2.gz	CGSNFDVDYPBKNH-VQIMIIECSA-N	0	3	343.471	3.189	20	30		EGEDHN
C#CCN(Cc1ccc(OCC(=O)OC)cc1)[C@H]1CCc2ccccc21	ZINC000783370836	1305083783	/nfs/dbraw/zinc/08/37/83/1305083783.db2.gz	COLGFBPDCAAZGR-NRFANRHFSA-N	0	3	349.430	3.361	20	30		EGEDHN
Cc1ccc(N2CCN(CCC(=O)Nc3ccc(C#N)cc3)CC2)cc1	ZINC000784389349	1305239717	/nfs/dbraw/zinc/23/97/17/1305239717.db2.gz	LRYLBFKRSJNGKQ-UHFFFAOYSA-N	0	3	348.450	3.018	20	30		EGEDHN
C[C@H](CC(=O)C(C#N)C(=O)Nc1ccccn1)c1c[nH]c2ccccc21	ZINC000786329047	1305557201	/nfs/dbraw/zinc/55/72/01/1305557201.db2.gz	KSYJWAQQNYLACY-UKRRQHHQSA-N	0	3	346.390	3.404	20	30		EGEDHN
CCCCCCCCNC(=O)N1CCN(C2CCOCC2)C[C@@H]1C	ZINC000787296436	1305727998	/nfs/dbraw/zinc/72/79/98/1305727998.db2.gz	LUDXPRYGXGUOPN-KRWDZBQOSA-N	0	3	339.524	3.242	20	30		EGEDHN
C=CCOc1ccc(-c2nnc(SCCN3CCCC3)o2)cc1	ZINC000789956769	1306236618	/nfs/dbraw/zinc/23/66/18/1306236618.db2.gz	YKFYVWWBYSMHRP-UHFFFAOYSA-N	0	3	331.441	3.489	20	30		EGEDHN
CC(C)CN(Cn1cc2c(c(C#N)c1=O)CCCC2)C1CCCC1	ZINC000793490124	1309383427	/nfs/dbraw/zinc/38/34/27/1309383427.db2.gz	HUGOYMDUDNAISG-UHFFFAOYSA-N	0	3	327.472	3.457	20	30		EGEDHN
N#CC(C(=O)CCc1cncnc1)c1nc2ccccc2n1C(F)F	ZINC000796757331	1310080800	/nfs/dbraw/zinc/08/08/00/1310080800.db2.gz	WHOUJSGMIBKCMI-GFCCVEGCSA-N	0	3	341.321	3.030	20	30		EGEDHN
N#CC(C(=O)NCc1cccc(Cl)c1)C(=O)[C@H]1CCC(F)(F)C1	ZINC000796883830	1310105001	/nfs/dbraw/zinc/10/50/01/1310105001.db2.gz	FXJMRIHDJLCXRO-WCQYABFASA-N	0	3	340.757	3.100	20	30		EGEDHN
C=C1CCC(C(=O)NC2CCN([C@H](C)c3ccncc3)CC2)CC1	ZINC000897157070	1310202130	/nfs/dbraw/zinc/20/21/30/1310202130.db2.gz	DJQXQPQDZPJILT-MRXNPFEDSA-N	0	3	327.472	3.470	20	30		EGEDHN
CCCC(=O)N1CCC[C@H]1C(=O)C(C#N)c1ncc(C(C)(C)C)s1	ZINC000797569071	1310212933	/nfs/dbraw/zinc/21/29/33/1310212933.db2.gz	AFFUBSJYFIMARO-OLZOCXBDSA-N	0	3	347.484	3.408	20	30		EGEDHN
CC(C)(C)c1cnc(C(C#N)C(=O)C2(C)COC(C)(C)OC2)s1	ZINC000797571116	1310213802	/nfs/dbraw/zinc/21/38/02/1310213802.db2.gz	NXWVIBCSNHBGIA-NSHDSACASA-N	0	3	336.457	3.406	20	30		EGEDHN
CC(C)[C@H](C(=O)C(C#N)c1ncc(C(C)(C)C)s1)N1CCCC1=O	ZINC000797572442	1310214215	/nfs/dbraw/zinc/21/42/15/1310214215.db2.gz	ZSJVNEXQBFCMHK-SWLSCSKDSA-N	0	3	347.484	3.264	20	30		EGEDHN
C#Cc1ccc(C(=O)Nc2cccc3c2CCN(CC(C)(C)O)C3)cc1	ZINC000897371815	1310310666	/nfs/dbraw/zinc/31/06/66/1310310666.db2.gz	GAUCMKISLXERKR-UHFFFAOYSA-N	0	3	348.446	3.049	20	30		EGEDHN
C=CCN1CCC(N[C@H](C)c2nc(Br)ccc2F)CC1	ZINC000798182047	1310311324	/nfs/dbraw/zinc/31/13/24/1310311324.db2.gz	DIIPBTKMJVWUMN-LLVKDONJSA-N	0	3	342.256	3.284	20	30		EGEDHN
C#C[C@@H](NC(=O)NC[C@H](c1cccc(OC)c1)N(CC)CC)C(C)C	ZINC000798510178	1310374352	/nfs/dbraw/zinc/37/43/52/1310374352.db2.gz	LSJHOUFFAYAVAQ-RTBURBONSA-N	0	3	345.487	3.035	20	30		EGEDHN
C#C[C@H](NC(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1)C(C)C	ZINC000798553733	1310388793	/nfs/dbraw/zinc/38/87/93/1310388793.db2.gz	XQDMJYBCVQRGLD-OALUTQOASA-N	0	3	327.472	3.089	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CN[C@@H](CCO)Cc1ccccc1	ZINC000799349180	1310533139	/nfs/dbraw/zinc/53/31/39/1310533139.db2.gz	DPXNQIMXMYTPIW-KRWDZBQOSA-N	0	3	343.854	3.435	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)[C@@H]2CCCC(F)(F)C2)cc1	ZINC000800385320	1310747119	/nfs/dbraw/zinc/74/71/19/1310747119.db2.gz	ACIQLJNPPZYOAM-RISCZKNCSA-N	0	3	336.338	3.168	20	30		EGEDHN
CCOc1ccc(CN2CCC(C#N)(c3ccccn3)CC2)c(O)c1	ZINC000800528763	1310778641	/nfs/dbraw/zinc/77/86/41/1310778641.db2.gz	UGJMRWDSEYDHTO-UHFFFAOYSA-N	0	3	337.423	3.243	20	30		EGEDHN
C[C@@H](Oc1ccc(C#N)cc1)C(=O)OCCN(C)Cc1ccccc1	ZINC000837373846	1320606716	/nfs/dbraw/zinc/60/67/16/1320606716.db2.gz	ZZPUNRMKZYBHGR-MRXNPFEDSA-N	0	3	338.407	3.001	20	30		EGEDHN
C[C@@H](C#N)OCCN(CCCO)Cc1ccc(Cl)c(Cl)c1	ZINC000801920468	1316965911	/nfs/dbraw/zinc/96/59/11/1316965911.db2.gz	PYLSPCQQMZWYDE-LBPRGKRZSA-N	0	3	331.243	3.106	20	30		EGEDHN
CCC(=O)N1CCC2(CCN(Cc3ccc(C#N)cc3F)CC2)CC1	ZINC000957481925	1317391421	/nfs/dbraw/zinc/39/14/21/1317391421.db2.gz	WCKSCEIZWQFPPJ-UHFFFAOYSA-N	0	3	343.446	3.312	20	30		EGEDHN
N#CCCCCCC(=O)C(C#N)C(=O)NCc1cccc(Cl)c1	ZINC000805926580	1317440470	/nfs/dbraw/zinc/44/04/70/1317440470.db2.gz	SNRAKHGIOZNMLR-OAHLLOKOSA-N	0	3	331.803	3.139	20	30		EGEDHN
Cc1cscc1C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001020057940	1317523224	/nfs/dbraw/zinc/52/32/24/1317523224.db2.gz	ROUYNUVYZGTYDW-SHTZXODSSA-N	0	3	343.427	3.118	20	30		EGEDHN
CC(C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1)=C1CCCC1	ZINC001020064137	1317528197	/nfs/dbraw/zinc/52/81/97/1317528197.db2.gz	DIHNOJVQJDTLHR-IYARVYRRSA-N	0	3	341.430	3.325	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)Cc2coc3cc(F)ccc23)C1	ZINC001020141280	1317558337	/nfs/dbraw/zinc/55/83/37/1317558337.db2.gz	HJAQNRZYTMCBTA-HDJSIYSDSA-N	0	3	336.794	3.104	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H](c2ccc(CC(C)C)cc2)N(C)C)cn1	ZINC000807726103	1317580154	/nfs/dbraw/zinc/58/01/54/1317580154.db2.gz	IUEREHSGHQWBEI-OAQYLSRUSA-N	0	3	349.478	3.294	20	30		EGEDHN
C[C@H]1CCC[C@@H]1CC(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001020185758	1317580394	/nfs/dbraw/zinc/58/03/94/1317580394.db2.gz	BLEWJTKJDVNSMS-DHXZDTOLSA-N	0	3	343.446	3.260	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@@H](c2ccc(CC(C)C)cc2)N(C)C)c1	ZINC000807858434	1317592993	/nfs/dbraw/zinc/59/29/93/1317592993.db2.gz	JSZUSVXEXDQMEU-NRFANRHFSA-N	0	3	349.478	3.294	20	30		EGEDHN
C#C[C@@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)C(C)(C)C	ZINC000808213923	1317645331	/nfs/dbraw/zinc/64/53/31/1317645331.db2.gz	SSXYEUJISXECPS-ZWKOTPCHSA-N	0	3	327.472	3.171	20	30		EGEDHN
C#C[C@H](NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1)C(C)(C)C	ZINC000808315861	1317660439	/nfs/dbraw/zinc/66/04/39/1317660439.db2.gz	NKWJVWBKTVOWPH-MJGOQNOKSA-N	0	3	341.499	3.340	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc(-c3cccs3)on2)C1	ZINC001020444751	1317700858	/nfs/dbraw/zinc/70/08/58/1317700858.db2.gz	UKMIVGNAKBTTDA-XYPYZODXSA-N	0	3	337.832	3.006	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc(C(F)F)c(F)c2)C1	ZINC001020579030	1317788182	/nfs/dbraw/zinc/78/81/82/1317788182.db2.gz	BSSAYGFZGCSZEH-XYPYZODXSA-N	0	3	332.753	3.366	20	30		EGEDHN
O=C(c1cccc(CN2CCCC2)c1)N(O)Cc1ccc(F)cc1	ZINC000904174883	1317802958	/nfs/dbraw/zinc/80/29/58/1317802958.db2.gz	KWYJJFZZYKHJGO-UHFFFAOYSA-N	0	3	328.387	3.453	20	30		EGEDHN
C#Cc1ccc(CN[C@@H](Cc2ccccc2)C(=O)N(CC)CC)cc1	ZINC000809603209	1317840810	/nfs/dbraw/zinc/84/08/10/1317840810.db2.gz	LQZCSMWMTMQTTK-NRFANRHFSA-N	0	3	334.463	3.237	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)c2csc(Cl)c2)C1	ZINC001020681803	1317860873	/nfs/dbraw/zinc/86/08/73/1317860873.db2.gz	YRUXDTYTLMODRC-MGCOHNPYSA-N	0	3	349.681	3.161	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N[C@H]1C[C@H](N[C@@H](C)c2ccccc2F)C1	ZINC001020726642	1317893268	/nfs/dbraw/zinc/89/32/68/1317893268.db2.gz	PWRRLKMLQZWJHM-SARNLOFESA-N	0	3	346.446	3.105	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc(-c3ccccc3)nc2)C1	ZINC001020802348	1317935607	/nfs/dbraw/zinc/93/56/07/1317935607.db2.gz	AOGXCMAXYWSXEL-QAQDUYKDSA-N	0	3	341.842	3.352	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@H](C)c2ccc(Cl)s2)C1	ZINC001020900039	1317989951	/nfs/dbraw/zinc/98/99/51/1317989951.db2.gz	BNHMVBTXPZANII-GMTAPVOTSA-N	0	3	333.284	3.494	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)c2ccc(C)cc2C)C1	ZINC001021005761	1318041014	/nfs/dbraw/zinc/04/10/14/1318041014.db2.gz	GZFWHOAPSICZDS-HDJSIYSDSA-N	0	3	337.261	3.062	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)C23CC(c4ccccc4)(C2)C3)C1	ZINC001021107176	1318087866	/nfs/dbraw/zinc/08/78/66/1318087866.db2.gz	ZSZCQYNXIDEALD-WREXNOFYSA-N	0	3	330.859	3.098	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C[C@H]2CCCC[C@H]2C)C1	ZINC001021119051	1318101760	/nfs/dbraw/zinc/10/17/60/1318101760.db2.gz	QYDYWDKODGLSCC-NMFUWQPSSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=C1CCC(C(=O)NC2C[C@H]3CC[C@@H](C2)N3Cc2cccnc2)CC1	ZINC001021368512	1318214183	/nfs/dbraw/zinc/21/41/83/1318214183.db2.gz	PXONZTWIDBCKQR-IHWFROFDSA-N	0	3	339.483	3.440	20	30		EGEDHN
C=C1CC(C)(C(=O)NC2C[C@H]3CC[C@@H](C2)N3Cc2scnc2C)C1	ZINC001021373911	1318219576	/nfs/dbraw/zinc/21/95/76/1318219576.db2.gz	VVCMMGCEFASFHP-MQVJKMGUSA-N	0	3	345.512	3.419	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)[C@H]2CC=CCC2)s1	ZINC000959870606	1318242777	/nfs/dbraw/zinc/24/27/77/1318242777.db2.gz	VFXFBWFXPGUVLQ-HOTGVXAUSA-N	0	3	343.496	3.447	20	30		EGEDHN
Cc1cocc1C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)s1	ZINC000960082924	1318343196	/nfs/dbraw/zinc/34/31/96/1318343196.db2.gz	AHLGKCQUOFSZJW-AWEZNQCLSA-N	0	3	343.452	3.306	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)s1	ZINC000960144733	1318379129	/nfs/dbraw/zinc/37/91/29/1318379129.db2.gz	XQFWGGBTLAXCIH-JKIFEVAISA-N	0	3	331.485	3.137	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC000960151754	1318384556	/nfs/dbraw/zinc/38/45/56/1318384556.db2.gz	CLXVBDRRMDQXTC-YJBOKZPZSA-N	0	3	345.462	3.460	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC[C@@H]2CN(Cc3ccc(C#N)cc3)CC[C@H]21	ZINC001021554640	1318399773	/nfs/dbraw/zinc/39/97/73/1318399773.db2.gz	ODIYTTWHZZIBHA-PSTDOWKUSA-N	0	3	337.467	3.337	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2c(C)oc3ccccc32)C1	ZINC001021590364	1318434476	/nfs/dbraw/zinc/43/44/76/1318434476.db2.gz	FHHLJBUHLLMABC-AEFFLSMTSA-N	0	3	336.435	3.301	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)Cc1ccc(C)cc1	ZINC000960281629	1318443807	/nfs/dbraw/zinc/44/38/07/1318443807.db2.gz	UNRMPDMAHZIPDC-IFMALSPDSA-N	0	3	334.463	3.485	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1c(F)ccc(C)c1F	ZINC000960302181	1318451915	/nfs/dbraw/zinc/45/19/15/1318451915.db2.gz	JCSZVBRGOUPYGY-VQIMIIECSA-N	0	3	342.389	3.445	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc(C2CC2)no1	ZINC000960311332	1318454375	/nfs/dbraw/zinc/45/43/75/1318454375.db2.gz	UQTVSSPVRJEWOW-IEBWSBKVSA-N	0	3	337.423	3.114	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(F)c(C)cc2F)C1	ZINC001021608481	1318454683	/nfs/dbraw/zinc/45/46/83/1318454683.db2.gz	QMEKLIDLTKLMCU-DNVCBOLYSA-N	0	3	346.421	3.223	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)Cc1ccc(CC)cc1	ZINC000960313875	1318456778	/nfs/dbraw/zinc/45/67/78/1318456778.db2.gz	SSJKVWBLUQFYBC-IFMALSPDSA-N	0	3	334.463	3.349	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccncc1Cl	ZINC000960314088	1318457057	/nfs/dbraw/zinc/45/70/57/1318457057.db2.gz	VHUQYVNSZBUGKV-QZTJIDSGSA-N	0	3	341.842	3.297	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc2c(c1)COC2	ZINC000960315368	1318457751	/nfs/dbraw/zinc/45/77/51/1318457751.db2.gz	WPHRSHKLIRMTOA-NHCUHLMSSA-N	0	3	348.446	3.278	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)Cc2ccccc2CC)C1	ZINC001021612596	1318459087	/nfs/dbraw/zinc/45/90/87/1318459087.db2.gz	CQAXHFFGARHQQD-SFTDATJTSA-N	0	3	338.495	3.128	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc(C2CC2)cn1	ZINC000960328718	1318463590	/nfs/dbraw/zinc/46/35/90/1318463590.db2.gz	CWDNVCGKUVPJKK-WOJBJXKFSA-N	0	3	333.435	3.130	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(F)cc3ccoc32)C1	ZINC001021621056	1318470586	/nfs/dbraw/zinc/47/05/86/1318470586.db2.gz	YVLDIBRARFSPOF-QAPCUYQASA-N	0	3	340.398	3.132	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(CC)s2)C1	ZINC001021622267	1318472719	/nfs/dbraw/zinc/47/27/19/1318472719.db2.gz	HUFWAVGQVUHFJE-RDJZCZTQSA-N	0	3	330.497	3.260	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N(c1ccccc1)C1CCN(C)CC1	ZINC000812919411	1318479147	/nfs/dbraw/zinc/47/91/47/1318479147.db2.gz	KLMOZXKTNDGBMZ-UHFFFAOYSA-N	0	3	332.447	3.338	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)Cc2ccc(C(F)F)cc2)C1	ZINC001021628278	1318480049	/nfs/dbraw/zinc/48/00/49/1318480049.db2.gz	AGCZXEMFUYIQPB-MSOLQXFVSA-N	0	3	346.421	3.113	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)C2CCC3(CC3)CC2)C1	ZINC001021636324	1318490131	/nfs/dbraw/zinc/49/01/31/1318490131.db2.gz	PIGNYLNCBRVOHL-OALUTQOASA-N	0	3	328.500	3.293	20	30		EGEDHN
CCc1cccc(CC)c1NC(=O)C(C#N)C(=O)[C@@H](C)[C@H](C)COC	ZINC000813060062	1318492748	/nfs/dbraw/zinc/49/27/48/1318492748.db2.gz	ONSPFYOSCYHDFQ-JKIFEVAISA-N	0	3	344.455	3.377	20	30		EGEDHN
N#CCCCC(=O)C(C#N)C(=O)Nc1ccc(SC(F)F)cc1	ZINC000813059891	1318493369	/nfs/dbraw/zinc/49/33/69/1318493369.db2.gz	KLLLXIGRGHHAIY-GFCCVEGCSA-N	0	3	337.351	3.343	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc3ccccc3n2C)C1	ZINC001021661698	1318523872	/nfs/dbraw/zinc/52/38/72/1318523872.db2.gz	RBWBJNSGCORUEK-UYAOXDASSA-N	0	3	349.478	3.128	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)C[C@H]1C=CCC1	ZINC000960397811	1318525103	/nfs/dbraw/zinc/52/51/03/1318525103.db2.gz	HPKLKQZMGOIQOX-PXNSSMCTSA-N	0	3	337.467	3.337	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(C)cc(F)c2)C1	ZINC001021675840	1318541519	/nfs/dbraw/zinc/54/15/19/1318541519.db2.gz	GQAIPZVEQXRNMJ-QFBILLFUSA-N	0	3	328.431	3.084	20	30		EGEDHN
CCC(CC)C(=O)N1CCC[C@H]1CN(C)Cc1cccc(C#N)c1	ZINC000960418507	1318542640	/nfs/dbraw/zinc/54/26/40/1318542640.db2.gz	HJIUINVQGSVVLS-IBGZPJMESA-N	0	3	327.472	3.417	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc3cnccc3c2)C1	ZINC001021709786	1318586363	/nfs/dbraw/zinc/58/63/63/1318586363.db2.gz	LISYNMCCUJTCOX-LEWJYISDSA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(C)c(CC)o2)C1	ZINC001021709576	1318586875	/nfs/dbraw/zinc/58/68/75/1318586875.db2.gz	CFRUWTXSTVTIFV-IAGOWNOFSA-N	0	3	328.456	3.100	20	30		EGEDHN
COc1ccc2c(c1)nccc2N1CC[C@H](Oc2ccc(C#N)cn2)C1	ZINC000813615034	1318606245	/nfs/dbraw/zinc/60/62/45/1318606245.db2.gz	SEZKRXCQPDIZJW-INIZCTEOSA-N	0	3	346.390	3.168	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc3[nH]ccc3s2)C1	ZINC001021723601	1318611984	/nfs/dbraw/zinc/61/19/84/1318611984.db2.gz	VMOPJOFSHCJTNI-HOCLYGCPSA-N	0	3	341.480	3.179	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)CCc2c[nH]c3ccccc23)C1	ZINC001021723313	1318612971	/nfs/dbraw/zinc/61/29/71/1318612971.db2.gz	DNCYNAVYQSHDIY-GHTZIAJQSA-N	0	3	349.478	3.047	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2oc3ccccc3c2C)C1	ZINC001021729034	1318627193	/nfs/dbraw/zinc/62/71/93/1318627193.db2.gz	XIESEVUJHVWCKR-WMZOPIPTSA-N	0	3	336.435	3.301	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2sc(C(C)C)nc2C)C1	ZINC001021733438	1318638253	/nfs/dbraw/zinc/63/82/53/1318638253.db2.gz	MUHNFUXYCIYERH-JKSUJKDBSA-N	0	3	345.512	3.135	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@@H]1CN(C)Cc1ccc(C#N)cc1)C1CC1	ZINC000960529152	1318646405	/nfs/dbraw/zinc/64/64/05/1318646405.db2.gz	MUENBYOKYIDXQX-DNVCBOLYSA-N	0	3	325.456	3.027	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(CC)c(CC)c2)C1	ZINC001021746219	1318661507	/nfs/dbraw/zinc/66/15/07/1318661507.db2.gz	JSCOMPHBGGAXLO-RTWAWAEBSA-N	0	3	338.495	3.371	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(-c3ccccc3)[nH]2)C1	ZINC001021746410	1318662612	/nfs/dbraw/zinc/66/26/12/1318662612.db2.gz	LGOANPABEZEJOI-NQIIRXRSSA-N	0	3	347.462	3.241	20	30		EGEDHN
CN(CCCCCCN1C(=O)c2ccccc2C1=O)CC(C)(C)C#N	ZINC000814670171	1318796633	/nfs/dbraw/zinc/79/66/33/1318796633.db2.gz	NHWIKGXRLUUTCM-UHFFFAOYSA-N	0	3	341.455	3.325	20	30		EGEDHN
FC(F)(F)[C@@H]1C=C(NNc2ccnc(Br)c2)CCO1	ZINC000814904691	1318844447	/nfs/dbraw/zinc/84/44/47/1318844447.db2.gz	UYETYXKNIUIQCN-VIFPVBQESA-N	0	3	338.127	3.353	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)N[C@H]1CCCc2[nH]c(=O)ccc21	ZINC000912196188	1318845842	/nfs/dbraw/zinc/84/58/42/1318845842.db2.gz	SOMJRSOGTFWDED-WBVHZDCISA-N	0	3	333.476	3.359	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N1CCC[C@H]1c1ccc(OC)c(OC)c1	ZINC000912197110	1318846995	/nfs/dbraw/zinc/84/69/95/1318846995.db2.gz	PFULFSPXFLEHQA-CVEARBPZSA-N	0	3	332.444	3.051	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N1CCC(C(=O)c2ccc(Cl)cc2)CC1	ZINC000912437495	1318886283	/nfs/dbraw/zinc/88/62/83/1318886283.db2.gz	YHQNWNGSSUWIBB-QGZVFWFLSA-N	0	3	348.874	3.445	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H]1CN(C)Cc1ccc(CO)cc1	ZINC000960828127	1318954854	/nfs/dbraw/zinc/95/48/54/1318954854.db2.gz	RMSNYEQGZNNKEE-FPOVZHCZSA-N	0	3	344.499	3.204	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc3c(o2)c(F)ccc3C)C1	ZINC001022485399	1318958706	/nfs/dbraw/zinc/95/87/06/1318958706.db2.gz	WZIKTLFMZFSNHK-TXEJJXNPSA-N	0	3	336.794	3.483	20	30		EGEDHN
CC1(C(=O)N[C@H]2C[C@@H](NCc3ccc(C#N)cc3F)C2)CCCC1	ZINC001022507743	1318970533	/nfs/dbraw/zinc/97/05/33/1318970533.db2.gz	BVBWHGADYJQFOE-IYBDPMFKSA-N	0	3	329.419	3.014	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]2CN(C)Cc2cccc(C#N)c2)C1	ZINC000960845858	1318982880	/nfs/dbraw/zinc/98/28/80/1318982880.db2.gz	HIIGVHCZKWSNGD-IBGZPJMESA-N	0	3	337.467	3.337	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]2CN(C)C[C@H]2CC(C)(C)CO2)C1	ZINC000960847641	1318986708	/nfs/dbraw/zinc/98/67/08/1318986708.db2.gz	RDVGPSJSAMSSAN-IAGOWNOFSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]2CN(C)C[C@@H]2CC(C)(C)CO2)C1	ZINC000960847643	1318987354	/nfs/dbraw/zinc/98/73/54/1318987354.db2.gz	RDVGPSJSAMSSAN-IRXDYDNUSA-N	0	3	334.504	3.081	20	30		EGEDHN
C[C@@H]1CCC[C@@H](C(=O)N[C@H]2C[C@@H](NCc3cc(C#N)ccc3F)C2)C1	ZINC001022623949	1319024405	/nfs/dbraw/zinc/02/44/05/1319024405.db2.gz	ZWHVWUDSXXDKIT-UWIFEVILSA-N	0	3	343.446	3.260	20	30		EGEDHN
CC1(C)CC[C@@H](C(=O)N[C@H]2C[C@@H](NCc3cc(C#N)ccc3F)C2)C1	ZINC001022675614	1319061196	/nfs/dbraw/zinc/06/11/96/1319061196.db2.gz	MCMZSEFXLIXRDJ-OIISXLGYSA-N	0	3	343.446	3.260	20	30		EGEDHN
CC(C)(C)Oc1ccc(C(=O)C(C#N)C(=O)Nc2ccccc2)nc1	ZINC000815907798	1319070738	/nfs/dbraw/zinc/07/07/38/1319070738.db2.gz	KQZFHRFTKJJVFA-OAHLLOKOSA-N	0	3	337.379	3.220	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)Cc2ccc(Cl)c(F)c2)C1	ZINC001022768899	1319096758	/nfs/dbraw/zinc/09/67/58/1319096758.db2.gz	CCJXEJRIAWRTPY-TXEJJXNPSA-N	0	3	331.218	3.011	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2csc(C(C)(C)C)n2)C1	ZINC001022853685	1319137456	/nfs/dbraw/zinc/13/74/56/1319137456.db2.gz	MIIDWCMQMXVCIH-PHIMTYICSA-N	0	3	327.881	3.044	20	30		EGEDHN
CC(C)[C@@]1(C)C[C@@H]1C(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001022916658	1319167383	/nfs/dbraw/zinc/16/73/83/1319167383.db2.gz	CTJPMWKTAHKTSH-AXVVYFOYSA-N	0	3	343.446	3.116	20	30		EGEDHN
C[C@H](C(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1)C1CCCC1	ZINC001022958082	1319186639	/nfs/dbraw/zinc/18/66/39/1319186639.db2.gz	AMAJCHROQIFEMY-DOPJRALCSA-N	0	3	343.446	3.260	20	30		EGEDHN
CCC(=O)N1CCC[C@H]([C@H]2CCN(Cc3ccc(F)c(C#N)c3)C2)C1	ZINC000961080831	1319194194	/nfs/dbraw/zinc/19/41/94/1319194194.db2.gz	SIPRCGLVHIQZLO-IRXDYDNUSA-N	0	3	343.446	3.168	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc(OCC3CC3)cc2)C1	ZINC001023105967	1319262886	/nfs/dbraw/zinc/26/28/86/1319262886.db2.gz	QFCFAHBEGUNHEA-IYBDPMFKSA-N	0	3	334.847	3.078	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@@H]([C@H]2CCN(CC#Cc3ccccc3)C2)C1	ZINC000961149287	1319269857	/nfs/dbraw/zinc/26/98/57/1319269857.db2.gz	WEQAFMAKQRVTCJ-RTWAWAEBSA-N	0	3	338.495	3.255	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@H]([C@@H]2CCN(CC#Cc3ccccc3)C2)C1	ZINC000961149273	1319270391	/nfs/dbraw/zinc/27/03/91/1319270391.db2.gz	WEQAFMAKQRVTCJ-LEWJYISDSA-N	0	3	338.495	3.255	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cnc(C(C)(C)C)s2)C1	ZINC001023134926	1319277453	/nfs/dbraw/zinc/27/74/53/1319277453.db2.gz	MVEDWFJENYQHEL-PHIMTYICSA-N	0	3	327.881	3.044	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@@H]2CCCCc3ccccc32)C1	ZINC001023137688	1319280901	/nfs/dbraw/zinc/28/09/01/1319280901.db2.gz	QGQKZHHIPLVFRB-SOLBZPMBSA-N	0	3	332.875	3.486	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N1CCC[C@@H]1c1ccccc1C(F)(F)F	ZINC000818109450	1319501936	/nfs/dbraw/zinc/50/19/36/1319501936.db2.gz	CPIXJISCPLOGSO-HUUCEWRRSA-N	0	3	339.361	3.390	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccccc2C(C)(C)C)C1	ZINC001023437838	1319533182	/nfs/dbraw/zinc/53/31/82/1319533182.db2.gz	HOHBGQMDPZEOBX-KRWDZBQOSA-N	0	3	326.484	3.449	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc3sccc3s2)C1	ZINC001023444210	1319541372	/nfs/dbraw/zinc/54/13/72/1319541372.db2.gz	FVFANPSCTPYVSD-CYBMUJFWSA-N	0	3	332.494	3.428	20	30		EGEDHN
C#CCN(C)CCCNC(=O)C[C@H](C)c1ccccc1C(F)(F)F	ZINC000818599575	1319567434	/nfs/dbraw/zinc/56/74/34/1319567434.db2.gz	ZHJMXRYBKMEMDV-AWEZNQCLSA-N	0	3	340.389	3.270	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1ccc(-c2ccc(F)cc2)s1	ZINC000818615283	1319570028	/nfs/dbraw/zinc/57/00/28/1319570028.db2.gz	GIRJFDWRQQPMSG-UHFFFAOYSA-N	0	3	330.428	3.239	20	30		EGEDHN
C=CCN1CCC[C@@H](CNC(=O)c2c(C)occ2C(F)(F)F)C1	ZINC001023493417	1319598893	/nfs/dbraw/zinc/59/88/93/1319598893.db2.gz	WJOHEPRHQGRUKD-LBPRGKRZSA-N	0	3	330.350	3.235	20	30		EGEDHN
N#Cc1ccccc1CNCC1CC(NC(=O)C=C2CCCCC2)C1	ZINC000961608832	1319666659	/nfs/dbraw/zinc/66/66/59/1319666659.db2.gz	YXUKOFKEEBIDGM-UHFFFAOYSA-N	0	3	337.467	3.433	20	30		EGEDHN
C=CCN(C(=O)Nc1ccc(N2CCN(CC)CC2)cc1)C(C)C	ZINC000916707209	1319698752	/nfs/dbraw/zinc/69/87/52/1319698752.db2.gz	MPJUBQXEPDNWCM-UHFFFAOYSA-N	0	3	330.476	3.257	20	30		EGEDHN
N#CC(C(=O)NC1CCCCC1)C(=O)[C@H]1C[C@@H]1c1ccc(F)cc1	ZINC000916894917	1319721675	/nfs/dbraw/zinc/72/16/75/1319721675.db2.gz	CJHBHPBAKQDTIQ-IKGGRYGDSA-N	0	3	328.387	3.087	20	30		EGEDHN
N#CC(C(=O)CCc1nc2ccccc2o1)C(=O)Nc1ccccc1	ZINC000916898806	1319721785	/nfs/dbraw/zinc/72/17/85/1319721785.db2.gz	JWROFBWWORRUQS-CQSZACIVSA-N	0	3	333.347	3.108	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H](CNC(=O)[C@@H]3CC34CCC4)C2)cc1	ZINC001023624834	1319744927	/nfs/dbraw/zinc/74/49/27/1319744927.db2.gz	HKIQGWGPAHTJOC-OALUTQOASA-N	0	3	337.467	3.077	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2)C1	ZINC001023640782	1319762362	/nfs/dbraw/zinc/76/23/62/1319762362.db2.gz	MXWTTXYGOQUHOK-ZYSHUDEJSA-N	0	3	344.886	3.295	20	30		EGEDHN
N#Cc1ccccc1CNCC1CC(NC(=O)C23CCC(CC2)C3)C1	ZINC000961998932	1319796883	/nfs/dbraw/zinc/79/68/83/1319796883.db2.gz	QCZMCNLEFBZOLO-UHFFFAOYSA-N	0	3	337.467	3.123	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc3nc(C)sc3c2)C1	ZINC001023686090	1319802818	/nfs/dbraw/zinc/80/28/18/1319802818.db2.gz	PFHARDDEPRPRJT-HNNXBMFYSA-N	0	3	341.480	3.070	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cccc(-c3ccoc3)c2)C1	ZINC001023693625	1319817852	/nfs/dbraw/zinc/81/78/52/1319817852.db2.gz	ZTEUMAXIYWQVIB-KRWDZBQOSA-N	0	3	336.435	3.412	20	30		EGEDHN
C#CCN1CCC[C@@H](CNC(=O)c2ccccc2-c2ccccc2)C1	ZINC001023733759	1319873503	/nfs/dbraw/zinc/87/35/03/1319873503.db2.gz	RLIWVIRERLCWLR-SFHVURJKSA-N	0	3	332.447	3.429	20	30		EGEDHN
C#C[C@@H](NC(=O)N(CCC)[C@H]1CCN(C)C1)c1ccc(Cl)cc1	ZINC000820552383	1319908543	/nfs/dbraw/zinc/90/85/43/1319908543.db2.gz	IXQSWBPODLRSIO-DLBZAZTESA-N	0	3	333.863	3.140	20	30		EGEDHN
C#C[C@@H](NC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1)c1ccccc1	ZINC000820591765	1319918111	/nfs/dbraw/zinc/91/81/11/1319918111.db2.gz	WVOMAYAXAYOOMK-MOPGFXCFSA-N	0	3	339.414	3.102	20	30		EGEDHN
C=C(C)CN(Cc1ccc(CO)o1)C[C@H]1CCCC[C@H]1C(=O)OC	ZINC000930455404	1328860126	/nfs/dbraw/zinc/86/01/26/1328860126.db2.gz	NXCRGDUOGIOMOW-CRAIPNDOSA-N	0	3	335.444	3.129	20	30		EGEDHN
C#CCCCOc1cccnc1NCCCCN1C[C@H](C)O[C@@H](C)C1	ZINC000820675612	1319933533	/nfs/dbraw/zinc/93/35/33/1319933533.db2.gz	JJPLXAQBCQZRNF-ROUUACIJSA-N	0	3	345.487	3.175	20	30		EGEDHN
C=C(C)CN1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1ccc(-c2cccs2)o1	ZINC000962436357	1319961557	/nfs/dbraw/zinc/96/15/57/1319961557.db2.gz	IJJIDUUZBLXIKG-LAQFHYBYSA-N	0	3	328.437	3.244	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1[NH2+]Cc1ccc(OCc2ccccc2)cc1[O-]	ZINC000824862359	1320292286	/nfs/dbraw/zinc/29/22/86/1320292286.db2.gz	YVOVASRQJARIRR-QUCCMNQESA-N	0	3	325.408	3.404	20	30		EGEDHN
C#Cc1cnc(NC[C@H](c2ccc(OC)cc2)N2CCCCC2)nc1	ZINC000827294666	1320441031	/nfs/dbraw/zinc/44/10/31/1320441031.db2.gz	LDBVJEJBCZXNME-LJQANCHMSA-N	0	3	336.439	3.106	20	30		EGEDHN
C#Cc1cnc(N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)nc1	ZINC000827630888	1320463390	/nfs/dbraw/zinc/46/33/90/1320463390.db2.gz	XZJCCFAOZWKINK-INIZCTEOSA-N	0	3	346.356	3.163	20	30		EGEDHN
C=CCONC(=O)N(CCC)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000838702733	1320806330	/nfs/dbraw/zinc/80/63/30/1320806330.db2.gz	BYRFFRIBCDNLIC-GOSISDBHSA-N	0	3	331.460	3.190	20	30		EGEDHN
C[C@H]1CN(Cc2ccc(OCC#N)cc2)CCN1Cc1ccccc1	ZINC000839647230	1320950585	/nfs/dbraw/zinc/95/05/85/1320950585.db2.gz	WGIBIRMLMFDNFD-SFHVURJKSA-N	0	3	335.451	3.295	20	30		EGEDHN
N#Cc1cccc([C@@H]2C[C@H]2C(=O)O[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000840607199	1321114569	/nfs/dbraw/zinc/11/45/69/1321114569.db2.gz	TWDQULBXOLTHNT-PCCBWWKXSA-N	0	3	346.430	3.479	20	30		EGEDHN
C#CCCCCNCc1ccc(F)cc1I	ZINC000841866974	1321325028	/nfs/dbraw/zinc/32/50/28/1321325028.db2.gz	IGMREBVQIMVQOH-UHFFFAOYSA-N	0	3	331.172	3.323	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1	ZINC000842285020	1321367238	/nfs/dbraw/zinc/36/72/38/1321367238.db2.gz	OVPCLUGMIVBILC-XHSDSOJGSA-N	0	3	332.831	3.459	20	30		EGEDHN
CC[C@H](OC1CCCC1)C(=O)C(C#N)C(=O)NCc1cccc(C)c1	ZINC000842344049	1321375263	/nfs/dbraw/zinc/37/52/63/1321375263.db2.gz	XCMLCQZPIMRPOH-ROUUACIJSA-N	0	3	342.439	3.058	20	30		EGEDHN
C=C(Br)CNC1CC(CCNC(=O)OC(C)(C)C)C1	ZINC000845936737	1321755547	/nfs/dbraw/zinc/75/55/47/1321755547.db2.gz	YJDGWCPSACNDKQ-UHFFFAOYSA-N	0	3	333.270	3.178	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1ccccc1COC(C)(C)CC	ZINC000930825461	1328981885	/nfs/dbraw/zinc/98/18/85/1328981885.db2.gz	OPMKIULUXSIOCU-UHFFFAOYSA-N	0	3	345.487	3.468	20	30		EGEDHN
N#CC1(COC(=O)/C=C/c2ccc[nH]2)CCN(Cc2ccccc2)CC1	ZINC000847747423	1321900736	/nfs/dbraw/zinc/90/07/36/1321900736.db2.gz	HITIGFRIKQDLBJ-CMDGGOBGSA-N	0	3	349.434	3.377	20	30		EGEDHN
CN(CC(=O)C(C#N)c1nc2ccccc2s1)Cc1ccoc1	ZINC000918739199	1321988837	/nfs/dbraw/zinc/98/88/37/1321988837.db2.gz	YFIAMCNCQSOFAW-CYBMUJFWSA-N	0	3	325.393	3.198	20	30		EGEDHN
N#Cc1ccc([C@H](O)CNC[C@H](OC2CCCC2)C(F)(F)F)cc1	ZINC000849328775	1322113119	/nfs/dbraw/zinc/11/31/19/1322113119.db2.gz	QRBHLOFNSMGWLP-CVEARBPZSA-N	0	3	342.361	3.071	20	30		EGEDHN
C#CCN(CC)C[C@H](O)CO[C@@H](c1ccccc1)c1ccccc1C	ZINC000920096055	1322136769	/nfs/dbraw/zinc/13/67/69/1322136769.db2.gz	UZNNCQYRBJKKKL-UNMCSNQZSA-N	0	3	337.463	3.417	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)Cc2cc3ccccc3o2)c1	ZINC000920108992	1322137476	/nfs/dbraw/zinc/13/74/76/1322137476.db2.gz	MHCDFZVSUSUNRA-KRWDZBQOSA-N	0	3	348.358	3.331	20	30		EGEDHN
Cc1ccc(C)c(C(=O)NC2CC(CNCc3ccccc3C#N)C2)c1	ZINC000962590637	1323018623	/nfs/dbraw/zinc/01/86/23/1323018623.db2.gz	CTIRVCAFKQWHIS-UHFFFAOYSA-N	0	3	347.462	3.473	20	30		EGEDHN
CC1=CC[C@@](C)(C(=O)N[C@@H]2[C@H]3CN(Cc4ccc(C#N)cc4)C[C@H]32)CC1	ZINC000962713482	1323050574	/nfs/dbraw/zinc/05/05/74/1323050574.db2.gz	GKROXENBTLXHFB-FCIYXJNOSA-N	0	3	349.478	3.241	20	30		EGEDHN
N#Cc1ccc(CCN2CCC(Oc3cncc(Cl)n3)CC2)cc1	ZINC000851953895	1323121352	/nfs/dbraw/zinc/12/13/52/1323121352.db2.gz	GMAUGPGWFMDQHB-UHFFFAOYSA-N	0	3	342.830	3.088	20	30		EGEDHN
C#C[C@@](C)(CC)NCC(=O)N(C)Cc1ccc2cc(OC)ccc2c1	ZINC000852098702	1323145454	/nfs/dbraw/zinc/14/54/54/1323145454.db2.gz	UGAXICFXJWXYNN-NRFANRHFSA-N	0	3	338.451	3.198	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@@H](CNCc2ccccc2C#N)C1)C(C)(F)F	ZINC001024162130	1323179569	/nfs/dbraw/zinc/17/95/69/1323179569.db2.gz	ROEVMLUNYZVFNX-GJZGRUSLSA-N	0	3	349.425	3.178	20	30		EGEDHN
C=C(Br)CNC1CCC(N(C)C(=O)c2ccco2)CC1	ZINC000963006083	1323185688	/nfs/dbraw/zinc/18/56/88/1323185688.db2.gz	JFGXQCHWHZDKFN-UHFFFAOYSA-N	0	3	341.249	3.161	20	30		EGEDHN
C=C(Br)CNC1CCC(N(C)C(=O)[C@H](C)C2CC2)CC1	ZINC000963202646	1323230529	/nfs/dbraw/zinc/23/05/29/1323230529.db2.gz	NZDOOOZJKNGOPJ-LRVUVFPRSA-N	0	3	343.309	3.300	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)c2ccc(C)nc2)C1	ZINC000963260335	1323272092	/nfs/dbraw/zinc/27/20/92/1323272092.db2.gz	SRGUBAFOLYZWPJ-MSOLQXFVSA-N	0	3	347.890	3.459	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1cccc(OCCC)c1	ZINC001024466620	1323421689	/nfs/dbraw/zinc/42/16/89/1323421689.db2.gz	IHKFONAKCLDOHD-SFHVURJKSA-N	0	3	328.456	3.083	20	30		EGEDHN
C=C(C)CCN1CCCC[C@@H]1CNC(=O)c1sc2nccn2c1C	ZINC001024485848	1323440485	/nfs/dbraw/zinc/44/04/85/1323440485.db2.gz	ULXHLSFDHVZUAK-OAHLLOKOSA-N	0	3	346.500	3.255	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccc2nc(C)oc2c1	ZINC001024492414	1323444471	/nfs/dbraw/zinc/44/44/71/1323444471.db2.gz	MEUXVEPWTCMLAL-INIZCTEOSA-N	0	3	327.428	3.297	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cc(C)n([C@H](C)CC)n1	ZINC001024517683	1323468116	/nfs/dbraw/zinc/46/81/16/1323468116.db2.gz	CQTGQCKZOUUNJD-WBVHZDCISA-N	0	3	332.492	3.323	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1cc(C)n(C(CC)CC)n1	ZINC001024519636	1323468698	/nfs/dbraw/zinc/46/86/98/1323468698.db2.gz	VYIVEWPZXSEYRD-GOSISDBHSA-N	0	3	344.503	3.160	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1c2c[nH]nc2ccc1C	ZINC001024519374	1323469224	/nfs/dbraw/zinc/46/92/24/1323469224.db2.gz	TZJUZWLWWDTORE-HNNXBMFYSA-N	0	3	326.444	3.032	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@H]1COc2ccc(Cl)cc21	ZINC001024555817	1323495282	/nfs/dbraw/zinc/49/52/82/1323495282.db2.gz	ZPJNOGRJXUZFQX-RDJZCZTQSA-N	0	3	348.874	3.363	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1cnc2ccccc2c1C	ZINC001024559014	1323498069	/nfs/dbraw/zinc/49/80/69/1323498069.db2.gz	RDTYZQZFTVEJKU-KRWDZBQOSA-N	0	3	335.451	3.151	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@@H]1COc2cc(C)c(C)cc21	ZINC001024576267	1323513797	/nfs/dbraw/zinc/51/37/97/1323513797.db2.gz	QHGOPPRCOOOFOI-PKOBYXMFSA-N	0	3	342.483	3.326	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccc2nc(C)n(C)c2c1	ZINC001024587740	1323523017	/nfs/dbraw/zinc/52/30/17/1323523017.db2.gz	POCKIIRTWPILSC-QGZVFWFLSA-N	0	3	340.471	3.042	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cn(CC)nc1C(C)C	ZINC001024685519	1323600476	/nfs/dbraw/zinc/60/04/76/1323600476.db2.gz	KCEQNSBLKYKOQB-MRXNPFEDSA-N	0	3	332.492	3.187	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cnc(C(C)C)nc1C	ZINC001024693313	1323608922	/nfs/dbraw/zinc/60/89/22/1323608922.db2.gz	XLQAFVTYIKLOQS-MRXNPFEDSA-N	0	3	330.476	3.069	20	30		EGEDHN
C#CCOc1ccc(C(=O)NC[C@H]2CCCCN2CC=C(C)C)cc1	ZINC001024694259	1323610899	/nfs/dbraw/zinc/61/08/99/1323610899.db2.gz	FZIPMVYJCLAFQO-LJQANCHMSA-N	0	3	340.467	3.249	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccc2[nH]c(C)nc2c1	ZINC001024732469	1323633369	/nfs/dbraw/zinc/63/33/69/1323633369.db2.gz	ANYMXBOFRLNSQV-MRXNPFEDSA-N	0	3	326.444	3.032	20	30		EGEDHN
C=CCCN1CCCC[C@@H]1CNC(=O)c1cc2nc(C)ccc2o1	ZINC001024766339	1323664824	/nfs/dbraw/zinc/66/48/24/1323664824.db2.gz	PRRKOTWWFFZFAE-OAHLLOKOSA-N	0	3	327.428	3.297	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)C12CC3CC(CC(C3)C1)C2	ZINC001024776298	1323678229	/nfs/dbraw/zinc/67/82/29/1323678229.db2.gz	WUNIJSUMTBETRV-VJJCQHNBSA-N	0	3	328.500	3.197	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccc(N(CC)CC)nc1	ZINC001024822160	1323726546	/nfs/dbraw/zinc/72/65/46/1323726546.db2.gz	YSEZZEZCMZQNBS-SFHVURJKSA-N	0	3	344.503	3.088	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)/C=C\C2CC2)c(F)c1	ZINC001024910484	1323776909	/nfs/dbraw/zinc/77/69/09/1323776909.db2.gz	QOAKQHYDRXCZGA-YPLUBFQTSA-N	0	3	341.430	3.134	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)C=C2CCC2)c(F)c1	ZINC001024923533	1323786364	/nfs/dbraw/zinc/78/63/64/1323786364.db2.gz	VXHLFRKZRRXKJA-GOSISDBHSA-N	0	3	341.430	3.278	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001024924696	1323787615	/nfs/dbraw/zinc/78/76/15/1323787615.db2.gz	QKWLZGPIHXDGCE-MRXNPFEDSA-N	0	3	347.409	3.431	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@H]2[C@H]2CCCCN2C(=O)C(F)F)c1	ZINC001025182796	1323948809	/nfs/dbraw/zinc/94/88/09/1323948809.db2.gz	GXBADXOEMJTJGW-IAGOWNOFSA-N	0	3	347.409	3.169	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1scnc1C	ZINC001025197015	1323980998	/nfs/dbraw/zinc/98/09/98/1323980998.db2.gz	FEZUKQKGSHGZJX-HZPDHXFCSA-N	0	3	333.501	3.487	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(Cl)c[nH]1	ZINC001025198627	1323981401	/nfs/dbraw/zinc/98/14/01/1323981401.db2.gz	QPTLOQKXCZLZKL-IAGOWNOFSA-N	0	3	333.863	3.151	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1nc(C)sc1C	ZINC001025239340	1324031275	/nfs/dbraw/zinc/03/12/75/1324031275.db2.gz	DDPAFBLGYDCXBV-CVEARBPZSA-N	0	3	333.501	3.405	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(F)ccc1F	ZINC001025239877	1324032708	/nfs/dbraw/zinc/03/27/08/1324032708.db2.gz	JSXQBFBZPJFYIK-OALUTQOASA-N	0	3	346.421	3.447	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc(F)c(F)c1	ZINC001025241039	1324035228	/nfs/dbraw/zinc/03/52/28/1324035228.db2.gz	SVYMYFUCIOYDEC-OALUTQOASA-N	0	3	346.421	3.447	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc(COC)o1	ZINC001025250524	1324051573	/nfs/dbraw/zinc/05/15/73/1324051573.db2.gz	KTAJBYGWRHGGHX-DLBZAZTESA-N	0	3	332.444	3.071	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)C1CCC2(CC2)CC1	ZINC001025252685	1324058228	/nfs/dbraw/zinc/05/82/28/1324058228.db2.gz	PZHDPTVQFGXUMX-MOPGFXCFSA-N	0	3	328.500	3.436	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cccc(OC)c1F	ZINC001025283326	1324104638	/nfs/dbraw/zinc/10/46/38/1324104638.db2.gz	FPFLIDLENFDUPJ-IAGOWNOFSA-N	0	3	346.446	3.479	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc2cnccc2c1	ZINC001025286799	1324107555	/nfs/dbraw/zinc/10/75/55/1324107555.db2.gz	LETXSLGEJIWOBU-RTWAWAEBSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)Cc1ccc(Cl)cc1	ZINC001025297011	1324129162	/nfs/dbraw/zinc/12/91/62/1324129162.db2.gz	NCWOUQLOVPEWOK-RBUKOAKNSA-N	0	3	344.886	3.361	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cccnc1OCC	ZINC001025298271	1324132036	/nfs/dbraw/zinc/13/20/36/1324132036.db2.gz	VSBNKKNVUWVAPA-MSOLQXFVSA-N	0	3	343.471	3.125	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc(F)cc1F	ZINC001025298751	1324132649	/nfs/dbraw/zinc/13/26/49/1324132649.db2.gz	ZUJMMBAAJUATPK-RTBURBONSA-N	0	3	346.421	3.447	20	30		EGEDHN
C#CCCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cnc(CC)s1	ZINC001025301556	1324134876	/nfs/dbraw/zinc/13/48/76/1324134876.db2.gz	LTGVICPTBCEXJD-CVEARBPZSA-N	0	3	345.512	3.188	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc(CF)cc1	ZINC001025305728	1324139885	/nfs/dbraw/zinc/13/98/85/1324139885.db2.gz	ZNRHAKTYCGMNEJ-MOPGFXCFSA-N	0	3	328.431	3.248	20	30		EGEDHN
C[C@@H](NC(=O)C1CCC1)[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001025316140	1324150852	/nfs/dbraw/zinc/15/08/52/1324150852.db2.gz	ISDYMVFSNJPWLV-BEFAXECRSA-N	0	3	325.456	3.075	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC001025426553	1324261398	/nfs/dbraw/zinc/26/13/98/1324261398.db2.gz	XDVBKJCEQKZBNM-OCCSQVGLSA-N	0	3	338.373	3.227	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2nsc3ccccc32)C1	ZINC001025429090	1324264032	/nfs/dbraw/zinc/26/40/32/1324264032.db2.gz	RMYBTPHPJCMKNK-HUUCEWRRSA-N	0	3	341.480	3.150	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccoc2C(F)(F)F)C1	ZINC001025432073	1324268812	/nfs/dbraw/zinc/26/88/12/1324268812.db2.gz	RTKILOLWWRMERQ-OLZOCXBDSA-N	0	3	342.361	3.152	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)C2C3CC4CC(C3)CC2C4)C1	ZINC001025442707	1324282526	/nfs/dbraw/zinc/28/25/26/1324282526.db2.gz	NDCPXEWDEVFCDP-OZMCYTDGSA-N	0	3	342.527	3.299	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N[C@H](C)[C@@H]1CCCN(CC#CC)C1	ZINC001025460426	1324304112	/nfs/dbraw/zinc/30/41/12/1324304112.db2.gz	HYBLBCQPEUVZSK-QZTJIDSGSA-N	0	3	340.467	3.105	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)C2CCc3ccccc3CC2)C1	ZINC001025464522	1324310214	/nfs/dbraw/zinc/31/02/14/1324310214.db2.gz	QSWQYFPDKRBUSB-UTKZUKDTSA-N	0	3	338.495	3.032	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2occc2-c2ccccc2)C1	ZINC001025480200	1324325657	/nfs/dbraw/zinc/32/56/57/1324325657.db2.gz	RERRRYKVGNFNHC-AEFFLSMTSA-N	0	3	336.435	3.410	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cnc3ccccc3c2C)C1	ZINC001025488274	1324338851	/nfs/dbraw/zinc/33/88/51/1324338851.db2.gz	JVIMZPJEKUZXNB-QZTJIDSGSA-N	0	3	349.478	3.397	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(CCC)cc2)C1	ZINC001025522885	1324366735	/nfs/dbraw/zinc/36/67/35/1324366735.db2.gz	IPDYEOWIIKDTLT-PXNSSMCTSA-N	0	3	326.484	3.493	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(C(C)C)nc2C)C1	ZINC001025530474	1324376908	/nfs/dbraw/zinc/37/69/08/1324376908.db2.gz	IRYIHZPKOLRSNC-SJLPKXTDSA-N	0	3	341.499	3.367	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(F)c3ccccc23)C1	ZINC001025538470	1324384942	/nfs/dbraw/zinc/38/49/42/1324384942.db2.gz	GOZCCNUHWHOKBE-JKSUJKDBSA-N	0	3	338.426	3.442	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(OCC)c(C)c2)C1	ZINC001025549216	1324398290	/nfs/dbraw/zinc/39/82/90/1324398290.db2.gz	MLTBUXIRPFNUFZ-IEBWSBKVSA-N	0	3	342.483	3.247	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2coc(C3CCCC3)n2)C1	ZINC001025582438	1324423464	/nfs/dbraw/zinc/42/34/64/1324423464.db2.gz	UCICHHRCYCVTEW-RDJZCZTQSA-N	0	3	343.471	3.186	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(CC)c(CC)o2)C1	ZINC001025598878	1324447379	/nfs/dbraw/zinc/44/73/79/1324447379.db2.gz	CFEAZXAERUTKLU-RDJZCZTQSA-N	0	3	330.472	3.258	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cccc3cnccc32)C1	ZINC001025617088	1324469663	/nfs/dbraw/zinc/46/96/63/1324469663.db2.gz	DMIUZZGWCONSQF-SJLPKXTDSA-N	0	3	335.451	3.088	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(Cl)cn2CC)C1	ZINC001025623720	1324473024	/nfs/dbraw/zinc/47/30/24/1324473024.db2.gz	HOZBGSUZVWYUBB-CABCVRRESA-N	0	3	335.879	3.015	20	30		EGEDHN
Cc1ccoc1C(=O)N1C[C@@H]2CC[C@@H](NCc3ccccc3C#N)[C@H]2C1	ZINC001026198013	1324658380	/nfs/dbraw/zinc/65/83/80/1324658380.db2.gz	CMIWFXLKOCNSDE-GBESFXJTSA-N	0	3	349.434	3.100	20	30		EGEDHN
Cc1ccoc1C(=O)N1C[C@@H]2CC[C@H](NCc3ccccc3C#N)[C@H]2C1	ZINC001026198012	1324658888	/nfs/dbraw/zinc/65/88/88/1324658888.db2.gz	CMIWFXLKOCNSDE-FHWLQOOXSA-N	0	3	349.434	3.100	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H]2CC[C@H](NCc3nc(C)cs3)[C@@H]2C1	ZINC001026325973	1324727646	/nfs/dbraw/zinc/72/76/46/1324727646.db2.gz	FVZFXWLCXBLYGV-XHSDSOJGSA-N	0	3	347.528	3.380	20	30		EGEDHN
N#Cc1ccccc1CNC1CCC(NC(=O)c2ccccc2)CC1	ZINC001026444715	1324807195	/nfs/dbraw/zinc/80/71/95/1324807195.db2.gz	FHXBYAOVRTWZOB-UHFFFAOYSA-N	0	3	333.435	3.389	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC1CCC(NC(=O)CC2CCC2)CC1	ZINC001026470495	1324828265	/nfs/dbraw/zinc/82/82/65/1324828265.db2.gz	DKCCNCILEGVEQG-UHFFFAOYSA-N	0	3	343.446	3.405	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)CC2CCCC2)C1	ZINC001026656804	1324955698	/nfs/dbraw/zinc/95/56/98/1324955698.db2.gz	WPZUYAKSQXIZTR-KRWDZBQOSA-N	0	3	325.456	3.077	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1CC[C@H](CNCc2ccccc2C#N)C1	ZINC001026864697	1325053183	/nfs/dbraw/zinc/05/31/83/1325053183.db2.gz	NDHKXBGRYSVQRW-MRXNPFEDSA-N	0	3	327.472	3.179	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)c2ccn(C)c2)C1	ZINC000963285370	1325068076	/nfs/dbraw/zinc/06/80/76/1325068076.db2.gz	GGNARZDURCVKGT-NVXWUHKLSA-N	0	3	335.879	3.094	20	30		EGEDHN
CC1(C(=O)N2CC[C@H](CNCc3cc(F)ccc3C#N)C2)CCCC1	ZINC001026978162	1325121029	/nfs/dbraw/zinc/12/10/29/1325121029.db2.gz	JKCQECHKKRKQCY-OAHLLOKOSA-N	0	3	343.446	3.216	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](CNCc2ccn(C(C)C)n2)C1	ZINC001026989174	1325128066	/nfs/dbraw/zinc/12/80/66/1325128066.db2.gz	ZCYCKHJABGGQOS-MRXNPFEDSA-N	0	3	332.492	3.004	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](CNCc2csc(C3CC3)n2)C1	ZINC001026993498	1325130315	/nfs/dbraw/zinc/13/03/15/1325130315.db2.gz	DXMRVNCLDISRTG-CYBMUJFWSA-N	0	3	333.501	3.171	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](CNCc3ccccc3C#N)C2)CC1	ZINC001027040834	1325176018	/nfs/dbraw/zinc/17/60/18/1325176018.db2.gz	KOTAMFFGDXOFRI-QGZVFWFLSA-N	0	3	337.467	3.243	20	30		EGEDHN
C[C@H](CC(C)(C)C#N)N[C@H]1CCN(CCCc2ccccc2)C1=O	ZINC000925499042	1325179838	/nfs/dbraw/zinc/17/98/38/1325179838.db2.gz	LYAHVXGCLKADQB-AEFFLSMTSA-N	0	3	327.472	3.138	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)Cc2ccco2)C1	ZINC000963374705	1325180118	/nfs/dbraw/zinc/18/01/18/1325180118.db2.gz	RXSBZRXMDYRYEX-NVXWUHKLSA-N	0	3	336.863	3.278	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)Cc2ccc[nH]2)C1	ZINC000963427135	1325235534	/nfs/dbraw/zinc/23/55/34/1325235534.db2.gz	DPGQDPSBRDRISL-WBVHZDCISA-N	0	3	335.879	3.013	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCN(C(=O)C2(F)CCCCC2)C1	ZINC001027155102	1325258298	/nfs/dbraw/zinc/25/82/98/1325258298.db2.gz	HRPMRQHBTDKTQB-MRXNPFEDSA-N	0	3	343.446	3.169	20	30		EGEDHN
Cc1occc1C(=O)N1CCC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001027289798	1325422628	/nfs/dbraw/zinc/42/26/28/1325422628.db2.gz	JRWFPBSMVRLKQF-SFHVURJKSA-N	0	3	337.423	3.196	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)CC(C)(C)C)C1	ZINC001027303415	1325447155	/nfs/dbraw/zinc/44/71/55/1325447155.db2.gz	VNZDPGQWBBHVTA-SFHVURJKSA-N	0	3	327.472	3.417	20	30		EGEDHN
Cc1nc(C(C)C)ccc1CN(C)[C@H]1CCCN(C(=O)[C@@H](C)C#N)C1	ZINC001027336219	1325494647	/nfs/dbraw/zinc/49/46/47/1325494647.db2.gz	NZHFOBTXDAHRGJ-YJBOKZPZSA-N	0	3	342.487	3.096	20	30		EGEDHN
CN(Cc1ccc(F)c(C#N)c1)[C@@H]1CCCN(C(=O)CC2CCC2)C1	ZINC001027346364	1325510166	/nfs/dbraw/zinc/51/01/66/1325510166.db2.gz	FFJICLTZRFKBCW-GOSISDBHSA-N	0	3	343.446	3.310	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)COCc2ccccc2C)c1	ZINC000857010438	1325553207	/nfs/dbraw/zinc/55/32/07/1325553207.db2.gz	NTKCQXJMDQSEIF-GOSISDBHSA-N	0	3	336.391	3.168	20	30		EGEDHN
CN(Cc1ccc(F)c(C#N)c1)[C@H]1CCCN(C(=O)C=C2CCC2)C1	ZINC001027364296	1325553204	/nfs/dbraw/zinc/55/32/04/1325553204.db2.gz	XSDMUAQQNBDZID-SFHVURJKSA-N	0	3	341.430	3.230	20	30		EGEDHN
CN(Cc1ccc(F)c(C#N)c1)[C@H]1CCCN(C(=O)[C@@H]2CC2(C)C)C1	ZINC001027374538	1325570899	/nfs/dbraw/zinc/57/08/99/1325570899.db2.gz	FHHSCRZWFVURED-IRXDYDNUSA-N	0	3	343.446	3.166	20	30		EGEDHN
Cc1cc(C(=O)N2CCC[C@H](N(C)Cc3ccc(C#N)cc3)C2)co1	ZINC001027383451	1325583288	/nfs/dbraw/zinc/58/32/88/1325583288.db2.gz	HJRMWWXFFUZXDM-IBGZPJMESA-N	0	3	337.423	3.196	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)C[C@H](C)c2ccco2)cc1	ZINC000860472959	1329321921	/nfs/dbraw/zinc/32/19/21/1329321921.db2.gz	QSLHYMOSZKJJPA-WFASDCNBSA-N	0	3	326.352	3.129	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)C2CC(C)(C)C2)C1	ZINC001027396548	1327612472	/nfs/dbraw/zinc/61/24/72/1327612472.db2.gz	YVDDMGNJBYPZQX-LJQANCHMSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)[C@H]1Cc3ccc(F)cc31)C2	ZINC000964690475	1327652810	/nfs/dbraw/zinc/65/28/10/1327652810.db2.gz	NYJBQBZFVAEDPY-GXMUVECYSA-N	0	3	348.849	3.235	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1occc1Cl)C2	ZINC000964899268	1327756909	/nfs/dbraw/zinc/75/69/09/1327756909.db2.gz	BXRUVPCQQZIEQC-UHFFFAOYSA-N	0	3	329.227	3.316	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2ccc(Cl)s2)C1	ZINC001027546277	1327851012	/nfs/dbraw/zinc/85/10/12/1327851012.db2.gz	KOHHROSCXXXKHS-BFHYXJOUSA-N	0	3	336.888	3.061	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001027563755	1327887029	/nfs/dbraw/zinc/88/70/29/1327887029.db2.gz	CXFJBFLZMROQER-VAMGGRTRSA-N	0	3	339.483	3.417	20	30		EGEDHN
C[C@@H](NCCNc1ccc(C#N)cn1)c1ccccc1OC(F)F	ZINC000927163128	1327901142	/nfs/dbraw/zinc/90/11/42/1327901142.db2.gz	DFIKRLHPXGFDAX-GFCCVEGCSA-N	0	3	332.354	3.317	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)C2CC3(CC3)C2)C1	ZINC001027571077	1327902944	/nfs/dbraw/zinc/90/29/44/1327902944.db2.gz	QRBYJTGRVIICGB-IBGZPJMESA-N	0	3	337.467	3.171	20	30		EGEDHN
C[C@H](NCCNc1ccc(C#N)cn1)c1ccc(C(F)(F)F)cn1	ZINC000927168417	1327904192	/nfs/dbraw/zinc/90/41/92/1327904192.db2.gz	SFZGPGIEMBPYMB-NSHDSACASA-N	0	3	335.333	3.130	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)C2(CF)CCC2)C1	ZINC001027582308	1327918384	/nfs/dbraw/zinc/91/83/84/1327918384.db2.gz	LTHNHDRXCIORJA-GOSISDBHSA-N	0	3	343.446	3.121	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)C(C)(C)c2ccccc2Cl)C1	ZINC001027656820	1328041463	/nfs/dbraw/zinc/04/14/63/1328041463.db2.gz	ZUOKTIFMYSEHRF-HNNXBMFYSA-N	0	3	332.875	3.174	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)Cc1cccc(F)c1)C2	ZINC000965903171	1328094209	/nfs/dbraw/zinc/09/42/09/1328094209.db2.gz	KEHJZSRKPRRYGN-UHFFFAOYSA-N	0	3	336.838	3.138	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)C2(C(F)(F)F)CCCCC2)C1	ZINC001027702161	1328116699	/nfs/dbraw/zinc/11/66/99/1328116699.db2.gz	WAORUWWFZXKDDZ-AWEZNQCLSA-N	0	3	330.394	3.055	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1c(C)nsc1C)C2	ZINC000965937500	1328118433	/nfs/dbraw/zinc/11/84/33/1328118433.db2.gz	CHJJBCYJXBWMDT-UHFFFAOYSA-N	0	3	339.892	3.143	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)[C@H](C)Cc2cccc(Cl)c2)C1	ZINC001027704240	1328119373	/nfs/dbraw/zinc/11/93/73/1328119373.db2.gz	LZGQSMDULHXXQN-CRAIPNDOSA-N	0	3	332.875	3.075	20	30		EGEDHN
N#Cc1cc(C(=O)NC[C@H]2CCCN2Cc2ccc(C3CC3)cc2)c[nH]1	ZINC001027835391	1328290172	/nfs/dbraw/zinc/29/01/72/1328290172.db2.gz	BMTHFAWDXIZFKO-HXUWFJFHSA-N	0	3	348.450	3.158	20	30		EGEDHN
N#Cc1cc(CN[C@@H]2CCN(C(=O)CCC3CCCC3)C2)ccc1F	ZINC000966560637	1328340514	/nfs/dbraw/zinc/34/05/14/1328340514.db2.gz	CZPPBVMSCPVTJI-GOSISDBHSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1ccn(C2CCCCC2)n1	ZINC001027881570	1328347305	/nfs/dbraw/zinc/34/73/05/1328347305.db2.gz	SIAPTGCGOFQMFQ-KRWDZBQOSA-N	0	3	330.476	3.159	20	30		EGEDHN
C=C(C)CCN1CCC[C@H]1CNC(=O)c1cnc([C@@H](C)OC)s1	ZINC001027886224	1328353944	/nfs/dbraw/zinc/35/39/44/1328353944.db2.gz	PJWHDPGYNKRKEE-KGLIPLIRSA-N	0	3	337.489	3.011	20	30		EGEDHN
C=C(C)CCN1CC[C@H](C)[C@@H](NC(=O)c2cn3cc(C)nc3s2)C1	ZINC000966718364	1328391274	/nfs/dbraw/zinc/39/12/74/1328391274.db2.gz	CIVMKXXCHBSILV-ZFWWWQNUSA-N	0	3	346.500	3.111	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)[C@@H]1C[C@H]1c1ccc(F)cc1F	ZINC001028042934	1328504847	/nfs/dbraw/zinc/50/48/47/1328504847.db2.gz	BWVTZIVYOPZCEY-BHYGNILZSA-N	0	3	334.410	3.225	20	30		EGEDHN
C#CC[C@H](CCOC)[NH2+]Cc1ccc(OCc2ccccc2)cc1[O-]	ZINC000862548132	1329495892	/nfs/dbraw/zinc/49/58/92/1329495892.db2.gz	YKXHEYZVYZRNHY-LJQANCHMSA-N	0	3	339.435	3.489	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN[C@H](c1ccccn1)C1CC1	ZINC000932375347	1329809533	/nfs/dbraw/zinc/80/95/33/1329809533.db2.gz	OPJOIUQWWBAORE-INIZCTEOSA-N	0	3	326.425	3.084	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(Cl)c(N(C)C)c2)CC1	ZINC000932742360	1329838895	/nfs/dbraw/zinc/83/88/95/1329838895.db2.gz	SGVYRNQYCDEWRM-UHFFFAOYSA-N	0	3	336.867	3.178	20	30		EGEDHN
CC(C)N1CCC[C@@H](N2CCC(c3ccc(C#N)cc3)CC2)C1=O	ZINC000933612111	1329905878	/nfs/dbraw/zinc/90/58/78/1329905878.db2.gz	DOHLPEJMEHIAOI-LJQANCHMSA-N	0	3	325.456	3.137	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc3nc(C)sc3c2)CC1	ZINC001052844013	1348699112	/nfs/dbraw/zinc/69/91/12/1348699112.db2.gz	YDNGQMZAPAPCFA-MRXNPFEDSA-N	0	3	341.480	3.212	20	30		EGEDHN
C#Cc1ccc(NC(=O)NCC2CCN(Cc3ccncc3)CC2)cc1	ZINC000934921750	1330017673	/nfs/dbraw/zinc/01/76/73/1330017673.db2.gz	DWPLAOUFYIWUGJ-UHFFFAOYSA-N	0	3	348.450	3.097	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2sc(Cl)nc2Cl)CC1	ZINC001052939072	1348757973	/nfs/dbraw/zinc/75/79/73/1348757973.db2.gz	JUGPQMXUDYRETK-JTQLQIEISA-N	0	3	346.283	3.058	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N[C@H]1CCN(Cc2ccc(C#N)cc2)CC1(C)C	ZINC000940685963	1331157566	/nfs/dbraw/zinc/15/75/66/1331157566.db2.gz	JEKMDWQZUUHCNC-MSOLQXFVSA-N	0	3	339.483	3.321	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2oc3c(cccc3F)c2C)[C@H](C)C1	ZINC000942124534	1331839637	/nfs/dbraw/zinc/83/96/37/1331839637.db2.gz	ZAHHVRMORQKDTK-DYVFJYSZSA-N	0	3	342.414	3.344	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3c([nH]2)c(F)ccc3C)[C@H](C)C1	ZINC000942205671	1331879620	/nfs/dbraw/zinc/87/96/20/1331879620.db2.gz	VLMKQEGVOKGUCQ-RHSMWYFYSA-N	0	3	341.430	3.079	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2csc(C(F)(F)F)c2)[C@H](C)C1	ZINC000942260026	1331890465	/nfs/dbraw/zinc/89/04/65/1331890465.db2.gz	WBGQWGJARNLRNP-PWSUYJOCSA-N	0	3	332.391	3.393	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2csc(C(F)(F)F)c2)[C@@H](C)C1	ZINC000942260036	1331890540	/nfs/dbraw/zinc/89/05/40/1331890540.db2.gz	WFBWGOOTFNLFHV-AAEUAGOBSA-N	0	3	344.402	3.230	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2c(C)occ2C(F)(F)F)[C@H](C)C1	ZINC000942517576	1331950709	/nfs/dbraw/zinc/95/07/09/1331950709.db2.gz	BOTAGLLNGHGPLZ-RISCZKNCSA-N	0	3	342.361	3.070	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2csc3ccccc23)[C@H](C)C1	ZINC000942541202	1331965636	/nfs/dbraw/zinc/96/56/36/1331965636.db2.gz	WXCVYFCBDIXMSU-PBHICJAKSA-N	0	3	326.465	3.365	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2sccc2-n2cccc2)[C@H](C)C1	ZINC000942546354	1331967523	/nfs/dbraw/zinc/96/75/23/1331967523.db2.gz	SVHREGOMJFJPQF-HUUCEWRRSA-N	0	3	329.469	3.165	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3ccc(F)cc3)CCC2)[C@@H](C)C1	ZINC000942547043	1331968363	/nfs/dbraw/zinc/96/83/63/1331968363.db2.gz	FIAOBOYEVQVWEI-LPHOPBHVSA-N	0	3	342.458	3.097	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2nsc3ccc(C)cc32)[C@@H](C)C1	ZINC000942563435	1331977418	/nfs/dbraw/zinc/97/74/18/1331977418.db2.gz	XRQNPKPMSFDHEA-DZGCQCFKSA-N	0	3	329.469	3.231	20	30		EGEDHN
C[C@H]1CN(Cc2ccc(C#N)cc2)CC[C@@H]1NC(=O)C(C)(C)C1CC1	ZINC000942569347	1331980030	/nfs/dbraw/zinc/98/00/30/1331980030.db2.gz	JCAYLKYPVCGEIZ-KXBFYZLASA-N	0	3	339.483	3.321	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCN(Cc3ncccc3C)C[C@@H]2C)CC1	ZINC000942600866	1331998110	/nfs/dbraw/zinc/99/81/10/1331998110.db2.gz	WDQGRLZQRIZKAG-PKOBYXMFSA-N	0	3	341.499	3.463	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3ccc(C#N)cc3)C[C@H]2C)C1	ZINC000942602839	1332000181	/nfs/dbraw/zinc/00/01/81/1332000181.db2.gz	OEWRYDJQQQHVKL-APWZRJJASA-N	0	3	337.467	3.241	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(C)oc2C(F)(F)F)[C@@H](C)C1	ZINC000943209074	1332121742	/nfs/dbraw/zinc/12/17/42/1332121742.db2.gz	ODSKNWOVOSRGOR-GXFFZTMASA-N	0	3	330.350	3.233	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc3nc(C)sc3c2)[C@H](C)C1	ZINC000943990026	1332305347	/nfs/dbraw/zinc/30/53/47/1332305347.db2.gz	ZUIWYFPGSUHJCC-CZUORRHYSA-N	0	3	341.480	3.068	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C(C)(C)c2ccccc2Cl)[C@@H](C)C1	ZINC000944215822	1332347552	/nfs/dbraw/zinc/34/75/52/1332347552.db2.gz	VSSZSSFCOQLNQA-WMLDXEAASA-N	0	3	332.875	3.077	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(Cl)c(Cl)c2)[C@H](C)C1	ZINC000944306532	1332368400	/nfs/dbraw/zinc/36/84/00/1332368400.db2.gz	SGQNMLVSEPHFTB-WBMJQRKESA-N	0	3	339.266	3.457	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccc(OCC(C)C)c2)[C@@H](C)C1	ZINC000944810261	1332426674	/nfs/dbraw/zinc/42/66/74/1332426674.db2.gz	HDGHFSNRBYZYLR-FXAWDEMLSA-N	0	3	342.483	3.185	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2c3ccccc3oc2CC)[C@H](C)C1	ZINC000945178717	1332525966	/nfs/dbraw/zinc/52/59/66/1332525966.db2.gz	GMYXQLZLUFLSHZ-WBVHZDCISA-N	0	3	338.451	3.459	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2coc(C3CCCCC3)n2)[C@@H](C)C1	ZINC000945334224	1332559301	/nfs/dbraw/zinc/55/93/01/1332559301.db2.gz	MHSKMWMCRDPPCO-GOEBONIOSA-N	0	3	331.460	3.349	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@H]3CCC[C@@H](F)C3)CC[C@@H]2C1	ZINC000946590905	1332858972	/nfs/dbraw/zinc/85/89/72/1332858972.db2.gz	KXYIDIAUOLGRCL-MWDXBVQZSA-N	0	3	342.886	3.438	20	30		EGEDHN
CC1(C(=O)N2CC[C@H]3CN(Cc4ccccc4C#N)C[C@H]3CC2)CC1	ZINC000946599959	1332860253	/nfs/dbraw/zinc/86/02/53/1332860253.db2.gz	YLAWJMTWSFENCE-KDURUIRLSA-N	0	3	337.467	3.029	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@H](C)C(F)(F)F)CC[C@@H]2C1	ZINC000946715855	1332883045	/nfs/dbraw/zinc/88/30/45/1332883045.db2.gz	PBMLGQZIOFYBJW-RWMBFGLXSA-N	0	3	338.801	3.108	20	30		EGEDHN
Cc1cc(CN2CC[C@@H](NC(=O)c3cc(C#N)c[nH]3)C[C@H]2C)cs1	ZINC000947171607	1333036016	/nfs/dbraw/zinc/03/60/16/1333036016.db2.gz	YELSMRXQINIAIP-MLGOLLRUSA-N	0	3	342.468	3.039	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2cc(C#N)c[nH]2)CCN1C/C=C/c1ccccc1	ZINC000947173871	1333036697	/nfs/dbraw/zinc/03/66/97/1333036697.db2.gz	AUPXDFXFDZAFNF-HPWWWVCSSA-N	0	3	348.450	3.182	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccc(C(F)F)c2F)C[C@@H]1C	ZINC000947319874	1333087456	/nfs/dbraw/zinc/08/74/56/1333087456.db2.gz	VLGOEPOAKARUTP-QWHCGFSZSA-N	0	3	338.373	3.369	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(C)CCC(F)(F)CC2)C[C@H]1C	ZINC000947460848	1333137699	/nfs/dbraw/zinc/13/76/99/1333137699.db2.gz	ZXFXYXOQJFJOCL-HUUCEWRRSA-N	0	3	326.431	3.194	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(F)cc3ccoc32)C[C@H]1C	ZINC000947468330	1333140102	/nfs/dbraw/zinc/14/01/02/1333140102.db2.gz	IQCBTCGVEAFELZ-CJNGLKHVSA-N	0	3	328.387	3.178	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)n(C(CC)CC)n2)C[C@@H]1C	ZINC000947471651	1333141365	/nfs/dbraw/zinc/14/13/65/1333141365.db2.gz	DUTWRSXAOHECQQ-RDJZCZTQSA-N	0	3	344.503	3.159	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](NC(=O)c2n[nH]c3ccc(C)cc32)C[C@@H]1C	ZINC000947492987	1333145821	/nfs/dbraw/zinc/14/58/21/1333145821.db2.gz	OINVWZPELQPVNY-UONOGXRCSA-N	0	3	346.862	3.207	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2[nH]c3ccccc3c2Cl)C[C@@H]1C	ZINC000947497214	1333147189	/nfs/dbraw/zinc/14/71/89/1333147189.db2.gz	HGKSMADHINKAGK-UONOGXRCSA-N	0	3	343.858	3.427	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2csc(C(F)(F)F)c2)C[C@@H]1C	ZINC000947497541	1333147530	/nfs/dbraw/zinc/14/75/30/1333147530.db2.gz	JHBXCDNZHGLQLU-AAEUAGOBSA-N	0	3	344.402	3.373	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(-n3cccc3)cc2)C[C@H]1C	ZINC000947512067	1333151515	/nfs/dbraw/zinc/15/15/15/1333151515.db2.gz	TUHOZXUJMGSRMR-IEBWSBKVSA-N	0	3	335.451	3.083	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(-c3ccccc3)on2)C[C@@H]1C	ZINC000947523525	1333157203	/nfs/dbraw/zinc/15/72/03/1333157203.db2.gz	DSGGJJGXJLNXGG-GOEBONIOSA-N	0	3	325.412	3.110	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc(C(F)F)cc2)C[C@H]1C	ZINC000947540857	1333164954	/nfs/dbraw/zinc/16/49/54/1333164954.db2.gz	ZKTYUEBYSSCVEF-RHSMWYFYSA-N	0	3	334.410	3.159	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C)nc2C(C)C)C[C@H]1C	ZINC000947584260	1333182203	/nfs/dbraw/zinc/18/22/03/1333182203.db2.gz	HFAKBSHOGUTKDG-IAGOWNOFSA-N	0	3	327.472	3.119	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3cccc(C)c3)CCC2)C[C@H]1C	ZINC000947602218	1333190004	/nfs/dbraw/zinc/19/00/04/1333190004.db2.gz	JCWJXMALNXAATL-UYAOXDASSA-N	0	3	338.495	3.409	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2csc(-c3ccco3)n2)C[C@H]1C	ZINC000947661788	1333212799	/nfs/dbraw/zinc/21/27/99/1333212799.db2.gz	AIVHOVCQXRMTER-OLZOCXBDSA-N	0	3	331.441	3.172	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccccc2-n2cccc2)C[C@@H]1C	ZINC000947686446	1333223274	/nfs/dbraw/zinc/22/32/74/1333223274.db2.gz	YHZIEBYPQQQSOP-ROUUACIJSA-N	0	3	335.451	3.083	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2c(C)cc(C)cc2C)C[C@H]1C	ZINC000947689940	1333225339	/nfs/dbraw/zinc/22/53/39/1333225339.db2.gz	OJOHOZLVGBTBED-MOPGFXCFSA-N	0	3	326.484	3.147	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ncoc2-c2cccs2)C[C@H]1C	ZINC000947825646	1333272069	/nfs/dbraw/zinc/27/20/69/1333272069.db2.gz	URCYJNZGPINVSU-OLZOCXBDSA-N	0	3	331.441	3.172	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2sc(CC3CC3)nc2C)C[C@H]1C	ZINC000947861457	1333283964	/nfs/dbraw/zinc/28/39/64/1333283964.db2.gz	MSJCVRSIVKQTIE-CJNGLKHVSA-N	0	3	345.512	3.010	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2sc(CC3CC3)nc2C)C[C@@H]1C	ZINC000947862051	1333284311	/nfs/dbraw/zinc/28/43/11/1333284311.db2.gz	RLZQOMRGXDEGTE-WFASDCNBSA-N	0	3	333.501	3.173	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cnn(C(CC)CC)c2C)C[C@@H]1C	ZINC000947908269	1333302230	/nfs/dbraw/zinc/30/22/30/1333302230.db2.gz	QUEPNCGTWRQSCX-DOTOQJQBSA-N	0	3	344.503	3.159	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2[nH]ccc2-c2ccccc2)C[C@@H]1C	ZINC000947916364	1333306659	/nfs/dbraw/zinc/30/66/59/1333306659.db2.gz	QMWZNILNXQVTJO-FUHWJXTLSA-N	0	3	335.451	3.288	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2coc(-c3ccccc3)n2)C[C@H]1C	ZINC000947940980	1333313870	/nfs/dbraw/zinc/31/38/70/1333313870.db2.gz	VTGGMGVKBLHTHH-GDBMZVCRSA-N	0	3	325.412	3.110	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccsc2C(F)F)C[C@H]1C	ZINC000947983498	1333330889	/nfs/dbraw/zinc/33/08/89/1333330889.db2.gz	BDKRVQFBQHOQJF-VXGBXAGGSA-N	0	3	326.412	3.292	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccccc2CC(C)C)C[C@@H]1C	ZINC000948082461	1333369648	/nfs/dbraw/zinc/36/96/48/1333369648.db2.gz	DBMFVGYXEQKKDD-PKOBYXMFSA-N	0	3	326.484	3.491	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(N(C)CCC)cc2)C[C@@H]1C	ZINC000948095306	1333372944	/nfs/dbraw/zinc/37/29/44/1333372944.db2.gz	VCHDDGYRSUOFSO-PKOBYXMFSA-N	0	3	341.499	3.139	20	30		EGEDHN
CN(C(=O)C(C)(C)F)[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948142834	1333390694	/nfs/dbraw/zinc/39/06/94/1333390694.db2.gz	QZRSMJMXFQHDSA-QGZVFWFLSA-N	0	3	331.435	3.119	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cccc3scnc32)CC1	ZINC000948374081	1333499752	/nfs/dbraw/zinc/49/97/52/1333499752.db2.gz	TUCMZBLFQKZSCS-HNNXBMFYSA-N	0	3	341.480	3.246	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cc(C)n([C@H](C)CC)n2)CC1	ZINC000948570228	1333580228	/nfs/dbraw/zinc/58/02/28/1333580228.db2.gz	ITAOLTKUCUQJCW-AEFFLSMTSA-N	0	3	344.503	3.112	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)Cc2cccc(C)c2Cl)CC1	ZINC000948611684	1333595112	/nfs/dbraw/zinc/59/51/12/1333595112.db2.gz	AFCPOPUGVIAVDB-KRWDZBQOSA-N	0	3	332.875	3.137	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)C2(c3cccc(C)c3)CCC2)CC1	ZINC000948665432	1333620110	/nfs/dbraw/zinc/62/01/10/1333620110.db2.gz	JXIYGURXJGHRJX-FQEVSTJZSA-N	0	3	338.495	3.363	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2cc3cc(Cl)ccc3[nH]2)CC1	ZINC000948666077	1333621960	/nfs/dbraw/zinc/62/19/60/1333621960.db2.gz	ZYVSHQXMXCAJGL-INIZCTEOSA-N	0	3	343.858	3.381	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)C[C@H]2CCCC2(F)F)CC1	ZINC000948717270	1333645322	/nfs/dbraw/zinc/64/53/22/1333645322.db2.gz	QCFRYYYREPNCDT-CVEARBPZSA-N	0	3	326.431	3.148	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)Cc2c(C)cc(C)cc2C)CC1	ZINC000948742204	1333654919	/nfs/dbraw/zinc/65/49/19/1333654919.db2.gz	IBHOSLAYRLHJRT-LJQANCHMSA-N	0	3	326.484	3.100	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@@H]2CCCN(Cc3cnoc3C)CC2)C1	ZINC000948753062	1333662123	/nfs/dbraw/zinc/66/21/23/1333662123.db2.gz	GBLAMKFUNURLAU-QGZVFWFLSA-N	0	3	331.460	3.152	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2ccccc2O[C@H](C)CC)CC1	ZINC000948820895	1333698138	/nfs/dbraw/zinc/69/81/38/1333698138.db2.gz	UQCBOJBUQJERLH-MSOLQXFVSA-N	0	3	342.483	3.424	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2ccc(OC)cc2Cl)CC1	ZINC000948865390	1333714746	/nfs/dbraw/zinc/71/47/46/1333714746.db2.gz	QJZXWCQHCXOKIJ-OAHLLOKOSA-N	0	3	348.874	3.298	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)[C@]2(c3ccccc3)CC2(C)C)CC1	ZINC000948876713	1333716830	/nfs/dbraw/zinc/71/68/30/1333716830.db2.gz	BNDAOUYWPZLBKH-SIKLNZKXSA-N	0	3	338.495	3.300	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@@H]1CNC(=O)c1ccsn1	ZINC000948932746	1333738705	/nfs/dbraw/zinc/73/87/05/1333738705.db2.gz	OIDLVDQUQGAESG-SFHVURJKSA-N	0	3	341.480	3.439	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H]1[C@H](C=C(C)C)C1(C)C)CCO2	ZINC000949135071	1333783237	/nfs/dbraw/zinc/78/32/37/1333783237.db2.gz	CBRYMYPVBUUSOS-ROUUACIJSA-N	0	3	346.515	3.104	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1cc(C)c(CC)s1)CCO2	ZINC000949241502	1333801753	/nfs/dbraw/zinc/80/17/53/1333801753.db2.gz	BIKIKGNSEVQMJO-UHFFFAOYSA-N	0	3	348.512	3.112	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C(C)=C3CCCC3)CC2)C1	ZINC000949338076	1333826564	/nfs/dbraw/zinc/82/65/64/1333826564.db2.gz	GQEODBIFLBVAOQ-UHFFFAOYSA-N	0	3	332.488	3.146	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC2(CC1)CN(CCC1CC1)CCO2	ZINC000949433521	1333845763	/nfs/dbraw/zinc/84/57/63/1333845763.db2.gz	YCERGGCSNHLCJR-UHFFFAOYSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C(CC)(CC)CC)CC2)C1	ZINC000949498704	1333861557	/nfs/dbraw/zinc/86/15/57/1333861557.db2.gz	IWSYXOHEGQGZCA-UHFFFAOYSA-N	0	3	336.520	3.472	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3oc(CC)cc3C)CC2)C1	ZINC000949512111	1333863718	/nfs/dbraw/zinc/86/37/18/1333863718.db2.gz	JJPXMZNOZOJBTL-UHFFFAOYSA-N	0	3	346.471	3.034	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N1CCN(CC2CCCCCC2)CC1	ZINC000951594864	1334276152	/nfs/dbraw/zinc/27/61/52/1334276152.db2.gz	MMOKXFDQYYFOPI-PMACEKPBSA-N	0	3	348.531	3.472	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cc3c([nH]2)c(F)ccc3C)C1	ZINC000967064529	1335652783	/nfs/dbraw/zinc/65/27/83/1335652783.db2.gz	UQBZTBKBEIOXTK-KDOFPFPSSA-N	0	3	341.430	3.079	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2cc3c([nH]2)c(F)ccc3C)C1	ZINC000967064530	1335652817	/nfs/dbraw/zinc/65/28/17/1335652817.db2.gz	UQBZTBKBEIOXTK-KSSFIOAISA-N	0	3	341.430	3.079	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2occc2-c2ccccc2)C1	ZINC000967284821	1335688808	/nfs/dbraw/zinc/68/88/08/1335688808.db2.gz	OKXAGABBGFLFJU-VQIMIIECSA-N	0	3	336.435	3.410	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2occc2-c2ccccc2)C1	ZINC000967284820	1335688861	/nfs/dbraw/zinc/68/88/61/1335688861.db2.gz	OKXAGABBGFLFJU-QFBILLFUSA-N	0	3	336.435	3.410	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2cnn3cccc(Cl)c23)C1	ZINC000967287683	1335690564	/nfs/dbraw/zinc/69/05/64/1335690564.db2.gz	IKGZKEZWZSKCLM-CJNGLKHVSA-N	0	3	346.862	3.004	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2cc(-c3ccccc3)on2)C1	ZINC000967289044	1335691003	/nfs/dbraw/zinc/69/10/03/1335691003.db2.gz	QVMQXCPLBOVDHZ-CRAIPNDOSA-N	0	3	339.439	3.358	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cc(-c3ccccc3)on2)C1	ZINC000967289046	1335691045	/nfs/dbraw/zinc/69/10/45/1335691045.db2.gz	QVMQXCPLBOVDHZ-QAPCUYQASA-N	0	3	339.439	3.358	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)Cc2cc3ccccc3s2)C1	ZINC000967331756	1335702957	/nfs/dbraw/zinc/70/29/57/1335702957.db2.gz	COBMJWOYWPNGOC-MAUKXSAKSA-N	0	3	340.492	3.294	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)Cc2ccc(C(F)F)cc2)C1	ZINC000967332336	1335703575	/nfs/dbraw/zinc/70/35/75/1335703575.db2.gz	DCRVAJYJCCKCEL-WMLDXEAASA-N	0	3	334.410	3.017	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2ncsc2C(F)(F)F)C1	ZINC000967358557	1335713254	/nfs/dbraw/zinc/71/32/54/1335713254.db2.gz	RYCCIZUWLJRNDN-QWRGUYRKSA-N	0	3	347.406	3.178	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2cc3ccc(C)cc3[nH]2)C1	ZINC000967467650	1335750295	/nfs/dbraw/zinc/75/02/95/1335750295.db2.gz	PMCGGYJVJNXBAC-BEFAXECRSA-N	0	3	325.456	3.493	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)Cc2ccccc2OC(C)C)C1	ZINC000968413948	1335923646	/nfs/dbraw/zinc/92/36/46/1335923646.db2.gz	NREHSRVDDVOTGJ-MJGOQNOKSA-N	0	3	344.499	3.419	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)C(C)(C)c2cccc(OC)c2)C1	ZINC000968501045	1335943382	/nfs/dbraw/zinc/94/33/82/1335943382.db2.gz	ODUKJAKAPZSAKO-QFBILLFUSA-N	0	3	344.499	3.376	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2csc(C(F)(F)F)n2)C1	ZINC000968500729	1335943764	/nfs/dbraw/zinc/94/37/64/1335943764.db2.gz	IVBJSKWVECPDBI-QWRGUYRKSA-N	0	3	347.406	3.178	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2cc3c(C)cccn3c2)C1	ZINC000968539933	1335956710	/nfs/dbraw/zinc/95/67/10/1335956710.db2.gz	RCBXEVAKYXZABU-CRAIPNDOSA-N	0	3	325.456	3.264	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2cc3c(C)cccn3c2)C1	ZINC000968539935	1335956765	/nfs/dbraw/zinc/95/67/65/1335956765.db2.gz	RCBXEVAKYXZABU-QAPCUYQASA-N	0	3	325.456	3.264	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccsc2C(F)F)C1	ZINC000968598340	1335978870	/nfs/dbraw/zinc/97/88/70/1335978870.db2.gz	DCUUOGSNNCJICJ-YPMHNXCESA-N	0	3	326.412	3.149	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2ccsc2C(F)F)C1	ZINC000968598339	1335978948	/nfs/dbraw/zinc/97/89/48/1335978948.db2.gz	DCUUOGSNNCJICJ-WCQYABFASA-N	0	3	326.412	3.149	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2sc(CCC)nc2C)C1	ZINC000968643412	1335994316	/nfs/dbraw/zinc/99/43/16/1335994316.db2.gz	LTPATPXISAXOKM-UKRRQHHQSA-N	0	3	335.517	3.420	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)C2(c3cc(C)cc(C)c3)CC2)C1	ZINC000968652180	1335997700	/nfs/dbraw/zinc/99/77/00/1335997700.db2.gz	PZOTZFPSHYBEPE-QUCCMNQESA-N	0	3	338.495	3.185	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cc(Cl)c(Cl)n1C	ZINC000968877295	1336076764	/nfs/dbraw/zinc/07/67/64/1336076764.db2.gz	SGTVMNXGFOJEPH-GFCCVEGCSA-N	0	3	344.286	3.492	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1ccc2cc(C)cn2c1	ZINC000968882504	1336078920	/nfs/dbraw/zinc/07/89/20/1336078920.db2.gz	PDEDHEWTXRYVDH-FQEVSTJZSA-N	0	3	337.467	3.245	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)[C@H]1CCCN1c1ccccc1	ZINC000968882264	1336079438	/nfs/dbraw/zinc/07/94/38/1336079438.db2.gz	KPAAFCXMBHBQPQ-VQTJNVASSA-N	0	3	341.499	3.202	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1ccc(C)c(OC)c1	ZINC000968940827	1336097765	/nfs/dbraw/zinc/09/77/65/1336097765.db2.gz	AUFKIVQANMAVGE-SFHVURJKSA-N	0	3	328.456	3.001	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)[C@@H]1CCc2cc(C)ccc2O1	ZINC000968951725	1336101148	/nfs/dbraw/zinc/10/11/48/1336101148.db2.gz	DDHLMQPTXBAWEC-ICSRJNTNSA-N	0	3	342.483	3.235	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)[C@H]1CCc2cc(C)ccc2O1	ZINC000968951727	1336101194	/nfs/dbraw/zinc/10/11/94/1336101194.db2.gz	DDHLMQPTXBAWEC-UYAOXDASSA-N	0	3	342.483	3.235	20	30		EGEDHN
C#CCN1CCCCC[C@H]1CNC(=O)c1[nH]ccc1-c1ccccc1	ZINC000969111842	1336148103	/nfs/dbraw/zinc/14/81/03/1336148103.db2.gz	URTIFSHTVBNZFY-SFHVURJKSA-N	0	3	335.451	3.289	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1cccnc1OCC	ZINC000969133776	1336155453	/nfs/dbraw/zinc/15/54/53/1336155453.db2.gz	SEHIGFOCNHPOLI-MRXNPFEDSA-N	0	3	331.460	3.031	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N[C@@H](C)C1CN(CC[C@H](C)F)C1	ZINC000969990781	1336269935	/nfs/dbraw/zinc/26/99/35/1336269935.db2.gz	ULXMVVUZCCUGIZ-GJZGRUSLSA-N	0	3	334.435	3.050	20	30		EGEDHN
C=Cc1ccc(C(=O)N2CC[C@@H](NCc3ccc(C#N)c(F)c3)C2)cc1	ZINC000970050803	1336273716	/nfs/dbraw/zinc/27/37/16/1336273716.db2.gz	ZLHAECILCHGLPI-LJQANCHMSA-N	0	3	349.409	3.345	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2coc(Br)c2)CC1	ZINC001005468450	1336356377	/nfs/dbraw/zinc/35/63/77/1336356377.db2.gz	FGHHHYUGCHLXEZ-UHFFFAOYSA-N	0	3	341.249	3.155	20	30		EGEDHN
C[C@@H](C(=O)N(C)C1CCN(Cc2ccc(C#N)cc2)CC1)C1CCC1	ZINC001005567717	1336372476	/nfs/dbraw/zinc/37/24/76/1336372476.db2.gz	CPWVBGAWQNVOCG-MRXNPFEDSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C(Cl)CN1CCC(N(C)C(=O)c2[nH]nc3ccc(C)cc32)CC1	ZINC001005661059	1336388400	/nfs/dbraw/zinc/38/84/00/1336388400.db2.gz	PTAZJMFIKIGIBR-UHFFFAOYSA-N	0	3	346.862	3.160	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2nc(Cl)sc2C)CC1	ZINC001005696664	1336394259	/nfs/dbraw/zinc/39/42/59/1336394259.db2.gz	YWQXBBNCXOKRMB-UHFFFAOYSA-N	0	3	327.881	3.217	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2noc3c2CC(C)(C)CC3)CC1	ZINC001005767874	1336400364	/nfs/dbraw/zinc/40/03/64/1336400364.db2.gz	JSCPMTMMXABWER-UHFFFAOYSA-N	0	3	345.487	3.302	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2sccc2-n2cccc2)CC1	ZINC001005795894	1336402747	/nfs/dbraw/zinc/40/27/47/1336402747.db2.gz	NRKWXSXXLDHKSH-UHFFFAOYSA-N	0	3	329.469	3.261	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)C2CCN(CCc3csc(C)n3)CC2)C1	ZINC001005963366	1336430917	/nfs/dbraw/zinc/43/09/17/1336430917.db2.gz	HGMHWDHVQXHDIJ-UHFFFAOYSA-N	0	3	347.528	3.273	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N(C)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001006025287	1336439230	/nfs/dbraw/zinc/43/92/30/1336439230.db2.gz	NHGUYGPAPFTNBF-IEBWSBKVSA-N	0	3	325.456	3.027	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)C[C@@H]2CCc3ccccc3C2)CC1	ZINC001006337059	1336491427	/nfs/dbraw/zinc/49/14/27/1336491427.db2.gz	HYJYPIYQMOAPOZ-QGZVFWFLSA-N	0	3	326.484	3.290	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H](NC(=O)c2noc3c2CCCCC3)C1	ZINC001008713070	1336915814	/nfs/dbraw/zinc/91/58/14/1336915814.db2.gz	HOUCSDDVGLOWHU-OAHLLOKOSA-N	0	3	331.460	3.104	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN(Cc3c(C)cccc3C)C2)cn1	ZINC001009269373	1336994378	/nfs/dbraw/zinc/99/43/78/1336994378.db2.gz	OBKCHOHIGZMWHM-HXUWFJFHSA-N	0	3	347.462	3.074	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2cc(F)c(F)c(F)c2F)C1	ZINC001009299369	1337000621	/nfs/dbraw/zinc/00/06/21/1337000621.db2.gz	BDVIAYLQOMEYOI-JTQLQIEISA-N	0	3	330.325	3.013	20	30		EGEDHN
C=C(C)CCN1CCC[C@H](NC(=O)c2cc(F)c(F)c(F)c2F)C1	ZINC001009299454	1337001424	/nfs/dbraw/zinc/00/14/24/1337001424.db2.gz	HZPIGDKEFCMFGI-NSHDSACASA-N	0	3	344.352	3.403	20	30		EGEDHN
N#Cc1ccc(C(=O)N[C@@H]2CCN(Cc3cccc4ccccc43)C2)[nH]1	ZINC001010647472	1337234825	/nfs/dbraw/zinc/23/48/25/1337234825.db2.gz	ZODPJWOENDVHDB-GOSISDBHSA-N	0	3	344.418	3.044	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N[C@H]1CCN(Cc2ccc(C(C)C)cc2)C1	ZINC001015722241	1338273508	/nfs/dbraw/zinc/27/35/08/1338273508.db2.gz	XIONMOKRZVOVBT-ZCNNSNEGSA-N	0	3	342.483	3.092	20	30		EGEDHN
C=C(C)CCN1CC[C@H](NC(=O)c2cnc(-c3ccoc3)s2)C1	ZINC001015805795	1338318197	/nfs/dbraw/zinc/31/81/97/1338318197.db2.gz	LCFHRMGZGGRFMI-AWEZNQCLSA-N	0	3	331.441	3.173	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN([C@H](C)c3cc(C)ccc3C)C2)cn1	ZINC001016032708	1338417570	/nfs/dbraw/zinc/41/75/70/1338417570.db2.gz	CPWSQHORVROPLN-YLJYHZDGSA-N	0	3	347.462	3.245	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)C2(c3ccccc3)CCC2)CC1	ZINC001016718876	1338701304	/nfs/dbraw/zinc/70/13/04/1338701304.db2.gz	HJYWFSNFYTXRAZ-LJQANCHMSA-N	0	3	336.479	3.102	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2cc(C)c(Cl)cc2C)CC1	ZINC001016761699	1338715640	/nfs/dbraw/zinc/71/56/40/1338715640.db2.gz	AHEXFHJJZLEILG-QGZVFWFLSA-N	0	3	330.859	3.174	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccc(F)c(Cl)c2)CC1	ZINC001016802653	1338731587	/nfs/dbraw/zinc/73/15/87/1338731587.db2.gz	ICLITAQKHQDEBB-MRXNPFEDSA-N	0	3	334.822	3.087	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)[C@H](C)c2ccc(Cl)cc2)CC1	ZINC001016809627	1338733542	/nfs/dbraw/zinc/73/35/42/1338733542.db2.gz	ZQTJKENNYBHLFQ-RHSMWYFYSA-N	0	3	330.859	3.047	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC23CCN(Cc2cccc(C#N)c2)CC3)C1	ZINC001016811865	1338734409	/nfs/dbraw/zinc/73/44/09/1338734409.db2.gz	GTDAOSLTWNIJEN-IBGZPJMESA-N	0	3	349.478	3.385	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC23CCN(Cc2ncccc2C)CC3)C1	ZINC001016812722	1338735188	/nfs/dbraw/zinc/73/51/88/1338735188.db2.gz	RVGHLFZBXIYWHS-SFHVURJKSA-N	0	3	339.483	3.217	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(-c3ccccc3)o2)CC1	ZINC001016832710	1338740277	/nfs/dbraw/zinc/74/02/77/1338740277.db2.gz	NIOKLGUXOKGDKO-IBGZPJMESA-N	0	3	334.419	3.164	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(-c3cccs3)o2)CC1	ZINC001016955167	1338783376	/nfs/dbraw/zinc/78/33/76/1338783376.db2.gz	LBYINJZAOPWVSP-KRWDZBQOSA-N	0	3	340.448	3.226	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)[C@@H](C)c2cccc(Cl)c2)CC1	ZINC001016987079	1338794117	/nfs/dbraw/zinc/79/41/17/1338794117.db2.gz	SBFMGSRYVFRUDV-YJBOKZPZSA-N	0	3	344.886	3.438	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H](CN(C)Cc2ccc(C#N)s2)C1)C1CC1	ZINC001017087637	1338855474	/nfs/dbraw/zinc/85/54/74/1338855474.db2.gz	NOCNUZWRSKCPQM-HUUCEWRRSA-N	0	3	345.512	3.336	20	30		EGEDHN
CN(Cc1ccccc1Cl)C[C@H]1CCCN(C(=O)C#CC2CC2)C1	ZINC001017123108	1338880629	/nfs/dbraw/zinc/88/06/29/1338880629.db2.gz	FDACXGNISJUPMU-QGZVFWFLSA-N	0	3	344.886	3.424	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCCN(C(=O)C(C)(C)C)C1	ZINC001017251365	1338981925	/nfs/dbraw/zinc/98/19/25/1338981925.db2.gz	NZMXUFNEIWIMNN-AWEZNQCLSA-N	0	3	333.501	3.336	20	30		EGEDHN
CC1(C)CCC(CN2C[C@H]3CC[C@@H](C2)N3C(=O)C#CC2CC2)CC1	ZINC001017541997	1339364520	/nfs/dbraw/zinc/36/45/20/1339364520.db2.gz	PZERTEYLXCJAND-KDURUIRLSA-N	0	3	328.500	3.291	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc(C)c(Cl)c1	ZINC001017653816	1339384019	/nfs/dbraw/zinc/38/40/19/1339384019.db2.gz	VJZBKEATICUJFO-CALCHBBNSA-N	0	3	332.875	3.442	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C1CCc2ccccc2CC1	ZINC001017687140	1339391201	/nfs/dbraw/zinc/39/12/01/1339391201.db2.gz	NOOTXDYDMYXXOP-OYRHEFFESA-N	0	3	338.495	3.433	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)COc1cccc(Cl)c1	ZINC001018249998	1339550320	/nfs/dbraw/zinc/55/03/20/1339550320.db2.gz	VGTLWZLMWAYQGC-CALCHBBNSA-N	0	3	348.874	3.360	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)COc1cc(C)cc(C)c1	ZINC001018262937	1339554481	/nfs/dbraw/zinc/55/44/81/1339554481.db2.gz	CEMQUFDNXMMSGZ-KDURUIRLSA-N	0	3	342.483	3.324	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1sccc1-n1cccc1	ZINC001028059787	1340403906	/nfs/dbraw/zinc/40/39/06/1340403906.db2.gz	GVSFDNXEGDWCCL-OAHLLOKOSA-N	0	3	329.469	3.309	20	30		EGEDHN
C=C(C)CCN1CCC[C@H]1CNC(=O)c1cnc([C@H]2CCCO2)s1	ZINC001028187455	1340475398	/nfs/dbraw/zinc/47/53/98/1340475398.db2.gz	JZSFXHAQRQMPBT-LSDHHAIUSA-N	0	3	349.500	3.155	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NC[C@@H]1CCCN1Cc1cccc(C)c1	ZINC001028195504	1340479600	/nfs/dbraw/zinc/47/96/00/1340479600.db2.gz	PERWXHIXKDRYKZ-UFYCRDLUSA-N	0	3	342.483	3.057	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1cnn(C2CCCC2)c1C	ZINC001028253216	1340514253	/nfs/dbraw/zinc/51/42/53/1340514253.db2.gz	RIAXHLBJPARKNG-QGZVFWFLSA-N	0	3	330.476	3.077	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1ccccc1C(F)(F)F	ZINC001028281645	1340535362	/nfs/dbraw/zinc/53/53/62/1340535362.db2.gz	NGTOAIXOWPTYQG-ZDUSSCGKSA-N	0	3	326.362	3.476	20	30		EGEDHN
C#CCCN1CCC[C@@H]1CNC(=O)c1cccc(Cl)c1Cl	ZINC001028284058	1340538699	/nfs/dbraw/zinc/53/86/99/1340538699.db2.gz	XGTVZVSTJLXZDQ-GFCCVEGCSA-N	0	3	325.239	3.211	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)[C@@H]1C[C@H]1c1cccc(F)c1F	ZINC001028327323	1340567733	/nfs/dbraw/zinc/56/77/33/1340567733.db2.gz	YMACXYPKZPRFJR-CWRNSKLLSA-N	0	3	334.410	3.225	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H](CNC(=O)[C@@H]3CCCC34CC4)C2)c1	ZINC001028625895	1340730316	/nfs/dbraw/zinc/73/03/16/1340730316.db2.gz	ADFQWNKCMVPOKM-MOPGFXCFSA-N	0	3	337.467	3.077	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)c2cc(C3CC3)oc2C2CC2)C1	ZINC001028702879	1340768104	/nfs/dbraw/zinc/76/81/04/1340768104.db2.gz	NOXKFWKPCODQFN-AWEZNQCLSA-N	0	3	326.440	3.109	20	30		EGEDHN
CC1(C)CCC[C@@H]1C(=O)NC[C@H]1CCN(Cc2ccc(C#N)cc2)C1	ZINC001028745583	1340785708	/nfs/dbraw/zinc/78/57/08/1340785708.db2.gz	DUULDXAGYHEBLI-RTBURBONSA-N	0	3	339.483	3.323	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H](CNC(=O)c3c[nH]cc3C3CC3)C2)c1	ZINC001028900752	1340878472	/nfs/dbraw/zinc/87/84/72/1340878472.db2.gz	JSIQGKKMJNLACM-KRWDZBQOSA-N	0	3	348.450	3.016	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)c2cc3c(cccc3F)s2)C1	ZINC001028973809	1340898738	/nfs/dbraw/zinc/89/87/38/1340898738.db2.gz	RWJYNJGYYZNNKU-CYBMUJFWSA-N	0	3	330.428	3.115	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC([C@@H](C)NCc2ccccc2C#N)CC1	ZINC001029054369	1340920129	/nfs/dbraw/zinc/92/01/29/1340920129.db2.gz	UGEIGFMZLRNLNB-HZPDHXFCSA-N	0	3	327.472	3.321	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)C1CCN(C(=O)C2(C)CC2)CC1	ZINC001029104281	1340930957	/nfs/dbraw/zinc/93/09/57/1340930957.db2.gz	RSIGYSITYOFWBP-OAHLLOKOSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC([C@H](C)NCc2cc(C)no2)CC1	ZINC001029136615	1340939803	/nfs/dbraw/zinc/93/98/03/1340939803.db2.gz	JLTQKRSKPSTPED-KXBFYZLASA-N	0	3	333.476	3.302	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1C[C@H]2CC[C@@H](C1)N2CCc1ccc2ccccc2c1	ZINC001029244606	1340960538	/nfs/dbraw/zinc/96/05/38/1340960538.db2.gz	JNZOWPRFOHJFCU-ORYQWCPZSA-N	0	3	347.462	3.217	20	30		EGEDHN
N#Cc1c[nH]c(C(=O)N2C[C@H]3CC[C@@H](C2)N3CCCC2CCCC2)c1	ZINC001029259485	1340962430	/nfs/dbraw/zinc/96/24/30/1340962430.db2.gz	GHNMUTVEJMAQFF-HDICACEKSA-N	0	3	340.471	3.146	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CC[C@@H](C1)N2CC[C@@H]1CCCCO1	ZINC001029453736	1340993588	/nfs/dbraw/zinc/99/35/88/1340993588.db2.gz	JTQIDQXSRWGCCM-HLNWXESRSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CC[C@@H](C1)N2C[C@@H](OC)C1CCC1	ZINC001029456439	1340994500	/nfs/dbraw/zinc/99/45/00/1340994500.db2.gz	CKGGXMSNDDFTKH-RMJJICAUSA-N	0	3	334.504	3.079	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H]3CC[C@@H](C2)N3CCC[C@@H]2CCOC2)CC1	ZINC001029457591	1340994711	/nfs/dbraw/zinc/99/47/11/1340994711.db2.gz	OWHPWCQKMMYWHT-RLLQIKCJSA-N	0	3	346.515	3.225	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CC[C@@H](C2)N3C[C@@H]2CCC(F)(F)C2)C1	ZINC001029464976	1340996570	/nfs/dbraw/zinc/99/65/70/1340996570.db2.gz	LJCSSKCTVVGLID-OAGGEKHMSA-N	0	3	338.442	3.453	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCN(C(=O)[C@@H]2CC=CCC2)C1	ZINC001029644786	1341031626	/nfs/dbraw/zinc/03/16/26/1341031626.db2.gz	DXNNPQLEHJMFPV-HZPDHXFCSA-N	0	3	343.496	3.256	20	30		EGEDHN
C[C@H](C(=O)N1CCC(CN(C)Cc2ccc(C#N)s2)CC1)C1CC1	ZINC001029950859	1341132078	/nfs/dbraw/zinc/13/20/78/1341132078.db2.gz	GQLFNMHIGRXDBP-AWEZNQCLSA-N	0	3	345.512	3.336	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC(CN(C)Cc2cncs2)CC1	ZINC001029990719	1341148179	/nfs/dbraw/zinc/14/81/79/1341148179.db2.gz	QCHSCPXERAQYRX-GOSISDBHSA-N	0	3	335.517	3.416	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)CC1CCN(C(=O)C2(CF)CC2)CC1	ZINC001029994429	1341150881	/nfs/dbraw/zinc/15/08/81/1341150881.db2.gz	ICFHUUQVQZTRRO-UHFFFAOYSA-N	0	3	349.475	3.040	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)CC1CCN(C(=O)[C@H]2CC23CC3)CC1	ZINC001029999765	1341152446	/nfs/dbraw/zinc/15/24/46/1341152446.db2.gz	KNUVHLJHYSZFAH-QGZVFWFLSA-N	0	3	343.496	3.090	20	30		EGEDHN
C=C(Cl)CN1C[C@H](NC(=O)c2cccc3nc(C)[nH]c32)CC[C@H]1C	ZINC001071968395	1355050545	/nfs/dbraw/zinc/05/05/45/1355050545.db2.gz	UOLQSAWEXIVDHN-TZMCWYRMSA-N	0	3	346.862	3.207	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](C)[C@@H](CNCc2csc(CC)n2)C1	ZINC001072336880	1355245274	/nfs/dbraw/zinc/24/52/74/1355245274.db2.gz	VCUNPUPFUHAYLB-CABCVRRESA-N	0	3	349.544	3.492	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C3(CC)CCC(F)(F)CC3)C2)C1	ZINC001072860744	1355471546	/nfs/dbraw/zinc/47/15/46/1355471546.db2.gz	FIFKKBNNFGZWCE-UHFFFAOYSA-N	0	3	338.442	3.150	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1coc2cc(F)ccc21	ZINC001032489947	1341522844	/nfs/dbraw/zinc/52/28/44/1341522844.db2.gz	WZRJEHOUMHIZIF-GJZGRUSLSA-N	0	3	328.387	3.437	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc2c(c1)C(C)(C)CO2	ZINC001032514038	1341528025	/nfs/dbraw/zinc/52/80/25/1341528025.db2.gz	IQXSAECORFXCHD-IRXDYDNUSA-N	0	3	340.467	3.222	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H]1COc2cc(C)c(C)cc21	ZINC001032541015	1341535316	/nfs/dbraw/zinc/53/53/16/1341535316.db2.gz	XLNWDDVGJIOYFE-LNLFQRSKSA-N	0	3	340.467	3.031	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cc2ccc(OC)cc2[nH]1	ZINC001032553058	1341538013	/nfs/dbraw/zinc/53/80/13/1341538013.db2.gz	KXTXGGNNGLGBLQ-HOTGVXAUSA-N	0	3	339.439	3.041	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C1(c2ccc(F)cc2)CCC1	ZINC001032553062	1341538489	/nfs/dbraw/zinc/53/84/89/1341538489.db2.gz	LESXZLUAZYOSIO-OALUTQOASA-N	0	3	342.458	3.499	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H]3C[C@H]2CN3C[C@@H]2CCCC(F)(F)C2)C1	ZINC001032613973	1341559861	/nfs/dbraw/zinc/55/98/61/1341559861.db2.gz	FFMKSMJEFWUFQK-PMPSAXMXSA-N	0	3	338.442	3.453	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H](Cc1ccccc1)C(C)C	ZINC001032624312	1341563834	/nfs/dbraw/zinc/56/38/34/1341563834.db2.gz	IQWJFCSIWSISFD-SLFFLAALSA-N	0	3	326.484	3.363	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H](CC)c1c(C)noc1C	ZINC001032684219	1341581583	/nfs/dbraw/zinc/58/15/83/1341581583.db2.gz	GNBZKFROTPSUGE-YESZJQIVSA-N	0	3	331.460	3.036	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1C[C@@H]2C[C@H]1CN2CCC1=CCCCC1	ZINC001032752886	1341603159	/nfs/dbraw/zinc/60/31/59/1341603159.db2.gz	ZIEBLHQLQUFMRA-VXKWHMMOSA-N	0	3	348.490	3.386	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@H]2CCN(C[C@H](OC)c3ccccc3)C2)C1	ZINC001033400064	1341814084	/nfs/dbraw/zinc/81/40/84/1341814084.db2.gz	SMPHEWOCQMMOSK-OALUTQOASA-N	0	3	342.483	3.263	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@H]2CCN([C@@H](C)c3cccc(C)c3)C2)cn1	ZINC001033597708	1341889765	/nfs/dbraw/zinc/88/97/65/1341889765.db2.gz	USVJUSCESJTNDA-UWJYYQICSA-N	0	3	347.462	3.279	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)C2(c3cc(C)cc(C)c3)CC2)C1	ZINC001033674324	1341940159	/nfs/dbraw/zinc/94/01/59/1341940159.db2.gz	SWAALJSFVIIBAH-LJQANCHMSA-N	0	3	326.484	3.444	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2ccccc2OCC2CC2)C1	ZINC001033684338	1341949565	/nfs/dbraw/zinc/94/95/65/1341949565.db2.gz	MWGKGYRGPKOHII-QGZVFWFLSA-N	0	3	328.456	3.198	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2c[nH]c3c2cccc3CC)C1	ZINC001033689973	1341952902	/nfs/dbraw/zinc/95/29/02/1341952902.db2.gz	OAAOPOGLCUOTNB-MRXNPFEDSA-N	0	3	325.456	3.453	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccc3nc(C)oc3c2)C1	ZINC001033863296	1342050513	/nfs/dbraw/zinc/05/05/13/1342050513.db2.gz	VMCGHFWSPWNEDU-INIZCTEOSA-N	0	3	327.428	3.249	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cccc([C@H]3CCOC3)c2)C1	ZINC001033875260	1342053584	/nfs/dbraw/zinc/05/35/84/1342053584.db2.gz	DALPIYZZRKSPGC-PMACEKPBSA-N	0	3	342.483	3.303	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2cc(C)nn2C(CC)CC)C1	ZINC001033879009	1342056063	/nfs/dbraw/zinc/05/60/63/1342056063.db2.gz	NXXAMWFTTKNTQV-GOSISDBHSA-N	0	3	344.503	3.112	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cnn3cccc(Cl)c23)C1	ZINC001033897816	1342069736	/nfs/dbraw/zinc/06/97/36/1342069736.db2.gz	RQZKPSYEAGXBOM-CQSZACIVSA-N	0	3	346.862	3.100	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cc3ccccc3[nH]c2=O)C1	ZINC001033917492	1342086950	/nfs/dbraw/zinc/08/69/50/1342086950.db2.gz	ZEQLMCXSCICHKF-MRXNPFEDSA-N	0	3	339.439	3.053	20	30		EGEDHN
C=C1CCC(C(=O)N(CC)[C@@H]2CCN(C[C@H]3CCCCO3)C2)CC1	ZINC001033948956	1342108864	/nfs/dbraw/zinc/10/88/64/1342108864.db2.gz	CYKJBXUXWFHTKK-RTBURBONSA-N	0	3	334.504	3.225	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2ccc(-c3ccccc3)nc2)C1	ZINC001033995223	1342136871	/nfs/dbraw/zinc/13/68/71/1342136871.db2.gz	BNLUKYHQLNDSJI-HXUWFJFHSA-N	0	3	347.462	3.308	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cnn([C@@H](C)CC)c2C)C1	ZINC001034017262	1342155271	/nfs/dbraw/zinc/15/52/71/1342155271.db2.gz	QSYAZTBVAYVJIT-DOTOQJQBSA-N	0	3	332.492	3.275	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2ccc(N(CC)CC)cc2)C1	ZINC001034025386	1342162997	/nfs/dbraw/zinc/16/29/97/1342162997.db2.gz	HJKYASGKZCIPAY-HXUWFJFHSA-N	0	3	341.499	3.093	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2ccc(OCC(C)C)cc2)C1	ZINC001034037123	1342177626	/nfs/dbraw/zinc/17/76/26/1342177626.db2.gz	WUPBJYHHHCMSMI-IBGZPJMESA-N	0	3	342.483	3.281	20	30		EGEDHN
C=CCCN1CCCC[C@@H](NC(=O)c2cnc([C@H](C)OC)s2)C1	ZINC001034209993	1342319774	/nfs/dbraw/zinc/31/97/74/1342319774.db2.gz	ILDRPKIWEYGJDB-UONOGXRCSA-N	0	3	337.489	3.011	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)c2coc3ccc(OC)cc32)C1	ZINC001034304764	1342387304	/nfs/dbraw/zinc/38/73/04/1342387304.db2.gz	XTLMAFKAUULPBZ-AWEZNQCLSA-N	0	3	328.412	3.212	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2nc(Cl)sc2Cl)C1	ZINC001034342814	1342415285	/nfs/dbraw/zinc/41/52/85/1342415285.db2.gz	VAFPQFMOEBOGGF-SNVBAGLBSA-N	0	3	346.283	3.058	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)c2ccc(F)c3ccncc23)C1	ZINC001034365293	1342435153	/nfs/dbraw/zinc/43/51/53/1342435153.db2.gz	UKBNUTQCFACNIN-CQSZACIVSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@H]2CCOc3ccccc32)C1	ZINC001034446120	1342507330	/nfs/dbraw/zinc/50/73/30/1342507330.db2.gz	LOKQQEYKHRYECE-WMZOPIPTSA-N	0	3	328.456	3.100	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2ccccc2OCC(C)C)C1	ZINC001034446786	1342508420	/nfs/dbraw/zinc/50/84/20/1342508420.db2.gz	YRHGEKBTJCBDJY-SFHVURJKSA-N	0	3	342.483	3.329	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2coc(C3CCCC3)n2)C1	ZINC001034464777	1342519475	/nfs/dbraw/zinc/51/94/75/1342519475.db2.gz	BJZCMFCQDZUCKZ-MRXNPFEDSA-N	0	3	331.460	3.493	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc(C)nc2OCCC)C1	ZINC001034464840	1342519887	/nfs/dbraw/zinc/51/98/87/1342519887.db2.gz	BQNOEFUOQVUGJR-QGZVFWFLSA-N	0	3	345.487	3.339	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cc3c(C)cccn3c2)C1	ZINC001034488534	1342546112	/nfs/dbraw/zinc/54/61/12/1342546112.db2.gz	XKSGMESXQZQSRN-GOSISDBHSA-N	0	3	325.456	3.408	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@H](C)c2cccc(OC)c2)C1	ZINC001034539670	1342599371	/nfs/dbraw/zinc/59/93/71/1342599371.db2.gz	BFCFRXBPPTWHCL-AEFFLSMTSA-N	0	3	330.472	3.346	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1	ZINC001034542878	1342602058	/nfs/dbraw/zinc/60/20/58/1342602058.db2.gz	CLWYOYSJONSHEJ-MRXNPFEDSA-N	0	3	343.431	3.009	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cccc3oc(C)nc32)C1	ZINC001034545387	1342606891	/nfs/dbraw/zinc/60/68/91/1342606891.db2.gz	VFGVVVXPQSUZRW-HNNXBMFYSA-N	0	3	327.428	3.297	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)C2(c3ccccc3OC)CC2)C1	ZINC001034551902	1342614623	/nfs/dbraw/zinc/61/46/23/1342614623.db2.gz	IMVUKFTVQPHNAK-QGZVFWFLSA-N	0	3	342.483	3.274	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1CC[C@H](NC(=O)c2ccsc2)CC1	ZINC001034590207	1342635019	/nfs/dbraw/zinc/63/50/19/1342635019.db2.gz	DKZYIOZOCFDSGQ-IYARVYRRSA-N	0	3	339.464	3.451	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1CC[C@H](NC(=O)[C@H]2[C@@H]3CCC[C@@H]32)CC1	ZINC001034619584	1342652974	/nfs/dbraw/zinc/65/29/74/1342652974.db2.gz	MWKPNKMJFBMYOL-GFXZNLHSSA-N	0	3	337.467	3.121	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)C=C2CCC2)CC1	ZINC001034623355	1342656115	/nfs/dbraw/zinc/65/61/15/1342656115.db2.gz	CUHOFDQQQSSOLU-HDJSIYSDSA-N	0	3	327.266	3.022	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)C2=CCCC2)CC1	ZINC001034624062	1342656870	/nfs/dbraw/zinc/65/68/70/1342656870.db2.gz	ADAJWXWEZGILEZ-HDJSIYSDSA-N	0	3	327.266	3.022	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)NCc1ccc(CNCc2ccc(C#N)s2)cc1	ZINC001034808063	1342773594	/nfs/dbraw/zinc/77/35/94/1342773594.db2.gz	UHVIYJZVADTYBY-UGSOOPFHSA-N	0	3	339.464	3.182	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2ccc(OCC)cc2)C12CCC2	ZINC001078799082	1357090827	/nfs/dbraw/zinc/09/08/27/1357090827.db2.gz	VVJFOGDLIGILGF-IAGOWNOFSA-N	0	3	348.874	3.468	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]1CNCc1c(C)onc1CC	ZINC001035011774	1342875217	/nfs/dbraw/zinc/87/52/17/1342875217.db2.gz	JJLFYZIOHHUUFQ-OAHLLOKOSA-N	0	3	333.476	3.228	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)[C@]23C[C@H]2CCCC3)s1	ZINC001035040635	1342893076	/nfs/dbraw/zinc/89/30/76/1342893076.db2.gz	AYHOVDQRIJWUFW-SPYBWZPUSA-N	0	3	343.496	3.281	20	30		EGEDHN
CC(C)C1(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)c(F)c2)CC1	ZINC001035042640	1342895103	/nfs/dbraw/zinc/89/51/03/1342895103.db2.gz	IVCXATOIDQTKRM-QGZVFWFLSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2ccc(C)nc2C)C12CCC2	ZINC001078819167	1357099140	/nfs/dbraw/zinc/09/91/40/1357099140.db2.gz	JIZOUDGVGLHGCE-HZPDHXFCSA-N	0	3	333.863	3.082	20	30		EGEDHN
C=C[C@H](C(=O)N1CCC[C@@H]1CNCc1cncs1)c1ccccc1	ZINC001035130843	1342947201	/nfs/dbraw/zinc/94/72/01/1342947201.db2.gz	FFOVKPGGGUOWCA-AEFFLSMTSA-N	0	3	341.480	3.194	20	30		EGEDHN
N#Cc1ccccc1CN1CCC2(C1)CCN(C(=O)c1ccc[nH]1)CC2	ZINC001035155392	1342970352	/nfs/dbraw/zinc/97/03/52/1342970352.db2.gz	CHCRAIYWVRYHGQ-UHFFFAOYSA-N	0	3	348.450	3.015	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)Cc2ccc(C)s2)C12CCC2	ZINC001078819575	1357100181	/nfs/dbraw/zinc/10/01/81/1357100181.db2.gz	POUGEGYSSRORNS-HUUCEWRRSA-N	0	3	338.904	3.369	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc3cc(C)cn3c1)CC2	ZINC001035721880	1343152946	/nfs/dbraw/zinc/15/29/46/1343152946.db2.gz	CKPJUJJVQCXTMO-UHFFFAOYSA-N	0	3	337.467	3.362	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2CCC3(CN(CC(=C)C)C3)CC2)cc1	ZINC001035734508	1343160165	/nfs/dbraw/zinc/16/01/65/1343160165.db2.gz	INZPIGVEPKVBKW-UHFFFAOYSA-N	0	3	340.467	3.366	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1scnc1C(F)F)CC2	ZINC001035746059	1343166524	/nfs/dbraw/zinc/16/65/24/1343166524.db2.gz	MXZQBBZAEMZSDD-UHFFFAOYSA-N	0	3	341.427	3.195	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc(C)nc1C1CC1)CC2	ZINC001035760196	1343174143	/nfs/dbraw/zinc/17/41/43/1343174143.db2.gz	MUZXHHSAENTWPY-UHFFFAOYSA-N	0	3	339.483	3.382	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cc(F)ccc1Cl)CC2	ZINC001035805250	1343207148	/nfs/dbraw/zinc/20/71/48/1343207148.db2.gz	FNYIBZKLCZLPJJ-UHFFFAOYSA-N	0	3	334.822	3.040	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccc(Cl)c(F)c1)CC2	ZINC001035806080	1343207622	/nfs/dbraw/zinc/20/76/22/1343207622.db2.gz	SOAREFSQBPCQEH-UHFFFAOYSA-N	0	3	334.822	3.040	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cccc3c1ccn3C)CC2	ZINC001035817206	1343213693	/nfs/dbraw/zinc/21/36/93/1343213693.db2.gz	BQQJGNMXKAYDFN-UHFFFAOYSA-N	0	3	337.467	3.292	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H]1Cc3ccc(Cl)cc31)CC2	ZINC001035844907	1343226026	/nfs/dbraw/zinc/22/60/26/1343226026.db2.gz	UGKZZYMGUBNGEI-GOSISDBHSA-N	0	3	344.886	3.480	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@H]1Cc3ccc(Cl)cc31)CC2	ZINC001035844908	1343226105	/nfs/dbraw/zinc/22/61/05/1343226105.db2.gz	UGKZZYMGUBNGEI-SFHVURJKSA-N	0	3	344.886	3.480	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C13CC(C(F)(F)F)(C1)C3)CC2	ZINC001035857322	1343233730	/nfs/dbraw/zinc/23/37/30/1343233730.db2.gz	QXAUQUXTFURLHL-UHFFFAOYSA-N	0	3	342.405	3.220	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CCCC2)CC[C@@H]1NCc1cc(F)ccc1C#N	ZINC001035872968	1343241837	/nfs/dbraw/zinc/24/18/37/1343241837.db2.gz	ABRPCRQQSHVORD-KUHUBIRLSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@H]1CN(C(=O)CC2CCC2)CC[C@H]1NCc1ccccc1C#N	ZINC001035977772	1343297055	/nfs/dbraw/zinc/29/70/55/1343297055.db2.gz	OKDFTUHDSVPGSK-HNAYVOBHSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](NCc2ccccc2C#N)[C@H](C)C1	ZINC001036136699	1343322599	/nfs/dbraw/zinc/32/25/99/1343322599.db2.gz	KEMBWILCIOAMDP-APWZRJJASA-N	0	3	339.483	3.487	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](NCc2cc(C3CC3)no2)[C@@H](C)C1	ZINC001036137703	1343322949	/nfs/dbraw/zinc/32/29/49/1343322949.db2.gz	OTKSAJRHCOMDPQ-WMLDXEAASA-N	0	3	345.487	3.481	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](NCc3cc(C4CC4)no3)[C@H](C)C2)C1	ZINC001036171390	1343344511	/nfs/dbraw/zinc/34/45/11/1343344511.db2.gz	XHQPSVXXRFFBQB-RHSMWYFYSA-N	0	3	343.471	3.235	20	30		EGEDHN
C[C@H]1CN(C(=O)C2(CF)CCC2)CC[C@H]1NCc1ccccc1C#N	ZINC001036190268	1343354865	/nfs/dbraw/zinc/35/48/65/1343354865.db2.gz	YTBPLKPLFYGRRP-MAUKXSAKSA-N	0	3	343.446	3.025	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]([C@H](C)NCc2ccn(C(C)C)n2)C1	ZINC001036425779	1343479195	/nfs/dbraw/zinc/47/91/95/1343479195.db2.gz	CGNRYQQVPTUMMR-IRXDYDNUSA-N	0	3	346.519	3.393	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCCN(C(=O)C(C)(C)C)C1	ZINC001036466047	1343500607	/nfs/dbraw/zinc/50/06/07/1343500607.db2.gz	PEBYKBSFPYIKKT-YJBOKZPZSA-N	0	3	327.472	3.321	20	30		EGEDHN
C[C@H]1CCCN(C(=O)C(C)(C)F)[C@@H]1CNCc1ccc(C#N)s1	ZINC001036501682	1343520105	/nfs/dbraw/zinc/52/01/05/1343520105.db2.gz	POTOLUJQGONRFC-SWLSCSKDSA-N	0	3	337.464	3.085	20	30		EGEDHN
O=C(C1CC1)N1CC[C@H]2[C@@H](CCN2CC#Cc2cccc(Cl)c2)C1	ZINC001036613867	1343574852	/nfs/dbraw/zinc/57/48/52/1343574852.db2.gz	NJVRULIZPVYHBD-HKUYNNGSSA-N	0	3	342.870	3.024	20	30		EGEDHN
CCCC(=O)N1CC[C@@H]2[C@@H](CCN2CC#Cc2cccc(Cl)c2)C1	ZINC001036617694	1343577146	/nfs/dbraw/zinc/57/71/46/1343577146.db2.gz	PQZIYLPWMJCLOV-PKOBYXMFSA-N	0	3	344.886	3.414	20	30		EGEDHN
O=C(c1ccccc1)N1CC[C@H]2[C@H](CCN2CC#Cc2ccccc2)C1	ZINC001036627246	1343584793	/nfs/dbraw/zinc/58/47/93/1343584793.db2.gz	JRHMFQUXYXDONN-YADHBBJMSA-N	0	3	344.458	3.275	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccccc2C#N)C1	ZINC001036652402	1343602457	/nfs/dbraw/zinc/60/24/57/1343602457.db2.gz	RSOKFAILHFGDFU-WOJBJXKFSA-N	0	3	339.483	3.417	20	30		EGEDHN
O=C(C=C1CCC1)N1CC[C@H]2[C@H](CCN2CC#Cc2ccccc2)C1	ZINC001036688545	1343631119	/nfs/dbraw/zinc/63/11/19/1343631119.db2.gz	URGOTTHOCRGIJH-RTWAWAEBSA-N	0	3	334.463	3.071	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@H]2[C@H](CCN2Cc2cccc(Cl)c2)C1	ZINC001036713813	1343647191	/nfs/dbraw/zinc/64/71/91/1343647191.db2.gz	OSOBBSKZWLXASW-MJGOQNOKSA-N	0	3	342.870	3.176	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]3[C@@H](CCN3Cc3ccccc3C#N)C2)C1	ZINC001036815937	1343753211	/nfs/dbraw/zinc/75/32/11/1343753211.db2.gz	NEUMHVHEXKLPGQ-VQTJNVASSA-N	0	3	349.478	3.337	20	30		EGEDHN
Cc1cocc1C(=O)N[C@@H]1CCC[C@H]1CNCc1ccccc1C#N	ZINC001037057926	1343954240	/nfs/dbraw/zinc/95/42/40/1343954240.db2.gz	BVYXPJDOZHZPEC-PKOBYXMFSA-N	0	3	337.423	3.148	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCC[C@@H]1NC(=O)C1CCC1	ZINC001037138491	1343988367	/nfs/dbraw/zinc/98/83/67/1343988367.db2.gz	KVDDEVHTGUGMOE-MOPGFXCFSA-N	0	3	325.456	3.123	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCC[C@@H]2CNCc2cnc(C)o2)C1	ZINC001037244541	1344065234	/nfs/dbraw/zinc/06/52/34/1344065234.db2.gz	ZPNVRFJKOLWFEO-NVXWUHKLSA-N	0	3	331.460	3.104	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](NCc2ccn(CC)n2)[C@H](CC)C1	ZINC001037889736	1344164134	/nfs/dbraw/zinc/16/41/34/1344164134.db2.gz	GBSZLKGMYPBJPC-AEFFLSMTSA-N	0	3	346.519	3.222	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NC[C@H]1CCN1CCCC1CCCC1	ZINC001038267191	1344349246	/nfs/dbraw/zinc/34/92/46/1344349246.db2.gz	QJTOVNOCKCGNPN-QRVBRYPASA-N	0	3	334.504	3.129	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1c(C)nn(C(C)(C)C)c1C	ZINC001038331113	1344383189	/nfs/dbraw/zinc/38/31/89/1344383189.db2.gz	USHZHVQNLAKGCD-INIZCTEOSA-N	0	3	332.492	3.025	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCN2CC2CCC(F)(F)CC2)cc1	ZINC001038581062	1344492984	/nfs/dbraw/zinc/49/29/84/1344492984.db2.gz	FSUQMECYTVNAPJ-GOSISDBHSA-N	0	3	346.421	3.298	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H](C)C2CCC2)CC[C@H]1c1ccc(F)cc1	ZINC001079154664	1357197968	/nfs/dbraw/zinc/19/79/68/1357197968.db2.gz	PEWLGBIHHLGJHI-RYGJVYDSSA-N	0	3	342.458	3.169	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)c3ccncc3)CC2)C1	ZINC001039095695	1344767446	/nfs/dbraw/zinc/76/74/46/1344767446.db2.gz	FLXRNDGHHVLSBU-KRWDZBQOSA-N	0	3	333.863	3.008	20	30		EGEDHN
C=C(C)C[N@@H+]1CC[C@H]([C@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001039194293	1344900397	/nfs/dbraw/zinc/90/03/97/1344900397.db2.gz	YJUAAZMQBIRZAO-FUHWJXTLSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=C(C)C[N@H+]1CC[C@H]([C@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001039194293	1344900398	/nfs/dbraw/zinc/90/03/98/1344900398.db2.gz	YJUAAZMQBIRZAO-FUHWJXTLSA-N	0	3	328.456	3.285	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc(C)nc(C)c2)C1	ZINC001039211382	1344925763	/nfs/dbraw/zinc/92/57/63/1344925763.db2.gz	TWOGTTMZKUZUBW-UYAOXDASSA-N	0	3	339.483	3.038	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccn3ccccc23)C1	ZINC001039215619	1344931749	/nfs/dbraw/zinc/93/17/49/1344931749.db2.gz	LLPNXMOUPKCQQM-QUCCMNQESA-N	0	3	349.478	3.279	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cccc(C(C)C)n2)C1	ZINC001039218182	1344936071	/nfs/dbraw/zinc/93/60/71/1344936071.db2.gz	KYBJUGYJMQHOFQ-FXAWDEMLSA-N	0	3	339.483	3.155	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(F)ccc2CC)C1	ZINC001039220346	1344937790	/nfs/dbraw/zinc/93/77/90/1344937790.db2.gz	YGPVAJOKCBLAIR-XLIONFOSSA-N	0	3	342.458	3.338	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc[nH]c2C(C)C)C1	ZINC001039224927	1344942672	/nfs/dbraw/zinc/94/26/72/1344942672.db2.gz	KYCRPDBXBBXMTJ-HKUYNNGSSA-N	0	3	341.499	3.478	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)Cc2ccsc2C)C1	ZINC001039230304	1344949941	/nfs/dbraw/zinc/94/99/41/1344949941.db2.gz	KAMNIIVHEGFAAX-RBUKOAKNSA-N	0	3	344.524	3.325	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccc3c(c2)CCC3)C1	ZINC001039238419	1344961991	/nfs/dbraw/zinc/96/19/91/1344961991.db2.gz	IDLSTICVYVHRIV-SFTDATJTSA-N	0	3	336.479	3.125	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(C)cc2F)C1	ZINC001039240519	1344965292	/nfs/dbraw/zinc/96/52/92/1344965292.db2.gz	XMLRIAQRJHUFBG-LPHOPBHVSA-N	0	3	328.431	3.084	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc3c(C)cccn3c2)C1	ZINC001039242877	1344970005	/nfs/dbraw/zinc/97/00/05/1344970005.db2.gz	CWOCJXNFGXOAST-UYAOXDASSA-N	0	3	349.478	3.198	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)Cc2c[nH]c3ccccc23)C1	ZINC001039246116	1344975540	/nfs/dbraw/zinc/97/55/40/1344975540.db2.gz	PEALFLQYSOTWGJ-UTKZUKDTSA-N	0	3	349.478	3.047	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2oc(CC)cc2C)C1	ZINC001039247176	1344977355	/nfs/dbraw/zinc/97/73/55/1344977355.db2.gz	UTVJKEPJKQBTGJ-HKUYNNGSSA-N	0	3	342.483	3.490	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2c[nH]c3ccc(C)cc23)C1	ZINC001039250071	1344981304	/nfs/dbraw/zinc/98/13/04/1344981304.db2.gz	GSVRMHWEVOJHGM-LAUBAEHRSA-N	0	3	349.478	3.426	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccc(OCCC)c1	ZINC001039385366	1345038505	/nfs/dbraw/zinc/03/85/05/1345038505.db2.gz	KVEFRXWXHLIZDW-MOPGFXCFSA-N	0	3	340.467	3.178	20	30		EGEDHN
C=C(C)CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1snnc1C1CC1	ZINC001039389453	1345040471	/nfs/dbraw/zinc/04/04/71/1345040471.db2.gz	UJLQOAWGWARERP-CABCVRRESA-N	0	3	346.500	3.061	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccc2cnccc21	ZINC001039395166	1345044069	/nfs/dbraw/zinc/04/40/69/1345044069.db2.gz	XYYYASWUZIDVPM-UXHICEINSA-N	0	3	349.478	3.419	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccc(COC)c1	ZINC001039400424	1345047273	/nfs/dbraw/zinc/04/72/73/1345047273.db2.gz	AXXVAPICOCPNTQ-MOPGFXCFSA-N	0	3	328.456	3.088	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H]1OCCc2ccsc21	ZINC001039461386	1345080183	/nfs/dbraw/zinc/08/01/83/1345080183.db2.gz	OJGFLBLCEZRNCE-IKGGRYGDSA-N	0	3	346.496	3.003	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccsc1C(F)F	ZINC001039462928	1345081398	/nfs/dbraw/zinc/08/13/98/1345081398.db2.gz	NJPRUTCEZHRNLL-OLZOCXBDSA-N	0	3	338.423	3.388	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(OC)c(Cl)c1	ZINC001039468215	1345085846	/nfs/dbraw/zinc/08/58/46/1345085846.db2.gz	ZGHMOJVAXVOSHQ-CVEARBPZSA-N	0	3	346.858	3.051	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)c1cccc(F)c1	ZINC001039471597	1345087092	/nfs/dbraw/zinc/08/70/92/1345087092.db2.gz	FIJBTOPBQFQEKA-LZQZEXGQSA-N	0	3	328.431	3.018	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H](C)n1nc(C)cc1C	ZINC001039471059	1345087122	/nfs/dbraw/zinc/08/71/22/1345087122.db2.gz	FNGHROCQNUNSFV-QRVBRYPASA-N	0	3	344.503	3.092	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)COC1CCC(C)CC1	ZINC001039477129	1345091882	/nfs/dbraw/zinc/09/18/82/1345091882.db2.gz	JEDFQIHUPHTCNJ-IAFLDTSXSA-N	0	3	334.504	3.223	20	30		EGEDHN
CC(C)C(=O)N1CC[C@]2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001040080734	1345326565	/nfs/dbraw/zinc/32/65/65/1345326565.db2.gz	PRPAYKBHHHBLOC-HXUWFJFHSA-N	0	3	325.456	3.029	20	30		EGEDHN
Cc1cc(F)ccc1CN1CCC[C@@]2(CCN(C(=O)[C@@H](C)C#N)C2)C1	ZINC001040128186	1345343615	/nfs/dbraw/zinc/34/36/15/1345343615.db2.gz	XLPAUYPCGPMMBP-OXJNMPFZSA-N	0	3	343.446	3.108	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@]3(CCN(C(=O)C4=CCCC4)C3)C2)cc1	ZINC001040156692	1345359160	/nfs/dbraw/zinc/35/91/60/1345359160.db2.gz	FZVBDXWONCUKKE-QFIPXVFZSA-N	0	3	349.478	3.483	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@]3(CCN(C(=O)C4=CCCC4)C3)C2)cc1	ZINC001040156691	1345359258	/nfs/dbraw/zinc/35/92/58/1345359258.db2.gz	FZVBDXWONCUKKE-JOCHJYFZSA-N	0	3	349.478	3.483	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@@H]3C[C@H]3c3ccsc3)C2)C1	ZINC001040264904	1345402467	/nfs/dbraw/zinc/40/24/67/1345402467.db2.gz	TXNIWRLLJLBCQF-NSHGMRRFSA-N	0	3	342.508	3.189	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ccc(C)c(F)c3)C2)C1	ZINC001040282402	1345410909	/nfs/dbraw/zinc/41/09/09/1345410909.db2.gz	IPNJXPOWBLTOBH-FQEVSTJZSA-N	0	3	328.431	3.086	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ccc(F)c(Cl)c3)C2)C1	ZINC001040359245	1345452913	/nfs/dbraw/zinc/45/29/13/1345452913.db2.gz	CUZBGYXYCKDIDQ-IBGZPJMESA-N	0	3	348.849	3.431	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(Cl)c(C)c3)C2)C1	ZINC001040371941	1345460437	/nfs/dbraw/zinc/46/04/37/1345460437.db2.gz	MINKJCBHHYDXQM-LJQANCHMSA-N	0	3	330.859	3.210	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@]3(C2)CCCN(Cc2cccnc2)C3)C1	ZINC001040380813	1345466505	/nfs/dbraw/zinc/46/65/05/1345466505.db2.gz	VADIMGQOTLCKKG-NRFANRHFSA-N	0	3	339.483	3.252	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cc[nH]c3C3CCC3)C2)C1	ZINC001040395708	1345474839	/nfs/dbraw/zinc/47/48/39/1345474839.db2.gz	QEJJVTVWFGPIGU-NRFANRHFSA-N	0	3	339.483	3.234	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(C(C)C)nc3C)C2)C1	ZINC001040398025	1345475760	/nfs/dbraw/zinc/47/57/60/1345475760.db2.gz	CMWOGJXYZWKXIM-OAQYLSRUSA-N	0	3	339.483	3.075	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cccc4cc[nH]c43)C2)C1	ZINC001040410022	1345481532	/nfs/dbraw/zinc/48/15/32/1345481532.db2.gz	CDKJGFQBTUAHJW-NRFANRHFSA-N	0	3	335.451	3.119	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cc(F)c(F)c(F)c3)C2)C1	ZINC001040412999	1345483397	/nfs/dbraw/zinc/48/33/97/1345483397.db2.gz	XCYCNWCRULUKHQ-SFHVURJKSA-N	0	3	338.373	3.218	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cc(CC)c(CC)o3)C2)C1	ZINC001040498270	1345521060	/nfs/dbraw/zinc/52/10/60/1345521060.db2.gz	YTNXASXOZPYUMK-NRFANRHFSA-N	0	3	342.483	3.356	20	30		EGEDHN
C=C[C@@H](C(=O)N1CC[C@]2(C1)CCCN(CC#CC)C2)c1ccccc1	ZINC001040538108	1345536387	/nfs/dbraw/zinc/53/63/87/1345536387.db2.gz	GFBRPQAAOWJNLF-IFMALSPDSA-N	0	3	336.479	3.294	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cccc4ccc(C)nc43)C2)CC1	ZINC001040742410	1345573139	/nfs/dbraw/zinc/57/31/39/1345573139.db2.gz	KOEFNBNVLCBAMT-UHFFFAOYSA-N	0	3	347.462	3.105	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC2(C1)CCN(Cc1cccnc1)CC2	ZINC001040830987	1345583802	/nfs/dbraw/zinc/58/38/02/1345583802.db2.gz	QIBXEFNBSSCZRI-FQEVSTJZSA-N	0	3	341.499	3.498	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@@H](F)c3ccccc3)C2)CC1	ZINC001040867311	1345590103	/nfs/dbraw/zinc/59/01/03/1345590103.db2.gz	CFGYSSJLVYHYLF-SFHVURJKSA-N	0	3	328.431	3.035	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccc(C4CC4)s3)C2)CC1	ZINC001040911327	1345598834	/nfs/dbraw/zinc/59/88/34/1345598834.db2.gz	BPCOBQYCECQKBK-UHFFFAOYSA-N	0	3	328.481	3.187	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3sccc3CC)C2)CC1	ZINC001040947709	1345607128	/nfs/dbraw/zinc/60/71/28/1345607128.db2.gz	AZLAQWDNXUNGCE-UHFFFAOYSA-N	0	3	330.497	3.262	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)C3(C(F)(F)F)CCCC3)C2)CC1	ZINC001040956986	1345609933	/nfs/dbraw/zinc/60/99/33/1345609933.db2.gz	NOELWWNYKCFNQK-UHFFFAOYSA-N	0	3	342.405	3.057	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3csc4cc(C)ccc43)C2)C1	ZINC001041320577	1345701867	/nfs/dbraw/zinc/70/18/67/1345701867.db2.gz	CZSMCEFHKSLYDS-HXUWFJFHSA-N	0	3	338.476	3.381	20	30		EGEDHN
C=CCN1CC[C@]2(CCN(C(=O)c3nc(C(C)(C)C)cs3)C2)C1	ZINC001041382069	1345713030	/nfs/dbraw/zinc/71/30/30/1345713030.db2.gz	UJJUMACWXDFKDJ-SFHVURJKSA-N	0	3	333.501	3.165	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)Cc3ccc(C)cc3Cl)C2)C1	ZINC001041417034	1345723426	/nfs/dbraw/zinc/72/34/26/1345723426.db2.gz	BXILGQKRRSBSDO-HXUWFJFHSA-N	0	3	344.886	3.139	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3cc4ccccc4cc3F)C2)C1	ZINC001041464546	1345736162	/nfs/dbraw/zinc/73/61/62/1345736162.db2.gz	RMCHPAIRKBBLDZ-OAQYLSRUSA-N	0	3	336.410	3.150	20	30		EGEDHN
CC1(CC(=O)N2CC[C@]3(CCN(Cc4cccc(C#N)c4)C3)C2)CC1	ZINC001041481860	1345741068	/nfs/dbraw/zinc/74/10/68/1345741068.db2.gz	KUVTYKOMESOJGG-NRFANRHFSA-N	0	3	337.467	3.173	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)[C@@H]3C[C@H]3c3ccc(Cl)s3)C2)C1	ZINC001041598981	1345788211	/nfs/dbraw/zinc/78/82/11/1345788211.db2.gz	PAYVSHIRHGTOBI-LBTNJELSSA-N	0	3	348.899	3.063	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@]2(CCN(Cc3ccccn3)C2)C1	ZINC001041627041	1345800932	/nfs/dbraw/zinc/80/09/32/1345800932.db2.gz	ZPUOOKPXNVSFSQ-PMACEKPBSA-N	0	3	327.472	3.108	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@]2(CCN(Cc3cncc(C)c3)C2)C1	ZINC001041626472	1345801097	/nfs/dbraw/zinc/80/10/97/1345801097.db2.gz	UKJGIIVFBOGCDO-LEWJYISDSA-N	0	3	341.499	3.417	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@]3(CCN(Cc4cccc(C#N)c4)C3)C2)C1	ZINC001041652593	1345811102	/nfs/dbraw/zinc/81/11/02/1345811102.db2.gz	KUZHSWXFHDCSQW-QFIPXVFZSA-N	0	3	349.478	3.339	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CC[C@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001041698052	1345822254	/nfs/dbraw/zinc/82/22/54/1345822254.db2.gz	PIJGOLSBMFBRCA-SBHAEUEKSA-N	0	3	337.467	3.029	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccc(Cl)c(F)c3)C2)C1	ZINC001041709051	1345825447	/nfs/dbraw/zinc/82/54/47/1345825447.db2.gz	QPYSFFWXUBQJSA-SFHVURJKSA-N	0	3	334.822	3.040	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)[C@H](CC)Cc3ccccc3)C2)C1	ZINC001041720034	1345830333	/nfs/dbraw/zinc/83/03/33/1345830333.db2.gz	HKZFOCJGCNQFRF-IRLDBZIGSA-N	0	3	338.495	3.203	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3ccc(Cl)cc3Cl)C2)C1	ZINC001041801151	1345855669	/nfs/dbraw/zinc/85/56/69/1345855669.db2.gz	HILRPBDMZMBHNX-QGZVFWFLSA-N	0	3	337.250	3.165	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)C3CCC(C(F)F)CC3)C2)C1	ZINC001041809846	1345858655	/nfs/dbraw/zinc/85/86/55/1345858655.db2.gz	SPYHJCBHZKRSBP-RJYAGPCLSA-N	0	3	338.442	3.006	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccc4c(c3)CCCC4)C2)C1	ZINC001041815354	1345860326	/nfs/dbraw/zinc/86/03/26/1345860326.db2.gz	AAECXPYVFFJALL-QFIPXVFZSA-N	0	3	336.479	3.127	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3CCN(C(=O)C4CCCC4)C[C@@H]32)c1	ZINC001041885669	1345882792	/nfs/dbraw/zinc/88/27/92/1345882792.db2.gz	PLMJYHXFELAEIK-ICSRJNTNSA-N	0	3	337.467	3.171	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3CCN(C(=O)c4ccccc4)C[C@H]32)cc1	ZINC001041906526	1345890695	/nfs/dbraw/zinc/89/06/95/1345890695.db2.gz	KJMCAGUMSUDBBI-PZJWPPBQSA-N	0	3	345.446	3.295	20	30		EGEDHN
CC(C)(C)CC(=O)N1CC[C@H]2CCN(Cc3cccc(C#N)c3)[C@@H]2C1	ZINC001041929956	1345900219	/nfs/dbraw/zinc/90/02/19/1345900219.db2.gz	VKZKYMCXNJATGH-RTBURBONSA-N	0	3	339.483	3.417	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@H]2CCN(Cc3ccc(C#N)cc3)[C@@H]2C1	ZINC001041950847	1345907292	/nfs/dbraw/zinc/90/72/92/1345907292.db2.gz	WBLIAPJMWCUZCM-WOJBJXKFSA-N	0	3	339.483	3.417	20	30		EGEDHN
C/C(=C/C(=O)N1CC[C@@H]2CCN(Cc3cccc(C#N)c3)[C@@H]2C1)C1CC1	ZINC001041962348	1345908748	/nfs/dbraw/zinc/90/87/48/1345908748.db2.gz	ROCRZYOECKKANA-RXZAAINWSA-N	0	3	349.478	3.337	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CCN(C(=O)CCC4CC4)C[C@@H]32)c1	ZINC001041984977	1345913543	/nfs/dbraw/zinc/91/35/43/1345913543.db2.gz	LNUVEAXRHPMICN-UXHICEINSA-N	0	3	337.467	3.171	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CCN(C(=O)C=C4CCC4)C[C@H]32)c1	ZINC001042006896	1345922511	/nfs/dbraw/zinc/92/25/11/1345922511.db2.gz	RMLZGKUMVRDYCD-WOJBJXKFSA-N	0	3	335.451	3.091	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)CC(C)(C)c3ccc(F)cc3)C[C@@H]21	ZINC001042095505	1345942393	/nfs/dbraw/zinc/94/23/93/1345942393.db2.gz	NCABRUGSVJYWFG-APWZRJJASA-N	0	3	342.458	3.049	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3c(C)noc3C(C)C)C[C@@H]21	ZINC001042100453	1345943727	/nfs/dbraw/zinc/94/37/27/1345943727.db2.gz	GCZJKPKJBJHKJE-HOTGVXAUSA-N	0	3	331.460	3.219	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3c(C)noc3C(C)C)C[C@H]21	ZINC001042100455	1345943904	/nfs/dbraw/zinc/94/39/04/1345943904.db2.gz	GCZJKPKJBJHKJE-JKSUJKDBSA-N	0	3	331.460	3.219	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccnc(-c4ccco4)c3)C[C@@H]21	ZINC001042108875	1345946205	/nfs/dbraw/zinc/94/62/05/1345946205.db2.gz	GEYZUNTWKDUEMF-QAPCUYQASA-N	0	3	337.423	3.064	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C3(C)CCC(F)(F)CC3)C[C@@H]21	ZINC001042119380	1345948895	/nfs/dbraw/zinc/94/88/95/1345948895.db2.gz	GSWCWULMVXRLSE-GJZGRUSLSA-N	0	3	326.431	3.311	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cccc(-n4cccc4)c3)C[C@H]21	ZINC001042139595	1345954194	/nfs/dbraw/zinc/95/41/94/1345954194.db2.gz	YACBFQDFBJCSKW-YLJYHZDGSA-N	0	3	335.451	3.200	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cccc(-n4cccc4)c3)C[C@@H]21	ZINC001042139593	1345954261	/nfs/dbraw/zinc/95/42/61/1345954261.db2.gz	YACBFQDFBJCSKW-PXNSSMCTSA-N	0	3	335.451	3.200	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(-c4cccs4)on3)C[C@@H]21	ZINC001042171006	1345965349	/nfs/dbraw/zinc/96/53/49/1345965349.db2.gz	BUVGIRNAVCIAMK-HIFRSBDPSA-N	0	3	343.452	3.126	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CCN(CCc3csc(C)n3)[C@H]2C1	ZINC001042181662	1345969484	/nfs/dbraw/zinc/96/94/84/1345969484.db2.gz	IEURLAGIEUVFNR-WBVHZDCISA-N	0	3	347.528	3.129	20	30		EGEDHN
CC1(C(=O)N2CC[C@H]3CCN(Cc4cccc(C#N)c4)[C@@H]3C2)CCC1	ZINC001042182994	1345970890	/nfs/dbraw/zinc/97/08/90/1345970890.db2.gz	HQYDDRCQOXPNLA-RTBURBONSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3ccc(F)cc3)[C@H]2C1	ZINC001042184827	1345972965	/nfs/dbraw/zinc/97/29/65/1345972965.db2.gz	ZTDAPWSSLYKKBW-WMZOPIPTSA-N	0	3	330.447	3.461	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3cccc(C#N)c3)[C@@H]2C1	ZINC001042185776	1345973410	/nfs/dbraw/zinc/97/34/10/1345973410.db2.gz	XMFQQKCWPXCTOZ-RBUKOAKNSA-N	0	3	337.467	3.193	20	30		EGEDHN
CC1(C(=O)N2CC[C@@H]3CCN(Cc4ccc(C#N)cc4)[C@H]3C2)CCC1	ZINC001042187181	1345974307	/nfs/dbraw/zinc/97/43/07/1345974307.db2.gz	MFTZFUHRVGLHOM-OALUTQOASA-N	0	3	337.467	3.171	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3cccnc3C)[C@@H]2C1	ZINC001042186644	1345974513	/nfs/dbraw/zinc/97/45/13/1345974513.db2.gz	IWUWPMFLJBYNTH-SJLPKXTDSA-N	0	3	327.472	3.025	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3ccc(C)nc3C)[C@H]2C1	ZINC001042188171	1345975110	/nfs/dbraw/zinc/97/51/10/1345975110.db2.gz	QCYJZLDTJBFMQA-MJGOQNOKSA-N	0	3	341.499	3.333	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)C(C3CCC3)C3CCC3)C[C@@H]21	ZINC001042201768	1345982200	/nfs/dbraw/zinc/98/22/00/1345982200.db2.gz	QOLKEQSAQLGTBE-LPHOPBHVSA-N	0	3	328.500	3.149	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3cc(F)c(F)cc3F)C[C@H]21	ZINC001042207563	1345985554	/nfs/dbraw/zinc/98/55/54/1345985554.db2.gz	RNJIZQFKOQHFEA-SJKOYZFVSA-N	0	3	338.373	3.216	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)C(C)(C)c3cccc(F)c3)C[C@@H]21	ZINC001042229514	1345997410	/nfs/dbraw/zinc/99/74/10/1345997410.db2.gz	FQUABHXGRMNPPE-LPHOPBHVSA-N	0	3	342.458	3.049	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(OCC)c(C)c3)C[C@@H]21	ZINC001042252828	1346006240	/nfs/dbraw/zinc/00/62/40/1346006240.db2.gz	NTROJJFFWWXEIB-WMZOPIPTSA-N	0	3	328.456	3.116	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc4c(c3)C=CCC4)C[C@@H]21	ZINC001042263782	1346010817	/nfs/dbraw/zinc/01/08/17/1346010817.db2.gz	YSJABZYIWHXACW-NQIIRXRSSA-N	0	3	334.463	3.206	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ncoc3-c3cccs3)C[C@@H]21	ZINC001042271978	1346014441	/nfs/dbraw/zinc/01/44/41/1346014441.db2.gz	JKQBNLCGZZESPM-KBPBESRZSA-N	0	3	343.452	3.126	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ncc(Cl)cc3Cl)C[C@@H]21	ZINC001042287976	1346017835	/nfs/dbraw/zinc/01/78/35/1346017835.db2.gz	PWKDVPOJJBYENZ-FZMZJTMJSA-N	0	3	340.254	3.111	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3coc(C4CCCC4)n3)C[C@H]21	ZINC001042293646	1346020326	/nfs/dbraw/zinc/02/03/26/1346020326.db2.gz	HSVPMUJENYWYAD-RHSMWYFYSA-N	0	3	329.444	3.055	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)c3ccc(Cl)c4occc43)C[C@@H]21	ZINC001042309002	1346027455	/nfs/dbraw/zinc/02/74/55/1346027455.db2.gz	JFUFSGJUQHRLMI-DYVFJYSZSA-N	0	3	342.826	3.256	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3coc(-c4ccccc4)n3)C[C@@H]21	ZINC001042316184	1346030483	/nfs/dbraw/zinc/03/04/83/1346030483.db2.gz	IUWPROWONBCXII-QAPCUYQASA-N	0	3	337.423	3.064	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccccc3C(F)(F)F)C[C@H]21	ZINC001042327199	1346036043	/nfs/dbraw/zinc/03/60/43/1346036043.db2.gz	MCUTYNYQKWCMPM-CZUORRHYSA-N	0	3	338.373	3.428	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C34CC5CC(CC(C5)C3)C4)C[C@@H]21	ZINC001042327945	1346037403	/nfs/dbraw/zinc/03/74/03/1346037403.db2.gz	QJJYWFKOHNAWNT-CHAHAOGTSA-N	0	3	340.511	3.149	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)COc3ccccc3C(C)C)C[C@H]21	ZINC001042342008	1346046165	/nfs/dbraw/zinc/04/61/65/1346046165.db2.gz	SFGBNWGKLMWLGK-IEBWSBKVSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3c(Cl)cccc3OC)C[C@H]21	ZINC001042369700	1346059886	/nfs/dbraw/zinc/05/98/86/1346059886.db2.gz	AAOJASGGLFBUGY-DZGCQCFKSA-N	0	3	334.847	3.071	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3csc(CC(C)C)n3)C[C@H]21	ZINC001042372736	1346061744	/nfs/dbraw/zinc/06/17/44/1346061744.db2.gz	ATXWDNNHINEYNO-GDBMZVCRSA-N	0	3	333.501	3.064	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccccc3CC(C)C)C[C@@H]21	ZINC001042373931	1346061858	/nfs/dbraw/zinc/06/18/58/1346061858.db2.gz	FILYRBIKRIYSPN-NQIIRXRSSA-N	0	3	338.495	3.445	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3csc(CC(C)C)n3)C[C@H]21	ZINC001042373367	1346062315	/nfs/dbraw/zinc/06/23/15/1346062315.db2.gz	FWQMEQKZULPTBC-DOTOQJQBSA-N	0	3	347.528	3.454	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@H](NCc3ccccc3C#N)C[C@H]2C)o1	ZINC001044446394	1346335373	/nfs/dbraw/zinc/33/53/73/1346335373.db2.gz	KCGXVYQUEJHKHH-KDOFPFPSSA-N	0	3	337.423	3.243	20	30		EGEDHN
Cc1occc1C(=O)N1CC[C@@H](NCc2ccccc2C#N)C[C@@H]1C	ZINC001044453548	1346336753	/nfs/dbraw/zinc/33/67/53/1346336753.db2.gz	VIKZBNAKBQQARJ-KBXCAEBGSA-N	0	3	337.423	3.243	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2cc(F)ccc2C#N)CCN1C(=O)C1=CCCC1	ZINC001044544780	1346365895	/nfs/dbraw/zinc/36/58/95/1346365895.db2.gz	VYOYXGDKQKVFBT-AUUYWEPGSA-N	0	3	341.430	3.277	20	30		EGEDHN
C[C@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)Cc1ccccc1	ZINC001044649950	1346393097	/nfs/dbraw/zinc/39/30/97/1346393097.db2.gz	AWQZNXKTIXIQAG-UWJYYQICSA-N	0	3	347.462	3.270	20	30		EGEDHN
Cc1coc(C(=O)N2CC[C@H](NCc3ccccc3C#N)C[C@H]2C)c1	ZINC001044717026	1346409948	/nfs/dbraw/zinc/40/99/48/1346409948.db2.gz	QFPZYEKEYZHSKE-QAPCUYQASA-N	0	3	337.423	3.243	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)c2ccccc2F)s1	ZINC001044902644	1346458060	/nfs/dbraw/zinc/45/80/60/1346458060.db2.gz	PHNODOQHOKYPSD-ZDUSSCGKSA-N	0	3	343.427	3.153	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)C[C@H]2C=CCC2)c(F)c1	ZINC001044914814	1346461731	/nfs/dbraw/zinc/46/17/31/1346461731.db2.gz	IVYKGJUGCXYUMC-YJBOKZPZSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C[C@H](C(=O)N1CCC[C@H]1CNCc1ncccc1C)c1ccccc1	ZINC001045320313	1346559001	/nfs/dbraw/zinc/55/90/01/1346559001.db2.gz	QLXNNVYCZMQGDR-PMACEKPBSA-N	0	3	349.478	3.440	20	30		EGEDHN
CC1CC(C(=O)NC2(C)CCN(Cc3cccc(C#N)c3)CC2)C1	ZINC001045405580	1346585587	/nfs/dbraw/zinc/58/55/87/1346585587.db2.gz	SQAHYPQEUGDHAG-UHFFFAOYSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC1(C)CC(C(=O)NC2(C)CCN(Cc3cccc(C#N)c3)CC2)C1	ZINC001045429431	1346591066	/nfs/dbraw/zinc/59/10/66/1346591066.db2.gz	XCSFJKWVQSCWGY-UHFFFAOYSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2ccc3nc(C)ccc3c2)CC1	ZINC001045593383	1346639402	/nfs/dbraw/zinc/63/94/02/1346639402.db2.gz	OWOBORJPLNFPJE-UHFFFAOYSA-N	0	3	335.451	3.151	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)C2CC(c3ccc(F)cc3)C2)CC1	ZINC001045650341	1346659183	/nfs/dbraw/zinc/65/91/83/1346659183.db2.gz	TXTSCKAMWSRPDM-UHFFFAOYSA-N	0	3	330.447	3.476	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1ccc(C#N)cc1	ZINC001045758036	1346691222	/nfs/dbraw/zinc/69/12/22/1346691222.db2.gz	SVOQXNCSTXQCCW-CEXWTWQISA-N	0	3	337.467	3.170	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc(Cl)c[nH]1)C2	ZINC001045910875	1346748666	/nfs/dbraw/zinc/74/86/66/1346748666.db2.gz	BUGTUBMPPSTUEF-GOSISDBHSA-N	0	3	333.863	3.010	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@]1(C)CC=CCC1)C2	ZINC001045940093	1346775553	/nfs/dbraw/zinc/77/55/53/1346775553.db2.gz	PZRNRFJBMDRLIN-LEWJYISDSA-N	0	3	328.500	3.461	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)C[C@H]1C=CCCC1)C2	ZINC001045947944	1346783655	/nfs/dbraw/zinc/78/36/55/1346783655.db2.gz	QCUPNACVAUCZHE-PZJWPPBQSA-N	0	3	328.500	3.461	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@@]2(CCN(Cc3conc3C)C2)C1	ZINC001045958912	1346794237	/nfs/dbraw/zinc/79/42/37/1346794237.db2.gz	ZMXSBRUXSQDDJP-FQEVSTJZSA-N	0	3	345.487	3.400	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc(F)c(C)c1)C2	ZINC001045961114	1346796135	/nfs/dbraw/zinc/79/61/35/1346796135.db2.gz	GSKQZGWKOUIOCY-FQEVSTJZSA-N	0	3	328.431	3.086	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)Cc1cccc(Cl)c1)C2	ZINC001045963366	1346798450	/nfs/dbraw/zinc/79/84/50/1346798450.db2.gz	YFDILMUVGAMPKZ-FQEVSTJZSA-N	0	3	344.886	3.220	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)C(C)(C)C(F)F)C2	ZINC001045963677	1346798920	/nfs/dbraw/zinc/79/89/20/1346798920.db2.gz	MUQUASJJIHOHHA-SFHVURJKSA-N	0	3	326.431	3.006	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc3c(C)cccn3c1)C2	ZINC001045980368	1346817189	/nfs/dbraw/zinc/81/71/89/1346817189.db2.gz	WODMRFKHABFRHJ-QFIPXVFZSA-N	0	3	349.478	3.199	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)CCc1cccs1)C2	ZINC001045983127	1346822254	/nfs/dbraw/zinc/82/22/54/1346822254.db2.gz	KCGRBTHUTJEQJR-LJQANCHMSA-N	0	3	330.497	3.019	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc3ccccc3[nH]1)C2	ZINC001045983079	1346822815	/nfs/dbraw/zinc/82/28/15/1346822815.db2.gz	ITGQOQWLZFNEPD-NRFANRHFSA-N	0	3	335.451	3.119	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)CC(C1CC1)C1CC1)C2	ZINC001045985918	1346826507	/nfs/dbraw/zinc/82/65/07/1346826507.db2.gz	FIAVJKSZCGPSRJ-NRFANRHFSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cnc(CC)s1)C2	ZINC001045986518	1346827578	/nfs/dbraw/zinc/82/75/78/1346827578.db2.gz	SUDSCWOOCWAGHU-LJQANCHMSA-N	0	3	345.512	3.047	20	30		EGEDHN
C=CCCN1CC[C@](C)(NC(=O)c2cc(-c3ccccc3)no2)C1	ZINC001046439780	1346975683	/nfs/dbraw/zinc/97/56/83/1346975683.db2.gz	AQZHTWGOORGKFQ-IBGZPJMESA-N	0	3	325.412	3.112	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2ccc(F)cc2)C1	ZINC001046909559	1347149312	/nfs/dbraw/zinc/14/93/12/1347149312.db2.gz	DNKJLFNNLXAIRD-CQSZACIVSA-N	0	3	326.362	3.089	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2ccoc2CC)C1	ZINC001046936929	1347157507	/nfs/dbraw/zinc/15/75/07/1347157507.db2.gz	YUYPCJMJNNOUOG-ZDUSSCGKSA-N	0	3	326.387	3.105	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2occ3c2CCC3)C1	ZINC001046956962	1347165168	/nfs/dbraw/zinc/16/51/68/1347165168.db2.gz	BZJIJTGCUUSFSV-AWEZNQCLSA-N	0	3	338.398	3.031	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2ccc(F)s2)C1	ZINC001046994582	1347176998	/nfs/dbraw/zinc/17/69/98/1347176998.db2.gz	ALZBNFWXUXPZRD-NSHDSACASA-N	0	3	332.391	3.150	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@H]3C[C@@H](C2)N(Cc2cncs2)C3)CC1	ZINC001047138996	1347217691	/nfs/dbraw/zinc/21/76/91/1347217691.db2.gz	IURIEUAXWCVGMY-XIRDDKMYSA-N	0	3	345.512	3.359	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)c3ccsc3)C2)CC1	ZINC001047222937	1347253506	/nfs/dbraw/zinc/25/35/06/1347253506.db2.gz	FTBNXWPSAMZMJN-QGZVFWFLSA-N	0	3	330.497	3.336	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3cc(C)oc3C)C2)CC1	ZINC001047223739	1347254200	/nfs/dbraw/zinc/25/42/00/1347254200.db2.gz	NUKUWZNRPHGJPZ-SFHVURJKSA-N	0	3	328.456	3.094	20	30		EGEDHN
CC[C@@H](F)CN1CCC([C@@H]2CCCN(C(=O)C#CC3CC3)C2)CC1	ZINC001047235695	1347263858	/nfs/dbraw/zinc/26/38/58/1347263858.db2.gz	AQFHMJGDOSSMHB-RTBURBONSA-N	0	3	334.479	3.099	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)C3(C(F)F)CC3)C2)CC1	ZINC001047239458	1347265955	/nfs/dbraw/zinc/26/59/55/1347265955.db2.gz	OBIWTWGFHIAXJI-MRXNPFEDSA-N	0	3	338.442	3.006	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)[C@@H]3CCC3(F)F)C2)CC1	ZINC001047242076	1347268408	/nfs/dbraw/zinc/26/84/08/1347268408.db2.gz	AYPCHPMTXCKQCZ-SJORKVTESA-N	0	3	338.442	3.006	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)C3C=CC=CC=C3)C2)CC1	ZINC001047243572	1347269246	/nfs/dbraw/zinc/26/92/46/1347269246.db2.gz	ZMCRBFKOVNJIKM-OAQYLSRUSA-N	0	3	338.495	3.259	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)c3[nH]c(C)cc3C)C2)CC1	ZINC001047245533	1347271254	/nfs/dbraw/zinc/27/12/54/1347271254.db2.gz	YPEAARFMGATZRF-LJQANCHMSA-N	0	3	341.499	3.219	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@@H]3CCCC3(C)C)C2)CC1	ZINC001047250007	1347274742	/nfs/dbraw/zinc/27/47/42/1347274742.db2.gz	YWHNETQOZURXRL-MOPGFXCFSA-N	0	3	330.516	3.397	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC001047683783	1347329032	/nfs/dbraw/zinc/32/90/32/1347329032.db2.gz	SCNUCXXLVPJSLF-UZLBHIALSA-N	0	3	333.435	3.199	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@H]([C@H](C)NCc2ccccc2C#N)C1	ZINC001047723539	1347350623	/nfs/dbraw/zinc/35/06/23/1347350623.db2.gz	BHRGVIZBTRBDEF-KXBFYZLASA-N	0	3	327.472	3.321	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)CC2CCC2)C1	ZINC001047772771	1347366551	/nfs/dbraw/zinc/36/65/51/1347366551.db2.gz	JDCXGFPJHMSKOM-DNVCBOLYSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)Cc2ccccc2)C1	ZINC001047883471	1347398595	/nfs/dbraw/zinc/39/85/95/1347398595.db2.gz	AMMJKNNFYZMQSM-UTKZUKDTSA-N	0	3	347.462	3.128	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H](C)[C@@H](CNCc3csc(C)n3)C2)CC1	ZINC001048375735	1347535559	/nfs/dbraw/zinc/53/55/59/1347535559.db2.gz	XBTHFEQOEGOMIY-PBHICJAKSA-N	0	3	347.528	3.382	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1C#N	ZINC001048500074	1347569304	/nfs/dbraw/zinc/56/93/04/1347569304.db2.gz	WYAYLEBVNCALMF-ZVMONYEMSA-N	0	3	337.467	3.073	20	30		EGEDHN
C=C(C)CN1CCC(N(Cc2ccccn2)C(=O)[C@H]2C[C@H]2C)CC1	ZINC001048625095	1347623607	/nfs/dbraw/zinc/62/36/07/1347623607.db2.gz	LGXNKUQCJRPKFR-APWZRJJASA-N	0	3	327.472	3.107	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)c2cc[nH]c2C)CC1	ZINC001048625710	1347624069	/nfs/dbraw/zinc/62/40/69/1347624069.db2.gz	LWOTWZDQTQBJAP-UHFFFAOYSA-N	0	3	338.455	3.011	20	30		EGEDHN
C[C@H](c1ccccc1Cl)N1C[C@@H]2CN(C(=O)C#CC3CC3)C[C@@H]2C1	ZINC001048812106	1347663135	/nfs/dbraw/zinc/66/31/35/1347663135.db2.gz	AFSAXDHYBHDPFB-OIISXLGYSA-N	0	3	342.870	3.205	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@H]2CN(Cc3cncc(C)c3)C[C@H]2C1	ZINC001048841430	1347670062	/nfs/dbraw/zinc/67/00/62/1347670062.db2.gz	UNRAMLOGPMVWNN-CALCHBBNSA-N	0	3	347.890	3.059	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@H]3CC[C@H](C4CCC4)CC3)C[C@@H]2C1	ZINC001048870656	1347674143	/nfs/dbraw/zinc/67/41/43/1347674143.db2.gz	KLFOKXOYHDSLIO-HKJRMUSSSA-N	0	3	328.500	3.006	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc(Cl)c(CCC)c3)C[C@@H]2C1	ZINC001049172607	1347738804	/nfs/dbraw/zinc/73/88/04/1347738804.db2.gz	YRYUBBMJDOVZEH-HDICACEKSA-N	0	3	344.886	3.320	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc(-c4cccs4)o3)C[C@@H]2C1	ZINC001049196797	1347744394	/nfs/dbraw/zinc/74/43/94/1347744394.db2.gz	ALVRJDXUFLJGBI-GASCZTMLSA-N	0	3	340.448	3.035	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)C[C@@H]2C=CCC2)c1	ZINC001049314028	1347787127	/nfs/dbraw/zinc/78/71/27/1347787127.db2.gz	KXUCIZXHPCRNRW-JRGCBEDISA-N	0	3	349.478	3.480	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)[C@H]2CC=CCC2)cc1	ZINC001049325979	1347792165	/nfs/dbraw/zinc/79/21/65/1347792165.db2.gz	LCAFJUXZLLSWAY-PCCBWWKXSA-N	0	3	349.478	3.480	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@@H]2[C@H]1CCN2CCc1ccccc1Cl	ZINC001049370972	1347808791	/nfs/dbraw/zinc/80/87/91/1347808791.db2.gz	DHSRFVYKJOQSAO-ZTFGCOKTSA-N	0	3	345.874	3.107	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)CCC2CC2)c1	ZINC001049385318	1347813497	/nfs/dbraw/zinc/81/34/97/1347813497.db2.gz	BMPBRZBLNKEMRA-WOJBJXKFSA-N	0	3	337.467	3.314	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049415507	1347838830	/nfs/dbraw/zinc/83/88/30/1347838830.db2.gz	LKAIZHOVZJRDIQ-QYZOEREBSA-N	0	3	337.467	3.170	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(F)cc2ccncc21	ZINC001049482422	1347869868	/nfs/dbraw/zinc/86/98/68/1347869868.db2.gz	XKUDKAAGJWHONB-OALUTQOASA-N	0	3	339.414	3.239	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(CCC)s1	ZINC001049499130	1347879304	/nfs/dbraw/zinc/87/93/04/1347879304.db2.gz	UYRHYHRLBZCGBZ-SJORKVTESA-N	0	3	330.497	3.403	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1c(C)nn(C(C)(C)C)c1C	ZINC001049507501	1347883720	/nfs/dbraw/zinc/88/37/20/1347883720.db2.gz	JNOZKUMCAHGKOR-DLBZAZTESA-N	0	3	344.503	3.120	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1cncc2ccccc21	ZINC001049528818	1347893630	/nfs/dbraw/zinc/89/36/30/1347893630.db2.gz	BBRUCFFLCZPGGQ-VQTJNVASSA-N	0	3	335.451	3.029	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cccnc1C(F)F	ZINC001049581856	1347920858	/nfs/dbraw/zinc/92/08/58/1347920858.db2.gz	AGQVJGWZCGYFEF-HUUCEWRRSA-N	0	3	335.398	3.274	20	30		EGEDHN
C=CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1scnc1C(F)F	ZINC001049590305	1347925205	/nfs/dbraw/zinc/92/52/05/1347925205.db2.gz	ZSWAQEUWIXVTRS-NWDGAFQWSA-N	0	3	341.427	3.336	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1cccc(C)c1Cl	ZINC001049595099	1347928423	/nfs/dbraw/zinc/92/84/23/1347928423.db2.gz	TUSJVGVETSUJKZ-MSOLQXFVSA-N	0	3	344.886	3.280	20	30		EGEDHN
CC1(CC(=O)N2CCC[C@H]3[C@@H]2CCN3Cc2cccc(C#N)c2)CC1	ZINC001049600763	1347930400	/nfs/dbraw/zinc/93/04/00/1347930400.db2.gz	CPFIRDJBEJMKDH-OALUTQOASA-N	0	3	337.467	3.314	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(C)nc1C(C)C	ZINC001049621796	1347939397	/nfs/dbraw/zinc/93/93/97/1347939397.db2.gz	OSMWUCTWEPOUCX-MSOLQXFVSA-N	0	3	327.472	3.378	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C1(c2cccc(F)c2)CCC1	ZINC001049624727	1347940180	/nfs/dbraw/zinc/94/01/80/1347940180.db2.gz	AHELHQZAGVJDEC-RTBURBONSA-N	0	3	342.458	3.499	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)C1(c2cccc(F)c2)CCC1	ZINC001049624723	1347940343	/nfs/dbraw/zinc/94/03/43/1347940343.db2.gz	AHELHQZAGVJDEC-OALUTQOASA-N	0	3	342.458	3.499	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(F)ccc1OC	ZINC001049630538	1347943579	/nfs/dbraw/zinc/94/35/79/1347943579.db2.gz	QTJWDDOQWNROJC-SJORKVTESA-N	0	3	332.419	3.089	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1c(F)ccc(F)c1F	ZINC001049677360	1347968412	/nfs/dbraw/zinc/96/84/12/1347968412.db2.gz	UIACQYBWZJMHMW-HUUCEWRRSA-N	0	3	338.373	3.359	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)C2CC3(CC3)C2)cc1	ZINC001049711186	1347986043	/nfs/dbraw/zinc/98/60/43/1347986043.db2.gz	RQBIIPWCFUKDLT-VQTJNVASSA-N	0	3	349.478	3.314	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](C)Cc1ccccc1F	ZINC001049714658	1347988411	/nfs/dbraw/zinc/98/84/11/1347988411.db2.gz	PLMOHSJVBUGXBI-NSISKUIASA-N	0	3	342.458	3.093	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1c(F)ccc(F)c1Cl	ZINC001049743473	1347996693	/nfs/dbraw/zinc/99/66/93/1347996693.db2.gz	QFPZBBYEKJDDFA-KBPBESRZSA-N	0	3	340.801	3.483	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1cccc2sccc21	ZINC001049762628	1348007698	/nfs/dbraw/zinc/00/76/98/1348007698.db2.gz	QWCQVNZISPIFPP-MSOLQXFVSA-N	0	3	338.476	3.142	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(C(CC)CC)no1	ZINC001049769034	1348012291	/nfs/dbraw/zinc/01/22/91/1348012291.db2.gz	GDUKUXIRKWMMQD-ZWKOTPCHSA-N	0	3	343.471	3.280	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](CC)Oc1cccc(C)c1	ZINC001049779150	1348018073	/nfs/dbraw/zinc/01/80/73/1348018073.db2.gz	SFHJBFSHRPWCAC-AQNXPRMDSA-N	0	3	342.483	3.404	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccccc1F	ZINC001049785828	1348021609	/nfs/dbraw/zinc/02/16/09/1348021609.db2.gz	ZJNGBFBAXGCBNJ-NBMJBFSESA-N	0	3	328.431	3.181	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc2nc(C)ccc2c1	ZINC001049799406	1348026654	/nfs/dbraw/zinc/02/66/54/1348026654.db2.gz	VOIZRUNBSXRTFI-WOJBJXKFSA-N	0	3	335.451	3.408	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)C1(c2ccccc2F)CC1	ZINC001049821504	1348038782	/nfs/dbraw/zinc/03/87/82/1348038782.db2.gz	ZVSDPCVPQSZFHR-ROUUACIJSA-N	0	3	328.431	3.109	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cnn(CCC(C)C)c1C	ZINC001049837299	1348049660	/nfs/dbraw/zinc/04/96/60/1348049660.db2.gz	ARWABYPTWRFGJY-MOPGFXCFSA-N	0	3	344.503	3.103	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cnn(C2CCCC2)c1C	ZINC001049837483	1348050502	/nfs/dbraw/zinc/05/05/02/1348050502.db2.gz	PRYGOWGNCRJFNH-RTBURBONSA-N	0	3	342.487	3.172	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1sccc1COC	ZINC001049838795	1348050774	/nfs/dbraw/zinc/05/07/74/1348050774.db2.gz	FNOKRFVDLCAXKR-HOTGVXAUSA-N	0	3	334.485	3.150	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)COc1c(C)cc(C)cc1C	ZINC001049877582	1348082428	/nfs/dbraw/zinc/08/24/28/1348082428.db2.gz	QVEGYEZICBQVDZ-MOPGFXCFSA-N	0	3	342.483	3.242	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1sc(C(C)C)nc1C	ZINC001049891497	1348096059	/nfs/dbraw/zinc/09/60/59/1348096059.db2.gz	UNAXRYUZVMPDSX-CVEARBPZSA-N	0	3	345.512	3.277	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1c[nH]cc1-c1ccccc1	ZINC001049898016	1348099171	/nfs/dbraw/zinc/09/91/71/1348099171.db2.gz	VQOOEOVIMIEGJV-RTWAWAEBSA-N	0	3	347.462	3.384	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(C)n(C(C)(C)C)n1	ZINC001049899762	1348100076	/nfs/dbraw/zinc/10/00/76/1348100076.db2.gz	GQYKTXLEHUBLAV-QZTJIDSGSA-N	0	3	344.503	3.202	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1	ZINC001049920308	1348112811	/nfs/dbraw/zinc/11/28/11/1348112811.db2.gz	AQIIXMBZJDRVBG-ZGXWSNOMSA-N	0	3	340.442	3.018	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)C1(C(F)(F)F)CCCC1	ZINC001049933930	1348120945	/nfs/dbraw/zinc/12/09/45/1348120945.db2.gz	UIRGXUSFDDBFNT-KGLIPLIRSA-N	0	3	330.394	3.360	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(OC(C)C)cn1	ZINC001049938697	1348123626	/nfs/dbraw/zinc/12/36/26/1348123626.db2.gz	ADJQWYAIGHXPSK-OALUTQOASA-N	0	3	343.471	3.124	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3ccnn3C3CCCC3)[C@@H]2C1	ZINC001050060013	1348169477	/nfs/dbraw/zinc/16/94/77/1348169477.db2.gz	OUXHRHRXYFZCJZ-QFBILLFUSA-N	0	3	342.487	3.111	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cc(F)c(Cl)cc3F)[C@@H]2C1	ZINC001050128752	1348190771	/nfs/dbraw/zinc/19/07/71/1348190771.db2.gz	OGVVSJJWLWZDFP-MEDUHNTESA-N	0	3	340.801	3.341	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)Cc3cccc(Cl)c3F)[C@@H]2C1	ZINC001050150566	1348197448	/nfs/dbraw/zinc/19/74/48/1348197448.db2.gz	VVVWONFRNSAASI-GOEBONIOSA-N	0	3	336.838	3.130	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)Cn3cc(C)c4ccccc43)[C@@H]2C1	ZINC001050161754	1348200132	/nfs/dbraw/zinc/20/01/32/1348200132.db2.gz	GGOOIUCLBXUKSO-FXAWDEMLSA-N	0	3	337.467	3.059	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)[C@@H](C)Cc3ccc(C)cc3)[C@@H]2C1	ZINC001050209954	1348211929	/nfs/dbraw/zinc/21/19/29/1348211929.db2.gz	JQLSSJTZQNZVFT-SESVDKBCSA-N	0	3	338.495	3.120	20	30		EGEDHN
Cc1ccc(CN2CCC3(CN(C(=O)[C@H](C)C#N)C3)CC2)c(Cl)c1	ZINC001050460982	1348271534	/nfs/dbraw/zinc/27/15/34/1348271534.db2.gz	BKLYOWWHZYLZLT-OAHLLOKOSA-N	0	3	345.874	3.233	20	30		EGEDHN
Cc1cc(Cl)ccc1CN1CCC2(CN(C(=O)[C@H](C)C#N)C2)CC1	ZINC001050463171	1348272240	/nfs/dbraw/zinc/27/22/40/1348272240.db2.gz	KUUMDNCANCNAMN-OAHLLOKOSA-N	0	3	345.874	3.233	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc(C)c4c3CCC4)C2)CC1	ZINC001050768162	1348353392	/nfs/dbraw/zinc/35/33/92/1348353392.db2.gz	OYQXAJUZXFBEAY-UHFFFAOYSA-N	0	3	336.479	3.045	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H](C)Cc3ccccc3C)C2)CC1	ZINC001050769571	1348354086	/nfs/dbraw/zinc/35/40/86/1348354086.db2.gz	XPFHYEIZNQLSEU-IBGZPJMESA-N	0	3	338.495	3.121	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)[C@@H]3CC[C@@H](OC)C3)cccc2C1	ZINC001051291796	1348421070	/nfs/dbraw/zinc/42/10/70/1348421070.db2.gz	ATPLPKARZLKJPJ-VQIMIIECSA-N	0	3	342.483	3.052	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)[C@@H]3CCC[C@H]3OC)cccc2C1	ZINC001051292492	1348421528	/nfs/dbraw/zinc/42/15/28/1348421528.db2.gz	ZEMRKGKLKUJHHW-WOJBJXKFSA-N	0	3	342.483	3.052	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)[C@H]3CC[C@@H](F)C3)cccc2C1	ZINC001051298373	1348423913	/nfs/dbraw/zinc/42/39/13/1348423913.db2.gz	NYDUJYCIMWQRBD-MAUKXSAKSA-N	0	3	330.447	3.375	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3cc[nH]c3C(C)C)cccc2C1	ZINC001051298248	1348424019	/nfs/dbraw/zinc/42/40/19/1348424019.db2.gz	HVAKNDQPXMHTFG-UHFFFAOYSA-N	0	3	349.478	3.450	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@@H]2CCCC[C@H]2C(F)(F)F)C1	ZINC001079886044	1357413816	/nfs/dbraw/zinc/41/38/16/1357413816.db2.gz	DYWQLUFRSFFYMV-KBUPBQIOSA-N	0	3	332.410	3.368	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)Cc1ccsc1	ZINC001133564933	1376091932	/nfs/dbraw/zinc/09/19/32/1376091932.db2.gz	TVFBZVHXGMJIST-NEPJUHHUSA-N	0	3	345.306	3.072	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)C[C@@H]2C[C@H]2Cc2ccccc2)CC1	ZINC001052582051	1348585590	/nfs/dbraw/zinc/58/55/90/1348585590.db2.gz	GFJZSFVKUNZXFU-QHAWAJNXSA-N	0	3	338.495	3.249	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)C2(c3ccc(F)cc3)CCC2)CC1	ZINC001052609626	1348596024	/nfs/dbraw/zinc/59/60/24/1348596024.db2.gz	XCJSGZUNCOHMPN-IBGZPJMESA-N	0	3	342.458	3.241	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2scnc2C(C)(C)C)CC1	ZINC001052774552	1348674724	/nfs/dbraw/zinc/67/47/24/1348674724.db2.gz	DOHKSEQOUIZLMK-AWEZNQCLSA-N	0	3	333.501	3.048	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H](NC(=O)[C@@H]3C[C@H]3C3CC3)CC2)cc1	ZINC001052780152	1348676653	/nfs/dbraw/zinc/67/66/53/1348676653.db2.gz	CSPSQTIFRKSERJ-HSALFYBXSA-N	0	3	337.467	3.075	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ncoc2-c2cccs2)CC1	ZINC001052798908	1348684067	/nfs/dbraw/zinc/68/40/67/1348684067.db2.gz	YZHIBTOETXCOIB-AWEZNQCLSA-N	0	3	343.452	3.011	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@H](C)c2ccc(Cl)s2)CC1	ZINC001052850161	1348701556	/nfs/dbraw/zinc/70/15/56/1348701556.db2.gz	NJTNERFEHNSYQY-KGLIPLIRSA-N	0	3	338.904	3.499	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@@H](C)c2ccc(Cl)s2)CC1	ZINC001052850160	1348701586	/nfs/dbraw/zinc/70/15/86/1348701586.db2.gz	NJTNERFEHNSYQY-KBPBESRZSA-N	0	3	338.904	3.499	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@@]2(c3ccccc3)C[C@H](F)C2)CC1	ZINC001052901592	1348734944	/nfs/dbraw/zinc/73/49/44/1348734944.db2.gz	SHDHBEJPEBSXAX-SFHLNBCPSA-N	0	3	342.458	3.050	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)Cc2c(C)oc3ccccc32)CC1	ZINC001052983072	1348787884	/nfs/dbraw/zinc/78/78/84/1348787884.db2.gz	BEOQNMWTGVNYHU-KRWDZBQOSA-N	0	3	338.451	3.278	20	30		EGEDHN
CC(=O)N1CCC[C@@H]([C@H]2CCCN(CC#Cc3ccc(F)cc3)C2)C1	ZINC001052998084	1348795116	/nfs/dbraw/zinc/79/51/16/1348795116.db2.gz	VGKQKARCFCPGMV-VQTJNVASSA-N	0	3	342.458	3.148	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cccs2)C1	ZINC001053062915	1348874495	/nfs/dbraw/zinc/87/44/95/1348874495.db2.gz	FCMPCZNSKCKMON-SJORKVTESA-N	0	3	330.497	3.478	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)CCc2ccoc2)C1	ZINC001053074645	1348892368	/nfs/dbraw/zinc/89/23/68/1348892368.db2.gz	DMYGUPCMCOURIR-WOJBJXKFSA-N	0	3	342.483	3.329	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccc(CC)o2)C1	ZINC001053087705	1348912207	/nfs/dbraw/zinc/91/22/07/1348912207.db2.gz	NKIAYFIAGHXNHK-FUHWJXTLSA-N	0	3	328.456	3.182	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(C)cc(C)n2)C1	ZINC001053087682	1348912390	/nfs/dbraw/zinc/91/23/90/1348912390.db2.gz	MYRIANTYFNOSRM-QUCCMNQESA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccn3ccccc23)C1	ZINC001053090884	1348916570	/nfs/dbraw/zinc/91/65/70/1348916570.db2.gz	JKHNPNYJQDFQFG-QUCCMNQESA-N	0	3	349.478	3.279	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)CC2CC(F)(F)C2)C1	ZINC001053093153	1348920773	/nfs/dbraw/zinc/92/07/73/1348920773.db2.gz	WEVZUHSQWKHFFV-DLBZAZTESA-N	0	3	338.442	3.148	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)Cc2occc2C)C1	ZINC001053093824	1348922512	/nfs/dbraw/zinc/92/25/12/1348922512.db2.gz	AECYGXWQXWTJMF-RTBURBONSA-N	0	3	342.483	3.247	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cc(C)co2)C1	ZINC001053094180	1348922732	/nfs/dbraw/zinc/92/27/32/1348922732.db2.gz	UIMUOLCNOJUUMB-ZWKOTPCHSA-N	0	3	328.456	3.318	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cccn2CC)C1	ZINC001053104802	1348940807	/nfs/dbraw/zinc/94/08/07/1348940807.db2.gz	JOEBHMZNHCMFFS-OALUTQOASA-N	0	3	341.499	3.238	20	30		EGEDHN
C=C(C)CCN1Cc2ccccc2C[C@H]1CNC(=O)[C@H]1C[C@@H]1C(F)F	ZINC001054041498	1349136254	/nfs/dbraw/zinc/13/62/54/1349136254.db2.gz	MWMRVJDHFWRRTL-BZSNNMDCSA-N	0	3	348.437	3.397	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1c(C)cc(F)cc1C)C2	ZINC001054173807	1349175365	/nfs/dbraw/zinc/17/53/65/1349175365.db2.gz	GPYZCHNDFYACNR-NRFANRHFSA-N	0	3	342.458	3.394	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)C[C@H]1CCCC1(F)F)C2	ZINC001054184681	1349187144	/nfs/dbraw/zinc/18/71/44/1349187144.db2.gz	JTQZREHQFDTYJW-SJLPKXTDSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(C)c(F)c1F)C2	ZINC001054200758	1349202404	/nfs/dbraw/zinc/20/24/04/1349202404.db2.gz	JKLWBJPSDXLLSI-FQEVSTJZSA-N	0	3	346.421	3.225	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cccc(OCC)c1)C2	ZINC001054205016	1349206962	/nfs/dbraw/zinc/20/69/62/1349206962.db2.gz	IQYAWLJQEULELX-OAQYLSRUSA-N	0	3	340.467	3.037	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H]1C[C@H]1c1ccc(C)s1)C2	ZINC001054212290	1349212753	/nfs/dbraw/zinc/21/27/53/1349212753.db2.gz	FDXIKHSPUCJKJB-MBOZVWFJSA-N	0	3	342.508	3.108	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cccc3c1ccn3C)C2	ZINC001054214894	1349213865	/nfs/dbraw/zinc/21/38/65/1349213865.db2.gz	IRJDOBLISRLFNC-JOCHJYFZSA-N	0	3	349.478	3.130	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1cccc3ccsc31)C2	ZINC001054224065	1349219035	/nfs/dbraw/zinc/21/90/35/1349219035.db2.gz	SALTZGGVCHLOLZ-FQEVSTJZSA-N	0	3	338.476	3.463	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccccc1OCC)C2	ZINC001054237010	1349230349	/nfs/dbraw/zinc/23/03/49/1349230349.db2.gz	PYZWKPVWPSLCNW-OAQYLSRUSA-N	0	3	340.467	3.037	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@]1(C)CCC(C)=C(C)C1)C2	ZINC001054246858	1349242346	/nfs/dbraw/zinc/24/23/46/1349242346.db2.gz	KWEXHCRCXFCZHM-NHCUHLMSSA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(-c3ccccc3)[nH]1)C2	ZINC001054248898	1349244730	/nfs/dbraw/zinc/24/47/30/1349244730.db2.gz	GPESJTDNHQJQOO-JOCHJYFZSA-N	0	3	347.462	3.243	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@H]3CCO[C@@H]3C(C)C)cc2C1	ZINC001054268774	1349267044	/nfs/dbraw/zinc/26/70/44/1349267044.db2.gz	XGJNDZVAGMLKSD-VQTJNVASSA-N	0	3	342.483	3.256	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@H]3CC[C@@H](OC)C3)cc2C1	ZINC001054271006	1349269693	/nfs/dbraw/zinc/26/96/93/1349269693.db2.gz	FFICIIWHRCGXQO-FXAWDEMLSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@H]3CO[C@H](C)C3)cc2C1	ZINC001054271266	1349271151	/nfs/dbraw/zinc/27/11/51/1349271151.db2.gz	KBHVAHVVLWHIJE-DNVCBOLYSA-N	0	3	328.456	3.010	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3ocnc3C3CC3)cc2C1	ZINC001054281728	1349283129	/nfs/dbraw/zinc/28/31/29/1349283129.db2.gz	YNRUQIUYBOZONN-UHFFFAOYSA-N	0	3	337.423	3.374	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3c(C)onc3CC)cc2C1	ZINC001054291556	1349296752	/nfs/dbraw/zinc/29/67/52/1349296752.db2.gz	VVCJTRKDCRLUTM-UHFFFAOYSA-N	0	3	339.439	3.367	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3c[nH]c4ncccc34)cc2C1	ZINC001054292204	1349297983	/nfs/dbraw/zinc/29/79/83/1349297983.db2.gz	VBSAPMOTUAZNEA-UHFFFAOYSA-N	0	3	346.434	3.385	20	30		EGEDHN
C[C@H]1CN(C(=O)c2cccc(F)c2)C[C@H]1NCc1ccc(C#N)s1	ZINC001054349523	1349329439	/nfs/dbraw/zinc/32/94/39/1349329439.db2.gz	DJUMVBWJFKSGEA-YVEFUNNKSA-N	0	3	343.427	3.009	20	30		EGEDHN
C[C@H]1CN(C(=O)c2ccsc2)C[C@@H]1NCc1ccc(C#N)c(F)c1	ZINC001054366434	1349337117	/nfs/dbraw/zinc/33/71/17/1349337117.db2.gz	LOYUTUNGOMYWBI-SJCJKPOMSA-N	0	3	343.427	3.009	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccc(Cl)o2)C[C@H]1NCc1ccc(C#N)s1	ZINC001054389077	1349345325	/nfs/dbraw/zinc/34/53/25/1349345325.db2.gz	FQUHVRQRISQHSP-ZWNOBZJWSA-N	0	3	349.843	3.116	20	30		EGEDHN
Cc1cscc1C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001054536632	1349389037	/nfs/dbraw/zinc/38/90/37/1349389037.db2.gz	FDTXPQJSDLBYCR-BDJLRTHQSA-N	0	3	345.493	3.240	20	30		EGEDHN
Cc1sccc1C(=O)N1C[C@H](NCc2ccc(C#N)s2)[C@@H](C)C1	ZINC001054626740	1349420757	/nfs/dbraw/zinc/42/07/57/1349420757.db2.gz	CUZVVWMNKKHWLL-ZBEGNZNMSA-N	0	3	345.493	3.240	20	30		EGEDHN
CC(C(=O)N1C[C@H](C)[C@H](NCc2ccc(C#N)s2)C1)=C1CCC1	ZINC001054638911	1349424722	/nfs/dbraw/zinc/42/47/22/1349424722.db2.gz	RDLLMERDGJGAQU-YVEFUNNKSA-N	0	3	329.469	3.057	20	30		EGEDHN
C=CCn1cccc1C(=O)N1C[C@@H](C)[C@@H](NCc2ccccc2F)C1	ZINC001054751938	1349453715	/nfs/dbraw/zinc/45/37/15/1349453715.db2.gz	WHNXITGHMPEXJY-QAPCUYQASA-N	0	3	341.430	3.064	20	30		EGEDHN
C[C@H]1CN(C(=O)C23CCC(CC2)C3)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054800682	1349466586	/nfs/dbraw/zinc/46/65/86/1349466586.db2.gz	AQTLTUDUWICGIR-QUNOEHBDSA-N	0	3	343.496	3.137	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2ccc(F)c(Cl)c2F)C1	ZINC001080387037	1357598981	/nfs/dbraw/zinc/59/89/81/1357598981.db2.gz	JGLRERFVPNPNBN-ZWNOBZJWSA-N	0	3	328.790	3.244	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2ccccc2O[C@@H](C)CC)C1	ZINC001080530734	1357664520	/nfs/dbraw/zinc/66/45/20/1357664520.db2.gz	RPBPMHUCOKZPIE-SOLBZPMBSA-N	0	3	330.472	3.490	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)Cc2c[nH]c3c2cccc3C)C1	ZINC001080550165	1357673557	/nfs/dbraw/zinc/67/35/57/1357673557.db2.gz	XZGJVKAVVFJCGV-CRAIPNDOSA-N	0	3	325.456	3.031	20	30		EGEDHN
C=C(C)CCN1C[C@@H](C)[C@H](NC(=O)c2scnc2C(C)(C)C)C1	ZINC001080580319	1357685051	/nfs/dbraw/zinc/68/50/51/1357685051.db2.gz	TXCZJARDVGCLKR-ZIAGYGMSSA-N	0	3	335.517	3.457	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)[C@@H]2CCC=CCCC2)C1	ZINC001070413260	1354340896	/nfs/dbraw/zinc/34/08/96/1354340896.db2.gz	YFLNIIUFVKLPCV-IAGOWNOFSA-N	0	3	342.487	3.138	20	30		EGEDHN
C=Cc1ccc(C(=O)N2C[C@H](C)O[C@@]3(CCN(CC(=C)C)C3)C2)cc1	ZINC001071209401	1354506781	/nfs/dbraw/zinc/50/67/81/1354506781.db2.gz	JIUADVGEWOSQOJ-LAUBAEHRSA-N	0	3	340.467	3.211	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1cc2ccccc2n1CC	ZINC001085985225	1358937395	/nfs/dbraw/zinc/93/73/95/1358937395.db2.gz	WCFBEQHDVVAEHL-KRWDZBQOSA-N	0	3	325.456	3.384	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc(C(F)F)ccc2F)CC[C@@H]1C	ZINC001071512500	1354736819	/nfs/dbraw/zinc/73/68/19/1354736819.db2.gz	YLRAYMTVFBTXOD-JSGCOSHPSA-N	0	3	338.373	3.369	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCCCC[C@@H](NCc2cn(C)nc2C)C1	ZINC001088359325	1359842948	/nfs/dbraw/zinc/84/29/48/1359842948.db2.gz	WOKFORXUSKMPCD-GOSISDBHSA-N	0	3	346.519	3.192	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccnn2-c2ccccc2)CC[C@H]1C	ZINC001071610738	1354794785	/nfs/dbraw/zinc/79/47/85/1354794785.db2.gz	WLLLBVWWYZJEFZ-SJORKVTESA-N	0	3	338.455	3.031	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cnn(-c3ccccc3)c2)CC[C@H]1C	ZINC001071662294	1354834118	/nfs/dbraw/zinc/83/41/18/1354834118.db2.gz	BSJREIMFJKJJOP-SJLPKXTDSA-N	0	3	338.455	3.031	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2coc3ccc(OC)cc32)CC[C@@H]1C	ZINC001071676030	1354843625	/nfs/dbraw/zinc/84/36/25/1354843625.db2.gz	JHCJCIXFEPGEMW-LSDHHAIUSA-N	0	3	340.423	3.047	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc3ccccc3n2C)CC[C@@H]1C	ZINC001071773119	1354920396	/nfs/dbraw/zinc/92/03/96/1354920396.db2.gz	WQKGLUBINPDEBP-DOTOQJQBSA-N	0	3	325.456	3.337	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc(F)c(Cl)cc2F)CC[C@H]1C	ZINC001071779846	1354928887	/nfs/dbraw/zinc/92/88/87/1354928887.db2.gz	PPFBXFVGHRLFTJ-VXGBXAGGSA-N	0	3	340.801	3.224	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)Cc2c(C)[nH]c3ccccc32)CC[C@@H]1C	ZINC001071783449	1354931882	/nfs/dbraw/zinc/93/18/82/1354931882.db2.gz	OSYWIWPBSJHVIR-HOCLYGCPSA-N	0	3	325.456	3.174	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2c(F)ccc(F)c2F)CC[C@H]1C	ZINC001071784095	1354932730	/nfs/dbraw/zinc/93/27/30/1354932730.db2.gz	YNTMQQKIGFFQTA-NEPJUHHUSA-N	0	3	326.362	3.263	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2oc(CC(C)C)nc2C)CC[C@@H]1C	ZINC001071882848	1355003832	/nfs/dbraw/zinc/00/38/32/1355003832.db2.gz	BFRDYOYFUPUKEH-GOEBONIOSA-N	0	3	333.476	3.340	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2noc3ccc(F)cc23)CC[C@@H]1C	ZINC001071884034	1355004823	/nfs/dbraw/zinc/00/48/23/1355004823.db2.gz	WOYZNTZODOSSLE-ZFWWWQNUSA-N	0	3	345.418	3.055	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc(-c3ccccc3)ccn2)CC[C@@H]1C	ZINC001071934007	1355032855	/nfs/dbraw/zinc/03/28/55/1355032855.db2.gz	FTIDTNXXDLCZFV-FXAWDEMLSA-N	0	3	347.462	3.355	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cccc3[nH]c(C)nc32)CC[C@@H]1C	ZINC001071954807	1355041016	/nfs/dbraw/zinc/04/10/16/1355041016.db2.gz	WPOQCEJAVIOUTD-DZGCQCFKSA-N	0	3	326.444	3.030	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cccc3[nH]c(C)nc32)CC[C@H]1C	ZINC001071954808	1355041529	/nfs/dbraw/zinc/04/15/29/1355041529.db2.gz	WPOQCEJAVIOUTD-HIFRSBDPSA-N	0	3	326.444	3.030	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc3scnc3c2)CC[C@@H]1C	ZINC001071960650	1355044736	/nfs/dbraw/zinc/04/47/36/1355044736.db2.gz	GNJNMQXLIMLYEL-ZFWWWQNUSA-N	0	3	329.469	3.455	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CC[C@@H](C)N(CC3=CCCCC3)C2)nc1	ZINC001072000642	1355066439	/nfs/dbraw/zinc/06/64/39/1355066439.db2.gz	XWUACDVCXMFTMY-VQIMIIECSA-N	0	3	337.467	3.146	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CC[C@@H](C)N(CC3=CCCCC3)C2)nc1	ZINC001072000639	1355066909	/nfs/dbraw/zinc/06/69/09/1355066909.db2.gz	XWUACDVCXMFTMY-APWZRJJASA-N	0	3	337.467	3.146	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(CC(C)C)cc2)CC[C@@H]1C	ZINC001072064207	1355108985	/nfs/dbraw/zinc/10/89/85/1355108985.db2.gz	XROISAWBTGOFDL-FXAWDEMLSA-N	0	3	326.484	3.491	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2scnc2Cl)CC[C@@H]1C	ZINC001072072353	1355113175	/nfs/dbraw/zinc/11/31/75/1355113175.db2.gz	JALUFZRMHAVITG-RYUDHWBXSA-N	0	3	327.881	3.345	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(OC(C)C)cn2)CC[C@H]1C	ZINC001072125910	1355143045	/nfs/dbraw/zinc/14/30/45/1355143045.db2.gz	HMRPMTBQVKDQBI-CVEARBPZSA-N	0	3	331.460	3.028	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)[C@H]1[C@H]2[C@@H]1[C@@H]1CC[C@H]2C1	ZINC001089736249	1360641499	/nfs/dbraw/zinc/64/14/99/1360641499.db2.gz	MSEQTAKCIAKMCX-WXJALIKYSA-N	0	3	330.516	3.461	20	30		EGEDHN
C[C@H]1CCN(C(=O)CC2CC2)C[C@H]1CNCc1cc(F)ccc1C#N	ZINC001072160859	1355159625	/nfs/dbraw/zinc/15/96/25/1355159625.db2.gz	WNDDROQHPJDMIL-KBXCAEBGSA-N	0	3	343.446	3.072	20	30		EGEDHN
C[C@H]1CCN(C(=O)C2CC=CC2)C[C@H]1CNCc1ccccc1C#N	ZINC001072237790	1355198462	/nfs/dbraw/zinc/19/84/62/1355198462.db2.gz	AFSJQQXOHMURCZ-OXJNMPFZSA-N	0	3	337.467	3.099	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](C)[C@@H](CNCc2cc(C3CC3)no2)C1	ZINC001072337570	1355245702	/nfs/dbraw/zinc/24/57/02/1355245702.db2.gz	YRWALHSTKOLZKT-ZBFHGGJFSA-N	0	3	345.487	3.338	20	30		EGEDHN
Cc1cccc(C(=O)N2CC3(C2)CCN(Cc2ccc(C#N)cc2)C3)c1	ZINC001072435300	1355287222	/nfs/dbraw/zinc/28/72/22/1355287222.db2.gz	ZFZQZJBRKVCUKG-UHFFFAOYSA-N	0	3	345.446	3.215	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3c(Cl)oc4ccccc43)C2)C1	ZINC001072906265	1355490733	/nfs/dbraw/zinc/49/07/33/1355490733.db2.gz	RQKDMHCADKZIGN-UHFFFAOYSA-N	0	3	330.815	3.420	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)N2CC3(C2)CCN(Cc2ccc(C#N)cc2)C3)C1	ZINC001073033599	1355561674	/nfs/dbraw/zinc/56/16/74/1355561674.db2.gz	PFKNKAGVNXZUCU-LPHOPBHVSA-N	0	3	337.467	3.029	20	30		EGEDHN
C[C@@H]1CC[C@@H](C(=O)N2CC3(C2)CCN(Cc2ccc(C#N)cc2)C3)C1	ZINC001073033601	1355561858	/nfs/dbraw/zinc/56/18/58/1355561858.db2.gz	PFKNKAGVNXZUCU-VQIMIIECSA-N	0	3	337.467	3.029	20	30		EGEDHN
CC[C@]1(C)C[C@@H]1C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001073091064	1355588814	/nfs/dbraw/zinc/58/88/14/1355588814.db2.gz	DHKTVHFWNSGQHJ-UYAOXDASSA-N	0	3	337.467	3.029	20	30		EGEDHN
C[C@@H](CC(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2)C1CC1	ZINC001073464047	1355797059	/nfs/dbraw/zinc/79/70/59/1355797059.db2.gz	XPQVVEWODTUJSZ-INIZCTEOSA-N	0	3	337.467	3.029	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCCN1C(=O)[C@H]1CC1(C)C	ZINC001073993624	1356021836	/nfs/dbraw/zinc/02/18/36/1356021836.db2.gz	LIDQTTLTECYWAX-RTBURBONSA-N	0	3	339.483	3.417	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCCN1C(=O)[C@@H]1CC1(F)F	ZINC001074012039	1356034041	/nfs/dbraw/zinc/03/40/41/1356034041.db2.gz	ADKBPNXPLPRPHC-SJORKVTESA-N	0	3	347.409	3.026	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N1CCCC[C@@H]1CN(C)Cc1cccc(C#N)c1	ZINC001074049273	1356053630	/nfs/dbraw/zinc/05/36/30/1356053630.db2.gz	LGWMDCAOZSMLDI-IPELMVKDSA-N	0	3	325.456	3.027	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCCN1C(=O)[C@@H]1CC12CC2	ZINC001074072197	1356067314	/nfs/dbraw/zinc/06/73/14/1356067314.db2.gz	SOKSWARVVGIQGM-MOPGFXCFSA-N	0	3	337.467	3.171	20	30		EGEDHN
C[C@H]1[C@@H](NCc2ccc(C#N)s2)CCN1C(=O)C[C@H]1C=CCC1	ZINC001074519304	1356203215	/nfs/dbraw/zinc/20/32/15/1356203215.db2.gz	COCNHWGLJSXJOG-ZQIUZPCESA-N	0	3	329.469	3.055	20	30		EGEDHN
C[C@H](N[C@H]1CCN(C(=O)C#CC2CC2)[C@H]1C)c1ccccc1Cl	ZINC001074642654	1356219927	/nfs/dbraw/zinc/21/99/27/1356219927.db2.gz	CXATZPMDYLCMLK-DEYYWGMASA-N	0	3	330.859	3.393	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)C[C@@H](C)c3ccc(CC)cc3)[C@@H]2C1	ZINC001076235778	1356526841	/nfs/dbraw/zinc/52/68/41/1356526841.db2.gz	FYEOWURMNFNWTC-LSTHTHJFSA-N	0	3	326.484	3.461	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@H](CC)Cc3ccccc3)[C@@H]2C1	ZINC001076312222	1356545917	/nfs/dbraw/zinc/54/59/17/1356545917.db2.gz	OULAUNDDNBAPBH-HSALFYBXSA-N	0	3	326.484	3.364	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3ccc(Cl)c(CCC)c3)[C@@H]2C1	ZINC001076460783	1356583488	/nfs/dbraw/zinc/58/34/88/1356583488.db2.gz	BUBSVGBGQHGDBL-PKOBYXMFSA-N	0	3	344.886	3.462	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccc(COC(C)C)cc3)[C@@H]2C1	ZINC001076556536	1356616390	/nfs/dbraw/zinc/61/63/90/1356616390.db2.gz	PCLQGPYEPNTWFO-VQTJNVASSA-N	0	3	342.483	3.334	20	30		EGEDHN
CCCCCCCCC(=O)N[C@@H](C)CCNC(=O)CN(CC)CC	ZINC001076628571	1356637750	/nfs/dbraw/zinc/63/77/50/1356637750.db2.gz	SLIOTOJGSPTSHG-KRWDZBQOSA-N	0	3	341.540	3.090	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccc(-c4ccccc4)[nH]3)[C@@H]2C1	ZINC001076632341	1356638383	/nfs/dbraw/zinc/63/83/83/1356638383.db2.gz	WDOXIYUBFAOLRU-FXAWDEMLSA-N	0	3	335.451	3.404	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)C[C@H](C)C(C)C	ZINC001098961238	1363542507	/nfs/dbraw/zinc/54/25/07/1363542507.db2.gz	WDYANLNWJBVSDG-ZWKOTPCHSA-N	0	3	338.536	3.478	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)C[C@H](C)c1ccncc1	ZINC001099125916	1363639009	/nfs/dbraw/zinc/63/90/09/1363639009.db2.gz	MPPAQLIAQNKESQ-FUHWJXTLSA-N	0	3	329.488	3.368	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCCO[C@@H](CNCc2ccsc2)C1	ZINC001078460279	1356977598	/nfs/dbraw/zinc/97/75/98/1356977598.db2.gz	PFVNKAXLUTVAFF-FUHWJXTLSA-N	0	3	336.501	3.058	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2C[C@H](NC(=O)CC3CC3)C23CCC3)c(F)c1	ZINC001078531565	1356998848	/nfs/dbraw/zinc/99/88/48/1356998848.db2.gz	OHTDSUXQKNZEEX-MSOLQXFVSA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)c2ccccc2)C12CCC2	ZINC001078539653	1357004324	/nfs/dbraw/zinc/00/43/24/1357004324.db2.gz	WDFTWYLMMJKMTO-GJZGRUSLSA-N	0	3	349.272	3.226	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2cc3c([nH]2)CCCC3)C12CCC2	ZINC001078773862	1357078498	/nfs/dbraw/zinc/07/84/98/1357078498.db2.gz	OZZIYGLUSIEBGP-IAGOWNOFSA-N	0	3	347.890	3.277	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](c2ccccc2)[C@H](NCc2ccccn2)C1	ZINC001081160159	1357846214	/nfs/dbraw/zinc/84/62/14/1357846214.db2.gz	XVBWWUBJQBCBRU-VQTJNVASSA-N	0	3	349.478	3.378	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H]2CCCC(F)(F)C2)C[C@H]1c1ccccc1	ZINC001081179008	1357847451	/nfs/dbraw/zinc/84/74/51/1357847451.db2.gz	ZXBKSWMPBSPMSR-FGTMMUONSA-N	0	3	346.421	3.029	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2ccc(C3CC3)cc2)C[C@H]1c1ccccc1	ZINC001081229676	1357851033	/nfs/dbraw/zinc/85/10/33/1357851033.db2.gz	VNAWDSACGSVMSA-FCHUYYIVSA-N	0	3	344.458	3.395	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2ccccc2C(C)C)[C@H](OC)C1	ZINC001081772321	1357862737	/nfs/dbraw/zinc/86/27/37/1357862737.db2.gz	VVLBKRSLKNUTKA-RTBURBONSA-N	0	3	330.472	3.205	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)C2CCC(CCCC)CC2)[C@H](OC)C1	ZINC001082358718	1358022162	/nfs/dbraw/zinc/02/21/62/1358022162.db2.gz	OBVWELRQAXHEFU-CSODTCANSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001082721762	1358079892	/nfs/dbraw/zinc/07/98/92/1358079892.db2.gz	IKYZLMOLDCQHIB-LXGCGDOSSA-N	0	3	343.446	3.236	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H](C)[C@H](NCc2cn(C(C)C)nc2C)C1	ZINC001082722889	1358080980	/nfs/dbraw/zinc/08/09/80/1358080980.db2.gz	MKNWVTWKVJMSQM-XFQXTVEOSA-N	0	3	346.519	3.311	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)Cc3coc4cc(F)ccc34)[C@@H]2C1	ZINC001084338923	1358195385	/nfs/dbraw/zinc/19/53/85/1358195385.db2.gz	HYHAFIMDYYWWMW-RDTXWAMCSA-N	0	3	342.414	3.223	20	30		EGEDHN
O=C(C#CC1CC1)N1C[C@H]2CCN(Cc3cccc4ccccc43)C[C@H]21	ZINC001084333857	1358195410	/nfs/dbraw/zinc/19/54/10/1358195410.db2.gz	DACIMLPCCROBEX-IFMALSPDSA-N	0	3	344.458	3.286	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3ccc4cc(C)ccc4n3)[C@@H]2C1	ZINC001084505476	1358227960	/nfs/dbraw/zinc/22/79/60/1358227960.db2.gz	CKSZWAJFTFGQDF-YLJYHZDGSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CCN(C[C@@H](OC)c3ccccc3)C[C@H]21	ZINC001084578001	1358242009	/nfs/dbraw/zinc/24/20/09/1358242009.db2.gz	DGVVSLDBTYAJSB-GUDVDZBRSA-N	0	3	342.483	3.119	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)COc3ccccc3C(C)C)[C@@H]2C1	ZINC001084816224	1358318830	/nfs/dbraw/zinc/31/88/30/1358318830.db2.gz	VLQBCLRCDGCQPX-IEBWSBKVSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@H](C)Cc3ccc(C)cc3)[C@@H]2C1	ZINC001084856013	1358330711	/nfs/dbraw/zinc/33/07/11/1358330711.db2.gz	PLKPNINVUSXBRR-MISYRCLQSA-N	0	3	326.484	3.282	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)[C@H](c3ccc(F)cc3)C(C)C)[C@@H]2C1	ZINC001084857960	1358330940	/nfs/dbraw/zinc/33/09/40/1358330940.db2.gz	CHSRCCKFEQDMQZ-RLLQIKCJSA-N	0	3	342.458	3.121	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)C3CC(c4cccc(F)c4)C3)[C@@H]2C1	ZINC001084868287	1358336003	/nfs/dbraw/zinc/33/60/03/1358336003.db2.gz	CNPSWJILKQPADH-CKVGWXAMSA-N	0	3	342.458	3.428	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H]2CCN(CCC(F)(F)F)[C@H]2C1	ZINC001085024003	1358369749	/nfs/dbraw/zinc/36/97/49/1358369749.db2.gz	MPZDFWGXFVPSEY-IJEWVQPXSA-N	0	3	332.410	3.464	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@@H]2CCCC[C@H]2NC(=O)C2CCC2)c1	ZINC001085113737	1358395192	/nfs/dbraw/zinc/39/51/92/1358395192.db2.gz	PLUVBQHONLFFNR-QZTJIDSGSA-N	0	3	329.419	3.014	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1nc(C(C)C)oc1C	ZINC001085197444	1358431715	/nfs/dbraw/zinc/43/17/15/1358431715.db2.gz	UBVHWQWXGDFCSM-ZIAGYGMSSA-N	0	3	339.867	3.490	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cc(C)ccc1OC	ZINC001085264033	1358446821	/nfs/dbraw/zinc/44/68/21/1358446821.db2.gz	SMGUGGUEXHOVFJ-HZPDHXFCSA-N	0	3	336.863	3.387	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cccc(OCC)c1	ZINC001085346213	1358474095	/nfs/dbraw/zinc/47/40/95/1358474095.db2.gz	LHTPEMUUWWHXNU-IAGOWNOFSA-N	0	3	336.863	3.468	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1nsc2ccccc21	ZINC001085615356	1358636517	/nfs/dbraw/zinc/63/65/17/1358636517.db2.gz	KDRRHALUEMFSDW-AWEZNQCLSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N(C)C[C@@H]1CCN1CCC(C)C	ZINC001085678149	1358682121	/nfs/dbraw/zinc/68/21/21/1358682121.db2.gz	BZOSJNQAMNUDEC-KRWDZBQOSA-N	0	3	330.472	3.444	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1cc(C)nn1C(CC)CC	ZINC001085682544	1358684114	/nfs/dbraw/zinc/68/41/14/1358684114.db2.gz	WAQQRXNRGQOQAE-QGZVFWFLSA-N	0	3	332.492	3.275	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc2ccc(OC)cc2[nH]1	ZINC001085755628	1358735892	/nfs/dbraw/zinc/73/58/92/1358735892.db2.gz	LUQVDUBTVGMGGR-INIZCTEOSA-N	0	3	341.455	3.289	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C[C@H]2CCN2CCCc2ccccc2)cc1	ZINC001085757626	1358737139	/nfs/dbraw/zinc/73/71/39/1358737139.db2.gz	MTSAGUFILOOSEU-JOCHJYFZSA-N	0	3	346.474	3.447	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@@H]1CCCc2cccnc21	ZINC001085781335	1358757383	/nfs/dbraw/zinc/75/73/83/1358757383.db2.gz	TXKBPXNRQDRDGE-QZTJIDSGSA-N	0	3	327.472	3.000	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc(-c2cccs2)n[nH]1	ZINC001085829611	1358796733	/nfs/dbraw/zinc/79/67/33/1358796733.db2.gz	CELFIEAKSNBTFT-CQSZACIVSA-N	0	3	344.484	3.251	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1ccc(C(F)F)cc1F	ZINC001085892914	1358853192	/nfs/dbraw/zinc/85/31/92/1358853192.db2.gz	MOQLXNFFOCSSRX-CYBMUJFWSA-N	0	3	326.362	3.486	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc(C)nc1OCCC	ZINC001085900596	1358859217	/nfs/dbraw/zinc/85/92/17/1358859217.db2.gz	KOZAFIKUCURPMO-QGZVFWFLSA-N	0	3	345.487	3.291	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cccc(NC(C)=O)c1C	ZINC001085925976	1358884181	/nfs/dbraw/zinc/88/41/81/1358884181.db2.gz	KPUKSBOLTRUMLQ-QGZVFWFLSA-N	0	3	343.471	3.066	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1c(F)ccc(OC)c1F	ZINC001085934572	1358889281	/nfs/dbraw/zinc/88/92/81/1358889281.db2.gz	FXITWCQBJLQZIG-CYBMUJFWSA-N	0	3	338.398	3.086	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NC[C@H]1C[C@@H](NCC(=C)Cl)C1	ZINC001086124415	1359003365	/nfs/dbraw/zinc/00/33/65/1359003365.db2.gz	QIXPZQQYOJEZJN-GASCZTMLSA-N	0	3	334.847	3.102	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cccc([C@@H]3CCOC3)c2)C1	ZINC001086131080	1359005063	/nfs/dbraw/zinc/00/50/63/1359005063.db2.gz	GCHZQFPSSKMCHY-OLMNPRSZSA-N	0	3	348.874	3.041	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(Cl)c(C)c2)C1	ZINC001086186110	1359020325	/nfs/dbraw/zinc/02/03/25/1359020325.db2.gz	IAKQUOOSLRUKIO-XBXGTLAGSA-N	0	3	327.255	3.499	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2C[C@@H](N[C@@H](C)c3cnc(C)cn3)C2)CC1	ZINC001086187798	1359020913	/nfs/dbraw/zinc/02/09/13/1359020913.db2.gz	PQSVPNFGYXKLLH-XYJFISCASA-N	0	3	342.487	3.077	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(C)c(F)c2F)C1	ZINC001086205437	1359025831	/nfs/dbraw/zinc/02/58/31/1359025831.db2.gz	QIALWHVZERKILQ-TXEJJXNPSA-N	0	3	328.790	3.124	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccccc2OCC2CC2)C1	ZINC001086277922	1359051527	/nfs/dbraw/zinc/05/15/27/1359051527.db2.gz	ADJYMGRHCBZOAV-IYBDPMFKSA-N	0	3	348.874	3.326	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cccc3c2OCC3(C)C)C1	ZINC001086286994	1359055690	/nfs/dbraw/zinc/05/56/90/1359055690.db2.gz	FKJQDLJUTLETCU-OKILXGFUSA-N	0	3	348.874	3.207	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2nccc3ccsc32)C1	ZINC001086392333	1359085484	/nfs/dbraw/zinc/08/54/84/1359085484.db2.gz	IOLCNKFILBHWFL-AULYBMBSSA-N	0	3	335.860	3.147	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc3c(c2)[C@H](C)CO3)C1	ZINC001086454970	1359101981	/nfs/dbraw/zinc/10/19/81/1359101981.db2.gz	QJMMDJSYHZETJE-UXIGCNINSA-N	0	3	334.847	3.033	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)[C@@H]2CCC[C@H](C)C2)C1	ZINC001086462407	1359105758	/nfs/dbraw/zinc/10/57/58/1359105758.db2.gz	MSTFKFBRQCYLDE-MHEUCROKSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2C[C@H](NCc3c(C)onc3CC)C2)CC1	ZINC001086467485	1359108452	/nfs/dbraw/zinc/10/84/52/1359108452.db2.gz	GFXJPFXSLAYOJN-JCNLHEQBSA-N	0	3	345.487	3.276	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cccc3c2ccn3C)C1	ZINC001086505782	1359122789	/nfs/dbraw/zinc/12/27/89/1359122789.db2.gz	PEBSLQRCLXHEGV-HDJSIYSDSA-N	0	3	331.847	3.029	20	30		EGEDHN
N#Cc1cccc(CNC2(CNC(=O)C3CCC4(CC4)CC3)CC2)c1	ZINC001323493392	1387377851	/nfs/dbraw/zinc/37/78/51/1387377851.db2.gz	DUDXUQOIPLQHPU-UHFFFAOYSA-N	0	3	337.467	3.267	20	30		EGEDHN
CC[C@@]1(C)C[C@H]1C(=O)NC[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001086521140	1359128841	/nfs/dbraw/zinc/12/88/41/1359128841.db2.gz	POTZGHVHJQJRBF-VERUCKTNSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)C2CCC(C(F)F)CC2)C1	ZINC001086543903	1359138691	/nfs/dbraw/zinc/13/86/91/1359138691.db2.gz	RTAAWZIGEYNZAN-WUPBRDTRSA-N	0	3	334.838	3.295	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](CNCc2cc(F)ccc2C#N)[C@@H](C)C1	ZINC001184019602	1387382685	/nfs/dbraw/zinc/38/26/85/1387382685.db2.gz	LLCRZLAKDIAYKC-RDJZCZTQSA-N	0	3	343.446	3.238	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)[C@@H]2C[C@H]2C(C)(C)C)C1	ZINC001086598881	1359160005	/nfs/dbraw/zinc/16/00/05/1359160005.db2.gz	JKUGUFSQCJGHCE-IYWMVGAKSA-N	0	3	338.495	3.276	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2cc[nH]c2C(C)C)C1	ZINC001086605202	1359162394	/nfs/dbraw/zinc/16/23/94/1359162394.db2.gz	QKJKMFFFDYHLQY-VQTJNVASSA-N	0	3	349.478	3.359	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CN(CCCF)C[C@H]2c2ccccc2)C1	ZINC001086608080	1359163326	/nfs/dbraw/zinc/16/33/26/1359163326.db2.gz	MWRUIKWCYAOTHZ-ZWKOTPCHSA-N	0	3	330.447	3.287	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cc(C)ccc2OC)C1	ZINC001086749378	1359194243	/nfs/dbraw/zinc/19/42/43/1359194243.db2.gz	WWDJZIXOSKQHLU-LSDHHAIUSA-N	0	3	336.863	3.244	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccnc(C3CC3)c2)C1	ZINC001086747066	1359194327	/nfs/dbraw/zinc/19/43/27/1359194327.db2.gz	GDMNWGDHRIHNNY-XJKSGUPXSA-N	0	3	333.863	3.200	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)[C@H]2Cc3ccc(F)cc32)C1	ZINC001086787309	1359201629	/nfs/dbraw/zinc/20/16/29/1359201629.db2.gz	MJQQTLIWMYOYBQ-MJEQTWJJSA-N	0	3	336.838	3.092	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CC[C@@H](NCc3cnoc3C)C2)CC1	ZINC001086794821	1359203370	/nfs/dbraw/zinc/20/33/70/1359203370.db2.gz	MLJCTVOGIIHNKA-MAUKXSAKSA-N	0	3	331.460	3.104	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cccc3[nH]ccc32)C1	ZINC001086810490	1359206029	/nfs/dbraw/zinc/20/60/29/1359206029.db2.gz	SVBPKCNNJQXNKQ-UONOGXRCSA-N	0	3	331.847	3.409	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)[C@@H]2CCc3ccccc3C2)C1	ZINC001086815110	1359207192	/nfs/dbraw/zinc/20/71/92/1359207192.db2.gz	FCMICXWAIURDOQ-KFKAGJAMSA-N	0	3	346.902	3.419	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ncoc2C(C)(C)C)C1	ZINC001086849447	1359213182	/nfs/dbraw/zinc/21/31/82/1359213182.db2.gz	IOKXMIKBRHUBCF-QWHCGFSZSA-N	0	3	339.867	3.213	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc(C)sc3C)C2)CC1	ZINC001086931382	1359255250	/nfs/dbraw/zinc/25/52/50/1359255250.db2.gz	HARXICWLMSSHJP-CQSZACIVSA-N	0	3	330.497	3.315	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H](C)C(C)(F)F)C2)CC1	ZINC001086943061	1359264355	/nfs/dbraw/zinc/26/43/55/1359264355.db2.gz	IYSQCVYZVOVFGM-HUUCEWRRSA-N	0	3	326.431	3.004	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc4cc[nH]c4c3)C2)CC1	ZINC001086945896	1359266886	/nfs/dbraw/zinc/26/68/86/1359266886.db2.gz	LCWVPPWYLQDRHE-MRXNPFEDSA-N	0	3	335.451	3.118	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc4cc[nH]c4c3)C2)CC1	ZINC001086945895	1359267043	/nfs/dbraw/zinc/26/70/43/1359267043.db2.gz	LCWVPPWYLQDRHE-INIZCTEOSA-N	0	3	335.451	3.118	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H](C)c3ccc(C)s3)C2)CC1	ZINC001086953108	1359273037	/nfs/dbraw/zinc/27/30/37/1359273037.db2.gz	ZBTIYAMTRYCBPW-WBVHZDCISA-N	0	3	344.524	3.496	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H]3C[C@H]3c3ccccc3)C2)CC1	ZINC001086953762	1359274310	/nfs/dbraw/zinc/27/43/10/1359274310.db2.gz	RWMYOVSJCVQZLO-YSIASYRMSA-N	0	3	336.479	3.126	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@H](C)c3ccccc3C)C2)CC1	ZINC001086956809	1359277701	/nfs/dbraw/zinc/27/77/01/1359277701.db2.gz	XYWFBVFNVBVBJE-RBUKOAKNSA-N	0	3	338.495	3.435	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cnc(C(C)C)s3)C2)CC1	ZINC001086960806	1359280219	/nfs/dbraw/zinc/28/02/19/1359280219.db2.gz	GYWDDGZCUZMLIF-OAHLLOKOSA-N	0	3	345.512	3.216	20	30		EGEDHN
C[C@@H]1CCN(C(=O)CC2CC2)[C@H](CNCc2ccc(C#N)s2)C1	ZINC001087109196	1359288745	/nfs/dbraw/zinc/28/87/45/1359288745.db2.gz	BDVKKMAGRYTCMW-HIFRSBDPSA-N	0	3	331.485	3.137	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccc(C#N)cc1F	ZINC001087200565	1359319667	/nfs/dbraw/zinc/31/96/67/1359319667.db2.gz	DBCBIDFZMRLRRK-BODMPHMZSA-N	0	3	343.446	3.070	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccc(C#N)s1	ZINC001087215974	1359323450	/nfs/dbraw/zinc/32/34/50/1359323450.db2.gz	BESOMXQAJIELNP-ZXFNITATSA-N	0	3	345.512	3.383	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc(C)sc3C)C(C)(C)[C@H]21	ZINC001087293895	1359374317	/nfs/dbraw/zinc/37/43/17/1359374317.db2.gz	LMKKTYHPGJIUGS-PVAVHDDUSA-N	0	3	330.497	3.217	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccn4ccccc34)C(C)(C)[C@H]21	ZINC001087295564	1359376939	/nfs/dbraw/zinc/37/69/39/1359376939.db2.gz	KYURKNVBXAIXFW-HOJAQTOUSA-N	0	3	349.478	3.181	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc(C)c(F)c3)C(C)(C)[C@H]21	ZINC001087295593	1359377107	/nfs/dbraw/zinc/37/71/07/1359377107.db2.gz	LHOXQDXPXRCALC-NEWSRXKRSA-N	0	3	342.458	3.376	20	30		EGEDHN
C=CCN1CCC[C@@H]2[C@@H](NC(=O)c3ocnc3C(F)F)C(C)(C)[C@@H]21	ZINC001087303013	1359386044	/nfs/dbraw/zinc/38/60/44/1359386044.db2.gz	FGJUJAXYLIXYSV-LERXQTSPSA-N	0	3	339.386	3.017	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc4occc4s3)C(C)(C)[C@H]21	ZINC001087304950	1359389347	/nfs/dbraw/zinc/38/93/47/1359389347.db2.gz	KDFQHPNULSTICJ-JLZZUVOBSA-N	0	3	342.464	3.346	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(F)cc(Cl)c3)C(C)(C)[C@@H]21	ZINC001087305464	1359390411	/nfs/dbraw/zinc/39/04/11/1359390411.db2.gz	SUDDTYMQDYFOAM-BRWVUGGUSA-N	0	3	348.849	3.331	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)C3CCC(F)(F)CC3)C(C)(C)[C@@H]21	ZINC001087305596	1359391374	/nfs/dbraw/zinc/39/13/74/1359391374.db2.gz	VVJWIWSPSLLUIN-BZUAXINKSA-N	0	3	338.442	3.050	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc4c(c3)C=CCC4)C(C)(C)[C@H]21	ZINC001087307775	1359394587	/nfs/dbraw/zinc/39/45/87/1359394587.db2.gz	GQUCEMJOAMVZNQ-NJYVYQBISA-N	0	3	348.490	3.498	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)Cc3ccc(Cl)cc3)C(C)(C)[C@H]21	ZINC001087315541	1359405918	/nfs/dbraw/zinc/40/59/18/1359405918.db2.gz	DMVGKCMOVHSBLE-NEWSRXKRSA-N	0	3	344.886	3.121	20	30		EGEDHN
CC(=O)N[C@@](C)(C(=O)C(C#N)c1ncc(C(C)(C)C)s1)C(C)C	ZINC001344603683	1390802456	/nfs/dbraw/zinc/80/24/56/1390802456.db2.gz	KDFRSTVQZZFYNJ-SJKOYZFVSA-N	0	3	335.473	3.168	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc(C)c(C)s3)C(C)(C)[C@H]21	ZINC001087317424	1359409445	/nfs/dbraw/zinc/40/94/45/1359409445.db2.gz	HZUBMWQDNIIRTN-PVAVHDDUSA-N	0	3	330.497	3.217	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cccc(C4CC4)c3)C(C)(C)[C@H]21	ZINC001087319562	1359412395	/nfs/dbraw/zinc/41/23/95/1359412395.db2.gz	PSWIOQPISRJWOP-AABGKKOBSA-N	0	3	336.479	3.416	20	30		EGEDHN
O=C(CC1CC1)N1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1CC#Cc1ccccc1	ZINC001087328443	1359418070	/nfs/dbraw/zinc/41/80/70/1359418070.db2.gz	XGLVDCTUWSWOGH-KJJMTIBFSA-N	0	3	348.490	3.007	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)c2[nH]c(C)cc2C)C1	ZINC001087430666	1359462972	/nfs/dbraw/zinc/46/29/72/1359462972.db2.gz	ATKWSURTEBMZAV-WOJBJXKFSA-N	0	3	349.478	3.243	20	30		EGEDHN
C=CCCN1CC[C@H](c2cccc(F)c2)[C@H](NC(=O)[C@@H]2C[C@H]2C)C1	ZINC001087457190	1359475680	/nfs/dbraw/zinc/47/56/80/1359475680.db2.gz	MQQCJLVAYJMSQC-UTRMSSBJSA-N	0	3	330.447	3.332	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)C2CCCC2)CCN1Cc1ccc(C#N)cc1	ZINC001087484819	1359488389	/nfs/dbraw/zinc/48/83/89/1359488389.db2.gz	ZRMGDRSAKZBWEY-RBUKOAKNSA-N	0	3	325.456	3.218	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2c(F)ccc3ccncc32)[C@H]1CC	ZINC001087580318	1359539480	/nfs/dbraw/zinc/53/94/80/1359539480.db2.gz	ZWJAOYAVYUJIQQ-DLBZAZTESA-N	0	3	327.403	3.143	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2oc3c(cccc3F)c2C)[C@H]1CC	ZINC001087602336	1359550342	/nfs/dbraw/zinc/55/03/42/1359550342.db2.gz	KUSYJIBTWVDFEO-DLBZAZTESA-N	0	3	342.414	3.486	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(F)cc3cccnc32)[C@H]1CC	ZINC001087748018	1359625655	/nfs/dbraw/zinc/62/56/55/1359625655.db2.gz	KLPMHGKVABNTOP-DLBZAZTESA-N	0	3	327.403	3.143	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cccc(OC(C)C)n2)[C@H]1CC	ZINC001087778851	1359639033	/nfs/dbraw/zinc/63/90/33/1359639033.db2.gz	VNXOCZKPXVJAAP-DOTOQJQBSA-N	0	3	331.460	3.028	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)[C@@H]2Cc3cc(C)c(C)cc3O2)[C@H]1CC	ZINC001087835508	1359671444	/nfs/dbraw/zinc/67/14/44/1359671444.db2.gz	CVPFNDQJMRCUBP-NSHGMRRFSA-N	0	3	342.483	3.152	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CCN(Cc4cnc(C)s4)C[C@H]3C2)C1	ZINC001088098101	1359755674	/nfs/dbraw/zinc/75/56/74/1359755674.db2.gz	UYHJPHXWPHLPSN-CVEARBPZSA-N	0	3	345.512	3.088	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3cc(C(C)C)oc3C)C[C@@H]2C1	ZINC001088157640	1359776118	/nfs/dbraw/zinc/77/61/18/1359776118.db2.gz	YYULXIWXXYXADK-SJORKVTESA-N	0	3	328.456	3.129	20	30		EGEDHN
CC#CCN1CC[C@H](OCC2CCN(C(=O)C(C)(CC)CC)CC2)C1	ZINC001088241137	1359813002	/nfs/dbraw/zinc/81/30/02/1359813002.db2.gz	QHHLQURVGQJKGK-IBGZPJMESA-N	0	3	348.531	3.166	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2scnc2CC)C1	ZINC001088323923	1359830684	/nfs/dbraw/zinc/83/06/84/1359830684.db2.gz	CFYOTVPFVVAIBI-CYBMUJFWSA-N	0	3	341.908	3.432	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2cc(C3CC3)on2)C1	ZINC001088354943	1359838936	/nfs/dbraw/zinc/83/89/36/1359838936.db2.gz	JXIOWRRFIXBKQX-AWEZNQCLSA-N	0	3	337.851	3.279	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)[C@H]2Cc3ccccc32)C1	ZINC001088371527	1359853995	/nfs/dbraw/zinc/85/39/95/1359853995.db2.gz	JWTLHUBPUIJRLP-AEFFLSMTSA-N	0	3	332.875	3.440	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCCCN(C(=O)[C@@H]2C[C@H]2CC)C1	ZINC001088384982	1359866109	/nfs/dbraw/zinc/86/61/09/1359866109.db2.gz	UMPDWWQJLVYWIL-RBSFLKMASA-N	0	3	343.309	3.302	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)[C@H]2[C@H]3[C@@H]2[C@@H]2CC[C@H]3C2)C1	ZINC001088433275	1359901711	/nfs/dbraw/zinc/90/17/11/1359901711.db2.gz	RGEKDXVYRZLDCQ-RFSXOUPVSA-N	0	3	336.907	3.392	20	30		EGEDHN
C=CCCN1CC[C@H](NC(=O)c2cc(-c3ccccc3)no2)[C@H]1C	ZINC001088698265	1360014761	/nfs/dbraw/zinc/01/47/61/1360014761.db2.gz	LZRIXVYQEFADER-ZBFHGGJFSA-N	0	3	325.412	3.110	20	30		EGEDHN
C=CCCN1CC[C@H](NC(=O)c2sc(C)nc2CC(C)C)[C@H]1C	ZINC001088712385	1360018157	/nfs/dbraw/zinc/01/81/57/1360018157.db2.gz	HUHUUOMWNHWMON-HIFRSBDPSA-N	0	3	335.517	3.419	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cnc3c(F)cccc3c2)[C@H]1C	ZINC001088751614	1360030596	/nfs/dbraw/zinc/03/05/96/1360030596.db2.gz	WUZOZDWMKMOCBK-DYVFJYSZSA-N	0	3	327.403	3.143	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCN(CCOc3ccccc3)[C@@H]2C)CC1	ZINC001088835967	1360070508	/nfs/dbraw/zinc/07/05/08/1360070508.db2.gz	XVFCIPKBBFQIFT-XLIONFOSSA-N	0	3	342.483	3.391	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3cccc(N(C)C)c3)[C@@H]2C)C1	ZINC001088839806	1360073991	/nfs/dbraw/zinc/07/39/91/1360073991.db2.gz	FMPSDJLFXGTHMX-APWZRJJASA-N	0	3	341.499	3.188	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)[C@@H]2C[C@H]2c2c(F)cccc2F)[C@H]1C	ZINC001088845423	1360079167	/nfs/dbraw/zinc/07/91/67/1360079167.db2.gz	UGGPFTQTLNNURA-WBOJAVRRSA-N	0	3	334.410	3.223	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccccc2OC2CCC2)[C@H]1C	ZINC001088846641	1360079585	/nfs/dbraw/zinc/07/95/85/1360079585.db2.gz	YROUDLKVEIPHJB-QAPCUYQASA-N	0	3	328.456	3.387	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CCN(Cc3ccc(C)cc3C)[C@@H]2C)c1	ZINC001088847005	1360079789	/nfs/dbraw/zinc/07/97/89/1360079789.db2.gz	SDGUYFURSLOGMX-UTKZUKDTSA-N	0	3	347.462	3.073	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3ccccc3CC)[C@@H]2C)cn1	ZINC001088990652	1360126616	/nfs/dbraw/zinc/12/66/16/1360126616.db2.gz	JAFHSXVCBAZSAZ-IERDGZPVSA-N	0	3	347.462	3.018	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2cc3c(s2)CCCCC3)[C@H]1C	ZINC001089019906	1360138608	/nfs/dbraw/zinc/13/86/08/1360138608.db2.gz	JHDWWBFUGYRLOD-ZBFHGGJFSA-N	0	3	330.497	3.233	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccc(N(C)CCC)cc2)[C@H]1C	ZINC001089077397	1360162002	/nfs/dbraw/zinc/16/20/02/1360162002.db2.gz	FJRGTXZWOFZJLH-APWZRJJASA-N	0	3	329.488	3.302	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCCN1C(=O)c1ccc[nH]1	ZINC001089117497	1360180438	/nfs/dbraw/zinc/18/04/38/1360180438.db2.gz	IJPQPYDXHGUREV-SFHVURJKSA-N	0	3	336.439	3.013	20	30		EGEDHN
Cc1ccc(CN(C)C[C@@H]2CCCCN2C(=O)[C@@H](C)C#N)cc1F	ZINC001089139747	1360196812	/nfs/dbraw/zinc/19/68/12/1360196812.db2.gz	LUZPZVSKJZXKQQ-RDJZCZTQSA-N	0	3	331.435	3.107	20	30		EGEDHN
CC1CC(C(=O)N2CCCC[C@H]2CN(C)Cc2cccc(C#N)c2)C1	ZINC001089154393	1360209484	/nfs/dbraw/zinc/20/94/84/1360209484.db2.gz	HNAQXWSDYZSENC-GQOXECLESA-N	0	3	339.483	3.417	20	30		EGEDHN
Cc1csc(CNC[C@@H]2CCN(C(=O)C#CC(C)(C)C)C[C@H]2C)n1	ZINC001184385700	1387445484	/nfs/dbraw/zinc/44/54/84/1387445484.db2.gz	DHOMKEYVSDXRMX-ZBFHGGJFSA-N	0	3	347.528	3.075	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2nc(C(C)C)oc2C)CC(C)(C)C1	ZINC001089383855	1360385163	/nfs/dbraw/zinc/38/51/63/1360385163.db2.gz	KPWIEBUHMILYMT-MRXNPFEDSA-N	0	3	345.487	3.350	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc3c(c2)[C@H](C)CO3)CC(C)(C)C1	ZINC001089468751	1360452615	/nfs/dbraw/zinc/45/26/15/1360452615.db2.gz	CQTUVNVSQCZUGW-WBVHZDCISA-N	0	3	340.467	3.036	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc[nH]c2C2CCC2)CC(C)(C)C1	ZINC001089493070	1360470287	/nfs/dbraw/zinc/47/02/87/1360470287.db2.gz	SONDIRWOWXQQHY-MRXNPFEDSA-N	0	3	327.472	3.136	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(C(C)C)cn2)CC(C)(C)C1	ZINC001089492626	1360470367	/nfs/dbraw/zinc/47/03/67/1360470367.db2.gz	LSHLTLFQUJMSRN-KRWDZBQOSA-N	0	3	327.472	3.059	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2F)CC(C)(C)C1	ZINC001089511222	1360482575	/nfs/dbraw/zinc/48/25/75/1360482575.db2.gz	OJZCCFIGBNHXHY-RYQLBKOJSA-N	0	3	342.458	3.169	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3c(s2)CCC3)CC(C)(C)C1	ZINC001089556992	1360506503	/nfs/dbraw/zinc/50/65/03/1360506503.db2.gz	XCWVZOBKXRRDIV-INIZCTEOSA-N	0	3	344.524	3.481	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@@H](C)c2ccc(F)cc2F)CC(C)(C)C1	ZINC001089560943	1360508991	/nfs/dbraw/zinc/50/89/91/1360508991.db2.gz	KPMQYVYLQKNJLU-HOCLYGCPSA-N	0	3	348.437	3.308	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cn2c(n1)CCCC2	ZINC001089648345	1360560674	/nfs/dbraw/zinc/56/06/74/1360560674.db2.gz	JPKPLWBKWNCIEO-INIZCTEOSA-N	0	3	344.503	3.016	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cccc2c[nH]nc21	ZINC001089681129	1360587345	/nfs/dbraw/zinc/58/73/45/1360587345.db2.gz	ZSDCKRDTKDOBHE-INIZCTEOSA-N	0	3	340.471	3.359	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)NC[C@@H]1CCC(C)(C)CN1CC=C(C)C	ZINC001089700142	1360604287	/nfs/dbraw/zinc/60/42/87/1360604287.db2.gz	ZTDGSUMTKXNRGS-KSZLIROESA-N	0	3	334.504	3.151	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H]1[C@@H]2Cc3ccccc3[C@@H]21	ZINC001089707560	1360610781	/nfs/dbraw/zinc/61/07/81/1360610781.db2.gz	NEKABMNDQMBBFW-RSPOEFSDSA-N	0	3	338.495	3.365	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1coc(C2CCC2)n1	ZINC001089720969	1360623119	/nfs/dbraw/zinc/62/31/19/1360623119.db2.gz	BDXCZXLVBNUSLK-INIZCTEOSA-N	0	3	343.471	3.186	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccoc1CCC	ZINC001089722115	1360625251	/nfs/dbraw/zinc/62/52/51/1360625251.db2.gz	QWYGIRKMWDUIJW-MRXNPFEDSA-N	0	3	330.472	3.476	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1cc(C)oc1C	ZINC001089769317	1360657303	/nfs/dbraw/zinc/65/73/03/1360657303.db2.gz	KNQINJIPUUBFLR-OWLYRPNTSA-N	0	3	348.874	3.431	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1CC2(CC2)C1	ZINC001089865759	1360709140	/nfs/dbraw/zinc/70/91/40/1360709140.db2.gz	TXMJLDJIRZFQBR-SVGFKBNWSA-N	0	3	334.891	3.098	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)[C@@]2(C)CC=CCC2)CC2(CCOCC2)C1	ZINC001089938762	1360754240	/nfs/dbraw/zinc/75/42/40/1360754240.db2.gz	HPPCUJOGWIFNEG-QUCCMNQESA-N	0	3	346.515	3.296	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)[C@@H]2CCC=CCCC2)CC2(CCOCC2)C1	ZINC001089945011	1360757594	/nfs/dbraw/zinc/75/75/94/1360757594.db2.gz	JFPVHXXWWNMWJI-RTBURBONSA-N	0	3	346.515	3.296	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](CNCc2ncc(C)s2)[C@@H](C)C1	ZINC001184497997	1387472860	/nfs/dbraw/zinc/47/28/60/1387472860.db2.gz	OHOAQVKVEJVILW-HOCLYGCPSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CN(CC=C(C)C)CC3(CCOCC3)C2)C1	ZINC001089956217	1360764887	/nfs/dbraw/zinc/76/48/87/1360764887.db2.gz	JGMCTCLDYDAIRV-GOSISDBHSA-N	0	3	346.515	3.296	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)[C@H](C)C2CCCC2)CC2(CCOCC2)C1	ZINC001089965111	1360770209	/nfs/dbraw/zinc/77/02/09/1360770209.db2.gz	VCXUXBRSJVLDIP-IEBWSBKVSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](CNCc2cc(C3CC3)no2)[C@@H](C)C1	ZINC001184498810	1387473966	/nfs/dbraw/zinc/47/39/66/1387473966.db2.gz	VWMYFEKKWAEFTL-DOTOQJQBSA-N	0	3	345.487	3.483	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)[C@H]2CC[C@H](C)CC2)C1	ZINC001091333313	1361048043	/nfs/dbraw/zinc/04/80/43/1361048043.db2.gz	LXQIIGUXJHRJSX-XSSWMBKUSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc(Cl)cn2CC)C1	ZINC001091369054	1361064197	/nfs/dbraw/zinc/06/41/97/1361064197.db2.gz	NQTDAPFYDTUWEZ-UHFFFAOYSA-N	0	3	330.259	3.012	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H]2Cc3c2cccc3Cl)C1	ZINC001091386022	1361073998	/nfs/dbraw/zinc/07/39/98/1361073998.db2.gz	XWOHLCJQJSXKJW-KOHJWAIASA-N	0	3	339.266	3.217	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CN(CCC(F)(F)F)C[C@@]3(C)C2)C1	ZINC001091996458	1361269692	/nfs/dbraw/zinc/26/96/92/1361269692.db2.gz	WOQBJQDBPQKLOA-CJNGLKHVSA-N	0	3	330.394	3.075	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccccc3C3(C)CC3)C[C@]2(C)C1	ZINC001092007226	1361273082	/nfs/dbraw/zinc/27/30/82/1361273082.db2.gz	VIVNYGCBNHHOSO-VGSWGCGISA-N	0	3	336.479	3.155	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3cccc(C4CCCC4)c3)C[C@]2(C)C1	ZINC001092199568	1361321217	/nfs/dbraw/zinc/32/12/17/1361321217.db2.gz	LRFQQYXCHJPDEA-IRLDBZIGSA-N	0	3	336.479	3.371	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C(C)(C)c3ccc(C)cc3)C[C@]2(C)C1	ZINC001092210436	1361323958	/nfs/dbraw/zinc/32/39/58/1361323958.db2.gz	NQHASRLZKQASJS-KNQAVFIVSA-N	0	3	338.495	3.076	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3ccc(-c4cccs4)o3)C[C@]2(C)C1	ZINC001092241830	1361337996	/nfs/dbraw/zinc/33/79/96/1361337996.db2.gz	BFYNJLQCXCBIHD-KUHUBIRLSA-N	0	3	340.448	3.035	20	30		EGEDHN
Cc1occc1C(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001092453697	1361387980	/nfs/dbraw/zinc/38/79/80/1361387980.db2.gz	WGNZNLFSNUEZHV-TZMCWYRMSA-N	0	3	343.452	3.019	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)c2ccccc2C)CC1	ZINC001093353780	1361568247	/nfs/dbraw/zinc/56/82/47/1361568247.db2.gz	YBZOKBQQBASXEZ-HXUWFJFHSA-N	0	3	336.479	3.335	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C(C)(C)C(=C)C)CC1	ZINC001093374449	1361584472	/nfs/dbraw/zinc/58/44/72/1361584472.db2.gz	JBLLHQJGWYBFBT-SFHVURJKSA-N	0	3	328.500	3.315	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)[C@@H]2C[C@H]2CCC)CC1	ZINC001093377163	1361587531	/nfs/dbraw/zinc/58/75/31/1361587531.db2.gz	GSJVWTWCWXLJBT-GUDVDZBRSA-N	0	3	328.500	3.149	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC001093383550	1361595582	/nfs/dbraw/zinc/59/55/82/1361595582.db2.gz	NFFPGYXZSUAMBN-FQEVSTJZSA-N	0	3	336.479	3.335	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3ccc(C)c(Cl)c3F)CCC[C@@H]12	ZINC001094475432	1361820087	/nfs/dbraw/zinc/82/00/87/1361820087.db2.gz	ATHDNLGFFLPSTO-DNVCBOLYSA-N	0	3	348.849	3.395	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cc(F)ccc3Cl)CCC[C@@H]12	ZINC001094523160	1361842619	/nfs/dbraw/zinc/84/26/19/1361842619.db2.gz	SIMIZCBDSGWQJS-SJLPKXTDSA-N	0	3	334.822	3.087	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3coc4ccc(F)cc34)CCC[C@@H]12	ZINC001094566992	1361863935	/nfs/dbraw/zinc/86/39/35/1361863935.db2.gz	CBYNWHIJFLTMRE-UYAOXDASSA-N	0	3	340.398	3.180	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3ccc(CC(C)C)cc3)CCC[C@@H]12	ZINC001094575646	1361867148	/nfs/dbraw/zinc/86/71/48/1361867148.db2.gz	YOLPELLIENUGSF-IFMALSPDSA-N	0	3	338.495	3.493	20	30		EGEDHN
Cc1ccc(CN2[C@@H]3CC[C@H]2[C@@H](NC(=O)c2cc(C#N)c[nH]2)C3)cc1C	ZINC001095283722	1362083137	/nfs/dbraw/zinc/08/31/37/1362083137.db2.gz	VFUFUMKBYNUPDN-HBFSDRIKSA-N	0	3	348.450	3.039	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](CNCc2cc(C)no2)[C@@H](C)C1	ZINC001184935451	1387565274	/nfs/dbraw/zinc/56/52/74/1387565274.db2.gz	XAIKUHIPGDSCQC-WMZOPIPTSA-N	0	3	345.487	3.141	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(C)c(OCC)c1)C2	ZINC001096097626	1362381603	/nfs/dbraw/zinc/38/16/03/1362381603.db2.gz	HRDXEZQCOKPMMJ-SQNIBIBYSA-N	0	3	328.456	3.305	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc([C@H](C)CC)no1)C2	ZINC001096124873	1362395637	/nfs/dbraw/zinc/39/56/37/1362395637.db2.gz	BWYUMDHAQMPRPK-JHNDHUHGSA-N	0	3	331.460	3.489	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1csc(C(F)(F)F)n1)C2	ZINC001096285199	1362455204	/nfs/dbraw/zinc/45/52/04/1362455204.db2.gz	YJMXAWJLXNMRFA-SCVCMEIPSA-N	0	3	345.390	3.073	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(Cl)cc1Cl)C2	ZINC001096411562	1362496886	/nfs/dbraw/zinc/49/68/86/1362496886.db2.gz	YACFUTDXELTGLE-KCXAZCMYSA-N	0	3	337.250	3.352	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(OCC)c(OC)c1)C2	ZINC001096520044	1362548548	/nfs/dbraw/zinc/54/85/48/1362548548.db2.gz	FSYAFONECLOABZ-IKGGRYGDSA-N	0	3	344.455	3.005	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](C)c1ccc(F)c(F)c1)C2	ZINC001096580207	1362586477	/nfs/dbraw/zinc/58/64/77/1362586477.db2.gz	KHYKEEBZSDGFJM-NMVRNDPTSA-N	0	3	334.410	3.366	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](N[C@H]2CCc3c2cc(F)cc3F)C1	ZINC001185035093	1387592905	/nfs/dbraw/zinc/59/29/05/1387592905.db2.gz	LESXSVLLAWGMTG-BEFAXECRSA-N	0	3	346.421	3.336	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@@H](NCc2ccc(OC)c(F)c2)C1	ZINC001185050082	1387597970	/nfs/dbraw/zinc/59/79/70/1387597970.db2.gz	PPZOGYZXDONZGU-GDBMZVCRSA-N	0	3	334.435	3.127	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cccc3ccc(C)nc31)C2	ZINC001097300581	1362919834	/nfs/dbraw/zinc/91/98/34/1362919834.db2.gz	WYSYXFXYWHIMLU-QRQLOZEOSA-N	0	3	335.451	3.454	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc(F)cc3ccoc31)C2	ZINC001097386262	1362966365	/nfs/dbraw/zinc/96/63/65/1362966365.db2.gz	XBZNHLZYWMQCQL-OIISXLGYSA-N	0	3	328.387	3.483	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1occc1-c1ccccc1)C2	ZINC001097485092	1363015189	/nfs/dbraw/zinc/01/51/89/1363015189.db2.gz	WUEBWDJLVWQTBF-QRQLOZEOSA-N	0	3	334.419	3.305	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1cccc3cccnc31)C2	ZINC001097610791	1363074237	/nfs/dbraw/zinc/07/42/37/1363074237.db2.gz	GIALRPDPHLYTAN-QRVBRYPASA-N	0	3	335.451	3.075	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@]1(C)CCCc3ccccc31)C2	ZINC001098041736	1363205378	/nfs/dbraw/zinc/20/53/78/1363205378.db2.gz	DLIPOQMPISZCPX-RPUPUWCGSA-N	0	3	336.479	3.025	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C(C)(C)c1ccc(CC)cc1)C2	ZINC001098177816	1363245108	/nfs/dbraw/zinc/24/51/08/1363245108.db2.gz	NJYDKNXVJBEFNX-AQNXPRMDSA-N	0	3	338.495	3.271	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](CNCc3ocnc3C)[C@H](C)C2)CCC1	ZINC001185095614	1387617632	/nfs/dbraw/zinc/61/76/32/1387617632.db2.gz	QZASOGZGSCRFES-NVXWUHKLSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)C[C@H](NC(=O)C1CC1)c1ccccc1O2	ZINC001098542112	1363364682	/nfs/dbraw/zinc/36/46/82/1363364682.db2.gz	VZVNBIVXRXPFJV-FXAWDEMLSA-N	0	3	326.440	3.057	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@H]1CC=CCC1)C[C@H](C)O2	ZINC001098623772	1363404170	/nfs/dbraw/zinc/40/41/70/1363404170.db2.gz	QJXORSXYZWIEJC-ROUUACIJSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1oc(CC)cc1C)C[C@H](C)O2	ZINC001098655390	1363420489	/nfs/dbraw/zinc/42/04/89/1363420489.db2.gz	JYRQIZORVMXKFP-INIZCTEOSA-N	0	3	346.471	3.032	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2sc(C3CC3)nc2C)C1	ZINC001098833841	1363486676	/nfs/dbraw/zinc/48/66/76/1363486676.db2.gz	VFWXDHJSNPDUMS-KXBFYZLASA-N	0	3	345.512	3.489	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)C1CCCCC1	ZINC001098854875	1363493531	/nfs/dbraw/zinc/49/35/31/1363493531.db2.gz	CLRLRXDTVDPDCO-SFHVURJKSA-N	0	3	336.520	3.376	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)Cc2ccc(C)c(Cl)c2)C1	ZINC001098898327	1363510018	/nfs/dbraw/zinc/51/00/18/1363510018.db2.gz	UTYPBENFPPPKRE-PXNSSMCTSA-N	0	3	344.886	3.185	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cnc3ccccc3c2C)C1	ZINC001098951079	1363537376	/nfs/dbraw/zinc/53/73/76/1363537376.db2.gz	WYVHJVCLPVGVDY-KKSFZXQISA-N	0	3	335.451	3.314	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NC[C@H]1CCC(C)(C)CN1CCOCC	ZINC001099093346	1363618370	/nfs/dbraw/zinc/61/83/70/1363618370.db2.gz	OSLQSZKSHSGIFP-OAHLLOKOSA-N	0	3	344.927	3.408	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@H]1CCC(C)(C)CN1CCn1cccn1	ZINC001099193453	1363684745	/nfs/dbraw/zinc/68/47/45/1363684745.db2.gz	BWCJGJKTESSWKE-ZWKOTPCHSA-N	0	3	346.519	3.092	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)Cc1cc(F)ccc1F	ZINC001099199738	1363688563	/nfs/dbraw/zinc/68/85/63/1363688563.db2.gz	QECXLFLUTSTLMW-INIZCTEOSA-N	0	3	336.426	3.300	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)C1(CCC)CC1	ZINC001099230811	1363703705	/nfs/dbraw/zinc/70/37/05/1363703705.db2.gz	XGWIKWXPWNFULK-KRWDZBQOSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2ccoc2CC)C[C@H]1C(F)(F)F	ZINC001099245449	1363711288	/nfs/dbraw/zinc/71/12/88/1363711288.db2.gz	DHBHBUWAINNOCH-CHWSQXEVSA-N	0	3	330.350	3.011	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)C23CCC(CC2)C3)C[C@H]1C(F)(F)F	ZINC001099269574	1363724371	/nfs/dbraw/zinc/72/43/71/1363724371.db2.gz	OKHNLRCFGORRHP-MYMJJRTCSA-N	0	3	330.394	3.122	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@@H]2CCCC23CC3)C[C@H]1C(F)(F)F	ZINC001099269850	1363724790	/nfs/dbraw/zinc/72/47/90/1363724790.db2.gz	SXKOLDIRULAYMX-BFHYXJOUSA-N	0	3	330.394	3.122	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2occc2C(C)C)C[C@H]1C(F)(F)F	ZINC001099295920	1363736662	/nfs/dbraw/zinc/73/66/62/1363736662.db2.gz	ZNLZQJFRHSIVEU-CHWSQXEVSA-N	0	3	330.350	3.182	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)Cc1cc(C)ccc1F	ZINC001099309907	1363742497	/nfs/dbraw/zinc/74/24/97/1363742497.db2.gz	GVCMAYSAMRUMBR-QGZVFWFLSA-N	0	3	332.463	3.469	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2cc(C)ccc2F)C[C@H]1C(F)(F)F	ZINC001099312565	1363745017	/nfs/dbraw/zinc/74/50/17/1363745017.db2.gz	ZRCIHYHRVJPZNG-UKRRQHHQSA-N	0	3	344.352	3.303	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2csc(C)c2)C[C@H]1C(F)(F)F	ZINC001099322265	1363749939	/nfs/dbraw/zinc/74/99/39/1363749939.db2.gz	NLALZSRZHDHWAG-CHWSQXEVSA-N	0	3	332.391	3.225	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)COc1ccccc1CC	ZINC001099328384	1363752870	/nfs/dbraw/zinc/75/28/70/1363752870.db2.gz	CCXBMUAAGLKKDQ-SFHVURJKSA-N	0	3	344.499	3.421	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)CCc1c(C)noc1C	ZINC001099329807	1363753755	/nfs/dbraw/zinc/75/37/55/1363753755.db2.gz	UTRDLMAOHCAURH-MRXNPFEDSA-N	0	3	333.476	3.017	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)COc1c(C)cccc1C	ZINC001099335324	1363756963	/nfs/dbraw/zinc/75/69/63/1363756963.db2.gz	VMRYWYUQVGRNFL-SFHVURJKSA-N	0	3	344.499	3.475	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)C[C@H](C)c2ccccc2)C[C@H]1C(F)(F)F	ZINC001099339866	1363760008	/nfs/dbraw/zinc/76/00/08/1363760008.db2.gz	HPEQQOYDYWZBMX-NUEKZKHPSA-N	0	3	340.389	3.345	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)CCOc1ccccc1	ZINC001099339937	1363760019	/nfs/dbraw/zinc/76/00/19/1363760019.db2.gz	MOSOVTAZHNBJBR-QGZVFWFLSA-N	0	3	330.472	3.248	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H](C)n1c(C)ccc1C	ZINC001099353588	1363768161	/nfs/dbraw/zinc/76/81/61/1363768161.db2.gz	COHZQAFKWMAERQ-ZWKOTPCHSA-N	0	3	331.504	3.459	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)CSC(C)C	ZINC001099425344	1363794881	/nfs/dbraw/zinc/79/48/81/1363794881.db2.gz	QOGMPPZUUACJEB-JONQDZQNSA-N	0	3	342.936	3.049	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)CCC1(C)CC1	ZINC001099544549	1363841178	/nfs/dbraw/zinc/84/11/78/1363841178.db2.gz	QPTWHTGRQDNLPO-HZMVEIRTSA-N	0	3	336.907	3.488	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C[C@@H](C)C(C)C)CC2(CCOCC2)C1	ZINC001099569417	1363854583	/nfs/dbraw/zinc/85/45/83/1363854583.db2.gz	ANPILADMUSVQCQ-MSOLQXFVSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CN(CC(=C)C)CC2(CCOCC2)C1	ZINC001099588905	1363870173	/nfs/dbraw/zinc/87/01/73/1363870173.db2.gz	LTQHQXVJSTVQJL-MSOLQXFVSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CN(CC(=C)C)CC2(CCOCC2)C1	ZINC001099588907	1363870281	/nfs/dbraw/zinc/87/02/81/1363870281.db2.gz	LTQHQXVJSTVQJL-ROUUACIJSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CCN(Cc2ccccc2C(C)C)C[C@@H]1O	ZINC001099858427	1363966092	/nfs/dbraw/zinc/96/60/92/1363966092.db2.gz	LNMXASDYXRLEQE-UXHICEINSA-N	0	3	344.499	3.218	20	30		EGEDHN
C=CC1(CC(=O)N[C@H]2CCN(CC=C(C)C)C[C@H]2O)CCCCC1	ZINC001100034527	1364003143	/nfs/dbraw/zinc/00/31/43/1364003143.db2.gz	RVRDJAUSICOCNF-ZWKOTPCHSA-N	0	3	334.504	3.031	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)CCCCCCCCCC)[C@H](O)C1	ZINC001100082362	1364011469	/nfs/dbraw/zinc/01/14/69/1364011469.db2.gz	AQOWHNMRKCQLAF-RBUKOAKNSA-N	0	3	336.520	3.092	20	30		EGEDHN
CCCCCCCCCC(=O)N[C@@H]1CCN(CCCF)C[C@H]1O	ZINC001100087223	1364013524	/nfs/dbraw/zinc/01/35/24/1364013524.db2.gz	IATSSOBAFQISOC-IAGOWNOFSA-N	0	3	330.488	3.038	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](CNCc2cnc(C)o2)[C@H](C)C1	ZINC001185226508	1387656573	/nfs/dbraw/zinc/65/65/73/1387656573.db2.gz	PPLKTIDOJUUEBO-ZBFHGGJFSA-N	0	3	333.476	3.160	20	30		EGEDHN
CC[C@@H](C)CC(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1	ZINC001100282395	1364066492	/nfs/dbraw/zinc/06/64/92/1364066492.db2.gz	KHZWDUVNRHAWGD-BZOOQXSSSA-N	0	3	331.435	3.118	20	30		EGEDHN
CC/C(C)=C\C(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1	ZINC001100307674	1364076236	/nfs/dbraw/zinc/07/62/36/1364076236.db2.gz	MRIPKFXTOSJQGW-MLPAPPSSSA-N	0	3	329.419	3.038	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCC1CC(NCc2cccc(Cl)n2)C1	ZINC001100358113	1364089825	/nfs/dbraw/zinc/08/98/25/1364089825.db2.gz	HEKSHFKLVVMZTR-UHFFFAOYSA-N	0	3	347.890	3.488	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)Cc2c(C)cccc2Cl)C1	ZINC001100480500	1364129771	/nfs/dbraw/zinc/12/97/71/1364129771.db2.gz	WBQRUQJDSJBMPH-UHFFFAOYSA-N	0	3	341.282	3.428	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C[C@@H]2C[C@H]2Cc2ccccc2)C1	ZINC001100527854	1364148671	/nfs/dbraw/zinc/14/86/71/1364148671.db2.gz	WNKWBAHLMVYUKZ-IAFLDTSXSA-N	0	3	346.902	3.492	20	30		EGEDHN
CC1(C(=O)NCC2CC(NCC#Cc3ccccc3Cl)C2)CCC1	ZINC001100577185	1364171141	/nfs/dbraw/zinc/17/11/41/1364171141.db2.gz	MZEDRJDUVXOPBJ-UHFFFAOYSA-N	0	3	344.886	3.366	20	30		EGEDHN
C[C@@]1(C(=O)NCC2CC(NCC#Cc3ccc(F)cc3)C2)C=CCC1	ZINC001100583641	1364174839	/nfs/dbraw/zinc/17/48/39/1364174839.db2.gz	XYYCDEDAASOFOX-CNBHCMJISA-N	0	3	340.442	3.018	20	30		EGEDHN
N#Cc1ccc(F)c(CNC2CC(CNC(=O)CCCC3CC3)C2)c1	ZINC001100593842	1364178886	/nfs/dbraw/zinc/17/88/86/1364178886.db2.gz	ZWIGOSAYRGXQKQ-UHFFFAOYSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC1CC(NCc2oc(CC)nc2C)C1	ZINC001100644776	1364202051	/nfs/dbraw/zinc/20/20/51/1364202051.db2.gz	HOPJMJYEUSDARL-JFIBYHEFSA-N	0	3	333.476	3.132	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1	ZINC001100644703	1364202214	/nfs/dbraw/zinc/20/22/14/1364202214.db2.gz	CXEAUABCSDXPEQ-MKJPBZQASA-N	0	3	343.446	3.284	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1	ZINC001100644960	1364202742	/nfs/dbraw/zinc/20/27/42/1364202742.db2.gz	OHBPSXAFLNRPOZ-LAGYLCCXSA-N	0	3	343.446	3.284	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC1CC(NCc2cnc(Cl)s2)C1	ZINC001100645047	1364202843	/nfs/dbraw/zinc/20/28/43/1364202843.db2.gz	RLGGQRMBMTTYBR-ZEPSKSRBSA-N	0	3	341.908	3.383	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@H](C)Cc2cccs2)C1	ZINC001100716746	1364233493	/nfs/dbraw/zinc/23/34/93/1364233493.db2.gz	OSKAAEHLDVSUTC-LMWSTFAQSA-N	0	3	326.893	3.164	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@H](C)c2ccc(F)cc2F)C1	ZINC001101006569	1364368569	/nfs/dbraw/zinc/36/85/69/1364368569.db2.gz	PKOQHGHVHFYDCP-LKSINWNRSA-N	0	3	342.817	3.305	20	30		EGEDHN
C[C@H](CC(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1)C1CC1	ZINC001101042924	1364388090	/nfs/dbraw/zinc/38/80/90/1364388090.db2.gz	SPBHOJLKJPNNKC-MJJDPTRDSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(C)CN1CC[C@@H](Oc2ccnc(CNC(=O)/C=C(\C)CC)c2)C1	ZINC001101093660	1364410322	/nfs/dbraw/zinc/41/03/22/1364410322.db2.gz	GXPYWFKBEYJAIX-OUQXZNHLSA-N	0	3	343.471	3.083	20	30		EGEDHN
C=C(C)CN1CC[C@@H](Oc2ccnc(CNC(=O)C[C@H](C)CC)c2)C1	ZINC001101093829	1364410336	/nfs/dbraw/zinc/41/03/36/1364410336.db2.gz	KWMNPTYQMSUCNV-VQIMIIECSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=CCN1CC[C@@H](Oc2ccnc(CNC(=O)CC[C@@H](C)CC)c2)C1	ZINC001101097679	1364413393	/nfs/dbraw/zinc/41/33/93/1364413393.db2.gz	XXEHWEYOSHNOAL-QFBILLFUSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=CCCC(=O)N1C[C@H]2CN(Cc3ccc(C)c(F)c3)C[C@@]2(C)C1	ZINC001101167888	1364443144	/nfs/dbraw/zinc/44/31/44/1364443144.db2.gz	ZNBHSEYLVSUHDL-XLIONFOSSA-N	0	3	330.447	3.381	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@H]2CN([C@H](C)c3cccc(F)c3)C[C@@]2(C)C1	ZINC001101230916	1364476597	/nfs/dbraw/zinc/47/65/97/1364476597.db2.gz	OZCUAYYVWWBWJM-BLIXFSHQSA-N	0	3	342.458	3.326	20	30		EGEDHN
CC(C)CCC(=O)N[C@]1(C)CCN(Cc2ccc(OCC#N)cc2)C1	ZINC001324572823	1387682064	/nfs/dbraw/zinc/68/20/64/1387682064.db2.gz	JXKGWKVPJRDNOW-HXUWFJFHSA-N	0	3	343.471	3.106	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@H]2CN(Cc3c(C)noc3C)C[C@@]2(C)C1	ZINC001101332057	1364512561	/nfs/dbraw/zinc/51/25/61/1364512561.db2.gz	RDVFOLNCZGGZDB-NQYLQCIDSA-N	0	3	345.487	3.174	20	30		EGEDHN
C=CCCCC(=O)N1C[C@H]2CN(Cc3ccc(F)cc3)C[C@@]2(C)C1	ZINC001101346811	1364519910	/nfs/dbraw/zinc/51/99/10/1364519910.db2.gz	IQIRWIVIWRRZCD-XLIONFOSSA-N	0	3	330.447	3.462	20	30		EGEDHN
C=CCCC1(C(=O)N2C[C@H]3CN(Cc4ccccn4)C[C@@]3(C)C2)CC1	ZINC001101354301	1364523948	/nfs/dbraw/zinc/52/39/48/1364523948.db2.gz	ZSNOLRXMSVSWLL-XLIONFOSSA-N	0	3	339.483	3.108	20	30		EGEDHN
C=CCCC1(C(=O)N2C[C@H]3CN(CCC(F)(F)F)C[C@@]3(C)C2)CC1	ZINC001101354309	1364524409	/nfs/dbraw/zinc/52/44/09/1364524409.db2.gz	ZXNDKBMBDKVJKZ-ZBFHGGJFSA-N	0	3	344.421	3.466	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@H]2CN(Cc3c(C)noc3C)C[C@@]2(C)C1	ZINC001101378014	1364534913	/nfs/dbraw/zinc/53/49/13/1364534913.db2.gz	NULDGYKANUTWPE-UZLBHIALSA-N	0	3	345.487	3.174	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@H]2CN(Cc3cnccc3C)C[C@@]2(C)C1	ZINC001101378192	1364535384	/nfs/dbraw/zinc/53/53/84/1364535384.db2.gz	RUZIIMJWNZWSJV-NQIIRXRSSA-N	0	3	341.499	3.273	20	30		EGEDHN
CCCN(CCN1CCCCC1)C(=O)Nc1ccc(OCC#N)cc1	ZINC001324584126	1387687491	/nfs/dbraw/zinc/68/74/91/1387687491.db2.gz	DGWVMFJKLBKTJB-UHFFFAOYSA-N	0	3	344.459	3.319	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@H](CCC)c3ccccc3)C[C@]2(C)C1	ZINC001101454192	1364570235	/nfs/dbraw/zinc/57/02/35/1364570235.db2.gz	HBVVQMRUWQSMNW-SJBKTWHCSA-N	0	3	338.495	3.374	20	30		EGEDHN
C#CCCCC(=O)N1CCC(C(C)(C)CNCc2cc(C)on2)CC1	ZINC001101535621	1364604726	/nfs/dbraw/zinc/60/47/26/1364604726.db2.gz	PRUJXCRBFWLYSC-UHFFFAOYSA-N	0	3	345.487	3.141	20	30		EGEDHN
C=CCC[C@H](C)N1CC2(C1)C[C@@H](NC(=O)/C=C(\C)CC)c1nccn12	ZINC001101627888	1364661635	/nfs/dbraw/zinc/66/16/35/1364661635.db2.gz	PSTWJNCBHWJYHG-OSGGRZCESA-N	0	3	342.487	3.166	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CC2(CN(CCC(C)(C)C)C2)n2ccnc21	ZINC001101631461	1364662898	/nfs/dbraw/zinc/66/28/98/1364662898.db2.gz	VTOMPHFLHRHGME-MRXNPFEDSA-N	0	3	344.503	3.248	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1CC2(CN(CCC(C)C)C2)n2ccnc21	ZINC001101643043	1364667757	/nfs/dbraw/zinc/66/77/57/1364667757.db2.gz	UBWLFRPBVMJHAQ-VQIMIIECSA-N	0	3	344.503	3.103	20	30		EGEDHN
CC(C)[C@@H](C)CC(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001101808133	1364734803	/nfs/dbraw/zinc/73/48/03/1364734803.db2.gz	URFWTJBFEIHFOU-ARFHVFGLSA-N	0	3	347.528	3.486	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H]1CN([C@@H](C)c2cnc(C)cn2)C[C@H]1C	ZINC001102219813	1364940867	/nfs/dbraw/zinc/94/08/67/1364940867.db2.gz	XHEZROJIPLLBJC-HYVNUMGLSA-N	0	3	344.503	3.132	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@@H]1CN(Cc2c(C)onc2CC)C[C@H]1C	ZINC001102328251	1365003959	/nfs/dbraw/zinc/00/39/59/1365003959.db2.gz	BNRYTPUFYUCVFO-AKCHCHLHSA-N	0	3	347.503	3.332	20	30		EGEDHN
CCC1(C(=O)NC[C@@H]2CN(CC#Cc3ccc(F)cc3)C[C@H]2C)CC1	ZINC001102331521	1365005787	/nfs/dbraw/zinc/00/57/87/1365005787.db2.gz	FWZNUYRIJPCSBP-SJLPKXTDSA-N	0	3	342.458	3.052	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H]2CN(Cc3cnc(C)o3)C[C@H]2C)CCCC1	ZINC001102621173	1365139998	/nfs/dbraw/zinc/13/99/98/1365139998.db2.gz	NUJXYUCRPMXGSE-NVXWUHKLSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](NCc3sc(C)nc3C)C2)CCC1	ZINC001185463240	1387721829	/nfs/dbraw/zinc/72/18/29/1387721829.db2.gz	LQVZBXQXICPKMO-OAHLLOKOSA-N	0	3	333.501	3.197	20	30		EGEDHN
CC[C@H](C)C(=O)NCC[C@@H]1CN(Cc2ccc(C#N)cc2F)C[C@H]1C	ZINC001102680104	1365167329	/nfs/dbraw/zinc/16/73/29/1365167329.db2.gz	WEVGSVSJXLTVKT-ZMSDIMECSA-N	0	3	345.462	3.318	20	30		EGEDHN
C/C=C(/C)C(=O)NCC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001102841371	1365246230	/nfs/dbraw/zinc/24/62/30/1365246230.db2.gz	GVTVOVBZHZMKHY-OYSBPKLDSA-N	0	3	331.485	3.160	20	30		EGEDHN
C/C=C(\C)C(=O)NCC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001102841372	1365246307	/nfs/dbraw/zinc/24/63/07/1365246307.db2.gz	GVTVOVBZHZMKHY-RJFUWOQPSA-N	0	3	331.485	3.160	20	30		EGEDHN
CC(C)C#CC(=O)NCC[C@@H]1CN(Cc2cccc(F)c2F)C[C@H]1C	ZINC001102955905	1365315390	/nfs/dbraw/zinc/31/53/90/1365315390.db2.gz	MQRXTFLGPFHZFZ-HZPDHXFCSA-N	0	3	348.437	3.198	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCC[C@@H]1CN(Cc2cncc(F)c2)C[C@H]1C	ZINC001103033274	1365348497	/nfs/dbraw/zinc/34/84/97/1365348497.db2.gz	CTRZLJRHNLXSMK-NVXWUHKLSA-N	0	3	347.478	3.397	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1CCNC(=O)CC(C)(F)F	ZINC001103407619	1365542149	/nfs/dbraw/zinc/54/21/49/1365542149.db2.gz	LSWCXYXNIAZOFP-GDBMZVCRSA-N	0	3	349.425	3.178	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2ccc(F)cc2F)C1	ZINC001103688862	1365728742	/nfs/dbraw/zinc/72/87/42/1365728742.db2.gz	CJGDATJANFPSOT-DGCLKSJQSA-N	0	3	342.817	3.405	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CCC2)C[C@H]1CCNCc1cc(C#N)ccc1F	ZINC001103810538	1365791865	/nfs/dbraw/zinc/79/18/65/1365791865.db2.gz	USXIZUQBCWUMHL-RHSMWYFYSA-N	0	3	343.446	3.072	20	30		EGEDHN
C[C@@H](C(=O)N1C[C@@H](C)[C@H](CCNCc2ccccc2C#N)C1)C1CC1	ZINC001104043269	1365887180	/nfs/dbraw/zinc/88/71/80/1365887180.db2.gz	NEQPUJWTJSYONL-JXXFODFXSA-N	0	3	339.483	3.179	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccncc2)C[C@H]1C	ZINC001104212333	1365953662	/nfs/dbraw/zinc/95/36/62/1365953662.db2.gz	BWQTVQWZYUQVSP-NKGKWGDASA-N	0	3	347.890	3.012	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](C)[C@H](CCNCc2conc2CC)C1	ZINC001104239926	1365965875	/nfs/dbraw/zinc/96/58/75/1365965875.db2.gz	XJEPFUIODQFIGK-HZPDHXFCSA-N	0	3	347.503	3.414	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](C)[C@H](CCNCc2conc2C)C1	ZINC001104239965	1365966151	/nfs/dbraw/zinc/96/61/51/1365966151.db2.gz	ZKLVDGYENPMVOZ-GDBMZVCRSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)[C@H](CCNCc2c(C)onc2CC)C1	ZINC001104245572	1365966746	/nfs/dbraw/zinc/96/67/46/1365966746.db2.gz	PXJKBNRFHCYCMW-NVXWUHKLSA-N	0	3	347.503	3.476	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2ncc(Cl)s2)C[C@H]1C	ZINC001104412050	1366012279	/nfs/dbraw/zinc/01/22/79/1366012279.db2.gz	VGBUOCVVHRXBOU-MWLCHTKSSA-N	0	3	348.299	3.237	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)[C@H](CCNCC(=C)Br)C1	ZINC001104492282	1366046467	/nfs/dbraw/zinc/04/64/67/1366046467.db2.gz	XQQIIJCKEHXRGC-TZMCWYRMSA-N	0	3	343.309	3.181	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)[C@@H](C)CC(F)(F)F)C[C@H]1C	ZINC001104619906	1366103962	/nfs/dbraw/zinc/10/39/62/1366103962.db2.gz	RHISKQMDKQYOOL-DMDPSCGWSA-N	0	3	340.817	3.402	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C/C=C(\C)C=C)CC1	ZINC001105394313	1366443270	/nfs/dbraw/zinc/44/32/70/1366443270.db2.gz	UIEDPIOPBDGRQW-FMDURADSSA-N	0	3	326.484	3.235	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C/C=C(\C)C=C)CC1	ZINC001105394315	1366443387	/nfs/dbraw/zinc/44/33/87/1366443387.db2.gz	UIEDPIOPBDGRQW-KDRVJRGFSA-N	0	3	326.484	3.235	20	30		EGEDHN
C=CCCC(=O)N1CCCC[C@H]1C1(CNCc2nccn2C)CCC1	ZINC001105522717	1366507720	/nfs/dbraw/zinc/50/77/20/1366507720.db2.gz	NRJKCHVOPZXIHG-KRWDZBQOSA-N	0	3	344.503	3.027	20	30		EGEDHN
C=CCCCNCc1cn([C@@H]2CCCN(C(=O)CCCCC)C2)nn1	ZINC001185872518	1387822037	/nfs/dbraw/zinc/82/20/37/1387822037.db2.gz	IZFQABTYVWGWGG-GOSISDBHSA-N	0	3	347.507	3.078	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](CNCc2nc(C)c(C)s2)[C@H](C)C1	ZINC001106189583	1366618952	/nfs/dbraw/zinc/61/89/52/1366618952.db2.gz	AMHQXYBVJOUAGJ-CZUORRHYSA-N	0	3	335.517	3.300	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001106610139	1366754589	/nfs/dbraw/zinc/75/45/89/1366754589.db2.gz	ZZVLNOCQVVOXON-VQIMIIECSA-N	0	3	325.456	3.099	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](CNCc3cscn3)[C@H](C)C2)CCC1	ZINC001106635897	1366762586	/nfs/dbraw/zinc/76/25/86/1366762586.db2.gz	JHSZQPHXOGIUCF-HUUCEWRRSA-N	0	3	333.501	3.074	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H](CNCc2cc(C3CC3)no2)[C@H](C)C1	ZINC001106711423	1366778153	/nfs/dbraw/zinc/77/81/53/1366778153.db2.gz	ULNQBVWOOFXULO-GDBMZVCRSA-N	0	3	345.487	3.338	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCN(C(=O)/C=C\C(C)(C)C)C1	ZINC001189437747	1367021379	/nfs/dbraw/zinc/02/13/79/1367021379.db2.gz	HWTZHOKCZOCGEK-LECLMCCNSA-N	0	3	325.456	3.193	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCCc1ccsc1	ZINC001109261198	1367031784	/nfs/dbraw/zinc/03/17/84/1367031784.db2.gz	WSFXOUNDOGMXAY-SQNIBIBYSA-N	0	3	344.524	3.452	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](N(C)Cc2ccc(C)c(OC)c2)C1	ZINC001189744033	1367100209	/nfs/dbraw/zinc/10/02/09/1367100209.db2.gz	LGOIKKLCKKAUIH-LJQANCHMSA-N	0	3	342.483	3.230	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](N(C)CCOc2cccc(C)c2)C1	ZINC001189751998	1367102331	/nfs/dbraw/zinc/10/23/31/1367102331.db2.gz	MLLDKHIOFWRYGM-IBGZPJMESA-N	0	3	342.483	3.100	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)C[C@H]3CCCC(C)(C)C3)[C@@H]2C1	ZINC001189786604	1367108655	/nfs/dbraw/zinc/10/86/55/1367108655.db2.gz	GEKQHRWCLFILEF-CEXWTWQISA-N	0	3	348.531	3.328	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H]1CCC=CCCC1)C2	ZINC001109438651	1367120156	/nfs/dbraw/zinc/12/01/56/1367120156.db2.gz	GNQZFJRCWICBIO-RDGPPVDQSA-N	0	3	332.488	3.047	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@H](N(C)[C@H](C)c2ccc(F)c(F)c2)C1	ZINC001190004164	1367149678	/nfs/dbraw/zinc/14/96/78/1367149678.db2.gz	NLUJMTJFWWJEOZ-ZBFHGGJFSA-N	0	3	334.410	3.218	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1scnc1C(F)F)C2	ZINC001109512475	1367169680	/nfs/dbraw/zinc/16/96/80/1367169680.db2.gz	JOSRCLWNTPQSFK-WOPDTQHZSA-N	0	3	341.427	3.382	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2ccoc2CC)C1	ZINC001107910699	1367197871	/nfs/dbraw/zinc/19/78/71/1367197871.db2.gz	MKSDVBDVVDFFFW-KXBFYZLASA-N	0	3	334.460	3.017	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2c(C)coc2C)C1	ZINC001107914890	1367200933	/nfs/dbraw/zinc/20/09/33/1367200933.db2.gz	SZMFEBDGWVASPQ-KXBFYZLASA-N	0	3	334.460	3.072	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](N(C)Cc2ccc(OC)cc2)C1	ZINC001190344298	1367232363	/nfs/dbraw/zinc/23/23/63/1367232363.db2.gz	HPPRWMLNNSXJAI-IBGZPJMESA-N	0	3	342.483	3.496	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2ccc(C)c(F)c2)C1	ZINC001108058291	1367260765	/nfs/dbraw/zinc/26/07/65/1367260765.db2.gz	XVLOFXVJQPVQSE-OXQOHEQNSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](N(C)Cc2cccc(OC)c2C)C1	ZINC001190436036	1367264900	/nfs/dbraw/zinc/26/49/00/1367264900.db2.gz	OUUGVPOFELRWSK-GOSISDBHSA-N	0	3	330.472	3.393	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)C2(C3CC3)CCC2)C1	ZINC001108101921	1367282718	/nfs/dbraw/zinc/28/27/18/1367282718.db2.gz	VPMGNJRYKLWBRZ-LPHOPBHVSA-N	0	3	334.504	3.129	20	30		EGEDHN
N#Cc1cccc(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)c1F	ZINC001190555119	1367291868	/nfs/dbraw/zinc/29/18/68/1367291868.db2.gz	RDKPJFKBDCMDNX-SFHVURJKSA-N	0	3	337.398	3.264	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)C2CC3(CCC3)C2)C1	ZINC001108141801	1367304837	/nfs/dbraw/zinc/30/48/37/1367304837.db2.gz	DMMFKXDTEUQXQY-QFBILLFUSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@@]1(C)CN(CC2CC(C)(C)C2)CCO1	ZINC001108147678	1367309474	/nfs/dbraw/zinc/30/94/74/1367309474.db2.gz	BZDWOJLZGPGVTL-JXFKEZNVSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@@]1(C)CN(CC2CCCCC2)CCO1	ZINC001108149406	1367310642	/nfs/dbraw/zinc/31/06/42/1367310642.db2.gz	VLIQVYVWINYXDX-XLIONFOSSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCCC1(C(=O)NC[C@]2(C)CN(CC3CC(C)(C)C3)CCO2)CC1	ZINC001108186476	1367330657	/nfs/dbraw/zinc/33/06/57/1367330657.db2.gz	OSWAELJZTQGEKC-HXUWFJFHSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2ccc(C)cc2C)C1	ZINC001108377109	1367423827	/nfs/dbraw/zinc/42/38/27/1367423827.db2.gz	WYACCONAVQUWFC-RXVVDRJESA-N	0	3	344.499	3.479	20	30		EGEDHN
C=CCCC(=O)N1CCC([C@H]2OCCC[C@@H]2NCC(=C)Cl)CC1	ZINC001186122554	1387874022	/nfs/dbraw/zinc/87/40/22/1387874022.db2.gz	CAPUHFANAZMVLP-FUHWJXTLSA-N	0	3	340.895	3.081	20	30		EGEDHN
C=C[C@H](CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCCF)c1ccccc1	ZINC001110133995	1367517078	/nfs/dbraw/zinc/51/70/78/1367517078.db2.gz	KHJVWVMPGRBBMB-YSHGAJCASA-N	0	3	330.447	3.427	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3C[C@@H](C)OC)CCCCC1	ZINC001110135418	1367518219	/nfs/dbraw/zinc/51/82/19/1367518219.db2.gz	BGEJJSVZPAPVLB-BDXSIMOUSA-N	0	3	334.504	3.269	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@H](C)c1cccc(OC)c1)C2	ZINC001110174910	1367545703	/nfs/dbraw/zinc/54/57/03/1367545703.db2.gz	DADJTZNTAHKGLV-RKOGWWSCSA-N	0	3	342.483	3.486	20	30		EGEDHN
C#CCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3C[C@H](CC)OC)CCCCC1	ZINC001110177725	1367546437	/nfs/dbraw/zinc/54/64/37/1367546437.db2.gz	FGPZGUIXPKEUGB-XWSJACJDSA-N	0	3	346.515	3.107	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2[C@@H](C)c1cccc(C)c1	ZINC001110181927	1367550829	/nfs/dbraw/zinc/55/08/29/1367550829.db2.gz	SLFRPIAHFBKADW-RNQOJCNYSA-N	0	3	342.483	3.370	20	30		EGEDHN
C#CC[C@@H](CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CC(=C)C)c1ccccc1	ZINC001110201300	1367561159	/nfs/dbraw/zinc/56/11/59/1367561159.db2.gz	AHFDVKNQOMHVJT-WOZUAGRISA-N	0	3	336.479	3.481	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCCc1ccc(C)s1)C2	ZINC001110218209	1367572935	/nfs/dbraw/zinc/57/29/35/1367572935.db2.gz	VMAQZESKGIHZSJ-NJAFHUGGSA-N	0	3	330.497	3.124	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccccc1C	ZINC001110366240	1367669711	/nfs/dbraw/zinc/66/97/11/1367669711.db2.gz	MYFJLTUMXIAYOC-NBYUQASBSA-N	0	3	342.483	3.198	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2[C@@H](C)c1cccc(OC)c1	ZINC001110380004	1367680124	/nfs/dbraw/zinc/68/01/24/1367680124.db2.gz	IXCIOFKOQDNLLO-WLWJZTKJSA-N	0	3	328.456	3.444	20	30		EGEDHN
CC(C)c1ccccc1CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](C)C#N)C2	ZINC001110401400	1367693057	/nfs/dbraw/zinc/69/30/57/1367693057.db2.gz	BYUVDFPNGICBNN-OPNNQBFTSA-N	0	3	325.456	3.191	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](N(C)CCc3scnc3C)C2)CCC1	ZINC001192225678	1367723659	/nfs/dbraw/zinc/72/36/59/1367723659.db2.gz	AJCBBPIBGAIOKX-MRXNPFEDSA-N	0	3	347.528	3.273	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](N(C)CCOc3ccc(C)cc3)C2)C1	ZINC001192258636	1367733214	/nfs/dbraw/zinc/73/32/14/1367733214.db2.gz	YXFYYXNWLWQQSK-SFHVURJKSA-N	0	3	342.483	3.263	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)CC/C=C\c2ccccc2)C1	ZINC001192326868	1367754162	/nfs/dbraw/zinc/75/41/62/1367754162.db2.gz	UBCWDIGZEFCPTA-RVPHRTOXSA-N	0	3	342.483	3.215	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CC[C@@H]1CCCC1(F)F	ZINC001110537987	1367817432	/nfs/dbraw/zinc/81/74/32/1367817432.db2.gz	INPDUZFSKTVCEO-HZMVEIRTSA-N	0	3	338.442	3.193	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](N(C)CCOCc2ccccc2)C1	ZINC001192578990	1367822859	/nfs/dbraw/zinc/82/28/59/1367822859.db2.gz	VLHDKAFIVRYTFH-IBGZPJMESA-N	0	3	344.499	3.338	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCc1scnc1C	ZINC001110610632	1367871770	/nfs/dbraw/zinc/87/17/70/1367871770.db2.gz	LHOXCRDMVMMFEM-OAGGEKHMSA-N	0	3	333.501	3.072	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)CC2(C=C)CCCCC2)C1	ZINC001192826738	1367883017	/nfs/dbraw/zinc/88/30/17/1367883017.db2.gz	SPJDVCNFELQCRI-GOSISDBHSA-N	0	3	334.504	3.248	20	30		EGEDHN
C=CCC[C@@H](C)N1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ncc(Cl)s1)C2	ZINC001110803497	1368000815	/nfs/dbraw/zinc/00/08/15/1368000815.db2.gz	YRQRPUWSLXFOCA-LPWJVIDDSA-N	0	3	339.892	3.486	20	30		EGEDHN
CN1CCC[C@H](C(=O)NC2=C(c3ccccc3)C(=O)c3ccccc32)C1	ZINC001186362859	1387929358	/nfs/dbraw/zinc/92/93/58/1387929358.db2.gz	VCFBSCZCXIKKAC-INIZCTEOSA-N	0	3	346.430	3.209	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2ccc(CC)c(CC)c2)C1	ZINC001194598433	1368293651	/nfs/dbraw/zinc/29/36/51/1368293651.db2.gz	XGBNDPAQFGUEGU-HXUWFJFHSA-N	0	3	344.499	3.160	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](C)c1ccccc1C)C2	ZINC001111440440	1368307650	/nfs/dbraw/zinc/30/76/50/1368307650.db2.gz	PDGLETFKRBGBNF-LFGUQSLTSA-N	0	3	342.483	3.023	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccc(C)c(C)c1	ZINC001111490943	1368320008	/nfs/dbraw/zinc/32/00/08/1368320008.db2.gz	GZEXXLFCYMZWKE-NBYUQASBSA-N	0	3	342.483	3.116	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H](C)C(CC)CC)C[C@@H](C)O2	ZINC001111545489	1368338114	/nfs/dbraw/zinc/33/81/14/1368338114.db2.gz	HTHXMSGGGJYOKX-IAGOWNOFSA-N	0	3	336.520	3.327	20	30		EGEDHN
CC[C@H](C)CC(=O)N[C@]12CCC[C@H]1CN(Cc1cccc(C#N)c1)C2	ZINC001111727694	1368430732	/nfs/dbraw/zinc/43/07/32/1368430732.db2.gz	IOAWULUQHHUTBX-LRQRDZAKSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2ccn(C3CCCC3)n2)CC1	ZINC001195996808	1368531828	/nfs/dbraw/zinc/53/18/28/1368531828.db2.gz	FORFUEXMXKKLMN-UHFFFAOYSA-N	0	3	330.476	3.112	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N[C@]12CCC[C@H]1CN(Cc1cccc(C#N)c1)C2	ZINC001111889112	1368533733	/nfs/dbraw/zinc/53/37/33/1368533733.db2.gz	XBDSMXNDDSKURK-LRQRDZAKSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=CCC[C@H](C)N1CCCN(C(=O)c2nc3cccnc3s2)CC1	ZINC001196171708	1368562274	/nfs/dbraw/zinc/56/22/74/1368562274.db2.gz	QHFGWQAEXGLTHB-AWEZNQCLSA-N	0	3	344.484	3.194	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cc(CC)nnc2C)CC1	ZINC001196619488	1368651513	/nfs/dbraw/zinc/65/15/13/1368651513.db2.gz	CEDAAPNUDZBVSW-UHFFFAOYSA-N	0	3	346.519	3.466	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2cc3ncccc3s2)CC1	ZINC001196725291	1368670890	/nfs/dbraw/zinc/67/08/90/1368670890.db2.gz	XMRDYKFZRKVNAO-UHFFFAOYSA-N	0	3	329.469	3.410	20	30		EGEDHN
C=CCCC1(C(=O)N2C[C@@H](C(F)(F)F)[C@H](NCC(=C)C)C2)CC1	ZINC001112158995	1368689522	/nfs/dbraw/zinc/68/95/22/1368689522.db2.gz	JWZUPHMVWZGNOK-ZIAGYGMSSA-N	0	3	330.394	3.288	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2ccc3nonc3c2)CC1	ZINC001196992920	1368727142	/nfs/dbraw/zinc/72/71/42/1368727142.db2.gz	GJASUFFIFAOUJW-UHFFFAOYSA-N	0	3	344.459	3.341	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)[C@@H](C)Oc2cccnc2)CC1	ZINC001197125673	1368750276	/nfs/dbraw/zinc/75/02/76/1368750276.db2.gz	HPEFGAROLLDISU-GOSISDBHSA-N	0	3	347.503	3.354	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2ocnc2C2CC2)CC1	ZINC001197149821	1368755152	/nfs/dbraw/zinc/75/51/52/1368755152.db2.gz	GTURRULBQMRVSN-UHFFFAOYSA-N	0	3	331.460	3.446	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H]2CCC[C@]2(CNCc2cscn2)C1	ZINC001112377490	1368804255	/nfs/dbraw/zinc/80/42/55/1368804255.db2.gz	SHOOIOQQSZCNEU-YJBOKZPZSA-N	0	3	333.501	3.218	20	30		EGEDHN
C=CCN(C(=O)c1ccc(CN2CC[C@@H](O)C2)cc1)C1CCCCC1	ZINC001197610512	1368854796	/nfs/dbraw/zinc/85/47/96/1368854796.db2.gz	NSJNJSLQEZPHRP-HXUWFJFHSA-N	0	3	342.483	3.214	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2coc(C3CCCC3)n2)CC1	ZINC001197621426	1368856680	/nfs/dbraw/zinc/85/66/80/1368856680.db2.gz	ZWVAEZMNYLIQOU-UHFFFAOYSA-N	0	3	331.460	3.446	20	30		EGEDHN
C=C[C@@H](CC(=O)N1CCCN(C[C@H](CC)OC)CC1)c1ccccc1	ZINC001198214572	1368982701	/nfs/dbraw/zinc/98/27/01/1368982701.db2.gz	QXYMWPMGSGLFCR-ICSRJNTNSA-N	0	3	344.499	3.306	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N1CCCN([C@@H](CC)c2ccccc2)CC1	ZINC001198343011	1369012059	/nfs/dbraw/zinc/01/20/59/1369012059.db2.gz	FBVAQBWHSFBRTC-HKUYNNGSSA-N	0	3	330.472	3.263	20	30		EGEDHN
C=CCC[C@@H](C)N[C@H](CNC(=O)C(C)(F)F)c1ccccc1OC	ZINC001198482539	1369041935	/nfs/dbraw/zinc/04/19/35/1369041935.db2.gz	PXVSPASPSOMCOW-UKRRQHHQSA-N	0	3	340.414	3.452	20	30		EGEDHN
C=CCC[C@@H](C)N[C@@H](CNC(=O)CSC)c1ccccc1OC	ZINC001198516218	1369050984	/nfs/dbraw/zinc/05/09/84/1369050984.db2.gz	VTLRDWRWBQRXCG-ZBFHGGJFSA-N	0	3	336.501	3.160	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)CCSCC)c1ccccc1OC	ZINC001198568587	1369062976	/nfs/dbraw/zinc/06/29/76/1369062976.db2.gz	USZZDQKLKTUBFB-MRXNPFEDSA-N	0	3	336.501	3.161	20	30		EGEDHN
COc1ccccc1[C@@H](CNC(=O)[C@@H](C)C#N)NCCC(C)(C)C	ZINC001198617992	1369074971	/nfs/dbraw/zinc/07/49/71/1369074971.db2.gz	VEXQNSBYOFAYBC-GOEBONIOSA-N	0	3	331.460	3.038	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)COCCCC)c1ccccc1OC	ZINC001198628351	1369076411	/nfs/dbraw/zinc/07/64/11/1369076411.db2.gz	SXBOUHRULSKDFR-SFHVURJKSA-N	0	3	348.487	3.225	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)/C=C/C1CC1)c1ccccc1OC	ZINC001198635275	1369078163	/nfs/dbraw/zinc/07/81/63/1369078163.db2.gz	DTDBUVKDBCAXNS-ZGKFYVQTSA-N	0	3	328.456	3.375	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)CO[C@@H](C)CC)c1ccccc1OC	ZINC001198669047	1369087243	/nfs/dbraw/zinc/08/72/43/1369087243.db2.gz	XAHARBWLQHNKAK-WMZOPIPTSA-N	0	3	348.487	3.223	20	30		EGEDHN
C#CCCCCC(=O)NC[C@H](NCC[C@H](C)F)c1ccccc1OC	ZINC001198677917	1369088672	/nfs/dbraw/zinc/08/86/72/1369088672.db2.gz	VERHSZVPKMFHBA-WMZOPIPTSA-N	0	3	348.462	3.384	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H](NCCC=C)c1ccccc1OC	ZINC001198678144	1369089411	/nfs/dbraw/zinc/08/94/11/1369089411.db2.gz	YMXCXHNGAWVNLY-GOSISDBHSA-N	0	3	328.456	3.212	20	30		EGEDHN
C#CCCCC(=O)NC[C@@H](NCCC(C)C)c1ccccc1OC	ZINC001198693368	1369091926	/nfs/dbraw/zinc/09/19/26/1369091926.db2.gz	ACLYBKCPKNQCEQ-GOSISDBHSA-N	0	3	330.472	3.292	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)C#CC(C)C)c1ccccc1OC	ZINC001198712722	1369096956	/nfs/dbraw/zinc/09/69/56/1369096956.db2.gz	FKTQHPMRMNRBQT-GOSISDBHSA-N	0	3	328.456	3.068	20	30		EGEDHN
COc1ccccc1[C@@H](CNC(=O)C#CC(C)(C)C)NCC(C)C	ZINC001198723466	1369100087	/nfs/dbraw/zinc/10/00/87/1369100087.db2.gz	HYPJXBVHAXARGH-QGZVFWFLSA-N	0	3	330.472	3.148	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H](NCCCOCC)c1ccccc1OC	ZINC001198751579	1369105561	/nfs/dbraw/zinc/10/55/61/1369105561.db2.gz	IMYNRJAYIVCFJE-GOSISDBHSA-N	0	3	348.487	3.225	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)CCC(F)F)c1ccccc1OC	ZINC001198795301	1369116159	/nfs/dbraw/zinc/11/61/59/1369116159.db2.gz	CLPOQCXFIQKKMJ-OAHLLOKOSA-N	0	3	340.414	3.454	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@H](C)CC(F)F)c1ccccc1OC	ZINC001198797536	1369117380	/nfs/dbraw/zinc/11/73/80/1369117380.db2.gz	VMGWOBQVWLLBGI-HIFRSBDPSA-N	0	3	340.414	3.310	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)[C@@H]2CCN(C)c3ccccc32)CC1	ZINC001112977231	1369120913	/nfs/dbraw/zinc/12/09/13/1369120913.db2.gz	SEXJAURQSYKCRN-IEBWSBKVSA-N	0	3	341.499	3.109	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NC[C@@H](NC(C)C)c1ccccc1OC	ZINC001198820188	1369121492	/nfs/dbraw/zinc/12/14/92/1369121492.db2.gz	YWRCXKREVWGONT-YLJYHZDGSA-N	0	3	348.487	3.079	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)C[C@@H]1C[C@H]1C1CC1)c1ccccc1OC	ZINC001198820122	1369121892	/nfs/dbraw/zinc/12/18/92/1369121892.db2.gz	XYPLUIIBJLLFMY-WDSOQIARSA-N	0	3	342.483	3.454	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@H](NCCCF)c1ccccc1OC	ZINC001198825537	1369122869	/nfs/dbraw/zinc/12/28/69/1369122869.db2.gz	CSMCOGALJCUSNN-INIZCTEOSA-N	0	3	336.451	3.404	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H](NCCC1CC1)c1ccccc1OC	ZINC001198835600	1369126535	/nfs/dbraw/zinc/12/65/35/1369126535.db2.gz	UNTWWBCLFSPALE-QGZVFWFLSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@@H](CCC)OCC)c1ccccc1OC	ZINC001198857513	1369131384	/nfs/dbraw/zinc/13/13/84/1369131384.db2.gz	QMWOMIOIJBPWED-PKOBYXMFSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=C[C@@H](CC(=O)N[C@@H]1CN(CCCCCC)C[C@H]1O)c1ccccc1	ZINC001198941118	1369153468	/nfs/dbraw/zinc/15/34/68/1369153468.db2.gz	YSNSDDSQXRCNOM-DFQSSKMNSA-N	0	3	344.499	3.088	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@H](C)CCCOC)c1ccccc1OC	ZINC001198961327	1369159607	/nfs/dbraw/zinc/15/96/07/1369159607.db2.gz	VMJRDHJZCIZNNP-AEFFLSMTSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)C2(CC)CCCCC2)C1	ZINC001198962053	1369160098	/nfs/dbraw/zinc/16/00/98/1369160098.db2.gz	AZGKPYYITPJZEL-QZTJIDSGSA-N	0	3	336.520	3.255	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CC#Cc1ccccc1	ZINC001325529474	1387998106	/nfs/dbraw/zinc/99/81/06/1387998106.db2.gz	IACYKPXUMACORM-GHTZIAJQSA-N	0	3	332.447	3.065	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC(NCc2nc(C)c(C)s2)CC1	ZINC001200783948	1369427936	/nfs/dbraw/zinc/42/79/36/1369427936.db2.gz	ZNHRHNICHVWGFO-UHFFFAOYSA-N	0	3	335.517	3.443	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC(NCc2csc([N+](=O)[O-])c2)CC1	ZINC001200815243	1369433014	/nfs/dbraw/zinc/43/30/14/1369433014.db2.gz	CXRGTOZZCXERAK-UHFFFAOYSA-N	0	3	337.445	3.093	20	30		EGEDHN
CC#CCNC[C@H]1CN(C(=O)[C@H](CC)CCCCCC)CCCO1	ZINC001201147369	1369486092	/nfs/dbraw/zinc/48/60/92/1369486092.db2.gz	LWBYSJHXERELFO-MOPGFXCFSA-N	0	3	336.520	3.213	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)CCCc2nc(C(C)C)no2)CC1	ZINC001113633317	1369533638	/nfs/dbraw/zinc/53/36/38/1369533638.db2.gz	VRALKZWUJFJHPV-INIZCTEOSA-N	0	3	348.491	3.015	20	30		EGEDHN
CC#CCNC[C@H]1CN(C(=O)[C@@H](CC)CC2CCCCC2)CCCO1	ZINC001201547092	1369571935	/nfs/dbraw/zinc/57/19/35/1369571935.db2.gz	PPHIKFSIOHJSSX-PMACEKPBSA-N	0	3	348.531	3.213	20	30		EGEDHN
CCCCCCCN1CCO[C@@H]2[C@@H](COc3ncccn3)CC[C@@H]21	ZINC001201776629	1369621622	/nfs/dbraw/zinc/62/16/22/1369621622.db2.gz	HPOLNODGGLWDCT-FGTMMUONSA-N	0	3	333.476	3.305	20	30		EGEDHN
CCCCCCCCN1CC[C@]2(CC(C(=O)N(C)C(C)C)=NO2)C1	ZINC001201815169	1369628506	/nfs/dbraw/zinc/62/85/06/1369628506.db2.gz	YGONFMBZALRJEB-IBGZPJMESA-N	0	3	337.508	3.435	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001201997906	1369663405	/nfs/dbraw/zinc/66/34/05/1369663405.db2.gz	HXOYMSWERVAOIL-UHFFFAOYSA-N	0	3	337.467	3.223	20	30		EGEDHN
CC#CCNC[C@@H]1CN(C(=O)C2CCC(CCCC)CC2)CCCO1	ZINC001202005719	1369665832	/nfs/dbraw/zinc/66/58/32/1369665832.db2.gz	IZEAZPSBUKSQPK-SOAGJPPSSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC(NCc2ccncc2Cl)CC1	ZINC001202108071	1369688203	/nfs/dbraw/zinc/68/82/03/1369688203.db2.gz	GKYUJNBUOJZMLI-AWEZNQCLSA-N	0	3	335.879	3.418	20	30		EGEDHN
C=CCCC(=O)NC1[C@H]2CN(C/C=C\c3ccc(Cl)cc3)C[C@@H]12	ZINC001114026226	1369690664	/nfs/dbraw/zinc/69/06/64/1369690664.db2.gz	YAQAAWAUVKETMM-SQHPWPPOSA-N	0	3	330.859	3.366	20	30		EGEDHN
CCCC(C)(C)C(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001202281275	1369728627	/nfs/dbraw/zinc/72/86/27/1369728627.db2.gz	UCRYZUCAAPLNFV-UHFFFAOYSA-N	0	3	327.472	3.465	20	30		EGEDHN
O=C(N[C@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2)c1ccccc1	ZINC001202337792	1369742505	/nfs/dbraw/zinc/74/25/05/1369742505.db2.gz	WNUPFVMUXBQAOC-RTWAWAEBSA-N	0	3	344.458	3.369	20	30		EGEDHN
CC(C)CC(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C12CCC2	ZINC001202340108	1369743081	/nfs/dbraw/zinc/74/30/81/1369743081.db2.gz	JTGONYRKYHQSCN-MSOLQXFVSA-N	0	3	343.446	3.260	20	30		EGEDHN
CC/C=C(/C)C(=O)N[C@@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202582110	1369812473	/nfs/dbraw/zinc/81/24/73/1369812473.db2.gz	LMOFMMNCTCAJSM-PBHAHDNLSA-N	0	3	336.479	3.411	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@H](NCc2cccc(F)c2F)C12CCC2	ZINC001202597733	1369818260	/nfs/dbraw/zinc/81/82/60/1369818260.db2.gz	ATYRPTNIVQZUAK-JKSUJKDBSA-N	0	3	334.410	3.448	20	30		EGEDHN
O=C(N[C@@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2)C1CC=CC1	ZINC001202644338	1369836182	/nfs/dbraw/zinc/83/61/82/1369836182.db2.gz	UTWZDFLERLONRX-WOJBJXKFSA-N	0	3	334.463	3.021	20	30		EGEDHN
C/C=C(/C)C(=O)N[C@@H]1C[C@@H](NCC#Cc2ccc(F)cc2)C12CCC2	ZINC001202722840	1369866541	/nfs/dbraw/zinc/86/65/41/1369866541.db2.gz	BZNAYAZJFXQYGS-IURQVSMNSA-N	0	3	340.442	3.160	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202786278	1369891852	/nfs/dbraw/zinc/89/18/52/1369891852.db2.gz	UKKABTSJJXIJPF-SFTDATJTSA-N	0	3	348.490	3.249	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1C[C@@H](NCc2oc(C)nc2C)C12CCC2	ZINC001202786638	1369892100	/nfs/dbraw/zinc/89/21/00/1369892100.db2.gz	VFQHHEVWLLOBKT-QZTJIDSGSA-N	0	3	343.471	3.002	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1[C@H]2CN(CCCc3c(F)cccc3F)C[C@H]21	ZINC001114352651	1369907985	/nfs/dbraw/zinc/90/79/85/1369907985.db2.gz	FHCOBHJJVGPNNA-IGOJGBNBSA-N	0	3	348.437	3.300	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1C[C@H](NCc2ccns2)C12CCC2	ZINC001202969410	1369940918	/nfs/dbraw/zinc/94/09/18/1369940918.db2.gz	PPWYZTWZGUOKKC-GJZGRUSLSA-N	0	3	333.501	3.262	20	30		EGEDHN
O=C(CCC(F)F)N[C@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001203193762	1370020128	/nfs/dbraw/zinc/02/01/28/1370020128.db2.gz	XIBNCTUKWXEGEV-SJORKVTESA-N	0	3	346.421	3.100	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1C[C@H](NCc2cnc(C)o2)C12CCC2	ZINC001203255648	1370043110	/nfs/dbraw/zinc/04/31/10/1370043110.db2.gz	DHBLYHOWBHYYLF-HOTGVXAUSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1[C@H]2CN(CCc3ccccc3F)C[C@H]21	ZINC001114724054	1370046345	/nfs/dbraw/zinc/04/63/45/1370046345.db2.gz	FPNUGOSZHISKNF-NWGLXNPWSA-N	0	3	330.447	3.017	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1[C@H]2CN(CCc3ccc(F)c(F)c3)C[C@H]21	ZINC001114727391	1370049147	/nfs/dbraw/zinc/04/91/47/1370049147.db2.gz	VMJWSUPSNVWCCW-NEVJAFOQSA-N	0	3	348.437	3.156	20	30		EGEDHN
CC#CCCCC(=O)N[C@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001203280451	1370059348	/nfs/dbraw/zinc/05/93/48/1370059348.db2.gz	HIRPVNBUJSLLFJ-RTWAWAEBSA-N	0	3	348.490	3.249	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2C[C@H](NCc3ccccn3)C23CCC3)CCC1	ZINC001203364750	1370099221	/nfs/dbraw/zinc/09/92/21/1370099221.db2.gz	BHHFCDUTLTWMMB-ZWKOTPCHSA-N	0	3	339.483	3.345	20	30		EGEDHN
COc1ccc(C[N@@H+]2CCC[C@@H](Oc3cccc(C#N)c3)C2)c([O-])c1	ZINC001203629119	1370193139	/nfs/dbraw/zinc/19/31/39/1370193139.db2.gz	REDNYMVZLFWBBA-LJQANCHMSA-N	0	3	338.407	3.316	20	30		EGEDHN
COc1ccc(C[N@H+]2CCC[C@@H](Oc3cccc(C#N)c3)C2)c([O-])c1	ZINC001203629119	1370193143	/nfs/dbraw/zinc/19/31/43/1370193143.db2.gz	REDNYMVZLFWBBA-LJQANCHMSA-N	0	3	338.407	3.316	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)CC#Cc2ccccc2)C12CCC2	ZINC001203762887	1370254954	/nfs/dbraw/zinc/25/49/54/1370254954.db2.gz	VABGXRGZJFYWBS-QZTJIDSGSA-N	0	3	342.870	3.198	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC001203899800	1370305387	/nfs/dbraw/zinc/30/53/87/1370305387.db2.gz	BTGBLQOMRWXLDJ-KRWDZBQOSA-N	0	3	329.444	3.390	20	30		EGEDHN
C=CCOC(=O)N1CCCC2(CCN(Cc3ccncc3)CC2)C1	ZINC001204077225	1370368993	/nfs/dbraw/zinc/36/89/93/1370368993.db2.gz	LQAXOIHDWBGNQI-UHFFFAOYSA-N	0	3	329.444	3.082	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(NCc3cc(C)ncn3)CC2)CCCC1	ZINC001204156417	1370393476	/nfs/dbraw/zinc/39/34/76/1370393476.db2.gz	ACVXEDQPSLIXAA-UHFFFAOYSA-N	0	3	342.487	3.002	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)c2ccco2)CCCCC1	ZINC001115382946	1370421098	/nfs/dbraw/zinc/42/10/98/1370421098.db2.gz	OKXRSWIVWHPSGU-UHFFFAOYSA-N	0	3	341.249	3.211	20	30		EGEDHN
CCCCCCCOc1ccc(CN2CC[C@@H](CO)[C@H](O)C2)cc1	ZINC001204369168	1370455623	/nfs/dbraw/zinc/45/56/23/1370455623.db2.gz	PUIXDEIITWBFRQ-AZUAARDMSA-N	0	3	335.488	3.211	20	30		EGEDHN
CN1CCN(Cc2cccc(Nc3cnc(C#N)c(Cl)c3)c2)CC1	ZINC001204517576	1370501448	/nfs/dbraw/zinc/50/14/48/1370501448.db2.gz	KFVATFPDMLJOLG-UHFFFAOYSA-N	0	3	341.846	3.098	20	30		EGEDHN
C=C[C@@](C)(O)CC(=O)NCC1(NCc2ccccc2F)CCCCC1	ZINC001115507033	1370507146	/nfs/dbraw/zinc/50/71/46/1370507146.db2.gz	ACFFYNIYYUSPAP-LJQANCHMSA-N	0	3	348.462	3.062	20	30		EGEDHN
Cc1nc(C)c(CNC2(CNC(=O)C#CC(C)(C)C)CCCCC2)o1	ZINC001115529491	1370528369	/nfs/dbraw/zinc/52/83/69/1370528369.db2.gz	WOUDPBNIEAXQGQ-UHFFFAOYSA-N	0	3	345.487	3.250	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC1(NCc2cnoc2C)CCCCC1	ZINC001115750611	1370731262	/nfs/dbraw/zinc/73/12/62/1370731262.db2.gz	YNPFPEKXCCFXED-UHFFFAOYSA-N	0	3	333.476	3.494	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC(CNCc2ccn(C(C)C)n2)CC1	ZINC001205407454	1370746991	/nfs/dbraw/zinc/74/69/91/1370746991.db2.gz	MNWKUVOTFSYFDP-UHFFFAOYSA-N	0	3	332.492	3.149	20	30		EGEDHN
N#Cc1ccccc1CNCC1CCN(C(=O)C2(CCF)CC2)CC1	ZINC001205751457	1370859042	/nfs/dbraw/zinc/85/90/42/1370859042.db2.gz	CQHNYCSVFMJUKW-UHFFFAOYSA-N	0	3	343.446	3.026	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)N1CCC(CNCc2oc(CC)nc2C)CC1	ZINC001205953916	1370921871	/nfs/dbraw/zinc/92/18/71/1370921871.db2.gz	BCWTXPNVLMZKKD-HUUCEWRRSA-N	0	3	347.503	3.332	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(CNCc3ocnc3C)CC2)CCC1	ZINC001206188068	1370987014	/nfs/dbraw/zinc/98/70/14/1370987014.db2.gz	SAQKVPCHWUUVDH-UHFFFAOYSA-N	0	3	331.460	3.058	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCN(Cc3ccc(N4CCCC4)cc3)C2)nc1	ZINC001117723125	1371069131	/nfs/dbraw/zinc/06/91/31/1371069131.db2.gz	RIJPBRUPXLWVBX-HXUWFJFHSA-N	0	3	348.450	3.207	20	30		EGEDHN
N#Cc1cc(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)cs1	ZINC001117777721	1371081539	/nfs/dbraw/zinc/08/15/39/1371081539.db2.gz	BXZUKXVEJKOBTH-KRWDZBQOSA-N	0	3	325.437	3.187	20	30		EGEDHN
COC(=O)c1ccc(C2CCN(Cc3cc(C#N)n(C)c3)CC2)cc1	ZINC001207106856	1371296116	/nfs/dbraw/zinc/29/61/16/1371296116.db2.gz	VRXWFVNHPSOWNS-UHFFFAOYSA-N	0	3	337.423	3.063	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1c(C)noc1C)[C@@H]2CC	ZINC001207133858	1371305033	/nfs/dbraw/zinc/30/50/33/1371305033.db2.gz	BAGRWIWBYKRWKE-MJGOQNOKSA-N	0	3	331.460	3.213	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CN(CCOc2ccccc2)C[C@H]1C	ZINC001207158199	1371314525	/nfs/dbraw/zinc/31/45/25/1371314525.db2.gz	KZYUTLAFNVYVLP-SJLPKXTDSA-N	0	3	330.472	3.104	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CN(CCOc2ccc(C)cc2)C[C@H]1C	ZINC001207158239	1371315540	/nfs/dbraw/zinc/31/55/40/1371315540.db2.gz	MNZUVHOKVJSZFJ-IEBWSBKVSA-N	0	3	344.499	3.413	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207167764	1371318261	/nfs/dbraw/zinc/31/82/61/1371318261.db2.gz	PQYOLAVAGZHXMQ-GOSISDBHSA-N	0	3	330.859	3.238	20	30		EGEDHN
CC(C)(C)c1ccc(NC(=O)C2CC3(C2)CNC[C@H]3C#N)cc1F	ZINC001119376880	1371324747	/nfs/dbraw/zinc/32/47/47/1371324747.db2.gz	FHQFFCPZHSKEOO-FWHMADFJSA-N	0	3	329.419	3.201	20	30		EGEDHN
CC(C)CCC(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207222426	1371333676	/nfs/dbraw/zinc/33/36/76/1371333676.db2.gz	PFHULYUTITTZPL-IBGZPJMESA-N	0	3	330.447	3.194	20	30		EGEDHN
O=C(c1ccoc1)N1CCC[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207276883	1371347972	/nfs/dbraw/zinc/34/79/72/1371347972.db2.gz	MQZIURSGJSHPQI-SFHVURJKSA-N	0	3	342.826	3.179	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)CCOc2ccc(C)c(C)c2)C1	ZINC001207351388	1371368635	/nfs/dbraw/zinc/36/86/35/1371368635.db2.gz	LPJMKHPFKMPABH-IEBWSBKVSA-N	0	3	330.472	3.085	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC[C@@H](NCC#Cc2ccccc2Cl)C1	ZINC001207363015	1371374311	/nfs/dbraw/zinc/37/43/11/1371374311.db2.gz	KTPZJJFVGFGKIG-DOTOQJQBSA-N	0	3	332.875	3.318	20	30		EGEDHN
CC[C@H](C)N[C@H](CNC(=O)Nc1sccc1C#N)c1ccco1	ZINC001119831574	1371410400	/nfs/dbraw/zinc/41/04/00/1371410400.db2.gz	YZFAMZTVVZWSML-WCQYABFASA-N	0	3	332.429	3.464	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H](NCc2cc(F)c(OC)c(F)c2)C1	ZINC001207653696	1371465631	/nfs/dbraw/zinc/46/56/31/1371465631.db2.gz	KAOHOVOYHPMLPV-CQSZACIVSA-N	0	3	338.398	3.020	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CCc2cscn2)CCCCC1	ZINC001120239888	1371511040	/nfs/dbraw/zinc/51/10/40/1371511040.db2.gz	ITZOYOHZGWDINA-UHFFFAOYSA-N	0	3	341.908	3.237	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N1CCC[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001207820044	1371511952	/nfs/dbraw/zinc/51/19/52/1371511952.db2.gz	OJTPMLMKTKFANE-DLBZAZTESA-N	0	3	344.886	3.318	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)C#CC(C)(C)C)C1	ZINC001120372803	1371552366	/nfs/dbraw/zinc/55/23/66/1371552366.db2.gz	JFKIHEHGEBWYDI-IRXDYDNUSA-N	0	3	336.907	3.491	20	30		EGEDHN
Cc1ccc(CN[C@@H]2CCCN(C(=O)C#CC(C)C)C2)c(Cl)c1	ZINC001208005326	1371565787	/nfs/dbraw/zinc/56/57/87/1371565787.db2.gz	CMARIOBSKNAODQ-QGZVFWFLSA-N	0	3	332.875	3.388	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@@H](NCc2cn(C(C)C)nc2C)C1	ZINC001208239501	1371672790	/nfs/dbraw/zinc/67/27/90/1371672790.db2.gz	BJPMYKHAPABZHO-GOSISDBHSA-N	0	3	346.519	3.455	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC[C@@H](NCc2cn(C(C)C)nc2C)C1	ZINC001208258551	1371687444	/nfs/dbraw/zinc/68/74/44/1371687444.db2.gz	LSNBQFHOHWEQIL-GOSISDBHSA-N	0	3	332.492	3.209	20	30		EGEDHN
C=CCCC(=O)NC1CC2(CC(NCc3cccc(F)c3F)C2)C1	ZINC001120787515	1371758709	/nfs/dbraw/zinc/75/87/09/1371758709.db2.gz	PQNRKLJPWKFTKW-UHFFFAOYSA-N	0	3	334.410	3.448	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN(Cc2ccc(OC)c(C)c2)C[C@H]1C	ZINC001208458270	1371774635	/nfs/dbraw/zinc/77/46/35/1371774635.db2.gz	AZCMWPJJJAOWHG-SJLPKXTDSA-N	0	3	330.472	3.296	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1CN(CCc2scnc2C)C[C@H]1C	ZINC001208512182	1371795038	/nfs/dbraw/zinc/79/50/38/1371795038.db2.gz	YRGAHIFUMOHVSS-SIIHOXLZSA-N	0	3	335.517	3.033	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@@H](C)CCc2ccccc2F)C1	ZINC001208574864	1371823185	/nfs/dbraw/zinc/82/31/85/1371823185.db2.gz	HMPIERJCDHXHID-FRQCXROJSA-N	0	3	332.463	3.407	20	30		EGEDHN
COc1ccc(N2CCN(CCCc3ccc(C#N)cc3)CC2)cc1	ZINC001208859532	1371922167	/nfs/dbraw/zinc/92/21/67/1371922167.db2.gz	CZNGWJOUQDFKAZ-UHFFFAOYSA-N	0	3	335.451	3.322	20	30		EGEDHN
N#Cc1ccc(CCN2CCC[C@@H](N3Cc4ccccc4C3=O)C2)cc1	ZINC001208929520	1371949297	/nfs/dbraw/zinc/94/92/97/1371949297.db2.gz	UIWXNIGUXQHJBJ-HXUWFJFHSA-N	0	3	345.446	3.221	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)CCc2cc(Cl)cs2)C1	ZINC001208964228	1371964685	/nfs/dbraw/zinc/96/46/85/1371964685.db2.gz	XJDALMADOAQDEP-IUODEOHRSA-N	0	3	326.893	3.347	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N1CCC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001209051424	1371983471	/nfs/dbraw/zinc/98/34/71/1371983471.db2.gz	JCDZTAROGDIDEG-HUJBZGQLSA-N	0	3	341.430	3.300	20	30		EGEDHN
C#CCCCCCC(=O)NC1CC2(CC(NCc3conc3C)C2)C1	ZINC001121534891	1372003271	/nfs/dbraw/zinc/00/32/71/1372003271.db2.gz	YNLREDWOLKDBFX-UHFFFAOYSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@@H](NCc2ccnc(Cl)c2)C1	ZINC001209145737	1372014199	/nfs/dbraw/zinc/01/41/99/1372014199.db2.gz	HBBFCJIUMACNIZ-GDBMZVCRSA-N	0	3	335.879	3.418	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NC1CC2(CC(NCc3conc3CC)C2)C1	ZINC001121610729	1372023872	/nfs/dbraw/zinc/02/38/72/1372023872.db2.gz	MEWRALSDFMMAPL-SOGFUBIXSA-N	0	3	345.487	3.212	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC1CC2(CC(NCc3nccn3CC)C2)C1	ZINC001121616174	1372026232	/nfs/dbraw/zinc/02/62/32/1372026232.db2.gz	CDOLQCUCUOCYLV-AKJOHPPZSA-N	0	3	344.503	3.022	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC1CC2(C1)CC(N[C@@H](C)c1cnccn1)C2	ZINC001121616613	1372026886	/nfs/dbraw/zinc/02/68/86/1372026886.db2.gz	MUWBGOMOZFGTAM-QTNZZUQDSA-N	0	3	342.487	3.157	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC[C@H](NCc2cc(CO)ccc2F)C1	ZINC001209182231	1372026983	/nfs/dbraw/zinc/02/69/83/1372026983.db2.gz	BHSXORABUNPYTK-YJBOKZPZSA-N	0	3	348.462	3.001	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC1CC2(C1)CC(N[C@H](C)c1cnccn1)C2	ZINC001121616663	1372027105	/nfs/dbraw/zinc/02/71/05/1372027105.db2.gz	NUWUVFOLVGZHDJ-USWDQHPYSA-N	0	3	342.487	3.157	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@H](NCc2cnn(C(C)(C)C)c2)C1	ZINC001209183025	1372028028	/nfs/dbraw/zinc/02/80/28/1372028028.db2.gz	KVBPNHCQBPRITF-FUHWJXTLSA-N	0	3	346.519	3.321	20	30		EGEDHN
C=CCCCC(=O)NC1CC2(CC(NCC(=C)Br)C2)C1	ZINC001121662656	1372039012	/nfs/dbraw/zinc/03/90/12/1372039012.db2.gz	AVNGOCYAKOGYFJ-UHFFFAOYSA-N	0	3	341.293	3.268	20	30		EGEDHN
C=CCCCC(=O)NC1CC2(CC(NCc3ccn(C(C)C)n3)C2)C1	ZINC001121674290	1372042840	/nfs/dbraw/zinc/04/28/40/1372042840.db2.gz	CRHZFLWETVAGTE-UHFFFAOYSA-N	0	3	344.503	3.337	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC1CC2(CC(NCc3nccs3)C2)C1	ZINC001121842187	1372099250	/nfs/dbraw/zinc/09/92/50/1372099250.db2.gz	YKCZMUGGNKIQGC-UHFFFAOYSA-N	0	3	333.501	3.262	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)NCc1ccc(-c2csc(C)n2)cc1	ZINC001121858836	1372105198	/nfs/dbraw/zinc/10/51/98/1372105198.db2.gz	KZBGBRMGFMIAQZ-INIZCTEOSA-N	0	3	329.469	3.418	20	30		EGEDHN
C=CCCCCCCN1CCCn2cnc(Cn3cccn3)c2C1	ZINC001209437647	1372106397	/nfs/dbraw/zinc/10/63/97/1372106397.db2.gz	PQRVCEYQJZLECG-UHFFFAOYSA-N	0	3	327.476	3.470	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)C[C@H](C)c1cccnc1)C2	ZINC001121867083	1372107993	/nfs/dbraw/zinc/10/79/93/1372107993.db2.gz	JWJRFMBHSQWYBE-UNSYWJDTSA-N	0	3	347.890	3.345	20	30		EGEDHN
O=C(N1CCC[C@H](NCC#Cc2ccc(Cl)cc2)C1)C1(CF)CC1	ZINC001209567894	1372138908	/nfs/dbraw/zinc/13/89/08/1372138908.db2.gz	JEIYRBQTFPIBDL-KRWDZBQOSA-N	0	3	348.849	3.022	20	30		EGEDHN
O=C(N1CCC[C@@H](NCC#Cc2cccc(Cl)c2)C1)C1(CF)CC1	ZINC001209576793	1372141880	/nfs/dbraw/zinc/14/18/80/1372141880.db2.gz	ACPFEUATVGVNGO-QGZVFWFLSA-N	0	3	348.849	3.022	20	30		EGEDHN
CC(C)CCCC(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001209777463	1372193296	/nfs/dbraw/zinc/19/32/96/1372193296.db2.gz	WRWZWOKAJXICTD-FQEVSTJZSA-N	0	3	326.484	3.445	20	30		EGEDHN
CC(C)C[C@H](C)C(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001210359414	1372332717	/nfs/dbraw/zinc/33/27/17/1372332717.db2.gz	WNWJESCRBJHRGA-PXNSSMCTSA-N	0	3	344.474	3.440	20	30		EGEDHN
C[C@H](CC(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1)n1cccc1	ZINC001210736021	1372416532	/nfs/dbraw/zinc/41/65/32/1372416532.db2.gz	HNEHWBVHXUMPMA-TZIWHRDSSA-N	0	3	349.478	3.072	20	30		EGEDHN
CCN1CCN(Cc2ccc(NC3=CC(=O)C[C@H](C)C3)cc2)CC1	ZINC001210775796	1372424976	/nfs/dbraw/zinc/42/49/76/1372424976.db2.gz	MBNBCCVZGVYRGU-MRXNPFEDSA-N	0	3	327.472	3.119	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)c2ccc([C@@H](C)CC)cc2)C1	ZINC001211384295	1372545921	/nfs/dbraw/zinc/54/59/21/1372545921.db2.gz	MJIWVRJLGHITNB-SQGPQFPESA-N	0	3	344.499	3.453	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2CN(CCOCCCC)C[C@H]2C)CCCCC1	ZINC001211405822	1372552769	/nfs/dbraw/zinc/55/27/69/1372552769.db2.gz	GOWXTZRMFPWZAJ-RTBURBONSA-N	0	3	348.531	3.213	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2CN(CCOCC(C)C)C[C@H]2C)CCCCC1	ZINC001211411035	1372553847	/nfs/dbraw/zinc/55/38/47/1372553847.db2.gz	UMIBGAREPXUSMY-RTBURBONSA-N	0	3	348.531	3.069	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2c(C)coc2C)C[C@H]1c1ccccc1	ZINC001211588442	1372586611	/nfs/dbraw/zinc/58/66/11/1372586611.db2.gz	NQEUYCXEDZRGFX-RBUKOAKNSA-N	0	3	336.435	3.118	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@]2(C)C[C@H]3C[C@H]3C2)C[C@H]1c1ccccc1	ZINC001211642542	1372594083	/nfs/dbraw/zinc/59/40/83/1372594083.db2.gz	IDEVSTCFSHGHMX-YWQQVWADSA-N	0	3	336.479	3.030	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](NC/C=C\Cl)C1	ZINC001188009153	1388212443	/nfs/dbraw/zinc/21/24/43/1388212443.db2.gz	FBQQQUUWCOWEEE-HZUVFCDBSA-N	0	3	332.875	3.364	20	30		EGEDHN
CCCCCCCCS(=O)(=O)N1CCC[C@@H]1CN1CCCC1	ZINC001188010944	1388213539	/nfs/dbraw/zinc/21/35/39/1388213539.db2.gz	STIGHTBOYWNXMD-QGZVFWFLSA-N	0	3	330.538	3.237	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)C(C)(C)CC(F)F)[C@H](OC)C1	ZINC001212397018	1372699516	/nfs/dbraw/zinc/69/95/16/1372699516.db2.gz	BAMCEHBUORLNEX-HUUCEWRRSA-N	0	3	346.462	3.230	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CN(Cc2c(C)cccc2C)C[C@H]1OC	ZINC001213317489	1372882717	/nfs/dbraw/zinc/88/27/17/1372882717.db2.gz	MBTNPPNIVPJDGL-DFQSSKMNSA-N	0	3	344.499	3.221	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H](NC(=O)c2coc(C(F)F)c2)[C@H](OC)C1	ZINC001213333687	1372886057	/nfs/dbraw/zinc/88/60/57/1372886057.db2.gz	MEQWUVYPNHHRST-UXIGCNINSA-N	0	3	342.386	3.001	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CN(CCCc2ccccc2)C[C@H]1OC	ZINC001213494242	1372913776	/nfs/dbraw/zinc/91/37/76/1372913776.db2.gz	UNEWJMMZUSAHPA-RTBURBONSA-N	0	3	344.499	3.037	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2ccc3sccc3c2)[C@H](OC)C1	ZINC001213655127	1372940734	/nfs/dbraw/zinc/94/07/34/1372940734.db2.gz	CNQTXLGRCWYEGH-IAGOWNOFSA-N	0	3	344.480	3.297	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)[C@H](F)CCCCCC)[C@H](OC)C1	ZINC001213723462	1372952461	/nfs/dbraw/zinc/95/24/61/1372952461.db2.gz	JQEUFHJDUKIPCP-BRWVUGGUSA-N	0	3	328.472	3.077	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)[C@H](CCC)c2ccccc2)[C@H](OC)C1	ZINC001213819315	1372966813	/nfs/dbraw/zinc/96/68/13/1372966813.db2.gz	QPQXTPZBWZTYCN-VAMGGRTRSA-N	0	3	344.499	3.352	20	30		EGEDHN
Cc1ccccc1C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2)C1	ZINC001214070795	1373003254	/nfs/dbraw/zinc/00/32/54/1373003254.db2.gz	XJLAKPGFOHEBAR-WIYYLYMNSA-N	0	3	332.447	3.097	20	30		EGEDHN
CC(C)C#CC(=O)NCCNCc1sc2ccccc2c1Cl	ZINC001126834543	1373038010	/nfs/dbraw/zinc/03/80/10/1373038010.db2.gz	RGLHIHQBVLDZBT-UHFFFAOYSA-N	0	3	334.872	3.420	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@H](NCc2ccc(Cl)cc2OC)C1	ZINC001214304556	1373040599	/nfs/dbraw/zinc/04/05/99/1373040599.db2.gz	ZKTDSCNPZNDRHE-CZUORRHYSA-N	0	3	336.863	3.251	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@@H](C)[C@H](NCc2ccccc2Cl)C1	ZINC001214466364	1373065980	/nfs/dbraw/zinc/06/59/80/1373065980.db2.gz	MWFWNRLWGBQJDB-CRAIPNDOSA-N	0	3	332.875	3.470	20	30		EGEDHN
C[C@@H]1CN(C(=O)C[C@@H]2C=CCCC2)C[C@H]1NCC#Cc1ccccc1	ZINC001214944487	1373146139	/nfs/dbraw/zinc/14/61/39/1373146139.db2.gz	UTEMHPYRPSGZRX-HMXCVIKNSA-N	0	3	336.479	3.221	20	30		EGEDHN
C=C(C)CNCc1ccncc1O[C@H]1CCN(C(=O)[C@@H](C)C(C)C)C1	ZINC001127898709	1373197789	/nfs/dbraw/zinc/19/77/89/1373197789.db2.gz	YYHWQVOCLVPGJR-WMZOPIPTSA-N	0	3	345.487	3.019	20	30		EGEDHN
C=C(C)CCC(=O)NCCNCc1cnc(-c2ccccc2)s1	ZINC001128413587	1373263741	/nfs/dbraw/zinc/26/37/41/1373263741.db2.gz	HRLYPESZBBEHIF-UHFFFAOYSA-N	0	3	329.469	3.372	20	30		EGEDHN
CC(C)c1ccccc1C(=O)NCCNCc1ccc(C#N)s1	ZINC001128869847	1373318446	/nfs/dbraw/zinc/31/84/46/1373318446.db2.gz	QNDJUXAXXNOJNL-UHFFFAOYSA-N	0	3	327.453	3.263	20	30		EGEDHN
Cc1cccc2c(C(=O)NCCNCc3cccc(C#N)c3)coc21	ZINC001129539164	1373395074	/nfs/dbraw/zinc/39/50/74/1373395074.db2.gz	LEVDLGYKIWFMBB-UHFFFAOYSA-N	0	3	333.391	3.133	20	30		EGEDHN
C=C(C)CN1CC[C@H](Oc2cnccc2CNC(=O)[C@@H](C)CCC)C1	ZINC001130313161	1373489651	/nfs/dbraw/zinc/48/96/51/1373489651.db2.gz	NWMNWYJAPQIUDZ-WMZOPIPTSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NCCN[C@@H](C)c1cccc(F)c1	ZINC001130376389	1373509767	/nfs/dbraw/zinc/50/97/67/1373509767.db2.gz	TYLOZQCIIFHXLQ-HNNXBMFYSA-N	0	3	342.414	3.471	20	30		EGEDHN
O=C(/C=C/c1ccc(O[C@H]2CC[C@@H]3NCCO[C@@H]32)cc1)c1ccccc1	ZINC001218116889	1373563274	/nfs/dbraw/zinc/56/32/74/1373563274.db2.gz	SKXTVYITAQPFAM-HUDYBKFWSA-N	0	3	349.430	3.481	20	30		EGEDHN
C=C[C@H](CCCCCC)Oc1cc(C[C@H](N)C(=O)N(C)C)ccc1O	ZINC001218355641	1373601859	/nfs/dbraw/zinc/60/18/59/1373601859.db2.gz	TYHBANKMSLZJPB-SJORKVTESA-N	0	3	348.487	3.254	20	30		EGEDHN
N#Cc1c2ccccc2sc1NC(=O)[C@@H](N)C1Cc2ccccc2C1	ZINC001218648874	1373640480	/nfs/dbraw/zinc/64/04/80/1373640480.db2.gz	MHEANIXQOQZJFV-SFHVURJKSA-N	0	3	347.443	3.454	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)Nc1cnc2c(C(C)(C)C)cnn2c1	ZINC001218747517	1373650021	/nfs/dbraw/zinc/65/00/21/1373650021.db2.gz	AAAIZSXVVVSACC-INIZCTEOSA-N	0	3	343.475	3.429	20	30		EGEDHN
N#Cc1ccc(F)c(F)c1NC(=O)[C@H](N)C12CC3CC(CC(C3)C1)C2	ZINC001219317183	1373699974	/nfs/dbraw/zinc/69/99/74/1373699974.db2.gz	QYUFTAMCFZBFQH-LHZRQFJVSA-N	0	3	345.393	3.319	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C1(CC(C)C)CC1)C[C@H](C)O2	ZINC001131665702	1373751363	/nfs/dbraw/zinc/75/13/63/1373751363.db2.gz	IRLMOMBQQGCUHI-FXAWDEMLSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)N[C@@H](CC1CCCCC1)C(=O)OC	ZINC001220300823	1373765053	/nfs/dbraw/zinc/76/50/53/1373765053.db2.gz	BFUUATDBCJXTLQ-IRXDYDNUSA-N	0	3	338.492	3.078	20	30		EGEDHN
C=CCCCN1CC[C@@H]2CN(C(=O)c3sc(C4CC4)nc3C)[C@@H]2C1	ZINC001221547187	1373778996	/nfs/dbraw/zinc/77/89/96/1373778996.db2.gz	HQVRKYLDPQHOSM-HZPDHXFCSA-N	0	3	345.512	3.441	20	30		EGEDHN
C=CCOCCN1CC[C@@H]2CN(C(=O)CCCCCC(C)C)[C@@H]2C1	ZINC001221853490	1373799328	/nfs/dbraw/zinc/79/93/28/1373799328.db2.gz	LJPYCHWBCYQCNU-RTBURBONSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@@H](C)N(Cc2cccc3c2CCOC3)C1	ZINC001131896550	1375033583	/nfs/dbraw/zinc/03/35/83/1375033583.db2.gz	TYAQMTQYQZVYBG-VQIMIIECSA-N	0	3	342.483	3.195	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@@H](C)N(Cc2ccc(COC)cc2)C1	ZINC001131899679	1375035413	/nfs/dbraw/zinc/03/54/13/1375035413.db2.gz	NWSHOPHXXKFGQF-VQIMIIECSA-N	0	3	330.472	3.268	20	30		EGEDHN
CCC1(C(=O)NCC2CCN(Cc3ccc(C#N)cc3)CC2)CCC1	ZINC001224174463	1375059572	/nfs/dbraw/zinc/05/95/72/1375059572.db2.gz	XIFSYHJJELWNJO-UHFFFAOYSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=C(Cl)CN1CCC(CNC(=O)CN(C)CCCCCC)CC1	ZINC001224884131	1375082154	/nfs/dbraw/zinc/08/21/54/1375082154.db2.gz	OROBHFDNKWLBJO-UHFFFAOYSA-N	0	3	343.943	3.079	20	30		EGEDHN
Cc1cc2[nH]c(C(=O)NCCNCc3cccc(C#N)c3)cc2c(C)c1	ZINC001131994470	1375086855	/nfs/dbraw/zinc/08/68/55/1375086855.db2.gz	QFRJHIJXPKLUKJ-UHFFFAOYSA-N	0	3	346.434	3.176	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@@H](C)N(Cc2ccc3c(c2)CCC3)C1	ZINC001131994997	1375087899	/nfs/dbraw/zinc/08/78/99/1375087899.db2.gz	FLEBUHUXSASDED-DYESRHJHSA-N	0	3	338.495	3.448	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@H](C)N(CCc2ccccc2F)C1	ZINC001132002014	1375092272	/nfs/dbraw/zinc/09/22/72/1375092272.db2.gz	GILLUQDDXSXOGJ-FUHWJXTLSA-N	0	3	330.447	3.141	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2csc3ccccc23)c1	ZINC001132013816	1375098878	/nfs/dbraw/zinc/09/88/78/1375098878.db2.gz	RPAQLTLJWZUGTE-UHFFFAOYSA-N	0	3	335.432	3.293	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1CC[C@@H](C)N(CCCOc2ccccc2)C1	ZINC001132025380	1375104851	/nfs/dbraw/zinc/10/48/51/1375104851.db2.gz	PFCBEQQRPNVKRF-RTBURBONSA-N	0	3	342.483	3.084	20	30		EGEDHN
C[C@@H]1CC[C@H](NC(=O)C#CC(C)(C)C)CN1CCc1cccs1	ZINC001132039318	1375111627	/nfs/dbraw/zinc/11/16/27/1375111627.db2.gz	YGZMSNKCQFZMTB-CVEARBPZSA-N	0	3	332.513	3.309	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1CC[C@@H](C)N(CCOC2CCC2)C1	ZINC001132057311	1375123200	/nfs/dbraw/zinc/12/32/00/1375123200.db2.gz	NAJPWFAOMIDZTB-SJLPKXTDSA-N	0	3	334.504	3.293	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H]1CC[C@H](C)N(CCOC2CCC2)C1	ZINC001132079393	1375136108	/nfs/dbraw/zinc/13/61/08/1375136108.db2.gz	XZXJIWZOBLDDSZ-DZGCQCFKSA-N	0	3	342.911	3.303	20	30		EGEDHN
C#CC[C@H](CC(=O)NCC1CCN(CC#CC)CC1)c1ccccc1	ZINC001225683832	1375143943	/nfs/dbraw/zinc/14/39/43/1375143943.db2.gz	GGIKHKVHUUZIIQ-OAQYLSRUSA-N	0	3	336.479	3.035	20	30		EGEDHN
C[C@@H](N[C@@H]1CCCC[C@H]1NC(=O)C#CC1CC1)c1ccc(F)cc1F	ZINC001226134125	1375208806	/nfs/dbraw/zinc/20/88/06/1375208806.db2.gz	SKVSONLTIKCNQE-UPRAQXHNSA-N	0	3	346.421	3.456	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2ccc(CCC)cc2)CC[C@H]1C	ZINC001132246329	1375241511	/nfs/dbraw/zinc/24/15/11/1375241511.db2.gz	SALCOMQOFWEYTC-XLIONFOSSA-N	0	3	344.499	3.424	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2CC[C@H](C)N(CCOC3CCC3)C2)CCC1	ZINC001132283010	1375265150	/nfs/dbraw/zinc/26/51/50/1375265150.db2.gz	PTLMEYVFFYYLAP-IRXDYDNUSA-N	0	3	334.504	3.271	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCc2ccc(F)cc2F)CC[C@@H]1C	ZINC001132392343	1375347232	/nfs/dbraw/zinc/34/72/32/1375347232.db2.gz	IMCXBYKAFILZEP-YOEHRIQHSA-N	0	3	336.426	3.443	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2cc(C)ccc2C)CC[C@@H]1C	ZINC001132444724	1375388290	/nfs/dbraw/zinc/38/82/90/1375388290.db2.gz	FEZOHZALHBKFKL-ROUUACIJSA-N	0	3	330.472	3.089	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)NC1CCN([C@@H](CC)c2ccc(F)cc2)CC1	ZINC001227124590	1375394423	/nfs/dbraw/zinc/39/44/23/1375394423.db2.gz	VONILTMKLSPIEV-ICSRJNTNSA-N	0	3	348.462	3.185	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COc2ccc(CC)cc2)CC[C@@H]1C	ZINC001132462389	1375405263	/nfs/dbraw/zinc/40/52/63/1375405263.db2.gz	ZKHFDJPYYXCOKJ-WMZOPIPTSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COc2ccccc2Cl)CC[C@@H]1C	ZINC001132487317	1375420877	/nfs/dbraw/zinc/42/08/77/1375420877.db2.gz	TUXHEZFUMMNKCY-GJZGRUSLSA-N	0	3	336.863	3.264	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCCOc2cccc(F)c2)CC[C@@H]1C	ZINC001132508441	1375432110	/nfs/dbraw/zinc/43/21/10/1375432110.db2.gz	KAESGMJRASSKTG-RDJZCZTQSA-N	0	3	334.435	3.140	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CN(CC)c2ccccc2)CC[C@H]1C	ZINC001132509548	1375432796	/nfs/dbraw/zinc/43/27/96/1375432796.db2.gz	WRLSXGCBYCUCKQ-QZTJIDSGSA-N	0	3	329.488	3.058	20	30		EGEDHN
C#CCC1(C(=O)N[C@H]2CC[C@H](C)N(CCOCC=C)C2)CCCCC1	ZINC001132529622	1375443230	/nfs/dbraw/zinc/44/32/30/1375443230.db2.gz	PCNKKXKBQDXTRL-OALUTQOASA-N	0	3	346.515	3.132	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1CC[C@H](C)N(Cc2ccccc2CC)C1	ZINC001132529174	1375443282	/nfs/dbraw/zinc/44/32/82/1375443282.db2.gz	JMULVYCHUJEWAR-PXNSSMCTSA-N	0	3	344.499	3.311	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1CC[C@H](C)N(Cc2ccc(CC)cc2)C1	ZINC001132532634	1375444962	/nfs/dbraw/zinc/44/49/62/1375444962.db2.gz	GDOXUFSVOLEFBU-PXNSSMCTSA-N	0	3	344.499	3.311	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2coc3ccccc32)CC[C@@H]1C	ZINC001132536463	1375445419	/nfs/dbraw/zinc/44/54/19/1375445419.db2.gz	AVLXOHIOCFZOTL-JKSUJKDBSA-N	0	3	342.439	3.218	20	30		EGEDHN
C=C(C)CCC(=O)NC1CCN(CCOc2cccc(C)c2)CC1	ZINC001227607274	1375452903	/nfs/dbraw/zinc/45/29/03/1375452903.db2.gz	NJTAQAUGGHKYQO-UHFFFAOYSA-N	0	3	330.472	3.311	20	30		EGEDHN
CC#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)CC2CC2)CC1	ZINC001132551885	1375457842	/nfs/dbraw/zinc/45/78/42/1375457842.db2.gz	NRPBGKDQFRRZFB-FQEVSTJZSA-N	0	3	339.483	3.088	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2N(Cc2ccsc2)C(=O)[C@@H](F)CC)CC1	ZINC001132561896	1375468578	/nfs/dbraw/zinc/46/85/78/1375468578.db2.gz	BMOISVXBNJNTGU-IRXDYDNUSA-N	0	3	348.487	3.313	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2N(Cc2nccs2)C(=O)[C@@H](C)CC)CC1	ZINC001132566094	1375470301	/nfs/dbraw/zinc/47/03/01/1375470301.db2.gz	HTEOLYUBQDLPGN-JKSUJKDBSA-N	0	3	345.512	3.006	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CCCC[C@H]1NCc1cc(OC)ccn1	ZINC001227916797	1375491007	/nfs/dbraw/zinc/49/10/07/1375491007.db2.gz	IZMJVELNRKPDSY-QZTJIDSGSA-N	0	3	345.487	3.210	20	30		EGEDHN
CCCCC(=O)N1CC[C@@H](C)[C@H](CNCc2ccccc2C#N)C1	ZINC001132669939	1375506533	/nfs/dbraw/zinc/50/65/33/1375506533.db2.gz	LBIULKZQNHYMGG-VQIMIIECSA-N	0	3	327.472	3.323	20	30		EGEDHN
CCCCCCC[NH2+][C@@H]1CCCC[C@H]1NC(=O)c1c(C)nc[n-]c1=O	ZINC001228138630	1375520109	/nfs/dbraw/zinc/52/01/09/1375520109.db2.gz	UPUIFJYGCRANDW-HZPDHXFCSA-N	0	3	348.491	3.092	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](C)[C@H](CNCc2csc(CC)n2)C1	ZINC001132701549	1375523145	/nfs/dbraw/zinc/52/31/45/1375523145.db2.gz	TZELHRJRVVTIQP-LSDHHAIUSA-N	0	3	335.517	3.246	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](C)[C@H](CNCc2ccn(CC)n2)C1	ZINC001132847068	1375600224	/nfs/dbraw/zinc/60/02/24/1375600224.db2.gz	RMIMTTCKGYGTMM-IAGOWNOFSA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](C)[C@@H](CNCc2cc(C3CC3)no2)C1	ZINC001132866150	1375609850	/nfs/dbraw/zinc/60/98/50/1375609850.db2.gz	WNRVSYCDDWBRBH-RDJZCZTQSA-N	0	3	345.487	3.483	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CCN(Cc2ccc3c(c2)CCC3)CC1	ZINC001228621993	1375618883	/nfs/dbraw/zinc/61/88/83/1375618883.db2.gz	IULJDVSXZSIJAO-UHFFFAOYSA-N	0	3	326.484	3.468	20	30		EGEDHN
CC#CCCCC(=O)NC1CCN(Cc2ccc(COC)cc2)CC1	ZINC001228717291	1375652135	/nfs/dbraw/zinc/65/21/35/1375652135.db2.gz	DRVRFRKIPYOUDH-UHFFFAOYSA-N	0	3	342.483	3.107	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NC1CCN(Cc2sc(C)nc2C)CC1	ZINC001228759718	1375666697	/nfs/dbraw/zinc/66/66/97/1375666697.db2.gz	CCNCBDSNRARGGU-QWHCGFSZSA-N	0	3	335.517	3.299	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC1CCN(CCc2scnc2C)CC1	ZINC001228801610	1375681816	/nfs/dbraw/zinc/68/18/16/1375681816.db2.gz	UJJNATSJRGYPOP-CQSZACIVSA-N	0	3	335.517	3.177	20	30		EGEDHN
C=CCCCC(=O)NC1CCN(C[C@H](O)c2ccc(CC)cc2)CC1	ZINC001228927399	1375717488	/nfs/dbraw/zinc/71/74/88/1375717488.db2.gz	AMXPIYYSRJBXFL-FQEVSTJZSA-N	0	3	344.499	3.219	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)C[C@@H]2CCCC(C)(C)C2)CC1	ZINC001230035835	1375934172	/nfs/dbraw/zinc/93/41/72/1375934172.db2.gz	XLLBZVMROXSEKL-KRWDZBQOSA-N	0	3	336.520	3.376	20	30		EGEDHN
C#CCCCCC(=O)N(CCNCC#CC)Cc1cccc(Cl)c1	ZINC001133392696	1375978394	/nfs/dbraw/zinc/97/83/94/1375978394.db2.gz	JMVNZNNHIJANMO-UHFFFAOYSA-N	0	3	344.886	3.475	20	30		EGEDHN
C#CCCCCC(=O)N(CCNCCF)Cc1cccc(Cl)c1	ZINC001133392767	1375978666	/nfs/dbraw/zinc/97/86/66/1375978666.db2.gz	MEYFIBISQNEAGA-UHFFFAOYSA-N	0	3	338.854	3.421	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NC1CCN(Cc2cc3ccccc3o2)CC1	ZINC001230406679	1376021587	/nfs/dbraw/zinc/02/15/87/1376021587.db2.gz	BKXUNTGDAKWOFI-HNNXBMFYSA-N	0	3	342.439	3.105	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)c1ccc(F)cc1	ZINC001133550474	1376079866	/nfs/dbraw/zinc/07/98/66/1376079866.db2.gz	PZNNDXZDIXVVHF-NWDGAFQWSA-N	0	3	343.240	3.221	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)c1sccc1C	ZINC001133560491	1376089502	/nfs/dbraw/zinc/08/95/02/1376089502.db2.gz	VMNQDTOVFQADQM-NEPJUHHUSA-N	0	3	345.306	3.452	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1ccccc1C#N)NC(=O)Cc1ccsc1	ZINC001133563725	1376091323	/nfs/dbraw/zinc/09/13/23/1376091323.db2.gz	LRDDWWQYZWRXIS-LSDHHAIUSA-N	0	3	341.480	3.235	20	30		EGEDHN
CC(C)[C@@H](Cc1ccccc1)C(=O)NCCNCc1cccc(C#N)c1	ZINC001133777074	1376203550	/nfs/dbraw/zinc/20/35/50/1376203550.db2.gz	UXNZVKUBRJLTKB-OAQYLSRUSA-N	0	3	349.478	3.279	20	30		EGEDHN
C[C@@H](C#N)C(=O)N(C)C[C@@H]1CCN1CCc1ccc2ccccc2c1	ZINC001231292691	1376222985	/nfs/dbraw/zinc/22/29/85/1376222985.db2.gz	FDWQUNFHDBGNDR-JXFKEZNVSA-N	0	3	335.451	3.075	20	30		EGEDHN
CC(=O)NC1CCN(Cc2ccccc2C#Cc2ccccc2)CC1	ZINC001231579262	1376270109	/nfs/dbraw/zinc/27/01/09/1376270109.db2.gz	VKIHAYXHYFQFJI-UHFFFAOYSA-N	0	3	332.447	3.187	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc(F)c3ccccc23)cc1	ZINC001134171095	1376397467	/nfs/dbraw/zinc/39/74/67/1376397467.db2.gz	FISSQDGZSGPVOT-UHFFFAOYSA-N	0	3	347.393	3.370	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc(-c3ccccc3)o2)cc1	ZINC001134178947	1376401801	/nfs/dbraw/zinc/40/18/01/1376401801.db2.gz	UIUDRABUQSOODO-UHFFFAOYSA-N	0	3	345.402	3.338	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](C)C[C@@H](C)NCc2ccccc2C#N)co1	ZINC001134179356	1376403461	/nfs/dbraw/zinc/40/34/61/1376403461.db2.gz	UEETUOUZRVYEIU-ZIAGYGMSSA-N	0	3	325.412	3.146	20	30		EGEDHN
C#CCCCC(=O)N[C@@H](C)C[C@H](C)NCc1ccn(C(CC)CC)n1	ZINC001134206243	1376417457	/nfs/dbraw/zinc/41/74/57/1376417457.db2.gz	QULPDPPTMIPZPP-IRXDYDNUSA-N	0	3	346.519	3.421	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)c1ccoc1CC	ZINC001134248684	1376432828	/nfs/dbraw/zinc/43/28/28/1376432828.db2.gz	SXXXFQZQVYGCRF-NEPJUHHUSA-N	0	3	343.265	3.237	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)C1CC(C)(C)C1	ZINC001134255461	1376439048	/nfs/dbraw/zinc/43/90/48/1376439048.db2.gz	BDMCFXUJXFRYRH-NWDGAFQWSA-N	0	3	331.298	3.204	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H](C)C[C@@H](C)NCc1ccn(CC)n1	ZINC001134417972	1376521973	/nfs/dbraw/zinc/52/19/73/1376521973.db2.gz	CIURDXFEYUAXOL-CVEARBPZSA-N	0	3	332.492	3.044	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@H](C)C[C@H](C)NCc1nccn1CC	ZINC001134456802	1376547792	/nfs/dbraw/zinc/54/77/92/1376547792.db2.gz	DOBDUFYQSCYOAS-QWHCGFSZSA-N	0	3	340.899	3.055	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H](C)C[C@H](C)NCc1nccn1C(F)F	ZINC001134470027	1376554571	/nfs/dbraw/zinc/55/45/71/1376554571.db2.gz	LJAIIVZBKXVEQV-QWHCGFSZSA-N	0	3	328.407	3.007	20	30		EGEDHN
COc1cc(Cl)cc(F)c1CN1CCC2SC(=O)C=C2C1	ZINC001233000117	1376554794	/nfs/dbraw/zinc/55/47/94/1376554794.db2.gz	MPZBGOYQNKHERH-AWEZNQCLSA-N	0	3	327.808	3.262	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCC[C@@](O)(C(F)(F)F)[C@@H](C)C1	ZINC001233080515	1376566384	/nfs/dbraw/zinc/56/63/84/1376566384.db2.gz	NKDNYBVXFRNNAF-BBRMVZONSA-N	0	3	326.362	3.392	20	30		EGEDHN
CC(C)C#CC(=O)N(C)C[C@H]1CCN1CC1CCC(F)(F)CC1	ZINC001234162557	1376781563	/nfs/dbraw/zinc/78/15/63/1376781563.db2.gz	SZGJASZBZNALDR-MRXNPFEDSA-N	0	3	326.431	3.004	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N(C)C[C@H]2CCN2CCCC)cc1	ZINC001234255702	1376793207	/nfs/dbraw/zinc/79/32/07/1376793207.db2.gz	PPWFJQIBHIQUKS-GOSISDBHSA-N	0	3	328.456	3.035	20	30		EGEDHN
C=CCCCN1CC[C@@H]1CN(C)C(=O)c1csc([C@H]2CCCO2)n1	ZINC001234333454	1376812224	/nfs/dbraw/zinc/81/22/24/1376812224.db2.gz	KKQBZFIKHJJYFV-GDBMZVCRSA-N	0	3	349.500	3.107	20	30		EGEDHN
COc1ccc(CNCCNC(=O)[C@H](C)[C@H](C)C(C)(C)C)cc1C#N	ZINC001135177685	1376950836	/nfs/dbraw/zinc/95/08/36/1376950836.db2.gz	KBJJDWWCIDMFTR-CABCVRRESA-N	0	3	345.487	3.091	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](C)C[C@@H](C)NCc1csnc1OC	ZINC001135181574	1376954065	/nfs/dbraw/zinc/95/40/65/1376954065.db2.gz	RLHCVVFLRNEXBZ-OLZOCXBDSA-N	0	3	339.505	3.127	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H](C)C[C@@H](C)NCc1nc2ccccc2o1	ZINC001135236058	1376992502	/nfs/dbraw/zinc/99/25/02/1376992502.db2.gz	PRMSYQQIZYCRMW-CVEARBPZSA-N	0	3	341.455	3.394	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N[C@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001135242590	1376997438	/nfs/dbraw/zinc/99/74/38/1376997438.db2.gz	BOOBTKNCWCRUEO-FAQRCVTKSA-N	0	3	325.456	3.454	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H](C)C[C@H](C)NCc2nc(C)sc2C)C1	ZINC001135426984	1377090615	/nfs/dbraw/zinc/09/06/15/1377090615.db2.gz	KEIPTZWKJQMQQV-QWHCGFSZSA-N	0	3	335.517	3.489	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)C1(C(C)(F)F)CC1)NCc1ccccc1C#N	ZINC001135493269	1377117438	/nfs/dbraw/zinc/11/74/38/1377117438.db2.gz	SGWPVHMNGJUVPY-KBPBESRZSA-N	0	3	349.425	3.367	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1ccccc1C#N)NC(=O)C1(CF)CCC1	ZINC001135502103	1377121024	/nfs/dbraw/zinc/12/10/24/1377121024.db2.gz	WUCXDUADDFOQDK-LSDHHAIUSA-N	0	3	331.435	3.071	20	30		EGEDHN
CCCn1cc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)c(C)n1	ZINC001263306632	1377134764	/nfs/dbraw/zinc/13/47/64/1377134764.db2.gz	DFDZDCKVOXGGCE-GFCCVEGCSA-N	0	3	344.802	3.216	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)C1(C)CC(F)(F)C1)NCc1ccccc1C#N	ZINC001135906449	1377258017	/nfs/dbraw/zinc/25/80/17/1377258017.db2.gz	CHMZUSKRQWGGQA-KBPBESRZSA-N	0	3	349.425	3.367	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)CC(F)(F)F)CCCC[C@@H]1C	ZINC001267868489	1377475835	/nfs/dbraw/zinc/47/58/35/1377475835.db2.gz	MKEAZDZDZKOXFV-GXFFZTMASA-N	0	3	326.790	3.346	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CCN1Cc1ccc(OCC#N)cc1	ZINC001137119335	1377481449	/nfs/dbraw/zinc/48/14/49/1377481449.db2.gz	HLAWICGTIVQOHX-SFHVURJKSA-N	0	3	335.451	3.295	20	30		EGEDHN
Cc1cccnc1N1CCCN(Cc2ccc(OCC#N)cc2)CC1	ZINC001137119265	1377481609	/nfs/dbraw/zinc/48/16/09/1377481609.db2.gz	BVPWWRJXUWUZQV-UHFFFAOYSA-N	0	3	336.439	3.005	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)CCCOc2ccc(C)cc2)C1	ZINC001268113921	1377486780	/nfs/dbraw/zinc/48/67/80/1377486780.db2.gz	FFZFCULBSDRWQJ-GOSISDBHSA-N	0	3	330.472	3.311	20	30		EGEDHN
N#CC1(c2ccccc2)CCN(Cc2ccc(-n3ccnn3)cc2)CC1	ZINC001137360483	1377532359	/nfs/dbraw/zinc/53/23/59/1377532359.db2.gz	BEJOUOZOWAKKNP-UHFFFAOYSA-N	0	3	343.434	3.325	20	30		EGEDHN
C=CCOC(=O)N[C@H]1CCCN(Cc2c(C)n(C)c3ccccc23)C1	ZINC001138260540	1377695343	/nfs/dbraw/zinc/69/53/43/1377695343.db2.gz	JJTDTJRETATMGQ-INIZCTEOSA-N	0	3	341.455	3.363	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@H](F)[C@@](O)(C(F)(F)F)CC2)c1[O-]	ZINC001138625918	1377755559	/nfs/dbraw/zinc/75/55/59/1377755559.db2.gz	WYJQASJOCTTXQU-GOEBONIOSA-N	0	3	347.352	3.348	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@H](F)[C@@](O)(C(F)(F)F)CC2)c1[O-]	ZINC001138625918	1377755564	/nfs/dbraw/zinc/75/55/64/1377755564.db2.gz	WYJQASJOCTTXQU-GOEBONIOSA-N	0	3	347.352	3.348	20	30		EGEDHN
C=CCc1cccc(C[N@@H+](C)CCN(C)C(=O)OC(C)(C)C)c1[O-]	ZINC001138625135	1377755628	/nfs/dbraw/zinc/75/56/28/1377755628.db2.gz	ZBPBKRICHVLVTM-UHFFFAOYSA-N	0	3	334.460	3.419	20	30		EGEDHN
C=CCc1cccc(C[N@H+](C)CCN(C)C(=O)OC(C)(C)C)c1[O-]	ZINC001138625135	1377755631	/nfs/dbraw/zinc/75/56/31/1377755631.db2.gz	ZBPBKRICHVLVTM-UHFFFAOYSA-N	0	3	334.460	3.419	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CC(CNC(=O)OC(C)(C)C)C2)c1[O-]	ZINC001138625522	1377756072	/nfs/dbraw/zinc/75/60/72/1377756072.db2.gz	NPBYVLHULRTLJM-UHFFFAOYSA-N	0	3	332.444	3.077	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2C[C@@H]3CN(C(=O)OC(C)(C)C)[C@@H]3C2)c1[O-]	ZINC001138629526	1377756588	/nfs/dbraw/zinc/75/65/88/1377756588.db2.gz	BVZWGOYYABVCLU-IAGOWNOFSA-N	0	3	344.455	3.172	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2C[C@@H]3CN(C(=O)OC(C)(C)C)[C@@H]3C2)c1[O-]	ZINC001138629526	1377756589	/nfs/dbraw/zinc/75/65/89/1377756589.db2.gz	BVZWGOYYABVCLU-IAGOWNOFSA-N	0	3	344.455	3.172	20	30		EGEDHN
CCOc1ccc(CN2CCC3SC(=O)C=C3C2)c(OCC)c1	ZINC001138981764	1377812668	/nfs/dbraw/zinc/81/26/68/1377812668.db2.gz	WFIXPAKOZVMQKW-KRWDZBQOSA-N	0	3	333.453	3.258	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3c[nH]c4c3cccc4C#N)C2)C1=O	ZINC001139704185	1377937831	/nfs/dbraw/zinc/93/78/31/1377937831.db2.gz	UASWPEYZYWVAJM-NRFANRHFSA-N	0	3	348.450	3.040	20	30		EGEDHN
Cc1cccnc1N1CCCN(Cc2c[nH]c3c2cccc3C#N)CC1	ZINC001139702800	1377937884	/nfs/dbraw/zinc/93/78/84/1377937884.db2.gz	APVQYWJUUJSOCZ-UHFFFAOYSA-N	0	3	345.450	3.455	20	30		EGEDHN
N#Cc1cccc2c(CN3CC[C@H](N4CCCCC4)[C@@H](F)C3)c[nH]c21	ZINC001139707836	1377938593	/nfs/dbraw/zinc/93/85/93/1377938593.db2.gz	VNLJNKUFUAYOFS-OALUTQOASA-N	0	3	340.446	3.438	20	30		EGEDHN
Cc1ccc(CN2CCC[C@@H](C(=O)N3CCCCC3)C2)cc1C#N	ZINC001139723779	1377941588	/nfs/dbraw/zinc/94/15/88/1377941588.db2.gz	GCRYCDDLJZGTCB-GOSISDBHSA-N	0	3	325.456	3.091	20	30		EGEDHN
Cc1cc(O[C@H]2CCCN(Cc3c[nH]c4ccc(C#N)cc34)C2)ncn1	ZINC001140117783	1378012663	/nfs/dbraw/zinc/01/26/63/1378012663.db2.gz	YPKHMVNMEOFXJY-KRWDZBQOSA-N	0	3	347.422	3.181	20	30		EGEDHN
Cn1cnc2cc(CN3CCC[C@H](Oc4cccc(C#N)c4)C3)ccc21	ZINC001140508698	1378075844	/nfs/dbraw/zinc/07/58/44/1378075844.db2.gz	OIYUVXBYKNWGKU-IBGZPJMESA-N	0	3	346.434	3.488	20	30		EGEDHN
Cn1cnc2cc(CN3CCC[C@H](Oc4ccc(C#N)cc4)C3)ccc21	ZINC001140511872	1378077025	/nfs/dbraw/zinc/07/70/25/1378077025.db2.gz	LQSZTUDUHJWBDQ-IBGZPJMESA-N	0	3	346.434	3.488	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(C[C@@H](c4ccccc4)CO3)CC2)cn1	ZINC001140543476	1378081343	/nfs/dbraw/zinc/08/13/43/1378081343.db2.gz	OYCOOBGTOZISBK-LJQANCHMSA-N	0	3	333.435	3.492	20	30		EGEDHN
N#Cc1ccc(CN2CCc3ncnc(-c4ccccc4)c3CC2)cn1	ZINC001140543177	1378081374	/nfs/dbraw/zinc/08/13/74/1378081374.db2.gz	LVAYHXFQEQXNGY-UHFFFAOYSA-N	0	3	341.418	3.011	20	30		EGEDHN
C=C(C)CN1C[C@]2(CC1=O)CCCCN2Cc1ccc2c(c1)CCO2	ZINC001273007852	1378085188	/nfs/dbraw/zinc/08/51/88/1378085188.db2.gz	GGJJYTBSRZNGSD-OAQYLSRUSA-N	0	3	340.467	3.155	20	30		EGEDHN
N#Cc1cccc(N2CCC[C@@]3(CCCN(Cc4cn[nH]c4)C3)C2)c1	ZINC001276953012	1378197043	/nfs/dbraw/zinc/19/70/43/1378197043.db2.gz	FCULZGAMDMNDEP-HXUWFJFHSA-N	0	3	335.455	3.164	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCCN(Cc3ccn4ccnc4c3)C2)cc1	ZINC001141050044	1378222079	/nfs/dbraw/zinc/22/20/79/1378222079.db2.gz	YCERQSMTSPCKPV-IBGZPJMESA-N	0	3	332.407	3.249	20	30		EGEDHN
Cc1ccc(CN2CC[C@@H]3[C@@H]2CCN3Cc2ccc(F)cc2C#N)o1	ZINC001141164025	1378255990	/nfs/dbraw/zinc/25/59/90/1378255990.db2.gz	ZBLFDMIHQUNYIF-UXHICEINSA-N	0	3	339.414	3.448	20	30		EGEDHN
C#Cc1ccc(NC(=O)C2CCN(Cc3ccncc3)CC2)cc1F	ZINC001142347021	1378434666	/nfs/dbraw/zinc/43/46/66/1378434666.db2.gz	GHDPQXJUBCULLA-UHFFFAOYSA-N	0	3	337.398	3.053	20	30		EGEDHN
COc1cc(CN2CCC3SC(=O)C=C3C2)ccc1C(F)(F)F	ZINC001143343189	1378583735	/nfs/dbraw/zinc/58/37/35/1378583735.db2.gz	IIIALAWIDZMPPW-AWEZNQCLSA-N	0	3	343.370	3.488	20	30		EGEDHN
N#Cc1cncc(CN2CCC3(C[C@@H](c4ccccc4)CO3)CC2)c1	ZINC001144080744	1378680514	/nfs/dbraw/zinc/68/05/14/1378680514.db2.gz	XANMYSMDGREQSS-HXUWFJFHSA-N	0	3	333.435	3.492	20	30		EGEDHN
CC(C)c1cccc(C(=O)NCCNCc2ccc(C#N)c(F)c2)c1	ZINC001146624059	1378880473	/nfs/dbraw/zinc/88/04/73/1378880473.db2.gz	TUUZMJRHCRAPLE-UHFFFAOYSA-N	0	3	339.414	3.340	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2cc(C)no2)CCCCC1	ZINC001146664759	1378893636	/nfs/dbraw/zinc/89/36/36/1378893636.db2.gz	SZTMFMTWYQHTNK-HOTGVXAUSA-N	0	3	345.487	3.330	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C[C@H](C)NCc2cc(C)n(C)n2)CCCC1	ZINC001146822653	1378928615	/nfs/dbraw/zinc/92/86/15/1378928615.db2.gz	UBFKZJVFECKRKA-JKSUJKDBSA-N	0	3	346.519	3.238	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2nccn2CC)CCCC1	ZINC001146832712	1378932088	/nfs/dbraw/zinc/93/20/88/1378932088.db2.gz	XWCWAXJZOVMOMJ-IAGOWNOFSA-N	0	3	346.519	3.412	20	30		EGEDHN
C=CCCC(=O)N1CC2(C1)CCN(CCO[C@@H]1CCCC[C@H]1C)C2	ZINC001147186822	1378984428	/nfs/dbraw/zinc/98/44/28/1378984428.db2.gz	CVMRDADNIKFUMD-QZTJIDSGSA-N	0	3	334.504	3.082	20	30		EGEDHN
CCC(=CC(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2)CC	ZINC001147329250	1379005524	/nfs/dbraw/zinc/00/55/24/1379005524.db2.gz	PVZQZIBWJVWDKH-UHFFFAOYSA-N	0	3	337.467	3.339	20	30		EGEDHN
Cc1cc(C(=O)N(C)C[C@@H](C)NCc2ccc(F)c(C#N)c2)c(C)o1	ZINC001283573571	1379029778	/nfs/dbraw/zinc/02/97/78/1379029778.db2.gz	UZVFTVIVPKUDHT-GFCCVEGCSA-N	0	3	343.402	3.158	20	30		EGEDHN
C=C(C)CCC(=O)N1CC2(C1)CCN(CCOc1ccc(F)cc1)C2	ZINC001147658410	1379056689	/nfs/dbraw/zinc/05/66/89/1379056689.db2.gz	SIBPNWKXXKGDPD-UHFFFAOYSA-N	0	3	346.446	3.095	20	30		EGEDHN
C[C@@H](CCC(C)(C)C)C(=O)NCCNCc1ccc(C#N)c(F)c1	ZINC001147786479	1379078211	/nfs/dbraw/zinc/07/82/11/1379078211.db2.gz	FTTNCSPZEPSSHG-AWEZNQCLSA-N	0	3	333.451	3.366	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N1CC2(C1)CCN([C@H](C)c1ccc(F)cc1)C2	ZINC001148899866	1379293458	/nfs/dbraw/zinc/29/34/58/1379293458.db2.gz	IFGUQTQMJWLEAH-HZPDHXFCSA-N	0	3	346.446	3.012	20	30		EGEDHN
C=CCC[C@@H](C(=O)N1CC2(C1)CCN(CC#CC)C2)c1ccccc1	ZINC001148941207	1379300819	/nfs/dbraw/zinc/30/08/19/1379300819.db2.gz	GSKZQYWTCXELBH-HXUWFJFHSA-N	0	3	336.479	3.294	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)C/C=C\c2cccc(F)c2)C1	ZINC001149868339	1379458101	/nfs/dbraw/zinc/45/81/01/1379458101.db2.gz	GPOARPRWPWFWJI-OCTSTCLRSA-N	0	3	346.446	3.012	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@H]1CN(Cc2cccc(CC)c2)CCCO1	ZINC001150085961	1379493185	/nfs/dbraw/zinc/49/31/85/1379493185.db2.gz	WDGJBTAXPFBZLC-IBGZPJMESA-N	0	3	344.499	3.168	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)CCc2ccccc2Cl)s1	ZINC001150284666	1379528763	/nfs/dbraw/zinc/52/87/63/1379528763.db2.gz	FFMKEPMKHURXSY-UHFFFAOYSA-N	0	3	347.871	3.112	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@H]1CN(Cc2cccc(C)c2)CCCO1	ZINC001150373098	1379540981	/nfs/dbraw/zinc/54/09/81/1379540981.db2.gz	WAOOSHHAKBDCCH-IBGZPJMESA-N	0	3	344.499	3.304	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)[C@@H](C)CC2CCCCC2)C1	ZINC001150417564	1379551620	/nfs/dbraw/zinc/55/16/20/1379551620.db2.gz	NUCVWNPKSJGCPX-PKOBYXMFSA-N	0	3	336.520	3.376	20	30		EGEDHN
CCCCCCCCC(=O)NC[C@@H]1CN(CCCF)CCCO1	ZINC001150625682	1379581435	/nfs/dbraw/zinc/58/14/35/1379581435.db2.gz	ODULEPXHMZQSAX-QGZVFWFLSA-N	0	3	330.488	3.304	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2cccc(C)c2)CC1	ZINC001150925094	1379633585	/nfs/dbraw/zinc/63/35/85/1379633585.db2.gz	ZZQBTBUOJQYHEF-UHFFFAOYSA-N	0	3	330.472	3.172	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@@H]2C[C@H]2CC(C)(C)C)CC1	ZINC001151138001	1379666157	/nfs/dbraw/zinc/66/61/57/1379666157.db2.gz	QAJPLFGGJHGWPX-DLBZAZTESA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@H](F)c2ccccc2)CC1	ZINC001151340287	1379701672	/nfs/dbraw/zinc/70/16/72/1379701672.db2.gz	QSORLSNPSZHXBM-GOSISDBHSA-N	0	3	348.462	3.261	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@H](C)c2cccc(F)c2)CC1	ZINC001151413315	1379714882	/nfs/dbraw/zinc/71/48/82/1379714882.db2.gz	UYIMEXCNWPFYKJ-MRXNPFEDSA-N	0	3	348.462	3.103	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)[C@H]1CC=CCC1	ZINC001151829102	1379789770	/nfs/dbraw/zinc/78/97/70/1379789770.db2.gz	DINJZORRUJRMTM-WBVHZDCISA-N	0	3	343.446	3.380	20	30		EGEDHN
C=C[C@H](CC(=O)NCCNCc1ccc(C)nc1C)c1ccccc1	ZINC001151942328	1379819992	/nfs/dbraw/zinc/81/99/92/1379819992.db2.gz	FIOZUAJALOQURY-GOSISDBHSA-N	0	3	337.467	3.264	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)CCC1CCC1	ZINC001152611474	1379957188	/nfs/dbraw/zinc/95/71/88/1379957188.db2.gz	CJSOTYQHBATZEY-MRXNPFEDSA-N	0	3	327.472	3.465	20	30		EGEDHN
CCCC[C@H](C(=O)NCCNCc1ccc(C#N)c(F)c1)C(C)C	ZINC001152653378	1379963114	/nfs/dbraw/zinc/96/31/14/1379963114.db2.gz	WNKGDWABBOTWMY-KRWDZBQOSA-N	0	3	333.451	3.366	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)[C@H]1CC1(C)C	ZINC001152801715	1379982159	/nfs/dbraw/zinc/98/21/59/1379982159.db2.gz	BWSRHSUVIKUSOK-CZUORRHYSA-N	0	3	331.435	3.070	20	30		EGEDHN
CC1=C(C)C[C@@](C)(C(=O)NCCNCc2ccc(C#N)cc2)CC1	ZINC001152936271	1379996494	/nfs/dbraw/zinc/99/64/94/1379996494.db2.gz	REYNVFSPPFGZOQ-FQEVSTJZSA-N	0	3	325.456	3.291	20	30		EGEDHN
C[C@H](CCc1ccccc1)CC(=O)NCCNCc1cccc(C#N)c1	ZINC001153213667	1380036839	/nfs/dbraw/zinc/03/68/39/1380036839.db2.gz	FNWPFNAMEODIDE-GOSISDBHSA-N	0	3	349.478	3.423	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C[C@H](C)Cc1cccc(F)c1	ZINC001153350221	1380061017	/nfs/dbraw/zinc/06/10/17/1380061017.db2.gz	XSVKVJQWDYYKCX-IAGOWNOFSA-N	0	3	332.463	3.244	20	30		EGEDHN
C=CCN1CCC[C@@](C)(CNC(=O)c2nc(Cl)sc2Cl)C1	ZINC001754735408	1440681989	/nfs/dbraw/zinc/68/19/89/1440681989.db2.gz	BKUJRPDBDKVVOW-AWEZNQCLSA-N	0	3	348.299	3.468	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@@H](C)N(CC)Cc1ccc2nonc2c1	ZINC001153609103	1380102715	/nfs/dbraw/zinc/10/27/15/1380102715.db2.gz	ZBCGQWPSJVQQRG-CQSZACIVSA-N	0	3	344.459	3.152	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)[C@@H](C)C1CCC1	ZINC001153974589	1380166028	/nfs/dbraw/zinc/16/60/28/1380166028.db2.gz	PUACFLBDWBMMEP-CABCVRRESA-N	0	3	345.462	3.460	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1sc(C)nc1CC(C)C	ZINC001154189886	1380223310	/nfs/dbraw/zinc/22/33/10/1380223310.db2.gz	WCKUEMYSQCUREI-CQSZACIVSA-N	0	3	335.517	3.114	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1cc2c(o1)c(F)ccc2C	ZINC001154439661	1380278436	/nfs/dbraw/zinc/27/84/36/1380278436.db2.gz	LTCVHXWCGYGXBQ-CQSZACIVSA-N	0	3	330.403	3.344	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)Cc1ccc(C2CCC2)cc1	ZINC001154493091	1380289564	/nfs/dbraw/zinc/28/95/64/1380289564.db2.gz	WEKVVPJFWXMTGC-QGZVFWFLSA-N	0	3	326.484	3.347	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H](C)N(CC)C[C@H](O)c1ccc(CC)cc1	ZINC001154606077	1380315650	/nfs/dbraw/zinc/31/56/50/1380315650.db2.gz	ZMDYLWUKHVQPIB-APWZRJJASA-N	0	3	346.515	3.321	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)c1cocc1C	ZINC001154661443	1380326756	/nfs/dbraw/zinc/32/67/56/1380326756.db2.gz	VDQRDUQLKGTIFJ-CQSZACIVSA-N	0	3	343.402	3.239	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H](C)N(CC)C[C@@H](O)c1ccc(F)cc1	ZINC001154927246	1380377708	/nfs/dbraw/zinc/37/77/08/1380377708.db2.gz	KIXNTBZVHKLZNV-CRAIPNDOSA-N	0	3	336.451	3.042	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)[C@@H](C)c1ccco1	ZINC001155204760	1380424977	/nfs/dbraw/zinc/42/49/77/1380424977.db2.gz	KGSNJPDHUGLROS-CVEARBPZSA-N	0	3	339.439	3.282	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)[C@@H]1CC12CCC2	ZINC001155503389	1380461549	/nfs/dbraw/zinc/46/15/49/1380461549.db2.gz	NXPMIIIWLHVPAO-QAPCUYQASA-N	0	3	325.456	3.075	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)C[C@@H](C)C1CC1	ZINC001157145661	1380786052	/nfs/dbraw/zinc/78/60/52/1380786052.db2.gz	HENUUVMDPAFVLL-HZPDHXFCSA-N	0	3	327.472	3.321	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NC[C@@H](C)N(CC)Cc1ccc(C)c(F)c1	ZINC001157217405	1380813692	/nfs/dbraw/zinc/81/36/92/1380813692.db2.gz	PQRJMHHJQJKCNK-CVEARBPZSA-N	0	3	336.451	3.052	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)CC1CCCCC1	ZINC001157486818	1380936119	/nfs/dbraw/zinc/93/61/19/1380936119.db2.gz	DNTAZFFLOATNTK-LJQANCHMSA-N	0	3	336.520	3.472	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)N1CC[C@H](c2ccccc2OC)C1	ZINC001157569514	1380968471	/nfs/dbraw/zinc/96/84/71/1380968471.db2.gz	ZXOVMAHUGRRORB-WMZOPIPTSA-N	0	3	330.472	3.475	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cn(C)c2ccccc12	ZINC001158190191	1381153484	/nfs/dbraw/zinc/15/34/84/1381153484.db2.gz	BOBWMYDRJNQIJN-MRXNPFEDSA-N	0	3	325.456	3.291	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1CCc2cc(C)ccc2O1	ZINC001158220693	1381163703	/nfs/dbraw/zinc/16/37/03/1381163703.db2.gz	AWSUOLWOQUALTB-QUCCMNQESA-N	0	3	342.483	3.188	20	30		EGEDHN
CC#CCCCC(=O)N1CCCC[C@@H]1CN(C)C[C@@H]1CCCCO1	ZINC001158357434	1381215655	/nfs/dbraw/zinc/21/56/55/1381215655.db2.gz	HODAIKHENWFBKM-MOPGFXCFSA-N	0	3	334.504	3.062	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc2cc(OC)ccc2[nH]1	ZINC001158425712	1381241175	/nfs/dbraw/zinc/24/11/75/1381241175.db2.gz	CRYNHIVXIHSTOB-MRXNPFEDSA-N	0	3	341.455	3.289	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1ccc(F)c(C)c1	ZINC001158425654	1381241488	/nfs/dbraw/zinc/24/14/88/1381241488.db2.gz	ALMJDGPUQBJBME-GOSISDBHSA-N	0	3	348.462	3.263	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc(-c2cccs2)n[nH]1	ZINC001158508390	1381272380	/nfs/dbraw/zinc/27/23/80/1381272380.db2.gz	WQVCKJGWPVWUFX-CQSZACIVSA-N	0	3	344.484	3.251	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)COCc1ccccc1C	ZINC001158571385	1381303974	/nfs/dbraw/zinc/30/39/74/1381303974.db2.gz	GAXWSPWTUVOOCX-LJQANCHMSA-N	0	3	330.472	3.011	20	30		EGEDHN
Cc1scc(C(=O)NCCCNCc2ccc(C#N)cc2F)c1C	ZINC001158798035	1381404042	/nfs/dbraw/zinc/40/40/42/1381404042.db2.gz	KRAZKOHICLFSSB-UHFFFAOYSA-N	0	3	345.443	3.285	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1cccc(C)c1C	ZINC001158811473	1381411486	/nfs/dbraw/zinc/41/14/86/1381411486.db2.gz	IZEWDJIQXPQUAR-LJQANCHMSA-N	0	3	344.499	3.433	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1ccc(CCC)s1	ZINC001158966023	1381489675	/nfs/dbraw/zinc/48/96/75/1381489675.db2.gz	RFANEDFZIPGPBC-UHFFFAOYSA-N	0	3	345.306	3.319	20	30		EGEDHN
C=C(C)CCC(=O)NCCCNCC(=O)Nc1ccccc1C(C)C	ZINC001159040257	1381532608	/nfs/dbraw/zinc/53/26/08/1381532608.db2.gz	JSGGLAVLOIMMIM-UHFFFAOYSA-N	0	3	345.487	3.201	20	30		EGEDHN
C=C(C)CCC(=O)NCCCNCc1cc(-c2ccc(F)cc2)no1	ZINC001159040134	1381534039	/nfs/dbraw/zinc/53/40/39/1381534039.db2.gz	INAMQEWHGNBVMW-UHFFFAOYSA-N	0	3	345.418	3.433	20	30		EGEDHN
C[C@@H](C(=O)NCC[C@H](C)NCc1ccccc1C#N)c1ccsc1	ZINC001328399705	1388736978	/nfs/dbraw/zinc/73/69/78/1388736978.db2.gz	JEQGSBVYQNOTQS-LSDHHAIUSA-N	0	3	341.480	3.408	20	30		EGEDHN
Cc1cc(Nc2ccc(N3CC[NH2+]CC3)c(C#N)c2)cc(Cl)c1[O-]	ZINC001159748653	1381888411	/nfs/dbraw/zinc/88/84/11/1381888411.db2.gz	GXTRQRWYYCWENH-UHFFFAOYSA-N	0	3	342.830	3.379	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)C1(C)CCCCCC1	ZINC001160096599	1381995376	/nfs/dbraw/zinc/99/53/76/1381995376.db2.gz	VPJKNKHFRWENAC-UHFFFAOYSA-N	0	3	331.298	3.351	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc(C)nc2C(C)C)CC1	ZINC001160798441	1382199485	/nfs/dbraw/zinc/19/94/85/1382199485.db2.gz	HXIUPUOAUJFJEV-UHFFFAOYSA-N	0	3	339.483	3.289	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc(Cl)c(Cl)[nH]2)CC1	ZINC001160828511	1382211575	/nfs/dbraw/zinc/21/15/75/1382211575.db2.gz	PQCQCPKUUZWXQS-UHFFFAOYSA-N	0	3	328.243	3.260	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCC1=CCN(CCOCC(C)C)CC1	ZINC001161116203	1382304591	/nfs/dbraw/zinc/30/45/91/1382304591.db2.gz	BFTPXLWHLSLHHM-FQEVSTJZSA-N	0	3	336.520	3.400	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H]2C[C@H]2c2ccccc2F)CC1	ZINC001161428284	1382407396	/nfs/dbraw/zinc/40/73/96/1382407396.db2.gz	WATUYRQWLFYPJN-RBUKOAKNSA-N	0	3	340.442	3.091	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc(C(F)F)cc2)CC1	ZINC001161478528	1382419416	/nfs/dbraw/zinc/41/94/16/1382419416.db2.gz	PQQDEBPRKDLEBG-UHFFFAOYSA-N	0	3	332.394	3.400	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc(Cl)cc(OC)c2)CC1	ZINC001161530595	1382431176	/nfs/dbraw/zinc/43/11/76/1382431176.db2.gz	IVWHVBKKETYBPP-UHFFFAOYSA-N	0	3	334.847	3.287	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H](C)c2ccc(F)cc2F)CC1	ZINC001161904353	1382545367	/nfs/dbraw/zinc/54/53/67/1382545367.db2.gz	RCRRJDROXLAKNN-HNNXBMFYSA-N	0	3	346.421	3.230	20	30		EGEDHN
CC#CCCCC(=O)N1CCCC[C@H]1CNCc1c(C)onc1CC	ZINC001328646956	1388796825	/nfs/dbraw/zinc/79/68/25/1388796825.db2.gz	JCAMOHUMWVJDTN-KRWDZBQOSA-N	0	3	345.487	3.210	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)C(C)(C)C2CCCC2)(COC)CC1	ZINC001162300626	1382725452	/nfs/dbraw/zinc/72/54/52/1382725452.db2.gz	MTMHPQYVDXVAMS-UHFFFAOYSA-N	0	3	348.531	3.071	20	30		EGEDHN
Cc1cc(NCC2(N3CCOC(C)(C)C3)CCCCC2)ncc1C#N	ZINC001162471709	1382768177	/nfs/dbraw/zinc/76/81/77/1382768177.db2.gz	VXXMUFVITQRHEQ-UHFFFAOYSA-N	0	3	342.487	3.487	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC1(COC)CCN(C[C@@H](F)CC)CC1	ZINC001162513446	1382778609	/nfs/dbraw/zinc/77/86/09/1382778609.db2.gz	NKTRLJZZFCXQLZ-INIZCTEOSA-N	0	3	342.499	3.182	20	30		EGEDHN
C#CCCCC(=O)N(CCNC/C=C\Cl)CCc1ccccc1	ZINC001162790964	1382874149	/nfs/dbraw/zinc/87/41/49/1382874149.db2.gz	SXXLDDCLAVHNDJ-JYRVWZFOSA-N	0	3	332.875	3.203	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)CCC(C)(F)F	ZINC001162852033	1382895238	/nfs/dbraw/zinc/89/52/38/1382895238.db2.gz	XUGBQOHDXWLYPC-UHFFFAOYSA-N	0	3	336.426	3.106	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C[C@@H]1C[C@H]1C1CC1	ZINC001162865327	1382899440	/nfs/dbraw/zinc/89/94/40/1382899440.db2.gz	ZVSRWDAZZDACTP-SFTDATJTSA-N	0	3	338.495	3.107	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C[C@H]1CC[C@H](C)C1	ZINC001162892069	1382906981	/nfs/dbraw/zinc/90/69/81/1382906981.db2.gz	GMUDCWKHVYBIII-FPOVZHCZSA-N	0	3	340.511	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1ccc(F)cc1C	ZINC001162987153	1382938867	/nfs/dbraw/zinc/93/88/67/1382938867.db2.gz	MLEZUMNMMQTWHH-UHFFFAOYSA-N	0	3	338.426	3.042	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1ccc(C)cc1C	ZINC001162992369	1382940686	/nfs/dbraw/zinc/94/06/86/1382940686.db2.gz	LYQXUKSZAVNMKV-UHFFFAOYSA-N	0	3	334.463	3.211	20	30		EGEDHN
N#Cc1ccc(F)c(CNCC2(CCNC(=O)C3CCCC3)CC2)c1	ZINC001163128567	1382972426	/nfs/dbraw/zinc/97/24/26/1382972426.db2.gz	ZZUBAUMPDMYZNL-UHFFFAOYSA-N	0	3	343.446	3.264	20	30		EGEDHN
CCOC(=O)c1cc(N[C@@H]2CNCc3ccsc32)ccc1C#N	ZINC001163229824	1383000464	/nfs/dbraw/zinc/00/04/64/1383000464.db2.gz	LNTLLSGAJPYUNH-OAHLLOKOSA-N	0	3	327.409	3.053	20	30		EGEDHN
CC/C=C(/C)C(=O)NCCC1(CNCc2cc(C#N)ccc2F)CC1	ZINC001163676821	1383103538	/nfs/dbraw/zinc/10/35/38/1383103538.db2.gz	LEHKRSFVXHKPDR-TVPGTPATSA-N	0	3	343.446	3.430	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCC1(CNCc2cc(F)ccc2Cl)CC1	ZINC001163854221	1383129777	/nfs/dbraw/zinc/12/97/77/1383129777.db2.gz	KUDODUTVESFWOZ-GFCCVEGCSA-N	0	3	337.826	3.015	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCCNCc1sccc1Br	ZINC001163963676	1383140403	/nfs/dbraw/zinc/14/04/03/1383140403.db2.gz	IZGSPAFUQVIOGL-UHFFFAOYSA-N	0	3	345.306	3.319	20	30		EGEDHN
CC[C@H](SC)C(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001164102401	1383156746	/nfs/dbraw/zinc/15/67/46/1383156746.db2.gz	LVQZJCBGYBZNDZ-KRWDZBQOSA-N	0	3	345.512	3.076	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCCNCc1cccc(OC)c1Cl	ZINC001164221949	1383167547	/nfs/dbraw/zinc/16/75/47/1383167547.db2.gz	GXMMTVYTUOEEMT-ZIAGYGMSSA-N	0	3	338.879	3.403	20	30		EGEDHN
Cc1nc(C(C)C)oc1CNCC1(CCNC(=O)C#CC(C)C)CC1	ZINC001164461156	1383189221	/nfs/dbraw/zinc/18/92/21/1383189221.db2.gz	QYKMWGOPXFFABK-UHFFFAOYSA-N	0	3	345.487	3.142	20	30		EGEDHN
O=C(C#CC1CC1)NCCC1(CNCc2cccc(F)c2Cl)CC1	ZINC001164479099	1383191029	/nfs/dbraw/zinc/19/10/29/1383191029.db2.gz	FZSXDZSJGZIBCG-UHFFFAOYSA-N	0	3	348.849	3.269	20	30		EGEDHN
C=C1CCC(C(=O)NCCCNCc2cnc(Cl)s2)CC1	ZINC001165901300	1383361892	/nfs/dbraw/zinc/36/18/92/1383361892.db2.gz	RDDDMERBAPYWKT-UHFFFAOYSA-N	0	3	327.881	3.139	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCCNCc1ccn(C2CCCC2)n1	ZINC001165921794	1383365354	/nfs/dbraw/zinc/36/53/54/1383365354.db2.gz	SDBFPLNTIBCXFG-IBGZPJMESA-N	0	3	332.492	3.196	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cccc(COC)c2)CC1	ZINC001166019137	1383377797	/nfs/dbraw/zinc/37/77/97/1383377797.db2.gz	IUOVPXWEICSXRV-UHFFFAOYSA-N	0	3	336.863	3.075	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cc(C)ccc2OC)CC1	ZINC001166031585	1383379204	/nfs/dbraw/zinc/37/92/04/1383379204.db2.gz	DOZMLUMEIBERHG-UHFFFAOYSA-N	0	3	336.863	3.246	20	30		EGEDHN
CC1(CC(=O)NCCC2(CNCc3cc(C#N)ccc3F)CC2)CC1	ZINC001166218344	1383403484	/nfs/dbraw/zinc/40/34/84/1383403484.db2.gz	VMZBQWPKXQVVBG-UHFFFAOYSA-N	0	3	343.446	3.264	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cccc3c2O[C@@H](C)C3)CC1	ZINC001166217746	1383403559	/nfs/dbraw/zinc/40/35/59/1383403559.db2.gz	OGAYWVRJMDKVFV-AWEZNQCLSA-N	0	3	348.874	3.252	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cc(C(C)C)on2)CC1	ZINC001166435092	1383422210	/nfs/dbraw/zinc/42/22/10/1383422210.db2.gz	KDERWQJIKOPZBK-UHFFFAOYSA-N	0	3	325.840	3.040	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCC1(CN[C@@H](C)c2cnc(C)cn2)CC1	ZINC001166541609	1383435750	/nfs/dbraw/zinc/43/57/50/1383435750.db2.gz	DZNLSDXFWLQDAK-INIZCTEOSA-N	0	3	344.503	3.324	20	30		EGEDHN
CC1(C(=O)NCCC2(CNCc3ccc(C#N)cc3F)CC2)CCC1	ZINC001166613459	1383447034	/nfs/dbraw/zinc/44/70/34/1383447034.db2.gz	HPSKKDFOOOZTJS-UHFFFAOYSA-N	0	3	343.446	3.264	20	30		EGEDHN
Cc1ccc(F)c(C(=O)NCCCNCc2ccc(C#N)cc2F)c1	ZINC001167320027	1383596552	/nfs/dbraw/zinc/59/65/52/1383596552.db2.gz	IAWVGDAYJXVHHG-UHFFFAOYSA-N	0	3	343.377	3.055	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@H]2C[C@@H]2c2ccccc2)CC1	ZINC001167403152	1383623877	/nfs/dbraw/zinc/62/38/77/1383623877.db2.gz	ROMISCPZNRJDSE-SJORKVTESA-N	0	3	332.875	3.419	20	30		EGEDHN
N#CC1(c2cccc(-n3nc(CN)c4ccccc43)c2)CCOCC1	ZINC001167700998	1383716071	/nfs/dbraw/zinc/71/60/71/1383716071.db2.gz	KSVKFVAXNCUHCK-UHFFFAOYSA-N	0	3	332.407	3.056	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C(C)(C)C(F)(F)F)CC1	ZINC001167801494	1383743270	/nfs/dbraw/zinc/74/32/70/1383743270.db2.gz	BSMLMUYUBWREJP-UHFFFAOYSA-N	0	3	326.790	3.204	20	30		EGEDHN
CC(C)N1CCN(c2ccc(N[C@H]3CC[C@H](C#N)CC3)cn2)CC1	ZINC001167844005	1383757632	/nfs/dbraw/zinc/75/76/32/1383757632.db2.gz	IOTFZWORGRGGLV-QAQDUYKDSA-N	0	3	327.476	3.106	20	30		EGEDHN
C[C@H]1C[C@H](NCc2ccc(F)c(C#N)c2)CN1C(=O)OC(C)(C)C	ZINC001168813767	1384015170	/nfs/dbraw/zinc/01/51/70/1384015170.db2.gz	ASEBZUMSKBWJMK-WFASDCNBSA-N	0	3	333.407	3.185	20	30		EGEDHN
N#Cc1ccccc1-c1ccc(CN2CCN(c3ncc[nH]3)CC2)cc1	ZINC001307735514	1384021362	/nfs/dbraw/zinc/02/13/62/1384021362.db2.gz	YNIDKZZSLWJUEO-UHFFFAOYSA-N	0	3	343.434	3.271	20	30		EGEDHN
CCC1(CC)[C@H](NCc2cccc(C(=O)OC)c2C#N)[C@H](C)[C@H]1OC	ZINC001307745414	1384023814	/nfs/dbraw/zinc/02/38/14/1384023814.db2.gz	PHMYJHBNSUKXEC-MORSLUCNSA-N	0	3	344.455	3.274	20	30		EGEDHN
C[C@]1(CNCc2cc(C#N)ccc2Br)CCCC[C@H]1O	ZINC001308301818	1384117969	/nfs/dbraw/zinc/11/79/69/1384117969.db2.gz	JAETWSDYZPVZPK-HZPDHXFCSA-N	0	3	337.261	3.352	20	30		EGEDHN
C[C@@H](N)c1ccn(-c2c(C#N)cnc3cc(Br)ccc32)n1	ZINC001169232232	1384125117	/nfs/dbraw/zinc/12/51/17/1384125117.db2.gz	BGSFXUFOVLOGKT-SECBINFHSA-N	0	3	342.200	3.074	20	30		EGEDHN
Cc1ccc(-n2ccc([C@@H](C)N)n2)cc1NC(=O)c1cccc(C#N)c1	ZINC001169232189	1384125132	/nfs/dbraw/zinc/12/51/32/1384125132.db2.gz	AMJZYCSZTIUIIP-CQSZACIVSA-N	0	3	345.406	3.324	20	30		EGEDHN
N#Cc1ccccc1N1CCCN(Cc2cccc3c2OCC3)CC1	ZINC001308614587	1384136209	/nfs/dbraw/zinc/13/62/09/1384136209.db2.gz	ANRMHQFLQZXWQG-UHFFFAOYSA-N	0	3	333.435	3.205	20	30		EGEDHN
N#CC12CCC(Nc3cncc([C@@H]4CN5CCC4CC5)n3)(CC1)CC2	ZINC001169748392	1384182153	/nfs/dbraw/zinc/18/21/53/1384182153.db2.gz	XHHGCTREVPPTQF-PBPGXSGUSA-N	0	3	337.471	3.314	20	30		EGEDHN
C/C=C(\C)C(=O)N[C@H](C)CCCCNCc1cc(F)ccc1C#N	ZINC001170067242	1384228263	/nfs/dbraw/zinc/22/82/63/1384228263.db2.gz	JLEHEQNXTWMVLE-XUYKZZHDSA-N	0	3	331.435	3.428	20	30		EGEDHN
C#CCCCC(=O)N[C@@H](C)CCCCNCc1cc(C2CC2)no1	ZINC001170452797	1384322815	/nfs/dbraw/zinc/32/28/15/1384322815.db2.gz	DUKJLKZKHZMUQK-HNNXBMFYSA-N	0	3	331.460	3.120	20	30		EGEDHN
Cc1nc(Cl)c(C#N)c(-n2c(-c3ccccc3)cnc2[C@H](C)N)n1	ZINC001170680526	1384364430	/nfs/dbraw/zinc/36/44/30/1384364430.db2.gz	WRXGHXISXSZECC-JTQLQIEISA-N	0	3	338.802	3.183	20	30		EGEDHN
COC[C@@H](NC[C@H](O)c1cccc(C#N)c1)c1cccc(Cl)c1	ZINC001170864518	1384400802	/nfs/dbraw/zinc/40/08/02/1384400802.db2.gz	YFNQGNQAWDOZND-MSOLQXFVSA-N	0	3	330.815	3.222	20	30		EGEDHN
CN(C)/C=N/c1ccc(NCC(F)(F)c2ccccn2)cc1C#N	ZINC001170910096	1384409675	/nfs/dbraw/zinc/40/96/75/1384409675.db2.gz	YVXYYCLOERNMBG-FSJBWODESA-N	0	3	329.354	3.379	20	30		EGEDHN
C=CCOC(=O)N[C@H]1CCCN([C@@H]2CCc3cccc(F)c3C2)C1	ZINC001171014292	1384429609	/nfs/dbraw/zinc/42/96/09/1384429609.db2.gz	XRQWBTJSCTVJTJ-JKSUJKDBSA-N	0	3	332.419	3.060	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H](C)CCCCNCc1nnc(C(C)C)n1C	ZINC001171034673	1384433441	/nfs/dbraw/zinc/43/34/41/1384433441.db2.gz	BRDKXDFXCUHOOU-INIZCTEOSA-N	0	3	349.523	3.059	20	30		EGEDHN
CC[C@H](C)[C@H]([NH2+][C@@H]1CCc2cc(Cl)c(Cl)cc2C1)C(=O)N[O-]	ZINC001171150403	1384455030	/nfs/dbraw/zinc/45/50/30/1384455030.db2.gz	RJOSJDHFYOAEDP-UAKXVISKSA-N	0	3	345.270	3.360	20	30		EGEDHN
N=C(Nc1cccc(N2CCC2=O)c1)c1ccc2cc(O)ccc2c1	ZINC001171181809	1384461968	/nfs/dbraw/zinc/46/19/68/1384461968.db2.gz	CHIJYXXOKAMIIJ-UHFFFAOYSA-N	0	3	331.375	3.319	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)NCc1cccnc1Br	ZINC001171193994	1384465419	/nfs/dbraw/zinc/46/54/19/1384465419.db2.gz	FFFNMYXYZSCFDR-GFCCVEGCSA-N	0	3	330.229	3.437	20	30		EGEDHN
C[C@@H](Cc1cccc(C#N)c1)NCc1cc(OCC2CCC2)ncn1	ZINC001171198751	1384467075	/nfs/dbraw/zinc/46/70/75/1384467075.db2.gz	PKVFEGIEFXPTQT-HNNXBMFYSA-N	0	3	336.439	3.248	20	30		EGEDHN
C[Si](C)(C)C#Cc1ccc(NC(=N)c2ccc(C(N)=O)cc2)cc1	ZINC001171256012	1384480233	/nfs/dbraw/zinc/48/02/33/1384480233.db2.gz	CNYBSBPEKPOOIZ-UHFFFAOYSA-N	0	3	335.483	3.051	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1cc(CC)c(CC)o1	ZINC001171286841	1384485989	/nfs/dbraw/zinc/48/59/89/1384485989.db2.gz	ZSCYGTIOSGFJPN-UHFFFAOYSA-N	0	3	343.265	3.023	20	30		EGEDHN
C=CCN1CCN([C@H]2CCN(C(=O)OC(C)(C)C)C3(CCC3)C2)CC1	ZINC001171852915	1384660985	/nfs/dbraw/zinc/66/09/85/1384660985.db2.gz	KVFBUWQSAUUUNO-KRWDZBQOSA-N	0	3	349.519	3.112	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)N1CC[C@H](N2CCCCC2)[C@@H](F)C1	ZINC001172317125	1384767815	/nfs/dbraw/zinc/76/78/15/1384767815.db2.gz	PNQBJMRBXFIQDK-UXPWSPDFSA-N	0	3	329.463	3.388	20	30		EGEDHN
C[C@@H](CCCC#N)NCC(=O)c1ccc(Br)c(F)c1	ZINC001172483093	1384803211	/nfs/dbraw/zinc/80/32/11/1384803211.db2.gz	NFSVJJPPTXYTMC-JTQLQIEISA-N	0	3	327.197	3.443	20	30		EGEDHN
CC(C)C[C@H](N[C@H](C)CSc1ccc(Cl)cc1)C(=O)NO	ZINC001172875277	1384870897	/nfs/dbraw/zinc/87/08/97/1384870897.db2.gz	KBYYIGFMYMLODE-RISCZKNCSA-N	0	3	330.881	3.330	20	30		EGEDHN
N#Cc1ccc(C(=O)N2CCC(N3Cc4ccc(F)cc4C3)CC2)cc1	ZINC001173433636	1384969852	/nfs/dbraw/zinc/96/98/52/1384969852.db2.gz	SXJALMQGSSNRNB-UHFFFAOYSA-N	0	3	349.409	3.318	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H](C)CCCCNCc1cc(C)n(C)n1	ZINC001174850154	1385160096	/nfs/dbraw/zinc/16/00/96/1385160096.db2.gz	UYLRVESECZGPDY-DOTOQJQBSA-N	0	3	334.508	3.095	20	30		EGEDHN
C=CCCCC(=O)N[C@H](C)CCCCNCc1csnc1OC	ZINC001174979424	1385177956	/nfs/dbraw/zinc/17/79/56/1385177956.db2.gz	ZPDMBCHGVCQWPY-CQSZACIVSA-N	0	3	339.505	3.273	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@H](C)CCCCNCc1cc2n(n1)CCC2	ZINC001175081920	1385191483	/nfs/dbraw/zinc/19/14/83/1385191483.db2.gz	KIUXUPUVDZGXSV-UZLBHIALSA-N	0	3	346.519	3.196	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)Cc1ccccc1Cl	ZINC001175409899	1385278983	/nfs/dbraw/zinc/27/89/83/1385278983.db2.gz	YEQHUAFRWAHRCA-UHFFFAOYSA-N	0	3	341.842	3.050	20	30		EGEDHN
CCc1cc(C(=O)NCCCNCc2ccccc2C#N)sc1C	ZINC001175607417	1385348596	/nfs/dbraw/zinc/34/85/96/1385348596.db2.gz	XJTMVGQGTBSIEB-UHFFFAOYSA-N	0	3	341.480	3.400	20	30		EGEDHN
C=C[C@H](CC(=O)NCCCNCc1nc(C)cs1)c1ccccc1	ZINC001176762522	1385687392	/nfs/dbraw/zinc/68/73/92/1385687392.db2.gz	FCWKTVCNBCNVSZ-MRXNPFEDSA-N	0	3	343.496	3.407	20	30		EGEDHN
C=C[C@H](C(=O)NCCCNCc1cccc(Cl)n1)c1ccccc1	ZINC001176777447	1385692914	/nfs/dbraw/zinc/69/29/14/1385692914.db2.gz	APTBJOKHCZXGBA-KRWDZBQOSA-N	0	3	343.858	3.301	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)[C@H](c1ccc(F)cc1)C(C)C	ZINC001177122146	1385820975	/nfs/dbraw/zinc/82/09/75/1385820975.db2.gz	UBGJRKTWZNKGEP-INIZCTEOSA-N	0	3	326.843	3.414	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)C1C[C@@H](C)C[C@H](C)C1	ZINC001177131704	1385827245	/nfs/dbraw/zinc/82/72/45/1385827245.db2.gz	NRKMPRXWKXZDPB-RYUDHWBXSA-N	0	3	331.298	3.063	20	30		EGEDHN
Cc1cnc(CNCCCN(CC2CCCC2)C(=O)[C@H](C)C#N)s1	ZINC001177261147	1385887845	/nfs/dbraw/zinc/88/78/45/1385887845.db2.gz	FIRGYCNTUAWROT-CQSZACIVSA-N	0	3	348.516	3.110	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NCCCNCc1ccc(Cl)cc1Cl	ZINC001177273099	1385892006	/nfs/dbraw/zinc/89/20/06/1385892006.db2.gz	HKVQRZFCQXMEJP-GFCCVEGCSA-N	0	3	345.270	3.180	20	30		EGEDHN
N#Cc1ccc(F)cc1CNCCCCCCNC(=O)C1CCC1	ZINC001177730091	1386029510	/nfs/dbraw/zinc/02/95/10/1386029510.db2.gz	FMRMIIWRVNELGB-UHFFFAOYSA-N	0	3	331.435	3.264	20	30		EGEDHN
Cc1nc(Cl)c(NC(=O)C(C#N)Cc2cccs2)c(Cl)n1	ZINC001177903586	1386078462	/nfs/dbraw/zinc/07/84/62/1386078462.db2.gz	IOPMSLLINBLWAJ-QMMMGPOBSA-N	0	3	341.223	3.474	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2c[nH]nc2-c2ccco2)CCCC1	ZINC001319389171	1386098625	/nfs/dbraw/zinc/09/86/25/1386098625.db2.gz	IDMQXBZGBOETOJ-UHFFFAOYSA-N	0	3	348.834	3.054	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccc(Cl)cc2)CCN1C(=O)CC1CC1	ZINC001178022613	1386110603	/nfs/dbraw/zinc/11/06/03/1386110603.db2.gz	HABNPAMBQZXOSI-KSSFIOAISA-N	0	3	330.859	3.071	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@H](NCC#Cc3ccccc3)[C@@H]2C)c(C)o1	ZINC001178099623	1386128820	/nfs/dbraw/zinc/12/88/20/1386128820.db2.gz	UARWCSPJYNRCNZ-JXFKEZNVSA-N	0	3	336.435	3.141	20	30		EGEDHN
N#Cc1c[nH]c(C(=O)NCCCCCCNC/C(Cl)=C/Cl)c1	ZINC001178134847	1386138450	/nfs/dbraw/zinc/13/84/50/1386138450.db2.gz	YSTDTFAMSWIXMJ-JYRVWZFOSA-N	0	3	343.258	3.085	20	30		EGEDHN
C[C@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)C1(F)CCCCC1	ZINC001319558510	1386177816	/nfs/dbraw/zinc/17/78/16/1386177816.db2.gz	NSPLKBKVSHBXBN-CQSZACIVSA-N	0	3	349.425	3.306	20	30		EGEDHN
CC(C)[C@@H](C)CC(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)[C@@H]1C	ZINC001178307783	1386184942	/nfs/dbraw/zinc/18/49/42/1386184942.db2.gz	AQBDWRLKOPZXFA-DOXZYTNZSA-N	0	3	345.462	3.459	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H](CNCc2ccc(C#N)s2)CC(C)C)o1	ZINC001319603666	1386201989	/nfs/dbraw/zinc/20/19/89/1386201989.db2.gz	SBQYIARSEYRSDA-AWEZNQCLSA-N	0	3	345.468	3.456	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)C(F)=C1CCCC1	ZINC001178462508	1386223799	/nfs/dbraw/zinc/22/37/99/1386223799.db2.gz	BQVHWARGFTWSMP-LPHOPBHVSA-N	0	3	340.442	3.415	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)[C@@H]2Cc3cccc(C)c3O2)CCCC1	ZINC001698637339	1406283632	/nfs/dbraw/zinc/28/36/32/1406283632.db2.gz	BISNMANQCGOJFM-INIZCTEOSA-N	0	3	348.874	3.070	20	30		EGEDHN
CCCCCCC[NH2+]CCCCCCNC(=O)c1cnc[n-]c1=O	ZINC001178786518	1386304858	/nfs/dbraw/zinc/30/48/58/1386304858.db2.gz	LNSTYPCKSCMNNO-UHFFFAOYSA-N	0	3	336.480	3.032	20	30		EGEDHN
Cc1coc(C(=O)NC[C@@H](NCc2ccc(C#N)cc2F)C(C)C)c1	ZINC001319934168	1386400716	/nfs/dbraw/zinc/40/07/16/1386400716.db2.gz	ARIQGAFXYRUZEG-QGZVFWFLSA-N	0	3	343.402	3.143	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2cccc(Cl)c2)CCN1C(=O)CCCF	ZINC001179337332	1386455213	/nfs/dbraw/zinc/45/52/13/1386455213.db2.gz	NDTJORGUPGFRDQ-YOEHRIQHSA-N	0	3	336.838	3.020	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](NCc2cnn(C(C)(C)C)c2)[C@@H]1C	ZINC001179384399	1386469105	/nfs/dbraw/zinc/46/91/05/1386469105.db2.gz	LIALIELQNLTRHB-BQFCYCMXSA-N	0	3	346.519	3.319	20	30		EGEDHN
N#Cc1ccccc1CNCCCCCCNC(=O)[C@H]1CC[C@H](F)C1	ZINC001179388042	1386470658	/nfs/dbraw/zinc/47/06/58/1386470658.db2.gz	LJOLUIOHSWXMLX-LPHOPBHVSA-N	0	3	345.462	3.463	20	30		EGEDHN
C=CCCCC(=O)NCCCCCCNCc1cc2n(n1)CCCC2	ZINC001179426328	1386481270	/nfs/dbraw/zinc/48/12/70/1386481270.db2.gz	UZWVGDBZYOBZRD-UHFFFAOYSA-N	0	3	346.519	3.342	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2cccc(Cl)c2)CCN1C(=O)[C@@H]1CC12CC2	ZINC001179598637	1386528338	/nfs/dbraw/zinc/52/83/38/1386528338.db2.gz	KIWGHTQVQACFBN-WBAXXEDZSA-N	0	3	342.870	3.071	20	30		EGEDHN
C[C@H](CNCc1ccc(F)c(C#N)c1)NC(=O)CC(C)(C)C1CC1	ZINC001321512372	1386919661	/nfs/dbraw/zinc/91/96/61/1386919661.db2.gz	WGRZXOKVMQVEAB-CYBMUJFWSA-N	0	3	331.435	3.118	20	30		EGEDHN
CCCC[C@H](C)C(=O)N1CC[C@@H](NCc2ccc(OC)c(C#N)c2)C1	ZINC001182277752	1387136534	/nfs/dbraw/zinc/13/65/34/1387136534.db2.gz	KEHXTSQBSQBHQZ-MAUKXSAKSA-N	0	3	343.471	3.084	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2ccccc2C#N)C1	ZINC001182796122	1387226222	/nfs/dbraw/zinc/22/62/22/1387226222.db2.gz	IJXKRJKHAXUQBY-CBGDNZLLSA-N	0	3	341.499	3.425	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](NCc2c(C)nsc2C)C1	ZINC001182841647	1387233987	/nfs/dbraw/zinc/23/39/87/1387233987.db2.gz	UTQGEFQZDMTAAA-MRXNPFEDSA-N	0	3	333.501	3.219	20	30		EGEDHN
CC(F)(F)CC(=O)NC[C@@H]1CCCCCN1Cc1ccc(C#N)cc1	ZINC001329935615	1389263643	/nfs/dbraw/zinc/26/36/43/1389263643.db2.gz	CCBBKJLEBAESQT-KRWDZBQOSA-N	0	3	349.425	3.464	20	30		EGEDHN
C=CCN(CC=C)C(=O)c1ccc(NC(=O)[C@@H](N)C[C@@H](C)CC)cc1	ZINC001339858882	1390177160	/nfs/dbraw/zinc/17/71/60/1390177160.db2.gz	VIVHRDOQBDKUMN-YJBOKZPZSA-N	0	3	343.471	3.203	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N[C@@H](C)c1noc(-c2ccc(Cl)cc2)n1	ZINC001340123974	1390231510	/nfs/dbraw/zinc/23/15/10/1390231510.db2.gz	WRURBEBVSJYRKY-FZMZJTMJSA-N	0	3	348.834	3.251	20	30		EGEDHN
C=C(Br)CNC1CC(N(C)C(=O)C2(CC)CCCC2)C1	ZINC001333131785	1390254412	/nfs/dbraw/zinc/25/44/12/1390254412.db2.gz	ZXGWGSBJOJWQQR-UHFFFAOYSA-N	0	3	343.309	3.444	20	30		EGEDHN
C=CCn1c(C(F)F)nnc1N1CCCN(Cc2ccccc2)CC1	ZINC001340682755	1390344312	/nfs/dbraw/zinc/34/43/12/1390344312.db2.gz	ZWULSFRHEBVYCT-UHFFFAOYSA-N	0	3	347.413	3.114	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N[C@H]1CCc2c1cccc2Br	ZINC001341421779	1390485113	/nfs/dbraw/zinc/48/51/13/1390485113.db2.gz	FNCGVCDGGPBXBE-GJZGRUSLSA-N	0	3	337.261	3.236	20	30		EGEDHN
C=C[C@H](CC)CC(=O)C(C#N)C(=O)Nc1ccc(C(=O)OCC)cc1	ZINC001341954936	1390554071	/nfs/dbraw/zinc/55/40/71/1390554071.db2.gz	IHNKWZWGNPUKQX-CZUORRHYSA-N	0	3	342.395	3.113	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc(Br)cc1OC	ZINC001342374952	1390606349	/nfs/dbraw/zinc/60/63/49/1390606349.db2.gz	RPMROVJLHRDUQV-NSHDSACASA-N	0	3	327.222	3.080	20	30		EGEDHN
C[C@H](CC#N)OC(=O)C1CCN(c2cc(Cl)ccc2Cl)C1=O	ZINC001342565522	1390626873	/nfs/dbraw/zinc/62/68/73/1390626873.db2.gz	GRTAMQWSPPCQNE-KOLCDFICSA-N	0	3	341.194	3.192	20	30		EGEDHN
C[C@@H](CC#N)OC(=O)C1CCN(c2cc(Cl)ccc2Cl)C1=O	ZINC001342565521	1390627013	/nfs/dbraw/zinc/62/70/13/1390627013.db2.gz	GRTAMQWSPPCQNE-GXSJLCMTSA-N	0	3	341.194	3.192	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CC(C)(C)CNC(=O)OC(C)(C)C	ZINC001344322466	1390782107	/nfs/dbraw/zinc/78/21/07/1390782107.db2.gz	PHXKTENJWIJTPV-CYBMUJFWSA-N	0	3	348.447	3.020	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCc1cccc(Br)c1	ZINC001346096240	1390907314	/nfs/dbraw/zinc/90/73/14/1390907314.db2.gz	OUKLJANHRVLQGP-AWEZNQCLSA-N	0	3	346.228	3.475	20	30		EGEDHN
CCN1C[C@H](C)N(c2nnc([C@H](C)CCC#N)n2CC2CC2)C[C@@H]1C	ZINC001346901825	1390985828	/nfs/dbraw/zinc/98/58/28/1390985828.db2.gz	SFNUWLWGZDERTD-PMPSAXMXSA-N	0	3	344.507	3.014	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)N(C)C(=O)CC(C)(C)C1CC1	ZINC001698821582	1406513571	/nfs/dbraw/zinc/51/35/71/1406513571.db2.gz	QAEUHWPMSIJMFY-CYBMUJFWSA-N	0	3	333.501	3.383	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@@H](CC)OC2CCCCC2)C1	ZINC001479368974	1392226691	/nfs/dbraw/zinc/22/66/91/1392226691.db2.gz	LONSEKNEHZFVPF-BFYDXBDKSA-N	0	3	342.911	3.351	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)Cc2ccc(C)c(Cl)c2)C1	ZINC001479378772	1392228392	/nfs/dbraw/zinc/22/83/92/1392228392.db2.gz	BAQVUNOZRWGUIE-SHTZXODSSA-N	0	3	341.282	3.428	20	30		EGEDHN
CCN(CCNC(=O)CC1CCCCC1)Cc1ccc(C#N)cc1	ZINC001480962122	1393051215	/nfs/dbraw/zinc/05/12/15/1393051215.db2.gz	YXNDASJGTSCMOW-UHFFFAOYSA-N	0	3	327.472	3.467	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)CC(C)(C)C)CC1	ZINC001491340864	1394507751	/nfs/dbraw/zinc/50/77/51/1394507751.db2.gz	RWIOTVISZOWPDR-UHFFFAOYSA-N	0	3	331.298	3.348	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)CCCC2CCOCC2)CCCC1	ZINC001481898099	1394585656	/nfs/dbraw/zinc/58/56/56/1394585656.db2.gz	RSXZVLVSZYZDEP-UHFFFAOYSA-N	0	3	342.911	3.354	20	30		EGEDHN
C=C(Br)CN[C@@H](CNC(=O)C1C(C)(C)C1(C)C)C(C)C	ZINC001698958223	1406709524	/nfs/dbraw/zinc/70/95/24/1406709524.db2.gz	GEJAGNRFBAEDQR-LBPRGKRZSA-N	0	3	345.325	3.308	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cc2ccncc2s1)C(C)C	ZINC001482534995	1395075789	/nfs/dbraw/zinc/07/57/89/1395075789.db2.gz	VYZVVEQXXZZOAK-ZDUSSCGKSA-N	0	3	337.876	3.393	20	30		EGEDHN
C[C@@H](CNC(=O)c1c[nH]c2ccccc21)N(C)Cc1cccc(C#N)c1	ZINC001485326889	1395803183	/nfs/dbraw/zinc/80/31/83/1395803183.db2.gz	PVOBKRXGLYULAT-HNNXBMFYSA-N	0	3	346.434	3.290	20	30		EGEDHN
CN(C(=O)C1CC2(CC2)C1)[C@@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001485828525	1396158715	/nfs/dbraw/zinc/15/87/15/1396158715.db2.gz	WZKNFAMRNLVURE-KRWDZBQOSA-N	0	3	343.496	3.137	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)CC(C)(F)F)CCN1Cc1ccc(C#N)cc1	ZINC001502985334	1396237220	/nfs/dbraw/zinc/23/72/20/1396237220.db2.gz	FRAOJIJYXMDUCD-BBRMVZONSA-N	0	3	335.398	3.073	20	30		EGEDHN
C=C(Br)CN[C@@H](C)CCNC(=O)c1ccc(C)c(C)c1	ZINC001503601010	1396260193	/nfs/dbraw/zinc/26/01/93/1396260193.db2.gz	HCHXTHBSFFRNDJ-AWEZNQCLSA-N	0	3	339.277	3.310	20	30		EGEDHN
CC1(C)CC(C(=O)NC[C@H](NCc2ccc(C#N)cc2F)C2CC2)C1	ZINC001690150097	1404349702	/nfs/dbraw/zinc/34/97/02/1404349702.db2.gz	XROADGSFBVJYTC-SFHVURJKSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](NCc3cccnc3C)C2)CCCC1	ZINC001690261039	1404433957	/nfs/dbraw/zinc/43/39/57/1404433957.db2.gz	RJOQBQPZZISVQV-SFHVURJKSA-N	0	3	327.472	3.217	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)c1ccc(CC)s1	ZINC001690852045	1404777547	/nfs/dbraw/zinc/77/75/47/1404777547.db2.gz	QUEILCVRVAKPDC-LLVKDONJSA-N	0	3	345.306	3.317	20	30		EGEDHN
C[C@H](CCNC(=O)c1ccoc1C1CC1)NCc1ccccc1C#N	ZINC001690859996	1404781074	/nfs/dbraw/zinc/78/10/74/1404781074.db2.gz	PEUQHUIXBSNAFW-CQSZACIVSA-N	0	3	337.423	3.327	20	30		EGEDHN
C[C@@H](C(=O)NC[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1)C(C)(C)C	ZINC001691100711	1405039688	/nfs/dbraw/zinc/03/96/88/1405039688.db2.gz	BMJSEHIFNKPROK-JLJPHGGASA-N	0	3	345.462	3.364	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H](CNC(=O)CC3CCCC3)C2)c1	ZINC001691115213	1405056651	/nfs/dbraw/zinc/05/66/51/1405056651.db2.gz	GHWJWEMOAVRLOD-IBGZPJMESA-N	0	3	325.456	3.077	20	30		EGEDHN
C[C@H](C(=O)NC[C@@H]1CCN(Cc2cccc(C#N)c2)C1)c1ccccc1	ZINC001691166693	1405102311	/nfs/dbraw/zinc/10/23/11/1405102311.db2.gz	YHTCCOJRZJYBSI-PXNSSMCTSA-N	0	3	347.462	3.300	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)CCc2c[nH]c3ccccc23)C1	ZINC001691537434	1405328684	/nfs/dbraw/zinc/32/86/84/1405328684.db2.gz	BEDBCLJOBFMCCL-KOMQPUFPSA-N	0	3	345.874	3.337	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)C[C@@H](C)CCC)C1	ZINC001691694811	1405428171	/nfs/dbraw/zinc/42/81/71/1405428171.db2.gz	UDUKTEVXDUZWJG-FPMFFAJLSA-N	0	3	331.298	3.206	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1cc2ccccc2[nH]1)C1CC1	ZINC001732252420	1428494136	/nfs/dbraw/zinc/49/41/36/1428494136.db2.gz	APWZZYCQMMORQL-GOSISDBHSA-N	0	3	331.847	3.409	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2c(C)noc2C)CCCC[C@H]1C	ZINC001732254171	1428495512	/nfs/dbraw/zinc/49/55/12/1428495512.db2.gz	TUJDFWFNCQWEKP-PIGZYNQJSA-N	0	3	339.867	3.312	20	30		EGEDHN
Cc1cccc(Cl)c1CNC1(CNC(=O)[C@@H](C)C#N)CCCC1	ZINC001732388358	1428558762	/nfs/dbraw/zinc/55/87/62/1428558762.db2.gz	IUGNSCQHKMFQRG-AWEZNQCLSA-N	0	3	333.863	3.327	20	30		EGEDHN
CC[C@@H](NC[C@H](C)NC(=O)c1cc(C#N)c[nH]1)c1ccc(F)cc1F	ZINC001699398582	1412712717	/nfs/dbraw/zinc/71/27/17/1412712717.db2.gz	CTCQWNBYTDVMJY-MEDUHNTESA-N	0	3	346.381	3.024	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(C(F)F)cc1)NC(=O)c1cc(C#N)c[nH]1	ZINC001699440888	1412768687	/nfs/dbraw/zinc/76/86/87/1412768687.db2.gz	GJPWEJOOUWTIOO-GFCCVEGCSA-N	0	3	346.381	3.074	20	30		EGEDHN
CC1(C)CC[C@@H]1C(=O)N1CCC[C@@H]1CNCC#Cc1ccc(F)cc1	ZINC001699756942	1413163438	/nfs/dbraw/zinc/16/34/38/1413163438.db2.gz	JVHOIJWCJPDBDM-RTBURBONSA-N	0	3	342.458	3.194	20	30		EGEDHN
Cc1ccc(CN2CCC(C)(CNC(=O)[C@H](C)C#N)CC2)cc1F	ZINC001699857993	1413289713	/nfs/dbraw/zinc/28/97/13/1413289713.db2.gz	HUPRGTZDQVPQNY-OAHLLOKOSA-N	0	3	331.435	3.012	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)C(C3CC3)C3CC3)CCC2)s1	ZINC001700142296	1413564164	/nfs/dbraw/zinc/56/41/64/1413564164.db2.gz	RGDXZGNNSQRRGB-UHFFFAOYSA-N	0	3	343.496	3.184	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1ccnc2ccccc21)C(C)C	ZINC001732559542	1428748613	/nfs/dbraw/zinc/74/86/13/1428748613.db2.gz	AXIPHYDWJHGTCD-KRWDZBQOSA-N	0	3	331.847	3.331	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cc(-c2ccccc2)n[nH]1)C(C)C	ZINC001732560037	1428749451	/nfs/dbraw/zinc/74/94/51/1428749451.db2.gz	DMVRTRXIYKTZMX-QGZVFWFLSA-N	0	3	346.862	3.173	20	30		EGEDHN
CCC(CC)C(=O)N[C@@H]1CCN(Cc2cccc(C#N)c2)[C@H](C)C1	ZINC001700312599	1413767873	/nfs/dbraw/zinc/76/78/73/1413767873.db2.gz	VHFBZAYVYITSRG-DNVCBOLYSA-N	0	3	327.472	3.464	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1c(F)ccc(F)c1OC)C(C)C	ZINC001732564143	1428754839	/nfs/dbraw/zinc/75/48/39/1428754839.db2.gz	GOXQOVANDHMFDG-ZDUSSCGKSA-N	0	3	346.805	3.070	20	30		EGEDHN
CN(CC(C)(C)CNCc1ccccc1C#N)C(=O)C1C=CC=CC=C1	ZINC001700440273	1414012459	/nfs/dbraw/zinc/01/24/59/1414012459.db2.gz	PMUDCEMEVPOJRW-UHFFFAOYSA-N	0	3	349.478	3.431	20	30		EGEDHN
CN(C(=O)C1(F)CCCC1)[C@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001700724975	1414386308	/nfs/dbraw/zinc/38/63/08/1414386308.db2.gz	OAAXNYXMAHCJDU-MRXNPFEDSA-N	0	3	349.475	3.229	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)NC(=O)c1cc2ccccc2o1	ZINC001733023014	1429142156	/nfs/dbraw/zinc/14/21/56/1429142156.db2.gz	STZIOBCVRUKENF-LBPRGKRZSA-N	0	3	339.420	3.274	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)C2(c3ccccc3C)CC2)C1	ZINC001707075280	1417186424	/nfs/dbraw/zinc/18/64/24/1417186424.db2.gz	RCODZGRWQMIUTJ-IYBDPMFKSA-N	0	3	332.875	3.264	20	30		EGEDHN
Cc1c(F)cccc1C(=O)N[C@H](C)CN(C)Cc1cccc(C#N)c1	ZINC001733040260	1429168690	/nfs/dbraw/zinc/16/86/90/1429168690.db2.gz	ZVCOUGPDHJTNIV-CQSZACIVSA-N	0	3	339.414	3.256	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)C1CCC2(CC2)CC1	ZINC001733042451	1429172354	/nfs/dbraw/zinc/17/23/54/1429172354.db2.gz	JBYJKPVWRRUCGZ-MRXNPFEDSA-N	0	3	339.483	3.465	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@H]3NC(=O)CCC3CC3)CC2)c1	ZINC001713091785	1417639891	/nfs/dbraw/zinc/63/98/91/1417639891.db2.gz	LJZKXVARGHFZEK-LJQANCHMSA-N	0	3	337.467	3.219	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)[C@H](CCC)C(C)C)C1	ZINC001713170039	1417743123	/nfs/dbraw/zinc/74/31/23/1417743123.db2.gz	QRKHMUDVYHHJDV-MGPQQGTHSA-N	0	3	331.298	3.204	20	30		EGEDHN
CC1(CC(=O)NC2CCC(NCc3ccccc3C#N)CC2)CC1	ZINC001713289716	1417917065	/nfs/dbraw/zinc/91/70/65/1417917065.db2.gz	QTJCRZTZAMMXQG-UHFFFAOYSA-N	0	3	325.456	3.265	20	30		EGEDHN
CC1(CCC(=O)N2CC[C@@H](CNCc3ccccc3C#N)C2)CC1	ZINC001713359971	1417975199	/nfs/dbraw/zinc/97/51/99/1417975199.db2.gz	YQDCIVCPNXHUCM-INIZCTEOSA-N	0	3	325.456	3.077	20	30		EGEDHN
CCCCC(=O)N1CCC[C@H](N(C)Cc2ccc(OC)c(C#N)c2)C1	ZINC001713388468	1417999013	/nfs/dbraw/zinc/99/90/13/1417999013.db2.gz	YQLPBELPSUEJDU-SFHVURJKSA-N	0	3	343.471	3.180	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCN(C1CC1)[C@@H]1CCc2c1cccc2Cl	ZINC001713555069	1418346095	/nfs/dbraw/zinc/34/60/95/1418346095.db2.gz	LSDXSTOESBPURM-YVEFUNNKSA-N	0	3	331.847	3.068	20	30		EGEDHN
CC(C)(C(=O)NC[C@H]1CCCN(Cc2ccc(C#N)cc2)C1)C(F)F	ZINC001714042904	1418833539	/nfs/dbraw/zinc/83/35/39/1418833539.db2.gz	IUIPTRDALSUOHA-MRXNPFEDSA-N	0	3	349.425	3.178	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)CC2(C)CC2)CC1	ZINC001714191346	1418997881	/nfs/dbraw/zinc/99/78/81/1418997881.db2.gz	ICWZCKRYBARXNV-UHFFFAOYSA-N	0	3	329.282	3.102	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1cccc2ccc(C)nc21	ZINC001714476188	1419199717	/nfs/dbraw/zinc/19/97/17/1419199717.db2.gz	ZINKHHVPPIOFBW-CYBMUJFWSA-N	0	3	331.847	3.394	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)c1ccoc1C(C)C	ZINC001714505149	1419232119	/nfs/dbraw/zinc/23/21/19/1419232119.db2.gz	WUQQFAMOADTDNN-GFCCVEGCSA-N	0	3	343.265	3.410	20	30		EGEDHN
Cc1cc(C(=O)N(C)[C@@H](C)CNCc2ccc(C#N)s2)oc1C	ZINC001714595911	1419348385	/nfs/dbraw/zinc/34/83/85/1419348385.db2.gz	YOSAZANILZNTSZ-LBPRGKRZSA-N	0	3	331.441	3.080	20	30		EGEDHN
CCC1(C(=O)N[C@@H](CNCc2ccc(C#N)s2)CC(C)C)CC1	ZINC001714925550	1419679366	/nfs/dbraw/zinc/67/93/66/1419679366.db2.gz	MPWHBGBPWJVYCZ-CQSZACIVSA-N	0	3	333.501	3.430	20	30		EGEDHN
CC(C)CC(=O)NCC1(NCc2cc(C#N)ccc2F)CCCC1	ZINC001715294252	1420001552	/nfs/dbraw/zinc/00/15/52/1420001552.db2.gz	LVWJTYVQTKGQAI-UHFFFAOYSA-N	0	3	331.435	3.262	20	30		EGEDHN
C=C(Br)CNC[C@@H]1[C@H](C)CCCN1C(=O)CC1CCC1	ZINC001715354183	1420054114	/nfs/dbraw/zinc/05/41/14/1420054114.db2.gz	HOYQXCGYVPSLNX-IUODEOHRSA-N	0	3	343.309	3.302	20	30		EGEDHN
Cc1ccc(C(=O)N(C)[C@@H](C)CNCc2ccc(C#N)s2)cc1F	ZINC001715345921	1420047804	/nfs/dbraw/zinc/04/78/04/1420047804.db2.gz	NOTMWXLSINAPPV-ZDUSSCGKSA-N	0	3	345.443	3.318	20	30		EGEDHN
CC(C)C[C@H](CNCc1ccc(F)c(C#N)c1)NC(=O)C(C)(C)C	ZINC001715393674	1420090863	/nfs/dbraw/zinc/09/08/63/1420090863.db2.gz	PQCORBUZUOPAFE-MRXNPFEDSA-N	0	3	333.451	3.364	20	30		EGEDHN
CCC(=O)N1CCC(CCN(C)Cc2ccc(C#N)cc2F)CC1	ZINC001715475957	1420154772	/nfs/dbraw/zinc/15/47/72/1420154772.db2.gz	NGGSHMDGPCOBPS-UHFFFAOYSA-N	0	3	331.435	3.168	20	30		EGEDHN
CCC(CC)C(=O)N[C@H]1CCC[C@@H]1CNCc1ccccc1C#N	ZINC001715544902	1420242154	/nfs/dbraw/zinc/24/21/54/1420242154.db2.gz	GWHNLSALDZHZIW-MOPGFXCFSA-N	0	3	327.472	3.369	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1nsc2ccccc21)C(C)C	ZINC001715554394	1420249387	/nfs/dbraw/zinc/24/93/87/1420249387.db2.gz	CDHBBFMWQRGGQU-CYBMUJFWSA-N	0	3	337.876	3.393	20	30		EGEDHN
Cc1cc(F)c(C(=O)N[C@@H](C)CNCc2ccc(C#N)s2)cc1F	ZINC001715986982	1420444841	/nfs/dbraw/zinc/44/48/41/1420444841.db2.gz	NEYVRBZNVBTPQZ-NSHDSACASA-N	0	3	349.406	3.115	20	30		EGEDHN
CC(C)SCC(=O)N[C@H]1CCN(Cc2ccc(C#N)cc2)[C@@H](C)C1	ZINC001717329766	1421265086	/nfs/dbraw/zinc/26/50/86/1421265086.db2.gz	MPCLYLULOJDWNL-YJBOKZPZSA-N	0	3	345.512	3.169	20	30		EGEDHN
C[C@@H](CCNC(=O)[C@]1(C)CC=CCC1)NCc1cc(C#N)ccc1F	ZINC001717340778	1421278358	/nfs/dbraw/zinc/27/83/58/1421278358.db2.gz	RWPTVGOOLXELDE-MGPUTAFESA-N	0	3	343.446	3.428	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)Cc1nc(C)sc1C	ZINC001717455009	1421384708	/nfs/dbraw/zinc/38/47/08/1421384708.db2.gz	UTCFTZXWKBFKIP-UHFFFAOYSA-N	0	3	343.924	3.129	20	30		EGEDHN
CN(C(=O)CCC1CC1)[C@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001717728416	1421595477	/nfs/dbraw/zinc/59/54/77/1421595477.db2.gz	JLHMUBSVQDWUGJ-LJQANCHMSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2ccc(C#N)s2)CN1C(=O)CCC(C)(F)F	ZINC001717817973	1421636967	/nfs/dbraw/zinc/63/69/67/1421636967.db2.gz	NNEXENHZVQWLAW-NEPJUHHUSA-N	0	3	341.427	3.134	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC1(C)CCN([C@H]2CCc3c2cccc3Cl)CC1	ZINC001723999067	1424621921	/nfs/dbraw/zinc/62/19/21/1424621921.db2.gz	XJTLYVOXCVSBGV-GUYCJALGSA-N	0	3	345.874	3.458	20	30		EGEDHN
CN(CCCN(C)C(=O)C1(F)CCCC1)Cc1ccc(F)c(C#N)c1	ZINC001724851215	1425213708	/nfs/dbraw/zinc/21/37/08/1425213708.db2.gz	IWRUPEJESWQYPC-UHFFFAOYSA-N	0	3	349.425	3.260	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)CCC2CC2)CCN1Cc1cccc(C#N)c1	ZINC001724988165	1425388268	/nfs/dbraw/zinc/38/82/68/1425388268.db2.gz	FNKNLCKQPAMWAK-DNVCBOLYSA-N	0	3	325.456	3.218	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)C(C)(C)C(F)F)CCN1Cc1cccc(C#N)c1	ZINC001724994497	1425399209	/nfs/dbraw/zinc/39/92/09/1425399209.db2.gz	IACPLZRSDRRSLR-BBRMVZONSA-N	0	3	349.425	3.319	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)CO[C@@H](C)CC)CC1	ZINC001725023360	1425439586	/nfs/dbraw/zinc/43/95/86/1425439586.db2.gz	LSNCPPAPQCPSPE-HNNXBMFYSA-N	0	3	330.900	3.115	20	30		EGEDHN
C[C@H](CNC(=O)c1ccc2cc[nH]c2c1)N(C)Cc1ccc(C#N)cc1	ZINC001725187792	1425723254	/nfs/dbraw/zinc/72/32/54/1425723254.db2.gz	XGMGLDXYGWVEEG-OAHLLOKOSA-N	0	3	346.434	3.290	20	30		EGEDHN
C[C@@H]1[C@H](NCc2ccc(C#N)s2)CCN1C(=O)CCC(C)(F)F	ZINC001725567825	1426229004	/nfs/dbraw/zinc/22/90/04/1426229004.db2.gz	UQFLDZOJDAKYHB-BXUZGUMPSA-N	0	3	341.427	3.134	20	30		EGEDHN
CC(C)CC(=O)N[C@@H](CNCc1ccc(C#N)cc1F)C(C)(C)C	ZINC001725739940	1426415835	/nfs/dbraw/zinc/41/58/35/1426415835.db2.gz	ZGWWQJGMDSWSHZ-KRWDZBQOSA-N	0	3	333.451	3.364	20	30		EGEDHN
C=C(Br)CNC[C@H](NC(=O)c1cocc1C)C(C)(C)C	ZINC001725792680	1426478091	/nfs/dbraw/zinc/47/80/91/1426478091.db2.gz	KKOAVQCIAXQHNL-ZDUSSCGKSA-N	0	3	343.265	3.231	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1cc2c(s1)CCCC2	ZINC001731738728	1427823403	/nfs/dbraw/zinc/82/34/03/1427823403.db2.gz	JQRYSWNOEZRAHA-LBPRGKRZSA-N	0	3	326.893	3.477	20	30		EGEDHN
CCC1(C(=O)NCC2(NCc3ccc(F)c(C#N)c3)CCC2)CCC1	ZINC001733722446	1429945168	/nfs/dbraw/zinc/94/51/68/1429945168.db2.gz	UJIWVVJUFWIKBG-UHFFFAOYSA-N	0	3	343.446	3.406	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)c2ccncc2F)CC1	ZINC001733918975	1437732434	/nfs/dbraw/zinc/73/24/34/1437732434.db2.gz	QULRIRSRKJCAJS-UHFFFAOYSA-N	0	3	339.842	3.147	20	30		EGEDHN
C[C@H](CNC(=O)C(C)(C)c1ccccc1)N(C)Cc1cccc(C#N)c1	ZINC001734061786	1437855919	/nfs/dbraw/zinc/85/59/19/1437855919.db2.gz	AXZGHOQOTBDAKR-QGZVFWFLSA-N	0	3	349.478	3.473	20	30		EGEDHN
C[C@@H](CN(C)C(=O)c1ccsc1)NCc1ccc(F)c(C#N)c1	ZINC001734311822	1438042658	/nfs/dbraw/zinc/04/26/58/1438042658.db2.gz	CWSXBQIVMPTMPP-LBPRGKRZSA-N	0	3	331.416	3.009	20	30		EGEDHN
Cc1ccc(C(=O)N(C)C[C@H](C)NCc2ccc(C#N)s2)c(F)c1	ZINC001734344800	1438064487	/nfs/dbraw/zinc/06/44/87/1438064487.db2.gz	XKLLESNHKWKKOD-ZDUSSCGKSA-N	0	3	345.443	3.318	20	30		EGEDHN
CC(C)(C)[C@@H](CNCc1ccc(C#N)cc1F)NC(=O)C1=CCCC1	ZINC001734558833	1438157031	/nfs/dbraw/zinc/15/70/31/1438157031.db2.gz	FDLYVTITVNRCOD-GOSISDBHSA-N	0	3	343.446	3.428	20	30		EGEDHN
C[C@H](NCC#Cc1ccccc1)[C@@H]1CCCCN1C(=O)c1ccc[nH]1	ZINC001752132948	1440143838	/nfs/dbraw/zinc/14/38/38/1440143838.db2.gz	XLIFSNUHWKTJFR-PXNSSMCTSA-N	0	3	335.451	3.039	20	30		EGEDHN
Cc1cc[nH]c1C(=O)N1CCCC[C@H]1[C@@H](C)NCC#Cc1ccccc1	ZINC001752144189	1440145390	/nfs/dbraw/zinc/14/53/90/1440145390.db2.gz	CFTCUFXOIXSZNV-QUCCMNQESA-N	0	3	349.478	3.348	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1CC12CCN(Cc1c(C)noc1CC)CC2	ZINC001752427433	1440177527	/nfs/dbraw/zinc/17/75/27/1440177527.db2.gz	OVMYNDOEHFMEFO-SFHVURJKSA-N	0	3	345.487	3.372	20	30		EGEDHN
C=CCN1CCC(N(CCC)C(=O)Cc2cccc(F)c2F)CC1	ZINC001752440178	1440181238	/nfs/dbraw/zinc/18/12/38/1440181238.db2.gz	UWQPWUHTCWNGHH-UHFFFAOYSA-N	0	3	336.426	3.396	20	30		EGEDHN
CCCC(C)(C)C(=O)NC[C@H](NCC#Cc1ccc(F)cc1)C1CC1	ZINC001752479920	1440185348	/nfs/dbraw/zinc/18/53/48/1440185348.db2.gz	ILIKGPKJIWMOIH-IBGZPJMESA-N	0	3	344.474	3.488	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CCCc1csc(C)n1	ZINC001752534493	1440194062	/nfs/dbraw/zinc/19/40/62/1440194062.db2.gz	KSGCAKQPCWJFPD-HDICACEKSA-N	0	3	347.528	3.416	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)COc1cccc(C)c1	ZINC001752544972	1440195039	/nfs/dbraw/zinc/19/50/39/1440195039.db2.gz	JVDZHHKQNCKNSJ-GBESFXJTSA-N	0	3	342.483	3.404	20	30		EGEDHN
CC[C@@H](C)CCC(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001752595564	1440195782	/nfs/dbraw/zinc/19/57/82/1440195782.db2.gz	DTHLSJZEKJPQGM-PBHICJAKSA-N	0	3	331.435	3.214	20	30		EGEDHN
Cc1ccoc1C(=O)N[C@H]1C[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001752612836	1440196349	/nfs/dbraw/zinc/19/63/49/1440196349.db2.gz	RYRLGOGTWBHADL-QAQDUYKDSA-N	0	3	342.826	3.144	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@H]1C[C@H](NCc2cccc(F)c2Cl)C1	ZINC001752629482	1440197068	/nfs/dbraw/zinc/19/70/68/1440197068.db2.gz	ZJTBSYNDQKOEPX-HDJSIYSDSA-N	0	3	336.838	3.265	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@H]1C[C@H](NCc2cc(F)ccc2OC)C1	ZINC001752654641	1440198147	/nfs/dbraw/zinc/19/81/47/1440198147.db2.gz	BTCOJQBXSAIZKS-JQFCIGGWSA-N	0	3	334.435	3.173	20	30		EGEDHN
CCC(CC)CC(=O)N[C@H]1C[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001752672167	1440198936	/nfs/dbraw/zinc/19/89/36/1440198936.db2.gz	APIWTBTVCOLCJO-WGSAOQKQSA-N	0	3	330.447	3.240	20	30		EGEDHN
CCC(C)(CC)C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2OC)C1	ZINC001752683396	1440199873	/nfs/dbraw/zinc/19/98/73/1440199873.db2.gz	ZUZBWFKFQCUTQI-QAQDUYKDSA-N	0	3	343.471	3.130	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1C[C@@H](NCc2ccncc2Cl)C1	ZINC001752730779	1440204067	/nfs/dbraw/zinc/20/40/67/1440204067.db2.gz	HMQILYILVWAXSH-IYBDPMFKSA-N	0	3	333.863	3.240	20	30		EGEDHN
CC[C@H](SC)C(=O)NC[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001752780211	1440208723	/nfs/dbraw/zinc/20/87/23/1440208723.db2.gz	UPHVIZICMMOODL-MSOLQXFVSA-N	0	3	345.512	3.028	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@H]1CCCN(Cc2ncccc2C)C1	ZINC001752785736	1440211210	/nfs/dbraw/zinc/21/12/10/1440211210.db2.gz	DFKAAHDTZGSYEG-ZWKOTPCHSA-N	0	3	329.488	3.321	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CCC[C@@H](CNC/C(Cl)=C\Cl)C1	ZINC001752794976	1440214227	/nfs/dbraw/zinc/21/42/27/1440214227.db2.gz	VPSFONPBZTVTJY-PWCXKOHKSA-N	0	3	349.302	3.115	20	30		EGEDHN
CC(C)c1ccc(CN2CCCC[C@H]2CNC(=O)[C@@H](C)C#N)cc1	ZINC001752816975	1440218355	/nfs/dbraw/zinc/21/83/55/1440218355.db2.gz	SSEKQTLAUWVBRP-LPHOPBHVSA-N	0	3	327.472	3.440	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)C1(Cc2ccccc2F)CC1	ZINC001752824173	1440222827	/nfs/dbraw/zinc/22/28/27/1440222827.db2.gz	QUFIATAJMROAQR-GOSISDBHSA-N	0	3	342.458	3.142	20	30		EGEDHN
COCC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)CCCC(C)C	ZINC001752833401	1440226412	/nfs/dbraw/zinc/22/64/12/1440226412.db2.gz	FSHVTGJODNQTDC-PMACEKPBSA-N	0	3	348.531	3.308	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)COCCCCCC	ZINC001752834558	1440226924	/nfs/dbraw/zinc/22/69/24/1440226924.db2.gz	UKTFKIHTNUXXPJ-OALUTQOASA-N	0	3	334.504	3.062	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)C(C)(C)c2ccccc2Cl)C1	ZINC001752840097	1440229917	/nfs/dbraw/zinc/22/99/17/1440229917.db2.gz	GONKCWCPKHOTRV-CVEARBPZSA-N	0	3	346.902	3.468	20	30		EGEDHN
C[C@H](CNC(=O)CC1CCCCC1)NCc1ccc(C#N)c(F)c1	ZINC001752858923	1440235294	/nfs/dbraw/zinc/23/52/94/1440235294.db2.gz	SEDUDNZHRHNVAN-CQSZACIVSA-N	0	3	331.435	3.262	20	30		EGEDHN
CC[C@@H](CC(C)C)C(=O)NC[C@H](C)NCc1ccc(F)c(C#N)c1	ZINC001752909959	1440245094	/nfs/dbraw/zinc/24/50/94/1440245094.db2.gz	ABZWMPRWHSDIJN-HOCLYGCPSA-N	0	3	333.451	3.364	20	30		EGEDHN
CC1=CC[C@](C)(C(=O)NC[C@H](C)NCc2ccc(C#N)c(F)c2)CC1	ZINC001752920783	1440248463	/nfs/dbraw/zinc/24/84/63/1440248463.db2.gz	GMVTWKDFJMWSSV-YWZLYKJASA-N	0	3	343.446	3.428	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H](C)NCc2ccc(F)c(C#N)c2)CCCC1	ZINC001752923972	1440249556	/nfs/dbraw/zinc/24/95/56/1440249556.db2.gz	KMIGHJZHCMDYRN-OAHLLOKOSA-N	0	3	343.446	3.428	20	30		EGEDHN
CC#CCN(C)[C@@H]1CCCN(C(=O)CCOc2ccc(C)c(C)c2)C1	ZINC001752991933	1440259761	/nfs/dbraw/zinc/25/97/61/1440259761.db2.gz	AYKQMMUEXZUSME-LJQANCHMSA-N	0	3	342.483	3.018	20	30		EGEDHN
CC#CCN(C)[C@H]1CCCN(C(=O)Cc2c(C)cccc2Cl)C1	ZINC001752993676	1440260939	/nfs/dbraw/zinc/26/09/39/1440260939.db2.gz	LQAQZRKVJYVKQA-INIZCTEOSA-N	0	3	332.875	3.137	20	30		EGEDHN
CC#CCN(C)[C@H]1CCCN(C(=O)c2ccsc2C(F)(F)F)C1	ZINC001752996529	1440262265	/nfs/dbraw/zinc/26/22/65/1440262265.db2.gz	FFSQCDULVYVPDZ-LBPRGKRZSA-N	0	3	344.402	3.327	20	30		EGEDHN
CC#CCN(C)[C@H]1CCCN(C(=O)c2ccccc2CC(C)C)C1	ZINC001753000965	1440264579	/nfs/dbraw/zinc/26/45/79/1440264579.db2.gz	WUEMHOCSKAIVKP-IBGZPJMESA-N	0	3	326.484	3.445	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1CCCNC(=O)c1occ2c1CCC2	ZINC001753032823	1440273424	/nfs/dbraw/zinc/27/34/24/1440273424.db2.gz	XZRLNVFGSWQYGO-HNNXBMFYSA-N	0	3	336.863	3.495	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1CCCNC(=O)c1ccc(Cl)[nH]1	ZINC001753034030	1440273995	/nfs/dbraw/zinc/27/39/95/1440273995.db2.gz	YTAQZWMJDMMEEK-LBPRGKRZSA-N	0	3	330.259	3.395	20	30		EGEDHN
CCN(CCNC(=O)[C@@H]1CCCC[C@@H]1C)Cc1ccc(C#N)cc1	ZINC001753087444	1440297067	/nfs/dbraw/zinc/29/70/67/1440297067.db2.gz	FXOLPSKYDXLYDN-QFBILLFUSA-N	0	3	327.472	3.323	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H](CNC(=O)CC3CCCCC3)C2)c1	ZINC001753120892	1440313618	/nfs/dbraw/zinc/31/36/18/1440313618.db2.gz	ZOIWOJARZYEOJC-FQEVSTJZSA-N	0	3	339.483	3.467	20	30		EGEDHN
Cc1cccc(CC(=O)NC[C@@H]2CCN(Cc3cccc(C#N)c3)C2)c1	ZINC001753133102	1440317459	/nfs/dbraw/zinc/31/74/59/1440317459.db2.gz	GTFLFUKRSKUABG-NRFANRHFSA-N	0	3	347.462	3.048	20	30		EGEDHN
Cc1ccncc1C(=O)NCCCN(CC#Cc1ccccc1)C(C)C	ZINC001753283892	1440348181	/nfs/dbraw/zinc/34/81/81/1440348181.db2.gz	CTEMBRQTXONJSG-UHFFFAOYSA-N	0	3	349.478	3.272	20	30		EGEDHN
C=C(C)CN[C@@H](CNC(=O)C1=COCCO1)c1ccc(C(C)C)cc1	ZINC001753294436	1440351575	/nfs/dbraw/zinc/35/15/75/1440351575.db2.gz	MWKYVIDMQMTFEE-SFHVURJKSA-N	0	3	344.455	3.021	20	30		EGEDHN
C=CCN[C@@H](CNC(=O)[C@@H]1CCc2cc(F)ccc21)c1ccccc1	ZINC001753300416	1440353724	/nfs/dbraw/zinc/35/37/24/1440353724.db2.gz	RZUAHVHAFWXERA-UXHICEINSA-N	0	3	338.426	3.489	20	30		EGEDHN
C#CCCN[C@@H](CNC(=O)C1(c2ccccc2)CC1)c1ccccc1	ZINC001753303240	1440354779	/nfs/dbraw/zinc/35/47/79/1440354779.db2.gz	UNSCFXXSOJVWGZ-FQEVSTJZSA-N	0	3	332.447	3.189	20	30		EGEDHN
C#CCCN[C@@H](CNC(=O)c1cccc(OC)c1C)c1ccccc1	ZINC001753309001	1440355974	/nfs/dbraw/zinc/35/59/74/1440355974.db2.gz	ALRULYLALOOFAP-IBGZPJMESA-N	0	3	336.435	3.088	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)N(CCC)[C@H]1CCN(Cc2cccc(C)c2)C1	ZINC001753316299	1440359838	/nfs/dbraw/zinc/35/98/38/1440359838.db2.gz	PEDQXZMOJATQFC-FPOVZHCZSA-N	0	3	344.499	3.135	20	30		EGEDHN
CN(CC#Cc1ccccc1)C[C@@H]1CCN(C(=O)CCC(C)(F)F)C1	ZINC001753350734	1440377952	/nfs/dbraw/zinc/37/79/52/1440377952.db2.gz	QBUSVJRQYNFAIV-SFHVURJKSA-N	0	3	348.437	3.254	20	30		EGEDHN
CN(Cc1cc(C#N)ccc1F)CC1CCN(C(=O)CCCF)CC1	ZINC001753364598	1440384370	/nfs/dbraw/zinc/38/43/70/1440384370.db2.gz	JSUJJOFCSYOSDH-UHFFFAOYSA-N	0	3	349.425	3.117	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(CN(C)Cc3cc(C)no3)CC2)CCC1	ZINC001753365657	1440385053	/nfs/dbraw/zinc/38/50/53/1440385053.db2.gz	HYNJAZWKGKYAFM-UHFFFAOYSA-N	0	3	345.487	3.400	20	30		EGEDHN
C=CC1(CC(=O)NCC2CN(C[C@H]3CC(C)(C)CO3)C2)CCCCC1	ZINC001753412214	1440393496	/nfs/dbraw/zinc/39/34/96/1440393496.db2.gz	JAHHQBGYVLBGSV-GOSISDBHSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1C[C@@H]2C[C@H]1CN2CCC1=CCCCC1	ZINC001753418453	1440394762	/nfs/dbraw/zinc/39/47/62/1440394762.db2.gz	DFKHFHWQGZARHP-NEWSRXKRSA-N	0	3	332.488	3.143	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C/C=C/c1ccc(F)cc1	ZINC001753422237	1440395542	/nfs/dbraw/zinc/39/55/42/1440395542.db2.gz	OQIBCYLUKUCYIT-YQHFQFMOSA-N	0	3	328.431	3.480	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H]2C[C@H]1CN2C(=O)Cc1noc2ccccc12	ZINC001753423777	1440396044	/nfs/dbraw/zinc/39/60/44/1440396044.db2.gz	YLKZVJMWCIUNJQ-JYJNAYRXSA-N	0	3	339.439	3.010	20	30		EGEDHN
CCCCCCCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc2c(c1)CCO2	ZINC001753425434	1440396523	/nfs/dbraw/zinc/39/65/23/1440396523.db2.gz	WAGSHUHBZIAIAZ-OALUTQOASA-N	0	3	342.483	3.491	20	30		EGEDHN
CCCCCCCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H]1COc2ccccc21	ZINC001753427578	1440397443	/nfs/dbraw/zinc/39/74/43/1440397443.db2.gz	MHHVFBYEFNLECX-LNLFQRSKSA-N	0	3	342.483	3.418	20	30		EGEDHN
CC[C@H](CNC(=O)CC1CCCC1)NCc1ccc(C#N)c(F)c1	ZINC001753464899	1440412366	/nfs/dbraw/zinc/41/23/66/1440412366.db2.gz	UPFREJUGYRLQPL-QGZVFWFLSA-N	0	3	331.435	3.262	20	30		EGEDHN
CC[C@H](CNC(=O)C(F)=C1CCCC1)NCc1ccc(C#N)c(F)c1	ZINC001753470103	1440413743	/nfs/dbraw/zinc/41/37/43/1440413743.db2.gz	MOZDTVOYTWMTGB-MRXNPFEDSA-N	0	3	347.409	3.479	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@](C)(CNCc1oc(C)nc1C)C1CC1	ZINC001753518414	1440428015	/nfs/dbraw/zinc/42/80/15/1440428015.db2.gz	HQIIPELQDKYJBG-IBGZPJMESA-N	0	3	333.476	3.268	20	30		EGEDHN
C=CCCC(=O)N[C@@]1(CNCc2cccc(OC)n2)CCCC[C@H]1C	ZINC001753531428	1440431126	/nfs/dbraw/zinc/43/11/26/1440431126.db2.gz	HWIPJNFATSXDOQ-OXQOHEQNSA-N	0	3	345.487	3.211	20	30		EGEDHN
N#Cc1ccccc1CNCC[C@H]1CCCN(C(=O)c2ccco2)C1	ZINC001753539045	1440433216	/nfs/dbraw/zinc/43/32/16/1440433216.db2.gz	NJWLSMVFUGAXLX-MRXNPFEDSA-N	0	3	337.423	3.183	20	30		EGEDHN
C#CCCCCC(=O)N1CCC[C@@H](CCNCc2ncc(C)s2)C1	ZINC001753543298	1440433886	/nfs/dbraw/zinc/43/38/86/1440433886.db2.gz	GMVSRGDRMSHCAN-KRWDZBQOSA-N	0	3	347.528	3.363	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1CC[C@H](N[C@H](C)c2cnc(C)cn2)CC1	ZINC001753584064	1440440948	/nfs/dbraw/zinc/44/09/48/1440440948.db2.gz	XOXVVYFEQPAKIZ-BZUAXINKSA-N	0	3	330.476	3.075	20	30		EGEDHN
CCC1(C(=O)NC[C@@H](C)CNCc2cc(F)ccc2C#N)CCC1	ZINC001753641138	1440454490	/nfs/dbraw/zinc/45/44/90/1440454490.db2.gz	VQWOMCDDPMBVTI-AWEZNQCLSA-N	0	3	331.435	3.120	20	30		EGEDHN
Cc1ccoc1C(=O)N(C)[C@@H](C)CNCC#Cc1ccc(Cl)cc1	ZINC001753680064	1440464380	/nfs/dbraw/zinc/46/43/80/1440464380.db2.gz	XEYOQMOFAFUMMI-HNNXBMFYSA-N	0	3	344.842	3.343	20	30		EGEDHN
Cc1csc(C(=O)N(C)[C@H](C)CNCc2ccc(C#N)s2)c1	ZINC001753688788	1440466057	/nfs/dbraw/zinc/46/60/57/1440466057.db2.gz	DMRZNYXNYIXQDG-GFCCVEGCSA-N	0	3	333.482	3.240	20	30		EGEDHN
C=C(Br)CNC[C@@H]1[C@@H](C)CCCN1C(=O)C=C(C)C	ZINC001753803238	1440491362	/nfs/dbraw/zinc/49/13/62/1440491362.db2.gz	KYHUDENRAWCFRW-GXTWGEPZSA-N	0	3	329.282	3.078	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H](C)[C@H]1CNCc1c(C)nsc1C	ZINC001753806005	1440491804	/nfs/dbraw/zinc/49/18/04/1440491804.db2.gz	UUQIHBBOECZCRZ-SUMWQHHRSA-N	0	3	335.517	3.443	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@H](C)[C@@H]1CNCc1cncs1	ZINC001753819167	1440495242	/nfs/dbraw/zinc/49/52/42/1440495242.db2.gz	PGUPGHVGOUDDDP-HOCLYGCPSA-N	0	3	335.517	3.462	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)/C=C/c1ccco1)NCC#Cc1ccccc1	ZINC001753822217	1440496769	/nfs/dbraw/zinc/49/67/69/1440496769.db2.gz	DTLUDCKPPSFXIA-DRUFCSCSSA-N	0	3	336.435	3.075	20	30		EGEDHN
CC/C=C(\C)C(=O)NC[C@H](NCc1cc(C#N)ccc1OC)C(C)C	ZINC001753824947	1440498016	/nfs/dbraw/zinc/49/80/16/1440498016.db2.gz	ACNCRPCNEFESIU-APSGNOSNSA-N	0	3	343.471	3.154	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)NC[C@H](NCc1ccc(C#N)cc1F)C(C)C	ZINC001753838167	1440501714	/nfs/dbraw/zinc/50/17/14/1440501714.db2.gz	OISQEAZJIWICCR-SUMDDJOVSA-N	0	3	345.462	3.364	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)[C@H]1CCOc2ccccc21)C(C)C	ZINC001753839874	1440502191	/nfs/dbraw/zinc/50/21/91/1440502191.db2.gz	RHLWFBOHQRDYOM-HOTGVXAUSA-N	0	3	336.863	3.036	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)Cn1cc(C)c2ccccc21)C(C)C	ZINC001753840135	1440502420	/nfs/dbraw/zinc/50/24/20/1440502420.db2.gz	WRUFLJBZZCYVEA-KRWDZBQOSA-N	0	3	347.890	3.433	20	30		EGEDHN
C=C[C@@H](CC(=O)N(C)CCN(C)C[C@H]1CCCCO1)c1ccccc1	ZINC001753869289	1440516498	/nfs/dbraw/zinc/51/64/98/1440516498.db2.gz	NWKBLUFMWSRCFA-AZUAARDMSA-N	0	3	344.499	3.306	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H]2[C@@H](CCN2Cc2cc(C)ns2)C1	ZINC001753873753	1440518472	/nfs/dbraw/zinc/51/84/72/1440518472.db2.gz	UUKLYYHYOHZIGI-WMZOPIPTSA-N	0	3	345.512	3.068	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CCC[C@H]2CNCc2ccn(CC)n2)CCC1	ZINC001753893694	1440522411	/nfs/dbraw/zinc/52/24/11/1440522411.db2.gz	LBALYNMKRUOBRI-FUHWJXTLSA-N	0	3	344.503	3.024	20	30		EGEDHN
C[C@H](CCNCc1cc(C#N)ccc1F)NC(=O)C1C(C)(C)C1(C)C	ZINC001753954152	1440525598	/nfs/dbraw/zinc/52/55/98/1440525598.db2.gz	FTDJCJIIIFVMLC-CYBMUJFWSA-N	0	3	345.462	3.364	20	30		EGEDHN
C=C(Br)CNCC[C@H](C)NC(=O)c1ccc(C)cc1F	ZINC001754001762	1440530358	/nfs/dbraw/zinc/53/03/58/1440530358.db2.gz	JXNMXMPONFLQEC-LBPRGKRZSA-N	0	3	343.240	3.141	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC/C=C/CNCc1cccc(Oc2ccccc2)c1	ZINC001754102487	1440541341	/nfs/dbraw/zinc/54/13/41/1440541341.db2.gz	BPHDYNHMQUKBTD-RTRPANQVSA-N	0	3	349.434	3.401	20	30		EGEDHN
Cc1sccc1C(=O)N[C@H](C)CNCC#Cc1cccc(Cl)c1	ZINC001754226220	1440553350	/nfs/dbraw/zinc/55/33/50/1440553350.db2.gz	DPGHFHQENXVLFX-CYBMUJFWSA-N	0	3	346.883	3.470	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccc(Cl)cc1)NC(=O)C[C@H]1C=CCC1	ZINC001754258430	1440559615	/nfs/dbraw/zinc/55/96/15/1440559615.db2.gz	BACUBTUFYMCAAP-RDJZCZTQSA-N	0	3	330.859	3.142	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H](C)CN[C@@H](C)C(=O)Nc1ccc(C)c(C)c1	ZINC001754268332	1440560958	/nfs/dbraw/zinc/56/09/58/1440560958.db2.gz	CYIKTESBHHJYCK-IRXDYDNUSA-N	0	3	345.487	3.081	20	30		EGEDHN
CC(C)CC(C)(C)C(=O)N[C@@H](C)CNCC#Cc1ccc(F)cc1	ZINC001754290043	1440564824	/nfs/dbraw/zinc/56/48/24/1440564824.db2.gz	FGWVJJCFIFKSBV-INIZCTEOSA-N	0	3	332.463	3.344	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)C12CCC(CC1)C2	ZINC001754315989	1440575473	/nfs/dbraw/zinc/57/54/73/1440575473.db2.gz	LRIGEARJDUFNRL-SHPPYHEDSA-N	0	3	325.456	3.075	20	30		EGEDHN
CN(CCCNCc1cc(F)ccc1Cl)C(=O)C#CC(C)(C)C	ZINC001754370046	1440592436	/nfs/dbraw/zinc/59/24/36/1440592436.db2.gz	NQZYCUFWIAJOMV-UHFFFAOYSA-N	0	3	338.854	3.467	20	30		EGEDHN
CN(CCCNCc1cc(C#N)ccc1F)C(=O)[C@@H]1CC12CCCC2	ZINC001754407127	1440595819	/nfs/dbraw/zinc/59/58/19/1440595819.db2.gz	MLRUCQDDOYBWAH-KRWDZBQOSA-N	0	3	343.446	3.216	20	30		EGEDHN
O=C(CCC1CCC1)N[C@H](CNCC#Cc1ccc(F)cc1)C1CC1	ZINC001754438454	1440598573	/nfs/dbraw/zinc/59/85/73/1440598573.db2.gz	YOWFHMQJFJWSRT-HXUWFJFHSA-N	0	3	342.458	3.242	20	30		EGEDHN
CC1(C)CC[C@H]1C(=O)N[C@@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001754448718	1440600520	/nfs/dbraw/zinc/60/05/20/1440600520.db2.gz	DPWAADWOIPBTHY-HOTGVXAUSA-N	0	3	331.485	3.040	20	30		EGEDHN
C=CCCCN1CC[C@H]1CNC(=O)CCc1cc(Cl)cs1	ZINC001754496333	1440612250	/nfs/dbraw/zinc/61/22/50/1440612250.db2.gz	UOZPUSUDYYIWIT-AWEZNQCLSA-N	0	3	326.893	3.491	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC1(NCc2ccc3c(c2)COC3)CC1	ZINC001754523748	1440620389	/nfs/dbraw/zinc/62/03/89/1440620389.db2.gz	HBNRUCWWBLLTNX-IBGZPJMESA-N	0	3	328.456	3.058	20	30		EGEDHN
CCC[C@H](CC)C(=O)NCC1(NCc2ccc(F)c(C#N)c2)CC1	ZINC001754530306	1440622153	/nfs/dbraw/zinc/62/21/53/1440622153.db2.gz	PIQSENUPBZQETD-HNNXBMFYSA-N	0	3	331.435	3.262	20	30		EGEDHN
C=C(Cl)CN(CC1CC1)C1CCN(C(=O)c2ccccn2)CC1	ZINC001754547758	1440628378	/nfs/dbraw/zinc/62/83/78/1440628378.db2.gz	PQANLXBAUBBGPL-UHFFFAOYSA-N	0	3	333.863	3.151	20	30		EGEDHN
C=CCOCCCC(=O)N1CCC2(C1)CCN(C/C=C/Cl)CC2	ZINC001754559617	1440633341	/nfs/dbraw/zinc/63/33/41/1440633341.db2.gz	QGLAKPOKCDTIPR-RUDMXATFSA-N	0	3	340.895	3.036	20	30		EGEDHN
O=C(CCCC1CC1)N1CCC[C@H]1CNCC#Cc1ccc(F)cc1	ZINC001754615099	1440644385	/nfs/dbraw/zinc/64/43/85/1440644385.db2.gz	BBDAAZNLZIIXQK-FQEVSTJZSA-N	0	3	342.458	3.338	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC1(C)CCN([C@H]2CCc3ccc(Cl)cc32)CC1	ZINC001754623446	1440645776	/nfs/dbraw/zinc/64/57/76/1440645776.db2.gz	DTCXTKHJNQBNBI-GUYCJALGSA-N	0	3	345.874	3.458	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)COc2c(C)cc(C)cc2C)CC1	ZINC001754631169	1440647900	/nfs/dbraw/zinc/64/79/00/1440647900.db2.gz	KVUCUYPOMUMXFA-UHFFFAOYSA-N	0	3	330.472	3.147	20	30		EGEDHN
C#CCN(C(=O)[C@H](C)c1c(F)cccc1F)C1CCN(CC=C)CC1	ZINC001754638071	1440648771	/nfs/dbraw/zinc/64/87/71/1440648771.db2.gz	JZLGXSMWLPTLTM-OAHLLOKOSA-N	0	3	346.421	3.181	20	30		EGEDHN
C#CCN(C(=O)[C@H]1C[C@@]1(C)C(C)C)C1CCN(CCOC(C)C)CC1	ZINC001754641480	1440649181	/nfs/dbraw/zinc/64/91/81/1440649181.db2.gz	CRUANZUVDCUDQU-CTNGQTDRSA-N	0	3	348.531	3.020	20	30		EGEDHN
C#CCNC[C@H](NC(=O)[C@H]1CC12CCC2)c1ccc2ccccc2c1	ZINC001754644844	1440649833	/nfs/dbraw/zinc/64/98/33/1440649833.db2.gz	YFLNKXQUICHLHK-UXHICEINSA-N	0	3	332.447	3.410	20	30		EGEDHN
C=CCOCCN1CC[C@](C)(NC(=O)c2cc(C(C)(C)C)oc2C)C1	ZINC001754680777	1440662294	/nfs/dbraw/zinc/66/22/94/1440662294.db2.gz	ULHGRHYLXQXJOX-FQEVSTJZSA-N	0	3	348.487	3.282	20	30		EGEDHN
CC#CCN1CCC[C@](C)(CNC(=O)c2cncc3sccc32)C1	ZINC001754730444	1440678957	/nfs/dbraw/zinc/67/89/57/1440678957.db2.gz	VYKHGQDQULAWED-LJQANCHMSA-N	0	3	341.480	3.152	20	30		EGEDHN
C=CCN1CCC[C@](C)(CNC(=O)C2(CCOCC)CCCC2)C1	ZINC001754731216	1440679482	/nfs/dbraw/zinc/67/94/82/1440679482.db2.gz	DGYFXGYZWCLGSA-LJQANCHMSA-N	0	3	336.520	3.378	20	30		EGEDHN
C=CCCOCC(=O)NC[C@]1(C)CCCN(Cc2ccsc2)C1	ZINC001754733338	1440681039	/nfs/dbraw/zinc/68/10/39/1440681039.db2.gz	BVPYYWZCPOVHJR-SFHVURJKSA-N	0	3	336.501	3.059	20	30		EGEDHN
C=CCN1CCC[C@](C)(CNC(=O)[C@@]2(C)CCc3ccccc32)C1	ZINC001754733685	1440681385	/nfs/dbraw/zinc/68/13/85/1440681385.db2.gz	FIZHWBXYMWAXKW-RTWAWAEBSA-N	0	3	326.484	3.295	20	30		EGEDHN
C=CCN1CCC[C@@](C)(CNC(=O)[C@H]2Cc3c2cccc3Cl)C1	ZINC001754735255	1440681895	/nfs/dbraw/zinc/68/18/95/1440681895.db2.gz	XJNRMJLDLOUOGU-LPHOPBHVSA-N	0	3	332.875	3.384	20	30		EGEDHN
C=CCN1CCC[C@](C)(CNC(=O)c2nc(Cl)sc2Cl)C1	ZINC001754735409	1440681961	/nfs/dbraw/zinc/68/19/61/1440681961.db2.gz	BKUJRPDBDKVVOW-CQSZACIVSA-N	0	3	348.299	3.468	20	30		EGEDHN
CC(F)(F)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1ccccc1)C2	ZINC001754782855	1440686708	/nfs/dbraw/zinc/68/67/08/1440686708.db2.gz	HZAKFEOVJDKFII-KSZLIROESA-N	0	3	346.421	3.053	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H](C)[C@@H](CNC/C(Cl)=C/Cl)C2)C1	ZINC001754822664	1440693188	/nfs/dbraw/zinc/69/31/88/1440693188.db2.gz	NRQOWVWWZWBALU-QNVQFBBUSA-N	0	3	331.287	3.346	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@H](C)[C@@H](CNCc3cnc(C)o3)C2)CCCC1	ZINC001754828770	1440694041	/nfs/dbraw/zinc/69/40/41/1440694041.db2.gz	QLMZBFVKHMFBNM-RDJZCZTQSA-N	0	3	345.487	3.304	20	30		EGEDHN
C#CCNCCN(Cc1ccccc1)C(=O)[C@H]1CCCC[C@H]1CC	ZINC001754836911	1440697097	/nfs/dbraw/zinc/69/70/97/1440697097.db2.gz	ACYCXARXJMKKAU-UXHICEINSA-N	0	3	326.484	3.454	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@]1(CO)CCCN([C@@H](C)c2ccccc2)C1	ZINC001754856611	1440700532	/nfs/dbraw/zinc/70/05/32/1440700532.db2.gz	NWYGZCANBXVJPI-LAUBAEHRSA-N	0	3	344.499	3.293	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H]2[C@H]1CCN2Cc1ccc(C)nc1C	ZINC001754863972	1440701972	/nfs/dbraw/zinc/70/19/72/1440701972.db2.gz	RTIKIIMXTBLHHH-RBUKOAKNSA-N	0	3	327.472	3.230	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)CCCc1sccc1C	ZINC001754872435	1440705522	/nfs/dbraw/zinc/70/55/22/1440705522.db2.gz	YSDQNFWHKAXNEC-ZWKOTPCHSA-N	0	3	344.524	3.468	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](CCNCc2cc(F)ccc2F)C1	ZINC001754928237	1440710175	/nfs/dbraw/zinc/71/01/75/1440710175.db2.gz	MSWHTEMUBSEDBU-MRXNPFEDSA-N	0	3	348.437	3.487	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](CCNCc3cnc(C)o3)C2)CC1	ZINC001754931113	1440710559	/nfs/dbraw/zinc/71/05/59/1440710559.db2.gz	UUWBTVTYPPNINH-MRXNPFEDSA-N	0	3	331.460	3.058	20	30		EGEDHN
C=C(C)CN(C)Cc1ccccc1CNC(=O)c1ccn(C)c1C	ZINC001754946562	1440713361	/nfs/dbraw/zinc/71/33/61/1440713361.db2.gz	MYOFVGWBLHZNCQ-UHFFFAOYSA-N	0	3	325.456	3.271	20	30		EGEDHN
C#CCN[C@@H](C)c1ccc(CNC(=O)[C@H]2CCCc3cccnc32)cc1	ZINC001754948822	1440714284	/nfs/dbraw/zinc/71/42/84/1440714284.db2.gz	PYDVUMORBPHINP-JXFKEZNVSA-N	0	3	347.462	3.102	20	30		EGEDHN
CC#CCN[C@H](C)c1ccc(CNC(=O)Cc2cccc(F)c2)cc1	ZINC001754951538	1440715055	/nfs/dbraw/zinc/71/50/55/1440715055.db2.gz	XGFIKVAEOOQGDY-MRXNPFEDSA-N	0	3	338.426	3.359	20	30		EGEDHN
CC(C)=CC(=O)N1C[C@H](C)[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001755102986	1440753602	/nfs/dbraw/zinc/75/36/02/1440753602.db2.gz	FESFQVRJEOIIIT-MAUKXSAKSA-N	0	3	330.859	3.094	20	30		EGEDHN
Cc1csc(C(=O)N2C[C@H](NCC#Cc3ccccc3)[C@@H](C)C2)c1	ZINC001755108390	1440753967	/nfs/dbraw/zinc/75/39/67/1440753967.db2.gz	DYDDPOWLGKVESS-WMZOPIPTSA-N	0	3	338.476	3.158	20	30		EGEDHN
CCc1ccc(C(=O)N2C[C@H](C)[C@H](NCC#Cc3ccccc3)C2)cc1	ZINC001755123933	1440756080	/nfs/dbraw/zinc/75/60/80/1440756080.db2.gz	WDGMIKXAILHHQB-PGRDOPGGSA-N	0	3	346.474	3.351	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)CC2(c3ccccc3)CC2)C(C)(C)C1	ZINC001755139085	1440759538	/nfs/dbraw/zinc/75/95/38/1440759538.db2.gz	SXPRZFSXGOYWBE-IBGZPJMESA-N	0	3	338.495	3.348	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)[C@H](CC)c2c(C)noc2C)C(C)(C)C1	ZINC001755142296	1440761333	/nfs/dbraw/zinc/76/13/33/1440761333.db2.gz	PYYYBBFJIRAWPK-IAGOWNOFSA-N	0	3	345.487	3.025	20	30		EGEDHN
CC(C)CCCN1CCc2ccccc2[C@H]1CNC(=O)[C@H](C)C#N	ZINC001755172173	1440769685	/nfs/dbraw/zinc/76/96/85/1440769685.db2.gz	LIIXKTBPLQZUBF-VQIMIIECSA-N	0	3	327.472	3.298	20	30		EGEDHN
C=C(C)CN1CCN(CCCCCNC(=O)C2C(C)(C)C2(C)C)CC1	ZINC001755172989	1440770016	/nfs/dbraw/zinc/77/00/16/1440770016.db2.gz	CSCTXFJLEBXBGN-UHFFFAOYSA-N	0	3	349.563	3.149	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)COC1CCCCC1	ZINC001755186666	1440773265	/nfs/dbraw/zinc/77/32/65/1440773265.db2.gz	YFGOQMLSWQSXKP-TZIWHRDSSA-N	0	3	342.483	3.284	20	30		EGEDHN
C=CCN(C)C[C@@H]1CCCN1C(=O)Cc1coc2ccc(C)cc12	ZINC001755195038	1440776483	/nfs/dbraw/zinc/77/64/83/1440776483.db2.gz	HYFXZFRHQWIEQR-KRWDZBQOSA-N	0	3	326.440	3.393	20	30		EGEDHN
C=CCN(C)C[C@@H]1CCCN1C(=O)[C@@H](C)CCOc1ccccc1	ZINC001755203581	1440781329	/nfs/dbraw/zinc/78/13/29/1440781329.db2.gz	YXZIVPHQEZNHCE-ROUUACIJSA-N	0	3	330.472	3.200	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H](C)[C@H](C)NCC#Cc2ccccc2)ccc1F	ZINC001755250199	1440791624	/nfs/dbraw/zinc/79/16/24/1440791624.db2.gz	QMOHBHUXNLEPKJ-IRXDYDNUSA-N	0	3	338.426	3.282	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)[C@@H](C)NCc2ccc(C#N)s2)CCC1	ZINC001755253077	1440792461	/nfs/dbraw/zinc/79/24/61/1440792461.db2.gz	OTGNLHZQFKNDOQ-KGLIPLIRSA-N	0	3	331.485	3.349	20	30		EGEDHN
C[C@@H](NC(=O)C(C1CC1)C1CC1)[C@H](C)NCc1ccc(C#N)c(F)c1	ZINC001755262556	1440794941	/nfs/dbraw/zinc/79/49/41/1440794941.db2.gz	LFVYDHKVCBXEHX-QWHCGFSZSA-N	0	3	343.446	3.116	20	30		EGEDHN
C=CCC1(C(=O)NC[C@H](C)N(C)Cc2cccc(C#N)c2)CCC1	ZINC001755315777	1440815579	/nfs/dbraw/zinc/81/55/79/1440815579.db2.gz	WPABZKRSFILLTC-INIZCTEOSA-N	0	3	325.456	3.241	20	30		EGEDHN
C[C@H](CNC(=O)[C@@H]1CC12CCCC2)N(C)Cc1cccc(C#N)c1	ZINC001755324402	1440820807	/nfs/dbraw/zinc/82/08/07/1440820807.db2.gz	MRXZNKXDKYVZMM-QAPCUYQASA-N	0	3	325.456	3.075	20	30		EGEDHN
C=C[C@H](C(=O)NC[C@H](C)N(C)Cc1cccc(C#N)c1)c1ccccc1	ZINC001755328484	1440823154	/nfs/dbraw/zinc/82/31/54/1440823154.db2.gz	QBJWMRUEPLANQE-UWJYYQICSA-N	0	3	347.462	3.465	20	30		EGEDHN
C#CCCCC(=O)NC[C@@H]1CCCCCN1Cc1cnccc1C	ZINC001755363834	1440833231	/nfs/dbraw/zinc/83/32/31/1440833231.db2.gz	NNKZPTIJGDEGFU-IBGZPJMESA-N	0	3	327.472	3.054	20	30		EGEDHN
C/C=C(/C)C(=O)NC[C@H]1CCCCCN1Cc1ccc(C#N)cc1	ZINC001755364929	1440833797	/nfs/dbraw/zinc/83/37/97/1440833797.db2.gz	MOSCDXYWJLCMJP-QVEXUMCLSA-N	0	3	325.456	3.385	20	30		EGEDHN
C#CCCN1CC([C@@H](C)NC(=O)CCCCc2ccc(C)cc2)C1	ZINC001755392901	1440842416	/nfs/dbraw/zinc/84/24/16/1440842416.db2.gz	ZBPPQRAFXJKOQL-GOSISDBHSA-N	0	3	326.484	3.168	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COc2ccc(CC)cc2)C(C)(C)C1	ZINC001755416894	1440849447	/nfs/dbraw/zinc/84/94/47/1440849447.db2.gz	VYTYBDXMMIAGCZ-GOSISDBHSA-N	0	3	330.472	3.031	20	30		EGEDHN
C=CCOCCN1CCCC2(CN(C(=O)c3cc(C)c(C)s3)C2)C1	ZINC001755458263	1440856591	/nfs/dbraw/zinc/85/65/91/1440856591.db2.gz	CAAUGEDCSSEBNV-UHFFFAOYSA-N	0	3	348.512	3.106	20	30		EGEDHN
C#CCN1C[C@]2(C)CN(C(=O)CC(C)(C)CC(F)(F)F)C[C@]2(C)C1	ZINC001755460046	1440856980	/nfs/dbraw/zinc/85/69/80/1440856980.db2.gz	ACONBRKQOCTXAA-CALCHBBNSA-N	0	3	344.421	3.159	20	30		EGEDHN
C[C@H](CCCNCc1ccccc1C#N)NC(=O)Cc1ccsc1	ZINC001755486858	1440860789	/nfs/dbraw/zinc/86/07/89/1440860789.db2.gz	ULQWSECTDHAKOI-OAHLLOKOSA-N	0	3	341.480	3.237	20	30		EGEDHN
C=C(Cl)CNCCC[C@@H](C)NC(=O)c1c[nH]c(Br)c1	ZINC001755507944	1440863201	/nfs/dbraw/zinc/86/32/01/1440863201.db2.gz	LCXVFDUSZAKEEJ-SNVBAGLBSA-N	0	3	348.672	3.018	20	30		EGEDHN
CN(C(=O)CC1CCC1)[C@@H](CNCC#Cc1ccc(F)cc1)C1CC1	ZINC001755555567	1440873172	/nfs/dbraw/zinc/87/31/72/1440873172.db2.gz	MAOQZQYJHUFUQC-FQEVSTJZSA-N	0	3	342.458	3.194	20	30		EGEDHN
C=C(Br)CNC[C@@H](C1CC1)N(C)C(=O)C(C)=C1CCC1	ZINC001755570821	1440876969	/nfs/dbraw/zinc/87/69/69/1440876969.db2.gz	JPWFSUHEKLCRQD-HNNXBMFYSA-N	0	3	341.293	3.222	20	30		EGEDHN
COCC#CCN[C@@H](C)CN(C)C(=O)c1ccc(C2CCCC2)cc1	ZINC001755594817	1440882431	/nfs/dbraw/zinc/88/24/31/1440882431.db2.gz	GPNZMPMGLUKNTH-KRWDZBQOSA-N	0	3	342.483	3.044	20	30		EGEDHN
C[C@H]1[C@H](NCC#Cc2cccc(Cl)c2)CCN1C(=O)CC1CC1	ZINC001755649258	1440891157	/nfs/dbraw/zinc/89/11/57/1440891157.db2.gz	QRCGYJOJQZWSBG-KBXCAEBGSA-N	0	3	330.859	3.071	20	30		EGEDHN
CC#CCN[C@@H]1C[C@H](C)N(C(=O)c2cc3c(o2)c(F)ccc3C)C1	ZINC001755685509	1440895799	/nfs/dbraw/zinc/89/57/99/1440895799.db2.gz	YMEIHILYSMVNHB-UONOGXRCSA-N	0	3	328.387	3.096	20	30		EGEDHN
C#CCCCCC(=O)N[C@@]12CCC[C@@H]1N(Cc1cnccc1C)CC2	ZINC001755697905	1440898506	/nfs/dbraw/zinc/89/85/06/1440898506.db2.gz	CUSZTKZVVVJPIX-PZJWPPBQSA-N	0	3	339.483	3.197	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1C[C@@H](NCc2ccc(C#N)s2)C(C)(C)C1	ZINC001755754155	1440913609	/nfs/dbraw/zinc/91/36/09/1440913609.db2.gz	SAUVHLBLPMOTNL-CZUORRHYSA-N	0	3	333.501	3.383	20	30		EGEDHN
C#CCCN(C)CCN(C(=O)c1nsc2ccccc21)C(C)C	ZINC001755812551	1440921268	/nfs/dbraw/zinc/92/12/68/1440921268.db2.gz	AGIZFSPRAPLXPO-UHFFFAOYSA-N	0	3	329.469	3.102	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N(C)C1CC(NCc2cccc(Cl)n2)C1	ZINC001755861508	1440936905	/nfs/dbraw/zinc/93/69/05/1440936905.db2.gz	XZEDWUQUAGNDRU-JMLCCBQJSA-N	0	3	335.879	3.416	20	30		EGEDHN
N#Cc1ccc(N2CCN(c3ccncc3)CC2)c(Br)c1	ZINC000134558483	283161389	/nfs/dbraw/zinc/16/13/89/283161389.db2.gz	FNLUTBCTBJXKMI-UHFFFAOYSA-N	0	3	343.228	3.042	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(Cc2ccccc2F)C2CC2)CC1	ZINC000264346253	201210590	/nfs/dbraw/zinc/21/05/90/201210590.db2.gz	KDDRGPGJBNEXHI-UHFFFAOYSA-N	0	3	331.435	3.150	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](C)c2c(F)cccc2F)CC1	ZINC000264375750	201211080	/nfs/dbraw/zinc/21/10/80/201211080.db2.gz	KECDKXHNLAFWMW-ZDUSSCGKSA-N	0	3	337.414	3.366	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCCc2c[nH]c3ccccc23)CC1	ZINC000264382517	201211134	/nfs/dbraw/zinc/21/11/34/201211134.db2.gz	LTAZJCBFNXVUFL-UHFFFAOYSA-N	0	3	340.471	3.050	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](C)CCc2ccccc2)CC1	ZINC000264351994	201211279	/nfs/dbraw/zinc/21/12/79/201211279.db2.gz	DDLOOUUOQZNSAQ-KRWDZBQOSA-N	0	3	329.488	3.347	20	30		EGEDHN
C=CCN1CCC(NC(=O)C2(c3ccccc3F)CCCC2)CC1	ZINC000264503281	201212261	/nfs/dbraw/zinc/21/22/61/201212261.db2.gz	QWVYLYTZJVOBIF-UHFFFAOYSA-N	0	3	330.447	3.404	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000264733401	201212895	/nfs/dbraw/zinc/21/28/95/201212895.db2.gz	HGEKDXZHGDULOC-RBUKOAKNSA-N	0	3	327.472	3.272	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N[C@@H]1[C@@H]2CCO[C@H]2C1(C)C	ZINC000265970596	201217502	/nfs/dbraw/zinc/21/75/02/201217502.db2.gz	KRJVWRCGWRTBON-QMCVQRASSA-N	0	3	348.512	3.054	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CC[C@H](c3ccc(F)cc3)C2)CC1	ZINC000267938332	201224275	/nfs/dbraw/zinc/22/42/75/201224275.db2.gz	HXRKUAWWVHVJMP-KRWDZBQOSA-N	0	3	345.462	3.365	20	30		EGEDHN
C#CC[C@H](NC[C@@H](O)COCc1ccccc1F)c1ccccc1	ZINC000271762446	201245780	/nfs/dbraw/zinc/24/57/80/201245780.db2.gz	ZWLRWIAAPPLERI-QUCCMNQESA-N	0	3	327.399	3.057	20	30		EGEDHN
Cc1nc([C@H]2CCCN(CC#Cc3ccc(C(F)(F)F)cc3)C2)n[nH]1	ZINC000268502138	201227013	/nfs/dbraw/zinc/22/70/13/201227013.db2.gz	SNXRFMIUSTZATJ-HNNXBMFYSA-N	0	3	348.372	3.363	20	30		EGEDHN
Cc1n[nH]c([C@H]2CCCN(CC#Cc3ccc(C(F)(F)F)cc3)C2)n1	ZINC000268502138	201227017	/nfs/dbraw/zinc/22/70/17/201227017.db2.gz	SNXRFMIUSTZATJ-HNNXBMFYSA-N	0	3	348.372	3.363	20	30		EGEDHN
Cc1nnc([C@H]2CCCN(CC#Cc3ccc(C(F)(F)F)cc3)C2)[nH]1	ZINC000268502138	201227020	/nfs/dbraw/zinc/22/70/20/201227020.db2.gz	SNXRFMIUSTZATJ-HNNXBMFYSA-N	0	3	348.372	3.363	20	30		EGEDHN
FC(F)(F)Oc1ccc(C#CCN2CCN(C3CCC3)CC2)cc1	ZINC000269536713	201231969	/nfs/dbraw/zinc/23/19/69/201231969.db2.gz	UQLQEAORESYOAE-UHFFFAOYSA-N	0	3	338.373	3.107	20	30		EGEDHN
C=CCC[C@H](NC(=O)N1CC[C@@H]2CCN(C)C[C@H]21)c1ccccc1	ZINC000272633272	201252627	/nfs/dbraw/zinc/25/26/27/201252627.db2.gz	XFXZUHMQEQWMLG-GBESFXJTSA-N	0	3	327.472	3.430	20	30		EGEDHN
C=C(C)[C@@H](NC(=O)N1CCCN(CC)CC1)c1ccc(F)c(F)c1	ZINC000275145098	201276593	/nfs/dbraw/zinc/27/65/93/201276593.db2.gz	QUCMNCUXAPXMPJ-QGZVFWFLSA-N	0	3	337.414	3.319	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000275682288	201284162	/nfs/dbraw/zinc/28/41/62/201284162.db2.gz	ZIUBVVXWNBVDOB-SLYNCCJLSA-N	0	3	344.499	3.242	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H](CN(C)Cc2scnc2C)C1	ZINC000275941863	201287329	/nfs/dbraw/zinc/28/73/29/201287329.db2.gz	DZEZWUWQSBXVMW-CRAIPNDOSA-N	0	3	335.517	3.334	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1C(=O)N(CC)Cc1ccc(CN(C)C)cc1	ZINC000278541731	201305021	/nfs/dbraw/zinc/30/50/21/201305021.db2.gz	CPLOGJSQNCYBLG-RTBURBONSA-N	0	3	330.472	3.078	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H](NCc2ccc(C#N)o2)C(C)(C)C1	ZINC000283129289	201329984	/nfs/dbraw/zinc/32/99/84/201329984.db2.gz	ZOYYNJQSOKAOKS-OAHLLOKOSA-N	0	3	333.432	3.276	20	30		EGEDHN
Cn1cc(CN[C@H]2CCN(c3ccccc3C(F)(F)F)C2)cc1C#N	ZINC000191616876	239212667	/nfs/dbraw/zinc/21/26/67/239212667.db2.gz	MRGMXJWPPULBQH-AWEZNQCLSA-N	0	3	348.372	3.284	20	30		EGEDHN
N#Cc1cccc(C(=O)NC[C@H]2CCCN(Cc3cccs3)C2)c1	ZINC000069777853	203048333	/nfs/dbraw/zinc/04/83/33/203048333.db2.gz	QMRWMHUNSXKXCJ-MRXNPFEDSA-N	0	3	339.464	3.262	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cc(F)ccc2N2CCCCC2)CC1	ZINC000069443264	203081603	/nfs/dbraw/zinc/08/16/03/203081603.db2.gz	WIPSHTDNQPNZKX-UHFFFAOYSA-N	0	3	343.446	3.100	20	30		EGEDHN
C[C@@H](NC[C@@H](c1cccs1)N1CCOCC1)c1ccc(C#N)cc1	ZINC000072287936	203192698	/nfs/dbraw/zinc/19/26/98/203192698.db2.gz	QMGLUPVGKNJVMS-QAPCUYQASA-N	0	3	341.480	3.344	20	30		EGEDHN
Cc1ccc(CN2CCCC2)cc1NC(=O)COc1ccccc1C#N	ZINC000128539737	205150953	/nfs/dbraw/zinc/15/09/53/205150953.db2.gz	RTDKLSMIOVYREJ-UHFFFAOYSA-N	0	3	349.434	3.480	20	30		EGEDHN
COc1cccc(N2C[C@@H](N[C@H](C)c3cccc(C#N)c3)CC2=O)c1	ZINC000378452267	169123397	/nfs/dbraw/zinc/12/33/97/169123397.db2.gz	LEELLPYXWATOBO-PBHICJAKSA-N	0	3	335.407	3.023	20	30		EGEDHN
COc1ccc(CNC[C@@H](C)Oc2ccccc2OC)cc1C#N	ZINC000174607223	207037287	/nfs/dbraw/zinc/03/72/87/207037287.db2.gz	YXJYMZKIRSCZEO-CQSZACIVSA-N	0	3	326.396	3.133	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1CCC(c2ccncc2)CC1	ZINC000191639041	533503441	/nfs/dbraw/zinc/50/34/41/533503441.db2.gz	SKHUBQWIVZNMQM-UHFFFAOYSA-N	0	3	337.423	3.220	20	30		EGEDHN
CN(CCCNC(=O)Nc1ccc(F)cc1C#N)Cc1ccccc1	ZINC000344484337	141163623	/nfs/dbraw/zinc/16/36/23/141163623.db2.gz	XEWVXKMNWFYRQM-UHFFFAOYSA-N	0	3	340.402	3.341	20	30		EGEDHN
C[C@H](NCCNC(=O)c1c(F)cccc1F)c1ccc(C#N)c(F)c1	ZINC000346226124	141184744	/nfs/dbraw/zinc/18/47/44/141184744.db2.gz	XRSRNKFAOAZZRR-NSHDSACASA-N	0	3	347.340	3.056	20	30		EGEDHN
C[C@@H](C(=O)NCCSCc1ccccc1C#N)N1CCCCCC1	ZINC000357940669	141362857	/nfs/dbraw/zinc/36/28/57/141362857.db2.gz	VDRZNVSHOSRNPO-INIZCTEOSA-N	0	3	345.512	3.172	20	30		EGEDHN
Cc1ccc(CNC(=O)C2CCN(Cc3ccc(C#N)cc3)CC2)cc1	ZINC000175318033	144061957	/nfs/dbraw/zinc/06/19/57/144061957.db2.gz	OSOLWKGSIJVDEZ-UHFFFAOYSA-N	0	3	347.462	3.395	20	30		EGEDHN
CC(C)OC(=O)C[C@H]1CCCN(CCCOc2cccc(C#N)c2)C1	ZINC000184488079	144093206	/nfs/dbraw/zinc/09/32/06/144093206.db2.gz	LGTKACPBVNAMSE-GOSISDBHSA-N	0	3	344.455	3.381	20	30		EGEDHN
N#Cc1csc(CNCCc2ccc(OCC(F)(F)F)nc2)c1	ZINC000187570586	144160856	/nfs/dbraw/zinc/16/08/56/144160856.db2.gz	QMEQNIWNZVWMKB-UHFFFAOYSA-N	0	3	341.358	3.288	20	30		EGEDHN
CSc1ccc([C@H](CNC(=O)c2ccc(C#N)s2)N(C)C)cc1	ZINC000341491610	155322539	/nfs/dbraw/zinc/32/25/39/155322539.db2.gz	ZLHBMELINHNXFL-HNNXBMFYSA-N	0	3	345.493	3.374	20	30		EGEDHN
CCCCNC(=O)[C@@H]1CC[C@@H](C)N(Cc2ccc(C#N)c(F)c2)C1	ZINC000191964373	153235576	/nfs/dbraw/zinc/23/55/76/153235576.db2.gz	UGXXDWGTUONKLS-RHSMWYFYSA-N	0	3	331.435	3.214	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN[C@@H](CCCO)c1ccccc1	ZINC000305772135	154117395	/nfs/dbraw/zinc/11/73/95/154117395.db2.gz	KTQLEYABQNAOCA-INIZCTEOSA-N	0	3	343.452	3.052	20	30		EGEDHN
Cc1ccc(C#N)c(NCc2ccc(OCCN3CCCC3)cc2)n1	ZINC000346819948	156150652	/nfs/dbraw/zinc/15/06/52/156150652.db2.gz	TWBUQSUXWWXRJJ-UHFFFAOYSA-N	0	3	336.439	3.348	20	30		EGEDHN
Cc1ncc(CN[C@H]2CCCN(c3ccc(C#N)cc3F)C2)s1	ZINC000109351983	162097631	/nfs/dbraw/zinc/09/76/31/162097631.db2.gz	GVLXDGIZKAJZOV-AWEZNQCLSA-N	0	3	330.432	3.221	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN2CC[C@H](c3c(F)cccc3F)C2)cc1	ZINC000249051275	163053199	/nfs/dbraw/zinc/05/31/99/163053199.db2.gz	WVTDBZUQYQAUTR-MAUKXSAKSA-N	0	3	328.362	3.359	20	30		EGEDHN
CN(C)CCOc1ccccc1CNc1ccc([N+](=O)[O-])cc1C#N	ZINC000338285231	163206876	/nfs/dbraw/zinc/20/68/76/163206876.db2.gz	YTBCMWJEWJNEDB-UHFFFAOYSA-N	0	3	340.383	3.019	20	30		EGEDHN
N#Cc1cc(C(=O)N[C@H](CN2CCCC2)c2ccccc2)ccc1F	ZINC000340927905	163696686	/nfs/dbraw/zinc/69/66/86/163696686.db2.gz	QKUPREQXNUHXSQ-LJQANCHMSA-N	0	3	337.398	3.264	20	30		EGEDHN
CCN1CCC(N(C)C(=O)CCCCOc2cccc(C#N)c2)CC1	ZINC000347277494	164472174	/nfs/dbraw/zinc/47/21/74/164472174.db2.gz	TXYWSQUVAOOOTB-UHFFFAOYSA-N	0	3	343.471	3.050	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N1CCC[C@@H](CNC(=O)c2ccco2)C1	ZINC000338354168	287142038	/nfs/dbraw/zinc/14/20/38/287142038.db2.gz	MACMFABQXNMHII-RDJZCZTQSA-N	0	3	337.423	3.354	20	30		EGEDHN
N#Cc1ccc(C(=O)N(CCN2CCCCCC2)C2CCC2)cc1	ZINC000359785238	167231616	/nfs/dbraw/zinc/23/16/16/167231616.db2.gz	DIEBHJJHAVRQNL-UHFFFAOYSA-N	0	3	325.456	3.429	20	30		EGEDHN
CSCCCCCCNC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000280003793	270039996	/nfs/dbraw/zinc/03/99/96/270039996.db2.gz	LJQVSNJFPFBTKY-KRWDZBQOSA-N	0	3	329.469	3.280	20	30		EGEDHN
N#Cc1cccc(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)c1	ZINC000299646310	270043753	/nfs/dbraw/zinc/04/37/53/270043753.db2.gz	MOTORELRAUHXIW-UHFFFAOYSA-N	0	3	349.434	3.015	20	30		EGEDHN
C#CCNC(=O)[C@@H](C)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000368057154	270045863	/nfs/dbraw/zinc/04/58/63/270045863.db2.gz	BUQCPCMPYJYZAQ-HZPDHXFCSA-N	0	3	331.419	3.014	20	30		EGEDHN
N#Cc1cccc(CNC[C@H]2CSCCN2Cc2ccccc2)c1	ZINC000428561181	270050315	/nfs/dbraw/zinc/05/03/15/270050315.db2.gz	UVURJEAZRNAZLX-FQEVSTJZSA-N	0	3	337.492	3.265	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]([C@H](CO)C2CC2)C2CC2)c(OC(F)F)c1	ZINC000451604174	270053637	/nfs/dbraw/zinc/05/36/37/270053637.db2.gz	KDHMCWBVJRNDIY-NVXWUHKLSA-N	0	3	336.382	3.046	20	30		EGEDHN
Cc1nc(N(CCN(C)C)Cc2cccc(Cl)c2)ccc1C#N	ZINC000488075052	270055948	/nfs/dbraw/zinc/05/59/48/270055948.db2.gz	BTWADVOOAKMCCO-UHFFFAOYSA-N	0	3	328.847	3.483	20	30		EGEDHN
Cc1cc(F)cc2c1ncc(C#N)c2N1CCN(C)[C@H](C(C)C)C1	ZINC000487081952	270055983	/nfs/dbraw/zinc/05/59/83/270055983.db2.gz	BECKDYSMTPJBBX-KRWDZBQOSA-N	0	3	326.419	3.330	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN1CCC[C@H]1c1ccccn1	ZINC000533348251	270060954	/nfs/dbraw/zinc/06/09/54/270060954.db2.gz	BRHQSVIZTYQGPL-HNNXBMFYSA-N	0	3	326.425	3.180	20	30		EGEDHN
CCC1(CC)[C@H](NCC(=O)Nc2oc(C)c(C)c2C#N)[C@H](C)[C@@H]1OC	ZINC000191397512	266013179	/nfs/dbraw/zinc/01/31/79/266013179.db2.gz	OSZCQMWDCCXNPE-VUCTXSBTSA-N	0	3	347.459	3.136	20	30		EGEDHN
CCO[C@H]1C[C@H](NCC(=O)Nc2sc(C)c(C)c2C#N)C12CCC2	ZINC000296169869	266303434	/nfs/dbraw/zinc/30/34/34/266303434.db2.gz	KXRGLHKQCGMJFB-GJZGRUSLSA-N	0	3	347.484	3.112	20	30		EGEDHN
CCSCC[C@H](C)N(C)C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000280298977	266342960	/nfs/dbraw/zinc/34/29/60/266342960.db2.gz	FPVVMHWQKWGOKW-WMLDXEAASA-N	0	3	329.469	3.231	20	30		EGEDHN
COC(=O)COc1cccc(CN[C@H](C)c2ccc(C#N)c(F)c2)c1	ZINC000271992205	266752533	/nfs/dbraw/zinc/75/25/33/266752533.db2.gz	ZOFGXZGTPIOTRX-CYBMUJFWSA-N	0	3	342.370	3.100	20	30		EGEDHN
CCCCN1CCCC[C@H]1CNC(=O)C1(c2cccc(C#N)c2)CC1	ZINC000435008384	267007611	/nfs/dbraw/zinc/00/76/11/267007611.db2.gz	MTMUKCFSSDHZOD-IBGZPJMESA-N	0	3	339.483	3.361	20	30		EGEDHN
CCCCO[C@@H]1C[C@H](NCC(=O)Nc2oc(C)c(C)c2C#N)C1(C)C	ZINC000450976677	267010770	/nfs/dbraw/zinc/01/07/70/267010770.db2.gz	ZVVAKFXZSZVAFS-JKSUJKDBSA-N	0	3	347.459	3.280	20	30		EGEDHN
C[C@@H]1CCN(c2nc3ccccn3c2C#N)CCN1Cc1ccccc1	ZINC000302140030	267023729	/nfs/dbraw/zinc/02/37/29/267023729.db2.gz	FBSPPQKTCAJQDD-QGZVFWFLSA-N	0	3	345.450	3.307	20	30		EGEDHN
C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)C(C)(C)c1cc(F)cc(C#N)c1	ZINC000288560628	267080297	/nfs/dbraw/zinc/08/02/97/267080297.db2.gz	WFDJFESZDCOZGH-RDTXWAMCSA-N	0	3	343.446	3.060	20	30		EGEDHN
C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)Nc1ccc(C#N)cc1Cl	ZINC000287292231	267089117	/nfs/dbraw/zinc/08/91/17/267089117.db2.gz	ZAQIRMYRNTYWTP-OCCSQVGLSA-N	0	3	332.835	3.302	20	30		EGEDHN
CCOC(=O)Nc1ccc(NC(=O)C(C)C(F)(F)F)cc1C#N	ZINC000493989813	267128102	/nfs/dbraw/zinc/12/81/02/267128102.db2.gz	UZWYGMXGIRLHME-MRVPVSSYSA-N	0	3	329.278	3.264	20	30		EGEDHN
C[C@H](CN1CCC[C@@H](C)C1)NC(=O)C(C)(C)c1cc(F)cc(C#N)c1	ZINC000285250708	267155470	/nfs/dbraw/zinc/15/54/70/267155470.db2.gz	ZSLZGQNQJXOUKM-HUUCEWRRSA-N	0	3	345.462	3.212	20	30		EGEDHN
C[C@H](NCCOc1ccc(C#N)cc1)c1ccc(Br)cn1	ZINC000280018584	267182943	/nfs/dbraw/zinc/18/29/43/267182943.db2.gz	HFYOMKRJWPVWSU-LBPRGKRZSA-N	0	3	346.228	3.445	20	30		EGEDHN
CC[C@@H](N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O)c1ccncc1	ZINC000453200738	267195431	/nfs/dbraw/zinc/19/54/31/267195431.db2.gz	VSNRGZNDVKIIOF-RTBURBONSA-N	0	3	334.423	3.190	20	30		EGEDHN
CC(C)O[C@@H]1C[C@H](N[C@@H](C)C(=O)Nc2ccccc2C#N)C1(C)C	ZINC000274206607	267198365	/nfs/dbraw/zinc/19/83/65/267198365.db2.gz	OERIYPGPXJYGEH-RRQGHBQHSA-N	0	3	329.444	3.067	20	30		EGEDHN
CC[C@H](C)N[C@@H](CNC(=O)NCc1ccc(C#N)s1)c1ccco1	ZINC000422205122	267204553	/nfs/dbraw/zinc/20/45/53/267204553.db2.gz	ONJGBNRBYKGXBE-WFASDCNBSA-N	0	3	346.456	3.141	20	30		EGEDHN
CN(CC(=O)NCc1cccc(C#N)c1)[C@@H]1CCC[C@H]1C(C)(C)C	ZINC000419328406	267297731	/nfs/dbraw/zinc/29/77/31/267297731.db2.gz	OSTMEFVSJMTQAX-QZTJIDSGSA-N	0	3	327.472	3.321	20	30		EGEDHN
COC(=O)[C@](C)(CN[C@@H](C)c1cccc(C#N)c1)c1ccc(F)cc1	ZINC000447017701	267392852	/nfs/dbraw/zinc/39/28/52/267392852.db2.gz	PLJJOHYIINFUCK-VBKZILBWSA-N	0	3	340.398	3.479	20	30		EGEDHN
COc1cc(CN(CCCO)[C@H]2CCc3ccccc32)ccc1C#N	ZINC000442882495	267579205	/nfs/dbraw/zinc/57/92/05/267579205.db2.gz	REKPZJGLQNDDIM-FQEVSTJZSA-N	0	3	336.435	3.439	20	30		EGEDHN
Cc1ccc([C@H](CNc2ccc(C(F)(F)F)c(C#N)n2)N(C)C)cc1	ZINC000443515041	268046276	/nfs/dbraw/zinc/04/62/76/268046276.db2.gz	IYCCTCUSVNVNCW-INIZCTEOSA-N	0	3	348.372	3.417	20	30		EGEDHN
Cc1cccc(C)c1OCCN1CC[C@@H](Oc2ccc(C#N)cn2)C1	ZINC000428821868	268051133	/nfs/dbraw/zinc/05/11/33/268051133.db2.gz	VIEWRPLUMDBRJZ-GOSISDBHSA-N	0	3	337.423	3.102	20	30		EGEDHN
N#Cc1ccc(CC(=O)NC[C@H](c2cccs2)N2CCCC2)cc1	ZINC000194840033	268057242	/nfs/dbraw/zinc/05/72/42/268057242.db2.gz	SXTIYAVGLCEISL-QGZVFWFLSA-N	0	3	339.464	3.116	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CCC(C(F)(F)F)CC2)cc1	ZINC000280643887	268084085	/nfs/dbraw/zinc/08/40/85/268084085.db2.gz	ZRZDURNRQWPZRG-AWEZNQCLSA-N	0	3	335.329	3.041	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NC[C@H]2CCCc3ccccc32)cc1	ZINC000279700976	268084795	/nfs/dbraw/zinc/08/47/95/268084795.db2.gz	JJTVNGJQRHPUCC-UXHICEINSA-N	0	3	343.430	3.477	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CCCc3ccccc3C2)cc1	ZINC000280600597	268088601	/nfs/dbraw/zinc/08/86/01/268088601.db2.gz	XDJZZLJJYWSTHL-HXUWFJFHSA-N	0	3	329.403	3.216	20	30		EGEDHN
Cc1nsc(N2CCN(Cc3ccccc3)C[C@H](C)C2)c1C#N	ZINC000450809172	268102648	/nfs/dbraw/zinc/10/26/48/268102648.db2.gz	JVXMNRKKOYCKKM-AWEZNQCLSA-N	0	3	326.469	3.282	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@@H]([NH2+][C@H]3CCc4cccc([O-])c43)C2=O)cc1	ZINC000296360911	268111944	/nfs/dbraw/zinc/11/19/44/268111944.db2.gz	IAIQYTLLDWNMCL-ZWKOTPCHSA-N	0	3	347.418	3.036	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCN(Cc3cccc4cccnc43)C2)nc1	ZINC000292258191	268185939	/nfs/dbraw/zinc/18/59/39/268185939.db2.gz	RGTZLYDQRZDJRP-SFHVURJKSA-N	0	3	330.391	3.155	20	30		EGEDHN
N#Cc1ccc(CNC[C@@]2(CO)C[C@H]2c2ccc(F)cc2)c(F)c1	ZINC000428543449	268233837	/nfs/dbraw/zinc/23/38/37/268233837.db2.gz	SERXFMDIKQHJND-PKOBYXMFSA-N	0	3	328.362	3.092	20	30		EGEDHN
N#Cc1cccc(C2(NCCC(=O)N3CCc4ccccc43)CC2)c1	ZINC000285126646	268241103	/nfs/dbraw/zinc/24/11/03/268241103.db2.gz	SCUKJKHHVYZCEA-UHFFFAOYSA-N	0	3	331.419	3.116	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN2CCC[C@]3(CCc4ccccc4O3)C2)cc1	ZINC000528737726	268263358	/nfs/dbraw/zinc/26/33/58/268263358.db2.gz	WSLQQNBGARFBSG-UNMCSNQZSA-N	0	3	348.446	3.451	20	30		EGEDHN
N#Cc1ccccc1OCCN[C@@H](CCO)c1ccc(Cl)cc1	ZINC000287116790	268284210	/nfs/dbraw/zinc/28/42/10/268284210.db2.gz	YUJJBOKKSFFXFR-KRWDZBQOSA-N	0	3	330.815	3.304	20	30		EGEDHN
C[C@@H](CN1CCCCC1)Nc1c(C#N)cnc2c(F)c(F)c(F)cc21	ZINC000341556536	274217389	/nfs/dbraw/zinc/21/73/89/274217389.db2.gz	ZZQHVBXJMQQSJQ-NSHDSACASA-N	0	3	348.372	3.232	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)C(=O)NCCN1CCC(C)CC1	ZINC000046369231	275137014	/nfs/dbraw/zinc/13/70/14/275137014.db2.gz	BBBMUEQYVZFOJW-UHFFFAOYSA-N	0	3	342.487	3.212	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1CC2(CCN(C)CC2)Oc2ccccc21	ZINC000179743618	275379166	/nfs/dbraw/zinc/37/91/66/275379166.db2.gz	JREKKAGXNRBDJG-SFHVURJKSA-N	0	3	340.467	3.284	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@H](N[C@@H](Cc1ccccc1)[C@@H](O)C(F)F)CC2	ZINC000353250725	303201792	/nfs/dbraw/zinc/20/17/92/303201792.db2.gz	GICYJRNTTNPMNV-CEXWTWQISA-N	0	3	342.389	3.372	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)c1ccc2c(c1)CCC2	ZINC000065930075	307360726	/nfs/dbraw/zinc/36/07/26/307360726.db2.gz	MZHSWVBZZCWHNM-UHFFFAOYSA-N	0	3	347.462	3.251	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)c1cc2ccccn2c1	ZINC000074596028	307394875	/nfs/dbraw/zinc/39/48/75/307394875.db2.gz	LYQZNPNVQQXHGT-UHFFFAOYSA-N	0	3	346.434	3.015	20	30		EGEDHN
CC(C)CN(C(=O)/C=C\c1cccc(C#N)c1)C1CCN(C)CC1	ZINC000255322405	308046471	/nfs/dbraw/zinc/04/64/71/308046471.db2.gz	BAXFNDUNFASORG-FPLPWBNLSA-N	0	3	325.456	3.150	20	30		EGEDHN
Cc1cc(NCC2=CCN(C)CC2)n2c3ccccc3nc2c1C#N	ZINC000538294329	314238133	/nfs/dbraw/zinc/23/81/33/314238133.db2.gz	UBGSNSMOFLCYFM-UHFFFAOYSA-N	0	3	331.423	3.341	20	30		EGEDHN
C[C@@H](N[C@H]1CCCN(C)C1=O)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000542004677	314511299	/nfs/dbraw/zinc/51/12/99/314511299.db2.gz	LYWBLFQYAUMWAQ-QRWLVFNGSA-N	0	3	333.435	3.497	20	30		EGEDHN
C[C@H](CC(=O)NCCc1ccccc1)NC1(c2cccc(C#N)c2)CC1	ZINC000551818998	315170550	/nfs/dbraw/zinc/17/05/50/315170550.db2.gz	VVPGHESZKPRTQE-QGZVFWFLSA-N	0	3	347.462	3.274	20	30		EGEDHN
CCN(C)C[C@@H](O)CSc1nc(-c2ccccc2)ccc1C#N	ZINC000563422540	316018921	/nfs/dbraw/zinc/01/89/21/316018921.db2.gz	GMLMCDKPGXGLSE-MRXNPFEDSA-N	0	3	327.453	3.025	20	30		EGEDHN
C[C@H]1CN(Cc2cnc3c(C#N)cnn3c2)CC[C@H]1c1ccccc1	ZINC000564989633	316242631	/nfs/dbraw/zinc/24/26/31/316242631.db2.gz	VHEJTZMEJSPTAM-HNAYVOBHSA-N	0	3	331.423	3.227	20	30		EGEDHN
COC1CCN(CCNc2ccc(C(F)(F)F)c(C#N)c2)CC1	ZINC000167046680	454917666	/nfs/dbraw/zinc/91/76/66/454917666.db2.gz	UTCFSCMOZOYBEK-UHFFFAOYSA-N	0	3	327.350	3.100	20	30		EGEDHN
OCCCCN(CC#Cc1ccc(OC(F)(F)F)cc1)C1CC1	ZINC000152327829	455102795	/nfs/dbraw/zinc/10/27/95/455102795.db2.gz	ISAOHKNDAFGDLY-UHFFFAOYSA-N	0	3	327.346	3.174	20	30		EGEDHN
COC(=O)c1cccc(CN[C@H](C(C)C)C2(CO)CCCC2)c1C#N	ZINC000577359552	324792418	/nfs/dbraw/zinc/79/24/18/324792418.db2.gz	IGSUWTMLWZAZRX-GOSISDBHSA-N	0	3	344.455	3.012	20	30		EGEDHN
CCO[C@@H]1C[C@H](N(C)Cc2cnc3c(C#N)cnn3c2)C1(CC)CC	ZINC000580952096	325313382	/nfs/dbraw/zinc/31/33/82/325313382.db2.gz	HKFIJXVMFUGYSE-DLBZAZTESA-N	0	3	341.459	3.017	20	30		EGEDHN
N#Cc1ccccc1NC(=O)CCN1CCC(C(F)(F)F)CC1	ZINC000173010700	455219176	/nfs/dbraw/zinc/21/91/76/455219176.db2.gz	RFSMPAZINPEEQS-UHFFFAOYSA-N	0	3	325.334	3.161	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC[C@@H](c3ccccc3)[C@@H](C)C2)CC1	ZINC000173199174	455246554	/nfs/dbraw/zinc/24/65/54/455246554.db2.gz	FEAIJVUGASOOSD-FXAWDEMLSA-N	0	3	341.499	3.472	20	30		EGEDHN
CCCC[C@@H](NCCNC(=O)C1N=CC=CC1=O)c1ccc(F)cc1	ZINC000180882026	455260837	/nfs/dbraw/zinc/26/08/37/455260837.db2.gz	KXEDVZRMGRUKLD-OZNQOIHVSA-N	0	3	345.418	3.173	20	30		EGEDHN
C[C@H]1CCC[C@](C#N)(NC(=O)c2ccc(CN3CCCC3)cc2)C1	ZINC000265383317	455316564	/nfs/dbraw/zinc/31/65/64/455316564.db2.gz	QXUHCVUWQDVVLG-JXFKEZNVSA-N	0	3	325.456	3.485	20	30		EGEDHN
N#CC(C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)c1ccccn1	ZINC000181410190	455331210	/nfs/dbraw/zinc/33/12/10/455331210.db2.gz	NRJNRYHKXDRXOZ-LLVKDONJSA-N	0	3	333.250	3.081	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@H]2CCn3ccnc3C2)cc1OC	ZINC000623497026	460582711	/nfs/dbraw/zinc/58/27/11/460582711.db2.gz	UJNWCLNDTRZHPT-AWEZNQCLSA-N	0	3	347.846	3.215	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCc2ccnc3ccccc23)CC1	ZINC000605660140	460616751	/nfs/dbraw/zinc/61/67/51/460616751.db2.gz	KRCKRLPMSKWDAE-UHFFFAOYSA-N	0	3	337.467	3.324	20	30		EGEDHN
C[C@H]1CCCC[C@@H]1CN1CCN(c2oc(C3CC3)nc2C#N)CC1	ZINC000612397679	460618612	/nfs/dbraw/zinc/61/86/12/460618612.db2.gz	XPWAKDCFMJCFKN-GOEBONIOSA-N	0	3	328.460	3.372	20	30		EGEDHN
C#CCNC(=O)[C@@H](C)NC[C@H](c1c[nH]c2ccccc21)c1ccccc1	ZINC000029569856	453829917	/nfs/dbraw/zinc/82/99/17/453829917.db2.gz	GNNIJHPVGYUVPW-APWZRJJASA-N	0	3	345.446	3.027	20	30		EGEDHN
CCN1CCC(NC(=O)c2ccc(C#Cc3ccccc3)cc2)CC1	ZINC000029608350	453830225	/nfs/dbraw/zinc/83/02/25/453830225.db2.gz	XZRIRBKGKIINHC-UHFFFAOYSA-N	0	3	332.447	3.301	20	30		EGEDHN
CC(C)[C@@H](C)N(C)CC(=O)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000030150442	453834062	/nfs/dbraw/zinc/83/40/62/453834062.db2.gz	NHCTVLWTBANFMF-CQSZACIVSA-N	0	3	340.389	3.149	20	30		EGEDHN
C[C@H](C#N)CN(C)C(=O)NC[C@@H](c1ccccc1)N1CCC(C)CC1	ZINC000052582232	453838326	/nfs/dbraw/zinc/83/83/26/453838326.db2.gz	AOGPFJFDBSQPMP-MJGOQNOKSA-N	0	3	342.487	3.261	20	30		EGEDHN
CCN1CCC[C@H]1CNC(=O)c1ccccc1-c1ccccc1C#N	ZINC000052834657	453846483	/nfs/dbraw/zinc/84/64/83/453846483.db2.gz	JXSBLCBRUJJKJH-KRWDZBQOSA-N	0	3	333.435	3.439	20	30		EGEDHN
N#Cc1ccc(NC(=O)NCCCN2CCc3ccccc3C2)cc1	ZINC000031662720	453851372	/nfs/dbraw/zinc/85/13/72/453851372.db2.gz	XHEQUENDSNBRLB-UHFFFAOYSA-N	0	3	334.423	3.128	20	30		EGEDHN
Cc1ccccc1CN1CCCN(C(=O)c2cccc(C#N)c2)CC1	ZINC000031766825	453854247	/nfs/dbraw/zinc/85/42/47/453854247.db2.gz	YIROLBTTYIXXDZ-UHFFFAOYSA-N	0	3	333.435	3.215	20	30		EGEDHN
Cc1ccc([C@@H]2CCC[C@@H]2N(C)CC(=O)N[C@@](C)(C#N)C2CC2)cc1	ZINC000075886397	453936107	/nfs/dbraw/zinc/93/61/07/453936107.db2.gz	CQTFVQJFBRCBRW-ZJOUEHCJSA-N	0	3	339.483	3.371	20	30		EGEDHN
N#Cc1cccc(C(=O)NCC2CCN(Cc3cccs3)CC2)c1	ZINC000038584405	453941437	/nfs/dbraw/zinc/94/14/37/453941437.db2.gz	ZQCZWEDANAEJEG-UHFFFAOYSA-N	0	3	339.464	3.262	20	30		EGEDHN
N#Cc1ccc(OCCN2CCCN(Cc3ccccc3)CC2)cc1	ZINC000054992841	453955130	/nfs/dbraw/zinc/95/51/30/453955130.db2.gz	DYAOTSOIBTVCLY-UHFFFAOYSA-N	0	3	335.451	3.145	20	30		EGEDHN
C=CCOc1ccc(C(=O)NCC(C)(C)N2CCCCC2)cc1OC	ZINC000041947679	453985586	/nfs/dbraw/zinc/98/55/86/453985586.db2.gz	AYZFUXMNMULGHG-UHFFFAOYSA-N	0	3	346.471	3.254	20	30		EGEDHN
Cc1ccc(C#N)cc1NC(=O)N(CCN(C)C)Cc1ccco1	ZINC000088376733	454101600	/nfs/dbraw/zinc/10/16/00/454101600.db2.gz	ZAAPCVDAZHKIIJ-UHFFFAOYSA-N	0	3	326.400	3.055	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C(=O)C1CCN(Cc2ccccc2)CC1	ZINC000057155633	454107752	/nfs/dbraw/zinc/10/77/52/454107752.db2.gz	KZRYKGRFIOZDBN-UHFFFAOYSA-N	0	3	347.462	3.429	20	30		EGEDHN
N#Cc1ccc(NC[C@H]2C[C@@H](O)CN2Cc2ccccc2)cc1Cl	ZINC000089644752	454173508	/nfs/dbraw/zinc/17/35/08/454173508.db2.gz	ODCZFENQNBCERD-QZTJIDSGSA-N	0	3	341.842	3.259	20	30		EGEDHN
CC#CCN1CCC(C(=O)Nc2ccc(Br)cc2)CC1	ZINC000160030939	455422864	/nfs/dbraw/zinc/42/28/64/455422864.db2.gz	HCCLOLFXLUZQAX-UHFFFAOYSA-N	0	3	335.245	3.123	20	30		EGEDHN
C[C@@H]1C[C@H]1c1ccc(CN(CCC(=O)N(C)CCC#N)C2CC2)o1	ZINC000130905369	454225695	/nfs/dbraw/zinc/22/56/95/454225695.db2.gz	GWXWVXIIAHJRMR-RHSMWYFYSA-N	0	3	329.444	3.130	20	30		EGEDHN
CN(CCC#N)C(=O)CCN1CCC[C@@H]1c1nc2ccccc2s1	ZINC000131034946	454231536	/nfs/dbraw/zinc/23/15/36/454231536.db2.gz	GBXOTLAFDYZQDI-OAHLLOKOSA-N	0	3	342.468	3.195	20	30		EGEDHN
C=CCc1ccc(OC[C@@H](O)CN(C)Cc2ccccc2)c(OC)c1	ZINC000046344822	454243183	/nfs/dbraw/zinc/24/31/83/454243183.db2.gz	WLXFMHZDDFZCDR-IBGZPJMESA-N	0	3	341.451	3.295	20	30		EGEDHN
N#CC(C(=O)c1cncc(Br)c1)c1nc2ccccc2[nH]1	ZINC000046440763	454252355	/nfs/dbraw/zinc/25/23/55/454252355.db2.gz	AWKDRNSDKYGLLL-NSHDSACASA-N	0	3	341.168	3.210	20	30		EGEDHN
COc1cc(F)c([C@@H](C)NCCOc2ccc(C#N)cc2)cc1OC	ZINC000090106811	454279945	/nfs/dbraw/zinc/27/99/45/454279945.db2.gz	RHBKMBZVEKZWBN-CYBMUJFWSA-N	0	3	344.386	3.444	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)N1CCC(c2ccc(O)cc2)CC1	ZINC000078682694	454299046	/nfs/dbraw/zinc/29/90/46/454299046.db2.gz	VPJUIAVCIGNRNX-INIZCTEOSA-N	0	3	328.456	3.161	20	30		EGEDHN
C=CCOc1ccc(CNc2ccn(CCN(C)C)n2)cc1Cl	ZINC000131948362	454300985	/nfs/dbraw/zinc/30/09/85/454300985.db2.gz	ILCDXQRABKKCTD-UHFFFAOYSA-N	0	3	334.851	3.275	20	30		EGEDHN
Cc1ccsc1C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000047010674	454318402	/nfs/dbraw/zinc/31/84/02/454318402.db2.gz	RGFZFKBSZAAJBV-UHFFFAOYSA-N	0	3	327.453	3.132	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@@H](C)N1CCC2(C1)CCOCC2	ZINC000072898785	454360400	/nfs/dbraw/zinc/36/04/00/454360400.db2.gz	CUDWLKBPHSCYGW-MRXNPFEDSA-N	0	3	348.512	3.154	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC(CNCc2ccc(C#N)cc2F)CC1	ZINC000133027683	454386144	/nfs/dbraw/zinc/38/61/44/454386144.db2.gz	BFUKECNGQRVDBI-UHFFFAOYSA-N	0	3	347.434	3.434	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)c2cccc(Nc3cnccn3)c2)n1	ZINC000097034274	454392116	/nfs/dbraw/zinc/39/21/16/454392116.db2.gz	SSPNCJSIJANOEA-AWEZNQCLSA-N	0	3	335.392	3.475	20	30		EGEDHN
C=CCOc1ccc(CN2CCC[C@@H](c3cc[nH]n3)C2)cc1OC	ZINC000121236927	454410405	/nfs/dbraw/zinc/41/04/05/454410405.db2.gz	QRDLVFDOJZKTGK-MRXNPFEDSA-N	0	3	327.428	3.363	20	30		EGEDHN
C[C@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)C1)c1ccc(C#N)cc1	ZINC000047966360	454424480	/nfs/dbraw/zinc/42/44/80/454424480.db2.gz	CLEQSBXTFZSXHT-JXFKEZNVSA-N	0	3	348.450	3.193	20	30		EGEDHN
CCCN(CC(=O)N(CC)CCC#N)[C@H]1CCc2ccccc2C1	ZINC000098136824	454461558	/nfs/dbraw/zinc/46/15/58/454461558.db2.gz	YWNJXXQTVDXSMY-IBGZPJMESA-N	0	3	327.472	3.018	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC[C@H]1CCCN(Cc2cccs2)C1	ZINC000064521121	454489297	/nfs/dbraw/zinc/48/92/97/454489297.db2.gz	FPLQYTCCQJDSBM-JKSUJKDBSA-N	0	3	336.501	3.058	20	30		EGEDHN
C=CCOCCCC(=O)N[C@@H](CN1CCCCC1)c1ccccc1	ZINC000079959020	454505903	/nfs/dbraw/zinc/50/59/03/454505903.db2.gz	YJAWXXNJEYQEJA-IBGZPJMESA-N	0	3	330.472	3.313	20	30		EGEDHN
CN(CCC#N)C(=O)CCN(Cc1ccccc1)Cc1ccccc1	ZINC000122113892	454509993	/nfs/dbraw/zinc/50/99/93/454509993.db2.gz	VEIGVZCBCNFMMP-UHFFFAOYSA-N	0	3	335.451	3.451	20	30		EGEDHN
CN(C)Cc1cccc(NC(=O)CSc2ccc(C#N)cc2)c1	ZINC000102987808	454530802	/nfs/dbraw/zinc/53/08/02/454530802.db2.gz	OHMLVYQPNAIPNE-UHFFFAOYSA-N	0	3	325.437	3.351	20	30		EGEDHN
C=CCOCCCC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C	ZINC000080431785	454580421	/nfs/dbraw/zinc/58/04/21/454580421.db2.gz	RSCXJPRUYBAWIU-GOSISDBHSA-N	0	3	330.472	3.092	20	30		EGEDHN
CC(C)(C)[C@H](NCC(=O)N(CCC#N)CCC#N)c1ccccc1	ZINC000065589080	454597343	/nfs/dbraw/zinc/59/73/43/454597343.db2.gz	WKURLOGSBNQWDI-GOSISDBHSA-N	0	3	326.444	3.019	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)CCc2ccc(C#N)cc2)CN1Cc1ccccc1	ZINC000134887908	454603547	/nfs/dbraw/zinc/60/35/47/454603547.db2.gz	LSDSLNAZGJFORA-UWJYYQICSA-N	0	3	347.462	3.270	20	30		EGEDHN
COc1ccc(CN(CCCO)[C@H]2CCc3ccccc32)cc1C#N	ZINC000135128342	454637017	/nfs/dbraw/zinc/63/70/17/454637017.db2.gz	NRAMFLHGGADXNB-FQEVSTJZSA-N	0	3	336.435	3.439	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)NCCN1CCC[C@@H](C)C1	ZINC000066178451	454664923	/nfs/dbraw/zinc/66/49/23/454664923.db2.gz	OYLJLDGZMJEKKF-QGZVFWFLSA-N	0	3	342.487	3.210	20	30		EGEDHN
C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCCCN1CCCSCC#N	ZINC000074989995	454671520	/nfs/dbraw/zinc/67/15/20/454671520.db2.gz	RMIJXGGILBYUDF-HUUCEWRRSA-N	0	3	341.521	3.401	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2sccc2-n2cccc2)CC1	ZINC000106037433	454674794	/nfs/dbraw/zinc/67/47/94/454674794.db2.gz	WDKBJDDVHWGJMU-UHFFFAOYSA-N	0	3	329.469	3.309	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2c(C)onc2-c2ccccc2)CC1	ZINC000106038855	454676164	/nfs/dbraw/zinc/67/61/64/454676164.db2.gz	HNHLWDWCKYSUER-UHFFFAOYSA-N	0	3	339.439	3.420	20	30		EGEDHN
C#CCN(Cc1ccc(F)cc1)C(=O)NC1CCN(CC(=C)C)CC1	ZINC000106275592	454689746	/nfs/dbraw/zinc/68/97/46/454689746.db2.gz	YHMPFWCMMLEKLA-UHFFFAOYSA-N	0	3	343.446	3.011	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc3cnn(CC)c3c2)CC1	ZINC000106324223	454691441	/nfs/dbraw/zinc/69/14/41/454691441.db2.gz	OHSZRMPATRQUFW-UHFFFAOYSA-N	0	3	341.459	3.218	20	30		EGEDHN
COCCCOC1CCN(Cc2ccc(N(C)CCC#N)cc2)CC1	ZINC000093561510	454721321	/nfs/dbraw/zinc/72/13/21/454721321.db2.gz	MCCCCMUYRVBWFL-UHFFFAOYSA-N	0	3	345.487	3.054	20	30		EGEDHN
CCOC[C@H]1CCN(Cc2cn(CCC#N)nc2-c2ccccc2)C1	ZINC000093838709	454738141	/nfs/dbraw/zinc/73/81/41/454738141.db2.gz	WZJNYVMYAIFFOF-KRWDZBQOSA-N	0	3	338.455	3.322	20	30		EGEDHN
N#Cc1ccccc1NC(=O)CCN1CCOC2(C1)CCCCCC2	ZINC000152893452	454738591	/nfs/dbraw/zinc/73/85/91/454738591.db2.gz	NSIVTNBGWWAQFP-UHFFFAOYSA-N	0	3	341.455	3.312	20	30		EGEDHN
CCOc1ccc(NC(=O)CCN(C)Cc2ccc(C#N)cc2)cc1	ZINC000136479648	454743799	/nfs/dbraw/zinc/74/37/99/454743799.db2.gz	FWSISYHSFVQFBK-UHFFFAOYSA-N	0	3	337.423	3.418	20	30		EGEDHN
N#C[C@H](NC(=O)c1cccc(CN2CCCC2)c1)c1ccccc1F	ZINC000108799913	454812989	/nfs/dbraw/zinc/81/29/89/454812989.db2.gz	BPHFIUIEMMZACO-IBGZPJMESA-N	0	3	337.398	3.416	20	30		EGEDHN
C=CCN(CC=C)C(=O)N[C@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000175641273	455475451	/nfs/dbraw/zinc/47/54/51/455475451.db2.gz	FHKQYQMABUWFGM-MJGOQNOKSA-N	0	3	327.472	3.423	20	30		EGEDHN
C=CCN(CC=C)C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000175641256	455475677	/nfs/dbraw/zinc/47/56/77/455475677.db2.gz	FHKQYQMABUWFGM-PKOBYXMFSA-N	0	3	327.472	3.423	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc3ccc(Cl)cc3n2)CC1	ZINC000177466535	454867333	/nfs/dbraw/zinc/86/73/33/454867333.db2.gz	YEXGTPJKKYAYSW-UHFFFAOYSA-N	0	3	329.831	3.268	20	30		EGEDHN
CC(C)CN1CCCC[C@@H]1CNC(=O)c1c(F)cc(C#N)cc1F	ZINC000154246760	454877427	/nfs/dbraw/zinc/87/74/27/454877427.db2.gz	HYJQHOREAOWYAS-CQSZACIVSA-N	0	3	335.398	3.077	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C(C)(C)Cc2ccccc2OC)CC1	ZINC000112636558	454893190	/nfs/dbraw/zinc/89/31/90/454893190.db2.gz	VXEOXQCGVWJOOJ-UHFFFAOYSA-N	0	3	344.499	3.421	20	30		EGEDHN
C#CCCOc1ccc(CNCc2ccc(OC)c(OC)c2)cc1	ZINC000113312145	454922013	/nfs/dbraw/zinc/92/20/13/454922013.db2.gz	HMXPPPFOEDPFGD-UHFFFAOYSA-N	0	3	325.408	3.396	20	30		EGEDHN
CC[C@H](NCC(=O)N(CCC#N)c1cccc(Cl)c1)[C@H]1CCCO1	ZINC000182325804	455489034	/nfs/dbraw/zinc/48/90/34/455489034.db2.gz	MSDOYAONBWRXBV-DLBZAZTESA-N	0	3	349.862	3.134	20	30		EGEDHN
COc1cccc(C2CCN(C[C@H](O)c3ccc(C#N)cc3)CC2)c1	ZINC000178311649	454947883	/nfs/dbraw/zinc/94/78/83/454947883.db2.gz	XCUIJASXAMAMFD-NRFANRHFSA-N	0	3	336.435	3.480	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)[C@H](C)N1C[C@@H](c2ccccc2)C[C@H]1C	ZINC000115553166	455019943	/nfs/dbraw/zinc/01/99/43/455019943.db2.gz	CZSDEQBTRJTRQM-JMVFIXPQSA-N	0	3	327.472	3.307	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)N1CCC(C#N)CC1)c1ccccc1	ZINC000171452105	455071561	/nfs/dbraw/zinc/07/15/61/455071561.db2.gz	SCTMIRNTYXJJHE-SFHVURJKSA-N	0	3	328.460	3.015	20	30		EGEDHN
C=CCC[C@H](N[C@@H]1CCN(CC(F)(F)F)C1=O)c1ccccc1	ZINC000180050434	455122419	/nfs/dbraw/zinc/12/24/19/455122419.db2.gz	YGEUWCJPMXQDDO-LSDHHAIUSA-N	0	3	326.362	3.447	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)Nc2ccc(C#N)cc2)CN1Cc1ccccc1	ZINC000152580318	455138508	/nfs/dbraw/zinc/13/85/08/455138508.db2.gz	GBVSDPGEZMTFJE-BEFAXECRSA-N	0	3	334.423	3.343	20	30		EGEDHN
C[C@H](c1ccccc1)N1CCC(NC(=O)Cc2ccc(C#N)cc2)CC1	ZINC000172246998	455139563	/nfs/dbraw/zinc/13/95/63/455139563.db2.gz	FJWDURPQPQFGCL-QGZVFWFLSA-N	0	3	347.462	3.443	20	30		EGEDHN
N#CCCN(CC1CC1)C(=O)C1CCN(Cc2ccccc2)CC1	ZINC000264127687	455192464	/nfs/dbraw/zinc/19/24/64/455192464.db2.gz	YCGKDMMJPONCKH-UHFFFAOYSA-N	0	3	325.456	3.051	20	30		EGEDHN
N#Cc1cc(CN2CCC(CCCN3CCOCC3)CC2)ccc1F	ZINC000182961340	455200296	/nfs/dbraw/zinc/20/02/96/455200296.db2.gz	MTNXTGVYQRBPJT-UHFFFAOYSA-N	0	3	345.462	3.022	20	30		EGEDHN
CCS[C@H]1CCCC[C@H]1NCC(=O)Nc1oc(C)c(C)c1C#N	ZINC000189512744	455211237	/nfs/dbraw/zinc/21/12/37/455211237.db2.gz	HPRFZNRYBDIKMF-CABCVRRESA-N	0	3	335.473	3.361	20	30		EGEDHN
Cc1oc(NC(=O)CN[C@@H](C)[C@H](C)c2ccccc2)c(C#N)c1C	ZINC000181528130	455350006	/nfs/dbraw/zinc/35/00/06/455350006.db2.gz	MQCABMIPWQWEFP-JSGCOSHPSA-N	0	3	325.412	3.488	20	30		EGEDHN
Cc1oc([N-]C(=O)C[NH2+][C@@H](C)[C@H](C)c2ccccc2)c(C#N)c1C	ZINC000181528130	455350008	/nfs/dbraw/zinc/35/00/08/455350008.db2.gz	MQCABMIPWQWEFP-JSGCOSHPSA-N	0	3	325.412	3.488	20	30		EGEDHN
N#CCOc1ccc(CN2CCC[C@@H](c3nnc4ccccn43)C2)cc1	ZINC000265639142	455354174	/nfs/dbraw/zinc/35/41/74/455354174.db2.gz	JCMQNDQVFZBJKK-QGZVFWFLSA-N	0	3	347.422	3.011	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN(C)[C@@H](C)c1ccncc1	ZINC000245755498	455373525	/nfs/dbraw/zinc/37/35/25/455373525.db2.gz	HNSXEVCHGVCSIH-QFBILLFUSA-N	0	3	326.440	3.243	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000190739166	455376550	/nfs/dbraw/zinc/37/65/50/455376550.db2.gz	XKSWBZMBAXQCPT-OAQYLSRUSA-N	0	3	343.515	3.307	20	30		EGEDHN
COCCN(Cc1ccc(C#N)cc1)C[C@@H](O)CCc1ccccc1	ZINC000182284074	455479435	/nfs/dbraw/zinc/47/94/35/455479435.db2.gz	BXXNWPWHOPHXCA-NRFANRHFSA-N	0	3	338.451	3.000	20	30		EGEDHN
CC[C@H](NCCC(=O)Nc1ccc(C#N)cc1)c1c(C)noc1C	ZINC000182396846	455505562	/nfs/dbraw/zinc/50/55/62/455505562.db2.gz	WQOIINVPDKQGRZ-INIZCTEOSA-N	0	3	326.400	3.233	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(c3ccnc4ccncc43)CC2)cc1	ZINC000267188425	455513820	/nfs/dbraw/zinc/51/38/20/455513820.db2.gz	GVIJJAOAOZPJMF-UHFFFAOYSA-N	0	3	343.434	3.214	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000176120929	455543596	/nfs/dbraw/zinc/54/35/96/455543596.db2.gz	ZPSWNMOSMGJDOA-YQVWRLOYSA-N	0	3	330.472	3.137	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN[C@H]2CCO[C@@H]2c2ccc(Cl)cc2)cc1	ZINC000192041492	455547292	/nfs/dbraw/zinc/54/72/92/455547292.db2.gz	WPDLKPQFHHCBSP-GBESFXJTSA-N	0	3	342.826	3.365	20	30		EGEDHN
CCOc1cccc2cc([C@H](C)NCCC(=O)N(C)CCC#N)oc21	ZINC000182659178	455561737	/nfs/dbraw/zinc/56/17/37/455561737.db2.gz	GXCWBWXJJQMYCZ-AWEZNQCLSA-N	0	3	343.427	3.244	20	30		EGEDHN
N#Cc1ccc(OCCN[C@H]2CCO[C@H]2c2ccc(F)c(F)c2)cc1	ZINC000192142834	455563684	/nfs/dbraw/zinc/56/36/84/455563684.db2.gz	MCRMKHXVCKPEKL-OALUTQOASA-N	0	3	344.361	3.335	20	30		EGEDHN
CCOc1cc(N2CCN(C)CC2)ccc1N[C@H]1CCC[C@@H](C#N)C1	ZINC000185731091	455608727	/nfs/dbraw/zinc/60/87/27/455608727.db2.gz	QNWPVPAVIHETJT-SJORKVTESA-N	0	3	342.487	3.331	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N1CC[C@H]2CC[C@@H](C1)N2C)c1ccc(F)c(F)c1	ZINC000185843963	455633196	/nfs/dbraw/zinc/63/31/96/455633196.db2.gz	ZSCSFXUQRKQNON-VKJFTORMSA-N	0	3	349.425	3.460	20	30		EGEDHN
C#CCN(C)C(=O)NCc1ccccc1-c1ccc(CN(C)C)cc1	ZINC000292443118	455664864	/nfs/dbraw/zinc/66/48/64/455664864.db2.gz	NZTFSMXFQKBDTC-UHFFFAOYSA-N	0	3	335.451	3.190	20	30		EGEDHN
C=C(Cl)CNC(=O)N(C)CCC1CCN(c2ccncc2)CC1	ZINC000271523849	455671975	/nfs/dbraw/zinc/67/19/75/455671975.db2.gz	QQTHXWZOFKFARF-UHFFFAOYSA-N	0	3	336.867	3.082	20	30		EGEDHN
C=CCNC(=O)CN[C@@H]1CCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000284343458	455672015	/nfs/dbraw/zinc/67/20/15/455672015.db2.gz	MWOGTTBKXSOAKG-HUUCEWRRSA-N	0	3	326.362	3.233	20	30		EGEDHN
C#CCOc1ccc(CN[C@H]2CCO[C@@H]2c2ccnn2C(C)C)cc1	ZINC000284429903	455684229	/nfs/dbraw/zinc/68/42/29/455684229.db2.gz	FNKZROADLAFGBP-ICSRJNTNSA-N	0	3	339.439	3.096	20	30		EGEDHN
C=CCOCCN1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000292677517	455728787	/nfs/dbraw/zinc/72/87/87/455728787.db2.gz	BOHVVMITIRADEQ-HNNXBMFYSA-N	0	3	331.391	3.258	20	30		EGEDHN
CNC(=O)[C@H](C)CN(C)CCC(C#N)(c1ccccc1)c1ccccc1	ZINC000193062108	455740863	/nfs/dbraw/zinc/74/08/63/455740863.db2.gz	GYKGDOGCUXSHGY-GOSISDBHSA-N	0	3	349.478	3.200	20	30		EGEDHN
C[C@H]1CCNC(=O)[C@@H]1NCCC(C#N)(c1ccccc1)c1ccccc1	ZINC000193662652	455768734	/nfs/dbraw/zinc/76/87/34/455768734.db2.gz	LAVVTYMFQHXOAL-FXAWDEMLSA-N	0	3	347.462	3.001	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(Oc3ccncc3)c(C)c2)CC1	ZINC000193703292	455771774	/nfs/dbraw/zinc/77/17/74/455771774.db2.gz	QHYSWJFUJOQLGN-UHFFFAOYSA-N	0	3	349.434	3.466	20	30		EGEDHN
C#CCOc1ccccc1CN[C@@H](C)C1CN(C(=O)OC(C)(C)C)C1	ZINC000293742779	455795878	/nfs/dbraw/zinc/79/58/78/455795878.db2.gz	XKFWDUFMCRKMOW-HNNXBMFYSA-N	0	3	344.455	3.044	20	30		EGEDHN
CCCC[C@@H](NCCC(=O)N(C)CCC#N)c1ccc(OC)cc1	ZINC000271881256	455797845	/nfs/dbraw/zinc/79/78/45/455797845.db2.gz	ZIBBJNCHBBVTFS-GOSISDBHSA-N	0	3	331.460	3.278	20	30		EGEDHN
CCO[C@H]1C[C@](CO)(NCc2cccc(OCCCC#N)c2)C1(C)C	ZINC000186582676	455798598	/nfs/dbraw/zinc/79/85/98/455798598.db2.gz	KCZGJFBGFPKSSZ-AZUAARDMSA-N	0	3	346.471	3.025	20	30		EGEDHN
CSc1ccc([C@H](CNc2nnc(C)c(C)c2C#N)N(C)C)cc1	ZINC000294248358	455809548	/nfs/dbraw/zinc/80/95/48/455809548.db2.gz	WINJCPDWPGOLQN-KRWDZBQOSA-N	0	3	341.484	3.402	20	30		EGEDHN
CCC[C@H](CNCc1cn(CCC#N)nc1-c1ccccc1)OC	ZINC000295043501	455836867	/nfs/dbraw/zinc/83/68/67/455836867.db2.gz	FBAGNFZWOTULCO-GOSISDBHSA-N	0	3	326.444	3.368	20	30		EGEDHN
CC(C)(C#N)CCON=C(N)c1cccc(CN2CCCCC2)c1	ZINC000272068613	455838261	/nfs/dbraw/zinc/83/82/61/455838261.db2.gz	HOZWSRYUOCUAEI-UHFFFAOYSA-N	0	3	328.460	3.249	20	30		EGEDHN
C[C@@H](CC#N)Sc1ccccc1NC(=O)NCC1=CCN(C)CC1	ZINC000272097277	455845073	/nfs/dbraw/zinc/84/50/73/455845073.db2.gz	ZACHCLVDFRHTNK-AWEZNQCLSA-N	0	3	344.484	3.464	20	30		EGEDHN
C=CC(C)(C)c1nc(-c2ccc(OCCN(C)C)c(OC)c2)no1	ZINC000296101349	455869797	/nfs/dbraw/zinc/86/97/97/455869797.db2.gz	UIUXSZAPAGKDRH-UHFFFAOYSA-N	0	3	331.416	3.149	20	30		EGEDHN
C=CCOc1cccc(CNCCn2cc(Br)cn2)c1	ZINC000285577514	455874189	/nfs/dbraw/zinc/87/41/89/455874189.db2.gz	UXGNGXWCIKHHLF-UHFFFAOYSA-N	0	3	336.233	3.000	20	30		EGEDHN
CC[C@@H](NCc1ccc(C#N)o1)[C@@H](c1ccc(C)cc1)n1cncn1	ZINC000270097935	455876968	/nfs/dbraw/zinc/87/69/68/455876968.db2.gz	LLINSNRMKPQGRB-RTBURBONSA-N	0	3	335.411	3.209	20	30		EGEDHN
CC1(C)[C@H](NCc2ccc(C#N)cc2Br)[C@@H]2CCO[C@@H]21	ZINC000296215090	455882094	/nfs/dbraw/zinc/88/20/94/455882094.db2.gz	MPIHCKQAJORQBE-CFVMTHIKSA-N	0	3	335.245	3.224	20	30		EGEDHN
CCC[C@]1(NCC(=O)N(CCC#N)c2cccc(C)c2C)CCOC1	ZINC000285614644	455883014	/nfs/dbraw/zinc/88/30/14/455883014.db2.gz	QGGGZGOQOKXXGB-FQEVSTJZSA-N	0	3	343.471	3.099	20	30		EGEDHN
COCCCOc1ccc(CNCc2ccc(OC)c(C#N)c2)cc1	ZINC000285631376	455884595	/nfs/dbraw/zinc/88/45/95/455884595.db2.gz	RGGDBFZMQLPZQP-UHFFFAOYSA-N	0	3	340.423	3.272	20	30		EGEDHN
C[C@@H](NC(=O)CCc1ccc(C#N)cc1)[C@@H](c1ccccc1)N(C)C	ZINC000187264389	455888837	/nfs/dbraw/zinc/88/88/37/455888837.db2.gz	VOKPFBDEOUVBOB-IERDGZPVSA-N	0	3	335.451	3.298	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1CNCc1c(C)nn(-c2ccccn2)c1Cl	ZINC000285932091	455945386	/nfs/dbraw/zinc/94/53/86/455945386.db2.gz	LUHARMLSYPNHRZ-WMLDXEAASA-N	0	3	346.862	3.300	20	30		EGEDHN
C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCN(Cc2ccc(C#N)cc2)C1	ZINC000272526498	455982757	/nfs/dbraw/zinc/98/27/57/455982757.db2.gz	QJVFSVYGSJERJE-PBHICJAKSA-N	0	3	329.444	3.293	20	30		EGEDHN
CCCNc1ccc(CNC(=O)C(C#N)Cc2ccc(C#N)cc2)cc1	ZINC000280521389	455988993	/nfs/dbraw/zinc/98/89/93/455988993.db2.gz	JBDOPEOUXQWQEN-LJQANCHMSA-N	0	3	346.434	3.379	20	30		EGEDHN
C=CCOc1cccc(NC(=O)N2CC[C@]3(C2)CCCN(C)C3)c1	ZINC000296617687	455990141	/nfs/dbraw/zinc/99/01/41/455990141.db2.gz	WHJWWLYFYRNWHY-LJQANCHMSA-N	0	3	329.444	3.201	20	30		EGEDHN
C[C@@H](CN1CCC[C@H](C)C1)NC(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000280597812	456009102	/nfs/dbraw/zinc/00/91/02/456009102.db2.gz	NTASYZUNGNTACC-HOTGVXAUSA-N	0	3	327.472	3.338	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1CNCc1cccc(OC)c1OC(F)F	ZINC000280724702	456039369	/nfs/dbraw/zinc/03/93/69/456039369.db2.gz	VGNPGTUSVLDGTA-HIFRSBDPSA-N	0	3	327.371	3.367	20	30		EGEDHN
N#Cc1ccc(N2CCC(NCc3ccc(C(F)F)nc3)CC2)nc1	ZINC000601104613	460712599	/nfs/dbraw/zinc/71/25/99/460712599.db2.gz	BEGBXMZBULIWRN-UHFFFAOYSA-N	0	3	343.381	3.044	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC(C)(C)[C@@H]2c2cccs2)CC1	ZINC000287892442	456082041	/nfs/dbraw/zinc/08/20/41/456082041.db2.gz	YKBILVRWKXWQEK-INIZCTEOSA-N	0	3	333.501	3.491	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000188567461	456085373	/nfs/dbraw/zinc/08/53/73/456085373.db2.gz	WUDLNAIFISZXNS-OAQYLSRUSA-N	0	3	344.499	3.422	20	30		EGEDHN
C#Cc1ccc(CNCc2ccc(N3CCC(CO)CC3)cc2)cc1	ZINC000289051176	456112718	/nfs/dbraw/zinc/11/27/18/456112718.db2.gz	BIGAQDZGWVXOJH-UHFFFAOYSA-N	0	3	334.463	3.166	20	30		EGEDHN
CN1CCC[C@]2(CCN(C(=O)N[C@@H](CCC#N)c3ccccc3)C2)C1	ZINC000297095280	456116871	/nfs/dbraw/zinc/11/68/71/456116871.db2.gz	ADKDADGOXCXJOR-ICSRJNTNSA-N	0	3	340.471	3.159	20	30		EGEDHN
C=C(CN[C@H]1CCCc2ccc(S(N)(=O)=O)cc21)c1ccccc1	ZINC000289577394	456131167	/nfs/dbraw/zinc/13/11/67/456131167.db2.gz	DRAOTXIZRRQCRS-IBGZPJMESA-N	0	3	342.464	3.014	20	30		EGEDHN
COC[C@]1(CN[C@@H](C)c2ccc(C#N)cc2)OCCc2ccccc21	ZINC000289657241	456134835	/nfs/dbraw/zinc/13/48/35/456134835.db2.gz	GMQGLEFQYLPDCF-KKSFZXQISA-N	0	3	336.435	3.323	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cnc(C)nc1C1CC1)C(C)C	ZINC000281169169	456151806	/nfs/dbraw/zinc/15/18/06/456151806.db2.gz	GTKZTOCQLTUMOU-GOSISDBHSA-N	0	3	342.487	3.091	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)CCC1	ZINC000188985839	456189389	/nfs/dbraw/zinc/18/93/89/456189389.db2.gz	QXPKQOAYECSALR-ROUUACIJSA-N	0	3	348.531	3.471	20	30		EGEDHN
CO/N=C/c1ccc(C(=O)NC[C@H](N)c2ccc(C(C)C)cc2)cc1	ZINC000237109856	456235235	/nfs/dbraw/zinc/23/52/35/456235235.db2.gz	OACUZEDHHUKZDK-DOUQRPAJSA-N	0	3	339.439	3.220	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN[C@@H]1c2ccccc2CC12CCOCC2	ZINC000290095850	456239134	/nfs/dbraw/zinc/23/91/34/456239134.db2.gz	IEYYJFWZDCIOKT-HXUWFJFHSA-N	0	3	342.483	3.095	20	30		EGEDHN
N#CCSCCCN1CCN(c2ccnc3ccccc32)CC1	ZINC000297566399	456254819	/nfs/dbraw/zinc/25/48/19/456254819.db2.gz	HMIBJYRQZZTXNZ-UHFFFAOYSA-N	0	3	326.469	3.004	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@@H](N3CCCC3)C2)c(Br)c1	ZINC000301991520	456266929	/nfs/dbraw/zinc/26/69/29/456266929.db2.gz	PTZLGYAOHPUTQS-CQSZACIVSA-N	0	3	334.261	3.385	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000189266456	456267659	/nfs/dbraw/zinc/26/76/59/456267659.db2.gz	DFABVVCMKCIQGR-FBBABVLZSA-N	0	3	344.499	3.385	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H](CNC(=O)c1ccc(CC#N)cc1)C1CC1	ZINC000275110215	456270268	/nfs/dbraw/zinc/27/02/68/456270268.db2.gz	XWIKOBRTAJWFSM-NRFANRHFSA-N	0	3	347.462	3.393	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000290286770	456280514	/nfs/dbraw/zinc/28/05/14/456280514.db2.gz	DQYHOBWWTKIZQR-GCJKJVERSA-N	0	3	346.474	3.380	20	30		EGEDHN
COc1cc(CN[C@H](C)c2ccc([S@@](C)=O)cc2)ccc1C#N	ZINC000281691291	456294088	/nfs/dbraw/zinc/29/40/88/456294088.db2.gz	NANVKDVYNQRCLG-JCQPUDPBSA-N	0	3	328.437	3.155	20	30		EGEDHN
CC[C@H]1CN(c2nc3ccccn3c2C#N)CCN1Cc1ccccc1	ZINC000302178461	456308701	/nfs/dbraw/zinc/30/87/01/456308701.db2.gz	YGGBKBNMDPPDIL-SFHVURJKSA-N	0	3	345.450	3.307	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(OCCC)c(F)c2)CC1	ZINC000627041409	460729688	/nfs/dbraw/zinc/72/96/88/460729688.db2.gz	JNXYFYCNGJJHPP-UHFFFAOYSA-N	0	3	335.423	3.386	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1	ZINC000353036462	456452343	/nfs/dbraw/zinc/45/23/43/456452343.db2.gz	ZDBAFIGPHZOTJW-NQIIRXRSSA-N	0	3	344.499	3.338	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)NC[C@@H](C)N1CCC(C)CC1	ZINC000343267794	456495833	/nfs/dbraw/zinc/49/58/33/456495833.db2.gz	AYULDSNQMXYSGW-OAHLLOKOSA-N	0	3	344.459	3.199	20	30		EGEDHN
C=CCc1cc(CNC[C@@H](O)[C@@H](C)c2ccccc2)cc(OC)c1O	ZINC000657797017	462272648	/nfs/dbraw/zinc/27/26/48/462272648.db2.gz	YNXJDWILFVWZLP-HNAYVOBHSA-N	0	3	341.451	3.384	20	30		EGEDHN
C[C@@H](C(=O)N(Cc1ccc(C#N)cc1)C1CC1)N1[C@H](C)CC[C@@H]1C	ZINC000298696227	456520228	/nfs/dbraw/zinc/52/02/28/456520228.db2.gz	SREGAEFUUPBRMR-XHSDSOJGSA-N	0	3	325.456	3.311	20	30		EGEDHN
CCC(CC)(CCO)NCC(=O)N(CCC#N)c1cc(C)cc(C)c1	ZINC000282483282	456528875	/nfs/dbraw/zinc/52/88/75/456528875.db2.gz	PCEISPDRZMCXPE-UHFFFAOYSA-N	0	3	345.487	3.081	20	30		EGEDHN
C[C@H](NCc1cc(C#N)n(C)c1)[C@@H](O)c1c(Cl)cccc1Cl	ZINC000276676530	456549576	/nfs/dbraw/zinc/54/95/76/456549576.db2.gz	ZRVGYZIDEXPNBR-MGPLVRAMSA-N	0	3	338.238	3.415	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H]2CC(=O)N3CCCC[C@@H]23)cc1Cl	ZINC000337847756	456570173	/nfs/dbraw/zinc/57/01/73/456570173.db2.gz	IISLVBWISSZNMI-CVEARBPZSA-N	0	3	334.847	3.148	20	30		EGEDHN
C=CCOc1cccc(CN[C@@H]2CCO[C@@H]2c2nccn2CC)c1	ZINC000343389614	456583865	/nfs/dbraw/zinc/58/38/65/456583865.db2.gz	LHLJCYPOIVCEDG-MSOLQXFVSA-N	0	3	327.428	3.088	20	30		EGEDHN
CN(C)Cc1ccc(S(=O)(=O)Nc2cc(C#N)ccc2Cl)cc1	ZINC000340634095	456587653	/nfs/dbraw/zinc/58/76/53/456587653.db2.gz	PMLOJOIRRQRIKV-UHFFFAOYSA-N	0	3	349.843	3.074	20	30		EGEDHN
Cc1ccc(C[C@H](C)NC(=O)C(C#N)Cc2ccc(C#N)cc2)s1	ZINC000348281202	456595085	/nfs/dbraw/zinc/59/50/85/456595085.db2.gz	KERUYEDRFJFWIH-SUMWQHHRSA-N	0	3	337.448	3.358	20	30		EGEDHN
CO[C@H]1CCCC[C@@H]1NCC(=O)N(CCC#N)c1cccc(C)c1C	ZINC000276892235	456611788	/nfs/dbraw/zinc/61/17/88/456611788.db2.gz	CDHQSYZNBBBLNN-HKUYNNGSSA-N	0	3	343.471	3.097	20	30		EGEDHN
C[C@@H](NC[C@@H](O)COc1ccccc1C#N)c1ccccc1Cl	ZINC000320417413	456629948	/nfs/dbraw/zinc/62/99/48/456629948.db2.gz	RVQZYLLVFCBKHZ-UKRRQHHQSA-N	0	3	330.815	3.302	20	30		EGEDHN
N#CCc1ccc(CN2CCC[C@H](CNC(=O)c3ccccc3)C2)cc1	ZINC000343529511	456686429	/nfs/dbraw/zinc/68/64/29/456686429.db2.gz	BQCUDSXWHRJJEX-HXUWFJFHSA-N	0	3	347.462	3.395	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCC[C@@H]2OC(F)F)c(OC(F)F)c1	ZINC000348443877	456689086	/nfs/dbraw/zinc/68/90/86/456689086.db2.gz	AKMRZOQCTXRYCO-RYUDHWBXSA-N	0	3	332.297	3.410	20	30		EGEDHN
C[C@@H](NC(=O)N1CCN(C2CCC2)C[C@H](C)C1)c1ccc(C#N)cc1	ZINC000291682678	456719263	/nfs/dbraw/zinc/71/92/63/456719263.db2.gz	RLGRAOAFSQHPQS-JKSUJKDBSA-N	0	3	340.471	3.135	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)NC[C@@H](C)N1CCCC[C@@H]1C	ZINC000348571927	456772292	/nfs/dbraw/zinc/77/22/92/456772292.db2.gz	UNQCEXBIVAKVAT-DLBZAZTESA-N	0	3	345.487	3.314	20	30		EGEDHN
CCC(CC)n1nc(C)cc1C(=O)C(C#N)c1cc(C)nc(C)n1	ZINC000343795757	456774565	/nfs/dbraw/zinc/77/45/65/456774565.db2.gz	CNBPIYJGYNTTFN-OAHLLOKOSA-N	0	3	325.416	3.450	20	30		EGEDHN
Cc1nnc(NC[C@H](C(C)C)N2CCc3ccccc3C2)c(C#N)c1C	ZINC000301065254	456788148	/nfs/dbraw/zinc/78/81/48/456788148.db2.gz	CSUXHYQUXBZIPE-HXUWFJFHSA-N	0	3	349.482	3.460	20	30		EGEDHN
CN(C)[C@H](CNC(=O)C[C@@H](CC#N)c1ccccc1)c1ccccc1	ZINC000353604395	456795927	/nfs/dbraw/zinc/79/59/27/456795927.db2.gz	OQXXKFCSAKIUHA-WOJBJXKFSA-N	0	3	335.451	3.493	20	30		EGEDHN
C[C@H](NC(=O)C(C#N)CCc1ccccc1)c1c(F)cncc1F	ZINC000344148085	456801666	/nfs/dbraw/zinc/80/16/66/456801666.db2.gz	FEYZGDTZYMBIET-GXTWGEPZSA-N	0	3	329.350	3.310	20	30		EGEDHN
C[C@H](OC[C@@H]1CCCCO1)C(=O)N[C@@H]1CN(C)C[C@@H]1c1ccccc1	ZINC000329018562	456815626	/nfs/dbraw/zinc/81/56/26/456815626.db2.gz	LAVAAQAQAXQRNY-GDAAHCPNSA-N	0	3	346.471	3.015	20	30		EGEDHN
CN(C)Cc1ccccc1CNC(=O)C[C@@H](CC#N)c1ccccc1	ZINC000353656150	456834717	/nfs/dbraw/zinc/83/47/17/456834717.db2.gz	KMHUQPIVRCCKBM-GOSISDBHSA-N	0	3	335.451	3.452	20	30		EGEDHN
N#C[C@H](NC(=O)c1ccc(CN2CCCC2)cc1)c1ccccc1F	ZINC000338534076	456837316	/nfs/dbraw/zinc/83/73/16/456837316.db2.gz	CAEQGVDYYLPDRE-IBGZPJMESA-N	0	3	337.398	3.416	20	30		EGEDHN
C=CC[C@H](CO)CNCc1cc(Cl)ccc1OC[C@H]1CCCO1	ZINC000341326944	456848893	/nfs/dbraw/zinc/84/88/93/456848893.db2.gz	ZDCNSWCJQULGGF-WMLDXEAASA-N	0	3	339.863	3.172	20	30		EGEDHN
C=CC[C@@H](CO)CNCc1c(C)nn(-c2ccc(Cl)cc2)c1C	ZINC000341326873	456849411	/nfs/dbraw/zinc/84/94/11/456849411.db2.gz	YKGZKCDEUAYNTD-OAHLLOKOSA-N	0	3	333.863	3.417	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccc(OC(F)F)c(F)c2)nc(C)n1	ZINC000344725526	456852662	/nfs/dbraw/zinc/85/26/62/456852662.db2.gz	LEVJWWKAWOHASM-LLVKDONJSA-N	0	3	335.285	3.324	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1sc(CC)nc1C)C(C)C	ZINC000344790243	456859301	/nfs/dbraw/zinc/85/93/01/456859301.db2.gz	NYRCDMIGTLTGRV-OAHLLOKOSA-N	0	3	335.517	3.442	20	30		EGEDHN
C=C(C)Cn1c(C2CC2)nnc1N1CCN(C2CCC(C)CC2)CC1	ZINC000338796278	456859269	/nfs/dbraw/zinc/85/92/69/456859269.db2.gz	RMQMSTJKSSJPFT-UHFFFAOYSA-N	0	3	343.519	3.432	20	30		EGEDHN
O=C(Nc1c[nH]nc1[C@@H]1CCCN(CC2(O)CCC2)C1)C1CCCC1	ZINC000329252219	456860739	/nfs/dbraw/zinc/86/07/39/456860739.db2.gz	BVVQWCRZSMJJTM-OAHLLOKOSA-N	0	3	346.475	3.282	20	30		EGEDHN
O=C(Nc1cccc2c1OCO2)N1CCN(CC2CCCCC2)CC1	ZINC000329263379	456863533	/nfs/dbraw/zinc/86/35/33/456863533.db2.gz	BQJPOKFACQYOOH-UHFFFAOYSA-N	0	3	345.443	3.159	20	30		EGEDHN
C=C(C)Cn1c(-c2ccc(C)s2)nnc1N1CCN2CCC[C@H]2C1	ZINC000338850225	456863753	/nfs/dbraw/zinc/86/37/53/456863753.db2.gz	NRAAQLNHUSBOFM-HNNXBMFYSA-N	0	3	343.500	3.176	20	30		EGEDHN
CN(C[C@@H]1CCCN(C)C1)C(=O)Nc1csc(-c2ccccn2)n1	ZINC000329297877	456868687	/nfs/dbraw/zinc/86/86/87/456868687.db2.gz	UJBUMNYSFOWBQY-CYBMUJFWSA-N	0	3	345.472	3.024	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)NCC(C)(C)CCC#N	ZINC000341538569	456875208	/nfs/dbraw/zinc/87/52/08/456875208.db2.gz	WNLBJQOOQBKLGY-INIZCTEOSA-N	0	3	330.476	3.136	20	30		EGEDHN
CC(C#N)C(=O)N1CCC[C@H]1c1cc(F)cc(Br)c1	ZINC000345004793	456893627	/nfs/dbraw/zinc/89/36/27/456893627.db2.gz	QXSFTFFCIWGJNL-RNCFNFMXSA-N	0	3	325.181	3.411	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cc(C3CC3)n(C)n2)C1	ZINC000329615002	456916017	/nfs/dbraw/zinc/91/60/17/456916017.db2.gz	PJMQSUFWYPDWDB-RHSMWYFYSA-N	0	3	338.455	3.438	20	30		EGEDHN
Cc1cc(N2CCC([C@@H](O)C(=O)NC3CC3)CC2)c2ccccc2n1	ZINC000329707452	456929537	/nfs/dbraw/zinc/92/95/37/456929537.db2.gz	KNDOSAAHUCCLFP-LJQANCHMSA-N	0	3	339.439	3.239	20	30		EGEDHN
Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)N[C@@H]1CCN(C)[C@@H](C)C1	ZINC000329703471	456930286	/nfs/dbraw/zinc/93/02/86/456930286.db2.gz	IUJBWOOKDIXWHC-XKQJLSEDSA-N	0	3	347.507	3.340	20	30		EGEDHN
C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)c1cn(C)nc1C1CCCCC1	ZINC000329824004	456946941	/nfs/dbraw/zinc/94/69/41/456946941.db2.gz	ZTCKMMAXSKOSDJ-DYVFJYSZSA-N	0	3	330.476	3.255	20	30		EGEDHN
O=C(CCC(=O)c1ccc(Cl)cn1)N[C@@H]1CCN2CCCC[C@H]12	ZINC000329948334	456965742	/nfs/dbraw/zinc/96/57/42/456965742.db2.gz	KQOBDPAQCBOMGT-UKRRQHHQSA-N	0	3	335.835	3.281	20	30		EGEDHN
O=C(CCN1CCSC[C@H]1CCO)N[C@H]1CCCc2ccccc21	ZINC000329954891	456966232	/nfs/dbraw/zinc/96/62/32/456966232.db2.gz	OAUKOHWTFBQTTC-AEFFLSMTSA-N	0	3	348.512	3.210	20	30		EGEDHN
Cc1nccn1C[C@H](C)CNC([O-])=[NH+][C@@H]1CCOC2(CCCCC2)C1	ZINC000330234419	457009307	/nfs/dbraw/zinc/00/93/07/457009307.db2.gz	SQKMWMABGHCLIZ-NVXWUHKLSA-N	0	3	348.491	3.213	20	30		EGEDHN
C[C@@H]1C[C@@H]1N1CCN(C(=O)C[C@H](CC#N)c2ccccc2)C[C@@H](C)C1	ZINC000346133243	457019766	/nfs/dbraw/zinc/01/97/66/457019766.db2.gz	AXMKCEAGQWSOES-HNJRGHQBSA-N	0	3	339.483	3.263	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)N(CCC)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000346299865	457028779	/nfs/dbraw/zinc/02/87/79/457028779.db2.gz	KJGZWDSKTGDWCY-FPOVZHCZSA-N	0	3	344.499	3.217	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccn(Cc3ccccc3)c2)CC1	ZINC000358972050	457043580	/nfs/dbraw/zinc/04/35/80/457043580.db2.gz	GFHCLFXDOITPQC-UHFFFAOYSA-N	0	3	337.467	3.307	20	30		EGEDHN
C[C@H](c1ccccc1)N1CCC(NC(=O)N(C)C[C@H](C)C#N)CC1	ZINC000342001575	457053722	/nfs/dbraw/zinc/05/37/22/457053722.db2.gz	IXUZQBGMSXEVLB-HZPDHXFCSA-N	0	3	328.460	3.013	20	30		EGEDHN
CC(=O)Nc1cccc(NC(=O)N(C)[C@@H](C)C2CCN(C)CC2)c1C	ZINC000330705266	457073322	/nfs/dbraw/zinc/07/33/22/457073322.db2.gz	KOUQXORRKMHUEC-AWEZNQCLSA-N	0	3	346.475	3.161	20	30		EGEDHN
C=CCN(CCC#N)C(=O)[C@H](C)N1CCC(Cc2ccccc2)CC1	ZINC000359435335	457082890	/nfs/dbraw/zinc/08/28/90/457082890.db2.gz	KJVIBGDPSFHXQQ-SFHVURJKSA-N	0	3	339.483	3.258	20	30		EGEDHN
C=CCC[C@H](O)CN[C@@H](c1cncc(Br)c1)C1CC1	ZINC000342093306	457104886	/nfs/dbraw/zinc/10/48/86/457104886.db2.gz	QUPMCXHWBXGAND-LSDHHAIUSA-N	0	3	325.250	3.212	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1)OCC	ZINC000339437910	457118458	/nfs/dbraw/zinc/11/84/58/457118458.db2.gz	HWDLXLUGIPMQMJ-QRQLOZEOSA-N	0	3	330.472	3.137	20	30		EGEDHN
CC(C)(C#N)c1ccc(C(=O)NCCN2CCCC(C)(C)C2)cc1	ZINC000331047184	457124903	/nfs/dbraw/zinc/12/49/03/457124903.db2.gz	ITWSODVGGOLOSI-UHFFFAOYSA-N	0	3	327.472	3.340	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)c1ccc(C#N)s1)c1ccccc1	ZINC000362899830	457146838	/nfs/dbraw/zinc/14/68/38/457146838.db2.gz	DOWCJDJTVQMBNA-INIZCTEOSA-N	0	3	327.453	3.433	20	30		EGEDHN
N#Cc1ccc(CNCCc2cnc(SC3CCCC3)nc2)o1	ZINC000339568692	457147790	/nfs/dbraw/zinc/14/77/90/457147790.db2.gz	RJTRAFABBGEGFK-UHFFFAOYSA-N	0	3	328.441	3.308	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)c2ccccc2-c2ccccc2C#N)CCN1C	ZINC000331370821	457174657	/nfs/dbraw/zinc/17/46/57/457174657.db2.gz	GHLJJJINJLXTOY-DOTOQJQBSA-N	0	3	333.435	3.438	20	30		EGEDHN
Cc1nc(N(C)CCCN(C)Cc2ccco2)c(Cl)cc1C#N	ZINC000359967378	457176334	/nfs/dbraw/zinc/17/63/34/457176334.db2.gz	GZYQLMRXHRETJM-UHFFFAOYSA-N	0	3	332.835	3.466	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)cc1	ZINC000346827748	457180045	/nfs/dbraw/zinc/18/00/45/457180045.db2.gz	MGBQUJISXBHTNB-AWEZNQCLSA-N	0	3	343.789	3.246	20	30		EGEDHN
N#CC1(NC(=O)CN[C@H](CC2CCCC2)c2ccccc2)CCC1	ZINC000346966592	457192807	/nfs/dbraw/zinc/19/28/07/457192807.db2.gz	OMMDRRCJMIJOIS-GOSISDBHSA-N	0	3	325.456	3.460	20	30		EGEDHN
CCCN(CCN1CCCC1)C(=O)[C@@H](C#N)CCc1ccccc1	ZINC000342254991	457193377	/nfs/dbraw/zinc/19/33/77/457193377.db2.gz	UMPOQNOCKFPKIF-LJQANCHMSA-N	0	3	327.472	3.093	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)NC[C@H]1CCCSC1)C(C)C	ZINC000350745433	457204270	/nfs/dbraw/zinc/20/42/70/457204270.db2.gz	BNXRJKUICNTKQX-SJORKVTESA-N	0	3	339.549	3.127	20	30		EGEDHN
N#CC1(CCCN2C[C@H](O)C[C@H]2c2ccc(F)cc2)CCOCC1	ZINC000331579210	457211658	/nfs/dbraw/zinc/21/16/58/457211658.db2.gz	LJSCSEMLXYZJGQ-MSOLQXFVSA-N	0	3	332.419	3.034	20	30		EGEDHN
Cc1ccc(C(=O)C(C#N)c2ccncn2)cc1NC(=O)c1ccco1	ZINC000354469624	457243647	/nfs/dbraw/zinc/24/36/47/457243647.db2.gz	RJHWLUVXYSKTMC-AWEZNQCLSA-N	0	3	346.346	3.120	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cnn2ccc(C)cc12)C(C)C	ZINC000347129601	457245419	/nfs/dbraw/zinc/24/54/19/457245419.db2.gz	XWXVXTSVKBKMTN-IBGZPJMESA-N	0	3	340.471	3.071	20	30		EGEDHN
COc1ccc(C[C@H](NC(=O)C(C)C#N)c2ccccc2)cc1OC	ZINC000347131290	457246831	/nfs/dbraw/zinc/24/68/31/457246831.db2.gz	IXWXFSVQDZVRBH-PBHICJAKSA-N	0	3	338.407	3.263	20	30		EGEDHN
C=CCN(Cc1cc(Br)ccc1F)C(=O)C(C)C#N	ZINC000347134609	457249553	/nfs/dbraw/zinc/24/95/53/457249553.db2.gz	MJPRMJGRKPDTPJ-JTQLQIEISA-N	0	3	325.181	3.262	20	30		EGEDHN
C=C(C)CN(Cc1ccc(CO)o1)C(=O)[C@H](C(C)C)N1CCCCC1	ZINC000342394479	457277803	/nfs/dbraw/zinc/27/78/03/457277803.db2.gz	LBMDONPKKIJQPO-IBGZPJMESA-N	0	3	348.487	3.187	20	30		EGEDHN
C[C@H](O)C[C@@H]1CCCCCN1C(=O)C(C#N)CCc1ccccc1	ZINC000331995162	457286186	/nfs/dbraw/zinc/28/61/86/457286186.db2.gz	NDCAWCHOOQTHRU-WDSOQIARSA-N	0	3	328.456	3.301	20	30		EGEDHN
N#CCCCC(=O)N1CC[C@@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000360309555	457300414	/nfs/dbraw/zinc/30/04/14/457300414.db2.gz	IDGZHOYWHOWZIO-FQEVSTJZSA-N	0	3	325.456	3.195	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000355020578	457335808	/nfs/dbraw/zinc/33/58/08/457335808.db2.gz	XIECIVUWPOCOKJ-FQEVSTJZSA-N	0	3	343.515	3.007	20	30		EGEDHN
COc1ccccc1NC(=O)C1CCN([C@@H]2CC[C@@H](C#N)C2)CC1	ZINC000332330324	457350683	/nfs/dbraw/zinc/35/06/83/457350683.db2.gz	SIJCNXFTNIWPEM-GDBMZVCRSA-N	0	3	327.428	3.038	20	30		EGEDHN
C=C(Cl)CNC(=O)N(CC)C[C@H]1CCN(Cc2ccccc2)C1	ZINC000369742029	457377680	/nfs/dbraw/zinc/37/76/80/457377680.db2.gz	PEGFBNRMDPENDP-KRWDZBQOSA-N	0	3	335.879	3.293	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H]2C[C@H](c3cccc(F)c3)C2)CC1	ZINC000373883082	457384073	/nfs/dbraw/zinc/38/40/73/457384073.db2.gz	VUALXNLMYDERGA-RUCARUNLSA-N	0	3	345.462	3.411	20	30		EGEDHN
C#CC[C@@H](NC(=O)N1CCC[C@H]1CN1CCCCC1)c1ccccc1	ZINC000378277612	457388133	/nfs/dbraw/zinc/38/81/33/457388133.db2.gz	OIGPWMHNYYAHHT-VQTJNVASSA-N	0	3	339.483	3.411	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H](CNC(=O)c1ccc(C#N)s1)C1CC1	ZINC000357265574	457410089	/nfs/dbraw/zinc/41/00/89/457410089.db2.gz	QVNGDYVFCFKFTL-KRWDZBQOSA-N	0	3	339.464	3.260	20	30		EGEDHN
CCC(C#N)(CC)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000383380252	457424131	/nfs/dbraw/zinc/42/41/31/457424131.db2.gz	AXSFXTMKXLQCDS-GOSISDBHSA-N	0	3	327.472	3.345	20	30		EGEDHN
Cc1cccc(N2CCN(CCCCNc3cccnc3C#N)CC2)c1	ZINC000357307617	457434834	/nfs/dbraw/zinc/43/48/34/457434834.db2.gz	VCQHMVIAMDXTBR-UHFFFAOYSA-N	0	3	349.482	3.276	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN(C[C@@H]1CCCO1)C1CCC(C)CC1	ZINC000347527486	457486139	/nfs/dbraw/zinc/48/61/39/457486139.db2.gz	RTJJAOHBQPXOEN-JEVOJNTISA-N	0	3	349.519	3.054	20	30		EGEDHN
COC[C@H]1CCCCN([C@@H](C)C(=O)Nc2ccc(C#N)c(Cl)c2)C1	ZINC000342743651	457493037	/nfs/dbraw/zinc/49/30/37/457493037.db2.gz	QHZNUPLLHUEEHL-KBPBESRZSA-N	0	3	349.862	3.287	20	30		EGEDHN
N#Cc1c[nH]c(C(=O)N2CC[C@]3(C2)CCCN(Cc2ccccc2)C3)c1	ZINC000370046027	457516763	/nfs/dbraw/zinc/51/67/63/457516763.db2.gz	IEBCSKRDXUABAX-OAQYLSRUSA-N	0	3	348.450	3.015	20	30		EGEDHN
C#CCCCNC(=O)N1CC[C@@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000370055280	457519323	/nfs/dbraw/zinc/51/93/23/457519323.db2.gz	HYCAUVJADXQCCI-NRFANRHFSA-N	0	3	339.483	3.098	20	30		EGEDHN
C[C@H](CC#N)N(C)C(=O)[C@@H](C)N1CCC(Cc2ccccc2)CC1	ZINC000347623370	457555606	/nfs/dbraw/zinc/55/56/06/457555606.db2.gz	XRZTVBVULBNQCH-IAGOWNOFSA-N	0	3	327.472	3.090	20	30		EGEDHN
COc1cc(C#N)ccc1CN1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1	ZINC000425504329	457579955	/nfs/dbraw/zinc/57/99/55/457579955.db2.gz	VQZJMDPUQNXGSO-PZJWPPBQSA-N	0	3	347.462	3.273	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N(C)C[C@H](O)COc1ccccc1F	ZINC000425544354	457592915	/nfs/dbraw/zinc/59/29/15/457592915.db2.gz	SKPAZSUIIRPBIC-YOEHRIQHSA-N	0	3	328.387	3.130	20	30		EGEDHN
C=C(C)CN1CCC(N[C@@H](C)c2nnn(-c3ccccc3)c2C)CC1	ZINC000361215017	457648428	/nfs/dbraw/zinc/64/84/28/457648428.db2.gz	HNOGODSNVNZGIQ-INIZCTEOSA-N	0	3	339.487	3.267	20	30		EGEDHN
CO[C@@H]1CCCN([C@@H](C)C(=O)N(CCC#N)c2ccc(C)cc2)CC1	ZINC000374696415	457688835	/nfs/dbraw/zinc/68/88/35/457688835.db2.gz	XKPQOHIAVKJWSX-PKOBYXMFSA-N	0	3	343.471	3.131	20	30		EGEDHN
C#CCCOc1ccc(CN2CCC(C)(c3nc(C)no3)CC2)cc1	ZINC000374725966	457695126	/nfs/dbraw/zinc/69/51/26/457695126.db2.gz	LIVJOZIHYFUJLL-UHFFFAOYSA-N	0	3	339.439	3.334	20	30		EGEDHN
C=CCN1CCC(NC(=O)CCc2ccc(-c3ccccc3)[nH]2)CC1	ZINC000357825655	457702630	/nfs/dbraw/zinc/70/26/30/457702630.db2.gz	AKWFKTUCBUYESW-UHFFFAOYSA-N	0	3	337.467	3.381	20	30		EGEDHN
C=C[C@@H]1CCCCN1C(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1	ZINC000426062482	457767435	/nfs/dbraw/zinc/76/74/35/457767435.db2.gz	QDHOSGHFSIIBKM-NZSAHSFTSA-N	0	3	327.472	3.400	20	30		EGEDHN
CC(C)Oc1ccc(CNC(=O)C(C#N)CCc2ccccc2)cn1	ZINC000433219118	457782352	/nfs/dbraw/zinc/78/23/52/457782352.db2.gz	LEBXXIFUBSYWAI-SFHVURJKSA-N	0	3	337.423	3.258	20	30		EGEDHN
N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)C1CCN(C2CC2)CC1	ZINC000365927866	457784776	/nfs/dbraw/zinc/78/47/76/457784776.db2.gz	BGMIFHSGFDKXPM-VQTJNVASSA-N	0	3	337.467	3.159	20	30		EGEDHN
Cc1ccc([C@@H](CNC(=O)[C@@H](C#N)CCc2ccccc2)N(C)C)cc1	ZINC000433305244	457804182	/nfs/dbraw/zinc/80/41/82/457804182.db2.gz	PKFXKGUUXLWKKV-NHCUHLMSSA-N	0	3	349.478	3.487	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCCc1c(F)cccc1F	ZINC000433322282	457809840	/nfs/dbraw/zinc/80/98/40/457809840.db2.gz	ZRNGLPMQERBKAG-OAHLLOKOSA-N	0	3	328.362	3.396	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC2(C[C@@H]2NCc2ccc(C#N)cc2)CC1	ZINC000366474741	457820139	/nfs/dbraw/zinc/82/01/39/457820139.db2.gz	OSJGIGKAHFWXHB-KRWDZBQOSA-N	0	3	341.455	3.437	20	30		EGEDHN
CCc1noc(CC)c1CNC(=O)C(C#N)CCc1ccccc1	ZINC000433374779	457825188	/nfs/dbraw/zinc/82/51/88/457825188.db2.gz	WIBAXJGYACFRAS-OAHLLOKOSA-N	0	3	325.412	3.188	20	30		EGEDHN
CCC1(CC)[C@H](NC(=O)C(C#N)CCc2ccccc2)C[C@H]1OC	ZINC000433381722	457826844	/nfs/dbraw/zinc/82/68/44/457826844.db2.gz	LHUFUNTZEOELNB-KZNAEPCWSA-N	0	3	328.456	3.469	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CCC(NC(=O)NCC2(CC#N)CC2)CC1	ZINC000366626005	457872253	/nfs/dbraw/zinc/87/22/53/457872253.db2.gz	LFDSMMKRGDVCOV-INIZCTEOSA-N	0	3	340.471	3.205	20	30		EGEDHN
CC[C@@H](N[C@H](C)CCC#N)c1ccccc1OCC(=O)N1CCCC1	ZINC000411457652	457892832	/nfs/dbraw/zinc/89/28/32/457892832.db2.gz	WOOUQPMJOOHTLB-SJLPKXTDSA-N	0	3	343.471	3.421	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1)OCC	ZINC000366823106	457902681	/nfs/dbraw/zinc/90/26/81/457902681.db2.gz	DJPPQUIBJJCTSE-WOJBJXKFSA-N	0	3	344.499	3.386	20	30		EGEDHN
CC(C)(C)OC(=O)CCCCN1CCC(C#N)(c2ccccn2)CC1	ZINC000367067032	457926048	/nfs/dbraw/zinc/92/60/48/457926048.db2.gz	PTXRMUBRMVAKEY-UHFFFAOYSA-N	0	3	343.471	3.451	20	30		EGEDHN
C=CCN(C)CCN(CC)[C@@H](C)c1nc(Cc2ccc(F)cc2)no1	ZINC000411639303	457936901	/nfs/dbraw/zinc/93/69/01/457936901.db2.gz	IVJVSFUWHOBQLV-HNNXBMFYSA-N	0	3	346.450	3.300	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Nc1cccc2c1CCO2)C(C)C	ZINC000434230059	457962722	/nfs/dbraw/zinc/96/27/22/457962722.db2.gz	VLBBDFSQUHQWFN-GOSISDBHSA-N	0	3	343.471	3.442	20	30		EGEDHN
CC(C)N(Cc1ccc(F)c(C#N)c1)C[C@@H](O)COc1ccccc1	ZINC000444817497	457984735	/nfs/dbraw/zinc/98/47/35/457984735.db2.gz	VCIYZHXNYACFBY-GOSISDBHSA-N	0	3	342.414	3.348	20	30		EGEDHN
N#CCCN(CC1CC1)C(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000371565741	457991507	/nfs/dbraw/zinc/99/15/07/457991507.db2.gz	UEQVFAAYXMANMD-SFHVURJKSA-N	0	3	343.446	3.190	20	30		EGEDHN
Cc1cccc2c1OC[C@H](NC(=O)C(C#N)CCc1ccccc1)C2	ZINC000427987122	458061834	/nfs/dbraw/zinc/06/18/34/458061834.db2.gz	JIHCAAWUYYVJMS-RBUKOAKNSA-N	0	3	334.419	3.187	20	30		EGEDHN
C=CCC[C@@H](N[C@@H]1CCN(c2ccccc2C(N)=O)C1)c1ccco1	ZINC000375789144	458064434	/nfs/dbraw/zinc/06/44/34/458064434.db2.gz	KJARUKQBQDATKQ-NVXWUHKLSA-N	0	3	339.439	3.254	20	30		EGEDHN
CC(C)C[C@H](CN[C@@H](C)c1ccc(C#N)cc1F)N1CCOCC1	ZINC000358582875	458090730	/nfs/dbraw/zinc/09/07/30/458090730.db2.gz	FSUBIDGGHRGVCT-DOTOQJQBSA-N	0	3	333.451	3.095	20	30		EGEDHN
C=CCC[C@H](NC(=O)N[C@@H]1CN(C2CC2)C[C@@H]1C)c1ccccc1	ZINC000435098850	458092504	/nfs/dbraw/zinc/09/25/04/458092504.db2.gz	OCIYKKBZQCCQRB-ZYSHUDEJSA-N	0	3	327.472	3.476	20	30		EGEDHN
C=CC[C@@H](C)NC(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000358629274	458117095	/nfs/dbraw/zinc/11/70/95/458117095.db2.gz	TUSWVINDIQTRCP-QAPCUYQASA-N	0	3	333.476	3.340	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1	ZINC000371925889	458124721	/nfs/dbraw/zinc/12/47/21/458124721.db2.gz	CQVUKSPQRFSVPV-ROUUACIJSA-N	0	3	348.531	3.493	20	30		EGEDHN
CCN1CCC(NC(=O)c2cn(CCCC#N)c3ccccc23)CC1	ZINC000435704408	458188820	/nfs/dbraw/zinc/18/88/20/458188820.db2.gz	HGKIZHRXPVKPSF-UHFFFAOYSA-N	0	3	338.455	3.159	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1CNCc1cc(O)ccc1Br	ZINC000435742308	458194739	/nfs/dbraw/zinc/19/47/39/458194739.db2.gz	NCFIKUUSAIWQSW-XHDPSFHLSA-N	0	3	326.234	3.226	20	30		EGEDHN
CCN(CCC#N)C(=O)CN(CCc1cccc(F)c1)C1CCCC1	ZINC000362487173	458211098	/nfs/dbraw/zinc/21/10/98/458211098.db2.gz	UCQXXCMTFYBCPP-UHFFFAOYSA-N	0	3	345.462	3.375	20	30		EGEDHN
CN(CCC#N)C(=O)CCN1CCC(=Cc2ccc(F)c(F)c2)CC1	ZINC000372205293	458232681	/nfs/dbraw/zinc/23/26/81/458232681.db2.gz	MVSWXIPORRHTOY-UHFFFAOYSA-N	0	3	347.409	3.206	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2Cc3cccc(O)c3C2)c(OC(F)F)c1	ZINC000429228355	458294323	/nfs/dbraw/zinc/29/43/23/458294323.db2.gz	REXMVSAJAZOUQD-CQSZACIVSA-N	0	3	330.334	3.122	20	30		EGEDHN
CN(C)C[C@H](NC(=O)NCC(C)(C)CC#N)c1ccc(Cl)cc1	ZINC000459234926	458297325	/nfs/dbraw/zinc/29/73/25/458297325.db2.gz	KDSOYWWDYVKSQH-HNNXBMFYSA-N	0	3	336.867	3.182	20	30		EGEDHN
CN(C)CCN(Cc1ccsc1)c1ccc(C#N)cc1[N+](=O)[O-]	ZINC000413451485	458301528	/nfs/dbraw/zinc/30/15/28/458301528.db2.gz	KPJUDKNVSNTBOX-UHFFFAOYSA-N	0	3	330.413	3.096	20	30		EGEDHN
C[C@H](C#N)CSc1ccccc1NC(=O)N1C[C@H](C)NC[C@@H]1C	ZINC000415152869	458328793	/nfs/dbraw/zinc/32/87/93/458328793.db2.gz	CGRZJNCCSOXZKK-RDBSUJKOSA-N	0	3	332.473	3.152	20	30		EGEDHN
N#C[C@@H](NC(=O)C12CCCN1CCC2)c1ccc(Cl)c(Cl)c1	ZINC000415378354	458332068	/nfs/dbraw/zinc/33/20/68/458332068.db2.gz	NEEQILAFCPSHTE-CQSZACIVSA-N	0	3	338.238	3.303	20	30		EGEDHN
C=C(C)CN(Cc1ccc(CO)o1)C(=O)Nc1cccc(CNC)c1	ZINC000415933819	458335038	/nfs/dbraw/zinc/33/50/38/458335038.db2.gz	QGTOCDPEJPTREO-UHFFFAOYSA-N	0	3	343.427	3.102	20	30		EGEDHN
N#CCC[C@@H](NC(=O)Nc1ccc2c(c1)CNCC2)c1ccccc1	ZINC000415901930	458335181	/nfs/dbraw/zinc/33/51/81/458335181.db2.gz	VGHAZRCUNJVBTI-LJQANCHMSA-N	0	3	334.423	3.499	20	30		EGEDHN
N#CCCN(CC1CC1)C(=O)Nc1cc(CN)cc(C(F)(F)F)c1	ZINC000415953646	458335312	/nfs/dbraw/zinc/33/53/12/458335312.db2.gz	IXQOETRSAXUYSB-UHFFFAOYSA-N	0	3	340.349	3.322	20	30		EGEDHN
CC(C)(CC#N)CNC(=O)Nc1cc(CN)cc(C(F)(F)F)c1	ZINC000415974103	458335780	/nfs/dbraw/zinc/33/57/80/458335780.db2.gz	RJAVZBRFCQZYBI-UHFFFAOYSA-N	0	3	328.338	3.225	20	30		EGEDHN
CN(CCCNC(=O)C1CCC1)Cc1ccccc1C(C)(C)C#N	ZINC000429557308	458345454	/nfs/dbraw/zinc/34/54/54/458345454.db2.gz	QSXWZIPWOXSMTR-UHFFFAOYSA-N	0	3	327.472	3.226	20	30		EGEDHN
C[C@@H](CN1CCCCC1)NC(=O)N[C@@H]1CCCc2cc(C#N)ccc21	ZINC000416684970	458352654	/nfs/dbraw/zinc/35/26/54/458352654.db2.gz	MCIGDBUDRFZGSR-HNAYVOBHSA-N	0	3	340.471	3.109	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)c1c[nH]c(C(F)(F)F)c1	ZINC000429671321	458355883	/nfs/dbraw/zinc/35/58/83/458355883.db2.gz	KEAGVTNUTHCIJI-JTQLQIEISA-N	0	3	332.285	3.410	20	30		EGEDHN
CC(C)c1ccc([C@H](N)CNC(=O)NCc2cccc(C#N)c2)cc1	ZINC000416993272	458358724	/nfs/dbraw/zinc/35/87/24/458358724.db2.gz	MGTIRCCVQFCURH-LJQANCHMSA-N	0	3	336.439	3.181	20	30		EGEDHN
CN(C[C@H]1CCCN1C)C(=O)Nc1cccc(C#Cc2ccccn2)c1	ZINC000421058741	458407456	/nfs/dbraw/zinc/40/74/56/458407456.db2.gz	MTFLWDJKOWMSAE-HXUWFJFHSA-N	0	3	348.450	3.039	20	30		EGEDHN
N#CCCn1cc(CN2C[C@H](C3CC3)[C@H]2C2CC2)c(-c2ccncc2)n1	ZINC000449543140	458425903	/nfs/dbraw/zinc/42/59/03/458425903.db2.gz	SEPNDFOETNTRPW-TZIWHRDSSA-N	0	3	347.466	3.479	20	30		EGEDHN
C[C@H](NC(=O)NCc1ccc(C#N)s1)[C@H](c1ccccc1)N(C)C	ZINC000422213433	458426239	/nfs/dbraw/zinc/42/62/39/458426239.db2.gz	YHUJVJNAFMNDBV-SUMWQHHRSA-N	0	3	342.468	3.110	20	30		EGEDHN
C=CCc1cc(C(=O)Nc2ccc3c(c2)CNC3)cc(OC)c1OC	ZINC000449668697	458428650	/nfs/dbraw/zinc/42/86/50/458428650.db2.gz	UISALMCISOUYBS-UHFFFAOYSA-N	0	3	338.407	3.288	20	30		EGEDHN
C[C@@H](CCCc1cccnc1)N[C@@H](C)C(=O)Nc1cccc(C#N)c1	ZINC000459631140	458431198	/nfs/dbraw/zinc/43/11/98/458431198.db2.gz	BPDOHRGUBJCIPT-HOTGVXAUSA-N	0	3	336.439	3.281	20	30		EGEDHN
C=CCC1(C(=O)NCCc2ccc(OCCN(C)C)cc2)CCCC1	ZINC000449839905	458432415	/nfs/dbraw/zinc/43/24/15/458432415.db2.gz	DQLUHUIBMCLHJV-UHFFFAOYSA-N	0	3	344.499	3.422	20	30		EGEDHN
C=CCc1cc(CN2CCC[C@@H](c3nccn3C)C2)cc(OC)c1O	ZINC000373227095	458436816	/nfs/dbraw/zinc/43/68/16/458436816.db2.gz	JETOYJCMKRUKOF-QGZVFWFLSA-N	0	3	341.455	3.242	20	30		EGEDHN
CC(C)(CC#N)CNCc1cc2c(c(Br)c1)OCO2	ZINC000459701526	458451529	/nfs/dbraw/zinc/45/15/29/458451529.db2.gz	TTXAGCXCHMJIDA-UHFFFAOYSA-N	0	3	325.206	3.207	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCC(=O)N[C@H](C)c1ccc(Cl)cc1Cl	ZINC000451605868	458482636	/nfs/dbraw/zinc/48/26/36/458482636.db2.gz	KTSKKPTVPCCFKC-KMUNFCNLSA-N	0	3	343.254	3.104	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1N[C@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O	ZINC000451607898	458483316	/nfs/dbraw/zinc/48/33/16/458483316.db2.gz	LYPFGRRCBFAZDM-ILXRZTDVSA-N	0	3	341.238	3.032	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NC[C@@H](CC)N1CCc2ccccc2C1	ZINC000437727412	458486510	/nfs/dbraw/zinc/48/65/10/458486510.db2.gz	QBGNIOKFQFCKBW-TZIWHRDSSA-N	0	3	344.499	3.168	20	30		EGEDHN
C[C@@H](c1ccc(C#N)c(F)c1)N1C[C@H]2C[C@H](Cn3c(=O)cccc32)C1	ZINC000453290719	458522528	/nfs/dbraw/zinc/52/25/28/458522528.db2.gz	USSYYKAGSKZGQY-GRDNDAEWSA-N	0	3	337.398	3.039	20	30		EGEDHN
C=CCn1c(Cc2ccsc2)nnc1N1CCCN(C(C)C)CC1	ZINC000453423778	458527932	/nfs/dbraw/zinc/52/79/32/458527932.db2.gz	FTYZWMVWHYIDPF-UHFFFAOYSA-N	0	3	345.516	3.037	20	30		EGEDHN
C=C(C)Cn1c(C(C)C)nnc1N1CCN([C@@H]2C[C@H]2C)C[C@H](C)C1	ZINC000453453120	458531862	/nfs/dbraw/zinc/53/18/62/458531862.db2.gz	NFUKVDIUUNLTJH-GVDBMIGSSA-N	0	3	331.508	3.144	20	30		EGEDHN
C[C@@]1(CO)CCC[C@@H]1NCC#Cc1ccc(OC(F)(F)F)cc1	ZINC000493711165	458541861	/nfs/dbraw/zinc/54/18/61/458541861.db2.gz	UANVLBWCQWLBNB-HOTGVXAUSA-N	0	3	327.346	3.077	20	30		EGEDHN
COc1ccc([C@@H]2CCCCCN2C(=O)[C@@H](N)CCCC#N)cc1	ZINC000424062540	458549376	/nfs/dbraw/zinc/54/93/76/458549376.db2.gz	LCESAGPZCFWPAT-ROUUACIJSA-N	0	3	329.444	3.160	20	30		EGEDHN
COc1ccc([C@@H]2CCCCCN2C(=O)[C@H](N)CCCC#N)cc1	ZINC000424062533	458549716	/nfs/dbraw/zinc/54/97/16/458549716.db2.gz	LCESAGPZCFWPAT-MSOLQXFVSA-N	0	3	329.444	3.160	20	30		EGEDHN
CCCOc1ccc(C(F)(F)F)cc1NC(=O)[C@H](N)CCCC#N	ZINC000424080688	458553263	/nfs/dbraw/zinc/55/32/63/458553263.db2.gz	TYGFINURWIVTGU-GFCCVEGCSA-N	0	3	343.349	3.454	20	30		EGEDHN
CCN(C(=O)[C@H](N)CCCC#N)[C@H](Cc1ccc(F)cc1)C(C)C	ZINC000424122264	458562919	/nfs/dbraw/zinc/56/29/19/458562919.db2.gz	IRCFCHICOIWQEV-QZTJIDSGSA-N	0	3	333.451	3.262	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1ccc(Cl)cc1OCC(F)(F)F	ZINC000424144950	458570794	/nfs/dbraw/zinc/57/07/94/458570794.db2.gz	TZSJIDBQMJMLMD-JTQLQIEISA-N	0	3	349.740	3.241	20	30		EGEDHN
Cc1cccc(C)c1OC[C@H](NC(=O)[C@H](N)CCCC#N)C(C)(C)C	ZINC000424145872	458570802	/nfs/dbraw/zinc/57/08/02/458570802.db2.gz	ZTNWCXUFUFECDA-SJORKVTESA-N	0	3	345.487	3.234	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1ccc(OCC(F)(F)F)c(Cl)c1	ZINC000424163977	458574723	/nfs/dbraw/zinc/57/47/23/458574723.db2.gz	BERDGRBKMVIICX-NSHDSACASA-N	0	3	349.740	3.241	20	30		EGEDHN
CC[C@H](CSc1ccc(C)c(C)c1)NC(=O)[C@@H](N)CCCC#N	ZINC000424177428	458577923	/nfs/dbraw/zinc/57/79/23/458577923.db2.gz	UHCMIKZFMAECRE-WBVHZDCISA-N	0	3	333.501	3.312	20	30		EGEDHN
CN(Cc1ccccc1NC(=O)[C@@H](N)CCCC#N)c1ccccc1	ZINC000424177999	458578922	/nfs/dbraw/zinc/57/89/22/458578922.db2.gz	VTEOBDQFOWZLNS-SFHVURJKSA-N	0	3	336.439	3.283	20	30		EGEDHN
CCN1CCCC[C@@H]1CNC(=O)C(C)(C)Cc1ccc(C#N)cc1	ZINC000455620644	458604575	/nfs/dbraw/zinc/60/45/75/458604575.db2.gz	KUFRXURTGZJLHX-GOSISDBHSA-N	0	3	327.472	3.118	20	30		EGEDHN
C[C@@H](C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(C#N)c1	ZINC000462260668	458608190	/nfs/dbraw/zinc/60/81/90/458608190.db2.gz	TVQWPZOIRPWIMK-DYESRHJHSA-N	0	3	347.462	3.395	20	30		EGEDHN
C[C@H](C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C)c1cccc(C#N)c1	ZINC000462502343	458627489	/nfs/dbraw/zinc/62/74/89/458627489.db2.gz	OMELMVGYCKXOFG-LLGFUMIMSA-N	0	3	347.462	3.298	20	30		EGEDHN
CN(C)C1(CN(C)C(=O)C(C)(C)Cc2ccc(C#N)cc2)CCC1	ZINC000456015164	458627568	/nfs/dbraw/zinc/62/75/68/458627568.db2.gz	BNDJRBHLGQZMNR-UHFFFAOYSA-N	0	3	327.472	3.070	20	30		EGEDHN
CC(C)(Cc1ccc(C#N)cc1)C(=O)NCCN1CCCC(C)(C)C1	ZINC000456039877	458629525	/nfs/dbraw/zinc/62/95/25/458629525.db2.gz	NCUATOYMLPCDJW-UHFFFAOYSA-N	0	3	341.499	3.365	20	30		EGEDHN
COc1ncc(CNC(=O)C(C#N)CCc2ccccc2)cc1Cl	ZINC000456098219	458631608	/nfs/dbraw/zinc/63/16/08/458631608.db2.gz	NQHQLLNFVZLCAT-HNNXBMFYSA-N	0	3	343.814	3.132	20	30		EGEDHN
Cc1c(C#N)cccc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000432259842	458707138	/nfs/dbraw/zinc/70/71/38/458707138.db2.gz	VBGFVMPYTNVJRF-GOSISDBHSA-N	0	3	334.423	3.263	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)NCc1ccccc1C)C(C)C	ZINC000503406848	458707398	/nfs/dbraw/zinc/70/73/98/458707398.db2.gz	NRZOWTHKGZXWDY-IBGZPJMESA-N	0	3	329.488	3.493	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)NCc1ccccc1F)C(C)C	ZINC000503443731	458708050	/nfs/dbraw/zinc/70/80/50/458708050.db2.gz	YTCHFGAWDFMGHG-GOSISDBHSA-N	0	3	333.451	3.324	20	30		EGEDHN
C[C@@H](C(=O)N(CCN(C)C)C1CCCCC1)c1cccc(C#N)c1	ZINC000463677248	458714542	/nfs/dbraw/zinc/71/45/42/458714542.db2.gz	GJFGLZVZSYCTGR-MRXNPFEDSA-N	0	3	327.472	3.385	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@]2(C)CCCc3ccccc32)CC1	ZINC000547312067	458718276	/nfs/dbraw/zinc/71/82/76/458718276.db2.gz	FYCQMESFEJLDOU-FQEVSTJZSA-N	0	3	327.472	3.188	20	30		EGEDHN
CC(C)Oc1ccc(C#N)cc1NC(=O)NCCN1CCCCCC1	ZINC000505690618	458746164	/nfs/dbraw/zinc/74/61/64/458746164.db2.gz	UCNNYDIFGQRUMK-UHFFFAOYSA-N	0	3	344.459	3.343	20	30		EGEDHN
Cc1cc([C@H](N[C@@H](C)C(=O)NC2(C#N)CCC2)C2CC2)ccc1F	ZINC000530337019	458749833	/nfs/dbraw/zinc/74/98/33/458749833.db2.gz	ZYJJSCRWZVFAPC-SUMWQHHRSA-N	0	3	329.419	3.126	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)cc1)Cc1ccc2c(c1)oc(=O)n2C	ZINC000507245222	458754141	/nfs/dbraw/zinc/75/41/41/458754141.db2.gz	XDNALXGWKZKGLA-UHFFFAOYSA-N	0	3	335.407	3.414	20	30		EGEDHN
C=CCOc1cccc(NC(=O)N[C@@H](C)CN2CCC[C@H](C)C2)c1	ZINC000510954713	458777235	/nfs/dbraw/zinc/77/72/35/458777235.db2.gz	YETYTFBMZBMINA-HOTGVXAUSA-N	0	3	331.460	3.493	20	30		EGEDHN
CN(CCc1nc(-c2ccccc2)no1)Cc1ccc(F)c(C#N)c1	ZINC000512193507	458782730	/nfs/dbraw/zinc/78/27/30/458782730.db2.gz	ICSQFURUJCYBPI-UHFFFAOYSA-N	0	3	336.370	3.422	20	30		EGEDHN
C=C(CNC(=O)N1CCN(C2CCCCC2)CC1)c1ccccc1	ZINC000512685074	458788400	/nfs/dbraw/zinc/78/84/00/458788400.db2.gz	MYYFNIBAGGSLNJ-UHFFFAOYSA-N	0	3	327.472	3.360	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN(C)CCN(C)C(=O)OC(C)(C)C)cc1	ZINC000495188882	458808761	/nfs/dbraw/zinc/80/87/61/458808761.db2.gz	KHPXKXXTJFDIRG-HNNXBMFYSA-N	0	3	347.459	3.276	20	30		EGEDHN
CC(C)CC[C@@H]1CCCCN1CC(=O)NCc1cccc(C#N)c1	ZINC000472815251	458808827	/nfs/dbraw/zinc/80/88/27/458808827.db2.gz	YCEZWWUSXASWPA-IBGZPJMESA-N	0	3	327.472	3.465	20	30		EGEDHN
CN(CC(=O)N[C@](C)(C#N)C1CC1)[C@H]1CCCC[C@@H]1c1ccccc1	ZINC000516417114	458817094	/nfs/dbraw/zinc/81/70/94/458817094.db2.gz	XPPRZDOJMYLEFP-SVFBPWRDSA-N	0	3	339.483	3.453	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1N[C@H](C)C(=O)N[C@@H](C)c1ccc2ccccc2c1	ZINC000517217290	458826659	/nfs/dbraw/zinc/82/66/59/458826659.db2.gz	JDIGASDWCHFFIA-BWMZKYQQSA-N	0	3	338.451	3.339	20	30		EGEDHN
Cc1ccc(C#N)cc1NC(=O)[C@H]1CCCN(Cc2cccnc2)C1	ZINC000530844801	458834777	/nfs/dbraw/zinc/83/47/77/458834777.db2.gz	SZKOLBJJQIGDSJ-SFHVURJKSA-N	0	3	334.423	3.112	20	30		EGEDHN
COc1cc(CN[C@H](C)COc2ccc(F)cc2F)ccc1C#N	ZINC000440808942	458855328	/nfs/dbraw/zinc/85/53/28/458855328.db2.gz	NJJRSKCRRYCVHR-GFCCVEGCSA-N	0	3	332.350	3.402	20	30		EGEDHN
CC(C)[C@@H](Cc1ccc(F)cc1)NCC(=O)Nc1cccc(C#N)c1	ZINC000495515079	458873133	/nfs/dbraw/zinc/87/31/33/458873133.db2.gz	JYPOTFWBPNSXIZ-LJQANCHMSA-N	0	3	339.414	3.493	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)Cc2ccc(CC)cc2)CC1	ZINC000518511048	458873282	/nfs/dbraw/zinc/87/32/82/458873282.db2.gz	QZZALRBTDUMPKS-UHFFFAOYSA-N	0	3	329.488	3.431	20	30		EGEDHN
C=C(C)Cn1c([C@@H](C)CC)nnc1N1CC[C@H](N2CCCCC2)C1	ZINC000549693017	458883826	/nfs/dbraw/zinc/88/38/26/458883826.db2.gz	LQDACGJKWLFRSS-IRXDYDNUSA-N	0	3	331.508	3.432	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1ccc(C#N)cc1F)NC(=O)OC(C)(C)C	ZINC000495691158	458922018	/nfs/dbraw/zinc/92/20/18/458922018.db2.gz	PZWNPINXLUGLJC-QWHCGFSZSA-N	0	3	335.423	3.479	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(OCC(C)C)cc2)CC1	ZINC000519270364	458929672	/nfs/dbraw/zinc/92/96/72/458929672.db2.gz	JHTBWUMPJUMUEB-UHFFFAOYSA-N	0	3	330.472	3.492	20	30		EGEDHN
CO[C@H](Cc1ccccc1)CN1CCC(C#N)(c2ccccn2)CC1	ZINC000519625238	458977121	/nfs/dbraw/zinc/97/71/21/458977121.db2.gz	OZJGEKHUWHWZQK-LJQANCHMSA-N	0	3	335.451	3.196	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N[C@H]1CCCN(C)[C@H]1C)c1ccc(F)c(F)c1	ZINC000477195718	459035003	/nfs/dbraw/zinc/03/50/03/459035003.db2.gz	VXXZIZFHMQFWBO-ZLIFDBKOSA-N	0	3	337.414	3.364	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@@H](C)N[C@H](c1ccc(OC)cc1)C1CC1	ZINC000477336372	459040782	/nfs/dbraw/zinc/04/07/82/459040782.db2.gz	HHOAIHSEHUVLTG-BEFAXECRSA-N	0	3	328.456	3.325	20	30		EGEDHN
CCOC(=O)c1csc(C(C#N)C(=O)c2ccc(OC)cc2C)n1	ZINC000442811029	459040783	/nfs/dbraw/zinc/04/07/83/459040783.db2.gz	BMRVYNUPAHUTPV-CYBMUJFWSA-N	0	3	344.392	3.127	20	30		EGEDHN
CCC1(CC)[C@H](N[C@H](C)C(=O)NC2(C#N)CCCCC2)[C@H](C)[C@@H]1OC	ZINC000557127539	459050764	/nfs/dbraw/zinc/05/07/64/459050764.db2.gz	QKIUHMIIDKSSPM-HZMVEIRTSA-N	0	3	349.519	3.147	20	30		EGEDHN
CC(C)c1cc(NC(=O)[C@@H](N)CCCC#N)n(Cc2ccccc2)n1	ZINC000594456956	459053317	/nfs/dbraw/zinc/05/33/17/459053317.db2.gz	TVAVKTJCUSWTDC-INIZCTEOSA-N	0	3	339.443	3.014	20	30		EGEDHN
Cc1cc(C)cc(OCCN2CC[C@H](Oc3ccc(C#N)cn3)C2)c1	ZINC000590005486	459064742	/nfs/dbraw/zinc/06/47/42/459064742.db2.gz	JAMOMNJAVMXWEG-SFHVURJKSA-N	0	3	337.423	3.102	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2N[C@H]1CCc2ccccc2NC1=O	ZINC000594510348	459069723	/nfs/dbraw/zinc/06/97/23/459069723.db2.gz	IXCNWZCGXNLUKM-PMACEKPBSA-N	0	3	331.419	3.479	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCN(Cc3nccc4ccccc43)C2)nc1	ZINC000590053359	459074024	/nfs/dbraw/zinc/07/40/24/459074024.db2.gz	SUSQTTXHOQQEHZ-QGZVFWFLSA-N	0	3	330.391	3.155	20	30		EGEDHN
Cc1csc(NC(=O)NC[C@@H](c2ccccc2)N(C)C)c1C#N	ZINC000577765738	459092085	/nfs/dbraw/zinc/09/20/85/459092085.db2.gz	KZLFNJSQGCBDHA-HNNXBMFYSA-N	0	3	328.441	3.353	20	30		EGEDHN
C[C@H]1CN(C(=O)c2ccc(C#N)c(Cl)c2)CCN(C2CCC2)C1	ZINC000557835364	459112481	/nfs/dbraw/zinc/11/24/81/459112481.db2.gz	AYVZDZSYNNBWAJ-CYBMUJFWSA-N	0	3	331.847	3.158	20	30		EGEDHN
CC[C@@H](C)N[C@H](CNC(=O)N1CCC(CC#N)CC1)c1ccco1	ZINC000557832047	459112528	/nfs/dbraw/zinc/11/25/28/459112528.db2.gz	PFZPGQNTQOHUEH-GDBMZVCRSA-N	0	3	332.448	3.044	20	30		EGEDHN
CS[C@@H]1CN(c2c(C#N)cnc3c(Cl)cccc32)C[C@@H]1N(C)C	ZINC000567749118	459160370	/nfs/dbraw/zinc/16/03/70/459160370.db2.gz	UTEIFRUBQJSQBE-LSDHHAIUSA-N	0	3	346.887	3.242	20	30		EGEDHN
C[C@@H](C(=O)Nc1cccc(C#N)c1)N1CC[C@@H](Cc2ccccc2)C1	ZINC000532971122	459168306	/nfs/dbraw/zinc/16/83/06/459168306.db2.gz	ACLOUUKIVKVZIK-LPHOPBHVSA-N	0	3	333.435	3.450	20	30		EGEDHN
Cc1ccccc1[C@@H]1C[C@@H](C)N([C@@H](C(N)=O)c2ccc(C#N)cc2)C1	ZINC000532976858	459170378	/nfs/dbraw/zinc/17/03/78/459170378.db2.gz	NPDAWDYVPUBIKA-XFQXTVEOSA-N	0	3	333.435	3.271	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)N(CC)C[C@@H]1CCCN1CC	ZINC000578390765	459193464	/nfs/dbraw/zinc/19/34/64/459193464.db2.gz	NYJLWKGOFXKPHW-INIZCTEOSA-N	0	3	346.471	3.206	20	30		EGEDHN
CO[C@](C)(CNCc1ccc(C#N)c(F)c1)COCc1ccccc1	ZINC000594975936	459202181	/nfs/dbraw/zinc/20/21/81/459202181.db2.gz	XMINABKDMHKFLF-HXUWFJFHSA-N	0	3	342.414	3.409	20	30		EGEDHN
N#Cc1cc(N2CCN(Cc3ccccc3)C3(CCCCC3)C2)ncn1	ZINC000578480686	459208242	/nfs/dbraw/zinc/20/82/42/459208242.db2.gz	UCAZUNDZWAPVBW-UHFFFAOYSA-N	0	3	347.466	3.373	20	30		EGEDHN
C=C(C)Cn1c(CCC(C)C)nnc1N1CCN(C)[C@@H](C(C)C)C1	ZINC000558995770	459229638	/nfs/dbraw/zinc/22/96/38/459229638.db2.gz	MVWHDHDZMNVXRY-QGZVFWFLSA-N	0	3	333.524	3.219	20	30		EGEDHN
N#CCCNCc1ccccc1CN1CCN(c2ccccc2)CC1	ZINC000579343845	459246509	/nfs/dbraw/zinc/24/65/09/459246509.db2.gz	LXWSQYBAYUFMLG-UHFFFAOYSA-N	0	3	334.467	3.012	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1N[C@@H](C)C(=O)N[C@@H](C)c1cccc2ccccc21	ZINC000579917354	459253740	/nfs/dbraw/zinc/25/37/40/459253740.db2.gz	UEFXVUOTUFEETR-QPAVJXABSA-N	0	3	338.451	3.339	20	30		EGEDHN
CCc1ccccc1[C@@H](CNC(=O)C(C)C#N)NC(=O)OC(C)(C)C	ZINC000496638189	459268517	/nfs/dbraw/zinc/26/85/17/459268517.db2.gz	BAWDKQIGWHOPNL-CZUORRHYSA-N	0	3	345.443	3.091	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CC2(CCC2)[C@H]1C1CC1	ZINC000581222578	459269928	/nfs/dbraw/zinc/26/99/28/459269928.db2.gz	ADXLLTGCASPEFO-AZUAARDMSA-N	0	3	327.468	3.419	20	30		EGEDHN
CC1CCN(C(=O)C2CCN(CCc3ccc(C#N)cc3)CC2)CC1	ZINC000595298839	459270351	/nfs/dbraw/zinc/27/03/51/459270351.db2.gz	TWNRKHQDWPULGB-UHFFFAOYSA-N	0	3	339.483	3.071	20	30		EGEDHN
C=CCOc1cccc(CNCCNC(=O)CC2CCCCC2)c1	ZINC000560050189	459296388	/nfs/dbraw/zinc/29/63/88/459296388.db2.gz	CUCHKAOKEXTBIB-UHFFFAOYSA-N	0	3	330.472	3.428	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NC[C@H](CC)N1CCc2ccccc2C1)OCC	ZINC000534401107	459324700	/nfs/dbraw/zinc/32/47/00/459324700.db2.gz	FBEPYVOBCUSOAW-VQTJNVASSA-N	0	3	344.499	3.311	20	30		EGEDHN
N#Cc1cc(Br)cnc1NC[C@H]1CCCCN1C1CC1	ZINC000582341543	459347855	/nfs/dbraw/zinc/34/78/55/459347855.db2.gz	PBZVTNRSCIOMBL-CQSZACIVSA-N	0	3	335.249	3.145	20	30		EGEDHN
C=C(C)[C@@H](NC(=O)N(C)CCN1CCCC1)c1ccc(F)c(F)c1	ZINC000483301822	459357239	/nfs/dbraw/zinc/35/72/39/459357239.db2.gz	HICQXMGETQAJRZ-QGZVFWFLSA-N	0	3	337.414	3.319	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN(CC)[C@H](C)CC)cc1	ZINC000595593497	459358585	/nfs/dbraw/zinc/35/85/85/459358585.db2.gz	QOYAKWPQTGSDQW-MRXNPFEDSA-N	0	3	331.460	3.452	20	30		EGEDHN
Cc1cccc(C)c1[C@@H]1CCCN1CC(=O)N(CCC#N)CCC#N	ZINC000595601103	459360426	/nfs/dbraw/zinc/36/04/26/459360426.db2.gz	MWEMQXORHKKXMY-SFHVURJKSA-N	0	3	338.455	3.096	20	30		EGEDHN
C=CCCC[C@H](C)NC(=O)NCCCN1CCc2ccccc2C1	ZINC000538286682	459370886	/nfs/dbraw/zinc/37/08/86/459370886.db2.gz	HYPJJKKGZKOJIW-KRWDZBQOSA-N	0	3	329.488	3.479	20	30		EGEDHN
COc1cccc(OC)c1OCCCCN1CCC[C@H](CC#N)C1	ZINC000595623200	459373766	/nfs/dbraw/zinc/37/37/66/459373766.db2.gz	JQEVLRAMXAQPKO-MRXNPFEDSA-N	0	3	332.444	3.488	20	30		EGEDHN
CC(C)[C@@H]1CCCN([C@@H]2CCN(c3ccc(C#N)cc3)C2=O)CC1	ZINC000569025960	459384657	/nfs/dbraw/zinc/38/46/57/459384657.db2.gz	YGAHPUHNLHACEV-IEBWSBKVSA-N	0	3	325.456	3.422	20	30		EGEDHN
N#Cc1cnn2c1NC[C@@H](CN1CCC[C@@H]1c1cccc(Cl)c1)C2	ZINC000569104843	459395948	/nfs/dbraw/zinc/39/59/48/459395948.db2.gz	ZVHMHXTXNNOMLV-SUMWQHHRSA-N	0	3	341.846	3.287	20	30		EGEDHN
N#C[C@H]1CC[C@@H](NC(=O)N[C@@H](CN2CCCCC2)c2ccccc2)C1	ZINC000591867041	459458532	/nfs/dbraw/zinc/45/85/32/459458532.db2.gz	AHTRRRVUMOIQBM-UHOSZYNNSA-N	0	3	340.471	3.205	20	30		EGEDHN
Cc1ccccc1OC[C@H](O)CN[C@@H]1CCCc2cc(C#N)ccc21	ZINC000569569184	459473301	/nfs/dbraw/zinc/47/33/01/459473301.db2.gz	WOSYYBDNRTVKQX-UYAOXDASSA-N	0	3	336.435	3.274	20	30		EGEDHN
Cc1[nH]c2ncnc(N(CCN(C)C)Cc3ccc(C#N)cc3)c2c1C	ZINC000591922984	459487003	/nfs/dbraw/zinc/48/70/03/459487003.db2.gz	LXCWORFMACEQOY-UHFFFAOYSA-N	0	3	348.454	3.015	20	30		EGEDHN
C=CCSCCNCCS(=O)(=O)c1ccc(C(C)(C)C)cc1	ZINC000569837138	459518092	/nfs/dbraw/zinc/51/80/92/459518092.db2.gz	JBZBVDDJLIABOP-UHFFFAOYSA-N	0	3	341.542	3.267	20	30		EGEDHN
C[C@H](CNC(=O)c1cn(CCCC#N)c2ccccc12)N1CCCC1	ZINC000569909590	459529848	/nfs/dbraw/zinc/52/98/48/459529848.db2.gz	XUUIOIUKYRZUKZ-MRXNPFEDSA-N	0	3	338.455	3.159	20	30		EGEDHN
Cc1nc(NC[C@@H](c2cccc(C(F)(F)F)c2)N(C)C)ccc1C#N	ZINC000487721333	459531610	/nfs/dbraw/zinc/53/16/10/459531610.db2.gz	JWUOCPOTQDRXOF-INIZCTEOSA-N	0	3	348.372	3.417	20	30		EGEDHN
C[C@H](NC(C)(C)CNC(=O)N1CCC(F)(C#N)CC1)c1ccccc1	ZINC000497439941	459536293	/nfs/dbraw/zinc/53/62/93/459536293.db2.gz	BGVDJCOYOAWFBX-HNNXBMFYSA-N	0	3	346.450	3.153	20	30		EGEDHN
Cc1nc(NC[C@@H]2CCCN(C)[C@@H]2c2cccs2)ccc1C#N	ZINC000488062882	459538344	/nfs/dbraw/zinc/53/83/44/459538344.db2.gz	IEWIRJADAPOJSJ-YJBOKZPZSA-N	0	3	326.469	3.240	20	30		EGEDHN
C=C[C@H]1CCCCN1C(=O)Nc1cccc(N2CCN(CC)CC2)c1	ZINC000488649443	459548144	/nfs/dbraw/zinc/54/81/44/459548144.db2.gz	WVCBESVBGVVWMV-SFHVURJKSA-N	0	3	342.487	3.401	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](CC(F)(F)F)C(C)C)CC1	ZINC000526099823	459549017	/nfs/dbraw/zinc/54/90/17/459549017.db2.gz	VVFBOWXBZFXQIC-AWEZNQCLSA-N	0	3	335.414	3.303	20	30		EGEDHN
CCc1nc(C#N)cc(N2C[C@@H](C)N(Cc3ccccc3)C[C@H]2C)n1	ZINC000596176267	459549692	/nfs/dbraw/zinc/54/96/92/459549692.db2.gz	BWCUSRAXNHEZOQ-HZPDHXFCSA-N	0	3	335.455	3.010	20	30		EGEDHN
C=CCN(Cc1ccncc1C)[C@@H](C)c1cccc(-n2cnnn2)c1	ZINC000570592543	459557871	/nfs/dbraw/zinc/55/78/71/459557871.db2.gz	RSHPSRJEHXPCSY-INIZCTEOSA-N	0	3	334.427	3.115	20	30		EGEDHN
C=CCCCS(=O)(=O)NC1CCN([C@H](C)c2ccccc2)CC1	ZINC000489494212	459566157	/nfs/dbraw/zinc/56/61/57/459566157.db2.gz	GTZDZCBCKUAYAI-MRXNPFEDSA-N	0	3	336.501	3.098	20	30		EGEDHN
CN1CCN(c2nc(C(F)(F)F)ccc2C#N)CC12CCCCC2	ZINC000596251296	459574902	/nfs/dbraw/zinc/57/49/02/459574902.db2.gz	PMEOOHVNMYODJL-UHFFFAOYSA-N	0	3	338.377	3.427	20	30		EGEDHN
C[C@@H]1C[C@H](c2ccc(F)cc2)CN1Cc1cnc2c(C#N)cnn2c1	ZINC000572961600	459603066	/nfs/dbraw/zinc/60/30/66/459603066.db2.gz	MJHSYVRFJJDCFE-CJNGLKHVSA-N	0	3	335.386	3.118	20	30		EGEDHN
C=C(CNC(=O)N1CCN([C@@H]2C[C@H]2C)C[C@H](C)C1)c1ccccc1	ZINC000491189444	459603863	/nfs/dbraw/zinc/60/38/63/459603863.db2.gz	VZMUUPBZRRVEBX-FRQCXROJSA-N	0	3	327.472	3.072	20	30		EGEDHN
N#CC[C@]1(O)CCN(CCCCc2cccc(C(F)(F)F)c2)C1	ZINC000592522283	459624110	/nfs/dbraw/zinc/62/41/10/459624110.db2.gz	KONZQNPRLKCGSS-INIZCTEOSA-N	0	3	326.362	3.379	20	30		EGEDHN
C[C@@H](N[C@H](c1ccc(F)cc1)C1CCC1)C(=O)NC1(C#N)CCC1	ZINC000583976893	459627590	/nfs/dbraw/zinc/62/75/90/459627590.db2.gz	SCMYAPUEDHIKEP-DYVFJYSZSA-N	0	3	329.419	3.207	20	30		EGEDHN
C=CCN1CCC(NC(=O)/C=C/c2cccc(Br)c2)CC1	ZINC000491543516	459636064	/nfs/dbraw/zinc/63/60/64/459636064.db2.gz	CBCBWIUFISDUCC-VOTSOKGWSA-N	0	3	349.272	3.229	20	30		EGEDHN
CN(C)C/C=C/C(=O)Nc1cccc(OCc2cccc(C#N)c2)c1	ZINC000491686263	459653073	/nfs/dbraw/zinc/65/30/73/459653073.db2.gz	QCXGEVAZRYLVMG-BJMVGYQFSA-N	0	3	335.407	3.194	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H]2CC[C@H](c3cccc(Cl)c3)C2)CC1	ZINC000491752475	459667565	/nfs/dbraw/zinc/66/75/65/459667565.db2.gz	MHJMSWQUFGCUPU-PKOBYXMFSA-N	0	3	344.886	3.438	20	30		EGEDHN
C#CCCN1CCC(NC(=O)/C=C/c2cccc(OC(C)C)c2)CC1	ZINC000491911221	459684226	/nfs/dbraw/zinc/68/42/26/459684226.db2.gz	GINLTLFGHLYGOI-MDZDMXLPSA-N	0	3	340.467	3.091	20	30		EGEDHN
C=CC(C)(C)CNCCS(=O)(=O)c1cccc(Br)c1	ZINC000563001520	459691434	/nfs/dbraw/zinc/69/14/34/459691434.db2.gz	WCPNKOZCJWUNKH-UHFFFAOYSA-N	0	3	346.290	3.025	20	30		EGEDHN
CN1CC[C@H](NC(=O)/C=C\c2ccc(C#N)cc2)[C@H]1c1ccccc1	ZINC000492248322	459697155	/nfs/dbraw/zinc/69/71/55/459697155.db2.gz	MIEXSQLKEXQBKM-OFFRDUJJSA-N	0	3	331.419	3.133	20	30		EGEDHN
N#Cc1cnn2cc(-c3cccc(OCCN4CCCCC4)c3)cnc12	ZINC000596630536	459705194	/nfs/dbraw/zinc/70/51/94/459705194.db2.gz	UIOCOZJOESEATL-UHFFFAOYSA-N	0	3	347.422	3.133	20	30		EGEDHN
CC(C)N(C(=O)c1cc(C#N)c[nH]1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000592874042	459708086	/nfs/dbraw/zinc/70/80/86/459708086.db2.gz	QSGGXMNZLPCPDS-SFHVURJKSA-N	0	3	336.439	3.011	20	30		EGEDHN
CN1CCN(Cc2ccccc2-c2ccc(OCCC#N)cc2)CC1	ZINC000596639375	459709775	/nfs/dbraw/zinc/70/97/75/459709775.db2.gz	PBQYKVLYRHNKHR-UHFFFAOYSA-N	0	3	335.451	3.393	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N[C@H](CCO)c1ccccc1F	ZINC000592879442	459710444	/nfs/dbraw/zinc/71/04/44/459710444.db2.gz	AWXVOLKZTIUMPN-QFBILLFUSA-N	0	3	340.398	3.138	20	30		EGEDHN
C#CCCN1CCC(NC(=O)/C=C/c2ccc(OCC)c(C)c2)CC1	ZINC000492575473	459711843	/nfs/dbraw/zinc/71/18/43/459711843.db2.gz	KNJJKGZGDWOUEG-CSKARUKUSA-N	0	3	340.467	3.011	20	30		EGEDHN
C[C@H](C#N)N(Cc1cccc(C(F)(F)F)c1)C(=O)/C=C/CN(C)C	ZINC000493094427	459733483	/nfs/dbraw/zinc/73/34/83/459733483.db2.gz	LURPRHOSUXWUDF-OQHXTRMZSA-N	0	3	339.361	3.064	20	30		EGEDHN
CN(C)CC(C)(C)NC(=O)/C=C\c1cn(CCC#N)c2ccccc12	ZINC000493388037	459742783	/nfs/dbraw/zinc/74/27/83/459742783.db2.gz	NEUIWAJAAZKNTF-KHPPLWFESA-N	0	3	338.455	3.025	20	30		EGEDHN
CC(C)O[C@H]1CCCN(Cc2cn(C)nc2-c2ccc(C#N)cc2)C1	ZINC000593054006	459757089	/nfs/dbraw/zinc/75/70/89/459757089.db2.gz	RBRSIWBBDOCLCI-IBGZPJMESA-N	0	3	338.455	3.348	20	30		EGEDHN
Cc1cc(C)cc(N(CCC#N)C(=O)[C@@H](C)NC2(C3CC3)CC2)c1	ZINC000544413595	459757837	/nfs/dbraw/zinc/75/78/37/459757837.db2.gz	GSEXZPDRNLYTIH-MRXNPFEDSA-N	0	3	325.456	3.471	20	30		EGEDHN
CC(C)Oc1ccc(NC(=O)N(C)CCN2CCCCC2)cc1C#N	ZINC000593172829	459796537	/nfs/dbraw/zinc/79/65/37/459796537.db2.gz	KYFCEMUOLPFSRM-UHFFFAOYSA-N	0	3	344.459	3.295	20	30		EGEDHN
Cc1cc(C#N)nc(N2CCN(Cc3ccccc3)[C@H](C(C)C)C2)n1	ZINC000528123915	459799169	/nfs/dbraw/zinc/79/91/69/459799169.db2.gz	BYZALYRGUCKPAW-IBGZPJMESA-N	0	3	335.455	3.004	20	30		EGEDHN
CCC(C#N)(CC)C(=O)N1CCC(N2CCc3ccccc3C2)CC1	ZINC000528269495	459801476	/nfs/dbraw/zinc/80/14/76/459801476.db2.gz	JCKVLPQEHQPJMX-UHFFFAOYSA-N	0	3	339.483	3.366	20	30		EGEDHN
COCCC1CCN(Cc2cn(C)nc2-c2ccc(C#N)cc2)CC1	ZINC000528577254	459810212	/nfs/dbraw/zinc/81/02/12/459810212.db2.gz	LYDNBGCVJGQMHC-UHFFFAOYSA-N	0	3	338.455	3.207	20	30		EGEDHN
CC(C)[C@H]1CN(Cc2ccc(C#N)cn2)CCN1Cc1ccccc1	ZINC000528642681	459811931	/nfs/dbraw/zinc/81/19/31/459811931.db2.gz	XYWTZNXXTDYHSJ-OAQYLSRUSA-N	0	3	334.467	3.296	20	30		EGEDHN
CC[C@H](c1nnc(NC(=O)[C@@H](N)CCCC#N)s1)c1ccccc1	ZINC000566179245	459820202	/nfs/dbraw/zinc/82/02/02/459820202.db2.gz	IWXBWEBHSZKNSS-KBPBESRZSA-N	0	3	343.456	3.040	20	30		EGEDHN
N#Cc1ccc(CC(=O)N[C@@H](CN2CCCCC2)c2ccccc2)cc1	ZINC000609018396	459899733	/nfs/dbraw/zinc/89/97/33/459899733.db2.gz	XKCATBQCBMFSNW-NRFANRHFSA-N	0	3	347.462	3.444	20	30		EGEDHN
Cc1cc(C)c(C#N)c(NC(=O)[C@@H]2CCN(Cc3ccccc3)C2)n1	ZINC000602356923	459903236	/nfs/dbraw/zinc/90/32/36/459903236.db2.gz	UQJJVKWAXRHIRQ-QGZVFWFLSA-N	0	3	334.423	3.031	20	30		EGEDHN
CN(C)CCOc1ccc(-c2noc(C3(C#N)CCCCC3)n2)cc1	ZINC000546293343	459908179	/nfs/dbraw/zinc/90/81/79/459908179.db2.gz	HSURYSRTNOQHAF-UHFFFAOYSA-N	0	3	340.427	3.402	20	30		EGEDHN
N#Cc1ccc(Oc2cccc(C(=O)N[C@@H]3CCN(C4CC4)C3)c2)cc1	ZINC000609135916	459908716	/nfs/dbraw/zinc/90/87/16/459908716.db2.gz	IFCCWEJTSLAWNU-QGZVFWFLSA-N	0	3	347.418	3.317	20	30		EGEDHN
C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)c1cc2ccccc2n1CC#N	ZINC000609166884	459917543	/nfs/dbraw/zinc/91/75/43/459917543.db2.gz	NVMHOSLIMAAAIM-CVEARBPZSA-N	0	3	338.455	3.015	20	30		EGEDHN
N#CCN1CCC(NCc2ccccc2OCc2ccccc2)CC1	ZINC000609334822	459946703	/nfs/dbraw/zinc/94/67/03/459946703.db2.gz	IYWUQPYHNHAZIO-UHFFFAOYSA-N	0	3	335.451	3.343	20	30		EGEDHN
CC(C)c1ccc(C(C)(C)NCC(=O)N(CCC#N)CCC#N)cc1	ZINC000609358234	459950065	/nfs/dbraw/zinc/95/00/65/459950065.db2.gz	UOXGIHKBIITVED-UHFFFAOYSA-N	0	3	340.471	3.291	20	30		EGEDHN
Cc1c([C@@H](C)NC[C@@H](O)CC(C)(C)C#N)cnn1-c1ccc(F)cc1	ZINC000598602069	459961540	/nfs/dbraw/zinc/96/15/40/459961540.db2.gz	KWDHRECJGYEKSN-DYVFJYSZSA-N	0	3	344.434	3.271	20	30		EGEDHN
COc1cc2c(c(OC)c1OC)CCN(C[C@H](C)CCC#N)CC2	ZINC000602485158	459962487	/nfs/dbraw/zinc/96/24/87/459962487.db2.gz	PMQAXNFAZBCJNY-CQSZACIVSA-N	0	3	332.444	3.053	20	30		EGEDHN
Cc1nc2ccccc2n1C[C@@H]1CCCN1Cc1cccc(C#N)n1	ZINC000602485800	459963600	/nfs/dbraw/zinc/96/36/00/459963600.db2.gz	STKDSZBSXGZFLC-SFHVURJKSA-N	0	3	331.423	3.276	20	30		EGEDHN
Cc1ccccc1[C@H]([C@@H](C)NC(=O)N1CCC(CC#N)CC1)N(C)C	ZINC000588722073	459975935	/nfs/dbraw/zinc/97/59/35/459975935.db2.gz	VOZPHFKTOXZWTE-APWZRJJASA-N	0	3	342.487	3.322	20	30		EGEDHN
N#Cc1ccc(CNC(=O)CN2CCCC3(CCCCC3)C2)cc1	ZINC000609541299	459979631	/nfs/dbraw/zinc/97/96/31/459979631.db2.gz	DDKWNZPAKBSQHS-UHFFFAOYSA-N	0	3	325.456	3.221	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N(Cc1ccc(F)cc1Cl)CC1CC1	ZINC000602525186	459984115	/nfs/dbraw/zinc/98/41/15/459984115.db2.gz	SBGPEEGOELJQIZ-INIZCTEOSA-N	0	3	337.826	3.239	20	30		EGEDHN
C[C@H](CC1(C#N)CCOCC1)NCc1cccc2c1OCCCO2	ZINC000602578662	460005950	/nfs/dbraw/zinc/00/59/50/460005950.db2.gz	ZKSZXVWZEWSWHX-OAHLLOKOSA-N	0	3	330.428	3.036	20	30		EGEDHN
Cn1nccc1[C@@H]1CCCCN1C(=O)C(C#N)CCc1ccccc1	ZINC000597612330	460008180	/nfs/dbraw/zinc/00/81/80/460008180.db2.gz	WACJOSJOVYXYAJ-MJGOQNOKSA-N	0	3	336.439	3.246	20	30		EGEDHN
CN(CCN1CCCCC1)C(=O)c1c(Cl)cc(C#N)cc1Cl	ZINC000593883347	460008590	/nfs/dbraw/zinc/00/85/90/460008590.db2.gz	NQBNBKRTLYHRQC-UHFFFAOYSA-N	0	3	340.254	3.423	20	30		EGEDHN
CC[C@@H](CN1CCCC1)NC(=O)Nc1cc(C#N)cn1C(C)(C)C	ZINC000609839771	460027847	/nfs/dbraw/zinc/02/78/47/460027847.db2.gz	PIDCFMVPFGNNJJ-HNNXBMFYSA-N	0	3	331.464	3.111	20	30		EGEDHN
C[C@@H](CCC#N)CN(CCO)Cc1ccc(Br)s1	ZINC000602628408	460031402	/nfs/dbraw/zinc/03/14/02/460031402.db2.gz	AQRIGSSQSSWNAU-NSHDSACASA-N	0	3	331.279	3.245	20	30		EGEDHN
CC(C#N)C(=O)N(C)CCOc1ccc(OCc2ccccc2)cc1	ZINC000609921477	460039400	/nfs/dbraw/zinc/03/94/00/460039400.db2.gz	ACINBNLJLZREIU-MRXNPFEDSA-N	0	3	338.407	3.262	20	30		EGEDHN
CN(Cc1cccc(OCc2cccc(C#N)c2)c1)C[C@H](O)C1CC1	ZINC000589198196	460053324	/nfs/dbraw/zinc/05/33/24/460053324.db2.gz	QNOOJGFRLOBOOI-NRFANRHFSA-N	0	3	336.435	3.340	20	30		EGEDHN
C[C@H](CC1(C#N)CCOCC1)NC[C@@]1(C)OCCc2sccc21	ZINC000602669037	460056262	/nfs/dbraw/zinc/05/62/62/460056262.db2.gz	ZHJNOLXCCHWNIH-RHSMWYFYSA-N	0	3	334.485	3.225	20	30		EGEDHN
N#Cc1ccc(NC(=O)N[C@H]2CCCN3CCCC[C@@H]23)cc1Cl	ZINC000594058752	460079855	/nfs/dbraw/zinc/07/98/55/460079855.db2.gz	QTBZWLHUKVVIAM-HOTGVXAUSA-N	0	3	332.835	3.350	20	30		EGEDHN
CCC(C)(C)N1CCN(C(=O)N[C@@H](C)c2ccc(C#N)cc2)CC1	ZINC000594067245	460084623	/nfs/dbraw/zinc/08/46/23/460084623.db2.gz	NJGQOSXTLBNQQQ-HNNXBMFYSA-N	0	3	328.460	3.135	20	30		EGEDHN
N#CCC1(CN2CCC[C@@H](CNC(=O)Nc3cccc(F)c3)C2)CC1	ZINC000602785783	460123653	/nfs/dbraw/zinc/12/36/53/460123653.db2.gz	CNJFIHNYYLCSSZ-HNNXBMFYSA-N	0	3	344.434	3.353	20	30		EGEDHN
Cc1csc([C@H](C)NC2CCN(c3ccc(C#N)cn3)CC2)n1	ZINC000599025945	460131382	/nfs/dbraw/zinc/13/13/82/460131382.db2.gz	FRNOKYFVQDDEJK-ZDUSSCGKSA-N	0	3	327.457	3.038	20	30		EGEDHN
C[C@H](NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1)c1cccc(C#N)c1	ZINC000610363356	460134880	/nfs/dbraw/zinc/13/48/80/460134880.db2.gz	FSEVASMCAZIIMC-OXJNMPFZSA-N	0	3	348.450	3.043	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H](Cn3cnc4ccccc43)C2)nc1	ZINC000602812233	460140487	/nfs/dbraw/zinc/14/04/87/460140487.db2.gz	ONXBSUUFUGAFSD-QGZVFWFLSA-N	0	3	331.423	3.215	20	30		EGEDHN
N#CC[C@H](CC(=O)N[C@H]1CCCN2CCCC[C@H]12)c1ccccc1	ZINC000594199010	460146056	/nfs/dbraw/zinc/14/60/56/460146056.db2.gz	XTHOMJQFIQPPFM-CEXWTWQISA-N	0	3	325.456	3.207	20	30		EGEDHN
N#Cc1cccc(OCCN[C@H](Cn2cccn2)c2ccccc2)c1	ZINC000610432966	460150302	/nfs/dbraw/zinc/15/03/02/460150302.db2.gz	KZQANGWPQYXFLR-HXUWFJFHSA-N	0	3	332.407	3.165	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)[C@@H](C)Cc2ccc(C#N)cc2)N(C)C)cc1	ZINC000594254559	460174071	/nfs/dbraw/zinc/17/40/71/460174071.db2.gz	ISQUWNMJAYVNIZ-UWJYYQICSA-N	0	3	349.478	3.464	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)C(=O)N1CCC[C@@H]1CN1CCCCC1	ZINC000594277810	460178682	/nfs/dbraw/zinc/17/86/82/460178682.db2.gz	NPBJEPKQNGCEFM-YLJYHZDGSA-N	0	3	339.483	3.214	20	30		EGEDHN
C[C@@H](CCC#N)N(C)C[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000602924557	460188376	/nfs/dbraw/zinc/18/83/76/460188376.db2.gz	FNTUXBYVQSOZAC-FZMZJTMJSA-N	0	3	331.243	3.357	20	30		EGEDHN
CC(C)(C)N1CCCN(C(=O)N[C@H]2CCc3cc(C#N)ccc32)CC1	ZINC000618845539	460194793	/nfs/dbraw/zinc/19/47/93/460194793.db2.gz	DOQUTYXPXLXFDW-SFHVURJKSA-N	0	3	340.471	3.061	20	30		EGEDHN
CN(CCc1ccc(Cl)cc1)C[C@@H](O)COc1ccccc1C#N	ZINC000599292358	460218023	/nfs/dbraw/zinc/21/80/23/460218023.db2.gz	CYHMWWBCTOMHDC-GOSISDBHSA-N	0	3	344.842	3.126	20	30		EGEDHN
CCN(C[C@H](O)COc1ccccc1C#N)[C@@H](C)c1cccc(O)c1	ZINC000599308093	460223299	/nfs/dbraw/zinc/22/32/99/460223299.db2.gz	RGSFFZVSTGSQQT-KXBFYZLASA-N	0	3	340.423	3.087	20	30		EGEDHN
CCN(CCNC(=O)c1c(Cl)cc(C#N)cc1Cl)C1CC1	ZINC000611094310	460288074	/nfs/dbraw/zinc/28/80/74/460288074.db2.gz	DIPAGLDZAVUBBI-UHFFFAOYSA-N	0	3	326.227	3.079	20	30		EGEDHN
N#Cc1cc(Cl)c(C(=O)NC2CCN(C3CC3)CC2)c(Cl)c1	ZINC000611093139	460288548	/nfs/dbraw/zinc/28/85/48/460288548.db2.gz	XAIQSXNLYNIQBI-UHFFFAOYSA-N	0	3	338.238	3.222	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@]3(C2)C(=O)Nc2ccccc23)c(Cl)c1	ZINC000615232058	460296255	/nfs/dbraw/zinc/29/62/55/460296255.db2.gz	XPPJCTRBFUBOHS-LJQANCHMSA-N	0	3	337.810	3.307	20	30		EGEDHN
CC(C)(C)C1=CCN(C[C@@H](O)COc2ccc(CC#N)cc2)CC1	ZINC000611152467	460297532	/nfs/dbraw/zinc/29/75/32/460297532.db2.gz	WDHXTHOJLKPVTH-GOSISDBHSA-N	0	3	328.456	3.171	20	30		EGEDHN
N#Cc1ccc(CN2CCN(C[C@H]3CCOc4ccccc43)CC2)cc1	ZINC000611252811	460317395	/nfs/dbraw/zinc/31/73/95/460317395.db2.gz	PVJPDHHQQNAIEQ-HXUWFJFHSA-N	0	3	347.462	3.242	20	30		EGEDHN
CCC[C@H](C#N)NC(=O)c1ccccc1OCCN1CCCC[C@H]1C	ZINC000611286023	460329117	/nfs/dbraw/zinc/32/91/17/460329117.db2.gz	AJIVDHGJPZWTAK-IAGOWNOFSA-N	0	3	343.471	3.362	20	30		EGEDHN
N#Cc1cccc(OCCN2C[C@H]3CN(c4ccccc4)C[C@@H]3C2)c1	ZINC000603865313	460351877	/nfs/dbraw/zinc/35/18/77/460351877.db2.gz	WQBRXELOIBQVJH-OALUTQOASA-N	0	3	333.435	3.005	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@@H]2Cc2ccccc2C)CC1	ZINC000604109773	460379332	/nfs/dbraw/zinc/37/93/32/460379332.db2.gz	AOABBYVTJHTQQS-HXUWFJFHSA-N	0	3	341.499	3.362	20	30		EGEDHN
CCc1cccnc1[C@H](C)NC1CCN(c2ccc(C#N)cn2)CC1	ZINC000611559521	460398529	/nfs/dbraw/zinc/39/85/29/460398529.db2.gz	QHKPWTIJCMHRAS-HNNXBMFYSA-N	0	3	335.455	3.230	20	30		EGEDHN
N#Cc1ccccc1OCCN1C[C@@H]2CN(c3ccccc3)C[C@@H]2C1	ZINC000604271977	460399022	/nfs/dbraw/zinc/39/90/22/460399022.db2.gz	ZYEKNOKXPBWYOE-KDURUIRLSA-N	0	3	333.435	3.005	20	30		EGEDHN
C[C@@H](CNC(=O)NCc1ccc(C#N)c(Cl)c1)N1CCCC[C@H]1C	ZINC000619756015	460432182	/nfs/dbraw/zinc/43/21/82/460432182.db2.gz	PTCJCODPTWIXDB-KGLIPLIRSA-N	0	3	348.878	3.274	20	30		EGEDHN
N#Cc1ccc(CNC(=O)NC[C@@H]2CCCCN2C2CC2)cc1Cl	ZINC000619761197	460434743	/nfs/dbraw/zinc/43/47/43/460434743.db2.gz	VSYBQIYTHRZUCE-INIZCTEOSA-N	0	3	346.862	3.028	20	30		EGEDHN
CN(C)Cc1ccc(C(=O)NCc2ccc(C#N)c(Cl)c2)cc1	ZINC000619766957	460438056	/nfs/dbraw/zinc/43/80/56/460438056.db2.gz	MNBMZRSGXNVEER-UHFFFAOYSA-N	0	3	327.815	3.203	20	30		EGEDHN
C=CCOc1c(Cl)cc(CNC[C@](C)(O)C(C)C)cc1OC	ZINC000623415862	460536697	/nfs/dbraw/zinc/53/66/97/460536697.db2.gz	AEWVECOQQUTUNK-KRWDZBQOSA-N	0	3	327.852	3.410	20	30		EGEDHN
N#CC(C(=O)c1ccc(Cn2ccnn2)cc1)c1nc(C2CC2)cs1	ZINC000626467409	460538166	/nfs/dbraw/zinc/53/81/66/460538166.db2.gz	RAKSBTHFRAWJBB-HNNXBMFYSA-N	0	3	349.419	3.150	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)c1ccccc1CC#N	ZINC000601279963	460774355	/nfs/dbraw/zinc/77/43/55/460774355.db2.gz	LKYCREZTTXTGNM-LAUBAEHRSA-N	0	3	347.462	3.393	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000621287802	460975528	/nfs/dbraw/zinc/97/55/28/460975528.db2.gz	APQNCYYMTLEVOF-KRWDZBQOSA-N	0	3	332.419	3.021	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2C[C@@]2(C)c2ccccc2)CC1	ZINC000608426151	461059478	/nfs/dbraw/zinc/05/94/78/461059478.db2.gz	DSRAHQQOKQRVSP-QUCCMNQESA-N	0	3	327.472	3.056	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@H]2CCCN3CCCC[C@@H]23)cc1OC	ZINC000655350089	461201445	/nfs/dbraw/zinc/20/14/45/461201445.db2.gz	WPJMSBRCVUCSQD-IRXDYDNUSA-N	0	3	344.455	3.007	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)c2ccc(C)c(N3CCOCC3)c2)n1	ZINC000633894810	461320676	/nfs/dbraw/zinc/32/06/76/461320676.db2.gz	SMRSKEAKNHJYAR-HNNXBMFYSA-N	0	3	341.436	3.087	20	30		EGEDHN
C=CCC[C@H](CO)NCc1cc(Cl)ccc1OC[C@@H]1CCCO1	ZINC000641759589	461356034	/nfs/dbraw/zinc/35/60/34/461356034.db2.gz	GVFJSYNDRBKQCM-SJORKVTESA-N	0	3	339.863	3.315	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)[C@@H](C)c1nc(C)cs1)C(C)C	ZINC000668683428	461380061	/nfs/dbraw/zinc/38/00/61/461380061.db2.gz	VZSUDGGKWVTCIO-HZPDHXFCSA-N	0	3	335.517	3.370	20	30		EGEDHN
C=CC[C@H]1CCCN(C(=O)Nc2cc(C)nn2C2CCN(C)CC2)C1	ZINC000666283430	461547141	/nfs/dbraw/zinc/54/71/41/461547141.db2.gz	SNFABOPULYPTKG-INIZCTEOSA-N	0	3	345.491	3.278	20	30		EGEDHN
N#CC(C(=O)c1ccc2[nH]c(=O)oc2c1)c1cc(C(F)(F)F)ccn1	ZINC000643779403	461802787	/nfs/dbraw/zinc/80/27/87/461802787.db2.gz	RXGKYKGETYNFFH-SNVBAGLBSA-N	0	3	347.252	3.437	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NCCS(=O)(=O)c1ccccc1	ZINC000644672202	462031759	/nfs/dbraw/zinc/03/17/59/462031759.db2.gz	DJGCMJLBODMPNA-GOSISDBHSA-N	0	3	329.465	3.237	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)c1cccc2c1OCCCO2	ZINC000651259074	462158011	/nfs/dbraw/zinc/15/80/11/462158011.db2.gz	FGPOLPJCHQGZPX-CQSZACIVSA-N	0	3	347.374	3.225	20	30		EGEDHN
C=CC[C@@H]1CCCN([C@@H](C)C(=O)Nc2cccc(NC(C)=O)c2)C1	ZINC000661381744	462225131	/nfs/dbraw/zinc/22/51/31/462225131.db2.gz	PBYGEESAKOMZOQ-GOEBONIOSA-N	0	3	329.444	3.260	20	30		EGEDHN
C=CC[C@@H]1CCCN([C@H](C)C(=O)Nc2cccc(NC(C)=O)c2)C1	ZINC000661381743	462225933	/nfs/dbraw/zinc/22/59/33/462225933.db2.gz	PBYGEESAKOMZOQ-GDBMZVCRSA-N	0	3	329.444	3.260	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCCc2c(F)cccc2F)CC1	ZINC000654749089	462370765	/nfs/dbraw/zinc/37/07/65/462370765.db2.gz	LSFOQMCMPXKAEH-UHFFFAOYSA-N	0	3	336.426	3.444	20	30		EGEDHN
C=CCN(CC(=O)N1CCc2[nH]c3ccccc3c2C1)C(C)(C)C	ZINC000661760331	462401309	/nfs/dbraw/zinc/40/13/09/462401309.db2.gz	RGMDZOVCZLBVLU-UHFFFAOYSA-N	0	3	325.456	3.339	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccccc2OCC(F)F)CC1	ZINC000178240877	526441823	/nfs/dbraw/zinc/44/18/23/526441823.db2.gz	ZLLAXHNQNLLEBY-UHFFFAOYSA-N	0	3	339.386	3.102	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1	ZINC000171679925	526441953	/nfs/dbraw/zinc/44/19/53/526441953.db2.gz	YAOJBKWPZDFNQX-UHFFFAOYSA-N	0	3	338.795	3.020	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C(C)(C)c2ccc(OC)cc2)CC1	ZINC000164413375	526579916	/nfs/dbraw/zinc/57/99/16/526579916.db2.gz	XDVYVMIOOAGJJZ-UHFFFAOYSA-N	0	3	330.472	3.130	20	30		EGEDHN
CCO[C@@H]1C[C@H](NCc2ccc(C#N)s2)[C@@H]1Oc1ccccc1	ZINC000187639829	535507540	/nfs/dbraw/zinc/50/75/40/535507540.db2.gz	MNTYCZZANISWGA-KSZLIROESA-N	0	3	328.437	3.334	20	30		EGEDHN
COc1cc(OC)c2ncc(C#N)c(N[C@@H]3CCCN(C)[C@@H]3C)c2c1	ZINC000342829660	536869844	/nfs/dbraw/zinc/86/98/44/536869844.db2.gz	FCAUWJZIHCRZFS-MLGOLLRUSA-N	0	3	340.427	3.018	20	30		EGEDHN
C[C@H](C(=O)NC1(C#N)CCCCC1)N1CC[C@H](Cc2ccccc2)C1	ZINC000124281720	546744129	/nfs/dbraw/zinc/74/41/29/546744129.db2.gz	GYRQUKWXVNCRQS-IEBWSBKVSA-N	0	3	339.483	3.282	20	30		EGEDHN
Cc1cc(Cl)ccc1C(=O)C(C#N)c1nnc2n1CCCCC2	ZINC000134156370	546826050	/nfs/dbraw/zinc/82/60/50/546826050.db2.gz	UMVRWQXABYMJCN-CQSZACIVSA-N	0	3	328.803	3.456	20	30		EGEDHN
C=C[C@@H](C)NCc1ccc(OCC(=O)N2CCCCC2)c(OCC)c1	ZINC000153691162	546882938	/nfs/dbraw/zinc/88/29/38/546882938.db2.gz	MUPSKZMGQWTCRO-MRXNPFEDSA-N	0	3	346.471	3.141	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@@H](C)N[C@@H]1CCCC[C@H]1OC	ZINC000278688170	547362496	/nfs/dbraw/zinc/36/24/96/547362496.db2.gz	PHKPRCZQAKPHBC-DJIMGWMZSA-N	0	3	336.501	3.198	20	30		EGEDHN
C[C@@H]1CCCCN(CC(=O)NC(=O)Nc2ccc3c(c2)OCCO3)C1	ZINC000330134079	547514097	/nfs/dbraw/zinc/51/40/97/547514097.db2.gz	GTQOGVGNFSRUQW-CYBMUJFWSA-N	0	3	347.415	3.082	20	30		EGEDHN
N#CC(C(=O)c1cnc2nccnc2c1)c1ccc2ccccc2n1	ZINC000680617219	549885879	/nfs/dbraw/zinc/88/58/79/549885879.db2.gz	ISGYXQAYAOTICR-AWEZNQCLSA-N	0	3	325.331	3.063	20	30		EGEDHN
C=CCSc1ccccc1C(=O)N1CCN(c2ccncc2)CC1	ZINC000681621492	550018829	/nfs/dbraw/zinc/01/88/29/550018829.db2.gz	WVBWHSJRHRIVMJ-UHFFFAOYSA-N	0	3	339.464	3.322	20	30		EGEDHN
C=CCN(C)Cc1sc(N2CCOCC2)nc1-c1ccccc1	ZINC000681758474	550033690	/nfs/dbraw/zinc/03/36/90/550033690.db2.gz	XFKXLWKHOMAEAQ-UHFFFAOYSA-N	0	3	329.469	3.265	20	30		EGEDHN
CC1(C)CCN(Cc2cc(=O)n3c4ccccc4[nH]c3c2C#N)CC1	ZINC000726970811	574624892	/nfs/dbraw/zinc/62/48/92/574624892.db2.gz	ZMVBQSSETFHOBH-HNNXBMFYSA-N	0	3	334.423	3.346	20	30		EGEDHN
COC(=O)[C@@H]1C[C@@H]1C(=O)C(C#N)c1nc(-c2ccc(C)cc2)cs1	ZINC000727628274	574678361	/nfs/dbraw/zinc/67/83/61/574678361.db2.gz	TYGWFKVIORFFCP-MJBXVCDLSA-N	0	3	340.404	3.104	20	30		EGEDHN
Brc1cnn(N=C2CCCC[C@H]2N2CCCCC2)c1	ZINC000752748013	574815507	/nfs/dbraw/zinc/81/55/07/574815507.db2.gz	SYFXAMYHCJUCSO-CQSZACIVSA-N	0	3	325.254	3.278	20	30		EGEDHN
C=C(C)CN1CCC(NC(=S)Nc2ccc(OCC)cc2)CC1	ZINC000729942377	574897818	/nfs/dbraw/zinc/89/78/18/574897818.db2.gz	MCNQUAICHUEIPB-UHFFFAOYSA-N	0	3	333.501	3.412	20	30		EGEDHN
C[C@@H](CNC(=O)OC(C)(C)C)N(C)CCCOc1ccc(C#N)cc1	ZINC000732207628	575244947	/nfs/dbraw/zinc/24/49/47/575244947.db2.gz	XUHGEAUPZNVMGI-HNNXBMFYSA-N	0	3	347.459	3.172	20	30		EGEDHN
C=CC[C@H](NC(=O)NC[C@@H](C)N1CCCC[C@@H]1C)c1ccncc1	ZINC000734658888	575533149	/nfs/dbraw/zinc/53/31/49/575533149.db2.gz	NDFWHCDCZCNHHX-JZXOWHBKSA-N	0	3	330.476	3.261	20	30		EGEDHN
C=CC[C@H](NC(=O)N1CCC[C@H]1CN1CCCCC1)c1ccncc1	ZINC000734684100	575536814	/nfs/dbraw/zinc/53/68/14/575536814.db2.gz	SDTFZFCVWDMNBI-OALUTQOASA-N	0	3	342.487	3.359	20	30		EGEDHN
C=CCc1cc(C(=O)N[C@H](CC)CN2CCCC2)cc(OC)c1OC	ZINC000735924173	575737626	/nfs/dbraw/zinc/73/76/26/575737626.db2.gz	PIPMUOHXICBSET-QGZVFWFLSA-N	0	3	346.471	3.037	20	30		EGEDHN
C#CCCN1CCC(NC(=O)CCc2ccc(-c3ccccc3)[nH]2)CC1	ZINC000740736519	576621739	/nfs/dbraw/zinc/62/17/39/576621739.db2.gz	XRKUIXAARGFMCB-UHFFFAOYSA-N	0	3	349.478	3.218	20	30		EGEDHN
CON=Cc1ccc(C(=O)N2CCN(CC3CCCCC3)CC2)cc1	ZINC000742911146	576797608	/nfs/dbraw/zinc/79/76/08/576797608.db2.gz	VPFWKYKAWHCFDN-UHFFFAOYSA-N	0	3	343.471	3.005	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)[C@@H](C)c2ccc(C)o2)cc1	ZINC000744033717	576819277	/nfs/dbraw/zinc/81/92/77/576819277.db2.gz	VRGOLRILXKSZRB-SWLSCSKDSA-N	0	3	326.352	3.048	20	30		EGEDHN
C#CCN(Cc1ccc(F)cc1)C(=O)NC[C@H](C)N1CCC[C@H](C)C1	ZINC000744843327	576835442	/nfs/dbraw/zinc/83/54/42/576835442.db2.gz	HPZFEZGGUJJQQI-IRXDYDNUSA-N	0	3	345.462	3.091	20	30		EGEDHN
C=CCCC[C@H](C)[NH+]1CCC(Oc2cccc(-c3nnn[n-]3)c2)CC1	ZINC000823894079	608391905	/nfs/dbraw/zinc/39/19/05/608391905.db2.gz	HAYJPHUSLZSXGA-HNNXBMFYSA-N	0	3	341.459	3.455	20	30		EGEDHN
C=CCCC[C@H](C)[NH+]1CCC(Oc2cccc(-c3nn[n-]n3)c2)CC1	ZINC000823894079	608391908	/nfs/dbraw/zinc/39/19/08/608391908.db2.gz	HAYJPHUSLZSXGA-HNNXBMFYSA-N	0	3	341.459	3.455	20	30		EGEDHN
Cc1cc(C)cc(OCCC(=O)C(C#N)C(=O)NC2CCCCC2)c1	ZINC000050683934	1291656342	/nfs/dbraw/zinc/65/63/42/1291656342.db2.gz	MAPOLTQDJUCQHJ-GOSISDBHSA-N	0	3	342.439	3.230	20	30		EGEDHN
COC(=O)c1ccc(CCC(=O)C(C#N)c2nc3ccccc3o2)cc1	ZINC000069581656	1292245763	/nfs/dbraw/zinc/24/57/63/1292245763.db2.gz	FJRGGAUOIQRVFY-HNNXBMFYSA-N	0	3	348.358	3.423	20	30		EGEDHN
CC[C@H](C#N)Oc1cccc(CNCc2ccc([S@@](C)=O)cc2)c1	ZINC000085324374	1292720361	/nfs/dbraw/zinc/72/03/61/1292720361.db2.gz	OOMCYBNPZFOLLC-OSPHWJPCSA-N	0	3	342.464	3.395	20	30		EGEDHN
C=C(Cl)COc1ccc([C@@H](C)N[C@H]2CC(=O)N(C3CC3)C2)cc1	ZINC000090181006	1292790085	/nfs/dbraw/zinc/79/00/85/1292790085.db2.gz	QRWMISQVYKTBHA-HIFRSBDPSA-N	0	3	334.847	3.232	20	30		EGEDHN
COc1ccc(CCNC(=O)C(C#N)C(=O)CCCC(C)(C)C)cc1	ZINC000103640035	1293010180	/nfs/dbraw/zinc/01/01/80/1293010180.db2.gz	YAPLNIKDUDUAFW-QGZVFWFLSA-N	0	3	344.455	3.279	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)CC[C@H]2CCCCO2)cc1	ZINC000111945041	1293113168	/nfs/dbraw/zinc/11/31/68/1293113168.db2.gz	NMSXJKAVLZTBAJ-SJORKVTESA-N	0	3	328.412	3.246	20	30		EGEDHN
N#Cc1ccc(CCC(=O)O[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000117093906	1293216519	/nfs/dbraw/zinc/21/65/19/1293216519.db2.gz	OKGFRFIGPWHERH-HXUWFJFHSA-N	0	3	334.419	3.309	20	30		EGEDHN
CC(=O)N[C@H](C(=O)C(C#N)c1nc2cc(F)ccc2s1)C(C)(C)C	ZINC000835144146	1293219101	/nfs/dbraw/zinc/21/91/01/1293219101.db2.gz	BMTFHBMFPQUIFO-XHDPSFHLSA-N	0	3	347.415	3.162	20	30		EGEDHN
CC(C)(CC(=O)C(C#N)C(=O)NCc1ccccc1)c1ccccc1	ZINC000119583233	1293278208	/nfs/dbraw/zinc/27/82/08/1293278208.db2.gz	DSOHXOYNPKRZAC-SFHVURJKSA-N	0	3	334.419	3.380	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)CCO[C@@H](C)CC(C)C	ZINC000120062816	1293301712	/nfs/dbraw/zinc/30/17/12/1293301712.db2.gz	VACBBSWDPJONET-GJZGRUSLSA-N	0	3	346.427	3.184	20	30		EGEDHN
N#Cc1c2[nH]c3ccccc3n2c(=O)cc1CN1CCC2(CCC2)C1	ZINC000123470919	1293444338	/nfs/dbraw/zinc/44/43/38/1293444338.db2.gz	LFMAPMDDHXOVJB-HNNXBMFYSA-N	0	3	332.407	3.100	20	30		EGEDHN
N#CC(C(=O)CCc1nc(-c2ccoc2)no1)c1nc2ccccc2[nH]1	ZINC000123810954	1293456521	/nfs/dbraw/zinc/45/65/21/1293456521.db2.gz	BEZCBSLYXOTZCJ-LBPRGKRZSA-N	0	3	347.334	3.015	20	30		EGEDHN
C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)C(C#N)C(=O)N1CCCC1	ZINC000124736204	1293484378	/nfs/dbraw/zinc/48/43/78/1293484378.db2.gz	BPHSFEGCUZQDCH-YOEHRIQHSA-N	0	3	342.439	3.083	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)CCCc1ccccc1	ZINC000129959339	1293640152	/nfs/dbraw/zinc/64/01/52/1293640152.db2.gz	ZNNDHUXJUIALBL-INIZCTEOSA-N	0	3	336.391	3.365	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)C[C@@H]2C=CCC2)cc1Cl	ZINC000130319709	1293652785	/nfs/dbraw/zinc/65/27/85/1293652785.db2.gz	NHQLPSHXQZEBHB-YPMHNXCESA-N	0	3	332.787	3.352	20	30		EGEDHN
N#CC(C(=O)Nc1cccc2ccccc21)C(=O)c1cncc(F)c1	ZINC000151606287	1293932332	/nfs/dbraw/zinc/93/23/32/1293932332.db2.gz	JUILYQLJOLMACL-MRXNPFEDSA-N	0	3	333.322	3.335	20	30		EGEDHN
C[C@@H](C(=O)C(C#N)C(=O)NCc1ccccc1)c1c(F)cccc1F	ZINC000153272889	1294006380	/nfs/dbraw/zinc/00/63/80/1294006380.db2.gz	LXGNJLWSQKXDGM-OCCSQVGLSA-N	0	3	342.345	3.094	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)CCc1cccc(OC2CCCC2)c1	ZINC000171037152	1294392264	/nfs/dbraw/zinc/39/22/64/1294392264.db2.gz	XYHLWEXRVCXLKT-GOSISDBHSA-N	0	3	342.439	3.174	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)C[C@H](C)c1cccc(OC)c1	ZINC000175940352	1294581408	/nfs/dbraw/zinc/58/14/08/1294581408.db2.gz	BDIHWGDPFZOLBK-YOEHRIQHSA-N	0	3	330.428	3.204	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)CC[C@H]2CCOC2)cc1	ZINC000176092238	1294590631	/nfs/dbraw/zinc/59/06/31/1294590631.db2.gz	HLMFXTHRWZAEFR-FUHWJXTLSA-N	0	3	342.439	3.493	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](O)c2cccc(C(F)(F)F)c2)s1	ZINC000176965852	1294646194	/nfs/dbraw/zinc/64/61/94/1294646194.db2.gz	DNQFVPPMRDPXRS-AWEZNQCLSA-N	0	3	326.343	3.462	20	30		EGEDHN
N#Cc1cnc2ccccc2c1N1CCN(Cc2ccccc2O)CC1	ZINC000179565477	1294805077	/nfs/dbraw/zinc/80/50/77/1294805077.db2.gz	UQGQNEDAOUCWHO-UHFFFAOYSA-N	0	3	344.418	3.134	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)COc1c(C)cc(C)cc1C	ZINC000193370343	1295858672	/nfs/dbraw/zinc/85/86/72/1295858672.db2.gz	MKWOWAWFQPHQDP-MRXNPFEDSA-N	0	3	330.428	3.006	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)CCc1cccs1	ZINC000193470348	1295871974	/nfs/dbraw/zinc/87/19/74/1295871974.db2.gz	OMTXTQFCIOZUEW-ZDUSSCGKSA-N	0	3	328.393	3.037	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCCC[C@H]1CNCc1ccc(C#N)s1	ZINC000226265196	1296138814	/nfs/dbraw/zinc/13/88/14/1296138814.db2.gz	AVPKKCWUFOXUJX-ZDUSSCGKSA-N	0	3	335.473	3.499	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CNCc2ccc(N(C)C)c(F)c2)cc1	ZINC000237577560	1296251471	/nfs/dbraw/zinc/25/14/71/1296251471.db2.gz	YGRLRWUGYCMFKS-CQSZACIVSA-N	0	3	327.403	3.472	20	30		EGEDHN
N#CC(C(=O)C=CSc1ccccc1)c1nnc2n1CCCCC2	ZINC000255544080	1296544689	/nfs/dbraw/zinc/54/46/89/1296544689.db2.gz	MEDRCCPUHAPZJZ-WQTVUKCASA-N	0	3	338.436	3.487	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CNC[C@@H](O)c2c(F)cccc2F)cc1	ZINC000304344044	1296922644	/nfs/dbraw/zinc/92/26/44/1296922644.db2.gz	ZESVBIGXZUWNJM-YVEFUNNKSA-N	0	3	332.350	3.079	20	30		EGEDHN
C[C@@H](CNC1CC(C#N)(c2ccccc2)C1)NC(=O)OC(C)(C)C	ZINC000379818601	1297540742	/nfs/dbraw/zinc/54/07/42/1297540742.db2.gz	SZOIZPOTAKNLDO-ASFAAARLSA-N	0	3	329.444	3.113	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@@H]1CNCc1ccc(C#N)c(F)c1	ZINC000404701727	1297759546	/nfs/dbraw/zinc/75/95/46/1297759546.db2.gz	YZUOSZUQIRMFPP-OAHLLOKOSA-N	0	3	333.407	3.186	20	30		EGEDHN
CC(C)(C)OC(=O)NCCN1CCC(c2ccc(C#N)cc2)CC1	ZINC000616619506	1298098355	/nfs/dbraw/zinc/09/83/55/1298098355.db2.gz	KEXACLWIBSRBAT-UHFFFAOYSA-N	0	3	329.444	3.262	20	30		EGEDHN
C[C@H]1CCN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(C#N)cc1	ZINC000716261121	1298295826	/nfs/dbraw/zinc/29/58/26/1298295826.db2.gz	DFZAYRMMBFUDAG-JXFKEZNVSA-N	0	3	333.435	3.199	20	30		EGEDHN
COc1ccc(C[NH2+]Cc2ccccc2[O-])cc1OCCCC#N	ZINC000725851401	1298376606	/nfs/dbraw/zinc/37/66/06/1298376606.db2.gz	OUXFLTHUZXLYNJ-UHFFFAOYSA-N	0	3	326.396	3.373	20	30		EGEDHN
C=C(Cl)C[C@H](N)C(=O)NCc1ccc(-c2csc(C)n2)s1	ZINC000876565498	1298832864	/nfs/dbraw/zinc/83/28/64/1298832864.db2.gz	KHAPMEAQKTWXQD-NSHDSACASA-N	0	3	341.889	3.266	20	30		EGEDHN
CON=Cc1ccc(-c2nc(-c3ccc(CN(C)C)cc3)no2)cc1	ZINC000747864230	1298874639	/nfs/dbraw/zinc/87/46/39/1298874639.db2.gz	VJZNNYFCXSNSAF-UHFFFAOYSA-N	0	3	336.395	3.446	20	30		EGEDHN
CCCN(CC(=O)C(C#N)c1nc2ccccc2s1)CC(F)F	ZINC000748311601	1298981795	/nfs/dbraw/zinc/98/17/95/1298981795.db2.gz	CAXJDCNJDINFPL-LLVKDONJSA-N	0	3	337.395	3.450	20	30		EGEDHN
C#Cc1ccc(CN2CCC(NC(=O)c3ccc(C)cc3)CC2)cc1	ZINC000877672316	1299468273	/nfs/dbraw/zinc/46/82/73/1299468273.db2.gz	BOSUCBSFLJDPLG-UHFFFAOYSA-N	0	3	332.447	3.371	20	30		EGEDHN
C#Cc1ccc(CN2CCC(NC(=O)c3cccc(C)c3)CC2)cc1	ZINC000877694985	1299488723	/nfs/dbraw/zinc/48/87/23/1299488723.db2.gz	VZQMJLNZIQXNDM-UHFFFAOYSA-N	0	3	332.447	3.371	20	30		EGEDHN
CC(=O)[C@@](C#N)(CCN1CC[C@@H](c2cccnc2)C1)c1ccccc1	ZINC000878761168	1300178755	/nfs/dbraw/zinc/17/87/55/1300178755.db2.gz	UMOLNWNYXMNWHA-CTNGQTDRSA-N	0	3	333.435	3.312	20	30		EGEDHN
Cc1ccc2ncc(C=NN=c3[nH]c4cc(F)c(F)cc4[nH]3)n2c1	ZINC000755632486	1300369284	/nfs/dbraw/zinc/36/92/84/1300369284.db2.gz	UPUVPKLCTDTHHR-UHFFFAOYSA-N	0	3	326.310	3.243	20	30		EGEDHN
C#CC[C@H](NC(=O)NC[C@@H](c1ccccc1)N(C)C)c1ccccc1	ZINC000757064705	1300627690	/nfs/dbraw/zinc/62/76/90/1300627690.db2.gz	MXNSJPPSQKJMBN-PMACEKPBSA-N	0	3	335.451	3.353	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN[C@H]2CC(=O)N(C3CCCCC3)C2)cc1	ZINC000757925005	1300758727	/nfs/dbraw/zinc/75/87/27/1300758727.db2.gz	QHPDQDXFNRMFHY-WBVHZDCISA-N	0	3	341.455	3.001	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@H](C)Oc1ccc(Cl)cc1	ZINC000759430216	1301089348	/nfs/dbraw/zinc/08/93/48/1301089348.db2.gz	OZYOLCDEZHGNCN-SWLSCSKDSA-N	0	3	336.819	3.123	20	30		EGEDHN
C[C@@H](N)c1cn(CCC(C#N)(c2ccccc2)c2ccccc2)nn1	ZINC000881038658	1301403771	/nfs/dbraw/zinc/40/37/71/1301403771.db2.gz	HIINVYSRZMIIDQ-MRXNPFEDSA-N	0	3	331.423	3.198	20	30		EGEDHN
COC(=O)N[C@@H](C)C(=O)C(C#N)c1nc(-c2ccc(C)cc2)cs1	ZINC000762026051	1301594159	/nfs/dbraw/zinc/59/41/59/1301594159.db2.gz	HIWMDQIDGPCCMC-WCQYABFASA-N	0	3	343.408	3.039	20	30		EGEDHN
CCCCCCCC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1CO	ZINC000762111393	1301615875	/nfs/dbraw/zinc/61/58/75/1301615875.db2.gz	KFJLTHXRNABONI-PMACEKPBSA-N	0	3	346.515	3.346	20	30		EGEDHN
COc1cc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)ccc1F	ZINC000763478936	1301911577	/nfs/dbraw/zinc/91/15/77/1301911577.db2.gz	RKERSGJRGQPELR-LLVKDONJSA-N	0	3	346.745	3.449	20	30		EGEDHN
CC[C@H](C)c1ccc(NC(=O)C(C#N)C(=O)[C@@H]2C[C@@]23CCOC3)cc1	ZINC000764755339	1302128025	/nfs/dbraw/zinc/12/80/25/1302128025.db2.gz	FDTKOYJSHXYWAW-DGELGTTISA-N	0	3	340.423	3.274	20	30		EGEDHN
C=CC[C@@H](NC(=O)NC[C@@H]1CCCCN1C1CC1)c1ccncc1	ZINC000765498899	1302272474	/nfs/dbraw/zinc/27/24/74/1302272474.db2.gz	JVXQEDLXVRXPPS-ZWKOTPCHSA-N	0	3	328.460	3.015	20	30		EGEDHN
C[C@@H]1CCN(Cc2cc(=O)n3c4ccccc4[nH]c3c2C#N)C[C@H]1C	ZINC000766984518	1302557692	/nfs/dbraw/zinc/55/76/92/1302557692.db2.gz	MKTZYSMFKCAOFF-FMKPAKJESA-N	0	3	334.423	3.202	20	30		EGEDHN
N#C[C@@H]1CNCC12CC(C(=O)N[C@@H](c1ccccc1)C1CCCC1)C2	ZINC000884095750	1302730297	/nfs/dbraw/zinc/73/02/97/1302730297.db2.gz	YEWQTIFZYDLGNR-LSNYBQGISA-N	0	3	337.467	3.173	20	30		EGEDHN
CC(C)[N@H+](Cc1ccc(C#N)cc1)Cc1cc2c(cc1[O-])OC[C@@H]2O	ZINC000768441537	1302903299	/nfs/dbraw/zinc/90/32/99/1302903299.db2.gz	ZYNHHGOATIKYTB-IBGZPJMESA-N	0	3	338.407	3.100	20	30		EGEDHN
CC(C)[N@@H+](Cc1ccc(C#N)cc1)Cc1cc2c(cc1[O-])OC[C@@H]2O	ZINC000768441537	1302903308	/nfs/dbraw/zinc/90/33/08/1302903308.db2.gz	ZYNHHGOATIKYTB-IBGZPJMESA-N	0	3	338.407	3.100	20	30		EGEDHN
C#C[C@H](C)N(C)C[C@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000769962069	1303198792	/nfs/dbraw/zinc/19/87/92/1303198792.db2.gz	PVJDROYXGXPYQA-IRXDYDNUSA-N	0	3	325.408	3.172	20	30		EGEDHN
C#CCOc1ccc([C@@H](C)N[C@@H]2CCN(Cc3ccccc3)C2=O)cc1	ZINC000772950487	1303597426	/nfs/dbraw/zinc/59/74/26/1303597426.db2.gz	LPTJUDGNCHKWPX-DYESRHJHSA-N	0	3	348.446	3.150	20	30		EGEDHN
C[C@H](N[C@@H](C)c1ccc(N(C)C)cc1)C(=O)Nc1cccc(C#N)c1	ZINC000774478536	1303815277	/nfs/dbraw/zinc/81/52/77/1303815277.db2.gz	GXLZZLKIHOEEDP-GJZGRUSLSA-N	0	3	336.439	3.302	20	30		EGEDHN
CC[C@](C)(NCCS(=O)(=O)c1ccc(C#N)cc1)c1ccccc1	ZINC000775386703	1303951972	/nfs/dbraw/zinc/95/19/72/1303951972.db2.gz	FXSULLKJQSACOI-IBGZPJMESA-N	0	3	342.464	3.247	20	30		EGEDHN
C#CCN(C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCc2ccccc21	ZINC000776580089	1304173730	/nfs/dbraw/zinc/17/37/30/1304173730.db2.gz	QZYWNPCQTJIRGL-UXHICEINSA-N	0	3	336.391	3.251	20	30		EGEDHN
CN1CCC(N(C(=O)Cc2ccccc2CC#N)c2ccccc2)CC1	ZINC000776823372	1304205944	/nfs/dbraw/zinc/20/59/44/1304205944.db2.gz	BFUXIKDFVGHCPR-UHFFFAOYSA-N	0	3	347.462	3.423	20	30		EGEDHN
N#CCc1ccccc1CC(=O)N1CCCN(Cc2ccccc2)CC1	ZINC000777287049	1304279001	/nfs/dbraw/zinc/27/90/01/1304279001.db2.gz	IOMAZAHREQKGEY-UHFFFAOYSA-N	0	3	347.462	3.030	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)Cc3cccc([N+](=O)[O-])c3)nc21	ZINC000777320153	1304282754	/nfs/dbraw/zinc/28/27/54/1304282754.db2.gz	DUIUMDXUZIKUGX-AWEZNQCLSA-N	0	3	334.335	3.199	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CN1CC[C@H](Cc2cnn(C)c2)C1	ZINC000779164988	1304536247	/nfs/dbraw/zinc/53/62/47/1304536247.db2.gz	WTCFQTFOTFPUQC-OAHLLOKOSA-N	0	3	343.858	3.150	20	30		EGEDHN
C#CCCCCCC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1	ZINC000779935169	1304623975	/nfs/dbraw/zinc/62/39/75/1304623975.db2.gz	HAQYQXBEKPFUDZ-UHFFFAOYSA-N	0	3	336.426	3.439	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(F)c(Cl)c1)C(=O)[C@@H]1CCCCS1	ZINC000783353134	1305082719	/nfs/dbraw/zinc/08/27/19/1305082719.db2.gz	PLPIAORMCIEBFS-MFKMUULPSA-N	0	3	340.807	3.412	20	30		EGEDHN
Cc1cc(F)ncc1CN1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC000891540319	1305085050	/nfs/dbraw/zinc/08/50/50/1305085050.db2.gz	LVRRBJSKPHDYRP-UHFFFAOYSA-N	0	3	338.430	3.109	20	30		EGEDHN
CC(C)Cn1ccc(C(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)n1	ZINC000892493515	1305404239	/nfs/dbraw/zinc/40/42/39/1305404239.db2.gz	LAUOXYBSTYXOEK-AWEZNQCLSA-N	0	3	344.802	3.154	20	30		EGEDHN
N#Cc1cccc(OCCCOC(=O)[C@H]2CCCN2C2CCCC2)c1	ZINC000786877641	1305644100	/nfs/dbraw/zinc/64/41/00/1305644100.db2.gz	DUZNKPUHUKAOPF-LJQANCHMSA-N	0	3	342.439	3.277	20	30		EGEDHN
C#CCC1(C(=O)NC[C@H](Cc2ccccc2)N(C)C)CCCCC1	ZINC000788134878	1305875428	/nfs/dbraw/zinc/87/54/28/1305875428.db2.gz	MIQORPXJQKMFAD-IBGZPJMESA-N	0	3	326.484	3.249	20	30		EGEDHN
Cc1c(CNCc2ccc(O[C@@H](C)C#N)cc2)cccc1[N+](=O)[O-]	ZINC000790995712	1308906470	/nfs/dbraw/zinc/90/64/70/1308906470.db2.gz	CCRSSIGHSMQCQH-ZDUSSCGKSA-N	0	3	325.368	3.484	20	30		EGEDHN
CN1CCCC(C)(C)[C@@H]1CNC(=O)c1ccccc1SCC#N	ZINC000791146002	1308928281	/nfs/dbraw/zinc/92/82/81/1308928281.db2.gz	CTKRUIUTFBASCT-INIZCTEOSA-N	0	3	331.485	3.152	20	30		EGEDHN
COC1(CC(=O)C(C#N)C(=O)Nc2cccc3ccccc32)CCC1	ZINC000791772088	1309060665	/nfs/dbraw/zinc/06/06/65/1309060665.db2.gz	VYNAIYZEHGRYOQ-MRXNPFEDSA-N	0	3	336.391	3.446	20	30		EGEDHN
N#CC(C(=O)c1cccc(C2OCCO2)c1)c1cnc2ccccc2n1	ZINC000792107409	1309121189	/nfs/dbraw/zinc/12/11/89/1309121189.db2.gz	FLSAHXJXTACMBL-HNNXBMFYSA-N	0	3	345.358	3.165	20	30		EGEDHN
C[C@@H](CC(C)(C)C#N)NC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000895980291	1309627778	/nfs/dbraw/zinc/62/77/78/1309627778.db2.gz	SWWGLSFZOADBFG-BBRMVZONSA-N	0	3	327.428	3.032	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN2CCC(Nc3ccccn3)CC2)cc1	ZINC000896197319	1309739637	/nfs/dbraw/zinc/73/96/37/1309739637.db2.gz	AOJAVWWJDLNMJF-INIZCTEOSA-N	0	3	336.439	3.449	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCN2CCC(F)(F)CC2)cc1Cl	ZINC000796542443	1310024848	/nfs/dbraw/zinc/02/48/48/1310024848.db2.gz	GIUAIEBKGGPRQL-UHFFFAOYSA-N	0	3	327.762	3.271	20	30		EGEDHN
C#CCN(Cc1ccccc1)C[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000796633324	1310050461	/nfs/dbraw/zinc/05/04/61/1310050461.db2.gz	RZJOXRNCGAITPO-SFHVURJKSA-N	0	3	328.456	3.379	20	30		EGEDHN
C#CCOc1ccccc1CN[C@H](C)c1ccccc1-n1ccnn1	ZINC000796816527	1310093742	/nfs/dbraw/zinc/09/37/42/1310093742.db2.gz	KQIOBKRRFZGTHW-MRXNPFEDSA-N	0	3	332.407	3.130	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)[C@H]1CCC(F)(F)C1)c1ccccc1	ZINC000796894867	1310106076	/nfs/dbraw/zinc/10/60/76/1310106076.db2.gz	ZMJHAEZPVROUMZ-ZNMIVQPWSA-N	0	3	334.366	3.398	20	30		EGEDHN
CC[C@H](C)[C@H](NC(C)=O)C(=O)C(C#N)c1nc2cc(F)ccc2s1	ZINC000796994258	1310121497	/nfs/dbraw/zinc/12/14/97/1310121497.db2.gz	DAMIAGOIQJMSDV-FMSQNYNMSA-N	0	3	347.415	3.162	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000822262102	1320065117	/nfs/dbraw/zinc/06/51/17/1320065117.db2.gz	UYPUCIBXVJRMDR-HXUWFJFHSA-N	0	3	348.446	3.093	20	30		EGEDHN
CC[C@@H](NC(=O)C(C#N)C(=O)COC(C)(C)CC)c1ccccc1	ZINC000838866463	1320826165	/nfs/dbraw/zinc/82/61/65/1320826165.db2.gz	PIOQJHFRXUVDRZ-JKSUJKDBSA-N	0	3	330.428	3.168	20	30		EGEDHN
C#C[C@H](NCCC(=O)Nc1cc(Cl)ccc1Cl)[C@@H]1CCCO1	ZINC000839565558	1320938518	/nfs/dbraw/zinc/93/85/18/1320938518.db2.gz	YRHDXVDPMCLCOJ-ZFWWWQNUSA-N	0	3	341.238	3.092	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)C[C@@H]3C=CCCC3)C2)s1	ZINC001019029128	1317012479	/nfs/dbraw/zinc/01/24/79/1317012479.db2.gz	NDLYUSUZYZFCMD-CABCVRRESA-N	0	3	329.469	3.057	20	30		EGEDHN
C=C(C)CN1CCC([NH2+]Cc2c([O-])cccc2Br)CC1	ZINC000858128655	1328690889	/nfs/dbraw/zinc/69/08/89/1328690889.db2.gz	XKFZDOKXFHBEQO-UHFFFAOYSA-N	0	3	339.277	3.285	20	30		EGEDHN
Cc1ccsc1C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001019940625	1317468141	/nfs/dbraw/zinc/46/81/41/1317468141.db2.gz	PXICYNAPVPKVDH-SHTZXODSSA-N	0	3	343.427	3.118	20	30		EGEDHN
C=C(C)CNC(=S)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000806599615	1317510378	/nfs/dbraw/zinc/51/03/78/1317510378.db2.gz	VCGFMECSLHRDAQ-KRWDZBQOSA-N	0	3	335.517	3.117	20	30		EGEDHN
C[C@H](N[C@H]1C[C@H](NC(=O)c2c[nH]c(C#N)c2)C1)c1ccccc1Cl	ZINC001020086018	1317539898	/nfs/dbraw/zinc/53/98/98/1317539898.db2.gz	HCOZFIMEVBZBRB-UBHSHLNASA-N	0	3	342.830	3.151	20	30		EGEDHN
C[C@]1(C(=O)N[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)CC=CCC1	ZINC001020193394	1317587794	/nfs/dbraw/zinc/58/77/94/1317587794.db2.gz	UAQIHNWXURLOOC-ZWOKBUDYSA-N	0	3	341.430	3.181	20	30		EGEDHN
CC[C@H](NCc1cccc(CS(C)(=O)=O)c1)c1cccc(C#N)c1	ZINC000902783415	1317615619	/nfs/dbraw/zinc/61/56/19/1317615619.db2.gz	DAWXWBJCHBIUDQ-IBGZPJMESA-N	0	3	342.464	3.344	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)Cc2ccc(C)cc2Cl)C1	ZINC001020307875	1317638705	/nfs/dbraw/zinc/63/87/05/1317638705.db2.gz	UQNKYZWIHPUXJP-HDJSIYSDSA-N	0	3	327.255	3.180	20	30		EGEDHN
CC[C@@H](N[C@@H](C)C(=O)NCCc1ccccc1)c1cccc(C#N)c1	ZINC000903010402	1317639156	/nfs/dbraw/zinc/63/91/56/1317639156.db2.gz	LIIDSMDIXAZWRD-OXJNMPFZSA-N	0	3	335.451	3.346	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cccc(-n3cccc3)c2)C1	ZINC001020362879	1317662178	/nfs/dbraw/zinc/66/21/78/1317662178.db2.gz	RCUXIVRZABJDHN-WKILWMFISA-N	0	3	329.831	3.080	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1)C(=O)c1cncc(C(F)(F)F)c1	ZINC000808979321	1317756040	/nfs/dbraw/zinc/75/60/40/1317756040.db2.gz	HUFZTRNHQAUZKP-ZDUSSCGKSA-N	0	3	333.269	3.062	20	30		EGEDHN
C=C[C@H](CC)Cc1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1	ZINC000904000244	1317765210	/nfs/dbraw/zinc/76/52/10/1317765210.db2.gz	YGJJQRCEZVIGLV-OAHLLOKOSA-N	0	3	341.459	3.028	20	30		EGEDHN
C[C@@H]1CCC[C@]1(C)C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001020555777	1317769006	/nfs/dbraw/zinc/76/90/06/1317769006.db2.gz	RGWAZDZRVZWEDY-RKURPORMSA-N	0	3	343.446	3.260	20	30		EGEDHN
CCOc1cc(/C=C2/C(=O)c3ncnn3C2C)ccc1OC(F)F	ZINC000905080260	1317920309	/nfs/dbraw/zinc/92/03/09/1317920309.db2.gz	JPAWUCKWTHSLJJ-VKRGWIQLSA-N	0	3	335.310	3.119	20	30		EGEDHN
CCCOc1c(/C=C2\C(=O)c3ncnn3C2C)cccc1OCC	ZINC000905081933	1317921635	/nfs/dbraw/zinc/92/16/35/1317921635.db2.gz	UTTJQPPNEIRQKE-GVIGZQTCSA-N	0	3	327.384	3.307	20	30		EGEDHN
CC1/C(=C/c2ccc(C(=O)OC(C)(C)C)cc2)C(=O)c2ncnn21	ZINC000905087249	1317922187	/nfs/dbraw/zinc/92/21/87/1317922187.db2.gz	WSZVNHQFXFXXBE-RLIURORJSA-N	0	3	325.368	3.074	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)c2ccccc2Cl)C1	ZINC001020960921	1318017095	/nfs/dbraw/zinc/01/70/95/1318017095.db2.gz	YIXCIQVKEYQMQA-XYPYZODXSA-N	0	3	343.652	3.099	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)[C@@H]1CCCSC1)c1ccccc1	ZINC000810710774	1318047190	/nfs/dbraw/zinc/04/71/90/1318047190.db2.gz	VEZSPVBLUTXRFO-PMPSAXMXSA-N	0	3	330.453	3.106	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc(COC(C)C)cc2)C1	ZINC001021035373	1318056305	/nfs/dbraw/zinc/05/63/05/1318056305.db2.gz	LEEQXLMTSJFPSL-QAQDUYKDSA-N	0	3	336.863	3.215	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)C2CC(c3ccc(F)cc3)C2)C1	ZINC001021136118	1318109317	/nfs/dbraw/zinc/10/93/17/1318109317.db2.gz	OLEOHOUHUSMDDL-UNUDIURISA-N	0	3	336.838	3.309	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc(N(C)C(C)C)cc2)C1	ZINC001021134485	1318109622	/nfs/dbraw/zinc/10/96/22/1318109622.db2.gz	PPSARLVKHYHDGN-WKILWMFISA-N	0	3	335.879	3.134	20	30		EGEDHN
C#Cc1ccc(C(=O)NC2C[C@H]3CC[C@@H](C2)N3C/C=C/Cl)cc1	ZINC001021342021	1318197723	/nfs/dbraw/zinc/19/77/23/1318197723.db2.gz	HRMJGWDBGCNTQJ-ATJKGOHWSA-N	0	3	328.843	3.146	20	30		EGEDHN
Cc1cccc(Cl)c1CNC[C@@H]1CCCCN1C(=O)[C@H](C)C#N	ZINC000959920244	1318266234	/nfs/dbraw/zinc/26/62/34/1318266234.db2.gz	RUOGLTYQSBSFCV-CABCVRRESA-N	0	3	333.863	3.279	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)CC2CCC2)c(F)c1	ZINC000959935951	1318275548	/nfs/dbraw/zinc/27/55/48/1318275548.db2.gz	DRBGZXLRBAGXHM-SFHVURJKSA-N	0	3	343.446	3.358	20	30		EGEDHN
C#C[C@H](NC(=O)NC[C@H](c1cccs1)N1CCCC1)C(C)(C)C	ZINC000811992721	1318303417	/nfs/dbraw/zinc/30/34/17/1318303417.db2.gz	LSDKHJCZKHVJKT-ZBFHGGJFSA-N	0	3	333.501	3.232	20	30		EGEDHN
CC(F)(F)C(=O)N1CCC[C@H]2CN(Cc3ccc(C#N)cc3)CC[C@H]21	ZINC001021502686	1318314776	/nfs/dbraw/zinc/31/47/76/1318314776.db2.gz	OOBUYNUBEDFKIS-DLBZAZTESA-N	0	3	347.409	3.026	20	30		EGEDHN
C=C(C)CC[N@@H+]1CC[C@H]2[C@@H](CCCN2C(=O)c2ccccc2[O-])C1	ZINC001021529289	1318367936	/nfs/dbraw/zinc/36/79/36/1318367936.db2.gz	LYVXGBRTQRWYAJ-WMZOPIPTSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=C(C)CC[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)c2ccccc2[O-])C1	ZINC001021529289	1318367942	/nfs/dbraw/zinc/36/79/42/1318367942.db2.gz	LYVXGBRTQRWYAJ-WMZOPIPTSA-N	0	3	328.456	3.285	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)[C@H]2CC23CCC3)s1	ZINC000960153934	1318388670	/nfs/dbraw/zinc/38/86/70/1318388670.db2.gz	KRPNUQJQSXFISL-WMLDXEAASA-N	0	3	343.496	3.281	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@H](CCCN3C(=O)/C=C/C3CC3)C2)cc1	ZINC001021550566	1318390343	/nfs/dbraw/zinc/39/03/43/1318390343.db2.gz	IMHLAPLSDIFZKD-XMHHWPDXSA-N	0	3	349.478	3.337	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@H](CCCN3C(=O)c3cc[nH]c3)C2)c1	ZINC001021592431	1318438657	/nfs/dbraw/zinc/43/86/57/1318438657.db2.gz	RPLHKTVVCMZYAA-UXHICEINSA-N	0	3	348.450	3.013	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc2cc[nH]c2n1	ZINC000960276855	1318439472	/nfs/dbraw/zinc/43/94/72/1318439472.db2.gz	VVSSKULLHHKNEA-RTBURBONSA-N	0	3	346.434	3.124	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc(C)ccc1OC	ZINC000960280156	1318442620	/nfs/dbraw/zinc/44/26/20/1318442620.db2.gz	LIMVSJWAEMWEFZ-UYAOXDASSA-N	0	3	336.435	3.175	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc(C(C)(C)C)on1	ZINC000960283171	1318443886	/nfs/dbraw/zinc/44/38/86/1318443886.db2.gz	MMDSRGUMTJAJHB-CRAIPNDOSA-N	0	3	339.439	3.144	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)C[C@H]1CC(C)(C)CO1	ZINC000960287400	1318445701	/nfs/dbraw/zinc/44/57/01/1318445701.db2.gz	ILIKRLKRHIUETP-ILZDJORESA-N	0	3	342.483	3.140	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)C[C@@H]1CCC(C)(C)CO1	ZINC000960292597	1318446838	/nfs/dbraw/zinc/44/68/38/1318446838.db2.gz	YPQLBBFFLZMBDS-ILZDJORESA-N	0	3	342.483	3.140	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)C[C@@H]1CCCC1(F)F	ZINC000960300853	1318450480	/nfs/dbraw/zinc/45/04/80/1318450480.db2.gz	TVAURKFMOOLFQL-YXJHDRRASA-N	0	3	334.410	3.370	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCC[C@@H]2CN(C/C=C\Cl)CC[C@@H]21	ZINC001021604815	1318451519	/nfs/dbraw/zinc/45/15/19/1318451519.db2.gz	GTEGTMNSXSJHOU-BRLJPEOMSA-N	0	3	347.890	3.353	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cccc2c1ccn2C	ZINC000960317085	1318457857	/nfs/dbraw/zinc/45/78/57/1318457857.db2.gz	NYTMUWGWXXZJBM-TZIWHRDSSA-N	0	3	345.446	3.350	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1csc(C2CC2)n1	ZINC000960334040	1318467171	/nfs/dbraw/zinc/46/71/71/1318467171.db2.gz	RULSFMQEQXGLMG-NVXWUHKLSA-N	0	3	339.464	3.192	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cnc(C(C)C)s1	ZINC000960353042	1318473450	/nfs/dbraw/zinc/47/34/50/1318473450.db2.gz	ASYSPTQFFXVACA-NVXWUHKLSA-N	0	3	341.480	3.438	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(C)c(F)c2)C1	ZINC001021627690	1318481008	/nfs/dbraw/zinc/48/10/08/1318481008.db2.gz	OTLQSQCVRVSKIZ-PKOBYXMFSA-N	0	3	328.431	3.084	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(C)cc(Cl)c2)C1	ZINC001021631881	1318484840	/nfs/dbraw/zinc/48/48/40/1318484840.db2.gz	BYSSAFJBFFGYBR-MAUKXSAKSA-N	0	3	330.859	3.208	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc3cc(C)ccc3[nH]2)C1	ZINC001021646884	1318503577	/nfs/dbraw/zinc/50/35/77/1318503577.db2.gz	SXWYOMHDTVCTNB-OXJNMPFZSA-N	0	3	335.451	3.036	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cccc(Cl)c2F)C1	ZINC001021658126	1318519766	/nfs/dbraw/zinc/51/97/66/1318519766.db2.gz	KIFKZFJBNCCGIT-RHSMWYFYSA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc3ccccc3n2C)C1	ZINC001021661693	1318523270	/nfs/dbraw/zinc/52/32/70/1318523270.db2.gz	RBWBJNSGCORUEK-AZUAARDMSA-N	0	3	349.478	3.128	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc3ccccc3n2C)C1	ZINC001021661695	1318523995	/nfs/dbraw/zinc/52/39/95/1318523995.db2.gz	RBWBJNSGCORUEK-ICSRJNTNSA-N	0	3	349.478	3.128	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc3occc3s2)C1	ZINC001021667010	1318529238	/nfs/dbraw/zinc/52/92/38/1318529238.db2.gz	FECUGYOORVYEIG-ZIAGYGMSSA-N	0	3	328.437	3.054	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(Cl)ccc2C)C1	ZINC001021694590	1318569008	/nfs/dbraw/zinc/56/90/08/1318569008.db2.gz	XICVBPNPMDHOKA-YJBOKZPZSA-N	0	3	330.859	3.208	20	30		EGEDHN
COc1cccc(CN2CCC(Nc3ccc(C#N)c(C)n3)CC2)c1	ZINC000813587695	1318597930	/nfs/dbraw/zinc/59/79/30/1318597930.db2.gz	ONZXRHXPXSZXAJ-UHFFFAOYSA-N	0	3	336.439	3.347	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2sccc2C(F)F)C1	ZINC001021723215	1318610815	/nfs/dbraw/zinc/61/08/15/1318610815.db2.gz	SBKLTDUKTNLZRN-TZMCWYRMSA-N	0	3	338.423	3.245	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)Cc2ccccc2Cl)C1	ZINC001021726318	1318619101	/nfs/dbraw/zinc/61/91/01/1318619101.db2.gz	BCNFJRDQASRSLD-MJGOQNOKSA-N	0	3	344.886	3.219	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc3ccccc3o2)C1	ZINC001021726668	1318620211	/nfs/dbraw/zinc/62/02/11/1318620211.db2.gz	FFBZKPBVBAPFKO-ZWKOTPCHSA-N	0	3	336.435	3.383	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(F)cc2Cl)C1	ZINC001021728769	1318628343	/nfs/dbraw/zinc/62/83/43/1318628343.db2.gz	VSXDHOBYWIRWBC-GUYCJALGSA-N	0	3	334.822	3.039	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cnc(C(C)(C)C)s2)C1	ZINC001021739938	1318650995	/nfs/dbraw/zinc/65/09/95/1318650995.db2.gz	PEDHEZGPYXOGMN-CABCVRRESA-N	0	3	345.512	3.000	20	30		EGEDHN
C[C@@H](c1ccc(F)cc1)N(C)C[C@H]1CCCN1C(=O)C#CC1CC1	ZINC000960618133	1318744913	/nfs/dbraw/zinc/74/49/13/1318744913.db2.gz	OTTLOWAZSDKBTN-HNAYVOBHSA-N	0	3	328.431	3.223	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)C1C=CC=CC=C1	ZINC000960663853	1318781398	/nfs/dbraw/zinc/78/13/98/1318781398.db2.gz	PFCNYPIKXXZMGB-NRFANRHFSA-N	0	3	347.462	3.279	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)C1C=CC=CC=C1	ZINC000960663855	1318782160	/nfs/dbraw/zinc/78/21/60/1318782160.db2.gz	PFCNYPIKXXZMGB-OAQYLSRUSA-N	0	3	347.462	3.279	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc(C(F)F)ccc2F)C1	ZINC001022091447	1318793588	/nfs/dbraw/zinc/79/35/88/1318793588.db2.gz	ZIEXEHPGWBZUJZ-PHIMTYICSA-N	0	3	332.753	3.366	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@@H]1CN(C)Cc1ccc(C#N)cc1)C1CCC1	ZINC000960712810	1318817188	/nfs/dbraw/zinc/81/71/88/1318817188.db2.gz	SYXIRHYQYZRNRQ-OXQOHEQNSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc(C3CCCCC3)n[nH]2)C1	ZINC001022213432	1318845849	/nfs/dbraw/zinc/84/58/49/1318845849.db2.gz	FECACMYIQORAHN-OKILXGFUSA-N	0	3	336.867	3.060	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N(C)Cc1ccccc1OC(F)(F)F	ZINC000912220961	1318850877	/nfs/dbraw/zinc/85/08/77/1318850877.db2.gz	JHQRXTRHKVIVNR-ZDUSSCGKSA-N	0	3	330.350	3.227	20	30		EGEDHN
C#CCN(CC)C[C@@](C)(O)c1ccc(Br)cc1Cl	ZINC000815058750	1318878570	/nfs/dbraw/zinc/87/85/70/1318878570.db2.gz	RTJRGVYGTSEJNX-CQSZACIVSA-N	0	3	330.653	3.265	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N[C@@H](C)c1ccc(OC(C)C)c(OC)c1	ZINC000912391137	1318881388	/nfs/dbraw/zinc/88/13/88/1318881388.db2.gz	PJAPLWLZVJDVHC-HOCLYGCPSA-N	0	3	334.460	3.343	20	30		EGEDHN
Cc1cocc1C(=O)N1CCC[C@H]1CN(C)Cc1ccc(C#N)cc1	ZINC000960793042	1318900732	/nfs/dbraw/zinc/90/07/32/1318900732.db2.gz	SZUGSXAYTMDWDA-SFHVURJKSA-N	0	3	337.423	3.196	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@H]2CC[C@H]2c2ccc(F)cc2)C1	ZINC001022486029	1318959735	/nfs/dbraw/zinc/95/97/35/1318959735.db2.gz	DQJXHUPMIYOJOF-YVSFHVDLSA-N	0	3	336.838	3.309	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2sccc2-n2cccc2)C1	ZINC001022517871	1318975537	/nfs/dbraw/zinc/97/55/37/1318975537.db2.gz	XNUJQXFKFMWTRY-BETUJISGSA-N	0	3	335.860	3.142	20	30		EGEDHN
CC1(C)CC[C@H](C(=O)N[C@H]2C[C@@H](NCc3cc(C#N)ccc3F)C2)C1	ZINC001022675611	1319061530	/nfs/dbraw/zinc/06/15/30/1319061530.db2.gz	MCMZSEFXLIXRDJ-BHYGNILZSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc(C(F)F)c(F)c2)C1	ZINC001022701429	1319076721	/nfs/dbraw/zinc/07/67/21/1319076721.db2.gz	BSSAYGFZGCSZEH-PHIMTYICSA-N	0	3	332.753	3.366	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2)C1	ZINC001022838108	1319132746	/nfs/dbraw/zinc/13/27/46/1319132746.db2.gz	CYSWRASKQPTTCF-XUWVNRHRSA-N	0	3	339.266	3.433	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@]2(c3ccccc3)CC2(C)C)C1	ZINC001022880150	1319147500	/nfs/dbraw/zinc/14/75/00/1319147500.db2.gz	IYKGJTGHGJUHBH-JTDSTZFVSA-N	0	3	332.875	3.344	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc(-c3ccccc3)ccn2)C1	ZINC001022887448	1319149978	/nfs/dbraw/zinc/14/99/78/1319149978.db2.gz	BXKVPASDAMEXMO-CALCHBBNSA-N	0	3	341.842	3.352	20	30		EGEDHN
CCC(=O)N1CCC[C@@H]([C@@H]2CCN(Cc3ccc(F)c(C#N)c3)C2)C1	ZINC000961080830	1319194327	/nfs/dbraw/zinc/19/43/27/1319194327.db2.gz	SIPRCGLVHIQZLO-IAGOWNOFSA-N	0	3	343.446	3.168	20	30		EGEDHN
C#Cc1ccc(CNCCCS(=O)(=O)c2ccc(Cl)cc2)cc1	ZINC000816668636	1319205804	/nfs/dbraw/zinc/20/58/04/1319205804.db2.gz	UDKAZHQDIFMUDB-UHFFFAOYSA-N	0	3	347.867	3.275	20	30		EGEDHN
C=C(C)C[N@@H+]1CC[C@H]([C@@H]2CCCN(C(=O)c3ccccc3[O-])C2)C1	ZINC000961099834	1319211784	/nfs/dbraw/zinc/21/17/84/1319211784.db2.gz	ZRIYCWZSMLRAMN-SJORKVTESA-N	0	3	328.456	3.142	20	30		EGEDHN
C=C(C)C[N@H+]1CC[C@H]([C@@H]2CCCN(C(=O)c3ccccc3[O-])C2)C1	ZINC000961099834	1319211794	/nfs/dbraw/zinc/21/17/94/1319211794.db2.gz	ZRIYCWZSMLRAMN-SJORKVTESA-N	0	3	328.456	3.142	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)[C@@]2(C)CC=C(C)CC2)C1	ZINC001023117398	1319268350	/nfs/dbraw/zinc/26/83/50/1319268350.db2.gz	SPUKYMLMAZHGRK-LZWOXQAQSA-N	0	3	341.293	3.268	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]([C@@H]2CCN(Cc3conc3C)C2)C1	ZINC000961223250	1319350452	/nfs/dbraw/zinc/35/04/52/1319350452.db2.gz	AJLJNSGYPNJHQM-IAGOWNOFSA-N	0	3	345.487	3.256	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](C2CCN(C(=O)[C@H](CC)OC)CC2)C1	ZINC000961342941	1319498844	/nfs/dbraw/zinc/49/88/44/1319498844.db2.gz	RVWXGYMEWOYBEF-IRXDYDNUSA-N	0	3	342.911	3.115	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2oc3ccc(F)cc3c2C)C1	ZINC001023415041	1319518144	/nfs/dbraw/zinc/51/81/44/1319518144.db2.gz	GSUDFZLXCOSOEU-OAHLLOKOSA-N	0	3	342.414	3.345	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2oc3c(cccc3F)c2C)C1	ZINC001023414521	1319518722	/nfs/dbraw/zinc/51/87/22/1319518722.db2.gz	VFOYIWYXEMTKSE-HNNXBMFYSA-N	0	3	342.414	3.345	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCC([C@H]2CCCN(CCF)C2)CC1	ZINC000961372268	1319527166	/nfs/dbraw/zinc/52/71/66/1319527166.db2.gz	AOHCZFCRRQFEHK-SFHVURJKSA-N	0	3	347.478	3.208	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cccc3c2CCCCC3)C1	ZINC001023434972	1319530613	/nfs/dbraw/zinc/53/06/13/1319530613.db2.gz	XAFZNLVZZFFZOY-SFHVURJKSA-N	0	3	338.495	3.421	20	30		EGEDHN
C#CCN1CCC[C@H](CNC(=O)c2cc3ccc(F)cc3s2)C1	ZINC001023475102	1319576586	/nfs/dbraw/zinc/57/65/86/1319576586.db2.gz	PLGCPSDWLNNZKT-CYBMUJFWSA-N	0	3	330.428	3.115	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc(-c3ccco3)o2)C1	ZINC001023481891	1319585583	/nfs/dbraw/zinc/58/55/83/1319585583.db2.gz	RRQYRVRGFMETJT-OAHLLOKOSA-N	0	3	326.396	3.005	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc3cc(Cl)ccc3[nH]2)C1	ZINC001023525466	1319631198	/nfs/dbraw/zinc/63/11/98/1319631198.db2.gz	VHOYGMAOZAKOQA-CQSZACIVSA-N	0	3	343.858	3.286	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2[C@H]3CN(CCc4ccccc4Cl)C[C@H]32)C1	ZINC000961732654	1319717801	/nfs/dbraw/zinc/71/78/01/1319717801.db2.gz	NGNCRQPZZZFNCX-VQFNDLOPSA-N	0	3	344.886	3.285	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2[C@H]3CN(CCOC4CCCCCC4)C[C@H]32)C1	ZINC000961735635	1319719042	/nfs/dbraw/zinc/71/90/42/1319719042.db2.gz	TYXNIYYQJFDMAA-BWTSREIZSA-N	0	3	346.515	3.129	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1Cl)C(=O)c1ccc([N+](=O)[O-])cc1	ZINC000916905283	1319723039	/nfs/dbraw/zinc/72/30/39/1319723039.db2.gz	KBYSMCJYJDDEHW-GFCCVEGCSA-N	0	3	343.726	3.209	20	30		EGEDHN
C[C@@H](Oc1ccccc1)C(=O)C(C#N)C(=O)Nc1ccccc1Cl	ZINC000916905894	1319723181	/nfs/dbraw/zinc/72/31/81/1319723181.db2.gz	NZAUQACNUMKARZ-TZMCWYRMSA-N	0	3	342.782	3.455	20	30		EGEDHN
C=CCNC(=O)C(C#N)C(=O)CCCSc1ccc(Cl)cc1	ZINC000916919937	1319724567	/nfs/dbraw/zinc/72/45/67/1319724567.db2.gz	DJSYPDLPWYIDHI-CQSZACIVSA-N	0	3	336.844	3.223	20	30		EGEDHN
CC[C@@H](Cc1ccccc1C)C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000819952691	1319809961	/nfs/dbraw/zinc/80/99/61/1319809961.db2.gz	VASICXGZEOJJIQ-DOTOQJQBSA-N	0	3	335.407	3.306	20	30		EGEDHN
C#CCN1CCC[C@H](CNC(=O)c2ccccc2-c2ccccc2)C1	ZINC001023733755	1319874280	/nfs/dbraw/zinc/87/42/80/1319874280.db2.gz	RLIWVIRERLCWLR-GOSISDBHSA-N	0	3	332.447	3.429	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc3c(s2)CCCC3)C1	ZINC001023738159	1319881062	/nfs/dbraw/zinc/88/10/62/1319881062.db2.gz	ZFXYRTQXSOTSQU-OAHLLOKOSA-N	0	3	330.497	3.092	20	30		EGEDHN
C=C(C)CN(Cc1ccc(CO)o1)C[C@H]1CCCC[C@@H]1C(=O)OC	ZINC000930455406	1328859624	/nfs/dbraw/zinc/85/96/24/1328859624.db2.gz	NXCRGDUOGIOMOW-QAPCUYQASA-N	0	3	335.444	3.129	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)C2CC(c3ccc(F)cc3)C2)C1	ZINC001023774887	1319924431	/nfs/dbraw/zinc/92/44/31/1319924431.db2.gz	QXNOFELRILMLII-IVMQYODDSA-N	0	3	342.458	3.171	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCN(C(=O)c2ccccc2)C1	ZINC001023816968	1319961062	/nfs/dbraw/zinc/96/10/62/1319961062.db2.gz	NOVUNGSQPHZCAM-QGZVFWFLSA-N	0	3	333.435	3.200	20	30		EGEDHN
Cc1ccc(C(=O)N2CCC[C@@H](CNCc3ccccc3C#N)C2)o1	ZINC001023824727	1319969763	/nfs/dbraw/zinc/96/97/63/1319969763.db2.gz	JPSXDPSFOOYMJA-INIZCTEOSA-N	0	3	337.423	3.102	20	30		EGEDHN
CC(C)(C)OC(=O)N1C[C@@H]2C[C@]2(CNCc2ccc(C#N)cc2F)C1	ZINC000823801565	1320208633	/nfs/dbraw/zinc/20/86/33/1320208633.db2.gz	JEUMFJQNLOBDDK-KXBFYZLASA-N	0	3	345.418	3.044	20	30		EGEDHN
Cc1ccc(C#N)cc1C(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1	ZINC000930508130	1328880785	/nfs/dbraw/zinc/88/07/85/1328880785.db2.gz	NVCOUYRROYJYNS-APWZRJJASA-N	0	3	333.435	3.432	20	30		EGEDHN
COc1cc(C#N)ccc1C(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1	ZINC000930508110	1328881553	/nfs/dbraw/zinc/88/15/53/1328881553.db2.gz	NIYMFVSUPUBKGS-QAPCUYQASA-N	0	3	349.434	3.132	20	30		EGEDHN
COCCc1ccc(OC[C@@H](C)NCc2cc(C#N)ccc2F)cc1	ZINC000825321251	1320327608	/nfs/dbraw/zinc/32/76/08/1320327608.db2.gz	VMMXJHBKDRXVSS-OAHLLOKOSA-N	0	3	342.414	3.443	20	30		EGEDHN
CC(C)N1CCN(c2cccc(NC(=O)C#CC(C)(C)C)c2)CC1	ZINC000837506175	1320632410	/nfs/dbraw/zinc/63/24/10/1320632410.db2.gz	DKHNOEFBSLZZOS-UHFFFAOYSA-N	0	3	327.472	3.205	20	30		EGEDHN
Cc1ccc2c(c1)[C@H]1CN(C)CC[C@H]1N2C(=O)c1ncc(C#N)cc1C	ZINC000839232599	1320897210	/nfs/dbraw/zinc/89/72/10/1320897210.db2.gz	OPFDODALNKKZOB-IEBWSBKVSA-N	0	3	346.434	3.018	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/C[C@H](O)Cc2cccc(F)c2)c([O-])c1	ZINC000840707068	1321131215	/nfs/dbraw/zinc/13/12/15/1321131215.db2.gz	NEHPAJCDQILERN-PPRFWAEMSA-N	0	3	344.430	3.400	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NCc1ncc(C2OCCO2)s1	ZINC000840970499	1321190909	/nfs/dbraw/zinc/19/09/09/1321190909.db2.gz	AHPGTDDSYFIUAM-OAHLLOKOSA-N	0	3	330.453	3.466	20	30		EGEDHN
CC[C@H](OC1CCCC1)C(=O)C(C#N)C(=O)NCc1cccc(C)c1	ZINC000842344047	1321375352	/nfs/dbraw/zinc/37/53/52/1321375352.db2.gz	XCMLCQZPIMRPOH-MSOLQXFVSA-N	0	3	342.439	3.058	20	30		EGEDHN
C[C@H](NC(=O)OC(C)(C)C)C(=O)C(C#N)c1nc(C2CC2)cs1	ZINC000842939125	1321451171	/nfs/dbraw/zinc/45/11/71/1321451171.db2.gz	ONSGKMYDMVURNR-ONGXEEELSA-N	0	3	335.429	3.110	20	30		EGEDHN
C[C@H](C(=O)C(C#N)c1nc(C2CC2)cs1)N(C)CC(F)(F)F	ZINC000842945729	1321452445	/nfs/dbraw/zinc/45/24/45/1321452445.db2.gz	RQDZSRNVYKBFLQ-SCZZXKLOSA-N	0	3	331.363	3.079	20	30		EGEDHN
C[C@H](C(=O)C(C#N)c1nc(C2CC2)cs1)N(C)CC(F)(F)F	ZINC000842945727	1321452541	/nfs/dbraw/zinc/45/25/41/1321452541.db2.gz	RQDZSRNVYKBFLQ-PSASIEDQSA-N	0	3	331.363	3.079	20	30		EGEDHN
C[C@]1(NC(=O)Cc2ccccc2CC#N)CCN(Cc2ccccc2)C1	ZINC000844964213	1321663220	/nfs/dbraw/zinc/66/32/20/1321663220.db2.gz	NIQNFKDFQBMDSY-QFIPXVFZSA-N	0	3	347.462	3.076	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@H]1CCCc2ccc(OC)cc21	ZINC000847622341	1321885161	/nfs/dbraw/zinc/88/51/61/1321885161.db2.gz	IIXWGSVSQCHIQO-FUHWJXTLSA-N	0	3	342.439	3.130	20	30		EGEDHN
CO[C@@H](C(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1)C(C)C	ZINC000847746341	1321900701	/nfs/dbraw/zinc/90/07/01/1321900701.db2.gz	DMRIBOMZAXYYSQ-GOSISDBHSA-N	0	3	344.455	3.007	20	30		EGEDHN
C[C@@H](COC(=O)c1cc2ccccc2n1CC#N)N1CCCCC1	ZINC000847960958	1321916626	/nfs/dbraw/zinc/91/66/26/1321916626.db2.gz	RIIOHHHKEMAJFE-HNNXBMFYSA-N	0	3	325.412	3.196	20	30		EGEDHN
N#C[C@@H]1CCCN(C(=O)N[C@H](CN2CCCCC2)c2ccccc2)C1	ZINC000918861647	1322004896	/nfs/dbraw/zinc/00/48/96/1322004896.db2.gz	PJDQENDAVIUIPK-PKOBYXMFSA-N	0	3	340.471	3.159	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)Cc2cc3ccccc3o2)cc1	ZINC000920112182	1322137991	/nfs/dbraw/zinc/13/79/91/1322137991.db2.gz	XVVHRCYGLATNBC-KRWDZBQOSA-N	0	3	348.358	3.331	20	30		EGEDHN
C=CCc1cc(CN[C@@H](c2cnn(C)c2)C(C)C)cc(OC)c1O	ZINC000922897414	1322643795	/nfs/dbraw/zinc/64/37/95/1322643795.db2.gz	ZWAOBJAJZOGTCL-GOSISDBHSA-N	0	3	329.444	3.350	20	30		EGEDHN
CC[C@H](SC)C(=O)N1CCC[C@@H](CNCc2ccccc2C#N)C1	ZINC001023937734	1323042560	/nfs/dbraw/zinc/04/25/60/1323042560.db2.gz	OMGNJVMDASYJFV-YJBOKZPZSA-N	0	3	345.512	3.028	20	30		EGEDHN
CC1(C)CC(C(=O)N2CCC[C@H](CNCc3ccccc3C#N)C2)C1	ZINC001023970129	1323056151	/nfs/dbraw/zinc/05/61/51/1323056151.db2.gz	UINSBAUPTJTGHM-MRXNPFEDSA-N	0	3	339.483	3.323	20	30		EGEDHN
CC1(C(=O)N2CCC[C@@H](CNCc3ccccc3C#N)C2)CCCC1	ZINC001024083748	1323118702	/nfs/dbraw/zinc/11/87/02/1323118702.db2.gz	WWVPOWJLGNKWQT-KRWDZBQOSA-N	0	3	339.483	3.467	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N1CCC[C@H](CNCc2ccccc2C#N)C1	ZINC001024143686	1323168665	/nfs/dbraw/zinc/16/86/65/1323168665.db2.gz	RTSXOYOPPDPOPN-MBOZVWFJSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H](CNCc3oc(CC)nc3C)C2)C1	ZINC001024146368	1323171396	/nfs/dbraw/zinc/17/13/96/1323171396.db2.gz	UDCSQLZUDWVXJB-MRXNPFEDSA-N	0	3	345.487	3.230	20	30		EGEDHN
CCc1ccc([C@H](NC2CCN(CC#N)CC2)c2cccnc2)cc1	ZINC000925003708	1323241821	/nfs/dbraw/zinc/24/18/21/1323241821.db2.gz	PNIAKFJBBCIMQO-NRFANRHFSA-N	0	3	334.467	3.311	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)c2ccc(C)n2C)C1	ZINC000963251368	1323260756	/nfs/dbraw/zinc/26/07/56/1323260756.db2.gz	PFOJXLKZAXVDGG-IRXDYDNUSA-N	0	3	349.906	3.403	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccc(N(C)C)cc1F	ZINC001024477175	1323430947	/nfs/dbraw/zinc/43/09/47/1323430947.db2.gz	KHHHWAZJNWNKDP-INIZCTEOSA-N	0	3	333.451	3.052	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cc2ccccc2c(=O)[nH]1	ZINC001024478987	1323431609	/nfs/dbraw/zinc/43/16/09/1323431609.db2.gz	XMJSCLQJHBTHEX-INIZCTEOSA-N	0	3	339.439	3.101	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC001024479935	1323432715	/nfs/dbraw/zinc/43/27/15/1323432715.db2.gz	UIWPZLJLHJTWEK-IBGZPJMESA-N	0	3	337.467	3.459	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@@H]1CCN(C)c2ccccc21	ZINC001024484004	1323438502	/nfs/dbraw/zinc/43/85/02/1323438502.db2.gz	IFQWHEYFBTZSKJ-IEBWSBKVSA-N	0	3	341.499	3.157	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cnn2c1ccc(C)c2C	ZINC001024488332	1323440382	/nfs/dbraw/zinc/44/03/82/1323440382.db2.gz	XEFAFPQJCOQFBH-KRWDZBQOSA-N	0	3	340.471	3.112	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)[C@@H]1CCCC[C@@H]1C(F)(F)F	ZINC001024509098	1323458562	/nfs/dbraw/zinc/45/85/62/1323458562.db2.gz	QMURYIOERSPLEX-XHSDSOJGSA-N	0	3	344.421	3.349	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@H]1CCc2cc(C)ccc2O1	ZINC001024553533	1323494422	/nfs/dbraw/zinc/49/44/22/1323494422.db2.gz	CFVUQBJPISPLAP-AZUAARDMSA-N	0	3	342.483	3.235	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1c(C)occ1C(F)(F)F	ZINC001024558961	1323498092	/nfs/dbraw/zinc/49/80/92/1323498092.db2.gz	PSKJAWNTYPLNNA-ZDUSSCGKSA-N	0	3	342.361	3.214	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cc2ccc(OC)cc2[nH]1	ZINC001024593994	1323526872	/nfs/dbraw/zinc/52/68/72/1323526872.db2.gz	WXTDLPYHAQUYSY-MRXNPFEDSA-N	0	3	341.455	3.337	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cncc2sccc21	ZINC001024620408	1323548862	/nfs/dbraw/zinc/54/88/62/1323548862.db2.gz	UEOBSKJZEWWGDN-AWEZNQCLSA-N	0	3	329.469	3.457	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccccc1-n1cccc1	ZINC001024630775	1323556418	/nfs/dbraw/zinc/55/64/18/1323556418.db2.gz	WPCFNWBXSZNDFH-SFHVURJKSA-N	0	3	335.451	3.085	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cc(-c2cccs2)n[nH]1	ZINC001024661360	1323576567	/nfs/dbraw/zinc/57/65/67/1323576567.db2.gz	DIYGHRRFNGUGAA-CQSZACIVSA-N	0	3	344.484	3.299	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccccc1O[C@H](C)CC	ZINC001024685826	1323601710	/nfs/dbraw/zinc/60/17/10/1323601710.db2.gz	NYWBVIUCVVYHTJ-MSOLQXFVSA-N	0	3	342.483	3.472	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cncc(C(F)(F)F)c1	ZINC001024743243	1323640573	/nfs/dbraw/zinc/64/05/73/1323640573.db2.gz	FFNFPUKOPUIVBM-HNNXBMFYSA-N	0	3	341.377	3.261	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)C1CCC(C(F)F)CC1	ZINC001024782013	1323684587	/nfs/dbraw/zinc/68/45/87/1323684587.db2.gz	FSEIHRFAVBCDJP-UYSNPLJNSA-N	0	3	326.431	3.052	20	30		EGEDHN
C=CCCN1CCCC[C@H]1CNC(=O)c1ccc(P(C)(C)=O)cc1	ZINC001024808301	1323711004	/nfs/dbraw/zinc/71/10/04/1323711004.db2.gz	FNOXDKUSHHAGSR-KRWDZBQOSA-N	0	3	348.427	3.095	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)C12CC(c3ccccc3)(C1)C2	ZINC001024816252	1323719608	/nfs/dbraw/zinc/71/96/08/1323719608.db2.gz	GJKSSZUZZUMTDF-KPQWGBOZSA-N	0	3	336.479	3.102	20	30		EGEDHN
CC(C)Oc1ccccc1CNC[C@H]1CCCCN1C(=O)[C@H](C)C#N	ZINC001024901951	1323772701	/nfs/dbraw/zinc/77/27/01/1323772701.db2.gz	DZXIPLZPSJCKHZ-SJLPKXTDSA-N	0	3	343.471	3.104	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)CCC2CC2)s1	ZINC001024906339	1323774382	/nfs/dbraw/zinc/77/43/82/1323774382.db2.gz	BTXZFJQGUPLWPH-OAHLLOKOSA-N	0	3	331.485	3.281	20	30		EGEDHN
O=C(C#CC1CC1)N1CCCC[C@@H]1CNCc1ccc(Cl)cc1F	ZINC001024960023	1323801983	/nfs/dbraw/zinc/80/19/83/1323801983.db2.gz	MFNOLIBLJSWGSW-QGZVFWFLSA-N	0	3	348.849	3.363	20	30		EGEDHN
O=C(C#CC1CC1)N1CCCC[C@@H]1CNCc1cc2ccccc2o1	ZINC001024960225	1323802130	/nfs/dbraw/zinc/80/21/30/1323802130.db2.gz	QMCASJUKAFMECC-GOSISDBHSA-N	0	3	336.435	3.317	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCCC[C@H]1CNCc1cncs1	ZINC001024975184	1323810462	/nfs/dbraw/zinc/81/04/62/1323810462.db2.gz	URXHKNDPWJVROY-ZDUSSCGKSA-N	0	3	341.908	3.393	20	30		EGEDHN
CC1(C(=O)N2CCCC[C@@H]2CNCc2ccc(C#N)cc2F)CCC1	ZINC001025045185	1323849329	/nfs/dbraw/zinc/84/93/29/1323849329.db2.gz	SJXOCYXKEZLVHE-QGZVFWFLSA-N	0	3	343.446	3.358	20	30		EGEDHN
C[C@@]1(C(=O)N2CCCC[C@H]2CNCc2ccc(C#N)s2)C=CCC1	ZINC001025046038	1323850364	/nfs/dbraw/zinc/85/03/64/1323850364.db2.gz	HBEUSKWVPDNJSS-HNAYVOBHSA-N	0	3	343.496	3.447	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)s1	ZINC001025048695	1323852826	/nfs/dbraw/zinc/85/28/26/1323852826.db2.gz	HEJVJXDQEOBUPV-CZUORRHYSA-N	0	3	337.464	3.085	20	30		EGEDHN
CC(C)[C@H](F)C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001025049047	1323854582	/nfs/dbraw/zinc/85/45/82/1323854582.db2.gz	OYSHIPUVRPQJEP-AEFFLSMTSA-N	0	3	349.425	3.162	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCCC[C@H]2CNCc2cc(C)ns2)C1	ZINC001025076913	1323879742	/nfs/dbraw/zinc/87/97/42/1323879742.db2.gz	VYDFATFFZGZSGY-HNNXBMFYSA-N	0	3	333.501	3.279	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@H]2[C@H]2CCCCN2C(=O)C2CC2)c1	ZINC001025183157	1323950793	/nfs/dbraw/zinc/95/07/93/1323950793.db2.gz	JEFNBYPVCCFTKW-WOJBJXKFSA-N	0	3	337.467	3.314	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H]2[C@H]2CCCCN2C(=O)C(F)F)cc1	ZINC001025186159	1323958305	/nfs/dbraw/zinc/95/83/05/1323958305.db2.gz	XFXHUKZSGGNIFU-IAGOWNOFSA-N	0	3	347.409	3.169	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ncc(C)cc1OC	ZINC001025241155	1324036506	/nfs/dbraw/zinc/03/65/06/1324036506.db2.gz	VBEHYYZLLHXCCY-SJORKVTESA-N	0	3	343.471	3.044	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)Cc1ccccc1CC	ZINC001025242301	1324038130	/nfs/dbraw/zinc/03/81/30/1324038130.db2.gz	HZPYXNMZWXDHBW-LEWJYISDSA-N	0	3	338.495	3.270	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1c[nH]c2ccccc12	ZINC001025248405	1324048340	/nfs/dbraw/zinc/04/83/40/1324048340.db2.gz	ZLCJXSDGYHWRQO-VQTJNVASSA-N	0	3	335.451	3.260	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cccc(C(C)C)n1	ZINC001025250291	1324049617	/nfs/dbraw/zinc/04/96/17/1324049617.db2.gz	ILCYFIUDGVKARD-WOJBJXKFSA-N	0	3	339.483	3.297	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccnc(C2CC2)c1	ZINC001025250782	1324053438	/nfs/dbraw/zinc/05/34/38/1324053438.db2.gz	NJYXZAOWHLRNIG-UXHICEINSA-N	0	3	337.467	3.051	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1nc(C)c(C)nc1C	ZINC001025251088	1324054404	/nfs/dbraw/zinc/05/44/04/1324054404.db2.gz	PWORHNJEQLUSTE-MSOLQXFVSA-N	0	3	342.487	3.047	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc[nH]c1C1CCC1	ZINC001025269575	1324083126	/nfs/dbraw/zinc/08/31/26/1324083126.db2.gz	TUCUBOXIOBKLQS-OALUTQOASA-N	0	3	339.483	3.375	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)C1(C(F)(F)F)CC1	ZINC001025271887	1324087991	/nfs/dbraw/zinc/08/79/91/1324087991.db2.gz	JPJISVAJJJWBMH-CABCVRRESA-N	0	3	342.405	3.198	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc2ccccn2c1	ZINC001025274651	1324092992	/nfs/dbraw/zinc/09/29/92/1324092992.db2.gz	LVAXEPMNSZSEKE-NHCUHLMSSA-N	0	3	349.478	3.422	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(CCC)on1	ZINC001025283881	1324103835	/nfs/dbraw/zinc/10/38/35/1324103835.db2.gz	BZMXMOLJGBPCKZ-RTBURBONSA-N	0	3	343.471	3.110	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(CCC)on1	ZINC001025283874	1324104455	/nfs/dbraw/zinc/10/44/55/1324104455.db2.gz	BYIYENYOMUDZEA-MSOLQXFVSA-N	0	3	331.460	3.272	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc(OC)cc1	ZINC001025292440	1324117039	/nfs/dbraw/zinc/11/70/39/1324117039.db2.gz	IOTPNJPBYIMEOX-UXHICEINSA-N	0	3	340.467	3.178	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(F)cc(F)c1	ZINC001025296793	1324128266	/nfs/dbraw/zinc/12/82/66/1324128266.db2.gz	LLMWGYUTZGAQFZ-QZTJIDSGSA-N	0	3	332.394	3.057	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cnc(CC)s1	ZINC001025301614	1324135615	/nfs/dbraw/zinc/13/56/15/1324135615.db2.gz	MWQDVIMBCAICMH-HUUCEWRRSA-N	0	3	333.501	3.351	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)C12CCC(CC1)CC2	ZINC001025302913	1324136652	/nfs/dbraw/zinc/13/66/52/1324136652.db2.gz	YWXXBXCNOXAGBC-JMDAGXMHSA-N	0	3	328.500	3.436	20	30		EGEDHN
C[C@@H](NC(=O)c1ccco1)[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001025320606	1324158690	/nfs/dbraw/zinc/15/86/90/1324158690.db2.gz	NQQLDZAEFWWYJK-QAPCUYQASA-N	0	3	337.423	3.182	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc3nccc(C)c3c2)C1	ZINC001025429046	1324264078	/nfs/dbraw/zinc/26/40/78/1324264078.db2.gz	QXNJFZATEMXTAK-FUHWJXTLSA-N	0	3	335.451	3.007	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@H](C)[C@@H]2CCCN(CC#CC)C2)cc1	ZINC001025461377	1324307387	/nfs/dbraw/zinc/30/73/87/1324307387.db2.gz	TWRYVRUSXVCMQZ-IEBWSBKVSA-N	0	3	340.467	3.105	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2coc3cc(F)ccc23)C1	ZINC001025461933	1324308093	/nfs/dbraw/zinc/30/80/93/1324308093.db2.gz	YMNDLJBLDUEFAY-GJZGRUSLSA-N	0	3	342.414	3.426	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(F)cc3ccoc32)C1	ZINC001025465863	1324311046	/nfs/dbraw/zinc/31/10/46/1324311046.db2.gz	WTODYSVESBHGBX-ZFWWWQNUSA-N	0	3	328.387	3.035	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(OC)c(C(C)C)c2)C1	ZINC001025475992	1324320795	/nfs/dbraw/zinc/32/07/95/1324320795.db2.gz	WDWQLAMCBMYWAG-FUHWJXTLSA-N	0	3	342.483	3.282	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2occc2-c2ccccc2)C1	ZINC001025480201	1324325775	/nfs/dbraw/zinc/32/57/75/1324325775.db2.gz	RERRRYKVGNFNHC-FUHWJXTLSA-N	0	3	336.435	3.410	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(-c3ccco3)o2)C1	ZINC001025481142	1324328320	/nfs/dbraw/zinc/32/83/20/1324328320.db2.gz	FHKXARXPDOSQMI-JKSUJKDBSA-N	0	3	340.423	3.393	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc3ccccc3cc2F)C1	ZINC001025482807	1324329946	/nfs/dbraw/zinc/32/99/46/1324329946.db2.gz	QORZLVTVVSGNFN-YJBOKZPZSA-N	0	3	338.426	3.442	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(C)c(C)cc2Cl)C1	ZINC001025502200	1324352442	/nfs/dbraw/zinc/35/24/42/1324352442.db2.gz	KWOIOJMWSNEERL-JKSUJKDBSA-N	0	3	332.875	3.420	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cnc3ccsc3c2)C1	ZINC001025503868	1324353916	/nfs/dbraw/zinc/35/39/16/1324353916.db2.gz	VWBVGQTUNZWVEJ-CABCVRRESA-N	0	3	341.480	3.150	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccn(C(C)C)c2C)C1	ZINC001025519054	1324363169	/nfs/dbraw/zinc/36/31/69/1324363169.db2.gz	JLDLAYLQDMKIEE-WMZOPIPTSA-N	0	3	329.488	3.231	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(F)c(Cl)c2)C1	ZINC001025522934	1324368091	/nfs/dbraw/zinc/36/80/91/1324368091.db2.gz	JDJDHJDDMQUIQU-HIFRSBDPSA-N	0	3	336.838	3.333	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](C)[C@@H]2CCCN(Cc3cnoc3C)C2)CC1	ZINC001025523311	1324368893	/nfs/dbraw/zinc/36/88/93/1324368893.db2.gz	OOXKREDASSAMKD-CRAIPNDOSA-N	0	3	345.487	3.446	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(C)c(F)c2F)C1	ZINC001025544547	1324392011	/nfs/dbraw/zinc/39/20/11/1324392011.db2.gz	XAZSKBJPWGNGHM-HUUCEWRRSA-N	0	3	334.410	3.127	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2scnc2C(C)(C)C)C1	ZINC001025556230	1324405212	/nfs/dbraw/zinc/40/52/12/1324405212.db2.gz	SXTKBFKTJIYITR-GJZGRUSLSA-N	0	3	347.528	3.294	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc3ccn(C)c3c2)C1	ZINC001025586816	1324430549	/nfs/dbraw/zinc/43/05/49/1324430549.db2.gz	FXEGPPNPVIOAGY-VQIMIIECSA-N	0	3	337.467	3.032	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cccc(-c3ccoc3)c2)C1	ZINC001025590893	1324436071	/nfs/dbraw/zinc/43/60/71/1324436071.db2.gz	UKZUMOKFCYFDEW-QFBILLFUSA-N	0	3	336.435	3.410	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cnn(C(CC)CC)c2C)C1	ZINC001025590624	1324436187	/nfs/dbraw/zinc/43/61/87/1324436187.db2.gz	PDPACGSMALCAEL-NVXWUHKLSA-N	0	3	344.503	3.016	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccccc2C(F)(F)F)C1	ZINC001025601535	1324448316	/nfs/dbraw/zinc/44/83/16/1324448316.db2.gz	BYFJPNOUQADWSO-ZIAGYGMSSA-N	0	3	338.373	3.169	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC001025603406	1324452475	/nfs/dbraw/zinc/45/24/75/1324452475.db2.gz	VTAUKOYOMUEQSW-ZFWWWQNUSA-N	0	3	338.373	3.169	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc3ccccc3n2)C1	ZINC001025606351	1324455027	/nfs/dbraw/zinc/45/50/27/1324455027.db2.gz	DQRNUGGQLMISHW-WMZOPIPTSA-N	0	3	335.451	3.088	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cccc(OCC(C)C)c2)C1	ZINC001025615595	1324468858	/nfs/dbraw/zinc/46/88/58/1324468858.db2.gz	WNKDEROBPAPDGW-IEBWSBKVSA-N	0	3	342.483	3.185	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2c[nH]c3ccc(C)cc23)C1	ZINC001025629747	1324480621	/nfs/dbraw/zinc/48/06/21/1324480621.db2.gz	JWOMUZIGIFARHQ-IAGOWNOFSA-N	0	3	337.467	3.330	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2coc(C3CCCCC3)n2)C1	ZINC001025633017	1324484680	/nfs/dbraw/zinc/48/46/80/1324484680.db2.gz	RSHMTSMFYRUACT-DOTOQJQBSA-N	0	3	343.471	3.186	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cnc(C(C)C)s2)C1	ZINC001025637352	1324489210	/nfs/dbraw/zinc/48/92/10/1324489210.db2.gz	SGIGZHJDJQPCBH-GJZGRUSLSA-N	0	3	333.501	3.120	20	30		EGEDHN
Cc1ccoc1C(=O)N1C[C@@H]2CC[C@H](NCc3ccccc3C#N)[C@@H]2C1	ZINC001026198015	1324658861	/nfs/dbraw/zinc/65/88/61/1324658861.db2.gz	CMIWFXLKOCNSDE-OTWHNJEPSA-N	0	3	349.434	3.100	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H]2CC[C@H](NCc3csc(CC)n3)[C@H]2C1	ZINC001026328213	1324729301	/nfs/dbraw/zinc/72/93/01/1324729301.db2.gz	LLCKWBYNSLYGMB-BPUTZDHNSA-N	0	3	347.528	3.244	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H]2CC[C@@H](NCc3ccn(C(C)C)n3)[C@@H]2C1	ZINC001026329590	1324730392	/nfs/dbraw/zinc/73/03/92/1324730392.db2.gz	ZIEVNRPPGJRMNV-CGTJXYLNSA-N	0	3	344.503	3.003	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H]3CC[C@@H](NCc4csc(C)n4)[C@@H]3C2)C1	ZINC001026353074	1324747175	/nfs/dbraw/zinc/74/71/75/1324747175.db2.gz	XSSJWEOCBUCQNS-USXIJHARSA-N	0	3	345.512	3.134	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H]3CC[C@H](NCc4ncc(C)s4)[C@H]3C2)C1	ZINC001026352897	1324747507	/nfs/dbraw/zinc/74/75/07/1324747507.db2.gz	WOBQIUASOPIZAP-JYJNAYRXSA-N	0	3	345.512	3.134	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC1CCC(NC(=O)C2CCCC2)CC1	ZINC001026439103	1324801265	/nfs/dbraw/zinc/80/12/65/1324801265.db2.gz	AVVQTOPBIGQYNW-UHFFFAOYSA-N	0	3	343.446	3.405	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)C2=CCCC2)CC1	ZINC001026476523	1324834975	/nfs/dbraw/zinc/83/49/75/1324834975.db2.gz	ADAJWXWEZGILEZ-UHFFFAOYSA-N	0	3	327.266	3.022	20	30		EGEDHN
C[C@]1(C(=O)NC2CCC(NCc3ccccc3C#N)CC2)C=CCC1	ZINC001026542647	1324879998	/nfs/dbraw/zinc/87/99/98/1324879998.db2.gz	VGRBDTJLJADMCR-GRERDSQWSA-N	0	3	337.467	3.432	20	30		EGEDHN
N#Cc1ccccc1CNC1CCC(NC(=O)[C@@H]2C[C@H]2C2CC2)CC1	ZINC001026574737	1324906307	/nfs/dbraw/zinc/90/63/07/1324906307.db2.gz	ISPPMBMOVFEKPS-GHBBCFCZSA-N	0	3	337.467	3.121	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCN(C(=O)C2=CCCCCC2)C1	ZINC001026802835	1325027341	/nfs/dbraw/zinc/02/73/41/1325027341.db2.gz	AVHZBCCLCDTVTD-QGZVFWFLSA-N	0	3	337.467	3.387	20	30		EGEDHN
C[C@]1(C(=O)N2CC[C@@H](CNCc3ccccc3C#N)C2)CC=CCC1	ZINC001026863789	1325051608	/nfs/dbraw/zinc/05/16/08/1325051608.db2.gz	RLFVYIREWSDPGD-UWJYYQICSA-N	0	3	337.467	3.243	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)c2cc[nH]c2C)C1	ZINC000963282024	1325063182	/nfs/dbraw/zinc/06/31/82/1325063182.db2.gz	NMJZHOMIKWLNRE-DOTOQJQBSA-N	0	3	335.879	3.392	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@@H](CNCc2cc(F)ccc2C#N)C1)C(C)(C)C	ZINC001026921253	1325084804	/nfs/dbraw/zinc/08/48/04/1325084804.db2.gz	PEOPTGRKEJQHRZ-CABCVRRESA-N	0	3	345.462	3.318	20	30		EGEDHN
CC1(C)CC[C@H]1C(=O)N1CC[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001027009124	1325148811	/nfs/dbraw/zinc/14/88/11/1325148811.db2.gz	WRWSDPZKVUDZDT-KSSFIOAISA-N	0	3	343.446	3.072	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@H](CNCc2oc(CC)nc2C)C1	ZINC001027038049	1325171896	/nfs/dbraw/zinc/17/18/96/1325171896.db2.gz	GUXYEPDPYMNLMX-KXBFYZLASA-N	0	3	333.476	3.086	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001027038784	1325172870	/nfs/dbraw/zinc/17/28/70/1325172870.db2.gz	QUMZNCBLYVBDCS-MGPUTAFESA-N	0	3	343.446	3.238	20	30		EGEDHN
CN(Cc1ccc(F)c(C#N)c1)[C@H]1CCCN(C(=O)c2ccco2)C1	ZINC001027274196	1325382939	/nfs/dbraw/zinc/38/29/39/1325382939.db2.gz	SSMXWNMHGMYBDO-INIZCTEOSA-N	0	3	341.386	3.027	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC[C@@H](N(C)Cc2ccc(F)c(C#N)c2)C1	ZINC001027305990	1325451596	/nfs/dbraw/zinc/45/15/96/1325451596.db2.gz	WWMATXJMIGLFQJ-RHSMWYFYSA-N	0	3	331.435	3.166	20	30		EGEDHN
C=C(CN(C)C)C(=O)N(OC)[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000856342748	1325482470	/nfs/dbraw/zinc/48/24/70/1325482470.db2.gz	WUYLKESNJQRULN-LBPRGKRZSA-N	0	3	330.350	3.274	20	30		EGEDHN
C[C@@H](CC(C)(C)C#N)N[C@H]1CCCN(Cc2ccc(F)cc2F)C1=O	ZINC000926255910	1325492682	/nfs/dbraw/zinc/49/26/82/1325492682.db2.gz	NKHIZLGROIVVJX-GUYCJALGSA-N	0	3	349.425	3.374	20	30		EGEDHN
CN(Cc1ccc(C#N)c(F)c1)[C@H]1CCCN(C(=O)CCC2CC2)C1	ZINC001027339917	1325498627	/nfs/dbraw/zinc/49/86/27/1325498627.db2.gz	KDEOYDUOZQZTRJ-SFHVURJKSA-N	0	3	343.446	3.310	20	30		EGEDHN
CN(Cc1ccc(F)c(C#N)c1)[C@@H]1CCCN(C(=O)/C=C\C2CC2)C1	ZINC001027340921	1325500129	/nfs/dbraw/zinc/50/01/29/1325500129.db2.gz	GTWMTUZCKIHCHM-YPLUBFQTSA-N	0	3	341.430	3.086	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)c(F)c2)C1	ZINC001027355793	1325531879	/nfs/dbraw/zinc/53/18/79/1325531879.db2.gz	AYMOPJJODOYTKQ-XIYYVKAQSA-N	0	3	329.419	3.086	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)C[C@@H](C)c1ccco1	ZINC000860473111	1329321894	/nfs/dbraw/zinc/32/18/94/1329321894.db2.gz	IJSXKUHAKPGFMS-OLZOCXBDSA-N	0	3	326.352	3.129	20	30		EGEDHN
C[C@@H](c1ccc(F)c(F)c1)N(C)[C@H]1CCCN(C(=O)C#CC2CC2)C1	ZINC001027402736	1327624135	/nfs/dbraw/zinc/62/41/35/1327624135.db2.gz	RJONVTJCCDBRFM-YOEHRIQHSA-N	0	3	346.421	3.362	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)c2csc3cc(C)ccc32)C1	ZINC001027425654	1327659782	/nfs/dbraw/zinc/65/97/82/1327659782.db2.gz	KRBZBVAMKDGPNF-OAHLLOKOSA-N	0	3	326.465	3.379	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)c2ccccc2CC(C)(C)C)C1	ZINC001027456875	1327699581	/nfs/dbraw/zinc/69/95/81/1327699581.db2.gz	PTALBANWXHQWOF-GOSISDBHSA-N	0	3	326.484	3.445	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)[C@H]2CCC2(F)F)C1	ZINC001027458454	1327700689	/nfs/dbraw/zinc/70/06/89/1327700689.db2.gz	JNBWVBPPMRUMIH-DLBZAZTESA-N	0	3	347.409	3.026	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)c2sc3ccccc3c2C)C1	ZINC001027483168	1327739360	/nfs/dbraw/zinc/73/93/60/1327739360.db2.gz	MIWLCPSGZAPCOU-OAHLLOKOSA-N	0	3	326.465	3.379	20	30		EGEDHN
CN(Cc1ccc(C#N)c(F)c1)[C@@H]1CCCN(C(=O)CC2(C)CC2)C1	ZINC001027496880	1327761146	/nfs/dbraw/zinc/76/11/46/1327761146.db2.gz	ZGNDLTBNRHHAAW-QGZVFWFLSA-N	0	3	343.446	3.310	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)C(C)(C)C2CC2)C1	ZINC001027539100	1327838557	/nfs/dbraw/zinc/83/85/57/1327838557.db2.gz	KRMKJPAEUZXRJY-LJQANCHMSA-N	0	3	339.483	3.417	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)C[C@@H](C)c2ccc(CC)cc2)C1	ZINC001027573044	1327909030	/nfs/dbraw/zinc/90/90/30/1327909030.db2.gz	YFMWGNJFKDJVNV-XLIONFOSSA-N	0	3	326.484	3.299	20	30		EGEDHN
CC(C)(C)C(=O)NC1CC2(CC(NCc3cc(F)ccc3C#N)C2)C1	ZINC000965875900	1328068635	/nfs/dbraw/zinc/06/86/35/1328068635.db2.gz	KYPOLYFUQBYAGL-UHFFFAOYSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2cccc3scnc32)C1	ZINC000966077637	1328170941	/nfs/dbraw/zinc/17/09/41/1328170941.db2.gz	QORHBGYSARDEPD-DZGCQCFKSA-N	0	3	329.469	3.313	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1ccn(C2CCCCC2)n1	ZINC001027881571	1328347642	/nfs/dbraw/zinc/34/76/42/1328347642.db2.gz	SIAPTGCGOFQMFQ-QGZVFWFLSA-N	0	3	330.476	3.159	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2ccc3cc(C)cn3c2)C1	ZINC000966632321	1328362830	/nfs/dbraw/zinc/36/28/30/1328362830.db2.gz	KLOODWIEEDTSDK-LPHOPBHVSA-N	0	3	325.456	3.264	20	30		EGEDHN
Cc1cccc(C(=O)N2CC[C@@H](NCc3ccc(C#N)c(F)c3)C2)c1	ZINC000966726457	1328394166	/nfs/dbraw/zinc/39/41/66/1328394166.db2.gz	JHCRMDUVBHYFDY-GOSISDBHSA-N	0	3	337.398	3.010	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC001027969482	1328441494	/nfs/dbraw/zinc/44/14/94/1328441494.db2.gz	NMCFRSSDAPXXJV-RRFJBIMHSA-N	0	3	330.394	3.288	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)Cc2ccc3cccnc3c2)C1	ZINC000966903358	1328465118	/nfs/dbraw/zinc/46/51/18/1328465118.db2.gz	FNGBRKKLGGLROA-OXQOHEQNSA-N	0	3	337.467	3.180	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)Cc2cccc3cnccc32)C1	ZINC000966907862	1328468350	/nfs/dbraw/zinc/46/83/50/1328468350.db2.gz	HHLGPFWEAMBEQV-UZLBHIALSA-N	0	3	337.467	3.180	20	30		EGEDHN
CCCCCCCNC(=O)C(=O)Nc1cc(CN(C)C)ccc1C	ZINC000861922817	1329451012	/nfs/dbraw/zinc/45/10/12/1329451012.db2.gz	ZGJMLZLLYQJFTC-UHFFFAOYSA-N	0	3	333.476	3.082	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)Nc2sccc2C#N)N(C)C)cc1	ZINC000931844636	1329765840	/nfs/dbraw/zinc/76/58/40/1329765840.db2.gz	FQCJMLPWDYHTFH-HNNXBMFYSA-N	0	3	328.441	3.353	20	30		EGEDHN
CC(C)(C)OC(=O)NCC[C@@H]1CCN(Cc2ccc(C#N)c(F)c2)C1	ZINC000932697427	1329834600	/nfs/dbraw/zinc/83/46/00/1329834600.db2.gz	QTRBFTNMNAUNAA-CQSZACIVSA-N	0	3	347.434	3.434	20	30		EGEDHN
CC(C)N1CCC[C@@H]1C(=O)NCC#Cc1ccc(C(F)(F)F)cc1	ZINC000934063246	1329943267	/nfs/dbraw/zinc/94/32/67/1329943267.db2.gz	DDCXPTTYSDDOCN-MRXNPFEDSA-N	0	3	338.373	3.046	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc3nc(C)sc3c2)CC1	ZINC001052844012	1348699107	/nfs/dbraw/zinc/69/91/07/1348699107.db2.gz	YDNGQMZAPAPCFA-INIZCTEOSA-N	0	3	341.480	3.212	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H](C)[C@H](NCc3cccc(Cl)n3)C2)CC1	ZINC000939048698	1330364539	/nfs/dbraw/zinc/36/45/39/1330364539.db2.gz	DFWXOZGKRQDIKB-RHSMWYFYSA-N	0	3	347.890	3.418	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](C)[C@H](NCc3cc(C)ccc3F)C2)C1	ZINC000939102747	1330376379	/nfs/dbraw/zinc/37/63/79/1330376379.db2.gz	LBASJBACOQFACY-CRAIPNDOSA-N	0	3	330.447	3.427	20	30		EGEDHN
CC1(C)CN(Cc2ccc(C#N)cc2)CC[C@@H]1NC(=O)CC1CCC1	ZINC000940634510	1331133988	/nfs/dbraw/zinc/13/39/88/1331133988.db2.gz	LJIGVZXQGJCJLR-IBGZPJMESA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2CCc3ccccc3CC2)[C@H](C)C1	ZINC000942208496	1331880112	/nfs/dbraw/zinc/88/01/12/1331880112.db2.gz	POTYJZMKGFEOOV-UTKZUKDTSA-N	0	3	338.495	3.032	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2CCc3ccccc3CC2)[C@H](C)C1	ZINC000942208494	1331880566	/nfs/dbraw/zinc/88/05/66/1331880566.db2.gz	POTYJZMKGFEOOV-DYESRHJHSA-N	0	3	338.495	3.032	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2coc3ccc(OC)cc32)[C@H](C)C1	ZINC000942431097	1331932762	/nfs/dbraw/zinc/93/27/62/1331932762.db2.gz	KYRXMCMIXKICRS-CXAGYDPISA-N	0	3	328.412	3.068	20	30		EGEDHN
C[C@H]1CN(Cc2ccc(C#N)cc2)CC[C@H]1NC(=O)C(C)(C)C1CC1	ZINC000942569346	1331980223	/nfs/dbraw/zinc/98/02/23/1331980223.db2.gz	JCAYLKYPVCGEIZ-HNAYVOBHSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCN(Cc3cncc(C)c3)C[C@H]2C)CC1	ZINC000942599888	1331997209	/nfs/dbraw/zinc/99/72/09/1331997209.db2.gz	HEGPFDBMELJXAN-XLIONFOSSA-N	0	3	341.499	3.463	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccccc2OCC(C)C)[C@H](C)C1	ZINC000943688633	1332239036	/nfs/dbraw/zinc/23/90/36/1332239036.db2.gz	FBDQFDRASBJEMS-MJGOQNOKSA-N	0	3	342.483	3.185	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(-c3ccccc3)ccn2)[C@H](C)C1	ZINC000943767178	1332259388	/nfs/dbraw/zinc/25/93/88/1332259388.db2.gz	RQDOOXUKGHRUPM-VQIMIIECSA-N	0	3	335.451	3.375	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cnc(CC(C)(C)C)s2)[C@@H](C)C1	ZINC000944031771	1332311608	/nfs/dbraw/zinc/31/16/08/1332311608.db2.gz	DFYYNFPUUDGFTD-LSDHHAIUSA-N	0	3	347.528	3.195	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccc(-c3ccoc3)c2)[C@H](C)C1	ZINC000944045263	1332315079	/nfs/dbraw/zinc/31/50/79/1332315079.db2.gz	CQMJQGMWILAYMN-OXQOHEQNSA-N	0	3	336.435	3.410	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cccc(Cl)c2Cl)[C@H](C)C1	ZINC000944304144	1332367373	/nfs/dbraw/zinc/36/73/73/1332367373.db2.gz	GOLFJGNTTXSEPM-RISCZKNCSA-N	0	3	325.239	3.067	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(Cl)cc2Cl)[C@H](C)C1	ZINC000944303158	1332367410	/nfs/dbraw/zinc/36/74/10/1332367410.db2.gz	BIECOASAANWIHU-MLGOLLRUSA-N	0	3	339.266	3.457	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C(C)(C)C)cc2)[C@H](C)C1	ZINC000944306201	1332368681	/nfs/dbraw/zinc/36/86/81/1332368681.db2.gz	RBVVNSYHRICNSX-APWZRJJASA-N	0	3	326.484	3.448	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2c[nH]c3c2cccc3CC)[C@@H](C)C1	ZINC000945180132	1332526611	/nfs/dbraw/zinc/52/66/11/1332526611.db2.gz	KRWUSTMCGICUFT-KXBFYZLASA-N	0	3	337.467	3.194	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2coc(C3CCCCC3)n2)[C@@H](C)C1	ZINC000945219705	1332533879	/nfs/dbraw/zinc/53/38/79/1332533879.db2.gz	DLTIXOBRHAEAAY-DOTOQJQBSA-N	0	3	343.471	3.186	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@H]3[C@@H]4CCCC[C@@H]43)CC[C@@H]2C1	ZINC000946536387	1332848900	/nfs/dbraw/zinc/84/89/00/1332848900.db2.gz	KUELUGQUFCOGRP-MEWRGDBZSA-N	0	3	336.907	3.346	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3c(C)coc3C)CC[C@@H]2C1	ZINC000946576516	1332856592	/nfs/dbraw/zinc/85/65/92/1332856592.db2.gz	RRVGXNHEBBOXLG-IYBDPMFKSA-N	0	3	336.863	3.433	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3cnc(C4CC4)o3)CC[C@@H]2C1	ZINC000946625735	1332865719	/nfs/dbraw/zinc/86/57/19/1332865719.db2.gz	CKYCRKHLIWKDAW-GASCZTMLSA-N	0	3	349.862	3.089	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H]2CN(Cc3ccns3)C[C@H]2CC1	ZINC000946758390	1332892575	/nfs/dbraw/zinc/89/25/75/1332892575.db2.gz	JNULFFLBKLDRAR-FCEWJHQRSA-N	0	3	347.528	3.416	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccccc2CC(C)(C)C)C[C@H]1C	ZINC000947429460	1333124935	/nfs/dbraw/zinc/12/49/35/1333124935.db2.gz	IDDSRDXXZLTENB-AEFFLSMTSA-N	0	3	326.484	3.491	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)c3ccccc3n2)C[C@@H]1C	ZINC000947456277	1333135912	/nfs/dbraw/zinc/13/59/12/1333135912.db2.gz	YXKUOXFVWWLPNJ-IRXDYDNUSA-N	0	3	335.451	3.149	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(C)cc2Cl)C[C@H]1C	ZINC000947459679	1333136700	/nfs/dbraw/zinc/13/67/00/1333136700.db2.gz	OFJHEQVVZGUHGS-WBVHZDCISA-N	0	3	332.875	3.183	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3c([nH]2)c(F)ccc3C)C[C@H]1C	ZINC000947467365	1333139791	/nfs/dbraw/zinc/13/97/91/1333139791.db2.gz	AITLPWPJSMQLHN-CABCVRRESA-N	0	3	341.430	3.221	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2c(C)cccc2Cl)C[C@@H]1C	ZINC000947496454	1333147011	/nfs/dbraw/zinc/14/70/11/1333147011.db2.gz	BCQJBVUYRMNFRG-JKSUJKDBSA-N	0	3	332.875	3.183	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3c(o2)c(F)ccc3C)C[C@@H]1C	ZINC000947560537	1333172038	/nfs/dbraw/zinc/17/20/38/1333172038.db2.gz	SCCVTZKHSQVHLU-GJZGRUSLSA-N	0	3	342.414	3.486	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2nsc3ccc(C)cc32)C[C@H]1C	ZINC000947622023	1333196339	/nfs/dbraw/zinc/19/63/39/1333196339.db2.gz	ZTTOJQHMVDACJW-HUUCEWRRSA-N	0	3	341.480	3.211	20	30		EGEDHN
Cc1cocc1C(=O)N[C@H]1CCN(Cc2cccc(C#N)c2)[C@@H](C)C1	ZINC000947623490	1333196799	/nfs/dbraw/zinc/19/67/99/1333196799.db2.gz	BMBAQXUJAZRSIW-YJBOKZPZSA-N	0	3	337.423	3.243	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)C(C)(C)C2CC2)CCN1Cc1cccc(C#N)c1	ZINC000947632744	1333201233	/nfs/dbraw/zinc/20/12/33/1333201233.db2.gz	FOSQVMFJIKIARS-DNVCBOLYSA-N	0	3	339.483	3.464	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C(C)(C)c2ccc(Cl)cc2)C[C@@H]1C	ZINC000947670643	1333217536	/nfs/dbraw/zinc/21/75/36/1333217536.db2.gz	HBSLCCPMQUEOEL-WMLDXEAASA-N	0	3	332.875	3.220	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)C2CC3(CC3)C2)CCN1Cc1cccc(C#N)c1	ZINC000947702291	1333231816	/nfs/dbraw/zinc/23/18/16/1333231816.db2.gz	LYRHFUGEOOZABY-HNAYVOBHSA-N	0	3	337.467	3.218	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(CCc3ccns3)[C@H](C)C2)C1	ZINC000947702767	1333232642	/nfs/dbraw/zinc/23/26/42/1333232642.db2.gz	SBNCZFDCWGFJDK-HUUCEWRRSA-N	0	3	333.501	3.011	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccccc2OC2CCC2)C[C@H]1C	ZINC000947712038	1333236977	/nfs/dbraw/zinc/23/69/77/1333236977.db2.gz	ZYFDXKSZHKWTNA-IAGOWNOFSA-N	0	3	340.467	3.224	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2c[nH]c3c2cccc3C)C[C@H]1C	ZINC000947776865	1333258381	/nfs/dbraw/zinc/25/83/81/1333258381.db2.gz	ZSMYUXCUVMMCHZ-SJLPKXTDSA-N	0	3	337.467	3.011	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2scnc2C(C)(C)C)C[C@H]1C	ZINC000947792390	1333263377	/nfs/dbraw/zinc/26/33/77/1333263377.db2.gz	LTXSOMIKFXNETA-KGLIPLIRSA-N	0	3	333.501	3.047	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc3nc(C)sc3c2)C[C@@H]1C	ZINC000947894694	1333295279	/nfs/dbraw/zinc/29/52/79/1333295279.db2.gz	BYQIATIJYGZKJF-BBRMVZONSA-N	0	3	341.480	3.211	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnn(C(CC)CC)c2C)C[C@@H]1C	ZINC000947907723	1333301414	/nfs/dbraw/zinc/30/14/14/1333301414.db2.gz	JPLCBNFSKKLHOH-HOCLYGCPSA-N	0	3	332.492	3.321	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnc(-c3ccco3)s2)C[C@H]1C	ZINC000947943525	1333314125	/nfs/dbraw/zinc/31/41/25/1333314125.db2.gz	MBXSEOCIJHGSPU-CHWSQXEVSA-N	0	3	331.441	3.172	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccccc2OC(C)C)C[C@H]1C	ZINC000947948140	1333315777	/nfs/dbraw/zinc/31/57/77/1333315777.db2.gz	KZMSUWPZPFOLKF-SJORKVTESA-N	0	3	328.456	3.080	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(F)c(F)c(F)c2F)C[C@@H]1C	ZINC000947957726	1333320408	/nfs/dbraw/zinc/32/04/08/1333320408.db2.gz	MXNACGFODVLDHS-UWVGGRQHSA-N	0	3	330.325	3.012	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc3ccccc3c2)C[C@@H]1C	ZINC000948017768	1333343660	/nfs/dbraw/zinc/34/36/60/1333343660.db2.gz	XCPCLJGUMSVCQJ-LAUBAEHRSA-N	0	3	334.463	3.375	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc3ccccc3c2)C[C@H]1C	ZINC000948017766	1333343927	/nfs/dbraw/zinc/34/39/27/1333343927.db2.gz	XCPCLJGUMSVCQJ-DYESRHJHSA-N	0	3	334.463	3.375	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2cc3ccccc3nc2C)CC1	ZINC000948416652	1333516698	/nfs/dbraw/zinc/51/66/98/1333516698.db2.gz	LORYDTZWYGVYAO-GOSISDBHSA-N	0	3	335.451	3.103	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cn(C)c3ccccc23)CC1	ZINC000948595492	1333589779	/nfs/dbraw/zinc/58/97/79/1333589779.db2.gz	ZWUJHNTVIMJJFL-KRWDZBQOSA-N	0	3	337.467	3.128	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2ccc(-c3ccco3)o2)CC1	ZINC000948605045	1333593820	/nfs/dbraw/zinc/59/38/20/1333593820.db2.gz	LVCZHZHPWPXIJJ-INIZCTEOSA-N	0	3	340.423	3.489	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)[C@@H]2CCCCC2(F)F)CC1	ZINC000948648779	1333612318	/nfs/dbraw/zinc/61/23/18/1333612318.db2.gz	WAYPJTODLCUBBM-HOTGVXAUSA-N	0	3	326.431	3.148	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)C2(c3cccc(F)c3)CCC2)CC1	ZINC000948664981	1333620213	/nfs/dbraw/zinc/62/02/13/1333620213.db2.gz	CBSWQHZEZYYWIS-LJQANCHMSA-N	0	3	342.458	3.194	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2ccc(Cl)c(F)c2)CC1	ZINC000948804509	1333686665	/nfs/dbraw/zinc/68/66/65/1333686665.db2.gz	PDGDQGJWVBFXPS-HNNXBMFYSA-N	0	3	336.838	3.429	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)[C@@]2(C)CCCc3ccccc32)CC1	ZINC000948852133	1333709034	/nfs/dbraw/zinc/70/90/34/1333709034.db2.gz	IHPYNMVFTDAHOI-UGKGYDQZSA-N	0	3	338.495	3.227	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cccc3c2ccn3C)CC1	ZINC000948855871	1333711233	/nfs/dbraw/zinc/71/12/33/1333711233.db2.gz	BQSRNWRGFSTJEO-KRWDZBQOSA-N	0	3	337.467	3.128	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)[C@H](C)c2cc(C)oc2C)CC1	ZINC000948860515	1333711454	/nfs/dbraw/zinc/71/14/54/1333711454.db2.gz	DZEVMVYIVKYKBH-SJLPKXTDSA-N	0	3	330.472	3.336	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)[C@H](C)c2ccccc2F)CC1	ZINC000948868481	1333715177	/nfs/dbraw/zinc/71/51/77/1333715177.db2.gz	MARCQHUICSBCPI-IAGOWNOFSA-N	0	3	330.447	3.265	20	30		EGEDHN
N#Cc1ccc(C(=O)NC[C@@H]2c3ccccc3CCN2CC2CCC2)[nH]1	ZINC000948909956	1333729635	/nfs/dbraw/zinc/72/96/35/1333729635.db2.gz	FJRXWCZQOGPIHH-HXUWFJFHSA-N	0	3	348.450	3.016	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)c3ccsc3)CC2)C1	ZINC000949290210	1333816131	/nfs/dbraw/zinc/81/61/31/1333816131.db2.gz	WWYOAFILGRYWCE-UHFFFAOYSA-N	0	3	334.485	3.021	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)CC3=CCCCC3)CC2)C1	ZINC000949323175	1333823613	/nfs/dbraw/zinc/82/36/13/1333823613.db2.gz	YGOKLDKQYFQLHD-UHFFFAOYSA-N	0	3	332.488	3.146	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C[C@H]3CCC[C@H]3C)CC2)C1	ZINC000949365844	1333831399	/nfs/dbraw/zinc/83/13/99/1333831399.db2.gz	ITDKQZCDQCNVGJ-RTBURBONSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C[C@H]3CCC[C@H]3C)CC2)C1	ZINC000949369938	1333832416	/nfs/dbraw/zinc/83/24/16/1333832416.db2.gz	HPKYCRLJXASIJD-QZTJIDSGSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C3CCC4(CC4)CC3)CC2)C1	ZINC000949411923	1333841090	/nfs/dbraw/zinc/84/10/90/1333841090.db2.gz	IULJHXJXULNGGZ-UHFFFAOYSA-N	0	3	346.515	3.226	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C3(C)CC=CC3)CC2)C1	ZINC000949464274	1333854168	/nfs/dbraw/zinc/85/41/68/1333854168.db2.gz	ZLDHDTBICVXVDI-UHFFFAOYSA-N	0	3	332.488	3.002	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@H]3CCC(C)(C)C3)CC2)C1	ZINC000949466934	1333855696	/nfs/dbraw/zinc/85/56/96/1333855696.db2.gz	WUTUUHBBXXJWQI-SFHVURJKSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@@H]3C[C@@]3(C)CC)CC2)C1	ZINC000949504379	1333861868	/nfs/dbraw/zinc/86/18/68/1333861868.db2.gz	RAPKNILZEKQKCM-PKOBYXMFSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C3C[C@@H](C)C[C@H](C)C3)CC2)C1	ZINC000949533678	1333870176	/nfs/dbraw/zinc/87/01/76/1333870176.db2.gz	CVACVOLCKWFJAU-ROUUACIJSA-N	0	3	348.531	3.328	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2c(C)c(F)ccc2Cl)C1	ZINC000967032762	1335646491	/nfs/dbraw/zinc/64/64/91/1335646491.db2.gz	OKMGBSZNXBAHJI-WBMJQRKESA-N	0	3	336.838	3.251	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccc3cc(C)ccc3n2)C1	ZINC000967293644	1335692530	/nfs/dbraw/zinc/69/25/30/1335692530.db2.gz	WICYNOXWLHSJQG-UZLBHIALSA-N	0	3	335.451	3.007	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccc(C)c(Cl)c2F)C1	ZINC000967420884	1335733322	/nfs/dbraw/zinc/73/33/22/1335733322.db2.gz	ZHIIMDFVALXWJD-WFASDCNBSA-N	0	3	336.838	3.251	20	30		EGEDHN
N#Cc1cc(CN[C@@H]2CCN(C(=O)C=C3CCCCC3)C2)ccc1F	ZINC000967453031	1335744287	/nfs/dbraw/zinc/74/42/87/1335744287.db2.gz	XVUGKVMJNVJRSE-GOSISDBHSA-N	0	3	341.430	3.278	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2cc(Cl)c(Cl)[nH]2)C1	ZINC000967527104	1335768414	/nfs/dbraw/zinc/76/84/14/1335768414.db2.gz	PSTCOEUSAIAUJQ-ZWNOBZJWSA-N	0	3	330.259	3.338	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(C(=O)C3CCCCCC3)C2)cc1F	ZINC000967664668	1335803777	/nfs/dbraw/zinc/80/37/77/1335803777.db2.gz	KEKKOQBGOKXRTR-GOSISDBHSA-N	0	3	343.446	3.358	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CN(Cc3cccc(C)c3)CC[C@@H]2C)c1	ZINC000968316710	1335888511	/nfs/dbraw/zinc/88/85/11/1335888511.db2.gz	GIKLQPWPGBUDLQ-LAUBAEHRSA-N	0	3	347.462	3.012	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2ccc(OCC)c(C)c2)C1	ZINC000968375384	1335908909	/nfs/dbraw/zinc/90/89/09/1335908909.db2.gz	WECYKEXPEBSEMP-CRAIPNDOSA-N	0	3	330.472	3.410	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(C(=O)C(F)=C3CCCC3)C2)cc1F	ZINC000968402931	1335921052	/nfs/dbraw/zinc/92/10/52/1335921052.db2.gz	CYBOIIPUMCXKMR-MRXNPFEDSA-N	0	3	345.393	3.185	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2occc2Br)C1	ZINC000968426056	1335926708	/nfs/dbraw/zinc/92/67/08/1335926708.db2.gz	ANDDXZPSUKWWPB-YPMHNXCESA-N	0	3	341.249	3.058	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccc(C(F)F)cc2F)C1	ZINC000968459082	1335931759	/nfs/dbraw/zinc/93/17/59/1335931759.db2.gz	IZALJTDSPDCDRI-LRDDRELGSA-N	0	3	338.373	3.227	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2ncc(Cl)cc2Cl)C1	ZINC000968473062	1335934824	/nfs/dbraw/zinc/93/48/24/1335934824.db2.gz	YWKFZUSOTQKRKK-FZMZJTMJSA-N	0	3	342.270	3.405	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2cccc(-c3cnco3)c2)C1	ZINC000968492537	1335941057	/nfs/dbraw/zinc/94/10/57/1335941057.db2.gz	JMSNKCLNNXTOJK-QAPCUYQASA-N	0	3	339.439	3.358	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)C2(c3ccccc3F)CC2)C1	ZINC000968498054	1335942253	/nfs/dbraw/zinc/94/22/53/1335942253.db2.gz	VVTDDRGHAWLROR-YJBOKZPZSA-N	0	3	330.447	3.260	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)C(C)(C)c2cccc(OC)c2)C1	ZINC000968501046	1335943280	/nfs/dbraw/zinc/94/32/80/1335943280.db2.gz	ODUKJAKAPZSAKO-VQIMIIECSA-N	0	3	344.499	3.376	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cc(C)nc3ccccc32)C1	ZINC000968609443	1335982144	/nfs/dbraw/zinc/98/21/44/1335982144.db2.gz	HHTFOSPDNAMSHN-QRWLVFNGSA-N	0	3	335.451	3.007	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](C)[C@H](NC(=O)c2scnc2Cl)C1	ZINC000968651046	1335995899	/nfs/dbraw/zinc/99/58/99/1335995899.db2.gz	COAFSRIRCNECDB-VXGBXAGGSA-N	0	3	327.881	3.203	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)C(C)(C)c2ccc(OC)cc2)C1	ZINC000968665023	1336002192	/nfs/dbraw/zinc/00/21/92/1336002192.db2.gz	LVUJJERDROTULE-QFBILLFUSA-N	0	3	344.499	3.376	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2ccc(N(C)CC)cc2)C1	ZINC000968701295	1336017354	/nfs/dbraw/zinc/01/73/54/1336017354.db2.gz	FOYQDBJJPANGFG-LPHOPBHVSA-N	0	3	329.488	3.159	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)C2(c3ccccc3C)CC2)C1	ZINC000968706760	1336019313	/nfs/dbraw/zinc/01/93/13/1336019313.db2.gz	UIPXBIMLKMUMTB-PKOBYXMFSA-N	0	3	326.484	3.429	20	30		EGEDHN
CC1CC(C(=O)NC[C@@H]2CCCCCN2Cc2cccc(C#N)c2)C1	ZINC000968807131	1336057552	/nfs/dbraw/zinc/05/75/52/1336057552.db2.gz	ZJIBVYPOBUAXPI-GQOXECLESA-N	0	3	339.483	3.465	20	30		EGEDHN
C#CCCN1CCCCC[C@H]1CNC(=O)c1conc1C1CCCC1	ZINC000968888440	1336080701	/nfs/dbraw/zinc/08/07/01/1336080701.db2.gz	VEHDUKYJOANXCV-KRWDZBQOSA-N	0	3	343.471	3.330	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1c(C)cc(F)cc1C	ZINC000968979656	1336107956	/nfs/dbraw/zinc/10/79/56/1336107956.db2.gz	JPVMGLRJJWMVQZ-SFHVURJKSA-N	0	3	330.447	3.440	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)[C@@H]1CCCC(F)(F)C1	ZINC000969025816	1336121851	/nfs/dbraw/zinc/12/18/51/1336121851.db2.gz	WDYLJRCDWKRBOY-CVEARBPZSA-N	0	3	326.431	3.196	20	30		EGEDHN
N#Cc1cccc(CN2CCCCC[C@@H]2CNC(=O)[C@H]2CC23CC3)c1	ZINC000969044490	1336125669	/nfs/dbraw/zinc/12/56/69/1336125669.db2.gz	RAJAAVYVSLRENK-RTBURBONSA-N	0	3	337.467	3.219	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1noc2c1CCCCC2	ZINC000969053294	1336129616	/nfs/dbraw/zinc/12/96/16/1336129616.db2.gz	IHZUWJJGPSHATE-INIZCTEOSA-N	0	3	345.487	3.494	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1ccccc1OC	ZINC000969064817	1336136277	/nfs/dbraw/zinc/13/62/77/1336136277.db2.gz	NAYQYKNEAGSRNH-NZSAHSFTSA-N	0	3	342.483	3.346	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccc(C)nc1OCCC	ZINC000969090791	1336139732	/nfs/dbraw/zinc/13/97/32/1336139732.db2.gz	KPIUKPOWIRMXEY-KRWDZBQOSA-N	0	3	345.487	3.339	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1ccc(OCC)cc1	ZINC000969134302	1336155827	/nfs/dbraw/zinc/15/58/27/1336155827.db2.gz	YECMOVATHJTTCJ-SFHVURJKSA-N	0	3	328.456	3.083	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cc(-c2ccc(C)o2)n[nH]1	ZINC000969144023	1336160672	/nfs/dbraw/zinc/16/06/72/1336160672.db2.gz	AXBRUGAUEMPREF-OAHLLOKOSA-N	0	3	342.443	3.139	20	30		EGEDHN
CC1(C(=O)N2CC[C@@H](NCc3ccc(C#N)c(F)c3)C2)CCCCC1	ZINC000969811841	1336250327	/nfs/dbraw/zinc/25/03/27/1336250327.db2.gz	UCULFBIYBDHCPV-QGZVFWFLSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3ccc(C)nc3C)C2)CC1	ZINC000969830370	1336251874	/nfs/dbraw/zinc/25/18/74/1336251874.db2.gz	KBRXNBLYBQPSMV-LJQANCHMSA-N	0	3	327.472	3.135	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3cc(F)cc(F)c3)C2)CC1	ZINC000969830927	1336252349	/nfs/dbraw/zinc/25/23/49/1336252349.db2.gz	WJXRRYNLJPBPAG-GOSISDBHSA-N	0	3	334.410	3.402	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3ccc(C#N)s3)C2)CC1	ZINC000969830947	1336252358	/nfs/dbraw/zinc/25/23/58/1336252358.db2.gz	WTKUQSAJBUQTPS-OAHLLOKOSA-N	0	3	329.469	3.057	20	30		EGEDHN
CC1(C)CC[C@H](C(=O)N2CC[C@@H](NCc3ccc(F)c(C#N)c3)C2)C1	ZINC000969867717	1336255216	/nfs/dbraw/zinc/25/52/16/1336255216.db2.gz	SKJWFDAAKBKOHD-DOTOQJQBSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)[C@@H]2CCCC[C@H]2C(F)(F)F)C1	ZINC000969881419	1336256777	/nfs/dbraw/zinc/25/67/77/1336256777.db2.gz	TYVXKPDRSHLQSZ-BPLDGKMQSA-N	0	3	332.410	3.368	20	30		EGEDHN
C#CCCN1CC([C@H](C)NC(=O)c2ccc(C(C)(C)CC)cc2)C1	ZINC000969926845	1336261780	/nfs/dbraw/zinc/26/17/80/1336261780.db2.gz	NPTGGMVOFWZWRX-INIZCTEOSA-N	0	3	326.484	3.448	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)[C@@H]2C[C@H]2c2ccccc2CC)C1	ZINC000970344855	1336295899	/nfs/dbraw/zinc/29/58/99/1336295899.db2.gz	XFZICBAUPBDUHC-UIAACRFSSA-N	0	3	326.484	3.365	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)N2CC[C@@H](NCc3ccc(F)c(C#N)c3)C2)CC1	ZINC000970528859	1336317882	/nfs/dbraw/zinc/31/78/82/1336317882.db2.gz	ZLPKPFATPCWJAW-QGPMSJSTSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)c2ccccc2OCC(C)C)C1	ZINC000970598750	1336326123	/nfs/dbraw/zinc/32/61/23/1336326123.db2.gz	ZBTLTSVIOPUMQN-MRXNPFEDSA-N	0	3	330.472	3.348	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)c2ccc3nc(C)sc3c2)C1	ZINC000970690359	1336333470	/nfs/dbraw/zinc/33/34/70/1336333470.db2.gz	NRICCLYBCHVPPA-LBPRGKRZSA-N	0	3	329.469	3.231	20	30		EGEDHN
C[C@@H]1C[C@H]1CC(=O)N(C)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001005929655	1336423619	/nfs/dbraw/zinc/42/36/19/1336423619.db2.gz	KRUHYCCSYCPEFL-QAPCUYQASA-N	0	3	325.456	3.027	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2c[nH]c(-c3ccccc3)n2)CC1	ZINC001006066848	1336445900	/nfs/dbraw/zinc/44/59/00/1336445900.db2.gz	CCSUWCDNBULIMI-UHFFFAOYSA-N	0	3	338.455	3.189	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cnc(C(C)C)nc2C)CC1	ZINC001006090934	1336451169	/nfs/dbraw/zinc/45/11/69/1336451169.db2.gz	IVTYMVWTBCEIEL-UHFFFAOYSA-N	0	3	330.476	3.021	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccnc(OC3CCC3)c2)CC1	ZINC001006201374	1336466115	/nfs/dbraw/zinc/46/61/15/1336466115.db2.gz	MBXDZIXNTIHNBG-UHFFFAOYSA-N	0	3	343.471	3.125	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2ccc(N(C)C(C)C)cc2)CC1	ZINC001006471345	1336513551	/nfs/dbraw/zinc/51/35/51/1336513551.db2.gz	QFVCYZCFWBZKOW-UHFFFAOYSA-N	0	3	329.488	3.254	20	30		EGEDHN
Cc1cccc([C@@H](C)N2CCC[C@@H](NC(=O)c3cc(C#N)c[nH]3)C2)c1	ZINC001007030016	1336628401	/nfs/dbraw/zinc/62/84/01/1336628401.db2.gz	PNEPUWKDHHNOJO-CRAIPNDOSA-N	0	3	336.439	3.150	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCN(CCc3ccc(C)cc3)C2)cc1	ZINC001008147335	1336779889	/nfs/dbraw/zinc/77/98/89/1336779889.db2.gz	KBVNKHUNMOKDAZ-QFIPXVFZSA-N	0	3	346.474	3.413	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2nc(Cl)sc2Cl)C1	ZINC001008170721	1336783791	/nfs/dbraw/zinc/78/37/91/1336783791.db2.gz	PKTQYPMACVMANB-SECBINFHSA-N	0	3	334.272	3.220	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2oc3ccccc3c2OC)C1	ZINC001008169439	1336783894	/nfs/dbraw/zinc/78/38/94/1336783894.db2.gz	MAKTYRXXTULKKB-CQSZACIVSA-N	0	3	328.412	3.212	20	30		EGEDHN
C=C(C)CCN1CCC[C@H](NC(=O)c2coc(C3CCCC3)n2)C1	ZINC001009039051	1336958533	/nfs/dbraw/zinc/95/85/33/1336958533.db2.gz	XECMDRMVYZHPSW-INIZCTEOSA-N	0	3	331.460	3.493	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2cnn(C(C)C)c2C2CC2)C1	ZINC001009139532	1336975528	/nfs/dbraw/zinc/97/55/28/1336975528.db2.gz	IZVWWCQXRXPUNA-MRXNPFEDSA-N	0	3	330.476	3.112	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCN(Cc3cc(C)ccc3C)C2)nc1	ZINC001009250047	1336991506	/nfs/dbraw/zinc/99/15/06/1336991506.db2.gz	DOSMSIXWQUHQAK-FQEVSTJZSA-N	0	3	347.462	3.074	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN(CCCC3CCCC3)C2)nc1	ZINC001009256296	1336992462	/nfs/dbraw/zinc/99/24/62/1336992462.db2.gz	YNEBWFSBZVUNKZ-LJQANCHMSA-N	0	3	339.483	3.228	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2cc(Cl)cc3c2OCC3)C1	ZINC001009664768	1337055506	/nfs/dbraw/zinc/05/55/06/1337055506.db2.gz	XRAXVVJULWGWGU-HNNXBMFYSA-N	0	3	334.847	3.045	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2cc(Cl)cc3c2OCC3)C1	ZINC001009664769	1337055774	/nfs/dbraw/zinc/05/57/74/1337055774.db2.gz	XRAXVVJULWGWGU-OAHLLOKOSA-N	0	3	334.847	3.045	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CCN(Cc2cccc(CC)c2)C1	ZINC001014725470	1337886871	/nfs/dbraw/zinc/88/68/71/1337886871.db2.gz	OMAGPUYGFADDCO-LJQANCHMSA-N	0	3	337.467	3.241	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCN(CCc3ccc(OC)cc3)C2)CC1	ZINC001015654810	1338234253	/nfs/dbraw/zinc/23/42/53/1338234253.db2.gz	FZDJUQZCVXZVCJ-LJQANCHMSA-N	0	3	342.483	3.175	20	30		EGEDHN
C=CCOc1cccnc1C(=O)N[C@H]1CCN(CCCC2CCC2)C1	ZINC001015969534	1338383872	/nfs/dbraw/zinc/38/38/72/1338383872.db2.gz	VYGCFHYJWCPRKC-KRWDZBQOSA-N	0	3	343.471	3.031	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@@H]1CCN(Cc2ccc(C)cc2C)C1	ZINC001016114974	1338466942	/nfs/dbraw/zinc/46/69/42/1338466942.db2.gz	VIAFGHDXYHLJDU-JOCHJYFZSA-N	0	3	346.474	3.218	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N[C@H]1CC12CCN(Cc1cccc(C#N)c1)CC2	ZINC001016577688	1338654134	/nfs/dbraw/zinc/65/41/34/1338654134.db2.gz	YOVNKDQHNBYXQT-MSOLQXFVSA-N	0	3	337.467	3.075	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(CC(C)C)s2)CC1	ZINC001016662806	1338683162	/nfs/dbraw/zinc/68/31/62/1338683162.db2.gz	DMCZXHUVYHJFOD-KRWDZBQOSA-N	0	3	330.497	3.164	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2cc3c(ccc(C)c3C)[nH]2)CC1	ZINC001016764940	1338716814	/nfs/dbraw/zinc/71/68/14/1338716814.db2.gz	ZYMMYTFYNMVNMW-IBGZPJMESA-N	0	3	335.451	3.002	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC23CCN(Cc2scnc2C)CC3)C1	ZINC001016812659	1338734963	/nfs/dbraw/zinc/73/49/63/1338734963.db2.gz	QLZDNTUOBZMHSL-INIZCTEOSA-N	0	3	345.512	3.279	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)[C@@]2(C)C[C@@H]2c2ccccc2)CC1	ZINC001016874854	1338754892	/nfs/dbraw/zinc/75/48/92/1338754892.db2.gz	ZRSIFVVCJFWTFD-DYXWJJEUSA-N	0	3	336.479	3.174	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)[C@@H](C)c2ccc(CC)cc2)CC1	ZINC001016880312	1338757529	/nfs/dbraw/zinc/75/75/29/1338757529.db2.gz	SHUVMRYZVHRLQQ-PXNSSMCTSA-N	0	3	338.495	3.347	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)[C@@H](C)c2ccc(C)s2)CC1	ZINC001016926920	1338772939	/nfs/dbraw/zinc/77/29/39/1338772939.db2.gz	OFADGIGFVVZWPV-RDJZCZTQSA-N	0	3	330.497	3.154	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2cc(C)c(F)cc2Cl)CC1	ZINC001016949601	1338781863	/nfs/dbraw/zinc/78/18/63/1338781863.db2.gz	GFXKNZIAHNBPKY-MRXNPFEDSA-N	0	3	334.822	3.005	20	30		EGEDHN
Cc1ccc(CN(C)C[C@H]2CCCN(C(=O)[C@@H](C)C#N)C2)c(Cl)c1	ZINC001017070871	1338848112	/nfs/dbraw/zinc/84/81/12/1338848112.db2.gz	JEYCQUHVUIZBMF-JKSUJKDBSA-N	0	3	347.890	3.479	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC[C@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001017092658	1338860861	/nfs/dbraw/zinc/86/08/61/1338860861.db2.gz	IOLHBXOXDKTIHZ-XUYKZZHDSA-N	0	3	331.485	3.256	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H](CN(C)Cc2ocnc2C)C1	ZINC001017179302	1338922371	/nfs/dbraw/zinc/92/23/71/1338922371.db2.gz	HYXHSWBPCHASBA-MRXNPFEDSA-N	0	3	333.476	3.256	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@H](CN(C)Cc3cccnc3)C2)CC1	ZINC001017197037	1338942118	/nfs/dbraw/zinc/94/21/18/1338942118.db2.gz	MQLQAFWLCYJPFF-LJQANCHMSA-N	0	3	341.499	3.498	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@H](C)n1ccnc1CC	ZINC001017565883	1339368415	/nfs/dbraw/zinc/36/84/15/1339368415.db2.gz	YVVLUIQVFSTTTO-OKZBNKHCSA-N	0	3	344.503	3.038	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cccc2nc(C)[nH]c21	ZINC001018139020	1339512068	/nfs/dbraw/zinc/51/20/68/1339512068.db2.gz	DOXGKFYKVATFRE-IYBDPMFKSA-N	0	3	338.455	3.126	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1c(F)cccc1Cl	ZINC001018211900	1339534643	/nfs/dbraw/zinc/53/46/43/1339534643.db2.gz	NFPHZQFIXKCOFW-OKILXGFUSA-N	0	3	336.838	3.273	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)c1ccc(F)c(F)c1	ZINC001018289569	1339564477	/nfs/dbraw/zinc/56/44/77/1339564477.db2.gz	SDQBFXAWOGQVKQ-CWRNSKLLSA-N	0	3	334.410	3.320	20	30		EGEDHN
CC(C)(CC(=O)N1CC[C@H](NCc2ccc(F)c(C#N)c2)C1)C1CC1	ZINC001018811143	1339732055	/nfs/dbraw/zinc/73/20/55/1339732055.db2.gz	AXNGMIPIQQNSQS-KRWDZBQOSA-N	0	3	343.446	3.214	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)[C@H]3CCCC4(CC4)C3)C2)s1	ZINC001018843109	1339737171	/nfs/dbraw/zinc/73/71/71/1339737171.db2.gz	IZDQDFJQDBVEIW-GJZGRUSLSA-N	0	3	343.496	3.281	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1CC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001018903369	1339747414	/nfs/dbraw/zinc/74/74/14/1339747414.db2.gz	FJRQOLHHFCKBOL-INIZCTEOSA-N	0	3	331.435	3.070	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1ccc(OC)c(C2CC2)c1	ZINC001028231966	1340495954	/nfs/dbraw/zinc/49/59/54/1340495954.db2.gz	ZRJNKPBNWJKSOI-QGZVFWFLSA-N	0	3	328.456	3.343	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)C1CC(c2ccc(F)cc2)C1	ZINC001028349281	1340588001	/nfs/dbraw/zinc/58/80/01/1340588001.db2.gz	KYPFTHISPTVCGO-TVPLGVNVSA-N	0	3	330.447	3.476	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](CNC(=O)c3ccc(Cl)o3)C2)cc1	ZINC001028408714	1340630161	/nfs/dbraw/zinc/63/01/61/1340630161.db2.gz	JJQLSQSSWNDOKT-HNNXBMFYSA-N	0	3	343.814	3.057	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@@H]1CCN(Cc2cccc(F)c2)C1	ZINC001028592740	1340717431	/nfs/dbraw/zinc/71/74/31/1340717431.db2.gz	BHLXZAYOIFEPCT-KRWDZBQOSA-N	0	3	341.430	3.065	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)c2ccc3c4c(cccc42)CC3)C1	ZINC001028671674	1340749943	/nfs/dbraw/zinc/74/99/43/1340749943.db2.gz	NYWIJWFLKXQKDB-MRXNPFEDSA-N	0	3	332.447	3.013	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H]1C(=O)NC[C@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC001028813062	1340831839	/nfs/dbraw/zinc/83/18/39/1340831839.db2.gz	SOVYXNAPRVTEDW-VAMGGRTRSA-N	0	3	339.483	3.179	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](CNC(=O)[C@H]3CC34CCCC4)C2)cc1	ZINC001028909305	1340881286	/nfs/dbraw/zinc/88/12/86/1340881286.db2.gz	JAXRYOCMPHYXMP-RTBURBONSA-N	0	3	337.467	3.077	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)c2cc(CC)c(CCC)s2)C1	ZINC001028978957	1340899553	/nfs/dbraw/zinc/89/95/53/1340899553.db2.gz	LXPQPHSREJXQRZ-HNNXBMFYSA-N	0	3	332.513	3.338	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)C1CCN(C(=O)C2(CF)CC2)CC1	ZINC001029143576	1340942048	/nfs/dbraw/zinc/94/20/48/1340942048.db2.gz	LRQSCNQDKNRMDA-HNNXBMFYSA-N	0	3	343.446	3.025	20	30		EGEDHN
C[C@H](C#N)C(=O)N1C[C@H]2CC[C@@H](C1)N2[C@@H]1CCc2ccc(Cl)cc21	ZINC001029244780	1340960396	/nfs/dbraw/zinc/96/03/96/1340960396.db2.gz	LPPQPAPCONZVEH-GMLZMKKNSA-N	0	3	343.858	3.162	20	30		EGEDHN
C#Cc1ccc(C(=O)N2C[C@H]3CC[C@@H](C2)N3CCc2ccccc2)cc1	ZINC001029417030	1340985800	/nfs/dbraw/zinc/98/58/00/1340985800.db2.gz	HQDUMQLWTVINGR-SZPZYZBQSA-N	0	3	344.458	3.199	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@@H](CN(C)Cc3ccc(C#N)s3)C2)o1	ZINC001029637204	1341029558	/nfs/dbraw/zinc/02/95/58/1341029558.db2.gz	CHKCNYKQYMCPBL-AWEZNQCLSA-N	0	3	343.452	3.115	20	30		EGEDHN
C[C@@H](c1cc(F)ccc1F)N(C)C[C@@H]1CCN(C(=O)C#CC2CC2)C1	ZINC001029734406	1341058098	/nfs/dbraw/zinc/05/80/98/1341058098.db2.gz	WXJMTPQMVYQRPZ-HOCLYGCPSA-N	0	3	346.421	3.220	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@H](CN(C)Cc2cncc(C)c2)C1	ZINC001029748330	1341062383	/nfs/dbraw/zinc/06/23/83/1341062383.db2.gz	BTPKARCVBFZBAE-MRXNPFEDSA-N	0	3	349.906	3.449	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H](CN(C)Cc2ccc(F)cn2)C1	ZINC001029826302	1341087503	/nfs/dbraw/zinc/08/75/03/1341087503.db2.gz	OQHPAYOSHJUWAL-DNVCBOLYSA-N	0	3	333.451	3.103	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](CN(C)Cc2oc(C)nc2C)C1	ZINC001029828909	1341088756	/nfs/dbraw/zinc/08/87/56/1341088756.db2.gz	OCJJPRPWVSKXLM-QFBILLFUSA-N	0	3	333.476	3.174	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H](CN(C)Cc2oc(CC)nc2C)C1	ZINC001029828680	1341088777	/nfs/dbraw/zinc/08/87/77/1341088777.db2.gz	IGFXZMHGBWCPNI-OXQOHEQNSA-N	0	3	347.503	3.428	20	30		EGEDHN
C=C[C@@H](C(=O)N1CC[C@@H](CN(C)Cc2ccccn2)C1)c1ccccc1	ZINC001029907954	1341112244	/nfs/dbraw/zinc/11/22/44/1341112244.db2.gz	WJQIXZDPLIFHFJ-GHTZIAJQSA-N	0	3	349.478	3.332	20	30		EGEDHN
C[C@@H](CC(=O)N1CC[C@H](CN(C)Cc2ccc(C#N)s2)C1)C1CC1	ZINC001029911879	1341114460	/nfs/dbraw/zinc/11/44/60/1341114460.db2.gz	SOIYLZSUZXCPHJ-LSDHHAIUSA-N	0	3	345.512	3.336	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N(Cc1ccccc1)[C@@H]1CCCN(CC)C1	ZINC001029921711	1341120589	/nfs/dbraw/zinc/12/05/89/1341120589.db2.gz	PTVHNRZOHFILLR-AQNXPRMDSA-N	0	3	342.483	3.091	20	30		EGEDHN
C[C@@H]1C[C@@H]1C(=O)N1CCC(CN(C)Cc2ccc(C#N)cc2F)CC1	ZINC001029931406	1341125306	/nfs/dbraw/zinc/12/53/06/1341125306.db2.gz	NXGCRJASGIHKBS-KDOFPFPSSA-N	0	3	343.446	3.024	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC(CN(C)Cc2ccc(C#N)cc2F)CC1	ZINC001029937368	1341128630	/nfs/dbraw/zinc/12/86/30/1341128630.db2.gz	LJOUWEOPTAPCRJ-OAHLLOKOSA-N	0	3	345.462	3.414	20	30		EGEDHN
C[C@H](c1ccc(F)cc1F)N(C)CC1CCN(C(=O)[C@@H](C)C#N)CC1	ZINC001029945969	1341130699	/nfs/dbraw/zinc/13/06/99/1341130699.db2.gz	YZIOVGONMPYFRQ-UONOGXRCSA-N	0	3	349.425	3.356	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2c(F)ccc(F)c2Cl)CC[C@H]1C	ZINC001071845075	1354975969	/nfs/dbraw/zinc/97/59/69/1354975969.db2.gz	WOHKJUYQWYCFNO-NEPJUHHUSA-N	0	3	340.801	3.224	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)CC1CCN(C(=O)[C@H]2CC2(C)C)CC1	ZINC001029957258	1341134906	/nfs/dbraw/zinc/13/49/06/1341134906.db2.gz	YMCLHAILEDHTPS-QGZVFWFLSA-N	0	3	345.512	3.336	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC(CN(C)Cc3conc3C)CC2)C1	ZINC001029993576	1341150091	/nfs/dbraw/zinc/15/00/91/1341150091.db2.gz	KDRXPEYIVZZELI-UHFFFAOYSA-N	0	3	331.460	3.010	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC(CN(C)Cc3cc(C)ns3)CC2)C1	ZINC001029993694	1341150650	/nfs/dbraw/zinc/15/06/50/1341150650.db2.gz	NBIWBFRTODXBLV-UHFFFAOYSA-N	0	3	347.528	3.478	20	30		EGEDHN
CN(Cc1cc(C#N)ccc1F)CC1CCN(C(=O)C(C)(C)C)CC1	ZINC001030010756	1341156818	/nfs/dbraw/zinc/15/68/18/1341156818.db2.gz	DFBOOQJOQFYAOS-UHFFFAOYSA-N	0	3	345.462	3.414	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H]1COc2ccc(Cl)cc21	ZINC001032521429	1341529648	/nfs/dbraw/zinc/52/96/48/1341529648.db2.gz	LBHCEZHVVNLQMY-YQQAZPJKSA-N	0	3	346.858	3.067	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N1C[C@@H]2C[C@H]1CN2CCC1CCCCC1	ZINC001032677846	1341579653	/nfs/dbraw/zinc/57/96/53/1341579653.db2.gz	URTNYINDEGYNKM-MUGJNUQGSA-N	0	3	346.515	3.223	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cnc2ccc(F)cc2c1	ZINC001032715453	1341589017	/nfs/dbraw/zinc/58/90/17/1341589017.db2.gz	BNEYYZHKWVUGTJ-ROUUACIJSA-N	0	3	339.414	3.239	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc2ncsc2c1	ZINC001032766163	1341607588	/nfs/dbraw/zinc/60/75/88/1341607588.db2.gz	ULZPZUADYCCVHB-GJZGRUSLSA-N	0	3	327.453	3.161	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(N(C)CC)cc1	ZINC001032814360	1341625132	/nfs/dbraw/zinc/62/51/32/1341625132.db2.gz	KPOGHUDSOGYWDU-OALUTQOASA-N	0	3	327.472	3.008	20	30		EGEDHN
CN(C(=O)c1ccc(C#N)[nH]1)[C@@H]1CCN(Cc2ccc(C3CC3)cc2)C1	ZINC001033012179	1341695667	/nfs/dbraw/zinc/69/56/67/1341695667.db2.gz	TXTCVXCFLNTNIV-LJQANCHMSA-N	0	3	348.450	3.110	20	30		EGEDHN
CN(C(=O)c1c[nH]c(C#N)c1)[C@@H]1CCN(Cc2ccc(C3CC3)cc2)C1	ZINC001033022290	1341698901	/nfs/dbraw/zinc/69/89/01/1341698901.db2.gz	HCOUTLUYVZTDNO-HXUWFJFHSA-N	0	3	348.450	3.110	20	30		EGEDHN
C#CCCN1CC[C@H](N(C)C(=O)c2csc3cc(C)ccc32)C1	ZINC001033111069	1341729181	/nfs/dbraw/zinc/72/91/81/1341729181.db2.gz	PSTYXTQIRJEQKZ-HNNXBMFYSA-N	0	3	326.465	3.379	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](N(C)C(=O)c2sc(Cl)nc2C)C1	ZINC001033124366	1341732433	/nfs/dbraw/zinc/73/24/33/1341732433.db2.gz	WTLWVMYGSXXTRJ-GFCCVEGCSA-N	0	3	327.881	3.217	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2ccc(-c3cnco3)cc2)C1	ZINC001033193855	1341749236	/nfs/dbraw/zinc/74/92/36/1341749236.db2.gz	JHUHGCGHNPQAGZ-KRWDZBQOSA-N	0	3	325.412	3.064	20	30		EGEDHN
C#CCCN1CC[C@H](N(C)C(=O)c2ccc3c4c(cccc42)CC3)C1	ZINC001033252333	1341758512	/nfs/dbraw/zinc/75/85/12/1341758512.db2.gz	DOAWFRNTRBOSMH-SFHVURJKSA-N	0	3	332.447	3.108	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2ccccc2OC2CCC2)C1	ZINC001033404943	1341816260	/nfs/dbraw/zinc/81/62/60/1341816260.db2.gz	IXHKUNUNMUTCST-MRXNPFEDSA-N	0	3	328.456	3.340	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2cnoc2-c2ccccc2)C1	ZINC001033537151	1341862407	/nfs/dbraw/zinc/86/24/07/1341862407.db2.gz	REORXEJKPLJGNY-INIZCTEOSA-N	0	3	325.412	3.064	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2cnn(C3CCCCC3)c2)C1	ZINC001033561724	1341873406	/nfs/dbraw/zinc/87/34/06/1341873406.db2.gz	HGTJAYWIWZDMPK-SFHVURJKSA-N	0	3	330.476	3.111	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)C[C@H]2CCc3ccccc3C2)C1	ZINC001033611352	1341901057	/nfs/dbraw/zinc/90/10/57/1341901057.db2.gz	RNUUDYIYZYYUJI-FXAWDEMLSA-N	0	3	326.484	3.290	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@@H]2CCc3cc(OC)ccc32)C1	ZINC001033853232	1342044548	/nfs/dbraw/zinc/04/45/48/1342044548.db2.gz	XHUFRQKJEJHULO-FXAWDEMLSA-N	0	3	342.483	3.224	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccc(N(C)C)cc2F)C1	ZINC001033855231	1342046016	/nfs/dbraw/zinc/04/60/16/1342046016.db2.gz	ILDHVZWTSFUEGA-INIZCTEOSA-N	0	3	333.451	3.004	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cc(Cl)c(Cl)[nH]2)C1	ZINC001033912219	1342081604	/nfs/dbraw/zinc/08/16/04/1342081604.db2.gz	GXASNKDSTUNGGI-LLVKDONJSA-N	0	3	330.259	3.434	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2nc3ccccc3cc2C)C1	ZINC001033908210	1342079750	/nfs/dbraw/zinc/07/97/50/1342079750.db2.gz	ZHHOTDKMGSJZIJ-GOSISDBHSA-N	0	3	335.451	3.103	20	30		EGEDHN
C=CCCN1CC[C@@H](N(CC)C(=O)c2cc3c(C)nn(C)c3s2)C1	ZINC001033910919	1342082030	/nfs/dbraw/zinc/08/20/30/1342082030.db2.gz	PKTMDUAFNRUNTL-CQSZACIVSA-N	0	3	346.500	3.056	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cc3ccc(OC)cc3[nH]2)C1	ZINC001033916993	1342086085	/nfs/dbraw/zinc/08/60/85/1342086085.db2.gz	RQJDGONLXYGGQX-INIZCTEOSA-N	0	3	341.455	3.289	20	30		EGEDHN
C#Cc1ccc(C(=O)N(CC)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC001033923962	1342090078	/nfs/dbraw/zinc/09/00/78/1342090078.db2.gz	WAJDTYSYINTVJS-OAQYLSRUSA-N	0	3	332.447	3.405	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@H]2CCc3ccccc3C2)C1	ZINC001033975344	1342125211	/nfs/dbraw/zinc/12/52/11/1342125211.db2.gz	MGDJCABEYXXXES-VQTJNVASSA-N	0	3	326.484	3.290	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2ccc(O[C@H](C)CC)cc2)C1	ZINC001034014161	1342150489	/nfs/dbraw/zinc/15/04/89/1342150489.db2.gz	YMIDFAGLAZXRAC-IEBWSBKVSA-N	0	3	342.483	3.424	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2[nH]ccc2-c2ccccc2)C1	ZINC001034015737	1342153500	/nfs/dbraw/zinc/15/35/00/1342153500.db2.gz	JHCMNSASJQACKA-SFHVURJKSA-N	0	3	335.451	3.241	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccc(OC)c(OCC)c2)C1	ZINC001034037575	1342177646	/nfs/dbraw/zinc/17/76/46/1342177646.db2.gz	ZUUWDVZIBYCOGU-KRWDZBQOSA-N	0	3	346.471	3.206	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2ccc(CC)c(CC)c2)C1	ZINC001034059264	1342199304	/nfs/dbraw/zinc/19/93/04/1342199304.db2.gz	DOYTUYXDFAXEEG-HXUWFJFHSA-N	0	3	326.484	3.371	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC001034208778	1342318221	/nfs/dbraw/zinc/31/82/21/1342318221.db2.gz	GBXLWJILTCADHB-CQSZACIVSA-N	0	3	338.373	3.371	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@@H]2CCc3cc(C)ccc3O2)C1	ZINC001034311098	1342392718	/nfs/dbraw/zinc/39/27/18/1342392718.db2.gz	ZAVYHSKREJLCHY-QUCCMNQESA-N	0	3	342.483	3.235	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)C[C@@H]2CCOc3ccccc32)C1	ZINC001034347407	1342417326	/nfs/dbraw/zinc/41/73/26/1342417326.db2.gz	YQEWVXYYNWBULP-IRXDYDNUSA-N	0	3	328.456	3.100	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2cc(F)c(Cl)cc2F)C1	ZINC001034382531	1342451477	/nfs/dbraw/zinc/45/14/77/1342451477.db2.gz	YTKPOYNYRZGXHL-GFCCVEGCSA-N	0	3	340.801	3.226	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCCCN(CCc3scnc3C)C2)C1	ZINC001034388023	1342457776	/nfs/dbraw/zinc/45/77/76/1342457776.db2.gz	BAAUDRIPGUNGGS-INIZCTEOSA-N	0	3	347.528	3.321	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc3scnc3c2)C1	ZINC001034468429	1342524000	/nfs/dbraw/zinc/52/40/00/1342524000.db2.gz	IMMPYIVFLHWQGW-HNNXBMFYSA-N	0	3	329.469	3.457	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cccc(NC(C)=O)c2C)C1	ZINC001034483838	1342541955	/nfs/dbraw/zinc/54/19/55/1342541955.db2.gz	HANACXOPWUATSR-KRWDZBQOSA-N	0	3	343.471	3.114	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cc(OC)c(C)c(OC)c2)C1	ZINC001034514639	1342573592	/nfs/dbraw/zinc/57/35/92/1342573592.db2.gz	MFLGQPFTUMDQQA-KRWDZBQOSA-N	0	3	346.471	3.173	20	30		EGEDHN
C=C(C)CCN1CCCC[C@H](NC(=O)c2scnc2Cl)C1	ZINC001034538443	1342596400	/nfs/dbraw/zinc/59/64/00/1342596400.db2.gz	OVCIVJVDPXUKGG-LBPRGKRZSA-N	0	3	327.881	3.347	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)C2(c3cc(C)cc(C)c3)CC2)C1	ZINC001034537760	1342594725	/nfs/dbraw/zinc/59/47/25/1342594725.db2.gz	KXACCPGKMZLQQG-IBGZPJMESA-N	0	3	326.484	3.492	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)C1	ZINC001034544825	1342605829	/nfs/dbraw/zinc/60/58/29/1342605829.db2.gz	KJXAEJYCXFGYJI-GBESFXJTSA-N	0	3	330.447	3.476	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)c2cccc3c2OCC3(C)C)C1	ZINC001034565401	1342620113	/nfs/dbraw/zinc/62/01/13/1342620113.db2.gz	RNOCBCMFWXJFCP-HNNXBMFYSA-N	0	3	328.456	3.127	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)NCc1ccc(CNCc2ccc(C#N)s2)cc1	ZINC001034808060	1342773729	/nfs/dbraw/zinc/77/37/29/1342773729.db2.gz	UHVIYJZVADTYBY-FZKQIMNGSA-N	0	3	339.464	3.182	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)c(F)c2)CCC1	ZINC001035018786	1342879978	/nfs/dbraw/zinc/87/99/78/1342879978.db2.gz	OMEVJJMENAGXPD-QGZVFWFLSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H]1CNCc1cnn(C(C)(C)C)c1	ZINC001035037134	1342891102	/nfs/dbraw/zinc/89/11/02/1342891102.db2.gz	OVRWJOZGOKWJPH-YLJYHZDGSA-N	0	3	346.519	3.321	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)cc2F)C1	ZINC001035044097	1342896073	/nfs/dbraw/zinc/89/60/73/1342896073.db2.gz	ASHYZXLTFFEQPV-QGZVFWFLSA-N	0	3	341.430	3.134	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H]1C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)s1	ZINC001035054855	1342900425	/nfs/dbraw/zinc/90/04/25/1342900425.db2.gz	VAQISRVYPWRADP-IIDMSEBBSA-N	0	3	345.512	3.383	20	30		EGEDHN
Cc1ccc(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)s2)cc1	ZINC001035110993	1342935178	/nfs/dbraw/zinc/93/51/78/1342935178.db2.gz	NGYOUESFOVLEOB-MRXNPFEDSA-N	0	3	339.464	3.323	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC2(CCN(Cc3ccc(Cl)cc3)C2)CC1	ZINC001035168326	1342984379	/nfs/dbraw/zinc/98/43/79/1342984379.db2.gz	VMOIEJHNLWTWLU-HNNXBMFYSA-N	0	3	345.874	3.314	20	30		EGEDHN
N#Cc1ccccc1CN1CCC2(C1)CCN(C(=O)c1cc[nH]c1)CC2	ZINC001035188071	1343002685	/nfs/dbraw/zinc/00/26/85/1343002685.db2.gz	QKSNLRDDPYVEDX-UHFFFAOYSA-N	0	3	348.450	3.015	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC3(CCN(C/C=C\Cl)C3)CC2)cc1	ZINC001035213304	1343031788	/nfs/dbraw/zinc/03/17/88/1343031788.db2.gz	VMSFELBUDMTOIW-JYOAFUTRSA-N	0	3	342.870	3.349	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC2(CCN(Cc3ocnc3C)C2)CC1	ZINC001035225903	1343046908	/nfs/dbraw/zinc/04/69/08/1343046908.db2.gz	GELVKNFVNZPMCN-IBGZPJMESA-N	0	3	345.487	3.400	20	30		EGEDHN
O=C([C@@H]1CC12CC2)N1CCC2(CCN(CC#Cc3ccccc3)C2)CC1	ZINC001035232698	1343054150	/nfs/dbraw/zinc/05/41/50/1343054150.db2.gz	FHIPDEHXYGIDSK-FQEVSTJZSA-N	0	3	348.490	3.153	20	30		EGEDHN
CC(C)c1ccc(CN2CC3(C2)CCN(C(=O)[C@@H](C)C#N)CC3)cc1	ZINC001035672849	1343131848	/nfs/dbraw/zinc/13/18/48/1343131848.db2.gz	JSZXOAHABIQFLX-KRWDZBQOSA-N	0	3	339.483	3.394	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccoc1C(F)(F)F)CC2	ZINC001035714820	1343149075	/nfs/dbraw/zinc/14/90/75/1343149075.db2.gz	WYCFSMLYGPWFSV-UHFFFAOYSA-N	0	3	342.361	3.413	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCC2(CN(Cc3ccccc3)C2)CC1	ZINC001035723652	1343153612	/nfs/dbraw/zinc/15/36/12/1343153612.db2.gz	LTBXESPVMJGYQL-UHFFFAOYSA-N	0	3	349.478	3.412	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)C1(C)CCC(F)(F)CC1)CC2	ZINC001035734617	1343160213	/nfs/dbraw/zinc/16/02/13/1343160213.db2.gz	BPQAJQXREYESRP-UHFFFAOYSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cn(CC)c3ccccc13)CC2	ZINC001035746155	1343166487	/nfs/dbraw/zinc/16/64/87/1343166487.db2.gz	VYQRZEOGRNONDY-UHFFFAOYSA-N	0	3	349.478	3.223	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccc(Cl)cc1F)CC2	ZINC001035746348	1343166566	/nfs/dbraw/zinc/16/65/66/1343166566.db2.gz	WOUQXUCZMRPPBT-UHFFFAOYSA-N	0	3	334.822	3.040	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc3ccsc3[nH]1)CC2	ZINC001035763327	1343176821	/nfs/dbraw/zinc/17/68/21/1343176821.db2.gz	SVGWXCKIQNQPPV-UHFFFAOYSA-N	0	3	329.469	3.344	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC2(CN(C[C@H]3CC(C)(C)CO3)C2)CC1	ZINC001035784952	1343194741	/nfs/dbraw/zinc/19/47/41/1343194741.db2.gz	MINJGDHKOUZLFV-YLJYHZDGSA-N	0	3	348.531	3.328	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cccc(OCC)c1)CC2	ZINC001035804236	1343206450	/nfs/dbraw/zinc/20/64/50/1343206450.db2.gz	LCFRTXRBAKWIPC-UHFFFAOYSA-N	0	3	328.456	3.199	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cnc(C(C)C)nc1C)CC2	ZINC001035812278	1343211294	/nfs/dbraw/zinc/21/12/94/1343211294.db2.gz	SZQTXBPICQBIIJ-UHFFFAOYSA-N	0	3	342.487	3.023	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1c[nH]c3ccc(F)cc13)CC2	ZINC001035864589	1343239410	/nfs/dbraw/zinc/23/94/10/1343239410.db2.gz	WEPNAYJIDJDHJT-UHFFFAOYSA-N	0	3	341.430	3.421	20	30		EGEDHN
C[C@H]1CN(C(=O)CC2(C)CC2)CC[C@@H]1NCc1cc(F)ccc1C#N	ZINC001036125509	1343318554	/nfs/dbraw/zinc/31/85/54/1343318554.db2.gz	WOGJHFKXFJTWCI-KSSFIOAISA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2(C)CC2)CC[C@@H]1NCc1cc(F)ccc1C#N	ZINC001036125505	1343318940	/nfs/dbraw/zinc/31/89/40/1343318940.db2.gz	WOGJHFKXFJTWCI-KDOFPFPSSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3nccs3)[C@@H](C)C2)CC1	ZINC001036163288	1343338044	/nfs/dbraw/zinc/33/80/44/1343338044.db2.gz	CZBSMOOCZDWWGQ-GOEBONIOSA-N	0	3	333.501	3.216	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@H](NCc2cc(F)ccc2C#N)[C@@H](C)C1	ZINC001036163220	1343338103	/nfs/dbraw/zinc/33/81/03/1343338103.db2.gz	FKJNQQLMNXNANA-KSSFIOAISA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](NCc3csc(CC)n3)[C@H](C)C2)C1	ZINC001036169761	1343342590	/nfs/dbraw/zinc/34/25/90/1343342590.db2.gz	NSLIMIQWVQIHET-GDBMZVCRSA-N	0	3	347.528	3.388	20	30		EGEDHN
C[C@H]1CN(C(=O)C2(C)CC=CC2)CC[C@@H]1NCc1ccccc1C#N	ZINC001036173725	1343346230	/nfs/dbraw/zinc/34/62/30/1343346230.db2.gz	NZKHMMFIOGTUDT-LPHOPBHVSA-N	0	3	337.467	3.241	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCCN(C(=O)C2CCCC2)C1	ZINC001036356596	1343439155	/nfs/dbraw/zinc/43/91/55/1343439155.db2.gz	JDZIUWFYSVFENU-OXQOHEQNSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCCN(C(=O)C(C)(C)F)C1	ZINC001036359290	1343441426	/nfs/dbraw/zinc/44/14/26/1343441426.db2.gz	XHGJVUIBFXNDMM-RHSMWYFYSA-N	0	3	331.435	3.023	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCCN(C(=O)C2=CCCC2)C1	ZINC001036389129	1343459518	/nfs/dbraw/zinc/45/95/18/1343459518.db2.gz	QVPQCULSLXNPKL-OXJNMPFZSA-N	0	3	337.467	3.385	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCCN(C(=O)/C=C\C2CC2)C1	ZINC001036389441	1343459605	/nfs/dbraw/zinc/45/96/05/1343459605.db2.gz	ROKJPGLAGINHIQ-IDTIXJOSSA-N	0	3	337.467	3.241	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCCN(C(=O)CC2CCC2)C1	ZINC001036389394	1343459673	/nfs/dbraw/zinc/45/96/73/1343459673.db2.gz	RCLLYPPNWZUZDD-OXJNMPFZSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCCN(C(=O)C2(C)CC2)C1	ZINC001036408328	1343469250	/nfs/dbraw/zinc/46/92/50/1343469250.db2.gz	ILIJPMFCYHFJRG-MAUKXSAKSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]([C@@H](C)NCc3nccs3)C2)C1	ZINC001036444124	1343491367	/nfs/dbraw/zinc/49/13/67/1343491367.db2.gz	IJIAYWSITCHEEK-HUUCEWRRSA-N	0	3	333.501	3.216	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@@H](C)[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001036502373	1343520397	/nfs/dbraw/zinc/52/03/97/1343520397.db2.gz	JCHKRXPKFNIMOH-BEFAXECRSA-N	0	3	343.446	3.380	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@H](C)[C@H]1CNCc1ccc(C#N)s1	ZINC001036503594	1343521288	/nfs/dbraw/zinc/52/12/88/1343521288.db2.gz	ODUGIDZWYIJLSY-WMLDXEAASA-N	0	3	331.485	3.303	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@H](C)[C@H]1CNCc1cc(C#N)ccc1F	ZINC001036503304	1343521678	/nfs/dbraw/zinc/52/16/78/1343521678.db2.gz	MWLQTSFPLRUFLL-HNAYVOBHSA-N	0	3	343.446	3.380	20	30		EGEDHN
C[C@H]1CCCN(C(=O)C(C)(C)F)[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001036503862	1343522015	/nfs/dbraw/zinc/52/20/15/1343522015.db2.gz	WQWWCLCQCXLLEI-SUMWQHHRSA-N	0	3	349.425	3.162	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@H](C)[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001036511348	1343526800	/nfs/dbraw/zinc/52/68/00/1343526800.db2.gz	SSHNUVDHBRROLT-KSSFIOAISA-N	0	3	331.435	3.070	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@@H](C)[C@@H]2CNCc2cnoc2C)CC1	ZINC001036574587	1343561107	/nfs/dbraw/zinc/56/11/07/1343561107.db2.gz	NXLGPRQCYKPHFN-BEFAXECRSA-N	0	3	345.487	3.446	20	30		EGEDHN
CCCC(=O)N1CC[C@@H]2[C@H](CCN2CC#Cc2cccc(Cl)c2)C1	ZINC001036617692	1343577001	/nfs/dbraw/zinc/57/70/01/1343577001.db2.gz	PQZIYLPWMJCLOV-IEBWSBKVSA-N	0	3	344.886	3.414	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@H]2[C@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001036628487	1343586094	/nfs/dbraw/zinc/58/60/94/1343586094.db2.gz	BUNZQESUCVGGCT-PBHICJAKSA-N	0	3	331.485	3.089	20	30		EGEDHN
CC(C)(C)CC(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001036640336	1343595008	/nfs/dbraw/zinc/59/50/08/1343595008.db2.gz	IPLKBTVJBRJTQD-RHSMWYFYSA-N	0	3	345.512	3.479	20	30		EGEDHN
C/C=C(\C)C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccc(F)c(C#N)c2)C1	ZINC001036683463	1343626584	/nfs/dbraw/zinc/62/65/84/1343626584.db2.gz	SVBGGBZWYLDQSS-MCBLENPVSA-N	0	3	341.430	3.086	20	30		EGEDHN
CC1(CC(=O)N2CC[C@@H]3[C@H](CCN3CC#Cc3ccccc3)C2)CC1	ZINC001036774918	1343703724	/nfs/dbraw/zinc/70/37/24/1343703724.db2.gz	MNVMRHLULDYSAT-WOJBJXKFSA-N	0	3	336.479	3.151	20	30		EGEDHN
CC1(CC(=O)N2CC[C@@H]3[C@@H](CCN3Cc3ccc(C#N)s3)C2)CC1	ZINC001036777049	1343706906	/nfs/dbraw/zinc/70/69/06/1343706906.db2.gz	UQIHZNIIJJNLES-WMLDXEAASA-N	0	3	343.496	3.233	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2[C@H](CCN2Cc2cc(C3CC3)no2)C1	ZINC001036788645	1343718658	/nfs/dbraw/zinc/71/86/58/1343718658.db2.gz	FATUYOXBGXOFTG-QAPCUYQASA-N	0	3	343.471	3.187	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2[C@@H](CCN2Cc2cc(C3CC3)no2)C1	ZINC001036788646	1343718977	/nfs/dbraw/zinc/71/89/77/1343718977.db2.gz	FATUYOXBGXOFTG-YJBOKZPZSA-N	0	3	343.471	3.187	20	30		EGEDHN
CC1(C(=O)N2CC[C@H]3[C@H](CCN3Cc3ccc(C#N)s3)C2)CCC1	ZINC001036792659	1343723425	/nfs/dbraw/zinc/72/34/25/1343723425.db2.gz	SHQIKMRQKFUYQX-PBHICJAKSA-N	0	3	343.496	3.233	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H]3[C@@H](CCN3Cc3cnoc3C)C2)CC1	ZINC001036810511	1343745207	/nfs/dbraw/zinc/74/52/07/1343745207.db2.gz	DQAYDGXIKVRJAU-HKUYNNGSSA-N	0	3	343.471	3.152	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCC[C@H]1NC(=O)Cc1ccccc1	ZINC001037031656	1343939782	/nfs/dbraw/zinc/93/97/82/1343939782.db2.gz	NFXUFJVFUOPGKW-NHCUHLMSSA-N	0	3	347.462	3.175	20	30		EGEDHN
Cc1cocc1C(=O)N[C@H]1CCC[C@H]1CNCc1ccccc1C#N	ZINC001037057923	1343954298	/nfs/dbraw/zinc/95/42/98/1343954298.db2.gz	BVYXPJDOZHZPEC-HKUYNNGSSA-N	0	3	337.423	3.148	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCC[C@H]2CNCc2cc(C)no2)CC1	ZINC001037070740	1343963841	/nfs/dbraw/zinc/96/38/41/1343963841.db2.gz	WDSHVKNDYMCLAT-FUHWJXTLSA-N	0	3	331.460	3.104	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCC[C@H]2CNCc2ccccc2C#N)C1	ZINC001037074820	1343967935	/nfs/dbraw/zinc/96/79/35/1343967935.db2.gz	HGDYLJYZTZIJPG-OALUTQOASA-N	0	3	337.467	3.289	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@H]1CCCC[C@H]1NC(=O)CC1CC1	ZINC001037148975	1344000020	/nfs/dbraw/zinc/00/00/20/1344000020.db2.gz	MDSYMDDYGAYKGU-VQIMIIECSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](NCc3cc(C)no3)[C@H](CC)C2)C1	ZINC001037915779	1344176326	/nfs/dbraw/zinc/17/63/26/1344176326.db2.gz	RVHGXNNEJZAORH-WBVHZDCISA-N	0	3	331.460	3.056	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@@H]1CCN1CCCC1CCCC1	ZINC001038348156	1344390382	/nfs/dbraw/zinc/39/03/82/1344390382.db2.gz	AMMSHJATJGKAPH-SFHVURJKSA-N	0	3	329.488	3.449	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CCN2C[C@@H]2CCC(F)(F)C2)CC1	ZINC001038668338	1344532326	/nfs/dbraw/zinc/53/23/26/1344532326.db2.gz	UEXJTOXDIWGEOQ-ZBFHGGJFSA-N	0	3	326.431	3.359	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@H]2CCN2CC2CCC(C)(C)CC2)c1	ZINC001038684920	1344542326	/nfs/dbraw/zinc/54/23/26/1344542326.db2.gz	NYZNRZQTFNJWPX-LJQANCHMSA-N	0	3	339.483	3.083	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)NC[C@H]1CCN1CC1CC2(CCC2)C1	ZINC001038798221	1344589255	/nfs/dbraw/zinc/58/92/55/1344589255.db2.gz	BKPLUVMVCVVRTE-QYZOEREBSA-N	0	3	346.515	3.129	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)[C@H]1CCCc2sc(C)nc21	ZINC001038910048	1344647584	/nfs/dbraw/zinc/64/75/84/1344647584.db2.gz	KSFIJOBFMJREIC-GJZGRUSLSA-N	0	3	333.501	3.028	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C(CC)CC)CC[C@H]1c1ccc(F)cc1	ZINC001079148985	1357196808	/nfs/dbraw/zinc/19/68/08/1357196808.db2.gz	WSNYQZVLHFEDIN-RBUKOAKNSA-N	0	3	330.447	3.169	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1cc(C)n(CC2CC2)c1C	ZINC001038933150	1344659580	/nfs/dbraw/zinc/65/95/80/1344659580.db2.gz	CZXZCNLYURWBJP-SFHVURJKSA-N	0	3	329.488	3.285	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCN2CC2CCC(C)(C)CC2)cn1	ZINC001038934583	1344660106	/nfs/dbraw/zinc/66/01/06/1344660106.db2.gz	ZOPUTRXQLJTIGM-IBGZPJMESA-N	0	3	339.483	3.083	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H]2CCC2(C)C)CC[C@H]1c1ccc(F)cc1	ZINC001079157078	1357198022	/nfs/dbraw/zinc/19/80/22/1357198022.db2.gz	YIGXXEHLETVYKP-IPMKNSEASA-N	0	3	342.458	3.169	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1cccc(OCC(C)C)c1	ZINC001039013396	1344715211	/nfs/dbraw/zinc/71/52/11/1344715211.db2.gz	UHIKKVMHIARZNX-SFHVURJKSA-N	0	3	330.472	3.492	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)C1CC(c2cccc(F)c2)C1	ZINC001039083500	1344760185	/nfs/dbraw/zinc/76/01/85/1344760185.db2.gz	YJMGMGKGGSRSII-FAFZWHIHSA-N	0	3	330.447	3.476	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)/C=C\c3ccc[nH]3)CC2)C1	ZINC001039126770	1344803864	/nfs/dbraw/zinc/80/38/64/1344803864.db2.gz	IUEVSZPYRAXXEK-VGOKWCNXSA-N	0	3	347.890	3.341	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)c3ccsn3)CC2)C1	ZINC001039142456	1344823420	/nfs/dbraw/zinc/82/34/20/1344823420.db2.gz	JFCHKJOYKYUGCY-CQSZACIVSA-N	0	3	339.892	3.070	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC([C@@H]2CCN(Cc3ccns3)C2)CC1	ZINC001039150012	1344832770	/nfs/dbraw/zinc/83/27/70/1344832770.db2.gz	HGONPLFVHFJHBR-MRXNPFEDSA-N	0	3	347.528	3.416	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]([C@@H]3CCCCN3C(=O)C3CC3)C2)s1	ZINC001039183524	1344882226	/nfs/dbraw/zinc/88/22/26/1344882226.db2.gz	LBDPGBDHMWSSED-QAPCUYQASA-N	0	3	343.496	3.233	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)Cc2cc(C)cc(C)c2)C1	ZINC001039231284	1344950997	/nfs/dbraw/zinc/95/09/97/1344950997.db2.gz	REPCHEKQEFGLLQ-LEWJYISDSA-N	0	3	338.495	3.182	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cccc3c2ccn3C)C1	ZINC001039232869	1344952344	/nfs/dbraw/zinc/95/23/44/1344952344.db2.gz	ZGECQWYNJVREIN-XLIONFOSSA-N	0	3	349.478	3.128	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)Cc2ccc(CC)cc2)C1	ZINC001039236376	1344957978	/nfs/dbraw/zinc/95/79/78/1344957978.db2.gz	BCACOYGQISAHBO-LEWJYISDSA-N	0	3	338.495	3.128	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc(C)ccc2F)C1	ZINC001039238406	1344962285	/nfs/dbraw/zinc/96/22/85/1344962285.db2.gz	NOFAMNOYTXBWGX-FXAWDEMLSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cccc(Cl)c2)C1	ZINC001039244385	1344973247	/nfs/dbraw/zinc/97/32/47/1344973247.db2.gz	IIHPLLPIMYIRSQ-SJLPKXTDSA-N	0	3	330.859	3.290	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccc2c1COCC2	ZINC001039383605	1345037762	/nfs/dbraw/zinc/03/77/62/1345037762.db2.gz	FNTSHENITLSCBF-MSOLQXFVSA-N	0	3	340.467	3.014	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H](C)c1ccncc1	ZINC001039393959	1345043500	/nfs/dbraw/zinc/04/35/00/1345043500.db2.gz	QXVKAGMDDMLAEP-QRQLOZEOSA-N	0	3	327.472	3.217	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccsc1COC	ZINC001039394980	1345044060	/nfs/dbraw/zinc/04/40/60/1345044060.db2.gz	QUUWKMMKMJIWFP-CABCVRRESA-N	0	3	334.485	3.150	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc2ccc(C)cc2[nH]1	ZINC001039413301	1345055732	/nfs/dbraw/zinc/05/57/32/1345055732.db2.gz	MUKAXXXSHAUBLV-MSOLQXFVSA-N	0	3	335.451	3.179	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1CCc2ccccc2O1	ZINC001039452409	1345075506	/nfs/dbraw/zinc/07/55/06/1345075506.db2.gz	UVWXGWAHSFMLOI-WSTZPKSXSA-N	0	3	340.467	3.022	20	30		EGEDHN
C=CCn1cccc1C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC1CCC1	ZINC001039644445	1345152295	/nfs/dbraw/zinc/15/22/95/1345152295.db2.gz	AWYMTJWKRIUWLS-HDICACEKSA-N	0	3	327.472	3.153	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H]3CCC[C@@H](C2)N3CC[C@@H]2CCCO2)CC1	ZINC001039891275	1345234316	/nfs/dbraw/zinc/23/43/16/1345234316.db2.gz	JNTKQVWLRWRWTN-ZCNNSNEGSA-N	0	3	346.515	3.367	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CCC[C@@H](C1)N2C[C@H]1CCCOC1	ZINC001039896072	1345238963	/nfs/dbraw/zinc/23/89/63/1345238963.db2.gz	DFLUIVRMUALYRM-FTEYMNFISA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CCC[C@@H](C2)N3CCC2CCOCC2)C1	ZINC001039905975	1345242915	/nfs/dbraw/zinc/24/29/15/1345242915.db2.gz	CVNOMFRZHRWICH-KDURUIRLSA-N	0	3	346.515	3.225	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N1C[C@H]2CCC[C@@H](C1)N2CCCC1CCC1	ZINC001039923464	1345246290	/nfs/dbraw/zinc/24/62/90/1345246290.db2.gz	SFYQIPMULLMFBF-WCIQWLHISA-N	0	3	346.515	3.223	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N1C[C@H]2CCC[C@@H](C1)N2CCC(C)C	ZINC001039944913	1345255903	/nfs/dbraw/zinc/25/59/03/1345255903.db2.gz	GCOIHSHHQKRVCL-RDGPPVDQSA-N	0	3	334.504	3.079	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@H]3CCC(C)=C(C)C3)C2)C1	ZINC001040217056	1345378860	/nfs/dbraw/zinc/37/88/60/1345378860.db2.gz	RUMJCFZSZWAMCA-PZJWPPBQSA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3c(C)c(F)ccc3Cl)C2)C1	ZINC001040271447	1345405917	/nfs/dbraw/zinc/40/59/17/1345405917.db2.gz	RNINGIXAQWHDQN-IBGZPJMESA-N	0	3	348.849	3.349	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)C3(C4CCC4)CCC3)C2)C1	ZINC001040318501	1345428584	/nfs/dbraw/zinc/42/85/84/1345428584.db2.gz	UAJOHHBUNIADOA-HXUWFJFHSA-N	0	3	328.500	3.295	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@]2(C1)CCCN(CCC(F)(F)F)C2	ZINC001040323366	1345432607	/nfs/dbraw/zinc/43/26/07/1345432607.db2.gz	QLYFGQDPYQSGIW-MRXNPFEDSA-N	0	3	332.410	3.466	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@]2(C1)CCCN(Cc1ccccn1)C2	ZINC001040373984	1345460984	/nfs/dbraw/zinc/46/09/84/1345460984.db2.gz	YFALXPJPSKZCMG-NHCUHLMSSA-N	0	3	341.499	3.498	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)C(C)(C)c3cccc(F)c3)C2)C1	ZINC001040391595	1345472551	/nfs/dbraw/zinc/47/25/51/1345472551.db2.gz	QAOUPZXKMICLME-OAQYLSRUSA-N	0	3	342.458	3.051	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3noc4c3CCCCC4)C2)C1	ZINC001040423127	1345489850	/nfs/dbraw/zinc/48/98/50/1345489850.db2.gz	CPGXBWHQOPAWTI-FQEVSTJZSA-N	0	3	343.471	3.058	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@H](CC)Cc3ccccc3)C2)C1	ZINC001040431556	1345494853	/nfs/dbraw/zinc/49/48/53/1345494853.db2.gz	PPMGQSXRWLPPIQ-IFMALSPDSA-N	0	3	338.495	3.203	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)C(C)(C)c3ccccc3F)C2)C1	ZINC001040453666	1345507775	/nfs/dbraw/zinc/50/77/75/1345507775.db2.gz	QCJRROJQODQMRB-OAQYLSRUSA-N	0	3	342.458	3.051	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3csc(C(C)C)n3)C2)C1	ZINC001040453606	1345507982	/nfs/dbraw/zinc/50/79/82/1345507982.db2.gz	OISHTPLVTLAENG-LJQANCHMSA-N	0	3	345.512	3.218	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)C[C@H](C)c3ccccc3F)C2)C1	ZINC001040454448	1345508593	/nfs/dbraw/zinc/50/85/93/1345508593.db2.gz	VKTMBISAYNQLLN-LAUBAEHRSA-N	0	3	342.458	3.267	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@H](C)c3ccc(C)cc3)C2)C1	ZINC001040496012	1345520133	/nfs/dbraw/zinc/52/01/33/1345520133.db2.gz	CYCYZCARKVLZJV-DENIHFKCSA-N	0	3	338.495	3.436	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@@]3(C)CC=C(C)CC3)C2)C1	ZINC001040539876	1345537528	/nfs/dbraw/zinc/53/75/28/1345537528.db2.gz	SCJUNENNLGWOKH-SFTDATJTSA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)C34CC(C(C)(C)C)(C3)C4)C2)C1	ZINC001040551789	1345543602	/nfs/dbraw/zinc/54/36/02/1345543602.db2.gz	RJDOVEPPLOVRCT-QNGMFEMESA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cnc(C(C)C)s3)C2)C1	ZINC001040555177	1345544856	/nfs/dbraw/zinc/54/48/56/1345544856.db2.gz	HIDJUUMWCBKXEO-IBGZPJMESA-N	0	3	345.512	3.218	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccc([C@H]4C[C@H]4C)o3)C2)CC1	ZINC001040701194	1345567836	/nfs/dbraw/zinc/56/78/36/1345567836.db2.gz	WGTBNKHZSKBDIR-SJORKVTESA-N	0	3	340.467	3.354	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccc(-n4cccc4)cc3)C2)CC1	ZINC001040764630	1345576341	/nfs/dbraw/zinc/57/63/41/1345576341.db2.gz	ZWXTWVLKGUXCIW-UHFFFAOYSA-N	0	3	347.462	3.039	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccc(C)cc3Cl)C2)CC1	ZINC001040862123	1345589309	/nfs/dbraw/zinc/58/93/09/1345589309.db2.gz	DBPHBHFECKKUIE-UHFFFAOYSA-N	0	3	330.859	3.210	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@H](F)c3ccccc3)C2)CC1	ZINC001040867309	1345590192	/nfs/dbraw/zinc/59/01/92/1345590192.db2.gz	CFGYSSJLVYHYLF-GOSISDBHSA-N	0	3	328.431	3.035	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)C[C@H]3CCc4ccccc43)C2)CC1	ZINC001040890359	1345594587	/nfs/dbraw/zinc/59/45/87/1345594587.db2.gz	RJMBBRQTACGVCZ-LJQANCHMSA-N	0	3	336.479	3.054	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@@H]3C[C@H]3C3CCCC3)C2)CC1	ZINC001040900175	1345595978	/nfs/dbraw/zinc/59/59/78/1345595978.db2.gz	SIEMYKKAKMCFJR-RBUKOAKNSA-N	0	3	328.500	3.151	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@]3(CCN(C(=O)C4CCCC4)C3)C2)cc1	ZINC001040994687	1345617769	/nfs/dbraw/zinc/61/77/69/1345617769.db2.gz	OTVRFQKKZWHIJW-OAQYLSRUSA-N	0	3	337.467	3.173	20	30		EGEDHN
C/C(=C\C(=O)N1CC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1)C1CC1	ZINC001041096415	1345652149	/nfs/dbraw/zinc/65/21/49/1345652149.db2.gz	DGKLOBXRFNEMIX-JRVGGCGHSA-N	0	3	349.478	3.339	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1)C1CC1	ZINC001041174045	1345666386	/nfs/dbraw/zinc/66/63/86/1345666386.db2.gz	NMGPFYPIUJCXFJ-KKSFZXQISA-N	0	3	337.467	3.029	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@]3(CCN(C(=O)C4=CCCC4)C3)C2)c1	ZINC001041200113	1345675722	/nfs/dbraw/zinc/67/57/22/1345675722.db2.gz	KJWYLQMVQLZIFA-OAQYLSRUSA-N	0	3	335.451	3.093	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N1CC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001041216868	1345679689	/nfs/dbraw/zinc/67/96/89/1345679689.db2.gz	XKLBCGYLRWNUHG-NQIIRXRSSA-N	0	3	337.467	3.029	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@]2(CCN(Cc3scnc3C)C2)C1	ZINC001041542547	1345757361	/nfs/dbraw/zinc/75/73/61/1345757361.db2.gz	DQYYPJJICWOPMP-SFHVURJKSA-N	0	3	333.501	3.088	20	30		EGEDHN
CC(F)(F)CC(=O)N1CC[C@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001041647569	1345809251	/nfs/dbraw/zinc/80/92/51/1345809251.db2.gz	YJFRGQKODMSGDR-IBGZPJMESA-N	0	3	347.409	3.028	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@]3(CCN(Cc4cccnc4C)C3)C2)C1	ZINC001041653423	1345812065	/nfs/dbraw/zinc/81/20/65/1345812065.db2.gz	RSWNVUNLWXXPSF-OAQYLSRUSA-N	0	3	339.483	3.171	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cc(C(C)(C)C)oc3C)C2)C1	ZINC001041713147	1345828507	/nfs/dbraw/zinc/82/85/07/1345828507.db2.gz	CZYDQQLCDNDHAR-NRFANRHFSA-N	0	3	342.483	3.447	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)[C@@H](C)Cc3ccccc3Cl)C2)C1	ZINC001041714965	1345828702	/nfs/dbraw/zinc/82/87/02/1345828702.db2.gz	AXDPSYYXYXIYHM-JXFKEZNVSA-N	0	3	344.886	3.076	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@]3(CCN(C(=O)[C@H]4CC45CCC5)C3)C2)c1	ZINC001041715994	1345828926	/nfs/dbraw/zinc/82/89/26/1345828926.db2.gz	YPUMXMMZEOMFEV-CTNGQTDRSA-N	0	3	349.478	3.173	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)C[C@@H](C)c3ccccc3C)C2)C1	ZINC001041724039	1345832380	/nfs/dbraw/zinc/83/23/80/1345832380.db2.gz	MQJYTOSVXJXZRY-DENIHFKCSA-N	0	3	338.495	3.436	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)[C@@H](C)c3ccc(C)s3)C2)C1	ZINC001041788111	1345850264	/nfs/dbraw/zinc/85/02/64/1345850264.db2.gz	WGRCWHMXBFCPRF-QFBILLFUSA-N	0	3	330.497	3.108	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)C(C)(C)c3ccc(F)cc3)C2)C1	ZINC001041792627	1345852045	/nfs/dbraw/zinc/85/20/45/1345852045.db2.gz	ROVPWWYWTUYWTN-OAQYLSRUSA-N	0	3	342.458	3.051	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cc(CC)c(C)s3)C2)C1	ZINC001041821627	1345863489	/nfs/dbraw/zinc/86/34/89/1345863489.db2.gz	HBFXSAVSPANGRA-IBGZPJMESA-N	0	3	330.497	3.180	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3cc(CCC)c(C)s3)C2)C1	ZINC001041820822	1345863603	/nfs/dbraw/zinc/86/36/03/1345863603.db2.gz	YLOKUJGHRMBLIX-IBGZPJMESA-N	0	3	330.497	3.180	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3cc(-c4ccccc4)co3)C2)C1	ZINC001041860817	1345876084	/nfs/dbraw/zinc/87/60/84/1345876084.db2.gz	JOADEAUBBVUPEW-OAQYLSRUSA-N	0	3	334.419	3.118	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@H]2CCN(Cc3ccc(C#N)cc3)[C@@H]2C1	ZINC001041902569	1345888643	/nfs/dbraw/zinc/88/86/43/1345888643.db2.gz	AXWHPRKFBAVPLZ-RTBURBONSA-N	0	3	325.456	3.027	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CCN(C(=O)c4ccccc4)C[C@H]32)cc1	ZINC001041906527	1345890829	/nfs/dbraw/zinc/89/08/29/1345890829.db2.gz	KJMCAGUMSUDBBI-TZIWHRDSSA-N	0	3	345.446	3.295	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3CCN(C(=O)CCC4CC4)C[C@@H]32)cc1	ZINC001041991164	1345914905	/nfs/dbraw/zinc/91/49/05/1345914905.db2.gz	YLDOSYOZBVEXFC-PMACEKPBSA-N	0	3	337.467	3.171	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CCN(C(=O)C=C4CCC4)C[C@@H]32)cc1	ZINC001042006825	1345922469	/nfs/dbraw/zinc/92/24/69/1345922469.db2.gz	QRGQZOANWVEXKY-UXHICEINSA-N	0	3	335.451	3.091	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3CCN(C(=O)C4=CCCC4)C[C@@H]32)cc1	ZINC001042009225	1345923162	/nfs/dbraw/zinc/92/31/62/1345923162.db2.gz	CJTLTKYQHLEUFI-ICSRJNTNSA-N	0	3	335.451	3.091	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc4nccc(C)c4c3)C[C@@H]21	ZINC001042077854	1345939186	/nfs/dbraw/zinc/93/91/86/1345939186.db2.gz	QKZBNECFPUIALU-UZLBHIALSA-N	0	3	335.451	3.266	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3scc(C)c3Cl)C[C@H]21	ZINC001042077777	1345939191	/nfs/dbraw/zinc/93/91/91/1345939191.db2.gz	PDXIUSPPXYTVTO-ZIAGYGMSSA-N	0	3	336.888	3.270	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc4ccccc4nc3C)C[C@H]21	ZINC001042085759	1345940433	/nfs/dbraw/zinc/94/04/33/1345940433.db2.gz	QTUMCYJGINHHDE-OXJNMPFZSA-N	0	3	335.451	3.266	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)C3C4CC5CC(C4)CC3C5)C[C@H]21	ZINC001042095860	1345943010	/nfs/dbraw/zinc/94/30/10/1345943010.db2.gz	RBXMJPNFQMAQLC-VXHMAKRFSA-N	0	3	340.511	3.005	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc4c([nH]3)c(F)ccc4C)C[C@H]21	ZINC001042123608	1345950240	/nfs/dbraw/zinc/95/02/40/1345950240.db2.gz	UFPYEKBIXCVTCH-KBXCAEBGSA-N	0	3	341.430	3.338	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cccc(-n4cccc4)c3)C[C@@H]21	ZINC001042139241	1345953955	/nfs/dbraw/zinc/95/39/55/1345953955.db2.gz	VXLUAOOTGHLFDN-NQIIRXRSSA-N	0	3	347.462	3.037	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc(-n4cccc4)cc3)C[C@@H]21	ZINC001042140522	1345954103	/nfs/dbraw/zinc/95/41/03/1345954103.db2.gz	ATNKULHRMZJTPJ-NQIIRXRSSA-N	0	3	347.462	3.037	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3cnccc3C)[C@H]2C1	ZINC001042182168	1345970494	/nfs/dbraw/zinc/97/04/94/1345970494.db2.gz	CJEAFHHGXVIGSE-HKUYNNGSSA-N	0	3	341.499	3.415	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3ncccc3C)[C@H]2C1	ZINC001042185159	1345972777	/nfs/dbraw/zinc/97/27/77/1345972777.db2.gz	QTZULRUGSIKBKT-HKUYNNGSSA-N	0	3	341.499	3.415	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3ccc(C)nc3C)[C@@H]2C1	ZINC001042188168	1345975081	/nfs/dbraw/zinc/97/50/81/1345975081.db2.gz	QCYJZLDTJBFMQA-IEBWSBKVSA-N	0	3	341.499	3.333	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3cncc(C)c3)[C@H]2C1	ZINC001042188858	1345975940	/nfs/dbraw/zinc/97/59/40/1345975940.db2.gz	WYQBKWUEXZGBPJ-ROUUACIJSA-N	0	3	327.472	3.025	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3cc(F)c(F)cc3F)C[C@@H]21	ZINC001042207561	1345985479	/nfs/dbraw/zinc/98/54/79/1345985479.db2.gz	RNJIZQFKOQHFEA-SJCJKPOMSA-N	0	3	338.373	3.216	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc4scnc4c3)C[C@H]21	ZINC001042296743	1346021754	/nfs/dbraw/zinc/02/17/54/1346021754.db2.gz	FJKBWOZYZQDPPG-XJKSGUPXSA-N	0	3	327.453	3.019	20	30		EGEDHN
C#CCN1CC[C@H]2CCN(C(=O)CC34CC5CC(CC(C5)C3)C4)C[C@@H]21	ZINC001042332732	1346040154	/nfs/dbraw/zinc/04/01/54/1346040154.db2.gz	XBVMECBHSRXOHH-BIQFSMEISA-N	0	3	340.511	3.149	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)COc3ccccc3C(C)C)C[C@H]21	ZINC001042342010	1346046039	/nfs/dbraw/zinc/04/60/39/1346046039.db2.gz	SFGBNWGKLMWLGK-PKOBYXMFSA-N	0	3	342.483	3.298	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3c[nH]cc3-c3ccccc3)C[C@H]21	ZINC001042358755	1346053770	/nfs/dbraw/zinc/05/37/70/1346053770.db2.gz	USIXFCVXIUZIOV-GHTZIAJQSA-N	0	3	347.462	3.241	20	30		EGEDHN
C[C@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)CCC1CC1	ZINC001044510319	1346352802	/nfs/dbraw/zinc/35/28/02/1346352802.db2.gz	PNOGHWDCCJDVDN-KXBFYZLASA-N	0	3	325.456	3.218	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@@H](NCc3ccccc3C#N)C[C@H]2C)co1	ZINC001044570736	1346371558	/nfs/dbraw/zinc/37/15/58/1346371558.db2.gz	HZCVFGHAHRJRMW-AUUYWEPGSA-N	0	3	337.423	3.243	20	30		EGEDHN
Cc1cnccc1C(=O)N1CC[C@@H](NCc2ccccc2C#N)C[C@H]1C	ZINC001044590345	1346377416	/nfs/dbraw/zinc/37/74/16/1346377416.db2.gz	ZJAWSKYCHVLSAU-VQIMIIECSA-N	0	3	348.450	3.045	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2c(F)cccc2Cl)CCN1C(=O)C#CC1CC1	ZINC001044595067	1346377984	/nfs/dbraw/zinc/37/79/84/1346377984.db2.gz	XCZRTFFUTHEEMA-UKRRQHHQSA-N	0	3	348.849	3.362	20	30		EGEDHN
C[C@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)[C@H]1C[C@H]2C[C@H]2C1	ZINC001044711767	1346408109	/nfs/dbraw/zinc/40/81/09/1346408109.db2.gz	JVLJGLUUTNATII-YLLORCDKSA-N	0	3	337.467	3.073	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)c2ccsc2)c(F)c1	ZINC001044914176	1346461941	/nfs/dbraw/zinc/46/19/41/1346461941.db2.gz	TYSNYBQOIDFYOZ-INIZCTEOSA-N	0	3	343.427	3.153	20	30		EGEDHN
CCc1occc1C(=O)N1CCC[C@H]1CNCc1ccc(C#N)s1	ZINC001045019323	1346481409	/nfs/dbraw/zinc/48/14/09/1346481409.db2.gz	HPSHWCYRETUJIC-ZDUSSCGKSA-N	0	3	343.452	3.170	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC[C@H]1CNCc1ccns1	ZINC001045051963	1346487216	/nfs/dbraw/zinc/48/72/16/1346487216.db2.gz	JXZLEEHUHPXBMQ-LBPRGKRZSA-N	0	3	327.881	3.002	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC[C@H]1CNCc1ncccc1C	ZINC001045054153	1346487736	/nfs/dbraw/zinc/48/77/36/1346487736.db2.gz	UXTXGXSWAUVRPZ-HNNXBMFYSA-N	0	3	335.879	3.249	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H]1CNCc1ccc(Cl)nc1	ZINC001045147698	1346505995	/nfs/dbraw/zinc/50/59/95/1346505995.db2.gz	QASPBECYHXSODV-HNNXBMFYSA-N	0	3	335.879	3.418	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H]1CNCc1cnc(Cl)s1	ZINC001045148691	1346506041	/nfs/dbraw/zinc/50/60/41/1346506041.db2.gz	FMLRRVJLKCCOJF-LBPRGKRZSA-N	0	3	341.908	3.479	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045411277	1346587742	/nfs/dbraw/zinc/58/77/42/1346587742.db2.gz	XZWWPDFWCLCUOC-QGZVFWFLSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC[C@]1(C)C[C@@H]1C(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1	ZINC001045604851	1346642527	/nfs/dbraw/zinc/64/25/27/1346642527.db2.gz	AYOHLIHYSCSFHD-UYAOXDASSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC1(CC(=O)N2CC[C@H]3CC[C@@H](C2)N3Cc2cccc(C#N)c2)CC1	ZINC001045815008	1346706352	/nfs/dbraw/zinc/70/63/52/1346706352.db2.gz	IECOZYMREVYOHW-MOPGFXCFSA-N	0	3	337.467	3.314	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@]3(C2)CCCCN(C(=O)C2CC2)C3)c1	ZINC001045906024	1346742016	/nfs/dbraw/zinc/74/20/16/1346742016.db2.gz	PCSZTXJXRNZQAW-NRFANRHFSA-N	0	3	337.467	3.173	20	30		EGEDHN
CC(C)C(=O)N1CCCC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001045920048	1346757273	/nfs/dbraw/zinc/75/72/73/1346757273.db2.gz	YPNUJJXIWYFSLI-NRFANRHFSA-N	0	3	339.483	3.419	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1sccc1F)C2	ZINC001045936016	1346773127	/nfs/dbraw/zinc/77/31/27/1346773127.db2.gz	YUITWJMVRVECRM-GOSISDBHSA-N	0	3	334.460	3.229	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc3occc3[nH]1)C2	ZINC001045945090	1346780993	/nfs/dbraw/zinc/78/09/93/1346780993.db2.gz	SKBKUPRTCFOQTR-FQEVSTJZSA-N	0	3	339.439	3.102	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)C1(C(F)(F)F)CCC1)C2	ZINC001045947006	1346782643	/nfs/dbraw/zinc/78/26/43/1346782643.db2.gz	HCUSUEMIEUJUFO-INIZCTEOSA-N	0	3	342.405	3.057	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc(F)ccc1CC)C2	ZINC001045950988	1346786045	/nfs/dbraw/zinc/78/60/45/1346786045.db2.gz	QPMLXYGIHYBRDN-OAQYLSRUSA-N	0	3	342.458	3.340	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc(F)ccc1CC)C2	ZINC001045950987	1346786342	/nfs/dbraw/zinc/78/63/42/1346786342.db2.gz	QPMLXYGIHYBRDN-NRFANRHFSA-N	0	3	342.458	3.340	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1c(C)cncc1C)C2	ZINC001045952300	1346787554	/nfs/dbraw/zinc/78/75/54/1346787554.db2.gz	LGEDMGZVQBAZNK-NRFANRHFSA-N	0	3	339.483	3.040	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc3ccc(C)cc3[nH]1)C2	ZINC001045955071	1346789891	/nfs/dbraw/zinc/78/98/91/1346789891.db2.gz	NOJFVFZENRCUHY-JOCHJYFZSA-N	0	3	349.478	3.428	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)C1(C3CCC3)CCC1)C2	ZINC001045955640	1346790804	/nfs/dbraw/zinc/79/08/04/1346790804.db2.gz	UVAAOGIUDWKYHN-FQEVSTJZSA-N	0	3	328.500	3.295	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc3ccsc3[nH]1)C2	ZINC001045958304	1346793583	/nfs/dbraw/zinc/79/35/83/1346793583.db2.gz	PDTURWVILUCISU-IBGZPJMESA-N	0	3	341.480	3.181	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cccc3[nH]ccc31)C2	ZINC001045967747	1346802699	/nfs/dbraw/zinc/80/26/99/1346802699.db2.gz	BXQMXDBNHIWXAZ-NRFANRHFSA-N	0	3	335.451	3.119	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cnc3ccccc3c1)C2	ZINC001045968549	1346803032	/nfs/dbraw/zinc/80/30/32/1346803032.db2.gz	CJMCWYOHCHOEAW-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H](C)c1cc(C)oc1C)C2	ZINC001045974921	1346810849	/nfs/dbraw/zinc/81/08/49/1346810849.db2.gz	QEMFTOKDFZBBKB-LAUBAEHRSA-N	0	3	342.483	3.338	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1csc(C)c1)C2	ZINC001045974759	1346811054	/nfs/dbraw/zinc/81/10/54/1346811054.db2.gz	LARVEQJIMSLRML-LJQANCHMSA-N	0	3	330.497	3.398	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cnoc1C(C)C)C2	ZINC001045975857	1346812447	/nfs/dbraw/zinc/81/24/47/1346812447.db2.gz	KNSJGCKWFBVLRX-HXUWFJFHSA-N	0	3	343.471	3.140	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)Cc1cccc(F)c1)C2	ZINC001045981284	1346819605	/nfs/dbraw/zinc/81/96/05/1346819605.db2.gz	BBIAZMYXBSJTMN-OAQYLSRUSA-N	0	3	342.458	3.096	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)C[C@H](C)n1cccc1)C2	ZINC001045981624	1346820037	/nfs/dbraw/zinc/82/00/37/1346820037.db2.gz	WBEYMYOSZDMQAK-FPOVZHCZSA-N	0	3	341.499	3.167	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cnc(CC)s1)C2	ZINC001045986517	1346827351	/nfs/dbraw/zinc/82/73/51/1346827351.db2.gz	SUDSCWOOCWAGHU-IBGZPJMESA-N	0	3	345.512	3.047	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2cc(F)c(Cl)cc2F)C1	ZINC001046586675	1347027126	/nfs/dbraw/zinc/02/71/26/1347027126.db2.gz	SYDSDXMWTQQCTE-INIZCTEOSA-N	0	3	328.790	3.389	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@]2(C)CCN(CCc3scnc3C)C2)CC1	ZINC001046594682	1347031502	/nfs/dbraw/zinc/03/15/02/1347031502.db2.gz	NDTNINOQTSNOIR-IBGZPJMESA-N	0	3	347.528	3.321	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2ccc3nc(C)sc3c2)C1	ZINC001046749232	1347082281	/nfs/dbraw/zinc/08/22/81/1347082281.db2.gz	JKFJXMFXJOZQNP-GOSISDBHSA-N	0	3	329.469	3.375	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)[C@H]2CCCc3sc(C)nc32)C1	ZINC001046765574	1347091016	/nfs/dbraw/zinc/09/10/16/1347091016.db2.gz	ZEJLAXIUJCUCKS-KBXCAEBGSA-N	0	3	333.501	3.028	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2coc(C(F)F)c2)C1	ZINC001046965391	1347168924	/nfs/dbraw/zinc/16/89/24/1347168924.db2.gz	AFCMFPNVOMPDFC-LBPRGKRZSA-N	0	3	348.340	3.480	20	30		EGEDHN
CCC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1cccc(Cl)c1)C2	ZINC001047001258	1347181186	/nfs/dbraw/zinc/18/11/86/1347181186.db2.gz	NGTXRVZFUITJQM-JQHSSLGASA-N	0	3	330.859	3.071	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(C/C=C/Cl)C2	ZINC001047084250	1347204152	/nfs/dbraw/zinc/20/41/52/1347204152.db2.gz	JBCHSYDKIOMWKA-QPSJONLNSA-N	0	3	333.863	3.009	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)C[C@@H]3C[C@H]3C3CC3)C2)CC1	ZINC001047246905	1347272349	/nfs/dbraw/zinc/27/23/49/1347272349.db2.gz	BCWWPKSIHIIFJK-UFYCRDLUSA-N	0	3	328.500	3.006	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)C(C)(C)C(F)F)C2)CC1	ZINC001047253988	1347278095	/nfs/dbraw/zinc/27/80/95/1347278095.db2.gz	LQOUCENMWJAKQK-MRXNPFEDSA-N	0	3	340.458	3.252	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@@H]([C@H](C)NCc3ccccc3C#N)C2)co1	ZINC001047815193	1347380243	/nfs/dbraw/zinc/38/02/43/1347380243.db2.gz	OBFBBULVSBCXSG-MAUKXSAKSA-N	0	3	337.423	3.100	20	30		EGEDHN
Cc1cocc1C(=O)N1CC[C@@H]([C@@H](C)NCc2ccccc2C#N)C1	ZINC001047922711	1347410645	/nfs/dbraw/zinc/41/06/45/1347410645.db2.gz	AWDDYOCZZMXRBS-CRAIPNDOSA-N	0	3	337.423	3.100	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]([C@@H](C)NCc2ccn(C(C)C)n2)C1	ZINC001047930650	1347413869	/nfs/dbraw/zinc/41/38/69/1347413869.db2.gz	GBGHSVUWPSBZGK-CVEARBPZSA-N	0	3	332.492	3.003	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H]([C@H](C)NCc3cscn3)C2)CC1	ZINC001047956893	1347423662	/nfs/dbraw/zinc/42/36/62/1347423662.db2.gz	ASXRGGOTPPOGJE-GOEBONIOSA-N	0	3	333.501	3.216	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)C2(C)CC=CC2)C1	ZINC001047962261	1347425876	/nfs/dbraw/zinc/42/58/76/1347425876.db2.gz	JZEWWSYNZQFMFZ-QFBILLFUSA-N	0	3	337.467	3.241	20	30		EGEDHN
CC(C)=C(F)C(=O)N1C[C@@H](C)[C@@H](CNCc2ccccc2C#N)C1	ZINC001048203846	1347493191	/nfs/dbraw/zinc/49/31/91/1347493191.db2.gz	KXIDRRSKXHEITE-PBHICJAKSA-N	0	3	329.419	3.006	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H](C)[C@@H](CNCc3ccn(C(C)C)n3)C2)C1	ZINC001048373696	1347534253	/nfs/dbraw/zinc/53/42/53/1347534253.db2.gz	IWVMUCGBYPLKRZ-IRXDYDNUSA-N	0	3	344.503	3.004	20	30		EGEDHN
C[C@@H]1CN(C(=O)C(C)(C)C(F)F)C[C@H]1CNCc1ccccc1C#N	ZINC001048382062	1347537926	/nfs/dbraw/zinc/53/79/26/1347537926.db2.gz	IPDXWKGVIKPJIT-CZUORRHYSA-N	0	3	349.425	3.034	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccccc3C(C)(C)CC)C[C@@H]2C1	ZINC001048882413	1347675757	/nfs/dbraw/zinc/67/57/57/1347675757.db2.gz	JUMXHGPGJSNUCY-HDICACEKSA-N	0	3	338.495	3.401	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CN(Cc3ccccc3F)C[C@H]2C1	ZINC001049026721	1347709915	/nfs/dbraw/zinc/70/99/15/1347709915.db2.gz	XXIWNZNNRWYFJL-FUHIMQAGSA-N	0	3	330.447	3.318	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@H](CC)CC3CCCCC3)C[C@@H]2C1	ZINC001049098119	1347725295	/nfs/dbraw/zinc/72/52/95/1347725295.db2.gz	IGBYIUSKUXTDNK-AQNXPRMDSA-N	0	3	330.516	3.397	20	30		EGEDHN
C=C[C@H](C(=O)N1C[C@H]2CN(C/C=C\Cl)C[C@H]2C1)c1ccccc1	ZINC001049229644	1347751836	/nfs/dbraw/zinc/75/18/36/1347751836.db2.gz	OZLMNUNSIJQCHA-PFBCZPDWSA-N	0	3	330.859	3.099	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)C[C@H]2C=CCC2)cc1	ZINC001049316224	1347787611	/nfs/dbraw/zinc/78/76/11/1347787611.db2.gz	UQQAIFVMSOBJHE-DZFGPLHGSA-N	0	3	349.478	3.480	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)/C=C/C2CC2)c1	ZINC001049399251	1347821267	/nfs/dbraw/zinc/82/12/67/1347821267.db2.gz	WSYAEJQHOAAVRA-GUKSKWGUSA-N	0	3	335.451	3.090	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H]2[C@H]1CCN2Cc1ccc(C#N)cc1)C1CC1	ZINC001049403694	1347826102	/nfs/dbraw/zinc/82/61/02/1347826102.db2.gz	KAOJODVRYLPAAS-RYGJVYDSSA-N	0	3	337.467	3.170	20	30		EGEDHN
C=CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cnc([C@@H](C)OC)s1	ZINC001049472254	1347864909	/nfs/dbraw/zinc/86/49/09/1347864909.db2.gz	ADGQTFFWFLIIMS-QLFBSQMISA-N	0	3	349.500	3.106	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)COc1cccc(C(C)C)c1	ZINC001049490153	1347873576	/nfs/dbraw/zinc/87/35/76/1347873576.db2.gz	KIGUXWZVTWHMBO-WOJBJXKFSA-N	0	3	342.483	3.440	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1nsc2ccccc21	ZINC001049494007	1347876070	/nfs/dbraw/zinc/87/60/70/1347876070.db2.gz	FGTJWLFBRVOCDX-HUUCEWRRSA-N	0	3	327.453	3.161	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cccc2c(C)c(C)[nH]c21	ZINC001049551781	1347904603	/nfs/dbraw/zinc/90/46/03/1347904603.db2.gz	IUQQDKBKITYIGX-UXHICEINSA-N	0	3	349.478	3.487	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(-n2cccc2)cc1	ZINC001049579532	1347919226	/nfs/dbraw/zinc/91/92/26/1347919226.db2.gz	LMFULJQLCVWLAS-LEWJYISDSA-N	0	3	347.462	3.180	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1coc2ccc(OC)cc21	ZINC001049586662	1347923367	/nfs/dbraw/zinc/92/33/67/1347923367.db2.gz	UXIWMARMBNKOMJ-MSOLQXFVSA-N	0	3	340.423	3.306	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1ccc(C(F)F)cc1	ZINC001049591164	1347925864	/nfs/dbraw/zinc/92/58/64/1347925864.db2.gz	DSCKWKSMPKPGHM-ROUUACIJSA-N	0	3	346.421	3.255	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc2ccc(OC)cc2[nH]1	ZINC001049632628	1347944717	/nfs/dbraw/zinc/94/47/17/1347944717.db2.gz	ZLNATUJGDURGRO-RTBURBONSA-N	0	3	339.439	3.041	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cnc2ccsc2c1	ZINC001049638030	1347947895	/nfs/dbraw/zinc/94/78/95/1347947895.db2.gz	JSDLGQCGZDAQHJ-HZPDHXFCSA-N	0	3	327.453	3.161	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1nsc2ccc(C)cc21	ZINC001049640524	1347948876	/nfs/dbraw/zinc/94/88/76/1347948876.db2.gz	VZYOYNZYUQNKIG-CVEARBPZSA-N	0	3	341.480	3.470	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]3[C@@H]2CCN3Cc2ccc(C#N)cc2)C1	ZINC001049711538	1347986514	/nfs/dbraw/zinc/98/65/14/1347986514.db2.gz	MXNDVBGVZYXRKK-PMACEKPBSA-N	0	3	349.478	3.480	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(OCC)c(C)c1	ZINC001049761424	1348006445	/nfs/dbraw/zinc/00/64/45/1348006445.db2.gz	JEYIDGRLRDRZJG-QZTJIDSGSA-N	0	3	328.456	3.259	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc2cc(F)ccc2o1	ZINC001049761204	1348006542	/nfs/dbraw/zinc/00/65/42/1348006542.db2.gz	HZUYZMLMFFGQJT-IRXDYDNUSA-N	0	3	340.398	3.274	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)[C@@H]2C[C@H]2C2CC2)cc1	ZINC001049778952	1348018168	/nfs/dbraw/zinc/01/81/68/1348018168.db2.gz	ZYZXAIRGTWHDRU-DOIPELPJSA-N	0	3	349.478	3.170	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1noc2c1C[C@@H](C)CC2	ZINC001049824485	1348041241	/nfs/dbraw/zinc/04/12/41/1348041241.db2.gz	WLKNDWXMFUCADT-USXIJHARSA-N	0	3	343.471	3.054	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C12CC3CC(CC(C3)C1)C2	ZINC001049856673	1348063775	/nfs/dbraw/zinc/06/37/75/1348063775.db2.gz	GRNIFOUBEFCEKW-MXDZQPNWSA-N	0	3	328.500	3.454	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(F)c(F)cc1Cl	ZINC001049869858	1348075567	/nfs/dbraw/zinc/07/55/67/1348075567.db2.gz	FTRAJOOMSPIRQO-HOTGVXAUSA-N	0	3	340.801	3.483	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](C)c1ccc(F)c(F)c1	ZINC001049905144	1348103765	/nfs/dbraw/zinc/10/37/65/1348103765.db2.gz	VLLSACNPZGSUOD-FSPWUOQZSA-N	0	3	334.410	3.320	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1nsc2ccccc21	ZINC001049907699	1348105432	/nfs/dbraw/zinc/10/54/32/1348105432.db2.gz	FBDXXWJMPIIPRY-IAGOWNOFSA-N	0	3	341.480	3.090	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H]1Cc2c1cccc2Cl	ZINC001049920975	1348113616	/nfs/dbraw/zinc/11/36/16/1348113616.db2.gz	DBJXEEASZTXASU-YTQUADARSA-N	0	3	342.870	3.068	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc2c(cccc2C)o1	ZINC001049924641	1348115728	/nfs/dbraw/zinc/11/57/28/1348115728.db2.gz	SIYXIZQZOPSKEM-ZWKOTPCHSA-N	0	3	336.435	3.443	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1csc(C2CC2)n1	ZINC001049928454	1348118655	/nfs/dbraw/zinc/11/86/55/1348118655.db2.gz	SGXUJRLFKFFFOL-JKSUJKDBSA-N	0	3	331.485	3.276	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cccc2c1OCC2(C)C	ZINC001049933616	1348120765	/nfs/dbraw/zinc/12/07/65/1348120765.db2.gz	MDYHJVCALVHVJR-ROUUACIJSA-N	0	3	340.467	3.222	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cc(C4CC4)[nH]c3C3CC3)[C@@H]2C1	ZINC001050073928	1348172959	/nfs/dbraw/zinc/17/29/59/1348172959.db2.gz	BMEXJANSFYTWEC-QFBILLFUSA-N	0	3	339.483	3.492	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3cc(C)n([C@H](C)CC)n3)[C@@H]2C1	ZINC001050081435	1348176090	/nfs/dbraw/zinc/17/60/90/1348176090.db2.gz	XJDBAUXPLLVJMT-HHXXYDBFSA-N	0	3	344.503	3.275	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)Cc3csc(C(C)(C)C)n3)[C@@H]2C1	ZINC001050164906	1348201413	/nfs/dbraw/zinc/20/14/13/1348201413.db2.gz	OLNIGDNRDVMMLI-GOEBONIOSA-N	0	3	347.528	3.092	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3ccc(OC)cc3Cl)[C@@H]2C1	ZINC001050165738	1348202038	/nfs/dbraw/zinc/20/20/38/1348202038.db2.gz	GZCQTLVIODLNJD-KBXCAEBGSA-N	0	3	348.874	3.461	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3[nH]ccc3-c3ccccc3)[C@@H]2C1	ZINC001050181070	1348203806	/nfs/dbraw/zinc/20/38/06/1348203806.db2.gz	DAKPUHLULGJRJA-PKOBYXMFSA-N	0	3	335.451	3.404	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cc4ccc(C)cc4[nH]3)C2)CC1	ZINC001050607711	1348299625	/nfs/dbraw/zinc/29/96/25/1348299625.db2.gz	RAOZGUFHWLMLOM-UHFFFAOYSA-N	0	3	335.451	3.038	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cc4c(ccc(C)c4C)[nH]3)C2)CC1	ZINC001050614793	1348303008	/nfs/dbraw/zinc/30/30/08/1348303008.db2.gz	FWZRLXIFXGPOSH-UHFFFAOYSA-N	0	3	349.478	3.346	20	30		EGEDHN
C=C1CCC(C(=O)N2CC3(C2)CCN(Cc2cccnc2)CC3)CC1	ZINC001050643662	1348312762	/nfs/dbraw/zinc/31/27/62/1348312762.db2.gz	KDMAPBVAPGEYJM-UHFFFAOYSA-N	0	3	339.483	3.252	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc(C(C)C)nc3C)C2)CC1	ZINC001050668364	1348322152	/nfs/dbraw/zinc/32/21/52/1348322152.db2.gz	NFWFZJYPZSPISG-UHFFFAOYSA-N	0	3	339.483	3.075	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)Cc3cccc4sccc43)C2)CC1	ZINC001050688582	1348327797	/nfs/dbraw/zinc/32/77/97/1348327797.db2.gz	YWZKYSZDVJMHOD-UHFFFAOYSA-N	0	3	338.476	3.001	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H](F)CC3CCCCC3)C2)CC1	ZINC001050731729	1348340338	/nfs/dbraw/zinc/34/03/38/1348340338.db2.gz	PKNVQMRHSHBUDJ-GOSISDBHSA-N	0	3	334.479	3.243	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)Cc3ccc4ccccc4c3)C2)CC1	ZINC001050749031	1348348094	/nfs/dbraw/zinc/34/80/94/1348348094.db2.gz	FDELLPJCJYVNQX-UHFFFAOYSA-N	0	3	346.474	3.330	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3oc(C)cc3C)cccc2C1	ZINC001051284413	1348417812	/nfs/dbraw/zinc/41/78/12/1348417812.db2.gz	RYRCJCVSHYMURM-UHFFFAOYSA-N	0	3	336.435	3.208	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3ccoc3Cl)cccc2C1	ZINC001051284811	1348418115	/nfs/dbraw/zinc/41/81/15/1348418115.db2.gz	JFCHLRXLMZIZQF-UHFFFAOYSA-N	0	3	342.826	3.244	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)[C@H]3CCC(F)(F)C3)cccc2C1	ZINC001051290921	1348421286	/nfs/dbraw/zinc/42/12/86/1348421286.db2.gz	VJESXJNZRJJGSX-HNNXBMFYSA-N	0	3	346.421	3.120	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)[C@@H]3C[C@H]3C(C)(C)C)cccc2C1	ZINC001051293969	1348422775	/nfs/dbraw/zinc/42/27/75/1348422775.db2.gz	YKUWUFCCRKRXHK-WOJBJXKFSA-N	0	3	338.495	3.366	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)[C@@H]3C[C@]3(C)C(C)C)cccc2C1	ZINC001051306260	1348427669	/nfs/dbraw/zinc/42/76/69/1348427669.db2.gz	QFLAGKYURGQVKL-RBBKRZOGSA-N	0	3	338.495	3.366	20	30		EGEDHN
CC1(C)CC(C(=O)N[C@@H]2CCCN(Cc3cccc(C#N)c3)CC2)C1	ZINC001052355552	1348532562	/nfs/dbraw/zinc/53/25/62/1348532562.db2.gz	WVQSUHFGRVYVJH-LJQANCHMSA-N	0	3	339.483	3.465	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H](NC(=O)C3(C4CC4)CC3)CC2)cc1	ZINC001052474717	1348550127	/nfs/dbraw/zinc/55/01/27/1348550127.db2.gz	WOPCQBFZGHFLIB-IBGZPJMESA-N	0	3	337.467	3.219	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@H](NC(=O)C3(F)CCCC3)CC2)c1	ZINC001052507728	1348562208	/nfs/dbraw/zinc/56/22/08/1348562208.db2.gz	XMVPUBVYAMWBCN-SFHVURJKSA-N	0	3	343.446	3.311	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc3cc(C)ccc3n2)CC1	ZINC001052550053	1348575619	/nfs/dbraw/zinc/57/56/19/1348575619.db2.gz	SASNPTYKFBKALU-GOSISDBHSA-N	0	3	335.451	3.151	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cnc3ccccc3c2C)CC1	ZINC001052567924	1348581910	/nfs/dbraw/zinc/58/19/10/1348581910.db2.gz	IVHPRAVRXBIPEC-QGZVFWFLSA-N	0	3	335.451	3.151	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@H](NC(=O)[C@]34C[C@H]3CCC4)CC2)c1	ZINC001052576273	1348584196	/nfs/dbraw/zinc/58/41/96/1348584196.db2.gz	KJFCEWFWJZOVOG-SVFBPWRDSA-N	0	3	337.467	3.219	20	30		EGEDHN
CC1(C(=O)N[C@@H]2CCCN(Cc3ccc(C#N)cc3)CC2)CCC1	ZINC001052626734	1348600213	/nfs/dbraw/zinc/60/02/13/1348600213.db2.gz	HYGYYJKLIPHUNU-GOSISDBHSA-N	0	3	325.456	3.219	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)C(C)(C)c2ccc(Cl)cc2)CC1	ZINC001052674456	1348623872	/nfs/dbraw/zinc/62/38/72/1348623872.db2.gz	NGBGCEPSZZJCAO-KRWDZBQOSA-N	0	3	332.875	3.222	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCCN(Cc3ocnc3C)CC2)CC1	ZINC001052682227	1348629579	/nfs/dbraw/zinc/62/95/79/1348629579.db2.gz	RORCTTNOOBFMFJ-QGZVFWFLSA-N	0	3	331.460	3.200	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2c(F)ccc(F)c2Cl)CC1	ZINC001052737290	1348653471	/nfs/dbraw/zinc/65/34/71/1348653471.db2.gz	KDFJZLLOTBWSDU-LBPRGKRZSA-N	0	3	340.801	3.226	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)Cc2c[nH]c3cc(C)ccc23)CC1	ZINC001052785254	1348678742	/nfs/dbraw/zinc/67/87/42/1348678742.db2.gz	FOKMJBOAMGEPSH-GOSISDBHSA-N	0	3	337.467	3.013	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccccc2OCC(C)C)CC1	ZINC001052796866	1348683284	/nfs/dbraw/zinc/68/32/84/1348683284.db2.gz	HCGSEGVNBMUOFB-SFHVURJKSA-N	0	3	342.483	3.329	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccccc2C(F)(F)F)CC1	ZINC001052887299	1348724523	/nfs/dbraw/zinc/72/45/23/1348724523.db2.gz	XIKJOCDXTNFGMB-AWEZNQCLSA-N	0	3	338.373	3.313	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)Cc2coc3cc(C)ccc23)CC1	ZINC001052916361	1348747148	/nfs/dbraw/zinc/74/71/48/1348747148.db2.gz	LBHLYDQAHRHWBB-GOSISDBHSA-N	0	3	338.451	3.278	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2cc3c(s2)CC[C@@H](C)C3)CC1	ZINC001052923804	1348750415	/nfs/dbraw/zinc/75/04/15/1348750415.db2.gz	MPWMAAVTHDVHFU-ZBFHGGJFSA-N	0	3	330.497	3.090	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@@H](C)c2ccc(F)c(F)c2)CC1	ZINC001052947151	1348764408	/nfs/dbraw/zinc/76/44/08/1348764408.db2.gz	JRFKJYKZWDEFIX-HOCLYGCPSA-N	0	3	334.410	3.062	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@@H]2C[C@H]2c2cccc(F)c2F)CC1	ZINC001052948126	1348764981	/nfs/dbraw/zinc/76/49/81/1348764981.db2.gz	YLEJYDKYOBDYTP-BHYGNILZSA-N	0	3	346.421	3.062	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)Cc2ccc(OC(C)C)cc2)CC1	ZINC001052950990	1348766705	/nfs/dbraw/zinc/76/67/05/1348766705.db2.gz	DGBRJRJICMWIBQ-LJQANCHMSA-N	0	3	342.483	3.010	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2coc(C3CCCCC3)n2)CC1	ZINC001052964176	1348775666	/nfs/dbraw/zinc/77/56/66/1348775666.db2.gz	DTXRXSZMBILOBX-QGZVFWFLSA-N	0	3	343.471	3.330	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(C)s2)C1	ZINC001053061846	1348871225	/nfs/dbraw/zinc/87/12/25/1348871225.db2.gz	VFFMUNOWOFMTFB-IRXDYDNUSA-N	0	3	330.497	3.396	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)Cc2ccsc2)C1	ZINC001053063070	1348874433	/nfs/dbraw/zinc/87/44/33/1348874433.db2.gz	GZPFFWCXTPEOTH-MSOLQXFVSA-N	0	3	330.497	3.017	20	30		EGEDHN
C=CC[N@H+]1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001053067563	1348880788	/nfs/dbraw/zinc/88/07/88/1348880788.db2.gz	RWTOOQRGSNIMOD-FUHWJXTLSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=CC[N@@H+]1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001053067563	1348880795	/nfs/dbraw/zinc/88/07/95/1348880795.db2.gz	RWTOOQRGSNIMOD-FUHWJXTLSA-N	0	3	328.456	3.285	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cc3occc3[nH]2)C1	ZINC001053088169	1348913626	/nfs/dbraw/zinc/91/36/26/1348913626.db2.gz	ZJYVIZYWAIJJKY-MAUKXSAKSA-N	0	3	339.439	3.101	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(Cl)[nH]2)C1	ZINC001053094478	1348923462	/nfs/dbraw/zinc/92/34/62/1348923462.db2.gz	FRKCGSVEDFKWFL-RDJZCZTQSA-N	0	3	347.890	3.398	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)CCc2ccccc2)C1	ZINC001053104138	1348939707	/nfs/dbraw/zinc/93/97/07/1348939707.db2.gz	COWGGYCQRJZMIU-NHCUHLMSSA-N	0	3	338.495	3.346	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)CCC1CCC1	ZINC001134036089	1376322572	/nfs/dbraw/zinc/32/25/72/1376322572.db2.gz	ZMTVSLQMSYOPFU-STQMWFEESA-N	0	3	331.298	3.348	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)Cc1c(C)cccc1Cl)C2	ZINC001054159555	1349162046	/nfs/dbraw/zinc/16/20/46/1349162046.db2.gz	KVJBUUQVUCATFW-HXUWFJFHSA-N	0	3	344.886	3.139	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(C)c3cccnc13)C2	ZINC001054166003	1349169249	/nfs/dbraw/zinc/16/92/49/1349169249.db2.gz	SKJSQGGEUMLTIK-QFIPXVFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc3ccc(C)cc3[nH]1)C2	ZINC001054172628	1349173506	/nfs/dbraw/zinc/17/35/06/1349173506.db2.gz	TXHIQBZBPQHERG-OAQYLSRUSA-N	0	3	335.451	3.038	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@H](C)c1cc(C)oc1C)C2	ZINC001054215310	1349215225	/nfs/dbraw/zinc/21/52/25/1349215225.db2.gz	QYQYAIWVMAZWHW-DYESRHJHSA-N	0	3	342.483	3.338	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc3ccccc3n1)C2	ZINC001054231678	1349225461	/nfs/dbraw/zinc/22/54/61/1349225461.db2.gz	XFUPVOVEMLLKOB-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc3c(s1)CCC3)C2	ZINC001054236403	1349228975	/nfs/dbraw/zinc/22/89/75/1349228975.db2.gz	JTSHFVIDOWANPB-FQEVSTJZSA-N	0	3	342.508	3.188	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cncc3ccccc31)C2	ZINC001054245579	1349239358	/nfs/dbraw/zinc/23/93/58/1349239358.db2.gz	VYAMPVOSFYSNPI-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@@H]3CCCO[C@H]3C)cc2C1	ZINC001054262300	1349259649	/nfs/dbraw/zinc/25/96/49/1349259649.db2.gz	URKVIVAIXFOLCS-HNAYVOBHSA-N	0	3	328.456	3.010	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)C3CCC(OC)CC3)cc2C1	ZINC001054278516	1349279182	/nfs/dbraw/zinc/27/91/82/1349279182.db2.gz	DJOUENUXBDNFNO-UHFFFAOYSA-N	0	3	342.483	3.400	20	30		EGEDHN
C[C@H]1CN(C(=O)C2CCCCC2)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054345193	1349324730	/nfs/dbraw/zinc/32/47/30/1349324730.db2.gz	MBIAWDXTFULVII-GUYCJALGSA-N	0	3	331.485	3.137	20	30		EGEDHN
Cc1ccccc1C(=O)N1C[C@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001054348910	1349328765	/nfs/dbraw/zinc/32/87/65/1349328765.db2.gz	PHTSLGAKLTXZSS-KBXCAEBGSA-N	0	3	339.464	3.179	20	30		EGEDHN
Cc1cscc1C(=O)N1C[C@H](NCc2ccc(C#N)s2)[C@@H](C)C1	ZINC001054536667	1349388548	/nfs/dbraw/zinc/38/85/48/1349388548.db2.gz	FDTXPQJSDLBYCR-ZBEGNZNMSA-N	0	3	345.493	3.240	20	30		EGEDHN
C[C@H]1CN(C(=O)C2CC(C)(C)C2)C[C@H]1NCc1ccc(C#N)c(F)c1	ZINC001054617076	1349415844	/nfs/dbraw/zinc/41/58/44/1349415844.db2.gz	CBYZRBGYKHQZEM-SCLBCKFNSA-N	0	3	343.446	3.070	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2(C)CCCC2)C[C@@H]1NCc1ccc(C#N)c(F)c1	ZINC001054942824	1349522816	/nfs/dbraw/zinc/52/28/16/1349522816.db2.gz	AVLHZBKMFFCSLW-KDOFPFPSSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)[C@H]1CC[C@H](CC)CC1)C[C@@H](C)O2	ZINC001071233303	1354516698	/nfs/dbraw/zinc/51/66/98/1354516698.db2.gz	GYGDYIDUCDNOAH-XCJLJZCSSA-N	0	3	348.531	3.471	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3cccc(F)c3C)C2)CC1	ZINC001086923875	1359250094	/nfs/dbraw/zinc/25/00/94/1359250094.db2.gz	CULMNHOVHATVPH-INIZCTEOSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)Cc2coc3cc(F)ccc23)CC[C@H]1C	ZINC001071498012	1354728514	/nfs/dbraw/zinc/72/85/14/1354728514.db2.gz	PVHYYQTXZSJUJX-RHSMWYFYSA-N	0	3	342.414	3.107	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)CC[C@@H]2CCCO2)C1	ZINC001088268403	1359823058	/nfs/dbraw/zinc/82/30/58/1359823058.db2.gz	NSWJNXSYHCYUDR-CVEARBPZSA-N	0	3	328.884	3.059	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cncn2-c2ccccc2)CC[C@H]1C	ZINC001071560560	1354764544	/nfs/dbraw/zinc/76/45/44/1354764544.db2.gz	CHQAIPZMVRBKLO-IAGOWNOFSA-N	0	3	338.455	3.031	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CC[C@@H](C)N(Cc2ccccc2)C1	ZINC001071571728	1354771443	/nfs/dbraw/zinc/77/14/43/1354771443.db2.gz	KZYGFTFRELCRAX-IEBWSBKVSA-N	0	3	337.467	3.457	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2cccc3cnccc32)CC[C@@H]1C	ZINC001071609047	1354794287	/nfs/dbraw/zinc/79/42/87/1354794287.db2.gz	GLULCHSLAPJZCH-LPHOPBHVSA-N	0	3	337.467	3.323	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2nc3c(s2)CCC3)CC[C@H]1C	ZINC001071683160	1354849680	/nfs/dbraw/zinc/84/96/80/1354849680.db2.gz	YDWVWAHXOCWKPX-KGLIPLIRSA-N	0	3	333.501	3.181	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(C)nc2C(C)C)CC[C@@H]1C	ZINC001071715465	1354873652	/nfs/dbraw/zinc/87/36/52/1354873652.db2.gz	IBXLEUHRPXDDAO-IRXDYDNUSA-N	0	3	327.472	3.119	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C2(c3cccc(F)c3)CC2)CC(C)(C)C1	ZINC001089508125	1360480165	/nfs/dbraw/zinc/48/01/65/1360480165.db2.gz	UPWPPPMHUQVXKM-GOSISDBHSA-N	0	3	342.458	3.097	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)Cc2cccc(OCCC)c2)CC[C@@H]1C	ZINC001071969684	1355050765	/nfs/dbraw/zinc/05/07/65/1355050765.db2.gz	AUHDYPVJPROULQ-FUHWJXTLSA-N	0	3	330.472	3.173	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@@H](NCc3ccc(Cl)c(F)c3)C2)CCC1	ZINC001183185656	1387273989	/nfs/dbraw/zinc/27/39/89/1387273989.db2.gz	OGJLQOGCEXPLTC-OAHLLOKOSA-N	0	3	348.849	3.363	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C23CC4CC(CC(C4)C2)C3)CC[C@@H]1C	ZINC001072012077	1355075804	/nfs/dbraw/zinc/07/58/04/1355075804.db2.gz	HZMLPXPMEODOCS-GZKSLDRRSA-N	0	3	328.500	3.195	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cccc(OCC(C)C)c2)CC[C@H]1C	ZINC001072058964	1355107790	/nfs/dbraw/zinc/10/77/90/1355107790.db2.gz	WCXOLGWEBVATHD-IEBWSBKVSA-N	0	3	342.483	3.327	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc3[nH]c(C)c(C)c3c2)CC[C@@H]1C	ZINC001072066713	1355110341	/nfs/dbraw/zinc/11/03/41/1355110341.db2.gz	OBOGYNQJUVAWRG-KSSFIOAISA-N	0	3	337.467	3.391	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)CC[C@@H]1C	ZINC001072102150	1355131421	/nfs/dbraw/zinc/13/14/21/1355131421.db2.gz	NKHZSHDEOOTEAA-BBRMVZONSA-N	0	3	343.431	3.008	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(N(C)CC)cc2)CC[C@@H]1C	ZINC001072112576	1355138150	/nfs/dbraw/zinc/13/81/50/1355138150.db2.gz	BZNBWNDYSASUMR-FUHWJXTLSA-N	0	3	329.488	3.302	20	30		EGEDHN
C[C@H]1CCN(C(=O)CCC2CC2)C[C@@H]1CNCc1ccccc1C#N	ZINC001072231673	1355196133	/nfs/dbraw/zinc/19/61/33/1355196133.db2.gz	LEQSSWUXOCBIKD-JXFKEZNVSA-N	0	3	339.483	3.323	20	30		EGEDHN
C[C@@H]1CCN(C(=O)C2CC=CC2)C[C@@H]1CNCc1ccccc1C#N	ZINC001072237792	1355198540	/nfs/dbraw/zinc/19/85/40/1355198540.db2.gz	AFSJQQXOHMURCZ-UZLBHIALSA-N	0	3	337.467	3.099	20	30		EGEDHN
C[C@]1(C(=O)N2CC3(C2)CCN(Cc2ccc(C#N)cc2)C3)CC=CCC1	ZINC001072773835	1355430170	/nfs/dbraw/zinc/43/01/70/1355430170.db2.gz	HVSKRJVDDKDONP-NRFANRHFSA-N	0	3	349.478	3.339	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)Cc3ccc(CCCC)cc3)C2)C1	ZINC001072899659	1355488871	/nfs/dbraw/zinc/48/88/71/1355488871.db2.gz	FUFOUXBAYMLIPU-UHFFFAOYSA-N	0	3	326.484	3.292	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@H](C)Cc3ccccc3Cl)C2)C1	ZINC001073021878	1355553122	/nfs/dbraw/zinc/55/31/22/1355553122.db2.gz	RFMKKKPEQZVEFL-OAHLLOKOSA-N	0	3	332.875	3.239	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)N2CC3(C2)CCN(Cc2cccc(C#N)c2)C3)C1	ZINC001073031949	1355560053	/nfs/dbraw/zinc/56/00/53/1355560053.db2.gz	VXQLALSGVNUNCE-LPHOPBHVSA-N	0	3	337.467	3.029	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc(O[C@@H](C)CC)cc3)C2)C1	ZINC001073106087	1355600980	/nfs/dbraw/zinc/60/09/80/1355600980.db2.gz	NYCDNZNNOAVOAI-KRWDZBQOSA-N	0	3	340.467	3.035	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H](c3ccc(F)cc3)C(C)C)C2)C1	ZINC001073469939	1355803982	/nfs/dbraw/zinc/80/39/82/1355803982.db2.gz	QHUGTMWXYUVKKE-IBGZPJMESA-N	0	3	342.458	3.123	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@@H](c3ccc(F)cc3)C(C)C)C2)C1	ZINC001073469922	1355804008	/nfs/dbraw/zinc/80/40/08/1355804008.db2.gz	PUCFTXLIGOJZFU-GOSISDBHSA-N	0	3	330.447	3.286	20	30		EGEDHN
C=CCN1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)c2cc[nH]c2)C1	ZINC001075421006	1356364154	/nfs/dbraw/zinc/36/41/54/1356364154.db2.gz	FQHJHTMFBIEEGK-IEBWSBKVSA-N	0	3	341.430	3.175	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](C2CCN(C(=O)CSC)CC2)CC1	ZINC001075444705	1356374816	/nfs/dbraw/zinc/37/48/16/1356374816.db2.gz	JAMCUGGMHXJJNP-OAHLLOKOSA-N	0	3	344.952	3.443	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)CCc3ccc(C(C)C)cc3)[C@@H]2C1	ZINC001076030113	1356469959	/nfs/dbraw/zinc/46/99/59/1356469959.db2.gz	SIYQNNOUWYZGLW-VQTJNVASSA-N	0	3	326.484	3.461	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cnc4c(F)cccc4c3)[C@@H]2C1	ZINC001076049485	1356475065	/nfs/dbraw/zinc/47/50/65/1356475065.db2.gz	AZPPQQQSMQKCSF-MAUKXSAKSA-N	0	3	339.414	3.096	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cnc4ccc(F)cc4c3)[C@@H]2C1	ZINC001076428180	1356576463	/nfs/dbraw/zinc/57/64/63/1356576463.db2.gz	HYOAXQSHFQCYDA-IFXJQAMLSA-N	0	3	339.414	3.096	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)C3CCC(C(F)F)CC3)[C@@H]2C1	ZINC001076514138	1356600014	/nfs/dbraw/zinc/60/00/14/1356600014.db2.gz	UCWKBDWSOKNBTI-SSHXOBKSSA-N	0	3	326.431	3.167	20	30		EGEDHN
C=CCCN1C[C@@H]2CCN(C(=O)c3sc(C(C)C)nc3C)[C@@H]2C1	ZINC001076566681	1356619271	/nfs/dbraw/zinc/61/92/71/1356619271.db2.gz	OVMBZSQKIRMEKT-LSDHHAIUSA-N	0	3	333.501	3.297	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)[C@H](C)Cc3cccc(Cl)c3)[C@@H]2C1	ZINC001076641232	1356640378	/nfs/dbraw/zinc/64/03/78/1356640378.db2.gz	YZZDTOUIYRLDRV-UWWQBHOKSA-N	0	3	332.875	3.237	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)C[C@H]1Cc2ccccc2O1	ZINC001099085690	1363615690	/nfs/dbraw/zinc/61/56/90/1363615690.db2.gz	QSLJAFOEBZTBPA-QZTJIDSGSA-N	0	3	342.483	3.173	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1[nH]c(C)cc1C	ZINC001099122115	1363636935	/nfs/dbraw/zinc/63/69/35/1363636935.db2.gz	UZTAVAVBQIXWFG-QGZVFWFLSA-N	0	3	347.503	3.055	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)CN(CC)c1ccccc1	ZINC001099345085	1363762869	/nfs/dbraw/zinc/76/28/69/1363762869.db2.gz	UKLIUYFQZVJOPZ-LJQANCHMSA-N	0	3	343.515	3.306	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCCO[C@@H](CNCc2ccccc2F)C1	ZINC001078460678	1356977940	/nfs/dbraw/zinc/97/79/40/1356977940.db2.gz	YPAZIFWWMLXZIU-FXAWDEMLSA-N	0	3	348.462	3.135	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@@H](NC(=O)C2=CCCC2)C12CCC2	ZINC001078588562	1357022572	/nfs/dbraw/zinc/02/25/72/1357022572.db2.gz	DBVQWIPKAFBNGC-ZIAGYGMSSA-N	0	3	339.277	3.022	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H](C)c2cccs2)C[C@H]1c1ccccc1	ZINC001081178462	1357847694	/nfs/dbraw/zinc/84/76/94/1357847694.db2.gz	NZRBNVZGMRHEOK-BPQIPLTHSA-N	0	3	338.476	3.069	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2ccc(Cl)cc2)C[C@H]1c1ccccc1	ZINC001081216833	1357850233	/nfs/dbraw/zinc/85/02/33/1357850233.db2.gz	XFGWCEWGONXOID-RBUKOAKNSA-N	0	3	338.838	3.171	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H]2CCCC(C)(C)C2)C[C@H]1c1ccccc1	ZINC001081233025	1357851811	/nfs/dbraw/zinc/85/18/11/1357851811.db2.gz	MXGGSRVDARUQMC-HSALFYBXSA-N	0	3	338.495	3.420	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H](C)[C@H](NCc2cnn(C(C)(C)C)c2)C1	ZINC001082722824	1358080747	/nfs/dbraw/zinc/08/07/47/1358080747.db2.gz	JLXXFQJTDXQWEX-WRWLIDTKSA-N	0	3	346.519	3.177	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)c3ccc(C)cc3Cl)[C@H]2C1	ZINC001083202016	1358122253	/nfs/dbraw/zinc/12/22/53/1358122253.db2.gz	VAPZHILMAKCAOP-ZWKOTPCHSA-N	0	3	348.874	3.140	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)[C@H]3CC[C@H](C(C)C)CC3)[C@H]2C1	ZINC001083234195	1358125694	/nfs/dbraw/zinc/12/56/94/1358125694.db2.gz	QTTMGLOEGNDYIH-LWYYNNOASA-N	0	3	348.531	3.327	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3ccsc3C(F)F)[C@@H]2C1	ZINC001084802578	1358314359	/nfs/dbraw/zinc/31/43/59/1358314359.db2.gz	GIVUATXWDBXUDQ-DGCLKSJQSA-N	0	3	326.412	3.408	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3cc4c(s3)CCC4)[C@@H]2C1	ZINC001084812550	1358316648	/nfs/dbraw/zinc/31/66/48/1358316648.db2.gz	MESLCIURQWATQH-HZPDHXFCSA-N	0	3	330.497	3.349	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)COc3c(C)cc(C)cc3C)[C@@H]2C1	ZINC001084813108	1358317626	/nfs/dbraw/zinc/31/76/26/1358317626.db2.gz	NYGCRSPTZHVMNJ-RTBURBONSA-N	0	3	342.483	3.099	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)C[C@H](C)c3ccc(OC)cc3)[C@@H]2C1	ZINC001084844221	1358326086	/nfs/dbraw/zinc/32/60/86/1358326086.db2.gz	KMMPJMRESCKVCU-ILZDJORESA-N	0	3	342.483	3.298	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)CCc3cccc(F)c3F)[C@@H]2C1	ZINC001084869464	1358335752	/nfs/dbraw/zinc/33/57/52/1358335752.db2.gz	NMAZKBPJMFPMDV-NVXWUHKLSA-N	0	3	334.410	3.006	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N[C@@H]1CCCC[C@H]1NCc1cc(C#N)ccc1F	ZINC001085174094	1358424102	/nfs/dbraw/zinc/42/41/02/1358424102.db2.gz	VSAISGWAIPENAH-KBAYOESNSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccc(C(F)F)nc1	ZINC001085219120	1358436467	/nfs/dbraw/zinc/43/64/67/1358436467.db2.gz	IDZPDTIMKCHRDF-CHWSQXEVSA-N	0	3	343.805	3.402	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ncn2ccc(C)cc12	ZINC001085251265	1358444716	/nfs/dbraw/zinc/44/47/16/1358444716.db2.gz	JOVJKCUNOYYVHI-HUUCEWRRSA-N	0	3	346.862	3.026	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1c(C)noc1C1CC1	ZINC001085277535	1358449770	/nfs/dbraw/zinc/44/97/70/1358449770.db2.gz	MTAQBJMGDWNPOQ-ZIAGYGMSSA-N	0	3	337.851	3.244	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCC[C@H]2NCc2c(C)noc2C)C1	ZINC001085324614	1358467511	/nfs/dbraw/zinc/46/75/11/1358467511.db2.gz	FQSOPOFUMSTTAW-IAGOWNOFSA-N	0	3	331.460	3.165	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCC[C@H]2NCc2cc(C)ns2)C1	ZINC001085325355	1358468344	/nfs/dbraw/zinc/46/83/44/1358468344.db2.gz	JSYVJCYCWCDEOM-HZPDHXFCSA-N	0	3	333.501	3.325	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)C1CC2(CC2)C1	ZINC001085326428	1358468741	/nfs/dbraw/zinc/46/87/41/1358468741.db2.gz	NLWLYUBAMRBOOD-ZIAGYGMSSA-N	0	3	341.293	3.102	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)C1Cc2ccccc2C1	ZINC001085343023	1358472262	/nfs/dbraw/zinc/47/22/62/1358472262.db2.gz	YSYULEGLOLRQEZ-QZTJIDSGSA-N	0	3	332.875	3.171	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccc(NC(C)=O)cc1	ZINC001085403566	1358491422	/nfs/dbraw/zinc/49/14/22/1358491422.db2.gz	RBCVBBIEKPRYNP-IAGOWNOFSA-N	0	3	349.862	3.028	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1sc(C)nc1C	ZINC001085417283	1358494247	/nfs/dbraw/zinc/49/42/47/1358494247.db2.gz	QOWHBDVKCZGEEP-CHWSQXEVSA-N	0	3	327.881	3.143	20	30		EGEDHN
Cc1ccccc1[C@H](C)N1CC[C@@H]1CN(C)C(=O)c1ccc(C#N)[nH]1	ZINC001085553694	1358589566	/nfs/dbraw/zinc/58/95/66/1358589566.db2.gz	UNSCXYDTRRFSDJ-DOTOQJQBSA-N	0	3	336.439	3.102	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1oc(CC2CC2)nc1C	ZINC001085597106	1358623231	/nfs/dbraw/zinc/62/32/31/1358623231.db2.gz	QEBHEKBGVKIFPL-INIZCTEOSA-N	0	3	331.460	3.048	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ocnc1-c1ccccc1	ZINC001085633551	1358649736	/nfs/dbraw/zinc/64/97/36/1358649736.db2.gz	VHQFORMTBJTSSA-KRWDZBQOSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)[C@@H]1CCc2c1cccc2Cl	ZINC001085726121	1358714296	/nfs/dbraw/zinc/71/42/96/1358714296.db2.gz	PMURCKFREFKNGF-WMLDXEAASA-N	0	3	332.875	3.479	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C[C@@H]2CCN2C[C@@H]2CCC(F)(F)C2)cc1	ZINC001085758098	1358737550	/nfs/dbraw/zinc/73/75/50/1358737550.db2.gz	ZLPRCKIMPUMEPO-AEFFLSMTSA-N	0	3	346.421	3.250	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1cc(F)cc2cccnc21	ZINC001085853317	1358820043	/nfs/dbraw/zinc/82/00/43/1358820043.db2.gz	UJDCDMHUEWEPNZ-MRXNPFEDSA-N	0	3	327.403	3.096	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@H]1CCc2cccc(OC)c21	ZINC001085859562	1358826749	/nfs/dbraw/zinc/82/67/49/1358826749.db2.gz	DMXIQUILGIUINQ-MSOLQXFVSA-N	0	3	342.483	3.224	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1c[nH]nc1C1CCCCC1	ZINC001085918105	1358879333	/nfs/dbraw/zinc/87/93/33/1358879333.db2.gz	UOBJTENSRCDAGC-INIZCTEOSA-N	0	3	330.476	3.180	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1c(F)ccc(OC)c1F	ZINC001085934573	1358889766	/nfs/dbraw/zinc/88/97/66/1358889766.db2.gz	FXITWCQBJLQZIG-ZDUSSCGKSA-N	0	3	338.398	3.086	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1[nH]c2ccccc2c1OC	ZINC001085992346	1358946313	/nfs/dbraw/zinc/94/63/13/1358946313.db2.gz	HZAVEWHVHYKKIN-HNNXBMFYSA-N	0	3	341.455	3.289	20	30		EGEDHN
CN(C)c1ncccc1CNCCSCc1ccccc1C#N	ZINC001323444944	1387371162	/nfs/dbraw/zinc/37/11/62/1387371162.db2.gz	MWNABDSKFGESPN-UHFFFAOYSA-N	0	3	326.469	3.042	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc3ncccc3s2)C1	ZINC001086165735	1359013282	/nfs/dbraw/zinc/01/32/82/1359013282.db2.gz	DROVNDQQFIXYEE-TXEJJXNPSA-N	0	3	335.860	3.147	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)[C@H]2CCC[C@@H](C)C2)C1	ZINC001086182895	1359019029	/nfs/dbraw/zinc/01/90/29/1359019029.db2.gz	MSTFKFBRQCYLDE-RZFFKMDDSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2c(F)ccc(C)c2F)C1	ZINC001086187828	1359021148	/nfs/dbraw/zinc/02/11/48/1359021148.db2.gz	SAUWNHRGRFLZFX-TXEJJXNPSA-N	0	3	328.790	3.124	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(C(F)F)cc2)C1	ZINC001086225619	1359032350	/nfs/dbraw/zinc/03/23/50/1359032350.db2.gz	BTQVCABPXJASSQ-VDISTLRHSA-N	0	3	328.790	3.475	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cccc(C)c2Cl)C1	ZINC001086228797	1359033459	/nfs/dbraw/zinc/03/34/59/1359033459.db2.gz	HDTWJDLKQXZIOX-BETUJISGSA-N	0	3	327.255	3.499	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc3c(cccc3OC)[nH]2)C1	ZINC001086272708	1359049760	/nfs/dbraw/zinc/04/97/60/1359049760.db2.gz	WGUYTHHSLPMRCV-BETUJISGSA-N	0	3	347.846	3.027	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)[C@H]2CCCC2(C)C)C1	ZINC001086450177	1359099737	/nfs/dbraw/zinc/09/97/37/1359099737.db2.gz	JHFORYLRUFXZFK-MGPQQGTHSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2C[C@H](NCc3c(C)noc3C)C2)CC1	ZINC001086466660	1359108068	/nfs/dbraw/zinc/10/80/68/1359108068.db2.gz	OCFFFOWPWWLZMJ-JCNLHEQBSA-N	0	3	331.460	3.022	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2C[C@H](N[C@@H](C)c3cnc(C)cn3)C2)CC1	ZINC001086467693	1359108814	/nfs/dbraw/zinc/10/88/14/1359108814.db2.gz	PQSVPNFGYXKLLH-BQFCYCMXSA-N	0	3	342.487	3.077	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(C3CC3)nc2C)C1	ZINC001086481674	1359113807	/nfs/dbraw/zinc/11/38/07/1359113807.db2.gz	RJFWQVWOXKCJNC-CTYIDZIISA-N	0	3	333.863	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccn(C(CC)CC)n2)C1	ZINC001086496280	1359120210	/nfs/dbraw/zinc/12/02/10/1359120210.db2.gz	RGFHALGPCBFOJW-HDJSIYSDSA-N	0	3	338.883	3.095	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@@H]2C[C@@]23CCc2ccccc23)C1	ZINC001086522497	1359130678	/nfs/dbraw/zinc/13/06/78/1359130678.db2.gz	XLZJUZYHOYWJPA-PFSLXQJOSA-N	0	3	344.886	3.127	20	30		EGEDHN
C=CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2cc(CC)on2)C1	ZINC001086620188	1359166393	/nfs/dbraw/zinc/16/63/93/1359166393.db2.gz	BQZJJWLOFDTTBF-PKOBYXMFSA-N	0	3	339.439	3.011	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2ccc(CC)cc2)C1	ZINC001086622753	1359168002	/nfs/dbraw/zinc/16/80/02/1359168002.db2.gz	PISWLNBNQHFDHU-FCHUYYIVSA-N	0	3	346.474	3.470	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CC[C@H](CNC(=O)c2ccccc2)C1	ZINC001086634261	1359172674	/nfs/dbraw/zinc/17/26/74/1359172674.db2.gz	ICBIDUDJTFXOHK-OXJNMPFZSA-N	0	3	333.435	3.247	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccnn2[C@@H](C)CC)C1	ZINC001086709639	1359190472	/nfs/dbraw/zinc/19/04/72/1359190472.db2.gz	NFORGSCEMTXRET-SOUVJXGZSA-N	0	3	338.883	3.095	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cc(F)ccc2F)C1	ZINC001086717555	1359190639	/nfs/dbraw/zinc/19/06/39/1359190639.db2.gz	CBWBSMZTKKBMQL-WCQYABFASA-N	0	3	328.790	3.205	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccc3c(c2)[C@H](C)CO3)C1	ZINC001086783951	1359200866	/nfs/dbraw/zinc/20/08/66/1359200866.db2.gz	WOALADUZJCJNDG-IVMMDQJWSA-N	0	3	348.874	3.423	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)[C@@H]2CCOc3ccccc32)C1	ZINC001086829551	1359209780	/nfs/dbraw/zinc/20/97/80/1359209780.db2.gz	FHOJAYLEHWPSEX-ZMSDIMECSA-N	0	3	348.874	3.180	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2occ3c2CCCC3)C1	ZINC001086863143	1359216645	/nfs/dbraw/zinc/21/66/45/1359216645.db2.gz	JRYYVVKJTVSIQO-DZGCQCFKSA-N	0	3	336.863	3.399	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2c(C)nsc2C)C1	ZINC001086884818	1359220773	/nfs/dbraw/zinc/22/07/73/1359220773.db2.gz	XWSKZNNZQRDDCD-QWHCGFSZSA-N	0	3	327.881	3.001	20	30		EGEDHN
C[C@@H]1CC2(CN1C(=O)C#CC1CC1)CCN(CCC(F)(F)F)CC2	ZINC001086922587	1359248768	/nfs/dbraw/zinc/24/87/68/1359248768.db2.gz	VDAUIYYUZMKNJX-CQSZACIVSA-N	0	3	342.405	3.055	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)Cc3ccc(C)cc3)C2)CC1	ZINC001086931183	1359255360	/nfs/dbraw/zinc/25/53/60/1359255360.db2.gz	BFQQDUQKAKXFNA-IBGZPJMESA-N	0	3	338.495	3.264	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cc4ccccc4n3C)C2)CC1	ZINC001086940275	1359261967	/nfs/dbraw/zinc/26/19/67/1359261967.db2.gz	NNLAAGJQBVQHHM-KRWDZBQOSA-N	0	3	349.478	3.128	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cccc(Cl)c3F)C2)CC1	ZINC001086940746	1359262808	/nfs/dbraw/zinc/26/28/08/1359262808.db2.gz	YVPDEWGVWXKZCE-CQSZACIVSA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cccc(OCC)c3)C2)CC1	ZINC001086945468	1359266443	/nfs/dbraw/zinc/26/64/43/1359266443.db2.gz	BYFCYPBWZMLWLB-QGZVFWFLSA-N	0	3	340.467	3.035	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc(C(C)C)no3)C2)CC1	ZINC001086947211	1359268605	/nfs/dbraw/zinc/26/86/05/1359268605.db2.gz	RWVYHBQQXNXRMA-MRXNPFEDSA-N	0	3	343.471	3.138	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc4c(C)cccn4c3)C2)CC1	ZINC001086952427	1359272632	/nfs/dbraw/zinc/27/26/32/1359272632.db2.gz	INRFVWSETPXFPB-GOSISDBHSA-N	0	3	349.478	3.198	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc4ccccc4n3)C2)CC1	ZINC001086953652	1359273516	/nfs/dbraw/zinc/27/35/16/1359273516.db2.gz	PBTBVNDWOBPRMH-KRWDZBQOSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3oc(CC)cc3C)C2)CC1	ZINC001086953662	1359273934	/nfs/dbraw/zinc/27/39/34/1359273934.db2.gz	PJBLVJQHMCXPKL-INIZCTEOSA-N	0	3	328.456	3.100	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc4[nH]ccc4s3)C2)CC1	ZINC001086954360	1359274555	/nfs/dbraw/zinc/27/45/55/1359274555.db2.gz	JKCYJLQJABNWIJ-CQSZACIVSA-N	0	3	341.480	3.179	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)[C@H]3[C@H]4[C@@H]3[C@@H]3CC[C@H]4C3)C2)CC1	ZINC001086958887	1359279703	/nfs/dbraw/zinc/27/97/03/1359279703.db2.gz	GPZWZWVRMGIEDQ-XRNRSJMDSA-N	0	3	340.511	3.005	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3coc4ccccc34)C2)CC1	ZINC001086959890	1359280339	/nfs/dbraw/zinc/28/03/39/1359280339.db2.gz	XRISPMRZKBKXJY-MRXNPFEDSA-N	0	3	336.435	3.383	20	30		EGEDHN
CC(C)c1cccc(CNC[C@@H]2C[C@H](C)CCN2C(=O)[C@@H](C)C#N)n1	ZINC001087135901	1359301784	/nfs/dbraw/zinc/30/17/84/1359301784.db2.gz	DEBYPSQVPZRGNT-RYRKJORJSA-N	0	3	342.487	3.081	20	30		EGEDHN
C[C@@H]1CCN(C(=O)C#CC2CC2)[C@H](CNCc2ccccc2Cl)C1	ZINC001087164166	1359311645	/nfs/dbraw/zinc/31/16/45/1359311645.db2.gz	KWYUWLLXWJMTQL-QAPCUYQASA-N	0	3	344.886	3.470	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccoc1Cl	ZINC001087282124	1359362007	/nfs/dbraw/zinc/36/20/07/1359362007.db2.gz	RWUYJNPNYPLYTC-VHDGCEQUSA-N	0	3	334.847	3.175	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3sccc3F)C(C)(C)[C@@H]21	ZINC001087284923	1359364222	/nfs/dbraw/zinc/36/42/22/1359364222.db2.gz	QCNYINATMOWKOJ-DAXOMENPSA-N	0	3	334.460	3.129	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(F)c(C)cc3F)C(C)(C)[C@@H]21	ZINC001087290477	1359369469	/nfs/dbraw/zinc/36/94/69/1359369469.db2.gz	CQDSHUQVBANAKJ-FSPWUOQZSA-N	0	3	346.421	3.125	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3c(C)oc(C)c3C)C(C)(C)[C@H]21	ZINC001087295223	1359376042	/nfs/dbraw/zinc/37/60/42/1359376042.db2.gz	GFGFANBHVGBBGH-NXHRZFHOSA-N	0	3	328.456	3.057	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccn(CC)c3C)C(C)(C)[C@H]21	ZINC001087299844	1359382837	/nfs/dbraw/zinc/38/28/37/1359382837.db2.gz	CHYOKYYEZBFQIW-QRVBRYPASA-N	0	3	341.499	3.059	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(Cl)c(F)c3)C(C)(C)[C@@H]21	ZINC001087305421	1359390666	/nfs/dbraw/zinc/39/06/66/1359390666.db2.gz	SEDYMEMIRVPIRK-KBRIMQKVSA-N	0	3	348.849	3.331	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc4c(c3)C=CCC4)C(C)(C)[C@H]21	ZINC001087307773	1359394672	/nfs/dbraw/zinc/39/46/72/1359394672.db2.gz	GQUCEMJOAMVZNQ-HKBOAZHASA-N	0	3	348.490	3.498	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc(C(F)F)cc1	ZINC001087308695	1359395722	/nfs/dbraw/zinc/39/57/22/1359395722.db2.gz	UTFFKYCTJPRUOW-IXDOHACOSA-N	0	3	346.421	3.476	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc4c(c3)CCC=C4)C(C)(C)[C@H]21	ZINC001087314587	1359404589	/nfs/dbraw/zinc/40/45/89/1359404589.db2.gz	NPXVUHPMPQBGBL-HKBOAZHASA-N	0	3	348.490	3.498	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cncc4ccccc43)C(C)(C)[C@H]21	ZINC001087317702	1359409244	/nfs/dbraw/zinc/40/92/44/1359409244.db2.gz	LQJCHGBWLKTWOP-HOJAQTOUSA-N	0	3	347.462	3.087	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3c[nH]c4ccc(C)cc34)C(C)(C)[C@H]21	ZINC001087319845	1359412073	/nfs/dbraw/zinc/41/20/73/1359412073.db2.gz	VGXAOEVZQGVJPC-YSGRDPCXSA-N	0	3	349.478	3.328	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1coc2ccccc12	ZINC001087321415	1359413077	/nfs/dbraw/zinc/41/30/77/1359413077.db2.gz	UAOKJAKOFPUKJN-AYOQOUSVSA-N	0	3	336.435	3.285	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3coc4ccccc34)C(C)(C)[C@H]21	ZINC001087321416	1359413098	/nfs/dbraw/zinc/41/30/98/1359413098.db2.gz	UAOKJAKOFPUKJN-LZQZEXGQSA-N	0	3	336.435	3.285	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)[C@@H]2CC[C@H](c3ccccc3)O2)[C@H]1CC	ZINC001087575088	1359538677	/nfs/dbraw/zinc/53/86/77/1359538677.db2.gz	ODKBKMFHDZMPHF-MANSERQUSA-N	0	3	328.456	3.062	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(C)c(Cl)c2)[C@H]1CC	ZINC001087620883	1359558885	/nfs/dbraw/zinc/55/88/85/1359558885.db2.gz	AHCSHQPLOUTUFZ-ZWKOTPCHSA-N	0	3	332.875	3.183	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ncoc2-c2cccs2)[C@H]1CC	ZINC001087765802	1359633869	/nfs/dbraw/zinc/63/38/69/1359633869.db2.gz	XKFRISWSYBPMAX-QWHCGFSZSA-N	0	3	331.441	3.172	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cccc(N3CCCC3)c2)[C@H]1CC	ZINC001087773203	1359637196	/nfs/dbraw/zinc/63/71/96/1359637196.db2.gz	ZLQWANVRNBSUHU-RBUKOAKNSA-N	0	3	327.472	3.056	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cnn(C(C)(C)C)c2CC)[C@H]1CC	ZINC001087831879	1359669172	/nfs/dbraw/zinc/66/91/72/1359669172.db2.gz	KIOIRSPRHODUHP-FUHWJXTLSA-N	0	3	346.519	3.359	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)[C@H](C)c2ccc(F)c(F)c2)[C@H]1CC	ZINC001087835948	1359671297	/nfs/dbraw/zinc/67/12/97/1359671297.db2.gz	YIERAGYQUMJGSY-JEBQAFNWSA-N	0	3	334.410	3.061	20	30		EGEDHN
C/C(=C/C(=O)N1C[C@H]2CCN(Cc3cccc(C#N)c3)C[C@H]2C1)C1CC1	ZINC001087898564	1359702021	/nfs/dbraw/zinc/70/20/21/1359702021.db2.gz	SUKKRXVRMLQGSM-JODRBCSHSA-N	0	3	349.478	3.195	20	30		EGEDHN
Cc1cc(C(=O)N2C[C@H]3CCN(Cc4ccc(C#N)cc4)C[C@H]3C2)co1	ZINC001087945507	1359717475	/nfs/dbraw/zinc/71/74/75/1359717475.db2.gz	AJXBCQHKBYVRPP-QUCCMNQESA-N	0	3	349.434	3.054	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3sccc3C(C)C)C[C@@H]2C1	ZINC001088211132	1359796953	/nfs/dbraw/zinc/79/69/53/1359796953.db2.gz	SESUCRPXKZJAML-CVEARBPZSA-N	0	3	330.497	3.289	20	30		EGEDHN
C=CCN1CC[C@H](OCC2CCN(C(=O)c3csc(C)c3)CC2)C1	ZINC001088239500	1359811243	/nfs/dbraw/zinc/81/12/43/1359811243.db2.gz	XEDIDDWTYFFRHZ-SFHVURJKSA-N	0	3	348.512	3.186	20	30		EGEDHN
C=CCN1CC[C@H](OCC2CCN(C(=O)C3(CC)CCCC3)CC2)C1	ZINC001088240127	1359811619	/nfs/dbraw/zinc/81/16/19/1359811619.db2.gz	PNWLSKNWTCTBMT-IBGZPJMESA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)[C@@H]2Cc3ccccc32)C1	ZINC001088371529	1359854159	/nfs/dbraw/zinc/85/41/59/1359854159.db2.gz	JWTLHUBPUIJRLP-SJLPKXTDSA-N	0	3	332.875	3.440	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCCCN(C(=O)C2(CF)CC2)C1	ZINC001088379945	1359863341	/nfs/dbraw/zinc/86/33/41/1359863341.db2.gz	UQHHQYJXPMZEQY-CYBMUJFWSA-N	0	3	347.272	3.006	20	30		EGEDHN
C=C(Br)CN[C@H]1CCCCCN(C(=O)C(C)(C)C)C1	ZINC001088416748	1359885766	/nfs/dbraw/zinc/88/57/66/1359885766.db2.gz	WTBGAIFHSRXJQF-ZDUSSCGKSA-N	0	3	331.298	3.302	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2ccc(Cl)cn2)C1	ZINC001088416066	1359886097	/nfs/dbraw/zinc/88/60/97/1359886097.db2.gz	BYXGXKYTZDOAKS-CQSZACIVSA-N	0	3	342.270	3.462	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2ccc(OC)cc2)C1	ZINC001088417263	1359887400	/nfs/dbraw/zinc/88/74/00/1359887400.db2.gz	KPNXXGKQAJGBRI-INIZCTEOSA-N	0	3	336.863	3.422	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)Cc2ccc(F)cc2)C1	ZINC001088420072	1359890019	/nfs/dbraw/zinc/89/00/19/1359890019.db2.gz	HGVVQZCITNLZKC-QGZVFWFLSA-N	0	3	338.854	3.482	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](CNCc2c(F)cccc2F)[C@H](C)C1	ZINC001184303440	1387425015	/nfs/dbraw/zinc/42/50/15/1387425015.db2.gz	YYXFBCSJNZIYJW-HZPDHXFCSA-N	0	3	348.437	3.343	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)C[C@@H]2C[C@H]2Cc2ccccc2)[C@H]1C	ZINC001088764776	1360034877	/nfs/dbraw/zinc/03/48/77/1360034877.db2.gz	SSWMLOXUZOEICO-LMCOJAPRSA-N	0	3	326.484	3.410	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)C(C)(C)c2cccc(OC)c2)[C@H]1C	ZINC001088959203	1360116491	/nfs/dbraw/zinc/11/64/91/1360116491.db2.gz	RAZMYHUOPBVMRF-QAPCUYQASA-N	0	3	330.472	3.128	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@H]1CCN(Cc2ccc(C)cc2)[C@@H]1C	ZINC001089006788	1360134780	/nfs/dbraw/zinc/13/47/80/1360134780.db2.gz	YCPZNSKXATWXDS-GCJKJVERSA-N	0	3	346.474	3.298	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)Cc2c(C)oc3ccccc32)[C@H]1C	ZINC001089089519	1360163576	/nfs/dbraw/zinc/16/35/76/1360163576.db2.gz	XTKHEZZTICEIDN-KDOFPFPSSA-N	0	3	326.440	3.439	20	30		EGEDHN
CS[C@H](C)C(=O)N1CCCC[C@H]1CN(C)Cc1cccc(C#N)c1	ZINC001089124536	1360187647	/nfs/dbraw/zinc/18/76/47/1360187647.db2.gz	ZWYMTOYJEZOBMR-QAPCUYQASA-N	0	3	345.512	3.123	20	30		EGEDHN
Cc1ccc(CN(C)C[C@@H]2CCCCN2C(=O)[C@H](C)C#N)cc1F	ZINC001089139748	1360197015	/nfs/dbraw/zinc/19/70/15/1360197015.db2.gz	LUZPZVSKJZXKQQ-WBVHZDCISA-N	0	3	331.435	3.107	20	30		EGEDHN
Cc1cnc(CNC[C@@H]2CCN(C(=O)C#CC(C)(C)C)C[C@H]2C)s1	ZINC001184368878	1387441793	/nfs/dbraw/zinc/44/17/93/1387441793.db2.gz	CURGCRUHTPVAEF-ZBFHGGJFSA-N	0	3	347.528	3.075	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CCCC[C@H]1CN(C)Cc1cccc(C#N)c1	ZINC001089209326	1360254989	/nfs/dbraw/zinc/25/49/89/1360254989.db2.gz	JIOKPHTVMKLLNY-ZWKOTPCHSA-N	0	3	331.435	3.119	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCc2sc(CNCC3CCC3)nc2C1	ZINC001089277453	1360297734	/nfs/dbraw/zinc/29/77/34/1360297734.db2.gz	HHISYEAFWPTQBJ-UHFFFAOYSA-N	0	3	333.501	3.130	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCc2sc(CNCC3CC3)nc2C1	ZINC001089278326	1360298598	/nfs/dbraw/zinc/29/85/98/1360298598.db2.gz	CLWCJJCIHDDNOJ-GOSISDBHSA-N	0	3	333.501	3.130	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2nccc3ccsc32)CC(C)(C)C1	ZINC001089413242	1360408916	/nfs/dbraw/zinc/40/89/16/1360408916.db2.gz	WPQPPZMQXDJVEC-HNNXBMFYSA-N	0	3	341.480	3.150	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc3occc3s2)CC(C)(C)C1	ZINC001089488754	1360468167	/nfs/dbraw/zinc/46/81/67/1360468167.db2.gz	XRXWRCGRTCPTQJ-CYBMUJFWSA-N	0	3	330.453	3.348	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C(C)C)no2)CC(C)(C)C1	ZINC001089511181	1360482924	/nfs/dbraw/zinc/48/29/24/1360482924.db2.gz	NJQPTYJPDJXUOK-HNNXBMFYSA-N	0	3	331.460	3.042	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C(C)(C)c2ccccc2F)CC(C)(C)C1	ZINC001089520419	1360488142	/nfs/dbraw/zinc/48/81/42/1360488142.db2.gz	VURRXAUZFSQJON-INIZCTEOSA-N	0	3	344.474	3.343	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2sccc2OC)CC(C)(C)C1	ZINC001089539571	1360497512	/nfs/dbraw/zinc/49/75/12/1360497512.db2.gz	MPMVMAMPLJOWKX-CQSZACIVSA-N	0	3	334.485	3.000	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2sccc2COC)CC(C)(C)C1	ZINC001089541253	1360497963	/nfs/dbraw/zinc/49/79/63/1360497963.db2.gz	IBXHKDWBHYCQIC-INIZCTEOSA-N	0	3	348.512	3.138	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc3ccccc3n2)CC(C)(C)C1	ZINC001089547101	1360501340	/nfs/dbraw/zinc/50/13/40/1360501340.db2.gz	ZENDONVRSWYNDP-GOSISDBHSA-N	0	3	349.478	3.479	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C2CCC(C3CC3)CC2)CC(C)(C)C1	ZINC001089548102	1360502427	/nfs/dbraw/zinc/50/24/27/1360502427.db2.gz	GXKNCPSXBNNSML-CTWPCTMYSA-N	0	3	330.516	3.443	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc3c(s2)CCC3)CC(C)(C)C1	ZINC001089553800	1360505286	/nfs/dbraw/zinc/50/52/86/1360505286.db2.gz	AIUSJTHGTFKYQG-HNNXBMFYSA-N	0	3	330.497	3.090	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@H](C)c2cccc(F)c2)CC(C)(C)C1	ZINC001089560250	1360508471	/nfs/dbraw/zinc/50/84/71/1360508471.db2.gz	AJAVUZVCYZVUJX-CRAIPNDOSA-N	0	3	330.447	3.169	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1coc(C(C)(C)C)n1	ZINC001089640229	1360553926	/nfs/dbraw/zinc/55/39/26/1360553926.db2.gz	CNGRXSQTCIHHBX-OAHLLOKOSA-N	0	3	345.487	3.216	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1cccc2c1COCC2	ZINC001089649124	1360561703	/nfs/dbraw/zinc/56/17/03/1360561703.db2.gz	BNLSGJQODDYUEU-KRWDZBQOSA-N	0	3	342.483	3.166	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1sccc1CN(C)C	ZINC001089648698	1360562210	/nfs/dbraw/zinc/56/22/10/1360562210.db2.gz	PSVYOKWDPQJSTA-MRXNPFEDSA-N	0	3	349.544	3.216	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cnn(C)c1CCC	ZINC001089664383	1360575322	/nfs/dbraw/zinc/57/53/22/1360575322.db2.gz	JRDCISRAKLWFJF-INIZCTEOSA-N	0	3	346.519	3.169	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cccc2n[nH]cc21	ZINC001089678264	1360586468	/nfs/dbraw/zinc/58/64/68/1360586468.db2.gz	NZILUJBZUZBUJU-HNNXBMFYSA-N	0	3	340.471	3.359	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cccc(F)c1F	ZINC001089685400	1360590994	/nfs/dbraw/zinc/59/09/94/1360590994.db2.gz	CIDZTFFWMGUZEV-CQSZACIVSA-N	0	3	334.410	3.209	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc2c(c1)COC2	ZINC001089705903	1360608258	/nfs/dbraw/zinc/60/82/58/1360608258.db2.gz	DBFLCMRCUOTZBC-SFHVURJKSA-N	0	3	328.456	3.123	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc2ccccc2[nH]1	ZINC001089731284	1360635012	/nfs/dbraw/zinc/63/50/12/1360635012.db2.gz	OXJFZIXIXLMQNJ-QGZVFWFLSA-N	0	3	337.467	3.412	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1c(C)nsc1C	ZINC001089734854	1360639172	/nfs/dbraw/zinc/63/91/72/1360639172.db2.gz	ZEUXTJMDEULRFV-OAHLLOKOSA-N	0	3	333.501	3.004	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1cccs1	ZINC001089762037	1360653941	/nfs/dbraw/zinc/65/39/41/1360653941.db2.gz	CGRGONYHUCSMBB-YJNKXOJESA-N	0	3	336.888	3.283	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](CNCc2oc(C)nc2C)[C@@H](C)C1	ZINC001184471613	1387467674	/nfs/dbraw/zinc/46/76/74/1387467674.db2.gz	GBYIRTSBVWODQI-WMLDXEAASA-N	0	3	347.503	3.468	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)Cc1occc1C	ZINC001089858460	1360703520	/nfs/dbraw/zinc/70/35/20/1360703520.db2.gz	AZVWJVBGTSRAMH-NXOAAHMSSA-N	0	3	348.874	3.052	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1(C)CC(=C)C1	ZINC001089865588	1360708248	/nfs/dbraw/zinc/70/82/48/1360708248.db2.gz	QWURTJKHLVTWDP-HZMVEIRTSA-N	0	3	334.891	3.264	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)[C@@H]2C[C@H]2CC(C)(C)C)CC2(CCOCC2)C1	ZINC001089941370	1360756072	/nfs/dbraw/zinc/75/60/72/1360756072.db2.gz	HORUPCVMEXVNLQ-OKZBNKHCSA-N	0	3	348.531	3.232	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2scnc2C(C)(C)C)C1	ZINC001091271590	1361027563	/nfs/dbraw/zinc/02/75/63/1361027563.db2.gz	QDRHKEUMELUTPE-UHFFFAOYSA-N	0	3	341.908	3.291	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cnn([C@@H](C)CC)c2C)C1	ZINC001091318749	1361042627	/nfs/dbraw/zinc/04/26/27/1361042627.db2.gz	MIZUSOMJFLTBEJ-GRTSSRMGSA-N	0	3	338.883	3.013	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@H]2Cc3ccc(Cl)cc32)C1	ZINC001091346389	1361053279	/nfs/dbraw/zinc/05/32/79/1361053279.db2.gz	DXVFJSAKWRIHHA-INORYPFCSA-N	0	3	339.266	3.217	20	30		EGEDHN
CC(C)=C(F)C(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@@]2(C)C1	ZINC001091591144	1361153780	/nfs/dbraw/zinc/15/37/80/1361153780.db2.gz	RZLIJZIGIMQTLH-XLIONFOSSA-N	0	3	341.430	3.102	20	30		EGEDHN
C[C@H](c1ccc(F)cc1)N1C[C@@H]2CN(C(=O)C#CC3CC3)C[C@]2(C)C1	ZINC001091655920	1361170590	/nfs/dbraw/zinc/17/05/90/1361170590.db2.gz	RNKXIAZOMHZENP-FPDPHYFHSA-N	0	3	340.442	3.080	20	30		EGEDHN
C[C@@H](c1cccc(F)c1)N1C[C@@H]2CN(C(=O)C#CC3CC3)C[C@]2(C)C1	ZINC001091655107	1361170783	/nfs/dbraw/zinc/17/07/83/1361170783.db2.gz	BCNWCEHCMNGXME-KLHJMIIUSA-N	0	3	340.442	3.080	20	30		EGEDHN
C[C@@H](c1ccc(F)cc1)N1C[C@@H]2CN(C(=O)C#CC3CC3)C[C@]2(C)C1	ZINC001091655922	1361170838	/nfs/dbraw/zinc/17/08/38/1361170838.db2.gz	RNKXIAZOMHZENP-KLHJMIIUSA-N	0	3	340.442	3.080	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3cc4cccc(C)c4s3)C[C@]2(C)C1	ZINC001091798332	1361223118	/nfs/dbraw/zinc/22/31/18/1361223118.db2.gz	UQYWBIBIBXTZJO-UZLBHIALSA-N	0	3	338.476	3.237	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)C3CC(C)(C)CC(C)(C)C3)C[C@]2(C)C1	ZINC001091883204	1361239975	/nfs/dbraw/zinc/23/99/75/1361239975.db2.gz	BQKCTYNFWCNBRR-UTKZUKDTSA-N	0	3	330.516	3.252	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CN(Cc3ncccc3C)C[C@@]2(C)C1	ZINC001091910541	1361244109	/nfs/dbraw/zinc/24/41/09/1361244109.db2.gz	AXUUNQIUXHBAHK-UTKZUKDTSA-N	0	3	341.499	3.273	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CN(Cc3c(C)nsc3C)C[C@@]2(C)C1	ZINC001091917404	1361248073	/nfs/dbraw/zinc/24/80/73/1361248073.db2.gz	WOTNMRPMVAJOFT-BEFAXECRSA-N	0	3	347.528	3.252	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C(C3CCC3)C3CCC3)C[C@]2(C)C1	ZINC001091959286	1361260017	/nfs/dbraw/zinc/26/00/17/1361260017.db2.gz	VBANBIFCPKPZNE-NQIIRXRSSA-N	0	3	328.500	3.006	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H]3CN(CCC(F)(F)F)C[C@@]3(C)C2)CC1	ZINC001091979193	1361265793	/nfs/dbraw/zinc/26/57/93/1361265793.db2.gz	VSGYYHMGGSBZEF-WBVHZDCISA-N	0	3	344.421	3.466	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@H](CC)CC3CCCC3)C[C@]2(C)C1	ZINC001092065016	1361286241	/nfs/dbraw/zinc/28/62/41/1361286241.db2.gz	HZYPOCVFKMLZBI-SBHAEUEKSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)c2ccccc2C)CC1	ZINC001093353776	1361568337	/nfs/dbraw/zinc/56/83/37/1361568337.db2.gz	YBZOKBQQBASXEZ-FQEVSTJZSA-N	0	3	336.479	3.335	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C2C(C)(C)C2(C)C)CC1	ZINC001093363441	1361574341	/nfs/dbraw/zinc/57/43/41/1361574341.db2.gz	FSEDMRZOCQHOGL-GOSISDBHSA-N	0	3	342.527	3.395	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@H](C)C(C)(C)C)CC1	ZINC001093372375	1361581809	/nfs/dbraw/zinc/58/18/09/1361581809.db2.gz	CEYQNWGPJDAVSV-WMZOPIPTSA-N	0	3	330.516	3.395	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@@H]2CCC2(C)C)CC1	ZINC001093376270	1361586509	/nfs/dbraw/zinc/58/65/09/1361586509.db2.gz	IFQFWNYKVQNSMQ-ROUUACIJSA-N	0	3	328.500	3.149	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C2(C)CC(=C)C2)CC1	ZINC001093378687	1361588903	/nfs/dbraw/zinc/58/89/03/1361588903.db2.gz	REYSWXRYCOCLDY-SFHVURJKSA-N	0	3	326.484	3.069	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C2(F)CCCCC2)CC1	ZINC001093383197	1361594947	/nfs/dbraw/zinc/59/49/47/1361594947.db2.gz	IXBNKTWHDUIOOD-SFHVURJKSA-N	0	3	346.490	3.385	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3ccc(Cl)cc3F)CCC[C@@H]12	ZINC001094462808	1361811484	/nfs/dbraw/zinc/81/14/84/1361811484.db2.gz	BVLXOZPXHVPIOL-SJLPKXTDSA-N	0	3	334.822	3.087	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3scnc3C(C)(C)C)CCC[C@@H]12	ZINC001094532867	1361848390	/nfs/dbraw/zinc/84/83/90/1361848390.db2.gz	RCSYIIUBIDAHMK-AUUYWEPGSA-N	0	3	345.512	3.048	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3csc4c3CCCC4)CCC[C@@H]12	ZINC001094574276	1361866179	/nfs/dbraw/zinc/86/61/79/1361866179.db2.gz	YXWCKQUAYQJGRM-UYAOXDASSA-N	0	3	342.508	3.235	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H]1CCc3ccc(OC)cc31)C2	ZINC001095545668	1362165354	/nfs/dbraw/zinc/16/53/54/1362165354.db2.gz	OGRQDVVMBZVRMK-BEKAIBRUSA-N	0	3	340.467	3.023	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CC1CC(c3ccccc3)C1)C2	ZINC001095648290	1362195842	/nfs/dbraw/zinc/19/58/42/1362195842.db2.gz	RTYKJXAHDDLGOA-CVRUDFDJSA-N	0	3	336.479	3.315	20	30		EGEDHN
CC(C)=C(C)CC(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001184918464	1387561880	/nfs/dbraw/zinc/56/18/80/1387561880.db2.gz	WJHASPDBDAPNKW-QGZVFWFLSA-N	0	3	329.419	3.134	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc3c(ccc(C)c3C)[nH]1)C2	ZINC001095865721	1362259021	/nfs/dbraw/zinc/25/90/21/1362259021.db2.gz	PEBPABHNGACYCJ-BPAFIMBUSA-N	0	3	335.451	3.143	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1csc(-c3ccco3)n1)C2	ZINC001095933789	1362293172	/nfs/dbraw/zinc/29/31/72/1362293172.db2.gz	BDXKKPTZDKJAFO-IPYPFGDCSA-N	0	3	343.452	3.314	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3[C@@H](C)c2ccccc2)cn1	ZINC001096379676	1362478823	/nfs/dbraw/zinc/47/88/23/1362478823.db2.gz	XOPXWWNELOMEBR-ZFCZOSEKSA-N	0	3	345.446	3.159	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](CNCc2oc(C)nc2C)[C@H](C)C1	ZINC001184967118	1387575909	/nfs/dbraw/zinc/57/59/09/1387575909.db2.gz	HTTSHKPXKIXTOY-QAPCUYQASA-N	0	3	345.487	3.059	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc(C)n(C(C)C)c1C)C2	ZINC001096512583	1362544870	/nfs/dbraw/zinc/54/48/70/1362544870.db2.gz	RVWSMVGVXLRAGB-NEWSRXKRSA-N	0	3	327.472	3.044	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H]1C[C@H]1c1cccc(F)c1F)C2	ZINC001096572019	1362584043	/nfs/dbraw/zinc/58/40/43/1362584043.db2.gz	GRJAZVVUTCOMEX-JGLPAQRISA-N	0	3	346.421	3.366	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C13CC(C(F)(F)F)(C1)C3)C2	ZINC001096618605	1362599005	/nfs/dbraw/zinc/59/90/05/1362599005.db2.gz	JZDINDQWPBWILW-ZCPDXSJMSA-N	0	3	328.378	3.017	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N[C@H]2C[C@H]3CC[C@@H]2N3CC(=C)C)cc1	ZINC001096622753	1362602037	/nfs/dbraw/zinc/60/20/37/1362602037.db2.gz	UOTWOBLZVFJSMM-HOJAQTOUSA-N	0	3	340.467	3.092	20	30		EGEDHN
Cc1cccc(Cl)c1CN1CCC(C)(NC(=O)[C@@H](C)C#N)CC1	ZINC001324301910	1387588634	/nfs/dbraw/zinc/58/86/34/1387588634.db2.gz	QIIXZGDUMTYVCZ-AWEZNQCLSA-N	0	3	333.863	3.279	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cnc([C@@H](C)OC)s1)C2	ZINC001097079709	1362835590	/nfs/dbraw/zinc/83/55/90/1362835590.db2.gz	NQFZDNWMIISKFC-TUVASFSCSA-N	0	3	349.500	3.152	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H]1CCc3ccc(OC)cc31)C2	ZINC001097235410	1362895956	/nfs/dbraw/zinc/89/59/56/1362895956.db2.gz	OGRQDVVMBZVRMK-QOJCHSLYSA-N	0	3	340.467	3.023	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccccc1-c1ccncc1)C2	ZINC001097330041	1362935835	/nfs/dbraw/zinc/93/58/35/1362935835.db2.gz	QPMRNCFPOFPZLI-UIFIKXQLSA-N	0	3	345.446	3.107	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cccc3c(C)c(C)[nH]c31)C2	ZINC001097359217	1362951018	/nfs/dbraw/zinc/95/10/18/1362951018.db2.gz	FANGQZNHOGLGEX-LZQZEXGQSA-N	0	3	335.451	3.143	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(-c3ccco3)o1)C2	ZINC001097502788	1363025833	/nfs/dbraw/zinc/02/58/33/1363025833.db2.gz	LMHAPTWRNWJMBH-KFWWJZLASA-N	0	3	326.396	3.451	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1scnc1C(F)F)C2	ZINC001097517543	1363035133	/nfs/dbraw/zinc/03/51/33/1363035133.db2.gz	XYUDJCVFXRQQMA-UTUOFQBUSA-N	0	3	341.427	3.382	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1cccc(C)c1Cl)C2	ZINC001097527152	1363040909	/nfs/dbraw/zinc/04/09/09/1363040909.db2.gz	YTDOQMMMXIDZBS-ZACQAIPSSA-N	0	3	332.875	3.489	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3CCOC2CCC2)CC1	ZINC001097789749	1363121980	/nfs/dbraw/zinc/12/19/80/1363121980.db2.gz	URLWDKMGQSLZJD-QRQLOZEOSA-N	0	3	332.488	3.023	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3[C@H](C)c2ccccc2)c1	ZINC001097813076	1363128658	/nfs/dbraw/zinc/12/86/58/1363128658.db2.gz	NEZMIQIBGMQKMO-DOVSJBTNSA-N	0	3	345.446	3.159	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@H](CNCc3cnc(C)o3)[C@@H](C)C2)CC1	ZINC001185096093	1387618214	/nfs/dbraw/zinc/61/82/14/1387618214.db2.gz	YGSQUEASPLWYGU-DOTOQJQBSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccoc1C1CC1)C[C@@H](C)O2	ZINC001098631373	1363407029	/nfs/dbraw/zinc/40/70/29/1363407029.db2.gz	WAWVPLRZNKXVJG-OAHLLOKOSA-N	0	3	344.455	3.039	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1CCC(C)(C)C1)C[C@H](C)O2	ZINC001098635918	1363409654	/nfs/dbraw/zinc/40/96/54/1363409654.db2.gz	UZKFGLIYPLESID-IRXDYDNUSA-N	0	3	334.504	3.081	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3CCC[C@]3(NC(=O)[C@H]3[C@@H]4CCC[C@@H]43)C2)cc1	ZINC001098779567	1363464941	/nfs/dbraw/zinc/46/49/41/1363464941.db2.gz	BKNCXHBLAXDKQT-WXOXAHCZSA-N	0	3	349.478	3.075	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)CCc1ccoc1	ZINC001099011892	1363572841	/nfs/dbraw/zinc/57/28/41/1363572841.db2.gz	FAXBLSAWFMAZJO-SFHVURJKSA-N	0	3	348.487	3.022	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)C2[C@@H]3CCCCCC[C@@H]23)C1	ZINC001099048952	1363594828	/nfs/dbraw/zinc/59/48/28/1363594828.db2.gz	KLZGZWFBUGGCGK-OOSNJVJTSA-N	0	3	328.500	3.197	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)Cc2csc(C(C)(C)C)n2)C1	ZINC001099080571	1363611759	/nfs/dbraw/zinc/61/17/59/1363611759.db2.gz	GWRVLDDJMVFVPP-LIRRHRJNSA-N	0	3	347.528	3.140	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)Cc1c(CC)noc1CC	ZINC001099110742	1363628690	/nfs/dbraw/zinc/62/86/90/1363628690.db2.gz	IAYSYDVAPRDOAJ-OAHLLOKOSA-N	0	3	347.503	3.135	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)C1(C2CC2)CCOCC1	ZINC001099153410	1363659693	/nfs/dbraw/zinc/65/96/93/1363659693.db2.gz	KJBTUXQGWUBSLI-GOSISDBHSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H]2C[C@H]2c2cccc(F)c2F)C1	ZINC001099169123	1363667976	/nfs/dbraw/zinc/66/79/76/1363667976.db2.gz	OLJNUEVQXHUXLM-NTNQKNOYSA-N	0	3	346.421	3.225	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@H]1CCC(C)(C)CN1CCn1cccn1	ZINC001099187990	1363679866	/nfs/dbraw/zinc/67/98/66/1363679866.db2.gz	AQBJJTNJTGIGPR-QZTJIDSGSA-N	0	3	346.519	3.092	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)C1(C)CC(=C)C1	ZINC001099228840	1363701797	/nfs/dbraw/zinc/70/17/97/1363701797.db2.gz	BLXJXRVIZHLUGH-KRWDZBQOSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2csc(C)c2C)C[C@H]1C(F)(F)F	ZINC001099256091	1363716676	/nfs/dbraw/zinc/71/66/76/1363716676.db2.gz	GPSAMTIIQMBWMZ-CHWSQXEVSA-N	0	3	332.391	3.143	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H]1C[C@H]1C1CCC1	ZINC001099264191	1363722039	/nfs/dbraw/zinc/72/20/39/1363722039.db2.gz	OWBGSRICDXQYNY-GBESFXJTSA-N	0	3	348.531	3.232	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@H]2CCC=CCCC2)C[C@H]1C(F)(F)F	ZINC001099268820	1363724817	/nfs/dbraw/zinc/72/48/17/1363724817.db2.gz	OZROSJRYRLXGSL-RRFJBIMHSA-N	0	3	330.394	3.288	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2c(C)cccc2Cl)C[C@H]1C(F)(F)F	ZINC001099301882	1363738466	/nfs/dbraw/zinc/73/84/66/1363738466.db2.gz	VYYSAXGPYMJDKT-DGCLKSJQSA-N	0	3	346.780	3.427	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@H](F)c2ccccc2)C[C@H]1C(F)(F)F	ZINC001099312789	1363744795	/nfs/dbraw/zinc/74/47/95/1363744795.db2.gz	HHXPSUQFFIBHLJ-RBSFLKMASA-N	0	3	344.352	3.252	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2ccc(C)cc2C)C[C@H]1C(F)(F)F	ZINC001099339806	1363759585	/nfs/dbraw/zinc/75/95/85/1363759585.db2.gz	YYXCTWOKDRRBRL-HUUCEWRRSA-N	0	3	326.362	3.082	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)C[C@@H](C)c2ccccc2)C[C@H]1C(F)(F)F	ZINC001099339864	1363759764	/nfs/dbraw/zinc/75/97/64/1363759764.db2.gz	HPEQQOYDYWZBMX-FVQBIDKESA-N	0	3	340.389	3.345	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)COc1cccc(C)c1	ZINC001099339316	1363759954	/nfs/dbraw/zinc/75/99/54/1363759954.db2.gz	GMYAOJAOBTZBKB-QGZVFWFLSA-N	0	3	330.472	3.167	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H](OC)C1CCCCC1	ZINC001099380846	1363782271	/nfs/dbraw/zinc/78/22/71/1363782271.db2.gz	WNAIJKHOAIKSLE-MOPGFXCFSA-N	0	3	348.531	3.212	20	30		EGEDHN
C[C@H](C#N)C(=O)NCC1CC(NCc2cccc(Cl)c2Cl)C1	ZINC001100196685	1364041863	/nfs/dbraw/zinc/04/18/63/1364041863.db2.gz	QBAIXNPUDCUXBW-XSRFYTQQSA-N	0	3	340.254	3.137	20	30		EGEDHN
CC1(C)C(C(=O)NCC2CC(NCC#Cc3ccccc3)C2)C1(C)C	ZINC001100221985	1364048842	/nfs/dbraw/zinc/04/88/42/1364048842.db2.gz	ZTKGUSSHSDMWCI-UHFFFAOYSA-N	0	3	338.495	3.205	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](CNCc2nccn2CC)[C@@H](C)C1	ZINC001185227180	1387656706	/nfs/dbraw/zinc/65/67/06/1387656706.db2.gz	VDQPSENVQXHVQG-DLBZAZTESA-N	0	3	346.519	3.080	20	30		EGEDHN
CC/C(C)=C/C(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1	ZINC001100307673	1364075975	/nfs/dbraw/zinc/07/59/75/1364075975.db2.gz	MRIPKFXTOSJQGW-AWNIVKPZSA-N	0	3	329.419	3.038	20	30		EGEDHN
C[C@@H](NC1CC(CNC(=O)C#CC(C)(C)C)C1)c1ccccc1F	ZINC001100318627	1364079073	/nfs/dbraw/zinc/07/90/73/1364079073.db2.gz	WPGHOIUAUPQGKF-QQFBHYJXSA-N	0	3	330.447	3.421	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCC1CC(NCc2oc(C)nc2C)C1	ZINC001100359796	1364090493	/nfs/dbraw/zinc/09/04/93/1364090493.db2.gz	MIQUXUBLWFGYHX-UHFFFAOYSA-N	0	3	331.460	3.044	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCC1CC(NCc2c(C)noc2CC)C1	ZINC001100359608	1364090783	/nfs/dbraw/zinc/09/07/83/1364090783.db2.gz	FUOWIZPTUYTWHK-UHFFFAOYSA-N	0	3	345.487	3.298	20	30		EGEDHN
CC(C)C(C)(C)C(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100365943	1364093772	/nfs/dbraw/zinc/09/37/72/1364093772.db2.gz	VJWSXCZEVPJXNL-UHFFFAOYSA-N	0	3	326.484	3.205	20	30		EGEDHN
C=C(C)CCC(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1	ZINC001100370793	1364094942	/nfs/dbraw/zinc/09/49/42/1364094942.db2.gz	AOXOMLXERWGLHH-UHFFFAOYSA-N	0	3	329.419	3.038	20	30		EGEDHN
O=C(NCC1CC(NCC#Cc2ccccc2)C1)C12CCC(CC1)C2	ZINC001100446023	1364117641	/nfs/dbraw/zinc/11/76/41/1364117641.db2.gz	LLEFINQQQDPMOF-UHFFFAOYSA-N	0	3	336.479	3.103	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)[C@@H](C)C(CC)CC)C1	ZINC001100465056	1364124573	/nfs/dbraw/zinc/12/45/73/1364124573.db2.gz	NUNBLCUTEOOLGU-OPFPJEHXSA-N	0	3	345.325	3.452	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC1CC(NCc2c(C)onc2CC)C1	ZINC001100560084	1364162725	/nfs/dbraw/zinc/16/27/25/1364162725.db2.gz	USHDIGOVOJYIAA-UHFFFAOYSA-N	0	3	333.476	3.132	20	30		EGEDHN
CC1(C(=O)NCC2CC(NCC#Cc3cccc(Cl)c3)C2)CCC1	ZINC001100577079	1364171263	/nfs/dbraw/zinc/17/12/63/1364171263.db2.gz	HMPLPQVMEKFSTM-UHFFFAOYSA-N	0	3	344.886	3.366	20	30		EGEDHN
C=CCC1(C(=O)NCC2CC(NCc3cc(C)ns3)C2)CCC1	ZINC001100647225	1364203516	/nfs/dbraw/zinc/20/35/16/1364203516.db2.gz	JMWCJVPXUDZOTF-UHFFFAOYSA-N	0	3	333.501	3.182	20	30		EGEDHN
CCC1(C(=O)NCC2CC(NCC#Cc3cccc(Cl)c3)C2)CC1	ZINC001100649469	1364204605	/nfs/dbraw/zinc/20/46/05/1364204605.db2.gz	IXXNCQMMVAIYFU-UHFFFAOYSA-N	0	3	344.886	3.366	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)[C@H](C)CC(C)C)C1	ZINC001100795741	1364264932	/nfs/dbraw/zinc/26/49/32/1364264932.db2.gz	GYVLWWSSHBBDJH-LMWSTFAQSA-N	0	3	331.298	3.062	20	30		EGEDHN
C=CCN1CC[C@@H](Oc2ccnc(CNC(=O)[C@H](C)CC(C)C)c2)C1	ZINC001101097760	1364413620	/nfs/dbraw/zinc/41/36/20/1364413620.db2.gz	ZGZXIDBYSDFCRD-VQIMIIECSA-N	0	3	345.487	3.019	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C/C=C\c3ccccc3F)C[C@]2(C)C1	ZINC001101279769	1364496987	/nfs/dbraw/zinc/49/69/87/1364496987.db2.gz	ZGRBSCUGLLMRQS-CHMBIBJPSA-N	0	3	340.442	3.033	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@H]2CN(Cc3cncc(C)c3)C[C@@]2(C)C1	ZINC001101333277	1364513355	/nfs/dbraw/zinc/51/33/55/1364513355.db2.gz	OBRHUGVWYBZRAH-DSKINZAPSA-N	0	3	341.499	3.273	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@H]2CN(CCC(F)(F)F)C[C@@]2(C)C1	ZINC001101378767	1364535997	/nfs/dbraw/zinc/53/59/97/1364535997.db2.gz	FDGNXDFEOWFGBP-CJNGLKHVSA-N	0	3	332.410	3.321	20	30		EGEDHN
CCCCC[C@@H](CC)C(=O)N1C[C@H]2CN(CC#CCOC)C[C@@]2(C)C1	ZINC001101471429	1364574869	/nfs/dbraw/zinc/57/48/69/1364574869.db2.gz	QUEBYALGWYAYHF-SBHAEUEKSA-N	0	3	348.531	3.023	20	30		EGEDHN
C=CCC[C@H](C)N1CC2(C1)C[C@@H](NC(=O)C(F)=C(C)C)c1nccn12	ZINC001101622862	1364659929	/nfs/dbraw/zinc/65/99/29/1364659929.db2.gz	RQOPBQOJOOUOPL-LSDHHAIUSA-N	0	3	346.450	3.073	20	30		EGEDHN
CCCCC(=O)NC[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1C	ZINC001101734522	1364707616	/nfs/dbraw/zinc/70/76/16/1364707616.db2.gz	JPUCOTKJWYLLQL-RHSMWYFYSA-N	0	3	331.435	3.072	20	30		EGEDHN
C#CCCCC(=O)NC[C@@H]1CN(Cc2cccc(Cl)c2)C[C@H]1C	ZINC001101921824	1364775853	/nfs/dbraw/zinc/77/58/53/1364775853.db2.gz	HGOLYYHQYOTCRC-NVXWUHKLSA-N	0	3	332.875	3.328	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@@H]1CN(Cc2c(C)noc2C)C[C@H]1C	ZINC001102004923	1364808192	/nfs/dbraw/zinc/80/81/92/1364808192.db2.gz	KZBRIEKQGDYEMO-CZUORRHYSA-N	0	3	333.476	3.078	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H]1CN(Cc2cc(F)ccc2OC)C[C@H]1C	ZINC001102010616	1364810623	/nfs/dbraw/zinc/81/06/23/1364810623.db2.gz	HLSXENJQBWXEFG-NVXWUHKLSA-N	0	3	348.462	3.375	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001102262715	1364974513	/nfs/dbraw/zinc/97/45/13/1364974513.db2.gz	JHBKAFZTUQICFH-BZUAXINKSA-N	0	3	345.512	3.406	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)NC[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1C	ZINC001102423360	1365048554	/nfs/dbraw/zinc/04/85/54/1365048554.db2.gz	UZETVWLHRINTAX-IIDMSEBBSA-N	0	3	345.462	3.174	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1CNC(=O)CCC1(C)CC1	ZINC001102494736	1365085835	/nfs/dbraw/zinc/08/58/35/1365085835.db2.gz	NIIFVFAPHAKXSM-UYAOXDASSA-N	0	3	338.495	3.303	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1CCNC(=O)CC1CC1	ZINC001102633897	1365145178	/nfs/dbraw/zinc/14/51/78/1365145178.db2.gz	NSYQUOGEPFVLON-RHSMWYFYSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=CCCC(=O)NCC[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1C	ZINC001102760038	1365205915	/nfs/dbraw/zinc/20/59/15/1365205915.db2.gz	BRBDCLRUXSTRCF-NVXWUHKLSA-N	0	3	343.446	3.238	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)[C@@H]2C[C@H]2c2ccncc2)C1	ZINC001103001941	1365332638	/nfs/dbraw/zinc/33/26/38/1365332638.db2.gz	CKKWHIXKAWEEGF-NKGKWGDASA-N	0	3	347.890	3.012	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)C2(C(F)(F)F)CC2)C1	ZINC001103462212	1365576796	/nfs/dbraw/zinc/57/67/96/1365576796.db2.gz	RLFVRQXWOBCIFU-ZYHUDNBSSA-N	0	3	338.801	3.156	20	30		EGEDHN
CC(C)N(CCc1ccccc1)CC(=O)NC1(C#N)CCCCC1	ZINC001324750010	1387759775	/nfs/dbraw/zinc/75/97/75/1387759775.db2.gz	ORBHCUSQXFSDAR-UHFFFAOYSA-N	0	3	327.472	3.282	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)CCc2ccc(C)o2)C1	ZINC001103750680	1365764208	/nfs/dbraw/zinc/76/42/08/1365764208.db2.gz	IBOHXHKYISXVMC-CZUORRHYSA-N	0	3	338.879	3.347	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cc(C)c(C)cn2)C[C@H]1C	ZINC001104438846	1366029661	/nfs/dbraw/zinc/02/96/61/1366029661.db2.gz	UVVFGYGKWAJREN-GDBMZVCRSA-N	0	3	335.879	3.139	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2(C)CCC2)C[C@H]1CCNCc1ccccc1C#N	ZINC001104500214	1366050461	/nfs/dbraw/zinc/05/04/61/1366050461.db2.gz	IQURCUHFEPTAGV-VQIMIIECSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H](C)[C@H](CCNCc3cc(C)no3)C2)CC1	ZINC001104629824	1366108844	/nfs/dbraw/zinc/10/88/44/1366108844.db2.gz	MKBQBXQCQRDMLR-CRAIPNDOSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)CCC2CCOCC2)C[C@H]1C	ZINC001104752257	1366156664	/nfs/dbraw/zinc/15/66/64/1366156664.db2.gz	AVOYRXAYRISTMS-RHSMWYFYSA-N	0	3	342.911	3.020	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cncc(Cl)c2)C[C@H]1C	ZINC001104791902	1366174228	/nfs/dbraw/zinc/17/42/28/1366174228.db2.gz	FJNDDMSSBYZUBB-DGCLKSJQSA-N	0	3	342.270	3.175	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)[C@@H](C)c2cccnc2)C[C@H]1C	ZINC001104920454	1366224213	/nfs/dbraw/zinc/22/42/13/1366224213.db2.gz	QSYBRCYLNCGAOY-UKPHBRMFSA-N	0	3	335.879	3.012	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2ccc(Cl)cn2)C[C@H]1C	ZINC001104931576	1366228992	/nfs/dbraw/zinc/22/89/92/1366228992.db2.gz	YCAHSHFHWOWRRL-DGCLKSJQSA-N	0	3	342.270	3.175	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2c[nH]c3ncccc23)C[C@H]1C	ZINC001105027008	1366283991	/nfs/dbraw/zinc/28/39/91/1366283991.db2.gz	JCNALQMKQJPILY-TZMCWYRMSA-N	0	3	346.862	3.003	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)c1ccc(NC(=O)C(C)(C)C)cc1	ZINC001185851901	1387815053	/nfs/dbraw/zinc/81/50/53/1387815053.db2.gz	QJGPZOQQKUXFCO-KRWDZBQOSA-N	0	3	343.471	3.051	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1C[C@@](CNCCF)(c2ccccc2)C1	ZINC001105432452	1366465443	/nfs/dbraw/zinc/46/54/43/1366465443.db2.gz	PNPPUAJZOFBCDU-MSEWRSJXSA-N	0	3	332.463	3.364	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@@H](CNCc2csc(CC)n2)[C@H](C)C1	ZINC001106562706	1366736904	/nfs/dbraw/zinc/73/69/04/1366736904.db2.gz	DJXZYAKVDRUUJO-OWCLPIDISA-N	0	3	349.544	3.492	20	30		EGEDHN
CC(C)=CC(=O)NC[C@]12CCC[C@H]1N(Cc1ccc(C#N)s1)CC2	ZINC001107273697	1366912851	/nfs/dbraw/zinc/91/28/51/1366912851.db2.gz	WWAWTWUVLVTNGW-IEBWSBKVSA-N	0	3	343.496	3.447	20	30		EGEDHN
C#CCCCCC(=O)NC[C@]12CCC[C@H]1N(Cc1cc(C)no1)CC2	ZINC001107365603	1366943933	/nfs/dbraw/zinc/94/39/33/1366943933.db2.gz	XWPRBFQPTNKSHT-UYAOXDASSA-N	0	3	343.471	3.037	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H]1CCC(C)=C(C)C1)C2	ZINC001109319796	1367050684	/nfs/dbraw/zinc/05/06/84/1367050684.db2.gz	HGYKIHRCENEUPL-YRXWBPOGSA-N	0	3	332.488	3.047	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](N(C)Cc2ccc(OC)c(C)c2)C1	ZINC001189744242	1367100794	/nfs/dbraw/zinc/10/07/94/1367100794.db2.gz	PEBWIJLZHBCFBW-LJQANCHMSA-N	0	3	342.483	3.230	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2ccccc2F)C1	ZINC001107701254	1367110387	/nfs/dbraw/zinc/11/03/87/1367110387.db2.gz	YWGKAAJRXDZRMH-KXBFYZLASA-N	0	3	334.435	3.001	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)c1ccccc1-c1c(C)n[nH]c1C	ZINC001190185947	1367195563	/nfs/dbraw/zinc/19/55/63/1367195563.db2.gz	PLTDIPXGLDJTPC-INIZCTEOSA-N	0	3	338.455	3.074	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CC1=CCCCC1	ZINC001109563054	1367200273	/nfs/dbraw/zinc/20/02/73/1367200273.db2.gz	GFDDYYIFRUSMPB-XODKDNOYSA-N	0	3	346.515	3.437	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](N(C)Cc2cccc3nsnc32)C1	ZINC001190429170	1367263260	/nfs/dbraw/zinc/26/32/60/1367263260.db2.gz	VYFDXAARRLZEQC-HNNXBMFYSA-N	0	3	344.484	3.080	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](N(C)Cc2cccc3c2CCOC3)C1	ZINC001190436583	1367265405	/nfs/dbraw/zinc/26/54/05/1367265405.db2.gz	XEZBIDKLHVYZMW-LJQANCHMSA-N	0	3	342.483	3.148	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](N(C)CCOc2cccc(F)c2)C1	ZINC001190435850	1367265425	/nfs/dbraw/zinc/26/54/25/1367265425.db2.gz	KENOZQIABPKTOY-KRWDZBQOSA-N	0	3	334.435	3.094	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@@]1(C)CN([C@H](C)CCC=C)CCO1	ZINC001108121730	1367291535	/nfs/dbraw/zinc/29/15/35/1367291535.db2.gz	FLZISQGCTBXHAF-QUCCMNQESA-N	0	3	334.504	3.132	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@@H](N(C)Cc3cccc(F)c3)C2)CCC1	ZINC001190603449	1367304665	/nfs/dbraw/zinc/30/46/65/1367304665.db2.gz	CKNGDCHMIWRSRH-GOSISDBHSA-N	0	3	328.431	3.052	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@]1(C)CN(CC2CC(C)(C)C2)CCO1	ZINC001108151887	1367312636	/nfs/dbraw/zinc/31/26/36/1367312636.db2.gz	VWLGBTCEPRLTDZ-OXQOHEQNSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2ccc(F)c(C)c2)C1	ZINC001108172531	1367321923	/nfs/dbraw/zinc/32/19/23/1367321923.db2.gz	FAFYAOZBTIINBT-JXFKEZNVSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1oc(C(C)C)nc1C)C2	ZINC001109817634	1367340195	/nfs/dbraw/zinc/34/01/95/1367340195.db2.gz	AFXDDNZYQBJMNU-PMPSAXMXSA-N	0	3	331.460	3.408	20	30		EGEDHN
CCCCCCCNC(=O)N1C[C@@H]2CN(Cc3ccccn3)C[C@H]2C1	ZINC001191091817	1367422350	/nfs/dbraw/zinc/42/23/50/1367422350.db2.gz	VCULJDQLQSKICN-ROUUACIJSA-N	0	3	344.503	3.125	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](C)c1ccc(C)s1)C2	ZINC001109975439	1367439424	/nfs/dbraw/zinc/43/94/24/1367439424.db2.gz	UEGXOTLVALJCOO-YVSFHVDLSA-N	0	3	348.512	3.084	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](CC)Cc1ccccc1C)C2	ZINC001109977679	1367440286	/nfs/dbraw/zinc/44/02/86/1367440286.db2.gz	URTIKCCIWFWQKX-PBASOCQRSA-N	0	3	338.495	3.309	20	30		EGEDHN
CC[C@@H](C#N)Oc1cccc(CNCc2cccc(C(=O)OC)c2)c1	ZINC001325037065	1387880468	/nfs/dbraw/zinc/88/04/68/1387880468.db2.gz	YGPJKYXJTZENCW-SFHVURJKSA-N	0	3	338.407	3.444	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H]1CCCCC1(C)C)C2	ZINC001110175107	1367545782	/nfs/dbraw/zinc/54/57/82/1367545782.db2.gz	NKJAFAPUOWXUTM-OWSLCNJRSA-N	0	3	334.504	3.127	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCc1cccc(OCC)c1)C2	ZINC001110174039	1367545903	/nfs/dbraw/zinc/54/59/03/1367545903.db2.gz	JSUGZZXUEMPPLJ-HOJAQTOUSA-N	0	3	342.483	3.316	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](CCC)CC(C)C)C2	ZINC001110176148	1367547320	/nfs/dbraw/zinc/54/73/20/1367547320.db2.gz	LELYTOOZSJZGOI-YRXWBPOGSA-N	0	3	336.520	3.373	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](N(C)CCOc2ccccc2)C1	ZINC001191694073	1367561847	/nfs/dbraw/zinc/56/18/47/1367561847.db2.gz	ABPSQFAFQZTBLJ-QGZVFWFLSA-N	0	3	330.472	3.200	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1C[C@H]2C[C@@H](C1)N(C(=O)CCC(F)F)C2	ZINC001108730510	1367562598	/nfs/dbraw/zinc/56/25/98/1367562598.db2.gz	QFRUSHQFBPDKHZ-XKQJLSEDSA-N	0	3	347.409	3.073	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](C)Cc1cccc(Cl)c1)C2	ZINC001110207522	1367563939	/nfs/dbraw/zinc/56/39/39/1367563939.db2.gz	FJQIXYPZSRRGPL-OAOYMFHYSA-N	0	3	344.886	3.263	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](N(C)CCOc2ccccc2)C1	ZINC001191765065	1367581204	/nfs/dbraw/zinc/58/12/04/1367581204.db2.gz	YEULBOVUIFQMAG-IBGZPJMESA-N	0	3	342.483	3.182	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)C[C@H]1CCc2cc(F)ccc2C1	ZINC001186165980	1387887868	/nfs/dbraw/zinc/88/78/68/1387887868.db2.gz	QWLWWMRADGPYCY-KXBFYZLASA-N	0	3	330.447	3.087	20	30		EGEDHN
Cc1ccccc1[C@H](C)N1[C@@H]2CC[C@H]1[C@H](NC(=O)CSCC#N)C2	ZINC001110305041	1367626519	/nfs/dbraw/zinc/62/65/19/1367626519.db2.gz	AZAPPSMVCDFOEA-IDCNUPLLSA-N	0	3	343.496	3.034	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H](N(C)CCOCc2ccccc2)C1	ZINC001192162493	1367705533	/nfs/dbraw/zinc/70/55/33/1367705533.db2.gz	PDMFNXROYYDUJJ-PZJWPPBQSA-N	0	3	344.499	3.338	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](N(C)CCOCC3CCC3)C2)CC1	ZINC001192207211	1367718727	/nfs/dbraw/zinc/71/87/27/1367718727.db2.gz	VNGYGZCXIORERL-GOSISDBHSA-N	0	3	334.504	3.082	20	30		EGEDHN
C[C@@H](C#N)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccc2ccccc2c1	ZINC001109089208	1367761500	/nfs/dbraw/zinc/76/15/00/1367761500.db2.gz	ZLVCTHIQAQBIPQ-WBCYEJBOSA-N	0	3	333.435	3.221	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)[C@@H](c2ccccc2)C(C)C)C1	ZINC001192560644	1367816551	/nfs/dbraw/zinc/81/65/51/1367816551.db2.gz	RRECQFMVFITLDT-WOJBJXKFSA-N	0	3	344.499	3.162	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CC[C@H]1CCCC1(F)F	ZINC001110537988	1367817454	/nfs/dbraw/zinc/81/74/54/1367817454.db2.gz	INPDUZFSKTVCEO-VQHPVUNQSA-N	0	3	338.442	3.193	20	30		EGEDHN
C[C@@H](c1ccc2c(c1)CCC2)N1[C@@H]2CC[C@H]1[C@H](NC(=O)C#CC1CC1)C2	ZINC001110540259	1367820027	/nfs/dbraw/zinc/82/00/27/1367820027.db2.gz	KRBQRQACBRCIBK-RGXPITOMSA-N	0	3	348.490	3.371	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](N(C)Cc2ccccc2N(C)C)C1	ZINC001192586874	1367827032	/nfs/dbraw/zinc/82/70/32/1367827032.db2.gz	WLXYRPLKXJWDQO-GOSISDBHSA-N	0	3	343.515	3.388	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1sc(Cl)nc1C)C2	ZINC001110602080	1367864276	/nfs/dbraw/zinc/86/42/76/1367864276.db2.gz	AKLLMJHLHSFRCK-UPJWGTAASA-N	0	3	339.892	3.406	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C1(CC)CCC(F)(F)CC1)C2	ZINC001110734547	1367953368	/nfs/dbraw/zinc/95/33/68/1367953368.db2.gz	UNPDTVBSDQOQQW-OAGGEKHMSA-N	0	3	338.442	3.337	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCc1ccc(OCC)cc1)C2	ZINC001110759967	1367966093	/nfs/dbraw/zinc/96/60/93/1367966093.db2.gz	WJRHNMZKWKLSIV-RLLQIKCJSA-N	0	3	342.483	3.316	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1scnc1C(F)F)C2	ZINC001110797753	1367996185	/nfs/dbraw/zinc/99/61/85/1367996185.db2.gz	JOSRCLWNTPQSFK-UTUOFQBUSA-N	0	3	341.427	3.382	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCc1ccc(C)c(Cl)c1)C2	ZINC001110872305	1368049765	/nfs/dbraw/zinc/04/97/65/1368049765.db2.gz	TVHNOFWDLNZWFV-QRQLOZEOSA-N	0	3	344.886	3.326	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc([C@H](C)CC)no1)C2	ZINC001111117416	1368161975	/nfs/dbraw/zinc/16/19/75/1368161975.db2.gz	UXDCRQROICKYJR-SRABZTEZSA-N	0	3	331.460	3.489	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](N(C)CCOC3CCC3)C2)CCCC1	ZINC001194555235	1368285204	/nfs/dbraw/zinc/28/52/04/1368285204.db2.gz	KJDYXQCQHRDKTH-QGZVFWFLSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](N(C)CCOCC3CC3)C2)CCCC1	ZINC001194568536	1368288580	/nfs/dbraw/zinc/28/85/80/1368288580.db2.gz	SXVJFUFHEIEMHQ-SFHVURJKSA-N	0	3	334.504	3.082	20	30		EGEDHN
CCCCCCCC[C@H](C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCCO	ZINC001111435619	1368306753	/nfs/dbraw/zinc/30/67/53/1368306753.db2.gz	VTTVEBXJBBZGNI-MANSERQUSA-N	0	3	338.536	3.477	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCc1cc(C)sc1C)C2	ZINC001111479452	1368316701	/nfs/dbraw/zinc/31/67/01/1368316701.db2.gz	WVGDIJWVUUGJEN-KURKYZTESA-N	0	3	330.497	3.042	20	30		EGEDHN
CN(C)c1ccncc1NC(=O)c1ccc(C#CBr)cc1	ZINC001194796882	1368326306	/nfs/dbraw/zinc/32/63/06/1368326306.db2.gz	AXMJVLLACHREEV-UHFFFAOYSA-N	0	3	344.212	3.104	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1(CC(C)C)CCC1)C[C@@H](C)O2	ZINC001111545830	1368339013	/nfs/dbraw/zinc/33/90/13/1368339013.db2.gz	QGVQRQQSVABWHL-GOSISDBHSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@](C)(CC)CCC)C[C@@H](C)O2	ZINC001111551203	1368342714	/nfs/dbraw/zinc/34/27/14/1368342714.db2.gz	UGVVNRIGMYXUPX-MJGOQNOKSA-N	0	3	336.520	3.471	20	30		EGEDHN
C#CCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1csc(C)c1)C2	ZINC001111729363	1368432523	/nfs/dbraw/zinc/43/25/23/1368432523.db2.gz	LRBXEZCANKKJAG-HKUYNNGSSA-N	0	3	330.497	3.331	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@]12CCC[C@H]1CN(Cc1ccsc1)C2	ZINC001111742650	1368438981	/nfs/dbraw/zinc/43/89/81/1368438981.db2.gz	IEDJZQMECVCARA-LPHOPBHVSA-N	0	3	330.497	3.268	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H](C)OCc2ccccc2C)C1	ZINC001111823983	1368483888	/nfs/dbraw/zinc/48/38/88/1368483888.db2.gz	QYVLADPEEWOWBJ-LMNJBCLMSA-N	0	3	342.483	3.057	20	30		EGEDHN
CCc1ccccc1CCN1CCCN(C(=O)C#CC(C)(C)C)CC1	ZINC001195785265	1368489248	/nfs/dbraw/zinc/48/92/48/1368489248.db2.gz	IQKNKAKHUSIXJH-UHFFFAOYSA-N	0	3	340.511	3.375	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@]12CCC[C@H]1CN(Cc1cnccc1C)C2	ZINC001111848586	1368502546	/nfs/dbraw/zinc/50/25/46/1368502546.db2.gz	LYIMALONZGHPIH-LMNJBCLMSA-N	0	3	341.499	3.463	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@]12CCC[C@H]1CN(Cc1cncc(C)c1)C2	ZINC001111850787	1368505046	/nfs/dbraw/zinc/50/50/46/1368505046.db2.gz	SITHGNPZMXJLKN-LMNJBCLMSA-N	0	3	341.499	3.463	20	30		EGEDHN
C=CCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1c(C)onc1CC)C2	ZINC001111855856	1368508419	/nfs/dbraw/zinc/50/84/19/1368508419.db2.gz	PHQLAZOLBQWULS-JXFKEZNVSA-N	0	3	345.487	3.372	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CCCN(CCCCCF)CC1)OCC	ZINC001196025447	1368538419	/nfs/dbraw/zinc/53/84/19/1368538419.db2.gz	QHODJFXYSOQZIF-KRWDZBQOSA-N	0	3	328.472	3.032	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cncc(COC)c2)CC1	ZINC001196184977	1368564858	/nfs/dbraw/zinc/56/48/58/1368564858.db2.gz	IXRWFTOLNFBTJX-UHFFFAOYSA-N	0	3	347.503	3.346	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)CC(C)(C)CC(F)(F)F)C1	ZINC001111958153	1368574146	/nfs/dbraw/zinc/57/41/46/1368574146.db2.gz	FSRJRTUXHVOXCH-YOEHRIQHSA-N	0	3	344.421	3.349	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2cc(C)n([C@@H](C)C3CC3)n2)CC1	ZINC001196383099	1368603251	/nfs/dbraw/zinc/60/32/51/1368603251.db2.gz	ZBYHSGKRAXRZTC-KRWDZBQOSA-N	0	3	344.503	3.277	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCCN(CCc2ccc(OC)cc2)CC1	ZINC001196895857	1368709250	/nfs/dbraw/zinc/70/92/50/1368709250.db2.gz	RYHCJELDDKVMGL-SFHVURJKSA-N	0	3	344.499	3.374	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)CCC2CCCCC2)C[C@H]1C(F)(F)F	ZINC001112201713	1368710756	/nfs/dbraw/zinc/71/07/56/1368710756.db2.gz	LHUISCUQFBOSCH-HZPDHXFCSA-N	0	3	344.421	3.349	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2occc2CN(C)C)CC1	ZINC001196935819	1368716356	/nfs/dbraw/zinc/71/63/56/1368716356.db2.gz	ZEKHHPSNLPUKLN-UHFFFAOYSA-N	0	3	349.519	3.460	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H]2CCC[C@]2(CNCc2ncc(C)s2)C1	ZINC001112282029	1368747285	/nfs/dbraw/zinc/74/72/85/1368747285.db2.gz	FPAARGKPIJXLRP-YJBOKZPZSA-N	0	3	333.501	3.136	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cc(C(C)C)nn2C)CC1	ZINC001197659347	1368866212	/nfs/dbraw/zinc/86/62/12/1368866212.db2.gz	MUGGCAIGYRQQAM-UHFFFAOYSA-N	0	3	346.519	3.438	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)C[C@H](C)C(C)(C)C)C1	ZINC001198161881	1368970412	/nfs/dbraw/zinc/97/04/12/1368970412.db2.gz	RBAQRMVPBAWYPB-GVDBMIGSSA-N	0	3	326.525	3.190	20	30		EGEDHN
C=CCOCCCC(=O)N1CCN(CC2CCC(C)(C)CC2)CC1	ZINC001112755285	1368989972	/nfs/dbraw/zinc/98/99/72/1368989972.db2.gz	BVXKIPSDMLMAON-UHFFFAOYSA-N	0	3	336.520	3.330	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)c1cc(C)on1)c1ccccc1OC	ZINC001198515774	1369050674	/nfs/dbraw/zinc/05/06/74/1369050674.db2.gz	QPXKOIVXOGDQPK-KRWDZBQOSA-N	0	3	343.427	3.019	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)CCCc2csc(C)n2)CC1	ZINC001112858476	1369051676	/nfs/dbraw/zinc/05/16/76/1369051676.db2.gz	FXXVDAPBROQWIU-HNNXBMFYSA-N	0	3	335.517	3.273	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)c1cc(C)no1)c1ccccc1OC	ZINC001198522349	1369052297	/nfs/dbraw/zinc/05/22/97/1369052297.db2.gz	KCPZDELAFDBLOF-INIZCTEOSA-N	0	3	343.427	3.019	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)/C=C(/C)C1CC1)c1ccccc1OC	ZINC001198578006	1369065545	/nfs/dbraw/zinc/06/55/45/1369065545.db2.gz	MOCQXQAVBXGKLS-OJSRQPNCSA-N	0	3	328.456	3.375	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@H](C)OCCCC)c1ccccc1OC	ZINC001198595392	1369069334	/nfs/dbraw/zinc/06/93/34/1369069334.db2.gz	LESVDBUIWKGBFT-FUHWJXTLSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)Cc1ccoc1)c1ccccc1OC	ZINC001198685709	1369091274	/nfs/dbraw/zinc/09/12/74/1369091274.db2.gz	DEEGASYVGITNHP-GOSISDBHSA-N	0	3	342.439	3.244	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)CCc2cccc(OC)c2F)CC1	ZINC001112929905	1369094384	/nfs/dbraw/zinc/09/43/84/1369094384.db2.gz	UBCZOTGJZQPYGU-INIZCTEOSA-N	0	3	348.462	3.266	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@@H](C)CC(F)F)c1ccccc1OC	ZINC001198797535	1369118217	/nfs/dbraw/zinc/11/82/17/1369118217.db2.gz	VMGWOBQVWLLBGI-DZGCQCFKSA-N	0	3	340.414	3.310	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NC[C@H](NCCC)c1ccccc1OC	ZINC001198819878	1369121938	/nfs/dbraw/zinc/12/19/38/1369121938.db2.gz	XHPWGSINJJDRER-PXNSSMCTSA-N	0	3	348.487	3.081	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H](NCC2CC2)c2ccccc2OC)cc1	ZINC001198825649	1369122557	/nfs/dbraw/zinc/12/25/57/1369122557.db2.gz	DTDHUIXRJRHAAL-FQEVSTJZSA-N	0	3	348.446	3.147	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H](NCC[C@@H](C)F)c1ccccc1OC	ZINC001198835048	1369125752	/nfs/dbraw/zinc/12/57/52/1369125752.db2.gz	QVBWEFYYBWYSPH-GDBMZVCRSA-N	0	3	336.451	3.402	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)CCCC#CC)c1ccccc1OC	ZINC001198857250	1369131693	/nfs/dbraw/zinc/13/16/93/1369131693.db2.gz	NWEZLPDNXQYVRH-GOSISDBHSA-N	0	3	328.456	3.212	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)C[C@H](C)c2c(C)n[nH]c2C)CC1	ZINC001113032984	1369153250	/nfs/dbraw/zinc/15/32/50/1369153250.db2.gz	TVLWGAZRSRQWBH-LSDHHAIUSA-N	0	3	332.492	3.019	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@@H](C)c2ccccc2C)C1	ZINC001198940572	1369153521	/nfs/dbraw/zinc/15/35/21/1369153521.db2.gz	PZKFACXZLPXRMC-DFQSSKMNSA-N	0	3	346.515	3.230	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@@H](C)CCCOC)c1ccccc1OC	ZINC001198961328	1369159238	/nfs/dbraw/zinc/15/92/38/1369159238.db2.gz	VMJRDHJZCIZNNP-FUHWJXTLSA-N	0	3	348.487	3.081	20	30		EGEDHN
CCCCCCCN1CCN(C(=O)c2ccc3cncn3c2)CC1	ZINC001113104497	1369203143	/nfs/dbraw/zinc/20/31/43/1369203143.db2.gz	DCNRXIAIRMSAES-UHFFFAOYSA-N	0	3	328.460	3.063	20	30		EGEDHN
CCCCCCCCCCNC(=S)N1CCOC[C@H]1CN(C)C	ZINC001200213111	1369329566	/nfs/dbraw/zinc/32/95/66/1369329566.db2.gz	UDQCMWUROJTSRF-QGZVFWFLSA-N	0	3	343.581	3.264	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC(NCc2csnc2OC)CC1	ZINC001200747665	1369422447	/nfs/dbraw/zinc/42/24/47/1369422447.db2.gz	LVEXPUCOYUDUMR-UHFFFAOYSA-N	0	3	349.500	3.001	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC(NCc2ccn(C(C)C)n2)CC1	ZINC001200794976	1369430244	/nfs/dbraw/zinc/43/02/44/1369430244.db2.gz	STRPDVGGOSEZLZ-UHFFFAOYSA-N	0	3	332.492	3.147	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC(N[C@@H](C)c2cnc(C)cn2)CC1	ZINC001200794188	1369430529	/nfs/dbraw/zinc/43/05/29/1369430529.db2.gz	BLYVAXZMJMUNTN-HNNXBMFYSA-N	0	3	330.476	3.029	20	30		EGEDHN
C#CCCCCCC(=O)N1CCCO[C@H](CNCc2ccsc2)C1	ZINC001201162903	1369487930	/nfs/dbraw/zinc/48/79/30/1369487930.db2.gz	RIFUZXIVPVDHDS-GOSISDBHSA-N	0	3	348.512	3.039	20	30		EGEDHN
CCCCCCCCCN1C[C@@H]2[C@H](C1)OCCN2c1ncccn1	ZINC001201839064	1369632710	/nfs/dbraw/zinc/63/27/10/1369632710.db2.gz	IORAMZXNVAKMJG-MSOLQXFVSA-N	0	3	332.492	3.117	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)N1CCC(NCc2oc(CCC)nc2C)CC1	ZINC001202084425	1369683798	/nfs/dbraw/zinc/68/37/98/1369683798.db2.gz	CGZXFTLINBNNCZ-LSDHHAIUSA-N	0	3	347.503	3.474	20	30		EGEDHN
CC#CCCCC(=O)N1CCC(NCc2nc(C)sc2C)CC1	ZINC001202101091	1369687145	/nfs/dbraw/zinc/68/71/45/1369687145.db2.gz	ICMBNGOLVUKQBY-UHFFFAOYSA-N	0	3	333.501	3.034	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC(NCC(=C)Br)CC1	ZINC001202108207	1369688597	/nfs/dbraw/zinc/68/85/97/1369688597.db2.gz	IIPXJBAEKKMVAA-GFCCVEGCSA-N	0	3	329.282	3.078	20	30		EGEDHN
C=CCC1(C(=O)N2CCCO[C@@H](CNC/C=C\Cl)C2)CCCC1	ZINC001202250852	1369723012	/nfs/dbraw/zinc/72/30/12/1369723012.db2.gz	MFTCVVMUQJNVMN-AVFOEOQDSA-N	0	3	340.895	3.083	20	30		EGEDHN
O=C(N[C@@H]1C[C@@H](NCC#Cc2ccccc2Cl)C12CCC2)C1CC1	ZINC001202282271	1369729237	/nfs/dbraw/zinc/72/92/37/1369729237.db2.gz	ZVPLXOCGAYEHCV-QZTJIDSGSA-N	0	3	342.870	3.119	20	30		EGEDHN
CC(C)=CC(=O)N[C@@H]1C[C@H](NCc2cc(C#N)ccc2F)C12CCC2	ZINC001202384018	1369756544	/nfs/dbraw/zinc/75/65/44/1369756544.db2.gz	PPQOTWNNVTZZFV-ZWKOTPCHSA-N	0	3	341.430	3.181	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@H](NC(=O)CCCC)C12CCC2	ZINC001202489474	1369788924	/nfs/dbraw/zinc/78/89/24/1369788924.db2.gz	LBMDSBPPDRVJAC-OLZOCXBDSA-N	0	3	329.282	3.102	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@@H](NCc2cccc(F)c2F)C12CCC2	ZINC001202597729	1369818717	/nfs/dbraw/zinc/81/87/17/1369818717.db2.gz	ATYRPTNIVQZUAK-CVEARBPZSA-N	0	3	334.410	3.448	20	30		EGEDHN
C=CCOCC(=O)N[C@@H]1C[C@@H](NCc2ccccc2Cl)C12CCC2	ZINC001202633689	1369832120	/nfs/dbraw/zinc/83/21/20/1369832120.db2.gz	PCBWVAOXIIVRIU-IAGOWNOFSA-N	0	3	348.874	3.060	20	30		EGEDHN
CCCC[C@H](CNc1cccc(F)c1C#N)NC(=O)CN(CC)CC	ZINC001114261178	1369835049	/nfs/dbraw/zinc/83/50/49/1369835049.db2.gz	ABIQJPFTMKILCF-OAHLLOKOSA-N	0	3	348.466	3.126	20	30		EGEDHN
C/C=C(/C)C(=O)N[C@@H]1C[C@H](NCc2cc(C#N)ccc2F)C12CCC2	ZINC001202725580	1369867512	/nfs/dbraw/zinc/86/75/12/1369867512.db2.gz	OEMIDSQLDCXUCX-ZAYZHACPSA-N	0	3	341.430	3.181	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@H](NC(=O)C(F)=C(C)C)C12CCC2	ZINC001202735275	1369873053	/nfs/dbraw/zinc/87/30/53/1369873053.db2.gz	LZFIVZIAVXEEMS-NEPJUHHUSA-N	0	3	345.256	3.175	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1[C@H]2CN(Cc3cccc(OC)c3)C[C@H]21	ZINC001114326514	1369886630	/nfs/dbraw/zinc/88/66/30/1369886630.db2.gz	TZQDYTYAJMEICE-PMOLBWCYSA-N	0	3	340.467	3.010	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1C[C@@H](NCc2cccc(F)c2F)C12CCC2	ZINC001202844979	1369906053	/nfs/dbraw/zinc/90/60/53/1369906053.db2.gz	AULLEUBSUPBHQC-SJORKVTESA-N	0	3	346.421	3.285	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@H]1C[C@@H](NCc2ccccc2F)C12CCC2	ZINC001202920782	1369927257	/nfs/dbraw/zinc/92/72/57/1369927257.db2.gz	PAUQRUCAKAMRIF-MSOLQXFVSA-N	0	3	342.458	3.392	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1[C@H]2CN(CCOC3CCCCCC3)C[C@H]21	ZINC001114679978	1370021640	/nfs/dbraw/zinc/02/16/40/1370021640.db2.gz	CTZLFDQMPUTHSE-BWTSREIZSA-N	0	3	348.531	3.375	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1[C@H]2CN(CC[C@H]3CC3(Cl)Cl)C[C@H]21	ZINC001114680254	1370021901	/nfs/dbraw/zinc/02/19/01/1370021901.db2.gz	GBBHVOSPWDSDDX-IGQOVBAYSA-N	0	3	345.314	3.219	20	30		EGEDHN
CC1(CC(=O)N[C@@H]2C[C@H](NCC#Cc3ccccc3)C23CCC3)CC1	ZINC001203214704	1370028178	/nfs/dbraw/zinc/02/81/78/1370028178.db2.gz	XUUQKBPBQBDUKL-RBUKOAKNSA-N	0	3	336.479	3.245	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1[C@H]2CN(Cc3ccc(F)cc3C)C[C@H]21	ZINC001114692785	1370029649	/nfs/dbraw/zinc/02/96/49/1370029649.db2.gz	OQDVGTCRRDTBDB-KXTWHKPSSA-N	0	3	342.458	3.264	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1C[C@@H](NCc2ncccc2C)C12CCC2	ZINC001203273514	1370054281	/nfs/dbraw/zinc/05/42/81/1370054281.db2.gz	IWJNUXKIHCYAEP-IAGOWNOFSA-N	0	3	327.472	3.119	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1C[C@@H](NCc2ccns2)C12CCC2	ZINC001203295571	1370067455	/nfs/dbraw/zinc/06/74/55/1370067455.db2.gz	LXBITSOWULXZNM-IAGOWNOFSA-N	0	3	345.512	3.244	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1C[C@@H](NCc2cnoc2C)C12CCC2	ZINC001203295822	1370068155	/nfs/dbraw/zinc/06/81/55/1370068155.db2.gz	NGQOYOONTXUDLO-QZTJIDSGSA-N	0	3	343.471	3.084	20	30		EGEDHN
CN1CCN(Cc2ccc(NC=Cc3ccc(C#N)cc3)cc2)CC1	ZINC001203305693	1370073590	/nfs/dbraw/zinc/07/35/90/1370073590.db2.gz	NWIYMAONNQBIJY-ZHACJKMWSA-N	0	3	332.451	3.388	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1[C@H]2CN(Cc3cccc(OC)c3C)C[C@H]21	ZINC001114792063	1370083509	/nfs/dbraw/zinc/08/35/09/1370083509.db2.gz	NWAJMGZSPSOXCM-DIJFTKHXSA-N	0	3	342.483	3.152	20	30		EGEDHN
CCC(C)(C)C(=O)N[C@@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001203331891	1370085946	/nfs/dbraw/zinc/08/59/46/1370085946.db2.gz	JBQPQGWWROWXSL-RTBURBONSA-N	0	3	338.495	3.491	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1C[C@@H](NCc2conc2CC)C12CCC2	ZINC001203341623	1370089864	/nfs/dbraw/zinc/08/98/64/1370089864.db2.gz	RZQAIMAZXYJESG-IAGOWNOFSA-N	0	3	331.460	3.110	20	30		EGEDHN
CC(F)(F)CC(=O)N[C@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001203372097	1370102615	/nfs/dbraw/zinc/10/26/15/1370102615.db2.gz	CJQJVGRIKQZWHQ-SJORKVTESA-N	0	3	346.421	3.100	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H]2C[C@@H](NCc3ccccn3)C23CCC3)CC1	ZINC001203375909	1370104957	/nfs/dbraw/zinc/10/49/57/1370104957.db2.gz	SCOFJXAAONFHRH-MSOLQXFVSA-N	0	3	339.483	3.345	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1C[C@@H](NCc2c(C)noc2C)C12CCC2	ZINC001203451112	1370131320	/nfs/dbraw/zinc/13/13/20/1370131320.db2.gz	IGGRFJSUZFZBQA-IAGOWNOFSA-N	0	3	345.487	3.411	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)CCCc2ccccn2)C12CCC2	ZINC001203640232	1370196823	/nfs/dbraw/zinc/19/68/23/1370196823.db2.gz	ALENZHYAXIMEHL-DLBZAZTESA-N	0	3	347.890	3.174	20	30		EGEDHN
N#Cc1cccc(N2C[C@@]3(CCN(Cc4cccc(F)c4)C3)CC2=O)c1	ZINC001203786707	1370264396	/nfs/dbraw/zinc/26/43/96/1370264396.db2.gz	OBKRBFBJCJAZDN-NRFANRHFSA-N	0	3	349.409	3.326	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3ccnc4ccccc34)C2)C1=O	ZINC001204083353	1370371353	/nfs/dbraw/zinc/37/13/53/1370371353.db2.gz	ODUQLNAIHJEOHO-NRFANRHFSA-N	0	3	335.451	3.235	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2[C@H]3CN(Cc4cccnc4C)C[C@H]32)CCCC1	ZINC001115365456	1370410633	/nfs/dbraw/zinc/41/06/33/1370410633.db2.gz	XYTZNLFYPIYHBN-BWTSREIZSA-N	0	3	339.483	3.073	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)[C@@H](C)SC)CCCCC1	ZINC001115419495	1370444311	/nfs/dbraw/zinc/44/43/11/1370444311.db2.gz	USGAWVTVQALFQB-GFCCVEGCSA-N	0	3	349.338	3.055	20	30		EGEDHN
CC(C)(C)C#CC(=O)NCC1(NCc2ccc(F)cn2)CCCCC1	ZINC001115528363	1370527220	/nfs/dbraw/zinc/52/72/20/1370527220.db2.gz	LWRAGERFJCBOTD-UHFFFAOYSA-N	0	3	345.462	3.179	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cnc3ccccn23)CCCCC1	ZINC001115608413	1370606887	/nfs/dbraw/zinc/60/68/87/1370606887.db2.gz	LWENJILMKLAPNL-UHFFFAOYSA-N	0	3	346.862	3.109	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2c[nH]nc2CCC)CCCCC1	ZINC001115611362	1370610261	/nfs/dbraw/zinc/61/02/61/1370610261.db2.gz	DWNYDSAGITZDRL-UHFFFAOYSA-N	0	3	338.883	3.137	20	30		EGEDHN
C#CCCCCC(=O)N1CCC(CNCc2ccncc2Cl)CC1	ZINC001205026844	1370632874	/nfs/dbraw/zinc/63/28/74/1370632874.db2.gz	DSJFHGLNQVENJN-UHFFFAOYSA-N	0	3	347.890	3.257	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N(Cc1ccccc1)[C@@H]1CN(CCC)C[C@H]1O	ZINC001205175101	1370670423	/nfs/dbraw/zinc/67/04/23/1370670423.db2.gz	KQAAMSXOUILCMV-MISYRCLQSA-N	0	3	344.499	3.073	20	30		EGEDHN
CC/C(C)=C\C(=O)N1CCC(CNCc2cc(F)ccc2C#N)CC1	ZINC001205195831	1370675629	/nfs/dbraw/zinc/67/56/29/1370675629.db2.gz	FQRIAFWRLBUNCM-GDNBJRDFSA-N	0	3	343.446	3.382	20	30		EGEDHN
C=CCCCC(=O)NCC1(NCc2n[nH]c(C(C)C)n2)CCCCC1	ZINC001115701561	1370682336	/nfs/dbraw/zinc/68/23/36/1370682336.db2.gz	UVLMEKZJNLLQGZ-UHFFFAOYSA-N	0	3	347.507	3.193	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)C[C@H]2CC[C@@H](C)O2)CCCCC1	ZINC001115709927	1370689184	/nfs/dbraw/zinc/68/91/84/1370689184.db2.gz	WALDWGDIBWOWKD-HUUCEWRRSA-N	0	3	328.884	3.105	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](c2ccc(F)cc2)[C@H](NCC#CC)C1	ZINC001205263408	1370699333	/nfs/dbraw/zinc/69/93/33/1370699333.db2.gz	ULVCSADZZTWPBX-RBUKOAKNSA-N	0	3	328.431	3.089	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC(CNCc2oc(C)nc2C)CC1	ZINC001205384499	1370738350	/nfs/dbraw/zinc/73/83/50/1370738350.db2.gz	WFZOKBMTVCRSML-UHFFFAOYSA-N	0	3	345.487	3.388	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C2(CC(C)C)CC2)C[C@H]1c1cccc(F)c1	ZINC001205414914	1370748526	/nfs/dbraw/zinc/74/85/26/1370748526.db2.gz	ALFOFIFBOOJIBO-RBUKOAKNSA-N	0	3	342.458	3.169	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C2(C)CC=CC2)C[C@H]1c1cccc(F)c1	ZINC001205432346	1370753397	/nfs/dbraw/zinc/75/33/97/1370753397.db2.gz	MAZDTMHWBVSABR-RBUKOAKNSA-N	0	3	340.442	3.089	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N[C@@H]1CN(Cc2cccc(CC)c2)C[C@H]1C	ZINC001206485116	1371069083	/nfs/dbraw/zinc/06/90/83/1371069083.db2.gz	DHIWKUQPQCXLOY-FUHIMQAGSA-N	0	3	344.499	3.167	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CN([C@@H]2CCCc3ccc(F)cc32)C[C@H]1C	ZINC001206912549	1371221678	/nfs/dbraw/zinc/22/16/78/1371221678.db2.gz	QYVWIIQDFLSVSE-CDHQVMDDSA-N	0	3	342.458	3.443	20	30		EGEDHN
O=C(C1CCCC1)N1CCC[C@@H](NCC#Cc2ccccc2Cl)C1	ZINC001207022917	1371270543	/nfs/dbraw/zinc/27/05/43/1371270543.db2.gz	YJBLAJDPMRRXSN-GOSISDBHSA-N	0	3	344.886	3.462	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207117391	1371298147	/nfs/dbraw/zinc/29/81/47/1371298147.db2.gz	VCJJSVOCRFZSJV-SFHVURJKSA-N	0	3	332.875	3.318	20	30		EGEDHN
CCCCCC(=O)N1CCC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001207344869	1371366400	/nfs/dbraw/zinc/36/64/00/1371366400.db2.gz	ZZHZBQBIGOUSLK-KRWDZBQOSA-N	0	3	331.435	3.358	20	30		EGEDHN
CC/C=C(\C)C(=O)N1CCC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001207567369	1371438388	/nfs/dbraw/zinc/43/83/88/1371438388.db2.gz	ZHIVFNYCFQVGEC-ANQFXYINSA-N	0	3	329.419	3.134	20	30		EGEDHN
CC(C)[C@H](C)CC(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001207645978	1371462867	/nfs/dbraw/zinc/46/28/67/1371462867.db2.gz	QIVPGZCZIHSYLO-QUCCMNQESA-N	0	3	326.484	3.301	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H](N[C@@H]2CCc3c2c(F)ccc3F)C1	ZINC001207654690	1371465536	/nfs/dbraw/zinc/46/55/36/1371465536.db2.gz	TVZFTPSPFHONIJ-CXAGYDPISA-N	0	3	334.410	3.499	20	30		EGEDHN
CC(C)(C)/C=C\C(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207710830	1371481404	/nfs/dbraw/zinc/48/14/04/1371481404.db2.gz	SHEMPHAOVJMBEJ-HSNDNRACSA-N	0	3	342.458	3.360	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC(CCN2CCc3cc(C#N)ccc3C2)C1	ZINC001207760353	1371496943	/nfs/dbraw/zinc/49/69/43/1371496943.db2.gz	WKZARYAOXYFMGH-UHFFFAOYSA-N	0	3	341.455	3.173	20	30		EGEDHN
CC1(CN(Cc2ccc(C#N)cc2)Cc2ccc(C#N)cc2)COC1	ZINC001207800181	1371507897	/nfs/dbraw/zinc/50/78/97/1371507897.db2.gz	MGMFKHGBKXNDLH-UHFFFAOYSA-N	0	3	331.419	3.469	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N1CCC[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207819278	1371512769	/nfs/dbraw/zinc/51/27/69/1371512769.db2.gz	HPPBTDJPFAYEAS-ROUUACIJSA-N	0	3	344.886	3.318	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)COc2ccc(C(C)C)cc2)C1	ZINC001207886597	1371530374	/nfs/dbraw/zinc/53/03/74/1371530374.db2.gz	RGIPJWBMWHHNJI-VQIMIIECSA-N	0	3	330.472	3.201	20	30		EGEDHN
CC[C@@H](CC(F)F)C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001208321925	1371717209	/nfs/dbraw/zinc/71/72/09/1371717209.db2.gz	NWJYANQYLBIWCI-ZWKOTPCHSA-N	0	3	348.437	3.300	20	30		EGEDHN
C=CCCC(=O)NC1CC2(CC(NCc3c(F)cccc3F)C2)C1	ZINC001120787998	1371759161	/nfs/dbraw/zinc/75/91/61/1371759161.db2.gz	YZIMAGSGGKJKOZ-UHFFFAOYSA-N	0	3	334.410	3.448	20	30		EGEDHN
CCc1ccc(C(=O)N2CCC[C@H](NCC#Cc3ccccc3)C2)o1	ZINC001208430724	1371764511	/nfs/dbraw/zinc/76/45/11/1371764511.db2.gz	QAGRCUBZWQLZAO-SFHVURJKSA-N	0	3	336.435	3.088	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1CN(Cc2ccccc2N(C)C)C[C@H]1C	ZINC001208508831	1371792215	/nfs/dbraw/zinc/79/22/15/1371792215.db2.gz	JCYFSJSVBLQCIK-HGHGUNKESA-N	0	3	343.515	3.291	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N1CCC[C@H](NCC=C(Cl)Cl)C1	ZINC001208796866	1371899587	/nfs/dbraw/zinc/89/95/87/1371899587.db2.gz	OCXHXRYCRRQUPE-XJKSGUPXSA-N	0	3	349.302	3.115	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)[C@@H](CC)CC(F)F)C2	ZINC001121233929	1371902904	/nfs/dbraw/zinc/90/29/04/1371902904.db2.gz	UCRPYHPZCUKGER-KWDKGFIESA-N	0	3	334.838	3.437	20	30		EGEDHN
N#Cc1ccc(CCCN2CCN(c3cc(Cl)ccn3)CC2)cc1	ZINC001208862650	1371922720	/nfs/dbraw/zinc/92/27/20/1371922720.db2.gz	MHMPYYWGVNLOKD-UHFFFAOYSA-N	0	3	340.858	3.361	20	30		EGEDHN
C[C@@H]1CC[C@H](NC(=O)OC(C)(C)C)CN1CCc1ccc(C#N)cc1	ZINC001208927661	1371948393	/nfs/dbraw/zinc/94/83/93/1371948393.db2.gz	NYGYRWFHKCDUKO-QAPCUYQASA-N	0	3	343.471	3.478	20	30		EGEDHN
C[C@@H]1CCN(CCc2ccc(C#N)cc2)C[C@@H]1NC(=O)OC(C)(C)C	ZINC001208930016	1371949511	/nfs/dbraw/zinc/94/95/11/1371949511.db2.gz	YIFOGRKZSLRWQW-QAPCUYQASA-N	0	3	343.471	3.336	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001208963694	1371964064	/nfs/dbraw/zinc/96/40/64/1371964064.db2.gz	VGAZIZQSBYEHOU-GOSISDBHSA-N	0	3	344.886	3.484	20	30		EGEDHN
C=CCN(CCN1CCC2(Cc3ccccc3O2)CC1)C(=O)OCC	ZINC001209020858	1371976996	/nfs/dbraw/zinc/97/69/96/1371976996.db2.gz	PHHWYTBOCFSWHQ-UHFFFAOYSA-N	0	3	344.455	3.101	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@H](NCc2cc(C)ccc2OC)C1	ZINC001209110669	1372001093	/nfs/dbraw/zinc/00/10/93/1372001093.db2.gz	DZPXYCMXKBKZJY-IBGZPJMESA-N	0	3	342.483	3.278	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC[C@@H](NCc2cn(C(C)C)nc2C)C1	ZINC001209184403	1372029543	/nfs/dbraw/zinc/02/95/43/1372029543.db2.gz	SFHLBBDBHFVLFD-IEBWSBKVSA-N	0	3	346.519	3.455	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)CC[C@@H](C)c2ccccc2)C1	ZINC001209197768	1372034968	/nfs/dbraw/zinc/03/49/68/1372034968.db2.gz	JUOMKHSGYVCVCJ-QWFCFKBJSA-N	0	3	344.499	3.209	20	30		EGEDHN
C#CCCCN1CCN(c2ccc(C(=O)OC(C)(C)C)cc2)CC1	ZINC001209267386	1372054642	/nfs/dbraw/zinc/05/46/42/1372054642.db2.gz	GKAFRPPOGUWTQK-UHFFFAOYSA-N	0	3	328.456	3.177	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)NCc1ccc(-c2csc(C)n2)cc1	ZINC001121858837	1372105039	/nfs/dbraw/zinc/10/50/39/1372105039.db2.gz	KZBGBRMGFMIAQZ-MRXNPFEDSA-N	0	3	329.469	3.418	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccc(C(=O)NCC(C)C)cc1C	ZINC001121862836	1372107169	/nfs/dbraw/zinc/10/71/69/1372107169.db2.gz	RMLFOIAVHYCMET-MRXNPFEDSA-N	0	3	331.460	3.003	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@@H](NCC#Cc3cccc(Cl)c3)C2)CC1	ZINC001209475709	1372116700	/nfs/dbraw/zinc/11/67/00/1372116700.db2.gz	QIUPPXLNTKLRRY-GOSISDBHSA-N	0	3	344.886	3.462	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc(OCc2ccccn2)c(F)c1	ZINC001122005194	1372151200	/nfs/dbraw/zinc/15/12/00/1372151200.db2.gz	GRJNFTBGTMHRDX-KRWDZBQOSA-N	0	3	343.402	3.422	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)c2cccc(C(C)(C)C)c2)C1	ZINC001209664061	1372164471	/nfs/dbraw/zinc/16/44/71/1372164471.db2.gz	KLXCWEISBVXTPJ-VQIMIIECSA-N	0	3	344.499	3.237	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@H](NCc2cnn(C(C)(C)C)c2)C1	ZINC001209873778	1372219471	/nfs/dbraw/zinc/21/94/71/1372219471.db2.gz	BNDXGQJSXGRBED-KRWDZBQOSA-N	0	3	346.519	3.321	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CCCN(C)C2)nnc1N1CC(C)(C)C[C@@H]1C	ZINC001122543601	1372271096	/nfs/dbraw/zinc/27/10/96/1372271096.db2.gz	LHKKOZPUUMBGPO-HOTGVXAUSA-N	0	3	331.508	3.288	20	30		EGEDHN
CCN1C[C@H](C)N(c2nnc(C(C)(C)CC#N)n2CC(C)C)C[C@@H]1C	ZINC001122782738	1372319967	/nfs/dbraw/zinc/31/99/67/1372319967.db2.gz	GJPYIRISYKRERW-HOTGVXAUSA-N	0	3	346.523	3.044	20	30		EGEDHN
CC1(CCC(=O)N2CCC[C@@H](NCc3ccc(C#N)s3)C2)CC1	ZINC001210464965	1372360295	/nfs/dbraw/zinc/36/02/95/1372360295.db2.gz	QENGCENJQHYRCK-CQSZACIVSA-N	0	3	331.485	3.281	20	30		EGEDHN
CC1(CCC(=O)N2CCC[C@@H](NCc3ccc(F)c(C#N)c3)C2)CC1	ZINC001210465889	1372360351	/nfs/dbraw/zinc/36/03/51/1372360351.db2.gz	YVLYZCAHHNHDHA-QGZVFWFLSA-N	0	3	343.446	3.358	20	30		EGEDHN
C[C@H](CC(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1)n1cccc1	ZINC001210736018	1372416307	/nfs/dbraw/zinc/41/63/07/1372416307.db2.gz	HNEHWBVHXUMPMA-CTNGQTDRSA-N	0	3	349.478	3.072	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N2CCC[C@H](NC[C@H](F)CC)C2)cc1	ZINC001211321197	1372530625	/nfs/dbraw/zinc/53/06/25/1372530625.db2.gz	MLUZQLNPCVDEFY-MSOLQXFVSA-N	0	3	348.462	3.123	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2cscc2C)C[C@H]1c1ccccc1	ZINC001211567660	1372581654	/nfs/dbraw/zinc/58/16/54/1372581654.db2.gz	OFCUQJYNTYFOBW-PKOBYXMFSA-N	0	3	338.476	3.278	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@H]2[C@@H]3CCCC[C@@H]32)C[C@H]1c1ccccc1	ZINC001211565254	1372581677	/nfs/dbraw/zinc/58/16/77/1372581677.db2.gz	SOVGRSUHVKBSAP-QGLKVJOYSA-N	0	3	336.479	3.030	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C(CCC)CCC)C[C@H]1c1ccccc1	ZINC001211662219	1372598904	/nfs/dbraw/zinc/59/89/04/1372598904.db2.gz	VZGNCMVTGWIADS-VQTJNVASSA-N	0	3	326.484	3.420	20	30		EGEDHN
C=CC[C@H](C(=O)N1CC[C@@H](NCc2cncs2)C1)c1ccccc1	ZINC001188002163	1388209738	/nfs/dbraw/zinc/20/97/38/1388209738.db2.gz	OBRHAUAXIJQMBV-AEFFLSMTSA-N	0	3	341.480	3.194	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2cccc(F)c2)[C@H](OC)C1	ZINC001211784139	1372614483	/nfs/dbraw/zinc/61/44/83/1372614483.db2.gz	PCVZTNIBRQCXDX-QZTJIDSGSA-N	0	3	336.451	3.225	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2oc(C)cc2C)[C@H](OC)C1	ZINC001212087522	1372654989	/nfs/dbraw/zinc/65/49/89/1372654989.db2.gz	XFIFUKZTWRDIFR-IAGOWNOFSA-N	0	3	336.476	3.296	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CN(CCCCCCC)C[C@H]1OC	ZINC001212414686	1372702513	/nfs/dbraw/zinc/70/25/13/1372702513.db2.gz	RTQBZMRVEKXIMX-IEBWSBKVSA-N	0	3	347.503	3.074	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN([C@H](CC)c2ccccc2)C[C@H]1OC	ZINC001213269183	1372871463	/nfs/dbraw/zinc/87/14/63/1372871463.db2.gz	CRXUMLKVPJIUBU-KZNAEPCWSA-N	0	3	330.472	3.165	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN([C@@H](CC)c2ccccc2)C[C@H]1OC	ZINC001213269182	1372871804	/nfs/dbraw/zinc/87/18/04/1372871804.db2.gz	CRXUMLKVPJIUBU-FGTMMUONSA-N	0	3	330.472	3.165	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H]2CN(Cc3sc(C)nc3C)C[C@H]21	ZINC001188057136	1388229862	/nfs/dbraw/zinc/22/98/62/1388229862.db2.gz	OLVMNSGBKPSLNE-JKSUJKDBSA-N	0	3	347.528	3.395	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)[C@H](CC2CCCC2)C(C)C)[C@H](OC)C1	ZINC001213524411	1372918614	/nfs/dbraw/zinc/91/86/14/1372918614.db2.gz	CWDHJLJFULKXSV-GUDVDZBRSA-N	0	3	336.520	3.230	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)[C@H](C)CC2CCCCC2)[C@H](OC)C1	ZINC001213524893	1372919120	/nfs/dbraw/zinc/91/91/20/1372919120.db2.gz	PQZCBWCOACHBEI-BHIYHBOVSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2csc(C)c2)[C@H](OC)C1	ZINC001213572311	1372928868	/nfs/dbraw/zinc/92/88/68/1372928868.db2.gz	RJALYFPZJIGQEF-IAGOWNOFSA-N	0	3	336.501	3.232	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)C(C)(C)Cc2ccccc2)[C@H](OC)C1	ZINC001213681368	1372944322	/nfs/dbraw/zinc/94/43/22/1372944322.db2.gz	IXZXVHHHJXZYKN-RTBURBONSA-N	0	3	344.499	3.037	20	30		EGEDHN
N#CC[C@H](C(=O)NC[C@@H]1CCCN1Cc1ccccc1)c1ccccc1	ZINC001126213447	1372949135	/nfs/dbraw/zinc/94/91/35/1372949135.db2.gz	BWAUOZHIDJVVSA-SFTDATJTSA-N	0	3	347.462	3.465	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2sccc2C2CC2)[C@H](OC)C1	ZINC001213815752	1372965390	/nfs/dbraw/zinc/96/53/90/1372965390.db2.gz	OCWCLTHFIUCGAE-HZPDHXFCSA-N	0	3	334.485	3.021	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccco2)C[C@H]1NCC#Cc1ccc(Cl)cc1	ZINC001214049843	1372999660	/nfs/dbraw/zinc/99/96/60/1372999660.db2.gz	WYNQFMYFKIXTDK-RHSMWYFYSA-N	0	3	342.826	3.035	20	30		EGEDHN
CC(C)CC(=O)N1C[C@@H](C)[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001214056494	1373001801	/nfs/dbraw/zinc/00/18/01/1373001801.db2.gz	MIRXNTKYDLBHHA-CRAIPNDOSA-N	0	3	332.875	3.174	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@H](NCc2cc(Cl)ccc2OC)C1	ZINC001214305553	1373041642	/nfs/dbraw/zinc/04/16/42/1373041642.db2.gz	GNVQCZBOQFQNDO-CZUORRHYSA-N	0	3	336.863	3.251	20	30		EGEDHN
O=C(C#CC1CC1)NCCN[C@@H]1CCc2c1cc(Cl)cc2Cl	ZINC001126875801	1373045093	/nfs/dbraw/zinc/04/50/93/1373045093.db2.gz	NUFDUMFYCSDMQD-MRXNPFEDSA-N	0	3	337.250	3.100	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cccc(C(F)F)c2F)cc1	ZINC001127519231	1373134113	/nfs/dbraw/zinc/13/41/13/1373134113.db2.gz	HWTJJKDQNVSSEU-UHFFFAOYSA-N	0	3	347.340	3.155	20	30		EGEDHN
C=CCCC1(C(=O)N2C[C@@H](C)[C@H](NCc3cc(C)ns3)C2)CC1	ZINC001215481840	1373207730	/nfs/dbraw/zinc/20/77/30/1373207730.db2.gz	AEGHFUVRJRGZNA-CZUORRHYSA-N	0	3	333.501	3.134	20	30		EGEDHN
C=C(C)CNCc1cccc(N2CC[C@@H](NC(=O)CCCCC)C2)n1	ZINC001128102372	1373218666	/nfs/dbraw/zinc/21/86/66/1373218666.db2.gz	QQPJHDQUTXQQPZ-GOSISDBHSA-N	0	3	344.503	3.023	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NCCNCc1ccc(Cl)c(F)c1)OCC	ZINC001128528269	1373283646	/nfs/dbraw/zinc/28/36/46/1373283646.db2.gz	KTEIREISPCWOJY-INIZCTEOSA-N	0	3	342.842	3.056	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NCCNCc1cc2ccccc2o1)OCC	ZINC001128528808	1373284133	/nfs/dbraw/zinc/28/41/33/1373284133.db2.gz	SEJOCWKUAFEJJB-GOSISDBHSA-N	0	3	330.428	3.010	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CCC=CCC2)C[C@H]1NCC#Cc1ccccc1	ZINC001216764765	1373340341	/nfs/dbraw/zinc/34/03/41/1373340341.db2.gz	KCTZSNYRFGHXPF-WIYYLYMNSA-N	0	3	336.479	3.221	20	30		EGEDHN
C[C@@H](CC(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(F)cc2)C1)C1CC1	ZINC001216855692	1373351403	/nfs/dbraw/zinc/35/14/03/1373351403.db2.gz	QYKLOPRLNGZFTR-RZQQEMMASA-N	0	3	342.458	3.050	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)C[C@@H](C)CC(C)(C)C)C1	ZINC001130426944	1373533475	/nfs/dbraw/zinc/53/34/75/1373533475.db2.gz	KLUSSJNZQADTEN-CVEARBPZSA-N	0	3	346.519	3.464	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)CC2CCCCCC2)C1	ZINC001130428552	1373534149	/nfs/dbraw/zinc/53/41/49/1373534149.db2.gz	ZFOPLOWHRAPTAE-QGZVFWFLSA-N	0	3	344.503	3.362	20	30		EGEDHN
Fc1ccc(/N=C/c2ccc(O[C@@H]3CC[C@@H]4NCCO[C@@H]34)cc2)cc1	ZINC001218126766	1373565415	/nfs/dbraw/zinc/56/54/15/1373565415.db2.gz	GJKJPFWCKVNKGT-DPTGNNJISA-N	0	3	340.398	3.475	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)[C@@H]3C[C@H]3C(C)(C)C)[C@H]2C1	ZINC001218282524	1373587924	/nfs/dbraw/zinc/58/79/24/1373587924.db2.gz	VMUIIZPBPXVNEB-AKHDSKFASA-N	0	3	348.531	3.327	20	30		EGEDHN
N#Cc1cccc(NC(=O)C[C@@H](N)c2ccc(Cl)cc2Cl)n1	ZINC001218588082	1373634453	/nfs/dbraw/zinc/63/44/53/1373634453.db2.gz	QEZPUFQCCZQCKW-CYBMUJFWSA-N	0	3	335.194	3.289	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2OCCN(C(=O)c3ccc(C=C)cc3)[C@H]2C1	ZINC001218665461	1373642188	/nfs/dbraw/zinc/64/21/88/1373642188.db2.gz	GGZNKZZWKYYVAH-LSTHTHJFSA-N	0	3	340.467	3.210	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)CCCCCC(C)C)[C@H]2C1	ZINC001218729796	1373648311	/nfs/dbraw/zinc/64/83/11/1373648311.db2.gz	IYUNGDMSFAUDQL-RBUKOAKNSA-N	0	3	336.520	3.471	20	30		EGEDHN
N#Cc1c(F)ccc(NC(=O)[C@@H]2C[C@@H](c3ccccc3)CCN2)c1F	ZINC001218914137	1373666297	/nfs/dbraw/zinc/66/62/97/1373666297.db2.gz	QVTQNKCEYJUOKT-GUYCJALGSA-N	0	3	341.361	3.311	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)Cc2cc3ccccc3s2)cc1	ZINC001131268851	1373672737	/nfs/dbraw/zinc/67/27/37/1373672737.db2.gz	ZDLYBBVIVYBXFZ-UHFFFAOYSA-N	0	3	349.459	3.221	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCO[C@H]1C1CCN(C(=O)/C=C(\C)CC)CC1	ZINC001131493697	1373710923	/nfs/dbraw/zinc/71/09/23/1373710923.db2.gz	NNOYTPCFZMARNN-AFRBYUIBSA-N	0	3	340.895	3.081	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1CN(CCC2CCCCCC2)C[C@@H]1O	ZINC001220293345	1373764282	/nfs/dbraw/zinc/76/42/82/1373764282.db2.gz	DINDVXLTGVLXQU-WSTZPKSXSA-N	0	3	336.520	3.111	20	30		EGEDHN
C=CCOCCN1CC[C@@H]2CN(C(=O)CCCCCCCC)[C@@H]2C1	ZINC001221974805	1373810694	/nfs/dbraw/zinc/81/06/94/1373810694.db2.gz	DLWRCYSBVBKHPN-RTBURBONSA-N	0	3	336.520	3.472	20	30		EGEDHN
Cc1cccc(C)c1CN1C[C@@H](NC(=O)CSCC#N)CC[C@@H]1C	ZINC001131825215	1373823367	/nfs/dbraw/zinc/82/33/67/1373823367.db2.gz	IFNCZZRKIVSLLN-IRXDYDNUSA-N	0	3	345.512	3.029	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H]2CCN(CCOc3cccc(F)c3)[C@H]2C1	ZINC001222398191	1373836273	/nfs/dbraw/zinc/83/62/73/1373836273.db2.gz	RKGCRWDLOCKLKU-APWZRJJASA-N	0	3	346.446	3.094	20	30		EGEDHN
C#CCCCCC(=O)NCC1CCN(Cc2ccc(C)nc2C)CC1	ZINC001222873433	1373904754	/nfs/dbraw/zinc/90/47/54/1373904754.db2.gz	XALXTJDXUSEBIG-UHFFFAOYSA-N	0	3	341.499	3.220	20	30		EGEDHN
Cc1ccc(F)cc1CN1CCC(CNC(=O)C#CC(C)C)CC1	ZINC001223097060	1375031128	/nfs/dbraw/zinc/03/11/28/1375031128.db2.gz	UNLIVCLVSDMMRE-UHFFFAOYSA-N	0	3	330.447	3.122	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC[C@H](C)N(Cc2cccc(OC)c2C)C1	ZINC001131894918	1375032903	/nfs/dbraw/zinc/03/29/03/1375032903.db2.gz	DAAXRXDEDBSUNL-YJBOKZPZSA-N	0	3	330.472	3.439	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)CCCCc2ccc(F)cc2)CC1	ZINC001224651816	1375070125	/nfs/dbraw/zinc/07/01/25/1375070125.db2.gz	ZFYIVQTYLHLVPF-UHFFFAOYSA-N	0	3	344.474	3.390	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CC[C@@H](C)N(Cc2ccc3c(c2)CCC3)C1	ZINC001131994999	1375088295	/nfs/dbraw/zinc/08/82/95/1375088295.db2.gz	FLEBUHUXSASDED-UTKZUKDTSA-N	0	3	338.495	3.448	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CC[C@H](C)N(Cc2ccc3cc[nH]c3c2)C1	ZINC001132003596	1375094059	/nfs/dbraw/zinc/09/40/59/1375094059.db2.gz	XRFQCXXDKCCGRC-LPHOPBHVSA-N	0	3	337.467	3.441	20	30		EGEDHN
Cc1ccc(CN2C[C@@H](NC(=O)C#CC(C)C)CC[C@@H]2C)c(C)c1	ZINC001132021722	1375102056	/nfs/dbraw/zinc/10/20/56/1375102056.db2.gz	OWFJDCPXUSADHI-ICSRJNTNSA-N	0	3	326.484	3.432	20	30		EGEDHN
Cc1cc(CN2C[C@@H](NC(=O)C#CC(C)C)CC[C@H]2C)c(C)s1	ZINC001132025846	1375105458	/nfs/dbraw/zinc/10/54/58/1375105458.db2.gz	WLPVSHRXVKINFO-KDOFPFPSSA-N	0	3	332.513	3.493	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2csc(C)c2C)CC[C@@H]1C	ZINC001132054413	1375119649	/nfs/dbraw/zinc/11/96/49/1375119649.db2.gz	OVNIXMVFMAHBTQ-BBRMVZONSA-N	0	3	336.501	3.150	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CC[C@H](C)N(CCc2cnn(CC)c2)C1	ZINC001132060403	1375124877	/nfs/dbraw/zinc/12/48/77/1375124877.db2.gz	FIGUQRNHOKDANP-FUHWJXTLSA-N	0	3	346.519	3.017	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CC[C@H](C)N(CCc2scnc2C)C1	ZINC001132071422	1375133018	/nfs/dbraw/zinc/13/30/18/1375133018.db2.gz	ANUOHMDPFJGHJV-GOEBONIOSA-N	0	3	335.517	3.319	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCc2ccc(OCC)cc2)CC[C@H]1C	ZINC001132150550	1375171609	/nfs/dbraw/zinc/17/16/09/1375171609.db2.gz	RZPXEMRMHMCISN-SJLPKXTDSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCc2nc3ccccc3[nH]2)CC[C@@H]1C	ZINC001132159769	1375177448	/nfs/dbraw/zinc/17/74/48/1375177448.db2.gz	FMYIGKBZKKPYTI-HOTGVXAUSA-N	0	3	340.471	3.041	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)C2(C3CCC3)CCC2)CC[C@@H]1C	ZINC001132201131	1375206044	/nfs/dbraw/zinc/20/60/44/1375206044.db2.gz	XEMZFHNIBVPOMP-WMZOPIPTSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCCOc2ccc(F)cc2)CC[C@@H]1C	ZINC001132214147	1375212710	/nfs/dbraw/zinc/21/27/10/1375212710.db2.gz	CLIDPOZZKFUUNW-DOTOQJQBSA-N	0	3	334.435	3.140	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1CC[C@H](C)N(Cc2ccccc2N(C)C)C1	ZINC001132217700	1375214972	/nfs/dbraw/zinc/21/49/72/1375214972.db2.gz	FYKASNJWQJJVCW-WMZOPIPTSA-N	0	3	343.515	3.434	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1CC[C@H](C)N(Cc2ccc(CO)cc2)C1	ZINC001132217902	1375216055	/nfs/dbraw/zinc/21/60/55/1375216055.db2.gz	IRJGSAKYOSQELJ-LPHOPBHVSA-N	0	3	344.499	3.250	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCNCc2ccc(Cl)c(Cl)c2)cc1	ZINC001132226619	1375222352	/nfs/dbraw/zinc/22/23/52/1375222352.db2.gz	HUHSTURNKVIOKA-UHFFFAOYSA-N	0	3	347.245	3.494	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CC[C@@H](C)N(CCOCc2ccccc2)C1	ZINC001132228180	1375223936	/nfs/dbraw/zinc/22/39/36/1375223936.db2.gz	NKMCVYGPYZBEBT-IEBWSBKVSA-N	0	3	344.499	3.385	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCc2cccc(N(C)C)c2)CC[C@H]1C	ZINC001132237619	1375233028	/nfs/dbraw/zinc/23/30/28/1375233028.db2.gz	KLKLKIONNXRYSE-IEBWSBKVSA-N	0	3	343.515	3.230	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCCc2ccc(OC)cc2)CC[C@H]1C	ZINC001132265588	1375254699	/nfs/dbraw/zinc/25/46/99/1375254699.db2.gz	PGRIKOZKFFPFBO-AEFFLSMTSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC1CCN(Cc2ccc(F)cc2C)CC1	ZINC001226448579	1375261018	/nfs/dbraw/zinc/26/10/18/1375261018.db2.gz	YQHQHMOWFVYTNG-MRXNPFEDSA-N	0	3	348.462	3.196	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCN(C)c2ccccc2)CC[C@@H]1C	ZINC001132365425	1375329538	/nfs/dbraw/zinc/32/95/38/1375329538.db2.gz	KCHFCMGXOYNWJQ-ZWKOTPCHSA-N	0	3	329.488	3.058	20	30		EGEDHN
CCCCCCCCOCC(=O)N[C@@H]1CCCC[C@H]1NCCF	ZINC001226817492	1375342489	/nfs/dbraw/zinc/34/24/89/1375342489.db2.gz	FKEYIMIPGMFYMC-IAGOWNOFSA-N	0	3	330.488	3.350	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCCOc2cccc(F)c2)CC[C@@H]1C	ZINC001132508439	1375432135	/nfs/dbraw/zinc/43/21/35/1375432135.db2.gz	KAESGMJRASSKTG-DOTOQJQBSA-N	0	3	334.435	3.140	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)C=C(C)C)CC1	ZINC001132551894	1375457475	/nfs/dbraw/zinc/45/74/75/1375457475.db2.gz	NSSGHCBAPIPRKO-HXUWFJFHSA-N	0	3	339.483	3.254	20	30		EGEDHN
C#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)CCC(=C)C)CC1	ZINC001132554706	1375461189	/nfs/dbraw/zinc/46/11/89/1375461189.db2.gz	KOEWEOREAHRGBG-HXUWFJFHSA-N	0	3	339.483	3.254	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2ccccc2C(C)C)CC1	ZINC001227691931	1375461742	/nfs/dbraw/zinc/46/17/42/1375461742.db2.gz	HXUBQAZZRGZSBS-UHFFFAOYSA-N	0	3	330.472	3.207	20	30		EGEDHN
C#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)[C@@H](C)C(C)C)CC1	ZINC001132557835	1375463792	/nfs/dbraw/zinc/46/37/92/1375463792.db2.gz	DWQRQXWYCCKTSB-ICSRJNTNSA-N	0	3	341.499	3.190	20	30		EGEDHN
C#CCC1(C(=O)NC2CCN(Cc3ccc(CF)cc3)CC2)CCC1	ZINC001227754755	1375472066	/nfs/dbraw/zinc/47/20/66/1375472066.db2.gz	QODRZEMYWFUYRI-UHFFFAOYSA-N	0	3	342.458	3.430	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)C/C=C/c2cccc(F)c2)CC1	ZINC001227849378	1375481969	/nfs/dbraw/zinc/48/19/69/1375481969.db2.gz	PXOXXAPWHRXSDJ-GQCTYLIASA-N	0	3	346.446	3.012	20	30		EGEDHN
CCCCC(=O)N1CC[C@H](C)[C@@H](CNCc2ccccc2C#N)C1	ZINC001132669936	1375506388	/nfs/dbraw/zinc/50/63/88/1375506388.db2.gz	LBIULKZQNHYMGG-LPHOPBHVSA-N	0	3	327.472	3.323	20	30		EGEDHN
C[C@@H]1CCN(C(=O)C#CC(C)(C)C)C[C@H]1CNC/C(Cl)=C/Cl	ZINC001132820369	1375582321	/nfs/dbraw/zinc/58/23/21/1375582321.db2.gz	ULFGRTCWHQBEDP-OFGWCQOXSA-N	0	3	345.314	3.429	20	30		EGEDHN
C[C@@H]1CCN(C(=O)C#CC(C)(C)C)C[C@@H]1CNC/C(Cl)=C/Cl	ZINC001132820372	1375582874	/nfs/dbraw/zinc/58/28/74/1375582874.db2.gz	ULFGRTCWHQBEDP-SYCNKOGLSA-N	0	3	345.314	3.429	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](C)[C@H](CNCc2ocnc2C)C1	ZINC001132843007	1375594729	/nfs/dbraw/zinc/59/47/29/1375594729.db2.gz	GXKPMHPIZQPGNV-MAUKXSAKSA-N	0	3	345.487	3.326	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CCN(CCO[C@H]2CCCC[C@H]2C)CC1	ZINC001228631970	1375622501	/nfs/dbraw/zinc/62/25/01/1375622501.db2.gz	ZAMQOLVIGIWIQO-AEFFLSMTSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC1CCN(Cc2cccc(N(C)C)c2)CC1	ZINC001228786883	1375677114	/nfs/dbraw/zinc/67/71/14/1375677114.db2.gz	TUFTZZARGZKALV-QGZVFWFLSA-N	0	3	343.515	3.436	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccc(F)cc1	ZINC001228901956	1375710697	/nfs/dbraw/zinc/71/06/97/1375710697.db2.gz	OPUCXQQUAOEAJE-NSISKUIASA-N	0	3	344.474	3.486	20	30		EGEDHN
C=CCCCC(=O)NC1CCN(Cc2ccc(C)c(OC)c2)CC1	ZINC001228928003	1375717468	/nfs/dbraw/zinc/71/74/68/1375717468.db2.gz	RUQNJEBOKUUYRC-UHFFFAOYSA-N	0	3	330.472	3.441	20	30		EGEDHN
O=C(N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1)[C@@H]1C[C@H]1C1CC1	ZINC001229029640	1375745872	/nfs/dbraw/zinc/74/58/72/1375745872.db2.gz	BIAOHVLMLKODEP-DOIPELPJSA-N	0	3	336.479	3.101	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](C)[C@H](CNCc2ncc(C)s2)C1	ZINC001133068674	1375756247	/nfs/dbraw/zinc/75/62/47/1375756247.db2.gz	JIQWIBTYCKDMDR-NVXWUHKLSA-N	0	3	347.528	3.219	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](C)[C@@H](CNCc2nccs2)C1	ZINC001133142221	1375804151	/nfs/dbraw/zinc/80/41/51/1375804151.db2.gz	MHQAPDVSHRGJLJ-GJZGRUSLSA-N	0	3	335.517	3.320	20	30		EGEDHN
C=CCCCC(=O)NCCNCc1ccccc1OCC(F)(F)F	ZINC001133145059	1375805365	/nfs/dbraw/zinc/80/53/65/1375805365.db2.gz	NVJWPSCOXGTNLX-UHFFFAOYSA-N	0	3	344.377	3.190	20	30		EGEDHN
Cc1cc(Cl)ccc1C(=O)NCCNCc1ccc(C#N)c(F)c1	ZINC001133248608	1375868298	/nfs/dbraw/zinc/86/82/98/1375868298.db2.gz	KQCMWBCHBSOSEW-UHFFFAOYSA-N	0	3	345.805	3.179	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H]2CN(Cc3csc(C)c3)C[C@H]21	ZINC001188908435	1388406969	/nfs/dbraw/zinc/40/69/69/1388406969.db2.gz	CTYMSIJDEKTABR-ZWKOTPCHSA-N	0	3	330.497	3.283	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)/C=C\C1CC1	ZINC001133391088	1375975708	/nfs/dbraw/zinc/97/57/08/1375975708.db2.gz	WYZDAGSKYODDOH-KTKRTIGZSA-N	0	3	330.859	3.248	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)/C=C\C(C)(C)C	ZINC001133392606	1375976827	/nfs/dbraw/zinc/97/68/27/1375976827.db2.gz	FLNPJFXMTNLPPS-KTKRTIGZSA-N	0	3	332.875	3.494	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)CCC(F)F	ZINC001133399214	1375984021	/nfs/dbraw/zinc/98/40/21/1375984021.db2.gz	HYBZFZOSHKJDIQ-UHFFFAOYSA-N	0	3	342.817	3.327	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C1(C)CC(=C)C1	ZINC001133403643	1375988294	/nfs/dbraw/zinc/98/82/94/1375988294.db2.gz	BXSXOEXYAPWNSI-UHFFFAOYSA-N	0	3	330.859	3.248	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@H](C)c1ccco1	ZINC001133407434	1375991718	/nfs/dbraw/zinc/99/17/18/1375991718.db2.gz	GZJIWDAQZIBDFZ-OAHLLOKOSA-N	0	3	344.842	3.288	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)Cc1ccsc1)NCc1ccccc1C#N	ZINC001133563722	1376090958	/nfs/dbraw/zinc/09/09/58/1376090958.db2.gz	LRDDWWQYZWRXIS-CABCVRRESA-N	0	3	341.480	3.235	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)c1ccsc1)NCc1ccccc1C#N	ZINC001133632342	1376128214	/nfs/dbraw/zinc/12/82/14/1376128214.db2.gz	FSDBAEMRIALKHF-KGLIPLIRSA-N	0	3	327.453	3.306	20	30		EGEDHN
Cc1ccoc1C(=O)N[C@@H](C)C[C@@H](C)NCc1cc(F)ccc1C#N	ZINC001133680329	1376151203	/nfs/dbraw/zinc/15/12/03/1376151203.db2.gz	YDZAIXBZCKKNQA-KGLIPLIRSA-N	0	3	343.402	3.286	20	30		EGEDHN
C#CCCN(CCCNC(=O)C(C)(C)C(=C)C)Cc1cccnc1	ZINC001230811132	1376155867	/nfs/dbraw/zinc/15/58/67/1376155867.db2.gz	KNWZMCLRDCXQLB-UHFFFAOYSA-N	0	3	327.472	3.016	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)[C@H]1C[C@H]2C[C@H]2C1)Cc1cccnc1	ZINC001230824845	1376160810	/nfs/dbraw/zinc/16/08/10/1376160810.db2.gz	SNGSWCUBNYXSSC-BWTSREIZSA-N	0	3	327.472	3.012	20	30		EGEDHN
C[C@@H](c1ccccn1)N1CC[C@@H](Oc2ncnc3c(C#N)cccc23)C1	ZINC001231039944	1376197794	/nfs/dbraw/zinc/19/77/94/1376197794.db2.gz	LUVKJFBKAAADDY-GOEBONIOSA-N	0	3	345.406	3.111	20	30		EGEDHN
Cc1ncc(C(=O)N[C@H](C)C[C@H](C)NCc2ccccc2C#N)s1	ZINC001133871114	1376244349	/nfs/dbraw/zinc/24/43/49/1376244349.db2.gz	HKZFWMKLFPGAOT-QWHCGFSZSA-N	0	3	342.468	3.010	20	30		EGEDHN
C/C(=C\C(=O)N[C@H](C)C[C@H](C)NCc1ccccc1C#N)C1CC1	ZINC001133872551	1376244905	/nfs/dbraw/zinc/24/49/05/1376244905.db2.gz	WMIKNJCWDCCMBC-KFOKOMITSA-N	0	3	325.456	3.287	20	30		EGEDHN
C=CCOCC(=O)N[C@H](C)C[C@H](C)NCc1cccc(F)c1Cl	ZINC001133910060	1376260938	/nfs/dbraw/zinc/26/09/38/1376260938.db2.gz	VIYUPKGIQHLKLL-QWHCGFSZSA-N	0	3	342.842	3.055	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)/C=C/C(C)(C)C	ZINC001133951003	1376280672	/nfs/dbraw/zinc/28/06/72/1376280672.db2.gz	UWNQTMIWBREUIW-WUOSCTTQSA-N	0	3	331.298	3.370	20	30		EGEDHN
C#Cc1cccc(CN2CCC(c3nc(-c4cccnc4)no3)CC2)c1	ZINC001231659079	1376298586	/nfs/dbraw/zinc/29/85/86/1376298586.db2.gz	FCVYAJCUNVXICT-UHFFFAOYSA-N	0	3	344.418	3.493	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H]2CN(CCOc3ccc(F)cc3)C[C@H]21	ZINC001189007352	1388434998	/nfs/dbraw/zinc/43/49/98/1388434998.db2.gz	SQUJVDNJZDJTHA-QFBILLFUSA-N	0	3	346.446	3.094	20	30		EGEDHN
CCN1CC[C@@]2(CCCN(Cc3ccc(C#N)c(Cl)c3)C2)C1=O	ZINC001232114391	1376401638	/nfs/dbraw/zinc/40/16/38/1376401638.db2.gz	IELBVEABVWIKOQ-GOSISDBHSA-N	0	3	331.847	3.046	20	30		EGEDHN
CCN1CCC2(CCN(Cc3ccc(C#N)c(Cl)c3)CC2)C1=O	ZINC001232116056	1376402504	/nfs/dbraw/zinc/40/25/04/1376402504.db2.gz	FVIAJLOEQZYBOF-UHFFFAOYSA-N	0	3	331.847	3.046	20	30		EGEDHN
C#CCCCC(=O)N[C@@H](C)C[C@@H](C)NCc1cc(O)ccc1Cl	ZINC001134206414	1376417408	/nfs/dbraw/zinc/41/74/08/1376417408.db2.gz	UNPOSWXYODBKJF-KGLIPLIRSA-N	0	3	336.863	3.222	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)C1CC(C)(C)C1)NCc1ccccc1C#N	ZINC001134252855	1376437581	/nfs/dbraw/zinc/43/75/81/1376437581.db2.gz	WAEJHOFYHIRODC-HUUCEWRRSA-N	0	3	327.472	3.367	20	30		EGEDHN
C[C@@H](CC(=O)NCCNCc1ccc(F)c(C#N)c1)CC(C)(C)C	ZINC001134255367	1376439273	/nfs/dbraw/zinc/43/92/73/1376439273.db2.gz	XVHMFRHEXWXRBO-AWEZNQCLSA-N	0	3	333.451	3.366	20	30		EGEDHN
COc1cccc(Cl)c1CN[C@@H](C)C[C@@H](C)NC(=O)C#CC1CC1	ZINC001134322682	1376475194	/nfs/dbraw/zinc/47/51/94/1376475194.db2.gz	VJJKEPGOOXZJOB-UONOGXRCSA-N	0	3	348.874	3.135	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cccc(CF)n1)CC2	ZINC001232534546	1376477957	/nfs/dbraw/zinc/47/79/57/1376477957.db2.gz	RMXQEDHUWITSGB-IBGZPJMESA-N	0	3	331.435	3.084	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)C#CC(C)(C)C)NCc1nc2ccccc2o1	ZINC001134329113	1376479391	/nfs/dbraw/zinc/47/93/91/1376479391.db2.gz	JRHZZMOSJSCNQH-HUUCEWRRSA-N	0	3	341.455	3.250	20	30		EGEDHN
Cc1nc(CN[C@H](C)C[C@H](C)NC(=O)C#CC(C)(C)C)sc1C	ZINC001134329770	1376480477	/nfs/dbraw/zinc/48/04/77/1376480477.db2.gz	SBPNGWSQCFKQSQ-OLZOCXBDSA-N	0	3	335.517	3.182	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H](C)C[C@@H](C)NCc1ccn(C2CCCC2)n1	ZINC001134341569	1376484793	/nfs/dbraw/zinc/48/47/93/1376484793.db2.gz	QJXQTFIXMIEQJC-IAGOWNOFSA-N	0	3	344.503	3.031	20	30		EGEDHN
N#Cc1ccccc1O[C@@H]1CCCN(Cc2ccc(CCO)cc2)C1	ZINC001232779949	1376512606	/nfs/dbraw/zinc/51/26/06/1376512606.db2.gz	YNMADZHTKOSYGG-HXUWFJFHSA-N	0	3	336.435	3.136	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)C(C)(C)C(C)C	ZINC001134440314	1376538068	/nfs/dbraw/zinc/53/80/68/1376538068.db2.gz	UERWPCYNDBXPIA-QWHCGFSZSA-N	0	3	333.314	3.450	20	30		EGEDHN
COC(=O)N1CCC2(CCN(Cc3ccc(C)cc3C#N)CC2)CC1	ZINC001232962790	1376549347	/nfs/dbraw/zinc/54/93/47/1376549347.db2.gz	QYUBEGCGPYVPLU-UHFFFAOYSA-N	0	3	341.455	3.311	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)C1C=CC=CC=C1	ZINC001134476548	1376559538	/nfs/dbraw/zinc/55/95/38/1376559538.db2.gz	UAKDNVFDTYCKAM-ZIAGYGMSSA-N	0	3	339.277	3.066	20	30		EGEDHN
CC[C@@H](Cc1ccccc1)C(=O)NCCNCc1ccc(C#N)s1	ZINC001134587897	1376611656	/nfs/dbraw/zinc/61/16/56/1376611656.db2.gz	FNKHPEFIMISTBJ-INIZCTEOSA-N	0	3	341.480	3.094	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)C1(C2CC2)CC1)NCc1cc(F)ccc1C#N	ZINC001134694510	1376664940	/nfs/dbraw/zinc/66/49/40/1376664940.db2.gz	SWOKFEUAMINOSO-KGLIPLIRSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=CCCCN1CC[C@H]1CN(C)C(=O)c1csc([C@@H]2CCCO2)n1	ZINC001234333457	1376813663	/nfs/dbraw/zinc/81/36/63/1376813663.db2.gz	KKQBZFIKHJJYFV-HOCLYGCPSA-N	0	3	349.500	3.107	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)CCOc1ccc(C)c(C)c1	ZINC001235036393	1376834685	/nfs/dbraw/zinc/83/46/85/1376834685.db2.gz	MUQMWZIJUHYMJQ-SFHVURJKSA-N	0	3	330.472	3.181	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@@](C)(OC)c1ccccc1F	ZINC001235124080	1376855367	/nfs/dbraw/zinc/85/53/67/1376855367.db2.gz	OIANYKVYIZVBRO-JXFKEZNVSA-N	0	3	348.462	3.186	20	30		EGEDHN
C=CC1(CC(=O)NCCNCc2sc(C)nc2C)CCCCC1	ZINC001135187634	1376960557	/nfs/dbraw/zinc/96/05/57/1376960557.db2.gz	YKMCRATYQJAFDL-UHFFFAOYSA-N	0	3	335.517	3.492	20	30		EGEDHN
Cc1cocc1C(=O)N[C@H](C)C[C@@H](C)NCc1cc(F)ccc1C#N	ZINC001135202789	1376972182	/nfs/dbraw/zinc/97/21/82/1376972182.db2.gz	IIWYOUANDAMSEY-ZIAGYGMSSA-N	0	3	343.402	3.286	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H](C)C[C@H](C)NCc1nc2ccccc2n1C	ZINC001135231239	1376991040	/nfs/dbraw/zinc/99/10/40/1376991040.db2.gz	YDWTYBPHSBAIRN-LSDHHAIUSA-N	0	3	342.487	3.158	20	30		EGEDHN
CCc1ccc([C@@H](C)C(=O)NCCNCc2ccc(C#N)s2)cc1	ZINC001135368468	1377058094	/nfs/dbraw/zinc/05/80/94/1377058094.db2.gz	CNYMHSJBUWCYLG-CQSZACIVSA-N	0	3	341.480	3.192	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)C1(C)CC(=C)C1	ZINC001135420719	1377086424	/nfs/dbraw/zinc/08/64/24/1377086424.db2.gz	YVGZGNDJASHYCI-QWHCGFSZSA-N	0	3	329.282	3.124	20	30		EGEDHN
N#CC[C@@H](C(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1	ZINC001135797681	1377213764	/nfs/dbraw/zinc/21/37/64/1377213764.db2.gz	PQOJOZIIKZCAGW-WOJBJXKFSA-N	0	3	333.435	3.075	20	30		EGEDHN
CC[C@@H]1CCCC[C@H]1C(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001136080309	1377333554	/nfs/dbraw/zinc/33/35/54/1377333554.db2.gz	DVXUHKQMMMNQJH-NVXWUHKLSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CC[C@@H](N(C)Cc2cc(F)ccc2C)C1	ZINC001189241954	1388493294	/nfs/dbraw/zinc/49/32/94/1388493294.db2.gz	BLAGVBSYEXILSE-VQIMIIECSA-N	0	3	348.462	3.148	20	30		EGEDHN
C=CCN1C(=O)CCC12CCN(Cc1ccc(N3CCCC3)o1)CC2	ZINC001137065093	1377471716	/nfs/dbraw/zinc/47/17/16/1377471716.db2.gz	VSMYEIJYLBLURA-UHFFFAOYSA-N	0	3	343.471	3.023	20	30		EGEDHN
CC(C)(C)OC(=O)C[C@H]1CCN(Cc2ccc(OCC#N)cc2)C1	ZINC001137121420	1377482524	/nfs/dbraw/zinc/48/25/24/1377482524.db2.gz	KMXSDDANAMIBPG-MRXNPFEDSA-N	0	3	330.428	3.143	20	30		EGEDHN
COc1nc2ccccc2cc1CN1CCC2SC(=O)C=C2C1	ZINC001137202217	1377495999	/nfs/dbraw/zinc/49/59/99/1377495999.db2.gz	BYUYOWUZPDPIGR-INIZCTEOSA-N	0	3	326.421	3.018	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cccc2oc(C)nc21)C(C)C	ZINC001268227665	1377498688	/nfs/dbraw/zinc/49/86/88/1377498688.db2.gz	NLQMPSIJSPZIEO-CQSZACIVSA-N	0	3	335.835	3.233	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC2(CCCN(Cc3cn[nH]c3)C2)CC1	ZINC001268985715	1377535457	/nfs/dbraw/zinc/53/54/57/1377535457.db2.gz	ZKZQMQVUHZFHEB-UHFFFAOYSA-N	0	3	344.503	3.217	20	30		EGEDHN
O=C1CCC2(CCN(Cc3ccc(C#Cc4ccccc4)cc3)CC2)N1	ZINC001138336346	1377704636	/nfs/dbraw/zinc/70/46/36/1377704636.db2.gz	PYBUFQPDZQDGLQ-UHFFFAOYSA-N	0	3	344.458	3.331	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3ccc(OC)c(Cl)c3)C2)C1=O	ZINC001138473501	1377728108	/nfs/dbraw/zinc/72/81/08/1377728108.db2.gz	RKVVSZOZNOQWLA-IBGZPJMESA-N	0	3	348.874	3.349	20	30		EGEDHN
C=CCc1cccc(CN2CCN(c3ccc(Cl)cn3)CC2)c1O	ZINC001138628019	1377756811	/nfs/dbraw/zinc/75/68/11/1377756811.db2.gz	LYVFPQPQFANSBX-UHFFFAOYSA-N	0	3	343.858	3.491	20	30		EGEDHN
C=CCc1cccc(CN2CCCN(C(=O)c3ccco3)CC2)c1O	ZINC001138628672	1377756867	/nfs/dbraw/zinc/75/68/67/1377756867.db2.gz	ZKWIJTPBEHFJIR-UHFFFAOYSA-N	0	3	340.423	3.062	20	30		EGEDHN
C=CCOc1ccccc1CN1CCC2(CCN(CC)C2=O)CC1	ZINC001139030046	1377819945	/nfs/dbraw/zinc/81/99/45/1377819945.db2.gz	DKUYLZLGYJSFKP-UHFFFAOYSA-N	0	3	328.456	3.086	20	30		EGEDHN
N#Cc1ccnc(-c2ccc(CN3CCC(F)(F)[C@H](CO)C3)cc2)c1	ZINC001139400498	1377878873	/nfs/dbraw/zinc/87/88/73/1377878873.db2.gz	ULRHXZBXZJYYDM-KRWDZBQOSA-N	0	3	343.377	3.070	20	30		EGEDHN
CCOC(=O)C[C@H]1CCCN(Cc2c[nH]c3c2cccc3C#N)C1	ZINC001139701396	1377937280	/nfs/dbraw/zinc/93/72/80/1377937280.db2.gz	HADVVYQFXHHWBS-CQSZACIVSA-N	0	3	325.412	3.205	20	30		EGEDHN
Cc1cc(O[C@H]2CCCN(Cc3c[nH]c4c3cccc4C#N)C2)ncn1	ZINC001139707936	1377939201	/nfs/dbraw/zinc/93/92/01/1377939201.db2.gz	YYYCFZGVRDNXLW-KRWDZBQOSA-N	0	3	347.422	3.181	20	30		EGEDHN
Cc1ccc(CN2C[C@@H]3CN(C(=O)c4ccccc4)C[C@H]3C2)cc1C#N	ZINC001139724993	1377941909	/nfs/dbraw/zinc/94/19/09/1377941909.db2.gz	YOEWGRZGNXXMJH-NHCUHLMSSA-N	0	3	345.446	3.071	20	30		EGEDHN
COCC[C@@H]1CO[C@]2(C1)CCCN(Cc1ccc(C)c(C#N)c1)C2	ZINC001139725366	1377942027	/nfs/dbraw/zinc/94/20/27/1377942027.db2.gz	MNNGMNFYQSODQX-ICSRJNTNSA-N	0	3	328.456	3.274	20	30		EGEDHN
C=CCn1cc(CN2CCC(COc3cccc(OC)c3)CC2)cn1	ZINC001139771439	1377948793	/nfs/dbraw/zinc/94/87/93/1377948793.db2.gz	ZVGMTDZJGYCDJZ-UHFFFAOYSA-N	0	3	341.455	3.369	20	30		EGEDHN
C=CCN1C(=O)CCC12CCN(Cc1ccc(COC)s1)CC2	ZINC001139826359	1377957860	/nfs/dbraw/zinc/95/78/60/1377957860.db2.gz	PXPFXPYJXKEPFX-UHFFFAOYSA-N	0	3	334.485	3.038	20	30		EGEDHN
COC(=O)c1cccc(CN(C)Cc2c[nH]c3ccc(C#N)cc23)c1	ZINC001140116403	1378012176	/nfs/dbraw/zinc/01/21/76/1378012176.db2.gz	XPQHAZADBVKKQA-UHFFFAOYSA-N	0	3	333.391	3.458	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)nc1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC001140547585	1378083139	/nfs/dbraw/zinc/08/31/39/1378083139.db2.gz	VDXHBZKBCFQBPQ-QGZVFWFLSA-N	0	3	344.459	3.173	20	30		EGEDHN
C=CCN1CCC2(CCN(Cc3cc(C)c(OC)c(C)c3)CC2)C1=O	ZINC001273326567	1378097963	/nfs/dbraw/zinc/09/79/63/1378097963.db2.gz	GIYOQJNICVSEME-UHFFFAOYSA-N	0	3	342.483	3.313	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@@H]3[C@H]2CCC(=O)N3[C@@H](C)CC)c1[O-]	ZINC001273360468	1378098791	/nfs/dbraw/zinc/09/87/91/1378098791.db2.gz	OGOZCWMBTGOYKJ-KFKAGJAMSA-N	0	3	342.483	3.485	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@@H]3[C@H]2CCC(=O)N3[C@@H](C)CC)c1[O-]	ZINC001273360468	1378098794	/nfs/dbraw/zinc/09/87/94/1378098794.db2.gz	OGOZCWMBTGOYKJ-KFKAGJAMSA-N	0	3	342.483	3.485	20	30		EGEDHN
Cn1cnc2ccc(CN3CCC(Oc4ccccc4C#N)CC3)cc21	ZINC001140738908	1378127888	/nfs/dbraw/zinc/12/78/88/1378127888.db2.gz	UIPXHTGXIUYBPS-UHFFFAOYSA-N	0	3	346.434	3.488	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@H]1CC[N@@H+](Cc1ccc(C)cc1[O-])C2	ZINC001140952055	1378189757	/nfs/dbraw/zinc/18/97/57/1378189757.db2.gz	CRRRTHZQRAKIKM-VQTJNVASSA-N	0	3	331.456	3.274	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@H]1CC[N@H+](Cc1ccc(C)cc1[O-])C2	ZINC001140952055	1378189759	/nfs/dbraw/zinc/18/97/59/1378189759.db2.gz	CRRRTHZQRAKIKM-VQTJNVASSA-N	0	3	331.456	3.274	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@@]3(CCC[C@@H]3C(=O)N(C)C)C2)c1[O-]	ZINC001277463808	1378224275	/nfs/dbraw/zinc/22/42/75/1378224275.db2.gz	OSEUIBMJQBECIW-NQIIRXRSSA-N	0	3	342.483	3.201	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@@]3(CCC[C@@H]3C(=O)N(C)C)C2)c1[O-]	ZINC001277463808	1378224277	/nfs/dbraw/zinc/22/42/77/1378224277.db2.gz	OSEUIBMJQBECIW-NQIIRXRSSA-N	0	3	342.483	3.201	20	30		EGEDHN
N#Cc1c(N)sc(CN(C2CCC2)C2CCOCC2)c1Cl	ZINC001141113575	1378242796	/nfs/dbraw/zinc/24/27/96/1378242796.db2.gz	LBDGFGZPKRYJJE-UHFFFAOYSA-N	0	3	325.865	3.389	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1[nH]cnc1C(C)(C)C)CC2	ZINC001142222575	1378422188	/nfs/dbraw/zinc/42/21/88/1378422188.db2.gz	RQBBEJWHXNFEOK-FQEVSTJZSA-N	0	3	344.503	3.240	20	30		EGEDHN
CCN(Cc1ccc(C#N)cn1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC001144163182	1378690063	/nfs/dbraw/zinc/69/00/63/1378690063.db2.gz	SRVNNIHXLLJONS-UHFFFAOYSA-N	0	3	344.459	3.175	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3cc(Cl)cc(OC)c3)C2)C1=O	ZINC001144480834	1378736090	/nfs/dbraw/zinc/73/60/90/1378736090.db2.gz	JEBLTYCQEXJXEQ-IBGZPJMESA-N	0	3	348.874	3.349	20	30		EGEDHN
C#Cc1ccc(CN2CC[C@@H]3[C@@H]2CCN3C(=O)OC(C)(C)C)cc1	ZINC001144568058	1378746077	/nfs/dbraw/zinc/74/60/77/1378746077.db2.gz	JKUJCUDQDBLQCO-ZWKOTPCHSA-N	0	3	326.440	3.252	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2nccs2)CCCCC1	ZINC001146661853	1378892363	/nfs/dbraw/zinc/89/23/63/1378892363.db2.gz	CTGHLVBDLAYUPT-HOTGVXAUSA-N	0	3	347.528	3.490	20	30		EGEDHN
C[C@@H](C(=O)NCCNCc1ccc(C#N)cc1)c1ccc(Cl)s1	ZINC001147161503	1378980436	/nfs/dbraw/zinc/98/04/36/1378980436.db2.gz	QWPRGNKMGPYZPL-GFCCVEGCSA-N	0	3	347.871	3.283	20	30		EGEDHN
C=C(C)CCC(=O)N1CC2(C1)CCN(CCc1ccccc1F)C2	ZINC001147639952	1379054207	/nfs/dbraw/zinc/05/42/07/1379054207.db2.gz	ITLJRCBODHAXFI-UHFFFAOYSA-N	0	3	330.447	3.259	20	30		EGEDHN
C=C(C)CCC(=O)N1CC2(C1)CCN(CCOc1cccc(F)c1)C2	ZINC001147658374	1379057043	/nfs/dbraw/zinc/05/70/43/1379057043.db2.gz	RNIPEVNJERCLPM-UHFFFAOYSA-N	0	3	346.446	3.095	20	30		EGEDHN
C[C@H](CCC(C)(C)C)C(=O)NCCNCc1ccc(C#N)c(F)c1	ZINC001147786480	1379078332	/nfs/dbraw/zinc/07/83/32/1379078332.db2.gz	FTTNCSPZEPSSHG-CQSZACIVSA-N	0	3	333.451	3.366	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001148080386	1379113764	/nfs/dbraw/zinc/11/37/64/1379113764.db2.gz	XINUGTYLRVTGKB-IDUWFGFVSA-N	0	3	335.451	3.115	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)N1CC2(C1)CCN(Cc1cccc(OC)c1)C2	ZINC001148088640	1379115133	/nfs/dbraw/zinc/11/51/33/1379115133.db2.gz	OQXYJDNULMEDAD-SJORKVTESA-N	0	3	342.483	3.188	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC2(C1)CCN(Cc1sc(C)nc1C)C2	ZINC001148132000	1379122544	/nfs/dbraw/zinc/12/25/44/1379122544.db2.gz	XBBLLFPZLUZHMV-MRXNPFEDSA-N	0	3	347.528	3.397	20	30		EGEDHN
CCCCCCCCCC(=O)NCCNCC(=O)NC(CC)CC	ZINC001148825785	1379276622	/nfs/dbraw/zinc/27/66/22/1379276622.db2.gz	LTXFCQSJJVVYJL-UHFFFAOYSA-N	0	3	341.540	3.138	20	30		EGEDHN
C=CCCOCC(=O)N1CC2(C1)CCN([C@H](C)c1ccccc1F)C2	ZINC001148874043	1379288629	/nfs/dbraw/zinc/28/86/29/1379288629.db2.gz	HOWYCSCCIYOHRC-MRXNPFEDSA-N	0	3	346.446	3.014	20	30		EGEDHN
CN1CCC[C@H]2CN(C(=O)c3ccc(C(C)(C)CCC#N)cc3)C[C@@H]21	ZINC001148906682	1379295858	/nfs/dbraw/zinc/29/58/58/1379295858.db2.gz	WFAQKELQKQPBKQ-HKUYNNGSSA-N	0	3	339.483	3.434	20	30		EGEDHN
C=C1CC=C(F)C=C1NC(=O)c1ccc(N2CCN(CC)CC2)cc1	ZINC001149010177	1379311190	/nfs/dbraw/zinc/31/11/90/1379311190.db2.gz	DDKGYBSQVZPFTK-UHFFFAOYSA-N	0	3	341.430	3.256	20	30		EGEDHN
CC#CCCCC(=O)N1C[C@@H](NCc2ccnc(Cl)c2)C[C@H]1C	ZINC001284004199	1379355594	/nfs/dbraw/zinc/35/55/94/1379355594.db2.gz	PUPXFEIHEIFADK-ZBFHGGJFSA-N	0	3	333.863	3.008	20	30		EGEDHN
Cc1cccc(CN2CC[C@@H](NC(=O)c3cc(C#N)ccc3C)C2)c1	ZINC001149849297	1379454811	/nfs/dbraw/zinc/45/48/11/1379454811.db2.gz	UMBDLBDZVGHFEV-LJQANCHMSA-N	0	3	333.435	3.179	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@@H]1CN(Cc2ccc(C)cc2)CCCO1	ZINC001150138528	1379501080	/nfs/dbraw/zinc/50/10/80/1379501080.db2.gz	AKQAXBWTPMLWHF-UYAOXDASSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@H]1CN(Cc2ccc(C)cc2)CCCO1	ZINC001150140167	1379501590	/nfs/dbraw/zinc/50/15/90/1379501590.db2.gz	QMFNAMLJUZULML-QUCCMNQESA-N	0	3	344.499	3.304	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@@H]1CN(CC2=CCCCC2)CCCO1	ZINC001150247882	1379522563	/nfs/dbraw/zinc/52/25/63/1379522563.db2.gz	RFSPFXYVBCHEKX-QUCCMNQESA-N	0	3	334.504	3.296	20	30		EGEDHN
C#CCCN1CCCO[C@@H](CNC(=O)[C@@H](CC)CC2CCCCC2)C1	ZINC001150404220	1379549825	/nfs/dbraw/zinc/54/98/25/1379549825.db2.gz	WDIUKMOCSIAIIZ-PMACEKPBSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)C[C@H](C)C2CCCCC2)C1	ZINC001150436305	1379552488	/nfs/dbraw/zinc/55/24/88/1379552488.db2.gz	QTBKVKSDIRQKMV-PKOBYXMFSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)C2(CC(C)C)CCCC2)C1	ZINC001150453290	1379554690	/nfs/dbraw/zinc/55/46/90/1379554690.db2.gz	QEGKWYGAOBTVNL-GOSISDBHSA-N	0	3	336.520	3.376	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)Cc2ccc3ccccc3c2)cc1	ZINC001150484291	1379556262	/nfs/dbraw/zinc/55/62/62/1379556262.db2.gz	BUTADDICRNILSK-UHFFFAOYSA-N	0	3	343.430	3.160	20	30		EGEDHN
C=C[C@@H](C(=O)NC[C@H]1CN(CC=C(C)C)CCCO1)c1ccccc1	ZINC001150751535	1379606810	/nfs/dbraw/zinc/60/68/10/1379606810.db2.gz	GQINSQXXPNEVTK-VQTJNVASSA-N	0	3	342.483	3.130	20	30		EGEDHN
C=C[C@H](CC(=O)NC[C@@H]1CN(CC(=C)C)CCCO1)c1ccccc1	ZINC001150770378	1379611537	/nfs/dbraw/zinc/61/15/37/1379611537.db2.gz	FHHIYPGTDFYRNJ-UYAOXDASSA-N	0	3	342.483	3.130	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)CC2CCC(C)(C)CC2)C1	ZINC001150842277	1379621320	/nfs/dbraw/zinc/62/13/20/1379621320.db2.gz	RWMSDBDYYXRFSB-GOSISDBHSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H]2CN(CC=C(C)C)CCCO2)CCCC1	ZINC001150883952	1379625870	/nfs/dbraw/zinc/62/58/70/1379625870.db2.gz	KSGNDVIGVSGIQB-GOSISDBHSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@H](C)Cc2ccco2)CC1	ZINC001151356703	1379704186	/nfs/dbraw/zinc/70/41/86/1379704186.db2.gz	BAICDADRWMFETG-QGZVFWFLSA-N	0	3	348.487	3.022	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@@H](C)[C@H](C)C(C)(C)C)CC1	ZINC001151357027	1379705108	/nfs/dbraw/zinc/70/51/08/1379705108.db2.gz	OBJSXXPUKFXBEG-IRXDYDNUSA-N	0	3	338.536	3.478	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@H]2C[C@@]2(C)C(C)C)CC1	ZINC001151374876	1379706960	/nfs/dbraw/zinc/70/69/60/1379706960.db2.gz	PIEZGDBOGAJWQO-MJGOQNOKSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@@H]2CCCCC2(C)C)CC1	ZINC001151415212	1379716102	/nfs/dbraw/zinc/71/61/02/1379716102.db2.gz	IFQZVGWOFGBIMH-KRWDZBQOSA-N	0	3	336.520	3.376	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)C1CCCC1	ZINC001151481283	1379724715	/nfs/dbraw/zinc/72/47/15/1379724715.db2.gz	FGNYKOWEUXUGLH-CQSZACIVSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=C[C@@H](CC(=O)NCCNCc1cccc(C#N)c1)c1ccccc1	ZINC001151942330	1379820405	/nfs/dbraw/zinc/82/04/05/1379820405.db2.gz	FIRWMFMQIPRSJK-IBGZPJMESA-N	0	3	333.435	3.124	20	30		EGEDHN
C=CCC1(C(=O)NCCNCc2ccnc(Cl)c2)CCCCC1	ZINC001152010682	1379837533	/nfs/dbraw/zinc/83/75/33/1379837533.db2.gz	LSIZZSGDKBKKON-UHFFFAOYSA-N	0	3	335.879	3.467	20	30		EGEDHN
Cc1cccc2cc(C(=O)NCCNCc3ccc(C#N)s3)oc21	ZINC001152639290	1379960459	/nfs/dbraw/zinc/96/04/59/1379960459.db2.gz	GBTKZZVJTKJWTL-UHFFFAOYSA-N	0	3	339.420	3.194	20	30		EGEDHN
C[C@H]1CCCC[C@@H]1CC(=O)NCCNCc1ccc(C#N)c(F)c1	ZINC001153251416	1380044663	/nfs/dbraw/zinc/04/46/63/1380044663.db2.gz	BHCPDEPLVBKREA-GOEBONIOSA-N	0	3	331.435	3.120	20	30		EGEDHN
C[C@@H]1CCCC[C@@H]1CC(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001153255320	1380045664	/nfs/dbraw/zinc/04/56/64/1380045664.db2.gz	ZNCXIDWRVJYREX-GDBMZVCRSA-N	0	3	331.435	3.120	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1cc(C(F)F)ccc1F	ZINC001153392981	1380069268	/nfs/dbraw/zinc/06/92/68/1380069268.db2.gz	DWFFQADVDXPJCU-GFCCVEGCSA-N	0	3	326.362	3.227	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1ccc(F)c(C(F)F)c1	ZINC001153407476	1380072057	/nfs/dbraw/zinc/07/20/57/1380072057.db2.gz	IVVUCAFZVVYQHN-GFCCVEGCSA-N	0	3	326.362	3.227	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)Cc1coc2ccc(C)cc12	ZINC001153632061	1380107475	/nfs/dbraw/zinc/10/74/75/1380107475.db2.gz	ZNHJZRWHJIDEPV-MRXNPFEDSA-N	0	3	326.440	3.134	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1cc2c(ccc(C)c2C)[nH]1	ZINC001154602088	1380315243	/nfs/dbraw/zinc/31/52/43/1380315243.db2.gz	RMFLMXVXMILIBO-OAHLLOKOSA-N	0	3	325.456	3.248	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H](C)N(CC)CCOc1ccccc1F	ZINC001154605980	1380315363	/nfs/dbraw/zinc/31/53/63/1380315363.db2.gz	VGAHMWPJCXGPSZ-OAHLLOKOSA-N	0	3	336.451	3.243	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H](C)N(CC)CCOc1ccccc1F	ZINC001154927894	1380377919	/nfs/dbraw/zinc/37/79/19/1380377919.db2.gz	RSTYIEQQHYGQNS-MRXNPFEDSA-N	0	3	336.451	3.387	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1ccc(F)c2ccccc12	ZINC001155383130	1380444212	/nfs/dbraw/zinc/44/42/12/1380444212.db2.gz	LIKRHIALZNCXCN-OAHLLOKOSA-N	0	3	326.415	3.442	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NCCCNCc1ccc(F)cc1Cl	ZINC001155427268	1380451577	/nfs/dbraw/zinc/45/15/77/1380451577.db2.gz	PIRXRKWJBKVVFD-ZDUSSCGKSA-N	0	3	342.842	3.056	20	30		EGEDHN
C=CCCC(=O)NCCCNCC(=O)Nc1c(C)cccc1C(C)C	ZINC001155593731	1380471379	/nfs/dbraw/zinc/47/13/79/1380471379.db2.gz	PJGMCHOZAGTIFU-UHFFFAOYSA-N	0	3	345.487	3.119	20	30		EGEDHN
CCN(CC#CCOC)[C@H](C)CNC(=O)CC[C@H](C)c1ccccc1	ZINC001155644834	1380477986	/nfs/dbraw/zinc/47/79/86/1380477986.db2.gz	QAWGYSHFLHPUAI-RBUKOAKNSA-N	0	3	344.499	3.047	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)s1)[C@H](C)NC(=O)CCC(C)(F)F	ZINC001755239698	1440789212	/nfs/dbraw/zinc/78/92/12/1440789212.db2.gz	GFDUNEZCIJMURY-QWRGUYRKSA-N	0	3	329.416	3.038	20	30		EGEDHN
C#CCCCC(=O)NCCCNCc1ccc(Cl)cc1Cl	ZINC001157171244	1380793822	/nfs/dbraw/zinc/79/38/22/1380793822.db2.gz	SXQVVVCKUCEUNC-UHFFFAOYSA-N	0	3	327.255	3.393	20	30		EGEDHN
C#CCCCC(=O)NCCCNCc1c(Cl)cccc1Cl	ZINC001157183369	1380798974	/nfs/dbraw/zinc/79/89/74/1380798974.db2.gz	YMPGCVYTMRABLC-UHFFFAOYSA-N	0	3	327.255	3.393	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NC[C@@H](C)N(CC)Cc1ccc(Cl)cc1	ZINC001157216898	1380813375	/nfs/dbraw/zinc/81/33/75/1380813375.db2.gz	BXUWJHAFOQDBDW-CABCVRRESA-N	0	3	338.879	3.258	20	30		EGEDHN
C=CCOCC(=O)N1CCCC[C@@H]1CN(C)[C@@H](C)c1cccc(F)c1	ZINC001157686801	1381002198	/nfs/dbraw/zinc/00/21/98/1381002198.db2.gz	LFRYOAZOECOYSA-QFBILLFUSA-N	0	3	348.462	3.402	20	30		EGEDHN
C=CCOCC(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(F)cc1C	ZINC001157705598	1381008895	/nfs/dbraw/zinc/00/88/95/1381008895.db2.gz	FSTNXQGAJDTCID-LJQANCHMSA-N	0	3	348.462	3.150	20	30		EGEDHN
C=CCOCC(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(C)c(F)c1	ZINC001157706336	1381009181	/nfs/dbraw/zinc/00/91/81/1381009181.db2.gz	YKCFVBJKPMFZIA-GOSISDBHSA-N	0	3	348.462	3.150	20	30		EGEDHN
CN(C/C=C/c1ccccc1)C[C@H]1CCCCN1C(=O)C#CC1CC1	ZINC001157920078	1381071520	/nfs/dbraw/zinc/07/15/20/1381071520.db2.gz	QUQUAERSJKQMQM-TYOLEZHBSA-N	0	3	336.479	3.426	20	30		EGEDHN
CN(CCc1ccccc1F)C[C@H]1CCCCN1C(=O)C#CC1CC1	ZINC001157925133	1381073641	/nfs/dbraw/zinc/07/36/41/1381073641.db2.gz	IRGIRFGDNIHVRI-LJQANCHMSA-N	0	3	342.458	3.095	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1CC[C@@H]2C[C@@H]2CC1	ZINC001158255106	1381175759	/nfs/dbraw/zinc/17/57/59/1381175759.db2.gz	SOWXBEJZKIIVEA-YSTOQKLRSA-N	0	3	348.531	3.328	20	30		EGEDHN
C#CCCCCCC(=O)N1CCCC[C@@H]1CN(C)CCOCC1CC1	ZINC001158316467	1381198410	/nfs/dbraw/zinc/19/84/10/1381198410.db2.gz	KZQBASNUDGYGGO-HXUWFJFHSA-N	0	3	348.531	3.310	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCCC[C@@H]1CN(C)CCOCC1CC1	ZINC001158377166	1381225443	/nfs/dbraw/zinc/22/54/43/1381225443.db2.gz	HOPCUIFQIYPIKY-IEBWSBKVSA-N	0	3	336.520	3.328	20	30		EGEDHN
CN1CCN(C(F)(F)c2nc(Cl)ccc2C#N)C2(CCCC2)C1	ZINC001158409859	1381235348	/nfs/dbraw/zinc/23/53/48/1381235348.db2.gz	DEZZEFUPDNGJJB-UHFFFAOYSA-N	0	3	340.805	3.216	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc2c(c1)C[C@H](C)O2	ZINC001158605309	1381315632	/nfs/dbraw/zinc/31/56/32/1381315632.db2.gz	UQRHHYYQOAGCDB-MAUKXSAKSA-N	0	3	328.456	3.123	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cnn(C2CCCC2)c1C	ZINC001158732759	1381375502	/nfs/dbraw/zinc/37/55/02/1381375502.db2.gz	ZIMRRCTVYIVHIU-GOSISDBHSA-N	0	3	344.503	3.419	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)COc1ccc(Cl)cc1	ZINC001158811934	1381410764	/nfs/dbraw/zinc/41/07/64/1381410764.db2.gz	UHEIHRVYMNIDAP-MRXNPFEDSA-N	0	3	336.863	3.218	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NCCCNCc1oc(CCC)nc1C	ZINC001158857086	1381437237	/nfs/dbraw/zinc/43/72/37/1381437237.db2.gz	NTOHVSBDMDEFHZ-UHFFFAOYSA-N	0	3	341.883	3.310	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc(-c2ccc(C)o2)n[nH]1	ZINC001158856457	1381437582	/nfs/dbraw/zinc/43/75/82/1381437582.db2.gz	HTXHHUZGBZDSDU-OAHLLOKOSA-N	0	3	342.443	3.091	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H](OC)c1ccc(F)cc1	ZINC001158942512	1381475444	/nfs/dbraw/zinc/47/54/44/1381475444.db2.gz	KAWSUTIUQREPSJ-QZTJIDSGSA-N	0	3	334.435	3.012	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCC1=CCN(CCc2ccccc2Cl)CC1	ZINC001159595619	1381842464	/nfs/dbraw/zinc/84/24/64/1381842464.db2.gz	ZMRNQSUTWAKUEG-HNNXBMFYSA-N	0	3	345.874	3.181	20	30		EGEDHN
C=CCOCC(=O)NCCC1=CCN([C@H](C)c2cccc(F)c2)CC1	ZINC001159619029	1381850117	/nfs/dbraw/zinc/85/01/17/1381850117.db2.gz	SUOGRJARKWGTOB-MRXNPFEDSA-N	0	3	346.446	3.228	20	30		EGEDHN
CN(C)Cc1ccnc(NC2(C#N)CCN(Cc3ccccc3)CC2)c1	ZINC001160107006	1381998153	/nfs/dbraw/zinc/99/81/53/1381998153.db2.gz	DJKVZUSXRHZOOM-UHFFFAOYSA-N	0	3	349.482	3.113	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)N1CC[C@@H]1COCc1ccccc1	ZINC001160527091	1382131983	/nfs/dbraw/zinc/13/19/83/1382131983.db2.gz	PLNDSSCODHNRCJ-MOPGFXCFSA-N	0	3	330.472	3.268	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCC1=CCN(Cc2cccnc2C)CC1	ZINC001160942461	1382245882	/nfs/dbraw/zinc/24/58/82/1382245882.db2.gz	YYKHFMQISSMYMY-IRXDYDNUSA-N	0	3	341.499	3.487	20	30		EGEDHN
CC#CCCCC(=O)NCCC1=CCN(Cc2cccnc2C)CC1	ZINC001160954455	1382250272	/nfs/dbraw/zinc/25/02/72/1382250272.db2.gz	UAFOKHJNFJMUKB-UHFFFAOYSA-N	0	3	339.483	3.222	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCCC1=CCN(CCc2ccns2)CC1	ZINC001160967338	1382253700	/nfs/dbraw/zinc/25/37/00/1382253700.db2.gz	GLVVIMUFSAQZOA-MRXNPFEDSA-N	0	3	347.528	3.426	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@H]2CC[C@@H](C(F)(F)F)C2)CC1	ZINC001161021047	1382275510	/nfs/dbraw/zinc/27/55/10/1382275510.db2.gz	JZAANNYCHMOVAI-JKSUJKDBSA-N	0	3	342.405	3.127	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H]2CC[C@@H](C(F)(F)F)C2)CC1	ZINC001161021046	1382276015	/nfs/dbraw/zinc/27/60/15/1382276015.db2.gz	JZAANNYCHMOVAI-HZPDHXFCSA-N	0	3	342.405	3.127	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc(Cl)c(C)c2)CC1	ZINC001161084148	1382293262	/nfs/dbraw/zinc/29/32/62/1382293262.db2.gz	HTQOOSKOGJCBGB-UHFFFAOYSA-N	0	3	330.859	3.424	20	30		EGEDHN
C[C@@H]1C[C@H]1CC(=O)NCCC1=CCN(Cc2ccc(C#N)cc2)CC1	ZINC001161114541	1382302668	/nfs/dbraw/zinc/30/26/68/1382302668.db2.gz	ZXHVIIULJHZYSA-UZLBHIALSA-N	0	3	337.467	3.243	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)c2ccc(C)nc2)CC1	ZINC001328566930	1388775602	/nfs/dbraw/zinc/77/56/02/1388775602.db2.gz	BJOHHUHGKBENBW-UHFFFAOYSA-N	0	3	335.879	3.317	20	30		EGEDHN
C=CCOc1ccc(C(=O)NCCCNCC=C(Cl)Cl)cc1	ZINC001161162780	1382321361	/nfs/dbraw/zinc/32/13/61/1382321361.db2.gz	FNAOEVVFKHVUFF-UHFFFAOYSA-N	0	3	343.254	3.280	20	30		EGEDHN
CCCC[C@@](C)(F)C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001161290506	1382361617	/nfs/dbraw/zinc/36/16/17/1382361617.db2.gz	YCVIURYOXFBUSU-GOSISDBHSA-N	0	3	337.414	3.212	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cnccc2C(F)(F)F)CC1	ZINC001161336666	1382374707	/nfs/dbraw/zinc/37/47/07/1382374707.db2.gz	WKNBPXZECPZVMA-UHFFFAOYSA-N	0	3	339.361	3.038	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H]2C[C@H]2c2ccc(OC)cc2)CC1	ZINC001161422021	1382404799	/nfs/dbraw/zinc/40/47/99/1382404799.db2.gz	DQVNEGJVFUJQFE-VQTJNVASSA-N	0	3	340.467	3.123	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C(C)(C)CC(F)(F)F)CC1	ZINC001161655330	1382471813	/nfs/dbraw/zinc/47/18/13/1382471813.db2.gz	HCTRAOREODMHJJ-UHFFFAOYSA-N	0	3	330.394	3.127	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@H](CC)CC(F)(F)F)CC1	ZINC001161709220	1382486740	/nfs/dbraw/zinc/48/67/40/1382486740.db2.gz	VKWLXLDAOFITGH-OAHLLOKOSA-N	0	3	330.394	3.127	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc(C)nc3ccccc32)CC1	ZINC001161818167	1382518683	/nfs/dbraw/zinc/51/86/83/1382518683.db2.gz	PYEXJEDXQJWAFQ-UHFFFAOYSA-N	0	3	347.462	3.319	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@H](C)c2ccc(F)cc2F)CC1	ZINC001161904354	1382545532	/nfs/dbraw/zinc/54/55/32/1382545532.db2.gz	RCRRJDROXLAKNN-OAHLLOKOSA-N	0	3	346.421	3.230	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CCCOc2cccc(F)c2)CC1	ZINC001161904132	1382545737	/nfs/dbraw/zinc/54/57/37/1382545737.db2.gz	GIMXHCYPDMHSDT-UHFFFAOYSA-N	0	3	346.446	3.309	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H]2C[C@H]2c2cc(F)ccc2F)CC1	ZINC001161904172	1382545778	/nfs/dbraw/zinc/54/57/78/1382545778.db2.gz	HTJHGONLXBGQOI-WMZOPIPTSA-N	0	3	346.421	3.393	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C23CC(c4ccccc4)(C2)C3)CC1	ZINC001161963627	1382574011	/nfs/dbraw/zinc/57/40/11/1382574011.db2.gz	OEUMCUIVZCQSTO-UHFFFAOYSA-N	0	3	348.490	3.270	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C23CC(c4ccccc4)(C2)C3)CC1	ZINC001161963375	1382574220	/nfs/dbraw/zinc/57/42/20/1382574220.db2.gz	CRFAVWVOLLUXIM-UHFFFAOYSA-N	0	3	336.479	3.433	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@H](C)Cc2ccc(F)cc2)CC1	ZINC001161983208	1382586538	/nfs/dbraw/zinc/58/65/38/1382586538.db2.gz	WDUVGEKTHQCCBA-QGZVFWFLSA-N	0	3	342.458	3.166	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc(-c3ccccc3)[nH]2)CC1	ZINC001161986369	1382588362	/nfs/dbraw/zinc/58/83/62/1382588362.db2.gz	DCKSDHNZLPUIPN-UHFFFAOYSA-N	0	3	347.462	3.457	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2c[nH]c3ccc(F)cc23)CC1	ZINC001162012620	1382600829	/nfs/dbraw/zinc/60/08/29/1382600829.db2.gz	WURAUEMGDJMDPJ-UHFFFAOYSA-N	0	3	339.414	3.082	20	30		EGEDHN
Cc1ccc(C(=O)NCCCNCc2cc(C#N)ccc2F)cc1F	ZINC001162075382	1382620194	/nfs/dbraw/zinc/62/01/94/1382620194.db2.gz	GKVKEBSELAIOPP-UHFFFAOYSA-N	0	3	343.377	3.055	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC1(COC)CCN(C[C@H](F)CC)CC1	ZINC001162513447	1382778279	/nfs/dbraw/zinc/77/82/79/1382778279.db2.gz	NKTRLJZZFCXQLZ-MRXNPFEDSA-N	0	3	342.499	3.182	20	30		EGEDHN
C[C@H](N)c1nc2ccccc2n1-c1ccc(C#N)c(C(F)(F)F)n1	ZINC001162758297	1382861416	/nfs/dbraw/zinc/86/14/16/1382861416.db2.gz	HWLXJBYVBXFKPH-VIFPVBQESA-N	0	3	331.301	3.331	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CCCC2(CC2)C1	ZINC001162810642	1382881051	/nfs/dbraw/zinc/88/10/51/1382881051.db2.gz	OMFLCVXWCKEIQZ-HXUWFJFHSA-N	0	3	338.495	3.251	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C[C@H]1CCC(F)(F)C1	ZINC001162826262	1382887640	/nfs/dbraw/zinc/88/76/40/1382887640.db2.gz	BOABVWLWMNIJFF-GOSISDBHSA-N	0	3	348.437	3.106	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)Cc1ccc(C)cc1	ZINC001162856364	1382896412	/nfs/dbraw/zinc/89/64/12/1382896412.db2.gz	CODVNIQTHJWEGX-UHFFFAOYSA-N	0	3	348.490	3.222	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@]1(C)CCC[C@H]1C	ZINC001162918962	1382917157	/nfs/dbraw/zinc/91/71/57/1382917157.db2.gz	JLFRXDSXRCEHHI-DENIHFKCSA-N	0	3	340.511	3.497	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)c1occc1CC	ZINC001162919622	1382917173	/nfs/dbraw/zinc/91/71/73/1382917173.db2.gz	WUIPOYQHEXBKNX-UHFFFAOYSA-N	0	3	338.451	3.140	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H]1C[C@@H]1c1ccccc1	ZINC001162952350	1382925749	/nfs/dbraw/zinc/92/57/49/1382925749.db2.gz	MQWFYGGSPMZVFH-YADHBBJMSA-N	0	3	346.474	3.084	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H](C=C)c1ccccc1	ZINC001163001468	1382943803	/nfs/dbraw/zinc/94/38/03/1382943803.db2.gz	FEJHJYKWESWQDR-JOCHJYFZSA-N	0	3	346.474	3.250	20	30		EGEDHN
CCCC(=O)NCCC1(CNCC#Cc2ccccc2Cl)CC1	ZINC001163162648	1382980548	/nfs/dbraw/zinc/98/05/48/1382980548.db2.gz	VAAQUVVCBSKKBA-UHFFFAOYSA-N	0	3	332.875	3.368	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)[C@H]1CCCC[C@H]1C1CC1	ZINC001163171579	1382982840	/nfs/dbraw/zinc/98/28/40/1382982840.db2.gz	KXITXGVPKDWJDF-PMACEKPBSA-N	0	3	339.483	3.371	20	30		EGEDHN
N#Cc1nc(N[C@H]2CNCc3ccsc32)ccc1Br	ZINC001163228436	1382999571	/nfs/dbraw/zinc/99/95/71/1382999571.db2.gz	BBKAWPPFNMTTKP-NSHDSACASA-N	0	3	335.230	3.034	20	30		EGEDHN
N=C(Nc1ccc(Cn2cncn2)cc1)c1ccc(C(F)(F)F)cc1	ZINC001163679983	1383104176	/nfs/dbraw/zinc/10/41/76/1383104176.db2.gz	HATOXEIFHMJTEK-UHFFFAOYSA-N	0	3	345.328	3.382	20	30		EGEDHN
N#Cc1ccc(F)c(CNCC2(CCNC(=O)CCC3CC3)CC2)c1	ZINC001163899679	1383134194	/nfs/dbraw/zinc/13/41/94/1383134194.db2.gz	IOKVZOVEBHUHOS-UHFFFAOYSA-N	0	3	343.446	3.264	20	30		EGEDHN
C#CCCCCC(=O)NCCC1(CNCc2cccc(Cl)n2)CC1	ZINC001164165977	1383161965	/nfs/dbraw/zinc/16/19/65/1383161965.db2.gz	HNGIWJXUQYGUET-UHFFFAOYSA-N	0	3	347.890	3.305	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)CCO[C@H](C)CC(C)C)CC1	ZINC001164519925	1383195545	/nfs/dbraw/zinc/19/55/45/1383195545.db2.gz	WRSPTRNQIUWYTC-MRXNPFEDSA-N	0	3	344.927	3.456	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2nc(C(C)C)oc2C)CC1	ZINC001164524650	1383196171	/nfs/dbraw/zinc/19/61/71/1383196171.db2.gz	WRKQZCDAKNEOHA-UHFFFAOYSA-N	0	3	339.867	3.349	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)Cc2c(C)cccc2C)CC1	ZINC001165244903	1383257124	/nfs/dbraw/zinc/25/71/24/1383257124.db2.gz	NLHMORYIFRZYHW-UHFFFAOYSA-N	0	3	334.891	3.475	20	30		EGEDHN
C[C@@H]1CCCC[C@H]1C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001165410516	1383289412	/nfs/dbraw/zinc/28/94/12/1383289412.db2.gz	QBSBFIOKNGNVLY-RHSMWYFYSA-N	0	3	331.435	3.120	20	30		EGEDHN
C[C@@H]1CCC[C@@H](C(=O)NCCCNCc2cc(C#N)ccc2F)C1	ZINC001165423258	1383292992	/nfs/dbraw/zinc/29/29/92/1383292992.db2.gz	GKNZLUCPXBNZCQ-GDBMZVCRSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)[C@H](C)CCc1ccccc1F	ZINC001166469177	1383425038	/nfs/dbraw/zinc/42/50/38/1383425038.db2.gz	DGSLVTGSGSVKFE-CYBMUJFWSA-N	0	3	326.843	3.243	20	30		EGEDHN
C#CCCCCCC(=O)NCCC1(CNCc2ccns2)CC1	ZINC001166579606	1383440728	/nfs/dbraw/zinc/44/07/28/1383440728.db2.gz	LHOHJWFQMCTEGJ-UHFFFAOYSA-N	0	3	333.501	3.103	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCC1(CNCc2nc(C)cs2)CC1	ZINC001166692127	1383461546	/nfs/dbraw/zinc/46/15/46/1383461546.db2.gz	AZWWWDXMHUKQLO-HIFRSBDPSA-N	0	3	335.517	3.286	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001166696170	1383462577	/nfs/dbraw/zinc/46/25/77/1383462577.db2.gz	XJNNQXKNSGPQGW-IAGOWNOFSA-N	0	3	339.483	3.393	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCC1(CNCc2c(C)onc2CC)CC1	ZINC001166696176	1383462623	/nfs/dbraw/zinc/46/26/23/1383462623.db2.gz	XORZVIWTOXIBSB-CABCVRRESA-N	0	3	347.503	3.380	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCCC1(CNCc2cc(OC)ccn2)CC1	ZINC001166746976	1383470372	/nfs/dbraw/zinc/47/03/72/1383470372.db2.gz	JCSXLJYZEAOWQF-INIZCTEOSA-N	0	3	345.487	3.069	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCCC1(CNCc2conc2CC)CC1	ZINC001166746218	1383470421	/nfs/dbraw/zinc/47/04/21/1383470421.db2.gz	DQIBRQSTRBRRIB-OAHLLOKOSA-N	0	3	333.476	3.215	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCCC1(CNCc2conc2CC)CC1	ZINC001166765259	1383474344	/nfs/dbraw/zinc/47/43/44/1383474344.db2.gz	JZCOYWUJRDVCCS-OAHLLOKOSA-N	0	3	333.476	3.215	20	30		EGEDHN
C[C@@H]1C[C@H]1CC(=O)NCCC1(CNCc2ccc(C#N)cc2F)CC1	ZINC001167013773	1383518854	/nfs/dbraw/zinc/51/88/54/1383518854.db2.gz	WXDACOLNBGGYRI-PBHICJAKSA-N	0	3	343.446	3.120	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCC2(CNCc3cc(C4CC4)no3)CC2)C1	ZINC001167129843	1383547156	/nfs/dbraw/zinc/54/71/56/1383547156.db2.gz	DUMSGTLTURDAJD-UHFFFAOYSA-N	0	3	343.471	3.284	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)CCCCc1ccc(F)cc1	ZINC001167292748	1383586793	/nfs/dbraw/zinc/58/67/93/1383586793.db2.gz	LRHRJUSGQJENJF-UHFFFAOYSA-N	0	3	326.843	3.387	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)CO[C@@H]2CCCC[C@H]2C)CC1	ZINC001167370026	1383612564	/nfs/dbraw/zinc/61/25/64/1383612564.db2.gz	DHTNWCZBMGRDGI-GDBMZVCRSA-N	0	3	342.911	3.210	20	30		EGEDHN
C[C@H]1CC[C@@H](C(=O)NCCC2(CNCc3ccccc3C#N)CC2)C1	ZINC001167382405	1383617509	/nfs/dbraw/zinc/61/75/09/1383617509.db2.gz	UUIPZHGZQCJPBC-DLBZAZTESA-N	0	3	339.483	3.371	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)C(C)(C)c1cccc(Cl)c1	ZINC001167399759	1383623508	/nfs/dbraw/zinc/62/35/08/1383623508.db2.gz	WMAKAGUVJNKCCN-UHFFFAOYSA-N	0	3	329.271	3.466	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cc([C@H](C)CC)no2)CC1	ZINC001167411841	1383627050	/nfs/dbraw/zinc/62/70/50/1383627050.db2.gz	XFUKZZZKKJYNHC-GFCCVEGCSA-N	0	3	339.867	3.430	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@@H]2CCO[C@@H](C(C)C)C2)CC1	ZINC001167652356	1383698837	/nfs/dbraw/zinc/69/88/37/1383698837.db2.gz	YFMCYOYFPKAUBB-HZPDHXFCSA-N	0	3	342.911	3.066	20	30		EGEDHN
C[C@H](Nc1cncc([C@@H]2CN3CCC2CC3)n1)c1cccc(C#N)c1	ZINC001167707333	1383718454	/nfs/dbraw/zinc/71/84/54/1383718454.db2.gz	QCBKJMPHUBWYCF-KBXCAEBGSA-N	0	3	333.439	3.331	20	30		EGEDHN
C=CCOC(=O)[C@@H](Nc1cncc(CN(CC)CC)c1)[C@@H](C)CC	ZINC001167957758	1383778927	/nfs/dbraw/zinc/77/89/27/1383778927.db2.gz	PIEFWCYMOYOLOA-YJBOKZPZSA-N	0	3	333.476	3.479	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1cccc(C)c1Cl	ZINC001168782036	1384002648	/nfs/dbraw/zinc/00/26/48/1384002648.db2.gz	UHIBWSQMPPRIPZ-UHFFFAOYSA-N	0	3	345.668	3.267	20	30		EGEDHN
CC[C@H](CN(C)C[C@H](O)CC#N)Oc1ccc(Cl)c(Cl)c1	ZINC001169353273	1384139293	/nfs/dbraw/zinc/13/92/93/1384139293.db2.gz	MXRDNWOSVPTGAU-VXGBXAGGSA-N	0	3	331.243	3.357	20	30		EGEDHN
CCCSCC(=O)N[C@@H](C)CCCCNCc1ccccc1C#N	ZINC001169471085	1384151517	/nfs/dbraw/zinc/15/15/17/1384151517.db2.gz	WMECUJOGADUOJE-INIZCTEOSA-N	0	3	347.528	3.466	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)CC(F)(F)F	ZINC001169588805	1384162433	/nfs/dbraw/zinc/16/24/33/1384162433.db2.gz	CTPMACZDECKHBT-CYBMUJFWSA-N	0	3	341.377	3.275	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@@H](C)CCCCNCc1nsc2ccccc12	ZINC001169822188	1384189145	/nfs/dbraw/zinc/18/91/45/1384189145.db2.gz	RRKWCHCQSUGXHP-KGLIPLIRSA-N	0	3	344.484	3.221	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)C1CC=CC1	ZINC001169926739	1384199398	/nfs/dbraw/zinc/19/93/98/1384199398.db2.gz	BKMRDBBAQSGQAQ-MRXNPFEDSA-N	0	3	325.456	3.289	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)COC(C)(C)C	ZINC001170292794	1384283762	/nfs/dbraw/zinc/28/37/62/1384283762.db2.gz	JOGKGXZBLNGJPO-INIZCTEOSA-N	0	3	345.487	3.138	20	30		EGEDHN
C[C@H](C(=O)NCCCNCc1cc(C#N)ccc1F)C1CCCC1	ZINC001170756780	1384380145	/nfs/dbraw/zinc/38/01/45/1384380145.db2.gz	QIRFCWVBHOXLSF-AWEZNQCLSA-N	0	3	331.435	3.120	20	30		EGEDHN
COc1cccc(N2CCN([C@@H](C)Cc3cccc(C#N)c3)CC2)c1	ZINC001171203677	1384468052	/nfs/dbraw/zinc/46/80/52/1384468052.db2.gz	OUTXGDRHJUYXKW-KRWDZBQOSA-N	0	3	335.451	3.320	20	30		EGEDHN
COc1cccc(N2CCN([C@H](C)Cc3cccc(C#N)c3)CC2)c1	ZINC001171203678	1384468076	/nfs/dbraw/zinc/46/80/76/1384468076.db2.gz	OUTXGDRHJUYXKW-QGZVFWFLSA-N	0	3	335.451	3.320	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1CCCC[C@](O)(C(F)(F)F)C1	ZINC001171208550	1384469188	/nfs/dbraw/zinc/46/91/88/1384469188.db2.gz	DEXKYRMYYNGVHF-CZUORRHYSA-N	0	3	326.362	3.269	20	30		EGEDHN
Cc1ccnc(OC2CCN([C@H](C)Cc3cccc(C#N)c3)CC2)n1	ZINC001171230022	1384474628	/nfs/dbraw/zinc/47/46/28/1384474628.db2.gz	ARLQMSKIFWZALW-MRXNPFEDSA-N	0	3	336.439	3.131	20	30		EGEDHN
CC[C@@H](N[C@@H]1CC(=O)N(C(=O)OC(C)(C)C)C1)c1cccc(C#N)c1	ZINC001171694274	1384604907	/nfs/dbraw/zinc/60/49/07/1384604907.db2.gz	OAUQJIGPENZNMM-HZPDHXFCSA-N	0	3	343.427	3.135	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1CCN(CCCOc2ccc(F)cc2)C1	ZINC001316981144	1384739677	/nfs/dbraw/zinc/73/96/77/1384739677.db2.gz	RMKXAURICJNCOA-KRWDZBQOSA-N	0	3	334.435	3.141	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)n1nc(C(F)(F)F)c2c1CCNC2	ZINC001172310972	1384766328	/nfs/dbraw/zinc/76/63/28/1384766328.db2.gz	MRRXXANQIAFYQB-LLVKDONJSA-N	0	3	334.345	3.223	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@H]1C[C@H](N[C@H](C)c2cc(Cl)ccc2Cl)C1	ZINC001317073717	1384841269	/nfs/dbraw/zinc/84/12/69/1384841269.db2.gz	UVCNNNRZTNIVLN-FPQZTECRSA-N	0	3	340.254	3.451	20	30		EGEDHN
C[C@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C#N)C1)c1cccc(O)c1	ZINC001172972206	1384892675	/nfs/dbraw/zinc/89/26/75/1384892675.db2.gz	XLVGUGVMOUXOSG-IMJJTQAJSA-N	0	3	345.443	3.334	20	30		EGEDHN
C[C@@H]([NH2+][C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C#N)C1)c1ccccc1[O-]	ZINC001172976745	1384894551	/nfs/dbraw/zinc/89/45/51/1384894551.db2.gz	TWRMYAMGFQLNCE-KFWWJZLASA-N	0	3	345.443	3.334	20	30		EGEDHN
C[C@@H](N[C@H]1CCN(C(=O)OC(C)(C)C)[C@H](C#N)C1)c1cncc(F)c1	ZINC001172980622	1384894598	/nfs/dbraw/zinc/89/45/98/1384894598.db2.gz	ZJITUADDDARMED-KCXAZCMYSA-N	0	3	348.422	3.163	20	30		EGEDHN
C=CCN1CCN([C@@H](C)Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC001173083810	1384910425	/nfs/dbraw/zinc/91/04/25/1384910425.db2.gz	QKWORPIRAPOWDH-AWEZNQCLSA-N	0	3	328.378	3.320	20	30		EGEDHN
C=CCOC1CCC(N2CCN(Cc3ccccc3F)CC2)CC1	ZINC001173320015	1384957559	/nfs/dbraw/zinc/95/75/59/1384957559.db2.gz	DYUFMUSEESQHFL-UHFFFAOYSA-N	0	3	332.463	3.457	20	30		EGEDHN
N#CC1CCN(C2CCN(C(=O)c3ccc(F)c(Cl)c3)CC2)CC1	ZINC001173776971	1385015490	/nfs/dbraw/zinc/01/54/90/1385015490.db2.gz	BGXWTMYDRGDBMY-UHFFFAOYSA-N	0	3	349.837	3.319	20	30		EGEDHN
CCc1ccsc1C(=O)NC[C@H](C)NCc1ccc(F)c(C#N)c1	ZINC001317294608	1385067192	/nfs/dbraw/zinc/06/71/92/1385067192.db2.gz	NRDYMZMBESHGHD-LBPRGKRZSA-N	0	3	345.443	3.229	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)Cc1ccc2c(c1)CCCC2	ZINC001317413765	1385124351	/nfs/dbraw/zinc/12/43/51/1385124351.db2.gz	DXSQTVQQOYZPPE-OAHLLOKOSA-N	0	3	334.891	3.345	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H](C)CCCCN[C@@H](C)c1nnc(CC)[nH]1	ZINC001174672843	1385132375	/nfs/dbraw/zinc/13/23/75/1385132375.db2.gz	RDDFTDYQRBRIST-CABCVRRESA-N	0	3	349.523	3.295	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H](C)CCCCNCc1cc(OC)no1	ZINC001174694291	1385135459	/nfs/dbraw/zinc/13/54/59/1385135459.db2.gz	LBSDSXCOMZNNSG-MRXNPFEDSA-N	0	3	349.475	3.032	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H](C)CCCCN[C@@H](C)c1nnc(C)[nH]1	ZINC001174694410	1385135637	/nfs/dbraw/zinc/13/56/37/1385135637.db2.gz	ODJXRADIKHDHQY-CVEARBPZSA-N	0	3	347.507	3.022	20	30		EGEDHN
C[C@@H](CCCCNCc1cc(F)ccc1C#N)NC(=O)CCCF	ZINC001174759376	1385145371	/nfs/dbraw/zinc/14/53/71/1385145371.db2.gz	WJMKMRQFTPGPAP-AWEZNQCLSA-N	0	3	337.414	3.212	20	30		EGEDHN
C=CCCCC(=O)N[C@H](C)CCCCNCc1nccn1C(F)F	ZINC001174985920	1385179019	/nfs/dbraw/zinc/17/90/19/1385179019.db2.gz	CXYWHFSUUOZRBG-CQSZACIVSA-N	0	3	342.434	3.399	20	30		EGEDHN
CCc1ccc(C(=O)NCCCNCc2cc(C#N)ccc2F)cc1	ZINC001175085348	1385192520	/nfs/dbraw/zinc/19/25/20/1385192520.db2.gz	PBCSJBXPNCJZBT-UHFFFAOYSA-N	0	3	339.414	3.169	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H](C)CCCCN[C@H](C)c2nnc(CC)[nH]2)C1	ZINC001175158989	1385208399	/nfs/dbraw/zinc/20/83/99/1385208399.db2.gz	MLLXVZKFTBYQFM-HUUCEWRRSA-N	0	3	347.507	3.049	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H](C)CCCCN[C@H](C)c1nnc(CC)[nH]1	ZINC001175469039	1385302175	/nfs/dbraw/zinc/30/21/75/1385302175.db2.gz	MGYMCUOHZFKYBR-HUUCEWRRSA-N	0	3	349.523	3.295	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)CCCc1cccs1	ZINC001175515705	1385317813	/nfs/dbraw/zinc/31/78/13/1385317813.db2.gz	XTJVVOUPGZQZOU-UHFFFAOYSA-N	0	3	341.480	3.239	20	30		EGEDHN
CCN1CCN(c2ccc(Nc3cc(C#N)ccc3OC)cc2)CC1	ZINC001175782266	1385403135	/nfs/dbraw/zinc/40/31/35/1385403135.db2.gz	REEQQCLZTFUWIG-UHFFFAOYSA-N	0	3	336.439	3.452	20	30		EGEDHN
CCN1CCN(c2ccc(Nc3c(C#N)cnn3C(C)C)cc2)CC1	ZINC001175783852	1385404488	/nfs/dbraw/zinc/40/44/88/1385404488.db2.gz	XMPDLTOTSFVLLC-UHFFFAOYSA-N	0	3	338.459	3.221	20	30		EGEDHN
C=CCC1(C(=O)NCCCNCc2nccn2CC)CCCCC1	ZINC001176785370	1385696653	/nfs/dbraw/zinc/69/66/53/1385696653.db2.gz	CCRSVNYQOHQLIQ-UHFFFAOYSA-N	0	3	332.492	3.026	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@@H]1C[C@H]1OCC	ZINC001177235907	1385879312	/nfs/dbraw/zinc/87/93/12/1385879312.db2.gz	PUNAFYJDZPKDDL-IAGOWNOFSA-N	0	3	342.911	3.162	20	30		EGEDHN
C[C@H]1CCCC[C@H]1CC(=O)NCCCNCc1ccccc1C#N	ZINC001177309868	1385907782	/nfs/dbraw/zinc/90/77/82/1385907782.db2.gz	JRAFEWZVKIQUTD-IRXDYDNUSA-N	0	3	327.472	3.371	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@]1(C)CCOC1	ZINC001177449100	1385960294	/nfs/dbraw/zinc/96/02/94/1385960294.db2.gz	ZZGRZCROHRCENH-GOSISDBHSA-N	0	3	342.911	3.164	20	30		EGEDHN
C=CCC[C@@H](C(=O)NCCCNCc1cc(C)no1)c1ccccc1	ZINC001177548141	1385993000	/nfs/dbraw/zinc/99/30/00/1385993000.db2.gz	RHUWRFDSQQTEHK-LJQANCHMSA-N	0	3	341.455	3.329	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)C2=CCCC2)CCCC1	ZINC001319350881	1386073016	/nfs/dbraw/zinc/07/30/16/1386073016.db2.gz	GCUGJOQHWRLYHW-UHFFFAOYSA-N	0	3	327.266	3.024	20	30		EGEDHN
Cc1nc(Cl)c(NC(=O)C(C#N)Cc2cccs2)c(Cl)n1	ZINC001177903578	1386078394	/nfs/dbraw/zinc/07/83/94/1386078394.db2.gz	IOPMSLLINBLWAJ-MRVPVSSYSA-N	0	3	341.223	3.474	20	30		EGEDHN
N#CC(Cc1cccs1)C(=O)Nc1cccc(C(F)(F)F)n1	ZINC001177904743	1386078941	/nfs/dbraw/zinc/07/89/41/1386078941.db2.gz	RYLFPPNLQSTPQU-SECBINFHSA-N	0	3	325.315	3.483	20	30		EGEDHN
CCOC(=O)c1c(NC(=O)C(C#N)Cc2cccs2)ccn1CC	ZINC001177905168	1386079258	/nfs/dbraw/zinc/07/92/58/1386079258.db2.gz	WQMGFUVKXDTMIP-GFCCVEGCSA-N	0	3	345.424	3.067	20	30		EGEDHN
C[C@@H](C(=O)NC1(CNCc2ccc(C#N)cc2F)CCCC1)C1CC1	ZINC001698628093	1406270001	/nfs/dbraw/zinc/27/00/01/1406270001.db2.gz	PXFZYWYTRDYPEZ-CQSZACIVSA-N	0	3	343.446	3.262	20	30		EGEDHN
C/C(=C/C(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@@H]1C)C1CC1	ZINC001178233775	1386167813	/nfs/dbraw/zinc/16/78/13/1386167813.db2.gz	ALXGVSLPAKNRHT-DELIEXBPSA-N	0	3	340.442	3.113	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CC[C@H](NCc2cc(C)ccc2F)[C@@H]1C	ZINC001178278169	1386178890	/nfs/dbraw/zinc/17/88/90/1386178890.db2.gz	FRCZCIFVNODXFH-BXWFABGCSA-N	0	3	348.462	3.194	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2Cl)CCN1C(=O)CC1CCC1	ZINC001178413957	1386210040	/nfs/dbraw/zinc/21/00/40/1386210040.db2.gz	BFXHFQVCNIBTQS-KXBFYZLASA-N	0	3	344.886	3.461	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@H](NCc3ccc4cc[nH]c4c3)C2=O)cc1	ZINC001178468797	1386227495	/nfs/dbraw/zinc/22/74/95/1386227495.db2.gz	FMDHCFWQVOAWME-IBGZPJMESA-N	0	3	344.418	3.325	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2Cl)CCN1C(=O)CC1(C)CC1	ZINC001179164759	1386415913	/nfs/dbraw/zinc/41/59/13/1386415913.db2.gz	GUSZKGKWEBENRJ-YJBOKZPZSA-N	0	3	344.886	3.461	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1csc(CC(C)C)n1)C(C)C	ZINC001319967017	1386423458	/nfs/dbraw/zinc/42/34/58/1386423458.db2.gz	BSNRDTNXEWJHFH-ZDUSSCGKSA-N	0	3	343.924	3.438	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)[C@@H]1C	ZINC001179454631	1386485545	/nfs/dbraw/zinc/48/55/45/1386485545.db2.gz	DOFJFUAVQHBYGG-KSSFIOAISA-N	0	3	329.419	3.133	20	30		EGEDHN
C=C1CCC(C(=O)NCCCCCCNCc2cc(C)n(C)n2)CC1	ZINC001179474970	1386491877	/nfs/dbraw/zinc/49/18/77/1386491877.db2.gz	OEZXOXKMQBLWLW-UHFFFAOYSA-N	0	3	346.519	3.241	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCCCCCNCc1cc(OC)no1	ZINC001179481829	1386494041	/nfs/dbraw/zinc/49/40/41/1386494041.db2.gz	MTSSVAQKIVAEFK-SFHVURJKSA-N	0	3	337.464	3.052	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2cccc(Cl)c2)CCN1C(=O)[C@H]1CC12CC2	ZINC001179598636	1386528375	/nfs/dbraw/zinc/52/83/75/1386528375.db2.gz	KIWGHTQVQACFBN-QGTPRVQTSA-N	0	3	342.870	3.071	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@H](NCC#Cc3ccccc3)[C@@H]2C)cc1	ZINC001179998439	1386663654	/nfs/dbraw/zinc/66/36/54/1386663654.db2.gz	IBOKMBGMONMECT-RXVVDRJESA-N	0	3	332.447	3.239	20	30		EGEDHN
CN(CC(=O)Nc1ccc(N2CCCCC2)c(C#N)c1)C1CCCC1	ZINC001180629082	1386851206	/nfs/dbraw/zinc/85/12/06/1386851206.db2.gz	GLDMAURQMJHDHO-UHFFFAOYSA-N	0	3	340.471	3.361	20	30		EGEDHN
CC[C@@H](C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2ccccc2C#N)C1	ZINC001180633851	1386853852	/nfs/dbraw/zinc/85/38/52/1386853852.db2.gz	UPBYOTVDTOOKJY-JXXFODFXSA-N	0	3	327.472	3.179	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)Cc1cccc(F)c1C(F)(F)F	ZINC001181677780	1387037259	/nfs/dbraw/zinc/03/72/59/1387037259.db2.gz	MTGRRENWFKFYIK-ZDUSSCGKSA-N	0	3	344.352	3.154	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2ocnc2C)C1	ZINC001182305040	1387143036	/nfs/dbraw/zinc/14/30/36/1387143036.db2.gz	DERACJBCJCWHNW-SPYBWZPUSA-N	0	3	333.476	3.160	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](O)c2ccccc2Br)cc1F	ZINC001182344405	1387153375	/nfs/dbraw/zinc/15/33/75/1387153375.db2.gz	JPRFLSHWKGZBJN-INIZCTEOSA-N	0	3	349.203	3.283	20	30		EGEDHN
CC(C)Oc1ccccc1CN[C@@H]1CCN(C(=O)C#CC(C)(C)C)C1	ZINC001182414443	1387163476	/nfs/dbraw/zinc/16/34/76/1387163476.db2.gz	LYSZRNNCMDYTRV-GOSISDBHSA-N	0	3	342.483	3.214	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@@H](NCc2ccc(Cl)c(Cl)c2)C1	ZINC001182432161	1387164990	/nfs/dbraw/zinc/16/49/90/1387164990.db2.gz	SOGIJOIZNQKLEE-CQSZACIVSA-N	0	3	339.266	3.343	20	30		EGEDHN
C[C@H](N[C@@H]1CCN(C(=O)C#CC(C)(C)C)C1)c1ccc(F)c(F)c1	ZINC001182440445	1387166654	/nfs/dbraw/zinc/16/66/54/1387166654.db2.gz	DWAKJYIHWNBHQE-DZGCQCFKSA-N	0	3	334.410	3.266	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H](C)[C@](C)(CNCc2cc(C)no2)C1	ZINC001182517727	1387180881	/nfs/dbraw/zinc/18/08/81/1387180881.db2.gz	WJGLITSWQNOZLE-NIKGAXFTSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001182841547	1387233499	/nfs/dbraw/zinc/23/34/99/1387233499.db2.gz	OBCDKBZFYZZPFL-GOSISDBHSA-N	0	3	341.430	3.156	20	30		EGEDHN
C=C(C)CCC(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1	ZINC001336374783	1389082621	/nfs/dbraw/zinc/08/26/21/1389082621.db2.gz	VTBHLRNXQXELMP-SFHVURJKSA-N	0	3	343.471	3.148	20	30		EGEDHN
Cc1sccc1CC(=O)NC[C@@H](C)CNCc1ccccc1C#N	ZINC001698764982	1406420621	/nfs/dbraw/zinc/42/06/21/1406420621.db2.gz	GLULAXMHGRTKGE-AWEZNQCLSA-N	0	3	341.480	3.013	20	30		EGEDHN
CCn1c(N2CCN(C(C)(C)CC)CC2)nnc1C(C#N)(CC)CC	ZINC001340070633	1390220230	/nfs/dbraw/zinc/22/02/30/1390220230.db2.gz	SJRXULGFMVNVJL-UHFFFAOYSA-N	0	3	346.523	3.190	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1cccc(OCc2cscn2)c1	ZINC001340201269	1390248609	/nfs/dbraw/zinc/24/86/09/1390248609.db2.gz	NCLCKMTWWKRTMM-INIZCTEOSA-N	0	3	331.441	3.344	20	30		EGEDHN
CC(C)NC(=O)Nc1ccccc1C(=O)C(C#N)c1cccc(F)n1	ZINC001342638330	1390635277	/nfs/dbraw/zinc/63/52/77/1390635277.db2.gz	BMUWULKXUVXVCB-CYBMUJFWSA-N	0	3	340.358	3.241	20	30		EGEDHN
CCOc1ccc(C(=O)C(C#N)c2nc(N)c3ccccc3n2)cc1	ZINC001343271100	1390703724	/nfs/dbraw/zinc/70/37/24/1390703724.db2.gz	AZBXORUVIFPXRT-OAHLLOKOSA-N	0	3	332.363	3.101	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)c2ccnc(Cl)c2)cc1	ZINC001343291073	1390705207	/nfs/dbraw/zinc/70/52/07/1390705207.db2.gz	DHJSRSZJESCYGO-CQSZACIVSA-N	0	3	327.771	3.259	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccc(OC(F)F)cc2F)nc(C)n1	ZINC001343575717	1390723820	/nfs/dbraw/zinc/72/38/20/1390723820.db2.gz	IWGQMOBMYFNDMF-LBPRGKRZSA-N	0	3	335.285	3.324	20	30		EGEDHN
Cn1c(Cl)cnc1C(C#N)C(=O)CCc1nc2ccccc2s1	ZINC001346095648	1390906927	/nfs/dbraw/zinc/90/69/27/1390906927.db2.gz	ICFGXUJGBKWWLA-JTQLQIEISA-N	0	3	344.827	3.492	20	30		EGEDHN
Cn1c(Cl)cnc1C(C#N)C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1F	ZINC001347339638	1391057354	/nfs/dbraw/zinc/05/73/54/1391057354.db2.gz	YPZZPTDEHNBJHK-QJPTWQEYSA-N	0	3	335.741	3.332	20	30		EGEDHN
C[C@@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)C1C(C)(C)C1(C)C	ZINC001698816255	1406505738	/nfs/dbraw/zinc/50/57/38/1406505738.db2.gz	RJMHYEUGMSQERU-ZDUSSCGKSA-N	0	3	345.462	3.316	20	30		EGEDHN
CC(C)(C)CC(=O)NC[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001488813937	1391728580	/nfs/dbraw/zinc/72/85/80/1391728580.db2.gz	ZDPIZJXLIMMAGB-KOMQPUFPSA-N	0	3	331.435	3.118	20	30		EGEDHN
CCN1CCN(c2ccc(NC(=O)C(C#N)(CC)CC)cc2)CC1	ZINC001352359831	1391787904	/nfs/dbraw/zinc/78/79/04/1391787904.db2.gz	GTTNMUHBSGBRGS-UHFFFAOYSA-N	0	3	328.460	3.097	20	30		EGEDHN
C=C(C)CCC(=O)NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC001354899271	1392176265	/nfs/dbraw/zinc/17/62/65/1392176265.db2.gz	KOYPRVWOMXOEEU-UHFFFAOYSA-N	0	3	343.471	3.082	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1cnc2cc[nH]c2c1	ZINC001479824373	1392413456	/nfs/dbraw/zinc/41/34/56/1392413456.db2.gz	MHXSPDQWYUAHOM-SUMWQHHRSA-N	0	3	346.862	3.288	20	30		EGEDHN
CC#CCCCC(=O)N1CCCC[C@H]1CNCc1ccc(Cl)nc1	ZINC001480358826	1392704482	/nfs/dbraw/zinc/70/44/82/1392704482.db2.gz	VUIYCFMOVAYYFJ-KRWDZBQOSA-N	0	3	347.890	3.399	20	30		EGEDHN
CCCC1(C(=O)NC[C@H](C)NCc2ccc(OC)c(C#N)c2)CCC1	ZINC001480518017	1392776223	/nfs/dbraw/zinc/77/62/23/1392776223.db2.gz	KZEOXQAPBLIHIW-HNNXBMFYSA-N	0	3	343.471	3.132	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@@H](C)NCc2ccc(C#N)s2)c(Cl)c1	ZINC001480540876	1392785489	/nfs/dbraw/zinc/78/54/89/1392785489.db2.gz	XMRAEJDPYARXQE-GFCCVEGCSA-N	0	3	347.871	3.490	20	30		EGEDHN
N#Cc1ccc(CNCC2(NC(=O)CC3CCC3)CCCC2)c(F)c1	ZINC001481890845	1394581290	/nfs/dbraw/zinc/58/12/90/1394581290.db2.gz	HFAPWIVRWOBQCZ-UHFFFAOYSA-N	0	3	343.446	3.406	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2ccc(N(C)C)cc2)CCCC1	ZINC001481911858	1394592506	/nfs/dbraw/zinc/59/25/06/1394592506.db2.gz	MSKMSTAFLFQOPS-UHFFFAOYSA-N	0	3	335.879	3.137	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1ccc(C(F)F)nc1)C1CC1	ZINC001481931332	1394601101	/nfs/dbraw/zinc/60/11/01/1394601101.db2.gz	SRLPQLSFHZDSMV-MRXNPFEDSA-N	0	3	343.805	3.260	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2ccc(F)cn2)CCCC[C@@H]1C	ZINC001481955295	1394617113	/nfs/dbraw/zinc/61/71/13/1394617113.db2.gz	DWWJKLZGVNGVOV-YVEFUNNKSA-N	0	3	339.842	3.242	20	30		EGEDHN
CC1(CCC(=O)N2CCC[C@@H]2CNCC#Cc2ccc(F)cc2)CC1	ZINC001482065858	1394727291	/nfs/dbraw/zinc/72/72/91/1394727291.db2.gz	UQUAOBXMSKTCQZ-LJQANCHMSA-N	0	3	342.458	3.338	20	30		EGEDHN
Cc1cc(C(=O)N(C)[C@@H](C)CNCc2ccc(F)c(C#N)c2)c(C)o1	ZINC001482256128	1394850909	/nfs/dbraw/zinc/85/09/09/1394850909.db2.gz	WHLZCJQSJSWKCD-LBPRGKRZSA-N	0	3	343.402	3.158	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)CCc1ccc(F)cc1)C(C)C	ZINC001698966892	1406726750	/nfs/dbraw/zinc/72/67/50/1406726750.db2.gz	YYYNPXCITDFHEY-MRXNPFEDSA-N	0	3	326.843	3.241	20	30		EGEDHN
CC(C)C[C@H](CNCc1ccc(C#N)s1)NC(=O)[C@H]1CC1(C)C	ZINC001482382686	1394943693	/nfs/dbraw/zinc/94/36/93/1394943693.db2.gz	VAJWKCBYYFLTJW-CZUORRHYSA-N	0	3	333.501	3.286	20	30		EGEDHN
CCC(=O)N[C@H](CNCc1ccc(C#N)cc1F)C1CCCCC1	ZINC001482401999	1394963707	/nfs/dbraw/zinc/96/37/07/1394963707.db2.gz	HXFMXCXOODJRJJ-GOSISDBHSA-N	0	3	331.435	3.262	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)Cc1cc(C)ccc1F)C(C)C	ZINC001698979723	1406754847	/nfs/dbraw/zinc/75/48/47/1406754847.db2.gz	UYSNFRNFDBQSDP-INIZCTEOSA-N	0	3	326.843	3.160	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1cccc2nccnc21	ZINC001485262942	1395747820	/nfs/dbraw/zinc/74/78/20/1395747820.db2.gz	SMUMZMLJJZPRLG-UHFFFAOYSA-N	0	3	346.862	3.070	20	30		EGEDHN
Cc1cc(C(=O)NC[C@H](C)N(C)Cc2ccc(C#N)cc2)ccc1F	ZINC001485346211	1395818177	/nfs/dbraw/zinc/81/81/77/1395818177.db2.gz	RKKBQSKYJJQLTA-HNNXBMFYSA-N	0	3	339.414	3.256	20	30		EGEDHN
C[C@@H](CNC(=O)c1cccc2c1CCC2)N(C)Cc1ccc(C#N)cc1	ZINC001485391129	1395884149	/nfs/dbraw/zinc/88/41/49/1395884149.db2.gz	NWLJYDCMINRVGE-INIZCTEOSA-N	0	3	347.462	3.297	20	30		EGEDHN
CCCC[C@@H](CNCc1ccc(F)c(C#N)c1)NC(=O)C1CCC1	ZINC001485460275	1395934216	/nfs/dbraw/zinc/93/42/16/1395934216.db2.gz	LNJSGVOKNLVSFQ-KRWDZBQOSA-N	0	3	331.435	3.262	20	30		EGEDHN
C=C(Cl)CNCC1(O)CCN(C(=O)CC2(C)CCCCC2)CC1	ZINC001502877582	1396230968	/nfs/dbraw/zinc/23/09/68/1396230968.db2.gz	SDOOVFWOIIRHFS-UHFFFAOYSA-N	0	3	342.911	3.043	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccc(F)cc2F)CCCC1	ZINC001495957933	1396577884	/nfs/dbraw/zinc/57/78/84/1396577884.db2.gz	VANAFRWJZUSEBZ-UHFFFAOYSA-N	0	3	328.790	3.350	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1cnc(CC)s1	ZINC001689911261	1404203960	/nfs/dbraw/zinc/20/39/60/1404203960.db2.gz	DEFDHIYETWWSOB-OLZOCXBDSA-N	0	3	341.908	3.431	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1n[nH]c2ccccc21	ZINC001689911640	1404204935	/nfs/dbraw/zinc/20/49/35/1404204935.db2.gz	JJJKYJJRINCIAA-CJNGLKHVSA-N	0	3	346.862	3.288	20	30		EGEDHN
CC[C@H](c1ccc(F)cc1)N1CCC(N(C)C(=O)[C@H](C)C#N)CC1	ZINC001690018883	1404259176	/nfs/dbraw/zinc/25/91/76/1404259176.db2.gz	VFKBJZMSQWEMCB-RDTXWAMCSA-N	0	3	331.435	3.359	20	30		EGEDHN
C=C(Br)CN1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)CC1CC1)C2	ZINC001724596730	1424926554	/nfs/dbraw/zinc/92/65/54/1424926554.db2.gz	NJNGBWINEAREBA-QDMKHBRRSA-N	0	3	341.293	3.054	20	30		EGEDHN
CC(C)(CC(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1)C1CC1	ZINC001690274484	1404440742	/nfs/dbraw/zinc/44/07/42/1404440742.db2.gz	SCLOXTJKWZKGOK-QAQDUYKDSA-N	0	3	343.446	3.260	20	30		EGEDHN
CC1(CCC(=O)NC[C@@H]2CCCN(Cc3ccc(C#N)cc3)C2)CC1	ZINC001690391946	1404532112	/nfs/dbraw/zinc/53/21/12/1404532112.db2.gz	MJPKNXZQZDWLTK-IBGZPJMESA-N	0	3	339.483	3.467	20	30		EGEDHN
Cc1ccc(CC(=O)NC[C@@H]2CCN(Cc3ccc(C#N)cc3)C2)cc1	ZINC001691147540	1405080322	/nfs/dbraw/zinc/08/03/22/1405080322.db2.gz	AQPRDVMDCIZXEF-NRFANRHFSA-N	0	3	347.462	3.048	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)Cc2cccc(Cl)c2F)C1	ZINC001691167143	1405102577	/nfs/dbraw/zinc/10/25/77/1405102577.db2.gz	MSXXLKFHMMITJA-AULYBMBSSA-N	0	3	345.245	3.259	20	30		EGEDHN
C[C@H](C(=O)NC[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1)C(C)(C)C	ZINC001691450219	1405276098	/nfs/dbraw/zinc/27/60/98/1405276098.db2.gz	MFGFNIPDNBUGBN-UNEWFSDZSA-N	0	3	345.462	3.364	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)C(C)(C)C(C)C)C1	ZINC001691786255	1405494953	/nfs/dbraw/zinc/49/49/53/1405494953.db2.gz	UADQMNWPFQYTRH-JOCQHMNTSA-N	0	3	331.298	3.062	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CCN(CCCOc2ccc(Cl)cc2)C1	ZINC001692392171	1405994833	/nfs/dbraw/zinc/99/48/33/1405994833.db2.gz	GIIBFQHLIVXDJJ-INIZCTEOSA-N	0	3	336.863	3.266	20	30		EGEDHN
CC(C)CCC(=O)NCC[C@H]1CCN(Cc2ccccc2C#N)C1	ZINC001732044244	1428278083	/nfs/dbraw/zinc/27/80/83/1428278083.db2.gz	LEFJBOGAZNOWQR-KRWDZBQOSA-N	0	3	327.472	3.323	20	30		EGEDHN
N#Cc1ccccc1CN1CCC2(C1)CCN(C(=O)CCCF)CC2	ZINC001732329415	1428536380	/nfs/dbraw/zinc/53/63/80/1428536380.db2.gz	GWZSSBNTJXLNQH-UHFFFAOYSA-N	0	3	343.446	3.122	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)N(C)C(=O)CCc1cccs1	ZINC001732455968	1428589573	/nfs/dbraw/zinc/58/95/73/1428589573.db2.gz	AXPOMUWGIFDCSU-ZDUSSCGKSA-N	0	3	347.509	3.251	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)NC(=O)c1cccc2c1CCC2	ZINC001699433965	1412752980	/nfs/dbraw/zinc/75/29/80/1412752980.db2.gz	PBRGPQPVCDNLFJ-ZDUSSCGKSA-N	0	3	339.464	3.017	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](NC(=O)C2=CCCC2)C2CCCC2)s1	ZINC001699794013	1413201848	/nfs/dbraw/zinc/20/18/48/1413201848.db2.gz	YBHXYKRTFOKKTN-GOSISDBHSA-N	0	3	343.496	3.495	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1[nH]cnc1C(C)(C)C	ZINC001700439768	1414010330	/nfs/dbraw/zinc/01/03/30/1414010330.db2.gz	AVDMYYMIJIUEDG-UHFFFAOYSA-N	0	3	340.899	3.148	20	30		EGEDHN
C[C@@H](CNC(=O)c1cc2ccccc2[nH]1)N(C)Cc1ccc(C#N)cc1	ZINC001700484871	1414129030	/nfs/dbraw/zinc/12/90/30/1414129030.db2.gz	FHDPDGQBQIXTIB-HNNXBMFYSA-N	0	3	346.434	3.290	20	30		EGEDHN
CN(C(=O)c1ccccc1)[C@@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001700717463	1414376415	/nfs/dbraw/zinc/37/64/15/1414376415.db2.gz	QYVMIYQFZRATCW-SFHVURJKSA-N	0	3	339.464	3.260	20	30		EGEDHN
C=C(Cl)CNC1CC(N(C)C(=O)C2(Cc3ccccc3)CC2)C1	ZINC001701019219	1414679892	/nfs/dbraw/zinc/67/98/92/1414679892.db2.gz	DRZYWMMUPYKCKM-UHFFFAOYSA-N	0	3	332.875	3.341	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@@H](C)OC2CCCCCC2)C1	ZINC001707071175	1417183385	/nfs/dbraw/zinc/18/33/85/1417183385.db2.gz	IMJHTJDSMXLFSK-OAGGEKHMSA-N	0	3	342.911	3.351	20	30		EGEDHN
CC[C@H](C)CC(=O)NC[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001707083122	1417191016	/nfs/dbraw/zinc/19/10/16/1417191016.db2.gz	KTVMTCOSPTVEJV-QRTARXTBSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)C/C=C\c2ccc(F)cc2)C1	ZINC001707084101	1417191389	/nfs/dbraw/zinc/19/13/89/1417191389.db2.gz	GHCMTXNRSDAMIL-DBBLJFJQSA-N	0	3	336.838	3.466	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)Cc2ccc(F)cc2Cl)C1	ZINC001707086181	1417193535	/nfs/dbraw/zinc/19/35/35/1417193535.db2.gz	ATXHOXDGDNPCHR-YEORSEQZSA-N	0	3	345.245	3.259	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@@H]3NC(=O)CCC3CC3)CC2)c1	ZINC001713091784	1417639873	/nfs/dbraw/zinc/63/98/73/1417639873.db2.gz	LJZKXVARGHFZEK-IBGZPJMESA-N	0	3	337.467	3.219	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001713161199	1417736715	/nfs/dbraw/zinc/73/67/15/1417736715.db2.gz	MURIAXCEIRHWDH-WKILWMFISA-N	0	3	331.435	3.116	20	30		EGEDHN
CC(C)c1cccc(C(=O)NC[C@@H](C)NCc2ccc(C#N)s2)n1	ZINC001713322814	1417947307	/nfs/dbraw/zinc/94/73/07/1417947307.db2.gz	VYZBIZSJSQMOTE-CYBMUJFWSA-N	0	3	342.468	3.046	20	30		EGEDHN
CCN(CCNC(=O)C[C@@H](C)c1ccco1)Cc1cccc(C#N)c1	ZINC001713496309	1418206224	/nfs/dbraw/zinc/20/62/24/1418206224.db2.gz	QMJQETWPFBXPAW-MRXNPFEDSA-N	0	3	339.439	3.283	20	30		EGEDHN
CCCN(CCNC(=O)C1(C)CC(F)(F)C1)Cc1ccc(C#N)cc1	ZINC001713551673	1418334774	/nfs/dbraw/zinc/33/47/74/1418334774.db2.gz	WBJJUYHIKUAMGI-UHFFFAOYSA-N	0	3	349.425	3.322	20	30		EGEDHN
CC[C@@H](CNC(=O)Cc1cccc(C)c1)NCc1ccc(C#N)s1	ZINC001714098402	1418893375	/nfs/dbraw/zinc/89/33/75/1418893375.db2.gz	NPHXSJMQYWAVIC-INIZCTEOSA-N	0	3	341.480	3.155	20	30		EGEDHN
CCCc1occc1C(=O)NC[C@@H](CC)NCc1ccc(C#N)s1	ZINC001714116410	1418919101	/nfs/dbraw/zinc/91/91/01/1418919101.db2.gz	URRPIMMSHKSYPU-CYBMUJFWSA-N	0	3	345.468	3.463	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1ccc2ccccc2n1)C1CC1	ZINC001714175095	1418982597	/nfs/dbraw/zinc/98/25/97/1418982597.db2.gz	WUIBJNBBSXBSAC-IBGZPJMESA-N	0	3	343.858	3.475	20	30		EGEDHN
Cc1c(F)cccc1C(=O)NC[C@@H](C)NCc1ccc(F)c(C#N)c1	ZINC001714234618	1419025168	/nfs/dbraw/zinc/02/51/68/1419025168.db2.gz	LGZJUXAFSJJBFF-GFCCVEGCSA-N	0	3	343.377	3.053	20	30		EGEDHN
Cc1cc(C)cc(C(=O)NC[C@H](C)NCc2ccc(C#N)s2)c1	ZINC001714295575	1419074660	/nfs/dbraw/zinc/07/46/60/1419074660.db2.gz	RXOKLVKZTSOTRH-AWEZNQCLSA-N	0	3	327.453	3.145	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1cnn(C2CCCCC2)c1	ZINC001714494582	1419218522	/nfs/dbraw/zinc/21/85/22/1419218522.db2.gz	HQDXYKNCNXKDNG-CQSZACIVSA-N	0	3	338.883	3.239	20	30		EGEDHN
CCN(CCNC(=O)CCc1cccc(C)c1)Cc1ccc(C#N)cc1	ZINC001714586873	1419330006	/nfs/dbraw/zinc/33/00/06/1419330006.db2.gz	KRUQHRWYTOZBQY-UHFFFAOYSA-N	0	3	349.478	3.438	20	30		EGEDHN
CCC(=O)N[C@]1(CNCc2cc(C#N)ccc2OC)CCCC[C@H]1C	ZINC001715128603	1419876910	/nfs/dbraw/zinc/87/69/10/1419876910.db2.gz	MWCOLLAXDNWRKC-QRWLVFNGSA-N	0	3	343.471	3.132	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)C2=COCCC2)CCCC[C@H]1C	ZINC001715131844	1419881462	/nfs/dbraw/zinc/88/14/62/1419881462.db2.gz	SVPJAULOUXZNCB-DYVFJYSZSA-N	0	3	326.868	3.088	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCC1CCN([C@@H](C)c2ccc(F)c(F)c2)CC1	ZINC001715200114	1419932029	/nfs/dbraw/zinc/93/20/29/1419932029.db2.gz	IQNPVMUZTRCSML-KBPBESRZSA-N	0	3	349.425	3.404	20	30		EGEDHN
C[C@@H](CNCc1ccccc1C#N)CNC(=O)[C@@H]1CCC(C)(C)C1	ZINC001715254403	1419977835	/nfs/dbraw/zinc/97/78/35/1419977835.db2.gz	YOKJOMHDNJORGP-JKSUJKDBSA-N	0	3	327.472	3.226	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccc(Cl)cn2)CCCC1	ZINC001715307254	1420016360	/nfs/dbraw/zinc/01/63/60/1420016360.db2.gz	GOODDRAELGNOQJ-UHFFFAOYSA-N	0	3	328.243	3.120	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1c[nH]c2ccc(F)cc12)C(C)C	ZINC001715511468	1420195946	/nfs/dbraw/zinc/19/59/46/1420195946.db2.gz	LFGJFXNMXQEJAZ-INIZCTEOSA-N	0	3	337.826	3.404	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)NC(=O)c1cccc(C2CC2)c1	ZINC001715965688	1420430873	/nfs/dbraw/zinc/43/08/73/1420430873.db2.gz	XHURURFUHIMIDC-CYBMUJFWSA-N	0	3	339.464	3.405	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H](C)CNCc2ccc(C#N)s2)cc1Cl	ZINC001715993384	1420447978	/nfs/dbraw/zinc/44/79/78/1420447978.db2.gz	PDXVJKQJAJWERB-LBPRGKRZSA-N	0	3	347.871	3.490	20	30		EGEDHN
CC1(C)CC[C@@H](C(=O)NCC2(NCc3ccc(C#N)cc3)CC2)C1	ZINC001716693382	1420846342	/nfs/dbraw/zinc/84/63/42/1420846342.db2.gz	UAVGMADLUKKBDN-QGZVFWFLSA-N	0	3	325.456	3.123	20	30		EGEDHN
CC(C)C[C@H](C)CC(=O)NCC1(NCc2ccc(C#N)cc2)CC1	ZINC001716699163	1420852033	/nfs/dbraw/zinc/85/20/33/1420852033.db2.gz	HNNJHHOOTNGBJP-INIZCTEOSA-N	0	3	327.472	3.369	20	30		EGEDHN
CCc1noc(C)c1CNC[C@H]1CCCCN1C(=O)C#CC(C)(C)C	ZINC001717144673	1421137549	/nfs/dbraw/zinc/13/75/49/1421137549.db2.gz	LVZZXGYQOZTSAA-MRXNPFEDSA-N	0	3	345.487	3.066	20	30		EGEDHN
CCC[C@@H](C)C(=O)N(C)CCCN(C)Cc1ccc(F)c(C#N)c1	ZINC001717205874	1421176516	/nfs/dbraw/zinc/17/65/16/1421176516.db2.gz	XEFBTGNHEDVWCW-OAHLLOKOSA-N	0	3	333.451	3.414	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@H](C)N(C)Cc2ccc(C#N)cc2)c(C)c1	ZINC001717498529	1421441134	/nfs/dbraw/zinc/44/11/34/1421441134.db2.gz	JORLQJIKDPMLJX-KRWDZBQOSA-N	0	3	335.451	3.425	20	30		EGEDHN
CC(C)(C)[C@@H](CNCc1ccc(C#N)s1)NC(=O)c1ccco1	ZINC001717955241	1421726812	/nfs/dbraw/zinc/72/68/12/1421726812.db2.gz	ISPFGSUIYSOSQL-OAHLLOKOSA-N	0	3	331.441	3.147	20	30		EGEDHN
CC1(C(=O)NC[C@@]2(C)CCCN(Cc3cccc(C#N)c3)C2)CCC1	ZINC001733463705	1429693827	/nfs/dbraw/zinc/69/38/27/1429693827.db2.gz	VNUHHZYVIOZYAK-HXUWFJFHSA-N	0	3	339.483	3.467	20	30		EGEDHN
CC[C@H](SC)C(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001724001636	1424622354	/nfs/dbraw/zinc/62/23/54/1424622354.db2.gz	NMQSRZOCWDDQHF-KRWDZBQOSA-N	0	3	345.512	3.171	20	30		EGEDHN
CCCC(=O)N[C@@H](CNCc1ccc(C#N)cc1F)C1CCCC1	ZINC001724073907	1424649214	/nfs/dbraw/zinc/64/92/14/1424649214.db2.gz	UMVFBENSLQOVDJ-SFHVURJKSA-N	0	3	331.435	3.262	20	30		EGEDHN
CC1(CNC(=O)C2CCCC2)CCN(Cc2cccc(C#N)c2)CC1	ZINC001724271953	1424766951	/nfs/dbraw/zinc/76/69/51/1424766951.db2.gz	OTBICLVWNZRIFS-UHFFFAOYSA-N	0	3	339.483	3.467	20	30		EGEDHN
COc1ccc(CN(C)CCCN(C)C(=O)C2(C)CCC2)cc1C#N	ZINC001724852102	1425216999	/nfs/dbraw/zinc/21/69/99/1425216999.db2.gz	FKLWCLCZUOIFHH-UHFFFAOYSA-N	0	3	343.471	3.037	20	30		EGEDHN
Cc1csc(C(=O)NC[C@@H](C)N(C)Cc2cccc(C#N)c2)c1	ZINC001725156868	1425649276	/nfs/dbraw/zinc/64/92/76/1425649276.db2.gz	ASMXEHYDZMVWTR-CQSZACIVSA-N	0	3	327.453	3.179	20	30		EGEDHN
C[C@@H](CNC(=O)C(C)(C)C(F)(F)F)N(C)Cc1ccc(C#N)cc1	ZINC001725190308	1425733461	/nfs/dbraw/zinc/73/34/61/1425733461.db2.gz	PFSWKIPIBWZUOD-LBPRGKRZSA-N	0	3	341.377	3.083	20	30		EGEDHN
C=C(Br)CNC[C@@H](C1CC1)N(C)C(=O)C(C)(C)CC	ZINC001725469353	1426138826	/nfs/dbraw/zinc/13/88/26/1426138826.db2.gz	VLBMMFKOVIHXRV-ZDUSSCGKSA-N	0	3	331.298	3.158	20	30		EGEDHN
C[C@H](CN(C)C(=O)CC(C)(C)C1CC1)NCc1ccc(F)c(C#N)c1	ZINC001725478342	1426153067	/nfs/dbraw/zinc/15/30/67/1426153067.db2.gz	AAJVEJYTFMIQAA-CQSZACIVSA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@H](CNC(=O)CCc1ccsc1)N(C)Cc1cccc(C#N)c1	ZINC001734040703	1437829346	/nfs/dbraw/zinc/82/93/46/1437829346.db2.gz	MEEJHHWZPULTLR-OAHLLOKOSA-N	0	3	341.480	3.189	20	30		EGEDHN
CCCC[C@H](CNCc1ccc(C#N)s1)NC(=O)c1cscn1	ZINC001734097122	1437881160	/nfs/dbraw/zinc/88/11/60/1437881160.db2.gz	WUNDVKOGFIZKNH-GFCCVEGCSA-N	0	3	348.497	3.155	20	30		EGEDHN
Cc1ccc(CC(=O)N(C)C[C@@H](C)NCc2ccc(C#N)s2)cc1	ZINC001734331949	1438055275	/nfs/dbraw/zinc/05/52/75/1438055275.db2.gz	OJAXKQTYACQVOI-OAHLLOKOSA-N	0	3	341.480	3.107	20	30		EGEDHN
C=C(Br)CN[C@H](C)[C@@H]1CCCCN1C(=O)CC1(C)CC1	ZINC001752142842	1440144946	/nfs/dbraw/zinc/14/49/46/1440144946.db2.gz	KGRXVDIBEHWDKE-KGLIPLIRSA-N	0	3	343.309	3.444	20	30		EGEDHN
CCN(CCCNC(=O)CC(C)(C)C)Cc1cc(C#N)ccc1OC	ZINC001752165780	1440149155	/nfs/dbraw/zinc/14/91/55/1440149155.db2.gz	RPRJNAPLSJQZCA-UHFFFAOYSA-N	0	3	345.487	3.331	20	30		EGEDHN
CC#CCN(CCCNC(=O)c1ccccc1OC(C)C)C1CC1	ZINC001752286051	1440165479	/nfs/dbraw/zinc/16/54/79/1440165479.db2.gz	BNSCRWVEKUNDGS-UHFFFAOYSA-N	0	3	328.456	3.081	20	30		EGEDHN
C=CCCCC(=O)NCCN1CCN([C@H](C)c2ccccc2C)CC1	ZINC001752373155	1440172554	/nfs/dbraw/zinc/17/25/54/1440172554.db2.gz	NRPVBIXLYMTPEL-LJQANCHMSA-N	0	3	343.515	3.146	20	30		EGEDHN
C=CCOCC(=O)N[C@@H]1CC12CCN([C@@H](C)c1ccccc1F)CC2	ZINC001752419017	1440175368	/nfs/dbraw/zinc/17/53/68/1440175368.db2.gz	BIUDDYQZOKTRPS-MAUKXSAKSA-N	0	3	346.446	3.060	20	30		EGEDHN
C=CCOCC(=O)N[C@H]1CC12CCN(Cc1cccc(Cl)c1)CC2	ZINC001752421022	1440175672	/nfs/dbraw/zinc/17/56/72/1440175672.db2.gz	HGTMISGSJQXSAR-KRWDZBQOSA-N	0	3	348.874	3.013	20	30		EGEDHN
C=CCN1CCC(N(CCC)C(=O)[C@H]2CCc3cccnc32)CC1	ZINC001752439823	1440181085	/nfs/dbraw/zinc/18/10/85/1440181085.db2.gz	OUSWCLZSNIVLTC-SFHVURJKSA-N	0	3	327.472	3.000	20	30		EGEDHN
C=CCN1CCC(N(CCC)C(=O)C[C@H]2CCO[C@H](CC)C2)CC1	ZINC001752442262	1440181592	/nfs/dbraw/zinc/18/15/92/1440181592.db2.gz	RXNPQYJTSKVETR-PKOBYXMFSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@H](NCc1cnc(Cl)s1)C1CC1	ZINC001752461670	1440183919	/nfs/dbraw/zinc/18/39/19/1440183919.db2.gz	ZFCUJIAUMXDKIC-ZDUSSCGKSA-N	0	3	327.881	3.137	20	30		EGEDHN
CC1(C)CC[C@@H](C(=O)NC[C@H](NCC#Cc2ccccc2)C2CC2)C1	ZINC001752483315	1440185966	/nfs/dbraw/zinc/18/59/66/1440185966.db2.gz	YBNNDIZZVBATFJ-UXHICEINSA-N	0	3	338.495	3.349	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)c1cncc2[nH]ccc21	ZINC001752538254	1440194532	/nfs/dbraw/zinc/19/45/32/1440194532.db2.gz	HGXJOFRHDGFFAS-OAGGEKHMSA-N	0	3	338.455	3.206	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)Cc1ccco1	ZINC001752567499	1440195497	/nfs/dbraw/zinc/19/54/97/1440195497.db2.gz	RZSDBGXQFUPVFT-XLAORIBOSA-N	0	3	330.472	3.488	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1C[C@H](NCc2cc(F)ccc2F)C1	ZINC001752633374	1440197173	/nfs/dbraw/zinc/19/71/73/1440197173.db2.gz	SLSLMBYASRDIDD-QAQDUYKDSA-N	0	3	334.410	3.470	20	30		EGEDHN
CCc1ccc(C(=O)N[C@H]2C[C@H](NCC#Cc3ccccc3)C2)s1	ZINC001752642134	1440197629	/nfs/dbraw/zinc/19/76/29/1440197629.db2.gz	RXYZJYXLOHOXBO-QAQDUYKDSA-N	0	3	338.476	3.213	20	30		EGEDHN
CC[C@@H](C)[C@H](C)C(=O)N[C@H]1C[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001752674567	1440199191	/nfs/dbraw/zinc/19/91/91/1440199191.db2.gz	XGWCXHVVUZXALE-WTLGNFPFSA-N	0	3	330.447	3.096	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)CCOc2ccccc2CC)C1	ZINC001752681355	1440199585	/nfs/dbraw/zinc/19/95/85/1440199585.db2.gz	HPGWRMXSYJKWKR-WKILWMFISA-N	0	3	336.863	3.007	20	30		EGEDHN
CCC1(C(=O)N[C@H]2C[C@@H](NCc3ccc(C#N)cc3F)C2)CCC1	ZINC001752753855	1440205201	/nfs/dbraw/zinc/20/52/01/1440205201.db2.gz	JFVKXIWOABLNLL-IYBDPMFKSA-N	0	3	329.419	3.014	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@@H](NCc3cccc(F)c3F)C2)CCC1	ZINC001752757359	1440205257	/nfs/dbraw/zinc/20/52/57/1440205257.db2.gz	ANIVPNNVAAYVQR-GASCZTMLSA-N	0	3	334.410	3.448	20	30		EGEDHN
CC1(C)CC[C@H](C(=O)N[C@H]2C[C@@H](NCC#Cc3ccc(F)cc3)C2)C1	ZINC001752765057	1440205490	/nfs/dbraw/zinc/20/54/90/1440205490.db2.gz	GGLYXIOYYXRQEI-YTQUADARSA-N	0	3	342.458	3.240	20	30		EGEDHN
C[C@H](C#N)C(=O)NC[C@@H]1CCCN(Cc2cccc(C(F)F)c2)C1	ZINC001752780184	1440208315	/nfs/dbraw/zinc/20/83/15/1440208315.db2.gz	UCIPAQAKLKVAAT-HIFRSBDPSA-N	0	3	335.398	3.112	20	30		EGEDHN
C=CCOCCN1CCCC[C@@H]1CNC(=O)c1cccc(C2CC2)c1	ZINC001752824762	1440222967	/nfs/dbraw/zinc/22/29/67/1440222967.db2.gz	CZZXWWWEYUFTAK-HXUWFJFHSA-N	0	3	342.483	3.351	20	30		EGEDHN
C[C@H](CNC(=O)[C@@H](C)C#N)NCc1sc2ccccc2c1Cl	ZINC001752863547	1440236119	/nfs/dbraw/zinc/23/61/19/1440236119.db2.gz	AMDRNFXXLRMNIO-WDEREUQCSA-N	0	3	335.860	3.309	20	30		EGEDHN
C[C@@H](CNC(=O)[C@H]1CCC=CCCC1)NCc1ccc(C#N)s1	ZINC001752883918	1440239492	/nfs/dbraw/zinc/23/94/92/1440239492.db2.gz	NAETYMFKCTYOCQ-GJZGRUSLSA-N	0	3	331.485	3.351	20	30		EGEDHN
CC#CCN(C)[C@H]1CCCN(C(=O)c2ccc3[nH]c(C)c(C)c3c2)C1	ZINC001752999825	1440263969	/nfs/dbraw/zinc/26/39/69/1440263969.db2.gz	IJEHENZAFMBKNI-SFHVURJKSA-N	0	3	337.467	3.344	20	30		EGEDHN
C[C@H](CCNC(=O)[C@H](C)c1ccsc1)NCc1ccccc1C#N	ZINC001753013389	1440267643	/nfs/dbraw/zinc/26/76/43/1440267643.db2.gz	JEQGSBVYQNOTQS-HUUCEWRRSA-N	0	3	341.480	3.408	20	30		EGEDHN
CC1(C(=O)NCCC[C@H]2CCCN2Cc2ccccc2C#N)CC1	ZINC001753027854	1440272010	/nfs/dbraw/zinc/27/20/10/1440272010.db2.gz	SMSDQQQRNYANEW-SFHVURJKSA-N	0	3	325.456	3.219	20	30		EGEDHN
CCN(CCNC(=O)c1ccc(C)c(F)c1)Cc1cccc(C#N)c1	ZINC001753085384	1440296182	/nfs/dbraw/zinc/29/61/82/1440296182.db2.gz	CGEAZIIANAMQOY-UHFFFAOYSA-N	0	3	339.414	3.258	20	30		EGEDHN
CCN(CCNC(=O)[C@H]1CCCC[C@@H]1C)Cc1ccc(C#N)cc1	ZINC001753087443	1440297086	/nfs/dbraw/zinc/29/70/86/1440297086.db2.gz	FXOLPSKYDXLYDN-LPHOPBHVSA-N	0	3	327.472	3.323	20	30		EGEDHN
CCN(CCNC(=O)[C@H]1CCC[C@H](C)C1)Cc1cccc(C#N)c1	ZINC001753087829	1440297381	/nfs/dbraw/zinc/29/73/81/1440297381.db2.gz	RZCCMQOSXALBEO-LPHOPBHVSA-N	0	3	327.472	3.323	20	30		EGEDHN
CCN(CCNC(=O)c1ccc2cc[nH]c2c1)Cc1ccc(C#N)cc1	ZINC001753090319	1440298710	/nfs/dbraw/zinc/29/87/10/1440298710.db2.gz	NULIGCMIHXJGST-UHFFFAOYSA-N	0	3	346.434	3.291	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@@H]1CCCN1Cc1ccc(OC)cc1	ZINC001753110720	1440308350	/nfs/dbraw/zinc/30/83/50/1440308350.db2.gz	SUBLZQFCOVKWOL-WMZOPIPTSA-N	0	3	330.472	3.378	20	30		EGEDHN
C#CCCCC(=O)NC[C@@H]1CCN(Cc2ccc(C(C)C)nc2C)C1	ZINC001753122285	1440314097	/nfs/dbraw/zinc/31/40/97/1440314097.db2.gz	JMFGYMVDAFAAGL-SFHVURJKSA-N	0	3	341.499	3.255	20	30		EGEDHN
CCCN(CCNC(=O)[C@H]1CC=CCC1)Cc1ccc(C#N)c(F)c1	ZINC001753141894	1440321591	/nfs/dbraw/zinc/32/15/91/1440321591.db2.gz	IIWXUUITASYOTI-KRWDZBQOSA-N	0	3	343.446	3.382	20	30		EGEDHN
CC(C)(C)C#CC(=O)NCCN(Cc1ccc2cc[nH]c2c1)C1CC1	ZINC001753152709	1440328889	/nfs/dbraw/zinc/32/88/89/1440328889.db2.gz	FLAZRCQGJJCIFO-UHFFFAOYSA-N	0	3	337.467	3.298	20	30		EGEDHN
CC(C)N(CC#Cc1ccc(F)cc1)CCCNC(=O)c1ccc[nH]1	ZINC001753283112	1440347949	/nfs/dbraw/zinc/34/79/49/1440347949.db2.gz	XOCCVHMCZGVFOX-UHFFFAOYSA-N	0	3	341.430	3.036	20	30		EGEDHN
COCCN[C@H](CNC(=O)C#CC(C)(C)C)c1ccc(C(C)C)cc1	ZINC001753294722	1440351856	/nfs/dbraw/zinc/35/18/56/1440351856.db2.gz	TXALFXRXWODYBD-LJQANCHMSA-N	0	3	344.499	3.253	20	30		EGEDHN
C#CCCN[C@H](CNC(=O)c1cc(C(C)(C)C)on1)c1ccccc1	ZINC001753299782	1440353510	/nfs/dbraw/zinc/35/35/10/1440353510.db2.gz	HNHMUOXZZRMZHP-QGZVFWFLSA-N	0	3	339.439	3.056	20	30		EGEDHN
C=C(C)CN[C@H](CNC(=O)Cc1ccn(C(C)C)n1)c1ccccc1	ZINC001753299776	1440353561	/nfs/dbraw/zinc/35/35/61/1440353561.db2.gz	HMWNURIAICFGSV-LJQANCHMSA-N	0	3	340.471	3.030	20	30		EGEDHN
C=C(C)CN[C@H](CNC(=O)c1sccc1OC)c1ccccc1	ZINC001753303007	1440354698	/nfs/dbraw/zinc/35/46/98/1440354698.db2.gz	NLHUTEQYTBNHCS-OAHLLOKOSA-N	0	3	330.453	3.394	20	30		EGEDHN
CC[C@@H](C)CC(=O)NCC[C@H]1CCN(CC#Cc2ccc(F)cc2)C1	ZINC001753326370	1440366744	/nfs/dbraw/zinc/36/67/44/1440366744.db2.gz	JSUHJWDZHWLMKD-MJGOQNOKSA-N	0	3	344.474	3.442	20	30		EGEDHN
CC(C)[C@H](F)C(=O)NCC[C@@H]1CCN(Cc2ccc(F)c(C#N)c2)C1	ZINC001753333099	1440370634	/nfs/dbraw/zinc/37/06/34/1440370634.db2.gz	BQCLHYPNXUZUIF-KDOFPFPSSA-N	0	3	349.425	3.020	20	30		EGEDHN
CC(C)CC(=O)N1CCC(CN(C)CC#Cc2ccc(F)cc2)CC1	ZINC001753361315	1440383012	/nfs/dbraw/zinc/38/30/12/1440383012.db2.gz	CMMFZWRCZOXXDR-UHFFFAOYSA-N	0	3	344.474	3.394	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NCC1CN([C@@H](C)c2cccc(C)c2)C1	ZINC001753407315	1440392296	/nfs/dbraw/zinc/39/22/96/1440392296.db2.gz	DDLYTTKNHIRHNV-UWJYYQICSA-N	0	3	344.499	3.333	20	30		EGEDHN
C=CCCCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc2c(c1)C(C)(C)CO2	ZINC001753423625	1440396182	/nfs/dbraw/zinc/39/61/82/1440396182.db2.gz	RMQJFHKCPGNGQA-IRXDYDNUSA-N	0	3	340.467	3.222	20	30		EGEDHN
C#CCCCCC(=O)N(C)[C@@H]1CCN(Cc2ccc3ncccc3c2)C1	ZINC001753434353	1440399580	/nfs/dbraw/zinc/39/95/80/1440399580.db2.gz	CCYCQKZGNODQEU-HXUWFJFHSA-N	0	3	349.478	3.461	20	30		EGEDHN
C=CCCC(=O)N(CC)[C@@H]1CCN(C[C@H](OC)c2ccccc2)C1	ZINC001753452858	1440406888	/nfs/dbraw/zinc/40/68/88/1440406888.db2.gz	GSEUIICEDKQOKA-MOPGFXCFSA-N	0	3	330.472	3.263	20	30		EGEDHN
CC[C@@H](CNC(=O)c1ccsc1C)NCc1ccc(C#N)s1	ZINC001753471401	1440414070	/nfs/dbraw/zinc/41/40/70/1440414070.db2.gz	MDPRKVBIBMMJDL-LBPRGKRZSA-N	0	3	333.482	3.288	20	30		EGEDHN
CC[C@H](CNC(=O)C1CC2(CCC2)C1)NCC#Cc1ccc(F)cc1	ZINC001753483098	1440417116	/nfs/dbraw/zinc/41/71/16/1440417116.db2.gz	IDDBBPOREVVONT-LJQANCHMSA-N	0	3	342.458	3.242	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)Cc2cc(F)ccc2F)CCCC1	ZINC001753506802	1440424642	/nfs/dbraw/zinc/42/46/42/1440424642.db2.gz	CPJXKACYKFEXSU-UHFFFAOYSA-N	0	3	342.817	3.278	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)C[C@H]1Cc2ccccc2O1)C1CC1	ZINC001753519065	1440428144	/nfs/dbraw/zinc/42/81/44/1440428144.db2.gz	WCMCLCMZXLXSPB-VQIMIIECSA-N	0	3	348.874	3.007	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N[C@@](C)(CNCc1ccc(C#N)cc1F)C1CC1	ZINC001753524773	1440429347	/nfs/dbraw/zinc/42/93/47/1440429347.db2.gz	LGHZHRQAEPSGBD-XOBRGWDASA-N	0	3	345.462	3.364	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2ccc(C)n2C)CCCC[C@H]1C	ZINC001753529300	1440430596	/nfs/dbraw/zinc/43/05/96/1440430596.db2.gz	CXWVUGKSLXSSPY-ACJLOTCBSA-N	0	3	337.895	3.354	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@H](CCNCc3ocnc3C)C2)CC1	ZINC001753555279	1440435877	/nfs/dbraw/zinc/43/58/77/1440435877.db2.gz	RORWMTHUHDXWHJ-QGZVFWFLSA-N	0	3	345.487	3.448	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@H]1CC[C@H](NCc2cc(C3CC3)no2)CC1	ZINC001753580720	1440440073	/nfs/dbraw/zinc/44/00/73/1440440073.db2.gz	OPHSDPSTUCZLPF-WKILWMFISA-N	0	3	343.471	3.119	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCC1CCN(Cc2conc2C)CC1	ZINC001753596882	1440445017	/nfs/dbraw/zinc/44/50/17/1440445017.db2.gz	HCAPHEJMDPFORA-UHFFFAOYSA-N	0	3	333.476	3.304	20	30		EGEDHN
C[C@@H](CNC(=O)C#CC(C)(C)C)CN[C@@H](C)c1nc2ccccc2o1	ZINC001753612852	1440449218	/nfs/dbraw/zinc/44/92/18/1440449218.db2.gz	LJZWQSPWIXVVBW-CABCVRRESA-N	0	3	341.455	3.280	20	30		EGEDHN
O=C(CC#Cc1ccccc1)NCC1(NCc2ccccn2)CCCC1	ZINC001753671416	1440462134	/nfs/dbraw/zinc/46/21/34/1440462134.db2.gz	YSMRJIIGKITLHX-UHFFFAOYSA-N	0	3	347.462	3.042	20	30		EGEDHN
CC#CCCCC(=O)N(C)[C@H](C)CNCc1cccc(C(C)C)n1	ZINC001753705854	1440469605	/nfs/dbraw/zinc/46/96/05/1440469605.db2.gz	HNGBGRGCEPZKMZ-QGZVFWFLSA-N	0	3	329.488	3.335	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccccc1)N(C)C(=O)c1occc1Cl	ZINC001753710367	1440470432	/nfs/dbraw/zinc/47/04/32/1440470432.db2.gz	COIFSCNLILOAGS-AWEZNQCLSA-N	0	3	330.815	3.035	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N(C)[C@@H](C)CNCc1ccc(F)c(C#N)c1	ZINC001753711116	1440470658	/nfs/dbraw/zinc/47/06/58/1440470658.db2.gz	NJCAXOLVSJIPFJ-YSVLISHTSA-N	0	3	331.435	3.070	20	30		EGEDHN
CC(C)C[C@H](CNCc1ccc(F)c(C#N)c1)NC(=O)C(C)(C)F	ZINC001753731733	1440476109	/nfs/dbraw/zinc/47/61/09/1440476109.db2.gz	ZESMJBZJBOEDDA-OAHLLOKOSA-N	0	3	337.414	3.066	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](NCc2cc(C3CC3)no2)[C@H](C)C1	ZINC001753756068	1440483179	/nfs/dbraw/zinc/48/31/79/1440483179.db2.gz	ZHSJWALGHHVZFD-PBHICJAKSA-N	0	3	345.487	3.481	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CCCCN1C(=O)C=C1CCC1	ZINC001753775066	1440486336	/nfs/dbraw/zinc/48/63/36/1440486336.db2.gz	FCPKCJNEWABKRJ-HNNXBMFYSA-N	0	3	341.293	3.366	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCCCN1C(=O)c1cnc(C2CC2)o1	ZINC001753778960	1440486961	/nfs/dbraw/zinc/48/69/61/1440486961.db2.gz	BXRBSPDSZFUTRJ-AWEZNQCLSA-N	0	3	337.851	3.279	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCCCN1C(=O)[C@@H](CC(C)C)OC	ZINC001753794915	1440489569	/nfs/dbraw/zinc/48/95/69/1440489569.db2.gz	DLYKFJYMDHJFLR-JKSUJKDBSA-N	0	3	330.900	3.161	20	30		EGEDHN
CC/C=C(/C)C(=O)NC[C@H](NCc1cc(C#N)ccc1OC)C(C)C	ZINC001753824949	1440497919	/nfs/dbraw/zinc/49/79/19/1440497919.db2.gz	ACNCRPCNEFESIU-GQJZTYNYSA-N	0	3	343.471	3.154	20	30		EGEDHN
C=CCC1(C(=O)NC[C@H](NCc2cc(C)ns2)C(C)C)CCC1	ZINC001753839241	1440502101	/nfs/dbraw/zinc/50/21/01/1440502101.db2.gz	YEEOJTILNHVUHX-INIZCTEOSA-N	0	3	335.517	3.428	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)Cc1c[nH]c2ccccc12)C(C)C	ZINC001753844473	1440503868	/nfs/dbraw/zinc/50/38/68/1440503868.db2.gz	NYVCCVIOXIZUFW-KRWDZBQOSA-N	0	3	333.863	3.193	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)[C@H](F)Cc1ccccc1)C(C)C	ZINC001753846084	1440504380	/nfs/dbraw/zinc/50/43/80/1440504380.db2.gz	YTIUCRIBULQCBG-CVEARBPZSA-N	0	3	326.843	3.050	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H]2[C@H](CCN2Cc2cc(C)ns2)C1	ZINC001753872849	1440517944	/nfs/dbraw/zinc/51/79/44/1440517944.db2.gz	PAQLXDATZKEYPK-WBVHZDCISA-N	0	3	347.528	3.477	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1CCC[C@@H]1CNCc1nc(C)cs1	ZINC001753883885	1440520853	/nfs/dbraw/zinc/52/08/53/1440520853.db2.gz	BIARMVPOURRKRN-CVEARBPZSA-N	0	3	333.501	3.020	20	30		EGEDHN
C=C[C@H](C(=O)N(CC)CCNCc1ccc(C#N)cc1)c1ccccc1	ZINC001754084460	1440539888	/nfs/dbraw/zinc/53/98/88/1440539888.db2.gz	IUIVWKGYBRTIDN-NRFANRHFSA-N	0	3	347.462	3.466	20	30		EGEDHN
Cc1ccc(F)c(C(=O)NC/C=C\CNCc2cccc(C#N)c2)c1	ZINC001754175402	1440547578	/nfs/dbraw/zinc/54/75/78/1440547578.db2.gz	MCMQRBNGNFMVOL-IHWYPQMZSA-N	0	3	337.398	3.082	20	30		EGEDHN
C=CC1(CC(=O)N[C@H](C)CNCc2ccc(OC)nc2)CCCCC1	ZINC001754245406	1440556667	/nfs/dbraw/zinc/55/66/67/1440556667.db2.gz	ZBGGEAUQDDMMLU-MRXNPFEDSA-N	0	3	345.487	3.211	20	30		EGEDHN
C[C@H](CN[C@@H](C)c1ccccc1F)NC(=O)CC#Cc1ccccc1	ZINC001754254439	1440558668	/nfs/dbraw/zinc/55/86/68/1440558668.db2.gz	BKTXYMWWAMXKBU-SJORKVTESA-N	0	3	338.426	3.423	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)c(F)c1)NC(=O)[C@@H]1C[C@H]1CC(C)(C)C	ZINC001754267035	1440560779	/nfs/dbraw/zinc/56/07/79/1440560779.db2.gz	SWALUHCUXXRCCJ-RRQGHBQHSA-N	0	3	345.462	3.364	20	30		EGEDHN
C[C@@H](C(=O)N[C@@H](C)CNCC#Cc1ccc(F)cc1)c1ccccc1	ZINC001754292062	1440565507	/nfs/dbraw/zinc/56/55/07/1440565507.db2.gz	LKKOPRILGHPOCQ-DLBZAZTESA-N	0	3	338.426	3.075	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H](C)CN(C)Cc2cc(F)ccc2C)cc1	ZINC001754318920	1440576864	/nfs/dbraw/zinc/57/68/64/1440576864.db2.gz	KTJMDTXHRBBLAV-INIZCTEOSA-N	0	3	338.426	3.366	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)C(C)(C)c1ccccc1	ZINC001754333747	1440585600	/nfs/dbraw/zinc/58/56/00/1440585600.db2.gz	QUJLTLPPJRTRTJ-KRWDZBQOSA-N	0	3	349.478	3.473	20	30		EGEDHN
C[C@@H]1CCCC[C@H]1C(=O)N(C)CCCNCc1ccccc1C#N	ZINC001754397066	1440594781	/nfs/dbraw/zinc/59/47/81/1440594781.db2.gz	IVCCGWKPMBXZPC-VQIMIIECSA-N	0	3	327.472	3.323	20	30		EGEDHN
C[C@@H]1CC[C@@H](C(=O)N(C)CCCNCc2ccc(C#N)cc2F)C1	ZINC001754400892	1440595307	/nfs/dbraw/zinc/59/53/07/1440595307.db2.gz	KHNVIZGNEDVKET-GDBMZVCRSA-N	0	3	331.435	3.072	20	30		EGEDHN
C=C(Br)CNCCCN(C)C(=O)[C@@]1(C)CC=C(C)CC1	ZINC001754416060	1440596764	/nfs/dbraw/zinc/59/67/64/1440596764.db2.gz	JHUOHQJCBRPKEV-INIZCTEOSA-N	0	3	343.309	3.470	20	30		EGEDHN
Cc1cc(C)c(C(=O)N[C@@H](CNCC#Cc2ccccc2)C2CC2)o1	ZINC001754437479	1440598460	/nfs/dbraw/zinc/59/84/60/1440598460.db2.gz	LBMYKBFPIVWYGH-IBGZPJMESA-N	0	3	336.435	3.046	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](NC(=O)C[C@@H]2C[C@H]2C2CC2)C2CC2)s1	ZINC001754446432	1440600019	/nfs/dbraw/zinc/60/00/19/1440600019.db2.gz	ILNRDRQKKHOOAI-WBAXXEDZSA-N	0	3	343.496	3.040	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](CNCc2ccnc(Cl)c2)C2CC2)CC1	ZINC001754450154	1440600840	/nfs/dbraw/zinc/60/08/40/1440600840.db2.gz	HNMIYULCFOSKSX-QGZVFWFLSA-N	0	3	347.890	3.466	20	30		EGEDHN
C=CCC[C@@H](C)N1CC[C@H]1CNC(=O)c1ccc(OC(C)C)nc1	ZINC001754485606	1440608521	/nfs/dbraw/zinc/60/85/21/1440608521.db2.gz	YQGFIBBYXSLEDE-WBVHZDCISA-N	0	3	331.460	3.028	20	30		EGEDHN
CCCCCCCN1CC[C@H]1CNC(=O)C1CC2(C1)CCOCC2	ZINC001754500346	1440614004	/nfs/dbraw/zinc/61/40/04/1440614004.db2.gz	MVTFLZSXIDGFTR-SFHVURJKSA-N	0	3	336.520	3.354	20	30		EGEDHN
C=CCCCN1CC[C@@H]1CNC(=O)[C@@]1(C)CCc2ccccc2C1	ZINC001754505029	1440616009	/nfs/dbraw/zinc/61/60/09/1440616009.db2.gz	PCIQBUGGMNFBGW-CTNGQTDRSA-N	0	3	326.484	3.338	20	30		EGEDHN
Cc1cccc([C@@H](C)C(=O)NCC2(NCc3cccc(C#N)c3)CC2)c1	ZINC001754527485	1440621599	/nfs/dbraw/zinc/62/15/99/1440621599.db2.gz	KCRDERPSSVSFCH-QGZVFWFLSA-N	0	3	347.462	3.409	20	30		EGEDHN
Cc1cnc(CNC2C[C@H]3CCC[C@@H](C2)N3C(=O)C#CC(C)C)s1	ZINC001754539553	1440625783	/nfs/dbraw/zinc/62/57/83/1440625783.db2.gz	HBOSJBSOJZOSRH-ALOPSCKCSA-N	0	3	345.512	3.113	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC2(C1)CCN(Cc1ocnc1C)CC2	ZINC001754560647	1440633512	/nfs/dbraw/zinc/63/35/12/1440633512.db2.gz	UFJOLJPGWAGOEL-UHFFFAOYSA-N	0	3	345.487	3.400	20	30		EGEDHN
C#CCN(C(=O)[C@@H]1C[C@H]1c1ccsc1)C1CCN(CC(=C)C)CC1	ZINC001754638666	1440648886	/nfs/dbraw/zinc/64/88/86/1440648886.db2.gz	HWCGZGGTJDUVDV-RBUKOAKNSA-N	0	3	342.508	3.354	20	30		EGEDHN
C=CCOCCN1CC[C@](C)(NC(=O)C/C=C\c2ccc(F)cc2)C1	ZINC001754675541	1440659724	/nfs/dbraw/zinc/65/97/24/1440659724.db2.gz	RAYJOEACCLFHMZ-FBQMEGEOSA-N	0	3	346.446	3.012	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@](C)(CNCc2cc(C3CC3)no2)C1	ZINC001754692835	1440666467	/nfs/dbraw/zinc/66/64/67/1440666467.db2.gz	NKFQXHCFNFUDSY-FQEVSTJZSA-N	0	3	343.471	3.074	20	30		EGEDHN
C[C@@]1(CNCc2ccccc2C#N)CCN(C(=O)CCCC2CC2)C1	ZINC001754703825	1440668501	/nfs/dbraw/zinc/66/85/01/1440668501.db2.gz	VLRPJEWQTQGRPY-NRFANRHFSA-N	0	3	339.483	3.467	20	30		EGEDHN
C#CCN1CCC(C)(CNC(=O)c2cc3c([nH]2)c(F)ccc3C)CC1	ZINC001754717821	1440672015	/nfs/dbraw/zinc/67/20/15/1440672015.db2.gz	GGJRVUURNCCJEJ-UHFFFAOYSA-N	0	3	341.430	3.081	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@H](CNC(=O)[C@H](C)c2ccccc2C)C1	ZINC001754744364	1440684019	/nfs/dbraw/zinc/68/40/19/1440684019.db2.gz	GPNLBEBNCGRPFR-IAGOWNOFSA-N	0	3	348.437	3.195	20	30		EGEDHN
C=C(C)CN[C@H](CNC(=O)c1cc(CC)n[nH]1)c1ccccc1CC	ZINC001754786029	1440687791	/nfs/dbraw/zinc/68/77/91/1440687791.db2.gz	SKBQLTKCDDCRPI-LJQANCHMSA-N	0	3	340.471	3.171	20	30		EGEDHN
C#CCNCCN(Cc1ccccc1)C(=O)[C@H]1CCCC[C@@H]1CC	ZINC001754836910	1440697110	/nfs/dbraw/zinc/69/71/10/1440697110.db2.gz	ACYCXARXJMKKAU-PMACEKPBSA-N	0	3	326.484	3.454	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@]1(CO)CCCN(Cc2ccccc2C)C1	ZINC001754858156	1440700430	/nfs/dbraw/zinc/70/04/30/1440700430.db2.gz	VNDBPEOSOXHYKQ-RXVVDRJESA-N	0	3	344.499	3.040	20	30		EGEDHN
Cc1cc(F)ccc1CN1CC[C@H]2[C@H]1CCCN2C(=O)C#CC(C)C	ZINC001754865397	1440702590	/nfs/dbraw/zinc/70/25/90/1440702590.db2.gz	LMKLAOTZGOPKFT-UXHICEINSA-N	0	3	342.458	3.359	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)C3(CCF)CC3)cccc2C1	ZINC001754975843	1440720087	/nfs/dbraw/zinc/72/00/87/1440720087.db2.gz	QZVUNLSTENDLCT-UHFFFAOYSA-N	0	3	330.447	3.377	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)C[C@@H](C)c2cccc(F)c2)CC1	ZINC001755028957	1440730459	/nfs/dbraw/zinc/73/04/59/1440730459.db2.gz	KACYYHQZQSFNAS-VQIMIIECSA-N	0	3	330.447	3.313	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)CCCN(C)Cc2ccc(C#N)c(F)c2)C1	ZINC001755041256	1440737327	/nfs/dbraw/zinc/73/73/27/1440737327.db2.gz	JSFBHGWBDFPXGR-UHFFFAOYSA-N	0	3	343.446	3.334	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)CCC(F)(F)F)C1	ZINC001755047828	1440742284	/nfs/dbraw/zinc/74/22/84/1440742284.db2.gz	RBVQGOSSBCKOGC-GJZGRUSLSA-N	0	3	330.394	3.055	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001755077002	1440749204	/nfs/dbraw/zinc/74/92/04/1440749204.db2.gz	MIVMEPHLCCHSPB-OAQYLSRUSA-N	0	3	337.467	3.339	20	30		EGEDHN
C=CCCCN1Cc2ccc(CNC(=O)[C@@H]3C[C@H](C)CO3)cc2C1	ZINC001755102039	1440753067	/nfs/dbraw/zinc/75/30/67/1440753067.db2.gz	GCWSOKXBIYDTPK-KXBFYZLASA-N	0	3	328.456	3.010	20	30		EGEDHN
CCC(C)(C)CC(=O)N1C[C@@H](C)[C@@H](NCc2ccc(C#N)s2)C1	ZINC001755120513	1440755559	/nfs/dbraw/zinc/75/55/59/1440755559.db2.gz	HVXKBNSUMPEXMH-CJNGLKHVSA-N	0	3	333.501	3.383	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)CC2(c3ccccc3)CC2)C(C)(C)C1	ZINC001755139086	1440759671	/nfs/dbraw/zinc/75/96/71/1440759671.db2.gz	SXPRZFSXGOYWBE-LJQANCHMSA-N	0	3	338.495	3.348	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2CCN(CC#CC)CC2(C)C)CCCCC1	ZINC001755142667	1440761480	/nfs/dbraw/zinc/76/14/80/1440761480.db2.gz	CWUXRGFKNKLZHM-GOSISDBHSA-N	0	3	328.500	3.200	20	30		EGEDHN
C=CCC[C@H](C)N1CCc2ccccc2[C@H]1CNC(=O)C#CC1CC1	ZINC001755172533	1440769607	/nfs/dbraw/zinc/76/96/07/1440769607.db2.gz	TXFSAUQUSVPXTQ-LAUBAEHRSA-N	0	3	336.479	3.470	20	30		EGEDHN
CC(C)CN1CCc2ccccc2[C@H]1CNC(=O)C#CC(C)(C)C	ZINC001755172799	1440769858	/nfs/dbraw/zinc/76/98/58/1440769858.db2.gz	YAKGRMQVZMKGHX-LJQANCHMSA-N	0	3	326.484	3.408	20	30		EGEDHN
C=CCCCN1CCOC2(CCN(C(=O)C[C@H]3C=CCCC3)CC2)C1	ZINC001755174096	1440770146	/nfs/dbraw/zinc/77/01/46/1440770146.db2.gz	JMJKNRIBIXJYTM-IBGZPJMESA-N	0	3	346.515	3.392	20	30		EGEDHN
C=C(C)CN1CCC(CO)(NC(=O)c2cc3ccccc3s2)CC1	ZINC001755178575	1440770903	/nfs/dbraw/zinc/77/09/03/1440770903.db2.gz	JJQWXTPBZWYDOU-UHFFFAOYSA-N	0	3	344.480	3.034	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)[C@@H]2CC[C@@H](CC)O2)CC1	ZINC001755183320	1440771796	/nfs/dbraw/zinc/77/17/96/1440771796.db2.gz	HRQMIAYCXIAFQL-SJORKVTESA-N	0	3	342.911	3.257	20	30		EGEDHN
C#CCCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc(Cl)s1	ZINC001755188113	1440773817	/nfs/dbraw/zinc/77/38/17/1440773817.db2.gz	YTQAXCMVBADKRY-RHSMWYFYSA-N	0	3	344.867	3.410	20	30		EGEDHN
CS[C@H](C)CC(=O)N1CCC[C@H]1CN(C)Cc1cccc(C#N)c1	ZINC001755191964	1440774973	/nfs/dbraw/zinc/77/49/73/1440774973.db2.gz	WSWGJCOXKBXWEV-QAPCUYQASA-N	0	3	345.512	3.123	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCN1C(=O)c1csc(C(F)(F)F)c1	ZINC001755194724	1440776632	/nfs/dbraw/zinc/77/66/32/1440776632.db2.gz	YTQREFMEFBYZED-GFCCVEGCSA-N	0	3	332.391	3.489	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@@H]1CN(C)Cc1cccc(OC)c1	ZINC001755197561	1440777778	/nfs/dbraw/zinc/77/77/78/1440777778.db2.gz	KPZMFFAUKKEVLK-LJQANCHMSA-N	0	3	342.483	3.312	20	30		EGEDHN
C=C(Cl)CNCC1CC(NC(=O)c2c(F)ccc(F)c2Cl)C1	ZINC001755218099	1440784307	/nfs/dbraw/zinc/78/43/07/1440784307.db2.gz	NINCPTHASOQCJO-UHFFFAOYSA-N	0	3	349.208	3.469	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H](C)[C@H](C)NCc2ccc(C#N)s2)s1	ZINC001755222380	1440784971	/nfs/dbraw/zinc/78/49/71/1440784971.db2.gz	CNKLXWXWXXOBLR-RYUDHWBXSA-N	0	3	333.482	3.286	20	30		EGEDHN
Cc1cscc1C(=O)N[C@@H](C)[C@@H](C)NCC#Cc1ccccc1	ZINC001755229596	1440786683	/nfs/dbraw/zinc/78/66/83/1440786683.db2.gz	DNDGEBGFJABEAB-CVEARBPZSA-N	0	3	326.465	3.205	20	30		EGEDHN
C[C@@H](NC(=O)c1ccoc1Cl)[C@H](C)NCc1ccc(C#N)c(F)c1	ZINC001755235139	1440788019	/nfs/dbraw/zinc/78/80/19/1440788019.db2.gz	YTWMHMHSLJYGDK-WDEREUQCSA-N	0	3	349.793	3.240	20	30		EGEDHN
Cc1cocc1C(=O)N[C@H](C)[C@@H](C)NCC#Cc1ccc(Cl)cc1	ZINC001755248786	1440791301	/nfs/dbraw/zinc/79/13/01/1440791301.db2.gz	LFFVWGMUSNUVHE-HUUCEWRRSA-N	0	3	344.842	3.390	20	30		EGEDHN
CC(C)=C(C)CC(=O)N[C@H](C)[C@@H](C)NCC#Cc1ccc(F)cc1	ZINC001755250236	1440791636	/nfs/dbraw/zinc/79/16/36/1440791636.db2.gz	VUAJQTYKRWOLBV-IAGOWNOFSA-N	0	3	330.447	3.406	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)[C@@H](C)NCc2cccc(OC)n2)CCCC1	ZINC001755267094	1440796530	/nfs/dbraw/zinc/79/65/30/1440796530.db2.gz	BLAUOSAMISWIAY-CVEARBPZSA-N	0	3	345.487	3.210	20	30		EGEDHN
C[C@H](C#N)C(=O)N(C)CC(C)(C)CN[C@H](C)c1nc2ccccc2o1	ZINC001755279411	1440800193	/nfs/dbraw/zinc/80/01/93/1440800193.db2.gz	NONWRTVHIZWMPO-ZIAGYGMSSA-N	0	3	342.443	3.123	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@@H](C)N(C)[C@@H]1CCc2c1cc(F)cc2F	ZINC001755297730	1440807083	/nfs/dbraw/zinc/80/70/83/1440807083.db2.gz	CMDWRZMJJOMUNS-FZKQIMNGSA-N	0	3	334.410	3.048	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@H](C)N(C)Cc2cccc(COC)c2)C1	ZINC001755315456	1440815592	/nfs/dbraw/zinc/81/55/92/1440815592.db2.gz	QBZIYKICOLCWQN-MRXNPFEDSA-N	0	3	330.472	3.126	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H](C)N(C)[C@H](C)c2cccc(F)c2)nc1	ZINC001755322231	1440819215	/nfs/dbraw/zinc/81/92/15/1440819215.db2.gz	DMZBMPGBYHSMNB-HUUCEWRRSA-N	0	3	339.414	3.013	20	30		EGEDHN
C[C@@H](Cc1ccccc1)C(=O)NC[C@H](C)N(C)Cc1cccc(C#N)c1	ZINC001755327209	1440822459	/nfs/dbraw/zinc/82/24/59/1440822459.db2.gz	FIEQXQPDZKWCNK-ROUUACIJSA-N	0	3	349.478	3.374	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2cc(CCC)n[nH]2)CCCCC1	ZINC001755353643	1440828790	/nfs/dbraw/zinc/82/87/90/1440828790.db2.gz	RPTUIPQSPMLADN-UHFFFAOYSA-N	0	3	338.883	3.137	20	30		EGEDHN
CCCC[C@@H](CNCc1ccc(C#N)cc1F)NC(=O)C(C)(F)F	ZINC001755356232	1440829511	/nfs/dbraw/zinc/82/95/11/1440829511.db2.gz	IAKFTQJFPIXREX-AWEZNQCLSA-N	0	3	341.377	3.117	20	30		EGEDHN
CCCC[C@H](CNCC#Cc1ccccc1)NC(=O)[C@@H]1CCC1(F)F	ZINC001755357360	1440830112	/nfs/dbraw/zinc/83/01/12/1440830112.db2.gz	DUWMEWBJAXYNAI-MSOLQXFVSA-N	0	3	348.437	3.348	20	30		EGEDHN
C#CCN1CCCCC[C@H]1CNC(=O)[C@@H](CC)c1ccc(OC)cc1	ZINC001755367320	1440835490	/nfs/dbraw/zinc/83/54/90/1440835490.db2.gz	FSESBPBRIWLHFZ-ICSRJNTNSA-N	0	3	342.483	3.183	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H](C)C1CN(CCc2ccc3ccccc3c2)C1	ZINC001755373376	1440837773	/nfs/dbraw/zinc/83/77/73/1440837773.db2.gz	JBIOFBXZHQVTRE-GOSISDBHSA-N	0	3	348.490	3.478	20	30		EGEDHN
C#CCCN1CC([C@@H](C)NC(=O)C[C@@H](c2ccccc2)C(C)C)C1	ZINC001755388196	1440841171	/nfs/dbraw/zinc/84/11/71/1440841171.db2.gz	AOOXTJHFJNQOMC-YLJYHZDGSA-N	0	3	326.484	3.276	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)[C@H](C)c2cccc(C)c2)C(C)(C)C1	ZINC001755411415	1440846608	/nfs/dbraw/zinc/84/66/08/1440846608.db2.gz	KQORRAWZZOFENB-IEBWSBKVSA-N	0	3	344.499	3.128	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C[C@@H](C)c2ccccc2C)C(C)(C)C1	ZINC001755411814	1440846677	/nfs/dbraw/zinc/84/66/77/1440846677.db2.gz	OMXLDMHGXQCZKW-MJGOQNOKSA-N	0	3	326.484	3.339	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@H]2CN(Cc3ncoc3C(C)C)C[C@@H]2C1	ZINC001755449721	1440853099	/nfs/dbraw/zinc/85/30/99/1440853099.db2.gz	IXBPNTLZHMVEBN-YESZJQIVSA-N	0	3	345.487	3.481	20	30		EGEDHN
C=C(Cl)CNCCC[C@@H](C)NC(=O)c1nc(C(C)C)oc1C	ZINC001755498489	1440862418	/nfs/dbraw/zinc/86/24/18/1440862418.db2.gz	JVDSPGDVMFDAIK-GFCCVEGCSA-N	0	3	327.856	3.347	20	30		EGEDHN
C[C@H](CCCNCc1cc(C#N)ccc1F)NC(=O)[C@H]1CC12CCC2	ZINC001755518950	1440864750	/nfs/dbraw/zinc/86/47/50/1440864750.db2.gz	XRFJAQGMYLHDHJ-RHSMWYFYSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CCC(N(C)C/C=C/Cl)CC1)OCC	ZINC001755530292	1440867115	/nfs/dbraw/zinc/86/71/15/1440867115.db2.gz	ZGYKMDDLXNENHF-YXMGTMDOSA-N	0	3	328.884	3.033	20	30		EGEDHN
CCCc1[nH]ccc1C(=O)N1C[C@H](NCC#Cc2ccccc2)C[C@H]1C	ZINC001755683816	1440895561	/nfs/dbraw/zinc/89/55/61/1440895561.db2.gz	YZFXTDQSNKRXFG-IEBWSBKVSA-N	0	3	349.478	3.212	20	30		EGEDHN
CC#CCN1CC[C@]2(NC(=O)[C@@H](CC)OC3CCCCC3)CCC[C@H]12	ZINC001755699112	1440899080	/nfs/dbraw/zinc/89/90/80/1440899080.db2.gz	SMCXWWWKQSFFNV-SVFBPWRDSA-N	0	3	346.515	3.251	20	30		EGEDHN
C#CCN1CC[C@@]2(NC(=O)CCCc3sccc3C)CCC[C@H]12	ZINC001755704063	1440901520	/nfs/dbraw/zinc/90/15/20/1440901520.db2.gz	HFKLEESNRXHRNX-HKUYNNGSSA-N	0	3	330.497	3.126	20	30		EGEDHN
C=CCN1CC[C@]2(NC(=O)COC[C@@H](C)c3ccccc3)CCC[C@H]12	ZINC001755704649	1440902061	/nfs/dbraw/zinc/90/20/61/1440902061.db2.gz	OIFDYRLXCPZSNY-SLYNCCJLSA-N	0	3	342.483	3.106	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@H](CNCc2cc(O)ccc2Cl)C1	ZINC001755730859	1440910160	/nfs/dbraw/zinc/91/01/60/1440910160.db2.gz	NYXMCOFKFWFOEL-DZGCQCFKSA-N	0	3	336.863	3.386	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1C[C@H](NCC#Cc2ccccc2)C(C)(C)C1	ZINC001755763971	1440915537	/nfs/dbraw/zinc/91/55/37/1440915537.db2.gz	LRFRXFWJSXAPAW-HKUYNNGSSA-N	0	3	326.484	3.157	20	30		EGEDHN
C#CCCN(C)CCN(C(=O)c1cc(F)cc2ccncc21)C(C)C	ZINC001755812537	1440921234	/nfs/dbraw/zinc/92/12/34/1440921234.db2.gz	ABSBLNMQWFWLAJ-UHFFFAOYSA-N	0	3	341.430	3.180	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H](CNCC#Cc2ccccc2)C(C)(C)C)cn1	ZINC001755818077	1440924789	/nfs/dbraw/zinc/92/47/89/1440924789.db2.gz	FZWKROWJYJNNDS-FQEVSTJZSA-N	0	3	349.478	3.176	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H](CNCc1ccnc(Cl)c1)C(C)(C)C	ZINC001755822782	1440926203	/nfs/dbraw/zinc/92/62/03/1440926203.db2.gz	XEDSBUINGZKIBY-OAHLLOKOSA-N	0	3	335.879	3.015	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H](CNCc1cnc(C)nc1)C(C)(C)C	ZINC001755825743	1440927233	/nfs/dbraw/zinc/92/72/33/1440927233.db2.gz	VZPLSDDKSUYZPO-INIZCTEOSA-N	0	3	332.492	3.008	20	30		EGEDHN
CC(C)(C)[C@@H](CNCc1ccc(C#N)s1)NC(=O)[C@H]1CC12CC2	ZINC001755833697	1440929359	/nfs/dbraw/zinc/92/93/59/1440929359.db2.gz	ODKVOIFNCGHPQJ-HUUCEWRRSA-N	0	3	331.485	3.040	20	30		EGEDHN
C#CCCCCC(=O)N[C@H](C)C1CCN(Cc2cccnc2C)CC1	ZINC001755842390	1440932131	/nfs/dbraw/zinc/93/21/31/1440932131.db2.gz	CLGNWRYJQSNMQJ-GOSISDBHSA-N	0	3	341.499	3.300	20	30		EGEDHN
C=CC(C)(C)CC(=O)N(C)C1CC(NCC(=C)Br)C1	ZINC001755858041	1440936076	/nfs/dbraw/zinc/93/60/76/1440936076.db2.gz	MPHVLGKKDLDUFK-UHFFFAOYSA-N	0	3	329.282	3.076	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)CCc1scnc1C)C(C)C	ZINC000298758746	202348584	/nfs/dbraw/zinc/34/85/84/202348584.db2.gz	WZVQBRQTKIHKDE-MRXNPFEDSA-N	0	3	335.517	3.199	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](c2ccccc2C)C2CC2)CC1	ZINC000264851419	201211418	/nfs/dbraw/zinc/21/14/18/201211418.db2.gz	LRXNDPKXHVBUDA-IBGZPJMESA-N	0	3	327.472	3.396	20	30		EGEDHN
C#CCNC(=O)[C@H](C)N[C@H](C)c1ccc(-c2ccccc2OC)cc1	ZINC000266435078	201220411	/nfs/dbraw/zinc/22/04/11/201220411.db2.gz	FDCSKBCKUWRQKX-CVEARBPZSA-N	0	3	336.435	3.151	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)N1CC[C@@H](COCc2ccccc2)C1	ZINC000266524085	201220735	/nfs/dbraw/zinc/22/07/35/201220735.db2.gz	APZMZVZPVQWWJC-AZUAARDMSA-N	0	3	342.483	3.114	20	30		EGEDHN
C=CCN(CCC(=O)Nc1cc(OC)c(Cl)cc1OC)C1CC1	ZINC000271366708	201242736	/nfs/dbraw/zinc/24/27/36/201242736.db2.gz	GEHBWNBHWNECAS-UHFFFAOYSA-N	0	3	338.835	3.336	20	30		EGEDHN
C=CCC[C@H](O)CN[C@@H](C)c1ccc(OC)c(Br)c1	ZINC000271712837	201245718	/nfs/dbraw/zinc/24/57/18/201245718.db2.gz	VLXJNMMLNNZKQL-AAEUAGOBSA-N	0	3	328.250	3.435	20	30		EGEDHN
C=CCC[C@@H](O)CN[C@@H](C)c1ccc(OC)c(Br)c1	ZINC000271712839	201246452	/nfs/dbraw/zinc/24/64/52/201246452.db2.gz	VLXJNMMLNNZKQL-WCQYABFASA-N	0	3	328.250	3.435	20	30		EGEDHN
C#CC[C@@H](NC[C@H](O)COCc1ccccc1F)c1ccccc1	ZINC000271762442	201246640	/nfs/dbraw/zinc/24/66/40/201246640.db2.gz	ZWLRWIAAPPLERI-AZUAARDMSA-N	0	3	327.399	3.057	20	30		EGEDHN
C[C@@H]1CCN(C[C@@H](O)c2ccc(C#N)cc2)CCN1Cc1ccccc1	ZINC000268616607	201226897	/nfs/dbraw/zinc/22/68/97/201226897.db2.gz	MNLBXTACDTYPTP-XMSQKQJNSA-N	0	3	349.478	3.188	20	30		EGEDHN
C=CCCCCNC(=O)N(Cc1ccncc1)C[C@@H]1CCCN1CC	ZINC000274690921	201270236	/nfs/dbraw/zinc/27/02/36/201270236.db2.gz	UUGODDRCTNTTQV-IBGZPJMESA-N	0	3	344.503	3.434	20	30		EGEDHN
C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCCN(Cc2cc(C#N)n(C)c2)C1	ZINC000191366176	239068798	/nfs/dbraw/zinc/06/87/98/239068798.db2.gz	PIYYGYKDMYFPGN-ZBFHGGJFSA-N	0	3	346.475	3.022	20	30		EGEDHN
Cn1cc(CN2CCC[C@@H]2C[C@H](O)c2ccc(F)cc2)cc1C#N	ZINC000191444168	239115485	/nfs/dbraw/zinc/11/54/85/239115485.db2.gz	KWMFUGUCCSKQMQ-MJGOQNOKSA-N	0	3	327.403	3.124	20	30		EGEDHN
C=CCC1(C(=O)NCCc2ccc(OCCN(C)C)cc2)CCC1	ZINC000277339575	201301677	/nfs/dbraw/zinc/30/16/77/201301677.db2.gz	WFVSPOCIDYWTQM-UHFFFAOYSA-N	0	3	330.472	3.032	20	30		EGEDHN
N#Cc1ccccc1/C=C\C(=O)NCCCN1CCc2ccccc2C1	ZINC000096401548	201376502	/nfs/dbraw/zinc/37/65/02/201376502.db2.gz	AJUQFIUGSFXKGY-KHPPLWFESA-N	0	3	345.446	3.136	20	30		EGEDHN
CN(CCSc1nccc(C#N)c1[N+](=O)[O-])Cc1ccccc1	ZINC000193746119	240291677	/nfs/dbraw/zinc/29/16/77/240291677.db2.gz	QYSSMRJBHGUQJA-UHFFFAOYSA-N	0	3	328.397	3.086	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C(=O)[C@H]1CCCCN1C1CCCC1	ZINC000241897231	243005030	/nfs/dbraw/zinc/00/50/30/243005030.db2.gz	TWTLVAQYLSIECA-LJQANCHMSA-N	0	3	325.456	3.314	20	30		EGEDHN
C[C@H]1SCCN(CCC(=O)Nc2ccc(C#N)c(Cl)c2)[C@H]1C	ZINC000118414071	204276212	/nfs/dbraw/zinc/27/62/12/204276212.db2.gz	UMHZVJTZPQSKPG-NWDGAFQWSA-N	0	3	337.876	3.366	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@H]1CCCC[C@H]1NCc1ccc(C#N)o1	ZINC000174565583	207032187	/nfs/dbraw/zinc/03/21/87/207032187.db2.gz	DKMBMXQZQCMMBS-CZUORRHYSA-N	0	3	333.432	3.324	20	30		EGEDHN
COC(=O)N1CCC[C@H]([C@H](C)N[C@@H](C)c2ccc(C#N)cc2F)C1	ZINC000495509118	269701592	/nfs/dbraw/zinc/70/15/92/269701592.db2.gz	DIEIZQMZRZDTGH-YDHLFZDLSA-N	0	3	333.407	3.215	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN2CCC(OCc3ccccc3)CC2)cc1	ZINC000268653429	252105754	/nfs/dbraw/zinc/10/57/54/252105754.db2.gz	WKJJMZLNODNCSW-NRFANRHFSA-N	0	3	336.435	3.273	20	30		EGEDHN
Cc1sc(NC(=O)CN[C@H]2CCCO[C@H]2CC(C)C)c(C#N)c1C	ZINC000186389094	144131969	/nfs/dbraw/zinc/13/19/69/144131969.db2.gz	CJAYCMSBZDOGID-HOTGVXAUSA-N	0	3	349.500	3.358	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccc(F)c(C#N)c2)C1	ZINC000341101265	155157375	/nfs/dbraw/zinc/15/73/75/155157375.db2.gz	DRRBSGHPBOYSDT-KSSFIOAISA-N	0	3	337.398	3.263	20	30		EGEDHN
CN(C)CCNC(=O)c1ccccc1Sc1ccccc1C#N	ZINC000120344590	152268809	/nfs/dbraw/zinc/26/88/09/152268809.db2.gz	MTQGUEHEXCFWQL-UHFFFAOYSA-N	0	3	325.437	3.001	20	30		EGEDHN
CSc1ccc([C@@H](CNC(=O)c2cccc(C#N)c2)N(C)C)cc1	ZINC000341608345	155380799	/nfs/dbraw/zinc/38/07/99/155380799.db2.gz	NSLRYTFEVBBKOK-GOSISDBHSA-N	0	3	339.464	3.313	20	30		EGEDHN
Cn1cc(CN2CCCN(Cc3ccc(Cl)cc3)CC2)cc1C#N	ZINC000191202697	153181859	/nfs/dbraw/zinc/18/18/59/153181859.db2.gz	FUTDOOZQEOYVBP-UHFFFAOYSA-N	0	3	342.874	3.258	20	30		EGEDHN
N#Cc1ccc(NC(=O)NC[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000193633460	153299708	/nfs/dbraw/zinc/29/97/08/153299708.db2.gz	WMTHBMBBEWQIKK-GOSISDBHSA-N	0	3	334.423	3.202	20	30		EGEDHN
N#Cc1ccsc1C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000194596513	153347389	/nfs/dbraw/zinc/34/73/89/153347389.db2.gz	DJSPOKIXXNLMQQ-UHFFFAOYSA-N	0	3	339.464	3.057	20	30		EGEDHN
CCCN(Cc1ccc(Br)cc1C#N)CC(C)(C)O	ZINC000346832050	156155607	/nfs/dbraw/zinc/15/56/07/156155607.db2.gz	AJMLVACPRKLWIN-UHFFFAOYSA-N	0	3	325.250	3.304	20	30		EGEDHN
Cc1nc(C(=O)NC[C@@H]2CCCCN2Cc2ccccc2)ccc1C#N	ZINC000109303397	162097822	/nfs/dbraw/zinc/09/78/22/162097822.db2.gz	KDQRHJAWBMLXOW-IBGZPJMESA-N	0	3	348.450	3.046	20	30		EGEDHN
Cc1ncsc1CN[C@H]1CCCN(c2ccc(C#N)cc2F)C1	ZINC000344241113	164135284	/nfs/dbraw/zinc/13/52/84/164135284.db2.gz	VCKCTUVBDGIUCA-AWEZNQCLSA-N	0	3	330.432	3.221	20	30		EGEDHN
C[C@@H](CN(C)C)NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1	ZINC000346128354	164344273	/nfs/dbraw/zinc/34/42/73/164344273.db2.gz	DIJFMCKRXNXUAW-ZDUSSCGKSA-N	0	3	341.386	3.170	20	30		EGEDHN
Cc1cccc(CN[C@H]2CCCN(c3ccc(C#N)cc3)C2=O)c1C	ZINC000355780342	166306363	/nfs/dbraw/zinc/30/63/63/166306363.db2.gz	VSMJAXYDQONZLC-FQEVSTJZSA-N	0	3	333.435	3.460	20	30		EGEDHN
CC[C@@H](C)N[C@@H](CNC(=O)Cc1c(F)cccc1C#N)c1ccco1	ZINC000359540106	167185478	/nfs/dbraw/zinc/18/54/78/167185478.db2.gz	JCMSNSBUUBMQJK-DYVFJYSZSA-N	0	3	343.402	3.078	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N[C@H](CN(C)C)c1ccc(F)cc1	ZINC000359819660	167240351	/nfs/dbraw/zinc/24/03/51/167240351.db2.gz	KWSOHHGAJULFRO-GOSISDBHSA-N	0	3	325.387	3.039	20	30		EGEDHN
C[C@@H]1COc2ccccc2CN1CCC(=O)Nc1ccccc1C#N	ZINC000360680757	167386596	/nfs/dbraw/zinc/38/65/96/167386596.db2.gz	NANHCPCUVCLYAJ-OAHLLOKOSA-N	0	3	335.407	3.170	20	30		EGEDHN
C[C@H](CN1CCCCC1)NC(=O)N[C@H]1CCCc2cc(C#N)ccc21	ZINC000416684968	269872066	/nfs/dbraw/zinc/87/20/66/269872066.db2.gz	MCIGDBUDRFZGSR-BEFAXECRSA-N	0	3	340.471	3.109	20	30		EGEDHN
N#Cc1ccc(NCC2CCN(Cc3ccccc3Cl)CC2)nn1	ZINC000302015926	270044472	/nfs/dbraw/zinc/04/44/72/270044472.db2.gz	YLMXMTSISPODGH-UHFFFAOYSA-N	0	3	341.846	3.326	20	30		EGEDHN
C#CCNC(=O)[C@H](C)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000368057153	270045884	/nfs/dbraw/zinc/04/58/84/270045884.db2.gz	BUQCPCMPYJYZAQ-HOTGVXAUSA-N	0	3	331.419	3.014	20	30		EGEDHN
N#Cc1cccc(CNC[C@@H]2CSCCN2Cc2ccccc2)c1	ZINC000428561182	270050287	/nfs/dbraw/zinc/05/02/87/270050287.db2.gz	UVURJEAZRNAZLX-HXUWFJFHSA-N	0	3	337.492	3.265	20	30		EGEDHN
N#Cc1ccccc1OCCN(CCc1ccccc1)[C@@H]1CCOC1	ZINC000437536522	270051433	/nfs/dbraw/zinc/05/14/33/270051433.db2.gz	MUZCGZLFJCHDMI-HXUWFJFHSA-N	0	3	336.435	3.271	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)c2ccc(C#N)s2)N(C)C)cc1	ZINC000486827477	270055998	/nfs/dbraw/zinc/05/59/98/270055998.db2.gz	SFAINOOUSRNRMP-MRXNPFEDSA-N	0	3	327.453	3.215	20	30		EGEDHN
N#Cc1ccc(/C=C\C(=O)N2CCCN(Cc3ccccc3)CC2)cc1	ZINC000490883981	270056956	/nfs/dbraw/zinc/05/69/56/270056956.db2.gz	BZNISHLCONTKTN-QXMHVHEDSA-N	0	3	345.446	3.306	20	30		EGEDHN
C/C(=C/c1ccccc1)CN(C)C[C@H](O)COc1ccc(C#N)cc1	ZINC000494272643	270058744	/nfs/dbraw/zinc/05/87/44/270058744.db2.gz	APXPARDMOBBJJT-PGNDWZGLSA-N	0	3	336.435	3.333	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@@H](NCc1cccc(N3CCOC3=O)c1)CC2	ZINC000496976975	270059147	/nfs/dbraw/zinc/05/91/47/270059147.db2.gz	IFCYOERLPXAIHH-IBGZPJMESA-N	0	3	333.391	3.292	20	30		EGEDHN
CCN(Cc1nnc(-c2ccc(C#N)cc2)o1)[C@H]1CCOC(C)(C)C1	ZINC000289359661	266140117	/nfs/dbraw/zinc/14/01/17/266140117.db2.gz	ABGZEHZYHIJCQC-INIZCTEOSA-N	0	3	340.427	3.388	20	30		EGEDHN
CCO[C@@H]1C[C@H](N[C@H](C)C(=O)Nc2oc(C)c(C)c2C#N)C12CCC2	ZINC000296038506	266297320	/nfs/dbraw/zinc/29/73/20/266297320.db2.gz	FCYGJOKIRJHINY-UHOFOFEASA-N	0	3	345.443	3.032	20	30		EGEDHN
CCS[C@H]1CCC[C@@H]1NCC(=O)Nc1cc(Cl)ccc1C#N	ZINC000286377507	266347633	/nfs/dbraw/zinc/34/76/33/266347633.db2.gz	YYGLWRIXLYJPKK-ZFWWWQNUSA-N	0	3	337.876	3.414	20	30		EGEDHN
COc1cc(CNCCc2nc3c(s2)CCCC3)ccc1C#N	ZINC000281808610	266824720	/nfs/dbraw/zinc/82/47/20/266824720.db2.gz	VWJSZICERAXDTG-UHFFFAOYSA-N	0	3	327.453	3.234	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@H](CNCc1ccc(C#N)c(F)c1)C1CC1	ZINC000496046795	266865424	/nfs/dbraw/zinc/86/54/24/266865424.db2.gz	VIVNAVFYLRCLEX-INIZCTEOSA-N	0	3	333.407	3.090	20	30		EGEDHN
C[C@@H](CNc1ccc(Cl)c(C#N)n1)N1CCc2ccccc2C1	ZINC000301187711	266933221	/nfs/dbraw/zinc/93/32/21/266933221.db2.gz	WFHDTNHJCYRBBY-ZDUSSCGKSA-N	0	3	326.831	3.465	20	30		EGEDHN
CCCN(CCc1cccs1)Cc1cnc2c(C#N)cnn2c1	ZINC000518771391	267013153	/nfs/dbraw/zinc/01/31/53/267013153.db2.gz	MKQBLUGBZOJDQZ-UHFFFAOYSA-N	0	3	325.441	3.117	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)C(=O)NC[C@@H]1CCCN1CCC	ZINC000511916206	267013952	/nfs/dbraw/zinc/01/39/52/267013952.db2.gz	KWUISBDPPJBAIO-IBGZPJMESA-N	0	3	342.487	3.354	20	30		EGEDHN
CCO[C@@H]1C[C@@H](NCC(=O)Nc2ccc(C#N)cc2)C1(CC)CC	ZINC000429338318	267150199	/nfs/dbraw/zinc/15/01/99/267150199.db2.gz	MGENFQKHEKDLDF-IAGOWNOFSA-N	0	3	329.444	3.070	20	30		EGEDHN
C[C@H](NCCC(=O)N1CCc2sccc2C1)c1ccc(C#N)cc1	ZINC000271870251	267182108	/nfs/dbraw/zinc/18/21/08/267182108.db2.gz	MLJFFFGLENAYIO-AWEZNQCLSA-N	0	3	339.464	3.245	20	30		EGEDHN
CC[C@@H](C)N[C@H](CNC(=O)NCc1ccc(C#N)cc1)c1ccco1	ZINC000479271333	267186260	/nfs/dbraw/zinc/18/62/60/267186260.db2.gz	FOYSBIMIYMGQLR-RHSMWYFYSA-N	0	3	340.427	3.080	20	30		EGEDHN
CC[C@H](NC[C@H]1CN(Cc2ccccc2)CCO1)c1ccc(C#N)cc1	ZINC000447511409	267222388	/nfs/dbraw/zinc/22/23/88/267222388.db2.gz	UDCFUEUMABKKQK-VXKWHMMOSA-N	0	3	349.478	3.500	20	30		EGEDHN
CC[C@H]1CCCCN1CCNC(=O)Nc1ccc(COC)c(C#N)c1	ZINC000529218226	267226191	/nfs/dbraw/zinc/22/61/91/267226191.db2.gz	VEUDCOXSEVGKKJ-SFHVURJKSA-N	0	3	344.459	3.091	20	30		EGEDHN
CN(CC(=O)NCc1ccc(C#N)cc1)[C@H]1CCC[C@H]1c1ccccc1	ZINC000459667452	267297942	/nfs/dbraw/zinc/29/79/42/267297942.db2.gz	ARJMGSLJTRIIJS-SFTDATJTSA-N	0	3	347.462	3.443	20	30		EGEDHN
CN1CC=C(CNC(=O)Nc2ccc(OC(C)(C)C)c(C#N)c2)CC1	ZINC000455766274	267331816	/nfs/dbraw/zinc/33/18/16/267331816.db2.gz	IBWUYLQUJDPJRY-UHFFFAOYSA-N	0	3	342.443	3.119	20	30		EGEDHN
Cc1cc([C@@H](C)NC[C@H](O)COc2ccc(C#N)cc2)c(C)s1	ZINC000193131520	267361837	/nfs/dbraw/zinc/36/18/37/267361837.db2.gz	GQIOCWKOPSUWQK-CJNGLKHVSA-N	0	3	330.453	3.327	20	30		EGEDHN
Cc1ccc(O)c([C@@H](C)N[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)c1	ZINC000190618213	267433302	/nfs/dbraw/zinc/43/33/02/267433302.db2.gz	CPFGSMQOIRZAEU-DNVCBOLYSA-N	0	3	349.434	3.024	20	30		EGEDHN
CC[C@H](NCc1ccc(Cn2cncn2)cc1)c1ccc(C#N)cc1	ZINC000278323793	267986927	/nfs/dbraw/zinc/98/69/27/267986927.db2.gz	VKSQUWGFUVWBRT-FQEVSTJZSA-N	0	3	331.423	3.439	20	30		EGEDHN
Cc1cnccc1OC1CCN(CCOc2ccc(C#N)cc2)CC1	ZINC000278499840	268025576	/nfs/dbraw/zinc/02/55/76/268025576.db2.gz	ACAZKSGLAXMHPY-UHFFFAOYSA-N	0	3	337.423	3.184	20	30		EGEDHN
Cc1ccc(OCCNC(=O)C(C#N)Cc2ccc(C#N)cc2)c(C)c1	ZINC000525830557	268041738	/nfs/dbraw/zinc/04/17/38/268041738.db2.gz	ULZJOYNHQMBJJV-IBGZPJMESA-N	0	3	347.418	3.053	20	30		EGEDHN
Cc1ccc([C@@H]2C[C@@H](C)N(CC(=O)NCc3ccc(C#N)cc3)C2)cc1	ZINC000490067229	268045039	/nfs/dbraw/zinc/04/50/39/268045039.db2.gz	XIWAKODNURZHBW-DYESRHJHSA-N	0	3	347.462	3.361	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CC=C(c3ccccc3F)C2)cc1	ZINC000370033812	268083991	/nfs/dbraw/zinc/08/39/91/268083991.db2.gz	TWWFWALXWYXKQS-SFHVURJKSA-N	0	3	345.377	3.305	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@@H]2CCCc3c(O)cccc32)cc1	ZINC000352084422	268086796	/nfs/dbraw/zinc/08/67/96/268086796.db2.gz	KSYTUWPFIYFAFJ-QFBILLFUSA-N	0	3	345.402	3.140	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@H]2CCc3cc(F)ccc32)cc1	ZINC000279395040	268087041	/nfs/dbraw/zinc/08/70/41/268087041.db2.gz	UPNMBGSYMDEBED-LPHOPBHVSA-N	0	3	333.366	3.183	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCC2(c3ccccc3)CC2)cc1	ZINC000279703371	268089325	/nfs/dbraw/zinc/08/93/25/268089325.db2.gz	JVRILMALRGMLQC-GOSISDBHSA-N	0	3	329.403	3.089	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN2CC[C@H](Oc3ccc(Cl)cc3)C2)cc1	ZINC000293030064	268213196	/nfs/dbraw/zinc/21/31/96/268213196.db2.gz	LFGFDBPDOISGSZ-OALUTQOASA-N	0	3	342.826	3.398	20	30		EGEDHN
N#Cc1cccc(OC2CCN([C@@H]3Cc4ccccc4[C@@H]3O)CC2)c1	ZINC000272038263	268271055	/nfs/dbraw/zinc/27/10/55/268271055.db2.gz	XQNDPEYQWGUKIB-RTWAWAEBSA-N	0	3	334.419	3.060	20	30		EGEDHN
N#Cc1cccc(OCCCN2CC[C@@H](OCc3ccncc3)C2)c1	ZINC000280951389	268273541	/nfs/dbraw/zinc/27/35/41/268273541.db2.gz	ISZZMPUAKRXLPI-HXUWFJFHSA-N	0	3	337.423	3.013	20	30		EGEDHN
N#Cc1cccc(OCCCN[C@@]2(CO)CCCc3ccccc32)c1	ZINC000440820413	268284383	/nfs/dbraw/zinc/28/43/83/268284383.db2.gz	OJUHSWOHQYVKTL-OAQYLSRUSA-N	0	3	336.435	3.141	20	30		EGEDHN
CCN1CCC(NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)CC1	ZINC000480393058	269654292	/nfs/dbraw/zinc/65/42/92/269654292.db2.gz	HNAYBDCNJISNQS-UHFFFAOYSA-N	0	3	342.487	3.210	20	30		EGEDHN
CN(C)CCOc1ccccc1CNc1nc(Cl)c(C#N)s1	ZINC000286091246	275950486	/nfs/dbraw/zinc/95/04/86/275950486.db2.gz	DXDQDQMINDRGNV-UHFFFAOYSA-N	0	3	336.848	3.221	20	30		EGEDHN
COc1ccc([C@H](C)NC[C@@H](O)c2ccc(C#N)cc2)c(C)c1OC	ZINC000287103806	276084168	/nfs/dbraw/zinc/08/41/68/276084168.db2.gz	XZHAHALXQIMXAV-KBXCAEBGSA-N	0	3	340.423	3.268	20	30		EGEDHN
COc1ccc(CN(CCN(C)C)Cc2cccs2)cc1C#N	ZINC000289178043	276300440	/nfs/dbraw/zinc/30/04/40/276300440.db2.gz	AERXKIAEEMKTMC-UHFFFAOYSA-N	0	3	329.469	3.192	20	30		EGEDHN
N#Cc1cc(Oc2ccc(NC(=O)C34CCCN3CCC4)cc2)ccn1	ZINC000290571560	276513508	/nfs/dbraw/zinc/51/35/08/276513508.db2.gz	OMCKEUCEALEEJQ-UHFFFAOYSA-N	0	3	348.406	3.312	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)c1cc2ccccc2[nH]1	ZINC000065931025	307360728	/nfs/dbraw/zinc/36/07/28/307360728.db2.gz	OYGPVXHOPRBQDW-UHFFFAOYSA-N	0	3	346.434	3.244	20	30		EGEDHN
N#Cc1ccccc1OCCN1CCC[C@H]1Cn1cnc2ccccc21	ZINC000536068815	314092833	/nfs/dbraw/zinc/09/28/33/314092833.db2.gz	OLZKPJSKBFGTBC-SFHVURJKSA-N	0	3	346.434	3.451	20	30		EGEDHN
C[C@@H](N[C@@H]1CCN(c2ncccc2F)C1)c1ccc(C#N)c(F)c1	ZINC000537406299	314179183	/nfs/dbraw/zinc/17/91/83/314179183.db2.gz	CLFZSJGAVNFYNN-IUODEOHRSA-N	0	3	328.366	3.161	20	30		EGEDHN
C[C@@]1(NC[C@@H](O)COc2ccc(C#N)cc2)CCCc2ccccc21	ZINC000537605237	314195267	/nfs/dbraw/zinc/19/52/67/314195267.db2.gz	LFMLBUYZLQFTQY-WIYYLYMNSA-N	0	3	336.435	3.139	20	30		EGEDHN
C[C@@H]1CN(Cc2cn(C)nc2-c2ccc(C#N)cc2)C[C@@H](C)S1	ZINC000537612882	314196302	/nfs/dbraw/zinc/19/63/02/314196302.db2.gz	HVQAUIXHKGHFFY-ZIAGYGMSSA-N	0	3	326.469	3.285	20	30		EGEDHN
CCc1ccc(CN[C@H]2CCCN(c3ccc(C#N)cc3)C2=O)s1	ZINC000541871296	314498852	/nfs/dbraw/zinc/49/88/52/314498852.db2.gz	ULLBKBHUOIIZOP-SFHVURJKSA-N	0	3	339.464	3.467	20	30		EGEDHN
CC(C)(Cc1ccccc1Cl)NCc1cnc2c(C#N)cnn2c1	ZINC000552413273	315219012	/nfs/dbraw/zinc/21/90/12/315219012.db2.gz	UDEIFIGSYVKCMW-UHFFFAOYSA-N	0	3	339.830	3.365	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCC[C@H]2Oc2cc(F)cc(F)c2)nc1	ZINC000563362179	316007388	/nfs/dbraw/zinc/00/73/88/316007388.db2.gz	ASHYLCKSZDWKNH-ZWKOTPCHSA-N	0	3	329.350	3.321	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN[C@@H]2CCc3sc(Cl)cc32)cc1	ZINC000564651112	316181989	/nfs/dbraw/zinc/18/19/89/316181989.db2.gz	KFEIMZXOGGXDBA-IUODEOHRSA-N	0	3	348.855	3.290	20	30		EGEDHN
C[C@H]1C[C@H](C(C)(C)C)CCN1CC(=O)NCc1cccc(C#N)c1	ZINC000565125638	316270958	/nfs/dbraw/zinc/27/09/58/316270958.db2.gz	QYQSWURVBVZRLG-MAUKXSAKSA-N	0	3	327.472	3.321	20	30		EGEDHN
C[C@]1(NC(=O)CCc2ccc(C#N)cc2)CCN(Cc2ccccc2)C1	ZINC000572770431	317389033	/nfs/dbraw/zinc/38/90/33/317389033.db2.gz	SRIKEMHFNXRKAZ-QFIPXVFZSA-N	0	3	347.462	3.272	20	30		EGEDHN
CC(C)n1cc([C@H](C)NCCC(=O)Nc2ccccc2C#N)cn1	ZINC000572819881	317395453	/nfs/dbraw/zinc/39/54/53/317395453.db2.gz	GUROYHQKLFWZOJ-AWEZNQCLSA-N	0	3	325.416	3.015	20	30		EGEDHN
C[C@H]1CCCc2ccccc2[C@H]1NCc1cnc2c(C#N)cnn2c1	ZINC000574205803	317572642	/nfs/dbraw/zinc/57/26/42/317572642.db2.gz	LHLPLSJWRAMNSK-LIRRHRJNSA-N	0	3	331.423	3.404	20	30		EGEDHN
N#Cc1ccc(N2CCC(N[C@@H]3COc4ccc(F)cc43)CC2)cc1	ZINC000578213008	324936231	/nfs/dbraw/zinc/93/62/31/324936231.db2.gz	SZCITDBUCJYPTI-LJQANCHMSA-N	0	3	337.398	3.389	20	30		EGEDHN
Cc1ccccc1[C@@H](CC(C)C)NCC(=O)N[C@@](C)(C#N)C1CC1	ZINC000183238761	455258213	/nfs/dbraw/zinc/25/82/13/455258213.db2.gz	QXPLUKAIJGGMJO-QUCCMNQESA-N	0	3	327.472	3.480	20	30		EGEDHN
C[C@H](NCC(=O)Nc1ccc(C#N)cc1)c1cccc(-n2cccn2)c1	ZINC000183588483	455309730	/nfs/dbraw/zinc/30/97/30/455309730.db2.gz	XZUABLQVLRTCJT-HNNXBMFYSA-N	0	3	345.406	3.033	20	30		EGEDHN
N#CCNC(=O)CN[C@H](CCCCc1ccccc1)c1ccccc1	ZINC000181455501	455337776	/nfs/dbraw/zinc/33/77/76/455337776.db2.gz	CJXWIEIGNKMXCN-HXUWFJFHSA-N	0	3	335.451	3.370	20	30		EGEDHN
COc1ccccc1[C@@H](C/N=C/c1cccc(O)c1O)N1CCCC1	ZINC000022769437	453697939	/nfs/dbraw/zinc/69/79/39/453697939.db2.gz	ZLSLDPOUGULYMD-VYVDHXHBSA-N	0	3	340.423	3.362	20	30		EGEDHN
Cc1cccc(OCCN(C)CCC(=O)Nc2cccc(C#N)c2)c1	ZINC000026337272	453797252	/nfs/dbraw/zinc/79/72/52/453797252.db2.gz	KAXMTQIGZJFIEQ-UHFFFAOYSA-N	0	3	337.423	3.206	20	30		EGEDHN
C[C@H](NC[C@H](O)COCc1ccccc1Cl)c1ccc(C#N)cc1	ZINC000030532599	453836436	/nfs/dbraw/zinc/83/64/36/453836436.db2.gz	SCIOCXKQNQPYMY-KSSFIOAISA-N	0	3	344.842	3.440	20	30		EGEDHN
COc1cccc2c1OCC(C(=O)C(C#N)c1nc3ccccc3o1)=C2	ZINC000075126775	453863841	/nfs/dbraw/zinc/86/38/41/453863841.db2.gz	AKDWJUVBTDCOFH-AWEZNQCLSA-N	0	3	346.342	3.489	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(CCC)Cc2ccccc2O)CC1	ZINC000066704081	453864051	/nfs/dbraw/zinc/86/40/51/453864051.db2.gz	ZMGFPGUMJJBGGF-UHFFFAOYSA-N	0	3	345.487	3.354	20	30		EGEDHN
CC(C)[C@@H](NCCS(=O)(=O)c1ccc(C#N)cc1)c1ccccc1	ZINC000081512373	453880022	/nfs/dbraw/zinc/88/00/22/453880022.db2.gz	QCQWKDIOUGSMNJ-LJQANCHMSA-N	0	3	342.464	3.319	20	30		EGEDHN
C[C@H](O)CN(Cc1nnc(-c2cccc(C#N)c2)o1)C1CCCCC1	ZINC000075717258	453921792	/nfs/dbraw/zinc/92/17/92/453921792.db2.gz	PSICDHKVNXIUJN-AWEZNQCLSA-N	0	3	340.427	3.124	20	30		EGEDHN
COc1ccc(C(=O)C(C#N)c2nc3ccccc3n2C(F)F)cn1	ZINC000041557822	453971259	/nfs/dbraw/zinc/97/12/59/453971259.db2.gz	ORQLCPZSCGNFTG-LLVKDONJSA-N	0	3	342.305	3.325	20	30		EGEDHN
CC(C)CN(CCN(C)C)C(=O)Nc1cc(C#N)ccc1OC(C)C	ZINC000085576072	454033573	/nfs/dbraw/zinc/03/35/73/454033573.db2.gz	RALBUXNTDTUWGL-UHFFFAOYSA-N	0	3	346.475	3.397	20	30		EGEDHN
Cc1cc([C@@H](NC2CCN(CC#N)CC2)c2cccnc2)ccc1F	ZINC000612409845	460623600	/nfs/dbraw/zinc/62/36/00/460623600.db2.gz	UBDQBRTXFDXBBG-HXUWFJFHSA-N	0	3	338.430	3.196	20	30		EGEDHN
CN(C)[C@@H](CNc1c(C#N)nnc2ccccc21)c1cccc(F)c1	ZINC000077165593	454069295	/nfs/dbraw/zinc/06/92/95/454069295.db2.gz	DFCPMRRLOXDYLP-SFHVURJKSA-N	0	3	335.386	3.355	20	30		EGEDHN
CC(C)(C)CCN1CCN(C(=O)Nc2cccc(OCC#N)c2)CC1	ZINC000056627398	454072025	/nfs/dbraw/zinc/07/20/25/454072025.db2.gz	UAYHPKULWSELKT-UHFFFAOYSA-N	0	3	344.459	3.175	20	30		EGEDHN
N#CC(C(=O)c1ccc(-n2ccnc2)cc1)c1cnc2ccccc2n1	ZINC000190930839	455408764	/nfs/dbraw/zinc/40/87/64/455408764.db2.gz	DFIWUROGIRGGJL-INIZCTEOSA-N	0	3	339.358	3.306	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)C(=O)NCCN1CCC(C)CC1	ZINC000056864769	454086309	/nfs/dbraw/zinc/08/63/09/454086309.db2.gz	NVXZEXWRUQZWHC-UHFFFAOYSA-N	0	3	345.487	3.125	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)cc1	ZINC000045053476	454135776	/nfs/dbraw/zinc/13/57/76/454135776.db2.gz	CDCWGIGJZLABAV-LJQANCHMSA-N	0	3	338.451	3.154	20	30		EGEDHN
Cc1cc(C(=O)C(C#N)c2cc(C)nc(C)n2)c(C)n1-c1ccccn1	ZINC000089599354	454166009	/nfs/dbraw/zinc/16/60/09/454166009.db2.gz	KETHMSVBMDAMBA-QGZVFWFLSA-N	0	3	345.406	3.386	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)c2ccsc2)cc1Cl	ZINC000130317077	454190158	/nfs/dbraw/zinc/19/01/58/454190158.db2.gz	DJFCMZVPLWUWPH-NSHDSACASA-N	0	3	334.784	3.371	20	30		EGEDHN
Cc1ccc(N2CC[C@H](N[C@@H](C)c3ccc(OCC#N)cc3)C2=O)cc1	ZINC000095404406	454203464	/nfs/dbraw/zinc/20/34/64/454203464.db2.gz	BSPIDVVDIRSPGK-JXFKEZNVSA-N	0	3	349.434	3.354	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)CCC1CCCC1	ZINC000047010906	454318422	/nfs/dbraw/zinc/31/84/22/454318422.db2.gz	WCMGALATRDHOBD-UHFFFAOYSA-N	0	3	327.472	3.419	20	30		EGEDHN
N#CCCCOc1cccc(CN[C@@H]2CCN(c3ccccn3)C2)c1	ZINC000120581440	454322060	/nfs/dbraw/zinc/32/20/60/454322060.db2.gz	UHQCAVXOPGMWLG-GOSISDBHSA-N	0	3	336.439	3.133	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@H](C)NCC1(c2ccccc2)CCOCC1	ZINC000078873917	454330625	/nfs/dbraw/zinc/33/06/25/454330625.db2.gz	XEQNVPXXFSUDFR-SFHVURJKSA-N	0	3	344.499	3.138	20	30		EGEDHN
C=CCn1c(Cc2ccccc2)nnc1SC[C@H]1CCN(C)C1	ZINC000191084428	455439562	/nfs/dbraw/zinc/43/95/62/455439562.db2.gz	HNBLQABWJZMWNU-INIZCTEOSA-N	0	3	328.485	3.099	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1F)C(=O)Nc1ccc(C#N)cc1	ZINC000047333869	454359277	/nfs/dbraw/zinc/35/92/77/454359277.db2.gz	AYINPKXIIVQDQW-UHFFFAOYSA-N	0	3	340.402	3.293	20	30		EGEDHN
C=CCOc1ccc(C(=O)N(CCN(C)C)Cc2ccco2)cc1	ZINC000121244275	454410588	/nfs/dbraw/zinc/41/05/88/454410588.db2.gz	NUMAGXSYVMPCSR-UHFFFAOYSA-N	0	3	328.412	3.048	20	30		EGEDHN
CC[C@@H]1CCCCN1CCNC(=O)c1cccc(SCC#N)c1	ZINC000079545744	454435835	/nfs/dbraw/zinc/43/58/35/454435835.db2.gz	CDIOBMLUNPMOOT-MRXNPFEDSA-N	0	3	331.485	3.297	20	30		EGEDHN
CN(C)Cc1cccc(NC(=O)CSCc2ccc(C#N)cc2)c1	ZINC000048147325	454448738	/nfs/dbraw/zinc/44/87/38/454448738.db2.gz	DMQBWZGXOMZZOU-UHFFFAOYSA-N	0	3	339.464	3.492	20	30		EGEDHN
N#CCCCOc1cccc(CN2CCS[C@H]3COCC[C@@H]32)c1	ZINC000091855945	454481826	/nfs/dbraw/zinc/48/18/26/454481826.db2.gz	OEFOBKUGOKIYIL-ROUUACIJSA-N	0	3	332.469	3.075	20	30		EGEDHN
Cc1nc(-c2ccc(C(=O)C(C#N)c3nc4ccccc4[nH]3)cc2)n[nH]1	ZINC000134120728	454505858	/nfs/dbraw/zinc/50/58/58/454505858.db2.gz	DLBBWRSAIUCJTE-CQSZACIVSA-N	0	3	342.362	3.147	20	30		EGEDHN
CC(C)(CCC#N)CNc1ccccc1CN1CCC[C@@H](C(N)=O)C1	ZINC000092161080	454529528	/nfs/dbraw/zinc/52/95/28/454529528.db2.gz	UNFBGSXGSLJFTR-QGZVFWFLSA-N	0	3	342.487	3.126	20	30		EGEDHN
N#Cc1ccccc1NC(=O)CCN1CC[C@H](Nc2ccccc2)C1	ZINC000103480948	454560485	/nfs/dbraw/zinc/56/04/85/454560485.db2.gz	WTCNQSXYLFTSNU-SFHVURJKSA-N	0	3	334.423	3.073	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)c1ccc(C(F)(F)F)nc1	ZINC000122890104	454578690	/nfs/dbraw/zinc/57/86/90/454578690.db2.gz	XHYACYUVYSMVFG-NSHDSACASA-N	0	3	344.296	3.477	20	30		EGEDHN
CC(C)Oc1ccc(C(=O)C(C#N)c2nc3ccccc3n2C)cn1	ZINC000123066870	454598796	/nfs/dbraw/zinc/59/87/96/454598796.db2.gz	WLMUCMSKNUPWBZ-AWEZNQCLSA-N	0	3	334.379	3.246	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN2CCC(OC[C@H]3CCCO3)CC2)cc1	ZINC000092661697	454604765	/nfs/dbraw/zinc/60/47/65/454604765.db2.gz	SKOFNOISIRGTAG-OXJNMPFZSA-N	0	3	344.455	3.137	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)/C=C/c1ccccc1	ZINC000065931228	454641423	/nfs/dbraw/zinc/64/14/23/454641423.db2.gz	FFTCMJMQXFSMAH-VAWYXSNFSA-N	0	3	333.435	3.162	20	30		EGEDHN
Cc1nccn1CCNCc1cccc(OCc2cccc(C#N)c2)c1	ZINC000052119978	454656736	/nfs/dbraw/zinc/65/67/36/454656736.db2.gz	DMGCMXWYUUHDGM-UHFFFAOYSA-N	0	3	346.434	3.432	20	30		EGEDHN
CC(C)Oc1ccc(C#N)cc1NC(=O)N1CC[C@H](N2CCCC2)C1	ZINC000066160850	454662694	/nfs/dbraw/zinc/66/26/94/454662694.db2.gz	ZWQKHTOBUWJFDN-INIZCTEOSA-N	0	3	342.443	3.047	20	30		EGEDHN
CC(C)(NC[C@H](O)COc1ccc(CC#N)cc1)c1cccs1	ZINC000612517149	460646989	/nfs/dbraw/zinc/64/69/89/460646989.db2.gz	ZANYJWAZVGALSI-HNNXBMFYSA-N	0	3	330.453	3.079	20	30		EGEDHN
C=CCCOCC(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000606310182	460647087	/nfs/dbraw/zinc/64/70/87/460647087.db2.gz	KYTRLLQYARRAGD-MJGOQNOKSA-N	0	3	330.472	3.091	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCc2c[nH]c3ccccc23)CC1	ZINC000106039612	454675646	/nfs/dbraw/zinc/67/56/46/454675646.db2.gz	IPKFKZZTGAPGAY-UHFFFAOYSA-N	0	3	325.456	3.257	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCC(OC3CCCC3)CC2)CC1	ZINC000106275516	454689536	/nfs/dbraw/zinc/68/95/36/454689536.db2.gz	AWLHNWGHPAUCLN-UHFFFAOYSA-N	0	3	349.519	3.160	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc(-n3cccn3)cc2)CC1	ZINC000106318919	454690506	/nfs/dbraw/zinc/69/05/06/454690506.db2.gz	KKYUHOUAFDCPKW-UHFFFAOYSA-N	0	3	339.443	3.034	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC2(c3ccccc3)CCC2)CC1	ZINC000106337888	454691047	/nfs/dbraw/zinc/69/10/47/454691047.db2.gz	IUBRZRUDVYRUGT-UHFFFAOYSA-N	0	3	327.472	3.406	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC[C@@H](CC)Oc2cccc(C)c2)CC1	ZINC000176158682	454705389	/nfs/dbraw/zinc/70/53/89/454705389.db2.gz	HSSVNPXALGHFTP-GOSISDBHSA-N	0	3	345.487	3.102	20	30		EGEDHN
C#CCCOc1ccc(CN(C)[C@@H](CO)c2ccc(OC)cc2)cc1	ZINC000093415609	454713240	/nfs/dbraw/zinc/71/32/40/454713240.db2.gz	XDKHQQMZHCZWKZ-NRFANRHFSA-N	0	3	339.435	3.263	20	30		EGEDHN
N#CCCCOc1cccc(CN2CC[C@H](Oc3ccncc3)C2)c1	ZINC000093865888	454741589	/nfs/dbraw/zinc/74/15/89/454741589.db2.gz	WQUHXFHCUWLECG-FQEVSTJZSA-N	0	3	337.423	3.417	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](c2ncc(C)s2)C2CC2)CC1	ZINC000176501231	454752659	/nfs/dbraw/zinc/75/26/59/454752659.db2.gz	RYLRBRVUPZAWIW-INIZCTEOSA-N	0	3	348.516	3.242	20	30		EGEDHN
C[C@H](C#N)CSc1ccccc1NC(=O)NC[C@H]1CCCN(C)C1	ZINC000108528535	454801789	/nfs/dbraw/zinc/80/17/89/454801789.db2.gz	KPJAWWGLSFXISM-HUUCEWRRSA-N	0	3	346.500	3.402	20	30		EGEDHN
C#CCN1CCC(C(=O)NC(c2ccccc2)c2ccccc2)CC1	ZINC000108929236	454816857	/nfs/dbraw/zinc/81/68/57/454816857.db2.gz	HYVYZZFEXGHWHV-UHFFFAOYSA-N	0	3	332.447	3.237	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(OC3CCC3)c(F)c2)CC1	ZINC000177204527	454836894	/nfs/dbraw/zinc/83/68/94/454836894.db2.gz	POHFTTQCTWCVQE-UHFFFAOYSA-N	0	3	330.403	3.041	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(C(F)(F)F)ccc2F)CC1	ZINC000177551440	454876296	/nfs/dbraw/zinc/87/62/96/454876296.db2.gz	IVAVPBBOHATTEU-UHFFFAOYSA-N	0	3	330.325	3.225	20	30		EGEDHN
CCS[C@@H]1CCCCN([C@@H](C)C(=O)N[C@@](C)(C#N)C(C)C)C1	ZINC000112089810	454880273	/nfs/dbraw/zinc/88/02/73/454880273.db2.gz	WYNUZFFMSDBIFF-UXLLHSPISA-N	0	3	325.522	3.037	20	30		EGEDHN
C=CCCC[C@@H](C)N[C@H](C(N)=O)c1cccc(Br)c1	ZINC000182343805	455493522	/nfs/dbraw/zinc/49/35/22/455493522.db2.gz	ZJTHRUOFZRWSRG-RISCZKNCSA-N	0	3	325.250	3.310	20	30		EGEDHN
C=CCCOCCNC(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1	ZINC000127266151	454949687	/nfs/dbraw/zinc/94/96/87/454949687.db2.gz	RVZBYFNJYFUYEL-LJQANCHMSA-N	0	3	345.487	3.024	20	30		EGEDHN
CC(C)CN(C(=O)/C=C/c1cccc(C#N)c1)C1CCN(C)CC1	ZINC000114383280	454952391	/nfs/dbraw/zinc/95/23/91/454952391.db2.gz	BAXFNDUNFASORG-BQYQJAHWSA-N	0	3	325.456	3.150	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCN2CCC[C@H](Nc3ccccc3)C2)cc1	ZINC000155011369	454953524	/nfs/dbraw/zinc/95/35/24/454953524.db2.gz	BABWDDVLDGJDTQ-FQEVSTJZSA-N	0	3	348.450	3.463	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CCN(CC2CCOCC2)CC1	ZINC000178537376	454960394	/nfs/dbraw/zinc/96/03/94/454960394.db2.gz	WEEOATUOQIZXNM-UHFFFAOYSA-N	0	3	341.499	3.032	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)NC1CCN(CC(=C)C)CC1	ZINC000127438567	454964670	/nfs/dbraw/zinc/96/46/70/454964670.db2.gz	YUYQQOMTVGFGML-UHFFFAOYSA-N	0	3	344.455	3.030	20	30		EGEDHN
CN(CC1CCN(C)CC1)C(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000151380709	454977096	/nfs/dbraw/zinc/97/70/96/454977096.db2.gz	YHSAVWCMWGIHPP-SFHVURJKSA-N	0	3	328.460	3.015	20	30		EGEDHN
CCC[C@@H](C(=O)NC1CCC(Oc2ccccc2C#N)CC1)N(C)C	ZINC000155380067	454994375	/nfs/dbraw/zinc/99/43/75/454994375.db2.gz	JWACFFMFRGXAJA-ABHNRTSZSA-N	0	3	343.471	3.095	20	30		EGEDHN
CCC[C@H](C(=O)NC1CCC(Oc2ccccc2C#N)CC1)N(C)C	ZINC000155380157	454994490	/nfs/dbraw/zinc/99/44/90/454994490.db2.gz	JWACFFMFRGXAJA-DAWZGUTISA-N	0	3	343.471	3.095	20	30		EGEDHN
Cc1cc(C(=O)C(C#N)c2nnc3n2CCCCC3)ccc1Cl	ZINC000151755113	455025878	/nfs/dbraw/zinc/02/58/78/455025878.db2.gz	VILDYVAUEJAMMV-CYBMUJFWSA-N	0	3	328.803	3.456	20	30		EGEDHN
C[C@H](NCC(=O)N[C@@](C)(C#N)C1CC1)c1ccc2c(c1)CCCC2	ZINC000128213968	455035493	/nfs/dbraw/zinc/03/54/93/455035493.db2.gz	JYCJCNNXCHTENO-XOBRGWDASA-N	0	3	325.456	3.024	20	30		EGEDHN
N#CCN(C(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)C1CCCC1	ZINC000128237103	455038068	/nfs/dbraw/zinc/03/80/68/455038068.db2.gz	JHMGOYCMCPJPIK-QGZVFWFLSA-N	0	3	343.446	3.332	20	30		EGEDHN
C=C(C)COc1cc(CN2CCC[C@@H](C3OCCO3)C2)ccc1OC	ZINC000179375257	455041387	/nfs/dbraw/zinc/04/13/87/455041387.db2.gz	PFWIGHFVLLIWQM-QGZVFWFLSA-N	0	3	347.455	3.235	20	30		EGEDHN
COc1ccc(O)c(/C=N/CC2CCN(c3ccncc3)CC2)c1	ZINC000179703964	455068658	/nfs/dbraw/zinc/06/86/58/455068658.db2.gz	BFFJRLRLFOQNJL-KGENOOAVSA-N	0	3	325.412	3.131	20	30		EGEDHN
C=CCN1CCC(NC(=O)/C=C/c2ccc(C(F)(F)F)cc2)CC1	ZINC000171726701	455089643	/nfs/dbraw/zinc/08/96/43/455089643.db2.gz	PRWFLHWLWSWCNE-VMPITWQZSA-N	0	3	338.373	3.485	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2C)CC1	ZINC000171725988	455089707	/nfs/dbraw/zinc/08/97/07/455089707.db2.gz	RBPSKMQKKJDYRF-CQSZACIVSA-N	0	3	336.863	3.182	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(-c3cccs3)on2)CC1	ZINC000171729187	455089739	/nfs/dbraw/zinc/08/97/39/455089739.db2.gz	VMCFAFIIZXTHKW-UHFFFAOYSA-N	0	3	331.441	3.173	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cccc(COC(C)C)c2)CC1	ZINC000171741077	455091113	/nfs/dbraw/zinc/09/11/13/455091113.db2.gz	UNGXRJHATHVMRE-UHFFFAOYSA-N	0	3	331.460	3.384	20	30		EGEDHN
N#Cc1ccc(CN2CCC(Nc3cccc4c3OCCO4)CC2)cc1	ZINC000180003635	455114713	/nfs/dbraw/zinc/11/47/13/455114713.db2.gz	IAEBSGPSEDFQJO-UHFFFAOYSA-N	0	3	349.434	3.406	20	30		EGEDHN
C[C@@H](C#N)Oc1ccccc1NC(=O)NC[C@H](C)N1CCC[C@@H](C)C1	ZINC000180042929	455121167	/nfs/dbraw/zinc/12/11/67/455121167.db2.gz	WKHDEQTXJXORTJ-PMPSAXMXSA-N	0	3	344.459	3.219	20	30		EGEDHN
C=CCNC(=O)[C@@H](C)N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1	ZINC000180058197	455124686	/nfs/dbraw/zinc/12/46/86/455124686.db2.gz	YRWCJGKVWQWKDZ-IAQYHMDHSA-N	0	3	326.362	3.437	20	30		EGEDHN
CC(C)(O)[C@H]1CCCN1CC#Cc1ccc(OC(F)(F)F)cc1	ZINC000119136381	455128069	/nfs/dbraw/zinc/12/80/69/455128069.db2.gz	CRWBVMGIFXSMRO-OAHLLOKOSA-N	0	3	327.346	3.172	20	30		EGEDHN
CO[C@@H](CNCc1cn(C)nc1-c1ccc(C#N)cc1)C(C)(C)C	ZINC000180270853	455153829	/nfs/dbraw/zinc/15/38/29/455153829.db2.gz	AOFPBPDRXFIRIB-KRWDZBQOSA-N	0	3	326.444	3.109	20	30		EGEDHN
N#CC(C(=O)NCc1ccccc1)c1nc2ccccc2n1C(F)F	ZINC000180512238	455187156	/nfs/dbraw/zinc/18/71/56/455187156.db2.gz	OIOHSNLFVXWGHG-CYBMUJFWSA-N	0	3	340.333	3.355	20	30		EGEDHN
C[C@H](NCCNC(=O)C1N=CC=CC1=O)c1ccc(C(C)(C)C)cc1	ZINC000173415172	455280216	/nfs/dbraw/zinc/28/02/16/455280216.db2.gz	WESOIRNLFAAZEZ-JGWKNBOWSA-N	0	3	341.455	3.161	20	30		EGEDHN
Cc1ccc(C#N)c(N(C)CCC2CCN(c3ccncc3)CC2)n1	ZINC000181261800	455309226	/nfs/dbraw/zinc/30/92/26/455309226.db2.gz	QDVRONDEUBPZQY-UHFFFAOYSA-N	0	3	335.455	3.400	20	30		EGEDHN
N#CCSCCCN1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1	ZINC000173902498	455340137	/nfs/dbraw/zinc/34/01/37/455340137.db2.gz	ZNSGUCBYWBWYAW-UHFFFAOYSA-N	0	3	335.429	3.085	20	30		EGEDHN
CN(CCC#N)C(=O)CCN[C@H](c1ccccc1F)C1CCCC1	ZINC000181499975	455345508	/nfs/dbraw/zinc/34/55/08/455345508.db2.gz	VZRNVOBNFOUQRB-IBGZPJMESA-N	0	3	331.435	3.409	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN[C@@H](C)c1cccc(O)c1	ZINC000181512325	455346665	/nfs/dbraw/zinc/34/66/65/455346665.db2.gz	ZYPPJIXMNPTSGR-KXBFYZLASA-N	0	3	327.424	3.211	20	30		EGEDHN
C[C@H](CSC(C)(C)C)N[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000190621998	455355466	/nfs/dbraw/zinc/35/54/66/455355466.db2.gz	ZJULDWUEYXZSQM-PBHICJAKSA-N	0	3	345.512	3.169	20	30		EGEDHN
COc1ccc(C#N)cc1NC(=O)N1CCCN(C2CCCC2)CC1	ZINC000265699661	455364455	/nfs/dbraw/zinc/36/44/55/455364455.db2.gz	JXCNHAUUZQGZNU-UHFFFAOYSA-N	0	3	342.443	3.049	20	30		EGEDHN
CN(CCC#N)C(=O)CCN[C@H](c1ccc(F)cc1F)C(C)(C)C	ZINC000181629509	455365204	/nfs/dbraw/zinc/36/52/04/455365204.db2.gz	GFPSYDOEZWNDCQ-QGZVFWFLSA-N	0	3	337.414	3.404	20	30		EGEDHN
C[C@H](CNC(=O)Nc1ccccc1O[C@@H](C)C#N)N1CCC(C)CC1	ZINC000184356547	455372960	/nfs/dbraw/zinc/37/29/60/455372960.db2.gz	LPYFXVJBZKFORK-CVEARBPZSA-N	0	3	344.459	3.219	20	30		EGEDHN
Cn1cc(CNCc2ccc(COCC(F)(F)F)cc2)cc1C#N	ZINC000190739794	455376299	/nfs/dbraw/zinc/37/62/99/455376299.db2.gz	MGJMOHVXTRFHMC-UHFFFAOYSA-N	0	3	337.345	3.265	20	30		EGEDHN
Cn1cc(CNC[C@@H](c2cccc(Cl)c2)N2CCCC2)cc1C#N	ZINC000190756420	455378779	/nfs/dbraw/zinc/37/87/79/455378779.db2.gz	JHKHOSYGZDKNPK-IBGZPJMESA-N	0	3	342.874	3.477	20	30		EGEDHN
CC(C)(C#N)CCCN1CCCN(C(=O)c2ccc(F)cc2)CC1	ZINC000174816667	455415523	/nfs/dbraw/zinc/41/55/23/455415523.db2.gz	UKCQWIURVFZNRQ-UHFFFAOYSA-N	0	3	331.435	3.304	20	30		EGEDHN
CC(C)(C#N)CCCN1CCc2c(cccc2N2CCOC2=O)C1	ZINC000174878362	455417357	/nfs/dbraw/zinc/41/73/57/455417357.db2.gz	BXNOGMBVJNWUFD-UHFFFAOYSA-N	0	3	327.428	3.331	20	30		EGEDHN
C=C(C)[C@@H](NC(=O)NC[C@H](C)N(C)C1CC1)c1ccc(F)c(F)c1	ZINC000184705939	455432386	/nfs/dbraw/zinc/43/23/86/455432386.db2.gz	DDZRZPUCWTVDLY-YVEFUNNKSA-N	0	3	337.414	3.364	20	30		EGEDHN
C=CCN(Cc1ccccc1F)C(=O)N[C@H]1C[C@H](C)N(C2CC2)C1	ZINC000175612273	455471468	/nfs/dbraw/zinc/47/14/68/455471468.db2.gz	VEYPTFKGCZGIEA-HOCLYGCPSA-N	0	3	331.435	3.149	20	30		EGEDHN
CC#CCCCC(=O)NC[C@H](c1ccc(OC)cc1)N1CCCC1	ZINC000184971569	455479135	/nfs/dbraw/zinc/47/91/35/455479135.db2.gz	XCAWQVRYRFHQTL-LJQANCHMSA-N	0	3	328.456	3.142	20	30		EGEDHN
C=CCC[C@H](C)NCc1ccccc1S(=O)(=O)N1CCCCC1	ZINC000184966163	455479153	/nfs/dbraw/zinc/47/91/53/455479153.db2.gz	CTCDDSKUWCZDQO-INIZCTEOSA-N	0	3	336.501	3.306	20	30		EGEDHN
CC[C@H](NCCOc1ccc(C#N)cc1OC)c1c(C)noc1C	ZINC000182420666	455509680	/nfs/dbraw/zinc/50/96/80/455509680.db2.gz	CTYMTUAANHNYAO-HNNXBMFYSA-N	0	3	329.400	3.291	20	30		EGEDHN
C=Cc1ccc(C(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)cc1	ZINC000185255413	455529931	/nfs/dbraw/zinc/52/99/31/455529931.db2.gz	HMCPPMKWPNWPML-UHFFFAOYSA-N	0	3	333.435	3.405	20	30		EGEDHN
C#CCC(C)(C)C(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000185317572	455538726	/nfs/dbraw/zinc/53/87/26/455538726.db2.gz	HRJHYAHAEDALGB-UHFFFAOYSA-N	0	3	342.483	3.073	20	30		EGEDHN
C[C@@H]1CN(CCC2CCN(CC#Cc3ccccc3)CC2)C[C@H](C)O1	ZINC000192061163	455551596	/nfs/dbraw/zinc/55/15/96/455551596.db2.gz	LVWBLERJXYIZHD-BGYRXZFFSA-N	0	3	340.511	3.249	20	30		EGEDHN
C#CCC(C)(C)C(=O)N1CCCN(CCCc2ccccc2)CC1	ZINC000185402251	455554844	/nfs/dbraw/zinc/55/48/44/455554844.db2.gz	DEEBAYIMQGPLEW-UHFFFAOYSA-N	0	3	326.484	3.203	20	30		EGEDHN
N#Cc1cccc(OCCN[C@@H]2CCO[C@@H]2c2ccc(F)c(F)c2)c1	ZINC000192138690	455562954	/nfs/dbraw/zinc/56/29/54/455562954.db2.gz	UWENXAAKNGUWCA-RTBURBONSA-N	0	3	344.361	3.335	20	30		EGEDHN
C[C@@H](NCCOc1cccc(C#N)c1)[C@H]1OCCc2sccc21	ZINC000292479239	455675038	/nfs/dbraw/zinc/67/50/38/455675038.db2.gz	RZSJEYRQYVEKSU-FZKQIMNGSA-N	0	3	328.437	3.291	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN2CCC[C@@H](Cc3nccn3C)C2)cc1	ZINC000248905530	455738484	/nfs/dbraw/zinc/73/84/84/455738484.db2.gz	YHKQNHCUNXMEMP-AEFFLSMTSA-N	0	3	338.455	3.166	20	30		EGEDHN
C=CCCCCCN1CCN(Cc2nc(N)c3ccccc3n2)CC1	ZINC000193413190	455757985	/nfs/dbraw/zinc/75/79/85/455757985.db2.gz	NAVRJYJEBIGQLG-UHFFFAOYSA-N	0	3	339.487	3.076	20	30		EGEDHN
CC1(C)CC[C@@H](CN2CCCN(Cc3ccc(C#N)cc3)CC2)O1	ZINC000186444892	455769773	/nfs/dbraw/zinc/76/97/73/455769773.db2.gz	UKEWFSCWMNEFQA-IBGZPJMESA-N	0	3	327.472	3.024	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCC[C@@]2(CCC)COC)CC1	ZINC000193749930	455774010	/nfs/dbraw/zinc/77/40/10/455774010.db2.gz	XUXGVJBDCMHOAX-IBGZPJMESA-N	0	3	337.508	3.018	20	30		EGEDHN
CO/N=C/c1ccc(C(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)cc1	ZINC000186486326	455779398	/nfs/dbraw/zinc/77/93/98/455779398.db2.gz	HUQHYAUXSSXACS-LAGKDRCJSA-N	0	3	339.439	3.088	20	30		EGEDHN
Cc1nc(C(=O)NC[C@@]2(C)CCCN2Cc2ccccc2)ccc1C#N	ZINC000186571120	455795373	/nfs/dbraw/zinc/79/53/73/455795373.db2.gz	SRGADFLCESOITR-OAQYLSRUSA-N	0	3	348.450	3.046	20	30		EGEDHN
Cc1ccc(NC(=O)c2cc(C#N)cc(N(C)C)c2)c(CN(C)C)c1	ZINC000294020961	455802801	/nfs/dbraw/zinc/80/28/01/455802801.db2.gz	DWPBOIPMOZVWKA-UHFFFAOYSA-N	0	3	336.439	3.247	20	30		EGEDHN
CC[C@H](C)[C@@H](CNCc1cn(CCC#N)nc1-c1ccncc1)OC	ZINC000294744881	455826717	/nfs/dbraw/zinc/82/67/17/455826717.db2.gz	HQFBQEHLAXGDND-MAUKXSAKSA-N	0	3	341.459	3.009	20	30		EGEDHN
COc1cccc(N2CC[C@@H](NCc3ccc(C#N)cc3F)C2)c1	ZINC000269456836	455848287	/nfs/dbraw/zinc/84/82/87/455848287.db2.gz	XCPVXNTXWKGDFV-MRXNPFEDSA-N	0	3	325.387	3.074	20	30		EGEDHN
CN(C(=O)[C@H]1CCCN(Cc2ccccc2)C1)c1ccccc1C#N	ZINC000269859176	455854108	/nfs/dbraw/zinc/85/41/08/455854108.db2.gz	RBIANUXENYLAOQ-IBGZPJMESA-N	0	3	333.435	3.433	20	30		EGEDHN
CCc1cc[n+](C(C(=O)c2c(C)noc2C)C(=S)[N-]C(C)C)cc1	ZINC000186960181	455855754	/nfs/dbraw/zinc/85/57/54/455855754.db2.gz	VMRPQBNDFNDUQD-UHFFFAOYSA-O	0	3	346.476	3.078	20	30		EGEDHN
C[C@@H](CCc1ccccc1)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000279504472	455867041	/nfs/dbraw/zinc/86/70/41/455867041.db2.gz	QTKZUUNZNAWMIJ-OXJNMPFZSA-N	0	3	331.419	3.378	20	30		EGEDHN
CCC[C@@]1(NCc2ccc(OC)c(OCCCC#N)c2)CCOC1	ZINC000285569868	455871931	/nfs/dbraw/zinc/87/19/31/455871931.db2.gz	SHPOQBMGPYHPLD-LJQANCHMSA-N	0	3	332.444	3.427	20	30		EGEDHN
C[C@@H](N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O)c1ccc(C#N)cc1	ZINC000272190954	455872494	/nfs/dbraw/zinc/87/24/94/455872494.db2.gz	KHLNIOMSUZXYJE-QRWLVFNGSA-N	0	3	344.418	3.276	20	30		EGEDHN
CCCNc1ccc(C#N)cc1NC(=O)C1CCN(C2CC2)CC1	ZINC000194686840	455873290	/nfs/dbraw/zinc/87/32/90/455873290.db2.gz	OFGTUQOFHLMRAR-UHFFFAOYSA-N	0	3	326.444	3.193	20	30		EGEDHN
CC(C)Oc1ccc(CNC(=O)C(C#N)Cc2ccc(C#N)cc2)cc1	ZINC000279837524	455874939	/nfs/dbraw/zinc/87/49/39/455874939.db2.gz	ZMTBOBQZEILUHV-LJQANCHMSA-N	0	3	347.418	3.344	20	30		EGEDHN
C[C@@H](NC(=O)CCc1ccc(C#N)cc1)[C@H](c1ccccc1)N(C)C	ZINC000187264427	455889301	/nfs/dbraw/zinc/88/93/01/455889301.db2.gz	VOKPFBDEOUVBOB-IIBYNOLFSA-N	0	3	335.451	3.298	20	30		EGEDHN
C#CCOc1ccc([C@H](C)N2CCC[C@H](CC(C)(C)C(N)=O)C2)cc1	ZINC000296473771	455948988	/nfs/dbraw/zinc/94/89/88/455948988.db2.gz	NWTQJFIZVUDHPL-DLBZAZTESA-N	0	3	342.483	3.373	20	30		EGEDHN
CC(C)Oc1ccc(C#N)cc1NC(=O)C1CCN(C2CC2)CC1	ZINC000195376016	455953306	/nfs/dbraw/zinc/95/33/06/455953306.db2.gz	MGXGZFVJWVOGKV-UHFFFAOYSA-N	0	3	327.428	3.158	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@H](NCc1ccc(C#N)o1)C1CCCC1	ZINC000195458212	455964156	/nfs/dbraw/zinc/96/41/56/455964156.db2.gz	VXAVVIXYXQNKBR-MRXNPFEDSA-N	0	3	333.432	3.324	20	30		EGEDHN
N#Cc1c(F)cccc1C(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000188018687	455980954	/nfs/dbraw/zinc/98/09/54/455980954.db2.gz	QSUXKENCEKIYLN-INIZCTEOSA-N	0	3	337.398	3.092	20	30		EGEDHN
CCOc1ccc(CN(CCCC#N)CCCn2ccnc2)cc1	ZINC000272578347	456000290	/nfs/dbraw/zinc/00/02/90/456000290.db2.gz	DNUWYDDNNRBTGK-UHFFFAOYSA-N	0	3	326.444	3.478	20	30		EGEDHN
C=CCN(CCc1ccco1)Cc1ccccc1N1CCOCC1	ZINC000272679356	456037980	/nfs/dbraw/zinc/03/79/80/456037980.db2.gz	VETJKJGFLHIIME-UHFFFAOYSA-N	0	3	326.440	3.347	20	30		EGEDHN
C[C@@H](C#N)Oc1ccccc1NC(=O)N1CC[C@@H](N2CCCCC2)C1	ZINC000272703310	456045663	/nfs/dbraw/zinc/04/56/63/456045663.db2.gz	VDPAVYOPTPSENF-JKSUJKDBSA-N	0	3	342.443	3.070	20	30		EGEDHN
CC[C@](C)(C#N)C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000286507670	456048794	/nfs/dbraw/zinc/04/87/94/456048794.db2.gz	QBTPDARSFKKBDZ-YVWKXTFCSA-N	0	3	327.472	3.438	20	30		EGEDHN
CC(C)Oc1ccc([C@H](CNCc2ccc(C#N)o2)N(C)C)cc1	ZINC000288510851	456098625	/nfs/dbraw/zinc/09/86/25/456098625.db2.gz	SYYGJJOFNXZZQI-IBGZPJMESA-N	0	3	327.428	3.331	20	30		EGEDHN
Cc1ccc2c(c1)[C@H]1CN(C)CC[C@H]1N2C(=O)Cc1ccc(C#N)cc1	ZINC000281006641	456108376	/nfs/dbraw/zinc/10/83/76/456108376.db2.gz	KVPGCHFHMLLZOI-TZIWHRDSSA-N	0	3	345.446	3.244	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCc3cc(Cl)ccc3C2)CC1	ZINC000188692389	456115386	/nfs/dbraw/zinc/11/53/86/456115386.db2.gz	AKURAWISDOFRKB-UHFFFAOYSA-N	0	3	333.863	3.058	20	30		EGEDHN
COc1cc(CN(CCN(C)C)Cc2ccc(C)o2)ccc1C#N	ZINC000289444580	456126325	/nfs/dbraw/zinc/12/63/25/456126325.db2.gz	MIMKPWYZFFBWTE-UHFFFAOYSA-N	0	3	327.428	3.032	20	30		EGEDHN
CCCCO[C@@H]1C[C@@H](NCC(=O)Nc2sccc2C#N)C1(C)C	ZINC000289470873	456127300	/nfs/dbraw/zinc/12/73/00/456127300.db2.gz	ZAMASPXDZPAMJI-ZIAGYGMSSA-N	0	3	335.473	3.132	20	30		EGEDHN
CC(C)(C)OC(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)CC[C@@H]2C1	ZINC000289509193	456128779	/nfs/dbraw/zinc/12/87/79/456128779.db2.gz	KQPDSCRWXILZIH-QZTJIDSGSA-N	0	3	341.455	3.247	20	30		EGEDHN
COc1cc(CN(C)CCc2nc(-c3ccccc3)no2)ccc1C#N	ZINC000289583495	456131625	/nfs/dbraw/zinc/13/16/25/456131625.db2.gz	KALYMTYHJZXJOL-UHFFFAOYSA-N	0	3	348.406	3.291	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000289967484	456199163	/nfs/dbraw/zinc/19/91/63/456199163.db2.gz	VUARLZSWXKXBAN-UHFFFAOYSA-N	0	3	346.474	3.300	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1CNC(=O)c1ccc(CN2CCCCC2)cc1	ZINC000281447400	456238137	/nfs/dbraw/zinc/23/81/37/456238137.db2.gz	OJWASKJFLJGSGU-UXHICEINSA-N	0	3	342.483	3.384	20	30		EGEDHN
C=CCOc1c(Br)cc(CNCCSC)cc1OC	ZINC000237146363	456239471	/nfs/dbraw/zinc/23/94/71/456239471.db2.gz	ZCIPSHNEXOPICU-UHFFFAOYSA-N	0	3	346.290	3.475	20	30		EGEDHN
CC1CCN([C@H](CNc2ccc(C#N)nn2)c2cccs2)CC1	ZINC000301919395	456250447	/nfs/dbraw/zinc/25/04/47/456250447.db2.gz	KCWRTJSQZNYQAX-OAHLLOKOSA-N	0	3	327.457	3.295	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)c1csc(Cl)c1	ZINC000189194439	456250947	/nfs/dbraw/zinc/25/09/47/456250947.db2.gz	LUAWSBKUIFGLKN-UHFFFAOYSA-N	0	3	347.871	3.477	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(CC#N)cc1	ZINC000274190717	456252443	/nfs/dbraw/zinc/25/24/43/456252443.db2.gz	MDDUVJXIRITEDN-OXQOHEQNSA-N	0	3	333.435	3.003	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(CC#N)cc1	ZINC000274190715	456252836	/nfs/dbraw/zinc/25/28/36/456252836.db2.gz	MDDUVJXIRITEDN-JXFKEZNVSA-N	0	3	333.435	3.003	20	30		EGEDHN
CCc1ccc([C@@H](CNc2nc3ccccn3c2C#N)N(C)C)cc1	ZINC000302057034	456277207	/nfs/dbraw/zinc/27/72/07/456277207.db2.gz	AMOAGHSNVNYZLE-GOSISDBHSA-N	0	3	333.439	3.483	20	30		EGEDHN
COc1cccc([C@H](CNc2cc(C#N)ccc2[N+](=O)[O-])N(C)C)c1	ZINC000302146574	456298857	/nfs/dbraw/zinc/29/88/57/456298857.db2.gz	JQASZDQPKGNABG-SFHVURJKSA-N	0	3	340.383	3.190	20	30		EGEDHN
N#Cc1cc(N2CCN(CC3CCCCC3)CC2)ccc1[N+](=O)[O-]	ZINC000302149664	456300834	/nfs/dbraw/zinc/30/08/34/456300834.db2.gz	AXKIAQNWMXHDLF-UHFFFAOYSA-N	0	3	328.416	3.169	20	30		EGEDHN
COc1cc(CN[C@@H]2CCO[C@@H]2c2ccc(F)c(F)c2)ccc1C#N	ZINC000281797176	456322789	/nfs/dbraw/zinc/32/27/89/456322789.db2.gz	VAKYVFMOXMISIL-IEBWSBKVSA-N	0	3	344.361	3.465	20	30		EGEDHN
CC(C)(C)OC(=O)C1CCN(CCCC2(C#N)CCOCC2)CC1	ZINC000337127111	456329147	/nfs/dbraw/zinc/32/91/47/456329147.db2.gz	GJTQVBGBUOGCSG-UHFFFAOYSA-N	0	3	336.476	3.141	20	30		EGEDHN
C=CCN1CC[C@@H](N(Cc2ccc3c(c2)CCO3)C2CCCC2)C1=O	ZINC000337144102	456330263	/nfs/dbraw/zinc/33/02/63/456330263.db2.gz	WGGGDASFAVRIGL-LJQANCHMSA-N	0	3	340.467	3.153	20	30		EGEDHN
CC[C@@](C)(C#N)C(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000290493735	456342867	/nfs/dbraw/zinc/34/28/67/456342867.db2.gz	MOQMLKHCHFKULE-HKUYNNGSSA-N	0	3	331.460	3.133	20	30		EGEDHN
C=CCOCCCN[C@H]1CCOc2c(Br)cccc21	ZINC000337375715	456349118	/nfs/dbraw/zinc/34/91/18/456349118.db2.gz	RKHUPSAUHKSNHC-AWEZNQCLSA-N	0	3	326.234	3.455	20	30		EGEDHN
CN(C[C@H]1CCN(C)[C@H]1c1cccnc1)c1nccc(C#N)c1Cl	ZINC000343011339	456356162	/nfs/dbraw/zinc/35/61/62/456356162.db2.gz	DYGBBEHZZYZJQE-WBVHZDCISA-N	0	3	341.846	3.131	20	30		EGEDHN
N#Cc1ccccc1COc1cccc(CN[C@@H]2C=C[C@@H](CO)C2)c1	ZINC000347777882	456362632	/nfs/dbraw/zinc/36/26/32/456362632.db2.gz	MTGMAWWBVIUHID-YLJYHZDGSA-N	0	3	334.419	3.164	20	30		EGEDHN
N#Cc1cccc(COc2cccc(CN[C@H]3C=C[C@H](CO)C3)c2)c1	ZINC000347781214	456364645	/nfs/dbraw/zinc/36/46/45/456364645.db2.gz	UHZOIVPUBOBOSK-ICSRJNTNSA-N	0	3	334.419	3.164	20	30		EGEDHN
C[C@H](NCCOCC(F)(F)C(F)F)c1ccc(OCC#N)cc1	ZINC000276152213	456401124	/nfs/dbraw/zinc/40/11/24/456401124.db2.gz	CDTLUFNNGIWAHT-NSHDSACASA-N	0	3	334.313	3.157	20	30		EGEDHN
C=CCOCCCN1C[C@H](O)C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000348047307	456444023	/nfs/dbraw/zinc/44/40/23/456444023.db2.gz	JWFOVHZVKWXAAN-CVEARBPZSA-N	0	3	329.362	3.406	20	30		EGEDHN
CCC[C@@H](C)C(=O)NCCN[C@@H]1CCCCc2cc(C#N)ccc21	ZINC000340420915	456450270	/nfs/dbraw/zinc/45/02/70/456450270.db2.gz	SAGJCIMICMGWIT-DNVCBOLYSA-N	0	3	327.472	3.468	20	30		EGEDHN
CC(C)(C)CCN1CCN(C(=O)Nc2ccc(F)c(C#N)c2)CC1	ZINC000343172702	456451103	/nfs/dbraw/zinc/45/11/03/456451103.db2.gz	VJIANIWXKKOYMQ-UHFFFAOYSA-N	0	3	332.423	3.283	20	30		EGEDHN
CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(CC2(C#N)CC2)[C@@H]2CCCC[C@@H]12	ZINC000343328157	456534310	/nfs/dbraw/zinc/53/43/10/456534310.db2.gz	XEVPPCNSHQTWKZ-NNPSNHGLSA-N	0	3	331.504	3.474	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H]2CC(=O)N3CCCC[C@H]23)cc1Cl	ZINC000337847759	456569972	/nfs/dbraw/zinc/56/99/72/456569972.db2.gz	IISLVBWISSZNMI-HZPDHXFCSA-N	0	3	334.847	3.148	20	30		EGEDHN
COCC[C@@H](N[C@H](C)C(=O)N(CCC#N)c1ccccc1)C(C)(C)C	ZINC000337857512	456572424	/nfs/dbraw/zinc/57/24/24/456572424.db2.gz	LZDWYQPYATYMEW-SJLPKXTDSA-N	0	3	345.487	3.363	20	30		EGEDHN
C=CCn1c(CC2CC2)nnc1N1CCN(C2CCC(C)CC2)CC1	ZINC000337900170	456591458	/nfs/dbraw/zinc/59/14/58/456591458.db2.gz	IFCZXYQFSGXCDO-UHFFFAOYSA-N	0	3	343.519	3.117	20	30		EGEDHN
C=CCCN(C)Cc1ccc(OCCN2CCOCC2)c(Cl)c1	ZINC000343449330	456629290	/nfs/dbraw/zinc/62/92/90/456629290.db2.gz	WCDFOAFWLQUITD-UHFFFAOYSA-N	0	3	338.879	3.059	20	30		EGEDHN
CO[C@@H]1CCCC[C@@H]1NCC(=O)N(CCC#N)c1ccc(C)c(C)c1	ZINC000276957125	456632155	/nfs/dbraw/zinc/63/21/55/456632155.db2.gz	LTFKLGIPRDHMHU-RBUKOAKNSA-N	0	3	343.471	3.097	20	30		EGEDHN
CS[C@@H]1CN(c2c(C#N)cnc3c(C)cc(F)cc32)C[C@@H]1N(C)C	ZINC000340753531	456667334	/nfs/dbraw/zinc/66/73/34/456667334.db2.gz	LKEMNYMULRGRFC-JKSUJKDBSA-N	0	3	344.459	3.036	20	30		EGEDHN
C=C(C)COc1cccc(NC(=O)N2C[C@@H](SC)[C@H](N(C)C)C2)c1	ZINC000353409998	456683105	/nfs/dbraw/zinc/68/31/05/456683105.db2.gz	WWXUMVKWPXSRFG-IAGOWNOFSA-N	0	3	349.500	3.151	20	30		EGEDHN
CN1CC[C@]2(CCN(c3nc4c(c(C#N)c3C#N)CCCCCC4)C2)C1	ZINC000291621702	456697948	/nfs/dbraw/zinc/69/79/48/456697948.db2.gz	AVSOEDUDXBLCJJ-NRFANRHFSA-N	0	3	349.482	3.016	20	30		EGEDHN
N#CCc1ccc(CN2CCC(C(=O)Nc3ccccc3O)CC2)cc1	ZINC000343568825	456713207	/nfs/dbraw/zinc/71/32/07/456713207.db2.gz	IAGSFIBPIOKMNK-UHFFFAOYSA-N	0	3	349.434	3.309	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)[C@@H](C)c1cccc(-n2cnnn2)c1	ZINC000353502488	456720004	/nfs/dbraw/zinc/72/00/04/456720004.db2.gz	LQGVAWOXQXDJKL-INIZCTEOSA-N	0	3	349.438	3.420	20	30		EGEDHN
CC[C@@H](N[C@H]1CCN(c2ccc(C#N)cc2)C1=O)c1ccc(OC)cc1	ZINC000299555426	456727307	/nfs/dbraw/zinc/72/73/07/456727307.db2.gz	GIPFHZYLKSUPLZ-UXHICEINSA-N	0	3	349.434	3.413	20	30		EGEDHN
C[C@H](CC#N)Sc1ccccc1NC(=O)NC[C@H]1CCCN1C	ZINC000343653736	456763117	/nfs/dbraw/zinc/76/31/17/456763117.db2.gz	SRNGFLNATXQIRR-ZIAGYGMSSA-N	0	3	332.473	3.297	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)Nc1ccc(CN2CCN(CC)CC2)cc1	ZINC000343669076	456766059	/nfs/dbraw/zinc/76/60/59/456766059.db2.gz	BPIVUBXGRATPBN-HXUWFJFHSA-N	0	3	329.488	3.365	20	30		EGEDHN
C=CCOCCCN1C[C@H](O)C[C@@H]1c1ccccc1C(F)(F)F	ZINC000343690392	456767272	/nfs/dbraw/zinc/76/72/72/456767272.db2.gz	QSOVEWHKPIHNQH-CZUORRHYSA-N	0	3	329.362	3.406	20	30		EGEDHN
CC(C#N)C(=O)N1C[C@@H](C)O[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000343963920	456786048	/nfs/dbraw/zinc/78/60/48/456786048.db2.gz	GMQSARKXYRZICJ-WDMOLILDSA-N	0	3	326.318	3.153	20	30		EGEDHN
C[C@H]1CC=CC[C@@H]1C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000340970538	456790235	/nfs/dbraw/zinc/79/02/35/456790235.db2.gz	IOMVXUXDRILRNQ-LPHOPBHVSA-N	0	3	325.456	3.051	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)NC[C@H](C)N2CCCC[C@@H]2C)cc1	ZINC000344098293	456796351	/nfs/dbraw/zinc/79/63/51/456796351.db2.gz	JCOCNWXSMLNIMA-IRXDYDNUSA-N	0	3	345.487	3.314	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)[C@H]2CCn3cncc3C2)CN1Cc1ccccc1	ZINC000328985816	456807204	/nfs/dbraw/zinc/80/72/04/456807204.db2.gz	ZUODTNDVRCZSSM-NJAFHUGGSA-N	0	3	338.455	3.065	20	30		EGEDHN
C=CC[C@H](CO)CNCc1c(C)nn(Cc2ccccc2Cl)c1C	ZINC000341258110	456826600	/nfs/dbraw/zinc/82/66/00/456826600.db2.gz	KWWBVHRLLABERG-INIZCTEOSA-N	0	3	347.890	3.476	20	30		EGEDHN
CC[C@@](C)(C#N)C(=O)N1CC[C@@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000353647090	456828633	/nfs/dbraw/zinc/82/86/33/456828633.db2.gz	GDJBMGGQSUFAAJ-SFTDATJTSA-N	0	3	339.483	3.441	20	30		EGEDHN
CCn1ccnc1[C@@H]1OCC[C@H]1C(=O)NCCN1CCCC(C)(C)C1	ZINC000329112118	456837455	/nfs/dbraw/zinc/83/74/55/456837455.db2.gz	GZVGEKRYAANWOG-HZPDHXFCSA-N	0	3	348.491	3.059	20	30		EGEDHN
C[C@@H](C(=O)N1CC=C(c2ccc(C#N)cc2)CC1)N1CCCCCC1	ZINC000348750243	456841018	/nfs/dbraw/zinc/84/10/18/456841018.db2.gz	OVBIZKPCZYLASD-KRWDZBQOSA-N	0	3	337.467	3.438	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)NCC#Cc2ccccc2)CN1Cc1ccccc1	ZINC000341318477	456844939	/nfs/dbraw/zinc/84/49/39/456844939.db2.gz	FWZRXDJLQALJMA-RXVVDRJESA-N	0	3	347.462	3.000	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@@H]2N(C)CCCC2(C)C)cc1OC	ZINC000344695864	456848899	/nfs/dbraw/zinc/84/88/99/456848899.db2.gz	GWZGJOIXVSOUAR-SFHVURJKSA-N	0	3	346.471	3.110	20	30		EGEDHN
COc1ccc(C)cc1NC(=O)[C@H]1CCCN1C[C@H]1CCCOC1	ZINC000329174115	456849156	/nfs/dbraw/zinc/84/91/56/456849156.db2.gz	AWRZSHXSIIINPZ-NVXWUHKLSA-N	0	3	332.444	3.483	20	30		EGEDHN
CN(C)Cc1ccc(CNC(=O)C[C@H](CC#N)c2ccccc2)cc1	ZINC000353688335	456855335	/nfs/dbraw/zinc/85/53/35/456855335.db2.gz	XCZPHQCGSLTUCS-FQEVSTJZSA-N	0	3	335.451	3.452	20	30		EGEDHN
CCn1cc(Br)cc1C(=O)C(C#N)c1cc(C)nc(C)n1	ZINC000339018187	456902754	/nfs/dbraw/zinc/90/27/54/456902754.db2.gz	WCQQCALAALMDTG-GFCCVEGCSA-N	0	3	347.216	3.167	20	30		EGEDHN
COCCN1CC[C@H](NC(=O)[C@@H]2CCCO[C@H]2c2ccc(C)cc2)C1	ZINC000329686773	456927197	/nfs/dbraw/zinc/92/71/97/456927197.db2.gz	BETQEEMYBMNGCD-OTWHNJEPSA-N	0	3	346.471	3.140	20	30		EGEDHN
C=CCC[C@H](C)[NH2+]Cc1cccc(-c2n[n-]c(C(=O)OCC)n2)c1	ZINC000349274507	456929095	/nfs/dbraw/zinc/92/90/95/456929095.db2.gz	FXRKDWYUCLJNRT-ZDUSSCGKSA-N	0	3	328.416	3.093	20	30		EGEDHN
O=C(NCc1cccc2cc[nH]c21)N1CC[C@H](N2CCCCC2)C1	ZINC000329799471	456942414	/nfs/dbraw/zinc/94/24/14/456942414.db2.gz	HNKCLCAKXDULFY-KRWDZBQOSA-N	0	3	326.444	3.142	20	30		EGEDHN
CC1(C)CCCN(CCNC(=O)c2cc(-c3cccnc3)on2)C1	ZINC000329906830	456959589	/nfs/dbraw/zinc/95/95/89/456959589.db2.gz	KJVRWQWVNNKIGM-UHFFFAOYSA-N	0	3	328.416	3.163	20	30		EGEDHN
C[C@H]1CCN(Cc2cccc(OCc3cccc(C#N)c3)c2)C[C@@H]1O	ZINC000349420757	456966430	/nfs/dbraw/zinc/96/64/30/456966430.db2.gz	RNPMEFBRMJCCHG-KKSFZXQISA-N	0	3	336.435	3.340	20	30		EGEDHN
CC(C)[C@@H]1CCC[C@H](NC(=O)C(C)S(=O)(=O)C2CCOCC2)C1	ZINC000330037000	456977716	/nfs/dbraw/zinc/97/77/16/456977716.db2.gz	CXPSLENZMKNXAV-ZNMIVQPWSA-N	0	3	345.505	3.140	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1CCCN(CC2CCC2)CC1	ZINC000339203258	456990216	/nfs/dbraw/zinc/99/02/16/456990216.db2.gz	LOIHNHVMJKTPGN-UHFFFAOYSA-N	0	3	328.456	3.199	20	30		EGEDHN
CN(C)[C@@H]1CCCN(C(=O)c2cn(CCCC#N)c3ccccc23)C1	ZINC000345816533	457000289	/nfs/dbraw/zinc/00/02/89/457000289.db2.gz	NCIITOLDGKUDCB-MRXNPFEDSA-N	0	3	338.455	3.111	20	30		EGEDHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)C[C@H](CC#N)c2ccccc2)C1	ZINC000356464979	457002220	/nfs/dbraw/zinc/00/22/20/457002220.db2.gz	UZDRPRLLBHQCEV-GBESFXJTSA-N	0	3	325.456	3.017	20	30		EGEDHN
[O-]C(=[NH+][C@@H]1CCc2nc[nH]c2C1)N1CC2(CCC2)[C@H]1c1ccccc1	ZINC000330346567	457033341	/nfs/dbraw/zinc/03/33/41/457033341.db2.gz	GSUBRQWBPYTRLM-CRAIPNDOSA-N	0	3	336.439	3.408	20	30		EGEDHN
[O-]C(=[NH+][C@@H]1CCc2[nH]cnc2C1)N1CC2(CCC2)[C@H]1c1ccccc1	ZINC000330346567	457033350	/nfs/dbraw/zinc/03/33/50/457033350.db2.gz	GSUBRQWBPYTRLM-CRAIPNDOSA-N	0	3	336.439	3.408	20	30		EGEDHN
CC[C@@H](C)N[C@@H](CNC(=O)c1cccc(CC#N)c1)c1ccco1	ZINC000359553390	457095496	/nfs/dbraw/zinc/09/54/96/457095496.db2.gz	HOCPCABFWCTGKF-PBHICJAKSA-N	0	3	325.412	3.205	20	30		EGEDHN
CSc1nc(C(C)C)nc(C)c1C(=O)N[C@@H]1CCN(C)[C@@H](C)C1	ZINC000331065040	457126996	/nfs/dbraw/zinc/12/69/96/457126996.db2.gz	QAYSUAUURGZTCG-WCQYABFASA-N	0	3	336.505	3.418	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H]1C)OCC	ZINC000359829600	457133229	/nfs/dbraw/zinc/13/32/29/457133229.db2.gz	FYQRDWZDLWKRQV-QRQLOZEOSA-N	0	3	330.472	3.137	20	30		EGEDHN
N#CC(C(=O)Nc1cccc2ccccc21)c1ccc([N+](=O)[O-])cn1	ZINC000359914653	457145334	/nfs/dbraw/zinc/14/53/34/457145334.db2.gz	BEPBPZYPTUKBBZ-HNNXBMFYSA-N	0	3	332.319	3.389	20	30		EGEDHN
CC(C)(C)[C@H](C#N)NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000331222958	457148793	/nfs/dbraw/zinc/14/87/93/457148793.db2.gz	YYPKVNUVXLICLU-RDJZCZTQSA-N	0	3	331.435	3.092	20	30		EGEDHN
N#Cc1csc(CN[C@@H]2CCCN(C(=O)CCC(F)(F)F)C2)c1	ZINC000342223046	457177805	/nfs/dbraw/zinc/17/78/05/457177805.db2.gz	MELWRTNJRKIAQT-GFCCVEGCSA-N	0	3	345.390	3.043	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CCC[C@H]1c1cccnc1	ZINC000347001475	457193632	/nfs/dbraw/zinc/19/36/32/457193632.db2.gz	AJWOOFSXMFRFJB-UXHICEINSA-N	0	3	338.451	3.387	20	30		EGEDHN
COCCN(C(=O)C(C)C#N)[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000347029983	457197033	/nfs/dbraw/zinc/19/70/33/457197033.db2.gz	BWOIYAPHHBMXDR-VXGBXAGGSA-N	0	3	328.334	3.401	20	30		EGEDHN
CC[C@H]1CCCCN1CCNC(=O)CSCc1ccc(C#N)cc1	ZINC000354395834	457198819	/nfs/dbraw/zinc/19/88/19/457198819.db2.gz	LGLNNVXDCYONJN-SFHVURJKSA-N	0	3	345.512	3.172	20	30		EGEDHN
CCCN(CC(=O)N(CC)CCC#N)[C@@H]1C[C@H](OCC)C12CCCC2	ZINC000354468187	457241707	/nfs/dbraw/zinc/24/17/07/457241707.db2.gz	WDNJYJCFRQUTMQ-MSOLQXFVSA-N	0	3	349.519	3.198	20	30		EGEDHN
Cc1cc(C(=O)C(C#N)c2ccncn2)ccc1NC(=O)CC(C)C	ZINC000354466279	457241792	/nfs/dbraw/zinc/24/17/92/457241792.db2.gz	MQLJUNLERJDPEQ-OAHLLOKOSA-N	0	3	336.395	3.260	20	30		EGEDHN
C[C@@H](C#N)CSc1ccccc1NC(=O)CSCCN(C)C	ZINC000339742268	457243900	/nfs/dbraw/zinc/24/39/00/457243900.db2.gz	JYSIYMUTMSSOFH-ZDUSSCGKSA-N	0	3	337.514	3.172	20	30		EGEDHN
COc1ccc(C(=O)C(C#N)c2ccncn2)cc1-c1ccccn1	ZINC000354472651	457246057	/nfs/dbraw/zinc/24/60/57/457246057.db2.gz	PEFJQTRFKKUSLV-HNNXBMFYSA-N	0	3	330.347	3.037	20	30		EGEDHN
C[C@H](CCC#N)N(C)C[C@H](O)COc1ccccc1C(F)(F)F	ZINC000351269695	457249674	/nfs/dbraw/zinc/24/96/74/457249674.db2.gz	MPWIUEZHHLOUKX-OLZOCXBDSA-N	0	3	330.350	3.069	20	30		EGEDHN
C[C@@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)CCC(C)(C)C#N	ZINC000347218845	457293595	/nfs/dbraw/zinc/29/35/95/457293595.db2.gz	BSTLSRXTYJCGJL-HNNXBMFYSA-N	0	3	349.500	3.159	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@H]1CCC[C@]1(C)CO	ZINC000351516100	457302382	/nfs/dbraw/zinc/30/23/82/457302382.db2.gz	IBCFNEGXSZRPAL-FUHWJXTLSA-N	0	3	334.485	3.044	20	30		EGEDHN
C=CCSc1ccccc1C(=O)NCCCN1CCCO[C@H](C)C1	ZINC000347235227	457303133	/nfs/dbraw/zinc/30/31/33/457303133.db2.gz	PMPZYPVZXASDRQ-MRXNPFEDSA-N	0	3	348.512	3.195	20	30		EGEDHN
CN(C)Cc1ccc(NC(=O)c2ccn(-c3cccc(C#N)c3)n2)cc1	ZINC000342440541	457306066	/nfs/dbraw/zinc/30/60/66/457306066.db2.gz	RGPBOXFGDRVOIZ-UHFFFAOYSA-N	0	3	345.406	3.058	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N[C@H]2CCC(C)(C)C2)cc1	ZINC000351696579	457314108	/nfs/dbraw/zinc/31/41/08/457314108.db2.gz	WYTINNQUJWLRLJ-JSGCOSHPSA-N	0	3	349.456	3.073	20	30		EGEDHN
C[C@H](CNC(=O)C[C@H](CC#N)c1ccccc1)N1CCC(C)CC1	ZINC000355272329	457351818	/nfs/dbraw/zinc/35/18/18/457351818.db2.gz	HGWCLWJJVOALDP-MJGOQNOKSA-N	0	3	327.472	3.311	20	30		EGEDHN
CN(Cc1ccccc1)[C@H](CNC(=O)c1ccc(C#N)s1)C1CC1	ZINC000357265577	457409621	/nfs/dbraw/zinc/40/96/21/457409621.db2.gz	QVNGDYVFCFKFTL-QGZVFWFLSA-N	0	3	339.464	3.260	20	30		EGEDHN
Cc1cc(F)cc2c1ncc(C#N)c2NCCN1CCC(C)CC1	ZINC000360955782	457464266	/nfs/dbraw/zinc/46/42/66/457464266.db2.gz	SOTFRWCXKZQXFS-UHFFFAOYSA-N	0	3	326.419	3.120	20	30		EGEDHN
COc1ccc(CN2CC3(CCC3)[C@H]2C2CCOCC2)cc1C#N	ZINC000425374162	457526789	/nfs/dbraw/zinc/52/67/89/457526789.db2.gz	RGROTCGKQMQPNK-LJQANCHMSA-N	0	3	326.440	3.348	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CCOC2(CCOCC2)CC1	ZINC000364239153	457542062	/nfs/dbraw/zinc/54/20/62/457542062.db2.gz	HFWFPELBZQRUIW-UHFFFAOYSA-N	0	3	328.456	3.259	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N(C)C[C@H](O)COc1cccc2[nH]ccc21	ZINC000425541259	457590776	/nfs/dbraw/zinc/59/07/76/457590776.db2.gz	WIMOLLBFAPTQEW-YJBOKZPZSA-N	0	3	349.434	3.472	20	30		EGEDHN
COC(=O)[C@@H]1CC[C@@H](NCc2ccc(C#N)cc2C(F)(F)F)C1	ZINC000356404051	457608487	/nfs/dbraw/zinc/60/84/87/457608487.db2.gz	IOQNCMPDBLYXQG-DGCLKSJQSA-N	0	3	326.318	3.008	20	30		EGEDHN
C=CCC[C@@H](C(=O)NC1CCN([C@@H]2CCOC2)CC1)c1ccccc1	ZINC000364462472	457613881	/nfs/dbraw/zinc/61/38/81/457613881.db2.gz	PQJSKJIMGCCZMQ-WOJBJXKFSA-N	0	3	342.483	3.106	20	30		EGEDHN
CO[C@H]1CCCN([C@H](C)C(=O)N(CCC#N)c2ccc(C)cc2)CC1	ZINC000374696414	457689247	/nfs/dbraw/zinc/68/92/47/457689247.db2.gz	XKPQOHIAVKJWSX-MJGOQNOKSA-N	0	3	343.471	3.131	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@H](C)N1CC[C@H](n2ncc3ccccc32)C1	ZINC000357791507	457691741	/nfs/dbraw/zinc/69/17/41/457691741.db2.gz	AGNUWBZGMGHENI-WMZOPIPTSA-N	0	3	340.471	3.096	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H](C)[C@H](c1ccccc1C)N(C)C	ZINC000357852652	457712428	/nfs/dbraw/zinc/71/24/28/457712428.db2.gz	BPLXNMSDMYEBTN-VQIMIIECSA-N	0	3	325.456	3.404	20	30		EGEDHN
Cc1nc2ccccc2n1CCNC(=O)C(C#N)CCc1ccccc1	ZINC000433154753	457765693	/nfs/dbraw/zinc/76/56/93/457765693.db2.gz	UXNIULYEXRZTCD-SFHVURJKSA-N	0	3	346.434	3.234	20	30		EGEDHN
Cc1cccc(N2CCN(C(=O)C(C#N)CCc3ccccc3)CC2)c1	ZINC000433217824	457782668	/nfs/dbraw/zinc/78/26/68/457782668.db2.gz	DPOFBGFVTOLBMG-HXUWFJFHSA-N	0	3	347.462	3.416	20	30		EGEDHN
COCCN(Cc1ccccc1)C(=O)C(C#N)CCc1ccccc1	ZINC000433217921	457783022	/nfs/dbraw/zinc/78/30/22/457783022.db2.gz	HEKNCGHYSNIKNV-HXUWFJFHSA-N	0	3	336.435	3.434	20	30		EGEDHN
N#CC(C(=O)c1cccc2c1OCC(=O)N2)c1nccc2ccccc21	ZINC000361543230	457784463	/nfs/dbraw/zinc/78/44/63/457784463.db2.gz	LXNKNSMMABTYRL-HNNXBMFYSA-N	0	3	343.342	3.056	20	30		EGEDHN
C=CCC[C@H](N[C@H]1CCN(C2CCOCC2)C1=O)c1ccccc1	ZINC000366121495	457795140	/nfs/dbraw/zinc/79/51/40/457795140.db2.gz	CXDVFDYSRBYFDZ-OALUTQOASA-N	0	3	328.456	3.063	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)c1ccnn1-c1ccccc1	ZINC000361655079	457812875	/nfs/dbraw/zinc/81/28/75/457812875.db2.gz	NQAIAAUOGADTNS-HNNXBMFYSA-N	0	3	341.374	3.249	20	30		EGEDHN
CCc1noc(CC)c1CNC(=O)C(C#N)CCc1ccccc1	ZINC000433374776	457825466	/nfs/dbraw/zinc/82/54/66/457825466.db2.gz	WIBAXJGYACFRAS-HNNXBMFYSA-N	0	3	325.412	3.188	20	30		EGEDHN
N#Cc1c(C#N)c(N2CC[C@@H](N3CCCC3)C2)nc2c1CCCCCC2	ZINC000366496709	457830353	/nfs/dbraw/zinc/83/03/53/457830353.db2.gz	YMQRQAJREHLJOF-MRXNPFEDSA-N	0	3	349.482	3.158	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1noc2c1C[C@H](C)CC2)C(C)C	ZINC000433791372	457887083	/nfs/dbraw/zinc/88/70/83/457887083.db2.gz	CMSHGIJBEHTRDL-WBVHZDCISA-N	0	3	345.487	3.228	20	30		EGEDHN
N#Cc1cccc(OCCN2CCC(F)(c3cccnc3)CC2)c1	ZINC000375363283	457898825	/nfs/dbraw/zinc/89/88/25/457898825.db2.gz	UIUTXWCEFCZKFR-UHFFFAOYSA-N	0	3	325.387	3.293	20	30		EGEDHN
C#CC[C@H](NC(=O)N1CCCC12CCN(C)CC2)c1ccccc1	ZINC000371404409	457912036	/nfs/dbraw/zinc/91/20/36/457912036.db2.gz	NKGXSDXYRCEKEL-SFHVURJKSA-N	0	3	325.456	3.021	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)N1CCCC12CCN(C)CC2	ZINC000371416993	457919914	/nfs/dbraw/zinc/91/99/14/457919914.db2.gz	QFJLDZMCTOLSLZ-UHFFFAOYSA-N	0	3	342.443	3.049	20	30		EGEDHN
C=CC[C@@H](C(=O)NCC(C)(C)N1CCC(OC)CC1)c1ccccc1	ZINC000426997694	457934360	/nfs/dbraw/zinc/93/43/60/457934360.db2.gz	MHMDMKPNHGWSGQ-LJQANCHMSA-N	0	3	344.499	3.352	20	30		EGEDHN
Cc1cc(NC(=O)c2ccc(CC#N)cc2)ccc1OCCN(C)C	ZINC000458206967	457969105	/nfs/dbraw/zinc/96/91/05/457969105.db2.gz	ISDFZTPZZYRSLC-UHFFFAOYSA-N	0	3	337.423	3.254	20	30		EGEDHN
C=CCN1CC[C@@H](N2CCC(c3c[nH]c4cc(F)ccc43)CC2)C1=O	ZINC000375598678	457984966	/nfs/dbraw/zinc/98/49/66/457984966.db2.gz	QLWIJDIUJGQDOO-LJQANCHMSA-N	0	3	341.430	3.273	20	30		EGEDHN
C#CCCN1CCC(NC(=O)C2(c3ccccc3C)CCCC2)CC1	ZINC000368272906	458022492	/nfs/dbraw/zinc/02/24/92/458022492.db2.gz	JUDVLVMLWFBZAS-UHFFFAOYSA-N	0	3	338.495	3.411	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1C(=O)NC1CCN([C@@H](C)c2ccccc2)CC1	ZINC000375716977	458036236	/nfs/dbraw/zinc/03/62/36/458036236.db2.gz	CGFLUIFILAUYGN-PWIZWCRZSA-N	0	3	342.483	3.309	20	30		EGEDHN
C=CCSc1ccccc1C(=O)N1CCC(OCCN(C)C)CC1	ZINC000362394369	458150161	/nfs/dbraw/zinc/15/01/61/458150161.db2.gz	CZBXBYAIMNXKLK-UHFFFAOYSA-N	0	3	348.512	3.148	20	30		EGEDHN
C=C(CN[C@H](C)c1cc(S(N)(=O)=O)c(C)cc1C)c1ccccc1	ZINC000358759056	458198423	/nfs/dbraw/zinc/19/84/23/458198423.db2.gz	SVMRFMKVBWDDMX-MRXNPFEDSA-N	0	3	344.480	3.315	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCN(CCSc3ccc(F)cc3)C2)nc1	ZINC000428824904	458217621	/nfs/dbraw/zinc/21/76/21/458217621.db2.gz	ZHNPDCSMQXXKJF-INIZCTEOSA-N	0	3	343.427	3.338	20	30		EGEDHN
C=CCC1(CNC(=O)N(CCN(C)C)Cc2ccccn2)CCCC1	ZINC000459056190	458255283	/nfs/dbraw/zinc/25/52/83/458255283.db2.gz	WAUXRABOQUHBBW-UHFFFAOYSA-N	0	3	344.503	3.291	20	30		EGEDHN
C=C(CC)CNC(=O)N1C[C@H]2CCN(Cc3ccccc3)C[C@H]2C1	ZINC000459103872	458266736	/nfs/dbraw/zinc/26/67/36/458266736.db2.gz	UYAXVINHRVDFPM-MOPGFXCFSA-N	0	3	327.472	3.116	20	30		EGEDHN
Cc1ccc(C(=O)NC2CCN([C@H](C)c3ccncc3)CC2)cc1C#N	ZINC000376385000	458284968	/nfs/dbraw/zinc/28/49/68/458284968.db2.gz	LCIQGQYTPUVFPQ-MRXNPFEDSA-N	0	3	348.450	3.217	20	30		EGEDHN
O=C1Nc2ccccc2[C@]12CCN(CC#Cc1ccc(Cl)cc1)C2	ZINC000372361239	458290672	/nfs/dbraw/zinc/29/06/72/458290672.db2.gz	SZKHPEOCZJCRJK-HXUWFJFHSA-N	0	3	336.822	3.287	20	30		EGEDHN
C=CCN1CCC(Nc2ncc([N+](=O)[O-])cc2C(F)(F)F)CC1	ZINC000413123408	458294133	/nfs/dbraw/zinc/29/41/33/458294133.db2.gz	CCVPGDNAFBSRDP-UHFFFAOYSA-N	0	3	330.310	3.071	20	30		EGEDHN
CCc1ccc([C@@H](CN2CCOCC2)NCC(C)(C)CC#N)cc1	ZINC000414170532	458315881	/nfs/dbraw/zinc/31/58/81/458315881.db2.gz	SULUONKWWMWUCN-LJQANCHMSA-N	0	3	329.488	3.152	20	30		EGEDHN
C=CCC1(C(=O)Nc2ccc(OCCN(C)C)c(OC)c2)CCC1	ZINC000416335043	458341880	/nfs/dbraw/zinc/34/18/80/458341880.db2.gz	SRXWZEQXKLUONJ-UHFFFAOYSA-N	0	3	332.444	3.321	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2c(OC)cccc2SC)CC1	ZINC000417672347	458366836	/nfs/dbraw/zinc/36/68/36/458366836.db2.gz	SQKRABAUZYNIRE-UHFFFAOYSA-N	0	3	335.473	3.189	20	30		EGEDHN
C[C@H](C(=O)N(CCC#N)c1ccc(F)cc1)N1C[C@@H](C)[C@@H](C)[C@H]1C	ZINC000419376526	458381540	/nfs/dbraw/zinc/38/15/40/458381540.db2.gz	TYPBAFCIJNEVFK-KLHDSHLOSA-N	0	3	331.435	3.437	20	30		EGEDHN
C=CCC[C@H]1NC(=O)N(C[C@H](c2ccsc2)N(CC)CC)C1=O	ZINC000419930081	458393298	/nfs/dbraw/zinc/39/32/98/458393298.db2.gz	XLHXXRNHDNISAS-HUUCEWRRSA-N	0	3	335.473	3.018	20	30		EGEDHN
C=CCC[C@H]1NC(=O)N(C2CCN([C@H](C)c3ccccc3)CC2)C1=O	ZINC000420006292	458395254	/nfs/dbraw/zinc/39/52/54/458395254.db2.gz	XVNFEYNTGAXNNE-CRAIPNDOSA-N	0	3	341.455	3.099	20	30		EGEDHN
Cc1c(F)cccc1C(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000421460698	458414419	/nfs/dbraw/zinc/41/44/19/458414419.db2.gz	AMJLQKPRRAYHNF-UHFFFAOYSA-N	0	3	339.414	3.210	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cc(C)n(C(C)C)n1)C(C)C	ZINC000448975557	458417434	/nfs/dbraw/zinc/41/74/34/458417434.db2.gz	PQUZSXKCDKWPEP-GOSISDBHSA-N	0	3	332.492	3.201	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)NCC(C)(C)CCC#N)CN1Cc1ccccc1	ZINC000376916679	458421318	/nfs/dbraw/zinc/42/13/18/458421318.db2.gz	IMQPQZWFQPXIMV-FUHWJXTLSA-N	0	3	342.487	3.279	20	30		EGEDHN
C=CCC1(C(=O)Nc2ccc(OC[C@H](O)CN(C)C)cc2)CCCC1	ZINC000450132446	458440864	/nfs/dbraw/zinc/44/08/64/458440864.db2.gz	IEPRRVXFWNTQDB-QGZVFWFLSA-N	0	3	346.471	3.063	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN(C)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000459670964	458442479	/nfs/dbraw/zinc/44/24/79/458442479.db2.gz	GHFJTVBIYCYWBN-QRQLOZEOSA-N	0	3	327.472	3.263	20	30		EGEDHN
C=CCS(=O)(=O)CCN[C@@H]1CCC[C@H]1c1ccc(Cl)cc1	ZINC000373265993	458447219	/nfs/dbraw/zinc/44/72/19/458447219.db2.gz	DFCKTZLXMGDPKH-JKSUJKDBSA-N	0	3	327.877	3.167	20	30		EGEDHN
N#Cc1cccc(COc2cccc(CN3CC[C@](O)(C4CC4)C3)c2)c1	ZINC000373270554	458448663	/nfs/dbraw/zinc/44/86/63/458448663.db2.gz	LSQAIIZNOIVZLE-JOCHJYFZSA-N	0	3	348.446	3.484	20	30		EGEDHN
N#Cc1cccc(OCCCN2CCC[C@](O)(C(F)(F)F)CC2)c1	ZINC000377085705	458457838	/nfs/dbraw/zinc/45/78/38/458457838.db2.gz	CHROWHKYBDNIPE-MRXNPFEDSA-N	0	3	342.361	3.106	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)CN1[C@H](C)C[C@H](c2ccccc2)[C@H]1C	ZINC000451184168	458468727	/nfs/dbraw/zinc/46/87/27/458468727.db2.gz	LLMVOWWRGMYOGF-HBXLWWENSA-N	0	3	327.472	3.307	20	30		EGEDHN
C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)N1CC(=O)NCc1ccc(C#N)cc1	ZINC000451182226	458469653	/nfs/dbraw/zinc/46/96/53/458469653.db2.gz	INKWDJDUVUDFLM-LZJOCLMNSA-N	0	3	347.462	3.441	20	30		EGEDHN
CO[C@@H]1CCC[C@H]1NCC(=O)Nc1ccccc1S[C@H](C)CC#N	ZINC000451628881	458484325	/nfs/dbraw/zinc/48/43/25/458484325.db2.gz	GGHKQDATIRVHAE-IIAWOOMASA-N	0	3	347.484	3.176	20	30		EGEDHN
C[C@]12CN([C@@H]3CCN(c4sccc4C#N)C3=O)C[C@@H]1[C@@H]1CC[C@H]2C1	ZINC000452053074	458494264	/nfs/dbraw/zinc/49/42/64/458494264.db2.gz	NWXIMKKYQQDWCE-BZKOTJRBSA-N	0	3	341.480	3.093	20	30		EGEDHN
C=CCN1CC[C@H](NCC2(c3ccc(F)cc3)CCCCC2)C1=O	ZINC000493623130	458515621	/nfs/dbraw/zinc/51/56/21/458515621.db2.gz	MVRWBQUTLVHDQR-SFHVURJKSA-N	0	3	330.447	3.404	20	30		EGEDHN
C=C(C)Cn1c(C(C)C)nnc1N1CCN([C@@H]2C[C@@H]2C)C[C@@H](C)C1	ZINC000453453121	458531921	/nfs/dbraw/zinc/53/19/21/458531921.db2.gz	NFUKVDIUUNLTJH-IXDOHACOSA-N	0	3	331.508	3.144	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1nc(-c2ccccc2Cl)cs1	ZINC000424082157	458554838	/nfs/dbraw/zinc/55/48/38/458554838.db2.gz	VZFGRYNNBUWBED-LBPRGKRZSA-N	0	3	334.832	3.423	20	30		EGEDHN
Cc1ccc(-c2nc(NC(=O)[C@@H](N)CCCC#N)sc2C)s1	ZINC000424111380	458560963	/nfs/dbraw/zinc/56/09/63/458560963.db2.gz	GIAKYGYBHQHFSO-NSHDSACASA-N	0	3	334.470	3.448	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)NC1(c2cccc(C(F)(F)F)c2)CCC1	ZINC000424123432	458564131	/nfs/dbraw/zinc/56/41/31/458564131.db2.gz	KLHTZNCEQZIJQC-AWEZNQCLSA-N	0	3	339.361	3.222	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N1Cc2ccccc2C[C@@H]1c1ccccc1	ZINC000424124194	458564409	/nfs/dbraw/zinc/56/44/09/458564409.db2.gz	MAHNLXUKAJEHEL-WOJBJXKFSA-N	0	3	333.435	3.334	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N(CCc1cccc(F)c1)C1CCCC1	ZINC000424131924	458566499	/nfs/dbraw/zinc/56/64/99/458566499.db2.gz	GZCGRZJZGBZTFQ-SFHVURJKSA-N	0	3	331.435	3.161	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1ncccc1OCC1CCCCC1	ZINC000424140060	458569497	/nfs/dbraw/zinc/56/94/97/458569497.db2.gz	AXCWWHXXKACJBA-HNNXBMFYSA-N	0	3	330.432	3.000	20	30		EGEDHN
Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)[C@@H](N)CCCC#N	ZINC000424150264	458571762	/nfs/dbraw/zinc/57/17/62/458571762.db2.gz	YNERAKUZTLWKFR-RDJZCZTQSA-N	0	3	328.460	3.334	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N1CCc2ccccc2[C@@H]1Cc1ccccc1	ZINC000424172806	458577967	/nfs/dbraw/zinc/57/79/67/458577967.db2.gz	MEXSGWOWULNDQJ-RTWAWAEBSA-N	0	3	347.462	3.376	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N(Cc1cccc(-c2cccnc2)c1)C1CC1	ZINC000424178892	458578447	/nfs/dbraw/zinc/57/84/47/458578447.db2.gz	XUPXYDWEAOLEHX-FQEVSTJZSA-N	0	3	348.450	3.261	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Nc1cc(C(C)C)on1)C(C)C	ZINC000438531465	458592491	/nfs/dbraw/zinc/59/24/91/458592491.db2.gz	UUKSYWRQXBLBTR-HNNXBMFYSA-N	0	3	334.464	3.040	20	30		EGEDHN
C[C@@H](C(=O)N1CCN(C2CCC(C)CC2)CC1)c1cccc(C#N)c1	ZINC000462071051	458592676	/nfs/dbraw/zinc/59/26/76/458592676.db2.gz	MYXRMDJCJHFZNP-OHTSDLOESA-N	0	3	339.483	3.385	20	30		EGEDHN
C=C(CC)CNC(=O)N(C)CCC1CCN(c2ccncc2)CC1	ZINC000455515599	458602144	/nfs/dbraw/zinc/60/21/44/458602144.db2.gz	BHXXESFXQMRCQI-UHFFFAOYSA-N	0	3	330.476	3.296	20	30		EGEDHN
C[C@H]1CCCCN1CCNC(=O)Nc1ccc(CC#N)cc1Cl	ZINC000455698059	458606325	/nfs/dbraw/zinc/60/63/25/458606325.db2.gz	FNNCXQLDZKNAQA-ZDUSSCGKSA-N	0	3	334.851	3.402	20	30		EGEDHN
CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000455704678	458607453	/nfs/dbraw/zinc/60/74/53/458607453.db2.gz	NWJJWIGHLGTYTQ-CABCVRRESA-N	0	3	346.862	3.497	20	30		EGEDHN
CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@@H]2CC[C@H](C#N)C2)cc1	ZINC000424320216	458614459	/nfs/dbraw/zinc/61/44/59/458614459.db2.gz	FURHFENVGFQVOM-HLLBOEOZSA-N	0	3	349.500	3.060	20	30		EGEDHN
CN(CCN1CCCC1)C(=O)Nc1ccc(OC(C)(C)C)c(C#N)c1	ZINC000455791408	458615867	/nfs/dbraw/zinc/61/58/67/458615867.db2.gz	IXOIGLWPRSKTQZ-UHFFFAOYSA-N	0	3	344.459	3.295	20	30		EGEDHN
C[C@@H](C(=O)N[C@H](CN(C)C)c1ccc(F)cc1)c1cccc(C#N)c1	ZINC000462465967	458622979	/nfs/dbraw/zinc/62/29/79/458622979.db2.gz	MYDSQTIVJOBHPV-AUUYWEPGSA-N	0	3	339.414	3.220	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NCC1(N(C)Cc2ccccc2)CCC1	ZINC000456122047	458632223	/nfs/dbraw/zinc/63/22/23/458632223.db2.gz	NCERNBSLOQLXSO-FQEVSTJZSA-N	0	3	344.499	3.386	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCc1ccccc1CN1CCN(CC)CC1	ZINC000424581299	458668221	/nfs/dbraw/zinc/66/82/21/458668221.db2.gz	FMOVDISVDJSFOL-UHFFFAOYSA-N	0	3	343.515	3.043	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000424596133	458675357	/nfs/dbraw/zinc/67/53/57/458675357.db2.gz	GFERVUBKJMJQTI-UHFFFAOYSA-N	0	3	343.515	3.307	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1	ZINC000424704365	458713064	/nfs/dbraw/zinc/71/30/64/458713064.db2.gz	IFYPVUIMZRWJGJ-IAGOWNOFSA-N	0	3	336.520	3.327	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)NCCN1CCCC[C@@H]1CC	ZINC000463763210	458718160	/nfs/dbraw/zinc/71/81/60/458718160.db2.gz	CLBHNEAECFAXIL-INIZCTEOSA-N	0	3	346.471	3.254	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)C/C(C)=C\c2ccccc2)CC1	ZINC000494814650	458750208	/nfs/dbraw/zinc/75/02/08/458750208.db2.gz	XJQKTDFFZLCDLR-ICFOKQHNSA-N	0	3	327.472	3.382	20	30		EGEDHN
C=CCn1c(-c2ccccc2C)nnc1N1CCN(CC(C)C)CC1	ZINC000508873423	458765961	/nfs/dbraw/zinc/76/59/61/458765961.db2.gz	NAGORHIBLXNSDD-UHFFFAOYSA-N	0	3	339.487	3.218	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)[C@@H](C)N1CC[C@H](Cc2ccccc2)[C@H]1C	ZINC000472339028	458787990	/nfs/dbraw/zinc/78/79/90/458787990.db2.gz	BBVYRBCUWJHIAB-VGUOSERISA-N	0	3	341.499	3.382	20	30		EGEDHN
CC(C)Cc1ccc([C@@H](CNC(=O)N(C)C[C@@H](C)C#N)N(C)C)cc1	ZINC000513397573	458793634	/nfs/dbraw/zinc/79/36/34/458793634.db2.gz	WBBABMAJTMIEJG-QFBILLFUSA-N	0	3	344.503	3.289	20	30		EGEDHN
CC#CCN(C)C[C@H](O)CO[C@@H](c1ccccc1)c1ccccc1C	ZINC000516096888	458814680	/nfs/dbraw/zinc/81/46/80/458814680.db2.gz	LZRKMYOSIWZCEA-UNMCSNQZSA-N	0	3	337.463	3.417	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNc1nc2ccccc2cc1CO)C(C)C	ZINC000518350487	458859926	/nfs/dbraw/zinc/85/99/26/458859926.db2.gz	CYAJTGGABIVTOX-HXUWFJFHSA-N	0	3	339.483	3.260	20	30		EGEDHN
C=CC1CCN(C(=O)NC[C@H](CC)N2CCc3ccccc3C2)CC1	ZINC000518441998	458867706	/nfs/dbraw/zinc/86/77/06/458867706.db2.gz	UKUWVDIIHVOKPK-FQEVSTJZSA-N	0	3	341.499	3.431	20	30		EGEDHN
CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H]1CCN(C)[C@@H](C)C1	ZINC000466032514	458872783	/nfs/dbraw/zinc/87/27/83/458872783.db2.gz	ISPFVFCYGOBWHR-QFBILLFUSA-N	0	3	342.487	3.209	20	30		EGEDHN
N#Cc1cccc(C2(NC(=O)C(C#N)CCc3ccccc3)CC2)c1	ZINC000552468632	458892331	/nfs/dbraw/zinc/89/23/31/458892331.db2.gz	VJTGDUURBNXWIR-GOSISDBHSA-N	0	3	329.403	3.436	20	30		EGEDHN
CCOC(=O)[C@@H](C)[C@H](C)NCC#Cc1ccc(OC(F)(F)F)cc1	ZINC000554816100	458901662	/nfs/dbraw/zinc/90/16/62/458901662.db2.gz	DTRRMWCONIRLMU-STQMWFEESA-N	0	3	343.345	3.114	20	30		EGEDHN
CO[C@]1(C)C[C@H](N(C)C(=O)C(C#N)CCc2ccccc2)C1(C)C	ZINC000555556504	458906958	/nfs/dbraw/zinc/90/69/58/458906958.db2.gz	VHPXFWBUQGUVME-ABSDTBQOSA-N	0	3	328.456	3.421	20	30		EGEDHN
C=CCOc1ccccc1CN1CCC[C@H](c2nc(N(C)C)no2)C1	ZINC000556045132	458925254	/nfs/dbraw/zinc/92/52/54/458925254.db2.gz	XIMUTKIUEDRLMP-INIZCTEOSA-N	0	3	342.443	3.080	20	30		EGEDHN
CC(C)[C@@H](NC(=O)C(C#N)CCc1ccccc1)C1(CO)CCCC1	ZINC000566465386	458940624	/nfs/dbraw/zinc/94/06/24/458940624.db2.gz	UWZBTHUMQBUHMQ-RTBURBONSA-N	0	3	342.483	3.452	20	30		EGEDHN
C[C@H]1CN(C2CC2)C[C@@H]1NC(=O)c1ccccc1-c1ccccc1C#N	ZINC000467027502	458944219	/nfs/dbraw/zinc/94/42/19/458944219.db2.gz	YKLGRHRVWTXCSS-BTYIYWSLSA-N	0	3	345.446	3.438	20	30		EGEDHN
COc1ccc([C@@H](CNC[C@@H](C#N)CCC#N)N2CCCCC2)cc1	ZINC000556483515	458965881	/nfs/dbraw/zinc/96/58/81/458965881.db2.gz	XTHBXCVZZGVOPI-YLJYHZDGSA-N	0	3	340.471	3.255	20	30		EGEDHN
C=C(C)CCNC(=O)NC[C@@H](c1cccc(OC)c1)N1CCCC1	ZINC000457482719	458972317	/nfs/dbraw/zinc/97/23/17/458972317.db2.gz	LNNWLZGSGHCOFM-SFHVURJKSA-N	0	3	331.460	3.098	20	30		EGEDHN
CC[C@@H]1CCCCN1CCNC(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000476039693	458976163	/nfs/dbraw/zinc/97/61/63/458976163.db2.gz	GXMRAWZPUGIWLV-GOSISDBHSA-N	0	3	327.472	3.482	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1	ZINC000467842090	458989717	/nfs/dbraw/zinc/98/97/17/458989717.db2.gz	PNKVTJOYGDUFRT-FPOVZHCZSA-N	0	3	344.499	3.477	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cn2ccc(C)cc2n1)C(C)C	ZINC000495967785	459022093	/nfs/dbraw/zinc/02/20/93/459022093.db2.gz	XPJPFUVYJILXAA-GOSISDBHSA-N	0	3	340.471	3.071	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H]2CN(Cc3cccc(C#N)c3)C[C@H]2C1	ZINC000496027726	459041935	/nfs/dbraw/zinc/04/19/35/459041935.db2.gz	IXIOBKYTPBOIRV-MSOLQXFVSA-N	0	3	341.455	3.247	20	30		EGEDHN
COc1ccc(OCCN(C)Cc2ccc(C#N)c(OC)c2)cc1	ZINC000442827082	459043213	/nfs/dbraw/zinc/04/32/13/459043213.db2.gz	YJOCELYOXMUQOX-UHFFFAOYSA-N	0	3	326.396	3.086	20	30		EGEDHN
Cc1cc(CN[C@@H]2CC[C@H](C#N)C2)ccc1I	ZINC000442854320	459045879	/nfs/dbraw/zinc/04/58/79/459045879.db2.gz	ADLQWNSZZXIKHU-WCQYABFASA-N	0	3	340.208	3.382	20	30		EGEDHN
N#CCC1CCN(C(=O)N[C@H](CN)c2ccc3ccccc3c2)CC1	ZINC000557223412	459058780	/nfs/dbraw/zinc/05/87/80/459058780.db2.gz	MIQQQZNSTKEMJL-LJQANCHMSA-N	0	3	336.439	3.175	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2cc3c(s2)CCCC3)CC1	ZINC000520693194	459083527	/nfs/dbraw/zinc/08/35/27/459083527.db2.gz	YDQUHAJLVLLXJZ-UHFFFAOYSA-N	0	3	347.528	3.467	20	30		EGEDHN
CSC1c2cc(-c3noc(-c4ccc(C#N)cn4)n3)ccc2NC1=O	ZINC000577798286	459095820	/nfs/dbraw/zinc/09/58/20/459095820.db2.gz	IDQKQIKIVMFUCK-AWEZNQCLSA-N	0	3	349.375	3.026	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N1CCSCC[C@H]1C)C(C)C	ZINC000478763359	459107829	/nfs/dbraw/zinc/10/78/29/459107829.db2.gz	QEQXYDOFYWNKSO-SJORKVTESA-N	0	3	339.549	3.222	20	30		EGEDHN
N#Cc1c(NC(=O)CCN2C3CCC2CC3)sc2c1CCCC2	ZINC000532915628	459160805	/nfs/dbraw/zinc/16/08/05/459160805.db2.gz	HLRSHILHJUSWIX-UHFFFAOYSA-N	0	3	329.469	3.454	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCc2c(Cl)cccc2Cl)CC1	ZINC000521600431	459165379	/nfs/dbraw/zinc/16/53/79/459165379.db2.gz	FNNOMXGZCCKTQY-UHFFFAOYSA-N	0	3	342.270	3.443	20	30		EGEDHN
CN(C)CCOc1cccc(NC(=O)N2CCC(CCC#N)CC2)c1	ZINC000567812996	459171674	/nfs/dbraw/zinc/17/16/74/459171674.db2.gz	PDZQZZHKQINBKZ-UHFFFAOYSA-N	0	3	344.459	3.175	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@H]1CCC[C@H](CNCc2ccc(C#N)o2)C1	ZINC000496388180	459175225	/nfs/dbraw/zinc/17/52/25/459175225.db2.gz	RMWMVMFLXCJPDJ-KBPBESRZSA-N	0	3	333.432	3.324	20	30		EGEDHN
CN(Cc1ccccc1)[C@H]1CCN(C(=O)[C@]2(C#N)CC23CCCC3)C1	ZINC000590671441	459177903	/nfs/dbraw/zinc/17/79/03/459177903.db2.gz	SMGBOSBFQYLXAL-GHTZIAJQSA-N	0	3	337.467	3.193	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CCC[C@@H]1[C@H]1CCCO1)C(C)C	ZINC000480515939	459202078	/nfs/dbraw/zinc/20/20/78/459202078.db2.gz	IHHRIYLKOZOSSW-GUDVDZBRSA-N	0	3	349.519	3.038	20	30		EGEDHN
C=CCOCCN[C@@H]1CCc2ccc(I)cc21	ZINC000595031780	459222214	/nfs/dbraw/zinc/22/22/14/459222214.db2.gz	DLCIUGCXRKPHIM-CQSZACIVSA-N	0	3	343.208	3.071	20	30		EGEDHN
CC[C@@H](NCC1(S(C)(=O)=O)CCCCC1)c1ccc(C#N)cc1	ZINC000595077859	459238201	/nfs/dbraw/zinc/23/82/01/459238201.db2.gz	QRMATUCHIOOWSH-QGZVFWFLSA-N	0	3	334.485	3.346	20	30		EGEDHN
CN(CCC#N)C[C@@H](O)CNCc1ccc(C2CCCCC2)cc1	ZINC000578741494	459238331	/nfs/dbraw/zinc/23/83/31/459238331.db2.gz	ZFSBIMGTFLFVIO-FQEVSTJZSA-N	0	3	329.488	3.030	20	30		EGEDHN
C[C@H](CN1CCN(c2nccnc2C#N)C[C@H]1C)C1CCCCC1	ZINC000559113739	459238721	/nfs/dbraw/zinc/23/87/21/459238721.db2.gz	XSTYRJLZVUPIOH-HZPDHXFCSA-N	0	3	327.476	3.075	20	30		EGEDHN
Cc1cc(Br)c(Cl)cc1NC(=O)[C@@H](N)CCCC#N	ZINC000595254950	459262989	/nfs/dbraw/zinc/26/29/89/459262989.db2.gz	FXCQHOCCWGRMEI-NSHDSACASA-N	0	3	344.640	3.371	20	30		EGEDHN
CN(CC(C)(C)C#N)C(=O)N[C@H](CN1CCCCC1)c1ccccc1	ZINC000590925599	459269429	/nfs/dbraw/zinc/26/94/29/459269429.db2.gz	OPCSIBVVCHRCBY-GOSISDBHSA-N	0	3	342.487	3.405	20	30		EGEDHN
COc1ccc([C@H](Cc2ccc(F)cc2)NC(=O)C(C)C#N)cc1	ZINC000522980256	459275374	/nfs/dbraw/zinc/27/53/74/459275374.db2.gz	UGSBCWMXWRSAQV-ACJLOTCBSA-N	0	3	326.371	3.394	20	30		EGEDHN
N#Cc1ccc(CCN[C@@H](CO)c2ccc(C(F)(F)F)cc2)cc1	ZINC000595428673	459297969	/nfs/dbraw/zinc/29/79/69/459297969.db2.gz	GKEDMWIHRPGHKZ-KRWDZBQOSA-N	0	3	334.341	3.443	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@H](C=Nn1cnc2ccccc21)CC(F)F	ZINC000496742178	459306698	/nfs/dbraw/zinc/30/66/98/459306698.db2.gz	QSQGYQDITMUHBD-LLVKDONJSA-N	0	3	338.358	3.419	20	30		EGEDHN
C[C@H](CN1CCC(C)CC1)NC(=O)N[C@H](CCC#N)c1ccccc1	ZINC000595568549	459349893	/nfs/dbraw/zinc/34/98/93/459349893.db2.gz	VLCWKBWAIQNRIU-IEBWSBKVSA-N	0	3	342.487	3.451	20	30		EGEDHN
CC(C)(CNC(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1)N1CCCCC1	ZINC000568849213	459354934	/nfs/dbraw/zinc/35/49/34/459354934.db2.gz	QHJIVDVVSFZMLC-ZWKOTPCHSA-N	0	3	325.456	3.042	20	30		EGEDHN
C[C@H](CNC(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1)N1CCCC[C@H]1C	ZINC000560686607	459386716	/nfs/dbraw/zinc/38/67/16/459386716.db2.gz	WYMKRNJVIHOFIL-VVWQDTPRSA-N	0	3	325.456	3.041	20	30		EGEDHN
C[C@H](c1ccc(F)cc1)N1CCC[C@H](N[C@@H]2CC[C@H](C#N)C2)C1=O	ZINC000569108706	459397608	/nfs/dbraw/zinc/39/76/08/459397608.db2.gz	QBKPFOXDXUAJLX-NONVJHHQSA-N	0	3	329.419	3.160	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N(C)C(=O)N[C@H]1CCN(C(C)(C)C)C1	ZINC000595704361	459405823	/nfs/dbraw/zinc/40/58/23/459405823.db2.gz	PXKAVNLCHBSDEB-YOEHRIQHSA-N	0	3	328.460	3.133	20	30		EGEDHN
CCc1cccc(OC[C@H](O)CN[C@@H]2CCc3cc(C#N)ccc32)c1	ZINC000591763703	459429913	/nfs/dbraw/zinc/42/99/13/459429913.db2.gz	CWAVXYOHYHFTDE-WIYYLYMNSA-N	0	3	336.435	3.137	20	30		EGEDHN
CC(C)(C)OC(=O)NCC12CCC(CC1)CN2[C@@H]1CC[C@@H](C#N)C1	ZINC000497100040	459438867	/nfs/dbraw/zinc/43/88/67/459438867.db2.gz	PXCUAWCZHYTERZ-BWRBCVJASA-N	0	3	333.476	3.448	20	30		EGEDHN
COc1ccc2ncc(C#N)c(N3CC[C@H](N4CCCCC4)C3)c2c1	ZINC000591909514	459480850	/nfs/dbraw/zinc/48/08/50/459480850.db2.gz	SWGCNYJSVVOGGS-INIZCTEOSA-N	0	3	336.439	3.180	20	30		EGEDHN
C=C(C)CN1CCC([C@H]2OCCC[C@H]2NC(=O)OC(C)(C)C)CC1	ZINC000497210239	459487344	/nfs/dbraw/zinc/48/73/44/459487344.db2.gz	ADVFUYJVEUONOT-IAGOWNOFSA-N	0	3	338.492	3.347	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1NCc1ccc(CC#N)cc1	ZINC000497267576	459508450	/nfs/dbraw/zinc/50/84/50/459508450.db2.gz	DKHGJRWANPPYHE-IRXDYDNUSA-N	0	3	329.444	3.288	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)c2ccc(C#N)[nH]2)N(CC)CC)cc1	ZINC000562189692	459516905	/nfs/dbraw/zinc/51/69/05/459516905.db2.gz	IGOBBUDHEAISIW-LJQANCHMSA-N	0	3	338.455	3.262	20	30		EGEDHN
C[C@H](N[C@H]1CCCN(C)C1=O)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000542004679	459519108	/nfs/dbraw/zinc/51/91/08/459519108.db2.gz	LYWBLFQYAUMWAQ-YWZLYKJASA-N	0	3	333.435	3.497	20	30		EGEDHN
CCc1nc(C#N)cc(N(C)[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)n1	ZINC000596132982	459531409	/nfs/dbraw/zinc/53/14/09/459531409.db2.gz	AALFPAUUGLWRKP-LPHOPBHVSA-N	0	3	349.482	3.400	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N1CCC[C@@H](CC#N)C1)C(C)C	ZINC000596139350	459535070	/nfs/dbraw/zinc/53/50/70/459535070.db2.gz	ROESGNOMLXLMTP-ROUUACIJSA-N	0	3	332.492	3.020	20	30		EGEDHN
CC(C)[C@@H]1C[C@H](N[C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)CS1	ZINC000488551053	459545783	/nfs/dbraw/zinc/54/57/83/459545783.db2.gz	ZTUORGNZLPCHCN-JQHSSLGASA-N	0	3	343.496	3.173	20	30		EGEDHN
CCCN(C(=O)Nc1ccc(OC(C)C)c(C#N)c1)[C@H]1CCN(C)C1	ZINC000592239301	459558484	/nfs/dbraw/zinc/55/84/84/459558484.db2.gz	KPVYDUJCRBTSFI-KRWDZBQOSA-N	0	3	344.459	3.293	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CC[C@@H]2Cc2ccccc2)cc1	ZINC000526928272	459560289	/nfs/dbraw/zinc/56/02/89/459560289.db2.gz	UDTBYQAQTDLWSP-WOJBJXKFSA-N	0	3	329.403	3.084	20	30		EGEDHN
C=CC[C@@H](C(=O)Nc1ccnc(OCCN(C)C)c1)c1ccccc1	ZINC000489607275	459568452	/nfs/dbraw/zinc/56/84/52/459568452.db2.gz	RRINWXAKVTYSMO-GOSISDBHSA-N	0	3	339.439	3.320	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCCCOC2CCCCC2)CC1	ZINC000592293337	459572262	/nfs/dbraw/zinc/57/22/62/459572262.db2.gz	FXKLEEPAFWJGON-UHFFFAOYSA-N	0	3	337.508	3.066	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2ccc([C@H]3C[C@H]3C)o2)CC1	ZINC000592293635	459572571	/nfs/dbraw/zinc/57/25/71/459572571.db2.gz	DWHFWMLETOLHMZ-PBHICJAKSA-N	0	3	331.460	3.243	20	30		EGEDHN
C=CCn1cccc1C(=O)N(Cc1ccccc1)C1CCN(C)CC1	ZINC000490017828	459574606	/nfs/dbraw/zinc/57/46/06/459574606.db2.gz	KGIICAQDBZJJMZ-UHFFFAOYSA-N	0	3	337.467	3.411	20	30		EGEDHN
C#C[C@@H](N[C@@H](C)C1CN(C(=O)OC(C)(C)C)C1)c1ccc(F)cc1	ZINC000491181831	459603270	/nfs/dbraw/zinc/60/32/70/459603270.db2.gz	WDXZTZYPQBOAJD-SUMWQHHRSA-N	0	3	332.419	3.345	20	30		EGEDHN
C=C(CNC(=O)N1CCN([C@@H]2C[C@H]2C)C[C@@H](C)C1)c1ccccc1	ZINC000491189445	459603431	/nfs/dbraw/zinc/60/34/31/459603431.db2.gz	VZMUUPBZRRVEBX-GPMSIDNRSA-N	0	3	327.472	3.072	20	30		EGEDHN
N#Cc1c(N2CCN(C3CCCCC3)CC2)nc2cc(Cl)ccn12	ZINC000583889099	459613146	/nfs/dbraw/zinc/61/31/46/459613146.db2.gz	RCTLTCIUCMADOJ-UHFFFAOYSA-N	0	3	343.862	3.314	20	30		EGEDHN
CC[C@@H]1CN([C@@H](C)C(=O)NC2(C#N)CCC2)CC[C@@H]1c1ccccc1	ZINC000527298025	459624419	/nfs/dbraw/zinc/62/44/19/459624419.db2.gz	LDSHHSMQXDRBFE-SCTDSRPQSA-N	0	3	339.483	3.453	20	30		EGEDHN
C=CCN(CCc1ccco1)C[C@H](O)COc1ccccc1Cl	ZINC000491424156	459626217	/nfs/dbraw/zinc/62/62/17/459626217.db2.gz	RSDZXOKBEFKFFL-HNNXBMFYSA-N	0	3	335.831	3.403	20	30		EGEDHN
Cc1csc(CNC2CCC(Oc3ncccc3C#N)CC2)n1	ZINC000527364536	459635908	/nfs/dbraw/zinc/63/59/08/459635908.db2.gz	OEAGPPXPKDCMPA-UHFFFAOYSA-N	0	3	328.441	3.198	20	30		EGEDHN
C=CCN1CCC(NC(=O)/C=C\c2cccc(Br)c2)CC1	ZINC000491543515	459636194	/nfs/dbraw/zinc/63/61/94/459636194.db2.gz	CBCBWIUFISDUCC-SREVYHEPSA-N	0	3	349.272	3.229	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H]2CC[C@@H](c3cccc(Cl)c3)C2)CC1	ZINC000491752469	459667730	/nfs/dbraw/zinc/66/77/30/459667730.db2.gz	MHJMSWQUFGCUPU-IEBWSBKVSA-N	0	3	344.886	3.438	20	30		EGEDHN
CC1CCN([C@@H](CNc2cncc(C#N)n2)c2cccs2)CC1	ZINC000562926690	459671950	/nfs/dbraw/zinc/67/19/50/459671950.db2.gz	ZWYVCASJDXZBAF-HNNXBMFYSA-N	0	3	327.457	3.295	20	30		EGEDHN
C=CCOc1ccccc1C(=O)Nc1cccc(OCCN(C)C)c1	ZINC000500298516	459675338	/nfs/dbraw/zinc/67/53/38/459675338.db2.gz	PGFCNTOSTLRTRF-UHFFFAOYSA-N	0	3	340.423	3.444	20	30		EGEDHN
C#CCCN1CCC(NC(=O)/C=C\c2ccc(OCCC)cc2)CC1	ZINC000491905143	459684212	/nfs/dbraw/zinc/68/42/12/459684212.db2.gz	LUTWMPMBTPSSAI-FLIBITNWSA-N	0	3	340.467	3.093	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN(C)Cc1ccc(F)cc1	ZINC000501348211	459723350	/nfs/dbraw/zinc/72/33/50/459723350.db2.gz	OMXFTSFZJLWHKC-IBGZPJMESA-N	0	3	329.415	3.426	20	30		EGEDHN
C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H]1CCN(C(C)(C)C)C1	ZINC000596677235	459724840	/nfs/dbraw/zinc/72/48/40/459724840.db2.gz	SUHRJCOYBSMFFG-SFHVURJKSA-N	0	3	340.471	3.129	20	30		EGEDHN
C[C@@H](C#N)N(Cc1cccc(C(F)(F)F)c1)C(=O)/C=C\CN(C)C	ZINC000493094428	459733389	/nfs/dbraw/zinc/73/33/89/459733389.db2.gz	LURPRHOSUXWUDF-UJZCVKTISA-N	0	3	339.361	3.064	20	30		EGEDHN
CC[C@@](C)(C#N)C(=O)N(C)C[C@@H]1CCN(Cc2ccc(C)s2)C1	ZINC000563266344	459750843	/nfs/dbraw/zinc/75/08/43/459750843.db2.gz	NCLFEWRLNXAPOR-YJBOKZPZSA-N	0	3	333.501	3.277	20	30		EGEDHN
C=CCOc1ccccc1CNC[C@@H](O)COc1ccccc1C	ZINC000564857738	459777430	/nfs/dbraw/zinc/77/74/30/459777430.db2.gz	XUYHHEMXLJYVHF-GOSISDBHSA-N	0	3	327.424	3.089	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC(=O)N[C@@H](C)c1ccc2c(c1)CCCC2	ZINC000565992037	459790111	/nfs/dbraw/zinc/79/01/11/459790111.db2.gz	UTKIBKUGPPMGCN-BEVDRBHNSA-N	0	3	342.483	3.066	20	30		EGEDHN
Cc1cc(C)cc(CC(=O)N(CCN(C)C)Cc2cccc(C#N)c2)c1	ZINC000596975382	459807931	/nfs/dbraw/zinc/80/79/31/459807931.db2.gz	SCSPCLJECQQTCV-UHFFFAOYSA-N	0	3	349.478	3.308	20	30		EGEDHN
COc1ccc([C@H](CCC#N)NC2CCN(C(=O)C3CC3)CC2)cc1	ZINC000584878678	459818509	/nfs/dbraw/zinc/81/85/09/459818509.db2.gz	SSEUPPDVGVCVQE-IBGZPJMESA-N	0	3	341.455	3.031	20	30		EGEDHN
COCc1ccc(NC(=O)CCN2CCc3ccccc3C2)cc1C#N	ZINC000529816239	459850383	/nfs/dbraw/zinc/85/03/83/459850383.db2.gz	KQRSIMFIDMCENR-UHFFFAOYSA-N	0	3	349.434	3.092	20	30		EGEDHN
N#Cc1cc(CN[C@H]2CCC[C@H]2Oc2cc(F)cc(F)c2)ccn1	ZINC000586789073	459873698	/nfs/dbraw/zinc/87/36/98/459873698.db2.gz	DWBYGSUVTLQGNV-ZWKOTPCHSA-N	0	3	329.350	3.321	20	30		EGEDHN
CN(c1ccccc1)[C@H]1CCN(C(=O)C(C#N)CCc2ccccc2)C1	ZINC000598378048	459883452	/nfs/dbraw/zinc/88/34/52/459883452.db2.gz	FHOJNCNVVXOYTI-CTNGQTDRSA-N	0	3	347.462	3.496	20	30		EGEDHN
CC[C@H](C#N)C(=O)N(CCN1CCCC1)Cc1ccc(Cl)cc1	ZINC000593457490	459894337	/nfs/dbraw/zinc/89/43/37/459894337.db2.gz	MGDYBAINEMDOGV-MRXNPFEDSA-N	0	3	333.863	3.314	20	30		EGEDHN
CCC(C#N)C(=O)N[C@@H](CC(=O)OC)c1ccc(C(C)(C)C)cc1	ZINC000593481993	459902701	/nfs/dbraw/zinc/90/27/01/459902701.db2.gz	UXDUVOWTTPRPRF-CJNGLKHVSA-N	0	3	330.428	3.254	20	30		EGEDHN
COc1ccc([C@@H](CNC(=O)CCCCCC#N)N2CCCC2)cc1	ZINC000588146971	459919011	/nfs/dbraw/zinc/91/90/11/459919011.db2.gz	UYQKCMHIMAQDLD-LJQANCHMSA-N	0	3	343.471	3.422	20	30		EGEDHN
Cc1cc(CN[C@H](Cc2ccccc2)[C@H](O)C(F)(F)F)ccc1C#N	ZINC000618193478	459928094	/nfs/dbraw/zinc/92/80/94/459928094.db2.gz	ILDSIDUKMSDCEV-MSOLQXFVSA-N	0	3	348.368	3.491	20	30		EGEDHN
Cc1cc(CN[C@H](Cc2ccccc2)[C@@H](O)C(F)(F)F)ccc1C#N	ZINC000618193479	459928248	/nfs/dbraw/zinc/92/82/48/459928248.db2.gz	ILDSIDUKMSDCEV-QZTJIDSGSA-N	0	3	348.368	3.491	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](NC/C=C\c3ccc(F)cc3)C2=O)cc1	ZINC000588589312	459955383	/nfs/dbraw/zinc/95/53/83/459955383.db2.gz	SENJQGZAVHKDFF-KXFGNQBASA-N	0	3	349.409	3.101	20	30		EGEDHN
CCCN(C[C@@H](O)CC(C)(C)C#N)[C@@H](C)C(=O)Nc1ccccc1	ZINC000598594913	459956967	/nfs/dbraw/zinc/95/69/67/459956967.db2.gz	NVWGLVXFXKBCQY-RDJZCZTQSA-N	0	3	331.460	3.026	20	30		EGEDHN
CCC[C@H]1CN(C[C@@H](O)CC(C)(C)C#N)CCN1Cc1ccccc1	ZINC000598600877	459959439	/nfs/dbraw/zinc/95/94/39/459959439.db2.gz	HOVARKUQUCOPKW-PMACEKPBSA-N	0	3	343.515	3.274	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN[C@@H](CN1CCCCC1)c1ccccc1	ZINC000598604015	459960183	/nfs/dbraw/zinc/96/01/83/459960183.db2.gz	NNRGZTRPVSNLMI-OALUTQOASA-N	0	3	329.488	3.104	20	30		EGEDHN
CCCOc1ccc([C@@H](C)NC[C@@H](O)CC(C)(C)C#N)cc1OC	ZINC000598603659	459960758	/nfs/dbraw/zinc/96/07/58/459960758.db2.gz	YDNNXROTBAXMBK-ZBFHGGJFSA-N	0	3	334.460	3.435	20	30		EGEDHN
CCn1cc([C@H](C)NC2CCN(Cc3cccc(C#N)c3)CC2)cn1	ZINC000593719876	459962853	/nfs/dbraw/zinc/96/28/53/459962853.db2.gz	CXHYTUUHXGBRCA-INIZCTEOSA-N	0	3	337.471	3.090	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN[C@@H](CCO)c1cccc(C(F)(F)F)c1	ZINC000598618834	459965270	/nfs/dbraw/zinc/96/52/70/459965270.db2.gz	RMIQAMMTTBILFT-GJZGRUSLSA-N	0	3	344.377	3.019	20	30		EGEDHN
CO[C@H](CN1CC=C(c2ccc(C#N)cc2)CC1)C1CCOCC1	ZINC000602495832	459968272	/nfs/dbraw/zinc/96/82/72/459968272.db2.gz	XOPDIMICVRTPDB-HXUWFJFHSA-N	0	3	326.440	3.089	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CNCc1ccc(Br)cc1Cl	ZINC000598719827	460005283	/nfs/dbraw/zinc/00/52/83/460005283.db2.gz	JLGHCXLXRMRHGT-LBPRGKRZSA-N	0	3	345.668	3.493	20	30		EGEDHN
C[C@H](CCC#N)CN[C@H](c1ccc(Cl)cc1)[C@H]1CN(C)CCO1	ZINC000602579274	460005846	/nfs/dbraw/zinc/00/58/46/460005846.db2.gz	ISRPLZIFESTRGW-ZTFGCOKTSA-N	0	3	335.879	3.241	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CNCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1	ZINC000598724527	460007225	/nfs/dbraw/zinc/00/72/25/460007225.db2.gz	POGOPJRJWNFFSW-CYBMUJFWSA-N	0	3	345.321	3.004	20	30		EGEDHN
Cc1cccc(CNC[C@@H](O)CC(C)(C)C#N)c1Br	ZINC000598725661	460008048	/nfs/dbraw/zinc/00/80/48/460008048.db2.gz	YQVZLTIORQOXME-ZDUSSCGKSA-N	0	3	325.250	3.148	20	30		EGEDHN
Cc1ccc(CN[C@H](C)CC2(C#N)CCOCC2)c(N2CCCC2)n1	ZINC000602596700	460016364	/nfs/dbraw/zinc/01/63/64/460016364.db2.gz	MZDMNPIRMZFFRD-QGZVFWFLSA-N	0	3	342.487	3.179	20	30		EGEDHN
CC[C@]1(O)CCCN(Cc2cn(CCC#N)nc2-c2ccccc2)C1	ZINC000602738607	460099204	/nfs/dbraw/zinc/09/92/04/460099204.db2.gz	GFNYSZLLWPIBSJ-FQEVSTJZSA-N	0	3	338.455	3.201	20	30		EGEDHN
COc1cc([C@@H](C)NCc2ccc(C#N)cc2C)ccc1OCCO	ZINC000614407414	460132895	/nfs/dbraw/zinc/13/28/95/460132895.db2.gz	QEJJGVLKCZRNNW-OAHLLOKOSA-N	0	3	340.423	3.097	20	30		EGEDHN
CCN1CCN(c2ccc(F)cc2[C@@H](C)NCC2(CC#N)CC2)CC1	ZINC000602805024	460137573	/nfs/dbraw/zinc/13/75/73/460137573.db2.gz	JRWBVRGRZSMEJU-MRXNPFEDSA-N	0	3	344.478	3.312	20	30		EGEDHN
C[C@@H](NC(=O)N[C@@H](C)CN1CCC[C@@H](C)C1)c1cccc(C#N)c1	ZINC000610401125	460142317	/nfs/dbraw/zinc/14/23/17/460142317.db2.gz	SDJVEDRKCSUZLN-OWCLPIDISA-N	0	3	328.460	3.039	20	30		EGEDHN
N#Cc1ccc2c(c1)CC[C@H]2NCc1ccc(-n2cncn2)c(F)c1	ZINC000618743202	460152135	/nfs/dbraw/zinc/15/21/35/460152135.db2.gz	ZXUKHJMSTWUZRL-GOSISDBHSA-N	0	3	333.370	3.055	20	30		EGEDHN
CC[C@H](C)CN(C)c1ccc(F)cc1CNC1CCN(CC#N)CC1	ZINC000610511412	460170490	/nfs/dbraw/zinc/17/04/90/460170490.db2.gz	RPQCMWJXHRLZAO-INIZCTEOSA-N	0	3	346.494	3.386	20	30		EGEDHN
N#Cc1ccc(CN[C@H]([C@@H]2CCCO2)C2(CO)CCC2)c(Cl)c1	ZINC000602889870	460173051	/nfs/dbraw/zinc/17/30/51/460173051.db2.gz	FLOUXZVXFRUKCX-DLBZAZTESA-N	0	3	334.847	3.011	20	30		EGEDHN
CC(C)(C)OC(=O)CCN(Cc1ccccc1C#N)C1CCOCC1	ZINC000576700487	460196243	/nfs/dbraw/zinc/19/62/43/460196243.db2.gz	LHPFZDYQKISSPG-UHFFFAOYSA-N	0	3	344.455	3.271	20	30		EGEDHN
CN(Cc1cc(Cl)cc(Cl)c1)C(=O)[C@H](N)CCCCC#N	ZINC000594428670	460216169	/nfs/dbraw/zinc/21/61/69/460216169.db2.gz	NWJWMGUMJVZKHK-CQSZACIVSA-N	0	3	328.243	3.363	20	30		EGEDHN
N#CCCCC[C@H](N)C(=O)Nc1ccc(-n2cnc3ccccc32)cc1	ZINC000594441928	460221590	/nfs/dbraw/zinc/22/15/90/460221590.db2.gz	YSYJEAVZSHABRR-KRWDZBQOSA-N	0	3	347.422	3.375	20	30		EGEDHN
N#CCCCC[C@H](N)C(=O)NCC1(c2ccc(F)cc2Cl)CC1	ZINC000594446727	460223930	/nfs/dbraw/zinc/22/39/30/460223930.db2.gz	RZXULHROVLHHQI-HNNXBMFYSA-N	0	3	337.826	3.038	20	30		EGEDHN
C[C@H](NC1CCN(CC#N)CC1)c1ccc(F)cc1OC(F)F	ZINC000610813990	460242335	/nfs/dbraw/zinc/24/23/35/460242335.db2.gz	YEJQOVRBBDQBJL-NSHDSACASA-N	0	3	327.350	3.066	20	30		EGEDHN
CC[C@H]1CN(C(=O)C(C)C)CC[C@H]1NCc1ccc(C#N)cc1F	ZINC000610947062	460263823	/nfs/dbraw/zinc/26/38/23/460263823.db2.gz	BUIJQRNLRSYJGY-MAUKXSAKSA-N	0	3	331.435	3.070	20	30		EGEDHN
CC(C)[C@@H]1CN(C[C@H](O)CC(C)(C)C#N)CCN1Cc1ccccc1	ZINC000599549001	460272090	/nfs/dbraw/zinc/27/20/90/460272090.db2.gz	LWAABUGACXCQNP-UXHICEINSA-N	0	3	343.515	3.130	20	30		EGEDHN
COCc1cc(C#N)ccc1N1CCN(CCc2cccs2)CC1	ZINC000603280032	460276442	/nfs/dbraw/zinc/27/64/42/460276442.db2.gz	KTHWHQPSUZMWGT-UHFFFAOYSA-N	0	3	341.480	3.131	20	30		EGEDHN
C[C@@H]1CN(CCOc2ccc(C#N)cc2)CC[C@H]1C(=O)OC(C)(C)C	ZINC000599597327	460285041	/nfs/dbraw/zinc/28/50/41/460285041.db2.gz	SJKHIOIZHGQUHW-CRAIPNDOSA-N	0	3	344.455	3.237	20	30		EGEDHN
COCCOCc1cc(C#N)ccc1NC[C@@H]1CCCCN1C1CC1	ZINC000603363969	460291328	/nfs/dbraw/zinc/29/13/28/460291328.db2.gz	ZGLMYAUETPYYBU-IBGZPJMESA-N	0	3	343.471	3.150	20	30		EGEDHN
Cc1ccc(CN2CC[C@@H](CN(C)c3ccncc3C#N)C2)s1	ZINC000603400076	460297770	/nfs/dbraw/zinc/29/77/70/460297770.db2.gz	IXGSFAKINNSJQT-HNNXBMFYSA-N	0	3	326.469	3.282	20	30		EGEDHN
CSc1ccc(CNC2CCN(c3ccc(C#N)cn3)CC2)o1	ZINC000603421866	460302464	/nfs/dbraw/zinc/30/24/64/460302464.db2.gz	VYVKBKSWNLRPQB-UHFFFAOYSA-N	0	3	328.441	3.027	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCCCCc2ccccc2)cc1	ZINC000619273084	460320340	/nfs/dbraw/zinc/32/03/40/460320340.db2.gz	ORIYWNFKYFPLEP-HXUWFJFHSA-N	0	3	331.419	3.380	20	30		EGEDHN
CCCC(=O)NC1CCN(Cc2cccc(OCCCC#N)c2)CC1	ZINC000611261193	460320855	/nfs/dbraw/zinc/32/08/55/460320855.db2.gz	HRSDOBPEGGNMAA-UHFFFAOYSA-N	0	3	343.471	3.250	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN(C)C[C@H]1CCCO[C@H]1c1ccccc1	ZINC000622841093	460331618	/nfs/dbraw/zinc/33/16/18/460331618.db2.gz	BOUHFABZLTWBPN-CTNGQTDRSA-N	0	3	342.483	3.287	20	30		EGEDHN
Cc1nn(-c2ccccc2)c(CN2CC[C@@H](N3CCCCC3)C2)c1C#N	ZINC000611347184	460342296	/nfs/dbraw/zinc/34/22/96/460342296.db2.gz	MHGQZDREVFWPBD-LJQANCHMSA-N	0	3	349.482	3.113	20	30		EGEDHN
C[C@H](NC[C@@H](O)COc1cccc2[nH]ccc21)c1cccc(C#N)c1	ZINC000611388489	460351097	/nfs/dbraw/zinc/35/10/97/460351097.db2.gz	PFOWVNJZMNZGMN-WMLDXEAASA-N	0	3	335.407	3.130	20	30		EGEDHN
CCOc1ccc(OC[C@@H](O)CN[C@@H](C)c2cccc(C#N)c2)cc1	ZINC000611388968	460351228	/nfs/dbraw/zinc/35/12/28/460351228.db2.gz	OLXFECDRLKKEHG-YJBOKZPZSA-N	0	3	340.423	3.047	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2NCc1ccc(Cn2cncn2)cc1	ZINC000611390508	460352865	/nfs/dbraw/zinc/35/28/65/460352865.db2.gz	FKFBVKLLHOLEGZ-OAQYLSRUSA-N	0	3	343.434	3.365	20	30		EGEDHN
CC1CCC(N(CC(=O)NCc2ccc(C#N)cc2)C2CC2)CC1	ZINC000603895489	460355416	/nfs/dbraw/zinc/35/54/16/460355416.db2.gz	GGDNLQNNVSLIRX-UHFFFAOYSA-N	0	3	325.456	3.218	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCc3ccccc3[C@H]2CC)CC1	ZINC000603984944	460367661	/nfs/dbraw/zinc/36/76/61/460367661.db2.gz	TXUAYIMTNWWZLH-LJQANCHMSA-N	0	3	327.472	3.356	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)NC[C@@H]1Cc2ccccc21)C(C)C	ZINC000615681537	460373071	/nfs/dbraw/zinc/37/30/71/460373071.db2.gz	ALCPQEOOAHMQST-ICSRJNTNSA-N	0	3	341.499	3.324	20	30		EGEDHN
CC1CCN([C@@H](CNC(=O)NCC(C)(C)C#N)c2cccs2)CC1	ZINC000611622970	460417104	/nfs/dbraw/zinc/41/71/04/460417104.db2.gz	PWWZOAPYKOZNIZ-HNNXBMFYSA-N	0	3	348.516	3.370	20	30		EGEDHN
C=CCOc1ccc(C(F)(F)F)cc1C(=O)NCCN1CCCC1	ZINC000606829666	460744360	/nfs/dbraw/zinc/74/43/60/460744360.db2.gz	JNQFFFJILLVAFR-UHFFFAOYSA-N	0	3	342.361	3.096	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNc1cc(C(C)C)nc2ncnn21)C(C)C	ZINC000613413993	460937656	/nfs/dbraw/zinc/93/76/56/460937656.db2.gz	ATGQXUUIINVWQC-KRWDZBQOSA-N	0	3	342.491	3.358	20	30		EGEDHN
C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)CN(C)CC(C)(C)C	ZINC000635920653	460975859	/nfs/dbraw/zinc/97/58/59/460975859.db2.gz	CQRYIAAMAPIRFA-UHFFFAOYSA-N	0	3	334.508	3.347	20	30		EGEDHN
N#CC(C(=O)c1cccc(N2CCCC2)c1)c1nnc2n1CCCCC2	ZINC000659054237	461165497	/nfs/dbraw/zinc/16/54/97/461165497.db2.gz	XOHXMSRUMKTMLP-QGZVFWFLSA-N	0	3	349.438	3.095	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@H]2CCC[C@H]2Cc2ccccc2)CC1	ZINC000668369115	461257804	/nfs/dbraw/zinc/25/78/04/461257804.db2.gz	OQMGKMDLMCHBPJ-ICSRJNTNSA-N	0	3	326.484	3.412	20	30		EGEDHN
C=C[C@@H]1CCCCN1C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000666150364	461474785	/nfs/dbraw/zinc/47/47/85/461474785.db2.gz	NVJXLHXDYPLLKB-LJQANCHMSA-N	0	3	342.487	3.044	20	30		EGEDHN
C=CCN(C(=O)NC[C@@H](c1ccccc1)N1CCCC1)[C@@H](C)COC	ZINC000663400149	461620756	/nfs/dbraw/zinc/62/07/56/461620756.db2.gz	MUKUKELSPNACEW-HKUYNNGSSA-N	0	3	345.487	3.056	20	30		EGEDHN
C=CCCC(C)(C)NC(=O)NCc1cccc(OCCN(C)C)c1	ZINC000663585407	461712179	/nfs/dbraw/zinc/71/21/79/461712179.db2.gz	HXBJHRLNJTVRBA-UHFFFAOYSA-N	0	3	333.476	3.171	20	30		EGEDHN
C=CCN(C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1)[C@@H](C)COC	ZINC000663785801	461805685	/nfs/dbraw/zinc/80/56/85/461805685.db2.gz	ZNJVTBQNJAZTLM-JENIJYKNSA-N	0	3	345.487	3.054	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCC[C@H]([C@H]3CCCCO3)C2)CC1	ZINC000660597455	461871118	/nfs/dbraw/zinc/87/11/18/461871118.db2.gz	PKNQLVOKTVGGGY-PKOBYXMFSA-N	0	3	349.519	3.018	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2ccc3occc3c2)CC1	ZINC000660596547	461871746	/nfs/dbraw/zinc/87/17/46/461871746.db2.gz	FCZBBBKJYSFDJF-UHFFFAOYSA-N	0	3	327.428	3.273	20	30		EGEDHN
C=CCC1(NC(=O)NC2CCN(CCOC(C)C)CC2)CCCC1	ZINC000664304584	462012078	/nfs/dbraw/zinc/01/20/78/462012078.db2.gz	XTCIMQAYQYXNSR-UHFFFAOYSA-N	0	3	337.508	3.064	20	30		EGEDHN
C=CCCn1cc(CN[C@@H]2CCc3[nH]c4ccc(C)cc4c3C2)nn1	ZINC000657429705	462117321	/nfs/dbraw/zinc/11/73/21/462117321.db2.gz	IVLCWPXQBPJKBM-OAHLLOKOSA-N	0	3	335.455	3.291	20	30		EGEDHN
C=CCN(C[C@H](O)COc1ccc2ccccc2c1)[C@@H](C)COC	ZINC000661248126	462169766	/nfs/dbraw/zinc/16/97/66/462169766.db2.gz	SBUMSPACTYFGDU-LPHOPBHVSA-N	0	3	329.440	3.102	20	30		EGEDHN
C=CC[C@H]1CCCN(CC(=O)NCc2ccc(OC(F)F)cc2)C1	ZINC000661378430	462223197	/nfs/dbraw/zinc/22/31/97/462223197.db2.gz	GLHLPFLGZBJCNX-HNNXBMFYSA-N	0	3	338.398	3.192	20	30		EGEDHN
C=CC[C@H]1CCCN(CC(=O)N2CCO[C@@H](c3ccc(F)cc3)C2)C1	ZINC000661381279	462224889	/nfs/dbraw/zinc/22/48/89/462224889.db2.gz	ZBQBQXAFWXHUOT-QFBILLFUSA-N	0	3	346.446	3.014	20	30		EGEDHN
C=CC[C@H]1CCCN([C@H](C)C(=O)Nc2ccc(OC)c(OC)c2)C1	ZINC000661379967	462225337	/nfs/dbraw/zinc/22/53/37/462225337.db2.gz	KBYFYEVCJBGCOB-CABCVRRESA-N	0	3	332.444	3.319	20	30		EGEDHN
C=CCN(Cc1ccccc1)C(=O)N[C@@H]1CCCN2CCCC[C@H]12	ZINC000654726587	462354491	/nfs/dbraw/zinc/35/44/91/462354491.db2.gz	WRZYCKIUBNFLFR-RTBURBONSA-N	0	3	327.472	3.401	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)NC(=O)N(CCC)[C@H]1CCN(C)C1	ZINC000645550708	462370170	/nfs/dbraw/zinc/37/01/70/462370170.db2.gz	VIVKBQSXZZGWNG-OALUTQOASA-N	0	3	329.488	3.300	20	30		EGEDHN
C=CCN(Cc1ccccc1F)C(=O)NC1CCN(CC=C)CC1	ZINC000171737033	526361375	/nfs/dbraw/zinc/36/13/75/526361375.db2.gz	RDBDUBLDPLUUTN-UHFFFAOYSA-N	0	3	331.435	3.174	20	30		EGEDHN
C=CCN1CCC(NC(=O)C2(c3cccc(F)c3)CCCC2)CC1	ZINC000171719820	526419957	/nfs/dbraw/zinc/41/99/57/526419957.db2.gz	URZSQZKAZJQAQQ-UHFFFAOYSA-N	0	3	330.447	3.404	20	30		EGEDHN
C=CCN1CCC(NC(=O)Cc2ccc(Cl)cc2Cl)CC1	ZINC000171725259	526423540	/nfs/dbraw/zinc/42/35/40/526423540.db2.gz	ZSMIFPUHNRJJET-UHFFFAOYSA-N	0	3	327.255	3.303	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCCCC[C@@H]2c2ccncc2)CC1	ZINC000171738329	526425881	/nfs/dbraw/zinc/42/58/81/526425881.db2.gz	CTQYNQYQOINPIR-LJQANCHMSA-N	0	3	342.487	3.359	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(CCSC)cc2)CC1	ZINC000171640382	526441758	/nfs/dbraw/zinc/44/17/58/526441758.db2.gz	QDUXEOOJXJIIRW-UHFFFAOYSA-N	0	3	333.501	3.364	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H](C)c2cc3ccccc3s2)CC1	ZINC000171722825	526930619	/nfs/dbraw/zinc/93/06/19/526930619.db2.gz	RIIICLACSJVNFZ-CQSZACIVSA-N	0	3	326.465	3.424	20	30		EGEDHN
COCCOc1ncccc1C(=O)C(C#N)c1ccc2ccccc2n1	ZINC000093243614	546682123	/nfs/dbraw/zinc/68/21/23/546682123.db2.gz	STMRROPJFRTOPK-INIZCTEOSA-N	0	3	347.374	3.145	20	30		EGEDHN
COCCOc1ncccc1C(=O)C(C#N)c1ccc2ccccc2n1	ZINC000093243615	546682341	/nfs/dbraw/zinc/68/23/41/546682341.db2.gz	STMRROPJFRTOPK-MRXNPFEDSA-N	0	3	347.374	3.145	20	30		EGEDHN
O=C(COc1cccnc1)NCC1(N2CCSCC2)CCCCC1	ZINC000329230551	547492863	/nfs/dbraw/zinc/49/28/63/547492863.db2.gz	DOMRNNIMZBXVGV-UHFFFAOYSA-N	0	3	349.500	3.169	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNCc1nn(C)c2ccccc12)C(C)C	ZINC000674711221	548786726	/nfs/dbraw/zinc/78/67/26/548786726.db2.gz	WBAHDTROQVZCAL-FQEVSTJZSA-N	0	3	326.488	3.362	20	30		EGEDHN
Cn1c2cc(C(=O)C(C#N)c3ccc4ccccc4n3)ccc2[nH]c1=O	ZINC000676997859	549191033	/nfs/dbraw/zinc/19/10/33/549191033.db2.gz	IMRZQPMIUCMGCR-CQSZACIVSA-N	0	3	342.358	3.317	20	30		EGEDHN
Cn1cc(CNCc2ccc(C#N)cc2)c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000726606821	574563664	/nfs/dbraw/zinc/56/36/64/574563664.db2.gz	AVIRBRIZWLFWQB-UHFFFAOYSA-N	0	3	347.378	3.157	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CNC[C@@H](c2ccsc2)N(C)C)cc1	ZINC000728712895	574767765	/nfs/dbraw/zinc/76/77/65/574767765.db2.gz	CAZXIDCGUVRCLB-KDOFPFPSSA-N	0	3	329.469	3.431	20	30		EGEDHN
CC(=NNc1ccnc2ccccc21)c1cccc(OCCN(C)C)c1	ZINC000730146446	574925484	/nfs/dbraw/zinc/92/54/84/574925484.db2.gz	WPKHDEWNNOTHOJ-UHFFFAOYSA-N	0	3	348.450	3.433	20	30		EGEDHN
C=CCNC(=O)C(C#N)C(=O)[C@H]1C[C@H]1c1ccc(Cl)cc1Cl	ZINC000730686512	575010194	/nfs/dbraw/zinc/01/01/94/575010194.db2.gz	GUCXYRALMDEDGF-RWMBFGLXSA-N	0	3	337.206	3.108	20	30		EGEDHN
C#CCN(C(=O)NC[C@@H](C)N(C)Cc1ccccc1)C1CCCCC1	ZINC000732470031	575271407	/nfs/dbraw/zinc/27/14/07/575271407.db2.gz	QINQFINZWHCJIA-GOSISDBHSA-N	0	3	341.499	3.484	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1Cl)C(=O)[C@H]1COc2ccccc21	ZINC000733678886	575381294	/nfs/dbraw/zinc/38/12/94/575381294.db2.gz	NIVIWGPNSVUNEP-STQMWFEESA-N	0	3	340.766	3.164	20	30		EGEDHN
CCN(CC(=O)/C=C1\N(C)c2ccccc2C1(C)C)C[C@H]1CCOC1	ZINC000734149459	575442970	/nfs/dbraw/zinc/44/29/70/575442970.db2.gz	NEKQMZXNQDGIEO-SDLDRHLBSA-N	0	3	342.483	3.225	20	30		EGEDHN
C=CC[C@H](NC(=O)N[C@H](C)CN1CCC[C@H](C)C1)c1ccncc1	ZINC000734661781	575533569	/nfs/dbraw/zinc/53/35/69/575533569.db2.gz	QJKYHGINCKYMHW-JZXOWHBKSA-N	0	3	330.476	3.118	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@H](C)Cc1ccccc1F	ZINC000739143379	576379627	/nfs/dbraw/zinc/37/96/27/576379627.db2.gz	KDWCBDXFPKOUIP-ZBFHGGJFSA-N	0	3	332.419	3.410	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2ccc(OC)c3ccccc23)CC1	ZINC000740737076	576621772	/nfs/dbraw/zinc/62/17/72/576621772.db2.gz	ARVQUWPRXMJBFG-UHFFFAOYSA-N	0	3	336.435	3.066	20	30		EGEDHN
C#CCOc1ccc(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1	ZINC000741662514	576709344	/nfs/dbraw/zinc/70/93/44/576709344.db2.gz	PCSGQTAYXTWSAV-NRFANRHFSA-N	0	3	348.446	3.266	20	30		EGEDHN
C#CCOc1cc(F)ccc1NC(=O)NC[C@H](C)N1CCC[C@H](C)C1	ZINC000743195587	576803024	/nfs/dbraw/zinc/80/30/24/576803024.db2.gz	YJZGJLCWCNGYAN-GJZGRUSLSA-N	0	3	347.434	3.080	20	30		EGEDHN
C[C@@H](C(=O)C(C#N)C(=O)Nc1ccccn1)c1cccc(Cl)c1	ZINC000744039384	576819343	/nfs/dbraw/zinc/81/93/43/576819343.db2.gz	OGIPDKUNBOFVRF-RISCZKNCSA-N	0	3	327.771	3.186	20	30		EGEDHN
N#Cc1c2[nH]c3ccccc3n2c(=O)cc1CN1CCC[C@@H]2CCC[C@@H]21	ZINC000744408629	576827576	/nfs/dbraw/zinc/82/75/76/576827576.db2.gz	AWLQJXDNHLBDLB-LESCRADOSA-N	0	3	346.434	3.488	20	30		EGEDHN
C[C@@H]1CN(CC(=O)C(C#N)c2nc3ccccc3s2)C[C@H](C)S1	ZINC000744413029	576827684	/nfs/dbraw/zinc/82/76/84/576827684.db2.gz	MCMBGQCUAWFDKS-XQQFMLRXSA-N	0	3	345.493	3.298	20	30		EGEDHN
C[C@H](CC(=O)C(C#N)c1nc2ccccc2o1)NC(=O)c1ccccc1	ZINC000041542782	1291418336	/nfs/dbraw/zinc/41/83/36/1291418336.db2.gz	OTBNVGKFKGQANB-HIFRSBDPSA-N	0	3	347.374	3.213	20	30		EGEDHN
N#CC(C(=O)CCc1cc(F)ccc1F)C(=O)NC1CCCCC1	ZINC000066507674	1292119577	/nfs/dbraw/zinc/11/95/77/1292119577.db2.gz	XQNJHCGSQGRNCP-OAHLLOKOSA-N	0	3	334.366	3.055	20	30		EGEDHN
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)c1ccc(C#N)[nH]1	ZINC000830975273	1292793737	/nfs/dbraw/zinc/79/37/37/1292793737.db2.gz	UMVRUDQBOSSSFO-GOSISDBHSA-N	0	3	336.439	3.013	20	30		EGEDHN
CN(Cc1ccc(C#N)c(F)c1)C1CC(NC(=O)OC(C)(C)C)C1	ZINC000831243413	1292831808	/nfs/dbraw/zinc/83/18/08/1292831808.db2.gz	MAQPLKDNWOCPQI-UHFFFAOYSA-N	0	3	333.407	3.185	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)CO[C@H]2CCC[C@H](C)C2)c1	ZINC000112758920	1293132896	/nfs/dbraw/zinc/13/28/96/1293132896.db2.gz	INSSIBAEPIYPRB-BHYGNILZSA-N	0	3	328.412	3.238	20	30		EGEDHN
N#CC(C(=O)CCCC(=O)C1CC1)C(=O)Nc1ccc(Cl)cc1	ZINC000835059894	1293196044	/nfs/dbraw/zinc/19/60/44/1293196044.db2.gz	GAKDPASNNPCFKM-AWEZNQCLSA-N	0	3	332.787	3.137	20	30		EGEDHN
CC(=O)N[C@H](C(=O)C(C#N)c1ncc(C(C)(C)C)s1)C(C)(C)C	ZINC000835387179	1293279883	/nfs/dbraw/zinc/27/98/83/1293279883.db2.gz	FMFULFWHDKRFTE-SMDDNHRTSA-N	0	3	335.473	3.168	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/C[C@@H](C(C)C)N2CCOCC2)c([O-])c1	ZINC000119812801	1293289785	/nfs/dbraw/zinc/28/97/85/1293289785.db2.gz	CLAJOFZVGMBMJE-ORTNRGLGSA-N	0	3	347.503	3.014	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)CCC(C)(C)C)cc1OC	ZINC000121749930	1293387286	/nfs/dbraw/zinc/38/72/86/1293387286.db2.gz	UKMUMISCZIKSHL-ZDUSSCGKSA-N	0	3	332.400	3.177	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)[C@H](C)Cc1ccc(C(F)(F)F)cc1	ZINC000121771445	1293388933	/nfs/dbraw/zinc/38/89/33/1293388933.db2.gz	MJBMAOPWIPHVFL-RISCZKNCSA-N	0	3	340.345	3.117	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)[C@@H](C)Cc1cccc(C(F)(F)F)c1	ZINC000121770505	1293389319	/nfs/dbraw/zinc/38/93/19/1293389319.db2.gz	GJQUWUCPJDGMQE-FZMZJTMJSA-N	0	3	340.345	3.117	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)CCCc1nc(C2CC2)no1	ZINC000123803920	1293456564	/nfs/dbraw/zinc/45/65/64/1293456564.db2.gz	DIESRURDZXSONF-ZDUSSCGKSA-N	0	3	349.394	3.033	20	30		EGEDHN
C[C@@H](Oc1cccc(C(C)(C)C)c1)C(=O)C(C#N)C(=O)N1CCCC1	ZINC000124839329	1293486851	/nfs/dbraw/zinc/48/68/51/1293486851.db2.gz	XMIULMXVPUWOLY-RHSMWYFYSA-N	0	3	342.439	3.083	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H](O)c1cccc(Br)c1	ZINC000125249542	1293501322	/nfs/dbraw/zinc/50/13/22/1293501322.db2.gz	QBHWBHAXAZUIHJ-KRWDZBQOSA-N	0	3	345.240	3.486	20	30		EGEDHN
N#CC(C(=O)C=Cc1nc2ccccc2s1)C(=O)Nc1ccccn1	ZINC000126415193	1293533567	/nfs/dbraw/zinc/53/35/67/1293533567.db2.gz	GKRUUAVTQSIGQN-BCPZQOPPSA-N	0	3	348.387	3.052	20	30		EGEDHN
N#CC(C(=O)CCCOc1ccc(F)cc1)C(=O)Nc1ccccc1	ZINC000128162623	1293584416	/nfs/dbraw/zinc/58/44/16/1293584416.db2.gz	WPQAGSCUPMFKGR-QGZVFWFLSA-N	0	3	340.354	3.332	20	30		EGEDHN
Cc1ccsc1[C@@H]1C[C@@H]1C(=O)C(C#N)C(=O)NC1CCCCC1	ZINC000129412460	1293623356	/nfs/dbraw/zinc/62/33/56/1293623356.db2.gz	LPAHDRRIQSSJMW-RRFJBIMHSA-N	0	3	330.453	3.318	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)C[C@H](C)c1ccc(F)cc1F	ZINC000152188610	1293958029	/nfs/dbraw/zinc/95/80/29/1293958029.db2.gz	DPUKPFZPNHEADL-WFASDCNBSA-N	0	3	336.382	3.474	20	30		EGEDHN
C#Cc1cccc(NC(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)c1	ZINC000160348353	1294265498	/nfs/dbraw/zinc/26/54/98/1294265498.db2.gz	GICTXTZJPKIALU-UZLBHIALSA-N	0	3	333.435	3.452	20	30		EGEDHN
N#CC(C(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)[C@H]1CCCOC1	ZINC000171037127	1294391616	/nfs/dbraw/zinc/39/16/16/1294391616.db2.gz	ZDJOHBUIQFYFES-ZANVPECISA-N	0	3	341.194	3.067	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(Cl)cc1Cl)C(=O)[C@H]1CCCOC1	ZINC000171036699	1294392051	/nfs/dbraw/zinc/39/20/51/1294392051.db2.gz	RQAKUCCKIHXMHH-GXSJLCMTSA-N	0	3	341.194	3.067	20	30		EGEDHN
N#CC(C(=O)CCNC(=O)c1ccc2ccccc2c1)c1ccccn1	ZINC000193252190	1295846666	/nfs/dbraw/zinc/84/66/66/1295846666.db2.gz	LBCVFUMALIPDDQ-GOSISDBHSA-N	0	3	343.386	3.231	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@H](C)Sc1ccc(OC)cc1	ZINC000193382777	1295859651	/nfs/dbraw/zinc/85/96/51/1295859651.db2.gz	AIERGJONNIXDRP-XJKSGUPXSA-N	0	3	348.468	3.191	20	30		EGEDHN
N#CC(C(=O)C[C@H]1CCCO1)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000193467775	1295872969	/nfs/dbraw/zinc/87/29/69/1295872969.db2.gz	KFUSBVHQZPEOIL-MNOVXSKESA-N	0	3	341.194	3.210	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CNCc2ccc3c(c2)OCCCO3)cc1	ZINC000237600186	1296252214	/nfs/dbraw/zinc/25/22/14/1296252214.db2.gz	MIBMLUMGEBGHFU-OAHLLOKOSA-N	0	3	338.407	3.429	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)CC[C@@H]1CC[C@@H](C)O1	ZINC000246528486	1296358688	/nfs/dbraw/zinc/35/86/88/1296358688.db2.gz	IMEPSPWGLMLFDL-QLFBSQMISA-N	0	3	344.411	3.080	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN1CCC[C@@H]1C[C@@H](O)c1ccc(F)cc1	ZINC000246816318	1296370853	/nfs/dbraw/zinc/37/08/53/1296370853.db2.gz	NNGRBEFWNVIYAL-RTBURBONSA-N	0	3	348.462	3.138	20	30		EGEDHN
CCO[C@@H]1C[C@@H]1C(=O)C(C#N)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000249739396	1296451483	/nfs/dbraw/zinc/45/14/83/1296451483.db2.gz	XGSSOMZOYOMXGV-RWMBFGLXSA-N	0	3	341.194	3.066	20	30		EGEDHN
C[C@H](CNC(=O)/C=C\c1ccccc1C#N)N(C)Cc1ccccc1	ZINC000255125600	1296501538	/nfs/dbraw/zinc/50/15/38/1296501538.db2.gz	HKTMYVYMTBFSPV-MUSGIIIZSA-N	0	3	333.435	3.208	20	30		EGEDHN
C[C@@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1ccc2[nH]c(=O)[nH]c2c1	ZINC000327355978	1297247540	/nfs/dbraw/zinc/24/75/40/1297247540.db2.gz	GNTFEMAZEJVMGA-QWHCGFSZSA-N	0	3	336.395	3.170	20	30		EGEDHN
Cn1c(=O)cc(C(=O)C(C#N)c2nc3ccccc3o2)c2ccccc21	ZINC000340037407	1297309231	/nfs/dbraw/zinc/30/92/31/1297309231.db2.gz	JOOXAECSHOZTRW-CQSZACIVSA-N	0	3	343.342	3.170	20	30		EGEDHN
C=CCOc1cc(OC)ccc1-c1nc([C@H]2CN3CCC2CC3)no1	ZINC000350067424	1297389877	/nfs/dbraw/zinc/38/98/77/1297389877.db2.gz	OURRLEWABISTGB-INIZCTEOSA-N	0	3	341.411	3.119	20	30		EGEDHN
C#C[C@H](NCc1cc(Br)c2c(c1)OCCCO2)C(C)C	ZINC000379670085	1297538262	/nfs/dbraw/zinc/53/82/62/1297538262.db2.gz	FYPRJOQOPUURRI-AWEZNQCLSA-N	0	3	338.245	3.358	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)C2CCC=CCC2)cc1OC	ZINC000873497020	1297543024	/nfs/dbraw/zinc/54/30/24/1297543024.db2.gz	BSYBKVMANCPFAK-HNNXBMFYSA-N	0	3	342.395	3.098	20	30		EGEDHN
CC[C@H](Cc1cccc(C)c1)C(=O)C(C#N)C(=O)NC1CCCC1	ZINC000873498930	1297544432	/nfs/dbraw/zinc/54/44/32/1297544432.db2.gz	UUULPQWFRHBMJN-AEFFLSMTSA-N	0	3	326.440	3.331	20	30		EGEDHN
CC[C@H](Cc1cccc(C)c1)C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000873499092	1297544510	/nfs/dbraw/zinc/54/45/10/1297544510.db2.gz	KVVUSGTVQBMHEW-SJORKVTESA-N	0	3	335.407	3.306	20	30		EGEDHN
CC1(C)CN(C[C@H](O)c2cccc(C#N)c2)CCN1Cc1ccccc1	ZINC000402409561	1297745317	/nfs/dbraw/zinc/74/53/17/1297745317.db2.gz	XZWZKCLLFBLFRQ-NRFANRHFSA-N	0	3	349.478	3.188	20	30		EGEDHN
C[C@@H]1CCN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(C#N)cc1	ZINC000716261126	1298296266	/nfs/dbraw/zinc/29/62/66/1298296266.db2.gz	DFZAYRMMBFUDAG-OXQOHEQNSA-N	0	3	333.435	3.199	20	30		EGEDHN
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)C1(C#N)CCC1	ZINC000719961872	1298324653	/nfs/dbraw/zinc/32/46/53/1298324653.db2.gz	KDFJLFPLFHZWLO-GOSISDBHSA-N	0	3	325.456	3.193	20	30		EGEDHN
COc1cccc([O-])c1C[NH2+]CCSCc1ccccc1C#N	ZINC000725847969	1298374715	/nfs/dbraw/zinc/37/47/15/1298374715.db2.gz	KXFSSIYKCBPAFV-UHFFFAOYSA-N	0	3	328.437	3.295	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cc(-c3cccc(Cl)c3)[nH]n2)CC1	ZINC000747876461	1298877515	/nfs/dbraw/zinc/87/75/15/1298877515.db2.gz	IIZGMAWFFQITGA-UHFFFAOYSA-N	0	3	342.830	3.014	20	30		EGEDHN
CC(C)C[C@](C)(CNC(=O)OC(C)(C)C)NCc1cccc(C#N)n1	ZINC000877149288	1299184382	/nfs/dbraw/zinc/18/43/82/1299184382.db2.gz	KJVMHHDPCUECJS-LJQANCHMSA-N	0	3	346.475	3.372	20	30		EGEDHN
Cc1noc(C)c1[C@@H](C)C(=O)C(C#N)C(=O)Nc1ccccc1Cl	ZINC000750391350	1299387773	/nfs/dbraw/zinc/38/77/73/1299387773.db2.gz	GFVJKBDYTFIOQW-BXKDBHETSA-N	0	3	345.786	3.396	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)OC(C)(C)C)CN1CCc1ccc(C#N)cc1	ZINC000879221636	1300433861	/nfs/dbraw/zinc/43/38/61/1300433861.db2.gz	CWQJBMCSBUXHJZ-YOEHRIQHSA-N	0	3	329.444	3.088	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)cc1	ZINC000758200910	1300809232	/nfs/dbraw/zinc/80/92/32/1300809232.db2.gz	FXSAARNELMUZOZ-PXNSSMCTSA-N	0	3	348.446	3.091	20	30		EGEDHN
CN(C)CCN(Cc1ccco1)C(=O)Nc1cc(C#N)c(F)cc1F	ZINC000880714030	1301238324	/nfs/dbraw/zinc/23/83/24/1301238324.db2.gz	FVNOWVLESYNTEA-UHFFFAOYSA-N	0	3	348.353	3.025	20	30		EGEDHN
C(=NNCc1cnc2ccccc2c1)c1ccc(N2CCOCC2)cc1	ZINC000764778268	1302133811	/nfs/dbraw/zinc/13/38/11/1302133811.db2.gz	IVBQRNKGYIMXQH-UHFFFAOYSA-N	0	3	346.434	3.195	20	30		EGEDHN
C#CCCCN[C@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1	ZINC000766726772	1302507130	/nfs/dbraw/zinc/50/71/30/1302507130.db2.gz	AEKVARHNDWWIBR-LJQANCHMSA-N	0	3	345.439	3.322	20	30		EGEDHN
CC(C)N1CCN(c2cccc(N=Cc3cccc(O)c3O)c2)CC1	ZINC000767880382	1302777610	/nfs/dbraw/zinc/77/76/10/1302777610.db2.gz	ZEOAZMQTYBOYBU-UHFFFAOYSA-N	0	3	339.439	3.379	20	30		EGEDHN
C#CCN[C@H](C(=O)N1CCC(Cc2ccccc2)CC1)[C@@H](C)CC	ZINC000775384140	1303952112	/nfs/dbraw/zinc/95/21/12/1303952112.db2.gz	CSTINESBQGQSEJ-PXNSSMCTSA-N	0	3	326.484	3.105	20	30		EGEDHN
N#CCC[C@@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1	ZINC000775553379	1303983557	/nfs/dbraw/zinc/98/35/57/1303983557.db2.gz	NQLHVEQMHWDZMU-MSOLQXFVSA-N	0	3	325.368	3.263	20	30		EGEDHN
N#CC(C(=O)NC1CCCC1)C(=O)[C@H]1CCc2c1cccc2Cl	ZINC000776079457	1304091604	/nfs/dbraw/zinc/09/16/04/1304091604.db2.gz	DEEOWESMRIMCFZ-LSDHHAIUSA-N	0	3	330.815	3.137	20	30		EGEDHN
Cc1ccc(NC(=S)NN=Cc2cnccc2N(C)C)cc1C	ZINC000776183868	1304108353	/nfs/dbraw/zinc/10/83/53/1304108353.db2.gz	QUJNYRVLFTUPTP-UHFFFAOYSA-N	0	3	327.457	3.085	20	30		EGEDHN
N#CCc1ccccc1CC(=O)N(CCN1CCCC1)c1ccccc1	ZINC000776951590	1304222278	/nfs/dbraw/zinc/22/22/78/1304222278.db2.gz	LFPBZBOYDGUCAE-UHFFFAOYSA-N	0	3	347.462	3.424	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CNC[C@H](CO)Cc1ccccc1	ZINC000778160899	1304407277	/nfs/dbraw/zinc/40/72/77/1304407277.db2.gz	YWCWFNVVFPHLPH-QGZVFWFLSA-N	0	3	343.854	3.293	20	30		EGEDHN
C#CCCCCCC(=O)Nc1cccc(CN2CCC(CO)CC2)c1	ZINC000780968109	1304756118	/nfs/dbraw/zinc/75/61/18/1304756118.db2.gz	BUZMTQNFWZBRQL-UHFFFAOYSA-N	0	3	342.483	3.413	20	30		EGEDHN
C#CCOc1ccc(CN[C@@H]2CCCN(C3CCCCC3)C2=O)cc1	ZINC000785549105	1305376698	/nfs/dbraw/zinc/37/66/98/1305376698.db2.gz	RZJBNUVLFLJPLI-HXUWFJFHSA-N	0	3	340.467	3.112	20	30		EGEDHN
C#C[C@H](NC1CC(c2ccc(Br)cc2)C1)[C@H]1CCCO1	ZINC000786921320	1305658722	/nfs/dbraw/zinc/65/87/22/1305658722.db2.gz	XNQFSWLJGZLRJG-MHVXSEJMSA-N	0	3	334.257	3.466	20	30		EGEDHN
CCCCSCC(=O)C(C#N)C(=O)N[C@H](CC)c1ccccc1	ZINC000787044575	1305683366	/nfs/dbraw/zinc/68/33/66/1305683366.db2.gz	GHHPVKBRMQVMPF-HZPDHXFCSA-N	0	3	332.469	3.496	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)Cc1cc(F)c(F)cc1F	ZINC000793126250	1309300632	/nfs/dbraw/zinc/30/06/32/1309300632.db2.gz	VIRPQQOLCORZJX-GFCCVEGCSA-N	0	3	340.345	3.052	20	30		EGEDHN
C(=NN[C@@H]1CCCOC1)c1ccc2c(c1)CCN2Cc1ccccc1	ZINC000794933141	1309624804	/nfs/dbraw/zinc/62/48/04/1309624804.db2.gz	OSZBEYWEYMCNIL-HXUWFJFHSA-N	0	3	335.451	3.352	20	30		EGEDHN
C[C@H](NCc1ccc(C[S@](C)=O)cc1)c1ccc(OCC#N)cc1	ZINC000797135640	1310145567	/nfs/dbraw/zinc/14/55/67/1310145567.db2.gz	YKORLIXQRSHUIE-OWJWWREXSA-N	0	3	342.464	3.318	20	30		EGEDHN
C[C@H](NC(=O)C(C)(C)C)C(=O)C(C#N)c1ncc(C(C)(C)C)s1	ZINC000797571482	1310214065	/nfs/dbraw/zinc/21/40/65/1310214065.db2.gz	RZLGPEWVIXJUHT-QWRGUYRKSA-N	0	3	335.473	3.168	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)[C@H]1CCCC(F)(F)C1	ZINC000800386488	1310747491	/nfs/dbraw/zinc/74/74/91/1310747491.db2.gz	KTIDHGVSKLUYPT-RYUDHWBXSA-N	0	3	336.338	3.168	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccsc2C(F)(F)F)C1	ZINC001023721100	1319856634	/nfs/dbraw/zinc/85/66/34/1319856634.db2.gz	BBZZGCZPVSVBAS-LBPRGKRZSA-N	0	3	344.402	3.232	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc(OC3CCC3)cc2)C1	ZINC001023760418	1319905256	/nfs/dbraw/zinc/90/52/56/1319905256.db2.gz	VUFYRAQFLZWDRK-KRWDZBQOSA-N	0	3	340.467	3.083	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3sc(C)nc3C)C2)CC1	ZINC001019331241	1317172141	/nfs/dbraw/zinc/17/21/41/1317172141.db2.gz	OWQZPUQFXRGABH-INIZCTEOSA-N	0	3	333.501	3.197	20	30		EGEDHN
CN(CCCN(C)c1ccc([N+](=O)[O-])cc1C#N)Cc1ccco1	ZINC000804841213	1317292651	/nfs/dbraw/zinc/29/26/51/1317292651.db2.gz	RFHBYZIWLYJBSA-UHFFFAOYSA-N	0	3	328.372	3.018	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@H](NCc2ccc(F)c(C#N)c2)C1)C1CCCC1	ZINC001019632231	1317311332	/nfs/dbraw/zinc/31/13/32/1317311332.db2.gz	FNJNGYWOCDZVPH-KSSFIOAISA-N	0	3	343.446	3.214	20	30		EGEDHN
O=C(C(F)F)N1CCC2(CCN(CC#Cc3ccccc3)CC2)CC1	ZINC000957484088	1317392850	/nfs/dbraw/zinc/39/28/50/1317392850.db2.gz	BJFUITUIVVSHSE-UHFFFAOYSA-N	0	3	346.421	3.008	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)C34CCC(CC3)CC4)C2)s1	ZINC001019802542	1317429655	/nfs/dbraw/zinc/42/96/55/1317429655.db2.gz	FXTTXQPDCBPKFT-HVEKOLDVSA-N	0	3	343.496	3.281	20	30		EGEDHN
CC1=CC[C@](C)(C(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)CC1	ZINC001019803838	1317432060	/nfs/dbraw/zinc/43/20/60/1317432060.db2.gz	RDTCYZDDHLZPHP-KXBFYZLASA-N	0	3	343.496	3.447	20	30		EGEDHN
COc1cccc(CN2CCC(NC(=O)CCCCCC#N)CC2)c1	ZINC000806534178	1317498341	/nfs/dbraw/zinc/49/83/41/1317498341.db2.gz	VLBZJGGVKNEDBZ-UHFFFAOYSA-N	0	3	343.471	3.250	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C2CCCCCC2)C1	ZINC001020022150	1317504767	/nfs/dbraw/zinc/50/47/67/1317504767.db2.gz	TYIQPPIFFFCEAU-HDJSIYSDSA-N	0	3	329.282	3.102	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1C[C@H](NCc2sccc2Cl)C1	ZINC001020239846	1317605016	/nfs/dbraw/zinc/60/50/16/1317605016.db2.gz	KDFWQOPJPDWBJT-JOCQHMNTSA-N	0	3	349.887	3.440	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)C2(c3cccc(C)c3)CCC2)C1	ZINC001020452056	1317703525	/nfs/dbraw/zinc/70/35/25/1317703525.db2.gz	QTDJITLQDSQVQV-QAQDUYKDSA-N	0	3	332.875	3.406	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc3cc(Cl)ccc3[nH]2)C1	ZINC001020455475	1317705081	/nfs/dbraw/zinc/70/50/81/1317705081.db2.gz	RKVQXVQMDIEOJR-JOCQHMNTSA-N	0	3	338.238	3.424	20	30		EGEDHN
C[C@@H]1CCC[C@H](C(=O)N[C@H]2C[C@H](NCc3ccc(C#N)cc3F)C2)C1	ZINC001020524704	1317744459	/nfs/dbraw/zinc/74/44/59/1317744459.db2.gz	XTUJOHJKBMSYQP-AETAKHFUSA-N	0	3	343.446	3.260	20	30		EGEDHN
CCOc1c(Cl)cc(/C=C2/C(=O)c3ncnn3C2C)cc1OC	ZINC000905079319	1317920753	/nfs/dbraw/zinc/92/07/53/1317920753.db2.gz	ATDBDKDGUUZLMM-JTTRITNRSA-N	0	3	333.775	3.180	20	30		EGEDHN
Cc1nn(-c2ccccc2C)c(C)c1/C=C1/C(=O)c2ncnn2C1C	ZINC000905083554	1317921967	/nfs/dbraw/zinc/92/19/67/1317921967.db2.gz	FGXRELJHWGREMQ-BRYYZUPOSA-N	0	3	333.395	3.230	20	30		EGEDHN
C[C@H]1CN(CC(=O)C(C#N)c2nc3ccccc3s2)CCC1(F)F	ZINC000810045876	1317943378	/nfs/dbraw/zinc/94/33/78/1317943378.db2.gz	IZLIQQVETSNIBQ-NWDGAFQWSA-N	0	3	349.406	3.450	20	30		EGEDHN
C#CC[C@H](CCOC)NCc1ccc(Br)c(F)c1F	ZINC000858334264	1328739280	/nfs/dbraw/zinc/73/92/80/1328739280.db2.gz	KRYOIGDIAHPRIA-LLVKDONJSA-N	0	3	332.188	3.245	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2sc(C(C)(C)C)nc2C)C1	ZINC001021136514	1318109506	/nfs/dbraw/zinc/10/95/06/1318109506.db2.gz	GZJGDGJXXMLFDZ-HAQNSBGRSA-N	0	3	341.908	3.352	20	30		EGEDHN
N#Cc1ccc(CN2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)[C@H]2CCCC3(CC3)C2)cc1	ZINC000959874063	1318243574	/nfs/dbraw/zinc/24/35/74/1318243574.db2.gz	RSSNUHCIXDCMJO-VNTMZGSJSA-N	0	3	349.478	3.075	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)/C=C/C2CC2)c(F)c1	ZINC000959938081	1318274857	/nfs/dbraw/zinc/27/48/57/1318274857.db2.gz	QOAKQHYDRXCZGA-KOEDOTQGSA-N	0	3	341.430	3.134	20	30		EGEDHN
CC1(CC(=O)N2CCCC[C@H]2CNCc2ccc(C#N)cc2F)CC1	ZINC000960066771	1318338242	/nfs/dbraw/zinc/33/82/42/1318338242.db2.gz	LRPXJDURZQHPOF-KRWDZBQOSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=CCCC(=O)[C@H]1CCCN1C(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000908658622	1318383122	/nfs/dbraw/zinc/38/31/22/1318383122.db2.gz	FTHIELLFAKZYQC-RBUKOAKNSA-N	0	3	340.467	3.035	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@H](CCCN3C(=O)C3=CCCC3)C2)c1	ZINC001021564226	1318414064	/nfs/dbraw/zinc/41/40/64/1318414064.db2.gz	XOHYOUXMQVIXHE-RTWAWAEBSA-N	0	3	349.478	3.481	20	30		EGEDHN
Cc1c[nH]cc1C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)s1	ZINC000960213605	1318414424	/nfs/dbraw/zinc/41/44/24/1318414424.db2.gz	MSIWQRGZMQTFAV-AWEZNQCLSA-N	0	3	342.468	3.041	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccnn1[C@@H](C)CC	ZINC000960272465	1318437492	/nfs/dbraw/zinc/43/74/92/1318437492.db2.gz	XQCKBUUGOKHXDQ-POZUXBRTSA-N	0	3	338.455	3.026	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccccc1OCC=C	ZINC000960274976	1318439044	/nfs/dbraw/zinc/43/90/44/1318439044.db2.gz	IRRLXEJGRONASB-TZIWHRDSSA-N	0	3	348.446	3.423	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc2ncccc2o1	ZINC000960286594	1318445941	/nfs/dbraw/zinc/44/59/41/1318445941.db2.gz	BUPVCLLKFWWICX-YLJYHZDGSA-N	0	3	347.418	3.389	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc2c(c1)CCO2	ZINC000960309577	1318454064	/nfs/dbraw/zinc/45/40/64/1318454064.db2.gz	VXHUUKXEWRRXSV-TZIWHRDSSA-N	0	3	348.446	3.183	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc(N(C)CC)cc1	ZINC000960333880	1318467152	/nfs/dbraw/zinc/46/71/52/1318467152.db2.gz	PPQZAGKXCRBARH-NHCUHLMSSA-N	0	3	349.478	3.314	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc(C)n(C)c1C	ZINC000960335771	1318469119	/nfs/dbraw/zinc/46/91/19/1318469119.db2.gz	ZEZJCISNAYQEHC-WOJBJXKFSA-N	0	3	337.467	3.203	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)CCc2ccc(F)cc2)C1	ZINC001021621502	1318470771	/nfs/dbraw/zinc/47/07/71/1318470771.db2.gz	BNLPONLBCGGSHF-QUCCMNQESA-N	0	3	342.458	3.095	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2c(C)oc(C)c2C)C1	ZINC001021625845	1318477416	/nfs/dbraw/zinc/47/74/16/1318477416.db2.gz	AZOANHOTWCKDPF-MSOLQXFVSA-N	0	3	328.456	3.155	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(Cl)ccc2F)C1	ZINC001021627299	1318479212	/nfs/dbraw/zinc/47/92/12/1318479212.db2.gz	NHBYKGYIGPAALY-KDOFPFPSSA-N	0	3	348.849	3.429	20	30		EGEDHN
N#CCCCC(=O)C(C#N)C(=O)Nc1ccc(SC(F)F)cc1	ZINC000813059892	1318492614	/nfs/dbraw/zinc/49/26/14/1318492614.db2.gz	KLLLXIGRGHHAIY-LBPRGKRZSA-N	0	3	337.351	3.343	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccn(C(C)C)c2C)C1	ZINC001021656261	1318519133	/nfs/dbraw/zinc/51/91/33/1318519133.db2.gz	SQKFARHNNYLPNB-AZUAARDMSA-N	0	3	341.499	3.327	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc3occc3s2)C1	ZINC001021667057	1318529986	/nfs/dbraw/zinc/52/99/86/1318529986.db2.gz	FSUHUDUBSJQOQX-CABCVRRESA-N	0	3	342.464	3.444	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(C)c(F)c2F)C1	ZINC001021673109	1318536395	/nfs/dbraw/zinc/53/63/95/1318536395.db2.gz	GEBPEQOKKPXKRL-DOTOQJQBSA-N	0	3	346.421	3.223	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)Cc2ccc(CC)cc2)C1	ZINC001021674300	1318540426	/nfs/dbraw/zinc/54/04/26/1318540426.db2.gz	AKMKCSSGVVAVJW-RTWAWAEBSA-N	0	3	338.495	3.128	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(F)cc(Cl)c2)C1	ZINC001021678586	1318547953	/nfs/dbraw/zinc/54/79/53/1318547953.db2.gz	YYJZABUYPNMDRG-GUYCJALGSA-N	0	3	334.822	3.039	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cccc(OCC)c2)C1	ZINC001021679368	1318549812	/nfs/dbraw/zinc/54/98/12/1318549812.db2.gz	NQVBQJBAMYDXPV-AZUAARDMSA-N	0	3	340.467	3.035	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(C(CC)CC)no2)C1	ZINC001021686392	1318560393	/nfs/dbraw/zinc/56/03/93/1318560393.db2.gz	YIMUQKMOBFUMRQ-SJLPKXTDSA-N	0	3	343.471	3.138	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cccn2C2CCCC2)C1	ZINC001021691418	1318565530	/nfs/dbraw/zinc/56/55/30/1318565530.db2.gz	AOCAPBXUUWPRBU-HKUYNNGSSA-N	0	3	339.483	3.163	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(C)c(CC)o2)C1	ZINC001021709579	1318586448	/nfs/dbraw/zinc/58/64/48/1318586448.db2.gz	CFRUWTXSTVTIFV-SJORKVTESA-N	0	3	328.456	3.100	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccoc2CCC)C1	ZINC001021714579	1318593522	/nfs/dbraw/zinc/59/35/22/1318593522.db2.gz	XOMCOVLYMJFLJH-SJLPKXTDSA-N	0	3	328.456	3.182	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)CCc2c[nH]c3ccccc23)C1	ZINC001021723314	1318611401	/nfs/dbraw/zinc/61/14/01/1318611401.db2.gz	DNCYNAVYQSHDIY-NQIIRXRSSA-N	0	3	349.478	3.047	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)CCc2c[nH]c3ccccc23)C1	ZINC001021723315	1318613129	/nfs/dbraw/zinc/61/31/29/1318613129.db2.gz	DNCYNAVYQSHDIY-RXVVDRJESA-N	0	3	349.478	3.047	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(C)nc3ccccc32)C1	ZINC001021724829	1318616535	/nfs/dbraw/zinc/61/65/35/1318616535.db2.gz	ONVJHIBFQMRLOC-DYESRHJHSA-N	0	3	347.462	3.103	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)CCC1CC1	ZINC000960509795	1318622211	/nfs/dbraw/zinc/62/22/11/1318622211.db2.gz	QFBTZHZIBLJCSB-LJQANCHMSA-N	0	3	325.456	3.171	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(CC)c(C)s2)C1	ZINC001021728373	1318625997	/nfs/dbraw/zinc/62/59/97/1318625997.db2.gz	SURRQENFRRARKS-IRXDYDNUSA-N	0	3	330.497	3.179	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(F)cc2Cl)C1	ZINC001021728766	1318628539	/nfs/dbraw/zinc/62/85/39/1318628539.db2.gz	VSXDHOBYWIRWBC-DYVFJYSZSA-N	0	3	334.822	3.039	20	30		EGEDHN
COc1ccc(CN[C@H](C)c2ccc(C(=O)N(C)C)cc2)cc1C#N	ZINC000813858949	1318644025	/nfs/dbraw/zinc/64/40/25/1318644025.db2.gz	MPUORJPYDHWXOK-CQSZACIVSA-N	0	3	337.423	3.119	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)CC(C2CC2)C2CC2)C1	ZINC001021738959	1318645308	/nfs/dbraw/zinc/64/53/08/1318645308.db2.gz	FXBGDCWYDDMGSX-QUCCMNQESA-N	0	3	328.500	3.149	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)CC(C2CC2)C2CC2)C1	ZINC001021738957	1318646962	/nfs/dbraw/zinc/64/69/62/1318646962.db2.gz	FXBGDCWYDDMGSX-AZUAARDMSA-N	0	3	328.500	3.149	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(C(C)(F)F)cc2)C1	ZINC001021745494	1318660581	/nfs/dbraw/zinc/66/05/81/1318660581.db2.gz	BHHRFRVAFBVEFZ-SJLPKXTDSA-N	0	3	346.421	3.358	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CCC[C@H]1CN(C)Cc1ccc(C#N)cc1	ZINC000960561774	1318693047	/nfs/dbraw/zinc/69/30/47/1318693047.db2.gz	IVDHMOHSXVUODT-KRWDZBQOSA-N	0	3	329.419	3.244	20	30		EGEDHN
CN(Cc1cccc(Cl)c1)C[C@H]1CCCN1C(=O)C#CC1CC1	ZINC000960627847	1318754403	/nfs/dbraw/zinc/75/44/03/1318754403.db2.gz	SHBSRZZDYKMRLV-GOSISDBHSA-N	0	3	330.859	3.176	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCC[C@@H]1CN(C)Cc1ccccc1	ZINC000960667816	1318784598	/nfs/dbraw/zinc/78/45/98/1318784598.db2.gz	KWJBWSHOTCNHEY-LJQANCHMSA-N	0	3	337.467	3.411	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1C[C@@H](NCc2cc(F)ccc2F)C1	ZINC001022202635	1318840705	/nfs/dbraw/zinc/84/07/05/1318840705.db2.gz	IIVLEOJWJAPPTL-IYBDPMFKSA-N	0	3	345.393	3.003	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@@H](NC(=O)C[C@H]3C=CCCC3)C2)c1	ZINC001022270527	1318866171	/nfs/dbraw/zinc/86/61/71/1318866171.db2.gz	QSDIGSWXGLNMRW-JCGIZDLHSA-N	0	3	341.430	3.181	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)Nc1cccc(N2CCNC2=O)c1	ZINC000912476277	1318890559	/nfs/dbraw/zinc/89/05/59/1318890559.db2.gz	NCZFSMACFHYOTK-QGZVFWFLSA-N	0	3	346.475	3.233	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)[C@@]1(C)C=CCC1	ZINC000960792580	1318898958	/nfs/dbraw/zinc/89/89/58/1318898958.db2.gz	QPNPCJMURQNGPX-FPOVZHCZSA-N	0	3	337.467	3.337	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@@H]2CN(C)Cc2cccc(C#N)c2)CC1	ZINC000960826035	1318950613	/nfs/dbraw/zinc/95/06/13/1318950613.db2.gz	IDUWFHVYAKRVJS-GOSISDBHSA-N	0	3	325.456	3.171	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2F)C1	ZINC001022477868	1318957274	/nfs/dbraw/zinc/95/72/74/1318957274.db2.gz	MMKPSXXXPHJDKU-MYZSUADSSA-N	0	3	340.801	3.058	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@@H](NCc3ccccc3[N+](=O)[O-])C2)CC1	ZINC001022655540	1319045638	/nfs/dbraw/zinc/04/56/38/1319045638.db2.gz	GNDPHYNBJHVKQK-CALCHBBNSA-N	0	3	343.427	3.078	20	30		EGEDHN
CC[C@H]1CCC[C@H]1C(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001022661182	1319050171	/nfs/dbraw/zinc/05/01/71/1319050171.db2.gz	KTTKABXABKQFDC-DZJNRPSUSA-N	0	3	343.446	3.260	20	30		EGEDHN
Cc1cc(C#N)cnc1C(=O)O[C@H]1CCCN(Cc2ccccc2)[C@@H]1C	ZINC000816471803	1319161592	/nfs/dbraw/zinc/16/15/92/1319161592.db2.gz	NJPDWQHRAGAJBA-APWZRJJASA-N	0	3	349.434	3.472	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H]2C[C@@H](NCc3ccc(C#N)cc3F)C2)cc1	ZINC001023014815	1319220119	/nfs/dbraw/zinc/22/01/19/1319220119.db2.gz	BCEUYQXXVHJWPT-HDICACEKSA-N	0	3	337.398	3.056	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@H]([C@H]2CCN(Cc3ccc(C#N)s3)C2)C1	ZINC000961138996	1319258435	/nfs/dbraw/zinc/25/84/35/1319258435.db2.gz	LOJOVEHMTJIRNK-HOTGVXAUSA-N	0	3	345.512	3.336	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2c2cc(F)ccc2F)C1	ZINC001023105907	1319263489	/nfs/dbraw/zinc/26/34/89/1319263489.db2.gz	NRGNPJKVOCTPSC-SFDCQRBFSA-N	0	3	340.801	3.058	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC[C@@H]([C@@H]2CCN(CCF)C2)C1	ZINC000961165648	1319285829	/nfs/dbraw/zinc/28/58/29/1319285829.db2.gz	ICQBMNCQZWBTBN-HUUCEWRRSA-N	0	3	330.875	3.295	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc(N(C)C(C)C)cc2)C1	ZINC001023166350	1319302271	/nfs/dbraw/zinc/30/22/71/1319302271.db2.gz	PPSARLVKHYHDGN-IYBDPMFKSA-N	0	3	335.879	3.134	20	30		EGEDHN
C#CC[C@@H](NCc1ccc(CN2CCOCC2)cc1)c1ccccc1	ZINC000817275342	1319310129	/nfs/dbraw/zinc/31/01/29/1319310129.db2.gz	FQOPRACPVLZIFS-JOCHJYFZSA-N	0	3	334.463	3.373	20	30		EGEDHN
CCN1CCN(c2ccc(NCc3ccc(C#N)c(F)c3)cc2)CC1	ZINC000817406527	1319349684	/nfs/dbraw/zinc/34/96/84/1319349684.db2.gz	NHWNTDHZUHMNSM-UHFFFAOYSA-N	0	3	338.430	3.451	20	30		EGEDHN
Cc1ccoc1C(=O)NC[C@@H]1CCCN(Cc2ccc(C#N)cc2)C1	ZINC001023223636	1319361951	/nfs/dbraw/zinc/36/19/51/1319361951.db2.gz	ROQVMWKJYZFYJG-SFHVURJKSA-N	0	3	337.423	3.102	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]([C@@H]2CCN(Cc3ccns3)C2)C1	ZINC000961233314	1319364948	/nfs/dbraw/zinc/36/49/48/1319364948.db2.gz	VZTSYBQWIIEJBM-JKSUJKDBSA-N	0	3	347.528	3.416	20	30		EGEDHN
Cc1cc(C(=O)NC[C@@H]2CCCN(Cc3cccc(C#N)c3)C2)co1	ZINC001023323072	1319447213	/nfs/dbraw/zinc/44/72/13/1319447213.db2.gz	FNOVCMMFWZYCIK-SFHVURJKSA-N	0	3	337.423	3.102	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1ccc(CCC(F)(F)F)cc1	ZINC000930305488	1328830099	/nfs/dbraw/zinc/83/00/99/1328830099.db2.gz	ISNKOLDXLCBLIW-UHFFFAOYSA-N	0	3	341.377	3.258	20	30		EGEDHN
C#CCN1CCC[C@H](CNC(=O)c2csc3cc(C)ccc23)C1	ZINC001023392058	1319498868	/nfs/dbraw/zinc/49/88/68/1319498868.db2.gz	KCMSOFZBTBWJNS-OAHLLOKOSA-N	0	3	326.465	3.285	20	30		EGEDHN
CN(C)CCN(CCc1ccccc1)C(=O)/C=C\c1ccccc1C#N	ZINC000915628797	1319511188	/nfs/dbraw/zinc/51/11/88/1319511188.db2.gz	CCTWXEOKDGDDGB-SEYXRHQNSA-N	0	3	347.462	3.204	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccccc2C(C)(C)C)C1	ZINC001023437839	1319532701	/nfs/dbraw/zinc/53/27/01/1319532701.db2.gz	HOHBGQMDPZEOBX-QGZVFWFLSA-N	0	3	326.484	3.449	20	30		EGEDHN
C#CCN(C)CCCNC(=O)[C@@H](CC)Oc1ccccc1C(C)C	ZINC000818595910	1319564626	/nfs/dbraw/zinc/56/46/26/1319564626.db2.gz	SBMPIQQSCFMDDD-GOSISDBHSA-N	0	3	330.472	3.039	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2scnc2C2CCCC2)C1	ZINC001023469203	1319567400	/nfs/dbraw/zinc/56/74/00/1319567400.db2.gz	AJCXKPMLXLBHJW-OAHLLOKOSA-N	0	3	345.512	3.266	20	30		EGEDHN
CCCCCCCCOCC(=O)Nc1ccc2c(c1)CNCCO2	ZINC000818598108	1319567412	/nfs/dbraw/zinc/56/74/12/1319567412.db2.gz	DGWDOVQISSMUGZ-UHFFFAOYSA-N	0	3	334.460	3.484	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](C2CCN(C(=O)[C@@H]3CC34CC4)CC2)C1	ZINC000961416158	1319572430	/nfs/dbraw/zinc/57/24/30/1319572430.db2.gz	RNAGAGOEGXZXDV-IRXDYDNUSA-N	0	3	336.907	3.490	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc(C)c3cccnc23)C1	ZINC001023494666	1319601137	/nfs/dbraw/zinc/60/11/37/1319601137.db2.gz	OUFUAJALVLMNHB-KRWDZBQOSA-N	0	3	335.451	3.008	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc3c(cc(C)cc3C)[nH]2)C1	ZINC001023515766	1319622528	/nfs/dbraw/zinc/62/25/28/1319622528.db2.gz	HKJKCXSMOWQPHS-KRWDZBQOSA-N	0	3	337.467	3.250	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc3c(ccc(C)c3C)[nH]2)C1	ZINC001023529217	1319632794	/nfs/dbraw/zinc/63/27/94/1319632794.db2.gz	ZSKRALRWMRSKSW-KRWDZBQOSA-N	0	3	337.467	3.250	20	30		EGEDHN
C=CCN1CCC[C@H](CNC(=O)c2cc3cccc(OC)c3o2)C1	ZINC001023563294	1319677491	/nfs/dbraw/zinc/67/74/91/1319677491.db2.gz	ZRGCTVOZJSUICQ-CQSZACIVSA-N	0	3	328.412	3.069	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CCCN(Cc3ncccc3C)C2)CC1	ZINC001023573313	1319690905	/nfs/dbraw/zinc/69/09/05/1319690905.db2.gz	WRGCXCMTDMHLNN-GOSISDBHSA-N	0	3	341.499	3.465	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CCCN(Cc3cncc(C)c3)C2)CC1	ZINC001023572712	1319691101	/nfs/dbraw/zinc/69/11/01/1319691101.db2.gz	LTACXMQDHBRKOT-SFHVURJKSA-N	0	3	341.499	3.465	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1cc(-c2nc(C)co2)ccc1C	ZINC000930379272	1328845119	/nfs/dbraw/zinc/84/51/19/1328845119.db2.gz	PVWYCTGFZGBTCI-UHFFFAOYSA-N	0	3	340.427	3.035	20	30		EGEDHN
CCc1cccc(CC)c1NC(=O)C(C#N)C(=O)C[C@@H]1CCCO1	ZINC000916905165	1319722654	/nfs/dbraw/zinc/72/26/54/1319722654.db2.gz	BHDHCZJNLLJMER-HOTGVXAUSA-N	0	3	328.412	3.028	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)[C@@H]2C[C@H]2c2ccc(C)s2)C1	ZINC001023639228	1319759316	/nfs/dbraw/zinc/75/93/16/1319759316.db2.gz	FKLYFDFMPZFOOI-GVDBMIGSSA-N	0	3	330.497	3.012	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc(-c3ccccc3)nc2)C1	ZINC001023669514	1319783372	/nfs/dbraw/zinc/78/33/72/1319783372.db2.gz	BYZHYYPJGOVVEU-SFHVURJKSA-N	0	3	347.462	3.214	20	30		EGEDHN
C=C1CCC(C(=O)NC2CC(CN[C@H](C)c3cnc(C)cn3)C2)CC1	ZINC000962266250	1319891589	/nfs/dbraw/zinc/89/15/89/1319891589.db2.gz	XFDRUGVQCYSFEF-KLHKWILBSA-N	0	3	342.487	3.077	20	30		EGEDHN
C#C[C@H](NC(=O)N(CCC)[C@H]1CCN(C)C1)c1ccc(Cl)cc1	ZINC000820552385	1319908703	/nfs/dbraw/zinc/90/87/03/1319908703.db2.gz	IXQSWBPODLRSIO-IRXDYDNUSA-N	0	3	333.863	3.140	20	30		EGEDHN
Cc1cc(C)cc(C(=O)N[C@@H]2[C@H]3CN(Cc4ccc(C#N)cc4)C[C@H]32)c1	ZINC000962391080	1319947393	/nfs/dbraw/zinc/94/73/93/1319947393.db2.gz	FPSOTHJSHZMVDK-AERCQKQUSA-N	0	3	345.446	3.035	20	30		EGEDHN
N#Cc1ccc(F)c(C(=O)N[C@H](CN2CCCC2)c2ccccc2)c1	ZINC000820889861	1319975743	/nfs/dbraw/zinc/97/57/43/1319975743.db2.gz	UZPWBSMAZVHNDJ-LJQANCHMSA-N	0	3	337.398	3.264	20	30		EGEDHN
N#Cc1ccccc1CNCC1CC(NC(=O)[C@@H]2CC23CCCC3)C1	ZINC000962497853	1319984319	/nfs/dbraw/zinc/98/43/19/1319984319.db2.gz	PWQNWASIOPVZLR-PPSBMQLTSA-N	0	3	337.467	3.123	20	30		EGEDHN
C#C[C@@H](NC(=O)Nc1ccc(CCN2CCSCC2)cc1)C(C)C	ZINC000821547976	1320020351	/nfs/dbraw/zinc/02/03/51/1320020351.db2.gz	VSMNVOIDPSGXDW-GOSISDBHSA-N	0	3	345.512	3.057	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N(C)C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000823618136	1320192746	/nfs/dbraw/zinc/19/27/46/1320192746.db2.gz	NWSRZSGQAWPLON-SCLBCKFNSA-N	0	3	325.368	3.193	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1ccc(N2CCCCC2)c(Cl)c1	ZINC000827589902	1320461405	/nfs/dbraw/zinc/46/14/05/1320461405.db2.gz	HDJANSQDKYQUNX-OAHLLOKOSA-N	0	3	334.851	3.290	20	30		EGEDHN
CCN1CCN(c2ccc(NC(=O)C#CC(C)(C)C)c(C)c2)CC1	ZINC000837316794	1320596359	/nfs/dbraw/zinc/59/63/59/1320596359.db2.gz	NVIZWSZZHXWPAD-UHFFFAOYSA-N	0	3	327.472	3.125	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1cccc(C2SCCS2)c1	ZINC000838624416	1320796441	/nfs/dbraw/zinc/79/64/41/1320796441.db2.gz	XWVJEZDAWAZBAL-UHFFFAOYSA-N	0	3	349.525	3.242	20	30		EGEDHN
Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@H]1N2C(=O)c1ncc(C#N)cc1C	ZINC000839232814	1320897420	/nfs/dbraw/zinc/89/74/20/1320897420.db2.gz	OPFDODALNKKZOB-PKOBYXMFSA-N	0	3	346.434	3.018	20	30		EGEDHN
CN(CC(=O)C(C#N)c1nc(C2CC2)cs1)C(=O)c1cccs1	ZINC000842940177	1321451244	/nfs/dbraw/zinc/45/12/44/1321451244.db2.gz	YKHHZMDLSJZLNE-LLVKDONJSA-N	0	3	345.449	3.030	20	30		EGEDHN
C[C@H](NC(=O)CC(C)(C)C)C(=O)C(C#N)c1nc(C2CC2)cs1	ZINC000842947175	1321452963	/nfs/dbraw/zinc/45/29/63/1321452963.db2.gz	ZKGZQUCBUPXPJX-CMPLNLGQSA-N	0	3	333.457	3.138	20	30		EGEDHN
C[C@H](NC(=O)CC(C)(C)C)C(=O)C(C#N)c1nc(C2CC2)cs1	ZINC000842947178	1321453432	/nfs/dbraw/zinc/45/34/32/1321453432.db2.gz	ZKGZQUCBUPXPJX-JQWIXIFHSA-N	0	3	333.457	3.138	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H]2C[C@H](O)c2ccc(F)cc2)nc1	ZINC000846831704	1321814156	/nfs/dbraw/zinc/81/41/56/1321814156.db2.gz	KSEJURKZHRMBCS-OALUTQOASA-N	0	3	325.387	3.180	20	30		EGEDHN
C/C(=C\c1ccco1)C(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000846871892	1321819047	/nfs/dbraw/zinc/81/90/47/1321819047.db2.gz	JYVNUOVJLFTQBG-FOWTUZBSSA-N	0	3	337.423	3.145	20	30		EGEDHN
CCC(C)(C)N1CCN(C(=O)Nc2ccccc2O[C@@H](C)C#N)CC1	ZINC000847166131	1321847318	/nfs/dbraw/zinc/84/73/18/1321847318.db2.gz	IQKIKNJLQOCIPO-HNNXBMFYSA-N	0	3	344.459	3.316	20	30		EGEDHN
N#CC1(COC(=O)c2ccsn2)CCN(Cc2ccccc2)CC1	ZINC000847746634	1321900449	/nfs/dbraw/zinc/90/04/49/1321900449.db2.gz	PBWXKIFBBIJZFU-UHFFFAOYSA-N	0	3	341.436	3.106	20	30		EGEDHN
C#CCN(CC)C[C@@H](O)CO[C@H](c1ccccc1)c1ccccc1C	ZINC000920096052	1322136605	/nfs/dbraw/zinc/13/66/05/1322136605.db2.gz	UZNNCQYRBJKKKL-IFMALSPDSA-N	0	3	337.463	3.417	20	30		EGEDHN
N#CC(C(=O)Cc1cc2ccccc2o1)C(=O)NCc1ccccc1	ZINC000920107829	1322137968	/nfs/dbraw/zinc/13/79/68/1322137968.db2.gz	HBFDJXGVZBHBIS-QGZVFWFLSA-N	0	3	332.359	3.001	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)C[C@@H](C)C(F)(F)F)C1	ZINC001103392550	1365532563	/nfs/dbraw/zinc/53/25/63/1365532563.db2.gz	IDAJKBWMDNSDRE-NQBHXWOUSA-N	0	3	340.817	3.402	20	30		EGEDHN
C[C@H](NCc1ccc(N2CCCNC2=O)cc1)c1ccc(C#N)cc1	ZINC000850574027	1322270603	/nfs/dbraw/zinc/27/06/03/1322270603.db2.gz	AQZDFFWXAOJRGG-HNNXBMFYSA-N	0	3	334.423	3.329	20	30		EGEDHN
N#Cc1ccc(Br)c(CN[C@H]2CCO[C@@H](C3CC3)C2)c1	ZINC000921999697	1322437248	/nfs/dbraw/zinc/43/72/48/1322437248.db2.gz	GPOXDCCDMHTCTA-GOEBONIOSA-N	0	3	335.245	3.368	20	30		EGEDHN
C[C@H](Cc1ccccn1)NCc1cc(C#N)ccc1Br	ZINC000922222777	1322481788	/nfs/dbraw/zinc/48/17/88/1322481788.db2.gz	JAYPGABZVWLEMN-GFCCVEGCSA-N	0	3	330.229	3.437	20	30		EGEDHN
CC#CCCN1CC[C@H](C(F)(F)F)[C@@H](CNC(=O)OC(C)(C)C)C1	ZINC000859605356	1329033218	/nfs/dbraw/zinc/03/32/18/1329033218.db2.gz	CFCYJRQWJAJLMZ-KBPBESRZSA-N	0	3	348.409	3.425	20	30		EGEDHN
CC1(CC(=O)N2CCC[C@H](CNCc3ccccc3C#N)C2)CC1	ZINC001024067351	1323108381	/nfs/dbraw/zinc/10/83/81/1323108381.db2.gz	HDJCSFDZEGRQCG-MRXNPFEDSA-N	0	3	325.456	3.077	20	30		EGEDHN
CC1(C(=O)N2CCC[C@@H](CNCc3cc(F)ccc3C#N)C2)CCC1	ZINC001024096117	1323126476	/nfs/dbraw/zinc/12/64/76/1323126476.db2.gz	BRXOZMPBZCBKSD-HNNXBMFYSA-N	0	3	343.446	3.216	20	30		EGEDHN
C#C[C@@](C)(CC)NCC(=O)N[C@H](c1cccs1)c1ccccc1	ZINC000852098195	1323146251	/nfs/dbraw/zinc/14/62/51/1323146251.db2.gz	HFKYONOAUIRPPY-OALUTQOASA-N	0	3	326.465	3.345	20	30		EGEDHN
C[C@H](CC(C)(C)C#N)NCc1cccc(NC(=O)[C@H]2CCCO2)c1	ZINC000924778557	1323159711	/nfs/dbraw/zinc/15/97/11/1323159711.db2.gz	UYIZOMFJGMPJQS-RHSMWYFYSA-N	0	3	329.444	3.222	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H](CNCc2oc(C)nc2C)C1	ZINC001024137891	1323163234	/nfs/dbraw/zinc/16/32/34/1323163234.db2.gz	VBTRDAKJGRLLGX-VQIMIIECSA-N	0	3	333.476	3.222	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H](CNCc3nc(C)sc3C)C2)C1	ZINC001024145732	1323170750	/nfs/dbraw/zinc/17/07/50/1323170750.db2.gz	GBFQVYAJNYZSSQ-MRXNPFEDSA-N	0	3	347.528	3.444	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H](CNCc3ncc(C)s3)C2)C1	ZINC001024146328	1323171617	/nfs/dbraw/zinc/17/16/17/1323171617.db2.gz	SMLFXVJQZWFQMR-OAHLLOKOSA-N	0	3	333.501	3.136	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H](CNCc2ccccc2C#N)C1)C(C)(F)F	ZINC001024162132	1323179403	/nfs/dbraw/zinc/17/94/03/1323179403.db2.gz	ROEVMLUNYZVFNX-HUUCEWRRSA-N	0	3	349.425	3.178	20	30		EGEDHN
C=CCN(C[C@@H](O)c1ccc(F)c(Br)c1)[C@H](C)COC	ZINC000852356295	1323182165	/nfs/dbraw/zinc/18/21/65/1323182165.db2.gz	AGKJNSUEPMCDEH-IAQYHMDHSA-N	0	3	346.240	3.145	20	30		EGEDHN
N#Cc1ccccc1-c1ccc(CN2CC[C@@H](N3CCOC3=O)C2)cc1	ZINC000852433898	1323192345	/nfs/dbraw/zinc/19/23/45/1323192345.db2.gz	BSVQMWONMFOMSK-LJQANCHMSA-N	0	3	347.418	3.252	20	30		EGEDHN
C=CCCN1CCCC[C@H]1CNC(=O)c1cnc([C@@H](C)OC)s1	ZINC001024439584	1323402911	/nfs/dbraw/zinc/40/29/11/1323402911.db2.gz	CWEOEHDBLUZDNV-KGLIPLIRSA-N	0	3	337.489	3.011	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cc2ccccc2c(=O)[nH]1	ZINC001024478988	1323431193	/nfs/dbraw/zinc/43/11/93/1323431193.db2.gz	XMJSCLQJHBTHEX-MRXNPFEDSA-N	0	3	339.439	3.101	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cc2cc(F)ccc2[nH]1	ZINC001024588705	1323523266	/nfs/dbraw/zinc/52/32/66/1323523266.db2.gz	DCQGSXWQANLOEE-INIZCTEOSA-N	0	3	329.419	3.467	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1csc(-c2ccco2)n1	ZINC001024624335	1323551825	/nfs/dbraw/zinc/55/18/25/1323551825.db2.gz	PSTOUVGTELPCLS-AWEZNQCLSA-N	0	3	343.452	3.011	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccc(C(C)C)nc1CC	ZINC001024652864	1323574471	/nfs/dbraw/zinc/57/44/71/1323574471.db2.gz	XKSJBKCXTNMEHH-KRWDZBQOSA-N	0	3	341.499	3.375	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1cc(C(C)(C)C)oc1C	ZINC001024684441	1323599608	/nfs/dbraw/zinc/59/96/08/1323599608.db2.gz	WSXYRXZMDNLTNI-INIZCTEOSA-N	0	3	330.472	3.493	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccccc1O[C@H](C)CC	ZINC001024685827	1323601118	/nfs/dbraw/zinc/60/11/18/1323601118.db2.gz	NYWBVIUCVVYHTJ-QZTJIDSGSA-N	0	3	342.483	3.472	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccc(C(C)C)[nH]c1=O	ZINC001024692883	1323608992	/nfs/dbraw/zinc/60/89/92/1323608992.db2.gz	SQTUGFBQKVWCGI-OAHLLOKOSA-N	0	3	331.460	3.071	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1cc(-c2ccccc2)ccn1	ZINC001024731108	1323631277	/nfs/dbraw/zinc/63/12/77/1323631277.db2.gz	DHLWQFNTFZBBNL-FQEVSTJZSA-N	0	3	347.462	3.356	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1cccc(OCC(C)C)c1	ZINC001024793132	1323699395	/nfs/dbraw/zinc/69/93/95/1323699395.db2.gz	RIEBIVLRBQETGH-IBGZPJMESA-N	0	3	342.483	3.329	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccc(OC(C)C)cn1	ZINC001024834622	1323734835	/nfs/dbraw/zinc/73/48/35/1323734835.db2.gz	ZNCFILJULJEEAO-MRXNPFEDSA-N	0	3	331.460	3.029	20	30		EGEDHN
Cc1ccc(CNC[C@H]2CCCCN2C(=O)[C@@H](C)C#N)c(Cl)c1	ZINC001024901821	1323772455	/nfs/dbraw/zinc/77/24/55/1323772455.db2.gz	AFINTAGZLTTWCQ-GOEBONIOSA-N	0	3	333.863	3.279	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCCC[C@@H]1CNCc1cc2ccccc2o1	ZINC001024902337	1323772774	/nfs/dbraw/zinc/77/27/74/1323772774.db2.gz	OOTLTIHQGDNVEQ-GDBMZVCRSA-N	0	3	325.412	3.063	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)CC2CCC2)s1	ZINC001024913369	1323778149	/nfs/dbraw/zinc/77/81/49/1323778149.db2.gz	CCCHGMKPBITAPT-OAHLLOKOSA-N	0	3	331.485	3.281	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCCC[C@@H]1CNCc1ccns1	ZINC001024975348	1323809439	/nfs/dbraw/zinc/80/94/39/1323809439.db2.gz	YQPAEUAXMFJBRV-CYBMUJFWSA-N	0	3	341.908	3.393	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@H]1CNCc1cc(CO)ccc1F	ZINC001025040466	1323843151	/nfs/dbraw/zinc/84/31/51/1323843151.db2.gz	DLKRIGMMLMCMJZ-KRWDZBQOSA-N	0	3	348.462	3.001	20	30		EGEDHN
CC1(C(=O)N2CCCC[C@H]2CNCc2ccc(C#N)cc2F)CCC1	ZINC001025045184	1323848387	/nfs/dbraw/zinc/84/83/87/1323848387.db2.gz	SJXOCYXKEZLVHE-KRWDZBQOSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=C1CCC(C(=O)N2CCCC[C@@H]2CNCc2cnc(C)nc2)CC1	ZINC001025068756	1323868968	/nfs/dbraw/zinc/86/89/68/1323868968.db2.gz	RBWHANJCSJANCA-LJQANCHMSA-N	0	3	342.487	3.002	20	30		EGEDHN
C=C1CCC(C(=O)N2CCCC[C@@H]2CNCc2ccccn2)CC1	ZINC001025068616	1323869665	/nfs/dbraw/zinc/86/96/65/1323869665.db2.gz	OPGWWCRRQPPPAA-LJQANCHMSA-N	0	3	327.472	3.299	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCCC[C@H]2CNCc2scnc2C)C1	ZINC001025074989	1323877016	/nfs/dbraw/zinc/87/70/16/1323877016.db2.gz	VLPJXDQXXZOODK-HNNXBMFYSA-N	0	3	333.501	3.279	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccoc1CC	ZINC001025229005	1324015550	/nfs/dbraw/zinc/01/55/50/1324015550.db2.gz	FMVFVEMTDIZCBQ-ROUUACIJSA-N	0	3	328.456	3.324	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccn(CC(C)C)n1	ZINC001025236813	1324026972	/nfs/dbraw/zinc/02/69/72/1324026972.db2.gz	HYQXZAONHFPMHU-RTBURBONSA-N	0	3	344.503	3.184	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cncc(Cl)c1C	ZINC001025240492	1324034125	/nfs/dbraw/zinc/03/41/25/1324034125.db2.gz	PETMPLJXKBOLOY-ROUUACIJSA-N	0	3	345.874	3.136	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc(COC)o1	ZINC001025250533	1324052359	/nfs/dbraw/zinc/05/23/59/1324052359.db2.gz	KTAJBYGWRHGGHX-SJORKVTESA-N	0	3	332.444	3.071	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc(C)c(F)c1	ZINC001025250690	1324053803	/nfs/dbraw/zinc/05/38/03/1324053803.db2.gz	MPZOSVNNVRMEOT-OALUTQOASA-N	0	3	328.431	3.226	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1nc(C)c(C)nc1C	ZINC001025251091	1324054468	/nfs/dbraw/zinc/05/44/68/1324054468.db2.gz	PWORHNJEQLUSTE-ZWKOTPCHSA-N	0	3	342.487	3.047	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(C(C)C)on1	ZINC001025254910	1324061798	/nfs/dbraw/zinc/06/17/98/1324061798.db2.gz	NBNWNWUNAHHJAW-ZWKOTPCHSA-N	0	3	343.471	3.280	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1occ2c1CCC2	ZINC001025255957	1324062428	/nfs/dbraw/zinc/06/24/28/1324062428.db2.gz	UGZRXNXQJPIIOB-ROUUACIJSA-N	0	3	328.456	3.413	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)C1(C(F)F)CCCC1	ZINC001025261488	1324072356	/nfs/dbraw/zinc/07/23/56/1324072356.db2.gz	WGGZCTQBVHMXGA-CVEARBPZSA-N	0	3	338.442	3.291	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1nccc2ccccc21	ZINC001025261073	1324072804	/nfs/dbraw/zinc/07/28/04/1324072804.db2.gz	SXPUDKPNEIRCNK-PMACEKPBSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc(OC)cc1C	ZINC001025263963	1324074836	/nfs/dbraw/zinc/07/48/36/1324074836.db2.gz	STUAJXBHIYCHHK-UXHICEINSA-N	0	3	340.467	3.096	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc(OC)cc1C	ZINC001025263965	1324075077	/nfs/dbraw/zinc/07/50/77/1324075077.db2.gz	STUAJXBHIYCHHK-WOJBJXKFSA-N	0	3	340.467	3.096	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)C(C)(C)C(F)F	ZINC001025268502	1324079628	/nfs/dbraw/zinc/07/96/28/1324079628.db2.gz	BUSKUVGVOLFENV-GJZGRUSLSA-N	0	3	326.431	3.147	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cccc2cc[nH]c21	ZINC001025271174	1324086505	/nfs/dbraw/zinc/08/65/05/1324086505.db2.gz	HFUZJSICZOXXJB-RBUKOAKNSA-N	0	3	335.451	3.260	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1nc(C)ncc1Cl	ZINC001025274746	1324094290	/nfs/dbraw/zinc/09/42/90/1324094290.db2.gz	NBYIJSROUUCIRO-CVEARBPZSA-N	0	3	348.878	3.084	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cccc2ccncc21	ZINC001025287504	1324108616	/nfs/dbraw/zinc/10/86/16/1324108616.db2.gz	OLKYZPVEDHRJOM-SFTDATJTSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc2ccn(C)c2c1	ZINC001025288135	1324111141	/nfs/dbraw/zinc/11/11/41/1324111141.db2.gz	RYOAEDJUJKCRAA-WOJBJXKFSA-N	0	3	349.478	3.271	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)Cc1cc(C)ccc1F	ZINC001025291483	1324116294	/nfs/dbraw/zinc/11/62/94/1324116294.db2.gz	AFXFLOUBFCFWKR-UXHICEINSA-N	0	3	342.458	3.155	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc(Cl)cn1	ZINC001025292466	1324118075	/nfs/dbraw/zinc/11/80/75/1324118075.db2.gz	JCAWEXQLVGFPRD-SJORKVTESA-N	0	3	333.863	3.380	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1nc(C)c(C)s1	ZINC001025295034	1324125636	/nfs/dbraw/zinc/12/56/36/1324125636.db2.gz	NQTJUCZLCQRGLS-HZPDHXFCSA-N	0	3	333.501	3.405	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(Cl)cn1CC	ZINC001025297520	1324129136	/nfs/dbraw/zinc/12/91/36/1324129136.db2.gz	YFVAGOQJFXGRTF-DLBZAZTESA-N	0	3	347.890	3.254	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)CCc1ccc(C)o1	ZINC001025301402	1324134898	/nfs/dbraw/zinc/13/48/98/1324134898.db2.gz	JCUVLJCEPPSBHV-VQTJNVASSA-N	0	3	342.483	3.389	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1c(C)cccc1F	ZINC001025303142	1324137981	/nfs/dbraw/zinc/13/79/81/1324137981.db2.gz	FELSNZAKUPMFCM-QZTJIDSGSA-N	0	3	328.431	3.226	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc(CF)cc1	ZINC001025305729	1324139526	/nfs/dbraw/zinc/13/95/26/1324139526.db2.gz	ZNRHAKTYCGMNEJ-OALUTQOASA-N	0	3	328.431	3.248	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc3cc(C)cn3c2)C1	ZINC001025437032	1324277293	/nfs/dbraw/zinc/27/72/93/1324277293.db2.gz	RQNGBCWBNLFWQD-QZTJIDSGSA-N	0	3	337.467	3.101	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H](C)[C@H]1CCCN(C/C=C/Cl)C1	ZINC001025438148	1324278363	/nfs/dbraw/zinc/27/83/63/1324278363.db2.gz	DBRVJRQODRNVGV-GRLYAWNKSA-N	0	3	335.879	3.257	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cccc3c2CCCCC3)C1	ZINC001025450658	1324293672	/nfs/dbraw/zinc/29/36/72/1324293672.db2.gz	LFPAHHLHHGIIFM-IEBWSBKVSA-N	0	3	338.495	3.419	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(C)c3ccccc3n2)C1	ZINC001025458054	1324300281	/nfs/dbraw/zinc/30/02/81/1324300281.db2.gz	GUALGVMMAXDITH-QZTJIDSGSA-N	0	3	349.478	3.397	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(CCCC)cc2)C1	ZINC001025477910	1324322990	/nfs/dbraw/zinc/32/29/90/1324322990.db2.gz	IPMPEHCOVNLGPQ-XLIONFOSSA-N	0	3	326.484	3.493	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(Cl)ccc2F)C1	ZINC001025480224	1324327270	/nfs/dbraw/zinc/32/72/70/1324327270.db2.gz	RJEGOZAGKBWCSD-KBPBESRZSA-N	0	3	336.838	3.333	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc3cnccc3c2)C1	ZINC001025587757	1324431242	/nfs/dbraw/zinc/43/12/42/1324431242.db2.gz	PNIYCJNDVVTYNU-JXFKEZNVSA-N	0	3	335.451	3.088	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(Cl)cc(Cl)c2)C1	ZINC001025609252	1324459740	/nfs/dbraw/zinc/45/97/40/1324459740.db2.gz	NGMLCPIHKMRSQB-STQMWFEESA-N	0	3	339.266	3.457	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(C)c(CC)s2)C1	ZINC001025613979	1324467296	/nfs/dbraw/zinc/46/72/96/1324467296.db2.gz	DQVJSJSBBLQWPX-JKSUJKDBSA-N	0	3	332.513	3.473	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(-c3ccccc3)[nH]2)C1	ZINC001025633015	1324484531	/nfs/dbraw/zinc/48/45/31/1324484531.db2.gz	RNUZTDZGDXKDAP-WMZOPIPTSA-N	0	3	335.451	3.145	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CC[C@@H]2CN(C(=O)CC3CCC3)C[C@@H]12	ZINC001026229729	1324673027	/nfs/dbraw/zinc/67/30/27/1324673027.db2.gz	QAAYFNZJWZAQIG-VAMGGRTRSA-N	0	3	337.467	3.075	20	30		EGEDHN
Cc1ccc(C(=O)NC2CCC(NCc3ccccc3C#N)CC2)o1	ZINC001026448230	1324812295	/nfs/dbraw/zinc/81/22/95/1324812295.db2.gz	POWPPEQXERQDAU-UHFFFAOYSA-N	0	3	337.423	3.291	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)c2occc2C)CC1	ZINC001026453026	1324816732	/nfs/dbraw/zinc/81/67/32/1324816732.db2.gz	DNZRKMXEGSNJHY-UHFFFAOYSA-N	0	3	341.249	3.127	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC1CCC(NC(=O)C2CC=CC2)CC1	ZINC001026468470	1324826682	/nfs/dbraw/zinc/82/66/82/1324826682.db2.gz	DLLRBMGWDYYDJQ-UHFFFAOYSA-N	0	3	341.430	3.181	20	30		EGEDHN
Cc1ccncc1C(=O)NC1CCC(NCc2ccccc2C#N)CC1	ZINC001026469646	1324827712	/nfs/dbraw/zinc/82/77/12/1324827712.db2.gz	UHKAIRXBBUEWBC-UHFFFAOYSA-N	0	3	348.450	3.093	20	30		EGEDHN
Cc1coc(C(=O)NC2CCC(NCc3ccccc3C#N)CC2)c1	ZINC001026545711	1324882631	/nfs/dbraw/zinc/88/26/31/1324882631.db2.gz	KNJIBXWBPGLKJS-UHFFFAOYSA-N	0	3	337.423	3.291	20	30		EGEDHN
N#Cc1ccccc1CNC1CCC(NC(=O)[C@H]2CC23CCC3)CC1	ZINC001026569555	1324902905	/nfs/dbraw/zinc/90/29/05/1324902905.db2.gz	ZQDCUVVFVNJBSO-CTWPCTMYSA-N	0	3	337.467	3.265	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)c2ncccc2C)C1	ZINC000963282977	1325063894	/nfs/dbraw/zinc/06/38/94/1325063894.db2.gz	RNWFWKMXLAGQQO-IAGOWNOFSA-N	0	3	347.890	3.459	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)c2ocnc2C)C1	ZINC000963283933	1325066208	/nfs/dbraw/zinc/06/62/08/1325066208.db2.gz	YDHJPNBWUTVQAF-GJZGRUSLSA-N	0	3	337.851	3.052	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](CNCc2ccn(C(CC)CC)n2)C1	ZINC001026992459	1325130520	/nfs/dbraw/zinc/13/05/20/1325130520.db2.gz	MZQNZWREHNWPKA-INIZCTEOSA-N	0	3	346.519	3.395	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](CNCc3nc(C)c(C)s3)C2)CC1	ZINC001027041078	1325175799	/nfs/dbraw/zinc/17/57/99/1325175799.db2.gz	OLKRDSYPPGUOQZ-MRXNPFEDSA-N	0	3	347.528	3.444	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](CNCc3nc(C)cs3)C2)CC1	ZINC001027040514	1325176135	/nfs/dbraw/zinc/17/61/35/1325176135.db2.gz	DOUBASHJUMIMOE-OAHLLOKOSA-N	0	3	333.501	3.136	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)[C@H]2CC23CCCC3)C1	ZINC001027155477	1325258660	/nfs/dbraw/zinc/25/86/60/1325258660.db2.gz	NNVNZUWIAOMWLG-QFBILLFUSA-N	0	3	337.467	3.077	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@H](CNCc3ccccc3C#N)C2)cc1	ZINC001027186146	1325285757	/nfs/dbraw/zinc/28/57/57/1325285757.db2.gz	BVKWALKNMOROBI-QGZVFWFLSA-N	0	3	333.435	3.119	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)c2ccccc2)C1	ZINC001027277779	1325396664	/nfs/dbraw/zinc/39/66/64/1325396664.db2.gz	LSDNLTBQNAGEFL-HXUWFJFHSA-N	0	3	333.435	3.295	20	30		EGEDHN
C=C(Br)CNC1CCC(N(C)C(=O)C(C)(C)C)CC1	ZINC000964241037	1325490201	/nfs/dbraw/zinc/49/02/01/1325490201.db2.gz	WJIWIGOZMHLIII-UHFFFAOYSA-N	0	3	331.298	3.300	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC[C@H](N(C)Cc2ccc(Cl)c(F)c2)C1	ZINC001027336837	1325495456	/nfs/dbraw/zinc/49/54/56/1325495456.db2.gz	UTJJBJDPMMAKCV-JSGCOSHPSA-N	0	3	337.826	3.062	20	30		EGEDHN
CC[C@@H](SC)C(=O)N1CCC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001027371782	1325564414	/nfs/dbraw/zinc/56/44/14/1325564414.db2.gz	IZQZDAHLHSSPQG-ZWKOTPCHSA-N	0	3	345.512	3.123	20	30		EGEDHN
CC[C@@H](SC)C(=O)N1CCC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001027371780	1325565415	/nfs/dbraw/zinc/56/54/15/1325565415.db2.gz	IZQZDAHLHSSPQG-QZTJIDSGSA-N	0	3	345.512	3.123	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)C2(C(F)F)CC2)C1	ZINC001027413294	1327641814	/nfs/dbraw/zinc/64/18/14/1327641814.db2.gz	MACDWKBEVZUALG-MRXNPFEDSA-N	0	3	347.409	3.026	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H](N(C)CCc2ccns2)C1	ZINC001027519461	1327789454	/nfs/dbraw/zinc/78/94/54/1327789454.db2.gz	NTQJNNPEQTZFAA-HNNXBMFYSA-N	0	3	335.517	3.211	20	30		EGEDHN
Cc1coc(C(=O)N2CCC[C@H](N(C)Cc3ccc(C#N)cc3)C2)c1	ZINC001027537440	1327832021	/nfs/dbraw/zinc/83/20/21/1327832021.db2.gz	IRJLCILNXIWCDC-SFHVURJKSA-N	0	3	337.423	3.196	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)c2ccc(-c3cccs3)o2)C1	ZINC001027667381	1328059378	/nfs/dbraw/zinc/05/93/78/1328059378.db2.gz	QOFICQNNZGPVGQ-CQSZACIVSA-N	0	3	328.437	3.178	20	30		EGEDHN
C[C@H](CC(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)cc2)C1)C1CC1	ZINC001027696869	1328106336	/nfs/dbraw/zinc/10/63/36/1328106336.db2.gz	RGYWFVIMSZGPFJ-UZLBHIALSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](C)[C@H](NC(=O)c2sc3nccn3c2C)C1	ZINC000966817156	1328425637	/nfs/dbraw/zinc/42/56/37/1328425637.db2.gz	WKCQZPAPQAYXKZ-UKRRQHHQSA-N	0	3	346.500	3.111	20	30		EGEDHN
C=C(C)CCN1CC[C@H](C)[C@H](NC(=O)c2sc3nccn3c2C)C1	ZINC000966817154	1328426052	/nfs/dbraw/zinc/42/60/52/1328426052.db2.gz	WKCQZPAPQAYXKZ-DZGCQCFKSA-N	0	3	346.500	3.111	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2nccc3ccsc32)C1	ZINC000966846043	1328436814	/nfs/dbraw/zinc/43/68/14/1328436814.db2.gz	OOQFXMSEWMQUKO-ZFWWWQNUSA-N	0	3	329.469	3.313	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)Cc2cncc3ccccc32)C1	ZINC000966876754	1328448749	/nfs/dbraw/zinc/44/87/49/1328448749.db2.gz	ZXEPPRSMHXWZSI-OXJNMPFZSA-N	0	3	337.467	3.180	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cccc(Nc3nccs3)c2)CC1	ZINC000932141437	1329788318	/nfs/dbraw/zinc/78/83/18/1329788318.db2.gz	ZMFYKIQYZLPEOF-UHFFFAOYSA-N	0	3	342.468	3.267	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccnc3cc(Cl)ccc32)CC1	ZINC000932141152	1329788389	/nfs/dbraw/zinc/78/83/89/1329788389.db2.gz	RVQRITKBOTXCKB-UHFFFAOYSA-N	0	3	329.831	3.268	20	30		EGEDHN
CC(C)(C)C(=O)N[C@@H]1CCN(Cc2ccc(C#N)cc2)CC1(C)C	ZINC000941177378	1331371323	/nfs/dbraw/zinc/37/13/23/1331371323.db2.gz	KYYAFRRZTUOVOO-QGZVFWFLSA-N	0	3	327.472	3.321	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3ccccc3nc2C)[C@@H](C)C1	ZINC000942107176	1331833190	/nfs/dbraw/zinc/83/31/90/1331833190.db2.gz	UYCBGRPTBXBJFK-KXBFYZLASA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2oc3ccc(F)cc3c2C)[C@@H](C)C1	ZINC000942122010	1331838282	/nfs/dbraw/zinc/83/82/82/1331838282.db2.gz	JTIKTNCZBPMNEN-SUMWQHHRSA-N	0	3	342.414	3.344	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccccc2-c2ccncc2)[C@@H](C)C1	ZINC000942176395	1331861748	/nfs/dbraw/zinc/86/17/48/1331861748.db2.gz	OXPWFYLVWGZFKZ-UWJYYQICSA-N	0	3	347.462	3.212	20	30		EGEDHN
C[C@@H]1CN(Cc2cccc(C#N)c2)CC[C@@H]1NC(=O)Cc1ccccc1	ZINC000942188590	1331869581	/nfs/dbraw/zinc/86/95/81/1331869581.db2.gz	LMYNAWUJBGCSNO-UTKZUKDTSA-N	0	3	347.462	3.128	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2scnc2C2CCCC2)[C@H](C)C1	ZINC000942301227	1331898053	/nfs/dbraw/zinc/89/80/53/1331898053.db2.gz	CLLFJVMONAAFHA-ZBFHGGJFSA-N	0	3	345.512	3.264	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2sc(C)nc2CC(C)C)[C@@H](C)C1	ZINC000942313693	1331900593	/nfs/dbraw/zinc/90/05/93/1331900593.db2.gz	LGOGLBGQXIAPQB-ZFWWWQNUSA-N	0	3	335.517	3.276	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2oc3ccccc3c2OC)[C@H](C)C1	ZINC000942546862	1331968499	/nfs/dbraw/zinc/96/84/99/1331968499.db2.gz	BKWUGLYHKXDGIW-UKRRQHHQSA-N	0	3	328.412	3.068	20	30		EGEDHN
Cc1coc(C(=O)N[C@H]2CCN(Cc3cccc(C#N)c3)C[C@@H]2C)c1	ZINC000942565389	1331978176	/nfs/dbraw/zinc/97/81/76/1331978176.db2.gz	KWIOCZJTNUCFPM-YJBOKZPZSA-N	0	3	337.423	3.100	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3c(C)nsc3C)C[C@@H]2C)C1	ZINC000942602890	1332000522	/nfs/dbraw/zinc/00/05/22/1332000522.db2.gz	OSXPFINCVOGINL-SUMWQHHRSA-N	0	3	347.528	3.443	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(CCc3csc(C)n3)C[C@@H]2C)C1	ZINC000942608634	1332003900	/nfs/dbraw/zinc/00/39/00/1332003900.db2.gz	XWSNDVQVKQYQNC-YOEHRIQHSA-N	0	3	347.528	3.177	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccc(C(C)(C)C)c2)[C@H](C)C1	ZINC000943744697	1332252002	/nfs/dbraw/zinc/25/20/02/1332252002.db2.gz	LVJVBPLJQDQDJW-VQIMIIECSA-N	0	3	326.484	3.448	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C)c(C)c2Cl)[C@@H](C)C1	ZINC000944078981	1332322698	/nfs/dbraw/zinc/32/26/98/1332322698.db2.gz	IFMPETCTOIVQCM-YOEHRIQHSA-N	0	3	332.875	3.420	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C)c(C)c2Cl)[C@H](C)C1	ZINC000944078978	1332322916	/nfs/dbraw/zinc/32/29/16/1332322916.db2.gz	IFMPETCTOIVQCM-PBHICJAKSA-N	0	3	332.875	3.420	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C(C)(C)c2ccc(CC)cc2)[C@H](C)C1	ZINC000944080854	1332323558	/nfs/dbraw/zinc/32/35/58/1332323558.db2.gz	OWHFVOAYGGAZDQ-YLJYHZDGSA-N	0	3	340.511	3.377	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2c(Cl)cccc2Cl)[C@H](C)C1	ZINC000944304771	1332367654	/nfs/dbraw/zinc/36/76/54/1332367654.db2.gz	LAOLWAWSIYGDDK-DOMZBBRYSA-N	0	3	339.266	3.457	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)CC23CC4CC(CC(C4)C2)C3)[C@H](C)C1	ZINC000944307281	1332369193	/nfs/dbraw/zinc/36/91/93/1332369193.db2.gz	XENPYXRRMPSAFD-CYSNLQCGSA-N	0	3	328.500	3.053	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(-c3cccs3)o2)[C@@H](C)C1	ZINC000944531863	1332415426	/nfs/dbraw/zinc/41/54/26/1332415426.db2.gz	KESYGZANAUVWFI-LSDHHAIUSA-N	0	3	342.464	3.472	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2coc(C3CCCCC3)n2)[C@@H](C)C1	ZINC000945219707	1332534174	/nfs/dbraw/zinc/53/41/74/1332534174.db2.gz	DLTIXOBRHAEAAY-RDJZCZTQSA-N	0	3	343.471	3.186	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C(F)(F)F)s2)[C@H](C)C1	ZINC000945368859	1332569179	/nfs/dbraw/zinc/56/91/79/1332569179.db2.gz	ZHAOUPXTTATVEK-NEPJUHHUSA-N	0	3	344.402	3.230	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C(F)(F)F)s2)[C@@H](C)C1	ZINC000945368861	1332569274	/nfs/dbraw/zinc/56/92/74/1332569274.db2.gz	ZHAOUPXTTATVEK-NWDGAFQWSA-N	0	3	344.402	3.230	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(-c3ccccc3)[nH]2)[C@H](C)C1	ZINC000945806549	1332678345	/nfs/dbraw/zinc/67/83/45/1332678345.db2.gz	DZZJEANXKZTRCT-SJLPKXTDSA-N	0	3	335.451	3.145	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2c(C)oc3ccccc32)[C@@H](C)C1	ZINC000946315069	1332785997	/nfs/dbraw/zinc/78/59/97/1332785997.db2.gz	WKTGQXVXCPTZNK-HNAYVOBHSA-N	0	3	338.451	3.134	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@@H](CC)SC)CC[C@@H]2C1	ZINC000946556592	1332853989	/nfs/dbraw/zinc/85/39/89/1332853989.db2.gz	RMXRQLYIZODVTN-QLFBSQMISA-N	0	3	330.925	3.051	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2ccc(C#N)[nH]2)CCN1C/C=C/c1ccccc1	ZINC000947215877	1333054000	/nfs/dbraw/zinc/05/40/00/1333054000.db2.gz	BOWYACLFGNVZCM-ODEKCMFZSA-N	0	3	348.450	3.182	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2c(F)ccc3ccncc32)C[C@H]1C	ZINC000947328345	1333091094	/nfs/dbraw/zinc/09/10/94/1333091094.db2.gz	QMSHOAYXIOBALX-UKRRQHHQSA-N	0	3	327.403	3.143	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2oc3c(cccc3F)c2C)C[C@H]1C	ZINC000947392661	1333113272	/nfs/dbraw/zinc/11/32/72/1333113272.db2.gz	XHBSYZASDNSUPR-UKRRQHHQSA-N	0	3	342.414	3.486	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C3CC3)[nH]c2C2CC2)C[C@H]1C	ZINC000947440550	1333128107	/nfs/dbraw/zinc/12/81/07/1333128107.db2.gz	BOTINAIWIAXAGO-PBHICJAKSA-N	0	3	339.483	3.376	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)n(C(CC)CC)n2)C[C@H]1C	ZINC000947471646	1333141290	/nfs/dbraw/zinc/14/12/90/1333141290.db2.gz	DUTWRSXAOHECQQ-NVXWUHKLSA-N	0	3	344.503	3.159	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2sc(C)nc2CC(C)C)C[C@@H]1C	ZINC000947506616	1333150557	/nfs/dbraw/zinc/15/05/57/1333150557.db2.gz	SFMQTRDNPIKUAQ-ZFWWWQNUSA-N	0	3	335.517	3.419	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2coc3ccc(OC)cc23)C[C@@H]1C	ZINC000947536991	1333162337	/nfs/dbraw/zinc/16/23/37/1333162337.db2.gz	KPXNDQQHXHOEMZ-GJZGRUSLSA-N	0	3	340.423	3.047	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2cccc(C(F)F)c2)C[C@H]1C	ZINC000947540613	1333164172	/nfs/dbraw/zinc/16/41/72/1333164172.db2.gz	WFEBXTHIDKPKHI-RHSMWYFYSA-N	0	3	334.410	3.159	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2nc3ccccc3cc2C)C[C@@H]1C	ZINC000947559125	1333172109	/nfs/dbraw/zinc/17/21/09/1333172109.db2.gz	GPIRRHQBFHJNET-WMZOPIPTSA-N	0	3	335.451	3.149	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2oc3ccccc3c2OC)C[C@H]1C	ZINC000947611883	1333192775	/nfs/dbraw/zinc/19/27/75/1333192775.db2.gz	ROOWLWSQAWLIAO-CABCVRRESA-N	0	3	340.423	3.047	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2nsc3ccc(C)cc32)C[C@H]1C	ZINC000947621790	1333196507	/nfs/dbraw/zinc/19/65/07/1333196507.db2.gz	WKIZICZGLDRBAV-KGLIPLIRSA-N	0	3	329.469	3.373	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3cnccc3C)[C@H](C)C2)C1	ZINC000947702791	1333232589	/nfs/dbraw/zinc/23/25/89/1333232589.db2.gz	SIUYQULIYWPAHF-SJLPKXTDSA-N	0	3	327.472	3.215	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3cc(F)ccc3o2)C[C@H]1C	ZINC000947771737	1333256505	/nfs/dbraw/zinc/25/65/05/1333256505.db2.gz	QOXABXXGSIQOKM-CJNGLKHVSA-N	0	3	328.387	3.178	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnoc2-c2ccccc2)C[C@@H]1C	ZINC000947878021	1333287821	/nfs/dbraw/zinc/28/78/21/1333287821.db2.gz	JJSWMUJCPAXMFL-GOEBONIOSA-N	0	3	325.412	3.110	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnc(-c3ccco3)s2)C[C@@H]1C	ZINC000947943528	1333314097	/nfs/dbraw/zinc/31/40/97/1333314097.db2.gz	MBXSEOCIJHGSPU-QWHCGFSZSA-N	0	3	331.441	3.172	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(F)c(F)c(F)c2F)C[C@H]1C	ZINC000947957728	1333320011	/nfs/dbraw/zinc/32/00/11/1333320011.db2.gz	MXNACGFODVLDHS-ZJUUUORDSA-N	0	3	330.325	3.012	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc3c(c2)CCCC3)C[C@H]1C	ZINC000948015833	1333342070	/nfs/dbraw/zinc/34/20/70/1333342070.db2.gz	IGGPFVDNCQTTMX-UTKZUKDTSA-N	0	3	338.495	3.100	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccc(COC(C)C)cc2)C[C@H]1C	ZINC000948015638	1333342218	/nfs/dbraw/zinc/34/22/18/1333342218.db2.gz	GBJVOZAELSPASM-VQIMIIECSA-N	0	3	330.472	3.380	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(COC(C)C)cc2)C[C@H]1C	ZINC000948017126	1333343129	/nfs/dbraw/zinc/34/31/29/1333343129.db2.gz	TXFREMXSKUMGFY-XLIONFOSSA-N	0	3	342.483	3.218	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2c[nH]cc2-c2ccccc2)C[C@@H]1C	ZINC000948035138	1333348219	/nfs/dbraw/zinc/34/82/19/1333348219.db2.gz	CSCWSYABKOTCJJ-FUHWJXTLSA-N	0	3	335.451	3.288	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2sc(CCC)nc2C)C[C@@H]1C	ZINC000948036076	1333349149	/nfs/dbraw/zinc/34/91/49/1333349149.db2.gz	NMWLSFAHWHXRPB-DZGCQCFKSA-N	0	3	333.501	3.010	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cnc(C(C)(C)C)s2)C[C@H]1C	ZINC000948070121	1333363870	/nfs/dbraw/zinc/36/38/70/1333363870.db2.gz	MOSLRXGCPYCTRB-ZIAGYGMSSA-N	0	3	333.501	3.047	20	30		EGEDHN
CN(C(=O)CC1CC1)[C@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948136744	1333386658	/nfs/dbraw/zinc/38/66/58/1333386658.db2.gz	RFSNYNJWYNTXGW-IBGZPJMESA-N	0	3	325.456	3.171	20	30		EGEDHN
CN(C(=O)C=C1CCC1)[C@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948286290	1333464095	/nfs/dbraw/zinc/46/40/95/1333464095.db2.gz	PPIIYCUHZBMPSG-FQEVSTJZSA-N	0	3	337.467	3.481	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2c(C)noc2C(C)C)CC1	ZINC000948457515	1333533706	/nfs/dbraw/zinc/53/37/06/1333533706.db2.gz	XOPGZTKBNRMICY-INIZCTEOSA-N	0	3	331.460	3.056	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2c(C)noc2C(C)C)CC1	ZINC000948457516	1333534007	/nfs/dbraw/zinc/53/40/07/1333534007.db2.gz	XOPGZTKBNRMICY-MRXNPFEDSA-N	0	3	331.460	3.056	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2cc(C)c3ccccc3n2)CC1	ZINC000948546974	1333567559	/nfs/dbraw/zinc/56/75/59/1333567559.db2.gz	NSDDHWOVCIDYKC-KRWDZBQOSA-N	0	3	335.451	3.103	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2csc3ccccc32)CC1	ZINC000948662383	1333618043	/nfs/dbraw/zinc/61/80/43/1333618043.db2.gz	XXWKRHMOSYYGCD-OAHLLOKOSA-N	0	3	326.465	3.461	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2scnc2C(C)(C)C)CC1	ZINC000948840836	1333705695	/nfs/dbraw/zinc/70/56/95/1333705695.db2.gz	NODOJWABSIGEMV-CQSZACIVSA-N	0	3	333.501	3.000	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccc(C)s2)CC1	ZINC000948841717	1333706370	/nfs/dbraw/zinc/70/63/70/1333706370.db2.gz	YYHPFYNAIXQVOB-BRWVUGGUSA-N	0	3	330.497	3.106	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2csc(C(C)(C)C)n2)CC1	ZINC000948856748	1333711155	/nfs/dbraw/zinc/71/11/55/1333711155.db2.gz	MDUIGGAMVQJRAN-OAHLLOKOSA-N	0	3	347.528	3.390	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)[C@@H](C)c2cc(C)oc2C)CC1	ZINC000948860516	1333711582	/nfs/dbraw/zinc/71/15/82/1333711582.db2.gz	DZEVMVYIVKYKBH-WMZOPIPTSA-N	0	3	330.472	3.336	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)[C@@H](C)c2ccc(CC)cc2)CC1	ZINC000948861843	1333713539	/nfs/dbraw/zinc/71/35/39/1333713539.db2.gz	UWPAHMXUPFKKGI-FXAWDEMLSA-N	0	3	326.484	3.299	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@@H]1CNC(=O)c1c[nH]c(C#N)c1	ZINC000948905913	1333728305	/nfs/dbraw/zinc/72/83/05/1333728305.db2.gz	GNRHCXJGRBUKIG-FQEVSTJZSA-N	0	3	348.450	3.182	20	30		EGEDHN
C=CCN1CCc2ccccc2[C@@H]1CNC(=O)c1n[nH]c2ccccc21	ZINC000948982496	1333758208	/nfs/dbraw/zinc/75/82/08/1333758208.db2.gz	MTGDQBCZACXSNV-IBGZPJMESA-N	0	3	346.434	3.078	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC2(CC1)CN(CCCC1CCC1)CCO2	ZINC000949433113	1333846056	/nfs/dbraw/zinc/84/60/56/1333846056.db2.gz	CFLSHYQHBLYHQQ-UHFFFAOYSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C[C@H]3CC[C@H](C)C3)CC2)C1	ZINC000949445047	1333849146	/nfs/dbraw/zinc/84/91/46/1333849146.db2.gz	SPGZAUVPTSBOFW-OALUTQOASA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2cc(-c3ccccc3)no2)C1	ZINC000967181758	1335675924	/nfs/dbraw/zinc/67/59/24/1335675924.db2.gz	HYCTUEILWSKTOZ-YJBOKZPZSA-N	0	3	339.439	3.358	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2nc(Cl)sc2C)C1	ZINC000967313648	1335697722	/nfs/dbraw/zinc/69/77/22/1335697722.db2.gz	OKWVSXKFQVJPKO-PWSUYJOCSA-N	0	3	327.881	3.121	20	30		EGEDHN
C=C(C)CCN1CC[C@H](C)[C@H](NC(=O)c2nc3c(s2)CCC3)C1	ZINC000967376602	1335718932	/nfs/dbraw/zinc/71/89/32/1335718932.db2.gz	INNXYECXKMNHFW-DZGCQCFKSA-N	0	3	333.501	3.038	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2nc3ccccc3cc2C)C1	ZINC000967415976	1335731422	/nfs/dbraw/zinc/73/14/22/1335731422.db2.gz	YZJHAVWIXVQIIH-DNVCBOLYSA-N	0	3	335.451	3.007	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC[C@@H](NCc2ccccc2Oc2ccccc2)C1	ZINC000967727591	1335808300	/nfs/dbraw/zinc/80/83/00/1335808300.db2.gz	GAFXKUGUERQUSL-FUHWJXTLSA-N	0	3	349.434	3.329	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2ccc(F)c(Cl)c2F)C1	ZINC000968216103	1335874056	/nfs/dbraw/zinc/87/40/56/1335874056.db2.gz	ZRRXBFKUNLLZKY-SMDDNHRTSA-N	0	3	340.801	3.082	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccc(F)c3ccccc23)C1	ZINC000968346576	1335896255	/nfs/dbraw/zinc/89/62/55/1335896255.db2.gz	XSYLJZXSTWGMTI-YWZLYKJASA-N	0	3	338.426	3.442	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccccc2OCC(C)C)C1	ZINC000968430493	1335927545	/nfs/dbraw/zinc/92/75/45/1335927545.db2.gz	CWMCNSKLMSUPQU-IEBWSBKVSA-N	0	3	342.483	3.185	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2cccn2C2CCCC2)C1	ZINC000968477580	1335936119	/nfs/dbraw/zinc/93/61/19/1335936119.db2.gz	UMWYJPOSUGSXTL-FUHWJXTLSA-N	0	3	327.472	3.067	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2csc3c2CCCC3)C1	ZINC000968620749	1335985998	/nfs/dbraw/zinc/98/59/98/1335985998.db2.gz	YVTIYASUWSZIIT-WMLDXEAASA-N	0	3	330.497	3.090	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)C2(c3ccccc3)CCCC2)C1	ZINC000968623011	1335986655	/nfs/dbraw/zinc/98/66/55/1335986655.db2.gz	DJODEDURYYYKOB-QUCCMNQESA-N	0	3	338.495	3.348	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2ccc(F)c3occc32)C1	ZINC000968677998	1336007716	/nfs/dbraw/zinc/00/77/16/1336007716.db2.gz	MUYYWYGIOOGLCX-SUMWQHHRSA-N	0	3	328.387	3.035	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2cc3ccccc3n2CC)C1	ZINC000968682225	1336008972	/nfs/dbraw/zinc/00/89/72/1336008972.db2.gz	PCAIVBXYVFXRBM-SJLPKXTDSA-N	0	3	337.467	3.125	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)Cc2cc3ccccc3n2C)C1	ZINC000968685241	1336010738	/nfs/dbraw/zinc/01/07/38/1336010738.db2.gz	PGNJNEPADXOCHE-LPHOPBHVSA-N	0	3	339.483	3.124	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)Cc2cc3ccccc3n2C)C1	ZINC000968685243	1336010855	/nfs/dbraw/zinc/01/08/55/1336010855.db2.gz	PGNJNEPADXOCHE-VQIMIIECSA-N	0	3	339.483	3.124	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2cnc(CC(C)C)s2)C1	ZINC000968695740	1336015630	/nfs/dbraw/zinc/01/56/30/1336015630.db2.gz	VJILIHUBLVVJGA-HUUCEWRRSA-N	0	3	335.517	3.358	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)C2(c3ccccc3OC)CC2)C1	ZINC000968706585	1336018764	/nfs/dbraw/zinc/01/87/64/1336018764.db2.gz	RNEQXDWUUZLNHA-AEFFLSMTSA-N	0	3	342.483	3.130	20	30		EGEDHN
Cc1scc(C(=O)N2CC[C@@H](NCc3ccc(C#N)s3)C2)c1C	ZINC000968785499	1336050100	/nfs/dbraw/zinc/05/01/00/1336050100.db2.gz	DUDAKKPCMUXKQR-CYBMUJFWSA-N	0	3	345.493	3.302	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H](NCc2cc(F)cc(F)c2)C1	ZINC000968795190	1336054359	/nfs/dbraw/zinc/05/43/59/1336054359.db2.gz	FXTLYYLCDUYVEL-OAHLLOKOSA-N	0	3	342.817	3.434	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cccc(NC(=O)CC)c1	ZINC000968877252	1336075734	/nfs/dbraw/zinc/07/57/34/1336075734.db2.gz	QQZOCDNIIXRMDG-SFHVURJKSA-N	0	3	343.471	3.196	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)[C@@H]1CCCN1c1ccccc1	ZINC000968882262	1336079114	/nfs/dbraw/zinc/07/91/14/1336079114.db2.gz	KPAAFCXMBHBQPQ-PMACEKPBSA-N	0	3	341.499	3.202	20	30		EGEDHN
C#CCCN1CCCCC[C@@H]1CNC(=O)c1cc2ccncc2s1	ZINC000968888623	1336080330	/nfs/dbraw/zinc/08/03/30/1336080330.db2.gz	XAGRUSOWGUMCQH-MRXNPFEDSA-N	0	3	341.480	3.294	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1cc2cnccc2o1	ZINC000968936877	1336096179	/nfs/dbraw/zinc/09/61/79/1336096179.db2.gz	UEBIBDMOWQPMNM-INIZCTEOSA-N	0	3	327.428	3.378	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1noc2c1CCCC2	ZINC000969044039	1336125216	/nfs/dbraw/zinc/12/52/16/1336125216.db2.gz	GCVSRZVRAPHTJE-HNNXBMFYSA-N	0	3	331.460	3.104	20	30		EGEDHN
N#Cc1ccc(CN2CCCCC[C@H]2CNC(=O)[C@@H]2CC23CC3)cc1	ZINC000969049838	1336127886	/nfs/dbraw/zinc/12/78/86/1336127886.db2.gz	OOFANORVUXODAB-OALUTQOASA-N	0	3	337.467	3.219	20	30		EGEDHN
C#CCN1CCCCC[C@H]1CNC(=O)c1c[nH]cc1-c1ccccc1	ZINC000969147272	1336161800	/nfs/dbraw/zinc/16/18/00/1336161800.db2.gz	BNYJPOUARZTAAO-SFHVURJKSA-N	0	3	335.451	3.289	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cccnc1OC(C)C	ZINC000969173576	1336171228	/nfs/dbraw/zinc/17/12/28/1336171228.db2.gz	NANBABYJRIJMBX-MRXNPFEDSA-N	0	3	331.460	3.029	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)c2coc3c2cccc3OC)C1	ZINC000969680073	1336236462	/nfs/dbraw/zinc/23/64/62/1336236462.db2.gz	JKXDZXQGZWKVBJ-CYBMUJFWSA-N	0	3	328.412	3.068	20	30		EGEDHN
CC1(C)CC[C@@H](C(=O)N2CC[C@@H](NCc3ccc(C#N)s3)C2)C1	ZINC000969867550	1336254706	/nfs/dbraw/zinc/25/47/06/1336254706.db2.gz	QPSLSBQDGGDXTQ-ZIAGYGMSSA-N	0	3	331.485	3.137	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)c2ccc(OC)c(C(C)C)c2)C1	ZINC000970068648	1336275504	/nfs/dbraw/zinc/27/55/04/1336275504.db2.gz	UYMRVZKCGATITB-OAHLLOKOSA-N	0	3	330.472	3.445	20	30		EGEDHN
CN(C(=O)[C@@H]1CC[C@H](F)C1)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001005893323	1336417595	/nfs/dbraw/zinc/41/75/95/1336417595.db2.gz	WBXCWXWSPSSBOB-MSOLQXFVSA-N	0	3	343.446	3.119	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cc(F)c(F)cc2F)CC1	ZINC001005900385	1336418235	/nfs/dbraw/zinc/41/82/35/1336418235.db2.gz	FFIMIDFUSLGHQM-UHFFFAOYSA-N	0	3	326.362	3.216	20	30		EGEDHN
CC(C)[C@@H]1C[C@@H]1C(=O)N(C)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001006219300	1336468813	/nfs/dbraw/zinc/46/88/13/1336468813.db2.gz	OFTMZGGZNVFOBO-PMACEKPBSA-N	0	3	339.483	3.273	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cnc3ccc(F)cc3c2)CC1	ZINC001006250284	1336476659	/nfs/dbraw/zinc/47/66/59/1336476659.db2.gz	AYNBYAHVDRZYKE-UHFFFAOYSA-N	0	3	341.430	3.486	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2ccc(N(C)CCC)cc2)CC1	ZINC001006477158	1336514242	/nfs/dbraw/zinc/51/42/42/1336514242.db2.gz	DXVJWBYFQLIVJY-UHFFFAOYSA-N	0	3	329.488	3.255	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CCCN(Cc3ccc(C)cc3C)C2)c1	ZINC001008471448	1336865135	/nfs/dbraw/zinc/86/51/35/1336865135.db2.gz	ZMUIWAWEFXPELL-NRFANRHFSA-N	0	3	347.462	3.074	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2ncoc2-c2cccs2)C1	ZINC001008906019	1336941180	/nfs/dbraw/zinc/94/11/80/1336941180.db2.gz	QUXBPHGLXZXWDH-ZDUSSCGKSA-N	0	3	331.441	3.173	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2cnoc2-c2ccccc2)C1	ZINC001009045768	1336959307	/nfs/dbraw/zinc/95/93/07/1336959307.db2.gz	PAUCCCZDGGQGAU-INIZCTEOSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)Cc2cccc(OCCC)c2)C1	ZINC001009124499	1336973201	/nfs/dbraw/zinc/97/32/01/1336973201.db2.gz	OTXAYPDWASQSHE-SFHVURJKSA-N	0	3	330.472	3.175	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2c[nH]nc2C2CCCCC2)C1	ZINC001009153827	1336977633	/nfs/dbraw/zinc/97/76/33/1336977633.db2.gz	NLDCXYRCQGJDHK-INIZCTEOSA-N	0	3	330.476	3.228	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCN([C@@H](C)c3cccc(C)c3)C2)nc1	ZINC001009271995	1336994944	/nfs/dbraw/zinc/99/49/44/1336994944.db2.gz	WSGNGVCXQKJBQG-PXNSSMCTSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@H]1CCCN(Cc2ccccc2C)C1	ZINC001009356916	1337010488	/nfs/dbraw/zinc/01/04/88/1337010488.db2.gz	ZXZATRPATANPBI-QFIPXVFZSA-N	0	3	346.474	3.300	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(CC[C@H]3CCCC3(F)F)C2)cc1	ZINC001015481772	1338155333	/nfs/dbraw/zinc/15/53/33/1338155333.db2.gz	HMIJNAOEFCJYBH-MSOLQXFVSA-N	0	3	346.421	3.298	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN([C@@H](CC)c3ccccc3)C2)nc1	ZINC001016028465	1338415190	/nfs/dbraw/zinc/41/51/90/1338415190.db2.gz	YOQPUGQPGDUBIU-ICSRJNTNSA-N	0	3	333.435	3.018	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@H]3NC(=O)[C@@H]3CC=CCC3)CC2)c1	ZINC001016500029	1338627410	/nfs/dbraw/zinc/62/74/10/1338627410.db2.gz	LVCDRRVDOHQXCY-WOJBJXKFSA-N	0	3	349.478	3.385	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)[C@H]2CC[C@H](C3CCC3)CC2)CC1	ZINC001016667667	1338685939	/nfs/dbraw/zinc/68/59/39/1338685939.db2.gz	ODALQKYGJWVXCX-GUDVDZBRSA-N	0	3	328.500	3.197	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)Cc2ccc(C)cc2Cl)CC1	ZINC001016695351	1338694309	/nfs/dbraw/zinc/69/43/09/1338694309.db2.gz	JYWOMPPVDMPGRG-GOSISDBHSA-N	0	3	344.886	3.185	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cccc(-n3cccc3)c2)CC1	ZINC001016713654	1338699927	/nfs/dbraw/zinc/69/99/27/1338699927.db2.gz	ZJVNZMHDGULHML-FQEVSTJZSA-N	0	3	347.462	3.085	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cc(C)cc(Cl)c2)CC1	ZINC001016735177	1338706877	/nfs/dbraw/zinc/70/68/77/1338706877.db2.gz	AVGQEARMWALRGE-QGZVFWFLSA-N	0	3	330.859	3.256	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2nc3ccccc3cc2C)CC1	ZINC001016737596	1338707447	/nfs/dbraw/zinc/70/74/47/1338707447.db2.gz	XOFPGKOFSRQNDC-IBGZPJMESA-N	0	3	347.462	3.151	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)[C@H](C)c2c(F)cccc2F)CC1	ZINC001016738953	1338707947	/nfs/dbraw/zinc/70/79/47/1338707947.db2.gz	UVSWDZOADWLWQC-PBHICJAKSA-N	0	3	346.421	3.062	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2cc(C3CC3)oc2C2CC2)CC1	ZINC001016743847	1338709346	/nfs/dbraw/zinc/70/93/46/1338709346.db2.gz	SMZCHZACWHLAKN-GOSISDBHSA-N	0	3	338.451	3.252	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2coc3cc(C)c(C)cc32)CC1	ZINC001016747980	1338710802	/nfs/dbraw/zinc/71/08/02/1338710802.db2.gz	FKWGWNRKVAEXSL-LJQANCHMSA-N	0	3	336.435	3.267	20	30		EGEDHN
Cc1coc(C(=O)N[C@H]2CC23CCN(Cc2cccc(C#N)c2)CC3)c1	ZINC001016784193	1338726125	/nfs/dbraw/zinc/72/61/25/1338726125.db2.gz	UUXSNKGCZZYVED-IBGZPJMESA-N	0	3	349.434	3.244	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)Cc2cccc(Cl)c2F)CC1	ZINC001016846220	1338745542	/nfs/dbraw/zinc/74/55/42/1338745542.db2.gz	BMMMKAYEJCGVRL-INIZCTEOSA-N	0	3	348.849	3.016	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)[C@@H]2C[C@H]2c2cccc(C)c2)CC1	ZINC001016872710	1338754556	/nfs/dbraw/zinc/75/45/56/1338754556.db2.gz	KNBMRKMVHKJCNA-ZCNNSNEGSA-N	0	3	336.479	3.093	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cc(Cl)ccc2C)CC1	ZINC001016882477	1338758068	/nfs/dbraw/zinc/75/80/68/1338758068.db2.gz	QZPDDHOZTIXPIM-QGZVFWFLSA-N	0	3	330.859	3.256	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)[C@@H](C)c2ccc(Cl)s2)CC1	ZINC001016919039	1338769649	/nfs/dbraw/zinc/76/96/49/1338769649.db2.gz	JPEVQTFLZFBECR-GXTWGEPZSA-N	0	3	336.888	3.109	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)Cc2c(F)cccc2Cl)CC1	ZINC001016947353	1338780580	/nfs/dbraw/zinc/78/05/80/1338780580.db2.gz	WMCXXYKIPCRRQO-QGZVFWFLSA-N	0	3	348.849	3.016	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2cc(C)c(F)cc2Cl)CC1	ZINC001016949600	1338782014	/nfs/dbraw/zinc/78/20/14/1338782014.db2.gz	GFXKNZIAHNBPKY-INIZCTEOSA-N	0	3	334.822	3.005	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCCN(C(=O)C2CCC2)C1	ZINC001017015605	1338808552	/nfs/dbraw/zinc/80/85/52/1338808552.db2.gz	ARWQXXZHJRJPSY-AWEZNQCLSA-N	0	3	331.485	3.090	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC[C@H](CN(C)Cc2ccccc2Cl)C1	ZINC001017071327	1338847940	/nfs/dbraw/zinc/84/79/40/1338847940.db2.gz	LEHZRMUOGIGJQV-LSDHHAIUSA-N	0	3	333.863	3.170	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC[C@@H](CN(C)Cc2ccccc2Cl)C1	ZINC001017071324	1338848084	/nfs/dbraw/zinc/84/80/84/1338848084.db2.gz	LEHZRMUOGIGJQV-GJZGRUSLSA-N	0	3	333.863	3.170	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H](CN(C)Cc2cccnc2)C1	ZINC001017197035	1338942638	/nfs/dbraw/zinc/94/26/38/1338942638.db2.gz	MNTQVMHHRNYGCN-UYAOXDASSA-N	0	3	329.488	3.354	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)CCc1ccc(OC)c(F)c1	ZINC001017730946	1339405985	/nfs/dbraw/zinc/40/59/85/1339405985.db2.gz	WOIUIOOKYZOWET-CALCHBBNSA-N	0	3	346.446	3.018	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1CC[C@@H](C(F)(F)F)C1	ZINC001017854960	1339430685	/nfs/dbraw/zinc/43/06/85/1339430685.db2.gz	FFBXFCIFUTVKLC-LJISPDSOSA-N	0	3	330.394	3.216	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1CCc2ccccc2O1	ZINC001018075181	1339496832	/nfs/dbraw/zinc/49/68/32/1339496832.db2.gz	JZJZMZSLLMMLBL-WSTZPKSXSA-N	0	3	340.467	3.022	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1ccccc1OC1CCC1	ZINC001028129532	1340447681	/nfs/dbraw/zinc/44/76/81/1340447681.db2.gz	QPVZKVQHERERHS-INIZCTEOSA-N	0	3	328.456	3.388	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1ccc(OCC2CC2)cc1	ZINC001028324949	1340565714	/nfs/dbraw/zinc/56/57/14/1340565714.db2.gz	FRJPSBRJVDBCJM-SFHVURJKSA-N	0	3	328.456	3.246	20	30		EGEDHN
Cc1cc(C(=O)NC[C@@H]2CCN(Cc3cccc(C#N)c3)C2)c(C)o1	ZINC001028404594	1340626078	/nfs/dbraw/zinc/62/60/78/1340626078.db2.gz	UENVYDUGVNBXER-SFHVURJKSA-N	0	3	337.423	3.020	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCN(Cc3cccc(F)c3)C2)cc1	ZINC001028730059	1340778577	/nfs/dbraw/zinc/77/85/77/1340778577.db2.gz	CZQFELJFUAFHHM-GOSISDBHSA-N	0	3	336.410	3.059	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)c2c(Cl)oc3ccccc32)C1	ZINC001028757074	1340792473	/nfs/dbraw/zinc/79/24/73/1340792473.db2.gz	UNQRGMXRTYTRAY-CYBMUJFWSA-N	0	3	330.815	3.161	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](CNC(=O)c3occc3Cl)C2)cc1	ZINC001028784376	1340815769	/nfs/dbraw/zinc/81/57/69/1340815769.db2.gz	MSCIPENBDDIHMM-HNNXBMFYSA-N	0	3	343.814	3.057	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@H]2CCN(Cc3ccc(C#N)cc3)C2)cc1	ZINC001028948206	1340891092	/nfs/dbraw/zinc/89/10/92/1340891092.db2.gz	HPWSDZQFLVBTRO-LJQANCHMSA-N	0	3	333.435	3.119	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)c2ccc(-c3ccccc3)cc2)C1	ZINC001028960732	1340893628	/nfs/dbraw/zinc/89/36/28/1340893628.db2.gz	JZJNONMNYDNSRC-SFHVURJKSA-N	0	3	332.447	3.429	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)C1CCN(C(=O)C2CCCC2)CC1	ZINC001029035343	1340913578	/nfs/dbraw/zinc/91/35/78/1340913578.db2.gz	USJBGDDAOAUNAV-INIZCTEOSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC([C@@H](C)NCc2cc(OC)no2)CC1	ZINC001029124626	1340935913	/nfs/dbraw/zinc/93/59/13/1340935913.db2.gz	AJFPBXDXUGOOJD-CQSZACIVSA-N	0	3	349.475	3.002	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC([C@H](C)NCc2ocnc2C)CC1	ZINC001029139280	1340940502	/nfs/dbraw/zinc/94/05/02/1340940502.db2.gz	BUSCNBKKGXNWRS-IFXJQAMLSA-N	0	3	333.476	3.302	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1C[C@H]2CC[C@@H](C1)N2CC1=CCCCC1	ZINC001029567212	1341013950	/nfs/dbraw/zinc/01/39/50/1341013950.db2.gz	PXTQESQULGTAFW-SZPZYZBQSA-N	0	3	348.490	3.386	20	30		EGEDHN
C/C(=C/C(=O)N1CC[C@@H](CN(C)Cc2ccc(C#N)s2)C1)C1CC1	ZINC001029663043	1341037184	/nfs/dbraw/zinc/03/71/84/1341037184.db2.gz	DPYDSAGQQAXQMP-MZLJFPOFSA-N	0	3	343.496	3.256	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](CN(C)[C@@H](C)c2cnc(C)cn2)C1	ZINC001029799751	1341076502	/nfs/dbraw/zinc/07/65/02/1341076502.db2.gz	CWMIWOFKUJFWEJ-DLBZAZTESA-N	0	3	344.503	3.229	20	30		EGEDHN
C#CCCN1CCC[C@@H](N(Cc2ccccc2)C(=O)c2ccc[nH]2)C1	ZINC001029918165	1341117981	/nfs/dbraw/zinc/11/79/81/1341117981.db2.gz	YJLDVCAGHDHNJM-LJQANCHMSA-N	0	3	335.451	3.145	20	30		EGEDHN
C#CCCN1CCC[C@H](N(Cc2ccccc2)C(=O)c2c[nH]cc2C)C1	ZINC001029920521	1341119904	/nfs/dbraw/zinc/11/99/04/1341119904.db2.gz	GRCVJXWBFDAYKZ-FQEVSTJZSA-N	0	3	349.478	3.453	20	30		EGEDHN
C[C@H]1C[C@H]1C(=O)N1CCC(CN(C)Cc2ccc(C#N)cc2F)CC1	ZINC001029931405	1341125289	/nfs/dbraw/zinc/12/52/89/1341125289.db2.gz	NXGCRJASGIHKBS-KBXCAEBGSA-N	0	3	343.446	3.024	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC(CN(C)[C@H](C)c2cc(F)ccc2F)CC1	ZINC001029945457	1341130392	/nfs/dbraw/zinc/13/03/92/1341130392.db2.gz	ISMFVRQZZPFQKF-ZIAGYGMSSA-N	0	3	349.425	3.356	20	30		EGEDHN
C[C@@H](C(=O)N1CCC(CN(C)Cc2ccc(C#N)s2)CC1)C1CC1	ZINC001029950860	1341132034	/nfs/dbraw/zinc/13/20/34/1341132034.db2.gz	GQLFNMHIGRXDBP-CQSZACIVSA-N	0	3	345.512	3.336	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC(CN(C)[C@@H](C)c2cnccn2)CC1	ZINC001029989933	1341147741	/nfs/dbraw/zinc/14/77/41/1341147741.db2.gz	DHFNOAJZLUVQCQ-OXJNMPFZSA-N	0	3	344.503	3.310	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1F)CC1CCN(C(=O)C(C)(C)C)CC1	ZINC001030011139	1341157544	/nfs/dbraw/zinc/15/75/44/1341157544.db2.gz	ZWWBINQHWJUPED-UHFFFAOYSA-N	0	3	345.462	3.414	20	30		EGEDHN
C=CCn1cccc1C(=O)NCC1CN(CCCc2ccsc2)C1	ZINC001031733402	1341395059	/nfs/dbraw/zinc/39/50/59/1341395059.db2.gz	XINJQRUCHOWNIO-UHFFFAOYSA-N	0	3	343.496	3.030	20	30		EGEDHN
C#Cc1ccc(C(=O)NCC2CN([C@@H](C)c3ccccc3C)C2)cc1	ZINC001031892106	1341417617	/nfs/dbraw/zinc/41/76/17/1341417617.db2.gz	MRTHYJCNVLNVIO-KRWDZBQOSA-N	0	3	332.447	3.399	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@@H]2C[C@H]1CN2CC[C@H]1CCCCO1	ZINC001032423106	1341509219	/nfs/dbraw/zinc/50/92/19/1341509219.db2.gz	VVJIIULOLSXGPY-HRCADAONSA-N	0	3	340.895	3.009	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)Cn1c(C)cc2ccccc21	ZINC001032506234	1341525748	/nfs/dbraw/zinc/52/57/48/1341525748.db2.gz	AJWHATCSYFXRKD-OALUTQOASA-N	0	3	337.467	3.201	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H]1CCc2c1cccc2Cl	ZINC001032523683	1341530792	/nfs/dbraw/zinc/53/07/92/1341530792.db2.gz	FYCGPYMTTUQOFF-GRDNDAEWSA-N	0	3	330.859	3.231	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc2c(c1)[C@H](C)CO2	ZINC001032580942	1341548625	/nfs/dbraw/zinc/54/86/25/1341548625.db2.gz	DZLBBKJYYCAEEW-PVAVHDDUSA-N	0	3	326.440	3.047	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)[C@@H]2CCCC[C@@H]2C(F)(F)F)C1	ZINC001033191246	1341748788	/nfs/dbraw/zinc/74/87/88/1341748788.db2.gz	HBVUHLHHBZNPGK-ZNMIVQPWSA-N	0	3	332.410	3.464	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2ccc(C(C)C)nc2CC)C1	ZINC001033427409	1341822016	/nfs/dbraw/zinc/82/20/16/1341822016.db2.gz	BDDWOPJFRQCQPV-INIZCTEOSA-N	0	3	329.488	3.490	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2ccccc2OCC(C)C)C1	ZINC001033511946	1341853201	/nfs/dbraw/zinc/85/32/01/1341853201.db2.gz	OKNGGEZBYSPCJG-KRWDZBQOSA-N	0	3	330.472	3.444	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)C(C)(C)c2ccccc2OC)C1	ZINC001033708060	1341969866	/nfs/dbraw/zinc/96/98/66/1341969866.db2.gz	TZEXITCVLBPMIJ-INIZCTEOSA-N	0	3	330.472	3.082	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2cccc(OCCC)c2)C1	ZINC001033844655	1342039867	/nfs/dbraw/zinc/03/98/67/1342039867.db2.gz	APSAFEMTXNUIIV-GOSISDBHSA-N	0	3	328.456	3.035	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cnn3c2ccc(C)c3C)C1	ZINC001033860222	1342049005	/nfs/dbraw/zinc/04/90/05/1342049005.db2.gz	UHYWYADKKSTHOK-KRWDZBQOSA-N	0	3	340.471	3.064	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2cc3c([nH]2)c(F)ccc3C)C1	ZINC001033876970	1342054458	/nfs/dbraw/zinc/05/44/58/1342054458.db2.gz	GANTXAFCJGACQC-OAHLLOKOSA-N	0	3	341.430	3.175	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@H]2Cc3cc(Cl)ccc3O2)C1	ZINC001033894734	1342067166	/nfs/dbraw/zinc/06/71/66/1342067166.db2.gz	ZTBHJWQHVGOKHC-FUHWJXTLSA-N	0	3	348.874	3.142	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@@H]2COc3ccc(Cl)cc32)C1	ZINC001033902082	1342075098	/nfs/dbraw/zinc/07/50/98/1342075098.db2.gz	XPOIEJCUTXLIFN-DOTOQJQBSA-N	0	3	348.874	3.315	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@H]2CCc3ccc(F)cc3O2)C1	ZINC001033901916	1342075281	/nfs/dbraw/zinc/07/52/81/1342075281.db2.gz	SSBWSDVGSIJUGX-ZWKOTPCHSA-N	0	3	346.446	3.018	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cc3cc(OC)ccc3[nH]2)C1	ZINC001033937840	1342099606	/nfs/dbraw/zinc/09/96/06/1342099606.db2.gz	KUACYDHDSKOVBV-INIZCTEOSA-N	0	3	341.455	3.289	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@H]2CCc3cccc(OC)c32)C1	ZINC001033979068	1342127303	/nfs/dbraw/zinc/12/73/03/1342127303.db2.gz	FTVHNSVMTBJPOT-MSOLQXFVSA-N	0	3	342.483	3.224	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@@H]2Cc3cc(C)c(C)cc3O2)C1	ZINC001034047771	1342187440	/nfs/dbraw/zinc/18/74/40/1342187440.db2.gz	KHXKKQMKTWNSMJ-QUCCMNQESA-N	0	3	342.483	3.106	20	30		EGEDHN
C=CCCN1CCCC[C@H](NC(=O)c2cnc([C@H](C)OC)s2)C1	ZINC001034209988	1342318962	/nfs/dbraw/zinc/31/89/62/1342318962.db2.gz	ILDRPKIWEYGJDB-KBPBESRZSA-N	0	3	337.489	3.011	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cccc(NC(=O)CC)c2)C1	ZINC001034230108	1342334587	/nfs/dbraw/zinc/33/45/87/1342334587.db2.gz	BPZAMIHGQQBCAD-SFHVURJKSA-N	0	3	343.471	3.196	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)[C@@H]2CCCO[C@H]2c2ccccc2)C1	ZINC001034246574	1342345291	/nfs/dbraw/zinc/34/52/91/1342345291.db2.gz	GLJJYNLALQHODF-ZCNNSNEGSA-N	0	3	342.483	3.311	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cc(-c3ccccc3)n[nH]2)C1	ZINC001034303980	1342386717	/nfs/dbraw/zinc/38/67/17/1342386717.db2.gz	OALOOHNBQZXIBM-QGZVFWFLSA-N	0	3	338.455	3.237	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc(C)nc2C2CC2)C1	ZINC001034327361	1342402489	/nfs/dbraw/zinc/40/24/89/1342402489.db2.gz	IMORDTDXFUYMHU-KRWDZBQOSA-N	0	3	327.472	3.428	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@H]2CCOc3ccccc32)C1	ZINC001034446117	1342507574	/nfs/dbraw/zinc/50/75/74/1342507574.db2.gz	LOKQQEYKHRYECE-AEFFLSMTSA-N	0	3	328.456	3.100	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cccc3c2OCCCO3)C1	ZINC001034456515	1342514026	/nfs/dbraw/zinc/51/40/26/1342514026.db2.gz	UIIGDYRJDVGNQR-MRXNPFEDSA-N	0	3	344.455	3.008	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2ccc(C(F)F)cc2F)C1	ZINC001034458521	1342515238	/nfs/dbraw/zinc/51/52/38/1342515238.db2.gz	NEUYHTOWRXRQMS-CQSZACIVSA-N	0	3	338.373	3.371	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)[C@H]2CCCc3sc(C)nc32)C1	ZINC001034493875	1342550482	/nfs/dbraw/zinc/55/04/82/1342550482.db2.gz	VZMRUFRSHBCVQB-GJZGRUSLSA-N	0	3	333.501	3.028	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC001034502049	1342559969	/nfs/dbraw/zinc/55/99/69/1342559969.db2.gz	CFNLJROFMNWKBR-HNNXBMFYSA-N	0	3	326.362	3.476	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc(OC)c(OCC)c2)C1	ZINC001034522196	1342580468	/nfs/dbraw/zinc/58/04/68/1342580468.db2.gz	SKGYFAZLLPDSID-KRWDZBQOSA-N	0	3	346.471	3.254	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)c2occc2C)CC1	ZINC001034594206	1342638731	/nfs/dbraw/zinc/63/87/31/1342638731.db2.gz	DNZRKMXEGSNJHY-JOCQHMNTSA-N	0	3	341.249	3.127	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)C2(C3CC3)CC2)CC1	ZINC001034665405	1342678588	/nfs/dbraw/zinc/67/85/88/1342678588.db2.gz	CWRRDPNSVXNBLR-HDJSIYSDSA-N	0	3	341.293	3.102	20	30		EGEDHN
C[C@@H]1C[C@H]1CC(=O)N[C@H]1CC[C@H](NCc2ccccc2C#N)CC1	ZINC001034724860	1342718608	/nfs/dbraw/zinc/71/86/08/1342718608.db2.gz	VTJAVVRAOXJIPX-ZWQIFLOQSA-N	0	3	325.456	3.121	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC[C@H](NCc3nc(C)cs3)CC2)C1	ZINC001034726543	1342721242	/nfs/dbraw/zinc/72/12/42/1342721242.db2.gz	MYWNFPDPGXIWBD-SHTZXODSSA-N	0	3	333.501	3.325	20	30		EGEDHN
N#Cc1ccc(CNCc2ccc(CNC(=O)c3ccc[nH]3)cc2)cc1	ZINC001034807300	1342772688	/nfs/dbraw/zinc/77/26/88/1342772688.db2.gz	JFYKLNRBXRDKIA-UHFFFAOYSA-N	0	3	344.418	3.106	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc(N(C)C)cc2)C12CCC2	ZINC001078795543	1357088926	/nfs/dbraw/zinc/08/89/26/1357088926.db2.gz	RSRAJLJILCVPGL-DLBZAZTESA-N	0	3	347.890	3.136	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)[C@@H]2CC=CCC2)cc1F	ZINC001034859035	1342809241	/nfs/dbraw/zinc/80/92/41/1342809241.db2.gz	OUPCEVABXQHAFG-SJLPKXTDSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC[C@@H]1CNCc1cc(C)ns1	ZINC001034947044	1342847908	/nfs/dbraw/zinc/84/79/08/1342847908.db2.gz	LCHUIOIKKOLAOD-CYBMUJFWSA-N	0	3	341.908	3.311	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)cc1F)C(C)(C)C	ZINC001034973918	1342859266	/nfs/dbraw/zinc/85/92/66/1342859266.db2.gz	UVGVEXZRKPMTLC-WMLDXEAASA-N	0	3	345.462	3.460	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC2(CCN(Cc3cc(C)no3)C2)CC1	ZINC001035211808	1343030838	/nfs/dbraw/zinc/03/08/38/1343030838.db2.gz	NFBGJDPYWQKIPV-UHFFFAOYSA-N	0	3	331.460	3.010	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1c(C)c(F)ccc1Cl)CC2	ZINC001035735610	1343161350	/nfs/dbraw/zinc/16/13/50/1343161350.db2.gz	IOUALZYMESXXOF-UHFFFAOYSA-N	0	3	348.849	3.349	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cccc3cccnc31)CC2	ZINC001035742235	1343163780	/nfs/dbraw/zinc/16/37/80/1343163780.db2.gz	DRORJAZRKZJEIN-UHFFFAOYSA-N	0	3	335.451	3.349	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@H]1CCCCC1(F)F)CC2	ZINC001035758128	1343173525	/nfs/dbraw/zinc/17/35/25/1343173525.db2.gz	UXBBLORDDDLTKI-OAHLLOKOSA-N	0	3	326.431	3.312	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@H](C)c1ccc(Cl)cc1)CC2	ZINC001035785806	1343196530	/nfs/dbraw/zinc/19/65/30/1343196530.db2.gz	NKFGTTILPQKNDE-MRXNPFEDSA-N	0	3	344.886	3.391	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc3cnccc3c1)CC2	ZINC001035828599	1343217565	/nfs/dbraw/zinc/21/75/65/1343217565.db2.gz	UNDNJKLZFGGVMT-UHFFFAOYSA-N	0	3	335.451	3.349	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc3ccncc3c1)CC2	ZINC001035831926	1343219905	/nfs/dbraw/zinc/21/99/05/1343219905.db2.gz	URMSNXHDWMHNFG-UHFFFAOYSA-N	0	3	335.451	3.349	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cccc(C(F)F)c1)CC2	ZINC001035839129	1343221612	/nfs/dbraw/zinc/22/16/12/1343221612.db2.gz	JUUIXQHCQNDTNY-UHFFFAOYSA-N	0	3	332.394	3.186	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc(C3CCCC3)no1)CC2	ZINC001035853888	1343231570	/nfs/dbraw/zinc/23/15/70/1343231570.db2.gz	VPEYPFFXDGFGFL-UHFFFAOYSA-N	0	3	343.471	3.446	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H](F)Cc1ccccc1)CC2	ZINC001035854958	1343232083	/nfs/dbraw/zinc/23/20/83/1343232083.db2.gz	BMXVLGUWQOPNSR-SFHVURJKSA-N	0	3	330.447	3.068	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc(N(C)C)c(F)c1)CC2	ZINC001035856919	1343232939	/nfs/dbraw/zinc/23/29/39/1343232939.db2.gz	FVVNNBQSZMSKKI-UHFFFAOYSA-N	0	3	345.462	3.006	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@H](C)Cc1ccc(C)cc1)CC2	ZINC001035857141	1343233882	/nfs/dbraw/zinc/23/38/82/1343233882.db2.gz	HCIDXAPHCKOCFX-LJQANCHMSA-N	0	3	338.495	3.121	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H]1Cc3c1cccc3Cl)CC2	ZINC001035861614	1343237985	/nfs/dbraw/zinc/23/79/85/1343237985.db2.gz	KKXWRWZWESUZJE-QGZVFWFLSA-N	0	3	344.886	3.480	20	30		EGEDHN
C/C(=C\C(=O)N1CC[C@H](NCc2ccccc2C#N)[C@@H](C)C1)C1CC1	ZINC001035938602	1343280540	/nfs/dbraw/zinc/28/05/40/1343280540.db2.gz	DSLLHYLFDAZEHA-QWSHPKPYSA-N	0	3	337.467	3.241	20	30		EGEDHN
C[C@H]1CN(C(=O)CC2CCC2)CC[C@@H]1NCc1cc(F)ccc1C#N	ZINC001035978319	1343297392	/nfs/dbraw/zinc/29/73/92/1343297392.db2.gz	REUQJBQTYGBSBS-LIRRHRJNSA-N	0	3	343.446	3.214	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@@H](NCc2ccccc2C#N)[C@H](C)C1	ZINC001036175674	1343347599	/nfs/dbraw/zinc/34/75/99/1343347599.db2.gz	SOPLVKQIYGGVJG-CRAIPNDOSA-N	0	3	327.472	3.321	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2(CF)CCC2)CC[C@@H]1NCc1ccccc1C#N	ZINC001036190270	1343354430	/nfs/dbraw/zinc/35/44/30/1343354430.db2.gz	YTBPLKPLFYGRRP-QAPCUYQASA-N	0	3	343.446	3.025	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@@H]([C@@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001036354514	1343437726	/nfs/dbraw/zinc/43/77/26/1343437726.db2.gz	YMLKRTIRTBADJW-GDBMZVCRSA-N	0	3	331.435	3.070	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)Cc1cccc(Br)c1C	ZINC001123337162	1372431325	/nfs/dbraw/zinc/43/13/25/1372431325.db2.gz	OBJIFJUFEMBMIR-ZDUSSCGKSA-N	0	3	346.228	3.393	20	30		EGEDHN
C[C@@H](NCc1cc(F)ccc1C#N)[C@H]1CCCN(C(=O)C2(C)CC2)C1	ZINC001036408392	1343469256	/nfs/dbraw/zinc/46/92/56/1343469256.db2.gz	IMIGKEMFFHYRAP-ZBFHGGJFSA-N	0	3	343.446	3.214	20	30		EGEDHN
CCCC(=O)N1CCC[C@H](C)[C@H]1CNCc1cc(C#N)ccc1OC	ZINC001036483048	1343508628	/nfs/dbraw/zinc/50/86/28/1343508628.db2.gz	AZDZZHIRTRVHBE-MAUKXSAKSA-N	0	3	343.471	3.084	20	30		EGEDHN
C[C@H]1CCCN(C(=O)CC2CC2)[C@H]1CNCc1ccc(C#N)s1	ZINC001036492110	1343514693	/nfs/dbraw/zinc/51/46/93/1343514693.db2.gz	BPZUFUVVXWRUCO-GUYCJALGSA-N	0	3	331.485	3.137	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC[C@H](C)[C@H]1CNCc1ccc(C#N)s1	ZINC001036533045	1343540343	/nfs/dbraw/zinc/54/03/43/1343540343.db2.gz	LXUMEYUTTBZZMG-SETZSJPOSA-N	0	3	331.485	3.303	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@@H]2CN(C(=O)C3CCCC3)CC[C@H]21	ZINC001036621146	1343580005	/nfs/dbraw/zinc/58/00/05/1343580005.db2.gz	PMDOKTJCESNIRW-WOJBJXKFSA-N	0	3	337.467	3.171	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@H]2[C@@H](CCN2Cc2ccc(C#N)c(F)c2)C1	ZINC001036628179	1343585546	/nfs/dbraw/zinc/58/55/46/1343585546.db2.gz	WYPPHQZXXHFTNP-HKUYNNGSSA-N	0	3	343.446	3.166	20	30		EGEDHN
O=C(CCC1CC1)N1CC[C@@H]2[C@H](CCN2CC#Cc2ccccc2)C1	ZINC001036670580	1343613571	/nfs/dbraw/zinc/61/35/71/1343613571.db2.gz	WWOUDSPXJYUGBM-NHCUHLMSSA-N	0	3	336.479	3.151	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CN(C(=O)/C=C/C4CC4)CC[C@H]32)s1	ZINC001036677561	1343618319	/nfs/dbraw/zinc/61/83/19/1343618319.db2.gz	DJXCGCGVMGMLCI-RHSHJQNGSA-N	0	3	341.480	3.009	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CN(C(=O)CC4CCC4)CC[C@H]32)s1	ZINC001036677819	1343618846	/nfs/dbraw/zinc/61/88/46/1343618846.db2.gz	IDNAMIOMRGOQGN-CRAIPNDOSA-N	0	3	343.496	3.233	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@H]2[C@H](CCN2CC#Cc2ccccc2)C1	ZINC001036686691	1343629979	/nfs/dbraw/zinc/62/99/79/1343629979.db2.gz	RDVDPWSRWDTLNC-MOPGFXCFSA-N	0	3	340.442	3.224	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@@H]2CN(C(=O)C=C3CCC3)CC[C@H]21	ZINC001036688978	1343632067	/nfs/dbraw/zinc/63/20/67/1343632067.db2.gz	BCBGIGCGFAHMAI-WOJBJXKFSA-N	0	3	335.451	3.091	20	30		EGEDHN
Cc1cocc1C(=O)N1CC[C@@H]2[C@H](CCN2CC#Cc2ccccc2)C1	ZINC001036787426	1343717022	/nfs/dbraw/zinc/71/70/22/1343717022.db2.gz	LAVSHQNCLSROHZ-TZIWHRDSSA-N	0	3	348.446	3.176	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2cc(C)no2)C1	ZINC001036793003	1343724621	/nfs/dbraw/zinc/72/46/21/1343724621.db2.gz	XQKNBYJLJHPULE-DOTOQJQBSA-N	0	3	331.460	3.008	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]2[C@H](CCN2Cc2oc(C)nc2C)C1	ZINC001036793872	1343725905	/nfs/dbraw/zinc/72/59/05/1343725905.db2.gz	MIMKNKZTKYPMNV-IAGOWNOFSA-N	0	3	345.487	3.317	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H]3[C@H](CCN3Cc3cncs3)C2)CC1	ZINC001036810459	1343744925	/nfs/dbraw/zinc/74/49/25/1343744925.db2.gz	CJTSVYBPUGKODF-AEFFLSMTSA-N	0	3	345.512	3.312	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]3[C@H](CCN3Cc3oc(C)nc3C)C2)C1	ZINC001036815958	1343753880	/nfs/dbraw/zinc/75/38/80/1343753880.db2.gz	NQSKAXQXTDSNDS-SJORKVTESA-N	0	3	343.471	3.071	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCC[C@H]1NC(=O)c1ccccc1	ZINC001036931226	1343875095	/nfs/dbraw/zinc/87/50/95/1343875095.db2.gz	QYPSEEXLNBEYAK-WOJBJXKFSA-N	0	3	333.435	3.247	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@@H]1CCC[C@@H]1NC(=O)C1CC=CC1	ZINC001036970644	1343900150	/nfs/dbraw/zinc/90/01/50/1343900150.db2.gz	PQOCGCUHPXHVEN-LPHOPBHVSA-N	0	3	341.430	3.038	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@H]1CCC[C@@H]1NC(=O)C1=CCCC1	ZINC001036981387	1343908979	/nfs/dbraw/zinc/90/89/79/1343908979.db2.gz	WRTWVAIDLHGGIN-APWZRJJASA-N	0	3	341.430	3.182	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCC[C@H]1NC(=O)C1=CCCC1	ZINC001037199151	1344036442	/nfs/dbraw/zinc/03/64/42/1344036442.db2.gz	WNKQOVMSVKDOKX-VQTJNVASSA-N	0	3	337.467	3.433	20	30		EGEDHN
CC[C@@H]1CN(C(=O)C2CCC2)CC[C@H]1NCc1cc(F)ccc1C#N	ZINC001037760971	1344075578	/nfs/dbraw/zinc/07/55/78/1344075578.db2.gz	XTOQQVKUXDJBCL-AUUYWEPGSA-N	0	3	343.446	3.214	20	30		EGEDHN
CC[C@H]1CN(C(=O)C2(C)CC2)CC[C@H]1NCc1cc(F)ccc1C#N	ZINC001037854941	1344141012	/nfs/dbraw/zinc/14/10/12/1344141012.db2.gz	SEDHBDDMRLZPIM-KBXCAEBGSA-N	0	3	343.446	3.214	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCN2C[C@H]2CCCC(F)(F)C2)cc1	ZINC001038582677	1344493324	/nfs/dbraw/zinc/49/33/24/1344493324.db2.gz	QNDGEHCFMXYTPW-FUHWJXTLSA-N	0	3	346.421	3.298	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1cnn(C2CCCCC2)c1	ZINC001038889604	1344633949	/nfs/dbraw/zinc/63/39/49/1344633949.db2.gz	LOQJUEYHZHOEMB-SFHVURJKSA-N	0	3	330.476	3.159	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C(C)(C)C(=C)C)CC[C@H]1c1ccc(F)cc1	ZINC001079155566	1357198144	/nfs/dbraw/zinc/19/81/44/1357198144.db2.gz	HAXUTJBYIKIUFN-RBUKOAKNSA-N	0	3	342.458	3.335	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)CC2CCCCC2)C[C@H]1c1cccc(F)c1	ZINC001079169823	1357199521	/nfs/dbraw/zinc/19/95/21/1357199521.db2.gz	JLFUITJSTSBWPL-VQTJNVASSA-N	0	3	342.458	3.313	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C(C)(C)C(C)C)C[C@H]1c1cccc(F)c1	ZINC001079183631	1357202913	/nfs/dbraw/zinc/20/29/13/1357202913.db2.gz	MFYAXMRCWGLBCU-ZWKOTPCHSA-N	0	3	330.447	3.025	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)c3cnccc3C)CC2)C1	ZINC001039123480	1344798334	/nfs/dbraw/zinc/79/83/34/1344798334.db2.gz	USLSSZAVOGUNFA-KRWDZBQOSA-N	0	3	347.890	3.317	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)c3ccnc(C)c3)CC2)C1	ZINC001039171336	1344861252	/nfs/dbraw/zinc/86/12/52/1344861252.db2.gz	RNMQLWIPIHSGTP-SFHVURJKSA-N	0	3	347.890	3.317	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)c3c[nH]cc3C)CC2)C1	ZINC001039173286	1344863245	/nfs/dbraw/zinc/86/32/45/1344863245.db2.gz	SDSJDAFVGXPMPV-INIZCTEOSA-N	0	3	335.879	3.250	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2sc(C)cc2C)C1	ZINC001039208909	1344921676	/nfs/dbraw/zinc/92/16/76/1344921676.db2.gz	GLNHKNTUBMDQQN-IRXDYDNUSA-N	0	3	330.497	3.315	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)CC2CC(F)(F)C2)C1	ZINC001039211977	1344926806	/nfs/dbraw/zinc/92/68/06/1344926806.db2.gz	HRNIJMMXVDNUEG-IRXDYDNUSA-N	0	3	338.442	3.148	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cccc(C)c2F)C1	ZINC001039213056	1344928157	/nfs/dbraw/zinc/92/81/57/1344928157.db2.gz	ZRGALQAPKNSDMS-SJLPKXTDSA-N	0	3	328.431	3.084	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccn3ccccc23)C1	ZINC001039215614	1344931455	/nfs/dbraw/zinc/93/14/55/1344931455.db2.gz	LLPNXMOUPKCQQM-AZUAARDMSA-N	0	3	349.478	3.279	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(CC)s2)C1	ZINC001039218075	1344934808	/nfs/dbraw/zinc/93/48/08/1344934808.db2.gz	KJEFVWLXRQDMSQ-NVXWUHKLSA-N	0	3	330.497	3.260	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccc3ncccc3c2)C1	ZINC001039224496	1344942329	/nfs/dbraw/zinc/94/23/29/1344942329.db2.gz	GSEGQPVKWRZBJF-FPOVZHCZSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccoc2C2CC2)C1	ZINC001039225043	1344942537	/nfs/dbraw/zinc/94/25/37/1344942537.db2.gz	KZSQMZHNPHNTEP-AEFFLSMTSA-N	0	3	326.440	3.107	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc3ccc(C)cc3[nH]2)C1	ZINC001039226007	1344944240	/nfs/dbraw/zinc/94/42/40/1344944240.db2.gz	RHBWSTHVVOCFLD-GHTZIAJQSA-N	0	3	349.478	3.426	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cccc3cc[nH]c32)C1	ZINC001039236412	1344958006	/nfs/dbraw/zinc/95/80/06/1344958006.db2.gz	BTHLDGKXXSLKPQ-HKUYNNGSSA-N	0	3	335.451	3.118	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc(C)c(C)s2)C1	ZINC001039238503	1344962315	/nfs/dbraw/zinc/96/23/15/1344962315.db2.gz	IQHRMAVPGGBZSS-DLBZAZTESA-N	0	3	330.497	3.315	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2nc(C)c(C)s2)C1	ZINC001039242498	1344969150	/nfs/dbraw/zinc/96/91/50/1344969150.db2.gz	PDTSCDILGGNDDJ-DLBZAZTESA-N	0	3	345.512	3.100	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2oc(CC)cc2C)C1	ZINC001039247179	1344977117	/nfs/dbraw/zinc/97/71/17/1344977117.db2.gz	UTVJKEPJKQBTGJ-IEBWSBKVSA-N	0	3	342.483	3.490	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccc(C(F)F)o2)C1	ZINC001039248940	1344979850	/nfs/dbraw/zinc/97/98/50/1344979850.db2.gz	FUNQRWBEMLGTLO-UONOGXRCSA-N	0	3	336.382	3.167	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cccc3ccncc32)C1	ZINC001039258391	1344986858	/nfs/dbraw/zinc/98/68/58/1344986858.db2.gz	XCCPPRYODIHGTR-NQIIRXRSSA-N	0	3	347.462	3.185	20	30		EGEDHN
N#Cc1ccccc1CNC1C[C@H]2CCC[C@@H](C1)N2C(=O)c1ccoc1	ZINC001039265131	1344989527	/nfs/dbraw/zinc/98/95/27/1344989527.db2.gz	PFXYYIUEYXSRMN-IHWFROFDSA-N	0	3	349.434	3.467	20	30		EGEDHN
C=CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cnc([C@@H](C)OC)s1	ZINC001039375101	1345033042	/nfs/dbraw/zinc/03/30/42/1345033042.db2.gz	RMLYVGZWOWRUAO-KFWWJZLASA-N	0	3	349.500	3.106	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C1([C@H]2CCCCO2)CCC1	ZINC001039403647	1345049415	/nfs/dbraw/zinc/04/94/15/1345049415.db2.gz	HMXMLSOJOCKXNN-CEXWTWQISA-N	0	3	346.515	3.367	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)c1c(F)cccc1F	ZINC001039406325	1345051289	/nfs/dbraw/zinc/05/12/89/1345051289.db2.gz	PJFRAGCIYGXKOK-OAGGEKHMSA-N	0	3	346.421	3.157	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H]1CCC(C)(C)CO1	ZINC001039408295	1345052689	/nfs/dbraw/zinc/05/26/89/1345052689.db2.gz	JDAOPKPXWXLMAW-SQNIBIBYSA-N	0	3	334.504	3.223	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1C[C@H]1c1ccccc1C	ZINC001039452822	1345075826	/nfs/dbraw/zinc/07/58/26/1345075826.db2.gz	QPNJQDUGZNHPCQ-YXYSEUPNSA-N	0	3	336.479	3.187	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)c1cc(C)oc1C	ZINC001039453465	1345076201	/nfs/dbraw/zinc/07/62/01/1345076201.db2.gz	DLZPMKMYUWXRKL-JQHSSLGASA-N	0	3	328.456	3.089	20	30		EGEDHN
C=CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc2c(s1)CCC2	ZINC001039466154	1345084357	/nfs/dbraw/zinc/08/43/57/1345084357.db2.gz	VDMXCHAFGSMXDE-CVEARBPZSA-N	0	3	330.497	3.492	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)COc1ccc(C)cc1	ZINC001039466983	1345084790	/nfs/dbraw/zinc/08/47/90/1345084790.db2.gz	PPDKCEWGIWDDAU-MSOLQXFVSA-N	0	3	328.456	3.015	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)Cc1ccccc1C	ZINC001039475779	1345090146	/nfs/dbraw/zinc/09/01/46/1345090146.db2.gz	JFOIHVOIZRNTMW-NRSPTQNISA-N	0	3	338.495	3.262	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccccc1N(C)C	ZINC001039476686	1345091223	/nfs/dbraw/zinc/09/12/23/1345091223.db2.gz	IQTKDMRNNDRSLE-SJORKVTESA-N	0	3	327.472	3.008	20	30		EGEDHN
C=CCn1cccc1C(=O)N1C[C@H]2CCC[C@@H](C1)N2CCC1CC1	ZINC001039644719	1345152808	/nfs/dbraw/zinc/15/28/08/1345152808.db2.gz	RWMZKTXRHANDPV-HDICACEKSA-N	0	3	327.472	3.153	20	30		EGEDHN
Cc1cc(CN2CCC[C@@]3(CCN(C(=O)C#CC4CC4)C3)C2)cs1	ZINC001040196115	1345371078	/nfs/dbraw/zinc/37/10/78/1345371078.db2.gz	BRQOUOBATLNUNF-HXUWFJFHSA-N	0	3	342.508	3.284	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)CCc3ccsc3)C2)C1	ZINC001040242550	1345392747	/nfs/dbraw/zinc/39/27/47/1345392747.db2.gz	YTYRQVNYIJDVON-LJQANCHMSA-N	0	3	330.497	3.019	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3c(C)[nH]c4ccccc43)C2)C1	ZINC001040285015	1345412336	/nfs/dbraw/zinc/41/23/36/1345412336.db2.gz	ZYDMAFVSZJQNJC-NRFANRHFSA-N	0	3	335.451	3.038	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@@H]3C[C@@H]4CCCC[C@H]34)C2)C1	ZINC001040301532	1345422229	/nfs/dbraw/zinc/42/22/29/1345422229.db2.gz	AKMWIIDYBNARSI-HUUJSLGLSA-N	0	3	328.500	3.151	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@]2(C1)CCCN(Cc1cncc(C)c1)C2	ZINC001040328422	1345435213	/nfs/dbraw/zinc/43/52/13/1345435213.db2.gz	LZSPPKHBIOYNNU-NRFANRHFSA-N	0	3	341.499	3.417	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)C[C@@H]3CCCC3(F)F)C2)C1	ZINC001040353306	1345449746	/nfs/dbraw/zinc/44/97/46/1345449746.db2.gz	HTBLIGCRVXBESE-WMZOPIPTSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3ccccc3C3(C)CC3)C2)C1	ZINC001040390332	1345472597	/nfs/dbraw/zinc/47/25/97/1345472597.db2.gz	IYQKLXLUSBSDIU-JOCHJYFZSA-N	0	3	336.479	3.299	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@@H](CC)Cc3ccccc3)C2)C1	ZINC001040431558	1345494714	/nfs/dbraw/zinc/49/47/14/1345494714.db2.gz	PPMGQSXRWLPPIQ-RBBKRZOGSA-N	0	3	338.495	3.203	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@@H](C)c3ccc(C)o3)C2)C1	ZINC001040433945	1345497407	/nfs/dbraw/zinc/49/74/07/1345497407.db2.gz	BCQUISVWEDOKLK-PXNSSMCTSA-N	0	3	328.456	3.029	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cc([C@H](C)CC)no3)C2)C1	ZINC001040434714	1345498027	/nfs/dbraw/zinc/49/80/27/1345498027.db2.gz	KGZQJXCROTUXNM-OXQOHEQNSA-N	0	3	343.471	3.140	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3cccc(C)c3Cl)C2)C1	ZINC001040454917	1345509122	/nfs/dbraw/zinc/50/91/22/1345509122.db2.gz	YYNLRMPXKYYOCP-LJQANCHMSA-N	0	3	330.859	3.210	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)C(C)(C)Cc3ccccc3)C2)C1	ZINC001040484392	1345515711	/nfs/dbraw/zinc/51/57/11/1345515711.db2.gz	OEDKQORRNXOTTR-JOCHJYFZSA-N	0	3	338.495	3.203	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)Cc3cc(C)ccc3F)C2)C1	ZINC001040503844	1345523825	/nfs/dbraw/zinc/52/38/25/1345523825.db2.gz	VHQGBSKEWYHTQP-OAQYLSRUSA-N	0	3	342.458	3.014	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(C(F)F)o3)C2)C1	ZINC001040511732	1345526724	/nfs/dbraw/zinc/52/67/24/1345526724.db2.gz	ACCDJJPLJYTPRQ-GOSISDBHSA-N	0	3	336.382	3.169	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3ccc(F)cc3Cl)C2)C1	ZINC001040514746	1345528074	/nfs/dbraw/zinc/52/80/74/1345528074.db2.gz	FECVXWHEGVJVNF-SFHVURJKSA-N	0	3	334.822	3.040	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)CCc3c[nH]c4ccccc34)C2)C1	ZINC001040514410	1345528446	/nfs/dbraw/zinc/52/84/46/1345528446.db2.gz	CCNRCINKDTZLDC-JOCHJYFZSA-N	0	3	349.478	3.048	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CCN(C(=O)CC4CC4)C3)CC2)c1	ZINC001040574961	1345547980	/nfs/dbraw/zinc/54/79/80/1345547980.db2.gz	BNULHDACQDHABK-UHFFFAOYSA-N	0	3	337.467	3.173	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC2(C1)CCN(Cc1ccc(Cl)cc1)CC2	ZINC001040644383	1345559251	/nfs/dbraw/zinc/55/92/51/1345559251.db2.gz	OCYDGOKELNGGKN-OAHLLOKOSA-N	0	3	345.874	3.314	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001040660117	1345562385	/nfs/dbraw/zinc/56/23/85/1345562385.db2.gz	BRFILNOSIIYULL-IJUHEHPCSA-N	0	3	337.467	3.339	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@@H]3CCC=CCCC3)C2)CC1	ZINC001040745098	1345573349	/nfs/dbraw/zinc/57/33/49/1345573349.db2.gz	HUJLUDIQMWGWRM-LJQANCHMSA-N	0	3	328.500	3.461	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cc(C)sc3C)C2)CC1	ZINC001040764569	1345576145	/nfs/dbraw/zinc/57/61/45/1345576145.db2.gz	YRLMQFJEYAHQMW-UHFFFAOYSA-N	0	3	330.497	3.316	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3coc(C(F)F)c3)C2)CC1	ZINC001040823501	1345583031	/nfs/dbraw/zinc/58/30/31/1345583031.db2.gz	RNOYCBPTSGQORK-UHFFFAOYSA-N	0	3	336.382	3.169	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cc(C)cc(F)c3)C2)CC1	ZINC001040862338	1345588966	/nfs/dbraw/zinc/58/89/66/1345588966.db2.gz	KBPUZAGFBZITHP-UHFFFAOYSA-N	0	3	328.431	3.086	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CCN(C(=O)[C@@H]4CC45CC5)C3)CC2)c1	ZINC001040865007	1345589617	/nfs/dbraw/zinc/58/96/17/1345589617.db2.gz	NJUARGQSUKEPLH-IBGZPJMESA-N	0	3	349.478	3.173	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@@H]3C[C@H]3c3ccccc3)C2)CC1	ZINC001040918461	1345599871	/nfs/dbraw/zinc/59/98/71/1345599871.db2.gz	BJAUOBOHBKLXBD-VQTJNVASSA-N	0	3	336.479	3.128	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)Cc3ccc(C)c(C)c3)C2)CC1	ZINC001040931953	1345604309	/nfs/dbraw/zinc/60/43/09/1345604309.db2.gz	XKQBQTUGLNBPKH-UHFFFAOYSA-N	0	3	338.495	3.184	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@]3(CCN(C(=O)C[C@H]4C=CCC4)C3)C2)cc1	ZINC001041053382	1345637738	/nfs/dbraw/zinc/63/77/38/1345637738.db2.gz	JBPLHWKDOXDCFL-AVRDEDQJSA-N	0	3	349.478	3.339	20	30		EGEDHN
Cc1cc(Cl)ccc1CN1CC[C@]2(CCN(C(=O)[C@H](C)C#N)C2)C1	ZINC001041146290	1345660197	/nfs/dbraw/zinc/66/01/97/1345660197.db2.gz	MBQXGIVLCOBRJZ-BEFAXECRSA-N	0	3	345.874	3.233	20	30		EGEDHN
Cc1cc(Cl)ccc1CN1CC[C@@]2(CCN(C(=O)[C@@H](C)C#N)C2)C1	ZINC001041146297	1345660422	/nfs/dbraw/zinc/66/04/22/1345660422.db2.gz	MBQXGIVLCOBRJZ-HNAYVOBHSA-N	0	3	345.874	3.233	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@]3(CCN(C(=O)CC4CCC4)C3)C2)c1	ZINC001041168480	1345664034	/nfs/dbraw/zinc/66/40/34/1345664034.db2.gz	CWWAUWORTOLPOF-OAQYLSRUSA-N	0	3	337.467	3.173	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@]3(CCN(C(=O)CC4CCC4)C3)C2)cc1	ZINC001041169103	1345664644	/nfs/dbraw/zinc/66/46/44/1345664644.db2.gz	HMMFRZCVHDZONG-NRFANRHFSA-N	0	3	337.467	3.173	20	30		EGEDHN
C[C@H](c1ccccc1F)N1CC[C@@]2(CCN(C(=O)C#CC3CC3)C2)C1	ZINC001041265575	1345689748	/nfs/dbraw/zinc/68/97/48/1345689748.db2.gz	JTHVKBFINYLVBC-IIBYNOLFSA-N	0	3	340.442	3.225	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cccc(OCCC)c3)C2)C1	ZINC001041336970	1345705493	/nfs/dbraw/zinc/70/54/93/1345705493.db2.gz	WJSUURFPDLWGGV-OAQYLSRUSA-N	0	3	340.467	3.037	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3coc4cc(F)ccc43)C2)C1	ZINC001041428085	1345726376	/nfs/dbraw/zinc/72/63/76/1345726376.db2.gz	MNLZLDAUHJQZFA-FQEVSTJZSA-N	0	3	340.398	3.133	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cn(CC)c4ccccc34)C2)C1	ZINC001041452178	1345731432	/nfs/dbraw/zinc/73/14/32/1345731432.db2.gz	AIECWIULOFETOY-JOCHJYFZSA-N	0	3	349.478	3.223	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)Cc3cc4ccccc4s3)C2)C1	ZINC001041467691	1345736795	/nfs/dbraw/zinc/73/67/95/1345736795.db2.gz	ODNPQVXSNDQVFC-FQEVSTJZSA-N	0	3	338.476	3.001	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@]2(CCN(Cc3cccnc3)C2)C1	ZINC001041537563	1345755027	/nfs/dbraw/zinc/75/50/27/1345755027.db2.gz	ZBIDAKYCCMAYAH-FQEVSTJZSA-N	0	3	327.472	3.108	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@]2(CCN(Cc3ccccc3F)C2)C1	ZINC001041543963	1345758892	/nfs/dbraw/zinc/75/88/92/1345758892.db2.gz	MEQOKZPICKDDPQ-FQEVSTJZSA-N	0	3	330.447	3.462	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@]2(CCN(Cc3cncc(C)c3)C2)C1	ZINC001041626473	1345801489	/nfs/dbraw/zinc/80/14/89/1345801489.db2.gz	UKJGIIVFBOGCDO-NHCUHLMSSA-N	0	3	341.499	3.417	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@]3(CCN(Cc4ncccc4C)C3)C2)C1	ZINC001041653160	1345812037	/nfs/dbraw/zinc/81/20/37/1345812037.db2.gz	PREWOBTYKWIJHV-NRFANRHFSA-N	0	3	339.483	3.171	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)[C@H]3CC[C@H](C(C)C)CC3)C2)C1	ZINC001041759948	1345841695	/nfs/dbraw/zinc/84/16/95/1345841695.db2.gz	ZCNPLPOQUSIYGY-ZJOUEHCJSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cccn3C3CCCC3)C2)C1	ZINC001041761937	1345841984	/nfs/dbraw/zinc/84/19/84/1345841984.db2.gz	VNZYFCPOGKWPHA-OAQYLSRUSA-N	0	3	339.483	3.165	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)[C@H](CC)Cc3ccccc3C)C2)C1	ZINC001041785017	1345849457	/nfs/dbraw/zinc/84/94/57/1345849457.db2.gz	XFCFAZLMCPHKED-DENIHFKCSA-N	0	3	338.495	3.121	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001041799564	1345854598	/nfs/dbraw/zinc/85/45/98/1345854598.db2.gz	CJOFNMOLKZJZSS-HXUWFJFHSA-N	0	3	325.456	3.029	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3cc(Cl)cc(Cl)c3)C2)C1	ZINC001041800944	1345855337	/nfs/dbraw/zinc/85/53/37/1345855337.db2.gz	CAVPWPIWPXZIPU-KRWDZBQOSA-N	0	3	337.250	3.165	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3cc(Cl)ccc3Cl)C2)C1	ZINC001041801255	1345855717	/nfs/dbraw/zinc/85/57/17/1345855717.db2.gz	IQZSCBSDDBTYCS-KRWDZBQOSA-N	0	3	337.250	3.165	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3ccc(-c4cccs4)o3)C2)C1	ZINC001041811580	1345859065	/nfs/dbraw/zinc/85/90/65/1345859065.db2.gz	CHLUHKATGGGAGG-LJQANCHMSA-N	0	3	340.448	3.179	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccc(F)cc3Cl)C2)C1	ZINC001041813885	1345860106	/nfs/dbraw/zinc/86/01/06/1345860106.db2.gz	IGDGAWBBWBXYJW-SFHVURJKSA-N	0	3	334.822	3.040	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)CCc3ccc(CC)cc3)C2)C1	ZINC001041822187	1345863813	/nfs/dbraw/zinc/86/38/13/1345863813.db2.gz	PEBXNJXDSSTOOW-QFIPXVFZSA-N	0	3	338.495	3.129	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)[C@@H](C)Cc3ccccc3C)C2)C1	ZINC001041850961	1345872975	/nfs/dbraw/zinc/87/29/75/1345872975.db2.gz	SDVPNXKEAUMNHW-UGKGYDQZSA-N	0	3	338.495	3.121	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cccc4c(C)c(C)[nH]c43)C[C@H]21	ZINC001042114903	1345947772	/nfs/dbraw/zinc/94/77/72/1345947772.db2.gz	PSVMRWYCCSJKFW-FXAWDEMLSA-N	0	3	349.478	3.344	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cn(CC)c4ccccc34)C[C@H]21	ZINC001042142057	1345955031	/nfs/dbraw/zinc/95/50/31/1345955031.db2.gz	KVOFYNYPZSCQMB-DYESRHJHSA-N	0	3	349.478	3.221	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C3(c4ccccc4)CCC3)C[C@H]21	ZINC001042142553	1345955082	/nfs/dbraw/zinc/95/50/82/1345955082.db2.gz	OVUJAZVNHAZYHE-UYAOXDASSA-N	0	3	336.479	3.054	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3cccc(C#N)c3)[C@@H]2C1	ZINC001042185777	1345973750	/nfs/dbraw/zinc/97/37/50/1345973750.db2.gz	XMFQQKCWPXCTOZ-RTBURBONSA-N	0	3	337.467	3.193	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@H]2C1	ZINC001042208900	1345987154	/nfs/dbraw/zinc/98/71/54/1345987154.db2.gz	UPWJPTJRAIKANH-OALUTQOASA-N	0	3	339.483	3.417	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccccc3C3(C)CC3)C[C@@H]21	ZINC001042232430	1345998383	/nfs/dbraw/zinc/99/83/83/1345998383.db2.gz	LUQHCEBTFTZBHD-PXNSSMCTSA-N	0	3	336.479	3.298	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)c3ccc(F)c4ccccc34)C[C@@H]21	ZINC001042238880	1346000064	/nfs/dbraw/zinc/00/00/64/1346000064.db2.gz	AEHVOLFILSTDGV-QRWLVFNGSA-N	0	3	336.410	3.149	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3ccn(C(CC)CC)n3)C[C@H]21	ZINC001042257219	1346008139	/nfs/dbraw/zinc/00/81/39/1346008139.db2.gz	FHWOAQSIGODZPL-VQIMIIECSA-N	0	3	344.503	3.357	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(-c4ccccc4)nc3)C[C@@H]21	ZINC001042282507	1346015998	/nfs/dbraw/zinc/01/59/98/1346015998.db2.gz	DYYICXCRXMAYML-RXVVDRJESA-N	0	3	347.462	3.471	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(-c4ccccc4)ccn3)C[C@H]21	ZINC001042288524	1346018594	/nfs/dbraw/zinc/01/85/94/1346018594.db2.gz	UAMWMWBCVYZNAM-GHTZIAJQSA-N	0	3	347.462	3.471	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cccn3C3CCCC3)C[C@@H]21	ZINC001042290000	1346018911	/nfs/dbraw/zinc/01/89/11/1346018911.db2.gz	NDWDLGJAOHFHJK-PXNSSMCTSA-N	0	3	339.483	3.163	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cccc(-c4cnco4)c3)C[C@H]21	ZINC001042297453	1346022130	/nfs/dbraw/zinc/02/21/30/1346022130.db2.gz	PDIRSSDCVFFWCR-CRAIPNDOSA-N	0	3	337.423	3.064	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3cc4cccnc4s3)C[C@@H]21	ZINC001042299907	1346023678	/nfs/dbraw/zinc/02/36/78/1346023678.db2.gz	SBLQLHTZKVVOBN-HOCLYGCPSA-N	0	3	341.480	3.409	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(C)n(CC4CC4)c3C)C[C@H]21	ZINC001042315794	1346030162	/nfs/dbraw/zinc/03/01/62/1346030162.db2.gz	CNKRLHISOSLLCT-AZUAARDMSA-N	0	3	341.499	3.237	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3cc4nc(C)ccc4o3)C[C@@H]21	ZINC001042324540	1346033856	/nfs/dbraw/zinc/03/38/56/1346033856.db2.gz	WESVGJYTSYYOTR-WBVHZDCISA-N	0	3	339.439	3.249	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3coc4ccc(F)cc34)C[C@H]21	ZINC001042326078	1346034785	/nfs/dbraw/zinc/03/47/85/1346034785.db2.gz	LIKKVHZZZUVKRD-CXAGYDPISA-N	0	3	328.387	3.294	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)CCc3ccccc3Cl)C[C@@H]21	ZINC001042341323	1346045907	/nfs/dbraw/zinc/04/59/07/1346045907.db2.gz	MTFHICMXDYEILO-HKUYNNGSSA-N	0	3	344.886	3.219	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3cc(C)c(CC)s3)C[C@@H]21	ZINC001042341010	1346046375	/nfs/dbraw/zinc/04/63/75/1346046375.db2.gz	JQFFTZBWBJQKDP-CVEARBPZSA-N	0	3	330.497	3.179	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3sc(C(C)C)nc3C)C[C@@H]21	ZINC001042355208	1346052693	/nfs/dbraw/zinc/05/26/93/1346052693.db2.gz	WVAWNCBKVHTRAR-CVEARBPZSA-N	0	3	345.512	3.135	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(OC4CCC4)cc3)C[C@H]21	ZINC001042362310	1346056445	/nfs/dbraw/zinc/05/64/45/1346056445.db2.gz	JJYQUEVEZUKALE-OXQOHEQNSA-N	0	3	340.467	3.340	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3csc(CC(C)C)n3)C[C@H]21	ZINC001042372739	1346061929	/nfs/dbraw/zinc/06/19/29/1346061929.db2.gz	ATXWDNNHINEYNO-GOEBONIOSA-N	0	3	333.501	3.064	20	30		EGEDHN
C[C@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)C1CCCC1	ZINC001044413175	1346321162	/nfs/dbraw/zinc/32/11/62/1346321162.db2.gz	NNRFRAZSXFZPIU-KXBFYZLASA-N	0	3	325.456	3.218	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)C1CC(F)(F)C1	ZINC001044545465	1346366132	/nfs/dbraw/zinc/36/61/32/1346366132.db2.gz	QGSGYHOAJWNQOO-DYVFJYSZSA-N	0	3	347.409	3.073	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)/C=C/c1ccc[nH]1	ZINC001044570482	1346371532	/nfs/dbraw/zinc/37/15/32/1346371532.db2.gz	IQPPMZOVJZOPEV-LMFNFFQTSA-N	0	3	348.450	3.069	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)Cc2ccsc2)s1	ZINC001044908307	1346460533	/nfs/dbraw/zinc/46/05/33/1346460533.db2.gz	MHSJXFSOBOBGIG-AWEZNQCLSA-N	0	3	345.493	3.005	20	30		EGEDHN
C[C@H](NC[C@@H]1CCCN1C(=O)C#CC1CC1)c1cc(F)ccc1F	ZINC001045028730	1346483372	/nfs/dbraw/zinc/48/33/72/1346483372.db2.gz	KMEXHDBHTMJWAY-BBRMVZONSA-N	0	3	332.394	3.020	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]1CNCc1cn(C(C)C)nc1C	ZINC001045148329	1346506123	/nfs/dbraw/zinc/50/61/23/1346506123.db2.gz	USZPNYKQNCNDLT-KRWDZBQOSA-N	0	3	332.492	3.065	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H]1CNCc1cnc(Cl)s1	ZINC001045181255	1346517277	/nfs/dbraw/zinc/51/72/77/1346517277.db2.gz	AAJMSYQXYIHXPH-BLLLJJGKSA-N	0	3	341.908	3.479	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)[C@@H]2C[C@H]2C2CCC2)s1	ZINC001045237050	1346538141	/nfs/dbraw/zinc/53/81/41/1346538141.db2.gz	ZHNZCOOZBVXMKL-JCGIZDLHSA-N	0	3	343.496	3.137	20	30		EGEDHN
Cc1cc(CN2CCC(C)(NC(=O)c3c[nH]c(C#N)c3)CC2)cs1	ZINC001045411704	1346587657	/nfs/dbraw/zinc/58/76/57/1346587657.db2.gz	QNVJJAWBRZBMFK-UHFFFAOYSA-N	0	3	342.468	3.041	20	30		EGEDHN
C=C(Cl)CN1CCC(C)(NC(=O)c2n[nH]c3ccc(C)cc32)CC1	ZINC001045491130	1346607751	/nfs/dbraw/zinc/60/77/51/1346607751.db2.gz	NDESYRLFDSKVIS-UHFFFAOYSA-N	0	3	346.862	3.208	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2cc(F)cc3cccnc32)CC1	ZINC001045576932	1346634347	/nfs/dbraw/zinc/63/43/47/1346634347.db2.gz	FAMZULNHQIRNKG-UHFFFAOYSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1cnccc1C	ZINC001045827561	1346710582	/nfs/dbraw/zinc/71/05/82/1346710582.db2.gz	OMWFHBOVSJYWHH-MSOLQXFVSA-N	0	3	327.472	3.168	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]3CC[C@@H](C2)N3Cc2ccc(C#N)cc2)C1	ZINC001045845129	1346719421	/nfs/dbraw/zinc/71/94/21/1346719421.db2.gz	VRDGNEKVZCLSFD-UXHICEINSA-N	0	3	349.478	3.480	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1sccc1C)C2	ZINC001045908698	1346745737	/nfs/dbraw/zinc/74/57/37/1346745737.db2.gz	JONMXNUUQSMDEW-LJQANCHMSA-N	0	3	330.497	3.398	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1c(C)coc1C)C2	ZINC001045936038	1346772717	/nfs/dbraw/zinc/77/27/17/1346772717.db2.gz	ZSDZDISOOMUMLW-FQEVSTJZSA-N	0	3	328.456	3.238	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc3occc3c1)C2	ZINC001045940431	1346776732	/nfs/dbraw/zinc/77/67/32/1346776732.db2.gz	YOEDAIBTSYYZHS-NRFANRHFSA-N	0	3	336.435	3.384	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1c(C)cc(F)cc1C)C2	ZINC001045956661	1346791012	/nfs/dbraw/zinc/79/10/12/1346791012.db2.gz	SACBFPLXMOUHPW-NRFANRHFSA-N	0	3	342.458	3.394	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc[nH]c1C1CC1)C2	ZINC001045960619	1346795359	/nfs/dbraw/zinc/79/53/59/1346795359.db2.gz	OLBRVSGPPNDELE-OAQYLSRUSA-N	0	3	339.483	3.234	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H](C)Cc1ccco1)C2	ZINC001045972373	1346808459	/nfs/dbraw/zinc/80/84/59/1346808459.db2.gz	ZHAFYRFWMIUXFK-RXVVDRJESA-N	0	3	342.483	3.186	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc(CC)c(CC)o1)C2	ZINC001045980422	1346817400	/nfs/dbraw/zinc/81/74/00/1346817400.db2.gz	YDCORKLWUAMPSI-OAQYLSRUSA-N	0	3	342.483	3.356	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc3c(s1)CCC3)C2	ZINC001045984202	1346824535	/nfs/dbraw/zinc/82/45/35/1346824535.db2.gz	XLXHJZOBBKNXEB-HXUWFJFHSA-N	0	3	342.508	3.188	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@]2(C)CCN(Cc3ccc(CC)cc3)C2)cn1	ZINC001046779336	1347096378	/nfs/dbraw/zinc/09/63/78/1347096378.db2.gz	RIWGSCYOJILOHT-QFIPXVFZSA-N	0	3	347.462	3.020	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@]2(C)CCN([C@H](C)c3ccccc3)C2)nc1	ZINC001046782987	1347098364	/nfs/dbraw/zinc/09/83/64/1347098364.db2.gz	HVNKDBCOHGIBGA-IIBYNOLFSA-N	0	3	333.435	3.018	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2cc(C)oc2C)C1	ZINC001046919577	1347153805	/nfs/dbraw/zinc/15/38/05/1347153805.db2.gz	VSQZEYFBNNIABJ-AWEZNQCLSA-N	0	3	326.387	3.160	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@H](CNC(=O)[C@@H]2CCC(C)=C(C)C2)C1	ZINC001046941719	1347158316	/nfs/dbraw/zinc/15/83/16/1347158316.db2.gz	PLAFWLFTMQSEPL-IAGOWNOFSA-N	0	3	338.442	3.220	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2cccc3[nH]ccc32)C1	ZINC001046973542	1347172747	/nfs/dbraw/zinc/17/27/47/1347172747.db2.gz	OADYMVGKHSPHIB-AWEZNQCLSA-N	0	3	347.409	3.431	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2c(C)cccc2F)C1	ZINC001046995514	1347178115	/nfs/dbraw/zinc/17/81/15/1347178115.db2.gz	KDECJZILVMGYED-AWEZNQCLSA-N	0	3	340.389	3.397	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)N(CC#Cc2ccccc2)C3)o1	ZINC001047018473	1347188896	/nfs/dbraw/zinc/18/88/96/1347188896.db2.gz	JHBHBCCMTOKUIK-ZCNNSNEGSA-N	0	3	348.446	3.222	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)N(Cc2conc2CC)C3)C1	ZINC001047143454	1347219292	/nfs/dbraw/zinc/21/92/92/1347219292.db2.gz	OAMFQMPRCPBIKO-UAGQMJEPSA-N	0	3	343.471	3.062	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3sccc3C)C2)CC1	ZINC001047214638	1347246618	/nfs/dbraw/zinc/24/66/18/1347246618.db2.gz	FCPUKFILGCBYPC-KRWDZBQOSA-N	0	3	330.497	3.254	20	30		EGEDHN
CC(=O)N1CCC[C@@H](C2CCN(Cc3ccc(C#N)s3)CC2)C1	ZINC001047218192	1347248741	/nfs/dbraw/zinc/24/87/41/1347248741.db2.gz	DAQMDXGHOSAHPG-MRXNPFEDSA-N	0	3	331.485	3.090	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)CCc3ccco3)C2)CC1	ZINC001047224860	1347254943	/nfs/dbraw/zinc/25/49/43/1347254943.db2.gz	KAPMOLRWQHNUJG-IBGZPJMESA-N	0	3	342.483	3.186	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)C(C)(C)C(=C)Cl)C2)CC1	ZINC001047239765	1347265905	/nfs/dbraw/zinc/26/59/05/1347265905.db2.gz	UMHCSWFUBFBLKQ-KRWDZBQOSA-N	0	3	336.907	3.349	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)C(C)(C)C3CC3)C2)CC1	ZINC001047249073	1347273989	/nfs/dbraw/zinc/27/39/89/1347273989.db2.gz	RMLPVHXBBQRRCJ-GOSISDBHSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@]34C[C@H]3CCCC4)C2)CC1	ZINC001047255374	1347279291	/nfs/dbraw/zinc/27/92/91/1347279291.db2.gz	XNCNOUQAHKHHSC-SFHLNBCPSA-N	0	3	328.500	3.151	20	30		EGEDHN
C[C@@H](NCc1cc(F)ccc1C#N)[C@H]1CCN(C(=O)CC(C)(C)C)C1	ZINC001047711942	1347344662	/nfs/dbraw/zinc/34/46/62/1347344662.db2.gz	DISKFWONJSNKET-ZBFHGGJFSA-N	0	3	345.462	3.460	20	30		EGEDHN
Cc1ccoc1C(=O)N1CC[C@@H]([C@@H](C)NCc2ccccc2C#N)C1	ZINC001047726580	1347352070	/nfs/dbraw/zinc/35/20/70/1347352070.db2.gz	SUCWSVDSXBGEDZ-CRAIPNDOSA-N	0	3	337.423	3.100	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)C2CC(C)(C)C2)C1	ZINC001047829771	1347382838	/nfs/dbraw/zinc/38/28/38/1347382838.db2.gz	IIBSROOMGVMSEN-QAPCUYQASA-N	0	3	339.483	3.321	20	30		EGEDHN
Cc1cocc1C(=O)N1CC[C@H]([C@H](C)NCc2ccccc2C#N)C1	ZINC001047922714	1347410554	/nfs/dbraw/zinc/41/05/54/1347410554.db2.gz	AWDDYOCZZMXRBS-YJBOKZPZSA-N	0	3	337.423	3.100	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]([C@H](C)NCc2csc(C)n2)C1	ZINC001047924336	1347411118	/nfs/dbraw/zinc/41/11/18/1347411118.db2.gz	NFSBBCJARNZXDW-DZGCQCFKSA-N	0	3	335.517	3.380	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]([C@@H](C)NCc3nc(C)cs3)C2)C1	ZINC001047972035	1347430151	/nfs/dbraw/zinc/43/01/51/1347430151.db2.gz	OKOHNPZQWXBBQI-CABCVRRESA-N	0	3	333.501	3.134	20	30		EGEDHN
C[C@H]1CN(C(=O)CC(C)(C)C)C[C@@H]1CNCc1cc(F)ccc1C#N	ZINC001048149939	1347481729	/nfs/dbraw/zinc/48/17/29/1347481729.db2.gz	YILWTSCYLWBBHV-YOEHRIQHSA-N	0	3	345.462	3.318	20	30		EGEDHN
C/C(=C/C(=O)N1C[C@H](C)[C@@H](CNCc2ccccc2C#N)C1)C1CC1	ZINC001048166670	1347485045	/nfs/dbraw/zinc/48/50/45/1347485045.db2.gz	UQJXLACOOBYYMQ-GEUTUFQVSA-N	0	3	337.467	3.099	20	30		EGEDHN
C[C@H]1CN(C(=O)CC2CCC2)C[C@H]1CNCc1cc(F)ccc1C#N	ZINC001048191254	1347488854	/nfs/dbraw/zinc/48/88/54/1347488854.db2.gz	BWCXNLZKGJGDKB-KBXCAEBGSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](C)[C@H](CNCc2cc(C3CC3)no2)C1	ZINC001048340824	1347523794	/nfs/dbraw/zinc/52/37/94/1347523794.db2.gz	UJKVVJURJUWRDI-GOEBONIOSA-N	0	3	345.487	3.338	20	30		EGEDHN
Cc1ccc(C(=O)N2C[C@@H](CNCc3ccccc3C#N)[C@H](C)C2)cc1	ZINC001048455154	1347555565	/nfs/dbraw/zinc/55/55/65/1347555565.db2.gz	PRFUATPMRFOPBM-DYESRHJHSA-N	0	3	347.462	3.365	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc(CCC)c(C)s3)C[C@@H]2C1	ZINC001049206145	1347747371	/nfs/dbraw/zinc/74/73/71/1347747371.db2.gz	UGWINMHQESCKIM-CALCHBBNSA-N	0	3	330.497	3.036	20	30		EGEDHN
C/C(=C/C(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1cccc(C#N)c1)C1CC1	ZINC001049337900	1347796766	/nfs/dbraw/zinc/79/67/66/1347796766.db2.gz	CEHHBJQTLLUUNZ-HEUNSUFQSA-N	0	3	349.478	3.480	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1cccc(C#N)c1	ZINC001049344072	1347798500	/nfs/dbraw/zinc/79/85/00/1347798500.db2.gz	OGHLDBBNFYYTSK-KFKAGJAMSA-N	0	3	325.456	3.170	20	30		EGEDHN
CC1CC(C(=O)N2CCC[C@H]3[C@@H]2CCN3Cc2ccc(C#N)cc2)C1	ZINC001049408041	1347831459	/nfs/dbraw/zinc/83/14/59/1347831459.db2.gz	TZXUUHRJFVNGER-YIGDWTTGSA-N	0	3	337.467	3.170	20	30		EGEDHN
Cc1cc[nH]c1C(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049460896	1347859950	/nfs/dbraw/zinc/85/99/50/1347859950.db2.gz	ZJGJQVIMRHIORJ-MOPGFXCFSA-N	0	3	348.450	3.074	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@@H]2[C@H]1CCN2Cc1ccc(CF)cc1	ZINC001049466893	1347863022	/nfs/dbraw/zinc/86/30/22/1347863022.db2.gz	LGLJJJRDPAROFP-WOJBJXKFSA-N	0	3	340.442	3.135	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1coc2cc(F)ccc12	ZINC001049475158	1347866625	/nfs/dbraw/zinc/86/66/25/1347866625.db2.gz	NWQKGQZJAWMDMF-ZWKOTPCHSA-N	0	3	342.414	3.366	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccoc1C(F)(F)F	ZINC001049497000	1347878417	/nfs/dbraw/zinc/87/84/17/1347878417.db2.gz	FXFFLEPFIPRMIE-KGLIPLIRSA-N	0	3	340.345	3.001	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccnn1C(CC)CC	ZINC001049519397	1347889221	/nfs/dbraw/zinc/88/92/21/1347889221.db2.gz	YPLXZIZGYQIYGF-IRXDYDNUSA-N	0	3	330.476	3.109	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc2nc(C)oc2c1	ZINC001049530408	1347894605	/nfs/dbraw/zinc/89/46/05/1347894605.db2.gz	CCADJAGHAMRMMF-IRXDYDNUSA-N	0	3	325.412	3.001	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cnc(-c2ccccc2)o1	ZINC001049537321	1347896915	/nfs/dbraw/zinc/89/69/15/1347896915.db2.gz	NIBLDFAOADJPAF-MSOLQXFVSA-N	0	3	349.434	3.044	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(C)n(C(CC)CC)n1	ZINC001049563137	1347910747	/nfs/dbraw/zinc/91/07/47/1347910747.db2.gz	CIQKDNPDCDDMMT-OALUTQOASA-N	0	3	344.503	3.418	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1cccc(C(C)C)c1	ZINC001049567951	1347914121	/nfs/dbraw/zinc/91/41/21/1347914121.db2.gz	QNMHLAHVOYWSGG-SFTDATJTSA-N	0	3	338.495	3.441	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cccc(-n2cccc2)c1	ZINC001049577319	1347918463	/nfs/dbraw/zinc/91/84/63/1347918463.db2.gz	PBNUYMQSBUWOGD-WOJBJXKFSA-N	0	3	335.451	3.342	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cn(CC)c2ccccc12	ZINC001049582978	1347921765	/nfs/dbraw/zinc/92/17/65/1347921765.db2.gz	RXAZOPQGWAHJGW-SFTDATJTSA-N	0	3	349.478	3.363	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H]1COc2ccc(Cl)cc21	ZINC001049589014	1347924718	/nfs/dbraw/zinc/92/47/18/1347924718.db2.gz	JSOURJXMVAJJCM-IXDOHACOSA-N	0	3	346.858	3.067	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1c(C)noc1C1CC1	ZINC001049602607	1347932377	/nfs/dbraw/zinc/93/23/77/1347932377.db2.gz	NPKDDNAIZNBDNH-CVEARBPZSA-N	0	3	329.444	3.115	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc2cc(F)ccc2[nH]1	ZINC001049627903	1347942000	/nfs/dbraw/zinc/94/20/00/1347942000.db2.gz	CIALPTJZKVCWTI-ZWKOTPCHSA-N	0	3	327.403	3.172	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc2cc(F)ccc2[nH]1	ZINC001049627899	1347942234	/nfs/dbraw/zinc/94/22/34/1347942234.db2.gz	CIALPTJZKVCWTI-QZTJIDSGSA-N	0	3	327.403	3.172	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1sccc1-n1cccc1	ZINC001049629025	1347943466	/nfs/dbraw/zinc/94/34/66/1347943466.db2.gz	ITISONVOYYHDHN-HZPDHXFCSA-N	0	3	341.480	3.404	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]2[C@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049649107	1347955003	/nfs/dbraw/zinc/95/50/03/1347955003.db2.gz	ZECKDJAGKNLLCG-RBUKOAKNSA-N	0	3	337.467	3.336	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(F)c(Cl)cc1F	ZINC001049678589	1347969287	/nfs/dbraw/zinc/96/92/87/1347969287.db2.gz	CAVZZMUVNZYZFZ-JKSUJKDBSA-N	0	3	340.801	3.483	20	30		EGEDHN
CC(F)(F)CC(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1cccc(C#N)c1	ZINC001049698118	1347977965	/nfs/dbraw/zinc/97/79/65/1347977965.db2.gz	NBJSGJXCVGOKPV-SJORKVTESA-N	0	3	347.409	3.169	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]3[C@@H]2CCN3CCc2ccns2)C1	ZINC001049704415	1347982056	/nfs/dbraw/zinc/98/20/56/1347982056.db2.gz	XZLAFMOWZFJSLZ-SJORKVTESA-N	0	3	345.512	3.107	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C[C@H](C)c1cccc(F)c1	ZINC001049708116	1347984592	/nfs/dbraw/zinc/98/45/92/1347984592.db2.gz	OOHZLKNOJZPMPE-FFZOFVMBSA-N	0	3	342.458	3.408	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]3[C@@H]2CCN3Cc2cccc(C#N)c2)C1	ZINC001049708157	1347984606	/nfs/dbraw/zinc/98/46/06/1347984606.db2.gz	OQFYQNTYBOOVIQ-PMACEKPBSA-N	0	3	349.478	3.480	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]3[C@@H]2CCN3Cc2ncccc2C)C1	ZINC001049712364	1347986354	/nfs/dbraw/zinc/98/63/54/1347986354.db2.gz	QBVWPYSOCFWIMZ-MOPGFXCFSA-N	0	3	339.483	3.312	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1cccc(Cl)c1F	ZINC001049747192	1347998377	/nfs/dbraw/zinc/99/83/77/1347998377.db2.gz	IEKJWROSMCMYKK-IRXDYDNUSA-N	0	3	348.849	3.110	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(C)c(OCC)c1	ZINC001049763566	1348008658	/nfs/dbraw/zinc/00/86/58/1348008658.db2.gz	WUVZLUNUOJUIOU-MSOLQXFVSA-N	0	3	328.456	3.259	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(C(CC)CC)no1	ZINC001049769033	1348012187	/nfs/dbraw/zinc/01/21/87/1348012187.db2.gz	GDUKUXIRKWMMQD-ROUUACIJSA-N	0	3	343.471	3.280	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1oc(CC(C)C)nc1C	ZINC001049774885	1348015008	/nfs/dbraw/zinc/01/50/08/1348015008.db2.gz	YOCRYRVXPBCSGA-SJORKVTESA-N	0	3	345.487	3.437	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@@H]2CCCN3C(=O)[C@@H]2C[C@H]2C2CC2)cc1	ZINC001049778956	1348018082	/nfs/dbraw/zinc/01/80/82/1348018082.db2.gz	ZYZXAIRGTWHDRU-WOZUAGRISA-N	0	3	349.478	3.170	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc2nc(C)ccc2c1	ZINC001049799404	1348026595	/nfs/dbraw/zinc/02/65/95/1348026595.db2.gz	VOIZRUNBSXRTFI-UXHICEINSA-N	0	3	335.451	3.408	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1coc2ccccc12	ZINC001049810419	1348030524	/nfs/dbraw/zinc/03/05/24/1348030524.db2.gz	LMPAIDVCUZUGQU-MOPGFXCFSA-N	0	3	336.435	3.064	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1c[nH]nc1-c1ccsc1	ZINC001049817793	1348035021	/nfs/dbraw/zinc/03/50/21/1348035021.db2.gz	NUNRXVOOEKONRF-CVEARBPZSA-N	0	3	342.468	3.003	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1coc(C2CCCC2)n1	ZINC001049828881	1348043977	/nfs/dbraw/zinc/04/39/77/1348043977.db2.gz	RCWLUOMUABLSNW-ROUUACIJSA-N	0	3	341.455	3.034	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1csc(C(F)(F)F)n1	ZINC001049830431	1348044526	/nfs/dbraw/zinc/04/45/26/1348044526.db2.gz	FRXCIPXEWUDJGN-NEPJUHHUSA-N	0	3	345.390	3.027	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1ncoc1C(C)(C)C	ZINC001049835246	1348048713	/nfs/dbraw/zinc/04/87/13/1348048713.db2.gz	PJPPFUORGSAUKE-CABCVRRESA-N	0	3	331.460	3.227	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1occ2c1CCCC2	ZINC001049863903	1348070872	/nfs/dbraw/zinc/07/08/72/1348070872.db2.gz	PQAOLFVOKZKSII-ROUUACIJSA-N	0	3	328.456	3.413	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc2ccccc2n1	ZINC001049865410	1348072129	/nfs/dbraw/zinc/07/21/29/1348072129.db2.gz	VKXGKDOXYHUBDQ-VQTJNVASSA-N	0	3	335.451	3.490	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc2ncsc2c1	ZINC001049871808	1348077030	/nfs/dbraw/zinc/07/70/30/1348077030.db2.gz	NZHULUQKUUWFNX-JKSUJKDBSA-N	0	3	327.453	3.161	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)CCn1ccc2ccccc21	ZINC001049880669	1348086247	/nfs/dbraw/zinc/08/62/47/1348086247.db2.gz	DCZIAYPZRTVASH-SFTDATJTSA-N	0	3	349.478	3.120	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(C)c(CC)s1	ZINC001049881904	1348087297	/nfs/dbraw/zinc/08/72/97/1348087297.db2.gz	SVVSXYHYWPJFDX-HOTGVXAUSA-N	0	3	330.497	3.321	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc2cccc(F)c2o1	ZINC001049903925	1348102946	/nfs/dbraw/zinc/10/29/46/1348102946.db2.gz	LMYRYIXLCOFOOV-SJORKVTESA-N	0	3	340.398	3.274	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)CC[C@@H]1CCc2ccccc21	ZINC001049910846	1348107084	/nfs/dbraw/zinc/10/70/84/1348107084.db2.gz	WJTBKTPZHWWCJN-CEWLAPEOSA-N	0	3	336.479	3.195	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc2cccc(C)c2o1	ZINC001049918398	1348111654	/nfs/dbraw/zinc/11/16/54/1348111654.db2.gz	HMZNGZMVBPTJLG-ZWKOTPCHSA-N	0	3	336.435	3.443	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cnc(CC(C)C)s1	ZINC001049920464	1348113312	/nfs/dbraw/zinc/11/33/12/1348113312.db2.gz	BPXCXMJHHRZEMA-CVEARBPZSA-N	0	3	345.512	3.044	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1	ZINC001049924702	1348115754	/nfs/dbraw/zinc/11/57/54/1348115754.db2.gz	SZRBRXPPZPJRPS-RDGPPVDQSA-N	0	3	328.431	3.181	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001049958115	1348132275	/nfs/dbraw/zinc/13/22/75/1348132275.db2.gz	AFPMCFIDOWGQFP-RBUKOAKNSA-N	0	3	325.456	3.027	20	30		EGEDHN
CC(C)(C)CC(=O)N1CCC[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001049974112	1348140917	/nfs/dbraw/zinc/14/09/17/1348140917.db2.gz	YPMUXCUZDPHUDG-RBUKOAKNSA-N	0	3	339.483	3.417	20	30		EGEDHN
CCC(CC)C(=O)N1CCC[C@H]2CN(Cc3cccc(C#N)c3)C[C@H]21	ZINC001049978357	1348142223	/nfs/dbraw/zinc/14/22/23/1348142223.db2.gz	VQPOOQYFPQNFTJ-VQTJNVASSA-N	0	3	339.483	3.417	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)CC3(c4ccccc4)CC3)[C@@H]2C1	ZINC001050062567	1348170187	/nfs/dbraw/zinc/17/01/87/1348170187.db2.gz	ZGWRCTXIVCEPAE-AZUAARDMSA-N	0	3	336.479	3.054	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)[C@H]3CCc4c3cccc4Cl)[C@@H]2C1	ZINC001050095865	1348181757	/nfs/dbraw/zinc/18/17/57/1348181757.db2.gz	BJKXXSUPNHLDNZ-UCLAIMLFSA-N	0	3	344.886	3.479	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)[C@H](CC)Oc3ccccc3F)[C@@H]2C1	ZINC001050180797	1348203132	/nfs/dbraw/zinc/20/31/32/1348203132.db2.gz	NVBYINDFGYZRBK-JQHSSLGASA-N	0	3	346.446	3.092	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC2(C1)CCN([C@H](C)c1ccc(Cl)cc1)CC2	ZINC001050458995	1348271044	/nfs/dbraw/zinc/27/10/44/1348271044.db2.gz	GQFHKYXOGRRSIQ-HUUCEWRRSA-N	0	3	345.874	3.485	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H]3CCCC[C@@H]3C3CC3)C2)CC1	ZINC001050603958	1348298730	/nfs/dbraw/zinc/29/87/30/1348298730.db2.gz	JAMUMMNAOKJEIE-RTBURBONSA-N	0	3	328.500	3.151	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC2(C1)CCN(Cc1cccnc1C)CC2	ZINC001050614306	1348302920	/nfs/dbraw/zinc/30/29/20/1348302920.db2.gz	WKNMQRIXSYOSNY-UHFFFAOYSA-N	0	3	341.499	3.417	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cc(C(C)(C)C)oc3C)C2)CC1	ZINC001050678476	1348323815	/nfs/dbraw/zinc/32/38/15/1348323815.db2.gz	MMOAZTXEPBCXEM-UHFFFAOYSA-N	0	3	342.483	3.447	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H](C)c3ccc(CC)cc3)C2)CC1	ZINC001050700489	1348331074	/nfs/dbraw/zinc/33/10/74/1348331074.db2.gz	IPICIISDBWYODB-GOSISDBHSA-N	0	3	338.495	3.300	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3cccnc3C)cccc2C1	ZINC001051299798	1348424819	/nfs/dbraw/zinc/42/48/19/1348424819.db2.gz	PACMOKKPZGWYRK-UHFFFAOYSA-N	0	3	335.451	3.254	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3cccn3CC)cccc2C1	ZINC001051307117	1348428730	/nfs/dbraw/zinc/42/87/30/1348428730.db2.gz	LLAMYAUIHZERAB-UHFFFAOYSA-N	0	3	337.467	3.372	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cscc2C(F)F)CC1	ZINC001052388019	1348538285	/nfs/dbraw/zinc/53/82/85/1348538285.db2.gz	YRXGAXKWZBOUSK-GFCCVEGCSA-N	0	3	326.412	3.293	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@H](NC(=O)Cc3ccccc3)CC2)c1	ZINC001052496487	1348558330	/nfs/dbraw/zinc/55/83/30/1348558330.db2.gz	HNQQVUIGERAFRE-OAQYLSRUSA-N	0	3	347.462	3.272	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cnc3ccccc3c2C)CC1	ZINC001052567922	1348581924	/nfs/dbraw/zinc/58/19/24/1348581924.db2.gz	IVHPRAVRXBIPEC-KRWDZBQOSA-N	0	3	335.451	3.151	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2c(Cl)oc3ccccc32)CC1	ZINC001052651221	1348613858	/nfs/dbraw/zinc/61/38/58/1348613858.db2.gz	SPOKESCOZXOSQS-CYBMUJFWSA-N	0	3	330.815	3.304	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCN(Cc3c(C)noc3C)CC2)C1	ZINC001052691093	1348634448	/nfs/dbraw/zinc/63/44/48/1348634448.db2.gz	RTGJNCUDZLDLPA-MRXNPFEDSA-N	0	3	331.460	3.118	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCN(Cc3oc(CC)nc3C)CC2)C1	ZINC001052693269	1348637068	/nfs/dbraw/zinc/63/70/68/1348637068.db2.gz	QVLDPNQUKBXUSU-MRXNPFEDSA-N	0	3	345.487	3.372	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)Cc2ccc(C(C)(C)C)cc2)CC1	ZINC001052751582	1348661978	/nfs/dbraw/zinc/66/19/78/1348661978.db2.gz	WGPVYRGOKHJABX-IBGZPJMESA-N	0	3	326.484	3.131	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2[nH]c3ccc(C)cc3c2C)CC1	ZINC001052836228	1348695335	/nfs/dbraw/zinc/69/53/35/1348695335.db2.gz	GVONYXHAJMJEKR-QGZVFWFLSA-N	0	3	337.467	3.392	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)Cc2cccc3ccccc32)CC1	ZINC001052890253	1348725940	/nfs/dbraw/zinc/72/59/40/1348725940.db2.gz	XUKDHSHBTJVKMK-FQEVSTJZSA-N	0	3	334.463	3.376	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2csc3c2CC[C@@H](C)C3)CC1	ZINC001052911890	1348744673	/nfs/dbraw/zinc/74/46/73/1348744673.db2.gz	PYUHOOYAIJSOQR-HUUCEWRRSA-N	0	3	330.497	3.090	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)C2(c3ccccc3)CCCC2)CC1	ZINC001052914727	1348746069	/nfs/dbraw/zinc/74/60/69/1348746069.db2.gz	VPFMNGNVAJWKMO-FQEVSTJZSA-N	0	3	338.495	3.492	20	30		EGEDHN
C#CCCN1C[C@@H](C)[C@H](NC(=O)c2ccccc2C(C)(C)CC)C1	ZINC001079925143	1357425498	/nfs/dbraw/zinc/42/54/98/1357425498.db2.gz	QEMVVNJUCSERHY-VQIMIIECSA-N	0	3	326.484	3.448	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2sc(C(C)(C)C)nc2C)CC1	ZINC001052971150	1348780636	/nfs/dbraw/zinc/78/06/36/1348780636.db2.gz	HTEMLAZICQHTHT-HNNXBMFYSA-N	0	3	347.528	3.357	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2cc3cccc(Cl)c3o2)CC1	ZINC001052983327	1348787826	/nfs/dbraw/zinc/78/78/26/1348787826.db2.gz	JCYYLDFPVKOSMF-CQSZACIVSA-N	0	3	330.815	3.304	20	30		EGEDHN
CC(=O)N1CCC[C@H]([C@H]2CCCN(Cc3ccc(C#N)c(F)c3)C2)C1	ZINC001052998335	1348794954	/nfs/dbraw/zinc/79/49/54/1348794954.db2.gz	XTJLVMBAACFAMF-OALUTQOASA-N	0	3	343.446	3.168	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)CC(F)(F)F)C1	ZINC001053069795	1348883182	/nfs/dbraw/zinc/88/31/82/1348883182.db2.gz	PZFPKSFKKBTSEV-HUUCEWRRSA-N	0	3	330.394	3.055	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)CC(F)(F)F)C1	ZINC001053069794	1348883726	/nfs/dbraw/zinc/88/37/26/1348883726.db2.gz	PZFPKSFKKBTSEV-GJZGRUSLSA-N	0	3	330.394	3.055	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ncccc2C)C1	ZINC001053076364	1348894583	/nfs/dbraw/zinc/89/45/83/1348894583.db2.gz	NLYICEIAYMQFIU-MOPGFXCFSA-N	0	3	339.483	3.120	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccsc2C)C1	ZINC001053083471	1348904378	/nfs/dbraw/zinc/90/43/78/1348904378.db2.gz	LBJNDXGEVQABPL-FUHWJXTLSA-N	0	3	330.497	3.396	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2[nH]ccc2C)C1	ZINC001053083703	1348905206	/nfs/dbraw/zinc/90/52/06/1348905206.db2.gz	LMAREJMECNHUGQ-ZWKOTPCHSA-N	0	3	327.472	3.053	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(OC)cs2)C1	ZINC001053092426	1348919658	/nfs/dbraw/zinc/91/96/58/1348919658.db2.gz	GXOKQSHBPWALCC-WBVHZDCISA-N	0	3	346.496	3.097	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cocc2C)C1	ZINC001053093263	1348920563	/nfs/dbraw/zinc/92/05/63/1348920563.db2.gz	XKODKOBPCKJQTI-PKOBYXMFSA-N	0	3	328.456	3.318	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccn(CC)c2C)C1	ZINC001053095916	1348926096	/nfs/dbraw/zinc/92/60/96/1348926096.db2.gz	MIZKKXWRVLBEAU-AZUAARDMSA-N	0	3	341.499	3.156	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cc(C)cc(F)c2)C1	ZINC001053098033	1348929054	/nfs/dbraw/zinc/92/90/54/1348929054.db2.gz	JHQVFYBUWQLLRC-FXAWDEMLSA-N	0	3	342.458	3.474	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(OC)o2)C1	ZINC001053102946	1348936584	/nfs/dbraw/zinc/93/65/84/1348936584.db2.gz	XWEVXXZAEDUDEJ-SJORKVTESA-N	0	3	344.455	3.018	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2c(C)nsc2C)C1	ZINC001053104738	1348940728	/nfs/dbraw/zinc/94/07/28/1348940728.db2.gz	IUUZCRKPLHUQIM-IRXDYDNUSA-N	0	3	345.512	3.100	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)Cc2ccc(F)cc2)C1	ZINC001053105217	1348941762	/nfs/dbraw/zinc/94/17/62/1348941762.db2.gz	MVBMJTBZCGWEIX-QUCCMNQESA-N	0	3	342.458	3.095	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)C2(F)CCCCC2)C1	ZINC001053105533	1348943117	/nfs/dbraw/zinc/94/31/17/1348943117.db2.gz	UORJVOUEPWOTRI-QZTJIDSGSA-N	0	3	334.479	3.385	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cnc(CC)s2)C1	ZINC001053106599	1348944475	/nfs/dbraw/zinc/94/44/75/1348944475.db2.gz	UUXWGOWROPLHRR-HOTGVXAUSA-N	0	3	345.512	3.045	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(F)cc2F)C1	ZINC001053106957	1348945353	/nfs/dbraw/zinc/94/53/53/1348945353.db2.gz	XYNDCIPJMFSTKK-KXBFYZLASA-N	0	3	346.421	3.305	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(CC)s1)C2	ZINC001054161213	1349163441	/nfs/dbraw/zinc/16/34/41/1349163441.db2.gz	ZSJWPRHEYZPRMY-LJQANCHMSA-N	0	3	330.497	3.262	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc3cc(C)ccc3n1)C2	ZINC001054162619	1349165150	/nfs/dbraw/zinc/16/51/50/1349165150.db2.gz	MSINJDMHMJUSSQ-QFIPXVFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc(F)ccc1C)C2	ZINC001054173878	1349174960	/nfs/dbraw/zinc/17/49/60/1349174960.db2.gz	UVEAYWWKLVCLFI-HXUWFJFHSA-N	0	3	328.431	3.086	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc3ncccc3c1)C2	ZINC001054188917	1349191724	/nfs/dbraw/zinc/19/17/24/1349191724.db2.gz	WPXYGPYRZLBXSJ-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)Cc1cc(C)cc(C)c1)C2	ZINC001054188899	1349191852	/nfs/dbraw/zinc/19/18/52/1349191852.db2.gz	WDULWXFSEGIMDT-QFIPXVFZSA-N	0	3	338.495	3.184	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)Cc1c(C)cc(C)cc1C)C2	ZINC001054190222	1349192200	/nfs/dbraw/zinc/19/22/00/1349192200.db2.gz	DYVALWDLDKMMJM-JOCHJYFZSA-N	0	3	338.495	3.102	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@]2(CCN(Cc3ocnc3C)C2)C1	ZINC001054191279	1349193427	/nfs/dbraw/zinc/19/34/27/1349193427.db2.gz	DXMNJWZHSUGCAH-PMACEKPBSA-N	0	3	345.487	3.400	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H]1CCCC(F)(F)C1)C2	ZINC001054196615	1349198936	/nfs/dbraw/zinc/19/89/36/1349198936.db2.gz	KQUSKJYPEXUGKG-AEFFLSMTSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1csc(C(C)C)n1)C2	ZINC001054212637	1349212243	/nfs/dbraw/zinc/21/22/43/1349212243.db2.gz	JWEGQWJFRSECCH-IBGZPJMESA-N	0	3	345.512	3.218	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)CCc1cc(C)cc(C)c1)C2	ZINC001054224951	1349219848	/nfs/dbraw/zinc/21/98/48/1349219848.db2.gz	NLGQJJAHDRAWJK-JOCHJYFZSA-N	0	3	338.495	3.184	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(Cl)s1)C2	ZINC001054235927	1349228428	/nfs/dbraw/zinc/22/84/28/1349228428.db2.gz	DTYGFWMSWZDJBU-KRWDZBQOSA-N	0	3	336.888	3.353	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc3ccccc3[nH]1)C2	ZINC001054238334	1349231659	/nfs/dbraw/zinc/23/16/59/1349231659.db2.gz	QWJVRHMYVNKYJD-NRFANRHFSA-N	0	3	335.451	3.119	20	30		EGEDHN
C=C[C@@H](C(=O)N1CCC[C@@]2(CCN(CC#CC)C2)C1)c1ccccc1	ZINC001054244644	1349238524	/nfs/dbraw/zinc/23/85/24/1349238524.db2.gz	XGQWJJYVYKODCA-IRLDBZIGSA-N	0	3	336.479	3.294	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc3cccc(F)c3o1)C2	ZINC001054244476	1349238843	/nfs/dbraw/zinc/23/88/43/1349238843.db2.gz	VZSWONNUTFAGFV-FQEVSTJZSA-N	0	3	340.398	3.133	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@H]3C[C@H](C)CO3)cc2C1	ZINC001054274637	1349274502	/nfs/dbraw/zinc/27/45/02/1349274502.db2.gz	NLCJVDVTAQSHQL-HNAYVOBHSA-N	0	3	328.456	3.010	20	30		EGEDHN
C#Cc1cncc(C(=O)NCc2ccc3c(c2)CN(CCC2CC2)C3)c1	ZINC001054281653	1349283610	/nfs/dbraw/zinc/28/36/10/1349283610.db2.gz	UYFDCLXHZRGERF-UHFFFAOYSA-N	0	3	345.446	3.109	20	30		EGEDHN
C=CCN1Cc2ccc(CNC(=O)[C@@H]3CCCCN3C(C)C)cc2C1	ZINC001054284789	1349287324	/nfs/dbraw/zinc/28/73/24/1349287324.db2.gz	HYYLKUAEVZKQIR-FQEVSTJZSA-N	0	3	341.499	3.067	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@@H]3CCO[C@@H](C)C3)cc2C1	ZINC001054286716	1349289465	/nfs/dbraw/zinc/28/94/65/1349289465.db2.gz	OHYHQOIDQAPENV-DOTOQJQBSA-N	0	3	328.456	3.010	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3ncccc3F)cc2C1	ZINC001054287457	1349290200	/nfs/dbraw/zinc/29/02/00/1349290200.db2.gz	MBYMDZXHHPFLKZ-UHFFFAOYSA-N	0	3	325.387	3.042	20	30		EGEDHN
C[C@H]1CN(C(=O)c2ccc(F)cc2)C[C@H]1NCc1ccc(C#N)s1	ZINC001054329314	1349311045	/nfs/dbraw/zinc/31/10/45/1349311045.db2.gz	QIWFSQLUUBYEQQ-YVEFUNNKSA-N	0	3	343.427	3.009	20	30		EGEDHN
Cc1csc(C(=O)N2C[C@H](NCc3ccc(C#N)s3)[C@@H](C)C2)c1	ZINC001054633188	1349422957	/nfs/dbraw/zinc/42/29/57/1349422957.db2.gz	JGSDPAGBXFVPGA-WFASDCNBSA-N	0	3	345.493	3.240	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@H](NCc2ncccc2C)[C@@H](C)C1	ZINC001054680051	1349435423	/nfs/dbraw/zinc/43/54/23/1349435423.db2.gz	LXRCBNAEXOIFLE-BBRMVZONSA-N	0	3	335.879	3.105	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)[C@@H](NCc2cccc(C(C)C)n2)C1	ZINC001054976005	1349534532	/nfs/dbraw/zinc/53/45/32/1349534532.db2.gz	HRNILGSEEMJEOA-QAPCUYQASA-N	0	3	329.488	3.354	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CN(Cc3cccc(CC)c3)C[C@H]2C)cc1	ZINC001080244651	1357535703	/nfs/dbraw/zinc/53/57/03/1357535703.db2.gz	FCEOLHCUXOGBQE-VGOFRKELSA-N	0	3	346.474	3.481	20	30		EGEDHN
C=C(CN1CCCC1)C(=O)N(C)[C@H](CCC)C(=O)c1ccccc1	ZINC001183044554	1387255590	/nfs/dbraw/zinc/25/55/90/1387255590.db2.gz	KHAUPVBJWBBGQJ-GOSISDBHSA-N	0	3	328.456	3.148	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)C2CCCCCCC2)C1	ZINC001070417171	1354342411	/nfs/dbraw/zinc/34/24/11/1354342411.db2.gz	VUUKMEHDQIVNFA-KRWDZBQOSA-N	0	3	344.503	3.362	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1ccccc1CC)C[C@H](C)O2	ZINC001071201908	1354502727	/nfs/dbraw/zinc/50/27/27/1354502727.db2.gz	MPLKDGSVYFEDHK-LAUBAEHRSA-N	0	3	342.483	3.131	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1ccoc1C1CC1)C[C@@H](C)O2	ZINC001071204016	1354504078	/nfs/dbraw/zinc/50/40/78/1354504078.db2.gz	LQMJAJATBXBYLU-QRWLVFNGSA-N	0	3	344.455	3.039	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1ccc(CC)cc1)C[C@@H](C)O2	ZINC001071238884	1354521767	/nfs/dbraw/zinc/52/17/67/1354521767.db2.gz	SLZOWSLOGCLVGY-DYESRHJHSA-N	0	3	342.483	3.131	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2sc(C3CC3)nc2C)CC[C@H]1C	ZINC001071508499	1354733266	/nfs/dbraw/zinc/73/32/66/1354733266.db2.gz	PBKNJJVDGDMQBC-DOMZBBRYSA-N	0	3	333.501	3.488	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2c(C)nn(C(C)(C)C)c2C)CC[C@H]1C	ZINC001071547603	1354760150	/nfs/dbraw/zinc/76/01/50/1354760150.db2.gz	WQOWXMDYBVOSBX-PBHICJAKSA-N	0	3	346.519	3.414	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2C3CC4CC(C3)CC2C4)CC[C@H]1C	ZINC001071572029	1354771556	/nfs/dbraw/zinc/77/15/56/1354771556.db2.gz	PBKWUBULSLFNGF-RJBHSWFSSA-N	0	3	328.500	3.051	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2nccc3ccsc32)CC[C@H]1C	ZINC001071583377	1354778307	/nfs/dbraw/zinc/77/83/07/1354778307.db2.gz	HBOCFOBXKYOCGO-UKRRQHHQSA-N	0	3	329.469	3.455	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@H]2CC[C@H](C)N(CC(=C)C)C2)cc1	ZINC001071620086	1354802942	/nfs/dbraw/zinc/80/29/42/1354802942.db2.gz	ZRZZYSUNRIOATP-WMZOPIPTSA-N	0	3	328.456	3.410	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2c(C)c(F)ccc2Cl)CC[C@H]1C	ZINC001071624189	1354806837	/nfs/dbraw/zinc/80/68/37/1354806837.db2.gz	FMOSDIDPVXYZCG-OCCSQVGLSA-N	0	3	336.838	3.394	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(-n3cccc3)cc2)CC[C@@H]1C	ZINC001071653887	1354829197	/nfs/dbraw/zinc/82/91/97/1354829197.db2.gz	AOZWNIWZHLPAOO-PKOBYXMFSA-N	0	3	335.451	3.083	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc3[nH]nc(C)c3c2)CC[C@H]1C	ZINC001071676968	1354843696	/nfs/dbraw/zinc/84/36/96/1354843696.db2.gz	QDEGJFFIAPELBA-CJNGLKHVSA-N	0	3	326.444	3.030	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2ccc3cnccc3c2)CC[C@@H]1C	ZINC001071678032	1354845452	/nfs/dbraw/zinc/84/54/52/1354845452.db2.gz	XYCNGIKCUQOEAK-OXJNMPFZSA-N	0	3	337.467	3.323	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2c[nH]nc2-c2ccccc2)CC[C@@H]1C	ZINC001071716665	1354874614	/nfs/dbraw/zinc/87/46/14/1354874614.db2.gz	YVJUUCDIFRQKPT-RDJZCZTQSA-N	0	3	338.455	3.236	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc3c(ccc(C)c3C)[nH]2)CC[C@@H]1C	ZINC001071739849	1354890374	/nfs/dbraw/zinc/89/03/74/1354890374.db2.gz	ZCJDXGZWZVZKNG-RDJZCZTQSA-N	0	3	337.467	3.391	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(N3CC=CC3)cc2)CC[C@H]1C	ZINC001071821865	1354962254	/nfs/dbraw/zinc/96/22/54/1354962254.db2.gz	SYOUQQHMYUVRNN-MJGOQNOKSA-N	0	3	339.483	3.222	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cccc(N3CC=CC3)c2)CC[C@@H]1C	ZINC001071854930	1354982044	/nfs/dbraw/zinc/98/20/44/1354982044.db2.gz	IIBLKMSROUHWPV-PKOBYXMFSA-N	0	3	339.483	3.222	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@@H]2CC[C@H](C)N(CC=C(C)C)C2)cc1	ZINC001071868046	1354994058	/nfs/dbraw/zinc/99/40/58/1354994058.db2.gz	GSUSXOCAINORCH-PKOBYXMFSA-N	0	3	340.467	3.248	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cn2cc(C)c3ccccc32)CC[C@H]1C	ZINC001071883355	1355004620	/nfs/dbraw/zinc/00/46/20/1355004620.db2.gz	JYWOHCQKAMHGQZ-MSOLQXFVSA-N	0	3	339.483	3.495	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc(C)cc3c[nH]nc32)CC[C@@H]1C	ZINC001071890193	1355008695	/nfs/dbraw/zinc/00/86/95/1355008695.db2.gz	IGTBFLMESPZJHH-HOCLYGCPSA-N	0	3	326.444	3.030	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C(C)(C)c2ccc(C)cc2)CC[C@@H]1C	ZINC001072003171	1355068029	/nfs/dbraw/zinc/06/80/29/1355068029.db2.gz	SETZHTFTQYYHNY-HKUYNNGSSA-N	0	3	326.484	3.265	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(N(CC)CC)cc2)CC[C@@H]1C	ZINC001072023451	1355086090	/nfs/dbraw/zinc/08/60/90/1355086090.db2.gz	RFBBUEGUHXRYJQ-HKUYNNGSSA-N	0	3	341.499	3.139	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc(F)c(F)cc2Cl)CC[C@@H]1C	ZINC001072046088	1355101558	/nfs/dbraw/zinc/10/15/58/1355101558.db2.gz	VFHPLVIGOFEHCR-RYUDHWBXSA-N	0	3	340.801	3.224	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(-c3ccccc3)[nH]2)CC[C@H]1C	ZINC001072113009	1355137736	/nfs/dbraw/zinc/13/77/36/1355137736.db2.gz	LVZKXNUAEXWUMB-SJLPKXTDSA-N	0	3	335.451	3.288	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(N(CC)CC)nc2)CC[C@H]1C	ZINC001072112511	1355137937	/nfs/dbraw/zinc/13/79/37/1355137937.db2.gz	BAZWZQGRGJKMFX-AEFFLSMTSA-N	0	3	344.503	3.087	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](C)[C@@H](CNCc2nccs2)C1	ZINC001072337385	1355245507	/nfs/dbraw/zinc/24/55/07/1355245507.db2.gz	XTYHEAUXSORPOK-CABCVRRESA-N	0	3	335.517	3.320	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](C)[C@@H](CNCc3nccs3)C2)CC1	ZINC001072356296	1355254389	/nfs/dbraw/zinc/25/43/89/1355254389.db2.gz	JFVCQXXFTWYADI-WBVHZDCISA-N	0	3	347.528	3.464	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC2(C1)CCN(C/C=C/c1ccc(Cl)cc1)C2	ZINC001072551498	1355330095	/nfs/dbraw/zinc/33/00/95/1355330095.db2.gz	GBPMFHRMIRMYPG-XYBNCVKDSA-N	0	3	343.858	3.047	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC2(C1)CCN(Cc1cccnc1C)C2	ZINC001072779806	1355433959	/nfs/dbraw/zinc/43/39/59/1355433959.db2.gz	HEIGQSDYCBVEBK-UHFFFAOYSA-N	0	3	347.890	3.203	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)C(C)(C)c3ccc(Cl)cc3)C2)C1	ZINC001072937552	1355507780	/nfs/dbraw/zinc/50/77/80/1355507780.db2.gz	DZSCDWXJMHCTLC-UHFFFAOYSA-N	0	3	332.875	3.338	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)Cc3cccc4sccc43)C2)C1	ZINC001073033413	1355561811	/nfs/dbraw/zinc/56/18/11/1355561811.db2.gz	LDGTZCHRUSMVJC-UHFFFAOYSA-N	0	3	326.465	3.164	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@@H](CC)Cc3cccc(C)c3)C2)C1	ZINC001073039284	1355564939	/nfs/dbraw/zinc/56/49/39/1355564939.db2.gz	JMQQVIJODYGWKA-IBGZPJMESA-N	0	3	326.484	3.284	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@@H](N[C@H](C)c3ccccc3F)C2)CCC1	ZINC001183200540	1387277635	/nfs/dbraw/zinc/27/76/35/1387277635.db2.gz	ROFYWFNYJAGDDE-HZPDHXFCSA-N	0	3	328.431	3.271	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2cccc(Cl)c2C)C1	ZINC001073616610	1355846455	/nfs/dbraw/zinc/84/64/55/1355846455.db2.gz	ZDIQRSUDMDVXMS-OAHLLOKOSA-N	0	3	336.863	3.045	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCCN1C(=O)C(C)(C)F	ZINC001073927501	1355961768	/nfs/dbraw/zinc/96/17/68/1355961768.db2.gz	JGCKPNYBRVRFGZ-QGZVFWFLSA-N	0	3	331.435	3.119	20	30		EGEDHN
Cc1cc(F)ccc1CN(C)C[C@H]1CCCCN1C(=O)[C@H](C)C#N	ZINC001073972992	1356004458	/nfs/dbraw/zinc/00/44/58/1356004458.db2.gz	MZIQSAIEZRLALQ-CRAIPNDOSA-N	0	3	331.435	3.107	20	30		EGEDHN
CN(Cc1cccc(F)c1)C[C@H]1CCCCN1C(=O)C#CC1CC1	ZINC001074012990	1356035599	/nfs/dbraw/zinc/03/55/99/1356035599.db2.gz	XUDJNLQJYZYLFP-LJQANCHMSA-N	0	3	328.431	3.052	20	30		EGEDHN
C[C@H]1[C@@H](NCc2ccc(C#N)s2)CCN1C(=O)[C@H]1[C@@H]2CCCC[C@@H]21	ZINC001074585227	1356212702	/nfs/dbraw/zinc/21/27/02/1356212702.db2.gz	VFSLDEYYCARGLL-LKIBZCMFSA-N	0	3	343.496	3.135	20	30		EGEDHN
CC[C@@H](N[C@H]1CCN(C(=O)C#CC2CC2)[C@H]1C)c1ccc(F)cc1F	ZINC001074647051	1356220423	/nfs/dbraw/zinc/22/04/23/1356220423.db2.gz	QZGXYDZRMMVSAU-BKTGTZMESA-N	0	3	346.421	3.408	20	30		EGEDHN
C[C@H]1[C@@H](NCc2ccc(C#N)s2)CCN1C(=O)C[C@@H]1CC=CCC1	ZINC001074798526	1356245303	/nfs/dbraw/zinc/24/53/03/1356245303.db2.gz	ONYOKALGENHPME-DAYGRLMNSA-N	0	3	343.496	3.445	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cc4cc(F)ccc4[nH]3)[C@@H]2C1	ZINC001076114816	1356494590	/nfs/dbraw/zinc/49/45/90/1356494590.db2.gz	KQSYEMMTPMRFCI-SCLBCKFNSA-N	0	3	327.403	3.029	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3c(Cl)oc4ccccc43)[C@@H]2C1	ZINC001076160255	1356510156	/nfs/dbraw/zinc/51/01/56/1356510156.db2.gz	UIYBCBATSCRSFW-DZGCQCFKSA-N	0	3	342.826	3.256	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3c3ccc(Cl)s3)[C@@H]2C1	ZINC001076173187	1356511935	/nfs/dbraw/zinc/51/19/35/1356511935.db2.gz	NZNGIDJPNWXVNI-REWJHTLYSA-N	0	3	336.888	3.224	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3cc4cccc(Cl)c4o3)[C@@H]2C1	ZINC001076651050	1356641653	/nfs/dbraw/zinc/64/16/53/1356641653.db2.gz	HFZUOPKWFVPRBB-GOEBONIOSA-N	0	3	342.826	3.256	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@@H](C)c2ccsc2)C[C@H]1C(F)(F)F	ZINC001099306318	1363741039	/nfs/dbraw/zinc/74/10/39/1363741039.db2.gz	XHXWWXRSMOIDNY-CYZMBNFOSA-N	0	3	332.391	3.017	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCCO[C@H](CNCc2ccccc2F)C1	ZINC001078460681	1356977629	/nfs/dbraw/zinc/97/76/29/1356977629.db2.gz	YPAZIFWWMLXZIU-YLJYHZDGSA-N	0	3	348.462	3.135	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)C=C2CCC2)C12CCC2	ZINC001078593896	1357026773	/nfs/dbraw/zinc/02/67/73/1357026773.db2.gz	KMZKGUVRMDYAOT-UONOGXRCSA-N	0	3	339.277	3.022	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2nc(C3CC3)oc2C)C12CCC2	ZINC001078767402	1357073884	/nfs/dbraw/zinc/07/38/84/1357073884.db2.gz	JLVDZFWKVHUIKY-UONOGXRCSA-N	0	3	349.862	3.244	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H]2CC[C@H](CC)CC2)C[C@H]1c1ccccc1	ZINC001081216640	1357850678	/nfs/dbraw/zinc/85/06/78/1357850678.db2.gz	MBVNJDGTUCCGBN-ZIBCJSCZSA-N	0	3	338.495	3.420	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2ccc(CCC)s2)[C@H](OC)C1	ZINC001081742935	1357863498	/nfs/dbraw/zinc/86/34/98/1357863498.db2.gz	DHQVMGLFMXLJCE-HZPDHXFCSA-N	0	3	336.501	3.096	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2cc(C3CC3)oc2C2CC2)[C@H](OC)C1	ZINC001081969303	1357905441	/nfs/dbraw/zinc/90/54/41/1357905441.db2.gz	ITMXVWBUWUNTJT-SJLPKXTDSA-N	0	3	344.455	3.040	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)[C@@H](C)c2ccc(CC)cc2)[C@H](OC)C1	ZINC001082243546	1357990767	/nfs/dbraw/zinc/99/07/67/1357990767.db2.gz	GCEZJXVZQPQIFN-PWIZWCRZSA-N	0	3	344.499	3.134	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)C(C)(C)c2ccccc2C)[C@H](OC)C1	ZINC001082398123	1358026399	/nfs/dbraw/zinc/02/63/99/1358026399.db2.gz	KSZKHGMMCSTVMX-RTBURBONSA-N	0	3	344.499	3.054	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)[C@H]3CCCCC3(C)C)[C@H]2C1	ZINC001083287496	1358128998	/nfs/dbraw/zinc/12/89/98/1358128998.db2.gz	LDVYMEZQRNUWJP-FGTMMUONSA-N	0	3	334.504	3.081	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)c3ccc4c5c(cccc53)CC4)[C@@H]2C1	ZINC001084503644	1358226944	/nfs/dbraw/zinc/22/69/44/1358226944.db2.gz	KPCBJSHPUXHHBW-WIYYLYMNSA-N	0	3	344.458	3.108	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@@H](C)Cc3ccccc3F)[C@@H]2C1	ZINC001084657583	1358271240	/nfs/dbraw/zinc/27/12/40/1358271240.db2.gz	FOROUEGSBNRCHD-KVSKMBFKSA-N	0	3	330.447	3.113	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)Cc3cccc(Cl)c3F)[C@@H]2C1	ZINC001084683026	1358276862	/nfs/dbraw/zinc/27/68/62/1358276862.db2.gz	NGCIRXMGXBPBEL-GDBMZVCRSA-N	0	3	336.838	3.130	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3cnc(C(C)C)s3)[C@@H]2C1	ZINC001084875830	1358337263	/nfs/dbraw/zinc/33/72/63/1358337263.db2.gz	UPXZVJHEGVJCIM-HUUCEWRRSA-N	0	3	333.501	3.379	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@H]3CC=CC[C@H]3C(F)(F)F)C[C@@H]21	ZINC001084972822	1358357367	/nfs/dbraw/zinc/35/73/67/1358357367.db2.gz	CZUKJKBYGCTTRG-FPCVCCKLSA-N	0	3	342.405	3.240	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CC[C@H]2CCN(Cc3ccc(C#N)cc3)[C@H]2C1	ZINC001085038271	1358373579	/nfs/dbraw/zinc/37/35/79/1358373579.db2.gz	FNEDJQYKUTZOQS-WTGUMLROSA-N	0	3	337.467	3.027	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N[C@@H]1CCCC[C@H]1NCc1ccc(C#N)cc1F	ZINC001085173930	1358423854	/nfs/dbraw/zinc/42/38/54/1358423854.db2.gz	OSRHWLWBJMBIBB-KBAYOESNSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H](C)C1CCC1	ZINC001085240691	1358440792	/nfs/dbraw/zinc/44/07/92/1358440792.db2.gz	PTSVCSGKYIAYFV-BPLDGKMQSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cccc2c1O[C@H](C)C2	ZINC001085277406	1358449307	/nfs/dbraw/zinc/44/93/07/1358449307.db2.gz	FUVINIPRDTVAFZ-KBRIMQKVSA-N	0	3	348.874	3.393	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cc(C)cc2c[nH]nc21	ZINC001085364157	1358479270	/nfs/dbraw/zinc/47/92/70/1358479270.db2.gz	OXAWMPNASIQKDM-HZPDHXFCSA-N	0	3	346.862	3.254	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1nc(C2CC2)oc1C	ZINC001085378792	1358482523	/nfs/dbraw/zinc/48/25/23/1358482523.db2.gz	QPXBHVWRVJIWEU-ZIAGYGMSSA-N	0	3	337.851	3.244	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cc(-c2ccoc2)n[nH]1	ZINC001085421675	1358495440	/nfs/dbraw/zinc/49/54/40/1358495440.db2.gz	QTAMFKPBOPHDPJ-ZIAGYGMSSA-N	0	3	348.834	3.053	20	30		EGEDHN
CC[C@H](c1ccccc1)N1CC[C@@H]1CN(C)C(=O)c1cc(C#N)c[nH]1	ZINC001085535817	1358573448	/nfs/dbraw/zinc/57/34/48/1358573448.db2.gz	PXRCPYWWEZCZBW-IEBWSBKVSA-N	0	3	336.439	3.184	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc(-c2ccccc2)on1	ZINC001085710082	1358702373	/nfs/dbraw/zinc/70/23/73/1358702373.db2.gz	YLRZJIYMXTZRFP-QGZVFWFLSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1c(F)ccc(F)c1OC	ZINC001085759735	1358738975	/nfs/dbraw/zinc/73/89/75/1358738975.db2.gz	OJMOWODILGKHSW-ZDUSSCGKSA-N	0	3	338.398	3.086	20	30		EGEDHN
C=C1CCC(C(=O)N(C)C[C@@H]2CCN2C[C@@H](OC)C2CCCC2)CC1	ZINC001085801160	1358776599	/nfs/dbraw/zinc/77/65/99/1358776599.db2.gz	LDLIQVSPTIKFQP-VQTJNVASSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1ccc(-c2ccccc2)nc1	ZINC001085891102	1358850077	/nfs/dbraw/zinc/85/00/77/1358850077.db2.gz	QFGIPNNQBWHTRV-IBGZPJMESA-N	0	3	335.451	3.471	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cccc(F)c1OCC	ZINC001085896092	1358856016	/nfs/dbraw/zinc/85/60/16/1358856016.db2.gz	SKYOXTQOZWHQQT-HNNXBMFYSA-N	0	3	334.435	3.337	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cnn(C(C)C)c1C1CC1	ZINC001085915613	1358874746	/nfs/dbraw/zinc/87/47/46/1358874746.db2.gz	FQCBTRXTKPQXMV-KRWDZBQOSA-N	0	3	344.503	3.454	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc(F)c(F)c(F)c1F	ZINC001085939217	1358895117	/nfs/dbraw/zinc/89/51/17/1358895117.db2.gz	ARSBMYYHIYOKSF-NSHDSACASA-N	0	3	344.352	3.356	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1ccsc1C(F)(F)F	ZINC001085944170	1358902899	/nfs/dbraw/zinc/90/28/99/1358902899.db2.gz	BCBLHZIZZFFEFO-LLVKDONJSA-N	0	3	332.391	3.489	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@@H](CNC(=O)c3cccs3)C2)c1	ZINC001086018467	1358967337	/nfs/dbraw/zinc/96/73/37/1358967337.db2.gz	WPTPLYOACXRGIV-OTVXOJSOSA-N	0	3	343.427	3.057	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2sc(C3CC3)nc2C)C1	ZINC001086083173	1358991389	/nfs/dbraw/zinc/99/13/89/1358991389.db2.gz	QFJBOGYFWSGDPE-BJHJDKERSA-N	0	3	339.892	3.179	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(-n3cccc3)cc2)C1	ZINC001086140706	1359006563	/nfs/dbraw/zinc/00/65/63/1359006563.db2.gz	YEMLZCXORPMMIL-WOVMCDHWSA-N	0	3	343.858	3.328	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)[C@@H]2CCC[C@H]2CC)C1	ZINC001086188875	1359021761	/nfs/dbraw/zinc/02/17/61/1359021761.db2.gz	CSFUQJBFNBWTKB-APIJFGDWSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ncc(Cl)cc2Cl)C1	ZINC001086233278	1359034444	/nfs/dbraw/zinc/03/44/44/1359034444.db2.gz	ZPJPXDXOTVCTAB-JGZJWPJOSA-N	0	3	348.661	3.239	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc(C)nc3ccccc32)C1	ZINC001086267296	1359048636	/nfs/dbraw/zinc/04/86/36/1359048636.db2.gz	XHEAQGZBAKQTQX-GASCZTMLSA-N	0	3	343.858	3.394	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cncc3ccccc32)C1	ZINC001086277860	1359051379	/nfs/dbraw/zinc/05/13/79/1359051379.db2.gz	XIOVIQQPIPNBFD-OTVXOJSOSA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cccc3scnc32)C1	ZINC001086365141	1359078670	/nfs/dbraw/zinc/07/86/70/1359078670.db2.gz	FYAFWGUZHPOOIY-HAQNSBGRSA-N	0	3	335.860	3.147	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@H]2Cc3ccc(Cl)cc32)C1	ZINC001086544159	1359138742	/nfs/dbraw/zinc/13/87/42/1359138742.db2.gz	DXVFJSAKWRIHHA-PJODQICGSA-N	0	3	339.266	3.217	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2ccc(F)cc2)C1	ZINC001086568793	1359150588	/nfs/dbraw/zinc/15/05/88/1359150588.db2.gz	VZGNLQDWVVXVLL-VQTJNVASSA-N	0	3	336.410	3.047	20	30		EGEDHN
C=CCC[N@@H+]1C[C@@H](c2ccccc2)[C@H](NC(=O)c2ccccc2[O-])C1	ZINC001086575243	1359152653	/nfs/dbraw/zinc/15/26/53/1359152653.db2.gz	HWXORDUDNQBFRA-RBUKOAKNSA-N	0	3	336.435	3.166	20	30		EGEDHN
C=CCC[N@H+]1C[C@@H](c2ccccc2)[C@H](NC(=O)c2ccccc2[O-])C1	ZINC001086575243	1359152655	/nfs/dbraw/zinc/15/26/55/1359152655.db2.gz	HWXORDUDNQBFRA-RBUKOAKNSA-N	0	3	336.435	3.166	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2ccsc2C)C1	ZINC001086586690	1359156578	/nfs/dbraw/zinc/15/65/78/1359156578.db2.gz	GYPUODBOBUEOOD-RBUKOAKNSA-N	0	3	338.476	3.278	20	30		EGEDHN
C=CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2csc(C)n2)C1	ZINC001086605491	1359162090	/nfs/dbraw/zinc/16/20/90/1359162090.db2.gz	HLKHIYCPEUUQCF-DLBZAZTESA-N	0	3	341.480	3.225	20	30		EGEDHN
C=C(C)CN1C[C@@H](c2ccccc2)[C@H](NC(=O)Cc2occc2C)C1	ZINC001086608556	1359163204	/nfs/dbraw/zinc/16/32/04/1359163204.db2.gz	OAMSPPLWBUSFDS-RBUKOAKNSA-N	0	3	338.451	3.291	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N(C)Cc1ccc(Br)cc1F	ZINC001342266648	1390593282	/nfs/dbraw/zinc/59/32/82/1390593282.db2.gz	JCBWQHCKEIIDGQ-AWEZNQCLSA-N	0	3	343.240	3.230	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)[C@H]2CCCO[C@H]2C(C)C)C1	ZINC001086699442	1359187908	/nfs/dbraw/zinc/18/79/08/1359187908.db2.gz	NHKJXLLYSBPPDL-YVSFHVDLSA-N	0	3	342.911	3.065	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2c(C)noc2C2CC2)C1	ZINC001086761297	1359196263	/nfs/dbraw/zinc/19/62/63/1359196263.db2.gz	YDLVHSDJQXHQOW-GXTWGEPZSA-N	0	3	337.851	3.101	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CC[C@@H](NCc3conc3CC)C2)CC1	ZINC001086794767	1359202990	/nfs/dbraw/zinc/20/29/90/1359202990.db2.gz	JYFXNCKXBPSCEH-MAUKXSAKSA-N	0	3	345.487	3.358	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC2(C[C@H]1C)CCN(Cc1cccc(F)c1)CC2	ZINC001086908829	1359237183	/nfs/dbraw/zinc/23/71/83/1359237183.db2.gz	IVCHEIHJNXZPQC-HZPDHXFCSA-N	0	3	343.446	3.188	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cscc3Cl)C2)CC1	ZINC001086927609	1359252826	/nfs/dbraw/zinc/25/28/26/1359252826.db2.gz	GTODATDLGHUTFV-CYBMUJFWSA-N	0	3	336.888	3.351	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H]3CCCC34CC4)C2)CC1	ZINC001086929774	1359254126	/nfs/dbraw/zinc/25/41/26/1359254126.db2.gz	QETYKHOTMJVTEY-ROUUACIJSA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3c[nH]c4ccccc34)C2)CC1	ZINC001086931911	1359255881	/nfs/dbraw/zinc/25/58/81/1359255881.db2.gz	VLVCGLFQXNRMBQ-INIZCTEOSA-N	0	3	335.451	3.118	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)C[C@@H]3C[C@H]3C3CC3)C2)CC1	ZINC001086933383	1359257259	/nfs/dbraw/zinc/25/72/59/1359257259.db2.gz	LSMQAUFKLINHPT-NEWSRXKRSA-N	0	3	328.500	3.149	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3cncc(Cl)c3)C2)CC1	ZINC001086947745	1359268927	/nfs/dbraw/zinc/26/89/27/1359268927.db2.gz	GMRWXDXVTYRVFF-OAHLLOKOSA-N	0	3	345.874	3.075	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H](C)Cc3ccco3)C2)CC1	ZINC001086947508	1359269154	/nfs/dbraw/zinc/26/91/54/1359269154.db2.gz	AARSQJREGGVZPI-ROUUACIJSA-N	0	3	342.483	3.185	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc4sccc4[nH]3)C2)CC1	ZINC001086951941	1359272171	/nfs/dbraw/zinc/27/21/71/1359272171.db2.gz	UQFRCUNPSSBORI-CQSZACIVSA-N	0	3	341.480	3.179	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3cc(C)c(CC)o3)C2)CC1	ZINC001086952393	1359272778	/nfs/dbraw/zinc/27/27/78/1359272778.db2.gz	HXYDZVRYGPQHEU-KRWDZBQOSA-N	0	3	342.483	3.490	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc4c(s3)CCC4)C2)CC1	ZINC001086955090	1359275821	/nfs/dbraw/zinc/27/58/21/1359275821.db2.gz	CUOSWKHLDDAKGN-OAHLLOKOSA-N	0	3	342.508	3.187	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cncc4ccccc43)C2)CC1	ZINC001086958146	1359279122	/nfs/dbraw/zinc/27/91/22/1359279122.db2.gz	FIWBQHHRTYFTGR-QGZVFWFLSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3coc4ccccc34)C2)CC1	ZINC001086959889	1359280051	/nfs/dbraw/zinc/28/00/51/1359280051.db2.gz	XRISPMRZKBKXJY-INIZCTEOSA-N	0	3	336.435	3.383	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(Cl)o3)C(C)(C)[C@@H]21	ZINC001087272307	1359346303	/nfs/dbraw/zinc/34/63/03/1359346303.db2.gz	FVUGBANEAMKIBH-DAXOMENPSA-N	0	3	334.847	3.175	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)C1C(C)(C)C1(C)C	ZINC001087280055	1359357730	/nfs/dbraw/zinc/35/77/30/1359357730.db2.gz	IXQRZUMYOSXQNC-HYVNUMGLSA-N	0	3	330.516	3.297	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(CC)s3)C(C)(C)[C@@H]21	ZINC001087294604	1359375353	/nfs/dbraw/zinc/37/53/53/1359375353.db2.gz	VZBUPBPYXMARCZ-DJIMGWMZSA-N	0	3	330.497	3.163	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc(C(C)C)n3)C(C)(C)[C@@H]21	ZINC001087294988	1359376064	/nfs/dbraw/zinc/37/60/64/1359376064.db2.gz	BXSZFQVWFCGMEU-ATZDWAIDSA-N	0	3	339.483	3.057	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cccc4[nH]ccc43)C(C)(C)[C@H]21	ZINC001087305797	1359391521	/nfs/dbraw/zinc/39/15/21/1359391521.db2.gz	YUBGTEZNHKLBMS-NEWSRXKRSA-N	0	3	335.451	3.020	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cccc(Cl)c3)C(C)(C)[C@H]21	ZINC001087313939	1359402537	/nfs/dbraw/zinc/40/25/37/1359402537.db2.gz	CFVBOFKAXJYYHD-IKGGRYGDSA-N	0	3	330.859	3.192	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc4ccn(C)c4c3)C(C)(C)[C@@H]21	ZINC001087313767	1359403033	/nfs/dbraw/zinc/40/30/33/1359403033.db2.gz	ZZSSSGHCIYKKDQ-MISYRCLQSA-N	0	3	349.478	3.030	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)[C@H](C)C2CC2)CCN1Cc1ccc(C#N)cc1	ZINC001087533054	1359515321	/nfs/dbraw/zinc/51/53/21/1359515321.db2.gz	KCRWWMMFKNSNEO-MDASCCDHSA-N	0	3	325.456	3.073	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2csc([C@H](C)OC)n2)[C@H]1CC	ZINC001087570631	1359535638	/nfs/dbraw/zinc/53/56/38/1359535638.db2.gz	BRBFYNKQYJRBBX-KCQAQPDRSA-N	0	3	337.489	3.009	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2c(F)cc(F)cc2F)[C@H]1CC	ZINC001087709015	1359603044	/nfs/dbraw/zinc/60/30/44/1359603044.db2.gz	AGWFAKXAMYCBDJ-LSDHHAIUSA-N	0	3	326.362	3.263	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCN(CCc3ccns3)[C@@H]2CC)CC1	ZINC001087714130	1359605602	/nfs/dbraw/zinc/60/56/02/1359605602.db2.gz	QTEMGDGMVSOENW-ZWKOTPCHSA-N	0	3	347.528	3.401	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cccc3sccc32)[C@H]1CC	ZINC001087748423	1359625635	/nfs/dbraw/zinc/62/56/35/1359625635.db2.gz	GWFYGUDWNTWRTM-ZWKOTPCHSA-N	0	3	340.492	3.436	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cnn(C3CCCC3)c2C)[C@H]1CC	ZINC001087790255	1359646738	/nfs/dbraw/zinc/64/67/38/1359646738.db2.gz	BFVGPESEMMTNLV-RBUKOAKNSA-N	0	3	344.503	3.465	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)[C@@H]2CCCc3sc(C)nc32)[C@H]1CC	ZINC001087794095	1359649680	/nfs/dbraw/zinc/64/96/80/1359649680.db2.gz	SMSZZPOBKSOREP-QLFBSQMISA-N	0	3	333.501	3.027	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc(C(F)(F)F)cc2)[C@H]1CC	ZINC001087806554	1359656810	/nfs/dbraw/zinc/65/68/10/1359656810.db2.gz	MIFGOXFEUSYRFG-LSDHHAIUSA-N	0	3	326.362	3.474	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2cc3cccc(F)c3o2)[C@H]1CC	ZINC001087836046	1359672089	/nfs/dbraw/zinc/67/20/89/1359672089.db2.gz	BTUQBGMKBGDKSG-JKSUJKDBSA-N	0	3	328.387	3.178	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3cc4cc(Cl)ccc4o3)C[C@@H]2C1	ZINC001088031813	1359728804	/nfs/dbraw/zinc/72/88/04/1359728804.db2.gz	NBYLAMBEPAIAND-HIFRSBDPSA-N	0	3	342.826	3.113	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)C3[C@H]4CCCCCC[C@H]34)C[C@@H]2C1	ZINC001088119174	1359762295	/nfs/dbraw/zinc/76/22/95/1359762295.db2.gz	IBPJLVFRPSGCQT-XWSJACJDSA-N	0	3	328.500	3.006	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1C[C@H]2CCN(Cc3ccc(C#N)cc3)C[C@H]2C1	ZINC001088127733	1359766106	/nfs/dbraw/zinc/76/61/06/1359766106.db2.gz	KWDPPVJCWLBAKZ-DBVUQKKJSA-N	0	3	339.483	3.131	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3ccc4c(c3)C=CCC4)C[C@@H]2C1	ZINC001088137636	1359769831	/nfs/dbraw/zinc/76/98/31/1359769831.db2.gz	WNMJMLGELAQLCR-RTWAWAEBSA-N	0	3	334.463	3.063	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3ccc(C(C)C)c(Cl)c3)C[C@@H]2C1	ZINC001088217501	1359800819	/nfs/dbraw/zinc/80/08/19/1359800819.db2.gz	JOELKDIEOKRYLZ-SJORKVTESA-N	0	3	344.886	3.491	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2ccn3ccnc3c2)C1	ZINC001088346590	1359833791	/nfs/dbraw/zinc/83/37/91/1359833791.db2.gz	SZPUVEFEMKCBNI-MRXNPFEDSA-N	0	3	346.862	3.061	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)[C@@H]2CC[C@H](c3ccccc3)O2)[C@H]1C	ZINC001088572988	1359978007	/nfs/dbraw/zinc/97/80/07/1359978007.db2.gz	SWSWDVBQNXHDGM-LULLPPNCSA-N	0	3	328.456	3.062	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)Cc2c(C)[nH]c3ccccc32)[C@H]1C	ZINC001088830576	1360067069	/nfs/dbraw/zinc/06/70/69/1360067069.db2.gz	RUSGKXNUJGKWFC-QAPCUYQASA-N	0	3	325.456	3.174	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3cccc(COC)c3)[C@@H]2C)C1	ZINC001088840182	1360074103	/nfs/dbraw/zinc/07/41/03/1360074103.db2.gz	ZODCWLBPGHFKKR-APWZRJJASA-N	0	3	342.483	3.268	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccc(OCC(C)C)cc2)[C@H]1C	ZINC001089021617	1360139809	/nfs/dbraw/zinc/13/98/09/1360139809.db2.gz	ZPSSXMHUHJNSCH-APWZRJJASA-N	0	3	330.472	3.490	20	30		EGEDHN
C=C(C)CCN1CC[C@H](NC(=O)c2ccc(P(C)(C)=O)cc2)[C@H]1C	ZINC001089054697	1360149802	/nfs/dbraw/zinc/14/98/02/1360149802.db2.gz	BCKOLVANMMZUPG-QAPCUYQASA-N	0	3	348.427	3.093	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@@H](CNCc2c(F)cccc2F)[C@H](C)C1	ZINC001184356032	1387438877	/nfs/dbraw/zinc/43/88/77/1387438877.db2.gz	GSYOVEXOGFYXDA-CVEARBPZSA-N	0	3	348.437	3.198	20	30		EGEDHN
CC(C)CC(=O)N1CCCC[C@H]1CN(C)Cc1cccc(C#N)c1	ZINC001089107996	1360172061	/nfs/dbraw/zinc/17/20/61/1360172061.db2.gz	VVWZFYFPIQXGRA-IBGZPJMESA-N	0	3	327.472	3.417	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCCN1C(=O)C=C1CCC1	ZINC001089154303	1360209492	/nfs/dbraw/zinc/20/94/92/1360209492.db2.gz	CEDXGPUXSQGFLP-FQEVSTJZSA-N	0	3	337.467	3.481	20	30		EGEDHN
Cc1cnc(CNC[C@H]2CCN(C(=O)C#CC(C)(C)C)C[C@H]2C)s1	ZINC001184368869	1387441726	/nfs/dbraw/zinc/44/17/26/1387441726.db2.gz	CURGCRUHTPVAEF-GDBMZVCRSA-N	0	3	347.528	3.075	20	30		EGEDHN
CC[C@H](CC#N)NC(=O)[C@@H]1CCCN(Cc2ccc(Cl)cc2)C1	ZINC001184404279	1387450624	/nfs/dbraw/zinc/45/06/24/1387450624.db2.gz	HKQWOOJZKVKROI-NVXWUHKLSA-N	0	3	333.863	3.360	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cccc3cccnc32)CC(C)(C)C1	ZINC001089432317	1360423630	/nfs/dbraw/zinc/42/36/30/1360423630.db2.gz	ABYNGIAPRPMKIB-KRWDZBQOSA-N	0	3	335.451	3.088	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(OC)cs2)CC(C)(C)C1	ZINC001089457257	1360444285	/nfs/dbraw/zinc/44/42/85/1360444285.db2.gz	TWFSGPUFJOMILT-AWEZNQCLSA-N	0	3	334.485	3.000	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cncc3sccc32)CC(C)(C)C1	ZINC001089471100	1360454441	/nfs/dbraw/zinc/45/44/41/1360454441.db2.gz	QFQSCMUIKAURKY-CQSZACIVSA-N	0	3	341.480	3.150	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2cc(C)ccc2C)CC(C)(C)C1	ZINC001089476485	1360458907	/nfs/dbraw/zinc/45/89/07/1360458907.db2.gz	NZWNYXDKSSEKOZ-IBGZPJMESA-N	0	3	326.484	3.086	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@@H]2CCc3ccccc3C2)CC(C)(C)C1	ZINC001089501797	1360475524	/nfs/dbraw/zinc/47/55/24/1360475524.db2.gz	HDSGPFWLHSDJFK-UXHICEINSA-N	0	3	338.495	3.032	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2sccc2COC)CC(C)(C)C1	ZINC001089541255	1360498221	/nfs/dbraw/zinc/49/82/21/1360498221.db2.gz	IBXHKDWBHYCQIC-MRXNPFEDSA-N	0	3	348.512	3.138	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C23CC4CC(CC(C4)C2)C3)CC(C)(C)C1	ZINC001089543805	1360499508	/nfs/dbraw/zinc/49/95/08/1360499508.db2.gz	HMWYVNHOQMLYSI-RQJZOYDLSA-N	0	3	342.527	3.443	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3c(s2)CCC3)CC(C)(C)C1	ZINC001089556993	1360506737	/nfs/dbraw/zinc/50/67/37/1360506737.db2.gz	XCWVZOBKXRRDIV-MRXNPFEDSA-N	0	3	344.524	3.481	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc(CC)c(C)s2)CC(C)(C)C1	ZINC001089556316	1360506892	/nfs/dbraw/zinc/50/68/92/1360506892.db2.gz	PNYOLJCKQVJLGR-MRXNPFEDSA-N	0	3	332.513	3.473	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc2cc[nH]c2n1	ZINC001089652957	1360565676	/nfs/dbraw/zinc/56/56/76/1360565676.db2.gz	MJAGPFYXJBKXBO-MRXNPFEDSA-N	0	3	340.471	3.359	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1[nH]nc2ccc(C)cc21	ZINC001089663824	1360574292	/nfs/dbraw/zinc/57/42/92/1360574292.db2.gz	WAMPAANFODWHRI-OAHLLOKOSA-N	0	3	340.471	3.278	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1c(C)cc(C)nc1C	ZINC001089675818	1360584345	/nfs/dbraw/zinc/58/43/45/1360584345.db2.gz	QXTKNRFQBCKEFB-SFHVURJKSA-N	0	3	341.499	3.251	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(C(C)C)n[nH]1	ZINC001089699818	1360602775	/nfs/dbraw/zinc/60/27/75/1360602775.db2.gz	QRFNDJATUBNUIF-HNNXBMFYSA-N	0	3	332.492	3.330	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ccnc(C2CC2)n1	ZINC001089706373	1360609016	/nfs/dbraw/zinc/60/90/16/1360609016.db2.gz	RTSDFJQECLQKCY-INIZCTEOSA-N	0	3	342.487	3.151	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H]1CCO[C@H]1C(=C)C	ZINC001089708678	1360612866	/nfs/dbraw/zinc/61/28/66/1360612866.db2.gz	KCBZUOKOVDFXAG-SQNIBIBYSA-N	0	3	334.504	3.151	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cccc2nsnc21	ZINC001089718632	1360619685	/nfs/dbraw/zinc/61/96/85/1360619685.db2.gz	RUTFVLKRFWFIIQ-CYBMUJFWSA-N	0	3	344.484	3.098	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1csc(Cl)n1	ZINC001089719921	1360622607	/nfs/dbraw/zinc/62/26/07/1360622607.db2.gz	MVZAFPDFVNLECT-GFCCVEGCSA-N	0	3	339.892	3.040	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1occ2c1CCCC2	ZINC001089723723	1360627039	/nfs/dbraw/zinc/62/70/39/1360627039.db2.gz	OAXCBTWVQUWSCD-KRWDZBQOSA-N	0	3	342.483	3.402	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cncnc1C1CC1	ZINC001089729451	1360632775	/nfs/dbraw/zinc/63/27/75/1360632775.db2.gz	OFHMYMZWECULKJ-INIZCTEOSA-N	0	3	342.487	3.151	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)c2ccccc2F)C1	ZINC001089760083	1360652517	/nfs/dbraw/zinc/65/25/17/1360652517.db2.gz	GYDMCNBDRFTFBI-MBGYTDRXSA-N	0	3	348.849	3.361	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1ccc(F)cc1	ZINC001089760490	1360652593	/nfs/dbraw/zinc/65/25/93/1360652593.db2.gz	LQMJWHFVYPIVFJ-OWLYRPNTSA-N	0	3	348.849	3.361	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1ccccc1F	ZINC001089760082	1360652766	/nfs/dbraw/zinc/65/27/66/1360652766.db2.gz	GYDMCNBDRFTFBI-DNMXQMFDSA-N	0	3	348.849	3.361	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)/C=C(/C)C1CC1	ZINC001089775688	1360658979	/nfs/dbraw/zinc/65/89/79/1360658979.db2.gz	AALJEXFUVQBFPG-GDVRHERXSA-N	0	3	334.891	3.264	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1ccoc1CC	ZINC001089804980	1360670944	/nfs/dbraw/zinc/67/09/44/1360670944.db2.gz	YKGCPONIAURZBI-ORQFMDKSSA-N	0	3	348.874	3.377	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C12CCC(CC1)C2	ZINC001089826031	1360682196	/nfs/dbraw/zinc/68/21/96/1360682196.db2.gz	FOWBOGONNSBYPL-UDDOEOBRSA-N	0	3	348.918	3.488	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cscc2C)CC2(CCOCC2)C1	ZINC001089931056	1360749730	/nfs/dbraw/zinc/74/97/30/1360749730.db2.gz	RCJMKCGADPKQLO-MRXNPFEDSA-N	0	3	348.512	3.234	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)C2CCC3(CC3)CC2)CC2(CCOCC2)C1	ZINC001089946695	1360758422	/nfs/dbraw/zinc/75/84/22/1360758422.db2.gz	NDJMFPKQRQTOAY-GOSISDBHSA-N	0	3	346.515	3.130	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2csc(C)c2)CC2(CCOCC2)C1	ZINC001089961493	1360768111	/nfs/dbraw/zinc/76/81/11/1360768111.db2.gz	JPOLZFGIFOVUES-QGZVFWFLSA-N	0	3	348.512	3.234	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)[C@H]2CC[C@H](CC)CC2)CC2(CCOCC2)C1	ZINC001089969904	1360772590	/nfs/dbraw/zinc/77/25/90/1360772590.db2.gz	ZHUIGDDTKWCYKQ-FHWLQOOXSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(C)CN1CC[C@@H](NC(=O)c2ccc(C(C)(C)CC)cc2)[C@H](O)C1	ZINC001090346881	1360893849	/nfs/dbraw/zinc/89/38/49/1360893849.db2.gz	HXMWSTNJBFDQTJ-RTBURBONSA-N	0	3	344.499	3.115	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cccc(C3CCCC3)c2)[C@H](O)C1	ZINC001090722795	1360928105	/nfs/dbraw/zinc/92/81/05/1360928105.db2.gz	PYUBBBWWXCRFSB-VQTJNVASSA-N	0	3	342.483	3.085	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cccc3cccnc32)C1	ZINC001091125619	1360994368	/nfs/dbraw/zinc/99/43/68/1360994368.db2.gz	LFXRIOVTABUOFF-UHFFFAOYSA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(Cl)cc2F)C1	ZINC001091130568	1360995722	/nfs/dbraw/zinc/99/57/22/1360995722.db2.gz	MBBKWPVLSOKXAQ-UHFFFAOYSA-N	0	3	331.218	3.330	20	30		EGEDHN
CC1(C)CC[C@H]1C(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1	ZINC001091193199	1361003181	/nfs/dbraw/zinc/00/31/81/1361003181.db2.gz	RGZGOGDJWWJVNQ-PREGVCBESA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CN(Cc3cccnc3C)C[C@@]2(C)C1	ZINC001091978047	1361265115	/nfs/dbraw/zinc/26/51/15/1361265115.db2.gz	FMNWJMOIQMKGKT-GIVPXCGWSA-N	0	3	341.499	3.273	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@@H](c3ccccc3)C(C)C)C[C@]2(C)C1	ZINC001092047640	1361282394	/nfs/dbraw/zinc/28/23/94/1361282394.db2.gz	JBNPMNQVDDKVPG-SJBKTWHCSA-N	0	3	338.495	3.230	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc4ccccc4n3CC)C[C@]2(C)C1	ZINC001092297929	1361358560	/nfs/dbraw/zinc/35/85/60/1361358560.db2.gz	GBWWEFFFPBEYAD-GCJKJVERSA-N	0	3	349.478	3.078	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc(C(C)(F)F)cc3)C[C@]2(C)C1	ZINC001092328894	1361366432	/nfs/dbraw/zinc/36/64/32/1361366432.db2.gz	QUMBQLKVMSUFEU-MJGOQNOKSA-N	0	3	346.421	3.216	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1CNC(=O)C1C=CC=CC=C1	ZINC001092644472	1361431628	/nfs/dbraw/zinc/43/16/28/1361431628.db2.gz	JIWLQZKRSPEVNZ-DENIHFKCSA-N	0	3	346.474	3.021	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)Cc2ccsc2)CC1	ZINC001093351783	1361565383	/nfs/dbraw/zinc/56/53/83/1361565383.db2.gz	OTCXZPDKZFYLAD-IBGZPJMESA-N	0	3	342.508	3.017	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@](C)(C=C)CC)CC1	ZINC001093377913	1361588677	/nfs/dbraw/zinc/58/86/77/1361588677.db2.gz	YRPWRSWROLANBH-AZUAARDMSA-N	0	3	328.500	3.315	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)c2ccc(F)s2)CC1	ZINC001093384271	1361595971	/nfs/dbraw/zinc/59/59/71/1361595971.db2.gz	XKGYXOJXDSPHDJ-KRWDZBQOSA-N	0	3	346.471	3.227	20	30		EGEDHN
Cc1cccc([C@H](C)N2[C@@H]3CC[C@H]2[C@@H](NC(=O)c2ccc(C#N)[nH]2)C3)c1	ZINC001095329682	1362103659	/nfs/dbraw/zinc/10/36/59/1362103659.db2.gz	XHMFHCSSKAEIIZ-KTGNWYGMSA-N	0	3	348.450	3.291	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1conc1C1CCCC1)C2	ZINC001095519238	1362161330	/nfs/dbraw/zinc/16/13/30/1362161330.db2.gz	UMXGZRBLPLWEAV-PVAVHDDUSA-N	0	3	329.444	3.243	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCc1ccccc1	ZINC001095537853	1362164101	/nfs/dbraw/zinc/16/41/01/1362164101.db2.gz	MJZGQBDNHKQOJO-AABGKKOBSA-N	0	3	349.478	3.252	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H]1CC[C@@H](c3ccccc3)C1)C2	ZINC001095610050	1362184924	/nfs/dbraw/zinc/18/49/24/1362184924.db2.gz	BFKPIHONSJXRLF-XKRYSZRTSA-N	0	3	336.479	3.315	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1cccc3ncccc13)C2	ZINC001095745361	1362219382	/nfs/dbraw/zinc/21/93/82/1362219382.db2.gz	LYYIEPDRTSLIIP-UXPWSPDFSA-N	0	3	335.451	3.075	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1noc3c1CC(C)(C)CC3)C2	ZINC001095808096	1362238741	/nfs/dbraw/zinc/23/87/41/1362238741.db2.gz	UEWXQCWGAQCRNJ-KBMXLJTQSA-N	0	3	343.471	3.101	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1c[nH]c3c1cccc3CC)C2	ZINC001096611510	1362596755	/nfs/dbraw/zinc/59/67/55/1362596755.db2.gz	OMYGKQYMVXTOHB-MNEFBYGVSA-N	0	3	335.451	3.089	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H]1CCc3cc(OC)ccc31)C2	ZINC001097183782	1362877353	/nfs/dbraw/zinc/87/73/53/1362877353.db2.gz	RPKOWMOLIQBRQY-NMLACTOBSA-N	0	3	340.467	3.023	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H]1CCc3cc(F)ccc31)C2	ZINC001097554171	1363054904	/nfs/dbraw/zinc/05/49/04/1363054904.db2.gz	AWPYRQSTGCJFHX-OWYHZJEWSA-N	0	3	328.431	3.153	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H]1CCc3cc(F)ccc31)C2	ZINC001097554170	1363055240	/nfs/dbraw/zinc/05/52/40/1363055240.db2.gz	AWPYRQSTGCJFHX-LULLPPNCSA-N	0	3	328.431	3.153	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1c(C)[nH]c3ccccc31)C2	ZINC001097759921	1363115435	/nfs/dbraw/zinc/11/54/35/1363115435.db2.gz	KUQZFPDRPNMXDF-YSGRDPCXSA-N	0	3	337.467	3.316	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H]1CCc3cccc(OC)c31)C2	ZINC001097993047	1363191329	/nfs/dbraw/zinc/19/13/29/1363191329.db2.gz	COMIALBRVSITBP-XDNAFOTISA-N	0	3	340.467	3.023	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ncccc1C(F)(F)F)C2	ZINC001098152250	1363237244	/nfs/dbraw/zinc/23/72/44/1363237244.db2.gz	HDYFTVFLAUBIEK-BNOWGMLFSA-N	0	3	339.361	3.012	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C1CCC(C(F)F)CC1)C2	ZINC001098303297	1363291271	/nfs/dbraw/zinc/29/12/71/1363291271.db2.gz	ZIOZHFLKWWLKLB-PEHJNBARSA-N	0	3	326.431	3.356	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H]1CC[C@@H]3C[C@@H]3CC1)C[C@@H](C)O2	ZINC001098616368	1363400437	/nfs/dbraw/zinc/40/04/37/1363400437.db2.gz	JQLNRVTYZVOYGI-MKXGPGLRSA-N	0	3	346.515	3.081	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@]1(C)CC=C(C)CC1)C[C@@H](C)O2	ZINC001098660716	1363424188	/nfs/dbraw/zinc/42/41/88/1363424188.db2.gz	XARJRUOMCNTDEI-QUCCMNQESA-N	0	3	346.515	3.391	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)C2C3CC4CC(C3)CC2C4)C1	ZINC001098876691	1363502138	/nfs/dbraw/zinc/50/21/38/1363502138.db2.gz	SDLODCBSVRWIQU-CZNJUIKWSA-N	0	3	328.500	3.215	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(F)c(C)cc2F)C1	ZINC001098885619	1363504761	/nfs/dbraw/zinc/50/47/61/1363504761.db2.gz	GCCISKKNELZMGB-LIRRHRJNSA-N	0	3	334.410	3.434	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CCC[C@]3(NC(=O)[C@H]3C[C@H]4C[C@H]4C3)C2)c1	ZINC001098986160	1363557176	/nfs/dbraw/zinc/55/71/76/1363557176.db2.gz	JXUANQNIFATDAT-MOFJNDHNSA-N	0	3	349.478	3.075	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)Cc2ccc(F)c(Cl)c2)C1	ZINC001099048585	1363593367	/nfs/dbraw/zinc/59/33/67/1363593367.db2.gz	ZGFCIYNFZVJJOZ-KXBFYZLASA-N	0	3	348.849	3.016	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)Cc2ccccc2OC(C)C)C1	ZINC001099078791	1363611360	/nfs/dbraw/zinc/61/13/60/1363611360.db2.gz	REAAMIVBTCMNSO-RXVVDRJESA-N	0	3	342.483	3.173	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)C(C)(C)[C@H]1CCCCO1	ZINC001099079658	1363611856	/nfs/dbraw/zinc/61/18/56/1363611856.db2.gz	HAPYTVMYKYCDQE-IAGOWNOFSA-N	0	3	336.520	3.375	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(C(F)F)cc2)C1	ZINC001099081322	1363612757	/nfs/dbraw/zinc/61/27/57/1363612757.db2.gz	NVBXEWUNTUKYLW-LPHOPBHVSA-N	0	3	332.394	3.232	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)C1(COC)CCCC1	ZINC001099103088	1363623491	/nfs/dbraw/zinc/62/34/91/1363623491.db2.gz	VIFKZRCIYOOTRB-QGZVFWFLSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)Cc1nc(C)sc1C	ZINC001099121872	1363635770	/nfs/dbraw/zinc/63/57/70/1363635770.db2.gz	QHFJGDOHFQVVMN-OAHLLOKOSA-N	0	3	335.517	3.095	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)Cc1nc(C)sc1C	ZINC001099121870	1363635823	/nfs/dbraw/zinc/63/58/23/1363635823.db2.gz	QHFJGDOHFQVVMN-HNNXBMFYSA-N	0	3	335.517	3.095	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)C(C)(C)C1CCOCC1	ZINC001099139972	1363650266	/nfs/dbraw/zinc/65/02/66/1363650266.db2.gz	MGTBKGDHEQHAIZ-QGZVFWFLSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@H]1CCC(C)(C)CN1CCOC1CCC1	ZINC001099170286	1363668585	/nfs/dbraw/zinc/66/85/85/1363668585.db2.gz	FOGIJHHFHPHWJD-MRXNPFEDSA-N	0	3	336.520	3.375	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H](CC)OC1CCCC1	ZINC001099251456	1363713941	/nfs/dbraw/zinc/71/39/41/1363713941.db2.gz	JZXIXOYPEVZJQU-MJGOQNOKSA-N	0	3	348.531	3.354	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H](C)c1c(C)noc1C	ZINC001099271356	1363725159	/nfs/dbraw/zinc/72/51/59/1363725159.db2.gz	XCUHKNJFCOAVLA-XJKSGUPXSA-N	0	3	333.476	3.188	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)Cc2cccc(C)c2)C[C@H]1C(F)(F)F	ZINC001099300539	1363738861	/nfs/dbraw/zinc/73/88/61/1363738861.db2.gz	LWXLIZDIBDPESA-HZPDHXFCSA-N	0	3	340.389	3.093	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2ccc3ccccc3n2)C[C@H]1C(F)(F)F	ZINC001099334875	1363757048	/nfs/dbraw/zinc/75/70/48/1363757048.db2.gz	FMQOJEJDASYRCM-CZUORRHYSA-N	0	3	349.356	3.013	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@@H](C=C)c2ccccc2)C[C@H]1C(F)(F)F	ZINC001099345891	1363763426	/nfs/dbraw/zinc/76/34/26/1363763426.db2.gz	AASPXYCQSRXSHR-ARFHVFGLSA-N	0	3	338.373	3.121	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)/C=C/C(C)(C)C)CC2(CCOCC2)C1	ZINC001099572235	1363856542	/nfs/dbraw/zinc/85/65/42/1363856542.db2.gz	SMOJLXCXHZPRAU-LXXRFIIISA-N	0	3	334.504	3.152	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C(C)(C)C(C)C)CC2(CCOCC2)C1	ZINC001099583406	1363865761	/nfs/dbraw/zinc/86/57/61/1363865761.db2.gz	QNQVLMZTOGAOPC-QGZVFWFLSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1CN(CC(=C)C)CC2(CCOCC2)C1	ZINC001099590846	1363872552	/nfs/dbraw/zinc/87/25/52/1363872552.db2.gz	MCHPEXHTYUCYKI-PKOBYXMFSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CCN(Cc2ccc(CCC)cc2)C[C@H]1O	ZINC001099858377	1363965796	/nfs/dbraw/zinc/96/57/96/1363965796.db2.gz	KXJPJSNUALWVQC-WOJBJXKFSA-N	0	3	344.499	3.047	20	30		EGEDHN
C=CCOCC(=O)NCC1CC(N[C@H](C)c2ccccc2Cl)C1	ZINC001100187585	1364039624	/nfs/dbraw/zinc/03/96/24/1364039624.db2.gz	CKSKMZPKCQZBDZ-WLYUNCDWSA-N	0	3	336.863	3.088	20	30		EGEDHN
O=C(NCC1CC(NCC#Cc2ccccc2Cl)C1)C1CC=CC1	ZINC001100210529	1364044766	/nfs/dbraw/zinc/04/47/66/1364044766.db2.gz	CAESUFWKUCCELF-UHFFFAOYSA-N	0	3	342.870	3.142	20	30		EGEDHN
O=C(NCC1CC(NCC#Cc2ccccc2Cl)C1)C1=CCCC1	ZINC001100238988	1364053996	/nfs/dbraw/zinc/05/39/96/1364053996.db2.gz	ACMZUKDEYVRTKU-UHFFFAOYSA-N	0	3	342.870	3.286	20	30		EGEDHN
CC(C)=C(F)C(=O)NCC1CC(NCC#Cc2cccc(Cl)c2)C1	ZINC001100242678	1364055203	/nfs/dbraw/zinc/05/52/03/1364055203.db2.gz	FIVUMQYNWVQPKV-UHFFFAOYSA-N	0	3	348.849	3.439	20	30		EGEDHN
O=C(NCC1CC(NCC#Cc2ccccc2)C1)C1=CCCCCC1	ZINC001100270354	1364064079	/nfs/dbraw/zinc/06/40/79/1364064079.db2.gz	BXVIBRVPJPQCTI-UHFFFAOYSA-N	0	3	336.479	3.413	20	30		EGEDHN
CC1(C)CC(C(=O)NCC2CC(NCC#Cc3ccc(F)cc3)C2)C1	ZINC001100294310	1364070397	/nfs/dbraw/zinc/07/03/97/1364070397.db2.gz	QIJJNMRLBPLZAE-UHFFFAOYSA-N	0	3	342.458	3.098	20	30		EGEDHN
CC(C)C#CC(=O)NCC1CC(NCc2cc(Cl)ccc2F)C1	ZINC001100308961	1364076047	/nfs/dbraw/zinc/07/60/47/1364076047.db2.gz	FNBYPSQDCVADFO-UHFFFAOYSA-N	0	3	336.838	3.123	20	30		EGEDHN
C[C@H](NC1CC(CNC(=O)C#CC(C)(C)C)C1)c1ccccc1F	ZINC001100318626	1364079377	/nfs/dbraw/zinc/07/93/77/1364079377.db2.gz	WPGHOIUAUPQGKF-FHERZECASA-N	0	3	330.447	3.421	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)[C@@H](C)C(C)(C)C)C1	ZINC001100448576	1364118691	/nfs/dbraw/zinc/11/86/91/1364118691.db2.gz	YPYXHEUESFTHQB-PNESKVBLSA-N	0	3	331.298	3.062	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)Cn2c(C)cc3ccccc32)C1	ZINC001100488408	1364132099	/nfs/dbraw/zinc/13/20/99/1364132099.db2.gz	IJGQZOSYDWRXGH-UHFFFAOYSA-N	0	3	345.874	3.187	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)Cc2ccc(C(F)F)cc2)C1	ZINC001100503486	1364138268	/nfs/dbraw/zinc/13/82/68/1364138268.db2.gz	DOHAJMQCDFMZKU-UHFFFAOYSA-N	0	3	342.817	3.404	20	30		EGEDHN
CCCC1(C(=O)NCC2CC(NCc3cc(C#N)ccc3F)C2)CC1	ZINC001100654158	1364206196	/nfs/dbraw/zinc/20/61/96/1364206196.db2.gz	PPRDOASMNKVGKD-UHFFFAOYSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100711586	1364230852	/nfs/dbraw/zinc/23/08/52/1364230852.db2.gz	WXEUFAXWPKNONS-UHFFFAOYSA-N	0	3	342.458	3.264	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1	ZINC001100711428	1364230940	/nfs/dbraw/zinc/23/09/40/1364230940.db2.gz	PABKNSNOOFXMCS-UHFFFAOYSA-N	0	3	343.446	3.284	20	30		EGEDHN
C=C[C@@H](C(=O)NCC1CC(NCc2ncccc2C)C1)c1ccccc1	ZINC001101016741	1364375526	/nfs/dbraw/zinc/37/55/26/1364375526.db2.gz	CRAQXHWKPJIVRB-LYBXBRPPSA-N	0	3	349.478	3.344	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@H](C)c2cccc(OC)c2)C1	ZINC001101037483	1364383600	/nfs/dbraw/zinc/38/36/00/1364383600.db2.gz	OQPBLGMKVFXZIS-VQCLRJIVSA-N	0	3	336.863	3.036	20	30		EGEDHN
C=CCC1(C(=O)NCC2CC(N[C@H](C)c3cnccn3)C2)CCCC1	ZINC001101080406	1364403800	/nfs/dbraw/zinc/40/38/00/1364403800.db2.gz	NXMLNLWFBWXGDS-KLAILNCOSA-N	0	3	342.487	3.159	20	30		EGEDHN
C=CCN1CC[C@H](Oc2ccnc(CNC(=O)CC(C)(C)CC)c2)C1	ZINC001101094175	1364410757	/nfs/dbraw/zinc/41/07/57/1364410757.db2.gz	RMWBCXHAXGREPD-SFHVURJKSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=CCN1CC[C@H](Oc2ccnc(CNC(=O)CC(CC)CC)c2)C1	ZINC001101096925	1364412199	/nfs/dbraw/zinc/41/21/99/1364412199.db2.gz	FSKJKTUKYVADBC-IBGZPJMESA-N	0	3	345.487	3.163	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@H]2CN([C@@H](C)c3ccc(F)cc3)C[C@@]2(C)C1	ZINC001101230736	1364476630	/nfs/dbraw/zinc/47/66/30/1364476630.db2.gz	HOWUQYKLCYSJGA-CDXJDZJCSA-N	0	3	342.458	3.326	20	30		EGEDHN
CC[C@H](C)CCCCC(=O)N1C[C@H]2CN(CC#CCOC)C[C@@]2(C)C1	ZINC001101249719	1364485607	/nfs/dbraw/zinc/48/56/07/1364485607.db2.gz	JRZNDUDHOMOQGW-ZVDOUQERSA-N	0	3	348.531	3.023	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)CCCc3ccccc3Cl)C[C@]2(C)C1	ZINC001101260656	1364489985	/nfs/dbraw/zinc/48/99/85/1364489985.db2.gz	GUZKLOFPNFHQAT-XLIONFOSSA-N	0	3	344.886	3.076	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@@]2(C)C1	ZINC001101327771	1364509959	/nfs/dbraw/zinc/50/99/59/1364509959.db2.gz	AYABGDXXQHGQQY-WZQNQVHYSA-N	0	3	349.478	3.361	20	30		EGEDHN
CCCCC[C@@H](C)CC(=O)N1C[C@H]2CN(CC#CCOC)C[C@@]2(C)C1	ZINC001101384593	1364539866	/nfs/dbraw/zinc/53/98/66/1364539866.db2.gz	KTVFYWCNDZIJKW-SBHAEUEKSA-N	0	3	348.531	3.023	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)CCCc3ccc(C)s3)C[C@]2(C)C1	ZINC001101494979	1364580869	/nfs/dbraw/zinc/58/08/69/1364580869.db2.gz	PEMOWFWCPGRSRK-XLIONFOSSA-N	0	3	344.524	3.183	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)N1CCC(C(C)(C)CNCc2ccon2)CC1	ZINC001101564791	1364621651	/nfs/dbraw/zinc/62/16/51/1364621651.db2.gz	GCZSODLEGPKGQP-HZPDHXFCSA-N	0	3	347.503	3.487	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1CNC(=O)/C=C\C(C)(C)C	ZINC001101824882	1364739780	/nfs/dbraw/zinc/73/97/80/1364739780.db2.gz	HRRGVRHKXPGTTA-QWKSHVCESA-N	0	3	338.495	3.325	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1CNC(=O)/C=C/C(C)(C)C	ZINC001101824881	1364740030	/nfs/dbraw/zinc/74/00/30/1364740030.db2.gz	HRRGVRHKXPGTTA-HOGDGFLFSA-N	0	3	338.495	3.325	20	30		EGEDHN
CCC[C@@H](C)C(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C	ZINC001101829261	1364742916	/nfs/dbraw/zinc/74/29/16/1364742916.db2.gz	VEQLVULTCUJRBM-QWFCFKBJSA-N	0	3	326.484	3.158	20	30		EGEDHN
CC/C(C)=C/C(=O)NC[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1C	ZINC001101943424	1364784341	/nfs/dbraw/zinc/78/43/41/1364784341.db2.gz	UFKDHUHBJJUSQL-SMODISSLSA-N	0	3	343.446	3.238	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@@H]1CN(Cc2c(C)noc2CC)C[C@H]1C	ZINC001102327247	1365003327	/nfs/dbraw/zinc/00/33/27/1365003327.db2.gz	IZPNUALKPNHHBV-KKVAFCGZSA-N	0	3	347.503	3.332	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](NCc3ccc(OC)c(F)c3)C2)CCC1	ZINC001185463310	1387721964	/nfs/dbraw/zinc/72/19/64/1387721964.db2.gz	OVYFHNBDOOTYJL-MRXNPFEDSA-N	0	3	346.446	3.271	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](NCc3ccc(Cl)nc3)C2)CCC1	ZINC001185462855	1387722013	/nfs/dbraw/zinc/72/20/13/1387722013.db2.gz	CKQURHKCRGRQRI-OAHLLOKOSA-N	0	3	333.863	3.172	20	30		EGEDHN
CC(C)CC(=O)NCC[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1C	ZINC001102642599	1365149854	/nfs/dbraw/zinc/14/98/54/1365149854.db2.gz	IDZNFOHDVGJXAB-SJLPKXTDSA-N	0	3	327.472	3.179	20	30		EGEDHN
C=CCCC(=O)NCC[C@@H]1CN(Cc2ccnc(Cl)c2)C[C@H]1C	ZINC001102760341	1365206484	/nfs/dbraw/zinc/20/64/84/1365206484.db2.gz	QIHZMSNVQXJBTF-GDBMZVCRSA-N	0	3	335.879	3.275	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](NCc3cnn(C(C)(C)C)c3)C2)CC1	ZINC001185486976	1387728689	/nfs/dbraw/zinc/72/86/89/1387728689.db2.gz	NQDZJBXSDUPOFE-QGZVFWFLSA-N	0	3	344.503	3.075	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCC[C@@H]1CN(Cc2cc(C)no2)C[C@H]1C	ZINC001103346084	1365511235	/nfs/dbraw/zinc/51/12/35/1365511235.db2.gz	CVOYUBUARCWLFI-HYVNUMGLSA-N	0	3	333.476	3.160	20	30		EGEDHN
CC/C(C)=C\C(=O)N1C[C@@H](C)[C@H](CCNCc2ccccc2C#N)C1	ZINC001104160533	1365931130	/nfs/dbraw/zinc/93/11/30/1365931130.db2.gz	XHNMTZZXOOMRJQ-ZCMYTDSZSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)[C@H](CCNCc2oc(CC)nc2C)C1	ZINC001104247130	1365968052	/nfs/dbraw/zinc/96/80/52/1365968052.db2.gz	YLJQLXMYCOVXNM-NVXWUHKLSA-N	0	3	347.503	3.476	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)[C@H]2CCC(F)(F)C2)C[C@H]1C	ZINC001104271719	1365973636	/nfs/dbraw/zinc/97/36/36/1365973636.db2.gz	DDVCPDNFESCWFU-KWCYVHTRSA-N	0	3	334.838	3.249	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H](C)[C@H](CCNCc2ccc(F)cn2)C1	ZINC001104563600	1366078357	/nfs/dbraw/zinc/07/83/57/1366078357.db2.gz	OKIJYIVDMPKAMT-BRWVUGGUSA-N	0	3	347.478	3.397	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H](C)[C@H](CCNCc2cnc(C)o2)C1	ZINC001104631382	1366110276	/nfs/dbraw/zinc/11/02/76/1366110276.db2.gz	KSSAGQPHKIYHIT-OGWOLHLISA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](C)[C@H](CCNCc3oc(C)nc3C)C2)C1	ZINC001104652563	1366118906	/nfs/dbraw/zinc/11/89/06/1366118906.db2.gz	MRCPELMOBGKFLR-RHSMWYFYSA-N	0	3	345.487	3.222	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CN(C(=O)[C@@H](C)C(C)C)C[C@H]1C	ZINC001104748582	1366156406	/nfs/dbraw/zinc/15/64/06/1366156406.db2.gz	VJJGPQIBRXGDGI-VHDGCEQUSA-N	0	3	345.325	3.261	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CN(C(=O)[C@H](C)C(C)C)C[C@H]1C	ZINC001104748581	1366156187	/nfs/dbraw/zinc/15/61/87/1366156187.db2.gz	VJJGPQIBRXGDGI-BPLDGKMQSA-N	0	3	345.325	3.261	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cc3c([nH]2)CCCC3)C[C@H]1C	ZINC001104878175	1366207775	/nfs/dbraw/zinc/20/77/75/1366207775.db2.gz	BJVLLFPESNXFIG-CZUORRHYSA-N	0	3	349.906	3.334	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)CCC2(C)CC2)CC1	ZINC001105396627	1366445206	/nfs/dbraw/zinc/44/52/06/1366445206.db2.gz	QORVOXXJESGPER-LJQANCHMSA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](CNCc2csc(CCC)n2)[C@H](C)C1	ZINC001106068943	1366609395	/nfs/dbraw/zinc/60/93/95/1366609395.db2.gz	SEKIMUXTRPHSBC-HZPDHXFCSA-N	0	3	347.528	3.083	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@@H](CNCc2csc(C)n2)[C@H](C)C1	ZINC001106562660	1366736831	/nfs/dbraw/zinc/73/68/31/1366736831.db2.gz	DALQPRFWDIPDDR-VNQPRFMTSA-N	0	3	335.517	3.238	20	30		EGEDHN
C[C@H](C#N)C(=O)NC[C@]12CCC[C@H]1N(Cc1cccc(Cl)c1)CC2	ZINC001107336256	1366931903	/nfs/dbraw/zinc/93/19/03/1366931903.db2.gz	JLARBQGCUYJMMW-LSBZLQRGSA-N	0	3	345.874	3.360	20	30		EGEDHN
C#CCCCCC(=O)NC[C@]12CCC[C@H]1N(Cc1cnc(C)o1)CC2	ZINC001107372849	1366945529	/nfs/dbraw/zinc/94/55/29/1366945529.db2.gz	SXTJUBDVXVUVPL-UYAOXDASSA-N	0	3	343.471	3.037	20	30		EGEDHN
CC#CCCCC(=O)NC[C@]12CCC[C@H]1N(Cc1cnoc1C)CC2	ZINC001107513242	1367012274	/nfs/dbraw/zinc/01/22/74/1367012274.db2.gz	WNOAYRQBLSVJPV-UYAOXDASSA-N	0	3	343.471	3.037	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCc1ccc(Cl)cc1	ZINC001109248787	1367025244	/nfs/dbraw/zinc/02/52/44/1367025244.db2.gz	VVYOGRQRBPFROC-QYZOEREBSA-N	0	3	344.886	3.263	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@]23CCC[C@H]2N(Cc2cnc(C)o2)CC3)C1	ZINC001107543568	1367035108	/nfs/dbraw/zinc/03/51/08/1367035108.db2.gz	MRXYJLILQJPYQR-YLJYHZDGSA-N	0	3	343.471	3.200	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCOC1CCC1	ZINC001109329410	1367056412	/nfs/dbraw/zinc/05/64/12/1367056412.db2.gz	WCNCNLMMNHCSDJ-NEWSRXKRSA-N	0	3	332.488	3.045	20	30		EGEDHN
CC[C@H](CC(C)C)C(=O)NC[C@]12CCC[C@H]1N(CC#CCOC)CC2	ZINC001107601051	1367066542	/nfs/dbraw/zinc/06/65/42/1367066542.db2.gz	KOKGAJIDOVKIQT-SFHLNBCPSA-N	0	3	348.531	3.069	20	30		EGEDHN
CC[C@@H](C)CC(=O)N1CC[C@@H](N(C)Cc2ccc(OCC#N)cc2)C1	ZINC001189855633	1367119658	/nfs/dbraw/zinc/11/96/58/1367119658.db2.gz	BBPMLCWUOLPXJR-SJLPKXTDSA-N	0	3	343.471	3.058	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)C(F)=C2CCCC2)C1	ZINC001107868629	1367185363	/nfs/dbraw/zinc/18/53/63/1367185363.db2.gz	VFMITVVJWLLLJM-HNAYVOBHSA-N	0	3	338.467	3.346	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2c(C)coc2C)C1	ZINC001107914887	1367200599	/nfs/dbraw/zinc/20/05/99/1367200599.db2.gz	SZMFEBDGWVASPQ-BEFAXECRSA-N	0	3	334.460	3.072	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)[C@H](CC)CCCCC)[C@@H]2C1	ZINC001190290621	1367218884	/nfs/dbraw/zinc/21/88/84/1367218884.db2.gz	OJJFMAZTXITVPV-CEXWTWQISA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC[C@]1(C)CN(CC(CC)CC)CCO1	ZINC001107967262	1367221699	/nfs/dbraw/zinc/22/16/99/1367221699.db2.gz	QLBDCUFJWYFPOY-HXUWFJFHSA-N	0	3	336.520	3.398	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NC[C@]1(C)CN(C[C@@H](C)CC)CCO1	ZINC001107971459	1367224452	/nfs/dbraw/zinc/22/44/52/1367224452.db2.gz	SPIHSDVXIGLWIQ-SUMWQHHRSA-N	0	3	330.900	3.018	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](N(C)CCOc2ccccc2)C1	ZINC001190387437	1367247768	/nfs/dbraw/zinc/24/77/68/1367247768.db2.gz	DLTYBWKKGSQJPX-QGZVFWFLSA-N	0	3	330.472	3.200	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCOCCC(C)C	ZINC001109634204	1367252855	/nfs/dbraw/zinc/25/28/55/1367252855.db2.gz	GGAYIIZVVVNFDB-YRXWBPOGSA-N	0	3	336.520	3.373	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](N(C)C[C@@H](OC)c2ccccc2)C1	ZINC001190428687	1367263295	/nfs/dbraw/zinc/26/32/95/1367263295.db2.gz	NNJHEBJFJVJJHM-RBUKOAKNSA-N	0	3	330.472	3.263	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CC[C@@H](N(C)Cc2cccc(F)c2)C1)OCC	ZINC001190443141	1367266887	/nfs/dbraw/zinc/26/68/87/1367266887.db2.gz	FGYPMIKVQUEXFG-MOPGFXCFSA-N	0	3	348.462	3.230	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3CC/C=C\CCC)c1	ZINC001109697054	1367285749	/nfs/dbraw/zinc/28/57/49/1367285749.db2.gz	SXQHJKUFOWFDHV-HPMXEOQNSA-N	0	3	337.467	3.144	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@]1(C)CN(C[C@H](C)CC(C)C)CCO1	ZINC001108114521	1367288141	/nfs/dbraw/zinc/28/81/41/1367288141.db2.gz	FYARAGFPRAYLGY-XLIONFOSSA-N	0	3	338.536	3.478	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)C2(CCC=C)CC2)C1	ZINC001108185864	1367328313	/nfs/dbraw/zinc/32/83/13/1367328313.db2.gz	GPPFKJJAEXTTFI-IEBWSBKVSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@]1(C)CN(CC2CCCCC2)CCO1	ZINC001108246525	1367360393	/nfs/dbraw/zinc/36/03/93/1367360393.db2.gz	PCRWKKRRRBHRRH-HXUWFJFHSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2ccc(F)cc2C)C1	ZINC001108353461	1367406507	/nfs/dbraw/zinc/40/65/07/1367406507.db2.gz	IQZVRVGWYNNCTD-UZLBHIALSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)C(C)(C)C(C)(F)F)C1	ZINC001108369230	1367417980	/nfs/dbraw/zinc/41/79/80/1367417980.db2.gz	NBHOJPAQYJCDBI-RHSMWYFYSA-N	0	3	346.462	3.230	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCCOc1ccccc1F)C2	ZINC001110141578	1367523720	/nfs/dbraw/zinc/52/37/20/1367523720.db2.gz	GCJKMAILDCBQTP-NJAFHUGGSA-N	0	3	346.446	3.282	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N1CC[C@H](N(C)Cc2ccc(F)cc2)C1	ZINC001191577857	1367533349	/nfs/dbraw/zinc/53/33/49/1367533349.db2.gz	XFLKKSPBPVMFPA-ICSRJNTNSA-N	0	3	348.462	3.087	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](N(C)CCOc2cc(C)ccc2C)C1	ZINC001191727077	1367571797	/nfs/dbraw/zinc/57/17/97/1367571797.db2.gz	FRLBDIOXFHSSDV-GOSISDBHSA-N	0	3	344.499	3.427	20	30		EGEDHN
C=CCN1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)C(C)(F)F)C1	ZINC001186156286	1387884835	/nfs/dbraw/zinc/88/48/35/1387884835.db2.gz	MTOJZLSTUDNDGK-GDBMZVCRSA-N	0	3	340.389	3.189	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H](N(C)Cc2ccc(OC)cc2)C1	ZINC001191867632	1367618935	/nfs/dbraw/zinc/61/89/35/1367618935.db2.gz	GAFQUVGHFHOMES-AEFFLSMTSA-N	0	3	330.472	3.330	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](N(C)Cc2cccc(COC)c2)C1	ZINC001191867837	1367620533	/nfs/dbraw/zinc/62/05/33/1367620533.db2.gz	JMXMYZAOYFPFLX-PXNSSMCTSA-N	0	3	344.499	3.468	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCOC1CCCCCC1	ZINC001110378658	1367679489	/nfs/dbraw/zinc/67/94/89/1367679489.db2.gz	ARSPFVKBKIJNOM-QRQLOZEOSA-N	0	3	334.504	3.414	20	30		EGEDHN
C#CCCCC(=O)NC[C@@H]1CN(CC=C)CC[C@@H]1c1ccc(F)cc1	ZINC001186190179	1387894007	/nfs/dbraw/zinc/89/40/07/1387894007.db2.gz	WVSFJKOSHBJEFX-UYAOXDASSA-N	0	3	342.458	3.337	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](N(C)Cc3ccc(OC)cc3)C2)CCC1	ZINC001192217874	1367720964	/nfs/dbraw/zinc/72/09/64/1367720964.db2.gz	LGQOPINWQYVMGQ-GOSISDBHSA-N	0	3	342.483	3.474	20	30		EGEDHN
Cc1cc(C)c(CN2[C@@H]3CC[C@H]2[C@H](NC(=O)C#CC2CC2)C3)c(C)c1	ZINC001110531954	1367813148	/nfs/dbraw/zinc/81/31/48/1367813148.db2.gz	TYZZDAFJZJWREK-NRSPTQNISA-N	0	3	336.479	3.247	20	30		EGEDHN
O=C(C#CC1CC1)N[C@@H]1C[C@H]2CC[C@@H]1N2CC/C=C/c1ccccc1	ZINC001110540311	1367819543	/nfs/dbraw/zinc/81/95/43/1367819543.db2.gz	MSZNRUUYBHACQM-VYTOFGJYSA-N	0	3	334.463	3.225	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)[C@H](CC)CC2CCCC2)C1	ZINC001192657701	1367843393	/nfs/dbraw/zinc/84/33/93/1367843393.db2.gz	ZHBNQWYTTCEZHV-RTBURBONSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)C[C@H](CC)c2ccccc2)C1	ZINC001193434242	1368030241	/nfs/dbraw/zinc/03/02/41/1368030241.db2.gz	XUOCZPPLLSROCS-ICSRJNTNSA-N	0	3	344.499	3.306	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2cccc(C3CCC3)c2)C1	ZINC001193461723	1368035514	/nfs/dbraw/zinc/03/55/14/1368035514.db2.gz	JGGTXLBXEMMJSC-HXUWFJFHSA-N	0	3	342.483	3.303	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2C[C@@H]1CC(C)(C)CO1	ZINC001110891906	1368066392	/nfs/dbraw/zinc/06/63/92/1368066392.db2.gz	FEROCKQTNGTGPY-TWMKSMIVSA-N	0	3	334.504	3.125	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@H](C)c1cccc(F)c1)C2	ZINC001111010176	1368142666	/nfs/dbraw/zinc/14/26/66/1368142666.db2.gz	XENNWHRFZZGVMH-PIKADFDJSA-N	0	3	328.431	3.064	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C1[C@H]3CCCCCC[C@H]13)C2	ZINC001111061726	1368150611	/nfs/dbraw/zinc/15/06/11/1368150611.db2.gz	JJLBFTHWHVNGRV-SPOLIRPYSA-N	0	3	346.515	3.127	20	30		EGEDHN
C=CCCCN1C[C@@H](O)[C@H](NC(=O)c2ccccc2C(C)(C)CC)C1	ZINC001193988504	1368161072	/nfs/dbraw/zinc/16/10/72/1368161072.db2.gz	OSOXQLSVXIZFBX-RTBURBONSA-N	0	3	344.499	3.115	20	30		EGEDHN
C=CCCCN1C[C@@H](O)[C@H](NC(=O)c2ccc(C(C)(C)CC)cc2)C1	ZINC001193986402	1368161437	/nfs/dbraw/zinc/16/14/37/1368161437.db2.gz	AUWDILADPVMHOK-RTBURBONSA-N	0	3	344.499	3.115	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1oc(CC(C)C)nc1C)C2	ZINC001111120855	1368162344	/nfs/dbraw/zinc/16/23/44/1368162344.db2.gz	DVYVTDNAMDCTBI-ZACQAIPSSA-N	0	3	345.487	3.483	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)COc1ccccc1C(C)C)C2	ZINC001111369653	1368273422	/nfs/dbraw/zinc/27/34/22/1368273422.db2.gz	JQLUNMITFJSSKI-QRQLOZEOSA-N	0	3	342.483	3.486	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](N(C)CCOCC(C)C)C2)CCCC1	ZINC001194554530	1368284669	/nfs/dbraw/zinc/28/46/69/1368284669.db2.gz	BCGMKDXFKAOIEX-GOSISDBHSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCc1ccc(CC)cc1)C2	ZINC001111394093	1368289786	/nfs/dbraw/zinc/28/97/86/1368289786.db2.gz	LCBTXRJVOZYYQV-AQNXPRMDSA-N	0	3	326.484	3.479	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)COc1ccccc1Cl)C2	ZINC001111397808	1368293882	/nfs/dbraw/zinc/29/38/82/1368293882.db2.gz	OOYOUHWWRFZDEK-BMFZPTHFSA-N	0	3	334.847	3.016	20	30		EGEDHN
CCCCCCCCOC(=O)NCCN1CCN(C(C)C)CC1	ZINC001194752695	1368316485	/nfs/dbraw/zinc/31/64/85/1368316485.db2.gz	PTKYLWJESBQHOU-UHFFFAOYSA-N	0	3	327.513	3.099	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2[C@H](C)c1ccccc1	ZINC001111487577	1368318381	/nfs/dbraw/zinc/31/83/81/1368318381.db2.gz	VXBKGJXVPOYIRF-OWYHZJEWSA-N	0	3	328.456	3.062	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3C[C@H](CC)OC)CCCC1	ZINC001111522937	1368324808	/nfs/dbraw/zinc/32/48/08/1368324808.db2.gz	NCHFUYCVIRRCMO-XDNAFOTISA-N	0	3	334.504	3.269	20	30		EGEDHN
C=CCCC(=O)N1CCCN(CCCOc2ccccc2C)CC1	ZINC001195181719	1368396176	/nfs/dbraw/zinc/39/61/76/1368396176.db2.gz	FKKKFZSUWKCTQP-UHFFFAOYSA-N	0	3	330.472	3.264	20	30		EGEDHN
C=CCCC(=O)N1CCCN(CCCOCc2ccccc2)CC1	ZINC001195226264	1368404158	/nfs/dbraw/zinc/40/41/58/1368404158.db2.gz	PGAUXQTVBAESRT-UHFFFAOYSA-N	0	3	330.472	3.094	20	30		EGEDHN
CC[C@@H](C)CC(=O)N[C@]12CCC[C@H]1CN(Cc1cccc(C#N)c1)C2	ZINC001111727695	1368430827	/nfs/dbraw/zinc/43/08/27/1368430827.db2.gz	IOAWULUQHHUTBX-PBEJRMEISA-N	0	3	339.483	3.465	20	30		EGEDHN
Cc1ccccc1CCCN1CCCN(C(=O)C#CC(C)C)CC1	ZINC001195754407	1368482303	/nfs/dbraw/zinc/48/23/03/1368482303.db2.gz	MWJHDSUDZRCXQL-UHFFFAOYSA-N	0	3	326.484	3.121	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@]12CCC[C@H]1CN(Cc1cncc(C)c1)C2	ZINC001111848285	1368501896	/nfs/dbraw/zinc/50/18/96/1368501896.db2.gz	AIRGTUCAGWEHOY-CUWPLCDZSA-N	0	3	341.499	3.463	20	30		EGEDHN
C=CCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1scnc1C)C2	ZINC001111858934	1368509373	/nfs/dbraw/zinc/50/93/73/1368509373.db2.gz	GHSRHDSFHITESN-YJBOKZPZSA-N	0	3	333.501	3.279	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cc(C3CC3)n(C)n2)CC1	ZINC001196073360	1368544109	/nfs/dbraw/zinc/54/41/09/1368544109.db2.gz	SFSVYKHSUHCVBH-UHFFFAOYSA-N	0	3	346.519	3.416	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)C(C)(C)n2cnc(C)c2)CC1	ZINC001196268574	1368580088	/nfs/dbraw/zinc/58/00/88/1368580088.db2.gz	IIEDEEDPPBIQMS-UHFFFAOYSA-N	0	3	348.535	3.431	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)C[C@H](C)CC(C)(C)C)C1	ZINC001196392979	1368605587	/nfs/dbraw/zinc/60/55/87/1368605587.db2.gz	VXHMLCUBZIDCCX-RCCFBDPRSA-N	0	3	338.536	3.357	20	30		EGEDHN
C#CC[C@@H](CC(=O)N[C@]12CCC[C@H]1CN(CC#CC)C2)c1ccccc1	ZINC001112027013	1368625378	/nfs/dbraw/zinc/62/53/78/1368625378.db2.gz	QPEWDFQUHSINBD-FUDKSRODSA-N	0	3	348.490	3.178	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2ccn3ccnc3c2)CC1	ZINC001196493059	1368626782	/nfs/dbraw/zinc/62/67/82/1368626782.db2.gz	ODUACLJCDADIHL-UHFFFAOYSA-N	0	3	342.487	3.453	20	30		EGEDHN
C=C(C)CCN1C[C@@H](O)[C@H](NC(=O)[C@@H](CC)CC2CCCCC2)C1	ZINC001196608744	1368648372	/nfs/dbraw/zinc/64/83/72/1368648372.db2.gz	MHAOFSQOGRMQHA-IPMKNSEASA-N	0	3	336.520	3.111	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCCN(CCc2ccc(OC)cc2)CC1	ZINC001196895855	1368708908	/nfs/dbraw/zinc/70/89/08/1368708908.db2.gz	RYHCJELDDKVMGL-GOSISDBHSA-N	0	3	344.499	3.374	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2occc2CN(C)C)CC1	ZINC001196934277	1368715718	/nfs/dbraw/zinc/71/57/18/1368715718.db2.gz	CMKAWJJEQFZBQJ-UHFFFAOYSA-N	0	3	347.503	3.236	20	30		EGEDHN
C=CCCCC(=O)N1CCCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC001197000723	1368730142	/nfs/dbraw/zinc/73/01/42/1368730142.db2.gz	YFGFZNLNIIVKNV-UYAOXDASSA-N	0	3	344.499	3.042	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@@H]2CCC[C@]2(CNCc2nccs2)C1	ZINC001112313937	1368760310	/nfs/dbraw/zinc/76/03/10/1368760310.db2.gz	WXEQQCWPPXENRY-LPHOPBHVSA-N	0	3	345.512	3.055	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N1CCCN([C@H](CC)c2ccccc2)CC1	ZINC001198343014	1369012277	/nfs/dbraw/zinc/01/22/77/1369012277.db2.gz	FBVAQBWHSFBRTC-PKOBYXMFSA-N	0	3	330.472	3.263	20	30		EGEDHN
C=CCC[C@@H](C)N[C@@H](CNC(=O)C(F)F)c1ccccc1OC	ZINC001198472323	1369040387	/nfs/dbraw/zinc/04/03/87/1369040387.db2.gz	OYKYNKKOQOAKPM-OCCSQVGLSA-N	0	3	326.387	3.062	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)CCSC)c1ccccc1OC	ZINC001198515087	1369050181	/nfs/dbraw/zinc/05/01/81/1369050181.db2.gz	KDBAVYBNRKBYMM-MRXNPFEDSA-N	0	3	336.501	3.161	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)[C@H](C)SC)c1ccccc1OC	ZINC001198551627	1369059015	/nfs/dbraw/zinc/05/90/15/1369059015.db2.gz	AMKXLFHPDWAIPR-GOEBONIOSA-N	0	3	336.501	3.160	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)[C@H](C)SC)c1ccccc1OC	ZINC001198555410	1369060361	/nfs/dbraw/zinc/06/03/61/1369060361.db2.gz	UQLCTSFTECNKRI-HOCLYGCPSA-N	0	3	336.501	3.160	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)C(=O)C(C)(C)C)c1ccccc1OC	ZINC001198617130	1369074784	/nfs/dbraw/zinc/07/47/84/1369074784.db2.gz	MOXSKWBAXNBYIW-INIZCTEOSA-N	0	3	346.471	3.024	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)c1csnc1C)c1ccccc1OC	ZINC001198667739	1369085951	/nfs/dbraw/zinc/08/59/51/1369085951.db2.gz	LCIVNMRUUUKDIC-MRXNPFEDSA-N	0	3	345.468	3.097	20	30		EGEDHN
C#CCCCCC(=O)NC[C@H](NCCCC)c1ccccc1OC	ZINC001198677524	1369088557	/nfs/dbraw/zinc/08/85/57/1369088557.db2.gz	NYLFZPMGZLNVOD-SFHVURJKSA-N	0	3	330.472	3.436	20	30		EGEDHN
C#CCCCC(=O)NC[C@H](NCCC(C)C)c1ccccc1OC	ZINC001198693369	1369092128	/nfs/dbraw/zinc/09/21/28/1369092128.db2.gz	ACLYBKCPKNQCEQ-SFHVURJKSA-N	0	3	330.472	3.292	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)[C@H]1CC1(F)F)c1ccccc1OC	ZINC001198712982	1369096810	/nfs/dbraw/zinc/09/68/10/1369096810.db2.gz	JLVWJZHBUUYRGD-HUUCEWRRSA-N	0	3	338.398	3.064	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)C1C=CC=CC=C1)c1ccccc1OC	ZINC001198752783	1369105397	/nfs/dbraw/zinc/10/53/97/1369105397.db2.gz	VGBCNMJLPVSFTH-IBGZPJMESA-N	0	3	338.451	3.317	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)C(C)(C)COC)c1ccccc1OC	ZINC001198798026	1369117450	/nfs/dbraw/zinc/11/74/50/1369117450.db2.gz	YYRTZSUBHMCKEZ-KRWDZBQOSA-N	0	3	348.487	3.081	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H](NC(C)C)c2ccccc2OC)cc1	ZINC001198825525	1369122346	/nfs/dbraw/zinc/12/23/46/1369122346.db2.gz	CNLZIPIYEAHAGK-LJQANCHMSA-N	0	3	336.435	3.146	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@@H](C)C(F)(F)F)c1ccccc1OC	ZINC001198834782	1369125525	/nfs/dbraw/zinc/12/55/25/1369125525.db2.gz	NYGDAQNKVKXVFB-TZMCWYRMSA-N	0	3	344.377	3.217	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@H](C)C(F)(F)F)c1ccccc1OC	ZINC001198834780	1369125622	/nfs/dbraw/zinc/12/56/22/1369125622.db2.gz	NYGDAQNKVKXVFB-JSGCOSHPSA-N	0	3	344.377	3.217	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H](NCC[C@H](C)F)c1ccccc1OC	ZINC001198835049	1369125714	/nfs/dbraw/zinc/12/57/14/1369125714.db2.gz	QVBWEFYYBWYSPH-GOEBONIOSA-N	0	3	336.451	3.402	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)[C@H]1C[C@H]2C[C@H]2C1)c1ccccc1OC	ZINC001198856892	1369130396	/nfs/dbraw/zinc/13/03/96/1369130396.db2.gz	LJQDTLZDHIUQBW-FAJBIJEISA-N	0	3	342.483	3.454	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)C23CCC(CC2)CC3)C1	ZINC001198879009	1369138035	/nfs/dbraw/zinc/13/80/35/1369138035.db2.gz	AXWOYBIKLASBBJ-SFANZJOMSA-N	0	3	336.520	3.089	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@H](C)C(C)(F)F)c1ccccc1OC	ZINC001198902195	1369144054	/nfs/dbraw/zinc/14/40/54/1369144054.db2.gz	HSASJVXEPHGCSV-DZGCQCFKSA-N	0	3	340.414	3.310	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@@H](NCC1CC1)c1ccccc1OC	ZINC001198915801	1369147790	/nfs/dbraw/zinc/14/77/90/1369147790.db2.gz	BEUROQKWRWFKAW-QGZVFWFLSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)[C@H]1CC12CC2)c1ccccc1OC	ZINC001198916735	1369148454	/nfs/dbraw/zinc/14/84/54/1369148454.db2.gz	SJGBXOMYKNIIRZ-IAGOWNOFSA-N	0	3	328.456	3.208	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)[C@@H]1C[C@H]1C1CC1)c1ccccc1OC	ZINC001198933228	1369152444	/nfs/dbraw/zinc/15/24/44/1369152444.db2.gz	ZYDKBYMNKWNVAR-OTWHNJEPSA-N	0	3	342.483	3.454	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)Cc1ccco1)c1ccccc1OC	ZINC001198938662	1369152604	/nfs/dbraw/zinc/15/26/04/1369152604.db2.gz	CSHHVORZMJUPQS-SFHVURJKSA-N	0	3	342.439	3.244	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)[C@@H]1C[C@H]1C1CC1)c1ccccc1OC	ZINC001198933226	1369152722	/nfs/dbraw/zinc/15/27/22/1369152722.db2.gz	ZYDKBYMNKWNVAR-IPMKNSEASA-N	0	3	342.483	3.454	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)c2cn(C)c3ccccc23)CC1	ZINC001113076103	1369183986	/nfs/dbraw/zinc/18/39/86/1369183986.db2.gz	PXYFRKUIWZYBJY-INIZCTEOSA-N	0	3	325.456	3.291	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)c2cccc(C3CC3)c2)C1	ZINC001199191257	1369188957	/nfs/dbraw/zinc/18/89/57/1369188957.db2.gz	CABMQLSKMQAQCO-WOJBJXKFSA-N	0	3	344.499	3.309	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)CCc2ccc(OC)c(F)c2)CC1	ZINC001113095479	1369198866	/nfs/dbraw/zinc/19/88/66/1369198866.db2.gz	LXMICAPNENJWLR-INIZCTEOSA-N	0	3	348.462	3.266	20	30		EGEDHN
C=C(Br)CNC1CCN(C(=O)C[C@@H](C)CCC)CC1	ZINC001199690342	1369254874	/nfs/dbraw/zinc/25/48/74/1369254874.db2.gz	JEGXYBSLOJLBHG-LBPRGKRZSA-N	0	3	331.298	3.302	20	30		EGEDHN
CC#CCCCC(=O)N1CCN(C[C@@H]2CCc3ccccc3C2)CC1	ZINC001113226023	1369275610	/nfs/dbraw/zinc/27/56/10/1369275610.db2.gz	HCGYGWHAVOAHPP-LJQANCHMSA-N	0	3	338.495	3.129	20	30		EGEDHN
CC(C)(C)/C=C/C(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001199848447	1369280640	/nfs/dbraw/zinc/28/06/40/1369280640.db2.gz	ZEXIGIMZGHLEAG-DHZHZOJOSA-N	0	3	325.456	3.241	20	30		EGEDHN
C#CCCCC(=O)N1CCC(NCc2cc(F)ccc2Cl)CC1	ZINC001200317340	1369347097	/nfs/dbraw/zinc/34/70/97/1369347097.db2.gz	QVKGNURKPYBHJU-UHFFFAOYSA-N	0	3	336.838	3.363	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCCO[C@H](CNCc2ccccc2F)C1	ZINC001200598529	1369398383	/nfs/dbraw/zinc/39/83/83/1369398383.db2.gz	QLLABAAMZLNOFP-QGZVFWFLSA-N	0	3	348.462	3.135	20	30		EGEDHN
C=CCCCCCN1CCN(C(=O)CN(C)CCCCCC)CC1	ZINC001113439591	1369430099	/nfs/dbraw/zinc/43/00/99/1369430099.db2.gz	JTWGCZQIHXUMDC-UHFFFAOYSA-N	0	3	337.552	3.389	20	30		EGEDHN
CSc1ccc(NC(=S)N2CCC3SC(=O)C=C3C2)cc1	ZINC001201180710	1369491404	/nfs/dbraw/zinc/49/14/04/1369491404.db2.gz	WANVRQWHOCIYEA-ZDUSSCGKSA-N	0	3	336.507	3.379	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCCO[C@@H](CNCc2ccsc2)C1	ZINC001201233181	1369501615	/nfs/dbraw/zinc/50/16/15/1369501615.db2.gz	LZUQMOLHBNFUND-RDJZCZTQSA-N	0	3	336.501	3.058	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)Cc2ccc(OCC)cc2)CC1	ZINC001113607713	1369518353	/nfs/dbraw/zinc/51/83/53/1369518353.db2.gz	QLAJEZPATOTNSV-QGZVFWFLSA-N	0	3	330.472	3.127	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCCO[C@H](CNCc2ccccc2F)C1	ZINC001201513777	1369561980	/nfs/dbraw/zinc/56/19/80/1369561980.db2.gz	CZHDPIZUICCOOD-QGZVFWFLSA-N	0	3	348.462	3.135	20	30		EGEDHN
CC#CCNC[C@@H]1CN(C(=O)C[C@H](C)CCCCCC)CCCO1	ZINC001201842478	1369633097	/nfs/dbraw/zinc/63/30/97/1369633097.db2.gz	WHLIXGKZCXSWGW-RTBURBONSA-N	0	3	336.520	3.213	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)N1CCC(NCc2cc(C3CC3)no2)CC1	ZINC001202084383	1369683604	/nfs/dbraw/zinc/68/36/04/1369683604.db2.gz	BLSIQTKNCRLOGW-KGLIPLIRSA-N	0	3	331.460	3.091	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)N1CCC(NCc2nc(C)sc2C)CC1	ZINC001202084679	1369684065	/nfs/dbraw/zinc/68/40/65/1369684065.db2.gz	HRBQQCMCQLWWQQ-OLZOCXBDSA-N	0	3	335.517	3.299	20	30		EGEDHN
O=C(N[C@@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2)C1CCCC1	ZINC001202290854	1369731845	/nfs/dbraw/zinc/73/18/45/1369731845.db2.gz	PQPSFPDWGIXUEM-VQTJNVASSA-N	0	3	336.479	3.245	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(NCc3oc(C)nc3C)CC2)CCC1	ZINC001202372715	1369753624	/nfs/dbraw/zinc/75/36/24/1369753624.db2.gz	WWKZPQRQOKWYMB-UHFFFAOYSA-N	0	3	331.460	3.118	20	30		EGEDHN
Cc1ccoc1C(=O)N[C@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202446659	1369774709	/nfs/dbraw/zinc/77/47/09/1369774709.db2.gz	FRVYDYFEYCABCO-MOPGFXCFSA-N	0	3	348.446	3.270	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1[C@H]2CN([C@H](CC)c3ccc(F)cc3)C[C@H]21	ZINC001114201758	1369791579	/nfs/dbraw/zinc/79/15/79/1369791579.db2.gz	VHZVBDKVZCNZQJ-RMJJICAUSA-N	0	3	328.431	3.127	20	30		EGEDHN
C/C=C(\C)C(=O)N[C@@H]1C[C@@H](NCc2ccc(C#N)cc2F)C12CCC2	ZINC001202726754	1369868673	/nfs/dbraw/zinc/86/86/73/1369868673.db2.gz	USSCMZVXGUZHSZ-KXVSIHCVSA-N	0	3	341.430	3.181	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1C[C@H](NCC=C(Cl)Cl)C12CCC2	ZINC001202846375	1369906631	/nfs/dbraw/zinc/90/66/31/1369906631.db2.gz	KALYOYKTGYQJAT-QWHCGFSZSA-N	0	3	329.271	3.126	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1C[C@H](NCc2cc(C)ccc2F)C12CCC2	ZINC001202846012	1369906756	/nfs/dbraw/zinc/90/67/56/1369906756.db2.gz	HGHADEYWMHGUCT-RBUKOAKNSA-N	0	3	342.458	3.455	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1C[C@H](NCc2ccc(F)cc2F)C12CCC2	ZINC001202867768	1369912222	/nfs/dbraw/zinc/91/22/22/1369912222.db2.gz	UJKPXJKJCQEAJJ-ZWKOTPCHSA-N	0	3	346.421	3.141	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1C[C@@H](NCc2conc2C)C12CCC2	ZINC001202951633	1369934812	/nfs/dbraw/zinc/93/48/12/1369934812.db2.gz	SKXWXUPIRYENSP-QZTJIDSGSA-N	0	3	343.471	3.268	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1C[C@H](NCc2cncs2)C12CCC2	ZINC001202959490	1369936484	/nfs/dbraw/zinc/93/64/84/1369936484.db2.gz	FTBVVEHEWDMBRO-DLBZAZTESA-N	0	3	345.512	3.429	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1C[C@@H](NCc2ccns2)C12CCC2	ZINC001202959447	1369936567	/nfs/dbraw/zinc/93/65/67/1369936567.db2.gz	DZAHDVSOUFKNKF-IAGOWNOFSA-N	0	3	345.512	3.429	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cc(CC)no1)[C@H]2CC	ZINC001203218413	1370029164	/nfs/dbraw/zinc/02/91/64/1370029164.db2.gz	ISPFZRAGTSJBOY-HKUYNNGSSA-N	0	3	331.460	3.159	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1[C@H]2CN([C@H](C)c3ccc(F)cc3)C[C@H]21	ZINC001114710490	1370039773	/nfs/dbraw/zinc/03/97/73/1370039773.db2.gz	DROVIGHCTFMWOV-QKUWSGOFSA-N	0	3	328.431	3.127	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1C[C@@H](NCc2oc(C)nc2C)C12CCC2	ZINC001203257581	1370044924	/nfs/dbraw/zinc/04/49/24/1370044924.db2.gz	NGCYPBDXDXJDNO-IAGOWNOFSA-N	0	3	345.487	3.411	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1C[C@@H](NCc2c(C)onc2CC)C12CCC2	ZINC001203272567	1370053189	/nfs/dbraw/zinc/05/31/89/1370053189.db2.gz	DLVPQEDEVPPCLY-SJORKVTESA-N	0	3	345.487	3.275	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1C[C@H](NCc2oc(CC)nc2C)C12CCC2	ZINC001203279919	1370058722	/nfs/dbraw/zinc/05/87/22/1370058722.db2.gz	CEGGSESAHBHLLG-JKSUJKDBSA-N	0	3	345.487	3.275	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1C[C@@H](NCc2cnoc2C)C12CCC2	ZINC001203295820	1370068495	/nfs/dbraw/zinc/06/84/95/1370068495.db2.gz	NGQOYOONTXUDLO-MSOLQXFVSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1[C@H]2CN(CCOc3cccc(C)c3)C[C@H]21	ZINC001114780782	1370076668	/nfs/dbraw/zinc/07/66/68/1370076668.db2.gz	LNHXCPHXHVOLPE-PXCRPINLSA-N	0	3	342.483	3.023	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2[C@H]3CN(Cc4ccc(F)cc4C)C[C@H]32)CC1	ZINC001114794312	1370085074	/nfs/dbraw/zinc/08/50/74/1370085074.db2.gz	GNKIZVVEDJXZJG-BWTSREIZSA-N	0	3	342.458	3.427	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1C[C@H](NCc2c(C)noc2CC)C12CCC2	ZINC001203339721	1370088913	/nfs/dbraw/zinc/08/89/13/1370088913.db2.gz	JJGRVNPQWJIUCZ-ROUUACIJSA-N	0	3	345.487	3.419	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1C[C@H](NCc2c(C)onc2CC)C12CCC2	ZINC001203341131	1370090013	/nfs/dbraw/zinc/09/00/13/1370090013.db2.gz	OPFLTNPJEWCHLS-ROUUACIJSA-N	0	3	345.487	3.419	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@@H](NCc3ocnc3C)C23CCC3)CCC1	ZINC001203367772	1370101277	/nfs/dbraw/zinc/10/12/77/1370101277.db2.gz	VREMDWHGTNNEAO-SJORKVTESA-N	0	3	343.471	3.246	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)CCCc2ccccn2)C12CCC2	ZINC001203640237	1370196868	/nfs/dbraw/zinc/19/68/68/1370196868.db2.gz	ALENZHYAXIMEHL-SJORKVTESA-N	0	3	347.890	3.174	20	30		EGEDHN
Cc1cccc(N2C[C@]3(CCN(Cc4ccc(C#N)cc4)C3)CC2=O)c1	ZINC001203901306	1370306487	/nfs/dbraw/zinc/30/64/87/1370306487.db2.gz	LDJHVMRLUHGVBR-JOCHJYFZSA-N	0	3	345.446	3.496	20	30		EGEDHN
CC[C@H](CC(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21)C(C)C	ZINC001115145354	1370307656	/nfs/dbraw/zinc/30/76/56/1370307656.db2.gz	FLXWSMOYAHCZOK-BNDYYXHWSA-N	0	3	339.483	3.177	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H]2CN([C@H](C)c3cccc(OC)c3)C[C@H]21	ZINC001187198125	1388069698	/nfs/dbraw/zinc/06/96/98/1388069698.db2.gz	BHEFJEFCCOVGJV-HHXXYDBFSA-N	0	3	328.456	3.255	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(NCc3nccn3CC)CC2)CCCC1	ZINC001204140437	1370388439	/nfs/dbraw/zinc/38/84/39/1370388439.db2.gz	QVGHZTUSMCDCBL-UHFFFAOYSA-N	0	3	344.503	3.120	20	30		EGEDHN
CSc1ccc(CN2CCCN(c3ccc(C#N)cn3)CC2)cc1	ZINC001204142762	1370389351	/nfs/dbraw/zinc/38/93/51/1370389351.db2.gz	VGPZFGRWJZQDLT-UHFFFAOYSA-N	0	3	338.480	3.387	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(NCc3nccnc3C)CC2)CCCC1	ZINC001204157674	1370394250	/nfs/dbraw/zinc/39/42/50/1370394250.db2.gz	XBNSOFUQCFAMEI-UHFFFAOYSA-N	0	3	342.487	3.002	20	30		EGEDHN
C=CCN1C(=O)CC[C@@]12CCCN(Cc1ccc(F)c(F)c1)CC2	ZINC001204223492	1370413714	/nfs/dbraw/zinc/41/37/14/1370413714.db2.gz	HOWKFNWCRRUSMP-LJQANCHMSA-N	0	3	334.410	3.498	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)NCC1(NCC#Cc2ccc(F)cc2)CCCCC1	ZINC001115388838	1370425403	/nfs/dbraw/zinc/42/54/03/1370425403.db2.gz	BVBIMCRZGCEBRT-VQIMIIECSA-N	0	3	342.458	3.242	20	30		EGEDHN
C[C@@H]1C[C@@H]1C(=O)NCC1(NCc2ccc(C#N)cc2F)CCCCC1	ZINC001115389181	1370426165	/nfs/dbraw/zinc/42/61/65/1370426165.db2.gz	KGGIVIAYRCTVQC-PBHICJAKSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=CCOc1ccc(CN2CCCN(c3ccc(F)cn3)CC2)cc1	ZINC001204298117	1370435008	/nfs/dbraw/zinc/43/50/08/1370435008.db2.gz	VXFYHVMFCYJIJA-UHFFFAOYSA-N	0	3	341.430	3.498	20	30		EGEDHN
Cc1cc(C#N)c(Nc2cccc(CN3CCN(C)CC3)c2)s1	ZINC001204491586	1370491157	/nfs/dbraw/zinc/49/11/57/1370491157.db2.gz	QISQBFSJHPQRRM-UHFFFAOYSA-N	0	3	326.469	3.419	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1cnc(C(C)(C)C)s1	ZINC001690880865	1404793877	/nfs/dbraw/zinc/79/38/77/1404793877.db2.gz	CSNBLIWTEYYWLI-LLVKDONJSA-N	0	3	329.897	3.291	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)NCC1(NCC=C(Cl)Cl)CCCCC1	ZINC001115508770	1370508172	/nfs/dbraw/zinc/50/81/72/1370508172.db2.gz	BOPIENQDPOCNAL-HNNXBMFYSA-N	0	3	349.302	3.041	20	30		EGEDHN
CN1CCN(Cc2cccc(Nc3ccc(C#N)c(F)c3F)c2)CC1	ZINC001204563561	1370516384	/nfs/dbraw/zinc/51/63/84/1370516384.db2.gz	BFPABNAMUBXHCI-UHFFFAOYSA-N	0	3	342.393	3.327	20	30		EGEDHN
CNc1ccc(C#N)cc1Nc1cccc(CN2CCN(C)CC2)c1	ZINC001204574857	1370520973	/nfs/dbraw/zinc/52/09/73/1370520973.db2.gz	QDPJICJOQVXPAY-UHFFFAOYSA-N	0	3	335.455	3.091	20	30		EGEDHN
C=CCOCCCC(=O)N1CCC(CNC/C(Cl)=C/Cl)CC1	ZINC001204908568	1370602864	/nfs/dbraw/zinc/60/28/64/1370602864.db2.gz	UUBIHYXTOHPYHZ-PTNGSMBKSA-N	0	3	349.302	3.116	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccncc2CC)CCCCC1	ZINC001115608676	1370607974	/nfs/dbraw/zinc/60/79/74/1370607974.db2.gz	ZMWBQOXFVUVNIL-UHFFFAOYSA-N	0	3	335.879	3.419	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NCC1(NCC(=C)Cl)CCCCC1	ZINC001115650307	1370637796	/nfs/dbraw/zinc/63/77/96/1370637796.db2.gz	SUEIZUJDAFMXII-KRWDZBQOSA-N	0	3	342.911	3.376	20	30		EGEDHN
C=CC(C)(C)C(=O)NCC1(NCc2n[nH]c(C(C)C)n2)CCCCC1	ZINC001115666942	1370647891	/nfs/dbraw/zinc/64/78/91/1370647891.db2.gz	FBUDBPWIZNELIQ-UHFFFAOYSA-N	0	3	347.507	3.049	20	30		EGEDHN
CC[C@H](C)CC(=O)N1CCC(CNCc2ccccc2C#N)CC1	ZINC001205105466	1370651654	/nfs/dbraw/zinc/65/16/54/1370651654.db2.gz	CODQAVYUFXBGST-INIZCTEOSA-N	0	3	327.472	3.323	20	30		EGEDHN
CC[C@@H](F)C(=O)NCC1(NCC#Cc2ccccc2)CCCCC1	ZINC001115670254	1370652164	/nfs/dbraw/zinc/65/21/64/1370652164.db2.gz	DYXRVSVMYHYBJQ-GOSISDBHSA-N	0	3	330.447	3.195	20	30		EGEDHN
CN1CCN(C2(c3ccc(Nc4ccc(O)c(C#N)c4)cc3)CC2)CC1	ZINC001205112877	1370653730	/nfs/dbraw/zinc/65/37/30/1370653730.db2.gz	DMWJMQODSYGVES-UHFFFAOYSA-N	0	3	348.450	3.244	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCC1(NCc2nccnc2C)CCCCC1	ZINC001115685152	1370668518	/nfs/dbraw/zinc/66/85/18/1370668518.db2.gz	VZPZHRZTCHSEPG-QGZVFWFLSA-N	0	3	344.503	3.296	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CC2CC(OCC)C2)CCCCC1	ZINC001115688218	1370671054	/nfs/dbraw/zinc/67/10/54/1370671054.db2.gz	QLLLBPYLXCPVRE-UHFFFAOYSA-N	0	3	342.911	3.353	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccc3n[nH]cc3c2)CCCCC1	ZINC001115697400	1370678889	/nfs/dbraw/zinc/67/88/89/1370678889.db2.gz	DCCDINYFJJBSJC-UHFFFAOYSA-N	0	3	346.862	3.338	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C2CC(C)C2)CC[C@H]1c1ccc(F)cc1	ZINC001205270326	1370701433	/nfs/dbraw/zinc/70/14/33/1370701433.db2.gz	RYBSFEZOMSEGLA-FCUIKFHKSA-N	0	3	342.458	3.169	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@H](C)C(C)C)CC[C@H]1c1ccc(F)cc1	ZINC001205312967	1370718126	/nfs/dbraw/zinc/71/81/26/1370718126.db2.gz	KXYJEJNILQJCHV-LSTHTHJFSA-N	0	3	344.474	3.415	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC1(NCc2nccnc2C)CCCCC1	ZINC001115750644	1370731549	/nfs/dbraw/zinc/73/15/49/1370731549.db2.gz	ZXANWTLTYHCNGG-UHFFFAOYSA-N	0	3	344.503	3.296	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC(CN[C@H](C)c2cnc(C)cn2)CC1	ZINC001205397595	1370742719	/nfs/dbraw/zinc/74/27/19/1370742719.db2.gz	COLPXAVHMROFJQ-MRXNPFEDSA-N	0	3	344.503	3.277	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC(CNCc2oc(CC)nc2C)CC1	ZINC001205407331	1370747080	/nfs/dbraw/zinc/74/70/80/1370747080.db2.gz	GKQAUNJXHQDGOM-UHFFFAOYSA-N	0	3	333.476	3.230	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@@H](C)C(C)(C)C)C[C@H]1c1cccc(F)c1	ZINC001205417229	1370748246	/nfs/dbraw/zinc/74/82/46/1370748246.db2.gz	VTCIWJPOBBIEHO-AYOQOUSVSA-N	0	3	344.474	3.415	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H](C)C(CC)CC)C[C@H]1c1cccc(F)c1	ZINC001205417127	1370748578	/nfs/dbraw/zinc/74/85/78/1370748578.db2.gz	PRKSYDCBUKTXKB-UIAACRFSSA-N	0	3	344.474	3.415	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC(CN[C@@H](C)c2cnc(C)cn2)CC1	ZINC001205988686	1370930914	/nfs/dbraw/zinc/93/09/14/1370930914.db2.gz	JWVJGUAKSBYUHL-IRXDYDNUSA-N	0	3	344.503	3.277	20	30		EGEDHN
C=CCN1C(=O)CCC[C@]12CCCN(Cc1sc(C)nc1C)C2	ZINC001206151015	1370973753	/nfs/dbraw/zinc/97/37/53/1370973753.db2.gz	INBBBCQJJOPLPA-GOSISDBHSA-N	0	3	333.501	3.293	20	30		EGEDHN
CC(C)(C)OC(=O)NCc1ccccc1CN[C@@H]1CC[C@@H](C#N)C1	ZINC001116910362	1371000015	/nfs/dbraw/zinc/00/00/15/1371000015.db2.gz	FTOQOPCJIJROHF-RHSMWYFYSA-N	0	3	329.444	3.493	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N[C@@H]1CN(Cc2cc(C)cc(C)c2)C[C@H]1C	ZINC001206429175	1371052324	/nfs/dbraw/zinc/05/23/24/1371052324.db2.gz	RPLQWNSZSSYWIF-WSTZPKSXSA-N	0	3	344.499	3.221	20	30		EGEDHN
C[C@H](NCc1cccc(OCC#N)c1)c1ccc(C(=O)N(C)C)cc1	ZINC001117714989	1371068201	/nfs/dbraw/zinc/06/82/01/1371068201.db2.gz	TVBNIWCGAPYXLS-HNNXBMFYSA-N	0	3	337.423	3.142	20	30		EGEDHN
CCSc1cc(CNCCC(=O)Nc2cccc(C#N)c2)ccn1	ZINC001326154788	1388120734	/nfs/dbraw/zinc/12/07/34/1388120734.db2.gz	AHNCPDAOAILNMZ-UHFFFAOYSA-N	0	3	340.452	3.184	20	30		EGEDHN
Cc1ccc(CN2C[C@@H](C)[C@H](NC(=O)C#CC(C)(C)C)C2)cc1C	ZINC001206951923	1371242288	/nfs/dbraw/zinc/24/22/88/1371242288.db2.gz	OYOCSNQVJUNUCP-IEBWSBKVSA-N	0	3	326.484	3.289	20	30		EGEDHN
CCC(=O)N1CCC[C@H](NCC#Cc2ccc(C(F)(F)F)cc2)C1	ZINC001206982130	1371258413	/nfs/dbraw/zinc/25/84/13/1371258413.db2.gz	HXLDHVVAXHBVQJ-INIZCTEOSA-N	0	3	338.373	3.048	20	30		EGEDHN
C[C@@H]1[C@H](CNC(=O)OC(C)(C)C)CCCN1Cc1cc(C#N)n(C)c1	ZINC001207103053	1371294916	/nfs/dbraw/zinc/29/49/16/1371294916.db2.gz	KTJXQXAFISAMTI-ZBFHGGJFSA-N	0	3	346.475	3.022	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN(CCOc2c(C)cccc2C)C[C@H]1C	ZINC001207190713	1371325857	/nfs/dbraw/zinc/32/58/57/1371325857.db2.gz	UAVWKPYXUJXYCF-RTBURBONSA-N	0	3	344.499	3.475	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)c2ccc(C3CCC3)cc2)C1	ZINC001207389519	1371382904	/nfs/dbraw/zinc/38/29/04/1371382904.db2.gz	GTAVRTIQALKKLQ-OXQOHEQNSA-N	0	3	342.483	3.207	20	30		EGEDHN
C=CCOC(=O)N[C@H]1CCCN(CCCc2cccc(OC)c2)C1	ZINC001207572077	1371439251	/nfs/dbraw/zinc/43/92/51/1371439251.db2.gz	HWUAYCUAYRJNSN-KRWDZBQOSA-N	0	3	332.444	3.004	20	30		EGEDHN
O=C(C1CC=CC1)N1CCC[C@@H](NCC#Cc2ccccc2Cl)C1	ZINC001207729654	1371487315	/nfs/dbraw/zinc/48/73/15/1371487315.db2.gz	WLKDFFFFSNCVEH-GOSISDBHSA-N	0	3	342.870	3.238	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NCC1(NCC=C(Cl)Cl)CCCCC1	ZINC001120233148	1371510246	/nfs/dbraw/zinc/51/02/46/1371510246.db2.gz	BHWYNVHMWVZCPJ-CYBMUJFWSA-N	0	3	349.302	3.305	20	30		EGEDHN
C#CCCCCC(=O)N1CCC[C@H](NCc2cc(F)ccc2OC)C1	ZINC001207862966	1371523529	/nfs/dbraw/zinc/52/35/29/1371523529.db2.gz	CQERMPXJWQOZBJ-SFHVURJKSA-N	0	3	346.446	3.109	20	30		EGEDHN
C=CCOC[C@H]1c2c(ncn2C)CCN1C[C@@H](C)c1ccccc1	ZINC001207904157	1371532928	/nfs/dbraw/zinc/53/29/28/1371532928.db2.gz	CNKURKKSZAMQNB-APWZRJJASA-N	0	3	325.456	3.326	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H]([C@@H]2CCCN2Cc2snnc2C)C1	ZINC001120348322	1371542855	/nfs/dbraw/zinc/54/28/55/1371542855.db2.gz	UFGQCJHGUDIINP-HOTGVXAUSA-N	0	3	348.516	3.016	20	30		EGEDHN
CC/C(C)=C/C(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001208002979	1371564921	/nfs/dbraw/zinc/56/49/21/1371564921.db2.gz	ZYQUEMRBBUNTHT-IDCODDLRSA-N	0	3	328.431	3.114	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CCC[C@@H](NCc2ccccc2Cl)C1	ZINC001208011197	1371567546	/nfs/dbraw/zinc/56/75/46/1371567546.db2.gz	XXBQNJOZANDMMQ-MRXNPFEDSA-N	0	3	332.875	3.470	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC[C@@H](NCc2cc(C)ns2)C1	ZINC001208194693	1371635197	/nfs/dbraw/zinc/63/51/97/1371635197.db2.gz	UTLUNAOVZUQMDO-MRXNPFEDSA-N	0	3	333.501	3.301	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CCC[C@H](NCc2ccccc2F)C1)OCC	ZINC001208263794	1371689965	/nfs/dbraw/zinc/68/99/65/1371689965.db2.gz	CLXHJLLKJSNROL-PKOBYXMFSA-N	0	3	348.462	3.278	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN(Cc2ccc(OC)c(C)c2)C[C@H]1C	ZINC001208314992	1371712335	/nfs/dbraw/zinc/71/23/35/1371712335.db2.gz	DNRIVSWHHOIAER-NVXWUHKLSA-N	0	3	330.472	3.152	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CN(Cc2ccc3cc[nH]c3c2)C[C@H]1C	ZINC001208374469	1371740882	/nfs/dbraw/zinc/74/08/82/1371740882.db2.gz	KFFUGEIQKCHYSU-OXQOHEQNSA-N	0	3	337.467	3.298	20	30		EGEDHN
C=CCCC(=O)NC1CC2(CC(NCc3nc(C)c(C)s3)C2)C1	ZINC001120786834	1371757776	/nfs/dbraw/zinc/75/77/76/1371757776.db2.gz	AJPRAOBRUHOVKC-UHFFFAOYSA-N	0	3	333.501	3.243	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1CN(CCOc2cccc(C)c2)C[C@H]1C	ZINC001208497815	1371787717	/nfs/dbraw/zinc/78/77/17/1371787717.db2.gz	AXKDUOPOKRUBCB-YFVAEKQCSA-N	0	3	344.499	3.413	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC1CC2(CC(NCc3conc3CC)C2)C1	ZINC001121169828	1371876137	/nfs/dbraw/zinc/87/61/37/1371876137.db2.gz	YRXHHOOHQZNUGT-UHFFFAOYSA-N	0	3	345.487	3.356	20	30		EGEDHN
C=C(C)CCC(=O)NC1CC2(CC(NCc3ncc(C)s3)C2)C1	ZINC001121180726	1371880472	/nfs/dbraw/zinc/88/04/72/1371880472.db2.gz	VZGNEJNSDOGBJO-UHFFFAOYSA-N	0	3	333.501	3.325	20	30		EGEDHN
COC(=O)c1ccc(C2CN(CCCc3cccc(C#N)c3)C2)cc1	ZINC001208853951	1371919358	/nfs/dbraw/zinc/91/93/58/1371919358.db2.gz	CZFASHLWGVKEEG-UHFFFAOYSA-N	0	3	334.419	3.377	20	30		EGEDHN
N#Cc1ccc(CCN2CCc3ncc(Br)cc3C2)cc1	ZINC001208926687	1371946986	/nfs/dbraw/zinc/94/69/86/1371946986.db2.gz	YKSISBCYRRRRHS-UHFFFAOYSA-N	0	3	342.240	3.317	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC[C@@H](NCc2ccnc(Cl)c2)C1	ZINC001209002842	1371971875	/nfs/dbraw/zinc/97/18/75/1371971875.db2.gz	CZISRASWGDBDMQ-QGZVFWFLSA-N	0	3	347.890	3.399	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N(C)c1cccc(C)c1	ZINC001121495585	1371992039	/nfs/dbraw/zinc/99/20/39/1371992039.db2.gz	LWFHDWBDHXAHTK-INIZCTEOSA-N	0	3	325.460	3.350	20	30		EGEDHN
N#Cc1cc(CN[C@H]2CCCN(C(=O)CCCC3CC3)C2)ccc1F	ZINC001209146744	1372013930	/nfs/dbraw/zinc/01/39/30/1372013930.db2.gz	QIGDIIJGLCNQCD-SFHVURJKSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001209147331	1372014697	/nfs/dbraw/zinc/01/46/97/1372014697.db2.gz	VXRGVQFTYHHCTN-CRAIPNDOSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@@H](NCc2cn(C(C)C)nc2C)C1	ZINC001209184415	1372029357	/nfs/dbraw/zinc/02/93/57/1372029357.db2.gz	SGFAFGOLRROFNF-VQIMIIECSA-N	0	3	346.519	3.455	20	30		EGEDHN
Cc1cc(C)cc(CN2C[C@@H]3CCN(C(=O)C#CC(C)(C)C)[C@@H]3C2)c1	ZINC001187833295	1388174214	/nfs/dbraw/zinc/17/42/14/1388174214.db2.gz	KNRQOFUSPICTRM-VQTJNVASSA-N	0	3	338.495	3.386	20	30		EGEDHN
C#CCCCN1CC[C@@H](NC(=O)OC(C)(C)C)[C@@H](C(F)(F)F)C1	ZINC001209268116	1372054604	/nfs/dbraw/zinc/05/46/04/1372054604.db2.gz	UIBFRJRYXRFMSX-QWHCGFSZSA-N	0	3	334.382	3.177	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H](NCC#Cc3ccc(F)cc3)C2)C1	ZINC001209542918	1372132742	/nfs/dbraw/zinc/13/27/42/1372132742.db2.gz	FLZDPOKLZNJZMI-IBGZPJMESA-N	0	3	340.442	3.114	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)CCc1cccs1)C2	ZINC001122161877	1372191828	/nfs/dbraw/zinc/19/18/28/1372191828.db2.gz	JJNVGXSQALOKFQ-UHFFFAOYSA-N	0	3	338.904	3.450	20	30		EGEDHN
C=CC1(CC(=O)N2CCC[C@@H](NCc3ccnn3C)C2)CCCCC1	ZINC001210109011	1372273185	/nfs/dbraw/zinc/27/31/85/1372273185.db2.gz	XZOHNUYAQCWERT-QGZVFWFLSA-N	0	3	344.503	3.027	20	30		EGEDHN
COc1cccc(Nc2ccc(N3CCN(C)CC3)cc2C)c1C#N	ZINC001210123237	1372276343	/nfs/dbraw/zinc/27/63/43/1372276343.db2.gz	DDRMOBTXISALAK-UHFFFAOYSA-N	0	3	336.439	3.371	20	30		EGEDHN
COc1ccc(Cl)cc1NC(=O)N1CCC2SC(=O)C=C2C1	ZINC001187913655	1388189404	/nfs/dbraw/zinc/18/94/04/1388189404.db2.gz	INAHQXSJLXXCMF-ZDUSSCGKSA-N	0	3	338.816	3.155	20	30		EGEDHN
CC1(CCC(=O)N2CCC[C@H](NCC#Cc3ccc(F)cc3)C2)CC1	ZINC001210463947	1372359488	/nfs/dbraw/zinc/35/94/88/1372359488.db2.gz	HQRHXWSMIHWBJX-IBGZPJMESA-N	0	3	342.458	3.338	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCN(C(=O)[C@@H](c2ccccc2)N(C)CC)C1	ZINC001210633572	1372396387	/nfs/dbraw/zinc/39/63/87/1372396387.db2.gz	FWRJIOWTQMPIIH-QZTJIDSGSA-N	0	3	349.906	3.013	20	30		EGEDHN
Cc1ccc(CN2C[C@@H](C)[C@H](NC(=O)CC#Cc3ccccc3)C2)cc1	ZINC001211232023	1372508219	/nfs/dbraw/zinc/50/82/19/1372508219.db2.gz	DPOUSRPYJFEMTL-DENIHFKCSA-N	0	3	346.474	3.373	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N[C@@H]1CN(Cc2ccc(C(C)C)cc2)C[C@H]1C	ZINC001211426110	1372556642	/nfs/dbraw/zinc/55/66/42/1372556642.db2.gz	ZDSHFUDMKRGPRL-MBOZVWFJSA-N	0	3	344.499	3.338	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C[C@@H]2CC=CCC2)C[C@H]1c1ccccc1	ZINC001211648495	1372595712	/nfs/dbraw/zinc/59/57/12/1372595712.db2.gz	BAUIHKNVDJPDNH-HLAWJBBLSA-N	0	3	336.479	3.340	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](c3ccccc3)[C@H](NCC#CC)C2)CCC1	ZINC001211671056	1372600803	/nfs/dbraw/zinc/60/08/03/1372600803.db2.gz	VDDZERJFBFDURB-VQTJNVASSA-N	0	3	336.479	3.340	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C2(C)CC(F)(F)C2)C[C@H]1c1ccccc1	ZINC001211706017	1372606283	/nfs/dbraw/zinc/60/62/83/1372606283.db2.gz	WMQIIYNHQVJHAX-DLBZAZTESA-N	0	3	346.421	3.029	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2cccn2C(C)C)C[C@H]1c1ccccc1	ZINC001211723644	1372608324	/nfs/dbraw/zinc/60/83/24/1372608324.db2.gz	YMRBNTDZCQNKIU-VQTJNVASSA-N	0	3	349.478	3.290	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2ccccc2C)[C@H](OC)C1	ZINC001211779610	1372614739	/nfs/dbraw/zinc/61/47/39/1372614739.db2.gz	HWRPXMWHKDNQOA-RTBURBONSA-N	0	3	332.488	3.394	20	30		EGEDHN
CCCCCCCC[C@@H](C)C(=O)N1CC[C@@H](NCc2cnn(C)c2)C1	ZINC001188015535	1388214259	/nfs/dbraw/zinc/21/42/59/1388214259.db2.gz	GVCVNJRZFYKRJM-IEBWSBKVSA-N	0	3	348.535	3.497	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2ccsc2C)[C@H](OC)C1	ZINC001212240094	1372676744	/nfs/dbraw/zinc/67/67/44/1372676744.db2.gz	XALQEJMXJOCWFL-IAGOWNOFSA-N	0	3	338.517	3.456	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@@H]2CCCC23CC3)[C@H](OC)C1	ZINC001212455900	1372709653	/nfs/dbraw/zinc/70/96/53/1372709653.db2.gz	YOWOWUKBKWLXKX-RCCFBDPRSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=C[C@@H](CC(=O)N1CC[C@@H](NCc2cnccc2C)C1)c1ccccc1	ZINC001188040510	1388224643	/nfs/dbraw/zinc/22/46/43/1388224643.db2.gz	QBTPOSAYTCKCHN-GHTZIAJQSA-N	0	3	349.478	3.440	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN([C@H]2CCCc3ccccc32)C[C@H]1OC	ZINC001213273377	1372872994	/nfs/dbraw/zinc/87/29/94/1372872994.db2.gz	MPRBYNHNNPVDPM-CEXWTWQISA-N	0	3	342.483	3.092	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2ccoc2C2CC2)[C@H](OC)C1	ZINC001213333853	1372886084	/nfs/dbraw/zinc/88/60/84/1372886084.db2.gz	RNIAVKZNKODLOJ-QZTJIDSGSA-N	0	3	346.471	3.332	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)C2CCC(F)CC2)[C@H](OC)C1	ZINC001213376858	1372896331	/nfs/dbraw/zinc/89/63/31/1372896331.db2.gz	KSPLYULKBHHBKF-OPQOLIRYSA-N	0	3	342.499	3.301	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)[C@H](CC)Cc2ccccc2)[C@H](OC)C1	ZINC001213506502	1372915469	/nfs/dbraw/zinc/91/54/69/1372915469.db2.gz	LJMVAWKWNRTKAW-VAMGGRTRSA-N	0	3	344.499	3.037	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H](NC(=O)c2ccc(C(F)F)o2)[C@H](OC)C1	ZINC001213792684	1372962500	/nfs/dbraw/zinc/96/25/00/1372962500.db2.gz	NREFXZNWONZVPR-YWPYICTPSA-N	0	3	342.386	3.001	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)C(=O)N[C@@H]1CN(CCCC)C[C@H]1OC	ZINC001213895103	1372976031	/nfs/dbraw/zinc/97/60/31/1372976031.db2.gz	IJFPXCDABHVFGZ-VAMGGRTRSA-N	0	3	344.499	3.037	20	30		EGEDHN
CC(C)[C@H](C)CC(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2)C1	ZINC001214308117	1373042307	/nfs/dbraw/zinc/04/23/07/1373042307.db2.gz	UEMWQZLCMMGFLF-QWFCFKBJSA-N	0	3	326.484	3.157	20	30		EGEDHN
CCCC[C@H](C)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001214550897	1373078711	/nfs/dbraw/zinc/07/87/11/1373078711.db2.gz	VTFKZJARMMRMSL-SQGPQFPESA-N	0	3	344.474	3.440	20	30		EGEDHN
CC(C)c1cccc(CN[C@@H]2CN(C(=O)C#CC(C)(C)C)C[C@H]2C)n1	ZINC001214589055	1373085550	/nfs/dbraw/zinc/08/55/50/1373085550.db2.gz	FDZPEUXBPIEZIG-VQIMIIECSA-N	0	3	341.499	3.191	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@@]2(C)CC=CCC2)C[C@H]1NCC#Cc1ccccc1	ZINC001214704873	1373105143	/nfs/dbraw/zinc/10/51/43/1373105143.db2.gz	KBSTWWYZVMSJMK-UZKOGDIHSA-N	0	3	336.479	3.221	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@@H]2CCC2(C)C)C[C@H]1NCC#Cc1ccc(F)cc1	ZINC001215356137	1373202289	/nfs/dbraw/zinc/20/22/89/1373202289.db2.gz	QIJFZFZLPBNLAS-AYOQOUSVSA-N	0	3	342.458	3.050	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001215367374	1373203519	/nfs/dbraw/zinc/20/35/19/1373203519.db2.gz	MBFDJTWAMKDXAI-CKEIUWERSA-N	0	3	331.485	3.159	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCN[C@@H]1CCc2c1cc(F)cc2F	ZINC001128085537	1373216471	/nfs/dbraw/zinc/21/64/71/1373216471.db2.gz	VHUAEEPSPOQUGN-GOSISDBHSA-N	0	3	334.410	3.426	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)C/C=C/c2ccccc2F)c1	ZINC001130169548	1373468566	/nfs/dbraw/zinc/46/85/66/1373468566.db2.gz	FXPYCKZWEGBKME-XBXARRHUSA-N	0	3	337.398	3.007	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)[C@@H](C)CC2CCCC2)C1	ZINC001130430969	1373536857	/nfs/dbraw/zinc/53/68/57/1373536857.db2.gz	NLTRCCVXMAIETB-DOTOQJQBSA-N	0	3	344.503	3.218	20	30		EGEDHN
N#Cc1cc(-c2ccc(Cl)cc2)cnc1O[C@@H]1CCNC[C@H]1F	ZINC001218064584	1373550838	/nfs/dbraw/zinc/55/08/38/1373550838.db2.gz	NAAOKGBFUCHAGE-HZPDHXFCSA-N	0	3	331.778	3.352	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)CC3(C)CCCCC3)[C@H]2C1	ZINC001218269589	1373586483	/nfs/dbraw/zinc/58/64/83/1373586483.db2.gz	DAWBYMOVDOXAPX-ZWKOTPCHSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)C[C@@H]3CC=CCC3)[C@H]2C1	ZINC001218428924	1373611726	/nfs/dbraw/zinc/61/17/26/1373611726.db2.gz	ITPQGCGHSQSSQK-HSALFYBXSA-N	0	3	346.515	3.391	20	30		EGEDHN
Fc1cc(O[C@@H]2CNCCC2(F)F)cc(F)c1OC(F)(F)F	ZINC001218446119	1373613979	/nfs/dbraw/zinc/61/39/79/1373613979.db2.gz	CAWVUJPSUXTLAV-SECBINFHSA-N	0	3	333.203	3.239	20	30		EGEDHN
CCCc1ccccc1C(=O)NCCNCc1ccc(C#N)c(F)c1	ZINC001131120844	1373646676	/nfs/dbraw/zinc/64/66/76/1373646676.db2.gz	YZPARWPVJWCJRX-UHFFFAOYSA-N	0	3	339.414	3.169	20	30		EGEDHN
N#Cc1cc(NC(=O)C[C@H]([NH3+])Cc2cccc3ccccc32)ccc1[O-]	ZINC001218955113	1373670579	/nfs/dbraw/zinc/67/05/79/1373670579.db2.gz	XKMJKTPUZIBZQC-QGZVFWFLSA-N	0	3	345.402	3.316	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)Nc1ccc(-n2ccccc2=O)cc1	ZINC001219016462	1373679795	/nfs/dbraw/zinc/67/97/95/1373679795.db2.gz	FHBNNAUQUSXYNJ-SFHVURJKSA-N	0	3	339.439	3.240	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@@H](NCc3ccsc3)C2)CCCCC1	ZINC001188257083	1388276232	/nfs/dbraw/zinc/27/62/32/1388276232.db2.gz	ITPOGRWLCDIZME-QGZVFWFLSA-N	0	3	330.497	3.412	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1CN([C@@H](CC)c2ccccc2)C[C@@H]1O	ZINC001219686839	1373725404	/nfs/dbraw/zinc/72/54/04/1373725404.db2.gz	WQCBHSWAACKQQG-AABGKKOBSA-N	0	3	342.483	3.067	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)C2CCC3(CC3)CC2)[C@@H](O)C1	ZINC001220021338	1373745900	/nfs/dbraw/zinc/74/59/00/1373745900.db2.gz	SRCFHAJYNGIGBT-MSOLQXFVSA-N	0	3	336.520	3.089	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](C)O[C@@]2(CCN(CC=C(C)C)C2)C1	ZINC001131661973	1373750341	/nfs/dbraw/zinc/75/03/41/1373750341.db2.gz	RVYAMAUNOBQWOL-YLJYHZDGSA-N	0	3	334.504	3.247	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)CN(C(=O)CCCCCCCC)C[C@@H](C)O2	ZINC001131697288	1373768948	/nfs/dbraw/zinc/76/89/48/1373768948.db2.gz	ISOSJEIGSXZZLI-TZIWHRDSSA-N	0	3	348.531	3.452	20	30		EGEDHN
Cc1ccc(C2CC2)c(C(=O)NCCNCc2ccc(C#N)cc2)c1	ZINC001131749731	1373784703	/nfs/dbraw/zinc/78/47/03/1373784703.db2.gz	LBOTWCRKQNTWNU-UHFFFAOYSA-N	0	3	333.435	3.264	20	30		EGEDHN
C=CCCCCCN1CC[C@@H]2CN(C(=O)c3ocnc3CC)[C@@H]2C1	ZINC001221802637	1373793389	/nfs/dbraw/zinc/79/33/89/1373793389.db2.gz	ODOGTZAOHKZFSP-NVXWUHKLSA-N	0	3	331.460	3.130	20	30		EGEDHN
C=CCC[C@@H](C)N1CC[C@@H]2CN(C(=O)c3snnc3C(C)C)[C@@H]2C1	ZINC001221886495	1373802161	/nfs/dbraw/zinc/80/21/61/1373802161.db2.gz	JASSEISHTJZKGH-RBSFLKMASA-N	0	3	348.516	3.163	20	30		EGEDHN
C=CCOCCN1CC[C@@H]2CN(C(=O)[C@@H](CC)CCCCC)[C@@H]2C1	ZINC001222038159	1373813042	/nfs/dbraw/zinc/81/30/42/1373813042.db2.gz	OISYJKPEDQIHOK-IPMKNSEASA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@H]3CCN(CCCOCC)C[C@H]32)CCCC1	ZINC001222151943	1373817828	/nfs/dbraw/zinc/81/78/28/1373817828.db2.gz	NPSDWFQTHKVYLK-QZTJIDSGSA-N	0	3	334.504	3.082	20	30		EGEDHN
O=C(C1=CCCC1)N1CCCC[C@@H]1CNCC#Cc1ccc(F)cc1	ZINC001326698835	1388285122	/nfs/dbraw/zinc/28/51/22/1388285122.db2.gz	PPAAXAUHMDVYRB-HXUWFJFHSA-N	0	3	340.442	3.258	20	30		EGEDHN
C=CCC1(C(=O)NCC2CCN(Cc3ncccc3C)CC2)CCC1	ZINC001224402224	1375066534	/nfs/dbraw/zinc/06/65/34/1375066534.db2.gz	ABSBPFSJOBZLBG-UHFFFAOYSA-N	0	3	341.499	3.465	20	30		EGEDHN
CCc1ccccc1CCN1C[C@H](NC(=O)C#CC(C)C)CC[C@@H]1C	ZINC001132022161	1375103848	/nfs/dbraw/zinc/10/38/48/1375103848.db2.gz	VTPYIJMBFSKJOL-GHTZIAJQSA-N	0	3	340.511	3.420	20	30		EGEDHN
C/C=C(\C)C(=O)N[C@@H]1CCCC[C@H]1NCc1cc(C#N)ccc1F	ZINC001225599574	1375130386	/nfs/dbraw/zinc/13/03/86/1375130386.db2.gz	CAFNKGRCAKUMDI-KXVSIHCVSA-N	0	3	329.419	3.181	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NCC1CCN([C@@H](C)c2ccccc2F)CC1	ZINC001225632133	1375135754	/nfs/dbraw/zinc/13/57/54/1375135754.db2.gz	YBFRSLZJZDMQJS-JKSUJKDBSA-N	0	3	348.462	3.306	20	30		EGEDHN
O=C(N[C@@H]1CCCC[C@H]1NCC#Cc1ccc(F)cc1)C1=CCCC1	ZINC001225638789	1375137470	/nfs/dbraw/zinc/13/74/70/1375137470.db2.gz	MYXHUIGGWAXASL-WOJBJXKFSA-N	0	3	340.442	3.305	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCOc2c(C)cccc2C)CC[C@H]1C	ZINC001132098194	1375146818	/nfs/dbraw/zinc/14/68/18/1375146818.db2.gz	VKGMMTOAJSYVRH-QZTJIDSGSA-N	0	3	330.472	3.227	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCc2ccccc2OCC)CC[C@H]1C	ZINC001132156403	1375174348	/nfs/dbraw/zinc/17/43/48/1375174348.db2.gz	DWZFFAZOCMSJFG-AEFFLSMTSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2cc(OCC)no2)CC[C@@H]1C	ZINC001132174398	1375188491	/nfs/dbraw/zinc/18/84/91/1375188491.db2.gz	UWBRVTNSUCJPQG-HOTGVXAUSA-N	0	3	349.475	3.402	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CC[C@H](C)N(CCc2cnn(CC)c2)C1	ZINC001132217898	1375216094	/nfs/dbraw/zinc/21/60/94/1375216094.db2.gz	IQMQLNJPTVBMJN-FUHWJXTLSA-N	0	3	346.519	3.017	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1CC[C@@H](C)N(CCOCC2CCC2)C1	ZINC001132221561	1375219013	/nfs/dbraw/zinc/21/90/13/1375219013.db2.gz	KFXJECBIGRVDKO-AEFFLSMTSA-N	0	3	336.520	3.375	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CC[C@H](C)N(CCOCCC(C)C)C1	ZINC001132223044	1375219426	/nfs/dbraw/zinc/21/94/26/1375219426.db2.gz	AXVTYUJDQAQKND-RBUKOAKNSA-N	0	3	336.520	3.212	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)Cc2cc(C)ccc2C)CC[C@@H]1C	ZINC001132266254	1375255963	/nfs/dbraw/zinc/25/59/63/1375255963.db2.gz	WFGOABQUAUNDPW-AZUAARDMSA-N	0	3	344.499	3.018	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CC[C@H](C)N(CCOCC(C)C)C2)CC1	ZINC001132292939	1375274146	/nfs/dbraw/zinc/27/41/46/1375274146.db2.gz	WODAJPXKLJXIOJ-HKUYNNGSSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCNCc1ccc(Br)s1	ZINC001132308291	1375287203	/nfs/dbraw/zinc/28/72/03/1375287203.db2.gz	BOVFAOSJLOWLOD-UHFFFAOYSA-N	0	3	345.306	3.319	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)C23CCC(CC2)C3(C)C)CC[C@H]1C	ZINC001132340195	1375319392	/nfs/dbraw/zinc/31/93/92/1375319392.db2.gz	OLCSHRPGJWPNFW-RAJLDSNDSA-N	0	3	348.531	3.375	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COc2ccccc2Cl)CC[C@@H]1C	ZINC001132487319	1375420347	/nfs/dbraw/zinc/42/03/47/1375420347.db2.gz	TUXHEZFUMMNKCY-LSDHHAIUSA-N	0	3	336.863	3.264	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCCc2nc(C(C)C)no2)CC[C@@H]1C	ZINC001132486929	1375420635	/nfs/dbraw/zinc/42/06/35/1375420635.db2.gz	QFOSSGMKPFAWTQ-HOTGVXAUSA-N	0	3	348.491	3.061	20	30		EGEDHN
C=C(C)CCC(=O)NC1CCN(CCOc2cccc(F)c2)CC1	ZINC001227606960	1375452941	/nfs/dbraw/zinc/45/29/41/1375452941.db2.gz	FRNWQYRDPUKRLH-UHFFFAOYSA-N	0	3	334.435	3.141	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)C2(C)CC2)CC1	ZINC001132554888	1375461941	/nfs/dbraw/zinc/46/19/41/1375461941.db2.gz	NMMLGANVCXUWAG-LJQANCHMSA-N	0	3	339.483	3.088	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2N(Cc2ccsc2)C(=O)CCCF)CC1	ZINC001132561932	1375468768	/nfs/dbraw/zinc/46/87/68/1375468768.db2.gz	CPBPISGYJSFUDK-KRWDZBQOSA-N	0	3	348.487	3.314	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1Cl	ZINC001227949357	1375493863	/nfs/dbraw/zinc/49/38/63/1375493863.db2.gz	QQNHJXDSJGTCLS-YCEFEEMOSA-N	0	3	344.886	3.365	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCCNCc1ccc(Br)s1	ZINC001132667842	1375505603	/nfs/dbraw/zinc/50/56/03/1375505603.db2.gz	UUDKOSPMBZXIIT-LLVKDONJSA-N	0	3	345.306	3.319	20	30		EGEDHN
CCCCC(=O)N1CC[C@H](C)[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001132670623	1375507250	/nfs/dbraw/zinc/50/72/50/1375507250.db2.gz	VKILFRUPNHVGFC-YJBOKZPZSA-N	0	3	345.462	3.462	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N[C@@H]1CCCC[C@H]1NCC(=C)Br	ZINC001228036915	1375507754	/nfs/dbraw/zinc/50/77/54/1375507754.db2.gz	YKSFZPSZXXQPJC-PUCGFSNJSA-N	0	3	341.293	3.434	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](C)[C@@H](CNCc2nc(C)c(C)s2)C1	ZINC001132696334	1375518608	/nfs/dbraw/zinc/51/86/08/1375518608.db2.gz	JUHPIYVCTQJADG-BBRMVZONSA-N	0	3	335.517	3.300	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](C)[C@@H](CNCc2cnc(C)o2)C1	ZINC001132843346	1375595561	/nfs/dbraw/zinc/59/55/61/1375595561.db2.gz	LNZGPSOAOMFTSS-QAPCUYQASA-N	0	3	345.487	3.326	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](C)[C@@H](CNCc2nccs2)C1	ZINC001132843203	1375595901	/nfs/dbraw/zinc/59/59/01/1375595901.db2.gz	JGNFDDHYMHUDDT-WBVHZDCISA-N	0	3	347.528	3.486	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](C)[C@@H](CNCc2ocnc2C)C1	ZINC001132846885	1375598828	/nfs/dbraw/zinc/59/88/28/1375598828.db2.gz	NVRPHJRQBJGPDP-HOCLYGCPSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](C)[C@@H](CNCc2ccccc2C#N)C1	ZINC001132865817	1375610889	/nfs/dbraw/zinc/61/08/89/1375610889.db2.gz	SKVIWUGIUAZDCT-PXNSSMCTSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)CC(F)(F)C(F)F	ZINC001228610413	1375615289	/nfs/dbraw/zinc/61/52/89/1375615289.db2.gz	GIOFHSCMKMLDMY-NXEZZACHSA-N	0	3	330.753	3.046	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NC1CCN(CCOc2cccc(F)c2)CC1	ZINC001228749117	1375661991	/nfs/dbraw/zinc/66/19/91/1375661991.db2.gz	PTTHZLGOESJDOL-JKSUJKDBSA-N	0	3	348.462	3.243	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NC1CCN(Cc2ccccc2N(C)C)CC1	ZINC001228760584	1375667453	/nfs/dbraw/zinc/66/74/53/1375667453.db2.gz	MTTWLSMWMRJEBE-SJORKVTESA-N	0	3	343.515	3.291	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC1CCN(C[C@H](O)c2ccc(F)cc2)CC1	ZINC001228795167	1375678880	/nfs/dbraw/zinc/67/88/80/1375678880.db2.gz	RXGOBGUNMGPWAE-BEFAXECRSA-N	0	3	348.462	3.042	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](C)[C@@H](CNCc2cscn2)C1	ZINC001133039134	1375729776	/nfs/dbraw/zinc/72/97/76/1375729776.db2.gz	LNXAXQLADUSGKK-SJORKVTESA-N	0	3	347.528	3.301	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](C)[C@H](CNCc2nc(C)cs2)C1	ZINC001133069890	1375756934	/nfs/dbraw/zinc/75/69/34/1375756934.db2.gz	YYXPYLQTMDOOJT-DOTOQJQBSA-N	0	3	347.528	3.219	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](C)[C@H](CNCc2cc(C3CC3)no2)C1	ZINC001133072885	1375759864	/nfs/dbraw/zinc/75/98/64/1375759864.db2.gz	MEITYQXBWCSONP-NVXWUHKLSA-N	0	3	345.487	3.483	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](C)[C@@H](CNCc3cc(C)no3)C2)CCC1	ZINC001133105498	1375778257	/nfs/dbraw/zinc/77/82/57/1375778257.db2.gz	UMUQBJREKPJCJF-RDJZCZTQSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2cc(C)n(C(C)C)c2C)CC1	ZINC001230204193	1375966998	/nfs/dbraw/zinc/96/69/98/1375966998.db2.gz	XRNHIRKWENBGKH-UHFFFAOYSA-N	0	3	347.503	3.083	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C1(F)CCCC1	ZINC001133399145	1375982000	/nfs/dbraw/zinc/98/20/00/1375982000.db2.gz	FFSFWQZAEPEQLW-UHFFFAOYSA-N	0	3	336.838	3.174	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@H](C)[C@@H](C)C=C	ZINC001133403818	1375988603	/nfs/dbraw/zinc/98/86/03/1375988603.db2.gz	KTHKRWDTUGXSEW-JKSUJKDBSA-N	0	3	332.875	3.350	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1CCCC[C@H]1NCc1cc(C)ccc1F	ZINC001230324821	1375998035	/nfs/dbraw/zinc/99/80/35/1375998035.db2.gz	UWBLNMHUJCBZLA-RTBURBONSA-N	0	3	348.462	3.244	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NC1CCN([C@@H](C)c2ccc(F)cc2)CC1	ZINC001230415816	1376024065	/nfs/dbraw/zinc/02/40/65/1376024065.db2.gz	YXGURTILONJQGC-GJZGRUSLSA-N	0	3	334.435	3.058	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NC1CCN([C@@H](CC)c2ccc(F)cc2)CC1	ZINC001230415147	1376024420	/nfs/dbraw/zinc/02/44/20/1376024420.db2.gz	LLVJSBLVBFWXNM-BEFAXECRSA-N	0	3	348.462	3.449	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)/C=C/c1ccco1	ZINC001133516164	1376051537	/nfs/dbraw/zinc/05/15/37/1376051537.db2.gz	XAGTVFLGBWYLQT-AMRKSYTLSA-N	0	3	341.249	3.074	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)Cc1cccs1	ZINC001133520904	1376055949	/nfs/dbraw/zinc/05/59/49/1376055949.db2.gz	NUQKGIPRKSWBEY-NEPJUHHUSA-N	0	3	345.306	3.072	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)Cc1cccs1	ZINC001133520905	1376055788	/nfs/dbraw/zinc/05/57/88/1376055788.db2.gz	NUQKGIPRKSWBEY-NWDGAFQWSA-N	0	3	345.306	3.072	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1C1CCN(C(=O)CO[C@H](C)CC)CC1	ZINC001230547956	1376067847	/nfs/dbraw/zinc/06/78/47/1376067847.db2.gz	DEMYZVWZMBUYMZ-WBVHZDCISA-N	0	3	342.911	3.257	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1C1CCN(C(=O)CC[C@H](C)OC)CC1	ZINC001230552049	1376073844	/nfs/dbraw/zinc/07/38/44/1376073844.db2.gz	HKBNWZLXVVAZCP-DOTOQJQBSA-N	0	3	342.911	3.257	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)C1CCCCC1	ZINC001133590322	1376107689	/nfs/dbraw/zinc/10/76/89/1376107689.db2.gz	JEFGNGJDILZNAL-OLZOCXBDSA-N	0	3	331.298	3.348	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N1CCC([C@H]2CCCN2CC(=C)Cl)CC1	ZINC001230630879	1376109151	/nfs/dbraw/zinc/10/91/51/1376109151.db2.gz	WMFBWNKEMZGWCB-DOTOQJQBSA-N	0	3	340.895	3.033	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H](C)C[C@H](C)NCc2ccccc2C#N)c(C)o1	ZINC001133641555	1376132294	/nfs/dbraw/zinc/13/22/94/1376132294.db2.gz	UJBKJAASPIUBFT-KBPBESRZSA-N	0	3	339.439	3.455	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)CCc1ccoc1)Cc1cccnc1	ZINC001230726354	1376134584	/nfs/dbraw/zinc/13/45/84/1376134584.db2.gz	HAVYCNBYYJIXEI-UHFFFAOYSA-N	0	3	341.455	3.192	20	30		EGEDHN
C#CCCN(CCCNC(=O)C(F)=C1CCCC1)Cc1cccnc1	ZINC001230731658	1376136635	/nfs/dbraw/zinc/13/66/35/1376136635.db2.gz	GDYFVBXVLNJTOF-UHFFFAOYSA-N	0	3	343.446	3.211	20	30		EGEDHN
C#CCCN(CCCNC(=O)[C@@H](C)CCCC)Cc1cccnc1	ZINC001230749292	1376138997	/nfs/dbraw/zinc/13/89/97/1376138997.db2.gz	ZLADOGJITRITBO-SFHVURJKSA-N	0	3	329.488	3.240	20	30		EGEDHN
C#CCCN(CCCNC(=O)C[C@H]1CCC[C@@H]1C)Cc1cccnc1	ZINC001230767287	1376143927	/nfs/dbraw/zinc/14/39/27/1376143927.db2.gz	PTUNKJZEUANHHI-AZUAARDMSA-N	0	3	341.499	3.240	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCCN(Cc1cccnc1)[C@@H](C)COC	ZINC001230769126	1376145850	/nfs/dbraw/zinc/14/58/50/1376145850.db2.gz	AHMVXVYPNXIXNX-KRWDZBQOSA-N	0	3	347.503	3.027	20	30		EGEDHN
Cc1ccoc1C(=O)N[C@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001133678724	1376149497	/nfs/dbraw/zinc/14/94/97/1376149497.db2.gz	GEKXGGMLYOWECW-HUUCEWRRSA-N	0	3	325.412	3.146	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)CCC1CC1)NCc1cc(F)ccc1C#N	ZINC001133960864	1376285975	/nfs/dbraw/zinc/28/59/75/1376285975.db2.gz	SJMPFOKNOFIADO-ZIAGYGMSSA-N	0	3	331.435	3.260	20	30		EGEDHN
C#Cc1cccc(CN2CC[C@]3(CCN3C(=O)OC(C)(C)C)C2)c1	ZINC001231656157	1376296635	/nfs/dbraw/zinc/29/66/35/1376296635.db2.gz	GALSXVNTAYHZIW-FQEVSTJZSA-N	0	3	326.440	3.253	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H](C)C[C@@H](C)NCc1ccn(C(C)C)n1	ZINC001134118961	1376377795	/nfs/dbraw/zinc/37/77/95/1376377795.db2.gz	JRPKJSJFLTUTPP-SJORKVTESA-N	0	3	332.492	3.031	20	30		EGEDHN
C#CCCCCC(=O)N[C@H](C)C[C@@H](C)NCc1oc(CC)nc1C	ZINC001134119600	1376378744	/nfs/dbraw/zinc/37/87/44/1376378744.db2.gz	UKEZHJILJJTVQN-HUUCEWRRSA-N	0	3	333.476	3.112	20	30		EGEDHN
C=CCN1C(=O)CCC[C@]12CCCN(Cc1ccc(C)nc1C)C2	ZINC001232080654	1376396071	/nfs/dbraw/zinc/39/60/71/1376396071.db2.gz	HBXIUEWBFGUZTO-HXUWFJFHSA-N	0	3	327.472	3.232	20	30		EGEDHN
CCc1[nH]ccc1C(=O)N[C@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001134264463	1376445199	/nfs/dbraw/zinc/44/51/99/1376445199.db2.gz	ALUDMJUVRXRFNK-HUUCEWRRSA-N	0	3	338.455	3.135	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)c1c(C)coc1C	ZINC001134289220	1376460089	/nfs/dbraw/zinc/46/00/89/1376460089.db2.gz	SGZLEELXSQOAKC-NWDGAFQWSA-N	0	3	343.265	3.292	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H](C)C[C@@H](C)NCc1nsc2ccccc21	ZINC001134316668	1376471923	/nfs/dbraw/zinc/47/19/23/1376471923.db2.gz	ALLUWEQVPZVBDB-HUUCEWRRSA-N	0	3	343.496	3.329	20	30		EGEDHN
CCC(CC)n1ccc(CN[C@H](C)C[C@H](C)NC(=O)C#CC2CC2)n1	ZINC001134317482	1376472579	/nfs/dbraw/zinc/47/25/79/1376472579.db2.gz	JQXJLIPTDUXJNK-CVEARBPZSA-N	0	3	344.503	3.031	20	30		EGEDHN
N#Cc1ccc([O-])c(C[NH+]2CCC(N3CCc4ccccc4C3)CC2)c1	ZINC001232678466	1376500372	/nfs/dbraw/zinc/50/03/72/1376500372.db2.gz	HADUGBGMGCMANJ-UHFFFAOYSA-N	0	3	347.462	3.287	20	30		EGEDHN
CCOC(=O)[C@H]1CN(Cc2ccc(C#N)s2)C[C@H]2CCCC[C@@H]12	ZINC001232844661	1376523394	/nfs/dbraw/zinc/52/33/94/1376523394.db2.gz	ZUXTYYCBJHVFNS-XYPHTWIQSA-N	0	3	332.469	3.421	20	30		EGEDHN
C=CCO[C@H]1CO[C@@]2(C1)CCCN(Cc1ccc3ncoc3c1)C2	ZINC001232940804	1376543290	/nfs/dbraw/zinc/54/32/90/1376543290.db2.gz	GPWZGQIBZJIVDX-VQIMIIECSA-N	0	3	328.412	3.154	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H](C)C[C@@H](C)NCc1nc2ccccc2n1C	ZINC001134471223	1376555801	/nfs/dbraw/zinc/55/58/01/1376555801.db2.gz	VMKXFBAZHCZZIG-HZPDHXFCSA-N	0	3	342.487	3.303	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CCN(Cc3ccc(C)c(O)c3)C2)C1	ZINC001233231706	1376594363	/nfs/dbraw/zinc/59/43/63/1376594363.db2.gz	YVOYZXPCRMXLOJ-FQEVSTJZSA-N	0	3	344.455	3.311	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2ccncc2Cl)CCC1	ZINC001134589120	1376612933	/nfs/dbraw/zinc/61/29/33/1376612933.db2.gz	PBABELJRHFRHID-CABCVRRESA-N	0	3	347.890	3.302	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2nc(C)sc2C)CCC1	ZINC001134592389	1376614397	/nfs/dbraw/zinc/61/43/97/1376614397.db2.gz	CSWXPHWNATZJKT-KGLIPLIRSA-N	0	3	347.528	3.326	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)C1(C2CC2)CC1)NCc1cc(F)ccc1C#N	ZINC001134694512	1376665161	/nfs/dbraw/zinc/66/51/61/1376665161.db2.gz	SWOKFEUAMINOSO-ZIAGYGMSSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=CCC[C@@H](C)N1CC[C@H]1CN(C)C(=O)c1coc(C(C)(C)C)n1	ZINC001234265084	1376794310	/nfs/dbraw/zinc/79/43/10/1376794310.db2.gz	HBODPBXIXBQDJH-CABCVRRESA-N	0	3	333.476	3.473	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)CCC(F)F)NCc1cc(F)ccc1C#N	ZINC001135011502	1376844186	/nfs/dbraw/zinc/84/41/86/1376844186.db2.gz	FLUXDFUEZOEESI-VXGBXAGGSA-N	0	3	341.377	3.116	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1ccccc1C#N)NC(=O)C1(CCF)CC1	ZINC001135081473	1376885100	/nfs/dbraw/zinc/88/51/00/1376885100.db2.gz	MVHCTCTYSAKTQN-LSDHHAIUSA-N	0	3	331.435	3.071	20	30		EGEDHN
Cc1cocc1C(=O)N[C@@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001135202234	1376972158	/nfs/dbraw/zinc/97/21/58/1376972158.db2.gz	CJRLXKNTGBWZDL-CABCVRRESA-N	0	3	325.412	3.146	20	30		EGEDHN
CN1CCC[C@](C)(NC(=O)c2ccc(C#C[Si](C)(C)C)cc2)C1	ZINC001189176487	1388472825	/nfs/dbraw/zinc/47/28/25/1388472825.db2.gz	CRUUTMQAGJNFNV-IBGZPJMESA-N	0	3	328.532	3.130	20	30		EGEDHN
CCOc1cc(F)c(F)cc1CN1CCC2SC(=O)C=C2C1	ZINC001238657138	1377000143	/nfs/dbraw/zinc/00/01/43/1377000143.db2.gz	WPNDNMCHPXYYCG-HNNXBMFYSA-N	0	3	325.380	3.138	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1cc(F)ccc1C#N)NC(=O)[C@H]1C[C@H]2C[C@H]2C1	ZINC001135247132	1377000201	/nfs/dbraw/zinc/00/02/01/1377000201.db2.gz	QHLGLPXNZCJWQS-GMBUGEKQSA-N	0	3	343.446	3.116	20	30		EGEDHN
Cc1c(O)cccc1-c1nccnc1C(C#N)C(=O)OC(C)(C)C	ZINC001244956763	1377041201	/nfs/dbraw/zinc/04/12/01/1377041201.db2.gz	MQNJOOSSPDUFEF-CYBMUJFWSA-N	0	3	325.368	3.107	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2oc(C)nc2C)CC1	ZINC001135384125	1377066490	/nfs/dbraw/zinc/06/64/90/1377066490.db2.gz	ZLTLLCYFBVYTEG-KBPBESRZSA-N	0	3	333.476	3.411	20	30		EGEDHN
C[C@@H](CC(=O)NCCNCc1cccc(C#N)c1)c1ccccc1F	ZINC001135391316	1377070470	/nfs/dbraw/zinc/07/04/70/1377070470.db2.gz	UTNSQCTUQZYYAP-HNNXBMFYSA-N	0	3	339.414	3.097	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)C1(CCC)CC1	ZINC001135401830	1377075665	/nfs/dbraw/zinc/07/56/65/1377075665.db2.gz	JVKGOWBIGWQETF-STQMWFEESA-N	0	3	331.298	3.348	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](C)C[C@@H](C)NCc2ccn(CC)n2)CC1	ZINC001135414598	1377081478	/nfs/dbraw/zinc/08/14/78/1377081478.db2.gz	BFXDIVMXJJIQTL-CVEARBPZSA-N	0	3	332.492	3.022	20	30		EGEDHN
C=C[C@@](C)(O)CNC(c1ccc(OC)cc1)c1ccc(OC)cc1	ZINC001252542072	1377090072	/nfs/dbraw/zinc/09/00/72/1377090072.db2.gz	ZKEJATNTNVZRRT-HXUWFJFHSA-N	0	3	327.424	3.320	20	30		EGEDHN
Cc1ccc(Cl)cc1C(=O)NCCNCc1cccc(C#N)c1	ZINC001135501614	1377121112	/nfs/dbraw/zinc/12/11/12/1377121112.db2.gz	XUWQWIPMPXDBND-UHFFFAOYSA-N	0	3	327.815	3.040	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)c1csc(C)c1	ZINC001135690713	1377184941	/nfs/dbraw/zinc/18/49/41/1377184941.db2.gz	KEIMTICSWAEMJD-WDEREUQCSA-N	0	3	345.306	3.452	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)Cc1ccc(Cl)c(F)c1	ZINC001266175150	1377217019	/nfs/dbraw/zinc/21/70/19/1377217019.db2.gz	FOJSXDFELYKIKQ-NSHDSACASA-N	0	3	333.234	3.259	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1ccccc1C#N)NC(=O)C1(C)CC(F)(F)C1	ZINC001135906451	1377258054	/nfs/dbraw/zinc/25/80/54/1377258054.db2.gz	CHMZUSKRQWGGQA-UONOGXRCSA-N	0	3	349.425	3.367	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3nc4ccccc4s3)C2)C1=O	ZINC001136950471	1377444708	/nfs/dbraw/zinc/44/47/08/1377444708.db2.gz	YWRUJXLEMMLZRH-LJQANCHMSA-N	0	3	341.480	3.297	20	30		EGEDHN
C=CCOC(=O)N[C@@H]1CCCN(Cc2cccc3cccnc32)C1	ZINC001137180163	1377492573	/nfs/dbraw/zinc/49/25/73/1377492573.db2.gz	ZNUPDDLPSRPLRQ-QGZVFWFLSA-N	0	3	325.412	3.111	20	30		EGEDHN
C=CCN1C(=O)CCC12CCN(Cc1cnc3ccccc3c1)CC2	ZINC001137279307	1377509362	/nfs/dbraw/zinc/50/93/62/1377509362.db2.gz	JSVDNFFVOYMCIB-UHFFFAOYSA-N	0	3	335.451	3.378	20	30		EGEDHN
O=C1C=C2CN(Cc3c(F)cccc3Br)CCC2S1	ZINC001137464321	1377552325	/nfs/dbraw/zinc/55/23/25/1377552325.db2.gz	WDBCGMHXDUZYFY-CYBMUJFWSA-N	0	3	342.233	3.362	20	30		EGEDHN
C[C@](CNCc1cc(C#N)ccc1F)(NC(=O)CC1CCC1)C1CC1	ZINC001269606592	1377559313	/nfs/dbraw/zinc/55/93/13/1377559313.db2.gz	PELDBYUUCKSJMT-HXUWFJFHSA-N	0	3	343.446	3.262	20	30		EGEDHN
CCC[C@@H](C)CC(=O)N1CC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001189270504	1388504138	/nfs/dbraw/zinc/50/41/38/1388504138.db2.gz	SPTAZMQOXNQQOE-VQIMIIECSA-N	0	3	327.472	3.417	20	30		EGEDHN
O=C1NCC2(CCN(Cc3ccc(C#Cc4ccccc4)cc3)CC2)O1	ZINC001138336064	1377704680	/nfs/dbraw/zinc/70/46/80/1377704680.db2.gz	JHYKLBLVBWIPSL-UHFFFAOYSA-N	0	3	346.430	3.161	20	30		EGEDHN
C#CCOc1ccc(CN2CCC[C@](O)(C(F)(F)F)[C@@H](C)C2)cc1	ZINC001138556008	1377741828	/nfs/dbraw/zinc/74/18/28/1377741828.db2.gz	AUSNMSNNCQSSKF-WMLDXEAASA-N	0	3	341.373	3.224	20	30		EGEDHN
C=CCOC(=O)N1CCCC2(CCN(Cc3c(C)n[nH]c3C)CC2)C1	ZINC001139094523	1377828900	/nfs/dbraw/zinc/82/89/00/1377828900.db2.gz	KCTZHECSYSEULI-UHFFFAOYSA-N	0	3	346.475	3.027	20	30		EGEDHN
Cc1ccc(CN2CCC3(CC(N4CCCC4)=NO3)CC2)cc1C#N	ZINC001139723556	1377941309	/nfs/dbraw/zinc/94/13/09/1377941309.db2.gz	AMHUCJQAGGTHLI-UHFFFAOYSA-N	0	3	338.455	3.031	20	30		EGEDHN
Cc1ccc(CN2CC[C@@]3(C[C@H](OCC4CC4)CO3)C2)cc1C#N	ZINC001139724321	1377941419	/nfs/dbraw/zinc/94/14/19/1377941419.db2.gz	ODPYWUUGIGVBTD-VQTJNVASSA-N	0	3	326.440	3.027	20	30		EGEDHN
C=CCN1C(=O)CCC12CCN(Cc1cc3ccccc3cn1)CC2	ZINC001139996666	1377989289	/nfs/dbraw/zinc/98/92/89/1377989289.db2.gz	OOESUXWGVPOJFG-UHFFFAOYSA-N	0	3	335.451	3.378	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CC[N@@H+](Cc3cc(F)ccc3[O-])C2)C1	ZINC001140057770	1377998250	/nfs/dbraw/zinc/99/82/50/1377998250.db2.gz	LOHNFDVNCWNMQD-IBGZPJMESA-N	0	3	348.418	3.142	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CC[N@H+](Cc3cc(F)ccc3[O-])C2)C1	ZINC001140057770	1377998251	/nfs/dbraw/zinc/99/82/51/1377998251.db2.gz	LOHNFDVNCWNMQD-IBGZPJMESA-N	0	3	348.418	3.142	20	30		EGEDHN
Cc1cc(O[C@@H]2CCCN(Cc3c[nH]c4ccc(C#N)cc34)C2)ncn1	ZINC001140117785	1378012523	/nfs/dbraw/zinc/01/25/23/1378012523.db2.gz	YPKHMVNMEOFXJY-QGZVFWFLSA-N	0	3	347.422	3.181	20	30		EGEDHN
Cn1cnc2cc(CN3CCC(Oc4ccccc4C#N)CC3)ccc21	ZINC001140508527	1378076078	/nfs/dbraw/zinc/07/60/78/1378076078.db2.gz	CWHBSNMYCLEUHD-UHFFFAOYSA-N	0	3	346.434	3.488	20	30		EGEDHN
C=C(C)CN1CC[C@]2(CCN(Cc3cc(OC)ccc3Cl)C2)C1=O	ZINC001273174743	1378091306	/nfs/dbraw/zinc/09/13/06/1378091306.db2.gz	YVTUCDZNTBTGGM-IBGZPJMESA-N	0	3	348.874	3.349	20	30		EGEDHN
N#Cc1cccc(N2CCN(Cc3cccc4ccncc43)CC2)c1	ZINC001140648577	1378105657	/nfs/dbraw/zinc/10/56/57/1378105657.db2.gz	GBUSZPPNMOECSF-UHFFFAOYSA-N	0	3	328.419	3.429	20	30		EGEDHN
CC(C)CCC(=O)N(C)[C@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001277615188	1378236797	/nfs/dbraw/zinc/23/67/97/1378236797.db2.gz	JWQDBEANLDTHGW-QGZVFWFLSA-N	0	3	333.501	3.383	20	30		EGEDHN
CCC[C@H](C)CN1CCc2nc(C(=O)NC3(C#N)CCC3)ccc2C1	ZINC001278146423	1378260346	/nfs/dbraw/zinc/26/03/46/1378260346.db2.gz	MQNHSWHDCVOWRM-HNNXBMFYSA-N	0	3	340.471	3.052	20	30		EGEDHN
C=CCN1C(=O)CCC[C@]12CCCN(Cc1sccc1OC)C2	ZINC001141321113	1378302044	/nfs/dbraw/zinc/30/20/44/1378302044.db2.gz	VNYJOTUOLKJVMG-GOSISDBHSA-N	0	3	334.485	3.290	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)Cc1ccccc1C(F)(F)F	ZINC001142840268	1378494041	/nfs/dbraw/zinc/49/40/41/1378494041.db2.gz	QUMLJVLYQHCCHZ-AWEZNQCLSA-N	0	3	326.362	3.015	20	30		EGEDHN
CCOc1ccc(CN2CCC3SC(=O)C=C3C2)c(F)c1F	ZINC001143270960	1378572634	/nfs/dbraw/zinc/57/26/34/1378572634.db2.gz	BJZGGQMMYQSUNX-CYBMUJFWSA-N	0	3	325.380	3.138	20	30		EGEDHN
C#Cc1ccc(CN2C[C@H](NC(=O)OC(C)(C)C)C[C@H](C)C2)cc1	ZINC001144578810	1378747390	/nfs/dbraw/zinc/74/73/90/1378747390.db2.gz	QLKVOIQYMWWZPA-MAUKXSAKSA-N	0	3	328.456	3.403	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2nccs2)CCCCC1	ZINC001146661854	1378892372	/nfs/dbraw/zinc/89/23/72/1378892372.db2.gz	CTGHLVBDLAYUPT-HZPDHXFCSA-N	0	3	347.528	3.490	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2nccn2CC)CCCC1	ZINC001146832715	1378932156	/nfs/dbraw/zinc/93/21/56/1378932156.db2.gz	XWCWAXJZOVMOMJ-IRXDYDNUSA-N	0	3	346.519	3.412	20	30		EGEDHN
CN(C(=O)CC1CCC1)[C@H](CNCc1cc(C#N)ccc1F)C1CC1	ZINC001283491311	1378983464	/nfs/dbraw/zinc/98/34/64/1378983464.db2.gz	ACXFATCASOMHEG-LJQANCHMSA-N	0	3	343.446	3.214	20	30		EGEDHN
C#CCCCC(=O)N1CC2(C1)CCN([C@@H]1CCc3c1cccc3F)C2	ZINC001147435584	1379021264	/nfs/dbraw/zinc/02/12/64/1379021264.db2.gz	VVJPRNIXZAVCDO-LJQANCHMSA-N	0	3	340.442	3.151	20	30		EGEDHN
C=C(C)CCC(=O)N1CC2(C1)CCN(Cc1ccc(OC)cc1)C2	ZINC001147640049	1379054705	/nfs/dbraw/zinc/05/47/05/1379054705.db2.gz	NRVLPAHQHBHKAF-UHFFFAOYSA-N	0	3	328.456	3.086	20	30		EGEDHN
Cc1ccc([C@@H](C)C(=O)NCCNCc2ccc(F)c(C#N)c2)s1	ZINC001147778728	1379077427	/nfs/dbraw/zinc/07/74/27/1379077427.db2.gz	RHKJVNPISUFGAJ-CYBMUJFWSA-N	0	3	345.443	3.077	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC2(C1)CCN(Cc1cccc(OC)c1)C2	ZINC001148129751	1379122581	/nfs/dbraw/zinc/12/25/81/1379122581.db2.gz	IGZBDGOHZQHZLY-KRWDZBQOSA-N	0	3	342.483	3.332	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC2(C1)CCN(Cc1cccc(OC)c1)C2	ZINC001148357317	1379156094	/nfs/dbraw/zinc/15/60/94/1379156094.db2.gz	INQUQDXPIVSQIZ-UHFFFAOYSA-N	0	3	342.483	3.332	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)C2(C3CCCCC3)CC2)s1	ZINC001149134780	1379330527	/nfs/dbraw/zinc/33/05/27/1379330527.db2.gz	MTJNMXIQOUNLPI-UHFFFAOYSA-N	0	3	331.485	3.186	20	30		EGEDHN
C=CCCC(=O)NC[C@H]1CN(Cc2ccc(CCC)cc2)CCCO1	ZINC001149363231	1379369188	/nfs/dbraw/zinc/36/91/88/1379369188.db2.gz	VNAJVIFGUMTLFS-FQEVSTJZSA-N	0	3	344.499	3.312	20	30		EGEDHN
Cc1nc(-c2ccc3c(c2)CCN3C(=O)[C@H](N)CCCC#N)cs1	ZINC001327855285	1388606664	/nfs/dbraw/zinc/60/66/64/1388606664.db2.gz	BDQZWVBKPPZCIT-OAHLLOKOSA-N	0	3	340.452	3.029	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)c2ccc(F)cc2Cl)ccc1F	ZINC001149740830	1379439215	/nfs/dbraw/zinc/43/92/15/1379439215.db2.gz	IJLBHUMWCKHHJY-UHFFFAOYSA-N	0	3	349.768	3.009	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)Cc2cccc(C(C)C)c2)C1	ZINC001149945329	1379471215	/nfs/dbraw/zinc/47/12/15/1379471215.db2.gz	COJADRIXKUQSMZ-HXUWFJFHSA-N	0	3	344.499	3.136	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@H]1CN(CC2=CCCCC2)CCCO1	ZINC001150091421	1379493593	/nfs/dbraw/zinc/49/35/93/1379493593.db2.gz	MJUDSNWVXKKREQ-FQEVSTJZSA-N	0	3	346.515	3.278	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@@H]1CN(Cc2ccc(C)cc2)CCCO1	ZINC001150140168	1379501358	/nfs/dbraw/zinc/50/13/58/1379501358.db2.gz	QMFNAMLJUZULML-UYAOXDASSA-N	0	3	344.499	3.304	20	30		EGEDHN
C[C@@H]1CCN(Cc2ccccc2)C[C@H]1NC(=O)Cc1cccc(C#N)c1	ZINC001150143984	1379502485	/nfs/dbraw/zinc/50/24/85/1379502485.db2.gz	WAAAUGCPFYIWRY-DYESRHJHSA-N	0	3	347.462	3.128	20	30		EGEDHN
CCCc1cc(C(=O)NCCNCc2ccc(C#N)cc2)sc1C	ZINC001150350152	1379535701	/nfs/dbraw/zinc/53/57/01/1379535701.db2.gz	ZBUKDFCQBPXZJZ-UHFFFAOYSA-N	0	3	341.480	3.400	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)C[C@@H](C)c2ccccc2C)C1	ZINC001150404153	1379549368	/nfs/dbraw/zinc/54/93/68/1379549368.db2.gz	URJZMJAGJJVPIB-RTBURBONSA-N	0	3	344.499	3.272	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2ccc(Cl)o2)CC1	ZINC001150948336	1379637749	/nfs/dbraw/zinc/63/77/49/1379637749.db2.gz	CSJGXTDMOXZNQL-UHFFFAOYSA-N	0	3	340.851	3.110	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@@H]2CCC[C@H]2CC)CC1	ZINC001151294582	1379694697	/nfs/dbraw/zinc/69/46/97/1379694697.db2.gz	MEXPTGPJPXHJAV-QZTJIDSGSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@H](C)CC2CCCC2)CC1	ZINC001151345557	1379702386	/nfs/dbraw/zinc/70/23/86/1379702386.db2.gz	GZCDNYXDGSYAIS-QGZVFWFLSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@H]2CCCC[C@H]2CC)CC1	ZINC001151382131	1379709509	/nfs/dbraw/zinc/70/95/09/1379709509.db2.gz	YJJRBZMSZQOFKT-MSOLQXFVSA-N	0	3	336.520	3.376	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2ccc(OC3CCC3)cc2)c1	ZINC001151707096	1379767937	/nfs/dbraw/zinc/76/79/37/1379767937.db2.gz	AFIRHJJERCOIDM-UHFFFAOYSA-N	0	3	349.434	3.009	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)c1ccsc1	ZINC001151778442	1379779111	/nfs/dbraw/zinc/77/91/11/1379779111.db2.gz	UXTYHVARRUTIHW-CYBMUJFWSA-N	0	3	345.443	3.399	20	30		EGEDHN
C=CC[C@H](C(=O)NCCNCc1ccc(C)nc1C)c1ccccc1	ZINC001151837992	1379793460	/nfs/dbraw/zinc/79/34/60/1379793460.db2.gz	FFRHBRSWSBDXAP-FQEVSTJZSA-N	0	3	337.467	3.264	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)C(=O)NCCNCc1cccnc1C	ZINC001151922978	1379816112	/nfs/dbraw/zinc/81/61/12/1379816112.db2.gz	LFNNMFJLCSQNGV-LJQANCHMSA-N	0	3	337.467	3.031	20	30		EGEDHN
O=C(CC#Cc1ccccc1)NCCNCc1ccc(F)c(Cl)c1	ZINC001151953041	1379824383	/nfs/dbraw/zinc/82/43/83/1379824383.db2.gz	QUVCASQCYGZHFT-UHFFFAOYSA-N	0	3	344.817	3.127	20	30		EGEDHN
C=CCC1(C(=O)NCCNCc2ccc([N+](=O)[O-])cc2)CCCCC1	ZINC001152010712	1379837482	/nfs/dbraw/zinc/83/74/82/1379837482.db2.gz	MNCDUZXCDFYTPN-UHFFFAOYSA-N	0	3	345.443	3.327	20	30		EGEDHN
Cc1ccc(C2(C(=O)NCCNCc3ccc(C#N)cc3)CCC2)cc1	ZINC001152941477	1379997170	/nfs/dbraw/zinc/99/71/70/1379997170.db2.gz	DYSFDBNGXWZQOK-UHFFFAOYSA-N	0	3	347.462	3.194	20	30		EGEDHN
C[C@H](CCc1ccccc1)CC(=O)NCCNCc1ccc(C#N)cc1	ZINC001153214494	1380037585	/nfs/dbraw/zinc/03/75/85/1380037585.db2.gz	MTJVTOJGSIJXAG-GOSISDBHSA-N	0	3	349.478	3.423	20	30		EGEDHN
CCN(Cc1ccc(C(C)C)nc1C)[C@H](C)CNC(=O)C#CC1CC1	ZINC001153232543	1380041264	/nfs/dbraw/zinc/04/12/64/1380041264.db2.gz	HRDNLIMZRQUNMS-MRXNPFEDSA-N	0	3	341.499	3.253	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NC[C@@H](C)N(CC)Cc1ccc(F)cc1	ZINC001153442129	1380077661	/nfs/dbraw/zinc/07/76/61/1380077661.db2.gz	YGLGLOLXTBBQDN-LZQZEXGQSA-N	0	3	348.462	3.134	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@@H](C)N(CC)Cc1cccc(C#N)c1	ZINC001153594262	1380099945	/nfs/dbraw/zinc/09/99/45/1380099945.db2.gz	MEIMDEUDKAHAPX-MRXNPFEDSA-N	0	3	327.472	3.487	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C1(CC)CCC(F)(F)CC1	ZINC001154066129	1380196869	/nfs/dbraw/zinc/19/68/69/1380196869.db2.gz	MKYSEFXVSNWONY-OAHLLOKOSA-N	0	3	328.447	3.442	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)C1(F)CCCC1	ZINC001154099089	1380207280	/nfs/dbraw/zinc/20/72/80/1380207280.db2.gz	AMWWKDQTVHGLMY-CQSZACIVSA-N	0	3	349.425	3.306	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H](C)N(CC)Cc1ccccc1N(C)C	ZINC001154620397	1380319555	/nfs/dbraw/zinc/31/95/55/1380319555.db2.gz	IQTVPNGPDZZWNX-MRXNPFEDSA-N	0	3	331.504	3.291	20	30		EGEDHN
CCN(CC#CCOC)[C@H](C)CNC(=O)CC[C@@H](C)c1ccccc1	ZINC001155644835	1380478037	/nfs/dbraw/zinc/47/80/37/1380478037.db2.gz	QAWGYSHFLHPUAI-RTBURBONSA-N	0	3	344.499	3.047	20	30		EGEDHN
CCCCC[C@H](C(=O)NC[C@@H](C)N(CC)CC#CCOC)C(C)C	ZINC001156276681	1380551621	/nfs/dbraw/zinc/55/16/21/1380551621.db2.gz	GUEJDLCYBWUFDM-MOPGFXCFSA-N	0	3	338.536	3.315	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@H](CC)Cc1ccccc1C	ZINC001156390500	1380569995	/nfs/dbraw/zinc/56/99/95/1380569995.db2.gz	PLSLQTQPMGFNSR-RTBURBONSA-N	0	3	328.500	3.414	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1c(Cl)cccc1Cl	ZINC001156579009	1380596121	/nfs/dbraw/zinc/59/61/21/1380596121.db2.gz	KDVGTWHDYWZCIJ-GFCCVEGCSA-N	0	3	327.255	3.457	20	30		EGEDHN
C#CCCCCC(=O)NCCCNCc1cc(OC)ccc1Cl	ZINC001156816876	1380645482	/nfs/dbraw/zinc/64/54/82/1380645482.db2.gz	RCUPZJTXHVRTOW-UHFFFAOYSA-N	0	3	336.863	3.138	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C[C@@H](C)c1ccc(OC)cc1	ZINC001157035592	1380756206	/nfs/dbraw/zinc/75/62/06/1380756206.db2.gz	VZLJFMVHUAFMII-IAGOWNOFSA-N	0	3	330.472	3.039	20	30		EGEDHN
CCCCC[C@@](C)(CC)C(=O)NC[C@@H](C)N(CC)CC#CCOC	ZINC001157171434	1380793681	/nfs/dbraw/zinc/79/36/81/1380793681.db2.gz	GWHOSEUSCLAHHJ-UYAOXDASSA-N	0	3	338.536	3.459	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)C=C1CCCCC1	ZINC001157641526	1380988031	/nfs/dbraw/zinc/98/80/31/1380988031.db2.gz	COPDWDMXUXEBBF-LJQANCHMSA-N	0	3	334.504	3.392	20	30		EGEDHN
C#CCCCC(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(F)cc1	ZINC001157885618	1381059904	/nfs/dbraw/zinc/05/99/04/1381059904.db2.gz	YZQCWAIXZMFGPR-LJQANCHMSA-N	0	3	330.447	3.442	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1CCCC2(CC2)C1	ZINC001157964506	1381083913	/nfs/dbraw/zinc/08/39/13/1381083913.db2.gz	FJUWWMQBMXPGAG-RTBURBONSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cccc([C@H]2CCOC2)c1	ZINC001158165381	1381146441	/nfs/dbraw/zinc/14/64/41/1381146441.db2.gz	VUORCUCFUOFFAA-VQTJNVASSA-N	0	3	342.483	3.303	20	30		EGEDHN
COc1cc(N2C[C@@H](C)N(Cc3ccccc3)C[C@H]2C)ncc1C#N	ZINC001158518860	1381276935	/nfs/dbraw/zinc/27/69/35/1381276935.db2.gz	LLYFQVBIMYQKBT-HZPDHXFCSA-N	0	3	336.439	3.061	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1c[nH]c(-c2ccccc2)n1	ZINC001158529016	1381282853	/nfs/dbraw/zinc/28/28/53/1381282853.db2.gz	BGHKFKWJCCGBRD-QGZVFWFLSA-N	0	3	338.455	3.189	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H]1CCCc2sc(C)nc21	ZINC001158739500	1381376282	/nfs/dbraw/zinc/37/62/82/1381376282.db2.gz	LVROZGRZLSETIL-CVEARBPZSA-N	0	3	347.528	3.370	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)C[C@H]1OCc2ccccc21	ZINC001158801025	1381405773	/nfs/dbraw/zinc/40/57/73/1381405773.db2.gz	NKECYAFEDAZGCU-IEBWSBKVSA-N	0	3	328.456	3.147	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1snc(Cl)c1Cl	ZINC001328351104	1388727782	/nfs/dbraw/zinc/72/77/82/1388727782.db2.gz	FRENOMSIHZJQSD-ZETCQYMHSA-N	0	3	342.679	3.300	20	30		EGEDHN
C=C(C)CCC(=O)NCCCNCc1cnc(-c2ccccc2)o1	ZINC001159032793	1381525495	/nfs/dbraw/zinc/52/54/95/1381525495.db2.gz	UMHPPSRYCFQKCB-UHFFFAOYSA-N	0	3	327.428	3.294	20	30		EGEDHN
C=CCCC(=O)NCCC1=CCN(CCOc2cccc(C)c2)CC1	ZINC001159538925	1381821443	/nfs/dbraw/zinc/82/14/43/1381821443.db2.gz	RXJNYTMXNIXIBM-UHFFFAOYSA-N	0	3	342.483	3.478	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCC1=CCN(Cc2ccc(C(F)F)cc2)CC1	ZINC001159587292	1381836744	/nfs/dbraw/zinc/83/67/44/1381836744.db2.gz	MXTBLFBQCVXHPI-CQSZACIVSA-N	0	3	347.409	3.422	20	30		EGEDHN
C#CCCCC(=O)NCCC1=CCN(Cc2ccc(C)nc2C)CC1	ZINC001159957910	1381950218	/nfs/dbraw/zinc/95/02/18/1381950218.db2.gz	TWXAGSVKEZOADG-UHFFFAOYSA-N	0	3	339.483	3.140	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc([C@H]3C[C@@H]3C)o2)CC1	ZINC001160121315	1382003932	/nfs/dbraw/zinc/00/39/32/1382003932.db2.gz	WOAMMNTVLVIXCT-RDJZCZTQSA-N	0	3	326.440	3.178	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc([C@@H]3C[C@H]3C)o2)CC1	ZINC001160121314	1382004035	/nfs/dbraw/zinc/00/40/35/1382004035.db2.gz	WOAMMNTVLVIXCT-NVXWUHKLSA-N	0	3	326.440	3.178	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2scc(C)c2Cl)CC1	ZINC001160229512	1382041181	/nfs/dbraw/zinc/04/11/81/1382041181.db2.gz	YXUVZCNGDXJXFA-UHFFFAOYSA-N	0	3	336.888	3.485	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2nsc3ccccc32)CC1	ZINC001160228505	1382040189	/nfs/dbraw/zinc/04/01/89/1382040189.db2.gz	LBDYTHJWSICLTR-UHFFFAOYSA-N	0	3	327.453	3.234	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cccc(OCCC)c2)CC1	ZINC001160279228	1382059868	/nfs/dbraw/zinc/05/98/68/1382059868.db2.gz	LSRMMUDYFCWZSU-UHFFFAOYSA-N	0	3	340.467	3.251	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)N1CCC[C@H](C(=O)OC(C)(C)C)C1	ZINC001160476723	1382118480	/nfs/dbraw/zinc/11/84/80/1382118480.db2.gz	LHHXBGZHYFHYNX-HOTGVXAUSA-N	0	3	338.492	3.031	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H]2C[C@]2(C)c2ccccc2)CC1	ZINC001160729495	1382180443	/nfs/dbraw/zinc/18/04/43/1382180443.db2.gz	ZPWYGMNVGUGWCU-RBBKRZOGSA-N	0	3	336.479	3.126	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc(C)nc2C2CC2)CC1	ZINC001160799111	1382200694	/nfs/dbraw/zinc/20/06/94/1382200694.db2.gz	YWGQBPTWYBUWQS-UHFFFAOYSA-N	0	3	337.467	3.043	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc3ccc(OC)cc3[nH]2)CC1	ZINC001160828493	1382210996	/nfs/dbraw/zinc/21/09/96/1382210996.db2.gz	OSFPOADDSDQZTG-UHFFFAOYSA-N	0	3	339.439	3.115	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2c(C)cc(F)cc2C)CC1	ZINC001160846192	1382215408	/nfs/dbraw/zinc/21/54/08/1382215408.db2.gz	XPHATDGQXBIVGV-UHFFFAOYSA-N	0	3	328.431	3.218	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCC1=CCN(Cc2cccnc2C)CC1	ZINC001160942457	1382245434	/nfs/dbraw/zinc/24/54/34/1382245434.db2.gz	YYKHFMQISSMYMY-DLBZAZTESA-N	0	3	341.499	3.487	20	30		EGEDHN
N#Cc1cnc2cc[nH]c(NC3CCN(Cc4ccc(O)cc4)CC3)c1-2	ZINC001161136567	1382314476	/nfs/dbraw/zinc/31/44/76/1382314476.db2.gz	HDFBNXSFSUWCKZ-UHFFFAOYSA-N	0	3	347.422	3.217	20	30		EGEDHN
CCC1(C(=O)NCCC2=CCN(Cc3ccc(C#N)cc3)CC2)CC1	ZINC001161160983	1382320056	/nfs/dbraw/zinc/32/00/56/1382320056.db2.gz	CBJBPERLYAYJFJ-UHFFFAOYSA-N	0	3	337.467	3.387	20	30		EGEDHN
COc1cccc(CN2CC[C@H](Nc3ccc(CC#N)c(C)n3)C2)c1	ZINC001161193076	1382336728	/nfs/dbraw/zinc/33/67/28/1382336728.db2.gz	QBJPHVUGNIJQGF-SFHVURJKSA-N	0	3	336.439	3.151	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)Cc2cccc(Cl)c2F)CC1	ZINC001161320090	1382370362	/nfs/dbraw/zinc/37/03/62/1382370362.db2.gz	BVJDZWUIBGDUFS-UHFFFAOYSA-N	0	3	336.838	3.346	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)Cc2c[nH]c3ccc(F)cc23)CC1	ZINC001161349496	1382378669	/nfs/dbraw/zinc/37/86/69/1382378669.db2.gz	NPZSYNGIQLKXLK-UHFFFAOYSA-N	0	3	341.430	3.174	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C[C@@H]2CCO[C@H](C(C)C)C2)CC1	ZINC001161656055	1382472592	/nfs/dbraw/zinc/47/25/92/1382472592.db2.gz	PTCLYNFFXGBUCN-MOPGFXCFSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H](CC)Oc2ccccc2F)CC1	ZINC001161699571	1382484322	/nfs/dbraw/zinc/48/43/22/1382484322.db2.gz	VFBGFKZQURCCBG-GOSISDBHSA-N	0	3	346.446	3.308	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cnc(-c3ccco3)s2)CC1	ZINC001161749827	1382494711	/nfs/dbraw/zinc/49/47/11/1382494711.db2.gz	PJCHRXCQLGXTAN-UHFFFAOYSA-N	0	3	343.452	3.341	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc(C3CCCC3)no2)CC1	ZINC001161898740	1382543921	/nfs/dbraw/zinc/54/39/21/1382543921.db2.gz	DBCYUGWYQSVQLX-UHFFFAOYSA-N	0	3	329.444	3.270	20	30		EGEDHN
C#CCN1CCC(CNC(=O)[C@@H](C)CCCCCC)(COC)CC1	ZINC001162539109	1382784073	/nfs/dbraw/zinc/78/40/73/1382784073.db2.gz	GRFYJRUPZCGLFU-SFHVURJKSA-N	0	3	336.520	3.071	20	30		EGEDHN
N#Cc1ccc(CNCCN(CCc2ccccc2)C(=O)C2CC2)cc1	ZINC001162655200	1382822590	/nfs/dbraw/zinc/82/25/90/1382822590.db2.gz	JRVDSEFDNGBGIZ-UHFFFAOYSA-N	0	3	347.462	3.129	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H](C)C1CCC1	ZINC001162841289	1382891906	/nfs/dbraw/zinc/89/19/06/1382891906.db2.gz	PSMZUOYDJKVSCN-SFHVURJKSA-N	0	3	326.484	3.107	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C(C)(C)C1CCC1	ZINC001162871361	1382900727	/nfs/dbraw/zinc/90/07/27/1382900727.db2.gz	ODSWDCXQAWVVNC-UHFFFAOYSA-N	0	3	326.484	3.107	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CCCC[C@H]1C	ZINC001162906546	1382911397	/nfs/dbraw/zinc/91/13/97/1382911397.db2.gz	NHTICAZDQGDQNH-CTNGQTDRSA-N	0	3	340.511	3.497	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@]12C[C@H]1CCCC2	ZINC001162924119	1382917607	/nfs/dbraw/zinc/91/76/07/1382917607.db2.gz	IDMFQJHWMROBRQ-IFMALSPDSA-N	0	3	338.495	3.251	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1C[C@@]1(CC)C(C)C	ZINC001162970864	1382933049	/nfs/dbraw/zinc/93/30/49/1382933049.db2.gz	NOFGCIIUPRQFQA-UNMCSNQZSA-N	0	3	340.511	3.353	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1cccc2c1CCC2	ZINC001163007293	1382946454	/nfs/dbraw/zinc/94/64/54/1382946454.db2.gz	PUJCYLFZXVIQFU-UHFFFAOYSA-N	0	3	346.474	3.083	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)[C@@H]1CCCC[C@H]1C1CC1	ZINC001163171581	1382982502	/nfs/dbraw/zinc/98/25/02/1382982502.db2.gz	KXITXGVPKDWJDF-VQTJNVASSA-N	0	3	339.483	3.371	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@H]1CCCC[C@@H]1C1CC1	ZINC001163173257	1382984001	/nfs/dbraw/zinc/98/40/01/1382984001.db2.gz	WTIMTWNYXDLKOA-CABCVRRESA-N	0	3	343.309	3.207	20	30		EGEDHN
N#Cc1c[nH]c2nc(Cl)cc(N[C@@H]3CNCc4ccsc43)c12	ZINC001163221912	1382996352	/nfs/dbraw/zinc/99/63/52/1382996352.db2.gz	ZKBBPPXAHBMZSK-LLVKDONJSA-N	0	3	329.816	3.406	20	30		EGEDHN
CC/C=C(\C)C(=O)NCCC1(CNCc2cc(C#N)ccc2F)CC1	ZINC001163676820	1383103332	/nfs/dbraw/zinc/10/33/32/1383103332.db2.gz	LEHKRSFVXHKPDR-SYZQJQIISA-N	0	3	343.446	3.430	20	30		EGEDHN
N#Cc1ccc2ccnc(N3CCCN(Cc4ccncc4)CC3)c2c1	ZINC001163826640	1383125966	/nfs/dbraw/zinc/12/59/66/1383125966.db2.gz	HDOXMOJRGVPGRG-UHFFFAOYSA-N	0	3	343.434	3.214	20	30		EGEDHN
CC(C)=C(F)C(=O)NCCC1(CNCc2ccc(C#N)cc2F)CC1	ZINC001164070651	1383152816	/nfs/dbraw/zinc/15/28/16/1383152816.db2.gz	MIPHPSMIUSRAOK-UHFFFAOYSA-N	0	3	347.409	3.337	20	30		EGEDHN
Cc1cc(C(=O)NCCC2(CNCc3ccccc3C#N)CC2)co1	ZINC001164263643	1383172763	/nfs/dbraw/zinc/17/27/63/1383172763.db2.gz	XUXZBNQILWIUKS-UHFFFAOYSA-N	0	3	337.423	3.150	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCC1(CNCc2cnc(C)o2)CC1	ZINC001164649926	1383213959	/nfs/dbraw/zinc/21/39/59/1383213959.db2.gz	YOZFAKJCPOMQBT-UHFFFAOYSA-N	0	3	331.460	3.128	20	30		EGEDHN
Cc1cc(C(=O)NCCCNCc2cc(C#N)ccc2F)ccc1F	ZINC001165560410	1383310836	/nfs/dbraw/zinc/31/08/36/1383310836.db2.gz	XPROOLVRRRUKNT-UHFFFAOYSA-N	0	3	343.377	3.055	20	30		EGEDHN
N#Cc1ccccc1CNCC1(CCNC(=O)C2(CCF)CC2)CC1	ZINC001166371583	1383416373	/nfs/dbraw/zinc/41/63/73/1383416373.db2.gz	IFIQAAHNTNGWJY-UHFFFAOYSA-N	0	3	343.446	3.074	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCC1(CNCc2cc(OC)ccn2)CC1	ZINC001166546324	1383436716	/nfs/dbraw/zinc/43/67/16/1383436716.db2.gz	UKMDIBUDLLTCKF-UHFFFAOYSA-N	0	3	345.487	3.069	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCC1(CNCc2c(C)noc2C)CC1	ZINC001166693186	1383461841	/nfs/dbraw/zinc/46/18/41/1383461841.db2.gz	GWSBICKGPSBWDN-KBPBESRZSA-N	0	3	333.476	3.126	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)C2(CC)CCC2)CC1	ZINC001166704789	1383464400	/nfs/dbraw/zinc/46/44/00/1383464400.db2.gz	ZKGRXFFKHYRMPR-UHFFFAOYSA-N	0	3	343.309	3.351	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCC1(CNCc2conc2CC)CC1	ZINC001167019308	1383520633	/nfs/dbraw/zinc/52/06/33/1383520633.db2.gz	ZKUNUOACFKNZPU-SFHVURJKSA-N	0	3	333.476	3.215	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cccc(OCC)c2)CC1	ZINC001167328554	1383599703	/nfs/dbraw/zinc/59/97/03/1383599703.db2.gz	JVPDJIVHHZVUQL-UHFFFAOYSA-N	0	3	336.863	3.328	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)CO[C@H]2CCC[C@@H](C)C2)CC1	ZINC001167362625	1383610523	/nfs/dbraw/zinc/61/05/23/1383610523.db2.gz	OLABNEHNELKTEO-ZBFHGGJFSA-N	0	3	342.911	3.210	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)[C@@H](C)CC(C)C)CC1	ZINC001167556249	1383666676	/nfs/dbraw/zinc/66/66/76/1383666676.db2.gz	FSTXHHYTGZOLFA-ZDUSSCGKSA-N	0	3	345.325	3.453	20	30		EGEDHN
C[C@@H](CC1CCCC1)C(=O)NCCCNCc1ccccc1C#N	ZINC001167557822	1383668168	/nfs/dbraw/zinc/66/81/68/1383668168.db2.gz	WVEOHUMZVHHYQS-INIZCTEOSA-N	0	3	327.472	3.371	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)[C@@H]2C[C@@]2(C)CC)CC1	ZINC001167583368	1383678645	/nfs/dbraw/zinc/67/86/45/1383678645.db2.gz	KUCMFCHSCBBARI-DZGCQCFKSA-N	0	3	343.309	3.207	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ncoc2C(C)(C)C)CC1	ZINC001167675688	1383707093	/nfs/dbraw/zinc/70/70/93/1383707093.db2.gz	JGFYPHYHYUKGMT-UHFFFAOYSA-N	0	3	339.867	3.214	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)C[C@H](C)C2CC2)CC1	ZINC001168355371	1383881758	/nfs/dbraw/zinc/88/17/58/1383881758.db2.gz	YFCNRBSELLYQPK-LBPRGKRZSA-N	0	3	343.309	3.207	20	30		EGEDHN
C[C@@H](COCC1CCCCC1)N[C@@H](C)C(=O)Nc1cccc(C#N)c1	ZINC001308093387	1384090162	/nfs/dbraw/zinc/09/01/62/1384090162.db2.gz	UEQHDFWBBFGMEA-HOTGVXAUSA-N	0	3	343.471	3.460	20	30		EGEDHN
CCN(CC)C(=O)C[C@@H](C)NCc1ccc(C#N)cc1C(F)(F)F	ZINC001169459987	1384150295	/nfs/dbraw/zinc/15/02/95/1384150295.db2.gz	SYXRERBNSCVHQX-GFCCVEGCSA-N	0	3	341.377	3.314	20	30		EGEDHN
CCCSCC(=O)N[C@H](C)CCCCNCc1ccccc1C#N	ZINC001169471086	1384151354	/nfs/dbraw/zinc/15/13/54/1384151354.db2.gz	WMECUJOGADUOJE-MRXNPFEDSA-N	0	3	347.528	3.466	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)c1cncs1	ZINC001169480756	1384152981	/nfs/dbraw/zinc/15/29/81/1384152981.db2.gz	RSHVLQPKGNVQDV-CQSZACIVSA-N	0	3	342.468	3.093	20	30		EGEDHN
N#Cc1csc(CN[C@@H]2CCCN(C(=O)c3ccccc3)C2)c1	ZINC001169757157	1384183239	/nfs/dbraw/zinc/18/32/39/1384183239.db2.gz	OIXKEVOANPYAOI-MRXNPFEDSA-N	0	3	325.437	3.014	20	30		EGEDHN
CN(C)/C=N/c1ccc(NC[C@@H](CO)Cc2ccccc2)cc1C#N	ZINC001169904218	1384196808	/nfs/dbraw/zinc/19/68/08/1384196808.db2.gz	MRXCKSCLCLCBAX-BDFKGGEMSA-N	0	3	336.439	3.043	20	30		EGEDHN
C(#Cc1ccccc1)CNc1cccc2cc([C@H]3CNCCO3)cn21	ZINC001170429958	1384317139	/nfs/dbraw/zinc/31/71/39/1384317139.db2.gz	TUOUAEDKASHJHE-HXUWFJFHSA-N	0	3	331.419	3.064	20	30		EGEDHN
CCOC(=O)C1=C(Nc2ccc([C@H](C#N)C(C)C)cc2)CCNC1	ZINC001170516876	1384333617	/nfs/dbraw/zinc/33/36/17/1384333617.db2.gz	IZRRCIQIFXVOOE-MRXNPFEDSA-N	0	3	327.428	3.172	20	30		EGEDHN
C=CCOc1ccc(-n2c(-c3ccccc3)cnc2[C@H](C)N)nc1C#N	ZINC001170680593	1384364299	/nfs/dbraw/zinc/36/42/99/1384364299.db2.gz	AILIXTNKWBKBAV-AWEZNQCLSA-N	0	3	345.406	3.390	20	30		EGEDHN
C[C@H](N)c1ncc(-c2ccccc2)n1-c1ncc2c(c1C#N)CCC2	ZINC001170680987	1384364407	/nfs/dbraw/zinc/36/44/07/1384364407.db2.gz	KUFXWAICMQGFMA-ZDUSSCGKSA-N	0	3	329.407	3.314	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1CC[C@@H](C)[C@](O)(C(F)(F)F)C1	ZINC001171204689	1384467864	/nfs/dbraw/zinc/46/78/64/1384467864.db2.gz	ZTEGMUDTOCAGHO-IOASZLSFSA-N	0	3	326.362	3.124	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1C[C@@H]2C[C@]2(NC(=O)OC(C)(C)C)C1	ZINC001171210495	1384469606	/nfs/dbraw/zinc/46/96/06/1384469606.db2.gz	UJNVEHQAVLCQIY-LIVBEALHSA-N	0	3	341.455	3.088	20	30		EGEDHN
Cc1cncnc1OC1CCN([C@H](C)Cc2cccc(C#N)c2)CC1	ZINC001171233070	1384475829	/nfs/dbraw/zinc/47/58/29/1384475829.db2.gz	ZAVKUBXVAMLNOX-MRXNPFEDSA-N	0	3	336.439	3.131	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@H](CNC(=O)CCC3CCC3)C2)c1	ZINC001316632635	1384495597	/nfs/dbraw/zinc/49/55/97/1384495597.db2.gz	RVTVYHZOIOJXCU-SAABIXHNSA-N	0	3	343.446	3.262	20	30		EGEDHN
COc1ccccc1N1CCN([C@H](C)Cc2ccc(C#N)cc2)CC1	ZINC001172307416	1384765178	/nfs/dbraw/zinc/76/51/78/1384765178.db2.gz	DXSQGGXREHOCEV-QGZVFWFLSA-N	0	3	335.451	3.320	20	30		EGEDHN
CCCCCCC[C@H](CC)N1CCCn2nnc(CNC(C)=O)c2C1	ZINC001172354147	1384776627	/nfs/dbraw/zinc/77/66/27/1384776627.db2.gz	FIVHVNRLYFJZLR-KRWDZBQOSA-N	0	3	349.523	3.259	20	30		EGEDHN
C[C@H](CCCC#N)N1C[C@@H](N(C)Cc2ccco2)[C@H]2OCCC[C@H]2C1	ZINC001172493948	1384804188	/nfs/dbraw/zinc/80/41/88/1384804188.db2.gz	DTSCGONQRBVCTL-BWPNAZKDSA-N	0	3	345.487	3.273	20	30		EGEDHN
C[C@@H](Cc1ccc(OC(F)(F)F)cc1)NC(=N)c1ccc(F)cn1	ZINC001173084631	1384910787	/nfs/dbraw/zinc/91/07/87/1384910787.db2.gz	BVFMBKPDDMTNNH-JTQLQIEISA-N	0	3	341.308	3.456	20	30		EGEDHN
CCCCCCCCC[C@@H](CCC)N1CC(N2CCNC(=O)C2)C1	ZINC001173285117	1384951979	/nfs/dbraw/zinc/95/19/79/1384951979.db2.gz	NQXXOLIBHJLXJP-GOSISDBHSA-N	0	3	337.552	3.412	20	30		EGEDHN
CCCCC(=O)N[C@H](C)[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001317202847	1384980832	/nfs/dbraw/zinc/98/08/32/1384980832.db2.gz	WJEJARDRXHWPHX-VQIMIIECSA-N	0	3	327.472	3.465	20	30		EGEDHN
C[C@H](CCCCNCc1cc(F)ccc1C#N)NC(=O)CCCF	ZINC001174759378	1385145505	/nfs/dbraw/zinc/14/55/05/1385145505.db2.gz	WJMKMRQFTPGPAP-CQSZACIVSA-N	0	3	337.414	3.212	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@H](C)CCCCNCc1cc2n(n1)CCC2	ZINC001174849624	1385159642	/nfs/dbraw/zinc/15/96/42/1385159642.db2.gz	PNDKAKKQWXNWJN-DLBZAZTESA-N	0	3	346.519	3.196	20	30		EGEDHN
C=CCCCC(=O)N[C@@H](C)CCCCNCc1nccn1C(F)F	ZINC001174985919	1385179233	/nfs/dbraw/zinc/17/92/33/1385179233.db2.gz	CXYWHFSUUOZRBG-AWEZNQCLSA-N	0	3	342.434	3.399	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H](C)CCCCNCc2cc(C)n(C)n2)CC1	ZINC001175081424	1385191480	/nfs/dbraw/zinc/19/14/80/1385191480.db2.gz	GHPZLUSPHSWZLN-INIZCTEOSA-N	0	3	346.519	3.240	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1cccc2ccccc21	ZINC001175125854	1385199033	/nfs/dbraw/zinc/19/90/33/1385199033.db2.gz	PSPUDWZPLASPIH-UHFFFAOYSA-N	0	3	347.256	3.458	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)C[C@@H](C)c1ccccc1	ZINC001175317997	1385250889	/nfs/dbraw/zinc/25/08/89/1385250889.db2.gz	UDPYKOAVFKNNRG-CYBMUJFWSA-N	0	3	339.277	3.185	20	30		EGEDHN
N#Cc1cc(I)c(Nc2ncc[nH]2)cc1Cl	ZINC001176086107	1385480552	/nfs/dbraw/zinc/48/05/52/1385480552.db2.gz	ZPRFBRQIEQWCOZ-UHFFFAOYSA-N	0	3	344.543	3.283	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1cccc2cnccc21	ZINC001176102772	1385484750	/nfs/dbraw/zinc/48/47/50/1385484750.db2.gz	LGLUMCPCOINZPR-UHFFFAOYSA-N	0	3	344.418	3.016	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@]1(C)CC=C(C)CC1	ZINC001176751769	1385682160	/nfs/dbraw/zinc/68/21/60/1385682160.db2.gz	FNYADJUZIRNPHE-OAHLLOKOSA-N	0	3	329.282	3.127	20	30		EGEDHN
C=C[C@H](C(=O)NCCCNCc1ncc(C)s1)c1ccccc1	ZINC001176778924	1385693410	/nfs/dbraw/zinc/69/34/10/1385693410.db2.gz	QXHFQDOYMCSREB-INIZCTEOSA-N	0	3	329.469	3.017	20	30		EGEDHN
C[C@H]1C[C@H](C(=O)NCCCNCc2ccccc2C#N)C[C@@H](C)C1	ZINC001177136503	1385829004	/nfs/dbraw/zinc/82/90/04/1385829004.db2.gz	OGUCPCRGEDFDPA-MNZLEMJZSA-N	0	3	327.472	3.226	20	30		EGEDHN
CC#CC[NH2+]CCCN(CC1CCCC1)C(=O)c1ccccc1[O-]	ZINC001177221176	1385872604	/nfs/dbraw/zinc/87/26/04/1385872604.db2.gz	CHUJMJNDXJEQPP-UHFFFAOYSA-N	0	3	328.456	3.028	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)C[C@H]1CCOC1	ZINC001177271170	1385892338	/nfs/dbraw/zinc/89/23/38/1385892338.db2.gz	XSPBNOBLGIMDJC-QGZVFWFLSA-N	0	3	342.911	3.164	20	30		EGEDHN
C=CCC1(C(=O)NCCCNCc2ccc(C#N)cc2F)CCCC1	ZINC001177552481	1385994896	/nfs/dbraw/zinc/99/48/96/1385994896.db2.gz	HOVNHXCJAHKCLW-UHFFFAOYSA-N	0	3	343.446	3.430	20	30		EGEDHN
C=C(Br)CNCC1(NC(=O)CCC(C)C)CCCC1	ZINC001698624514	1406265278	/nfs/dbraw/zinc/26/52/78/1406265278.db2.gz	UCYNVQGNBHSEOP-UHFFFAOYSA-N	0	3	331.298	3.350	20	30		EGEDHN
N#CC(Cc1cccs1)C(=O)Nc1ncccc1OC(F)(F)F	ZINC001177903279	1386078391	/nfs/dbraw/zinc/07/83/91/1386078391.db2.gz	GQQWSHXYQNDVEX-VIFPVBQESA-N	0	3	341.314	3.363	20	30		EGEDHN
CC[C@@H](SC)C(=O)NCCCCCCNCc1ccccc1C#N	ZINC001178204294	1386159365	/nfs/dbraw/zinc/15/93/65/1386159365.db2.gz	RJKZUZHUHPFQAK-GOSISDBHSA-N	0	3	347.528	3.466	20	30		EGEDHN
C#CCCCCC(=O)NCCCCCCNCc1nc(C)cs1	ZINC001178254230	1386173978	/nfs/dbraw/zinc/17/39/78/1386173978.db2.gz	USEROKBZMCZWIE-UHFFFAOYSA-N	0	3	335.517	3.411	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](NCC#Cc2ccc(Cl)cc2)[C@@H]1C	ZINC001178320302	1386187714	/nfs/dbraw/zinc/18/77/14/1386187714.db2.gz	QGVBHIMMTFWVAX-YJBOKZPZSA-N	0	3	330.859	3.237	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2oc(CCC)nc2C)CCCC1	ZINC001698635300	1406280202	/nfs/dbraw/zinc/28/02/02/1406280202.db2.gz	KQZJGKBBKSHGST-UHFFFAOYSA-N	0	3	339.867	3.320	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CC[C@H](NCc2ccccc2F)[C@@H]1C)OCC	ZINC001178818728	1386317053	/nfs/dbraw/zinc/31/70/53/1386317053.db2.gz	WXFXNBZLAYEANX-ZYSHUDEJSA-N	0	3	348.462	3.276	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](NCc2c(C)nsc2C)[C@@H]1C	ZINC001179314703	1386448469	/nfs/dbraw/zinc/44/84/69/1386448469.db2.gz	ZKDNMTYRBLTBHB-YJBOKZPZSA-N	0	3	347.528	3.423	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccc(F)cc2)CCN1C(=O)CCCC1CC1	ZINC001179370345	1386465398	/nfs/dbraw/zinc/46/53/98/1386465398.db2.gz	QPCYBTWXFRHVCM-JXFKEZNVSA-N	0	3	342.458	3.337	20	30		EGEDHN
C=CCCC1(C(=O)NCCCCCCNCc2cnc(C)o2)CC1	ZINC001179481868	1386494049	/nfs/dbraw/zinc/49/40/49/1386494049.db2.gz	NELVGINOSCOCBH-UHFFFAOYSA-N	0	3	333.476	3.496	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCCCCCNCc1nnc(C(C)C)[nH]1	ZINC001179482346	1386495277	/nfs/dbraw/zinc/49/52/77/1386495277.db2.gz	TZKCQBCHTWZKDT-LJQANCHMSA-N	0	3	349.523	3.297	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)CCCC(C)=O)CCCC[C@@H]1C	ZINC001698657348	1406307870	/nfs/dbraw/zinc/30/78/70/1406307870.db2.gz	QYIXGJFNWXTHKS-SUMWQHHRSA-N	0	3	328.884	3.153	20	30		EGEDHN
C=CCCOCC(=O)N1CC[C@H](NCc2sccc2Cl)[C@@H]1C	ZINC001180253669	1386747268	/nfs/dbraw/zinc/74/72/68/1386747268.db2.gz	HCBMDBQGBOSMNH-JSGCOSHPSA-N	0	3	342.892	3.073	20	30		EGEDHN
C[C@@H](CNCc1ccc(F)c(C#N)c1)NC(=O)CC(C)(C)C1CC1	ZINC001321843572	1386994602	/nfs/dbraw/zinc/99/46/02/1386994602.db2.gz	WGRZXOKVMQVEAB-ZDUSSCGKSA-N	0	3	331.435	3.118	20	30		EGEDHN
CCC(=CC(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1)CC	ZINC001181988836	1387088412	/nfs/dbraw/zinc/08/84/12/1387088412.db2.gz	GHQMXOMMUZHAPF-QGZVFWFLSA-N	0	3	329.419	3.134	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2csc(C)n2)C1	ZINC001182208135	1387120754	/nfs/dbraw/zinc/12/07/54/1387120754.db2.gz	PDEDRHUFPZFHPY-FZKQIMNGSA-N	0	3	335.517	3.238	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](O)c2ccccc2Br)cc1F	ZINC001182344412	1387153269	/nfs/dbraw/zinc/15/32/69/1387153269.db2.gz	JPRFLSHWKGZBJN-MRXNPFEDSA-N	0	3	349.203	3.283	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](NCc2ccc(C)nc2C)C1	ZINC001182841326	1387233515	/nfs/dbraw/zinc/23/35/15/1387233515.db2.gz	KCIZERYTGGPKNH-LJQANCHMSA-N	0	3	327.472	3.157	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](N[C@H]2CCc3c2cc(F)cc3F)C1	ZINC001182933992	1387248784	/nfs/dbraw/zinc/24/87/84/1387248784.db2.gz	ZHHNKXNZEGURKQ-KDOFPFPSSA-N	0	3	334.410	3.499	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](NCc2ccccc2OC2CC2)C1	ZINC001182940078	1387249323	/nfs/dbraw/zinc/24/93/23/1387249323.db2.gz	FNIMRUBLVJGFMF-QGZVFWFLSA-N	0	3	328.456	3.275	20	30		EGEDHN
N#Cc1ccc(C(=O)NC2CCN(Cc3ccccc3)CC2)c(F)c1	ZINC001336422965	1389096050	/nfs/dbraw/zinc/09/60/50/1389096050.db2.gz	FFVXDNDVHIFNLS-UHFFFAOYSA-N	0	3	337.398	3.092	20	30		EGEDHN
COC[C@@H](C)Oc1ccc(CNCc2cccc(OCC#N)c2)cc1	ZINC001329543132	1389150229	/nfs/dbraw/zinc/15/02/29/1389150229.db2.gz	KCBZSJPNZXIMOB-MRXNPFEDSA-N	0	3	340.423	3.292	20	30		EGEDHN
COc1ccc(CN[C@H](C)CN(C)C(=O)C2(C)CCCC2)cc1C#N	ZINC001331520531	1389781812	/nfs/dbraw/zinc/78/18/12/1389781812.db2.gz	UAOMSNPOWVKSRT-OAHLLOKOSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=CCn1c([C@H](C)CCC#N)nnc1N1CCN(C(C)(C)CC)CC1	ZINC001339500060	1390047184	/nfs/dbraw/zinc/04/71/84/1390047184.db2.gz	NIHXONUUMRLQTP-MRXNPFEDSA-N	0	3	344.507	3.182	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N1CCO[C@H](c2ccc(F)c(Cl)c2)C1	ZINC001339899127	1390185079	/nfs/dbraw/zinc/18/50/79/1390185079.db2.gz	NSDVMMYPXXBIHX-CVEARBPZSA-N	0	3	340.826	3.063	20	30		EGEDHN
C=C(Br)CNC[C@@H](NC(=O)C1CC2(CC2)C1)C(C)(C)C	ZINC001332857124	1390201941	/nfs/dbraw/zinc/20/19/41/1390201941.db2.gz	LGVKYPYAOQCVJL-CYBMUJFWSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N(C)Cc1cc(Br)ccc1F	ZINC001341519855	1390497143	/nfs/dbraw/zinc/49/71/43/1390497143.db2.gz	BSMGAAYSVNBZME-AWEZNQCLSA-N	0	3	343.240	3.230	20	30		EGEDHN
C[C@@H](Sc1ccc(F)cc1)C(=O)C(C#N)C(=O)NC1CCCC1	ZINC001342011895	1390561510	/nfs/dbraw/zinc/56/15/10/1390561510.db2.gz	XWPKJLYYLHIJGQ-ABAIWWIYSA-N	0	3	334.416	3.074	20	30		EGEDHN
C=C(C)Cn1c(N2CCN(C3CCCC3)CC2)nnc1C(C)(F)F	ZINC001342648542	1390636347	/nfs/dbraw/zinc/63/63/47/1390636347.db2.gz	AVUOXUNCNLKGCF-UHFFFAOYSA-N	0	3	339.434	3.031	20	30		EGEDHN
CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)[C@H](N)CCCC#N	ZINC001343446314	1390714707	/nfs/dbraw/zinc/71/47/07/1390714707.db2.gz	GJUHJMQFVTWHKK-CQSZACIVSA-N	0	3	327.350	3.075	20	30		EGEDHN
Cc1ccc(C(=O)NCC(=O)C(C#N)c2nc(C(C)C)cs2)s1	ZINC001344007314	1390749655	/nfs/dbraw/zinc/74/96/55/1390749655.db2.gz	PBUWJTXYDRQIOX-NSHDSACASA-N	0	3	347.465	3.243	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)Cc1ccc(Br)cc1	ZINC001344875206	1390821149	/nfs/dbraw/zinc/82/11/49/1390821149.db2.gz	PIBILSWBQZTVIK-ZDUSSCGKSA-N	0	3	332.201	3.084	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1	ZINC001346095200	1390906963	/nfs/dbraw/zinc/90/69/63/1390906963.db2.gz	AKHXWZCGCNXHFY-QJPTWQEYSA-N	0	3	333.313	3.300	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCCC[C@@H]1CNCc1cccnc1	ZINC001480345464	1392697669	/nfs/dbraw/zinc/69/76/69/1392697669.db2.gz	JYDKGLBHGPJJQU-LJQANCHMSA-N	0	3	327.472	3.321	20	30		EGEDHN
CC(F)(F)CC(=O)NC1CCC(NCc2ccccc2C#N)CC1	ZINC001480407729	1392744462	/nfs/dbraw/zinc/74/44/62/1392744462.db2.gz	FHRROVUSKNYXOG-UHFFFAOYSA-N	0	3	335.398	3.121	20	30		EGEDHN
C[C@H](CNC(=O)c1ccc2cc[nH]c2c1)NCc1ccc(C#N)s1	ZINC001480541834	1392785810	/nfs/dbraw/zinc/78/58/10/1392785810.db2.gz	HOVJZEBOMVSINT-GFCCVEGCSA-N	0	3	338.436	3.009	20	30		EGEDHN
CC(C)C[C@H](CNCc1ccc(C#N)s1)NC(=O)CC1(C)CC1	ZINC001698875721	1406600034	/nfs/dbraw/zinc/60/00/34/1406600034.db2.gz	OBSYHBDWSYFTKX-CQSZACIVSA-N	0	3	333.501	3.430	20	30		EGEDHN
CCC(C)(C)CC(=O)NC[C@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC001481093597	1393117731	/nfs/dbraw/zinc/11/77/31/1393117731.db2.gz	FZXGVFWOJFQFMS-GOSISDBHSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2ncccc2C)CCCC[C@@H]1C	ZINC001481957840	1394619671	/nfs/dbraw/zinc/61/96/71/1394619671.db2.gz	SFYYBTGJEUCAHX-KSSFIOAISA-N	0	3	335.879	3.411	20	30		EGEDHN
C=C(Br)CN[C@H](CNC(=O)CCC1CCC1)C(C)C	ZINC001698962187	1406716866	/nfs/dbraw/zinc/71/68/66/1406716866.db2.gz	WWLGMTGXHPFLPQ-CQSZACIVSA-N	0	3	331.298	3.206	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)C1=CCCC1)NCc1ccc(C#N)cc1F	ZINC001482524301	1395070896	/nfs/dbraw/zinc/07/08/96/1395070896.db2.gz	BDBAAHDBKLHBKE-GOSISDBHSA-N	0	3	329.419	3.038	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1ccc2scnc2c1)C(C)C	ZINC001482564996	1395091268	/nfs/dbraw/zinc/09/12/68/1395091268.db2.gz	ZDTJALYUCNSGSF-AWEZNQCLSA-N	0	3	337.876	3.393	20	30		EGEDHN
C=C(Cl)CN(CC1CC1)C1CCN(C(=O)[C@H]2CC2(F)F)CC1	ZINC001483815724	1395101616	/nfs/dbraw/zinc/10/16/16/1395101616.db2.gz	AGIQZDQHVJGNKQ-CQSZACIVSA-N	0	3	332.822	3.097	20	30		EGEDHN
C[C@H](CNC(=O)c1ccc(Cl)cc1)N(C)Cc1cccc(C#N)c1	ZINC001485374884	1395853010	/nfs/dbraw/zinc/85/30/10/1395853010.db2.gz	MEHKPOGETRCWHC-CQSZACIVSA-N	0	3	341.842	3.462	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccc(Cl)cc1)N(C)Cc1cccc(C#N)c1	ZINC001485374883	1395854134	/nfs/dbraw/zinc/85/41/34/1395854134.db2.gz	MEHKPOGETRCWHC-AWEZNQCLSA-N	0	3	341.842	3.462	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)CC[C@@H](C)OC)CC1	ZINC001505395859	1396283854	/nfs/dbraw/zinc/28/38/54/1396283854.db2.gz	ZRELAFFZCOGSSZ-OAHLLOKOSA-N	0	3	330.900	3.115	20	30		EGEDHN
N#Cc1cccc(C[NH2+]CC2(NC(=O)c3ccccc3[O-])CCCC2)c1	ZINC001495128556	1396519699	/nfs/dbraw/zinc/51/96/99/1396519699.db2.gz	YCVKYRIUYXZARP-UHFFFAOYSA-N	0	3	349.434	3.096	20	30		EGEDHN
Cc1cc(C)c(C(=O)N[C@H](C)CN(C)Cc2cccc(C#N)c2)s1	ZINC001498294046	1396961741	/nfs/dbraw/zinc/96/17/41/1396961741.db2.gz	OVEZDBCNSVYWHE-CQSZACIVSA-N	0	3	341.480	3.487	20	30		EGEDHN
Cc1cccc(C(=O)NCC[C@@H](C)NCc2cc(C#N)ccc2F)c1	ZINC001690830189	1404766766	/nfs/dbraw/zinc/76/67/66/1404766766.db2.gz	VJJJWROTGDGTEN-OAHLLOKOSA-N	0	3	339.414	3.304	20	30		EGEDHN
Cc1cscc1C(=O)NCC[C@H](C)NCc1ccccc1C#N	ZINC001690837724	1404770009	/nfs/dbraw/zinc/77/00/09/1404770009.db2.gz	QBJFOOZAPUAWAZ-AWEZNQCLSA-N	0	3	327.453	3.226	20	30		EGEDHN
CCCN(CCNC(=O)[C@H]1CC12CCC2)Cc1ccc(F)c(C#N)c1	ZINC001691193655	1405132041	/nfs/dbraw/zinc/13/20/41/1405132041.db2.gz	ASOFYHCVHLZPMP-QGZVFWFLSA-N	0	3	343.446	3.216	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)C2(C)CCCCC2)C1	ZINC001691520731	1405318293	/nfs/dbraw/zinc/31/82/93/1405318293.db2.gz	UCCDJAKYADVIHK-HDJSIYSDSA-N	0	3	343.309	3.350	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1CCN(Cc2cccc3cccnc32)C1	ZINC001732152205	1428395572	/nfs/dbraw/zinc/39/55/72/1428395572.db2.gz	JFMJSNKVOHQEJR-IBGZPJMESA-N	0	3	335.451	3.119	20	30		EGEDHN
C=C(Br)CNCC1(NC(=O)C[C@H](C)C2CC2)CCCC1	ZINC001732236934	1428482882	/nfs/dbraw/zinc/48/28/82/1428482882.db2.gz	HHPDKSSRZRXFKY-LBPRGKRZSA-N	0	3	343.309	3.350	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)c1ccc(Cl)cc1	ZINC001732369161	1428551563	/nfs/dbraw/zinc/55/15/63/1428551563.db2.gz	GZOXBAIEEZRQRZ-CQSZACIVSA-N	0	3	341.842	3.367	20	30		EGEDHN
CC1(C(=O)NCC2(NCc3ccc(C#N)cc3F)CCCC2)CC1	ZINC001732391993	1428561048	/nfs/dbraw/zinc/56/10/48/1428561048.db2.gz	AIHNVELAEGPMKS-UHFFFAOYSA-N	0	3	329.419	3.016	20	30		EGEDHN
Cc1sccc1C(=O)N[C@@H](C)CN(C)Cc1cccc(C#N)c1	ZINC001699448119	1412784150	/nfs/dbraw/zinc/78/41/50/1412784150.db2.gz	OOTSPZYWQDOQFQ-ZDUSSCGKSA-N	0	3	327.453	3.179	20	30		EGEDHN
Cc1cccc(C)c1C(=O)N[C@H](C)CN(C)Cc1cccc(C#N)c1	ZINC001699460031	1412811546	/nfs/dbraw/zinc/81/15/46/1412811546.db2.gz	KRRQFUOCFMZXHO-QGZVFWFLSA-N	0	3	335.451	3.425	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)CC3CCCCC3)CC2)cc1	ZINC001699642913	1413023986	/nfs/dbraw/zinc/02/39/86/1413023986.db2.gz	ZPIHUXSDAMYEEX-UHFFFAOYSA-N	0	3	325.456	3.267	20	30		EGEDHN
C[C@@]1(CNCc2ccccc2C#N)CCN(C(=O)CC2CCC2)C1	ZINC001699833526	1413262162	/nfs/dbraw/zinc/26/21/62/1413262162.db2.gz	FZSXZWSUIIAVBW-FQEVSTJZSA-N	0	3	325.456	3.077	20	30		EGEDHN
CCC[C@@H](C)C(=O)NCC1(NCc2ccc(OC)c(C#N)c2)CCC1	ZINC001700147481	1413568517	/nfs/dbraw/zinc/56/85/17/1413568517.db2.gz	ZJMFXQWRNDGXOS-OAHLLOKOSA-N	0	3	343.471	3.132	20	30		EGEDHN
CCC(C)(C)C(=O)N(C)[C@@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001700729351	1414391994	/nfs/dbraw/zinc/39/19/94/1414391994.db2.gz	JKOXTOGTYIKECG-SFHVURJKSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC(C)CC(=O)N[C@@H](C)[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001713270847	1417882594	/nfs/dbraw/zinc/88/25/94/1417882594.db2.gz	FMAXMLRCKFDZSF-QFBILLFUSA-N	0	3	327.472	3.321	20	30		EGEDHN
CCN(CCNC(=O)C(C)(C)C1CCC1)Cc1ccc(C#N)cc1	ZINC001713489498	1418186760	/nfs/dbraw/zinc/18/67/60/1418186760.db2.gz	XEXYJAHVFKKNNI-UHFFFAOYSA-N	0	3	327.472	3.323	20	30		EGEDHN
CCN(CCNC(=O)[C@@H](C)Cc1ccccc1)Cc1ccc(C#N)cc1	ZINC001713497666	1418210419	/nfs/dbraw/zinc/21/04/19/1418210419.db2.gz	VEADZQXJJNULRN-SFHVURJKSA-N	0	3	349.478	3.375	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](NC(=O)C(C2CC2)C2CC2)C2CC2)s1	ZINC001733187592	1429289242	/nfs/dbraw/zinc/28/92/42/1429289242.db2.gz	PACJMDPZIWFFMJ-KRWDZBQOSA-N	0	3	343.496	3.040	20	30		EGEDHN
Cc1ccc(F)cc1C(=O)NC[C@H](C)NCc1ccc(F)c(C#N)c1	ZINC001714258134	1419042382	/nfs/dbraw/zinc/04/23/82/1419042382.db2.gz	MHXHZCFWFOJHRW-ZDUSSCGKSA-N	0	3	343.377	3.053	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1CC[C@H](NC(=O)CCC2CC2)CC1	ZINC001714297281	1419076155	/nfs/dbraw/zinc/07/61/55/1419076155.db2.gz	OOEVFCBCXOZEDP-WGSAOQKQSA-N	0	3	325.456	3.265	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)c1c(C)cccc1C	ZINC001714492821	1419216414	/nfs/dbraw/zinc/21/64/14/1419216414.db2.gz	WQPRDNDBPFOOHN-CQSZACIVSA-N	0	3	339.277	3.310	20	30		EGEDHN
CC(C)SCC(=O)N1CC[C@H](NCc2ccccc2C#N)[C@H](C)C1	ZINC001714998225	1419730156	/nfs/dbraw/zinc/73/01/56/1419730156.db2.gz	GBFHCEMVGFQQHY-QAPCUYQASA-N	0	3	345.512	3.026	20	30		EGEDHN
CCCC1(C(=O)N2CC[C@H](NCc3ccccc3C#N)[C@H](C)C2)CC1	ZINC001715064218	1419802041	/nfs/dbraw/zinc/80/20/41/1419802041.db2.gz	XBWMFENYJIJDSI-APWZRJJASA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)CCOc2ccccc2)CCCC1	ZINC001715104225	1419845653	/nfs/dbraw/zinc/84/56/53/1419845653.db2.gz	OOKCGEUIZCCCFP-UHFFFAOYSA-N	0	3	336.863	3.227	20	30		EGEDHN
C=C(Br)CNC[C@@](C)(NC(=O)CCC1(C)CC1)C1CC1	ZINC001715118102	1419863550	/nfs/dbraw/zinc/86/35/50/1419863550.db2.gz	GBYDAOOYJSDZJM-MRXNPFEDSA-N	0	3	343.309	3.350	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H]2COc3ccccc3C2)CCCC1	ZINC001715303901	1420012313	/nfs/dbraw/zinc/01/23/13/1420012313.db2.gz	PHDCLTNPTRLZBD-MRXNPFEDSA-N	0	3	348.874	3.009	20	30		EGEDHN
CC1(CC(=O)N[C@@H]2CCC[C@H]2CNCc2ccccc2C#N)CC1	ZINC001715566857	1420256979	/nfs/dbraw/zinc/25/69/79/1420256979.db2.gz	KLODQOLRPJDWSX-ZWKOTPCHSA-N	0	3	325.456	3.123	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)NC(=O)Cc1cccc(Cl)c1	ZINC001715993023	1420448146	/nfs/dbraw/zinc/44/81/46/1420448146.db2.gz	MFQIEZWEKLLADW-LBPRGKRZSA-N	0	3	347.871	3.110	20	30		EGEDHN
Cc1scc(C(=O)N[C@@H](C)CN(C)Cc2ccc(C#N)cc2)c1C	ZINC001716021470	1420476631	/nfs/dbraw/zinc/47/66/31/1420476631.db2.gz	HQKNUENBPCVKPT-ZDUSSCGKSA-N	0	3	341.480	3.487	20	30		EGEDHN
C[C@H](CN(C)Cc1cccc(C#N)c1)NC(=O)c1c[nH]c2ccccc21	ZINC001716486700	1420705478	/nfs/dbraw/zinc/70/54/78/1420705478.db2.gz	XDWUSBQGSZSDST-OAHLLOKOSA-N	0	3	346.434	3.290	20	30		EGEDHN
Cc1ncsc1CN(CCNC(=O)[C@H](C)C#N)C1CCCCCC1	ZINC001733275462	1429438504	/nfs/dbraw/zinc/43/85/04/1429438504.db2.gz	KRRZAZCTEPDXTK-CQSZACIVSA-N	0	3	348.516	3.252	20	30		EGEDHN
C=C(Cl)CN(C)CCCN(C)C(=O)c1cc(-c2ccccc2)[nH]n1	ZINC001717208154	1421179393	/nfs/dbraw/zinc/17/93/93/1421179393.db2.gz	FASCKZHYKMOHBV-UHFFFAOYSA-N	0	3	346.862	3.223	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)[C@H](C)C(F)(F)F)CC1	ZINC001717356104	1421291282	/nfs/dbraw/zinc/29/12/82/1421291282.db2.gz	MJPBZYUIFVALKE-LBPRGKRZSA-N	0	3	340.817	3.498	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)[C@H](CCC)OC)CC1	ZINC001717356105	1421291252	/nfs/dbraw/zinc/29/12/52/1421291252.db2.gz	MOXWBCAWEDVDSN-INIZCTEOSA-N	0	3	330.900	3.115	20	30		EGEDHN
CCC(C)(C)C(=O)N(C)[C@@H](CNCc1cc(C#N)ccc1F)C1CC1	ZINC001717736582	1421601296	/nfs/dbraw/zinc/60/12/96/1421601296.db2.gz	UJGVWSSIMXTQMX-SFHVURJKSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC(C)CCC(=O)N1CC[C@](C)(CNCc2ccccc2C#N)C1	ZINC001733417330	1429622047	/nfs/dbraw/zinc/62/20/47/1429622047.db2.gz	GNHJKFKSTPDFJW-HXUWFJFHSA-N	0	3	327.472	3.323	20	30		EGEDHN
CCC(C)(C)C(=O)N1CCC[C@@H]1CNCC#Cc1ccc(F)cc1	ZINC001723937030	1424608264	/nfs/dbraw/zinc/60/82/64/1424608264.db2.gz	CBRWAEOHNRHGQM-GOSISDBHSA-N	0	3	330.447	3.194	20	30		EGEDHN
C[C@@H](CN(C)C(=O)CC(C)(C)C1CC1)NCc1ccc(F)c(C#N)c1	ZINC001725478306	1426152902	/nfs/dbraw/zinc/15/29/02/1426152902.db2.gz	AAJVEJYTFMIQAA-AWEZNQCLSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC(C)(CC(=O)NC[C@H]1CCN(Cc2ccc(C#N)cc2)C1)C1CC1	ZINC001731848576	1428074912	/nfs/dbraw/zinc/07/49/12/1428074912.db2.gz	ZWNXAXIOWRYPBF-GOSISDBHSA-N	0	3	339.483	3.323	20	30		EGEDHN
CCC1(C(=O)NC[C@H]2CCN(Cc3ccc(C#N)cc3)C2)CCCC1	ZINC001731855636	1428089555	/nfs/dbraw/zinc/08/95/55/1428089555.db2.gz	CBIFHPFEYHUUPS-LJQANCHMSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=C(Br)CNC[C@@H](C1CC1)N(C)C(=O)C1CCCCC1	ZINC001734292462	1438023150	/nfs/dbraw/zinc/02/31/50/1438023150.db2.gz	ONRCKTJKZAXNAJ-HNNXBMFYSA-N	0	3	343.309	3.302	20	30		EGEDHN
C=C(Cl)CNC[C@@H](NC(=O)c1ccn2c(C)cnc2c1)C(C)(C)C	ZINC001734559591	1438157833	/nfs/dbraw/zinc/15/78/33/1438157833.db2.gz	CYPQEBXQWSMLRZ-OAHLLOKOSA-N	0	3	348.878	3.129	20	30		EGEDHN
C[C@H](NCC#Cc1ccccc1)[C@H]1CCCCN1C(=O)CCCF	ZINC001752144530	1440145473	/nfs/dbraw/zinc/14/54/73/1440145473.db2.gz	QRHNVLFTWQIBRX-PKOBYXMFSA-N	0	3	330.447	3.147	20	30		EGEDHN
CCN(CC#Cc1ccc(F)cc1)CCCNC(=O)[C@@H]1CC12CCC2	ZINC001752214712	1440155602	/nfs/dbraw/zinc/15/56/02/1440155602.db2.gz	CERJUIPJWOSZPM-IBGZPJMESA-N	0	3	342.458	3.196	20	30		EGEDHN
CC#CCN(CCCNC(=O)C(C)(C)c1cccc(F)c1)C1CC1	ZINC001752274931	1440163493	/nfs/dbraw/zinc/16/34/93/1440163493.db2.gz	RKBHQXRVESKMNH-UHFFFAOYSA-N	0	3	330.447	3.097	20	30		EGEDHN
C=C(C)CN1CCN(CCCNC(=O)CCC2CCCCC2)CC1	ZINC001752357214	1440172113	/nfs/dbraw/zinc/17/21/13/1440172113.db2.gz	OURZPVTXHVTGCS-UHFFFAOYSA-N	0	3	335.536	3.047	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCN2CCN(CCCC3CCCC3)CC2)C1	ZINC001752372530	1440172360	/nfs/dbraw/zinc/17/23/60/1440172360.db2.gz	FRRJVWFZKKGNGI-UHFFFAOYSA-N	0	3	347.547	3.047	20	30		EGEDHN
C=CCN1CCC(N(CCC)C(=O)c2ccnn2[C@H](C)CC)CC1	ZINC001752440066	1440181068	/nfs/dbraw/zinc/18/10/68/1440181068.db2.gz	QHTHMBDMDXLQBY-MRXNPFEDSA-N	0	3	332.492	3.357	20	30		EGEDHN
CC1(CCC(=O)NC[C@H](NCC#Cc2ccc(F)cc2)C2CC2)CC1	ZINC001752492060	1440187007	/nfs/dbraw/zinc/18/70/07/1440187007.db2.gz	XWCPJTXMXVWRTI-IBGZPJMESA-N	0	3	342.458	3.242	20	30		EGEDHN
O=C(N[C@H]1C[C@H](NCC#Cc2cccc(Cl)c2)C1)C1(F)CCCC1	ZINC001752638953	1440197574	/nfs/dbraw/zinc/19/75/74/1440197574.db2.gz	GLGOVGCSBPZZCA-QAQDUYKDSA-N	0	3	348.849	3.211	20	30		EGEDHN
O=C(N[C@H]1C[C@H](NCC#Cc2ccccc2)C1)[C@@H]1CC[C@@H]2C[C@@H]2CC1	ZINC001752647809	1440197884	/nfs/dbraw/zinc/19/78/84/1440197884.db2.gz	UCSGWZHEOJHCQW-GZYGRNMYSA-N	0	3	336.479	3.101	20	30		EGEDHN
CCC[C@H](CC)C(=O)N[C@H]1C[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001752672644	1440198950	/nfs/dbraw/zinc/19/89/50/1440198950.db2.gz	FUNSMOIUVQRMQG-WDSOQIARSA-N	0	3	330.447	3.240	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)C[C@H](C)c2ccc(OC)cc2)C1	ZINC001752687233	1440199993	/nfs/dbraw/zinc/19/99/93/1440199993.db2.gz	JYDQYKZRHNTVEH-RCBQFDQVSA-N	0	3	336.863	3.178	20	30		EGEDHN
CC(C)(C)/C=C\C(=O)N[C@H]1C[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001752719437	1440203694	/nfs/dbraw/zinc/20/36/94/1440203694.db2.gz	BNZZICQTRGEIAT-DMSKUMDMSA-N	0	3	328.431	3.016	20	30		EGEDHN
O=C(N[C@H]1C[C@@H](NCC#Cc2cccc(Cl)c2)C1)C1(F)CCCC1	ZINC001752740691	1440204422	/nfs/dbraw/zinc/20/44/22/1440204422.db2.gz	GLGOVGCSBPZZCA-CALCHBBNSA-N	0	3	348.849	3.211	20	30		EGEDHN
C#CCC1(C(=O)N[C@H]2C[C@@H](NCc3oc(C)nc3C)C2)CCCCC1	ZINC001752775884	1440206756	/nfs/dbraw/zinc/20/67/56/1440206756.db2.gz	ZGLZKZWODWOHSB-CALCHBBNSA-N	0	3	343.471	3.002	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@H]1CCCN(Cc2c(C)onc2CC)C1	ZINC001752786061	1440211365	/nfs/dbraw/zinc/21/13/65/1440211365.db2.gz	JZFGZAUHUMHHSL-DLBZAZTESA-N	0	3	347.503	3.476	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)CCCc2sccc2C)C1	ZINC001752788824	1440212795	/nfs/dbraw/zinc/21/27/95/1440212795.db2.gz	SARUVSZHDRLESD-QGZVFWFLSA-N	0	3	332.513	3.231	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@@H](CNCc2ccccc2C#N)C1	ZINC001752808270	1440216230	/nfs/dbraw/zinc/21/62/30/1440216230.db2.gz	XWSWRUKTRUDVCU-KRWDZBQOSA-N	0	3	339.483	3.489	20	30		EGEDHN
C#CCCCC(=O)NC[C@H]1CCCCN1Cc1ccc(COC)cc1	ZINC001752818333	1440219186	/nfs/dbraw/zinc/21/91/86/1440219186.db2.gz	AFQIPKFHHLTEGB-HXUWFJFHSA-N	0	3	342.483	3.107	20	30		EGEDHN
C=CCOCCN1CCCC[C@H]1CNC(=O)C12CCC(CC1)C2(C)C	ZINC001752823021	1440221838	/nfs/dbraw/zinc/22/18/38/1440221838.db2.gz	SJXTXXJJHZANRK-WBTXTPOCSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H](C)NCc1ccccc1OC1CC1	ZINC001752891622	1440241113	/nfs/dbraw/zinc/24/11/13/1440241113.db2.gz	NSBYNXMEPIBIAE-OAHLLOKOSA-N	0	3	330.472	3.424	20	30		EGEDHN
Cc1cc(C(=O)NC[C@@H](C)NCc2ccc(F)c(C#N)c2)ccc1F	ZINC001752897415	1440242026	/nfs/dbraw/zinc/24/20/26/1440242026.db2.gz	ZLKOJSLKAKKQFS-CYBMUJFWSA-N	0	3	343.377	3.053	20	30		EGEDHN
CC1=CC[C@@](C)(C(=O)NC[C@H](C)NCc2ccc(C#N)c(F)c2)CC1	ZINC001752920781	1440248484	/nfs/dbraw/zinc/24/84/84/1440248484.db2.gz	GMVTWKDFJMWSSV-MGPUTAFESA-N	0	3	343.446	3.428	20	30		EGEDHN
CC[C@@H](C)CC(=O)N1CC[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001752936772	1440250493	/nfs/dbraw/zinc/25/04/93/1440250493.db2.gz	VVZVGBCAQGFETL-HUUCEWRRSA-N	0	3	331.435	3.072	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N1CC[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001752950051	1440251966	/nfs/dbraw/zinc/25/19/66/1440251966.db2.gz	RTKSFTSBFOFEST-UDCCBSLUSA-N	0	3	341.430	3.158	20	30		EGEDHN
CC#CCN(C)[C@@H]1CCCN(C(=O)c2ccc(F)c(Cl)c2F)C1	ZINC001752997386	1440262834	/nfs/dbraw/zinc/26/28/34/1440262834.db2.gz	UYWCCPPXIZVNIT-GFCCVEGCSA-N	0	3	340.801	3.178	20	30		EGEDHN
CCN(CCNC(=O)C#CC(C)(C)C)[C@H]1CCc2c1cc(F)cc2F	ZINC001753081462	1440293911	/nfs/dbraw/zinc/29/39/11/1440293911.db2.gz	GNQAORVPGQVXLC-SFHVURJKSA-N	0	3	348.437	3.440	20	30		EGEDHN
CCN(CCNC(=O)c1cc2ccccc2[nH]1)Cc1cccc(C#N)c1	ZINC001753094338	1440301493	/nfs/dbraw/zinc/30/14/93/1440301493.db2.gz	HWRZSJMWIIVCRW-UHFFFAOYSA-N	0	3	346.434	3.291	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC[C@H]1CCCN1Cc1ccc(C)cc1	ZINC001753099918	1440303937	/nfs/dbraw/zinc/30/39/37/1440303937.db2.gz	YZTUQTWZGOBDKG-PKOBYXMFSA-N	0	3	330.472	3.057	20	30		EGEDHN
C#CCCCC(=O)NC[C@H]1CCCN1CCOc1ccc(Cl)cc1	ZINC001753105965	1440306217	/nfs/dbraw/zinc/30/62/17/1440306217.db2.gz	SXEMMIQDAAAOJP-QGZVFWFLSA-N	0	3	348.874	3.103	20	30		EGEDHN
O=C(C#CC1CC1)NC[C@H]1CCN([C@H]2CCc3c2cccc3Cl)C1	ZINC001753123589	1440314436	/nfs/dbraw/zinc/31/44/36/1440314436.db2.gz	FDYNRZHLMIOUPP-BEFAXECRSA-N	0	3	342.870	3.179	20	30		EGEDHN
CC#CCN(CCC)CCNC(=O)c1cccc2c1CCCCC2	ZINC001753144917	1440323789	/nfs/dbraw/zinc/32/37/89/1440323789.db2.gz	NGTLMLIBMLFHRZ-UHFFFAOYSA-N	0	3	326.484	3.421	20	30		EGEDHN
CCCN(CCNC(=O)C12CCC(CC1)C2)Cc1ccc(C#N)cc1	ZINC001753145553	1440324195	/nfs/dbraw/zinc/32/41/95/1440324195.db2.gz	MHTYOSYZCKEKBL-UHFFFAOYSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=CCCC(=O)N(C)CCNCc1cc(F)cc(Br)c1	ZINC001753174719	1440336536	/nfs/dbraw/zinc/33/65/36/1440336536.db2.gz	NPALTKHJDUCVNI-UHFFFAOYSA-N	0	3	343.240	3.102	20	30		EGEDHN
CN(CCNCc1ccc(C#N)cc1)C(=O)c1cc2ccccc2o1	ZINC001753257837	1440343753	/nfs/dbraw/zinc/34/37/53/1440343753.db2.gz	KVJUIVBBLQUHQO-UHFFFAOYSA-N	0	3	333.391	3.166	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC([C@@H](C)NCc2cnc(C)o2)CC1	ZINC001753275624	1440346145	/nfs/dbraw/zinc/34/61/45/1440346145.db2.gz	SZIIFSGCZRPDLD-CQSZACIVSA-N	0	3	333.476	3.302	20	30		EGEDHN
C=CCN[C@@H](CNC(=O)c1ncoc1C)c1ccc(C(C)C)cc1	ZINC001753294882	1440351930	/nfs/dbraw/zinc/35/19/30/1440351930.db2.gz	WZLXQQDSPWDYGQ-KRWDZBQOSA-N	0	3	327.428	3.353	20	30		EGEDHN
C=C(C)CN[C@@H](CNC(=O)c1cccc2[nH]cnc21)c1ccccc1	ZINC001753311244	1440356557	/nfs/dbraw/zinc/35/65/57/1440356557.db2.gz	KEMPJDATKUYHGB-SFHVURJKSA-N	0	3	334.423	3.200	20	30		EGEDHN
C=CCOCC(=O)N(CCC)[C@H]1CCN(Cc2ccccc2C)C1	ZINC001753315096	1440359158	/nfs/dbraw/zinc/35/91/58/1440359158.db2.gz	STEXEYFCTXQPCS-IBGZPJMESA-N	0	3	330.472	3.011	20	30		EGEDHN
C#CCCN1CC[C@H](N(CCC)C(=O)c2cc(F)cc(Cl)c2)C1	ZINC001753329112	1440368181	/nfs/dbraw/zinc/36/81/81/1440368181.db2.gz	UZPKVLLNELEJKA-KRWDZBQOSA-N	0	3	336.838	3.429	20	30		EGEDHN
CC(C)[C@H](F)C(=O)NCC[C@H]1CCN(Cc2ccc(F)c(C#N)c2)C1	ZINC001753333100	1440370646	/nfs/dbraw/zinc/37/06/46/1440370646.db2.gz	BQCLHYPNXUZUIF-KSSFIOAISA-N	0	3	349.425	3.020	20	30		EGEDHN
C=CCCCC(=O)N1CCC(CN(C)Cc2ccc(F)cn2)CC1	ZINC001753365568	1440384915	/nfs/dbraw/zinc/38/49/15/1440384915.db2.gz	GETHWBWEIITNNV-UHFFFAOYSA-N	0	3	333.451	3.247	20	30		EGEDHN
C=C[C@H](CC(=O)N1CCC(CN(C)CCF)CC1)c1ccccc1	ZINC001753367886	1440386373	/nfs/dbraw/zinc/38/63/73/1440386373.db2.gz	HQUQJGLMMGDZFX-GOSISDBHSA-N	0	3	332.463	3.486	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H]2C[C@H]1CN2CCCC1CCOCC1	ZINC001753421355	1440395435	/nfs/dbraw/zinc/39/54/35/1440395435.db2.gz	GYXJQBWDWWBLKR-PMACEKPBSA-N	0	3	346.515	3.247	20	30		EGEDHN
C=C[C@@](C)(O)CC(=O)N(C)[C@H]1CCN(Cc2ccc(C(C)C)cc2)C1	ZINC001753434172	1440399410	/nfs/dbraw/zinc/39/94/10/1440399410.db2.gz	AZMBATBDGXILPI-PZJWPPBQSA-N	0	3	344.499	3.170	20	30		EGEDHN
CC[C@H](CNC(=O)c1cc(C)c(C)o1)NCC#Cc1ccc(F)cc1	ZINC001753469824	1440413756	/nfs/dbraw/zinc/41/37/56/1440413756.db2.gz	HFKNDMAXSYUFEE-GOSISDBHSA-N	0	3	342.414	3.185	20	30		EGEDHN
CC[C@@H](CNC(=O)C[C@@H]1CC=CCC1)NCc1ccc(C#N)c(F)c1	ZINC001753482112	1440416878	/nfs/dbraw/zinc/41/68/78/1440416878.db2.gz	BIYGYMVSDNFIFZ-QAPCUYQASA-N	0	3	343.446	3.428	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@](C)(CNCc1cccc(F)c1F)C1CC1	ZINC001753518951	1440428076	/nfs/dbraw/zinc/42/80/76/1440428076.db2.gz	SZPYXKLQTBIHQQ-HXUWFJFHSA-N	0	3	348.437	3.389	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)CCc1csc(C)n1)C1CC1	ZINC001753524549	1440429231	/nfs/dbraw/zinc/42/92/31/1440429231.db2.gz	GRFWNRDYSOGNFI-MRXNPFEDSA-N	0	3	341.908	3.011	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N[C@](C)(CNCc1ccc(C#N)cc1F)C1CC1	ZINC001753524770	1440429425	/nfs/dbraw/zinc/42/94/25/1440429425.db2.gz	LGHZHRQAEPSGBD-JLTOFOAXSA-N	0	3	345.462	3.364	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H](CCNCc2ocnc2C)C1	ZINC001753554788	1440435716	/nfs/dbraw/zinc/43/57/16/1440435716.db2.gz	HOWLIQCWWZTYBN-APWZRJJASA-N	0	3	333.476	3.304	20	30		EGEDHN
N#Cc1ccccc1CNCCC1CCN(C(=O)CCCF)CC1	ZINC001753571657	1440438623	/nfs/dbraw/zinc/43/86/23/1440438623.db2.gz	TYVTWDHGIGLTHS-UHFFFAOYSA-N	0	3	331.435	3.026	20	30		EGEDHN
CC#CCNCc1ccc(CNC(=O)[C@@H](C)c2ccccc2F)cc1	ZINC001753591872	1440443099	/nfs/dbraw/zinc/44/30/99/1440443099.db2.gz	QMPKHMBGCWLULQ-INIZCTEOSA-N	0	3	338.426	3.359	20	30		EGEDHN
CC#CCNCc1ccc(CNC(=O)[C@@H]2C[C@H]2c2ccccc2)cc1	ZINC001753591781	1440443154	/nfs/dbraw/zinc/44/31/54/1440443154.db2.gz	OAMUFGWVQPMXTA-LEWJYISDSA-N	0	3	332.447	3.219	20	30		EGEDHN
C#CCNCc1ccc(CNC(=O)c2ccc(OC3CCC3)cc2)cc1	ZINC001753592127	1440443173	/nfs/dbraw/zinc/44/31/73/1440443173.db2.gz	AFCCUHTWTIDISY-UHFFFAOYSA-N	0	3	348.446	3.271	20	30		EGEDHN
C#CCNCc1ccc(CNC(=O)CCCc2cccs2)cc1	ZINC001753592281	1440443244	/nfs/dbraw/zinc/44/32/44/1440443244.db2.gz	HQZMWKAHWHTGDY-UHFFFAOYSA-N	0	3	326.465	3.110	20	30		EGEDHN
CC#CCNCc1ccc(CNC(=O)c2cc3ccccc3o2)cc1	ZINC001753592516	1440443294	/nfs/dbraw/zinc/44/32/94/1440443294.db2.gz	QGKCRPYWYBDXBH-UHFFFAOYSA-N	0	3	332.403	3.476	20	30		EGEDHN
C[C@@]1(C(=O)NCC2(NCC#Cc3ccccc3)CCCC2)C=CCC1	ZINC001753667196	1440460720	/nfs/dbraw/zinc/46/07/20/1440460720.db2.gz	SZYBBDPEQWPYNX-OAQYLSRUSA-N	0	3	336.479	3.413	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccccc1)N(C)C(=O)c1ccc(Cl)o1	ZINC001753678990	1440464222	/nfs/dbraw/zinc/46/42/22/1440464222.db2.gz	HCBBOLZXEMLBDN-AWEZNQCLSA-N	0	3	330.815	3.035	20	30		EGEDHN
C[C@H](CNCC#Cc1ccccc1)N(C)C(=O)C1C(C)(C)C1(C)C	ZINC001753687627	1440465921	/nfs/dbraw/zinc/46/59/21/1440465921.db2.gz	QFNCKCXSPXYXBU-MRXNPFEDSA-N	0	3	326.484	3.157	20	30		EGEDHN
C[C@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)c1ccc(F)s1	ZINC001753727760	1440474877	/nfs/dbraw/zinc/47/48/77/1440474877.db2.gz	IDWCRZXFBYWCAS-LLVKDONJSA-N	0	3	349.406	3.148	20	30		EGEDHN
CC(C)C[C@@H](CNCC#Cc1ccccc1Cl)NC(=O)C(C)C	ZINC001753732818	1440476767	/nfs/dbraw/zinc/47/67/67/1440476767.db2.gz	KRMAWOQHHBGAIE-KRWDZBQOSA-N	0	3	334.891	3.468	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCCC[C@@H]1CCNCc1cc(C)n(C)n1	ZINC001753776846	1440486631	/nfs/dbraw/zinc/48/66/31/1440486631.db2.gz	LBXUFDFXKLXLRW-GOSISDBHSA-N	0	3	346.519	3.192	20	30		EGEDHN
C=C(Br)CNC[C@@H]1[C@H](C)CCCN1C(=O)C=C(C)C	ZINC001753803241	1440491341	/nfs/dbraw/zinc/49/13/41/1440491341.db2.gz	KYHUDENRAWCFRW-TZMCWYRMSA-N	0	3	329.282	3.078	20	30		EGEDHN
CCC(=O)N1CCC(CCN(C)CC#Cc2ccc(F)cc2)CC1	ZINC001753816720	1440494198	/nfs/dbraw/zinc/49/41/98/1440494198.db2.gz	NMEFDKJQSDDGPA-UHFFFAOYSA-N	0	3	330.447	3.148	20	30		EGEDHN
CC(C)[C@H](CNC(=O)C1(CF)CCC1)NCc1cc(C#N)ccc1F	ZINC001753841221	1440502634	/nfs/dbraw/zinc/50/26/34/1440502634.db2.gz	VQDJQNABYGVXKO-KRWDZBQOSA-N	0	3	349.425	3.068	20	30		EGEDHN
CN(CCN(C)[C@@H]1CCc2c1cccc2Cl)C(=O)C#CC1CC1	ZINC001753852160	1440507397	/nfs/dbraw/zinc/50/73/97/1440507397.db2.gz	DIQBSZBYVPKUAZ-GOSISDBHSA-N	0	3	330.859	3.131	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N(C)CCN(C)Cc1ccc(C2CC2)cc1	ZINC001753863880	1440513003	/nfs/dbraw/zinc/51/30/03/1440513003.db2.gz	QXVLLCHMYLFLNH-UXHICEINSA-N	0	3	342.483	3.045	20	30		EGEDHN
C[C@H](CCNCc1ccccc1C#N)NC(=O)[C@]12C[C@H]1CCCC2	ZINC001753998233	1440529786	/nfs/dbraw/zinc/52/97/86/1440529786.db2.gz	OXFONMZWEKLALP-XFQXTVEOSA-N	0	3	325.456	3.123	20	30		EGEDHN
C=C[C@@H](C(=O)N[C@@H](C)CCNCc1ncc(C)s1)c1ccccc1	ZINC001754024339	1440532947	/nfs/dbraw/zinc/53/29/47/1440532947.db2.gz	OQFZGLYJCVXNMO-WMLDXEAASA-N	0	3	343.496	3.406	20	30		EGEDHN
CCN(CCNCc1ccc(F)c(C#N)c1)C(=O)c1ccsc1	ZINC001754032643	1440533905	/nfs/dbraw/zinc/53/39/05/1440533905.db2.gz	ZUBWCYWPSBDFNT-UHFFFAOYSA-N	0	3	331.416	3.011	20	30		EGEDHN
C=C1CCC(C(=O)N(CC)CCNCc2cccc(C#N)c2)CC1	ZINC001754065136	1440537239	/nfs/dbraw/zinc/53/72/39/1440537239.db2.gz	UOEJVAGOECZLEF-UHFFFAOYSA-N	0	3	325.456	3.243	20	30		EGEDHN
CC(C)(CC(=O)NC/C=C\CNCc1ccc(F)c(C#N)c1)C1CC1	ZINC001754131486	1440543661	/nfs/dbraw/zinc/54/36/61/1440543661.db2.gz	JPMUSTBHKQRSBV-ARJAWSKDSA-N	0	3	343.446	3.286	20	30		EGEDHN
N#Cc1cccc(CNC/C=C\CNC(=O)c2cccc(Cl)c2)c1	ZINC001754198301	1440549748	/nfs/dbraw/zinc/54/97/48/1440549748.db2.gz	UBZHGGLCPAMMPV-UPHRSURJSA-N	0	3	339.826	3.287	20	30		EGEDHN
COCC#CCNC/C=C\CNC(=O)CC1CCC(C(C)(C)C)CC1	ZINC001754212759	1440551440	/nfs/dbraw/zinc/55/14/40/1440551440.db2.gz	HDYQLJWOCWKVJV-WAYWQWQTSA-N	0	3	348.531	3.141	20	30		EGEDHN
Cc1cccc(CCC(=O)N[C@H](C)CNCc2ccc(C#N)s2)c1	ZINC001754236126	1440554951	/nfs/dbraw/zinc/55/49/51/1440554951.db2.gz	BISBQLROGDTMKM-OAHLLOKOSA-N	0	3	341.480	3.155	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H](C)CNCC#Cc1ccc(Cl)cc1	ZINC001754237627	1440555069	/nfs/dbraw/zinc/55/50/69/1440555069.db2.gz	NWZISHURKMCGIP-OAHLLOKOSA-N	0	3	332.875	3.388	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H](C)CN[C@@H](C)C(=O)Nc1ccccc1C	ZINC001754242747	1440556049	/nfs/dbraw/zinc/55/60/49/1440556049.db2.gz	QQZHJCXAMQTUTA-CVEARBPZSA-N	0	3	345.487	3.019	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H](C)CN(C)C[C@@H](O)c1ccc(CC)cc1	ZINC001754317771	1440576456	/nfs/dbraw/zinc/57/64/56/1440576456.db2.gz	BHHSRYXFAMLYLA-VQIMIIECSA-N	0	3	346.515	3.321	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)c1ccc2[nH]ccc2c1	ZINC001754324455	1440579640	/nfs/dbraw/zinc/57/96/40/1440579640.db2.gz	VRPAOUJBNDQUJD-HNNXBMFYSA-N	0	3	346.434	3.290	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N[C@@H](C)CN(C)Cc1ccc(CF)cc1	ZINC001754337890	1440587426	/nfs/dbraw/zinc/58/74/26/1440587426.db2.gz	MJWYHJFDNBXUAN-SNRMKQJTSA-N	0	3	348.462	3.074	20	30		EGEDHN
C#CCCCC(=O)N(C)CCCNCc1nc2cc(C)ccc2s1	ZINC001754368143	1440592348	/nfs/dbraw/zinc/59/23/48/1440592348.db2.gz	VXGHGQZFYXCADX-UHFFFAOYSA-N	0	3	343.496	3.346	20	30		EGEDHN
CN(CCCNCc1nsc2ccccc21)C(=O)C#CC(C)(C)C	ZINC001754370125	1440592481	/nfs/dbraw/zinc/59/24/81/1440592481.db2.gz	QYSSIAAZUCDWBA-UHFFFAOYSA-N	0	3	343.496	3.284	20	30		EGEDHN
C=C(Br)CNCCCN(C)C(=O)c1sccc1CC	ZINC001754416447	1440596843	/nfs/dbraw/zinc/59/68/43/1440596843.db2.gz	OMYUFUWODFVKRU-UHFFFAOYSA-N	0	3	345.306	3.271	20	30		EGEDHN
CCC[C@@H](C)C(=O)N[C@@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001754436297	1440598125	/nfs/dbraw/zinc/59/81/25/1440598125.db2.gz	SVIUIHCIBZRLIW-ACJLOTCBSA-N	0	3	331.435	3.118	20	30		EGEDHN
CC1(C(=O)N[C@H](CNCC#Cc2ccc(F)cc2)C2CC2)CC=CC1	ZINC001754450834	1440601009	/nfs/dbraw/zinc/60/10/09/1440601009.db2.gz	VFZWFLVRYINOIE-LJQANCHMSA-N	0	3	340.442	3.018	20	30		EGEDHN
C[C@H](C(=O)NCC1(NCc2ccc(C#N)c(F)c2)CC1)C(C)(C)C	ZINC001754517899	1440618942	/nfs/dbraw/zinc/61/89/42/1440618942.db2.gz	FDJSJUXCHYZZHL-CYBMUJFWSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@H]2CCC[C@@H](C1)N2C[C@@H](OCC)C1CC1	ZINC001754553143	1440630627	/nfs/dbraw/zinc/63/06/27/1440630627.db2.gz	WJXJBFKFSZBNMA-RSPOEFSDSA-N	0	3	348.531	3.469	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC(N(C/C=C\Cl)CCOC)CC1	ZINC001754559003	1440632971	/nfs/dbraw/zinc/63/29/71/1440632971.db2.gz	JXQWHUHRKLWLPP-VOCYLRNQSA-N	0	3	342.911	3.281	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001754565146	1440635185	/nfs/dbraw/zinc/63/51/85/1440635185.db2.gz	MHRYCIMDDCKYDC-NRFANRHFSA-N	0	3	337.467	3.339	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@]2(CCN(Cc3cncc(C)c3)C2)C1	ZINC001754566292	1440635587	/nfs/dbraw/zinc/63/55/87/1440635587.db2.gz	YLFBOLXYPHETGW-NRFANRHFSA-N	0	3	341.499	3.417	20	30		EGEDHN
C#CCN(C(=O)C1CCCC1)C1CCN(CCOCCC(C)C)CC1	ZINC001754634564	1440648408	/nfs/dbraw/zinc/64/84/08/1440648408.db2.gz	XQHJAWUFISUQLZ-UHFFFAOYSA-N	0	3	348.531	3.166	20	30		EGEDHN
C#CCN(C(=O)Cc1c[nH]c2cccc(C)c12)C1CCN(CC=C)CC1	ZINC001754642747	1440649236	/nfs/dbraw/zinc/64/92/36/1440649236.db2.gz	XRQQTEQTUOOSPM-UHFFFAOYSA-N	0	3	349.478	3.131	20	30		EGEDHN
C#CCN(C(=O)[C@@H](C)c1ccc(CC)cc1)C1CCN(CC=C)CC1	ZINC001754641895	1440649336	/nfs/dbraw/zinc/64/93/36/1440649336.db2.gz	NIYXULACKFWOFA-SFHVURJKSA-N	0	3	338.495	3.465	20	30		EGEDHN
CC#CCNC[C@@H](NC(=O)c1cccnc1)c1ccc2ccccc2c1	ZINC001754644027	1440649512	/nfs/dbraw/zinc/64/95/12/1440649512.db2.gz	MHXOODOQGGAEJP-OAQYLSRUSA-N	0	3	343.430	3.319	20	30		EGEDHN
CC#CCNC[C@H](NC(=O)c1cccnc1)c1ccc2ccccc2c1	ZINC001754644026	1440649537	/nfs/dbraw/zinc/64/95/37/1440649537.db2.gz	MHXOODOQGGAEJP-NRFANRHFSA-N	0	3	343.430	3.319	20	30		EGEDHN
C=CCOCCN1CC[C@@](C)(NC(=O)C/C=C/c2ccc(F)cc2)C1	ZINC001754675540	1440659775	/nfs/dbraw/zinc/65/97/75/1440659775.db2.gz	RAYJOEACCLFHMZ-DPZZJQGRSA-N	0	3	346.446	3.012	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@]1(C)CCN(CCc2scnc2C)C1	ZINC001754677823	1440660785	/nfs/dbraw/zinc/66/07/85/1440660785.db2.gz	ASLAPAGVOWZNAM-CRAIPNDOSA-N	0	3	335.517	3.177	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@](C)(CNCc2ccncc2Cl)C1	ZINC001754693690	1440666512	/nfs/dbraw/zinc/66/65/12/1440666512.db2.gz	WRAVKBFKRRKXNJ-LJQANCHMSA-N	0	3	347.890	3.257	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@](C)(CN[C@H](C)c3cnccn3)C2)CC1	ZINC001754704973	1440668921	/nfs/dbraw/zinc/66/89/21/1440668921.db2.gz	SRZJDACIYMVDPB-OXQOHEQNSA-N	0	3	342.487	3.112	20	30		EGEDHN
C=CCN1CCC[C@@](C)(CNC(=O)[C@@H](C)CCOc2ccccc2)C1	ZINC001754734669	1440681831	/nfs/dbraw/zinc/68/18/31/1440681831.db2.gz	PDOHERPKRUQKNM-RXVVDRJESA-N	0	3	344.499	3.496	20	30		EGEDHN
CC#CCNCCN(Cc1ccccc1)C(=O)CCc1ccccc1	ZINC001754839421	1440697495	/nfs/dbraw/zinc/69/74/95/1440697495.db2.gz	PWRCMKTUXRDKFB-UHFFFAOYSA-N	0	3	334.463	3.261	20	30		EGEDHN
C=CCOCCCC(=O)N1CCC[C@H]2[C@H]1CCN2Cc1ccsc1	ZINC001754864731	1440702519	/nfs/dbraw/zinc/70/25/19/1440702519.db2.gz	YGMFJKMKOZGSDL-ZWKOTPCHSA-N	0	3	348.512	3.296	20	30		EGEDHN
C=C(Br)CNCC[C@H]1CCN(C(=O)CCCCC)C1	ZINC001754902662	1440707230	/nfs/dbraw/zinc/70/72/30/1440707230.db2.gz	MJYSVBNNUGJCCP-AWEZNQCLSA-N	0	3	331.298	3.304	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)NCc1ccc([C@H](C)NC/C=C/Cl)cc1	ZINC001754947560	1440713791	/nfs/dbraw/zinc/71/37/91/1440713791.db2.gz	OMGUOFIIDPTVGY-MDVIOIQYSA-N	0	3	336.863	3.033	20	30		EGEDHN
C#CCN[C@@H](C)c1ccc(CNC(=O)[C@@H](OCC)C2CCCC2)cc1	ZINC001754949082	1440714505	/nfs/dbraw/zinc/71/45/05/1440714505.db2.gz	VXXNHRWQMJHHJV-JXFKEZNVSA-N	0	3	342.483	3.182	20	30		EGEDHN
Cc1cc(C(=O)NCC2(NCc3ccc(F)c(C#N)c3)CCC2)co1	ZINC001754981631	1440721358	/nfs/dbraw/zinc/72/13/58/1440721358.db2.gz	ZVGXJXBEBIEXHQ-UHFFFAOYSA-N	0	3	341.386	3.041	20	30		EGEDHN
C=CCCC(=O)N1CCO[C@@H](CN[C@H](C)c2ccccc2Cl)C1	ZINC001754994825	1440725437	/nfs/dbraw/zinc/72/54/37/1440725437.db2.gz	CIHFZHKUKZGCAZ-CABCVRRESA-N	0	3	336.863	3.184	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](N3CCN(CCCC)CC3)C2)CCCC1	ZINC001755019373	1440726525	/nfs/dbraw/zinc/72/65/25/1440726525.db2.gz	KIYLDIBGGPFLNB-LJQANCHMSA-N	0	3	347.547	3.142	20	30		EGEDHN
CC#CCCCC(=O)N[C@H]1CCCN(Cc2ccccc2F)CC1	ZINC001755027865	1440729754	/nfs/dbraw/zinc/72/97/54/1440729754.db2.gz	HZHHVRRFIJRHFJ-SFHVURJKSA-N	0	3	330.447	3.490	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CCCN(Cc2ccccc2F)CC1	ZINC001755027864	1440729760	/nfs/dbraw/zinc/72/97/60/1440729760.db2.gz	HZHHVRRFIJRHFJ-GOSISDBHSA-N	0	3	330.447	3.490	20	30		EGEDHN
C[C@@H](C(=O)N(C)CCCN(C)Cc1ccc(F)c(C#N)c1)C1CCC1	ZINC001755038624	1440736033	/nfs/dbraw/zinc/73/60/33/1440736033.db2.gz	AVOFNDAFWIHLNU-OAHLLOKOSA-N	0	3	345.462	3.414	20	30		EGEDHN
C=CCCN1Cc2ccccc2C[C@H]1CNC(=O)Cc1cnccc1C	ZINC001755075253	1440748502	/nfs/dbraw/zinc/74/85/02/1440748502.db2.gz	CKKLUFXQVLQPJC-NRFANRHFSA-N	0	3	349.478	3.052	20	30		EGEDHN
C=C[C@@](C)(O)CC(=O)NCc1ccc2c(c1)CN(CC/C=C/CC)C2	ZINC001755100815	1440752190	/nfs/dbraw/zinc/75/21/90/1440752190.db2.gz	HZZHHXDRFYAGDR-IRUYWQDXSA-N	0	3	342.483	3.302	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@H](C)OCC(C)C)cc2C1	ZINC001755101190	1440752232	/nfs/dbraw/zinc/75/22/32/1440752232.db2.gz	VBICAMMOKPMFMX-INIZCTEOSA-N	0	3	330.472	3.256	20	30		EGEDHN
C[C@@H]1CN(C(=O)/C=C\C(C)(C)C)C[C@@H]1NCC#Cc1ccc(F)cc1	ZINC001755107804	1440754026	/nfs/dbraw/zinc/75/40/26/1440754026.db2.gz	UELBMRUYPADFFW-VVSAXJSQSA-N	0	3	342.458	3.216	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CCN(Cc2ccc3c(c2)COC3)CC1(C)C	ZINC001755137014	1440758622	/nfs/dbraw/zinc/75/86/22/1440758622.db2.gz	KWFPKOUPPBKRLX-LJQANCHMSA-N	0	3	342.483	3.400	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)CC(C)(C)c2ccc(F)cc2)C[C@@H]1C	ZINC001755162435	1440765282	/nfs/dbraw/zinc/76/52/82/1440765282.db2.gz	VBYITEKJNPILQK-MAUKXSAKSA-N	0	3	330.447	3.096	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CCN(CCOc2ccccc2C)[C@H](C)C1	ZINC001755168439	1440767973	/nfs/dbraw/zinc/76/79/73/1440767973.db2.gz	BTXZHUAMIMYAPF-QZTJIDSGSA-N	0	3	330.472	3.309	20	30		EGEDHN
C=CCOCCCC(=O)N[C@H]1CCN(Cc2cccc(F)c2)[C@@H](C)C1	ZINC001755168511	1440768062	/nfs/dbraw/zinc/76/80/62/1440768062.db2.gz	CJLUXEVFAXRZGZ-LPHOPBHVSA-N	0	3	348.462	3.278	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@@H](C)CC(C)(C)C)CCO2	ZINC001755174372	1440770313	/nfs/dbraw/zinc/77/03/13/1440770313.db2.gz	OZOWKNNUCMOBIV-QGZVFWFLSA-N	0	3	336.520	3.328	20	30		EGEDHN
CCC(CC)CC(=O)N1CCC2(CCN(CC#CCOC)CC2)CC1	ZINC001755175909	1440770863	/nfs/dbraw/zinc/77/08/63/1440770863.db2.gz	LZMDAOGSXIBVEE-UHFFFAOYSA-N	0	3	348.531	3.167	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1Cc2ccccc2[C@H]1NCCOC(C)C	ZINC001755186515	1440773312	/nfs/dbraw/zinc/77/33/12/1440773312.db2.gz	WPFDZNAAWSAIET-UYAOXDASSA-N	0	3	344.499	3.386	20	30		EGEDHN
C#CCCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccoc1CCC	ZINC001755187461	1440773593	/nfs/dbraw/zinc/77/35/93/1440773593.db2.gz	HGGYBNMURONLJO-UYAOXDASSA-N	0	3	336.435	3.241	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)C#CC(C)(C)C	ZINC001755192524	1440775380	/nfs/dbraw/zinc/77/53/80/1440775380.db2.gz	HEBCJWDELDURSU-IBGZPJMESA-N	0	3	337.467	3.031	20	30		EGEDHN
C=CCN(C)C[C@@H]1CCCN1C(=O)c1nsc2ccc(C)cc21	ZINC001755196066	1440776959	/nfs/dbraw/zinc/77/69/59/1440776959.db2.gz	DMRCDPQAOFFLSI-AWEZNQCLSA-N	0	3	329.469	3.327	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@@H]1CN(C)Cc1ccc(CO)cc1	ZINC001755199329	1440778769	/nfs/dbraw/zinc/77/87/69/1440778769.db2.gz	UYAQQALPDAWKCY-LJQANCHMSA-N	0	3	344.499	3.204	20	30		EGEDHN
C=CCN(C)C[C@@H]1CCCN1C(=O)Cc1cccc(OCCC)c1	ZINC001755200297	1440779106	/nfs/dbraw/zinc/77/91/06/1440779106.db2.gz	FQKDCBAVAKGNKQ-SFHVURJKSA-N	0	3	330.472	3.127	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](C2CCN(C(=O)COC(C)C)CC2)C1	ZINC001755204116	1440781611	/nfs/dbraw/zinc/78/16/11/1440781611.db2.gz	HDWCKFFATBKKAI-QGZVFWFLSA-N	0	3	342.911	3.115	20	30		EGEDHN
C[C@H](NCC#Cc1ccccc1)[C@H](C)NC(=O)CC1CCCCC1	ZINC001755226338	1440786025	/nfs/dbraw/zinc/78/60/25/1440786025.db2.gz	NBQGFYBJMWCOMQ-ROUUACIJSA-N	0	3	326.484	3.491	20	30		EGEDHN
C[C@@H](NC(=O)c1ccoc1Cl)[C@H](C)NCc1ccc(C#N)s1	ZINC001755235046	1440788022	/nfs/dbraw/zinc/78/80/22/1440788022.db2.gz	XQITXNTVDWORHD-VHSXEESVSA-N	0	3	337.832	3.163	20	30		EGEDHN
CCCC1(C(=O)N[C@H](C)[C@@H](C)NCC#Cc2ccc(F)cc2)CC1	ZINC001755252942	1440792325	/nfs/dbraw/zinc/79/23/25/1440792325.db2.gz	MXUDQFYGRNXXKJ-HZPDHXFCSA-N	0	3	330.447	3.240	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)c(F)c1)[C@H](C)NC(=O)C(C1CC1)C1CC1	ZINC001755262554	1440795005	/nfs/dbraw/zinc/79/50/05/1440795005.db2.gz	LFVYDHKVCBXEHX-OLZOCXBDSA-N	0	3	343.446	3.116	20	30		EGEDHN
COc1cccc([C@H](C)N(C)[C@H](C)CNC(=O)C#CC(C)(C)C)c1	ZINC001755299325	1440807899	/nfs/dbraw/zinc/80/78/99/1440807899.db2.gz	AIGPZWNSRPFFSU-CVEARBPZSA-N	0	3	330.472	3.242	20	30		EGEDHN
C=CCOCCN(C)[C@H](C)CNC(=O)c1ccc(Cl)cc1Cl	ZINC001755322969	1440819933	/nfs/dbraw/zinc/81/99/33/1440819933.db2.gz	OGIKNCAGAAQCFM-GFCCVEGCSA-N	0	3	345.270	3.246	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC1(CNCc2nccnc2C)CCCCC1	ZINC001755353796	1440828669	/nfs/dbraw/zinc/82/86/69/1440828669.db2.gz	XDOHZKUPAJFGGG-QGZVFWFLSA-N	0	3	344.503	3.296	20	30		EGEDHN
C=CCCC(=O)NC[C@@H]1CCCCCN1Cc1cccc(C#N)c1	ZINC001755363402	1440833122	/nfs/dbraw/zinc/83/31/22/1440833122.db2.gz	ABRJXMXUFCXFSV-IBGZPJMESA-N	0	3	325.456	3.385	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](C)C1CN(CCCOc2ccccc2)C1	ZINC001755382278	1440839619	/nfs/dbraw/zinc/83/96/19/1440839619.db2.gz	DAKNTXFKGRCXLS-KRWDZBQOSA-N	0	3	344.499	3.494	20	30		EGEDHN
C=CCOCC(=O)N[C@H]1CN([C@@H](CC)c2ccc(F)cc2)CC1(C)C	ZINC001755406125	1440844240	/nfs/dbraw/zinc/84/42/40/1440844240.db2.gz	KFKSZNIAVCLHGR-ROUUACIJSA-N	0	3	348.462	3.306	20	30		EGEDHN
C=C(Cl)CNCCC[C@H](C)NC(=O)c1cnn(C(C)(C)C)c1C	ZINC001755501206	1440862574	/nfs/dbraw/zinc/86/25/74/1440862574.db2.gz	ARSRRJKMPZJJDI-ZDUSSCGKSA-N	0	3	340.899	3.187	20	30		EGEDHN
C=C(Cl)CNCCC[C@H](C)NC(=O)c1ccc(F)c(F)c1F	ZINC001755510681	1440863529	/nfs/dbraw/zinc/86/35/29/1440863529.db2.gz	DLUBACMTVWXUBP-JTQLQIEISA-N	0	3	334.769	3.345	20	30		EGEDHN
C=C(C)CCC(=O)N(C)C[C@H](C)NCc1cnn(-c2ccccc2)c1	ZINC001755588487	1440880926	/nfs/dbraw/zinc/88/09/26/1440880926.db2.gz	AMEHQLGAGPUXOO-KRWDZBQOSA-N	0	3	340.471	3.165	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N[C@@]12CCC[C@@H]1N(Cc1ccsc1)CC2	ZINC001755697508	1440898455	/nfs/dbraw/zinc/89/84/55/1440898455.db2.gz	YSJYDOWJBHMLOD-HHXXYDBFSA-N	0	3	348.512	3.343	20	30		EGEDHN
C#CCN1CC[C@]2(NC(=O)C[C@@H](C)c3ccc(CC)cc3)CCC[C@H]12	ZINC001755699928	1440899361	/nfs/dbraw/zinc/89/93/61/1440899361.db2.gz	DGEUFXYGYVCXLL-PIPMEXSNSA-N	0	3	338.495	3.489	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CCCN(CCn2nc(C)cc2C)[C@@H]1C	ZINC001755716240	1440905380	/nfs/dbraw/zinc/90/53/80/1440905380.db2.gz	KTXZGTYIGJUWEE-QZTJIDSGSA-N	0	3	346.519	3.071	20	30		EGEDHN
C=CCOCCN1CCC[C@@H](NC(=O)C2CCC(C)(C)CC2)[C@H]1C	ZINC001755724377	1440908873	/nfs/dbraw/zinc/90/88/73/1440908873.db2.gz	XAEPMEPZKFSNDU-SJLPKXTDSA-N	0	3	336.520	3.375	20	30		EGEDHN
CC1(C)CN(C(=O)[C@@]2(C)C=CCC2)C[C@@H]1NCC#Cc1ccccc1	ZINC001755773845	1440917120	/nfs/dbraw/zinc/91/71/20/1440917120.db2.gz	JZYSHELKSQZZFG-UGKGYDQZSA-N	0	3	336.479	3.221	20	30		EGEDHN
C#CCCN(C)CCN(C(=O)Cc1ccc(C)c(Cl)c1)C(C)C	ZINC001755811696	1440920627	/nfs/dbraw/zinc/92/06/27/1440920627.db2.gz	DZGWRYYWNJVNFY-UHFFFAOYSA-N	0	3	334.891	3.383	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N(CCN(C)Cc1ccccc1C)C(C)C	ZINC001755812134	1440920872	/nfs/dbraw/zinc/92/08/72/1440920872.db2.gz	JXZDHMVKCTTZMX-UXHICEINSA-N	0	3	344.499	3.255	20	30		EGEDHN
C=CCN(C)CCN(C(=O)Cc1cccc(Cl)c1F)C(C)C	ZINC001755814430	1440922590	/nfs/dbraw/zinc/92/25/90/1440922590.db2.gz	BQWBGBWHWDAPNI-UHFFFAOYSA-N	0	3	326.843	3.376	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@H](CNCc1cnc(C)nc1)C(C)(C)C	ZINC001755831262	1440928729	/nfs/dbraw/zinc/92/87/29/1440928729.db2.gz	WIDPBKUJSVVGCF-NVXWUHKLSA-N	0	3	332.492	3.008	20	30		EGEDHN
CC(C)(C)[C@@H](CNCc1ccc(C#N)s1)NC(=O)C1CC2(CC2)C1	ZINC001755831862	1440929050	/nfs/dbraw/zinc/92/90/50/1440929050.db2.gz	ABGHJJUZLXMNSD-MRXNPFEDSA-N	0	3	345.512	3.430	20	30		EGEDHN
Cc1c[nH]cc1C(=O)N[C@H](CNCc1ccc(C#N)s1)C(C)(C)C	ZINC001755837522	1440930736	/nfs/dbraw/zinc/93/07/36/1440930736.db2.gz	SEWWPDMNXQUZTF-MRXNPFEDSA-N	0	3	344.484	3.191	20	30		EGEDHN
C=C(Cl)CNC1CC(N(C)C(=O)[C@H](C)Cc2ccc(F)cc2)C1	ZINC001755865388	1440937638	/nfs/dbraw/zinc/93/76/38/1440937638.db2.gz	BHYCXCDBZMODBO-AXOLYNHLSA-N	0	3	338.854	3.336	20	30		EGEDHN
C#CCN1CCC(C2(NC(=O)CC3(c4ccccc4)CC3)CC2)CC1	ZINC001755868654	1440938415	/nfs/dbraw/zinc/93/84/15/1440938415.db2.gz	BTQWSBVICZCFBL-UHFFFAOYSA-N	0	3	336.479	3.102	20	30		EGEDHN
C=CCOCCN1CC=C(CNC(=O)c2cccc(Cl)c2C)CC1	ZINC001755888161	1440940937	/nfs/dbraw/zinc/94/09/37/1440940937.db2.gz	ORDFSQWOVHUEQM-UHFFFAOYSA-N	0	3	348.874	3.213	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC1=CCN(C[C@H]2CC(C)(C)CO2)CC1	ZINC001755891205	1440941434	/nfs/dbraw/zinc/94/14/34/1440941434.db2.gz	VQGVHFLVRZUFPG-QGZVFWFLSA-N	0	3	334.504	3.152	20	30		EGEDHN
COc1ccccc1C[C@@](C)(CO)NCc1ccc(C#N)cc1Cl	ZINC000931605222	1126137060	/nfs/dbraw/zinc/13/70/60/1126137060.db2.gz	JOMOKQRPNZAVQV-IBGZPJMESA-N	0	3	344.842	3.304	20	30		EGEDHN
Cc1nsc(N2C[C@H]3CN(Cc4ccccc4)CC[C@@H]3C2)c1C#N	ZINC000368185113	168321715	/nfs/dbraw/zinc/32/17/15/168321715.db2.gz	QBFVMPDXIPBEEI-IAGOWNOFSA-N	0	3	338.480	3.282	20	30		EGEDHN
CCC(CC)N(CCS(=O)(=O)c1ccc(C#N)cc1)CC(C)C	ZINC000321948078	282184836	/nfs/dbraw/zinc/18/48/36/282184836.db2.gz	NQKWGGLCTCDRAO-UHFFFAOYSA-N	0	3	336.501	3.479	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN2CCC(c3ccsc3)CC2)cc1	ZINC000186936111	236070596	/nfs/dbraw/zinc/07/05/96/236070596.db2.gz	XTTVURGXOBHIEC-GOSISDBHSA-N	0	3	342.464	3.239	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)CC1	ZINC000189728902	201048259	/nfs/dbraw/zinc/04/82/59/201048259.db2.gz	IIFRBOQEIBGOKA-UHFFFAOYSA-N	0	3	345.443	3.489	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(Cc2ccc(F)cc2)C(C)C)CC1	ZINC000264392020	201209988	/nfs/dbraw/zinc/20/99/88/201209988.db2.gz	WXYLGTHIUYYNCL-UHFFFAOYSA-N	0	3	333.451	3.396	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@H]2c2ccc(OC)cc2)CC1	ZINC000264381999	201211303	/nfs/dbraw/zinc/21/13/03/201211303.db2.gz	USTBJTPSMFXCBE-IBGZPJMESA-N	0	3	343.471	3.192	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cccc(Oc3ccncc3)c2)CC1	ZINC000264811440	201212920	/nfs/dbraw/zinc/21/29/20/201212920.db2.gz	SNNBMUSTIUKPCC-UHFFFAOYSA-N	0	3	335.407	3.158	20	30		EGEDHN
C=CCC(CC=C)C(=O)N(C)C1CCN(CCc2ccccn2)CC1	ZINC000268228511	201225419	/nfs/dbraw/zinc/22/54/19/201225419.db2.gz	UUGJHFOJLZBTRZ-UHFFFAOYSA-N	0	3	341.499	3.315	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H]2COc3c2ccc(C)c3C)CC1	ZINC000264369487	201209491	/nfs/dbraw/zinc/20/94/91/201209491.db2.gz	IWDQUBWGBRVZNG-SFHVURJKSA-N	0	3	343.471	3.077	20	30		EGEDHN
C=CCOc1ccc(CN2CCC[C@@H](c3n[nH]c(C)n3)C2)cc1OC	ZINC000271405020	201243689	/nfs/dbraw/zinc/24/36/89/201243689.db2.gz	WMWIKGCSBDFGQB-MRXNPFEDSA-N	0	3	342.443	3.066	20	30		EGEDHN
C=CCOc1ccc(CN2CCC[C@@H](c3nc(C)n[nH]3)C2)cc1OC	ZINC000271405020	201243692	/nfs/dbraw/zinc/24/36/92/201243692.db2.gz	WMWIKGCSBDFGQB-MRXNPFEDSA-N	0	3	342.443	3.066	20	30		EGEDHN
C=CCN(CCC(=O)Nc1c(C)nn(-c2ccccc2)c1C)C1CC1	ZINC000271545720	201244714	/nfs/dbraw/zinc/24/47/14/201244714.db2.gz	ZOBXFGVGZLJOJT-UHFFFAOYSA-N	0	3	338.455	3.468	20	30		EGEDHN
C#CC[C@@H](N[C@H](C)c1ccc(S(=O)(=O)NC)cc1)c1ccccc1	ZINC000271593406	201244848	/nfs/dbraw/zinc/24/48/48/201244848.db2.gz	YOUWSBRXSWERJY-DNVCBOLYSA-N	0	3	342.464	3.010	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NC1CCN(Cc2ccccc2C)CC1)OCC	ZINC000270015729	201234598	/nfs/dbraw/zinc/23/45/98/201234598.db2.gz	HDOMODVHSKSNDI-HXUWFJFHSA-N	0	3	344.499	3.447	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C)OCC	ZINC000270204409	201237061	/nfs/dbraw/zinc/23/70/61/201237061.db2.gz	QWGFXWCOMSWSNR-SXLOBPIMSA-N	0	3	344.499	3.385	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NC[C@H](c1cccs1)N1CCCC1)OCC	ZINC000270136918	201237679	/nfs/dbraw/zinc/23/76/79/201237679.db2.gz	QPBWTQKUZJCLCE-HZPDHXFCSA-N	0	3	336.501	3.373	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000275682286	201285276	/nfs/dbraw/zinc/28/52/76/201285276.db2.gz	ZIUBVVXWNBVDOB-FBBABVLZSA-N	0	3	344.499	3.242	20	30		EGEDHN
C=CCc1cc(CNC[C@@H](O)c2ccc(F)cc2)cc(OC)c1O	ZINC000277775553	201303534	/nfs/dbraw/zinc/30/35/34/201303534.db2.gz	UMCFXJQDWMLSKZ-QGZVFWFLSA-N	0	3	331.387	3.092	20	30		EGEDHN
C=CCC[C@@H](CC)N[C@H](C(N)=O)c1cccc(Br)c1	ZINC000279592175	201318841	/nfs/dbraw/zinc/31/88/41/201318841.db2.gz	CRKXYBYLGCYGMG-KGLIPLIRSA-N	0	3	325.250	3.310	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H]2C[C@H](c3ccc(Cl)cc3)C2)CC1	ZINC000279881746	201322237	/nfs/dbraw/zinc/32/22/37/201322237.db2.gz	BKVWYJGXFHNCPW-SAABIXHNSA-N	0	3	330.859	3.047	20	30		EGEDHN
COc1cc(C#N)ccc1CN1CC[C@@H]2[C@@H](CCCN2C2CC2)C1	ZINC000246058867	243185086	/nfs/dbraw/zinc/18/50/86/243185086.db2.gz	YCQIXDUQMXRODH-QFBILLFUSA-N	0	3	325.456	3.016	20	30		EGEDHN
Cc1cc(C(=O)N(CCN(C)C)Cc2cccc(C#N)c2)ccc1F	ZINC000103432697	204077926	/nfs/dbraw/zinc/07/79/26/204077926.db2.gz	ZPHJCTJGJFIHTN-UHFFFAOYSA-N	0	3	339.414	3.210	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccnn2[C@H](C)C2CC2)CC1	ZINC000156421685	205084562	/nfs/dbraw/zinc/08/45/62/205084562.db2.gz	XOMBZKHHQIPNLK-CQSZACIVSA-N	0	3	331.464	3.016	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC[C@@H](C)c2ccc(F)cc2)CC1	ZINC000264429688	246492656	/nfs/dbraw/zinc/49/26/56/246492656.db2.gz	ZINQEKRJSADSQH-OAHLLOKOSA-N	0	3	333.451	3.269	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)o1)Oc1cccc(Br)c1	ZINC000266143711	248127918	/nfs/dbraw/zinc/12/79/18/248127918.db2.gz	IABMWRTWMNGHSI-LLVKDONJSA-N	0	3	335.201	3.471	20	30		EGEDHN
CC(C)(O)CN1CCc2c(cccc2NCc2ccc(C#N)cc2)C1	ZINC000378644165	169151601	/nfs/dbraw/zinc/15/16/01/169151601.db2.gz	CEMUVQPECBUVHF-UHFFFAOYSA-N	0	3	335.451	3.299	20	30		EGEDHN
Cc1sc(NC(=O)CN(C[C@@H](C)O)C2CCCCC2)c(C#N)c1C	ZINC000267420622	251042505	/nfs/dbraw/zinc/04/25/05/251042505.db2.gz	WFLNYXJSXZMAMN-GFCCVEGCSA-N	0	3	349.500	3.191	20	30		EGEDHN
COC(=O)[C@@]1(c2ccccc2)CCN(Cc2ccc(F)c(C#N)c2)C1	ZINC000428805223	269709980	/nfs/dbraw/zinc/70/99/80/269709980.db2.gz	WARKBTULJUXXLW-FQEVSTJZSA-N	0	3	338.382	3.014	20	30		EGEDHN
CC(C)CCO[C@@H]1CCN(CCC(=O)Nc2ccccc2C#N)C1	ZINC000177372908	207327859	/nfs/dbraw/zinc/32/78/59/207327859.db2.gz	CTHJXUNOSZWDAS-QGZVFWFLSA-N	0	3	329.444	3.024	20	30		EGEDHN
CC(C)(C)c1ccc(-c2ccc(CNCCn3cnc(C#N)n3)o2)cc1	ZINC000353014197	141285484	/nfs/dbraw/zinc/28/54/84/141285484.db2.gz	CHGWZEFCVBPCBB-UHFFFAOYSA-N	0	3	349.438	3.497	20	30		EGEDHN
COc1cccc(CNC2CCC(Oc3ccccc3C#N)CC2)n1	ZINC000359713297	141408404	/nfs/dbraw/zinc/40/84/04/141408404.db2.gz	HXYZZQVTFGFWMT-UHFFFAOYSA-N	0	3	337.423	3.442	20	30		EGEDHN
CN(Cc1ccccc1)[C@H]1CCN(C(=O)c2cccc(F)c2C#N)C1	ZINC000363770175	144364262	/nfs/dbraw/zinc/36/42/62/144364262.db2.gz	SWOZRKTVLPSHQE-INIZCTEOSA-N	0	3	337.398	3.044	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@H](c3nc(C4CC4)n[nH]3)C2)c1F	ZINC000341136032	155181546	/nfs/dbraw/zinc/18/15/46/155181546.db2.gz	ZHMURWRNIJHVRA-HNNXBMFYSA-N	0	3	325.391	3.072	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@H](c3n[nH]c(C4CC4)n3)C2)c1F	ZINC000341136032	155181549	/nfs/dbraw/zinc/18/15/49/155181549.db2.gz	ZHMURWRNIJHVRA-HNNXBMFYSA-N	0	3	325.391	3.072	20	30		EGEDHN
N#Cc1cccc(CCNCc2cc(O)ccc2Br)c1	ZINC000341494989	155323664	/nfs/dbraw/zinc/32/36/64/155323664.db2.gz	XETOOEBWFLWHNL-UHFFFAOYSA-N	0	3	331.213	3.359	20	30		EGEDHN
Cc1nn2c(nc(C(C)C)c2CNCCc2cccc(C#N)c2)s1	ZINC000341495152	155324392	/nfs/dbraw/zinc/32/43/92/155324392.db2.gz	XYELTSHEEQKSBJ-UHFFFAOYSA-N	0	3	339.468	3.427	20	30		EGEDHN
CC1CCC(N2CCN(CCOc3ccc(C#N)cc3)CC2)CC1	ZINC000115567494	152020952	/nfs/dbraw/zinc/02/09/52/152020952.db2.gz	DPNYNQWJIRMDGE-UHFFFAOYSA-N	0	3	327.472	3.133	20	30		EGEDHN
C[C@H]1CN(CC2CCN(Cc3ccc(C#N)c(F)c3)CC2)C[C@H](C)O1	ZINC000191984260	153235544	/nfs/dbraw/zinc/23/55/44/153235544.db2.gz	CXENKFXVFATMKM-HOTGVXAUSA-N	0	3	345.462	3.019	20	30		EGEDHN
C[C@H](NC(=O)c1cccc(F)c1C#N)[C@H](c1ccccc1)N(C)C	ZINC000193654181	153299460	/nfs/dbraw/zinc/29/94/60/153299460.db2.gz	PAUJOCHJSKIKFK-SCLBCKFNSA-N	0	3	325.387	3.119	20	30		EGEDHN
Cc1cccc(OC[C@H](O)CN[C@H](C)c2ccc(C#N)c(F)c2)c1	ZINC000271944337	154001169	/nfs/dbraw/zinc/00/11/69/154001169.db2.gz	PNQMIUXTHJMCQC-RHSMWYFYSA-N	0	3	328.387	3.096	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN(C)CCOc1cccc(C)c1	ZINC000303811246	154056277	/nfs/dbraw/zinc/05/62/77/154056277.db2.gz	IJMPGXCBAGFXKG-UHFFFAOYSA-N	0	3	340.423	3.265	20	30		EGEDHN
CC(C)N(Cc1cccs1)C[C@@H](O)COc1ccc(C#N)cc1	ZINC000336865176	154221256	/nfs/dbraw/zinc/22/12/56/154221256.db2.gz	UXJPVUOXQUFSGX-MRXNPFEDSA-N	0	3	330.453	3.270	20	30		EGEDHN
C[C@H](NCCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(C#N)cc1	ZINC000336964658	154247078	/nfs/dbraw/zinc/24/70/78/154247078.db2.gz	IHHLOVKKSNHEAK-ZDUSSCGKSA-N	0	3	338.367	3.146	20	30		EGEDHN
CN(Cc1cc2ccccc2o1)C[C@H](O)COc1ccc(C#N)cc1	ZINC000127276147	162327035	/nfs/dbraw/zinc/32/70/35/162327035.db2.gz	ZXKIGKUJFQFIOV-KRWDZBQOSA-N	0	3	336.391	3.176	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCCN(C(=O)CCC(F)(F)F)C2)s1	ZINC000342186886	163808815	/nfs/dbraw/zinc/80/88/15/163808815.db2.gz	FFLBIYZKKYPMCD-LLVKDONJSA-N	0	3	345.390	3.043	20	30		EGEDHN
CCCN(CCN1CCN(CC)CC1)Cc1ccc(C#N)cc1Cl	ZINC000344137238	164112624	/nfs/dbraw/zinc/11/26/24/164112624.db2.gz	VORDUPUANWOEEB-UHFFFAOYSA-N	0	3	348.922	3.061	20	30		EGEDHN
Cc1cccc(CN[C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)c1C	ZINC000355780343	166306141	/nfs/dbraw/zinc/30/61/41/166306141.db2.gz	VSMJAXYDQONZLC-HXUWFJFHSA-N	0	3	333.435	3.460	20	30		EGEDHN
COc1cccc(CN(CCN(C)C)c2cccc(F)c2C#N)c1	ZINC000357674777	166741292	/nfs/dbraw/zinc/74/12/92/166741292.db2.gz	OYRDRKCSTWQCMO-UHFFFAOYSA-N	0	3	327.403	3.274	20	30		EGEDHN
CC[C@H](N[C@H]1CCCN(c2ccc(C#N)cc2F)C1)c1nccn1C	ZINC000367746120	168265692	/nfs/dbraw/zinc/26/56/92/168265692.db2.gz	FASLQGDGRSQWBL-RDJZCZTQSA-N	0	3	341.434	3.141	20	30		EGEDHN
COc1ccc(CNC[C@H](c2ccco2)N2CCCC2)cc1C#N	ZINC000124928365	222497581	/nfs/dbraw/zinc/49/75/81/222497581.db2.gz	HGTOGTMRRQCUMU-QGZVFWFLSA-N	0	3	325.412	3.087	20	30		EGEDHN
CC(C)Oc1ccccc1CNC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000279444225	270039844	/nfs/dbraw/zinc/03/98/44/270039844.db2.gz	YVRCDXPFMHRVDM-IBGZPJMESA-N	0	3	347.418	3.344	20	30		EGEDHN
C#CCCOc1ccc(CN2CC[C@H](Oc3ccc(C#N)cn3)C2)cc1	ZINC000366544096	270045814	/nfs/dbraw/zinc/04/58/14/270045814.db2.gz	KUSOQGFHIWCGJV-FQEVSTJZSA-N	0	3	347.418	3.009	20	30		EGEDHN
CSc1ccc(OC[C@@H](O)CN(C)Cc2cccc(C#N)c2)cc1	ZINC000411132072	270046786	/nfs/dbraw/zinc/04/67/86/270046786.db2.gz	KQACDFVWNCDCAZ-KRWDZBQOSA-N	0	3	342.464	3.152	20	30		EGEDHN
N#Cc1cccc(COc2cccc(CNC[C@H](O)C3CCC3)c2)c1	ZINC000449738519	270052849	/nfs/dbraw/zinc/05/28/49/270052849.db2.gz	CNJXNJOUNLASBJ-NRFANRHFSA-N	0	3	336.435	3.388	20	30		EGEDHN
N#Cc1ccccc1OCCN(CCCO)Cc1cccc(Cl)c1	ZINC000441074332	270051958	/nfs/dbraw/zinc/05/19/58/270051958.db2.gz	ZLNVRMUARYAOJF-UHFFFAOYSA-N	0	3	344.842	3.475	20	30		EGEDHN
Cc1cc(N(C)[C@@H]2CCCN(C)C2)n2c3ccccc3nc2c1C#N	ZINC000525128942	270059698	/nfs/dbraw/zinc/05/96/98/270059698.db2.gz	UJNJIEKZZZQIFW-OAHLLOKOSA-N	0	3	333.439	3.198	20	30		EGEDHN
N#Cc1ccccc1OCC(=O)N(CCN1CCCC1)c1ccccc1	ZINC000523542687	270059734	/nfs/dbraw/zinc/05/97/34/270059734.db2.gz	FOYWCLMRMWAINS-UHFFFAOYSA-N	0	3	349.434	3.066	20	30		EGEDHN
N#Cc1c(F)cccc1C(=O)NC[C@@H](c1ccccc1)N1CCCC1	ZINC000187506100	265604736	/nfs/dbraw/zinc/60/47/36/265604736.db2.gz	OJGSZGGRQMDQEW-IBGZPJMESA-N	0	3	337.398	3.264	20	30		EGEDHN
CCC[C@@H]1CN(c2c(C#N)cnc3ccccc32)CCN1CCOC	ZINC000301914367	266070374	/nfs/dbraw/zinc/07/03/74/266070374.db2.gz	IENQFYKEBVYPHN-QGZVFWFLSA-N	0	3	338.455	3.044	20	30		EGEDHN
CCN(CC)CCOC(=O)c1cccc(NCc2ccc(C#N)o2)c1	ZINC000285142189	266115041	/nfs/dbraw/zinc/11/50/41/266115041.db2.gz	OQNCRYWTYBAUSS-UHFFFAOYSA-N	0	3	341.411	3.262	20	30		EGEDHN
CCN1CCO[C@@H](CNCc2ccc(C#N)cc2)[C@@H]1c1ccccc1	ZINC000284823015	266153071	/nfs/dbraw/zinc/15/30/71/266153071.db2.gz	VAWQCRFHBACYBW-SFTDATJTSA-N	0	3	335.451	3.110	20	30		EGEDHN
CCCN(CCc1cccs1)[C@@H](C(N)=O)c1ccc(C#N)cc1	ZINC000411546606	267013233	/nfs/dbraw/zinc/01/32/33/267013233.db2.gz	BEIFABFDWUMLOS-QGZVFWFLSA-N	0	3	327.453	3.101	20	30		EGEDHN
C[C@@H]1C[C@H](N[C@H]2CCN(Cc3ccc(C#N)cc3)C2=O)c2ccccc21	ZINC000290154916	267090953	/nfs/dbraw/zinc/09/09/53/267090953.db2.gz	CWLKSDVEUMXUCB-NQERJWCQSA-N	0	3	345.446	3.497	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2ccccc2-c2ccccc2C#N)CCN1C	ZINC000331370829	267091725	/nfs/dbraw/zinc/09/17/25/267091725.db2.gz	GHLJJJINJLXTOY-NVXWUHKLSA-N	0	3	333.435	3.438	20	30		EGEDHN
CCOC(=O)C(C)(C)C1CCN(CCOc2ccc(C#N)cc2)CC1	ZINC000510088089	267112021	/nfs/dbraw/zinc/11/20/21/267112021.db2.gz	RUNTYKJRLTXQOC-UHFFFAOYSA-N	0	3	344.455	3.238	20	30		EGEDHN
CCOC(=O)C(C)(C)C1CCN(Cc2ccc(OC)c(C#N)c2)CC1	ZINC000510079143	267113422	/nfs/dbraw/zinc/11/34/22/267113422.db2.gz	OANZISIZCJAKON-UHFFFAOYSA-N	0	3	344.455	3.368	20	30		EGEDHN
CCOc1ccc2c(c1)CCN(CCC(=O)Nc1ccccc1C#N)C2	ZINC000441068483	267172555	/nfs/dbraw/zinc/17/25/55/267172555.db2.gz	NLWZZINLIRBFKW-UHFFFAOYSA-N	0	3	349.434	3.344	20	30		EGEDHN
CCS[C@@H]1CCCC[C@H]1N[C@H]1CCN(c2ccc(C#N)cc2)C1=O	ZINC000411564009	267181205	/nfs/dbraw/zinc/18/12/05/267181205.db2.gz	VOCOOCKJLDIDRU-FGTMMUONSA-N	0	3	343.496	3.317	20	30		EGEDHN
C[C@H](CCN1CCN(C)CC1)Nc1ccc(C(F)(F)F)cc1C#N	ZINC000274500520	267248293	/nfs/dbraw/zinc/24/82/93/267248293.db2.gz	RWGVGLIZQADHHT-CYBMUJFWSA-N	0	3	340.393	3.015	20	30		EGEDHN
CN(C(=O)C(C#N)Cc1ccc(C#N)cc1)C1CC(OC(C)(C)C)C1	ZINC000421690920	267275725	/nfs/dbraw/zinc/27/57/25/267275725.db2.gz	ULFFNFNKZNMLGR-WWDZGPRUSA-N	0	3	339.439	3.045	20	30		EGEDHN
CN(C)CC1(NC(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)CCC1	ZINC000439447647	267279474	/nfs/dbraw/zinc/27/94/74/267279474.db2.gz	FGEZUJFTADPNRQ-UHFFFAOYSA-N	0	3	340.349	3.183	20	30		EGEDHN
CN(C)Cc1cccc(CNC(=O)c2cc(C#N)ccc2Cl)c1	ZINC000505415641	267283785	/nfs/dbraw/zinc/28/37/85/267283785.db2.gz	PMHUXXAEYYLTSW-UHFFFAOYSA-N	0	3	327.815	3.203	20	30		EGEDHN
CN(CC(=O)NCc1ccc(C#N)cc1)[C@@H]1CCC[C@@H]1C(C)(C)C	ZINC000419327230	267297658	/nfs/dbraw/zinc/29/76/58/267297658.db2.gz	NMSBQHQHDSEDDQ-ZWKOTPCHSA-N	0	3	327.472	3.321	20	30		EGEDHN
Cc1cc([C@H](C)NC[C@H](O)COc2ccc(C#N)cc2)c(C)s1	ZINC000193131532	267364429	/nfs/dbraw/zinc/36/44/29/267364429.db2.gz	GQIOCWKOPSUWQK-BBRMVZONSA-N	0	3	330.453	3.327	20	30		EGEDHN
COCCN(CC(=O)Nc1cc(Cl)ccc1C#N)[C@@H]1CCC[C@@H]1C	ZINC000487948769	267453606	/nfs/dbraw/zinc/45/36/06/267453606.db2.gz	ARCBTPVSLPNYNA-SUMWQHHRSA-N	0	3	349.862	3.287	20	30		EGEDHN
CS(=O)(=O)c1ccc(CN[C@H]2CCCc3cc(C#N)ccc32)cc1	ZINC000516592135	267665391	/nfs/dbraw/zinc/66/53/91/267665391.db2.gz	WTRMYBQSIBRTCN-IBGZPJMESA-N	0	3	340.448	3.129	20	30		EGEDHN
Cc1cc(Cl)c2ncc(C#N)c(N3C[C@H]4CCN(C)[C@H]4C3)c2c1	ZINC000450773567	268002804	/nfs/dbraw/zinc/00/28/04/268002804.db2.gz	AXVBWWGZZVKTKK-WBMJQRKESA-N	0	3	326.831	3.209	20	30		EGEDHN
Cc1ccc(C)c(CN[C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)c1	ZINC000503965069	268032861	/nfs/dbraw/zinc/03/28/61/268032861.db2.gz	WGBZNORJKIUSRK-HXUWFJFHSA-N	0	3	333.435	3.460	20	30		EGEDHN
Cc1ccc([C@@H](CNC(=O)[C@@H]2C[C@H]2c2cccc(C#N)c2)N(C)C)cc1	ZINC000411688651	268043891	/nfs/dbraw/zinc/04/38/91/268043891.db2.gz	CTTLTWYIECNOJN-PWRODBHTSA-N	0	3	347.462	3.389	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCc2c(F)cccc2Cl)cc1	ZINC000348063700	268084772	/nfs/dbraw/zinc/08/47/72/268084772.db2.gz	GNCNOCKVFXSGKN-AWEZNQCLSA-N	0	3	341.773	3.349	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCCc2ccc3[nH]ccc3c2)cc1	ZINC000337779512	268085175	/nfs/dbraw/zinc/08/51/75/268085175.db2.gz	LLHUJBGEEWYZEF-IBGZPJMESA-N	0	3	342.402	3.081	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NC[C@@H]2CCc3ccccc32)cc1	ZINC000348229057	268085466	/nfs/dbraw/zinc/08/54/66/268085466.db2.gz	LMBXNFSUODCTFR-OALUTQOASA-N	0	3	329.403	3.087	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CC[C@@H](Cc3ccccc3)C2)cc1	ZINC000280516198	268089604	/nfs/dbraw/zinc/08/96/04/268089604.db2.gz	RPRQFOMJWFGDRZ-LEWJYISDSA-N	0	3	343.430	3.332	20	30		EGEDHN
N#Cc1ccnc(N[C@H](CN2CCCC2)c2ccccc2)c1Cl	ZINC000429215427	268196693	/nfs/dbraw/zinc/19/66/93/268196693.db2.gz	PJXRJMXEORHSMA-MRXNPFEDSA-N	0	3	326.831	3.278	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H]2[C@@H]2CCC[C@H]2O)c(Br)c1	ZINC000451415652	268219651	/nfs/dbraw/zinc/21/96/51/268219651.db2.gz	FOJQMLYXVYUCPW-USXIJHARSA-N	0	3	349.272	3.446	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)c(F)c1	ZINC000425348406	268224058	/nfs/dbraw/zinc/22/40/58/268224058.db2.gz	JIXGMSDKNUZOJD-PZJWPPBQSA-N	0	3	335.426	3.404	20	30		EGEDHN
N#Cc1ccccc1-c1ccc(CN2C[C@@H]3CCC[C@H]3[C@H]2C(N)=O)cc1	ZINC000527056173	268294621	/nfs/dbraw/zinc/29/46/21/268294621.db2.gz	SQDDHLOHOULSTF-TYPHKJRUSA-N	0	3	345.446	3.311	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CN1CCC[C@H]1c1cccc(F)c1	ZINC000528350183	268300320	/nfs/dbraw/zinc/30/03/20/268300320.db2.gz	DAURFQUBPCDZHZ-MOPGFXCFSA-N	0	3	340.398	3.274	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@H]2c2ccc(F)cc2)CC1	ZINC000065590293	273485455	/nfs/dbraw/zinc/48/54/55/273485455.db2.gz	FZZYPKQEQJTECR-SFHVURJKSA-N	0	3	331.435	3.323	20	30		EGEDHN
N#Cc1ccc(CNCCOc2ccc(Br)cc2)cc1	ZINC000049596036	275149211	/nfs/dbraw/zinc/14/92/11/275149211.db2.gz	QVSLKGACACZNIZ-UHFFFAOYSA-N	0	3	331.213	3.489	20	30		EGEDHN
CCN(CCN1CCCCCC1)C(=O)[C@H](C)Oc1ccc(C#N)cc1	ZINC000346350435	276124519	/nfs/dbraw/zinc/12/45/19/276124519.db2.gz	RQCGYMRZLOIPJJ-KRWDZBQOSA-N	0	3	343.471	3.050	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)C[C@@H](C)c1c(C)n[nH]c1C)C(C)C	ZINC000270648902	277847553	/nfs/dbraw/zinc/84/75/53/277847553.db2.gz	AXWIXHHRAXIPFI-QAPCUYQASA-N	0	3	346.519	3.335	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)NCC1(C)CCCC1	ZINC000066704917	307363014	/nfs/dbraw/zinc/36/30/14/307363014.db2.gz	BHGVNJSBAZOGHD-UHFFFAOYSA-N	0	3	342.487	3.212	20	30		EGEDHN
C[C@]1(NCC(=O)NCc2ccc(C#N)cc2)CCCc2ccccc21	ZINC000537605817	314194957	/nfs/dbraw/zinc/19/49/57/314194957.db2.gz	RTSXILSNTCEPIX-NRFANRHFSA-N	0	3	333.435	3.016	20	30		EGEDHN
CC(C)CN(C(=O)[C@@H](C1CC1)N1CCCC1)c1ccc(C#N)cc1	ZINC000546789499	314858287	/nfs/dbraw/zinc/85/82/87/314858287.db2.gz	QIJBYCNNIDTKTA-LJQANCHMSA-N	0	3	325.456	3.422	20	30		EGEDHN
C=C(C)COCCNCC1=Cc2cc(Br)ccc2OC1	ZINC000134508511	454552461	/nfs/dbraw/zinc/55/24/61/454552461.db2.gz	QVMXWKKXBHODCD-UHFFFAOYSA-N	0	3	338.245	3.407	20	30		EGEDHN
N#Cc1cnn2c1NC[C@H](CN[C@H](CC(F)(F)F)c1ccccc1)C2	ZINC000561220755	315749677	/nfs/dbraw/zinc/74/96/77/315749677.db2.gz	BKYVIUIEKMAQBD-SWLSCSKDSA-N	0	3	349.360	3.080	20	30		EGEDHN
Cc1csc(NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)c1C#N	ZINC000563355658	316004654	/nfs/dbraw/zinc/00/46/54/316004654.db2.gz	MLPHIMSTJVLTEY-OAHLLOKOSA-N	0	3	346.431	3.492	20	30		EGEDHN
CN1CCC(N(Cc2ccccc2)C(=O)Nc2cccc(C#N)n2)CC1	ZINC000564082158	316110846	/nfs/dbraw/zinc/11/08/46/316110846.db2.gz	VRXMGBMTZGJHSY-UHFFFAOYSA-N	0	3	349.438	3.082	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN[C@@H]2CCc3c2cccc3Cl)cc1	ZINC000566059646	316409547	/nfs/dbraw/zinc/40/95/47/316409547.db2.gz	QLLCMUXSNBVYNJ-AUUYWEPGSA-N	0	3	342.826	3.228	20	30		EGEDHN
CCCCO[C@@H]1C[C@H](N[C@H](C)C(=O)Nc2ccccc2C#N)C1(C)C	ZINC000568681309	316806833	/nfs/dbraw/zinc/80/68/33/316806833.db2.gz	CMANIBJZGAFOCS-FHLIZLRMSA-N	0	3	343.471	3.459	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)c2ncc(C#N)cc2C)N2CCCC2)cc1	ZINC000572979574	317420670	/nfs/dbraw/zinc/42/06/70/317420670.db2.gz	QRGNNTPSPAIOBW-IBGZPJMESA-N	0	3	348.450	3.137	20	30		EGEDHN
COc1ccc([C@H](CNCc2cc(C#N)cs2)N(C)C)cc1OC	ZINC000177680888	323343416	/nfs/dbraw/zinc/34/34/16/323343416.db2.gz	DNWFNDNOEHRSIM-INIZCTEOSA-N	0	3	345.468	3.029	20	30		EGEDHN
CCCN(CCN1CCCCCC1)C(=O)Cc1ccc(C#N)cc1	ZINC000581334916	325352599	/nfs/dbraw/zinc/35/25/99/325352599.db2.gz	NVRAWHYOIUBZDM-UHFFFAOYSA-N	0	3	327.472	3.215	20	30		EGEDHN
C=CCN1CCC(Nc2ccc(Br)cc2[N+](=O)[O-])CC1	ZINC000301151217	456807343	/nfs/dbraw/zinc/80/73/43/456807343.db2.gz	AHYKWPILUWNYDB-UHFFFAOYSA-N	0	3	340.221	3.420	20	30		EGEDHN
CCS[C@@H]1CCCCN([C@H](C)C(=O)N[C@@](C)(C#N)C(C)C)C1	ZINC000331936463	457276530	/nfs/dbraw/zinc/27/65/30/457276530.db2.gz	WYNUZFFMSDBIFF-INMHGKMJSA-N	0	3	325.522	3.037	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/C[C@H](O)c2cccc(OC)c2)c([O-])c1	ZINC000264664487	455258734	/nfs/dbraw/zinc/25/87/34/455258734.db2.gz	RXBDGEGAAUCMGP-DZSVRRGNSA-N	0	3	342.439	3.400	20	30		EGEDHN
C=C[C@@](C)(O)C(=O)Nc1ccc(SCCN2CCCCC2)cc1	ZINC000616475906	460565147	/nfs/dbraw/zinc/56/51/47/460565147.db2.gz	CDXZWSPBQXCTGW-GOSISDBHSA-N	0	3	334.485	3.140	20	30		EGEDHN
C=CC1CCN(CC(=O)N2CCC(Cc3ccccc3)CC2)CC1	ZINC000600683402	460567644	/nfs/dbraw/zinc/56/76/44/460567644.db2.gz	WYWQNNMMZMSOCN-UHFFFAOYSA-N	0	3	326.484	3.366	20	30		EGEDHN
COc1cccc([C@H](CNc2ccc([N+](=O)[O-])cc2C#N)N(C)C)c1	ZINC000006250203	452928507	/nfs/dbraw/zinc/92/85/07/452928507.db2.gz	NHMSUFLBZZMARB-SFHVURJKSA-N	0	3	340.383	3.190	20	30		EGEDHN
CCC1(CC)[C@H](N[C@H](C)C(=O)Nc2ccccc2C#N)[C@@H](C)[C@@H]1OC	ZINC000245596983	455337594	/nfs/dbraw/zinc/33/75/94/455337594.db2.gz	IWGZCTNEZVNCDP-DTDBQYNISA-N	0	3	343.471	3.315	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CN[C@@H]1C[C@H]1c1cccc(Cl)c1	ZINC000600735616	460584087	/nfs/dbraw/zinc/58/40/87/460584087.db2.gz	MPFITWDCCMWHML-OKZBNKHCSA-N	0	3	342.826	3.097	20	30		EGEDHN
N#Cc1ccc(OCCN2CCC[C@H](C(=O)Nc3ccccc3)C2)cc1	ZINC000012284481	453353988	/nfs/dbraw/zinc/35/39/88/453353988.db2.gz	KHFFLUACWBXLNA-SFHVURJKSA-N	0	3	349.434	3.288	20	30		EGEDHN
C[C@@H](CC1(C#N)CCOCC1)NC[C@@H](c1ccco1)N1CCCC1	ZINC000600848179	460621131	/nfs/dbraw/zinc/62/11/31/460621131.db2.gz	DLQSQVYOBAPOLL-IRXDYDNUSA-N	0	3	331.460	3.105	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN1CCC[C@H](c2ccccc2)CC1	ZINC000066897818	453884547	/nfs/dbraw/zinc/88/45/47/453884547.db2.gz	WRLHZDCVZBDOFM-HKUYNNGSSA-N	0	3	327.472	3.264	20	30		EGEDHN
Cc1nc(COc2ccc(CNCc3cccc(C#N)c3)cc2)no1	ZINC000066971904	453891734	/nfs/dbraw/zinc/89/17/34/453891734.db2.gz	VMGMXTMHOFSMPO-UHFFFAOYSA-N	0	3	334.379	3.119	20	30		EGEDHN
CC[C@@H](Cc1ccc(C)cc1)N(C)CC(=O)N[C@@](C)(C#N)C(C)C	ZINC000075886098	453936037	/nfs/dbraw/zinc/93/60/37/453936037.db2.gz	OTTLRTVMQSWVLQ-ICSRJNTNSA-N	0	3	329.488	3.302	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](c2ncccc2C)C(C)C)CC1	ZINC000076016569	453949154	/nfs/dbraw/zinc/94/91/54/453949154.db2.gz	NRQVWQMVKSRSFG-KRWDZBQOSA-N	0	3	330.476	3.037	20	30		EGEDHN
N#CC(C(=O)c1csc2c1CCCC2)c1nnc2n1CCCCC2	ZINC000041510503	453969792	/nfs/dbraw/zinc/96/97/92/453969792.db2.gz	AWOYZRAUAVFEBY-CYBMUJFWSA-N	0	3	340.452	3.435	20	30		EGEDHN
CN(CCCOc1ccc([N+](=O)[O-])cc1)Cc1cccc(C#N)c1	ZINC000055901780	454024033	/nfs/dbraw/zinc/02/40/33/454024033.db2.gz	OWKXFAVAGSDDGA-UHFFFAOYSA-N	0	3	325.368	3.367	20	30		EGEDHN
Cc1cc(N2CCN(c3cc(C#N)ccn3)CC2)c2ccccc2n1	ZINC000043536437	454067068	/nfs/dbraw/zinc/06/70/68/454067068.db2.gz	WJDRIHKOAOPFSN-UHFFFAOYSA-N	0	3	329.407	3.137	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)NCC(C)(C)N1CCCCC1	ZINC000056553006	454067519	/nfs/dbraw/zinc/06/75/19/454067519.db2.gz	JOHRCVOIUXGVDG-UHFFFAOYSA-N	0	3	344.459	3.343	20	30		EGEDHN
C=CCC[C@H](O)CN(C)[C@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O	ZINC000245982033	455408953	/nfs/dbraw/zinc/40/89/53/455408953.db2.gz	DDVVHYPWYPWORV-UVBJJODRSA-N	0	3	330.255	3.210	20	30		EGEDHN
CCN(CCOc1ccc(C#N)cc1)C[C@@H]1COc2ccccc2O1	ZINC000069286488	454092185	/nfs/dbraw/zinc/09/21/85/454092185.db2.gz	ZNAAPBQXMWVABS-GOSISDBHSA-N	0	3	338.407	3.099	20	30		EGEDHN
C[C@H](N[C@@H]1CCCN(Cc2ccccc2)C1=O)c1ccc(C#N)cc1	ZINC000089596474	454165819	/nfs/dbraw/zinc/16/58/19/454165819.db2.gz	CKAFSZYLXNKQEB-OXJNMPFZSA-N	0	3	333.435	3.400	20	30		EGEDHN
N#Cc1ccc(N2CCN(c3ccncc3)CC2)c(C(F)(F)F)c1	ZINC000077905874	454167983	/nfs/dbraw/zinc/16/79/83/454167983.db2.gz	RAFGYDHCAVTGJO-UHFFFAOYSA-N	0	3	332.329	3.299	20	30		EGEDHN
CC(C)(C)c1cnc(CO/N=C/c2ccc(N3CCOCC3)cc2)o1	ZINC000130244546	454184056	/nfs/dbraw/zinc/18/40/56/454184056.db2.gz	VVQUGZBEMLUPJU-CIAFOILYSA-N	0	3	343.427	3.359	20	30		EGEDHN
C[C@H](N[C@H]1CC(C)(C)OC1(C)C)C(=O)N(C)C1(C#N)CCC(C)CC1	ZINC000119693413	454213712	/nfs/dbraw/zinc/21/37/12/454213712.db2.gz	IUZUCHBEMWILJW-FZTQNYJHSA-N	0	3	349.519	3.241	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN(C)Cc1cccc(N(C)C)c1	ZINC000089922654	454236108	/nfs/dbraw/zinc/23/61/08/454236108.db2.gz	FNRYQUULFOUDLH-UHFFFAOYSA-N	0	3	339.439	3.144	20	30		EGEDHN
C[C@@H](C(=O)N(CCC#N)c1ccccc1)N(C)CCC1CCOCC1	ZINC000120571576	454320540	/nfs/dbraw/zinc/32/05/40/454320540.db2.gz	KPTUBEYOWGKXNP-KRWDZBQOSA-N	0	3	343.471	3.070	20	30		EGEDHN
N#CC(C(=O)c1cc(Br)cc([N+](=O)[O-])c1)c1ccccn1	ZINC000132627602	454353926	/nfs/dbraw/zinc/35/39/26/454353926.db2.gz	XSIMASVAKYCXFQ-GFCCVEGCSA-N	0	3	346.140	3.242	20	30		EGEDHN
CC[C@H]1CCCCN1CCNC(=O)C(C)(C)Oc1ccc(C#N)cc1	ZINC000132725130	454361290	/nfs/dbraw/zinc/36/12/90/454361290.db2.gz	GUOBRPYAGNZGPI-KRWDZBQOSA-N	0	3	343.471	3.096	20	30		EGEDHN
CN(C)[C@H](CNC(=O)N(C)Cc1cccc(C#N)c1)c1ccccc1	ZINC000079121274	454371921	/nfs/dbraw/zinc/37/19/21/454371921.db2.gz	WLNYVELSZKFXJE-LJQANCHMSA-N	0	3	336.439	3.003	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cnn(CCC(C)C)c2C)CC1	ZINC000132902071	454376207	/nfs/dbraw/zinc/37/62/07/454376207.db2.gz	NEFIINTWNMHIQH-UHFFFAOYSA-N	0	3	332.492	3.008	20	30		EGEDHN
Cn1cnc2cc(C(=O)C(C#N)c3ccc(C(F)(F)F)cn3)ccc21	ZINC000097038919	454393642	/nfs/dbraw/zinc/39/36/42/454393642.db2.gz	UICMQNCATFESQT-GFCCVEGCSA-N	0	3	344.296	3.477	20	30		EGEDHN
CC[C@@H](NCC(=O)N(CCC#N)CCC#N)c1ccc(Cl)cc1	ZINC000097258871	454429500	/nfs/dbraw/zinc/42/95/00/454429500.db2.gz	NFFHVCJYCPCABZ-MRXNPFEDSA-N	0	3	332.835	3.037	20	30		EGEDHN
Cc1cc(C)c(C#N)c(NCC2(N3CCSCC3)CCCC2)n1	ZINC000097286632	454431028	/nfs/dbraw/zinc/43/10/28/454431028.db2.gz	CJEYINXFTFMEPE-UHFFFAOYSA-N	0	3	330.501	3.344	20	30		EGEDHN
N#CCSc1cccc(C(=O)N2CCC[C@@H](N3CCCC3)C2)c1	ZINC000079533939	454432872	/nfs/dbraw/zinc/43/28/72/454432872.db2.gz	XMDMZLJWLRFIER-MRXNPFEDSA-N	0	3	329.469	3.003	20	30		EGEDHN
COCCN(CCc1ccc([N+](=O)[O-])cc1)Cc1ccc(C#N)cc1	ZINC000063753783	454444990	/nfs/dbraw/zinc/44/49/90/454444990.db2.gz	QDMLZLWPBPCLCP-UHFFFAOYSA-N	0	3	339.395	3.158	20	30		EGEDHN
C[C@H](CN1CCC[C@H](C)C1)NC(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000133862924	454476789	/nfs/dbraw/zinc/47/67/89/454476789.db2.gz	DUPRUFSMFQFBQG-SCTDSRPQSA-N	0	3	342.487	3.451	20	30		EGEDHN
CN(Cc1cn(CCC#N)nc1-c1ccccc1)C[C@H]1CCC[C@@H]1O	ZINC000091898836	454487492	/nfs/dbraw/zinc/48/74/92/454487492.db2.gz	XXTUKINBFPHLIS-MJGOQNOKSA-N	0	3	338.455	3.057	20	30		EGEDHN
C[C@H](CNC(=O)N[C@@H](C)c1cccc(C#N)c1)N1CCC(C)CC1	ZINC000073897911	454498816	/nfs/dbraw/zinc/49/88/16/454498816.db2.gz	GUERIKXWLSGRPV-CVEARBPZSA-N	0	3	328.460	3.039	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2CNCc2cccc(C#N)c2)C[C@H](C)O1	ZINC000048816757	454518288	/nfs/dbraw/zinc/51/82/88/454518288.db2.gz	QSLBYWONKSGKLV-ROUUACIJSA-N	0	3	349.478	3.457	20	30		EGEDHN
CC(C(=O)Nc1ccc(OCC(F)(F)C(F)F)nc1)C(F)(F)F	ZINC000080034845	454522661	/nfs/dbraw/zinc/52/26/61/454522661.db2.gz	OAPBGJPGYLNKOP-LURJTMIESA-N	0	3	348.218	3.498	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN1CCC[C@@H]1c1cccc(C)c1C	ZINC000122330173	454524311	/nfs/dbraw/zinc/52/43/11/454524311.db2.gz	OYEGHWCUZBOADB-HNAYVOBHSA-N	0	3	327.472	3.449	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N(C)CCC1CCN(c2ccncc2)CC1	ZINC000092503418	454576493	/nfs/dbraw/zinc/57/64/93/454576493.db2.gz	SVDFCEXVPOHQOX-KRWDZBQOSA-N	0	3	345.487	3.128	20	30		EGEDHN
C=CCN(Cc1cccc(C#N)c1)C(=O)[C@@H](C)N1CCCCCC1	ZINC000074534322	454598821	/nfs/dbraw/zinc/59/88/21/454598821.db2.gz	NIGSHYNMYXYOSN-QGZVFWFLSA-N	0	3	325.456	3.337	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccc(Br)c(F)c2)nc(C)n1	ZINC000065650303	454608906	/nfs/dbraw/zinc/60/89/06/454608906.db2.gz	ZXJDOVOVDNJNLB-LLVKDONJSA-N	0	3	348.175	3.485	20	30		EGEDHN
N#Cc1cccnc1N1CC[C@@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000080685982	454619153	/nfs/dbraw/zinc/61/91/53/454619153.db2.gz	LUEDSKJQAQCNFV-NRFANRHFSA-N	0	3	332.451	3.446	20	30		EGEDHN
N#CCc1ccc(OC[C@H](O)CN(Cc2cccs2)C2CC2)cc1	ZINC000051407820	454622319	/nfs/dbraw/zinc/62/23/19/454622319.db2.gz	DPMYLMZPEJNJEC-QGZVFWFLSA-N	0	3	342.464	3.218	20	30		EGEDHN
CN(C(=O)C1CCN(Cc2ccccc2)CC1)c1cccc(C#N)c1	ZINC000065897421	454636372	/nfs/dbraw/zinc/63/63/72/454636372.db2.gz	PNZYIESRVKHGRS-UHFFFAOYSA-N	0	3	333.435	3.433	20	30		EGEDHN
CCc1ccsc1C(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000065930259	454641195	/nfs/dbraw/zinc/64/11/95/454641195.db2.gz	JBCSUDURNBJYIU-UHFFFAOYSA-N	0	3	341.480	3.386	20	30		EGEDHN
N#Cc1ccsc1C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000052050530	454651686	/nfs/dbraw/zinc/65/16/86/454651686.db2.gz	IQASJVSQIOXFJC-INIZCTEOSA-N	0	3	339.464	3.262	20	30		EGEDHN
N#Cc1c(Cl)nsc1NCC1(N2CCCCC2)CCOCC1	ZINC000081000992	454668453	/nfs/dbraw/zinc/66/84/53/454668453.db2.gz	RETOJQGISCXLGC-UHFFFAOYSA-N	0	3	340.880	3.115	20	30		EGEDHN
C[C@@](C#N)(NC(=O)CN1CCC[C@@H]1CCCc1ccccc1)C1CC1	ZINC000135362407	454669039	/nfs/dbraw/zinc/66/90/39/454669039.db2.gz	BJLFWSOFGLLQDT-FPOVZHCZSA-N	0	3	339.483	3.282	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc3ccc(OCC)cc3[nH]2)CC1	ZINC000106035861	454675047	/nfs/dbraw/zinc/67/50/47/454675047.db2.gz	RXIDUASEDGIUSP-UHFFFAOYSA-N	0	3	341.455	3.337	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCCOc2cccc(C)c2)CC1	ZINC000106039376	454675512	/nfs/dbraw/zinc/67/55/12/454675512.db2.gz	NJCJLSWYEKPHJM-UHFFFAOYSA-N	0	3	330.472	3.311	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)COc2ccc(Cl)cc2C)CC1	ZINC000106039523	454675665	/nfs/dbraw/zinc/67/56/65/454675665.db2.gz	CZDBXZYHXJSEKK-UHFFFAOYSA-N	0	3	336.863	3.184	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1	ZINC000106039466	454676119	/nfs/dbraw/zinc/67/61/19/454676119.db2.gz	LSBAZZDMNAPGKM-UHFFFAOYSA-N	0	3	337.807	3.019	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N[C@@H](C)c1nccs1)C(C)C	ZINC000106332277	454691022	/nfs/dbraw/zinc/69/10/22/454691022.db2.gz	RPCURIAMJDSADF-GJZGRUSLSA-N	0	3	336.505	3.202	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(Cc2cccs2)C2CC2)CC1	ZINC000106341098	454691977	/nfs/dbraw/zinc/69/19/77/454691977.db2.gz	YZSQVAXAVMCSEN-UHFFFAOYSA-N	0	3	333.501	3.463	20	30		EGEDHN
CC[C@H](NCC(=O)N(C)C1(C#N)CCCCC1)c1ccc(OC)cc1	ZINC000124188386	454705037	/nfs/dbraw/zinc/70/50/37/454705037.db2.gz	HPYXRCIDNHLEKD-SFHVURJKSA-N	0	3	343.471	3.421	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2csc(-c3ccoc3)n2)CC1	ZINC000108278751	454790994	/nfs/dbraw/zinc/79/09/94/454790994.db2.gz	PLNYPJZYAKYYML-UHFFFAOYSA-N	0	3	331.441	3.173	20	30		EGEDHN
N#CC1(C(=O)NC[C@@H]2CCCN(Cc3cccs3)C2)CCCC1	ZINC000140122726	454816878	/nfs/dbraw/zinc/81/68/78/454816878.db2.gz	VVWQKZLHYJIIKK-HNNXBMFYSA-N	0	3	331.485	3.160	20	30		EGEDHN
CC(C)(CCC#N)CN1CCN(c2ncnc3sccc32)CC1	ZINC000125669074	454838770	/nfs/dbraw/zinc/83/87/70/454838770.db2.gz	JQCJBHOLAROAGQ-UHFFFAOYSA-N	0	3	329.473	3.143	20	30		EGEDHN
Cc1nnc(NC[C@H]2CCCN(Cc3cccs3)C2)c(C#N)c1C	ZINC000142820919	454838841	/nfs/dbraw/zinc/83/88/41/454838841.db2.gz	OAXXBNHOGNICCO-OAHLLOKOSA-N	0	3	341.484	3.351	20	30		EGEDHN
C=CCNC(=O)[C@H](C)N1CCC(c2c[nH]c3cc(F)ccc32)CC1	ZINC000111260893	454859829	/nfs/dbraw/zinc/85/98/29/454859829.db2.gz	QWUJVHQLYQJAFT-ZDUSSCGKSA-N	0	3	329.419	3.177	20	30		EGEDHN
N#CCCCOc1cccc(CN2CCN(C3CCCC3)CC2)c1	ZINC000126965826	454929148	/nfs/dbraw/zinc/92/91/48/454929148.db2.gz	ZEZSECCZQWDPJX-UHFFFAOYSA-N	0	3	327.472	3.429	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)N[C@H]1CCN(C2CCCC2)C1	ZINC000127456798	454967588	/nfs/dbraw/zinc/96/75/88/454967588.db2.gz	DZHJWJBMVAMWTH-HNNXBMFYSA-N	0	3	344.455	3.007	20	30		EGEDHN
C=CCN(CC=C)CCC(=O)Nc1c(C)nn(-c2ccccc2)c1C	ZINC000114723674	454972827	/nfs/dbraw/zinc/97/28/27/454972827.db2.gz	IQJWSQKLKLLEKJ-UHFFFAOYSA-N	0	3	338.455	3.492	20	30		EGEDHN
N#Cc1ccc(NC(=O)NC[C@@H]2CCCN2Cc2ccccc2)cc1	ZINC000114778802	454978313	/nfs/dbraw/zinc/97/83/13/454978313.db2.gz	CAZSBWDIKLMHJR-IBGZPJMESA-N	0	3	334.423	3.344	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N1CC[C@H]2OCCC[C@@H]2C1	ZINC000155533265	455012747	/nfs/dbraw/zinc/01/27/47/455012747.db2.gz	RDOXCRVYFDIKNG-LZLYRXPVSA-N	0	3	348.512	3.152	20	30		EGEDHN
COc1ccc(CNCc2ccc(N(C)CCC#N)cc2)cc1O	ZINC000171135261	455034798	/nfs/dbraw/zinc/03/47/98/455034798.db2.gz	NIJCOSUOQWHZJK-UHFFFAOYSA-N	0	3	325.412	3.040	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)Cc2ccc(Cl)c(F)c2)CC1	ZINC000179357080	455038235	/nfs/dbraw/zinc/03/82/35/455038235.db2.gz	ZPFPTXSLKBLCGU-UHFFFAOYSA-N	0	3	339.842	3.271	20	30		EGEDHN
COc1cccc(/C=N/CC2CCN(c3ccncc3)CC2)c1O	ZINC000179703942	455068705	/nfs/dbraw/zinc/06/87/05/455068705.db2.gz	JQKHWDXKYWRNKI-KGENOOAVSA-N	0	3	325.412	3.131	20	30		EGEDHN
C=CCN(Cc1cccc(C#N)c1)C(=O)c1cccc(CN(C)C)c1	ZINC000156003323	455071923	/nfs/dbraw/zinc/07/19/23/455071923.db2.gz	OYHYQSSMUDJXJN-UHFFFAOYSA-N	0	3	333.435	3.448	20	30		EGEDHN
C=CC[C@@H](C)NC(=O)NC[C@@H](c1cccc(OC)c1)N(CC)CC	ZINC000116938360	455075644	/nfs/dbraw/zinc/07/56/44/455075644.db2.gz	DSYKKUHLPOXCBR-QAPCUYQASA-N	0	3	333.476	3.342	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc(OCC(C)C)nc2)CC1	ZINC000117008865	455077648	/nfs/dbraw/zinc/07/76/48/455077648.db2.gz	HIHLDFMZHUMVJM-UHFFFAOYSA-N	0	3	346.475	3.278	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@@H](C)Oc2ccc(Cl)c(C)c2)CC1	ZINC000171717743	455088721	/nfs/dbraw/zinc/08/87/21/455088721.db2.gz	JKOSTEYZSUPNGW-CQSZACIVSA-N	0	3	336.863	3.182	20	30		EGEDHN
C=CCN1CCC(NC(=O)COc2ccc(C(C)C)c(C)c2)CC1	ZINC000171724467	455089198	/nfs/dbraw/zinc/08/91/98/455089198.db2.gz	UJDYOJXERGRUSM-UHFFFAOYSA-N	0	3	330.472	3.264	20	30		EGEDHN
CCN1CCCC[C@@H]1CNC(=O)N(Cc1ccc(C#N)cc1)C1CC1	ZINC000171776817	455093773	/nfs/dbraw/zinc/09/37/73/455093773.db2.gz	LUMJTPHQICFMJO-LJQANCHMSA-N	0	3	340.471	3.107	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cnn(C(CC)CC)c2C)CC1	ZINC000119094185	455125199	/nfs/dbraw/zinc/12/51/99/455125199.db2.gz	COJAFHRRAFRXOZ-UHFFFAOYSA-N	0	3	332.492	3.323	20	30		EGEDHN
CO[C@@H](CNCc1cn(C)nc1-c1ccc(C#N)cc1)c1ccccc1	ZINC000180104277	455132833	/nfs/dbraw/zinc/13/28/33/455132833.db2.gz	KTKQREMGUWMUIP-FQEVSTJZSA-N	0	3	346.434	3.436	20	30		EGEDHN
CN1CC[C@H](NC(=O)/C=C/c2cccc(C#N)c2)[C@@H]1c1ccccc1	ZINC000180132184	455137330	/nfs/dbraw/zinc/13/73/30/455137330.db2.gz	INJVRPJKCMZDAK-PSVQYUNKSA-N	0	3	331.419	3.133	20	30		EGEDHN
CC1(C)[C@H](O)C[C@H]1NCc1cccc(OCc2cccc(C#N)c2)c1	ZINC000189327723	455177213	/nfs/dbraw/zinc/17/72/13/455177213.db2.gz	KOUVYXLAFGHOBZ-WOJBJXKFSA-N	0	3	336.435	3.386	20	30		EGEDHN
N#Cc1ccc(F)cc1CN1CCC(CCCN2CCOCC2)CC1	ZINC000182983909	455203612	/nfs/dbraw/zinc/20/36/12/455203612.db2.gz	ZNJSLGVTSVYOQV-UHFFFAOYSA-N	0	3	345.462	3.022	20	30		EGEDHN
C[C@H](c1ccc(C#N)cc1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000245430523	455297232	/nfs/dbraw/zinc/29/72/32/455297232.db2.gz	AFPIDMQHPLOAMF-CZUORRHYSA-N	0	3	337.383	3.109	20	30		EGEDHN
N#CCOc1ccc(CN(CCCO)[C@@H]2CCc3ccccc32)cc1	ZINC000265225776	455303354	/nfs/dbraw/zinc/30/33/54/455303354.db2.gz	OJPHVYDRLZCJMR-OAQYLSRUSA-N	0	3	336.435	3.461	20	30		EGEDHN
C[C@H](N[C@H](CN1CCOCC1)c1ccccc1)c1ccc(C#N)cc1	ZINC000181421304	455331971	/nfs/dbraw/zinc/33/19/71/455331971.db2.gz	KVNRIJWPCOMZLG-LAUBAEHRSA-N	0	3	335.451	3.282	20	30		EGEDHN
C[C@H](NCc1cccnc1-n1cccn1)c1ccc(OCC#N)cc1	ZINC000181473348	455340247	/nfs/dbraw/zinc/34/02/47/455340247.db2.gz	QEPQZIXOSLIPNE-HNNXBMFYSA-N	0	3	333.395	3.020	20	30		EGEDHN
N#Cc1ccc(Cl)cc1NC(=O)CN[C@@H](CCO)C1CCCCC1	ZINC000181495715	455344395	/nfs/dbraw/zinc/34/43/95/455344395.db2.gz	VVYSYHIUFIQNEO-INIZCTEOSA-N	0	3	349.862	3.071	20	30		EGEDHN
C[C@H](CN(C)CCC(=O)Nc1cccc(C#N)c1)c1nccs1	ZINC000183999367	455346743	/nfs/dbraw/zinc/34/67/43/455346743.db2.gz	YNISTQPVBMUISV-CYBMUJFWSA-N	0	3	328.441	3.079	20	30		EGEDHN
COc1ccc([C@@H](C)N[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)cc1	ZINC000190606070	455351836	/nfs/dbraw/zinc/35/18/36/455351836.db2.gz	PAHFNPOCGIXNCI-FOIQADDNSA-N	0	3	349.434	3.019	20	30		EGEDHN
CC#CCCCC(=O)N[C@H]1CC2(CCN(C)CC2)Oc2ccccc21	ZINC000184352761	455372781	/nfs/dbraw/zinc/37/27/81/455372781.db2.gz	KYHFXCMGBXHNJX-SFHVURJKSA-N	0	3	340.467	3.284	20	30		EGEDHN
C[C@H](NCCCS(=O)(=O)c1ccccc1)c1cccc(C#N)c1	ZINC000181982380	455409573	/nfs/dbraw/zinc/40/95/73/455409573.db2.gz	MOFNVWZMCQYJOZ-HNNXBMFYSA-N	0	3	328.437	3.073	20	30		EGEDHN
CC(C)(C#N)CCCN1CCCN(C(=O)c2cccc(F)c2)CC1	ZINC000174816757	455415355	/nfs/dbraw/zinc/41/53/55/455415355.db2.gz	GQYQEPRXYFSHQI-UHFFFAOYSA-N	0	3	331.435	3.304	20	30		EGEDHN
Cc1cccc(C(=O)N2CCCN(CCCC(C)(C)C#N)CC2)c1	ZINC000174816516	455415381	/nfs/dbraw/zinc/41/53/81/455415381.db2.gz	DHWNHNLRKBZKLV-UHFFFAOYSA-N	0	3	327.472	3.473	20	30		EGEDHN
Cc1cc(C(=O)NC2CCN(CCCC(C)(C)C#N)CC2)c(C)o1	ZINC000174843719	455415824	/nfs/dbraw/zinc/41/58/24/455415824.db2.gz	SBHAYSQTBRPPCT-UHFFFAOYSA-N	0	3	331.460	3.421	20	30		EGEDHN
C=CCC1(C(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)CCC1	ZINC000190991017	455420818	/nfs/dbraw/zinc/42/08/18/455420818.db2.gz	XHXLGMYVSWXXNT-IBGZPJMESA-N	0	3	342.483	3.140	20	30		EGEDHN
N#Cc1ccccc1NC(=O)CCN1CCS[C@@H]2CCCC[C@H]21	ZINC000246072035	455421538	/nfs/dbraw/zinc/42/15/38/455421538.db2.gz	CQHXGDAFPNLCOT-IAGOWNOFSA-N	0	3	329.469	3.247	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN2CCC[C@H]2C[C@@H](O)c2cccs2)cc1	ZINC000246106182	455427914	/nfs/dbraw/zinc/42/79/14/455427914.db2.gz	WYJQVVLTUPRZKW-RCCFBDPRSA-N	0	3	342.464	3.241	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2Cc3ccccc3C[C@H]2CC)CC1	ZINC000184868838	455463943	/nfs/dbraw/zinc/46/39/43/455463943.db2.gz	AVHQKMJETRVNLK-LJQANCHMSA-N	0	3	327.472	3.183	20	30		EGEDHN
CCN(C[C@H](O)COc1ccc(C#N)cc1)[C@H](C)c1cccc(O)c1	ZINC000266921528	455475878	/nfs/dbraw/zinc/47/58/78/455475878.db2.gz	MEJCUXKACUMAJP-BEFAXECRSA-N	0	3	340.423	3.087	20	30		EGEDHN
Cc1ccc(CN(C)C)cc1NC(=O)[C@@H](C)Oc1ccc(C#N)cc1	ZINC000267175812	455511308	/nfs/dbraw/zinc/51/13/08/455511308.db2.gz	WOTUTSFMIHKCJD-OAHLLOKOSA-N	0	3	337.423	3.334	20	30		EGEDHN
N#Cc1ccc(OCCN[C@@H]2CCO[C@H]2c2ccc(F)c(F)c2)cc1	ZINC000192142828	455563600	/nfs/dbraw/zinc/56/36/00/455563600.db2.gz	MCRMKHXVCKPEKL-MOPGFXCFSA-N	0	3	344.361	3.335	20	30		EGEDHN
Cc1cc(C#N)ccc1Oc1ccc(C(=O)N(C)CCN(C)C)cc1	ZINC000268071262	455589207	/nfs/dbraw/zinc/58/92/07/455589207.db2.gz	FCXVJOXBYARVQU-UHFFFAOYSA-N	0	3	337.423	3.293	20	30		EGEDHN
C=CCNC(=O)CN[C@](C)(c1ccc(Br)cc1)C(C)C	ZINC000192373602	455600272	/nfs/dbraw/zinc/60/02/72/455600272.db2.gz	SDHYNNVIONMLJB-INIZCTEOSA-N	0	3	339.277	3.212	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1	ZINC000185789405	455623443	/nfs/dbraw/zinc/62/34/43/455623443.db2.gz	YTCQFXHLXZYVJG-OKZBNKHCSA-N	0	3	336.520	3.327	20	30		EGEDHN
COC(=O)c1ccc(CNCCCCC#N)c(Br)c1	ZINC000284185738	455648667	/nfs/dbraw/zinc/64/86/67/455648667.db2.gz	ASRWCIOGPGHSGD-UHFFFAOYSA-N	0	3	325.206	3.019	20	30		EGEDHN
Cc1ccc(C(=O)C(C(=S)[N-]C2(C)CC2)[n+]2ccccc2)s1	ZINC000284378275	455676284	/nfs/dbraw/zinc/67/62/84/455676284.db2.gz	LVSWISXHWBKOKS-UHFFFAOYSA-O	0	3	331.486	3.425	20	30		EGEDHN
CC1(C)CCCN(C(=O)c2ccc(CN3CCCC3)cc2)[C@@H]1C#N	ZINC000277994739	455729630	/nfs/dbraw/zinc/72/96/30/455729630.db2.gz	RLWJFZQZCMAPSV-GOSISDBHSA-N	0	3	325.456	3.437	20	30		EGEDHN
C[C@H](N[C@@H](C)c1ccc(OCC#N)cc1)c1ccc(NC(N)=O)cc1	ZINC000193024408	455736080	/nfs/dbraw/zinc/73/60/80/455736080.db2.gz	NKYMJUYSPAKRND-KBPBESRZSA-N	0	3	338.411	3.491	20	30		EGEDHN
N#C[C@@H]1CCC[C@@H](N[C@@H]2CCN(c3ccc(F)c(Cl)c3)C2=O)C1	ZINC000248927122	455739297	/nfs/dbraw/zinc/73/92/97/455739297.db2.gz	XIFJLEHDFIBMFW-XHBSWPGZSA-N	0	3	335.810	3.256	20	30		EGEDHN
N#C[C@H]1CCC[C@H](Nc2ccccc2CN2CCC(CO)CC2)C1	ZINC000193112412	455742937	/nfs/dbraw/zinc/74/29/37/455742937.db2.gz	ZRFISWNQJWWMNH-HKUYNNGSSA-N	0	3	327.472	3.385	20	30		EGEDHN
Cc1ccc(C)c(OC[C@@H](O)CNC2(c3cccc(C#N)c3)CC2)c1	ZINC000271751957	455746691	/nfs/dbraw/zinc/74/66/91/455746691.db2.gz	GBYIUHFGKZKPKC-IBGZPJMESA-N	0	3	336.435	3.194	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N1CCCN(Cc2ccccc2)C[C@H]1C	ZINC000249274239	455747114	/nfs/dbraw/zinc/74/71/14/455747114.db2.gz	LMJQBRVKZSMPOC-NQIIRXRSSA-N	0	3	344.499	3.338	20	30		EGEDHN
CCO[C@H]1C[C@H](O)C12CCN(Cc1ccccc1C(C)(C)C#N)CC2	ZINC000268986684	455753656	/nfs/dbraw/zinc/75/36/56/455753656.db2.gz	QXWHWASUERVYCZ-OALUTQOASA-N	0	3	342.483	3.240	20	30		EGEDHN
CCO[C@@H]1C[C@@H](NCc2cc(C#N)cs2)[C@H]1Oc1ccccc1	ZINC000249422580	455755032	/nfs/dbraw/zinc/75/50/32/455755032.db2.gz	HTKBSLHUTGZMHC-KZNAEPCWSA-N	0	3	328.437	3.334	20	30		EGEDHN
C=C(C)[C@H](NC[C@H](O)COCC(F)(F)F)c1ccc(F)c(F)c1	ZINC000292849601	455763991	/nfs/dbraw/zinc/76/39/91/455763991.db2.gz	FXFNUAKHLRODCT-FZMZJTMJSA-N	0	3	339.304	3.111	20	30		EGEDHN
C=C(C)[C@@H](NC1CCN(C(=O)N(C)C)CC1)c1ccc(F)c(F)c1	ZINC000186451716	455770949	/nfs/dbraw/zinc/77/09/49/455770949.db2.gz	PLKPELZPYHOPBK-QGZVFWFLSA-N	0	3	337.414	3.318	20	30		EGEDHN
CN(CCCNC(=O)c1cc(C#N)ccc1Cl)Cc1ccccc1	ZINC000285045798	455781103	/nfs/dbraw/zinc/78/11/03/455781103.db2.gz	PWXCOWUFQCVCOR-UHFFFAOYSA-N	0	3	341.842	3.464	20	30		EGEDHN
CCOCC(C)(C)NCC(=O)Nc1ccccc1S[C@H](C)CC#N	ZINC000293347106	455782672	/nfs/dbraw/zinc/78/26/72/455782672.db2.gz	SUARVGKAZOWUCQ-CQSZACIVSA-N	0	3	349.500	3.424	20	30		EGEDHN
CCC(C)(C)[N-]C(=S)C(C(=O)c1nccs1)[n+]1cccc(C)c1	ZINC000278193287	455783177	/nfs/dbraw/zinc/78/31/77/455783177.db2.gz	GJUFPXDKJOOBPM-UHFFFAOYSA-O	0	3	348.517	3.456	20	30		EGEDHN
COc1ccc(OC)c([C@H](O)CN[C@H](C)c2ccc(C#N)c(F)c2)c1	ZINC000271939600	455799705	/nfs/dbraw/zinc/79/97/05/455799705.db2.gz	OKWQQAPOJDRVNC-KZULUSFZSA-N	0	3	344.386	3.099	20	30		EGEDHN
N#Cc1cc(F)ccc1NCc1ccccc1CN1CCC(O)CC1	ZINC000269316169	455833811	/nfs/dbraw/zinc/83/38/11/455833811.db2.gz	CSRHHCMKXKUGRR-UHFFFAOYSA-N	0	3	339.414	3.266	20	30		EGEDHN
CCC(CC)n1ccc(CON=C(N)c2ccc(CN(C)C)cc2)n1	ZINC000269336026	455837656	/nfs/dbraw/zinc/83/76/56/455837656.db2.gz	NWJNPDMOPBQWAW-UHFFFAOYSA-N	0	3	343.475	3.143	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N[C@@H]2CCCC[C@H]2C)cc1	ZINC000278553741	455840063	/nfs/dbraw/zinc/84/00/63/455840063.db2.gz	HQOVUMHGFGFWRT-DVOMOZLQSA-N	0	3	349.456	3.073	20	30		EGEDHN
N#C[C@@H]1CC[C@H](N2CCC[C@@H](CNC(=O)Nc3cccc(F)c3)C2)C1	ZINC000278618946	455842630	/nfs/dbraw/zinc/84/26/30/455842630.db2.gz	NFGOGDHIVBFLOW-VKJFTORMSA-N	0	3	344.434	3.351	20	30		EGEDHN
C[C@@H]1[C@H](NC(=O)[C@]2(C#N)CC23CCCC3)CCN1Cc1ccccc1	ZINC000295302351	455845098	/nfs/dbraw/zinc/84/50/98/455845098.db2.gz	KHNKMOHARWHRRL-HGHGUNKESA-N	0	3	337.467	3.240	20	30		EGEDHN
CCN1CCN(c2ccc(F)cc2[C@H](C)N[C@@H]2CC[C@@H](C#N)C2)CC1	ZINC000278707078	455846066	/nfs/dbraw/zinc/84/60/66/455846066.db2.gz	UFARPBCVFIQZJZ-LZLYRXPVSA-N	0	3	344.478	3.310	20	30		EGEDHN
CC[C@H](C)[C@@H](C)NC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000194474192	455847432	/nfs/dbraw/zinc/84/74/32/455847432.db2.gz	ASDYDPDGVZPOTR-JKSUJKDBSA-N	0	3	330.476	3.066	20	30		EGEDHN
C[C@H](O)C[C@@H]1CCCN1CC#Cc1ccc(OC(F)(F)F)cc1	ZINC000269790517	455854259	/nfs/dbraw/zinc/85/42/59/455854259.db2.gz	JHOYSISGXQHOOJ-ZFWWWQNUSA-N	0	3	327.346	3.172	20	30		EGEDHN
N#Cc1ccc(CN(C[C@H](O)COCc2cccs2)C2CC2)cc1	ZINC000194539491	455855684	/nfs/dbraw/zinc/85/56/84/455855684.db2.gz	JOUFEAVEIXYMQF-SFHVURJKSA-N	0	3	342.464	3.162	20	30		EGEDHN
C=CCOc1ccc(CNCc2cc3c(c(OC)c2)OCO3)cc1	ZINC000285484242	455855954	/nfs/dbraw/zinc/85/59/54/455855954.db2.gz	IHXUTAGQIIGGQI-UHFFFAOYSA-N	0	3	327.380	3.279	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cccnc2-c2ccc(C)s2)CC1	ZINC000187049926	455866509	/nfs/dbraw/zinc/86/65/09/455866509.db2.gz	IOFNCKNWSCPETQ-UHFFFAOYSA-N	0	3	339.464	3.402	20	30		EGEDHN
CN(Cc1ccc(OCC#N)cc1)[C@@H](CO)c1ccc(Cl)cc1	ZINC000296094593	455869232	/nfs/dbraw/zinc/86/92/32/455869232.db2.gz	DEQKDXTVTIYELQ-SFHVURJKSA-N	0	3	330.815	3.408	20	30		EGEDHN
CC(C)OCCCN(C)Cc1cn(C)nc1-c1ccc(C#N)cc1	ZINC000272233261	455885545	/nfs/dbraw/zinc/88/55/45/455885545.db2.gz	FEIIVYDQPJDLSM-UHFFFAOYSA-N	0	3	326.444	3.206	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)Cc2ccc(C#N)cc2)N2CCCC2)cc1	ZINC000194882344	455895783	/nfs/dbraw/zinc/89/57/83/455895783.db2.gz	NQYVVYRUOLKFSL-NRFANRHFSA-N	0	3	347.462	3.363	20	30		EGEDHN
C=CCC[C@@H](NC[C@H](O)COc1ccc2c(c1)OCO2)c1ccco1	ZINC000285904236	455939043	/nfs/dbraw/zinc/93/90/43/455939043.db2.gz	CVYJMSKIFQKUFA-GOEBONIOSA-N	0	3	345.395	3.045	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000280561747	456000084	/nfs/dbraw/zinc/00/00/84/456000084.db2.gz	FVAISIGKNCMGRQ-WMLDXEAASA-N	0	3	337.423	3.243	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(C(C)(C)C#N)cc2)CC1	ZINC000280644905	456021918	/nfs/dbraw/zinc/02/19/18/456021918.db2.gz	YRXYZYVGCDKIAR-UHFFFAOYSA-N	0	3	325.456	3.258	20	30		EGEDHN
CC(C)Oc1ccc(NC(=O)N[C@H](C)C2=CCN(C)CC2)cc1C#N	ZINC000272651007	456025476	/nfs/dbraw/zinc/02/54/76/456025476.db2.gz	FCFDKBHWNQGOHK-CQSZACIVSA-N	0	3	342.443	3.117	20	30		EGEDHN
CC(C)Oc1ccc([C@H](CNC(=O)CC(C)(C)C#N)N(C)C)cc1	ZINC000286836037	456055073	/nfs/dbraw/zinc/05/50/73/456055073.db2.gz	PCAUDEIHXLQCHU-KRWDZBQOSA-N	0	3	331.460	3.133	20	30		EGEDHN
CC(C)(C(=O)NC[C@H]1CCCCN1C1CC1)c1cc(F)cc(C#N)c1	ZINC000287115166	456061022	/nfs/dbraw/zinc/06/10/22/456061022.db2.gz	PIEZFJDMUCVRGM-GOSISDBHSA-N	0	3	343.446	3.108	20	30		EGEDHN
CC1CCC(N2CCN(c3ccc(C#N)cc3[N+](=O)[O-])CC2)CC1	ZINC000301267886	456075081	/nfs/dbraw/zinc/07/50/81/456075081.db2.gz	GZYLCQQPXOXWHJ-UHFFFAOYSA-N	0	3	328.416	3.167	20	30		EGEDHN
C[C@@H]1[C@@H](NC(=O)c2ccc(CC#N)cc2)CCN1Cc1ccccc1	ZINC000288024704	456084710	/nfs/dbraw/zinc/08/47/10/456084710.db2.gz	CIDRITMMZUOTHU-UZLBHIALSA-N	0	3	333.435	3.145	20	30		EGEDHN
C[C@H]1[C@@H](NC(=O)C2(C#N)CCCCC2)CCN1Cc1ccccc1	ZINC000288246299	456090407	/nfs/dbraw/zinc/09/04/07/456090407.db2.gz	OPLZSUMYMLMEIP-WMZOPIPTSA-N	0	3	325.456	3.240	20	30		EGEDHN
C=C(C)CN1CCC(Nc2nc(-c3cccc(OC)c3)no2)CC1	ZINC000301395726	456107594	/nfs/dbraw/zinc/10/75/94/456107594.db2.gz	LUUCUELQIMYZGZ-UHFFFAOYSA-N	0	3	328.416	3.198	20	30		EGEDHN
C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NCC#Cc1ccccc1	ZINC000289438662	456125336	/nfs/dbraw/zinc/12/53/36/456125336.db2.gz	WISPTLRUQPPSEC-AEFFLSMTSA-N	0	3	328.456	3.273	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H]2C[C@H]2c2cccc(Cl)c2)CC1	ZINC000281128376	456140864	/nfs/dbraw/zinc/14/08/64/456140864.db2.gz	XMIIGHDKTUPBGC-DLBZAZTESA-N	0	3	333.863	3.146	20	30		EGEDHN
C[C@H]1CN(C(=O)N[C@@H](CCC#N)c2ccccc2)CCN(C2CC2)C1	ZINC000297176520	456141820	/nfs/dbraw/zinc/14/18/20/456141820.db2.gz	FJAVXGKTZXCYGG-APWZRJJASA-N	0	3	340.471	3.157	20	30		EGEDHN
N#Cc1cc(C(F)(F)F)ccc1N1CCN(c2ccncc2)CC1	ZINC000301639504	456169973	/nfs/dbraw/zinc/16/99/73/456169973.db2.gz	YEABGVPLUWHKPV-UHFFFAOYSA-N	0	3	332.329	3.299	20	30		EGEDHN
C=C(C)CN1CCC(Nc2ncnc3c(F)c(OC)ccc23)CC1	ZINC000281235062	456173291	/nfs/dbraw/zinc/17/32/91/456173291.db2.gz	FRBLTPCZGAUWSG-UHFFFAOYSA-N	0	3	330.407	3.230	20	30		EGEDHN
CCN(CCNC(=O)c1ccccc1-c1ccccc1C#N)C1CC1	ZINC000263726112	456203708	/nfs/dbraw/zinc/20/37/08/456203708.db2.gz	MLNHLHLDJLBOJJ-UHFFFAOYSA-N	0	3	333.435	3.439	20	30		EGEDHN
C=CCOc1ccc(CN[C@H](CO)Cc2cccc(C)c2)cc1OC	ZINC000189027459	456203649	/nfs/dbraw/zinc/20/36/49/456203649.db2.gz	QRMRCILSBCNAKY-IBGZPJMESA-N	0	3	341.451	3.262	20	30		EGEDHN
CSc1ccc(CCNC(=O)C(C#N)Cc2ccc(C#N)cc2)cc1	ZINC000281447422	456237825	/nfs/dbraw/zinc/23/78/25/456237825.db2.gz	OKBYYEQDWSOSEV-GOSISDBHSA-N	0	3	349.459	3.321	20	30		EGEDHN
N#CC1(CCCN2CCC(Oc3ncccc3F)CC2)CCOCC1	ZINC000281486650	456246901	/nfs/dbraw/zinc/24/69/01/456246901.db2.gz	WZCCJXJPXDNUSV-UHFFFAOYSA-N	0	3	347.434	3.164	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2c(F)cc(C(F)(F)F)cc2F)CC1	ZINC000290138129	456249216	/nfs/dbraw/zinc/24/92/16/456249216.db2.gz	BKOKGYBMMZKKEX-UHFFFAOYSA-N	0	3	348.315	3.364	20	30		EGEDHN
C[C@]12CN(Cc3nnc(-c4ccc(C#N)cc4)o3)C[C@H]1[C@@H]1CC[C@H]2C1	ZINC000333711581	456252442	/nfs/dbraw/zinc/25/24/42/456252442.db2.gz	PXXGLZBXJIQAPS-NHAYFPRASA-N	0	3	334.423	3.476	20	30		EGEDHN
C=CCNC(=O)CNc1c(C)c(C)nc2ccc(Br)cc21	ZINC000301982796	456263834	/nfs/dbraw/zinc/26/38/34/456263834.db2.gz	ANNKGWXXNVRPKZ-UHFFFAOYSA-N	0	3	348.244	3.328	20	30		EGEDHN
C#C[C@@H](N[C@@H](C)CC(=O)Nc1ccc(OC)cc1OC)C(C)(C)C	ZINC000290244661	456273924	/nfs/dbraw/zinc/27/39/24/456273924.db2.gz	VBYZPSKSEQYFBR-SUMWQHHRSA-N	0	3	332.444	3.058	20	30		EGEDHN
COc1cc(CNC[C@](C)(O)c2cccc(Cl)c2)ccc1C#N	ZINC000281692777	456295708	/nfs/dbraw/zinc/29/57/08/456295708.db2.gz	NEGOZPGLSXTWAJ-SFHVURJKSA-N	0	3	330.815	3.218	20	30		EGEDHN
C[C@@](C#N)(NC(=O)CN[C@H](Cc1ccccc1)c1ccccc1)C1CC1	ZINC000302589960	456363309	/nfs/dbraw/zinc/36/33/09/456363309.db2.gz	JGWHDLGUJMWNCS-IRLDBZIGSA-N	0	3	347.462	3.368	20	30		EGEDHN
C=CCN(CCNS(=O)(=O)c1ccccc1)CC1CCCCC1	ZINC000303467330	456461096	/nfs/dbraw/zinc/46/10/96/456461096.db2.gz	PQVTYHJYDIWDSG-UHFFFAOYSA-N	0	3	336.501	3.033	20	30		EGEDHN
CC[NH+](CC)Cc1cccc(C/N=C/c2c([O-])c(C)ncc2CO)c1	ZINC000298629352	456505824	/nfs/dbraw/zinc/50/58/24/456505824.db2.gz	DTLXKCGQXOMNAX-CIAFOILYSA-N	0	3	341.455	3.049	20	30		EGEDHN
N#CCCCOc1cccc(CN[C@@]2(CO)CCc3ccccc32)c1	ZINC000305183486	456534598	/nfs/dbraw/zinc/53/45/98/456534598.db2.gz	SSZRQOGIJKNDFT-OAQYLSRUSA-N	0	3	336.435	3.293	20	30		EGEDHN
C=CCn1c(-c2ccc[nH]2)nnc1N1CCN(CCC(C)(C)C)CC1	ZINC000337824552	456567805	/nfs/dbraw/zinc/56/78/05/456567805.db2.gz	UXMIHZDNFUNCDB-UHFFFAOYSA-N	0	3	342.491	3.017	20	30		EGEDHN
C[C@@H](NCCC(=O)Nc1sccc1C#N)c1ccc2n[nH]cc2c1	ZINC000353261665	456595146	/nfs/dbraw/zinc/59/51/46/456595146.db2.gz	QEJXVYIHFSIJFX-LLVKDONJSA-N	0	3	339.424	3.175	20	30		EGEDHN
Cc1ccnc(N(CCN(C)C)Cc2ccc(F)cc2F)c1C#N	ZINC000343523394	456682004	/nfs/dbraw/zinc/68/20/04/456682004.db2.gz	GBKGWCWBQXYYQD-UHFFFAOYSA-N	0	3	330.382	3.108	20	30		EGEDHN
CCOC[C@@H](N[C@@H](C)C(=O)Nc1sc2c(c1C#N)CCC2)C(C)C	ZINC000348467732	456701483	/nfs/dbraw/zinc/70/14/83/456701483.db2.gz	JAACMBAQQWFCER-SWLSCSKDSA-N	0	3	349.500	3.086	20	30		EGEDHN
C=CCC[C@H](NCCOc1ccc(S(C)(=O)=O)cc1)c1ccco1	ZINC000353499870	456718786	/nfs/dbraw/zinc/71/87/86/456718786.db2.gz	DVVXEZYJSUULHS-KRWDZBQOSA-N	0	3	349.452	3.359	20	30		EGEDHN
CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@H](C)CCC#N)cc1	ZINC000299550190	456724669	/nfs/dbraw/zinc/72/46/69/456724669.db2.gz	FZYZZVKHZVRNOE-CABCVRRESA-N	0	3	337.489	3.060	20	30		EGEDHN
C[C@H](NC(=O)CC1CCCCC1)C(=O)N1CCC[C@@H]1CN1CCCC1	ZINC000328688196	456736778	/nfs/dbraw/zinc/73/67/78/456736778.db2.gz	HNMBPRBICCPCPO-FUHWJXTLSA-N	0	3	349.519	3.389	20	30		EGEDHN
O=C(CCN1CCC[C@H]2C(=O)NC[C@H]21)N[C@H]1CCCc2ccccc21	ZINC000328814085	456767250	/nfs/dbraw/zinc/76/72/50/456767250.db2.gz	NHYVSGNXGNCRTD-FGTMMUONSA-N	0	3	341.455	3.461	20	30		EGEDHN
Cc1c(C(=O)C(C#N)c2cc(C)nc(C)n2)cnn1Cc1ccccc1	ZINC000338316216	456768320	/nfs/dbraw/zinc/76/83/20/456768320.db2.gz	KGWXQOUREMMOPE-KRWDZBQOSA-N	0	3	345.406	3.137	20	30		EGEDHN
Cc1noc(C[C@@H](NCCOc2ccccc2C#N)c2ccccc2)n1	ZINC000277323817	456777645	/nfs/dbraw/zinc/77/76/45/456777645.db2.gz	VGFNUVWVGASPCC-GOSISDBHSA-N	0	3	348.406	3.202	20	30		EGEDHN
Cc1noc([C@H]2CCCCN2C(=O)C(C#N)CCc2ccccc2)n1	ZINC000343951863	456784484	/nfs/dbraw/zinc/78/44/84/456784484.db2.gz	IMQUMJDRZSWUFQ-IAGOWNOFSA-N	0	3	338.411	3.204	20	30		EGEDHN
CC1=C(C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2CO)CCC1	ZINC000328904289	456787619	/nfs/dbraw/zinc/78/76/19/456787619.db2.gz	JDPYIHFBXBIWRZ-IEBWSBKVSA-N	0	3	328.456	3.326	20	30		EGEDHN
Cc1c(NC(=O)N2CCCN(C3CCCC3)CC2)cnn1CC(C)C	ZINC000328935616	456795469	/nfs/dbraw/zinc/79/54/69/456795469.db2.gz	AJLOEPPYQXJLBT-UHFFFAOYSA-N	0	3	347.507	3.343	20	30		EGEDHN
CC[C@H](C)n1ncc(NC(=O)N2CCN3CCC[C@H]3C2)c1C1CC1	ZINC000328944636	456796575	/nfs/dbraw/zinc/79/65/75/456796575.db2.gz	UTSHTCIILMPTBV-ZFWWWQNUSA-N	0	3	331.464	3.057	20	30		EGEDHN
CC[C@@H](C)n1ncc(NC(=O)N2CCN3CCC[C@@H]3C2)c1C1CC1	ZINC000328944635	456797033	/nfs/dbraw/zinc/79/70/33/456797033.db2.gz	UTSHTCIILMPTBV-UKRRQHHQSA-N	0	3	331.464	3.057	20	30		EGEDHN
O=C(CN1C[C@H](c2ccccc2)[C@@H]2CCC[C@@H]21)NC(=O)NC1CC1	ZINC000329039480	456820574	/nfs/dbraw/zinc/82/05/74/456820574.db2.gz	DBTSOTJTODCRNT-BBWFWOEESA-N	0	3	327.428	3.287	20	30		EGEDHN
O=C(NCC1CCN(c2ccncc2)CC1)c1ccc2c(c1)COC2	ZINC000329105836	456836366	/nfs/dbraw/zinc/83/63/66/456836366.db2.gz	DEMJKMGJWIZNNN-UHFFFAOYSA-N	0	3	337.423	3.333	20	30		EGEDHN
CC(C(=O)Nc1ccnc(OCC(F)(F)C(F)F)c1)C(F)(F)F	ZINC000344529511	456837055	/nfs/dbraw/zinc/83/70/55/456837055.db2.gz	IYDLYZHVCZYNOD-LURJTMIESA-N	0	3	348.218	3.498	20	30		EGEDHN
CC(C)C(=O)Nc1cc(C(=O)C(C#N)c2nc3ccccc3[nH]2)ccn1	ZINC000344644411	456843452	/nfs/dbraw/zinc/84/34/52/456843452.db2.gz	XUZFZQJVDBZCQP-ZDUSSCGKSA-N	0	3	347.378	3.042	20	30		EGEDHN
CSCC[C@@](C)(C#N)NC(=O)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000344698578	456849500	/nfs/dbraw/zinc/84/95/00/456849500.db2.gz	JAVPYMAEUMIGSY-MJGOQNOKSA-N	0	3	345.512	3.050	20	30		EGEDHN
CC[C@H](C)n1ncc(NC(=O)N2C[C@@H](N3CCCC3)C[C@@H]2C)c1C	ZINC000329229570	456858097	/nfs/dbraw/zinc/85/80/97/456858097.db2.gz	CTEFCRGZPJUXQM-DZKIICNBSA-N	0	3	333.480	3.267	20	30		EGEDHN
C=C(C)Cn1c(C)nnc1N1CCN(Cc2ccccc2)C(C)(C)C1	ZINC000338810069	456860794	/nfs/dbraw/zinc/86/07/94/456860794.db2.gz	XTYUJSMTUPYHIO-UHFFFAOYSA-N	0	3	339.487	3.263	20	30		EGEDHN
CC[C@H](NCCCC#N)c1ccccc1OCC(=O)N1CCCC1	ZINC000341658440	456887515	/nfs/dbraw/zinc/88/75/15/456887515.db2.gz	MOARNOWRSIKMSK-KRWDZBQOSA-N	0	3	329.444	3.032	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)c2ccc(F)c(C#N)c2)CN1Cc1ccccc1	ZINC000353766337	456898139	/nfs/dbraw/zinc/89/81/39/456898139.db2.gz	GPIYRUNIYJOZDC-KSSFIOAISA-N	0	3	337.398	3.090	20	30		EGEDHN
CCCN1CCC[C@@H]1C(=O)N1CCC(NC(=O)C2CCCCC2)CC1	ZINC000329507714	456902285	/nfs/dbraw/zinc/90/22/85/456902285.db2.gz	LXELUCBUPCYUEG-GOSISDBHSA-N	0	3	349.519	3.389	20	30		EGEDHN
C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)c1cnc(OCC2CC2)c(Cl)c1	ZINC000329564050	456910082	/nfs/dbraw/zinc/91/00/82/456910082.db2.gz	NRWAZHGSVVDCOM-BDJLRTHQSA-N	0	3	349.862	3.311	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1csc(C2CC2)n1)C(C)C	ZINC000353809473	456916921	/nfs/dbraw/zinc/91/69/21/456916921.db2.gz	AVMJHMXYRQLXKQ-MRXNPFEDSA-N	0	3	333.501	3.449	20	30		EGEDHN
CC1(C)CCCN(CCNC(=O)c2csc([C@@H]3CCCO3)n2)C1	ZINC000329962934	456967662	/nfs/dbraw/zinc/96/76/62/456967662.db2.gz	SJAYXQHANYWSOV-AWEZNQCLSA-N	0	3	337.489	3.421	20	30		EGEDHN
CCN1CCC[C@H](NC(=O)N[C@@H]2CCCO[C@@H]2c2ccc(C)cc2)C1	ZINC000329966529	456968674	/nfs/dbraw/zinc/96/86/74/456968674.db2.gz	UZVZUBUCBLYFDK-IPMKNSEASA-N	0	3	345.487	3.203	20	30		EGEDHN
CC(C)(CNC(=O)NC1(c2cccc(C#N)c2)CC1)N1CCCCC1	ZINC000349553523	456986047	/nfs/dbraw/zinc/98/60/47/456986047.db2.gz	RMGNSSJMXNMIPN-UHFFFAOYSA-N	0	3	340.471	3.111	20	30		EGEDHN
CC(C)C[C@@H]1OCCC[C@@H]1NCC(=O)Nc1nc2c(s1)CCC2	ZINC000330136799	456989775	/nfs/dbraw/zinc/98/97/75/456989775.db2.gz	HQUKQWGXLGEZCR-JSGCOSHPSA-N	0	3	337.489	3.403	20	30		EGEDHN
CC(C#N)C(=O)NCC1(c2ccc(Cl)cc2Cl)CCOCC1	ZINC000345755015	456991615	/nfs/dbraw/zinc/99/16/15/456991615.db2.gz	FCUCGPHMFRCOLZ-NSHDSACASA-N	0	3	341.238	3.317	20	30		EGEDHN
COc1cccc([C@@H](NC(=O)C(C)C#N)c2cc(F)ccc2OC)c1	ZINC000349612482	456995213	/nfs/dbraw/zinc/99/52/13/456995213.db2.gz	QXHNKUBTFJPWME-KPZWWZAWSA-N	0	3	342.370	3.208	20	30		EGEDHN
CC(C)CCn1ncc(NC(=O)N2CCN3CCC[C@H]3C2)c1C(C)C	ZINC000330174886	456995875	/nfs/dbraw/zinc/99/58/75/456995875.db2.gz	IQASUOPNCXOTEN-INIZCTEOSA-N	0	3	347.507	3.378	20	30		EGEDHN
Cc1cc2c(o1)CC(C)(C)C[C@@H]2NC(=O)N[C@@H]1CCn2ccnc2C1	ZINC000330189239	456997990	/nfs/dbraw/zinc/99/79/90/456997990.db2.gz	VDIYCMYOGXGNNP-HIFRSBDPSA-N	0	3	342.443	3.317	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)CN1C1CC1	ZINC000330214792	457005345	/nfs/dbraw/zinc/00/53/45/457005345.db2.gz	GKQWNFHWAKYJSD-YPMHNXCESA-N	0	3	327.428	3.496	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@@H](Nc2ncc([N+](=O)[O-])cc2C#N)C1	ZINC000341925902	457005541	/nfs/dbraw/zinc/00/55/41/457005541.db2.gz	HSYWLPUYYRMQEE-XJKSGUPXSA-N	0	3	337.383	3.109	20	30		EGEDHN
O=C(Nc1ccccc1)[C@@H]1CCCN(C(=O)[C@@H]2CCCN2C2CC2)C1	ZINC000330220273	457006610	/nfs/dbraw/zinc/00/66/10/457006610.db2.gz	QBURSQNRYPWEAR-QAPCUYQASA-N	0	3	341.455	3.140	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NC1CCN([C@H](C)c2ccccc2)CC1	ZINC000346048725	457015272	/nfs/dbraw/zinc/01/52/72/457015272.db2.gz	CGFLUIFILAUYGN-UXPWSPDFSA-N	0	3	342.483	3.309	20	30		EGEDHN
CCN(Cc1cnc2ccc(C#N)cn12)[C@@H](COC)Cc1ccccc1	ZINC000354062318	457038760	/nfs/dbraw/zinc/03/87/60/457038760.db2.gz	YPUGVZWSTSUOKQ-LJQANCHMSA-N	0	3	348.450	3.286	20	30		EGEDHN
C[C@H]1[C@@H](NC(=O)Nc2cccc(C#N)c2)CCN1Cc1ccccc1	ZINC000359006098	457045722	/nfs/dbraw/zinc/04/57/22/457045722.db2.gz	HEGGYKKXNJMLRI-KXBFYZLASA-N	0	3	334.423	3.343	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2cnn(C(C)(C)C)c2C(F)(F)F)CCN1C	ZINC000330899099	457101776	/nfs/dbraw/zinc/10/17/76/457101776.db2.gz	IVQRHDUPWGVJHA-GHMZBOCLSA-N	0	3	346.397	3.444	20	30		EGEDHN
C=CC[C@@H](CC)NC(=O)NCc1ccc(OCCN2CCCC2)cc1	ZINC000359679009	457111478	/nfs/dbraw/zinc/11/14/78/457111478.db2.gz	NKDGYXMXDFUHHC-GOSISDBHSA-N	0	3	345.487	3.315	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F	ZINC000349992345	457136192	/nfs/dbraw/zinc/13/61/92/457136192.db2.gz	REQXTOZPQYEXOI-RDJZCZTQSA-N	0	3	349.425	3.152	20	30		EGEDHN
CC(C#N)C(=O)N1CCSC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000354248453	457153718	/nfs/dbraw/zinc/15/37/18/457153718.db2.gz	TVEPLRKZDYACKT-GXFFZTMASA-N	0	3	328.359	3.482	20	30		EGEDHN
N#Cc1ccc(CNCCCS(=O)(=O)c2ccc(Cl)cc2)cc1	ZINC000339589300	457158801	/nfs/dbraw/zinc/15/88/01/457158801.db2.gz	UTMMYBNDFCCQBO-UHFFFAOYSA-N	0	3	348.855	3.165	20	30		EGEDHN
N#Cc1ccccc1NC(=O)CCN1CC[C@@H](Oc2ccccc2)C1	ZINC000362953761	457172471	/nfs/dbraw/zinc/17/24/71/457172471.db2.gz	YOOCSPUMNJAFPJ-GOSISDBHSA-N	0	3	335.407	3.040	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)NC[C@H]1CCCSC1)C(C)C	ZINC000350745431	457203930	/nfs/dbraw/zinc/20/39/30/457203930.db2.gz	BNXRJKUICNTKQX-IAGOWNOFSA-N	0	3	339.549	3.127	20	30		EGEDHN
C[C@@H](c1ccccc1)N(CC(=O)NC1(C#N)CCC1)CC1CCC1	ZINC000347058778	457208598	/nfs/dbraw/zinc/20/85/98/457208598.db2.gz	QZBLREKXXISRIC-INIZCTEOSA-N	0	3	325.456	3.412	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2cc3cnn(C(C)C)c3nc2C)nc(C)n1	ZINC000350948113	457212818	/nfs/dbraw/zinc/21/28/18/457212818.db2.gz	HHIXEDSUKZIVFO-MRXNPFEDSA-N	0	3	348.410	3.218	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)Cc2ccc(C#N)cc2)C1	ZINC000347074624	457217151	/nfs/dbraw/zinc/21/71/51/457217151.db2.gz	KKMXFWFCEVNEFU-OXJNMPFZSA-N	0	3	333.435	3.052	20	30		EGEDHN
CCCN(CCN1CCCC1)C(=O)CSCc1ccc(C#N)cc1	ZINC000342299035	457221377	/nfs/dbraw/zinc/22/13/77/457221377.db2.gz	ZIBWKVMJELZKDP-UHFFFAOYSA-N	0	3	345.512	3.126	20	30		EGEDHN
CN(C)CCN(Cc1cccc(F)c1)c1ccc(C#N)cc1[N+](=O)[O-]	ZINC000347088153	457223881	/nfs/dbraw/zinc/22/38/81/457223881.db2.gz	BLIJXANQQCGKJX-UHFFFAOYSA-N	0	3	342.374	3.174	20	30		EGEDHN
C=CCN(C[C@@H]1CCC(C)(C)O1)[C@H](C)c1cccc(-n2cnnn2)c1	ZINC000360072008	457238279	/nfs/dbraw/zinc/23/82/79/457238279.db2.gz	NZQIRZYOKMGXCB-QAPCUYQASA-N	0	3	341.459	3.169	20	30		EGEDHN
C=C(C)CN(Cc1ccc(CO)o1)C(=O)c1ccc(CN(C)C)cc1	ZINC000342366214	457259774	/nfs/dbraw/zinc/25/97/74/457259774.db2.gz	DTCMEKQPTZJMSN-UHFFFAOYSA-N	0	3	342.439	3.052	20	30		EGEDHN
N#CC1CCC(CNC(=O)N2CCN(CC3CCCCC3)CC2)CC1	ZINC000331919375	457274028	/nfs/dbraw/zinc/27/40/28/457274028.db2.gz	BOTPNAGRMOGJLF-UHFFFAOYSA-N	0	3	346.519	3.224	20	30		EGEDHN
N#Cc1ccc2c(c1)N(C(=O)[C@H]1CCCN(Cc3ccccc3)C1)CC2	ZINC000339810356	457282708	/nfs/dbraw/zinc/28/27/08/457282708.db2.gz	DMAAPVNBIBDHST-FQEVSTJZSA-N	0	3	345.446	3.360	20	30		EGEDHN
C=CCc1cc(CN(C)C(C)(C)CC(=O)OCC)cc(OC)c1O	ZINC000355356065	457364349	/nfs/dbraw/zinc/36/43/49/457364349.db2.gz	PRBHLHRUGXSYPA-UHFFFAOYSA-N	0	3	335.444	3.293	20	30		EGEDHN
CN(C)CCOc1ccccc1CNc1c(C#N)cnc2ccccc21	ZINC000357221843	457381256	/nfs/dbraw/zinc/38/12/56/457381256.db2.gz	AYEJQKLOGNCOJF-UHFFFAOYSA-N	0	3	346.434	3.081	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)CC1	ZINC000355554853	457388721	/nfs/dbraw/zinc/38/87/21/457388721.db2.gz	XRUNLIUYGRJXBV-IAGOWNOFSA-N	0	3	334.504	3.081	20	30		EGEDHN
CCCCN(C)C(=O)C1CCN(Cc2ccc(CC#N)cc2)CC1	ZINC000342653504	457431592	/nfs/dbraw/zinc/43/15/92/457431592.db2.gz	ASJXGFDQYGRMAJ-UHFFFAOYSA-N	0	3	327.472	3.223	20	30		EGEDHN
CCCCCCCCC(=O)N1CCC(CN2CCN(C)CC2)CC1	ZINC000374019450	457442441	/nfs/dbraw/zinc/44/24/41/457442441.db2.gz	LELVSCMCBVEJBY-UHFFFAOYSA-N	0	3	337.552	3.223	20	30		EGEDHN
C[C@@H](CCC1CC1)NC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000347500477	457469502	/nfs/dbraw/zinc/46/95/02/457469502.db2.gz	UATJRTYMJIHJQF-INIZCTEOSA-N	0	3	342.487	3.210	20	30		EGEDHN
N#Cc1ccc([N+](=O)[O-])c(N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)c1	ZINC000425273379	457478150	/nfs/dbraw/zinc/47/81/50/457478150.db2.gz	IUADRTFTJNQILK-FXAWDEMLSA-N	0	3	348.406	3.177	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN(C[C@@H]1CCCO1)C1CCC(C)CC1	ZINC000347527485	457486772	/nfs/dbraw/zinc/48/67/72/457486772.db2.gz	RTJJAOHBQPXOEN-CHPDAQJUSA-N	0	3	349.519	3.054	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)NCCN2CCCC(C)(C)C2)cc1	ZINC000357446773	457534049	/nfs/dbraw/zinc/53/40/49/457534049.db2.gz	STGPESSLZXPQMD-UHFFFAOYSA-N	0	3	345.487	3.173	20	30		EGEDHN
COC(=O)[C@]1(C)CN(Cc2cccc(OCCCC#N)c2)C[C@H]1C	ZINC000374384452	457606979	/nfs/dbraw/zinc/60/69/79/457606979.db2.gz	IAAXSFTWRWJRKD-DNVCBOLYSA-N	0	3	330.428	3.000	20	30		EGEDHN
C=CCN1CC[C@H](N2CCCCC[C@H]2c2ccc(OC)cc2)C1=O	ZINC000410309676	457637421	/nfs/dbraw/zinc/63/74/21/457637421.db2.gz	ATIXTHPQNDFKDK-OALUTQOASA-N	0	3	328.456	3.399	20	30		EGEDHN
C=CCN1CC[C@@H](N(CCc2ccc(Cl)cc2)CC2CC2)C1=O	ZINC000410383404	457639333	/nfs/dbraw/zinc/63/93/33/457639333.db2.gz	OATGBIFZSDOALZ-GOSISDBHSA-N	0	3	332.875	3.381	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)c1ccc(OC(F)F)cn1	ZINC000357776671	457686024	/nfs/dbraw/zinc/68/60/24/457686024.db2.gz	AWKWXZPCBPKCDA-NSHDSACASA-N	0	3	342.305	3.060	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@@H](C)N1CCC[C@@H](OC)CC1	ZINC000374681972	457686919	/nfs/dbraw/zinc/68/69/19/457686919.db2.gz	XQOCHXQILSTFPB-HZPDHXFCSA-N	0	3	336.501	3.152	20	30		EGEDHN
C=CCOc1cccc(CN2CCC(C)(c3nc(C)no3)CC2)c1	ZINC000374730035	457695759	/nfs/dbraw/zinc/69/57/59/457695759.db2.gz	XUMBYXRDZHVCKA-UHFFFAOYSA-N	0	3	327.428	3.497	20	30		EGEDHN
C=CCN1CCC(NC(=O)CCOc2ccc(F)cc2Cl)CC1	ZINC000357824845	457702686	/nfs/dbraw/zinc/70/26/86/457702686.db2.gz	XUDDFLIJSNKNTI-UHFFFAOYSA-N	0	3	340.826	3.015	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N1CCCN(Cc2ccccc2C)CC1	ZINC000364847684	457705322	/nfs/dbraw/zinc/70/53/22/457705322.db2.gz	OKXRNQRCXKDTHD-NRFANRHFSA-N	0	3	344.499	3.258	20	30		EGEDHN
N#Cc1nc(N[C@@H]2CCN(Cc3ccccc3)C2)ccc1C(F)(F)F	ZINC000443411905	457759657	/nfs/dbraw/zinc/75/96/57/457759657.db2.gz	YHMGCJBRTGRNAW-CQSZACIVSA-N	0	3	346.356	3.080	20	30		EGEDHN
CCC[C@@H](C#N)N(C)C(=O)[C@@H]1CN(C(C)(C)C)C[C@H]1C(F)(F)F	ZINC000410833839	457761367	/nfs/dbraw/zinc/76/13/67/457761367.db2.gz	IDWYOCYXAJBXAT-YNEHKIRRSA-N	0	3	333.398	3.046	20	30		EGEDHN
COc1ccc(CNC(=O)C(C#N)CCc2ccccc2)cc1F	ZINC000433220367	457782291	/nfs/dbraw/zinc/78/22/91/457782291.db2.gz	KQACPBVEEVBPEF-MRXNPFEDSA-N	0	3	326.371	3.223	20	30		EGEDHN
CN(CCOc1ccc(F)cc1)C(=O)C(C#N)CCc1ccccc1	ZINC000433226263	457783532	/nfs/dbraw/zinc/78/35/32/457783532.db2.gz	FZMNUDGNEBCKLN-KRWDZBQOSA-N	0	3	340.398	3.435	20	30		EGEDHN
CCN1CCC[C@H]1CNC(=O)c1cn(CCCC#N)c2ccccc12	ZINC000443915519	457822658	/nfs/dbraw/zinc/82/26/58/457822658.db2.gz	JNAYGHGZWGAASY-INIZCTEOSA-N	0	3	338.455	3.159	20	30		EGEDHN
COc1ccc(CN(C)C(=O)C(C#N)CCc2ccccc2)cc1O	ZINC000433369194	457823142	/nfs/dbraw/zinc/82/31/42/457823142.db2.gz	ZWEBFXDOASAHEJ-KRWDZBQOSA-N	0	3	338.407	3.132	20	30		EGEDHN
C[C@@H](CNC(=O)C(C#N)CCc1ccccc1)Oc1ccccc1F	ZINC000433379211	457824788	/nfs/dbraw/zinc/82/47/88/457824788.db2.gz	SVXSSUWMEZDVHT-RDJZCZTQSA-N	0	3	340.398	3.482	20	30		EGEDHN
Cc1cc(CNCCOc2ncccc2C(F)(F)F)ccc1C#N	ZINC000443991660	457836633	/nfs/dbraw/zinc/83/66/33/457836633.db2.gz	WHYZARBKMDDJGK-UHFFFAOYSA-N	0	3	335.329	3.449	20	30		EGEDHN
CCCN(CCc1cccc(F)c1)[C@@H](C)C(=O)NC1(C#N)CCC1	ZINC000411277080	457847774	/nfs/dbraw/zinc/84/77/74/457847774.db2.gz	HUHJXOIFEUIZJF-HNNXBMFYSA-N	0	3	331.435	3.031	20	30		EGEDHN
C[C@H]1C[C@@H](c2cccnc2)N(CCC(=O)Nc2ccccc2C#N)C1	ZINC000411524429	457910717	/nfs/dbraw/zinc/91/07/17/457910717.db2.gz	KUFPKBNGVBILBX-KXBFYZLASA-N	0	3	334.423	3.365	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1CCSC2(CCC2)CC1	ZINC000411870918	457998921	/nfs/dbraw/zinc/99/89/21/457998921.db2.gz	PWGJMOQEVVYRBM-UHFFFAOYSA-N	0	3	332.469	3.307	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC2(C(C)(C)c3ccccc3)CC2)CC1	ZINC000458334673	458017753	/nfs/dbraw/zinc/01/77/53/458017753.db2.gz	MRHSSSNVSAYIKY-UHFFFAOYSA-N	0	3	341.499	3.446	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N(C)CC(C)(C)C#N	ZINC000458523567	458081002	/nfs/dbraw/zinc/08/10/02/458081002.db2.gz	YSTSOUCSMUCIAA-AEFFLSMTSA-N	0	3	342.487	3.088	20	30		EGEDHN
C[C@H]1[C@H](CO)CCCN1CC#Cc1ccc(OC(F)(F)F)cc1	ZINC000412095277	458088929	/nfs/dbraw/zinc/08/89/29/458088929.db2.gz	SZLSVKFQRNPULO-ZFWWWQNUSA-N	0	3	327.346	3.030	20	30		EGEDHN
C[C@H]1[C@@H](CO)CCCN1CC#Cc1ccc(OC(F)(F)F)cc1	ZINC000412095274	458089025	/nfs/dbraw/zinc/08/90/25/458089025.db2.gz	SZLSVKFQRNPULO-DZGCQCFKSA-N	0	3	327.346	3.030	20	30		EGEDHN
N#Cc1cccc(C2(C(=O)N3CCN(C4CCCCC4)CC3)CC2)c1	ZINC000435267684	458111133	/nfs/dbraw/zinc/11/11/33/458111133.db2.gz	NESWFMYOJYXCHF-UHFFFAOYSA-N	0	3	337.467	3.067	20	30		EGEDHN
C[C@@H](NC(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1)[C@H](c1ccccc1)N(C)C	ZINC000412249358	458142887	/nfs/dbraw/zinc/14/28/87/458142887.db2.gz	CDTPJYUZGNGWOX-CGRMTHRGSA-N	0	3	347.462	3.469	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@@H]2c2ccc(F)c(F)c2)CC1	ZINC000369285023	458157409	/nfs/dbraw/zinc/15/74/09/458157409.db2.gz	MTWUVUMICNSNHN-GOSISDBHSA-N	0	3	349.425	3.462	20	30		EGEDHN
Cc1ccccc1[C@@H]([C@H](C)NC(=O)NCC(C)(C)CC#N)N(C)C	ZINC000458766059	458164323	/nfs/dbraw/zinc/16/43/23/458164323.db2.gz	KAMSIQIAIXNANG-DOTOQJQBSA-N	0	3	330.476	3.225	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)N(C)C[C@H](C)C#N)N(CC)CC)cc1	ZINC000458790222	458171441	/nfs/dbraw/zinc/17/14/41/458171441.db2.gz	IBDSYNLNYIQQIW-VQIMIIECSA-N	0	3	344.503	3.433	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCN(CCOc3ccc(Cl)cc3)C2)nc1	ZINC000428794410	458212011	/nfs/dbraw/zinc/21/20/11/458212011.db2.gz	ROYKELQDPWSJRJ-KRWDZBQOSA-N	0	3	343.814	3.139	20	30		EGEDHN
C#CCOc1ccc(CNCc2ccccc2-c2cnn(C)c2)cc1	ZINC000372291813	458266060	/nfs/dbraw/zinc/26/60/60/458266060.db2.gz	RDQFLIHLSQXCLD-UHFFFAOYSA-N	0	3	331.419	3.389	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1CN[C@@H](c1cnn(C)c1)c1cccc(F)c1	ZINC000436310580	458287385	/nfs/dbraw/zinc/28/73/85/458287385.db2.gz	QLNGWMXJMGJUFY-LZQZEXGQSA-N	0	3	329.419	3.219	20	30		EGEDHN
Oc1cccc2c1C[C@H](NCC#Cc1ccc(OC(F)(F)F)cc1)C2	ZINC000429246566	458298047	/nfs/dbraw/zinc/29/80/47/458298047.db2.gz	OJKOSEWNAQCPEP-OAHLLOKOSA-N	0	3	347.336	3.399	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1C[C@H](O)C[C@H]1c1ccccc1	ZINC000413928563	458311738	/nfs/dbraw/zinc/31/17/38/458311738.db2.gz	ALVYPTPSIKOVBE-ZCNNSNEGSA-N	0	3	334.419	3.093	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@H](NCc3cn4ccccc4n3)C2)c(F)c1	ZINC000369672230	458312413	/nfs/dbraw/zinc/31/24/13/458312413.db2.gz	NCKFTXKAKBQKDV-INIZCTEOSA-N	0	3	349.413	3.104	20	30		EGEDHN
C=CCOc1ccc(CN2CCC(c3ccncn3)CC2)cc1OC	ZINC000414468263	458319176	/nfs/dbraw/zinc/31/91/76/458319176.db2.gz	GDOIZVMONCQHPH-UHFFFAOYSA-N	0	3	339.439	3.430	20	30		EGEDHN
N#C[C@@H](NC(=O)C12CCCN1CCC2)c1cccc(C(F)(F)F)c1	ZINC000415383474	458331830	/nfs/dbraw/zinc/33/18/30/458331830.db2.gz	SVFGJWAUXMGQJA-CQSZACIVSA-N	0	3	337.345	3.015	20	30		EGEDHN
CC(C)(C)n1cc(C#N)cc1NC(=O)NCc1ccc2c(c1)CNC2	ZINC000415582193	458332355	/nfs/dbraw/zinc/33/23/55/458332355.db2.gz	TZCTUKQQRPGCBT-UHFFFAOYSA-N	0	3	337.427	3.040	20	30		EGEDHN
CN(C)[C@H](CC(=O)N[C@@H](C#N)c1ccccc1F)c1ccccc1	ZINC000416152096	458340071	/nfs/dbraw/zinc/34/00/71/458340071.db2.gz	UVAOTMXNJVLWEV-ZWKOTPCHSA-N	0	3	325.387	3.200	20	30		EGEDHN
N#Cc1ccc(N2CCC(N[C@H]3COCc4ccccc43)CC2)cc1	ZINC000417372097	458362587	/nfs/dbraw/zinc/36/25/87/458362587.db2.gz	WNFXMCLVFMEZOE-NRFANRHFSA-N	0	3	333.435	3.388	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc(OCC)cc2F)CC1	ZINC000417450508	458363346	/nfs/dbraw/zinc/36/33/46/458363346.db2.gz	DSZCGYQPMZZURO-UHFFFAOYSA-N	0	3	335.423	3.386	20	30		EGEDHN
C[C@@H](NC(=O)N1CCCNCC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000417996246	458369407	/nfs/dbraw/zinc/36/94/07/458369407.db2.gz	QWCWGDGSHWVSTQ-MRXNPFEDSA-N	0	3	348.450	3.291	20	30		EGEDHN
C=CCC(C)(C)C(=O)Nc1ccc(CN2CCN(CC)CC2)cc1	ZINC000429860818	458377764	/nfs/dbraw/zinc/37/77/64/458377764.db2.gz	QDRGVJMTFJYDOG-UHFFFAOYSA-N	0	3	329.488	3.365	20	30		EGEDHN
C=CCC[C@@H]1NC(=O)N(C[C@H](c2ccc(C)cc2)N2CCCC2)C1=O	ZINC000419957178	458395302	/nfs/dbraw/zinc/39/53/02/458395302.db2.gz	VABOPVLXDZUDBV-ZWKOTPCHSA-N	0	3	341.455	3.019	20	30		EGEDHN
CC(C)(C)O[C@@H]1C[C@H](NCc2ccc(C#N)c(F)c2)[C@H]1n1cccn1	ZINC000421374201	458412798	/nfs/dbraw/zinc/41/27/98/458412798.db2.gz	BHROPADFSHXWMR-RCCFBDPRSA-N	0	3	342.418	3.181	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)NCC1(CC#N)CC1)c1ccsc1	ZINC000430202542	458420755	/nfs/dbraw/zinc/42/07/55/458420755.db2.gz	YJSSTFWICYGZJM-HNNXBMFYSA-N	0	3	334.489	3.124	20	30		EGEDHN
COc1ccc(CN2CC[C@H](OC)[C@@H](C)C2)cc1OCCCC#N	ZINC000449493989	458425090	/nfs/dbraw/zinc/42/50/90/458425090.db2.gz	FVPFUMQQTWZAEQ-RDJZCZTQSA-N	0	3	332.444	3.235	20	30		EGEDHN
Cc1[nH]c(C#N)cc1C(=O)NC1CCN([C@@H](C)c2ccccc2)CC1	ZINC000449874380	458433500	/nfs/dbraw/zinc/43/35/00/458433500.db2.gz	BJTBHIBKECYWKS-HNNXBMFYSA-N	0	3	336.439	3.150	20	30		EGEDHN
COC(=O)c1cc2c(o1)c(OC)ccc2CNCC(C)(C)CC#N	ZINC000459729956	458460702	/nfs/dbraw/zinc/46/07/02/458460702.db2.gz	LEBOXCJVMDOPJE-UHFFFAOYSA-N	0	3	330.384	3.257	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N[C@H]1C[C@H](OC)C12CCC2	ZINC000459746650	458467643	/nfs/dbraw/zinc/46/76/43/458467643.db2.gz	FWEGECBOCXLIMQ-XIRDDKMYSA-N	0	3	348.512	3.198	20	30		EGEDHN
CCO[C@H]1C[C@H](NCC(=O)Nc2ccc(C#N)c(Cl)c2)C12CCC2	ZINC000451480295	458478418	/nfs/dbraw/zinc/47/84/18/458478418.db2.gz	OLQCQBVLGCOIES-HOTGVXAUSA-N	0	3	347.846	3.087	20	30		EGEDHN
CC1(C)[C@H](NCc2ccc(C#N)cc2OC(F)F)[C@@H]2CCCO[C@H]21	ZINC000451478005	458478756	/nfs/dbraw/zinc/47/87/56/458478756.db2.gz	JIFAOXIYHWPOCU-NUEKZKHPSA-N	0	3	336.382	3.453	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCC(=O)N[C@@H](c1ccccc1)C1CCCCC1	ZINC000451601576	458482327	/nfs/dbraw/zinc/48/23/27/458482327.db2.gz	ASTHTZKQIXGSPZ-DYXWJJEUSA-N	0	3	342.483	3.357	20	30		EGEDHN
N#Cc1ccc(Br)c(CN[C@@H]([C@@H](CO)C2CC2)C2CC2)c1	ZINC000451618204	458483376	/nfs/dbraw/zinc/48/33/76/458483376.db2.gz	VQNQKZKRLHCYBG-DOTOQJQBSA-N	0	3	349.272	3.207	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)[C@@]2(C#N)C[C@@H]2C)N(CC)CC)cc1	ZINC000452134068	458494975	/nfs/dbraw/zinc/49/49/75/458494975.db2.gz	SLJUFDNKCBGRDK-ZAAXVRCTSA-N	0	3	327.472	3.298	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(CC)[C@@H]2CCOC(C)(C)C2)CC1	ZINC000460252523	458508497	/nfs/dbraw/zinc/50/84/97/458508497.db2.gz	AJNCIANYTZTACZ-QGZVFWFLSA-N	0	3	337.508	3.016	20	30		EGEDHN
CN1C[C@H](NC(=O)C[C@H](CC#N)c2ccccc2)[C@@H](c2ccccc2)C1	ZINC000373534843	458522215	/nfs/dbraw/zinc/52/22/15/458522215.db2.gz	KNAQOOVNPDLGMH-HBMCJLEFSA-N	0	3	347.462	3.288	20	30		EGEDHN
CN1C[C@H](NC(=O)C[C@@H](CC#N)c2ccccc2)[C@@H](c2ccccc2)C1	ZINC000373534846	458522284	/nfs/dbraw/zinc/52/22/84/458522284.db2.gz	KNAQOOVNPDLGMH-NJYVYQBISA-N	0	3	347.462	3.288	20	30		EGEDHN
C=CCn1c(-c2ccccc2)nnc1N1CCN([C@@H](C)CC)CC1	ZINC000453445683	458530834	/nfs/dbraw/zinc/53/08/34/458530834.db2.gz	NVHQXZBKFNUFHG-INIZCTEOSA-N	0	3	325.460	3.052	20	30		EGEDHN
C=C(C)Cn1c([C@@H]2CCCCO2)nnc1N1C[C@@H](C)N(CC)C[C@H]1C	ZINC000453467250	458534671	/nfs/dbraw/zinc/53/46/71/458534671.db2.gz	QRUPKYISLDGIAJ-ZACQAIPSSA-N	0	3	347.507	3.015	20	30		EGEDHN
C[C@]1(CO)CCC[C@H]1NCC#Cc1ccc(OC(F)(F)F)cc1	ZINC000493711166	458542208	/nfs/dbraw/zinc/54/22/08/458542208.db2.gz	UANVLBWCQWLBNB-HZPDHXFCSA-N	0	3	327.346	3.077	20	30		EGEDHN
Cc1ccc(CCC2CCN(C(=O)[C@@H](N)CCCC#N)CC2)cc1	ZINC000424072744	458550277	/nfs/dbraw/zinc/55/02/77/458550277.db2.gz	YXYQUNRXCXJOAA-IBGZPJMESA-N	0	3	327.472	3.187	20	30		EGEDHN
CSc1ccc(-c2csc(NC(=O)[C@H](N)CCCC#N)n2)cc1	ZINC000424071293	458550980	/nfs/dbraw/zinc/55/09/80/458550980.db2.gz	ZKDLVZWKPCVMEZ-CYBMUJFWSA-N	0	3	346.481	3.492	20	30		EGEDHN
CCCN(Cc1c(F)cccc1Cl)C(=O)[C@H](N)CCCC#N	ZINC000424088838	458555690	/nfs/dbraw/zinc/55/56/90/458555690.db2.gz	JVEWRWQFYZBGMG-OAHLLOKOSA-N	0	3	325.815	3.239	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N[C@H](CCc1ccccc1)c1ccccc1	ZINC000424086317	458555963	/nfs/dbraw/zinc/55/59/63/458555963.db2.gz	BUNPJXGQHVELQF-WOJBJXKFSA-N	0	3	335.451	3.498	20	30		EGEDHN
CC[C@H](Cc1ccccc1)N(CC)CC(=O)N[C@](C)(C#N)C(C)C	ZINC000469142718	458557138	/nfs/dbraw/zinc/55/71/38/458557138.db2.gz	ZQSOSEAPWXMAPW-UYAOXDASSA-N	0	3	329.488	3.384	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1ccccc1OCCc1ccccc1	ZINC000424106718	458560180	/nfs/dbraw/zinc/56/01/80/458560180.db2.gz	XVVUYSAXUHBIDJ-QGZVFWFLSA-N	0	3	337.423	3.268	20	30		EGEDHN
C[C@H](C(=O)NC1CCN(Cc2ccccc2)CC1)c1cccc(C#N)c1	ZINC000461729682	458570042	/nfs/dbraw/zinc/57/00/42/458570042.db2.gz	SLHCAIHSYIVDBO-KRWDZBQOSA-N	0	3	347.462	3.443	20	30		EGEDHN
C[C@@H](CN1CCC[C@H](C)C1)NC(=O)C(C)(C)Cc1ccc(C#N)cc1	ZINC000454995225	458582212	/nfs/dbraw/zinc/58/22/12/458582212.db2.gz	NJAFJEJCFLKADL-IRXDYDNUSA-N	0	3	341.499	3.364	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NC[C@H]1CCOc2ccccc21	ZINC000469644878	458582387	/nfs/dbraw/zinc/58/23/87/458582387.db2.gz	PHDDKRJABMZAGO-QZTJIDSGSA-N	0	3	334.419	3.441	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H](N(CCCSCC#N)C2CC2)C1	ZINC000493909121	458598932	/nfs/dbraw/zinc/59/89/32/458598932.db2.gz	ULIUXSJRDJDRLV-OAHLLOKOSA-N	0	3	339.505	3.107	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCC(C)(C)c2ccc(CC)cc2)CC1	ZINC000431642941	458601154	/nfs/dbraw/zinc/60/11/54/458601154.db2.gz	JQVZKYIILVWRIV-UHFFFAOYSA-N	0	3	343.515	3.476	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(CC#N)cc2Cl)CC1	ZINC000455712108	458608681	/nfs/dbraw/zinc/60/86/81/458608681.db2.gz	ZTRKAIQSVGFQLV-UHFFFAOYSA-N	0	3	332.835	3.178	20	30		EGEDHN
N#Cc1ccc(OCCCN2CC[C@H](OCc3ccncc3)C2)cc1	ZINC000373829400	458618048	/nfs/dbraw/zinc/61/80/48/458618048.db2.gz	BGPDPNWKAYZDGK-FQEVSTJZSA-N	0	3	337.423	3.013	20	30		EGEDHN
C[C@H](C(=O)N[C@H](CN(C)C)c1ccc(F)cc1)c1cccc(C#N)c1	ZINC000462465973	458622220	/nfs/dbraw/zinc/62/22/20/458622220.db2.gz	MYDSQTIVJOBHPV-IFXJQAMLSA-N	0	3	339.414	3.220	20	30		EGEDHN
C[C@H](C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C)c1cccc(C#N)c1	ZINC000462502345	458627110	/nfs/dbraw/zinc/62/71/10/458627110.db2.gz	OMELMVGYCKXOFG-XGHQBKJUSA-N	0	3	347.462	3.298	20	30		EGEDHN
C[C@H](C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C)c1cccc(C#N)c1	ZINC000462502344	458627637	/nfs/dbraw/zinc/62/76/37/458627637.db2.gz	OMELMVGYCKXOFG-WWMYMODYSA-N	0	3	347.462	3.298	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1ccc(N(C)C)cc1F)C(C)C	ZINC000502306366	458645290	/nfs/dbraw/zinc/64/52/90/458645290.db2.gz	ZZHVJOJQIGVJNO-LJQANCHMSA-N	0	3	347.478	3.320	20	30		EGEDHN
C[C@H]1CCCN(CCNc2c(C#N)cnc3c(F)c(F)c(F)cc32)C1	ZINC000439096482	458653955	/nfs/dbraw/zinc/65/39/55/458653955.db2.gz	KKGOYOJRXHUQDN-NSHDSACASA-N	0	3	348.372	3.089	20	30		EGEDHN
C=C(C)CN1CCC(Nc2nnc(-c3cccc(F)c3)cc2C)CC1	ZINC000462828087	458659680	/nfs/dbraw/zinc/65/96/80/458659680.db2.gz	LFTBDUDYLXAXRP-UHFFFAOYSA-N	0	3	340.446	3.465	20	30		EGEDHN
C[C@H]1CCCC[C@H]1C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000424593074	458674331	/nfs/dbraw/zinc/67/43/31/458674331.db2.gz	BXIYKPYOEPQZGU-QFBILLFUSA-N	0	3	327.472	3.275	20	30		EGEDHN
C=CCC(C)(C)CNC(=O)NCc1ccccc1OCCN(C)C	ZINC000432092484	458675946	/nfs/dbraw/zinc/67/59/46/458675946.db2.gz	IEHBOEXMRSDYJH-UHFFFAOYSA-N	0	3	333.476	3.029	20	30		EGEDHN
C=CCC1(C(=O)NC[C@H]2CCCN2Cc2ccccc2)CCOCC1	ZINC000424669711	458701605	/nfs/dbraw/zinc/70/16/05/458701605.db2.gz	SXLJRSRXYUGESS-LJQANCHMSA-N	0	3	342.483	3.140	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)CCOCC1	ZINC000424669709	458702186	/nfs/dbraw/zinc/70/21/86/458702186.db2.gz	SXLJRSRXYUGESS-IBGZPJMESA-N	0	3	342.483	3.140	20	30		EGEDHN
CO[C@@H]1C[C@H](N(C)C(=O)C(C#N)CCc2ccccc2)C12CCC2	ZINC000456591220	458722770	/nfs/dbraw/zinc/72/27/70/458722770.db2.gz	QAQJUVDNGGMPPZ-OKZBNKHCSA-N	0	3	326.440	3.175	20	30		EGEDHN
C=C[C@@H]1CCCCN1C(=O)NCCCN1CCc2ccccc2C1	ZINC000494662857	458724969	/nfs/dbraw/zinc/72/49/69/458724969.db2.gz	TXMARWAATVZPHR-LJQANCHMSA-N	0	3	327.472	3.185	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](CN(C)Cc2scnc2C)C1	ZINC000424802875	458736159	/nfs/dbraw/zinc/73/61/59/458736159.db2.gz	YAPLHEDWXBPWNI-HNNXBMFYSA-N	0	3	335.517	3.334	20	30		EGEDHN
C=CCn1c(N2CCN(C3CCCCC3)CC2)nnc1C(C)(C)C	ZINC000508734313	458761449	/nfs/dbraw/zinc/76/14/49/458761449.db2.gz	QPHYVRBHENPQOQ-UHFFFAOYSA-N	0	3	331.508	3.216	20	30		EGEDHN
C=C[C@H](C)NC(=O)N1CC[C@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000464751904	458768258	/nfs/dbraw/zinc/76/82/58/458768258.db2.gz	MZSXEUFMYFKYMG-FXAWDEMLSA-N	0	3	327.472	3.259	20	30		EGEDHN
CCC(C)(C)N(C)CC(=O)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000512267618	458784613	/nfs/dbraw/zinc/78/46/13/458784613.db2.gz	YGUOFIGKZDVGFN-UHFFFAOYSA-N	0	3	340.389	3.294	20	30		EGEDHN
C[C@@H]1C[C@H](c2ccccc2)N(CC(=O)NCc2cccc(C#N)c2)C1	ZINC000513271456	458794370	/nfs/dbraw/zinc/79/43/70/458794370.db2.gz	KRDRCXYGEWUQGN-OXQOHEQNSA-N	0	3	333.435	3.258	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN(C)Cc1cccc(OC)c1	ZINC000514712716	458800498	/nfs/dbraw/zinc/80/04/98/458800498.db2.gz	BHGAWIVCNCEPHU-IBGZPJMESA-N	0	3	341.451	3.295	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNc1cc(C(F)(F)F)nc(C)n1)C(C)C	ZINC000515037280	458804676	/nfs/dbraw/zinc/80/46/76/458804676.db2.gz	PVDHEMIRBRNREK-CQSZACIVSA-N	0	3	342.409	3.336	20	30		EGEDHN
CC(C)c1cccc(CNC[C@@H](O)COc2ccc(CC#N)cc2)c1	ZINC000516862806	458822206	/nfs/dbraw/zinc/82/22/06/458822206.db2.gz	IHNVUSYKJODIAX-HXUWFJFHSA-N	0	3	338.451	3.406	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H]2CCN(c3ccccc3)[C@@H]2C)CC1	ZINC000473571810	458835716	/nfs/dbraw/zinc/83/57/16/458835716.db2.gz	VMLNVNGGGKSBOS-YLJYHZDGSA-N	0	3	341.499	3.058	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc3nc(C)c(C)nc3c2)CC1	ZINC000518496790	458872585	/nfs/dbraw/zinc/87/25/85/458872585.db2.gz	GJJIURNUCPEKAN-UHFFFAOYSA-N	0	3	338.455	3.017	20	30		EGEDHN
Cc1ccc2c(c1)CC[C@H]2NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000552226883	458891087	/nfs/dbraw/zinc/89/10/87/458891087.db2.gz	RMSDZFASQXLUJK-WIYYLYMNSA-N	0	3	336.435	3.078	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC2(CC(NCc3cccc(C#N)c3)C2)C1	ZINC000495600462	458893959	/nfs/dbraw/zinc/89/39/59/458893959.db2.gz	FTCPEPONLHMFCD-UHFFFAOYSA-N	0	3	327.428	3.047	20	30		EGEDHN
C=CCN(CCc1ccccc1)C[C@@H](O)COc1ccccc1C	ZINC000553495691	458895048	/nfs/dbraw/zinc/89/50/48/458895048.db2.gz	JXBPAOZXLBGKKE-HXUWFJFHSA-N	0	3	325.452	3.465	20	30		EGEDHN
CC1(C)CCCN(C(=O)[C@H]2CCN(Cc3ccccc3)C2)[C@H]1C#N	ZINC000553578697	458895716	/nfs/dbraw/zinc/89/57/16/458895716.db2.gz	VUGORMKCOILJLF-ROUUACIJSA-N	0	3	325.456	3.049	20	30		EGEDHN
C=CC[C@H](CC)NC(=O)N(CCN(C)C)Cc1ccc(F)cc1F	ZINC000466379251	458896864	/nfs/dbraw/zinc/89/68/64/458896864.db2.gz	WOEKCDVVVBKEGH-INIZCTEOSA-N	0	3	339.430	3.393	20	30		EGEDHN
C[C@H](C(=O)N(C)CCC#N)N1CCC[C@@H](CCCc2ccccc2)C1	ZINC000441215021	458901085	/nfs/dbraw/zinc/90/10/85/458901085.db2.gz	ZGXZGMBOYCSJMC-UYAOXDASSA-N	0	3	341.499	3.482	20	30		EGEDHN
CC[C@H](Cc1ccc(C)cc1)N(CC)CC(=O)N[C@@](C)(C#N)C1CC1	ZINC000441358818	458927031	/nfs/dbraw/zinc/92/70/31/458927031.db2.gz	OQTJONCVWJJMJS-CTNGQTDRSA-N	0	3	341.499	3.447	20	30		EGEDHN
C=CCCN(C)CC(=O)NC[C@@H](c1ccccc1Cl)N1CCCC1	ZINC000467296422	458965589	/nfs/dbraw/zinc/96/55/89/458965589.db2.gz	DFAJMQZDDNBOPB-SFHVURJKSA-N	0	3	349.906	3.101	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)N(C)CC(C)(C)C#N)N(C)C)cc1	ZINC000457476791	458970761	/nfs/dbraw/zinc/97/07/61/458970761.db2.gz	KKGVROGYMPMWIV-QGZVFWFLSA-N	0	3	330.476	3.043	20	30		EGEDHN
CCn1ncc2cc(C(=O)C(C#N)c3nc4ccccc4[nH]3)c(C)nc21	ZINC000442002008	458987142	/nfs/dbraw/zinc/98/71/42/458987142.db2.gz	NCMTZROJEHJUAG-AWEZNQCLSA-N	0	3	344.378	3.126	20	30		EGEDHN
CC[C@H](CNCc1ccc(O[C@@H](C)C#N)cc1)NC(=O)OC(C)(C)C	ZINC000495916260	459003504	/nfs/dbraw/zinc/00/35/04/459003504.db2.gz	UUIWFPPICNQUGJ-GOEBONIOSA-N	0	3	347.459	3.370	20	30		EGEDHN
CC[C@@H](CN[C@@H]1CCc2ccc(C#N)cc21)NC(=O)OC(C)(C)C	ZINC000495925490	459007517	/nfs/dbraw/zinc/00/75/17/459007517.db2.gz	XYEWKSAWEJPVQR-DOTOQJQBSA-N	0	3	329.444	3.438	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)C[C@@H](O)Cc1ccc(F)cc1	ZINC000566986792	459033340	/nfs/dbraw/zinc/03/33/40/459033340.db2.gz	LYEXKRHABDXZDB-IBGZPJMESA-N	0	3	329.415	3.426	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1ccc(F)c(OC)c1)C(C)C	ZINC000477231924	459037071	/nfs/dbraw/zinc/03/70/71/459037071.db2.gz	OIXXNGNWNOXDGS-KRWDZBQOSA-N	0	3	334.435	3.263	20	30		EGEDHN
C=C(C)CS(=O)(=O)NCC(CC)(CC)N[C@@H](C)c1ccccc1	ZINC000477599799	459050141	/nfs/dbraw/zinc/05/01/41/459050141.db2.gz	FYANFKBWAAXUNE-INIZCTEOSA-N	0	3	338.517	3.392	20	30		EGEDHN
CCC1(CC)[C@H](N[C@H](C)C(=O)NC2(C#N)CCCCC2)[C@H](C)[C@H]1OC	ZINC000557127542	459050372	/nfs/dbraw/zinc/05/03/72/459050372.db2.gz	QKIUHMIIDKSSPM-YLFCFFPRSA-N	0	3	349.519	3.147	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC(=O)Nc1nc(-c2cccs2)cs1	ZINC000567351740	459091350	/nfs/dbraw/zinc/09/13/50/459091350.db2.gz	WHHNENAISCAIFU-YPMHNXCESA-N	0	3	349.481	3.133	20	30		EGEDHN
C[C@H]1C[C@H]1N1CCN(C(=O)c2ccc(C#N)c(Cl)c2)C[C@@H](C)C1	ZINC000558023228	459125963	/nfs/dbraw/zinc/12/59/63/459125963.db2.gz	IMOGADHUMIAZCE-GDZNZVCISA-N	0	3	331.847	3.014	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CNCc2ccc(C3CCC3)cc2)cc1	ZINC000521228199	459132862	/nfs/dbraw/zinc/13/28/62/459132862.db2.gz	PCCCARKRHBMYNR-FQEVSTJZSA-N	0	3	336.435	3.355	20	30		EGEDHN
C[C@H](CNC(=O)NC1(c2cccc(C#N)c2)CC1)N1CCCC[C@@H]1C	ZINC000479387245	459136819	/nfs/dbraw/zinc/13/68/19/459136819.db2.gz	NPGCHCALTIYMOO-JKSUJKDBSA-N	0	3	340.471	3.109	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)C(=O)NC[C@@H]1CCCCN1C1CC1	ZINC000567728454	459155835	/nfs/dbraw/zinc/15/58/35/459155835.db2.gz	AJPPFYYGMIGDSP-BEFAXECRSA-N	0	3	340.471	3.278	20	30		EGEDHN
C=CCOc1cccc(NC(=O)NC[C@@H](C)N2CCC(C)CC2)c1	ZINC000521466981	459156535	/nfs/dbraw/zinc/15/65/35/459156535.db2.gz	YOTYESNTUKYSST-MRXNPFEDSA-N	0	3	331.460	3.493	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCOc2c(C)cccc2C)CC1	ZINC000521573590	459162376	/nfs/dbraw/zinc/16/23/76/459162376.db2.gz	HHGNGGYORQKIDF-UHFFFAOYSA-N	0	3	330.472	3.229	20	30		EGEDHN
Cc1ccccc1[C@@H]1C[C@H](C)N([C@@H](C(N)=O)c2ccc(C#N)cc2)C1	ZINC000532976857	459170544	/nfs/dbraw/zinc/17/05/44/459170544.db2.gz	NPDAWDYVPUBIKA-QKYXUNIQSA-N	0	3	333.435	3.271	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@H](N[C@H]1CC(=O)N(c3ccccc3F)C1)CC2	ZINC000521712214	459173222	/nfs/dbraw/zinc/17/32/22/459173222.db2.gz	RWFGFKSWDWIFHO-MAUKXSAKSA-N	0	3	335.382	3.080	20	30		EGEDHN
N#CCN1CCC(NCc2ccc(Oc3ccc(F)cc3)nc2)CC1	ZINC000594923811	459177110	/nfs/dbraw/zinc/17/71/10/459177110.db2.gz	JREDMNUTTHITAC-UHFFFAOYSA-N	0	3	340.402	3.091	20	30		EGEDHN
N#Cc1cnn2cc(CN[C@H]3C[C@H](c4ccc(Cl)cc4)C3)cnc12	ZINC000567889046	459184788	/nfs/dbraw/zinc/18/47/88/459184788.db2.gz	WMWDRIKHOMRCPU-CZIWCDLHSA-N	0	3	337.814	3.290	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C[C@H]2CCc3ccccc3C2)CC1	ZINC000480596719	459208070	/nfs/dbraw/zinc/20/80/70/459208070.db2.gz	RXLGZRCMNRZQMG-KRWDZBQOSA-N	0	3	326.484	3.338	20	30		EGEDHN
C[C@H](N[C@@H]1CCCc2cc(C#N)ccc21)C(=O)NCCc1ccccc1	ZINC000590779932	459215191	/nfs/dbraw/zinc/21/51/91/459215191.db2.gz	DKDNJUPOHKNHEA-HRAATJIYSA-N	0	3	347.462	3.273	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2cnc(-c3ccccc3)nc2)nc(C)n1	ZINC000522231492	459228363	/nfs/dbraw/zinc/22/83/63/459228363.db2.gz	ITANMAVBNFCUJT-INIZCTEOSA-N	0	3	329.363	3.041	20	30		EGEDHN
Cc1c([C@H](C)NCCc2ccc(C#N)cc2)nnn1-c1ccccc1	ZINC000595055472	459229664	/nfs/dbraw/zinc/22/96/64/459229664.db2.gz	FDPCNSQBFCYLSY-HNNXBMFYSA-N	0	3	331.423	3.341	20	30		EGEDHN
COC(=O)Nc1cccc(CNCc2ccc(C#N)c(OC)c2)c1	ZINC000496541743	459233783	/nfs/dbraw/zinc/23/37/83/459233783.db2.gz	DQFWLSGSQCSBIR-UHFFFAOYSA-N	0	3	325.368	3.035	20	30		EGEDHN
CC[C@@H](N[C@@H]1CC(=O)N(c2ccc(OC)cc2)C1)c1ccc(C#N)cc1	ZINC000595077341	459238473	/nfs/dbraw/zinc/23/84/73/459238473.db2.gz	HBKCQAZYCZVPAE-YLJYHZDGSA-N	0	3	349.434	3.413	20	30		EGEDHN
N#CCc1ccc(CN2CCC(O)(Cc3ccc(F)cc3)CC2)cc1	ZINC000481606833	459264876	/nfs/dbraw/zinc/26/48/76/459264876.db2.gz	BCOCOWQTNLSBBM-UHFFFAOYSA-N	0	3	338.426	3.461	20	30		EGEDHN
CN(CC[C@@H]1Sc2ccccc2NC1=O)Cc1ccc(C#N)cc1	ZINC000595290096	459267441	/nfs/dbraw/zinc/26/74/41/459267441.db2.gz	VCBLNNUEAIBZOJ-SFHVURJKSA-N	0	3	337.448	3.493	20	30		EGEDHN
COc1ccc([C@@H](Cc2ccc(F)cc2)NC(=O)C(C)C#N)cc1	ZINC000522980258	459275560	/nfs/dbraw/zinc/27/55/60/459275560.db2.gz	UGSBCWMXWRSAQV-SCLBCKFNSA-N	0	3	326.371	3.394	20	30		EGEDHN
C[C@H]1CCCC[C@H]1CCNCCS(=O)(=O)c1ccc(C#N)cc1	ZINC000568502090	459298423	/nfs/dbraw/zinc/29/84/23/459298423.db2.gz	FHCXGDFKZGYPSC-RDJZCZTQSA-N	0	3	334.485	3.138	20	30		EGEDHN
C[C@@H](C(=O)N(CCC#N)c1ccccc1)N1CC[C@@H](C2CCC2)C1	ZINC000591061768	459303338	/nfs/dbraw/zinc/30/33/38/459303338.db2.gz	HORQMXKZOAWTBR-FUHWJXTLSA-N	0	3	325.456	3.444	20	30		EGEDHN
C=CCCCCCN(C)C(=O)[C@@H]1CCCN(Cc2cccnc2)C1	ZINC000523538175	459312707	/nfs/dbraw/zinc/31/27/07/459312707.db2.gz	UXEPGOHADZGMGB-LJQANCHMSA-N	0	3	329.488	3.498	20	30		EGEDHN
N#Cc1cccc(C2(NC3CCN(Cc4ccncc4)CC3)CC2)c1	ZINC000560258883	459316720	/nfs/dbraw/zinc/31/67/20/459316720.db2.gz	IAAVAMLXRGEHEW-UHFFFAOYSA-N	0	3	332.451	3.197	20	30		EGEDHN
C[C@H](CO)N(CC#Cc1ccc(OC(F)(F)F)cc1)CC1CCC1	ZINC000483135321	459344540	/nfs/dbraw/zinc/34/45/40/459344540.db2.gz	FSCKQRBZYOWNPP-CQSZACIVSA-N	0	3	341.373	3.420	20	30		EGEDHN
N#Cc1cc(Br)cnc1NC[C@@H]1CCCCN1C1CC1	ZINC000582341542	459348023	/nfs/dbraw/zinc/34/80/23/459348023.db2.gz	PBZVTNRSCIOMBL-AWEZNQCLSA-N	0	3	335.249	3.145	20	30		EGEDHN
COC1(CN2CCN([C@@H](C#N)c3ccccc3)CC2)CCCCC1	ZINC000483175485	459348030	/nfs/dbraw/zinc/34/80/30/459348030.db2.gz	UIVZXXZFEXNEGX-IBGZPJMESA-N	0	3	327.472	3.218	20	30		EGEDHN
CCCOc1ccc(C(C)(C)NCC(=O)N[C@](C)(C#N)C(C)C)cc1	ZINC000483274973	459356338	/nfs/dbraw/zinc/35/63/38/459356338.db2.gz	ZXVVBLYLQIMDTE-HXUWFJFHSA-N	0	3	345.487	3.355	20	30		EGEDHN
C[C@@H](N[C@H]1CCCc2cc(C#N)ccc21)c1cccc(-n2cnnn2)c1	ZINC000591348828	459358545	/nfs/dbraw/zinc/35/85/45/459358545.db2.gz	FLINLJVMVUPYEF-VLIAUNLRSA-N	0	3	344.422	3.262	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N(CCN1CCCC1)c1ccccc1)OCC	ZINC000535911324	459358792	/nfs/dbraw/zinc/35/87/92/459358792.db2.gz	VVBZMKZBGADKHA-IBGZPJMESA-N	0	3	330.472	3.487	20	30		EGEDHN
C[C@@H](CN1CCC(C)CC1)NC(=O)NCc1ccc(C#N)c(Cl)c1	ZINC000595599784	459360155	/nfs/dbraw/zinc/36/01/55/459360155.db2.gz	CHTHJTDRGJORAQ-AWEZNQCLSA-N	0	3	348.878	3.131	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2NCc1ccccc1-n1cncn1	ZINC000591357538	459361811	/nfs/dbraw/zinc/36/18/11/459361811.db2.gz	LVDCGKRMSQOHFM-LJQANCHMSA-N	0	3	329.407	3.306	20	30		EGEDHN
COCCC1(CNC(=O)C(C#N)CCc2ccccc2)CCCC1	ZINC000537285938	459364579	/nfs/dbraw/zinc/36/45/79/459364579.db2.gz	ZTYPCWPZIKSZNZ-GOSISDBHSA-N	0	3	328.456	3.472	20	30		EGEDHN
C[C@H](OC[C@@H](O)CN1CCC[C@H](CC#N)C1)c1ccc(Cl)cc1	ZINC000595610474	459365548	/nfs/dbraw/zinc/36/55/48/459365548.db2.gz	ZLCFHEZXGAVKTR-DAYGRLMNSA-N	0	3	336.863	3.404	20	30		EGEDHN
N#CC[C@H]1CCCN(C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000595610239	459365840	/nfs/dbraw/zinc/36/58/40/459365840.db2.gz	ULCMEEVVDVIOAN-OLZOCXBDSA-N	0	3	343.254	3.359	20	30		EGEDHN
N#CC[C@@H]1CCCN(C[C@@H](O)CO[C@H]2CCCc3ccccc32)C1	ZINC000595611909	459366404	/nfs/dbraw/zinc/36/64/04/459366404.db2.gz	OXNFWIJARGWGMM-HQRMLTQVSA-N	0	3	328.456	3.067	20	30		EGEDHN
C=CCN(CCC(=O)Nc1ccc(C#N)c(Cl)c1)[C@H](C)COC	ZINC000595638982	459378890	/nfs/dbraw/zinc/37/88/90/459378890.db2.gz	QLFMGHCROOGDIW-CYBMUJFWSA-N	0	3	335.835	3.063	20	30		EGEDHN
CC(C)CN(C(=O)c1ccc(Cl)c(C#N)c1)C1CCN(C)CC1	ZINC000540883551	459395769	/nfs/dbraw/zinc/39/57/69/459395769.db2.gz	WQXMNDNTDYSWOW-UHFFFAOYSA-N	0	3	333.863	3.404	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H](NCc2ccc(C#N)cn2)C(C)(C)C1	ZINC000497005829	459401789	/nfs/dbraw/zinc/40/17/89/459401789.db2.gz	VAUIXYPLYNZQNM-INIZCTEOSA-N	0	3	344.459	3.078	20	30		EGEDHN
N#Cc1cccc(CNC(=O)CN2CC[C@@H](C3CCCCC3)C2)c1	ZINC000595733841	459418141	/nfs/dbraw/zinc/41/81/41/459418141.db2.gz	JWVBCCKZGXJHJA-LJQANCHMSA-N	0	3	325.456	3.077	20	30		EGEDHN
N#Cc1cccc(C2(NCCc3nc4ccccc4c(=O)[nH]3)CC2)c1	ZINC000582771634	459424763	/nfs/dbraw/zinc/42/47/63/459424763.db2.gz	CSMQALFHRNBHGM-UHFFFAOYSA-N	0	3	330.391	3.028	20	30		EGEDHN
Cc1cccc(OC[C@@H](O)CNCc2ccc(C#N)c(Cl)c2)c1	ZINC000591765945	459431326	/nfs/dbraw/zinc/43/13/26/459431326.db2.gz	VCWYLZFYMZWINT-INIZCTEOSA-N	0	3	330.815	3.050	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)C[C@H](O)COc1ccc(CC#N)cc1	ZINC000591853638	459454867	/nfs/dbraw/zinc/45/48/67/459454867.db2.gz	AYYVUQAPJKZPIZ-UZLBHIALSA-N	0	3	349.434	3.057	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N(C)C[C@H](O)COc1ccc(CC#N)cc1	ZINC000591853631	459455688	/nfs/dbraw/zinc/45/56/88/459455688.db2.gz	AYYVUQAPJKZPIZ-JXFKEZNVSA-N	0	3	349.434	3.057	20	30		EGEDHN
Cc1nnc(-c2ccc(C(=O)C(C#N)c3nc4ccccc4[nH]3)cc2)o1	ZINC000541720101	459483588	/nfs/dbraw/zinc/48/35/88/459483588.db2.gz	KSZMWCAHSJDSCL-AWEZNQCLSA-N	0	3	343.346	3.411	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@H]1CCC[C@H]1NCc1ccc(CC#N)cc1	ZINC000497267577	459508972	/nfs/dbraw/zinc/50/89/72/459508972.db2.gz	DKHGJRWANPPYHE-SJORKVTESA-N	0	3	329.444	3.288	20	30		EGEDHN
C[C@@H]1CCN(CC(=O)NCc2ccc(C#N)cc2)[C@H]2CCCC[C@@H]12	ZINC000562140552	459513281	/nfs/dbraw/zinc/51/32/81/459513281.db2.gz	DAEIKVSZQPLDJI-MNEFBYGVSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@@H]1CN(C)CC[C@H]1N(C)c1cc(Br)c(C#N)cc1F	ZINC000569824661	459516107	/nfs/dbraw/zinc/51/61/07/459516107.db2.gz	IXKSHXGSOLGVET-QMTHXVAHSA-N	0	3	340.240	3.236	20	30		EGEDHN
C=CCOc1ccccc1CNC[C@@H](O)COc1ccccc1Cl	ZINC000583317637	459519686	/nfs/dbraw/zinc/51/96/86/459519686.db2.gz	RIWQAVOZLGAGOW-MRXNPFEDSA-N	0	3	347.842	3.434	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CCSC[C@H](C)C1)C(C)C	ZINC000487371937	459529945	/nfs/dbraw/zinc/52/99/45/459529945.db2.gz	GCRQFLGVKYHJMB-IAGOWNOFSA-N	0	3	339.549	3.080	20	30		EGEDHN
C=C[C@H]1CCCCN1C(=O)CCCN1CCN(c2ccccc2)CC1	ZINC000488863106	459554055	/nfs/dbraw/zinc/55/40/55/459554055.db2.gz	SFXYDCFHCSISJQ-IBGZPJMESA-N	0	3	341.499	3.156	20	30		EGEDHN
CC[C@@H]1CCC[C@H](CN2CCN(c3nccnc3C#N)C[C@H]2C)C1	ZINC000542465663	459559594	/nfs/dbraw/zinc/55/95/94/459559594.db2.gz	IAIULSSPSAAEST-ZACQAIPSSA-N	0	3	327.476	3.075	20	30		EGEDHN
C=C[C@H]1CCCCN1C[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000489481129	459565174	/nfs/dbraw/zinc/56/51/74/459565174.db2.gz	OGTOUUCRILPWOA-LSDHHAIUSA-N	0	3	329.362	3.486	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCCCCc2ccccc2)CC1	ZINC000592293333	459572087	/nfs/dbraw/zinc/57/20/87/459572087.db2.gz	FWMJEBNFZLIIKT-UHFFFAOYSA-N	0	3	329.488	3.349	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)/C=C\c1ccsc1	ZINC000490920274	459590331	/nfs/dbraw/zinc/59/03/31/459590331.db2.gz	XJUQBMKQHQDLCI-FPLPWBNLSA-N	0	3	339.464	3.223	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@]2(c3ccc(Cl)cc3)C[C@@H]2C)CC1	ZINC000491047518	459596334	/nfs/dbraw/zinc/59/63/34/459596334.db2.gz	UXYGZRHQYZDBLT-LIRRHRJNSA-N	0	3	330.859	3.037	20	30		EGEDHN
C#CCNC(=O)CCN[C@H](C)c1ccccc1OCc1ccccc1	ZINC000491201394	459605054	/nfs/dbraw/zinc/60/50/54/459605054.db2.gz	HIEUFSJGHIPEOQ-QGZVFWFLSA-N	0	3	336.435	3.056	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCCC(C)(C)c2ccccc2)CC1	ZINC000592505717	459616752	/nfs/dbraw/zinc/61/67/52/459616752.db2.gz	BTCCIJWLXAIVCC-UHFFFAOYSA-N	0	3	329.488	3.304	20	30		EGEDHN
C#CCN1CCC(C(=O)NC2(C(C)(C)c3ccc(F)cc3)CC2)CC1	ZINC000491545295	459635934	/nfs/dbraw/zinc/63/59/34/459635934.db2.gz	PQEOTEZKZDGBFM-UHFFFAOYSA-N	0	3	342.458	3.097	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1oc2ccccc2c1COC(C)C	ZINC000491555576	459636986	/nfs/dbraw/zinc/63/69/86/459636986.db2.gz	RSPNNKHIFUEMKT-UHFFFAOYSA-N	0	3	342.439	3.043	20	30		EGEDHN
C#C[C@H](NC(=O)NCc1cccc(CN(C)C)c1)c1ccc(F)cc1	ZINC000491636647	459644418	/nfs/dbraw/zinc/64/44/18/459644418.db2.gz	TWGMIVHOWLGVEL-IBGZPJMESA-N	0	3	339.414	3.061	20	30		EGEDHN
C#CCNC(=O)C1CCN(Cc2ccc(-c3ccccc3)s2)CC1	ZINC000491692297	459654343	/nfs/dbraw/zinc/65/43/43/459654343.db2.gz	QUMOEPHFRODETQ-UHFFFAOYSA-N	0	3	338.476	3.377	20	30		EGEDHN
C#CCCN1CCC(NC(=O)/C=C/c2ccc([C@@H]3C[C@@H]3C)o2)CC1	ZINC000491924562	459685047	/nfs/dbraw/zinc/68/50/47/459685047.db2.gz	JSFKOJPEXFQNPK-WHFNLZNOSA-N	0	3	326.440	3.020	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2NC[C@@H](O)COCc1cccs1	ZINC000562998011	459690181	/nfs/dbraw/zinc/69/01/81/459690181.db2.gz	YPULXONXUPFAAI-VQIMIIECSA-N	0	3	342.464	3.164	20	30		EGEDHN
CCN1C[C@@H](C)N(Cc2cc(C#N)ccc2Br)C[C@H]1C	ZINC000492585122	459711581	/nfs/dbraw/zinc/71/15/81/459711581.db2.gz	WPXPNLZNLATEGM-CHWSQXEVSA-N	0	3	336.277	3.235	20	30		EGEDHN
C=CCC1(C(=O)N(C)CCCN(C)Cc2ccncc2)CCCC1	ZINC000563265142	459750893	/nfs/dbraw/zinc/75/08/93/459750893.db2.gz	UFUYIPUSKGCSRF-UHFFFAOYSA-N	0	3	329.488	3.498	20	30		EGEDHN
N#CC(C(=O)c1cnc2n1CCCC2)c1cc(C(F)(F)F)ccn1	ZINC000563937649	459769375	/nfs/dbraw/zinc/76/93/75/459769375.db2.gz	VXASLEQSIIUIKM-NSHDSACASA-N	0	3	334.301	3.123	20	30		EGEDHN
Cc1cccc(C)c1[C@H](C)NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000564494376	459774599	/nfs/dbraw/zinc/77/45/99/459774599.db2.gz	FBKNGXPDBPDQIU-HKUYNNGSSA-N	0	3	338.451	3.460	20	30		EGEDHN
N#Cc1ccc2c(c1)N(C(=O)C(C[C@@H]1CCCO1)C(F)(F)F)CC2	ZINC000593108342	459775530	/nfs/dbraw/zinc/77/55/30/459775530.db2.gz	WFHBVFYLBCHHOK-KBPBESRZSA-N	0	3	338.329	3.195	20	30		EGEDHN
C[C@@H]1CC[C@H](N(CC#Cc2ccc(OC(F)(F)F)cc2)CCO)C1	ZINC000565919525	459789572	/nfs/dbraw/zinc/78/95/72/459789572.db2.gz	DBICXAZVCBGXST-ZBFHGGJFSA-N	0	3	341.373	3.420	20	30		EGEDHN
N#Cc1cccc2c1CCN2C(=O)C(C[C@@H]1CCCO1)C(F)(F)F	ZINC000593175703	459797593	/nfs/dbraw/zinc/79/75/93/459797593.db2.gz	ZLQVBNLWMDITBT-JSGCOSHPSA-N	0	3	338.329	3.195	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(C)c(C(F)(F)F)c2)CC1	ZINC000528451259	459807435	/nfs/dbraw/zinc/80/74/35/459807435.db2.gz	WLBWXVLHRYIKFI-UHFFFAOYSA-N	0	3	326.362	3.394	20	30		EGEDHN
Cc1cc(C)cc(N(CCC#N)C(=O)CN[C@@H]2CCC[C@@H]3C[C@@H]32)c1	ZINC000584825046	459809385	/nfs/dbraw/zinc/80/93/85/459809385.db2.gz	LHLWPJBACSFODZ-NZSAHSFTSA-N	0	3	325.456	3.328	20	30		EGEDHN
CCC(C#N)(CC)C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1	ZINC000528799168	459814250	/nfs/dbraw/zinc/81/42/50/459814250.db2.gz	PJNDBBFQCHTQEY-IAGOWNOFSA-N	0	3	349.519	3.054	20	30		EGEDHN
N#CCc1ccc(NC(=O)NC[C@@H]2CCN2C2CCCCC2)cc1	ZINC000528884617	459816054	/nfs/dbraw/zinc/81/60/54/459816054.db2.gz	CYUORVXDBBVKMC-SFHVURJKSA-N	0	3	326.444	3.281	20	30		EGEDHN
Cc1c(C#N)cccc1NC(=O)NC[C@H]1CCN1C1CCCCC1	ZINC000529034207	459821469	/nfs/dbraw/zinc/82/14/69/459821469.db2.gz	ZVRVXTLBNITVTG-QGZVFWFLSA-N	0	3	326.444	3.395	20	30		EGEDHN
Cc1c(C#N)cccc1NC(=O)NC[C@@H]1CCN1C1CCCCC1	ZINC000529034205	459821490	/nfs/dbraw/zinc/82/14/90/459821490.db2.gz	ZVRVXTLBNITVTG-KRWDZBQOSA-N	0	3	326.444	3.395	20	30		EGEDHN
CC(C)C(CN1CCN(c2oc(C3CC3)nc2C#N)CC1)C(C)C	ZINC000585766000	459843811	/nfs/dbraw/zinc/84/38/11/459843811.db2.gz	XKFKMAXFFSEMAK-UHFFFAOYSA-N	0	3	330.476	3.474	20	30		EGEDHN
COCc1csc(CN(CCN(C)C)Cc2ccc(C#N)cc2)c1	ZINC000597128032	459846005	/nfs/dbraw/zinc/84/60/05/459846005.db2.gz	SINGRWIDELZWQD-UHFFFAOYSA-N	0	3	343.496	3.330	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@@H]2CC[C@@H]2c2ccccc2)cc1	ZINC000598303991	459856114	/nfs/dbraw/zinc/85/61/14/459856114.db2.gz	DJFXMNKUSOOGQP-VAMGGRTRSA-N	0	3	329.403	3.303	20	30		EGEDHN
C[C@H](CNC(=O)CC1(C#N)CCCCC1)N(C)Cc1ccccc1	ZINC000597206196	459876705	/nfs/dbraw/zinc/87/67/05/459876705.db2.gz	MKLAMDBKEVTKDL-QGZVFWFLSA-N	0	3	327.472	3.487	20	30		EGEDHN
CC(C)C[C@@H](C#N)NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000608822125	459886502	/nfs/dbraw/zinc/88/65/02/459886502.db2.gz	GOTIEZHRNDIJHH-WMZOPIPTSA-N	0	3	331.435	3.092	20	30		EGEDHN
CC1(C)C[C@@]1(CNCc1cnc2c(C#N)cnn2c1)c1ccccc1	ZINC000597250201	459895517	/nfs/dbraw/zinc/89/55/17/459895517.db2.gz	BJCWITIRPUMHOD-HXUWFJFHSA-N	0	3	331.423	3.058	20	30		EGEDHN
CC[C@@H](C#N)C(=O)N1CC[C@@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000593500724	459907687	/nfs/dbraw/zinc/90/76/87/459907687.db2.gz	SHQRTTBKHQOCTL-ICSRJNTNSA-N	0	3	325.456	3.051	20	30		EGEDHN
CCCN1CCC[C@H]1CNC(=O)c1c(Cl)cc(C#N)cc1Cl	ZINC000588063433	459907788	/nfs/dbraw/zinc/90/77/88/459907788.db2.gz	OLQAGRBOGXSXMM-LBPRGKRZSA-N	0	3	340.254	3.469	20	30		EGEDHN
C[C@H](c1ccccc1)[C@@H](O)CNC(=O)C(C#N)CCc1ccccc1	ZINC000598480645	459911610	/nfs/dbraw/zinc/91/16/10/459911610.db2.gz	WKIKKQPJHCSFJO-UXPWSPDFSA-N	0	3	336.435	3.040	20	30		EGEDHN
N#CCCCCCC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000588154677	459920245	/nfs/dbraw/zinc/92/02/45/459920245.db2.gz	BEIOXAKQMVKMKV-IBGZPJMESA-N	0	3	327.472	3.489	20	30		EGEDHN
COC[C@H](CC(C)(C)C)N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000593614865	459934023	/nfs/dbraw/zinc/93/40/23/459934023.db2.gz	XVLOJHQJCBJHTK-FUHWJXTLSA-N	0	3	343.471	3.094	20	30		EGEDHN
C[C@@H](CCC#N)CN1CCCN(C(=O)c2cccc(Cl)c2)CC1	ZINC000602450796	459944125	/nfs/dbraw/zinc/94/41/25/459944125.db2.gz	YNIQQEBAKWABPX-HNNXBMFYSA-N	0	3	333.863	3.428	20	30		EGEDHN
CCCOc1ccc(CNC2CCN(CC#N)CC2)c(OCCC)c1	ZINC000609334918	459946392	/nfs/dbraw/zinc/94/63/92/459946392.db2.gz	KYDXMDWUAKXUPB-UHFFFAOYSA-N	0	3	345.487	3.342	20	30		EGEDHN
COc1cccc(C=C2CCN(C[C@H](O)CC(C)(C)C#N)CC2)c1	ZINC000598593313	459955870	/nfs/dbraw/zinc/95/58/70/459955870.db2.gz	QYFOIGNZMLFTFP-GOSISDBHSA-N	0	3	328.456	3.475	20	30		EGEDHN
CCCN(C[C@@H](O)CC(C)(C)C#N)[C@H](C)C(=O)Nc1ccccc1	ZINC000598594914	459957332	/nfs/dbraw/zinc/95/73/32/459957332.db2.gz	NVWGLVXFXKBCQY-WBVHZDCISA-N	0	3	331.460	3.026	20	30		EGEDHN
C[C@H](NC1CCN(Cc2cccc(C#N)c2)CC1)c1cscn1	ZINC000593720499	459963151	/nfs/dbraw/zinc/96/31/51/459963151.db2.gz	GFWSJUBVVIJURK-AWEZNQCLSA-N	0	3	326.469	3.330	20	30		EGEDHN
CC[C@H](C)N[C@@H](CNC(=O)N1CCC[C@@](C)(C#N)C1)c1ccco1	ZINC000588724794	459975762	/nfs/dbraw/zinc/97/57/62/459975762.db2.gz	YTJTVUXQEOWTNU-MPGHIAIKSA-N	0	3	332.448	3.044	20	30		EGEDHN
COc1cc2c(cc1CN[C@@H](C)CC1(C#N)CCOCC1)O[C@H](C)C2	ZINC000602512288	459976443	/nfs/dbraw/zinc/97/64/43/459976443.db2.gz	SHPQFHOXUGCJOU-LSDHHAIUSA-N	0	3	344.455	3.207	20	30		EGEDHN
N#Cc1cccc(CNC2CCN(Cc3ccc(Cl)cc3)CC2)n1	ZINC000602514661	459977486	/nfs/dbraw/zinc/97/74/86/459977486.db2.gz	UFWVXUOUHAIQRP-UHFFFAOYSA-N	0	3	340.858	3.361	20	30		EGEDHN
C[C@@H](Cc1ccc(Br)cc1)NCc1cccc(C#N)n1	ZINC000602515085	459977835	/nfs/dbraw/zinc/97/78/35/459977835.db2.gz	UAPLKVCBKONZGV-LBPRGKRZSA-N	0	3	330.229	3.437	20	30		EGEDHN
CN1CCC(N(C(=O)COc2ccc(C#N)cc2)c2ccccc2)CC1	ZINC000609566830	459983512	/nfs/dbraw/zinc/98/35/12/459983512.db2.gz	QKAPKBZWYJAULR-UHFFFAOYSA-N	0	3	349.434	3.064	20	30		EGEDHN
C[C@H](CCC#N)CN[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1=O	ZINC000602545573	459992451	/nfs/dbraw/zinc/99/24/51/459992451.db2.gz	FYVGPKQLFXRQRN-DOMZBBRYSA-N	0	3	339.361	3.340	20	30		EGEDHN
Cc1cccc2oc(CCN[C@H](C)CC3(C#N)CCOCC3)nc21	ZINC000602559469	459997388	/nfs/dbraw/zinc/99/73/88/459997388.db2.gz	UBMBNVBVKRMWOS-OAHLLOKOSA-N	0	3	327.428	3.367	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CNCc1ccnc(OC2CCCCC2)c1	ZINC000598718906	460004511	/nfs/dbraw/zinc/00/45/11/460004511.db2.gz	DWEXFRBLPHJUHP-MRXNPFEDSA-N	0	3	331.460	3.183	20	30		EGEDHN
CC[C@H](NCc1cccc(C#N)n1)[C@@H](c1ccc(C)cc1)n1cncn1	ZINC000602576137	460004690	/nfs/dbraw/zinc/00/46/90/460004690.db2.gz	MQAMBAHFEDHGBH-VQTJNVASSA-N	0	3	346.438	3.011	20	30		EGEDHN
CC1(C)CN(CCC(=O)Nc2ccc(C#N)c(Cl)c2)C(C)(C)CO1	ZINC000609671937	460006039	/nfs/dbraw/zinc/00/60/39/460006039.db2.gz	QEVIXDXSLWXFQP-UHFFFAOYSA-N	0	3	349.862	3.430	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CNCc1ccnc(Oc2ccccc2F)c1	ZINC000598724352	460008003	/nfs/dbraw/zinc/00/80/03/460008003.db2.gz	OBSVCANYNCPTMH-OAHLLOKOSA-N	0	3	343.402	3.403	20	30		EGEDHN
CC(C)(C)CCOc1cnccc1CNC[C@@H](O)CC(C)(C)C#N	ZINC000598727214	460009208	/nfs/dbraw/zinc/00/92/08/460009208.db2.gz	DXTPKROPAQGFGW-INIZCTEOSA-N	0	3	333.476	3.287	20	30		EGEDHN
N#Cc1ccc(CN[C@H](Cc2ccccc2)[C@H](O)C(F)(F)F)cc1	ZINC000609707685	460009651	/nfs/dbraw/zinc/00/96/51/460009651.db2.gz	RXMXNHWOWWDVBC-SJORKVTESA-N	0	3	334.341	3.182	20	30		EGEDHN
N#Cc1cncc(N(CCN2CCCC2)Cc2ccc(Cl)cc2)n1	ZINC000575858352	460018971	/nfs/dbraw/zinc/01/89/71/460018971.db2.gz	KLIBSTQVVURMGW-UHFFFAOYSA-N	0	3	341.846	3.104	20	30		EGEDHN
N#Cc1cccc(CN[C@H]2CCN(c3ccc(F)c(Cl)c3)C2)n1	ZINC000602603172	460019282	/nfs/dbraw/zinc/01/92/82/460019282.db2.gz	MKUBWAFVOPDOIY-AWEZNQCLSA-N	0	3	330.794	3.114	20	30		EGEDHN
C[C@@H](CC1(C#N)CCOCC1)NCc1cn(C)nc1-c1ccccc1	ZINC000602602515	460019401	/nfs/dbraw/zinc/01/94/01/460019401.db2.gz	UNUYANQWLCNEDL-INIZCTEOSA-N	0	3	338.455	3.276	20	30		EGEDHN
CCCOc1ccc(O[C@@H]2CCCC[C@@H]2NC(=O)C(C)C#N)cc1	ZINC000609921551	460039759	/nfs/dbraw/zinc/03/97/59/460039759.db2.gz	LSZQQHLFHITAHX-FHLIZLRMSA-N	0	3	330.428	3.441	20	30		EGEDHN
C[C@@H](CC1(C#N)CCOCC1)NCc1c(F)cccc1-n1cccn1	ZINC000602682910	460063675	/nfs/dbraw/zinc/06/36/75/460063675.db2.gz	UHEAMDPOYDXWNM-HNNXBMFYSA-N	0	3	342.418	3.200	20	30		EGEDHN
Cn1ccnc1[C@@H]1N(C(=O)C(C#N)CCc2ccccc2)CC1(C)C	ZINC000576198112	460087569	/nfs/dbraw/zinc/08/75/69/460087569.db2.gz	UCMDURZDKLARBF-SJORKVTESA-N	0	3	336.439	3.102	20	30		EGEDHN
N#CCCCNCc1c[nH]nc1-c1ccc(Br)s1	ZINC000598972013	460109941	/nfs/dbraw/zinc/10/99/41/460109941.db2.gz	LOTZCNLJKAKXRY-UHFFFAOYSA-N	0	3	325.235	3.294	20	30		EGEDHN
N#Cc1cccc(OCCN[C@@H](Cn2cccn2)c2ccccc2)c1	ZINC000610432965	460150391	/nfs/dbraw/zinc/15/03/91/460150391.db2.gz	KZQANGWPQYXFLR-FQEVSTJZSA-N	0	3	332.407	3.165	20	30		EGEDHN
COC(=O)[C@@H]1CN(CC2(CC#N)CC2)C[C@H]1c1ccc(Cl)cc1	ZINC000602874140	460168163	/nfs/dbraw/zinc/16/81/63/460168163.db2.gz	OALVZIXDFWPZFH-JKSUJKDBSA-N	0	3	332.831	3.222	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)C(=O)N[C@H]1CCCN2CCCC[C@@H]12	ZINC000594282883	460179677	/nfs/dbraw/zinc/17/96/77/460179677.db2.gz	AXENVRSOSUEPCM-MNEFBYGVSA-N	0	3	340.471	3.278	20	30		EGEDHN
CCN(C[C@@H](O)COc1ccccc1C#N)[C@@H](C)c1ccc(C#N)cc1	ZINC000599270436	460212245	/nfs/dbraw/zinc/21/22/45/460212245.db2.gz	JPBLBXLWFGLXHE-OXJNMPFZSA-N	0	3	349.434	3.253	20	30		EGEDHN
CC1(F)CCN(CCC(=O)Nc2sc3c(c2C#N)CCC3)CC1	ZINC000602992628	460213940	/nfs/dbraw/zinc/21/39/40/460213940.db2.gz	AVXBCJVZLYKOGV-UHFFFAOYSA-N	0	3	335.448	3.261	20	30		EGEDHN
N#CCCCC[C@H](N)C(=O)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000594424936	460214788	/nfs/dbraw/zinc/21/47/88/460214788.db2.gz	DZADVSAZZGSYPC-HNNXBMFYSA-N	0	3	346.431	3.223	20	30		EGEDHN
CSc1ccccc1[C@@H](C)NC[C@H](O)COc1ccccc1C#N	ZINC000599399434	460247104	/nfs/dbraw/zinc/24/71/04/460247104.db2.gz	SBOHIHDHOFVNQU-ZBFHGGJFSA-N	0	3	342.464	3.371	20	30		EGEDHN
Cc1nc([C@H](C)NC2CCN(c3ccc(C#N)cn3)CC2)c(C)s1	ZINC000610946384	460264373	/nfs/dbraw/zinc/26/43/73/460264373.db2.gz	NFEULZLKQRMROA-LBPRGKRZSA-N	0	3	341.484	3.346	20	30		EGEDHN
Cc1ccc2c(c1)[C@@H](NC(=O)C(C#N)Cc1ccc(C#N)cc1)CC2	ZINC000619285415	460320979	/nfs/dbraw/zinc/32/09/79/460320979.db2.gz	SZVCLMSXTTYJBZ-ICSRJNTNSA-N	0	3	329.403	3.353	20	30		EGEDHN
CC(C)OC1CCC(NC(=O)C(C#N)Cc2ccc(C#N)cc2)CC1	ZINC000619304531	460324205	/nfs/dbraw/zinc/32/42/05/460324205.db2.gz	OSFYKCCETZWGDA-VIQWUECVSA-N	0	3	339.439	3.093	20	30		EGEDHN
CN(C)Cc1cccc(NCC(=O)N(CCC#N)c2ccccc2)c1	ZINC000603658801	460332067	/nfs/dbraw/zinc/33/20/67/460332067.db2.gz	BDMFIQJHBIAJGQ-UHFFFAOYSA-N	0	3	336.439	3.107	20	30		EGEDHN
Cc1cccc(C(=O)NCCN[C@@H]2CCCc3cc(C#N)ccc32)c1	ZINC000611391008	460352202	/nfs/dbraw/zinc/35/22/02/460352202.db2.gz	MFVJACWPDACOCD-HXUWFJFHSA-N	0	3	333.435	3.264	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2N[C@H]1CCN(c2ccccc2F)C1=O	ZINC000611394137	460354164	/nfs/dbraw/zinc/35/41/64/460354164.db2.gz	LKYBNLPULNIGFC-OALUTQOASA-N	0	3	349.409	3.470	20	30		EGEDHN
N#Cc1cccc(CNC(=O)CN2CCC[C@H]2C2CCCCC2)c1	ZINC000603896139	460357089	/nfs/dbraw/zinc/35/70/89/460357089.db2.gz	HUSBKDDFUPBXAR-IBGZPJMESA-N	0	3	325.456	3.219	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@H](C)N(CC)Cc1ccc(CN(C)C)cc1	ZINC000626062550	460358272	/nfs/dbraw/zinc/35/82/72/460358272.db2.gz	WQGLKCHWGBXFBX-SFHVURJKSA-N	0	3	345.531	3.383	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@H](NCc3cc4ccccc4[nH]3)C2=O)cc1	ZINC000611509119	460381573	/nfs/dbraw/zinc/38/15/73/460381573.db2.gz	YJPOKALOJCJFCP-FQEVSTJZSA-N	0	3	344.418	3.325	20	30		EGEDHN
COc1ccc(C#N)cc1NCc1ccc(OCCN(C)C)cc1	ZINC000611530357	460390666	/nfs/dbraw/zinc/39/06/66/460390666.db2.gz	CNKOFYUFSWLXLF-UHFFFAOYSA-N	0	3	325.412	3.119	20	30		EGEDHN
C=CCOc1ccc(CNCC2(C(=O)OC)CCCC2)cc1OC	ZINC000619654271	460405611	/nfs/dbraw/zinc/40/56/11/460405611.db2.gz	BKCNZDFCHUYISK-UHFFFAOYSA-N	0	3	333.428	3.083	20	30		EGEDHN
Cc1ccc(C(C)(C)CNC(=O)C(C#N)Cc2ccc(C#N)cc2)nc1	ZINC000600309137	460469828	/nfs/dbraw/zinc/46/98/28/460469828.db2.gz	WNYMMMKMDNQTBQ-SFHVURJKSA-N	0	3	346.434	3.038	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)N1CCC[C@](C)(C#N)C1)c1ccccc1	ZINC000612094737	460536855	/nfs/dbraw/zinc/53/68/55/460536855.db2.gz	WGCMCPYNBOJJFK-UYAOXDASSA-N	0	3	342.487	3.405	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](CN(C)Cc3scnc3C)C2)C1	ZINC000632634914	460789944	/nfs/dbraw/zinc/78/99/44/460789944.db2.gz	YWEFYTXFUJCIMB-HNNXBMFYSA-N	0	3	333.501	3.088	20	30		EGEDHN
Cc1cccc(CN2CC[C@@H](NC(=O)CCc3ccc(C#N)cc3)C2)c1	ZINC000601852430	460925698	/nfs/dbraw/zinc/92/56/98/460925698.db2.gz	ZJHYZYNUTJLCPE-OAQYLSRUSA-N	0	3	347.462	3.190	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccc(C#Cc2ccccc2)cc1)N1CCCC1	ZINC000613625191	461018050	/nfs/dbraw/zinc/01/80/50/461018050.db2.gz	UPTCREGWLIGOTF-SFHVURJKSA-N	0	3	332.447	3.301	20	30		EGEDHN
CC(=O)c1cc(C#N)ccc1NC(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000637326619	461482863	/nfs/dbraw/zinc/48/28/63/461482863.db2.gz	DIVNIWITLSSVMN-SFHVURJKSA-N	0	3	347.418	3.221	20	30		EGEDHN
C=CCC[C@@H]1NC(=O)N([C@@H](CN2CCCCC2)c2ccccc2)C1=O	ZINC000642927422	461581179	/nfs/dbraw/zinc/58/11/79/461581179.db2.gz	KUPGXVGITMRNQX-ROUUACIJSA-N	0	3	341.455	3.100	20	30		EGEDHN
CC#CCN(C)C(=O)c1ccccc1OCCN1CCCC[C@H]1C	ZINC000647541884	461754446	/nfs/dbraw/zinc/75/44/46/461754446.db2.gz	DBYWMZZKYATNJA-QGZVFWFLSA-N	0	3	328.456	3.035	20	30		EGEDHN
C=CCOc1cccc(NC(=O)N[C@H]2CCCN3CCCC[C@H]23)c1	ZINC000653953296	461958701	/nfs/dbraw/zinc/95/87/01/461958701.db2.gz	XITBUIXIYWNBRM-ZWKOTPCHSA-N	0	3	329.444	3.390	20	30		EGEDHN
C=C(CNC[C@H](O)COc1ccc(OCC)cc1)c1ccccc1	ZINC000644647375	462021033	/nfs/dbraw/zinc/02/10/33/462021033.db2.gz	SJNHZWQVCZPWCC-SFHVURJKSA-N	0	3	327.424	3.128	20	30		EGEDHN
C=CCCn1cc(CNC[C@@H]2CCCN(C)[C@@H]2c2cccs2)nn1	ZINC000657374872	462080674	/nfs/dbraw/zinc/08/06/74/462080674.db2.gz	TZQSZNONMNTDAM-YJBOKZPZSA-N	0	3	345.516	3.088	20	30		EGEDHN
C=CCCn1cc(CNCCc2cn(C)c3cc(Cl)ccc23)nn1	ZINC000657443320	462127581	/nfs/dbraw/zinc/12/75/81/462127581.db2.gz	JTGFZEJFOOXAKO-UHFFFAOYSA-N	0	3	343.862	3.332	20	30		EGEDHN
C=CCN(C[C@@H](O)Cc1ccc(C(F)(F)F)cc1)[C@@H](C)COC	ZINC000661242387	462166221	/nfs/dbraw/zinc/16/62/21/462166221.db2.gz	NVYUDYSXSYKZIO-BBRMVZONSA-N	0	3	331.378	3.132	20	30		EGEDHN
C=CC[C@@H]1CCCC[C@H]1NCc1ccccc1S(=O)(=O)N(C)C	ZINC000657830397	462288210	/nfs/dbraw/zinc/28/82/10/462288210.db2.gz	IESFQHPRFQYHIW-NVXWUHKLSA-N	0	3	336.501	3.161	20	30		EGEDHN
C=CCN1CCC(N[C@H](c2ccc(OC)cc2)c2ccccn2)CC1	ZINC000652151140	462452880	/nfs/dbraw/zinc/45/28/80/462452880.db2.gz	KEZNYEWIZUTGOI-OAQYLSRUSA-N	0	3	337.467	3.420	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(CCC)Cc2ccc(C#N)cc2)CC1	ZINC000171740285	526425106	/nfs/dbraw/zinc/42/51/06/526425106.db2.gz	WHSTXPSYMVQNMZ-UHFFFAOYSA-N	0	3	340.471	3.130	20	30		EGEDHN
N#CCc1ccc(OC[C@@H](O)CN2CCC[C@@H]2c2ccccc2)cc1	ZINC000025305932	526486221	/nfs/dbraw/zinc/48/62/21/526486221.db2.gz	SIMVSEIQFYZBSC-PZJWPPBQSA-N	0	3	336.435	3.329	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](C)Cc2ccccc2C)CC1	ZINC000171556348	526592618	/nfs/dbraw/zinc/59/26/18/526592618.db2.gz	OSKPEHXTTPKPJL-KRWDZBQOSA-N	0	3	329.488	3.266	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2c(F)cc(F)cc2F)CC1	ZINC000174281163	526595175	/nfs/dbraw/zinc/59/51/75/526595175.db2.gz	XKKAQAJLHVFJBZ-UHFFFAOYSA-N	0	3	327.350	3.266	20	30		EGEDHN
C=CCOc1cccc(CN2CCC3(CC2)[C@@H](O)C[C@@H]3OCC)c1	ZINC000130230710	526897268	/nfs/dbraw/zinc/89/72/68/526897268.db2.gz	PRGUUGIADZOIII-OALUTQOASA-N	0	3	331.456	3.003	20	30		EGEDHN
C=CCC[C@H](NC(=O)NCCN1CCC(OC)CC1)c1ccccc1	ZINC000131036827	546802307	/nfs/dbraw/zinc/80/23/07/546802307.db2.gz	IERWHTNOKUCYIS-IBGZPJMESA-N	0	3	345.487	3.104	20	30		EGEDHN
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N[C@H]1CCCc2occc21	ZINC000328660960	547482982	/nfs/dbraw/zinc/48/29/82/547482982.db2.gz	WHNGVGZYWLYRHY-AEFFLSMTSA-N	0	3	339.439	3.435	20	30		EGEDHN
C[C@@H]1CC[C@H](C)N1CC(=O)Nc1cccc([C@@]2(C)NC(=O)NC2=O)c1	ZINC000329572624	547501708	/nfs/dbraw/zinc/50/17/08/547501708.db2.gz	NCITWYPTWRWCLS-FTLABTOESA-N	0	3	344.415	3.247	20	30		EGEDHN
CN1CCC(CC(=O)Nc2ccc3c(c2)N(C(N)=O)CCC3)CC1	ZINC000330187771	547516099	/nfs/dbraw/zinc/51/60/99/547516099.db2.gz	UBAFCFPJZQKREG-UHFFFAOYSA-N	0	3	330.432	3.252	20	30		EGEDHN
C=CCN(Cc1ccccc1F)C(=O)N[C@H](CC)CN1CCCC1	ZINC000675200920	548871787	/nfs/dbraw/zinc/87/17/87/548871787.db2.gz	XCUNRQUNPCBEBO-QGZVFWFLSA-N	0	3	333.451	3.398	20	30		EGEDHN
N#CC(C(=O)c1ccc(N2CCCC2)nn1)c1ccc2ccccc2n1	ZINC000677222686	549232141	/nfs/dbraw/zinc/23/21/41/549232141.db2.gz	YIQMCDVYICYFBN-OAHLLOKOSA-N	0	3	343.390	3.115	20	30		EGEDHN
CN1CCCN(C(=O)Nc2cccc(C#Cc3cccs3)c2)CC1	ZINC000679421997	549709026	/nfs/dbraw/zinc/70/90/26/549709026.db2.gz	UJGDDUNWQQMKSA-UHFFFAOYSA-N	0	3	339.464	3.317	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H](CN2CCCCC2)c2ccccc2)nc1	ZINC000728867564	574782496	/nfs/dbraw/zinc/78/24/96/574782496.db2.gz	NWWINNACEPLOIY-HXUWFJFHSA-N	0	3	333.435	3.020	20	30		EGEDHN
CCC(=O)N[C@@H](C)C(=O)C(C#N)c1nc2cc(Cl)ccc2s1	ZINC000729069500	574810595	/nfs/dbraw/zinc/81/05/95/574810595.db2.gz	FXMYRUALHRRHJK-WCBMZHEXSA-N	0	3	335.816	3.041	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccccc2OCC(C)C)CC1	ZINC000731344862	575067264	/nfs/dbraw/zinc/06/72/64/575067264.db2.gz	NCMCFTYGNBUAAL-UHFFFAOYSA-N	0	3	330.472	3.492	20	30		EGEDHN
N#CC(C(=O)C[C@@H]1CCc2ccccc2C1)C(=O)NCc1ccccc1	ZINC000732593230	575278646	/nfs/dbraw/zinc/27/86/46/575278646.db2.gz	HSULQKGKLXZQDI-YLJYHZDGSA-N	0	3	346.430	3.207	20	30		EGEDHN
CCN(CC(=O)C(C#N)c1nc2ccccc2s1)CC(F)(F)F	ZINC000732808189	575289353	/nfs/dbraw/zinc/28/93/53/575289353.db2.gz	IQQHEELPXUNXEC-JTQLQIEISA-N	0	3	341.358	3.357	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)Cc3ccc4c(c3)CCO4)nc21	ZINC000735792590	575715268	/nfs/dbraw/zinc/71/52/68/575715268.db2.gz	MUNHSGDYAKNVBD-OAHLLOKOSA-N	0	3	331.375	3.225	20	30		EGEDHN
CC[C@H](C#N)Oc1cccc(CNC(=O)[C@H](CC)N(CC)CC)c1	ZINC000736018425	575752112	/nfs/dbraw/zinc/75/21/12/575752112.db2.gz	BXADCNRQMFPYTG-AEFFLSMTSA-N	0	3	331.460	3.104	20	30		EGEDHN
CCCN(C)CC(=O)NCc1cccc(-c2ccc(C#N)s2)c1	ZINC000740128679	576552425	/nfs/dbraw/zinc/55/24/25/576552425.db2.gz	SFMWDXZCAQZNCN-UHFFFAOYSA-N	0	3	327.453	3.245	20	30		EGEDHN
C#CCCN1CCC(NC(=O)[C@H](C)Oc2ccc(Cl)cc2C)CC1	ZINC000740736249	576621761	/nfs/dbraw/zinc/62/17/61/576621761.db2.gz	LBZMTMSAWWJFEM-HNNXBMFYSA-N	0	3	348.874	3.020	20	30		EGEDHN
C=C(Br)COC(=O)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000741323488	576676265	/nfs/dbraw/zinc/67/62/65/576676265.db2.gz	ZPFAWPWANJNZAV-HNNXBMFYSA-N	0	3	338.245	3.350	20	30		EGEDHN
C[C@H]1CC(=NNC(=S)Nc2ccccc2C(F)(F)F)CCN1C	ZINC000741458174	576687653	/nfs/dbraw/zinc/68/76/53/576687653.db2.gz	QMQZUYOHTPLHTL-JTQLQIEISA-N	0	3	344.406	3.462	20	30		EGEDHN
C=CCSc1nc2ccccc2n1CN1CC[C@H](N2CC=CC2)C1	ZINC000742163010	576753865	/nfs/dbraw/zinc/75/38/65/576753865.db2.gz	MSVFCXNUSXPERH-INIZCTEOSA-N	0	3	340.496	3.218	20	30		EGEDHN
C#CCOc1ccc(CN[C@H]2CCCN(c3ccc(C)cc3)C2=O)cc1	ZINC000742380071	576776548	/nfs/dbraw/zinc/77/65/48/576776548.db2.gz	KOKNHGBWIHBZKS-NRFANRHFSA-N	0	3	348.446	3.292	20	30		EGEDHN
N#CC(C(=O)C[C@@H](Cc1ccccc1)c1ccccc1)C(=O)NC1CC1	ZINC000744031473	576819286	/nfs/dbraw/zinc/81/92/86/576819286.db2.gz	XXNFJVGWEVOOTC-QUCCMNQESA-N	0	3	346.430	3.390	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)C=C(C)C(C)(C)C)cc1OC	ZINC000744031885	576819293	/nfs/dbraw/zinc/81/92/93/576819293.db2.gz	CWNBAMOBAVNOFR-TZIYXEQSSA-N	0	3	344.411	3.344	20	30		EGEDHN
C[C@@H]1CN(CC(=O)C(C#N)c2nc3ccccc3s2)C[C@@H](C)S1	ZINC000744413027	576827702	/nfs/dbraw/zinc/82/77/02/576827702.db2.gz	MCMBGQCUAWFDKS-JHJVBQTASA-N	0	3	345.493	3.298	20	30		EGEDHN
CCN(C(=O)C#Cc1cccs1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000829297964	1292559045	/nfs/dbraw/zinc/55/90/45/1292559045.db2.gz	LGTFKCYSLVHZSR-GOSISDBHSA-N	0	3	338.476	3.223	20	30		EGEDHN
C[C@@H](NCC#Cc1ccc(F)cc1)c1ccc(N2CCNC2=O)cc1	ZINC000829745458	1292611874	/nfs/dbraw/zinc/61/18/74/1292611874.db2.gz	LZDIVMCEGFFJDS-OAHLLOKOSA-N	0	3	337.398	3.058	20	30		EGEDHN
C#CCOc1ccc([C@H](C)NCc2ccc([S@](C)=O)cc2)cc1	ZINC000090221437	1292791592	/nfs/dbraw/zinc/79/15/92/1292791592.db2.gz	TXTJIRVTXNKUBO-NPMXOYFQSA-N	0	3	327.449	3.287	20	30		EGEDHN
CCOc1cccc(CN(CCOC)Cc2ccc(C#N)cc2)c1O	ZINC000092567775	1292877623	/nfs/dbraw/zinc/87/76/23/1292877623.db2.gz	RNYUHPWZTMWNSD-UHFFFAOYSA-N	0	3	340.423	3.311	20	30		EGEDHN
CS[C@H](C)C(=O)C(C#N)C(=O)Nc1ccc(SC(F)F)cc1	ZINC000103329903	1293001783	/nfs/dbraw/zinc/00/17/83/1293001783.db2.gz	XBTJZMNPMUOPII-KCJUWKMLSA-N	0	3	344.408	3.400	20	30		EGEDHN
CC(=O)N(C)CC(=O)C(C#N)c1nc(-c2ccc(Cl)cc2)cs1	ZINC000103799301	1293014299	/nfs/dbraw/zinc/01/42/99/1293014299.db2.gz	NYMZVWQUSNLNOE-ZDUSSCGKSA-N	0	3	347.827	3.118	20	30		EGEDHN
C=C(Cl)COc1ccc([C@H](C)N[C@@H]2COC[C@H]2OCC)cc1	ZINC000834902443	1293170264	/nfs/dbraw/zinc/17/02/64/1293170264.db2.gz	AWTYDBDWLJKRFU-IAOVAPTHSA-N	0	3	325.836	3.272	20	30		EGEDHN
CC(N=Nc1ccncn1)c1ccc([O-])c(C[NH+]2CCCCC2)c1	ZINC000835000863	1293184839	/nfs/dbraw/zinc/18/48/39/1293184839.db2.gz	BJMKFAQKGAFJIA-UHFFFAOYSA-N	0	3	325.416	3.004	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)[C@H](CCC)OC)cc1	ZINC000835062274	1293196935	/nfs/dbraw/zinc/19/69/35/1293196935.db2.gz	NKAKQSBIZVYAOK-IRXDYDNUSA-N	0	3	330.428	3.492	20	30		EGEDHN
CN(C)Cc1cccc(C(=O)O[C@H](C#N)Cc2ccc(F)cc2F)c1	ZINC000835295440	1293255554	/nfs/dbraw/zinc/25/55/54/1293255554.db2.gz	OWVSCWCZRVAKBA-KRWDZBQOSA-N	0	3	344.361	3.318	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CNC(C)(C)C(=O)NCC(C)(C)C)cc1	ZINC000121196139	1293360604	/nfs/dbraw/zinc/36/06/04/1293360604.db2.gz	JQUBYVDOCAVVOH-AWEZNQCLSA-N	0	3	331.460	3.008	20	30		EGEDHN
N#CC(C(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)[C@H]1CCCCO1	ZINC000121996808	1293399511	/nfs/dbraw/zinc/39/95/11/1293399511.db2.gz	GKGGTORSKHAUGC-CHWSQXEVSA-N	0	3	341.194	3.210	20	30		EGEDHN
Cc1ccc2c(CC(=O)C(C#N)C(=O)Nc3ccccn3)coc2c1	ZINC000126367459	1293532729	/nfs/dbraw/zinc/53/27/29/1293532729.db2.gz	JSDBZMZUCMPSMZ-HNNXBMFYSA-N	0	3	333.347	3.026	20	30		EGEDHN
N#CC1(c2ccccc2)CC(NC[C@@H](O)c2c(F)cccc2F)C1	ZINC000127964533	1293578487	/nfs/dbraw/zinc/57/84/87/1293578487.db2.gz	WKNFJSLQUPQIJO-LTCLLZNKSA-N	0	3	328.362	3.212	20	30		EGEDHN
N#CC(C(=O)CSc1ccc(F)c(F)c1)C(=O)Nc1ccccc1	ZINC000128130121	1293583317	/nfs/dbraw/zinc/58/33/17/1293583317.db2.gz	GMQCQVAHEXTKKF-ZDUSSCGKSA-N	0	3	346.358	3.404	20	30		EGEDHN
N#CC(C(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)C1CCOCC1	ZINC000130460967	1293657168	/nfs/dbraw/zinc/65/71/68/1293657168.db2.gz	AMVFZEUEEKEGMI-CYBMUJFWSA-N	0	3	341.194	3.067	20	30		EGEDHN
C=CCOc1cccc(CN2CCC(N(C)C(=O)OCC)CC2)c1	ZINC000130841225	1293670674	/nfs/dbraw/zinc/67/06/74/1293670674.db2.gz	KIKRTNQISYERIS-UHFFFAOYSA-N	0	3	332.444	3.304	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)CCCc2ccccc2)cc1	ZINC000131784789	1293700742	/nfs/dbraw/zinc/70/07/42/1293700742.db2.gz	IRPXFZRDCSVGLV-GOSISDBHSA-N	0	3	336.391	3.365	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@@H]1C[C@@]12CCCc1ccccc12	ZINC000173943295	1294474682	/nfs/dbraw/zinc/47/46/82/1294474682.db2.gz	ZHNUZNRKIBPNLV-PLMTUMEDSA-N	0	3	338.451	3.296	20	30		EGEDHN
C=CCOc1ccc(CN2CCC[C@@H](C3OCCO3)C2)cc1Cl	ZINC000179366245	1294787407	/nfs/dbraw/zinc/78/74/07/1294787407.db2.gz	XVIXOQLWZOXWRG-OAHLLOKOSA-N	0	3	337.847	3.490	20	30		EGEDHN
C[C@H](C#N)Oc1ccccc1NC(=O)N(CCN(C)C)C1CCCC1	ZINC000180015195	1294851384	/nfs/dbraw/zinc/85/13/84/1294851384.db2.gz	MDXCKNYTGPMRQL-OAHLLOKOSA-N	0	3	344.459	3.316	20	30		EGEDHN
CC(C)N1CCN(c2ccc(C(=O)O[C@H]3CC[C@@H](C#N)C3)cc2)CC1	ZINC000183714144	1295139554	/nfs/dbraw/zinc/13/95/54/1295139554.db2.gz	PNHHCKOKJIAFTD-APWZRJJASA-N	0	3	341.455	3.066	20	30		EGEDHN
CC[C@H](NC(C)=O)C(=O)C(C#N)c1nc2cc(Cl)ccc2s1	ZINC000870161092	1295711201	/nfs/dbraw/zinc/71/12/01/1295711201.db2.gz	WXDKMGOZBWZRBP-MNOVXSKESA-N	0	3	335.816	3.041	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)COc1c(C)cc(C)cc1C	ZINC000193370334	1295857921	/nfs/dbraw/zinc/85/79/21/1295857921.db2.gz	MKWOWAWFQPHQDP-INIZCTEOSA-N	0	3	330.428	3.006	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)C[C@@H]2CCCO2)cc1	ZINC000193451760	1295871412	/nfs/dbraw/zinc/87/14/12/1295871412.db2.gz	AYBGQSLYQGATBO-IRXDYDNUSA-N	0	3	328.412	3.246	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)Cc1ccsc1	ZINC000193457485	1295873406	/nfs/dbraw/zinc/87/34/06/1295873406.db2.gz	AJGWNKAFFPXOJV-CYBMUJFWSA-N	0	3	328.393	3.037	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CNCc2ccc3c(c2)OCCCO3)cc1	ZINC000237496028	1296245619	/nfs/dbraw/zinc/24/56/19/1296245619.db2.gz	MIBMLUMGEBGHFU-HNNXBMFYSA-N	0	3	338.407	3.429	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CNCc2ccc(N(C)C)c(F)c2)cc1	ZINC000237702006	1296258755	/nfs/dbraw/zinc/25/87/55/1296258755.db2.gz	YGRLRWUGYCMFKS-AWEZNQCLSA-N	0	3	327.403	3.472	20	30		EGEDHN
N#CC(C(=O)NC1CCCCC1)C(=O)[C@H]1C[C@H]1c1cccc(F)c1F	ZINC000246540091	1296359790	/nfs/dbraw/zinc/35/97/90/1296359790.db2.gz	JSODCMFJYWDXSJ-KKUMJFAQSA-N	0	3	346.377	3.226	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2cc(CC#N)ccn2)C1	ZINC000871721046	1296500298	/nfs/dbraw/zinc/50/02/98/1296500298.db2.gz	IXKOUBOMPZSSSP-QAPCUYQASA-N	0	3	349.438	3.105	20	30		EGEDHN
CC[C@H](NCc1ccc(OCC#N)cc1)C(=O)Nc1ccc(C)cc1	ZINC000871872061	1296582628	/nfs/dbraw/zinc/58/26/28/1296582628.db2.gz	GJVURQRASNXGPK-IBGZPJMESA-N	0	3	337.423	3.404	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](C#N)CCC#N)C(C)(C)C1	ZINC000872223229	1296825867	/nfs/dbraw/zinc/82/58/67/1296825867.db2.gz	ONOISKSUGNKFOF-LSDHHAIUSA-N	0	3	334.464	3.055	20	30		EGEDHN
C#CCOc1ccc(Br)cc1CNC[C@H](OC)C(C)C	ZINC000381696441	1297554239	/nfs/dbraw/zinc/55/42/39/1297554239.db2.gz	NMGZLOYRRSWEJY-INIZCTEOSA-N	0	3	340.261	3.222	20	30		EGEDHN
C[C@H]1CC[C@H](NCc2cc(C#N)cs2)CN1C(=O)OC(C)(C)C	ZINC000690964303	1298132340	/nfs/dbraw/zinc/13/23/40/1298132340.db2.gz	IUGKZFVHWLLZBR-JSGCOSHPSA-N	0	3	335.473	3.497	20	30		EGEDHN
CCc1nc(C#N)cc(N2CCN(Cc3ccccc3)[C@H](C(C)C)C2)n1	ZINC000704721512	1298207729	/nfs/dbraw/zinc/20/77/29/1298207729.db2.gz	YLQBFCMSRPRJMW-IBGZPJMESA-N	0	3	349.482	3.257	20	30		EGEDHN
C=CCN(CC(=O)Nc1cccc(CN2CCSCC2)c1)C(C)C	ZINC000725795389	1298363493	/nfs/dbraw/zinc/36/34/93/1298363493.db2.gz	OOJZBKMYHVJFSZ-UHFFFAOYSA-N	0	3	347.528	3.070	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)CSCc3cscn3)nc21	ZINC000747232369	1298745773	/nfs/dbraw/zinc/74/57/73/1298745773.db2.gz	IGLLCJMCEVXTJM-LBPRGKRZSA-N	0	3	342.449	3.438	20	30		EGEDHN
Cc1cccc2nc(C(C#N)C(=O)CSCc3cscn3)[nH]c21	ZINC000747232369	1298745779	/nfs/dbraw/zinc/74/57/79/1298745779.db2.gz	IGLLCJMCEVXTJM-LBPRGKRZSA-N	0	3	342.449	3.438	20	30		EGEDHN
CCN1CCN(c2ccc(NC(=O)c3sccc3C#N)cc2)CC1	ZINC000748053546	1298920246	/nfs/dbraw/zinc/92/02/46/1298920246.db2.gz	PHNRVYIKQWUHMV-UHFFFAOYSA-N	0	3	340.452	3.014	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1SCCSCC	ZINC000750002486	1299320501	/nfs/dbraw/zinc/32/05/01/1299320501.db2.gz	GKJHUWXDXMRVKH-UHFFFAOYSA-N	0	3	340.562	3.338	20	30		EGEDHN
CCO[C@@H](CC(=O)C(C#N)C(=O)Nc1ccccc1Cl)C(C)C	ZINC000761038024	1301386023	/nfs/dbraw/zinc/38/60/23/1301386023.db2.gz	PXNIFHWBAWDKDB-LRDDRELGSA-N	0	3	336.819	3.439	20	30		EGEDHN
C[C@H]1CN(C[C@@H](O)COc2ccc(CC#N)cc2)Cc2ccccc21	ZINC000763628390	1301936342	/nfs/dbraw/zinc/93/63/42/1301936342.db2.gz	JHXMRATWOAJNCL-QFBILLFUSA-N	0	3	336.435	3.112	20	30		EGEDHN
C#CCNC(=O)CCN[C@@H](CC(C)C)c1cc(Cl)ccc1OC	ZINC000765506987	1302275662	/nfs/dbraw/zinc/27/56/62/1302275662.db2.gz	PBFXCQFQISHNCG-INIZCTEOSA-N	0	3	336.863	3.165	20	30		EGEDHN
CN(CCOC(C)(C)C)CC(=O)C(C#N)c1nc2ccccc2s1	ZINC000767905379	1302781388	/nfs/dbraw/zinc/78/13/88/1302781388.db2.gz	MEXHGYOYLDJXRK-ZDUSSCGKSA-N	0	3	345.468	3.219	20	30		EGEDHN
CN(CCCCC(C)(C)C#N)[C@H]1CCN(Cc2ccccc2)C1=O	ZINC000769799483	1303176167	/nfs/dbraw/zinc/17/61/67/1303176167.db2.gz	GMGDTPJGNOVZOV-SFHVURJKSA-N	0	3	327.472	3.439	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)cc1	ZINC000770042874	1303211535	/nfs/dbraw/zinc/21/15/35/1303211535.db2.gz	BJUBIZZUGFOKIR-JXFKEZNVSA-N	0	3	336.435	3.120	20	30		EGEDHN
COc1cc(Cl)c(C)cc1NC(=O)C(C#N)C(=O)C=CSC	ZINC000771581995	1303422979	/nfs/dbraw/zinc/42/29/79/1303422979.db2.gz	IDLYYPLFVKOSCD-YEZKRMTDSA-N	0	3	338.816	3.181	20	30		EGEDHN
C[C@H](N[C@@H]1CCN(c2ccc(C#N)cc2)C1=O)c1ccc(N(C)C)cc1	ZINC000774487387	1303816879	/nfs/dbraw/zinc/81/68/79/1303816879.db2.gz	ZZNOQVLOLIKDRC-MGPUTAFESA-N	0	3	348.450	3.080	20	30		EGEDHN
CC1(C)OCC(C)(C(=O)C(C#N)c2nc3cc(F)ccc3s2)CO1	ZINC000775241166	1303928983	/nfs/dbraw/zinc/92/89/83/1303928983.db2.gz	XBEAVZDKHKTGHK-NSHDSACASA-N	0	3	348.399	3.401	20	30		EGEDHN
C[C@@H](NCC#Cc1ccc(F)cc1)c1ccc(N2CCOCC2)cc1	ZINC000775254402	1303930656	/nfs/dbraw/zinc/93/06/56/1303930656.db2.gz	IKVSKBFKKFHCAP-QGZVFWFLSA-N	0	3	338.426	3.365	20	30		EGEDHN
C#CCCN1CCN(CCCOc2cccc(C(C)(C)C)c2)CC1	ZINC000776593322	1304178127	/nfs/dbraw/zinc/17/81/27/1304178127.db2.gz	GYYGVPWRENGMBY-UHFFFAOYSA-N	0	3	328.500	3.394	20	30		EGEDHN
N#CCC[C@H](NC[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1	ZINC000776606117	1304179025	/nfs/dbraw/zinc/17/90/25/1304179025.db2.gz	RQXGFQXHDOYVJZ-ZWKOTPCHSA-N	0	3	325.368	3.263	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cccc(Oc3ccccc3)n2)CC1	ZINC000889469804	1304491130	/nfs/dbraw/zinc/49/11/30/1304491130.db2.gz	NVLYUMWGLZCODD-UHFFFAOYSA-N	0	3	335.407	3.158	20	30		EGEDHN
C=CCCN(OCc1ccccc1)C(=O)N[C@H]1C[C@H](C)N(C2CC2)C1	ZINC000782976145	1305033323	/nfs/dbraw/zinc/03/33/23/1305033323.db2.gz	GVIDPABCEBOHRE-WMZOPIPTSA-N	0	3	343.471	3.331	20	30		EGEDHN
CC(=O)N[C@@H](CC(C)C)C(=O)C(C#N)c1nc2cc(F)ccc2s1	ZINC000783379344	1305084763	/nfs/dbraw/zinc/08/47/63/1305084763.db2.gz	SVIJEIXBGGMEAA-OCCSQVGLSA-N	0	3	347.415	3.162	20	30		EGEDHN
CN1c2ccc(CN[C@@H]3CCc4cc(C#N)ccc43)cc2CCC1=O	ZINC000785617801	1305394153	/nfs/dbraw/zinc/39/41/53/1305394153.db2.gz	UROGERQUUSJJEM-LJQANCHMSA-N	0	3	331.419	3.244	20	30		EGEDHN
C#CCCCCCC(=O)C(C#N)C(=O)NCc1cccc(Cl)c1	ZINC000786529330	1305590479	/nfs/dbraw/zinc/59/04/79/1305590479.db2.gz	URSRRIHYUKENCV-MRXNPFEDSA-N	0	3	330.815	3.249	20	30		EGEDHN
CCO[C@H](CC(=O)C(C#N)C(=O)N[C@@H](CC)c1ccccc1)C(C)C	ZINC000787036594	1305680583	/nfs/dbraw/zinc/68/05/83/1305680583.db2.gz	PAPHBDDZPJBRHL-ZIFCJYIRSA-N	0	3	344.455	3.414	20	30		EGEDHN
COc1ccc(C(C)=NOC[C@H]2CCOC2)cc1CN1CCCCC1	ZINC000788037282	1305853121	/nfs/dbraw/zinc/85/31/21/1305853121.db2.gz	SYWZXILVVJHXCL-KRWDZBQOSA-N	0	3	346.471	3.458	20	30		EGEDHN
C#CCC1(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)CCCCC1	ZINC000788135525	1305876027	/nfs/dbraw/zinc/87/60/27/1305876027.db2.gz	MIQORPXJQKMFAD-LJQANCHMSA-N	0	3	326.484	3.249	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)[C@@H]3CC(=O)c4ccccc43)nc21	ZINC000789376513	1306149415	/nfs/dbraw/zinc/14/94/15/1306149415.db2.gz	AAEULFWGKQQGBI-HUUCEWRRSA-N	0	3	329.359	3.418	20	30		EGEDHN
Cc1cccc2nc(C(C#N)C(=O)[C@@H]3CC(=O)c4ccccc43)[nH]c21	ZINC000789376513	1306149417	/nfs/dbraw/zinc/14/94/17/1306149417.db2.gz	AAEULFWGKQQGBI-HUUCEWRRSA-N	0	3	329.359	3.418	20	30		EGEDHN
N#CC(C(=O)c1cccc(C2OCCO2)c1)c1cnc2ccccc2n1	ZINC000792107412	1309121385	/nfs/dbraw/zinc/12/13/85/1309121385.db2.gz	FLSAHXJXTACMBL-OAHLLOKOSA-N	0	3	345.358	3.165	20	30		EGEDHN
COc1ccc(C[NH2+]Cc2cccc(OCCCC#N)c2)c([O-])c1	ZINC000793387574	1309361282	/nfs/dbraw/zinc/36/12/82/1309361282.db2.gz	HWHGBISRHKUENE-UHFFFAOYSA-N	0	3	326.396	3.373	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1Cl)C(=O)[C@H]1CCC(F)(F)C1	ZINC000796632371	1310050519	/nfs/dbraw/zinc/05/05/19/1310050519.db2.gz	KRWPCIDVYWKSPV-UWVGGRQHSA-N	0	3	326.730	3.423	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)CCCOC(C)(C)C	ZINC000796796481	1310089060	/nfs/dbraw/zinc/08/90/60/1310089060.db2.gz	FCEIUFMUJUCWRI-AWEZNQCLSA-N	0	3	346.427	3.328	20	30		EGEDHN
CN(CCC#N)c1ccc(CNCc2cnn(CC3CCC3)c2)cc1	ZINC000897434842	1310336406	/nfs/dbraw/zinc/33/64/06/1310336406.db2.gz	CWLCYVYYFGNRHK-UHFFFAOYSA-N	0	3	337.471	3.323	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)cc1C#N	ZINC000799366801	1310537686	/nfs/dbraw/zinc/53/76/86/1310537686.db2.gz	SXZADLFLERUMGV-UZLBHIALSA-N	0	3	333.435	3.117	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1C#N	ZINC000799529736	1310567696	/nfs/dbraw/zinc/56/76/96/1310567696.db2.gz	XCZAWSHPOSUQRP-FQEVSTJZSA-N	0	3	333.435	3.434	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)[C@@H]2O[C@H](C)C[C@H]2C)cc1	ZINC000800384766	1310746623	/nfs/dbraw/zinc/74/66/23/1310746623.db2.gz	JUXVBKNAIXGHSZ-BCXHYRKLSA-N	0	3	342.439	3.490	20	30		EGEDHN
Cc1cccc(CNC(=O)C(C#N)C(=O)[C@H]2CCCC(F)(F)C2)c1	ZINC000800409208	1310749675	/nfs/dbraw/zinc/74/96/75/1310749675.db2.gz	KEELYUYVEMUWSL-GJZGRUSLSA-N	0	3	334.366	3.146	20	30		EGEDHN
COC(=O)c1c(F)cccc1NN=Cc1nc(C)n2ccccc12	ZINC000800817979	1310812060	/nfs/dbraw/zinc/81/20/60/1310812060.db2.gz	BLZWGDYLQRFQTI-UHFFFAOYSA-N	0	3	326.331	3.014	20	30		EGEDHN
CCCC[N@H+](Cc1ccccc1[O-])[C@@H](C)C(=O)N[C@](C)(C#N)C(C)C	ZINC000801597514	1310970627	/nfs/dbraw/zinc/97/06/27/1310970627.db2.gz	JAYWPIUINYRPHA-OXJNMPFZSA-N	0	3	345.487	3.437	20	30		EGEDHN
CCCC[N@@H+](Cc1ccccc1[O-])[C@@H](C)C(=O)N[C@](C)(C#N)C(C)C	ZINC000801597514	1310970633	/nfs/dbraw/zinc/97/06/33/1310970633.db2.gz	JAYWPIUINYRPHA-OXJNMPFZSA-N	0	3	345.487	3.437	20	30		EGEDHN
Cc1ccc(C(=O)N2CCN(Cc3ccccc3)C[C@H](C)C2)cc1C#N	ZINC000836921047	1320554791	/nfs/dbraw/zinc/55/47/91/1320554791.db2.gz	WSDFUIMSCBEVLY-KRWDZBQOSA-N	0	3	347.462	3.461	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)Cc1ccc(Cl)s1	ZINC000802040674	1316975721	/nfs/dbraw/zinc/97/57/21/1316975721.db2.gz	JGJWKBFCVUNHRE-NSHDSACASA-N	0	3	348.811	3.300	20	30		EGEDHN
N#Cc1cc(CN[C@H]2CCN(C(=O)C[C@H]3C=CCCC3)C2)ccc1F	ZINC001019029378	1317013239	/nfs/dbraw/zinc/01/32/39/1317013239.db2.gz	UXMSAIBGYXXEQH-YJBOKZPZSA-N	0	3	341.430	3.134	20	30		EGEDHN
CC1(C)CC(CC(=O)N2CC[C@H](NCc3ccc(F)c(C#N)c3)C2)C1	ZINC001019278826	1317142553	/nfs/dbraw/zinc/14/25/53/1317142553.db2.gz	WIMLSOZPYRJBCL-KRWDZBQOSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H](NCc2ccc(OC)c(F)c2)C1	ZINC001019331741	1317173094	/nfs/dbraw/zinc/17/30/94/1317173094.db2.gz	CKDCEONJQCMESP-HNAYVOBHSA-N	0	3	334.435	3.127	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)[C@H](F)c3ccccc3)C2)s1	ZINC001019440664	1317246736	/nfs/dbraw/zinc/24/67/36/1317246736.db2.gz	OCDLRMKSAOYROV-WMLDXEAASA-N	0	3	343.427	3.021	20	30		EGEDHN
C[C@@H](CC(=O)N1CC[C@H](NCc2ccc(C#N)s2)C1)c1ccco1	ZINC001019667221	1317324109	/nfs/dbraw/zinc/32/41/09/1317324109.db2.gz	XDIXILUWVLECHA-KBPBESRZSA-N	0	3	343.452	3.097	20	30		EGEDHN
C#Cc1ccc(C(=O)N(Cc2ccccc2)C2CCN(C)CC2)cc1	ZINC000900964676	1317363650	/nfs/dbraw/zinc/36/36/50/1317363650.db2.gz	ZHYLKXBCCMVMKQ-UHFFFAOYSA-N	0	3	332.447	3.405	20	30		EGEDHN
C=C[C@H](C(=O)N1CC[C@H](NCc2ccsc2)C1)c1ccccc1	ZINC001019804554	1317431459	/nfs/dbraw/zinc/43/14/59/1317431459.db2.gz	ALEUQDUABZGRAO-ROUUACIJSA-N	0	3	326.465	3.408	20	30		EGEDHN
C=C[C@H](C(=O)N1CC[C@H](NCc2cnccc2C)C1)c1ccccc1	ZINC001019805122	1317433221	/nfs/dbraw/zinc/43/32/21/1317433221.db2.gz	UBFFHLDPKOTVQJ-PMACEKPBSA-N	0	3	335.451	3.050	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)CC(C3CC3)C3CC3)C2)s1	ZINC001019831830	1317442295	/nfs/dbraw/zinc/44/22/95/1317442295.db2.gz	SPQATOQCAXZDBA-HNNXBMFYSA-N	0	3	343.496	3.137	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)cc1	ZINC000807738238	1317581434	/nfs/dbraw/zinc/58/14/34/1317581434.db2.gz	CBVOPSPBVVIDIE-UWJYYQICSA-N	0	3	348.446	3.091	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C2(C)CCCCCC2)C1	ZINC001020247069	1317608730	/nfs/dbraw/zinc/60/87/30/1317608730.db2.gz	XLAIWXDLRHORNM-HDJSIYSDSA-N	0	3	343.309	3.492	20	30		EGEDHN
CC[C@@H](N[C@H]1CCCN(CC(F)(F)F)C1=O)c1cccc(C#N)c1	ZINC000902882154	1317627178	/nfs/dbraw/zinc/62/71/78/1317627178.db2.gz	PGRJPDRZVMKRQP-CABCVRRESA-N	0	3	339.361	3.152	20	30		EGEDHN
CC[C@@H](NCC1(S(C)(=O)=O)CCCCC1)c1cccc(C#N)c1	ZINC000903051004	1317642900	/nfs/dbraw/zinc/64/29/00/1317642900.db2.gz	BQINRBGRKAIZAT-QGZVFWFLSA-N	0	3	334.485	3.346	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H]2CCC[C@H](C(F)(F)F)C2)C1	ZINC001020335996	1317651974	/nfs/dbraw/zinc/65/19/74/1317651974.db2.gz	PISKDCDCTFXZJP-YVECIDJPSA-N	0	3	338.801	3.344	20	30		EGEDHN
C[C@@H](NCCCONC(=O)OC(C)(C)C)c1ccc(C#N)cc1F	ZINC000903238974	1317679639	/nfs/dbraw/zinc/67/96/39/1317679639.db2.gz	CPVZNIJBQCEKIV-GFCCVEGCSA-N	0	3	337.395	3.194	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2F)C1	ZINC001020423728	1317690967	/nfs/dbraw/zinc/69/09/67/1317690967.db2.gz	MMKPSXXXPHJDKU-NZBPQXDJSA-N	0	3	340.801	3.058	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@H](NC(=O)C3(C4CC4)CCC3)C2)c1	ZINC001020440831	1317697877	/nfs/dbraw/zinc/69/78/77/1317697877.db2.gz	USIWUFWQLDZNKH-QAQDUYKDSA-N	0	3	341.430	3.014	20	30		EGEDHN
C[C@H]1CCC[C@@H](C(=O)N[C@H]2C[C@H](NCc3ccc(C#N)cc3F)C2)C1	ZINC001020524705	1317743984	/nfs/dbraw/zinc/74/39/84/1317743984.db2.gz	XTUJOHJKBMSYQP-DHXZDTOLSA-N	0	3	343.446	3.260	20	30		EGEDHN
CC1(C)CC[C@H](C(=O)N[C@H]2C[C@H](NCc3ccc(C#N)cc3F)C2)C1	ZINC001020561874	1317774386	/nfs/dbraw/zinc/77/43/86/1317774386.db2.gz	MZWCCPBBZFQHDD-XIRDDKMYSA-N	0	3	343.446	3.260	20	30		EGEDHN
C#CCCOc1ccc(CNCc2ccc(N(C)C(C)=O)cc2)cc1	ZINC000858250178	1328723038	/nfs/dbraw/zinc/72/30/38/1328723038.db2.gz	JQALTVFNOPQAGH-UHFFFAOYSA-N	0	3	336.435	3.361	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CN1CC[C@@H](c2nccn2C)C1	ZINC000809755891	1317892307	/nfs/dbraw/zinc/89/23/07/1317892307.db2.gz	CZQIKLURWLPDIN-CQSZACIVSA-N	0	3	329.831	3.075	20	30		EGEDHN
CCOc1c(Cl)cc(/C=C2/C(=O)c3ncnn3C2C)cc1OC	ZINC000905079321	1317920166	/nfs/dbraw/zinc/92/01/66/1317920166.db2.gz	ATDBDKDGUUZLMM-WUFUFFIZSA-N	0	3	333.775	3.180	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NC[C@@H](CC)N1CCc2ccccc2C1	ZINC000810090998	1317948912	/nfs/dbraw/zinc/94/89/12/1317948912.db2.gz	FITKPFUXOUWBQA-JOCHJYFZSA-N	0	3	346.474	3.164	20	30		EGEDHN
C[C@H](N[C@@H]1CCc2ccc(C#N)cc21)c1ccc2c(c1)CC(=O)N2C	ZINC000810216575	1317979181	/nfs/dbraw/zinc/97/91/81/1317979181.db2.gz	XMQAJFLQQCLLSQ-ORAYPTAESA-N	0	3	331.419	3.415	20	30		EGEDHN
C[C@H](C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1)C1CCCC1	ZINC001020907571	1317993385	/nfs/dbraw/zinc/99/33/85/1317993385.db2.gz	HCUXSKFIDPTKBH-KKXDTOCCSA-N	0	3	343.446	3.260	20	30		EGEDHN
Cc1cc(=O)cc(C)n1CCCC(=O)C(C#N)c1nc2ccccc2o1	ZINC000810536838	1318019453	/nfs/dbraw/zinc/01/94/53/1318019453.db2.gz	UUSRTIAKPWRQJZ-MRXNPFEDSA-N	0	3	349.390	3.263	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)Cc2c(F)cccc2Cl)C1	ZINC001020973512	1318024917	/nfs/dbraw/zinc/02/49/17/1318024917.db2.gz	VXUHCLZBSNZTDC-XYPYZODXSA-N	0	3	331.218	3.011	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)[C@@H]1CCCSC1)c1ccccc1	ZINC000810710773	1318047524	/nfs/dbraw/zinc/04/75/24/1318047524.db2.gz	VEZSPVBLUTXRFO-OAGGEKHMSA-N	0	3	330.453	3.106	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc3c(s2)CC[C@H](C)C3)C1	ZINC001021036318	1318057236	/nfs/dbraw/zinc/05/72/36/1318057236.db2.gz	VZVIAMQYCYHFSL-BPNCWPANSA-N	0	3	338.904	3.476	20	30		EGEDHN
CN(C(=O)c1ccsc1C#N)C1CCN(Cc2ccccc2)CC1	ZINC000906690077	1318137826	/nfs/dbraw/zinc/13/78/26/1318137826.db2.gz	VFHNMKOVJMDPOY-UHFFFAOYSA-N	0	3	339.464	3.356	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@@H]2CN(Cc3ccc(C#N)cc3)CC[C@H]21	ZINC001021507618	1318324740	/nfs/dbraw/zinc/32/47/40/1318324740.db2.gz	ZTELHIHCZUKIEU-WOJBJXKFSA-N	0	3	339.483	3.417	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@H](CCCN3C(=O)c3ccoc3)C2)c1	ZINC001021519176	1318346487	/nfs/dbraw/zinc/34/64/87/1318346487.db2.gz	KTIIDLZUXXIKDA-QUCCMNQESA-N	0	3	349.434	3.278	20	30		EGEDHN
C=C1CCC(C(=O)N2CCCC[C@H]2CNCc2cnc(C)nc2)CC1	ZINC000960111946	1318362702	/nfs/dbraw/zinc/36/27/02/1318362702.db2.gz	RBWHANJCSJANCA-IBGZPJMESA-N	0	3	342.487	3.002	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)s1	ZINC000960152363	1318385056	/nfs/dbraw/zinc/38/50/56/1318385056.db2.gz	HMZOGYIUBKDAGB-GJZGRUSLSA-N	0	3	333.501	3.383	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2c(C)oc3ccccc32)C1	ZINC001021590370	1318434126	/nfs/dbraw/zinc/43/41/26/1318434126.db2.gz	FHHLJBUHLLMABC-FUHWJXTLSA-N	0	3	336.435	3.301	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc3nccc(C)c3c2)C1	ZINC001021595518	1318441858	/nfs/dbraw/zinc/44/18/58/1318441858.db2.gz	ZICFRCISXSRAAS-NQIIRXRSSA-N	0	3	347.462	3.103	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1c(F)cc(C)cc1F	ZINC000960280478	1318442528	/nfs/dbraw/zinc/44/25/28/1318442528.db2.gz	DRXFZYIJLLPZFY-IEBWSBKVSA-N	0	3	342.389	3.445	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc3cc(C)cn3c2)C1	ZINC001021599598	1318442792	/nfs/dbraw/zinc/44/27/92/1318442792.db2.gz	IJAGJYVBAMFXJQ-NQIIRXRSSA-N	0	3	349.478	3.198	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc2ccn(C)c2c1	ZINC000960318125	1318459237	/nfs/dbraw/zinc/45/92/37/1318459237.db2.gz	MEUIDEMJAZOGJO-TZIWHRDSSA-N	0	3	345.446	3.350	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@]1(C)CCc2ccccc21	ZINC000960334036	1318467445	/nfs/dbraw/zinc/46/74/45/1318467445.db2.gz	RPZYROPXZYPVOK-MQSCRBSSSA-N	0	3	346.474	3.448	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)Cc1ccccc1C	ZINC000960335531	1318469288	/nfs/dbraw/zinc/46/92/88/1318469288.db2.gz	XVOAARZUFBOIMJ-IFMALSPDSA-N	0	3	334.463	3.485	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(Cl)cc2F)C1	ZINC001021626162	1318477283	/nfs/dbraw/zinc/47/72/83/1318477283.db2.gz	DENBBYOCPMWZBT-KBXCAEBGSA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cn(CC)c3ccccc23)C1	ZINC001021628013	1318480292	/nfs/dbraw/zinc/48/02/92/1318480292.db2.gz	RRKMHOKZDIVNHQ-PXNSSMCTSA-N	0	3	349.478	3.221	20	30		EGEDHN
N#CC[C@@H](O)CNC1(c2cccc(Br)c2)CCCCC1	ZINC000930036605	1328769173	/nfs/dbraw/zinc/76/91/73/1328769173.db2.gz	PHMZZHQBMSUBLP-OAHLLOKOSA-N	0	3	337.261	3.473	20	30		EGEDHN
CC(C)[C@H](NCc1ccc(O[C@@H](C)C#N)cc1)[C@H](O)C(F)(F)F	ZINC000813327358	1318534104	/nfs/dbraw/zinc/53/41/04/1318534104.db2.gz	FULTYYNUTRJBCG-CQDKDKBSSA-N	0	3	330.350	3.015	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(C(CC)CC)no2)C1	ZINC001021686393	1318560928	/nfs/dbraw/zinc/56/09/28/1318560928.db2.gz	YIMUQKMOBFUMRQ-WMZOPIPTSA-N	0	3	343.471	3.138	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cccc3c2ccn3C)C1	ZINC001021693034	1318565900	/nfs/dbraw/zinc/56/59/00/1318565900.db2.gz	XIFANMYAUQIIAJ-YLJYHZDGSA-N	0	3	349.478	3.128	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC[C@@H]1CN(C)Cc1cc2ccccc2o1	ZINC000960498052	1318606259	/nfs/dbraw/zinc/60/62/59/1318606259.db2.gz	CGGRGMGRCDVVRK-GOEBONIOSA-N	0	3	325.412	3.015	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(C(F)F)o2)C1	ZINC001021723987	1318615327	/nfs/dbraw/zinc/61/53/27/1318615327.db2.gz	HRAMJJKIBZQCTG-UONOGXRCSA-N	0	3	336.382	3.167	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)Cc2sc(C)cc2C)C1	ZINC001021725750	1318616656	/nfs/dbraw/zinc/61/66/56/1318616656.db2.gz	VZDZNPDSTFIQPS-MSOLQXFVSA-N	0	3	344.524	3.244	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cccc3cnccc32)C1	ZINC001021737352	1318643697	/nfs/dbraw/zinc/64/36/97/1318643697.db2.gz	SXUHYFIDGQYAQO-GHTZIAJQSA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)CC(C2CC2)C2CC2)C1	ZINC001021738958	1318645806	/nfs/dbraw/zinc/64/58/06/1318645806.db2.gz	FXBGDCWYDDMGSX-ICSRJNTNSA-N	0	3	328.500	3.149	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cnc(C(C)(C)C)s2)C1	ZINC001021739940	1318650555	/nfs/dbraw/zinc/65/05/55/1318650555.db2.gz	PEDHEZGPYXOGMN-HUUCEWRRSA-N	0	3	345.512	3.000	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@@H](NC(=O)C3CCCCCC3)C2)c1	ZINC001021890360	1318721511	/nfs/dbraw/zinc/72/15/11/1318721511.db2.gz	WWGXWDGHTRLIIS-HDICACEKSA-N	0	3	343.446	3.405	20	30		EGEDHN
Cc1cc(Cl)ccc1CN(C)C[C@H]1CCCN1C(=O)C#CC1CC1	ZINC000960627857	1318753592	/nfs/dbraw/zinc/75/35/92/1318753592.db2.gz	SILZOESHBLWXDE-LJQANCHMSA-N	0	3	344.886	3.485	20	30		EGEDHN
CN(Cc1ccc2ncccc2c1)C[C@@H]1CCCN1C(=O)C#CC1CC1	ZINC000960628251	1318753739	/nfs/dbraw/zinc/75/37/39/1318753739.db2.gz	VLFQFKUMPPDDEH-FQEVSTJZSA-N	0	3	347.462	3.071	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)N[C@@H]1CCCc2[nH]c(=O)ccc21	ZINC000912196185	1318846510	/nfs/dbraw/zinc/84/65/10/1318846510.db2.gz	SOMJRSOGTFWDED-DOTOQJQBSA-N	0	3	333.476	3.359	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1cc(C(F)(F)F)ccc1NC(C)=O	ZINC000912257712	1318855198	/nfs/dbraw/zinc/85/51/98/1318855198.db2.gz	CEYNBCLCAUDODW-GFCCVEGCSA-N	0	3	343.349	3.286	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)[C@]12C[C@H]1CCC2	ZINC000960755230	1318858035	/nfs/dbraw/zinc/85/80/35/1318858035.db2.gz	IAAGWAONQONUMT-SVFBPWRDSA-N	0	3	337.467	3.171	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)Nc1ccc(NC(=O)COC)cc1	ZINC000912301439	1318864866	/nfs/dbraw/zinc/86/48/66/1318864866.db2.gz	KRMVKJLDQOZCJS-QGZVFWFLSA-N	0	3	349.475	3.288	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)Nc1cnn(C[C@@H]2CCCO2)c1	ZINC000912483108	1318893383	/nfs/dbraw/zinc/89/33/83/1318893383.db2.gz	YKEQZIWXPVUDPW-DLBZAZTESA-N	0	3	336.480	3.079	20	30		EGEDHN
CCN(C)c1ccc(CN2CC[C@H](Oc3ccc(C#N)cn3)C2)cc1	ZINC000815120110	1318899792	/nfs/dbraw/zinc/89/97/92/1318899792.db2.gz	AYKLRVOZSIUFJW-IBGZPJMESA-N	0	3	336.439	3.063	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]\C2CCN(C(=O)C3CC3)CC2)c([O-])c1	ZINC000912782406	1318931122	/nfs/dbraw/zinc/93/11/22/1318931122.db2.gz	QRRALZPFAFBKCS-STZFKDTASA-N	0	3	343.471	3.058	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)C2(c3cccc(C)c3)CCC2)C1	ZINC001022522490	1318977351	/nfs/dbraw/zinc/97/73/51/1318977351.db2.gz	QTDJITLQDSQVQV-CALCHBBNSA-N	0	3	332.875	3.406	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2C[C@@H](NCc3cccc(C(C)C)n3)C2)cc1	ZINC001022527469	1318978703	/nfs/dbraw/zinc/97/87/03/1318978703.db2.gz	YTBKJPOXDHGLNO-BGYRXZFFSA-N	0	3	347.462	3.237	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)[C@@H]1CC12CCC2	ZINC000960916417	1319062060	/nfs/dbraw/zinc/06/20/60/1319062060.db2.gz	XNZCABKAZOAKJB-OALUTQOASA-N	0	3	337.467	3.171	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@@H](NC(=O)[C@@]34C[C@@H]3CCCC4)C2)c1	ZINC001022681632	1319066112	/nfs/dbraw/zinc/06/61/12/1319066112.db2.gz	KWIJAWPBEPJTHB-LJCCNALRSA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2c2c(F)cccc2F)C1	ZINC001022687782	1319067920	/nfs/dbraw/zinc/06/79/20/1319067920.db2.gz	MLQSPCQUXAKEHA-YVECIDJPSA-N	0	3	340.801	3.058	20	30		EGEDHN
CC(C)[C@@]1(C)C[C@H]1C(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001022916660	1319166878	/nfs/dbraw/zinc/16/68/78/1319166878.db2.gz	CTJPMWKTAHKTSH-PFRQMTDMSA-N	0	3	343.446	3.116	20	30		EGEDHN
CCC(=O)N1CCC[C@@H]([C@H]2CCN(Cc3ccc(C#N)s3)C2)C1	ZINC000961092658	1319203201	/nfs/dbraw/zinc/20/32/01/1319203201.db2.gz	SNRWKWCBNJHVSQ-CABCVRRESA-N	0	3	331.485	3.090	20	30		EGEDHN
CCCC(=O)N1CCC[C@H]([C@H]2CCN(CC#Cc3ccccc3)C2)C1	ZINC000961101332	1319211657	/nfs/dbraw/zinc/21/16/57/1319211657.db2.gz	RVCXLHYSCCZAHM-SFTDATJTSA-N	0	3	338.495	3.399	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc(C)c(F)cc2Cl)C1	ZINC001023030067	1319229236	/nfs/dbraw/zinc/22/92/36/1319229236.db2.gz	MXKWRFBNAPSJPY-PHIMTYICSA-N	0	3	331.218	3.390	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)C2(c3ccccc3)CCCC2)C1	ZINC001023056606	1319243510	/nfs/dbraw/zinc/24/35/10/1319243510.db2.gz	BILBICSNYLMOGP-CALCHBBNSA-N	0	3	332.875	3.488	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@H]2C[C@@H]2c2cc(F)ccc2F)C1	ZINC001023105905	1319262865	/nfs/dbraw/zinc/26/28/65/1319262865.db2.gz	NRGNPJKVOCTPSC-COMQUAJESA-N	0	3	340.801	3.058	20	30		EGEDHN
CC(=O)N[C@@H](C)C(=O)C(C#N)c1nc(-c2ccc(Cl)cc2)cs1	ZINC000915101821	1319423311	/nfs/dbraw/zinc/42/33/11/1319423311.db2.gz	LUOYPVWHPXHDGD-TVQRCGJNSA-N	0	3	347.827	3.164	20	30		EGEDHN
C=CCN(CC=C)C(=O)Nc1ccc(N2CCN(CC)CC2)cc1	ZINC000915322642	1319468323	/nfs/dbraw/zinc/46/83/23/1319468323.db2.gz	CDUWLQXRZOHRNL-UHFFFAOYSA-N	0	3	328.460	3.034	20	30		EGEDHN
CCCCCCCCCC(=O)N1CCC[C@@H](n2cc(CN)nn2)C1	ZINC000818011349	1319490773	/nfs/dbraw/zinc/49/07/73/1319490773.db2.gz	YLNHSEQMXAKAFS-QGZVFWFLSA-N	0	3	335.496	3.041	20	30		EGEDHN
C#CCN(C)CCCNC(=O)[C@H](SCc1ccccc1)C(C)C	ZINC000818588775	1319563994	/nfs/dbraw/zinc/56/39/94/1319563994.db2.gz	GLHWUCXDZWPXNF-GOSISDBHSA-N	0	3	332.513	3.016	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1cc(C)n(C2CCCCC2)c1C	ZINC000818603223	1319567222	/nfs/dbraw/zinc/56/72/22/1319567222.db2.gz	URCYUEXYPOUNQX-UHFFFAOYSA-N	0	3	329.488	3.295	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc(OC)c(C(C)C)c2)C1	ZINC001023469616	1319567561	/nfs/dbraw/zinc/56/75/61/1319567561.db2.gz	JTBYHKQFCZAUKD-QGZVFWFLSA-N	0	3	342.483	3.284	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1ccccc1SCC=C(C)C	ZINC000818606362	1319567922	/nfs/dbraw/zinc/56/79/22/1319567922.db2.gz	OZMQQQOXSLOPQG-UHFFFAOYSA-N	0	3	330.497	3.430	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc3cc(C)ccc3n2)C1	ZINC001023479872	1319584951	/nfs/dbraw/zinc/58/49/51/1319584951.db2.gz	SVYZILRYWNEXGO-KRWDZBQOSA-N	0	3	335.451	3.008	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)[C@@H]2CCc3c2cccc3Cl)C1	ZINC001023492740	1319596528	/nfs/dbraw/zinc/59/65/28/1319596528.db2.gz	CHNWVQCXHXIAQK-MAUKXSAKSA-N	0	3	344.886	3.221	20	30		EGEDHN
Cc1sccc1C(=O)NC1CC(CNCc2ccccc2C#N)C1	ZINC000961820399	1319741012	/nfs/dbraw/zinc/74/10/12/1319741012.db2.gz	GFTSXWURHKGNAQ-UHFFFAOYSA-N	0	3	339.464	3.226	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc3nc(C)sc3c2)C1	ZINC001023686091	1319802169	/nfs/dbraw/zinc/80/21/69/1319802169.db2.gz	PFHARDDEPRPRJT-OAHLLOKOSA-N	0	3	341.480	3.070	20	30		EGEDHN
Cc1ccc(CC(=O)NC2CC(CNCc3ccccc3C#N)C2)cc1	ZINC000962047431	1319806477	/nfs/dbraw/zinc/80/64/77/1319806477.db2.gz	AUQQIMZTXQJXPI-UHFFFAOYSA-N	0	3	347.462	3.094	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cccc(Cl)c2Cl)C1	ZINC001023718383	1319855268	/nfs/dbraw/zinc/85/52/68/1319855268.db2.gz	RXRVVSCXHBLRQE-ZDUSSCGKSA-N	0	3	339.266	3.459	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc(OCC(C)C)cc2)C1	ZINC001023735350	1319876182	/nfs/dbraw/zinc/87/61/82/1319876182.db2.gz	LVPPKKKGGSNQPR-SFHVURJKSA-N	0	3	342.483	3.187	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2csc3c2CCCC3)C1	ZINC001023736616	1319879221	/nfs/dbraw/zinc/87/92/21/1319879221.db2.gz	GRYBBOBKHVPZQH-OAHLLOKOSA-N	0	3	330.497	3.092	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc(COC(C)C)cc2)C1	ZINC001023740319	1319885866	/nfs/dbraw/zinc/88/58/66/1319885866.db2.gz	DXCWYIYUQMKJNK-LJQANCHMSA-N	0	3	342.483	3.077	20	30		EGEDHN
C#C[C@H](NC(=O)N1CCN(C2CC2)C[C@@H](C)C1)c1ccc(Cl)cc1	ZINC000820560738	1319911090	/nfs/dbraw/zinc/91/10/90/1319911090.db2.gz	YSEGDHLPEVAFMF-KDOFPFPSSA-N	0	3	345.874	3.140	20	30		EGEDHN
C#C[C@H](NC(=O)N(CCN(C)C)Cc1ccc(C)o1)c1ccccc1	ZINC000820605302	1319920435	/nfs/dbraw/zinc/92/04/35/1319920435.db2.gz	MGEDAWRBVGCRAR-IBGZPJMESA-N	0	3	339.439	3.036	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)C2CC(c3ccc(F)cc3)C2)C1	ZINC001023774886	1319923756	/nfs/dbraw/zinc/92/37/56/1319923756.db2.gz	QXNOFELRILMLII-IPJUCJBFSA-N	0	3	342.458	3.171	20	30		EGEDHN
C#CCN(C[C@H](C)c1ccc(S(C)(=O)=O)cc1)C1CCCCC1	ZINC000823423408	1320178173	/nfs/dbraw/zinc/17/81/73/1320178173.db2.gz	HYVYAEOWFUFEPG-INIZCTEOSA-N	0	3	333.497	3.462	20	30		EGEDHN
CN(C)[C@@H]1Cc2ccccc2N(C(=O)CC2(C#N)CCCCC2)C1	ZINC000826985462	1320418274	/nfs/dbraw/zinc/41/82/74/1320418274.db2.gz	HMEKPYZTXGVDDQ-QGZVFWFLSA-N	0	3	325.456	3.370	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N[C@@H](C)c1csc2ccccc21	ZINC000836288492	1320469512	/nfs/dbraw/zinc/46/95/12/1320469512.db2.gz	WUJVQTPYJYNWET-AWEZNQCLSA-N	0	3	329.469	3.217	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N(C)C1c2ccccc2-c2ccccc21	ZINC000838623275	1320796113	/nfs/dbraw/zinc/79/61/13/1320796113.db2.gz	YIKQEBKTPUFCCB-UHFFFAOYSA-N	0	3	347.462	3.353	20	30		EGEDHN
C#Cc1cccc(CNC(=O)N(CCN(C)C)Cc2cccs2)c1	ZINC000838724076	1320808537	/nfs/dbraw/zinc/80/85/37/1320808537.db2.gz	NHMFLNJNCZVIHS-UHFFFAOYSA-N	0	3	341.480	3.003	20	30		EGEDHN
Cc1ccc([C@@H](C)N[C@H]2CCN(c3sccc3C#N)C2=O)s1	ZINC000839553422	1320936881	/nfs/dbraw/zinc/93/68/81/1320936881.db2.gz	QBICDBCQGSCCHW-YPMHNXCESA-N	0	3	331.466	3.446	20	30		EGEDHN
C[C@@H](NC(=O)c1ccccc1)C(=O)C(C#N)c1nc(C2CC2)cs1	ZINC000842940205	1321451361	/nfs/dbraw/zinc/45/13/61/1321451361.db2.gz	YSBVMALSORQTAX-RISCZKNCSA-N	0	3	339.420	3.015	20	30		EGEDHN
C#CCOc1ccc([C@H](C)N[C@H]2CCc3ccccc3NC2=O)cc1	ZINC000848557311	1321976019	/nfs/dbraw/zinc/97/60/19/1321976019.db2.gz	DTUOCNRQWRKXEY-YWZLYKJASA-N	0	3	334.419	3.303	20	30		EGEDHN
C=CCOc1cccc(CNCc2ccccc2CC(=O)OC)c1	ZINC000848578480	1321979962	/nfs/dbraw/zinc/97/99/62/1321979962.db2.gz	DQKLAWOAGZKERG-UHFFFAOYSA-N	0	3	325.408	3.257	20	30		EGEDHN
CCN(CCO)c1ccc(C=NN[C@H](C)c2ccccc2)c(C)c1	ZINC000920385868	1322171286	/nfs/dbraw/zinc/17/12/86/1322171286.db2.gz	JANJYRRBDKNIJR-QGZVFWFLSA-N	0	3	325.456	3.498	20	30		EGEDHN
CN(CC(=O)C(C#N)c1nc2ccccc2s1)Cc1cscn1	ZINC000920416088	1322174311	/nfs/dbraw/zinc/17/43/11/1322174311.db2.gz	RDYLCGRTRJHAAP-LBPRGKRZSA-N	0	3	342.449	3.061	20	30		EGEDHN
C#CCOc1ccc(CNCc2ccc(O[C@H](C)COC)cc2)cc1	ZINC000850315807	1322226450	/nfs/dbraw/zinc/22/64/50/1322226450.db2.gz	NTXBFJGAOSZQAN-QGZVFWFLSA-N	0	3	339.435	3.402	20	30		EGEDHN
N#Cc1ccc(Br)c(CNCCCc2nccs2)c1	ZINC000921761456	1322394434	/nfs/dbraw/zinc/39/44/34/1322394434.db2.gz	XKGNIBYJSKCCER-UHFFFAOYSA-N	0	3	336.258	3.500	20	30		EGEDHN
CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)N1CCC[C@@H](C#N)C1	ZINC000922021178	1322441166	/nfs/dbraw/zinc/44/11/66/1322441166.db2.gz	MSGAGIPSUAFJLM-OALUTQOASA-N	0	3	342.487	3.088	20	30		EGEDHN
CC#CCCN1CC[C@@H](C(F)(F)F)[C@@H](CNC(=O)OC(C)(C)C)C1	ZINC000859605359	1329032929	/nfs/dbraw/zinc/03/29/29/1329032929.db2.gz	CFCYJRQWJAJLMZ-UONOGXRCSA-N	0	3	348.409	3.425	20	30		EGEDHN
C#C[C@](C)(CC)NCC(=O)N1CCC[C@@H]1c1ccc(OCC)cc1	ZINC000852099873	1323146535	/nfs/dbraw/zinc/14/65/35/1323146535.db2.gz	CFBYJSMKKVWVTE-UYAOXDASSA-N	0	3	328.456	3.140	20	30		EGEDHN
CN(C(=O)CC1CC1)C1CCC(NCc2ccccc2C#N)CC1	ZINC000962995740	1323182272	/nfs/dbraw/zinc/18/22/72/1323182272.db2.gz	YXGVWATZWYCBJF-UHFFFAOYSA-N	0	3	325.456	3.218	20	30		EGEDHN
CC(=O)N1CCC[C@@H]([C@@H]2CCCN2CC#Cc2cccc(Cl)c2)C1	ZINC000963209277	1323236741	/nfs/dbraw/zinc/23/67/41/1323236741.db2.gz	PMAKTKUUVCMQGB-QUCCMNQESA-N	0	3	344.886	3.414	20	30		EGEDHN
C=C(C)C[N@@H+]1CCC[C@H]1[C@@H]1CCCN(C(=O)c2ccccc2[O-])C1	ZINC000963248524	1323259670	/nfs/dbraw/zinc/25/96/70/1323259670.db2.gz	CJWMXCIMTODPRX-AEFFLSMTSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=C(C)C[N@H+]1CCC[C@H]1[C@@H]1CCCN(C(=O)c2ccccc2[O-])C1	ZINC000963248524	1323259680	/nfs/dbraw/zinc/25/96/80/1323259680.db2.gz	CJWMXCIMTODPRX-AEFFLSMTSA-N	0	3	328.456	3.285	20	30		EGEDHN
CN(C(=O)[C@@H]1CC1(C)C)C1CCC(NCc2ccccc2C#N)CC1	ZINC000963252203	1323263518	/nfs/dbraw/zinc/26/35/18/1323263518.db2.gz	RUURXXGEAYLYPI-ACBHZAAOSA-N	0	3	339.483	3.464	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccc(OC(C)C)nc1	ZINC001024467811	1323423463	/nfs/dbraw/zinc/42/34/63/1323423463.db2.gz	HMSJKSGKEAIPNI-KRWDZBQOSA-N	0	3	331.460	3.029	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccnc(-n2cccc2)c1	ZINC001024495124	1323444163	/nfs/dbraw/zinc/44/41/63/1323444163.db2.gz	FAEZZHVHBGVFOA-GOSISDBHSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC001024507829	1323455289	/nfs/dbraw/zinc/45/52/89/1323455289.db2.gz	ZAGUCBDHDJXCAQ-QUCCMNQESA-N	0	3	341.499	3.060	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cnoc1-c1ccco1	ZINC001024511670	1323461545	/nfs/dbraw/zinc/46/15/45/1323461545.db2.gz	JNUYDMIZQGBTRI-AWEZNQCLSA-N	0	3	329.400	3.095	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cnn(-c2ccccc2)c1	ZINC001024540850	1323481793	/nfs/dbraw/zinc/48/17/93/1323481793.db2.gz	OMWWLIVZRCGKMR-LJQANCHMSA-N	0	3	338.455	3.033	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccc(C)c2cccnc12	ZINC001024560338	1323501038	/nfs/dbraw/zinc/50/10/38/1323501038.db2.gz	DOWDSRDETGRAQE-KRWDZBQOSA-N	0	3	335.451	3.151	20	30		EGEDHN
C=CCCN1CCCC[C@H]1CNC(=O)c1cc2c(C)nn(C)c2s1	ZINC001024577308	1323512926	/nfs/dbraw/zinc/51/29/26/1323512926.db2.gz	AQWJPIGLXWNMIC-AWEZNQCLSA-N	0	3	346.500	3.104	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cc2ccc(OC)cc2[nH]1	ZINC001024593993	1323527667	/nfs/dbraw/zinc/52/76/67/1323527667.db2.gz	WXTDLPYHAQUYSY-INIZCTEOSA-N	0	3	341.455	3.337	20	30		EGEDHN
C=CCCN1CCCC[C@@H]1CNC(=O)c1cnc([C@@H]2CCCO2)s1	ZINC001024695519	1323610773	/nfs/dbraw/zinc/61/07/73/1323610773.db2.gz	AIXIMSYJRXITTB-CABCVRRESA-N	0	3	349.500	3.155	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cc(C)cc2c[nH]nc21	ZINC001024706215	1323617576	/nfs/dbraw/zinc/61/75/76/1323617576.db2.gz	VYUXATNDPNOCDP-INIZCTEOSA-N	0	3	326.444	3.032	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1csc(C(C)(C)C)n1	ZINC001024710799	1323617912	/nfs/dbraw/zinc/61/79/12/1323617912.db2.gz	ZGZWQAFHHGGAPU-AWEZNQCLSA-N	0	3	333.501	3.048	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccc(OC)c(C2CC2)c1	ZINC001024732075	1323632511	/nfs/dbraw/zinc/63/25/11/1323632511.db2.gz	PQKMRQAUDALCSB-GOSISDBHSA-N	0	3	340.467	3.180	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccccc1C(F)(F)F	ZINC001024774603	1323673753	/nfs/dbraw/zinc/67/37/53/1323673753.db2.gz	RXDKCLSFKGVFIH-CQSZACIVSA-N	0	3	338.373	3.313	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccc(N(CC)CC)cc1	ZINC001024777237	1323678568	/nfs/dbraw/zinc/67/85/68/1323678568.db2.gz	HEKYQXGLPUEBSG-FQEVSTJZSA-N	0	3	341.499	3.140	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cc(OC)c(C)c(OC)c1	ZINC001024790237	1323694058	/nfs/dbraw/zinc/69/40/58/1323694058.db2.gz	DQMMJUGBSWJNAK-KRWDZBQOSA-N	0	3	346.471	3.173	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@H]1CNCc1c(C)noc1CC	ZINC001025041197	1323842876	/nfs/dbraw/zinc/84/28/76/1323842876.db2.gz	VTLYJGGWOATCPM-HNNXBMFYSA-N	0	3	333.476	3.228	20	30		EGEDHN
Cc1coc(C(=O)N2CCCC[C@@H]2CNCc2ccc(C#N)s2)c1	ZINC001025052793	1323856972	/nfs/dbraw/zinc/85/69/72/1323856972.db2.gz	YQBYQNDIIOJLDS-CQSZACIVSA-N	0	3	343.452	3.306	20	30		EGEDHN
COc1ccc(C#N)cc1CNC[C@@H]1CCCCN1C(=O)C(C)(C)C	ZINC001025145442	1323921735	/nfs/dbraw/zinc/92/17/35/1323921735.db2.gz	JWXMUBKYARMXAR-KRWDZBQOSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=CCC[N@H+]1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccccc1[O-]	ZINC001025202261	1323988226	/nfs/dbraw/zinc/98/82/26/1323988226.db2.gz	WHLBVEDBJWCIQI-QZTJIDSGSA-N	0	3	328.456	3.427	20	30		EGEDHN
C=CCC[N@@H+]1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccccc1[O-]	ZINC001025202261	1323988230	/nfs/dbraw/zinc/98/82/30/1323988230.db2.gz	WHLBVEDBJWCIQI-QZTJIDSGSA-N	0	3	328.456	3.427	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ncccc1CC	ZINC001025243665	1324040497	/nfs/dbraw/zinc/04/04/97/1324040497.db2.gz	DDTUMJXLJGBEKH-RBUKOAKNSA-N	0	3	339.483	3.126	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1c(C)oc(C)c1C	ZINC001025250408	1324051643	/nfs/dbraw/zinc/05/16/43/1324051643.db2.gz	JXZLILJTBYRWDE-MSOLQXFVSA-N	0	3	328.456	3.297	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1occ2c1CCC2	ZINC001025255946	1324062675	/nfs/dbraw/zinc/06/26/75/1324062675.db2.gz	UBUYRYQULFTJRN-RTBURBONSA-N	0	3	340.467	3.251	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc2ccsc2[nH]1	ZINC001025256689	1324064285	/nfs/dbraw/zinc/06/42/85/1324064285.db2.gz	ZIOPPCIZRKOUQL-IAGOWNOFSA-N	0	3	341.480	3.322	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc2ccccc2n1C	ZINC001025261900	1324073845	/nfs/dbraw/zinc/07/38/45/1324073845.db2.gz	ZAHHOYLNQJJZNK-WOJBJXKFSA-N	0	3	349.478	3.271	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)Cc1cccc(Cl)c1	ZINC001025263242	1324073988	/nfs/dbraw/zinc/07/39/88/1324073988.db2.gz	JROYBMYCNOISMW-RTBURBONSA-N	0	3	344.886	3.361	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc(C)c(F)c1F	ZINC001025269506	1324082345	/nfs/dbraw/zinc/08/23/45/1324082345.db2.gz	RQXIXPJYWHCSQU-DLBZAZTESA-N	0	3	346.421	3.366	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccn(C)c1CC	ZINC001025269096	1324082374	/nfs/dbraw/zinc/08/23/74/1324082374.db2.gz	KVNKBWPGNRBUKA-VQTJNVASSA-N	0	3	341.499	3.070	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc(OC)c(C)c1	ZINC001025278088	1324099210	/nfs/dbraw/zinc/09/92/10/1324099210.db2.gz	QTWRSASBQFYCII-RBUKOAKNSA-N	0	3	340.467	3.096	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc2cccnc2c1	ZINC001025278764	1324100768	/nfs/dbraw/zinc/10/07/68/1324100768.db2.gz	VGJNDMCIEPNMCF-LEWJYISDSA-N	0	3	347.462	3.327	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc(Cl)cn1	ZINC001025292465	1324118467	/nfs/dbraw/zinc/11/84/67/1324118467.db2.gz	JCAWEXQLVGFPRD-IRXDYDNUSA-N	0	3	333.863	3.380	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ncccc1Cl	ZINC001025293043	1324119657	/nfs/dbraw/zinc/11/96/57/1324119657.db2.gz	OYNWWYDVJADQAX-HOTGVXAUSA-N	0	3	333.863	3.380	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ncccc1Cl	ZINC001025293591	1324120418	/nfs/dbraw/zinc/12/04/18/1324120418.db2.gz	SAWGEMMZSFCYOQ-IAGOWNOFSA-N	0	3	345.874	3.217	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)CCc1cccs1	ZINC001025293561	1324120850	/nfs/dbraw/zinc/12/08/50/1324120850.db2.gz	DOMASLRPNOLPOC-ZWKOTPCHSA-N	0	3	330.497	3.159	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(F)cc(F)c1	ZINC001025296796	1324127918	/nfs/dbraw/zinc/12/79/18/1324127918.db2.gz	LLMWGYUTZGAQFZ-ZWKOTPCHSA-N	0	3	332.394	3.057	20	30		EGEDHN
C[C@@H](NC(=O)c1ccoc1)[C@H]1CCCN(Cc2ccc(C#N)cc2)C1	ZINC001025347072	1324193134	/nfs/dbraw/zinc/19/31/34/1324193134.db2.gz	XFGXFYRWNCPJTE-QAPCUYQASA-N	0	3	337.423	3.182	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(CC(C)C)s2)C1	ZINC001025441686	1324281729	/nfs/dbraw/zinc/28/17/29/1324281729.db2.gz	GVXRWRUDZXBYQD-HZPDHXFCSA-N	0	3	332.513	3.410	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccnc3ccccc32)C1	ZINC001025480644	1324327283	/nfs/dbraw/zinc/32/72/83/1324327283.db2.gz	YTWPONWFXKLJKK-IRXDYDNUSA-N	0	3	335.451	3.088	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(C)nc2C2CC2)C1	ZINC001025494608	1324346282	/nfs/dbraw/zinc/34/62/82/1324346282.db2.gz	ZBSQCJUGFHEUQG-AEFFLSMTSA-N	0	3	339.483	3.121	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(C(C)C)nc2CC)C1	ZINC001025530613	1324376710	/nfs/dbraw/zinc/37/67/10/1324376710.db2.gz	JUXFNESPHVHVMZ-IAGOWNOFSA-N	0	3	341.499	3.231	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(Cl)c(F)c2)C1	ZINC001025544487	1324391519	/nfs/dbraw/zinc/39/15/19/1324391519.db2.gz	WDCUWYNWTGNJRH-ZFWWWQNUSA-N	0	3	336.838	3.333	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2csc(C(C)(C)C)n2)C1	ZINC001025560263	1324407053	/nfs/dbraw/zinc/40/70/53/1324407053.db2.gz	CAXIQRHCAQEEQI-HUUCEWRRSA-N	0	3	347.528	3.294	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2csc(C(C)(C)C)n2)C1	ZINC001025560264	1324407511	/nfs/dbraw/zinc/40/75/11/1324407511.db2.gz	CAXIQRHCAQEEQI-LSDHHAIUSA-N	0	3	347.528	3.294	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2sccc2C(F)F)C1	ZINC001025605996	1324453918	/nfs/dbraw/zinc/45/39/18/1324453918.db2.gz	KMKWXSYSENVCHU-NWDGAFQWSA-N	0	3	326.412	3.149	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(Cl)cc2Cl)C1	ZINC001025608898	1324460587	/nfs/dbraw/zinc/46/05/87/1324460587.db2.gz	MIUKBRRLXRQJLU-CHWSQXEVSA-N	0	3	339.266	3.457	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2sc(CCC)nc2C)C1	ZINC001025618662	1324470667	/nfs/dbraw/zinc/47/06/67/1324470667.db2.gz	DOPHCWDCZREAGI-GDBMZVCRSA-N	0	3	347.528	3.258	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(F)c3occc32)C1	ZINC001025623579	1324473198	/nfs/dbraw/zinc/47/31/98/1324473198.db2.gz	FRHMJWKBIOFZTM-LSDHHAIUSA-N	0	3	342.414	3.426	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2coc(C3CCCCC3)n2)C1	ZINC001025633021	1324484704	/nfs/dbraw/zinc/48/47/04/1324484704.db2.gz	RSHMTSMFYRUACT-WBVHZDCISA-N	0	3	343.471	3.186	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H]3CC[C@@H](NCc4cc(C)no4)[C@@H]3C2)CC1	ZINC001026347787	1324743055	/nfs/dbraw/zinc/74/30/55/1324743055.db2.gz	IILPLUXGXFPOHT-QXAKKESOSA-N	0	3	343.471	3.056	20	30		EGEDHN
CCC1(C(=O)N2C[C@@H]3CC[C@@H](NCc4ccccc4C#N)[C@@H]3C2)CC1	ZINC001026353508	1324747050	/nfs/dbraw/zinc/74/70/50/1324747050.db2.gz	GJCKIJYHEAJNJK-IPMKNSEASA-N	0	3	337.467	3.075	20	30		EGEDHN
N#Cc1ccccc1CNC1CCC(NC(=O)C2CC(F)(F)C2)CC1	ZINC001026474401	1324833302	/nfs/dbraw/zinc/83/33/02/1324833302.db2.gz	ZSCBYXNPQLNZEX-UHFFFAOYSA-N	0	3	347.409	3.121	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)[C@@H]2CC23CCC3)CC1	ZINC001026569339	1324902738	/nfs/dbraw/zinc/90/27/38/1324902738.db2.gz	PSWKVCVSVYPZKS-RUXDESIVSA-N	0	3	341.293	3.102	20	30		EGEDHN
CC(C)(C)C(=O)NC1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001026596947	1324921734	/nfs/dbraw/zinc/92/17/34/1324921734.db2.gz	QGFANVFMUQNRNU-UHFFFAOYSA-N	0	3	331.435	3.260	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@@H]1CCN(C(=O)c2ccsc2)C1	ZINC001026670322	1324964179	/nfs/dbraw/zinc/96/41/79/1324964179.db2.gz	VSYYKFBVKIMKRK-ZDUSSCGKSA-N	0	3	343.427	3.011	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC[C@H](CNCc2cc(Cl)sc2Cl)C1	ZINC001026732519	1324995595	/nfs/dbraw/zinc/99/55/95/1324995595.db2.gz	KDMRRWFMHVTOGD-NXEZZACHSA-N	0	3	346.283	3.153	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)C2CC(F)(F)C2)C1	ZINC000963281255	1325061116	/nfs/dbraw/zinc/06/11/16/1325061116.db2.gz	HOAQJSWMZWMFRL-UKRRQHHQSA-N	0	3	346.849	3.487	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](CNCc2oc(CC)nc2C)C1	ZINC001026989130	1325127977	/nfs/dbraw/zinc/12/79/77/1325127977.db2.gz	XULBXOPGTZAMED-OAHLLOKOSA-N	0	3	333.476	3.086	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)c2c[nH]cc2C)C1	ZINC000963411938	1325216606	/nfs/dbraw/zinc/21/66/06/1325216606.db2.gz	AWYNAGGPXGJBPJ-NVXWUHKLSA-N	0	3	335.879	3.392	20	30		EGEDHN
C[C@H]1[C@@H](NC(=O)c2cc(C#N)ccc2F)CCN1Cc1ccccc1	ZINC000854483810	1325265233	/nfs/dbraw/zinc/26/52/33/1325265233.db2.gz	JCFLIHQYFBFTPP-LIRRHRJNSA-N	0	3	337.398	3.090	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)/C=C\c2ccco2)C1	ZINC001027275551	1325388481	/nfs/dbraw/zinc/38/84/81/1325388481.db2.gz	SJUARMYOQRKENC-OEIFXAAASA-N	0	3	349.434	3.287	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)Cc1ccc(C)cc1)C2	ZINC000964248858	1325490810	/nfs/dbraw/zinc/49/08/10/1325490810.db2.gz	HBOKJHGFYFLWCM-UHFFFAOYSA-N	0	3	332.875	3.307	20	30		EGEDHN
CC(C)Oc1cccc(CN(C)[C@@H]2CCCN(C(=O)[C@@H](C)C#N)C2)c1	ZINC001027337180	1325496283	/nfs/dbraw/zinc/49/62/83/1325496283.db2.gz	ZMCXHVCSNZURSU-FUHWJXTLSA-N	0	3	343.471	3.056	20	30		EGEDHN
C=C1CCC(C(=O)NC2CC3(CC(NCc4cnc(C)o4)C3)C2)CC1	ZINC000964878965	1327746184	/nfs/dbraw/zinc/74/61/84/1327746184.db2.gz	ACDSSWCVWNFJJO-UHFFFAOYSA-N	0	3	343.471	3.246	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)CCc2ccc(C(C)C)cc2)C1	ZINC001027489308	1327747778	/nfs/dbraw/zinc/74/77/78/1327747778.db2.gz	AMSFBXKTKNFWSU-FQEVSTJZSA-N	0	3	326.484	3.299	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)[C@@]2(C)C=CCC2)C1	ZINC001027531258	1327813449	/nfs/dbraw/zinc/81/34/49/1327813449.db2.gz	HLCOAAILQCDELV-FPOVZHCZSA-N	0	3	337.467	3.337	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)[C@H]2C[C@H]3C[C@H]3C2)C1	ZINC001027537792	1327833956	/nfs/dbraw/zinc/83/39/56/1327833956.db2.gz	QIHLHPPRXPLKNA-FUMNGEBKSA-N	0	3	337.467	3.027	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2ccc(Cl)s2)C1	ZINC001027546278	1327851345	/nfs/dbraw/zinc/85/13/45/1327851345.db2.gz	KOHHROSCXXXKHS-MGPQQGTHSA-N	0	3	336.888	3.061	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H](N(C)Cc3ccc(C#N)cc3)C2)C1	ZINC001027567558	1327895681	/nfs/dbraw/zinc/89/56/81/1327895681.db2.gz	XVCJDWNGHOUSNW-LJQANCHMSA-N	0	3	337.467	3.337	20	30		EGEDHN
C[C@H]1C[C@@H]([NH2+]CCNc2ccc(C#N)cn2)c2c1c(F)ccc2[O-]	ZINC000927164833	1327902479	/nfs/dbraw/zinc/90/24/79/1327902479.db2.gz	PIETXEALHWWQFF-SMDDNHRTSA-N	0	3	326.375	3.048	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)c2c(Cl)cccc2Cl)C1	ZINC001027661014	1328049144	/nfs/dbraw/zinc/04/91/44/1328049144.db2.gz	YJXZWEITNANNIH-GFCCVEGCSA-N	0	3	325.239	3.163	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)C(CC)(CC)c2ccccc2)C1	ZINC001027690456	1328094513	/nfs/dbraw/zinc/09/45/13/1328094513.db2.gz	GYDGCHDUYCSLMO-LJQANCHMSA-N	0	3	326.484	3.300	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)[C@H](CC)c2ccc(Cl)cc2)C1	ZINC001027690552	1328095449	/nfs/dbraw/zinc/09/54/49/1328095449.db2.gz	OWRAIDTVXDIURE-ZWKOTPCHSA-N	0	3	332.875	3.390	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)C2(C(F)(F)F)CCCCC2)C1	ZINC001027702162	1328116978	/nfs/dbraw/zinc/11/69/78/1328116978.db2.gz	WAORUWWFZXKDDZ-CQSZACIVSA-N	0	3	330.394	3.055	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2conc2C2CCCC2)C1	ZINC000966672415	1328374876	/nfs/dbraw/zinc/37/48/76/1328374876.db2.gz	WRFYJOUWEKIZTN-YOEHRIQHSA-N	0	3	331.460	3.349	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccccc2C(C)(C)C)C1	ZINC000966892683	1328457288	/nfs/dbraw/zinc/45/72/88/1328457288.db2.gz	PSFBLOLUOPRDRT-LPHOPBHVSA-N	0	3	326.484	3.448	20	30		EGEDHN
C#CCCN1CCC[C@@H]1CNC(=O)c1cc2c(o1)c(F)ccc2C	ZINC001028043102	1328507738	/nfs/dbraw/zinc/50/77/38/1328507738.db2.gz	GLTQLFJVAHIOMM-CQSZACIVSA-N	0	3	328.387	3.098	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC2(C1)CCN(Cc1cnccc1C)CC2	ZINC001050618138	1348304351	/nfs/dbraw/zinc/30/43/51/1348304351.db2.gz	RJVBJHFMVZHMQW-UHFFFAOYSA-N	0	3	327.472	3.027	20	30		EGEDHN
COc1ccc([C@@H](CN(C)C)NC(=O)Nc2sccc2C#N)cc1	ZINC000931839868	1329765515	/nfs/dbraw/zinc/76/55/15/1329765515.db2.gz	XESZNOFTQWMFNR-OAHLLOKOSA-N	0	3	344.440	3.053	20	30		EGEDHN
CC(C)(C)OC(=O)NCC[C@H]1CCN(Cc2ccccc2C#N)C1	ZINC000932697606	1329834538	/nfs/dbraw/zinc/83/45/38/1329834538.db2.gz	TUDADQAVLNZTTR-HNNXBMFYSA-N	0	3	329.444	3.295	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cccc(-c3ccon3)c2)CC1	ZINC000933794649	1329924386	/nfs/dbraw/zinc/92/43/86/1329924386.db2.gz	PSFJCPOHYOPORA-UHFFFAOYSA-N	0	3	326.400	3.114	20	30		EGEDHN
CSCC(C)(C)NCC(=O)N(CCC#N)c1cc(C)cc(C)c1	ZINC000934677634	1329999093	/nfs/dbraw/zinc/99/90/93/1329999093.db2.gz	NUNSACGSEMXKGV-UHFFFAOYSA-N	0	3	333.501	3.281	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2(F)CCCCC2)C[C@H]1NCc1ccc(C#N)s1	ZINC000939469723	1330442159	/nfs/dbraw/zinc/44/21/59/1330442159.db2.gz	LKFVMPLRRZVHAN-CZUORRHYSA-N	0	3	349.475	3.229	20	30		EGEDHN
Cc1ccc(C(=O)N2C[C@@H](C)[C@H](NCc3ccc(C#N)s3)C2)cc1	ZINC000939601475	1330466337	/nfs/dbraw/zinc/46/63/37/1330466337.db2.gz	HROCLYKOXFTBAZ-RDTXWAMCSA-N	0	3	339.464	3.179	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3cccc(Cl)c3)CC2)[C@@H](C)C1	ZINC000942107148	1331832890	/nfs/dbraw/zinc/83/28/90/1331832890.db2.gz	UPVLWEZIXMXWFC-YJBOKZPZSA-N	0	3	344.886	3.222	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C3CC3)[nH]c2C2CC2)[C@@H](C)C1	ZINC000942172295	1331858908	/nfs/dbraw/zinc/85/89/08/1331858908.db2.gz	BYMMODSANSUFOJ-KBXCAEBGSA-N	0	3	339.483	3.233	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)cc2)CC[C@@H]1NC(=O)C1(F)CCCC1	ZINC000942194385	1331872940	/nfs/dbraw/zinc/87/29/40/1331872940.db2.gz	ALZRXIKGOMEUGU-QAPCUYQASA-N	0	3	343.446	3.167	20	30		EGEDHN
C[C@H]1CN(Cc2ccc(C#N)cc2)CC[C@@H]1NC(=O)C1(F)CCCC1	ZINC000942194387	1331873531	/nfs/dbraw/zinc/87/35/31/1331873531.db2.gz	ALZRXIKGOMEUGU-YJBOKZPZSA-N	0	3	343.446	3.167	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(OC)c(C(C)C)c2)[C@H](C)C1	ZINC000942301310	1331898590	/nfs/dbraw/zinc/89/85/90/1331898590.db2.gz	FEPOBMPHCVIHLG-VQIMIIECSA-N	0	3	342.483	3.282	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc(CC(C)C)cc2)[C@@H](C)C1	ZINC000942346076	1331908766	/nfs/dbraw/zinc/90/87/66/1331908766.db2.gz	XANJXAALBLXWQL-GHTZIAJQSA-N	0	3	340.511	3.278	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2c(C)occ2C(F)(F)F)[C@@H](C)C1	ZINC000942517575	1331950375	/nfs/dbraw/zinc/95/03/75/1331950375.db2.gz	BOTAGLLNGHGPLZ-FZMZJTMJSA-N	0	3	342.361	3.070	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cnc3ccccc3c2C)[C@H](C)C1	ZINC000942523371	1331954158	/nfs/dbraw/zinc/95/41/58/1331954158.db2.gz	PIWGMIXFBNXLHC-DNVCBOLYSA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3c(cc(C)cc3C)[nH]2)[C@H](C)C1	ZINC000942538622	1331963868	/nfs/dbraw/zinc/96/38/68/1331963868.db2.gz	TUHVGUCCUXVBPK-AEFFLSMTSA-N	0	3	337.467	3.248	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3cccnc3C)C[C@@H]2C)cc1	ZINC000942554164	1331970521	/nfs/dbraw/zinc/97/05/21/1331970521.db2.gz	ZLIITQWVFOLPFU-KKSFZXQISA-N	0	3	347.462	3.012	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3cccnc3C)C[C@@H]2C)C1	ZINC000942603392	1332001276	/nfs/dbraw/zinc/00/12/76/1332001276.db2.gz	WUFWSXKRPIYSRJ-YJBOKZPZSA-N	0	3	327.472	3.073	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnn(C3CCCCC3)c2)[C@H](C)C1	ZINC000944016737	1332308593	/nfs/dbraw/zinc/30/85/93/1332308593.db2.gz	NJNICVPQCQCHOY-QAPCUYQASA-N	0	3	330.476	3.015	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cnn(C(CC)CC)c2C)[C@H](C)C1	ZINC000944033474	1332312306	/nfs/dbraw/zinc/31/23/06/1332312306.db2.gz	MHOXFFIVXBDUKW-DNVCBOLYSA-N	0	3	344.503	3.016	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2[nH]ccc2-c2ccccc2)[C@@H](C)C1	ZINC000944135241	1332333209	/nfs/dbraw/zinc/33/32/09/1332333209.db2.gz	JHXSBCVKOPRKBS-LPHOPBHVSA-N	0	3	335.451	3.145	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccc(Cl)c2Cl)[C@@H](C)C1	ZINC000944303074	1332367155	/nfs/dbraw/zinc/36/71/55/1332367155.db2.gz	AETIIHMUDNLOTR-SWLSCSKDSA-N	0	3	339.266	3.457	20	30		EGEDHN
N#Cc1ccccc1CN1C[C@@H]2CCN(C(=O)c3ccoc3)CC[C@@H]2C1	ZINC000946477564	1332839321	/nfs/dbraw/zinc/83/93/21/1332839321.db2.gz	QJSRXYHIJVVAAC-KDURUIRLSA-N	0	3	349.434	3.135	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CN(Cc3ncc(C)s3)C[C@H]2CC1	ZINC000946714441	1332882497	/nfs/dbraw/zinc/88/24/97/1332882497.db2.gz	VPUDQGHWSKAJKP-IYBDPMFKSA-N	0	3	347.528	3.334	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3cccc(OC)c3)CC[C@@H]2C1	ZINC000946872383	1332920805	/nfs/dbraw/zinc/92/08/05/1332920805.db2.gz	OKPYVBWATLFIBE-CALCHBBNSA-N	0	3	348.874	3.232	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2ccsc2)CCN1Cc1cccc(C#N)c1	ZINC000947000677	1332964106	/nfs/dbraw/zinc/96/41/06/1332964106.db2.gz	JRAFFYPTDXGTGY-KDOFPFPSSA-N	0	3	339.464	3.403	20	30		EGEDHN
Cc1cccnc1C(=O)N[C@@H]1CCN(Cc2ccc(C#N)cc2)[C@H](C)C1	ZINC000947156499	1333027813	/nfs/dbraw/zinc/02/78/13/1333027813.db2.gz	DSVQFTGZMSTYQU-VQIMIIECSA-N	0	3	348.450	3.045	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)C2(C3CC3)CC2)CCN1Cc1ccc(C#N)cc1	ZINC000947425714	1333122551	/nfs/dbraw/zinc/12/25/51/1333122551.db2.gz	KRZIBGDVGVJDPK-BEFAXECRSA-N	0	3	337.467	3.218	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(OC)c(C(C)C)c2)C[C@H]1C	ZINC000947505819	1333149752	/nfs/dbraw/zinc/14/97/52/1333149752.db2.gz	FPVJLEJTVPVGAT-AEFFLSMTSA-N	0	3	342.483	3.425	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2scnc2C2CCCC2)C[C@H]1C	ZINC000947505998	1333149839	/nfs/dbraw/zinc/14/98/39/1333149839.db2.gz	ICACXLSBBPXWHL-ZBFHGGJFSA-N	0	3	345.512	3.407	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2ccc(CC(C)C)cc2)C[C@H]1C	ZINC000947520661	1333155425	/nfs/dbraw/zinc/15/54/25/1333155425.db2.gz	QPHZFPHRZYJOAN-YLJYHZDGSA-N	0	3	326.484	3.030	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(Cc3cnccc3C)[C@H](C)C2)cc1	ZINC000947610771	1333191144	/nfs/dbraw/zinc/19/11/44/1333191144.db2.gz	CLLAVIWFVFHRQE-DYESRHJHSA-N	0	3	347.462	3.154	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(CCc3csc(C)n3)[C@H](C)C2)C1	ZINC000947702744	1333232550	/nfs/dbraw/zinc/23/25/50/1333232550.db2.gz	RUNQKZIBOBPMDZ-ZBFHGGJFSA-N	0	3	347.528	3.319	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccccc2OC2CCC2)C[C@@H]1C	ZINC000947710380	1333236295	/nfs/dbraw/zinc/23/62/95/1333236295.db2.gz	MPBBRRGBEIWMEX-HOTGVXAUSA-N	0	3	328.456	3.387	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C(C)C)nc2CC)C[C@H]1C	ZINC000947725594	1333241142	/nfs/dbraw/zinc/24/11/42/1333241142.db2.gz	BJEAYXMRZXDDCX-IAGOWNOFSA-N	0	3	341.499	3.373	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2ccc(C(C)(C)C)cc2)C[C@H]1C	ZINC000947751267	1333250654	/nfs/dbraw/zinc/25/06/54/1333250654.db2.gz	WPCMEBULZNJANV-VQIMIIECSA-N	0	3	326.484	3.129	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnn(C(CC)CC)c2C)C[C@@H]1C	ZINC000947907722	1333301741	/nfs/dbraw/zinc/30/17/41/1333301741.db2.gz	JPLCBNFSKKLHOH-GOEBONIOSA-N	0	3	332.492	3.321	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C(C)(C)c2ccccc2Cl)C[C@@H]1C	ZINC000947948412	1333315764	/nfs/dbraw/zinc/31/57/64/1333315764.db2.gz	NKAPCTSULDQCOS-GJZGRUSLSA-N	0	3	332.875	3.220	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)CC23CC4CC(CC(C4)C2)C3)C[C@H]1C	ZINC000947966498	1333323599	/nfs/dbraw/zinc/32/35/99/1333323599.db2.gz	BZAWGDHGECXZNN-AGWGEYTISA-N	0	3	328.500	3.195	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(N(CC)CC)cc2)C[C@H]1C	ZINC000947966615	1333324273	/nfs/dbraw/zinc/32/42/73/1333324273.db2.gz	DSQVXALXXSFYGN-IEBWSBKVSA-N	0	3	341.499	3.139	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccsc2C(F)(F)F)C[C@H]1C	ZINC000947975168	1333328522	/nfs/dbraw/zinc/32/85/22/1333328522.db2.gz	KWBWTIPLFREEFO-NEPJUHHUSA-N	0	3	344.402	3.373	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc3c(c2)CCCC3)C[C@@H]1C	ZINC000948015832	1333342027	/nfs/dbraw/zinc/34/20/27/1333342027.db2.gz	IGGPFVDNCQTTMX-LAUBAEHRSA-N	0	3	338.495	3.100	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)CC2C3CC4CC(C3)CC2C4)C[C@H]1C	ZINC000948057744	1333358497	/nfs/dbraw/zinc/35/84/97/1333358497.db2.gz	YXCLHVZRHPLMNN-RJBHSWFSSA-N	0	3	328.500	3.051	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3ccc(C)cc3)CCC2)C[C@H]1C	ZINC000948082560	1333369746	/nfs/dbraw/zinc/36/97/46/1333369746.db2.gz	FHZNQPZMXRBMHX-QUCCMNQESA-N	0	3	338.495	3.409	20	30		EGEDHN
COc1ccc(CN2CCC[C@@H](N(C)C(=O)C(C)C)CC2)cc1C#N	ZINC000948205265	1333422798	/nfs/dbraw/zinc/42/27/98/1333422798.db2.gz	FNVHNVOYNRPUAJ-GOSISDBHSA-N	0	3	343.471	3.036	20	30		EGEDHN
C[C@H](C(=O)N(C)[C@H]1CCCN(Cc2cccc(C#N)c2)CC1)C1CC1	ZINC000948274341	1333456818	/nfs/dbraw/zinc/45/68/18/1333456818.db2.gz	TVXAEMYYDLWNCV-JXFKEZNVSA-N	0	3	339.483	3.417	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2sc(C3CC3)nc2C)CC1	ZINC000948362110	1333494284	/nfs/dbraw/zinc/49/42/84/1333494284.db2.gz	VJHVRIRPJNPINO-INIZCTEOSA-N	0	3	345.512	3.279	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2ccnn2C(CC)CC)CC1	ZINC000948439038	1333525636	/nfs/dbraw/zinc/52/56/36/1333525636.db2.gz	GEKMSNOVEQZNLP-SFHVURJKSA-N	0	3	344.503	3.194	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2ccnn2C(CC)CC)CC1	ZINC000948439037	1333525918	/nfs/dbraw/zinc/52/59/18/1333525918.db2.gz	GEKMSNOVEQZNLP-GOSISDBHSA-N	0	3	344.503	3.194	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2ccc3oc(C)nc3c2)CC1	ZINC000948470763	1333538377	/nfs/dbraw/zinc/53/83/77/1333538377.db2.gz	IJRJXWLYQSXIIZ-KRWDZBQOSA-N	0	3	339.439	3.086	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2cc(C3CC3)[nH]c2C2CC2)CC1	ZINC000948547295	1333568005	/nfs/dbraw/zinc/56/80/05/1333568005.db2.gz	WGGVIBJTRWGNME-QGZVFWFLSA-N	0	3	339.483	3.329	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)C[C@@H]2C[C@H]2Cc2ccccc2)CC1	ZINC000948638507	1333607181	/nfs/dbraw/zinc/60/71/81/1333607181.db2.gz	CEXVCPPOAONWJU-QHAWAJNXSA-N	0	3	338.495	3.201	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2ccc(F)c(F)c2F)CC1	ZINC000948730219	1333650078	/nfs/dbraw/zinc/65/00/78/1333650078.db2.gz	TUMYLEBHXAEFJL-CYBMUJFWSA-N	0	3	338.373	3.054	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2ccccc2-n2cccc2)CC1	ZINC000948743336	1333655452	/nfs/dbraw/zinc/65/54/52/1333655452.db2.gz	RNHVGFHMTXLKPZ-GOSISDBHSA-N	0	3	335.451	3.037	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2ccc(C(C)C)nc2CC)CC1	ZINC000948779528	1333676685	/nfs/dbraw/zinc/67/66/85/1333676685.db2.gz	OMLYSTDLCBUNCG-KRWDZBQOSA-N	0	3	341.499	3.327	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2sccc2OC)C12CCC2	ZINC001078786302	1357082042	/nfs/dbraw/zinc/08/20/42/1357082042.db2.gz	SLYWDASDMHZQKB-OLZOCXBDSA-N	0	3	340.876	3.140	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)[C@H]2CCc3ccccc3C2)CC1	ZINC000948813160	1333694270	/nfs/dbraw/zinc/69/42/70/1333694270.db2.gz	VQCHMOGLWYIZGY-LEWJYISDSA-N	0	3	338.495	3.128	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)[C@@H](C)c2cccc(C)c2)CC1	ZINC000948816905	1333695962	/nfs/dbraw/zinc/69/59/62/1333695962.db2.gz	PKPAJDWCCBTCON-ICSRJNTNSA-N	0	3	326.484	3.435	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@@H]1CNC(=O)c1ccc(C)n1C	ZINC000948889791	1333720725	/nfs/dbraw/zinc/72/07/25/1333720725.db2.gz	GGOPYDFWOPEVKB-FQEVSTJZSA-N	0	3	337.467	3.239	20	30		EGEDHN
N#Cc1ccc(C(=O)NC[C@@H]2c3ccccc3CCN2CCC2CC2)[nH]1	ZINC000948909808	1333729741	/nfs/dbraw/zinc/72/97/41/1333729741.db2.gz	BDQFCQOEMHOQGI-HXUWFJFHSA-N	0	3	348.450	3.016	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@@H]1CNC(=O)c1c(C)ccn1C	ZINC000948910461	1333730462	/nfs/dbraw/zinc/73/04/62/1333730462.db2.gz	SGNSJLVZYNGZNM-IBGZPJMESA-N	0	3	337.467	3.239	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@H]1c2ccccc2CCN1CCC	ZINC000948923610	1333735942	/nfs/dbraw/zinc/73/59/42/1333735942.db2.gz	NJXZKDLMSBKZKG-FQEVSTJZSA-N	0	3	337.467	3.413	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2c3ccccc3CCN2CC2CC2)cc1	ZINC000948947061	1333743859	/nfs/dbraw/zinc/74/38/59/1333743859.db2.gz	UBCCAOZYNCEXHK-JOCHJYFZSA-N	0	3	344.458	3.407	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccccc1CCC)CCO2	ZINC000949135307	1333783144	/nfs/dbraw/zinc/78/31/44/1333783144.db2.gz	KBWCWXRPIGDNTQ-UHFFFAOYSA-N	0	3	342.483	3.132	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)CCC1CCCCC1)CCO2	ZINC000949236345	1333800317	/nfs/dbraw/zinc/80/03/17/1333800317.db2.gz	SOHIOFGLDHEAEN-UHFFFAOYSA-N	0	3	334.504	3.226	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1(C3CCCCC3)CC1)CCO2	ZINC000949236407	1333800446	/nfs/dbraw/zinc/80/04/46/1333800446.db2.gz	WMGSTDKSUGLBCB-UHFFFAOYSA-N	0	3	346.515	3.226	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@@H](C)c1ccccc1)CCO2	ZINC000949239299	1333801460	/nfs/dbraw/zinc/80/14/60/1333801460.db2.gz	JGKWLAFQBUXRIQ-GOSISDBHSA-N	0	3	342.483	3.060	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@@H]3CCC[C@H]4C[C@H]43)CC2)C1	ZINC000949402277	1333838265	/nfs/dbraw/zinc/83/82/65/1333838265.db2.gz	XFKOIFWSMYXASQ-IPMKNSEASA-N	0	3	346.515	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3cc(C)sc3C)CC2)C1	ZINC000949408928	1333839878	/nfs/dbraw/zinc/83/98/78/1333839878.db2.gz	PDMLYQUJYWVZSI-UHFFFAOYSA-N	0	3	348.512	3.248	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@@H]3CC[C@@H]4C[C@@H]4CC3)CC2)C1	ZINC000949423409	1333844559	/nfs/dbraw/zinc/84/45/59/1333844559.db2.gz	AJWVZLPJXJMDQM-LDLYASANSA-N	0	3	346.515	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@@H]3CCCC3(C)C)CC2)C1	ZINC000949444830	1333848740	/nfs/dbraw/zinc/84/87/40/1333848740.db2.gz	NFSPDWSMXMFAHK-KRWDZBQOSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@@H]3CCC[C@H]3CC)CC2)C1	ZINC000949466996	1333855965	/nfs/dbraw/zinc/85/59/65/1333855965.db2.gz	YHNSWWPATFWDCC-RTBURBONSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@H](C)c3ccsc3)CC2)C1	ZINC000949468257	1333856461	/nfs/dbraw/zinc/85/64/61/1333856461.db2.gz	BBKKZQMBNYRRDM-MRXNPFEDSA-N	0	3	348.512	3.121	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)Cc2cccc(C)c2Cl)C1	ZINC000967340514	1335707073	/nfs/dbraw/zinc/70/70/73/1335707073.db2.gz	WOEASKITYHYMIY-RHSMWYFYSA-N	0	3	332.875	3.041	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ncsc2C(F)(F)F)C1	ZINC000967358555	1335713087	/nfs/dbraw/zinc/71/30/87/1335713087.db2.gz	RYCCIZUWLJRNDN-MNOVXSKESA-N	0	3	347.406	3.178	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cc(-c3cccs3)on2)C1	ZINC000967524020	1335767255	/nfs/dbraw/zinc/76/72/55/1335767255.db2.gz	KIZHOIMTWWGTND-HIFRSBDPSA-N	0	3	345.468	3.419	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CN(Cc3ccccc3C)CC[C@H]2C)c1	ZINC000968318398	1335889156	/nfs/dbraw/zinc/88/91/56/1335889156.db2.gz	UQLOYAPVLSIGKS-DYESRHJHSA-N	0	3	347.462	3.012	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2ccc(C)c(OCC)c2)C1	ZINC000968382788	1335912273	/nfs/dbraw/zinc/91/22/73/1335912273.db2.gz	VUVCCCWDWLIJDL-CRAIPNDOSA-N	0	3	330.472	3.410	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CN(Cc3ccccc3C)CC[C@@H]2C)nc1	ZINC000968549915	1335960257	/nfs/dbraw/zinc/96/02/57/1335960257.db2.gz	ZZFSCMWJUKKOTC-LAUBAEHRSA-N	0	3	347.462	3.012	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000968584710	1335974031	/nfs/dbraw/zinc/97/40/31/1335974031.db2.gz	ZWDWRYDUDVTKDW-LPHOPBHVSA-N	0	3	326.484	3.448	20	30		EGEDHN
CC(C)(CC(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C1)C1CC1	ZINC000968589733	1335976532	/nfs/dbraw/zinc/97/65/32/1335976532.db2.gz	GPRORYRBEQQFIL-CQSZACIVSA-N	0	3	331.485	3.137	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)C(C)(C)c2ccc(OC)cc2)C1	ZINC000968665024	1336002092	/nfs/dbraw/zinc/00/20/92/1336002092.db2.gz	LVUJJERDROTULE-VQIMIIECSA-N	0	3	344.499	3.376	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)Cc2cccc(OC(C)C)c2)C1	ZINC000968687980	1336011475	/nfs/dbraw/zinc/01/14/75/1336011475.db2.gz	ITNJPNVBNVEFGV-FXAWDEMLSA-N	0	3	344.499	3.419	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccc(-c3ccccc3)[nH]2)C1	ZINC000968695382	1336015138	/nfs/dbraw/zinc/01/51/38/1336015138.db2.gz	OEXZDSOLMONTDX-JXFKEZNVSA-N	0	3	335.451	3.145	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(CC)c(CC)c2)C1	ZINC000968710450	1336019953	/nfs/dbraw/zinc/01/99/53/1336019953.db2.gz	QRFPHCLHMZDZAI-UZLBHIALSA-N	0	3	326.484	3.275	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccc2oc(C)nc2c1	ZINC000968910520	1336086741	/nfs/dbraw/zinc/08/67/41/1336086741.db2.gz	WPFZFBJYXIGKLB-MRXNPFEDSA-N	0	3	327.428	3.297	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CC[C@@H](NCc2ccc(Cl)s2)C1	ZINC000968920512	1336089455	/nfs/dbraw/zinc/08/94/55/1336089455.db2.gz	SBOMXDGTPRBPFP-CYBMUJFWSA-N	0	3	349.887	3.393	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)[C@H]1CCOc2c(F)cccc21	ZINC000968942220	1336098712	/nfs/dbraw/zinc/09/87/12/1336098712.db2.gz	VEPOMCNXROEVAT-WBVHZDCISA-N	0	3	346.446	3.239	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1nc(Cl)sc1C	ZINC000968944201	1336099286	/nfs/dbraw/zinc/09/92/86/1336099286.db2.gz	HNVXSXXGEHKFJO-LBPRGKRZSA-N	0	3	327.881	3.265	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)C[C@@H]2C[C@H]2C)CCCCC1	ZINC001115710287	1370688711	/nfs/dbraw/zinc/68/87/11/1370688711.db2.gz	HLHBXJBMGLVMBP-OCCSQVGLSA-N	0	3	343.309	3.350	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1ccn(C(C)C)c1C	ZINC000968994619	1336113616	/nfs/dbraw/zinc/11/36/16/1336113616.db2.gz	WGIXICPSGZVNQY-SFHVURJKSA-N	0	3	329.488	3.375	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1c(F)cc(F)cc1F	ZINC000969007365	1336116065	/nfs/dbraw/zinc/11/60/65/1336116065.db2.gz	APOYIPBYDKJWFH-ZDUSSCGKSA-N	0	3	326.362	3.264	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cccnc1C(F)(F)F	ZINC000969046432	1336126466	/nfs/dbraw/zinc/12/64/66/1336126466.db2.gz	KRRQNQRZROWBOB-CYBMUJFWSA-N	0	3	341.377	3.261	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC000969065381	1336136637	/nfs/dbraw/zinc/13/66/37/1336136637.db2.gz	RLZVCAAFVCFGPV-YSIASYRMSA-N	0	3	342.483	3.346	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccc(-c2cn[nH]c2)cc1	ZINC000969072711	1336138156	/nfs/dbraw/zinc/13/81/56/1336138156.db2.gz	QEJRNLDUHLRPND-LJQANCHMSA-N	0	3	338.455	3.237	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cc(-n2cccc2)ccn1	ZINC000969103201	1336143918	/nfs/dbraw/zinc/14/39/18/1336143918.db2.gz	FSODDRMOURVCMD-GOSISDBHSA-N	0	3	338.455	3.033	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1cc(CC(C)C)c[nH]1	ZINC000969118144	1336150347	/nfs/dbraw/zinc/15/03/47/1336150347.db2.gz	GGNRLRGHZYAEHX-GOSISDBHSA-N	0	3	329.488	3.211	20	30		EGEDHN
C#CCCN1CCCCC[C@H]1CNC(=O)c1occ2c1CCCC2	ZINC000969127017	1336152364	/nfs/dbraw/zinc/15/23/64/1336152364.db2.gz	PXLVYEXCXRVBGC-KRWDZBQOSA-N	0	3	328.456	3.156	20	30		EGEDHN
C#CCCN1CCCCC[C@@H]1CNC(=O)c1occ2c1CCCC2	ZINC000969127018	1336152385	/nfs/dbraw/zinc/15/23/85/1336152385.db2.gz	PXLVYEXCXRVBGC-QGZVFWFLSA-N	0	3	328.456	3.156	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cccnc1OC(C)C	ZINC000969173575	1336171426	/nfs/dbraw/zinc/17/14/26/1336171426.db2.gz	NANBABYJRIJMBX-INIZCTEOSA-N	0	3	331.460	3.029	20	30		EGEDHN
C[C@@H](NC(=O)c1cc(C#N)c[nH]1)C1CN(Cc2ccccc2C2CC2)C1	ZINC000969463070	1336214577	/nfs/dbraw/zinc/21/45/77/1336214577.db2.gz	JEMBGRNCDXPJQQ-CQSZACIVSA-N	0	3	348.450	3.014	20	30		EGEDHN
Cc1cc(F)cc(C(=O)N2CC[C@@H](NCc3ccc(C#N)s3)C2)c1	ZINC000970050112	1336273880	/nfs/dbraw/zinc/27/38/80/1336273880.db2.gz	JWEAIHTWMHNDTM-OAHLLOKOSA-N	0	3	343.427	3.072	20	30		EGEDHN
CCCc1occc1C(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C1	ZINC000970475658	1336310130	/nfs/dbraw/zinc/31/01/30/1336310130.db2.gz	TVBXJDXNGBSVQS-CYBMUJFWSA-N	0	3	343.452	3.170	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)c2ccc(O[C@@H](C)CC)cc2)C1	ZINC000970708573	1336334756	/nfs/dbraw/zinc/33/47/56/1336334756.db2.gz	NRARPWHMEOUHFR-JKSUJKDBSA-N	0	3	330.472	3.490	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2c(C)noc2C(F)F)CC1	ZINC001005563457	1336371918	/nfs/dbraw/zinc/37/19/18/1336371918.db2.gz	ASRWAVJLHHCLRA-UHFFFAOYSA-N	0	3	327.375	3.033	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)[C@@H]2CCc3c2cccc3Cl)CC1	ZINC001005723508	1336397275	/nfs/dbraw/zinc/39/72/75/1336397275.db2.gz	RQWQHMOWORFQJX-QGZVFWFLSA-N	0	3	332.875	3.479	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccc(Cl)cc2OC)CC1	ZINC001005897758	1336417872	/nfs/dbraw/zinc/41/78/72/1336417872.db2.gz	QDGYLIBHAHCQCV-UHFFFAOYSA-N	0	3	336.863	3.461	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccoc2Br)CC1	ZINC001006246312	1336475601	/nfs/dbraw/zinc/47/56/01/1336475601.db2.gz	BAQBCGOONRJEDC-UHFFFAOYSA-N	0	3	341.249	3.155	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)[C@@H]2C[C@H]2c2cc(F)ccc2F)CC1	ZINC001006429479	1336504126	/nfs/dbraw/zinc/50/41/26/1336504126.db2.gz	POGSUJHAIZKRDM-DOTOQJQBSA-N	0	3	334.410	3.177	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cc(Cl)cc3c2OCC3)CC1	ZINC001006461260	1336510948	/nfs/dbraw/zinc/51/09/48/1336510948.db2.gz	PZTQZURIGZHKQQ-UHFFFAOYSA-N	0	3	348.874	3.387	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2cc(C)nn2C(CC)CC)C1	ZINC001007722400	1336691197	/nfs/dbraw/zinc/69/11/97/1336691197.db2.gz	HWYDRZXGHYNWOA-INIZCTEOSA-N	0	3	332.492	3.323	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)Cc2ccccc2OC(C)C)C1	ZINC001008864233	1336934381	/nfs/dbraw/zinc/93/43/81/1336934381.db2.gz	UPVWLCYWGDXMCX-SFHVURJKSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2sc(CC3CC3)nc2C)C1	ZINC001008995646	1336954408	/nfs/dbraw/zinc/95/44/08/1336954408.db2.gz	ROSNAAAENZNYLL-OAHLLOKOSA-N	0	3	333.501	3.174	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2coc(-c3ccccc3)n2)C1	ZINC001009256400	1336992435	/nfs/dbraw/zinc/99/24/35/1336992435.db2.gz	ZTTFFNFQPVSPRC-INIZCTEOSA-N	0	3	325.412	3.112	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN([C@H](CC)c3ccccc3)C2)nc1	ZINC001009270849	1336994327	/nfs/dbraw/zinc/99/43/27/1336994327.db2.gz	TYZROJOIKYZTKQ-TZIWHRDSSA-N	0	3	347.462	3.408	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)Cc2ccc(OC(C)C)cc2)C1	ZINC001009604892	1337045171	/nfs/dbraw/zinc/04/51/71/1337045171.db2.gz	ULGRLZDPQVDYSO-SFHVURJKSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CCN(Cc2ccc3cc[nH]c3c2)C1	ZINC001014730568	1337889239	/nfs/dbraw/zinc/88/92/39/1337889239.db2.gz	CUQLQJDGRQHBES-GOSISDBHSA-N	0	3	348.450	3.160	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(Cc3c(C)cccc3C)C2)cc1	ZINC001015481815	1338155326	/nfs/dbraw/zinc/15/53/26/1338155326.db2.gz	IQKBPRRUSDHUCO-HXUWFJFHSA-N	0	3	332.447	3.289	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(CC[C@H]3CCCC3(F)F)C2)C1	ZINC001015677492	1338254142	/nfs/dbraw/zinc/25/41/42/1338254142.db2.gz	WGWNHFMGDAXSOP-CABCVRRESA-N	0	3	326.431	3.359	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)[C@H]2CCCc3ccccc32)CC1	ZINC001016685369	1338689499	/nfs/dbraw/zinc/68/94/99/1338689499.db2.gz	NXWYNTYOJPYKGP-VQTJNVASSA-N	0	3	336.479	3.101	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2ccc(OC)c(C(C)C)c2)CC1	ZINC001016711322	1338699184	/nfs/dbraw/zinc/69/91/84/1338699184.db2.gz	FJDJVTJMWRQWQM-LJQANCHMSA-N	0	3	340.467	3.036	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)[C@H](c2ccccc2)C2CC2)CC1	ZINC001016726033	1338703545	/nfs/dbraw/zinc/70/35/45/1338703545.db2.gz	LKKOOWFCKKTPEV-WOJBJXKFSA-N	0	3	336.479	3.174	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)C(C)(C)c2cccs2)CC1	ZINC001016766203	1338716850	/nfs/dbraw/zinc/71/68/50/1338716850.db2.gz	MCWUCEJVZHMTQQ-OAHLLOKOSA-N	0	3	330.497	3.020	20	30		EGEDHN
C[C@@]1(C(=O)N[C@@H]2CC23CCN(Cc2cccc(C#N)c2)CC3)C=CCC1	ZINC001016776639	1338722249	/nfs/dbraw/zinc/72/22/49/1338722249.db2.gz	ZQCRFCSGOSJCPG-TZIWHRDSSA-N	0	3	349.478	3.385	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(OCC)c(C)c2)CC1	ZINC001016854723	1338748406	/nfs/dbraw/zinc/74/84/06/1338748406.db2.gz	CCLMRAYADYONFJ-IBGZPJMESA-N	0	3	340.467	3.001	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)[C@@H](C)c2cc3ccccc3o2)CC1	ZINC001016921283	1338770326	/nfs/dbraw/zinc/77/03/26/1338770326.db2.gz	PULGPUWUSBBQRF-HNAYVOBHSA-N	0	3	336.435	3.140	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccc3c(c2)CCC=C3)CC1	ZINC001016930614	1338773231	/nfs/dbraw/zinc/77/32/31/1338773231.db2.gz	NEHLFVZINZQZIK-FQEVSTJZSA-N	0	3	334.463	3.254	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)C2CCC(C(F)F)CC2)CC1	ZINC001016956221	1338783981	/nfs/dbraw/zinc/78/39/81/1338783981.db2.gz	SHWUYAZTBMYICN-UYSNPLJNSA-N	0	3	338.442	3.052	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cc3ccccc3n2CC)CC1	ZINC001016983101	1338791781	/nfs/dbraw/zinc/79/17/81/1338791781.db2.gz	OPBSSJKMKRORAH-FQEVSTJZSA-N	0	3	349.478	3.269	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](CN(C)[C@H](C)c2cnc(C)cn2)C1	ZINC001017179162	1338922980	/nfs/dbraw/zinc/92/29/80/1338922980.db2.gz	FEJQELXBMOGOCA-SJORKVTESA-N	0	3	344.503	3.229	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CCC[C@@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001017183113	1338927735	/nfs/dbraw/zinc/92/77/35/1338927735.db2.gz	BIZVISXTEUURER-XJKSGUPXSA-N	0	3	337.464	3.038	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc2cccnc2c1	ZINC001017651809	1339382980	/nfs/dbraw/zinc/38/29/80/1339382980.db2.gz	PLEWPOIFBACTJJ-BGYRXZFFSA-N	0	3	349.478	3.419	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1cc(C)c(Cl)cn1	ZINC001017659662	1339386380	/nfs/dbraw/zinc/38/63/80/1339386380.db2.gz	XPFGTXKVPVFRIU-CALCHBBNSA-N	0	3	347.890	3.227	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccc2cccnc21	ZINC001017782920	1339420005	/nfs/dbraw/zinc/42/00/05/1339420005.db2.gz	SJEPPIDXRJUPBN-KDURUIRLSA-N	0	3	335.451	3.029	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2c(c1)[C@@H](C)CO2	ZINC001017834435	1339428365	/nfs/dbraw/zinc/42/83/65/1339428365.db2.gz	PBOSRULZEFVGNA-RYQLBKOJSA-N	0	3	340.467	3.438	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(OC)cc1C	ZINC001017872704	1339437575	/nfs/dbraw/zinc/43/75/75/1339437575.db2.gz	SFEQIWGZUHYYLZ-CALCHBBNSA-N	0	3	328.456	3.259	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1C[C@H]1c1ccc(C)s1	ZINC001018039467	1339488643	/nfs/dbraw/zinc/48/86/43/1339488643.db2.gz	AWHSUTNWYYJBGV-YYIAUSFCSA-N	0	3	330.497	3.411	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cnn([C@@H](C)CC)c1C	ZINC001018153870	1339516883	/nfs/dbraw/zinc/51/68/83/1339516883.db2.gz	ARDDMQIFIQBDGD-RYQLBKOJSA-N	0	3	344.503	3.418	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CCCN2Cc2ccc(CO)cc2)CC1	ZINC001028118022	1340438694	/nfs/dbraw/zinc/43/86/94/1340438694.db2.gz	VMKXZXSNDIRVEX-HXUWFJFHSA-N	0	3	342.483	3.006	20	30		EGEDHN
C=CCCN1CCC[C@H]1CNC(=O)c1sc(CC2CC2)nc1C	ZINC001028225814	1340492845	/nfs/dbraw/zinc/49/28/45/1340492845.db2.gz	BUDMEQHSUDTSQA-HNNXBMFYSA-N	0	3	333.501	3.174	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1cc(F)c(F)c(F)c1F	ZINC001028277406	1340529862	/nfs/dbraw/zinc/52/98/62/1340529862.db2.gz	WISYBVRYDPFTJS-JTQLQIEISA-N	0	3	330.325	3.013	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1cc(F)c(F)c(F)c1F	ZINC001028277407	1340529904	/nfs/dbraw/zinc/52/99/04/1340529904.db2.gz	WISYBVRYDPFTJS-SNVBAGLBSA-N	0	3	330.325	3.013	20	30		EGEDHN
C#CCCN1CCC[C@@H]1CNC(=O)c1c(Cl)cccc1Cl	ZINC001028283299	1340537509	/nfs/dbraw/zinc/53/75/09/1340537509.db2.gz	CENZGVHBBARYGJ-GFCCVEGCSA-N	0	3	325.239	3.211	20	30		EGEDHN
CC1(C)C(C(=O)NC[C@@H]2CCN(Cc3ccc(C#N)cc3)C2)C1(C)C	ZINC001028468482	1340656519	/nfs/dbraw/zinc/65/65/19/1340656519.db2.gz	WVMDKUVRNPMDSZ-KRWDZBQOSA-N	0	3	339.483	3.179	20	30		EGEDHN
Cc1csc(C(=O)NC[C@@H]2CCN(Cc3cccc(C#N)c3)C2)c1	ZINC001028528994	1340688395	/nfs/dbraw/zinc/68/83/95/1340688395.db2.gz	TWWCFYMGZXZCHF-KRWDZBQOSA-N	0	3	339.464	3.180	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H](CNC(=O)[C@H]3CCCC34CC4)C2)c1	ZINC001028625902	1340730484	/nfs/dbraw/zinc/73/04/84/1340730484.db2.gz	ADFQWNKCMVPOKM-RTBURBONSA-N	0	3	337.467	3.077	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)NC[C@H]2CCN(Cc3cccc(C#N)c3)C2)CC1	ZINC001028938447	1340887630	/nfs/dbraw/zinc/88/76/30/1340887630.db2.gz	PJZMAIITDCVUHL-NSISKUIASA-N	0	3	339.483	3.323	20	30		EGEDHN
CCc1ccc(C(=O)NC[C@@H]2CCN(Cc3ccc(C#N)cc3)C2)cc1	ZINC001028966052	1340894980	/nfs/dbraw/zinc/89/49/80/1340894980.db2.gz	RYGANHLJCPQOJX-FQEVSTJZSA-N	0	3	347.462	3.373	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC([C@H](C)NCc2cc(F)ccc2C#N)CC1	ZINC001029054071	1340920006	/nfs/dbraw/zinc/92/00/06/1340920006.db2.gz	OWWQRTPOOCNZJC-GJZGRUSLSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC([C@@H](C)NCc2ccccc2C#N)CC1	ZINC001029054370	1340920321	/nfs/dbraw/zinc/92/03/21/1340920321.db2.gz	UGEIGFMZLRNLNB-JKSUJKDBSA-N	0	3	327.472	3.321	20	30		EGEDHN
C=C[C@H](C(=O)N1C[C@H]2CC[C@@H](C1)N2C[C@H](CC)OC)c1ccccc1	ZINC001029594651	1341018319	/nfs/dbraw/zinc/01/83/19/1341018319.db2.gz	TUHKFJXKCFKPRP-YRPNKDGESA-N	0	3	342.483	3.056	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@@H](CN(C)Cc2ccc(C#N)s2)C1)C1CCC1	ZINC001029766411	1341066214	/nfs/dbraw/zinc/06/62/14/1341066214.db2.gz	AKLUGNNKMCWGCX-GJZGRUSLSA-N	0	3	345.512	3.336	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCN(C(=O)C2(F)CCCC2)C1	ZINC001029771096	1341069125	/nfs/dbraw/zinc/06/91/25/1341069125.db2.gz	ANMROCFCVSUHDO-CQSZACIVSA-N	0	3	349.475	3.182	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001029801431	1341077319	/nfs/dbraw/zinc/07/73/19/1341077319.db2.gz	MPYKZFPMYOUEAG-AWEZNQCLSA-N	0	3	331.485	3.112	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](CN(C)Cc2cc(F)ccc2OC)C1	ZINC001029804257	1341078531	/nfs/dbraw/zinc/07/85/31/1341078531.db2.gz	UAQDVDDPEOKDCU-OAHLLOKOSA-N	0	3	348.462	3.327	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H](CN(C)Cc2cnc(C)s2)C1	ZINC001029826761	1341088083	/nfs/dbraw/zinc/08/80/83/1341088083.db2.gz	VIWHURQQGQUSCW-QAPCUYQASA-N	0	3	335.517	3.334	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H](CN(C)Cc2c(C)noc2CC)C1	ZINC001029828630	1341088676	/nfs/dbraw/zinc/08/86/76/1341088676.db2.gz	GXWOOGJIMAPESZ-OXQOHEQNSA-N	0	3	347.503	3.428	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](CN(C)Cc3ccccc3F)C2)C1	ZINC001029836557	1341092087	/nfs/dbraw/zinc/09/20/87/1341092087.db2.gz	SILGXQDANKAGLH-INIZCTEOSA-N	0	3	330.447	3.462	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCN(C(=O)[C@@H]2CC23CCC3)C1	ZINC001029856089	1341097185	/nfs/dbraw/zinc/09/71/85/1341097185.db2.gz	XFNXAFPKKRKPIH-PBHICJAKSA-N	0	3	343.496	3.090	20	30		EGEDHN
CCN1CCC[C@@H](N(Cc2ccccc2)C(=O)c2cc(C#N)c[nH]2)C1	ZINC001029918132	1341118189	/nfs/dbraw/zinc/11/81/89/1341118189.db2.gz	XYTOOOWFUDANFW-GOSISDBHSA-N	0	3	336.439	3.013	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)CC1CCN(C(=O)CC2(C)CC2)CC1	ZINC001029978362	1341142070	/nfs/dbraw/zinc/14/20/70/1341142070.db2.gz	XJXOYEWJNONZFD-UHFFFAOYSA-N	0	3	345.512	3.480	20	30		EGEDHN
C=CCOc1ccc(C(=O)NCC2CN(CC3=CCCCC3)C2)cc1	ZINC001031777893	1341400726	/nfs/dbraw/zinc/40/07/26/1341400726.db2.gz	FIIRYWMVMLBPFT-UHFFFAOYSA-N	0	3	340.467	3.413	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cccc2ccc(C)nc21	ZINC001032466929	1341514816	/nfs/dbraw/zinc/51/48/16/1341514816.db2.gz	KYGHLYCUOLGOTH-ROUUACIJSA-N	0	3	335.451	3.408	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C1CCc2ccccc2CC1	ZINC001032487891	1341521667	/nfs/dbraw/zinc/52/16/67/1341521667.db2.gz	JMFKLGJFZDXNPO-SFTDATJTSA-N	0	3	338.495	3.433	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H]1C[C@H]1c1ccccc1OC	ZINC001032671797	1341577492	/nfs/dbraw/zinc/57/74/92/1341577492.db2.gz	DSUBAXGJDKHXRH-PBWTXFEYSA-N	0	3	340.467	3.050	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H]1C[C@H]1c1ccccc1F	ZINC001032671788	1341577561	/nfs/dbraw/zinc/57/75/61/1341577561.db2.gz	DDSUFUGOEMWIQD-UOVPBQLFSA-N	0	3	328.431	3.181	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H](CC)Oc1cccc(C)c1	ZINC001032679218	1341579833	/nfs/dbraw/zinc/57/98/33/1341579833.db2.gz	JECXIBDKNLIVLY-CMKODMSKSA-N	0	3	342.483	3.404	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cc(Cl)ccc1OC	ZINC001032766785	1341607722	/nfs/dbraw/zinc/60/77/22/1341607722.db2.gz	QYJHEUGJBLAOBO-GJZGRUSLSA-N	0	3	334.847	3.214	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N(C)[C@@H]1CCN(Cc2cccc(C)c2)C1	ZINC001033086336	1341719437	/nfs/dbraw/zinc/71/94/37/1341719437.db2.gz	HIWDCLBGWORLMF-AQNXPRMDSA-N	0	3	342.483	3.009	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC001033089773	1341719690	/nfs/dbraw/zinc/71/96/90/1341719690.db2.gz	CRZUKWSZOXYCGZ-CYBMUJFWSA-N	0	3	326.362	3.486	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2cc(C)nn2C(CC)CC)C1	ZINC001033214396	1341754400	/nfs/dbraw/zinc/75/44/00/1341754400.db2.gz	MTQFMXSAGLUCQL-KRWDZBQOSA-N	0	3	332.492	3.275	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@H]2CCN(Cc3cccc(N(C)C)c3)C2)C1	ZINC001033400043	1341814150	/nfs/dbraw/zinc/81/41/50/1341814150.db2.gz	RXUMUIXYXHRUAG-IBGZPJMESA-N	0	3	341.499	3.142	20	30		EGEDHN
C#CCCN1CC[C@H](N(C)C(=O)[C@@H]2C[C@H]2c2cccc3ccccc32)C1	ZINC001033506280	1341851003	/nfs/dbraw/zinc/85/10/03/1341851003.db2.gz	SXNVKVZXSQTYRJ-YUXAGFNASA-N	0	3	346.474	3.499	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)[C@@]2(c3ccccc3)CC2(C)C)C1	ZINC001033523029	1341858141	/nfs/dbraw/zinc/85/81/41/1341858141.db2.gz	VZMDCUNUONFHQH-NQIIRXRSSA-N	0	3	326.484	3.463	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2c[nH]nc2C2CCCCC2)C1	ZINC001033570235	1341878435	/nfs/dbraw/zinc/87/84/35/1341878435.db2.gz	GLBMYBGBBALSSY-INIZCTEOSA-N	0	3	330.476	3.180	20	30		EGEDHN
C#CCCN1CC[C@H](N(C)C(=O)c2cc(Cl)ccc2Cl)C1	ZINC001033608927	1341900309	/nfs/dbraw/zinc/90/03/09/1341900309.db2.gz	BNLZJCAMGIDJLC-ZDUSSCGKSA-N	0	3	325.239	3.163	20	30		EGEDHN
C=C(C)CCN1CC[C@H](N(C)C(=O)c2ccc(P(C)(C)=O)cc2)C1	ZINC001033684804	1341951072	/nfs/dbraw/zinc/95/10/72/1341951072.db2.gz	MDUDOPVFPOPERW-KRWDZBQOSA-N	0	3	348.427	3.047	20	30		EGEDHN
C=CCCN1CC[C@@H](N(C)C(=O)c2sc(C(C)(C)C)nc2C)C1	ZINC001033709209	1341970301	/nfs/dbraw/zinc/97/03/01/1341970301.db2.gz	FDCUSQJYIWCHRC-CQSZACIVSA-N	0	3	335.517	3.471	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2cc(F)cc3ccoc32)C1	ZINC001033879173	1342056543	/nfs/dbraw/zinc/05/65/43/1342056543.db2.gz	WXIGSYLZSFVIEJ-MRXNPFEDSA-N	0	3	328.387	3.132	20	30		EGEDHN
C=CCOc1ccc(C(=O)N(CC)[C@H]2CCN(CCCF)C2)cc1	ZINC001033879937	1342057284	/nfs/dbraw/zinc/05/72/84/1342057284.db2.gz	IEIMIBGACRWQEV-KRWDZBQOSA-N	0	3	334.435	3.147	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2ccc(-n3cccc3)cc2)C1	ZINC001033888561	1342062127	/nfs/dbraw/zinc/06/21/27/1342062127.db2.gz	RWHMYUVQFRIFRO-FQEVSTJZSA-N	0	3	335.451	3.037	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cnn3cccc(Cl)c23)C1	ZINC001033897814	1342069447	/nfs/dbraw/zinc/06/94/47/1342069447.db2.gz	RQZKPSYEAGXBOM-AWEZNQCLSA-N	0	3	346.862	3.100	20	30		EGEDHN
C=CCCN1CC[C@H](N(CC)C(=O)c2cc3ncccc3s2)C1	ZINC001033914425	1342083578	/nfs/dbraw/zinc/08/35/78/1342083578.db2.gz	CKWVTZGYYJYZMX-AWEZNQCLSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cc3ccc(OC)cc3[nH]2)C1	ZINC001033916994	1342085513	/nfs/dbraw/zinc/08/55/13/1342085513.db2.gz	RQJDGONLXYGGQX-MRXNPFEDSA-N	0	3	341.455	3.289	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccc(F)c(COC)c2)C1	ZINC001033946852	1342107504	/nfs/dbraw/zinc/10/75/04/1342107504.db2.gz	JXCPTRVZNQYMNW-KRWDZBQOSA-N	0	3	334.435	3.085	20	30		EGEDHN
C#Cc1cncc(C(=O)N(CC)[C@@H]2CCN(Cc3ccccc3C)C2)c1	ZINC001033955452	1342112084	/nfs/dbraw/zinc/11/20/84/1342112084.db2.gz	LEPXAOWRPSFRQE-OAQYLSRUSA-N	0	3	347.462	3.108	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccc(C3CC3)nc2C)C1	ZINC001033959046	1342112827	/nfs/dbraw/zinc/11/28/27/1342112827.db2.gz	VDALJINZFNOICV-QGZVFWFLSA-N	0	3	327.472	3.380	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccc(C3CC3)nc2C)C1	ZINC001033959043	1342113109	/nfs/dbraw/zinc/11/31/09/1342113109.db2.gz	VDALJINZFNOICV-KRWDZBQOSA-N	0	3	327.472	3.380	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccnc(C(F)(F)F)c2)C1	ZINC001034007287	1342144972	/nfs/dbraw/zinc/14/49/72/1342144972.db2.gz	KGZAFWNLWHBVAK-AWEZNQCLSA-N	0	3	341.377	3.213	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2ccc3[nH]c(C)c(C)c3c2)C1	ZINC001034038265	1342178089	/nfs/dbraw/zinc/17/80/89/1342178089.db2.gz	RVPVAACVWJUCIY-SFHVURJKSA-N	0	3	337.467	3.344	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2ccc(OC3CCC3)cc2)C1	ZINC001034044517	1342185362	/nfs/dbraw/zinc/18/53/62/1342185362.db2.gz	BUWHIKWWPZRXRY-SFHVURJKSA-N	0	3	340.467	3.178	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2ccc(N(C)CCC)cc2)C1	ZINC001034057064	1342197469	/nfs/dbraw/zinc/19/74/69/1342197469.db2.gz	RGPSOUCRHRXCAS-HXUWFJFHSA-N	0	3	341.499	3.093	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cnoc2-c2ccco2)C1	ZINC001034270264	1342360956	/nfs/dbraw/zinc/36/09/56/1342360956.db2.gz	DSHFEKYDCAPTJA-AWEZNQCLSA-N	0	3	329.400	3.095	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cnn3cccc(Cl)c23)C1	ZINC001034298075	1342381330	/nfs/dbraw/zinc/38/13/30/1342381330.db2.gz	AIZAPTNJNDYTQN-AWEZNQCLSA-N	0	3	346.862	3.148	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2cc3c(o2)c(F)ccc3C)C1	ZINC001034323958	1342399639	/nfs/dbraw/zinc/39/96/39/1342399639.db2.gz	RVPDMWOQFYQVOG-HNNXBMFYSA-N	0	3	342.414	3.488	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2F)C1	ZINC001034326029	1342401709	/nfs/dbraw/zinc/40/17/09/1342401709.db2.gz	GVSHGZONKCBIDV-HYVNUMGLSA-N	0	3	334.410	3.225	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ncccc2OCCC)C1	ZINC001034381395	1342450107	/nfs/dbraw/zinc/45/01/07/1342450107.db2.gz	MHRGIBCKYNDCIS-INIZCTEOSA-N	0	3	331.460	3.031	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2cc(F)c(Cl)cc2F)C1	ZINC001034382537	1342451543	/nfs/dbraw/zinc/45/15/43/1342451543.db2.gz	YTKPOYNYRZGXHL-LBPRGKRZSA-N	0	3	340.801	3.226	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cccnc2C(F)(F)F)C1	ZINC001034414356	1342475656	/nfs/dbraw/zinc/47/56/56/1342475656.db2.gz	YPWFDVBZJXUSLI-CYBMUJFWSA-N	0	3	341.377	3.261	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2cc(C(C)(C)C)oc2C)C1	ZINC001034415616	1342477338	/nfs/dbraw/zinc/47/73/38/1342477338.db2.gz	ILEMNNVBXDGQCM-MRXNPFEDSA-N	0	3	330.472	3.493	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCCN(Cc3ccc(C)cc3)C2)nc1	ZINC001034492911	1342549030	/nfs/dbraw/zinc/54/90/30/1342549030.db2.gz	IZJGWXGDAIGNLM-FQEVSTJZSA-N	0	3	347.462	3.156	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)[C@@H]2CCCc3sc(C)nc32)C1	ZINC001034493876	1342550069	/nfs/dbraw/zinc/55/00/69/1342550069.db2.gz	VZMRUFRSHBCVQB-HUUCEWRRSA-N	0	3	333.501	3.028	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC001034502050	1342559920	/nfs/dbraw/zinc/55/99/20/1342559920.db2.gz	CFNLJROFMNWKBR-OAHLLOKOSA-N	0	3	326.362	3.476	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)C(C)(C)c2ccc(OC)cc2)C1	ZINC001034531110	1342587134	/nfs/dbraw/zinc/58/71/34/1342587134.db2.gz	DYBRJCRHHXGEGF-QGZVFWFLSA-N	0	3	330.472	3.130	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)C23CC(C(F)(F)F)(C2)C3)C1	ZINC001034542999	1342603422	/nfs/dbraw/zinc/60/34/22/1342603422.db2.gz	DSNVZEBHZQYDMS-JEYLPNPQSA-N	0	3	330.394	3.266	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)c2ccc(N(C)C(C)C)cc2)C1	ZINC001034550905	1342614262	/nfs/dbraw/zinc/61/42/62/1342614262.db2.gz	AQQHGBZAGJZXQL-SFHVURJKSA-N	0	3	329.488	3.302	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)[C@H]2CC[C@H](C)C2)CC1	ZINC001034750107	1342737423	/nfs/dbraw/zinc/73/74/23/1342737423.db2.gz	YDLHKDSVDIZZME-MXAVVETBSA-N	0	3	343.309	3.348	20	30		EGEDHN
C/C(=C/C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)c(F)c1)C1CC1	ZINC001034873460	1342815826	/nfs/dbraw/zinc/81/58/26/1342815826.db2.gz	IQRMGYAKLJYBFU-GIIHOQTISA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2cc(F)cc(F)c2)C12CCC2	ZINC001078800135	1357091364	/nfs/dbraw/zinc/09/13/64/1357091364.db2.gz	JBVBGNOHELGJGT-HUUCEWRRSA-N	0	3	340.801	3.348	20	30		EGEDHN
CC1(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)c(F)c2)CCCC1	ZINC001035007966	1342873888	/nfs/dbraw/zinc/87/38/88/1342873888.db2.gz	GGJOJJGOWFNCCU-QGZVFWFLSA-N	0	3	343.446	3.358	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)s1)c1ccco1	ZINC001035048692	1342898563	/nfs/dbraw/zinc/89/85/63/1342898563.db2.gz	KJVFGUUXUXVUTQ-UONOGXRCSA-N	0	3	343.452	3.097	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)N1CCC2(CCN(Cc3ccc(C#N)s3)C2)CC1	ZINC001035156159	1342970766	/nfs/dbraw/zinc/97/07/66/1342970766.db2.gz	JIUABBTWRLDEQJ-RHSMWYFYSA-N	0	3	343.496	3.090	20	30		EGEDHN
O=C([C@H]1CC12CC2)N1CCC2(CCN(CC#Cc3ccccc3)C2)CC1	ZINC001035232700	1343054143	/nfs/dbraw/zinc/05/41/43/1343054143.db2.gz	FHIPDEHXYGIDSK-HXUWFJFHSA-N	0	3	348.490	3.153	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C[C@@H]1CCC[C@@H](OC)C1)CC2	ZINC001035722758	1343152516	/nfs/dbraw/zinc/15/25/16/1343152516.db2.gz	OCIQDTOGCADKIQ-QZTJIDSGSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1[nH]nc(C3CC3)c1Cl)CC2	ZINC001035744547	1343164778	/nfs/dbraw/zinc/16/47/78/1343164778.db2.gz	IDOYOPBZZPZFNK-UHFFFAOYSA-N	0	3	348.878	3.055	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cc3ccccc3s1)CC2	ZINC001035744956	1343165709	/nfs/dbraw/zinc/16/57/09/1343165709.db2.gz	XXNBFSJYZCJWLA-UHFFFAOYSA-N	0	3	338.476	3.463	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccc(C)c(Cl)c1)CC2	ZINC001035786068	1343197284	/nfs/dbraw/zinc/19/72/84/1343197284.db2.gz	PCNCUMWXMVUIIU-UHFFFAOYSA-N	0	3	330.859	3.210	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)CCc1ccc(OC)cc1)CC2	ZINC001035849253	1343229036	/nfs/dbraw/zinc/22/90/36/1343229036.db2.gz	VDCMIPIKTCCGSU-UHFFFAOYSA-N	0	3	342.483	3.128	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@H](F)Cc1ccccc1)CC2	ZINC001035854957	1343231881	/nfs/dbraw/zinc/23/18/81/1343231881.db2.gz	BMXVLGUWQOPNSR-GOSISDBHSA-N	0	3	330.447	3.068	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H]1Oc3ccccc3[C@@H]1C)CC2	ZINC001035867158	1343239847	/nfs/dbraw/zinc/23/98/47/1343239847.db2.gz	YDAPPOPDPYYLDO-QFBILLFUSA-N	0	3	340.467	3.052	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccccc2)CC[C@H]1NCc1ccccc1C#N	ZINC001035885940	1343248726	/nfs/dbraw/zinc/24/87/26/1343248726.db2.gz	CXNNCTVLBJWKOV-OXQOHEQNSA-N	0	3	333.435	3.199	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2=CCCC2)CC[C@H]1NCc1cc(F)ccc1C#N	ZINC001035994792	1343305993	/nfs/dbraw/zinc/30/59/93/1343305993.db2.gz	ZDZLKQZTNXFENQ-AUUYWEPGSA-N	0	3	341.430	3.134	20	30		EGEDHN
C[C@H]1CN(C(=O)CC2(C)CC2)CC[C@@H]1NCc1ccccc1C#N	ZINC001036123992	1343317230	/nfs/dbraw/zinc/31/72/30/1343317230.db2.gz	PZZNBOUASLOSHW-YJBOKZPZSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](NCc2ccn(C(C)C)n2)[C@@H](C)C1	ZINC001036133278	1343321034	/nfs/dbraw/zinc/32/10/34/1343321034.db2.gz	AGHPAKKMEMETOX-FUHWJXTLSA-N	0	3	346.519	3.393	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2(C)CCC2)CC[C@@H]1NCc1ccccc1C#N	ZINC001036141224	1343325466	/nfs/dbraw/zinc/32/54/66/1343325466.db2.gz	GRQWVAAXBGBQRJ-QAPCUYQASA-N	0	3	325.456	3.075	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](NCc3nc(C)sc3C)[C@@H](C)C2)C1	ZINC001036171827	1343344243	/nfs/dbraw/zinc/34/42/43/1343344243.db2.gz	ZRDMFWNAQCYISP-BBRMVZONSA-N	0	3	347.528	3.443	20	30		EGEDHN
CCC1(C(=O)N2CC[C@@H](NCc3ccccc3C#N)[C@H](C)C2)CC1	ZINC001036189373	1343353987	/nfs/dbraw/zinc/35/39/87/1343353987.db2.gz	YHQUHDUGURUBCR-CRAIPNDOSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCCN(C(=O)C2CCC2)C1	ZINC001036341707	1343427373	/nfs/dbraw/zinc/42/73/73/1343427373.db2.gz	WBTJZPXXOLDYDK-KXBFYZLASA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCCN(C(=O)CCC2CC2)C1	ZINC001036372363	1343449058	/nfs/dbraw/zinc/44/90/58/1343449058.db2.gz	WXNBTUUVMJFRIT-OXQOHEQNSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCCN(C(=O)C=C2CCC2)C1	ZINC001036380490	1343453439	/nfs/dbraw/zinc/45/34/39/1343453439.db2.gz	CMYYCPOSYBKBNV-UZLBHIALSA-N	0	3	337.467	3.385	20	30		EGEDHN
C[C@H](NCc1c(F)cccc1F)[C@H]1CCCN(C(=O)C#CC2CC2)C1	ZINC001036405037	1343467200	/nfs/dbraw/zinc/46/72/00/1343467200.db2.gz	OOPSREWYCFRNMH-HOCLYGCPSA-N	0	3	346.421	3.095	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]([C@@H](C)NCc2ncc(C)s2)C1	ZINC001036427211	1343480371	/nfs/dbraw/zinc/48/03/71/1343480371.db2.gz	JUEMWGSEKPZOGM-HUUCEWRRSA-N	0	3	335.517	3.380	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]([C@H](C)NCc2cc(OC)no2)C1	ZINC001036435679	1343485587	/nfs/dbraw/zinc/48/55/87/1343485587.db2.gz	AWMWPIHOCMWCPI-LSDHHAIUSA-N	0	3	349.475	3.002	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H]([C@@H](C)NCc2cnc(C)o2)C1	ZINC001036440536	1343489173	/nfs/dbraw/zinc/48/91/73/1343489173.db2.gz	OBQSGKFHOMRHCT-ZBFHGGJFSA-N	0	3	333.476	3.302	20	30		EGEDHN
CCCC(=O)N1CCC[C@@H](C)[C@H]1CNCc1ccc(C#N)cc1F	ZINC001036492082	1343514852	/nfs/dbraw/zinc/51/48/52/1343514852.db2.gz	BMAIQOSVJLITIY-RDTXWAMCSA-N	0	3	331.435	3.214	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)C=C2CCC2)[C@H]1CNCc1ccc(C#N)s1	ZINC001036534612	1343541880	/nfs/dbraw/zinc/54/18/80/1343541880.db2.gz	IYRLINGSAXWYOO-KDOFPFPSSA-N	0	3	343.496	3.447	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC[C@H](C)[C@@H]2CNCc2ccccn2)cc1	ZINC001036567806	1343557374	/nfs/dbraw/zinc/55/73/74/1343557374.db2.gz	MZFWIWGITQXRGE-UWJYYQICSA-N	0	3	347.462	3.093	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CN(C(=O)C4CCCC4)CC[C@H]32)s1	ZINC001036621439	1343580315	/nfs/dbraw/zinc/58/03/15/1343580315.db2.gz	UPQRLACVDVMXHS-CRAIPNDOSA-N	0	3	343.496	3.233	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3CN(C(=O)CC4CCC4)CC[C@H]32)s1	ZINC001036677820	1343618636	/nfs/dbraw/zinc/61/86/36/1343618636.db2.gz	IDNAMIOMRGOQGN-MAUKXSAKSA-N	0	3	343.496	3.233	20	30		EGEDHN
C/C=C(\C)C(=O)N1CC[C@@H]2[C@H](CCN2CC#Cc2ccc(F)cc2)C1	ZINC001036683601	1343626564	/nfs/dbraw/zinc/62/65/64/1343626564.db2.gz	VGCUXRVZLPRAOC-MALATEFESA-N	0	3	340.442	3.066	20	30		EGEDHN
O=C(C1=CCCC1)N1CC[C@H]2[C@@H](CCN2CC#Cc2ccccc2)C1	ZINC001036687162	1343629214	/nfs/dbraw/zinc/62/92/14/1343629214.db2.gz	YDPAUNZTIJWGHE-SFTDATJTSA-N	0	3	334.463	3.071	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CN(C(=O)C=C4CCC4)CC[C@@H]32)s1	ZINC001036689137	1343632375	/nfs/dbraw/zinc/63/23/75/1343632375.db2.gz	CZDVHTLXZDHBOH-QAPCUYQASA-N	0	3	341.480	3.153	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@H]2CN(C(=O)C=C3CCC3)CC[C@H]21	ZINC001036688977	1343632561	/nfs/dbraw/zinc/63/25/61/1343632561.db2.gz	BCBGIGCGFAHMAI-VQTJNVASSA-N	0	3	335.451	3.091	20	30		EGEDHN
CC1(CC(=O)N2CC[C@H]3[C@H](CCN3CC#Cc3ccccc3)C2)CC1	ZINC001036774916	1343702895	/nfs/dbraw/zinc/70/28/95/1343702895.db2.gz	MNVMRHLULDYSAT-UXHICEINSA-N	0	3	336.479	3.151	20	30		EGEDHN
CC1(CC(=O)N2CC[C@H]3[C@@H](CCN3CC#Cc3ccccc3)C2)CC1	ZINC001036774915	1343703051	/nfs/dbraw/zinc/70/30/51/1343703051.db2.gz	MNVMRHLULDYSAT-PMACEKPBSA-N	0	3	336.479	3.151	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2conc2CC)C1	ZINC001036794264	1343726833	/nfs/dbraw/zinc/72/68/33/1343726833.db2.gz	RSTOOXWUAVOKOJ-MAUKXSAKSA-N	0	3	345.487	3.262	20	30		EGEDHN
CCC1(C(=O)N2CC[C@H]3[C@@H](CCN3Cc3ccccc3C#N)C2)CC1	ZINC001036813640	1343749739	/nfs/dbraw/zinc/74/97/39/1343749739.db2.gz	AJLVCORHFWRIEB-OALUTQOASA-N	0	3	337.467	3.171	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@@H]1CCC[C@H]1NC(=O)C1CCCC1	ZINC001036921777	1343865966	/nfs/dbraw/zinc/86/59/66/1343865966.db2.gz	HWUXAKGRERFQRX-QFBILLFUSA-N	0	3	343.446	3.262	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCC[C@H]1NC(=O)c1ccsc1	ZINC001036939113	1343882448	/nfs/dbraw/zinc/88/24/48/1343882448.db2.gz	FRGZQAKQUIJJMN-SJLPKXTDSA-N	0	3	339.464	3.308	20	30		EGEDHN
CC1(C)CC(C(=O)N[C@H]2CCC[C@@H]2CNCc2ccccc2C#N)C1	ZINC001037001889	1343920701	/nfs/dbraw/zinc/92/07/01/1343920701.db2.gz	AENKNNQNXFTZJN-MJGOQNOKSA-N	0	3	339.483	3.369	20	30		EGEDHN
CC(C(=O)N[C@@H]1CCC[C@@H]1CNCc1ccccc1C#N)=C1CCC1	ZINC001037005982	1343925374	/nfs/dbraw/zinc/92/53/74/1343925374.db2.gz	KWVLBVFZYGOJOE-WOJBJXKFSA-N	0	3	337.467	3.433	20	30		EGEDHN
CC1(C(=O)N[C@@H]2CCC[C@H]2CNCc2cc(F)ccc2C#N)CCC1	ZINC001037056248	1343953773	/nfs/dbraw/zinc/95/37/73/1343953773.db2.gz	DETMBTFNVVHXCQ-MAUKXSAKSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCC[C@@H]2CNCc2cc(C)no2)CC1	ZINC001037070741	1343963696	/nfs/dbraw/zinc/96/36/96/1343963696.db2.gz	WDSHVKNDYMCLAT-SJLPKXTDSA-N	0	3	331.460	3.104	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCC[C@@H]2CNCc2nccs2)CC1	ZINC001037070653	1343963940	/nfs/dbraw/zinc/96/39/40/1343963940.db2.gz	VCMTWOMFDJIRQV-HZPDHXFCSA-N	0	3	333.501	3.264	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCC[C@@H]2CNCc2nccs2)CC1	ZINC001037070651	1343963950	/nfs/dbraw/zinc/96/39/50/1343963950.db2.gz	VCMTWOMFDJIRQV-CVEARBPZSA-N	0	3	333.501	3.264	20	30		EGEDHN
CC(C)(F)C(=O)N[C@@H]1CCCC[C@@H]1CNCc1cc(F)ccc1C#N	ZINC001037155426	1344006786	/nfs/dbraw/zinc/00/67/86/1344006786.db2.gz	IQTFSEQKPIXJHZ-RHSMWYFYSA-N	0	3	349.425	3.210	20	30		EGEDHN
CC[C@@H]1CN(C(=O)C2CCC2)CC[C@@H]1NCc1cc(F)ccc1C#N	ZINC001037760974	1344075505	/nfs/dbraw/zinc/07/55/05/1344075505.db2.gz	XTOQQVKUXDJBCL-KUHUBIRLSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](NCc3nocc3C)[C@H](CC)C2)C1	ZINC001037915769	1344176319	/nfs/dbraw/zinc/17/63/19/1344176319.db2.gz	RVAIQPGGIPIKMC-CVEARBPZSA-N	0	3	331.460	3.056	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)[C@@H]1CC[C@H](c2ccccc2)O1	ZINC001038258722	1344346740	/nfs/dbraw/zinc/34/67/40/1344346740.db2.gz	SNVNXZYKNWWTOU-OTWHNJEPSA-N	0	3	328.456	3.063	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CCN2CCCC2CCOCC2)CC1	ZINC001038661767	1344526716	/nfs/dbraw/zinc/52/67/16/1344526716.db2.gz	MPWOZQFRGQDNBO-IBGZPJMESA-N	0	3	334.504	3.130	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CCN2C[C@H]2CCC(F)(F)C2)CC1	ZINC001038668336	1344532464	/nfs/dbraw/zinc/53/24/64/1344532464.db2.gz	UEXJTOXDIWGEOQ-HOCLYGCPSA-N	0	3	326.431	3.359	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)NC[C@H]1CCN1CCC1=CCCCC1	ZINC001038801498	1344589461	/nfs/dbraw/zinc/58/94/61/1344589461.db2.gz	ZGNHGJKXBVNXEK-AABGKKOBSA-N	0	3	346.515	3.439	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)[C@@H](CC)SC)CC2)C1	ZINC001039119084	1344792476	/nfs/dbraw/zinc/79/24/76/1344792476.db2.gz	VMFOILYRGCRSCJ-JKSUJKDBSA-N	0	3	344.952	3.441	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)c3cnccc3C)CC2)C1	ZINC001039123481	1344798283	/nfs/dbraw/zinc/79/82/83/1344798283.db2.gz	USLSSZAVOGUNFA-QGZVFWFLSA-N	0	3	347.890	3.317	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)/C=C/c3ccc[nH]3)CC2)C1	ZINC001039126760	1344803886	/nfs/dbraw/zinc/80/38/86/1344803886.db2.gz	IUEVSZPYRAXXEK-BDUNBXCCSA-N	0	3	347.890	3.341	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)c3cccn3CC)CC2)C1	ZINC001039173175	1344863732	/nfs/dbraw/zinc/86/37/32/1344863732.db2.gz	PSKJPBYAGOGAHW-QGZVFWFLSA-N	0	3	349.906	3.435	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2oc(C)cc2C)C1	ZINC001039203564	1344913833	/nfs/dbraw/zinc/91/38/33/1344913833.db2.gz	QKYYEVMIOAVTNB-ZWKOTPCHSA-N	0	3	328.456	3.236	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccc(CC)o2)C1	ZINC001039215690	1344932240	/nfs/dbraw/zinc/93/22/40/1344932240.db2.gz	YFKQQJFFVNXQTI-FUHWJXTLSA-N	0	3	328.456	3.182	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc3cc(C)ccc3[nH]2)C1	ZINC001039224855	1344942955	/nfs/dbraw/zinc/94/29/55/1344942955.db2.gz	IZSMXCDWAAGUKD-LAUBAEHRSA-N	0	3	349.478	3.426	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccn(CC)c2C)C1	ZINC001039226678	1344945434	/nfs/dbraw/zinc/94/54/34/1344945434.db2.gz	YUXUAPTXBZGEIN-UYAOXDASSA-N	0	3	341.499	3.156	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ncc(C)cc2C)C1	ZINC001039228643	1344948426	/nfs/dbraw/zinc/94/84/26/1344948426.db2.gz	KIRFEFMDUUILKF-RTBURBONSA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccsc2Cl)C1	ZINC001039232218	1344952018	/nfs/dbraw/zinc/95/20/18/1344952018.db2.gz	UKLFMKYBKHGOKS-DZGCQCFKSA-N	0	3	336.888	3.351	20	30		EGEDHN
C=C1CCC(C(=O)N2CCCC[C@H]2[C@@H]2CCN(CC#CC)C2)CC1	ZINC001039233050	1344952369	/nfs/dbraw/zinc/95/23/69/1344952369.db2.gz	ZMDLYGDRKDLYQP-UXHICEINSA-N	0	3	328.500	3.459	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)CCc2cccs2)C1	ZINC001039237619	1344960335	/nfs/dbraw/zinc/96/03/35/1344960335.db2.gz	DHHAARUMDXFULY-WMZOPIPTSA-N	0	3	330.497	3.017	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(C)ccc2F)C1	ZINC001039238410	1344962138	/nfs/dbraw/zinc/96/21/38/1344962138.db2.gz	NOFAMNOYTXBWGX-XLIONFOSSA-N	0	3	342.458	3.474	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)CCc2cccs2)C1	ZINC001039238394	1344962233	/nfs/dbraw/zinc/96/22/33/1344962233.db2.gz	IDHICUKFUDBBOO-IEBWSBKVSA-N	0	3	344.524	3.407	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cccc3c2CCC3)C1	ZINC001039241422	1344967316	/nfs/dbraw/zinc/96/73/16/1344967316.db2.gz	AWXXYIYXYZDLIV-GHTZIAJQSA-N	0	3	336.479	3.125	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc(C)c(CC)o2)C1	ZINC001039244184	1344971870	/nfs/dbraw/zinc/97/18/70/1344971870.db2.gz	HPVAAKYBOGXFHB-DLBZAZTESA-N	0	3	328.456	3.100	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cccc(Cl)c2)C1	ZINC001039244382	1344972624	/nfs/dbraw/zinc/97/26/24/1344972624.db2.gz	IIHPLLPIMYIRSQ-FUHWJXTLSA-N	0	3	330.859	3.290	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cccc(Cl)c2)C1	ZINC001039244393	1344973198	/nfs/dbraw/zinc/97/31/98/1344973198.db2.gz	IIHPLLPIMYIRSQ-WMZOPIPTSA-N	0	3	330.859	3.290	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2coc(C(F)F)c2)C1	ZINC001039245448	1344974754	/nfs/dbraw/zinc/97/47/54/1344974754.db2.gz	OJQFEEQDOYGEPL-ZFWWWQNUSA-N	0	3	336.382	3.167	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc2ccccc2nc1C	ZINC001039382556	1345037073	/nfs/dbraw/zinc/03/70/73/1345037073.db2.gz	JJRCXZBRGCONPT-MOPGFXCFSA-N	0	3	347.462	3.245	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cnn(C(C)(C)C)c1C	ZINC001039385240	1345038687	/nfs/dbraw/zinc/03/86/87/1345038687.db2.gz	DPAAZEJPIJTIHA-SJORKVTESA-N	0	3	344.503	3.202	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1c(C)c(F)ccc1Cl	ZINC001039396735	1345045425	/nfs/dbraw/zinc/04/54/25/1345045425.db2.gz	CBYCOZXXUZHPDL-CABCVRRESA-N	0	3	348.849	3.490	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1cc(C)ccc1C	ZINC001039428535	1345063555	/nfs/dbraw/zinc/06/35/55/1345063555.db2.gz	QOVICYHMTLUWDG-UXHICEINSA-N	0	3	326.484	3.487	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(F)c(F)c(F)c1	ZINC001039441414	1345067900	/nfs/dbraw/zinc/06/79/00/1345067900.db2.gz	FKHSGIKHGJWFKD-KGLIPLIRSA-N	0	3	338.373	3.359	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccccc1COC	ZINC001039451188	1345074710	/nfs/dbraw/zinc/07/47/10/1345074710.db2.gz	NDZGWWVRXGNFFW-UXHICEINSA-N	0	3	342.483	3.017	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(OC)c(C)c1	ZINC001039452301	1345075445	/nfs/dbraw/zinc/07/54/45/1345075445.db2.gz	PCUSAKXCLHPUEE-MSOLQXFVSA-N	0	3	328.456	3.259	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(C)n(C(C)C)c1C	ZINC001039468130	1345085928	/nfs/dbraw/zinc/08/59/28/1345085928.db2.gz	VUEAHVRSYHFETL-MOPGFXCFSA-N	0	3	341.499	3.388	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc2n(c1)CCCC2	ZINC001039479700	1345093632	/nfs/dbraw/zinc/09/36/32/1345093632.db2.gz	KUQRWIGCBBLZHO-MJGOQNOKSA-N	0	3	327.472	3.079	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CCC[C@@H](C2)N3C[C@@H]2CCO[C@H](C)C2)C1	ZINC001039906203	1345243728	/nfs/dbraw/zinc/24/37/28/1345243728.db2.gz	JBEPRSZZLLEWKD-MKXGPGLRSA-N	0	3	346.515	3.223	20	30		EGEDHN
CC(F)(F)C(=O)N1CC[C@@]2(C1)CCCN(Cc1cccc(C#N)c1)C2	ZINC001040037001	1345302322	/nfs/dbraw/zinc/30/23/22/1345302322.db2.gz	MZYQZFVOEONTEK-IBGZPJMESA-N	0	3	347.409	3.028	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@]2(C1)CCCN(Cc1cccc(C#N)c1)C2	ZINC001040051647	1345313003	/nfs/dbraw/zinc/31/30/03/1345313003.db2.gz	XAMQMIHYPQOZNX-OAQYLSRUSA-N	0	3	337.467	3.339	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)Cc3c(C)cccc3C)C2)C1	ZINC001040224615	1345383745	/nfs/dbraw/zinc/38/37/45/1345383745.db2.gz	MWMPBNQJZZYZTE-JOCHJYFZSA-N	0	3	338.495	3.184	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@@H]3CCC=CCCC3)C2)C1	ZINC001040256898	1345397958	/nfs/dbraw/zinc/39/79/58/1345397958.db2.gz	BEFJLAPJPSQDEJ-CTNGQTDRSA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)CCc3ccc(Cl)cc3)C2)C1	ZINC001040317979	1345428667	/nfs/dbraw/zinc/42/86/67/1345428667.db2.gz	OXCHAHGTOLWTRS-FQEVSTJZSA-N	0	3	344.886	3.220	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(F)c(Cl)c3)C2)C1	ZINC001040360630	1345453831	/nfs/dbraw/zinc/45/38/31/1345453831.db2.gz	MGHJYUVAZRVJOX-GOSISDBHSA-N	0	3	334.822	3.040	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3ccc(F)c(F)c3F)C2)C1	ZINC001040362065	1345455040	/nfs/dbraw/zinc/45/50/40/1345455040.db2.gz	ZJKWLDLRSOXVOU-GOSISDBHSA-N	0	3	338.373	3.218	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3c(F)ccc(C)c3F)C2)C1	ZINC001040371948	1345460449	/nfs/dbraw/zinc/46/04/49/1345460449.db2.gz	MVNWMRMQCWTQFC-FQEVSTJZSA-N	0	3	346.421	3.225	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)C[C@H](C)c3cccc(F)c3)C2)C1	ZINC001040383148	1345468041	/nfs/dbraw/zinc/46/80/41/1345468041.db2.gz	GFTPDSYRGTZJFU-LAUBAEHRSA-N	0	3	342.458	3.267	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(C)cc3F)C2)C1	ZINC001040419903	1345487623	/nfs/dbraw/zinc/48/76/23/1345487623.db2.gz	ZEJCEXQTQWIQDK-HXUWFJFHSA-N	0	3	328.431	3.086	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3noc4c3CCCCC4)C2)C1	ZINC001040423130	1345489445	/nfs/dbraw/zinc/48/94/45/1345489445.db2.gz	CPGXBWHQOPAWTI-HXUWFJFHSA-N	0	3	343.471	3.058	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)C34CCC(CC3)C4(C)C)C2)C1	ZINC001040434002	1345497144	/nfs/dbraw/zinc/49/71/44/1345497144.db2.gz	BWSJBSSMXPVJRI-SGDIKTSBSA-N	0	3	328.500	3.151	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cc4cccnc4s3)C2)C1	ZINC001040478018	1345513359	/nfs/dbraw/zinc/51/33/59/1345513359.db2.gz	FCNUYAUQIUPBJJ-LJQANCHMSA-N	0	3	341.480	3.410	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ccc4c(c3)CCC4)C2)C1	ZINC001040524961	1345533400	/nfs/dbraw/zinc/53/34/00/1345533400.db2.gz	OTNDISVUYLBOPN-JOCHJYFZSA-N	0	3	336.479	3.127	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@@H](C)c3ccc(F)cc3F)C2)C1	ZINC001040537618	1345536408	/nfs/dbraw/zinc/53/64/08/1345536408.db2.gz	BLKKKVQMIPNKSA-MGPUTAFESA-N	0	3	346.421	3.016	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)C34CC(c5ccccc5)(C3)C4)C2)C1	ZINC001040544852	1345539298	/nfs/dbraw/zinc/53/92/98/1345539298.db2.gz	LCKOIHMFEXOKCP-DDRJZQQSSA-N	0	3	348.490	3.056	20	30		EGEDHN
CC(C)=CC(=O)N1CCC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001040582845	1345549766	/nfs/dbraw/zinc/54/97/66/1345549766.db2.gz	UZCATLYHDQLGFE-UHFFFAOYSA-N	0	3	337.467	3.339	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC2(C1)CCN(Cc1cccc(F)c1)CC2	ZINC001040697448	1345567209	/nfs/dbraw/zinc/56/72/09/1345567209.db2.gz	TXMQSWLOUQMSNA-UHFFFAOYSA-N	0	3	340.442	3.054	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3c(C)oc4ccccc43)C2)CC1	ZINC001040715125	1345569310	/nfs/dbraw/zinc/56/93/10/1345569310.db2.gz	RHHTVIHBCYAPAU-UHFFFAOYSA-N	0	3	336.435	3.303	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)Cc3cccc(C(C)C)c3)C2)CC1	ZINC001040760352	1345575625	/nfs/dbraw/zinc/57/56/25/1345575625.db2.gz	HJPHAUFFIOJVBX-UHFFFAOYSA-N	0	3	338.495	3.300	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cc(F)ccc3CC)C2)CC1	ZINC001040760747	1345575799	/nfs/dbraw/zinc/57/57/99/1345575799.db2.gz	NFUDEUOUOODODB-UHFFFAOYSA-N	0	3	342.458	3.340	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@@H]3[C@H](C=C(C)C)C3(C)C)C2)CC1	ZINC001040766037	1345576645	/nfs/dbraw/zinc/57/66/45/1345576645.db2.gz	YXCXJXZNAVUNAB-ROUUACIJSA-N	0	3	328.500	3.173	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cnc4ccccc4c3)C2)CC1	ZINC001040870833	1345591025	/nfs/dbraw/zinc/59/10/25/1345591025.db2.gz	XPDDMNZAWXYVKJ-UHFFFAOYSA-N	0	3	347.462	3.186	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)C[C@@H](C)c3ccco3)C2)CC1	ZINC001040916814	1345599621	/nfs/dbraw/zinc/59/96/21/1345599621.db2.gz	JONDUPWFYXHRMY-QGZVFWFLSA-N	0	3	328.456	3.111	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@@H](CC)c3ccc(F)cc3)C2)CC1	ZINC001040950912	1345607334	/nfs/dbraw/zinc/60/73/34/1345607334.db2.gz	AVHSPYLISDWESH-IBGZPJMESA-N	0	3	342.458	3.267	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001041196419	1345674476	/nfs/dbraw/zinc/67/44/76/1345674476.db2.gz	SOLKJTVJCYZGSK-FQEVSTJZSA-N	0	3	341.430	3.246	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)C3CC(C)(C)CC(C)(C)C3)C2)C1	ZINC001041507925	1345747176	/nfs/dbraw/zinc/74/71/76/1345747176.db2.gz	KJWPDBYVSMBYCF-NRFANRHFSA-N	0	3	330.516	3.397	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@]2(CCN(Cc3cccnc3C)C2)C1	ZINC001041545074	1345759392	/nfs/dbraw/zinc/75/93/92/1345759392.db2.gz	RQXZHPPLPXIUPY-HXUWFJFHSA-N	0	3	327.472	3.027	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@]2(CCN(Cc3cccnc3C)C2)C1	ZINC001041545071	1345759407	/nfs/dbraw/zinc/75/94/07/1345759407.db2.gz	RQXZHPPLPXIUPY-FQEVSTJZSA-N	0	3	327.472	3.027	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@]2(CCN(Cc3cnccc3C)C2)C1	ZINC001041625706	1345800276	/nfs/dbraw/zinc/80/02/76/1345800276.db2.gz	KKWIUZRNPHJRCU-SFTDATJTSA-N	0	3	341.499	3.417	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@]2(CCN(Cc3oc(C)nc3C)C2)C1	ZINC001041638091	1345805456	/nfs/dbraw/zinc/80/54/56/1345805456.db2.gz	HTSLPKMDBYXLPC-WOJBJXKFSA-N	0	3	345.487	3.318	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001041698673	1345822610	/nfs/dbraw/zinc/82/26/10/1345822610.db2.gz	WFYOUHTWZQEBTG-SFHLNBCPSA-N	0	3	337.467	3.029	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)Cc3ccc(C(C)(C)C)cc3)C2)C1	ZINC001041712684	1345827564	/nfs/dbraw/zinc/82/75/64/1345827564.db2.gz	ULNDCSLNZZXXBC-JOCHJYFZSA-N	0	3	338.495	3.084	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)C(C)(C)Cc3ccccc3)C2)C1	ZINC001041775304	1345846179	/nfs/dbraw/zinc/84/61/79/1345846179.db2.gz	KZPMVZMGIFSBKH-QFIPXVFZSA-N	0	3	338.495	3.203	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)C3(C4CCCCC4)CC3)C2)C1	ZINC001041806150	1345857379	/nfs/dbraw/zinc/85/73/79/1345857379.db2.gz	USYDDRISBISAFM-HXUWFJFHSA-N	0	3	328.500	3.295	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cnc(C(C)(C)C)s3)C2)C1	ZINC001041846943	1345872188	/nfs/dbraw/zinc/87/21/88/1345872188.db2.gz	FETMCAHMSKHUKX-LJQANCHMSA-N	0	3	345.512	3.002	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)[C@@H](C)Cc3cccc(Cl)c3)C2)C1	ZINC001041856008	1345875079	/nfs/dbraw/zinc/87/50/79/1345875079.db2.gz	WAHOSPMBOHRPDL-OXJNMPFZSA-N	0	3	344.886	3.076	20	30		EGEDHN
CC(C)(C)CC(=O)N1CC[C@H]2CCN(Cc3ccc(C#N)cc3)[C@@H]2C1	ZINC001041926798	1345899610	/nfs/dbraw/zinc/89/96/10/1345899610.db2.gz	FENHKJRAYYUJJF-RTBURBONSA-N	0	3	339.483	3.417	20	30		EGEDHN
CC(C(=O)N1CC[C@@H]2CCN(Cc3cccc(C#N)c3)[C@H]2C1)=C1CCC1	ZINC001042054068	1345932268	/nfs/dbraw/zinc/93/22/68/1345932268.db2.gz	GKSSBFQMYAPJIX-SFTDATJTSA-N	0	3	349.478	3.481	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3coc4c3cccc4OC)C[C@@H]21	ZINC001042064780	1345933721	/nfs/dbraw/zinc/93/37/21/1345933721.db2.gz	JLVXFQUOZRJGKP-PBHICJAKSA-N	0	3	340.423	3.164	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(C)c(OC)c(C)c3)C[C@@H]21	ZINC001042066312	1345934688	/nfs/dbraw/zinc/93/46/88/1345934688.db2.gz	DBPKTUYTJXUIQL-WMZOPIPTSA-N	0	3	328.456	3.034	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc4nccc(C)c4c3)C[C@@H]21	ZINC001042077894	1345939019	/nfs/dbraw/zinc/93/90/19/1345939019.db2.gz	QWUGILWPRQJYIP-UWJYYQICSA-N	0	3	347.462	3.103	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(C4CCCCC4)n[nH]3)C[C@H]21	ZINC001042099253	1345943469	/nfs/dbraw/zinc/94/34/69/1345943469.db2.gz	YXYSZYCBSCMLBK-VQIMIIECSA-N	0	3	342.487	3.180	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cccc4ccc(C)nc43)C[C@@H]21	ZINC001042111489	1345946426	/nfs/dbraw/zinc/94/64/26/1345946426.db2.gz	JUJMMCCTPGAKHR-APWZRJJASA-N	0	3	335.451	3.266	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cccc4ccc(C)nc43)C[C@H]21	ZINC001042111491	1345946457	/nfs/dbraw/zinc/94/64/57/1345946457.db2.gz	JUJMMCCTPGAKHR-QFBILLFUSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(-c4cnco4)cc3)C[C@H]21	ZINC001042116008	1345948786	/nfs/dbraw/zinc/94/87/86/1345948786.db2.gz	FJRBZWVGWBBTAG-MAUKXSAKSA-N	0	3	337.423	3.064	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(C)nc3C(C)C)C[C@H]21	ZINC001042167739	1345963996	/nfs/dbraw/zinc/96/39/96/1345963996.db2.gz	NIBINKYOEZHXHB-FUHWJXTLSA-N	0	3	327.472	3.236	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)CCc3ccc(Cl)cc3)C[C@H]21	ZINC001042168434	1345964027	/nfs/dbraw/zinc/96/40/27/1345964027.db2.gz	UZDCJESPMBZXAC-PKOBYXMFSA-N	0	3	344.886	3.219	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2CCN(Cc3cncc(C)c3)[C@@H]2C1	ZINC001042182041	1345970312	/nfs/dbraw/zinc/97/03/12/1345970312.db2.gz	BNGGXNYRAQTKGQ-RTBURBONSA-N	0	3	341.499	3.415	20	30		EGEDHN
CC1(C(=O)N2CC[C@H]3CCN(Cc4ccc(C#N)cc4)[C@H]3C2)CCC1	ZINC001042187177	1345974098	/nfs/dbraw/zinc/97/40/98/1345974098.db2.gz	MFTZFUHRVGLHOM-MOPGFXCFSA-N	0	3	337.467	3.171	20	30		EGEDHN
CCC1(C(=O)N2CC[C@H]3CCN(Cc4cccc(C#N)c4)[C@@H]3C2)CC1	ZINC001042220770	1345991846	/nfs/dbraw/zinc/99/18/46/1345991846.db2.gz	FKUCUERGETZJMP-RTBURBONSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]3CCN(CCC(F)(F)F)[C@@H]3C2)C1	ZINC001042224611	1345995259	/nfs/dbraw/zinc/99/52/59/1345995259.db2.gz	PUNMXSBQTYNEHZ-ZIAGYGMSSA-N	0	3	330.394	3.218	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ncc(Cl)cc3Cl)C[C@@H]21	ZINC001042287977	1346017935	/nfs/dbraw/zinc/01/79/35/1346017935.db2.gz	PWKDVPOJJBYENZ-RISCZKNCSA-N	0	3	340.254	3.111	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C(C)(C)c3cccc(OC)c3)C[C@H]21	ZINC001042297788	1346022237	/nfs/dbraw/zinc/02/22/37/1346022237.db2.gz	VLEKWFWVUVKBLD-VQIMIIECSA-N	0	3	342.483	3.082	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C(C)(C)Cc3ccccc3)C[C@H]21	ZINC001042305245	1346025308	/nfs/dbraw/zinc/02/53/08/1346025308.db2.gz	XPKVFMBXZJBUJG-RTBURBONSA-N	0	3	326.484	3.364	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cnn(C4CCCC4)c3C)C[C@@H]21	ZINC001042306329	1346026209	/nfs/dbraw/zinc/02/62/09/1346026209.db2.gz	FZMHSNMYQKLKIS-APWZRJJASA-N	0	3	342.487	3.029	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc4c(c3)CCC=C4)C[C@H]21	ZINC001042315754	1346030150	/nfs/dbraw/zinc/03/01/50/1346030150.db2.gz	BZTBERHGSYFQGV-GHTZIAJQSA-N	0	3	334.463	3.206	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3occ4c3CCCC4)C[C@@H]21	ZINC001042330826	1346038822	/nfs/dbraw/zinc/03/88/22/1346038822.db2.gz	HFITWJMJIOQXJF-YJBOKZPZSA-N	0	3	328.456	3.271	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3cc4c(s3)CCC4)C[C@H]21	ZINC001042337944	1346042710	/nfs/dbraw/zinc/04/27/10/1346042710.db2.gz	ICGQJUWALNIQDL-GOEBONIOSA-N	0	3	330.497	3.349	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(F)c(F)cc3Cl)C[C@H]21	ZINC001042338939	1346043353	/nfs/dbraw/zinc/04/33/53/1346043353.db2.gz	OEJGEGWEWSTEHA-MEDUHNTESA-N	0	3	340.801	3.341	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C3(c4ccc(Cl)cc4)CC3)C[C@H]21	ZINC001042340947	1346045885	/nfs/dbraw/zinc/04/58/85/1346045885.db2.gz	JOUARSBABQGTRN-CRAIPNDOSA-N	0	3	344.886	3.480	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cccc(OCC(C)C)c3)C[C@H]21	ZINC001042349064	1346050525	/nfs/dbraw/zinc/05/05/25/1346050525.db2.gz	NRNIISQSWAYNQB-YLJYHZDGSA-N	0	3	342.483	3.444	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(OCC4CC4)cc3)C[C@@H]21	ZINC001042354795	1346052966	/nfs/dbraw/zinc/05/29/66/1346052966.db2.gz	GWLYUMTVQCCUJE-PXNSSMCTSA-N	0	3	340.467	3.198	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3c[nH]c4c3cccc4CC)C[C@@H]21	ZINC001042367169	1346058463	/nfs/dbraw/zinc/05/84/63/1346058463.db2.gz	BVPGVBQMAMKKIH-XLIONFOSSA-N	0	3	349.478	3.290	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(-c4ccccc4)[nH]3)C[C@H]21	ZINC001042375667	1346063131	/nfs/dbraw/zinc/06/31/31/1346063131.db2.gz	ZOCBYFNOJGMCJM-YLJYHZDGSA-N	0	3	335.451	3.404	20	30		EGEDHN
C[C@H]1C[C@H](NCc2cc(F)ccc2C#N)CCN1C(=O)C1CCCC1	ZINC001044414799	1346321869	/nfs/dbraw/zinc/32/18/69/1346321869.db2.gz	WKXOILMQYTZGJZ-IFXJQAMLSA-N	0	3	343.446	3.357	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)[C@H]2CC=CCC2)c(F)c1	ZINC001044919215	1346462971	/nfs/dbraw/zinc/46/29/71/1346462971.db2.gz	KEVGMXUEMOARSN-WMZOPIPTSA-N	0	3	341.430	3.134	20	30		EGEDHN
CC1(C)CC(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)cc2F)C1	ZINC001045023618	1346482239	/nfs/dbraw/zinc/48/22/39/1346482239.db2.gz	UFFGTPAOFXWYLB-KRWDZBQOSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)s2)CC1	ZINC001045182026	1346517828	/nfs/dbraw/zinc/51/78/28/1346517828.db2.gz	IVHXIXLOFIFWHM-INIZCTEOSA-N	0	3	343.496	3.447	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]2CNCc2cn(C(C)C)nc2C)C1	ZINC001045191196	1346525406	/nfs/dbraw/zinc/52/54/06/1346525406.db2.gz	RKZYPLQKKJIYOY-SFHVURJKSA-N	0	3	344.503	3.209	20	30		EGEDHN
CC1(NC(=O)[C@H]2C[C@H]3C[C@H]3C2)CCN(Cc2cccc(C#N)c2)CC1	ZINC001045528765	1346618127	/nfs/dbraw/zinc/61/81/27/1346618127.db2.gz	CHDZTWQMNNYWLC-BWTSREIZSA-N	0	3	337.467	3.075	20	30		EGEDHN
CC1(NC(=O)[C@H]2CC23CCC3)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045571606	1346632183	/nfs/dbraw/zinc/63/21/83/1346632183.db2.gz	FSSBOJABEZDCMX-GOSISDBHSA-N	0	3	337.467	3.219	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2)CC1	ZINC001045581322	1346636280	/nfs/dbraw/zinc/63/62/80/1346636280.db2.gz	PJUWRAGSNVLUNS-ZWKOTPCHSA-N	0	3	344.886	3.438	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)[C@@H]2C[C@H]2c2ccc(C)s2)CC1	ZINC001045582881	1346636615	/nfs/dbraw/zinc/63/66/15/1346636615.db2.gz	OMIMFJMOMPFYSR-HZPDHXFCSA-N	0	3	330.497	3.154	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2csc(-c3ccoc3)n2)CC1	ZINC001045590450	1346638864	/nfs/dbraw/zinc/63/88/64/1346638864.db2.gz	DOGYFMKRELPEIT-UHFFFAOYSA-N	0	3	331.441	3.173	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2cnn(C(CC)CC)c2C)CC1	ZINC001045616112	1346648308	/nfs/dbraw/zinc/64/83/08/1346648308.db2.gz	SWMSBWGLHXCGGS-UHFFFAOYSA-N	0	3	332.492	3.323	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)[C@H]2C[C@H]2c2cc(F)ccc2F)CC1	ZINC001045644501	1346657109	/nfs/dbraw/zinc/65/71/09/1346657109.db2.gz	KKBMOQHIRKYOAH-RDJZCZTQSA-N	0	3	346.421	3.062	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2ccc(OC3CCC3)cc2)CC1	ZINC001045647215	1346658392	/nfs/dbraw/zinc/65/83/92/1346658392.db2.gz	VTLGMQOEGCWSFH-UHFFFAOYSA-N	0	3	328.456	3.388	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccsc1C)C2	ZINC001045936867	1346773722	/nfs/dbraw/zinc/77/37/22/1346773722.db2.gz	OEGCPLSKUUMUAQ-IBGZPJMESA-N	0	3	330.497	3.398	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc3ccc(C)cc3[nH]1)C2	ZINC001045955072	1346789703	/nfs/dbraw/zinc/78/97/03/1346789703.db2.gz	NOJFVFZENRCUHY-QFIPXVFZSA-N	0	3	349.478	3.428	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H]1C[C@@H]3CCCC[C@H]13)C2	ZINC001045955111	1346789714	/nfs/dbraw/zinc/78/97/14/1346789714.db2.gz	OQIJVQFFICTRAA-CTAFRAEOSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)C1(C(F)F)CCCC1)C2	ZINC001045959887	1346795177	/nfs/dbraw/zinc/79/51/77/1346795177.db2.gz	CFGDSXDGKLPIRB-GOSISDBHSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc(F)c(C)c1)C2	ZINC001045961115	1346796113	/nfs/dbraw/zinc/79/61/13/1346796113.db2.gz	GSKQZGWKOUIOCY-HXUWFJFHSA-N	0	3	328.431	3.086	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H](C)c1cccs1)C2	ZINC001045966470	1346802459	/nfs/dbraw/zinc/80/24/59/1346802459.db2.gz	XHRGMECZUMINEQ-QFBILLFUSA-N	0	3	330.497	3.189	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)C1(F)CCCCC1)C2	ZINC001045977351	1346813851	/nfs/dbraw/zinc/81/38/51/1346813851.db2.gz	BJYLNJULPYRXOQ-IBGZPJMESA-N	0	3	334.479	3.387	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)Cc1sc(C)cc1C)C2	ZINC001045981009	1346818992	/nfs/dbraw/zinc/81/89/92/1346818992.db2.gz	ANGCAPSPXAZXEY-FQEVSTJZSA-N	0	3	344.524	3.245	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H](C)c1cccc(F)c1)C2	ZINC001045984716	1346825014	/nfs/dbraw/zinc/82/50/14/1346825014.db2.gz	HKGCBMMZFFZQFQ-LAUBAEHRSA-N	0	3	342.458	3.267	20	30		EGEDHN
C[C@]1(NC(=O)c2cc(C#N)c[nH]2)CCN(Cc2ccc(C3CC3)cc2)C1	ZINC001046222748	1346897409	/nfs/dbraw/zinc/89/74/09/1346897409.db2.gz	CJPKFTATMDVVQX-NRFANRHFSA-N	0	3	348.450	3.158	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2ccc(C(F)(F)F)cc2)C1	ZINC001046792037	1347105003	/nfs/dbraw/zinc/10/50/03/1347105003.db2.gz	BHEMOICBUCEOFX-MRXNPFEDSA-N	0	3	326.362	3.476	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC001046795549	1347107345	/nfs/dbraw/zinc/10/73/45/1347107345.db2.gz	VMIFWIUBIPCROW-INIZCTEOSA-N	0	3	326.362	3.476	20	30		EGEDHN
C=CCCN1CC[C@](C)(NC(=O)c2sc(Cl)nc2Cl)C1	ZINC001046843243	1347127399	/nfs/dbraw/zinc/12/73/99/1347127399.db2.gz	SLNDMPIUSBYHJZ-ZDUSSCGKSA-N	0	3	334.272	3.220	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2ccc(OC3CCC3)cc2)C1	ZINC001046851154	1347129630	/nfs/dbraw/zinc/12/96/30/1347129630.db2.gz	CXFHUYHVWDSGPF-HXUWFJFHSA-N	0	3	328.456	3.388	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2oc(C)cc2C)C1	ZINC001046923953	1347153645	/nfs/dbraw/zinc/15/36/45/1347153645.db2.gz	AHPIFIDVHBNJFV-CQSZACIVSA-N	0	3	326.387	3.160	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2ccn3ccccc23)C1	ZINC001046955338	1347163617	/nfs/dbraw/zinc/16/36/17/1347163617.db2.gz	AHRWTJBHEYKWBH-OAHLLOKOSA-N	0	3	347.409	3.202	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2cc(C)ccc2F)C1	ZINC001046975171	1347172787	/nfs/dbraw/zinc/17/27/87/1347172787.db2.gz	LBYHTNWHCOEFHE-CQSZACIVSA-N	0	3	340.389	3.397	20	30		EGEDHN
O=C(N[C@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1ccccc1)C2)[C@H]1C[C@H]2C[C@H]2C1	ZINC001047131899	1347215376	/nfs/dbraw/zinc/21/53/76/1347215376.db2.gz	BQZJNJHWSHMXQT-RBFKZVKLSA-N	0	3	348.490	3.053	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)Cc3cccs3)C2)CC1	ZINC001047218413	1347249767	/nfs/dbraw/zinc/24/97/67/1347249767.db2.gz	BQWADURBOSVVOQ-GOSISDBHSA-N	0	3	344.524	3.265	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)c3cc(C)oc3C)C2)CC1	ZINC001047222751	1347253493	/nfs/dbraw/zinc/25/34/93/1347253493.db2.gz	FCXLFDNVTUPHCL-IBGZPJMESA-N	0	3	342.483	3.484	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)[C@H]3[C@@H]4CCC[C@@H]43)C2)CC1	ZINC001047233044	1347261516	/nfs/dbraw/zinc/26/15/16/1347261516.db2.gz	SBFASIUHGJJVNH-ZRNYENFQSA-N	0	3	328.500	3.006	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)C3CC(C)(C)C3)C2)CC1	ZINC001047236146	1347263780	/nfs/dbraw/zinc/26/37/80/1347263780.db2.gz	GIZQKHVZUAHLCE-GOSISDBHSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3cccc(C)c3F)C2)CC1	ZINC001047240335	1347266654	/nfs/dbraw/zinc/26/66/54/1347266654.db2.gz	BIRCERHAZWQSCU-GOSISDBHSA-N	0	3	342.458	3.332	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@H](C)c3cccs3)C2)CC1	ZINC001047254739	1347278777	/nfs/dbraw/zinc/27/87/77/1347278777.db2.gz	RPSXOWPNVWBNIX-SJLPKXTDSA-N	0	3	344.524	3.435	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)[C@@H]3C[C@H]3C3CC3)C2)CC1	ZINC001047257099	1347280153	/nfs/dbraw/zinc/28/01/53/1347280153.db2.gz	GGOGZDRYRMEMPO-SLFFLAALSA-N	0	3	328.500	3.006	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@H](F)c3ccccc3)C2)CC1	ZINC001047259203	1347281891	/nfs/dbraw/zinc/28/18/91/1347281891.db2.gz	MGNBLMJTEGGABH-VQTJNVASSA-N	0	3	342.458	3.281	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)C[C@@H](C)C3CC3)C2)CC1	ZINC001047265740	1347286350	/nfs/dbraw/zinc/28/63/50/1347286350.db2.gz	MCJZSGCQZIZZAR-YLJYHZDGSA-N	0	3	330.516	3.397	20	30		EGEDHN
C[C@H](NCc1cc(F)ccc1C#N)[C@H]1CCN(C(=O)CC(C)(C)C)C1	ZINC001047711941	1347344566	/nfs/dbraw/zinc/34/45/66/1347344566.db2.gz	DISKFWONJSNKET-HOCLYGCPSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@@H]([C@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001047791338	1347373392	/nfs/dbraw/zinc/37/33/92/1347373392.db2.gz	URQSTSWVOIGUCI-DZGCQCFKSA-N	0	3	347.409	3.287	20	30		EGEDHN
C[C@@H](NCc1c(F)cccc1Cl)[C@H]1CCN(C(=O)C#CC2CC2)C1	ZINC001047837343	1347385158	/nfs/dbraw/zinc/38/51/58/1347385158.db2.gz	WHARZKHUXXZODN-HIFRSBDPSA-N	0	3	348.849	3.219	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]([C@@H](C)NCc2nc(C)c(C)s2)C1	ZINC001047929883	1347413839	/nfs/dbraw/zinc/41/38/39/1347413839.db2.gz	ABWBSBZPRWVOEC-HIFRSBDPSA-N	0	3	335.517	3.299	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]([C@@H](C)NCc2ccn(C(C)C)n2)C1	ZINC001047930652	1347413957	/nfs/dbraw/zinc/41/39/57/1347413957.db2.gz	GBGHSVUWPSBZGK-HZPDHXFCSA-N	0	3	332.492	3.003	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H]([C@@H](C)NCc3cnc(C)o3)C2)CC1	ZINC001047962736	1347425907	/nfs/dbraw/zinc/42/59/07/1347425907.db2.gz	NJFPDAAUUFFFEZ-RHSMWYFYSA-N	0	3	331.460	3.056	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)C2CC3(CC3)C2)C1	ZINC001047970657	1347429193	/nfs/dbraw/zinc/42/91/93/1347429193.db2.gz	XKPDSEGVUGDYEK-YJBOKZPZSA-N	0	3	337.467	3.075	20	30		EGEDHN
Cc1cccc(C(=O)N2C[C@H](C)[C@H](CNCc3ccccc3C#N)C2)c1	ZINC001048121734	1347473908	/nfs/dbraw/zinc/47/39/08/1347473908.db2.gz	HWNWRWFNDLWVFN-LAUBAEHRSA-N	0	3	347.462	3.365	20	30		EGEDHN
C[C@H]1CN(C(=O)c2ccsc2)C[C@@H]1CNCc1ccccc1C#N	ZINC001048121826	1347474259	/nfs/dbraw/zinc/47/42/59/1347474259.db2.gz	GLWQRZRNWLJSQO-KSSFIOAISA-N	0	3	339.464	3.118	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2CCCC2)C[C@@H]1CNCc1ccccc1C#N	ZINC001048122015	1347474353	/nfs/dbraw/zinc/47/43/53/1347474353.db2.gz	KCGGFIZMVMHWFN-UZLBHIALSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@@H](CNCc2ccn(C(C)C)n2)C1	ZINC001048340032	1347523103	/nfs/dbraw/zinc/52/31/03/1347523103.db2.gz	NWQMZUSVEKITPE-SJORKVTESA-N	0	3	346.519	3.250	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H](C)[C@@H](CNCc3ncc(C)s3)C2)CC1	ZINC001048373033	1347533757	/nfs/dbraw/zinc/53/37/57/1347533757.db2.gz	JAFJMQMJZSEFCX-YOEHRIQHSA-N	0	3	347.528	3.382	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H](C)[C@@H](CNCc3csc(CC)n3)C2)C1	ZINC001048373979	1347534837	/nfs/dbraw/zinc/53/48/37/1347534837.db2.gz	LXYWIKXAFNTIJK-GJZGRUSLSA-N	0	3	347.528	3.246	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CN(Cc4ccc(F)cc4)C[C@H]3C2)C1	ZINC001049042632	1347713946	/nfs/dbraw/zinc/71/39/46/1347713946.db2.gz	DVUJGOQPCNWMOA-CALCHBBNSA-N	0	3	328.431	3.072	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@@H]2CCCN3C(=O)C2CCCC2)c1	ZINC001049282174	1347769003	/nfs/dbraw/zinc/76/90/03/1347769003.db2.gz	WLLZOMXGSLOVHY-PMACEKPBSA-N	0	3	337.467	3.314	20	30		EGEDHN
C/C(=C/C(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1cccc(C#N)c1)C1CC1	ZINC001049337901	1347796539	/nfs/dbraw/zinc/79/65/39/1347796539.db2.gz	CEHHBJQTLLUUNZ-IPSNVBBLSA-N	0	3	349.478	3.480	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@@H]2CCCN3C(=O)CC2CCC2)cc1	ZINC001049395416	1347818923	/nfs/dbraw/zinc/81/89/23/1347818923.db2.gz	GEKFVVIHNPRPNL-PMACEKPBSA-N	0	3	337.467	3.314	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)/C=C\C2CC2)cc1	ZINC001049399891	1347822509	/nfs/dbraw/zinc/82/25/09/1347822509.db2.gz	ZQZOADPKNZMWAC-XEWGXYBMSA-N	0	3	335.451	3.090	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@@H]2CCCN3C(=O)C=C2CCC2)cc1	ZINC001049410323	1347832872	/nfs/dbraw/zinc/83/28/72/1347832872.db2.gz	AVBWFOVIIGGDTQ-PMACEKPBSA-N	0	3	335.451	3.234	20	30		EGEDHN
C=CCCN1C[C@@H](C)[C@H](NC(=O)c2snc(Cl)c2Cl)C1	ZINC001079768022	1357375978	/nfs/dbraw/zinc/37/59/78/1357375978.db2.gz	ADUNLUYHGHQWNF-RKDXNWHRSA-N	0	3	334.272	3.076	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1nsc2ccccc21	ZINC001049494008	1347876097	/nfs/dbraw/zinc/87/60/97/1347876097.db2.gz	FGTJWLFBRVOCDX-LSDHHAIUSA-N	0	3	327.453	3.161	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cccc2c1CCCC2	ZINC001049496762	1347877907	/nfs/dbraw/zinc/87/79/07/1347877907.db2.gz	CXDQHWYJLWXSTH-RTWAWAEBSA-N	0	3	336.479	3.268	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)C1C2CC3CC(C2)CC1C3	ZINC001049522065	1347889978	/nfs/dbraw/zinc/88/99/78/1347889978.db2.gz	OJUNXZXSBMJKTP-LYSNUAOQSA-N	0	3	328.500	3.310	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C1C2CC3CC(C2)CC1C3	ZINC001049521757	1347890001	/nfs/dbraw/zinc/89/00/01/1347890001.db2.gz	MWTMMWONTUTPTF-HIOLGBDYSA-N	0	3	340.511	3.147	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)C1C2CC3CC(C2)CC1C3	ZINC001049521758	1347890194	/nfs/dbraw/zinc/89/01/94/1347890194.db2.gz	MWTMMWONTUTPTF-LFEHMJROSA-N	0	3	340.511	3.147	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cccc2ccc(C)nc21	ZINC001049542869	1347899568	/nfs/dbraw/zinc/89/95/68/1347899568.db2.gz	YPJYOXADSZDYIZ-MOPGFXCFSA-N	0	3	335.451	3.408	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1c(C)cccc1Cl	ZINC001049568699	1347914986	/nfs/dbraw/zinc/91/49/86/1347914986.db2.gz	WFLDRGFLJVMIQE-RBUKOAKNSA-N	0	3	344.886	3.280	20	30		EGEDHN
C=CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ncc(Cl)s1	ZINC001049588933	1347924204	/nfs/dbraw/zinc/92/42/04/1347924204.db2.gz	INZJYSOEWHUUCW-NWDGAFQWSA-N	0	3	325.865	3.052	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)CCc1ccc2[nH]ccc2c1	ZINC001049592775	1347927325	/nfs/dbraw/zinc/92/73/25/1347927325.db2.gz	JSXRRGBANHTUPF-RTWAWAEBSA-N	0	3	349.478	3.189	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cnc2c(F)cccc2c1	ZINC001049596914	1347929314	/nfs/dbraw/zinc/92/93/14/1347929314.db2.gz	ZZAFCYHNJPANCL-QZTJIDSGSA-N	0	3	339.414	3.239	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@@H]2CCCN3C(=O)[C@]23C[C@H]2CCC3)cc1	ZINC001049602337	1347931633	/nfs/dbraw/zinc/93/16/33/1347931633.db2.gz	QXUNGNUDWBTMBO-FCIYXJNOSA-N	0	3	349.478	3.314	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(Cl)c(Cl)[nH]1	ZINC001049626822	1347941174	/nfs/dbraw/zinc/94/11/74/1347941174.db2.gz	SZXDUECYWCEWPR-STQMWFEESA-N	0	3	328.243	3.186	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(Cl)cc1OC	ZINC001049671491	1347965888	/nfs/dbraw/zinc/96/58/88/1347965888.db2.gz	LNMTZLZFNNGIQV-HZPDHXFCSA-N	0	3	334.847	3.214	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1csc(-c2ccco2)n1	ZINC001049677121	1347968062	/nfs/dbraw/zinc/96/80/62/1347968062.db2.gz	RSZNZLMXLVKKFT-LSDHHAIUSA-N	0	3	343.452	3.268	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1ccc(F)cc1Cl	ZINC001049688289	1347971851	/nfs/dbraw/zinc/97/18/51/1347971851.db2.gz	AAIRCDWBUFALEY-SJORKVTESA-N	0	3	336.838	3.273	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@@H]3[C@H]2CCN3Cc2cccc(C#N)c2)CC1	ZINC001049704319	1347982069	/nfs/dbraw/zinc/98/20/69/1347982069.db2.gz	PLUFRIYPMNJNFF-RTBURBONSA-N	0	3	337.467	3.314	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccccc1OC1CCC1	ZINC001049705097	1347982270	/nfs/dbraw/zinc/98/22/70/1347982270.db2.gz	CUPXSBQZSCVXLQ-RBUKOAKNSA-N	0	3	340.467	3.483	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1ccc(Cl)c(F)c1	ZINC001049746102	1347998042	/nfs/dbraw/zinc/99/80/42/1347998042.db2.gz	CNDZKGLVEIWFQY-QZTJIDSGSA-N	0	3	348.849	3.110	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccn(C(CC)CC)n1	ZINC001049766433	1348009663	/nfs/dbraw/zinc/00/96/63/1348009663.db2.gz	KYKRAAAPXGSOPU-RTBURBONSA-N	0	3	344.503	3.499	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccccc1OC	ZINC001049778851	1348017060	/nfs/dbraw/zinc/01/70/60/1348017060.db2.gz	ZFRMUZWOXOLBOS-RDGPPVDQSA-N	0	3	340.467	3.050	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1cccc(C)c1	ZINC001049784826	1348020572	/nfs/dbraw/zinc/02/05/72/1348020572.db2.gz	XNZOZJFFEMHGFT-JSXRDJHFSA-N	0	3	336.479	3.187	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1nc(C2CC2)oc1C	ZINC001049829372	1348044159	/nfs/dbraw/zinc/04/41/59/1348044159.db2.gz	SSDMXEGHBIJRMD-CVEARBPZSA-N	0	3	329.444	3.115	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(C2CC2)s1	ZINC001049839974	1348051871	/nfs/dbraw/zinc/05/18/71/1348051871.db2.gz	KKGBRJTWYFUDLE-CVEARBPZSA-N	0	3	328.481	3.328	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc2c(c1)CCC=C2	ZINC001049846471	1348055891	/nfs/dbraw/zinc/05/58/91/1348055891.db2.gz	INECKVSJORFFLD-RTWAWAEBSA-N	0	3	334.463	3.348	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](CC)Oc1ccccc1F	ZINC001049850158	1348058370	/nfs/dbraw/zinc/05/83/70/1348058370.db2.gz	SDHYTYMCRUQLRC-RCCFBDPRSA-N	0	3	346.446	3.234	20	30		EGEDHN
CC(C)(C)C(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049860101	1348066683	/nfs/dbraw/zinc/06/66/83/1348066683.db2.gz	ZECDRYDTIQMANH-ROUUACIJSA-N	0	3	325.456	3.170	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(F)c(F)cc1Cl	ZINC001049869859	1348075171	/nfs/dbraw/zinc/07/51/71/1348075171.db2.gz	FTRAJOOMSPIRQO-HZPDHXFCSA-N	0	3	340.801	3.483	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(F)c2occc21	ZINC001049905819	1348104103	/nfs/dbraw/zinc/10/41/03/1348104103.db2.gz	BFLNMTIBXYPCKN-ROUUACIJSA-N	0	3	340.398	3.274	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3CCCN(C(=O)[C@H]4CC=CCC4)[C@@H]3C2)cc1	ZINC001049971213	1348138825	/nfs/dbraw/zinc/13/88/25/1348138825.db2.gz	JSNQHAJARORPHU-PCCBWWKXSA-N	0	3	349.478	3.337	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N1CCC[C@H]2CN(Cc3cccc(C#N)c3)C[C@H]21	ZINC001050021361	1348158031	/nfs/dbraw/zinc/15/80/31/1348158031.db2.gz	XHFJLXPGSWIWGS-IPMKNSEASA-N	0	3	337.467	3.027	20	30		EGEDHN
CC(C(=O)N1CCC[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21)=C1CCC1	ZINC001050044638	1348164195	/nfs/dbraw/zinc/16/41/95/1348164195.db2.gz	ZQNRXKWPDDIQKD-LEWJYISDSA-N	0	3	349.478	3.481	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3cn(C(C)(C)C)nc3C)[C@@H]2C1	ZINC001050046416	1348164832	/nfs/dbraw/zinc/16/48/32/1348164832.db2.gz	BVRGGMXOHRGWKN-FUHWJXTLSA-N	0	3	344.503	3.059	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)[C@@H]3CC[C@H](c4ccccc4)O3)[C@@H]2C1	ZINC001050048119	1348165196	/nfs/dbraw/zinc/16/51/96/1348165196.db2.gz	FREFVSCHVXDRFX-NMLBUPMWSA-N	0	3	340.467	3.016	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3ccnn3C(CC)CC)[C@@H]2C1	ZINC001050067136	1348171075	/nfs/dbraw/zinc/17/10/75/1348171075.db2.gz	OWLGHHBHXVPVIP-QFBILLFUSA-N	0	3	344.503	3.357	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)CCc3ccc(OCC)cc3)[C@@H]2C1	ZINC001050081909	1348176209	/nfs/dbraw/zinc/17/62/09/1348176209.db2.gz	XTLAIFIDTROTGJ-AZUAARDMSA-N	0	3	342.483	3.127	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)CCc3cc4ccccc4o3)[C@@H]2C1	ZINC001050088739	1348178445	/nfs/dbraw/zinc/17/84/45/1348178445.db2.gz	MPJWIGVKINGIGK-PKOBYXMFSA-N	0	3	338.451	3.474	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)c3ccc(C)c4cccnc34)[C@@H]2C1	ZINC001050098391	1348182896	/nfs/dbraw/zinc/18/28/96/1348182896.db2.gz	NXYBYGCXASNMCT-FXAWDEMLSA-N	0	3	347.462	3.103	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)[C@@H](C)c3ccc(Cl)cc3)[C@@H]2C1	ZINC001050129853	1348191673	/nfs/dbraw/zinc/19/16/73/1348191673.db2.gz	BJIZKOZTUBZUIL-VDZJLULYSA-N	0	3	344.886	3.390	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)[C@@H]3C[C@H]3c3ccc(C)s3)[C@@H]2C1	ZINC001050160795	1348200360	/nfs/dbraw/zinc/20/03/60/1348200360.db2.gz	TYHWFHKRLDMVLK-YLFCFFPRSA-N	0	3	330.497	3.269	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3ccc4ccccc4n3)[C@@H]2C1	ZINC001050190460	1348206357	/nfs/dbraw/zinc/20/63/57/1348206357.db2.gz	KXOPTVHREPJIEV-FXAWDEMLSA-N	0	3	335.451	3.347	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)Cc3ccc4c(c3)CCCC4)[C@@H]2C1	ZINC001050198981	1348209378	/nfs/dbraw/zinc/20/93/78/1348209378.db2.gz	XHQMLKYOWLZCFF-LEWJYISDSA-N	0	3	338.495	3.217	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H](CC)OC3CCCCC3)C2)CC1	ZINC001050518087	1348282406	/nfs/dbraw/zinc/28/24/06/1348282406.db2.gz	RTCGQVFTMBTCME-IBGZPJMESA-N	0	3	346.515	3.062	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cc4c(cc(C)cc4C)[nH]3)C2)CC1	ZINC001050607392	1348299185	/nfs/dbraw/zinc/29/91/85/1348299185.db2.gz	BKINSWYDRUHRIG-UHFFFAOYSA-N	0	3	349.478	3.346	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C[C@H](C)c3ccccc3C)C2)CC1	ZINC001050691316	1348328774	/nfs/dbraw/zinc/32/87/74/1348328774.db2.gz	WGACXHTUECAYGP-IBGZPJMESA-N	0	3	338.495	3.436	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)[C@H]3CCC[C@H]3OC)cccc2C1	ZINC001051292491	1348421420	/nfs/dbraw/zinc/42/14/20/1348421420.db2.gz	ZEMRKGKLKUJHHW-VQTJNVASSA-N	0	3	342.483	3.052	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3ccc(CC)o3)cccc2C1	ZINC001051293897	1348422561	/nfs/dbraw/zinc/42/25/61/1348422561.db2.gz	YYOKGFZUVHFLMW-UHFFFAOYSA-N	0	3	336.435	3.153	20	30		EGEDHN
C=CCCN1CCN([C@H]2CCN(C(=O)CC3CCCCCC3)C2)CC1	ZINC001052086527	1348501592	/nfs/dbraw/zinc/50/15/92/1348501592.db2.gz	ULKNNKUCCYKSPA-FQEVSTJZSA-N	0	3	347.547	3.142	20	30		EGEDHN
C[C@H](C(=O)N[C@@H]1CCCN(Cc2ccc(C#N)cc2)CC1)C1CC1	ZINC001052283087	1348516960	/nfs/dbraw/zinc/51/69/60/1348516960.db2.gz	VGJQFVMLNAKWQM-HNAYVOBHSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@@H]2C[C@H]2c2sccc2C)CC1	ZINC001052376512	1348534767	/nfs/dbraw/zinc/53/47/67/1348534767.db2.gz	HGNCCSOOGYHUHE-BRWVUGGUSA-N	0	3	330.497	3.154	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cscc2C(F)F)CC1	ZINC001052388020	1348538672	/nfs/dbraw/zinc/53/86/72/1348538672.db2.gz	YRXGAXKWZBOUSK-LBPRGKRZSA-N	0	3	326.412	3.293	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)c1cc(C)oc1C	ZINC001133640489	1376130918	/nfs/dbraw/zinc/13/09/18/1376130918.db2.gz	IIIGHGMQILFMEB-GHMZBOCLSA-N	0	3	343.265	3.292	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cc3c([nH]2)c(F)ccc3C)CC1	ZINC001052512646	1348563408	/nfs/dbraw/zinc/56/34/08/1348563408.db2.gz	OESKFXXRIWVMGX-OAHLLOKOSA-N	0	3	341.430	3.223	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2ccc(OC)c(C(C)C)c2)CC1	ZINC001052531580	1348567932	/nfs/dbraw/zinc/56/79/32/1348567932.db2.gz	KIHKZXIVFSVYPQ-KRWDZBQOSA-N	0	3	328.456	3.036	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc(C)nc2C(C)C)CC1	ZINC001052598377	1348590926	/nfs/dbraw/zinc/59/09/26/1348590926.db2.gz	LMEROWMWHDIFHJ-QGZVFWFLSA-N	0	3	327.472	3.121	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@@H]2C[C@H]2c2c(F)cccc2F)CC1	ZINC001052696984	1348639022	/nfs/dbraw/zinc/63/90/22/1348639022.db2.gz	WNNHDEZZTQXQDG-BZUAXINKSA-N	0	3	346.421	3.062	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@H](NC(=O)[C@@H]3CC34CCC4)CC2)c1	ZINC001052755245	1348664904	/nfs/dbraw/zinc/66/49/04/1348664904.db2.gz	SMXVLDJFIUEKNX-OALUTQOASA-N	0	3	337.467	3.219	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N[C@H]1CCCN(C/C=C/Cl)CC1	ZINC001052779510	1348675762	/nfs/dbraw/zinc/67/57/62/1348675762.db2.gz	GXUJCSCJIOQSBR-PBTNIWHWSA-N	0	3	340.895	3.081	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc(-c3ccccc3)[nH]2)CC1	ZINC001052973039	1348781687	/nfs/dbraw/zinc/78/16/87/1348781687.db2.gz	ZMEYTMDBAMSNGF-GOSISDBHSA-N	0	3	335.451	3.289	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@H]([C@@H]2CCCN(C/C=C\Cl)C2)C1	ZINC001053023308	1348821751	/nfs/dbraw/zinc/82/17/51/1348821751.db2.gz	HYBHZAZADRPGHG-MEBKWMQKSA-N	0	3	334.891	3.103	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCC[C@@H]([C@H]2CCCN(CCF)C2)C1	ZINC001053029173	1348828649	/nfs/dbraw/zinc/82/86/49/1348828649.db2.gz	QFTWTGSZYZJQAG-ZWKOTPCHSA-N	0	3	347.478	3.208	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2occc2C)C1	ZINC001053067557	1348880701	/nfs/dbraw/zinc/88/07/01/1348880701.db2.gz	RUAYUFKHDKKDMU-ZWKOTPCHSA-N	0	3	328.456	3.318	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)C2C(C)(C)C2(C)C)C1	ZINC001053076552	1348894460	/nfs/dbraw/zinc/89/44/60/1348894460.db2.gz	PPUHJELNFKCUJV-DLBZAZTESA-N	0	3	330.516	3.395	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cscc2C)C1	ZINC001053077002	1348895733	/nfs/dbraw/zinc/89/57/33/1348895733.db2.gz	XFUQUPJLBHMPDP-SJLPKXTDSA-N	0	3	330.497	3.396	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCCC[C@@H]2[C@H]2CCCN(CC#CC)C2)cc1	ZINC001053092476	1348919050	/nfs/dbraw/zinc/91/90/50/1348919050.db2.gz	HDSJLHQGQDKRKW-FCHUYYIVSA-N	0	3	348.490	3.398	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)C2CC3(CCC3)C2)C1	ZINC001053092751	1348919067	/nfs/dbraw/zinc/91/90/67/1348919067.db2.gz	IUDCMBUYOGBPNP-HKUYNNGSSA-N	0	3	328.500	3.293	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)C2CC3(CC3)C2)C1	ZINC001053098925	1348930251	/nfs/dbraw/zinc/93/02/51/1348930251.db2.gz	RBDKNTQPQGELBY-HKUYNNGSSA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2sccc2OC)C1	ZINC001053103700	1348937797	/nfs/dbraw/zinc/93/77/97/1348937797.db2.gz	KWGWPXOCEFNYBR-CVEARBPZSA-N	0	3	346.496	3.097	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(F)s2)C1	ZINC001053106111	1348944331	/nfs/dbraw/zinc/94/43/31/1348944331.db2.gz	SFRXFVUAFODMPP-GJZGRUSLSA-N	0	3	334.460	3.227	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)C[C@@H]1CCC(F)(F)C1)C2	ZINC001054143038	1349153407	/nfs/dbraw/zinc/15/34/07/1349153407.db2.gz	MUOYHKYKOFRTSD-WMZOPIPTSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)C1CCC3(CC3)CC1)C2	ZINC001054164545	1349167106	/nfs/dbraw/zinc/16/71/06/1349167106.db2.gz	LYUFRHBVZSOVDI-OAQYLSRUSA-N	0	3	328.500	3.295	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)Cc1ccc(C(F)F)cc1)C2	ZINC001054164107	1349167246	/nfs/dbraw/zinc/16/72/46/1349167246.db2.gz	ZOCFTKZBZLLJBZ-FQEVSTJZSA-N	0	3	346.421	3.114	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cccc3ncccc31)C2	ZINC001054173347	1349174454	/nfs/dbraw/zinc/17/44/54/1349174454.db2.gz	NTPZZMJCKNETFF-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
CC[C@H](F)C(=O)N1CCC[C@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001054176082	1349177492	/nfs/dbraw/zinc/17/74/92/1349177492.db2.gz	BIMRFNFQHNVOTL-AZUAARDMSA-N	0	3	343.446	3.121	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N1CCC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001054180486	1349183438	/nfs/dbraw/zinc/18/34/38/1349183438.db2.gz	UGHLUIPUDRYTKS-LRQRDZAKSA-N	0	3	337.467	3.029	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)C(C)(C)c1cccc(F)c1)C2	ZINC001054195883	1349198763	/nfs/dbraw/zinc/19/87/63/1349198763.db2.gz	FMRMINWNFFOZKA-OAQYLSRUSA-N	0	3	342.458	3.051	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(C(C)C)nc1C)C2	ZINC001054199186	1349201195	/nfs/dbraw/zinc/20/11/95/1349201195.db2.gz	PMHXEWRGWNPMNB-OAQYLSRUSA-N	0	3	339.483	3.075	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H](C)c1ccc(CC)cc1)C2	ZINC001054214787	1349213843	/nfs/dbraw/zinc/21/38/43/1349213843.db2.gz	HAKVLBNZNOKHIV-PGRDOPGGSA-N	0	3	338.495	3.300	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1cccn1C1CCCC1)C2	ZINC001054218132	1349215792	/nfs/dbraw/zinc/21/57/92/1349215792.db2.gz	MICKEWRJMCSFFE-NRFANRHFSA-N	0	3	339.483	3.165	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)CCc1ccc(CC)cc1)C2	ZINC001054238550	1349232500	/nfs/dbraw/zinc/23/25/00/1349232500.db2.gz	XLUVKKIGLVEVSA-JOCHJYFZSA-N	0	3	338.495	3.129	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H](C)c1cccc(F)c1)C2	ZINC001054243132	1349237055	/nfs/dbraw/zinc/23/70/55/1349237055.db2.gz	XEQKISDEHVFTSI-UWJYYQICSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc3ccccc3n1CC)C2	ZINC001054245584	1349239661	/nfs/dbraw/zinc/23/96/61/1349239661.db2.gz	VZVZSNMRPISLPK-JOCHJYFZSA-N	0	3	349.478	3.223	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3ccn(C(F)F)n3)cc2C1	ZINC001054267311	1349265008	/nfs/dbraw/zinc/26/50/08/1349265008.db2.gz	MJFZLRMIRJCXOX-UHFFFAOYSA-N	0	3	346.381	3.100	20	30		EGEDHN
C=CCn1cccc1C(=O)NCc1ccc2c(c1)CN(CC1CC1)C2	ZINC001054268250	1349266751	/nfs/dbraw/zinc/26/67/51/1349266751.db2.gz	RSHIYYLAFXDCNG-UHFFFAOYSA-N	0	3	335.451	3.330	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@@H]3CO[C@@H](C)C3)cc2C1	ZINC001054271268	1349270973	/nfs/dbraw/zinc/27/09/73/1349270973.db2.gz	KBHVAHVVLWHIJE-KXBFYZLASA-N	0	3	328.456	3.010	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@H]3CCC[C@@H](OC)C3)cc2C1	ZINC001054278880	1349280242	/nfs/dbraw/zinc/28/02/42/1349280242.db2.gz	QECLVYJFTCRVRQ-FXAWDEMLSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3ccnc(C4CC4)n3)cc2C1	ZINC001054284451	1349285813	/nfs/dbraw/zinc/28/58/13/1349285813.db2.gz	STKIBNBUZZPJMC-UHFFFAOYSA-N	0	3	348.450	3.176	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@@H]3COc4ccccc43)cc2C1	ZINC001054293034	1349299447	/nfs/dbraw/zinc/29/94/47/1349299447.db2.gz	KOQPQXBBMLMJCC-HXUWFJFHSA-N	0	3	348.446	3.371	20	30		EGEDHN
Cc1sccc1C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001054626736	1349420547	/nfs/dbraw/zinc/42/05/47/1349420547.db2.gz	CUZVVWMNKKHWLL-BDJLRTHQSA-N	0	3	345.493	3.240	20	30		EGEDHN
Cc1csc(C(=O)N2C[C@@H](C)[C@H](NCc3ccc(C#N)s3)C2)c1	ZINC001054633183	1349422984	/nfs/dbraw/zinc/42/29/84/1349422984.db2.gz	JGSDPAGBXFVPGA-IUODEOHRSA-N	0	3	345.493	3.240	20	30		EGEDHN
C[C@H]1CN(C(=O)C(C)(C)C2CCC2)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054936540	1349519343	/nfs/dbraw/zinc/51/93/43/1349519343.db2.gz	MAGFCMJUOLYLBS-GUYCJALGSA-N	0	3	345.512	3.383	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2cc(-c3ccccc3)ccn2)C1	ZINC001080672236	1357720115	/nfs/dbraw/zinc/72/01/15/1357720115.db2.gz	NWFNPIPSZAHIIJ-OXQOHEQNSA-N	0	3	335.451	3.375	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2ccc(OC)c(C3CC3)c2)C1	ZINC001080692022	1357722150	/nfs/dbraw/zinc/72/21/50/1357722150.db2.gz	SWXUOHKJRVXDKR-RDTXWAMCSA-N	0	3	328.456	3.199	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C1CCC3(CC3)CC1)C[C@@H](C)O2	ZINC001071189739	1354495246	/nfs/dbraw/zinc/49/52/46/1354495246.db2.gz	OWTSWMNOHVSWTJ-DYESRHJHSA-N	0	3	346.515	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1cc(C)ccc1C)C[C@@H](C)O2	ZINC001071235838	1354519549	/nfs/dbraw/zinc/51/95/49/1354519549.db2.gz	LDQNKWILYQRWRG-NQIIRXRSSA-N	0	3	342.483	3.185	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1cc(C)cc(C)c1)C[C@@H](C)O2	ZINC001071236640	1354520649	/nfs/dbraw/zinc/52/06/49/1354520649.db2.gz	XISGKCNAYHXFQZ-WIYYLYMNSA-N	0	3	342.483	3.185	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1cc(C)c(C)s1)C[C@H](C)O2	ZINC001071238434	1354521745	/nfs/dbraw/zinc/52/17/45/1354521745.db2.gz	MMSRVOOAZWCILF-HNAYVOBHSA-N	0	3	348.512	3.246	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C1CCC=CCC1)C[C@@H](C)O2	ZINC001071244553	1354524221	/nfs/dbraw/zinc/52/42/21/1354524221.db2.gz	WSRXUZXEKATECL-YLJYHZDGSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C1CCC(C)(C)CC1)C[C@@H](C)O2	ZINC001071246180	1354526515	/nfs/dbraw/zinc/52/65/15/1354526515.db2.gz	QCLYUHVYZUKMSK-DYESRHJHSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2sc(C3CC3)nc2C)CC[C@H]1C	ZINC001071508500	1354733357	/nfs/dbraw/zinc/73/33/57/1354733357.db2.gz	PBKNJJVDGDMQBC-IUODEOHRSA-N	0	3	333.501	3.488	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc3ccccc3c(=O)[nH]2)CC[C@H]1C	ZINC001071567743	1354767243	/nfs/dbraw/zinc/76/72/43/1354767243.db2.gz	BVZDGEHCZWWRLS-GDBMZVCRSA-N	0	3	339.439	3.099	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cn2c(C)cc3ccccc32)CC[C@@H]1C	ZINC001071660313	1354832738	/nfs/dbraw/zinc/83/27/38/1354832738.db2.gz	UAWCKOREXIBJHE-QFBILLFUSA-N	0	3	339.483	3.495	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2cc(C)ccc2OC)CC[C@H]1C	ZINC001071664177	1354835987	/nfs/dbraw/zinc/83/59/87/1354835987.db2.gz	ZMVLUXOOCCMHMI-SJLPKXTDSA-N	0	3	330.472	3.091	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)c2cn(CC)c3ccccc23)CC[C@H]1C	ZINC001071670583	1354840222	/nfs/dbraw/zinc/84/02/22/1354840222.db2.gz	NHKPFTBGXYQOME-CVEARBPZSA-N	0	3	325.456	3.430	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2ncsc2C(F)(F)F)CC[C@@H]1C	ZINC001071682634	1354849489	/nfs/dbraw/zinc/84/94/89/1354849489.db2.gz	ONNJQAZNZRCATK-WDEREUQCSA-N	0	3	347.406	3.321	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2cnc(CC3CC3)s2)CC[C@@H]1C	ZINC001071692026	1354853307	/nfs/dbraw/zinc/85/33/07/1354853307.db2.gz	DXHQLTFFAAMEDZ-ZFWWWQNUSA-N	0	3	333.501	3.254	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(C)nc2C2CC2)CC[C@@H]1C	ZINC001071704511	1354862478	/nfs/dbraw/zinc/86/24/78/1354862478.db2.gz	AJLCCFJCDUQWCH-DOTOQJQBSA-N	0	3	327.472	3.426	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2cc3c(C)nn(C)c3s2)CC[C@H]1C	ZINC001071719700	1354876852	/nfs/dbraw/zinc/87/68/52/1354876852.db2.gz	YYQVKHCZRNGMNY-OCCSQVGLSA-N	0	3	346.500	3.102	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2cc3c(C)nn(C)c3s2)CC[C@@H]1C	ZINC001071719698	1354877595	/nfs/dbraw/zinc/87/75/95/1354877595.db2.gz	YYQVKHCZRNGMNY-JSGCOSHPSA-N	0	3	346.500	3.102	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2(c3cccc(F)c3)CCC2)CC[C@H]1C	ZINC001071728263	1354884269	/nfs/dbraw/zinc/88/42/69/1354884269.db2.gz	KANCJDLSIONSBF-APWZRJJASA-N	0	3	342.458	3.240	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2nsc3ccc(C)cc32)CC[C@H]1C	ZINC001071742643	1354893715	/nfs/dbraw/zinc/89/37/15/1354893715.db2.gz	RWXNREGUSUEHCG-CABCVRRESA-N	0	3	341.480	3.211	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CC[C@@H](C)N(Cc3ccccc3C)C2)c1	ZINC001071816015	1354956720	/nfs/dbraw/zinc/95/67/20/1354956720.db2.gz	SYZGEMNVLGJURH-DYESRHJHSA-N	0	3	347.462	3.154	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2ccc(Cl)s2)CC[C@H]1C	ZINC001071870518	1354995838	/nfs/dbraw/zinc/99/58/38/1354995838.db2.gz	BBQPIVPLIHIKRM-OLZOCXBDSA-N	0	3	326.893	3.489	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2ccc(Cl)s2)CC[C@H]1C	ZINC001071870510	1354996532	/nfs/dbraw/zinc/99/65/32/1354996532.db2.gz	BBQPIVPLIHIKRM-CHWSQXEVSA-N	0	3	326.893	3.489	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccccc2NC(=O)CC)CC[C@@H]1C	ZINC001071908434	1355018943	/nfs/dbraw/zinc/01/89/43/1355018943.db2.gz	VQMNYTXLWKTIHS-JKSUJKDBSA-N	0	3	343.471	3.194	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cnn(C3CCCC3)c2C)CC[C@@H]1C	ZINC001071977891	1355057265	/nfs/dbraw/zinc/05/72/65/1355057265.db2.gz	UKQAUBXRMAJESA-DOTOQJQBSA-N	0	3	344.503	3.465	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2c(C)nn(C(C)C)c2C)CC[C@H]1C	ZINC001071982717	1355058256	/nfs/dbraw/zinc/05/82/56/1355058256.db2.gz	PSEDUMOEAYDSMP-QAPCUYQASA-N	0	3	346.519	3.169	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2c[nH]c3ccccc23)CC[C@@H]1C	ZINC001072012949	1355076714	/nfs/dbraw/zinc/07/67/14/1355076714.db2.gz	VQRXEYJZYBAGJC-RDJZCZTQSA-N	0	3	325.456	3.256	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2ccc(Br)o2)CC[C@@H]1C	ZINC001072019200	1355081752	/nfs/dbraw/zinc/08/17/52/1355081752.db2.gz	DZSGCWRISGBTDC-NWDGAFQWSA-N	0	3	341.249	3.201	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)[C@@]2(c3ccccc3)C[C@H](F)C2)CC[C@@H]1C	ZINC001072030629	1355091086	/nfs/dbraw/zinc/09/10/86/1355091086.db2.gz	SHXKEZRPJMVMIU-WBKMXMRLSA-N	0	3	342.458	3.049	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)Cc2coc3cc(C)ccc23)CC[C@@H]1C	ZINC001072048394	1355102679	/nfs/dbraw/zinc/10/26/79/1355102679.db2.gz	JYIVZWXWRGSLMC-WMZOPIPTSA-N	0	3	338.451	3.276	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2(c3ccc(Cl)cc3)CC2)CC[C@H]1C	ZINC001072049870	1355103396	/nfs/dbraw/zinc/10/33/96/1355103396.db2.gz	RJNFVGFPHTUDEW-QAPCUYQASA-N	0	3	344.886	3.364	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2(c3ccccc3)CCCC2)CC[C@H]1C	ZINC001072053924	1355105314	/nfs/dbraw/zinc/10/53/14/1355105314.db2.gz	WKNVHYLUKISFQX-UYAOXDASSA-N	0	3	338.495	3.491	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)c2c[nH]c3c2cccc3CC)CC[C@@H]1C	ZINC001072098824	1355128396	/nfs/dbraw/zinc/12/83/96/1355128396.db2.gz	GXUOGDWYHSRFOC-GOEBONIOSA-N	0	3	325.456	3.499	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccccc2OCC2CC2)CC[C@H]1C	ZINC001072099081	1355129136	/nfs/dbraw/zinc/12/91/36/1355129136.db2.gz	LGSVTUSEBUODCG-SJLPKXTDSA-N	0	3	340.467	3.081	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2(c3ccc(C)cc3)CCC2)CC[C@H]1C	ZINC001072101935	1355130875	/nfs/dbraw/zinc/13/08/75/1355130875.db2.gz	LQGNPPGHDFJZPA-QUCCMNQESA-N	0	3	338.495	3.409	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2coc(C3CCCCC3)n2)CC[C@H]1C	ZINC001072102001	1355131473	/nfs/dbraw/zinc/13/14/73/1355131473.db2.gz	MAUHTEFUGBBGKT-NVXWUHKLSA-N	0	3	343.471	3.328	20	30		EGEDHN
C#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)C2CCCC2)CC1	ZINC001072129562	1355145303	/nfs/dbraw/zinc/14/53/03/1355145303.db2.gz	MFVOGSJAZTYHCA-FQEVSTJZSA-N	0	3	339.483	3.088	20	30		EGEDHN
CCCC(=O)N1CC[C@H](C)[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001072162899	1355160404	/nfs/dbraw/zinc/16/04/04/1355160404.db2.gz	GMAHHAFDWWRDEP-WMLDXEAASA-N	0	3	331.435	3.072	20	30		EGEDHN
C[C@@H]1CCN(C(=O)c2ccccc2)C[C@@H]1CNCc1ccccc1C#N	ZINC001072174607	1355168941	/nfs/dbraw/zinc/16/89/41/1355168941.db2.gz	BAMAUPDBRJAZRA-UTKZUKDTSA-N	0	3	347.462	3.446	20	30		EGEDHN
C[C@H]1CCN(C(=O)C=C2CCC2)C[C@H]1CNCc1ccccc1C#N	ZINC001072252726	1355209752	/nfs/dbraw/zinc/20/97/52/1355209752.db2.gz	ZHBSCKCPYXHFST-OXJNMPFZSA-N	0	3	337.467	3.243	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](C)[C@H](CNCc2csc(C)n2)C1	ZINC001072334925	1355243848	/nfs/dbraw/zinc/24/38/48/1355243848.db2.gz	JULJUIQVCUAAKO-DZGCQCFKSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](C)[C@H](CNCc2ncc(C)s2)C1	ZINC001072334987	1355244432	/nfs/dbraw/zinc/24/44/32/1355244432.db2.gz	KMZYXIQBNBAMRO-UKRRQHHQSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](C)[C@@H](CNCc2ccccc2C#N)C1	ZINC001072338518	1355246048	/nfs/dbraw/zinc/24/60/48/1355246048.db2.gz	CMSHTZOHWJZTJD-APWZRJJASA-N	0	3	339.483	3.345	20	30		EGEDHN
CCC1(C(=O)N2CC[C@H](C)[C@H](CNCc3ccccc3C#N)C2)CC1	ZINC001072364207	1355258587	/nfs/dbraw/zinc/25/85/87/1355258587.db2.gz	QCTCQSBWLHQTMI-QFBILLFUSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@@H]3CCC[C@H](C(F)(F)F)C3)C2)C1	ZINC001072884452	1355483927	/nfs/dbraw/zinc/48/39/27/1355483927.db2.gz	VFPMGAYPGQVRHB-KGLIPLIRSA-N	0	3	330.394	3.075	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)CC[C@H]3CCc4ccccc43)C2)C1	ZINC001073450679	1355786209	/nfs/dbraw/zinc/78/62/09/1355786209.db2.gz	DTNJSIZMLMZKQQ-LJQANCHMSA-N	0	3	336.479	3.054	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCCN1C(=O)C1CC=CC1	ZINC001073978611	1356007746	/nfs/dbraw/zinc/00/77/46/1356007746.db2.gz	QUKFCQBWANPZDD-HXUWFJFHSA-N	0	3	337.467	3.337	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(C#N)cc1	ZINC001074049548	1356053723	/nfs/dbraw/zinc/05/37/23/1356053723.db2.gz	QFFKJHNSRFUVPQ-IPELMVKDSA-N	0	3	325.456	3.027	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1nc(Cl)sc1C)C2	ZINC001097509841	1363030083	/nfs/dbraw/zinc/03/00/83/1363030083.db2.gz	NBIMDGBGCZSPLK-UTUOFQBUSA-N	0	3	325.865	3.016	20	30		EGEDHN
CC#CCN1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)C2CCC2)C1	ZINC001075419069	1356363252	/nfs/dbraw/zinc/36/32/52/1356363252.db2.gz	PYGBAVCUOGODAR-UYAOXDASSA-N	0	3	342.458	3.171	20	30		EGEDHN
C=CCCN1C[C@@H]2CCN(C(=O)c3nc(C(C)(C)C)cs3)[C@@H]2C1	ZINC001075909833	1356444308	/nfs/dbraw/zinc/44/43/08/1356444308.db2.gz	ALVLKZFHKQQKCL-UONOGXRCSA-N	0	3	333.501	3.163	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@H]3Cc4c3cccc4Cl)[C@@H]2C1	ZINC001076623015	1356636439	/nfs/dbraw/zinc/63/64/39/1356636439.db2.gz	BXXOGHHSAMDNST-QANKJYHBSA-N	0	3	330.859	3.089	20	30		EGEDHN
C=C(C)CCN1C[C@@H](O)[C@H](NC(=O)c2ccccc2CC(C)(C)C)C1	ZINC001077199348	1356743369	/nfs/dbraw/zinc/74/33/69/1356743369.db2.gz	KIKBPRNPJMTAGR-RTBURBONSA-N	0	3	344.499	3.016	20	30		EGEDHN
C=C(C)CCN1C[C@@H](O)[C@H](NC(=O)C2CCC(CCCC)CC2)C1	ZINC001078137361	1356912384	/nfs/dbraw/zinc/91/23/84/1356912384.db2.gz	VVNATJAYAQBRJD-CSODTCANSA-N	0	3	336.520	3.111	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc(C)c(OC)c2)C12CCC2	ZINC001078676408	1357050517	/nfs/dbraw/zinc/05/05/17/1357050517.db2.gz	WFPFXBSCBPFYHI-DLBZAZTESA-N	0	3	348.874	3.387	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2c(C)cncc2C)C12CCC2	ZINC001078680282	1357052584	/nfs/dbraw/zinc/05/25/84/1357052584.db2.gz	NQWAAQQDWAPILX-LSDHHAIUSA-N	0	3	333.863	3.082	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2C[C@@H](NCC(=C)Cl)C23CCC3)cc1	ZINC001078698716	1357060530	/nfs/dbraw/zinc/06/05/30/1357060530.db2.gz	UOVDZTWWVGCTEP-SJORKVTESA-N	0	3	328.843	3.051	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2C[C@H](NCc3ncccc3C)C23CCC3)C1	ZINC001078720581	1357066077	/nfs/dbraw/zinc/06/60/77/1357066077.db2.gz	NIRYVNDZQKPIRU-ZWKOTPCHSA-N	0	3	339.483	3.263	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc(CCC)on2)C12CCC2	ZINC001078768690	1357074551	/nfs/dbraw/zinc/07/45/51/1357074551.db2.gz	VBSKTDWQNIOSHX-GJZGRUSLSA-N	0	3	337.851	3.010	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H]2C[C@@H]3CCCC[C@H]23)C[C@H]1c1ccccc1	ZINC001081151906	1357845153	/nfs/dbraw/zinc/84/51/53/1357845153.db2.gz	VRNCAQDLFZBQQM-JRSUCEMESA-N	0	3	336.479	3.030	20	30		EGEDHN
C[C@@H](N[C@@H]1CN(C(=O)C#CC2CC2)C[C@H]1C)c1ccccc1Cl	ZINC001082502780	1358051452	/nfs/dbraw/zinc/05/14/52/1358051452.db2.gz	KELWQPCXXMINMU-HBUWYVDXSA-N	0	3	330.859	3.251	20	30		EGEDHN
C[C@@H](C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1)C(C)(C)C	ZINC001082595119	1358065177	/nfs/dbraw/zinc/06/51/77/1358065177.db2.gz	XFILQSXYXLLKFT-DVOMOZLQSA-N	0	3	333.501	3.238	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)c3cccc(-n4cccc4)c3)[C@@H]2C1	ZINC001084493425	1358225070	/nfs/dbraw/zinc/22/50/70/1358225070.db2.gz	RLYFESCVLVUTTP-UYAOXDASSA-N	0	3	335.451	3.200	20	30		EGEDHN
C#Cc1ccc(C(=O)N2C[C@H]3CCN(CCc4ccccc4)C[C@H]32)cc1	ZINC001084567790	1358239367	/nfs/dbraw/zinc/23/93/67/1358239367.db2.gz	JPRDJVLZVMVJNA-FGZHOGPDSA-N	0	3	344.458	3.057	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3ncoc3C(C)(C)C)[C@@H]2C1	ZINC001084763555	1358303540	/nfs/dbraw/zinc/30/35/40/1358303540.db2.gz	RKOOCYWFGNQYIT-HUUCEWRRSA-N	0	3	331.460	3.085	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CCN(C(=O)[C@@H]4CC=CCC4)C[C@@H]32)cc1	ZINC001084888183	1358340854	/nfs/dbraw/zinc/34/08/54/1358340854.db2.gz	AWHQEADERXQELO-NJYVYQBISA-N	0	3	349.478	3.337	20	30		EGEDHN
Cc1cccc(Cl)c1CN1CC[C@@H]2CCN(C(=O)[C@@H](C)C#N)C[C@@H]21	ZINC001084906694	1358344159	/nfs/dbraw/zinc/34/41/59/1358344159.db2.gz	CVWHPRJRJUDQGN-DAYGRLMNSA-N	0	3	345.874	3.231	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3cc(C)n([C@@H](C)CC)n3)C[C@@H]21	ZINC001084977330	1358358090	/nfs/dbraw/zinc/35/80/90/1358358090.db2.gz	YVAKJXUHAKKAQG-WDYCEAGBSA-N	0	3	344.503	3.275	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CCN(C(=O)[C@]45C[C@H]4CCC5)C[C@@H]32)c1	ZINC001084993805	1358360785	/nfs/dbraw/zinc/36/07/85/1358360785.db2.gz	BWKZNNJSJOWIGI-XWSHUIEDSA-N	0	3	349.478	3.171	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@H](C)OC3CCCCCC3)C[C@@H]21	ZINC001085028103	1358371662	/nfs/dbraw/zinc/37/16/62/1358371662.db2.gz	MMAPAJBIMURCKU-SCTDSRPQSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@H](CC)Oc3cccc(C)c3)C[C@@H]21	ZINC001085054900	1358380248	/nfs/dbraw/zinc/38/02/48/1358380248.db2.gz	BGMXWFJNKMMKOS-YZGWKJHDSA-N	0	3	342.483	3.261	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@H]3Cc4ccc(Cl)cc43)C[C@@H]21	ZINC001085085030	1358387145	/nfs/dbraw/zinc/38/71/45/1358387145.db2.gz	SSXSMQGCEOMNEZ-BVGQSLNGSA-N	0	3	330.859	3.089	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)CC[C@@H]3CCc4ccccc43)C[C@@H]21	ZINC001085098447	1358390871	/nfs/dbraw/zinc/39/08/71/1358390871.db2.gz	SAOJKVWRAOYZTG-ZVDOUQERSA-N	0	3	336.479	3.053	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1c(Cl)n[nH]c1CC	ZINC001085222114	1358437202	/nfs/dbraw/zinc/43/72/02/1358437202.db2.gz	FCHIRIXUDQZNTE-VXGBXAGGSA-N	0	3	345.274	3.009	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cc(C(C)C)on1	ZINC001085287475	1358452786	/nfs/dbraw/zinc/45/27/86/1358452786.db2.gz	JFOWAIPGMZONQD-CHWSQXEVSA-N	0	3	325.840	3.181	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCCC[C@H]2NCc2cc(C)ncn2)CC1	ZINC001085321277	1358465428	/nfs/dbraw/zinc/46/54/28/1358465428.db2.gz	PCHMEMSMYPIAAF-RTBURBONSA-N	0	3	342.487	3.048	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccc(OCC)cc1	ZINC001085410134	1358492853	/nfs/dbraw/zinc/49/28/53/1358492853.db2.gz	HBZKRMRHQCEHBP-IAGOWNOFSA-N	0	3	336.863	3.468	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccccc1N(C)C	ZINC001085438338	1358500634	/nfs/dbraw/zinc/50/06/34/1358500634.db2.gz	IWBKMQULOFGJHT-HZPDHXFCSA-N	0	3	335.879	3.136	20	30		EGEDHN
CN(C[C@@H]1CCN1CCCC1CCCC1)C(=O)c1c[nH]c(C#N)c1	ZINC001085556507	1358592819	/nfs/dbraw/zinc/59/28/19/1358592819.db2.gz	RXTHMBLLICWTNO-SFHVURJKSA-N	0	3	328.460	3.003	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccnn1C(CC)CC	ZINC001085639538	1358652390	/nfs/dbraw/zinc/65/23/90/1358652390.db2.gz	QRDKPRRHTSLZHR-QGZVFWFLSA-N	0	3	332.492	3.357	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1cc(C2CCCCC2)n[nH]1	ZINC001085644131	1358656065	/nfs/dbraw/zinc/65/60/65/1358656065.db2.gz	GVGHCJWTNZATDF-INIZCTEOSA-N	0	3	330.476	3.180	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cccc([C@@H]2CCOC2)c1	ZINC001085682130	1358684177	/nfs/dbraw/zinc/68/41/77/1358684177.db2.gz	NTCBOMCTCHLIBG-WOJBJXKFSA-N	0	3	342.483	3.303	20	30		EGEDHN
C=C1CCC(C(=O)N(C)C[C@H]2CCN2CC[C@H]2CCCCO2)CC1	ZINC001085800799	1358776577	/nfs/dbraw/zinc/77/65/77/1358776577.db2.gz	BWEQVXOBAAYPJU-RTBURBONSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C1CCC(C(=O)N(C)C[C@@H]2CCN2C[C@@H](OC)C2CCC2)CC1	ZINC001085801616	1358777414	/nfs/dbraw/zinc/77/74/14/1358777414.db2.gz	XRJDICGZCSRPPK-RBUKOAKNSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1ccc(C(F)F)c(F)c1	ZINC001085818159	1358792080	/nfs/dbraw/zinc/79/20/80/1358792080.db2.gz	SKAIBKOKEIYLAU-ZDUSSCGKSA-N	0	3	326.362	3.486	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@@H]1CCc2cccc(OC)c21	ZINC001085859565	1358826846	/nfs/dbraw/zinc/82/68/46/1358826846.db2.gz	DMXIQUILGIUINQ-ZWKOTPCHSA-N	0	3	342.483	3.224	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N(C)C[C@@H]1CCN1CCCC1CCC1	ZINC001085870234	1358835127	/nfs/dbraw/zinc/83/51/27/1358835127.db2.gz	NOPPUGJWUUXGKY-FHWLQOOXSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1cccc(N2CCCC2)c1	ZINC001085890838	1358850393	/nfs/dbraw/zinc/85/03/93/1358850393.db2.gz	JVFRPIFPWHBRFI-IBGZPJMESA-N	0	3	327.472	3.009	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cnn(CCC)c1C1CC1	ZINC001085917409	1358877589	/nfs/dbraw/zinc/87/75/89/1358877589.db2.gz	YZSAIXXYMAUCMI-KRWDZBQOSA-N	0	3	344.503	3.283	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1ccc(C(F)(F)F)cc1	ZINC001085940966	1358898429	/nfs/dbraw/zinc/89/84/29/1358898429.db2.gz	URHJFXQUDXTSJR-HNNXBMFYSA-N	0	3	326.362	3.428	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc(OC)c(OC)cc1C	ZINC001085982940	1358935029	/nfs/dbraw/zinc/93/50/29/1358935029.db2.gz	VEEOQZRHKIQZCW-MRXNPFEDSA-N	0	3	346.471	3.125	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2c(C)[nH]c3ccccc32)C1	ZINC001086142674	1359007060	/nfs/dbraw/zinc/00/70/60/1359007060.db2.gz	IBJDKZOLLFUILJ-OKILXGFUSA-N	0	3	331.847	3.327	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc3ccc(C)cc3[nH]2)C1	ZINC001086162263	1359012272	/nfs/dbraw/zinc/01/22/72/1359012272.db2.gz	CLCRHTJNGWWWSX-OTVXOJSOSA-N	0	3	331.847	3.327	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cccc(N3CCCC3)c2)C1	ZINC001086231013	1359033974	/nfs/dbraw/zinc/03/39/74/1359033974.db2.gz	MLQRUYVKQNMPHA-WOVMCDHWSA-N	0	3	347.890	3.137	20	30		EGEDHN
CC[C@@]1(C)C[C@@H]1C(=O)NC[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001086239426	1359037001	/nfs/dbraw/zinc/03/70/01/1359037001.db2.gz	FCAVKWUNBPCAMK-ASKNOMKYSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc(C)cc(Cl)c2)C1	ZINC001086428333	1359094621	/nfs/dbraw/zinc/09/46/21/1359094621.db2.gz	NPYMJOIUVWUWAZ-NNUKFRKNSA-N	0	3	327.255	3.499	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(C)nc2C(C)C)C1	ZINC001086440653	1359097961	/nfs/dbraw/zinc/09/79/61/1359097961.db2.gz	JOUNHTVYUWYLRO-SHTZXODSSA-N	0	3	335.879	3.364	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cnc3ccsc3c2)C1	ZINC001086446933	1359099365	/nfs/dbraw/zinc/09/93/65/1359099365.db2.gz	YXLIQRRFUDEJJD-AULYBMBSSA-N	0	3	335.860	3.147	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)[C@@H]2CCCC[C@H]2C)C1	ZINC001086462966	1359106500	/nfs/dbraw/zinc/10/65/00/1359106500.db2.gz	WECFHFYUOAPDIL-NMFUWQPSSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cccc(F)c2Cl)C1	ZINC001086489552	1359116859	/nfs/dbraw/zinc/11/68/59/1359116859.db2.gz	PHZLDRXJFKOHRT-XYPYZODXSA-N	0	3	331.218	3.330	20	30		EGEDHN
C[C@H]1CC[C@@H](C(=O)NC[C@H]2C[C@H](NCc3ccc(C#N)cc3F)C2)C1	ZINC001086496110	1359120046	/nfs/dbraw/zinc/12/00/46/1359120046.db2.gz	NKJYMTZVCXFYRD-SCNOPHJPSA-N	0	3	343.446	3.118	20	30		EGEDHN
CC(C)C(=O)N[C@@H]1CN(Cc2cccc(C#N)c2)C[C@H]1c1ccccc1	ZINC001086575363	1359152517	/nfs/dbraw/zinc/15/25/17/1359152517.db2.gz	NJSGEQMQDASAPA-LEWJYISDSA-N	0	3	347.462	3.298	20	30		EGEDHN
C=CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2cnc(C)s2)C1	ZINC001086579036	1359154451	/nfs/dbraw/zinc/15/44/51/1359154451.db2.gz	JPZODKBCXJEIIU-DLBZAZTESA-N	0	3	341.480	3.225	20	30		EGEDHN
C=C(C)CN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2cc(C)[nH]c2C)C1	ZINC001086612271	1359164596	/nfs/dbraw/zinc/16/45/96/1359164596.db2.gz	JUAHCMXLXJEZLH-VQTJNVASSA-N	0	3	337.467	3.405	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2scnc2C(F)F)C1	ZINC001086755362	1359195453	/nfs/dbraw/zinc/19/54/53/1359195453.db2.gz	PLUWHRHOZOXEME-VHSXEESVSA-N	0	3	349.834	3.321	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccc3ccncc3c2)C1	ZINC001086847250	1359213286	/nfs/dbraw/zinc/21/32/86/1359213286.db2.gz	LJRINDDCBXIWKI-KBXCAEBGSA-N	0	3	343.858	3.475	20	30		EGEDHN
C=C(C)C[NH+]1CCC2(C[C@H](C)N(C(=O)c3ccccc3[O-])C2)CC1	ZINC001086904262	1359233896	/nfs/dbraw/zinc/23/38/96/1359233896.db2.gz	ANOADKAGFBHKPB-INIZCTEOSA-N	0	3	328.456	3.285	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)C3C(C)(C)C3(C)C)C2)CC1	ZINC001086913626	1359240762	/nfs/dbraw/zinc/24/07/62/1359240762.db2.gz	UKJZQZSPVUZOIN-MRXNPFEDSA-N	0	3	330.516	3.395	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3c(C)coc3C)C2)CC1	ZINC001086920913	1359247629	/nfs/dbraw/zinc/24/76/29/1359247629.db2.gz	BQWWKWQKDNUHGF-MRXNPFEDSA-N	0	3	328.456	3.236	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3nc(C)sc3C)C2)CC1	ZINC001086929002	1359253730	/nfs/dbraw/zinc/25/37/30/1359253730.db2.gz	UOOPSWRXMYNYRZ-CQSZACIVSA-N	0	3	345.512	3.100	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H]3CCCC34CC4)C2)CC1	ZINC001086929772	1359254265	/nfs/dbraw/zinc/25/42/65/1359254265.db2.gz	QETYKHOTMJVTEY-MSOLQXFVSA-N	0	3	328.500	3.293	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3occc3Cl)C2)CC1	ZINC001086941045	1359262650	/nfs/dbraw/zinc/26/26/50/1359262650.db2.gz	HSXQNMYRIQJDKW-AWEZNQCLSA-N	0	3	334.847	3.273	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cc(C)cc(F)c3)C2)CC1	ZINC001086943844	1359264956	/nfs/dbraw/zinc/26/49/56/1359264956.db2.gz	GVVZJQYSZJZZBK-INIZCTEOSA-N	0	3	328.431	3.084	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3oc(C(C)C)nc3C)C2)CC1	ZINC001086946508	1359267566	/nfs/dbraw/zinc/26/75/66/1359267566.db2.gz	BDDPBPZQHPNDQB-HNNXBMFYSA-N	0	3	343.471	3.056	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H]3C[C@H]3C3CCC3)C2)CC1	ZINC001086948467	1359269680	/nfs/dbraw/zinc/26/96/80/1359269680.db2.gz	YXUPTNNZXMARDC-NZSAHSFTSA-N	0	3	328.500	3.149	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3ccoc3CCC)C2)CC1	ZINC001086952653	1359272508	/nfs/dbraw/zinc/27/25/08/1359272508.db2.gz	MUYBCMZGAPCOMH-INIZCTEOSA-N	0	3	328.456	3.182	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H]3C[C@H]3c3ccccc3)C2)CC1	ZINC001086953763	1359274195	/nfs/dbraw/zinc/27/41/95/1359274195.db2.gz	RWMYOVSJCVQZLO-YZGWKJHDSA-N	0	3	336.479	3.126	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)CCc3ccccc3)C2)CC1	ZINC001086954241	1359274787	/nfs/dbraw/zinc/27/47/87/1359274787.db2.gz	GASMRVPBWLOOME-IBGZPJMESA-N	0	3	338.495	3.346	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)Cc3ccc(F)cc3)C2)CC1	ZINC001086955084	1359275473	/nfs/dbraw/zinc/27/54/73/1359275473.db2.gz	CSFZOXGSQQVSEA-QGZVFWFLSA-N	0	3	342.458	3.095	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc(F)cc3Cl)C2)CC1	ZINC001086955431	1359276244	/nfs/dbraw/zinc/27/62/44/1359276244.db2.gz	NDCADFBLCNUJIJ-AWEZNQCLSA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc(CF)cc3)C2)CC1	ZINC001086958990	1359279586	/nfs/dbraw/zinc/27/95/86/1359279586.db2.gz	KUPMKTGGURWGJI-MRXNPFEDSA-N	0	3	328.431	3.106	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccc(C#N)cc1F	ZINC001087112256	1359290883	/nfs/dbraw/zinc/29/08/83/1359290883.db2.gz	RQPYRMVXZIQYSR-QAPCUYQASA-N	0	3	345.462	3.460	20	30		EGEDHN
C=CCN1CCC[C@@H]2[C@H](NC(=O)c3nc(Cl)cs3)C(C)(C)[C@H]21	ZINC001087300097	1359382192	/nfs/dbraw/zinc/38/21/92/1359382192.db2.gz	GUSSXDWSWDMSAG-WXHSDQCUSA-N	0	3	339.892	3.201	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc4ncccc4c3)C(C)(C)[C@@H]21	ZINC001087302271	1359385049	/nfs/dbraw/zinc/38/50/49/1359385049.db2.gz	QBBYWXRZTYXTQO-MISYRCLQSA-N	0	3	347.462	3.087	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc(C)cc1F	ZINC001087305734	1359391192	/nfs/dbraw/zinc/39/11/92/1359391192.db2.gz	XRRNQMWXOHENBM-NZSAHSFTSA-N	0	3	342.458	3.376	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc(CC)c(C)s3)C(C)(C)[C@H]21	ZINC001087316903	1359408484	/nfs/dbraw/zinc/40/84/84/1359408484.db2.gz	ZBUPXZBDIYEQCO-NJAFHUGGSA-N	0	3	344.524	3.471	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3coc4ccccc34)C(C)(C)[C@H]21	ZINC001087321417	1359413201	/nfs/dbraw/zinc/41/32/01/1359413201.db2.gz	UAOKJAKOFPUKJN-MNEFBYGVSA-N	0	3	336.435	3.285	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)C[C@H]2C=CCC2)CCN1Cc1ccc(C#N)cc1	ZINC001087497048	1359496954	/nfs/dbraw/zinc/49/69/54/1359496954.db2.gz	VDMPNXFRMBJYKJ-FFZOFVMBSA-N	0	3	337.467	3.384	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)C2CC(C)(C)C2)CCN1Cc1ccc(C#N)cc1	ZINC001087561841	1359533259	/nfs/dbraw/zinc/53/32/59/1359533259.db2.gz	RBPDOWLCGKSFDG-RBUKOAKNSA-N	0	3	339.483	3.464	20	30		EGEDHN
C=CCCN1CC[C@H](NC(=O)c2cnc([C@@H](C)OC)s2)[C@H]1CC	ZINC001087573191	1359537957	/nfs/dbraw/zinc/53/79/57/1359537957.db2.gz	XLRDXGAHGKJMLJ-HZSPNIEDSA-N	0	3	337.489	3.009	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccnn2C2CCCC2)[C@H]1CC	ZINC001087589680	1359545930	/nfs/dbraw/zinc/54/59/30/1359545930.db2.gz	PPKRQYDJXHZNRE-DLBZAZTESA-N	0	3	330.476	3.157	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cc(Cl)c(Cl)n2C)[C@H]1CC	ZINC001087593396	1359546718	/nfs/dbraw/zinc/54/67/18/1359546718.db2.gz	FLMKSNUPWLJVDN-QWHCGFSZSA-N	0	3	344.286	3.491	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)C2(C3CC3)CC2)CCN1Cc1ccc(C#N)cc1	ZINC001087614665	1359555025	/nfs/dbraw/zinc/55/50/25/1359555025.db2.gz	GUUAKKIGSGYZFH-RBUKOAKNSA-N	0	3	337.467	3.218	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc3ccc(C)nc32)[C@H]1CC	ZINC001087617824	1359556391	/nfs/dbraw/zinc/55/63/91/1359556391.db2.gz	NRJBNDOEZVYNAG-RBUKOAKNSA-N	0	3	335.451	3.149	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cc3ccccc3s2)[C@H]1CC	ZINC001087655143	1359574827	/nfs/dbraw/zinc/57/48/27/1359574827.db2.gz	LQOPZQGWEGIGCS-ZWKOTPCHSA-N	0	3	340.492	3.436	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2noc3c2CC(C)(C)CC3)[C@H]1CC	ZINC001087670132	1359581293	/nfs/dbraw/zinc/58/12/93/1359581293.db2.gz	FJKQBNBHMBCQHX-JKSUJKDBSA-N	0	3	345.487	3.348	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)C2(c3ccc(F)cc3)CCC2)[C@H]1CC	ZINC001087680723	1359587020	/nfs/dbraw/zinc/58/70/20/1359587020.db2.gz	IFSTTWAHHFSTBN-ZWKOTPCHSA-N	0	3	330.447	3.403	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cn(C)nc2C2CCCC2)[C@H]1CC	ZINC001087719440	1359610870	/nfs/dbraw/zinc/61/08/70/1359610870.db2.gz	SMRDQGONWPJMJX-ZWKOTPCHSA-N	0	3	344.503	3.237	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc3c(c2)CCCC3)[C@H]1CC	ZINC001087824400	1359666381	/nfs/dbraw/zinc/66/63/81/1359666381.db2.gz	AOMLYUQDRKHJOC-LEWJYISDSA-N	0	3	338.495	3.100	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3cc4cscc4s3)C[C@@H]2C1	ZINC001088045256	1359733795	/nfs/dbraw/zinc/73/37/95/1359733795.db2.gz	JMGYSKBHXJJTOX-HIFRSBDPSA-N	0	3	344.505	3.380	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3cc4cc(C)ccc4s3)C[C@@H]2C1	ZINC001088157621	1359775592	/nfs/dbraw/zinc/77/55/92/1359775592.db2.gz	YEQIVHGNVYANNX-WBVHZDCISA-N	0	3	338.476	3.237	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2ccc3n[nH]cc3c2)C1	ZINC001088369869	1359853078	/nfs/dbraw/zinc/85/30/78/1359853078.db2.gz	UNSVCFKESPHBPX-INIZCTEOSA-N	0	3	346.862	3.290	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2ccc3c(c2)CCO3)C1	ZINC001088388603	1359867321	/nfs/dbraw/zinc/86/73/21/1359867321.db2.gz	ZPBZJRAGPFZGSY-KRWDZBQOSA-N	0	3	348.874	3.348	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2cnn(CCC)c2)C1	ZINC001088392332	1359869553	/nfs/dbraw/zinc/86/95/53/1359869553.db2.gz	GPTPXUAFNDAOPK-MRXNPFEDSA-N	0	3	338.883	3.020	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cc(C)n(CC3CC3)c2C)[C@H]1C	ZINC001088985833	1360124607	/nfs/dbraw/zinc/12/46/07/1360124607.db2.gz	WOANSDAVWUQPIO-APWZRJJASA-N	0	3	329.488	3.284	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2csc3c2CC[C@H](C)C3)[C@H]1C	ZINC001089020059	1360138737	/nfs/dbraw/zinc/13/87/37/1360138737.db2.gz	QCJAPXGHJFLIID-VBQJREDUSA-N	0	3	330.497	3.089	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)C2(c3cc(C)cc(C)c3)CC2)[C@H]1C	ZINC001089042508	1360144938	/nfs/dbraw/zinc/14/49/38/1360144938.db2.gz	DBRVRIJYZVOOLQ-MJGOQNOKSA-N	0	3	326.484	3.490	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCCC[C@H]1CN(C)Cc1cc2ccccc2o1	ZINC001089139606	1360197122	/nfs/dbraw/zinc/19/71/22/1360197122.db2.gz	GXXDBUBFKGGXQG-WBVHZDCISA-N	0	3	339.439	3.405	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCCC[C@H]1CN(C)Cc1ccc(C#N)cc1	ZINC001089153551	1360208301	/nfs/dbraw/zinc/20/83/01/1360208301.db2.gz	VKPIUXOEBIJUFH-OZLDOMPNSA-N	0	3	325.456	3.337	20	30		EGEDHN
CCC(=O)N[C@H]1CCN(Cc2cc(C#N)ccc2OC)CC(C)(C)C1	ZINC001089283138	1360301704	/nfs/dbraw/zinc/30/17/04/1360301704.db2.gz	GKHQWBYWJDVWAY-KRWDZBQOSA-N	0	3	343.471	3.084	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3cnccc3o2)CC(C)(C)C1	ZINC001089430813	1360422777	/nfs/dbraw/zinc/42/27/77/1360422777.db2.gz	USNWERUJIMHRKY-INIZCTEOSA-N	0	3	339.439	3.072	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2cccc(C(F)F)c2)CC(C)(C)C1	ZINC001089438546	1360428768	/nfs/dbraw/zinc/42/87/68/1360428768.db2.gz	JTAIWJFJYCGOTO-KRWDZBQOSA-N	0	3	348.437	3.407	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2nccc3ccccc32)CC(C)(C)C1	ZINC001089476296	1360458932	/nfs/dbraw/zinc/45/89/32/1360458932.db2.gz	MCGYJZMGSYTFGK-KRWDZBQOSA-N	0	3	335.451	3.088	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2coc(C(F)F)c2)CC(C)(C)C1	ZINC001089477072	1360459566	/nfs/dbraw/zinc/45/95/66/1360459566.db2.gz	LAMXPEZXEQFGAN-CQSZACIVSA-N	0	3	338.398	3.461	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2cc(C)cc(C)c2)CC(C)(C)C1	ZINC001089483831	1360464731	/nfs/dbraw/zinc/46/47/31/1360464731.db2.gz	NWEBDYNKFZNLPH-IBGZPJMESA-N	0	3	326.484	3.086	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc([C@H](C)CC)no2)CC(C)(C)C1	ZINC001089509398	1360480832	/nfs/dbraw/zinc/48/08/32/1360480832.db2.gz	BOXOQVUPUKUAPE-CVEARBPZSA-N	0	3	345.487	3.432	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccn(C(CC)CC)n2)CC(C)(C)C1	ZINC001089512131	1360483874	/nfs/dbraw/zinc/48/38/74/1360483874.db2.gz	ZUNVXJXVVPSBFT-MRXNPFEDSA-N	0	3	344.503	3.098	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(C[C@H](F)CC)CC(C)(C)C2)cn1	ZINC001089544504	1360500083	/nfs/dbraw/zinc/50/00/83/1360500083.db2.gz	UHGDQHGTRIJVQP-SJLPKXTDSA-N	0	3	345.462	3.031	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2ccc(C)c(C)c2)CC(C)(C)C1	ZINC001089554877	1360505592	/nfs/dbraw/zinc/50/55/92/1360505592.db2.gz	FKXOMKMTCJUEGZ-IBGZPJMESA-N	0	3	326.484	3.086	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)[C@H]1CCCc2c[nH]nc21	ZINC001089641629	1360554561	/nfs/dbraw/zinc/55/45/61/1360554561.db2.gz	PIXWROWMMNOUET-IRXDYDNUSA-N	0	3	344.503	3.013	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cncc(OC)c1C	ZINC001089659261	1360570342	/nfs/dbraw/zinc/57/03/42/1360570342.db2.gz	WJMZFPZMDPMLMP-INIZCTEOSA-N	0	3	345.487	3.195	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1c(C)cc(C)nc1C	ZINC001089674476	1360583300	/nfs/dbraw/zinc/58/33/00/1360583300.db2.gz	AENCVHAWSJYRGE-KRWDZBQOSA-N	0	3	329.488	3.413	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc2ncccc2c1	ZINC001089690455	1360596101	/nfs/dbraw/zinc/59/61/01/1360596101.db2.gz	QHBPOIKCVDSSDY-IBGZPJMESA-N	0	3	349.478	3.479	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1oc(CC)cc1C	ZINC001089723198	1360626701	/nfs/dbraw/zinc/62/67/01/1360626701.db2.gz	HXRNORFNDWLDSD-MRXNPFEDSA-N	0	3	330.472	3.394	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(OC)cc(OC)c1	ZINC001089730086	1360633374	/nfs/dbraw/zinc/63/33/74/1360633374.db2.gz	VYWNIILVBPNGJM-INIZCTEOSA-N	0	3	346.471	3.110	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1cc(C)oc1C	ZINC001089769318	1360657420	/nfs/dbraw/zinc/65/74/20/1360657420.db2.gz	KNQINJIPUUBFLR-RANZSIQMSA-N	0	3	348.874	3.431	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)C2(C3CC3)CCC2)C1	ZINC001089841646	1360691839	/nfs/dbraw/zinc/69/18/39/1360691839.db2.gz	GKYOFOPCAWWEDV-DKIMLUQUSA-N	0	3	348.918	3.488	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1cc(C)[nH]c1C	ZINC001089868704	1360710892	/nfs/dbraw/zinc/71/08/92/1360710892.db2.gz	FITRGDYRLUKOSQ-HPBDAGMYSA-N	0	3	347.890	3.166	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)c2cccn2CC)C1	ZINC001089905043	1360735668	/nfs/dbraw/zinc/73/56/68/1360735668.db2.gz	NGUCBDYKWUYTAN-QAETUUGQSA-N	0	3	347.890	3.043	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C23CCC(CC2)C3)CC2(CCOCC2)C1	ZINC001089943324	1360756774	/nfs/dbraw/zinc/75/67/74/1360756774.db2.gz	OFEDJQIDDMZTQO-WBTXTPOCSA-N	0	3	346.515	3.130	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)[C@H](C)c2ccsc2)CC2(CCOCC2)C1	ZINC001089959916	1360767147	/nfs/dbraw/zinc/76/71/47/1360767147.db2.gz	UKIIDUHVUAXTKZ-WBVHZDCISA-N	0	3	348.512	3.025	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)[C@H]2CC[C@H](C)CC2)CC2(CCOCC2)C1	ZINC001089969828	1360773064	/nfs/dbraw/zinc/77/30/64/1360773064.db2.gz	YHTALJSDEMZERE-GUDVDZBRSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cn(C)c3ccccc23)C1	ZINC001091125706	1360995099	/nfs/dbraw/zinc/99/50/99/1360995099.db2.gz	PPNIYYLSZUJONW-UHFFFAOYSA-N	0	3	331.847	3.029	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc3ccccc3n2C)C1	ZINC001091206135	1361007164	/nfs/dbraw/zinc/00/71/64/1361007164.db2.gz	KTVYUZCYHWNIOZ-UHFFFAOYSA-N	0	3	331.847	3.029	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2c(Cl)cncc2Cl)C1	ZINC001091212809	1361009025	/nfs/dbraw/zinc/00/90/25/1361009025.db2.gz	BCEOHONXWGFKBR-UHFFFAOYSA-N	0	3	348.661	3.239	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cccn2C2CCCC2)C1	ZINC001091300665	1361036577	/nfs/dbraw/zinc/03/65/77/1361036577.db2.gz	SSNFDUGWQVLXQR-UHFFFAOYSA-N	0	3	335.879	3.454	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CN(Cc3cccnc3C)C[C@@]2(C)C1	ZINC001091911860	1361244626	/nfs/dbraw/zinc/24/46/26/1361244626.db2.gz	ZFXRBDWHCOOHIZ-NQIIRXRSSA-N	0	3	341.499	3.273	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)[C@@H](CC)CC3CCCCC3)C[C@]2(C)C1	ZINC001092066118	1361287075	/nfs/dbraw/zinc/28/70/75/1361287075.db2.gz	ZGZWCGITNMCPMO-ZVDOUQERSA-N	0	3	330.516	3.397	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CNC(=O)[C@@H]1CCC1(C)C	ZINC001092899535	1361481348	/nfs/dbraw/zinc/48/13/48/1361481348.db2.gz	DYCKHAHAJBWQFD-CPUCHLNUSA-N	0	3	345.512	3.240	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)c2occc2Cl)CC1	ZINC001093377110	1361587851	/nfs/dbraw/zinc/58/78/51/1361587851.db2.gz	GGFHNWBLPSSBQL-KRWDZBQOSA-N	0	3	346.858	3.273	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)[C@](C)(C=C)CC)CC1	ZINC001093377916	1361588664	/nfs/dbraw/zinc/58/86/64/1361588664.db2.gz	YRPWRSWROLANBH-UYAOXDASSA-N	0	3	328.500	3.315	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@@]23C[C@@H]2CCCC3)CC1	ZINC001093378444	1361589105	/nfs/dbraw/zinc/58/91/05/1361589105.db2.gz	OFNFELBIFCXCLV-IPJJNNNSSA-N	0	3	340.511	3.293	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001094084213	1361735377	/nfs/dbraw/zinc/73/53/77/1361735377.db2.gz	PGSQUBFNTMSOEK-JTDSTZFVSA-N	0	3	327.472	3.034	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3ccc(C)nc3C(C)C)CCC[C@@H]12	ZINC001094479771	1361821788	/nfs/dbraw/zinc/82/17/88/1361821788.db2.gz	OWXCOXPIFAEMNI-WIYYLYMNSA-N	0	3	339.483	3.121	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCC(F)F)CC[C@H]1CNCc1ccccc1C#N	ZINC001184831864	1387546397	/nfs/dbraw/zinc/54/63/97/1387546397.db2.gz	NJVBDZHCJPFBNQ-ZBFHGGJFSA-N	0	3	349.425	3.178	20	30		EGEDHN
Cc1cccc([C@@H](C)N2[C@@H]3CC[C@H]2[C@@H](NC(=O)c2c[nH]c(C#N)c2)C3)c1	ZINC001095337361	1362105524	/nfs/dbraw/zinc/10/55/24/1362105524.db2.gz	RFVAAYOYPGNKDU-FCDRMGDPSA-N	0	3	348.450	3.291	20	30		EGEDHN
Cc1cccc([C@H](C)N2[C@@H]3CC[C@H]2[C@@H](NC(=O)c2c[nH]c(C#N)c2)C3)c1	ZINC001095337362	1362105570	/nfs/dbraw/zinc/10/55/70/1362105570.db2.gz	RFVAAYOYPGNKDU-WBCYEJBOSA-N	0	3	348.450	3.291	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H]1CCc3cccc(OC)c31)C2	ZINC001096122500	1362393620	/nfs/dbraw/zinc/39/36/20/1362393620.db2.gz	COMIALBRVSITBP-OWSLCNJRSA-N	0	3	340.467	3.023	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@@H]1CCCc3ccccc31)C2	ZINC001096405372	1362492586	/nfs/dbraw/zinc/49/25/86/1362492586.db2.gz	YAMZOHWUDDFGDB-YHELAOLJSA-N	0	3	336.479	3.241	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccccc1C(F)(F)F)C2	ZINC001096409833	1362495077	/nfs/dbraw/zinc/49/50/77/1362495077.db2.gz	AHBLTIFUFZNEQT-KCXAZCMYSA-N	0	3	336.357	3.064	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1c(Cl)cccc1Cl)C2	ZINC001096422592	1362503863	/nfs/dbraw/zinc/50/38/63/1362503863.db2.gz	ZYNKAEFMEAWLRY-UGFHNGPFSA-N	0	3	337.250	3.352	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H]1Cc3c1cccc3Cl)C2	ZINC001096638077	1362610835	/nfs/dbraw/zinc/61/08/35/1362610835.db2.gz	QSHHVMBHUKLWLN-ZYUBPSHWSA-N	0	3	330.859	3.277	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(N(C)CC)cc1)C2	ZINC001096652314	1362617277	/nfs/dbraw/zinc/61/72/77/1362617277.db2.gz	IVGPJNPXSSQWAZ-QYZOEREBSA-N	0	3	327.472	3.054	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cccc([C@@H]3CCOC3)c1)C2	ZINC001097380825	1362962390	/nfs/dbraw/zinc/96/23/90/1362962390.db2.gz	IVHZRGGLVHMWFL-WTGUMLROSA-N	0	3	340.467	3.102	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc(-c3ccccc3)no1)C2	ZINC001097418116	1362980704	/nfs/dbraw/zinc/98/07/04/1362980704.db2.gz	AALRKNMBMFDCLV-NXHRZFHOSA-N	0	3	337.423	3.253	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](CNCc2nc(C)cs2)[C@H](C)C1	ZINC001185061353	1387604360	/nfs/dbraw/zinc/60/43/60/1387604360.db2.gz	LSUZEELKKGTYGY-ZBFHGGJFSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](CNCc2oc(CC)nc2C)[C@@H](C)C1	ZINC001185061765	1387604552	/nfs/dbraw/zinc/60/45/52/1387604552.db2.gz	PLBPKIKPSYSZOR-RDJZCZTQSA-N	0	3	347.503	3.476	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3CCc2scnc2C)C1	ZINC001097810223	1363126955	/nfs/dbraw/zinc/12/69/55/1363126955.db2.gz	QTLOUPDPABKHMP-OAGGEKHMSA-N	0	3	345.512	3.072	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1ccc(F)c(Cl)c1)C2	ZINC001097918032	1363166725	/nfs/dbraw/zinc/16/67/25/1363166725.db2.gz	YOQJFGUHDAMUIN-XYPHTWIQSA-N	0	3	336.838	3.319	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccccc1O[C@H](C)CC)C2	ZINC001097945978	1363175233	/nfs/dbraw/zinc/17/52/33/1363175233.db2.gz	AIHCXFADNQGQNC-RWQQGDIJSA-N	0	3	340.467	3.222	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc(-c3ccccc3)ccn1)C2	ZINC001098102315	1363222645	/nfs/dbraw/zinc/22/26/45/1363222645.db2.gz	ODMRXKSUSNYCDS-SBHAEUEKSA-N	0	3	345.446	3.107	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1cccc(OCCC)c1)C2	ZINC001098176978	1363244160	/nfs/dbraw/zinc/24/41/60/1363244160.db2.gz	SJOPTSBSSIATNF-RLLQIKCJSA-N	0	3	342.483	3.316	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H]1CCCc3sc(C)nc31)C2	ZINC001098201835	1363253971	/nfs/dbraw/zinc/25/39/71/1363253971.db2.gz	HWEPVECRHYNFQA-FPCVCCKLSA-N	0	3	345.512	3.169	20	30		EGEDHN
C#CCCN1CCC2(CC1)CN(C(=O)CCC)Cc1ccccc1O2	ZINC001098538306	1363359288	/nfs/dbraw/zinc/35/92/88/1363359288.db2.gz	CZWXQERYJCLSQB-UHFFFAOYSA-N	0	3	340.467	3.066	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)C[C@H](NC(=O)C1CC1)c1ccccc1O2	ZINC001098542115	1363364519	/nfs/dbraw/zinc/36/45/19/1363364519.db2.gz	VZVNBIVXRXPFJV-PXNSSMCTSA-N	0	3	326.440	3.057	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1cccc(C)c1F)C[C@@H](C)O2	ZINC001098603733	1363395241	/nfs/dbraw/zinc/39/52/41/1363395241.db2.gz	VWSVTGGHRNAUAP-MRXNPFEDSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=CCCCCCNCc1cn([C@H]2CCN(C(=O)CCCC)C2)nn1	ZINC001098618537	1363401485	/nfs/dbraw/zinc/40/14/85/1363401485.db2.gz	DAXZGXUJDGRJHU-SFHVURJKSA-N	0	3	347.507	3.078	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1cccc(Cl)c1)C[C@H](C)O2	ZINC001098654686	1363419895	/nfs/dbraw/zinc/41/98/95/1363419895.db2.gz	FKXZCHYTPLDMJG-HNNXBMFYSA-N	0	3	348.874	3.222	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccoc1CCC)C[C@H](C)O2	ZINC001098655885	1363421105	/nfs/dbraw/zinc/42/11/05/1363421105.db2.gz	NKIOKSFFSUCXRU-INIZCTEOSA-N	0	3	346.471	3.114	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1CCC(C)(C)CC1)C[C@H](C)O2	ZINC001098664893	1363426288	/nfs/dbraw/zinc/42/62/88/1363426288.db2.gz	YCTRAWSZLMUDCU-KRWDZBQOSA-N	0	3	348.531	3.471	20	30		EGEDHN
CCC(=O)NC[C@H]1CCC(C)(C)CN1Cc1ccc(OCC#N)cc1	ZINC001098845571	1363489992	/nfs/dbraw/zinc/48/99/92/1363489992.db2.gz	WBZRVFPLVUQTQI-QGZVFWFLSA-N	0	3	343.471	3.106	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H]2C[C@H]2c2c(F)cccc2F)C1	ZINC001099018942	1363578798	/nfs/dbraw/zinc/57/87/98/1363578798.db2.gz	WNXPJBDGCDEXOJ-DSEONOSFSA-N	0	3	346.421	3.225	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)COc1cc(C)ccc1F	ZINC001099069334	1363605641	/nfs/dbraw/zinc/60/56/41/1363605641.db2.gz	GCUJXDOTZCQFAX-INIZCTEOSA-N	0	3	348.462	3.306	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)CCOc1cccc(F)c1	ZINC001099097656	1363620259	/nfs/dbraw/zinc/62/02/59/1363620259.db2.gz	CADIWUQJTSHOKI-KRWDZBQOSA-N	0	3	348.462	3.387	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)C1(COC)CCCC1	ZINC001099103086	1363623007	/nfs/dbraw/zinc/62/30/07/1363623007.db2.gz	VIFKZRCIYOOTRB-KRWDZBQOSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)[C@H](CC(C)C)n1ccnc1	ZINC001099117086	1363632826	/nfs/dbraw/zinc/63/28/26/1363632826.db2.gz	ZKNFVTPVZKUSBR-ROUUACIJSA-N	0	3	346.519	3.263	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@H](C)C(C)(C)C	ZINC001099121285	1363635747	/nfs/dbraw/zinc/63/57/47/1363635747.db2.gz	JXHJLFJDRDGQHL-IRXDYDNUSA-N	0	3	338.536	3.478	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2oc(CCC)nc2C)C1	ZINC001099121475	1363635798	/nfs/dbraw/zinc/63/57/98/1363635798.db2.gz	APEGKRFDIFQCQT-KXBFYZLASA-N	0	3	331.460	3.096	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@]1(C)C[C@H]2C[C@H]2C1	ZINC001099152935	1363658373	/nfs/dbraw/zinc/65/83/73/1363658373.db2.gz	BDBNUUZLYPIHLL-NYUBLWNDSA-N	0	3	348.531	3.232	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)C(C)(C)COCC(F)F	ZINC001099153226	1363659180	/nfs/dbraw/zinc/65/91/80/1363659180.db2.gz	HIOYZVJNVMECDB-AWEZNQCLSA-N	0	3	346.462	3.087	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H]1CCC(C)(C)CN1CCOCC1CC1	ZINC001099170191	1363668405	/nfs/dbraw/zinc/66/84/05/1363668405.db2.gz	DQPLWWUCOPGAHL-KRWDZBQOSA-N	0	3	336.520	3.232	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@H]1CCC(C)(C)CN1CCOCC=C	ZINC001099170929	1363668904	/nfs/dbraw/zinc/66/89/04/1363668904.db2.gz	LSTOOSLWXXAAHV-LJQANCHMSA-N	0	3	348.531	3.380	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)C1(C)CC=CC1	ZINC001099214961	1363695826	/nfs/dbraw/zinc/69/58/26/1363695826.db2.gz	ORRGCNGHQBUUSN-KRWDZBQOSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@H]1CCC(C)(C)CN1CCn1cccn1	ZINC001099215658	1363696454	/nfs/dbraw/zinc/69/64/54/1363696454.db2.gz	YGZLGYTZGGMZSF-YLJYHZDGSA-N	0	3	346.519	3.092	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H]1C[C@H]1CCC	ZINC001099220797	1363698844	/nfs/dbraw/zinc/69/88/44/1363698844.db2.gz	SHFAZODKFQVYHY-KZNAEPCWSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H](C)c1ccco1	ZINC001099230556	1363704289	/nfs/dbraw/zinc/70/42/89/1363704289.db2.gz	UOEBOBYHLACFAN-IRXDYDNUSA-N	0	3	348.487	3.193	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2cc(F)ccc2CC)C[C@H]1C(F)(F)F	ZINC001099274285	1363727202	/nfs/dbraw/zinc/72/72/02/1363727202.db2.gz	DXXHRLMTMNVBMQ-HUUCEWRRSA-N	0	3	344.352	3.167	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H](OC)c1ccccc1	ZINC001099310135	1363742811	/nfs/dbraw/zinc/74/28/11/1363742811.db2.gz	IHHJKIPJUBRFRD-RTBURBONSA-N	0	3	342.483	3.004	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@H](C)c2ccc(C)o2)C[C@H]1C(F)(F)F	ZINC001099318155	1363747227	/nfs/dbraw/zinc/74/72/27/1363747227.db2.gz	HSZUEAMXJBFYJZ-MGPQQGTHSA-N	0	3	344.377	3.247	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2ccc(CC)cc2)C[C@H]1C(F)(F)F	ZINC001099338707	1363758772	/nfs/dbraw/zinc/75/87/72/1363758772.db2.gz	GOWPKUHYHALQEM-HZPDHXFCSA-N	0	3	340.389	3.418	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H](C)n1nc(C)cc1C	ZINC001099372203	1363777611	/nfs/dbraw/zinc/77/76/11/1363777611.db2.gz	LVDCVECYQBDUIO-QZTJIDSGSA-N	0	3	346.519	3.244	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)CSCCC	ZINC001099424854	1363794344	/nfs/dbraw/zinc/79/43/44/1363794344.db2.gz	MFVONZNFBXTGGY-JJXSEGSLSA-N	0	3	342.936	3.051	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCCC2CC2)CC2(CCOCC2)C1	ZINC001099588917	1363870075	/nfs/dbraw/zinc/87/00/75/1363870075.db2.gz	LWVMUPRECVWNLM-GOSISDBHSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CC(CC)CC)CC2(CCOCC2)C1	ZINC001099595305	1363878429	/nfs/dbraw/zinc/87/84/29/1363878429.db2.gz	YFHVBLWMSYGNGB-GOSISDBHSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2CCN(CC=C(C)C)C[C@H]2O)CCCCC1	ZINC001100121519	1364021417	/nfs/dbraw/zinc/02/14/17/1364021417.db2.gz	BRYRPRTULGIADY-ZWKOTPCHSA-N	0	3	334.504	3.031	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](CNCc2oc(C)nc2C)[C@@H](C)C1	ZINC001185227242	1387656944	/nfs/dbraw/zinc/65/69/44/1387656944.db2.gz	WBDUZFRARYRQQA-WMLDXEAASA-N	0	3	347.503	3.468	20	30		EGEDHN
C#CCCCC(=O)NCC1CC(N[C@H](C)c2ccc(F)cc2F)C1	ZINC001100285882	1364067729	/nfs/dbraw/zinc/06/77/29/1364067729.db2.gz	XPYZMIKIVLOBOG-VQCLRJIVSA-N	0	3	334.410	3.314	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100362041	1364091733	/nfs/dbraw/zinc/09/17/33/1364091733.db2.gz	NKLDVQDTPTWGJW-UHFFFAOYSA-N	0	3	344.886	3.301	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C/C=C/Cc2ccccc2)C1	ZINC001100420590	1364108169	/nfs/dbraw/zinc/10/81/69/1364108169.db2.gz	NXANENREEYTAHI-AATRIKPKSA-N	0	3	332.875	3.412	20	30		EGEDHN
C[C@H](C(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1)C(C)(C)C	ZINC001100447938	1364118037	/nfs/dbraw/zinc/11/80/37/1364118037.db2.gz	BMJSEHIFNKPROK-BZOOQXSSSA-N	0	3	345.462	3.364	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)Cc2cccc(Cl)c2)C1	ZINC001100632891	1364196764	/nfs/dbraw/zinc/19/67/64/1364196764.db2.gz	UZKCUEKEEPWJLU-UHFFFAOYSA-N	0	3	327.255	3.119	20	30		EGEDHN
CC1(C(=O)NCC2CC(NCc3cc(C#N)ccc3F)C2)CC=CC1	ZINC001100639860	1364200025	/nfs/dbraw/zinc/20/00/25/1364200025.db2.gz	CRLXZYOLOWHRFI-UHFFFAOYSA-N	0	3	341.430	3.038	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC1CC(NCc2cccc(OCC)n2)C1	ZINC001100645165	1364202794	/nfs/dbraw/zinc/20/27/94/1364202794.db2.gz	WSJVUIRRDJKHPA-MKJPBZQASA-N	0	3	345.487	3.067	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC1CC(NCc2ccncc2Cl)C1	ZINC001100645243	1364202801	/nfs/dbraw/zinc/20/28/01/1364202801.db2.gz	ZUBNGDMKGCMJAH-RWKZGTHUSA-N	0	3	335.879	3.322	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C(C)(C)c2cccc(F)c2)C1	ZINC001100674569	1364213858	/nfs/dbraw/zinc/21/38/58/1364213858.db2.gz	YSYGFYCDDWTRCB-UHFFFAOYSA-N	0	3	338.854	3.340	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)CCCC(C)C)C1	ZINC001100699120	1364223807	/nfs/dbraw/zinc/22/38/07/1364223807.db2.gz	CBJUMBVPUNQHMA-UHFFFAOYSA-N	0	3	331.298	3.206	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)NCC1CC(NCC#Cc2ccc(Cl)cc2)C1	ZINC001100721279	1364235102	/nfs/dbraw/zinc/23/51/02/1364235102.db2.gz	JLNYAQGHKXUAEN-LSJNQWAISA-N	0	3	346.902	3.468	20	30		EGEDHN
CC(C)[C@H](C)C(=O)NCC1CC(NCC#Cc2cccc(Cl)c2)C1	ZINC001100724259	1364235976	/nfs/dbraw/zinc/23/59/76/1364235976.db2.gz	RGZVYPJAYPIBHB-DMKPSLHHSA-N	0	3	346.902	3.468	20	30		EGEDHN
CC(C)[C@H](C)C(=O)NCC1CC(NCC#Cc2ccccc2Cl)C1	ZINC001100723654	1364235989	/nfs/dbraw/zinc/23/59/89/1364235989.db2.gz	GMGFQQOLQIOJKX-HJOIGYKYSA-N	0	3	346.902	3.468	20	30		EGEDHN
C=CCC1(C(=O)NCC2CC(NCc3cnoc3C)C2)CCCCC1	ZINC001101018684	1364376864	/nfs/dbraw/zinc/37/68/64/1364376864.db2.gz	WGEBFZBECHOTLN-UHFFFAOYSA-N	0	3	345.487	3.494	20	30		EGEDHN
C=CCN1CC[C@@H](Oc2ccnc(CNC(=O)[C@@H](C)CC(C)C)c2)C1	ZINC001101097759	1364413652	/nfs/dbraw/zinc/41/36/52/1364413652.db2.gz	ZGZXIDBYSDFCRD-QFBILLFUSA-N	0	3	345.487	3.019	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@H]2CN(Cc3cncc(C)c3)C[C@@]2(C)C1	ZINC001101253603	1364487593	/nfs/dbraw/zinc/48/75/93/1364487593.db2.gz	SKNMJYMYTCDEFI-QUCCMNQESA-N	0	3	327.472	3.027	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N1C[C@H]2CN(Cc3ccc(C#N)cc3)C[C@@]2(C)C1	ZINC001101328884	1364511303	/nfs/dbraw/zinc/51/13/03/1364511303.db2.gz	VHXDEZDTUJIPTA-OKACVUPZSA-N	0	3	349.478	3.361	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)N1CCC(C(C)(C)CNCc2ccon2)CC1	ZINC001101564792	1364621764	/nfs/dbraw/zinc/62/17/64/1364621764.db2.gz	GCZSODLEGPKGQP-JKSUJKDBSA-N	0	3	347.503	3.487	20	30		EGEDHN
C=CCC[C@H](C)N1CC2(C1)C[C@H](NC(=O)/C(C)=C/CC)c1nccn12	ZINC001101613833	1364655856	/nfs/dbraw/zinc/65/58/56/1364655856.db2.gz	JBBFDVSDCOIHDH-GXUJAFARSA-N	0	3	342.487	3.166	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1CNC(=O)/C=C/c1ccco1	ZINC001101687891	1364689388	/nfs/dbraw/zinc/68/93/88/1364689388.db2.gz	YOQYUVSTPCPQJH-KALAYHLKSA-N	0	3	348.446	3.029	20	30		EGEDHN
CCC[C@@H](C)C(=O)NC[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1C	ZINC001101829227	1364742878	/nfs/dbraw/zinc/74/28/78/1364742878.db2.gz	TWHOEMHAEQHOCO-IIDMSEBBSA-N	0	3	345.462	3.318	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@@H]1CN(Cc2conc2CC)C[C@H]1C	ZINC001102004833	1364807720	/nfs/dbraw/zinc/80/77/20/1364807720.db2.gz	HABORRWJTQJZCF-HUUCEWRRSA-N	0	3	333.476	3.023	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1C	ZINC001102226390	1364943538	/nfs/dbraw/zinc/94/35/38/1364943538.db2.gz	NPYRHXULPQEVDB-SJLPKXTDSA-N	0	3	342.458	3.074	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1C	ZINC001102295615	1364988607	/nfs/dbraw/zinc/98/86/07/1364988607.db2.gz	SOCNHOCIWRMZDO-CRAIPNDOSA-N	0	3	343.446	3.238	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@@H]1CN(Cc2oc(CC)nc2C)C[C@H]1C	ZINC001102326717	1365002903	/nfs/dbraw/zinc/00/29/03/1365002903.db2.gz	ZPAQLUAFRGFNIC-AKCHCHLHSA-N	0	3	347.503	3.332	20	30		EGEDHN
CCCCCCCCC(=O)NC[C@@H]1CN(Cc2cnn(C)c2)C[C@H]1C	ZINC001102527304	1365100019	/nfs/dbraw/zinc/10/00/19/1365100019.db2.gz	SIMMLTVTBXJHRP-IEBWSBKVSA-N	0	3	348.535	3.355	20	30		EGEDHN
COCC#CCN1C[C@@H](CNC(=O)CCCC2CCCCC2)[C@H](C)C1	ZINC001102549414	1365109577	/nfs/dbraw/zinc/10/95/77/1365109577.db2.gz	SPCFMYZFYNRMNG-UYAOXDASSA-N	0	3	348.531	3.071	20	30		EGEDHN
C[C@@H]1CN(Cc2cc(C#N)ccc2F)C[C@H]1CCNC(=O)CC1CC1	ZINC001102633716	1365145053	/nfs/dbraw/zinc/14/50/53/1365145053.db2.gz	DWWPTDGYRBSLBJ-RHSMWYFYSA-N	0	3	343.446	3.072	20	30		EGEDHN
CC/C(C)=C\C(=O)NCC[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1C	ZINC001102951890	1365313495	/nfs/dbraw/zinc/31/34/95/1365313495.db2.gz	QZMQMUFYMJOUNU-KNXLQNQVSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2ccnc(C3CC3)c2)C1	ZINC001103194037	1365428938	/nfs/dbraw/zinc/42/89/38/1365428938.db2.gz	XQEHTFLVRNMRFO-CXAGYDPISA-N	0	3	347.890	3.399	20	30		EGEDHN
C#CCCCCCC(=O)NCC[C@@H]1CN(Cc2cc(C)no2)C[C@H]1C	ZINC001103315077	1365488672	/nfs/dbraw/zinc/48/86/72/1365488672.db2.gz	NPGPOQFVESZMJE-SJLPKXTDSA-N	0	3	345.487	3.141	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1CCNC(=O)C1(C)CCC1	ZINC001103322427	1365493244	/nfs/dbraw/zinc/49/32/44/1365493244.db2.gz	WPRJBVZSJJNNAF-SJLPKXTDSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)[C@H]2Cc3ccccc32)C1	ZINC001103383617	1365527881	/nfs/dbraw/zinc/52/78/81/1365527881.db2.gz	DZUVTBQUIFDWQT-QBIMZIAESA-N	0	3	332.875	3.153	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)CC[C@H]2CCCOC2)C1	ZINC001103587300	1365654114	/nfs/dbraw/zinc/65/41/14/1365654114.db2.gz	OZMDQFFAILJKNR-DJIMGWMZSA-N	0	3	342.911	3.020	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)CCCc2ccccn2)C1	ZINC001103663612	1365711981	/nfs/dbraw/zinc/71/19/81/1365711981.db2.gz	JXPIAQJEMRONHH-NVXWUHKLSA-N	0	3	349.906	3.231	20	30		EGEDHN
CC[C@H](C)C(=O)N1C[C@@H](C)[C@H](CCNCc2cc(C#N)ccc2F)C1	ZINC001103904499	1365828978	/nfs/dbraw/zinc/82/89/78/1365828978.db2.gz	HEDHOONLHJRYIR-ZMSDIMECSA-N	0	3	345.462	3.318	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CN(C(=O)[C@@H](C)C2CC2)C[C@H]1C	ZINC001104041423	1365886485	/nfs/dbraw/zinc/88/64/85/1365886485.db2.gz	CPJSBZAGIVSFOM-OSAQELSMSA-N	0	3	343.309	3.015	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2cc(F)ccc2F)C1	ZINC001104124375	1365918317	/nfs/dbraw/zinc/91/83/17/1365918317.db2.gz	GHVHHVGTSNPNKP-HZPDHXFCSA-N	0	3	348.437	3.343	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@H](CCN[C@@H](C)c2cnccn2)C1	ZINC001104485539	1366045106	/nfs/dbraw/zinc/04/51/06/1366045106.db2.gz	ADLBVPZHHNZLQX-IXDOHACOSA-N	0	3	344.503	3.214	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@H](CCNCc2nccn2CC)C1	ZINC001104485932	1366045379	/nfs/dbraw/zinc/04/53/79/1366045379.db2.gz	UKHWPZSAWDHZBM-IAGOWNOFSA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@@H](C)[C@H](CCNCc2nccn2CC)C1	ZINC001104563602	1366078231	/nfs/dbraw/zinc/07/82/31/1366078231.db2.gz	OMIYKYPIODFJGF-FGTMMUONSA-N	0	3	346.519	3.080	20	30		EGEDHN
CC[C@@H](C)C(=O)NCC1(C)CCN(Cc2cccc(C#N)c2)CC1	ZINC001324845219	1387790132	/nfs/dbraw/zinc/79/01/32/1387790132.db2.gz	HXVVLQYXVUJUGT-MRXNPFEDSA-N	0	3	327.472	3.323	20	30		EGEDHN
CC1(C(=O)NCC2(C)CCN(Cc3cccc(C#N)c3)CC2)CCC1	ZINC001324880907	1387802719	/nfs/dbraw/zinc/80/27/19/1387802719.db2.gz	RDYQSNPSSBMIND-UHFFFAOYSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(c2ccccc2)C[C@H](NC(=O)[C@@H]2C[C@@H]2C)C1	ZINC001105402999	1366449398	/nfs/dbraw/zinc/44/93/98/1366449398.db2.gz	JWPAQIJDECOPLP-CKNFYHOISA-N	0	3	332.875	3.201	20	30		EGEDHN
C=CCC[C@@H](C)NCc1cn([C@@H]2CCCN(C(=O)CCCC)C2)nn1	ZINC001185871376	1387821270	/nfs/dbraw/zinc/82/12/70/1387821270.db2.gz	AUDYJDIPRQISDR-SJLPKXTDSA-N	0	3	347.507	3.076	20	30		EGEDHN
C=CCC[C@H](C)NCc1cn([C@@H]2CCCN(C(=O)CCCC)C2)nn1	ZINC001185871375	1387821708	/nfs/dbraw/zinc/82/17/08/1387821708.db2.gz	AUDYJDIPRQISDR-FUHWJXTLSA-N	0	3	347.507	3.076	20	30		EGEDHN
CC#CCCCC(=O)N1C[C@@H](CNCc2nc(C)c(C)s2)[C@H](C)C1	ZINC001106557818	1366734693	/nfs/dbraw/zinc/73/46/93/1366734693.db2.gz	IIEDXWRRMHEOPE-RHSMWYFYSA-N	0	3	347.528	3.138	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001106567245	1366739285	/nfs/dbraw/zinc/73/92/85/1366739285.db2.gz	AXEORFCLVYOYJW-MBOZVWFJSA-N	0	3	339.483	3.345	20	30		EGEDHN
O=C(CC1CC1)NC[C@]12CCC[C@H]1N(CC#Cc1ccccc1)CC2	ZINC001107254158	1366905470	/nfs/dbraw/zinc/90/54/70/1366905470.db2.gz	OSQWVDDVBZNUOO-IFMALSPDSA-N	0	3	336.479	3.199	20	30		EGEDHN
C#CCCCCC(=O)NC[C@]12CCC[C@H]1N(Cc1ccccn1)CC2	ZINC001107371772	1366945576	/nfs/dbraw/zinc/94/55/76/1366945576.db2.gz	BAPFANJEMXCPQX-TZIWHRDSSA-N	0	3	339.483	3.136	20	30		EGEDHN
O=C(C#CC1CC1)NC[C@]12CCC[C@H]1N(Cc1ccccc1F)CC2	ZINC001107398276	1366952094	/nfs/dbraw/zinc/95/20/94/1366952094.db2.gz	NCPSFUUPDAMCCA-TZIWHRDSSA-N	0	3	340.442	3.100	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@]12CCC[C@H]1N(Cc1ccccn1)CC2	ZINC001107423140	1366960093	/nfs/dbraw/zinc/96/00/93/1366960093.db2.gz	YMCGZBAVMQOUQB-UYAOXDASSA-N	0	3	327.472	3.299	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](N(C)Cc2cccc(OCCC)c2)C1	ZINC001189319284	1366988128	/nfs/dbraw/zinc/98/81/28/1366988128.db2.gz	WCNOGLCDUZQXLX-GOSISDBHSA-N	0	3	330.472	3.474	20	30		EGEDHN
CC(C)[C@@H](C)CC(=O)N1CC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001189326204	1366991293	/nfs/dbraw/zinc/99/12/93/1366991293.db2.gz	DDBAZZZKEUAWPU-QFBILLFUSA-N	0	3	327.472	3.273	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@]12CCC[C@H]1N(Cc1cc(C)no1)CC2	ZINC001107514561	1367012171	/nfs/dbraw/zinc/01/21/71/1367012171.db2.gz	MDVYGACITPVXEI-QKYXUNIQSA-N	0	3	345.487	3.446	20	30		EGEDHN
C=CC1(CC(=O)N2CC[C@H]3CN(CCOCC)C[C@H]32)CCCCC1	ZINC001189406719	1367014168	/nfs/dbraw/zinc/01/41/68/1367014168.db2.gz	WUOSZURBRKELDM-ZWKOTPCHSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@]12CCC[C@H]1N(Cc1cc(C)no1)CC2	ZINC001107536253	1367027648	/nfs/dbraw/zinc/02/76/48/1367027648.db2.gz	JQQYBINSZLTSKN-MISYRCLQSA-N	0	3	345.487	3.446	20	30		EGEDHN
CCC[C@@](C)(CC)C(=O)NC[C@]12CCC[C@H]1N(CC#CCOC)CC2	ZINC001107591075	1367061381	/nfs/dbraw/zinc/06/13/81/1367061381.db2.gz	RGZJQXFQYGMBDR-HMXCVIKNSA-N	0	3	348.531	3.213	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](N(C)Cc2cccc(OC)c2C)C1	ZINC001189743963	1367100623	/nfs/dbraw/zinc/10/06/23/1367100623.db2.gz	KUQPYQLOXMDIAF-LJQANCHMSA-N	0	3	342.483	3.230	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](N(C)CCOc2c(C)cccc2C)C1	ZINC001189926933	1367133389	/nfs/dbraw/zinc/13/33/89/1367133389.db2.gz	USOYAMSGJZOVSP-IBGZPJMESA-N	0	3	342.483	3.018	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)C(C)(C)CC(F)F)C1	ZINC001107988867	1367232158	/nfs/dbraw/zinc/23/21/58/1367232158.db2.gz	KYJWJHVXNDLZKQ-KDOFPFPSSA-N	0	3	346.462	3.230	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2C[C@H](OC)c1ccccc1	ZINC001109657633	1367267572	/nfs/dbraw/zinc/26/75/72/1367267572.db2.gz	YEVLLVBGDFIFKK-FYQPLNBISA-N	0	3	342.483	3.452	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3C[C@@H]2CC(C)(C)CO2)CCC1	ZINC001109683731	1367280926	/nfs/dbraw/zinc/28/09/26/1367280926.db2.gz	ZKNROXARZIZNNY-OWSLCNJRSA-N	0	3	346.515	3.269	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)CC2CC(C)(C)C2)C1	ZINC001108156759	1367315059	/nfs/dbraw/zinc/31/50/59/1367315059.db2.gz	JIQGPQNSUHXYGO-OXQOHEQNSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)Cc2cccc(C)c2)C1	ZINC001108176701	1367324718	/nfs/dbraw/zinc/32/47/18/1367324718.db2.gz	CVFPRMRJITWVMW-GHTZIAJQSA-N	0	3	344.499	3.099	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@@]1(C)CN(CC2CC(C)(C)C2)CCO1	ZINC001108188501	1367331312	/nfs/dbraw/zinc/33/13/12/1367331312.db2.gz	UEUJDRHNEUUVBP-UXHICEINSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@@]1(C)CN(CC2CCCCC2)CCO1	ZINC001108189837	1367332770	/nfs/dbraw/zinc/33/27/70/1367332770.db2.gz	MINHACLBYCYWPC-PMACEKPBSA-N	0	3	336.520	3.376	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@@H](C)c1ccccc1F)C2	ZINC001109854872	1367359769	/nfs/dbraw/zinc/35/97/69/1367359769.db2.gz	CMMCMCHZRPHNPT-LTDCPUDJSA-N	0	3	328.431	3.064	20	30		EGEDHN
C[C@@H](CC(C)(C)C)C(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C1	ZINC001186110920	1387872983	/nfs/dbraw/zinc/87/29/83/1387872983.db2.gz	MVORKEZXBSDVAM-UONOGXRCSA-N	0	3	333.501	3.383	20	30		EGEDHN
CCCCCCCCNC(=O)N(CCOC)C1CCN(C)CC1	ZINC001191061705	1367413137	/nfs/dbraw/zinc/41/31/37/1367413137.db2.gz	VRTIMFYMPJJKIY-UHFFFAOYSA-N	0	3	327.513	3.099	20	30		EGEDHN
C[C@H](CC(C)(C)C)C(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C1	ZINC001186110922	1387873186	/nfs/dbraw/zinc/87/31/86/1387873186.db2.gz	MVORKEZXBSDVAM-ZIAGYGMSSA-N	0	3	333.501	3.383	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)CCc2ccc(C)o2)C1	ZINC001108417429	1367444961	/nfs/dbraw/zinc/44/49/61/1367444961.db2.gz	AQGKFVHTBJYLAF-OXJNMPFZSA-N	0	3	348.487	3.082	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1cc(C)cc(C)c1	ZINC001110177630	1367546496	/nfs/dbraw/zinc/54/64/96/1367546496.db2.gz	AEYIBNUWEFACLQ-AABGKKOBSA-N	0	3	342.483	3.118	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccccc1CC	ZINC001110178321	1367547623	/nfs/dbraw/zinc/54/76/23/1367547623.db2.gz	YMCOFMBIUYRCKY-AABGKKOBSA-N	0	3	342.483	3.063	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CN([C@@H](C)c2ccc3ccccc3c2)C[C@H]1O	ZINC001191652042	1367553665	/nfs/dbraw/zinc/55/36/65/1367553665.db2.gz	NCRFLNZHVBBKEV-CWFSZBLJSA-N	0	3	338.451	3.028	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCc1cccc(F)c1F)C2	ZINC001110203602	1367561800	/nfs/dbraw/zinc/56/18/00/1367561800.db2.gz	HTZIUMAZMHAIMG-PVAVHDDUSA-N	0	3	334.410	3.195	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](N(C)Cc2ccc(COC)cc2)C1	ZINC001191840599	1367608384	/nfs/dbraw/zinc/60/83/84/1367608384.db2.gz	YZXHOYCNARTLHP-HXUWFJFHSA-N	0	3	342.483	3.059	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](N(C)CCc2ccccc2F)C1	ZINC001191859553	1367617172	/nfs/dbraw/zinc/61/71/72/1367617172.db2.gz	NDJYAMUCSKJCOS-GOSISDBHSA-N	0	3	330.447	3.095	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](N(C)CCOc2ccc(F)cc2)C1	ZINC001191913611	1367638320	/nfs/dbraw/zinc/63/83/20/1367638320.db2.gz	ZQDBBPJXMCOHAP-WMZOPIPTSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H](N(C)CCOc2ccc(F)cc2)C1	ZINC001191913608	1367638458	/nfs/dbraw/zinc/63/84/58/1367638458.db2.gz	ZQDBBPJXMCOHAP-AEFFLSMTSA-N	0	3	348.462	3.340	20	30		EGEDHN
CC#CCN1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)[C@@H](C)CC)C1	ZINC001186180911	1387892452	/nfs/dbraw/zinc/89/24/52/1387892452.db2.gz	UFYKSSQAYIGTKH-ILZDJORESA-N	0	3	344.474	3.417	20	30		EGEDHN
CCCC(C)(C)C(=O)N1CC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001192082120	1367682897	/nfs/dbraw/zinc/68/28/97/1367682897.db2.gz	CINFCOWMCJHXLZ-GOSISDBHSA-N	0	3	327.472	3.417	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](N(C)Cc2cccc3c2CCOC3)C1	ZINC001192094550	1367685798	/nfs/dbraw/zinc/68/57/98/1367685798.db2.gz	VAMCAHFNVQIOKB-LJQANCHMSA-N	0	3	342.483	3.148	20	30		EGEDHN
CC(C)c1ccccc1CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](C)C#N)C2	ZINC001110401401	1367693088	/nfs/dbraw/zinc/69/30/88/1367693088.db2.gz	BYUVDFPNGICBNN-WLWJZTKJSA-N	0	3	325.456	3.191	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](N(C)C[C@@H](OC)c3ccccc3)C2)C1	ZINC001192257404	1367732116	/nfs/dbraw/zinc/73/21/16/1367732116.db2.gz	ODAABEMFVRWKNH-RTBURBONSA-N	0	3	342.483	3.263	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)C[C@H](C)CCC=C(C)C)C1	ZINC001192472024	1367792112	/nfs/dbraw/zinc/79/21/12/1367792112.db2.gz	JIIHHBZNETVOGJ-MOPGFXCFSA-N	0	3	336.520	3.494	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1cccc2cccnc21	ZINC001110532892	1367813210	/nfs/dbraw/zinc/81/32/10/1367813210.db2.gz	FRXMOAMRBMMBGV-AQNXPRMDSA-N	0	3	347.462	3.116	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCOCc1ccccc1	ZINC001110610550	1367871834	/nfs/dbraw/zinc/87/18/34/1367871834.db2.gz	IDDGSTFFAHTMEL-AQNXPRMDSA-N	0	3	342.483	3.281	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCCc1ccc(Cl)cc1)C2	ZINC001110764492	1367967093	/nfs/dbraw/zinc/96/70/93/1367967093.db2.gz	XOMYXLPYTZVPPQ-QRVBRYPASA-N	0	3	344.886	3.408	20	30		EGEDHN
C=CCCCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc(OCC)no1)C2	ZINC001110821623	1368009912	/nfs/dbraw/zinc/00/99/12/1368009912.db2.gz	DJQKVURISYQFKD-OAGGEKHMSA-N	0	3	347.459	3.155	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCOCCC(C)C	ZINC001110902287	1368075689	/nfs/dbraw/zinc/07/56/89/1368075689.db2.gz	SQAAIBLPUBFCEW-AQNXPRMDSA-N	0	3	348.531	3.354	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCc1scnc1C	ZINC001110933808	1368103745	/nfs/dbraw/zinc/10/37/45/1368103745.db2.gz	RMGPXFVEDFHJJC-HZMVEIRTSA-N	0	3	347.528	3.318	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](CCC)c1ccccn1)C2	ZINC001110950481	1368116937	/nfs/dbraw/zinc/11/69/37/1368116937.db2.gz	LYCXXDAQRKKMDG-RWQQGDIJSA-N	0	3	327.472	3.263	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)[C@@H](CCC)c2ccccc2)C1	ZINC001193877894	1368137954	/nfs/dbraw/zinc/13/79/54/1368137954.db2.gz	JSNVXRDIRFGQQP-PMACEKPBSA-N	0	3	344.499	3.306	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](C)CCC(C)(C)C)C2	ZINC001111279892	1368247656	/nfs/dbraw/zinc/24/76/56/1368247656.db2.gz	KUSNDAGOKRJLGB-MLHJIOFPSA-N	0	3	336.520	3.373	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)CC[C@@H]1CCc3ccccc31)C2	ZINC001111446280	1368309596	/nfs/dbraw/zinc/30/95/96/1368309596.db2.gz	NQGIONSSEOAVFG-ZSXPUABSSA-N	0	3	336.479	3.241	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@@H](C)c1ccc(F)cc1)C2	ZINC001111449710	1368310630	/nfs/dbraw/zinc/31/06/30/1368310630.db2.gz	HCUGMLNYVWYLCL-AXUOBQJMSA-N	0	3	328.431	3.064	20	30		EGEDHN
CCCCCCCCOC(=O)N1CCO[C@@H](CN2CCCC2)C1	ZINC001194743948	1368315800	/nfs/dbraw/zinc/31/58/00/1368315800.db2.gz	UZVSWNBSHRQDOF-KRWDZBQOSA-N	0	3	326.481	3.280	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](C)Cc1ccc(F)cc1)C2	ZINC001111496213	1368321293	/nfs/dbraw/zinc/32/12/93/1368321293.db2.gz	SKJWKGCZJQZMON-AXUOBQJMSA-N	0	3	330.447	3.302	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)C[C@H](NC(=O)CCC)c1ccccc1O2	ZINC001111529103	1368327259	/nfs/dbraw/zinc/32/72/59/1368327259.db2.gz	DOIJDFWHGVLJSP-PXNSSMCTSA-N	0	3	328.456	3.447	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)C[C@H](NC(=O)/C(C)=C/C)c1ccccc1O2	ZINC001111529814	1368329784	/nfs/dbraw/zinc/32/97/84/1368329784.db2.gz	QBNAJOOJOGTSQO-YIFMKKJRSA-N	0	3	338.451	3.060	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1(CCC)CCC1)C[C@H](C)O2	ZINC001111547191	1368340020	/nfs/dbraw/zinc/34/00/20/1368340020.db2.gz	KDVIMNHQIZRZDZ-KRWDZBQOSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H](CC)CC(C)C)C[C@@H](C)O2	ZINC001111552425	1368343533	/nfs/dbraw/zinc/34/35/33/1368343533.db2.gz	DXXBBOFWMZIICY-QZTJIDSGSA-N	0	3	336.520	3.327	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@H](C)C(C)(C)C)C[C@@H](C)O2	ZINC001111553072	1368344264	/nfs/dbraw/zinc/34/42/64/1368344264.db2.gz	UDEQSGCHMKWLGX-DLBZAZTESA-N	0	3	336.520	3.327	20	30		EGEDHN
C#CCCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1ncccc1C)C2	ZINC001111711234	1368427473	/nfs/dbraw/zinc/42/74/73/1368427473.db2.gz	IVPVFPJBBJWAMA-RXVVDRJESA-N	0	3	339.483	3.054	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CCCN(CCCCC2CCOCC2)CC1	ZINC001195785568	1368489441	/nfs/dbraw/zinc/48/94/41/1368489441.db2.gz	PFKRWKKWZSCSFW-UHFFFAOYSA-N	0	3	348.531	3.167	20	30		EGEDHN
C=CCCCC(=O)N[C@]12CCC[C@H]1CN(CCc1csc(C)n1)C2	ZINC001111859247	1368509245	/nfs/dbraw/zinc/50/92/45/1368509245.db2.gz	WNECTVMTDYVFFG-LPHOPBHVSA-N	0	3	347.528	3.321	20	30		EGEDHN
C=CCCCC(=O)N[C@]12CCC[C@H]1CN(CCc1ccns1)C2	ZINC001111858931	1368509600	/nfs/dbraw/zinc/50/96/00/1368509600.db2.gz	GFMWTWLWAIFYSG-YJBOKZPZSA-N	0	3	333.501	3.013	20	30		EGEDHN
CC(F)(F)CC(=O)N[C@]12CCC[C@H]1CN(Cc1cccc(C#N)c1)C2	ZINC001111861699	1368511380	/nfs/dbraw/zinc/51/13/80/1368511380.db2.gz	ZWQYLCUSAWVYNA-LPHOPBHVSA-N	0	3	347.409	3.074	20	30		EGEDHN
C#CCN1C[C@@H]2CCC[C@]2(NC(=O)C[C@@H](CC)c2ccc(C)cc2)C1	ZINC001111870841	1368517734	/nfs/dbraw/zinc/51/77/34/1368517734.db2.gz	PNJMXTMHJCZYHP-CBQOVEMMSA-N	0	3	338.495	3.483	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2ccnn2CCC)CC1	ZINC001195974351	1368526735	/nfs/dbraw/zinc/52/67/35/1368526735.db2.gz	DWHRFOXPCWHCAS-UHFFFAOYSA-N	0	3	334.508	3.411	20	30		EGEDHN
C=C(C)CCC(=O)N1CCCN(CCc2ccc(OC)cc2)CC1	ZINC001196009729	1368534046	/nfs/dbraw/zinc/53/40/46/1368534046.db2.gz	DVCKPBANNDMZFI-UHFFFAOYSA-N	0	3	330.472	3.128	20	30		EGEDHN
CCCCCCCCOCC(=O)N1CCCN(CCCF)CC1	ZINC001196178002	1368562769	/nfs/dbraw/zinc/56/27/69/1368562769.db2.gz	UZEXAGFBICGFRY-UHFFFAOYSA-N	0	3	330.488	3.257	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2n[nH]c3c2CCC3)CC1	ZINC001196401446	1368607451	/nfs/dbraw/zinc/60/74/51/1368607451.db2.gz	NANDZDRATVNSRS-UHFFFAOYSA-N	0	3	332.492	3.017	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H](C)Cc2ccccc2C)C1	ZINC001112014191	1368619261	/nfs/dbraw/zinc/61/92/61/1368619261.db2.gz	MBGZNVJAOUMMCN-LMNJBCLMSA-N	0	3	326.484	3.330	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H](C)CCOc2ccccc2)C1	ZINC001112026725	1368624893	/nfs/dbraw/zinc/62/48/93/1368624893.db2.gz	CIQRELBEMIQVMX-LQWHRVPQSA-N	0	3	342.483	3.248	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@](C)(F)CCCC)C[C@H]1C(F)(F)F	ZINC001112124480	1368670972	/nfs/dbraw/zinc/67/09/72/1368670972.db2.gz	JXPBKBLXKAZYEJ-UMVBOHGHSA-N	0	3	338.389	3.460	20	30		EGEDHN
C#CCCCCCC(=O)N1CCCN(CC2CC(F)(F)C2)CC1	ZINC001196771768	1368681234	/nfs/dbraw/zinc/68/12/34/1368681234.db2.gz	YVSMDAALEFXXIW-UHFFFAOYSA-N	0	3	326.431	3.150	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)[C@]2(C)CC=C(C)CC2)C[C@H]1C(F)(F)F	ZINC001112209915	1368718876	/nfs/dbraw/zinc/71/88/76/1368718876.db2.gz	NJOSXVXJMPYOMC-BFYDXBDKSA-N	0	3	342.405	3.125	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2coc(C3CC3)n2)CC1	ZINC001197354223	1368795964	/nfs/dbraw/zinc/79/59/64/1368795964.db2.gz	PZEXDMDVQPISQA-UHFFFAOYSA-N	0	3	331.460	3.446	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cc(C)nc(C)n2)CC1	ZINC001197435691	1368813625	/nfs/dbraw/zinc/81/36/25/1368813625.db2.gz	OLRUENIQELFUCD-UHFFFAOYSA-N	0	3	332.492	3.212	20	30		EGEDHN
C=C(C)CCN1C[C@@H](O)[C@H](NC(=O)CC(C)(C)C2CCCCC2)C1	ZINC001197804412	1368902344	/nfs/dbraw/zinc/90/23/44/1368902344.db2.gz	AYKSGYKWWWKGAG-QZTJIDSGSA-N	0	3	336.520	3.111	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCCN(CCCCCCC)CC2)nc1	ZINC001197855981	1368913592	/nfs/dbraw/zinc/91/35/92/1368913592.db2.gz	IVQLHYDUJUZTET-UHFFFAOYSA-N	0	3	327.472	3.181	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2cscn2)C1	ZINC001112537069	1368919356	/nfs/dbraw/zinc/91/93/56/1368919356.db2.gz	OFDMLRFXXPBKMJ-KXBFYZLASA-N	0	3	347.528	3.464	20	30		EGEDHN
CC(C)C[C@@H]1CN(C)CCN1Cc1ccc(C#N)cc1OC(F)F	ZINC001198084351	1368956943	/nfs/dbraw/zinc/95/69/43/1368956943.db2.gz	GVLFBNWFPKWTHC-MRXNPFEDSA-N	0	3	337.414	3.322	20	30		EGEDHN
C=C[C@@H](C(=O)N1CCCN(CCCOC(C)C)CC1)c1ccccc1	ZINC001198205454	1368980460	/nfs/dbraw/zinc/98/04/60/1368980460.db2.gz	XJBJXLKNAUTGJH-HXUWFJFHSA-N	0	3	344.499	3.306	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2ccc(N(C)C)cn2)CC1	ZINC001198296579	1369000952	/nfs/dbraw/zinc/00/09/52/1369000952.db2.gz	ORBNLBHDHDUSDL-UHFFFAOYSA-N	0	3	344.503	3.042	20	30		EGEDHN
C#CC[C@@H](CC(=O)N1CCCN(CCCF)CC1)c1ccccc1	ZINC001198394892	1369021930	/nfs/dbraw/zinc/02/19/30/1369021930.db2.gz	PJEBRNPHXRVWKW-IBGZPJMESA-N	0	3	330.447	3.078	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)c1cccnc1)c1ccccc1OC	ZINC001198493233	1369045443	/nfs/dbraw/zinc/04/54/43/1369045443.db2.gz	ZEUBPQHCGDPZQQ-GOSISDBHSA-N	0	3	339.439	3.117	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)[C@@H](C)SC)c1ccccc1OC	ZINC001198551626	1369059438	/nfs/dbraw/zinc/05/94/38/1369059438.db2.gz	AMKXLFHPDWAIPR-GDBMZVCRSA-N	0	3	336.501	3.160	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)CC(F)(F)F)c1ccccc1OC	ZINC001198585012	1369067300	/nfs/dbraw/zinc/06/73/00/1369067300.db2.gz	PJCOSMBGWNHIKL-CQSZACIVSA-N	0	3	344.377	3.361	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC[C@@H](NCCCC)c1ccccc1OC	ZINC001198594945	1369069320	/nfs/dbraw/zinc/06/93/20/1369069320.db2.gz	FPGBLKHHBCRADA-FUHWJXTLSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@H](C)CSC)c1ccccc1OC	ZINC001198618276	1369074906	/nfs/dbraw/zinc/07/49/06/1369074906.db2.gz	XQQYXQCDPOLEGX-GDBMZVCRSA-N	0	3	336.501	3.017	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)c1cc[nH]c1C)c1ccccc1OC	ZINC001198647169	1369080966	/nfs/dbraw/zinc/08/09/66/1369080966.db2.gz	KACLQDYSJPVSPM-GOSISDBHSA-N	0	3	341.455	3.359	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@H]1[C@@H]2CCC[C@@H]21)c1ccccc1OC	ZINC001198648204	1369081785	/nfs/dbraw/zinc/08/17/85/1369081785.db2.gz	TYUAXSPXLHJOLN-GFIVTLFCSA-N	0	3	328.456	3.064	20	30		EGEDHN
CC/C=C\CCN[C@@H](CNC(=O)C#CC(C)C)c1ccccc1OC	ZINC001198713073	1369096673	/nfs/dbraw/zinc/09/66/73/1369096673.db2.gz	LNZNOVNEHFNJOI-RURPWVQCSA-N	0	3	342.483	3.458	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)C1(CCF)CC1)c1ccccc1OC	ZINC001198805495	1369118864	/nfs/dbraw/zinc/11/88/64/1369118864.db2.gz	AAPVZNQMPSXDOG-INIZCTEOSA-N	0	3	334.435	3.158	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@H](NCC1CC1)c1ccccc1OC	ZINC001198856493	1369130347	/nfs/dbraw/zinc/13/03/47/1369130347.db2.gz	IMKPOMRXTVCFJH-QAPCUYQASA-N	0	3	330.472	3.454	20	30		EGEDHN
CCCCCCCC[C@H](C)C(=O)N[C@@H]1CN(CC(C)C)C[C@H]1O	ZINC001198905017	1369145704	/nfs/dbraw/zinc/14/57/04/1369145704.db2.gz	UBKQFNFPFQJAQF-RCCFBDPRSA-N	0	3	326.525	3.190	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@@H]1C[C@H]1C1CCC1)c1ccccc1OC	ZINC001198932994	1369151841	/nfs/dbraw/zinc/15/18/41/1369151841.db2.gz	WUBQIYCRQCYYHS-IPMKNSEASA-N	0	3	342.483	3.454	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)c1nocc1C)c1ccccc1OC	ZINC001198953550	1369156714	/nfs/dbraw/zinc/15/67/14/1369156714.db2.gz	PVJSGORARFWZHQ-MRXNPFEDSA-N	0	3	343.427	3.019	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)c1cccn1CC)c1ccccc1OC	ZINC001198984536	1369165193	/nfs/dbraw/zinc/16/51/93/1369165193.db2.gz	PBLJQSRLXHKIGQ-QGZVFWFLSA-N	0	3	341.455	3.153	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@H]2CCCCC2(C)C)C1	ZINC001199226775	1369194450	/nfs/dbraw/zinc/19/44/50/1369194450.db2.gz	KNCLUFRFAITUOY-KZNAEPCWSA-N	0	3	338.536	3.335	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC(N[C@H](C)c2cnc(C)cn2)CC1	ZINC001200794189	1369430431	/nfs/dbraw/zinc/43/04/31/1369430431.db2.gz	BLYVAXZMJMUNTN-OAHLLOKOSA-N	0	3	330.476	3.029	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CCC(NC/C(Cl)=C/Cl)CC1)OCC	ZINC001200850002	1369438803	/nfs/dbraw/zinc/43/88/03/1369438803.db2.gz	DPAJXLDPHLJTSQ-WVUXNXBLSA-N	0	3	349.302	3.257	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)C[C@H]2OCCc3ccsc32)CC1	ZINC001113559522	1369493372	/nfs/dbraw/zinc/49/33/72/1369493372.db2.gz	XLUKDFNBDKCHHC-DOTOQJQBSA-N	0	3	348.512	3.251	20	30		EGEDHN
CC#CCNC[C@@H]1CN(C(=O)[C@@H](CC2CCCC2)C(C)C)CCCO1	ZINC001201548456	1369573319	/nfs/dbraw/zinc/57/33/19/1369573319.db2.gz	XKNSPEPYOFHLOY-UXHICEINSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC(N[C@H](C)c2cnc(C)cn2)CC1	ZINC001202122731	1369692417	/nfs/dbraw/zinc/69/24/17/1369692417.db2.gz	GGIOMFYPAXKBIN-GDBMZVCRSA-N	0	3	330.476	3.029	20	30		EGEDHN
C#CCNC[C@H]1CN(C(=O)[C@H](C)CCCCCCCC)CCCO1	ZINC001202142519	1369700573	/nfs/dbraw/zinc/70/05/73/1369700573.db2.gz	XPFKWBKYWAYMRJ-MOPGFXCFSA-N	0	3	336.520	3.213	20	30		EGEDHN
O=C(N[C@@H]1C[C@@H](NCC#Cc2cccc(Cl)c2)C12CCC2)C1CC1	ZINC001202281797	1369728394	/nfs/dbraw/zinc/72/83/94/1369728394.db2.gz	UBLARZMSBMKIOK-QZTJIDSGSA-N	0	3	342.870	3.119	20	30		EGEDHN
CCCC(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C12CCC2	ZINC001202334312	1369741239	/nfs/dbraw/zinc/74/12/39/1369741239.db2.gz	BRAPAQKUMMZBNB-SJORKVTESA-N	0	3	329.419	3.014	20	30		EGEDHN
CC(C)=CC(=O)N[C@H]1C[C@H](NCC#Cc2ccc(F)cc2)C12CCC2	ZINC001202408311	1369764418	/nfs/dbraw/zinc/76/44/18/1369764418.db2.gz	SRHUYVVYLZLIKN-OALUTQOASA-N	0	3	340.442	3.160	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)CCCCC)C12CCC2	ZINC001202470225	1369781825	/nfs/dbraw/zinc/78/18/25/1369781825.db2.gz	PGCMYHLELAKANJ-KBPBESRZSA-N	0	3	343.309	3.492	20	30		EGEDHN
C#CCCCC(=O)NC1[C@H]2CN(C/C=C\c3ccc(Cl)cc3)C[C@@H]12	ZINC001114198671	1369789483	/nfs/dbraw/zinc/78/94/83/1369789483.db2.gz	GWJIGSYZGXCZPW-MNZSGCHJSA-N	0	3	342.870	3.203	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@@H](NC(=O)C(CC)CC)C12CCC2	ZINC001202520714	1369798054	/nfs/dbraw/zinc/79/80/54/1369798054.db2.gz	KLDOSEOENJSWSZ-ZIAGYGMSSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@@H](NCc2cccc(Cl)n2)C12CCC2	ZINC001202592681	1369816466	/nfs/dbraw/zinc/81/64/66/1369816466.db2.gz	VTTKZTQGNXKIDN-CABCVRRESA-N	0	3	333.863	3.218	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C12CCC2	ZINC001202600394	1369819147	/nfs/dbraw/zinc/81/91/47/1369819147.db2.gz	UAWHAPGKFROLCZ-MSOLQXFVSA-N	0	3	341.430	3.181	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@@H](NCc2c(C)noc2CC)C12CCC2	ZINC001202618033	1369825624	/nfs/dbraw/zinc/82/56/24/1369825624.db2.gz	RPQCBLNYHRVQLO-SJORKVTESA-N	0	3	331.460	3.029	20	30		EGEDHN
O=C(CCC1CC1)N[C@@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202652409	1369838395	/nfs/dbraw/zinc/83/83/95/1369838395.db2.gz	CBSHQNHYNJRWGH-VQTJNVASSA-N	0	3	336.479	3.245	20	30		EGEDHN
CCCC[C@@H](CNc1cccc(F)c1C#N)NC(=O)[C@H](CC)N(C)C	ZINC001114272099	1369841937	/nfs/dbraw/zinc/84/19/37/1369841937.db2.gz	JMEVDEQPCBHRKG-KSSFIOAISA-N	0	3	348.466	3.124	20	30		EGEDHN
Cc1[nH]ccc1C(=O)N[C@@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202694758	1369854699	/nfs/dbraw/zinc/85/46/99/1369854699.db2.gz	JSSLHZDUYBVIER-WOJBJXKFSA-N	0	3	347.462	3.005	20	30		EGEDHN
O=C(CC1CCC1)N[C@@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202696380	1369855463	/nfs/dbraw/zinc/85/54/63/1369855463.db2.gz	YZSCEFMMUHKGLV-VQTJNVASSA-N	0	3	336.479	3.245	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1C[C@H](NCc2c(C)noc2C)C12CCC2	ZINC001202766687	1369884550	/nfs/dbraw/zinc/88/45/50/1369884550.db2.gz	WRGXBKOMIIMMJD-ROUUACIJSA-N	0	3	343.471	3.002	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1C[C@H](NCc2oc(C)nc2C)C12CCC2	ZINC001202786647	1369891811	/nfs/dbraw/zinc/89/18/11/1369891811.db2.gz	VFQHHEVWLLOBKT-ZWKOTPCHSA-N	0	3	343.471	3.002	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1[C@H]2CN(CCc3ccccc3F)C[C@H]21	ZINC001114340202	1369900667	/nfs/dbraw/zinc/90/06/67/1369900667.db2.gz	BZCFLHUJYCFJFQ-MNZLEMJZSA-N	0	3	330.447	3.017	20	30		EGEDHN
C[C@H](c1ccccc1)N(Cc1ccc(C#N)cc1)C[C@@H]1CCC(=O)N1	ZINC001202898827	1369921157	/nfs/dbraw/zinc/92/11/57/1369921157.db2.gz	IRIWVDXYOMZAID-UZLBHIALSA-N	0	3	333.435	3.400	20	30		EGEDHN
C[C@@H](c1ccccc1)N(Cc1ccc(C#N)cc1)C[C@H]1CCC(=O)N1	ZINC001202898825	1369921215	/nfs/dbraw/zinc/92/12/15/1369921215.db2.gz	IRIWVDXYOMZAID-OXJNMPFZSA-N	0	3	333.435	3.400	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1[C@H]2CN(CCOc3ccc(C)cc3)C[C@H]21	ZINC001114720112	1370044630	/nfs/dbraw/zinc/04/46/30/1370044630.db2.gz	QNQQNLXMCUCYQJ-XFIJJGBISA-N	0	3	342.483	3.023	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1C[C@@H](NCC(=C)Br)C12CCC2	ZINC001203275284	1370056023	/nfs/dbraw/zinc/05/60/23/1370056023.db2.gz	SBMHSQHDISEEQL-CHWSQXEVSA-N	0	3	341.293	3.124	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1C[C@@H](NCc2cncs2)C12CCC2	ZINC001203294556	1370066437	/nfs/dbraw/zinc/06/64/37/1370066437.db2.gz	CZOQLHVTDLDLHL-IAGOWNOFSA-N	0	3	345.512	3.244	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1C[C@@H](NCc2c(C)noc2CC)C12CCC2	ZINC001203339718	1370089242	/nfs/dbraw/zinc/08/92/42/1370089242.db2.gz	JJGRVNPQWJIUCZ-MSOLQXFVSA-N	0	3	345.487	3.419	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H]2C[C@H](NCc3conc3C)C23CCC3)CC1	ZINC001203372128	1370102690	/nfs/dbraw/zinc/10/26/90/1370102690.db2.gz	COQSQUINZQIJJE-IRXDYDNUSA-N	0	3	343.471	3.246	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1C[C@H](NCc2ccns2)C12CCC2	ZINC001203453501	1370132307	/nfs/dbraw/zinc/13/23/07/1370132307.db2.gz	SPQUODUKFBXYPI-GJZGRUSLSA-N	0	3	333.501	3.262	20	30		EGEDHN
CCCCCCCCCC(=O)N[C@@H]1[C@H]2CN(CCn3cccn3)C[C@H]21	ZINC001115164295	1370322232	/nfs/dbraw/zinc/32/22/32/1370322232.db2.gz	SIRHMOSNTWMHHA-RUYXUALKSA-N	0	3	346.519	3.070	20	30		EGEDHN
CCCC(=O)NCC1(NCC#Cc2ccc(F)cc2)CCCCC1	ZINC001115381360	1370419534	/nfs/dbraw/zinc/41/95/34/1370419534.db2.gz	RALDOQZPRYBAQC-UHFFFAOYSA-N	0	3	330.447	3.386	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)CCSC)CCCCC1	ZINC001115397878	1370431464	/nfs/dbraw/zinc/43/14/64/1370431464.db2.gz	CQXGOIKSZHHVOI-UHFFFAOYSA-N	0	3	349.338	3.057	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cc(Cl)c[nH]2)CCCCC1	ZINC001115405686	1370436577	/nfs/dbraw/zinc/43/65/77/1370436577.db2.gz	BWCKOBYFAHLBKH-UHFFFAOYSA-N	0	3	330.259	3.443	20	30		EGEDHN
Cn1cc(CN2CCN(c3ccc(C#N)cc3)CC2)c2ccccc21	ZINC001204321657	1370443776	/nfs/dbraw/zinc/44/37/76/1370443776.db2.gz	RRNXJGLRCQDREC-UHFFFAOYSA-N	0	3	330.435	3.372	20	30		EGEDHN
CC(C)CCC(=O)N1CCC(CNCc2ccccc2C#N)CC1	ZINC001204437323	1370476791	/nfs/dbraw/zinc/47/67/91/1370476791.db2.gz	QNJUOEFBEIOZAF-UHFFFAOYSA-N	0	3	327.472	3.323	20	30		EGEDHN
CC1CC(C(=O)NCC2(NCC#Cc3ccccc3)CCCCC2)C1	ZINC001115476061	1370482057	/nfs/dbraw/zinc/48/20/57/1370482057.db2.gz	YLSCZLHZPLLFBS-UHFFFAOYSA-N	0	3	338.495	3.493	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)[C@H]2CC2(C)C)CCCCC1	ZINC001115485856	1370490078	/nfs/dbraw/zinc/49/00/78/1370490078.db2.gz	HMCUOFZFUPJYRH-CYBMUJFWSA-N	0	3	343.309	3.350	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2csnc2C)CCCCC1	ZINC001115492423	1370495038	/nfs/dbraw/zinc/49/50/38/1370495038.db2.gz	ZCJWUUSSVIBRHY-UHFFFAOYSA-N	0	3	327.881	3.226	20	30		EGEDHN
O=C(C#CC1CC1)NCC1(NCc2cccc(Cl)n2)CCCCC1	ZINC001115527208	1370525606	/nfs/dbraw/zinc/52/56/06/1370525606.db2.gz	GQQCDMTUSJLROA-UHFFFAOYSA-N	0	3	345.874	3.057	20	30		EGEDHN
Cc1cc(C#N)cc(C#N)c1Nc1ccc(CN2CCN(C)CC2)cc1	ZINC001204751826	1370565983	/nfs/dbraw/zinc/56/59/83/1370565983.db2.gz	ZVQWAGXCVIOIOG-UHFFFAOYSA-N	0	3	345.450	3.229	20	30		EGEDHN
CCC[C@H](C)C(=O)N1CCC(CNCc2cc(F)ccc2C#N)CC1	ZINC001204827513	1370584907	/nfs/dbraw/zinc/58/49/07/1370584907.db2.gz	OMGRRVFGLBWKCY-HNNXBMFYSA-N	0	3	345.462	3.462	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CCC(CNCc2ccncc2Cl)CC1	ZINC001205235590	1370690253	/nfs/dbraw/zinc/69/02/53/1370690253.db2.gz	BLQIZJOBBBBPAU-UHFFFAOYSA-N	0	3	347.890	3.113	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC1(NCc2nccnc2C)CCCCC1	ZINC001115712733	1370692169	/nfs/dbraw/zinc/69/21/69/1370692169.db2.gz	ZWLIRTLZHGTAIN-IBGZPJMESA-N	0	3	344.503	3.296	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CCc2cncs2)CCCCC1	ZINC001115730974	1370714107	/nfs/dbraw/zinc/71/41/07/1370714107.db2.gz	WMHMZCIFMZLHOL-UHFFFAOYSA-N	0	3	341.908	3.237	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)CCCC2CC2)CC[C@H]1c1ccc(F)cc1	ZINC001205307109	1370716332	/nfs/dbraw/zinc/71/63/32/1370716332.db2.gz	PHOIMQACUKOPHI-VQTJNVASSA-N	0	3	342.458	3.313	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)[C@@H]2C[C@H]2CC)CCCCC1	ZINC001115739073	1370721325	/nfs/dbraw/zinc/72/13/25/1370721325.db2.gz	RKBKNIZXLKRXDR-ZIAGYGMSSA-N	0	3	343.309	3.350	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C[C@H](C)CCC)C[C@H]1c1cccc(F)c1	ZINC001205386617	1370738503	/nfs/dbraw/zinc/73/85/03/1370738503.db2.gz	YLUBDFCWTGLSHV-AYOQOUSVSA-N	0	3	330.447	3.169	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC(CNCc2oc(CC)nc2C)CC1	ZINC001205398161	1370743681	/nfs/dbraw/zinc/74/36/81/1370743681.db2.gz	VLEYWJREHBCNEM-UHFFFAOYSA-N	0	3	347.503	3.476	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC(CNCc2ncc(C)s2)CC1	ZINC001205397678	1370743926	/nfs/dbraw/zinc/74/39/26/1370743926.db2.gz	HZXHOSCRSMTCPK-UHFFFAOYSA-N	0	3	335.517	3.382	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](c2cccc(F)c2)[C@H](NC/C=C\Cl)C1	ZINC001205401375	1370744721	/nfs/dbraw/zinc/74/47/21/1370744721.db2.gz	AMNUYOVRSAUAIR-MGEGMALFSA-N	0	3	348.849	3.266	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC(CNCc2nc(C)sc2C)CC1	ZINC001205404629	1370745142	/nfs/dbraw/zinc/74/51/42/1370745142.db2.gz	JAWRFEGJKZFAEN-UHFFFAOYSA-N	0	3	335.517	3.444	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC(CNCc3oc(C)nc3C)CC2)CC1	ZINC001206181877	1370984067	/nfs/dbraw/zinc/98/40/67/1370984067.db2.gz	WISVYPPGKPBVCO-UHFFFAOYSA-N	0	3	345.487	3.366	20	30		EGEDHN
CCCC1(C(=O)N2CCC(CNCc3ccccc3C#N)CC2)CC1	ZINC001206188613	1370987266	/nfs/dbraw/zinc/98/72/66/1370987266.db2.gz	XXDGTISYUOYUAR-UHFFFAOYSA-N	0	3	339.483	3.467	20	30		EGEDHN
CN1CCN(CCCOC(C#CC(C)(C)C)C#CC(C)(C)C)CC1	ZINC001206594951	1371104084	/nfs/dbraw/zinc/10/40/84/1371104084.db2.gz	DKFZRWIJKVDFJF-UHFFFAOYSA-N	0	3	332.532	3.108	20	30		EGEDHN
CCCCCCCCC(=O)N1CCC(CNCc2ccn(C)n2)CC1	ZINC001206891225	1371209887	/nfs/dbraw/zinc/20/98/87/1371209887.db2.gz	CPJGNGIXQPOWQU-UHFFFAOYSA-N	0	3	348.535	3.499	20	30		EGEDHN
Cc1ccc(CN2C[C@@H](C)[C@H](NC(=O)C#CC(C)(C)C)C2)c(C)c1	ZINC001206952130	1371242808	/nfs/dbraw/zinc/24/28/08/1371242808.db2.gz	ZMBQGKUIQGEONA-IEBWSBKVSA-N	0	3	326.484	3.289	20	30		EGEDHN
C[C@@H]1CN(CCc2ccc(Cl)cc2)C[C@H]1NC(=O)C#CC(C)(C)C	ZINC001206951736	1371243065	/nfs/dbraw/zinc/24/30/65/1371243065.db2.gz	HDSOORWCFVJYGA-CRAIPNDOSA-N	0	3	346.902	3.369	20	30		EGEDHN
O=C(C1CCC1)N1CCC[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207011456	1371266542	/nfs/dbraw/zinc/26/65/42/1371266542.db2.gz	ABOOABCOMJLJIE-SFHVURJKSA-N	0	3	330.859	3.072	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H]2CN(C/C=C\c3ccccc3)C[C@H]21	ZINC001187569316	1388126613	/nfs/dbraw/zinc/12/66/13/1388126613.db2.gz	GKLSEZYUIALOAY-VDXCVWLFSA-N	0	3	336.479	3.426	20	30		EGEDHN
CN(Cc1cc(C#N)n(C)c1)[C@]1(C)CCCN(C(=O)OC(C)(C)C)C1	ZINC001207111002	1371297012	/nfs/dbraw/zinc/29/70/12/1371297012.db2.gz	YRMCUZKOZCXHGJ-LJQANCHMSA-N	0	3	346.475	3.118	20	30		EGEDHN
O=C(c1ccc(Cl)o1)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001207306826	1371356096	/nfs/dbraw/zinc/35/60/96/1371356096.db2.gz	OEWQPGNYSDOBGF-INIZCTEOSA-N	0	3	342.826	3.179	20	30		EGEDHN
CC(C)(C)CC(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207335583	1371364089	/nfs/dbraw/zinc/36/40/89/1371364089.db2.gz	NCALLKKGTKUTNG-GOSISDBHSA-N	0	3	330.447	3.194	20	30		EGEDHN
N#Cc1ccc(C2CCN(Cc3cc(=O)[nH]c(C4CC4)n3)CC2)cc1	ZINC001119870087	1371416385	/nfs/dbraw/zinc/41/63/85/1371416385.db2.gz	OCKZGIMBQPMNQX-UHFFFAOYSA-N	0	3	334.423	3.311	20	30		EGEDHN
C/C(=C/C(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1)C1CC1	ZINC001207548875	1371432239	/nfs/dbraw/zinc/43/22/39/1371432239.db2.gz	BTEZABNCQGTEJV-FZWACIFYSA-N	0	3	340.442	3.114	20	30		EGEDHN
O=C(/C=C/C1CC1)N1CCC[C@@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207742265	1371491040	/nfs/dbraw/zinc/49/10/40/1371491040.db2.gz	UIZNWQDKWAVNOC-GNISGLHKSA-N	0	3	342.870	3.238	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N1CCC[C@@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207818953	1371512473	/nfs/dbraw/zinc/51/24/73/1371512473.db2.gz	CTHGZBOUUGNBJP-QZTJIDSGSA-N	0	3	344.886	3.318	20	30		EGEDHN
C#CCCCCC(=O)N1CCC[C@@H](NCc2ccnc(Cl)c2)C1	ZINC001207860167	1371522877	/nfs/dbraw/zinc/52/28/77/1371522877.db2.gz	IDLKYFHGBAXNBV-MRXNPFEDSA-N	0	3	333.863	3.009	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)CCC2CCCCCC2)C1	ZINC001208032928	1371574871	/nfs/dbraw/zinc/57/48/71/1371574871.db2.gz	BIDZYAANZNOKDF-IEBWSBKVSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@H](NCc2cn(C(C)C)nc2C)C1	ZINC001208239505	1371673603	/nfs/dbraw/zinc/67/36/03/1371673603.db2.gz	BJPMYKHAPABZHO-SFHVURJKSA-N	0	3	346.519	3.455	20	30		EGEDHN
O=C(c1[nH]ccc1C1CC1)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001208306003	1371707912	/nfs/dbraw/zinc/70/79/12/1371707912.db2.gz	QWLQVKFFAREBNA-IBGZPJMESA-N	0	3	347.462	3.138	20	30		EGEDHN
C#CCC1(C(=O)N2CCC[C@@H](NCc3ccnc(Cl)c3)C2)CCC1	ZINC001208319354	1371716563	/nfs/dbraw/zinc/71/65/63/1371716563.db2.gz	RKTHLLMPALRLEY-MRXNPFEDSA-N	0	3	345.874	3.009	20	30		EGEDHN
C#CCC1(C(=O)N2CCC[C@@H](NCc3ccc(F)c(F)c3)C2)CCC1	ZINC001208319797	1371716966	/nfs/dbraw/zinc/71/69/66/1371716966.db2.gz	ZNQALMWSIWLDJA-MRXNPFEDSA-N	0	3	346.421	3.239	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1CN(Cc2cccc(N(C)C)c2)C[C@H]1C	ZINC001208392907	1371750635	/nfs/dbraw/zinc/75/06/35/1371750635.db2.gz	FNPZIFDOODVTJC-MBOZVWFJSA-N	0	3	343.515	3.291	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1)C(C)(C)C	ZINC001208424464	1371762771	/nfs/dbraw/zinc/76/27/71/1371762771.db2.gz	ZFMIDWHWXMRBNK-PKOBYXMFSA-N	0	3	326.484	3.301	20	30		EGEDHN
C=CCCC(=O)NC1CC2(CC(NCc3cc(C4CC4)no3)C2)C1	ZINC001120819214	1371771741	/nfs/dbraw/zinc/77/17/41/1371771741.db2.gz	SILNJJVUOVYNCQ-UHFFFAOYSA-N	0	3	329.444	3.035	20	30		EGEDHN
N#Cc1ccccc1CNC1CC2(C1)CC(NC(=O)/C=C/C1CC1)C2	ZINC001120907215	1371802863	/nfs/dbraw/zinc/80/28/63/1371802863.db2.gz	GPYUFBYJECCSPI-BQYQJAHWSA-N	0	3	335.451	3.041	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CN(CCCOc3ccccc3)C[C@H]2C)C1	ZINC001208546469	1371810638	/nfs/dbraw/zinc/81/06/38/1371810638.db2.gz	JNGHXIMIBDCAIZ-IEBWSBKVSA-N	0	3	342.483	3.248	20	30		EGEDHN
COc1cccc(N2CCN(CCCc3cccc(C#N)c3)CC2)c1	ZINC001208846272	1371915383	/nfs/dbraw/zinc/91/53/83/1371915383.db2.gz	YWTCWDRNNPTHJU-UHFFFAOYSA-N	0	3	335.451	3.322	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)CCc1cncc(C)c1)C2	ZINC001121390267	1371959641	/nfs/dbraw/zinc/95/96/41/1371959641.db2.gz	MNXSBRICAQYMPO-UHFFFAOYSA-N	0	3	347.890	3.092	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CN(C[C@H](OC)c2ccccc2)C[C@H]1C	ZINC001208953833	1371960978	/nfs/dbraw/zinc/96/09/78/1371960978.db2.gz	ADQSEQGQZMOBPY-QRQLOZEOSA-N	0	3	344.499	3.413	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC[C@@H](NCc2ncccc2C)C1	ZINC001209005316	1371973368	/nfs/dbraw/zinc/97/33/68/1371973368.db2.gz	UZTABDNFKLMVOX-GOSISDBHSA-N	0	3	327.472	3.054	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CCC[C@@H](NCC#Cc2ccccc2Cl)C1	ZINC001209017397	1371976215	/nfs/dbraw/zinc/97/62/15/1371976215.db2.gz	KYOFJMQQUATCMS-NVXWUHKLSA-N	0	3	336.838	3.020	20	30		EGEDHN
C=CCN(CCN(C)Cc1cccc2cccnc21)C(=O)OCC	ZINC001209022206	1371976553	/nfs/dbraw/zinc/97/65/53/1371976553.db2.gz	JEUJVIVPMJMNIR-UHFFFAOYSA-N	0	3	327.428	3.311	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@H](NCc2c(C)nsc2C)C1	ZINC001209147139	1372014997	/nfs/dbraw/zinc/01/49/97/1372014997.db2.gz	SUZLUWVKFXQHKQ-CJNGLKHVSA-N	0	3	335.517	3.443	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC1CC2(C1)CC(N[C@H](C)c1cnccn1)C2	ZINC001121616660	1372027077	/nfs/dbraw/zinc/02/70/77/1372027077.db2.gz	NUWUVFOLVGZHDJ-CZFKBKNTSA-N	0	3	342.487	3.157	20	30		EGEDHN
CC(C)c1[nH]ccc1C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001209196026	1372034205	/nfs/dbraw/zinc/03/42/05/1372034205.db2.gz	ZDNJOMGZBVYFCK-IBGZPJMESA-N	0	3	349.478	3.384	20	30		EGEDHN
C=CCn1c(C(F)F)nnc1N1CCN(CC2CCCCC2)CC1	ZINC001121698631	1372050331	/nfs/dbraw/zinc/05/03/31/1372050331.db2.gz	OWZJESGJLJAUTI-UHFFFAOYSA-N	0	3	339.434	3.104	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001209335183	1372072104	/nfs/dbraw/zinc/07/21/04/1372072104.db2.gz	IOLUUPPULIDUAZ-LJQANCHMSA-N	0	3	328.431	3.114	20	30		EGEDHN
O=C(C1CCC(F)CC1)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001209453898	1372110184	/nfs/dbraw/zinc/11/01/84/1372110184.db2.gz	GBZPPOZXCDFZSS-MHJFOBGBSA-N	0	3	342.458	3.147	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC[C@H](NCc3ccc(C#N)s3)C2)CC1	ZINC001209493446	1372120235	/nfs/dbraw/zinc/12/02/35/1372120235.db2.gz	MBQBJFQAIBMBOV-HNNXBMFYSA-N	0	3	343.496	3.447	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N[C@H](Cc1ccc(C)cc1)c1ccccn1	ZINC001121923695	1372123716	/nfs/dbraw/zinc/12/37/16/1372123716.db2.gz	RDEPPBIHPWMOMU-AZUAARDMSA-N	0	3	337.467	3.474	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)NCc1ccc(Oc2cccnc2)c(F)c1	ZINC001121988133	1372146503	/nfs/dbraw/zinc/14/65/03/1372146503.db2.gz	JEDSFJHOUJNGQQ-QGZVFWFLSA-N	0	3	343.402	3.313	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1cc(Br)c(C)cc1OC	ZINC001122042832	1372159926	/nfs/dbraw/zinc/15/99/26/1372159926.db2.gz	QQKRSQCQHMKBAK-GFCCVEGCSA-N	0	3	341.249	3.388	20	30		EGEDHN
O=C([C@@H]1C[C@H]1c1ccco1)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001209737522	1372180448	/nfs/dbraw/zinc/18/04/48/1372180448.db2.gz	UPPXQVIZWKMXRS-VAMGGRTRSA-N	0	3	348.446	3.015	20	30		EGEDHN
O=C([C@@H]1CC12CC2)N1CCC[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001209808951	1372204779	/nfs/dbraw/zinc/20/47/79/1372204779.db2.gz	QOOZJYAFJBRTCP-IRXDYDNUSA-N	0	3	342.870	3.072	20	30		EGEDHN
CC[C@H](C)c1ccc(NC(=O)C(C#N)C(=O)COC(F)(F)F)cc1	ZINC001122547855	1372272741	/nfs/dbraw/zinc/27/27/41/1372272741.db2.gz	YMXWFEBDHBTONI-GXFFZTMASA-N	0	3	342.317	3.384	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)Cc1cccc(Br)c1C	ZINC001123337161	1372431456	/nfs/dbraw/zinc/43/14/56/1372431456.db2.gz	OBJIFJUFEMBMIR-CYBMUJFWSA-N	0	3	346.228	3.393	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)[C@H](CCC)c2ccccc2)C1	ZINC001210824636	1372433595	/nfs/dbraw/zinc/43/35/95/1372433595.db2.gz	PCWURQDITIULOX-MISYRCLQSA-N	0	3	344.499	3.209	20	30		EGEDHN
CCc1ccc(C(=O)N2CCC[C@@H](NCC#Cc3ccccc3)C2)cc1	ZINC001210913494	1372452383	/nfs/dbraw/zinc/45/23/83/1372452383.db2.gz	PJMCVBAVWHHGPD-JOCHJYFZSA-N	0	3	346.474	3.495	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1CN([C@@H](CC)c2ccc(F)cc2)C[C@H]1C	ZINC001211422990	1372555735	/nfs/dbraw/zinc/55/57/35/1372555735.db2.gz	WIIPITWLUDWCOV-LZQZEXGQSA-N	0	3	348.462	3.306	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@@H](C)CCOc2ccccc2)C1	ZINC001211473086	1372565593	/nfs/dbraw/zinc/56/55/93/1372565593.db2.gz	DPMMMMPBPBRYPV-YQVWRLOYSA-N	0	3	330.472	3.104	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](c2ccccc2)[C@H](NCc2ccns2)C1	ZINC001211553606	1372579349	/nfs/dbraw/zinc/57/93/49/1372579349.db2.gz	HZHDHCALBGBBEU-ZWKOTPCHSA-N	0	3	341.480	3.194	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C23CCC(CC2)C3)C[C@H]1c1ccccc1	ZINC001211623961	1372592380	/nfs/dbraw/zinc/59/23/80/1372592380.db2.gz	XXUQZJGWMLZOMP-GWFKXHKXSA-N	0	3	336.479	3.174	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2ccccc2F)[C@H](OC)C1	ZINC001211765701	1372613112	/nfs/dbraw/zinc/61/31/12/1372613112.db2.gz	ITJYNGGMWVGTNP-QZTJIDSGSA-N	0	3	336.451	3.225	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H]1CN(CC/C=C\CCC)C[C@H]1OC	ZINC001212337484	1372690857	/nfs/dbraw/zinc/69/08/57/1372690857.db2.gz	PQYCNSVJIFEIQC-NKIGNDQYSA-N	0	3	342.911	3.327	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CN([C@H](C)c2cccc(C)c2)C[C@H]1OC	ZINC001212341282	1372691073	/nfs/dbraw/zinc/69/10/73/1372691073.db2.gz	ZTDAUCWZIHXQNO-BHIYHBOVSA-N	0	3	344.499	3.474	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@@H]2CCC(F)(F)C2)[C@H](OC)C1	ZINC001212377361	1372696653	/nfs/dbraw/zinc/69/66/53/1372696653.db2.gz	HSPMUHKCDOLITN-BZUAXINKSA-N	0	3	346.462	3.208	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NCCN[C@@H](C)c1ccc(F)c(Cl)c1	ZINC001124496162	1372707103	/nfs/dbraw/zinc/70/71/03/1372707103.db2.gz	XCCUCZOSPNPYSY-QWHCGFSZSA-N	0	3	342.842	3.227	20	30		EGEDHN
CCN1CCN(c2ccc(Nc3ccc(OCC#N)cc3)cc2)CC1	ZINC001212608173	1372737153	/nfs/dbraw/zinc/73/71/53/1372737153.db2.gz	SVHXEQWBGNHGEG-UHFFFAOYSA-N	0	3	336.439	3.474	20	30		EGEDHN
CCCCCCCCS(=O)(=O)N[C@H]1CCN(CC2CCC2)C1	ZINC001188030168	1388221626	/nfs/dbraw/zinc/22/16/26/1388221626.db2.gz	JDKBBRINGMRJGR-KRWDZBQOSA-N	0	3	330.538	3.141	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@H]2CC[C@@H]3C[C@@H]3CC2)[C@H](OC)C1	ZINC001213201724	1372859222	/nfs/dbraw/zinc/85/92/22/1372859222.db2.gz	WCHNTYWFWXEXKQ-USYVTKNRSA-N	0	3	348.531	3.375	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H](NC(=O)c2cc3occc3s2)[C@H](OC)C1	ZINC001213434793	1372906317	/nfs/dbraw/zinc/90/63/17/1372906317.db2.gz	LIOLHMMWBOHNKZ-GZBFAFLISA-N	0	3	348.468	3.278	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)[C@@H](CC)CC2CCCC2)[C@H](OC)C1	ZINC001213524521	1372918871	/nfs/dbraw/zinc/91/88/71/1372918871.db2.gz	HWEJXYHLEYJWNH-IPMKNSEASA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@@H](C)C2CCCC2)[C@H](OC)C1	ZINC001213702388	1372947281	/nfs/dbraw/zinc/94/72/81/1372947281.db2.gz	IUOQAZKUBWFEMD-QXAKKESOSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H](NC(=O)c2ccc(Cl)s2)[C@H](OC)C1	ZINC001213810942	1372964776	/nfs/dbraw/zinc/96/47/76/1372964776.db2.gz	FBYWHYUSHKYSRL-JHJVBQTASA-N	0	3	342.892	3.185	20	30		EGEDHN
C=C[C@H](C(=O)N[C@@H]1CN(CC/C=C\CC)C[C@H]1OC)c1ccccc1	ZINC001213900216	1372978010	/nfs/dbraw/zinc/97/80/10/1372978010.db2.gz	VNAWFPQDRWLBCI-STEYPSJLSA-N	0	3	342.483	3.128	20	30		EGEDHN
CCCCC(=O)N1C[C@@H](C)[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001214161914	1373017665	/nfs/dbraw/zinc/01/76/65/1373017665.db2.gz	MFNATNVDZPDSDT-CRAIPNDOSA-N	0	3	332.875	3.318	20	30		EGEDHN
CC(C)C#CC(=O)NCCN[C@@H](C)c1ccc(Cl)c(Cl)c1	ZINC001126816007	1373033419	/nfs/dbraw/zinc/03/34/19/1373033419.db2.gz	RFPWOFQATQATFM-LBPRGKRZSA-N	0	3	327.255	3.420	20	30		EGEDHN
CCC[C@@H](C)CC(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001214296455	1373039077	/nfs/dbraw/zinc/03/90/77/1373039077.db2.gz	IODWKPIUYADKMG-CKEIUWERSA-N	0	3	333.501	3.383	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001214304397	1373040839	/nfs/dbraw/zinc/04/08/39/1373040839.db2.gz	QUYSGCSIYUXWGK-CRAIPNDOSA-N	0	3	330.859	3.094	20	30		EGEDHN
CC(C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2)C1)=C1CCCC1	ZINC001214422715	1373058661	/nfs/dbraw/zinc/05/86/61/1373058661.db2.gz	XXQNEHDVQVTINM-DYESRHJHSA-N	0	3	336.479	3.365	20	30		EGEDHN
CCC(=CC(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(F)cc2)C1)CC	ZINC001214435545	1373061017	/nfs/dbraw/zinc/06/10/17/1373061017.db2.gz	KVPRTVCTIFBEQI-OXQOHEQNSA-N	0	3	342.458	3.360	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H]2CN(CCOc3cccc(C)c3)C[C@H]21	ZINC001188086993	1388239603	/nfs/dbraw/zinc/23/96/03/1388239603.db2.gz	KAQNATMLPURISG-AZUAARDMSA-N	0	3	342.483	3.263	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2)C1	ZINC001214708346	1373106109	/nfs/dbraw/zinc/10/61/09/1373106109.db2.gz	BRQDURKKUFGGDA-IEBWSBKVSA-N	0	3	326.484	3.157	20	30		EGEDHN
C[C@H](C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2)C1)C(C)(C)C	ZINC001214967340	1373149192	/nfs/dbraw/zinc/14/91/92/1373149192.db2.gz	XIDVBZNRQZZGLF-ZHALLVOQSA-N	0	3	326.484	3.157	20	30		EGEDHN
C#CCCCC(=O)N1CCO[C@@H]2CN(CCC3CCCCCC3)C[C@@H]21	ZINC001217759031	1373498896	/nfs/dbraw/zinc/49/88/96/1373498896.db2.gz	YCZQGZBBMHTECS-VQTJNVASSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2OCCN(C(=O)c3cccc(C)c3F)[C@H]2C1	ZINC001217953264	1373517654	/nfs/dbraw/zinc/51/76/54/1373517654.db2.gz	BOCKBBIXHFBQBT-RYQLBKOJSA-N	0	3	346.446	3.014	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)[C@H](CCC)C(C)C)C1	ZINC001130431348	1373536407	/nfs/dbraw/zinc/53/64/07/1373536407.db2.gz	VYUTVORWSAEGGT-NVXWUHKLSA-N	0	3	332.492	3.074	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)[C@](C)(CC)CCC)C1	ZINC001130438622	1373539493	/nfs/dbraw/zinc/53/94/93/1373539493.db2.gz	NARKWCYMCMITBS-DNVCBOLYSA-N	0	3	332.492	3.218	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)C[C@H](C)C(C)(C)C)C1	ZINC001130442889	1373541578	/nfs/dbraw/zinc/54/15/78/1373541578.db2.gz	PGSYPKXOXXVTBE-LSDHHAIUSA-N	0	3	332.492	3.074	20	30		EGEDHN
C=C(C)CCC(=O)N1CCO[C@@H]2CN([C@@H](CC)c3ccccc3)C[C@@H]21	ZINC001218040518	1373545831	/nfs/dbraw/zinc/54/58/31/1373545831.db2.gz	BLSKNYISJXLBDP-SLFFLAALSA-N	0	3	342.483	3.406	20	30		EGEDHN
CCC[C@@H]1CCC[C@@H]1C(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001130567338	1373560898	/nfs/dbraw/zinc/56/08/98/1373560898.db2.gz	UJDHMARHLMMXAH-WBVHZDCISA-N	0	3	331.435	3.120	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)c3[nH]c(C)cc3C)[C@H]2C1	ZINC001218176886	1373573211	/nfs/dbraw/zinc/57/32/11/1373573211.db2.gz	RMJPTLFVKCUTAD-ZWKOTPCHSA-N	0	3	347.503	3.127	20	30		EGEDHN
C#CCCCCCC(=O)N1CCO[C@@H]2CN(CC/C=C\CCC)C[C@@H]21	ZINC001218455091	1373617189	/nfs/dbraw/zinc/61/71/89/1373617189.db2.gz	MGKHRPVNAIOGCM-SJGBYXOVSA-N	0	3	346.515	3.228	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)C/C=C(/C)C=C)[C@H]2C1	ZINC001218487664	1373623856	/nfs/dbraw/zinc/62/38/56/1373623856.db2.gz	LWRVQACUURRVNY-KWFFUSLTSA-N	0	3	332.488	3.167	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cc(Cl)ccc2F)cc1F	ZINC001131029342	1373627292	/nfs/dbraw/zinc/62/72/92/1373627292.db2.gz	NDGSANVREMUDDN-UHFFFAOYSA-N	0	3	349.768	3.009	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2OCCN(C(=O)c3ccc(C=C)cc3)[C@H]2C1	ZINC001218665460	1373642310	/nfs/dbraw/zinc/64/23/10/1373642310.db2.gz	GGZNKZZWKYYVAH-FFZOFVMBSA-N	0	3	340.467	3.210	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)CCc2cccc(C)c2)[C@@H](O)C1	ZINC001220090511	1373751715	/nfs/dbraw/zinc/75/17/15/1373751715.db2.gz	NFNJYJYPAQDCAO-UXHICEINSA-N	0	3	346.515	3.059	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C(CCC)CCC)C[C@@H](C)O2	ZINC001131681652	1373760392	/nfs/dbraw/zinc/76/03/92/1373760392.db2.gz	GBGOBDWAILDBCL-YLJYHZDGSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@H](C)O[C@@]2(CCN(CC=C(C)C)C2)C1	ZINC001131688993	1373764667	/nfs/dbraw/zinc/76/46/67/1373764667.db2.gz	VQKWDNUKUVCWBW-FXAWDEMLSA-N	0	3	334.504	3.247	20	30		EGEDHN
Cc1cc2occ(C(=O)NCCNCc3cccc(C#N)c3)c2cc1C	ZINC001131824712	1373823920	/nfs/dbraw/zinc/82/39/20/1373823920.db2.gz	GGWVPTUVKOPIGS-UHFFFAOYSA-N	0	3	347.418	3.441	20	30		EGEDHN
Cc1cccc(C)c1CN1C[C@@H](NC(=O)CSCC#N)CC[C@H]1C	ZINC001131825216	1373825090	/nfs/dbraw/zinc/82/50/90/1373825090.db2.gz	IFNCZZRKIVSLLN-SJORKVTESA-N	0	3	345.512	3.029	20	30		EGEDHN
CCCCCC(=O)NCC1CCN(Cc2cccc(C#N)c2)CC1	ZINC001222372281	1373826830	/nfs/dbraw/zinc/82/68/30/1373826830.db2.gz	SZMVVOMILPRENT-UHFFFAOYSA-N	0	3	327.472	3.467	20	30		EGEDHN
Cc1ccc(CN2C[C@@H](NC(=O)CSCC#N)CC[C@@H]2C)c(C)c1	ZINC001131830308	1373827814	/nfs/dbraw/zinc/82/78/14/1373827814.db2.gz	PSNCAIGOPFVNAD-WMZOPIPTSA-N	0	3	345.512	3.029	20	30		EGEDHN
C#CCCCCC(=O)NCC1CCN(Cc2c(C)nsc2C)CC1	ZINC001222871563	1373905168	/nfs/dbraw/zinc/90/51/68/1373905168.db2.gz	DYJMMXUEMDVUHV-UHFFFAOYSA-N	0	3	347.528	3.282	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](NCc3cc(C)ns3)C2)CCCC1	ZINC001188490757	1388318397	/nfs/dbraw/zinc/31/83/97/1388318397.db2.gz	ZNNWPIGYVHMDKX-OAHLLOKOSA-N	0	3	333.501	3.279	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC1CCN(Cc2cccc(C#N)c2)CC1	ZINC001224013549	1375052263	/nfs/dbraw/zinc/05/22/63/1375052263.db2.gz	CAZYKTGRHBLWCK-UHFFFAOYSA-N	0	3	339.483	3.489	20	30		EGEDHN
CC#CCCCC(=O)NCC1CCN(Cc2ccc(F)cc2)CC1	ZINC001224157938	1375057143	/nfs/dbraw/zinc/05/71/43/1375057143.db2.gz	MCORXGGEPVLCJO-UHFFFAOYSA-N	0	3	330.447	3.348	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@H](C)N(Cc2ccc3c(c2)CCC3)C1	ZINC001131994998	1375088548	/nfs/dbraw/zinc/08/85/48/1375088548.db2.gz	FLEBUHUXSASDED-LAUBAEHRSA-N	0	3	338.495	3.448	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H]1CC[C@@H](C)N(Cc2ccc3c(c2)CCC3)C1	ZINC001132017147	1375100641	/nfs/dbraw/zinc/10/06/41/1375100641.db2.gz	MIKPLWQLYPKECA-UTKZUKDTSA-N	0	3	338.495	3.304	20	30		EGEDHN
Cc1ccc(CN2C[C@H](NC(=O)C#CC(C)C)CC[C@@H]2C)c(C)c1	ZINC001132021721	1375102077	/nfs/dbraw/zinc/10/20/77/1375102077.db2.gz	OWFJDCPXUSADHI-AZUAARDMSA-N	0	3	326.484	3.432	20	30		EGEDHN
Cc1cc(CN2C[C@@H](NC(=O)C#CC3CC3)CC[C@H]2C)c(C)s1	ZINC001132034743	1375109209	/nfs/dbraw/zinc/10/92/09/1375109209.db2.gz	UTWPDWKICKYXNE-ACJLOTCBSA-N	0	3	330.497	3.247	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1CC[C@H](C)N(CCOCC2CCC2)C1	ZINC001132060533	1375126418	/nfs/dbraw/zinc/12/64/18/1375126418.db2.gz	HAHDUAZQZWSXRP-WMZOPIPTSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)Cc2c(C)cccc2C)CC[C@H]1C	ZINC001132065517	1375128869	/nfs/dbraw/zinc/12/88/69/1375128869.db2.gz	VMWSAIGXFQSKSE-RTBURBONSA-N	0	3	344.499	3.018	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CC[C@H](C)N(CCOc2ccccc2)C1	ZINC001132071616	1375132547	/nfs/dbraw/zinc/13/25/47/1375132547.db2.gz	BOVXPXQNMGBDEV-ZWKOTPCHSA-N	0	3	330.472	3.391	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CC[C@@H](C)N(CCOc2ccccc2)C1	ZINC001132071614	1375132598	/nfs/dbraw/zinc/13/25/98/1375132598.db2.gz	BOVXPXQNMGBDEV-QZTJIDSGSA-N	0	3	330.472	3.391	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CC[C@@H](C)N(CCOCCCC)C1	ZINC001132106169	1375151211	/nfs/dbraw/zinc/15/12/11/1375151211.db2.gz	QSVXLORQENPKBI-MSOLQXFVSA-N	0	3	347.503	3.074	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCc2ccc(OCC)cc2)CC[C@@H]1C	ZINC001132150551	1375171571	/nfs/dbraw/zinc/17/15/71/1375171571.db2.gz	RZPXEMRMHMCISN-WMZOPIPTSA-N	0	3	330.472	3.173	20	30		EGEDHN
C[C@@H](N[C@@H]1CCCC[C@H]1NC(=O)C#CC1CC1)c1ccccc1F	ZINC001226133363	1375209023	/nfs/dbraw/zinc/20/90/23/1375209023.db2.gz	AYKRFKOFAPWYMP-NIKGAXFTSA-N	0	3	328.431	3.317	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CC[C@@H](C)N(CCOc2ccccc2)C1	ZINC001132223380	1375220449	/nfs/dbraw/zinc/22/04/49/1375220449.db2.gz	CLZQBGZCHZPEFL-RTBURBONSA-N	0	3	342.483	3.228	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC1CCN(C/C=C\c2ccccc2)CC1	ZINC001226455269	1375262446	/nfs/dbraw/zinc/26/24/46/1375262446.db2.gz	DOABYYHCCMECAL-YFWYWMRJSA-N	0	3	342.483	3.262	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC[C@H](C)N(CCOCCC(C)C)C2)C1	ZINC001132286546	1375267756	/nfs/dbraw/zinc/26/77/56/1375267756.db2.gz	BNBPIGXPAPHCIU-ROUUACIJSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)C[C@@H](OCC)C(=C)C	ZINC001226541681	1375279064	/nfs/dbraw/zinc/27/90/64/1375279064.db2.gz	CVBFGQCANKZCNE-BZUAXINKSA-N	0	3	328.884	3.127	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1CC[C@@H](C)N(Cc2ccc(CO)cc2)C1	ZINC001132330275	1375308780	/nfs/dbraw/zinc/30/87/80/1375308780.db2.gz	DOKZNZDJCOIKKH-APWZRJJASA-N	0	3	344.499	3.250	20	30		EGEDHN
C=CCOCCCC(=O)NC1CCN(Cc2ccc(C)cc2)CC1	ZINC001226759829	1375326685	/nfs/dbraw/zinc/32/66/85/1375326685.db2.gz	BMVYYQGXTKAZKE-UHFFFAOYSA-N	0	3	330.472	3.058	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)C[C@H](OCC)C(C)C	ZINC001226766249	1375329328	/nfs/dbraw/zinc/32/93/28/1375329328.db2.gz	KLXXNTAPLQKHBO-OAGGEKHMSA-N	0	3	330.900	3.207	20	30		EGEDHN
C#CCCCCC(=O)NC1CCN(CCCCC(F)(F)F)CC1	ZINC001226951836	1375368346	/nfs/dbraw/zinc/36/83/46/1375368346.db2.gz	KDPXLLCXSHKPPW-UHFFFAOYSA-N	0	3	332.410	3.493	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2cc(C)cc(C)c2)CC[C@H]1C	ZINC001132444596	1375387797	/nfs/dbraw/zinc/38/77/97/1375387797.db2.gz	CGXPGSACZYSHDG-MJGOQNOKSA-N	0	3	330.472	3.089	20	30		EGEDHN
O=C(Cc1ccccc1)N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1	ZINC001227099121	1375389472	/nfs/dbraw/zinc/38/94/72/1375389472.db2.gz	TTXGNSWGGHJURP-FGZHOGPDSA-N	0	3	346.474	3.298	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2ccc(C)cc2C)CC[C@H]1C	ZINC001132458184	1375400997	/nfs/dbraw/zinc/40/09/97/1375400997.db2.gz	QXZFZINJAVNJKE-MSOLQXFVSA-N	0	3	330.472	3.089	20	30		EGEDHN
CC(C)C#CC(=O)NC1CCN([C@H]2CCCc3ccc(F)cc32)CC1	ZINC001227243649	1375411077	/nfs/dbraw/zinc/41/10/77/1375411077.db2.gz	BGRBWTUPWGMULH-FQEVSTJZSA-N	0	3	342.458	3.443	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCc2cc(F)ccc2F)CC[C@@H]1C	ZINC001132524833	1375440577	/nfs/dbraw/zinc/44/05/77/1375440577.db2.gz	MMMBZVQNDORPNT-WMLDXEAASA-N	0	3	336.426	3.443	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NC1CCN(Cc2ccc(C)cc2)CC1)OCC	ZINC001227606864	1375452252	/nfs/dbraw/zinc/45/22/52/1375452252.db2.gz	BSCZFYUVSDLMBU-FQEVSTJZSA-N	0	3	344.499	3.447	20	30		EGEDHN
C#CCN1CC[C@@H](CN(Cc2scnc2C)C(=O)/C=C(\C)CC)C1	ZINC001132563264	1375469382	/nfs/dbraw/zinc/46/93/82/1375469382.db2.gz	QBQGDBCWWDNDOO-IUYQLWOBSA-N	0	3	345.512	3.092	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)C1(CC)CCC1	ZINC001228080873	1375515743	/nfs/dbraw/zinc/51/57/43/1375515743.db2.gz	WXWSRIFCOTWFER-ZIAGYGMSSA-N	0	3	343.309	3.492	20	30		EGEDHN
CC/C=C(/C)C(=O)N1CC[C@H](C)[C@@H](CNCc2ccccc2C#N)C1	ZINC001132697954	1375520260	/nfs/dbraw/zinc/52/02/60/1375520260.db2.gz	UKEJGCXIZAXALD-JTLQBXQTSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CCCC[C@H]2NCc2ccc(F)cn2)CCC1	ZINC001228406409	1375566516	/nfs/dbraw/zinc/56/65/16/1375566516.db2.gz	FRABBEMCVXRKFM-QZTJIDSGSA-N	0	3	345.462	3.484	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@H](NC(=O)CCC3CC3)CC2)c1	ZINC001327109570	1388382569	/nfs/dbraw/zinc/38/25/69/1388382569.db2.gz	CWJGHYOZMLGBRT-IBGZPJMESA-N	0	3	325.456	3.219	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](C)[C@H](CNCc2ccn(C(C)C)n2)C1	ZINC001132864699	1375607222	/nfs/dbraw/zinc/60/72/22/1375607222.db2.gz	AIZQFTLCDLLNFS-ZWKOTPCHSA-N	0	3	346.519	3.395	20	30		EGEDHN
CC#CCCCC(=O)NC1CCN(Cc2sc(C)nc2C)CC1	ZINC001228716964	1375650605	/nfs/dbraw/zinc/65/06/05/1375650605.db2.gz	BJGFOLITYDOAMJ-UHFFFAOYSA-N	0	3	333.501	3.034	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NC1CCN(CCOc2cccc(F)c2)CC1	ZINC001228749114	1375661729	/nfs/dbraw/zinc/66/17/29/1375661729.db2.gz	PTTHZLGOESJDOL-CVEARBPZSA-N	0	3	348.462	3.243	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NC1CCN(CCOc2cccc(F)c2)CC1	ZINC001228749115	1375662085	/nfs/dbraw/zinc/66/20/85/1375662085.db2.gz	PTTHZLGOESJDOL-HOTGVXAUSA-N	0	3	348.462	3.243	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NC1CCN(Cc2cccc(N(C)C)c2)CC1	ZINC001228760353	1375667377	/nfs/dbraw/zinc/66/73/77/1375667377.db2.gz	LCNSFZKAQSNHHF-SJORKVTESA-N	0	3	343.515	3.291	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)C(C2CCC2)C2CCC2)cc1F	ZINC001132966902	1375680814	/nfs/dbraw/zinc/68/08/14/1375680814.db2.gz	WPEODQDNTPFWIT-UHFFFAOYSA-N	0	3	343.446	3.120	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](C)[C@@H](CNCc2cnc(C)o2)C1	ZINC001133038902	1375730579	/nfs/dbraw/zinc/73/05/79/1375730579.db2.gz	HSZUQCBBMCZGKJ-WMZOPIPTSA-N	0	3	345.487	3.141	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](C)[C@H](CNCc2cnc(C)o2)C1	ZINC001133038901	1375730696	/nfs/dbraw/zinc/73/06/96/1375730696.db2.gz	HSZUQCBBMCZGKJ-SJLPKXTDSA-N	0	3	345.487	3.141	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC1CCN(CCOc2ccccc2)CC1	ZINC001229017029	1375738900	/nfs/dbraw/zinc/73/89/00/1375738900.db2.gz	PFWVACPPBSFXSC-FQEVSTJZSA-N	0	3	330.472	3.248	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](C)[C@@H](CNCc3ocnc3C)C2)CC1	ZINC001133105787	1375779155	/nfs/dbraw/zinc/77/91/55/1375779155.db2.gz	XMLPJMJAIDZCDC-WBVHZDCISA-N	0	3	345.487	3.304	20	30		EGEDHN
Cc1cc(C(=O)NCCNCc2ccc(F)c(C#N)c2)ccc1Cl	ZINC001133244774	1375864574	/nfs/dbraw/zinc/86/45/74/1375864574.db2.gz	ODNFQRRDTBWXEP-UHFFFAOYSA-N	0	3	345.805	3.179	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H](OC)c1ccccc1	ZINC001229808528	1375896359	/nfs/dbraw/zinc/89/63/59/1375896359.db2.gz	UEYPPVCFYSYZBW-BRWVUGGUSA-N	0	3	336.863	3.144	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCNCc1ccc(Br)s1	ZINC001133383680	1375964257	/nfs/dbraw/zinc/96/42/57/1375964257.db2.gz	WKMNFSKXLIISFV-CQSZACIVSA-N	0	3	345.306	3.319	20	30		EGEDHN
C=CCC1(C(=O)NCCNCc2ccc(Cl)c(OC)c2)CCC1	ZINC001133395680	1375980020	/nfs/dbraw/zinc/98/00/20/1375980020.db2.gz	WIEONQALSSAQBB-UHFFFAOYSA-N	0	3	336.863	3.301	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1c(C)coc1C	ZINC001133396079	1375980119	/nfs/dbraw/zinc/98/01/19/1375980119.db2.gz	QEIDSVWZDKSXRH-UHFFFAOYSA-N	0	3	344.842	3.415	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)COC1CCC(C)CC1	ZINC001230341722	1376004468	/nfs/dbraw/zinc/00/44/68/1376004468.db2.gz	SOPPLWQTIOXPCS-OKEQZYBDSA-N	0	3	342.911	3.351	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)CC(C)(C)c2ccccc2)CC1	ZINC001230374275	1376009646	/nfs/dbraw/zinc/00/96/46/1376009646.db2.gz	MPNKFSWAXPXJLZ-UHFFFAOYSA-N	0	3	344.499	3.138	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2cc3cccc(C)c3o2)CC1	ZINC001230377980	1376010984	/nfs/dbraw/zinc/01/09/84/1376010984.db2.gz	GLKMHKRVQFYXQC-UHFFFAOYSA-N	0	3	342.439	3.138	20	30		EGEDHN
C#CCC1(C(=O)NC2CCN(CCOCCCC)CC2)CCCCC1	ZINC001230399405	1376019016	/nfs/dbraw/zinc/01/90/16/1376019016.db2.gz	OOJFEPHFQYPRHB-UHFFFAOYSA-N	0	3	348.531	3.358	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NC1CCN([C@@H](C)c2cccc(F)c2)CC1	ZINC001230415761	1376023510	/nfs/dbraw/zinc/02/35/10/1376023510.db2.gz	YHJIUGZTKUAWNC-GJZGRUSLSA-N	0	3	334.435	3.058	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NC1CCN([C@@H](C)c2cccc(F)c2)CC1	ZINC001230415763	1376024160	/nfs/dbraw/zinc/02/41/60/1376024160.db2.gz	YHJIUGZTKUAWNC-LSDHHAIUSA-N	0	3	334.435	3.058	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1C1CCN(C(=O)CC[C@H](C)OC)CC1	ZINC001230552053	1376074369	/nfs/dbraw/zinc/07/43/69/1376074369.db2.gz	HKBNWZLXVVAZCP-RDJZCZTQSA-N	0	3	342.911	3.257	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1C1CCN(C(=O)[C@H](CCC)OC)CC1	ZINC001230584730	1376087433	/nfs/dbraw/zinc/08/74/33/1376087433.db2.gz	TZNANADWBYCLDP-IRXDYDNUSA-N	0	3	342.911	3.257	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)c1cccs1	ZINC001133580668	1376103626	/nfs/dbraw/zinc/10/36/26/1376103626.db2.gz	CNNFECZMQPKQEQ-WDEREUQCSA-N	0	3	331.279	3.143	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)C1CCCCC1	ZINC001133590321	1376108406	/nfs/dbraw/zinc/10/84/06/1376108406.db2.gz	JEFGNGJDILZNAL-CHWSQXEVSA-N	0	3	331.298	3.348	20	30		EGEDHN
C#CCCN(CCCNC(=O)CC1CCCCC1)Cc1cccnc1	ZINC001230663245	1376120828	/nfs/dbraw/zinc/12/08/28/1376120828.db2.gz	YMEGTYXPZTUVCZ-UHFFFAOYSA-N	0	3	341.499	3.384	20	30		EGEDHN
Cc1occc1C(=O)N[C@@H](C)C[C@@H](C)NCc1cc(F)ccc1C#N	ZINC001133627654	1376125960	/nfs/dbraw/zinc/12/59/60/1376125960.db2.gz	IFZWBUZQLJHULD-OLZOCXBDSA-N	0	3	343.402	3.286	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCCN(Cc1cccnc1)[C@H](C)COC	ZINC001230769127	1376145569	/nfs/dbraw/zinc/14/55/69/1376145569.db2.gz	AHMVXVYPNXIXNX-QGZVFWFLSA-N	0	3	347.503	3.027	20	30		EGEDHN
C#CCCN(CCCNC(=O)[C@@H]1C[C@H]1C(C)(C)C)Cc1cccnc1	ZINC001230800488	1376152827	/nfs/dbraw/zinc/15/28/27/1376152827.db2.gz	KVTLWJOSIJLOBR-RTBURBONSA-N	0	3	341.499	3.095	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)CC/C=C\c2ccccc2)cc1	ZINC001133699937	1376163751	/nfs/dbraw/zinc/16/37/51/1376163751.db2.gz	BBFGKADGCKSLJA-YWEYNIOJSA-N	0	3	333.435	3.258	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)[C@H]1C[C@]1(C)CC)Cc1cccnc1	ZINC001230881954	1376176738	/nfs/dbraw/zinc/17/67/38/1376176738.db2.gz	KVFGIRJULXQAIT-QUCCMNQESA-N	0	3	329.488	3.402	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H]2CN(Cc3ccc4c(c3)COC4)C[C@H]21	ZINC001188999349	1388431496	/nfs/dbraw/zinc/43/14/96/1388431496.db2.gz	KJPLPAHEDXXQAL-FXAWDEMLSA-N	0	3	340.467	3.106	20	30		EGEDHN
C=CCOCC(=O)N[C@H](C)C[C@@H](C)NCc1cc(F)ccc1Cl	ZINC001133909042	1376260421	/nfs/dbraw/zinc/26/04/21/1376260421.db2.gz	GJESWFHDUFSDJA-CHWSQXEVSA-N	0	3	342.842	3.055	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H]2CN(CC[C@@H]3CC3(Cl)Cl)C[C@H]21	ZINC001189006258	1388435260	/nfs/dbraw/zinc/43/52/60/1388435260.db2.gz	AMSKGSICGNWYSH-RRFJBIMHSA-N	0	3	345.314	3.459	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)c1cc(C)c(C)o1	ZINC001134110417	1376372691	/nfs/dbraw/zinc/37/26/91/1376372691.db2.gz	VZELJYOBPHQHGI-NEPJUHHUSA-N	0	3	343.265	3.292	20	30		EGEDHN
C#CCCCCC(=O)N[C@H](C)C[C@@H](C)NCc1ccn(C(C)C)n1	ZINC001134118959	1376377126	/nfs/dbraw/zinc/37/71/26/1376377126.db2.gz	JRPKJSJFLTUTPP-IAGOWNOFSA-N	0	3	332.492	3.031	20	30		EGEDHN
Cc1nscc1C(=O)N[C@@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001134127539	1376382819	/nfs/dbraw/zinc/38/28/19/1376382819.db2.gz	PJRFUQGBSIEIDN-OLZOCXBDSA-N	0	3	342.468	3.010	20	30		EGEDHN
N#Cc1cccc(O[C@H]2CCCN(Cc3cc4c[nH]ccc-4n3)C2)c1	ZINC001232015178	1376384376	/nfs/dbraw/zinc/38/43/76/1376384376.db2.gz	CGJCTQDNPNHYJI-IBGZPJMESA-N	0	3	332.407	3.478	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCCN(Cc3cc4c[nH]ccc-4n3)C2)cc1	ZINC001232017953	1376386030	/nfs/dbraw/zinc/38/60/30/1376386030.db2.gz	BUGRUMKFCSCFST-IBGZPJMESA-N	0	3	332.407	3.478	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H](C)C[C@H](C)NCc2ccccc2C#N)co1	ZINC001134179353	1376403372	/nfs/dbraw/zinc/40/33/72/1376403372.db2.gz	UEETUOUZRVYEIU-KBPBESRZSA-N	0	3	325.412	3.146	20	30		EGEDHN
C#CCCCC(=O)N[C@H](C)C[C@H](C)NCc1nc2ccccc2o1	ZINC001134201715	1376415300	/nfs/dbraw/zinc/41/53/00/1376415300.db2.gz	SPFNQFQRSUQKRA-LSDHHAIUSA-N	0	3	327.428	3.004	20	30		EGEDHN
C#CCCCC(=O)N[C@@H](C)C[C@H](C)NCc1ccn(C2CCCC2)n1	ZINC001134200910	1376415634	/nfs/dbraw/zinc/41/56/34/1376415634.db2.gz	JSGZAXBHRFNQNE-IRXDYDNUSA-N	0	3	344.503	3.175	20	30		EGEDHN
C#CCCCC(=O)N[C@H](C)C[C@H](C)NCc1nc2ccc(F)cc2o1	ZINC001134206459	1376418446	/nfs/dbraw/zinc/41/84/46/1376418446.db2.gz	VEMGMUSXXMQIDJ-UONOGXRCSA-N	0	3	345.418	3.143	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)C(C)=C1CCC1	ZINC001134308911	1376467364	/nfs/dbraw/zinc/46/73/64/1376467364.db2.gz	WBCFEVNQXSJLNM-NEPJUHHUSA-N	0	3	329.282	3.268	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)[C@H]2[C@@H]3CCCCCC[C@@H]32)s1	ZINC001134315069	1376470130	/nfs/dbraw/zinc/47/01/30/1376470130.db2.gz	WGBUODPDAJPWSQ-FVQHAEBGSA-N	0	3	331.485	3.042	20	30		EGEDHN
CCCc1nc(C)c(CN[C@H](C)C[C@H](C)NC(=O)C#CC(C)(C)C)o1	ZINC001134328543	1376478246	/nfs/dbraw/zinc/47/82/46/1376478246.db2.gz	DESYKDJWVDOCNU-CABCVRRESA-N	0	3	347.503	3.358	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CCN(Cc3cc(C)cc(O)c3)C2)C1	ZINC001232879147	1376528579	/nfs/dbraw/zinc/52/85/79/1376528579.db2.gz	BSODFJQJPAWPER-HXUWFJFHSA-N	0	3	344.455	3.311	20	30		EGEDHN
COC(=O)[C@@H](c1ccccc1)[C@@H]1CCCCN1Cc1cccc(C#N)n1	ZINC001232926437	1376538557	/nfs/dbraw/zinc/53/85/57/1376538557.db2.gz	PDSLBPSQKVVXRA-PMACEKPBSA-N	0	3	349.434	3.265	20	30		EGEDHN
N#Cc1cccc(CN2CCN([C@H]3CCCc4ccccc43)CC2)n1	ZINC001232926660	1376538745	/nfs/dbraw/zinc/53/87/45/1376538745.db2.gz	ZDWSIEAKWHRJPJ-NRFANRHFSA-N	0	3	332.451	3.148	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H](C)C[C@@H](C)NCc1conc1C	ZINC001134450072	1376544745	/nfs/dbraw/zinc/54/47/45/1376544745.db2.gz	ZMNJULRTCHFBJX-MNOVXSKESA-N	0	3	327.856	3.135	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H](C)C[C@@H](C)NCc1ncc(Cl)n1C	ZINC001134454360	1376546749	/nfs/dbraw/zinc/54/67/49/1376546749.db2.gz	VXOPRCVIXOBHSV-OLZOCXBDSA-N	0	3	340.899	3.049	20	30		EGEDHN
Cc1ccc(CN2CCN3C[C@H](Oc4ccccc4)C[C@@H]3C2)c(C#N)c1	ZINC001232966641	1376550345	/nfs/dbraw/zinc/55/03/45/1376550345.db2.gz	UXHUMWSRKJHEDL-IFMALSPDSA-N	0	3	347.462	3.204	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)C12CCC(CC1)C2	ZINC001134737001	1376687672	/nfs/dbraw/zinc/68/76/72/1376687672.db2.gz	MJKAKXVJFFAPLU-NOZYUVCASA-N	0	3	343.309	3.348	20	30		EGEDHN
CN(CCCNC(=O)c1ccsc1)Cc1ccc(C#N)c(F)c1	ZINC001233733964	1376704622	/nfs/dbraw/zinc/70/46/22/1376704622.db2.gz	WDPJZUAUPSQOAJ-UHFFFAOYSA-N	0	3	331.416	3.011	20	30		EGEDHN
CCCCCCCN1CC[C@H]1CN(C)C(=O)c1cc2n(n1)CCCC2	ZINC001235634059	1376881229	/nfs/dbraw/zinc/88/12/29/1376881229.db2.gz	TZYVECPDGQNGTJ-SFHVURJKSA-N	0	3	346.519	3.336	20	30		EGEDHN
C[C@@H](C(=O)NCCNCc1ccc(C#N)c(F)c1)[C@H](C)C(C)(C)C	ZINC001135177678	1376949928	/nfs/dbraw/zinc/94/99/28/1376949928.db2.gz	KAPRVRBADYHBRF-KGLIPLIRSA-N	0	3	333.451	3.221	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H](C)C[C@@H](C)NCc2nc(C)cs2)cc1	ZINC001135185361	1376958187	/nfs/dbraw/zinc/95/81/87/1376958187.db2.gz	YJFWPWWXQCRZTC-KGLIPLIRSA-N	0	3	341.480	3.120	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H](C)C[C@@H](C)NCc1ncc(C)s1	ZINC001135193343	1376965147	/nfs/dbraw/zinc/96/51/47/1376965147.db2.gz	HSRZDWTTZQKXMS-CABCVRRESA-N	0	3	335.517	3.408	20	30		EGEDHN
CCN1CCC2(CCN(Cc3ccc(C#N)cc3Cl)CC2)C1=O	ZINC001238084834	1376995076	/nfs/dbraw/zinc/99/50/76/1376995076.db2.gz	OPLMNYPXFLQOPN-UHFFFAOYSA-N	0	3	331.847	3.046	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)CCCC1CC1	ZINC001135246419	1376999695	/nfs/dbraw/zinc/99/96/95/1376999695.db2.gz	HMHRQDHUDGFBON-QWHCGFSZSA-N	0	3	331.298	3.348	20	30		EGEDHN
Cc1coc(C(=O)N[C@@H](C)C[C@H](C)NCc2cc(F)ccc2C#N)c1	ZINC001135269822	1377012884	/nfs/dbraw/zinc/01/28/84/1377012884.db2.gz	HSXJSJQYBCBEQP-KBPBESRZSA-N	0	3	343.402	3.286	20	30		EGEDHN
Cc1coc(C(=O)N[C@H](C)C[C@H](C)NCc2cc(F)ccc2C#N)c1	ZINC001135269829	1377013294	/nfs/dbraw/zinc/01/32/94/1377013294.db2.gz	HSXJSJQYBCBEQP-UONOGXRCSA-N	0	3	343.402	3.286	20	30		EGEDHN
Cc1cccc(CC(=O)N[C@@H](C)C[C@H](C)NCc2ccccc2C#N)c1	ZINC001135350325	1377048523	/nfs/dbraw/zinc/04/85/23/1377048523.db2.gz	SLRMBLOWACFHLD-ROUUACIJSA-N	0	3	349.478	3.482	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)CC(C)(F)F)NCc1cc(F)ccc1C#N	ZINC001135402562	1377075889	/nfs/dbraw/zinc/07/58/89/1377075889.db2.gz	OELNFMJXSAYKPT-VXGBXAGGSA-N	0	3	341.377	3.116	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)C1(C)CC=CC1)NCc1ccccc1C#N	ZINC001135412705	1377081017	/nfs/dbraw/zinc/08/10/17/1377081017.db2.gz	UTMHAPMHARPQPO-HZPDHXFCSA-N	0	3	325.456	3.287	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)C(C)(C)C(F)F	ZINC001135427305	1377090808	/nfs/dbraw/zinc/09/08/08/1377090808.db2.gz	PFEMHVPADCOYRX-ZJUUUORDSA-N	0	3	341.240	3.059	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H](C)C[C@@H](C)NCc1cc2n(n1)CCCC2	ZINC001135565110	1377147964	/nfs/dbraw/zinc/14/79/64/1377147964.db2.gz	PKVXJIBYNBPKBE-CVEARBPZSA-N	0	3	346.519	3.195	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)C1(F)CCCCC1	ZINC001135854306	1377235818	/nfs/dbraw/zinc/23/58/18/1377235818.db2.gz	CDOXFECFWSFZSY-OLZOCXBDSA-N	0	3	349.288	3.440	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CC[C@H](N(C)Cc2ccc(F)cc2C)C1	ZINC001189242799	1388493483	/nfs/dbraw/zinc/49/34/83/1388493483.db2.gz	MCFLZMFYYGAWCG-LPHOPBHVSA-N	0	3	348.462	3.148	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CC[C@H](N(C)Cc2ccc(C)c(F)c2)C1	ZINC001189251260	1388496323	/nfs/dbraw/zinc/49/63/23/1388496323.db2.gz	OUAYTDPYDBQKMS-AEFFLSMTSA-N	0	3	348.462	3.148	20	30		EGEDHN
CCCc1noc([C@H]2CCCN(Cc3ccc(OCC#N)cc3)C2)n1	ZINC001137121485	1377482406	/nfs/dbraw/zinc/48/24/06/1377482406.db2.gz	NTTVXJUAJKJKKL-INIZCTEOSA-N	0	3	340.427	3.304	20	30		EGEDHN
CC(=O)N[C@H]1CCN(Cc2ccc(N(C)c3ccc(C#N)cc3)cc2)C1	ZINC001137904243	1377641630	/nfs/dbraw/zinc/64/16/30/1377641630.db2.gz	UGAULKFZLQYZDS-IBGZPJMESA-N	0	3	348.450	3.037	20	30		EGEDHN
C#CCOc1ccc(CN2CC[C@@H](Oc3ccccc3OC)C2)cc1	ZINC001138559472	1377742059	/nfs/dbraw/zinc/74/20/59/1377742059.db2.gz	VJLPEANCMACRLT-LJQANCHMSA-N	0	3	337.419	3.361	20	30		EGEDHN
C=CCc1cccc(C[NH+]2C[C@@H]3CN(Cc4ccccn4)C[C@H]3C2)c1[O-]	ZINC001138626848	1377756251	/nfs/dbraw/zinc/75/62/51/1377756251.db2.gz	QGTDAJOIQNGNPU-WOJBJXKFSA-N	0	3	349.478	3.080	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@@H](Oc3ncccc3OC)C2)c1[O-]	ZINC001138631058	1377757562	/nfs/dbraw/zinc/75/75/62/1377757562.db2.gz	IYXOOCJGZOQBMG-QGZVFWFLSA-N	0	3	340.423	3.178	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@@H](Oc3ncccc3OC)C2)c1[O-]	ZINC001138631058	1377757565	/nfs/dbraw/zinc/75/75/65/1377757565.db2.gz	IYXOOCJGZOQBMG-QGZVFWFLSA-N	0	3	340.423	3.178	20	30		EGEDHN
C=C(C)COc1ccccc1CN1CCC2(CCC(=O)N2C)CC1	ZINC001138666615	1377765129	/nfs/dbraw/zinc/76/51/29/1377765129.db2.gz	ZXBODHJMWLNDLZ-UHFFFAOYSA-N	0	3	328.456	3.228	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(Oc3ccc(C#N)cc3)nc2)C[C@H](C)N1C	ZINC001139427751	1377883009	/nfs/dbraw/zinc/88/30/09/1377883009.db2.gz	QJUICZYJBHHCOS-IYBDPMFKSA-N	0	3	336.439	3.270	20	30		EGEDHN
CC(C)N(CCNC(=O)OC(C)(C)C)Cc1ccc(C#N)c(F)c1	ZINC001139528997	1377898507	/nfs/dbraw/zinc/89/85/07/1377898507.db2.gz	BPTBEHMGTOFKPD-UHFFFAOYSA-N	0	3	335.423	3.432	20	30		EGEDHN
N#Cc1cccc2c(CN3CCC[C@@H](Oc4ccncc4)C3)c[nH]c21	ZINC001139706932	1377938154	/nfs/dbraw/zinc/93/81/54/1377938154.db2.gz	CUICESQCHAVMHB-GOSISDBHSA-N	0	3	332.407	3.478	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CN(Cc3c(C)cc(O)cc3C)C2)CC1	ZINC001139711193	1377939057	/nfs/dbraw/zinc/93/90/57/1377939057.db2.gz	CNVHNVBJPBKEQA-UHFFFAOYSA-N	0	3	344.455	3.229	20	30		EGEDHN
Cc1ccc(CN2C[C@@H]3C[C@H]2C[C@@H]3NC(=O)OC(C)(C)C)cc1C#N	ZINC001139724732	1377941651	/nfs/dbraw/zinc/94/16/51/1377941651.db2.gz	OAMKOABUCFYSJJ-BZSNNMDCSA-N	0	3	341.455	3.354	20	30		EGEDHN
COCC[C@H]1CO[C@]2(C1)CCCN(Cc1ccc(C)c(C#N)c1)C2	ZINC001139725367	1377942030	/nfs/dbraw/zinc/94/20/30/1377942030.db2.gz	MNNGMNFYQSODQX-QUCCMNQESA-N	0	3	328.456	3.274	20	30		EGEDHN
N#Cc1ccc2[nH]cc(CN3CCC4(CC(F)(F)CO4)CC3)c2c1	ZINC001140110563	1378009489	/nfs/dbraw/zinc/00/94/89/1378009489.db2.gz	NGQSBQACWHODKA-UHFFFAOYSA-N	0	3	331.366	3.430	20	30		EGEDHN
N#Cc1ccc2[nH]cc(CN3CCC(Oc4ccncc4)CC3)c2c1	ZINC001140109914	1378009688	/nfs/dbraw/zinc/00/96/88/1378009688.db2.gz	AANZEAHYNSCEPP-UHFFFAOYSA-N	0	3	332.407	3.478	20	30		EGEDHN
N#Cc1ccc2[nH]cc(CN3CCC[C@](O)(C(F)(F)F)CC3)c2c1	ZINC001140110676	1378009901	/nfs/dbraw/zinc/00/99/01/1378009901.db2.gz	PRXRWODIDRLGDI-MRXNPFEDSA-N	0	3	337.345	3.319	20	30		EGEDHN
C=CCO[C@H]1CO[C@]2(C1)CCCN(Cc1ccc(C)c(OC)c1)C2	ZINC001140157983	1378022901	/nfs/dbraw/zinc/02/29/01/1378022901.db2.gz	ANUSHJVBGVCASG-QUCCMNQESA-N	0	3	331.456	3.330	20	30		EGEDHN
CC[C@H](C)N1CCC2(CCN(Cc3ccc(C#N)cc3F)CC2)C1=O	ZINC001273303659	1378095819	/nfs/dbraw/zinc/09/58/19/1378095819.db2.gz	NLASQTXOOMHGAD-HNNXBMFYSA-N	0	3	343.446	3.310	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2cscn2)CCCC[C@H]1C	ZINC001753531691	1440431206	/nfs/dbraw/zinc/43/12/06/1440431206.db2.gz	LMTXYSPBLJWWIA-IAQYHMDHSA-N	0	3	327.881	3.164	20	30		EGEDHN
C=C(C)CN1CCC2(CCN(Cc3ccc(C)nc3C)CC2)C1=O	ZINC001274477122	1378126904	/nfs/dbraw/zinc/12/69/04/1378126904.db2.gz	AAJHDLBXKMTWPN-UHFFFAOYSA-N	0	3	327.472	3.089	20	30		EGEDHN
C=CCN1C(=O)CCC[C@]12CCCN(Cc1cnc(CCCC)[nH]1)C2	ZINC001141069062	1378229932	/nfs/dbraw/zinc/22/99/32/1378229932.db2.gz	UKUFODLEYFGFOL-HXUWFJFHSA-N	0	3	344.503	3.285	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCCN(Cc3ccc4nccn4c3)C2)cc1	ZINC001143036002	1378531797	/nfs/dbraw/zinc/53/17/97/1378531797.db2.gz	WKSRYPZVSFFBTM-IBGZPJMESA-N	0	3	332.407	3.249	20	30		EGEDHN
COC(=O)c1ccc2[nH]cc(CN(C)Cc3ccc(C#N)cc3)c2c1	ZINC001143236942	1378566739	/nfs/dbraw/zinc/56/67/39/1378566739.db2.gz	ADXUCRUZRPWCOJ-UHFFFAOYSA-N	0	3	333.391	3.458	20	30		EGEDHN
N#Cc1ccc(CN2C[C@H]3CCC[C@@]3(COCc3cccnc3)C2)nc1	ZINC001144157416	1378689876	/nfs/dbraw/zinc/68/98/76/1378689876.db2.gz	HCMOZPFODCVNEZ-CTNGQTDRSA-N	0	3	348.450	3.167	20	30		EGEDHN
C#Cc1ccc(CN2CC[C@@H]3CCN(C(=O)OC(C)(C)C)[C@@H]3C2)cc1	ZINC001144568106	1378745983	/nfs/dbraw/zinc/74/59/83/1378745983.db2.gz	LILOUMHNEHCNQT-RTBURBONSA-N	0	3	340.467	3.499	20	30		EGEDHN
C#Cc1ccc(CN2CCC(Oc3ccc(Cl)nn3)CC2)cc1	ZINC001144578724	1378747348	/nfs/dbraw/zinc/74/73/48/1378747348.db2.gz	KVLXOLFUVHJKKL-UHFFFAOYSA-N	0	3	327.815	3.155	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)CCCc1c[nH]c2ccccc12	ZINC001144980875	1378786362	/nfs/dbraw/zinc/78/63/62/1378786362.db2.gz	HQBFDYXOHDDYCR-KRWDZBQOSA-N	0	3	325.456	3.257	20	30		EGEDHN
C=C(Cl)CNCC[C@@H](C)NC(=O)[C@@H](C)Cc1cccc(F)c1	ZINC001754026873	1440533253	/nfs/dbraw/zinc/53/32/53/1440533253.db2.gz	NYXSEACAYYAQGB-GXTWGEPZSA-N	0	3	326.843	3.241	20	30		EGEDHN
C=CCCC(=O)N1CC2(C1)CCN(Cc1cc(C)ccc1OC)C2	ZINC001147187656	1378984060	/nfs/dbraw/zinc/98/40/60/1378984060.db2.gz	LZLJRUVONSANRA-UHFFFAOYSA-N	0	3	328.456	3.004	20	30		EGEDHN
C#CCCCC(=O)N1CC2(C1)CCN([C@H](C)c1ccc(F)cc1)C2	ZINC001147461974	1379025608	/nfs/dbraw/zinc/02/56/08/1379025608.db2.gz	JYNUYZWRNKGUSB-MRXNPFEDSA-N	0	3	328.431	3.225	20	30		EGEDHN
CC[C@H](CC(=O)NCCNCc1ccc(C#N)s1)c1ccccc1	ZINC001147476445	1379030477	/nfs/dbraw/zinc/03/04/77/1379030477.db2.gz	YOCMNOTYGHARCG-OAHLLOKOSA-N	0	3	341.480	3.409	20	30		EGEDHN
C#CCCCCCC(=O)N1CC2(C1)CCN(Cc1cccnc1C)C2	ZINC001148059722	1379110947	/nfs/dbraw/zinc/11/09/47/1379110947.db2.gz	JTEBISRPINVLPI-UHFFFAOYSA-N	0	3	339.483	3.008	20	30		EGEDHN
CC#CCCCC(=O)N1CC2(C1)CCN(Cc1cc(F)ccc1C)C2	ZINC001148104589	1379119294	/nfs/dbraw/zinc/11/92/94/1379119294.db2.gz	QVOROUCAKFVFPV-UHFFFAOYSA-N	0	3	342.458	3.362	20	30		EGEDHN
C=CCC1(C(=O)N2CC3(C2)CCN(CCC(F)(F)F)C3)CCC1	ZINC001148250271	1379139216	/nfs/dbraw/zinc/13/92/16/1379139216.db2.gz	VHLBSXBSTXFBBD-UHFFFAOYSA-N	0	3	330.394	3.220	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)C[C@@H](C)CCc3ccccc3)C2)C1	ZINC001148874180	1379289194	/nfs/dbraw/zinc/28/91/94/1379289194.db2.gz	LOAMYAGVGLRUQX-SFHVURJKSA-N	0	3	326.484	3.366	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N1CC2(C1)CCN([C@H](C)c1cccc(F)c1)C2	ZINC001148899935	1379293737	/nfs/dbraw/zinc/29/37/37/1379293737.db2.gz	LRBOEYOOIKVTHU-HZPDHXFCSA-N	0	3	346.446	3.012	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H]1CN([C@H](C)c2ccccc2)CCCO1	ZINC001150211808	1379516018	/nfs/dbraw/zinc/51/60/18/1379516018.db2.gz	LEWBIXZSCWQSKB-IEBWSBKVSA-N	0	3	330.472	3.311	20	30		EGEDHN
C#CCCN1CCCO[C@H](CNC(=O)[C@@H](CC)CC2CCCCC2)C1	ZINC001150404222	1379549227	/nfs/dbraw/zinc/54/92/27/1379549227.db2.gz	WDIUKMOCSIAIIZ-VQTJNVASSA-N	0	3	348.531	3.213	20	30		EGEDHN
C#CCCN1CCCO[C@H](CNC(=O)[C@H](CC)CC2CCCCC2)C1	ZINC001150404223	1379549571	/nfs/dbraw/zinc/54/95/71/1379549571.db2.gz	WDIUKMOCSIAIIZ-WOJBJXKFSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)C[C@H](C)C2CCCCC2)C1	ZINC001150436302	1379552079	/nfs/dbraw/zinc/55/20/79/1379552079.db2.gz	QTBKVKSDIRQKMV-HKUYNNGSSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C[C@H](C(=O)NC[C@H]1CN(CC=C(C)C)CCCO1)c1ccccc1	ZINC001150751521	1379606515	/nfs/dbraw/zinc/60/65/15/1379606515.db2.gz	GQINSQXXPNEVTK-PMACEKPBSA-N	0	3	342.483	3.130	20	30		EGEDHN
C=CCC1(C(=O)NC[C@H]2CN(CC=C(C)C)CCCO2)CCCC1	ZINC001150883953	1379626116	/nfs/dbraw/zinc/62/61/16/1379626116.db2.gz	KSGNDVIGVSGIQB-SFHVURJKSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)C[C@H]2CC[C@@H](C)C2)CC1	ZINC001151248159	1379686892	/nfs/dbraw/zinc/68/68/92/1379686892.db2.gz	JFVPFGMCKAXCPX-MSOLQXFVSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@H]2[C@@H]3CCCCCC[C@@H]32)CC1	ZINC001151339830	1379701207	/nfs/dbraw/zinc/70/12/07/1379701207.db2.gz	MHLYJZDIIGJZMP-BWTSREIZSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)C[C@@H](C)n2cccc2)CC1	ZINC001151399290	1379711073	/nfs/dbraw/zinc/71/10/73/1379711073.db2.gz	YPHBWEFGPVSGIG-GOSISDBHSA-N	0	3	347.503	3.003	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)C[C@H](C)c2ccccc2)CC1	ZINC001151406301	1379712276	/nfs/dbraw/zinc/71/22/76/1379712276.db2.gz	AONBPUVQEXSZLX-SFHVURJKSA-N	0	3	344.499	3.354	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)Cc1cccs1	ZINC001151560265	1379738431	/nfs/dbraw/zinc/73/84/31/1379738431.db2.gz	LPEDRKWJKHFZQI-OAHLLOKOSA-N	0	3	341.480	3.189	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)Cc1ccsc1	ZINC001151698228	1379765446	/nfs/dbraw/zinc/76/54/46/1379765446.db2.gz	BNRKQSSRPDEPHN-OAHLLOKOSA-N	0	3	341.480	3.189	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)c1cc(Cl)c[nH]1	ZINC001151841528	1379796441	/nfs/dbraw/zinc/79/64/41/1379796441.db2.gz	LZPXRBYUDCQTFU-CYBMUJFWSA-N	0	3	344.846	3.180	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)c1ccc(Cl)o1	ZINC001151880521	1379809300	/nfs/dbraw/zinc/80/93/00/1379809300.db2.gz	XCGFKVUJGFNENG-CYBMUJFWSA-N	0	3	345.830	3.445	20	30		EGEDHN
C=C[C@@H](CC(=O)NCCNCc1ccnc(Cl)c1)c1ccccc1	ZINC001151943367	1379822758	/nfs/dbraw/zinc/82/27/58/1379822758.db2.gz	XXFSCUFFVOEFTQ-INIZCTEOSA-N	0	3	343.858	3.301	20	30		EGEDHN
C=CCC1(C(=O)NCCNCc2ccc(F)c(C#N)c2)CCCCC1	ZINC001152010883	1379837473	/nfs/dbraw/zinc/83/74/73/1379837473.db2.gz	SRKXEGBIMBQDIR-UHFFFAOYSA-N	0	3	343.446	3.430	20	30		EGEDHN
C=CCOCCCC(=O)NC[C@@H](C)N(CC)Cc1cccc(F)c1	ZINC001152561183	1379948604	/nfs/dbraw/zinc/94/86/04/1379948604.db2.gz	DUYRVGBDUDBUTJ-MRXNPFEDSA-N	0	3	336.451	3.135	20	30		EGEDHN
CCCC[C@@H](C(=O)NCCNCc1ccc(OC)c(C#N)c1)C(C)C	ZINC001152653205	1379963185	/nfs/dbraw/zinc/96/31/85/1379963185.db2.gz	SUHBJJXSAZUTRH-GOSISDBHSA-N	0	3	345.487	3.235	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)c1oc(C)cc1C	ZINC001152701946	1379972802	/nfs/dbraw/zinc/97/28/02/1379972802.db2.gz	MXRCLLUKPGPNLC-OAHLLOKOSA-N	0	3	339.439	3.409	20	30		EGEDHN
CC(C)c1ccc(C(=O)NCCNCc2cccc(C#N)c2)s1	ZINC001152777223	1379980567	/nfs/dbraw/zinc/98/05/67/1379980567.db2.gz	HUPWYEGPCPUVHS-UHFFFAOYSA-N	0	3	327.453	3.263	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)C[C@H](C)SC	ZINC001152820463	1379983415	/nfs/dbraw/zinc/98/34/15/1379983415.db2.gz	FHUQRFHZWDFMCJ-CABCVRRESA-N	0	3	333.501	3.026	20	30		EGEDHN
CC1(C)CCC[C@@H](C(=O)NCCNCc2ccc(C#N)c(F)c2)C1	ZINC001152832268	1379985412	/nfs/dbraw/zinc/98/54/12/1379985412.db2.gz	YEMUZOBZADCHNH-OAHLLOKOSA-N	0	3	331.435	3.120	20	30		EGEDHN
CC[C@H](C)CC(=O)NC[C@@H](C)N(CC)Cc1ccc(F)c(C#N)c1	ZINC001153006932	1380006712	/nfs/dbraw/zinc/00/67/12/1380006712.db2.gz	LTYQALUPOXYHAF-LSDHHAIUSA-N	0	3	333.451	3.460	20	30		EGEDHN
CC/C(C)=C\C(=O)NC[C@@H](C)N(CC)Cc1ccc(F)c(C#N)c1	ZINC001153181761	1380031809	/nfs/dbraw/zinc/03/18/09/1380031809.db2.gz	VVHGQBNYYYDCHP-KQGZCTBQSA-N	0	3	331.435	3.380	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H](C)N(CC)C[C@@H](O)c1ccccc1F	ZINC001153635709	1380108498	/nfs/dbraw/zinc/10/84/98/1380108498.db2.gz	AIMOYWYMTCNSBK-CRAIPNDOSA-N	0	3	336.451	3.042	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C1(c2cccc(Cl)c2)CC1	ZINC001153727603	1380119573	/nfs/dbraw/zinc/11/95/73/1380119573.db2.gz	DPLHOJIYLFMNCR-OAHLLOKOSA-N	0	3	332.875	3.222	20	30		EGEDHN
C=C(Br)CNC1CC(N(C)C(=O)C2(CCC)CCC2)C1	ZINC001284787672	1380210175	/nfs/dbraw/zinc/21/01/75/1380210175.db2.gz	LWBUSQRGPGMKFT-UHFFFAOYSA-N	0	3	343.309	3.444	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)C1(C(F)F)CCC1	ZINC001154812914	1380357242	/nfs/dbraw/zinc/35/72/42/1380357242.db2.gz	CQWXFYALVOXERL-CQSZACIVSA-N	0	3	349.425	3.320	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1	ZINC001154825994	1380359338	/nfs/dbraw/zinc/35/93/38/1380359338.db2.gz	JRZOSAAGHUEDDG-MGPQQGTHSA-N	0	3	338.904	3.355	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@H](C)N(CC)C[C@@H](O)c2ccccc2F)C1	ZINC001155126199	1380413543	/nfs/dbraw/zinc/41/35/43/1380413543.db2.gz	GZBVBTWISNFGQB-CRAIPNDOSA-N	0	3	348.462	3.042	20	30		EGEDHN
CCN(CC#CCOC)[C@H](C)CNC(=O)CC(C1CCC1)C1CCC1	ZINC001155273615	1380431592	/nfs/dbraw/zinc/43/15/92/1380431592.db2.gz	YMAZMECRDDCVEW-QGZVFWFLSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)NC[C@@H](C)N(CC)Cc1ccc(F)cc1C	ZINC001155325924	1380437560	/nfs/dbraw/zinc/43/75/60/1380437560.db2.gz	LQFJWEMFEVPBTK-LZQZEXGQSA-N	0	3	348.462	3.052	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@@]1(c2ccccc2)CC1(C)C	ZINC001155980481	1380510086	/nfs/dbraw/zinc/51/00/86/1380510086.db2.gz	ZEPUUQVLNCEZRV-UTKZUKDTSA-N	0	3	326.484	3.204	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1cc(Cl)ccc1Cl	ZINC001156602324	1380599112	/nfs/dbraw/zinc/59/91/12/1380599112.db2.gz	YCAPFDBGCQQQSU-GFCCVEGCSA-N	0	3	327.255	3.457	20	30		EGEDHN
CCN(CC#CCOC)[C@H](C)CNC(=O)CCCC1CCCCC1	ZINC001156740386	1380621877	/nfs/dbraw/zinc/62/18/77/1380621877.db2.gz	KQZMRXZQGACTBN-GOSISDBHSA-N	0	3	336.520	3.213	20	30		EGEDHN
CCC[C@@H](C(=O)NC[C@@H](C)N(CC)CC#CCOC)c1ccccc1	ZINC001156746505	1380625961	/nfs/dbraw/zinc/62/59/61/1380625961.db2.gz	QUMAHOCHTLQFKO-UYAOXDASSA-N	0	3	344.499	3.047	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)c1cccn1CC	ZINC001156918871	1380726867	/nfs/dbraw/zinc/72/68/67/1380726867.db2.gz	XXIBNAVJFUABNG-MRXNPFEDSA-N	0	3	338.455	3.020	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1cc2ccccc2n1CC	ZINC001157075288	1380769927	/nfs/dbraw/zinc/76/99/27/1380769927.db2.gz	WINAMPHFIYSHRG-MRXNPFEDSA-N	0	3	325.456	3.125	20	30		EGEDHN
C#CCCCC(=O)NCCCNCc1cc(-c2ccc(C)cc2)no1	ZINC001157182878	1380799267	/nfs/dbraw/zinc/79/92/67/1380799267.db2.gz	HZAFKKKBJLFSJB-UHFFFAOYSA-N	0	3	339.439	3.049	20	30		EGEDHN
C=C(C)C(=O)OCCNc1nc(N2CCCC2)cc2ccccc21	ZINC001157308330	1380838745	/nfs/dbraw/zinc/83/87/45/1380838745.db2.gz	MQVBBNWONBQXRX-UHFFFAOYSA-N	0	3	325.412	3.366	20	30		EGEDHN
C#CCCCCC(=O)N1CCCC[C@@H]1CN(C)C[C@H]1CCCCO1	ZINC001157856857	1381052833	/nfs/dbraw/zinc/05/28/33/1381052833.db2.gz	PNNWRXVZFZTAHR-RTBURBONSA-N	0	3	334.504	3.062	20	30		EGEDHN
CCCCCCO[C@H](C)C(=O)NCCCNCc1ccccc1C#N	ZINC001157924062	1381072273	/nfs/dbraw/zinc/07/22/73/1381072273.db2.gz	DPYMCPAPZUCZEK-QGZVFWFLSA-N	0	3	345.487	3.140	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCCC[C@@H]1CN(C)CCOC(C)C	ZINC001157994155	1381095484	/nfs/dbraw/zinc/09/54/84/1381095484.db2.gz	IWJPIJYUGANSFC-LJQANCHMSA-N	0	3	336.520	3.493	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc(-c2cc[nH]n2)s1	ZINC001158101530	1381127934	/nfs/dbraw/zinc/12/79/34/1381127934.db2.gz	HPNGAKFWPZPZEN-CQSZACIVSA-N	0	3	344.484	3.251	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)COC/C=C/c1ccccc1	ZINC001158124186	1381135152	/nfs/dbraw/zinc/13/51/52/1381135152.db2.gz	LKDMQZWSFZRVLS-RGFVMQALSA-N	0	3	342.483	3.215	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)C[C@@H](C)c1c(C)noc1C	ZINC001158149119	1381143017	/nfs/dbraw/zinc/14/30/17/1381143017.db2.gz	VIAYATRUZOWEFQ-RHSMWYFYSA-N	0	3	333.476	3.284	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1C[C@@H]2CCCC[C@H]12	ZINC001158270686	1381180045	/nfs/dbraw/zinc/18/00/45/1381180045.db2.gz	LWGMCHOFASTKGA-ZGXWSNOMSA-N	0	3	348.531	3.328	20	30		EGEDHN
C=CCCCC(=O)N1CCCC[C@@H]1CN(C)CCn1nc(C)cc1C	ZINC001158419717	1381239806	/nfs/dbraw/zinc/23/98/06/1381239806.db2.gz	YEIITLSZQSRBDW-LJQANCHMSA-N	0	3	346.519	3.169	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1noc2c1CCCCC2	ZINC001158533906	1381285611	/nfs/dbraw/zinc/28/56/11/1381285611.db2.gz	LFIIUPKBSOXJCF-OAHLLOKOSA-N	0	3	331.460	3.056	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1OC	ZINC001158565685	1381302421	/nfs/dbraw/zinc/30/24/21/1381302421.db2.gz	YMZFADCBEFKKGH-NZSAHSFTSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=CC1(CC(=O)N2CCCC[C@@H]2CN(C)CCOC)CCCCC1	ZINC001158588040	1381308460	/nfs/dbraw/zinc/30/84/60/1381308460.db2.gz	MPCVEJDBJVNJPO-GOSISDBHSA-N	0	3	336.520	3.472	20	30		EGEDHN
C[C@H]1CCC[C@H]1CC(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001158620020	1381324908	/nfs/dbraw/zinc/32/49/08/1381324908.db2.gz	ZGPVYPKGENWIOR-HOCLYGCPSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H](C)Cc1ccc(OC)cc1	ZINC001158914679	1381462519	/nfs/dbraw/zinc/46/25/19/1381462519.db2.gz	RRLCINAMVSUZKM-IEBWSBKVSA-N	0	3	344.499	3.373	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc(-n3cccc3)cc2)CC1	ZINC001160628994	1382156369	/nfs/dbraw/zinc/15/63/69/1382156369.db2.gz	WZADKAJCWDWDLE-UHFFFAOYSA-N	0	3	347.462	3.253	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)Cc2ccc(C(F)F)cc2)CC1	ZINC001160665800	1382164826	/nfs/dbraw/zinc/16/48/26/1382164826.db2.gz	HTYSAEAWCHLJGA-UHFFFAOYSA-N	0	3	346.421	3.328	20	30		EGEDHN
CC(C)[C@H](F)C(=O)NCCC1=CCN(Cc2ccc(C#N)cc2)CC1	ZINC001160946694	1382247881	/nfs/dbraw/zinc/24/78/81/1382247881.db2.gz	MSVXMIMAXOWCCI-IBGZPJMESA-N	0	3	343.446	3.191	20	30		EGEDHN
C=CCN1CCC[C@H]1CNc1cc(C(=O)Nc2ccccc2)ccn1	ZINC001160953467	1382250433	/nfs/dbraw/zinc/25/04/33/1382250433.db2.gz	BOUXNYYZLGXWFH-SFHVURJKSA-N	0	3	336.439	3.396	20	30		EGEDHN
C=CCN1CCC[C@H]1CNc1ccc(C(=O)N2CCC[C@H](C)C2)cn1	ZINC001160957811	1382251098	/nfs/dbraw/zinc/25/10/98/1382251098.db2.gz	VEECWJIDBLREQF-WMZOPIPTSA-N	0	3	342.487	3.016	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCCC1=CCN(CCOCC(C)C)CC1	ZINC001160967055	1382254003	/nfs/dbraw/zinc/25/40/03/1382254003.db2.gz	AKNPIKAFMAYLBJ-GOSISDBHSA-N	0	3	336.520	3.400	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C2(c3cccnc3)CCCC2)CC1	ZINC001161029659	1382278005	/nfs/dbraw/zinc/27/80/05/1382278005.db2.gz	QJYPGMMDSUBJCT-UHFFFAOYSA-N	0	3	339.483	3.218	20	30		EGEDHN
C=CCCC1(C(=O)NCCC2=CCN(CCOCC3CC3)CC2)CC1	ZINC001161116497	1382303922	/nfs/dbraw/zinc/30/39/22/1382303922.db2.gz	KDLJJKWETGNMNS-UHFFFAOYSA-N	0	3	346.515	3.298	20	30		EGEDHN
N#Cc1cc2c(nc1NCC1CCN(Cc3ccccn3)CC1)CCC2	ZINC001161246216	1382353402	/nfs/dbraw/zinc/35/34/02/1382353402.db2.gz	KWCWWSKRIHMGFB-UHFFFAOYSA-N	0	3	347.466	3.161	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C2[C@H]3CCCCCC[C@H]23)CC1	ZINC001161314406	1382368888	/nfs/dbraw/zinc/36/88/88/1382368888.db2.gz	YCPKQLPCJRCNMP-OALUTQOASA-N	0	3	328.500	3.365	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc(C)n(CC3CC3)c2C)CC1	ZINC001161709173	1382486600	/nfs/dbraw/zinc/48/66/00/1382486600.db2.gz	RCUGTDONGWAFGO-UHFFFAOYSA-N	0	3	341.499	3.453	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@H]2Cc3ccc(Cl)cc32)CC1	ZINC001161805996	1382512444	/nfs/dbraw/zinc/51/24/44/1382512444.db2.gz	WWPKFQUCZULYFM-IBGZPJMESA-N	0	3	342.870	3.141	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CCCOc2ccccc2)CC1	ZINC001161818539	1382519817	/nfs/dbraw/zinc/51/98/17/1382519817.db2.gz	YXZZSABUGVELAG-UHFFFAOYSA-N	0	3	328.456	3.170	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2c[nH]cc2-c2ccccc2)CC1	ZINC001161869609	1382535104	/nfs/dbraw/zinc/53/51/04/1382535104.db2.gz	GWVDNPFQLJRKMV-UHFFFAOYSA-N	0	3	347.462	3.457	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@H](C)Cc2ccccc2C)CC1	ZINC001161968199	1382576106	/nfs/dbraw/zinc/57/61/06/1382576106.db2.gz	KSQFDRFGFYSHRY-LJQANCHMSA-N	0	3	338.495	3.335	20	30		EGEDHN
C[C@H](C#N)C(=O)N(CCNCc1ccsc1)CCc1ccccc1	ZINC001162741007	1382854257	/nfs/dbraw/zinc/85/42/57/1382854257.db2.gz	DRDZJKNJABMQNJ-MRXNPFEDSA-N	0	3	341.480	3.069	20	30		EGEDHN
CC(C)(CC(=O)NCCCNCc1ccccc1C#N)CC(F)F	ZINC001162799268	1382875735	/nfs/dbraw/zinc/87/57/35/1382875735.db2.gz	YEARUIXMCAXRCF-UHFFFAOYSA-N	0	3	337.414	3.226	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C(CCC)CCC	ZINC001162906270	1382911625	/nfs/dbraw/zinc/91/16/25/1382911625.db2.gz	HPRZGNGYDQXMSA-UHFFFAOYSA-N	0	3	328.500	3.497	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CCC[C@H](C)C1	ZINC001162907150	1382911664	/nfs/dbraw/zinc/91/16/64/1382911664.db2.gz	YWWISXGFVUXRRI-FPOVZHCZSA-N	0	3	340.511	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H]1C[C@H]1C1CCCC1	ZINC001162970778	1382932190	/nfs/dbraw/zinc/93/21/90/1382932190.db2.gz	KVZQMCJCKHQFNY-SFTDATJTSA-N	0	3	338.495	3.107	20	30		EGEDHN
Cc1ccc2cc(C(=O)NCCCNCc3ccccc3C#N)[nH]c2c1	ZINC001163485287	1383062305	/nfs/dbraw/zinc/06/23/05/1383062305.db2.gz	LKHKTIFCAPWABX-UHFFFAOYSA-N	0	3	346.434	3.258	20	30		EGEDHN
N#Cc1ccc(CNCC2(CCNC(=O)CC3CCC3)CC2)c(F)c1	ZINC001163959510	1383139720	/nfs/dbraw/zinc/13/97/20/1383139720.db2.gz	OZEQACYWSIUGLI-UHFFFAOYSA-N	0	3	343.446	3.264	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)C[C@H]2CC=CCC2)c1	ZINC001164002043	1383145086	/nfs/dbraw/zinc/14/50/86/1383145086.db2.gz	YELPJANYFKWZOT-HNNXBMFYSA-N	0	3	329.419	3.040	20	30		EGEDHN
CC1CC(C(=O)NCCC2(CNCc3ccc(C#N)cc3F)CC2)C1	ZINC001164026551	1383148124	/nfs/dbraw/zinc/14/81/24/1383148124.db2.gz	ISRUUCKDRJUQIK-UHFFFAOYSA-N	0	3	343.446	3.120	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCCNCc1nsc2ccccc12	ZINC001164222281	1383167579	/nfs/dbraw/zinc/16/75/79/1383167579.db2.gz	JXTJNDARUJHHDW-ZIAGYGMSSA-N	0	3	331.485	3.350	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCCNCc1cc(OC)ccc1Cl	ZINC001164223467	1383168023	/nfs/dbraw/zinc/16/80/23/1383168023.db2.gz	SSCVJSNYKOHJAR-KGLIPLIRSA-N	0	3	338.879	3.403	20	30		EGEDHN
CC[C@@H](C)CC(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001164284916	1383174414	/nfs/dbraw/zinc/17/44/14/1383174414.db2.gz	IYYVXRRHKMBAET-MRXNPFEDSA-N	0	3	327.472	3.371	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)C[C@H](C)CC)CC1	ZINC001164285119	1383174506	/nfs/dbraw/zinc/17/45/06/1383174506.db2.gz	QCRQTISXQZKYCY-GFCCVEGCSA-N	0	3	331.298	3.207	20	30		EGEDHN
CC(C)C#CC(=O)NCCC1(CNCc2ccc(F)cc2F)CC1	ZINC001164461420	1383189192	/nfs/dbraw/zinc/18/91/92/1383189192.db2.gz	WHRZYLODFBKOFQ-UHFFFAOYSA-N	0	3	334.410	3.000	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCC1(CNCc2cc(OC)ccn2)CC1	ZINC001165215204	1383250300	/nfs/dbraw/zinc/25/03/00/1383250300.db2.gz	LPWWSWXXCLACGA-UHFFFAOYSA-N	0	3	345.487	3.069	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@H]2CCC[C@@H]2C(F)F)CC1	ZINC001165465085	1383298780	/nfs/dbraw/zinc/29/87/80/1383298780.db2.gz	SKPDWQMTAKHQEP-STQMWFEESA-N	0	3	334.838	3.296	20	30		EGEDHN
C[C@H](CC(F)F)C(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001166226578	1383404987	/nfs/dbraw/zinc/40/49/87/1383404987.db2.gz	RPSGOXOFTSIDPO-CQSZACIVSA-N	0	3	349.425	3.226	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCC1(CNCc2c(C)onc2CC)CC1	ZINC001166696179	1383462655	/nfs/dbraw/zinc/46/26/55/1383462655.db2.gz	XORZVIWTOXIBSB-LSDHHAIUSA-N	0	3	347.503	3.380	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCCC1(CNCc2cc(OC)ccn2)CC1	ZINC001166746978	1383470552	/nfs/dbraw/zinc/47/05/52/1383470552.db2.gz	JCSXLJYZEAOWQF-MRXNPFEDSA-N	0	3	345.487	3.069	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCCC1(CN[C@H](C)c2cnccn2)CC1	ZINC001166765540	1383474441	/nfs/dbraw/zinc/47/44/41/1383474441.db2.gz	PXLVYDLMVRULRV-CVEARBPZSA-N	0	3	330.476	3.016	20	30		EGEDHN
Cc1nc(N(C)C)cc(N2CCC(Cc3ccc(C#N)cc3)CC2)n1	ZINC001166766923	1383474930	/nfs/dbraw/zinc/47/49/30/1383474930.db2.gz	OXHSWQVUINCAGN-UHFFFAOYSA-N	0	3	335.455	3.182	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@H]2Cc3ccc(F)cc32)CC1	ZINC001166835964	1383484880	/nfs/dbraw/zinc/48/48/80/1383484880.db2.gz	CISXGZXZUVDLII-INIZCTEOSA-N	0	3	336.838	3.094	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cccc(F)c2F)CC1	ZINC001166890664	1383495131	/nfs/dbraw/zinc/49/51/31/1383495131.db2.gz	PACOSMSWTKYLID-UHFFFAOYSA-N	0	3	328.790	3.207	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc(F)c(F)c2F)CC1	ZINC001166897259	1383496473	/nfs/dbraw/zinc/49/64/73/1383496473.db2.gz	RBWBYJBFFQDNLO-UHFFFAOYSA-N	0	3	346.780	3.346	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc3[nH]ccc3c2)CC1	ZINC001166940870	1383502432	/nfs/dbraw/zinc/50/24/32/1383502432.db2.gz	VYFLXZVWWPEKIC-UHFFFAOYSA-N	0	3	331.847	3.410	20	30		EGEDHN
C=CCC1(C(=O)NCCC2(CNCc3cnc(C)o3)CC2)CCC1	ZINC001167035692	1383525274	/nfs/dbraw/zinc/52/52/74/1383525274.db2.gz	MDMNOCQHTOJBKG-UHFFFAOYSA-N	0	3	331.460	3.106	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1ccc(Cl)c(F)c1	ZINC001167272563	1383581418	/nfs/dbraw/zinc/58/14/18/1383581418.db2.gz	ZCXWWOPVAQRUHG-UHFFFAOYSA-N	0	3	349.631	3.097	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)[C@H](C)[C@@H](C)CC)CC1	ZINC001167557057	1383667727	/nfs/dbraw/zinc/66/77/27/1383667727.db2.gz	PGJLTWDPIGBHPL-GXTWGEPZSA-N	0	3	345.325	3.453	20	30		EGEDHN
CC(C)C1CCC(N2CCN(Cc3cc(C#N)ccn3)CC2)CC1	ZINC001167594956	1383683716	/nfs/dbraw/zinc/68/37/16/1383683716.db2.gz	YANGTOJVDJLDTO-UHFFFAOYSA-N	0	3	326.488	3.286	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C[C@@H]2CCO[C@H](CC)C2)CC1	ZINC001167657984	1383701170	/nfs/dbraw/zinc/70/11/70/1383701170.db2.gz	KFFJWTSUXOUDHD-HZPDHXFCSA-N	0	3	342.911	3.210	20	30		EGEDHN
C[C@]1(C(=O)NCCCNCc2ccccc2C#N)C[C@@H]1c1ccccc1	ZINC001168022849	1383798439	/nfs/dbraw/zinc/79/84/39/1383798439.db2.gz	RZHPLZKQTXWDDK-IRLDBZIGSA-N	0	3	347.462	3.348	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2scnc2Cl)CC1	ZINC001168177958	1383835961	/nfs/dbraw/zinc/83/59/61/1383835961.db2.gz	NHCQETZOICPLAX-UHFFFAOYSA-N	0	3	334.272	3.039	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2nc(C)c(C)s2)CC1	ZINC001168211056	1383843808	/nfs/dbraw/zinc/84/38/08/1383843808.db2.gz	RBNIWHDHXRJZQC-UHFFFAOYSA-N	0	3	327.881	3.002	20	30		EGEDHN
C[C@@H](CCCCNCc1cc(F)ccc1C#N)NC(=O)c1ccoc1	ZINC001169166248	1384118395	/nfs/dbraw/zinc/11/83/95/1384118395.db2.gz	METKEETZKZHEAM-AWEZNQCLSA-N	0	3	343.402	3.369	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@H]1C[C@H](NCc2cc(C#N)ccc2F)C1(C)C	ZINC001308941211	1384160980	/nfs/dbraw/zinc/16/09/80/1384160980.db2.gz	OEYFJGMNZRHQCH-JKSUJKDBSA-N	0	3	347.434	3.479	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@H]1CCCC[C@@H]1CC	ZINC001169720862	1384178550	/nfs/dbraw/zinc/17/85/50/1384178550.db2.gz	WJUGNVSKCURBSJ-KBPBESRZSA-N	0	3	331.298	3.207	20	30		EGEDHN
CSC[C@@H](C)C(=O)N[C@@H](C)CCCCNCc1ccccc1C#N	ZINC001169821719	1384188907	/nfs/dbraw/zinc/18/89/07/1384188907.db2.gz	NDOUQYZAVYGQNR-CVEARBPZSA-N	0	3	347.528	3.322	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)[C@H]1[C@@H]2CCC[C@@H]21	ZINC001170029684	1384220998	/nfs/dbraw/zinc/22/09/98/1384220998.db2.gz	HDZGZVHSPBHFTP-KCUHQSDYSA-N	0	3	339.483	3.369	20	30		EGEDHN
C[C@H](CCCCNC/C(Cl)=C\Cl)NC(=O)c1ccc(C#N)[nH]1	ZINC001170202048	1384262722	/nfs/dbraw/zinc/26/27/22/1384262722.db2.gz	QYLBEMIPLYIKME-OYGDSYQHSA-N	0	3	343.258	3.084	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)C[C@H](CC)C(C)(C)C	ZINC001170886334	1384405471	/nfs/dbraw/zinc/40/54/71/1384405471.db2.gz	SWJUCPJDSOSDTN-ZDUSSCGKSA-N	0	3	333.314	3.453	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H](C)CCCCN[C@H](C)c1nnc(C)[nH]1	ZINC001170998535	1384427159	/nfs/dbraw/zinc/42/71/59/1384427159.db2.gz	SZMBIJXIZHARCS-UONOGXRCSA-N	0	3	335.496	3.041	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H](C)CCCCNCc1nccn1CC	ZINC001171010726	1384429148	/nfs/dbraw/zinc/42/91/48/1384429148.db2.gz	UQKGFHSDMVCZNO-INIZCTEOSA-N	0	3	334.508	3.270	20	30		EGEDHN
C=CCOC(=O)N[C@@H]1CCCN([C@H]2CCc3cccc(F)c3C2)C1	ZINC001171014287	1384429993	/nfs/dbraw/zinc/42/99/93/1384429993.db2.gz	XRQWBTJSCTVJTJ-CVEARBPZSA-N	0	3	332.419	3.060	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)c1ccns1	ZINC001171077119	1384442189	/nfs/dbraw/zinc/44/21/89/1384442189.db2.gz	NYJWGHPMOHABNA-CQSZACIVSA-N	0	3	342.468	3.093	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)CCCCNCc2ncc(C)s2)CCC1	ZINC001171187290	1384463523	/nfs/dbraw/zinc/46/35/23/1384463523.db2.gz	RPIBRXBUSKQGQP-OAHLLOKOSA-N	0	3	347.528	3.410	20	30		EGEDHN
COC(=O)c1ccc2c(c1)CN([C@H](C)Cc1cccc(C#N)c1)CC2	ZINC001171224982	1384473252	/nfs/dbraw/zinc/47/32/52/1384473252.db2.gz	WIXPITPGVOWCGI-OAHLLOKOSA-N	0	3	334.419	3.334	20	30		EGEDHN
CCCCCCC[NH2+]CCCC[C@H](C)NC(=O)c1cnc[n-]c1=O	ZINC001171436813	1384523111	/nfs/dbraw/zinc/52/31/11/1384523111.db2.gz	NRUBVHJHPXASTD-HNNXBMFYSA-N	0	3	336.480	3.031	20	30		EGEDHN
N#Cc1ccc(N2CCN([C@H]3CCc4c(F)cccc4C3)CC2)cc1	ZINC001171435801	1384523770	/nfs/dbraw/zinc/52/37/70/1384523770.db2.gz	ZAXOXJUPUOHOSW-IBGZPJMESA-N	0	3	335.426	3.377	20	30		EGEDHN
O=C1C=C2CN([C@H]3CCc4cc(F)c(F)c(F)c4C3)CCC2S1	ZINC001171534058	1384554835	/nfs/dbraw/zinc/55/48/35/1384554835.db2.gz	DKMSDVYRQYSBLU-FZMZJTMJSA-N	0	3	339.382	3.235	20	30		EGEDHN
Cc1ccc(CC[C@H](C)N2CCN(c3cc(C#N)ccn3)CC2)cc1	ZINC001171680325	1384599992	/nfs/dbraw/zinc/59/99/92/1384599992.db2.gz	QCRMKBJEGDBJIT-SFHVURJKSA-N	0	3	334.467	3.405	20	30		EGEDHN
C=CCOC(=O)[C@H](CC(C)C)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1	ZINC001171728538	1384615282	/nfs/dbraw/zinc/61/52/82/1384615282.db2.gz	PVYPPPXFJGPLRM-HOJAQTOUSA-N	0	3	344.499	3.383	20	30		EGEDHN
CC[C@H](C)[C@H]([NH2+][C@H](C)Cc1ccc(C(F)(F)F)cc1)C(=O)N[O-]	ZINC001171966599	1384698878	/nfs/dbraw/zinc/69/88/78/1384698878.db2.gz	VZWYWAIMPSGHQW-WDMOLILDSA-N	0	3	332.366	3.146	20	30		EGEDHN
COc1ccc(CN2CCN([C@H](C)Cc3ccc(C#N)cc3)CC2)cc1	ZINC001172307705	1384765542	/nfs/dbraw/zinc/76/55/42/1384765542.db2.gz	QGPPRECMXUOXKO-GOSISDBHSA-N	0	3	349.478	3.316	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)N1CC[C@H](NC(=O)OC(C)(C)C)C1	ZINC001172316952	1384767965	/nfs/dbraw/zinc/76/79/65/1384767965.db2.gz	YXIPEAQALABRCP-YOEHRIQHSA-N	0	3	329.444	3.088	20	30		EGEDHN
CC1(CCC(=O)NC[C@H](NCc2ccc(C#N)s2)C2CC2)CC1	ZINC001317028715	1384796190	/nfs/dbraw/zinc/79/61/90/1384796190.db2.gz	GVOYCHZHSJFOIM-INIZCTEOSA-N	0	3	331.485	3.184	20	30		EGEDHN
C[C@@H](CCCC#N)N1CCN(c2ccc(C(F)(F)F)cn2)CC1	ZINC001172507547	1384807839	/nfs/dbraw/zinc/80/78/39/1384807839.db2.gz	WMHATYUZEIJNMJ-ZDUSSCGKSA-N	0	3	326.366	3.305	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@H](C)OC2CCCCCC2)C1	ZINC001317088665	1384850672	/nfs/dbraw/zinc/85/06/72/1384850672.db2.gz	UHCUGPPSAHHPOQ-KKUMJFAQSA-N	0	3	328.884	3.104	20	30		EGEDHN
C[C@@H](NC(=O)C1(C)CCC1)[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001317211302	1384991289	/nfs/dbraw/zinc/99/12/89/1384991289.db2.gz	XYUIZVMQHRRAFX-VQIMIIECSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccsc1Cl)NCc1ccc(C#N)s1	ZINC001317270656	1385041330	/nfs/dbraw/zinc/04/13/30/1385041330.db2.gz	JJWOJSXTLSDBGA-VIFPVBQESA-N	0	3	339.873	3.243	20	30		EGEDHN
CCc1ccsc1C(=O)NC[C@@H](C)NCc1ccc(F)c(C#N)c1	ZINC001317294607	1385067278	/nfs/dbraw/zinc/06/72/78/1385067278.db2.gz	NRDYMZMBESHGHD-GFCCVEGCSA-N	0	3	345.443	3.229	20	30		EGEDHN
C=C(Br)CN[C@@H](C)CCNC(=O)C1=CCCCCC1	ZINC001317390007	1385110329	/nfs/dbraw/zinc/11/03/29/1385110329.db2.gz	NAZGJUUFGRTFRF-ZDUSSCGKSA-N	0	3	329.282	3.270	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H](C)CCCCNCc1cn(C(C)(C)C)nn1	ZINC001174683073	1385133729	/nfs/dbraw/zinc/13/37/29/1385133729.db2.gz	PJQIATQIBAUIFH-HNNXBMFYSA-N	0	3	349.523	3.010	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H](C)CCCCNCc1cc(OC)no1	ZINC001174832873	1385156553	/nfs/dbraw/zinc/15/65/53/1385156553.db2.gz	GXHBQFWUJOWLAN-LSDHHAIUSA-N	0	3	337.464	3.050	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@H](C)CCCCNCc1cn(C(C)C)nn1	ZINC001174849183	1385159937	/nfs/dbraw/zinc/15/99/37/1385159937.db2.gz	KOJAKSRFUPJRNG-IAGOWNOFSA-N	0	3	349.523	3.226	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](C)CCCCNCc2cc(C)no2)CC1	ZINC001175074409	1385190414	/nfs/dbraw/zinc/19/04/14/1385190414.db2.gz	QZRPQSIQOCQQQJ-HNNXBMFYSA-N	0	3	333.476	3.494	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H](C)CCCCN[C@H](C)c2nnc(C)[nH]2)CC1	ZINC001175081721	1385191441	/nfs/dbraw/zinc/19/14/41/1385191441.db2.gz	IFFHHBZNJOFGCI-HUUCEWRRSA-N	0	3	347.507	3.185	20	30		EGEDHN
C[C@H](C(=O)NC[C@@H]1CCN(Cc2ccc(C#N)cc2)C1)c1ccccc1	ZINC001317532289	1385259245	/nfs/dbraw/zinc/25/92/45/1385259245.db2.gz	IQPDYAZTTWGSCQ-PXNSSMCTSA-N	0	3	347.462	3.300	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H](C)CCCCNCc1cc(C)n(C)n1	ZINC001175467893	1385299986	/nfs/dbraw/zinc/29/99/86/1385299986.db2.gz	ACQRJOUBAQLOFX-HNNXBMFYSA-N	0	3	334.508	3.095	20	30		EGEDHN
C=CCn1cnc2c1ncnc2N=C1CCN(Cc2ccccc2)CC1	ZINC001175505626	1385315571	/nfs/dbraw/zinc/31/55/71/1385315571.db2.gz	WFYOBCKNJCMEIQ-UHFFFAOYSA-N	0	3	346.438	3.214	20	30		EGEDHN
CCCCC(=O)NCC[C@H]1CCN(Cc2cc(C#N)ccc2OC)C1	ZINC001317775084	1385468335	/nfs/dbraw/zinc/46/83/35/1385468335.db2.gz	NUGSDERMYMDRAB-INIZCTEOSA-N	0	3	343.471	3.085	20	30		EGEDHN
C#CCOc1ccccc1CN[C@@H]1CCCN(C(=O)c2ccccc2)C1	ZINC001318339934	1385654861	/nfs/dbraw/zinc/65/48/61/1385654861.db2.gz	BOQNBUXJQRLBMW-HXUWFJFHSA-N	0	3	348.446	3.093	20	30		EGEDHN
C=CC[C@H](C(=O)NCCCNCc1c(C)noc1C)c1ccccc1	ZINC001176697808	1385663091	/nfs/dbraw/zinc/66/30/91/1385663091.db2.gz	NPYFOHXZBZTHOJ-SFHVURJKSA-N	0	3	341.455	3.247	20	30		EGEDHN
N#Cc1ccc(CNCC2(NC(=O)CCC3CC3)CCCC2)c(F)c1	ZINC001318624567	1385801550	/nfs/dbraw/zinc/80/15/50/1385801550.db2.gz	QZOBKEMPCJMBDM-UHFFFAOYSA-N	0	3	343.446	3.406	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1cccc(C2CC2)c1	ZINC001177111040	1385816310	/nfs/dbraw/zinc/81/63/10/1385816310.db2.gz	CIYJRNKOKPOFBN-UHFFFAOYSA-N	0	3	337.261	3.182	20	30		EGEDHN
CC1(C)CCC[C@H](C(=O)NCCCNCc2ccccc2C#N)C1	ZINC001177155527	1385836106	/nfs/dbraw/zinc/83/61/06/1385836106.db2.gz	KEBBNUNCLUTZPZ-INIZCTEOSA-N	0	3	327.472	3.371	20	30		EGEDHN
C=C(Br)CNC[C@@](C)(NC(=O)CCC1CCC1)C1CC1	ZINC001318689662	1385842534	/nfs/dbraw/zinc/84/25/34/1385842534.db2.gz	MIJARJUXCKXVIU-MRXNPFEDSA-N	0	3	343.309	3.350	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)CCc2ccon2)CCCC[C@H]1C	ZINC001318745995	1385852302	/nfs/dbraw/zinc/85/23/02/1385852302.db2.gz	QBYYMBFXLNILQB-CXAGYDPISA-N	0	3	339.867	3.014	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)c1ccncc1	ZINC001177191697	1385852395	/nfs/dbraw/zinc/85/23/95/1385852395.db2.gz	AFTFXDLNIVEIJT-UHFFFAOYSA-N	0	3	335.879	3.446	20	30		EGEDHN
C=CCCC(=O)N(CCCNCc1cc(C)ncn1)CC1CCCC1	ZINC001177245787	1385882660	/nfs/dbraw/zinc/88/26/60/1385882660.db2.gz	ILXUZPLXPLGMSY-UHFFFAOYSA-N	0	3	344.503	3.250	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)C1CC(C(C)(C)C)C1	ZINC001177251227	1385884995	/nfs/dbraw/zinc/88/49/95/1385884995.db2.gz	DXNMJTGIHFXTCZ-UHFFFAOYSA-N	0	3	331.298	3.063	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)c1[nH]cnc1C	ZINC001177495976	1385979528	/nfs/dbraw/zinc/97/95/28/1385979528.db2.gz	OKCCCBUDQNCXSB-UHFFFAOYSA-N	0	3	338.883	3.083	20	30		EGEDHN
N#Cc1ccccc1CNCCCCCCNC(=O)C1=COCCC1	ZINC001178023584	1386110399	/nfs/dbraw/zinc/11/03/99/1386110399.db2.gz	HBPADULWHYBORS-UHFFFAOYSA-N	0	3	341.455	3.019	20	30		EGEDHN
C[C@@H](C(=O)NCCCCCCNCc1ccccc1C#N)C1CC1	ZINC001178121689	1386136066	/nfs/dbraw/zinc/13/60/66/1386136066.db2.gz	KLSANKQYXZJVFP-MRXNPFEDSA-N	0	3	327.472	3.371	20	30		EGEDHN
CC(C)[C@H](C)CC(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C	ZINC001178308524	1386184803	/nfs/dbraw/zinc/18/48/03/1386184803.db2.gz	JKNWFCPRHCAAML-HBFSDRIKSA-N	0	3	326.484	3.299	20	30		EGEDHN
CC1CC(C(=O)N2CC[C@H](NCC#Cc3ccccc3Cl)[C@@H]2C)C1	ZINC001178446896	1386220223	/nfs/dbraw/zinc/22/02/23/1386220223.db2.gz	CAMCLHFYPNQMIJ-ULGDZEHDSA-N	0	3	344.886	3.317	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCCCCCNCc1cnns1	ZINC001178567362	1386251097	/nfs/dbraw/zinc/25/10/97/1386251097.db2.gz	SPBOJRDUBLEBFH-UHFFFAOYSA-N	0	3	336.505	3.073	20	30		EGEDHN
O=C(NCCCS)C1CN(C(c2ccccc2)c2ccccc2)C1	ZINC001178593401	1386257540	/nfs/dbraw/zinc/25/75/40/1386257540.db2.gz	UNNRQYKIWHOBJQ-UHFFFAOYSA-N	0	3	340.492	3.144	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](NCc2ccc(Cl)cc2F)[C@@H]1C	ZINC001178599379	1386259500	/nfs/dbraw/zinc/25/95/00/1386259500.db2.gz	COCWLTNKRYRTQP-GUYCJALGSA-N	0	3	336.838	3.362	20	30		EGEDHN
COc1ccc(CN2CCC[C@@H]2CNc2cccc(C)n2)cc1C#N	ZINC001319823515	1386318933	/nfs/dbraw/zinc/31/89/33/1386318933.db2.gz	OFMFTZRUGGCFNC-GOSISDBHSA-N	0	3	336.439	3.347	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CC[C@H](NCC#Cc2cccc(Cl)c2)[C@@H]1C	ZINC001179314695	1386448148	/nfs/dbraw/zinc/44/81/48/1386448148.db2.gz	ZIRNQRNAQKAXMA-XKQJLSEDSA-N	0	3	336.838	3.019	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](NCc2ccccc2F)[C@@H]1C	ZINC001179313529	1386448274	/nfs/dbraw/zinc/44/82/74/1386448274.db2.gz	FMWDKXSFGKVJSC-LPHOPBHVSA-N	0	3	330.447	3.488	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCCCCCCN[C@@H](C)c1nnc(CC)[nH]1	ZINC001179339504	1386455356	/nfs/dbraw/zinc/45/53/56/1386455356.db2.gz	FYXNRUKUVILKIX-HOTGVXAUSA-N	0	3	349.523	3.297	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](NCc2cccc(C(C)C)n2)[C@@H]1C	ZINC001179360348	1386463602	/nfs/dbraw/zinc/46/36/02/1386463602.db2.gz	SMXNVUDEOXRANW-PXNSSMCTSA-N	0	3	341.499	3.478	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCCCCCN[C@H](C)c2nnc(CC)[nH]2)C1	ZINC001179532866	1386507615	/nfs/dbraw/zinc/50/76/15/1386507615.db2.gz	ABIANAGPMBLJPM-OAHLLOKOSA-N	0	3	347.507	3.051	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)[C@@H]1C[C@H]1c1ccco1	ZINC001179573948	1386519907	/nfs/dbraw/zinc/51/99/07/1386519907.db2.gz	RNVRPXYPHQKVSO-NBYUQASBSA-N	0	3	348.446	3.014	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)[C@H]1CC12CCCC2	ZINC001179856426	1386608573	/nfs/dbraw/zinc/60/85/73/1386608573.db2.gz	ACKYWMONDCESMC-SXLOBPIMSA-N	0	3	336.479	3.197	20	30		EGEDHN
C/C=C(\C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2ccccc2C#N)C1	ZINC001181049808	1386924978	/nfs/dbraw/zinc/92/49/78/1386924978.db2.gz	XLICKNVNURARGK-HVRMBUOZSA-N	0	3	325.456	3.099	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(C)n(Cc3ccco3)c2C)CC1	ZINC001321606548	1386939832	/nfs/dbraw/zinc/93/98/32/1386939832.db2.gz	OEFSNQMKGNKATF-UHFFFAOYSA-N	0	3	341.455	3.126	20	30		EGEDHN
CC(C)[C@H](C)CC(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001181527312	1387011163	/nfs/dbraw/zinc/01/11/63/1387011163.db2.gz	XJUCNRFPRHDSMX-RHSMWYFYSA-N	0	3	331.435	3.070	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2cnc(C)o2)C1	ZINC001181573271	1387018288	/nfs/dbraw/zinc/01/82/88/1387018288.db2.gz	NWFMYOQSEADTPG-FOIQADDNSA-N	0	3	345.487	3.326	20	30		EGEDHN
CCCCN(CC)[C@H](C(=O)NC1(C#N)CCOCC1)c1ccccc1	ZINC001182235341	1387127833	/nfs/dbraw/zinc/12/78/33/1387127833.db2.gz	IOWWBPGUJSMYRE-SFHVURJKSA-N	0	3	343.471	3.039	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2ccn(CC)n2)C1	ZINC001182305354	1387143163	/nfs/dbraw/zinc/14/31/63/1387143163.db2.gz	FTTZWKYFNDDTTM-MBOZVWFJSA-N	0	3	346.519	3.080	20	30		EGEDHN
CC(C)c1ccccc1CN(C)[C@H](C)CNC(=O)c1cc(C#N)c[nH]1	ZINC001329407393	1389100097	/nfs/dbraw/zinc/10/00/97/1389100097.db2.gz	DBUTUQFXOSMFJU-OAHLLOKOSA-N	0	3	338.455	3.260	20	30		EGEDHN
CN(C)C[C@@H]1CCc2ccccc2N1C(=O)c1ccc(C#N)cc1F	ZINC001339054171	1389877856	/nfs/dbraw/zinc/87/78/56/1389877856.db2.gz	LGYSAOROUWPKRE-INIZCTEOSA-N	0	3	337.398	3.221	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)N1CCC(c2nc(C)no2)CC1	ZINC001339997268	1390205118	/nfs/dbraw/zinc/20/51/18/1390205118.db2.gz	XZCMHOOOIBAEOJ-MRXNPFEDSA-N	0	3	336.480	3.162	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N[C@H](CC(C)C)c1nc2ccccc2[nH]1	ZINC001341540725	1390499560	/nfs/dbraw/zinc/49/95/60/1390499560.db2.gz	RVKYSMPSZJBHCT-WMLDXEAASA-N	0	3	328.460	3.450	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccn2)CC[C@H]1Nc1ccc(OCC#N)cc1	ZINC001341853817	1390537889	/nfs/dbraw/zinc/53/78/89/1390537889.db2.gz	ABBCBVBRSLHIJA-OXQOHEQNSA-N	0	3	336.439	3.306	20	30		EGEDHN
CC(C)Oc1ccc(C(=O)C(C#N)c2nc(N)c3ccccc3n2)cc1	ZINC001342607987	1390631905	/nfs/dbraw/zinc/63/19/05/1390631905.db2.gz	VPHYEJXOKRZPDL-MRXNPFEDSA-N	0	3	346.390	3.489	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N(C)Cc1csc(Br)c1	ZINC001343181895	1390697831	/nfs/dbraw/zinc/69/78/31/1390697831.db2.gz	UPWYNYQTGUJHQN-LLVKDONJSA-N	0	3	331.279	3.153	20	30		EGEDHN
CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)C(C#N)c1nccn1C	ZINC001343715419	1390732895	/nfs/dbraw/zinc/73/28/95/1390732895.db2.gz	CUDNRKUBPWTSGP-AWEZNQCLSA-N	0	3	348.410	3.113	20	30		EGEDHN
CCn1cc(C(=O)C(C#N)c2nc3c(cccc3Cl)[nH]2)c(C)n1	ZINC001346150194	1390911323	/nfs/dbraw/zinc/91/13/23/1390911323.db2.gz	ILBKYVSSPBUICW-SNVBAGLBSA-N	0	3	327.775	3.231	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)C2(c3ccccc3)CC2)CCCC1	ZINC001698803699	1406482558	/nfs/dbraw/zinc/48/25/58/1406482558.db2.gz	JDKARAOMMZAFFD-UHFFFAOYSA-N	0	3	332.875	3.489	20	30		EGEDHN
CCc1ccc(CC(=O)C(C#N)C(=O)N[C@@H](CC)c2ccccc2)nc1	ZINC001348268603	1391196122	/nfs/dbraw/zinc/19/61/22/1391196122.db2.gz	BCICXRJIPWBFOB-MOPGFXCFSA-N	0	3	349.434	3.163	20	30		EGEDHN
CCCN1CCCC[C@H]1C(=O)N[C@H]1CCCc2cc(C#N)ccc21	ZINC001348538140	1391234514	/nfs/dbraw/zinc/23/45/14/1391234514.db2.gz	UTSFFIAFEBFOHF-OALUTQOASA-N	0	3	325.456	3.316	20	30		EGEDHN
N#CCOc1ccc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)cc1	ZINC001349499272	1391335656	/nfs/dbraw/zinc/33/56/56/1391335656.db2.gz	SWYGJGGEVABFDB-KGLIPLIRSA-N	0	3	342.317	3.275	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1ccccc1SC[C@@H](C)C#N	ZINC001351187902	1391609290	/nfs/dbraw/zinc/60/92/90/1391609290.db2.gz	VTDHFOTXGHWQFL-HNNXBMFYSA-N	0	3	344.484	3.015	20	30		EGEDHN
C=CCOCCN1CCC[C@@H](NC(=O)C[C@@H](C)C2CCCCC2)C1	ZINC001479911986	1392479919	/nfs/dbraw/zinc/47/99/19/1392479919.db2.gz	UKYYLGWMXDYHRY-IEBWSBKVSA-N	0	3	336.520	3.376	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@@H](C)NCc2ccc(F)c(C#N)c2)c(F)c1	ZINC001480545065	1392787444	/nfs/dbraw/zinc/78/74/44/1392787444.db2.gz	UPTQZLPBWRQXCO-CYBMUJFWSA-N	0	3	343.377	3.053	20	30		EGEDHN
CCCN(CCNC(=O)Cc1ccsc1)Cc1ccc(C#N)cc1	ZINC001481129472	1393127931	/nfs/dbraw/zinc/12/79/31/1393127931.db2.gz	PJSOEVGMNPSCOT-UHFFFAOYSA-N	0	3	341.480	3.191	20	30		EGEDHN
C[C@H](C#N)C(=O)N(C)C1CCN(C/C=C\c2ccc(Cl)cc2)CC1	ZINC001490401480	1394215385	/nfs/dbraw/zinc/21/53/85/1394215385.db2.gz	AQWBTVRSQTYFOI-ABCZVMIZSA-N	0	3	345.874	3.436	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N[C@@H]1CCCN(Cc2ccc(C)cc2)C1)OCC	ZINC001481525892	1394376424	/nfs/dbraw/zinc/37/64/24/1394376424.db2.gz	OMYRZYMADHUTOD-WOJBJXKFSA-N	0	3	344.499	3.447	20	30		EGEDHN
CC[C@H](CNC(=O)CCc1ccsc1)NCc1ccc(C#N)s1	ZINC001481819661	1394545329	/nfs/dbraw/zinc/54/53/29/1394545329.db2.gz	AJCFDPAWGSNIST-CQSZACIVSA-N	0	3	347.509	3.298	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1cccc2c1ccn2C)C1CC1	ZINC001481944065	1394608818	/nfs/dbraw/zinc/60/88/18/1394608818.db2.gz	FUBJHWHFJUFDAK-LJQANCHMSA-N	0	3	345.874	3.419	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1ccc2oc(C)nc2c1)C(C)C	ZINC001698968994	1406729759	/nfs/dbraw/zinc/72/97/59/1406729759.db2.gz	UMBAKDZYRJUEJR-OAHLLOKOSA-N	0	3	335.835	3.233	20	30		EGEDHN
CN(CCC1CCN(C(=O)C2CC2)CC1)Cc1ccc(C#N)cc1F	ZINC001496493536	1396711010	/nfs/dbraw/zinc/71/10/10/1396711010.db2.gz	MEPZBTYJVBCSRJ-UHFFFAOYSA-N	0	3	343.446	3.168	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1cnn2ccccc12	ZINC001689908286	1404200302	/nfs/dbraw/zinc/20/03/02/1404200302.db2.gz	BCYKXLNNJMAYSB-GOEBONIOSA-N	0	3	346.862	3.060	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1CCN(Cc2cccc(OC)c2C)C1	ZINC001690100662	1404299379	/nfs/dbraw/zinc/29/93/79/1404299379.db2.gz	VYEITSFRUFOOQQ-LJQANCHMSA-N	0	3	342.483	3.278	20	30		EGEDHN
C[C@@H](C(=O)N1CCCC[C@@H]1CNCC#Cc1ccc(F)cc1)C1CC1	ZINC001690464274	1404593717	/nfs/dbraw/zinc/59/37/17/1404593717.db2.gz	VRXYMAWBWMUZPW-OXQOHEQNSA-N	0	3	342.458	3.194	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)Cc1coc2cc(F)ccc12	ZINC001690843345	1404773109	/nfs/dbraw/zinc/77/31/09/1404773109.db2.gz	VNIFBUFJWSPPNV-GFCCVEGCSA-N	0	3	338.810	3.351	20	30		EGEDHN
C[C@H](CCNC(=O)c1c[nH]c2ccccc21)NCc1ccccc1C#N	ZINC001690851725	1404776971	/nfs/dbraw/zinc/77/69/71/1404776971.db2.gz	GVYASOAPEFFOFS-OAHLLOKOSA-N	0	3	346.434	3.338	20	30		EGEDHN
C=Cc1ccc(C(=O)NCCN(CC)Cc2cccc(C#N)c2)cc1	ZINC001691042217	1404952177	/nfs/dbraw/zinc/95/21/77/1404952177.db2.gz	GSEJFEOLHKTABS-UHFFFAOYSA-N	0	3	333.435	3.453	20	30		EGEDHN
CCN(CCNC(=O)C1(CC)CCCC1)Cc1ccc(C#N)cc1	ZINC001691045971	1404957708	/nfs/dbraw/zinc/95/77/08/1404957708.db2.gz	BOMZBBSVLXPTBC-UHFFFAOYSA-N	0	3	327.472	3.467	20	30		EGEDHN
CC(C)C(C)(C)C(=O)NC[C@@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC001691143100	1405076088	/nfs/dbraw/zinc/07/60/88/1405076088.db2.gz	KEOIPWPJOSQUGV-SFHVURJKSA-N	0	3	327.472	3.179	20	30		EGEDHN
CCC(C)(C)C(=O)NC[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001691164148	1405099850	/nfs/dbraw/zinc/09/98/50/1405099850.db2.gz	OJUFHNRAKFMJAP-KOMQPUFPSA-N	0	3	331.435	3.118	20	30		EGEDHN
CCCN(CCNC(=O)c1ccccc1)Cc1ccc(F)c(C#N)c1	ZINC001691173669	1405109745	/nfs/dbraw/zinc/10/97/45/1405109745.db2.gz	JPTRSCSVSPFLHL-UHFFFAOYSA-N	0	3	339.414	3.339	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC[C@H]1C[C@@H](NCc2cc(Cl)ccc2Cl)C1	ZINC001691694478	1405428256	/nfs/dbraw/zinc/42/82/56/1405428256.db2.gz	MYYSXPAPGBVDLY-COPLHBTASA-N	0	3	340.254	3.137	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)CC2(OC)CCC2)CCCC[C@@H]1C	ZINC001732255842	1428496770	/nfs/dbraw/zinc/49/67/70/1428496770.db2.gz	BKHHEENQBFMLSI-KSSFIOAISA-N	0	3	342.911	3.353	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@H]1CC[C@H](N[C@H](C)c2c(F)cccc2F)CC1	ZINC001732306070	1428521790	/nfs/dbraw/zinc/52/17/90/1428521790.db2.gz	LGJHXMBJLHQFBC-AAVRWANBSA-N	0	3	335.398	3.202	20	30		EGEDHN
Cc1cscc1C(=O)NC[C@H](C)CNCc1ccccc1C#N	ZINC001732337741	1428540168	/nfs/dbraw/zinc/54/01/68/1428540168.db2.gz	AULKKDNKYWIWHB-CYBMUJFWSA-N	0	3	327.453	3.084	20	30		EGEDHN
C[C@@H](CNCc1ccccc1C#N)CNC(=O)C1(c2ccccc2)CC1	ZINC001732366895	1428550495	/nfs/dbraw/zinc/55/04/95/1428550495.db2.gz	FNVCOJATHZFBTI-KRWDZBQOSA-N	0	3	347.462	3.132	20	30		EGEDHN
C[C@@H](CNCc1ccc(F)c(C#N)c1)NC(=O)C1CCC2(CC2)CC1	ZINC001699411892	1412724931	/nfs/dbraw/zinc/72/49/31/1412724931.db2.gz	BYYHWGWHILYSJA-AWEZNQCLSA-N	0	3	343.446	3.262	20	30		EGEDHN
CCC1(C(=O)N[C@@H](C)CN(C)Cc2ccc(OCC#N)cc2)CCC1	ZINC001699454361	1412797409	/nfs/dbraw/zinc/79/74/09/1412797409.db2.gz	LBFPPPTVBFEPTB-INIZCTEOSA-N	0	3	343.471	3.106	20	30		EGEDHN
CC(C)(C)CC(=O)N[C@@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001699568315	1412924567	/nfs/dbraw/zinc/92/45/67/1412924567.db2.gz	BMGQMRKSHVZJIP-KRWDZBQOSA-N	0	3	331.435	3.118	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@]3(CCN(C(=O)CCCF)C3)C2)cc1	ZINC001699695653	1413105478	/nfs/dbraw/zinc/10/54/78/1413105478.db2.gz	RGLSCGPUZRAZLH-HXUWFJFHSA-N	0	3	343.446	3.122	20	30		EGEDHN
CC(C)(F)C(=O)N[C@H](CNCc1ccc(C#N)cc1F)C1CCCC1	ZINC001699787577	1413192568	/nfs/dbraw/zinc/19/25/68/1413192568.db2.gz	LAPJQWUDNOEJHR-QGZVFWFLSA-N	0	3	349.425	3.210	20	30		EGEDHN
CC(C)(C(=O)NCC1(NCc2ccc(F)c(C#N)c2)CCC1)C1CC1	ZINC001700135776	1413552469	/nfs/dbraw/zinc/55/24/69/1413552469.db2.gz	OAAIECHCFSENNA-UHFFFAOYSA-N	0	3	343.446	3.262	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)C3CC4(CCC4)C3)CCC2)s1	ZINC001700136010	1413553193	/nfs/dbraw/zinc/55/31/93/1413553193.db2.gz	OSGRXXQQKDZBBV-UHFFFAOYSA-N	0	3	343.496	3.329	20	30		EGEDHN
CCC[C@H](C)C(=O)NCC1(NCc2ccc(OC)c(C#N)c2)CCC1	ZINC001700147478	1413568253	/nfs/dbraw/zinc/56/82/53/1413568253.db2.gz	ZJMFXQWRNDGXOS-HNNXBMFYSA-N	0	3	343.471	3.132	20	30		EGEDHN
CC1(C)CN(Cc2ccc(C#N)cc2)CC[C@@H]1NC(=O)CCCF	ZINC001700290108	1413740771	/nfs/dbraw/zinc/74/07/71/1413740771.db2.gz	HELNXPZLCXIYSC-KRWDZBQOSA-N	0	3	331.435	3.025	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cc(Cl)c(Cl)[nH]1)C(C)C	ZINC001732564388	1428756036	/nfs/dbraw/zinc/75/60/36/1428756036.db2.gz	HCYMQZZPOFRYSK-LLVKDONJSA-N	0	3	338.666	3.418	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCCC[C@H]1CNCc1cccc(OC)n1	ZINC001700345577	1413832220	/nfs/dbraw/zinc/83/22/20/1413832220.db2.gz	ZUBUOQGJQLCQAE-AEFFLSMTSA-N	0	3	345.487	3.163	20	30		EGEDHN
C[C@H](c1cccc(Cl)c1)N(C)[C@@H](C)CNC(=O)c1cc(C#N)c[nH]1	ZINC001700454449	1414041301	/nfs/dbraw/zinc/04/13/01/1414041301.db2.gz	HBHCTZAEYRDZRX-QWHCGFSZSA-N	0	3	344.846	3.351	20	30		EGEDHN
Cc1cscc1C(=O)N(C)C[C@H](C)NCc1ccc(F)c(C#N)c1	ZINC001700748705	1414418164	/nfs/dbraw/zinc/41/81/64/1414418164.db2.gz	YWMKOQXNUTYSRO-ZDUSSCGKSA-N	0	3	345.443	3.318	20	30		EGEDHN
CCC(CC)C(=O)N(C)C1CC(NCc2ccc(C#N)cc2F)C1	ZINC001701016288	1414677869	/nfs/dbraw/zinc/67/78/69/1414677869.db2.gz	QZZVZFDXGJPJJD-UHFFFAOYSA-N	0	3	331.435	3.213	20	30		EGEDHN
Cc1ccc(F)c(C(=O)N[C@@H](C)CNCc2ccc(F)c(C#N)c2)c1	ZINC001733016993	1429136251	/nfs/dbraw/zinc/13/62/51/1429136251.db2.gz	YZDPLCMUPDRPBL-ZDUSSCGKSA-N	0	3	343.377	3.053	20	30		EGEDHN
Cc1ccc(C)c(C(=O)N[C@@H](C)CNCc2ccc(F)c(C#N)c2)c1	ZINC001733021139	1429140569	/nfs/dbraw/zinc/14/05/69/1429140569.db2.gz	MRTPOEHESIDJNL-HNNXBMFYSA-N	0	3	339.414	3.222	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@H](CNC(=O)CCCC3CC3)C2)c1	ZINC001707088771	1417195284	/nfs/dbraw/zinc/19/52/84/1417195284.db2.gz	ZWIGOSAYRGXQKQ-SAABIXHNSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)Cc1ccc(F)cc1	ZINC001707439632	1417343761	/nfs/dbraw/zinc/34/37/61/1417343761.db2.gz	TYSXMDOUURFLEJ-RHSMWYFYSA-N	0	3	338.854	3.480	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1ccc(COC)o1	ZINC001712998005	1417549180	/nfs/dbraw/zinc/54/91/80/1417549180.db2.gz	DCNYLNZSXRAWNX-DZGCQCFKSA-N	0	3	340.851	3.151	20	30		EGEDHN
CC1(C)CC(C(=O)NC[C@H](NCc2cc(C#N)ccc2F)C2CC2)C1	ZINC001713109632	1417670948	/nfs/dbraw/zinc/67/09/48/1417670948.db2.gz	VPMCZQKFTWAMDO-SFHVURJKSA-N	0	3	343.446	3.118	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCN(C1CC1)[C@@H]1CCc2c1cccc2Cl	ZINC001713555068	1418345344	/nfs/dbraw/zinc/34/53/44/1418345344.db2.gz	LSDXSTOESBPURM-SJKOYZFVSA-N	0	3	331.847	3.068	20	30		EGEDHN
CCCCC(=O)N1CCC(CN(C)Cc2ccc(C#N)s2)CC1	ZINC001713761398	1418570829	/nfs/dbraw/zinc/57/08/29/1418570829.db2.gz	PBGNABLNLKYPAI-UHFFFAOYSA-N	0	3	333.501	3.480	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2cncc(C)c2)CCCC[C@H]1C	ZINC001714180552	1418989111	/nfs/dbraw/zinc/98/91/11/1418989111.db2.gz	QCPCWCRHLFOOTR-RDTXWAMCSA-N	0	3	335.879	3.411	20	30		EGEDHN
CCN(CCNC(=O)C1(C)CCCCC1)Cc1ccc(C#N)cc1	ZINC001714588659	1419333177	/nfs/dbraw/zinc/33/31/77/1419333177.db2.gz	CTJYXDGBPGAOAL-UHFFFAOYSA-N	0	3	327.472	3.467	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1cccc2[nH]c(C)nc21)C1CC1	ZINC001715117101	1419861865	/nfs/dbraw/zinc/86/18/65/1419861865.db2.gz	AMICJVKQRNAVQC-GOSISDBHSA-N	0	3	346.862	3.112	20	30		EGEDHN
CN(CCC1CCN(C(=O)C2(C)CC2)CC1)Cc1ccc(C#N)s1	ZINC001715483016	1420162353	/nfs/dbraw/zinc/16/23/53/1420162353.db2.gz	YXTOMSFNMYKQMR-UHFFFAOYSA-N	0	3	345.512	3.480	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)COc1ccc(C)cc1C)C(C)C	ZINC001715502972	1420185977	/nfs/dbraw/zinc/18/59/77/1420185977.db2.gz	BVGJHYHXNGRBOO-INIZCTEOSA-N	0	3	338.879	3.165	20	30		EGEDHN
C=C(Br)CN[C@@H](CNC(=O)c1cccs1)C(C)C	ZINC001715515649	1420200958	/nfs/dbraw/zinc/20/09/58/1420200958.db2.gz	LMHYGNHJBZZPTE-NSHDSACASA-N	0	3	331.279	3.001	20	30		EGEDHN
C=C(Br)CN[C@H](CNC(=O)c1cccc(C)c1)C(C)C	ZINC001715518078	1420204047	/nfs/dbraw/zinc/20/40/47/1420204047.db2.gz	VFIJGUMUYDMLGU-OAHLLOKOSA-N	0	3	339.277	3.248	20	30		EGEDHN
Cc1ccc(C)c(CC(=O)N[C@H](C)CN(C)Cc2cccc(C#N)c2)c1	ZINC001716042781	1420505173	/nfs/dbraw/zinc/50/51/73/1420505173.db2.gz	YHIHJXLPHMWCJC-GOSISDBHSA-N	0	3	349.478	3.354	20	30		EGEDHN
CC(C)CCC(=O)N[C@@H]1CCC[C@@H]1CNCc1ccccc1C#N	ZINC001716054860	1420518729	/nfs/dbraw/zinc/51/87/29/1420518729.db2.gz	NHHGQFGKJQDMHW-RTBURBONSA-N	0	3	327.472	3.369	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)CCCC(C)=O)CC2)C1	ZINC001716703217	1420856594	/nfs/dbraw/zinc/85/65/94/1420856594.db2.gz	TUSSCCWAZSWARI-QGZVFWFLSA-N	0	3	340.895	3.059	20	30		EGEDHN
CC(C)SCC(=O)N[C@@H]1CCN(Cc2ccc(C#N)cc2)[C@@H](C)C1	ZINC001717329764	1421265012	/nfs/dbraw/zinc/26/50/12/1421265012.db2.gz	MPCLYLULOJDWNL-MAUKXSAKSA-N	0	3	345.512	3.169	20	30		EGEDHN
C[C@@H](CNC(=O)c1cccnc1C1CC1)N(C)Cc1ccc(C#N)cc1	ZINC001717479057	1421413286	/nfs/dbraw/zinc/41/32/86/1421413286.db2.gz	GOJUMDOTGJCOBH-HNNXBMFYSA-N	0	3	348.450	3.081	20	30		EGEDHN
C=C(Cl)CNC1CC(N(C)C(=O)CCCc2cccs2)C1	ZINC001717999893	1421767149	/nfs/dbraw/zinc/76/71/49/1421767149.db2.gz	PHGBBLXQLCZMKE-UHFFFAOYSA-N	0	3	326.893	3.402	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](NC(=O)C2(F)CCCCC2)C2CC2)s1	ZINC001723341701	1424360748	/nfs/dbraw/zinc/36/07/48/1424360748.db2.gz	PXWPDEFUZTUKDW-MRXNPFEDSA-N	0	3	349.475	3.277	20	30		EGEDHN
N#Cc1cccc(CNC2(CNC(=O)CC(C3CC3)C3CC3)CC2)c1	ZINC001723595012	1424481403	/nfs/dbraw/zinc/48/14/03/1424481403.db2.gz	LLDNBTJUNZRIJF-UHFFFAOYSA-N	0	3	337.467	3.123	20	30		EGEDHN
C[C@H](C#N)C(=O)NC1(C)CCN([C@@H]2CCc3c2cccc3Cl)CC1	ZINC001723999059	1424621465	/nfs/dbraw/zinc/62/14/65/1424621465.db2.gz	XJTLYVOXCVSBGV-CXAGYDPISA-N	0	3	345.874	3.458	20	30		EGEDHN
C[C@@]1(CNC(=O)C2CCCC2)CCCN(Cc2ccc(C#N)cc2)C1	ZINC001724311592	1424795301	/nfs/dbraw/zinc/79/53/01/1424795301.db2.gz	QGZAVGZWOJDANL-NRFANRHFSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=C(Cl)CNCC1(O)CCN(C(=O)C2CCCCCCC2)CC1	ZINC001724983408	1425384332	/nfs/dbraw/zinc/38/43/32/1425384332.db2.gz	BEKWQLMXAIMEMC-UHFFFAOYSA-N	0	3	342.911	3.043	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1ccc2c(c1)ncn2C	ZINC001725142315	1425622145	/nfs/dbraw/zinc/62/21/45/1425622145.db2.gz	DREHZYULAOIJBI-UHFFFAOYSA-N	0	3	348.878	3.014	20	30		EGEDHN
C[C@H](CNC(=O)CCC1CCCC1)N(C)Cc1cccc(C#N)c1	ZINC001734026701	1437814927	/nfs/dbraw/zinc/81/49/27/1437814927.db2.gz	WHQIQXJYAABUBW-MRXNPFEDSA-N	0	3	327.472	3.465	20	30		EGEDHN
Cc1cscc1C(=O)NC[C@H](C)N(C)Cc1cccc(C#N)c1	ZINC001734030944	1437819088	/nfs/dbraw/zinc/81/90/88/1437819088.db2.gz	CAHCPOKKXYWUCO-AWEZNQCLSA-N	0	3	327.453	3.179	20	30		EGEDHN
CN(CCCNC(=O)[C@@H]1CCC[C@@H](F)C1)Cc1ccc(F)c(C#N)c1	ZINC001751976148	1440130012	/nfs/dbraw/zinc/13/00/12/1440130012.db2.gz	ZLVXTTNJPVKKJZ-NVXWUHKLSA-N	0	3	349.425	3.164	20	30		EGEDHN
C#CCCCCC(=O)N1CCCC[C@H]1[C@H](C)NCc1c(C)noc1C	ZINC001752143560	1440145198	/nfs/dbraw/zinc/14/51/98/1440145198.db2.gz	UDQLWMXTXOEQRZ-LPHOPBHVSA-N	0	3	345.487	3.344	20	30		EGEDHN
CCN(CC#Cc1ccccc1)CCCNC(=O)CCc1ccco1	ZINC001752166114	1440149282	/nfs/dbraw/zinc/14/92/82/1440149282.db2.gz	TUJDQINXXIPJEJ-UHFFFAOYSA-N	0	3	338.451	3.092	20	30		EGEDHN
C/C=C(/C)C(=O)NCCCN(CC)CC#Cc1ccc(Cl)cc1	ZINC001752172038	1440150484	/nfs/dbraw/zinc/15/04/84/1440150484.db2.gz	KHKBSKMLTUSHFW-XRVIQIRUSA-N	0	3	332.875	3.486	20	30		EGEDHN
CC/C(C)=C/C(=O)NCCCN(CC)CC#Cc1ccc(F)cc1	ZINC001752181212	1440151049	/nfs/dbraw/zinc/15/10/49/1440151049.db2.gz	PBCSVFKZLGIQRK-WUKNDPDISA-N	0	3	330.447	3.362	20	30		EGEDHN
C=CCN1CCC(N(CCC)C(=O)c2ccnn2[C@@H](C)CC)CC1	ZINC001752440065	1440181127	/nfs/dbraw/zinc/18/11/27/1440181127.db2.gz	QHTHMBDMDXLQBY-INIZCTEOSA-N	0	3	332.492	3.357	20	30		EGEDHN
CCC(=CC(=O)NC[C@@H](NCc1ccc(C#N)cc1F)C1CC1)CC	ZINC001752453805	1440182822	/nfs/dbraw/zinc/18/28/22/1440182822.db2.gz	DVHFGXMLBWHDFM-LJQANCHMSA-N	0	3	343.446	3.428	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)CCOc1cc(C)ccc1C	ZINC001752545170	1440195013	/nfs/dbraw/zinc/19/50/13/1440195013.db2.gz	MLSNRONVNCFZNI-KDURUIRLSA-N	0	3	342.483	3.324	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CCCc1ccccn1	ZINC001752545055	1440195055	/nfs/dbraw/zinc/19/50/55/1440195055.db2.gz	LEXNPFIQJPIIAH-KDURUIRLSA-N	0	3	327.472	3.046	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1C[C@H](NCc2cc(Cl)ccc2F)C1	ZINC001752626268	1440196954	/nfs/dbraw/zinc/19/69/54/1440196954.db2.gz	NXVJKIGVPMKMEF-WKILWMFISA-N	0	3	336.838	3.410	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@H](CC)c2ccc(OC)cc2)C1	ZINC001752687625	1440200109	/nfs/dbraw/zinc/20/01/09/1440200109.db2.gz	WROOMCQVCCXNID-BFYDXBDKSA-N	0	3	336.863	3.178	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)COc2cccc(C(C)C)c2)C1	ZINC001752731268	1440204056	/nfs/dbraw/zinc/20/40/56/1440204056.db2.gz	LDQWDBWXGXZSDV-IYBDPMFKSA-N	0	3	336.863	3.178	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1C[C@@H](NCc2cc(Cl)ccc2F)C1	ZINC001752750207	1440204782	/nfs/dbraw/zinc/20/47/82/1440204782.db2.gz	NXVJKIGVPMKMEF-IYBDPMFKSA-N	0	3	336.838	3.410	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)[C@H](C)CCc2ccc(F)cc2)C1	ZINC001752783822	1440210185	/nfs/dbraw/zinc/21/01/85/1440210185.db2.gz	PVKKKWXNCCFTBO-IEBWSBKVSA-N	0	3	344.474	3.246	20	30		EGEDHN
C#CCN1CCC[C@@H](CNC(=O)C(C)(C)c2cccc(Cl)c2)C1	ZINC001752786957	1440211807	/nfs/dbraw/zinc/21/18/07/1440211807.db2.gz	CQBNUOCUJZIVBL-HNNXBMFYSA-N	0	3	332.875	3.079	20	30		EGEDHN
C#CCN1CCC[C@H](CNC(=O)[C@H](CC)Cc2cccc(C)c2)C1	ZINC001752787080	1440211873	/nfs/dbraw/zinc/21/18/73/1440211873.db2.gz	FZDNEMZELDXUAJ-WOJBJXKFSA-N	0	3	326.484	3.025	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@H](CNCc2ncc(C)s2)C1	ZINC001752798477	1440214663	/nfs/dbraw/zinc/21/46/63/1440214663.db2.gz	AQYOYINCUFGKOC-OAHLLOKOSA-N	0	3	335.517	3.382	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)C1(c2cccc(Cl)c2)CC1	ZINC001752821003	1440220495	/nfs/dbraw/zinc/22/04/95/1440220495.db2.gz	JMDLOHIQUTXKPH-SFHVURJKSA-N	0	3	344.886	3.366	20	30		EGEDHN
C#CCCCC(=O)N[C@@H](C)[C@@H]1CCCN(Cc2ccccc2F)C1	ZINC001752838749	1440228936	/nfs/dbraw/zinc/22/89/36/1440228936.db2.gz	WMRKKLJYHKVELY-DLBZAZTESA-N	0	3	330.447	3.346	20	30		EGEDHN
CC#CCCCC(=O)NC1CCC(NCc2nc(C)c(C)s2)CC1	ZINC001752851935	1440233717	/nfs/dbraw/zinc/23/37/17/1440233717.db2.gz	JBDVHWZBALMQEF-UHFFFAOYSA-N	0	3	347.528	3.471	20	30		EGEDHN
C#CCC1(C(=O)NC[C@@H](C)NCc2sc(C)nc2C)CCCCC1	ZINC001752922543	1440249150	/nfs/dbraw/zinc/24/91/50/1440249150.db2.gz	NVNYSVMYBGPREU-CQSZACIVSA-N	0	3	347.528	3.328	20	30		EGEDHN
C/C=C(\C)C(=O)N[C@@H]1CCC[C@H](NCc2cc(F)ccc2C#N)C1	ZINC001752966823	1440254202	/nfs/dbraw/zinc/25/42/02/1440254202.db2.gz	KNLILVFUZWFTBY-XUAIMZCTSA-N	0	3	329.419	3.181	20	30		EGEDHN
Cc1nc(C(C)C)oc1CN[C@@H]1CCC[C@H](NC(=O)C#CC(C)C)C1	ZINC001752967590	1440254384	/nfs/dbraw/zinc/25/43/84/1440254384.db2.gz	GPGCAFBVGQMEQX-SJORKVTESA-N	0	3	345.487	3.283	20	30		EGEDHN
C=CCOCCCC(=O)N1CCC[C@H](N(C)Cc2ccsc2)C1	ZINC001752989276	1440258988	/nfs/dbraw/zinc/25/89/88/1440258988.db2.gz	AKRVAULJQLSNMB-KRWDZBQOSA-N	0	3	336.501	3.154	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)c(F)c2)C1	ZINC001752992033	1440259695	/nfs/dbraw/zinc/25/96/95/1440259695.db2.gz	CTDZWPIVRJAIFD-SFHVURJKSA-N	0	3	343.446	3.476	20	30		EGEDHN
C[C@H](CCNC(=O)[C@H](C)c1cccs1)NCc1ccccc1C#N	ZINC001753013244	1440267563	/nfs/dbraw/zinc/26/75/63/1440267563.db2.gz	CSQMZQHLNWPGAI-HUUCEWRRSA-N	0	3	341.480	3.408	20	30		EGEDHN
C[C@H](CCNC(=O)c1cccc2[nH]ccc21)NCc1ccccc1C#N	ZINC001753014733	1440268020	/nfs/dbraw/zinc/26/80/20/1440268020.db2.gz	QHZLEGMYRZYVLI-OAHLLOKOSA-N	0	3	346.434	3.338	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCN(C)Cc2ccc3c(c2)CCC3)cc1	ZINC001753059309	1440282746	/nfs/dbraw/zinc/28/27/46/1440282746.db2.gz	CSXIGANWFOJMQU-UHFFFAOYSA-N	0	3	332.447	3.018	20	30		EGEDHN
CCCOc1cccc(CN(CC)CCNC(=O)C#CC(C)(C)C)c1	ZINC001753081405	1440293931	/nfs/dbraw/zinc/29/39/31/1440293931.db2.gz	DRCHRPALKFYZKT-UHFFFAOYSA-N	0	3	344.499	3.463	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NC[C@H]1CCN(Cc2cccc(F)c2)C1)OCC	ZINC001753128940	1440315691	/nfs/dbraw/zinc/31/56/91/1440315691.db2.gz	KWPKFTFIUXXLPE-MJGOQNOKSA-N	0	3	348.462	3.135	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H]1CCN(CCc2csc(C)n2)C1	ZINC001753131096	1440316667	/nfs/dbraw/zinc/31/66/67/1440316667.db2.gz	MTVALFXERHMJBF-HNNXBMFYSA-N	0	3	335.517	3.034	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCN(Cc1ccc(C2CCC2)cc1)C1CC1	ZINC001753153236	1440329274	/nfs/dbraw/zinc/32/92/74/1440329274.db2.gz	XPWZWQVFLXNFQG-HNNXBMFYSA-N	0	3	325.456	3.194	20	30		EGEDHN
C#CCCCC(=O)NCCN(C1CC1)[C@@H]1CCc2ccc(F)cc21	ZINC001753153091	1440329313	/nfs/dbraw/zinc/32/93/13/1440329313.db2.gz	METFLVQRBXNIQY-LJQANCHMSA-N	0	3	328.431	3.197	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCN(Cc1ccc2c(c1)COC2)C1CC1	ZINC001753160073	1440333072	/nfs/dbraw/zinc/33/30/72/1440333072.db2.gz	HDLFJRQRPLDFOG-UHFFFAOYSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=C(C)CN(CCNC(=O)C(C)(C)c1ccccc1OC)C1CC1	ZINC001753165403	1440335953	/nfs/dbraw/zinc/33/59/53/1440335953.db2.gz	WHZDDQFDBGIHQD-UHFFFAOYSA-N	0	3	330.472	3.130	20	30		EGEDHN
Cc1cc(C(=O)N(C)CCNCc2ccc(C#N)cc2)sc1C	ZINC001753258556	1440344023	/nfs/dbraw/zinc/34/40/23/1440344023.db2.gz	NCBWYZFMMMLHSO-UHFFFAOYSA-N	0	3	327.453	3.098	20	30		EGEDHN
CC(=O)NCCCN(CC#Cc1ccc(C(F)(F)F)cc1)C(C)C	ZINC001753281854	1440347570	/nfs/dbraw/zinc/34/75/70/1440347570.db2.gz	SBESZZMLRDIXQQ-UHFFFAOYSA-N	0	3	340.389	3.294	20	30		EGEDHN
C#CCCN[C@H](CNC(=O)c1cc2ccsc2[nH]1)c1ccccc1	ZINC001753299910	1440353541	/nfs/dbraw/zinc/35/35/41/1440353541.db2.gz	JJMITAQLDUDXKB-QGZVFWFLSA-N	0	3	337.448	3.313	20	30		EGEDHN
C=C(C)CN[C@H](CNC(=O)CCc1csc(C)n1)c1ccccc1	ZINC001753310487	1440356356	/nfs/dbraw/zinc/35/63/56/1440356356.db2.gz	DRKMAJVGJQUSQW-GOSISDBHSA-N	0	3	343.496	3.407	20	30		EGEDHN
C#CCCN[C@H](CNC(=O)c1ccc2ccn(C)c2c1)c1ccccc1	ZINC001753311040	1440356606	/nfs/dbraw/zinc/35/66/06/1440356606.db2.gz	FSUKOKPRYPFXHM-HXUWFJFHSA-N	0	3	345.446	3.262	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CCC)C(=O)Cc2c(C)noc2Cl)C1	ZINC001753319107	1440361975	/nfs/dbraw/zinc/36/19/75/1440361975.db2.gz	ALBIHTJWQAPCNW-CQSZACIVSA-N	0	3	339.867	3.068	20	30		EGEDHN
CC/C=C(/C)C(=O)NCC[C@H]1CCN(Cc2ccc(C#N)s2)C1	ZINC001753321084	1440363383	/nfs/dbraw/zinc/36/33/83/1440363383.db2.gz	BNCZWDKPXMXHEO-XCROGBHMSA-N	0	3	331.485	3.304	20	30		EGEDHN
C=CCOCCN1CC[C@@H](N(CCC)C(=O)[C@@H]2CCC(C)(C)C2)C1	ZINC001753329199	1440368169	/nfs/dbraw/zinc/36/81/69/1440368169.db2.gz	WOXBSIQMYFUHRB-QZTJIDSGSA-N	0	3	336.520	3.328	20	30		EGEDHN
C[C@@H](CC(=O)NCC[C@@H]1CCN(Cc2ccc(C#N)s2)C1)C1CC1	ZINC001753340812	1440375204	/nfs/dbraw/zinc/37/52/04/1440375204.db2.gz	KEVLENJFCIONAQ-LSDHHAIUSA-N	0	3	345.512	3.384	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC(CN(C)Cc2ccc(F)cn2)CC1	ZINC001753365610	1440385079	/nfs/dbraw/zinc/38/50/79/1440385079.db2.gz	GXGYAOAUHFRYAI-INIZCTEOSA-N	0	3	347.478	3.493	20	30		EGEDHN
CCCCCCCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H]1Cc2cccnc2C1	ZINC001753426900	1440397053	/nfs/dbraw/zinc/39/70/53/1440397053.db2.gz	UYMKRFXFSICIDU-QYZOEREBSA-N	0	3	341.499	3.052	20	30		EGEDHN
CCN(C(=O)[C@H](C)C#N)[C@@H]1CCN(CCCc2ccccc2Cl)C1	ZINC001753453817	1440407195	/nfs/dbraw/zinc/40/71/95/1440407195.db2.gz	XWNHLBKRULESBS-NVXWUHKLSA-N	0	3	347.890	3.355	20	30		EGEDHN
CC[C@H](CNC(=O)[C@H](C)C(C)(C)C)NCC#Cc1ccc(F)cc1	ZINC001753478791	1440415892	/nfs/dbraw/zinc/41/58/92/1440415892.db2.gz	MNKUMXXUHUTJPN-MAUKXSAKSA-N	0	3	332.463	3.344	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2csc(C3CC3)n2)CCCC1	ZINC001753511139	1440425967	/nfs/dbraw/zinc/42/59/67/1440425967.db2.gz	DQNKMBPLSBQRKZ-UHFFFAOYSA-N	0	3	339.892	3.405	20	30		EGEDHN
CC(C)CCC(=O)N[C@](C)(CNCC#Cc1ccc(F)cc1)C1CC1	ZINC001753513791	1440426825	/nfs/dbraw/zinc/42/68/25/1440426825.db2.gz	WGHFWWATZOXIDE-OAQYLSRUSA-N	0	3	344.474	3.488	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCCN(C(=O)C2CCC(F)CC2)C1	ZINC001753555343	1440435943	/nfs/dbraw/zinc/43/59/43/1440435943.db2.gz	SOWCKSQQNJKJOY-QQFBHYJXSA-N	0	3	330.875	3.486	20	30		EGEDHN
CCC1(C(=O)NC[C@H](C)CNCc2cc(F)ccc2C#N)CCC1	ZINC001753641139	1440454434	/nfs/dbraw/zinc/45/44/34/1440454434.db2.gz	VQWOMCDDPMBVTI-CQSZACIVSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)C[C@H]2CCC(C)(C)CO2)CCCC1	ZINC001753666416	1440460323	/nfs/dbraw/zinc/46/03/23/1440460323.db2.gz	HJEOEWADWGFNTB-OAHLLOKOSA-N	0	3	342.911	3.353	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccccc1)N(C)C(=O)C[C@@H]1CCC(F)(F)C1	ZINC001753694718	1440467187	/nfs/dbraw/zinc/46/71/87/1440467187.db2.gz	FGNOEQUHMMSWPB-WMZOPIPTSA-N	0	3	348.437	3.300	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)N(C)C(=O)C[C@@H]1C=CCCC1	ZINC001753698981	1440468018	/nfs/dbraw/zinc/46/80/18/1440468018.db2.gz	OECQULFHVPWSGT-HUUCEWRRSA-N	0	3	331.485	3.303	20	30		EGEDHN
C=CCC1(C(=O)N(C)[C@H](C)CNCC#Cc2ccc(F)cc2)CCC1	ZINC001753710550	1440470537	/nfs/dbraw/zinc/47/05/37/1440470537.db2.gz	FBFWYKNGJVFULH-QGZVFWFLSA-N	0	3	342.458	3.360	20	30		EGEDHN
CC(C)C[C@@H](CNCC#Cc1ccc(F)cc1)NC(=O)CC1CC1	ZINC001753731604	1440476058	/nfs/dbraw/zinc/47/60/58/1440476058.db2.gz	WGSTULCVOUXGSS-IBGZPJMESA-N	0	3	330.447	3.098	20	30		EGEDHN
CN(CC#Cc1ccccc1)CCC1CCN(C(=O)C2CCC2)CC1	ZINC001753816277	1440493985	/nfs/dbraw/zinc/49/39/85/1440493985.db2.gz	ARKWRLDWKILVMD-UHFFFAOYSA-N	0	3	338.495	3.399	20	30		EGEDHN
CC(C)[C@H](CNC(=O)c1c[nH]c(C#N)c1)NCc1ccccc1Cl	ZINC001753828035	1440498904	/nfs/dbraw/zinc/49/89/04/1440498904.db2.gz	BCZPBLGBWPCXRJ-KRWDZBQOSA-N	0	3	344.846	3.084	20	30		EGEDHN
C=C(Cl)CNCC[C@@H](C)NC(=O)c1cnn(C(C)(C)C)c1CC	ZINC001754022555	1440532705	/nfs/dbraw/zinc/53/27/05/1440532705.db2.gz	DXJJKNSHBJIHFP-CYBMUJFWSA-N	0	3	340.899	3.051	20	30		EGEDHN
C#Cc1cncc(C(=O)N(CC)CCNCc2cc3ccccc3o2)c1	ZINC001754066491	1440537542	/nfs/dbraw/zinc/53/75/42/1440537542.db2.gz	NNLTXJUPRQSUEJ-UHFFFAOYSA-N	0	3	347.418	3.061	20	30		EGEDHN
C=CCCC(=O)NC/C=C\CNCc1cccc(C(F)(F)F)c1	ZINC001754101576	1440541273	/nfs/dbraw/zinc/54/12/73/1440541273.db2.gz	PXDFVDMKULXPJF-PLNGDYQASA-N	0	3	326.362	3.434	20	30		EGEDHN
C#CCC1(C(=O)NC/C=C/CNCc2cccnc2C)CCCCC1	ZINC001754211998	1440551294	/nfs/dbraw/zinc/55/12/94/1440551294.db2.gz	NOVWIZGDTPSGCC-BQYQJAHWSA-N	0	3	339.483	3.126	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H](C)CN[C@@H](C)c2ccccc2Cl)cn1	ZINC001754249798	1440557547	/nfs/dbraw/zinc/55/75/47/1440557547.db2.gz	PLEUBGNBNCUCTO-KGLIPLIRSA-N	0	3	341.842	3.185	20	30		EGEDHN
CC1=C(C)C[C@@H](C(=O)N[C@@H](C)CNCc2ccc(C#N)s2)CC1	ZINC001754268645	1440561121	/nfs/dbraw/zinc/56/11/21/1440561121.db2.gz	WYPOMSYOAAWQGY-GJZGRUSLSA-N	0	3	331.485	3.351	20	30		EGEDHN
CCc1ccsc1C(=O)N[C@@H](C)CNCC#Cc1ccccc1	ZINC001754296101	1440566492	/nfs/dbraw/zinc/56/64/92/1440566492.db2.gz	DVIDGYIKRQXGSS-HNNXBMFYSA-N	0	3	326.465	3.070	20	30		EGEDHN
C=CCOCCN(C)C[C@@H](C)NC(=O)c1cccc2ccsc21	ZINC001754331588	1440584193	/nfs/dbraw/zinc/58/41/93/1440584193.db2.gz	UZYNYUCZFFZDOV-CQSZACIVSA-N	0	3	332.469	3.154	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)c1ccc2c(c1)CCC2	ZINC001754332633	1440584860	/nfs/dbraw/zinc/58/48/60/1440584860.db2.gz	JDUYUJYKYFMNIU-INIZCTEOSA-N	0	3	347.462	3.297	20	30		EGEDHN
Cc1ccc(C(=O)N(C)CCCNCc2ccccc2C#N)s1	ZINC001754355020	1440591474	/nfs/dbraw/zinc/59/14/74/1440591474.db2.gz	SMYSJMDBJVWMNQ-UHFFFAOYSA-N	0	3	327.453	3.180	20	30		EGEDHN
Cc1cccc(C(=O)N[C@@H](CNCc2ccc(C#N)s2)C2CC2)c1	ZINC001754437274	1440598491	/nfs/dbraw/zinc/59/84/91/1440598491.db2.gz	UJUZUSAAJRQKPF-SFHVURJKSA-N	0	3	339.464	3.226	20	30		EGEDHN
C=CCCCN1CC[C@@H]1CNC(=O)c1cc(F)cc2ccncc21	ZINC001754482230	1440607844	/nfs/dbraw/zinc/60/78/44/1440607844.db2.gz	JVLOWQRWVNWIOP-MRXNPFEDSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)C[C@@H](C)c1ccccc1OC	ZINC001754501666	1440614711	/nfs/dbraw/zinc/61/47/11/1440614711.db2.gz	ZTPQDCVRFHQZIR-IAGOWNOFSA-N	0	3	330.472	3.346	20	30		EGEDHN
C#Cc1ccc(C(=O)NCC2(N[C@H](C)c3ccc(F)cc3)CC2)cc1	ZINC001754521451	1440619856	/nfs/dbraw/zinc/61/98/56/1440619856.db2.gz	GUWSPZJVCQLTBP-OAHLLOKOSA-N	0	3	336.410	3.420	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC1(NCc2cccc(OC)c2C)CC1	ZINC001754523584	1440620247	/nfs/dbraw/zinc/62/02/47/1440620247.db2.gz	AMZHJIBCAPPMOR-LJQANCHMSA-N	0	3	330.472	3.344	20	30		EGEDHN
Cc1cccc([C@H](C)C(=O)NCC2(NCc3cccc(C#N)c3)CC2)c1	ZINC001754527484	1440621608	/nfs/dbraw/zinc/62/16/08/1440621608.db2.gz	KCRDERPSSVSFCH-KRWDZBQOSA-N	0	3	347.462	3.409	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1CC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001754563542	1440634601	/nfs/dbraw/zinc/63/46/01/1440634601.db2.gz	LQGABUXZAODKTR-DYESRHJHSA-N	0	3	339.483	3.419	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H]1CNCc1ccccc1OC1CC1	ZINC001754608851	1440643676	/nfs/dbraw/zinc/64/36/76/1440643676.db2.gz	FFSIQYCQIFKZNO-SFHVURJKSA-N	0	3	340.467	3.112	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@H]1CNCC#Cc1ccccc1Cl	ZINC001754617235	1440644718	/nfs/dbraw/zinc/64/47/18/1440644718.db2.gz	AONKAAAZMCIZCT-BPQIPLTHSA-N	0	3	344.886	3.318	20	30		EGEDHN
CC1(NC(=O)C2(F)CCCC2)CCN(Cc2cccc(C#N)c2)CC1	ZINC001754627220	1440646708	/nfs/dbraw/zinc/64/67/08/1440646708.db2.gz	GHWFXQZGKGRHHU-UHFFFAOYSA-N	0	3	343.446	3.311	20	30		EGEDHN
C#CCN(C(=O)CC)C1CCN([C@H]2CCc3ccc(F)cc32)CC1	ZINC001754632149	1440648058	/nfs/dbraw/zinc/64/80/58/1440648058.db2.gz	LHUVVTWSNSITNA-IBGZPJMESA-N	0	3	328.431	3.149	20	30		EGEDHN
C#CCN1CCC2(CO[C@@H](CNC(=O)[C@H](CCCC)C(C)C)C2)CC1	ZINC001754632055	1440648111	/nfs/dbraw/zinc/64/81/11/1440648111.db2.gz	ISKZYGSXRCGVFU-RTBURBONSA-N	0	3	348.531	3.069	20	30		EGEDHN
C#CCN(C(=O)CCCF)C1CCN(Cc2ccc(F)cc2C)CC1	ZINC001754639317	1440648854	/nfs/dbraw/zinc/64/88/54/1440648854.db2.gz	CTKCRXGDBDQTBN-UHFFFAOYSA-N	0	3	348.437	3.310	20	30		EGEDHN
C#CCN(C(=O)[C@@H](C)C(C)(F)F)C1CCN(Cc2ccccc2)CC1	ZINC001754641325	1440649112	/nfs/dbraw/zinc/64/91/12/1440649112.db2.gz	XZJXTRVLASHRTH-MRXNPFEDSA-N	0	3	348.437	3.404	20	30		EGEDHN
C#CCN(C(=O)c1coc(CCC)n1)C1CCN(CC=C(C)C)CC1	ZINC001754641995	1440649342	/nfs/dbraw/zinc/64/93/42/1440649342.db2.gz	DPBOWWOLEFERKN-UHFFFAOYSA-N	0	3	343.471	3.133	20	30		EGEDHN
C#CCCN[C@@H](CNC(=O)c1cccnc1C)c1ccccc1CC	ZINC001754785888	1440687721	/nfs/dbraw/zinc/68/77/21/1440687721.db2.gz	RJAXVNVUYZFMDT-FQEVSTJZSA-N	0	3	335.451	3.036	20	30		EGEDHN
C=CCCCC(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2Cc1conc1CC	ZINC001754831589	1440695657	/nfs/dbraw/zinc/69/56/57/1440695657.db2.gz	HJOKZKCPHTYFJZ-VBUUOAMHSA-N	0	3	345.487	3.453	20	30		EGEDHN
C#CCNCCN(Cc1ccccc1)C(=O)C(C1CCC1)C1CCC1	ZINC001754838095	1440697264	/nfs/dbraw/zinc/69/72/64/1440697264.db2.gz	YSUYHAIUFQRLLF-UHFFFAOYSA-N	0	3	338.495	3.454	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](CCN[C@@H](C)c2cnc(C)cn2)C1	ZINC001754917406	1440709011	/nfs/dbraw/zinc/70/90/11/1440709011.db2.gz	OVRMVHNFKLATSO-DLBZAZTESA-N	0	3	330.476	3.031	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCN(C(=O)c2cc3ccccc3n2C)C1	ZINC001754929560	1440710317	/nfs/dbraw/zinc/71/03/17/1440710317.db2.gz	NYFAPUMKWRVNNT-HNNXBMFYSA-N	0	3	345.874	3.373	20	30		EGEDHN
C=C(C)CCN(C)Cc1ccccc1CNC(=O)C(=O)C(C)(C)C	ZINC001754945696	1440712965	/nfs/dbraw/zinc/71/29/65/1440712965.db2.gz	FZVYILBAMXYZIZ-UHFFFAOYSA-N	0	3	330.472	3.316	20	30		EGEDHN
C#CCN[C@H](C)c1ccc(CNC(=O)c2cc(C)cc3c[nH]nc32)cc1	ZINC001754948707	1440714337	/nfs/dbraw/zinc/71/43/37/1440714337.db2.gz	NOGMKTNVSDDUBQ-OAHLLOKOSA-N	0	3	346.434	3.085	20	30		EGEDHN
C#CCN[C@H](C)c1ccc(CNC(=O)[C@H](OCC)C2CCCC2)cc1	ZINC001754949084	1440714477	/nfs/dbraw/zinc/71/44/77/1440714477.db2.gz	VXXNHRWQMJHHJV-OXQOHEQNSA-N	0	3	342.483	3.182	20	30		EGEDHN
C#CCCN(C)Cc1ccccc1CNC(=O)c1cccc(N(C)C)c1	ZINC001754955195	1440716210	/nfs/dbraw/zinc/71/62/10/1440716210.db2.gz	WUVHBQUQOGUWNK-UHFFFAOYSA-N	0	3	349.478	3.138	20	30		EGEDHN
CC#CCNC1(CNC(=O)CCc2ccc(C)c(Cl)c2)CCC1	ZINC001754988405	1440723547	/nfs/dbraw/zinc/72/35/47/1440723547.db2.gz	CJAXXKVWMZKNFT-UHFFFAOYSA-N	0	3	332.875	3.233	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCO[C@@H](CNCc2cc(C)ccc2F)C1	ZINC001755010206	1440725880	/nfs/dbraw/zinc/72/58/80/1440725880.db2.gz	ZZLAGDPEQADXAW-KRWDZBQOSA-N	0	3	348.462	3.053	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)C[C@@H](C)c2cccc(F)c2)CC1	ZINC001755028954	1440730237	/nfs/dbraw/zinc/73/02/37/1440730237.db2.gz	KACYYHQZQSFNAS-APWZRJJASA-N	0	3	330.447	3.313	20	30		EGEDHN
C=C(C)CCN1Cc2ccccc2C[C@H]1CNC(=O)C(C)(C)COC	ZINC001755075869	1440748774	/nfs/dbraw/zinc/74/87/74/1440748774.db2.gz	OHTUEPODQKVKGY-IBGZPJMESA-N	0	3	344.499	3.168	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@]2(CCN(Cc3oc(C)nc3C)C2)C1	ZINC001755079182	1440750348	/nfs/dbraw/zinc/75/03/48/1440750348.db2.gz	HHGHWLSROWFOPJ-HXUWFJFHSA-N	0	3	345.487	3.462	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@@H](CC(C)C)OC)cc2C1	ZINC001755102077	1440753048	/nfs/dbraw/zinc/75/30/48/1440753048.db2.gz	HGPQNIZLVSKIIC-LJQANCHMSA-N	0	3	330.472	3.256	20	30		EGEDHN
C=CCCC(=O)N1C[C@H](C)[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001755104793	1440753762	/nfs/dbraw/zinc/75/37/62/1440753762.db2.gz	KHWCFLWSWFALSU-MAUKXSAKSA-N	0	3	330.859	3.094	20	30		EGEDHN
C=CCOCCCC(=O)N1C[C@H](NCc2cc(C)ccc2F)[C@@H](C)C1	ZINC001755107134	1440753858	/nfs/dbraw/zinc/75/38/58/1440753858.db2.gz	JKQWHLPNSUXUNO-LPHOPBHVSA-N	0	3	348.462	3.053	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@H](NCc2ccccc2OC(C)C)[C@@H](C)C1	ZINC001755109003	1440754084	/nfs/dbraw/zinc/75/40/84/1440754084.db2.gz	ORSNYJXLGMNTMV-HKUYNNGSSA-N	0	3	342.483	3.070	20	30		EGEDHN
C[C@H]1CN(C(=O)C23CCC(CC2)C3)C[C@@H]1NCC#Cc1ccccc1	ZINC001755110175	1440754159	/nfs/dbraw/zinc/75/41/59/1440754159.db2.gz	JGQMQHQVRMJGRQ-DOLPWQRDSA-N	0	3	336.479	3.055	20	30		EGEDHN
Cc1nc(C)c(CN2CC[C@H](NC(=O)C#CC(C)C)C(C)(C)C2)s1	ZINC001755137665	1440759114	/nfs/dbraw/zinc/75/91/14/1440759114.db2.gz	BRXDIDSFHUWNBM-KRWDZBQOSA-N	0	3	347.528	3.136	20	30		EGEDHN
C=CCOCC(=O)N[C@@H]1CCN([C@H](C)c2ccc(F)cc2)CC1(C)C	ZINC001755139881	1440759769	/nfs/dbraw/zinc/75/97/69/1440759769.db2.gz	NJTJVEUJTCOKLG-CRAIPNDOSA-N	0	3	348.462	3.306	20	30		EGEDHN
CC(C)CCC(=O)N[C@@H]1CCN(Cc2cccc(C#N)c2)[C@H](C)C1	ZINC001755157408	1440763261	/nfs/dbraw/zinc/76/32/61/1440763261.db2.gz	IDDFFDPIMPHJHZ-VQIMIIECSA-N	0	3	327.472	3.464	20	30		EGEDHN
C=CCCCN1CCOC2(CCN(C(=O)[C@@H]3CCC[C@H]3CC)CC2)C1	ZINC001755174040	1440770237	/nfs/dbraw/zinc/77/02/37/1440770237.db2.gz	HJYVQPKRMJQIRK-RTBURBONSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCN1C(=O)[C@H](C)OCc1ccc(C)cc1	ZINC001755196689	1440777205	/nfs/dbraw/zinc/77/72/05/1440777205.db2.gz	RJYAKZXTHHMQDC-PKOBYXMFSA-N	0	3	330.472	3.009	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCN1C(=O)C[C@H](C)c1cccc(OC)c1	ZINC001755202338	1440780542	/nfs/dbraw/zinc/78/05/42/1440780542.db2.gz	DCDAOYZMPCALPK-FUHWJXTLSA-N	0	3	330.472	3.298	20	30		EGEDHN
CC(C)c1cccc(CN[C@@H](C)[C@@H](C)NC(=O)C#CC(C)(C)C)n1	ZINC001755251599	1440791974	/nfs/dbraw/zinc/79/19/74/1440791974.db2.gz	FPFYWMZEDWRIGU-JKSUJKDBSA-N	0	3	329.488	3.237	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)[C@@H](C)NCc2ccc(C#N)s2)CCC1	ZINC001755253079	1440792343	/nfs/dbraw/zinc/79/23/43/1440792343.db2.gz	OTGNLHZQFKNDOQ-ZIAGYGMSSA-N	0	3	331.485	3.349	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@@H](C)N(C)Cc1cccc(OC(C)C)c1	ZINC001755299458	1440808026	/nfs/dbraw/zinc/80/80/26/1440808026.db2.gz	VCTKYDQMNQVRHR-QGZVFWFLSA-N	0	3	330.472	3.070	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@H](C)N(C)Cc2ccc3cc[nH]c3c2)C1	ZINC001755315235	1440815270	/nfs/dbraw/zinc/81/52/70/1440815270.db2.gz	MDLKUJVWQZUHIO-HNNXBMFYSA-N	0	3	325.456	3.461	20	30		EGEDHN
CCCC[C@H](CNCC#Cc1ccccc1)NC(=O)C1CCCC1	ZINC001755356156	1440829587	/nfs/dbraw/zinc/82/95/87/1440829587.db2.gz	GMYQRYGEJIRAAD-HXUWFJFHSA-N	0	3	326.484	3.493	20	30		EGEDHN
CCCC[C@H](CNCc1ccc(C#N)s1)NC(=O)c1cc[nH]c1C	ZINC001755356977	1440829969	/nfs/dbraw/zinc/82/99/69/1440829969.db2.gz	CGWYWVCBFYDXHF-CQSZACIVSA-N	0	3	344.484	3.335	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)[C@@H](C)CCc2cccc(F)c2)C1	ZINC001755392310	1440842305	/nfs/dbraw/zinc/84/23/05/1440842305.db2.gz	STWHSQKGQPACKI-HOTGVXAUSA-N	0	3	332.463	3.407	20	30		EGEDHN
C=C(Cl)CNC[C@H]1C[C@H](NC(=O)Cc2ccc(C)cc2Cl)C1	ZINC001755473699	1440859173	/nfs/dbraw/zinc/85/91/73/1440859173.db2.gz	PSXLNSZCXFTBRD-CTYIDZIISA-N	0	3	341.282	3.428	20	30		EGEDHN
C=C(Cl)CNC[C@H]1C[C@H](NC(=O)[C@@H](C)Cc2ccccc2F)C1	ZINC001755478706	1440859753	/nfs/dbraw/zinc/85/97/53/1440859753.db2.gz	MYWGTIUJTGDJRW-NOLJZWGESA-N	0	3	338.854	3.241	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N[C@H](C)CCCNCC=C(Cl)Cl	ZINC001755517324	1440864382	/nfs/dbraw/zinc/86/43/82/1440864382.db2.gz	XBKXNTJLQRXBJC-IPYPFGDCSA-N	0	3	349.302	3.161	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N[C@@H](C)CCCNCC=C(Cl)Cl	ZINC001755517335	1440864390	/nfs/dbraw/zinc/86/43/90/1440864390.db2.gz	XBKXNTJLQRXBJC-YDHLFZDLSA-N	0	3	349.302	3.161	20	30		EGEDHN
CCC1(C(=O)N(C)[C@@H](CNCC#Cc2ccc(F)cc2)C2CC2)CC1	ZINC001755566434	1440875882	/nfs/dbraw/zinc/87/58/82/1440875882.db2.gz	UDJRIQYCSSQUQO-IBGZPJMESA-N	0	3	342.458	3.194	20	30		EGEDHN
C[C@H](CN(C)C(=O)[C@H](C)C(C)(C)C)NCc1ccc(C#N)c(F)c1	ZINC001755592254	1440881570	/nfs/dbraw/zinc/88/15/70/1440881570.db2.gz	BAKTUSSVOXTSDP-KGLIPLIRSA-N	0	3	333.451	3.316	20	30		EGEDHN
C=CCC(C)(C)C(=O)N(C)C[C@@H](C)NCc1cn(C(C)C)nc1C	ZINC001755608192	1440886468	/nfs/dbraw/zinc/88/64/68/1440886468.db2.gz	ZVTVDTIZIPASRW-OAHLLOKOSA-N	0	3	334.508	3.311	20	30		EGEDHN
C#CCOc1ccc(C(=O)N(C)C[C@H](C)NCc2ccsc2)cc1	ZINC001755608509	1440886505	/nfs/dbraw/zinc/88/65/05/1440886505.db2.gz	CVOFVNVJJLTDOB-HNNXBMFYSA-N	0	3	342.464	3.010	20	30		EGEDHN
C[C@H]1[C@H](NCC#Cc2ccccc2)CCN1C(=O)C1(F)CCCCC1	ZINC001755662936	1440893042	/nfs/dbraw/zinc/89/30/42/1440893042.db2.gz	BRTWYMFCCBVOMJ-PKOBYXMFSA-N	0	3	342.458	3.290	20	30		EGEDHN
CCCCCC(=O)N1C[C@H](NCc2ccc(F)c(C#N)c2)C[C@@H]1C	ZINC001755670384	1440893976	/nfs/dbraw/zinc/89/39/76/1440893976.db2.gz	QMSVWRSPSNINMB-WMLDXEAASA-N	0	3	331.435	3.357	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@H](NCc2ccc(C)nc2C)C[C@@H]1C	ZINC001755674816	1440894494	/nfs/dbraw/zinc/89/44/94/1440894494.db2.gz	HNBGAMDSVGIIEP-MAUKXSAKSA-N	0	3	329.488	3.380	20	30		EGEDHN
C#CCCCCC(=O)N[C@]12CCC[C@H]1N(Cc1cnccc1C)CC2	ZINC001755697903	1440898593	/nfs/dbraw/zinc/89/85/93/1440898593.db2.gz	CUSZTKZVVVJPIX-CTNGQTDRSA-N	0	3	339.483	3.197	20	30		EGEDHN
C=CCN1CC[C@]2(NC(=O)[C@H](C)Cc3ccc(C)cc3)CCC[C@H]12	ZINC001755704889	1440902105	/nfs/dbraw/zinc/90/21/05/1440902105.db2.gz	RMLOWZRIGXFMTQ-SLYNCCJLSA-N	0	3	326.484	3.473	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CC[C@H](CNCc2nc(C)c(C)s2)C1	ZINC001755743555	1440912078	/nfs/dbraw/zinc/91/20/78/1440912078.db2.gz	KADROCVPPMUYNH-DLBZAZTESA-N	0	3	347.528	3.328	20	30		EGEDHN
CC(C)N(CCN(C)[C@@H]1CCc2c1cccc2F)C(=O)C#CC1CC1	ZINC001755810683	1440920225	/nfs/dbraw/zinc/92/02/25/1440920225.db2.gz	LXAAGCNRBWJSRY-HXUWFJFHSA-N	0	3	342.458	3.395	20	30		EGEDHN
CC(C)N(CCN(C)[C@H]1CCc2c1cccc2F)C(=O)C#CC1CC1	ZINC001755810682	1440920250	/nfs/dbraw/zinc/92/02/50/1440920250.db2.gz	LXAAGCNRBWJSRY-FQEVSTJZSA-N	0	3	342.458	3.395	20	30		EGEDHN
C=C(C)CN(C)CCN(C(=O)c1ccnc(OC(C)C)c1)C(C)C	ZINC001755817768	1440924605	/nfs/dbraw/zinc/92/46/05/1440924605.db2.gz	YFCMDSFMWFKSCS-UHFFFAOYSA-N	0	3	333.476	3.227	20	30		EGEDHN
C#CCCCC(=O)N[C@@H](CNCc1cccc(Cl)n1)C(C)(C)C	ZINC001755823667	1440926441	/nfs/dbraw/zinc/92/64/41/1440926441.db2.gz	KJFLXCZPGFNSEB-HNNXBMFYSA-N	0	3	335.879	3.159	20	30		EGEDHN
C#CCN1CCC([C@H](C)NC(=O)C[C@H](C)c2cccc(F)c2)CC1	ZINC001755851134	1440934911	/nfs/dbraw/zinc/93/49/11/1440934911.db2.gz	SQBMJDFCWRTUDV-HOTGVXAUSA-N	0	3	330.447	3.169	20	30		EGEDHN
C=CCN1CC=C(CNC(=O)C2(Cc3ccccc3F)CC2)CC1	ZINC001755895861	1440942532	/nfs/dbraw/zinc/94/25/32/1440942532.db2.gz	XYUHKCQQVQOKNE-UHFFFAOYSA-N	0	3	328.431	3.083	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)C[C@H]1C=CCCC1	ZINC000187988724	236372877	/nfs/dbraw/zinc/37/28/77/236372877.db2.gz	LGZZUOHXSIZAAO-KRWDZBQOSA-N	0	3	325.456	3.195	20	30		EGEDHN
C[C@H](NC[C@@H](O)COc1ccccc1Cl)c1ccc(C#N)cc1	ZINC000298401952	202312121	/nfs/dbraw/zinc/31/21/21/202312121.db2.gz	JWFSXMJFKPVMBA-XJKSGUPXSA-N	0	3	330.815	3.302	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N[C@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000189266479	201047168	/nfs/dbraw/zinc/04/71/68/201047168.db2.gz	DFABVVCMKCIQGR-SLYNCCJLSA-N	0	3	344.499	3.385	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H](CCCC)c2ccc(OC)cc2)CC1	ZINC000264169845	201210371	/nfs/dbraw/zinc/21/03/71/201210371.db2.gz	VVMATIPFYBFLIW-HXUWFJFHSA-N	0	3	342.483	3.388	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC[C@@H](c3ccccc3C)C2)CC1	ZINC000264362346	201210686	/nfs/dbraw/zinc/21/06/86/201210686.db2.gz	OSJGJTJFTCRFJH-QGZVFWFLSA-N	0	3	327.472	3.144	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2cc3ccccc3[nH]2)CC1	ZINC000264417032	201210941	/nfs/dbraw/zinc/21/09/41/201210941.db2.gz	VORMXPAHZVZCOC-UHFFFAOYSA-N	0	3	326.444	3.008	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)Cc1ccc(C#N)cc1	ZINC000267342873	201222795	/nfs/dbraw/zinc/22/27/95/201222795.db2.gz	BWXUKFAEPXGSNP-LAUBAEHRSA-N	0	3	347.462	3.128	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H](c2ccc(F)cc2)C2CCC2)CC1	ZINC000264256745	201209863	/nfs/dbraw/zinc/20/98/63/201209863.db2.gz	PNZHUJMPCCTNON-IBGZPJMESA-N	0	3	328.431	3.128	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H]2C[C@H]2c2cccc(F)c2)CC1	ZINC000264382468	201209891	/nfs/dbraw/zinc/20/98/91/201209891.db2.gz	LPJQJWVQPDFWSI-ROUUACIJSA-N	0	3	331.435	3.021	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H](CN1CCCC1)c1ccc(OC)cc1	ZINC000272659714	201252204	/nfs/dbraw/zinc/25/22/04/201252204.db2.gz	OJVSHBUTSIZZEE-IBGZPJMESA-N	0	3	328.456	3.142	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN(C)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1	ZINC000273438236	201254019	/nfs/dbraw/zinc/25/40/19/201254019.db2.gz	MURUIXKXLOJXMQ-MOPGFXCFSA-N	0	3	346.446	3.178	20	30		EGEDHN
C#CC[C@H](NC(=O)N(C)[C@@H](C)C1CCN(C)CC1)c1ccccc1	ZINC000273406835	201256665	/nfs/dbraw/zinc/25/66/65/201256665.db2.gz	HSTKNOHVVBPXTL-LPHOPBHVSA-N	0	3	327.472	3.123	20	30		EGEDHN
C#CCOc1cc(F)ccc1NC(=O)N(C)[C@@H](C)C1CCN(C)CC1	ZINC000273529605	201259641	/nfs/dbraw/zinc/25/96/41/201259641.db2.gz	WAXMCARPRFQRGR-AWEZNQCLSA-N	0	3	347.434	3.032	20	30		EGEDHN
C=CC[C@@H](C(=O)NCCCCN1C[C@@H](C)O[C@@H](C)C1)c1ccccc1	ZINC000275099899	201275423	/nfs/dbraw/zinc/27/54/23/201275423.db2.gz	CTPUPESAEPFOOW-WSTZPKSXSA-N	0	3	344.499	3.352	20	30		EGEDHN
C#CCCOc1ccc(CNCCOCC(F)(F)C(F)F)cc1	ZINC000277471586	201301440	/nfs/dbraw/zinc/30/14/40/201301440.db2.gz	KIVDWEZVHDJDDE-UHFFFAOYSA-N	0	3	333.325	3.095	20	30		EGEDHN
C=C[C@@H](CC(=O)N1CCN(C2CCOCC2)C[C@@H]1C)c1ccccc1	ZINC000278342637	201310388	/nfs/dbraw/zinc/31/03/88/201310388.db2.gz	CHKQMNHUNZIUHV-ROUUACIJSA-N	0	3	342.483	3.058	20	30		EGEDHN
C=C(C)CN1CCC(Nc2cc(C(F)(F)F)ncc2[N+](=O)[O-])CC1	ZINC000278284857	201309366	/nfs/dbraw/zinc/30/93/66/201309366.db2.gz	FUSKIPIGFBJPKF-UHFFFAOYSA-N	0	3	344.337	3.461	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@H]1CCC[C@H]1CCO	ZINC000279196945	201314485	/nfs/dbraw/zinc/31/44/85/201314485.db2.gz	FOYGXZUALRWCGB-GJZGRUSLSA-N	0	3	334.485	3.044	20	30		EGEDHN
CN(CCOCc1ccccc1)CCC(=O)Nc1ccccc1C#N	ZINC000154597076	201396608	/nfs/dbraw/zinc/39/66/08/201396608.db2.gz	WZYQINKBGXRPEQ-UHFFFAOYSA-N	0	3	337.423	3.035	20	30		EGEDHN
Cc1ccc(CN[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)c(C)c1	ZINC000192244725	239603712	/nfs/dbraw/zinc/60/37/12/239603712.db2.gz	GZWKOFJSJBKFIF-HXUWFJFHSA-N	0	3	333.435	3.066	20	30		EGEDHN
Cc1ncsc1CCN1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC000074330909	203285668	/nfs/dbraw/zinc/28/56/68/203285668.db2.gz	CIQGGKWMGXZJFE-UHFFFAOYSA-N	0	3	340.496	3.074	20	30		EGEDHN
CCCO[C@@H]1CCCN(CCOc2ccc(C#N)cc2OC)CC1	ZINC000158050531	206170020	/nfs/dbraw/zinc/17/00/20/206170020.db2.gz	FMNPFNYXDZJKDR-QGZVFWFLSA-N	0	3	332.444	3.227	20	30		EGEDHN
Cc1noc(C2(C)CCN(CCCOc3ccc(C#N)cc3)CC2)n1	ZINC000378578530	169141334	/nfs/dbraw/zinc/14/13/34/169141334.db2.gz	HKXUEAHFCCALNN-UHFFFAOYSA-N	0	3	340.427	3.072	20	30		EGEDHN
COc1ccc(CNC[C@H](c2cccc(F)c2)N(C)C)cc1C#N	ZINC000174237833	207002432	/nfs/dbraw/zinc/00/24/32/207002432.db2.gz	WRODHOUQYGNCEH-GOSISDBHSA-N	0	3	327.403	3.098	20	30		EGEDHN
CN(Cc1ccccc1N1CCCC1)C[C@@H](O)c1ccc(C#N)cc1	ZINC000268650797	252104337	/nfs/dbraw/zinc/10/43/37/252104337.db2.gz	GKGRSJPPHZGQKK-OAQYLSRUSA-N	0	3	335.451	3.324	20	30		EGEDHN
N#Cc1csc(CNC[C@@H](CO)Cc2c(F)cccc2Cl)c1	ZINC000344678658	144209011	/nfs/dbraw/zinc/20/90/11/144209011.db2.gz	MMNAGSREJOLFAE-LBPRGKRZSA-N	0	3	338.835	3.353	20	30		EGEDHN
N#Cc1ccnc(NC[C@H](c2ccccc2)N2CCCC2)c1Cl	ZINC000341349822	155247761	/nfs/dbraw/zinc/24/77/61/155247761.db2.gz	BDXDVNNRDXTKJQ-MRXNPFEDSA-N	0	3	326.831	3.278	20	30		EGEDHN
N#Cc1c(F)cccc1C(=O)N1CCCN(CC2CCCCC2)CC1	ZINC000188554633	153022594	/nfs/dbraw/zinc/02/25/94/153022594.db2.gz	ILPSOZFHYBZZPM-UHFFFAOYSA-N	0	3	343.446	3.426	20	30		EGEDHN
COc1cccc([C@H](CNc2nc3c(cc2C#N)CCC3)N(C)C)c1	ZINC000336889251	154231401	/nfs/dbraw/zinc/23/14/01/154231401.db2.gz	LJBBLSPDEZSUSS-IBGZPJMESA-N	0	3	336.439	3.165	20	30		EGEDHN
COc1ccc(CN(CCN(C)C)Cc2ccc(C)o2)cc1C#N	ZINC000349063124	156339659	/nfs/dbraw/zinc/33/96/59/156339659.db2.gz	PFLASXYENHTFEF-UHFFFAOYSA-N	0	3	327.428	3.032	20	30		EGEDHN
CSc1ccc([C@@H](CNc2nccc(C#N)c2Cl)N(C)C)cc1	ZINC000338835929	163360263	/nfs/dbraw/zinc/36/02/63/163360263.db2.gz	WNKZZOCTCZWZAK-OAHLLOKOSA-N	0	3	346.887	3.465	20	30		EGEDHN
C[C@@H](Oc1ccc(C#N)cc1)C(=O)N(CCN(C)C)C1CCCCC1	ZINC000344060321	164093711	/nfs/dbraw/zinc/09/37/11/164093711.db2.gz	LLLGUWRGOMXKBI-MRXNPFEDSA-N	0	3	343.471	3.048	20	30		EGEDHN
CN(Cc1cc(C#N)n(C)c1)C[C@@H]1C[C@H](F)CN1Cc1cccs1	ZINC000354933145	166068122	/nfs/dbraw/zinc/06/81/22/166068122.db2.gz	FZIMFSMJJOKYKV-RDJZCZTQSA-N	0	3	346.475	3.003	20	30		EGEDHN
CCN(CC(=O)Nc1sc(C)c(C)c1C#N)[C@@H]1CCOC(C)(C)C1	ZINC000351939605	165158406	/nfs/dbraw/zinc/15/84/06/165158406.db2.gz	VPDILRJXEZHTHT-CQSZACIVSA-N	0	3	349.500	3.455	20	30		EGEDHN
C[C@H]1[C@H](NC(=O)Nc2ccc(C#N)cc2)CCN1Cc1ccccc1	ZINC000359021709	167041337	/nfs/dbraw/zinc/04/13/37/167041337.db2.gz	UFCOVUHVKMPQNS-HNAYVOBHSA-N	0	3	334.423	3.343	20	30		EGEDHN
COCCSc1ccc([C@H](C)NCc2cc(C#N)n(C)c2)cc1	ZINC000359739683	167219037	/nfs/dbraw/zinc/21/90/37/167219037.db2.gz	MKUMNIBJCQHDNB-AWEZNQCLSA-N	0	3	329.469	3.486	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1CCC[C@H](C[C@@H]2CCOC2)C1	ZINC000367403344	168221244	/nfs/dbraw/zinc/22/12/44/168221244.db2.gz	OSTHAHCKFMHKFG-MSOLQXFVSA-N	0	3	344.455	3.084	20	30		EGEDHN
C[C@@H](NC1(C2CC2)CCOCC1)C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000367564646	168242241	/nfs/dbraw/zinc/24/22/41/168242241.db2.gz	IYTMALQZEGPGET-GFCCVEGCSA-N	0	3	347.846	3.087	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N(CC)C[C@@H]1CCOC1	ZINC000677885895	549351469	/nfs/dbraw/zinc/35/14/69/549351469.db2.gz	MLSXKQUMNPLUMQ-HOTGVXAUSA-N	0	3	336.501	3.010	20	30		EGEDHN
C#Cc1ccc(CN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)cc1	ZINC000289433525	270041458	/nfs/dbraw/zinc/04/14/58/270041458.db2.gz	VVVFQMSEPUFSQK-UHFFFAOYSA-N	0	3	343.430	3.390	20	30		EGEDHN
CC(C)(CO)[C@@H](NCc1cc(C#N)ccc1Br)C1CC1	ZINC000293030054	270042411	/nfs/dbraw/zinc/04/24/11/270042411.db2.gz	LFBNTJUPUXXAMH-HNNXBMFYSA-N	0	3	337.261	3.207	20	30		EGEDHN
CCC(CC)[C@@H](CCNC(=O)C(C#N)Cc1ccc(C#N)cc1)OC	ZINC000348354570	270045513	/nfs/dbraw/zinc/04/55/13/270045513.db2.gz	YQFBJVHFKACWSO-RTBURBONSA-N	0	3	341.455	3.198	20	30		EGEDHN
N#Cc1ccccc1COc1cccc(CN[C@H](CO)CC(F)F)c1	ZINC000428642349	270050247	/nfs/dbraw/zinc/05/02/47/270050247.db2.gz	HIEGDTBMDGRFJQ-KRWDZBQOSA-N	0	3	346.377	3.243	20	30		EGEDHN
C/C(=C/c1ccccc1)CN(C)C[C@@H](O)COc1ccc(C#N)cc1	ZINC000494272642	270058752	/nfs/dbraw/zinc/05/87/52/270058752.db2.gz	APXPARDMOBBJJT-MJLBXUHQSA-N	0	3	336.435	3.333	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CN1CCC[C@@H]1c1cccc(F)c1	ZINC000528350186	270060183	/nfs/dbraw/zinc/06/01/83/270060183.db2.gz	DAURFQUBPCDZHZ-RBUKOAKNSA-N	0	3	340.398	3.274	20	30		EGEDHN
CCC(CC)(CNC(=O)C(C#N)Cc1ccc(C#N)cc1)SC	ZINC000280296204	266001069	/nfs/dbraw/zinc/00/10/69/266001069.db2.gz	FLECOUWXHXQMQP-MRXNPFEDSA-N	0	3	329.469	3.279	20	30		EGEDHN
CCC1(CC)[C@@H](NCC(=O)Nc2cc(Cl)ccc2C#N)C[C@@H]1OC	ZINC000191382644	266010396	/nfs/dbraw/zinc/01/03/96/266010396.db2.gz	OTXNQUSBYDYXIA-HOTGVXAUSA-N	0	3	349.862	3.333	20	30		EGEDHN
CCS[C@@H]1CCCC[C@@H]1N[C@@H]1CCN(c2sccc2C#N)C1=O	ZINC000299204479	266346035	/nfs/dbraw/zinc/34/60/35/266346035.db2.gz	GAVYUZUEVCHAOG-RRFJBIMHSA-N	0	3	349.525	3.379	20	30		EGEDHN
CCS[C@@H]1CCC[C@@H](NC(=O)C(C#N)Cc2ccc(C#N)cc2)C1	ZINC000280351225	266346861	/nfs/dbraw/zinc/34/68/61/266346861.db2.gz	IIOXSENDFJTKAD-KZNAEPCWSA-N	0	3	341.480	3.421	20	30		EGEDHN
CCS[C@H]1CCCCN(C(=O)C(C#N)Cc2ccc(C#N)cc2)C1	ZINC000280498095	266348037	/nfs/dbraw/zinc/34/80/37/266348037.db2.gz	QQEYRSTWISZVJR-ROUUACIJSA-N	0	3	341.480	3.375	20	30		EGEDHN
C[C@@H]1CN(C(=O)Nc2ccc(F)cc2C#N)CCN(C2CCC2)C1	ZINC000292879675	267039725	/nfs/dbraw/zinc/03/97/25/267039725.db2.gz	XUODYXMCPNSATH-ZDUSSCGKSA-N	0	3	330.407	3.035	20	30		EGEDHN
C[C@@H]1C[C@H](N[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)c2ccccc21	ZINC000290154913	267091515	/nfs/dbraw/zinc/09/15/15/267091515.db2.gz	CWLKSDVEUMXUCB-LPTQZCDUSA-N	0	3	345.446	3.497	20	30		EGEDHN
C[C@H](CCCC(F)(F)F)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000348510937	267149749	/nfs/dbraw/zinc/14/97/49/267149749.db2.gz	QOCBQVQEWGTPOF-IUODEOHRSA-N	0	3	337.345	3.478	20	30		EGEDHN
CC[C@H](N[C@@H]1CCN(c2ccc(C#N)cc2)C1=O)c1cccs1	ZINC000411512383	267223504	/nfs/dbraw/zinc/22/35/04/267223504.db2.gz	LOTQORNLXZUJSR-JKSUJKDBSA-N	0	3	325.437	3.466	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1Nc1nccc(C#N)c1Cl	ZINC000398014156	267233424	/nfs/dbraw/zinc/23/34/24/267233424.db2.gz	FIVHHSGKHSFXAE-YOEHRIQHSA-N	0	3	340.858	3.351	20	30		EGEDHN
C[C@H](CCN1CCN(C)CC1)Nc1ccc(C#N)c(C(F)(F)F)c1	ZINC000274495972	267246924	/nfs/dbraw/zinc/24/69/24/267246924.db2.gz	QXBLBGOOYAWFPD-CYBMUJFWSA-N	0	3	340.393	3.015	20	30		EGEDHN
CN(C)[C@@H](CNc1ccc(C(F)(F)F)c(C#N)n1)c1cccs1	ZINC000443407280	267285801	/nfs/dbraw/zinc/28/58/01/267285801.db2.gz	CQHLISCWWCQJJM-LBPRGKRZSA-N	0	3	340.374	3.170	20	30		EGEDHN
Cc1cc2ncn(C[C@H](O)CN[C@H](C)c3ccc(C#N)cc3)c2cc1C	ZINC000298750202	267366983	/nfs/dbraw/zinc/36/69/83/267366983.db2.gz	VVCNWRNXFONDMP-VQIMIIECSA-N	0	3	348.450	3.237	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)NCc2ccc(C#N)s2)N(C)C)cc1	ZINC000420801166	268046114	/nfs/dbraw/zinc/04/61/14/268046114.db2.gz	QLJLKDGCZXRZAI-KRWDZBQOSA-N	0	3	342.468	3.030	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CC[C@@H](c3ccccc3F)C2)cc1	ZINC000280214644	268084329	/nfs/dbraw/zinc/08/43/29/268084329.db2.gz	AIIDTSBTZMMABR-MSOLQXFVSA-N	0	3	347.393	3.396	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@H]2CCCc3c(O)cccc32)cc1	ZINC000352084421	268087037	/nfs/dbraw/zinc/08/70/37/268087037.db2.gz	KSYTUWPFIYFAFJ-LPHOPBHVSA-N	0	3	345.402	3.140	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCc2ccc3ncccc3c2)cc1	ZINC000349240691	268090554	/nfs/dbraw/zinc/09/05/54/268090554.db2.gz	IMBLGRWBLXLHQB-LJQANCHMSA-N	0	3	340.386	3.105	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NC[C@@H]2CCCc3ccccc32)cc1	ZINC000279700977	268091258	/nfs/dbraw/zinc/09/12/58/268091258.db2.gz	JJTVNGJQRHPUCC-VQTJNVASSA-N	0	3	343.430	3.477	20	30		EGEDHN
N#Cc1c(Cl)cccc1NC[C@H]1C[C@@H](O)CN1Cc1ccccc1	ZINC000450403948	268158633	/nfs/dbraw/zinc/15/86/33/268158633.db2.gz	DRIIVIAFLWFKFC-HZPDHXFCSA-N	0	3	341.842	3.259	20	30		EGEDHN
N#Cc1cccc(CN2CCC(C(=O)Nc3ccc(O)cc3)CC2)c1	ZINC000299647347	268246788	/nfs/dbraw/zinc/24/67/88/268246788.db2.gz	ZHGQJNPTRUZTMI-UHFFFAOYSA-N	0	3	335.407	3.115	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccc(F)c(C#N)c1	ZINC000183097148	274212587	/nfs/dbraw/zinc/21/25/87/274212587.db2.gz	PNWYYLNZXAOLJP-AWEZNQCLSA-N	0	3	340.402	3.339	20	30		EGEDHN
C[C@@H]1CN(c2nccnc2C#N)CCN1CC1CCC(C)(C)CC1	ZINC000354995234	274370583	/nfs/dbraw/zinc/37/05/83/274370583.db2.gz	TVQJNYBBZIRZHZ-OAHLLOKOSA-N	0	3	327.476	3.075	20	30		EGEDHN
N#Cc1ccccc1CSCCNCc1cccc2c1OCO2	ZINC000047698792	275143102	/nfs/dbraw/zinc/14/31/02/275143102.db2.gz	JNQLMZVDGOYPSD-UHFFFAOYSA-N	0	3	326.421	3.310	20	30		EGEDHN
Cc1cccc(C(=O)NCCN[C@H](C)c2ccc(C#N)c(F)c2)c1	ZINC000271927249	275242219	/nfs/dbraw/zinc/24/22/19/275242219.db2.gz	JODGMVYFLWTZFT-CQSZACIVSA-N	0	3	325.387	3.086	20	30		EGEDHN
CN(C)CCOc1ccccc1CNc1ccc([N+](=O)[O-])c(C#N)c1	ZINC000290628244	276521792	/nfs/dbraw/zinc/52/17/92/276521792.db2.gz	MGTGKTHDNLRDSX-UHFFFAOYSA-N	0	3	340.383	3.019	20	30		EGEDHN
CN(C)C[C@@H](NC(=O)Nc1ccc(F)c(C#N)c1)c1ccc(F)cc1	ZINC000349278620	276794928	/nfs/dbraw/zinc/79/49/28/276794928.db2.gz	CBXYTGOFGBWWEQ-QGZVFWFLSA-N	0	3	344.365	3.261	20	30		EGEDHN
CC(C)(C)[C@@H](NCC(=O)N[C@@](C)(C#N)C1CC1)c1ccc(F)cc1	ZINC000053644249	277227279	/nfs/dbraw/zinc/22/72/79/277227279.db2.gz	XKJTVDUDSUGVND-HKUYNNGSSA-N	0	3	331.435	3.311	20	30		EGEDHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccc(F)cc1C#N	ZINC000179671394	278179339	/nfs/dbraw/zinc/17/93/39/278179339.db2.gz	SBUJLNDITOIMBS-CQSZACIVSA-N	0	3	340.402	3.339	20	30		EGEDHN
CC(C)c1ccc(CCCN[C@H](C(N)=O)c2ccc(C#N)cc2)cc1	ZINC000116907637	307484972	/nfs/dbraw/zinc/48/49/72/307484972.db2.gz	QUDOGPCZFPSQPD-FQEVSTJZSA-N	0	3	335.451	3.430	20	30		EGEDHN
C[C@H](N[C@H](CN1CCN(C)CC1)c1ccccc1)c1cccc(C#N)c1	ZINC000539497751	314317091	/nfs/dbraw/zinc/31/70/91/314317091.db2.gz	VFHKMBKZDNXDGN-PGRDOPGGSA-N	0	3	348.494	3.198	20	30		EGEDHN
CCCN(CCN1CCCCC1)C(=O)CCc1ccc(C#N)cc1	ZINC000553152149	315247930	/nfs/dbraw/zinc/24/79/30/315247930.db2.gz	CHQYEZUTNRNABD-UHFFFAOYSA-N	0	3	327.472	3.215	20	30		EGEDHN
CCCN(CCc1cccc(F)c1)Cc1cnc2c(C#N)cnn2c1	ZINC000564729340	316195362	/nfs/dbraw/zinc/19/53/62/316195362.db2.gz	PTLXPAXONHHULU-UHFFFAOYSA-N	0	3	337.402	3.195	20	30		EGEDHN
CCN1CCCC[C@H]1CNC(=O)N[C@@H]1CCCc2cc(C#N)ccc21	ZINC000570306035	317037878	/nfs/dbraw/zinc/03/78/78/317037878.db2.gz	FBUKBSKKGITZKO-PKOBYXMFSA-N	0	3	340.471	3.109	20	30		EGEDHN
Cc1cccc(CCN2CCCN(Cc3ccc(C#N)cc3)CC2)n1	ZINC000572516192	317350215	/nfs/dbraw/zinc/35/02/15/317350215.db2.gz	KTCHWGYVZOJJKQ-UHFFFAOYSA-N	0	3	334.467	3.012	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2CCC[C@@H](SC)C2)CC1	ZINC000117493437	455087747	/nfs/dbraw/zinc/08/77/47/455087747.db2.gz	GFHHGFQOIGHRPM-HZPDHXFCSA-N	0	3	325.522	3.000	20	30		EGEDHN
COc1ccc(CN(C)CCC(=O)Nc2cccc(C#N)c2)cc1C	ZINC000171392749	323232688	/nfs/dbraw/zinc/23/26/88/323232688.db2.gz	ABEAXCPBMUTUHD-UHFFFAOYSA-N	0	3	337.423	3.336	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NCc2ccc(C#N)s2)C1	ZINC000382483516	324251711	/nfs/dbraw/zinc/25/17/11/324251711.db2.gz	YCANATOBECSGKK-CHWSQXEVSA-N	0	3	335.473	3.403	20	30		EGEDHN
C[C@H]1C[C@@H](Nc2cc(Br)c(C#N)cc2F)CCN1C	ZINC000388242099	324272993	/nfs/dbraw/zinc/27/29/93/324272993.db2.gz	VPPWFSWDDQNDOE-ONGXEEELSA-N	0	3	326.213	3.354	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1Nc1c(C#N)nnc2ccccc21	ZINC000389877177	324281218	/nfs/dbraw/zinc/28/12/18/324281218.db2.gz	VJHLABKIDQQKTD-QRWLVFNGSA-N	0	3	343.434	3.434	20	30		EGEDHN
N#Cc1cc(C(=O)N(CCN2CCCC2)c2ccccc2)ccc1F	ZINC000578385602	324961299	/nfs/dbraw/zinc/96/12/99/324961299.db2.gz	SMGLLLIZGIZBMV-UHFFFAOYSA-N	0	3	337.398	3.440	20	30		EGEDHN
Cc1csc(NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)c1C#N	ZINC000579073940	325057237	/nfs/dbraw/zinc/05/72/37/325057237.db2.gz	YIWOTAVQUFAJGJ-HNNXBMFYSA-N	0	3	340.452	3.324	20	30		EGEDHN
Cc1csc(NC(=O)NCc2ccc(CN(C)C)cc2)c1C#N	ZINC000580900195	325307513	/nfs/dbraw/zinc/30/75/13/325307513.db2.gz	IYOMBWWCTVOYCO-UHFFFAOYSA-N	0	3	328.441	3.312	20	30		EGEDHN
CN(C)[C@H]1CCOc2c(Nc3nccc(C#N)c3Cl)cccc21	ZINC000583254557	325508514	/nfs/dbraw/zinc/50/85/14/325508514.db2.gz	IQERUXGOKVCVMW-AWEZNQCLSA-N	0	3	328.803	3.157	20	30		EGEDHN
CC[C@@H](NCc1cccc(OCCCC#N)c1)[C@@H](O)C(F)(F)F	ZINC000345816299	456999992	/nfs/dbraw/zinc/99/99/92/456999992.db2.gz	LBDQLHKNJCCJGX-HUUCEWRRSA-N	0	3	330.350	3.161	20	30		EGEDHN
N#CCC1(CNCc2cnn(-c3ccc(Br)cc3)c2)CC1	ZINC000430042452	458392919	/nfs/dbraw/zinc/39/29/19/458392919.db2.gz	YKWKRXZEIJCKRB-UHFFFAOYSA-N	0	3	345.244	3.418	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCc1cc(Br)ccc1OC(F)F	ZINC000451608653	458483397	/nfs/dbraw/zinc/48/33/97/458483397.db2.gz	SXCAKXPOCCZTKJ-NEPJUHHUSA-N	0	3	348.187	3.484	20	30		EGEDHN
C=CCOc1ccc(CNC2(COC)CCOCC2)cc1Cl	ZINC000552083449	458890214	/nfs/dbraw/zinc/89/02/14/458890214.db2.gz	FZGSMWYSXHIEKK-UHFFFAOYSA-N	0	3	325.836	3.190	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H]2CC[C@@H](Cc3ccccc3)C2)CC1	ZINC000189887489	455250595	/nfs/dbraw/zinc/25/05/95/455250595.db2.gz	NPNDFZKBHRJBQX-AZUAARDMSA-N	0	3	341.499	3.347	20	30		EGEDHN
CCO[C@@H]1C[C@@](CO)(NCc2ccccc2C(C)(C)C#N)C1(C)C	ZINC000189983975	455265782	/nfs/dbraw/zinc/26/57/82/455265782.db2.gz	LZVIIOUAAQFISU-XLIONFOSSA-N	0	3	330.472	3.143	20	30		EGEDHN
C=C[C@](C)(O)C(=O)Nc1ccc(SCCN2CCCCC2)cc1	ZINC000616475907	460565294	/nfs/dbraw/zinc/56/52/94/460565294.db2.gz	CDXZWSPBQXCTGW-SFHVURJKSA-N	0	3	334.485	3.140	20	30		EGEDHN
CO/N=C/c1ccc(C(=O)N(CCN(C)C)C2CCCCC2)cc1	ZINC000264794510	455282995	/nfs/dbraw/zinc/28/29/95/455282995.db2.gz	VFFXAADPNNHMLI-HMMYKYKNSA-N	0	3	331.460	3.003	20	30		EGEDHN
CS[C@H]1CCCCN([C@H]2CCCN(c3ccc(C#N)cc3)C2=O)C1	ZINC000245531704	455322925	/nfs/dbraw/zinc/32/29/25/455322925.db2.gz	UBBMHZAVPHJEDD-ROUUACIJSA-N	0	3	343.496	3.271	20	30		EGEDHN
CC[NH+](CC)[C@H](C/N=C/c1c([O-])c(C)ncc1CO)c1ccccc1	ZINC000005111018	452838247	/nfs/dbraw/zinc/83/82/47/452838247.db2.gz	SPBUXMIZHAKSDC-MRUVXERFSA-N	0	3	341.455	3.090	20	30		EGEDHN
CC[NH+](CC)Cc1ccc(C/N=C/c2c([O-])c(C)ncc2CO)cc1	ZINC000005335188	452860173	/nfs/dbraw/zinc/86/01/73/452860173.db2.gz	LRRPDZOOFONOBG-CIAFOILYSA-N	0	3	341.455	3.049	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CN[C@@H]1CCSc2ccccc21	ZINC000600714690	460576640	/nfs/dbraw/zinc/57/66/40/460576640.db2.gz	OWAAHINJPCPZFF-DOTOQJQBSA-N	0	3	340.448	3.125	20	30		EGEDHN
COc1ccccc1[C@H](C/N=C/c1cccc(O)c1O)N1CCCC1	ZINC000022769440	453697954	/nfs/dbraw/zinc/69/79/54/453697954.db2.gz	ZLSLDPOUGULYMD-RSZPVBOMSA-N	0	3	340.423	3.362	20	30		EGEDHN
C#CCN1CCC(C(=O)NC(C)(C)c2cccc(Cl)c2F)CC1	ZINC000184219762	455363931	/nfs/dbraw/zinc/36/39/31/455363931.db2.gz	NLJLPZUEYNLCBD-UHFFFAOYSA-N	0	3	336.838	3.176	20	30		EGEDHN
C[C@@H](NC[C@H](O)COCc1ccccc1Cl)c1ccc(C#N)cc1	ZINC000030532597	453836445	/nfs/dbraw/zinc/83/64/45/453836445.db2.gz	SCIOCXKQNQPYMY-KDOFPFPSSA-N	0	3	344.842	3.440	20	30		EGEDHN
Cc1nnc(NC2CCN(CCc3ccccc3)CC2)c(C#N)c1C	ZINC000075669866	453915437	/nfs/dbraw/zinc/91/54/37/453915437.db2.gz	REEDPEKRDGRCBI-UHFFFAOYSA-N	0	3	335.455	3.084	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN(C)[C@@H](CCO)c1ccccc1	ZINC000075898800	453937535	/nfs/dbraw/zinc/93/75/35/453937535.db2.gz	LPXXDGCDCUXXBN-SFHVURJKSA-N	0	3	340.423	3.001	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)C1(C#N)CCCC1)c1cccc(OC)c1	ZINC000042002627	453988676	/nfs/dbraw/zinc/98/86/76/453988676.db2.gz	JMWMFPIPZDVETF-SFHVURJKSA-N	0	3	343.471	3.278	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC[C@H](Cc3ccc(F)cc3)C2)CC1	ZINC000076984280	454056365	/nfs/dbraw/zinc/05/63/65/454056365.db2.gz	IWCBCRULELANRU-QGZVFWFLSA-N	0	3	345.462	3.050	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2C[C@H](c3ccc(F)cc3)C[C@H]2C)CC1	ZINC000076984262	454056633	/nfs/dbraw/zinc/05/66/33/454056633.db2.gz	XEIPVYZAYBYTCJ-NVXWUHKLSA-N	0	3	345.462	3.364	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@@H]2C[C@H]2c2c(F)cccc2Cl)CC1	ZINC000076994584	454058084	/nfs/dbraw/zinc/05/80/84/454058084.db2.gz	RBFDULUUTRPDCF-ZIAGYGMSSA-N	0	3	336.838	3.349	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)C(=O)NCCN1CCC[C@@H](C)C1	ZINC000056864929	454086223	/nfs/dbraw/zinc/08/62/23/454086223.db2.gz	LBTUHDNSEFGLBA-QGZVFWFLSA-N	0	3	345.487	3.125	20	30		EGEDHN
C#CCN1C(=O)c2ccccc2NC12CCN(Cc1ccccc1)CC2	ZINC000077472589	454110164	/nfs/dbraw/zinc/11/01/64/454110164.db2.gz	VSTKSZBMIJHBIH-UHFFFAOYSA-N	0	3	345.446	3.180	20	30		EGEDHN
O=C(NCC#Cc1ccccc1)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000077741963	454150851	/nfs/dbraw/zinc/15/08/51/454150851.db2.gz	RFUJLEOUFFSTQA-NRFANRHFSA-N	0	3	347.462	3.002	20	30		EGEDHN
N#Cc1ccc(NC2CCN([C@@H]3CCOC3)CC2)cc1C(F)(F)F	ZINC000089603313	454166761	/nfs/dbraw/zinc/16/67/61/454166761.db2.gz	PFCAXPPVMPSINF-OAHLLOKOSA-N	0	3	339.361	3.242	20	30		EGEDHN
Cc1cccc2c1ncc(C#N)c2NC1CCN([C@H]2CCOC2)CC1	ZINC000089603037	454167204	/nfs/dbraw/zinc/16/72/04/454167204.db2.gz	KVRSUEDQNRQOJC-KRWDZBQOSA-N	0	3	336.439	3.080	20	30		EGEDHN
Cc1ccc([N-]S(=O)(=O)c2ccc(C#N)cc2C)c(C[NH+](C)C)c1	ZINC000077966354	454172487	/nfs/dbraw/zinc/17/24/87/454172487.db2.gz	RLBBTQBFXWZSBD-UHFFFAOYSA-N	0	3	343.452	3.038	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H]2C[C@@H]2c2cccc(F)c2F)CC1	ZINC000119278280	454183437	/nfs/dbraw/zinc/18/34/37/454183437.db2.gz	OSQJLYNKRAMMGT-HZPDHXFCSA-N	0	3	334.410	3.225	20	30		EGEDHN
C=CCN(Cc1ccccc1)C[C@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000045796840	454183672	/nfs/dbraw/zinc/18/36/72/454183672.db2.gz	GWMJWIAMEYMVED-SFHVURJKSA-N	0	3	342.395	3.023	20	30		EGEDHN
CN1CCC(NC(=O)c2cccc(Nc3ccc(C#N)cc3)c2)CC1	ZINC000130234949	454184064	/nfs/dbraw/zinc/18/40/64/454184064.db2.gz	ISJRMXAEKLUFOX-UHFFFAOYSA-N	0	3	334.423	3.126	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cc(F)c(F)c(F)c2)CC1	ZINC000119308330	454185740	/nfs/dbraw/zinc/18/57/40/454185740.db2.gz	OVDQFMDDZPCXHD-UHFFFAOYSA-N	0	3	327.350	3.266	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](CC)c2ccc(OC)cc2)CC1	ZINC000078533569	454270575	/nfs/dbraw/zinc/27/05/75/454270575.db2.gz	HRJZNEKFPYXCKL-IBGZPJMESA-N	0	3	345.487	3.486	20	30		EGEDHN
CCN(CCc1nc2ccccc2c(=O)[nH]1)[C@H](C)c1ccc(C#N)cc1	ZINC000060469303	454292247	/nfs/dbraw/zinc/29/22/47/454292247.db2.gz	UAAMXCAVJHUECZ-OAHLLOKOSA-N	0	3	346.434	3.420	20	30		EGEDHN
Cc1nnc(N2CC[C@@H](C)N(Cc3ccccc3)CC2)c(C#N)c1C	ZINC000078689553	454300125	/nfs/dbraw/zinc/30/01/25/454300125.db2.gz	YNLUAVZWFAMRGE-OAHLLOKOSA-N	0	3	335.455	3.066	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)CCc1cccs1	ZINC000060575871	454303429	/nfs/dbraw/zinc/30/34/29/454303429.db2.gz	RQDOTDOERQIKBI-UHFFFAOYSA-N	0	3	341.480	3.143	20	30		EGEDHN
CCc1ccc([C@@H](NCC(=O)N[C@](C)(C#N)C2CC2)C(C)C)cc1	ZINC000072835435	454347374	/nfs/dbraw/zinc/34/73/74/454347374.db2.gz	RGSKWHLJDMDIIM-VQTJNVASSA-N	0	3	327.472	3.344	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)c2ccc(CN3CCCC3=O)cc2)n1	ZINC000047358020	454362551	/nfs/dbraw/zinc/36/25/51/454362551.db2.gz	YMMCKLVGTJTHRS-OAHLLOKOSA-N	0	3	339.420	3.064	20	30		EGEDHN
CCN1CCCN(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)CC1	ZINC000091179598	454401374	/nfs/dbraw/zinc/40/13/74/454401374.db2.gz	SBQBGEVBZCDUGG-UHFFFAOYSA-N	0	3	340.349	3.137	20	30		EGEDHN
CN(CCC(=O)Nc1ccc(C#N)c(Cl)c1)CCC(F)(F)F	ZINC000063562325	454424059	/nfs/dbraw/zinc/42/40/59/454424059.db2.gz	NAIMOBQUFKAYLL-UHFFFAOYSA-N	0	3	333.741	3.424	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)C2(C#N)CCCC2)CCN1Cc1ccccc1	ZINC000079558694	454439632	/nfs/dbraw/zinc/43/96/32/454439632.db2.gz	WXFMZOGYAYDQNW-AEFFLSMTSA-N	0	3	325.456	3.240	20	30		EGEDHN
CCC[C@@H](C)N(C)CC(=O)N(CCC#N)c1ccc(OCC)cc1	ZINC000048071179	454439997	/nfs/dbraw/zinc/43/99/97/454439997.db2.gz	ATALBZNNGGLUEL-MRXNPFEDSA-N	0	3	331.460	3.452	20	30		EGEDHN
COCCN(CCOc1ccc(F)cc1)Cc1ccc(C#N)cc1	ZINC000063754476	454444411	/nfs/dbraw/zinc/44/44/11/454444411.db2.gz	OEWDGRMBLNXXKK-UHFFFAOYSA-N	0	3	328.387	3.225	20	30		EGEDHN
C#CCCCCNC(=O)NC1CCN([C@@H](C)c2ccccc2)CC1	ZINC000133690907	454455495	/nfs/dbraw/zinc/45/54/95/454455495.db2.gz	SLGUYTQFEDZBLO-KRWDZBQOSA-N	0	3	327.472	3.315	20	30		EGEDHN
N#CC(C(=O)c1cnn(-c2ccccc2)c1)c1nc2ccccc2[nH]1	ZINC000073972441	454509885	/nfs/dbraw/zinc/50/98/85/454509885.db2.gz	XHEFODPXZUBCBW-HNNXBMFYSA-N	0	3	327.347	3.239	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNc1ccc2nnc(C3CC3)n2n1)C(C)C	ZINC000102822563	454521692	/nfs/dbraw/zinc/52/16/92/454521692.db2.gz	OGFQKFSPKLYVQJ-INIZCTEOSA-N	0	3	340.475	3.112	20	30		EGEDHN
N#CC(C(=O)CCc1ccccc1Cl)C(=O)Nc1ccccn1	ZINC000103717596	454564917	/nfs/dbraw/zinc/56/49/17/454564917.db2.gz	QSZJFRQXRAZGQE-ZDUSSCGKSA-N	0	3	327.771	3.015	20	30		EGEDHN
CC(C)c1csc(C(C#N)C(=O)c2ccc3c(c2)NC(=O)CO3)n1	ZINC000080455209	454583582	/nfs/dbraw/zinc/58/35/82/454583582.db2.gz	OPEINAAMRHXTOH-LLVKDONJSA-N	0	3	341.392	3.087	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000074446845	454583757	/nfs/dbraw/zinc/58/37/57/454583757.db2.gz	CWAPBVBRRGINCO-MJGOQNOKSA-N	0	3	330.472	3.091	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)/C=C/c1ccsc1	ZINC000065931082	454640853	/nfs/dbraw/zinc/64/08/53/454640853.db2.gz	ZZMWAONDXRLKOK-VOTSOKGWSA-N	0	3	339.464	3.223	20	30		EGEDHN
COc1ccc(CN(CCO)[C@@H]2CCCc3ccccc32)cc1C#N	ZINC000135190623	454644477	/nfs/dbraw/zinc/64/44/77/454644477.db2.gz	GGHVBPGOWOUPES-HXUWFJFHSA-N	0	3	336.435	3.439	20	30		EGEDHN
CCC[C@H]1CN(c2ccc3cc(C#N)ccc3n2)CCN1CCOC	ZINC000092940927	454655850	/nfs/dbraw/zinc/65/58/50/454655850.db2.gz	ODSMPJGNZUXUGU-SFHVURJKSA-N	0	3	338.455	3.044	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCc2nc3ccccc3s2)CC1	ZINC000106039850	454675500	/nfs/dbraw/zinc/67/55/00/454675500.db2.gz	JYUJNNSVQXDVFY-UHFFFAOYSA-N	0	3	343.496	3.386	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCOc2cc(C)cc(C)c2)CC1	ZINC000106040810	454675733	/nfs/dbraw/zinc/67/57/33/454675733.db2.gz	NPFUXTRYVCUITP-UHFFFAOYSA-N	0	3	330.472	3.229	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCCOc2c(C)cccc2C)CC1	ZINC000106260628	454688854	/nfs/dbraw/zinc/68/88/54/454688854.db2.gz	OOWAKSOAKVQOHI-UHFFFAOYSA-N	0	3	345.487	3.022	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](C)Cc2ccccc2F)CC1	ZINC000106265597	454688925	/nfs/dbraw/zinc/68/89/25/454688925.db2.gz	RDEBIVUZXPZUMP-HNNXBMFYSA-N	0	3	333.451	3.096	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCC[C@@H]2Cc2ccccc2)CC1	ZINC000106275107	454689922	/nfs/dbraw/zinc/68/99/22/454689922.db2.gz	NYSSWEXUWRFLHN-HXUWFJFHSA-N	0	3	341.499	3.444	20	30		EGEDHN
CC[C@]1(NCC(=O)Nc2ccccc2S[C@@H](C)CC#N)CCOC1	ZINC000616865341	460648483	/nfs/dbraw/zinc/64/84/83/460648483.db2.gz	LGKZWHLUBCWUIT-KSSFIOAISA-N	0	3	347.484	3.178	20	30		EGEDHN
C(=N/OCc1csc(C2CC2)n1)\c1ccc(N2CCOCC2)cc1	ZINC000152783546	454725643	/nfs/dbraw/zinc/72/56/43/454725643.db2.gz	NAQYVONTWQUTDC-YBFXNURJSA-N	0	3	343.452	3.408	20	30		EGEDHN
CN(CCC#N)c1ccc(CN(C)[C@@H]2CCCc3c2cnn3C)cc1	ZINC000093864177	454738858	/nfs/dbraw/zinc/73/88/58/454738858.db2.gz	ZGTXBYGNJNAOAC-LJQANCHMSA-N	0	3	337.471	3.279	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCCC2Cc3ccccc3C2)CC1	ZINC000124652227	454756674	/nfs/dbraw/zinc/75/66/74/454756674.db2.gz	BCSQQGRLSLKKME-UHFFFAOYSA-N	0	3	341.499	3.131	20	30		EGEDHN
CCN1CCN([C@H](C)CNc2ccc(C(F)(F)F)c(C#N)c2)CC1	ZINC000136933617	454761991	/nfs/dbraw/zinc/76/19/91/454761991.db2.gz	WSJCCLMEEZUZMF-CYBMUJFWSA-N	0	3	340.393	3.015	20	30		EGEDHN
C=CCn1c(SCCN2CCCCC2)nnc1-c1ccccn1	ZINC000124846622	454775331	/nfs/dbraw/zinc/77/53/31/454775331.db2.gz	IYBJWJOUMPEKGP-UHFFFAOYSA-N	0	3	329.473	3.104	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN1CCC[C@H]1c1ccc(O)cc1	ZINC000138870656	454798477	/nfs/dbraw/zinc/79/84/77/454798477.db2.gz	WDGXVFZNSVHEDL-INIZCTEOSA-N	0	3	341.436	3.491	20	30		EGEDHN
CN(C)[C@H](CNC(=O)c1ccc(C#N)c(Cl)c1)c1ccccc1	ZINC000153628522	454814728	/nfs/dbraw/zinc/81/47/28/454814728.db2.gz	KQYRXVXEXXVIFO-QGZVFWFLSA-N	0	3	327.815	3.244	20	30		EGEDHN
C[C@H]1CN(C[C@@H]2CCCN2CC#Cc2ccc(Cl)cc2)C[C@H](C)O1	ZINC000177046746	454816105	/nfs/dbraw/zinc/81/61/05/454816105.db2.gz	HVEZUBNFGUHDLB-ZWOKBUDYSA-N	0	3	346.902	3.265	20	30		EGEDHN
CCN(CCC(=O)Nc1ccc(C#N)c(Cl)c1)Cc1ccccn1	ZINC000125359328	454816618	/nfs/dbraw/zinc/81/66/18/454816618.db2.gz	NNTAABXZSNLCRH-UHFFFAOYSA-N	0	3	342.830	3.457	20	30		EGEDHN
C[C@H](NCc1ccc(N2CCCC2)nc1)c1ccc(OCC#N)cc1	ZINC000177116573	454825074	/nfs/dbraw/zinc/82/50/74/454825074.db2.gz	UNWITNQWGWLUBY-INIZCTEOSA-N	0	3	336.439	3.435	20	30		EGEDHN
C#CCN1CCC(C(=O)NCC2(c3cccs3)CCCCC2)CC1	ZINC000153895954	454845177	/nfs/dbraw/zinc/84/51/77/454845177.db2.gz	NSGILWUOHGYDQN-UHFFFAOYSA-N	0	3	344.524	3.411	20	30		EGEDHN
C=CC1CCN([C@@H](C)C(=O)N[C@@H](C)c2cc(OC)ccc2OC)CC1	ZINC000111258567	454860075	/nfs/dbraw/zinc/86/00/75/454860075.db2.gz	XECMKAYFBDLKIZ-GJZGRUSLSA-N	0	3	346.471	3.168	20	30		EGEDHN
C#CCOc1ccc([C@H](C)NCc2cccnc2-n2cccn2)cc1	ZINC000177904220	454917735	/nfs/dbraw/zinc/91/77/35/454917735.db2.gz	VCSQPVPXBKTSIO-INIZCTEOSA-N	0	3	332.407	3.130	20	30		EGEDHN
CC[C@H](NCC(=O)N(CCC#N)c1cccc(C)c1C)[C@@H]1CCCO1	ZINC000182329711	455489753	/nfs/dbraw/zinc/48/97/53/455489753.db2.gz	CVGQIRIDEKZCOX-HKUYNNGSSA-N	0	3	343.471	3.097	20	30		EGEDHN
CCC1(CC)[C@H](N[C@@H](C)C(=O)Nc2ccccc2C#N)C[C@@H]1OC	ZINC000178363514	454952052	/nfs/dbraw/zinc/95/20/52/454952052.db2.gz	YGECSTIFTRQMNG-XKQJLSEDSA-N	0	3	329.444	3.069	20	30		EGEDHN
C#CCN(Cc1cc(=O)n2c3ccccc3[nH]c2c1C#N)C1CCCC1	ZINC000155735339	455038255	/nfs/dbraw/zinc/03/82/55/455038255.db2.gz	QLZYPHJEHCYPBT-QGZVFWFLSA-N	0	3	344.418	3.101	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H]2CCOC3(CCCCC3)C2)CC1	ZINC000151937746	455050887	/nfs/dbraw/zinc/05/08/87/455050887.db2.gz	YOJTYZCVWPEUHU-SFHVURJKSA-N	0	3	349.519	3.208	20	30		EGEDHN
C=CCC[C@@H](NC(=O)Nc1ccn(CCN(C)C)n1)c1ccccc1	ZINC000155885339	455056998	/nfs/dbraw/zinc/05/69/98/455056998.db2.gz	USPBIBGUBVVYDK-QGZVFWFLSA-N	0	3	341.459	3.274	20	30		EGEDHN
C[C@@H]1CN(CC2CCN(Cc3cc(C#N)ccc3F)CC2)C[C@@H](C)O1	ZINC000171306902	455060413	/nfs/dbraw/zinc/06/04/13/455060413.db2.gz	JPBSFKDGHYITFZ-HZPDHXFCSA-N	0	3	345.462	3.019	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)N1CCC(C#N)CC1)c1ccccc1	ZINC000171452110	455071504	/nfs/dbraw/zinc/07/15/04/455071504.db2.gz	SCTMIRNTYXJJHE-GOSISDBHSA-N	0	3	328.460	3.015	20	30		EGEDHN
CC[C@H](NCC(=O)N[C@@](C)(C#N)C(C)C)C(C)(C)c1ccccc1	ZINC000180011257	455115784	/nfs/dbraw/zinc/11/57/84/455115784.db2.gz	BKPRBGOUGMYZAA-PXNSSMCTSA-N	0	3	329.488	3.387	20	30		EGEDHN
C[C@H]1C[C@H]1[C@H](NCCC(=O)N(C)CCC#N)c1ccc(Cl)cc1	ZINC000180016380	455116662	/nfs/dbraw/zinc/11/66/62/455116662.db2.gz	CPGRNMVXDALQSD-FDQGKXFDSA-N	0	3	333.863	3.389	20	30		EGEDHN
C=CC[C@@H](C)NC(=O)NC[C@@H](c1ccc(OC)cc1)N1CCCC1	ZINC000172077955	455118720	/nfs/dbraw/zinc/11/87/20/455118720.db2.gz	NSRWQYBDQOPXSV-QAPCUYQASA-N	0	3	331.460	3.096	20	30		EGEDHN
COc1ccc(CNC[C@H](O)c2ccsc2)cc1OCCCC#N	ZINC000152560194	455135987	/nfs/dbraw/zinc/13/59/87/455135987.db2.gz	XDCYOIFNDJPLMG-INIZCTEOSA-N	0	3	346.452	3.262	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)Nc2cccc(C#N)c2)CN1Cc1ccccc1	ZINC000152595097	455140306	/nfs/dbraw/zinc/14/03/06/455140306.db2.gz	MMIGBXKMGNAEFF-BEFAXECRSA-N	0	3	334.423	3.343	20	30		EGEDHN
C=CCN1CCC(NC(=O)C2(c3ccc(F)cc3F)CCC2)CC1	ZINC000180286675	455154868	/nfs/dbraw/zinc/15/48/68/455154868.db2.gz	WZWASDDAVLHJFR-UHFFFAOYSA-N	0	3	334.410	3.153	20	30		EGEDHN
N#CCCCN1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1	ZINC000172587686	455163244	/nfs/dbraw/zinc/16/32/44/455163244.db2.gz	FNRGKLQXSYLJCN-UHFFFAOYSA-N	0	3	325.456	3.193	20	30		EGEDHN
Cc1nc(C)c([C@@H](C)N(C)C[C@@H](O)COc2ccc(C#N)cc2)s1	ZINC000264398463	455205085	/nfs/dbraw/zinc/20/50/85/455205085.db2.gz	HBQYMNVDGDUWNS-CZUORRHYSA-N	0	3	345.468	3.064	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@@H](C)N[C@@H](CC)c1ccc2c(c1)OCCO2	ZINC000180642685	455215888	/nfs/dbraw/zinc/21/58/88/455215888.db2.gz	UIPXQZTXZXUBIY-WBVHZDCISA-N	0	3	346.471	3.312	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2C[C@H](C)C[C@@H]2c2cccnc2)CC1	ZINC000183344430	455279819	/nfs/dbraw/zinc/27/98/19/455279819.db2.gz	VMWIZHGZCJTYHO-VQIMIIECSA-N	0	3	342.487	3.215	20	30		EGEDHN
CC(C)(C)[C@@H](NCC(=O)N[C@@](C)(C#N)C1CC1)c1cccc(F)c1	ZINC000181057412	455281512	/nfs/dbraw/zinc/28/15/12/455281512.db2.gz	ANKJQJJBKWOBIA-HKUYNNGSSA-N	0	3	331.435	3.311	20	30		EGEDHN
C[C@@H](CN(C)CCC(=O)Nc1cccc(C#N)c1)c1nccs1	ZINC000183999347	455346618	/nfs/dbraw/zinc/34/66/18/455346618.db2.gz	YNISTQPVBMUISV-ZDUSSCGKSA-N	0	3	328.441	3.079	20	30		EGEDHN
C[C@H](CCc1ccccc1)N[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000190613093	455352784	/nfs/dbraw/zinc/35/27/84/455352784.db2.gz	NHIJFKRBHXJZMJ-UTKZUKDTSA-N	0	3	347.462	3.270	20	30		EGEDHN
CC(C)[C@@H](NCc1cc(C#N)n(C)c1)c1ccc2c(c1)OCCO2	ZINC000190699094	455369258	/nfs/dbraw/zinc/36/92/58/455369258.db2.gz	BLHRLQGLCNBDEA-LJQANCHMSA-N	0	3	325.412	3.155	20	30		EGEDHN
C[C@H](NCC(=O)N[C@](C)(C#N)C1CC1)c1cc2ccccc2s1	ZINC000184365964	455373882	/nfs/dbraw/zinc/37/38/82/455373882.db2.gz	ITLTWXNYQJJDQP-KPZWWZAWSA-N	0	3	327.453	3.360	20	30		EGEDHN
COc1cc(OC)cc(C(=O)C(C#N)c2cnc3ccccc3n2)c1	ZINC000190970634	455416988	/nfs/dbraw/zinc/41/69/88/455416988.db2.gz	NIJUSNBQQWVAHF-OAHLLOKOSA-N	0	3	333.347	3.137	20	30		EGEDHN
C=CCn1c(SC[C@@H]2CCN(C)C2)nnc1-c1ccccc1F	ZINC000190986594	455419845	/nfs/dbraw/zinc/41/98/45/455419845.db2.gz	ACNNPVJLRSUDJM-CYBMUJFWSA-N	0	3	332.448	3.314	20	30		EGEDHN
C=CCOc1cccc(CN2CCC[C@H](Cc3nccn3C)C2)c1	ZINC000182090331	455432877	/nfs/dbraw/zinc/43/28/77/455432877.db2.gz	MSNFQLKXJCUZHY-GOSISDBHSA-N	0	3	325.456	3.440	20	30		EGEDHN
CN(C)Cc1ccnc(NCc2cn(C)nc2-c2ccc(C#N)cc2)c1	ZINC000182171899	455452916	/nfs/dbraw/zinc/45/29/16/455452916.db2.gz	CXDSBPHBNDHVDM-UHFFFAOYSA-N	0	3	346.438	3.027	20	30		EGEDHN
CN(C)CCOc1ccccc1CNc1ccc(Cl)c(C#N)n1	ZINC000267218811	455518368	/nfs/dbraw/zinc/51/83/68/455518368.db2.gz	NKBURMVDKHRCJA-UHFFFAOYSA-N	0	3	330.819	3.159	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1C[C@@H](c2ccccc2C)C[C@H]1C	ZINC000246932581	455536552	/nfs/dbraw/zinc/53/65/52/455536552.db2.gz	DRODYVIUKLUADB-NXHRZFHOSA-N	0	3	327.472	3.181	20	30		EGEDHN
C#CCCCC(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000192125512	455560413	/nfs/dbraw/zinc/56/04/13/455560413.db2.gz	MGCHIIHBGFPNGT-UHFFFAOYSA-N	0	3	348.874	3.103	20	30		EGEDHN
C=C(C)[C@@H](NC(=O)NC[C@H]1CCCN1CC)c1ccc(F)c(F)c1	ZINC000185510411	455570324	/nfs/dbraw/zinc/57/03/24/455570324.db2.gz	UTRYGYGJRAHLKF-RHSMWYFYSA-N	0	3	337.414	3.366	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN2CCC(O)(c3ccccc3)CC2)cc1	ZINC000185642299	455588852	/nfs/dbraw/zinc/58/88/52/455588852.db2.gz	JBSDBMPLPKADJB-KRWDZBQOSA-N	0	3	336.435	3.461	20	30		EGEDHN
COc1ccccc1-c1nc(C2CCN(CCCC#N)CC2)no1	ZINC000192338996	455592612	/nfs/dbraw/zinc/59/26/12/455592612.db2.gz	QIYKFOXSXRDIBD-UHFFFAOYSA-N	0	3	326.400	3.228	20	30		EGEDHN
C=CCNC(=O)CN[C@@](C)(c1ccc(Br)cc1)C(C)C	ZINC000192373607	455600725	/nfs/dbraw/zinc/60/07/25/455600725.db2.gz	SDHYNNVIONMLJB-MRXNPFEDSA-N	0	3	339.277	3.212	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1CCN(C2CCC2)C[C@@H](C)C1	ZINC000292231800	455602989	/nfs/dbraw/zinc/60/29/89/455602989.db2.gz	CKSFURTYGYRIQZ-MRXNPFEDSA-N	0	3	328.456	3.198	20	30		EGEDHN
N#C[C@H]1CCC[C@@H](NCc2ccc(N3CCC(CO)CC3)cc2)C1	ZINC000185795754	455623276	/nfs/dbraw/zinc/62/32/76/455623276.db2.gz	WWWXSZSMAYYHSC-RBUKOAKNSA-N	0	3	327.472	3.067	20	30		EGEDHN
CC(C)c1ccoc1C(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000284118466	455638531	/nfs/dbraw/zinc/63/85/31/455638531.db2.gz	XHPDXRIGGQPKAO-UHFFFAOYSA-N	0	3	339.439	3.479	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)c1ncc(C#N)cc1Cl	ZINC000268342122	455656415	/nfs/dbraw/zinc/65/64/15/455656415.db2.gz	SHUWKJUTGKXGEQ-UHFFFAOYSA-N	0	3	339.830	3.047	20	30		EGEDHN
N#C[C@@H]1CC[C@H](N2CCC(NC(=O)Nc3ccc(F)cc3)CC2)C1	ZINC000292711988	455737792	/nfs/dbraw/zinc/73/77/92/455737792.db2.gz	FFORPEOBIVXQAK-DYVFJYSZSA-N	0	3	330.407	3.104	20	30		EGEDHN
CC(C)C[C@@H]1OCCC[C@H]1NCC(=O)N(CCC#N)c1ccccc1	ZINC000186358490	455751780	/nfs/dbraw/zinc/75/17/80/455751780.db2.gz	FFVMAYMJVLKLNM-MOPGFXCFSA-N	0	3	343.471	3.117	20	30		EGEDHN
C=CCOc1ccc(CN2CCCC[C@H]2CC(=O)NCC)cc1OC	ZINC000285079602	455785700	/nfs/dbraw/zinc/78/57/00/455785700.db2.gz	MFVNDLKPXJANSM-KRWDZBQOSA-N	0	3	346.471	3.141	20	30		EGEDHN
C=C(Cl)COc1ccc([C@H](C)NC[C@H]2CC[C@@H](CO)O2)cc1	ZINC000293694812	455794881	/nfs/dbraw/zinc/79/48/81/455794881.db2.gz	LLUZZKYKJCKHFP-XKQJLSEDSA-N	0	3	325.836	3.008	20	30		EGEDHN
COc1ccc(CN(CCOCCC#N)[C@H](C)C2CC2)c(OC)c1	ZINC000294121193	455806349	/nfs/dbraw/zinc/80/63/49/455806349.db2.gz	NICWBOWMTMRIGK-OAHLLOKOSA-N	0	3	332.444	3.235	20	30		EGEDHN
C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)C(C)(C)c1cc(F)cc(C#N)c1	ZINC000285250691	455813095	/nfs/dbraw/zinc/81/30/95/455813095.db2.gz	ZSLZGQNQJXOUKM-CABCVRRESA-N	0	3	345.462	3.212	20	30		EGEDHN
CC[C@@H](NCc1ccc(CS(C)(=O)=O)cc1)c1ccc(C#N)cc1	ZINC000278314997	455814934	/nfs/dbraw/zinc/81/49/34/455814934.db2.gz	UIIFXUATDPPWLB-LJQANCHMSA-N	0	3	342.464	3.344	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N2CCC[C@H]2CN2CCCCC2)cc1	ZINC000294680982	455823455	/nfs/dbraw/zinc/82/34/55/455823455.db2.gz	TXEDGJZRZXAEOT-IBGZPJMESA-N	0	3	340.467	3.179	20	30		EGEDHN
Cc1cc([C@@H](NCC(=O)N[C@@](C)(C#N)C(C)C)C2CC2)ccc1F	ZINC000272059916	455834769	/nfs/dbraw/zinc/83/47/69/455834769.db2.gz	HPVQXFTYEWKTQD-OALUTQOASA-N	0	3	331.435	3.229	20	30		EGEDHN
COC[C@]1(C)CCN(Cc2ccc(OC)c(OCCCC#N)c2)C1	ZINC000295048602	455836521	/nfs/dbraw/zinc/83/65/21/455836521.db2.gz	FMWNDNPLMLKLOR-LJQANCHMSA-N	0	3	332.444	3.236	20	30		EGEDHN
C[C@@H]1[C@H](NC(=O)[C@@]2(C#N)CC23CCCC3)CCN1Cc1ccccc1	ZINC000295302350	455845618	/nfs/dbraw/zinc/84/56/18/455845618.db2.gz	KHNKMOHARWHRRL-BLIXFSHQSA-N	0	3	337.467	3.240	20	30		EGEDHN
Cc1sc(NC(=O)CN[C@](C)(CO)C2CCCCC2)c(C#N)c1C	ZINC000269428826	455847006	/nfs/dbraw/zinc/84/70/06/455847006.db2.gz	KTIOXGDSTPNZSU-GOSISDBHSA-N	0	3	349.500	3.096	20	30		EGEDHN
COc1ccc(CN[C@@H](CO)CC(C)(C)C)cc1OCCCC#N	ZINC000269511838	455849108	/nfs/dbraw/zinc/84/91/08/455849108.db2.gz	OUTSGDGXJZWWLB-MRXNPFEDSA-N	0	3	334.460	3.264	20	30		EGEDHN
C[C@@H](O)C[C@H]1CCCN1CC#Cc1ccc(OC(F)(F)F)cc1	ZINC000269790515	455854301	/nfs/dbraw/zinc/85/43/01/455854301.db2.gz	JHOYSISGXQHOOJ-UKRRQHHQSA-N	0	3	327.346	3.172	20	30		EGEDHN
CCC[C@@]1(NCC(=O)N(CCC#N)c2ccc(C)c(C)c2)CCOC1	ZINC000285484185	455856027	/nfs/dbraw/zinc/85/60/27/455856027.db2.gz	IFVXXCPXCOVLLP-HXUWFJFHSA-N	0	3	343.471	3.099	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)c(Br)c1	ZINC000295878200	455861650	/nfs/dbraw/zinc/86/16/50/455861650.db2.gz	FZMPFUMLQHKHHL-IMJJTQAJSA-N	0	3	347.256	3.368	20	30		EGEDHN
C[C@H](N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O)c1ccc(C#N)cc1	ZINC000272190957	455871832	/nfs/dbraw/zinc/87/18/32/455871832.db2.gz	KHLNIOMSUZXYJE-YWZLYKJASA-N	0	3	344.418	3.276	20	30		EGEDHN
Cn1cc(CN2CCC[C@H](c3ncc[nH]3)C2)c(-c2ccc(C#N)cc2)n1	ZINC000272215836	455879373	/nfs/dbraw/zinc/87/93/73/455879373.db2.gz	BFSKHPTZYUWBTP-KRWDZBQOSA-N	0	3	346.438	3.061	20	30		EGEDHN
C[C@@H](NCCOc1ccccc1C#N)c1ccc(Br)cn1	ZINC000280260783	455930241	/nfs/dbraw/zinc/93/02/41/455930241.db2.gz	CEEQQSAPMAKQNN-GFCCVEGCSA-N	0	3	346.228	3.445	20	30		EGEDHN
Cc1ccc(NC(=O)c2ccc(CC#N)cc2)c(OCCN(C)C)c1	ZINC000270346515	455934183	/nfs/dbraw/zinc/93/41/83/455934183.db2.gz	SMPNNMDVEDEOMV-UHFFFAOYSA-N	0	3	337.423	3.254	20	30		EGEDHN
CC(=O)c1ccc(C#N)c(N2C[C@H]3CN(Cc4ccccc4)C[C@H]3C2)c1	ZINC000280512416	455986535	/nfs/dbraw/zinc/98/65/35/455986535.db2.gz	QCFYWJDJUSOAIE-OYRHEFFESA-N	0	3	345.446	3.329	20	30		EGEDHN
Cc1ccnc(N2CC[C@]3(CCN(Cc4ccccc4)C3)C2)c1C#N	ZINC000286197451	455998161	/nfs/dbraw/zinc/99/81/61/455998161.db2.gz	BMBJTEQIBHRZLL-NRFANRHFSA-N	0	3	332.451	3.364	20	30		EGEDHN
CO[C@H](C)c1nc(CNC(=N)Nc2cc(F)ccc2F)cs1	ZINC000262239406	456015785	/nfs/dbraw/zinc/01/57/85/456015785.db2.gz	BFVBJKZRKKZNCY-MRVPVSSYSA-N	0	3	326.372	3.056	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)N1CC[C@@]2(CCN(Cc3ccccc3)C2)C1	ZINC000286321729	456024639	/nfs/dbraw/zinc/02/46/39/456024639.db2.gz	RBKBNYLKQWFJBU-OAQYLSRUSA-N	0	3	349.434	3.198	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1CN[C@@H](C(=O)N(CC)CC)c1ccccc1	ZINC000280715441	456037661	/nfs/dbraw/zinc/03/76/61/456037661.db2.gz	UKODVGIWKQBFJB-OTWHNJEPSA-N	0	3	330.472	3.167	20	30		EGEDHN
CC[C@@](C)(C#N)C(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000286702970	456051791	/nfs/dbraw/zinc/05/17/91/456051791.db2.gz	HVMJLGLYLAKHON-IBGZPJMESA-N	0	3	329.444	3.430	20	30		EGEDHN
CC(C)OCCN1CCC(Nc2nc3c(cc2C#N)CCCC3)CC1	ZINC000270874650	456057815	/nfs/dbraw/zinc/05/78/15/456057815.db2.gz	CLWABRAHPLVKAC-UHFFFAOYSA-N	0	3	342.487	3.133	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N[C@H]2CCCC2(C)C)cc1	ZINC000287382968	456068267	/nfs/dbraw/zinc/06/82/67/456068267.db2.gz	RRZRLMCTDNENFR-DOMZBBRYSA-N	0	3	349.456	3.073	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N(C)C2CCCCC2)cc1	ZINC000287441599	456069136	/nfs/dbraw/zinc/06/91/36/456069136.db2.gz	WGIMLIWLNHEKNB-ZDUSSCGKSA-N	0	3	349.456	3.169	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cc(C)c(OC)cc2Cl)CC1	ZINC000288709305	456103310	/nfs/dbraw/zinc/10/33/10/456103310.db2.gz	DQNZFFJEFXCNSP-UHFFFAOYSA-N	0	3	337.851	3.429	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H]2CC[C@H](c3cccc(F)c3)C2)CC1	ZINC000281005018	456107215	/nfs/dbraw/zinc/10/72/15/456107215.db2.gz	WFFJKUXIVFACOM-QFBILLFUSA-N	0	3	345.462	3.411	20	30		EGEDHN
CC(C)(C)OC(=O)N1C[C@@H](c2ccccc2)[C@H](NCCCC#N)C1	ZINC000289661206	456135016	/nfs/dbraw/zinc/13/50/16/456135016.db2.gz	FHHOEXNOSHFZLN-DLBZAZTESA-N	0	3	329.444	3.283	20	30		EGEDHN
C=CCN1CC[C@H](N[C@@H](C)c2ccc(OCC(F)(F)F)cc2)C1=O	ZINC000281219570	456169003	/nfs/dbraw/zinc/16/90/03/456169003.db2.gz	OJEJCDJFTZOKBG-WFASDCNBSA-N	0	3	342.361	3.065	20	30		EGEDHN
C=C(C)COc1cc(CNCCN2CCC(C)CC2)ccc1OC	ZINC000237137358	456237568	/nfs/dbraw/zinc/23/75/68/456237568.db2.gz	PZPPGOLVDXNCDJ-UHFFFAOYSA-N	0	3	332.488	3.472	20	30		EGEDHN
C#C[C@H](N[C@H](C)CC(=O)Nc1cc(OC)ccc1OC)C(C)(C)C	ZINC000290157224	456255767	/nfs/dbraw/zinc/25/57/67/456255767.db2.gz	LPDRWYGINRRNAE-DYVFJYSZSA-N	0	3	332.444	3.058	20	30		EGEDHN
CN(CCN(C)C1CC1)c1c(C#N)cnc2c(F)c(F)c(F)cc21	ZINC000342864656	456281299	/nfs/dbraw/zinc/28/12/99/456281299.db2.gz	CBTRJKLEZKLCNH-UHFFFAOYSA-N	0	3	334.345	3.054	20	30		EGEDHN
N#Cc1cccc(OCCCN2CCCC[C@@H]2[C@@H](O)C(F)(F)F)c1	ZINC000340192832	456303761	/nfs/dbraw/zinc/30/37/61/456303761.db2.gz	PYLMLAJDTOQMGM-HZPDHXFCSA-N	0	3	342.361	3.105	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@H]1Nc1ccc([N+](=O)[O-])cc1C#N	ZINC000302183785	456309725	/nfs/dbraw/zinc/30/97/25/456309725.db2.gz	SDESLMVUSSKKPI-IFXJQAMLSA-N	0	3	336.395	3.399	20	30		EGEDHN
Cc1nsc(N(C)CCC2CCN(c3ccncc3)CC2)c1C#N	ZINC000342917544	456312688	/nfs/dbraw/zinc/31/26/88/456312688.db2.gz	NLAUDQLRCZYHBR-UHFFFAOYSA-N	0	3	341.484	3.461	20	30		EGEDHN
CN(CCC(C)(C)C#N)C[C@H](O)c1cccc(Br)c1	ZINC000298025854	456347005	/nfs/dbraw/zinc/34/70/05/456347005.db2.gz	BNVXRDHFOQDXJC-AWEZNQCLSA-N	0	3	325.250	3.354	20	30		EGEDHN
CN(CCC#N)c1ccc(CN[C@]2(CO)CCCc3ccccc32)cc1	ZINC000282196158	456439498	/nfs/dbraw/zinc/43/94/98/456439498.db2.gz	CHNXLPBKIHXFCG-QFIPXVFZSA-N	0	3	349.478	3.350	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)CC23CC4CC(CC(C4)C2)C3)CC1	ZINC000303315034	456455902	/nfs/dbraw/zinc/45/59/02/456455902.db2.gz	PYSJLQOBISEHTQ-UHFFFAOYSA-N	0	3	345.531	3.495	20	30		EGEDHN
N#Cc1ncn(CCNCc2ccc(-c3ccc(Cl)cc3)s2)n1	ZINC000353043774	456458659	/nfs/dbraw/zinc/45/86/59/456458659.db2.gz	CYLBTXOFBWECRK-UHFFFAOYSA-N	0	3	343.843	3.321	20	30		EGEDHN
CCC(CC)(CCO)NCc1cc(C#N)ccc1Br	ZINC000282345978	456484446	/nfs/dbraw/zinc/48/44/46/456484446.db2.gz	CFHIDSBIDSNOHZ-UHFFFAOYSA-N	0	3	325.250	3.352	20	30		EGEDHN
C[C@H](C#N)CSc1ccccc1NC(=O)NCC1=CCN(C)CC1	ZINC000343322166	456531898	/nfs/dbraw/zinc/53/18/98/456531898.db2.gz	ZLKQGBQTWAUBHO-CQSZACIVSA-N	0	3	344.484	3.322	20	30		EGEDHN
COc1ccccc1C(C)(C)NCCC(=O)Nc1ccccc1C#N	ZINC000298755110	456533299	/nfs/dbraw/zinc/53/32/99/456533299.db2.gz	WSRPRXUWEQPSMZ-UHFFFAOYSA-N	0	3	337.423	3.420	20	30		EGEDHN
C[C@H](N[C@@H]1CCN(C(=O)Cc2ccccc2)C1)c1cccc(C#N)c1	ZINC000340622018	456578153	/nfs/dbraw/zinc/57/81/53/456578153.db2.gz	UAHIOBSXZNPMGP-OXJNMPFZSA-N	0	3	333.435	3.052	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@H](NCc1cccc(CN3CCCC3=O)c1)CC2	ZINC000353263499	456597213	/nfs/dbraw/zinc/59/72/13/456597213.db2.gz	JRBQASYUIKUBIS-OAQYLSRUSA-N	0	3	345.446	3.458	20	30		EGEDHN
CC(C)[C@H](NCC(=O)N(CCC#N)CCC#N)c1ccc(Cl)cc1	ZINC000299083592	456601185	/nfs/dbraw/zinc/60/11/85/456601185.db2.gz	IVGJJANUDACLJA-SFHVURJKSA-N	0	3	346.862	3.283	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1CC[C@@H](c2ccc(C)cc2C)C1	ZINC000348306471	456612187	/nfs/dbraw/zinc/61/21/87/456612187.db2.gz	MGQMTJWWTCEJBF-SJLPKXTDSA-N	0	3	327.472	3.101	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)Cc1ccc(Cl)cc1-n1cncn1	ZINC000353375355	456659209	/nfs/dbraw/zinc/65/92/09/456659209.db2.gz	AEEKEHPIYPESMY-UHFFFAOYSA-N	0	3	337.814	3.424	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@@H](NC[C@H]1CN(Cc3ccccc3)CCO1)CC2	ZINC000353426632	456692223	/nfs/dbraw/zinc/69/22/23/456692223.db2.gz	NDZVEKSRKAYRHR-UNMCSNQZSA-N	0	3	347.462	3.036	20	30		EGEDHN
CCOC[C@@H](N[C@H](C)C(=O)Nc1sc2c(c1C#N)CCC2)C(C)C	ZINC000348467730	456701004	/nfs/dbraw/zinc/70/10/04/456701004.db2.gz	JAACMBAQQWFCER-IUODEOHRSA-N	0	3	349.500	3.086	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(C(=O)Nc3ccccc3)C2)s1	ZINC000283115927	456713995	/nfs/dbraw/zinc/71/39/95/456713995.db2.gz	YMBSXMMOOQSAQG-CQSZACIVSA-N	0	3	326.425	3.016	20	30		EGEDHN
C[C@H](NC(=O)N1CCN(C2CCC2)C[C@H](C)C1)c1ccc(C#N)cc1	ZINC000291682675	456720055	/nfs/dbraw/zinc/72/00/55/456720055.db2.gz	RLGRAOAFSQHPQS-HOTGVXAUSA-N	0	3	340.471	3.135	20	30		EGEDHN
CC(C)(C)c1cn2c(n1)CC[C@H](NC(=O)C1CCN(C3CC3)CC1)C2	ZINC000328712099	456742082	/nfs/dbraw/zinc/74/20/82/456742082.db2.gz	CEQGDFMHLPBXDF-HNNXBMFYSA-N	0	3	344.503	3.326	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2cn3c(n2)CCCC3)CN1Cc1ccccc1	ZINC000328714690	456744431	/nfs/dbraw/zinc/74/44/31/456744431.db2.gz	OEWYATMQUJCHCN-WBVHZDCISA-N	0	3	338.455	3.187	20	30		EGEDHN
C=CCOc1ccccc1CN(C)C1CCN(c2cccnn2)CC1	ZINC000353585476	456784024	/nfs/dbraw/zinc/78/40/24/456784024.db2.gz	TVDXPUJJHZYDMN-UHFFFAOYSA-N	0	3	338.455	3.142	20	30		EGEDHN
CCN1CCC[C@@H]1CNc1c(C#N)cnc2c(F)ccc(Cl)c21	ZINC000338389654	456789864	/nfs/dbraw/zinc/78/98/64/456789864.db2.gz	ZHQASXXLAPUEEO-GFCCVEGCSA-N	0	3	332.810	3.217	20	30		EGEDHN
C=C(C)CN1CCC(Nc2nc(N(C)C)cc(C(F)(F)F)n2)CC1	ZINC000301190156	456818041	/nfs/dbraw/zinc/81/80/41/456818041.db2.gz	VVXDOFBPXGRUQB-UHFFFAOYSA-N	0	3	343.397	3.014	20	30		EGEDHN
Cc1ccc([C@H](C)[C@H](O)C(=O)N[C@@H]2CCN(C3CCCC3)C2)cc1	ZINC000329047093	456821285	/nfs/dbraw/zinc/82/12/85/456821285.db2.gz	VHHMTTNSPFZLES-WDYCEAGBSA-N	0	3	330.472	3.433	20	30		EGEDHN
CC(C(=O)Nc1ccnc(OCC(F)(F)C(F)F)c1)C(F)(F)F	ZINC000344529515	456836611	/nfs/dbraw/zinc/83/66/11/456836611.db2.gz	IYDLYZHVCZYNOD-ZCFIWIBFSA-N	0	3	348.218	3.498	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cccc2[nH]c(C)nc21)C(C)C	ZINC000338539480	456837382	/nfs/dbraw/zinc/83/73/82/456837382.db2.gz	JSLXJFVBFNTJPH-SFHVURJKSA-N	0	3	340.471	3.300	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C	ZINC000341463410	456865719	/nfs/dbraw/zinc/86/57/19/456865719.db2.gz	AYXZHXBFPNRWGW-KSZLIROESA-N	0	3	348.512	3.109	20	30		EGEDHN
CCc1nc2n(n1)CCC[C@@H]2NC(=O)[C@@H]1CCCN1C1CCCC1	ZINC000329352946	456877780	/nfs/dbraw/zinc/87/77/80/456877780.db2.gz	FWOACHCOUPKUID-GJZGRUSLSA-N	0	3	331.464	3.039	20	30		EGEDHN
COCCn1cc2c(n1)[C@H](NC(=O)[C@@H](C)N1CCCCCC1)CCC2	ZINC000329379487	456882087	/nfs/dbraw/zinc/88/20/87/456882087.db2.gz	NBNVCTOGFWBYIL-NVXWUHKLSA-N	0	3	348.491	3.128	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)C1C(C)(C)C1(C)C	ZINC000344969139	456882885	/nfs/dbraw/zinc/88/28/85/456882885.db2.gz	IJBYYAVKXQDWHQ-UHFFFAOYSA-N	0	3	327.472	3.131	20	30		EGEDHN
Cc1nnc([C@H]2CCCN([C@@H](C)C(=O)NCc3ccc(C)cc3)C2)[nH]1	ZINC000329491188	456899120	/nfs/dbraw/zinc/89/91/20/456899120.db2.gz	VIDTYDKJTKNAKR-YOEHRIQHSA-N	0	3	341.459	3.146	20	30		EGEDHN
Cc1nn(C(F)F)c(C)c1CC(=O)N[C@@H](C)C1=CCN(C)CC1	ZINC000329528403	456904723	/nfs/dbraw/zinc/90/47/23/456904723.db2.gz	UQJNKULHGCEHIE-JTQLQIEISA-N	0	3	326.391	3.044	20	30		EGEDHN
Cc1cccc(C(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)c1C	ZINC000353800213	456912288	/nfs/dbraw/zinc/91/22/88/456912288.db2.gz	QLYZHTXXZTVKES-UHFFFAOYSA-N	0	3	335.451	3.379	20	30		EGEDHN
Cc1ccccc1CN1CCC(Nc2nccc(C#N)c2Cl)CC1	ZINC000341719242	456913122	/nfs/dbraw/zinc/91/31/22/456913122.db2.gz	BEDCIWUCEZSVRO-UHFFFAOYSA-N	0	3	340.858	3.414	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CN1C(=O)N[C@H](c2cccs2)C1=O)C(C)C	ZINC000349230956	456918170	/nfs/dbraw/zinc/91/81/70/456918170.db2.gz	AJRWBICAEMTNCE-GOEBONIOSA-N	0	3	347.484	3.040	20	30		EGEDHN
C=CCN(CC=C)[C@H](CN1C(=O)N[C@H](c2ccsc2)C1=O)C(C)C	ZINC000349234812	456918806	/nfs/dbraw/zinc/91/88/06/456918806.db2.gz	RBKXFNFETZCVDS-HZPDHXFCSA-N	0	3	347.484	3.040	20	30		EGEDHN
C=CC[C@@H](C)[C@@H](C)[NH2+]Cc1cccc(-c2n[n-]c(C(=O)OCC)n2)c1	ZINC000349254661	456925724	/nfs/dbraw/zinc/92/57/24/456925724.db2.gz	ZYJFWQLKFXKMNV-ZIAGYGMSSA-N	0	3	342.443	3.339	20	30		EGEDHN
C[C@@H](CN1C[C@H](C)C[C@H](C)C1)NC(=O)[C@@H]1CCC(=O)c2cccn21	ZINC000329828593	456947853	/nfs/dbraw/zinc/94/78/53/456947853.db2.gz	DHXYCAGSCUEWKT-IVSAIRAKSA-N	0	3	331.460	3.329	20	30		EGEDHN
CCN(Cc1ccc(C(=O)N(CCC#N)CC2CC2)cc1)C1CC1	ZINC000349403321	456962387	/nfs/dbraw/zinc/96/23/87/456962387.db2.gz	VZNWLRKGWCYZPA-UHFFFAOYSA-N	0	3	325.456	3.437	20	30		EGEDHN
C=CCNC(=O)NC(=O)CN[C@@H](CC(C)C)c1ccc(Cl)cc1	ZINC000341883529	456985614	/nfs/dbraw/zinc/98/56/14/456985614.db2.gz	FCQMYQZAGADZKX-HNNXBMFYSA-N	0	3	337.851	3.029	20	30		EGEDHN
N#Cc1ccccc1OCCN(Cc1ccccc1)CC1(CO)CC1	ZINC000341913236	456999029	/nfs/dbraw/zinc/99/90/29/456999029.db2.gz	IXKBZQDQOLIGNT-UHFFFAOYSA-N	0	3	336.435	3.212	20	30		EGEDHN
COCCN(Cc1ccc(C)o1)C(=O)C(C#N)CCc1ccccc1	ZINC000339232569	457006141	/nfs/dbraw/zinc/00/61/41/457006141.db2.gz	OMPXYGWMESUSBS-SFHVURJKSA-N	0	3	340.423	3.336	20	30		EGEDHN
CCn1ccnc1[C@H]1CCCCN1C(=O)NC[C@H]1CCCCN1CC	ZINC000330280633	457021119	/nfs/dbraw/zinc/02/11/19/457021119.db2.gz	SSNCSNSITJXELC-IAGOWNOFSA-N	0	3	347.507	3.218	20	30		EGEDHN
N#CC(C(=O)c1cncc(F)c1)c1nc2ccccc2n1C(F)F	ZINC000346185603	457023322	/nfs/dbraw/zinc/02/33/22/457023322.db2.gz	HWBUGZUGZZAHGD-NSHDSACASA-N	0	3	330.269	3.456	20	30		EGEDHN
O=C(N[C@@H](CO)CN1CCCCC1)c1cc(Cl)cc(Cl)c1	ZINC000330610225	457060684	/nfs/dbraw/zinc/06/06/84/457060684.db2.gz	OUKSWWHGYQEJOR-CQSZACIVSA-N	0	3	331.243	3.145	20	30		EGEDHN
CCN(CCC#N)C(=O)CN1CC[C@@H](Cc2ccc(C(C)C)cc2)C1	ZINC000359291571	457071992	/nfs/dbraw/zinc/07/19/92/457071992.db2.gz	NOPWXWJMMHNURC-IBGZPJMESA-N	0	3	341.499	3.437	20	30		EGEDHN
CN(C)Cc1cccc(CNC(=O)C[C@@H](CC#N)c2ccccc2)c1	ZINC000354114360	457072301	/nfs/dbraw/zinc/07/23/01/457072301.db2.gz	GIFLUSVHMZJVCR-HXUWFJFHSA-N	0	3	335.451	3.452	20	30		EGEDHN
CC[C@H](C)N[C@H](CNC(=O)c1ccc(CC#N)cc1)c1ccco1	ZINC000359536414	457092872	/nfs/dbraw/zinc/09/28/72/457092872.db2.gz	DYDJYZIQXMNUHI-WMLDXEAASA-N	0	3	325.412	3.205	20	30		EGEDHN
N#Cc1c[nH]c(-c2nc(-c3ccc(OCCN4CCCC4)cc3)no2)c1	ZINC000356687612	457119754	/nfs/dbraw/zinc/11/97/54/457119754.db2.gz	VVYRVNKKUFBSQT-UHFFFAOYSA-N	0	3	349.394	3.078	20	30		EGEDHN
CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1ccc(C#N)s1	ZINC000362992535	457188413	/nfs/dbraw/zinc/18/84/13/457188413.db2.gz	LZUMUJKHZMKZSI-UHFFFAOYSA-N	0	3	349.406	3.102	20	30		EGEDHN
C[C@H](O)[C@@H]1CCN(Cc2cccc(OCc3ccccc3C#N)c2)C1	ZINC000356919814	457219283	/nfs/dbraw/zinc/21/92/83/457219283.db2.gz	SCHJYYYFAUJDNF-QFBILLFUSA-N	0	3	336.435	3.340	20	30		EGEDHN
CC(C)[C@@H](NCc1ccc(C#N)cc1OC(F)F)C1(CO)CCC1	ZINC000339730062	457236419	/nfs/dbraw/zinc/23/64/19/457236419.db2.gz	ZTVSGKIPIDZOOL-MRXNPFEDSA-N	0	3	338.398	3.436	20	30		EGEDHN
CCC[C@H](NC(C)C)C(=O)Nc1nc(C)c(SCC#N)s1	ZINC000351671218	457310666	/nfs/dbraw/zinc/31/06/66/457310666.db2.gz	BZRNACDLPBQYCF-NSHDSACASA-N	0	3	326.491	3.172	20	30		EGEDHN
Cc1ccccc1[C@H]([C@@H](C)NC(=O)N1CCC(F)(C#N)CC1)N(C)C	ZINC000357280612	457418751	/nfs/dbraw/zinc/41/87/51/457418751.db2.gz	HVCBOJSYFOOGIX-WBVHZDCISA-N	0	3	346.450	3.024	20	30		EGEDHN
CC(C)N(C)CC(=O)N(Cc1cccc(C(F)(F)F)c1)[C@@H](C)C#N	ZINC000425085857	457434420	/nfs/dbraw/zinc/43/44/20/457434420.db2.gz	MEYNCDPYCOSIKW-ZDUSSCGKSA-N	0	3	341.377	3.286	20	30		EGEDHN
C=CC[C@@H](C)NC(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000342666502	457441232	/nfs/dbraw/zinc/44/12/32/457441232.db2.gz	UXTQIDHBUVQZIL-OAHLLOKOSA-N	0	3	325.522	3.002	20	30		EGEDHN
Cc1ccc(C(=O)N2C[C@@H]3CCCN3Cc3ccccc32)cc1C#N	ZINC000374150569	457498195	/nfs/dbraw/zinc/49/81/95/457498195.db2.gz	ZDGLACLMXXOXLL-IBGZPJMESA-N	0	3	331.419	3.492	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Nc1ccc(OC)nc1C)C(C)C	ZINC000347583819	457527335	/nfs/dbraw/zinc/52/73/35/457527335.db2.gz	BIOWMLDDGSKKMH-KRWDZBQOSA-N	0	3	346.475	3.219	20	30		EGEDHN
C=CCN(CCC(=O)Nc1sccc1C#N)CCc1ccco1	ZINC000352701202	457541937	/nfs/dbraw/zinc/54/19/37/457541937.db2.gz	GDYLMDMDJYLATE-UHFFFAOYSA-N	0	3	329.425	3.272	20	30		EGEDHN
COc1ccc(C#N)cc1CN1CC2(CCC2)[C@@H]1C1CCOCC1	ZINC000425559202	457600386	/nfs/dbraw/zinc/60/03/86/457600386.db2.gz	YVKCPGOLCVSEPH-IBGZPJMESA-N	0	3	326.440	3.348	20	30		EGEDHN
C[C@H](NC(C)(C)CNC(=O)N[C@@H]1CC[C@H](C#N)C1)c1ccccc1	ZINC000425680351	457629119	/nfs/dbraw/zinc/62/91/19/457629119.db2.gz	ZBFMKOPAYZFJMB-YQQAZPJKSA-N	0	3	328.460	3.107	20	30		EGEDHN
CC(C#N)C(=O)N1CCCC[C@@H]1c1nc(-c2cccc(F)c2)c[nH]1	ZINC000357802461	457695121	/nfs/dbraw/zinc/69/51/21/457695121.db2.gz	KMEYZSPYCFSMRV-BLLLJJGKSA-N	0	3	326.375	3.429	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H]2CCc3sc(Cl)cc32)CC1	ZINC000357955369	457733508	/nfs/dbraw/zinc/73/35/08/457733508.db2.gz	IMPBUBZUZIUTRK-ZDUSSCGKSA-N	0	3	339.892	3.338	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000457572952	457750298	/nfs/dbraw/zinc/75/02/98/457750298.db2.gz	RTNJBDPVXLOBDZ-UFYCRDLUSA-N	0	3	342.483	3.139	20	30		EGEDHN
C[C@@H](C(=O)N(C)CCC#N)N1CCC(C)(c2cccc(Cl)c2)CC1	ZINC000361544146	457783680	/nfs/dbraw/zinc/78/36/80/457783680.db2.gz	SHBZGWBYTJZILO-HNNXBMFYSA-N	0	3	347.890	3.454	20	30		EGEDHN
C[C@@H]1CCCC[C@@H]1OCCNC(=O)C(C#N)CCc1ccccc1	ZINC000433225227	457784483	/nfs/dbraw/zinc/78/44/83/457784483.db2.gz	APBADBONXLNULG-QRQLOZEOSA-N	0	3	328.456	3.470	20	30		EGEDHN
CN(C)[C@H](CC(=O)N(CCC#N)Cc1cccnc1)c1ccccc1	ZINC000433318983	457809934	/nfs/dbraw/zinc/80/99/34/457809934.db2.gz	PUGARGYXXWCNPR-LJQANCHMSA-N	0	3	336.439	3.017	20	30		EGEDHN
Cc1cc(CN[C@@H]2CC(=O)N([C@H]3C[C@H]3c3ccccc3)C2)ccc1C#N	ZINC000443981744	457832571	/nfs/dbraw/zinc/83/25/71/457832571.db2.gz	BNNDJYKLBLQYRU-HKBOAZHASA-N	0	3	345.446	3.113	20	30		EGEDHN
Cc1ccc2cc(CN3CC[C@H](Oc4ccc(C#N)cn4)C3)ccc2n1	ZINC000366513814	457835531	/nfs/dbraw/zinc/83/55/31/457835531.db2.gz	BYPGZKRIDCWKQL-IBGZPJMESA-N	0	3	344.418	3.463	20	30		EGEDHN
COc1cc(CCNC(=O)C(C#N)CCc2ccccc2)ccc1C	ZINC000433485319	457840648	/nfs/dbraw/zinc/84/06/48/457840648.db2.gz	YWSLQYWLAAHDHZ-IBGZPJMESA-N	0	3	336.435	3.435	20	30		EGEDHN
CN(CCC1(C#N)CCCCC1)C[C@@H](O)COCc1ccccc1	ZINC000411264743	457844930	/nfs/dbraw/zinc/84/49/30/457844930.db2.gz	MQAXKTXGSLEODN-LJQANCHMSA-N	0	3	330.472	3.360	20	30		EGEDHN
N#Cc1ccc(OCCN[C@H](Cc2ccccn2)c2cccnc2)cc1	ZINC000358211913	457862827	/nfs/dbraw/zinc/86/28/27/457862827.db2.gz	ZXYIAKYLYMESPZ-OAQYLSRUSA-N	0	3	344.418	3.301	20	30		EGEDHN
N#CC1(CCN2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)CCCCC1	ZINC000411371961	457868419	/nfs/dbraw/zinc/86/84/19/457868419.db2.gz	BJRJFCQYGHPKKH-HNNXBMFYSA-N	0	3	343.431	3.340	20	30		EGEDHN
C=CCN(CCC(=O)Nc1cccnc1)Cc1ccc(OC)cc1	ZINC000358279344	457905524	/nfs/dbraw/zinc/90/55/24/457905524.db2.gz	SPKYLSWCGBNLMR-UHFFFAOYSA-N	0	3	325.412	3.107	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN[C@]2(CO)CCCc3ccccc32)cc1	ZINC000366921355	457910590	/nfs/dbraw/zinc/91/05/90/457910590.db2.gz	KNCXDKQLXRUJLM-IERDGZPVSA-N	0	3	336.435	3.291	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN1CC[C@H](N2CCCC2)C1	ZINC000371517024	457970334	/nfs/dbraw/zinc/97/03/34/457970334.db2.gz	INQGAQLODMKGRU-INIZCTEOSA-N	0	3	345.512	3.073	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CC(CC)(c3ccccc3)C2)CC1	ZINC000458319868	458012091	/nfs/dbraw/zinc/01/20/91/458012091.db2.gz	LRVMSPSNMBRKSE-UHFFFAOYSA-N	0	3	341.499	3.400	20	30		EGEDHN
C=C[C@@H]1CCCCN1C(=O)C(=O)Nc1cccc(CN(CC)CC)c1	ZINC000427663792	458018136	/nfs/dbraw/zinc/01/81/36/458018136.db2.gz	POYKLUGONYEEEM-GOSISDBHSA-N	0	3	343.471	3.034	20	30		EGEDHN
CC1(C)CCN([C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)CCS1	ZINC000434690558	458037751	/nfs/dbraw/zinc/03/77/51/458037751.db2.gz	ICZKQUMDCRKJRH-QGZVFWFLSA-N	0	3	343.496	3.271	20	30		EGEDHN
C[C@@H]1[C@@H](CO)CCCN1CC#Cc1ccc(OC(F)(F)F)cc1	ZINC000412095276	458088602	/nfs/dbraw/zinc/08/86/02/458088602.db2.gz	SZLSVKFQRNPULO-UKRRQHHQSA-N	0	3	327.346	3.030	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N[C@H](C)c1cccc(O)c1)C(C)C	ZINC000428489730	458157813	/nfs/dbraw/zinc/15/78/13/458157813.db2.gz	WWKGPXRPOXNDRG-VQIMIIECSA-N	0	3	345.487	3.451	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1CNC(=O)c1cccc(CN2CCCCC2)c1	ZINC000412306949	458161355	/nfs/dbraw/zinc/16/13/55/458161355.db2.gz	GGVWLFYSRAIQST-PMACEKPBSA-N	0	3	342.483	3.384	20	30		EGEDHN
N#CC[C@@H](CC(=O)N1CCCN(CC2CCC2)CC1)c1ccccc1	ZINC000412319807	458166769	/nfs/dbraw/zinc/16/67/69/458166769.db2.gz	UPXBFVYIVPOJTQ-FQEVSTJZSA-N	0	3	339.483	3.408	20	30		EGEDHN
COc1ccc([C@@H](CCn2cncn2)NCc2cccc(C#N)c2)cc1	ZINC000446746210	458224449	/nfs/dbraw/zinc/22/44/49/458224449.db2.gz	STKFHHHNFWJHTJ-HXUWFJFHSA-N	0	3	347.422	3.080	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN2CCN([C@@H]3C[C@@H]3C)C[C@@H](C)C2)c1C	ZINC000429033528	458262630	/nfs/dbraw/zinc/26/26/30/458262630.db2.gz	ZLKDQRMGHGBHCB-TWOQFEAHSA-N	0	3	343.515	3.136	20	30		EGEDHN
N#CCc1ccc(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)cc1	ZINC000372291436	458266124	/nfs/dbraw/zinc/26/61/24/458266124.db2.gz	KVIPEHCMPHUVKQ-HXUWFJFHSA-N	0	3	347.462	3.395	20	30		EGEDHN
CC(C)[C@@]1(C)C[C@@H]1NC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000459248368	458300454	/nfs/dbraw/zinc/30/04/54/458300454.db2.gz	MLIJBNFFZDUGHX-AZUAARDMSA-N	0	3	342.487	3.066	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NC(=O)N[C@@H](C)C1=CCN(C)CC1	ZINC000413439488	458301523	/nfs/dbraw/zinc/30/15/23/458301523.db2.gz	KAPAINJVJYMAJW-QFBILLFUSA-N	0	3	327.472	3.123	20	30		EGEDHN
CC[S@](=O)[C@H]1CCC[C@@H](NC2CC(C#N)(c3ccccc3)C2)C1	ZINC000372461775	458303046	/nfs/dbraw/zinc/30/30/46/458303046.db2.gz	DUSQDIZEOHFUDQ-UNOVPIDPSA-N	0	3	330.497	3.280	20	30		EGEDHN
Cc1ccc([C@H]2CCC[C@H]2N(C)CC(=O)NC2(C#N)CCC2)cc1	ZINC000372613596	458308279	/nfs/dbraw/zinc/30/82/79/458308279.db2.gz	ZQXKZDOOBWBMAD-QZTJIDSGSA-N	0	3	325.456	3.125	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NC(=O)N(C)[C@H]1CCN(C)C[C@@H]1C	ZINC000413834745	458309782	/nfs/dbraw/zinc/30/97/82/458309782.db2.gz	MLCDQABEAFZAJX-UHOSZYNNSA-N	0	3	329.488	3.155	20	30		EGEDHN
CN(CCC#N)C[C@H](O)CN1CC2(CCCCC2)[C@@H]1c1ccccc1	ZINC000414135673	458315342	/nfs/dbraw/zinc/31/53/42/458315342.db2.gz	DOGKVSJRCAPJHO-PMACEKPBSA-N	0	3	341.499	3.200	20	30		EGEDHN
CCS(=O)(=O)c1cc(Cl)cc(CN[C@@H]2CCC[C@H](C#N)C2)c1	ZINC000414206510	458315824	/nfs/dbraw/zinc/31/58/24/458315824.db2.gz	FPFJNLKKBQRJNP-SWLSCSKDSA-N	0	3	340.876	3.306	20	30		EGEDHN
CN(CC(C)(C)C#N)C(=O)Nc1cc(CN)cc(C(F)(F)F)c1	ZINC000415961364	458335451	/nfs/dbraw/zinc/33/54/51/458335451.db2.gz	DBRRKIYQZFNDHP-UHFFFAOYSA-N	0	3	328.338	3.178	20	30		EGEDHN
C[C@H](C(=O)N[C@H]1CCCc2cc(C#N)ccc21)N1[C@H](C)CC[C@@H]1C	ZINC000416343334	458342453	/nfs/dbraw/zinc/34/24/53/458342453.db2.gz	RLALXVTWBDGDPQ-GJRWTSMGSA-N	0	3	325.456	3.313	20	30		EGEDHN
C=CCN(C)CCN(CC)Cc1nnc(-c2ccc(Cl)cc2)o1	ZINC000429718941	458363409	/nfs/dbraw/zinc/36/34/09/458363409.db2.gz	NNHLQPPFRSVOBV-UHFFFAOYSA-N	0	3	334.851	3.330	20	30		EGEDHN
C=C(C)CN(CC)C(=O)Nc1ccc(OCCN(C)C)c(OC)c1	ZINC000417653203	458366799	/nfs/dbraw/zinc/36/67/99/458366799.db2.gz	QJYHBARYSGIGGW-UHFFFAOYSA-N	0	3	335.448	3.066	20	30		EGEDHN
CO[C@@H](CNCc1cn(CCC#N)nc1-c1ccncc1)CC(C)C	ZINC000418088296	458371807	/nfs/dbraw/zinc/37/18/07/458371807.db2.gz	ACMCBEYONJKUJP-GOSISDBHSA-N	0	3	341.459	3.009	20	30		EGEDHN
C[C@H](C(=O)N(CCC#N)c1ccc(F)cc1)N1C[C@@H](C)[C@@H](C)[C@@H]1C	ZINC000419376527	458381705	/nfs/dbraw/zinc/38/17/05/458381705.db2.gz	TYPBAFCIJNEVFK-LVQVYYBASA-N	0	3	331.435	3.437	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@H](CC(F)(F)F)C2)CC1	ZINC000420912669	458404702	/nfs/dbraw/zinc/40/47/02/458404702.db2.gz	IQRWWCBKWXEYCO-CYBMUJFWSA-N	0	3	333.398	3.011	20	30		EGEDHN
COc1cccc(CN(CCN(C)C)Cc2ccc(C#N)c(F)c2)c1	ZINC000421353567	458411934	/nfs/dbraw/zinc/41/19/34/458411934.db2.gz	GGSMPEXNAQFNJN-UHFFFAOYSA-N	0	3	341.430	3.270	20	30		EGEDHN
COc1ccc([C@H](C)CN2CC[C@@H](Oc3ccc(C#N)cn3)C2)cc1	ZINC000430153555	458412281	/nfs/dbraw/zinc/41/22/81/458412281.db2.gz	FAXZFKMJJCAADC-DNVCBOLYSA-N	0	3	337.423	3.219	20	30		EGEDHN
CC[C@@H](CS(=O)(=O)c1ccccc1)NC1CCC(C)(C#N)CC1	ZINC000449196038	458420464	/nfs/dbraw/zinc/42/04/64/458420464.db2.gz	WLAHXXJYBTVZJI-HJOIGYKYSA-N	0	3	334.485	3.301	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(OC)c(SC)c2)CC1	ZINC000459652637	458436432	/nfs/dbraw/zinc/43/64/32/458436432.db2.gz	USNDVWLVTYGFLL-UHFFFAOYSA-N	0	3	335.473	3.189	20	30		EGEDHN
CN1CCC(N(Cc2ccco2)C(=O)NCC(C)(C)CCC#N)CC1	ZINC000377044845	458448781	/nfs/dbraw/zinc/44/87/81/458448781.db2.gz	RBDDLJZZWYSMEP-UHFFFAOYSA-N	0	3	346.475	3.215	20	30		EGEDHN
CN(C)CCN(c1ncc(Br)cc1C#N)C1CCCC1	ZINC000450499793	458450330	/nfs/dbraw/zinc/45/03/30/458450330.db2.gz	KZWVDYYZBSGOOI-UHFFFAOYSA-N	0	3	337.265	3.026	20	30		EGEDHN
CO[C@@H](C)c1nc(CN2CCCN(CCCCC#N)CC2)cs1	ZINC000437542720	458465554	/nfs/dbraw/zinc/46/55/54/458465554.db2.gz	UUYBHIYZXCLGTE-HNNXBMFYSA-N	0	3	336.505	3.052	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)c2ccc(C#N)s2)CCN1Cc1ccccc1	ZINC000430662528	458476480	/nfs/dbraw/zinc/47/64/80/458476480.db2.gz	JRDJHUYAWOUEDV-HOCLYGCPSA-N	0	3	339.464	3.403	20	30		EGEDHN
CC[C@@H]1OCC[C@H]1NCC(=O)Nc1ccccc1SC[C@H](C)C#N	ZINC000459776927	458477005	/nfs/dbraw/zinc/47/70/05/458477005.db2.gz	NJPBSMFAOJDBLJ-FMKPAKJESA-N	0	3	347.484	3.034	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@H]1C[C@@H](OC)C1(C)C	ZINC000451490507	458478631	/nfs/dbraw/zinc/47/86/31/458478631.db2.gz	IDAOWFWJCVSTFQ-JKSUJKDBSA-N	0	3	334.485	3.306	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCC(=O)N(c1ccccc1)C1CCCCC1	ZINC000451609765	458483220	/nfs/dbraw/zinc/48/32/20/458483220.db2.gz	WCWRPCAAIJQRBS-MOPGFXCFSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC#Cc1ccc(OC(F)(F)F)cc1	ZINC000451683007	458485103	/nfs/dbraw/zinc/48/51/03/458485103.db2.gz	QMHYPVMDPHWMSZ-CVEARBPZSA-N	0	3	325.330	3.260	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N1CCC(F)(F)[C@@H](C)C1)C(C)C	ZINC000460129946	458501518	/nfs/dbraw/zinc/50/15/18/458501518.db2.gz	WTNIPSOCVFEADG-HOTGVXAUSA-N	0	3	343.462	3.372	20	30		EGEDHN
C=C(C)Cn1c(C2CCC2)nnc1N1CCN([C@@H]2C[C@@H]2C)C[C@H](C)C1	ZINC000453449741	458530657	/nfs/dbraw/zinc/53/06/57/458530657.db2.gz	FSTKULDOIPSUNO-XYJFISCASA-N	0	3	343.519	3.288	20	30		EGEDHN
CN1CCC2(CCCN2C(=O)C[C@@H](CC#N)c2ccccc2)CC1	ZINC000373573813	458537179	/nfs/dbraw/zinc/53/71/79/458537179.db2.gz	OLOYSHMWKLCILX-GOSISDBHSA-N	0	3	325.456	3.161	20	30		EGEDHN
CC(C)C1CCC(N2CCN(C(=O)NCC3(CC#N)CC3)CC2)CC1	ZINC000431188671	458542420	/nfs/dbraw/zinc/54/24/20/458542420.db2.gz	XKJSPBGXBSORJD-UHFFFAOYSA-N	0	3	346.519	3.222	20	30		EGEDHN
CCCOc1ccc(C(F)(F)F)cc1NC(=O)[C@@H](N)CCCC#N	ZINC000424080689	458553497	/nfs/dbraw/zinc/55/34/97/458553497.db2.gz	TYGFINURWIVTGU-LBPRGKRZSA-N	0	3	343.349	3.454	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N[C@@H](CCc1ccccc1)c1ccccc1	ZINC000424086314	458555626	/nfs/dbraw/zinc/55/56/26/458555626.db2.gz	BUNPJXGQHVELQF-UXHICEINSA-N	0	3	335.451	3.498	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)NCC1(c2ccccc2)CCCCCC1	ZINC000424117479	458561940	/nfs/dbraw/zinc/56/19/40/458561940.db2.gz	YXYDCZGYMYERMC-SFHVURJKSA-N	0	3	327.472	3.416	20	30		EGEDHN
Cc1ccc(CNC(=O)[C@@H](N)CCCC#N)c(OCCC(C)C)c1	ZINC000424126710	458565282	/nfs/dbraw/zinc/56/52/82/458565282.db2.gz	PQDXMDFSMGOTDA-KRWDZBQOSA-N	0	3	331.460	3.057	20	30		EGEDHN
C=CC(C)(C)CNC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000454623959	458568700	/nfs/dbraw/zinc/56/87/00/458568700.db2.gz	SABGNAGUASYLMQ-SJLPKXTDSA-N	0	3	329.488	3.408	20	30		EGEDHN
C=CCC[C@H](NC[C@]1(N2CCOCC2)CCSC1)c1ccco1	ZINC000373700956	458577182	/nfs/dbraw/zinc/57/71/82/458577182.db2.gz	PFBMMKCEXQLPAF-FUHWJXTLSA-N	0	3	336.501	3.084	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N1CCC(F)(c2cccc(Cl)c2)CC1	ZINC000424188656	458580071	/nfs/dbraw/zinc/58/00/71/458580071.db2.gz	YJSPSJDVKTVLCB-HNNXBMFYSA-N	0	3	337.826	3.148	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CCCS2)nnc1N1CCN(C)[C@H](C(C)C)C1	ZINC000424232157	458588869	/nfs/dbraw/zinc/58/88/69/458588869.db2.gz	BUIRPSNZWQBNQK-JKSUJKDBSA-N	0	3	349.548	3.199	20	30		EGEDHN
CC[C@H](CN(CC)[C@@H](C)C(=O)NC1(C#N)CCC1)c1ccccc1	ZINC000469790534	458591812	/nfs/dbraw/zinc/59/18/12/458591812.db2.gz	KKVNUEYKGABZIS-DLBZAZTESA-N	0	3	327.472	3.453	20	30		EGEDHN
C[C@H]1C[C@H](CNC(=O)OC(C)(C)C)CN1Cc1cccc(C#N)c1	ZINC000493988828	458611943	/nfs/dbraw/zinc/61/19/43/458611943.db2.gz	LOYVTGZAZQBDDI-WMLDXEAASA-N	0	3	329.444	3.293	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)NC[C@H]1CCCCN1C1CC1	ZINC000470165741	458619756	/nfs/dbraw/zinc/61/97/56/458619756.db2.gz	BBMCUXIMVCRSNB-MRXNPFEDSA-N	0	3	344.455	3.007	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(Br)c(C)s2)CC1	ZINC000424655280	458696008	/nfs/dbraw/zinc/69/60/08/458696008.db2.gz	VWQWGLAFZHECRM-UHFFFAOYSA-N	0	3	343.290	3.199	20	30		EGEDHN
C#CC[C@@H](C)N[C@H](C)c1ccc(CNC(=O)OC(C)(C)C)nc1C	ZINC000494556684	458697862	/nfs/dbraw/zinc/69/78/62/458697862.db2.gz	XXXQRRGMMXQRHN-ZIAGYGMSSA-N	0	3	331.460	3.477	20	30		EGEDHN
CC1(C)C[C@H](NC[C@@H](O)COc2ccccc2C#N)c2ccccc21	ZINC000530233642	458725643	/nfs/dbraw/zinc/72/56/43/458725643.db2.gz	ZMAAGKBSIJQGOK-APWZRJJASA-N	0	3	336.435	3.310	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cccc([N+](=O)[O-])c1C)C(C)C	ZINC000503979439	458734435	/nfs/dbraw/zinc/73/44/35/458734435.db2.gz	JLHDDMRQVSUQON-SFHVURJKSA-N	0	3	345.443	3.332	20	30		EGEDHN
Cc1cc([C@@H](N[C@H](C)C(=O)NC2(C#N)CCC2)C2CC2)ccc1F	ZINC000530337017	458751147	/nfs/dbraw/zinc/75/11/47/458751147.db2.gz	ZYJJSCRWZVFAPC-DYVFJYSZSA-N	0	3	329.419	3.126	20	30		EGEDHN
Cc1cc(C)cc(N(CCC#N)C(=O)[C@H](C)N[C@H]2CSC[C@@H]2C)c1	ZINC000507252138	458754353	/nfs/dbraw/zinc/75/43/53/458754353.db2.gz	LTAFDEVUAZDGHA-BQFCYCMXSA-N	0	3	345.512	3.280	20	30		EGEDHN
C=CCNC(=O)C(C)S(=O)(=O)Cc1ccc(C2CCCCC2)cc1	ZINC000507833998	458755844	/nfs/dbraw/zinc/75/58/44/458755844.db2.gz	NTSYVXMAMIKDFN-OAHLLOKOSA-N	0	3	349.496	3.340	20	30		EGEDHN
C=CCn1c(-c2sccc2C)nnc1N1CCN(C)[C@H](C(C)C)C1	ZINC000508897321	458767117	/nfs/dbraw/zinc/76/71/17/458767117.db2.gz	WSFVKRJPODNNNN-HNNXBMFYSA-N	0	3	345.516	3.277	20	30		EGEDHN
C=CCn1c(-c2ccccc2)nnc1N1CCN(C2CCCC2)CC1	ZINC000508938154	458768437	/nfs/dbraw/zinc/76/84/37/458768437.db2.gz	HGVXZJSNLZMGIK-UHFFFAOYSA-N	0	3	337.471	3.196	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCCc2cc3ccccc3o2)cc1	ZINC000472209207	458774310	/nfs/dbraw/zinc/77/43/10/458774310.db2.gz	UAQQZUYISHQYFS-GOSISDBHSA-N	0	3	343.386	3.346	20	30		EGEDHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@H](C#N)CCc1ccccc1	ZINC000495003343	458781095	/nfs/dbraw/zinc/78/10/95/458781095.db2.gz	HSLOOJDAHJFRFL-NQIIRXRSSA-N	0	3	349.478	3.396	20	30		EGEDHN
CC(C)(CCc1ccccc1)NCC(=O)NCc1cccc(C#N)c1	ZINC000464879963	458788344	/nfs/dbraw/zinc/78/83/44/458788344.db2.gz	RNZJBGXVHYWNRT-UHFFFAOYSA-N	0	3	335.451	3.175	20	30		EGEDHN
C[C@@H]1[C@H](Nc2ccc(Cl)c(C#N)n2)CCN1Cc1ccccc1	ZINC000516506425	458818941	/nfs/dbraw/zinc/81/89/41/458818941.db2.gz	CWYGCGWOZQBRLW-CZUORRHYSA-N	0	3	326.831	3.103	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H]2CCN(c3ccccc3)[C@@H]2C)CC1	ZINC000473571808	458835930	/nfs/dbraw/zinc/83/59/30/458835930.db2.gz	VMLNVNGGGKSBOS-XLIONFOSSA-N	0	3	341.499	3.058	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCCC[C@H]2Cc2ccccc2)CC1	ZINC000518024200	458838064	/nfs/dbraw/zinc/83/80/64/458838064.db2.gz	XXTLNNXEXIYNEG-FQEVSTJZSA-N	0	3	341.499	3.444	20	30		EGEDHN
C=C(C)Cn1c(CC(C)(C)C)nnc1N1CCN(CC(C)C)CC1	ZINC000549644034	458881648	/nfs/dbraw/zinc/88/16/48/458881648.db2.gz	DCTFAONIGRORMO-UHFFFAOYSA-N	0	3	333.524	3.221	20	30		EGEDHN
CC(C)N(CCC#N)C(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F	ZINC000552063418	458890377	/nfs/dbraw/zinc/89/03/77/458890377.db2.gz	IZERUHONGPXRKZ-KRWDZBQOSA-N	0	3	349.425	3.294	20	30		EGEDHN
C=C(C)Cn1c(CC2CCCC2)nnc1N1CCN(CC2CC2)CC1	ZINC000555270628	458905338	/nfs/dbraw/zinc/90/53/38/458905338.db2.gz	DSGFGNSMVKSHAD-UHFFFAOYSA-N	0	3	343.519	3.119	20	30		EGEDHN
C[C@H]1CCC[C@H]1CNC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000466718797	458914680	/nfs/dbraw/zinc/91/46/80/458914680.db2.gz	JLUPMYQJCZEVCU-LPHOPBHVSA-N	0	3	342.487	3.068	20	30		EGEDHN
C=C(C)Cn1c(CC2CC2)nnc1N1CCN(CCC(C)(C)C)CC1	ZINC000576831632	458930496	/nfs/dbraw/zinc/93/04/96/458930496.db2.gz	NXHJBUWWUAVRIP-UHFFFAOYSA-N	0	3	345.535	3.365	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCC(C)(C)c2ccc(F)cc2)CC1	ZINC000519282816	458931026	/nfs/dbraw/zinc/93/10/26/458931026.db2.gz	SIVIFLJGZJVDIL-UHFFFAOYSA-N	0	3	347.478	3.443	20	30		EGEDHN
C[C@H](C1CC1)N(Cc1ccccc1)Cc1cnc2c(C#N)cnn2c1	ZINC000576943702	458952827	/nfs/dbraw/zinc/95/28/27/458952827.db2.gz	SRPMPPDEDKHFFK-OAHLLOKOSA-N	0	3	331.423	3.402	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N[C@@]1(C)CCN(Cc2ccccc2)C1)OCC	ZINC000519757551	458999110	/nfs/dbraw/zinc/99/91/10/458999110.db2.gz	IMCBKOKNWDLWBY-ICSRJNTNSA-N	0	3	330.472	3.139	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CC(C)(C)[C@@H]1[C@H]1CCCO1	ZINC000577307208	459013443	/nfs/dbraw/zinc/01/34/43/459013443.db2.gz	KDHQFZYFVCQOGP-RLLQIKCJSA-N	0	3	345.483	3.044	20	30		EGEDHN
Cc1c(C#N)cccc1NC(=O)N1CCN(C2CCC2)C[C@H](C)C1	ZINC000577453179	459033276	/nfs/dbraw/zinc/03/32/76/459033276.db2.gz	KSUIUSZOTSGQKN-AWEZNQCLSA-N	0	3	326.444	3.205	20	30		EGEDHN
C=CC1CCN(CC(=O)NCCc2ccc(OC(C)C)cc2)CC1	ZINC000532415237	459083625	/nfs/dbraw/zinc/08/36/25/459083625.db2.gz	UDTZWTBGQWZFSW-UHFFFAOYSA-N	0	3	330.472	3.031	20	30		EGEDHN
CCC(CC)Nc1ccncc1NC(=O)c1ccc(F)c(C#N)c1	ZINC000567313316	459083924	/nfs/dbraw/zinc/08/39/24/459083924.db2.gz	XLZSVLRPVUUOGX-UHFFFAOYSA-N	0	3	326.375	3.367	20	30		EGEDHN
Cc1cc(N(C)CCC2CCN(c3ccncc3)CC2)cc(C#N)n1	ZINC000557647879	459094724	/nfs/dbraw/zinc/09/47/24/459094724.db2.gz	SELWSBDBPDHQIL-UHFFFAOYSA-N	0	3	335.455	3.400	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CC2(CCOCC2)[C@@H]1C1CC1	ZINC000520871296	459102354	/nfs/dbraw/zinc/10/23/54/459102354.db2.gz	FNAMHZVHCCPRCI-MOPGFXCFSA-N	0	3	338.451	3.177	20	30		EGEDHN
N#Cc1cc(Br)cnc1N[C@@H]1CCCN2CCCC[C@@H]12	ZINC000594601869	459106315	/nfs/dbraw/zinc/10/63/15/459106315.db2.gz	PFHICTBWPRPUPE-KGLIPLIRSA-N	0	3	335.249	3.145	20	30		EGEDHN
C=CCN(CC=C)[C@H](CN1C(=O)N2CCC[C@@]2(CCC)C1=O)C(C)C	ZINC000479008053	459118008	/nfs/dbraw/zinc/11/80/08/459118008.db2.gz	VOVIBINRKHJPCV-XLIONFOSSA-N	0	3	347.503	3.282	20	30		EGEDHN
N#CCSCCCN1CCCC[C@@H]1COC(=O)NC1CCCC1	ZINC000496263568	459129084	/nfs/dbraw/zinc/12/90/84/459129084.db2.gz	KRSLXULKFFYCPK-MRXNPFEDSA-N	0	3	339.505	3.157	20	30		EGEDHN
C=CCNC(=O)CN[C@H]1CC(C)(C)c2ccc(Br)cc21	ZINC000479414707	459139345	/nfs/dbraw/zinc/13/93/45/459139345.db2.gz	FVMOTFYEAZNLKN-AWEZNQCLSA-N	0	3	337.261	3.063	20	30		EGEDHN
C=CCC1(CNCCS(=O)(=O)c2ccc(F)cc2)CCCC1	ZINC000567696051	459148367	/nfs/dbraw/zinc/14/83/67/459148367.db2.gz	OKRGRUMUARPFKH-UHFFFAOYSA-N	0	3	325.449	3.326	20	30		EGEDHN
Cc1ccc(C)c(OC[C@H](O)CNCc2ccc(C#N)c(F)c2)c1C	ZINC000567698097	459148385	/nfs/dbraw/zinc/14/83/85/459148385.db2.gz	ZWOXRWFOIPAUFS-GOSISDBHSA-N	0	3	342.414	3.152	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@]2(CCN([C@@H]3CC[C@@H](C#N)C3)C2)C1	ZINC000496375907	459170263	/nfs/dbraw/zinc/17/02/63/459170263.db2.gz	AWHRLDCFCCNTJX-GPMSIDNRSA-N	0	3	333.476	3.402	20	30		EGEDHN
COc1cc(C)ccc1CNC1CCN(c2ccc(C#N)cn2)CC1	ZINC000590644752	459170903	/nfs/dbraw/zinc/17/09/03/459170903.db2.gz	WKRTVXPNHMDVQR-UHFFFAOYSA-N	0	3	336.439	3.029	20	30		EGEDHN
C[S@](=O)[C@H]1CCC[C@@H](NCc2cccc(OCCCC#N)c2)C1	ZINC000594962111	459194753	/nfs/dbraw/zinc/19/47/53/459194753.db2.gz	PSQNHNQQYXYFCE-QSAZIKIQSA-N	0	3	334.485	3.148	20	30		EGEDHN
C=CCOCCN[C@H](C)c1ccc(F)c(I)c1	ZINC000590778552	459214019	/nfs/dbraw/zinc/21/40/19/459214019.db2.gz	PBKXUGVARUKVFK-SNVBAGLBSA-N	0	3	349.187	3.284	20	30		EGEDHN
N#CCc1ccc(OC[C@H](O)CN[C@H](c2cccs2)C2CC2)cc1	ZINC000578538094	459220044	/nfs/dbraw/zinc/22/00/44/459220044.db2.gz	LNYNYQRNAIOIOE-APWZRJJASA-N	0	3	342.464	3.295	20	30		EGEDHN
N#CCCCN[C@@H]1CCc2ccc(I)cc21	ZINC000595034338	459223421	/nfs/dbraw/zinc/22/34/21/459223421.db2.gz	VKKLOBMIQCKCKU-CYBMUJFWSA-N	0	3	326.181	3.172	20	30		EGEDHN
C[C@H](COc1cccc(F)c1)NC(=O)C(C#N)CCc1ccccc1	ZINC000559279085	459249286	/nfs/dbraw/zinc/24/92/86/459249286.db2.gz	OOJWUUSPCSYEGN-WBVHZDCISA-N	0	3	340.398	3.482	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1N[C@H](C)C(=O)N[C@H](C)c1cccc2ccccc21	ZINC000579917352	459253503	/nfs/dbraw/zinc/25/35/03/459253503.db2.gz	UEFXVUOTUFEETR-IONDEXAJSA-N	0	3	338.451	3.339	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@H]2C[C@H](c3ccc(F)cc3)C2)cc1	ZINC000481662053	459267056	/nfs/dbraw/zinc/26/70/56/459267056.db2.gz	YIYIXYCSJAQOJB-QWFCFKBJSA-N	0	3	347.393	3.442	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)[C@@H]1C[C@H]2CCCC[C@@H]2NC1=O	ZINC000595290916	459267692	/nfs/dbraw/zinc/26/76/92/459267692.db2.gz	NODSVYFEMOUOQK-CEXWTWQISA-N	0	3	325.456	3.218	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN[C@@H](C)C1(c2ccccc2)CCCC1	ZINC000481825665	459277114	/nfs/dbraw/zinc/27/71/14/459277114.db2.gz	PULVOLWHSQXMTE-MSOLQXFVSA-N	0	3	341.499	3.485	20	30		EGEDHN
N#Cc1ccc(OC2CCN(Cc3cccc(N)c3)CC2)c(F)c1	ZINC000595484921	459320785	/nfs/dbraw/zinc/32/07/85/459320785.db2.gz	SWSNVQPXWNCRSM-UHFFFAOYSA-N	0	3	325.387	3.323	20	30		EGEDHN
CC(C)(C)c1ccc(CNC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000568710269	459330240	/nfs/dbraw/zinc/33/02/40/459330240.db2.gz	RIQUJWABQQPKGR-IBGZPJMESA-N	0	3	338.451	3.385	20	30		EGEDHN
CC(C)N1CCN(c2cccc(NC[C@H](C#N)CCC#N)c2)CC1	ZINC000560414402	459340732	/nfs/dbraw/zinc/34/07/32/459340732.db2.gz	OIAMIEWZYGXJIU-KRWDZBQOSA-N	0	3	325.460	3.072	20	30		EGEDHN
C=CC[C@@H](CO)CN[C@@H](C)c1ccccc1I	ZINC000540393425	459380398	/nfs/dbraw/zinc/38/03/98/459380398.db2.gz	JANBWICTQLENEQ-NWDGAFQWSA-N	0	3	345.224	3.126	20	30		EGEDHN
CN(CCCNC(=O)c1ccc(Cl)c(C#N)c1)Cc1ccccc1	ZINC000540848376	459393330	/nfs/dbraw/zinc/39/33/30/459393330.db2.gz	SYHXNQJZAHPAEB-UHFFFAOYSA-N	0	3	341.842	3.464	20	30		EGEDHN
N#CCCC1CCN(Cc2ccc(Cl)cc2-n2cncn2)CC1	ZINC000582603797	459393934	/nfs/dbraw/zinc/39/39/34/459393934.db2.gz	VKBGYRABYOHODW-UHFFFAOYSA-N	0	3	329.835	3.436	20	30		EGEDHN
C[C@H](c1ccc(F)cc1)N1CCC[C@H](N[C@H]2CC[C@H](C#N)C2)C1=O	ZINC000569108703	459397188	/nfs/dbraw/zinc/39/71/88/459397188.db2.gz	QBKPFOXDXUAJLX-BODMPHMZSA-N	0	3	329.419	3.160	20	30		EGEDHN
N#Cc1cccc(CNC(=O)CN2CC[C@H](C3CCCCC3)C2)c1	ZINC000595733840	459419312	/nfs/dbraw/zinc/41/93/12/459419312.db2.gz	JWVBCCKZGXJHJA-IBGZPJMESA-N	0	3	325.456	3.077	20	30		EGEDHN
N#Cc1ccc2c(c1)CC[C@@H]2NC[C@@H](O)COc1ccc(Cl)cc1	ZINC000591763954	459431892	/nfs/dbraw/zinc/43/18/92/459431892.db2.gz	SSOROTVOYHQJLT-APWZRJJASA-N	0	3	342.826	3.228	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@H](NC/C=C\c3ccccc3)C2=O)cc1	ZINC000485257669	459446754	/nfs/dbraw/zinc/44/67/54/459446754.db2.gz	GJDXJUYQRAAGCT-CWWFIGIMSA-N	0	3	331.419	3.357	20	30		EGEDHN
COCCCN(C)CCNc1c(C#N)cnc2c(Cl)cccc21	ZINC000591915858	459481986	/nfs/dbraw/zinc/48/19/86/459481986.db2.gz	XERKZHPLMBWJID-UHFFFAOYSA-N	0	3	332.835	3.140	20	30		EGEDHN
C=C[C@@](C)(O)CC(=O)NC[C@@H](c1ccc(CC)cc1)N(CC)CC	ZINC000562187525	459516804	/nfs/dbraw/zinc/51/68/04/459516804.db2.gz	ZAOOOCSMIKQDLM-AZUAARDMSA-N	0	3	332.488	3.075	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2oc3ccc(OC)cc3c2C)CC1	ZINC000592070429	459519956	/nfs/dbraw/zinc/51/99/56/459519956.db2.gz	XVMHWZFWKNZCHY-UHFFFAOYSA-N	0	3	328.412	3.130	20	30		EGEDHN
C[C@@H]1CCCC[C@@H]1OCCN1CC[C@@H](Oc2ccc(C#N)cn2)C1	ZINC000562363296	459546242	/nfs/dbraw/zinc/54/62/42/459546242.db2.gz	QRTXZRKJCDYELM-NXHRZFHOSA-N	0	3	329.444	3.002	20	30		EGEDHN
CCCN(C(=O)Nc1cc(C#N)cn1C(C)(C)C)[C@@H]1CCN(C)C1	ZINC000592252658	459561344	/nfs/dbraw/zinc/56/13/44/459561344.db2.gz	JXHAZQVCOIUNJQ-OAHLLOKOSA-N	0	3	331.464	3.063	20	30		EGEDHN
C=CCN(CCc1ccco1)C(=O)NC[C@H](c1ccccc1)N(C)C	ZINC000498111391	459569829	/nfs/dbraw/zinc/56/98/29/459569829.db2.gz	IDNBVXIBVXIFRW-LJQANCHMSA-N	0	3	341.455	3.323	20	30		EGEDHN
C=CCN(CCc1ccco1)C(=O)NC[C@@H](C)N1CCC[C@H](C)C1	ZINC000498155011	459571522	/nfs/dbraw/zinc/57/15/22/459571522.db2.gz	HJUXSPFUVASXRF-DLBZAZTESA-N	0	3	333.476	3.140	20	30		EGEDHN
CC(=O)Nc1ccc(C(=O)C(C#N)c2nc3ccccc3[nH]2)cc1F	ZINC000562497020	459572401	/nfs/dbraw/zinc/57/24/01/459572401.db2.gz	WHDAUAOHVURCCZ-GFCCVEGCSA-N	0	3	336.326	3.150	20	30		EGEDHN
C=C(CNC(=O)N1CCN([C@@H]2C[C@@H]2C)C[C@@H](C)C1)c1ccccc1	ZINC000491189446	459603635	/nfs/dbraw/zinc/60/36/35/459603635.db2.gz	VZMUUPBZRRVEBX-JTDSTZFVSA-N	0	3	327.472	3.072	20	30		EGEDHN
CCCN(C(=O)NC[C@@H](C)C#N)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000542875474	459605587	/nfs/dbraw/zinc/60/55/87/459605587.db2.gz	JYYHODUMPCPVIV-PKOBYXMFSA-N	0	3	342.487	3.232	20	30		EGEDHN
C=CCCC[C@@H](C)N[C@H](Cc1ccc(C(F)(F)F)cc1)C(N)=O	ZINC000543138725	459626859	/nfs/dbraw/zinc/62/68/59/459626859.db2.gz	LTSNOHUCMXYCGN-IUODEOHRSA-N	0	3	328.378	3.436	20	30		EGEDHN
C#CCN(C(=O)NC1CCN([C@H](C)c2ccccc2)CC1)C1CC1	ZINC000491465277	459628113	/nfs/dbraw/zinc/62/81/13/459628113.db2.gz	VSNMEMNQWDMYEA-MRXNPFEDSA-N	0	3	325.456	3.019	20	30		EGEDHN
C=C(C)Cn1c(C2CCCC2)nnc1N1CCN(CC2CC2)CC1	ZINC000562755093	459641431	/nfs/dbraw/zinc/64/14/31/459641431.db2.gz	PQQKBVNGBNVWJD-UHFFFAOYSA-N	0	3	329.492	3.044	20	30		EGEDHN
C[C@H](C#N)CN[C@@H](C)CCc1ccc(I)cc1	ZINC000527526560	459656295	/nfs/dbraw/zinc/65/62/95/459656295.db2.gz	IOBRMVPBUOERKN-NEPJUHHUSA-N	0	3	342.224	3.362	20	30		EGEDHN
C#CCCN1CCC(NC(=O)/C=C\c2ccc(OC(C)C)cc2)CC1	ZINC000492087634	459690676	/nfs/dbraw/zinc/69/06/76/459690676.db2.gz	KAZPMNDVJUMAPB-FLIBITNWSA-N	0	3	340.467	3.091	20	30		EGEDHN
CC[C@H](C)N[C@H](CNC(=O)N1CCC[C@H](CC#N)C1)c1ccco1	ZINC000596599314	459691947	/nfs/dbraw/zinc/69/19/47/459691947.db2.gz	TXAGFGFRUQMKDN-ARFHVFGLSA-N	0	3	332.448	3.044	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CCC(CC#N)CC2)C1	ZINC000543776829	459698752	/nfs/dbraw/zinc/69/87/52/459698752.db2.gz	XEUCVNUROQCZFD-VQIMIIECSA-N	0	3	340.471	3.157	20	30		EGEDHN
COc1cccc([C@@H](CNCc2ccc(OC)c(C#N)c2)OC)c1	ZINC000527732919	459717847	/nfs/dbraw/zinc/71/78/47/459717847.db2.gz	BPJQJAORPRYZGN-LJQANCHMSA-N	0	3	326.396	3.053	20	30		EGEDHN
CN(CCOCc1ccc(C#N)cc1)C[C@@H]1CCC2(CCCC2)O1	ZINC000584678596	459782345	/nfs/dbraw/zinc/78/23/45/459782345.db2.gz	YEXJVBQODCZTNU-IBGZPJMESA-N	0	3	328.456	3.498	20	30		EGEDHN
Cc1ccccc1[C@@H]1CCN(C[C@@H](O)COc2ccccc2C#N)C1	ZINC000528366304	459804323	/nfs/dbraw/zinc/80/43/23/459804323.db2.gz	SXYWXJIWMNJWEJ-RTBURBONSA-N	0	3	336.435	3.096	20	30		EGEDHN
C[C@H]1O[C@@H](C)[C@H](C)[C@H]1C(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1	ZINC000528917759	459817661	/nfs/dbraw/zinc/81/76/61/459817661.db2.gz	HPXVTKWXRKHJLB-ABNINFQISA-N	0	3	334.803	3.047	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)CCCCCC#N	ZINC000588160344	459922055	/nfs/dbraw/zinc/92/20/55/459922055.db2.gz	GWLNNBSWHUHNSS-HKUYNNGSSA-N	0	3	327.472	3.487	20	30		EGEDHN
CCc1nc(CNC2CCN(Cc3cccc(C#N)c3)CC2)cs1	ZINC000593693151	459953854	/nfs/dbraw/zinc/95/38/54/459953854.db2.gz	QUWWWJMUTZLKQI-UHFFFAOYSA-N	0	3	340.496	3.331	20	30		EGEDHN
COC(=O)[C@@H]1CN(Cc2cccc(OCCCC#N)c2)C[C@H]1C1CC1	ZINC000593696942	459955697	/nfs/dbraw/zinc/95/56/97/459955697.db2.gz	LJNGNYUYHDRFSJ-RBUKOAKNSA-N	0	3	342.439	3.000	20	30		EGEDHN
CCN(Cc1cccc(C#N)n1)CC1CCN(c2ccccn2)CC1	ZINC000602479255	459957985	/nfs/dbraw/zinc/95/79/85/459957985.db2.gz	ZLJOIGIDLUTVNF-UHFFFAOYSA-N	0	3	335.455	3.087	20	30		EGEDHN
CCC[C@@H]1CN(C[C@@H](O)CC(C)(C)C#N)CCN1Cc1ccccc1	ZINC000598600880	459958687	/nfs/dbraw/zinc/95/86/87/459958687.db2.gz	HOVARKUQUCOPKW-UXHICEINSA-N	0	3	343.515	3.274	20	30		EGEDHN
CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1ccc2c(c1)CNC2	ZINC000602527918	459983388	/nfs/dbraw/zinc/98/33/88/459983388.db2.gz	JUJFPBCSWKBZIL-UHFFFAOYSA-N	0	3	333.435	3.460	20	30		EGEDHN
N#Cc1cccc(CNC[C@@H]2CCN(c3ccc(Cl)cc3)C2)n1	ZINC000602532119	459984818	/nfs/dbraw/zinc/98/48/18/459984818.db2.gz	KMLLEVJGZIIHHL-AWEZNQCLSA-N	0	3	326.831	3.223	20	30		EGEDHN
C[C@H](CCC#N)CN[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1=O	ZINC000602545574	459992821	/nfs/dbraw/zinc/99/28/21/459992821.db2.gz	FYVGPKQLFXRQRN-IUODEOHRSA-N	0	3	339.361	3.340	20	30		EGEDHN
N#Cc1cccc(CN[C@@H]2CCN(c3ccc(C(F)(F)F)cc3)C2)n1	ZINC000602559216	459994954	/nfs/dbraw/zinc/99/49/54/459994954.db2.gz	VDBCVHHOHDIKNB-MRXNPFEDSA-N	0	3	346.356	3.341	20	30		EGEDHN
CCn1cc(CN(C(=O)C(C#N)CCc2ccccc2)C(C)C)cn1	ZINC000593836112	460000154	/nfs/dbraw/zinc/00/01/54/460000154.db2.gz	RPZKFQHGGYJQSW-IBGZPJMESA-N	0	3	338.455	3.413	20	30		EGEDHN
Cc1cc2c(cc1C#N)[nH]nc2NC(=O)C[C@H](c1ccccc1)N(C)C	ZINC000593844889	460000403	/nfs/dbraw/zinc/00/04/03/460000403.db2.gz	GNKNRAMGAPDUKQ-GOSISDBHSA-N	0	3	347.422	3.375	20	30		EGEDHN
N#Cc1cccc(CN[C@H]2CCN(c3ccc(Cl)c(F)c3)C2)n1	ZINC000602575760	460004706	/nfs/dbraw/zinc/00/47/06/460004706.db2.gz	JLTGCIGYEIHONA-AWEZNQCLSA-N	0	3	330.794	3.114	20	30		EGEDHN
CC(C)C[C@@H](C)Oc1cc(CNC[C@@H](O)CC(C)(C)C#N)ccn1	ZINC000598720617	460006352	/nfs/dbraw/zinc/00/63/52/460006352.db2.gz	PXXGLYQVCWNYDM-WBVHZDCISA-N	0	3	333.476	3.285	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CNCc1ccnc(Oc2ccccc2F)c1	ZINC000598724350	460007476	/nfs/dbraw/zinc/00/74/76/460007476.db2.gz	OBSVCANYNCPTMH-HNNXBMFYSA-N	0	3	343.402	3.403	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000593949121	460024081	/nfs/dbraw/zinc/02/40/81/460024081.db2.gz	WCHQSTPDNWPRII-UTKZUKDTSA-N	0	3	347.462	3.128	20	30		EGEDHN
C[C@@H](c1ccc(C#N)cc1)N1CCC(C(=O)NCC(F)(F)F)CC1	ZINC000609822869	460025025	/nfs/dbraw/zinc/02/50/25/460025025.db2.gz	NHUUUUPMXIZDIW-LBPRGKRZSA-N	0	3	339.361	3.010	20	30		EGEDHN
CCOc1cc(N2CCN(C[C@H](C)CCC#N)CC2)ccc1[N+](=O)[O-]	ZINC000602638248	460036145	/nfs/dbraw/zinc/03/61/45/460036145.db2.gz	OUYVWJVYTZNELG-OAHLLOKOSA-N	0	3	346.431	3.055	20	30		EGEDHN
CN(C)CCN(Cc1nc2c(s1)CCC2)Cc1ccc(C#N)cc1	ZINC000589195073	460051460	/nfs/dbraw/zinc/05/14/60/460051460.db2.gz	ZJIJQTKHPGPOHO-UHFFFAOYSA-N	0	3	340.496	3.067	20	30		EGEDHN
Cc1cc(C)c(C#N)c(NC(=O)C2CCN(Cc3ccccc3)CC2)n1	ZINC000598853143	460067920	/nfs/dbraw/zinc/06/79/20/460067920.db2.gz	MAZARGQGAFDTIB-UHFFFAOYSA-N	0	3	348.450	3.421	20	30		EGEDHN
Cc1cc(NC(=O)CNC[C@H](C)CCC#N)ccc1Br	ZINC000602694351	460069439	/nfs/dbraw/zinc/06/94/39/460069439.db2.gz	LOZRDZXUSRFHIX-LLVKDONJSA-N	0	3	338.249	3.226	20	30		EGEDHN
CC[C@@H](Cc1ccccc1)N(C)CC(=O)NCc1ccc(C#N)cc1	ZINC000610215781	460084838	/nfs/dbraw/zinc/08/48/38/460084838.db2.gz	WYKAHHNDZAWQLA-FQEVSTJZSA-N	0	3	335.451	3.128	20	30		EGEDHN
CC(C)(C)n1cc(C#N)cc1NC(=O)N[C@@H]1CCCN2CCCC[C@H]12	ZINC000594095693	460099628	/nfs/dbraw/zinc/09/96/28/460099628.db2.gz	BYUCIJLIEHHYFB-HZPDHXFCSA-N	0	3	343.475	3.253	20	30		EGEDHN
CCO[C@@H]1C[C@H](N[C@@H](C)C(=O)Nc2ccccc2C#N)C12CCCC2	ZINC000610345466	460127328	/nfs/dbraw/zinc/12/73/28/460127328.db2.gz	ZCLPJORTHOILLV-JCGIZDLHSA-N	0	3	341.455	3.213	20	30		EGEDHN
N#CC[C@H](CC(=O)N[C@@H]1CCCN2CCCC[C@H]12)c1ccccc1	ZINC000594199011	460145820	/nfs/dbraw/zinc/14/58/20/460145820.db2.gz	XTHOMJQFIQPPFM-GUDVDZBRSA-N	0	3	325.456	3.207	20	30		EGEDHN
CC(C)(C)OC(=O)CC1(NCc2ccc(C#N)cn2)CCCCC1	ZINC000602878047	460167827	/nfs/dbraw/zinc/16/78/27/460167827.db2.gz	PFCISLDIHDOLEO-UHFFFAOYSA-N	0	3	329.444	3.478	20	30		EGEDHN
CCN(C[C@H](O)COc1ccccc1C#N)[C@H](C)c1ccc(C#N)cc1	ZINC000599270438	460212137	/nfs/dbraw/zinc/21/21/37/460212137.db2.gz	JPBLBXLWFGLXHE-UZLBHIALSA-N	0	3	349.434	3.253	20	30		EGEDHN
CCOc1cccc([C@H](C)NC[C@H](O)COc2ccccc2C#N)c1	ZINC000599349035	460234673	/nfs/dbraw/zinc/23/46/73/460234673.db2.gz	JVHOFUDTUNROPO-YJBOKZPZSA-N	0	3	340.423	3.047	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CN[C@@H](c1cccs1)C1CC1	ZINC000599348761	460234901	/nfs/dbraw/zinc/23/49/01/460234901.db2.gz	LNEXIXGLANLRPF-MAUKXSAKSA-N	0	3	328.437	3.100	20	30		EGEDHN
Cc1nccc([C@@H]2CCCN(CCCOc3cccc(C#N)c3)C2)n1	ZINC000610786224	460236585	/nfs/dbraw/zinc/23/65/85/460236585.db2.gz	NMPSWFXVHWBPFS-GOSISDBHSA-N	0	3	336.439	3.305	20	30		EGEDHN
C[C@@H](N[C@H](C)c1cccc(NS(C)(=O)=O)c1)c1cccc(C#N)c1	ZINC000610830417	460245295	/nfs/dbraw/zinc/24/52/95/460245295.db2.gz	RKAMBOMYYSFVAT-ZIAGYGMSSA-N	0	3	343.452	3.342	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@@H](C)CN2CCC(C)CC2)cc1OC	ZINC000618991995	460245829	/nfs/dbraw/zinc/24/58/29/460245829.db2.gz	ISVFTCACRCWYCJ-INIZCTEOSA-N	0	3	346.471	3.110	20	30		EGEDHN
CC(C)(NCCCOc1cccc(C#N)c1)C(=O)Nc1ccccc1	ZINC000610844521	460246503	/nfs/dbraw/zinc/24/65/03/460246503.db2.gz	VNHMJRNXPBIFAI-UHFFFAOYSA-N	0	3	337.423	3.334	20	30		EGEDHN
CN(C)C1(CNC(=O)c2c(Cl)cc(C#N)cc2Cl)CCC1	ZINC000615141727	460283646	/nfs/dbraw/zinc/28/36/46/460283646.db2.gz	SEUUPMDGBYWZEP-UHFFFAOYSA-N	0	3	326.227	3.079	20	30		EGEDHN
CC[C@@H](NCC(=O)N(CCC#N)CCC#N)c1cc(C)ccc1C	ZINC000599640570	460295756	/nfs/dbraw/zinc/29/57/56/460295756.db2.gz	JUBZDHFYNKCLPQ-GOSISDBHSA-N	0	3	326.444	3.000	20	30		EGEDHN
Cc1ccc2c(c1)[C@@H](NC(=O)C(C#N)Cc1ccc(C#N)cc1)CC2	ZINC000619285417	460320763	/nfs/dbraw/zinc/32/07/63/460320763.db2.gz	SZVCLMSXTTYJBZ-QUCCMNQESA-N	0	3	329.403	3.353	20	30		EGEDHN
C[C@H](NC[C@@H](O)COc1ccccc1Cl)c1cccc(C#N)c1	ZINC000611386303	460350218	/nfs/dbraw/zinc/35/02/18/460350218.db2.gz	KTXKPQHCDCXJTE-XJKSGUPXSA-N	0	3	330.815	3.302	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN(C)C[C@@H](C)C(=O)OC)cc1OC	ZINC000600112964	460387774	/nfs/dbraw/zinc/38/77/74/460387774.db2.gz	PDCWBBBPZLQJPG-GFCCVEGCSA-N	0	3	341.835	3.154	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)N1CCC[C@](C)(C#N)C1)c1ccccc1	ZINC000612094734	460537346	/nfs/dbraw/zinc/53/73/46/460537346.db2.gz	WGCMCPYNBOJJFK-AZUAARDMSA-N	0	3	342.487	3.405	20	30		EGEDHN
CC[C@@H](CC#N)NC(=O)c1ccccc1OCCN1CCCC[C@@H]1C	ZINC000613037136	460809409	/nfs/dbraw/zinc/80/94/09/460809409.db2.gz	HXTHMDAPXDOVJJ-IRXDYDNUSA-N	0	3	343.471	3.362	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@H]2CCC[C@@H]2Cc2ccccc2)CC1	ZINC000668369116	461257527	/nfs/dbraw/zinc/25/75/27/461257527.db2.gz	OQMGKMDLMCHBPJ-QUCCMNQESA-N	0	3	326.484	3.412	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1ncoc1C(F)(F)F)C(C)C	ZINC000668682888	461380451	/nfs/dbraw/zinc/38/04/51/461380451.db2.gz	OKHVITLUBGZGCX-GFCCVEGCSA-N	0	3	345.365	3.122	20	30		EGEDHN
C=C(C)[C@H](NC1CCN([C@@H]2CCOC2)CC1)c1ccc(F)c(F)c1	ZINC000655757649	461425078	/nfs/dbraw/zinc/42/50/78/461425078.db2.gz	WLWNBFVNAOIFPK-APWZRJJASA-N	0	3	336.426	3.425	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)c2ccc3c(c2)CCCC(=O)N3)n1	ZINC000642281946	461485266	/nfs/dbraw/zinc/48/52/66/461485266.db2.gz	UGBSONSMWVMEKT-CYBMUJFWSA-N	0	3	325.393	3.216	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC(=O)N[C@@H](C)c1ccc2ccccc2c1	ZINC000650075179	461554554	/nfs/dbraw/zinc/55/45/54/461554554.db2.gz	JPZAYGDWKSJSFZ-BEVDRBHNSA-N	0	3	338.451	3.340	20	30		EGEDHN
C=CCC[C@@H]1NC(=O)N([C@H](CN2CCCCC2)c2ccccc2)C1=O	ZINC000642927423	461580660	/nfs/dbraw/zinc/58/06/60/461580660.db2.gz	KUPGXVGITMRNQX-ZWKOTPCHSA-N	0	3	341.455	3.100	20	30		EGEDHN
C=CC[C@@H]1CCCN(C(=O)NCc2cccc(OCCN(C)C)c2)C1	ZINC000660386979	461745792	/nfs/dbraw/zinc/74/57/92/461745792.db2.gz	SNDWKJJAXOCKPM-QGZVFWFLSA-N	0	3	345.487	3.125	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CC[C@H]2c2ccc(F)cc2)CC1	ZINC000660597485	461871825	/nfs/dbraw/zinc/87/18/25/461871825.db2.gz	PQRZUOONOUJBCB-SFHVURJKSA-N	0	3	331.435	3.323	20	30		EGEDHN
C=CC[C@@H]1CCCN([C@@H](C)C(=O)N[C@@H]2CCOc3ccccc32)C1	ZINC000661378771	462224737	/nfs/dbraw/zinc/22/47/37/462224737.db2.gz	LVVSAHFARSMAND-LZLYRXPVSA-N	0	3	328.456	3.303	20	30		EGEDHN
C=CCN(CC(=O)N1CCO[C@H](c2ccc(F)cc2)C1)C(C)(C)C	ZINC000661756597	462398778	/nfs/dbraw/zinc/39/87/78/462398778.db2.gz	SCJBYADKKGVJHO-KRWDZBQOSA-N	0	3	334.435	3.012	20	30		EGEDHN
C=CCN(CC(=O)N[C@H](C)c1cc(OC)c(OC)cc1C)C(C)(C)C	ZINC000661756915	462399492	/nfs/dbraw/zinc/39/94/92/462399492.db2.gz	XJVZQEKTRFQJSX-OAHLLOKOSA-N	0	3	348.487	3.476	20	30		EGEDHN
C=C[C@@H](CC(=O)N1CCCN(c2ccncc2)CC1)c1ccccc1	ZINC000640446401	462408640	/nfs/dbraw/zinc/40/86/40/462408640.db2.gz	VYHIQESEMUHSIJ-SFHVURJKSA-N	0	3	335.451	3.480	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccccc2N2CCCC2)CC1	ZINC000171741414	526441565	/nfs/dbraw/zinc/44/15/65/526441565.db2.gz	JOMDPAKKWGWBDK-UHFFFAOYSA-N	0	3	328.460	3.059	20	30		EGEDHN
CC(C)Oc1cccc(C(=O)C(C#N)c2nc3ccccc3n2C)n1	ZINC000162348203	546963755	/nfs/dbraw/zinc/96/37/55/546963755.db2.gz	JQCBPVJOTAJSJG-CYBMUJFWSA-N	0	3	334.379	3.246	20	30		EGEDHN
O=C(NCc1ccccc1CN1CCCCC1)NCC1CCOCC1	ZINC000328637309	547481159	/nfs/dbraw/zinc/48/11/59/547481159.db2.gz	CTOIWMBEYQOQGZ-UHFFFAOYSA-N	0	3	345.487	3.103	20	30		EGEDHN
CCCN1CCC[C@H]1CNC(=O)[C@@H]1CCCN1C(=O)c1cccs1	ZINC000329221232	547492106	/nfs/dbraw/zinc/49/21/06/547492106.db2.gz	UMTGKFBZWBRFAU-GJZGRUSLSA-N	0	3	349.500	3.184	20	30		EGEDHN
C[C@H](NC([O-])=[NH+][C@H]1CCn2ccnc2C1)C12CC3CC(CC(C3)C1)C2	ZINC000330185687	547514969	/nfs/dbraw/zinc/51/49/69/547514969.db2.gz	RMEQXARZPKWHHQ-OYDALLEOSA-N	0	3	342.487	3.306	20	30		EGEDHN
C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)c1ccc2c(c1)C(C)(C)C(=O)N2	ZINC000330212057	547516051	/nfs/dbraw/zinc/51/60/51/547516051.db2.gz	DJWFMONMJRDKMV-BDJLRTHQSA-N	0	3	327.428	3.353	20	30		EGEDHN
C=CCC[C@@H](C(=O)N1CCN(c2ccncc2)CC1)c1ccccc1	ZINC000681668356	550025231	/nfs/dbraw/zinc/02/52/31/550025231.db2.gz	ZMCADNTVWUKTHF-HXUWFJFHSA-N	0	3	335.451	3.480	20	30		EGEDHN
C[C@@H](CN1CCCCC1)NC(=S)Nc1ccc(C#N)c(Cl)c1	ZINC000726463275	574557306	/nfs/dbraw/zinc/55/73/06/574557306.db2.gz	SNYTXDSKMKEESG-LBPRGKRZSA-N	0	3	336.892	3.372	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H](CN2CCCCC2)c2ccccc2)nc1	ZINC000728867562	574782499	/nfs/dbraw/zinc/78/24/99/574782499.db2.gz	NWWINNACEPLOIY-FQEVSTJZSA-N	0	3	333.435	3.020	20	30		EGEDHN
CN(C)CCOc1ccc(CCNc2ccc(C#N)cc2F)cc1	ZINC000729184267	574821795	/nfs/dbraw/zinc/82/17/95/574821795.db2.gz	XHKOFLKTEVVKLM-UHFFFAOYSA-N	0	3	327.403	3.292	20	30		EGEDHN
Cc1ccc(N=NC(C)c2ccc([O-])c(C[NH+]3CCCCC3)c2)nn1	ZINC000729936231	574897629	/nfs/dbraw/zinc/89/76/29/574897629.db2.gz	MESCJSUFMCUUQQ-UHFFFAOYSA-N	0	3	339.443	3.313	20	30		EGEDHN
CC[C@H]1CCCCN1CCNC(=O)c1ccccc1SCC#N	ZINC000733274084	575323618	/nfs/dbraw/zinc/32/36/18/575323618.db2.gz	ROQNDXBUGKHVPZ-HNNXBMFYSA-N	0	3	331.485	3.297	20	30		EGEDHN
CC[C@@H]1CCCCN1CCNC(=O)c1ccccc1SCC#N	ZINC000733274085	575323643	/nfs/dbraw/zinc/32/36/43/575323643.db2.gz	ROQNDXBUGKHVPZ-OAHLLOKOSA-N	0	3	331.485	3.297	20	30		EGEDHN
CC[C@H](C#N)Oc1cccc(CNCc2c(O)cccc2OC)c1	ZINC000733800375	575397959	/nfs/dbraw/zinc/39/79/59/575397959.db2.gz	OGWWLAPUEHTZRF-OAHLLOKOSA-N	0	3	326.396	3.372	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)c2cc3occc3s2)c1	ZINC000737316753	576203406	/nfs/dbraw/zinc/20/34/06/576203406.db2.gz	MYJXMTDMIGBVIQ-LBPRGKRZSA-N	0	3	340.360	3.464	20	30		EGEDHN
C#CCCN1CCC(NC(=O)[C@H]2C[C@H]2c2cccc(Cl)c2)CC1	ZINC000740736028	576621402	/nfs/dbraw/zinc/62/14/02/576621402.db2.gz	ASRNKIOIYBWFAA-ROUUACIJSA-N	0	3	330.859	3.047	20	30		EGEDHN
CC(C)CN(CCC#N)CC(=O)C(C#N)c1nc2ccccc2s1	ZINC000740878710	576632885	/nfs/dbraw/zinc/63/28/85/576632885.db2.gz	UJZBSTLSLBFPBA-AWEZNQCLSA-N	0	3	340.452	3.344	20	30		EGEDHN
CCOc1ccc(NC(=S)NN=C2CCN(CC)C[C@@H]2C)cc1	ZINC000741457624	576687767	/nfs/dbraw/zinc/68/77/67/576687767.db2.gz	OEMYGAAOGYWNKO-ZDUSSCGKSA-N	0	3	334.489	3.089	20	30		EGEDHN
C#CCOc1cc(F)ccc1NC(=O)NC[C@H](C)N1CCCC[C@@H]1C	ZINC000743194181	576802969	/nfs/dbraw/zinc/80/29/69/576802969.db2.gz	GNQAQECKZJRLNA-GJZGRUSLSA-N	0	3	347.434	3.222	20	30		EGEDHN
C#CCOc1cc(F)ccc1NC(=O)NC[C@H](C)N1CCC[C@@H](C)C1	ZINC000743195586	576802994	/nfs/dbraw/zinc/80/29/94/576802994.db2.gz	YJZGJLCWCNGYAN-CABCVRRESA-N	0	3	347.434	3.080	20	30		EGEDHN
C#CCOc1ccc(F)cc1NC(=O)NC[C@@H](C)N1CCCC[C@@H]1C	ZINC000743201292	576803224	/nfs/dbraw/zinc/80/32/24/576803224.db2.gz	MPXUYGWMGKMXKK-LSDHHAIUSA-N	0	3	347.434	3.222	20	30		EGEDHN
C#CCCN1CCC(NC(=O)/C=C(/C)c2ccccc2Cl)CC1	ZINC000743493006	576810406	/nfs/dbraw/zinc/81/04/06/576810406.db2.gz	DPVNILMCBPGSEG-PFONDFGASA-N	0	3	330.859	3.347	20	30		EGEDHN
Cc1ncc(CO)c(/C=N\C2CC[NH+](CC3CCCCC3)CC2)c1[O-]	ZINC000743538852	576811475	/nfs/dbraw/zinc/81/14/75/576811475.db2.gz	QIJPIRGUJIXAAW-UUYOSTAYSA-N	0	3	345.487	3.052	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)[C@@H](C)c2ccco2)cc1Cl	ZINC000744031934	576819275	/nfs/dbraw/zinc/81/92/75/576819275.db2.gz	DHCGLTSCXCETKV-JQWIXIFHSA-N	0	3	346.770	3.393	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N[C@@H]1CC[C@H](SC)C1)C(C)C	ZINC000745537860	576849552	/nfs/dbraw/zinc/84/95/52/576849552.db2.gz	WEKFNVRLLDXPFN-IXDOHACOSA-N	0	3	339.549	3.268	20	30		EGEDHN
C=CCC[C@H]([NH2+]C[C@@H](O)c1ccc(-c2nnn[n-]2)cc1)c1ccccc1	ZINC000823894162	608537769	/nfs/dbraw/zinc/53/77/69/608537769.db2.gz	JAJRYQIKIAOIRS-RBUKOAKNSA-N	0	3	349.438	3.197	20	30		EGEDHN
C=CCC[C@H]([NH2+]C[C@@H](O)c1ccc(-c2nn[n-]n2)cc1)c1ccccc1	ZINC000823894162	608537770	/nfs/dbraw/zinc/53/77/70/608537770.db2.gz	JAJRYQIKIAOIRS-RBUKOAKNSA-N	0	3	349.438	3.197	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1cccc(Cl)c1Br	ZINC000691634180	1298135605	/nfs/dbraw/zinc/13/56/05/1298135605.db2.gz	ZYPVRYBYMPAJRP-VIFPVBQESA-N	0	3	330.613	3.062	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)c2ccc(N3CCCC3=O)cc2)n1	ZINC000041521792	1291419039	/nfs/dbraw/zinc/41/90/39/1291419039.db2.gz	LSWZLKWTNBGZBI-CQSZACIVSA-N	0	3	325.393	3.068	20	30		EGEDHN
C=C(C)CN(CC)C(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000063143076	1292000232	/nfs/dbraw/zinc/00/02/32/1292000232.db2.gz	ONMXYLIMMMYKSN-UHFFFAOYSA-N	0	3	331.529	3.424	20	30		EGEDHN
C[C@@H](NCc1ccc(CC#N)cc1)c1ccc(N2CCNC2=O)cc1	ZINC000829751155	1292614278	/nfs/dbraw/zinc/61/42/78/1292614278.db2.gz	HGIVXIZDZOLKLD-OAHLLOKOSA-N	0	3	334.423	3.133	20	30		EGEDHN
C#CCOc1ccccc1CN1CCC[C@@H](CNC(=O)C(C)(C)C)C1	ZINC000093281824	1292913292	/nfs/dbraw/zinc/91/32/92/1292913292.db2.gz	OEOLVYTVXDABSE-KRWDZBQOSA-N	0	3	342.483	3.073	20	30		EGEDHN
CS[C@@H](C)C(=O)C(C#N)C(=O)Nc1ccc(SC(F)F)cc1	ZINC000103329898	1293002724	/nfs/dbraw/zinc/00/27/24/1293002724.db2.gz	XBTJZMNPMUOPII-GZMMTYOYSA-N	0	3	344.408	3.400	20	30		EGEDHN
CC(C)COc1ccc(CC(=O)C(C#N)C(=O)NC2CCCC2)cc1	ZINC000106985473	1293055690	/nfs/dbraw/zinc/05/56/90/1293055690.db2.gz	KGSLVHZWMORWRL-GOSISDBHSA-N	0	3	342.439	3.032	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)[C@H](C)Cc1ccc(Cl)cc1Cl	ZINC000107409402	1293066541	/nfs/dbraw/zinc/06/65/41/1293066541.db2.gz	AEWDLVLJPMWSER-MFKMUULPSA-N	0	3	341.238	3.405	20	30		EGEDHN
CC[C@@H](CC(F)(F)F)C(=O)C(C#N)C(=O)Nc1cccc(OC)c1	ZINC000835060545	1293195728	/nfs/dbraw/zinc/19/57/28/1293195728.db2.gz	FRPOIGFYILTTAC-GWCFXTLKSA-N	0	3	342.317	3.321	20	30		EGEDHN
Cc1ccc(Oc2ccccc2CC(=O)C(C#N)C(=O)NC2CC2)cc1	ZINC000835064897	1293197644	/nfs/dbraw/zinc/19/76/44/1293197644.db2.gz	JFQNETQIKIZBLJ-SFHVURJKSA-N	0	3	348.402	3.317	20	30		EGEDHN
CC(=O)NC[C@H](CC(=O)C(C#N)c1nc2ccccc2o1)CC(C)C	ZINC000835077454	1293202478	/nfs/dbraw/zinc/20/24/78/1293202478.db2.gz	TVVKKQVDXNTVHC-LSDHHAIUSA-N	0	3	341.411	3.193	20	30		EGEDHN
Cc1ccccc1[C@H](C)CC(=O)C(C#N)C(=O)NCCCOC(C)C	ZINC000116591933	1293208107	/nfs/dbraw/zinc/20/81/07/1293208107.db2.gz	XPTURKKOQIVGGM-AEFFLSMTSA-N	0	3	344.455	3.129	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)C[C@H]3COc4ccccc4O3)nc21	ZINC000835174662	1293226229	/nfs/dbraw/zinc/22/62/29/1293226229.db2.gz	VXPWGZWGRWKELO-UONOGXRCSA-N	0	3	347.374	3.278	20	30		EGEDHN
CC[C@@H](NC(=O)C(C#N)C(=O)CCCC(=O)C1CC1)c1ccccc1	ZINC000835342202	1293268383	/nfs/dbraw/zinc/26/83/83/1293268383.db2.gz	ZPLKKEIURIYAGE-DLBZAZTESA-N	0	3	340.423	3.112	20	30		EGEDHN
N#CC(C(=O)Cn1ccc2ccc(Cl)cc21)C(=O)NC1CCCC1	ZINC000121455738	1293371885	/nfs/dbraw/zinc/37/18/85/1293371885.db2.gz	BUZNAZQJADAJFI-OAHLLOKOSA-N	0	3	343.814	3.062	20	30		EGEDHN
N#CC(C(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)[C@H]1CCCCO1	ZINC000121996560	1293399149	/nfs/dbraw/zinc/39/91/49/1293399149.db2.gz	GKGGTORSKHAUGC-QWHCGFSZSA-N	0	3	341.194	3.210	20	30		EGEDHN
N#CC(C(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)[C@@H]1CCCCO1	ZINC000121996128	1293399614	/nfs/dbraw/zinc/39/96/14/1293399614.db2.gz	GKGGTORSKHAUGC-STQMWFEESA-N	0	3	341.194	3.210	20	30		EGEDHN
N#CC(C(=O)Cc1ccoc1)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000123638891	1293449696	/nfs/dbraw/zinc/44/96/96/1293449696.db2.gz	QCGLWBKRYGDVRW-LLVKDONJSA-N	0	3	337.162	3.476	20	30		EGEDHN
C[C@@](O)(CNC1CC(C#N)(c2ccccc2)C1)c1ccc(F)cc1F	ZINC000127929474	1293577323	/nfs/dbraw/zinc/57/73/23/1293577323.db2.gz	KITHGPKQZPISQK-NQKNOSNGSA-N	0	3	342.389	3.386	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)c2ccoc2C)cc1Cl	ZINC000130318970	1293652446	/nfs/dbraw/zinc/65/24/46/1293652446.db2.gz	BFKYCPGHJBKLNT-LBPRGKRZSA-N	0	3	332.743	3.211	20	30		EGEDHN
C=C(Br)CN[C@@](C)(CNC(=O)OC(C)(C)C)C1CC1	ZINC000133266686	1293740392	/nfs/dbraw/zinc/74/03/92/1293740392.db2.gz	JPYQWFBXZJZZAQ-AWEZNQCLSA-N	0	3	333.270	3.178	20	30		EGEDHN
COc1ccc(C[C@H](C)C(=O)C(C#N)C(=O)NC2CCCCC2)cc1	ZINC000136584026	1293818231	/nfs/dbraw/zinc/81/82/31/1293818231.db2.gz	CHIKXNHKJRFWNA-KSSFIOAISA-N	0	3	342.439	3.032	20	30		EGEDHN
CCCNC(=O)C1(NCc2ccc(O[C@H](C)C#N)cc2)CCCCC1	ZINC000154539885	1294059313	/nfs/dbraw/zinc/05/93/13/1294059313.db2.gz	MIWLDWRNENPMDI-MRXNPFEDSA-N	0	3	343.471	3.296	20	30		EGEDHN
Cc1nc(CCCC(=O)C(C#N)C(=O)Nc2ccccc2)cs1	ZINC000175106941	1294539875	/nfs/dbraw/zinc/53/98/75/1294539875.db2.gz	QDAFOVDYLXGYRX-OAHLLOKOSA-N	0	3	327.409	3.122	20	30		EGEDHN
CC[C@H](CC#N)OC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1	ZINC000188093500	1295435957	/nfs/dbraw/zinc/43/59/57/1295435957.db2.gz	JYLPAGZXRXMXJW-GOSISDBHSA-N	0	3	329.444	3.066	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)COc1cccc(C(C)C)c1	ZINC000193379968	1295859746	/nfs/dbraw/zinc/85/97/46/1295859746.db2.gz	CBDRWAWSCVBICR-KRWDZBQOSA-N	0	3	330.428	3.204	20	30		EGEDHN
CO[C@H](C)CC(=O)C(C#N)C(=O)Nc1ccc(SC(F)F)cc1	ZINC000195491973	1296071764	/nfs/dbraw/zinc/07/17/64/1296071764.db2.gz	JEJFRXXYWQHIRN-BXKDBHETSA-N	0	3	342.367	3.074	20	30		EGEDHN
CO[C@H](C)CC(=O)C(C#N)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000195492378	1296071819	/nfs/dbraw/zinc/07/18/19/1296071819.db2.gz	ZFBOOURVDAZXRY-PELKAZGASA-N	0	3	329.183	3.066	20	30		EGEDHN
CO[C@@H](C)CC(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000195492283	1296073038	/nfs/dbraw/zinc/07/30/38/1296073038.db2.gz	XITXZGZFRGGLME-WPRPVWTQSA-N	0	3	329.183	3.066	20	30		EGEDHN
C#CCOc1ccccc1CNC[C@@H](c1ccco1)N(CC)CC	ZINC000236850627	1296208410	/nfs/dbraw/zinc/20/84/10/1296208410.db2.gz	JWUDZCMWFRFTKN-SFHVURJKSA-N	0	3	326.440	3.464	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]\CCC(=O)N2CCCCC2)c([O-])c1	ZINC000255087106	1296497916	/nfs/dbraw/zinc/49/79/16/1296497916.db2.gz	PWLBXDZOFMRZPM-HKWRFOASSA-N	0	3	331.460	3.060	20	30		EGEDHN
CN(C)[C@H]1Cc2ccccc2N(C(=O)/C=C\c2ccccc2C#N)C1	ZINC000255265683	1296512105	/nfs/dbraw/zinc/51/21/05/1296512105.db2.gz	HYDVCKSOUBUOTM-JZHDPFOFSA-N	0	3	331.419	3.091	20	30		EGEDHN
N#Cc1sc(NC(=O)[C@@H]2CCN(Cc3ccccc3)C2)nc1Cl	ZINC000875684072	1298439836	/nfs/dbraw/zinc/43/98/36/1298439836.db2.gz	YQOVYZUYMMJCDP-GFCCVEGCSA-N	0	3	346.843	3.129	20	30		EGEDHN
C[C@H](C(=O)C(C#N)C(=O)NC1CC1)c1ccc(Cl)c(Cl)c1	ZINC000747107690	1298728895	/nfs/dbraw/zinc/72/88/95/1298728895.db2.gz	AJGYKPMXVKTGSY-KWQFWETISA-N	0	3	325.195	3.084	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)CSCc3cscn3)nc21	ZINC000747232368	1298746263	/nfs/dbraw/zinc/74/62/63/1298746263.db2.gz	IGLLCJMCEVXTJM-GFCCVEGCSA-N	0	3	342.449	3.438	20	30		EGEDHN
Cc1cccc2nc(C(C#N)C(=O)CSCc3cscn3)[nH]c21	ZINC000747232368	1298746274	/nfs/dbraw/zinc/74/62/74/1298746274.db2.gz	IGLLCJMCEVXTJM-GFCCVEGCSA-N	0	3	342.449	3.438	20	30		EGEDHN
C=C(Cl)C[C@@H](N)C(=O)NCc1cn(-c2ccccc2)nc1C(C)C	ZINC000876684661	1298918882	/nfs/dbraw/zinc/91/88/82/1298918882.db2.gz	QGHCTEGVSNHZTF-MRXNPFEDSA-N	0	3	346.862	3.082	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@@H]2C[C@@H](NCC3(C#N)CC3)CC[C@H]21	ZINC000877493531	1299344202	/nfs/dbraw/zinc/34/42/02/1299344202.db2.gz	FDYBXNAHGMIOSL-OWCLPIDISA-N	0	3	333.476	3.448	20	30		EGEDHN
N#CC(C(=O)CCc1cccc(F)c1F)C(=O)NC1CCCCC1	ZINC000750391449	1299387792	/nfs/dbraw/zinc/38/77/92/1299387792.db2.gz	HSJZTSUDGRLKLH-AWEZNQCLSA-N	0	3	334.366	3.055	20	30		EGEDHN
CCOC[C@@H]1CCCN(CC[C@@](C#N)(C(C)=O)c2ccccc2)C1	ZINC000878106592	1299751798	/nfs/dbraw/zinc/75/17/98/1299751798.db2.gz	JALMAPOJLZFSME-UYAOXDASSA-N	0	3	328.456	3.176	20	30		EGEDHN
N#Cc1ccc(-c2ccn(CN3CC[C@@H](C4CCOCC4)C3)n2)cc1	ZINC000754782620	1300214911	/nfs/dbraw/zinc/21/49/11/1300214911.db2.gz	JHYSTNUWSUHAIS-LJQANCHMSA-N	0	3	336.439	3.128	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)Nc1ccc(N2CCN(CC)CC2)cc1)OCC	ZINC000755423076	1300338962	/nfs/dbraw/zinc/33/89/62/1300338962.db2.gz	RKGNKFBCNDKPEU-LJQANCHMSA-N	0	3	345.487	3.138	20	30		EGEDHN
C[C@@]1(COC(=O)c2c[nH]c(C#N)c2)CCCCN1Cc1ccccc1	ZINC000755910213	1300413637	/nfs/dbraw/zinc/41/36/37/1300413637.db2.gz	PZKKNWDSOAZKJX-FQEVSTJZSA-N	0	3	337.423	3.488	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)C[C@@H](C)COC)cc1	ZINC000756232615	1300454106	/nfs/dbraw/zinc/45/41/06/1300454106.db2.gz	CHTVNLWLCAZCIC-PBHICJAKSA-N	0	3	330.428	3.349	20	30		EGEDHN
C#CC[C@H](NC(=O)[C@H]1CCCN(Cc2cccnc2)C1)c1ccccc1	ZINC000757618882	1300695720	/nfs/dbraw/zinc/69/57/20/1300695720.db2.gz	ZZJNHKURPDCYAD-SFTDATJTSA-N	0	3	347.462	3.174	20	30		EGEDHN
CC(=O)Nc1ccc2c(c1)CN(CCCC1(C#N)CCOCC1)CC2	ZINC000880032260	1300880252	/nfs/dbraw/zinc/88/02/52/1300880252.db2.gz	BAACUOZKOLEHDL-UHFFFAOYSA-N	0	3	341.455	3.104	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)c2cc(Cl)cs2)c1	ZINC000759432547	1301091088	/nfs/dbraw/zinc/09/10/88/1301091088.db2.gz	XDSZYOWBFOCGJA-LBPRGKRZSA-N	0	3	334.784	3.371	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@](C)(NCc1cc(C#N)ccc1F)C1CC1	ZINC000759615903	1301129399	/nfs/dbraw/zinc/12/93/99/1301129399.db2.gz	SYATVIKZPJYLCW-LJQANCHMSA-N	0	3	347.434	3.480	20	30		EGEDHN
C#CCCN[C@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1	ZINC000760295782	1301247544	/nfs/dbraw/zinc/24/75/44/1301247544.db2.gz	MVHANMBHWARLBT-LJQANCHMSA-N	0	3	327.449	3.101	20	30		EGEDHN
C[C@H]1C[C@H](Nc2nccc(Oc3cccc(C#N)c3)n2)CN1C1CC1	ZINC000882073741	1301816188	/nfs/dbraw/zinc/81/61/88/1301816188.db2.gz	UGQMJUQASYRHEX-ZFWWWQNUSA-N	0	3	335.411	3.178	20	30		EGEDHN
C#Cc1cccc(NC(=S)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)c1	ZINC000764933777	1302170010	/nfs/dbraw/zinc/17/00/10/1302170010.db2.gz	VJZCYRDUQKHOHT-OXJNMPFZSA-N	0	3	349.503	3.475	20	30		EGEDHN
N#CCSc1ccccc1C(=O)NC[C@H]1CCCCN1C1CC1	ZINC000765204435	1302219086	/nfs/dbraw/zinc/21/90/86/1302219086.db2.gz	HFXUXKOUUQUYJE-OAHLLOKOSA-N	0	3	329.469	3.049	20	30		EGEDHN
Cc1cc(CNCc2ccc(N3CCC(CO)CC3)cc2)ccc1C#N	ZINC000767679590	1302745128	/nfs/dbraw/zinc/74/51/28/1302745128.db2.gz	DYBPSTMUGXCKJF-UHFFFAOYSA-N	0	3	349.478	3.365	20	30		EGEDHN
C=CCNC(=O)[C@@H](C)N1CC[C@H](c2ccc(C(F)(F)F)cc2)C1	ZINC000767875144	1302777782	/nfs/dbraw/zinc/77/77/82/1302777782.db2.gz	JSBKLYODOPCCMP-OCCSQVGLSA-N	0	3	326.362	3.185	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)cc1	ZINC000770042877	1303212059	/nfs/dbraw/zinc/21/20/59/1303212059.db2.gz	BJUBIZZUGFOKIR-OXJNMPFZSA-N	0	3	336.435	3.120	20	30		EGEDHN
C#CCOc1ccc(CNc2ccc(N3CCN(CC)CC3)cc2)cc1	ZINC000770484188	1303275240	/nfs/dbraw/zinc/27/52/40/1303275240.db2.gz	CJGKOJZWBZZJLU-UHFFFAOYSA-N	0	3	349.478	3.453	20	30		EGEDHN
CC(C)[C@@H](CNCc1ccc(C#N)cc1F)NC(=O)OC(C)(C)C	ZINC000772920694	1303595348	/nfs/dbraw/zinc/59/53/48/1303595348.db2.gz	IPOAKAASSNVSOK-MRXNPFEDSA-N	0	3	335.423	3.336	20	30		EGEDHN
C=CC[C@@H](CO)CNCc1c(C)nn(-c2ccc(F)cc2)c1Cl	ZINC000774827264	1303865210	/nfs/dbraw/zinc/86/52/10/1303865210.db2.gz	OBGLXOURQYZHBA-CYBMUJFWSA-N	0	3	337.826	3.247	20	30		EGEDHN
Cc1cc(CN2CC[C@H](CNC(=O)OC(C)(C)C)C2)ccc1C#N	ZINC000774861868	1303868436	/nfs/dbraw/zinc/86/84/36/1303868436.db2.gz	FPTHQIPPLNOFGE-MRXNPFEDSA-N	0	3	329.444	3.213	20	30		EGEDHN
C[C@H](NCC#Cc1ccc(F)cc1)c1ccc(N2CCOCC2)cc1	ZINC000775254401	1303930405	/nfs/dbraw/zinc/93/04/05/1303930405.db2.gz	IKVSKBFKKFHCAP-KRWDZBQOSA-N	0	3	338.426	3.365	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H](CNC(=O)OC(C)(C)C)C1CC1	ZINC000775926972	1304062250	/nfs/dbraw/zinc/06/22/50/1304062250.db2.gz	DAVPGBQIJPAYAH-KRWDZBQOSA-N	0	3	329.444	3.293	20	30		EGEDHN
CN(C)[C@H](CNC(=O)Nc1nc(Cl)c(C#N)s1)c1ccccc1	ZINC000888406925	1304150956	/nfs/dbraw/zinc/15/09/56/1304150956.db2.gz	MTWVHYKTCIZPRJ-LLVKDONJSA-N	0	3	349.847	3.093	20	30		EGEDHN
C[C@@H](NCCNC(=O)c1ccc(Cl)cc1)c1ccc(C#N)c(F)c1	ZINC000776731513	1304189651	/nfs/dbraw/zinc/18/96/51/1304189651.db2.gz	CNVFNMDVJBBFGY-GFCCVEGCSA-N	0	3	345.805	3.431	20	30		EGEDHN
Cc1cccc(CN(CCN(C)C)C(=O)Cc2ccccc2CC#N)c1	ZINC000776889345	1304216463	/nfs/dbraw/zinc/21/64/63/1304216463.db2.gz	BUIKVTQDJXSULP-UHFFFAOYSA-N	0	3	349.478	3.194	20	30		EGEDHN
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NCc1cc(C#N)ccc1F	ZINC000779121113	1304531301	/nfs/dbraw/zinc/53/13/01/1304531301.db2.gz	SQICETTUMDOFKF-CXAGYDPISA-N	0	3	347.434	3.432	20	30		EGEDHN
Cc1c2occ(CC(=O)C(C#N)C(=O)NC(C)C)c2ccc1Cl	ZINC000892499554	1305408383	/nfs/dbraw/zinc/40/83/83/1305408383.db2.gz	YFEPMPCYBWHEGS-CYBMUJFWSA-N	0	3	332.787	3.171	20	30		EGEDHN
C=CCc1ccccc1OS(=O)(=O)c1ccc(CN(C)C)cc1	ZINC000788583904	1305975516	/nfs/dbraw/zinc/97/55/16/1305975516.db2.gz	XPMZTESDIJVEQR-UHFFFAOYSA-N	0	3	331.437	3.244	20	30		EGEDHN
CC(=N[N-]c1[nH+]ccn1C)c1ccc(OC[C@@H]2CCCCO2)c(F)c1	ZINC000790303864	1306295570	/nfs/dbraw/zinc/29/55/70/1306295570.db2.gz	YVCDGFIZBHEPDL-HNNXBMFYSA-N	0	3	346.406	3.343	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)Cc2cc(F)c(F)cc2F)c1	ZINC000793126590	1309300770	/nfs/dbraw/zinc/30/07/70/1309300770.db2.gz	UGYBACCZQSPNCE-ZDUSSCGKSA-N	0	3	346.308	3.302	20	30		EGEDHN
CN(C)c1ccc(C=NNCCN2CCCCC2)c(C(F)(F)F)c1	ZINC000794495627	1309538188	/nfs/dbraw/zinc/53/81/88/1309538188.db2.gz	SSEDWTNJIYQVOK-UHFFFAOYSA-N	0	3	342.409	3.181	20	30		EGEDHN
CC(N=Nc1cncnc1)c1ccc([O-])c(C[NH+]2CCCCC2)c1	ZINC000794976128	1309639173	/nfs/dbraw/zinc/63/91/73/1309639173.db2.gz	DNVCYOULXLNSCG-UHFFFAOYSA-N	0	3	325.416	3.004	20	30		EGEDHN
C#CCN(CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1	ZINC000796641112	1310053878	/nfs/dbraw/zinc/05/38/78/1310053878.db2.gz	WPNSYFKUBSKJCU-UHFFFAOYSA-N	0	3	337.379	3.059	20	30		EGEDHN
CC(C)(C)c1cnc(C(C#N)C(=O)c2ccc(N)c([N+](=O)[O-])c2)s1	ZINC000797568924	1310212648	/nfs/dbraw/zinc/21/26/48/1310212648.db2.gz	XZRUHPVEAOFXAT-JTQLQIEISA-N	0	3	344.396	3.421	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)c1	ZINC000798283203	1310336101	/nfs/dbraw/zinc/33/61/01/1310336101.db2.gz	WGWPSIJFPZQSGE-NRFANRHFSA-N	0	3	347.462	3.266	20	30		EGEDHN
C#CCCOc1ccc(CN2CCC[C@@H](Cc3nc(C)no3)C2)cc1	ZINC000897579278	1310393083	/nfs/dbraw/zinc/39/30/83/1310393083.db2.gz	SNFKPUIJFKYJPM-SFHVURJKSA-N	0	3	339.439	3.235	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)cc1C#N	ZINC000799366800	1310537586	/nfs/dbraw/zinc/53/75/86/1310537586.db2.gz	SXZADLFLERUMGV-OXQOHEQNSA-N	0	3	333.435	3.117	20	30		EGEDHN
CCCCN(CC(=O)N[C@](C)(C#N)C(C)C)Cc1ccccc1O	ZINC000801598407	1310972538	/nfs/dbraw/zinc/97/25/38/1310972538.db2.gz	ZDHWPCMJTXHECA-LJQANCHMSA-N	0	3	331.460	3.049	20	30		EGEDHN
C#CC1CCN(C(=O)NC[C@@H](c2ccc(C)cc2)N2CCCC2)CC1	ZINC000826020545	1320378811	/nfs/dbraw/zinc/37/88/11/1320378811.db2.gz	VBNVSXACLVSQES-FQEVSTJZSA-N	0	3	339.483	3.187	20	30		EGEDHN
Fc1ccc(CCN2CCC(N=Nc3ncc(Cl)cn3)CC2)cc1	ZINC000857223462	1328524968	/nfs/dbraw/zinc/52/49/68/1328524968.db2.gz	RUIIFPUZUCXOFS-UHFFFAOYSA-N	0	3	347.825	3.376	20	30		EGEDHN
CCOc1cc(CN(C)CCO[C@@H](C)C#N)ccc1OC(F)F	ZINC000801915845	1316965385	/nfs/dbraw/zinc/96/53/85/1316965385.db2.gz	VWJCJKZOGKWPLP-LBPRGKRZSA-N	0	3	328.359	3.047	20	30		EGEDHN
C[C@H](C#N)OCCN[C@H](COc1ccccc1F)c1ccccc1	ZINC000801937569	1316970127	/nfs/dbraw/zinc/97/01/27/1316970127.db2.gz	PZVZEXRBFBVWPV-CRAIPNDOSA-N	0	3	328.387	3.464	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](NCc2ccc(OC)c(F)c2)C1	ZINC001019232238	1317114714	/nfs/dbraw/zinc/11/47/14/1317114714.db2.gz	QPVKFXXRROHEAX-HNNXBMFYSA-N	0	3	334.435	3.127	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](N[C@H]3CCc4c3cc(F)cc4F)C2)C1	ZINC001019353503	1317189344	/nfs/dbraw/zinc/18/93/44/1317189344.db2.gz	NWPJVMMKYCKCMP-KSSFIOAISA-N	0	3	346.421	3.499	20	30		EGEDHN
C#Cc1ccc(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)cc1	ZINC000901002295	1317369817	/nfs/dbraw/zinc/36/98/17/1317369817.db2.gz	BLTMUXCVFVGSGI-UHFFFAOYSA-N	0	3	348.446	3.125	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC2(CCN(C/C(Cl)=C\Cl)CC2)CC1	ZINC000957520092	1317421435	/nfs/dbraw/zinc/42/14/35/1317421435.db2.gz	NXENMCVEYAYKMH-PCRWRXJSSA-N	0	3	344.286	3.170	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@H](NC(=O)C3CCCCC3)C2)c(F)c1	ZINC001019948176	1317471968	/nfs/dbraw/zinc/47/19/68/1317471968.db2.gz	GXKCSGJGNSXBEE-QAQDUYKDSA-N	0	3	329.419	3.014	20	30		EGEDHN
CC[C@@H](NCc1cccc(CS(C)(=O)=O)c1)c1cccc(C#N)c1	ZINC000902783416	1317615599	/nfs/dbraw/zinc/61/55/99/1317615599.db2.gz	DAWXWBJCHBIUDQ-LJQANCHMSA-N	0	3	342.464	3.344	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccccc2-c2ccncc2)C1	ZINC001020291712	1317629280	/nfs/dbraw/zinc/62/92/80/1317629280.db2.gz	MCLQWICPOHBWSG-WKILWMFISA-N	0	3	341.842	3.352	20	30		EGEDHN
CC[C@H](NCc1ccc(N2CCNC2=O)cc1)c1cccc(C#N)c1	ZINC000903088797	1317650664	/nfs/dbraw/zinc/65/06/64/1317650664.db2.gz	SXOKFPAMSMQUMQ-IBGZPJMESA-N	0	3	334.423	3.329	20	30		EGEDHN
C[C@@H]1CC[C@@H](CC(=O)N[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)C1	ZINC001020482432	1317716924	/nfs/dbraw/zinc/71/69/24/1317716924.db2.gz	FQXYWGZZLSOJTI-DTTOXWODSA-N	0	3	343.446	3.260	20	30		EGEDHN
C#Cc1ccc(CN2CC[C@@](C)(CNC(=O)OC(C)(C)C)C2)cc1	ZINC000809662133	1317859400	/nfs/dbraw/zinc/85/94/00/1317859400.db2.gz	AWMIFVPLPGMXSH-FQEVSTJZSA-N	0	3	328.456	3.405	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N[C@H]1C[C@H](NCc2ccccc2Cl)C1	ZINC001020726368	1317891792	/nfs/dbraw/zinc/89/17/92/1317891792.db2.gz	HQYMNJVKDSTRLD-OVWQWFNUSA-N	0	3	348.874	3.058	20	30		EGEDHN
Cc1nn(-c2ccccc2C)c(C)c1/C=C1\C(=O)c2ncnn2C1C	ZINC000905083562	1317922302	/nfs/dbraw/zinc/92/23/02/1317922302.db2.gz	FGXRELJHWGREMQ-CIKBWMHTSA-N	0	3	333.395	3.230	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc(OC)c(C3CC3)c2)C1	ZINC001020852292	1317955481	/nfs/dbraw/zinc/95/54/81/1317955481.db2.gz	BMSORBBRWMDDCE-SHTZXODSSA-N	0	3	334.847	3.176	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1	ZINC000810192180	1317972833	/nfs/dbraw/zinc/97/28/33/1317972833.db2.gz	LIGXYPDRRBSHNJ-LAUBAEHRSA-N	0	3	332.447	3.162	20	30		EGEDHN
CC[C@@H](C)c1ccc(NC(=O)C(C#N)C(=O)c2cccc(C#N)n2)cc1	ZINC000810532363	1318019067	/nfs/dbraw/zinc/01/90/67/1318019067.db2.gz	CZPDDJLTHFBGAN-CXAGYDPISA-N	0	3	346.390	3.428	20	30		EGEDHN
COC(=O)c1cccc(CC(=O)C(C#N)c2nc3ccccc3o2)c1	ZINC000810537229	1318019230	/nfs/dbraw/zinc/01/92/30/1318019230.db2.gz	ZOKGLQCQSBKAQQ-AWEZNQCLSA-N	0	3	334.331	3.033	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC001020967685	1318020391	/nfs/dbraw/zinc/02/03/91/1318020391.db2.gz	KUUFWFUBGXHTOK-JOCQHMNTSA-N	0	3	332.753	3.308	20	30		EGEDHN
Cc1cc(C)nc(CN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1	ZINC000929928059	1328740647	/nfs/dbraw/zinc/74/06/47/1328740647.db2.gz	WDHMUNKBALDUMF-UHFFFAOYSA-N	0	3	348.450	3.421	20	30		EGEDHN
C#CCC1(OC(=O)C2CCN(c3ccc(Cl)cc3)C2=O)CCC1	ZINC000810749875	1318052608	/nfs/dbraw/zinc/05/26/08/1318052608.db2.gz	XKHRMQQUVFYROR-HNNXBMFYSA-N	0	3	331.799	3.182	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2sc(Cl)nc2Cl)C1	ZINC001021059944	1318063575	/nfs/dbraw/zinc/06/35/75/1318063575.db2.gz	OTCOZIRFEUMBDI-LJGSYFOKSA-N	0	3	340.663	3.053	20	30		EGEDHN
Cc1cocc1C(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1cccc(C#N)c1	ZINC001021345313	1318200230	/nfs/dbraw/zinc/20/02/30/1318200230.db2.gz	DJJWSKUDRVOYCN-YQQQUEKLSA-N	0	3	349.434	3.385	20	30		EGEDHN
Cc1occc1C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)s1	ZINC000959865736	1318238026	/nfs/dbraw/zinc/23/80/26/1318238026.db2.gz	NLMFFCWZYNDXJJ-AWEZNQCLSA-N	0	3	343.452	3.306	20	30		EGEDHN
CC(C)(F)C(=O)N1CCC[C@@H]2CN(Cc3ccc(C#N)cc3)CC[C@H]21	ZINC001021497471	1318303912	/nfs/dbraw/zinc/30/39/12/1318303912.db2.gz	XXTBREMNRRFMPG-QZTJIDSGSA-N	0	3	343.446	3.119	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@H]2CN(Cc3ccc(C#N)cc3)CC[C@H]21	ZINC001021512115	1318336912	/nfs/dbraw/zinc/33/69/12/1318336912.db2.gz	UYIUKSNNMLHVON-VQTJNVASSA-N	0	3	337.467	3.337	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@H](CCCN3C(=O)C3CC=CC3)C2)c1	ZINC001021548810	1318388280	/nfs/dbraw/zinc/38/82/80/1318388280.db2.gz	SBPCFMYGRRVBCG-RTWAWAEBSA-N	0	3	349.478	3.337	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@@H](CCCN3C(=O)/C=C\C3CC3)C2)cc1	ZINC001021550564	1318391384	/nfs/dbraw/zinc/39/13/84/1318391384.db2.gz	IMHLAPLSDIFZKD-FSDCKFOESA-N	0	3	349.478	3.337	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2scc(C)c2Cl)C1	ZINC001021586719	1318431586	/nfs/dbraw/zinc/43/15/86/1318431586.db2.gz	DARUGVZTAHLGIA-ZIAGYGMSSA-N	0	3	336.888	3.270	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1c(C)noc1C(C)C	ZINC000960277218	1318440178	/nfs/dbraw/zinc/44/01/78/1318440178.db2.gz	ASZILQOLWPHMFR-SJLPKXTDSA-N	0	3	339.439	3.278	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1c[nH]nc1C(C)C	ZINC000960281664	1318443299	/nfs/dbraw/zinc/44/32/99/1318443299.db2.gz	QIUOBTFRQMOHAZ-IEBWSBKVSA-N	0	3	338.455	3.095	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cccc2c[nH]nc21	ZINC000960294516	1318447898	/nfs/dbraw/zinc/44/78/98/1318447898.db2.gz	ZKMNHUWBYFYHSE-UYAOXDASSA-N	0	3	346.434	3.124	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cncc2sccc21	ZINC000960295045	1318448168	/nfs/dbraw/zinc/44/81/68/1318448168.db2.gz	IWKCQIWPLYBZMN-IEBWSBKVSA-N	0	3	349.459	3.468	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1nccc2ccccc21	ZINC000960300189	1318450698	/nfs/dbraw/zinc/45/06/98/1318450698.db2.gz	UPCFFRHEUOZBGK-WOJBJXKFSA-N	0	3	343.430	3.406	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ncsc1C1CC1	ZINC000960305242	1318452719	/nfs/dbraw/zinc/45/27/19/1318452719.db2.gz	WJVPUKNYZMFEDX-HZPDHXFCSA-N	0	3	339.464	3.192	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)Cc2cccc(CC)c2)C1	ZINC001021617599	1318466694	/nfs/dbraw/zinc/46/66/94/1318466694.db2.gz	WCRJBGAXLFUREJ-RTWAWAEBSA-N	0	3	338.495	3.128	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2coc3cc(F)ccc32)C1	ZINC001021619377	1318469097	/nfs/dbraw/zinc/46/90/97/1318469097.db2.gz	KSVKASSQIUEIFU-RDTXWAMCSA-N	0	3	340.398	3.132	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(-n3cccc3)cc2)C1	ZINC001021626734	1318478103	/nfs/dbraw/zinc/47/81/03/1318478103.db2.gz	HSHNNSQIHLFCAW-FPOVZHCZSA-N	0	3	347.462	3.037	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cccc(-n3cccc3)c2)C1	ZINC001021627073	1318479340	/nfs/dbraw/zinc/47/93/40/1318479340.db2.gz	LBPBQUSMIVNPEI-TZIWHRDSSA-N	0	3	347.462	3.037	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)Cc2cccc(C(F)F)c2)C1	ZINC001021633336	1318486788	/nfs/dbraw/zinc/48/67/88/1318486788.db2.gz	QINHUPHJYOZPQT-QZTJIDSGSA-N	0	3	346.421	3.113	20	30		EGEDHN
CC(COC(=O)c1cccc(Oc2ccc(C#N)cc2)c1)[N+](=O)[O-]	ZINC000813110001	1318501168	/nfs/dbraw/zinc/50/11/68/1318501168.db2.gz	YJHZLJSTIYKUCT-GFCCVEGCSA-N	0	3	326.308	3.173	20	30		EGEDHN
Cc1cc(C#N)ccc1Oc1ccc(C(=O)OCC(C)[N+](=O)[O-])cc1	ZINC000813115750	1318502121	/nfs/dbraw/zinc/50/21/21/1318502121.db2.gz	ZDMYMNPWMCGSII-ZDUSSCGKSA-N	0	3	340.335	3.481	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc3c(ccc(C)c3C)[nH]2)C1	ZINC001021651764	1318512463	/nfs/dbraw/zinc/51/24/63/1318512463.db2.gz	FOGXHENDPNDKPF-UWJYYQICSA-N	0	3	349.478	3.344	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2c(C)cc(C)cc2C)C1	ZINC001021663804	1318525497	/nfs/dbraw/zinc/52/54/97/1318525497.db2.gz	DYKRLJHPWPEKAW-PZJWPPBQSA-N	0	3	338.495	3.100	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(C)c(Cl)c2)C1	ZINC001021666516	1318527890	/nfs/dbraw/zinc/52/78/90/1318527890.db2.gz	UWRMYERZTHLIDF-AEFFLSMTSA-N	0	3	330.859	3.208	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)Cc2cccc(Cl)c2)C1	ZINC001021664831	1318527998	/nfs/dbraw/zinc/52/79/98/1318527998.db2.gz	IVLDDBOLFIDSMK-HKUYNNGSSA-N	0	3	344.886	3.219	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(C)c(Cl)c2)C1	ZINC001021666517	1318528104	/nfs/dbraw/zinc/52/81/04/1318528104.db2.gz	UWRMYERZTHLIDF-FUHWJXTLSA-N	0	3	330.859	3.208	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(C(C)C)oc2C)C1	ZINC001021703641	1318573746	/nfs/dbraw/zinc/57/37/46/1318573746.db2.gz	ANXNKANGZBIXCQ-SJLPKXTDSA-N	0	3	328.456	3.271	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc3ccncc3c2)C1	ZINC001021711498	1318587869	/nfs/dbraw/zinc/58/78/69/1318587869.db2.gz	XCPHJIJOERFNLF-TZIWHRDSSA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(Cl)cc2)C1	ZINC001021720693	1318604475	/nfs/dbraw/zinc/60/44/75/1318604475.db2.gz	YQCPFUWEADVGLW-SJLPKXTDSA-N	0	3	330.859	3.290	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc3ccccc3c2)C1	ZINC001021721313	1318605345	/nfs/dbraw/zinc/60/53/45/1318605345.db2.gz	DXKHCLLUXNZVEC-NHCUHLMSSA-N	0	3	332.447	3.400	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)[C@H]1[C@@H]2CCC[C@@H]21	ZINC000960524137	1318636681	/nfs/dbraw/zinc/63/66/81/1318636681.db2.gz	CFBPSAKLUVWJBO-VNTMZGSJSA-N	0	3	337.467	3.027	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2sc(C(C)C)nc2C)C1	ZINC001021733435	1318640096	/nfs/dbraw/zinc/64/00/96/1318640096.db2.gz	MUHNFUXYCIYERH-CVEARBPZSA-N	0	3	345.512	3.135	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2c[nH]c3c2cccc3CC)C1	ZINC001021742991	1318656855	/nfs/dbraw/zinc/65/68/55/1318656855.db2.gz	OJARJLRYHVVCLD-YLJYHZDGSA-N	0	3	349.478	3.290	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@@H](NC(=O)C3CCCCC3)C2)c1	ZINC001021786034	1318681591	/nfs/dbraw/zinc/68/15/91/1318681591.db2.gz	WITOSHGMQFYJGI-CALCHBBNSA-N	0	3	329.419	3.014	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@@H]1CN(C)Cc1cccc(C#N)c1)C1CCC1	ZINC000960701562	1318801920	/nfs/dbraw/zinc/80/19/20/1318801920.db2.gz	LTDHYWHXCODENN-OXQOHEQNSA-N	0	3	339.483	3.417	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)[C@H]1CCC1(F)F	ZINC000960702169	1318803060	/nfs/dbraw/zinc/80/30/60/1318803060.db2.gz	PAFCWJQQAPJWEN-DLBZAZTESA-N	0	3	347.409	3.026	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)[C@@H]1CCC1(F)F	ZINC000960702172	1318804899	/nfs/dbraw/zinc/80/48/99/1318804899.db2.gz	PAFCWJQQAPJWEN-SJORKVTESA-N	0	3	347.409	3.026	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)[C@@H]2CCC[C@@H]2CCC)C1	ZINC001022333170	1318894971	/nfs/dbraw/zinc/89/49/71/1318894971.db2.gz	NWWJDFILMLUFTK-BYNSBNAKSA-N	0	3	343.309	3.348	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)[C@]1(C)C=CCC1	ZINC000960792583	1318897631	/nfs/dbraw/zinc/89/76/31/1318897631.db2.gz	QPNPCJMURQNGPX-TZIWHRDSSA-N	0	3	337.467	3.337	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)[C@H]1CCC1(C)C	ZINC000960814408	1318936007	/nfs/dbraw/zinc/93/60/07/1318936007.db2.gz	JAPNZRCDQCEVJR-RTBURBONSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@@H]2CN(C)C[C@H]2CC(C)(C)CO2)CC1	ZINC000960835271	1318964306	/nfs/dbraw/zinc/96/43/06/1318964306.db2.gz	XPGZZCNQNGGEJP-RTBURBONSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2nsc3ccc(C)cc32)C1	ZINC001022537227	1318981214	/nfs/dbraw/zinc/98/12/14/1318981214.db2.gz	HTPVJBMYLMVOQU-TXEJJXNPSA-N	0	3	335.860	3.208	20	30		EGEDHN
CC1(C)CCC[C@H]1C(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001022557303	1318988476	/nfs/dbraw/zinc/98/84/76/1318988476.db2.gz	MSTNGAKBZSVAFK-BBWFWOEESA-N	0	3	343.446	3.260	20	30		EGEDHN
C[C@@H]1CC[C@H](CC(=O)N[C@H]2C[C@@H](NCc3ccc(C#N)cc3F)C2)C1	ZINC001022563366	1318993433	/nfs/dbraw/zinc/99/34/33/1318993433.db2.gz	GPVYUBJLVVSNSR-NONVJHHQSA-N	0	3	343.446	3.260	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H]1CN(C)Cc1ccc(C#N)cc1)C(C)(F)F	ZINC000960870839	1319014003	/nfs/dbraw/zinc/01/40/03/1319014003.db2.gz	UEDTXCBJAUVWMF-RHSMWYFYSA-N	0	3	349.425	3.272	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)C1(CF)CCC1	ZINC000960876778	1319017233	/nfs/dbraw/zinc/01/72/33/1319017233.db2.gz	ZZFPMWKYQBPEJT-SFHVURJKSA-N	0	3	343.446	3.121	20	30		EGEDHN
C[C@H]1CCCC[C@@H]1C(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001022620402	1319020349	/nfs/dbraw/zinc/02/03/49/1319020349.db2.gz	NHRIOOLMCJNISU-RUGDWHBFSA-N	0	3	343.446	3.260	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CCC[C@@H]1CN(C)Cc1ccc(C#N)cc1	ZINC000960904478	1319046328	/nfs/dbraw/zinc/04/63/28/1319046328.db2.gz	GSXNVPOQLWMTFY-VQIMIIECSA-N	0	3	327.472	3.273	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccccc2OC2CCC2)C1	ZINC001022687740	1319068623	/nfs/dbraw/zinc/06/86/23/1319068623.db2.gz	LJBABRBDSAESJI-OKILXGFUSA-N	0	3	334.847	3.221	20	30		EGEDHN
Cc1cc(C#N)cnc1C(=O)O[C@@H]1CCCN(Cc2ccccc2)[C@@H]1C	ZINC000816471806	1319162087	/nfs/dbraw/zinc/16/20/87/1319162087.db2.gz	NJPDWQHRAGAJBA-VQIMIIECSA-N	0	3	349.434	3.472	20	30		EGEDHN
CCC(=O)N1CCC[C@@H]([C@@H]2CCN(Cc3ccccc3C#N)C2)C1	ZINC000961065383	1319181624	/nfs/dbraw/zinc/18/16/24/1319181624.db2.gz	JOPAWXPREXICNC-RTBURBONSA-N	0	3	325.456	3.029	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]([C@H]3CCCN(C(=O)C4CC4)C3)C2)s1	ZINC000961082316	1319194906	/nfs/dbraw/zinc/19/49/06/1319194906.db2.gz	RRJRCWBMISQKSB-JKSUJKDBSA-N	0	3	343.496	3.090	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2c2cccc(F)c2F)C1	ZINC001023110283	1319263834	/nfs/dbraw/zinc/26/38/34/1319263834.db2.gz	WMYMKAYLPMMHKB-UZGDPCLZSA-N	0	3	340.801	3.058	20	30		EGEDHN
C#CC[C@H](NCc1ccc(CN2CCOCC2)cc1)c1ccccc1	ZINC000817275343	1319310231	/nfs/dbraw/zinc/31/02/31/1319310231.db2.gz	FQOPRACPVLZIFS-QFIPXVFZSA-N	0	3	334.463	3.373	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H](CNC(=O)C3CCCC3)C2)cc1	ZINC001023196778	1319322282	/nfs/dbraw/zinc/32/22/82/1319322282.db2.gz	XEIOEMHWSYYCMW-SFHVURJKSA-N	0	3	325.456	3.077	20	30		EGEDHN
CC(C)[C@@H](CNCc1ccc(C#N)c(F)c1)NC(=O)OC(C)(C)C	ZINC000817407068	1319349995	/nfs/dbraw/zinc/34/99/95/1319349995.db2.gz	BWTNAUICEZCNCG-MRXNPFEDSA-N	0	3	335.423	3.336	20	30		EGEDHN
CC(=O)N1CCC([C@H]2CCCN(Cc3cc(C#N)ccc3F)C2)CC1	ZINC000961308919	1319468052	/nfs/dbraw/zinc/46/80/52/1319468052.db2.gz	UXCOTDXRDWJIGI-SFHVURJKSA-N	0	3	343.446	3.168	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC001023372440	1319484509	/nfs/dbraw/zinc/48/45/09/1319484509.db2.gz	SPSQCSSGTTYWIS-CYBMUJFWSA-N	0	3	338.373	3.228	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](C2CCN(C(=O)c3cccn3C)CC2)C1	ZINC000961330505	1319485808	/nfs/dbraw/zinc/48/58/08/1319485808.db2.gz	KPXCNVVZFRLFRJ-KRWDZBQOSA-N	0	3	349.906	3.342	20	30		EGEDHN
C=C(C)CN1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1cc2c(o1)c(F)ccc2C	ZINC000961336148	1319491732	/nfs/dbraw/zinc/49/17/32/1319491732.db2.gz	OFYPZLOVSZYJOY-HALDLXJZSA-N	0	3	328.387	3.116	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](C2CCN(C(=O)[C@H](CC)OC)CC2)C1	ZINC000961342946	1319498170	/nfs/dbraw/zinc/49/81/70/1319498170.db2.gz	RVWXGYMEWOYBEF-SJORKVTESA-N	0	3	342.911	3.115	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N1CCC[C@H]1c1ccccc1C(F)(F)F	ZINC000818109448	1319501545	/nfs/dbraw/zinc/50/15/45/1319501545.db2.gz	CPIXJISCPLOGSO-GJZGRUSLSA-N	0	3	339.361	3.390	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](C2CCN(C(=O)[C@H]3CC3(F)F)CC2)C1	ZINC000961358413	1319516030	/nfs/dbraw/zinc/51/60/30/1319516030.db2.gz	FVWYLOCCGOREDW-LSDHHAIUSA-N	0	3	346.849	3.345	20	30		EGEDHN
C#CCN1CCC[C@@H](CNC(=O)c2ccccc2C(C)(C)CC)C1	ZINC001023438046	1319532652	/nfs/dbraw/zinc/53/26/52/1319532652.db2.gz	NHBRJJNBVDCGHK-KRWDZBQOSA-N	0	3	326.484	3.449	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc(C)c3ccccc3n2)C1	ZINC001023446900	1319547640	/nfs/dbraw/zinc/54/76/40/1319547640.db2.gz	AIOQTNYPNFCUPR-QGZVFWFLSA-N	0	3	335.451	3.008	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@H]2CCCN(C[C@H](F)CC)C2)cc1	ZINC001023448813	1319549400	/nfs/dbraw/zinc/54/94/00/1319549400.db2.gz	YQXIRIQEQCPEKM-SJLPKXTDSA-N	0	3	348.462	3.441	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc(C)nn2C(CC)CC)C1	ZINC001023451074	1319554035	/nfs/dbraw/zinc/55/40/35/1319554035.db2.gz	DXMKFHNGBFCHAU-KRWDZBQOSA-N	0	3	344.503	3.018	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN[C@@H](c2ccc(F)cc2)[C@H]2CCCO2)cc1	ZINC000818968346	1319595140	/nfs/dbraw/zinc/59/51/40/1319595140.db2.gz	RLMJZHRILJZWAG-AQNXPRMDSA-N	0	3	340.398	3.241	20	30		EGEDHN
C#CCN1CCC[C@@H](CNC(=O)c2cc(C3CC3)oc2C2CC2)C1	ZINC001023494793	1319603885	/nfs/dbraw/zinc/60/38/85/1319603885.db2.gz	QRUPBKNILQUWQR-AWEZNQCLSA-N	0	3	326.440	3.109	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc(C)c(C)cc2Cl)C1	ZINC001023529747	1319637174	/nfs/dbraw/zinc/63/71/74/1319637174.db2.gz	INGIPAZMCYUQRH-MRXNPFEDSA-N	0	3	332.875	3.422	20	30		EGEDHN
CC1(C)CC[C@@H]1C(=O)NC[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001023536109	1319641984	/nfs/dbraw/zinc/64/19/84/1319641984.db2.gz	QGYYJJXEPQXCID-RBUKOAKNSA-N	0	3	339.483	3.323	20	30		EGEDHN
Cc1cc2ccccc2n1CC(=O)C(C#N)C(=O)NC1CCCCC1	ZINC000916895467	1319721124	/nfs/dbraw/zinc/72/11/24/1319721124.db2.gz	LJHNOHGNKRCQHL-KRWDZBQOSA-N	0	3	337.423	3.108	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)COc2ccccc2C)cc1	ZINC000916909575	1319722951	/nfs/dbraw/zinc/72/29/51/1319722951.db2.gz	LEHDWJIUJODVQY-KRWDZBQOSA-N	0	3	336.391	3.284	20	30		EGEDHN
N#CC(C(=O)COCc1ccccc1)C(=O)Nc1ccccc1Cl	ZINC000916912128	1319724262	/nfs/dbraw/zinc/72/42/62/1319724262.db2.gz	ZBCUGPYSZVJLOH-CQSZACIVSA-N	0	3	342.782	3.204	20	30		EGEDHN
CCN1CCN(c2ccc(NC(=O)Nc3cccc(C#N)c3)cc2)CC1	ZINC000916996763	1319734622	/nfs/dbraw/zinc/73/46/22/1319734622.db2.gz	UKPKAJXLKAYUDR-UHFFFAOYSA-N	0	3	349.438	3.344	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc(C(CC)CC)no2)C1	ZINC001023634824	1319755622	/nfs/dbraw/zinc/75/56/22/1319755622.db2.gz	SWMGWDOCQLXMQN-OAHLLOKOSA-N	0	3	331.460	3.043	20	30		EGEDHN
Cc1ccc2c(C)cc(N=NC3CCN(CCO)CC3)nc2c1C	ZINC000819803262	1319789018	/nfs/dbraw/zinc/78/90/18/1319789018.db2.gz	LRIOTGXXCUDWSS-UHFFFAOYSA-N	0	3	326.444	3.016	20	30		EGEDHN
N#Cc1sc(N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)nc1Cl	ZINC000819946660	1319809104	/nfs/dbraw/zinc/80/91/04/1319809104.db2.gz	NOLKBAXZLVHXGT-UONOGXRCSA-N	0	3	344.871	3.379	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1cc(C(F)F)ccc1Cl	ZINC000930440004	1328855086	/nfs/dbraw/zinc/85/50/86/1328855086.db2.gz	DPOPMHSJNXWMKV-UHFFFAOYSA-N	0	3	329.778	3.354	20	30		EGEDHN
C=CCc1cc(C(=O)NC[C@H](C)N2CCCCC2)cc(OC)c1OC	ZINC000917839043	1319880032	/nfs/dbraw/zinc/88/00/32/1319880032.db2.gz	VQNKMDQWGDJXTI-HNNXBMFYSA-N	0	3	346.471	3.037	20	30		EGEDHN
C=C1CC(C)(C(=O)NC2CC(CNCc3cc(O)ccc3Cl)C2)C1	ZINC000962283547	1319900345	/nfs/dbraw/zinc/90/03/45/1319900345.db2.gz	UFZHGNSIHDSOIW-UHFFFAOYSA-N	0	3	348.874	3.386	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N(Cc1ccc([C@@H]2C[C@H]2C)o1)C1CC1	ZINC000838624296	1320796215	/nfs/dbraw/zinc/79/62/15/1320796215.db2.gz	QIOAKCVTPZZNBS-CRAIPNDOSA-N	0	3	343.471	3.032	20	30		EGEDHN
C[C@H](N[C@@H]1CCc2ccc(C#N)cc21)c1ccc(N2CCNC2=O)cc1	ZINC000842903419	1321448611	/nfs/dbraw/zinc/44/86/11/1321448611.db2.gz	ROZSCEYZBBHYQX-VBKZILBWSA-N	0	3	346.434	3.426	20	30		EGEDHN
C[C@H](NC(=O)OC(C)(C)C)C(=O)C(C#N)c1nc(C2CC2)cs1	ZINC000842939122	1321451087	/nfs/dbraw/zinc/45/10/87/1321451087.db2.gz	ONSGKMYDMVURNR-GXSJLCMTSA-N	0	3	335.429	3.110	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847747782	1321900189	/nfs/dbraw/zinc/90/01/89/1321900189.db2.gz	QJRRYQZAXBWOLM-QGZVFWFLSA-N	0	3	332.419	3.330	20	30		EGEDHN
COc1cccc([C@H](C/N=C\c2cccc(O)c2O)N2CCCC2)c1	ZINC000920945423	1322238185	/nfs/dbraw/zinc/23/81/85/1322238185.db2.gz	YWLBCZWWRVCLCW-PKIWBCANSA-N	0	3	340.423	3.362	20	30		EGEDHN
C[C@@H](NCc1ccc(N2CCCNC2=O)cc1)c1ccc(C#N)cc1	ZINC000850574028	1322270369	/nfs/dbraw/zinc/27/03/69/1322270369.db2.gz	AQZDFFWXAOJRGG-OAHLLOKOSA-N	0	3	334.423	3.329	20	30		EGEDHN
CC(C)[C@H](NCc1cc(C#N)ccc1Br)C(C)(C)O	ZINC000922049892	1322445137	/nfs/dbraw/zinc/44/51/37/1322445137.db2.gz	AAAHYIRQPILSGD-AWEZNQCLSA-N	0	3	325.250	3.206	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCN(C(=O)CCC2CCC2)C1	ZINC001023919923	1323025838	/nfs/dbraw/zinc/02/58/38/1323025838.db2.gz	AWQLDLFGURTTPZ-SFHVURJKSA-N	0	3	339.483	3.467	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N1CCC[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001023936248	1323041035	/nfs/dbraw/zinc/04/10/35/1323041035.db2.gz	YKJAKKDWICAPFV-RDTXWAMCSA-N	0	3	343.446	3.072	20	30		EGEDHN
CC[C@@H](SC)C(=O)N1CCC[C@H](CNCc2ccccc2C#N)C1	ZINC001023937731	1323042435	/nfs/dbraw/zinc/04/24/35/1323042435.db2.gz	OMGNJVMDASYJFV-CRAIPNDOSA-N	0	3	345.512	3.028	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](CNCc2ccccc2C#N)C1	ZINC001024095037	1323126761	/nfs/dbraw/zinc/12/67/61/1323126761.db2.gz	PCGUZOYGAMZREJ-INIZCTEOSA-N	0	3	325.456	3.099	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H](CNCc2ncc(C)s2)C1	ZINC001024137919	1323162966	/nfs/dbraw/zinc/16/29/66/1323162966.db2.gz	VXORISZRNIFSCR-MAUKXSAKSA-N	0	3	335.517	3.382	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCN(C(=O)C2CC3(CC3)C2)C1	ZINC001024149206	1323175291	/nfs/dbraw/zinc/17/52/91/1323175291.db2.gz	HFFWYOHPFPTTIX-MRXNPFEDSA-N	0	3	337.467	3.077	20	30		EGEDHN
C=CCN(C[C@@H](O)c1ccc(Br)cc1)[C@@H](C)COC	ZINC000852358461	1323182289	/nfs/dbraw/zinc/18/22/89/1323182289.db2.gz	SPQLCDKBDQVRDA-SWLSCSKDSA-N	0	3	328.250	3.005	20	30		EGEDHN
CC(C)(C)C(=O)N1CCC[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001024246368	1323230476	/nfs/dbraw/zinc/23/04/76/1323230476.db2.gz	CGRSEMUVBWUDKA-CQSZACIVSA-N	0	3	331.435	3.072	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1c(Cl)n[nH]c1C1CC1	ZINC001024477102	1323429906	/nfs/dbraw/zinc/42/99/06/1323429906.db2.gz	ILDFNZRTEGKJAQ-ZDUSSCGKSA-N	0	3	336.867	3.101	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cc(C)n([C@@H](C)CC)n1	ZINC001024517681	1323467481	/nfs/dbraw/zinc/46/74/81/1323467481.db2.gz	CQTGQCKZOUUNJD-RDJZCZTQSA-N	0	3	332.492	3.323	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@@H]1CCc2cc(F)ccc21	ZINC001024556365	1323495169	/nfs/dbraw/zinc/49/51/69/1323495169.db2.gz	FTEAQWBHCZVFTB-IEBWSBKVSA-N	0	3	330.447	3.402	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cc(-c2cccs2)n[nH]1	ZINC001024661359	1323576255	/nfs/dbraw/zinc/57/62/55/1323576255.db2.gz	DIYGHRRFNGUGAA-AWEZNQCLSA-N	0	3	344.484	3.299	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1coc(C2CCCCC2)n1	ZINC001024819009	1323723617	/nfs/dbraw/zinc/72/36/17/1323723617.db2.gz	KETMZPHVPLOEBC-QGZVFWFLSA-N	0	3	343.471	3.330	20	30		EGEDHN
CC(C)CC(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001024850261	1323743553	/nfs/dbraw/zinc/74/35/53/1323743553.db2.gz	KDJIFALQXOTECO-QGZVFWFLSA-N	0	3	331.435	3.214	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001024876277	1323761770	/nfs/dbraw/zinc/76/17/70/1323761770.db2.gz	LFMYDVBNBPTJRH-WMLDXEAASA-N	0	3	331.435	3.214	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)s1	ZINC001025040538	1323843181	/nfs/dbraw/zinc/84/31/81/1323843181.db2.gz	GCGGWLKREKPXTN-AWEZNQCLSA-N	0	3	331.485	3.303	20	30		EGEDHN
CC1(C(=O)N2CCCC[C@@H]2CNCc2ccc(C#N)s2)CC=CC1	ZINC001025066917	1323866390	/nfs/dbraw/zinc/86/63/90/1323866390.db2.gz	HUVDFGVQGUJECQ-OAHLLOKOSA-N	0	3	343.496	3.447	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCCC[C@H]2CNCc2c(C)onc2CC)C1	ZINC001025074076	1323874778	/nfs/dbraw/zinc/87/47/78/1323874778.db2.gz	CNCKKNKQDAMSOJ-INIZCTEOSA-N	0	3	345.487	3.372	20	30		EGEDHN
O=C(C#CC1CC1)N1CCCC[C@@H]1[C@@H]1CCCN1CCC(F)(F)F	ZINC001025229614	1324015179	/nfs/dbraw/zinc/01/51/79/1324015179.db2.gz	NCDGULZKLYTBAF-JKSUJKDBSA-N	0	3	342.405	3.198	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(C)nc(C)c1	ZINC001025237098	1324027992	/nfs/dbraw/zinc/02/79/92/1324027992.db2.gz	XIVPIOZYFIELSE-WOJBJXKFSA-N	0	3	339.483	3.181	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc(F)c(F)c1	ZINC001025239891	1324032573	/nfs/dbraw/zinc/03/25/73/1324032573.db2.gz	JXCDXRVJQHGCPM-ZWKOTPCHSA-N	0	3	332.394	3.057	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1c[nH]nc1C(C)C	ZINC001025245483	1324043189	/nfs/dbraw/zinc/04/31/89/1324043189.db2.gz	NDICJTJRMURLKM-QZTJIDSGSA-N	0	3	342.487	3.016	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)COC1CCCCC1	ZINC001025245545	1324043593	/nfs/dbraw/zinc/04/35/93/1324043593.db2.gz	NYFRARDIISRLLQ-WOJBJXKFSA-N	0	3	346.515	3.205	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1occ2c1CCC2	ZINC001025255958	1324063231	/nfs/dbraw/zinc/06/32/31/1324063231.db2.gz	UGZRXNXQJPIIOB-ZWKOTPCHSA-N	0	3	328.456	3.413	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cccc(F)c1F	ZINC001025258816	1324066947	/nfs/dbraw/zinc/06/69/47/1324066947.db2.gz	JFNSGWJUOAFZRM-QZTJIDSGSA-N	0	3	346.421	3.447	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc[nH]c1C1CC1	ZINC001025259135	1324069533	/nfs/dbraw/zinc/06/95/33/1324069533.db2.gz	LPNGTAYPESYBGI-RTBURBONSA-N	0	3	339.483	3.375	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc(OC)cc1C	ZINC001025263964	1324074954	/nfs/dbraw/zinc/07/49/54/1324074954.db2.gz	STUAJXBHIYCHHK-VQTJNVASSA-N	0	3	340.467	3.096	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc(Cl)[nH]1	ZINC001025268691	1324081132	/nfs/dbraw/zinc/08/11/32/1324081132.db2.gz	FBMYZMLAXLNYHV-HOTGVXAUSA-N	0	3	333.863	3.151	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccn(C)c1CC	ZINC001025269095	1324082013	/nfs/dbraw/zinc/08/20/13/1324082013.db2.gz	KVNKBWPGNRBUKA-UXHICEINSA-N	0	3	341.499	3.070	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cnc2ccccc2c1	ZINC001025270579	1324086932	/nfs/dbraw/zinc/08/69/32/1324086932.db2.gz	DUNUUARRDDBEKE-RTWAWAEBSA-N	0	3	347.462	3.327	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)C1(C(F)(F)F)CC1	ZINC001025271890	1324087144	/nfs/dbraw/zinc/08/71/44/1324087144.db2.gz	JPJISVAJJJWBMH-LSDHHAIUSA-N	0	3	342.405	3.198	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cncc(Cl)c1	ZINC001025278398	1324099527	/nfs/dbraw/zinc/09/95/27/1324099527.db2.gz	SHJUPUWFLMEZCM-MSOLQXFVSA-N	0	3	345.874	3.217	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc2c(C)cccn2c1	ZINC001025289214	1324112689	/nfs/dbraw/zinc/11/26/89/1324112689.db2.gz	OKADLTKGTIDRMZ-PMACEKPBSA-N	0	3	349.478	3.340	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1sccc1OC	ZINC001025289955	1324115023	/nfs/dbraw/zinc/11/50/23/1324115023.db2.gz	VWNFDIYPTWUMEB-GJZGRUSLSA-N	0	3	334.485	3.402	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccccc1Cl	ZINC001025291943	1324115421	/nfs/dbraw/zinc/11/54/21/1324115421.db2.gz	DCQFZDZCFLOHAG-QZTJIDSGSA-N	0	3	330.859	3.432	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1c(F)cccc1F	ZINC001025292197	1324116962	/nfs/dbraw/zinc/11/69/62/1324116962.db2.gz	GQYZIJLUEWFBDY-ROUUACIJSA-N	0	3	346.421	3.447	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ncccc1Cl	ZINC001025293045	1324119371	/nfs/dbraw/zinc/11/93/71/1324119371.db2.gz	OYNWWYDVJADQAX-HZPDHXFCSA-N	0	3	333.863	3.380	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)C(C)(C)c1ccccc1	ZINC001025295487	1324125596	/nfs/dbraw/zinc/12/55/96/1324125596.db2.gz	GKIBDZOUZCVAPS-WOJBJXKFSA-N	0	3	338.495	3.443	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc(OCC)cc1	ZINC001025296554	1324128142	/nfs/dbraw/zinc/12/81/42/1324128142.db2.gz	KFHQWFIGKVUPRE-PMACEKPBSA-N	0	3	340.467	3.178	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)CCc1ccc(C)o1	ZINC001025301403	1324135069	/nfs/dbraw/zinc/13/50/69/1324135069.db2.gz	JCUVLJCEPPSBHV-WOJBJXKFSA-N	0	3	342.483	3.389	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2c(C)cc(F)cc2C)C1	ZINC001025505547	1324352764	/nfs/dbraw/zinc/35/27/64/1324352764.db2.gz	IAJFGGAHKNWQOI-IRXDYDNUSA-N	0	3	330.447	3.296	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc3c(ccc(C)c3C)[nH]2)C1	ZINC001025506117	1324355313	/nfs/dbraw/zinc/35/53/13/1324355313.db2.gz	OQPGOAFCXWQYMX-SJORKVTESA-N	0	3	337.467	3.248	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc3ccccc3n2C)C1	ZINC001025518836	1324362365	/nfs/dbraw/zinc/36/23/65/1324362365.db2.gz	INHZWNJZRURJRC-AEFFLSMTSA-N	0	3	337.467	3.032	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(-c3ccccc3)o2)C1	ZINC001025539879	1324387416	/nfs/dbraw/zinc/38/74/16/1324387416.db2.gz	QOXDWHDOVCZLBY-FUHWJXTLSA-N	0	3	336.435	3.410	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2c(F)ccc(F)c2Cl)C1	ZINC001025540752	1324389225	/nfs/dbraw/zinc/38/92/25/1324389225.db2.gz	YZEOOZNHMFHLBY-RYUDHWBXSA-N	0	3	340.801	3.082	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)C23CCC(CC2)C3(C)C)C1	ZINC001025556657	1324404776	/nfs/dbraw/zinc/40/47/76/1324404776.db2.gz	XETSOYNQWZKSRC-WVNPWQTNSA-N	0	3	330.516	3.443	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2scnc2C(C)(C)C)C1	ZINC001025556232	1324405412	/nfs/dbraw/zinc/40/54/12/1324405412.db2.gz	SXTKBFKTJIYITR-LSDHHAIUSA-N	0	3	347.528	3.294	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2csc(C(C)C)n2)C1	ZINC001025556679	1324405865	/nfs/dbraw/zinc/40/58/65/1324405865.db2.gz	XPINEPLCOSVWFC-GJZGRUSLSA-N	0	3	333.501	3.120	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2csc(C(C)(C)C)n2)C1	ZINC001025560262	1324407229	/nfs/dbraw/zinc/40/72/29/1324407229.db2.gz	CAXIQRHCAQEEQI-GJZGRUSLSA-N	0	3	347.528	3.294	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2csc3c2CCCC3)C1	ZINC001025613734	1324465725	/nfs/dbraw/zinc/46/57/25/1324465725.db2.gz	ZUFWIDAQCKELKP-HZPDHXFCSA-N	0	3	344.524	3.481	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(OC)c(Cl)c2)C1	ZINC001025615399	1324467832	/nfs/dbraw/zinc/46/78/32/1324467832.db2.gz	VAHAEHKNBMPTSU-ZBFHGGJFSA-N	0	3	348.874	3.202	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc3c(s2)CCCC3)C1	ZINC001025614669	1324468298	/nfs/dbraw/zinc/46/82/98/1324468298.db2.gz	NSIGEURVUGFHRF-DOTOQJQBSA-N	0	3	344.524	3.481	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2csc(CC(C)C)n2)C1	ZINC001025631671	1324483126	/nfs/dbraw/zinc/48/31/26/1324483126.db2.gz	CTBQIWFZLWRUMQ-JKSUJKDBSA-N	0	3	347.528	3.195	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2sc(C(C)(C)C)nc2C)C1	ZINC001025636218	1324487766	/nfs/dbraw/zinc/48/77/66/1324487766.db2.gz	YCTBLOSBBKOGFH-ZFWWWQNUSA-N	0	3	347.528	3.213	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(C(F)(F)F)s2)C1	ZINC001025635559	1324488095	/nfs/dbraw/zinc/48/80/95/1324488095.db2.gz	RWPTUJYGFYRIED-NWDGAFQWSA-N	0	3	344.402	3.230	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2sc(C(C)(C)C)nc2C)C1	ZINC001025636216	1324488400	/nfs/dbraw/zinc/48/84/00/1324488400.db2.gz	YCTBLOSBBKOGFH-HIFRSBDPSA-N	0	3	347.528	3.213	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H]2CC[C@@H](NCc3ncc(C)s3)[C@H]2C1	ZINC001026330911	1324731139	/nfs/dbraw/zinc/73/11/39/1324731139.db2.gz	MYQLJDXFPYKHSB-HRCADAONSA-N	0	3	347.528	3.380	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H]2CC[C@@H](NCc3ccccc3C#N)[C@@H]2C1	ZINC001026332738	1324732936	/nfs/dbraw/zinc/73/29/36/1324732936.db2.gz	PDZKGJMYNKECBR-IPMKNSEASA-N	0	3	337.467	3.097	20	30		EGEDHN
CCC(C)(C)C(=O)N1C[C@@H]2CC[C@@H](NCc3ccccc3C#N)[C@@H]2C1	ZINC001026344541	1324742182	/nfs/dbraw/zinc/74/21/82/1324742182.db2.gz	SFISTTWUGLDIEG-IPMKNSEASA-N	0	3	339.483	3.321	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H]3CC[C@@H](NCc4csc(C)n4)[C@H]3C2)C1	ZINC001026353072	1324747533	/nfs/dbraw/zinc/74/75/33/1324747533.db2.gz	XSSJWEOCBUCQNS-BHYGNILZSA-N	0	3	345.512	3.134	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC1CCC(NC(=O)C2=CCCC2)CC1	ZINC001026476714	1324834870	/nfs/dbraw/zinc/83/48/70/1324834870.db2.gz	KTMZPAYZOAVCOS-UHFFFAOYSA-N	0	3	341.430	3.325	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@H](CNCc2csc(C)n2)C1	ZINC001026864358	1325053459	/nfs/dbraw/zinc/05/34/59/1325053459.db2.gz	FKPYSBFEINFFPQ-CYBMUJFWSA-N	0	3	341.908	3.168	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)c2[nH]ccc2C)C1	ZINC000963293261	1325079267	/nfs/dbraw/zinc/07/92/67/1325079267.db2.gz	LJBXRPQSMPOYOX-HZPDHXFCSA-N	0	3	335.879	3.392	20	30		EGEDHN
CC1(C(=O)N2CC[C@H](CNCc3ccccc3C#N)C2)CCCC1	ZINC001026978180	1325121287	/nfs/dbraw/zinc/12/12/87/1325121287.db2.gz	JUIHEWQAVGZWAZ-MRXNPFEDSA-N	0	3	325.456	3.077	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@@H](CNCc3ccccc3C#N)C2)cs1	ZINC001027122550	1325239850	/nfs/dbraw/zinc/23/98/50/1325239850.db2.gz	YXJJKENIQITKED-HNNXBMFYSA-N	0	3	339.464	3.180	20	30		EGEDHN
C[C@@H]1[C@H](NC(=O)c2cc(C#N)ccc2F)CCN1Cc1ccccc1	ZINC000854483803	1325264886	/nfs/dbraw/zinc/26/48/86/1325264886.db2.gz	JCFLIHQYFBFTPP-AUUYWEPGSA-N	0	3	337.398	3.090	20	30		EGEDHN
CC(F)(F)C(C)(C)C(=O)N1CC[C@H](CNCc2ccccc2C#N)C1	ZINC001027193108	1325294300	/nfs/dbraw/zinc/29/43/00/1325294300.db2.gz	WQLGWBPPQDUBEO-CQSZACIVSA-N	0	3	349.425	3.178	20	30		EGEDHN
CN(Cc1ccc(C#N)c(F)c1)[C@H]1CCCN(C(=O)c2ccoc2)C1	ZINC001027298103	1325438625	/nfs/dbraw/zinc/43/86/25/1325438625.db2.gz	VZAYADKOYVQBRN-KRWDZBQOSA-N	0	3	341.386	3.027	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1ncccc1CC)C2	ZINC000964143928	1325482858	/nfs/dbraw/zinc/48/28/58/1325482858.db2.gz	LBKWHQBHDDKSFR-UHFFFAOYSA-N	0	3	333.863	3.027	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@H](N(C)Cc2ccc(Cl)c(F)c2)C1	ZINC001027336838	1325495668	/nfs/dbraw/zinc/49/56/68/1325495668.db2.gz	UTJJBJDPMMAKCV-OCCSQVGLSA-N	0	3	337.826	3.062	20	30		EGEDHN
CN(Cc1ccc(C#N)c(F)c1)[C@H]1CCCN(C(=O)/C=C\C2CC2)C1	ZINC001027340124	1325499507	/nfs/dbraw/zinc/49/95/07/1325499507.db2.gz	APOXSIDMEQZAQF-CNRGFGOASA-N	0	3	341.430	3.086	20	30		EGEDHN
CC[C@H](SC)C(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001027371380	1325565255	/nfs/dbraw/zinc/56/52/55/1325565255.db2.gz	ADNZZRYLHYGYRX-MSOLQXFVSA-N	0	3	345.512	3.123	20	30		EGEDHN
C[C@H](c1ccc(F)c(F)c1)N(C)[C@H]1CCCN(C(=O)C#CC2CC2)C1	ZINC001027402733	1327624790	/nfs/dbraw/zinc/62/47/90/1327624790.db2.gz	RJONVTJCCDBRFM-PBHICJAKSA-N	0	3	346.421	3.362	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)[C@@H]2CCC2(F)F)C1	ZINC001027458447	1327700867	/nfs/dbraw/zinc/70/08/67/1327700867.db2.gz	JHSCVFNXRKMUIX-SJORKVTESA-N	0	3	347.409	3.026	20	30		EGEDHN
C[C@H](CC(C)(C)C#N)N[C@@H]1CC(=O)N(C)[C@H]1c1ccc(F)c(F)c1	ZINC000926879917	1327754195	/nfs/dbraw/zinc/75/41/95/1327754195.db2.gz	YJAVDNNRPQDEPO-JGFGOQIWSA-N	0	3	335.398	3.155	20	30		EGEDHN
CCC(C)(C)C(=O)N1CCC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001027550049	1327856300	/nfs/dbraw/zinc/85/63/00/1327856300.db2.gz	PXSWGZJMKXIVSV-SFHVURJKSA-N	0	3	327.472	3.417	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)C2(CF)CCC2)C1	ZINC001027582309	1327917982	/nfs/dbraw/zinc/91/79/82/1327917982.db2.gz	LTHNHDRXCIORJA-SFHVURJKSA-N	0	3	343.446	3.121	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)[C@@H]2CC23CCC3)C1	ZINC001027597015	1327948859	/nfs/dbraw/zinc/94/88/59/1327948859.db2.gz	FWMPZZBFEBPNNZ-MOPGFXCFSA-N	0	3	337.467	3.171	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CCC[C@H](N(C)Cc2ccc(F)c(C#N)c2)C1	ZINC001027602815	1327955763	/nfs/dbraw/zinc/95/57/63/1327955763.db2.gz	FGUOGOAQCGAGHM-QAPCUYQASA-N	0	3	345.462	3.412	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)C1(C)CC(F)(F)C1)C2	ZINC000965841676	1328042581	/nfs/dbraw/zinc/04/25/81/1328042581.db2.gz	KFCLIUDLNSNZQN-UHFFFAOYSA-N	0	3	332.822	3.191	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)[C@H](C)Cc2cccc(Cl)c2)C1	ZINC001027704242	1328118138	/nfs/dbraw/zinc/11/81/38/1328118138.db2.gz	LZGQSMDULHXXQN-QAPCUYQASA-N	0	3	332.875	3.075	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2c(F)ccc3ccncc32)C1	ZINC000966239596	1328235120	/nfs/dbraw/zinc/23/51/20/1328235120.db2.gz	WDEOGUJBELUDFX-KBXCAEBGSA-N	0	3	341.430	3.390	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2coc(Br)c2)C1	ZINC000966522750	1328332423	/nfs/dbraw/zinc/33/24/23/1328332423.db2.gz	JEXRCEDYSCVARJ-YPMHNXCESA-N	0	3	341.249	3.058	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)C2(c3cccc(Cl)c3)CC2)C1	ZINC000966567435	1328343999	/nfs/dbraw/zinc/34/39/99/1328343999.db2.gz	RZPKITLZNWGGIK-QAPCUYQASA-N	0	3	344.886	3.222	20	30		EGEDHN
C=C(C)CCN1CC[C@H](C)[C@@H](NC(=O)c2nc3cccnc3s2)C1	ZINC000966750402	1328400106	/nfs/dbraw/zinc/40/01/06/1328400106.db2.gz	HQEVQTZASBYFPR-ZFWWWQNUSA-N	0	3	344.484	3.098	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)C1CCc2ccccc2CC1	ZINC001027982397	1328455469	/nfs/dbraw/zinc/45/54/69/1328455469.db2.gz	VHJMWCOOFBGZGU-HXUWFJFHSA-N	0	3	326.484	3.338	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H]2CCCc3ccc(Cl)cc32)CC1	ZINC000863810453	1329583193	/nfs/dbraw/zinc/58/31/93/1329583193.db2.gz	KWPNRCQIUJQALY-GOSISDBHSA-N	0	3	330.859	3.179	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@@H](OCCC)c2ccc(F)cc2C)CC1	ZINC000932140483	1329788208	/nfs/dbraw/zinc/78/82/08/1329788208.db2.gz	CVMYSYPWCIWJMQ-IBGZPJMESA-N	0	3	348.462	3.368	20	30		EGEDHN
C=CCC[C@H](O)CN[C@H]1CCOc2ccc(Br)cc21	ZINC000932209813	1329796145	/nfs/dbraw/zinc/79/61/45/1329796145.db2.gz	XZTXSWKUQNRVDF-JSGCOSHPSA-N	0	3	326.234	3.189	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc3c(c2)C[C@@H](C)O3)CC1	ZINC000933154134	1329867405	/nfs/dbraw/zinc/86/74/05/1329867405.db2.gz	AHDWDTRARJIAKW-CQSZACIVSA-N	0	3	329.444	3.172	20	30		EGEDHN
C[C@]12CN(Cc3nnc(-c4ccc(C#N)cc4)o3)C[C@H]1[C@H]1CC[C@@H]2C1	ZINC000933709484	1329915210	/nfs/dbraw/zinc/91/52/10/1329915210.db2.gz	PXXGLZBXJIQAPS-PFRQMTDMSA-N	0	3	334.423	3.476	20	30		EGEDHN
C#Cc1ccc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)cc1	ZINC000934937778	1330018766	/nfs/dbraw/zinc/01/87/66/1330018766.db2.gz	QADMAZKRCBKHON-UHFFFAOYSA-N	0	3	339.414	3.403	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N(C[C@@H](O)CC(C)(C)C)C1CCN(C)CC1	ZINC000935816744	1330087773	/nfs/dbraw/zinc/08/77/73/1330087773.db2.gz	GILQBUVYZGZSGX-AEFFLSMTSA-N	0	3	338.536	3.309	20	30		EGEDHN
N#Cc1ccc(N2CCN(C3CCN(c4ccccc4)CC3)CC2)cc1	ZINC000866587118	1330129846	/nfs/dbraw/zinc/12/98/46/1330129846.db2.gz	IAAOTSKOVSHDAP-UHFFFAOYSA-N	0	3	346.478	3.349	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1C[C@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001054699479	1349441513	/nfs/dbraw/zinc/44/15/13/1349441513.db2.gz	FYWWGYZCWQHLFP-KBXCAEBGSA-N	0	3	345.462	3.316	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1C[C@@H](C)[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001054699480	1349441602	/nfs/dbraw/zinc/44/16/02/1349441602.db2.gz	FYWWGYZCWQHLFP-KDOFPFPSSA-N	0	3	345.462	3.316	20	30		EGEDHN
CCC(C)(CC)C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC000939797571	1330986605	/nfs/dbraw/zinc/98/66/05/1330986605.db2.gz	UGQRNZZMXVSGCF-RDTXWAMCSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC1(C)CN(Cc2cccc(C#N)c2)CC[C@@H]1NC(=O)C1CCC1	ZINC000940513288	1331096386	/nfs/dbraw/zinc/09/63/86/1331096386.db2.gz	BBRMHVYBCBRSCM-SFHVURJKSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3cccc(Cl)c3)CC2)[C@@H](C)C1	ZINC000942107146	1331833160	/nfs/dbraw/zinc/83/31/60/1331833160.db2.gz	UPVLWEZIXMXWFC-MAUKXSAKSA-N	0	3	344.886	3.222	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3c([nH]2)c(F)ccc3C)[C@@H](C)C1	ZINC000942205673	1331879223	/nfs/dbraw/zinc/87/92/23/1331879223.db2.gz	VLMKQEGVOKGUCQ-YOEHRIQHSA-N	0	3	341.430	3.079	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2c(C)cccc2Cl)[C@@H](C)C1	ZINC000942272828	1331893681	/nfs/dbraw/zinc/89/36/81/1331893681.db2.gz	RYGVEDWGQKKRMI-YJBOKZPZSA-N	0	3	332.875	3.041	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2c(C)occ2C(F)(F)F)[C@@H](C)C1	ZINC000942517577	1331950110	/nfs/dbraw/zinc/95/01/10/1331950110.db2.gz	BOTAGLLNGHGPLZ-SMDDNHRTSA-N	0	3	342.361	3.070	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C3CC3)oc2C2CC2)[C@@H](C)C1	ZINC000942525590	1331955751	/nfs/dbraw/zinc/95/57/51/1331955751.db2.gz	RPUUZFTZVTWONP-KBXCAEBGSA-N	0	3	340.467	3.498	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3c(ccc(C)c3C)[nH]2)[C@H](C)C1	ZINC000942557847	1331972056	/nfs/dbraw/zinc/97/20/56/1331972056.db2.gz	NXBKYQGSGXYRSR-QAPCUYQASA-N	0	3	337.467	3.248	20	30		EGEDHN
C[C@H]1CN(Cc2cccc(C#N)c2)CC[C@H]1NC(=O)C(C)(C)C1CC1	ZINC000942572558	1331983278	/nfs/dbraw/zinc/98/32/78/1331983278.db2.gz	VLDSKCUQHBHMHZ-HNAYVOBHSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCN(Cc3cnccc3C)C[C@@H]2C)CC1	ZINC000942599626	1331996572	/nfs/dbraw/zinc/99/65/72/1331996572.db2.gz	BZQPFWZXZQMWHF-FXAWDEMLSA-N	0	3	341.499	3.463	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCN(Cc3cccnc3C)C[C@H]2C)CC1	ZINC000942600894	1331997957	/nfs/dbraw/zinc/99/79/57/1331997957.db2.gz	WNMZZQCRZPPJSO-UZLBHIALSA-N	0	3	341.499	3.463	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2c(F)ccc(F)c2Cl)[C@@H](C)C1	ZINC000942959265	1332067092	/nfs/dbraw/zinc/06/70/92/1332067092.db2.gz	KPVUIMCWGLYNKB-FZMZJTMJSA-N	0	3	340.801	3.082	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C(C)(C)c2cccc(Cl)c2)[C@@H](C)C1	ZINC000943211109	1332122389	/nfs/dbraw/zinc/12/23/89/1332122389.db2.gz	WYTDZEYBWDJZPZ-WMLDXEAASA-N	0	3	332.875	3.077	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C(C)(C)c2cccc(Cl)c2)[C@H](C)C1	ZINC000943211105	1332122464	/nfs/dbraw/zinc/12/24/64/1332122464.db2.gz	WYTDZEYBWDJZPZ-PBHICJAKSA-N	0	3	332.875	3.077	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(OC)c(C3CC3)c2)[C@@H](C)C1	ZINC000943778895	1332264218	/nfs/dbraw/zinc/26/42/18/1332264218.db2.gz	XNLDMFCDKIXSQD-KXBFYZLASA-N	0	3	340.467	3.036	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2c[nH]nc2C2CCCCC2)[C@@H](C)C1	ZINC000944081218	1332323367	/nfs/dbraw/zinc/32/33/67/1332323367.db2.gz	RAHLGVHMBKSBAU-WMLDXEAASA-N	0	3	330.476	3.084	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2sc(C(C)(C)C)nc2C)[C@H](C)C1	ZINC000945808992	1332679265	/nfs/dbraw/zinc/67/92/65/1332679265.db2.gz	QLVUMHVDTMHQTJ-OCCSQVGLSA-N	0	3	335.517	3.375	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@@H](C)C(F)(F)F)CC[C@@H]2C1	ZINC000946715856	1332883428	/nfs/dbraw/zinc/88/34/28/1332883428.db2.gz	PBMLGQZIOFYBJW-UPJWGTAASA-N	0	3	338.801	3.108	20	30		EGEDHN
Cc1occc1C(=O)N[C@H]1CCN(Cc2ccc(C#N)cc2)[C@@H](C)C1	ZINC000947032547	1332982953	/nfs/dbraw/zinc/98/29/53/1332982953.db2.gz	PPEKEOZUKKKGKV-KSSFIOAISA-N	0	3	337.423	3.243	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)CC2CCC2)CCN1Cc1cccc(C#N)c1	ZINC000947162724	1333029805	/nfs/dbraw/zinc/02/98/05/1333029805.db2.gz	LYVSDKQWMUTTER-KXBFYZLASA-N	0	3	325.456	3.218	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccc(OCCC)c2)C[C@H]1C	ZINC000947365842	1333105538	/nfs/dbraw/zinc/10/55/38/1333105538.db2.gz	UYBDDVJXLMYZBG-SJLPKXTDSA-N	0	3	328.456	3.081	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ncoc2-c2ccccc2)C[C@@H]1C	ZINC000947371559	1333107044	/nfs/dbraw/zinc/10/70/44/1333107044.db2.gz	ZWHOTIDSSFLKOV-GOEBONIOSA-N	0	3	325.412	3.110	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccc(-c3ccncc3)o2)C[C@H]1C	ZINC000947381806	1333109487	/nfs/dbraw/zinc/10/94/87/1333109487.db2.gz	CFZKEXFBKKHVBO-GDBMZVCRSA-N	0	3	325.412	3.110	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(C)n(C(CC)CC)n2)C[C@@H]1C	ZINC000947472585	1333141721	/nfs/dbraw/zinc/14/17/21/1333141721.db2.gz	HQMDYULWBMSGKA-HOCLYGCPSA-N	0	3	332.492	3.321	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C)c3cccnc23)C[C@H]1C	ZINC000947554424	1333169828	/nfs/dbraw/zinc/16/98/28/1333169828.db2.gz	BLMDUXOJLDJSGB-SJORKVTESA-N	0	3	335.451	3.149	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2nsc3ccc(C)cc32)C[C@@H]1C	ZINC000947621789	1333196444	/nfs/dbraw/zinc/19/64/44/1333196444.db2.gz	WKIZICZGLDRBAV-KBPBESRZSA-N	0	3	329.469	3.373	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)[C@H]2C[C@H]3C[C@H]3C2)CCN1Cc1ccc(C#N)cc1	ZINC000947639284	1333204080	/nfs/dbraw/zinc/20/40/80/1333204080.db2.gz	OYKUAWQJTZMYGU-IGGMLHCZSA-N	0	3	337.467	3.073	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)C2(C)CC=CC2)CCN1Cc1ccc(C#N)cc1	ZINC000947693115	1333227215	/nfs/dbraw/zinc/22/72/15/1333227215.db2.gz	HDLKYVQZZVDIOJ-LPHOPBHVSA-N	0	3	337.467	3.384	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2c(F)ccc(F)c2Cl)C[C@H]1C	ZINC000947734575	1333244780	/nfs/dbraw/zinc/24/47/80/1333244780.db2.gz	BJEAXQWSUVVINN-MNOVXSKESA-N	0	3	328.790	3.387	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2cccc(Cl)c2F)C[C@@H]1C	ZINC000947751474	1333250908	/nfs/dbraw/zinc/25/09/08/1333250908.db2.gz	YDCHYVWYUTWRBG-DZGCQCFKSA-N	0	3	336.838	3.014	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H]2CCN(Cc3cccc(C#N)c3)[C@H](C)C2)ccn1	ZINC000947818877	1333270629	/nfs/dbraw/zinc/27/06/29/1333270629.db2.gz	BMALZKBDDFBANU-OXQOHEQNSA-N	0	3	348.450	3.045	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ncc(Cl)cc2Cl)C[C@H]1C	ZINC000947857165	1333282032	/nfs/dbraw/zinc/28/20/32/1333282032.db2.gz	HPJNPPQDROAGQQ-PWSUYJOCSA-N	0	3	328.243	3.157	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnn(C(CC)CC)c2C)C[C@H]1C	ZINC000947907721	1333301278	/nfs/dbraw/zinc/30/12/78/1333301278.db2.gz	JPLCBNFSKKLHOH-GDBMZVCRSA-N	0	3	332.492	3.321	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C(C)(C)c2ccc(CC)cc2)C[C@H]1C	ZINC000947907276	1333301623	/nfs/dbraw/zinc/30/16/23/1333301623.db2.gz	FYZVWOGIBNYMHY-VQIMIIECSA-N	0	3	326.484	3.129	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cnn(C(CC)CC)c2C)C[C@H]1C	ZINC000947908272	1333302202	/nfs/dbraw/zinc/30/22/02/1333302202.db2.gz	QUEPNCGTWRQSCX-WBVHZDCISA-N	0	3	344.503	3.159	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)C[C@H]1C	ZINC000947961780	1333322184	/nfs/dbraw/zinc/32/21/84/1333322184.db2.gz	FMKVQQIWZLGCMF-CZUORRHYSA-N	0	3	338.373	3.311	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3ccccc3C)CCC2)C[C@@H]1C	ZINC000947974837	1333328501	/nfs/dbraw/zinc/32/85/01/1333328501.db2.gz	HJMJMUVDFUJRKO-OALUTQOASA-N	0	3	338.495	3.409	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(F)c(F)cc2Cl)C[C@H]1C	ZINC000947998824	1333337218	/nfs/dbraw/zinc/33/72/18/1333337218.db2.gz	PKNLSVQAIDDCMK-VXGBXAGGSA-N	0	3	340.801	3.224	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(OCC3CC3)cc2)C[C@H]1C	ZINC000948039467	1333350106	/nfs/dbraw/zinc/35/01/06/1333350106.db2.gz	HLVONKNRSYULFO-VQIMIIECSA-N	0	3	340.467	3.081	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc(OC(C)C)cc2)C[C@@H]1C	ZINC000948055981	1333357906	/nfs/dbraw/zinc/35/79/06/1333357906.db2.gz	GVJZCHPCVFWUFS-PKOBYXMFSA-N	0	3	342.483	3.009	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccccc2OCC2CC2)C[C@@H]1C	ZINC000948067795	1333362687	/nfs/dbraw/zinc/36/26/87/1333362687.db2.gz	YZRMUSLBSXTPKF-WMZOPIPTSA-N	0	3	340.467	3.081	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2coc(C3CCCCC3)n2)C[C@@H]1C	ZINC000948072667	1333365418	/nfs/dbraw/zinc/36/54/18/1333365418.db2.gz	AWLHZWNTGQDJIZ-GOEBONIOSA-N	0	3	331.460	3.491	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)Cc2ccccc2CC)CC1	ZINC000948540958	1333562469	/nfs/dbraw/zinc/56/24/69/1333562469.db2.gz	BCEKXYXCOATJMN-FQEVSTJZSA-N	0	3	326.484	3.128	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2cc3ccccc3s2)CC1	ZINC000948590143	1333587852	/nfs/dbraw/zinc/58/78/52/1333587852.db2.gz	JFYOUVULKLMVFU-INIZCTEOSA-N	0	3	326.465	3.461	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2ccnc3ccccc32)CC1	ZINC000948597366	1333590066	/nfs/dbraw/zinc/59/00/66/1333590066.db2.gz	AHPYARSJBWDYPN-KRWDZBQOSA-N	0	3	335.451	3.185	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2ccc3cc(C)ccc3n2)CC1	ZINC000948605440	1333593752	/nfs/dbraw/zinc/59/37/52/1333593752.db2.gz	QBCKNFFBDSNEIN-SFHVURJKSA-N	0	3	335.451	3.103	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2ccc(C)nc2C(C)C)CC1	ZINC000948655842	1333614797	/nfs/dbraw/zinc/61/47/97/1333614797.db2.gz	NHTPWMOWVAJBJS-KRWDZBQOSA-N	0	3	327.472	3.073	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@@H]2CCCN(C/C=C/Cl)CC2)cc1	ZINC000948665949	1333620788	/nfs/dbraw/zinc/62/07/88/1333620788.db2.gz	WRVONKYEXHMPIH-OPGJMIRHSA-N	0	3	330.859	3.347	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cc3cc(C)ccc3[nH]2)CC1	ZINC000948665910	1333620902	/nfs/dbraw/zinc/62/09/02/1333620902.db2.gz	VRCVFASTJXAXDR-SFHVURJKSA-N	0	3	337.467	3.426	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc(Cl)cn2)C12CCC2	ZINC001078786435	1357081987	/nfs/dbraw/zinc/08/19/87/1357081987.db2.gz	VQXDSFUILNYKOF-UONOGXRCSA-N	0	3	340.254	3.118	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2ccccc2-n2cccc2)CC1	ZINC000948743407	1333655474	/nfs/dbraw/zinc/65/54/74/1333655474.db2.gz	TVXGVHKKQNEPIO-LJQANCHMSA-N	0	3	349.478	3.427	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@H]2CCCN(Cc3conc3CC)CC2)C1	ZINC000948753429	1333662286	/nfs/dbraw/zinc/66/22/86/1333662286.db2.gz	KDXHYRWOGGZAHM-KRWDZBQOSA-N	0	3	345.487	3.406	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cc3occc3s2)CC1	ZINC000948766134	1333668647	/nfs/dbraw/zinc/66/86/47/1333668647.db2.gz	GUSKEKLRUQVWBZ-AWEZNQCLSA-N	0	3	330.453	3.444	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2scnc2C(C)C)CC1	ZINC000948840323	1333705342	/nfs/dbraw/zinc/70/53/42/1333705342.db2.gz	FMSGJCLCBDPNGO-HNNXBMFYSA-N	0	3	333.501	3.216	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)NC[C@H]1c2ccccc2CCN1CCCC	ZINC000948959333	1333748274	/nfs/dbraw/zinc/74/82/74/1333748274.db2.gz	VUGDUXQKDVHXSF-AABGKKOBSA-N	0	3	342.483	3.093	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@H]2c3ccccc3CCN2CCCC)c1	ZINC000948959179	1333748444	/nfs/dbraw/zinc/74/84/44/1333748444.db2.gz	URTJOJOKGZHFSE-NRFANRHFSA-N	0	3	347.462	3.192	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@@H]1CNC(=O)c1cccn1CC	ZINC000948987481	1333761324	/nfs/dbraw/zinc/76/13/24/1333761324.db2.gz	ZBWPDWWUEXXNQS-FQEVSTJZSA-N	0	3	337.467	3.413	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1CCC(C)=C(C)C1)CCO2	ZINC000949104675	1333778967	/nfs/dbraw/zinc/77/89/67/1333778967.db2.gz	KRDZETWNNFFYDM-SFHVURJKSA-N	0	3	332.488	3.002	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1[C@@H](C=C(C)C)C1(C)C)CCO2	ZINC000949135070	1333783178	/nfs/dbraw/zinc/78/31/78/1333783178.db2.gz	CBRYMYPVBUUSOS-QZTJIDSGSA-N	0	3	346.515	3.104	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1CCCC[C@H]1C1CC1)CCO2	ZINC000949141447	1333783677	/nfs/dbraw/zinc/78/36/77/1333783677.db2.gz	CBSGGKWBQCOMAQ-OALUTQOASA-N	0	3	346.515	3.082	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C(C1CCC1)C1CCC1)CCO2	ZINC000949170436	1333788293	/nfs/dbraw/zinc/78/82/93/1333788293.db2.gz	LKBVALXKXCDCJQ-UHFFFAOYSA-N	0	3	346.515	3.082	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1[C@@H]3CCCCCC[C@@H]31)CCO2	ZINC000949200151	1333794252	/nfs/dbraw/zinc/79/42/52/1333794252.db2.gz	KNDQFVCKRPTGBJ-BWTSREIZSA-N	0	3	346.515	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@@H]3CCC[C@H](C)C3)CC2)C1	ZINC000949455188	1333851932	/nfs/dbraw/zinc/85/19/32/1333851932.db2.gz	VXUSSWZSYHKEIQ-ZWKOTPCHSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC2(CC1)CN(CCC1CC1)CCO2	ZINC000949463461	1333854298	/nfs/dbraw/zinc/85/42/98/1333854298.db2.gz	NNTBRRAKLNQPSI-IBGZPJMESA-N	0	3	334.504	3.082	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)Cc2c(C)cccc2Cl)C1	ZINC000967231347	1335677756	/nfs/dbraw/zinc/67/77/56/1335677756.db2.gz	PTZZTYJNKYPGHK-MAUKXSAKSA-N	0	3	332.875	3.041	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)Cc2cccc(C(F)F)c2)C1	ZINC000967333217	1335703490	/nfs/dbraw/zinc/70/34/90/1335703490.db2.gz	GWOLQJHJHSJMGY-YOEHRIQHSA-N	0	3	334.410	3.017	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2ccc(F)c3ccncc23)C1	ZINC000967947796	1335832944	/nfs/dbraw/zinc/83/29/44/1335832944.db2.gz	YFDRYXIFBDSYOF-AUUYWEPGSA-N	0	3	341.430	3.390	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2csc(-c3ccco3)n2)C1	ZINC000968078823	1335854133	/nfs/dbraw/zinc/85/41/33/1335854133.db2.gz	LVGSVAVPOVMJFS-KGLIPLIRSA-N	0	3	345.468	3.419	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CN(CCc3scnc3C)CC[C@H]2C)C1	ZINC000968272084	1335881700	/nfs/dbraw/zinc/88/17/00/1335881700.db2.gz	DWOMQQFMBZSUMG-ZBFHGGJFSA-N	0	3	347.528	3.177	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cc(Br)co2)C1	ZINC000968386434	1335914092	/nfs/dbraw/zinc/91/40/92/1335914092.db2.gz	IWBWTHYBBXVCDA-YPMHNXCESA-N	0	3	341.249	3.058	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)Cc2csc(C(C)(C)C)n2)C1	ZINC000968412803	1335923860	/nfs/dbraw/zinc/92/38/60/1335923860.db2.gz	DNQFOSMLIUUCST-GOEBONIOSA-N	0	3	349.544	3.386	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2ncc(Cl)cc2Cl)C1	ZINC000968473061	1335934570	/nfs/dbraw/zinc/93/45/70/1335934570.db2.gz	YWKFZUSOTQKRKK-BXUZGUMPSA-N	0	3	342.270	3.405	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2ncc(Cl)cc2Cl)C1	ZINC000968473064	1335934615	/nfs/dbraw/zinc/93/46/15/1335934615.db2.gz	YWKFZUSOTQKRKK-SMDDNHRTSA-N	0	3	342.270	3.405	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(Cl)cc2Cl)C1	ZINC000968578654	1335968879	/nfs/dbraw/zinc/96/88/79/1335968879.db2.gz	GZFUHOZXVVDVGX-WBMJQRKESA-N	0	3	339.266	3.457	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccc(Cl)c(Cl)c2)C1	ZINC000968579945	1335969758	/nfs/dbraw/zinc/96/97/58/1335969758.db2.gz	QWDHXANTZORDPM-MLGOLLRUSA-N	0	3	339.266	3.457	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2)C1	ZINC000968580536	1335971550	/nfs/dbraw/zinc/97/15/50/1335971550.db2.gz	WGWBPCZLWQEXAD-BBRMVZONSA-N	0	3	338.373	3.169	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)C2(c3cc(C)cc(C)c3)CC2)C1	ZINC000968652179	1335997549	/nfs/dbraw/zinc/99/75/49/1335997549.db2.gz	PZOTZFPSHYBEPE-ICSRJNTNSA-N	0	3	338.495	3.185	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)CC2C3CC4CC(C3)CC2C4)C1	ZINC000968668412	1336002950	/nfs/dbraw/zinc/00/29/50/1336002950.db2.gz	BWZIYBWZXSMKPA-SXOVULEUSA-N	0	3	342.527	3.299	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2c[nH]c3ccc(C)cc23)C1	ZINC000968685587	1336011105	/nfs/dbraw/zinc/01/11/05/1336011105.db2.gz	VXQROFQVWVCLKK-KXBFYZLASA-N	0	3	325.456	3.493	20	30		EGEDHN
N#Cc1cccc(CN2CCCCC[C@H]2CNC(=O)[C@@H]2CC2(F)F)c1	ZINC000968853714	1336068395	/nfs/dbraw/zinc/06/83/95/1336068395.db2.gz	OSQGQENCJZLMAU-IRXDYDNUSA-N	0	3	347.409	3.074	20	30		EGEDHN
N#Cc1ccc(CN2CCCCC[C@@H]2CNC(=O)[C@H]2CC2(F)F)cc1	ZINC000968853863	1336068665	/nfs/dbraw/zinc/06/86/65/1336068665.db2.gz	SICLHYXMRUAJGP-IAGOWNOFSA-N	0	3	347.409	3.074	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccc(OC(C)C)nc1	ZINC000968879261	1336077033	/nfs/dbraw/zinc/07/70/33/1336077033.db2.gz	CJKMGXHPGLBJAP-QGZVFWFLSA-N	0	3	331.460	3.029	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)[C@@H]1CCOc2c(F)cccc21	ZINC000968942214	1336098575	/nfs/dbraw/zinc/09/85/75/1336098575.db2.gz	VEPOMCNXROEVAT-DOTOQJQBSA-N	0	3	346.446	3.239	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1c(C)onc1C1CC1	ZINC000968955439	1336102231	/nfs/dbraw/zinc/10/22/31/1336102231.db2.gz	VUCIVAUCLIYNIO-MRXNPFEDSA-N	0	3	331.460	3.411	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cncc(OC(C)C)c1	ZINC000968974082	1336106454	/nfs/dbraw/zinc/10/64/54/1336106454.db2.gz	NZCCHCMKQRXFAD-KRWDZBQOSA-N	0	3	331.460	3.029	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cnc2ccsc2c1	ZINC000968977246	1336107392	/nfs/dbraw/zinc/10/73/92/1336107392.db2.gz	QCVAXCVEOVJIAI-HNNXBMFYSA-N	0	3	329.469	3.457	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1n[nH]c2c1C[C@H](C)CC2	ZINC000969093738	1336140234	/nfs/dbraw/zinc/14/02/34/1336140234.db2.gz	XGEQRDDXSSATJZ-HZPDHXFCSA-N	0	3	344.503	3.085	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1	ZINC000969158166	1336166035	/nfs/dbraw/zinc/16/60/35/1336166035.db2.gz	CYOLRTWPIYDBIZ-MRXNPFEDSA-N	0	3	343.431	3.009	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cccc2oc(C)nc21	ZINC000969160503	1336167545	/nfs/dbraw/zinc/16/75/45/1336167545.db2.gz	FLTUODCRGYNLJW-OAHLLOKOSA-N	0	3	327.428	3.297	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1ccc(N(C)CC)cc1	ZINC000969164692	1336168837	/nfs/dbraw/zinc/16/88/37/1336168837.db2.gz	MZLFOZBJJVDPQQ-HXUWFJFHSA-N	0	3	341.499	3.140	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)[C@H]1Cc2c1cccc2Cl	ZINC000969165537	1336169557	/nfs/dbraw/zinc/16/95/57/1336169557.db2.gz	ZWHAMIOPOVEZGV-YJBOKZPZSA-N	0	3	344.886	3.364	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@@H](NCc3ccc(C#N)s3)C2)c(F)c1	ZINC000970077611	1336277097	/nfs/dbraw/zinc/27/70/97/1336277097.db2.gz	QMFDPVMINILESO-CYBMUJFWSA-N	0	3	343.427	3.072	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)c2cnc3c(F)cccc3c2)C1	ZINC000970167956	1336287811	/nfs/dbraw/zinc/28/78/11/1336287811.db2.gz	RYGKHOOUMLRMBF-CYBMUJFWSA-N	0	3	327.403	3.000	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)c2ccc(C(F)F)c(F)c2)C1	ZINC000970421813	1336307238	/nfs/dbraw/zinc/30/72/38/1336307238.db2.gz	ZQJZTRIAXWTTJJ-NSHDSACASA-N	0	3	326.362	3.390	20	30		EGEDHN
C#CCCN1CC([C@H](C)NC(=O)[C@@H]2C[C@H]2c2ccc3ccccc3c2)C1	ZINC000970594808	1336325884	/nfs/dbraw/zinc/32/58/84/1336325884.db2.gz	YABCZABQAQCNIP-WQTXXOFMSA-N	0	3	346.474	3.403	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccc3scnc3c2)CC1	ZINC001006223445	1336470293	/nfs/dbraw/zinc/47/02/93/1336470293.db2.gz	UPYDSFJRLWQBEI-UHFFFAOYSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H](NC(=O)c2n[nH]c(C3CC3)c2Cl)C1	ZINC001007780086	1336698403	/nfs/dbraw/zinc/69/84/03/1336698403.db2.gz	FBASNEFWXYGLQL-CYBMUJFWSA-N	0	3	336.867	3.101	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN(CCc3ccccc3)C2)cc1	ZINC001008150353	1336780217	/nfs/dbraw/zinc/78/02/17/1336780217.db2.gz	UCCIJWUHBLAGPD-OAQYLSRUSA-N	0	3	332.447	3.105	20	30		EGEDHN
C=C(C)CCN1CCC[C@H](NC(=O)c2c(F)ccc(F)c2OC)C1	ZINC001008158939	1336781897	/nfs/dbraw/zinc/78/18/97/1336781897.db2.gz	QJUNWRMANCPUJX-ZDUSSCGKSA-N	0	3	338.398	3.134	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CCCN(Cc3c(C)cccc3C)C2)c1	ZINC001008470040	1336864822	/nfs/dbraw/zinc/86/48/22/1336864822.db2.gz	RVZSLTCDERQGRZ-HXUWFJFHSA-N	0	3	347.462	3.074	20	30		EGEDHN
C#CCCN1CCC[C@@H](NC(=O)C(C)(C)c2ccc(CC)cc2)C1	ZINC001009134401	1336974784	/nfs/dbraw/zinc/97/47/84/1336974784.db2.gz	TYFCMVTYEMHTDP-LJQANCHMSA-N	0	3	326.484	3.131	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)c2cc(C)n(CC3CC3)c2C)C1	ZINC001009244958	1336989774	/nfs/dbraw/zinc/98/97/74/1336989774.db2.gz	GYVVBGBNOLHVQJ-GOSISDBHSA-N	0	3	329.488	3.285	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCN(Cc3c(C)cccc3C)C2)nc1	ZINC001009251899	1336991404	/nfs/dbraw/zinc/99/14/04/1336991404.db2.gz	KCXAPIPHDKONDI-IBGZPJMESA-N	0	3	347.462	3.074	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)Cc2cccc(OC(C)C)c2)C1	ZINC001009690678	1337060740	/nfs/dbraw/zinc/06/07/40/1337060740.db2.gz	LAPDRHZXRBOQKJ-GOSISDBHSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=C(C)CCN1CC[C@H](NC(=O)c2sc(C)nc2CC(C)C)C1	ZINC001015123526	1338025707	/nfs/dbraw/zinc/02/57/07/1338025707.db2.gz	BYPREVRDARPPGT-HNNXBMFYSA-N	0	3	335.517	3.420	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCN(C[C@H](OC)c3ccccc3)C2)CC1	ZINC001015660296	1338239386	/nfs/dbraw/zinc/23/93/86/1338239386.db2.gz	XBRYONAWEUKWFO-UXHICEINSA-N	0	3	342.483	3.311	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@@H]2CCN(CC3=CCCCC3)C2)cc1	ZINC001015809483	1338321667	/nfs/dbraw/zinc/32/16/67/1338321667.db2.gz	OXSKIRNFVOUTPZ-LJQANCHMSA-N	0	3	338.451	3.003	20	30		EGEDHN
C=C(C)CCN1CC[C@H](NC(=O)c2cnc(-c3ccco3)s2)C1	ZINC001016041142	1338424261	/nfs/dbraw/zinc/42/42/61/1338424261.db2.gz	OPLGBLJQMNFASH-ZDUSSCGKSA-N	0	3	331.441	3.173	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@@H]3NC(=O)C3CCCC3)CC2)c1	ZINC001016460666	1338610155	/nfs/dbraw/zinc/61/01/55/1338610155.db2.gz	GFNKXWKNCXWHCV-IBGZPJMESA-N	0	3	337.467	3.219	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@@H]3NC(=O)[C@@H]3CC=CCC3)CC2)c1	ZINC001016500025	1338627324	/nfs/dbraw/zinc/62/73/24/1338627324.db2.gz	LVCDRRVDOHQXCY-UXHICEINSA-N	0	3	349.478	3.385	20	30		EGEDHN
CC1CC(C(=O)N[C@@H]2CC23CCN(Cc2cccc(C#N)c2)CC3)C1	ZINC001016563609	1338647449	/nfs/dbraw/zinc/64/74/49/1338647449.db2.gz	ADHKPHXQVWKSEG-XUJQIHCRSA-N	0	3	337.467	3.075	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cscc2C(F)F)CC1	ZINC001016627518	1338669494	/nfs/dbraw/zinc/66/94/94/1338669494.db2.gz	MSUGPSBFJDKHPX-AWEZNQCLSA-N	0	3	338.423	3.293	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2csc3cc(C)ccc32)CC1	ZINC001016644430	1338675069	/nfs/dbraw/zinc/67/50/69/1338675069.db2.gz	DRXYECYTTAXHJV-GOSISDBHSA-N	0	3	338.476	3.427	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CC12CCN(C/C=C/Cl)CC2	ZINC001016658717	1338681585	/nfs/dbraw/zinc/68/15/85/1338681585.db2.gz	JRFBMNPIIZXNGM-YCOJEUHLSA-N	0	3	333.863	3.011	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)C2(C)CCC(F)(F)CC2)CC1	ZINC001016694518	1338693735	/nfs/dbraw/zinc/69/37/35/1338693735.db2.gz	PPVCLUQWAWXOQZ-HNNXBMFYSA-N	0	3	338.442	3.196	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CC23CCN(C/C=C/Cl)CC3)cc1	ZINC001016761757	1338715927	/nfs/dbraw/zinc/71/59/27/1338715927.db2.gz	PBAUNRVXZCJJBL-QYSIDVQXSA-N	0	3	328.843	3.005	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)s2)CC1	ZINC001016791157	1338728468	/nfs/dbraw/zinc/72/84/68/1338728468.db2.gz	KSZFMZQGQCMXFL-UMVBOHGHSA-N	0	3	348.899	3.109	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CC23CCN(Cc2cccnc2C)CC3)C1	ZINC001016811284	1338734730	/nfs/dbraw/zinc/73/47/30/1338734730.db2.gz	CGCZNTZDAXTCBK-GOSISDBHSA-N	0	3	339.483	3.217	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)CC23CC4CC(CC(C4)C2)C3)CC1	ZINC001016946197	1338779675	/nfs/dbraw/zinc/77/96/75/1338779675.db2.gz	KSCIYAQMXSEMSM-VJJCQHNBSA-N	0	3	340.511	3.197	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2cccc(Cl)c2Cl)CC1	ZINC001016946914	1338780201	/nfs/dbraw/zinc/78/02/01/1338780201.db2.gz	RINFEBOIXXKYPR-AWEZNQCLSA-N	0	3	337.250	3.211	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)C2CCC(C3CC3)CC2)CC1	ZINC001016953178	1338782401	/nfs/dbraw/zinc/78/24/01/1338782401.db2.gz	BRYQPDYWRWJKGR-CTWPCTMYSA-N	0	3	328.500	3.197	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccc3c(c2)CCCC3)CC1	ZINC001016957394	1338784228	/nfs/dbraw/zinc/78/42/28/1338784228.db2.gz	WSLCHGFWFUIFJK-FQEVSTJZSA-N	0	3	336.479	3.173	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2oc3ccccc3c2C)CC1	ZINC001016962206	1338785231	/nfs/dbraw/zinc/78/52/31/1338785231.db2.gz	XMUFPFKKLSQJKW-SFHVURJKSA-N	0	3	336.435	3.349	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)[C@@H](C)c2cccc(Cl)c2)CC1	ZINC001016987077	1338794010	/nfs/dbraw/zinc/79/40/10/1338794010.db2.gz	SBFMGSRYVFRUDV-MAUKXSAKSA-N	0	3	344.886	3.438	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001017033234	1338824783	/nfs/dbraw/zinc/82/47/83/1338824783.db2.gz	QUYQPDPTVWTOKO-HNNXBMFYSA-N	0	3	333.501	3.336	20	30		EGEDHN
C[C@@H](c1ccccc1F)N(C)C[C@@H]1CCCN(C(=O)C#CC2CC2)C1	ZINC001017121071	1338878971	/nfs/dbraw/zinc/87/89/71/1338878971.db2.gz	PNDQXCSYPWRDNN-WMZOPIPTSA-N	0	3	342.458	3.471	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H](CN(C)Cc2cncc(F)c2)C1	ZINC001017180036	1338924164	/nfs/dbraw/zinc/92/41/64/1338924164.db2.gz	QWSFWQYJUDPFIY-MRXNPFEDSA-N	0	3	347.478	3.493	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@H](CN(C)Cc3ocnc3C)C2)CC1	ZINC001017199149	1338944645	/nfs/dbraw/zinc/94/46/45/1338944645.db2.gz	ZQMFODPABGVSHG-QGZVFWFLSA-N	0	3	345.487	3.400	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1cncc2ccccc21	ZINC001017634872	1339379534	/nfs/dbraw/zinc/37/95/34/1339379534.db2.gz	XBKGSBIUHNSGFV-BGYRXZFFSA-N	0	3	349.478	3.419	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1cncc2ccccc21	ZINC001017633302	1339379768	/nfs/dbraw/zinc/37/97/68/1339379768.db2.gz	SZCUIXZSOORVRL-KDURUIRLSA-N	0	3	335.451	3.029	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc2cccnc2c1	ZINC001017651783	1339382872	/nfs/dbraw/zinc/38/28/72/1339382872.db2.gz	OHXHMHUBFSXECQ-KDURUIRLSA-N	0	3	335.451	3.029	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CCO[C@H]1c1ccccc1	ZINC001018050894	1339490452	/nfs/dbraw/zinc/49/04/52/1339490452.db2.gz	BSAOTHZTNLCWES-WCIQWLHISA-N	0	3	340.467	3.016	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)COc1ccc(C)cc1C	ZINC001018259023	1339552695	/nfs/dbraw/zinc/55/26/95/1339552695.db2.gz	SCBMCWVQZAAVHI-KDURUIRLSA-N	0	3	342.483	3.324	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)Cc1ccc(F)cc1	ZINC001018332493	1339580936	/nfs/dbraw/zinc/58/09/36/1339580936.db2.gz	OUPSDLCXRSHZES-ZYSHUDEJSA-N	0	3	330.447	3.256	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1cnn(CCC(C)C)c1C	ZINC001028250957	1340511693	/nfs/dbraw/zinc/51/16/93/1340511693.db2.gz	OXZPFICFAHLAMQ-KRWDZBQOSA-N	0	3	332.492	3.008	20	30		EGEDHN
C#CCCN1CCC[C@@H]1CNC(=O)c1cc(CC)c(CCC)s1	ZINC001028310919	1340557948	/nfs/dbraw/zinc/55/79/48/1340557948.db2.gz	BSQNEDFUPFGOEG-MRXNPFEDSA-N	0	3	332.513	3.481	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1ccc(OC2CCC2)cc1	ZINC001028329909	1340568825	/nfs/dbraw/zinc/56/88/25/1340568825.db2.gz	VHZPGUUAVRDUPU-KRWDZBQOSA-N	0	3	328.456	3.388	20	30		EGEDHN
Cc1ccccc1C(=O)NC[C@H]1CCN(Cc2ccc(C#N)cc2)C1	ZINC001028383827	1340611292	/nfs/dbraw/zinc/61/12/92/1340611292.db2.gz	YJFIHNXKQIZFNU-LJQANCHMSA-N	0	3	333.435	3.119	20	30		EGEDHN
Cc1cc(C(=O)NC[C@@H]2CCN(Cc3cccc(C#N)c3)C2)oc1C	ZINC001028478929	1340665089	/nfs/dbraw/zinc/66/50/89/1340665089.db2.gz	WCYBJCNJKPEMNU-SFHVURJKSA-N	0	3	337.423	3.020	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)c2csc3cc(C)ccc23)C1	ZINC001028568217	1340706533	/nfs/dbraw/zinc/70/65/33/1340706533.db2.gz	OEBREABUEXEWGH-HNNXBMFYSA-N	0	3	326.465	3.285	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NC[C@H]1CCN(C[C@H](F)CC)C1	ZINC001028637612	1340738232	/nfs/dbraw/zinc/73/82/32/1340738232.db2.gz	SSULUPOAAWVXJU-HZPDHXFCSA-N	0	3	334.435	3.051	20	30		EGEDHN
CC1(C)CCC[C@@H]1C(=O)NC[C@@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC001028747026	1340787664	/nfs/dbraw/zinc/78/76/64/1340787664.db2.gz	WARMIOSYQZIQGI-RBUKOAKNSA-N	0	3	339.483	3.323	20	30		EGEDHN
CC1(C)CC[C@@H](C(=O)NC[C@H]2CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001028782031	1340813869	/nfs/dbraw/zinc/81/38/69/1340813869.db2.gz	ADKROZDXSYITGU-RTBURBONSA-N	0	3	339.483	3.323	20	30		EGEDHN
Cc1cccc(C)c1C(=O)NC[C@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC001028820934	1340835445	/nfs/dbraw/zinc/83/54/45/1340835445.db2.gz	LDLBNJZRQZEVED-HXUWFJFHSA-N	0	3	347.462	3.427	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H](CNC(=O)[C@H]3CC34CCCC4)C2)c1	ZINC001028908433	1340881031	/nfs/dbraw/zinc/88/10/31/1340881031.db2.gz	MCCKQVNPQPCILK-RBUKOAKNSA-N	0	3	337.467	3.077	20	30		EGEDHN
Cc1cc(C)cc(C(=O)NC[C@@H]2CCN(Cc3cccc(C#N)c3)C2)c1	ZINC001028953509	1340893232	/nfs/dbraw/zinc/89/32/32/1340893232.db2.gz	HQUFHNVQBCTFHE-FQEVSTJZSA-N	0	3	347.462	3.427	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@@H]2CCN(Cc3ccc(C#N)cc3)C2)c(C)c1	ZINC001028965741	1340895156	/nfs/dbraw/zinc/89/51/56/1340895156.db2.gz	NBBTYQTXGCQIDM-FQEVSTJZSA-N	0	3	347.462	3.427	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](CNC(=O)c3ccc(F)s3)C2)cc1	ZINC001029015641	1340910397	/nfs/dbraw/zinc/91/03/97/1340910397.db2.gz	DRACYHAIZZZIQP-OAHLLOKOSA-N	0	3	343.427	3.011	20	30		EGEDHN
C[C@@H](NCc1cc(F)ccc1C#N)C1CCN(C(=O)CC2CC2)CC1	ZINC001029037231	1340914018	/nfs/dbraw/zinc/91/40/18/1340914018.db2.gz	BKDXARFCMFQJHH-CQSZACIVSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC([C@H](C)NCc2cnc(C)cn2)CC1	ZINC001029124623	1340935831	/nfs/dbraw/zinc/93/58/31/1340935831.db2.gz	AHXDBBTZMFDZIQ-INIZCTEOSA-N	0	3	344.503	3.104	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CC[C@@H](C1)N2CC[C@H]1CCCCO1	ZINC001029453737	1340993661	/nfs/dbraw/zinc/99/36/61/1340993661.db2.gz	JTQIDQXSRWGCCM-RMJJICAUSA-N	0	3	334.504	3.223	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCN(C(=O)C2CCCC2)C1	ZINC001029621206	1341023853	/nfs/dbraw/zinc/02/38/53/1341023853.db2.gz	XQYIGMFAPKHQTN-CQSZACIVSA-N	0	3	331.485	3.090	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCN(C(=O)C2=CCCC2)C1	ZINC001029705574	1341050703	/nfs/dbraw/zinc/05/07/03/1341050703.db2.gz	LTAQUIVCZXTBLE-AWEZNQCLSA-N	0	3	329.469	3.010	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@H](CN(C)Cc3ccc(C#N)s3)C2)co1	ZINC001029716896	1341053423	/nfs/dbraw/zinc/05/34/23/1341053423.db2.gz	GUUGZHKVHXNOCC-CQSZACIVSA-N	0	3	343.452	3.115	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](CN(C)Cc2cccc(Cl)n2)C1	ZINC001029801836	1341077727	/nfs/dbraw/zinc/07/77/27/1341077727.db2.gz	SAFZRHDWYHUJAU-AWEZNQCLSA-N	0	3	335.879	3.228	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](CN(C)Cc3ncccc3C)C2)CC1	ZINC001029825936	1341087250	/nfs/dbraw/zinc/08/72/50/1341087250.db2.gz	JUEIQIUORKMCSS-SFHVURJKSA-N	0	3	341.499	3.417	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@H](CN(C)Cc2oc(C)nc2C)C1	ZINC001029828908	1341088890	/nfs/dbraw/zinc/08/88/90/1341088890.db2.gz	OCJJPRPWVSKXLM-LPHOPBHVSA-N	0	3	333.476	3.174	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CC[C@@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001029859210	1341098434	/nfs/dbraw/zinc/09/84/34/1341098434.db2.gz	PRQYEMPJNYAOEM-GJZGRUSLSA-N	0	3	333.501	3.192	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC(CN(C)Cc2ccc(C#N)cc2F)CC1	ZINC001029937367	1341128581	/nfs/dbraw/zinc/12/85/81/1341128581.db2.gz	LJOUWEOPTAPCRJ-HNNXBMFYSA-N	0	3	345.462	3.414	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC(CN(C)Cc2cnc(C)s2)CC1	ZINC001029983585	1341143902	/nfs/dbraw/zinc/14/39/02/1341143902.db2.gz	IWTNGHJMTMZCFT-UHFFFAOYSA-N	0	3	335.517	3.334	20	30		EGEDHN
C=CCn1cccc1C(=O)NCC1CN([C@@H](C)c2ccccc2C)C1	ZINC001031733317	1341394790	/nfs/dbraw/zinc/39/47/90/1341394790.db2.gz	TUSSNTWTEICZBU-KRWDZBQOSA-N	0	3	337.467	3.405	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)COc1ccc(C(C)C)cc1	ZINC001032503784	1341524612	/nfs/dbraw/zinc/52/46/12/1341524612.db2.gz	QRLUDUWTXAULLZ-OALUTQOASA-N	0	3	342.483	3.440	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cnc2c(F)cccc2c1	ZINC001032521482	1341530481	/nfs/dbraw/zinc/53/04/81/1341530481.db2.gz	AJPZPTAUQZTBJQ-IRXDYDNUSA-N	0	3	339.414	3.239	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C(C)(C)CC1CCOCC1	ZINC001032709106	1341587079	/nfs/dbraw/zinc/58/70/79/1341587079.db2.gz	PDJNIBWTBUZPKC-ROUUACIJSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H](CC)Oc1ccccc1F	ZINC001032731260	1341594210	/nfs/dbraw/zinc/59/42/10/1341594210.db2.gz	GVCIPSLCWMIBHJ-BQFCYCMXSA-N	0	3	346.446	3.234	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(N(C)CCC)cc1	ZINC001032817287	1341625978	/nfs/dbraw/zinc/62/59/78/1341625978.db2.gz	WFHCOCYSDYYUEN-OALUTQOASA-N	0	3	327.472	3.008	20	30		EGEDHN
C=CCCN1CC[C@@H](N(C)C(=O)c2nc(Cl)sc2Cl)C1	ZINC001033321748	1341780622	/nfs/dbraw/zinc/78/06/22/1341780622.db2.gz	NHLRHTKYKMSILY-SECBINFHSA-N	0	3	334.272	3.172	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@@H]2CCN(Cc3cccc(OC)c3C)C2)C1	ZINC001033400323	1341814172	/nfs/dbraw/zinc/81/41/72/1341814172.db2.gz	ULGSJRGESYFWEF-GOSISDBHSA-N	0	3	342.483	3.393	20	30		EGEDHN
C=CCCN1CC[C@@H](N(C)C(=O)c2cnc(-c3ccoc3)s2)C1	ZINC001033479610	1341841395	/nfs/dbraw/zinc/84/13/95/1341841395.db2.gz	LWSQCDBZTMIPBE-CQSZACIVSA-N	0	3	331.441	3.126	20	30		EGEDHN
C#CCCN1CC[C@@H](N(C)C(=O)C(C)(C)c2ccc(CC)cc2)C1	ZINC001033566849	1341875931	/nfs/dbraw/zinc/87/59/31/1341875931.db2.gz	UCWZYOCRLIZEMM-LJQANCHMSA-N	0	3	326.484	3.083	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2cnn(C3CCCC3)c2C)C1	ZINC001033568368	1341877498	/nfs/dbraw/zinc/87/74/98/1341877498.db2.gz	IUVHMRCGWTZLOT-KRWDZBQOSA-N	0	3	330.476	3.029	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)C2(c3ccccc3F)CCC2)C1	ZINC001033573147	1341879200	/nfs/dbraw/zinc/87/92/00/1341879200.db2.gz	ACDYXEYOTXSCKA-MRXNPFEDSA-N	0	3	330.447	3.356	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cccc([C@H]3CCOC3)c2)C1	ZINC001033875262	1342053617	/nfs/dbraw/zinc/05/36/17/1342053617.db2.gz	DALPIYZZRKSPGC-VQTJNVASSA-N	0	3	342.483	3.303	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@H]2CCc3cc(F)ccc32)C1	ZINC001033902530	1342076384	/nfs/dbraw/zinc/07/63/84/1342076384.db2.gz	KFNNHADFNPHLDJ-MJGOQNOKSA-N	0	3	330.447	3.354	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccc(C(F)(F)F)nc2)C1	ZINC001033919831	1342088118	/nfs/dbraw/zinc/08/81/18/1342088118.db2.gz	VPNKECNRYPJZJU-CQSZACIVSA-N	0	3	341.377	3.213	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cc(-c3cccs3)n[nH]2)C1	ZINC001033963008	1342116183	/nfs/dbraw/zinc/11/61/83/1342116183.db2.gz	IYUUZKRXVPRREX-AWEZNQCLSA-N	0	3	344.484	3.251	20	30		EGEDHN
C=CCCN1CC[C@H](N(CC)C(=O)c2cnc([C@@H]3CCCO3)s2)C1	ZINC001033980537	1342128240	/nfs/dbraw/zinc/12/82/40/1342128240.db2.gz	UXFKRQXGLOUXPU-GJZGRUSLSA-N	0	3	349.500	3.107	20	30		EGEDHN
Cc1cc(CN2CCCC[C@H](NC(=O)c3cc(C#N)c[nH]3)C2)cs1	ZINC001034162987	1342287272	/nfs/dbraw/zinc/28/72/72/1342287272.db2.gz	FNLAGWIBKNLZMD-INIZCTEOSA-N	0	3	342.468	3.041	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3coc4ccc(F)cc43)[C@@H]2C1	ZINC001076508275	1356599348	/nfs/dbraw/zinc/59/93/48/1356599348.db2.gz	PJVVPBDNBYLBIG-SUMWQHHRSA-N	0	3	328.387	3.294	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@@H]2CC[C@H](c3ccccc3)O2)C1	ZINC001034210895	1342321593	/nfs/dbraw/zinc/32/15/93/1342321593.db2.gz	VIZJMENWKOQAFU-AQNXPRMDSA-N	0	3	342.483	3.454	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2oc3ccc(F)cc3c2C)C1	ZINC001034246913	1342345016	/nfs/dbraw/zinc/34/50/16/1342345016.db2.gz	HXKIEYULVVRGFI-INIZCTEOSA-N	0	3	342.414	3.488	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cccc([C@@H]3CCOC3)c2)C1	ZINC001034279138	1342369915	/nfs/dbraw/zinc/36/99/15/1342369915.db2.gz	IQRQHZVCDVXLJX-WOJBJXKFSA-N	0	3	342.483	3.351	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cc(C(C)C)nn2CC)C1	ZINC001034287084	1342374331	/nfs/dbraw/zinc/37/43/31/1342374331.db2.gz	NCEHRRNAHIGPII-MRXNPFEDSA-N	0	3	332.492	3.187	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2ccc3cc(C)ccc3n2)C1	ZINC001034299546	1342382325	/nfs/dbraw/zinc/38/23/25/1342382325.db2.gz	HEVDDCPGXTTWBS-SFHVURJKSA-N	0	3	335.451	3.151	20	30		EGEDHN
C=CCCN1CCCC[C@H](NC(=O)c2cc3c(C)nn(C)c3s2)C1	ZINC001034330915	1342405457	/nfs/dbraw/zinc/40/54/57/1342405457.db2.gz	BCHNJUKCGBJUBG-AWEZNQCLSA-N	0	3	346.500	3.104	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2sccc2-n2cccc2)C1	ZINC001034333980	1342408483	/nfs/dbraw/zinc/40/84/83/1342408483.db2.gz	CGPZCEVSOVZSNG-INIZCTEOSA-N	0	3	341.480	3.146	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cnc3ccsc3c2)C1	ZINC001034340341	1342413574	/nfs/dbraw/zinc/41/35/74/1342413574.db2.gz	NQLIEBPCZOWHMI-OAHLLOKOSA-N	0	3	329.469	3.457	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2nsc3ccc(C)cc32)C1	ZINC001034344286	1342416221	/nfs/dbraw/zinc/41/62/21/1342416221.db2.gz	GVBWQJAPKPKMNQ-HNNXBMFYSA-N	0	3	341.480	3.212	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2ccccc2O[C@H](C)CC)C1	ZINC001034420535	1342481965	/nfs/dbraw/zinc/48/19/65/1342481965.db2.gz	JCXCTQGCPVLDFM-MSOLQXFVSA-N	0	3	342.483	3.472	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2ccccc2O[C@@H](C)CC)C1	ZINC001034420539	1342482408	/nfs/dbraw/zinc/48/24/08/1342482408.db2.gz	JCXCTQGCPVLDFM-ROUUACIJSA-N	0	3	342.483	3.472	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cnccc2C(F)(F)F)C1	ZINC001034422445	1342484102	/nfs/dbraw/zinc/48/41/02/1342484102.db2.gz	XKHAHQSXBSAVDV-CYBMUJFWSA-N	0	3	341.377	3.261	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc(-c3cn[nH]c3)cc2)C1	ZINC001034440221	1342502688	/nfs/dbraw/zinc/50/26/88/1342502688.db2.gz	SRCMTFXLOSFURZ-IBGZPJMESA-N	0	3	338.455	3.237	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2csc(-c3ccoc3)n2)C1	ZINC001034449059	1342509247	/nfs/dbraw/zinc/50/92/47/1342509247.db2.gz	VDXVAIHANQIZIH-OAHLLOKOSA-N	0	3	343.452	3.011	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2cc(F)c(F)cc2Cl)C1	ZINC001034518314	1342578011	/nfs/dbraw/zinc/57/80/11/1342578011.db2.gz	JBHMLDYANCLFHN-GFCCVEGCSA-N	0	3	340.801	3.226	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)C[C@H]2C=CCC2)CC1	ZINC001034589106	1342634037	/nfs/dbraw/zinc/63/40/37/1342634037.db2.gz	CJVAFUKZWAFYPZ-KKUMJFAQSA-N	0	3	341.293	3.268	20	30		EGEDHN
C[C@]1(C(=O)N[C@H]2CC[C@H](NCc3ccccc3C#N)CC2)C=CCC1	ZINC001034711160	1342707832	/nfs/dbraw/zinc/70/78/32/1342707832.db2.gz	VGRBDTJLJADMCR-ZJOUEHCJSA-N	0	3	337.467	3.432	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CC[C@H](NCc3cc(C)ncn3)CC2)CC1	ZINC001034725404	1342719088	/nfs/dbraw/zinc/71/90/88/1342719088.db2.gz	JVLAIMUWHNQTOW-IYARVYRRSA-N	0	3	342.487	3.048	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC[C@H](NCc3csnc3OC)CC2)C1	ZINC001034729430	1342723665	/nfs/dbraw/zinc/72/36/65/1342723665.db2.gz	LYMQZMNDWVHWBS-SHTZXODSSA-N	0	3	349.500	3.025	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CC[C@H](NCc3ocnc3C)CC2)CC1	ZINC001034729748	1342724546	/nfs/dbraw/zinc/72/45/46/1342724546.db2.gz	VEMBIKGDMDFQJM-QAQDUYKDSA-N	0	3	331.460	3.246	20	30		EGEDHN
C[C@@H]1C[C@@H]1C(=O)NCc1ccc(CNCc2ccc(C#N)cc2)cc1	ZINC001034807305	1342772906	/nfs/dbraw/zinc/77/29/06/1342772906.db2.gz	ODLRDTFGDSJOTF-QRWLVFNGSA-N	0	3	333.435	3.120	20	30		EGEDHN
C[C@H]1C[C@H]1C(=O)NCc1ccc(CNCc2ccc(C#N)s2)cc1	ZINC001034808061	1342773459	/nfs/dbraw/zinc/77/34/59/1342773459.db2.gz	UHVIYJZVADTYBY-SCLBCKFNSA-N	0	3	339.464	3.182	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)Cc2ccc(OC)cc2)C12CCC2	ZINC001078793670	1357088072	/nfs/dbraw/zinc/08/80/72/1357088072.db2.gz	ZTJICJHARCUCEQ-SJORKVTESA-N	0	3	348.874	3.007	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)Cc2ccc(F)cc2)C12CCC2	ZINC001078796566	1357090222	/nfs/dbraw/zinc/09/02/22/1357090222.db2.gz	BJQCGKAVMFJCTD-JKSUJKDBSA-N	0	3	336.838	3.138	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]1CNCc1cnn(C(C)(C)C)c1	ZINC001035010676	1342874522	/nfs/dbraw/zinc/87/45/22/1342874522.db2.gz	FZZJUIMIRGPFHN-QGZVFWFLSA-N	0	3	346.519	3.321	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H]1CNCc1c(C)nsc1C	ZINC001035036005	1342889298	/nfs/dbraw/zinc/88/92/98/1342889298.db2.gz	UJNBLBQFMLWMAS-CRAIPNDOSA-N	0	3	335.517	3.443	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]2CNCc2c(C)nsc2C)C1	ZINC001035045027	1342896551	/nfs/dbraw/zinc/89/65/51/1342896551.db2.gz	WXGGEBUUGJTGQZ-OAHLLOKOSA-N	0	3	333.501	3.197	20	30		EGEDHN
O=C(C1CCC1)N1CCC2(CCN(CC#Cc3ccccc3)C2)CC1	ZINC001035148152	1342959811	/nfs/dbraw/zinc/95/98/11/1342959811.db2.gz	XTIHBRMBODBLRH-UHFFFAOYSA-N	0	3	336.479	3.153	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCC2(CCN(C/C=C\Cl)C2)CC1	ZINC001035194535	1343008464	/nfs/dbraw/zinc/00/84/64/1343008464.db2.gz	QMNPJUISMQCBTQ-WTKPLQERSA-N	0	3	347.890	3.355	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CCC2(CCN(Cc3ccccc3C#N)C2)CC1	ZINC001035217837	1343037598	/nfs/dbraw/zinc/03/75/98/1343037598.db2.gz	MOHNYXUVWHPHDZ-GOSISDBHSA-N	0	3	343.446	3.121	20	30		EGEDHN
C=C[C@@H](C(=O)N1CCC2(CCN(CCF)C2)CC1)c1ccccc1	ZINC001035257029	1343083291	/nfs/dbraw/zinc/08/32/91/1343083291.db2.gz	QZJJZMPDSBICEF-GOSISDBHSA-N	0	3	330.447	3.240	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC2(CN(CCCc3ccsc3)C2)CC1	ZINC001035702039	1343142686	/nfs/dbraw/zinc/14/26/86/1343142686.db2.gz	IIJDBZQJJTZLOK-UHFFFAOYSA-N	0	3	342.508	3.019	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H](C)Oc1ccccc1F)CC2	ZINC001035709426	1343145183	/nfs/dbraw/zinc/14/51/83/1343145183.db2.gz	FMWVCOQPBZRVFA-MRXNPFEDSA-N	0	3	346.446	3.094	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cc1cccc(CC)c1)CC2	ZINC001035735310	1343160196	/nfs/dbraw/zinc/16/01/96/1343160196.db2.gz	RIVXJSBAQPULCC-UHFFFAOYSA-N	0	3	326.484	3.292	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc(C)ccc1OC)CC2	ZINC001035744346	1343164728	/nfs/dbraw/zinc/16/47/28/1343164728.db2.gz	HABJNZQVRVQHLS-UHFFFAOYSA-N	0	3	328.456	3.118	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)Cc1ccc(C(F)F)cc1)CC2	ZINC001035750579	1343169606	/nfs/dbraw/zinc/16/96/06/1343169606.db2.gz	MQXWTKWCAYIRDW-UHFFFAOYSA-N	0	3	346.421	3.114	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cc1ccc(F)c(F)c1)CC2	ZINC001035781358	1343191817	/nfs/dbraw/zinc/19/18/17/1343191817.db2.gz	PKKTUCJBMBWYQH-UHFFFAOYSA-N	0	3	334.410	3.008	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C1CCC(F)(F)CC1)CC2	ZINC001035807680	1343208081	/nfs/dbraw/zinc/20/80/81/1343208081.db2.gz	SLFSQYQHBCGWSP-UHFFFAOYSA-N	0	3	326.431	3.312	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)CO[C@@H]1CCCC[C@@H]1C)CC2	ZINC001035807921	1343208029	/nfs/dbraw/zinc/20/80/29/1343208029.db2.gz	XCOWNSDNHYPVSD-ZWKOTPCHSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C[C@H]1CCO[C@@H](C(C)C)C1)CC2	ZINC001035832291	1343219829	/nfs/dbraw/zinc/21/98/29/1343219829.db2.gz	FXSNCOIQIUUPDB-RBUKOAKNSA-N	0	3	348.531	3.328	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)C[C@@H](C)c1ccc(F)cc1)CC2	ZINC001035859727	1343235832	/nfs/dbraw/zinc/23/58/32/1343235832.db2.gz	XLFIMAMUGNDUFV-QGZVFWFLSA-N	0	3	342.458	3.267	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@H]1Cc3c1cccc3Cl)CC2	ZINC001035861613	1343237900	/nfs/dbraw/zinc/23/79/00/1343237900.db2.gz	KKXWRWZWESUZJE-KRWDZBQOSA-N	0	3	344.886	3.480	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccc(C(C)(F)F)cc1)CC2	ZINC001035863062	1343238562	/nfs/dbraw/zinc/23/85/62/1343238562.db2.gz	VLYMBMKFXGCJQU-UHFFFAOYSA-N	0	3	346.421	3.360	20	30		EGEDHN
C[C@H]1CN(C(=O)CCC2CC2)CC[C@H]1NCc1ccccc1C#N	ZINC001035966341	1343292358	/nfs/dbraw/zinc/29/23/58/1343292358.db2.gz	JHXMBRYFOMSWPD-HNAYVOBHSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@H](NCc2cc(C)no2)[C@@H](C)C1	ZINC001036041940	1343309624	/nfs/dbraw/zinc/30/96/24/1343309624.db2.gz	HLTDZNHGFKVJLC-NHYWBVRUSA-N	0	3	339.867	3.088	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2(C)CCCC2)CC[C@@H]1NCc1ccccc1C#N	ZINC001036136745	1343322641	/nfs/dbraw/zinc/32/26/41/1343322641.db2.gz	SIOJJUPPKRHUJI-APWZRJJASA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](NCc2nc(C)cs2)[C@H](C)C1	ZINC001036139639	1343324316	/nfs/dbraw/zinc/32/43/16/1343324316.db2.gz	ZXGJZKADFCXEIN-UKRRQHHQSA-N	0	3	335.517	3.380	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](NCc2ccccc2C#N)[C@@H](C)C1	ZINC001036144943	1343327789	/nfs/dbraw/zinc/32/77/89/1343327789.db2.gz	VVMCVJSDTCAERI-YJBOKZPZSA-N	0	3	325.456	3.097	20	30		EGEDHN
CC(C)C1(C(=O)N2CC[C@H](NCc3ccccc3C#N)[C@@H](C)C2)CC1	ZINC001036169042	1343342150	/nfs/dbraw/zinc/34/21/50/1343342150.db2.gz	KSUTWWHPSSKNGO-LPHOPBHVSA-N	0	3	339.483	3.321	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@H]([C@@H](C)NCc2ccccc2C#N)C1	ZINC001036339159	1343424810	/nfs/dbraw/zinc/42/48/10/1343424810.db2.gz	DOOKOMFZRXPLLI-APWZRJJASA-N	0	3	325.456	3.241	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCCN(C(=O)C2CCCC2)C1	ZINC001036356595	1343439374	/nfs/dbraw/zinc/43/93/74/1343439374.db2.gz	JDZIUWFYSVFENU-OXJNMPFZSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H]([C@H](C)NCc2cc(C)no2)C1	ZINC001036442227	1343489779	/nfs/dbraw/zinc/48/97/79/1343489779.db2.gz	SKUGOCPJGIJOKD-HOTGVXAUSA-N	0	3	333.476	3.302	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@H](C)[C@H]1CNCc1ccc(C#N)s1	ZINC001036490370	1343513256	/nfs/dbraw/zinc/51/32/56/1343513256.db2.gz	GCZKVMWKNRKVFN-WMLDXEAASA-N	0	3	333.501	3.383	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@H](C)[C@H]1CNCc1ccc(C#N)cc1F	ZINC001036496593	1343518033	/nfs/dbraw/zinc/51/80/33/1343518033.db2.gz	YUMFUCGDAIURHS-HNAYVOBHSA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@H]1CCCN(C(=O)c2ccoc2)[C@H]1CNCc1ccc(C#N)s1	ZINC001036501824	1343519903	/nfs/dbraw/zinc/51/99/03/1343519903.db2.gz	OGWCDHJSOJDXDL-GUYCJALGSA-N	0	3	343.452	3.243	20	30		EGEDHN
C[C@H]1CCCN(C(=O)C2CC=CC2)[C@H]1CNCc1ccc(C#N)s1	ZINC001036526965	1343535835	/nfs/dbraw/zinc/53/58/35/1343535835.db2.gz	XHUHCGMJGWMCGR-KSSFIOAISA-N	0	3	343.496	3.303	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)/C=C\C2CC2)[C@H]1CNCc1ccc(C#N)s1	ZINC001036528054	1343536415	/nfs/dbraw/zinc/53/64/15/1343536415.db2.gz	NDTPVONOCBBLRL-UHDQJTOSSA-N	0	3	343.496	3.303	20	30		EGEDHN
C[C@H]1CCCN(C(=O)C#CC2CC2)[C@H]1CNCc1cc(F)ccc1F	ZINC001036550438	1343549616	/nfs/dbraw/zinc/54/96/16/1343549616.db2.gz	VJKKPHGGIJLDIC-LIRRHRJNSA-N	0	3	346.421	3.095	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccccc2C#N)C1	ZINC001036629973	1343587762	/nfs/dbraw/zinc/58/77/62/1343587762.db2.gz	ZCSLATPCXJDSJK-RBUKOAKNSA-N	0	3	325.456	3.027	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccc(C#N)cc2F)C1	ZINC001036632320	1343589695	/nfs/dbraw/zinc/58/96/95/1343589695.db2.gz	LWQNPKDMSFKJSS-IEBWSBKVSA-N	0	3	341.430	3.086	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@H]3[C@@H](CCN3CC#Cc3ccccc3)C2)co1	ZINC001036699572	1343638266	/nfs/dbraw/zinc/63/82/66/1343638266.db2.gz	RJZIDPIFVADKGK-FPOVZHCZSA-N	0	3	348.446	3.176	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@@H]2[C@@H](CCN2Cc2ccc(Cl)cc2)C1	ZINC001036713154	1343646032	/nfs/dbraw/zinc/64/60/32/1343646032.db2.gz	DIIBEFAZXQHMBT-PKOBYXMFSA-N	0	3	342.870	3.176	20	30		EGEDHN
Cc1cocc1C(=O)N1CC[C@H]2[C@H](CCN2CC#Cc2ccccc2)C1	ZINC001036787423	1343717050	/nfs/dbraw/zinc/71/70/50/1343717050.db2.gz	LAVSHQNCLSROHZ-CTNGQTDRSA-N	0	3	348.446	3.176	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2[C@H](CCN2Cc2oc(CC)nc2C)C1	ZINC001036789129	1343718822	/nfs/dbraw/zinc/71/88/22/1343718822.db2.gz	MSGGQYQWNHCFEW-HZPDHXFCSA-N	0	3	345.487	3.180	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@@H]2CN(C(=O)[C@H]3C[C@H]4C[C@H]4C3)CC[C@@H]21	ZINC001036798409	1343732475	/nfs/dbraw/zinc/73/24/75/1343732475.db2.gz	KPWWSCPKPWFRNN-MJCUULBUSA-N	0	3	349.478	3.027	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCC[C@@H]1NC(=O)c1ccccc1	ZINC001036931224	1343874930	/nfs/dbraw/zinc/87/49/30/1343874930.db2.gz	QYPSEEXLNBEYAK-UXHICEINSA-N	0	3	333.435	3.247	20	30		EGEDHN
CC1(C(=O)N[C@H]2CCC[C@H]2CNCc2cc(F)ccc2C#N)CCC1	ZINC001037056250	1343953622	/nfs/dbraw/zinc/95/36/22/1343953622.db2.gz	DETMBTFNVVHXCQ-YJBOKZPZSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCC[C@@H]2CNCc2cc(C3CC3)no2)C1	ZINC001037075558	1343968770	/nfs/dbraw/zinc/96/87/70/1343968770.db2.gz	RGOMJSHIKRTTCL-WBVHZDCISA-N	0	3	343.471	3.283	20	30		EGEDHN
CC[C@@H]1CN(C(=O)C#CC2CC2)CC[C@@H]1NCc1c(F)cccc1F	ZINC001037839868	1344130185	/nfs/dbraw/zinc/13/01/85/1344130185.db2.gz	OMPXRJAYULBIEB-BEFAXECRSA-N	0	3	346.421	3.095	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1cc(F)cc2ccncc21	ZINC001038259387	1344348446	/nfs/dbraw/zinc/34/84/46/1344348446.db2.gz	GGXFSSDNYAGCKY-INIZCTEOSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1ccc(F)c2ccncc12	ZINC001038617590	1344505889	/nfs/dbraw/zinc/50/58/89/1344505889.db2.gz	WBDOYUGEXAIXMA-CQSZACIVSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1cnn(CCCC)c1CC	ZINC001038898729	1344639558	/nfs/dbraw/zinc/63/95/58/1344639558.db2.gz	CONPWCGLHZNTDU-INIZCTEOSA-N	0	3	332.492	3.016	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C[C@@H]2C=CCC2)CC[C@H]1c1ccc(F)cc1	ZINC001079148938	1357196608	/nfs/dbraw/zinc/19/66/08/1357196608.db2.gz	UBOPFFFODCGZQJ-LSTHTHJFSA-N	0	3	340.442	3.089	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C(C)(C)C(=C)Cl)C[C@H]1c1cccc(F)c1	ZINC001079186542	1357203130	/nfs/dbraw/zinc/20/31/30/1357203130.db2.gz	QJMFHLVSOWIBMY-DLBZAZTESA-N	0	3	348.849	3.122	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)c3[nH]ccc3C)CC2)C1	ZINC001039119913	1344793350	/nfs/dbraw/zinc/79/33/50/1344793350.db2.gz	GDWDNKHVAKNQMG-MRXNPFEDSA-N	0	3	335.879	3.250	20	30		EGEDHN
CC(C)C(=O)N1CCCC[C@@H]1[C@@H]1CCN(CC#Cc2ccccc2)C1	ZINC001039185239	1344884105	/nfs/dbraw/zinc/88/41/05/1344884105.db2.gz	DPSSKXQCSUQNCM-NHCUHLMSSA-N	0	3	338.495	3.397	20	30		EGEDHN
C=C(C)C[N@@H+]1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001039194292	1344900721	/nfs/dbraw/zinc/90/07/21/1344900721.db2.gz	YJUAAZMQBIRZAO-AEFFLSMTSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=C(C)C[N@H+]1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001039194292	1344900725	/nfs/dbraw/zinc/90/07/25/1344900725.db2.gz	YJUAAZMQBIRZAO-AEFFLSMTSA-N	0	3	328.456	3.285	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(F)c(C)cc2F)C1	ZINC001039215593	1344931429	/nfs/dbraw/zinc/93/14/29/1344931429.db2.gz	VOGCHCCAAMHOAZ-BEFAXECRSA-N	0	3	346.421	3.223	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccn3ccccc23)C1	ZINC001039215617	1344931671	/nfs/dbraw/zinc/93/16/71/1344931671.db2.gz	LLPNXMOUPKCQQM-ICSRJNTNSA-N	0	3	349.478	3.279	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc(C)cc(F)c2)C1	ZINC001039228688	1344948550	/nfs/dbraw/zinc/94/85/50/1344948550.db2.gz	HDQHLURCZLGANC-YLJYHZDGSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)Cc2cc(C)cc(C)c2)C1	ZINC001039231286	1344951219	/nfs/dbraw/zinc/95/12/19/1344951219.db2.gz	REPCHEKQEFGLLQ-RTWAWAEBSA-N	0	3	338.495	3.182	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc[nH]c2C2CCC2)C1	ZINC001039233577	1344953573	/nfs/dbraw/zinc/95/35/73/1344953573.db2.gz	LUGWBLKDMQRFMZ-MJGOQNOKSA-N	0	3	339.483	3.232	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc(C(C)C)no2)C1	ZINC001039234416	1344954951	/nfs/dbraw/zinc/95/49/51/1344954951.db2.gz	JJMLLCYTIWHMGB-SJLPKXTDSA-N	0	3	343.471	3.138	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccc2c1CCCC2	ZINC001039379636	1345035318	/nfs/dbraw/zinc/03/53/18/1345035318.db2.gz	ZWBJACMDWFJFKP-MOPGFXCFSA-N	0	3	336.479	3.268	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@H](C)c1c(C)noc1C	ZINC001039395825	1345044609	/nfs/dbraw/zinc/04/46/09/1345044609.db2.gz	LVEYQEALUFXLKQ-XKQJLSEDSA-N	0	3	331.460	3.036	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccc2ncccc12	ZINC001039403736	1345049378	/nfs/dbraw/zinc/04/93/78/1345049378.db2.gz	MCWZUVJEHGIFIF-MSOLQXFVSA-N	0	3	335.451	3.029	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccc2c1CCOC2	ZINC001039404008	1345049475	/nfs/dbraw/zinc/04/94/75/1345049475.db2.gz	BARRVNHMGZRYHY-MSOLQXFVSA-N	0	3	340.467	3.014	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)CCc1nc(C)cs1	ZINC001039405706	1345050678	/nfs/dbraw/zinc/05/06/78/1345050678.db2.gz	CEPFDMPFPOSEDI-CVEARBPZSA-N	0	3	333.501	3.026	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1CCc2cc(F)ccc21	ZINC001039405867	1345050842	/nfs/dbraw/zinc/05/08/42/1345050842.db2.gz	MNMJMJOUNANWBR-HBFSDRIKSA-N	0	3	342.458	3.497	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(Cl)c(Cl)[nH]1	ZINC001039412127	1345054561	/nfs/dbraw/zinc/05/45/61/1345054561.db2.gz	CQLDKWIPVVEJCO-NEPJUHHUSA-N	0	3	340.254	3.024	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)CCc1ccc(C)cc1C	ZINC001039413444	1345055749	/nfs/dbraw/zinc/05/57/49/1345055749.db2.gz	XZMSXCFKZUHHJL-UXHICEINSA-N	0	3	326.484	3.487	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1csc(C(C)(C)C)n1	ZINC001039453432	1345075997	/nfs/dbraw/zinc/07/59/97/1345075997.db2.gz	BPWQVGCNRFNBJU-CVEARBPZSA-N	0	3	347.528	3.234	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2c(c1)CCCC2	ZINC001039466239	1345083863	/nfs/dbraw/zinc/08/38/63/1345083863.db2.gz	ZXAUCKBUMLFQKJ-RTWAWAEBSA-N	0	3	336.479	3.268	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccc2cnccc21	ZINC001039471204	1345087234	/nfs/dbraw/zinc/08/72/34/1345087234.db2.gz	MREHPOSIJQTZEB-MSOLQXFVSA-N	0	3	335.451	3.490	20	30		EGEDHN
C=CCn1cccc1C(=O)N1C[C@H]2CCC[C@@H](C1)N2CCC(=C)C	ZINC001039644485	1345152311	/nfs/dbraw/zinc/15/23/11/1345152311.db2.gz	DFMHUSNVLKSLBZ-HDICACEKSA-N	0	3	327.472	3.319	20	30		EGEDHN
C=CCn1cccc1C(=O)N1C[C@H]2CCC[C@@H](C1)N2C[C@H](C)CC	ZINC001039644851	1345152975	/nfs/dbraw/zinc/15/29/75/1345152975.db2.gz	YUNFYHIVCVJAOR-KURKYZTESA-N	0	3	329.488	3.399	20	30		EGEDHN
C#Cc1cncc(C(=O)N2C[C@H]3CCC[C@@H](C2)N3CCC(C)(C)C)c1	ZINC001039905765	1345242932	/nfs/dbraw/zinc/24/29/32/1345242932.db2.gz	UYKAVUAJQKWYLF-KDURUIRLSA-N	0	3	339.483	3.178	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N1C[C@H]2CCC[C@@H](C1)N2CCC(C)C	ZINC001039941430	1345254494	/nfs/dbraw/zinc/25/44/94/1345254494.db2.gz	REXAERAUIFUZOZ-YRPNKDGESA-N	0	3	348.531	3.469	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N2C[C@H]3CCC[C@@H](C2)N3CCC)cc1	ZINC001040018643	1345290108	/nfs/dbraw/zinc/29/01/08/1345290108.db2.gz	YUCSSQQYZSKRKZ-KDURUIRLSA-N	0	3	342.483	3.269	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@]3(CCN(C(=O)C4CC=CC4)C3)C2)c1	ZINC001040130161	1345344554	/nfs/dbraw/zinc/34/45/54/1345344554.db2.gz	NAHLALOSGZVQIB-QFIPXVFZSA-N	0	3	349.478	3.339	20	30		EGEDHN
Cc1cc(CN2CCC[C@]3(CCN(C(=O)C#CC4CC4)C3)C2)cs1	ZINC001040196114	1345370838	/nfs/dbraw/zinc/37/08/38/1345370838.db2.gz	BRQOUOBATLNUNF-FQEVSTJZSA-N	0	3	342.508	3.284	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3cccc4c3CCCC4)C2)C1	ZINC001040221715	1345381600	/nfs/dbraw/zinc/38/16/00/1345381600.db2.gz	VWZRITSCAJCWQW-QFIPXVFZSA-N	0	3	336.479	3.127	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cc4ccncc4s3)C2)C1	ZINC001040240495	1345390908	/nfs/dbraw/zinc/39/09/08/1345390908.db2.gz	HFKOEBIUBJWKHW-IBGZPJMESA-N	0	3	341.480	3.410	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cc(F)c(C)cc3F)C2)C1	ZINC001040250704	1345395095	/nfs/dbraw/zinc/39/50/95/1345395095.db2.gz	SSUNHJIFYXAAMQ-IBGZPJMESA-N	0	3	334.410	3.387	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cnc(CC4CC4)s3)C2)C1	ZINC001040304467	1345423060	/nfs/dbraw/zinc/42/30/60/1345423060.db2.gz	UVKSSALBKVAVNP-LJQANCHMSA-N	0	3	345.512	3.210	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)C3(C4CCC4)CCC3)C2)C1	ZINC001040318500	1345428458	/nfs/dbraw/zinc/42/84/58/1345428458.db2.gz	UAJOHHBUNIADOA-FQEVSTJZSA-N	0	3	328.500	3.295	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3cc4cc(C)ccc4[nH]3)C2)C1	ZINC001040323042	1345431651	/nfs/dbraw/zinc/43/16/51/1345431651.db2.gz	NQXFIDACVMGORE-NRFANRHFSA-N	0	3	335.451	3.038	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3ccc(Cl)cc3OC)C2)C1	ZINC001040355834	1345451590	/nfs/dbraw/zinc/45/15/90/1345451590.db2.gz	FLXDLKDLYIXNDH-LJQANCHMSA-N	0	3	348.874	3.463	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@@H](C)OC3CCCCCC3)C2)C1	ZINC001040384498	1345468556	/nfs/dbraw/zinc/46/85/56/1345468556.db2.gz	NXYAOIFKUYFLSR-NQIIRXRSSA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@H](C)OC3CCCCCC3)C2)C1	ZINC001040384506	1345469320	/nfs/dbraw/zinc/46/93/20/1345469320.db2.gz	NXYAOIFKUYFLSR-RXVVDRJESA-N	0	3	346.515	3.062	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cccc4[nH]ccc43)C2)C1	ZINC001040416084	1345485133	/nfs/dbraw/zinc/48/51/33/1345485133.db2.gz	UBMHXSRSOOMGCF-OAQYLSRUSA-N	0	3	335.451	3.119	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3cc(F)ccc3Cl)C2)C1	ZINC001040417045	1345485465	/nfs/dbraw/zinc/48/54/65/1345485465.db2.gz	ABSWVHJGBKRCFY-GOSISDBHSA-N	0	3	334.822	3.040	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@H](CC)Cc3ccccc3)C2)C1	ZINC001040431557	1345494692	/nfs/dbraw/zinc/49/46/92/1345494692.db2.gz	PPMGQSXRWLPPIQ-IRLDBZIGSA-N	0	3	338.495	3.203	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cc([C@@H](C)CC)no3)C2)C1	ZINC001040434713	1345497637	/nfs/dbraw/zinc/49/76/37/1345497637.db2.gz	KGZQJXCROTUXNM-OXJNMPFZSA-N	0	3	343.471	3.140	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3csc(C(C)C)n3)C2)C1	ZINC001040453605	1345508038	/nfs/dbraw/zinc/50/80/38/1345508038.db2.gz	OISHTPLVTLAENG-IBGZPJMESA-N	0	3	345.512	3.218	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)C3(C(F)(F)F)CCCC3)C2)C1	ZINC001040551221	1345543396	/nfs/dbraw/zinc/54/33/96/1345543396.db2.gz	KPMJAJWHRWRIQT-INIZCTEOSA-N	0	3	342.405	3.057	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3coc4ccccc34)C2)C1	ZINC001040553218	1345544233	/nfs/dbraw/zinc/54/42/33/1345544233.db2.gz	SSUWPEQRCDQEDS-NRFANRHFSA-N	0	3	336.435	3.384	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@@H]3CCC[C@H]3C(F)F)C2)CC1	ZINC001040730577	1345571826	/nfs/dbraw/zinc/57/18/26/1345571826.db2.gz	WOPZVGQADZOWMK-HZPDHXFCSA-N	0	3	338.442	3.006	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@H]3[C@H](C=C(C)C)C3(C)C)C2)CC1	ZINC001040766038	1345576564	/nfs/dbraw/zinc/57/65/64/1345576564.db2.gz	YXCXJXZNAVUNAB-ZWKOTPCHSA-N	0	3	328.500	3.173	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cc4c(ccc(C)c4C)[nH]3)C2)CC1	ZINC001040800885	1345579545	/nfs/dbraw/zinc/57/95/45/1345579545.db2.gz	NXASJDGKPPOCAP-UHFFFAOYSA-N	0	3	349.478	3.346	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccccc3-n3cccc3)C2)CC1	ZINC001040829704	1345583988	/nfs/dbraw/zinc/58/39/88/1345583988.db2.gz	FITIFJQJAFPIEV-UHFFFAOYSA-N	0	3	347.462	3.039	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@H](CC)Cc3ccccc3)C2)CC1	ZINC001040869946	1345590795	/nfs/dbraw/zinc/59/07/95/1345590795.db2.gz	APKAKUFOTVPRQM-HXUWFJFHSA-N	0	3	338.495	3.203	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccc4nc(C)ccc4c3)C2)CC1	ZINC001040889342	1345594583	/nfs/dbraw/zinc/59/45/83/1345594583.db2.gz	YZSPMCJQUIXUDE-UHFFFAOYSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccoc3CCC)C2)CC1	ZINC001040913175	1345599219	/nfs/dbraw/zinc/59/92/19/1345599219.db2.gz	ZBSPVFRUAJFMRX-UHFFFAOYSA-N	0	3	328.456	3.184	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3occ4c3CCCC4)C2)CC1	ZINC001040926061	1345602049	/nfs/dbraw/zinc/60/20/49/1345602049.db2.gz	IFZAUAHOKAEPII-UHFFFAOYSA-N	0	3	340.467	3.110	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cc(CC)c(C)s3)C2)CC1	ZINC001040930090	1345603397	/nfs/dbraw/zinc/60/33/97/1345603397.db2.gz	JXMJKPDWMMFIQM-UHFFFAOYSA-N	0	3	330.497	3.180	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)C34CCC(CC3)CC4)C2)CC1	ZINC001040944994	1345606267	/nfs/dbraw/zinc/60/62/67/1345606267.db2.gz	LDBRMTRRGULYPL-UHFFFAOYSA-N	0	3	328.500	3.295	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@]3(CCN(C(=O)c4ccccc4)C3)C2)c1	ZINC001041028836	1345628497	/nfs/dbraw/zinc/62/84/97/1345628497.db2.gz	WAZYJICHDZJPFB-JOCHJYFZSA-N	0	3	345.446	3.296	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@]2(CCN(Cc3ccc(C#N)cc3)C2)C1)C1CC1	ZINC001041175170	1345666671	/nfs/dbraw/zinc/66/66/71/1345666671.db2.gz	RROZLDCVFNEZGP-KKSFZXQISA-N	0	3	337.467	3.029	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@]3(CCN(Cc4ccc(C#N)cc4)C3)C2)co1	ZINC001041235909	1345682486	/nfs/dbraw/zinc/68/24/86/1345682486.db2.gz	FTOQGQCRTHOCBE-NRFANRHFSA-N	0	3	349.434	3.198	20	30		EGEDHN
C[C@@H](c1ccccc1F)N1CC[C@@]2(CCN(C(=O)C#CC3CC3)C2)C1	ZINC001041265573	1345689963	/nfs/dbraw/zinc/68/99/63/1345689963.db2.gz	JTHVKBFINYLVBC-HRAATJIYSA-N	0	3	340.442	3.225	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@@]2(CCN(C/C=C/c3ccccc3)C2)C1	ZINC001041273583	1345691918	/nfs/dbraw/zinc/69/19/18/1345691918.db2.gz	OBEFSJODVOTRRI-ZMTJCJBESA-N	0	3	334.463	3.038	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)C[C@@H]3C[C@H]3c3ccccc3)C2)C1	ZINC001041291652	1345695615	/nfs/dbraw/zinc/69/56/15/1345695615.db2.gz	VAEZQBFHRPYKIY-ONTIZHBOSA-N	0	3	336.479	3.128	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)C3C4CC5CC(C4)CC3C5)C2)C1	ZINC001041361603	1345709779	/nfs/dbraw/zinc/70/97/79/1345709779.db2.gz	AYSNDSKQSLFXSR-CUZPGCTQSA-N	0	3	340.511	3.006	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@]3(CCN(C(=O)C4(C5CC5)CC4)C3)C2)cc1	ZINC001041385862	1345713508	/nfs/dbraw/zinc/71/35/08/1345713508.db2.gz	GRSAFXCIVNCUGJ-OAQYLSRUSA-N	0	3	349.478	3.173	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)Cc3ccc(C)c(Cl)c3)C2)C1	ZINC001041401703	1345718342	/nfs/dbraw/zinc/71/83/42/1345718342.db2.gz	DMMPNNAFZQQKPH-FQEVSTJZSA-N	0	3	344.886	3.139	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)Cc3cccc(C)c3Cl)C2)C1	ZINC001041469257	1345738017	/nfs/dbraw/zinc/73/80/17/1345738017.db2.gz	ZFRKOBQGPMWDSV-HXUWFJFHSA-N	0	3	344.886	3.139	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cnc4ccccc4c3C)C2)C1	ZINC001041476106	1345739732	/nfs/dbraw/zinc/73/97/32/1345739732.db2.gz	OECTXTGXHLYLJF-JOCHJYFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3nc4ccccc4cc3C)C2)C1	ZINC001041488820	1345743096	/nfs/dbraw/zinc/74/30/96/1345743096.db2.gz	LCBGJYUSZDKLQU-JOCHJYFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cc4c(cc(C)cc4C)[nH]3)C2)C1	ZINC001041515068	1345749085	/nfs/dbraw/zinc/74/90/85/1345749085.db2.gz	NTCZJNDKKGFDOC-QFIPXVFZSA-N	0	3	349.478	3.346	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)CCc3ccc(C)cc3C)C2)C1	ZINC001041515614	1345750238	/nfs/dbraw/zinc/75/02/38/1345750238.db2.gz	SMUVVPULCNFZJK-JOCHJYFZSA-N	0	3	338.495	3.184	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@]2(CCN(Cc3cccc(F)c3)C2)C1	ZINC001041541156	1345756168	/nfs/dbraw/zinc/75/61/68/1345756168.db2.gz	TZHZOYUYIZPVBY-HXUWFJFHSA-N	0	3	330.447	3.462	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@]2(CCN(Cc3c(C)onc3CC)C2)C1	ZINC001041545845	1345759980	/nfs/dbraw/zinc/75/99/80/1345759980.db2.gz	YNKVALGUSDZFIK-FQEVSTJZSA-N	0	3	345.487	3.182	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccc(Cl)cc3C)C2)C1	ZINC001041625413	1345800560	/nfs/dbraw/zinc/80/05/60/1345800560.db2.gz	HZUNDFNNZFTZHX-LJQANCHMSA-N	0	3	330.859	3.210	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3c(C)cccc3Cl)C2)C1	ZINC001041632555	1345802839	/nfs/dbraw/zinc/80/28/39/1345802839.db2.gz	KGWJSTRLUYLCTR-IBGZPJMESA-N	0	3	330.859	3.210	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@]3(CCN(C(=O)C4CC5(CC5)C4)C3)C2)cc1	ZINC001041664494	1345815822	/nfs/dbraw/zinc/81/58/22/1345815822.db2.gz	NATVAPSTFAABQM-JOCHJYFZSA-N	0	3	349.478	3.173	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@]3(CCN(C(=O)[C@H]4CC45CCC5)C3)C2)cc1	ZINC001041713125	1345828542	/nfs/dbraw/zinc/82/85/42/1345828542.db2.gz	CWYXPYLDNPGTHL-CTNGQTDRSA-N	0	3	349.478	3.173	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)C[C@H](C)c3ccccc3C)C2)C1	ZINC001041724044	1345832331	/nfs/dbraw/zinc/83/23/31/1345832331.db2.gz	MQJYTOSVXJXZRY-UGKGYDQZSA-N	0	3	338.495	3.436	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)C(C)(C)Cc3ccccc3)C2)C1	ZINC001041775303	1345846117	/nfs/dbraw/zinc/84/61/17/1345846117.db2.gz	KZPMVZMGIFSBKH-JOCHJYFZSA-N	0	3	338.495	3.203	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)[C@H](C)c3ccc(C)s3)C2)C1	ZINC001041788112	1345850293	/nfs/dbraw/zinc/85/02/93/1345850293.db2.gz	WGRCWHMXBFCPRF-VQIMIIECSA-N	0	3	330.497	3.108	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3cc4cc(C)c(C)cc4o3)C2)C1	ZINC001041788611	1345850497	/nfs/dbraw/zinc/85/04/97/1345850497.db2.gz	GTJSNXHEGGSUTE-NRFANRHFSA-N	0	3	336.435	3.221	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)CC34CC5CC(CC(C5)C3)C4)C2)C1	ZINC001041804108	1345856636	/nfs/dbraw/zinc/85/66/36/1345856636.db2.gz	QGBRAHMDQSCPDW-RKRCHRGQSA-N	0	3	340.511	3.151	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)[C@@H](CC)c3ccc(Cl)cc3)C2)C1	ZINC001041842076	1345870169	/nfs/dbraw/zinc/87/01/69/1345870169.db2.gz	AKGFFWLFTODPRX-ICSRJNTNSA-N	0	3	344.886	3.391	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)[C@H]3CCCCc4ccccc43)C2)C1	ZINC001041847239	1345872344	/nfs/dbraw/zinc/87/23/44/1345872344.db2.gz	LWHJHNLLXQYUMU-UNMCSNQZSA-N	0	3	336.479	3.054	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc4nccc(C)c4c3)C[C@H]21	ZINC001042077852	1345939093	/nfs/dbraw/zinc/93/90/93/1345939093.db2.gz	QKZBNECFPUIALU-OXJNMPFZSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(-c4cnco4)cc3)C[C@@H]21	ZINC001042116009	1345948382	/nfs/dbraw/zinc/94/83/82/1345948382.db2.gz	FJRBZWVGWBBTAG-QAPCUYQASA-N	0	3	337.423	3.064	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C3(C)CCC(F)(F)CC3)C[C@H]21	ZINC001042119381	1345948950	/nfs/dbraw/zinc/94/89/50/1345948950.db2.gz	GSWCWULMVXRLSE-HUUCEWRRSA-N	0	3	326.431	3.311	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(C)cc(OC)c3C)C[C@H]21	ZINC001042132587	1345951606	/nfs/dbraw/zinc/95/16/06/1345951606.db2.gz	DVXKTCUTTBQKIB-FUHWJXTLSA-N	0	3	328.456	3.034	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc(-n4cccc4)cc3)C[C@H]21	ZINC001042140521	1345954046	/nfs/dbraw/zinc/95/40/46/1345954046.db2.gz	ATNKULHRMZJTPJ-GHTZIAJQSA-N	0	3	347.462	3.037	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)CCc3ccc4[nH]ccc4c3)C[C@H]21	ZINC001042152028	1345957526	/nfs/dbraw/zinc/95/75/26/1345957526.db2.gz	DBBFWGDEZZZHAO-WIYYLYMNSA-N	0	3	349.478	3.047	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc(C)c4cccnc34)C[C@H]21	ZINC001042154868	1345957640	/nfs/dbraw/zinc/95/76/40/1345957640.db2.gz	GHEMGIYIYLWZNS-YLJYHZDGSA-N	0	3	347.462	3.103	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(C)c4cccnc34)C[C@@H]21	ZINC001042155799	1345958520	/nfs/dbraw/zinc/95/85/20/1345958520.db2.gz	NARVCESKLJTYDZ-APWZRJJASA-N	0	3	335.451	3.266	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cc(C)cc(Cl)c3)C[C@H]21	ZINC001042156454	1345958973	/nfs/dbraw/zinc/95/89/73/1345958973.db2.gz	JCSNOTGGWAQSMF-MAUKXSAKSA-N	0	3	330.859	3.208	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(-c4cccs4)on3)C[C@H]21	ZINC001042171009	1345966018	/nfs/dbraw/zinc/96/60/18/1345966018.db2.gz	BUVGIRNAVCIAMK-UKRRQHHQSA-N	0	3	343.452	3.126	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3CCN(C(=O)[C@H]4C[C@H]5C[C@H]5C4)C[C@@H]32)c1	ZINC001042196049	1345978417	/nfs/dbraw/zinc/97/84/17/1345978417.db2.gz	GIVMXCMCQNGPSW-AFDCHOCNSA-N	0	3	349.478	3.027	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3ccc(C#N)cc3)[C@@H]2C1	ZINC001042208902	1345986861	/nfs/dbraw/zinc/98/68/61/1345986861.db2.gz	UPWJPTJRAIKANH-RTBURBONSA-N	0	3	339.483	3.417	20	30		EGEDHN
CC(F)(F)CC(=O)N1CC[C@H]2CCN(Cc3ccc(C#N)cc3)[C@H]2C1	ZINC001042218388	1345990769	/nfs/dbraw/zinc/99/07/69/1345990769.db2.gz	JDBLKLXZKSHIMC-SJORKVTESA-N	0	3	347.409	3.026	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]3CCN(Cc4cccnc4C)[C@@H]3C2)C1	ZINC001042224818	1345995440	/nfs/dbraw/zinc/99/54/40/1345995440.db2.gz	RLIFAOCRFUHDMT-IEBWSBKVSA-N	0	3	339.483	3.169	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]3CCN(Cc4cnccc4C)[C@H]3C2)C1	ZINC001042227190	1345996054	/nfs/dbraw/zinc/99/60/54/1345996054.db2.gz	ILSABRUZMFQSCV-HKUYNNGSSA-N	0	3	339.483	3.169	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]3CCN(Cc4ncccc4C)[C@@H]3C2)C1	ZINC001042228073	1345996630	/nfs/dbraw/zinc/99/66/30/1345996630.db2.gz	PLZYHDCDZAKNAP-IEBWSBKVSA-N	0	3	339.483	3.169	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)Cc3ccc(C(C)(C)C)cc3)C[C@H]21	ZINC001042247263	1346004744	/nfs/dbraw/zinc/00/47/44/1346004744.db2.gz	NLFGMIHQXIWMIU-UYAOXDASSA-N	0	3	338.495	3.083	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3cnc(C(C)C)nc3C)C[C@H]21	ZINC001042259168	1346008899	/nfs/dbraw/zinc/00/88/99/1346008899.db2.gz	FUZRBPHMTJCXGO-SJLPKXTDSA-N	0	3	342.487	3.021	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)C34CCC(CC3)C4(C)C)C[C@H]21	ZINC001042262917	1346010298	/nfs/dbraw/zinc/01/02/98/1346010298.db2.gz	QIEMNLBMSFGTJG-LWLAFGSWSA-N	0	3	328.500	3.149	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3scnc3C(C)C)C[C@@H]21	ZINC001042263941	1346011147	/nfs/dbraw/zinc/01/11/47/1346011147.db2.gz	ZRIVRBGLTXUGSE-GJZGRUSLSA-N	0	3	333.501	3.379	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C3(Cc4ccccc4F)CC3)C[C@@H]21	ZINC001042266543	1346012657	/nfs/dbraw/zinc/01/26/57/1346012657.db2.gz	NHODBXPROZMDMP-APWZRJJASA-N	0	3	342.458	3.257	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cccn3C3CCCC3)C[C@H]21	ZINC001042291549	1346019476	/nfs/dbraw/zinc/01/94/76/1346019476.db2.gz	ZBFUHFQHELMWKV-VQIMIIECSA-N	0	3	327.472	3.326	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc4scnc4c3)C[C@H]21	ZINC001042296742	1346021577	/nfs/dbraw/zinc/02/15/77/1346021577.db2.gz	FJKBWOZYZQDPPG-CZUORRHYSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3ncoc3C(C)(C)C)C[C@H]21	ZINC001042307167	1346026383	/nfs/dbraw/zinc/02/63/83/1346026383.db2.gz	MKUGTSXLFLIVGE-LSDHHAIUSA-N	0	3	331.460	3.085	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3ncsc3C(C)C)C[C@@H]21	ZINC001042308974	1346027127	/nfs/dbraw/zinc/02/71/27/1346027127.db2.gz	IQLJUZHAABQKFN-GJZGRUSLSA-N	0	3	333.501	3.379	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3coc(-c4ccccc4)n3)C[C@H]21	ZINC001042316183	1346030875	/nfs/dbraw/zinc/03/08/75/1346030875.db2.gz	IUWPROWONBCXII-MAUKXSAKSA-N	0	3	337.423	3.064	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cccc(C(F)(F)F)c3)C[C@@H]21	ZINC001042326953	1346035958	/nfs/dbraw/zinc/03/59/58/1346035958.db2.gz	KUPNHQWPGNMBCD-BBRMVZONSA-N	0	3	338.373	3.428	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3cc4c(s3)CCCC4)C[C@@H]21	ZINC001042338739	1346043400	/nfs/dbraw/zinc/04/34/00/1346043400.db2.gz	LVHMHBFUNCEERS-RDJZCZTQSA-N	0	3	342.508	3.187	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc(OC(C)C)cc3)C[C@@H]21	ZINC001042344686	1346048023	/nfs/dbraw/zinc/04/80/23/1346048023.db2.gz	ZMYKNHUZPHPMCX-XLIONFOSSA-N	0	3	340.467	3.034	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3cc4cc(C)ccc4o3)C[C@H]21	ZINC001042369162	1346060083	/nfs/dbraw/zinc/06/00/83/1346060083.db2.gz	UPJOPDSGWXPJBL-FUHWJXTLSA-N	0	3	336.435	3.301	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc(-c4ccccc4)[nH]3)C[C@H]21	ZINC001042373479	1346062292	/nfs/dbraw/zinc/06/22/92/1346062292.db2.gz	GPHFLTOHTHFTPL-GHTZIAJQSA-N	0	3	347.462	3.241	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(N(C)C(C)C)cc3)C[C@H]21	ZINC001042379267	1346064443	/nfs/dbraw/zinc/06/44/43/1346064443.db2.gz	IWKCMXWVVQYGRV-FXAWDEMLSA-N	0	3	341.499	3.254	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(N(C)CCC)cc3)C[C@H]21	ZINC001042379935	1346065374	/nfs/dbraw/zinc/06/53/74/1346065374.db2.gz	PTGQLWQERWCHFL-FXAWDEMLSA-N	0	3	341.499	3.255	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C(C)(C)c3ccccc3OC)C[C@@H]21	ZINC001042385725	1346066983	/nfs/dbraw/zinc/06/69/83/1346066983.db2.gz	VPWPQWICNWDCTP-AEFFLSMTSA-N	0	3	342.483	3.082	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)/C=C/c1ccco1	ZINC001044430960	1346328237	/nfs/dbraw/zinc/32/82/37/1346328237.db2.gz	KKAMLHBANLDIRN-ZCLAENRFSA-N	0	3	349.434	3.334	20	30		EGEDHN
C[C@H]1C[C@@H](NCc2cc(F)ccc2C#N)CCN1C(=O)c1ccoc1	ZINC001044457220	1346337803	/nfs/dbraw/zinc/33/78/03/1346337803.db2.gz	FSGFDTGRVAXAQP-UGSOOPFHSA-N	0	3	341.386	3.073	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@@H](NCc2ccccc2C#N)C[C@H]1C	ZINC001044471508	1346342383	/nfs/dbraw/zinc/34/23/83/1346342383.db2.gz	OMSMJPUMPDTZJT-DNVCBOLYSA-N	0	3	327.472	3.464	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@H](NCc2ccccc2C#N)C[C@@H]1C	ZINC001044471510	1346342715	/nfs/dbraw/zinc/34/27/15/1346342715.db2.gz	OMSMJPUMPDTZJT-KXBFYZLASA-N	0	3	327.472	3.464	20	30		EGEDHN
C/C(=C\C(=O)N1CC[C@H](NCc2ccccc2C#N)C[C@H]1C)C1CC1	ZINC001044491566	1346347055	/nfs/dbraw/zinc/34/70/55/1346347055.db2.gz	SSSFOKOQQPQJBS-HWIYTKFHSA-N	0	3	337.467	3.384	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)/C=C/c1ccc[nH]1	ZINC001044570486	1346371688	/nfs/dbraw/zinc/37/16/88/1346371688.db2.gz	IQPPMZOVJZOPEV-QBWPFYJZSA-N	0	3	348.450	3.069	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)Cc1ccccc1	ZINC001044649948	1346393048	/nfs/dbraw/zinc/39/30/48/1346393048.db2.gz	AWQZNXKTIXIQAG-UTKZUKDTSA-N	0	3	347.462	3.270	20	30		EGEDHN
Cc1cocc1C(=O)N1CC[C@@H](NCc2ccccc2C#N)C[C@H]1C	ZINC001044706549	1346407058	/nfs/dbraw/zinc/40/70/58/1346407058.db2.gz	CEMCLPSHMVIWKW-CRAIPNDOSA-N	0	3	337.423	3.243	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3ccn(CC)n3)C[C@H]2C)CC1	ZINC001044729865	1346414566	/nfs/dbraw/zinc/41/45/66/1346414566.db2.gz	KZOVKLFAXWEDCE-AEFFLSMTSA-N	0	3	344.503	3.119	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)C[C@H]2C=CCC2)s1	ZINC001044914832	1346461932	/nfs/dbraw/zinc/46/19/32/1346461932.db2.gz	JGKPEGYHXVAPLO-GJZGRUSLSA-N	0	3	329.469	3.057	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)C[C@@H]2C[C@H]2C2CC2)s1	ZINC001045128499	1346500321	/nfs/dbraw/zinc/50/03/21/1346500321.db2.gz	ZPYTZWJZPDZLAJ-MPGHIAIKSA-N	0	3	343.496	3.137	20	30		EGEDHN
Cc1cc(C(=O)NC2(C)CCN(Cc3cccc(C#N)c3)CC2)ccn1	ZINC001045590528	1346639187	/nfs/dbraw/zinc/63/91/87/1346639187.db2.gz	IFJWDALKDPLFJR-UHFFFAOYSA-N	0	3	348.450	3.046	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2ccc(OC)c(C3CC3)c2)CC1	ZINC001045600538	1346641103	/nfs/dbraw/zinc/64/11/03/1346641103.db2.gz	ANPQWGIUEBHACH-UHFFFAOYSA-N	0	3	328.456	3.343	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)[C@H]2C[C@H]2c2cc(F)ccc2F)CC1	ZINC001045643380	1346656817	/nfs/dbraw/zinc/65/68/17/1346656817.db2.gz	ATVNHEUCRCHPIE-HOCLYGCPSA-N	0	3	334.410	3.225	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]3CC[C@@H](C2)N3Cc2cnccc2C)C1	ZINC001045844449	1346718793	/nfs/dbraw/zinc/71/87/93/1346718793.db2.gz	LUJZTHBVXNLELC-MOPGFXCFSA-N	0	3	339.483	3.312	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1c(C)noc1C(C)C)C2	ZINC001045945032	1346780659	/nfs/dbraw/zinc/78/06/59/1346780659.db2.gz	NBTFAVJYDFWHRL-FQEVSTJZSA-N	0	3	343.471	3.058	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc(CC)o1)C2	ZINC001045949160	1346784233	/nfs/dbraw/zinc/78/42/33/1346784233.db2.gz	YZOONZQNGBTPDB-FQEVSTJZSA-N	0	3	328.456	3.184	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc(OC)cc1)C2	ZINC001045980818	1346818898	/nfs/dbraw/zinc/81/88/98/1346818898.db2.gz	KAZUFEAVKQFJFZ-OAQYLSRUSA-N	0	3	340.467	3.037	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc(C(F)F)o1)C2	ZINC001045982275	1346820845	/nfs/dbraw/zinc/82/08/45/1346820845.db2.gz	SDBFKHOWARYXRA-GOSISDBHSA-N	0	3	336.382	3.169	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)C(C)(C)C(C)(F)F)C2	ZINC001045982142	1346821216	/nfs/dbraw/zinc/82/12/16/1346821216.db2.gz	PEHZFXXWJNTFNY-LJQANCHMSA-N	0	3	340.458	3.396	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc(C)c(C)s1)C2	ZINC001045983521	1346823180	/nfs/dbraw/zinc/82/31/80/1346823180.db2.gz	OXSPSKPFBBFONZ-IBGZPJMESA-N	0	3	330.497	3.316	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@H](C=C)c1ccccc1)C2	ZINC001045985493	1346826191	/nfs/dbraw/zinc/82/61/91/1346826191.db2.gz	VOHVUVBTBUHXEG-IFMALSPDSA-N	0	3	336.479	3.294	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cnc(C(C)C)s1)C2	ZINC001045988153	1346829809	/nfs/dbraw/zinc/82/98/09/1346829809.db2.gz	JOFVJVLZPVYJHZ-IBGZPJMESA-N	0	3	345.512	3.218	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C3CC3)cc2)C[C@H]1NC(=O)c1c[nH]c(C#N)c1	ZINC001079601109	1357322918	/nfs/dbraw/zinc/32/29/18/1357322918.db2.gz	JANIDXMAJCWDGX-JLTOFOAXSA-N	0	3	348.450	3.014	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2cn(CC)c3ccccc23)C1	ZINC001046468042	1346984798	/nfs/dbraw/zinc/98/47/98/1346984798.db2.gz	MEOTYWISOSZOGZ-HXUWFJFHSA-N	0	3	325.456	3.432	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@]2(C)CCN(Cc3ccccc3CC)C2)c1	ZINC001046608590	1347038396	/nfs/dbraw/zinc/03/83/96/1347038396.db2.gz	XRYMWWNDYLTSNH-QFIPXVFZSA-N	0	3	347.462	3.020	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2cnc3ccc(F)cc3c2)C1	ZINC001046758857	1347087535	/nfs/dbraw/zinc/08/75/35/1347087535.db2.gz	VDGXHZAIIUANKY-IBGZPJMESA-N	0	3	327.403	3.144	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2cc3ccccc3n2CC)C1	ZINC001046849362	1347128785	/nfs/dbraw/zinc/12/87/85/1347128785.db2.gz	DMPHLNFYFIOFCS-FQEVSTJZSA-N	0	3	325.456	3.432	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@H]3C[C@@H](C2)N(Cc2cnc(C)o2)C3)CC1	ZINC001047139321	1347217938	/nfs/dbraw/zinc/21/79/38/1347217938.db2.gz	QBJXFPCLGFHQGS-SZMVWBNQSA-N	0	3	343.471	3.199	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)N(CC#Cc2ccccc2)C3)C1	ZINC001047143475	1347218787	/nfs/dbraw/zinc/21/87/87/1347218787.db2.gz	OMVMFAAQNQFGOQ-HBMCJLEFSA-N	0	3	348.490	3.364	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)/C=C\c3ccco3)C2)CC1	ZINC001047219050	1347250042	/nfs/dbraw/zinc/25/00/42/1347250042.db2.gz	IYFXMLTXPKLCMM-QWUACUGRSA-N	0	3	340.467	3.267	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)c3cc(C)c(C)o3)C2)CC1	ZINC001047234654	1347262488	/nfs/dbraw/zinc/26/24/88/1347262488.db2.gz	OMTFUVBWGJZPPG-IBGZPJMESA-N	0	3	342.483	3.484	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)C(F)=C3CCCC3)C2)CC1	ZINC001047235155	1347262950	/nfs/dbraw/zinc/26/29/50/1347262950.db2.gz	VOGKCEICIJHVLJ-GOSISDBHSA-N	0	3	332.463	3.368	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3ccoc3CC)C2)CC1	ZINC001047236579	1347264064	/nfs/dbraw/zinc/26/40/64/1347264064.db2.gz	IWVZYIHDTXHREV-KRWDZBQOSA-N	0	3	328.456	3.039	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@@H](C2CCN(C/C=C/Cl)CC2)C1	ZINC001047236945	1347264366	/nfs/dbraw/zinc/26/43/66/1347264366.db2.gz	LFXFBSUAHPKDFF-GHHPMEKESA-N	0	3	334.891	3.103	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@@]34C[C@@H]3CCCC4)C2)CC1	ZINC001047255372	1347278994	/nfs/dbraw/zinc/27/89/94/1347278994.db2.gz	XNCNOUQAHKHHSC-DYXWJJEUSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)C3(C(C)C)CC3)C2)CC1	ZINC001047255370	1347279106	/nfs/dbraw/zinc/27/91/06/1347279106.db2.gz	XMYJHKNFEMBQTE-IBGZPJMESA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@H](C)c3ccc(C)o3)C2)CC1	ZINC001047259446	1347282037	/nfs/dbraw/zinc/28/20/37/1347282037.db2.gz	QCNHLYMEXWVMPT-IEBWSBKVSA-N	0	3	342.483	3.275	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@H](C)C3CCCC3)C2)CC1	ZINC001047263085	1347284078	/nfs/dbraw/zinc/28/40/78/1347284078.db2.gz	YRPSHRUUNAUNPJ-YLJYHZDGSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@H]3CC[C@H](C)CC3)C2)CC1	ZINC001047263152	1347284423	/nfs/dbraw/zinc/28/44/23/1347284423.db2.gz	AMLQWWMEIWSQAZ-IHPCNDPISA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@@H]3CC4CCC3CC4)C2)CC1	ZINC001047265752	1347286932	/nfs/dbraw/zinc/28/69/32/1347286932.db2.gz	MGMKKCXYOHYXTK-NLDTVIPQSA-N	0	3	342.527	3.397	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)c2cccs2)C1	ZINC001047692243	1347334138	/nfs/dbraw/zinc/33/41/38/1347334138.db2.gz	KKCRISFPOAYMMI-PBHICJAKSA-N	0	3	339.464	3.260	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)CC(C)(C)C)C1	ZINC001047717632	1347347783	/nfs/dbraw/zinc/34/77/83/1347347783.db2.gz	XWNAPJRBTZDETP-YJBOKZPZSA-N	0	3	327.472	3.321	20	30		EGEDHN
C[C@H](NCc1cc(F)ccc1C#N)[C@@H]1CCN(C(=O)C=C2CCC2)C1	ZINC001047799994	1347376332	/nfs/dbraw/zinc/37/63/32/1347376332.db2.gz	OLRYTZJOSZPVTD-WMLDXEAASA-N	0	3	341.430	3.134	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]([C@@H](C)NCc2nc(C)c(C)s2)C1	ZINC001047929885	1347413920	/nfs/dbraw/zinc/41/39/20/1347413920.db2.gz	ABWBSBZPRWVOEC-UKRRQHHQSA-N	0	3	335.517	3.299	20	30		EGEDHN
CC(C)=C(F)C(=O)N1C[C@@H](C)[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001048210193	1347495804	/nfs/dbraw/zinc/49/58/04/1347495804.db2.gz	LAIROUSGISCBNF-CJNGLKHVSA-N	0	3	347.409	3.145	20	30		EGEDHN
C[C@H]1CN(C(=O)C2(F)CCCC2)C[C@@H]1CNCc1ccccc1C#N	ZINC001048295917	1347511758	/nfs/dbraw/zinc/51/17/58/1347511758.db2.gz	RPKUYAUVHXAFKW-YJBOKZPZSA-N	0	3	343.446	3.025	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H](C)[C@H](CNCc2c(F)cccc2F)C1	ZINC001048344770	1347525033	/nfs/dbraw/zinc/52/50/33/1347525033.db2.gz	RMPQBIIBOVWHPQ-UONOGXRCSA-N	0	3	336.426	3.361	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H](CNCc3csc(C)n3)[C@H](C)C2)CC1	ZINC001048375736	1347535641	/nfs/dbraw/zinc/53/56/41/1347535641.db2.gz	XBTHFEQOEGOMIY-RHSMWYFYSA-N	0	3	347.528	3.382	20	30		EGEDHN
Cc1ccc(C(=O)N2C[C@@H](C)[C@@H](CNCc3ccccc3C#N)C2)cc1	ZINC001048455156	1347555727	/nfs/dbraw/zinc/55/57/27/1347555727.db2.gz	PRFUATPMRFOPBM-UTKZUKDTSA-N	0	3	347.462	3.365	20	30		EGEDHN
CC(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2CC#Cc1ccc(Cl)cc1	ZINC001048490835	1347565459	/nfs/dbraw/zinc/56/54/59/1347565459.db2.gz	QINVQBZARKXUOX-GGPHIMKMSA-N	0	3	330.859	3.071	20	30		EGEDHN
C[C@H]1C[C@H]1C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1C#N	ZINC001048500067	1347569392	/nfs/dbraw/zinc/56/93/92/1347569392.db2.gz	WYAYLEBVNCALMF-WOCWYEKDSA-N	0	3	337.467	3.073	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3csc4cc(C)ccc34)C[C@@H]2C1	ZINC001048841538	1347669915	/nfs/dbraw/zinc/66/99/15/1347669915.db2.gz	UZDQEXZENFLGFD-IYBDPMFKSA-N	0	3	338.476	3.237	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@H](CC)C3CCC(C)CC3)C[C@@H]2C1	ZINC001048856758	1347672010	/nfs/dbraw/zinc/67/20/10/1347672010.db2.gz	VBGYHLQOEKXZPP-ZCFHBRKKSA-N	0	3	330.516	3.252	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1C[C@H]2CN(C/C=C\Cl)C[C@H]2C1	ZINC001048898288	1347679738	/nfs/dbraw/zinc/67/97/38/1347679738.db2.gz	MOVAFMFLGZKRTE-QVOOOWOGSA-N	0	3	346.858	3.008	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc(Cl)cc(Cl)c3)C[C@@H]2C1	ZINC001049187021	1347742289	/nfs/dbraw/zinc/74/22/89/1347742289.db2.gz	PWIHBLCIVCNAFD-OKILXGFUSA-N	0	3	337.250	3.021	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CN(C(=O)C4CCC=CCC4)C[C@@H]3C2)c1	ZINC001049219433	1347749234	/nfs/dbraw/zinc/74/92/34/1347749234.db2.gz	PXPIKRDDQUMYFC-OYRHEFFESA-N	0	3	349.478	3.195	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1ccc(C(F)F)cc1	ZINC001049373198	1347810060	/nfs/dbraw/zinc/81/00/60/1347810060.db2.gz	QUVIZUPRKSRVDZ-COXVUDFISA-N	0	3	347.409	3.349	20	30		EGEDHN
Cc1[nH]ccc1C(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1cccc(C#N)c1	ZINC001049405699	1347828425	/nfs/dbraw/zinc/82/84/25/1347828425.db2.gz	ISJHDXFRGJKWDY-WOJBJXKFSA-N	0	3	348.450	3.074	20	30		EGEDHN
Cc1[nH]ccc1C(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049406843	1347830300	/nfs/dbraw/zinc/83/03/00/1347830300.db2.gz	NQMQGLLPPYPZFH-WOJBJXKFSA-N	0	3	348.450	3.074	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccoc1C(F)(F)F	ZINC001049497001	1347878388	/nfs/dbraw/zinc/87/83/88/1347878388.db2.gz	FXFFLEPFIPRMIE-UONOGXRCSA-N	0	3	340.345	3.001	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(Cl)c(Cl)n1C	ZINC001049509340	1347884276	/nfs/dbraw/zinc/88/42/76/1347884276.db2.gz	TUWIPRRJLJFDAH-QWHCGFSZSA-N	0	3	342.270	3.197	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc2c(o1)CCCC2	ZINC001049514682	1347887115	/nfs/dbraw/zinc/88/71/15/1347887115.db2.gz	IPZQRBPLNVAPKP-SJORKVTESA-N	0	3	328.456	3.413	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cccc2ccc(C)nc21	ZINC001049542872	1347899749	/nfs/dbraw/zinc/89/97/49/1347899749.db2.gz	YPJYOXADSZDYIZ-RTBURBONSA-N	0	3	335.451	3.408	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1c(C)noc1C(F)F	ZINC001049544807	1347900204	/nfs/dbraw/zinc/90/02/04/1347900204.db2.gz	PFEXUYMRFLLQON-CHWSQXEVSA-N	0	3	339.386	3.176	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1cnoc1-c1ccco1	ZINC001049556884	1347907626	/nfs/dbraw/zinc/90/76/26/1347907626.db2.gz	CRLSNSGXZJWKAQ-CVEARBPZSA-N	0	3	341.411	3.190	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)CCc1ccc(C(C)C)cc1	ZINC001049594753	1347927845	/nfs/dbraw/zinc/92/78/45/1347927845.db2.gz	RWBUMOXGJGXPEJ-SFTDATJTSA-N	0	3	338.495	3.441	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)[C@@H]1C[C@]1(C)c1ccccc1	ZINC001049612624	1347935939	/nfs/dbraw/zinc/93/59/39/1347935939.db2.gz	UXFCTGCCGDPLDL-BPBCIEFSSA-N	0	3	336.479	3.053	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(-c2ccco2)on1	ZINC001049620414	1347938294	/nfs/dbraw/zinc/93/82/94/1347938294.db2.gz	KLDJCRVQVFBKRR-JKSUJKDBSA-N	0	3	341.411	3.190	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(F)c2ccncc12	ZINC001049661793	1347961542	/nfs/dbraw/zinc/96/15/42/1347961542.db2.gz	ZVDRBCRCJWBMCN-MOPGFXCFSA-N	0	3	339.414	3.239	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1ccc(F)cc1Cl	ZINC001049690054	1347973121	/nfs/dbraw/zinc/97/31/21/1347973121.db2.gz	NNKSGKFGRSZDJD-MSOLQXFVSA-N	0	3	348.849	3.110	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(F)c(Cl)c1F	ZINC001049690064	1347973204	/nfs/dbraw/zinc/97/32/04/1347973204.db2.gz	NNUGEYYBELFTHF-ZIAGYGMSSA-N	0	3	340.801	3.483	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]3[C@@H]2CCN3Cc2cnccc2C)C1	ZINC001049706745	1347983303	/nfs/dbraw/zinc/98/33/03/1347983303.db2.gz	KEZLMWJQNPEHJC-MOPGFXCFSA-N	0	3	339.483	3.312	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1c(F)ccc(F)c1Cl	ZINC001049743475	1347996912	/nfs/dbraw/zinc/99/69/12/1347996912.db2.gz	QFPZBBYEKJDDFA-UONOGXRCSA-N	0	3	340.801	3.483	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H]1CCCN2C(=O)CCc1cc(Cl)cs1	ZINC001049756421	1348003544	/nfs/dbraw/zinc/00/35/44/1348003544.db2.gz	VFSHBZIORJHTGY-CVEARBPZSA-N	0	3	336.888	3.033	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cn(CC)nc1C(C)C	ZINC001049757985	1348004581	/nfs/dbraw/zinc/00/45/81/1348004581.db2.gz	FHUIPRGROHZQSU-ZWKOTPCHSA-N	0	3	344.503	3.281	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(OCC)c(C)c1	ZINC001049761423	1348006247	/nfs/dbraw/zinc/00/62/47/1348006247.db2.gz	JEYIDGRLRDRZJG-MSOLQXFVSA-N	0	3	328.456	3.259	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(F)cc2cccnc21	ZINC001049766567	1348009925	/nfs/dbraw/zinc/00/99/25/1348009925.db2.gz	DFCPKZMSEMLQJN-MSOLQXFVSA-N	0	3	339.414	3.239	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)C(C)(C)c1ccccc1F	ZINC001049788817	1348022518	/nfs/dbraw/zinc/02/25/18/1348022518.db2.gz	RIDVDPGINXUBDU-MSOLQXFVSA-N	0	3	330.447	3.355	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)C1(c2ccccc2F)CC1	ZINC001049821502	1348038569	/nfs/dbraw/zinc/03/85/69/1348038569.db2.gz	ZVSDPCVPQSZFHR-MSOLQXFVSA-N	0	3	328.431	3.109	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C1(c2ccccc2F)CC1	ZINC001049821503	1348038853	/nfs/dbraw/zinc/03/88/53/1348038853.db2.gz	ZVSDPCVPQSZFHR-QZTJIDSGSA-N	0	3	328.431	3.109	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(CC)c(CC)o1	ZINC001049850670	1348058465	/nfs/dbraw/zinc/05/84/65/1348058465.db2.gz	UCJAVVLLBYUZFL-IRXDYDNUSA-N	0	3	328.456	3.107	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccccc1OC(C)C	ZINC001049854942	1348061869	/nfs/dbraw/zinc/06/18/69/1348061869.db2.gz	OUCVSPYDYGRIOC-ROUUACIJSA-N	0	3	328.456	3.339	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc2c(s1)CCOC2	ZINC001049856516	1348064045	/nfs/dbraw/zinc/06/40/45/1348064045.db2.gz	ZLDXXUNOADXOFM-JKSUJKDBSA-N	0	3	346.496	3.076	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(C)nc2ccccc21	ZINC001049869494	1348075162	/nfs/dbraw/zinc/07/51/62/1348075162.db2.gz	CENQPSDHRUETME-NHCUHLMSSA-N	0	3	347.462	3.245	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(C2CC2)cn1	ZINC001049872736	1348077723	/nfs/dbraw/zinc/07/77/23/1348077723.db2.gz	XYRZXEUXKZLSIX-RBUKOAKNSA-N	0	3	325.456	3.214	20	30		EGEDHN
C=CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1scnc1Cl	ZINC001049899236	1348100167	/nfs/dbraw/zinc/10/01/67/1348100167.db2.gz	CUYHGBOCGVOALW-NWDGAFQWSA-N	0	3	325.865	3.052	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccccc1OCC1CC1	ZINC001049913460	1348108222	/nfs/dbraw/zinc/10/82/22/1348108222.db2.gz	YHEQXINTMPIJPW-MOPGFXCFSA-N	0	3	340.467	3.340	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3nc(C(C)C)oc3C)[C@@H]2C1	ZINC001050046778	1348164682	/nfs/dbraw/zinc/16/46/82/1348164682.db2.gz	ISTISCPHLRBHOG-JKSUJKDBSA-N	0	3	331.460	3.219	20	30		EGEDHN
C#CCCN1C[C@@H]2CCCN(C(=O)c3nc(C(C)(C)C)cs3)[C@@H]2C1	ZINC001050068172	1348171569	/nfs/dbraw/zinc/17/15/69/1348171569.db2.gz	BSTNRADERXVGRZ-LSDHHAIUSA-N	0	3	345.512	3.000	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)[C@@H](C)OC3CCCCCC3)[C@@H]2C1	ZINC001050137401	1348193147	/nfs/dbraw/zinc/19/31/47/1348193147.db2.gz	WAPGUOFTIRWWJG-ZIFCJYIRSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cccn3C3CCCC3)[C@@H]2C1	ZINC001050173844	1348202492	/nfs/dbraw/zinc/20/24/92/1348202492.db2.gz	VSPVXYOFDDPYKR-QFBILLFUSA-N	0	3	327.472	3.326	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3ccc(C(F)(F)F)cc3)[C@@H]2C1	ZINC001050190669	1348206473	/nfs/dbraw/zinc/20/64/73/1348206473.db2.gz	NTUFGMQLAYIOOF-GOEBONIOSA-N	0	3	338.373	3.428	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cccc(OCCC)c3)C2)CC1	ZINC001050534962	1348285417	/nfs/dbraw/zinc/28/54/17/1348285417.db2.gz	FIPIFHXPPROFOR-UHFFFAOYSA-N	0	3	340.467	3.037	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc(-n4cccc4)cc3)C2)CC1	ZINC001050583873	1348293626	/nfs/dbraw/zinc/29/36/26/1348293626.db2.gz	RKVBHJTVQCTJBI-UHFFFAOYSA-N	0	3	347.462	3.039	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3cc4ccc(F)cc4s3)C2)CC1	ZINC001050584319	1348293813	/nfs/dbraw/zinc/29/38/13/1348293813.db2.gz	MLIYFTUXADXNMU-UHFFFAOYSA-N	0	3	342.439	3.212	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H]3CCCC[C@@H]3C3CC3)C2)CC1	ZINC001050603954	1348298936	/nfs/dbraw/zinc/29/89/36/1348298936.db2.gz	JAMUMMNAOKJEIE-MOPGFXCFSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc4c(c3)CCCC4)C2)CC1	ZINC001050746056	1348347065	/nfs/dbraw/zinc/34/70/65/1348347065.db2.gz	DTOOBPCHHCDOGI-UHFFFAOYSA-N	0	3	336.479	3.127	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C(C)(C)c3ccccc3C)C2)CC1	ZINC001050774448	1348355258	/nfs/dbraw/zinc/35/52/58/1348355258.db2.gz	IGADPHGXOVMALH-UHFFFAOYSA-N	0	3	338.495	3.220	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3csnc3C)cccc2C1	ZINC001051285395	1348418365	/nfs/dbraw/zinc/41/83/65/1348418365.db2.gz	KDCMFCOOVLODHO-UHFFFAOYSA-N	0	3	341.480	3.316	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)[C@@H]3CC[C@@H]4C[C@@H]4C3)cccc2C1	ZINC001051293568	1348422596	/nfs/dbraw/zinc/42/25/96/1348422596.db2.gz	WUVMIMJOMDMZTM-MBOZVWFJSA-N	0	3	336.479	3.120	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N[C@H]1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC001052314420	1348519471	/nfs/dbraw/zinc/51/94/71/1348519471.db2.gz	JVYBWQPAUJAQTN-ZWKOTPCHSA-N	0	3	325.456	3.075	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2oc3ccc(F)cc3c2C)CC1	ZINC001052446664	1348543180	/nfs/dbraw/zinc/54/31/80/1348543180.db2.gz	NESFVZAKWXVQCD-OAHLLOKOSA-N	0	3	328.387	3.098	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@@H]2CC=CC[C@H]2C(F)(F)F)CC1	ZINC001052493190	1348557188	/nfs/dbraw/zinc/55/71/88/1348557188.db2.gz	PSLJBJDKTJSVLJ-ARFHVFGLSA-N	0	3	342.405	3.125	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cn(CC)c3ccccc23)CC1	ZINC001052544044	1348573496	/nfs/dbraw/zinc/57/34/96/1348573496.db2.gz	KSIDXVUTZMZEKW-QGZVFWFLSA-N	0	3	337.467	3.269	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cn(CC)c3ccccc23)CC1	ZINC001052544043	1348573570	/nfs/dbraw/zinc/57/35/70/1348573570.db2.gz	KSIDXVUTZMZEKW-KRWDZBQOSA-N	0	3	337.467	3.269	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2cc3cc(Cl)ccc3[nH]2)CC1	ZINC001052614395	1348597387	/nfs/dbraw/zinc/59/73/87/1348597387.db2.gz	QCAMCIONCJYMAW-OAHLLOKOSA-N	0	3	329.831	3.039	20	30		EGEDHN
CC1(C)CC[C@H]1C(=O)N[C@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC001052636716	1348605035	/nfs/dbraw/zinc/60/50/35/1348605035.db2.gz	WYGWCVJTZWCCQE-OALUTQOASA-N	0	3	339.483	3.465	20	30		EGEDHN
CC(C)(C(=O)N[C@H]1CCCN(Cc2cccc(C#N)c2)CC1)C1CC1	ZINC001052637323	1348606662	/nfs/dbraw/zinc/60/66/62/1348606662.db2.gz	IUNZOCJTOLRRAM-IBGZPJMESA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@@H](C)c2ccc(Cl)cc2)CC1	ZINC001052676490	1348625458	/nfs/dbraw/zinc/62/54/58/1348625458.db2.gz	HESCQXVWULABFW-YJBOKZPZSA-N	0	3	332.875	3.438	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccccc2O[C@@H](C)CC)CC1	ZINC001052755592	1348665194	/nfs/dbraw/zinc/66/51/94/1348665194.db2.gz	WOKZRBRQVPQCHD-ROUUACIJSA-N	0	3	342.483	3.472	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC001052888029	1348725147	/nfs/dbraw/zinc/72/51/47/1348725147.db2.gz	GQENYFHTCDBNRV-INIZCTEOSA-N	0	3	338.373	3.313	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)Cc2c(F)cccc2Cl)CC1	ZINC001052891424	1348728528	/nfs/dbraw/zinc/72/85/28/1348728528.db2.gz	SIBGUPUJZQFWKG-CQSZACIVSA-N	0	3	336.838	3.016	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2cc3c(s2)CC[C@@H](C)C3)CC1	ZINC001052923801	1348750830	/nfs/dbraw/zinc/75/08/30/1348750830.db2.gz	MPWMAAVTHDVHFU-GDBMZVCRSA-N	0	3	330.497	3.090	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc3[nH]c(C)c(C)c3c2)CC1	ZINC001052925528	1348751604	/nfs/dbraw/zinc/75/16/04/1348751604.db2.gz	RNTWGIHCOCHYSO-GOSISDBHSA-N	0	3	337.467	3.392	20	30		EGEDHN
CCC(=O)N1CCC[C@@H]([C@@H]2CCCN(CC#Cc3ccccc3)C2)C1	ZINC001052996518	1348792998	/nfs/dbraw/zinc/79/29/98/1348792998.db2.gz	JQCCIGJXYWWYJV-NHCUHLMSSA-N	0	3	338.495	3.399	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)Cc2cccs2)C1	ZINC001053060122	1348868827	/nfs/dbraw/zinc/86/88/27/1348868827.db2.gz	CZCYNORIDHSICE-PKOBYXMFSA-N	0	3	344.524	3.407	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)CCc2ccoc2)C1	ZINC001053074644	1348892023	/nfs/dbraw/zinc/89/20/23/1348892023.db2.gz	DMYGUPCMCOURIR-VQTJNVASSA-N	0	3	342.483	3.329	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)C2CC(F)(F)C2)C1	ZINC001053075695	1348893427	/nfs/dbraw/zinc/89/34/27/1348893427.db2.gz	IZZUNTYOPUBYGV-NVXWUHKLSA-N	0	3	338.442	3.148	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cccc(C)c2F)C1	ZINC001053086798	1348909803	/nfs/dbraw/zinc/90/98/03/1348909803.db2.gz	OVBMCQZRWZHKTH-PKOBYXMFSA-N	0	3	342.458	3.474	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)Cc2ccccc2)C1	ZINC001053088493	1348913164	/nfs/dbraw/zinc/91/31/64/1348913164.db2.gz	WJHFHDRDLQYOQT-NHCUHLMSSA-N	0	3	338.495	3.346	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccc(C#C)cc2)C1	ZINC001053093908	1348922229	/nfs/dbraw/zinc/92/22/29/1348922229.db2.gz	RXOJNOULUFGJOB-LEWJYISDSA-N	0	3	334.463	3.008	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)Cc2occc2C)C1	ZINC001053093821	1348922980	/nfs/dbraw/zinc/92/29/80/1348922980.db2.gz	AECYGXWQXWTJMF-MOPGFXCFSA-N	0	3	342.483	3.247	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2occc2CC)C1	ZINC001053099790	1348932039	/nfs/dbraw/zinc/93/20/39/1348932039.db2.gz	YZUQZNFQTPLFCK-MSOLQXFVSA-N	0	3	328.456	3.182	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2occc2CC)C1	ZINC001053099792	1348932370	/nfs/dbraw/zinc/93/23/70/1348932370.db2.gz	YZUQZNFQTPLFCK-ROUUACIJSA-N	0	3	328.456	3.182	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2csc(C)c2)C1	ZINC001053100303	1348933535	/nfs/dbraw/zinc/93/35/35/1348933535.db2.gz	GLSWQYGPVKOICW-FUHWJXTLSA-N	0	3	330.497	3.396	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(OC)o2)C1	ZINC001053102944	1348936604	/nfs/dbraw/zinc/93/66/04/1348936604.db2.gz	XWEVXXZAEDUDEJ-IAGOWNOFSA-N	0	3	344.455	3.018	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)Cc2ccc(C)s2)C1	ZINC001053103861	1348938309	/nfs/dbraw/zinc/93/83/09/1348938309.db2.gz	AMTGAIYRDIEAMK-MJGOQNOKSA-N	0	3	344.524	3.325	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccnc(C)c2)C1	ZINC001053105288	1348942071	/nfs/dbraw/zinc/94/20/71/1348942071.db2.gz	SWGJILZCQZCPKP-UXHICEINSA-N	0	3	339.483	3.120	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)C2CCC=CCC2)C1	ZINC001053106225	1348944204	/nfs/dbraw/zinc/94/42/04/1348944204.db2.gz	SRMBERJCLHGSPB-UXHICEINSA-N	0	3	328.500	3.459	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)C2CCC=CCC2)C1	ZINC001053106227	1348944653	/nfs/dbraw/zinc/94/46/53/1348944653.db2.gz	SRMBERJCLHGSPB-VQTJNVASSA-N	0	3	328.500	3.459	20	30		EGEDHN
C=C(C)CCN1Cc2ccccc2C[C@H]1CNC(=O)c1ccc(C#N)[nH]1	ZINC001054038717	1349134513	/nfs/dbraw/zinc/13/45/13/1349134513.db2.gz	KDULXPRZPLXFBV-IBGZPJMESA-N	0	3	348.450	3.009	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2Cc3ccccc3CN2CC2CC2)cc1	ZINC001054048547	1349138439	/nfs/dbraw/zinc/13/84/39/1349138439.db2.gz	DULJWOSABKVXKI-JOCHJYFZSA-N	0	3	344.458	3.235	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2Cc3ccccc3CN2CCC=C)cc1	ZINC001054049792	1349139238	/nfs/dbraw/zinc/13/92/38/1349139238.db2.gz	JBVXZAXABYALKF-QFIPXVFZSA-N	0	3	344.458	3.401	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1c(C)[nH]c3ccccc31)C2	ZINC001054161500	1349163587	/nfs/dbraw/zinc/16/35/87/1349163587.db2.gz	HHLCBTVVIFCAML-QFIPXVFZSA-N	0	3	349.478	3.428	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1nc3ccccc3cc1C)C2	ZINC001054166783	1349169829	/nfs/dbraw/zinc/16/98/29/1349169829.db2.gz	JJOAYBYYSYSIPY-QFIPXVFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC[C@]3(CCN(C[C@H](F)CC)C3)C2)cc1	ZINC001054174371	1349174947	/nfs/dbraw/zinc/17/49/47/1349174947.db2.gz	NRUYTEUJSDQQCB-TZIWHRDSSA-N	0	3	342.458	3.344	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@]2(CCN(Cc3ocnc3C)C2)C1	ZINC001054175822	1349177552	/nfs/dbraw/zinc/17/75/52/1349177552.db2.gz	WPANIIOGQAKQQV-IBGZPJMESA-N	0	3	331.460	3.010	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc3ccccc3n1C)C2	ZINC001054185648	1349188262	/nfs/dbraw/zinc/18/82/62/1349188262.db2.gz	HAMYUMXUNZQBFX-QFIPXVFZSA-N	0	3	349.478	3.130	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc3[nH]ccc3c1)C2	ZINC001054185960	1349188300	/nfs/dbraw/zinc/18/83/00/1349188300.db2.gz	AUXMDPAFCQZLBK-NRFANRHFSA-N	0	3	335.451	3.119	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@]3(CCN(Cc4ccccn4)C3)C2)C1	ZINC001054194903	1349197506	/nfs/dbraw/zinc/19/75/06/1349197506.db2.gz	ZOJFXDYDAMGJGY-NRFANRHFSA-N	0	3	339.483	3.252	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@H](C)c1cccs1)C2	ZINC001054196563	1349198524	/nfs/dbraw/zinc/19/85/24/1349198524.db2.gz	JKOOKKHOETXHQK-APWZRJJASA-N	0	3	330.497	3.189	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@H](C)c1ccc(C)s1)C2	ZINC001054227112	1349220533	/nfs/dbraw/zinc/22/05/33/1349220533.db2.gz	IEWCGQLMVGDMIT-XLIONFOSSA-N	0	3	344.524	3.498	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)CCc1c[nH]c3ccccc13)C2	ZINC001054237385	1349231293	/nfs/dbraw/zinc/23/12/93/1349231293.db2.gz	VOZKHAGAIJJVDW-JOCHJYFZSA-N	0	3	349.478	3.048	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)C13CCC(CC1)CC3)C2	ZINC001054243706	1349237507	/nfs/dbraw/zinc/23/75/07/1349237507.db2.gz	MLRMONKCNVRGNN-VEDCXYSMSA-N	0	3	328.500	3.295	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1c[nH]c3ccc(C)cc13)C2	ZINC001054246124	1349240620	/nfs/dbraw/zinc/24/06/20/1349240620.db2.gz	OGPIEAIULRXBAA-QFIPXVFZSA-N	0	3	349.478	3.428	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@H](C)Cc1ccc(C)cc1)C2	ZINC001054246369	1349240795	/nfs/dbraw/zinc/24/07/95/1349240795.db2.gz	XMKLNCFIMKCFSX-DENIHFKCSA-N	0	3	338.495	3.121	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H](C)Cc1ccc(C)cc1)C2	ZINC001054246372	1349241378	/nfs/dbraw/zinc/24/13/78/1349241378.db2.gz	XMKLNCFIMKCFSX-UGKGYDQZSA-N	0	3	338.495	3.121	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)C1(C)C(C)(C)C1(C)C)C2	ZINC001054248698	1349244112	/nfs/dbraw/zinc/24/41/12/1349244112.db2.gz	AZPRCYDLACSICP-OAQYLSRUSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(CC)c(CC)c1)C2	ZINC001054250449	1349245885	/nfs/dbraw/zinc/24/58/85/1349245885.db2.gz	UIAOKZQADYXNMR-JOCHJYFZSA-N	0	3	338.495	3.373	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@H]3CCCO[C@@H]3C)cc2C1	ZINC001054262204	1349260198	/nfs/dbraw/zinc/26/01/98/1349260198.db2.gz	OOABTKBHMGFIJS-UZLBHIALSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@@H]3CCCO[C@H]3CC)cc2C1	ZINC001054267666	1349265624	/nfs/dbraw/zinc/26/56/24/1349265624.db2.gz	BHPHSCYDFYVJLT-UXHICEINSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3ncccc3CC)cc2C1	ZINC001054270770	1349270404	/nfs/dbraw/zinc/27/04/04/1349270404.db2.gz	AAUUIZKCNNFBGO-UHFFFAOYSA-N	0	3	335.451	3.466	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3ccn4ccnc4c3)cc2C1	ZINC001054273821	1349273703	/nfs/dbraw/zinc/27/37/03/1349273703.db2.gz	BWDHHMFLIHSOPZ-UHFFFAOYSA-N	0	3	346.434	3.156	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3ccc4c(c3)CCO4)cc2C1	ZINC001054282945	1349284283	/nfs/dbraw/zinc/28/42/83/1349284283.db2.gz	FOLPDBZXKQORSX-UHFFFAOYSA-N	0	3	348.446	3.443	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cnc(C4CC4)nc3)cc2C1	ZINC001054284766	1349287597	/nfs/dbraw/zinc/28/75/97/1349287597.db2.gz	HEZQDDXNXCUVHR-UHFFFAOYSA-N	0	3	348.450	3.176	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@H]3CCO[C@@H]3C)cc2C1	ZINC001054286504	1349289127	/nfs/dbraw/zinc/28/91/27/1349289127.db2.gz	INNAMLUZRVWQRW-BEFAXECRSA-N	0	3	328.456	3.010	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@@H]3CCO[C@H](C)C3)cc2C1	ZINC001054286717	1349289207	/nfs/dbraw/zinc/28/92/07/1349289207.db2.gz	OHYHQOIDQAPENV-NVXWUHKLSA-N	0	3	328.456	3.010	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cnn(CC)c3C)cc2C1	ZINC001054287465	1349290124	/nfs/dbraw/zinc/29/01/24/1349290124.db2.gz	MVFACLDWEVAITM-UHFFFAOYSA-N	0	3	338.455	3.033	20	30		EGEDHN
C#Cc1ccc(C(=O)NCc2ccc3c(c2)CN(CCC2CC2)C3)nc1	ZINC001054290137	1349293811	/nfs/dbraw/zinc/29/38/11/1349293811.db2.gz	ALNTZZKJTLKELA-UHFFFAOYSA-N	0	3	345.446	3.109	20	30		EGEDHN
C#Cc1ccc(C(=O)NCc2ccc3c(c2)CN(CCC(C)C)C3)cn1	ZINC001054290502	1349294960	/nfs/dbraw/zinc/29/49/60/1349294960.db2.gz	RCGYOBVPPRYCOQ-UHFFFAOYSA-N	0	3	347.462	3.355	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@H]3CC34CCOCC4)cc2C1	ZINC001054293533	1349300326	/nfs/dbraw/zinc/30/03/26/1349300326.db2.gz	RRLFITFLLLOSDC-LJQANCHMSA-N	0	3	340.467	3.011	20	30		EGEDHN
Cc1ccccc1C(=O)N1C[C@H](NCc2ccc(C#N)s2)[C@@H](C)C1	ZINC001054348912	1349328510	/nfs/dbraw/zinc/32/85/10/1349328510.db2.gz	PHTSLGAKLTXZSS-KSSFIOAISA-N	0	3	339.464	3.179	20	30		EGEDHN
Cc1ccccc1C(=O)N1C[C@@H](C)[C@@H](NCc2ccc(C#N)s2)C1	ZINC001054348911	1349328899	/nfs/dbraw/zinc/32/88/99/1349328899.db2.gz	PHTSLGAKLTXZSS-KDOFPFPSSA-N	0	3	339.464	3.179	20	30		EGEDHN
Cc1cccc(C(=O)N2C[C@@H](C)[C@@H](NCc3ccc(C#N)s3)C2)c1	ZINC001054354401	1349332087	/nfs/dbraw/zinc/33/20/87/1349332087.db2.gz	AFGDDCMNPWNGSA-KDOFPFPSSA-N	0	3	339.464	3.179	20	30		EGEDHN
Cc1csc(C(=O)N2C[C@@H](C)[C@@H](NCc3ccc(C#N)s3)C2)c1	ZINC001054633180	1349423182	/nfs/dbraw/zinc/42/31/82/1349423182.db2.gz	JGSDPAGBXFVPGA-DOMZBBRYSA-N	0	3	345.493	3.240	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@H](C)[C@H](NCc2ncccc2C)C1	ZINC001054680055	1349435387	/nfs/dbraw/zinc/43/53/87/1349435387.db2.gz	LXRCBNAEXOIFLE-XJKSGUPXSA-N	0	3	335.879	3.105	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@@H](C)[C@H](NCc2ncccc2C)C1	ZINC001054680054	1349435480	/nfs/dbraw/zinc/43/54/80/1349435480.db2.gz	LXRCBNAEXOIFLE-CZUORRHYSA-N	0	3	335.879	3.105	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CN(Cc3ccc4c(c3)CCC4)C[C@H]2C)C1	ZINC001080404418	1357608058	/nfs/dbraw/zinc/60/80/58/1357608058.db2.gz	HGHDYLUQQDQSLO-OXQOHEQNSA-N	0	3	338.495	3.468	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@]2(C)CCCc3ccccc32)C1	ZINC001080621999	1357703219	/nfs/dbraw/zinc/70/32/19/1357703219.db2.gz	AJWFQHQDEQUULD-OZOXKJRCSA-N	0	3	326.484	3.293	20	30		EGEDHN
C#CCCN1C[C@@H](C)[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc3ccccc3c2)C1	ZINC001080639772	1357713868	/nfs/dbraw/zinc/71/38/68/1357713868.db2.gz	YHUJFXNXADGGKV-IDZYALCFSA-N	0	3	346.474	3.403	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)[C@H]2CC[C@H](CC)CC2)C1	ZINC001070433708	1354347423	/nfs/dbraw/zinc/34/74/23/1354347423.db2.gz	BLCWJBBEOZENJJ-ULQDDVLXSA-N	0	3	344.503	3.218	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)c2ccoc2C(C)C)C1	ZINC001070435508	1354348765	/nfs/dbraw/zinc/34/87/65/1354348765.db2.gz	IQFWQBNDGSROBP-CQSZACIVSA-N	0	3	342.443	3.031	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1c(C)oc(C)c1C)C[C@H](C)O2	ZINC001071190434	1354495048	/nfs/dbraw/zinc/49/50/48/1354495048.db2.gz	ZGOVANKMICLVDB-XOBRGWDASA-N	0	3	346.471	3.086	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1ccoc1C1CC1)C[C@@H](C)O2	ZINC001071204014	1354504226	/nfs/dbraw/zinc/50/42/26/1354504226.db2.gz	LQMJAJATBXBYLU-FOIQADDNSA-N	0	3	344.455	3.039	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1ccoc1CCC)C[C@H](C)O2	ZINC001071228442	1354514273	/nfs/dbraw/zinc/51/42/73/1354514273.db2.gz	UUZNPBGEZNAJGQ-JXFKEZNVSA-N	0	3	346.471	3.114	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1ccc(C)c(C)c1)C[C@H](C)O2	ZINC001071236451	1354521068	/nfs/dbraw/zinc/52/10/68/1354521068.db2.gz	VEQJCZWNJVGGSS-RXVVDRJESA-N	0	3	342.483	3.185	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1cc(C)cc(C)c1)C[C@H](C)O2	ZINC001071236639	1354521128	/nfs/dbraw/zinc/52/11/28/1354521128.db2.gz	XISGKCNAYHXFQZ-RXVVDRJESA-N	0	3	342.483	3.185	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1c(C)cccc1F)C[C@H](C)O2	ZINC001071245866	1354525846	/nfs/dbraw/zinc/52/58/46/1354525846.db2.gz	KYQCLAQTEBCTHQ-JXFKEZNVSA-N	0	3	346.446	3.016	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)Cc2coc3cc(F)ccc23)CC[C@@H]1C	ZINC001071498013	1354728296	/nfs/dbraw/zinc/72/82/96/1354728296.db2.gz	PVHYYQTXZSJUJX-WMLDXEAASA-N	0	3	342.414	3.107	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2c(F)c(F)cc(F)c2F)CC[C@H]1C	ZINC001071526852	1354746908	/nfs/dbraw/zinc/74/69/08/1354746908.db2.gz	VGPHPBXGHVAWEQ-MNOVXSKESA-N	0	3	344.352	3.402	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)Cc2coc3ccc(C)cc23)CC[C@H]1C	ZINC001071543934	1354756755	/nfs/dbraw/zinc/75/67/55/1354756755.db2.gz	PWGZJDRYVCTSSO-WBVHZDCISA-N	0	3	326.440	3.439	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C2(c3ccc(F)cc3)CC2)CC[C@@H]1C	ZINC001071543986	1354756987	/nfs/dbraw/zinc/75/69/87/1354756987.db2.gz	QXVGTMXGUBCCDO-YJBOKZPZSA-N	0	3	330.447	3.403	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc(Cl)c(Cl)n2C)CC[C@H]1C	ZINC001071548518	1354760947	/nfs/dbraw/zinc/76/09/47/1354760947.db2.gz	HHHDKTKFWDLUEP-VXGBXAGGSA-N	0	3	344.286	3.491	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2C3CC4CC(C3)CC2C4)CC[C@@H]1C	ZINC001071572028	1354771179	/nfs/dbraw/zinc/77/11/79/1354771179.db2.gz	PBKWUBULSLFNGF-PPHBOOHOSA-N	0	3	328.500	3.051	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc(C3CCCCC3)n[nH]2)CC[C@H]1C	ZINC001071576442	1354773991	/nfs/dbraw/zinc/77/39/91/1354773991.db2.gz	GOCZRRNZCUOPDK-WBVHZDCISA-N	0	3	342.487	3.063	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cnn3c2ccc(C)c3C)CC[C@H]1C	ZINC001071580280	1354777197	/nfs/dbraw/zinc/77/71/97/1354777197.db2.gz	RADKXAMPMDJQQC-NVXWUHKLSA-N	0	3	340.471	3.110	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc(C3CC3)[nH]c2C2CC2)CC[C@@H]1C	ZINC001071607845	1354792937	/nfs/dbraw/zinc/79/29/37/1354792937.db2.gz	SXHUEKOFIAWBBT-WMLDXEAASA-N	0	3	339.483	3.376	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2CCc3ccccc3CC2)CC[C@@H]1C	ZINC001071621688	1354804458	/nfs/dbraw/zinc/80/44/58/1354804458.db2.gz	BPYPETJVLOMNAH-LAUBAEHRSA-N	0	3	338.495	3.174	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(OC)c(C(C)C)c2)CC[C@@H]1C	ZINC001071653376	1354828177	/nfs/dbraw/zinc/82/81/77/1354828177.db2.gz	XKHQGWPWDKUWKZ-FUHWJXTLSA-N	0	3	342.483	3.425	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2cccc3ncccc23)CC[C@@H]1C	ZINC001071677152	1354845293	/nfs/dbraw/zinc/84/52/93/1354845293.db2.gz	RLYFMLGYUCUWTM-FUHWJXTLSA-N	0	3	337.467	3.323	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C2(c3cccnc3)CCCC2)CC[C@@H]1C	ZINC001071773163	1354920538	/nfs/dbraw/zinc/92/05/38/1354920538.db2.gz	XGRXHKVMPPNLSN-HKUYNNGSSA-N	0	3	341.499	3.439	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@@H]2CCCc3ccccc32)CC(C)(C)C1	ZINC001089419372	1360413228	/nfs/dbraw/zinc/41/32/28/1360413228.db2.gz	FEFGLVABMXEIBT-AZUAARDMSA-N	0	3	338.495	3.347	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(F)c(COC)c2)CC[C@@H]1C	ZINC001071820053	1354961592	/nfs/dbraw/zinc/96/15/92/1354961592.db2.gz	ZJNHJRSKDARXLT-WMLDXEAASA-N	0	3	334.435	3.131	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccccc2OCC(C)C)CC[C@H]1C	ZINC001071904176	1355016628	/nfs/dbraw/zinc/01/66/28/1355016628.db2.gz	DNDWNYKWTDRJNV-QZTJIDSGSA-N	0	3	342.483	3.327	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cccc3c2OCCCO3)CC[C@H]1C	ZINC001071934681	1355032898	/nfs/dbraw/zinc/03/28/98/1355032898.db2.gz	QQHACSYMKUCZAC-HZPDHXFCSA-N	0	3	344.455	3.007	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2[nH]c3ccc(C)cc3c2C)CC[C@H]1C	ZINC001071954954	1355041572	/nfs/dbraw/zinc/04/15/72/1355041572.db2.gz	ZFYPGUZOXNIVJG-WBVHZDCISA-N	0	3	337.467	3.391	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@@H](NCc3ccc(F)c(Cl)c3)C2)CCC1	ZINC001183185823	1387273618	/nfs/dbraw/zinc/27/36/18/1387273618.db2.gz	VZBUUURDEWGAKT-OAHLLOKOSA-N	0	3	348.849	3.363	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2(c3ccccc3F)CCC2)CC[C@H]1C	ZINC001071990302	1355062040	/nfs/dbraw/zinc/06/20/40/1355062040.db2.gz	XTHDRVWNXJTZBY-SJORKVTESA-N	0	3	342.458	3.240	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2cc3nc(C)ccc3o2)CC[C@H]1C	ZINC001072012773	1355076796	/nfs/dbraw/zinc/07/67/96/1355076796.db2.gz	SCPIMUCFZWJDRO-HUUCEWRRSA-N	0	3	327.428	3.295	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccccc2C(F)(F)F)CC[C@H]1C	ZINC001072016038	1355078861	/nfs/dbraw/zinc/07/88/61/1355078861.db2.gz	LKMQAILUTVZFHX-ZIAGYGMSSA-N	0	3	338.373	3.311	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(OCC(C)C)cc2)CC[C@H]1C	ZINC001072049032	1355103866	/nfs/dbraw/zinc/10/38/66/1355103866.db2.gz	NNKYKULGABFQEY-IEBWSBKVSA-N	0	3	342.483	3.327	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc(C)n(C(C)C)c2C)CC[C@@H]1C	ZINC001072063222	1355109441	/nfs/dbraw/zinc/10/94/41/1355109441.db2.gz	SNXLNKNVCDJTRX-YJBOKZPZSA-N	0	3	329.488	3.292	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cn2ccc3ccccc32)CC[C@@H]1C	ZINC001072088740	1355122322	/nfs/dbraw/zinc/12/23/22/1355122322.db2.gz	PDFJVMXZJNEWGM-FUHWJXTLSA-N	0	3	325.456	3.187	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cccc3oc(C)nc32)CC[C@@H]1C	ZINC001072101046	1355130814	/nfs/dbraw/zinc/13/08/14/1355130814.db2.gz	CJNAUVSLOULSRT-ZFWWWQNUSA-N	0	3	327.428	3.295	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(C(C)(F)F)cc2)CC[C@@H]1C	ZINC001072124215	1355142059	/nfs/dbraw/zinc/14/20/59/1355142059.db2.gz	YOUMUTYGRUWCLH-YOEHRIQHSA-N	0	3	334.410	3.404	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)C2CCC2)CC1	ZINC001072129317	1355145194	/nfs/dbraw/zinc/14/51/94/1355145194.db2.gz	JVSYXIQETZSVOB-HXUWFJFHSA-N	0	3	339.483	3.088	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](C)[C@H](CNCc2cc(C3CC3)no2)C1	ZINC001072337566	1355245744	/nfs/dbraw/zinc/24/57/44/1355245744.db2.gz	YRWALHSTKOLZKT-GOEBONIOSA-N	0	3	345.487	3.338	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](C)[C@H](CNCc3cnc(C)o3)C2)CC1	ZINC001072356157	1355254781	/nfs/dbraw/zinc/25/47/81/1355254781.db2.gz	HIGKXZVBWGXRNO-CRAIPNDOSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](C)[C@H](CNCc3cscn3)C2)C1	ZINC001072364171	1355258517	/nfs/dbraw/zinc/25/85/17/1355258517.db2.gz	POLOKWOPIWNNQL-HUUCEWRRSA-N	0	3	333.501	3.074	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](NC(=O)C2CC3(CCC3)C2)C2CC2)s1	ZINC001323048671	1387275671	/nfs/dbraw/zinc/27/56/71/1387275671.db2.gz	TVQXWRQFEOOTCW-KRWDZBQOSA-N	0	3	343.496	3.184	20	30		EGEDHN
C[C@H](C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2)C(C)(C)C	ZINC001072854420	1355467011	/nfs/dbraw/zinc/46/70/11/1355467011.db2.gz	NJLKVFLFZRUOBJ-MRXNPFEDSA-N	0	3	339.483	3.275	20	30		EGEDHN
C[C@@H](C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2)C(C)(C)C	ZINC001072855716	1355467350	/nfs/dbraw/zinc/46/73/50/1355467350.db2.gz	FATLJIXFRTWJCL-INIZCTEOSA-N	0	3	339.483	3.275	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CN(C(=O)[C@]45C[C@H]4CCCC5)C3)C2)cc1	ZINC001072967267	1355528253	/nfs/dbraw/zinc/52/82/53/1355528253.db2.gz	YLAOMUPMINRMCA-DENIHFKCSA-N	0	3	349.478	3.173	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3oc4ccccc4c3Cl)C2)C1	ZINC001073121296	1355608556	/nfs/dbraw/zinc/60/85/56/1355608556.db2.gz	RSILAKMIHJEJAB-UHFFFAOYSA-N	0	3	330.815	3.420	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3csc4c3CC[C@@H](C)C4)C2)C1	ZINC001073403823	1355758066	/nfs/dbraw/zinc/75/80/66/1355758066.db2.gz	BFERLDGDVNEYTB-CQSZACIVSA-N	0	3	330.497	3.207	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2cscc2C(F)F)C1	ZINC001073603586	1355842952	/nfs/dbraw/zinc/84/29/52/1355842952.db2.gz	KLEWIWRAXMMIJG-LBPRGKRZSA-N	0	3	344.427	3.083	20	30		EGEDHN
CC(C)=CC(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(C#N)cc1	ZINC001073937117	1355975480	/nfs/dbraw/zinc/97/54/80/1355975480.db2.gz	HOOCMZPOHDJJCA-LJQANCHMSA-N	0	3	325.456	3.337	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(Cl)cc1	ZINC001073972899	1356004842	/nfs/dbraw/zinc/00/48/42/1356004842.db2.gz	JGFIKEGPEGDWKW-WMLDXEAASA-N	0	3	333.863	3.313	20	30		EGEDHN
C[C@H]1CN(C(=O)c2ccoc2)CC[C@@H]1CNCc1ccccc1C#N	ZINC001075224667	1356350393	/nfs/dbraw/zinc/35/03/93/1356350393.db2.gz	XNWRAOUWDDMZNN-DOTOQJQBSA-N	0	3	337.423	3.039	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)CC(C)(C)c3ccc(F)cc3)[C@@H]2C1	ZINC001075885351	1356439457	/nfs/dbraw/zinc/43/94/57/1356439457.db2.gz	RXLSQGCEHDRYCC-MAUKXSAKSA-N	0	3	330.447	3.212	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccc(C(F)F)c(F)c3)[C@@H]2C1	ZINC001076237991	1356526905	/nfs/dbraw/zinc/52/69/05/1356526905.db2.gz	KOEJXWXDBINORF-XJKSGUPXSA-N	0	3	338.373	3.486	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)[C@@H](C)c3cc4ccccc4o3)[C@@H]2C1	ZINC001076445968	1356579866	/nfs/dbraw/zinc/57/98/66/1356579866.db2.gz	UMVJFYIBFMHEOL-RYQLBKOJSA-N	0	3	336.435	3.092	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccsc3C(F)F)[C@@H]2C1	ZINC001076512624	1356599846	/nfs/dbraw/zinc/59/98/46/1356599846.db2.gz	GJJZCWLUOYZIDF-WCQYABFASA-N	0	3	326.412	3.408	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccc4ncsc4c3)[C@@H]2C1	ZINC001076530420	1356605701	/nfs/dbraw/zinc/60/57/01/1356605701.db2.gz	NDTOQBJUVCLVBN-GOEBONIOSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@@H]3Cc4c3cccc4Cl)[C@@H]2C1	ZINC001076623014	1356636865	/nfs/dbraw/zinc/63/68/65/1356636865.db2.gz	BXXOGHHSAMDNST-FDQGKXFDSA-N	0	3	330.859	3.089	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(-n3cccc3)cc2)C1	ZINC001098927449	1363524671	/nfs/dbraw/zinc/52/46/71/1363524671.db2.gz	OZKCOBWMWOCEJL-RXVVDRJESA-N	0	3	335.451	3.248	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@H]2[C@@H]3CCCCCC[C@@H]32)C[C@H]1C(F)(F)F	ZINC001099314410	1363745755	/nfs/dbraw/zinc/74/57/55/1363745755.db2.gz	MUBJTQWDLQRIJG-JKJDWNRSSA-N	0	3	344.421	3.368	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)Cn1ccc2ccccc21	ZINC001099344443	1363762805	/nfs/dbraw/zinc/76/28/05/1363762805.db2.gz	KWKMCYIDJLMGDO-SFHVURJKSA-N	0	3	339.483	3.434	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)C[C@@H](C)C1CC1	ZINC001099359590	1363772546	/nfs/dbraw/zinc/77/25/46/1363772546.db2.gz	RSYYXTPFDYYTSI-AEFFLSMTSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccoc2Cl)C12CCC2	ZINC001078601706	1357030595	/nfs/dbraw/zinc/03/05/95/1357030595.db2.gz	LFINCSVZBZFNME-RYUDHWBXSA-N	0	3	329.227	3.316	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2csc(Cl)c2)C[C@H]1c1ccccc1	ZINC001081190935	1357848554	/nfs/dbraw/zinc/84/85/54/1357848554.db2.gz	YVXGHSBALRFVDR-JKSUJKDBSA-N	0	3	344.867	3.233	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2cc(C)c(C)s2)C[C@H]1c1ccccc1	ZINC001081221996	1357851312	/nfs/dbraw/zinc/85/13/12/1357851312.db2.gz	GQXJQNNDPKZIJE-ZWKOTPCHSA-N	0	3	338.476	3.196	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CN([C@@H](C)c3ccccc3C)C[C@H]2OC)C1	ZINC001082111033	1357949479	/nfs/dbraw/zinc/94/94/79/1357949479.db2.gz	QKQFRIMIHGOKDS-QXAKKESOSA-N	0	3	342.483	3.228	20	30		EGEDHN
C=C[C@@H](C(=O)N1C[C@@H](C)[C@H](NCc2ncccc2C)C1)c1ccccc1	ZINC001082936955	1358106089	/nfs/dbraw/zinc/10/60/89/1358106089.db2.gz	DYIMPDNWHLXFPF-YFVAEKQCSA-N	0	3	349.478	3.296	20	30		EGEDHN
C[C@@H](CC(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1)C1CC1	ZINC001082945898	1358107363	/nfs/dbraw/zinc/10/73/63/1358107363.db2.gz	JJRYTAUWAZTZGU-IQUTYRLHSA-N	0	3	343.446	3.070	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3cc4ccncc4s3)[C@@H]2C1	ZINC001084408994	1358209239	/nfs/dbraw/zinc/20/92/39/1358209239.db2.gz	FEWKGXLKECFJID-HUUCEWRRSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3cc4ncccc4s3)[C@@H]2C1	ZINC001084573380	1358240838	/nfs/dbraw/zinc/24/08/38/1358240838.db2.gz	QTRGIQGMVBVREN-UKRRQHHQSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3cnc4ccsc4c3)[C@@H]2C1	ZINC001084574545	1358241827	/nfs/dbraw/zinc/24/18/27/1358241827.db2.gz	BRQHLLZDZXEGEO-CZUORRHYSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CCN(Cc3ccc4ncccc4c3)C[C@H]21	ZINC001084578013	1358242268	/nfs/dbraw/zinc/24/22/68/1358242268.db2.gz	DZEKSZBMLFQBQX-UYAOXDASSA-N	0	3	349.478	3.480	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)C[C@H](C)c3ccccc3OC)[C@@H]2C1	ZINC001084781426	1358307410	/nfs/dbraw/zinc/30/74/10/1358307410.db2.gz	AMKGXHMPVZJOIU-YQVWRLOYSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)c3cc(C)n(CC4CC4)c3C)[C@@H]2C1	ZINC001084779953	1358307910	/nfs/dbraw/zinc/30/79/10/1358307910.db2.gz	IIOHDTNGEDRYCZ-UYAOXDASSA-N	0	3	341.499	3.237	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)c3c[nH]c4c3cccc4CC)[C@@H]2C1	ZINC001084852516	1358328558	/nfs/dbraw/zinc/32/85/58/1358328558.db2.gz	CJVTYCUZCPHTDL-VQIMIIECSA-N	0	3	337.467	3.453	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC[C@H]2CCN(Cc3ccc(C(F)F)cc3)[C@H]2C1	ZINC001084907033	1358344761	/nfs/dbraw/zinc/34/47/61/1358344761.db2.gz	RLDCESKFJIUVQY-LXZKKBNFSA-N	0	3	347.409	3.207	20	30		EGEDHN
C[C@@]1(C(=O)N2CC[C@H]3CCN(Cc4cccc(C#N)c4)[C@H]3C2)C=CCC1	ZINC001085010029	1358364868	/nfs/dbraw/zinc/36/48/68/1358364868.db2.gz	JVYZTJKMJOPHKJ-RZUBCFFCSA-N	0	3	349.478	3.337	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@H](C)Cc3ccc(C)cc3)C[C@@H]21	ZINC001085102773	1358392212	/nfs/dbraw/zinc/39/22/12/1358392212.db2.gz	VLUMYSHYGWPSKK-RLLQIKCJSA-N	0	3	326.484	3.282	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@@H](C)Cc3ccccc3C)C[C@@H]21	ZINC001085103331	1358392324	/nfs/dbraw/zinc/39/23/24/1358392324.db2.gz	KOHGTJMMFPPOEL-ZVDOUQERSA-N	0	3	338.495	3.120	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cccc2[nH]c(C)nc21	ZINC001085383984	1358484015	/nfs/dbraw/zinc/48/40/15/1358484015.db2.gz	JVTJSOURKOTZPT-HUUCEWRRSA-N	0	3	346.862	3.254	20	30		EGEDHN
CC[C@H](c1ccccc1)N1CC[C@@H]1CN(C)C(=O)c1c[nH]c(C#N)c1	ZINC001085553201	1358589217	/nfs/dbraw/zinc/58/92/17/1358589217.db2.gz	ZAHYAIZDTFCWCJ-RTBURBONSA-N	0	3	336.439	3.184	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N(C)C[C@@H]1CCN1CCCC1CCCC1	ZINC001085599855	1358624967	/nfs/dbraw/zinc/62/49/67/1358624967.db2.gz	CPYNGQISSVTTKD-ZCNNSNEGSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc(-c2ccncc2)o1	ZINC001085640006	1358654328	/nfs/dbraw/zinc/65/43/28/1358654328.db2.gz	ZZBQXSANRYIQBR-QGZVFWFLSA-N	0	3	339.439	3.454	20	30		EGEDHN
CCC(CC)[C@@H](C)C(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C1	ZINC001183817653	1387353262	/nfs/dbraw/zinc/35/32/62/1387353262.db2.gz	QJTYVZOQUIUPNL-UKRRQHHQSA-N	0	3	333.501	3.383	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@@H]1CCc2ccccc2C1	ZINC001085844015	1358811592	/nfs/dbraw/zinc/81/15/92/1358811592.db2.gz	BPHDDYNDZUEUBC-UXHICEINSA-N	0	3	326.484	3.290	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cnc(C(C)C)nc1C	ZINC001085857622	1358825421	/nfs/dbraw/zinc/82/54/21/1358825421.db2.gz	CUZPTIXLCNGYII-INIZCTEOSA-N	0	3	330.476	3.021	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1occc1Br	ZINC001085878777	1358842736	/nfs/dbraw/zinc/84/27/36/1358842736.db2.gz	MQOWAHAVSDEKQO-LBPRGKRZSA-N	0	3	341.249	3.155	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cccc(C(F)(F)F)n1	ZINC001085887044	1358846748	/nfs/dbraw/zinc/84/67/48/1358846748.db2.gz	ODMLHFLOXVNTEK-CYBMUJFWSA-N	0	3	341.377	3.213	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1cccc(-c2cnco2)c1	ZINC001085903651	1358862717	/nfs/dbraw/zinc/86/27/17/1358862717.db2.gz	KCQDBZMXQDCAGJ-KRWDZBQOSA-N	0	3	325.412	3.064	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@H]1Cc2c1cccc2Cl	ZINC001085995298	1358950325	/nfs/dbraw/zinc/95/03/25/1358950325.db2.gz	JHQYJQJGXXARTJ-PBHICJAKSA-N	0	3	332.875	3.479	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1ccc(N(C)CCC)cc1	ZINC001086001912	1358957211	/nfs/dbraw/zinc/95/72/11/1358957211.db2.gz	USXXRGYOJVYJIP-IBGZPJMESA-N	0	3	329.488	3.255	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)C2C3CC4CC(C3)CC2C4)C1	ZINC001086107922	1358999026	/nfs/dbraw/zinc/99/90/26/1358999026.db2.gz	USPIUKCXXXCUNR-ORZQMPQJSA-N	0	3	336.907	3.296	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc(Cl)ccc2F)C1	ZINC001086142474	1359007047	/nfs/dbraw/zinc/00/70/47/1359007047.db2.gz	ZAWRHNMDQUBOED-KLPPZKSPSA-N	0	3	331.218	3.330	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc3cccnc3c2)C1	ZINC001086227721	1359033638	/nfs/dbraw/zinc/03/36/38/1359033638.db2.gz	DLXRBVIHTOYEFI-AKAXFMLLSA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cccc3ccncc32)C1	ZINC001086243245	1359039975	/nfs/dbraw/zinc/03/99/75/1359039975.db2.gz	AFGUDRJCKZCPFW-OTVXOJSOSA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)C23CC4CC(CC(C4)C2)C3)C1	ZINC001086260223	1359045499	/nfs/dbraw/zinc/04/54/99/1359045499.db2.gz	ORTRIFQCEXCEPD-CEYRACAXSA-N	0	3	336.907	3.440	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc3ccncc3s2)C1	ZINC001086387566	1359084678	/nfs/dbraw/zinc/08/46/78/1359084678.db2.gz	JUSYVMXPACKHQR-AULYBMBSSA-N	0	3	335.860	3.147	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(Cl)cc2F)C1	ZINC001086422007	1359092397	/nfs/dbraw/zinc/09/23/97/1359092397.db2.gz	MBBKWPVLSOKXAQ-UMSPYCQHSA-N	0	3	331.218	3.330	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@@H]2C[C@H]2c2ccc(C)s2)C1	ZINC001086501037	1359121666	/nfs/dbraw/zinc/12/16/66/1359121666.db2.gz	GXDZWDVOAWAXFU-KBUPBQIOSA-N	0	3	338.904	3.397	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(F)cc2Cl)C1	ZINC001086545303	1359139355	/nfs/dbraw/zinc/13/93/55/1359139355.db2.gz	DVBOPWAGFNUYNS-UMSPYCQHSA-N	0	3	331.218	3.330	20	30		EGEDHN
C=CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2c(C)noc2C)C1	ZINC001086574254	1359152826	/nfs/dbraw/zinc/15/28/26/1359152826.db2.gz	IIYAEALHBDMCGZ-ZWKOTPCHSA-N	0	3	339.439	3.065	20	30		EGEDHN
CC(C)C(=O)N[C@@H]1CN(Cc2ccc(C#N)cc2)C[C@H]1c1ccccc1	ZINC001086575825	1359153490	/nfs/dbraw/zinc/15/34/90/1359153490.db2.gz	LSPXTJPZGJNFID-LEWJYISDSA-N	0	3	347.462	3.298	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)[C@@H]2CCCC2(C)C)C1	ZINC001086604524	1359161592	/nfs/dbraw/zinc/16/15/92/1359161592.db2.gz	HIKWRVYNZIVYCH-SLFFLAALSA-N	0	3	338.495	3.420	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)[C@@H]2C[C@H]2CC(C)C)C1	ZINC001086611062	1359163850	/nfs/dbraw/zinc/16/38/50/1359163850.db2.gz	XSHLJRSXQOCLDD-MXEMCNAFSA-N	0	3	338.495	3.276	20	30		EGEDHN
C=CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2nc(C)oc2C)C1	ZINC001086616769	1359165454	/nfs/dbraw/zinc/16/54/54/1359165454.db2.gz	WZDRBYXVSVIHBA-ZWKOTPCHSA-N	0	3	339.439	3.065	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)[C@@H]2CC23CCCC3)C1	ZINC001086617883	1359165792	/nfs/dbraw/zinc/16/57/92/1359165792.db2.gz	DIOANSYYWRRKBK-SLFFLAALSA-N	0	3	336.479	3.174	20	30		EGEDHN
C=C(Br)CN[C@@H]1CC[C@H](CNC(=O)c2cccs2)C1	ZINC001086636066	1359173224	/nfs/dbraw/zinc/17/32/24/1359173224.db2.gz	SRFXUUBMTBHKMV-NWDGAFQWSA-N	0	3	343.290	3.145	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2c3c[nH]nc3ccc2C)C1	ZINC001086738884	1359193349	/nfs/dbraw/zinc/19/33/49/1359193349.db2.gz	WUSLMAXRUVQWGY-UONOGXRCSA-N	0	3	346.862	3.112	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cccc(Cl)c3)C2)CC1	ZINC001086954623	1359275246	/nfs/dbraw/zinc/27/52/46/1359275246.db2.gz	PZVZISDZJRWMFG-HNNXBMFYSA-N	0	3	330.859	3.290	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3nc(C)c(C)s3)C2)CC1	ZINC001086956397	1359277001	/nfs/dbraw/zinc/27/70/01/1359277001.db2.gz	MUBMMZWCEUVOCR-AWEZNQCLSA-N	0	3	345.512	3.100	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3cccn3C(C)C)C2)CC1	ZINC001086957670	1359278622	/nfs/dbraw/zinc/27/86/22/1359278622.db2.gz	SYYQDVJLXJQWSD-SFHVURJKSA-N	0	3	341.499	3.409	20	30		EGEDHN
C[C@@H]1CCN(C(=O)C(C)(C)F)[C@H](CNCc2ccc(C#N)cc2F)C1	ZINC001087108206	1359287856	/nfs/dbraw/zinc/28/78/56/1359287856.db2.gz	GDPAUIDJZDTCNZ-CJNGLKHVSA-N	0	3	349.425	3.162	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](CNCc2csc(CC)n2)[C@H](C)C1	ZINC001184079114	1387389806	/nfs/dbraw/zinc/38/98/06/1387389806.db2.gz	TYZQIVHIIJLPBT-CABCVRRESA-N	0	3	335.517	3.246	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1oc(C)cc1C	ZINC001087278312	1359354023	/nfs/dbraw/zinc/35/40/23/1359354023.db2.gz	FGDFUPDXASXNHU-BPQIPLTHSA-N	0	3	328.456	3.139	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1c[nH]c2ccccc12	ZINC001087293357	1359374543	/nfs/dbraw/zinc/37/45/43/1359374543.db2.gz	COIUQXVWULJFPZ-AYOQOUSVSA-N	0	3	335.451	3.020	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc(Cl)ccc3F)C(C)(C)[C@H]21	ZINC001087295132	1359375928	/nfs/dbraw/zinc/37/59/28/1359375928.db2.gz	FFDWPRRYAYUPLF-COXVUDFISA-N	0	3	348.849	3.331	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc4ccc(C)cc4[nH]3)C(C)(C)[C@H]21	ZINC001087296623	1359378005	/nfs/dbraw/zinc/37/80/05/1359378005.db2.gz	CLJJRFFEPSJHQK-UXPWSPDFSA-N	0	3	349.478	3.328	20	30		EGEDHN
C=CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1nc(Cl)cs1	ZINC001087300094	1359382590	/nfs/dbraw/zinc/38/25/90/1359382590.db2.gz	GUSSXDWSWDMSAG-KGYLQXTDSA-N	0	3	339.892	3.201	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1coc(C(F)F)c1	ZINC001087300416	1359383587	/nfs/dbraw/zinc/38/35/87/1359383587.db2.gz	KJVJJAGNIJVFQK-VHDGCEQUSA-N	0	3	336.382	3.069	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc(CCC)cc3)C(C)(C)[C@H]21	ZINC001087301222	1359383938	/nfs/dbraw/zinc/38/39/38/1359383938.db2.gz	ZPESGDUORHNOKZ-AABGKKOBSA-N	0	3	338.495	3.491	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2[C@@H]3CCCN(CC#CC)[C@@H]3C2(C)C)CC1	ZINC001087303366	1359386927	/nfs/dbraw/zinc/38/69/27/1359386927.db2.gz	KMTADJDUQSOHJL-OTWHNJEPSA-N	0	3	328.500	3.361	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(Cl)cc3)C(C)(C)[C@@H]21	ZINC001087313850	1359402665	/nfs/dbraw/zinc/40/26/65/1359402665.db2.gz	BAGWJUFPBJHEQD-BRWVUGGUSA-N	0	3	330.859	3.192	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc(F)cc1F	ZINC001087316669	1359407716	/nfs/dbraw/zinc/40/77/16/1359407716.db2.gz	VZZHLYKUIXQSAC-BPQIPLTHSA-N	0	3	346.421	3.207	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc4c(c3)CCC4)C(C)(C)[C@H]21	ZINC001087317117	1359408431	/nfs/dbraw/zinc/40/84/31/1359408431.db2.gz	CVMZBCSIXWHWNY-AABGKKOBSA-N	0	3	336.479	3.027	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(CF)cc3)C(C)(C)[C@@H]21	ZINC001087319432	1359411749	/nfs/dbraw/zinc/41/17/49/1359411749.db2.gz	NOMSITHMRHMCJR-KZNAEPCWSA-N	0	3	328.431	3.008	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)[C@@H]2C[C@H]2C2CC2)C1	ZINC001087439546	1359465477	/nfs/dbraw/zinc/46/54/77/1359465477.db2.gz	DLLSTEXZEGSWGM-PLACYPQZSA-N	0	3	336.479	3.030	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CN(C(C)C)CC[C@@H]2c2ccccc2)c1	ZINC001087437374	1359465954	/nfs/dbraw/zinc/46/59/54/1359465954.db2.gz	OWGYORKJNJVGJX-NHCUHLMSSA-N	0	3	347.462	3.059	20	30		EGEDHN
C=C(C)CCN1CC[C@H](c2cccc(F)c2)[C@H](NC(=O)C(F)F)C1	ZINC001087451549	1359472254	/nfs/dbraw/zinc/47/22/54/1359472254.db2.gz	YMVJMZJIDAVRTD-HZPDHXFCSA-N	0	3	340.389	3.331	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2coc3cc(F)ccc23)[C@H]1CC	ZINC001087569370	1359535410	/nfs/dbraw/zinc/53/54/10/1359535410.db2.gz	SDBLEWXRDBRZFE-ZWKOTPCHSA-N	0	3	342.414	3.107	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)[C@@H]2CC[C@H](c3ccccc3)O2)[C@H]1CC	ZINC001087575264	1359538527	/nfs/dbraw/zinc/53/85/27/1359538527.db2.gz	YXEBWOMCGKLDDT-NMLBUPMWSA-N	0	3	342.483	3.452	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cn(C)c3ccc(F)cc23)[C@H]1CC	ZINC001087605272	1359552086	/nfs/dbraw/zinc/55/20/86/1359552086.db2.gz	QGSRAXGMSBTHNX-DLBZAZTESA-N	0	3	329.419	3.086	20	30		EGEDHN
C=CCCN1CC[C@H](NC(=O)c2scnc2C(F)(F)F)[C@H]1CC	ZINC001087606654	1359552798	/nfs/dbraw/zinc/55/27/98/1359552798.db2.gz	KHBHWMIUSDCDAQ-WDEREUQCSA-N	0	3	347.406	3.321	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)[C@H]2CCc3ccc(F)cc3O2)[C@H]1CC	ZINC001087657957	1359575752	/nfs/dbraw/zinc/57/57/52/1359575752.db2.gz	FGZLFBLNYXLJIQ-RCCFBDPRSA-N	0	3	346.446	3.065	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccccc2OC2CCC2)[C@H]1CC	ZINC001087718460	1359609549	/nfs/dbraw/zinc/60/95/49/1359609549.db2.gz	POVNGJQGADUHQZ-ZWKOTPCHSA-N	0	3	328.456	3.387	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N[C@H]1CCN(Cc2csc(C)c2)[C@@H]1CC	ZINC001087732179	1359615339	/nfs/dbraw/zinc/61/53/39/1359615339.db2.gz	GNFACXGFRUTSNL-XDNAFOTISA-N	0	3	348.512	3.117	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@H]1CC	ZINC001087806955	1359656766	/nfs/dbraw/zinc/65/67/66/1359656766.db2.gz	JDCIKOKWCCRXEQ-LSDHHAIUSA-N	0	3	326.362	3.474	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C[C@H]2CCc3ccccc3C2)[C@H]1CC	ZINC001087808814	1359658730	/nfs/dbraw/zinc/65/87/30/1359658730.db2.gz	LBBFZUFIMKMODQ-DZFGPLHGSA-N	0	3	338.495	3.174	20	30		EGEDHN
C[C@H](c1ccc(F)cc1)N1CC[C@@H]2CN(C(=O)C#CC3CC3)C[C@@H]2C1	ZINC001087959462	1359719370	/nfs/dbraw/zinc/71/93/70/1359719370.db2.gz	ZKZBGWKTHQEFMX-LZQZEXGQSA-N	0	3	340.442	3.080	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3cc(C)c(Cl)cc3C)C[C@@H]2C1	ZINC001088063646	1359738919	/nfs/dbraw/zinc/73/89/19/1359738919.db2.gz	PPOMFJKBGGATRC-SJORKVTESA-N	0	3	344.886	3.374	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)C3[C@@H]4CCCCCC[C@@H]34)C[C@@H]2C1	ZINC001088119172	1359762419	/nfs/dbraw/zinc/76/24/19/1359762419.db2.gz	IBPJLVFRPSGCQT-FCGDIQPGSA-N	0	3	328.500	3.006	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)C[C@H]2CC(C)(C)CO2)C1	ZINC001088346613	1359833739	/nfs/dbraw/zinc/83/37/39/1359833739.db2.gz	UKJVKYJGAAGKPP-CVEARBPZSA-N	0	3	342.911	3.305	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCCCN(C(=O)CC2(C)CC2)C1	ZINC001088349160	1359835594	/nfs/dbraw/zinc/83/55/94/1359835594.db2.gz	MZIVFDGWYSBVTI-CQSZACIVSA-N	0	3	343.309	3.446	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCCC[C@H](NCc2ncccc2C)C1	ZINC001088360313	1359843682	/nfs/dbraw/zinc/84/36/82/1359843682.db2.gz	VVCPVAXJFQSXNQ-KRWDZBQOSA-N	0	3	329.488	3.463	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCCCC[C@@H](NCc2cn(C)nc2C)C1	ZINC001088374686	1359856046	/nfs/dbraw/zinc/85/60/46/1359856046.db2.gz	NPZCPZYNMVFJSS-UYAOXDASSA-N	0	3	346.519	3.192	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cccc(N3CCCC3)c2)[C@H]1C	ZINC001088939798	1360109388	/nfs/dbraw/zinc/10/93/88/1360109388.db2.gz	KKPVNEAOXZWXIM-APWZRJJASA-N	0	3	327.472	3.056	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2ccc(Cl)c3occc32)[C@H]1C	ZINC001088975481	1360121140	/nfs/dbraw/zinc/12/11/40/1360121140.db2.gz	ZGKLJNAJMHDPRY-WBMJQRKESA-N	0	3	330.815	3.302	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccc(OCC3CC3)cc2)[C@H]1C	ZINC001089048261	1360147877	/nfs/dbraw/zinc/14/78/77/1360147877.db2.gz	ARADRANRTKUNAH-BEFAXECRSA-N	0	3	328.456	3.244	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3c(o2)CCCC3)CC(C)(C)C1	ZINC001089407453	1360405880	/nfs/dbraw/zinc/40/58/80/1360405880.db2.gz	ZNGHYTWUJIIIPQ-QGZVFWFLSA-N	0	3	342.483	3.402	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C2(C)CCC(F)(F)CC2)CC(C)(C)C1	ZINC001089423343	1360417605	/nfs/dbraw/zinc/41/76/05/1360417605.db2.gz	IHUCUDMPMLGFFE-OAHLLOKOSA-N	0	3	340.458	3.442	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@H](C)c2c(F)cccc2F)CC(C)(C)C1	ZINC001089440488	1360430565	/nfs/dbraw/zinc/43/05/65/1360430565.db2.gz	AMOCIOSOLCPLPG-HUUCEWRRSA-N	0	3	348.437	3.308	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2cccc(C3CC3)c2)CC(C)(C)C1	ZINC001089448311	1360437187	/nfs/dbraw/zinc/43/71/87/1360437187.db2.gz	OSXAVTKUJNRCLF-HXUWFJFHSA-N	0	3	338.495	3.347	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2occ3c2CCC3)CC(C)(C)C1	ZINC001089451942	1360439581	/nfs/dbraw/zinc/43/95/81/1360439581.db2.gz	ZMAHYIMLDILRGP-MRXNPFEDSA-N	0	3	328.456	3.012	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2c(C)cc(F)cc2C)CC(C)(C)C1	ZINC001089459043	1360445384	/nfs/dbraw/zinc/44/53/84/1360445384.db2.gz	REGCIHKEQDCKNG-KRWDZBQOSA-N	0	3	330.447	3.296	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc(C(CC)CC)no2)CC(C)(C)C1	ZINC001089511299	1360482647	/nfs/dbraw/zinc/48/26/47/1360482647.db2.gz	PVSVVOJPVSZYBG-INIZCTEOSA-N	0	3	345.487	3.432	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cccc(F)c2OCC)CC(C)(C)C1	ZINC001089526568	1360490105	/nfs/dbraw/zinc/49/01/05/1360490105.db2.gz	DECBFVNJDWSFLL-OAHLLOKOSA-N	0	3	346.446	3.078	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(F)cc2Cl)CC(C)(C)C1	ZINC001089551878	1360503287	/nfs/dbraw/zinc/50/32/87/1360503287.db2.gz	KUUPMMHCIXKSDK-CQSZACIVSA-N	0	3	336.838	3.333	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(OC)c(Cl)c2)CC(C)(C)C1	ZINC001089552304	1360503357	/nfs/dbraw/zinc/50/33/57/1360503357.db2.gz	AJSZATXXBGSFFZ-HNNXBMFYSA-N	0	3	348.874	3.202	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc3c(s2)CCCC3)CC(C)(C)C1	ZINC001089557240	1360506751	/nfs/dbraw/zinc/50/67/51/1360506751.db2.gz	YZTIGBUZILTJOL-INIZCTEOSA-N	0	3	344.524	3.481	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2c(Cl)cccc2OC)CC(C)(C)C1	ZINC001089560985	1360508705	/nfs/dbraw/zinc/50/87/05/1360508705.db2.gz	LRLQDJKVCPPLQK-AWEZNQCLSA-N	0	3	348.874	3.202	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cncc3ccccc32)CC(C)(C)C1	ZINC001089561763	1360508730	/nfs/dbraw/zinc/50/87/30/1360508730.db2.gz	TUQVNUIIRXNZKZ-KRWDZBQOSA-N	0	3	335.451	3.088	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@]2(C)CCc3ccccc32)CC(C)(C)C1	ZINC001089565252	1360512032	/nfs/dbraw/zinc/51/20/32/1360512032.db2.gz	QHKJGTJFVLQTND-PGRDOPGGSA-N	0	3	338.495	3.131	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C2(c3ccccc3C)CC2)CC(C)(C)C1	ZINC001089569311	1360514875	/nfs/dbraw/zinc/51/48/75/1360514875.db2.gz	WCNHFAUFLNKZIJ-SFHVURJKSA-N	0	3	338.495	3.267	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1nc(C(C)C)oc1C	ZINC001089640103	1360552974	/nfs/dbraw/zinc/55/29/74/1360552974.db2.gz	AVTNCTKZWIDXCJ-INIZCTEOSA-N	0	3	345.487	3.350	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](CNCc2ocnc2C)[C@H](C)C1	ZINC001184448357	1387462593	/nfs/dbraw/zinc/46/25/93/1387462593.db2.gz	OBBBHYAPIUQJKK-QAPCUYQASA-N	0	3	345.487	3.326	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccnn1CC(C)C	ZINC001089646193	1360558774	/nfs/dbraw/zinc/55/87/74/1360558774.db2.gz	LNTZKTIOGXIUCX-QGZVFWFLSA-N	0	3	346.519	3.336	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](CNCc2cnc(C)o2)[C@@H](C)C1	ZINC001184447624	1387462682	/nfs/dbraw/zinc/46/26/82/1387462682.db2.gz	JVLSKONVGJNQGZ-YJBOKZPZSA-N	0	3	345.487	3.326	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cccc2c1COCC2	ZINC001089649125	1360561815	/nfs/dbraw/zinc/56/18/15/1360561815.db2.gz	BNLSGJQODDYUEU-QGZVFWFLSA-N	0	3	342.483	3.166	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1nccc2cccnc21	ZINC001089652137	1360564991	/nfs/dbraw/zinc/56/49/91/1360564991.db2.gz	XTZJTPYKDRWKKZ-MRXNPFEDSA-N	0	3	338.455	3.036	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cnn2ccc(C)cc12	ZINC001089652692	1360566076	/nfs/dbraw/zinc/56/60/76/1360566076.db2.gz	JRXREWYWZHRCHI-MRXNPFEDSA-N	0	3	340.471	3.049	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccn2c1CCCC2	ZINC001089653753	1360566485	/nfs/dbraw/zinc/56/64/85/1360566485.db2.gz	SXDHRXDEHUWTCS-INIZCTEOSA-N	0	3	329.488	3.231	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(OC)c(F)c1	ZINC001089653793	1360566968	/nfs/dbraw/zinc/56/69/68/1360566968.db2.gz	UEMAMRIQFAVTSK-INIZCTEOSA-N	0	3	346.446	3.078	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccccc1COC	ZINC001089664284	1360574139	/nfs/dbraw/zinc/57/41/39/1360574139.db2.gz	IATBLYAZTOSDSS-GOSISDBHSA-N	0	3	342.483	3.077	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cccc(COC)c1	ZINC001089666202	1360576442	/nfs/dbraw/zinc/57/64/42/1360576442.db2.gz	MOKBZRRSLOYERL-GOSISDBHSA-N	0	3	330.472	3.239	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(COC)o1	ZINC001089666876	1360577213	/nfs/dbraw/zinc/57/72/13/1360577213.db2.gz	ZWUCCWFILISSCZ-HNNXBMFYSA-N	0	3	334.460	3.223	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(C)c(C)n1	ZINC001089671590	1360581358	/nfs/dbraw/zinc/58/13/58/1360581358.db2.gz	UCQQYMVKMDJYOS-KRWDZBQOSA-N	0	3	329.488	3.495	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cn(CC)nc1C	ZINC001089703656	1360606861	/nfs/dbraw/zinc/60/68/61/1360606861.db2.gz	NMBGBSITFPXGQF-INIZCTEOSA-N	0	3	332.492	3.008	20	30		EGEDHN
C#CCOc1ccc(C(=O)NC[C@H]2CCC(C)(C)CN2CC=C)cc1	ZINC001089706339	1360609450	/nfs/dbraw/zinc/60/94/50/1360609450.db2.gz	QXYHGFFAPMVPIW-GOSISDBHSA-N	0	3	340.467	3.105	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(C)c(CC)o1	ZINC001089726116	1360629007	/nfs/dbraw/zinc/62/90/07/1360629007.db2.gz	NDLXUWFAYWXUPG-MRXNPFEDSA-N	0	3	330.472	3.394	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccccc1OC	ZINC001089726579	1360630360	/nfs/dbraw/zinc/63/03/60/1360630360.db2.gz	OJTXZUNCIYEROI-MRXNPFEDSA-N	0	3	330.472	3.492	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(F)cc1F	ZINC001089730066	1360633515	/nfs/dbraw/zinc/63/35/15/1360633515.db2.gz	VQXFOVURLHBVDH-OAHLLOKOSA-N	0	3	334.410	3.209	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1ccsc1	ZINC001089764240	1360654865	/nfs/dbraw/zinc/65/48/65/1360654865.db2.gz	NUFILPYLAOPXCX-HNKHHVNMSA-N	0	3	336.888	3.283	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C(C)=C1CCC1	ZINC001089805750	1360671552	/nfs/dbraw/zinc/67/15/52/1360671552.db2.gz	LGPIKTJCJBVTDP-FJIDUMEYSA-N	0	3	334.891	3.408	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)C(C)=C2CCC2)C1	ZINC001089805756	1360671568	/nfs/dbraw/zinc/67/15/68/1360671568.db2.gz	LGPIKTJCJBVTDP-XSLAGTTESA-N	0	3	334.891	3.408	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1(C2CC2)CC1	ZINC001089824494	1360681392	/nfs/dbraw/zinc/68/13/92/1360681392.db2.gz	OPVUSNJEPBKNOD-LLLHUVSDSA-N	0	3	334.891	3.098	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)C2(C3CC3)CC2)C1	ZINC001089824493	1360681627	/nfs/dbraw/zinc/68/16/27/1360681627.db2.gz	OPVUSNJEPBKNOD-HJWJTTGWSA-N	0	3	334.891	3.098	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)C2CC3(CCC3)C2)C1	ZINC001089849595	1360696694	/nfs/dbraw/zinc/69/66/94/1360696694.db2.gz	HENHKMSJTYLALQ-DKIMLUQUSA-N	0	3	348.918	3.488	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1(CF)CCC1	ZINC001089867442	1360709370	/nfs/dbraw/zinc/70/93/70/1360709370.db2.gz	JFOSIRSMPTYRFH-FZKCQIBNSA-N	0	3	340.870	3.048	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)[C@H]2CCC(C)=C(C)C2)CC2(CCOCC2)C1	ZINC001089939321	1360754233	/nfs/dbraw/zinc/75/42/33/1360754233.db2.gz	PXIQQXGGQXUPAZ-RBUKOAKNSA-N	0	3	346.515	3.296	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C[C@H]2C=CCCC2)CC2(CCOCC2)C1	ZINC001089944336	1360757471	/nfs/dbraw/zinc/75/74/71/1360757471.db2.gz	BRFKWRZCOIXZNR-RBUKOAKNSA-N	0	3	346.515	3.296	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)[C@H](C)c2ccsc2)CC2(CCOCC2)C1	ZINC001089959914	1360767072	/nfs/dbraw/zinc/76/70/72/1360767072.db2.gz	UKIIDUHVUAXTKZ-NVXWUHKLSA-N	0	3	348.512	3.025	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)[C@@H]2CCCC(C)(C)C2)CC2(CCOCC2)C1	ZINC001089969396	1360772794	/nfs/dbraw/zinc/77/27/94/1360772794.db2.gz	KPIGZKWTWRTOIW-QZTJIDSGSA-N	0	3	348.531	3.376	20	30		EGEDHN
CCCN(C)CC(=O)N[C@@H](C)CCCCNc1cccc(F)c1C#N	ZINC001090102348	1360826242	/nfs/dbraw/zinc/82/62/42/1360826242.db2.gz	IPNJFGQZFDLBHO-HNNXBMFYSA-N	0	3	348.466	3.126	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccc(C3CCCC3)cc2)[C@H](O)C1	ZINC001090435721	1360896540	/nfs/dbraw/zinc/89/65/40/1360896540.db2.gz	JWYFPFUFHLMOKZ-VQTJNVASSA-N	0	3	342.483	3.085	20	30		EGEDHN
N#Cc1ccc(CNC2CC(CNC(=O)[C@H]3CC=CCC3)C2)c(F)c1	ZINC001090922881	1360954696	/nfs/dbraw/zinc/95/46/96/1360954696.db2.gz	VKJBKWJYTNUOIP-PQUAAJSLSA-N	0	3	341.430	3.038	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc(F)cc3ccncc32)C1	ZINC001091030669	1360983048	/nfs/dbraw/zinc/98/30/48/1360983048.db2.gz	LSLLJCOKKMUVKJ-UHFFFAOYSA-N	0	3	347.821	3.224	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@H]2COc3cc(C)c(C)cc32)C1	ZINC001091162381	1360999508	/nfs/dbraw/zinc/99/95/08/1360999508.db2.gz	KTOQFYIHSBVNJC-DQPZFDDXSA-N	0	3	348.874	3.016	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(C)nc2C(C)C)C1	ZINC001091166281	1361000285	/nfs/dbraw/zinc/00/02/85/1361000285.db2.gz	JOUNHTVYUWYLRO-UHFFFAOYSA-N	0	3	335.879	3.364	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc3cc(F)ccc3o2)C1	ZINC001091263558	1361026162	/nfs/dbraw/zinc/02/61/62/1361026162.db2.gz	MTSIRGFOILKFNE-UHFFFAOYSA-N	0	3	336.794	3.422	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccccc2OC(C)C)C1	ZINC001091334619	1361048610	/nfs/dbraw/zinc/04/86/10/1361048610.db2.gz	WDJSQBHAGSAEPC-UHFFFAOYSA-N	0	3	336.863	3.324	20	30		EGEDHN
Cc1ccoc1C(=O)N1C[C@H]2CN(Cc3ccc(C#N)cc3)C[C@@]2(C)C1	ZINC001091485287	1361117074	/nfs/dbraw/zinc/11/70/74/1361117074.db2.gz	XMQOBXGJOHLWSE-NQIIRXRSSA-N	0	3	349.434	3.054	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3coc4ccc(CC)cc43)C[C@]2(C)C1	ZINC001091672148	1361176970	/nfs/dbraw/zinc/17/69/70/1361176970.db2.gz	IVMXLFGLCXZJHN-IERDGZPVSA-N	0	3	336.435	3.022	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CN(Cc3cnccc3C)C[C@@]2(C)C1	ZINC001091978575	1361265332	/nfs/dbraw/zinc/26/53/32/1361265332.db2.gz	WHNJFQAIZRRAGE-GIVPXCGWSA-N	0	3	341.499	3.273	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@H](F)CC3CCCCC3)C[C@]2(C)C1	ZINC001092202387	1361321585	/nfs/dbraw/zinc/32/15/85/1361321585.db2.gz	KDIXLAQMDXBTEX-GGPKGHCWSA-N	0	3	334.479	3.099	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)C3CCC(CCCC)CC3)C[C@]2(C)C1	ZINC001092254757	1361344556	/nfs/dbraw/zinc/34/45/56/1361344556.db2.gz	BMPOOUWXSVWGGI-BRAJZSMUSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1C[C@@H](CNC(=O)c2csc3cc(C)ccc23)[C@H](C)C1	ZINC001092639465	1361430137	/nfs/dbraw/zinc/43/01/37/1361430137.db2.gz	ZORRZELRXRLZAY-HUUCEWRRSA-N	0	3	326.465	3.141	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)c2ccoc2CC)CC1	ZINC001093370172	1361579082	/nfs/dbraw/zinc/57/90/82/1361579082.db2.gz	ORBZPBPFZWOEAL-IBGZPJMESA-N	0	3	340.467	3.182	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)c2ccoc2CC)CC1	ZINC001093370173	1361579343	/nfs/dbraw/zinc/57/93/43/1361579343.db2.gz	ORBZPBPFZWOEAL-LJQANCHMSA-N	0	3	340.467	3.182	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H](CNCc2cc(C3CC3)no2)[C@H](C)C1	ZINC001094018561	1361725235	/nfs/dbraw/zinc/72/52/35/1361725235.db2.gz	UMAIOGPSJRJVIW-KKVAFCGZSA-N	0	3	345.487	3.338	20	30		EGEDHN
C[C@H](CC(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1)C1CC1	ZINC001094246148	1361759269	/nfs/dbraw/zinc/75/92/69/1361759269.db2.gz	SSCNNROKBSETFF-JXXFODFXSA-N	0	3	339.483	3.179	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cc4ccccc4nc3C)CCC[C@@H]12	ZINC001094427187	1361797674	/nfs/dbraw/zinc/79/76/74/1361797674.db2.gz	IDHHNGYBUNZQDX-IFMALSPDSA-N	0	3	347.462	3.151	20	30		EGEDHN
CC#CCN1CC[C@@]2(CNC(=O)c3ccc(C(F)F)o3)CCC[C@@H]12	ZINC001094572155	1361865616	/nfs/dbraw/zinc/86/56/16/1361865616.db2.gz	NQNSSGXMWDDUQN-CRAIPNDOSA-N	0	3	336.382	3.215	20	30		EGEDHN
Cc1cc(C)cc(CN2[C@@H]3CC[C@H]2[C@@H](NC(=O)c2ccc(C#N)[nH]2)C3)c1	ZINC001095328053	1362102987	/nfs/dbraw/zinc/10/29/87/1362102987.db2.gz	SDUXKIJIVGKLBH-HOJAQTOUSA-N	0	3	348.450	3.039	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc(C3CC3)[nH]c1C1CC1)C2	ZINC001095616090	1362187122	/nfs/dbraw/zinc/18/71/22/1362187122.db2.gz	VJGYXDZKNYMBAN-MNEFBYGVSA-N	0	3	337.467	3.128	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CC[C@@H](C)F	ZINC001095635617	1362192460	/nfs/dbraw/zinc/19/24/60/1362192460.db2.gz	KOFSGQACIXWNOP-LMSBXDPUSA-N	0	3	346.446	3.335	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1c(C)cc(C)cc1C)C2	ZINC001095960609	1362309070	/nfs/dbraw/zinc/30/90/70/1362309070.db2.gz	RKUVFUUMPPFCJI-HOJAQTOUSA-N	0	3	326.484	3.452	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](CNCc2nccs2)[C@@H](C)C1	ZINC001184943912	1387567375	/nfs/dbraw/zinc/56/73/75/1387567375.db2.gz	BIGIHYURFAMFCZ-DLBZAZTESA-N	0	3	347.528	3.301	20	30		EGEDHN
CCC[C@@H](C)C(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1	ZINC001324301769	1387588192	/nfs/dbraw/zinc/58/81/92/1387588192.db2.gz	PVVNMUTYOLDGLR-MRXNPFEDSA-N	0	3	327.472	3.465	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1sc3nccn3c1C)C2	ZINC001097240359	1362897045	/nfs/dbraw/zinc/89/70/45/1362897045.db2.gz	ARTABHHYJQWNRO-KFWWJZLASA-N	0	3	344.484	3.006	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc(C)c(Cl)cc1C)C2	ZINC001097630198	1363081410	/nfs/dbraw/zinc/08/14/10/1363081410.db2.gz	ARJHWZTVEZABNB-OLMNPRSZSA-N	0	3	330.859	3.315	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(F)c3ccccc13)C2	ZINC001097898422	1363156199	/nfs/dbraw/zinc/15/61/99/1363156199.db2.gz	NGHCFNNUFJJPHT-XMCHAPAWSA-N	0	3	336.410	3.337	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc(C(C)(C)C)oc1C)C2	ZINC001097938098	1363172015	/nfs/dbraw/zinc/17/20/15/1363172015.db2.gz	ZVPXRSVOFVBNGN-OIISXLGYSA-N	0	3	328.456	3.244	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1csc3c1CC[C@@H](C)C3)C2	ZINC001098324006	1363299192	/nfs/dbraw/zinc/29/91/92/1363299192.db2.gz	VJKKAUYANNBDIW-DTDBQYNISA-N	0	3	342.508	3.231	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)C[C@H](NC(=O)CC1CC1)c1ccccc1O2	ZINC001098541033	1363361524	/nfs/dbraw/zinc/36/15/24/1363361524.db2.gz	GHBFGUBBEJIUJI-RXVVDRJESA-N	0	3	340.467	3.447	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](NC(=O)C2CCC2)C2CCCC2)c(F)c1	ZINC001324452981	1387626504	/nfs/dbraw/zinc/62/65/04/1387626504.db2.gz	YZHJTVLZNHNURV-IBGZPJMESA-N	0	3	343.446	3.262	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cccc(F)c1	ZINC001098869489	1363498876	/nfs/dbraw/zinc/49/88/76/1363498876.db2.gz	WQURWECJYDOZHS-SFHVURJKSA-N	0	3	348.462	3.249	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)CC1CCCC1	ZINC001098874077	1363500773	/nfs/dbraw/zinc/50/07/73/1363500773.db2.gz	VLSYAOVKUFSOPV-SFHVURJKSA-N	0	3	336.520	3.376	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc3c(cc(C)cc3C)[nH]2)C1	ZINC001098963117	1363543461	/nfs/dbraw/zinc/54/34/61/1363543461.db2.gz	SRPBTHJJIULHHZ-JTSKRJEESA-N	0	3	349.478	3.392	20	30		EGEDHN
Cc1cccc(CN2CC(C)(C)CC[C@H]2CNC(=O)[C@@H](C)C#N)c1	ZINC001098976558	1363551824	/nfs/dbraw/zinc/55/18/24/1363551824.db2.gz	VLZPIQGULNPDDE-WMZOPIPTSA-N	0	3	327.472	3.262	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@H]1CCC(C)(C)CN1C[C@H]1CC(C)(C)CO1	ZINC001099065105	1363604154	/nfs/dbraw/zinc/60/41/54/1363604154.db2.gz	MPLOREIFWZCMAO-QZTJIDSGSA-N	0	3	348.531	3.068	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H]1CCC(C)(C)CN1CCOCC1CC1	ZINC001099097803	1363620423	/nfs/dbraw/zinc/62/04/23/1363620423.db2.gz	DDIYJGOUXSUVDE-SFHVURJKSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)Cc1cc(C2CC2)no1	ZINC001099106444	1363625401	/nfs/dbraw/zinc/62/54/01/1363625401.db2.gz	GEGCQILIWLPXOD-MRXNPFEDSA-N	0	3	345.487	3.277	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(CC)o1	ZINC001099125554	1363637864	/nfs/dbraw/zinc/63/78/64/1363637864.db2.gz	IGQQINMBXKFIBB-INIZCTEOSA-N	0	3	348.487	3.265	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)c2c[nH]c3ccc(C)cc23)C1	ZINC001099178185	1363675267	/nfs/dbraw/zinc/67/52/67/1363675267.db2.gz	CYGLZKSMUQHMRI-KKSFZXQISA-N	0	3	335.451	3.084	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H](C)CC(=C)C	ZINC001099187982	1363680024	/nfs/dbraw/zinc/68/00/24/1363680024.db2.gz	AJNCTEJWHYCWOA-ZWKOTPCHSA-N	0	3	336.520	3.398	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)C[C@@H](C=C)CC	ZINC001099194843	1363686672	/nfs/dbraw/zinc/68/66/72/1363686672.db2.gz	SWNCJJQGXLTKEI-ROUUACIJSA-N	0	3	336.520	3.398	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)Cc1cccc(F)c1F	ZINC001099252551	1363714747	/nfs/dbraw/zinc/71/47/47/1363714747.db2.gz	XMAHYUMHQVZKMH-OAHLLOKOSA-N	0	3	336.426	3.300	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2cc(C)c(F)cc2F)C[C@H]1C(F)(F)F	ZINC001099268866	1363724424	/nfs/dbraw/zinc/72/44/24/1363724424.db2.gz	RBCAJDLNHCOBTR-BXUZGUMPSA-N	0	3	348.315	3.052	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)C2CC3(CCC3)C2)C[C@H]1C(F)(F)F	ZINC001099293321	1363736050	/nfs/dbraw/zinc/73/60/50/1363736050.db2.gz	JWRQALSTYBCAQN-ZIAGYGMSSA-N	0	3	330.394	3.122	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2cc[nH]c2CCC)C[C@H]1C(F)(F)F	ZINC001099295354	1363736686	/nfs/dbraw/zinc/73/66/86/1363736686.db2.gz	WFXOZDRGONVCOZ-UKRRQHHQSA-N	0	3	343.393	3.136	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2occc2CC)C[C@H]1C(F)(F)F	ZINC001099301379	1363738617	/nfs/dbraw/zinc/73/86/17/1363738617.db2.gz	RXRMZTHTUGLKTB-CHWSQXEVSA-N	0	3	330.350	3.011	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)CCCC2CC2)C1	ZINC001099513349	1363828262	/nfs/dbraw/zinc/82/82/62/1363828262.db2.gz	OIIKJGANARKLFF-XSLAGTTESA-N	0	3	336.907	3.488	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C[C@H](C)CCC)CC2(CCOCC2)C1	ZINC001099572308	1363856651	/nfs/dbraw/zinc/85/66/51/1363856651.db2.gz	VCRPIVNTNDKZDK-QZTJIDSGSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)C(CCC)CCC)CC2(CCOCC2)C1	ZINC001099588816	1363870569	/nfs/dbraw/zinc/87/05/69/1363870569.db2.gz	JQZPGXOKBZDWAF-SFHVURJKSA-N	0	3	336.520	3.376	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)[C@@](C)(CC)CCC)CC2(CCOCC2)C1	ZINC001099594653	1363877147	/nfs/dbraw/zinc/87/71/47/1363877147.db2.gz	IIEWVTBAJYGPSS-QUCCMNQESA-N	0	3	348.531	3.213	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C(C)(C)CC(C)C)CC2(CCOCC2)C1	ZINC001099596882	1363879019	/nfs/dbraw/zinc/87/90/19/1363879019.db2.gz	OARQQQIXIPOCLR-SFHVURJKSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CCN(Cc2ccccc2C(C)C)C[C@H]1O	ZINC001099973788	1363994525	/nfs/dbraw/zinc/99/45/25/1363994525.db2.gz	JGHZJTFJNIGJRM-WOJBJXKFSA-N	0	3	344.499	3.218	20	30		EGEDHN
CC(C)[C@H](C)CC(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1	ZINC001100178742	1364037577	/nfs/dbraw/zinc/03/75/77/1364037577.db2.gz	WVRKFDACWNGNRC-MXWWQKGMSA-N	0	3	345.462	3.364	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](CNCc2nccn2CC)[C@H](C)C1	ZINC001185227181	1387656860	/nfs/dbraw/zinc/65/68/60/1387656860.db2.gz	VDQPSENVQXHVQG-IAGOWNOFSA-N	0	3	346.519	3.080	20	30		EGEDHN
C#CCCCC(=O)NCC1CC(N[C@@H](C)c2cc(F)ccc2F)C1	ZINC001100285511	1364067963	/nfs/dbraw/zinc/06/79/63/1364067963.db2.gz	KRUJKROYNYRYLB-HLIUYOAVSA-N	0	3	334.410	3.314	20	30		EGEDHN
CC/C(C)=C/C(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1	ZINC001100307635	1364075897	/nfs/dbraw/zinc/07/58/97/1364075897.db2.gz	LXSSKVMOBOBLJF-AWNIVKPZSA-N	0	3	329.419	3.038	20	30		EGEDHN
CCCCCCC[NH2+]C1CC(CNC(=O)c2cccc3n[n-]nc32)C1	ZINC001100353087	1364089123	/nfs/dbraw/zinc/08/91/23/1364089123.db2.gz	HDURJFOGURSEDU-UHFFFAOYSA-N	0	3	343.475	3.026	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)[C@]2(C)CC=CCC2)C1	ZINC001100359846	1364090749	/nfs/dbraw/zinc/09/07/49/1364090749.db2.gz	OFCOHXZNUBBTRR-ZBCRRDGASA-N	0	3	341.293	3.126	20	30		EGEDHN
C=C(C)CCC(=O)NCC1CC(NCc2oc(CCC)nc2C)C1	ZINC001100371173	1364094729	/nfs/dbraw/zinc/09/47/29/1364094729.db2.gz	SVPIXNFNMFWKJL-UHFFFAOYSA-N	0	3	333.476	3.276	20	30		EGEDHN
CC(C)C[C@@H](C)OC(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC001185253186	1387659993	/nfs/dbraw/zinc/65/99/93/1387659993.db2.gz	XHIRPGHISZERFW-MRXNPFEDSA-N	0	3	331.460	3.493	20	30		EGEDHN
CC[C@@H](C)CCC(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100780649	1364259139	/nfs/dbraw/zinc/25/91/39/1364259139.db2.gz	YUVIEBCCWGTOCA-PPDQVPDSSA-N	0	3	344.474	3.488	20	30		EGEDHN
O=C(CCc1ccccc1)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100911119	1364328094	/nfs/dbraw/zinc/32/80/94/1364328094.db2.gz	BIALVMBBSXKORT-UHFFFAOYSA-N	0	3	346.474	3.155	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)CCc2c[nH]c3ccccc23)C1	ZINC001100938897	1364338523	/nfs/dbraw/zinc/33/85/23/1364338523.db2.gz	BEDBCLJOBFMCCL-UHFFFAOYSA-N	0	3	345.874	3.337	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)CCCCCC)C1	ZINC001100941202	1364339808	/nfs/dbraw/zinc/33/98/08/1364339808.db2.gz	VLLDNIOEZACUCK-UHFFFAOYSA-N	0	3	331.298	3.350	20	30		EGEDHN
C=C(C)CN1CC[C@@H](Oc2ccnc(CNC(=O)CCCCC)c2)C1	ZINC001101091322	1364408920	/nfs/dbraw/zinc/40/89/20/1364408920.db2.gz	ZWRDXJLVLCPMHR-LJQANCHMSA-N	0	3	345.487	3.307	20	30		EGEDHN
C=CCN1CC[C@@H](Oc2ccnc(CNC(=O)C(C)(C)CCC)c2)C1	ZINC001101096955	1364412345	/nfs/dbraw/zinc/41/23/45/1364412345.db2.gz	GLZMMVPAOBITTR-GOSISDBHSA-N	0	3	345.487	3.163	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@@]2(C)C1	ZINC001101181685	1364449546	/nfs/dbraw/zinc/44/95/46/1364449546.db2.gz	CADBFNXHHWXESX-BSIFCXSSSA-N	0	3	339.483	3.275	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C/C=C/c3ccccc3F)C[C@]2(C)C1	ZINC001101279770	1364496708	/nfs/dbraw/zinc/49/67/08/1364496708.db2.gz	ZGRBSCUGLLMRQS-XDJBQHOISA-N	0	3	340.442	3.033	20	30		EGEDHN
C=CCCCC(=O)N1C[C@H]2CN(CCc3csc(C)n3)C[C@@]2(C)C1	ZINC001101347654	1364520440	/nfs/dbraw/zinc/52/04/40/1364520440.db2.gz	AWLFHMKRSFXWPY-APWZRJJASA-N	0	3	347.528	3.131	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C[C@H](CC)c3ccccc3)C[C@]2(C)C1	ZINC001101429048	1364560150	/nfs/dbraw/zinc/56/01/50/1364560150.db2.gz	YUSUMEDZHSIZGX-DWLFOUALSA-N	0	3	338.495	3.374	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1CC2(CN(CCC(C)C)C2)n2ccnc21	ZINC001101638043	1364664559	/nfs/dbraw/zinc/66/45/59/1364664559.db2.gz	UDMKGUUZEKQMHP-IAGOWNOFSA-N	0	3	344.503	3.103	20	30		EGEDHN
C=CC[C@H]1NC(=O)N(C[C@@H](c2cccs2)N2CCC(C)CC2)C1=O	ZINC001324607263	1387695474	/nfs/dbraw/zinc/69/54/74/1387695474.db2.gz	HAKJOAJRFTZQTO-CABCVRRESA-N	0	3	347.484	3.018	20	30		EGEDHN
CC(C)[C@H](C)CC(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001101808134	1364734693	/nfs/dbraw/zinc/73/46/93/1364734693.db2.gz	URFWTJBFEIHFOU-BZUAXINKSA-N	0	3	347.528	3.486	20	30		EGEDHN
CC(C)=C(F)C(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001101876384	1364761090	/nfs/dbraw/zinc/76/10/90/1364761090.db2.gz	ODUFURBXHKBLFA-CHWSQXEVSA-N	0	3	335.448	3.067	20	30		EGEDHN
CC[C@@H](C)CC(=O)NC[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1C	ZINC001101918685	1364774020	/nfs/dbraw/zinc/77/40/20/1364774020.db2.gz	ZIRWKACJZJNONQ-ZHALLVOQSA-N	0	3	344.474	3.298	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@@H]1CN(Cc2ccccc2Cl)C[C@H]1C	ZINC001101946834	1364786469	/nfs/dbraw/zinc/78/64/69/1364786469.db2.gz	LUDYQQGMCOCLJO-NVXWUHKLSA-N	0	3	332.875	3.184	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(F)cc2)C[C@H]1CNC(=O)C#CC(C)(C)C	ZINC001101954987	1364789766	/nfs/dbraw/zinc/78/97/66/1364789766.db2.gz	NFOVATOJUXYYLV-NVXWUHKLSA-N	0	3	330.447	3.059	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](NCc3ccc(C#N)s3)C2)CCC1	ZINC001185463688	1387721762	/nfs/dbraw/zinc/72/17/62/1387721762.db2.gz	XGWWKKISTWMRKZ-CQSZACIVSA-N	0	3	329.469	3.057	20	30		EGEDHN
CC[C@@H](C)C(=O)NCC[C@@H]1CN(Cc2cc(C#N)ccc2F)C[C@H]1C	ZINC001102680130	1365167235	/nfs/dbraw/zinc/16/72/35/1365167235.db2.gz	XIQQMKWAHDRNHI-BFYDXBDKSA-N	0	3	345.462	3.318	20	30		EGEDHN
CN(CCOC(=O)C1(c2cccc(C#N)c2)CC1)Cc1ccccc1	ZINC001324665341	1387723671	/nfs/dbraw/zinc/72/36/71/1387723671.db2.gz	KLAFXTVVUUDOKX-UHFFFAOYSA-N	0	3	334.419	3.265	20	30		EGEDHN
C=CCCC(=O)NCC[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1C	ZINC001102760364	1365206332	/nfs/dbraw/zinc/20/63/32/1365206332.db2.gz	RGTSXWNPTVXASR-CRAIPNDOSA-N	0	3	343.446	3.238	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CCNC(=O)C1CC=CC1	ZINC001102808606	1365229127	/nfs/dbraw/zinc/22/91/27/1365229127.db2.gz	RDJQYMCRPDEXTA-GDBMZVCRSA-N	0	3	343.496	3.160	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CCNC(=O)/C=C/C1CC1	ZINC001102822515	1365236273	/nfs/dbraw/zinc/23/62/73/1365236273.db2.gz	ONGRYNPMNUPYBL-JWLFTQPQSA-N	0	3	343.496	3.160	20	30		EGEDHN
C=C(C)CCC(=O)NCC[C@@H]1CN([C@@H](C)c2ncc(C)o2)C[C@H]1C	ZINC001103040437	1365351673	/nfs/dbraw/zinc/35/16/73/1365351673.db2.gz	WJHKLTPAORQQBE-HYVNUMGLSA-N	0	3	333.476	3.475	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2ccc(C)c(C)n2)C1	ZINC001103234261	1365447567	/nfs/dbraw/zinc/44/75/67/1365447567.db2.gz	JCXTXCCVGWWKMJ-CZUORRHYSA-N	0	3	335.879	3.139	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2nccc3occc32)C1	ZINC001103257373	1365459600	/nfs/dbraw/zinc/45/96/00/1365459600.db2.gz	UISBDRGIEPJMHX-TZMCWYRMSA-N	0	3	347.846	3.268	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCC[C@@H]1CN(Cc2cncs2)C[C@H]1C	ZINC001103344473	1365510316	/nfs/dbraw/zinc/51/03/16/1365510316.db2.gz	LFSMWNQQKCNTMT-ARFHVFGLSA-N	0	3	335.517	3.320	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCC[C@@H]1CN(Cc2ccc(F)cn2)C[C@H]1C	ZINC001103346336	1365510647	/nfs/dbraw/zinc/51/06/47/1365510647.db2.gz	ICGXFPXESOFENL-BRWVUGGUSA-N	0	3	347.478	3.397	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCC[C@@H]1CN(Cc2ccc(F)cn2)C[C@H]1C	ZINC001103344893	1365510942	/nfs/dbraw/zinc/51/09/42/1365510942.db2.gz	UVKVHUSJLVSUBJ-BRWVUGGUSA-N	0	3	347.478	3.397	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCC[C@@H]1CN(Cc2cc(C)no2)C[C@H]1C	ZINC001103344875	1365511291	/nfs/dbraw/zinc/51/12/91/1365511291.db2.gz	UKKPZEVMOMUIHU-BFYDXBDKSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C1CCC(C(=O)NCC[C@@H]2CN(Cc3cnc(C)o3)C[C@H]2C)CC1	ZINC001103401739	1365537408	/nfs/dbraw/zinc/53/74/08/1365537408.db2.gz	LXQRWKRZWCWEPE-CRAIPNDOSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC[C@@H]2CN(Cc3ccc(F)cn3)C[C@H]2C)C1	ZINC001103418713	1365549533	/nfs/dbraw/zinc/54/95/33/1365549533.db2.gz	VUHZMHFKVXCSOH-HZPDHXFCSA-N	0	3	345.462	3.151	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2=CCCC2)C[C@H]1CCNCc1ccccc1C#N	ZINC001104067274	1365897879	/nfs/dbraw/zinc/89/78/79/1365897879.db2.gz	PBCFLIYHSIWHLO-OXQOHEQNSA-N	0	3	337.467	3.243	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H](C)[C@H](CCNCc2cnc(C)o2)C1	ZINC001104231942	1365961709	/nfs/dbraw/zinc/96/17/09/1365961709.db2.gz	ZJLUQMCXLFMRKT-CRAIPNDOSA-N	0	3	345.487	3.326	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)[C@@H](C)C(F)(F)F)C[C@H]1C	ZINC001104511059	1366055522	/nfs/dbraw/zinc/05/55/22/1366055522.db2.gz	CLYZBGOJZKLLCF-YUSALJHKSA-N	0	3	326.790	3.012	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@@H](C)[C@H](CCNCc2ccc(F)cn2)C1	ZINC001104561886	1366076882	/nfs/dbraw/zinc/07/68/82/1366076882.db2.gz	BAFSRYIQAQUYLL-IXDOHACOSA-N	0	3	347.478	3.397	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)CCCc2cccnc2)C[C@H]1C	ZINC001104846807	1366197918	/nfs/dbraw/zinc/19/79/18/1366197918.db2.gz	KQGCFTCYZLTMIZ-CRAIPNDOSA-N	0	3	349.906	3.231	20	30		EGEDHN
C=CCCC(=O)N1CCCC[C@H]1C1(CNCc2ccn(C)n2)CCC1	ZINC001105522802	1366507685	/nfs/dbraw/zinc/50/76/85/1366507685.db2.gz	ONJVBALIOSZYEN-SFHVURJKSA-N	0	3	344.503	3.027	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H](CNCc2csc(C)n2)[C@H](C)C1	ZINC001106174060	1366616470	/nfs/dbraw/zinc/61/64/70/1366616470.db2.gz	TTWLVLQABNUJOA-RHSMWYFYSA-N	0	3	347.528	3.404	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)CC3(C=C)CCCCC3)[C@@H]2C1	ZINC001189406005	1367012402	/nfs/dbraw/zinc/01/24/02/1367012402.db2.gz	FYQCDUFAWWXOSY-RBUKOAKNSA-N	0	3	346.515	3.248	20	30		EGEDHN
Cc1cc(C)c(CN2[C@@H]3CC[C@H]2[C@@H](NC(=O)C#CC(C)C)C3)c(C)c1	ZINC001109246380	1367024204	/nfs/dbraw/zinc/02/42/04/1367024204.db2.gz	XHAXXHOTJBJCRY-GIVPXCGWSA-N	0	3	338.495	3.493	20	30		EGEDHN
O=C(C#CC1CC1)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccc2ccccc2c1	ZINC001109259460	1367030900	/nfs/dbraw/zinc/03/09/00/1367030900.db2.gz	DKJSNSGQXDKNLQ-FSSWDIPSSA-N	0	3	344.458	3.475	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)[C@H]3CC[C@H](C(C)C)CC3)[C@@H]2C1	ZINC001189530838	1367045832	/nfs/dbraw/zinc/04/58/32/1367045832.db2.gz	QZYJFBNMWVAQQI-LWYYNNOASA-N	0	3	348.531	3.184	20	30		EGEDHN
C=CCOCCCC(=O)N1CC[C@@H](N(C)Cc2cc(F)ccc2C)C1	ZINC001189565379	1367054944	/nfs/dbraw/zinc/05/49/44/1367054944.db2.gz	QDPGRHIVXASRBB-LJQANCHMSA-N	0	3	348.462	3.150	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2C[C@@H]1CC(C)(C)CO1	ZINC001109343218	1367070626	/nfs/dbraw/zinc/07/06/26/1367070626.db2.gz	OCGJRTKAVVXRGP-QZWWFDLISA-N	0	3	334.504	3.125	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2ccc(C)s2)C1	ZINC001107698341	1367107029	/nfs/dbraw/zinc/10/70/29/1367107029.db2.gz	OOYWPMIOIBJNBD-KSSFIOAISA-N	0	3	336.501	3.232	20	30		EGEDHN
COCC#CCN[C@@H]1CCN(C(=O)[C@@H](CC2CCCCC2)C(C)C)C1	ZINC001186042153	1387853513	/nfs/dbraw/zinc/85/35/13/1387853513.db2.gz	UGCMYMSXEJNXSU-UXHICEINSA-N	0	3	348.531	3.069	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](N(C)[C@H](C)c2ccc(F)c(F)c2)C1	ZINC001189925983	1367132126	/nfs/dbraw/zinc/13/21/26/1367132126.db2.gz	JLJQFYDBUASGRQ-GDBMZVCRSA-N	0	3	334.410	3.362	20	30		EGEDHN
C[C@H](c1ccc(F)cc1)N(C)[C@@H]1CCN(C(=O)C#CC(C)(C)C)C1	ZINC001190085278	1367169557	/nfs/dbraw/zinc/16/95/57/1367169557.db2.gz	WJLHTHLLRLPRBT-CRAIPNDOSA-N	0	3	330.447	3.469	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2oc(C)cc2C)C1	ZINC001107853162	1367176411	/nfs/dbraw/zinc/17/64/11/1367176411.db2.gz	MTQNCLQKDGKPPE-HNAYVOBHSA-N	0	3	334.460	3.072	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)CC(C)(C)C2CC2)C1	ZINC001107922018	1367202817	/nfs/dbraw/zinc/20/28/17/1367202817.db2.gz	KLTRHWIKLHXWMD-UZLBHIALSA-N	0	3	336.520	3.375	20	30		EGEDHN
CC(C)(C)C#CC(=O)NC[C@]1(C)CN(CC2CCCCCC2)CCO1	ZINC001107934505	1367210627	/nfs/dbraw/zinc/21/06/27/1367210627.db2.gz	DFCUUONFJWHPAV-OAQYLSRUSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)C(C)(C)CC(F)F)C1	ZINC001107988869	1367231830	/nfs/dbraw/zinc/23/18/30/1367231830.db2.gz	KYJWJHVXNDLZKQ-KSSFIOAISA-N	0	3	346.462	3.230	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CC1CC(F)(F)C1	ZINC001109633141	1367252467	/nfs/dbraw/zinc/25/24/67/1367252467.db2.gz	PYAIREAYRRMXEL-OJLVUWQFSA-N	0	3	326.431	3.356	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2c(C)oc(C)c2C)C1	ZINC001108061049	1367263217	/nfs/dbraw/zinc/26/32/17/1367263217.db2.gz	FOUXHZUEEJDBOY-JLTOFOAXSA-N	0	3	348.487	3.380	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CC1CC(F)(F)C1	ZINC001109677042	1367276757	/nfs/dbraw/zinc/27/67/57/1367276757.db2.gz	GMKWJBIZQOIJQI-WBTNSWJXSA-N	0	3	326.431	3.356	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@]1(C)CN(C[C@H](C)CC(C)C)CCO1	ZINC001108144165	1367306716	/nfs/dbraw/zinc/30/67/16/1367306716.db2.gz	LLHABBZGWKXMEX-QUCCMNQESA-N	0	3	336.520	3.069	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@]1(C)CN(CC2CC(C)(C)C2)CCO1	ZINC001108147680	1367309784	/nfs/dbraw/zinc/30/97/84/1367309784.db2.gz	BZDWOJLZGPGVTL-OXQOHEQNSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2ccc(F)c(C)c2)C1	ZINC001108172534	1367321810	/nfs/dbraw/zinc/32/18/10/1367321810.db2.gz	FAFYAOZBTIINBT-UZLBHIALSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@]2(C)CN(CCC(C)(C)C)CCO2)CC1	ZINC001108186572	1367330343	/nfs/dbraw/zinc/33/03/43/1367330343.db2.gz	QWNWIAJLLZFHCT-HXUWFJFHSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2cc(C)cc(C)c2)C1	ZINC001108365460	1367414179	/nfs/dbraw/zinc/41/41/79/1367414179.db2.gz	KCTQDBGHVSQXIJ-WIYYLYMNSA-N	0	3	344.499	3.479	20	30		EGEDHN
C=C[C@@H](CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCOCC)c1ccccc1	ZINC001110134984	1367518268	/nfs/dbraw/zinc/51/82/68/1367518268.db2.gz	GUXJJTHDXUNGAU-RNQOJCNYSA-N	0	3	342.483	3.104	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](N(C)CCOc2cccc(C)c2)C1	ZINC001191727091	1367571825	/nfs/dbraw/zinc/57/18/25/1367571825.db2.gz	FUHGQTCAVHWFBT-KRWDZBQOSA-N	0	3	330.472	3.119	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](N(C)CCc2ccccc2F)C1	ZINC001191859554	1367617438	/nfs/dbraw/zinc/61/74/38/1367617438.db2.gz	NDJYAMUCSKJCOS-SFHVURJKSA-N	0	3	330.447	3.095	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@@H](N(C)Cc2cccc(OC)c2)C1	ZINC001191867718	1367621021	/nfs/dbraw/zinc/62/10/21/1367621021.db2.gz	HFCRNEJHAWTLQA-SJLPKXTDSA-N	0	3	330.472	3.330	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@@H](N(C)Cc2ccc(OC)cc2)C1	ZINC001191913286	1367637546	/nfs/dbraw/zinc/63/75/46/1367637546.db2.gz	VRCGZSQLFDLLPN-SJLPKXTDSA-N	0	3	330.472	3.330	20	30		EGEDHN
C=CCCCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1c(C)noc1C)C2	ZINC001108913665	1367661318	/nfs/dbraw/zinc/66/13/18/1367661318.db2.gz	SUHSJLZVNOEUMQ-IKGGRYGDSA-N	0	3	331.460	3.373	20	30		EGEDHN
C=CCOCCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1cccc(C)c1	ZINC001110424340	1367708817	/nfs/dbraw/zinc/70/88/17/1367708817.db2.gz	MDCZEBWSHPGYAT-AQNXPRMDSA-N	0	3	342.483	3.199	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)CC[C@@H](C)c2ccccc2)C1	ZINC001192687793	1367851288	/nfs/dbraw/zinc/85/12/88/1367851288.db2.gz	LTKMWIKFATVKPZ-UYAOXDASSA-N	0	3	344.499	3.306	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2C[C@@H](OC)c1ccccc1	ZINC001110610633	1367871538	/nfs/dbraw/zinc/87/15/38/1367871538.db2.gz	LIKQJFGAUUIDCN-YSTOQKLRSA-N	0	3	342.483	3.452	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCOc1c(C)cccc1C)C2	ZINC001110626719	1367875037	/nfs/dbraw/zinc/87/50/37/1367875037.db2.gz	NKEHKMPGHKFWHV-QRVBRYPASA-N	0	3	342.483	3.370	20	30		EGEDHN
C=CCCCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ncc(F)cc1F)C2	ZINC001110723619	1367950305	/nfs/dbraw/zinc/95/03/05/1367950305.db2.gz	QOPFXSHYNQACBD-OIISXLGYSA-N	0	3	349.425	3.441	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc3ncccc3o1)C2	ZINC001110826238	1368011546	/nfs/dbraw/zinc/01/15/46/1368011546.db2.gz	BAZBQGRRDLGOHA-FMKPAKJESA-N	0	3	325.412	3.129	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)C2(C3CCCCC3)CC2)C1	ZINC001193704592	1368099440	/nfs/dbraw/zinc/09/94/40/1368099440.db2.gz	HKDXYHIPHKUBMI-GOSISDBHSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCOCCC(C)C	ZINC001110934509	1368104910	/nfs/dbraw/zinc/10/49/10/1368104910.db2.gz	GGAYIIZVVVNFDB-MKXGPGLRSA-N	0	3	336.520	3.373	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](C)CC1CCCC1)C2	ZINC001111097355	1368158835	/nfs/dbraw/zinc/15/88/35/1368158835.db2.gz	VCWAEOMMLGAIGR-OWYHZJEWSA-N	0	3	334.504	3.127	20	30		EGEDHN
C=CC1(CC(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3CCOCC)CCCCC1	ZINC001111135128	1368162959	/nfs/dbraw/zinc/16/29/59/1368162959.db2.gz	CEIMHCMJJRQSPS-KURKYZTESA-N	0	3	334.504	3.271	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)C/C=C/c2ccc(C)cc2)C1	ZINC001194590043	1368292522	/nfs/dbraw/zinc/29/25/22/1368292522.db2.gz	CZPNXTKVPHWIKJ-XJDXJNMNSA-N	0	3	342.483	3.134	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](C)Cc1ccc(OC)cc1)C2	ZINC001111435522	1368306586	/nfs/dbraw/zinc/30/65/86/1368306586.db2.gz	RGPAKJUQVDUJJY-ZSXHRAQDSA-N	0	3	342.483	3.171	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H](CCC)C(C)C)C[C@H](C)O2	ZINC001111551171	1368342930	/nfs/dbraw/zinc/34/29/30/1368342930.db2.gz	SSCGNIYLSDFZJQ-ROUUACIJSA-N	0	3	336.520	3.327	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H](CCC)C(C)C)C[C@H](C)O2	ZINC001111551172	1368343295	/nfs/dbraw/zinc/34/32/95/1368343295.db2.gz	SSCGNIYLSDFZJQ-ZWKOTPCHSA-N	0	3	336.520	3.327	20	30		EGEDHN
C=CCCC(=O)N[C@]12CCC[C@H]1CN(CCOc1cccc(F)c1)C2	ZINC001111649028	1368411318	/nfs/dbraw/zinc/41/13/18/1368411318.db2.gz	ZVNRKFOSXPYWMJ-JXFKEZNVSA-N	0	3	346.446	3.141	20	30		EGEDHN
CC(C)CCOCCN1C[C@@H]2CCC[C@]2(NC(=O)C#CC(C)(C)C)C1	ZINC001111738085	1368436202	/nfs/dbraw/zinc/43/62/02/1368436202.db2.gz	XSDWXWWQFBMIIK-RXVVDRJESA-N	0	3	348.531	3.069	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)C/C=C\c2ccc(F)cc2)C1	ZINC001111788466	1368462756	/nfs/dbraw/zinc/46/27/56/1368462756.db2.gz	CXTHBTFNDBUTPZ-JATIFAPOSA-N	0	3	340.442	3.223	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)CCc2ccc(Cl)cc2)C1	ZINC001111822577	1368483164	/nfs/dbraw/zinc/48/31/64/1368483164.db2.gz	FXZNMKFORBGRGS-PXNSSMCTSA-N	0	3	344.886	3.267	20	30		EGEDHN
CC#CCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(C#N)cc1)C2	ZINC001111846161	1368500400	/nfs/dbraw/zinc/50/04/00/1368500400.db2.gz	SRRRHWCRPMFOBZ-UNMCSNQZSA-N	0	3	349.478	3.223	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1CN(CCC2CCCCCC2)C[C@H]1O	ZINC001195923502	1368517417	/nfs/dbraw/zinc/51/74/17/1368517417.db2.gz	DINDVXLTGVLXQU-QWFCFKBJSA-N	0	3	336.520	3.111	20	30		EGEDHN
C#CCN1C[C@@H]2CCC[C@]2(NC(=O)C[C@H](CC)c2ccc(C)cc2)C1	ZINC001111870842	1368518509	/nfs/dbraw/zinc/51/85/09/1368518509.db2.gz	PNJMXTMHJCZYHP-VCOUNFBDSA-N	0	3	338.495	3.483	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCCN(C[C@H](O)C2CCCCC2)CC1	ZINC001195966733	1368524905	/nfs/dbraw/zinc/52/49/05/1368524905.db2.gz	UXMNUGOAYGSGMJ-FQEVSTJZSA-N	0	3	348.531	3.230	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2ccc(-c3ccncc3)o2)CC1	ZINC001196163451	1368559482	/nfs/dbraw/zinc/55/94/82/1368559482.db2.gz	OJSDBZAJGXHTMY-UHFFFAOYSA-N	0	3	339.439	3.456	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)CCCc2sccc2C)C1	ZINC001111958824	1368573928	/nfs/dbraw/zinc/57/39/28/1368573928.db2.gz	SNIIFTUUOTYQTH-PXNSSMCTSA-N	0	3	344.524	3.373	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cnc3ccccn23)CC1	ZINC001196366896	1368598227	/nfs/dbraw/zinc/59/82/27/1368598227.db2.gz	QPWYMJVKFZRJJS-UHFFFAOYSA-N	0	3	340.471	3.229	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@H]2[C@@H]3CCCCCC[C@@H]32)C1	ZINC001196408319	1368609026	/nfs/dbraw/zinc/60/90/26/1368609026.db2.gz	ZTYCAYLAHROUNJ-IVDHNXQLSA-N	0	3	348.531	3.111	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cc(CC)nnc2C)CC1	ZINC001196620179	1368651281	/nfs/dbraw/zinc/65/12/81/1368651281.db2.gz	UZPIGYVHVMZVML-UHFFFAOYSA-N	0	3	344.503	3.242	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2cnn(C(C)C)c2Cl)CC1	ZINC001196665859	1368658387	/nfs/dbraw/zinc/65/83/87/1368658387.db2.gz	IQNCKVHTWFHVDA-UHFFFAOYSA-N	0	3	338.883	3.232	20	30		EGEDHN
C#CCCCCCC(=O)N1CCCN(CCc2cccs2)CC1	ZINC001196754034	1368676303	/nfs/dbraw/zinc/67/63/03/1368676303.db2.gz	QPIYVBWIIRTQFZ-UHFFFAOYSA-N	0	3	332.513	3.409	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)N1CCCN(CCc2ccc(OC)cc2)CC1	ZINC001196830161	1368692496	/nfs/dbraw/zinc/69/24/96/1368692496.db2.gz	ISRILFCQSLIJBB-ROUUACIJSA-N	0	3	344.499	3.230	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)N1CCCN(CCCOc2ccccc2)CC1	ZINC001196829682	1368692789	/nfs/dbraw/zinc/69/27/89/1368692789.db2.gz	HIRIQBXBEXQJSG-RTBURBONSA-N	0	3	344.499	3.448	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)[C@@H](CCCC)C(C)C)C[C@H]1C(F)(F)F	ZINC001112213269	1368721917	/nfs/dbraw/zinc/72/19/17/1368721917.db2.gz	IDCHUBBYKDGBPK-ARFHVFGLSA-N	0	3	346.437	3.451	20	30		EGEDHN
C=CCC1(C(=O)N2CCCN(CCC[C@H]3CCOC3)CC2)CCC1	ZINC001197077674	1368742392	/nfs/dbraw/zinc/74/23/92/1368742392.db2.gz	VWZZVTTZERWYSP-SFHVURJKSA-N	0	3	334.504	3.084	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H]2CCC[C@]2(CNCc2ccn(C(C)C)n2)C1	ZINC001112282554	1368747834	/nfs/dbraw/zinc/74/78/34/1368747834.db2.gz	DWOFJOQFNNSJHJ-PXNSSMCTSA-N	0	3	344.503	3.149	20	30		EGEDHN
C#CCOc1ccc(C(=O)N2CCCN(CC/C=C\CC)CC2)cc1	ZINC001197369862	1368799757	/nfs/dbraw/zinc/79/97/57/1368799757.db2.gz	MIJKLTJQHJWNIX-WAYWQWQTSA-N	0	3	340.467	3.203	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@@H](F)CCCCCC)C1	ZINC001197776380	1368893797	/nfs/dbraw/zinc/89/37/97/1368893797.db2.gz	UUURTQGFJZVANC-RCCFBDPRSA-N	0	3	342.499	3.203	20	30		EGEDHN
C=CCC[C@@H](C)N1CCCN(C(=O)c2cc3c(s2)CCOC3)CC1	ZINC001197849533	1368912281	/nfs/dbraw/zinc/91/22/81/1368912281.db2.gz	JZCCVINNJNNTET-OAHLLOKOSA-N	0	3	348.512	3.323	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cn3ccccc3n2)CC1	ZINC001198015395	1368942626	/nfs/dbraw/zinc/94/26/26/1368942626.db2.gz	FTDAURQTXUQCJS-UHFFFAOYSA-N	0	3	340.471	3.229	20	30		EGEDHN
C=CCC1(C(=O)N2CCCN(CCCOCC)CC2)CCCCC1	ZINC001198221638	1368983406	/nfs/dbraw/zinc/98/34/06/1368983406.db2.gz	LACOINBBKVEMOY-UHFFFAOYSA-N	0	3	336.520	3.474	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cnn(C)c2C2CC2)CC1	ZINC001198372708	1369018574	/nfs/dbraw/zinc/01/85/74/1369018574.db2.gz	HYFLJDNHUVCFAH-UHFFFAOYSA-N	0	3	344.503	3.192	20	30		EGEDHN
C=CCCCCCN1CCN(C(=O)c2cnc(CC(C)C)[nH]2)CC1	ZINC001112852203	1369047325	/nfs/dbraw/zinc/04/73/25/1369047325.db2.gz	UZIIPKLRXVXJTB-UHFFFAOYSA-N	0	3	332.492	3.112	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)c1cc(C)no1)c1ccccc1OC	ZINC001198522804	1369052728	/nfs/dbraw/zinc/05/27/28/1369052728.db2.gz	QTUVNDJXFXZPFZ-MRXNPFEDSA-N	0	3	343.427	3.019	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@@H](C)OCCCC)c1ccccc1OC	ZINC001198595393	1369068508	/nfs/dbraw/zinc/06/85/08/1369068508.db2.gz	LESVDBUIWKGBFT-SJLPKXTDSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)COC(C)(C)C)c1ccccc1OC	ZINC001198677789	1369089385	/nfs/dbraw/zinc/08/93/85/1369089385.db2.gz	SVJCKWZARSPUNT-KRWDZBQOSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCC[C@@H](C)N[C@H](CNC(=O)C#CC1CC1)c1ccccc1OC	ZINC001198723846	1369099242	/nfs/dbraw/zinc/09/92/42/1369099242.db2.gz	LJBZOOOXUJLZPY-VQIMIIECSA-N	0	3	340.467	3.210	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@@H](NCC1CC1)c1ccccc1OC	ZINC001198743437	1369103981	/nfs/dbraw/zinc/10/39/81/1369103981.db2.gz	ZGYPNKCYPCTPKJ-QGZVFWFLSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@@H](NCCCF)c1ccccc1OC	ZINC001198857503	1369131424	/nfs/dbraw/zinc/13/14/24/1369131424.db2.gz	QMICKAYOXIMFPM-NVXWUHKLSA-N	0	3	336.451	3.404	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)[C@@H](OC)C(C)C)c1ccccc1OC	ZINC001198876292	1369137131	/nfs/dbraw/zinc/13/71/31/1369137131.db2.gz	QHQDZVUYODVTSV-MJGOQNOKSA-N	0	3	348.487	3.079	20	30		EGEDHN
CCCCCCCC[C@@H](C)C(=O)N[C@@H]1CN(CCCC)C[C@H]1O	ZINC001198904167	1369144717	/nfs/dbraw/zinc/14/47/17/1369144717.db2.gz	BNIBLVRWDCLICX-KZNAEPCWSA-N	0	3	326.525	3.335	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)[C@@H]1CC12CC2)c1ccccc1OC	ZINC001198916862	1369148413	/nfs/dbraw/zinc/14/84/13/1369148413.db2.gz	VPUJBXIVVCMNEA-DLBZAZTESA-N	0	3	328.456	3.208	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)[C@@H]1C[C@H]1C1CC1)c1ccccc1OC	ZINC001198931926	1369151870	/nfs/dbraw/zinc/15/18/70/1369151870.db2.gz	GRYYLLNWSVWALC-IPMKNSEASA-N	0	3	342.483	3.454	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H](O)[C@H](NC(=O)c2ccc(C(C)C)s2)C1	ZINC001199211106	1369192006	/nfs/dbraw/zinc/19/20/06/1369192006.db2.gz	UDPNDNZFYBUATP-RBSFLKMASA-N	0	3	336.501	3.001	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)CCc2cccc(OC)c2)CC1	ZINC001113094435	1369198435	/nfs/dbraw/zinc/19/84/35/1369198435.db2.gz	VGPIXPUIDHUWTE-KRWDZBQOSA-N	0	3	330.472	3.127	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)Cc2cccc3ncccc23)CC1	ZINC001113095637	1369198751	/nfs/dbraw/zinc/19/87/51/1369198751.db2.gz	WWXMBBJQOKPXBW-QGZVFWFLSA-N	0	3	337.467	3.276	20	30		EGEDHN
CC(C)[C@@H](C)CC(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001199742063	1369265687	/nfs/dbraw/zinc/26/56/87/1369265687.db2.gz	SFJQIJKQKXWLMU-INIZCTEOSA-N	0	3	327.472	3.321	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)c2ccc(F)c3ccncc23)CC1	ZINC001113246238	1369289088	/nfs/dbraw/zinc/28/90/88/1369289088.db2.gz	JYHYEIDBXOAGAM-HNNXBMFYSA-N	0	3	341.430	3.486	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)CCCOCc2ccccc2)CC1	ZINC001113279707	1369313365	/nfs/dbraw/zinc/31/33/65/1369313365.db2.gz	CFYHFXMQHUBZHB-IBGZPJMESA-N	0	3	344.499	3.482	20	30		EGEDHN
C=CCCC(=O)N1CCCO[C@@H](CN[C@H](C)c2ccccc2F)C1	ZINC001200101271	1369315488	/nfs/dbraw/zinc/31/54/88/1369315488.db2.gz	TWLOKRJURXDVGE-CVEARBPZSA-N	0	3	334.435	3.060	20	30		EGEDHN
CC/C(C)=C/C(=O)N1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001200406594	1369361938	/nfs/dbraw/zinc/36/19/38/1369361938.db2.gz	USSDDLGOXCXTEB-GXDHUFHOSA-N	0	3	329.419	3.134	20	30		EGEDHN
N#Cc1ccc(NC(=S)NCCN2CCCCC2)c(F)c1Cl	ZINC001200432405	1369367029	/nfs/dbraw/zinc/36/70/29/1369367029.db2.gz	KWYHVHJFZSHJTD-UHFFFAOYSA-N	0	3	340.855	3.123	20	30		EGEDHN
CCCc1nc(C)c(CNC2CCN(C(=O)C#CC(C)(C)C)CC2)o1	ZINC001200461464	1369373857	/nfs/dbraw/zinc/37/38/57/1369373857.db2.gz	CYLOOOBHPHLLFU-UHFFFAOYSA-N	0	3	345.487	3.066	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)Cc2csc(C3CC3)n2)CC1	ZINC001113405882	1369403952	/nfs/dbraw/zinc/40/39/52/1369403952.db2.gz	HTMMAAFBEXHMJH-CQSZACIVSA-N	0	3	333.501	3.062	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N1CCN(C[C@@H](C)CC(C)C)CC1	ZINC001113417776	1369412623	/nfs/dbraw/zinc/41/26/23/1369412623.db2.gz	USLYNDBBOOLTFG-FHWLQOOXSA-N	0	3	336.520	3.184	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001200747703	1369422311	/nfs/dbraw/zinc/42/23/11/1369422311.db2.gz	NQKXOLFOSSHFPE-UHFFFAOYSA-N	0	3	337.467	3.407	20	30		EGEDHN
C=CCCCCCN1CCN(C(=O)c2ccccc2CN(C)C)CC1	ZINC001113680191	1369562653	/nfs/dbraw/zinc/56/26/53/1369562653.db2.gz	AFBWVXXISQMLAU-UHFFFAOYSA-N	0	3	343.515	3.252	20	30		EGEDHN
C#CCNC[C@H]1CN(C(=O)[C@H](CC2CCCCC2)C(C)C)CCCO1	ZINC001201546137	1369570975	/nfs/dbraw/zinc/57/09/75/1369570975.db2.gz	GDTIGOSCAJXQGC-VQTJNVASSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)c2ccc(CN(CC)CC)o2)CC1	ZINC001113717195	1369584095	/nfs/dbraw/zinc/58/40/95/1369584095.db2.gz	QSYQDTJEKHJSCP-KRWDZBQOSA-N	0	3	347.503	3.234	20	30		EGEDHN
CCCCCCCCCCS(=O)(=O)NC[C@H]1CCCN(C)C1	ZINC001201838736	1369632510	/nfs/dbraw/zinc/63/25/10/1369632510.db2.gz	NQWIGQRUNDFOIN-QGZVFWFLSA-N	0	3	332.554	3.388	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC(NCC(=C)Br)CC1	ZINC001201991169	1369661502	/nfs/dbraw/zinc/66/15/02/1369661502.db2.gz	SESZBAQPZUGORI-UHFFFAOYSA-N	0	3	341.293	3.059	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC(NCc2ccn(C(C)C)n2)CC1	ZINC001202004253	1369664624	/nfs/dbraw/zinc/66/46/24/1369664624.db2.gz	INBYICYHKTYNTJ-UHFFFAOYSA-N	0	3	344.503	3.128	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)N1CCC(NCc2ccn(C(C)C)n2)CC1	ZINC001202085566	1369685214	/nfs/dbraw/zinc/68/52/14/1369685214.db2.gz	VYUHIHGQWKVJBK-CVEARBPZSA-N	0	3	332.492	3.003	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)N1CCC(NCc2nc3ccccc3o2)CC1	ZINC001202092061	1369685563	/nfs/dbraw/zinc/68/55/63/1369685563.db2.gz	GZXCVHKZIOGKNT-GJZGRUSLSA-N	0	3	341.455	3.367	20	30		EGEDHN
CC#CCCCC(=O)N1CCC(NCc2cc(O)ccc2Cl)CC1	ZINC001202101187	1369687712	/nfs/dbraw/zinc/68/77/12/1369687712.db2.gz	KHYQBXIUOVASLU-UHFFFAOYSA-N	0	3	348.874	3.320	20	30		EGEDHN
C#CCNC[C@H]1CN(C(=O)[C@](C)(CC)CCCCCC)CCCO1	ZINC001202107994	1369688888	/nfs/dbraw/zinc/68/88/88/1369688888.db2.gz	DOBVDTYGXGLQBQ-AZUAARDMSA-N	0	3	336.520	3.213	20	30		EGEDHN
C=CCOC(=O)N1CCCC2(CCN(CCC(F)(F)F)CC2)C1	ZINC001202283127	1369729330	/nfs/dbraw/zinc/72/93/30/1369729330.db2.gz	DHHXNWFBJKNCKI-UHFFFAOYSA-N	0	3	334.382	3.439	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C(F)F)cc3)C[C@H]21	ZINC001114255965	1369831849	/nfs/dbraw/zinc/83/18/49/1369831849.db2.gz	RGRXGXQTRTUKPI-VQFNDLOPSA-N	0	3	346.421	3.220	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C4CC4)cc3)C[C@H]21	ZINC001114256350	1369831887	/nfs/dbraw/zinc/83/18/87/1369831887.db2.gz	YXEDIHJKRZTSDI-KXTWHKPSSA-N	0	3	336.479	3.160	20	30		EGEDHN
N#Cc1cccc(NC(=O)N2CC[C@H]3CN(Cc4ccccc4)C[C@H]32)c1	ZINC001202788409	1369892251	/nfs/dbraw/zinc/89/22/51/1369892251.db2.gz	NWQSUEUGKSVNPV-AZUAARDMSA-N	0	3	346.434	3.296	20	30		EGEDHN
CN1CCC(N(C(=O)Nc2cccc(C#N)c2)C2CCCC2)CC1	ZINC001202787949	1369892398	/nfs/dbraw/zinc/89/23/98/1369892398.db2.gz	WSTZKANFAOPAID-UHFFFAOYSA-N	0	3	326.444	3.429	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H]1C[C@H](NCc2cc(F)ccc2F)C12CCC2	ZINC001202867366	1369912081	/nfs/dbraw/zinc/91/20/81/1369912081.db2.gz	QHZRAADQTZTYTA-ROUUACIJSA-N	0	3	346.421	3.141	20	30		EGEDHN
O=C(N[C@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2)C1(C2CC2)CC1	ZINC001203050909	1369967011	/nfs/dbraw/zinc/96/70/11/1369967011.db2.gz	HFBSBJYFLHCWGA-PMACEKPBSA-N	0	3	348.490	3.245	20	30		EGEDHN
CCC[C@H](CC)C(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001203099546	1369982452	/nfs/dbraw/zinc/98/24/52/1369982452.db2.gz	LOMFCBDTNSBVHP-INIZCTEOSA-N	0	3	327.472	3.465	20	30		EGEDHN
C=C(Br)CNC1CCN(C(=O)[C@H](C)CC(C)C)CC1	ZINC001203107315	1369985325	/nfs/dbraw/zinc/98/53/25/1369985325.db2.gz	DMMVCJJDWRIXLU-GFCCVEGCSA-N	0	3	331.298	3.158	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1C[C@H](NCc2cncs2)C12CCC2	ZINC001203294555	1370066414	/nfs/dbraw/zinc/06/64/14/1370066414.db2.gz	CZOQLHVTDLDLHL-DLBZAZTESA-N	0	3	345.512	3.244	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1C[C@H](NCc2cnoc2C)C12CCC2	ZINC001203295825	1370068383	/nfs/dbraw/zinc/06/83/83/1370068383.db2.gz	NGQOYOONTXUDLO-ZWKOTPCHSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@@H](NC(=O)C2(CC)CC2)C12CCC2	ZINC001203359471	1370097469	/nfs/dbraw/zinc/09/74/69/1370097469.db2.gz	SPKVBFCIFUEOSQ-CHWSQXEVSA-N	0	3	341.293	3.102	20	30		EGEDHN
O=C(N[C@@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2)C1CC2(CC2)C1	ZINC001203402615	1370113642	/nfs/dbraw/zinc/11/36/42/1370113642.db2.gz	IQRJSJSNWRWPPN-WOJBJXKFSA-N	0	3	348.490	3.245	20	30		EGEDHN
C=CC1(CC(=O)N[C@@H]2[C@H]3CN(CCOCC(C)C)C[C@H]32)CCCCC1	ZINC001114966083	1370181837	/nfs/dbraw/zinc/18/18/37/1370181837.db2.gz	WJIGXQUCTZVPDW-RUYXUALKSA-N	0	3	348.531	3.232	20	30		EGEDHN
CN1C(=O)C2(CCN(Cc3ccc(C#N)cc3)CC2)[C@H]1c1ccccc1	ZINC001203901495	1370307193	/nfs/dbraw/zinc/30/71/93/1370307193.db2.gz	OFTMTMHHZYOUDG-HXUWFJFHSA-N	0	3	345.446	3.354	20	30		EGEDHN
CCCCCCCCOc1ccc(CN2C[C@H](O)[C@@H](CO)C2)cc1	ZINC001204311960	1370440259	/nfs/dbraw/zinc/44/02/59/1370440259.db2.gz	NAFXEBDNUGRXTE-QUCCMNQESA-N	0	3	335.488	3.211	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NCC1(NCC(=C)Cl)CCCCC1	ZINC001115438195	1370452720	/nfs/dbraw/zinc/45/27/20/1370452720.db2.gz	WJDWIFZJCCAYGC-OAHLLOKOSA-N	0	3	328.884	3.129	20	30		EGEDHN
Cc1cc[nH]c1C(=O)NCC1(NCC#Cc2ccccc2)CCCCC1	ZINC001115512597	1370511097	/nfs/dbraw/zinc/51/10/97/1370511097.db2.gz	RGNNUXDMOBQHKA-UHFFFAOYSA-N	0	3	349.478	3.397	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CCc2ccncc2)CCCCC1	ZINC001115611421	1370610848	/nfs/dbraw/zinc/61/08/48/1370610848.db2.gz	HJGGENLDLDZXFC-UHFFFAOYSA-N	0	3	335.879	3.175	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cccc3c[nH]nc32)CCCCC1	ZINC001115658714	1370644003	/nfs/dbraw/zinc/64/40/03/1370644003.db2.gz	GAFBHLOLGCPAMJ-UHFFFAOYSA-N	0	3	346.862	3.338	20	30		EGEDHN
C#CCCCC(=O)N1CCC(CNCc2oc(CCC)nc2C)CC1	ZINC001205131343	1370659729	/nfs/dbraw/zinc/65/97/29/1370659729.db2.gz	DYKYKTZCROVYBF-UHFFFAOYSA-N	0	3	345.487	3.067	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCC1(NCc2cnc(C)cn2)CCCCC1	ZINC001115684962	1370667667	/nfs/dbraw/zinc/66/76/67/1370667667.db2.gz	OURNXGKLSYDEPX-KRWDZBQOSA-N	0	3	344.503	3.296	20	30		EGEDHN
N#Cc1cc(Cl)c(-c2noc([C@H]3CCNC[C@H]3F)n2)cc1Cl	ZINC001205220622	1370686060	/nfs/dbraw/zinc/68/60/60/1370686060.db2.gz	ZDQHOXMLKCHWIA-QPUJVOFHSA-N	0	3	341.173	3.330	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC[C@@H](c2ccc(F)cc2)[C@H](NC/C=C/Cl)C1	ZINC001205262961	1370699664	/nfs/dbraw/zinc/69/96/64/1370699664.db2.gz	HJFJNXSUGWDCEQ-XUVKREGZSA-N	0	3	349.837	3.012	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)N1CCC(CNCc2nc(C)cs2)CC1	ZINC001205956088	1370923151	/nfs/dbraw/zinc/92/31/51/1370923151.db2.gz	ZUCAMZNQGZESED-UKRRQHHQSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC(CNCc2ncc(C)s2)CC1	ZINC001205988145	1370930246	/nfs/dbraw/zinc/93/02/46/1370930246.db2.gz	BJFWLNPUAHZFOV-AWEZNQCLSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(CNCc3cc(C)no3)CC2)CCC1	ZINC001206181825	1370983674	/nfs/dbraw/zinc/98/36/74/1370983674.db2.gz	UGEYTIDQBUTHJK-UHFFFAOYSA-N	0	3	331.460	3.058	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@@H]1CN(Cc2ccc(C(C)(C)C)cc2)C[C@H]1C	ZINC001206641321	1371116034	/nfs/dbraw/zinc/11/60/34/1371116034.db2.gz	RBWDYMXBYJMXIV-IIDMSEBBSA-N	0	3	327.472	3.080	20	30		EGEDHN
C=C[C@@H](COC)NC[C@@H](O)COc1cc(C)c(Cl)cc1C(C)C	ZINC001326156323	1388120493	/nfs/dbraw/zinc/12/04/93/1388120493.db2.gz	OJDRLLQQTYCWLH-LSDHHAIUSA-N	0	3	341.879	3.302	20	30		EGEDHN
C=CCOC(=O)N1CCCC2(CCN(Cc3scnc3C)CC2)C1	ZINC001206863302	1371194662	/nfs/dbraw/zinc/19/46/62/1371194662.db2.gz	AVJWQZZCCJBHDW-UHFFFAOYSA-N	0	3	349.500	3.452	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CN([C@H]2CCc3ccc(F)cc32)C[C@H]1C	ZINC001206886653	1371207714	/nfs/dbraw/zinc/20/77/14/1371207714.db2.gz	BIBNFYUFQPCEJB-YSGRDPCXSA-N	0	3	342.458	3.443	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(CF)cc2)C[C@H]1NC(=O)C#CC(C)(C)C	ZINC001206951085	1371242776	/nfs/dbraw/zinc/24/27/76/1371242776.db2.gz	WNPPXDFTVRKAFE-CRAIPNDOSA-N	0	3	330.447	3.142	20	30		EGEDHN
C[C@H]1CC[C@H](CNC(=O)OC(C)(C)C)CN1Cc1cc(C#N)n(C)c1	ZINC001207102575	1371294767	/nfs/dbraw/zinc/29/47/67/1371294767.db2.gz	BRPKNGWHTJFKIG-LSDHHAIUSA-N	0	3	346.475	3.022	20	30		EGEDHN
C[C@@H]1CC[C@@H](CNC(=O)OC(C)(C)C)CN1Cc1cc(C#N)n(C)c1	ZINC001207102570	1371295022	/nfs/dbraw/zinc/29/50/22/1371295022.db2.gz	BRPKNGWHTJFKIG-CABCVRRESA-N	0	3	346.475	3.022	20	30		EGEDHN
CCN(Cc1cc(C#N)n(C)c1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC001207108505	1371296055	/nfs/dbraw/zinc/29/60/55/1371296055.db2.gz	DNZPZHVFMXPAHB-INIZCTEOSA-N	0	3	346.475	3.118	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN(CCOc2cc(C)cc(C)c2)C[C@H]1C	ZINC001207190263	1371325000	/nfs/dbraw/zinc/32/50/00/1371325000.db2.gz	KKEQMTMCOZSRMZ-UYAOXDASSA-N	0	3	344.499	3.475	20	30		EGEDHN
C=CCN(CCN1CC[C@H](c2ccccn2)C1)C(=O)OC(C)(C)C	ZINC001207205761	1371328382	/nfs/dbraw/zinc/32/83/82/1371328382.db2.gz	NQDCSOBYKDEGQY-INIZCTEOSA-N	0	3	331.460	3.294	20	30		EGEDHN
COc1ccc(C#N)cc1CN[C@H]1CCCN(C(=O)CCC(C)C)C1	ZINC001207221501	1371332654	/nfs/dbraw/zinc/33/26/54/1371332654.db2.gz	GSBZFGKMFSWVGJ-SFHVURJKSA-N	0	3	343.471	3.084	20	30		EGEDHN
O=C(C[C@H]1C=CCC1)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207232039	1371336916	/nfs/dbraw/zinc/33/69/16/1371336916.db2.gz	IAHCQOKQGXPFIR-AZUAARDMSA-N	0	3	340.442	3.114	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207362563	1371374713	/nfs/dbraw/zinc/37/47/13/1371374713.db2.gz	HKMUYQHDAJRESJ-QAPCUYQASA-N	0	3	332.875	3.318	20	30		EGEDHN
C=CCOCC(=O)N1CCC[C@H](N[C@H](C)c2ccccc2Cl)C1	ZINC001207679699	1371473276	/nfs/dbraw/zinc/47/32/76/1371473276.db2.gz	CKSMGGVLNBVFFB-CABCVRRESA-N	0	3	336.863	3.184	20	30		EGEDHN
CC(C)(C)/C=C\C(=O)N1CCC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001207711033	1371482372	/nfs/dbraw/zinc/48/23/72/1371482372.db2.gz	WDNCRYRMOBPWQG-XZVRFQMRSA-N	0	3	343.446	3.380	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@@H](NCC#Cc2ccccc2Cl)C1)C1CC1	ZINC001207743777	1371491654	/nfs/dbraw/zinc/49/16/54/1371491654.db2.gz	FUKWYUHXGKJSFI-CRAIPNDOSA-N	0	3	344.886	3.318	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H](NCC#Cc2ccc(Cl)cc2)C1)C1CC1	ZINC001207753959	1371495170	/nfs/dbraw/zinc/49/51/70/1371495170.db2.gz	GVMLUAKRHKECJK-KXBFYZLASA-N	0	3	344.886	3.318	20	30		EGEDHN
C=CCOCCCC(=O)N1CCC[C@@H](NCc2cc(C)ccc2F)C1	ZINC001207758588	1371496162	/nfs/dbraw/zinc/49/61/62/1371496162.db2.gz	BZEVDNSNNMBBRQ-GOSISDBHSA-N	0	3	348.462	3.198	20	30		EGEDHN
O=C(C1=CCCC1)N1CCC[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207790013	1371505680	/nfs/dbraw/zinc/50/56/80/1371505680.db2.gz	QAYSYKNCAMHQNK-IBGZPJMESA-N	0	3	342.870	3.382	20	30		EGEDHN
C#CCCCCC(=O)N1CCC[C@H](NCc2ccc(F)c(F)c2)C1	ZINC001207860071	1371521609	/nfs/dbraw/zinc/52/16/09/1371521609.db2.gz	GKGGOGPDASYBGG-INIZCTEOSA-N	0	3	334.410	3.239	20	30		EGEDHN
C#CCCCCC(=O)N1CCC[C@H](NCc2cn(C(C)C)nc2C)C1	ZINC001207863015	1371523137	/nfs/dbraw/zinc/52/31/37/1371523137.db2.gz	DSSAVCGIRJXBQV-IBGZPJMESA-N	0	3	344.503	3.047	20	30		EGEDHN
C#CCCCCC(=O)N1CCC[C@@H](NCc2cc(C)ccc2OC)C1	ZINC001207863796	1371523506	/nfs/dbraw/zinc/52/35/06/1371523506.db2.gz	XZJUVLFIBVOJJR-LJQANCHMSA-N	0	3	342.483	3.278	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H]([C@H]2CCCN2Cc2nc(C)oc2C)C1	ZINC001120348584	1371543264	/nfs/dbraw/zinc/54/32/64/1371543264.db2.gz	YSSMJRDKYVLMDU-PKOBYXMFSA-N	0	3	345.487	3.461	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC[C@@H]([C@@H]2CCCN2Cc2ccns2)C1	ZINC001120383106	1371556481	/nfs/dbraw/zinc/55/64/81/1371556481.db2.gz	UBESJJXQGDSDMY-AEFFLSMTSA-N	0	3	345.512	3.006	20	30		EGEDHN
Cc1sccc1C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001207992597	1371561729	/nfs/dbraw/zinc/56/17/29/1371561729.db2.gz	OFTVWQGXMPHTIV-SFHVURJKSA-N	0	3	338.476	3.302	20	30		EGEDHN
C=CCOCc1nn(C)c2c1CN(C[C@@H]1CCC(C)=C[C@@H]1C)CC2	ZINC001208171160	1371616900	/nfs/dbraw/zinc/61/69/00/1371616900.db2.gz	SODGJQYPHPEOPC-IRXDYDNUSA-N	0	3	329.488	3.473	20	30		EGEDHN
C=C(C)[C@@H]1CC=C(CN2CCC(C(=O)N3CCC(=O)CC3)CC2)CC1	ZINC001208177443	1371620725	/nfs/dbraw/zinc/62/07/25/1371620725.db2.gz	SGBCFPRISDFGOH-GOSISDBHSA-N	0	3	344.499	3.193	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@@H](NCc2ccc(Cl)nc2)C1	ZINC001208239551	1371673799	/nfs/dbraw/zinc/67/37/99/1371673799.db2.gz	CGBRVGAFKUFSGF-OAHLLOKOSA-N	0	3	335.879	3.418	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@H](NCc2cnn(C(C)(C)C)c2)C1	ZINC001208241185	1371674398	/nfs/dbraw/zinc/67/43/98/1371674398.db2.gz	UQNKAOFABDZHFC-KRWDZBQOSA-N	0	3	346.519	3.321	20	30		EGEDHN
C=CCC[C@H](C)[NH2+]C1CC2(CC(NC(=O)c3ccccc3[O-])C2)C1	ZINC001120644798	1371681077	/nfs/dbraw/zinc/68/10/77/1371681077.db2.gz	CEQLJGMFWPKTBI-VPDSAYSTSA-N	0	3	328.456	3.378	20	30		EGEDHN
C#CCC1(C(=O)N2CCC[C@H](NCc3ccccc3F)C2)CCC1	ZINC001208318854	1371715005	/nfs/dbraw/zinc/71/50/05/1371715005.db2.gz	JCFJKFXOTGWNMD-KRWDZBQOSA-N	0	3	328.431	3.100	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN([C@H]2CCc3ccc(F)cc32)C[C@H]1C	ZINC001208318143	1371715507	/nfs/dbraw/zinc/71/55/07/1371715507.db2.gz	LVIDLLMYWLYTQJ-XWIAVFTESA-N	0	3	330.447	3.462	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CN(CCCOc2ccccc2)C[C@H]1C	ZINC001208391124	1371749140	/nfs/dbraw/zinc/74/91/40/1371749140.db2.gz	JFTJKLCUBLDQCI-QWFCFKBJSA-N	0	3	344.499	3.494	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CN(CCOc2ccccc2)C[C@H]1C	ZINC001208390746	1371749386	/nfs/dbraw/zinc/74/93/86/1371749386.db2.gz	CDQPLKFSFYCHGP-YQVWRLOYSA-N	0	3	330.472	3.104	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1CN(CCOc2ccccc2C)C[C@H]1C	ZINC001208393693	1371751273	/nfs/dbraw/zinc/75/12/73/1371751273.db2.gz	WZLSVRZIDACJHH-CEXWTWQISA-N	0	3	344.499	3.413	20	30		EGEDHN
C=CCCC(=O)NC1CC2(CC(NCc3oc(CCC)nc3C)C2)C1	ZINC001120787210	1371758846	/nfs/dbraw/zinc/75/88/46/1371758846.db2.gz	HNJGOMWEAGICBD-UHFFFAOYSA-N	0	3	345.487	3.419	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1CCC[C@@H](NC[C@H](F)CC)C1	ZINC001208433007	1371764241	/nfs/dbraw/zinc/76/42/41/1371764241.db2.gz	PSRXIDAXVNJBHG-HZPDHXFCSA-N	0	3	334.435	3.194	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1CCC[C@H](NC[C@@H](F)CC)C1	ZINC001208433006	1371764589	/nfs/dbraw/zinc/76/45/89/1371764589.db2.gz	PSRXIDAXVNJBHG-HOTGVXAUSA-N	0	3	334.435	3.194	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN(C[C@H](O)c2ccc(CC)cc2)C[C@H]1C	ZINC001208452584	1371771618	/nfs/dbraw/zinc/77/16/18/1371771618.db2.gz	SXLRHUUTNXMTHH-AHRSYUTCSA-N	0	3	344.499	3.075	20	30		EGEDHN
C=C(Br)CNC[C@H](C1CC1)N(C)C(=O)c1cccs1	ZINC001734291706	1438021567	/nfs/dbraw/zinc/02/15/67/1438021567.db2.gz	GDIZFRSFZMIYST-GFCCVEGCSA-N	0	3	343.290	3.097	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN(CCOc2ccc(C)cc2)C[C@H]1C	ZINC001208458440	1371774642	/nfs/dbraw/zinc/77/46/42/1371774642.db2.gz	JXVVJTRJUGXYSK-IEBWSBKVSA-N	0	3	330.472	3.167	20	30		EGEDHN
C#CCCCCC(=O)NC1CC2(CC(NCc3oc(C)nc3C)C2)C1	ZINC001120968794	1371825903	/nfs/dbraw/zinc/82/59/03/1371825903.db2.gz	OAFNSOKKIJBOBX-UHFFFAOYSA-N	0	3	343.471	3.002	20	30		EGEDHN
O=C(C[C@@H]1C[C@H]1C1CC1)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001208638551	1371849688	/nfs/dbraw/zinc/84/96/88/1371849688.db2.gz	IRVMPENTQXYWNA-ACRUOGEOSA-N	0	3	336.479	3.055	20	30		EGEDHN
C[C@@H]1[C@@H](NC(=O)OC(C)(C)C)CCCN1CCc1ccc(C#N)cc1	ZINC001208928445	1371948399	/nfs/dbraw/zinc/94/83/99/1371948399.db2.gz	CEUHILRZIGRCEF-QAPCUYQASA-N	0	3	343.471	3.478	20	30		EGEDHN
N#Cc1cc(CN[C@@H]2CCCN(C(=O)CCCC3CC3)C2)ccc1F	ZINC001209146743	1372013940	/nfs/dbraw/zinc/01/39/40/1372013940.db2.gz	QIGDIIJGLCNQCD-GOSISDBHSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001209147388	1372014912	/nfs/dbraw/zinc/01/49/12/1372014912.db2.gz	WRHUHCWSWUPXBL-CRAIPNDOSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC1CC2(CC(NCc3nccs3)C2)C1	ZINC001121610216	1372023811	/nfs/dbraw/zinc/02/38/11/1372023811.db2.gz	JICNZQQSFKGMIF-OQDWRCPYSA-N	0	3	333.501	3.262	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC1CC2(CC(NCc3ocnc3C)C2)C1	ZINC001121616254	1372025909	/nfs/dbraw/zinc/02/59/09/1372025909.db2.gz	FMUJJSQKBHDQRF-DKWICNMVSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC1CC2(CC(NCc3cnoc3C)C2)C1	ZINC001121618188	1372027374	/nfs/dbraw/zinc/02/73/74/1372027374.db2.gz	ZTQKWSGYQSMUPL-AEGNVBMISA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC[C@@H](NCc2ccnc(Cl)c2)C1	ZINC001209183061	1372028019	/nfs/dbraw/zinc/02/80/19/1372028019.db2.gz	LFGSSQAOGNHQJS-GOEBONIOSA-N	0	3	335.879	3.418	20	30		EGEDHN
C#CCCCN1Cc2cn(CC3CCCC3)nc2[C@@H](COCC)C1	ZINC001209264201	1372054078	/nfs/dbraw/zinc/05/40/78/1372054078.db2.gz	XCOJWFBIQXAVSQ-LJQANCHMSA-N	0	3	329.488	3.422	20	30		EGEDHN
C=CCOC(=O)N[C@@H]1CCCN(CCCCOCc2ccccc2)C1	ZINC001209261991	1372054134	/nfs/dbraw/zinc/05/41/34/1372054134.db2.gz	YJZVRXBICVCSHD-LJQANCHMSA-N	0	3	346.471	3.360	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC1CC2(CC(NCc3conc3C)C2)C1	ZINC001121842185	1372099492	/nfs/dbraw/zinc/09/94/92/1372099492.db2.gz	YHHFWNGWCRFGLX-UHFFFAOYSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=CCCCCCCCN1CCCn2cnc(CNC(C)=O)c2C1	ZINC001209439186	1372106229	/nfs/dbraw/zinc/10/62/29/1372106229.db2.gz	KCKICSKRMNCMDU-UHFFFAOYSA-N	0	3	332.492	3.252	20	30		EGEDHN
C=CCCCCCCCN1CC[C@H]2[C@H]1CC(=O)N2c1cnn(C)c1	ZINC001209440543	1372107421	/nfs/dbraw/zinc/10/74/21/1372107421.db2.gz	FGWCMLKGVQFPAU-ZWKOTPCHSA-N	0	3	330.476	3.126	20	30		EGEDHN
O=C(C1CCC(F)CC1)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001209453899	1372110037	/nfs/dbraw/zinc/11/00/37/1372110037.db2.gz	GBZPPOZXCDFZSS-SOAGJPPSSA-N	0	3	342.458	3.147	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)C[C@@H](C)C(=O)c1cccc(F)c1	ZINC001123338035	1372431371	/nfs/dbraw/zinc/43/13/71/1372431371.db2.gz	RKZDMNSSGWICLT-IUODEOHRSA-N	0	3	327.359	3.127	20	30		EGEDHN
C=C[C@@H](C(=O)N[C@@H]1CN(CCOCC(C)C)C[C@H]1C)c1ccccc1	ZINC001211235141	1372509128	/nfs/dbraw/zinc/50/91/28/1372509128.db2.gz	IWZLSBRMUOPADO-MISYRCLQSA-N	0	3	344.499	3.065	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@@H](CC)c2ccc(OC)cc2)C1	ZINC001211241946	1372510299	/nfs/dbraw/zinc/51/02/99/1372510299.db2.gz	SIAZIICMNIBIHK-AYOQOUSVSA-N	0	3	330.472	3.201	20	30		EGEDHN
C#CCC1(C(=O)N2CCC[C@@H](NCc3ccccn3)C2)CCCCC1	ZINC001211360298	1372539658	/nfs/dbraw/zinc/53/96/58/1372539658.db2.gz	IFHYDXYTHFVCFQ-LJQANCHMSA-N	0	3	339.483	3.136	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)C[C@H]2CCCCC2(C)C)C1	ZINC001211482410	1372566888	/nfs/dbraw/zinc/56/68/88/1372566888.db2.gz	TUXUMOITLNMYJO-KZNAEPCWSA-N	0	3	336.520	3.232	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@@H](CC)CC(F)F)C[C@H]1c1ccccc1	ZINC001211616062	1372590928	/nfs/dbraw/zinc/59/09/28/1372590928.db2.gz	UBXXVONBCCLONX-RYQLBKOJSA-N	0	3	348.437	3.275	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)CCC(C)(C)C)C[C@H]1c1ccccc1	ZINC001211692648	1372603165	/nfs/dbraw/zinc/60/31/65/1372603165.db2.gz	DEXWSOSXUFWOAV-RBUKOAKNSA-N	0	3	326.484	3.420	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN(Cc2c(C)cc(C)cc2C)C[C@H]1OC	ZINC001212344720	1372691608	/nfs/dbraw/zinc/69/16/08/1372691608.db2.gz	JMBMPPJALPVSPQ-WOJBJXKFSA-N	0	3	344.499	3.284	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@H](CC)CC(F)F)[C@H](OC)C1	ZINC001212401027	1372700391	/nfs/dbraw/zinc/70/03/91/1372700391.db2.gz	BOPCRRGDWXCIHS-BZUAXINKSA-N	0	3	348.478	3.454	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2ccc(CC)o2)[C@H](OC)C1	ZINC001212467077	1372711473	/nfs/dbraw/zinc/71/14/73/1372711473.db2.gz	PYVICPLMBNIPQJ-SJLPKXTDSA-N	0	3	334.460	3.017	20	30		EGEDHN
C=CCOCC(=O)NCCN[C@H](CC)c1ccc(Cl)cc1Cl	ZINC001124767362	1372729002	/nfs/dbraw/zinc/72/90/02/1372729002.db2.gz	DMQINKMHURHRGH-OAHLLOKOSA-N	0	3	345.270	3.353	20	30		EGEDHN
CCCCCCCCS(=O)(=O)N[C@@H]1CCN(C2CCCC2)C1	ZINC001188030399	1388221585	/nfs/dbraw/zinc/22/15/85/1388221585.db2.gz	LWPAIULPTOLPAK-MRXNPFEDSA-N	0	3	330.538	3.283	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)C2CC3(CCC3)C2)[C@H](OC)C1	ZINC001213302969	1372879725	/nfs/dbraw/zinc/87/97/25/1372879725.db2.gz	CAATZBNVQQTDBI-QZTJIDSGSA-N	0	3	336.520	3.353	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN(CCCc2ccc(C)cc2)C[C@H]1OC	ZINC001213357432	1372891423	/nfs/dbraw/zinc/89/14/23/1372891423.db2.gz	VLDLRBLSQSKLFD-WOJBJXKFSA-N	0	3	344.499	3.099	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)C(CC)(CC)c2ccccc2)[C@H](OC)C1	ZINC001213901581	1372977658	/nfs/dbraw/zinc/97/76/58/1372977658.db2.gz	XDGYGKJRDAYCPL-RTBURBONSA-N	0	3	344.499	3.136	20	30		EGEDHN
N#Cc1ccc(-c2noc(-c3ccc(CN)nc3)n2)c2ccccc12	ZINC001214113646	1373010193	/nfs/dbraw/zinc/01/01/93/1373010193.db2.gz	KVYDDYWZKZIGHJ-UHFFFAOYSA-N	0	3	327.347	3.282	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H]2CN(CCOc3ccc(C)cc3)C[C@H]21	ZINC001188086850	1388239897	/nfs/dbraw/zinc/23/98/97/1388239897.db2.gz	CJODWRDFDPJDIH-AZUAARDMSA-N	0	3	342.483	3.263	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@@H](C)[C@H](NCc2ccc(Cl)cc2F)C1	ZINC001214581961	1373084862	/nfs/dbraw/zinc/08/48/62/1373084862.db2.gz	CYVKYXVOPIHJQD-CXAGYDPISA-N	0	3	336.838	3.075	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](C)[C@H](NCc2cccc(OCC)n2)C1	ZINC001214727687	1373110437	/nfs/dbraw/zinc/11/04/37/1373110437.db2.gz	MVRUWOFGZMKWKG-NVXWUHKLSA-N	0	3	345.487	3.019	20	30		EGEDHN
Cc1c(Cl)cccc1C(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001127876103	1373193718	/nfs/dbraw/zinc/19/37/18/1373193718.db2.gz	TWRNJYZLJPHIDM-UHFFFAOYSA-N	0	3	345.805	3.179	20	30		EGEDHN
Cc1c(Cl)cccc1C(=O)NCCNCc1ccc(C#N)c(F)c1	ZINC001127874770	1373193889	/nfs/dbraw/zinc/19/38/89/1373193889.db2.gz	AQMPQRQJGXYVMG-UHFFFAOYSA-N	0	3	345.805	3.179	20	30		EGEDHN
CN(C)Cc1ccc(-c2noc(-c3cccc([N+](=O)[O-])c3C#N)n2)cc1	ZINC001216900732	1373361107	/nfs/dbraw/zinc/36/11/07/1373361107.db2.gz	CGHCHAIKBFAZHR-UHFFFAOYSA-N	0	3	349.350	3.245	20	30		EGEDHN
COc1cc(C#N)ccc1-c1nc(-c2ccc(CN(C)C)cc2)no1	ZINC001216905069	1373361895	/nfs/dbraw/zinc/36/18/95/1373361895.db2.gz	RHIRQLJXKGLIKB-UHFFFAOYSA-N	0	3	334.379	3.345	20	30		EGEDHN
C=CCn1cccc1C(=O)NCCN[C@@H](C)c1ccc(F)c(F)c1	ZINC001129503139	1373391594	/nfs/dbraw/zinc/39/15/94/1373391594.db2.gz	XAQRUPFWRHXUEX-ZDUSSCGKSA-N	0	3	333.382	3.033	20	30		EGEDHN
C=CCn1cccc1C(=O)NCCNCc1ccc(C(C)C)nc1C	ZINC001129514465	1373392854	/nfs/dbraw/zinc/39/28/54/1373392854.db2.gz	VGAHNXPNSUGNHB-UHFFFAOYSA-N	0	3	340.471	3.021	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)CC3CCCC3)[C@H]2C1	ZINC001217200463	1373404645	/nfs/dbraw/zinc/40/46/45/1373404645.db2.gz	GVNYXBROTNIBKR-RBUKOAKNSA-N	0	3	334.504	3.225	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)[C@H]2CC[C@H](C3CCC3)CC2)c1	ZINC001129849343	1373429145	/nfs/dbraw/zinc/42/91/45/1373429145.db2.gz	BCFSSDCGWNGBNF-MXVIHJGJSA-N	0	3	339.483	3.371	20	30		EGEDHN
C=C(C)CN1CC[C@H](Oc2cnccc2CNC(=O)C[C@H](C)CC)C1	ZINC001130317277	1373491177	/nfs/dbraw/zinc/49/11/77/1373491177.db2.gz	OHCSAWHHNLKJLL-AEFFLSMTSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=C(C)CN1CC[C@H](Oc2cnccc2CNC(=O)[C@H](C)C(C)C)C1	ZINC001130323308	1373492957	/nfs/dbraw/zinc/49/29/57/1373492957.db2.gz	FCSKGUSZMQPLIC-AEFFLSMTSA-N	0	3	345.487	3.019	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)[C@H](C)CCCC)[C@H]2C1	ZINC001217795307	1373501525	/nfs/dbraw/zinc/50/15/25/1373501525.db2.gz	SUGZNYNEJZBCDL-CEXWTWQISA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCOc1ccc(C(=O)c2ccccc2)c(O[C@H]2CNC[C@@H]2F)c1	ZINC001218020951	1373540043	/nfs/dbraw/zinc/54/00/43/1373540043.db2.gz	UYIZCEMWWKINLO-HKUYNNGSSA-N	0	3	341.382	3.171	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)C[C@@H](C)C(C)(C)C)C1	ZINC001130442886	1373541520	/nfs/dbraw/zinc/54/15/20/1373541520.db2.gz	PGSYPKXOXXVTBE-CABCVRRESA-N	0	3	332.492	3.074	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)COCCCCCCCC)[C@@H]2C1	ZINC001188225975	1388269329	/nfs/dbraw/zinc/26/93/29/1388269329.db2.gz	ACZYTEVXDPIXJV-RBUKOAKNSA-N	0	3	336.520	3.472	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2OCCN(C(=O)c3cc(C)sc3C)[C@H]2C1	ZINC001218252580	1373583978	/nfs/dbraw/zinc/58/39/78/1373583978.db2.gz	DZDUPSOGJNERDI-JEBQAFNWSA-N	0	3	348.512	3.245	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCO[C@@H]2CN(CC/C=C/CCC)C[C@@H]21	ZINC001218524405	1373630173	/nfs/dbraw/zinc/63/01/73/1373630173.db2.gz	XAVTUECMIQYEJE-OZHPBFKBSA-N	0	3	334.504	3.247	20	30		EGEDHN
CC(C)(C)n1cc(C#N)cc1NC(=O)[C@@H](N)CCCc1ccccc1	ZINC001218559810	1373632554	/nfs/dbraw/zinc/63/25/54/1373632554.db2.gz	VAKFFCRZOIJNRA-KRWDZBQOSA-N	0	3	338.455	3.403	20	30		EGEDHN
CCn1cc(C(=O)NCCNCc2cccc(C#N)c2)c2ccccc21	ZINC001131055215	1373634155	/nfs/dbraw/zinc/63/41/55/1373634155.db2.gz	KZQXWOAWAKWFIJ-UHFFFAOYSA-N	0	3	346.434	3.052	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)C[C@@H](C)CC(C)(C)C)[C@H]2C1	ZINC001218683644	1373644195	/nfs/dbraw/zinc/64/41/95/1373644195.db2.gz	YPZMMAXKCWNJJY-FGTMMUONSA-N	0	3	336.520	3.327	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)[C@@H]3C[C@H]3C3CCC3)[C@H]2C1	ZINC001218758274	1373652285	/nfs/dbraw/zinc/65/22/85/1373652285.db2.gz	PFINYDKIAHFLEB-ZGXWSNOMSA-N	0	3	348.531	3.305	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)CC3(C=C)CCCCC3)[C@H]2C1	ZINC001218789977	1373654664	/nfs/dbraw/zinc/65/46/64/1373654664.db2.gz	ZJOMFQKFERVLJM-ZWKOTPCHSA-N	0	3	332.488	3.001	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)[C@@H]3CC34CCCC4)[C@H]2C1	ZINC001218899419	1373665431	/nfs/dbraw/zinc/66/54/31/1373665431.db2.gz	GLKYWMFXVQXOTI-GBESFXJTSA-N	0	3	348.531	3.449	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2OCCN(C(=O)c3ccccc3Cl)[C@H]2C1	ZINC001219004182	1373677531	/nfs/dbraw/zinc/67/75/31/1373677531.db2.gz	AIKTYHAQLYIVTJ-FHLIZLRMSA-N	0	3	348.874	3.220	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)C34CC(C(C)(C)C)(C3)C4)[C@H]2C1	ZINC001219058857	1373683897	/nfs/dbraw/zinc/68/38/97/1373683897.db2.gz	OXNVVQLFSCJKHO-ZGDXVETISA-N	0	3	346.515	3.081	20	30		EGEDHN
Cc1cc(Cl)cc(C(=O)NCCNCc2ccc(C#N)s2)c1	ZINC001131363118	1373684122	/nfs/dbraw/zinc/68/41/22/1373684122.db2.gz	VTFVWVLYJSEWCJ-UHFFFAOYSA-N	0	3	333.844	3.101	20	30		EGEDHN
C[Si](C)(C)C#Cc1cccc(NC(=O)c2cncc3c2CCNC3)c1	ZINC001219311434	1373700020	/nfs/dbraw/zinc/70/00/20/1373700020.db2.gz	ZHXPYMLRMHGJLT-UHFFFAOYSA-N	0	3	349.510	3.209	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cc(C3CC3)oc2C2CC2)cc1	ZINC001131573850	1373724477	/nfs/dbraw/zinc/72/44/77/1373724477.db2.gz	IWVTWHUZQMBLEZ-UHFFFAOYSA-N	0	3	349.434	3.426	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@H](C)O[C@]2(CCN(CC=C(C)C)C2)C1	ZINC001131661968	1373749695	/nfs/dbraw/zinc/74/96/95/1373749695.db2.gz	RVYAMAUNOBQWOL-PXNSSMCTSA-N	0	3	334.504	3.247	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2CN([C@H](CC)c3ccccc3)C[C@@H]2O)CC1	ZINC001220292152	1373764396	/nfs/dbraw/zinc/76/43/96/1373764396.db2.gz	ORMKWHYCSAKXIZ-QRVBRYPASA-N	0	3	342.483	3.045	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)[C@@H]2CCCC[C@@H]2C2CC2)ccc1F	ZINC001131743406	1373782385	/nfs/dbraw/zinc/78/23/85/1373782385.db2.gz	ZGPOBUFQCULQTJ-QZTJIDSGSA-N	0	3	343.446	3.120	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)CCCc3cc(C)ccc3C)[C@@H]2C1	ZINC001222036770	1373812540	/nfs/dbraw/zinc/81/25/40/1373812540.db2.gz	CWQHIGLGROCVNK-NHCUHLMSSA-N	0	3	338.495	3.182	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@@H](C)N(CCOc2cccc(C)c2)C1	ZINC001131896904	1375033329	/nfs/dbraw/zinc/03/33/29/1375033329.db2.gz	WZTUNCDNVMGZTF-QZTJIDSGSA-N	0	3	330.472	3.309	20	30		EGEDHN
C=CCOCC(=O)N[C@H]1CC[C@H](C)N(Cc2cc(C)sc2C)C1	ZINC001131896565	1375033505	/nfs/dbraw/zinc/03/35/05/1375033505.db2.gz	UAHHUQDTCAMLQF-GUYCJALGSA-N	0	3	336.501	3.037	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@H](C)N(CCOc2ccc(C)cc2)C1	ZINC001131896878	1375034044	/nfs/dbraw/zinc/03/40/44/1375034044.db2.gz	WULUKBLEIKRTMS-ZWKOTPCHSA-N	0	3	330.472	3.309	20	30		EGEDHN
CC1(CC(=O)NCC2CCN(Cc3cccc(C#N)c3)CC2)CC1	ZINC001223855450	1375046352	/nfs/dbraw/zinc/04/63/52/1375046352.db2.gz	ZSIVXQRCWAKEDQ-UHFFFAOYSA-N	0	3	325.456	3.077	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)CC(C)(C)CC(F)(F)F)C[C@@H]21	ZINC001224009135	1375051410	/nfs/dbraw/zinc/05/14/10/1375051410.db2.gz	HDPDKTDUPFBDQS-CABCVRRESA-N	0	3	344.421	3.301	20	30		EGEDHN
C=CCC1(C(=O)NCC2CCN(Cc3cnccc3C)CC2)CCC1	ZINC001224402585	1375066526	/nfs/dbraw/zinc/06/65/26/1375066526.db2.gz	MVESXKPAADNTTD-UHFFFAOYSA-N	0	3	341.499	3.465	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2cc(OC)no2)CC[C@H]1C	ZINC001131981426	1375080402	/nfs/dbraw/zinc/08/04/02/1375080402.db2.gz	WGZOJAHZKYGAJC-CABCVRRESA-N	0	3	337.464	3.236	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CC[C@H](C)N(CCOc2ccc(C)cc2)C1	ZINC001131996914	1375089600	/nfs/dbraw/zinc/08/96/00/1375089600.db2.gz	ZSTPYCHNMALVJN-OALUTQOASA-N	0	3	342.483	3.146	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)CSCCC	ZINC001225091122	1375092466	/nfs/dbraw/zinc/09/24/66/1375092466.db2.gz	QQEIIILZHRKBGH-CHWSQXEVSA-N	0	3	349.338	3.055	20	30		EGEDHN
Cc1cc(C)cc(CN2C[C@@H](NC(=O)C#CC(C)C)CC[C@H]2C)c1	ZINC001132015931	1375099703	/nfs/dbraw/zinc/09/97/03/1375099703.db2.gz	BQZZWGZSEBPZTJ-QUCCMNQESA-N	0	3	326.484	3.432	20	30		EGEDHN
C[C@H]1CC[C@H](NC(=O)C#CC2CC2)CN1Cc1ccc(C2CC2)cc1	ZINC001132033581	1375108900	/nfs/dbraw/zinc/10/89/00/1375108900.db2.gz	IJSXIJXFAPISJF-KKSFZXQISA-N	0	3	336.479	3.447	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H](C)CCC	ZINC001225441039	1375111224	/nfs/dbraw/zinc/11/12/24/1375111224.db2.gz	VZEBEGXEIZALDM-MRVWCRGKSA-N	0	3	331.298	3.348	20	30		EGEDHN
CCc1ccccc1CCN1C[C@H](NC(=O)C#CC2CC2)CC[C@@H]1C	ZINC001132047104	1375116169	/nfs/dbraw/zinc/11/61/69/1375116169.db2.gz	UIYBGGSOZIBJOF-LAUBAEHRSA-N	0	3	338.495	3.174	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)Cc2c(C)cccc2C)CC[C@@H]1C	ZINC001132065515	1375129429	/nfs/dbraw/zinc/12/94/29/1375129429.db2.gz	VMWSAIGXFQSKSE-OALUTQOASA-N	0	3	344.499	3.018	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H]1CC[C@@H](C)N(CCOC(C)C)C1	ZINC001132076930	1375134744	/nfs/dbraw/zinc/13/47/44/1375134744.db2.gz	DWBJXEUGHFBPOH-UKRRQHHQSA-N	0	3	330.900	3.159	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@H](C)Cc2cccc(Cl)c2)CC1	ZINC001225693942	1375145832	/nfs/dbraw/zinc/14/58/32/1375145832.db2.gz	FQEOMLAJUKIMQW-MRXNPFEDSA-N	0	3	346.902	3.370	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2cc(F)ccc2CC)CC[C@H]1C	ZINC001132148969	1375170675	/nfs/dbraw/zinc/17/06/75/1375170675.db2.gz	DRUMLZVJSXOBPL-QAPCUYQASA-N	0	3	348.462	3.173	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCc2ccc(N(C)C)cc2)CC[C@@H]1C	ZINC001132157483	1375176139	/nfs/dbraw/zinc/17/61/39/1375176139.db2.gz	QAOLZYFCGHYUCD-HKUYNNGSSA-N	0	3	343.515	3.230	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CCCC[C@H]1NCc1cc(C)ccc1OC	ZINC001225928677	1375176420	/nfs/dbraw/zinc/17/64/20/1375176420.db2.gz	KSNDMPTZFRRHIJ-RTBURBONSA-N	0	3	342.483	3.324	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)COc2ccc(C(C)C)cc2)CC[C@H]1C	ZINC001132160018	1375178241	/nfs/dbraw/zinc/17/82/41/1375178241.db2.gz	HSGKLCRUQAKRGS-MJGOQNOKSA-N	0	3	342.483	3.181	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)C2CCC3(CC3)CC2)CC[C@H]1C	ZINC001132173006	1375188068	/nfs/dbraw/zinc/18/80/68/1375188068.db2.gz	GAEKWKHKEUEDSA-SJLPKXTDSA-N	0	3	334.504	3.129	20	30		EGEDHN
Cc1nc(O[C@@H]2CCN(C(C)C)C2)c(C#N)c(C)c1Br	ZINC001226203838	1375220054	/nfs/dbraw/zinc/22/00/54/1375220054.db2.gz	KAJIZHIQTJMCKP-GFCCVEGCSA-N	0	3	338.249	3.194	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1CC[C@H](C)N(CCOCc2ccccc2)C1	ZINC001132228179	1375223844	/nfs/dbraw/zinc/22/38/44/1375223844.db2.gz	NKMCVYGPYZBEBT-HKUYNNGSSA-N	0	3	344.499	3.385	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCCOCc2ccccc2)CC[C@H]1C	ZINC001132261135	1375252699	/nfs/dbraw/zinc/25/26/99/1375252699.db2.gz	KRVJGLKUNBOUKV-MJGOQNOKSA-N	0	3	330.472	3.139	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC1CCN([C@H](C)c2cccc(F)c2)CC1	ZINC001226446465	1375260182	/nfs/dbraw/zinc/26/01/82/1375260182.db2.gz	BTROFIUSPFURAL-CVEARBPZSA-N	0	3	348.462	3.449	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H]2CC[C@@H](C)N(CCOCC3CC3)C2)CC1	ZINC001132277620	1375261319	/nfs/dbraw/zinc/26/13/19/1375261319.db2.gz	HVQMRPUDCIFWKH-AEFFLSMTSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)CCCC1CCOCC1	ZINC001226657948	1375301171	/nfs/dbraw/zinc/30/11/71/1375301171.db2.gz	WMUXOQMJPBZZCJ-IAGOWNOFSA-N	0	3	342.911	3.353	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2cccc(Cl)c2)CC[C@H]1C	ZINC001132437496	1375382142	/nfs/dbraw/zinc/38/21/42/1375382142.db2.gz	VKQWIXYOJBTWLB-RHSMWYFYSA-N	0	3	336.863	3.125	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COc2c(C)cccc2C)CC[C@@H]1C	ZINC001132467026	1375408103	/nfs/dbraw/zinc/40/81/03/1375408103.db2.gz	ARXHZVDEAOMDKQ-ZWKOTPCHSA-N	0	3	330.472	3.227	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)Cc2ccc(C)c(C)c2)CC[C@H]1C	ZINC001132469792	1375410865	/nfs/dbraw/zinc/41/08/65/1375410865.db2.gz	WMIIRVYOCOLWRY-UYAOXDASSA-N	0	3	344.499	3.018	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CN(CC)c2ccccc2)CC[C@H]1C	ZINC001132509547	1375433018	/nfs/dbraw/zinc/43/30/18/1375433018.db2.gz	WRLSXGCBYCUCKQ-MSOLQXFVSA-N	0	3	329.488	3.058	20	30		EGEDHN
C#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)CC(C)(C)C)CC1	ZINC001132552443	1375459378	/nfs/dbraw/zinc/45/93/78/1375459378.db2.gz	VGXCOGVLSXUETR-IBGZPJMESA-N	0	3	341.499	3.334	20	30		EGEDHN
C#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)CC(C)(C)C)CC1	ZINC001132552445	1375459465	/nfs/dbraw/zinc/45/94/65/1375459465.db2.gz	VGXCOGVLSXUETR-LJQANCHMSA-N	0	3	341.499	3.334	20	30		EGEDHN
C#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)[C@H](C)CCC)CC1	ZINC001132554212	1375459615	/nfs/dbraw/zinc/45/96/15/1375459615.db2.gz	DAGJZLMIKFKAFZ-UYAOXDASSA-N	0	3	341.499	3.334	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)[C@@H](C)CC)CC1	ZINC001132552811	1375459898	/nfs/dbraw/zinc/45/98/98/1375459898.db2.gz	ZTAJALGQRNIGEJ-AZUAARDMSA-N	0	3	341.499	3.334	20	30		EGEDHN
C#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)[C@H](C)C(C)C)CC1	ZINC001132557838	1375463697	/nfs/dbraw/zinc/46/36/97/1375463697.db2.gz	DWQRQXWYCCKTSB-UYAOXDASSA-N	0	3	341.499	3.190	20	30		EGEDHN
C#CCN1CC[C@H](CN(Cc2scnc2C)C(=O)CCCCC)C1	ZINC001132557695	1375463700	/nfs/dbraw/zinc/46/37/00/1375463700.db2.gz	CGQPXJVGPKAJHC-KRWDZBQOSA-N	0	3	347.528	3.316	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCNCc1cccc(C(F)(F)F)c1	ZINC001132575964	1375472969	/nfs/dbraw/zinc/47/29/69/1375472969.db2.gz	FORCFIUFHLZRMJ-OLZOCXBDSA-N	0	3	328.378	3.369	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CCCC[C@H]1NCc1cc(CO)ccc1F	ZINC001227973081	1375496465	/nfs/dbraw/zinc/49/64/65/1375496465.db2.gz	LTFMNMTXRMVKPM-QZTJIDSGSA-N	0	3	348.462	3.047	20	30		EGEDHN
C[C@@H]1CCN(C(=O)C#CC(C)(C)C)C[C@H]1CNC/C(Cl)=C\Cl	ZINC001132820370	1375583464	/nfs/dbraw/zinc/58/34/64/1375583464.db2.gz	ULFGRTCWHQBEDP-OMZQKGCKSA-N	0	3	345.314	3.429	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](C)[C@H](CNCc2nccs2)C1	ZINC001132843201	1375595200	/nfs/dbraw/zinc/59/52/00/1375595200.db2.gz	JGNFDDHYMHUDDT-NVXWUHKLSA-N	0	3	347.528	3.486	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](C)[C@H](CNCc2nccn2CC)C1	ZINC001132846551	1375598446	/nfs/dbraw/zinc/59/84/46/1375598446.db2.gz	JTCYZLWKRBHBKR-DLBZAZTESA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC1CCN(Cc2cccc(N(C)C)c2)CC1	ZINC001228579631	1375603298	/nfs/dbraw/zinc/60/32/98/1375603298.db2.gz	NHLAWJWXAHCLLS-UHFFFAOYSA-N	0	3	343.515	3.436	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](C)[C@@H](CNCc2ccccc2C#N)C1	ZINC001132865818	1375610617	/nfs/dbraw/zinc/61/06/17/1375610617.db2.gz	SKVIWUGIUAZDCT-XLIONFOSSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CCN(Cc2ccc(C)c(OC)c2)CC1	ZINC001228631446	1375622059	/nfs/dbraw/zinc/62/20/59/1375622059.db2.gz	LZJHYFBTNHGPFA-UHFFFAOYSA-N	0	3	330.472	3.296	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CCN(CCOc2c(C)cccc2C)CC1	ZINC001228631557	1375622530	/nfs/dbraw/zinc/62/25/30/1375622530.db2.gz	OPXWQIZUVXPDOK-UHFFFAOYSA-N	0	3	344.499	3.475	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N1CC[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001188844883	1388389570	/nfs/dbraw/zinc/38/95/70/1388389570.db2.gz	CXIFEBPRSIBJHR-MJEQZMIGSA-N	0	3	335.451	3.113	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NC1CCN(CCc2ccccc2F)CC1	ZINC001228750414	1375663800	/nfs/dbraw/zinc/66/38/00/1375663800.db2.gz	YEKSBBWBIPLPKN-HZPDHXFCSA-N	0	3	332.463	3.407	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC1CCN(C[C@@H](O)c2ccc(F)cc2)CC1	ZINC001228795171	1375679328	/nfs/dbraw/zinc/67/93/28/1375679328.db2.gz	RXGOBGUNMGPWAE-HNAYVOBHSA-N	0	3	348.462	3.042	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2ccc(CCC)cc2)CC1	ZINC001228879150	1375704110	/nfs/dbraw/zinc/70/41/10/1375704110.db2.gz	GMYIHHOJHLLPKI-UHFFFAOYSA-N	0	3	330.472	3.036	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)CCCC(C)=O	ZINC001133379814	1375958964	/nfs/dbraw/zinc/95/89/64/1375958964.db2.gz	HSPIEMPXUJIGLV-UHFFFAOYSA-N	0	3	348.874	3.041	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)[C@@H](CCC)c2ccccc2)CC1	ZINC001230194014	1375963076	/nfs/dbraw/zinc/96/30/76/1375963076.db2.gz	HXLBEOFZZDJVIA-FQEVSTJZSA-N	0	3	344.499	3.354	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)CCC(F)(F)F	ZINC001133390659	1375974185	/nfs/dbraw/zinc/97/41/85/1375974185.db2.gz	CBSCTWLNAPSVPA-UHFFFAOYSA-N	0	3	346.780	3.234	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)CC1CCCC1	ZINC001133572736	1376098136	/nfs/dbraw/zinc/09/81/36/1376098136.db2.gz	KGCFNMVYNCYBQQ-CHWSQXEVSA-N	0	3	331.298	3.348	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)c1ccoc1CC)Cc1cccnc1	ZINC001230747404	1376137969	/nfs/dbraw/zinc/13/79/69/1376137969.db2.gz	BIPRTQZHPGWRPO-UHFFFAOYSA-N	0	3	341.455	3.435	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)c1cc(Cl)c[nH]1	ZINC001133672404	1376147584	/nfs/dbraw/zinc/14/75/84/1376147584.db2.gz	ZKNBKTZYFQNHFZ-NXEZZACHSA-N	0	3	348.672	3.063	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)[C@@H]1C[C@H]1CCC)Cc1cccnc1	ZINC001230840627	1376165043	/nfs/dbraw/zinc/16/50/43/1376165043.db2.gz	CBOYNZMBHODQMX-RTBURBONSA-N	0	3	329.488	3.402	20	30		EGEDHN
C#CCCN(CCCNC(=O)[C@H](CC)CCC)Cc1cccnc1	ZINC001230881586	1376175277	/nfs/dbraw/zinc/17/52/77/1376175277.db2.gz	HZSIBYWIEAMUSN-LJQANCHMSA-N	0	3	329.488	3.240	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H]2CN(Cc3cccc(N(C)C)c3)C[C@H]21	ZINC001188999377	1388432201	/nfs/dbraw/zinc/43/22/01/1388432201.db2.gz	MBNVNXOURBALES-AZUAARDMSA-N	0	3	341.499	3.142	20	30		EGEDHN
N#C[C@H]1CCCN(Cc2n[nH]c3cc(Br)ccc32)CC1	ZINC001231617963	1376282614	/nfs/dbraw/zinc/28/26/14/1376282614.db2.gz	UKRCYVXFQDCJNU-NSHDSACASA-N	0	3	333.233	3.451	20	30		EGEDHN
C=CCOc1cccc(CN2CCC(NC(=O)C(C)(C)C)CC2)c1	ZINC001231624692	1376286018	/nfs/dbraw/zinc/28/60/18/1376286018.db2.gz	UVZILASZVDFMLY-UHFFFAOYSA-N	0	3	330.472	3.378	20	30		EGEDHN
C=CCN1C(=O)CC[C@@]12CCCN(Cc1ccc(OCC)nc1)CC2	ZINC001231653746	1376294194	/nfs/dbraw/zinc/29/41/94/1376294194.db2.gz	NWIFOFMMIZDPFR-HXUWFJFHSA-N	0	3	343.471	3.013	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)/C=C\C1CC1)NCc1cc(F)ccc1C#N	ZINC001134009868	1376311926	/nfs/dbraw/zinc/31/19/26/1376311926.db2.gz	YRHDJDGNPVBRSK-GMOCCLDISA-N	0	3	329.419	3.036	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)c1oc(C)cc1C	ZINC001134042116	1376327546	/nfs/dbraw/zinc/32/75/46/1376327546.db2.gz	KZZIMHZMIFAWJB-RYUDHWBXSA-N	0	3	343.265	3.292	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)CCc1ccoc1)NCc1ccccc1C#N	ZINC001134057219	1376336776	/nfs/dbraw/zinc/33/67/76/1376336776.db2.gz	WOYCXBSHIIMYAD-HOTGVXAUSA-N	0	3	339.439	3.157	20	30		EGEDHN
Cc1[nH]ccc1C(=O)N[C@@H](C)C[C@@H](C)NCc1cc(F)ccc1C#N	ZINC001134104964	1376370611	/nfs/dbraw/zinc/37/06/11/1376370611.db2.gz	NROMIDWPVQLJRX-OLZOCXBDSA-N	0	3	342.418	3.021	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)C1=CCCC1)NCc1cc(F)ccc1C#N	ZINC001134119318	1376378615	/nfs/dbraw/zinc/37/86/15/1376378615.db2.gz	PHGDEANOEDXKNN-KBPBESRZSA-N	0	3	329.419	3.181	20	30		EGEDHN
Cc1ccc(CC(=O)N[C@H](C)C[C@@H](C)NCc2ccccc2C#N)o1	ZINC001134156651	1376390822	/nfs/dbraw/zinc/39/08/22/1376390822.db2.gz	NPXDRTHFDWRHAR-HUUCEWRRSA-N	0	3	339.439	3.075	20	30		EGEDHN
C=CCN(CC=C)CCN1CCN(Cc2cc(Cl)cs2)CC1	ZINC001232282842	1376432033	/nfs/dbraw/zinc/43/20/33/1376432033.db2.gz	BJXGXJNWHNZMJW-UHFFFAOYSA-N	0	3	339.936	3.193	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H](C)C[C@H](C)NCc1nsc2ccccc21	ZINC001134316669	1376471377	/nfs/dbraw/zinc/47/13/77/1376471377.db2.gz	ALLUWEQVPZVBDB-LSDHHAIUSA-N	0	3	343.496	3.329	20	30		EGEDHN
Cc1nc(CN[C@@H](C)C[C@H](C)NC(=O)C#CC(C)(C)C)c(C)s1	ZINC001134329246	1376479332	/nfs/dbraw/zinc/47/93/32/1376479332.db2.gz	MDFBLIVFXUQWDY-STQMWFEESA-N	0	3	335.517	3.182	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H](C)C[C@H](C)NCc1conc1CC	ZINC001134418279	1376523289	/nfs/dbraw/zinc/52/32/89/1376523289.db2.gz	IADJRAULESJTEE-LSDHHAIUSA-N	0	3	333.476	3.378	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H](C)C[C@@H](C)NCc1ccn(CC)n1	ZINC001134447413	1376542439	/nfs/dbraw/zinc/54/24/39/1376542439.db2.gz	HUOCNZNBTYDVHQ-OLZOCXBDSA-N	0	3	340.899	3.055	20	30		EGEDHN
C=CCN1C(=O)CCC[C@@]12CCCN(Cc1ccc3ncoc3c1)C2	ZINC001232941267	1376543406	/nfs/dbraw/zinc/54/34/06/1376543406.db2.gz	VVWPQZQIRSMHAC-FQEVSTJZSA-N	0	3	339.439	3.361	20	30		EGEDHN
COc1ccc(CCN(Cc2ccc(C)cc2C#N)C[C@H](C)O)cc1	ZINC001232962927	1376549328	/nfs/dbraw/zinc/54/93/28/1376549328.db2.gz	UOYBGZOQUZQJSJ-KRWDZBQOSA-N	0	3	338.451	3.301	20	30		EGEDHN
Cc1ccc(CN2CCN3C[C@@H](Oc4ccccc4)C[C@@H]3C2)c(C#N)c1	ZINC001232966642	1376549985	/nfs/dbraw/zinc/54/99/85/1376549985.db2.gz	UXHUMWSRKJHEDL-IRLDBZIGSA-N	0	3	347.462	3.204	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H](C)C[C@H](C)NC/C(Cl)=C/Cl	ZINC001134638738	1376637034	/nfs/dbraw/zinc/63/70/34/1376637034.db2.gz	UETFTRKLKVVDIP-UDVMBWJESA-N	0	3	344.286	3.480	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)C1(C2CC2)CC1)NCc1cc(F)ccc1C#N	ZINC001134694509	1376665541	/nfs/dbraw/zinc/66/55/41/1376665541.db2.gz	SWOKFEUAMINOSO-KBPBESRZSA-N	0	3	343.446	3.260	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)CC1CC(F)(F)C1)NCc1ccccc1C#N	ZINC001134779520	1376716726	/nfs/dbraw/zinc/71/67/26/1376716726.db2.gz	WOIRYIOHCPLERE-KBPBESRZSA-N	0	3	349.425	3.367	20	30		EGEDHN
C#CCCCC(=O)N(C)C[C@@H]1CCN1CCCCc1ccccc1	ZINC001233948565	1376741844	/nfs/dbraw/zinc/74/18/44/1376741844.db2.gz	YFLRKBOVEPFLHJ-FQEVSTJZSA-N	0	3	326.484	3.346	20	30		EGEDHN
COCCN1CCC(Oc2ccc([C@@H]3CC(=O)C=C(C)O3)cc2)CC1	ZINC001234165685	1376781141	/nfs/dbraw/zinc/78/11/41/1376781141.db2.gz	LRRJRMHJBFMJEZ-FQEVSTJZSA-N	0	3	345.439	3.111	20	30		EGEDHN
C=CCCCCCN1CC[C@H]1CN(C)C(=O)[C@H]1OCC[C@H]1C(C)C	ZINC001234378451	1376823738	/nfs/dbraw/zinc/82/37/38/1376823738.db2.gz	RDPVDIWVKFTQKI-FHWLQOOXSA-N	0	3	336.520	3.327	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)C1(C2CC2)CCC1	ZINC001135086855	1376887492	/nfs/dbraw/zinc/88/74/92/1376887492.db2.gz	LKMDSIDAORCBBO-STQMWFEESA-N	0	3	343.309	3.348	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H](C)C[C@@H](C)NCc1nc(C)cs1	ZINC001135188744	1376962238	/nfs/dbraw/zinc/96/22/38/1376962238.db2.gz	OYDFFOHHPSFUEZ-CABCVRRESA-N	0	3	335.517	3.408	20	30		EGEDHN
C=CC1(CC(=O)NCCNC[C@@H](O)c2ccccc2F)CCCCC1	ZINC001135197120	1376967900	/nfs/dbraw/zinc/96/79/00/1376967900.db2.gz	YLTYPYHKKFPTAG-GOSISDBHSA-N	0	3	348.462	3.092	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1ccccc1C#N)NC(=O)C(C)(C)C1CC1	ZINC001135248295	1377001380	/nfs/dbraw/zinc/00/13/80/1377001380.db2.gz	YGZWMNNFIOGTJV-LSDHHAIUSA-N	0	3	327.472	3.367	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2nccn2CC)CCC1	ZINC001135390887	1377069603	/nfs/dbraw/zinc/06/96/03/1377069603.db2.gz	NXFYGRCCFRREHS-HZPDHXFCSA-N	0	3	332.492	3.022	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](C)C[C@@H](C)NCc2nccn2CC)CC1	ZINC001135416447	1377083296	/nfs/dbraw/zinc/08/32/96/1377083296.db2.gz	UKCDBNUPNYDABD-HZPDHXFCSA-N	0	3	332.492	3.022	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](C)C[C@H](C)NCc2oc(C)nc2C)CC1	ZINC001135416191	1377083360	/nfs/dbraw/zinc/08/33/60/1377083360.db2.gz	RGMBUFSNWIYTJK-UONOGXRCSA-N	0	3	333.476	3.411	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H](C)C[C@H](C)NCc2ccncc2Cl)C1	ZINC001135417977	1377084977	/nfs/dbraw/zinc/08/49/77/1377084977.db2.gz	ASWKYBYBAGMFOM-KBPBESRZSA-N	0	3	335.879	3.464	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)c1ccc(Cl)[nH]1	ZINC001135420038	1377085424	/nfs/dbraw/zinc/08/54/24/1377085424.db2.gz	SKHZVMLJPRCMOJ-ZJUUUORDSA-N	0	3	348.672	3.063	20	30		EGEDHN
CCCCCC[C@H](C)C(=O)NCCNCc1ccc(OC)c(C#N)c1	ZINC001135547507	1377138482	/nfs/dbraw/zinc/13/84/82/1377138482.db2.gz	KTMMDJHZGJFBJI-INIZCTEOSA-N	0	3	345.487	3.379	20	30		EGEDHN
N#CC[C@H](C(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1	ZINC001135797679	1377213337	/nfs/dbraw/zinc/21/33/37/1377213337.db2.gz	PQOJOZIIKZCAGW-UXHICEINSA-N	0	3	333.435	3.075	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3c[nH]c4cc(C)ccc34)C2)C1=O	ZINC001136970539	1377447132	/nfs/dbraw/zinc/44/71/32/1377447132.db2.gz	SOIGBWMNTPMBSX-OAQYLSRUSA-N	0	3	337.467	3.477	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1ccc(COC)c(F)c1)C(C)C	ZINC001268227623	1377498642	/nfs/dbraw/zinc/49/86/42/1377498642.db2.gz	VRAHIWPJPWEGMZ-INIZCTEOSA-N	0	3	342.842	3.069	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCCN(Cc3[nH]nc4ccccc43)C2)cc1	ZINC001137352466	1377530284	/nfs/dbraw/zinc/53/02/84/1377530284.db2.gz	YXRREDKVZWHUNF-KRWDZBQOSA-N	0	3	332.407	3.478	20	30		EGEDHN
C=CCO[C@H]1CO[C@]2(C1)CCCN(Cc1cc(C)ccc1OC)C2	ZINC001138486786	1377731564	/nfs/dbraw/zinc/73/15/64/1377731564.db2.gz	XRCOYMDTHRZRSU-QUCCMNQESA-N	0	3	331.456	3.330	20	30		EGEDHN
CCn1nc(C)c(CN2CCC[C@@H](Oc3cccc(C#N)c3)C2)c1C	ZINC001138646556	1377762346	/nfs/dbraw/zinc/76/23/46/1377762346.db2.gz	RYMWWJDWIZOIFC-LJQANCHMSA-N	0	3	338.455	3.435	20	30		EGEDHN
C=C(C)COc1ccccc1CN1C[C@@H]2CC[C@H](C1)C2C(=O)OC	ZINC001138664945	1377765152	/nfs/dbraw/zinc/76/51/52/1377765152.db2.gz	BGQICRNAMZERGP-JJTKIYQPSA-N	0	3	329.440	3.273	20	30		EGEDHN
Cc1cnc2n1CCC21CCN(Cc2c[nH]c3c2cccc3C#N)CC1	ZINC001139701802	1377937448	/nfs/dbraw/zinc/93/74/48/1377937448.db2.gz	RPESNTFJDRQVAC-UHFFFAOYSA-N	0	3	345.450	3.482	20	30		EGEDHN
N#Cc1cccc2c(CN3CCCN(Cc4ccncc4)CC3)c[nH]c21	ZINC001139701566	1377937619	/nfs/dbraw/zinc/93/76/19/1377937619.db2.gz	JVZPWSOYPMYWEP-UHFFFAOYSA-N	0	3	345.450	3.142	20	30		EGEDHN
CCc1nnc(C2CCN(Cc3c[nH]c4c3cccc4C#N)CC2)o1	ZINC001139706526	1377938110	/nfs/dbraw/zinc/93/81/10/1377938110.db2.gz	XYEDIXCTHYKVSA-UHFFFAOYSA-N	0	3	335.411	3.365	20	30		EGEDHN
CCCCOC(=O)[C@@H]1CCN(Cc2c[nH]c3c2cccc3C#N)C1	ZINC001139706887	1377938144	/nfs/dbraw/zinc/93/81/44/1377938144.db2.gz	BPZDLPKYXAZMRK-OAHLLOKOSA-N	0	3	325.412	3.205	20	30		EGEDHN
C=CCN1C(=O)CC[C@@]12CCCN(Cc1cc(F)cc(C#N)c1)CC2	ZINC001139876990	1377970033	/nfs/dbraw/zinc/97/00/33/1377970033.db2.gz	TYVKTYFEVXBDOZ-HXUWFJFHSA-N	0	3	341.430	3.230	20	30		EGEDHN
Cn1ncc2ccc(CN3CCC[C@H](Oc4ccccc4C#N)C3)cc21	ZINC001139908011	1377975356	/nfs/dbraw/zinc/97/53/56/1377975356.db2.gz	VQECIXNQPYFMSW-IBGZPJMESA-N	0	3	346.434	3.488	20	30		EGEDHN
COc1ccnc(O[C@@H]2CCN(Cc3c[nH]c4ccc(C#N)cc34)C2)c1	ZINC001140117412	1378011451	/nfs/dbraw/zinc/01/14/51/1378011451.db2.gz	PQHHLYMTVIOMQX-QGZVFWFLSA-N	0	3	348.406	3.096	20	30		EGEDHN
COc1cccc(O[C@H]2CCN(Cc3c[nH]c4ccc(C#N)cc34)C2)n1	ZINC001140117853	1378012944	/nfs/dbraw/zinc/01/29/44/1378012944.db2.gz	ZXYZOKFQIYEREQ-INIZCTEOSA-N	0	3	348.406	3.096	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCCN(C(=O)C2(C(C)(F)F)CC2)C1	ZINC001753556583	1440436169	/nfs/dbraw/zinc/43/61/69/1440436169.db2.gz	STALFVJBKSCBHV-ZDUSSCGKSA-N	0	3	334.838	3.393	20	30		EGEDHN
O=C1C=C2CN(Cc3ccc(OC(F)(F)F)c(F)c3)CCC2S1	ZINC001140886441	1378169469	/nfs/dbraw/zinc/16/94/69/1378169469.db2.gz	YSZVLCWAAMMOFZ-ZDUSSCGKSA-N	0	3	347.333	3.498	20	30		EGEDHN
Cc1cccnc1O[C@H]1CCN(Cc2c[nH]c3cc(C#N)ccc23)C1	ZINC001142930787	1378511827	/nfs/dbraw/zinc/51/18/27/1378511827.db2.gz	MQXGFKVCYUCRSU-KRWDZBQOSA-N	0	3	332.407	3.396	20	30		EGEDHN
O=C1C=C2CN(Cc3ccc(OC(F)(F)F)cc3F)CCC2S1	ZINC001143788285	1378646231	/nfs/dbraw/zinc/64/62/31/1378646231.db2.gz	BDYXQASCRRGDNC-CYBMUJFWSA-N	0	3	347.333	3.498	20	30		EGEDHN
C#Cc1ccc(CN(CC)C[C@H]2CN(Cc3ccccc3)CCO2)cc1	ZINC001144581673	1378747892	/nfs/dbraw/zinc/74/78/92/1378747892.db2.gz	XRSUBBWCZZENIO-QHCPKHFHSA-N	0	3	348.490	3.391	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2nccn2C)CCCCC1	ZINC001146506255	1378855786	/nfs/dbraw/zinc/85/57/86/1378855786.db2.gz	YZDSIDIFMTYUPT-IAGOWNOFSA-N	0	3	346.519	3.320	20	30		EGEDHN
CC[C@H](CC(=O)NCCNCc1cccc(C#N)c1)c1ccccc1	ZINC001147474494	1379028859	/nfs/dbraw/zinc/02/88/59/1379028859.db2.gz	JMONAZFWRYNIAK-LJQANCHMSA-N	0	3	335.451	3.348	20	30		EGEDHN
Cc1cc(C(=O)N(C)C[C@H](C)NCc2ccc(F)c(C#N)c2)c(C)o1	ZINC001283573572	1379029962	/nfs/dbraw/zinc/02/99/62/1379029962.db2.gz	UZVFTVIVPKUDHT-LBPRGKRZSA-N	0	3	343.402	3.158	20	30		EGEDHN
C=C(C)CCC(=O)N1CC2(C1)CCN(Cc1ccc(C)c(OC)c1)C2	ZINC001147640044	1379054488	/nfs/dbraw/zinc/05/44/88/1379054488.db2.gz	NLWOFSWVRWAAPT-UHFFFAOYSA-N	0	3	342.483	3.394	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC2(C1)CCN(CCc1csc(C)n1)C2	ZINC001147652308	1379055945	/nfs/dbraw/zinc/05/59/45/1379055945.db2.gz	DWGYVKDEDZDJQV-UHFFFAOYSA-N	0	3	347.528	3.131	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC2(C1)CCN(Cc1cccnc1C)C2	ZINC001148129516	1379121797	/nfs/dbraw/zinc/12/17/97/1379121797.db2.gz	GCSSUVIKXZUUML-KRWDZBQOSA-N	0	3	327.472	3.027	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001148130214	1379122541	/nfs/dbraw/zinc/12/25/41/1379122541.db2.gz	LYUGFEZJUZEXSU-QGZVFWFLSA-N	0	3	337.467	3.195	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)C/C=C\c2ccccc2F)C1	ZINC001149881303	1379459764	/nfs/dbraw/zinc/45/97/64/1379459764.db2.gz	KMFHXYDSZMZRBU-GNJLHFKMSA-N	0	3	346.446	3.012	20	30		EGEDHN
C[C@@H](CC(=O)NCCNCc1ccc(C#N)c(F)c1)c1ccccc1	ZINC001149980017	1379478028	/nfs/dbraw/zinc/47/80/28/1379478028.db2.gz	CSLLWJVKRSVCGV-HNNXBMFYSA-N	0	3	339.414	3.097	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)[C@@H](C)c2ccc(CC)cc2)C1	ZINC001150444055	1379553275	/nfs/dbraw/zinc/55/32/75/1379553275.db2.gz	CMVAUPLTOFVFAO-PXNSSMCTSA-N	0	3	344.499	3.136	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)[C@H](C)c2ccc(CC)cc2)C1	ZINC001150444059	1379553507	/nfs/dbraw/zinc/55/35/07/1379553507.db2.gz	CMVAUPLTOFVFAO-YLJYHZDGSA-N	0	3	344.499	3.136	20	30		EGEDHN
C=CCC1(C(=O)NC[C@H]2CN(CC(=C)C)CCCO2)CCCCC1	ZINC001150762313	1379610015	/nfs/dbraw/zinc/61/00/15/1379610015.db2.gz	WLVBNWDTZNJAEH-SFHVURJKSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H]2CN(CCCF)CCCO2)CCCCC1	ZINC001150761777	1379610270	/nfs/dbraw/zinc/61/02/70/1379610270.db2.gz	SAWCMKBIHOEROE-QGZVFWFLSA-N	0	3	340.483	3.080	20	30		EGEDHN
C=C[C@@H](CC(=O)NC[C@H]1CN(CC(=C)C)CCCO1)c1ccccc1	ZINC001150770376	1379611351	/nfs/dbraw/zinc/61/13/51/1379611351.db2.gz	FHHIYPGTDFYRNJ-ICSRJNTNSA-N	0	3	342.483	3.130	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2ccoc2Cl)CC1	ZINC001151090955	1379659610	/nfs/dbraw/zinc/65/96/10/1379659610.db2.gz	KNZFFTMZQWIFFT-UHFFFAOYSA-N	0	3	340.851	3.110	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2ccc3occc3c2)CC1	ZINC001151138298	1379667040	/nfs/dbraw/zinc/66/70/40/1379667040.db2.gz	ZNIXECVHYYEOPS-UHFFFAOYSA-N	0	3	342.439	3.220	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2sc(C)cc2C)CC1	ZINC001151145756	1379667640	/nfs/dbraw/zinc/66/76/40/1379667640.db2.gz	YCKICDMDQNFDQA-UHFFFAOYSA-N	0	3	336.501	3.152	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)C(=O)NCCNCc1cnc(C)s1	ZINC001151906391	1379814065	/nfs/dbraw/zinc/81/40/65/1379814065.db2.gz	IEEYKYIOYZIIBJ-KRWDZBQOSA-N	0	3	343.496	3.092	20	30		EGEDHN
C=C[C@@H](CC(=O)NCCNCc1ccc(C#N)cc1)c1ccccc1	ZINC001151942380	1379821563	/nfs/dbraw/zinc/82/15/63/1379821563.db2.gz	HDLNILSVXNBDOB-IBGZPJMESA-N	0	3	333.435	3.124	20	30		EGEDHN
CCC(CC)C(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)c(F)c1	ZINC001151980949	1379829922	/nfs/dbraw/zinc/82/99/22/1379829922.db2.gz	MXCUREDRTWYSSP-CQSZACIVSA-N	0	3	333.451	3.460	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)C[C@@H](C)SC	ZINC001152820259	1379983269	/nfs/dbraw/zinc/98/32/69/1379983269.db2.gz	AXFQXHUTAQNGMD-HUUCEWRRSA-N	0	3	333.501	3.026	20	30		EGEDHN
C#CC[C@@H](CC(=O)NCCNCc1csc(C)c1)c1ccccc1	ZINC001153714489	1380117126	/nfs/dbraw/zinc/11/71/26/1380117126.db2.gz	NFUUXWMFJXPUML-IBGZPJMESA-N	0	3	340.492	3.460	20	30		EGEDHN
C=CCC1(C(=O)NCCNCc2ccccc2N(C)C)CCCC1	ZINC001153813971	1380134657	/nfs/dbraw/zinc/13/46/57/1380134657.db2.gz	KUZIPCTZQOYTBC-UHFFFAOYSA-N	0	3	329.488	3.095	20	30		EGEDHN
C=CCC1(C(=O)NCCNCc2ccc(F)c(C#N)c2)CCCC1	ZINC001153813878	1380134811	/nfs/dbraw/zinc/13/48/11/1380134811.db2.gz	HCWGQQYCXLGPER-UHFFFAOYSA-N	0	3	329.419	3.040	20	30		EGEDHN
Cc1ccc(/C=C/CC(=O)NCCNCc2ccc(C#N)cc2)cc1	ZINC001153979402	1380167777	/nfs/dbraw/zinc/16/77/77/1380167777.db2.gz	AVABNJDERGTQFD-NSCUHMNNSA-N	0	3	333.435	3.176	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@@H]1CC[C@@H](c2ccccc2)C1	ZINC001153998129	1380174204	/nfs/dbraw/zinc/17/42/04/1380174204.db2.gz	JSIODTWVVFSSTK-MISYRCLQSA-N	0	3	326.484	3.420	20	30		EGEDHN
CCN(Cc1ccc(OC)c(C#N)c1)[C@H](C)CNC(=O)C(C)(C)CC	ZINC001154963709	1380381875	/nfs/dbraw/zinc/38/18/75/1380381875.db2.gz	VGQCZONALXTZPT-OAHLLOKOSA-N	0	3	345.487	3.330	20	30		EGEDHN
CCc1ccoc1C(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)cc1	ZINC001155061986	1380401133	/nfs/dbraw/zinc/40/11/33/1380401133.db2.gz	PQCYADTWCFYECN-OAHLLOKOSA-N	0	3	339.439	3.354	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@@H](C)N(CC)C/C=C/c2ccccc2)c1	ZINC001155148700	1380416335	/nfs/dbraw/zinc/41/63/35/1380416335.db2.gz	AIEAQWFGTISAMA-ZPHJMFTNSA-N	0	3	347.462	3.217	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)[C@H](C)c1ccco1	ZINC001155199827	1380423855	/nfs/dbraw/zinc/42/38/55/1380423855.db2.gz	KREDKBZIJJWXJB-HZPDHXFCSA-N	0	3	339.439	3.282	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)C1(C(C)(F)F)CC1	ZINC001155279370	1380432737	/nfs/dbraw/zinc/43/27/37/1380432737.db2.gz	MSDOLCMIDRMMHM-CQSZACIVSA-N	0	3	349.425	3.320	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NCCCN[C@H](C)c1c(F)cccc1F	ZINC001155440525	1380454289	/nfs/dbraw/zinc/45/42/89/1380454289.db2.gz	TUFQOCZUDYOULR-KGLIPLIRSA-N	0	3	340.414	3.103	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)[C@@H]1C[C@H]1C1CC1	ZINC001155744656	1380488760	/nfs/dbraw/zinc/48/87/60/1380488760.db2.gz	YKOHXYWNSKUBPI-JEBQAFNWSA-N	0	3	343.446	3.070	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)CCC1(C)CC1	ZINC001156177361	1380537020	/nfs/dbraw/zinc/53/70/20/1380537020.db2.gz	WYYMTMNZXUDMAQ-MRXNPFEDSA-N	0	3	327.472	3.465	20	30		EGEDHN
N#Cc1ccc([N+](=O)[O-])c(NC[C@@H](c2ccccc2)N2CCCC2)n1	ZINC001156532586	1380589302	/nfs/dbraw/zinc/58/93/02/1380589302.db2.gz	XWWWPLIUBWRQDW-KRWDZBQOSA-N	0	3	337.383	3.110	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1ccc(-c2cccs2)o1	ZINC001156682473	1380609804	/nfs/dbraw/zinc/60/98/04/1380609804.db2.gz	BGYXBPJAOZRKMB-CQSZACIVSA-N	0	3	330.453	3.472	20	30		EGEDHN
C=C(Cl)CNCC1CC(NC(=O)c2cccc(C)c2Cl)C1	ZINC001755219181	1440784491	/nfs/dbraw/zinc/78/44/91/1440784491.db2.gz	HGGMWSASEWGOPR-UHFFFAOYSA-N	0	3	327.255	3.499	20	30		EGEDHN
C=CCCOCC(=O)NC[C@@H](C)N(CC)C/C=C\c1ccccc1	ZINC001157214134	1380811937	/nfs/dbraw/zinc/81/19/37/1380811937.db2.gz	XUQDPYQKYNTICL-ADYSOMBNSA-N	0	3	330.472	3.119	20	30		EGEDHN
CN1CCC[C@H]2CN(c3nc4cc(F)ccc4c(Cl)c3C#N)C[C@H]21	ZINC001157281754	1380832214	/nfs/dbraw/zinc/83/22/14/1380832214.db2.gz	IACVLOGPWWDZFH-MEDUHNTESA-N	0	3	344.821	3.429	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@@H](OC(C)C)c1ccccc1	ZINC001157395184	1380867786	/nfs/dbraw/zinc/86/77/86/1380867786.db2.gz	LPWDPOWWUUEDKD-MJGOQNOKSA-N	0	3	330.472	3.003	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1sccc1F	ZINC001157913764	1381069166	/nfs/dbraw/zinc/06/91/66/1381069166.db2.gz	OGSRZUCCXOJSFJ-CQSZACIVSA-N	0	3	340.464	3.016	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1Cc2cc(Cl)ccc2O1	ZINC001158199965	1381157342	/nfs/dbraw/zinc/15/73/42/1381157342.db2.gz	OFPNKFKDCZHBJH-AEFFLSMTSA-N	0	3	348.874	3.142	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1C[C@H]1C(C)(C)C	ZINC001158227736	1381166622	/nfs/dbraw/zinc/16/66/22/1381166622.db2.gz	MXYJITMYBPQQJP-KZNAEPCWSA-N	0	3	336.520	3.184	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)C[C@@H]1CC=CCC1	ZINC001158316750	1381197312	/nfs/dbraw/zinc/19/73/12/1381197312.db2.gz	QHCRWBLJRMPKFD-RTBURBONSA-N	0	3	334.504	3.248	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)Cc1cn(C)c2ccccc12	ZINC001158427162	1381243292	/nfs/dbraw/zinc/24/32/92/1381243292.db2.gz	SMYMIIVTQCLHMC-GOSISDBHSA-N	0	3	339.483	3.220	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc(F)c2ncccc2c1	ZINC001158631334	1381331836	/nfs/dbraw/zinc/33/18/36/1381331836.db2.gz	LTTJXJJCJUYRKI-QGZVFWFLSA-N	0	3	341.430	3.486	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@@H]1CCC(C)=C(C)C1	ZINC001158720853	1381366058	/nfs/dbraw/zinc/36/60/58/1381366058.db2.gz	MMAUFYKLEGGIIO-CQSZACIVSA-N	0	3	329.282	3.127	20	30		EGEDHN
C=CCN(C)CCN(C(=O)c1ccnc(C(F)(F)F)c1)C(C)C	ZINC001755817636	1440924483	/nfs/dbraw/zinc/92/44/83/1440924483.db2.gz	SQCSQBJJMUQCMG-UHFFFAOYSA-N	0	3	329.366	3.069	20	30		EGEDHN
C[C@@H](CCNC(=O)C1CCC(F)(F)CC1)NCc1ccccc1C#N	ZINC001328414719	1388741570	/nfs/dbraw/zinc/74/15/70/1388741570.db2.gz	YGERSRURBYWGQL-AWEZNQCLSA-N	0	3	349.425	3.368	20	30		EGEDHN
C#CCC1(C(=O)NCCCNCc2c(F)cccc2Cl)CCC1	ZINC001159638013	1381856087	/nfs/dbraw/zinc/85/60/87/1381856087.db2.gz	FMUXJCKGCKCYOG-UHFFFAOYSA-N	0	3	336.838	3.269	20	30		EGEDHN
C#CCC1(C(=O)NCCCNCc2cccc(OC)c2Cl)CCC1	ZINC001159643963	1381857758	/nfs/dbraw/zinc/85/77/58/1381857758.db2.gz	BIIHVPAPHKYCPF-UHFFFAOYSA-N	0	3	348.874	3.138	20	30		EGEDHN
C[C@@H](CCNC(=O)c1ccc(F)s1)NCc1ccccc1C#N	ZINC001328458716	1388750785	/nfs/dbraw/zinc/75/07/85/1388750785.db2.gz	KDLIAFYCBGJICK-LBPRGKRZSA-N	0	3	331.416	3.057	20	30		EGEDHN
C[C@@H](c1ccc(F)cc1)N1CC=C(CCNC(=O)C#CC2CC2)CC1	ZINC001160084028	1381993165	/nfs/dbraw/zinc/99/31/65/1381993165.db2.gz	FHSRYROGNWIWTI-INIZCTEOSA-N	0	3	340.442	3.439	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cccc3scnc32)CC1	ZINC001160126233	1382005769	/nfs/dbraw/zinc/00/57/69/1382005769.db2.gz	XTMWWLDXOLABMX-UHFFFAOYSA-N	0	3	339.464	3.072	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCC1=CCN(CCOCC(C)C)CC1	ZINC001160242536	1382046407	/nfs/dbraw/zinc/04/64/07/1382046407.db2.gz	WCVLUSGSANZSGA-UHFFFAOYSA-N	0	3	336.520	3.400	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc3ccccc3nc2C)CC1	ZINC001160296527	1382065470	/nfs/dbraw/zinc/06/54/70/1382065470.db2.gz	TUIAYMBDWYSAMV-UHFFFAOYSA-N	0	3	335.451	3.481	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2c(C)nn(C(C)(C)C)c2C)CC1	ZINC001160301933	1382066788	/nfs/dbraw/zinc/06/67/88/1382066788.db2.gz	IPWXVHBNRRJEIU-UHFFFAOYSA-N	0	3	344.503	3.193	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)CCc2ccc(C)cc2C)CC1	ZINC001160816671	1382207349	/nfs/dbraw/zinc/20/73/49/1382207349.db2.gz	VWBWEQMGYKJVRE-UHFFFAOYSA-N	0	3	338.495	3.398	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CCCOc2ccc(F)cc2)CC1	ZINC001160836314	1382213951	/nfs/dbraw/zinc/21/39/51/1382213951.db2.gz	UYTYSFJHLWEFAT-UHFFFAOYSA-N	0	3	346.446	3.309	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@@]1(C)CCC[C@H]1CC	ZINC001160980053	1382260620	/nfs/dbraw/zinc/26/06/20/1382260620.db2.gz	YCZHPHVVWMGNIA-HIFRSBDPSA-N	0	3	331.298	3.207	20	30		EGEDHN
CC#CCCCC(=O)NCCC1=CCN(Cc2ccc(C#N)cc2)CC1	ZINC001160954383	1382249885	/nfs/dbraw/zinc/24/98/85/1382249885.db2.gz	RXEMQHRZZSXQFV-UHFFFAOYSA-N	0	3	349.478	3.390	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H]2CC[C@H](C(F)(F)F)C2)CC1	ZINC001161019246	1382274704	/nfs/dbraw/zinc/27/47/04/1382274704.db2.gz	AKKBVYVIJYQFAU-GJZGRUSLSA-N	0	3	330.394	3.289	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc3cc(OC)ccc3[nH]2)CC1	ZINC001161050982	1382283657	/nfs/dbraw/zinc/28/36/57/1382283657.db2.gz	NIBNXKUVNGOVRN-UHFFFAOYSA-N	0	3	339.439	3.115	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)Cc2cn(C)c3ccccc23)CC1	ZINC001161051334	1382283962	/nfs/dbraw/zinc/28/39/62/1382283962.db2.gz	VZQJHPQKELMGNE-UHFFFAOYSA-N	0	3	337.467	3.045	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C[C@@H](C)c2cccc(F)c2)CC1	ZINC001161180668	1382328656	/nfs/dbraw/zinc/32/86/56/1382328656.db2.gz	CTCQTVUPWNMUDR-QGZVFWFLSA-N	0	3	342.458	3.481	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc(Cl)c(OC)c2)CC1	ZINC001161422329	1382404635	/nfs/dbraw/zinc/40/46/35/1382404635.db2.gz	MPFCUBBYVLFJEN-UHFFFAOYSA-N	0	3	346.858	3.124	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H]2C[C@H]2c2ccc(C)s2)CC1	ZINC001161427258	1382406766	/nfs/dbraw/zinc/40/67/66/1382406766.db2.gz	HVRKSYOAKJXCQN-QZTJIDSGSA-N	0	3	342.508	3.322	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@H](C)c2ccccc2F)CC1	ZINC001161496887	1382423527	/nfs/dbraw/zinc/42/35/27/1382423527.db2.gz	JKFIHMHHCFURAY-MRXNPFEDSA-N	0	3	328.431	3.091	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C[C@H]2CCO[C@@H](C(C)C)C2)CC1	ZINC001161656059	1382472891	/nfs/dbraw/zinc/47/28/91/1382472891.db2.gz	PTCLYNFFXGBUCN-RBUKOAKNSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cnn(C3CCCC3)c2C)CC1	ZINC001161674612	1382477476	/nfs/dbraw/zinc/47/74/76/1382477476.db2.gz	PIOICAWDLBZPRY-UHFFFAOYSA-N	0	3	342.487	3.245	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ncsc2C(C)C)CC1	ZINC001161694642	1382482633	/nfs/dbraw/zinc/48/26/33/1382482633.db2.gz	QREYFBDZPCFVTK-UHFFFAOYSA-N	0	3	331.485	3.042	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H]2Cc3ccc(Cl)cc32)CC1	ZINC001161805997	1382512306	/nfs/dbraw/zinc/51/23/06/1382512306.db2.gz	WWPKFQUCZULYFM-LJQANCHMSA-N	0	3	342.870	3.141	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@H](C)c2ccc(F)c(F)c2)CC1	ZINC001161904342	1382545895	/nfs/dbraw/zinc/54/58/95/1382545895.db2.gz	QUIZZTLNMITAJY-OAHLLOKOSA-N	0	3	346.421	3.230	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc(C3CCCC3)no2)CC1	ZINC001161904324	1382546071	/nfs/dbraw/zinc/54/60/71/1382546071.db2.gz	QBZSCYCIQHFIHP-UHFFFAOYSA-N	0	3	341.455	3.108	20	30		EGEDHN
C=CCOc1ccc(CC(=O)NCCC2=CCN(CC=C)CC2)cc1	ZINC001161968413	1382576592	/nfs/dbraw/zinc/57/65/92/1382576592.db2.gz	SLAIJXWJXAEELA-UHFFFAOYSA-N	0	3	340.467	3.118	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)C1(CC(C)C)CCC1	ZINC001162245769	1382673009	/nfs/dbraw/zinc/67/30/09/1382673009.db2.gz	GCTCHBWHGDUNPF-UHFFFAOYSA-N	0	3	331.298	3.207	20	30		EGEDHN
C#CCN1CCC(CNC(=O)CCC2CCCCCC2)(COC)CC1	ZINC001162357004	1382740167	/nfs/dbraw/zinc/74/01/67/1382740167.db2.gz	VAZDAYYXWSZMKL-UHFFFAOYSA-N	0	3	348.531	3.215	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@@H]2CCCC[C@@H]2CC)(COC)CC1	ZINC001162558795	1382789682	/nfs/dbraw/zinc/78/96/82/1382789682.db2.gz	RSLKIULWJZBMNQ-RBUKOAKNSA-N	0	3	348.531	3.071	20	30		EGEDHN
COc1nc(-n2c3ccccc3nc2[C@@H](C)N)c(C#N)c(C)c1Cl	ZINC001162759967	1382862452	/nfs/dbraw/zinc/86/24/52/1382862452.db2.gz	VBNIPQDHYZGPIB-SNVBAGLBSA-N	0	3	341.802	3.282	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@]1(C)CCC[C@H]1CC	ZINC001162840903	1382891414	/nfs/dbraw/zinc/89/14/14/1382891414.db2.gz	HOMKOCKBOTYOBY-IRLDBZIGSA-N	0	3	340.511	3.497	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CCC1(C)C	ZINC001162897628	1382908536	/nfs/dbraw/zinc/90/85/36/1382908536.db2.gz	DSOQGFDMRMYWEW-LJQANCHMSA-N	0	3	326.484	3.107	20	30		EGEDHN
C=CCC(C)(C)C(=O)N(CCNCC#CC)CCc1ccccc1	ZINC001162946766	1382923631	/nfs/dbraw/zinc/92/36/31/1382923631.db2.gz	QBOPGOTWSYPNEO-UHFFFAOYSA-N	0	3	326.484	3.273	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1cccc2cc[nH]c21	ZINC001162946455	1382923640	/nfs/dbraw/zinc/92/36/40/1382923640.db2.gz	KAEKHAGLOPGSJO-UHFFFAOYSA-N	0	3	345.446	3.076	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCCNCc2ccc(F)cc2Cl)cc1	ZINC001163733776	1383116371	/nfs/dbraw/zinc/11/63/71/1383116371.db2.gz	CCGPZVHULVXHSJ-UHFFFAOYSA-N	0	3	344.817	3.370	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCCNCc1cc(-c2ccccc2)no1	ZINC001164234387	1383169533	/nfs/dbraw/zinc/16/95/33/1383169533.db2.gz	WTZPYSCQDSTYQR-JKSUJKDBSA-N	0	3	341.455	3.396	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCCCNCc1ccn(C(CC)CC)n1	ZINC001164323210	1383177692	/nfs/dbraw/zinc/17/76/92/1383177692.db2.gz	DGLIXUMDQQNORU-INIZCTEOSA-N	0	3	334.508	3.442	20	30		EGEDHN
CC(C)c1ccoc1C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001164491488	1383192690	/nfs/dbraw/zinc/19/26/90/1383192690.db2.gz	IJISPGLPYVLEOJ-UHFFFAOYSA-N	0	3	343.402	3.323	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)C(C1CCC1)C1CCC1	ZINC001164682209	1383215903	/nfs/dbraw/zinc/21/59/03/1383215903.db2.gz	AZIGFWDTGCHUIV-UHFFFAOYSA-N	0	3	343.309	3.207	20	30		EGEDHN
CCN1CCC(N(C)C(F)(F)c2cc(Cl)ncc2C#N)CC1	ZINC001165068221	1383221062	/nfs/dbraw/zinc/22/10/62/1383221062.db2.gz	NXAHONZCTBBTRJ-UHFFFAOYSA-N	0	3	328.794	3.072	20	30		EGEDHN
C=C(C)CCC(=O)NCCC1(CN[C@H](C)c2cnc(C)cn2)CC1	ZINC001165258920	1383260074	/nfs/dbraw/zinc/26/00/74/1383260074.db2.gz	WJZTWTWSPKSZDV-MRXNPFEDSA-N	0	3	330.476	3.078	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)CCCc1ccccc1	ZINC001165673363	1383323339	/nfs/dbraw/zinc/32/33/39/1383323339.db2.gz	NFUIQPCBOLBCOY-UHFFFAOYSA-N	0	3	339.277	3.014	20	30		EGEDHN
Cc1ccc(F)c(C(=O)NCCCNCc2ccccc2C#N)c1F	ZINC001165811360	1383349553	/nfs/dbraw/zinc/34/95/53/1383349553.db2.gz	ZCZYQIZGHUHJSV-UHFFFAOYSA-N	0	3	343.377	3.055	20	30		EGEDHN
CC1(CC(=O)NCCC2(CNCc3ccc(C#N)cc3F)CC2)CC1	ZINC001166218668	1383403619	/nfs/dbraw/zinc/40/36/19/1383403619.db2.gz	XBWORTCIRNWWTD-UHFFFAOYSA-N	0	3	343.446	3.264	20	30		EGEDHN
C#CCCCCCC(=O)NCCC1(CNCc2ccc(F)cn2)CC1	ZINC001166588477	1383442335	/nfs/dbraw/zinc/44/23/35/1383442335.db2.gz	BAPNNJIOXWUEFQ-UHFFFAOYSA-N	0	3	345.462	3.181	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2nccc3ccccc32)CC1	ZINC001166869493	1383490559	/nfs/dbraw/zinc/49/05/59/1383490559.db2.gz	ACLSZMPDWBDGFP-UHFFFAOYSA-N	0	3	343.858	3.477	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCC2(CNCc3c(C)noc3CC)CC2)C1	ZINC001167130686	1383547663	/nfs/dbraw/zinc/54/76/63/1383547663.db2.gz	UWDBGACMDAZQKF-UHFFFAOYSA-N	0	3	345.487	3.278	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)CO[C@H]2CCC[C@H](C)C2)CC1	ZINC001167362624	1383610605	/nfs/dbraw/zinc/61/06/05/1383610605.db2.gz	OLABNEHNELKTEO-HOCLYGCPSA-N	0	3	342.911	3.210	20	30		EGEDHN
CCC[C@@H](C(=O)NCCCNCc1ccc(C#N)cc1F)C(C)C	ZINC001167471323	1383643421	/nfs/dbraw/zinc/64/34/21/1383643421.db2.gz	FQTYDNJTFCISQM-QGZVFWFLSA-N	0	3	333.451	3.366	20	30		EGEDHN
N#Cc1ccccc1CNc1cccc2cc([C@@H]3CNCCO3)cn21	ZINC001167633111	1383694414	/nfs/dbraw/zinc/69/44/14/1383694414.db2.gz	GNJBPYGPQVMPBV-IBGZPJMESA-N	0	3	332.407	3.084	20	30		EGEDHN
CC(C)(C)C(=O)NCCC1(CNCc2ccc(C#N)cc2F)CC1	ZINC001167836574	1383754684	/nfs/dbraw/zinc/75/46/84/1383754684.db2.gz	ZRVMCEXAMDKKEJ-UHFFFAOYSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=CC1(CC(=O)NCCCNCc2cccc(OC)n2)CCCCC1	ZINC001168182288	1383836607	/nfs/dbraw/zinc/83/66/07/1383836607.db2.gz	BAROXGXRPRYMOE-UHFFFAOYSA-N	0	3	345.487	3.213	20	30		EGEDHN
C=CC1(CC(=O)NCCCNCc2c(C)noc2C)CCCCC1	ZINC001168182920	1383836664	/nfs/dbraw/zinc/83/66/64/1383836664.db2.gz	SRVCVRCQGNRQDQ-UHFFFAOYSA-N	0	3	333.476	3.414	20	30		EGEDHN
C[C@H]1C[C@@H](NCc2ccc(F)c(C#N)c2)CN1C(=O)OC(C)(C)C	ZINC001168813765	1384015732	/nfs/dbraw/zinc/01/57/32/1384015732.db2.gz	ASEBZUMSKBWJMK-SWLSCSKDSA-N	0	3	333.407	3.185	20	30		EGEDHN
CCO[C@@H](CC)C(=O)N[C@@H](C)CCCCNCc1ccccc1C#N	ZINC001169568664	1384160469	/nfs/dbraw/zinc/16/04/69/1384160469.db2.gz	REVSSDQPYPUDCY-LPHOPBHVSA-N	0	3	345.487	3.138	20	30		EGEDHN
Cc1cc(CN(C)C[C@H]2CCN2C(=O)OC(C)(C)C)ccc1C#N	ZINC001308955245	1384162198	/nfs/dbraw/zinc/16/21/98/1384162198.db2.gz	QWEBKGRMHNRQEU-QGZVFWFLSA-N	0	3	329.444	3.308	20	30		EGEDHN
COCCCCC(=O)N[C@H](C)CCCCNCc1ccccc1C#N	ZINC001169656134	1384169301	/nfs/dbraw/zinc/16/93/01/1384169301.db2.gz	QOZJFZFTCICQNP-QGZVFWFLSA-N	0	3	345.487	3.140	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)c1cscn1	ZINC001169738474	1384180903	/nfs/dbraw/zinc/18/09/03/1384180903.db2.gz	RFPBQLVMUYKUCZ-CQSZACIVSA-N	0	3	342.468	3.093	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@H](C)CCCCNCc1nsc2ccccc12	ZINC001169822190	1384188941	/nfs/dbraw/zinc/18/89/41/1384188941.db2.gz	RRKWCHCQSUGXHP-ZIAGYGMSSA-N	0	3	344.484	3.221	20	30		EGEDHN
N#Cc1ccc(CCN2CCCC[C@@H]2COC(=O)N2CCCC2)cc1	ZINC001170141843	1384246576	/nfs/dbraw/zinc/24/65/76/1384246576.db2.gz	WJOUMMGMWBGTGA-LJQANCHMSA-N	0	3	341.455	3.188	20	30		EGEDHN
CC[C@H](SC)C(=O)N[C@@H](C)CCCCNCc1ccccc1C#N	ZINC001170213289	1384266481	/nfs/dbraw/zinc/26/64/81/1384266481.db2.gz	XZBINRCBJHBICG-YJBOKZPZSA-N	0	3	347.528	3.464	20	30		EGEDHN
C#CCCCC(=O)N[C@H](C)CCCCNCc1nc2ccccc2o1	ZINC001170425808	1384315968	/nfs/dbraw/zinc/31/59/68/1384315968.db2.gz	QXUQQQOQNVWQDM-MRXNPFEDSA-N	0	3	341.455	3.396	20	30		EGEDHN
CC[C@H](CC(C)C)C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001170511307	1384332073	/nfs/dbraw/zinc/33/20/73/1384332073.db2.gz	PTFYOFPXEIHCQL-MRXNPFEDSA-N	0	3	333.451	3.366	20	30		EGEDHN
CC[C@H](CC(C)C)C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001170511559	1384332286	/nfs/dbraw/zinc/33/22/86/1384332286.db2.gz	SWOAKCVPPGDDJV-MRXNPFEDSA-N	0	3	333.451	3.366	20	30		EGEDHN
C[C@H](N)c1ncc(-c2ccccc2)n1-c1ccc([N+](=O)[O-])cc1C#N	ZINC001170683116	1384364964	/nfs/dbraw/zinc/36/49/64/1384364964.db2.gz	VNDODCZJCCOALH-LBPRGKRZSA-N	0	3	333.351	3.339	20	30		EGEDHN
N#Cc1cccc([C@@H](O)CN2CC[C@]3(C2)CCc2ccccc2O3)c1	ZINC001170733037	1384375153	/nfs/dbraw/zinc/37/51/53/1384375153.db2.gz	PTCDSUPGTBRXTM-FPOVZHCZSA-N	0	3	334.419	3.061	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H](C)CCCCNCc1cc(C)n(C)n1	ZINC001170961904	1384419093	/nfs/dbraw/zinc/41/90/93/1384419093.db2.gz	FVQWHVPUGSCWTH-INIZCTEOSA-N	0	3	346.519	3.262	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H](C)CCCCN[C@H](C)c1nnc(CC)[nH]1	ZINC001170997965	1384427184	/nfs/dbraw/zinc/42/71/84/1384427184.db2.gz	NCGSCLCDNADHRL-HUUCEWRRSA-N	0	3	349.523	3.295	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H](C)CCCCNCc1cn(C(C)(C)C)nn1	ZINC001171043907	1384435767	/nfs/dbraw/zinc/43/57/67/1384435767.db2.gz	RDDAIFXHCZVHCX-INIZCTEOSA-N	0	3	349.523	3.154	20	30		EGEDHN
C[C@@H](Cc1cccc(C#N)c1)N1CC(CCNC(=O)OC(C)(C)C)C1	ZINC001171222923	1384472491	/nfs/dbraw/zinc/47/24/91/1384472491.db2.gz	JNYUHLXVHOGABA-HNNXBMFYSA-N	0	3	343.471	3.336	20	30		EGEDHN
COC(=O)c1ccc2c(c1)CN([C@@H](C)Cc1cccc(C#N)c1)CC2	ZINC001171224981	1384473307	/nfs/dbraw/zinc/47/33/07/1384473307.db2.gz	WIXPITPGVOWCGI-HNNXBMFYSA-N	0	3	334.419	3.334	20	30		EGEDHN
Cc1ccnc(O[C@H]2CCCN([C@@H](C)Cc3cccc(C#N)c3)C2)n1	ZINC001171231324	1384474904	/nfs/dbraw/zinc/47/49/04/1384474904.db2.gz	IKRUEURDQKJATO-LPHOPBHVSA-N	0	3	336.439	3.131	20	30		EGEDHN
C[C@H](CC(=O)NCCCNCc1ccc(C#N)cc1F)c1ccco1	ZINC001171387143	1384509580	/nfs/dbraw/zinc/50/95/80/1384509580.db2.gz	XOZWKGFRVWOZTN-CQSZACIVSA-N	0	3	343.402	3.080	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)[C@@H]1CCC1(F)F	ZINC001171446263	1384526713	/nfs/dbraw/zinc/52/67/13/1384526713.db2.gz	YNHRTOKMKNNIFM-YOEHRIQHSA-N	0	3	349.425	3.368	20	30		EGEDHN
C[C@H]1C[C@H](NC2(C#N)Cc3ccccc3C2)CN1Cc1ccccc1	ZINC001171742871	1384622654	/nfs/dbraw/zinc/62/26/54/1384622654.db2.gz	ZGPJWYSHJZQCCL-UWJYYQICSA-N	0	3	331.463	3.300	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CN([C@@H]3Cc4cccc(F)c4C3)C2)CC1	ZINC001171795491	1384640028	/nfs/dbraw/zinc/64/00/28/1384640028.db2.gz	XMRFUGSHTFEZQM-MRXNPFEDSA-N	0	3	344.430	3.013	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)c1cc(F)c[nH]1	ZINC001171832157	1384654733	/nfs/dbraw/zinc/65/47/33/1384654733.db2.gz	RVLLFIVYGDCVSZ-CQSZACIVSA-N	0	3	342.418	3.104	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1cnn(C(C)C)c1	ZINC001316878619	1384663211	/nfs/dbraw/zinc/66/32/11/1384663211.db2.gz	HXOKIHWKLYJUCN-ZBFHGGJFSA-N	0	3	338.883	3.189	20	30		EGEDHN
N#Cc1c[nH]c(C(=O)N[C@@H]2CCCN(CC/C=C/c3ccccc3)C2)c1	ZINC001316939932	1384710544	/nfs/dbraw/zinc/71/05/44/1384710544.db2.gz	CBOXZTISDNHTSV-ROSSNEFBSA-N	0	3	348.450	3.184	20	30		EGEDHN
N#Cc1ccc(N2CCN([C@@H]3CSc4ccccc4C3)CC2)cc1	ZINC001172204269	1384747726	/nfs/dbraw/zinc/74/77/26/1384747726.db2.gz	YDHXSLBIZMQIFR-IBGZPJMESA-N	0	3	335.476	3.397	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)N1CCN(CCc2cccs2)CC1	ZINC001172308117	1384765048	/nfs/dbraw/zinc/76/50/48/1384765048.db2.gz	TVGZPRCSBBEYGL-KRWDZBQOSA-N	0	3	339.508	3.411	20	30		EGEDHN
N#CCCN(C1CCCC1)[C@H]1CCN(Cc2ccccc2)C(=O)C1	ZINC001172675622	1384831629	/nfs/dbraw/zinc/83/16/29/1384831629.db2.gz	ICVOEFBKKUBFLE-IBGZPJMESA-N	0	3	325.456	3.336	20	30		EGEDHN
N#Cc1ccc(C2(N[C@H]3CCN(Cc4ccccc4)C(=O)C3)CC2)cc1	ZINC001172678917	1384831995	/nfs/dbraw/zinc/83/19/95/1384831995.db2.gz	HRXQOZIJFMDKOU-FQEVSTJZSA-N	0	3	345.446	3.328	20	30		EGEDHN
COc1ccc([N+](=O)[O-])c(C[C@H](C)NCc2csc(C#N)c2)c1F	ZINC001173181774	1384932707	/nfs/dbraw/zinc/93/27/07/1384932707.db2.gz	QMXPPOCMIGOHTF-JTQLQIEISA-N	0	3	349.387	3.396	20	30		EGEDHN
N#CCC1CCC(N2CCN(c3cccc4c3OCCO4)CC2)CC1	ZINC001173338771	1384961579	/nfs/dbraw/zinc/96/15/79/1384961579.db2.gz	ISWWGZMSCPEBHA-UHFFFAOYSA-N	0	3	341.455	3.052	20	30		EGEDHN
CCCCN(CCC#N)C1CCN(C(=O)c2ccc(OC)cc2)CC1	ZINC001173405910	1384966965	/nfs/dbraw/zinc/96/69/65/1384966965.db2.gz	GOCRCJAYPHSCHA-UHFFFAOYSA-N	0	3	343.471	3.316	20	30		EGEDHN
CC1(C#N)CCC(N2CCN(c3cccc4c3OCCO4)CC2)CC1	ZINC001173600331	1384985449	/nfs/dbraw/zinc/98/54/49/1384985449.db2.gz	ZZEIXEDUAPAWAH-UHFFFAOYSA-N	0	3	341.455	3.052	20	30		EGEDHN
Cc1cc(C)c(C(=O)NC[C@H](C)NCc2ccc(C#N)s2)s1	ZINC001317243179	1385016320	/nfs/dbraw/zinc/01/63/20/1385016320.db2.gz	XKZODZMBUPZAIJ-NSHDSACASA-N	0	3	333.482	3.206	20	30		EGEDHN
CC(C)CC(C)(C)C(=O)N1CC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001317307885	1385073692	/nfs/dbraw/zinc/07/36/92/1385073692.db2.gz	WVVMQEFHXPZRGR-KRWDZBQOSA-N	0	3	345.462	3.460	20	30		EGEDHN
CCCC1(C(=O)NCC[C@H](C)NCc2cc(C#N)ccc2F)CC1	ZINC001317405603	1385118532	/nfs/dbraw/zinc/11/85/32/1385118532.db2.gz	LNJDDZXMJTVDHN-AWEZNQCLSA-N	0	3	331.435	3.262	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H](C)CCCCNCc1ccn(CC)n1	ZINC001174848611	1385159431	/nfs/dbraw/zinc/15/94/31/1385159431.db2.gz	FBLPZYXUFZPYHX-SJORKVTESA-N	0	3	334.508	3.270	20	30		EGEDHN
C=CCCCC(=O)N[C@@H](C)CCCCNCc1nnc(C)n1CCC	ZINC001174985889	1385179238	/nfs/dbraw/zinc/17/92/38/1385179238.db2.gz	CAAGFWHMLZFMMT-INIZCTEOSA-N	0	3	349.523	3.117	20	30		EGEDHN
CCN(CCNC(=O)[C@@H]1CCCC(F)(F)C1)Cc1cccc(C#N)c1	ZINC001317487456	1385185635	/nfs/dbraw/zinc/18/56/35/1385185635.db2.gz	LRLXBQNWQKXNGY-QGZVFWFLSA-N	0	3	349.425	3.322	20	30		EGEDHN
CCN(CCNC(=O)CCc1ccccc1)Cc1cccc(C#N)c1	ZINC001317490628	1385190367	/nfs/dbraw/zinc/19/03/67/1385190367.db2.gz	CWVVEMJKQUYADT-UHFFFAOYSA-N	0	3	335.451	3.129	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@H](C)CCCCNCc1cc(C)n(C)n1	ZINC001175081937	1385191456	/nfs/dbraw/zinc/19/14/56/1385191456.db2.gz	LBBPZPBNVONLEW-BEFAXECRSA-N	0	3	334.508	3.095	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H](C)CCCCNCc2ccn(CC)n2)CC1	ZINC001175083097	1385191885	/nfs/dbraw/zinc/19/18/85/1385191885.db2.gz	VBWOIGRQBSSHRN-QGZVFWFLSA-N	0	3	346.519	3.414	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H](C)CCCCNCc2cnc(C)o2)CC1	ZINC001175083412	1385192506	/nfs/dbraw/zinc/19/25/06/1385192506.db2.gz	YZKCHONDEFJTQO-HNNXBMFYSA-N	0	3	333.476	3.494	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)CCCCNCc2cc(C)no2)CCC1	ZINC001175089623	1385193085	/nfs/dbraw/zinc/19/30/85/1385193085.db2.gz	NMOPHBRKTKPEKH-OAHLLOKOSA-N	0	3	333.476	3.494	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1ccc2c(c1)CCCC2	ZINC001175308775	1385247610	/nfs/dbraw/zinc/24/76/10/1385247610.db2.gz	VOWDFUCGJQCMML-UHFFFAOYSA-N	0	3	347.462	3.347	20	30		EGEDHN
C=C[C@@H](C(=O)NCCCNCC=C(Cl)Cl)c1ccccc1	ZINC001176781663	1385695277	/nfs/dbraw/zinc/69/52/77/1385695277.db2.gz	IZPLTULPPBNLPN-CQSZACIVSA-N	0	3	327.255	3.371	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)c1cc(C)on1	ZINC001177207344	1385863530	/nfs/dbraw/zinc/86/35/30/1385863530.db2.gz	LAWHOTRDGODEPP-UHFFFAOYSA-N	0	3	339.867	3.348	20	30		EGEDHN
N#CC(Cc1cccs1)C(=O)Nc1csc(Br)n1	ZINC001177903239	1386078446	/nfs/dbraw/zinc/07/84/46/1386078446.db2.gz	GHSLIRPFCBCODI-SSDOTTSWSA-N	0	3	342.243	3.288	20	30		EGEDHN
N#CC(Cc1cccs1)C(=O)Nc1c(Cl)cnnc1Cl	ZINC001177903923	1386079532	/nfs/dbraw/zinc/07/95/32/1386079532.db2.gz	LOEHAPIWJSOCJI-ZETCQYMHSA-N	0	3	327.196	3.166	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cn3ccc(C)cc3n2)CCCC1	ZINC001319363064	1386080267	/nfs/dbraw/zinc/08/02/67/1386080267.db2.gz	OPMQUPLPZVBXET-UHFFFAOYSA-N	0	3	346.862	3.027	20	30		EGEDHN
CC(C)[C@@H](C)CC(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C	ZINC001178308523	1386184976	/nfs/dbraw/zinc/18/49/76/1386184976.db2.gz	JKNWFCPRHCAAML-BJLQDIEVSA-N	0	3	326.484	3.299	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2Cl)CCN1C(=O)/C=C\C1CC1	ZINC001178418165	1386211694	/nfs/dbraw/zinc/21/16/94/1386211694.db2.gz	MISNLUCWXYJZQY-IFCXGXMFSA-N	0	3	342.870	3.237	20	30		EGEDHN
CC1CC(C(=O)N2CC[C@H](NCC#Cc3cccc(Cl)c3)[C@@H]2C)C1	ZINC001178455569	1386223182	/nfs/dbraw/zinc/22/31/82/1386223182.db2.gz	IEGDYLJFCHRIQD-ULGDZEHDSA-N	0	3	344.886	3.317	20	30		EGEDHN
C=C(C)CCC(=O)NCCCCCCNCc1cn(C(C)(C)C)nn1	ZINC001178598317	1386259135	/nfs/dbraw/zinc/25/91/35/1386259135.db2.gz	AHDCQKORMACIPZ-UHFFFAOYSA-N	0	3	349.523	3.156	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@H](NCc2cc(Cl)ccc2F)[C@@H]1C	ZINC001178645436	1386268144	/nfs/dbraw/zinc/26/81/44/1386268144.db2.gz	LPZHVDVNOFFBFU-GUYCJALGSA-N	0	3	336.838	3.218	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](NCc2cccc(Cl)n2)[C@@H]1C	ZINC001179314078	1386448425	/nfs/dbraw/zinc/44/84/25/1386448425.db2.gz	PQKRCWHRUHSJGE-RDJZCZTQSA-N	0	3	347.890	3.398	20	30		EGEDHN
CC[C@H](F)C(=O)N1CC[C@H](NCC#Cc2ccccc2Cl)[C@@H]1C	ZINC001179313747	1386448756	/nfs/dbraw/zinc/44/87/56/1386448756.db2.gz	JNYGLEAICKEYII-JQFCIGGWSA-N	0	3	336.838	3.019	20	30		EGEDHN
CC#CCCCC(=O)NCCCCCCNCc1ccn(C(C)C)n1	ZINC001179320414	1386451404	/nfs/dbraw/zinc/45/14/04/1386451404.db2.gz	SPSJHAQBVQPLFE-UHFFFAOYSA-N	0	3	346.519	3.424	20	30		EGEDHN
N#Cc1ccccc1CNCCCCCCNC(=O)[C@@H]1CC[C@@H](F)C1	ZINC001179388044	1386470722	/nfs/dbraw/zinc/47/07/22/1386470722.db2.gz	LJOLUIOHSWXMLX-VQIMIIECSA-N	0	3	345.462	3.463	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCCCCCNCc1cn(C(C)C)nn1	ZINC001179482207	1386495062	/nfs/dbraw/zinc/49/50/62/1386495062.db2.gz	RMCVJOJPJFRJGX-IBGZPJMESA-N	0	3	349.523	3.228	20	30		EGEDHN
C=CCC1(C(=O)NCCCCCCNCc2ocnc2C)CCC1	ZINC001179492913	1386497683	/nfs/dbraw/zinc/49/76/83/1386497683.db2.gz	SQFMOCQSHBIMRP-UHFFFAOYSA-N	0	3	333.476	3.496	20	30		EGEDHN
N#Cc1ccc(F)cc1CNCCCCCCNC(=O)[C@H]1CC12CC2	ZINC001179677740	1386550116	/nfs/dbraw/zinc/55/01/16/1386550116.db2.gz	CJZKPMFLGNXKLB-GOSISDBHSA-N	0	3	343.446	3.264	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)CCC(C)(C)C	ZINC001179754752	1386573364	/nfs/dbraw/zinc/57/33/64/1386573364.db2.gz	FPSZKVGWQGQEMD-HKUYNNGSSA-N	0	3	326.484	3.443	20	30		EGEDHN
CC[C@@H](C)CCC(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C	ZINC001179775371	1386580918	/nfs/dbraw/zinc/58/09/18/1386580918.db2.gz	PFPBONNZBISQAC-HBFSDRIKSA-N	0	3	326.484	3.443	20	30		EGEDHN
CS[C@@H]1CC[C@@H](N(C)[C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)C1	ZINC001321021878	1386785409	/nfs/dbraw/zinc/78/54/09/1386785409.db2.gz	MXVDGFGZNAIETM-KZNAEPCWSA-N	0	3	343.496	3.270	20	30		EGEDHN
CC1CC(C(=O)N2C[C@@H](C)[C@](C)(CNCc3ccccc3C#N)C2)C1	ZINC001181055939	1386926252	/nfs/dbraw/zinc/92/62/52/1386926252.db2.gz	JMGKAEJHLJZDEG-HVPGBKFDSA-N	0	3	339.483	3.179	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)CCn1cc(C)c2ccccc21	ZINC001181210667	1386960036	/nfs/dbraw/zinc/96/00/36/1386960036.db2.gz	LWBPPMBQCOBXNG-KRWDZBQOSA-N	0	3	325.456	3.106	20	30		EGEDHN
CCc1ccc(C(=O)N[C@@H](C)CNCc2ccc(C#N)s2)s1	ZINC001321914577	1387008679	/nfs/dbraw/zinc/00/86/79/1387008679.db2.gz	BAKCNUWRANOILY-NSHDSACASA-N	0	3	333.482	3.152	20	30		EGEDHN
Cc1ccccc1CCC(=O)N[C@@H](C)CNCc1ccc(C#N)s1	ZINC001322001960	1387027633	/nfs/dbraw/zinc/02/76/33/1387027633.db2.gz	FYWWXFHCXGWAKN-HNNXBMFYSA-N	0	3	341.480	3.155	20	30		EGEDHN
CCN1CCCC[C@@H]1C(=O)N1CCC(Cc2ccc(C#N)cc2)CC1	ZINC001181993151	1387088613	/nfs/dbraw/zinc/08/86/13/1387088613.db2.gz	AQGBJISDMKTWTD-HXUWFJFHSA-N	0	3	339.483	3.214	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)c1cccc2[nH]ccc21	ZINC001322246944	1387119108	/nfs/dbraw/zinc/11/91/08/1387119108.db2.gz	BORRGZZHGVPKAP-HNNXBMFYSA-N	0	3	346.434	3.290	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2ccn(CC)n2)C1	ZINC001182750046	1387218530	/nfs/dbraw/zinc/21/85/30/1387218530.db2.gz	HMRVJDMEAVVDBL-OXQOHEQNSA-N	0	3	346.519	3.080	20	30		EGEDHN
CCCC(=O)NCCC1CCN(Cc2ccc(OC)c(C#N)c2)CC1	ZINC001698721539	1406367507	/nfs/dbraw/zinc/36/75/07/1406367507.db2.gz	JZIRMPUVOGVMNK-UHFFFAOYSA-N	0	3	343.471	3.085	20	30		EGEDHN
C[C@@H](CC(=O)N1CCC[C@@H]1CNCC#Cc1ccccc1)n1cccc1	ZINC001698746723	1406397958	/nfs/dbraw/zinc/39/79/58/1406397958.db2.gz	VSDGRCXIHVREDL-PZJWPPBQSA-N	0	3	349.478	3.072	20	30		EGEDHN
Cc1ccc2c(c1)[C@H]1CN(C)CC[C@@H]1N2C(=O)c1ccc(C#N)cc1F	ZINC001338834753	1389784545	/nfs/dbraw/zinc/78/45/45/1389784545.db2.gz	PATSJHLLVNNMRC-XLIONFOSSA-N	0	3	349.409	3.454	20	30		EGEDHN
C[C@H](N[C@@H]1CCC[C@@H](C#N)C1)C(=O)Nc1cccc(N2CCCC2)c1	ZINC001331567093	1389804566	/nfs/dbraw/zinc/80/45/66/1389804566.db2.gz	UUZGWCUGJUUFBF-GVDBMIGSSA-N	0	3	340.471	3.286	20	30		EGEDHN
C=CCC[C@H]1CCCN1C(=O)[C@H]1CCCN(Cc2cccnc2)C1	ZINC001339281406	1389972817	/nfs/dbraw/zinc/97/28/17/1389972817.db2.gz	QWXGUKUPYGZJNA-OALUTQOASA-N	0	3	327.472	3.251	20	30		EGEDHN
CC(C)(C)[C@@H](CNCc1ccc(C#N)s1)NC(=O)c1ccsn1	ZINC001332809276	1390192026	/nfs/dbraw/zinc/19/20/26/1390192026.db2.gz	XGRDRSCZSKWUMA-CQSZACIVSA-N	0	3	348.497	3.011	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N[C@@H](CC)c1nc(C(F)(F)F)cs1	ZINC001339993462	1390204715	/nfs/dbraw/zinc/20/47/15/1390204715.db2.gz	ROQAVWGSTXLRKN-ZJUUUORDSA-N	0	3	335.395	3.413	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)[C@@H]1CCCC(F)(F)C1	ZINC001698769280	1406427713	/nfs/dbraw/zinc/42/77/13/1406427713.db2.gz	XWVCCVAFRFFTIY-HUUCEWRRSA-N	0	3	349.425	3.226	20	30		EGEDHN
C[C@]1(Cc2ccc(F)cc2)CCCN1C(=O)[C@H](N)CCCCC#N	ZINC001333276612	1390275133	/nfs/dbraw/zinc/27/51/33/1390275133.db2.gz	KZXIDMYIEQGECY-IEBWSBKVSA-N	0	3	331.435	3.161	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC001334162633	1390492000	/nfs/dbraw/zinc/49/20/00/1390492000.db2.gz	SXSMLSGTGNTCJW-LJQANCHMSA-N	0	3	343.515	3.307	20	30		EGEDHN
N#CC(C(=O)[C@H]1[C@H]2[C@@H]1[C@@H]1CC[C@H]2C1)c1nccn1Cc1ccccc1	ZINC001342164182	1390580540	/nfs/dbraw/zinc/58/05/40/1390580540.db2.gz	GHJFSKGYGFCHBC-JWXAEQQXSA-N	0	3	331.419	3.400	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CCCN(C)C2)nnc1N1C[C@@H]2CC=CC[C@@H]2C1	ZINC001342355742	1390604361	/nfs/dbraw/zinc/60/43/61/1390604361.db2.gz	SWYJHGSPUWSFGM-KSZLIROESA-N	0	3	341.503	3.066	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1Cl)C(=O)c1ccnc(Cl)c1	ZINC001342521524	1390621709	/nfs/dbraw/zinc/62/17/09/1390621709.db2.gz	SEOATCOKBOJNJW-SNVBAGLBSA-N	0	3	334.162	3.350	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CCCN(C)C2)nnc1N1CC[C@@H](C)[C@@H](C)C1	ZINC001343786599	1390736953	/nfs/dbraw/zinc/73/69/53/1390736953.db2.gz	GGLFCPYMJWILNY-IKGGRYGDSA-N	0	3	331.508	3.146	20	30		EGEDHN
N#Cc1ccccc1Oc1ccc(NC(=O)N2CCN3CC[C@H]2C3)cc1	ZINC001346395127	1390932076	/nfs/dbraw/zinc/93/20/76/1390932076.db2.gz	LHSJMSUTXDFUGR-KRWDZBQOSA-N	0	3	348.406	3.272	20	30		EGEDHN
CCN1C[C@H](C)N(c2nnc([C@@H](C)CCC#N)n2CC2CC2)C[C@@H]1C	ZINC001346901819	1390985817	/nfs/dbraw/zinc/98/58/17/1390985817.db2.gz	SFNUWLWGZDERTD-JYJNAYRXSA-N	0	3	344.507	3.014	20	30		EGEDHN
N#CCOc1ccc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)cc1	ZINC001349499273	1391335874	/nfs/dbraw/zinc/33/58/74/1391335874.db2.gz	SWYGJGGEVABFDB-UONOGXRCSA-N	0	3	342.317	3.275	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)C(C)(C)CC(C)C)C1	ZINC001479407208	1392235889	/nfs/dbraw/zinc/23/58/89/1392235889.db2.gz	CEONQGIXRDVRNM-HDJSIYSDSA-N	0	3	345.325	3.452	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)COC1CCCCC1	ZINC001479825067	1392413519	/nfs/dbraw/zinc/41/35/19/1392413519.db2.gz	JIQWKJAUZRLSHE-DOTOQJQBSA-N	0	3	342.911	3.447	20	30		EGEDHN
N#Cc1ccc(CN[C@H](CNC(=O)C(C2CC2)C2CC2)C2CC2)s1	ZINC001480057335	1392554906	/nfs/dbraw/zinc/55/49/06/1392554906.db2.gz	LOUITWOZRXXHOK-QGZVFWFLSA-N	0	3	343.496	3.040	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccc2cc[nH]c2c1)NCc1ccc(C#N)s1	ZINC001480541835	1392785547	/nfs/dbraw/zinc/78/55/47/1392785547.db2.gz	HOVJZEBOMVSINT-LBPRGKRZSA-N	0	3	338.436	3.009	20	30		EGEDHN
CCC(C)(C)CC(=O)N1CC[C@H](CNCc2ccccc2C#N)C1	ZINC001480643827	1392834180	/nfs/dbraw/zinc/83/41/80/1392834180.db2.gz	LMYOXDMXLLIGLC-MRXNPFEDSA-N	0	3	327.472	3.323	20	30		EGEDHN
CCCN(C(=O)[C@H](C)C#N)C1CCN(CCc2ccccc2F)CC1	ZINC001490612310	1394282187	/nfs/dbraw/zinc/28/21/87/1394282187.db2.gz	FANLANCCNIEUEA-MRXNPFEDSA-N	0	3	345.462	3.231	20	30		EGEDHN
CC1(C(=O)NCC[C@H]2CCN(Cc3ccc(F)c(C#N)c3)C2)CCC1	ZINC001481447940	1394301814	/nfs/dbraw/zinc/30/18/14/1394301814.db2.gz	UPPGVHRLLJXSRZ-HNNXBMFYSA-N	0	3	343.446	3.216	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N[C@H]1CCCN(Cc2ccc(C)cc2)C1)OCC	ZINC001481535185	1394394083	/nfs/dbraw/zinc/39/40/83/1394394083.db2.gz	OMYRZYMADHUTOD-VQTJNVASSA-N	0	3	344.499	3.447	20	30		EGEDHN
CC[C@@H](CNC(=O)c1cc(C#N)c[nH]1)N[C@H](C)c1ccc(F)cc1F	ZINC001481801737	1394536188	/nfs/dbraw/zinc/53/61/88/1394536188.db2.gz	WNBXYEYHRIVZTE-RISCZKNCSA-N	0	3	346.381	3.024	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1oc(CCC)nc1C)C1CC1	ZINC001481947613	1394612467	/nfs/dbraw/zinc/61/24/67/1394612467.db2.gz	VJJNJDZHKBDXRS-QGZVFWFLSA-N	0	3	339.867	3.176	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2ncccc2C)CCCC[C@@H]1C	ZINC001481957836	1394619300	/nfs/dbraw/zinc/61/93/00/1394619300.db2.gz	SFYYBTGJEUCAHX-KBXCAEBGSA-N	0	3	335.879	3.411	20	30		EGEDHN
COc1ccc(Cl)cc1CNC1(CNC(=O)[C@H](C)C#N)CCCC1	ZINC001482213401	1394807164	/nfs/dbraw/zinc/80/71/64/1394807164.db2.gz	MQKLNNDEYAHWFI-CYBMUJFWSA-N	0	3	349.862	3.027	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccccc2OCC)CCCC1	ZINC001482237702	1394833493	/nfs/dbraw/zinc/83/34/93/1394833493.db2.gz	RCRGAZABHWFCEU-UHFFFAOYSA-N	0	3	336.863	3.470	20	30		EGEDHN
Cc1cc(C(=O)N(C)[C@H](C)CNCc2ccc(C#N)s2)ccc1F	ZINC001482328096	1394898513	/nfs/dbraw/zinc/89/85/13/1394898513.db2.gz	YTIPLMCSYKRJFP-CYBMUJFWSA-N	0	3	345.443	3.318	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1ccc(Cl)c(OC)c1)C(C)C	ZINC001482555847	1395087730	/nfs/dbraw/zinc/08/77/30/1395087730.db2.gz	CSHKESFAKUSBBC-CQSZACIVSA-N	0	3	345.270	3.445	20	30		EGEDHN
C[C@H](CCNC(=O)c1cccc2c1CCC2)NCc1ccccc1C#N	ZINC001492133739	1396307058	/nfs/dbraw/zinc/30/70/58/1396307058.db2.gz	PZTHLYONJREEGS-MRXNPFEDSA-N	0	3	347.462	3.345	20	30		EGEDHN
Cc1cccc(CC(=O)NC[C@@H]2CCN(Cc3ccc(C#N)cc3)C2)c1	ZINC001493233213	1396338373	/nfs/dbraw/zinc/33/83/73/1396338373.db2.gz	JZQMZUKSAJIZDN-NRFANRHFSA-N	0	3	347.462	3.048	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H](C)CNCc2ccc(C#N)s2)sc1C	ZINC001498182084	1396933020	/nfs/dbraw/zinc/93/30/20/1396933020.db2.gz	SQLJSJFHYZAACO-NSHDSACASA-N	0	3	333.482	3.206	20	30		EGEDHN
C[C@H](C(=O)NCC1(NCc2ccc(OCC#N)cc2)CC1)C(C)(C)C	ZINC001499264383	1397071737	/nfs/dbraw/zinc/07/17/37/1397071737.db2.gz	XZBJLPFIJDUAIN-OAHLLOKOSA-N	0	3	343.471	3.010	20	30		EGEDHN
CCCCCCCN1CCC[C@H](NC(=O)c2cnn(C)c2Cl)C1	ZINC001690041251	1404276485	/nfs/dbraw/zinc/27/64/85/1404276485.db2.gz	JCCCKEQPVZYQSG-AWEZNQCLSA-N	0	3	340.899	3.238	20	30		EGEDHN
CCCC1(C(=O)NC[C@H]2CCN(Cc3ccc(C#N)cc3)C2)CCC1	ZINC001691154657	1405089729	/nfs/dbraw/zinc/08/97/29/1405089729.db2.gz	TVJMBYWCRLEZTA-LJQANCHMSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)C2(c3cccc(F)c3)CC2)C1	ZINC001691745710	1405466548	/nfs/dbraw/zinc/46/65/48/1405466548.db2.gz	OFOIZODRPUYTNV-AKAXFMLLSA-N	0	3	336.838	3.094	20	30		EGEDHN
CC(C)CCC(=O)NCC[C@@H]1CCN(Cc2ccccc2C#N)C1	ZINC001732044246	1428277561	/nfs/dbraw/zinc/27/75/61/1428277561.db2.gz	LEFJBOGAZNOWQR-QGZVFWFLSA-N	0	3	327.472	3.323	20	30		EGEDHN
Cc1cocc1C(=O)NCC[C@H]1CCN(Cc2ccccc2C#N)C1	ZINC001732053341	1428295159	/nfs/dbraw/zinc/29/51/59/1428295159.db2.gz	MVGDBRCOMRCWRA-INIZCTEOSA-N	0	3	337.423	3.102	20	30		EGEDHN
CC(C)c1occc1C(=O)N[C@@H](C)CNCc1ccc(C#N)s1	ZINC001699433537	1412753075	/nfs/dbraw/zinc/75/30/75/1412753075.db2.gz	DIXACJXOIVULPL-LBPRGKRZSA-N	0	3	331.441	3.244	20	30		EGEDHN
C[C@@]1(CNCc2ccccc2C#N)CCN(C(=O)C2C=CC=CC=C2)C1	ZINC001699834329	1413263331	/nfs/dbraw/zinc/26/33/31/1413263331.db2.gz	FPIRGGHONPOQES-QFIPXVFZSA-N	0	3	347.462	3.185	20	30		EGEDHN
Cc1cc(C(=O)NC[C@H](C)N(C)Cc2cccc(C#N)c2)sc1C	ZINC001700485078	1414130035	/nfs/dbraw/zinc/13/00/35/1414130035.db2.gz	GVPOLURROPDOHB-AWEZNQCLSA-N	0	3	341.480	3.487	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2ccc(F)c(C#N)c2)CN1C(=O)CCCC1CC1	ZINC001700841003	1414491505	/nfs/dbraw/zinc/49/15/05/1414491505.db2.gz	KNBZAIYVRQIOSX-RDTXWAMCSA-N	0	3	343.446	3.357	20	30		EGEDHN
COc1ccc(C#N)cc1CNC[C@@H](C)NC(=O)C1(C)CCCCC1	ZINC001732969665	1429095389	/nfs/dbraw/zinc/09/53/89/1429095389.db2.gz	UXNMAILKRYFNJM-OAHLLOKOSA-N	0	3	343.471	3.132	20	30		EGEDHN
CCC(CC)C(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1	ZINC001707286827	1417295640	/nfs/dbraw/zinc/29/56/40/1417295640.db2.gz	ZGQWEPPOCDFOJQ-UHFFFAOYSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)COC1CCCC1	ZINC001707432928	1417337875	/nfs/dbraw/zinc/33/78/75/1417337875.db2.gz	HBLCNANRBDNALK-ZBFHGGJFSA-N	0	3	328.884	3.057	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1c[nH]c2ncccc12	ZINC001707434449	1417338944	/nfs/dbraw/zinc/33/89/44/1417338944.db2.gz	KOCADIIDOYNZLQ-BBRMVZONSA-N	0	3	346.862	3.288	20	30		EGEDHN
CC(C)CC(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1cccc(C#N)c1	ZINC001713177729	1417750935	/nfs/dbraw/zinc/75/09/35/1417750935.db2.gz	WUNMHOHUYAJBGX-YQQQUEKLSA-N	0	3	325.456	3.216	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)c1cccc(C)c1F	ZINC001713408667	1418031753	/nfs/dbraw/zinc/03/17/53/1418031753.db2.gz	XHLPGFLKLLIGDR-GFCCVEGCSA-N	0	3	343.240	3.141	20	30		EGEDHN
C[C@H](NCCN(C)C(=O)c1cc(C#N)c[nH]1)c1ccc(F)c(Cl)c1	ZINC001713581487	1418383355	/nfs/dbraw/zinc/38/33/55/1418383355.db2.gz	IFJGKMWIVOWJLN-NSHDSACASA-N	0	3	348.809	3.102	20	30		EGEDHN
N#Cc1ccc(CN[C@H](CNC(=O)CCC2CCC2)C2CC2)s1	ZINC001713864397	1418661593	/nfs/dbraw/zinc/66/15/93/1418661593.db2.gz	NDTXKLPOOYXPNS-QGZVFWFLSA-N	0	3	331.485	3.184	20	30		EGEDHN
C[C@H](CCNC(=O)[C@@H](C)c1ccccc1)NCc1ccccc1C#N	ZINC001714494753	1419218822	/nfs/dbraw/zinc/21/88/22/1419218822.db2.gz	CGTNMUOIZVDOPK-SJORKVTESA-N	0	3	335.451	3.346	20	30		EGEDHN
CCCc1occc1C(=O)NCC[C@H](C)NCc1ccccc1C#N	ZINC001714495535	1419219591	/nfs/dbraw/zinc/21/95/91/1419219591.db2.gz	OOCPBYXWWVQVPC-HNNXBMFYSA-N	0	3	339.439	3.402	20	30		EGEDHN
COc1ccc(C#N)cc1CNC[C@@H](C)N(C)C(=O)C1CCCCC1	ZINC001714529161	1419255442	/nfs/dbraw/zinc/25/54/42/1419255442.db2.gz	FATLHNCXEXEXCK-OAHLLOKOSA-N	0	3	343.471	3.084	20	30		EGEDHN
C[C@@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)C1CCCCC1	ZINC001714531771	1419258503	/nfs/dbraw/zinc/25/85/03/1419258503.db2.gz	UDLITVRSGRYDEN-AWEZNQCLSA-N	0	3	331.435	3.214	20	30		EGEDHN
C[C@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)c1ccoc1Cl	ZINC001714581571	1419320810	/nfs/dbraw/zinc/32/08/10/1419320810.db2.gz	CUTOOSKXGIYJOC-LLVKDONJSA-N	0	3	349.793	3.194	20	30		EGEDHN
CCN(CCNC(=O)c1cccn1C(C)C)Cc1ccc(C#N)cc1	ZINC001714601092	1419358231	/nfs/dbraw/zinc/35/82/31/1419358231.db2.gz	XNBIJMAXQWFBLZ-UHFFFAOYSA-N	0	3	338.455	3.193	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@H]1CCCN(C[C@H]2CCC(F)(F)C2)C1	ZINC001714923849	1419676841	/nfs/dbraw/zinc/67/68/41/1419676841.db2.gz	PIFPIGCRBUAXSX-GJZGRUSLSA-N	0	3	326.431	3.052	20	30		EGEDHN
CCc1ccc(CN2CC[C@@H](NC(=O)CC#Cc3ccccc3)C2)cc1	ZINC001715006686	1419736270	/nfs/dbraw/zinc/73/62/70/1419736270.db2.gz	UZRGNUCBXBLGNJ-JOCHJYFZSA-N	0	3	346.474	3.381	20	30		EGEDHN
C=C(Br)CNC[C@](C)(NC(=O)CCC1(C)CC1)C1CC1	ZINC001715118100	1419863231	/nfs/dbraw/zinc/86/32/31/1419863231.db2.gz	GBYDAOOYJSDZJM-INIZCTEOSA-N	0	3	343.309	3.350	20	30		EGEDHN
CCc1ccccc1CC(=O)NC[C@@H](C)CNCc1ccccc1C#N	ZINC001715231404	1419963256	/nfs/dbraw/zinc/96/32/56/1419963256.db2.gz	AMXFEMYHMKYLHX-KRWDZBQOSA-N	0	3	349.478	3.205	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2scnc2Cl)CCCC1	ZINC001715309135	1420018282	/nfs/dbraw/zinc/01/82/82/1420018282.db2.gz	GRKHSNQJBMNUTP-UHFFFAOYSA-N	0	3	334.272	3.181	20	30		EGEDHN
C=C(Br)CNC[C@H]1[C@@H](C)CCCN1C(=O)CCC1CC1	ZINC001715350530	1420051218	/nfs/dbraw/zinc/05/12/18/1420051218.db2.gz	BJEJNSKVRPYBKR-WFASDCNBSA-N	0	3	343.309	3.302	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)c1cccs1)NCc1cc(C#N)ccc1F	ZINC001715487435	1420168993	/nfs/dbraw/zinc/16/89/93/1420168993.db2.gz	NZCUVAHDHMBOAH-MRXNPFEDSA-N	0	3	345.443	3.303	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)C1CC(C)(C)C1)NCc1ccc(C#N)cc1F	ZINC001715490186	1420171678	/nfs/dbraw/zinc/17/16/78/1420171678.db2.gz	AHIFRGKTSRMTSB-GOSISDBHSA-N	0	3	345.462	3.364	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)c3cccc4cc[nH]c43)CC2)cc1	ZINC001733257429	1429408811	/nfs/dbraw/zinc/40/88/11/1429408811.db2.gz	MZUCIFWDMDZTMM-UHFFFAOYSA-N	0	3	344.418	3.092	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)CC1CCCCC1	ZINC001716013841	1420467334	/nfs/dbraw/zinc/46/73/34/1420467334.db2.gz	JEPAJUXQFINCKX-MRXNPFEDSA-N	0	3	327.472	3.465	20	30		EGEDHN
C[C@H](CNC(=O)CC(C1CC1)C1CC1)N(C)Cc1cccc(C#N)c1	ZINC001717500019	1421443509	/nfs/dbraw/zinc/44/35/09/1421443509.db2.gz	OIJYQUNSSLODHU-OAHLLOKOSA-N	0	3	339.483	3.321	20	30		EGEDHN
CCC1(C(=O)N[C@H]2CCN(Cc3cccc(C#N)c3)[C@H](C)C2)CC1	ZINC001724996808	1425402749	/nfs/dbraw/zinc/40/27/49/1425402749.db2.gz	MPRMNDQOUHPUDO-QAPCUYQASA-N	0	3	325.456	3.218	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)c2cnc(C)s2)CC1	ZINC001725024274	1425440884	/nfs/dbraw/zinc/44/08/84/1425440884.db2.gz	QUTDPYHNOYCQJU-UHFFFAOYSA-N	0	3	341.908	3.378	20	30		EGEDHN
CCCCC(=O)N1CCC[C@@H]1CN(C)Cc1ccc(OCC#N)cc1	ZINC001725035263	1425457560	/nfs/dbraw/zinc/45/75/60/1425457560.db2.gz	IZCMUJOXLSDBHG-GOSISDBHSA-N	0	3	343.471	3.202	20	30		EGEDHN
CC1(C(=O)NC[C@@H]2CCCCCN2Cc2cccc(C#N)c2)CC1	ZINC001725235594	1425819347	/nfs/dbraw/zinc/81/93/47/1425819347.db2.gz	FUGYVZYVORPPLH-SFHVURJKSA-N	0	3	325.456	3.219	20	30		EGEDHN
C=C(Br)CNC[C@H](C1CC1)N(C)C(=O)C(C)(C)CC	ZINC001725469351	1426139012	/nfs/dbraw/zinc/13/90/12/1426139012.db2.gz	VLBMMFKOVIHXRV-CYBMUJFWSA-N	0	3	331.298	3.158	20	30		EGEDHN
C=C(Br)CNC[C@@H](NC(=O)c1ccc(C)o1)C(C)(C)C	ZINC001725738898	1426413712	/nfs/dbraw/zinc/41/37/12/1426413712.db2.gz	WEEUMNUCQMVDAQ-CYBMUJFWSA-N	0	3	343.265	3.231	20	30		EGEDHN
C=C(Cl)CNC[C@H](NC(=O)c1c(C)cc(C)nc1C)C(C)(C)C	ZINC001725744593	1426421860	/nfs/dbraw/zinc/42/18/60/1426421860.db2.gz	LGEOWDGBBLMQHL-HNNXBMFYSA-N	0	3	337.895	3.493	20	30		EGEDHN
CC(C)(C)[C@@H](CNCc1ccc(C#N)s1)NC(=O)Cc1ccco1	ZINC001725756278	1426435608	/nfs/dbraw/zinc/43/56/08/1426435608.db2.gz	NIPJVSREEDDGIV-MRXNPFEDSA-N	0	3	345.468	3.076	20	30		EGEDHN
CCCC1(C(=O)NC[C@H](NCc2ccc(C#N)s2)C2CC2)CC1	ZINC001731405618	1427367763	/nfs/dbraw/zinc/36/77/63/1427367763.db2.gz	OPNMHUSXBWRNKW-INIZCTEOSA-N	0	3	331.485	3.184	20	30		EGEDHN
CC(C)CCC(=O)N1CCC[C@@H](CNCc2ccccc2C#N)C1	ZINC001731507463	1427495111	/nfs/dbraw/zinc/49/51/11/1427495111.db2.gz	BQXWWGJVMNYFAO-KRWDZBQOSA-N	0	3	327.472	3.323	20	30		EGEDHN
O=C(C1CC=CC1)N1CCCC[C@H]1CNCC#Cc1ccc(F)cc1	ZINC001731544939	1427562161	/nfs/dbraw/zinc/56/21/61/1427562161.db2.gz	HQOCEBLSPDMOJY-FQEVSTJZSA-N	0	3	340.442	3.114	20	30		EGEDHN
CC(C)CCC(=O)NCC1(NCc2ccc(F)c(C#N)c2)CCC1	ZINC001733712288	1429928918	/nfs/dbraw/zinc/92/89/18/1429928918.db2.gz	SMSPIRSSXWGXGE-UHFFFAOYSA-N	0	3	331.435	3.262	20	30		EGEDHN
C[C@H](CNC(=O)C1CCCCCC1)N(C)Cc1cccc(C#N)c1	ZINC001734032845	1437820577	/nfs/dbraw/zinc/82/05/77/1437820577.db2.gz	UOYGPGZJPFFVIL-MRXNPFEDSA-N	0	3	327.472	3.465	20	30		EGEDHN
C[C@@H](CNC(=O)CCc1ccsc1)N(C)Cc1cccc(C#N)c1	ZINC001734040702	1437829168	/nfs/dbraw/zinc/82/91/68/1437829168.db2.gz	MEEJHHWZPULTLR-HNNXBMFYSA-N	0	3	341.480	3.189	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@]2(C1)CN(CC1CCCCC1)CCO2	ZINC001734141706	1437910916	/nfs/dbraw/zinc/91/09/16/1437910916.db2.gz	ZMDUSFPWQAOCOK-NRFANRHFSA-N	0	3	348.531	3.472	20	30		EGEDHN
COc1ccc(CN[C@H]2C[C@H](C)N(C(=O)CCC(C)C)C2)cc1C#N	ZINC001734407132	1438084960	/nfs/dbraw/zinc/08/49/60/1438084960.db2.gz	SZFLERHMFCBMQP-YJBOKZPZSA-N	0	3	343.471	3.082	20	30		EGEDHN
CN(CCCNC(=O)[C@H]1CCCC1(C)C)Cc1ccc(C#N)c(F)c1	ZINC001752042957	1440134900	/nfs/dbraw/zinc/13/49/00/1440134900.db2.gz	SALQNWJWJIBLGW-QGZVFWFLSA-N	0	3	345.462	3.462	20	30		EGEDHN
C=C(Br)CN[C@@H](C)[C@H]1CCCCN1C(=O)CC1(C)CC1	ZINC001752142843	1440145068	/nfs/dbraw/zinc/14/50/68/1440145068.db2.gz	KGRXVDIBEHWDKE-UONOGXRCSA-N	0	3	343.309	3.444	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1cc(C)nc(C)c1	ZINC001752146754	1440146215	/nfs/dbraw/zinc/14/62/15/1440146215.db2.gz	PBFLLLZWFDVRDU-NVXWUHKLSA-N	0	3	335.879	3.424	20	30		EGEDHN
Cc1c[nH]cc1C(=O)N1CCCC[C@H]1[C@H](C)NCC#Cc1ccccc1	ZINC001752154641	1440146741	/nfs/dbraw/zinc/14/67/41/1440146741.db2.gz	DBZDUDZYOKFYFI-RXVVDRJESA-N	0	3	349.478	3.348	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1cnn(C(F)F)c1	ZINC001752156872	1440147405	/nfs/dbraw/zinc/14/74/05/1440147405.db2.gz	IDSUETMQNOEANF-WCQYABFASA-N	0	3	346.809	3.004	20	30		EGEDHN
C=CCOCC(=O)N[C@@H]1CC12CCN(Cc1cccc(Cl)c1)CC2	ZINC001752421023	1440175777	/nfs/dbraw/zinc/17/57/77/1440175777.db2.gz	HGTMISGSJQXSAR-QGZVFWFLSA-N	0	3	348.874	3.013	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CC12CCN(Cc1ccccn1)CC2	ZINC001752436831	1440180340	/nfs/dbraw/zinc/18/03/40/1440180340.db2.gz	ZCMGVSNCUZORJO-QGZVFWFLSA-N	0	3	327.472	3.155	20	30		EGEDHN
C=CCN1CCC(N(CCC)C(=O)CCc2nc(C)cs2)CC1	ZINC001752439540	1440180875	/nfs/dbraw/zinc/18/08/75/1440180875.db2.gz	HFZVKIUJQZPFEJ-UHFFFAOYSA-N	0	3	335.517	3.273	20	30		EGEDHN
C=CCN1CCC(N(CCC)C(=O)c2ccc(N(C)C)c(F)c2)CC1	ZINC001752441626	1440181398	/nfs/dbraw/zinc/18/13/98/1440181398.db2.gz	IJNYKEVEWVNRCW-UHFFFAOYSA-N	0	3	347.478	3.394	20	30		EGEDHN
C[C@@H](C(=O)NC[C@@H](NCc1ccc(C#N)cc1F)C1CC1)C(C)(C)C	ZINC001752468566	1440184200	/nfs/dbraw/zinc/18/42/00/1440184200.db2.gz	JPAVRGUAVFVOKH-SCLBCKFNSA-N	0	3	345.462	3.364	20	30		EGEDHN
CC1(C(=O)NC[C@@H](NCc2cc(C#N)ccc2F)C2CC2)CCCC1	ZINC001752474694	1440185059	/nfs/dbraw/zinc/18/50/59/1440185059.db2.gz	ZVPXLVJVTBKOJW-GOSISDBHSA-N	0	3	343.446	3.262	20	30		EGEDHN
CC(C)c1[nH]ccc1C(=O)NC[C@@H](NCC#Cc1ccccc1)C1CC1	ZINC001752478729	1440185182	/nfs/dbraw/zinc/18/51/82/1440185182.db2.gz	AKLLKENELQJNGE-HXUWFJFHSA-N	0	3	349.478	3.288	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H](NCc2scnc2C)C2CC2)CC1	ZINC001752481932	1440185758	/nfs/dbraw/zinc/18/57/58/1440185758.db2.gz	IPUHHUKNBIJVNP-MRXNPFEDSA-N	0	3	333.501	3.182	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)N1CCC[C@@H](CN(C)CC#Cc2ccc(F)cc2)C1	ZINC001752516380	1440191478	/nfs/dbraw/zinc/19/14/78/1440191478.db2.gz	DRFKSLHGFJTVBU-IMFGXOCKSA-N	0	3	342.458	3.004	20	30		EGEDHN
C=CCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cccc2cccnc21	ZINC001752538387	1440194399	/nfs/dbraw/zinc/19/43/99/1440194399.db2.gz	JDTKZKYLVOEDGU-HDICACEKSA-N	0	3	335.451	3.490	20	30		EGEDHN
C=CCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cnn(C(C)C)c1C	ZINC001752542917	1440194734	/nfs/dbraw/zinc/19/47/34/1440194734.db2.gz	HQNGAUCSNHOWMI-CALCHBBNSA-N	0	3	330.476	3.027	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2c(c1)COC2	ZINC001752564653	1440195301	/nfs/dbraw/zinc/19/53/01/1440195301.db2.gz	HDNYBJNDGVGNQH-YSGRDPCXSA-N	0	3	340.467	3.360	20	30		EGEDHN
CCCCCC(C)(C)C(=O)NC1C[C@H]2CC[C@@H](C1)N2CC#CCOC	ZINC001752704008	1440202087	/nfs/dbraw/zinc/20/20/87/1440202087.db2.gz	XUHRUOHVGNAIRU-YQQQUEKLSA-N	0	3	348.531	3.354	20	30		EGEDHN
CC1(C)CC[C@@H](C(=O)N[C@H]2C[C@@H](NCC#Cc3ccc(F)cc3)C2)C1	ZINC001752765056	1440205577	/nfs/dbraw/zinc/20/55/77/1440205577.db2.gz	GGLYXIOYYXRQEI-QRQLOZEOSA-N	0	3	342.458	3.240	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc(OCCCC)cc2)C1	ZINC001752790472	1440213754	/nfs/dbraw/zinc/21/37/54/1440213754.db2.gz	ZBBFVJCWKWJQKJ-GOSISDBHSA-N	0	3	342.483	3.331	20	30		EGEDHN
C=CCOCCN1CCCC[C@H]1CNC(=O)[C@@H](C)c1cccc(C)c1	ZINC001752822721	1440221598	/nfs/dbraw/zinc/22/15/98/1440221598.db2.gz	MTYYNZTYBARKBL-ICSRJNTNSA-N	0	3	344.499	3.272	20	30		EGEDHN
C=CCN1CCCC[C@H]1CNC(=O)CCCOc1ccc(C)cc1	ZINC001752824868	1440223047	/nfs/dbraw/zinc/22/30/47/1440223047.db2.gz	GASADPVOIACQGC-SFHVURJKSA-N	0	3	330.472	3.311	20	30		EGEDHN
C[C@@H](NC(=O)CCC1CC1)[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001752835947	1440227867	/nfs/dbraw/zinc/22/78/67/1440227867.db2.gz	CSMDTKAYNNEARA-OXQOHEQNSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)C2(C(F)F)CCCC2)C1	ZINC001752840935	1440230442	/nfs/dbraw/zinc/23/04/42/1440230442.db2.gz	NGIWOJNHFOEXOJ-HUUCEWRRSA-N	0	3	326.431	3.052	20	30		EGEDHN
C=CCCOCC(=O)N[C@H](C)[C@H]1CCCN(Cc2ccc(F)cc2)C1	ZINC001752841447	1440230643	/nfs/dbraw/zinc/23/06/43/1440230643.db2.gz	QSXRDCHXXSVQSZ-AEFFLSMTSA-N	0	3	348.462	3.135	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC1CCC(NCc2ocnc2C)CC1	ZINC001752850059	1440233293	/nfs/dbraw/zinc/23/32/93/1440233293.db2.gz	IWJJFFABYRVJDT-UHFFFAOYSA-N	0	3	331.460	3.268	20	30		EGEDHN
C=CCC1(C(=O)NC2CCC(NCc3cnc(C)cn3)CC2)CCC1	ZINC001752853390	1440234145	/nfs/dbraw/zinc/23/41/45/1440234145.db2.gz	HUUBAKFCUQTPEL-UHFFFAOYSA-N	0	3	342.487	3.048	20	30		EGEDHN
C[C@H](C#N)C(=O)NC[C@@H](C)NCc1sc2ccccc2c1Cl	ZINC001752863544	1440236130	/nfs/dbraw/zinc/23/61/30/1440236130.db2.gz	AMDRNFXXLRMNIO-GHMZBOCLSA-N	0	3	335.860	3.309	20	30		EGEDHN
C=CCC1(C(=O)NC[C@H](C)NCc2ccc(C#N)c(F)c2)CCC1	ZINC001752899827	1440242597	/nfs/dbraw/zinc/24/25/97/1440242597.db2.gz	UCUZNMJRGKUCSA-AWEZNQCLSA-N	0	3	329.419	3.038	20	30		EGEDHN
Cc1csc(CN[C@@H]2CCC[C@H](NC(=O)C#CC(C)(C)C)C2)n1	ZINC001752970031	1440254836	/nfs/dbraw/zinc/25/48/36/1440254836.db2.gz	XAFNYMLMGGUMOU-CABCVRRESA-N	0	3	333.501	3.018	20	30		EGEDHN
CC#CCN(C)[C@@H]1CCCN(C(=O)c2ccsc2C(F)(F)F)C1	ZINC001752996528	1440262276	/nfs/dbraw/zinc/26/22/76/1440262276.db2.gz	FFSQCDULVYVPDZ-GFCCVEGCSA-N	0	3	344.402	3.327	20	30		EGEDHN
C[C@H](CCNC(=O)[C@@]1(C)CC=CCC1)NCc1cc(C#N)ccc1F	ZINC001753006842	1440266028	/nfs/dbraw/zinc/26/60/28/1440266028.db2.gz	RWPTVGOOLXELDE-QRWLVFNGSA-N	0	3	343.446	3.428	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)[C@@H]1C[C@H]1c1c(F)cccc1F	ZINC001753013197	1440267482	/nfs/dbraw/zinc/26/74/82/1440267482.db2.gz	BITXFUKDCWJLGI-JHJVBQTASA-N	0	3	342.817	3.305	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCC[C@H]1CCCN1Cc1ccc(OC)nc1	ZINC001753032049	1440273172	/nfs/dbraw/zinc/27/31/72/1440273172.db2.gz	IEMUVMACVNRDPC-KRWDZBQOSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCC[C@@H]1CCCN1Cc1ccc(OC)nc1	ZINC001753032050	1440273246	/nfs/dbraw/zinc/27/32/46/1440273246.db2.gz	IEMUVMACVNRDPC-QGZVFWFLSA-N	0	3	345.487	3.163	20	30		EGEDHN
CCN(CCNC(=O)C12CCC(CC1)CC2)Cc1ccc(C#N)cc1	ZINC001753094827	1440301955	/nfs/dbraw/zinc/30/19/55/1440301955.db2.gz	JMOXKEMSSVAMRQ-UHFFFAOYSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@H]1CCCN1Cc1ccc(OCC#N)cc1	ZINC001753106647	1440306538	/nfs/dbraw/zinc/30/65/38/1440306538.db2.gz	QYKPYGAAIYKCJK-GOSISDBHSA-N	0	3	341.455	3.026	20	30		EGEDHN
CCC[C@@H](C)CC(=O)NC[C@@H]1CCN(Cc2ccc(C#N)cc2)C1	ZINC001753122776	1440314188	/nfs/dbraw/zinc/31/41/88/1440314188.db2.gz	MTGPYHGIEZVKMY-APWZRJJASA-N	0	3	327.472	3.323	20	30		EGEDHN
CC[C@@H](CC(F)F)C(=O)NC[C@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC001753126993	1440315196	/nfs/dbraw/zinc/31/51/96/1440315196.db2.gz	GCJGFGWZDSNYLE-SJORKVTESA-N	0	3	349.425	3.178	20	30		EGEDHN
CC(C)C#CC(=O)N(C)CCNCc1cc(Cl)cc(Cl)c1	ZINC001753187494	1440337392	/nfs/dbraw/zinc/33/73/92/1440337392.db2.gz	JDYHEJAFVWCTCM-UHFFFAOYSA-N	0	3	327.255	3.201	20	30		EGEDHN
CC[C@H]1CC[C@H](C(=O)N(C)CCNCc2ccc(C#N)c(F)c2)CC1	ZINC001753253626	1440343385	/nfs/dbraw/zinc/34/33/85/1440343385.db2.gz	TXXJRKWTIXRFRE-JCNLHEQBSA-N	0	3	345.462	3.462	20	30		EGEDHN
Cc1cccc2oc(C(=O)N(C)CCNCc3ccc(C#N)cc3)cc21	ZINC001753266170	1440344831	/nfs/dbraw/zinc/34/48/31/1440344831.db2.gz	DULIHPVRNLYHPQ-UHFFFAOYSA-N	0	3	347.418	3.475	20	30		EGEDHN
C#CCCCC(=O)N1CCC([C@H](C)NC/C(Cl)=C\Cl)CC1	ZINC001753274763	1440346028	/nfs/dbraw/zinc/34/60/28/1440346028.db2.gz	IWWFDFXRNDABMS-JMRXEAOASA-N	0	3	331.287	3.326	20	30		EGEDHN
C#CCCN[C@H](CNC(=O)c1coc(C(C)(C)C)n1)c1ccccc1	ZINC001753298924	1440353283	/nfs/dbraw/zinc/35/32/83/1440353283.db2.gz	PDOYCDXGISMGOS-MRXNPFEDSA-N	0	3	339.439	3.056	20	30		EGEDHN
CC(C)CCC(=O)NCC[C@H]1CCN(Cc2ccc(C#N)s2)C1	ZINC001753320708	1440363136	/nfs/dbraw/zinc/36/31/36/1440363136.db2.gz	GKYXAGMAQYKJOC-HNNXBMFYSA-N	0	3	333.501	3.384	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N(CCC)[C@H]1CCN(CC=C(C)C)C1	ZINC001753323140	1440364823	/nfs/dbraw/zinc/36/48/23/1440364823.db2.gz	LYHPCEGRLWJMHK-NRFANRHFSA-N	0	3	338.495	3.490	20	30		EGEDHN
C#CCCN1CC[C@H](N(CCC)C(=O)[C@H](C)Oc2ccc(C)cc2)C1	ZINC001753323881	1440365338	/nfs/dbraw/zinc/36/53/38/1440365338.db2.gz	SGGCPKLUZDGBGO-OALUTQOASA-N	0	3	342.483	3.099	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CCC)C(=O)[C@H](C)OC2CCCCCC2)C1	ZINC001753328922	1440368349	/nfs/dbraw/zinc/36/83/49/1440368349.db2.gz	QJLCZNWOSXXBGA-RBUKOAKNSA-N	0	3	348.531	3.451	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC(CN(C)Cc2cc(C)no2)CC1	ZINC001753365346	1440384685	/nfs/dbraw/zinc/38/46/85/1440384685.db2.gz	DFXMTAPCZBVHDN-INIZCTEOSA-N	0	3	333.476	3.256	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H]2C[C@H]1CN2C(=O)c1ccc2[nH]nc(C)c2c1	ZINC001753423506	1440396022	/nfs/dbraw/zinc/39/60/22/1440396022.db2.gz	MYIZVPMHENLYLF-COXVUDFISA-N	0	3	338.455	3.125	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H]2C[C@H]1CN2C(=O)Cc1noc2ccccc12	ZINC001753423778	1440396148	/nfs/dbraw/zinc/39/61/48/1440396148.db2.gz	YLKZVJMWCIUNJQ-PMPSAXMXSA-N	0	3	339.439	3.010	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N(C)[C@@H]1CCN(Cc2cccc(N(C)C)c2)C1	ZINC001753441669	1440401958	/nfs/dbraw/zinc/40/19/58/1440401958.db2.gz	NNXXWGJCPZIYLE-YLJYHZDGSA-N	0	3	343.515	3.388	20	30		EGEDHN
CC[C@@H](CNC(=O)CCC1CCCC1)NCC#Cc1ccccc1	ZINC001753463144	1440411877	/nfs/dbraw/zinc/41/18/77/1440411877.db2.gz	AIRKHGQDPMCZFS-FQEVSTJZSA-N	0	3	326.484	3.493	20	30		EGEDHN
CC[C@H](CNC(=O)c1cc(C)oc1C)NCC#Cc1ccc(F)cc1	ZINC001753467200	1440413035	/nfs/dbraw/zinc/41/30/35/1440413035.db2.gz	UDKJFUZXPAEIQN-GOSISDBHSA-N	0	3	342.414	3.185	20	30		EGEDHN
CC[C@@H](CNC(=O)CC(C)(C)C1CC1)NCC#Cc1ccc(F)cc1	ZINC001753471044	1440414030	/nfs/dbraw/zinc/41/40/30/1440414030.db2.gz	DRXCDPGOZXIMBT-IBGZPJMESA-N	0	3	344.474	3.488	20	30		EGEDHN
C[C@@H](C(=O)NC1(CNCC#Cc2ccccc2)CCCC1)C(C)(F)F	ZINC001753507944	1440425070	/nfs/dbraw/zinc/42/50/70/1440425070.db2.gz	PUYIULWKNWAGSB-INIZCTEOSA-N	0	3	348.437	3.348	20	30		EGEDHN
C[C@H]1CCCC[C@@]1(CNCC#Cc1ccccc1)NC(=O)C(C)(C)F	ZINC001753530031	1440430722	/nfs/dbraw/zinc/43/07/22/1440430722.db2.gz	NKIWBCPNMNIHCF-UWJYYQICSA-N	0	3	344.474	3.441	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H](C)CNCc2ccncc2Cl)CC1	ZINC001753631356	1440452185	/nfs/dbraw/zinc/45/21/85/1440452185.db2.gz	XAUXNMAXETVMTP-AWEZNQCLSA-N	0	3	335.879	3.323	20	30		EGEDHN
C/C(=C/C(=O)NCC1(NCC#Cc2ccccc2)CCCC1)C1CC1	ZINC001753660999	1440458609	/nfs/dbraw/zinc/45/86/09/1440458609.db2.gz	WHRDNMVYKLPCTR-VLGSPTGOSA-N	0	3	336.479	3.413	20	30		EGEDHN
C=CCC1(C(=O)NCC2(NCc3ccnn3C)CCCC2)CCCC1	ZINC001753670890	1440462024	/nfs/dbraw/zinc/46/20/24/1440462024.db2.gz	MBHLANATZCPLQN-UHFFFAOYSA-N	0	3	344.503	3.075	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCCC[C@H]1CCNCc1ccccc1C#N	ZINC001753795920	1440489798	/nfs/dbraw/zinc/48/97/98/1440489798.db2.gz	IDSHCXVWHFULBJ-LSTHTHJFSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H](C)[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001753803718	1440491506	/nfs/dbraw/zinc/49/15/06/1440491506.db2.gz	AQYKBMYGEUZBON-BEFAXECRSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H](NCc2ncccc2C)C(C)C)CCC1	ZINC001753837074	1440501376	/nfs/dbraw/zinc/50/13/76/1440501376.db2.gz	ADMMLHUEANEFIK-QGZVFWFLSA-N	0	3	329.488	3.367	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)[C@@H](F)Cc1ccccc1)C(C)C	ZINC001753846087	1440504453	/nfs/dbraw/zinc/50/44/53/1440504453.db2.gz	YTIUCRIBULQCBG-JKSUJKDBSA-N	0	3	326.843	3.050	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N(C)CCN(C)Cc1cccc2c1CCOC2	ZINC001753860543	1440511437	/nfs/dbraw/zinc/51/14/37/1440511437.db2.gz	BQDLROWTVOTYHW-QGZVFWFLSA-N	0	3	344.499	3.252	20	30		EGEDHN
C[C@@H](CCNCc1cc(C#N)ccc1F)NC(=O)/C=C/C(C)(C)C	ZINC001753953476	1440525467	/nfs/dbraw/zinc/52/54/67/1440525467.db2.gz	NWYOOUYRRILMMX-KGXGESDWSA-N	0	3	331.435	3.284	20	30		EGEDHN
C[C@@H](CCNCc1nsc2ccccc21)NC(=O)C#CC(C)(C)C	ZINC001753965381	1440526521	/nfs/dbraw/zinc/52/65/21/1440526521.db2.gz	ZPTQZSMFABWXPH-AWEZNQCLSA-N	0	3	343.496	3.330	20	30		EGEDHN
CCN(CCNCc1ccc(OC)c(C#N)c1)C(=O)C(C)=C1CCC1	ZINC001754043868	1440534931	/nfs/dbraw/zinc/53/49/31/1440534931.db2.gz	GUZQGVSVTAMSSG-UHFFFAOYSA-N	0	3	341.455	3.005	20	30		EGEDHN
CCN(CCNCc1ccc(C#N)s1)C(=O)[C@@H]1C[C@@H]2C=C[C@H]1CC2	ZINC001754046114	1440535283	/nfs/dbraw/zinc/53/52/83/1440535283.db2.gz	PKAOFSJFFNHENT-RVKKMQEKSA-N	0	3	343.496	3.160	20	30		EGEDHN
CCc1cccc(CC(=O)NC/C=C\CNCc2ccc(C#N)cc2)c1	ZINC001754141544	1440544209	/nfs/dbraw/zinc/54/42/09/1440544209.db2.gz	GZHKNMMKGYZDNL-ARJAWSKDSA-N	0	3	347.462	3.125	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H](C)CNCC#Cc2ccc(Cl)cc2)s1	ZINC001754216021	1440551997	/nfs/dbraw/zinc/55/19/97/1440551997.db2.gz	HEFWNKIJLQUEHM-CYBMUJFWSA-N	0	3	346.883	3.470	20	30		EGEDHN
C/C(=C\C(=O)N[C@H](C)CNCC#Cc1cccc(Cl)c1)C1CC1	ZINC001754219957	1440552603	/nfs/dbraw/zinc/55/26/03/1440552603.db2.gz	GZIFTBGAJNEILB-ATGUSINASA-N	0	3	330.859	3.142	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)NC(=O)[C@@H]1CCCC2(CC2)C1	ZINC001754225528	1440553250	/nfs/dbraw/zinc/55/32/50/1440553250.db2.gz	ZREHWPOFIKKVJG-ZIAGYGMSSA-N	0	3	331.485	3.184	20	30		EGEDHN
CC(C(=O)N[C@H](C)CNCC#Cc1ccc(Cl)cc1)=C1CCC1	ZINC001754226613	1440553353	/nfs/dbraw/zinc/55/33/53/1440553353.db2.gz	UFHBHINUJSKESM-CQSZACIVSA-N	0	3	330.859	3.286	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)NC(=O)c1coc(C(F)F)c1	ZINC001754239334	1440555337	/nfs/dbraw/zinc/55/53/37/1440555337.db2.gz	SLXRTDCYEQEJLS-SECBINFHSA-N	0	3	339.367	3.058	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H](C)CN(C)Cc2ccccc2N(C)C)C1	ZINC001754323568	1440579282	/nfs/dbraw/zinc/57/92/82/1440579282.db2.gz	RZWSDNYZNKLXMK-MRXNPFEDSA-N	0	3	329.488	3.045	20	30		EGEDHN
C=C(Br)CNCCCN(C)C(=O)c1cc(C)cs1	ZINC001754369272	1440592520	/nfs/dbraw/zinc/59/25/20/1440592520.db2.gz	LAPRQKJLNLCKNP-UHFFFAOYSA-N	0	3	331.279	3.017	20	30		EGEDHN
CN(CCCNCc1cc(C#N)ccc1F)C(=O)/C=C\C(C)(C)C	ZINC001754362762	1440591949	/nfs/dbraw/zinc/59/19/49/1440591949.db2.gz	FQCIQVZHDZTDHE-HJWRWDBZSA-N	0	3	331.435	3.238	20	30		EGEDHN
CN(CCCNCc1ccccc1C#N)C(=O)C[C@H]1C=CCCC1	ZINC001754380721	1440593375	/nfs/dbraw/zinc/59/33/75/1440593375.db2.gz	YWTVMIRBAPTXAL-KRWDZBQOSA-N	0	3	325.456	3.243	20	30		EGEDHN
C=C(Br)CNCCCN(C)C(=O)c1cc[nH]c1C(C)C	ZINC001754390867	1440594184	/nfs/dbraw/zinc/59/41/84/1440594184.db2.gz	HAIJWAXUMWDORA-UHFFFAOYSA-N	0	3	342.281	3.098	20	30		EGEDHN
CN(CCCNCc1ccccc1C#N)C(=O)[C@@H]1CCCC1(C)C	ZINC001754390381	1440594258	/nfs/dbraw/zinc/59/42/58/1440594258.db2.gz	QQKUKLLNSMBEAV-SFHVURJKSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C[C@@H](C(=O)N[C@@H](CNCc1ccns1)C1CC1)c1ccccc1	ZINC001754461297	1440603513	/nfs/dbraw/zinc/60/35/13/1440603513.db2.gz	KKYNUMOCFUXELW-MSOLQXFVSA-N	0	3	341.480	3.097	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](NCc3cnns3)[C@H](CC)C2)CCC1	ZINC001754471482	1440605654	/nfs/dbraw/zinc/60/56/54/1440605654.db2.gz	ZDFXJNLMLSBTNQ-ZBFHGGJFSA-N	0	3	348.516	3.001	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)c3cccc(Cl)c3)CC2)cc1	ZINC001754533443	1440623197	/nfs/dbraw/zinc/62/31/97/1440623197.db2.gz	PUQQQOSKHCSKIU-UHFFFAOYSA-N	0	3	339.826	3.264	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)CC2(C(F)(F)F)CC2)C1	ZINC001754537754	1440625284	/nfs/dbraw/zinc/62/52/84/1440625284.db2.gz	CYPWJKBORVGGEO-CABCVRRESA-N	0	3	342.405	3.055	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)C[C@H](C=C)c3ccccc3)C2)CC1	ZINC001754561451	1440633894	/nfs/dbraw/zinc/63/38/94/1440633894.db2.gz	UHIWWGGDZIPKCR-IBGZPJMESA-N	0	3	336.479	3.294	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](NCc2ccn(C(C)C)n2)C[C@@H]1C	ZINC001754596373	1440641614	/nfs/dbraw/zinc/64/16/14/1440641614.db2.gz	VZQLVUZSOLORSO-DLBZAZTESA-N	0	3	332.492	3.289	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@H]1CNCc1cccc(Cl)n1	ZINC001754615533	1440644438	/nfs/dbraw/zinc/64/44/38/1440644438.db2.gz	RDRWLZLWXZTWOK-INIZCTEOSA-N	0	3	333.863	3.009	20	30		EGEDHN
CCC(C)(C)CC(=O)N1CCCC[C@]2(CCN(CC#CCOC)C2)C1	ZINC001754662430	1440655369	/nfs/dbraw/zinc/65/53/69/1440655369.db2.gz	YZLDKWBOXQGABA-OAQYLSRUSA-N	0	3	348.531	3.167	20	30		EGEDHN
C=CCOCC(=O)N[C@]1(C)CCN([C@@H](CC)c2ccc(F)cc2)C1	ZINC001754668541	1440657348	/nfs/dbraw/zinc/65/73/48/1440657348.db2.gz	NJBQBNCOQLTWRE-PKOBYXMFSA-N	0	3	334.435	3.060	20	30		EGEDHN
CCCSCC(=O)N1CC[C@](C)(CNCc2ccccc2C#N)C1	ZINC001754691170	1440666108	/nfs/dbraw/zinc/66/61/08/1440666108.db2.gz	ZVEAQAQSVNVTKR-LJQANCHMSA-N	0	3	345.512	3.030	20	30		EGEDHN
CCCC(CCC)C(=O)NCC1(C)CCN(CC#CCOC)CC1	ZINC001754718419	1440672358	/nfs/dbraw/zinc/67/23/58/1440672358.db2.gz	AJLRCAFYTBAVOE-UHFFFAOYSA-N	0	3	336.520	3.071	20	30		EGEDHN
C#CCN1CCC(C)(CNC(=O)c2ccsc2C(F)(F)F)CC1	ZINC001754721128	1440673247	/nfs/dbraw/zinc/67/32/47/1440673247.db2.gz	BNEHCKVCLRESHX-UHFFFAOYSA-N	0	3	344.402	3.232	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@]1(C)CCCN(Cc2ncccc2C)C1	ZINC001754726665	1440676551	/nfs/dbraw/zinc/67/65/51/1440676551.db2.gz	FYKVVZBYQGORKE-FQEVSTJZSA-N	0	3	329.488	3.465	20	30		EGEDHN
CC#CCN1CCC[C@@](C)(CNC(=O)c2cccc3cccnc32)C1	ZINC001754736832	1440682525	/nfs/dbraw/zinc/68/25/25/1440682525.db2.gz	UEQRREBHTRGEGN-NRFANRHFSA-N	0	3	335.451	3.090	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H]([C@@H](C)NCc3nc(C)oc3C)C2)CCC1	ZINC001754800317	1440690312	/nfs/dbraw/zinc/69/03/12/1440690312.db2.gz	TVBVEHZECAWUHT-PBHICJAKSA-N	0	3	345.487	3.364	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H]([C@H](C)NCc3nc(C)oc3C)C2)CCC1	ZINC001754800322	1440690329	/nfs/dbraw/zinc/69/03/29/1440690329.db2.gz	TVBVEHZECAWUHT-YOEHRIQHSA-N	0	3	345.487	3.364	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@H](C)[C@H](CNCc2csc(C)n2)C1	ZINC001754815537	1440692254	/nfs/dbraw/zinc/69/22/54/1440692254.db2.gz	TTWLVLQABNUJOA-WMLDXEAASA-N	0	3	347.528	3.404	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@H](C)[C@H](CNCc3nccs3)C2)CCC1	ZINC001754821943	1440693081	/nfs/dbraw/zinc/69/30/81/1440693081.db2.gz	AXZDPDJKNOLRLV-LSDHHAIUSA-N	0	3	333.501	3.074	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@]2(CO)CCCN(CC/C=C/CC)C2)CC1	ZINC001754858393	1440700463	/nfs/dbraw/zinc/70/04/63/1440700463.db2.gz	ZJGXJHQHLMPFMP-SGSXCFNPSA-N	0	3	334.504	3.032	20	30		EGEDHN
CC/C=C(\C)C(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1cccc(C#N)c1	ZINC001754863259	1440701732	/nfs/dbraw/zinc/70/17/32/1440701732.db2.gz	UXLJBPKZFHJIIG-BNZMVHIJSA-N	0	3	337.467	3.480	20	30		EGEDHN
Cc1cc(F)ccc1CN1CC[C@H]2[C@@H]1CCCN2C(=O)C#CC(C)C	ZINC001754865396	1440702694	/nfs/dbraw/zinc/70/26/94/1440702694.db2.gz	LMKLAOTZGOPKFT-PMACEKPBSA-N	0	3	342.458	3.359	20	30		EGEDHN
N#Cc1ccccc1CNCC[C@H]1CCN(C(=O)CC2CCCC2)C1	ZINC001754901303	1440706957	/nfs/dbraw/zinc/70/69/57/1440706957.db2.gz	AIMPYZPTEPBXBG-SFHVURJKSA-N	0	3	339.483	3.467	20	30		EGEDHN
CC[C@H](C)CC(=O)N1CC[C@@H](CCNCc2cc(C#N)ccc2F)C1	ZINC001754913109	1440708303	/nfs/dbraw/zinc/70/83/03/1440708303.db2.gz	SEXZIXLBTLIFAE-JKSUJKDBSA-N	0	3	345.462	3.462	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](CCNCc3cc(C)no3)C2)CCCC1	ZINC001754943537	1440712138	/nfs/dbraw/zinc/71/21/38/1440712138.db2.gz	HTQLUFBQTOMXDH-KRWDZBQOSA-N	0	3	345.487	3.448	20	30		EGEDHN
C=C(C)CN(C)Cc1ccccc1CNC(=O)[C@H]1OCC[C@H]1CC	ZINC001754945678	1440712760	/nfs/dbraw/zinc/71/27/60/1440712760.db2.gz	FIRIGRYAFKWNKN-APWZRJJASA-N	0	3	330.472	3.126	20	30		EGEDHN
C=CCC[NH2+][C@H](C)c1ccc(CNC(=O)c2cccc3n[n-]nc32)cc1	ZINC001754948289	1440714079	/nfs/dbraw/zinc/71/40/79/1440714079.db2.gz	XTTHTYBDGAPUCE-CQSZACIVSA-N	0	3	349.438	3.115	20	30		EGEDHN
COCC#CCN[C@@H](C)c1ccc(CNC(=O)CC(C)(C)C)cc1	ZINC001754952748	1440715516	/nfs/dbraw/zinc/71/55/16/1440715516.db2.gz	GRRHQVYHOGFGJS-INIZCTEOSA-N	0	3	330.472	3.039	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCC1(NCc2ccc(C#N)s2)CCC1	ZINC001754985517	1440722591	/nfs/dbraw/zinc/72/25/91/1440722591.db2.gz	UVTWTTIQMDLMJC-AWEZNQCLSA-N	0	3	331.485	3.351	20	30		EGEDHN
CC#CCNC1(CNC(=O)C(C)(C)c2ccccc2Cl)CCC1	ZINC001754991679	1440724677	/nfs/dbraw/zinc/72/46/77/1440724677.db2.gz	XJQXYMFMMIJAHV-UHFFFAOYSA-N	0	3	332.875	3.269	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)CCCOC(C)C)C1	ZINC001755047437	1440741999	/nfs/dbraw/zinc/74/19/99/1440741999.db2.gz	NTKUOOJNFRVOFB-UXHICEINSA-N	0	3	348.531	3.308	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001755077001	1440749155	/nfs/dbraw/zinc/74/91/55/1440749155.db2.gz	MIVMEPHLCCHSPB-NRFANRHFSA-N	0	3	337.467	3.339	20	30		EGEDHN
C=CCCC(=O)NCc1ccc2c(c1)CN(CC[C@H]1CCOC1)C2	ZINC001755101051	1440752399	/nfs/dbraw/zinc/75/23/99/1440752399.db2.gz	PLPDQYOIBPHNEH-INIZCTEOSA-N	0	3	328.456	3.011	20	30		EGEDHN
CCCCCC(=O)N1C[C@H](C)[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001755103224	1440753642	/nfs/dbraw/zinc/75/36/42/1440753642.db2.gz	IPQQLTFLDSFVTG-QFBILLFUSA-N	0	3	330.447	3.194	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1CCN(Cc2cnccc2C)CC1(C)C	ZINC001755137706	1440759206	/nfs/dbraw/zinc/75/92/06/1440759206.db2.gz	CLVPLRXWPPBOLP-SFHVURJKSA-N	0	3	329.488	3.463	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CCN(Cc2cccnc2C)CC1(C)C	ZINC001755139091	1440759609	/nfs/dbraw/zinc/75/96/09/1440759609.db2.gz	TURCESZBONSOCX-GOSISDBHSA-N	0	3	329.488	3.463	20	30		EGEDHN
C=CCOCCCC(=O)N[C@H]1CCN(Cc2cccc(F)c2)[C@H](C)C1	ZINC001755168510	1440768144	/nfs/dbraw/zinc/76/81/44/1440768144.db2.gz	CJLUXEVFAXRZGZ-APWZRJJASA-N	0	3	348.462	3.278	20	30		EGEDHN
C=C(C)CN1CCN(CCCCCNC(=O)C2(C)CCCCC2)CC1	ZINC001755175156	1440770531	/nfs/dbraw/zinc/77/05/31/1440770531.db2.gz	INHDCPILBZVXCD-UHFFFAOYSA-N	0	3	349.563	3.437	20	30		EGEDHN
C=CCOCCN(C)C[C@@H]1CCCN1C(=O)c1cc(C)sc1C	ZINC001755193554	1440775743	/nfs/dbraw/zinc/77/57/43/1440775743.db2.gz	BLYBDCYRHLTOLW-INIZCTEOSA-N	0	3	336.501	3.104	20	30		EGEDHN
Cc1occc1C(=O)N[C@H](C)[C@@H](C)NCC#Cc1ccccc1Cl	ZINC001755228143	1440786443	/nfs/dbraw/zinc/78/64/43/1440786443.db2.gz	ZJZYUWJKFIYIDU-ZIAGYGMSSA-N	0	3	344.842	3.390	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H](C)[C@@H](C)NCC(=O)Nc1cccc(C)c1C	ZINC001755235437	1440788086	/nfs/dbraw/zinc/78/80/86/1440788086.db2.gz	CIQGWOXDHHWPRM-IAGOWNOFSA-N	0	3	345.487	3.081	20	30		EGEDHN
Cc1cocc1C(=O)N[C@@H](C)[C@@H](C)NCC#Cc1ccc(Cl)cc1	ZINC001755248784	1440791312	/nfs/dbraw/zinc/79/13/12/1440791312.db2.gz	LFFVWGMUSNUVHE-CABCVRRESA-N	0	3	344.842	3.390	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N(C)CC(C)(C)CNCC(=C)Br	ZINC001755284189	1440801356	/nfs/dbraw/zinc/80/13/56/1440801356.db2.gz	JOKPWOYPPBUAEV-JYRVWZFOSA-N	0	3	343.309	3.492	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@H](C)N(C)CCOc1ccccc1F	ZINC001755311557	1440813550	/nfs/dbraw/zinc/81/35/50/1440813550.db2.gz	QYEGVDOCVMHWEQ-HNNXBMFYSA-N	0	3	336.451	3.243	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@@H](C)N(C)Cc1cccc2nsnc21	ZINC001755313898	1440814715	/nfs/dbraw/zinc/81/47/15/1440814715.db2.gz	AOABABLKTYXPQY-FZKQIMNGSA-N	0	3	346.500	3.230	20	30		EGEDHN
CCCC[C@@H](CNCC#Cc1ccccc1)NC(=O)[C@H]1CCC1(F)F	ZINC001755357363	1440830226	/nfs/dbraw/zinc/83/02/26/1440830226.db2.gz	DUWMEWBJAXYNAI-ZWKOTPCHSA-N	0	3	348.437	3.348	20	30		EGEDHN
CCCC[C@H](CNCc1ccc(F)c(C#N)c1)NC(=O)[C@H]1C[C@@H]1C	ZINC001755359843	1440831195	/nfs/dbraw/zinc/83/11/95/1440831195.db2.gz	KZRFHXRXSGDDTF-XKQJLSEDSA-N	0	3	331.435	3.118	20	30		EGEDHN
C#CCN1CCCCC[C@H]1CNC(=O)C[C@H](C)c1ccc(F)cc1	ZINC001755367890	1440835532	/nfs/dbraw/zinc/83/55/32/1440835532.db2.gz	KOCSIQZRWFLWHI-LPHOPBHVSA-N	0	3	330.447	3.313	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H](C)C1CN(Cc2ccc3ncccc3c2)C1	ZINC001755374904	1440837979	/nfs/dbraw/zinc/83/79/79/1440837979.db2.gz	SZWBYQKKYWJSDI-KRWDZBQOSA-N	0	3	349.478	3.365	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)CCCOc2ccccc2C)C1	ZINC001755381390	1440839262	/nfs/dbraw/zinc/83/92/62/1440839262.db2.gz	GJRFHEFNCYOWPO-KRWDZBQOSA-N	0	3	330.472	3.167	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)CCCOc2ccccc2C)C1	ZINC001755381391	1440839364	/nfs/dbraw/zinc/83/93/64/1440839364.db2.gz	GJRFHEFNCYOWPO-QGZVFWFLSA-N	0	3	330.472	3.167	20	30		EGEDHN
Cc1ccc(CN2C[C@@H](NC(=O)C#CC(C)C)C(C)(C)C2)cc1C	ZINC001755407203	1440844533	/nfs/dbraw/zinc/84/45/33/1440844533.db2.gz	KLVQVFGWUAGZCR-LJQANCHMSA-N	0	3	326.484	3.289	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)C2CCC(C)(C)CC2)C(C)(C)C1	ZINC001755416620	1440849093	/nfs/dbraw/zinc/84/90/93/1440849093.db2.gz	VREOMPOKXHVAMW-QGZVFWFLSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CC[C@H](NC(=O)C(C)(C)C(F)F)C[C@@H]2C1	ZINC001755454212	1440854993	/nfs/dbraw/zinc/85/49/93/1440854993.db2.gz	YJTFWRGLGFGLIM-XQQFMLRXSA-N	0	3	334.838	3.247	20	30		EGEDHN
C=C(Cl)CNC[C@H]1C[C@H](NC(=O)c2scnc2C(C)C)C1	ZINC001755480758	1440860068	/nfs/dbraw/zinc/86/00/68/1440860068.db2.gz	KAKQDVHIWVPSPY-HAQNSBGRSA-N	0	3	327.881	3.117	20	30		EGEDHN
C=C(Cl)CNCCC[C@@H](C)NC(=O)c1ccc2ncccc2c1	ZINC001755513150	1440863686	/nfs/dbraw/zinc/86/36/86/1440863686.db2.gz	YLQUMNJZMWQXDJ-CQSZACIVSA-N	0	3	331.847	3.475	20	30		EGEDHN
CN(CC#Cc1ccc(F)cc1)C1CCN(C(=O)C2CC=CC2)CC1	ZINC001755528722	1440866499	/nfs/dbraw/zinc/86/64/99/1440866499.db2.gz	WIRHQPZZEBSGFU-UHFFFAOYSA-N	0	3	340.442	3.066	20	30		EGEDHN
CN(C(=O)CC1CC1)[C@@H](CNCC#Cc1ccccc1Cl)C1CC1	ZINC001755554855	1440873024	/nfs/dbraw/zinc/87/30/24/1440873024.db2.gz	LJOTXZZHVXCPRN-IBGZPJMESA-N	0	3	344.886	3.318	20	30		EGEDHN
C=CC(C)(C)CC(=O)N(C)[C@H](CNCc1cnc(C)s1)C1CC1	ZINC001755562965	1440874936	/nfs/dbraw/zinc/87/49/36/1440874936.db2.gz	ZNDNUCUDQUKQQU-MRXNPFEDSA-N	0	3	335.517	3.380	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N(C)[C@@H](CNCC#Cc1ccccc1Cl)C1CC1	ZINC001755565456	1440875549	/nfs/dbraw/zinc/87/55/49/1440875549.db2.gz	ZOFJRMPPSSVDEM-FNHZYXHNSA-N	0	3	344.886	3.174	20	30		EGEDHN
C=CCC(C)(C)C(=O)N(C)C[C@H](C)NCC#Cc1ccc(F)cc1	ZINC001755608129	1440886276	/nfs/dbraw/zinc/88/62/76/1440886276.db2.gz	ZCCZGQLGGWEXOZ-INIZCTEOSA-N	0	3	330.447	3.216	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](NCc2ccc(F)c(Cl)c2)C[C@H]1C	ZINC001755673518	1440894146	/nfs/dbraw/zinc/89/41/46/1440894146.db2.gz	ILGTXPXAVDQPEF-HIFRSBDPSA-N	0	3	336.838	3.362	20	30		EGEDHN
CC#CCN1CC[C@@]2(NC(=O)CCCc3ccc(F)cc3)CCC[C@@H]12	ZINC001755699651	1440899168	/nfs/dbraw/zinc/89/91/68/1440899168.db2.gz	CHAFUENKRAAGCZ-CTNGQTDRSA-N	0	3	342.458	3.285	20	30		EGEDHN
CC#CCN1CC[C@]2(NC(=O)CCCc3ccc(F)cc3)CCC[C@H]12	ZINC001755699653	1440899211	/nfs/dbraw/zinc/89/92/11/1440899211.db2.gz	CHAFUENKRAAGCZ-PZJWPPBQSA-N	0	3	342.458	3.285	20	30		EGEDHN
C#CCN1CC[C@@]2(NC(=O)CCCc3ccccc3Cl)CCC[C@@H]12	ZINC001755700091	1440899728	/nfs/dbraw/zinc/89/97/28/1440899728.db2.gz	CCLPCGITFMTNKH-QUCCMNQESA-N	0	3	344.886	3.409	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1CCCN(Cc2ccc(CO)cc2)[C@H]1C	ZINC001755716932	1440905232	/nfs/dbraw/zinc/90/52/32/1440905232.db2.gz	CUUOMQVJHFUCRC-LPHOPBHVSA-N	0	3	330.472	3.004	20	30		EGEDHN
C=CCOCCN1CCC[C@H](NC(=O)c2cc(C)sc2C)[C@@H]1C	ZINC001755717902	1440906062	/nfs/dbraw/zinc/90/60/62/1440906062.db2.gz	WFIAJZHUUVJJJA-YOEHRIQHSA-N	0	3	336.501	3.150	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)CC(F)(F)C(F)(F)F)[C@@H]1C	ZINC001755721789	1440907768	/nfs/dbraw/zinc/90/77/68/1440907768.db2.gz	CYHFAKFJNICQMF-QWRGUYRKSA-N	0	3	328.325	3.119	20	30		EGEDHN
C=CCOCCN1CCC[C@@H](NC(=O)c2coc3ccccc32)[C@H]1C	ZINC001755723459	1440908493	/nfs/dbraw/zinc/90/84/93/1440908493.db2.gz	PLPVJUQHRVTIKF-CRAIPNDOSA-N	0	3	342.439	3.218	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC[C@@H](CNCc2cc(O)ccc2Cl)C1	ZINC001755730860	1440910149	/nfs/dbraw/zinc/91/01/49/1440910149.db2.gz	NYXMCOFKFWFOEL-HIFRSBDPSA-N	0	3	336.863	3.386	20	30		EGEDHN
C=C(C)CN(C)CCN(C(=O)Cc1ccc2c(c1)CCC2)C(C)C	ZINC001755817079	1440923938	/nfs/dbraw/zinc/92/39/38/1440923938.db2.gz	BWYNPHDLSICJFM-UHFFFAOYSA-N	0	3	328.500	3.463	20	30		EGEDHN
CC(C)(C)[C@@H](CNCC#Cc1ccc(F)cc1)NC(=O)C1=CCCC1	ZINC001755819534	1440925261	/nfs/dbraw/zinc/92/52/61/1440925261.db2.gz	GHZSDMYUIXGFMS-LJQANCHMSA-N	0	3	342.458	3.408	20	30		EGEDHN
CC(C)(C)[C@H](CNCC#Cc1ccccc1)NC(=O)[C@H]1C[C@@H]1C(F)F	ZINC001755823975	1440926724	/nfs/dbraw/zinc/92/67/24/1440926724.db2.gz	QKBJRSXZZSHWSB-ULQDDVLXSA-N	0	3	348.437	3.060	20	30		EGEDHN
CC#CCCCC(=O)N[C@H](CNCc1cncc(F)c1)C(C)(C)C	ZINC001755829363	1440928353	/nfs/dbraw/zinc/92/83/53/1440928353.db2.gz	AYRFPCKKAPQKMH-QGZVFWFLSA-N	0	3	333.451	3.035	20	30		EGEDHN
C=CCCC(=O)N[C@@H](C)C1CCN(C[C@@H](O)c2ccccc2F)CC1	ZINC001755847345	1440933610	/nfs/dbraw/zinc/93/36/10/1440933610.db2.gz	HWLGPGAMDDTKQW-HNAYVOBHSA-N	0	3	348.462	3.042	20	30		EGEDHN
CC(C)c1cccc(CN2CCC([C@H](C)NC(=O)[C@@H](C)C#N)CC2)n1	ZINC001755847607	1440933834	/nfs/dbraw/zinc/93/38/34/1440933834.db2.gz	MZYFAJRMLMWLJC-HOTGVXAUSA-N	0	3	342.487	3.081	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N(C)C2CC(NCC(=C)Cl)C2)cc1	ZINC001755856549	1440935802	/nfs/dbraw/zinc/93/58/02/1440935802.db2.gz	CWTUSPPFLQHZTD-UHFFFAOYSA-N	0	3	346.858	3.034	20	30		EGEDHN
C=CCNCc1ccc(CNC(=O)CCc2nc(C)cs2)c(F)c1	ZINC001755901930	1440944176	/nfs/dbraw/zinc/94/41/76/1440944176.db2.gz	JBDITOYVSOWSFG-UHFFFAOYSA-N	0	3	347.459	3.115	20	30		EGEDHN
C[Si](C)(C)C#Cc1cccnc1N1CCN(C2CCCC2)CC1	ZINC001165032214	721858159	/nfs/dbraw/zinc/85/81/59/721858159.db2.gz	NDHWFTMZOXCGDN-UHFFFAOYSA-N	0	3	327.548	3.375	20	30		EGEDHN
C=CCC1([NH2+]Cc2cc(-c3nnn[n-]3)ccc2OC)CCCCC1	ZINC001573329000	947416523	/nfs/dbraw/zinc/41/65/23/947416523.db2.gz	GDVCNZJADVECFX-UHFFFAOYSA-N	0	3	327.432	3.244	20	30		EGEDHN
C=CCC1([NH2+]Cc2cc(-c3nn[n-]n3)ccc2OC)CCCCC1	ZINC001573329000	947416528	/nfs/dbraw/zinc/41/65/28/947416528.db2.gz	GDVCNZJADVECFX-UHFFFAOYSA-N	0	3	327.432	3.244	20	30		EGEDHN
COc1ccc(C#N)cc1CN[C@@H](C)[C@H]1OCCc2sccc21	ZINC000368637588	168377092	/nfs/dbraw/zinc/37/70/92/168377092.db2.gz	YNACYRGFWLRMPE-KPZWWZAWSA-N	0	3	328.437	3.420	20	30		EGEDHN
C[C@H](NC(=O)c1cccc(F)c1C#N)[C@@H](c1ccccc1)N(C)C	ZINC000193654151	299248082	/nfs/dbraw/zinc/24/80/82/299248082.db2.gz	PAUJOCHJSKIKFK-UGSOOPFHSA-N	0	3	325.387	3.119	20	30		EGEDHN
C[C@@H](NC[C@@H](O)COc1ccc(C#N)cc1)c1ccccc1Cl	ZINC000068046231	202203905	/nfs/dbraw/zinc/20/39/05/202203905.db2.gz	SBVGWGSNWNGODI-UKRRQHHQSA-N	0	3	330.815	3.302	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@H]2c2cccc(OC)c2)CC1	ZINC000264373852	201210282	/nfs/dbraw/zinc/21/02/82/201210282.db2.gz	RSDJPJLQOMESOG-IBGZPJMESA-N	0	3	343.471	3.192	20	30		EGEDHN
C=C(C)CN1CCC(Nc2ccc3nnc(-c4ccccc4)n3n2)CC1	ZINC000264494710	201210918	/nfs/dbraw/zinc/21/09/18/201210918.db2.gz	ORLIAPXKGDXGDK-UHFFFAOYSA-N	0	3	348.454	3.244	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](c2ccc(OC)cc2)C2CC2)CC1	ZINC000264428913	201210977	/nfs/dbraw/zinc/21/09/77/201210977.db2.gz	TWMUVQAUZCBTBB-LJQANCHMSA-N	0	3	343.471	3.096	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000264733394	201213046	/nfs/dbraw/zinc/21/30/46/201213046.db2.gz	HGEKDXZHGDULOC-MOPGFXCFSA-N	0	3	327.472	3.272	20	30		EGEDHN
C=C1CCN(CCC(=O)Nc2cc(OC)c(Cl)cc2OC)CC1	ZINC000266741510	201220129	/nfs/dbraw/zinc/22/01/29/201220129.db2.gz	NSGWLUYUBGHBOJ-UHFFFAOYSA-N	0	3	338.835	3.338	20	30		EGEDHN
C#CCNC(=O)[C@@H](C)N[C@@H](C)c1ccc(-c2ccccc2OC)cc1	ZINC000266435081	201220263	/nfs/dbraw/zinc/22/02/63/201220263.db2.gz	FDCSKBCKUWRQKX-JKSUJKDBSA-N	0	3	336.435	3.151	20	30		EGEDHN
C=CCSCCNC(=O)N(CC)Cc1ccc(CN(C)C)cc1	ZINC000263875730	201208110	/nfs/dbraw/zinc/20/81/10/201208110.db2.gz	PMJFSMHSZUROMH-UHFFFAOYSA-N	0	3	335.517	3.199	20	30		EGEDHN
C#CCCOc1ccc(CN2CCC(C3(C)OCCO3)CC2)cc1	ZINC000271152946	201243308	/nfs/dbraw/zinc/24/33/08/201243308.db2.gz	BTJBUMPYDTVNAM-UHFFFAOYSA-N	0	3	329.440	3.064	20	30		EGEDHN
C=CCC[C@H](O)CN[C@H](C)c1ccc(OC)c(Br)c1	ZINC000271712840	201246101	/nfs/dbraw/zinc/24/61/01/201246101.db2.gz	VLXJNMMLNNZKQL-YPMHNXCESA-N	0	3	328.250	3.435	20	30		EGEDHN
C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCCN(Cc2cc(C#N)n(C)c2)C1	ZINC000191366161	239068115	/nfs/dbraw/zinc/06/81/15/239068115.db2.gz	PIYYGYKDMYFPGN-HOCLYGCPSA-N	0	3	346.475	3.022	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C2(Cc3ccc(F)cc3)CC2)CC1	ZINC000275674680	201284141	/nfs/dbraw/zinc/28/41/41/201284141.db2.gz	GGJHVZBRHBNEOE-UHFFFAOYSA-N	0	3	330.447	3.305	20	30		EGEDHN
C=CCN(CCc1ccco1)C(=O)NC[C@@H]1CCCCN1C1CC1	ZINC000277358545	201301406	/nfs/dbraw/zinc/30/14/06/201301406.db2.gz	AHBSXMSCOBECIJ-KRWDZBQOSA-N	0	3	331.460	3.037	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1C(=O)NC[C@H](c1ccsc1)N(CC)CC	ZINC000279566594	201319603	/nfs/dbraw/zinc/31/96/03/201319603.db2.gz	SJMRJXLFEQJCEC-BRWVUGGUSA-N	0	3	336.501	3.228	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Nc1c(C)noc1CC)C(C)C	ZINC000089416192	201370314	/nfs/dbraw/zinc/37/03/14/201370314.db2.gz	ZWPACOOOUJRDCS-HNNXBMFYSA-N	0	3	334.464	3.366	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNc1nc2sccn2c1[N+](=O)[O-])C(C)C	ZINC000023030505	212342426	/nfs/dbraw/zinc/34/24/26/212342426.db2.gz	NQTJATSPNZTXFD-CYBMUJFWSA-N	0	3	349.460	3.415	20	30		EGEDHN
COC[C@H](NC[C@H](O)c1ccc(C#N)cc1)c1ccc(Cl)cc1	ZINC000193668959	240258377	/nfs/dbraw/zinc/25/83/77/240258377.db2.gz	KCFYXRWPXGNUSI-ROUUACIJSA-N	0	3	330.815	3.222	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN(Cc2cccs2)C[C@@H]2CCCO2)cc1	ZINC000126683640	205066921	/nfs/dbraw/zinc/06/69/21/205066921.db2.gz	LBDOHKMCGJGVJR-HKUYNNGSSA-N	0	3	342.464	3.334	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN(Cc2cccs2)C[C@H]2CCCO2)cc1	ZINC000126683915	205068259	/nfs/dbraw/zinc/06/82/59/205068259.db2.gz	LBDOHKMCGJGVJR-MJGOQNOKSA-N	0	3	342.464	3.334	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CN[C@H]1CCC[C@H]1c1ccccc1	ZINC000133754176	205377891	/nfs/dbraw/zinc/37/78/91/205377891.db2.gz	GKLCUJXTSNARDN-HOTGVXAUSA-N	0	3	325.437	3.484	20	30		EGEDHN
COc1ccc(CNC[C@H](C)Oc2ccccc2OC)cc1C#N	ZINC000174607208	207036810	/nfs/dbraw/zinc/03/68/10/207036810.db2.gz	YXJYMZKIRSCZEO-AWEZNQCLSA-N	0	3	326.396	3.133	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@](C)(NCc1ccc(C#N)s1)C1CC1	ZINC000177578957	207358673	/nfs/dbraw/zinc/35/86/73/207358673.db2.gz	OECQZPVXTGZSAW-QGZVFWFLSA-N	0	3	335.473	3.403	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN2CCC(Oc3cccc(C#N)c3)CC2)cc1	ZINC000268688718	252141908	/nfs/dbraw/zinc/14/19/08/252141908.db2.gz	OKMRSYOBDAEJER-OAQYLSRUSA-N	0	3	347.418	3.007	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CNC2(c3ccc(F)cc3)CCOCC2)cc1	ZINC000268704959	252156090	/nfs/dbraw/zinc/15/60/90/252156090.db2.gz	WBDYENNPDVWMJL-IBGZPJMESA-N	0	3	340.398	3.026	20	30		EGEDHN
Cc1cccc(NC2CCN(C[C@@H](O)c3ccc(C#N)cc3)CC2)c1	ZINC000268708530	252159166	/nfs/dbraw/zinc/15/91/66/252159166.db2.gz	WZZSJAJMNSIDCU-OAQYLSRUSA-N	0	3	335.451	3.477	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N(CCN(C)C)CC1CCCCC1	ZINC000338118548	141096753	/nfs/dbraw/zinc/09/67/53/141096753.db2.gz	MPNOWDHNTVIVJB-UHFFFAOYSA-N	0	3	327.472	3.451	20	30		EGEDHN
Cn1cc(CN2CC[C@H](COC(F)F)C2)c(-c2ccc(C#N)cc2)n1	ZINC000353027191	141287623	/nfs/dbraw/zinc/28/76/23/141287623.db2.gz	MJZHWCSWWFCQLD-AWEZNQCLSA-N	0	3	346.381	3.020	20	30		EGEDHN
CC[C@@H](CC(F)(F)F)N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000354574552	141308835	/nfs/dbraw/zinc/30/88/35/141308835.db2.gz	XZUVZNARZXBFDO-ZFWWWQNUSA-N	0	3	339.361	3.374	20	30		EGEDHN
C[C@@H]1CC(C)(C)CC[C@H]1NCCS(=O)(=O)c1ccc(C#N)cc1	ZINC000120834262	152304447	/nfs/dbraw/zinc/30/44/47/152304447.db2.gz	UMPGSBJQEQAHBF-RHSMWYFYSA-N	0	3	334.485	3.136	20	30		EGEDHN
CCOC[C@@H](N[C@@H](C)C(=O)Nc1ccc(C#N)c(Cl)c1)C(C)C	ZINC000189814579	153099228	/nfs/dbraw/zinc/09/92/28/153099228.db2.gz	KJNWESPNIJMEAY-BLLLJJGKSA-N	0	3	337.851	3.189	20	30		EGEDHN
COc1ccc(C#N)cc1CN1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O	ZINC000326518648	154183376	/nfs/dbraw/zinc/18/33/76/154183376.db2.gz	UGXBNOAAKOEYPN-QRVBRYPASA-N	0	3	328.456	3.472	20	30		EGEDHN
CN(Cc1cc2ccccc2o1)C[C@@H](O)COc1ccc(C#N)cc1	ZINC000127276399	162327753	/nfs/dbraw/zinc/32/77/53/162327753.db2.gz	ZXKIGKUJFQFIOV-QGZVFWFLSA-N	0	3	336.391	3.176	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CCc1ccc(C#N)cc1	ZINC000248913764	163045163	/nfs/dbraw/zinc/04/51/63/163045163.db2.gz	VSOXAOSCPYCJSV-LAUBAEHRSA-N	0	3	347.462	3.128	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN(C)Cc1ccccc1N(C)C	ZINC000344076600	164097995	/nfs/dbraw/zinc/09/79/95/164097995.db2.gz	UYGWFTNODRZCDM-UHFFFAOYSA-N	0	3	339.439	3.144	20	30		EGEDHN
C[C@@H](CN(C)C)NC(=O)c1ccc(Sc2ccccc2C#N)cc1	ZINC000346235931	164361278	/nfs/dbraw/zinc/36/12/78/164361278.db2.gz	YLWUCGAXLPPYFW-AWEZNQCLSA-N	0	3	339.464	3.389	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@H](N[C@@H](CN1CCOCC1)c1ccccc1)CC2	ZINC000353411129	165759789	/nfs/dbraw/zinc/75/97/89/165759789.db2.gz	JSPJVJHRGSAYJX-YADHBBJMSA-N	0	3	347.462	3.209	20	30		EGEDHN
CC[C@@H](C)N[C@H](CNC(=O)c1cccc(F)c1C#N)c1ccco1	ZINC000359528886	167180375	/nfs/dbraw/zinc/18/03/75/167180375.db2.gz	BHVHNJJIPAZSFY-MLGOLLRUSA-N	0	3	329.375	3.150	20	30		EGEDHN
Cc1ccc([C@H](Cn2ccnc2)NCc2cc(C#N)n(C)c2)c(C)c1	ZINC000359691311	167210079	/nfs/dbraw/zinc/21/00/79/167210079.db2.gz	YSLMKMMZSOICTI-FQEVSTJZSA-N	0	3	333.439	3.241	20	30		EGEDHN
COc1cc(CNC[C@@]2(C)OCCc3sccc32)ccc1C#N	ZINC000367988815	168293269	/nfs/dbraw/zinc/29/32/69/168293269.db2.gz	VEDBJLZMJPQXDC-GOSISDBHSA-N	0	3	328.437	3.206	20	30		EGEDHN
Cc1ccc(CN(CCN(C)C)C(=O)c2cc(C#N)ccc2Cl)o1	ZINC000285224763	269917305	/nfs/dbraw/zinc/91/73/05/269917305.db2.gz	VBUZEUHWCJNQJY-UHFFFAOYSA-N	0	3	345.830	3.317	20	30		EGEDHN
CCC(CC)[C@@H](CCNC(=O)C(C#N)Cc1ccc(C#N)cc1)OC	ZINC000348354569	270045539	/nfs/dbraw/zinc/04/55/39/270045539.db2.gz	YQFBJVHFKACWSO-RBUKOAKNSA-N	0	3	341.455	3.198	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CCC[C@@H](CC(F)(F)F)C2)cc1	ZINC000421970713	270048899	/nfs/dbraw/zinc/04/88/99/270048899.db2.gz	SWTLFWRLLJLURT-HOTGVXAUSA-N	0	3	349.356	3.432	20	30		EGEDHN
CC(C)Oc1cccc(CN2CC[C@H](Oc3ccc(C#N)cn3)C2)c1	ZINC000428813846	270050239	/nfs/dbraw/zinc/05/02/39/270050239.db2.gz	FJSPTLSZLYHHIY-IBGZPJMESA-N	0	3	337.423	3.394	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]([C@@H](CO)C2CC2)C2CC2)c(OC(F)F)c1	ZINC000451604173	270053358	/nfs/dbraw/zinc/05/33/58/270053358.db2.gz	KDHMCWBVJRNDIY-DOTOQJQBSA-N	0	3	336.382	3.046	20	30		EGEDHN
N#Cc1ccccc1OCCN[C@@H](c1cccs1)C1(CO)CCC1	ZINC000452057293	270053532	/nfs/dbraw/zinc/05/35/32/270053532.db2.gz	GATFPCCRAKDXHF-SFHVURJKSA-N	0	3	342.464	3.492	20	30		EGEDHN
CN(CCCc1ccccc1)[C@@H]1CCN(c2ccc(C#N)cc2)C1=O	ZINC000534601199	270061006	/nfs/dbraw/zinc/06/10/06/270061006.db2.gz	CCXUXDZLRPBTRC-HXUWFJFHSA-N	0	3	333.435	3.228	20	30		EGEDHN
COc1ccc(CCNCc2ccc(C#N)cc2F)c(OC)c1OC	ZINC000269414065	266290253	/nfs/dbraw/zinc/29/02/53/266290253.db2.gz	JUGBFIRJUSVACX-UHFFFAOYSA-N	0	3	344.386	3.055	20	30		EGEDHN
C[C@H](C1CCN(C)CC1)N(C)C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000272342731	267144228	/nfs/dbraw/zinc/14/42/28/267144228.db2.gz	MYTAMOPLWLHAFO-GFCCVEGCSA-N	0	3	334.851	3.406	20	30		EGEDHN
C[C@H](CCN1CCN(c2nccnc2C#N)C[C@H]1C)c1ccccc1	ZINC000194065655	267150297	/nfs/dbraw/zinc/15/02/97/267150297.db2.gz	GTWKXQQJMRWWSO-IAGOWNOFSA-N	0	3	335.455	3.053	20	30		EGEDHN
CN(C)C[C@@H](NC(=O)/C=C\c1cccc(C#N)c1)c1ccc(F)cc1	ZINC000493001816	267282947	/nfs/dbraw/zinc/28/29/47/267282947.db2.gz	CRUDOVGHQKAIIN-PVABEOQZSA-N	0	3	337.398	3.130	20	30		EGEDHN
CN(Cc1ccc(-c2ccccc2C#N)cc1)C1(C(N)=O)CCCC1	ZINC000411409012	267311722	/nfs/dbraw/zinc/31/17/22/267311722.db2.gz	RLLXEYCBBMXGNW-UHFFFAOYSA-N	0	3	333.435	3.455	20	30		EGEDHN
CN1CCCN(Cc2cccc(OCc3cccc(C#N)c3)c2)CC1	ZINC000435247074	267334534	/nfs/dbraw/zinc/33/45/34/267334534.db2.gz	JXRKXOSBDZIICC-UHFFFAOYSA-N	0	3	335.451	3.275	20	30		EGEDHN
Cc1ccc(/C=C\C(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)o1	ZINC000490793134	268024293	/nfs/dbraw/zinc/02/42/93/268024293.db2.gz	XIWVQNQUFUZJMQ-KHPPLWFESA-N	0	3	337.423	3.063	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)s1)C[C@H](O)COc1ccccc1	ZINC000278556193	268038835	/nfs/dbraw/zinc/03/88/35/268038835.db2.gz	ALENJUBYKXMMBF-HNNXBMFYSA-N	0	3	330.453	3.270	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@@H]2CCCc3sccc32)cc1	ZINC000280175227	268092099	/nfs/dbraw/zinc/09/20/99/268092099.db2.gz	XVXOITQAPHGZBZ-NVXWUHKLSA-N	0	3	335.432	3.496	20	30		EGEDHN
N#Cc1c(Cl)cccc1NC[C@@H]1C[C@H](O)CN1Cc1ccccc1	ZINC000450403946	268158613	/nfs/dbraw/zinc/15/86/13/268158613.db2.gz	DRIIVIAFLWFKFC-HOTGVXAUSA-N	0	3	341.842	3.259	20	30		EGEDHN
N#Cc1cccc(OC2CCN([C@@H]3Cc4ccccc4[C@H]3O)CC2)c1	ZINC000272038255	268270520	/nfs/dbraw/zinc/27/05/20/268270520.db2.gz	XQNDPEYQWGUKIB-NHCUHLMSSA-N	0	3	334.419	3.060	20	30		EGEDHN
N#Cc1cccc(OCCN2CCC(N3CCc4ccccc43)CC2)c1	ZINC000503406301	268284687	/nfs/dbraw/zinc/28/46/87/268284687.db2.gz	NCNIGDSORJUHFU-UHFFFAOYSA-N	0	3	347.462	3.464	20	30		EGEDHN
CC(C)(CCN[C@@H]1CCCCc2cc(C#N)ccc21)S(C)(=O)=O	ZINC000414268416	269603139	/nfs/dbraw/zinc/60/31/39/269603139.db2.gz	UKRMRFCRVALCKO-QGZVFWFLSA-N	0	3	334.485	3.129	20	30		EGEDHN
CC(C)(C)n1cc(C#N)cc1NC(=O)N1CC[C@H](N2CCCCC2)C1	ZINC000264574710	275542736	/nfs/dbraw/zinc/54/27/36/275542736.db2.gz	IKIYPDLCUJVFTC-INIZCTEOSA-N	0	3	343.475	3.207	20	30		EGEDHN
CC(C)[C@H](CNC(=O)c1c(F)cc(C#N)cc1F)N1CCC(C)CC1	ZINC000119837676	307500258	/nfs/dbraw/zinc/50/02/58/307500258.db2.gz	UUPKIFMZJZGTJT-KRWDZBQOSA-N	0	3	349.425	3.323	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@@H](N[C@@H]1CC(=O)N(c3ccccc3F)C1)CC2	ZINC000521712219	312556850	/nfs/dbraw/zinc/55/68/50/312556850.db2.gz	RWFGFKSWDWIFHO-QAPCUYQASA-N	0	3	335.382	3.080	20	30		EGEDHN
C[C@@]1(NC[C@H](O)COc2ccc(C#N)cc2)CCCc2ccccc21	ZINC000537605226	314194963	/nfs/dbraw/zinc/19/49/63/314194963.db2.gz	LFMLBUYZLQFTQY-GHTZIAJQSA-N	0	3	336.435	3.139	20	30		EGEDHN
Cc1ccccc1[C@H](NCC(=O)NCc1ccc(C#N)cc1)C(C)C	ZINC000538160396	314230181	/nfs/dbraw/zinc/23/01/81/314230181.db2.gz	VTGSLNCXKIIUIJ-OAQYLSRUSA-N	0	3	335.451	3.470	20	30		EGEDHN
N#Cc1ccc(NC(=O)CN2CCC[C@H]2C2CCOCC2)cc1Cl	ZINC000539727425	314332253	/nfs/dbraw/zinc/33/22/53/314332253.db2.gz	LNSMLMURECDXEA-KRWDZBQOSA-N	0	3	347.846	3.041	20	30		EGEDHN
CCC[C@H]1CCCC[C@H]1NCCS(=O)(=O)c1ccc(C#N)cc1	ZINC000548487626	315016234	/nfs/dbraw/zinc/01/62/34/315016234.db2.gz	ADIGYPGBSYWGES-FUHWJXTLSA-N	0	3	334.485	3.280	20	30		EGEDHN
N#Cc1cnn2cc(CNCCSc3ccc(Cl)cc3)cnc12	ZINC000555554154	315390101	/nfs/dbraw/zinc/39/01/01/315390101.db2.gz	PSXNUPRYPCLEAF-UHFFFAOYSA-N	0	3	343.843	3.136	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN1CCC[C@]2(CCSC2)C1	ZINC000563597132	316043668	/nfs/dbraw/zinc/04/36/68/316043668.db2.gz	DPKTTXMFDXIDDH-INIZCTEOSA-N	0	3	335.498	3.167	20	30		EGEDHN
C[C@@H](OC[C@@H](O)CNCc1cccc(C#N)c1)c1ccc(Cl)cc1	ZINC000567678505	316652597	/nfs/dbraw/zinc/65/25/97/316652597.db2.gz	UXGXCBUSKHBKOH-KUHUBIRLSA-N	0	3	344.842	3.440	20	30		EGEDHN
CS[C@H]1CN(c2c(C#N)cnc3c(Cl)cccc32)C[C@@H]1N(C)C	ZINC000567749116	316668781	/nfs/dbraw/zinc/66/87/81/316668781.db2.gz	UTEIFRUBQJSQBE-GJZGRUSLSA-N	0	3	346.887	3.242	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN1CCSC[C@H]1C1CCC1	ZINC000571777936	317247586	/nfs/dbraw/zinc/24/75/86/317247586.db2.gz	JVRMTPFOIJRYJH-AWEZNQCLSA-N	0	3	335.498	3.166	20	30		EGEDHN
C[C@H](N[C@H]1CCC[C@@H](N2CCCC2=O)C1)c1ccc(C#N)cc1F	ZINC000572497854	317348303	/nfs/dbraw/zinc/34/83/03/317348303.db2.gz	ACCMWXYHJCEJKI-CWRNSKLLSA-N	0	3	329.419	3.282	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN(Cc1ccc(C#N)cc1)C1CC1	ZINC000172652681	323287573	/nfs/dbraw/zinc/28/75/73/323287573.db2.gz	IZZPQZDWPUFXGF-UHFFFAOYSA-N	0	3	347.418	3.482	20	30		EGEDHN
N#Cc1ccc(NC(=O)CN[C@H](C[C@@H]2CCOC2)c2ccccc2)cc1	ZINC000181215527	323474313	/nfs/dbraw/zinc/47/43/13/323474313.db2.gz	AUXCSWHIYYHLKI-FXAWDEMLSA-N	0	3	349.434	3.254	20	30		EGEDHN
C[C@@H](CO)N(Cc1ccc(Br)cc1C#N)CC1CCC1	ZINC000347094304	457225835	/nfs/dbraw/zinc/22/58/35/457225835.db2.gz	QXBSWTUAKWWOBN-LBPRGKRZSA-N	0	3	337.261	3.304	20	30		EGEDHN
C=CCOc1ccccc1CNC1CCN(CC(F)(F)F)CC1	ZINC000237846748	455225055	/nfs/dbraw/zinc/22/50/55/455225055.db2.gz	TWBWLJXJEPYFMU-UHFFFAOYSA-N	0	3	328.378	3.368	20	30		EGEDHN
C[C@@H](C#N)CSc1ccccc1NC(=O)NC[C@H]1CCCN1C	ZINC000264506334	455226894	/nfs/dbraw/zinc/22/68/94/455226894.db2.gz	DPLVWQHBIILQLZ-UONOGXRCSA-N	0	3	332.473	3.154	20	30		EGEDHN
CCN1CCCC[C@@H]1CNC(=O)CCCCOc1cccc(C#N)c1	ZINC000264696819	455265871	/nfs/dbraw/zinc/26/58/71/455265871.db2.gz	IWRBMPWUMPBJQX-GOSISDBHSA-N	0	3	343.471	3.098	20	30		EGEDHN
CN(C)C1(CN(C)C(=O)N[C@@H](CCC#N)c2ccccc2)CCC1	ZINC000190013510	455272410	/nfs/dbraw/zinc/27/24/10/455272410.db2.gz	IMWGFQQLMOGXLK-KRWDZBQOSA-N	0	3	328.460	3.157	20	30		EGEDHN
C[C@@H]1C[C@@H](N(C)C(=O)c2c[nH]c(C#N)c2)CCN1Cc1ccccc1	ZINC000181306419	455316407	/nfs/dbraw/zinc/31/64/07/455316407.db2.gz	GHKIYDQAHJLRRS-BEFAXECRSA-N	0	3	336.439	3.011	20	30		EGEDHN
Cc1ccc(C(=O)NCCN[C@@H](C)c2ccc(C#N)cc2)cc1F	ZINC000173871944	455336754	/nfs/dbraw/zinc/33/67/54/455336754.db2.gz	YZDUFNDSJOPHGU-AWEZNQCLSA-N	0	3	325.387	3.086	20	30		EGEDHN
Cc1ccc([C@H](C)N[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)s1	ZINC000190603993	455350766	/nfs/dbraw/zinc/35/07/66/455350766.db2.gz	KBHHPFUKBYJFQC-WMLDXEAASA-N	0	3	339.464	3.380	20	30		EGEDHN
CC[C@@H]([NH2+][C@H]1CCN(Cc2ccc(C#N)cc2)C1=O)c1ccccc1[O-]	ZINC000190602192	455351090	/nfs/dbraw/zinc/35/10/90/455351090.db2.gz	SQJPRLLBCWNBSK-MOPGFXCFSA-N	0	3	349.434	3.106	20	30		EGEDHN
COCCNc1ccc(-c2cc(CN(C)C)ccc2F)cc1C#N	ZINC000600791572	460606530	/nfs/dbraw/zinc/60/65/30/460606530.db2.gz	RXOWTQPTUSJJIV-UHFFFAOYSA-N	0	3	327.403	3.484	20	30		EGEDHN
C=CCNC(=O)NC(=O)CN[C@H](c1ccc(C(C)C)cc1)C(C)C	ZINC000015521035	453574722	/nfs/dbraw/zinc/57/47/22/453574722.db2.gz	JMADSZGSWJBSGI-SFHVURJKSA-N	0	3	331.460	3.109	20	30		EGEDHN
N#Cc1ccc(CCC(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1	ZINC000023741858	453716069	/nfs/dbraw/zinc/71/60/69/453716069.db2.gz	KRJGJHQOGNJZJG-OAQYLSRUSA-N	0	3	347.462	3.444	20	30		EGEDHN
CN(CCC#N)C(=O)CCN[C@@H](c1ccc(F)cc1F)C(C)(C)C	ZINC000181629529	455365335	/nfs/dbraw/zinc/36/53/35/455365335.db2.gz	GFPSYDOEZWNDCQ-KRWDZBQOSA-N	0	3	337.414	3.404	20	30		EGEDHN
Cc1cccc(N2CCN(CCCCNc3ncccc3C#N)CC2)c1	ZINC000029587468	453829961	/nfs/dbraw/zinc/82/99/61/453829961.db2.gz	SKXUQDABIVSOMC-UHFFFAOYSA-N	0	3	349.482	3.276	20	30		EGEDHN
COc1cccc([C@H](CNCc2ccc(C#N)cc2)N2CCCC2)c1	ZINC000052660166	453841216	/nfs/dbraw/zinc/84/12/16/453841216.db2.gz	FTAMYEAQLXGFIM-NRFANRHFSA-N	0	3	335.451	3.494	20	30		EGEDHN
C=CCOc1ccc(C(=O)N(CCN(C)C)C2CCCC2)cc1OC	ZINC000053152362	453862084	/nfs/dbraw/zinc/86/20/84/453862084.db2.gz	QUQDFVQVFHBWCW-UHFFFAOYSA-N	0	3	346.471	3.206	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cc(Cc3ccccc3)ccc2O)CC1	ZINC000081459959	453874078	/nfs/dbraw/zinc/87/40/78/453874078.db2.gz	OEGBAAUKORABGU-UHFFFAOYSA-N	0	3	348.446	3.267	20	30		EGEDHN
CC(C)CN(C(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1)C1CCN(C)CC1	ZINC000081725391	453905494	/nfs/dbraw/zinc/90/54/94/453905494.db2.gz	QXEYUPJBFOPMGY-VQTJNVASSA-N	0	3	339.483	3.241	20	30		EGEDHN
N#Cc1nc(N2CCCN(Cc3ccccc3)CC2)ccc1Cl	ZINC000067348404	453923391	/nfs/dbraw/zinc/92/33/91/453923391.db2.gz	MMTMWZBQEWJEAS-UHFFFAOYSA-N	0	3	326.831	3.319	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H](c2ccc(Cl)cc2)C(C)C)CC1	ZINC000067707216	453959260	/nfs/dbraw/zinc/95/92/60/453959260.db2.gz	CSQJEZZFDOTFOG-SFHVURJKSA-N	0	3	332.875	3.499	20	30		EGEDHN
N#CC(C(=O)c1cnn(Cc2ccccc2)c1)c1nc2ccccc2[nH]1	ZINC000041495950	453969276	/nfs/dbraw/zinc/96/92/76/453969276.db2.gz	DTESNJLCVPXSAZ-INIZCTEOSA-N	0	3	341.374	3.298	20	30		EGEDHN
Cc1c(C(=O)C(C#N)c2cc(C)nc(C)n2)cnn1-c1ccc(F)cc1	ZINC000041560377	453972397	/nfs/dbraw/zinc/97/23/97/453972397.db2.gz	KALRIQRLEXNFLT-MRXNPFEDSA-N	0	3	349.369	3.217	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N(CCN(C)C)Cc1cccc(Cl)c1	ZINC000068311903	454016106	/nfs/dbraw/zinc/01/61/06/454016106.db2.gz	ZYQSKTUWBDIHGA-OAHLLOKOSA-N	0	3	338.879	3.211	20	30		EGEDHN
CCN(CCC#N)C(=O)CN[C@H](Cc1ccccc1)c1ccccc1	ZINC000076650239	454022200	/nfs/dbraw/zinc/02/22/00/454022200.db2.gz	HKXSNOQARPAPHG-HXUWFJFHSA-N	0	3	335.451	3.322	20	30		EGEDHN
C=C(Cl)CNC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C	ZINC000076775182	454035613	/nfs/dbraw/zinc/03/56/13/454035613.db2.gz	BHCBNXXVLQPSJV-UHFFFAOYSA-N	0	3	336.867	3.011	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@H]2C[C@H]2c2c(F)cccc2Cl)CC1	ZINC000076994586	454057864	/nfs/dbraw/zinc/05/78/64/454057864.db2.gz	RBFDULUUTRPDCF-KGLIPLIRSA-N	0	3	336.838	3.349	20	30		EGEDHN
C=CCOc1ccc(CN[C@H](CCO)c2ccccc2)cc1OC	ZINC000077467991	454109164	/nfs/dbraw/zinc/10/91/64/454109164.db2.gz	LAGWMZZDCNXVSJ-GOSISDBHSA-N	0	3	327.424	3.473	20	30		EGEDHN
COC[C@H](N[C@@H](C)C(=O)N(CCC#N)c1cc(C)cc(C)c1)C(C)C	ZINC000130281241	454186671	/nfs/dbraw/zinc/18/66/71/454186671.db2.gz	KNSVBQWOIJOZSO-HKUYNNGSSA-N	0	3	345.487	3.199	20	30		EGEDHN
N#CC(C(=O)c1cccc(OCC(F)F)n1)c1nc2ccccc2[nH]1	ZINC000089964420	454248702	/nfs/dbraw/zinc/24/87/02/454248702.db2.gz	FLPGJLNKZCTNSG-SNVBAGLBSA-N	0	3	342.305	3.092	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC1CCN([C@@H](C)c2ccccc2)CC1	ZINC000071909305	454252320	/nfs/dbraw/zinc/25/23/20/454252320.db2.gz	MXFZCFWSIZCTPK-DLBZAZTESA-N	0	3	330.472	3.309	20	30		EGEDHN
COCCC1(CN[C@H](C)C(=O)Nc2ccccc2C#N)CCCCC1	ZINC000184730466	455438408	/nfs/dbraw/zinc/43/84/08/455438408.db2.gz	NXMKGDFFMYXNQQ-MRXNPFEDSA-N	0	3	343.471	3.462	20	30		EGEDHN
C[C@H]1C[C@@H](N(C)C(=O)c2ccc(C#N)cn2)CCN1Cc1ccccc1	ZINC000132447239	454339053	/nfs/dbraw/zinc/33/90/53/454339053.db2.gz	NTXBRRILDUKMPW-LPHOPBHVSA-N	0	3	348.450	3.078	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1	ZINC000061502333	454343138	/nfs/dbraw/zinc/34/31/38/454343138.db2.gz	SIRNYWIPVGXWNR-IEBWSBKVSA-N	0	3	330.472	3.229	20	30		EGEDHN
C=CCC[N@@H+](C)Cc1cccc([N-]S(=O)(=O)c2ccccc2)c1	ZINC000132784696	454365601	/nfs/dbraw/zinc/36/56/01/454365601.db2.gz	MVRAUQPPMASTNR-UHFFFAOYSA-N	0	3	330.453	3.495	20	30		EGEDHN
C=CCC[N@H+](C)Cc1cccc([N-]S(=O)(=O)c2ccccc2)c1	ZINC000132784696	454365607	/nfs/dbraw/zinc/36/56/07/454365607.db2.gz	MVRAUQPPMASTNR-UHFFFAOYSA-N	0	3	330.453	3.495	20	30		EGEDHN
Cc1nn(-c2ccccc2)c(CN2CCN(C3CCCC3)CC2)c1C#N	ZINC000091066358	454374974	/nfs/dbraw/zinc/37/49/74/454374974.db2.gz	NPSZZWPMZLBDIK-UHFFFAOYSA-N	0	3	349.482	3.113	20	30		EGEDHN
COc1ccc(CN2CCC(CNc3ccc(C#N)cn3)CC2)cc1	ZINC000063282527	454400708	/nfs/dbraw/zinc/40/07/08/454400708.db2.gz	GEIRYXOOVDQGAU-UHFFFAOYSA-N	0	3	336.439	3.286	20	30		EGEDHN
C=CCN(CCC(=O)Nc1ccccc1C#N)Cc1cccc(C#N)c1	ZINC000063300300	454403274	/nfs/dbraw/zinc/40/32/74/454403274.db2.gz	CCAICOGIVMGGDT-UHFFFAOYSA-N	0	3	344.418	3.447	20	30		EGEDHN
CC(C)(CNC(=O)c1cccc(SCC#N)c1)N1CCCCC1	ZINC000079526245	454431101	/nfs/dbraw/zinc/43/11/01/454431101.db2.gz	HKLMJKNRCGMVJC-UHFFFAOYSA-N	0	3	331.485	3.297	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2ccc(C#N)cc2)CCN1Cc1ccccc1	ZINC000079553069	454437997	/nfs/dbraw/zinc/43/79/97/454437997.db2.gz	NITNEYMCOGYBFK-OXQOHEQNSA-N	0	3	333.435	3.341	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)C2(C#N)CCCC2)CCN1Cc1ccccc1	ZINC000079558687	454439197	/nfs/dbraw/zinc/43/91/97/454439197.db2.gz	WXFMZOGYAYDQNW-SJLPKXTDSA-N	0	3	325.456	3.240	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)C2(C#N)CCCC2)CCN1Cc1ccccc1	ZINC000079558691	454439792	/nfs/dbraw/zinc/43/97/92/454439792.db2.gz	WXFMZOGYAYDQNW-FUHWJXTLSA-N	0	3	325.456	3.240	20	30		EGEDHN
C[C@@H](CNC(=O)CSCc1ccc(C#N)cc1)N1CCCC[C@H]1C	ZINC000048220680	454458329	/nfs/dbraw/zinc/45/83/29/454458329.db2.gz	UVYOJQPQEGIYOW-CVEARBPZSA-N	0	3	345.512	3.171	20	30		EGEDHN
C[C@H](CN1CCCCC1)NC(=O)N[C@H](CCC#N)c1ccccc1	ZINC000133799079	454468593	/nfs/dbraw/zinc/46/85/93/454468593.db2.gz	AJBGLFFMHHQLBO-SJLPKXTDSA-N	0	3	328.460	3.205	20	30		EGEDHN
Cc1nc(CON=C(N)c2cccc(CN3CCCCC3)c2)cs1	ZINC000101540825	454472752	/nfs/dbraw/zinc/47/27/52/454472752.db2.gz	BHNJRRDLHAPFKD-UHFFFAOYSA-N	0	3	344.484	3.275	20	30		EGEDHN
C=CCOc1ccc(C(=O)N(CC(C)C)C2CCN(C)CC2)cc1	ZINC000074139573	454536774	/nfs/dbraw/zinc/53/67/74/454536774.db2.gz	WYHMGEWJWQIHAZ-UHFFFAOYSA-N	0	3	330.472	3.444	20	30		EGEDHN
CN(CC#Cc1ccc(OC(F)(F)F)cc1)[C@@H](CO)C(C)(C)C	ZINC000134445729	454544331	/nfs/dbraw/zinc/54/43/31/454544331.db2.gz	XJVLSLWHNWNRLO-HNNXBMFYSA-N	0	3	329.362	3.276	20	30		EGEDHN
CCN(CC)[C@H](C/N=C/c1ccc(O)c(O)c1O)c1ccsc1	ZINC000122565894	454548405	/nfs/dbraw/zinc/54/84/05/454548405.db2.gz	AEAGUZCAPORYKG-UHPUNMKFSA-N	0	3	334.441	3.367	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cccc(OCCF)c2)CC1	ZINC000122662663	454557249	/nfs/dbraw/zinc/55/72/49/454557249.db2.gz	ZZXXETIAGDNGNV-UHFFFAOYSA-N	0	3	335.423	3.197	20	30		EGEDHN
Cc1noc(C)c1CCC(=O)C(C#N)C(=O)Nc1ccccc1Cl	ZINC000103504494	454561413	/nfs/dbraw/zinc/56/14/13/454561413.db2.gz	KDRYCBVHRZIQOF-CYBMUJFWSA-N	0	3	345.786	3.225	20	30		EGEDHN
C=CCOc1ccc(CNCc2ccc([S@@](C)=O)cc2)cc1OC	ZINC000080343220	454568501	/nfs/dbraw/zinc/56/85/01/454568501.db2.gz	JTHNZLFGEMFPEX-DEOSSOPVSA-N	0	3	345.464	3.287	20	30		EGEDHN
Cc1cncc(CNCc2cn(CCC#N)nc2-c2ccccc2)c1	ZINC000122933146	454583465	/nfs/dbraw/zinc/58/34/65/454583465.db2.gz	AXSJVSQYLBZYKI-UHFFFAOYSA-N	0	3	331.423	3.457	20	30		EGEDHN
N#Cc1c(CN2CC[C@@H]3[C@H](CCCN3C3CC3)C2)cn2ccccc12	ZINC000134877236	454602163	/nfs/dbraw/zinc/60/21/63/454602163.db2.gz	UMCHJBSJFCPOMG-OXQOHEQNSA-N	0	3	334.467	3.260	20	30		EGEDHN
CN(C)CCN(Cc1cccc(F)c1)c1snc(Cl)c1C#N	ZINC000092681990	454610220	/nfs/dbraw/zinc/61/02/20/454610220.db2.gz	BMSZSHWPSIUDRT-UHFFFAOYSA-N	0	3	338.839	3.375	20	30		EGEDHN
CC(C)(CCC#N)CN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000092704804	454613652	/nfs/dbraw/zinc/61/36/52/454613652.db2.gz	ZRAUSBQWTBUYCN-INIZCTEOSA-N	0	3	332.423	3.351	20	30		EGEDHN
CN(CCC#N)C(=O)CCN[C@H](c1ccccc1)c1ccc(F)cc1	ZINC000092804107	454636833	/nfs/dbraw/zinc/63/68/33/454636833.db2.gz	MLQCLXYMNRYGOQ-HXUWFJFHSA-N	0	3	339.414	3.267	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)c1ccc(F)cc1F	ZINC000065931210	454641271	/nfs/dbraw/zinc/64/12/71/454641271.db2.gz	JVWZYEYIBRGXMB-UHFFFAOYSA-N	0	3	343.377	3.040	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)Cc2ccccc2OCC)CC1	ZINC000106274862	454689585	/nfs/dbraw/zinc/68/95/85/454689585.db2.gz	HOEKPYXZQYQBID-UHFFFAOYSA-N	0	3	345.487	3.267	20	30		EGEDHN
COC(=O)C(C)(C)[C@H]1CCCN(CCCOc2cccc(C#N)c2)C1	ZINC000093298194	454700358	/nfs/dbraw/zinc/70/03/58/454700358.db2.gz	JBLKSKCNJOZMGD-KRWDZBQOSA-N	0	3	344.455	3.238	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@H](C)CSc2ccc(F)cc2)CC1	ZINC000176301756	454726319	/nfs/dbraw/zinc/72/63/19/454726319.db2.gz	RECYBUMEWAATHO-CQSZACIVSA-N	0	3	336.476	3.321	20	30		EGEDHN
C=CCOc1ccc(CN2CC[C@H](COCCOC)C2)cc1Cl	ZINC000093754149	454732058	/nfs/dbraw/zinc/73/20/58/454732058.db2.gz	NHGGKYSNTKWMPN-INIZCTEOSA-N	0	3	339.863	3.390	20	30		EGEDHN
COc1cc(CN2CCN(CC(C)(C)CCC#N)CC2)cc(OC)c1	ZINC000093841110	454740180	/nfs/dbraw/zinc/74/01/80/454740180.db2.gz	FXAUCZMXVFHPPP-UHFFFAOYSA-N	0	3	345.487	3.151	20	30		EGEDHN
CCOc1ccccc1NC(=O)CCN(C)Cc1cccc(C#N)c1	ZINC000136479313	454744173	/nfs/dbraw/zinc/74/41/73/454744173.db2.gz	SRFKZRZWZOYBQW-UHFFFAOYSA-N	0	3	337.423	3.418	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2C[C@@H](OCC)C23CCCC3)CC1	ZINC000176500316	454752736	/nfs/dbraw/zinc/75/27/36/454752736.db2.gz	LKYANDLSVSJKMA-QZTJIDSGSA-N	0	3	349.519	3.064	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN2C[C@H]3CCC[C@@H]3C2)cc1	ZINC000153071985	454757052	/nfs/dbraw/zinc/75/70/52/454757052.db2.gz	VMNFHMRJDPIVCR-IAGOWNOFSA-N	0	3	341.455	3.064	20	30		EGEDHN
CC[C@H](NCc1cccc(C#N)c1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000153641078	454816651	/nfs/dbraw/zinc/81/66/51/454816651.db2.gz	YJFFXCASBYPJCS-VXKWHMMOSA-N	0	3	349.478	3.327	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN2CCN(C3CCCCC3)CC2)c1C	ZINC000163217536	454830845	/nfs/dbraw/zinc/83/08/45/454830845.db2.gz	WQHLTYXTFDRSQG-UHFFFAOYSA-N	0	3	343.515	3.424	20	30		EGEDHN
C[C@@H](C(=O)N(CCC#N)c1ccccc1)N1C[C@@H]2CCCC[C@@H]2C1	ZINC000177534291	454874383	/nfs/dbraw/zinc/87/43/83/454874383.db2.gz	GHGPCQSJTAHTNT-OKZBNKHCSA-N	0	3	325.456	3.444	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CNCCN2CCc3sccc3C2)cc1	ZINC000112372605	454885669	/nfs/dbraw/zinc/88/56/69/454885669.db2.gz	OWIFKTYARKIRFS-OAHLLOKOSA-N	0	3	341.480	3.187	20	30		EGEDHN
C=C(Br)CN[C@H]1CCCN(C(=O)OC(C)(C)C)CC1	ZINC000167444522	454921511	/nfs/dbraw/zinc/92/15/11/454921511.db2.gz	ZVHKRDFXUKWBLZ-LBPRGKRZSA-N	0	3	333.270	3.274	20	30		EGEDHN
C#CCOc1ccc([C@H](C)N[C@H]2CCN(c3ncccc3F)C2)cc1	ZINC000168152975	454924615	/nfs/dbraw/zinc/92/46/15/454924615.db2.gz	XEGGNQYSYBOWLZ-RDJZCZTQSA-N	0	3	339.414	3.162	20	30		EGEDHN
C#CCCOc1ccc(CNCc2ccc(C3OCCO3)cc2)cc1	ZINC000114216796	454947676	/nfs/dbraw/zinc/94/76/76/454947676.db2.gz	FHNOLYMPHJPWLV-UHFFFAOYSA-N	0	3	337.419	3.424	20	30		EGEDHN
C#CCCCCNC(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000155038217	454956119	/nfs/dbraw/zinc/95/61/19/454956119.db2.gz	YPMVLZFZLDSJRD-QUCCMNQESA-N	0	3	341.499	3.484	20	30		EGEDHN
CC(C)OCCN1CCC(Nc2c(C#N)cnc3ccccc32)CC1	ZINC000267070699	455497910	/nfs/dbraw/zinc/49/79/10/455497910.db2.gz	QQKBXKMLYHXQKL-UHFFFAOYSA-N	0	3	338.455	3.408	20	30		EGEDHN
CN(C)Cc1cccc(NC(=O)/C=C/c2ccc(OCC#N)cc2)c1	ZINC000127620024	454982505	/nfs/dbraw/zinc/98/25/05/454982505.db2.gz	GVNHTOFPPCVCSN-DHZHZOJOSA-N	0	3	335.407	3.302	20	30		EGEDHN
CC1CCN([C@@H](CNC(=O)c2ccc(C#N)[nH]2)c2cccs2)CC1	ZINC000151512061	454994961	/nfs/dbraw/zinc/99/49/61/454994961.db2.gz	RNSZAADWFBPQBF-INIZCTEOSA-N	0	3	342.468	3.151	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN[C@@H](C)c1ccc(C#N)cc1	ZINC000127771049	454995561	/nfs/dbraw/zinc/99/55/61/454995561.db2.gz	FWEIGAOIQJXLEQ-OXJNMPFZSA-N	0	3	336.435	3.377	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(OC(C)C)c(C#N)c2)CC1	ZINC000178995415	454996721	/nfs/dbraw/zinc/99/67/21/454996721.db2.gz	MPQWJGPRZJBNKX-UHFFFAOYSA-N	0	3	342.443	3.117	20	30		EGEDHN
N#CC(C(=O)c1cnc2ccc(F)cc2c1)c1nnc2n1CCCCC2	ZINC000179000261	454997313	/nfs/dbraw/zinc/99/73/13/454997313.db2.gz	YMRKZLMVDHKTKO-HNNXBMFYSA-N	0	3	349.369	3.182	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H]2CCC[C@@H](SC)C2)CC1	ZINC000117493439	455087457	/nfs/dbraw/zinc/08/74/57/455087457.db2.gz	GFHHGFQOIGHRPM-JKSUJKDBSA-N	0	3	325.522	3.000	20	30		EGEDHN
C=CCN1CCC(NC(=O)C(C)(C)Oc2cccc(Cl)c2)CC1	ZINC000172001778	455107843	/nfs/dbraw/zinc/10/78/43/455107843.db2.gz	XZCGIBVSBUINGQ-UHFFFAOYSA-N	0	3	336.863	3.264	20	30		EGEDHN
CC[C@@H]1CCCCN1CCNC(=O)Nc1ccccc1O[C@@H](C)C#N	ZINC000180073418	455127034	/nfs/dbraw/zinc/12/70/34/455127034.db2.gz	JNGBCTGQNVPGCI-JKSUJKDBSA-N	0	3	344.459	3.363	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCC2(c3cccc(Cl)c3)CC2)CC1	ZINC000172390324	455150861	/nfs/dbraw/zinc/15/08/61/455150861.db2.gz	YOCNPHLHQQVUDT-UHFFFAOYSA-N	0	3	347.890	3.321	20	30		EGEDHN
CC(C)CO[C@H]1CCN(Cc2cn(C)nc2-c2ccc(C#N)cc2)C1	ZINC000180274028	455154285	/nfs/dbraw/zinc/15/42/85/455154285.db2.gz	XQRCBQRGLBUHOI-IBGZPJMESA-N	0	3	338.455	3.206	20	30		EGEDHN
C[C@@H]1C[C@H](N(C)C(=O)NCCCCC#N)CCN1Cc1ccccc1	ZINC000172582840	455162866	/nfs/dbraw/zinc/16/28/66/455162866.db2.gz	WARYDSSVAAGEGZ-IEBWSBKVSA-N	0	3	342.487	3.375	20	30		EGEDHN
COC[C@H](NCC(=O)Nc1ccccc1S[C@H](C)CC#N)C1CC1	ZINC000183433359	455292996	/nfs/dbraw/zinc/29/29/96/455292996.db2.gz	OEWYOLOZWIWNFX-CJNGLKHVSA-N	0	3	347.484	3.034	20	30		EGEDHN
C[C@H]1CCN(C(=O)c2cccc(C#N)c2)CCN1Cc1ccccc1	ZINC000173523135	455299814	/nfs/dbraw/zinc/29/98/14/455299814.db2.gz	ROGYBQJSRGEVAC-KRWDZBQOSA-N	0	3	333.435	3.295	20	30		EGEDHN
C[C@@H]1CCC[C@](C#N)(NC(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000265370301	455313742	/nfs/dbraw/zinc/31/37/42/455313742.db2.gz	OBOZPEGURBKJKX-UTKZUKDTSA-N	0	3	339.483	3.487	20	30		EGEDHN
C[C@H](CSC(C)(C)C)N[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000190621956	455355524	/nfs/dbraw/zinc/35/55/24/455355524.db2.gz	ZJULDWUEYXZSQM-RHSMWYFYSA-N	0	3	345.512	3.169	20	30		EGEDHN
C[C@@H](NC[C@@H](O)COc1ccc(C#N)cc1)c1cc2ccccc2o1	ZINC000182634546	455557310	/nfs/dbraw/zinc/55/73/10/455557310.db2.gz	COVCBZFZTJDQQH-RHSMWYFYSA-N	0	3	336.391	3.395	20	30		EGEDHN
C[C@@H](NC[C@H](O)COc1ccc(C#N)cc1)c1cc2ccccc2o1	ZINC000182634512	455557411	/nfs/dbraw/zinc/55/74/11/455557411.db2.gz	COVCBZFZTJDQQH-PBHICJAKSA-N	0	3	336.391	3.395	20	30		EGEDHN
C[C@H]1CCN(Cc2cn(C)nc2-c2ccc(C#N)cc2)CCS1	ZINC000192188291	455570845	/nfs/dbraw/zinc/57/08/45/455570845.db2.gz	SACBJCWVTFANQQ-AWEZNQCLSA-N	0	3	326.469	3.286	20	30		EGEDHN
C=CCCOCC(=O)N(CC)[C@H]1CCN([C@@H](C)c2ccccc2)C1	ZINC000620531718	460679916	/nfs/dbraw/zinc/67/99/16/460679916.db2.gz	NNFLORWIYPJXOK-HKUYNNGSSA-N	0	3	330.472	3.263	20	30		EGEDHN
N#Cc1cc(C(=O)N2C[C@@H]3CCCN3Cc3ccccc32)ccc1F	ZINC000283802940	455595941	/nfs/dbraw/zinc/59/59/41/455595941.db2.gz	ATENZPVIIPJNPM-KRWDZBQOSA-N	0	3	335.382	3.322	20	30		EGEDHN
C[C@H](c1ccc(C#N)cc1)N1C[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C1	ZINC000277632506	455619511	/nfs/dbraw/zinc/61/95/11/455619511.db2.gz	BJSMWRTZUKRVPU-CKEIUWERSA-N	0	3	329.444	3.464	20	30		EGEDHN
N#CCOc1ccc(CN2CCC[C@@H]2C[C@@H](O)c2ccco2)cc1	ZINC000268310511	455647879	/nfs/dbraw/zinc/64/78/79/455647879.db2.gz	XLTZMCQWYKLCMU-SJLPKXTDSA-N	0	3	326.396	3.270	20	30		EGEDHN
C[C@@H](N[C@@H]1CCC[C@H](C#N)C1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000192691521	455669682	/nfs/dbraw/zinc/66/96/82/455669682.db2.gz	VHQJTRJBYFWQRU-RVKKMQEKSA-N	0	3	341.455	3.077	20	30		EGEDHN
C[C@H](N[C@@H]1CCC[C@@H](C#N)C1)c1cc(F)ccc1N1CCN(C)CC1	ZINC000248809846	455731855	/nfs/dbraw/zinc/73/18/55/455731855.db2.gz	KKODVTATIYYGEC-LZLYRXPVSA-N	0	3	344.478	3.310	20	30		EGEDHN
C=CCN(CCC#N)Cc1ccccc1N(C)C1CCN(C)CC1	ZINC000292704502	455736932	/nfs/dbraw/zinc/73/69/32/455736932.db2.gz	CSIFVOARNMWNEK-UHFFFAOYSA-N	0	3	326.488	3.119	20	30		EGEDHN
CC(C)C[C@H]1OCCC[C@H]1NCC(=O)N(CCC#N)c1ccccc1	ZINC000186358460	455751301	/nfs/dbraw/zinc/75/13/01/455751301.db2.gz	FFVMAYMJVLKLNM-RTBURBONSA-N	0	3	343.471	3.117	20	30		EGEDHN
Cc1ccc(CN[C@H]2CCC[C@H](C#N)C2)c(-n2cc(Cl)cn2)n1	ZINC000193338077	455753089	/nfs/dbraw/zinc/75/30/89/455753089.db2.gz	WEOCLROVMOBQGW-BBRMVZONSA-N	0	3	329.835	3.401	20	30		EGEDHN
N#CCCOCCN(CCCO)C(c1ccccc1)c1ccccc1	ZINC000292801589	455760882	/nfs/dbraw/zinc/76/08/82/455760882.db2.gz	MHLWWOMCQHXMIM-UHFFFAOYSA-N	0	3	338.451	3.391	20	30		EGEDHN
Cn1cc(CN2CCC[C@H]2[C@H]2CCCO2)c(-c2ccc(C#N)cc2)n1	ZINC000284990011	455773940	/nfs/dbraw/zinc/77/39/40/455773940.db2.gz	YJRJVWBJKQXBRO-RBUKOAKNSA-N	0	3	336.439	3.102	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@@H](C)N[C@H](CC)c1ccc(OC)c(OC)c1	ZINC000285036749	455780470	/nfs/dbraw/zinc/78/04/70/455780470.db2.gz	HZWGSBMNPBHRIJ-NVXWUHKLSA-N	0	3	346.471	3.334	20	30		EGEDHN
COc1ccc2c(c1)OC[C@H](N[C@@H](C)c1ccc(OCC#N)cc1)C2	ZINC000271899422	455797804	/nfs/dbraw/zinc/79/78/04/455797804.db2.gz	VFXOOHWRBHEVLX-WMLDXEAASA-N	0	3	338.407	3.252	20	30		EGEDHN
COc1ccc(CN[C@H](C)[C@@H]2CCCCO2)cc1OCCCC#N	ZINC000271941849	455800108	/nfs/dbraw/zinc/80/01/08/455800108.db2.gz	BTURIYYQZHCQCW-WBVHZDCISA-N	0	3	332.444	3.425	20	30		EGEDHN
COc1ccc(CN[C@@H](C)[C@H]2CCCCO2)cc1OCCCC#N	ZINC000271941842	455800288	/nfs/dbraw/zinc/80/02/88/455800288.db2.gz	BTURIYYQZHCQCW-DOTOQJQBSA-N	0	3	332.444	3.425	20	30		EGEDHN
C=CCOCCNC1(c2cccc(OC(F)(F)F)c2)CCOCC1	ZINC000293987171	455801944	/nfs/dbraw/zinc/80/19/44/455801944.db2.gz	FFPBLQNUOKEBEX-UHFFFAOYSA-N	0	3	345.361	3.383	20	30		EGEDHN
C=CCc1cc(CN2CCC[C@](CO)(C(C)C)C2)cc(OC)c1O	ZINC000293972671	455802462	/nfs/dbraw/zinc/80/24/62/455802462.db2.gz	KGCYIIJYRMHYNW-FQEVSTJZSA-N	0	3	333.472	3.360	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C	ZINC000294237550	455808868	/nfs/dbraw/zinc/80/88/68/455808868.db2.gz	AYXZHXBFPNRWGW-FGTMMUONSA-N	0	3	348.512	3.109	20	30		EGEDHN
C=CCOc1ccc(CC(=O)NCc2cccc(CN(C)C)c2)cc1	ZINC000294294076	455810335	/nfs/dbraw/zinc/81/03/35/455810335.db2.gz	FKQKJCYBZZPFKK-UHFFFAOYSA-N	0	3	338.451	3.172	20	30		EGEDHN
CC[C@](C)(C#N)C(=O)Nc1ccc(OCCN2CCCC2)c(C)c1	ZINC000285382449	455833911	/nfs/dbraw/zinc/83/39/11/455833911.db2.gz	CSYHOYRSOXPNPJ-LJQANCHMSA-N	0	3	329.444	3.348	20	30		EGEDHN
CC1(C)[C@H](NCc2cc(C#N)ccc2Br)[C@H]2CCO[C@@H]21	ZINC000295092040	455838737	/nfs/dbraw/zinc/83/87/37/455838737.db2.gz	ADCJFNTWNLKBTQ-YUELXQCFSA-N	0	3	335.245	3.224	20	30		EGEDHN
CC[C@H](C)N1CCN(Cc2ccc(OC)c(OCCCC#N)c2)CC1	ZINC000295325713	455846418	/nfs/dbraw/zinc/84/64/18/455846418.db2.gz	XFGMHRYXLCTIGB-KRWDZBQOSA-N	0	3	345.487	3.294	20	30		EGEDHN
CN(CCc1ccccc1[N+](=O)[O-])Cc1ccc(OCC#N)cc1	ZINC000285458607	455850665	/nfs/dbraw/zinc/85/06/65/455850665.db2.gz	ZCFYXVGRTXORJP-UHFFFAOYSA-N	0	3	325.368	3.172	20	30		EGEDHN
N#CCC[C@H](NC(=O)N1CC[C@@H](N2CCCCC2)C1)c1ccccc1	ZINC000269636372	455851187	/nfs/dbraw/zinc/85/11/87/455851187.db2.gz	WBMIAFBHVFTKRY-MOPGFXCFSA-N	0	3	340.471	3.301	20	30		EGEDHN
COc1cccc([C@@H](C)N[C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)c1	ZINC000272173821	455866434	/nfs/dbraw/zinc/86/64/34/455866434.db2.gz	GTAPILBMSZIKEL-FOIQADDNSA-N	0	3	349.434	3.413	20	30		EGEDHN
COc1ccc([C@H](C)NC(=O)C(C#N)Cc2ccc(C#N)cc2)cc1	ZINC000279812887	455873969	/nfs/dbraw/zinc/87/39/69/455873969.db2.gz	XNEVMIMYSYSADQ-KBXCAEBGSA-N	0	3	333.391	3.127	20	30		EGEDHN
C=CCCCNCc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-]	ZINC000280000649	455880773	/nfs/dbraw/zinc/88/07/73/455880773.db2.gz	VFHGQPCAFQCMLX-UHFFFAOYSA-N	0	3	330.331	3.303	20	30		EGEDHN
CC1(C)[C@H](NCc2ccc(C#N)cc2Br)[C@H]2CCO[C@@H]21	ZINC000296215107	455882707	/nfs/dbraw/zinc/88/27/07/455882707.db2.gz	MPIHCKQAJORQBE-YUELXQCFSA-N	0	3	335.245	3.224	20	30		EGEDHN
C[C@H]1C[C@@H](N2CCCC2)CN1C(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000285656781	455891015	/nfs/dbraw/zinc/89/10/15/455891015.db2.gz	FAPPQISBODCULP-MAUKXSAKSA-N	0	3	325.456	3.187	20	30		EGEDHN
CCC[C@]1(COC)CCCN1Cc1nnc(-c2ccc(C#N)cc2)o1	ZINC000194923845	455901592	/nfs/dbraw/zinc/90/15/92/455901592.db2.gz	PAIRRGBFQZRULR-LJQANCHMSA-N	0	3	340.427	3.389	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CCc3cc(Cl)ccc3C2)cc1	ZINC000280193083	455913209	/nfs/dbraw/zinc/91/32/09/455913209.db2.gz	YZAZGIUALWEHNT-SFHVURJKSA-N	0	3	349.821	3.479	20	30		EGEDHN
N#CCc1ccc(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1	ZINC000270273647	455917081	/nfs/dbraw/zinc/91/70/81/455917081.db2.gz	KPNMDUPMDVQEFF-FQEVSTJZSA-N	0	3	333.435	3.320	20	30		EGEDHN
C=C(C)[C@H](N[C@H](C)C1CCS(=O)(=O)CC1)c1ccc(F)c(F)c1	ZINC000187567793	455926884	/nfs/dbraw/zinc/92/68/84/455926884.db2.gz	JEXGJCWQKKEHED-PXAZEXFGSA-N	0	3	343.439	3.385	20	30		EGEDHN
CC1(C)[C@H](NCC#Cc2ccc(OC(F)(F)F)cc2)[C@H]2CCO[C@H]21	ZINC000296470479	455947825	/nfs/dbraw/zinc/94/78/25/455947825.db2.gz	XUJLEJIQOHNRCX-BZUAXINKSA-N	0	3	339.357	3.340	20	30		EGEDHN
CC[C@H]1c2ccsc2CCN1C[C@H](O)COc1ccc(C#N)cc1	ZINC000198642961	456010437	/nfs/dbraw/zinc/01/04/37/456010437.db2.gz	GBLKYIBDVCLAKL-YJBOKZPZSA-N	0	3	342.464	3.369	20	30		EGEDHN
CO[C@]1(C)CCCN(Cc2cn(CCC#N)nc2-c2ccccc2)C1	ZINC000280688993	456032234	/nfs/dbraw/zinc/03/22/34/456032234.db2.gz	VNOYJGJAXGRKSW-HXUWFJFHSA-N	0	3	338.455	3.465	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1CNCc1cccc(OC)c1OC(F)F	ZINC000280724710	456039627	/nfs/dbraw/zinc/03/96/27/456039627.db2.gz	VGNPGTUSVLDGTA-ZFWWWQNUSA-N	0	3	327.371	3.367	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@@H](C)N[C@@H](C)c1ccc(OC)c(OC)c1C	ZINC000286671032	456051135	/nfs/dbraw/zinc/05/11/35/456051135.db2.gz	BNFHJRQGRIIOOX-JKSUJKDBSA-N	0	3	348.487	3.476	20	30		EGEDHN
C[C@@H](CN(C)C)NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1	ZINC000286854346	456055258	/nfs/dbraw/zinc/05/52/58/456055258.db2.gz	BGBLAIBXWQGSLF-AWEZNQCLSA-N	0	3	338.411	3.422	20	30		EGEDHN
C=CCNC(=O)[C@H](C)N[C@H](C)c1ccc(Oc2cccnc2)cc1	ZINC000287245333	456064847	/nfs/dbraw/zinc/06/48/47/456064847.db2.gz	PCADSRQITZBOFG-CABCVRRESA-N	0	3	325.412	3.215	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)NC2CCN(CC(=C)C)CC2)cc1	ZINC000287500805	456071348	/nfs/dbraw/zinc/07/13/48/456071348.db2.gz	UNKSZBASOOFTJZ-UHFFFAOYSA-N	0	3	343.471	3.091	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1	ZINC000188491477	456072791	/nfs/dbraw/zinc/07/27/91/456072791.db2.gz	GMVQHFSYUZUJGG-QKLQHJQFSA-N	0	3	336.520	3.327	20	30		EGEDHN
CN(C(=O)C(C#N)Cc1ccc(C#N)cc1)C1CCC(F)(F)CC1	ZINC000288834575	456107311	/nfs/dbraw/zinc/10/73/11/456107311.db2.gz	ACNJSHSTWWLWAE-OAHLLOKOSA-N	0	3	331.366	3.277	20	30		EGEDHN
COc1cc(CN(CCN(C)C)Cc2cccs2)ccc1C#N	ZINC000289436240	456124621	/nfs/dbraw/zinc/12/46/21/456124621.db2.gz	LJXOBRDOLLZYMY-UHFFFAOYSA-N	0	3	329.469	3.192	20	30		EGEDHN
CN(C)[C@@H](CNC(=O)/C=C\c1ccc(OCC#N)cc1)c1ccccc1	ZINC000229941468	456130842	/nfs/dbraw/zinc/13/08/42/456130842.db2.gz	VHYHVSJNHJQKHG-IMTHGLKYSA-N	0	3	349.434	3.021	20	30		EGEDHN
N#CCC[C@H](NC(=O)C1C[C@@H](c2ccccc2)OC1=O)c1ccccc1	ZINC000289816560	456144022	/nfs/dbraw/zinc/14/40/22/456144022.db2.gz	NVVDWKNHPVXPIS-FHWLQOOXSA-N	0	3	348.402	3.452	20	30		EGEDHN
N#Cc1cc(Cl)ccc1NCc1ccccc1CN1CC[C@H](O)C1	ZINC000273048500	456159240	/nfs/dbraw/zinc/15/92/40/456159240.db2.gz	BFQCBRAVGLIXBL-SFHVURJKSA-N	0	3	341.842	3.390	20	30		EGEDHN
N#CCCn1cc(CN2CCN(C3CCC3)CC2)c(-c2ccccc2)n1	ZINC000271210017	456175353	/nfs/dbraw/zinc/17/53/53/456175353.db2.gz	XSSSFFBUZZHABX-UHFFFAOYSA-N	0	3	349.482	3.134	20	30		EGEDHN
COc1ccc([C@H](CN2CCCC2)NC(=O)c2cccc(C#N)c2)cc1	ZINC000271257105	456193428	/nfs/dbraw/zinc/19/34/28/456193428.db2.gz	GDFIZJQQZOBZJU-FQEVSTJZSA-N	0	3	349.434	3.134	20	30		EGEDHN
C[C@@H](C#N)Oc1ccccc1NC(=O)N(C)[C@@H](C)C1CCN(C)CC1	ZINC000273354596	456225328	/nfs/dbraw/zinc/22/53/28/456225328.db2.gz	BQSNPAOUKUQKMD-GJZGRUSLSA-N	0	3	344.459	3.171	20	30		EGEDHN
CCO[C@@H]1C[C@@H](/[NH+]=C/c2ccc(N(CC)CC)cc2[O-])[C@]12CCCO2	ZINC000273538219	456238179	/nfs/dbraw/zinc/23/81/79/456238179.db2.gz	SNUWWJNMXYMJNP-IGFFHSSSSA-N	0	3	346.471	3.384	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/Cc2nnc(SC)s2)c([O-])c1	ZINC000275727407	456297030	/nfs/dbraw/zinc/29/70/30/456297030.db2.gz	TXEZYWYADYZEPM-CXUHLZMHSA-N	0	3	336.486	3.431	20	30		EGEDHN
C[C@H]1C[C@@H](Nc2nc3ccccn3c2C#N)CN1Cc1ccccc1	ZINC000302147719	456299536	/nfs/dbraw/zinc/29/95/36/456299536.db2.gz	GXKZOYVCEXYOFV-DOTOQJQBSA-N	0	3	331.423	3.281	20	30		EGEDHN
C=CCN1CCC(Nc2ccc([N+](=O)[O-])cc2OC(F)F)CC1	ZINC000302152857	456300824	/nfs/dbraw/zinc/30/08/24/456300824.db2.gz	LEYNLAFKTCEGLT-UHFFFAOYSA-N	0	3	327.331	3.259	20	30		EGEDHN
N#Cc1cccc(OCCCN2CCCC[C@H]2[C@H](O)C(F)(F)F)c1	ZINC000340192831	456304737	/nfs/dbraw/zinc/30/47/37/456304737.db2.gz	PYLMLAJDTOQMGM-HOTGVXAUSA-N	0	3	342.361	3.105	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1F)c1ncc(C#N)cc1Cl	ZINC000347701802	456313918	/nfs/dbraw/zinc/31/39/18/456313918.db2.gz	DALCLSZOZYQIRP-UHFFFAOYSA-N	0	3	332.810	3.314	20	30		EGEDHN
COc1ccc2c(c1OC)CCN(CCCC1(C#N)CCOCC1)C2	ZINC000337187241	456336624	/nfs/dbraw/zinc/33/66/24/456336624.db2.gz	PXOSWFUGTLXCPC-UHFFFAOYSA-N	0	3	344.455	3.162	20	30		EGEDHN
C=CCN(CC(=O)NCc1ccccc1OC)CC1CCCCC1	ZINC000303447540	456460729	/nfs/dbraw/zinc/46/07/29/456460729.db2.gz	JJOMVFSRZHXVDF-UHFFFAOYSA-N	0	3	330.472	3.380	20	30		EGEDHN
C=CCn1c(-c2ccc(C)o2)nnc1N1CC[C@H](N2CCCCC2)C1	ZINC000282310904	456473783	/nfs/dbraw/zinc/47/37/83/456473783.db2.gz	PLGRBGDUNHBKRM-INIZCTEOSA-N	0	3	341.459	3.097	20	30		EGEDHN
N#CCCn1cc(CN2CC[C@@H](n3cccn3)C2)c(-c2ccccc2)n1	ZINC000291220801	456568435	/nfs/dbraw/zinc/56/84/35/456568435.db2.gz	JMYBDOGYPDVSEZ-LJQANCHMSA-N	0	3	346.438	3.107	20	30		EGEDHN
C=CCOc1ccc(CN[C@H]2CCO[C@H]2c2nccn2C)cc1Cl	ZINC000343386613	456580287	/nfs/dbraw/zinc/58/02/87/456580287.db2.gz	GUZJGQOWIDONFF-DOTOQJQBSA-N	0	3	347.846	3.258	20	30		EGEDHN
C=CCn1c(-c2cc(C)oc2C)nnc1N1CCN(C)[C@@H](C(C)C)C1	ZINC000337916167	456597428	/nfs/dbraw/zinc/59/74/28/456597428.db2.gz	UQCGXOJINBKZTG-QGZVFWFLSA-N	0	3	343.475	3.117	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N1CCN(CC2CCCCC2)CC1	ZINC000337942540	456613600	/nfs/dbraw/zinc/61/36/00/456613600.db2.gz	LEEQSNRZRZTDMB-UHFFFAOYSA-N	0	3	325.456	3.205	20	30		EGEDHN
C[C@@H](CN1CCOCC1)N(Cc1ccccc1)Cc1cccc(C#N)c1	ZINC000353324074	456638366	/nfs/dbraw/zinc/63/83/66/456638366.db2.gz	GJCRYBUFSATTCR-IBGZPJMESA-N	0	3	349.478	3.281	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@@H](N[C@@H](CN1CCOCC1)c1ccccc1)CC2	ZINC000353411128	456683045	/nfs/dbraw/zinc/68/30/45/456683045.db2.gz	JSPJVJHRGSAYJX-VXKWHMMOSA-N	0	3	347.462	3.209	20	30		EGEDHN
CCO[C@@H]1C[C@H](NCC(=O)N[C@H]2CCOc3ccccc32)C1(C)C	ZINC000328656593	456728860	/nfs/dbraw/zinc/72/88/60/456728860.db2.gz	OAGJCTQBAKAXEN-BHYGNILZSA-N	0	3	332.444	3.260	20	30		EGEDHN
N#Cc1ccc(NC(=O)CN[C@H]2CCC[C@@H]2OCc2ccccc2)cc1	ZINC000348523259	456735199	/nfs/dbraw/zinc/73/51/99/456735199.db2.gz	CNRVCMXFIADBJT-PMACEKPBSA-N	0	3	349.434	3.224	20	30		EGEDHN
CCc1ccc(CNC(=O)CN[C@@H]2CCC(=O)NC23CCC3)s1	ZINC000328699314	456739339	/nfs/dbraw/zinc/73/93/39/456739339.db2.gz	MFHKWXJKIYKQIO-CQSZACIVSA-N	0	3	335.473	3.398	20	30		EGEDHN
CC1CCN(C[C@H](O)CNC(=O)c2coc(C3CCCCC3)n2)CC1	ZINC000328715365	456744023	/nfs/dbraw/zinc/74/40/23/456744023.db2.gz	CUKANONSGRYMMJ-MRXNPFEDSA-N	0	3	349.475	3.120	20	30		EGEDHN
Cc1nccn1C[C@@H]1CCCN1C([O-])=[NH+][C@@H]1CCO[C@H](C(C)(C)C)C1	ZINC000328934365	456795825	/nfs/dbraw/zinc/79/58/25/456795825.db2.gz	PZBCYROAAHVSQM-IKGGRYGDSA-N	0	3	348.491	3.164	20	30		EGEDHN
Cn1nccc1[C@@H]1OCCC[C@H]1C(=O)NCC(C)(C)N1CCCCC1	ZINC000328940120	456797161	/nfs/dbraw/zinc/79/71/61/456797161.db2.gz	HLDLODSMLRTVJU-NVXWUHKLSA-N	0	3	348.491	3.109	20	30		EGEDHN
C[C@H]1[C@@H](NC(=O)c2cccc(CC#N)c2)CCN1Cc1ccccc1	ZINC000291923338	456799376	/nfs/dbraw/zinc/79/93/76/456799376.db2.gz	RXOXOBOKTZRPED-JXFKEZNVSA-N	0	3	333.435	3.145	20	30		EGEDHN
Cc1cc(C(=O)N[C@H]2CCN(C3CC3)C2)c2c(n1)onc2C(C)C	ZINC000328969146	456802614	/nfs/dbraw/zinc/80/26/14/456802614.db2.gz	APPICQYVTHZXQE-LBPRGKRZSA-N	0	3	328.416	3.196	20	30		EGEDHN
Cc1cccc(C)c1NC(=O)CN1CCC[C@@H]1[C@@H]1COCC[C@@]1(C)O	ZINC000328968289	456803412	/nfs/dbraw/zinc/80/34/12/456803412.db2.gz	NTAWRRWGSXOMMK-SQGPQFPESA-N	0	3	346.471	3.143	20	30		EGEDHN
CC(C)[C@@H]1N(C[C@H](O)COc2ccc(CC#N)cc2)CC12CCC2	ZINC000292003235	456826468	/nfs/dbraw/zinc/82/64/68/456826468.db2.gz	XTJYICVRCNQNEV-HKUYNNGSSA-N	0	3	328.456	3.003	20	30		EGEDHN
C[C@@H](c1ccccc1)[C@H](NCc1ccccc1C(C)(C)C#N)C(N)=O	ZINC000292075811	456847601	/nfs/dbraw/zinc/84/76/01/456847601.db2.gz	DBPVJYBSOUUVHJ-KXBFYZLASA-N	0	3	335.451	3.235	20	30		EGEDHN
CC(C#N)C(=O)N1CCc2c(Br)ccc(Cl)c2C1	ZINC000344807242	456862526	/nfs/dbraw/zinc/86/25/26/456862526.db2.gz	GZECFZIQNWRPOY-MRVPVSSYSA-N	0	3	327.609	3.147	20	30		EGEDHN
CCN1CCO[C@H](CN[C@@H]2CCC[C@H](C#N)C2)[C@@H]1c1ccccc1	ZINC000344900746	456869898	/nfs/dbraw/zinc/86/98/98/456869898.db2.gz	YVKPIZMJKYKVQM-NBYUQASBSA-N	0	3	327.472	3.120	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN(C)[C@H]1CCO[C@H](c2ccc(F)cc2)C1	ZINC000348822304	456871223	/nfs/dbraw/zinc/87/12/23/456871223.db2.gz	NRTLGQPFQCCFDP-OALUTQOASA-N	0	3	348.462	3.402	20	30		EGEDHN
Cc1c(C(=O)N[C@@H]2CN(C3CC3)C[C@H]2C)cnn1C1CCCCC1	ZINC000329500907	456900289	/nfs/dbraw/zinc/90/02/89/456900289.db2.gz	KHTGUWSDUBXLJZ-FZKQIMNGSA-N	0	3	330.476	3.484	20	30		EGEDHN
Cc1nn(C(F)F)c(C)c1CC(=O)N[C@H](C)C1=CCN(C)CC1	ZINC000329528404	456905097	/nfs/dbraw/zinc/90/50/97/456905097.db2.gz	UQJNKULHGCEHIE-SNVBAGLBSA-N	0	3	326.391	3.044	20	30		EGEDHN
Cc1nc2ccccc2n1CCC(=O)N[C@@H]1C[C@H](C)N(C2CC2)C1	ZINC000329580613	456912022	/nfs/dbraw/zinc/91/20/22/456912022.db2.gz	WXFIXJVRABREAQ-DZGCQCFKSA-N	0	3	326.444	3.317	20	30		EGEDHN
C=CCN(CC=C)[C@H](CN1C(=O)N[C@@H](c2ccsc2)C1=O)C(C)C	ZINC000349234808	456918969	/nfs/dbraw/zinc/91/89/69/456918969.db2.gz	RBKXFNFETZCVDS-CVEARBPZSA-N	0	3	347.484	3.040	20	30		EGEDHN
CCc1nccn1[C@@H]1CCCN(C([O-])=[NH+]C[C@@H]2CCCSC2)C1	ZINC000329705912	456930308	/nfs/dbraw/zinc/93/03/08/456930308.db2.gz	KRPHIYYDWDZUHD-LSDHHAIUSA-N	0	3	336.505	3.140	20	30		EGEDHN
CCN1CCC(NC(=O)CN2C[C@H]3CCC(=O)c4cccc2c43)CC1	ZINC000329821316	456946172	/nfs/dbraw/zinc/94/61/72/456946172.db2.gz	PRIANCQUUNMESI-CQSZACIVSA-N	0	3	341.455	3.008	20	30		EGEDHN
[O-]C(=[NH+]C[C@@H]1CCc2nccn2C1)N1CCC[C@@H]1C1CCCCC1	ZINC000329897435	456957726	/nfs/dbraw/zinc/95/77/26/456957726.db2.gz	LKARCROJZJGLII-DOTOQJQBSA-N	0	3	330.476	3.404	20	30		EGEDHN
C[C@H](c1ccncc1)N1CCC(NC(=O)[C@H]2CCCOCC2)CC1	ZINC000329898214	456957915	/nfs/dbraw/zinc/95/79/15/456957915.db2.gz	LYUIMHBWPHNFPZ-WBVHZDCISA-N	0	3	331.460	3.380	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCc2nccc3ccccc32)cc1	ZINC000349422390	456966209	/nfs/dbraw/zinc/96/62/09/456966209.db2.gz	IVNSHAOVFNYBQQ-SFHVURJKSA-N	0	3	340.386	3.105	20	30		EGEDHN
C[C@@H]1[C@H](NC(=O)Nc2cccc(C#Cc3ccccn3)c2)CCCN1C	ZINC000345306731	456974559	/nfs/dbraw/zinc/97/45/59/456974559.db2.gz	YUCPLFPXZYDIHW-OXQOHEQNSA-N	0	3	348.450	3.086	20	30		EGEDHN
C=CCNC(=O)NC(=O)CN[C@H](CC(C)C)c1ccc(Cl)cc1	ZINC000341883530	456985465	/nfs/dbraw/zinc/98/54/65/456985465.db2.gz	FCQMYQZAGADZKX-OAHLLOKOSA-N	0	3	337.851	3.029	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H]2CCCc3sc(C)nc32)CC1	ZINC000345897897	457004967	/nfs/dbraw/zinc/00/49/67/457004967.db2.gz	AWSVQKDQQWPDTA-HNNXBMFYSA-N	0	3	333.501	3.028	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2cn(CCCC#N)c3ccccc23)CCN1C	ZINC000346104314	457016833	/nfs/dbraw/zinc/01/68/33/457016833.db2.gz	WOYZITDTBVYARL-HZPDHXFCSA-N	0	3	338.455	3.158	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN1CCC[C@H]1Cc1ccccc1C	ZINC000358962269	457043038	/nfs/dbraw/zinc/04/30/38/457043038.db2.gz	BPQWTLUGQSZLDZ-LPHOPBHVSA-N	0	3	327.472	3.010	20	30		EGEDHN
COc1ccc(SC)c(OC)c1C(=O)N[C@@H]1CCN(C)[C@@H](C)C1	ZINC000330673678	457069544	/nfs/dbraw/zinc/06/95/44/457069544.db2.gz	YSATZVJEJNETRP-NWDGAFQWSA-N	0	3	338.473	3.213	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H]2CCSc3ccccc32)CC1	ZINC000359414384	457082265	/nfs/dbraw/zinc/08/22/65/457082265.db2.gz	QNWRSKOOOPDJCX-KRWDZBQOSA-N	0	3	330.497	3.423	20	30		EGEDHN
COc1ccc(C(=O)N[C@@H]2CCN(C)[C@H](C)C2)c(OC(F)F)c1	ZINC000331011976	457120638	/nfs/dbraw/zinc/12/06/38/457120638.db2.gz	JPXILPDQRULNOJ-GHMZBOCLSA-N	0	3	328.359	3.084	20	30		EGEDHN
CC(C)Cc1ccc([C@H](CNC(=O)C2(C#N)CCC2)N(C)C)cc1	ZINC000359892561	457140165	/nfs/dbraw/zinc/14/01/65/457140165.db2.gz	ICXURMGBVFNIJZ-SFHVURJKSA-N	0	3	327.472	3.298	20	30		EGEDHN
CCCCN(C)C(=O)C1CCN(Cc2ccc(C#N)c(C)c2)CC1	ZINC000362932205	457161353	/nfs/dbraw/zinc/16/13/53/457161353.db2.gz	VIVDQKXWRQSTTH-UHFFFAOYSA-N	0	3	327.472	3.337	20	30		EGEDHN
C[C@@H](CN1C[C@H](C)C[C@@H](C)C1)NC(=O)c1cc(C#N)ccc1Cl	ZINC000350074202	457162147	/nfs/dbraw/zinc/16/21/47/457162147.db2.gz	KXDXCRFDTXBHBK-MCIONIFRSA-N	0	3	333.863	3.308	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)C(C)(C)c1cccnc1)C(C)C	ZINC000350084954	457163310	/nfs/dbraw/zinc/16/33/10/457163310.db2.gz	WZGTUDAMXJUNDC-SFHVURJKSA-N	0	3	329.488	3.174	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CCC(C)(C#N)CC2)C1	ZINC000331501415	457195570	/nfs/dbraw/zinc/19/55/70/457195570.db2.gz	BMZXDUWHOAFWJR-SJLPKXTDSA-N	0	3	340.471	3.157	20	30		EGEDHN
C[C@H]1C[C@@H](N(C)C(=O)c2cnccc2C#N)CCN1Cc1ccccc1	ZINC000342269618	457201036	/nfs/dbraw/zinc/20/10/36/457201036.db2.gz	BMDNCMAGEVYYIH-LPHOPBHVSA-N	0	3	348.450	3.078	20	30		EGEDHN
C[C@H](C(=O)N(CCC#N)c1ccccc1)N1CC[C@@H](CC2CC2)C1	ZINC000339681341	457210170	/nfs/dbraw/zinc/21/01/70/457210170.db2.gz	HERNQSOYXUTWPP-AEFFLSMTSA-N	0	3	325.456	3.444	20	30		EGEDHN
N#CC(C(=O)c1ccc(-n2cnc3ccccc32)cc1)c1ccncn1	ZINC000354467136	457242179	/nfs/dbraw/zinc/24/21/79/457242179.db2.gz	NSRJOYXXZLVWON-MRXNPFEDSA-N	0	3	339.358	3.306	20	30		EGEDHN
CC[C@@H]1Cc2ccccc2CN1C[C@H](O)COc1ccc(C#N)cc1	ZINC000342350197	457250893	/nfs/dbraw/zinc/25/08/93/457250893.db2.gz	SOKBTTMZXDBQND-UXHICEINSA-N	0	3	336.435	3.135	20	30		EGEDHN
CC1(C)CCCN(CCNC(=O)C[C@H](CC#N)c2ccccc2)C1	ZINC000357112845	457330086	/nfs/dbraw/zinc/33/00/86/457330086.db2.gz	DKYNRJGRRNQGHN-SFHVURJKSA-N	0	3	327.472	3.312	20	30		EGEDHN
CC(=O)Nc1c[nH]nc1[C@@H]1CCCN([C@@H](C)c2ccc(C#N)cc2)C1	ZINC000332316489	457347341	/nfs/dbraw/zinc/34/73/41/457347341.db2.gz	KLTVFGPNCQMTBQ-SUMWQHHRSA-N	0	3	337.427	3.180	20	30		EGEDHN
CSC1(CNC(=O)c2ccc(C(C)(C)C#N)cc2)CCN(C)CC1	ZINC000355446457	457373621	/nfs/dbraw/zinc/37/36/21/457373621.db2.gz	ROEOBSJLRBTLOT-UHFFFAOYSA-N	0	3	345.512	3.045	20	30		EGEDHN
CC(C)CN1CCO[C@H](CN[C@H]2CCCCc3cc(C#N)ccc32)C1	ZINC000360838317	457377494	/nfs/dbraw/zinc/37/74/94/457377494.db2.gz	UBTQOPOLFYCMER-CTNGQTDRSA-N	0	3	341.499	3.272	20	30		EGEDHN
C=C[C@H](CO)NCc1cn(-c2ccccc2)nc1-c1ccccc1C	ZINC000352453279	457379179	/nfs/dbraw/zinc/37/91/79/457379179.db2.gz	LNCGCNWDJCVIRA-GOSISDBHSA-N	0	3	333.435	3.484	20	30		EGEDHN
N#Cc1ccc(C2=CCN(C(=O)C3CCN(C4CC4)CC3)CC2)cc1	ZINC000369795531	457404878	/nfs/dbraw/zinc/40/48/78/457404878.db2.gz	KJIGFJGOFYYRMN-UHFFFAOYSA-N	0	3	335.451	3.048	20	30		EGEDHN
CCC(C)(C)N[C@H](C)C(=O)Nc1nc(C)c(SCC#N)s1	ZINC000356010198	457439562	/nfs/dbraw/zinc/43/95/62/457439562.db2.gz	LLZOIZAVGIKFMA-SECBINFHSA-N	0	3	326.491	3.172	20	30		EGEDHN
N#Cc1ccnc(N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)c1Cl	ZINC000425271333	457477545	/nfs/dbraw/zinc/47/75/45/457477545.db2.gz	CJCLSLYXAUBVDI-DLBZAZTESA-N	0	3	338.842	3.317	20	30		EGEDHN
CC(C#N)C(=O)N(Cc1nnc(-c2ccc(Cl)cc2)o1)C1CC1	ZINC000347562564	457509026	/nfs/dbraw/zinc/50/90/26/457509026.db2.gz	MSOBFISXVCGOAV-JTQLQIEISA-N	0	3	330.775	3.041	20	30		EGEDHN
C=CCOc1cccc(CNc2cccc(CN3CC[C@H](O)C3)c2)c1	ZINC000361044923	457540736	/nfs/dbraw/zinc/54/07/36/457540736.db2.gz	NYNAAPADGUVBSC-FQEVSTJZSA-N	0	3	338.451	3.430	20	30		EGEDHN
C=CCN(CCC(=O)Nc1ccc2c(c1)OCO2)CCc1ccco1	ZINC000352700164	457541470	/nfs/dbraw/zinc/54/14/70/457541470.db2.gz	ADGZJTQZIBBHHH-UHFFFAOYSA-N	0	3	342.395	3.068	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC000404688439	457546018	/nfs/dbraw/zinc/54/60/18/457546018.db2.gz	QCUZAVHQFKRXKF-HNNXBMFYSA-N	0	3	333.407	3.186	20	30		EGEDHN
COC(=O)c1cccc(OCCN(C)[C@H](C)c2cccc(C#N)c2)c1	ZINC000425542086	457590562	/nfs/dbraw/zinc/59/05/62/457590562.db2.gz	YCCQGKHAXKTXJT-OAHLLOKOSA-N	0	3	338.407	3.417	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)C[C@@H](O)COc1ccccc1F	ZINC000425544350	457592613	/nfs/dbraw/zinc/59/26/13/457592613.db2.gz	SKPAZSUIIRPBIC-RHSMWYFYSA-N	0	3	328.387	3.130	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCc2cncc3ccccc32)CC1	ZINC000361218965	457650291	/nfs/dbraw/zinc/65/02/91/457650291.db2.gz	AZBOJWKETXZCEV-UHFFFAOYSA-N	0	3	337.467	3.324	20	30		EGEDHN
Cn1nccc1C1=C[C@H]2CC[C@@H](C1)N2CCCOc1ccc(C#N)cc1	ZINC000374762253	457701755	/nfs/dbraw/zinc/70/17/55/457701755.db2.gz	MZMQCRJDKUCRJO-MOPGFXCFSA-N	0	3	348.450	3.381	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2c[nH]cc2-c2cccc(OC)c2)CC1	ZINC000357825751	457702813	/nfs/dbraw/zinc/70/28/13/457702813.db2.gz	AWGUHSQAFRTUOX-UHFFFAOYSA-N	0	3	339.439	3.071	20	30		EGEDHN
CN(CCCNC(=O)C(C#N)CCc1ccccc1)c1ccccc1	ZINC000433169146	457768609	/nfs/dbraw/zinc/76/86/09/457768609.db2.gz	PYFZLNCXZOVTAL-LJQANCHMSA-N	0	3	335.451	3.402	20	30		EGEDHN
CC(=O)Nc1cccc(CNC(=O)C(C#N)CCc2ccccc2)c1	ZINC000433223534	457783510	/nfs/dbraw/zinc/78/35/10/457783510.db2.gz	QBIAOTAGRDMKIE-GOSISDBHSA-N	0	3	335.407	3.034	20	30		EGEDHN
C[C@H](C(=O)N(C)CCC#N)N1CCC(C)(c2cccc(Cl)c2)CC1	ZINC000361544147	457784369	/nfs/dbraw/zinc/78/43/69/457784369.db2.gz	SHBZGWBYTJZILO-OAHLLOKOSA-N	0	3	347.890	3.454	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCc1ccc(-n2cccn2)cc1	ZINC000433223673	457784693	/nfs/dbraw/zinc/78/46/93/457784693.db2.gz	RPOQTYKDVWAYKT-IBGZPJMESA-N	0	3	344.418	3.261	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCc1ccnc(N2CCCC2)c1	ZINC000433232894	457785677	/nfs/dbraw/zinc/78/56/77/457785677.db2.gz	NFWLNHLRDGRCFO-IBGZPJMESA-N	0	3	348.450	3.071	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NC[C@H]1CCN(c2ccccc2)C1	ZINC000433231839	457786096	/nfs/dbraw/zinc/78/60/96/457786096.db2.gz	YUNPNQLEYAUJKR-UXHICEINSA-N	0	3	347.462	3.402	20	30		EGEDHN
CN(CCOc1ccccc1C(C)(C)C)CCC(=O)N(C)CCC#N	ZINC000361593112	457802909	/nfs/dbraw/zinc/80/29/09/457802909.db2.gz	GJVCOQLHLIAGEG-UHFFFAOYSA-N	0	3	345.487	3.057	20	30		EGEDHN
C=CC[C@H]1N(C(=O)c2ccnc(OCCN(C)C)c2)CCCC1(C)C	ZINC000444633258	457923690	/nfs/dbraw/zinc/92/36/90/457923690.db2.gz	RVEXTDXAPJVCCH-QGZVFWFLSA-N	0	3	345.487	3.229	20	30		EGEDHN
C=CC[C@H](C(=O)NCC(C)(C)N1CCC(OC)CC1)c1ccccc1	ZINC000426997693	457933552	/nfs/dbraw/zinc/93/35/52/457933552.db2.gz	MHMDMKPNHGWSGQ-IBGZPJMESA-N	0	3	344.499	3.352	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)[C@@H](C)Cc2cccc(F)c2)CC1	ZINC000458325999	458013605	/nfs/dbraw/zinc/01/36/05/458013605.db2.gz	TWJLXEDWNPIVGA-INIZCTEOSA-N	0	3	347.478	3.439	20	30		EGEDHN
C[C@H](NC(C)(C)CNC(=O)NCC(C)(C)CC#N)c1ccccc1	ZINC000458366963	458025540	/nfs/dbraw/zinc/02/55/40/458025540.db2.gz	HKEXILQHPPZLSC-HNNXBMFYSA-N	0	3	330.476	3.355	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H]2CC(C)(C)Oc3ccccc32)CC1	ZINC000412043754	458061900	/nfs/dbraw/zinc/06/19/00/458061900.db2.gz	QFEJCERUWJUVNP-GOSISDBHSA-N	0	3	342.483	3.488	20	30		EGEDHN
C=C[C@@H]1CCCCN1C(=O)c1ccc(CN2CCC(CO)CC2)cc1	ZINC000428033036	458070101	/nfs/dbraw/zinc/07/01/01/458070101.db2.gz	AIWBNDOHDFLDGU-HXUWFJFHSA-N	0	3	342.483	3.072	20	30		EGEDHN
CS[C@H]1CN(c2nc3c(cc2C#N)CCCC3(C)C)C[C@H]1N(C)C	ZINC000428167665	458090208	/nfs/dbraw/zinc/09/02/08/458090208.db2.gz	RPMYNMOAAWYHHG-CVEARBPZSA-N	0	3	344.528	3.049	20	30		EGEDHN
C=CCC[C@H](NC(=O)NC[C@]1(N(C)C)CCSC1)c1ccccc1	ZINC000435111934	458095541	/nfs/dbraw/zinc/09/55/41/458095541.db2.gz	UDGIDAKYPNOTOA-PKOBYXMFSA-N	0	3	347.528	3.430	20	30		EGEDHN
C=CCOc1ccc(CN[C@H]2Cc3cccc(O)c3C2)cc1OC	ZINC000428573931	458173062	/nfs/dbraw/zinc/17/30/62/458173062.db2.gz	QFVQSWDJJFQAQY-INIZCTEOSA-N	0	3	325.408	3.223	20	30		EGEDHN
CCCCOC1CCN(CCC(=O)Nc2cccc(C#N)c2)CC1	ZINC000362447306	458182704	/nfs/dbraw/zinc/18/27/04/458182704.db2.gz	BWONCAFXFANYCN-UHFFFAOYSA-N	0	3	329.444	3.168	20	30		EGEDHN
C=CCN(CC=C)C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C	ZINC000458907513	458211668	/nfs/dbraw/zinc/21/16/68/458211668.db2.gz	XBBCWXPBTADAGQ-KRWDZBQOSA-N	0	3	333.501	3.395	20	30		EGEDHN
Cc1ccccc1OCCCN1CC[C@@H](Oc2ccc(C#N)cn2)C1	ZINC000428823707	458217420	/nfs/dbraw/zinc/21/74/20/458217420.db2.gz	XJSYWWPJPVHPCM-GOSISDBHSA-N	0	3	337.423	3.184	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNc1cc(N2CCCC2)ncn1)C(C)C	ZINC000358803249	458226666	/nfs/dbraw/zinc/22/66/66/458226666.db2.gz	GXGCLQWQVVRLPJ-QGZVFWFLSA-N	0	3	329.492	3.187	20	30		EGEDHN
C=C(C)CCNC(=O)N(Cc1ccncc1)C[C@@H]1CCCN1CC	ZINC000459014341	458244171	/nfs/dbraw/zinc/24/41/71/458244171.db2.gz	ZTIUFRVRWVETDK-SFHVURJKSA-N	0	3	330.476	3.044	20	30		EGEDHN
N#Cc1cccc(CNC(=O)CN[C@H]2CCC[C@H]2c2ccccc2)c1	ZINC000376278547	458257217	/nfs/dbraw/zinc/25/72/17/458257217.db2.gz	HTUOWNFSVJDACA-PMACEKPBSA-N	0	3	333.435	3.100	20	30		EGEDHN
COc1ccc(CNCc2ccccc2-c2cnn(C)c2)cc1C#N	ZINC000372291338	458266898	/nfs/dbraw/zinc/26/68/98/458266898.db2.gz	JDOLEHBSRITWCL-UHFFFAOYSA-N	0	3	332.407	3.257	20	30		EGEDHN
N#CCCCNC1(c2cccc(OC(F)(F)F)c2)CCOCC1	ZINC000447320498	458285970	/nfs/dbraw/zinc/28/59/70/458285970.db2.gz	BOJZFFQUCLVOOW-UHFFFAOYSA-N	0	3	328.334	3.484	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1S[C@@H](C)CCOC	ZINC000447366983	458287859	/nfs/dbraw/zinc/28/78/59/458287859.db2.gz	UBKBMFZKPLDIGD-HNNXBMFYSA-N	0	3	338.521	3.010	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@@H]1CNc1ccnc2cc(OC)c(OC)cc21	ZINC000413261719	458296683	/nfs/dbraw/zinc/29/66/83/458296683.db2.gz	FDZOLUWTFIPANZ-BFUOFWGJSA-N	0	3	328.412	3.067	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NC(=O)N[C@H](C)C1=CCN(C)CC1	ZINC000413439489	458301292	/nfs/dbraw/zinc/30/12/92/458301292.db2.gz	KAPAINJVJYMAJW-VQIMIIECSA-N	0	3	327.472	3.123	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@H]2CN(C)CC[C@H]21	ZINC000413824181	458308080	/nfs/dbraw/zinc/30/80/80/458308080.db2.gz	CATCXLLWOVOKOS-XUVXKRRUSA-N	0	3	341.499	3.300	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H]1CCN(C(=O)c2cccc(CC#N)c2)C1	ZINC000369710892	458322874	/nfs/dbraw/zinc/32/28/74/458322874.db2.gz	UHSITOFDCVHXND-HXUWFJFHSA-N	0	3	333.435	3.099	20	30		EGEDHN
C=CCN(Cc1ccccc1)C(=O)Nc1ccc2c(c1)CNCCO2	ZINC000415965547	458335711	/nfs/dbraw/zinc/33/57/11/458335711.db2.gz	AHWULFJJSACFAX-UHFFFAOYSA-N	0	3	337.423	3.389	20	30		EGEDHN
N#CC(C(=O)c1cnc2c(F)cccc2c1)c1nnc2n1CCCCC2	ZINC000429680324	458356848	/nfs/dbraw/zinc/35/68/48/458356848.db2.gz	HJOVLFHUTQLRNJ-CQSZACIVSA-N	0	3	349.369	3.182	20	30		EGEDHN
C[C@H](NCC(=O)NCc1ccc(C#N)cc1)c1ccc(C2CC2)cc1	ZINC000419365156	458380279	/nfs/dbraw/zinc/38/02/79/458380279.db2.gz	XNLKTHKXSCJQOB-HNNXBMFYSA-N	0	3	333.435	3.403	20	30		EGEDHN
C=CCN(CCc1ccco1)Cc1cccc(CN2CCOCC2)c1	ZINC000420933775	458404109	/nfs/dbraw/zinc/40/41/09/458404109.db2.gz	IIBQTIBTCAHCMB-UHFFFAOYSA-N	0	3	340.467	3.343	20	30		EGEDHN
CC1(C)[C@H](c2ccccc2)CCN1CC(=O)NCc1ccc(C#N)cc1	ZINC000421008957	458405305	/nfs/dbraw/zinc/40/53/05/458405305.db2.gz	BGLMXOFTQYOFCV-FQEVSTJZSA-N	0	3	347.462	3.443	20	30		EGEDHN
C=CCOc1ccc(CC(=O)NC[C@H](C)N2CCC(C)CC2)cc1	ZINC000448810162	458410890	/nfs/dbraw/zinc/41/08/90/458410890.db2.gz	HSARLKKOGMMYHS-KRWDZBQOSA-N	0	3	330.472	3.031	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)[C@H]1CC12CCSCC2)C(C)C	ZINC000448974633	458417624	/nfs/dbraw/zinc/41/76/24/458417624.db2.gz	LKYXYWIONNGEFY-IAGOWNOFSA-N	0	3	336.545	3.335	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCc1nc2cc(C(F)(F)F)ccc2n1C	ZINC000449549287	458426776	/nfs/dbraw/zinc/42/67/76/458426776.db2.gz	WLLBSUFGZMFMKM-DOMZBBRYSA-N	0	3	339.361	3.415	20	30		EGEDHN
C[C@@H](N[C@@H](C)CCCc1cccnc1)C(=O)Nc1ccccc1C#N	ZINC000459631084	458431188	/nfs/dbraw/zinc/43/11/88/458431188.db2.gz	BCBGIFRRWRFKAB-JKSUJKDBSA-N	0	3	336.439	3.281	20	30		EGEDHN
CN(Cc1ccccc1)[C@H]1CCN(C(=O)NCC(C)(C)CCC#N)C1	ZINC000376990265	458435448	/nfs/dbraw/zinc/43/54/48/458435448.db2.gz	CDKSRPVCJIYBJX-SFHVURJKSA-N	0	3	342.487	3.232	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1S[C@H]1CC[C@H](C#N)C1	ZINC000450743782	458456092	/nfs/dbraw/zinc/45/60/92/458456092.db2.gz	JEOUCXGUDXXXAZ-HOTGVXAUSA-N	0	3	345.516	3.277	20	30		EGEDHN
C[C@@H]1C[C@@H](c2ccccc2)[C@@H](C)N1CC(=O)NCc1cccc(C#N)c1	ZINC000451194552	458469447	/nfs/dbraw/zinc/46/94/47/458469447.db2.gz	ZDVOYACNACSATA-CBGDNZLLSA-N	0	3	347.462	3.441	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCC[C@@H](OC)C(CC)CC)CC1	ZINC000437599299	458472291	/nfs/dbraw/zinc/47/22/91/458472291.db2.gz	CLPIISGJNVBDTA-GOSISDBHSA-N	0	3	339.524	3.167	20	30		EGEDHN
CC[C@@H]1OCC[C@H]1NCC(=O)Nc1ccccc1S[C@@H](C)CC#N	ZINC000459771939	458474530	/nfs/dbraw/zinc/47/45/30/458474530.db2.gz	JBNVGLMCAMXJST-LZWOXQAQSA-N	0	3	347.484	3.176	20	30		EGEDHN
CCCN(C)[C@H](CNC(=O)[C@@]1(C#N)C[C@@H]1C)c1ccc(Cl)cc1	ZINC000451655343	458484285	/nfs/dbraw/zinc/48/42/85/458484285.db2.gz	XRULJUOXBFKXPW-FDQGKXFDSA-N	0	3	333.863	3.389	20	30		EGEDHN
C[C@@H](NCCCC#N)c1ccc(F)c(I)c1	ZINC000453199254	458521443	/nfs/dbraw/zinc/52/14/43/458521443.db2.gz	XHDXEYMUCPTOBS-SECBINFHSA-N	0	3	332.160	3.385	20	30		EGEDHN
C=C(C)CCN[C@H]1CCS(=O)(=O)c2ccc(Br)cc21	ZINC000453323717	458524187	/nfs/dbraw/zinc/52/41/87/458524187.db2.gz	SIXLPKLWAVBCIB-ZDUSSCGKSA-N	0	3	344.274	3.223	20	30		EGEDHN
C=C(C)Cn1c([C@@H]2CCCCO2)nnc1N1C[C@H](C)N(CC)C[C@H]1C	ZINC000453467247	458534759	/nfs/dbraw/zinc/53/47/59/458534759.db2.gz	QRUPKYISLDGIAJ-BBWFWOEESA-N	0	3	347.507	3.015	20	30		EGEDHN
C[C@]1(CO)CCC[C@@H]1NCC#Cc1ccc(OC(F)(F)F)cc1	ZINC000493711169	458541754	/nfs/dbraw/zinc/54/17/54/458541754.db2.gz	UANVLBWCQWLBNB-JKSUJKDBSA-N	0	3	327.346	3.077	20	30		EGEDHN
C=CCN1CC[C@@H](NCC2(c3ccc(F)cc3F)CCCC2)C1=O	ZINC000493739245	458551148	/nfs/dbraw/zinc/55/11/48/458551148.db2.gz	WWVKSANDXBAQJX-QGZVFWFLSA-N	0	3	334.410	3.153	20	30		EGEDHN
C=CCN1CC[C@H](NCC2(c3cccc(F)c3)CCCCC2)C1=O	ZINC000493762921	458558704	/nfs/dbraw/zinc/55/87/04/458558704.db2.gz	HFOQSPHJORWOSA-SFHVURJKSA-N	0	3	330.447	3.404	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N(CCc1ccc(F)cc1)C1CCCC1	ZINC000424127119	458565293	/nfs/dbraw/zinc/56/52/93/458565293.db2.gz	ANGHBMPMJJBKHT-GOSISDBHSA-N	0	3	331.435	3.161	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1ccc(SCc2cccnc2)cc1	ZINC000424137866	458567715	/nfs/dbraw/zinc/56/77/15/458567715.db2.gz	PLQPOAVMIMJMCQ-QGZVFWFLSA-N	0	3	340.452	3.334	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N1CCC[C@@H](CCCc2ccccc2)C1	ZINC000424168215	458576429	/nfs/dbraw/zinc/57/64/29/458576429.db2.gz	IADYICLSLPSURI-RTBURBONSA-N	0	3	327.472	3.269	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)[C@@H](C)c1cccc(C#N)c1)C(C)C	ZINC000461893697	458577222	/nfs/dbraw/zinc/57/72/22/458577222.db2.gz	FWCHAIYGNWTTQD-PXNSSMCTSA-N	0	3	339.483	3.477	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000424177066	458577864	/nfs/dbraw/zinc/57/78/64/458577864.db2.gz	TYIPJFZIWDPSLF-ZFWWWQNUSA-N	0	3	339.361	3.042	20	30		EGEDHN
C[C@@H](C(=O)N1CCN(CCC(C)(C)C)CC1)c1cccc(C#N)c1	ZINC000461924569	458579415	/nfs/dbraw/zinc/57/94/15/458579415.db2.gz	XCVWCLYCLJEDRP-MRXNPFEDSA-N	0	3	327.472	3.242	20	30		EGEDHN
C=CC(C)(C)CNC(=O)Nc1cccc(N2CCN(CC)CC2)c1	ZINC000455159007	458586848	/nfs/dbraw/zinc/58/68/48/458586848.db2.gz	NTXYSUIBTXLCPS-UHFFFAOYSA-N	0	3	330.476	3.162	20	30		EGEDHN
CC(C)C[C@@H](CN1CCCC1)NC(=O)Nc1cccc(CC#N)c1	ZINC000455911288	458620682	/nfs/dbraw/zinc/62/06/82/458620682.db2.gz	VWGFMJZHYWFNAU-SFHVURJKSA-N	0	3	328.460	3.385	20	30		EGEDHN
N#CCc1cccc(NC(=O)NCCCN2CCc3ccccc3C2)c1	ZINC000455954170	458623980	/nfs/dbraw/zinc/62/39/80/458623980.db2.gz	VPEUTEPYCUEQLL-UHFFFAOYSA-N	0	3	348.450	3.323	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)NC[C@H](C)N1CCCC[C@@H]1C	ZINC000463503760	458706525	/nfs/dbraw/zinc/70/65/25/458706525.db2.gz	YJUFTMGKWCAYPQ-HOTGVXAUSA-N	0	3	346.471	3.253	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CCC[C@@H](OCC2CC2)C1	ZINC000494660528	458723577	/nfs/dbraw/zinc/72/35/77/458723577.db2.gz	GBLVLQRKYPTSCN-VQTJNVASSA-N	0	3	345.483	3.046	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CCC[C@@H](OCC2CC2)C1	ZINC000494660529	458723791	/nfs/dbraw/zinc/72/37/91/458723791.db2.gz	GBLVLQRKYPTSCN-WOJBJXKFSA-N	0	3	345.483	3.046	20	30		EGEDHN
C=C[C@@H]1CCCCN1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000494704262	458733069	/nfs/dbraw/zinc/73/30/69/458733069.db2.gz	SVAULXVWRWYFNA-RBUKOAKNSA-N	0	3	327.472	3.401	20	30		EGEDHN
CC(C)Oc1ccc(C#N)cc1NC(=O)NCCN1CCC(C)CC1	ZINC000505682096	458746386	/nfs/dbraw/zinc/74/63/86/458746386.db2.gz	CBGWPZBQIRCBGT-UHFFFAOYSA-N	0	3	344.459	3.199	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)CN1CCC[C@](C)(c2ccccc2)CC1	ZINC000510079917	458774202	/nfs/dbraw/zinc/77/42/02/458774202.db2.gz	QYONQUQHHWLSRZ-SFTDATJTSA-N	0	3	341.499	3.485	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)N[C@H]1CCC(C)(C)C1	ZINC000511395430	458777622	/nfs/dbraw/zinc/77/76/22/458777622.db2.gz	DKKAGIQKOABMDT-SFHVURJKSA-N	0	3	342.487	3.210	20	30		EGEDHN
CN(CCOc1ccccc1C#N)CCc1nc(-c2ccccc2)no1	ZINC000512154111	458782277	/nfs/dbraw/zinc/78/22/77/458782277.db2.gz	XIKDVRIPHAHXEB-UHFFFAOYSA-N	0	3	348.406	3.162	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NC[C@H]1CCOC2(CCC2)C1	ZINC000515464485	458810063	/nfs/dbraw/zinc/81/00/63/458810063.db2.gz	KVROVZSJGHCZID-ZWKOTPCHSA-N	0	3	326.440	3.224	20	30		EGEDHN
Cc1cc(CNC[C@H]2CC[C@@H](c3nc(C4CC4)no3)O2)ccc1C#N	ZINC000516920371	458823183	/nfs/dbraw/zinc/82/31/83/458823183.db2.gz	DXWNGGINUAKDBZ-SJORKVTESA-N	0	3	338.411	3.137	20	30		EGEDHN
COc1cc(CN[C@@H]2CCCN(c3ccccc3F)C2)ccc1C#N	ZINC000440617275	458833779	/nfs/dbraw/zinc/83/37/79/458833779.db2.gz	SVIRIIFTBPLHLI-QGZVFWFLSA-N	0	3	339.414	3.465	20	30		EGEDHN
C=C(C)Cn1c([C@H](C)CC)nnc1N1CC[C@@H](N2CCCCC2)C1	ZINC000549693015	458883653	/nfs/dbraw/zinc/88/36/53/458883653.db2.gz	LQDACGJKWLFRSS-IAGOWNOFSA-N	0	3	331.508	3.432	20	30		EGEDHN
C=C(C)Cn1c(-c2sccc2C)nnc1N1CCN2CCC[C@@H]2C1	ZINC000555242615	458904591	/nfs/dbraw/zinc/90/45/91/458904591.db2.gz	SFAKWZLYIZAFAX-OAHLLOKOSA-N	0	3	343.500	3.176	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN(Cc1cccc(C)c1)CC(C)C	ZINC000531588088	458941741	/nfs/dbraw/zinc/94/17/41/458941741.db2.gz	BYAWWPMSUQYZRL-GOSISDBHSA-N	0	3	329.488	3.461	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)NCC2(C#N)CC2)N(CC)CC)cc1	ZINC000576951686	458954154	/nfs/dbraw/zinc/95/41/54/458954154.db2.gz	NPHFYHPYXBFKIS-GOSISDBHSA-N	0	3	342.487	3.235	20	30		EGEDHN
CN(CC(C)(C)C#N)C(=O)NC[C@@H](c1cccs1)N1CCCC1	ZINC000457454245	458962384	/nfs/dbraw/zinc/96/23/84/458962384.db2.gz	KWFFFMNOTRMBPL-AWEZNQCLSA-N	0	3	334.489	3.076	20	30		EGEDHN
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCc1ccc(C#N)c(C)c1	ZINC000556522407	458968965	/nfs/dbraw/zinc/96/89/65/458968965.db2.gz	GIEJKFOLACNSDF-OXQOHEQNSA-N	0	3	336.435	3.377	20	30		EGEDHN
O[C@@H](CNCC#Cc1cccc(C(F)(F)F)c1)Cc1ccccc1	ZINC000519825038	459012852	/nfs/dbraw/zinc/01/28/52/459012852.db2.gz	UCKPQQMRSKPXEH-GOSISDBHSA-N	0	3	333.353	3.250	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)n1	ZINC000532020207	459018680	/nfs/dbraw/zinc/01/86/80/459018680.db2.gz	VUXZYCBMGDFRPT-LLVKDONJSA-N	0	3	325.393	3.171	20	30		EGEDHN
Cc1ccccc1CN1CCC(NC(=O)C2(C#N)CC(C)C2)CC1	ZINC000532068200	459024873	/nfs/dbraw/zinc/02/48/73/459024873.db2.gz	CAOMBNSGJAJWIX-UHFFFAOYSA-N	0	3	325.456	3.016	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N[C@H]1CCN(C)[C@H](C)C1)c1ccc(F)c(F)c1	ZINC000477048860	459028945	/nfs/dbraw/zinc/02/89/45/459028945.db2.gz	YZJFGFOBRTUGHA-IFIJOSMWSA-N	0	3	337.414	3.364	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N[C@H]1CN(C2CC2)C[C@H]1C)c1ccc(F)c(F)c1	ZINC000477227248	459036921	/nfs/dbraw/zinc/03/69/21/459036921.db2.gz	YQBXDYUMNYSQMR-UUWFMWQGSA-N	0	3	349.425	3.364	20	30		EGEDHN
COC(=O)N1CCC(CN[C@H](CCC#N)c2ccc(OC)cc2)CC1	ZINC000496039354	459045798	/nfs/dbraw/zinc/04/57/98/459045798.db2.gz	CNPXEGQIZJVYHE-GOSISDBHSA-N	0	3	345.443	3.108	20	30		EGEDHN
C=C(C)CS(=O)(=O)NCC(CC)(CC)N[C@H](C)c1ccccc1	ZINC000477599802	459050376	/nfs/dbraw/zinc/05/03/76/459050376.db2.gz	FYANFKBWAAXUNE-MRXNPFEDSA-N	0	3	338.517	3.392	20	30		EGEDHN
CCN1CCN(Cc2ccccc2CNc2cc(C)nc(C#N)c2)CC1	ZINC000557492946	459077869	/nfs/dbraw/zinc/07/78/69/459077869.db2.gz	IFYUAXRXKYYXFR-UHFFFAOYSA-N	0	3	349.482	3.011	20	30		EGEDHN
CCOC1CC2(C1)CCN(C(=O)C(C#N)CCc1ccccc1)C2	ZINC000557657571	459096867	/nfs/dbraw/zinc/09/68/67/459096867.db2.gz	XMVZIEFEUOKYLH-ZJRDLVKKSA-N	0	3	326.440	3.177	20	30		EGEDHN
N#CC1(CNC2CCN(C(=O)OCc3ccccc3)CC2)CCC1	ZINC000496257468	459127047	/nfs/dbraw/zinc/12/70/47/459127047.db2.gz	SBUZGBIDWIMJNB-UHFFFAOYSA-N	0	3	327.428	3.071	20	30		EGEDHN
CC(C#N)C(=O)N[C@@H](Cc1cccc(Br)c1)CC1CC1	ZINC000479266833	459130854	/nfs/dbraw/zinc/13/08/54/459130854.db2.gz	OQXUKKVHTMBNAF-IAQYHMDHSA-N	0	3	335.245	3.436	20	30		EGEDHN
COc1ccc(N2C[C@@H](N[C@@H](C)c3cccc(C#N)c3)CC2=O)cc1	ZINC000594723195	459142026	/nfs/dbraw/zinc/14/20/26/459142026.db2.gz	YSQAJPPXVCRWGH-YOEHRIQHSA-N	0	3	335.407	3.023	20	30		EGEDHN
C[C@H](OC[C@H](O)CNCc1cccc(C#N)c1)c1ccc(Cl)cc1	ZINC000567678504	459143708	/nfs/dbraw/zinc/14/37/08/459143708.db2.gz	UXGXCBUSKHBKOH-IFXJQAMLSA-N	0	3	344.842	3.440	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN[C@@H](C)[C@@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000496444572	459195586	/nfs/dbraw/zinc/19/55/86/459195586.db2.gz	SCDHZZHSCVNXMG-QLFBSQMISA-N	0	3	347.459	3.369	20	30		EGEDHN
CN(CCN1CCCC1)C(=O)c1ccc(C#Cc2ccccc2)cc1	ZINC000590739287	459200895	/nfs/dbraw/zinc/20/08/95/459200895.db2.gz	YNLLLULOZZYYSZ-UHFFFAOYSA-N	0	3	332.447	3.254	20	30		EGEDHN
COC1CCN(C2(CNC(=O)C3(C#N)CCCCC3)CCCC2)CC1	ZINC000522102922	459214576	/nfs/dbraw/zinc/21/45/76/459214576.db2.gz	NAGLTBLUAVENPZ-UHFFFAOYSA-N	0	3	347.503	3.000	20	30		EGEDHN
C=C(C)CN(C)C[C@H](O)COc1ccc(Cl)cc1Br	ZINC000481308783	459244992	/nfs/dbraw/zinc/24/49/92/459244992.db2.gz	ASWWUTPLTBLATO-LBPRGKRZSA-N	0	3	348.668	3.350	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CCO[C@H](c2ccccc2)C1	ZINC000559271587	459247966	/nfs/dbraw/zinc/24/79/66/459247966.db2.gz	LETLSZXRFRIRPB-PMACEKPBSA-N	0	3	334.419	3.359	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN[C@@H](CC)c1ccncc1	ZINC000579704385	459250618	/nfs/dbraw/zinc/25/06/18/459250618.db2.gz	SNRZWJRBAUSTMX-MOPGFXCFSA-N	0	3	326.440	3.291	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CCN(C(=O)CCCCCC#N)C1	ZINC000590874727	459254213	/nfs/dbraw/zinc/25/42/13/459254213.db2.gz	QFWURUVZLLGMTP-GOSISDBHSA-N	0	3	327.472	3.441	20	30		EGEDHN
CC(C)N1CC[C@@H](N(C)C(=O)c2c(Cl)cc(C#N)cc2Cl)C1	ZINC000590889470	459260489	/nfs/dbraw/zinc/26/04/89/459260489.db2.gz	WYGMJSUSQUAVBH-GFCCVEGCSA-N	0	3	340.254	3.420	20	30		EGEDHN
C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NCc1ccc(F)cc1C#N	ZINC000496776200	459319569	/nfs/dbraw/zinc/31/95/69/459319569.db2.gz	NVBNKQZWGQKVKP-SUMWQHHRSA-N	0	3	347.434	3.432	20	30		EGEDHN
CCCN(CC(=O)Nc1cc(Cl)ccc1Cl)C(=O)C(C)C#N	ZINC000523686491	459323385	/nfs/dbraw/zinc/32/33/85/459323385.db2.gz	NILFGQYCLKJHHG-SNVBAGLBSA-N	0	3	342.226	3.330	20	30		EGEDHN
N#Cc1cnn2cc(CN3CCCC[C@H]3Cc3ccccc3)cnc12	ZINC000582242265	459332354	/nfs/dbraw/zinc/33/23/54/459332354.db2.gz	RZLIHBDOPLENQU-IBGZPJMESA-N	0	3	331.423	3.198	20	30		EGEDHN
Cc1cccc(CCN2CCC(Oc3ccc(C#N)cc3F)CC2)n1	ZINC000582418007	459361743	/nfs/dbraw/zinc/36/17/43/459361743.db2.gz	YNNCSPPMMNHOAM-UHFFFAOYSA-N	0	3	339.414	3.487	20	30		EGEDHN
C=CCCOCCCCC(=O)N1CCN(CC2CCCCC2)CC1	ZINC000537299510	459364344	/nfs/dbraw/zinc/36/43/44/459364344.db2.gz	GEHHGPTWMIOWSR-UHFFFAOYSA-N	0	3	336.520	3.474	20	30		EGEDHN
CC#CCCNC(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000483419129	459368288	/nfs/dbraw/zinc/36/82/88/459368288.db2.gz	HGBJPICPJMWPET-MJGOQNOKSA-N	0	3	327.472	3.094	20	30		EGEDHN
N#CC[C@@H]1CCCN(C[C@@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000595619564	459372590	/nfs/dbraw/zinc/37/25/90/459372590.db2.gz	DFEICHDIULRBDI-ZFWWWQNUSA-N	0	3	326.362	3.234	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Nc1cccc2c1OCO2)C(C)C	ZINC000541098867	459427257	/nfs/dbraw/zinc/42/72/57/459427257.db2.gz	PRNVZCIWEVLJQM-MRXNPFEDSA-N	0	3	345.443	3.235	20	30		EGEDHN
CN(CCC#N)C[C@@H](O)CN[C@@H]1CCc2ccc(-c3ccccc3)cc21	ZINC000591761372	459430146	/nfs/dbraw/zinc/43/01/46/459430146.db2.gz	FMHFTQDDGSMYBC-RBBKRZOGSA-N	0	3	349.478	3.137	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H]1CCN(c2c(C#N)cccc2[N+](=O)[O-])C1	ZINC000591820756	459447705	/nfs/dbraw/zinc/44/77/05/459447705.db2.gz	NXXHKGVPYWGILF-QGZVFWFLSA-N	0	3	336.395	3.177	20	30		EGEDHN
CCCN1CC[C@@H](NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)C1	ZINC000595808102	459448683	/nfs/dbraw/zinc/44/86/83/459448683.db2.gz	SPQCLJWXXFLHEV-LJQANCHMSA-N	0	3	342.487	3.210	20	30		EGEDHN
N#Cc1cccc(CC(=O)N(CCN2CCCCCC2)C2CCC2)c1	ZINC000561620348	459469075	/nfs/dbraw/zinc/46/90/75/459469075.db2.gz	FBRBHNHIZPJRHE-UHFFFAOYSA-N	0	3	339.483	3.358	20	30		EGEDHN
Cc1csc(NC(=O)N2CCN(C3CCC3)C[C@H](C)C2)c1C#N	ZINC000569619661	459482891	/nfs/dbraw/zinc/48/28/91/459482891.db2.gz	VSHVJFXWTJQWDO-LBPRGKRZSA-N	0	3	332.473	3.266	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1ccc(OC(F)(F)F)cc1Cl	ZINC000595991007	459492223	/nfs/dbraw/zinc/49/22/23/459492223.db2.gz	FPWSYAJRVUTKNO-SNVBAGLBSA-N	0	3	335.713	3.198	20	30		EGEDHN
C[C@@H]1CCN(CC(=O)NCc2ccc(C#N)cc2)[C@H]2CCCC[C@H]12	ZINC000562140551	459513349	/nfs/dbraw/zinc/51/33/49/459513349.db2.gz	DAEIKVSZQPLDJI-LZQZEXGQSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@H](C(=O)N(C)CC(C)(C)C#N)N1CCC(Cc2ccccc2)CC1	ZINC000497406975	459533260	/nfs/dbraw/zinc/53/32/60/459533260.db2.gz	IYKCJDZUSJATBZ-QGZVFWFLSA-N	0	3	341.499	3.338	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H]1CCN(c2nc(C#N)c(Cl)s2)C1	ZINC000596139252	459533730	/nfs/dbraw/zinc/53/37/30/459533730.db2.gz	KQGUMCHHPIVAPQ-CYBMUJFWSA-N	0	3	332.860	3.379	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN1CCN(C)[C@@H](C(C)C)C1	ZINC000487973334	459536676	/nfs/dbraw/zinc/53/66/76/459536676.db2.gz	RVHXMOQYGQMUDG-QGZVFWFLSA-N	0	3	347.528	3.175	20	30		EGEDHN
Cc1nc(NC[C@@H]2CCCN(Cc3cccs3)C2)ccc1C#N	ZINC000488093059	459538038	/nfs/dbraw/zinc/53/80/38/459538038.db2.gz	FYDBFSRAWYXBKQ-HNNXBMFYSA-N	0	3	326.469	3.069	20	30		EGEDHN
CCCN(C)[C@H](CNC(=O)NC[C@@H](C)C#N)c1ccc(Cl)cc1	ZINC000570069923	459550852	/nfs/dbraw/zinc/55/08/52/459550852.db2.gz	SWOUFLBDUBTRNK-XJKSGUPXSA-N	0	3	336.867	3.182	20	30		EGEDHN
C=CCn1cccc1C(=O)N(CCN(C)C)Cc1cccc(C)c1	ZINC000489006266	459559072	/nfs/dbraw/zinc/55/90/72/459559072.db2.gz	DAGLYVROTINOCH-UHFFFAOYSA-N	0	3	325.456	3.187	20	30		EGEDHN
C=CCOc1ccc(CNC[C@@H](O)COc2ccccc2C)cc1	ZINC000570795364	459560946	/nfs/dbraw/zinc/56/09/46/459560946.db2.gz	YDVLKRROLKRKMU-GOSISDBHSA-N	0	3	327.424	3.089	20	30		EGEDHN
N#Cc1ncccc1SC[C@H]1CN(Cc2ccccc2)CCCO1	ZINC000583575269	459561908	/nfs/dbraw/zinc/56/19/08/459561908.db2.gz	YBSMCVWEWMRTGG-QGZVFWFLSA-N	0	3	339.464	3.336	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CCC[C@@H](c3ccncc3)C2)cc1	ZINC000570969571	459562607	/nfs/dbraw/zinc/56/26/07/459562607.db2.gz	FNRKKQJCGLXDFD-UXHICEINSA-N	0	3	344.418	3.042	20	30		EGEDHN
C[C@]1(NC(=O)NCC#Cc2ccccc2)CCN(Cc2ccccc2)C1	ZINC000572885784	459590276	/nfs/dbraw/zinc/59/02/76/459590276.db2.gz	MYWOZEMWTKOFOB-QFIPXVFZSA-N	0	3	347.462	3.002	20	30		EGEDHN
CC[C@H](Cc1ccc(C)cc1)N(CC)CC(=O)NC1(C#N)CCC1	ZINC000527128144	459596267	/nfs/dbraw/zinc/59/62/67/459596267.db2.gz	BJONLBKRVPATQF-GOSISDBHSA-N	0	3	327.472	3.201	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)[C@]2(C#N)CC23CCCC3)N(C)C)cc1	ZINC000573069583	459619881	/nfs/dbraw/zinc/61/98/81/459619881.db2.gz	ORFADVKFGAAKRR-GHTZIAJQSA-N	0	3	339.483	3.442	20	30		EGEDHN
C=CCN1CC[C@H](N2CCC(C)(c3ccc(Cl)cc3)CC2)C1=O	ZINC000499771765	459651877	/nfs/dbraw/zinc/65/18/77/459651877.db2.gz	IYWLNLGUAXTRQK-KRWDZBQOSA-N	0	3	332.875	3.480	20	30		EGEDHN
CC(C)N(C(=O)c1cccc(C#N)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000592694821	459668856	/nfs/dbraw/zinc/66/88/56/459668856.db2.gz	NYVPJHIHFMEQHO-IBGZPJMESA-N	0	3	348.450	3.078	20	30		EGEDHN
COC(=O)N1CCC([C@H](C)NCC#Cc2ccccc2Cl)CC1	ZINC000492200129	459694616	/nfs/dbraw/zinc/69/46/16/459694616.db2.gz	DAKPJYISSHZBOI-AWEZNQCLSA-N	0	3	334.847	3.148	20	30		EGEDHN
N#C[C@@H]1CC[C@H](N[C@@H]2CC(=O)N(c3cccc(C(F)(F)F)c3)C2)C1	ZINC000584389685	459724349	/nfs/dbraw/zinc/72/43/49/459724349.db2.gz	RHJWJGMWCFMUJS-KWCYVHTRSA-N	0	3	337.345	3.093	20	30		EGEDHN
N#CC1(CC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)CCCCC1	ZINC000596681547	459727085	/nfs/dbraw/zinc/72/70/85/459727085.db2.gz	LESLJXWAYUFSIM-GOSISDBHSA-N	0	3	325.456	3.241	20	30		EGEDHN
C=CCCSCCNC(=O)N[C@H](CN(C)C)c1ccc(F)cc1	ZINC000596715949	459739430	/nfs/dbraw/zinc/73/94/30/459739430.db2.gz	OUGQTFBVIMYIIV-MRXNPFEDSA-N	0	3	339.480	3.037	20	30		EGEDHN
CN(C)CC(C)(C)NC(=O)/C=C/c1cn(CCC#N)c2ccccc12	ZINC000493388041	459742662	/nfs/dbraw/zinc/74/26/62/459742662.db2.gz	NEUIWAJAAZKNTF-ZHACJKMWSA-N	0	3	338.455	3.025	20	30		EGEDHN
C[C@@H]1CN(CCC(=O)N(C)CCC#N)CCc2ccc(Cl)cc21	ZINC000593066556	459763224	/nfs/dbraw/zinc/76/32/24/459763224.db2.gz	NNDWFOVNCQBSRW-CQSZACIVSA-N	0	3	333.863	3.064	20	30		EGEDHN
Cc1ccc(CN2CC[C@@H](CN(C)C(=O)CC(C)(C)C#N)C2)s1	ZINC000564091848	459771009	/nfs/dbraw/zinc/77/10/09/459771009.db2.gz	FNEMKEOGKHYKGQ-HNNXBMFYSA-N	0	3	333.501	3.277	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N[C@H]1CCO[C@H](c2ccncc2)C1	ZINC000564637050	459775297	/nfs/dbraw/zinc/77/52/97/459775297.db2.gz	DWRHEOOHFYKDPG-UFYCRDLUSA-N	0	3	349.434	3.190	20	30		EGEDHN
N#CC(C(=O)c1ccc2cnccc2c1)c1nnc2n1CCCCC2	ZINC000564777438	459776726	/nfs/dbraw/zinc/77/67/26/459776726.db2.gz	DOEGPNNKKZDNDK-MRXNPFEDSA-N	0	3	331.379	3.043	20	30		EGEDHN
N#CCCC1CCN(C(=O)c2cccc(CN3CCCC3)c2)CC1	ZINC000565020847	459780799	/nfs/dbraw/zinc/78/07/99/459780799.db2.gz	ZERYOZSXNMRCEZ-UHFFFAOYSA-N	0	3	325.456	3.438	20	30		EGEDHN
Cc1cc(C#N)nc(N2CCN(Cc3ccccc3)[C@@H](C(C)C)C2)n1	ZINC000528123916	459799223	/nfs/dbraw/zinc/79/92/23/459799223.db2.gz	BYZALYRGUCKPAW-LJQANCHMSA-N	0	3	335.455	3.004	20	30		EGEDHN
C=CCn1c(C)nnc1N1CCN(Cc2ccccc2)[C@@H](C(C)C)C1	ZINC000528295543	459801892	/nfs/dbraw/zinc/80/18/92/459801892.db2.gz	NDWQFXDFTOFFRE-LJQANCHMSA-N	0	3	339.487	3.119	20	30		EGEDHN
N#CC(C(=O)NC1CCCCC1)C(=O)[C@H]1Cc2c1cccc2Cl	ZINC000528919618	459817453	/nfs/dbraw/zinc/81/74/53/459817453.db2.gz	MHUQRNJIIVJUCC-LSDHHAIUSA-N	0	3	330.815	3.137	20	30		EGEDHN
Cc1ccccc1CN(C)C(=O)[C@@H](C)N1CCC(CCC#N)CC1	ZINC000566172610	459818956	/nfs/dbraw/zinc/81/89/56/459818956.db2.gz	FXCNBYDOHSYQTA-QGZVFWFLSA-N	0	3	327.472	3.358	20	30		EGEDHN
C[C@@H](CN1CCC(C)CC1)NC(=O)C[C@@H](CC#N)c1ccccc1	ZINC000598261305	459842280	/nfs/dbraw/zinc/84/22/80/459842280.db2.gz	QASOSMWSCGYSSW-PKOBYXMFSA-N	0	3	327.472	3.311	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2CCCC[C@H]2SC)CC1	ZINC000593339539	459852601	/nfs/dbraw/zinc/85/26/01/459852601.db2.gz	OWSPTLMHKVMKRZ-HZPDHXFCSA-N	0	3	325.522	3.000	20	30		EGEDHN
N#Cc1ccc([C@H](N[C@H]2CCC[C@H](c3ccccc3)C2)C(N)=O)cc1	ZINC000574738980	459863163	/nfs/dbraw/zinc/86/31/63/459863163.db2.gz	GUVDXMXROXRJNH-UFYCRDLUSA-N	0	3	333.435	3.401	20	30		EGEDHN
CCCN1CC[C@@H](NC(=O)c2c(Cl)cc(C#N)cc2Cl)C1	ZINC000598343936	459873113	/nfs/dbraw/zinc/87/31/13/459873113.db2.gz	YTNNQVRKLQQWBS-LLVKDONJSA-N	0	3	326.227	3.079	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CCOC(C2CC2)(C2CC2)C1	ZINC000598364535	459879709	/nfs/dbraw/zinc/87/97/09/459879709.db2.gz	OQEXVNNLAJAMOF-QGZVFWFLSA-N	0	3	338.451	3.177	20	30		EGEDHN
N#Cc1cccc(CNC(=O)CN2CCC[C@H](c3ccccc3)CC2)c1	ZINC000608977399	459897236	/nfs/dbraw/zinc/89/72/36/459897236.db2.gz	IUKQKXGRUICXTO-NRFANRHFSA-N	0	3	347.462	3.444	20	30		EGEDHN
CO[C@H](CNC(=O)C(C#N)CCc1ccccc1)C1CCCCC1	ZINC000598437842	459899316	/nfs/dbraw/zinc/89/93/16/459899316.db2.gz	QJMDTWFINVRZPQ-RTBURBONSA-N	0	3	328.456	3.470	20	30		EGEDHN
C[C@@H]1CCCCN1CCOc1ccccc1C(=O)NCCCCC#N	ZINC000609202455	459924459	/nfs/dbraw/zinc/92/44/59/459924459.db2.gz	JPNGITPZVFPCGX-QGZVFWFLSA-N	0	3	343.471	3.363	20	30		EGEDHN
C[C@@H](CCC#N)CN1CCCN(C(=O)c2ccc(Cl)cc2)CC1	ZINC000602449687	459943754	/nfs/dbraw/zinc/94/37/54/459943754.db2.gz	QSQUANCNJYBWTF-HNNXBMFYSA-N	0	3	333.863	3.428	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)N1CCN[C@@H](C(C)C)C1	ZINC000598575618	459946149	/nfs/dbraw/zinc/94/61/49/459946149.db2.gz	VEWVHXGYBWDXBI-OAHLLOKOSA-N	0	3	327.453	3.151	20	30		EGEDHN
C[C@H](NC1CCN(Cc2cccc(C#N)c2)CC1)c1cncc(F)c1	ZINC000593693432	459954508	/nfs/dbraw/zinc/95/45/08/459954508.db2.gz	ZDEYBCQFNDXVMI-HNNXBMFYSA-N	0	3	338.430	3.408	20	30		EGEDHN
N#Cc1ccc(CNC2CCN(Cc3cccc(C#N)c3)CC2)s1	ZINC000593692609	459954896	/nfs/dbraw/zinc/95/48/96/459954896.db2.gz	GUHUPLGBWFLZLL-UHFFFAOYSA-N	0	3	336.464	3.246	20	30		EGEDHN
C[C@@H](CCC#N)CN1CCCC[C@H]1C(=O)Nc1ccc2c(c1)CCO2	ZINC000602471846	459955554	/nfs/dbraw/zinc/95/55/54/459955554.db2.gz	LLKKBARNEVNMKB-YJBOKZPZSA-N	0	3	341.455	3.354	20	30		EGEDHN
CCOc1ccc([C@@H](C)NC[C@@H](O)CC(C)(C)C#N)cc1OCC	ZINC000598599284	459959296	/nfs/dbraw/zinc/95/92/96/459959296.db2.gz	IYPQLASIJGSTQT-ZBFHGGJFSA-N	0	3	334.460	3.435	20	30		EGEDHN
C[C@H](NC[C@@H](O)CC(C)(C)C#N)c1nc2ccccc2n1C(F)F	ZINC000598605598	459960254	/nfs/dbraw/zinc/96/02/54/459960254.db2.gz	BXKKKFDEOXEZOD-RYUDHWBXSA-N	0	3	336.386	3.383	20	30		EGEDHN
CN(CCOc1ccc(C(F)(F)F)cc1)C[C@H](O)CC(C)(C)C#N	ZINC000598615701	459965081	/nfs/dbraw/zinc/96/50/81/459965081.db2.gz	LBCBWBZRIRJVOQ-CQSZACIVSA-N	0	3	344.377	3.317	20	30		EGEDHN
C[C@H]1C[C@H](NC2CCN(Cc3cccc(C#N)c3)CC2)c2nccn21	ZINC000593724689	459965412	/nfs/dbraw/zinc/96/54/12/459965412.db2.gz	GOSAKHWOQCROMA-KXBFYZLASA-N	0	3	335.455	3.015	20	30		EGEDHN
Cc1ccc(N[C@H](C)CC2(C#N)CCOCC2)c(OCCN(C)C)c1	ZINC000602496173	459967834	/nfs/dbraw/zinc/96/78/34/459967834.db2.gz	BORBIMUEQXVGOW-QGZVFWFLSA-N	0	3	345.487	3.446	20	30		EGEDHN
Cc1ccccc1[C@H]([C@@H](C)NC(=O)N1CCC[C@@](C)(C#N)C1)N(C)C	ZINC000588722069	459975397	/nfs/dbraw/zinc/97/53/97/459975397.db2.gz	SWSJBRJNBCRKEH-KPFFTGBYSA-N	0	3	342.487	3.322	20	30		EGEDHN
C[C@H](CNCc1cccc(C#N)n1)Oc1ccc(Br)cc1	ZINC000602569425	460000571	/nfs/dbraw/zinc/00/05/71/460000571.db2.gz	RRYQRXUFUQOOED-GFCCVEGCSA-N	0	3	346.228	3.273	20	30		EGEDHN
CC(=O)N1CC[C@@H](N[C@H](C)CC2(C#N)CCOCC2)c2ccccc21	ZINC000602578969	460005532	/nfs/dbraw/zinc/00/55/32/460005532.db2.gz	XRJVDOSRLAURBV-CRAIPNDOSA-N	0	3	341.455	3.173	20	30		EGEDHN
CC(C)CC(=O)Nc1cccc(CNC[C@@H](O)CC(C)(C)C#N)c1	ZINC000598720700	460006732	/nfs/dbraw/zinc/00/67/32/460006732.db2.gz	PRNUWPFZTNKHQN-KRWDZBQOSA-N	0	3	331.460	3.062	20	30		EGEDHN
COCCCOc1cccc(CN[C@H](C)CC2(C#N)CCOCC2)c1	ZINC000602580190	460007874	/nfs/dbraw/zinc/00/78/74/460007874.db2.gz	DYTGBYYLYVWYCB-QGZVFWFLSA-N	0	3	346.471	3.290	20	30		EGEDHN
CC(C)(CO)N1CCN(Cc2ccc(-c3ccccc3C#N)cc2)CC1	ZINC000609846035	460027757	/nfs/dbraw/zinc/02/77/57/460027757.db2.gz	ZKZBCYJVJGHIBI-UHFFFAOYSA-N	0	3	349.478	3.114	20	30		EGEDHN
C[C@@H](CCC#N)CN1CCCN(c2nnc(C(F)(F)F)s2)CC1	ZINC000602629529	460033429	/nfs/dbraw/zinc/03/34/29/460033429.db2.gz	KYDCYMCBNUEHLL-NSHDSACASA-N	0	3	347.410	3.009	20	30		EGEDHN
C[C@@H]1[C@@H](C)N(Cc2ccccc2)[C@@H](C)CN1Cc1ccc(C#N)cn1	ZINC000594015141	460057464	/nfs/dbraw/zinc/05/74/64/460057464.db2.gz	GQJHGZVEQPZNEC-RCCFBDPRSA-N	0	3	334.467	3.437	20	30		EGEDHN
CC[C@H](C#N)N(C)C(=O)c1ccccc1OCCN1CCCC[C@H]1C	ZINC000594095063	460099957	/nfs/dbraw/zinc/09/99/57/460099957.db2.gz	SOOBDJMXBZQTIO-IAGOWNOFSA-N	0	3	343.471	3.314	20	30		EGEDHN
N#CC[C@@H]1CCCN(C(=O)c2cccc(CN3CCCCC3)c2)C1	ZINC000597902068	460101885	/nfs/dbraw/zinc/10/18/85/460101885.db2.gz	PVDPYEQWUXXVTE-KRWDZBQOSA-N	0	3	325.456	3.438	20	30		EGEDHN
N#CC[C@@H]1CCCN(C(=O)c2ccc(CN3CCCCC3)cc2)C1	ZINC000597904477	460103628	/nfs/dbraw/zinc/10/36/28/460103628.db2.gz	SGSIKYWUGVBEJP-KRWDZBQOSA-N	0	3	325.456	3.438	20	30		EGEDHN
N#Cc1ncccc1NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000589582533	460105005	/nfs/dbraw/zinc/10/50/05/460105005.db2.gz	HFNMMCVNDDBZCQ-UHFFFAOYSA-N	0	3	340.402	3.048	20	30		EGEDHN
N#CC[C@H]1CCCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000597911977	460107689	/nfs/dbraw/zinc/10/76/89/460107689.db2.gz	RUZDEBAUSHYWBA-GOSISDBHSA-N	0	3	325.456	3.051	20	30		EGEDHN
C=CCCSCCNC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000597970728	460128640	/nfs/dbraw/zinc/12/86/40/460128640.db2.gz	CIPBXLNETATQKY-UHFFFAOYSA-N	0	3	332.513	3.324	20	30		EGEDHN
CC[C@H](C)[C@@H]1CN(CC2(CC#N)CC2)CCN1CC1(CC#N)CC1	ZINC000602802479	460135220	/nfs/dbraw/zinc/13/52/20/460135220.db2.gz	USKUOAUCGROPSE-ROUUACIJSA-N	0	3	328.504	3.406	20	30		EGEDHN
C[C@H](CN1CCC[C@@H](C)C1)NC(=O)N[C@H](C)c1cccc(C#N)c1	ZINC000610401123	460142597	/nfs/dbraw/zinc/14/25/97/460142597.db2.gz	SDJVEDRKCSUZLN-BZUAXINKSA-N	0	3	328.460	3.039	20	30		EGEDHN
N#CCC[C@H](NC(=O)N[C@@H]1CCCN2CCCC[C@H]12)c1ccccc1	ZINC000594228767	460160861	/nfs/dbraw/zinc/16/08/61/460160861.db2.gz	DLOHKPYUZQWOAW-IPMKNSEASA-N	0	3	340.471	3.348	20	30		EGEDHN
CC(C)(C#N)CCN1CC[C@H](Oc2cncc(Br)c2)C1	ZINC000602889114	460173441	/nfs/dbraw/zinc/17/34/41/460173441.db2.gz	WQEBXVRXSNXWBU-ZDUSSCGKSA-N	0	3	338.249	3.237	20	30		EGEDHN
C[C@H](CC(=O)N(CCN(C)C)Cc1cccc(C#N)c1)c1ccco1	ZINC000599197955	460197554	/nfs/dbraw/zinc/19/75/54/460197554.db2.gz	DPPYQBKFTIKNJM-MRXNPFEDSA-N	0	3	339.439	3.235	20	30		EGEDHN
CN(CCc1ccccc1)[C@@H]1CCN(C(=O)c2sccc2C#N)C1	ZINC000598195605	460200099	/nfs/dbraw/zinc/20/00/99/460200099.db2.gz	PFLBNAPEQWDBMN-QGZVFWFLSA-N	0	3	339.464	3.009	20	30		EGEDHN
CC[C@H](CN1CCCC1)NC(=O)N(Cc1ccc(C#N)cc1)C1CC1	ZINC000610722119	460225900	/nfs/dbraw/zinc/22/59/00/460225900.db2.gz	JOCUZHQHOBDBEK-GOSISDBHSA-N	0	3	340.471	3.107	20	30		EGEDHN
C[C@H](NC1CCN(CC#N)CC1)c1ccc(F)cc1Br	ZINC000610812664	460241148	/nfs/dbraw/zinc/24/11/48/460241148.db2.gz	HFODALNPRDZIPR-NSHDSACASA-N	0	3	340.240	3.227	20	30		EGEDHN
C[C@@H](N[C@@H](C)c1ccc(NS(C)(=O)=O)cc1)c1cccc(C#N)c1	ZINC000610829952	460245336	/nfs/dbraw/zinc/24/53/36/460245336.db2.gz	TVVFHEQJXLKLDQ-UONOGXRCSA-N	0	3	343.452	3.342	20	30		EGEDHN
Cc1ccccc1[C@H]([C@@H](C)NC(=O)Nc1ccnc(C#N)c1)N(C)C	ZINC000603125814	460248379	/nfs/dbraw/zinc/24/83/79/460248379.db2.gz	LWOBGWVIHKKARU-KDOFPFPSSA-N	0	3	337.427	3.075	20	30		EGEDHN
COc1ccc(C#N)cc1CN1CC[C@@H](N(C)Cc2ccccc2)C1	ZINC000610968318	460267488	/nfs/dbraw/zinc/26/74/88/460267488.db2.gz	VBNQLLRTWIBDJZ-HXUWFJFHSA-N	0	3	335.451	3.273	20	30		EGEDHN
N#Cc1cc(Cl)c(C(=O)N[C@@H]2CCN(CC3CC3)C2)c(Cl)c1	ZINC000611094767	460288657	/nfs/dbraw/zinc/28/86/57/460288657.db2.gz	XXPLXWPVLPFIQE-GFCCVEGCSA-N	0	3	338.238	3.079	20	30		EGEDHN
C[C@H](NC(=O)NC[C@H]1N(C)CCCC1(C)C)c1cccc(C#N)c1	ZINC000619204618	460300750	/nfs/dbraw/zinc/30/07/50/460300750.db2.gz	AIDOBCFALXHGQL-WMLDXEAASA-N	0	3	328.460	3.039	20	30		EGEDHN
C[C@@H]1CC[C@@H](C(F)(F)F)CN1C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000619306666	460325086	/nfs/dbraw/zinc/32/50/86/460325086.db2.gz	QMVDXRDSMGFABF-UHOFOFEASA-N	0	3	349.356	3.430	20	30		EGEDHN
COCC(=O)Nc1cccc(CN[C@H]2CCCc3cc(C#N)ccc32)c1	ZINC000611390544	460352596	/nfs/dbraw/zinc/35/25/96/460352596.db2.gz	GQAXBVOJIFBVER-FQEVSTJZSA-N	0	3	349.434	3.310	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCc3ccccc3[C@@H]2CC)CC1	ZINC000603984943	460367609	/nfs/dbraw/zinc/36/76/09/460367609.db2.gz	TXUAYIMTNWWZLH-IBGZPJMESA-N	0	3	327.472	3.356	20	30		EGEDHN
COc1cc(CN[C@@H]2CCN(c3ccc(F)cc3F)C2)ccc1C#N	ZINC000619653850	460405119	/nfs/dbraw/zinc/40/51/19/460405119.db2.gz	GKUWRKGNJYYKEI-MRXNPFEDSA-N	0	3	343.377	3.214	20	30		EGEDHN
CC(C)CN(CCc1ccccc1)CC(=O)N[C@@](C)(C#N)C(C)C	ZINC000604459649	460429838	/nfs/dbraw/zinc/42/98/38/460429838.db2.gz	BDRWSOGXEKFWNT-FQEVSTJZSA-N	0	3	329.488	3.242	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)c1ccccc1CC#N	ZINC000601279962	460774430	/nfs/dbraw/zinc/77/44/30/460774430.db2.gz	LKYCREZTTXTGNM-DYESRHJHSA-N	0	3	347.462	3.393	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@@H]2CCCN3CCCC[C@H]23)cc1OC	ZINC000655350087	461201053	/nfs/dbraw/zinc/20/10/53/461201053.db2.gz	WPJMSBRCVUCSQD-IAGOWNOFSA-N	0	3	344.455	3.007	20	30		EGEDHN
CC#CC[C@H](CO)NCc1cc2ccccc2nc1N1CCCCC1	ZINC000641769046	461361498	/nfs/dbraw/zinc/36/14/98/461361498.db2.gz	OPNJOXKFZWUEPH-LJQANCHMSA-N	0	3	337.467	3.089	20	30		EGEDHN
C=CCN(C(=O)N[C@H](CN)c1ccc2ccccc2c1)[C@H](C)COC	ZINC000659528900	461373066	/nfs/dbraw/zinc/37/30/66/461373066.db2.gz	YRURLLLZHDZLJT-DNVCBOLYSA-N	0	3	341.455	3.072	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC(=O)N[C@H](C)c1ccc2ccccc2c1	ZINC000650075180	461554077	/nfs/dbraw/zinc/55/40/77/461554077.db2.gz	JPZAYGDWKSJSFZ-YSGRDPCXSA-N	0	3	338.451	3.340	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cc3c(cn2)CCCC3)CC1	ZINC000643592649	461760539	/nfs/dbraw/zinc/76/05/39/461760539.db2.gz	BPKZRPKDDCAZCH-UHFFFAOYSA-N	0	3	328.460	3.122	20	30		EGEDHN
C=CCN(CC1CCCCC1)C(=O)NC1CCN([C@H]2CCOC2)CC1	ZINC000666972681	461893947	/nfs/dbraw/zinc/89/39/47/461893947.db2.gz	FJKZEDOIMBIQDC-IBGZPJMESA-N	0	3	349.519	3.018	20	30		EGEDHN
C=CCN(CC1CCCCC1)C(=O)NC1CCN([C@@H]2CCOC2)CC1	ZINC000666972682	461894849	/nfs/dbraw/zinc/89/48/49/461894849.db2.gz	FJKZEDOIMBIQDC-LJQANCHMSA-N	0	3	349.519	3.018	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC2(c3cccc(OC)c3)CCC2)CC1	ZINC000664018893	461914986	/nfs/dbraw/zinc/91/49/86/461914986.db2.gz	FXKAMTMQHPRYBW-UHFFFAOYSA-N	0	3	343.471	3.024	20	30		EGEDHN
C=C(CNC[C@H](O)COc1ccc(SC)cc1)c1ccccc1	ZINC000644647260	462021553	/nfs/dbraw/zinc/02/15/53/462021553.db2.gz	KOXYIMADLZUKBF-KRWDZBQOSA-N	0	3	329.465	3.451	20	30		EGEDHN
C=CCCOCC(=O)N(C(C)C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000648565573	462178944	/nfs/dbraw/zinc/17/89/44/462178944.db2.gz	FSJFEKGICRIVOT-LJQANCHMSA-N	0	3	330.472	3.091	20	30		EGEDHN
C=CC[C@@H]1CCCN([C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)C1	ZINC000661384679	462224661	/nfs/dbraw/zinc/22/46/61/462224661.db2.gz	KGPAVJAHGGTSFE-VQIMIIECSA-N	0	3	328.456	3.084	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)N[C@@H]1CCCN2CCCC[C@H]12	ZINC000654439614	462225300	/nfs/dbraw/zinc/22/53/00/462225300.db2.gz	SJJYGHNYHHHSKI-QZTJIDSGSA-N	0	3	343.471	3.068	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCc1cnn(Cc2ccccc2Cl)c1	ZINC000648763034	462266505	/nfs/dbraw/zinc/26/65/05/462266505.db2.gz	LVRFSJJSSUEFTK-MSOLQXFVSA-N	0	3	331.847	3.408	20	30		EGEDHN
CCN1CCN(Cc2ccc(CNc3ccc(C#N)c(C)n3)cc2)CC1	ZINC000487880096	468057697	/nfs/dbraw/zinc/05/76/97/468057697.db2.gz	RCXXPPVWMYLSLZ-UHFFFAOYSA-N	0	3	349.482	3.011	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCCCO[C@H](C)c2ccccc2)CC1	ZINC000171704383	526431647	/nfs/dbraw/zinc/43/16/47/526431647.db2.gz	DVXMPFPCDRXIRO-QGZVFWFLSA-N	0	3	345.487	3.104	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](C)c2ccc(OC(C)C)cc2)CC1	ZINC000171710420	526438135	/nfs/dbraw/zinc/43/81/35/526438135.db2.gz	CUGGWVLQXMCLAE-MRXNPFEDSA-N	0	3	345.487	3.484	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cc(C#N)ccc2OC(C)C)CC1	ZINC000171739108	526439763	/nfs/dbraw/zinc/43/97/63/526439763.db2.gz	COJLHOLOKIEATO-UHFFFAOYSA-N	0	3	342.443	3.117	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cccc(Cl)c2N(C)C)CC1	ZINC000171737084	526441067	/nfs/dbraw/zinc/44/10/67/526441067.db2.gz	RVCQDFYQOBITSX-UHFFFAOYSA-N	0	3	336.867	3.178	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2csc(Cc3ccccc3)n2)CC1	ZINC000171718830	526449096	/nfs/dbraw/zinc/44/90/96/526449096.db2.gz	MZUMZFNBQFWUIS-UHFFFAOYSA-N	0	3	341.480	3.114	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H](CCC)CCc2ccccc2)CC1	ZINC000130227580	526929527	/nfs/dbraw/zinc/92/95/27/526929527.db2.gz	ZSYNXKIYVSHOFM-HXUWFJFHSA-N	0	3	326.484	3.249	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H](c2ccc(Cl)cc2)[C@@H]2C[C@@H]2C)CC1	ZINC000174635128	526932213	/nfs/dbraw/zinc/93/22/13/526932213.db2.gz	XMSGKXJOYQIOBS-GDIGMMSISA-N	0	3	344.886	3.499	20	30		EGEDHN
N#CC(=C([O-])c1cccc2[nH]c(=O)oc21)c1ccc(C(F)(F)F)cn1	ZINC000152077955	546865344	/nfs/dbraw/zinc/86/53/44/546865344.db2.gz	RWBZJQOIMOTEPC-JTQLQIEISA-N	0	3	347.252	3.025	20	30		EGEDHN
N#CC(C(=O)c1cccc2[nH]c(=O)oc21)c1ccc(C(F)(F)F)cn1	ZINC000152077955	546865348	/nfs/dbraw/zinc/86/53/48/546865348.db2.gz	RWBZJQOIMOTEPC-JTQLQIEISA-N	0	3	347.252	3.025	20	30		EGEDHN
C=CCOc1ccccc1CN[C@H](C)c1cccc(-n2cnnn2)c1	ZINC000161484690	546955447	/nfs/dbraw/zinc/95/54/47/546955447.db2.gz	AOOZWOBHASUIRH-OAHLLOKOSA-N	0	3	335.411	3.078	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN2CC[C@@](CO)(c3ccccc3)C2)cc1	ZINC000365835898	547778815	/nfs/dbraw/zinc/77/88/15/547778815.db2.gz	GDYRPNHTSZENHO-DYESRHJHSA-N	0	3	336.435	3.113	20	30		EGEDHN
C=CCN(CCc1ccccc1)C(=O)N[C@@H](CC)CN1CCCC1	ZINC000675193428	548869431	/nfs/dbraw/zinc/86/94/31/548869431.db2.gz	CCHVPKSIRNNQDE-IBGZPJMESA-N	0	3	329.488	3.301	20	30		EGEDHN
COCC#CCN[C@H](C)c1sc(-c2ccc(OC)cc2)nc1C	ZINC000680421556	549864725	/nfs/dbraw/zinc/86/47/25/549864725.db2.gz	SNKSDIOCHUOREW-CYBMUJFWSA-N	0	3	330.453	3.428	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)[C@H]1Cc2ccc(F)cc21)C(C)C	ZINC000684441367	550330532	/nfs/dbraw/zinc/33/05/32/550330532.db2.gz	DWLRZWVXBSQIAP-OALUTQOASA-N	0	3	330.447	3.280	20	30		EGEDHN
CC(N=Nc1cnc2ccccc2n1)c1ccc(OCCN(C)C)cc1	ZINC000727255444	574655962	/nfs/dbraw/zinc/65/59/62/574655962.db2.gz	DGOBBQILBJTSKP-UHFFFAOYSA-N	0	3	349.438	3.406	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNc1nccc(N2CCCC2)n1)C(C)C	ZINC000730106556	574920167	/nfs/dbraw/zinc/92/01/67/574920167.db2.gz	BHVKDALWPACKBO-QGZVFWFLSA-N	0	3	329.492	3.187	20	30		EGEDHN
C=CC1CCN(C(=S)NC2CCN(Cc3ccccc3)CC2)CC1	ZINC000731942266	575221051	/nfs/dbraw/zinc/22/10/51/575221051.db2.gz	LQGAUQONXGJNTE-UHFFFAOYSA-N	0	3	343.540	3.424	20	30		EGEDHN
CN(C)CCOc1ccc(N(C)C(=O)/C=C/c2ccccc2C#N)cc1	ZINC000732004264	575230434	/nfs/dbraw/zinc/23/04/34/575230434.db2.gz	JCUDSMDKGNLNPZ-MDWZMJQESA-N	0	3	349.434	3.175	20	30		EGEDHN
C#CCN(Cc1ccc(F)cc1)C(=O)NCCN1CCCC[C@@H]1CC	ZINC000733351457	575330018	/nfs/dbraw/zinc/33/00/18/575330018.db2.gz	FLDXKEAUTDGTID-IBGZPJMESA-N	0	3	345.462	3.235	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1Cl)C(=O)[C@H]1COc2ccccc21	ZINC000733678884	575381090	/nfs/dbraw/zinc/38/10/90/575381090.db2.gz	NIVIWGPNSVUNEP-OLZOCXBDSA-N	0	3	340.766	3.164	20	30		EGEDHN
CC(N=Nc1cnnc2ccccc12)c1ccc(OCCN(C)C)cc1	ZINC000733748419	575388183	/nfs/dbraw/zinc/38/81/83/575388183.db2.gz	WCYOOIHZIIDISP-UHFFFAOYSA-N	0	3	349.438	3.406	20	30		EGEDHN
N#CC1CCN(C(=O)N[C@@H](CN2CCCCC2)c2ccccc2)CC1	ZINC000734279694	575461380	/nfs/dbraw/zinc/46/13/80/575461380.db2.gz	BUQUXJWIHBLLRC-IBGZPJMESA-N	0	3	340.471	3.159	20	30		EGEDHN
C=CC[C@H](NC(=O)NC[C@H](C)N1CCC[C@H](C)C1)c1ccncc1	ZINC000734658554	575532770	/nfs/dbraw/zinc/53/27/70/575532770.db2.gz	JJNWOMABWVLMHW-BQFCYCMXSA-N	0	3	330.476	3.118	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)C[C@@H]2CCOC2)cc1	ZINC000740536475	576594343	/nfs/dbraw/zinc/59/43/43/576594343.db2.gz	UPYOPANDNFKEHV-RDJZCZTQSA-N	0	3	328.412	3.103	20	30		EGEDHN
C#CCCN1CCC(NC(=O)CCCc2ccc(Cl)cc2)CC1	ZINC000740738777	576621940	/nfs/dbraw/zinc/62/19/40/576621940.db2.gz	MGJROCADALVJBJ-UHFFFAOYSA-N	0	3	332.875	3.267	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)C[C@@H]3c4ccccc4NC3=O)nc21	ZINC000741122558	576656712	/nfs/dbraw/zinc/65/67/12/576656712.db2.gz	QMUGCVYXVSCGBF-ZIAGYGMSSA-N	0	3	344.374	3.174	20	30		EGEDHN
C=C(Br)COC(=O)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000741323491	576676327	/nfs/dbraw/zinc/67/63/27/576676327.db2.gz	ZPFAWPWANJNZAV-OAHLLOKOSA-N	0	3	338.245	3.350	20	30		EGEDHN
CCN1CCC(=NNC(=S)Nc2ccc(OC(C)C)cc2)[C@H](C)C1	ZINC000741464001	576688201	/nfs/dbraw/zinc/68/82/01/576688201.db2.gz	LSHYWNPPHYDPOW-CQSZACIVSA-N	0	3	348.516	3.478	20	30		EGEDHN
C=CCOc1ccc(CNCCN2CCc3ccccc32)cc1OC	ZINC000742717546	576794055	/nfs/dbraw/zinc/79/40/55/576794055.db2.gz	AMLWCWAOCSUGRR-UHFFFAOYSA-N	0	3	338.451	3.412	20	30		EGEDHN
C#CCOc1ccc(F)cc1NC(=O)NC[C@@H](C)N1CCC[C@@H](C)C1	ZINC000743201515	576803308	/nfs/dbraw/zinc/80/33/08/576803308.db2.gz	XAGKIYFCXFBAKJ-HUUCEWRRSA-N	0	3	347.434	3.080	20	30		EGEDHN
C#CCOc1ccc(F)cc1NC(=O)NCC(C)(C)N1CCCCC1	ZINC000743203402	576803387	/nfs/dbraw/zinc/80/33/87/576803387.db2.gz	HAJCQAVRRIMLOP-UHFFFAOYSA-N	0	3	347.434	3.224	20	30		EGEDHN
C#CCCN1CCC(NC(=O)/C=C(\C)c2ccccc2Cl)CC1	ZINC000743493005	576810367	/nfs/dbraw/zinc/81/03/67/576810367.db2.gz	DPVNILMCBPGSEG-CCEZHUSRSA-N	0	3	330.859	3.347	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)C=C(C)C(C)(C)C)cc1OC	ZINC000744031887	576819282	/nfs/dbraw/zinc/81/92/82/576819282.db2.gz	CWNBAMOBAVNOFR-UQTJOTSZSA-N	0	3	344.411	3.344	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)CCCOc3cccnc3)nc21	ZINC000744162313	576821968	/nfs/dbraw/zinc/82/19/68/576821968.db2.gz	YTHHVBXKXCOXIM-OAHLLOKOSA-N	0	3	334.379	3.302	20	30		EGEDHN
Cc1cccc2nc(C(C#N)C(=O)CCCOc3cccnc3)[nH]c21	ZINC000744162313	576821969	/nfs/dbraw/zinc/82/19/69/576821969.db2.gz	YTHHVBXKXCOXIM-OAHLLOKOSA-N	0	3	334.379	3.302	20	30		EGEDHN
COc1ccc(CN(C)CCC(=O)Nc2cccc(C#N)c2)cc1F	ZINC000026256734	1291270078	/nfs/dbraw/zinc/27/00/78/1291270078.db2.gz	RUQHZQMLOLQERN-UHFFFAOYSA-N	0	3	341.386	3.167	20	30		EGEDHN
C=C(C)CNC(=S)Nc1ccc(CCN2CCSCC2)cc1	ZINC000057817447	1291866439	/nfs/dbraw/zinc/86/64/39/1291866439.db2.gz	QHYNYDJKSJIJLV-UHFFFAOYSA-N	0	3	335.542	3.140	20	30		EGEDHN
C#CCCN(CCOC)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1	ZINC000827823953	1292384040	/nfs/dbraw/zinc/38/40/40/1292384040.db2.gz	YFWNEHZEGGKRTQ-UHFFFAOYSA-N	0	3	328.368	3.327	20	30		EGEDHN
C[C@@H](NC[C@H]1CN(C2CCCCC2)C(=O)O1)c1ccc(C#N)cc1	ZINC000828148540	1292436787	/nfs/dbraw/zinc/43/67/87/1292436787.db2.gz	ZCLWNIPNJTUOMG-KDOFPFPSSA-N	0	3	327.428	3.362	20	30		EGEDHN
Cc1nn(C)c(C)c1C[C@@H](C)C(=O)C(C#N)c1nc2ccccc2o1	ZINC000076842603	1292445729	/nfs/dbraw/zinc/44/57/29/1292445729.db2.gz	HZKGFXPTFVZXJK-IAQYHMDHSA-N	0	3	336.395	3.233	20	30		EGEDHN
C#CC[C@H](C)OC(=O)C1CCN(c2cc(Cl)ccc2Cl)C1=O	ZINC000083784185	1292690461	/nfs/dbraw/zinc/69/04/61/1292690461.db2.gz	SYYQJGYXPOBEMM-JQWIXIFHSA-N	0	3	340.206	3.301	20	30		EGEDHN
N#CCOc1ccc(Cl)cc1CN1CCC[C@@H]1[C@H]1CCC[C@H]1O	ZINC000831154044	1292819705	/nfs/dbraw/zinc/81/97/05/1292819705.db2.gz	VESICWFOSNGTDX-BRWVUGGUSA-N	0	3	334.847	3.368	20	30		EGEDHN
C[C@H](NC(=O)c1cc(C#N)ccc1F)[C@@H](c1ccccc1)N(C)C	ZINC000832319943	1292988459	/nfs/dbraw/zinc/98/84/59/1292988459.db2.gz	NKCMXRLHVMAVRK-UGSOOPFHSA-N	0	3	325.387	3.119	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)Cc1cc(F)c(C)cc1F	ZINC000835057083	1293194865	/nfs/dbraw/zinc/19/48/65/1293194865.db2.gz	LDCINQNOYXRECW-CQSZACIVSA-N	0	3	336.382	3.221	20	30		EGEDHN
C=CCNC(=O)C(C#N)C(=O)CCCc1cc(Cl)sc1Cl	ZINC000120035224	1293300309	/nfs/dbraw/zinc/30/03/09/1293300309.db2.gz	VRHOBWUPNSTCPL-JTQLQIEISA-N	0	3	345.251	3.389	20	30		EGEDHN
CCCCCCCC(=O)Nc1ccc2oc(=O)n(CCN(C)C)c2c1	ZINC000121761494	1293387405	/nfs/dbraw/zinc/38/74/05/1293387405.db2.gz	CFDFOEWQFNLCNF-UHFFFAOYSA-N	0	3	347.459	3.455	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)c2cc(C)cc([N+](=O)[O-])c2)c1	ZINC000121769908	1293389261	/nfs/dbraw/zinc/38/92/61/1293389261.db2.gz	XCEJPVTWEMRFEG-INIZCTEOSA-N	0	3	337.335	3.173	20	30		EGEDHN
C[C@H](SCc1ccccc1)C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000125220810	1293500607	/nfs/dbraw/zinc/50/06/07/1293500607.db2.gz	TUJBZDZRBZWMAZ-ZFWWWQNUSA-N	0	3	339.420	3.051	20	30		EGEDHN
CCCSCC(=O)C(C#N)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000125586269	1293511897	/nfs/dbraw/zinc/51/18/97/1293511897.db2.gz	ACIRNRKPKOBUEX-JTQLQIEISA-N	0	3	328.796	3.270	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)[C@H](C)Oc2cccc(C)c2)c1	ZINC000127519358	1293567104	/nfs/dbraw/zinc/56/71/04/1293567104.db2.gz	FBBQIDIXVKLGEO-MAUKXSAKSA-N	0	3	336.391	3.418	20	30		EGEDHN
C[C@H](Oc1cccc(Cl)c1)C(=O)C(C#N)C(=O)Nc1ccccc1	ZINC000127951237	1293578715	/nfs/dbraw/zinc/57/87/15/1293578715.db2.gz	UDSILVDKGLAIIC-BLLLJJGKSA-N	0	3	342.782	3.455	20	30		EGEDHN
Cc1ccsc1[C@@H]1C[C@H]1C(=O)C(C#N)C(=O)NC1CCCCC1	ZINC000129412909	1293623565	/nfs/dbraw/zinc/62/35/65/1293623565.db2.gz	LPAHDRRIQSSJMW-RBSFLKMASA-N	0	3	330.453	3.318	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)C[C@H]2C=CCC2)cc1Cl	ZINC000130319457	1293652811	/nfs/dbraw/zinc/65/28/11/1293652811.db2.gz	NHQLPSHXQZEBHB-WCQYABFASA-N	0	3	332.787	3.352	20	30		EGEDHN
N#CC(C(=O)CCc1ccc(F)cc1F)C(=O)NC1CCCCC1	ZINC000152290362	1293962375	/nfs/dbraw/zinc/96/23/75/1293962375.db2.gz	VTIOMPHNIZQWSJ-OAHLLOKOSA-N	0	3	334.366	3.055	20	30		EGEDHN
CCCOc1ccc2c(c1)CCN(C[C@H](O)c1ccc(C#N)cc1)C2	ZINC000153214809	1294003310	/nfs/dbraw/zinc/00/33/10/1294003310.db2.gz	PJJZUDTVWILVLI-NRFANRHFSA-N	0	3	336.435	3.439	20	30		EGEDHN
N#CC(C(=O)CC1CCOCC1)c1nc2ccccc2n1C(F)F	ZINC000172019772	1294426178	/nfs/dbraw/zinc/42/61/78/1294426178.db2.gz	DDLRHOWMURIXTL-LBPRGKRZSA-N	0	3	333.338	3.424	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)c1oc(C)cc1C	ZINC000175110492	1294540387	/nfs/dbraw/zinc/54/03/87/1294540387.db2.gz	ZGWAWLYYMQFUJS-ZDUSSCGKSA-N	0	3	326.352	3.256	20	30		EGEDHN
Cc1cccc(CO[C@@H](C)C(=O)C(C#N)C(=O)Nc2ccccc2)c1	ZINC000870136608	1295694403	/nfs/dbraw/zinc/69/44/03/1295694403.db2.gz	MAVFRSPOIPOOBU-MAUKXSAKSA-N	0	3	336.391	3.248	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)CCOc1ccc(C)cc1C	ZINC000193380455	1295860574	/nfs/dbraw/zinc/86/05/74/1295860574.db2.gz	CPAGCOXLVPEOGW-MRXNPFEDSA-N	0	3	330.428	3.088	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN(C)C[C@H]2COc3ccccc3O2)cc1	ZINC000245502892	1296310746	/nfs/dbraw/zinc/31/07/46/1296310746.db2.gz	GZLQTLIISDEYMT-QAPCUYQASA-N	0	3	338.407	3.249	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@H]1C[C@]12CCCc1ccccc12	ZINC000246680273	1296367036	/nfs/dbraw/zinc/36/70/36/1296367036.db2.gz	ZHNUZNRKIBPNLV-BLIXFSHQSA-N	0	3	338.451	3.296	20	30		EGEDHN
C#CCOc1ccccc1CNC[C@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000301354802	1296788431	/nfs/dbraw/zinc/78/84/31/1296788431.db2.gz	LOUFXKZQPICVIN-KRWDZBQOSA-N	0	3	346.471	3.338	20	30		EGEDHN
Cc1nn(C)c2nc(Cl)cc(N=NC3CCCN4CCCC[C@@H]34)c12	ZINC000872422285	1296952620	/nfs/dbraw/zinc/95/26/20/1296952620.db2.gz	KHWBXFBXKZJSQI-AWEZNQCLSA-N	0	3	346.866	3.346	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2cccc3ncccc23)CC1	ZINC000872880360	1297152618	/nfs/dbraw/zinc/15/26/18/1297152618.db2.gz	CFBLOUMAADOMQW-UHFFFAOYSA-N	0	3	338.455	3.075	20	30		EGEDHN
COc1cc(C=NOCCN2CCCCC2)ccc1OC(F)F	ZINC000588574743	1298087499	/nfs/dbraw/zinc/08/74/99/1298087499.db2.gz	RJSMGFWUPKMPLA-UHFFFAOYSA-N	0	3	328.359	3.133	20	30		EGEDHN
CCCN(CC(=O)C(C#N)c1nc2ccccc2s1)CC(F)F	ZINC000748311602	1298982067	/nfs/dbraw/zinc/98/20/67/1298982067.db2.gz	CAXJDCNJDINFPL-NSHDSACASA-N	0	3	337.395	3.450	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/CC2(C(=O)OC)CCCC2)c([O-])c1	ZINC000751890612	1299645201	/nfs/dbraw/zinc/64/52/01/1299645201.db2.gz	PDWDSPOWJJXNJG-DEDYPNTBSA-N	0	3	332.444	3.391	20	30		EGEDHN
C#CCSCC[NH2+]Cc1ccc(OCc2ccccc2)cc1[O-]	ZINC000753566394	1299975164	/nfs/dbraw/zinc/97/51/64/1299975164.db2.gz	PJIRZMUATJZJPK-UHFFFAOYSA-N	0	3	327.449	3.427	20	30		EGEDHN
N#CCC1(CN2CCC[C@H](CNC(=O)OCc3ccccc3)C2)CC1	ZINC000878538681	1300060169	/nfs/dbraw/zinc/06/01/69/1300060169.db2.gz	PVFZVZIBXYBJSW-GOSISDBHSA-N	0	3	341.455	3.319	20	30		EGEDHN
CNc1cc(C(=O)C(C#N)c2nc3ccccc3n2C)cc(Cl)n1	ZINC000755580823	1300360707	/nfs/dbraw/zinc/36/07/07/1300360707.db2.gz	PFQIZAGJFYTDIL-NSHDSACASA-N	0	3	339.786	3.153	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)C[C@H](C)COC)cc1	ZINC000756232622	1300454551	/nfs/dbraw/zinc/45/45/51/1300454551.db2.gz	CHTVNLWLCAZCIC-WMLDXEAASA-N	0	3	330.428	3.349	20	30		EGEDHN
Cc1cccc(N(CCC#N)C(=O)CN2C[C@@H]3CC=CC[C@@H]3C2)c1C	ZINC000879528963	1300582922	/nfs/dbraw/zinc/58/29/22/1300582922.db2.gz	PDTDWQQTALUXDJ-KDURUIRLSA-N	0	3	337.467	3.448	20	30		EGEDHN
C#CC[C@H](NC(=O)NC[C@@H](Cc1ccccc1)N(C)C)c1ccccc1	ZINC000757605422	1300692182	/nfs/dbraw/zinc/69/21/82/1300692182.db2.gz	KXFNETXCGFXVAL-RTWAWAEBSA-N	0	3	349.478	3.223	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)C[C@@H](OCC)C(C)C	ZINC000761038187	1301387290	/nfs/dbraw/zinc/38/72/90/1301387290.db2.gz	ROOVNDYMAIVVBX-KBXCAEBGSA-N	0	3	346.427	3.184	20	30		EGEDHN
Cc1nc(C#N)cc(NC[C@H](c2cccc(C(F)(F)F)c2)N(C)C)n1	ZINC000882197019	1301874957	/nfs/dbraw/zinc/87/49/57/1301874957.db2.gz	JOVFRSNLCWABIC-OAHLLOKOSA-N	0	3	349.360	3.390	20	30		EGEDHN
C#CCOc1ccc([C@H](C)NCc2ccc(N3CCNC3=O)cc2)cc1	ZINC000883285360	1302363382	/nfs/dbraw/zinc/36/33/82/1302363382.db2.gz	NIQUFNFKAJBWLX-INIZCTEOSA-N	0	3	349.434	3.079	20	30		EGEDHN
N#C[C@H]1CNCC12CC(C(=O)N[C@H](c1ccccc1)C1CCCC1)C2	ZINC000884095749	1302730516	/nfs/dbraw/zinc/73/05/16/1302730516.db2.gz	YEWQTIFZYDLGNR-KYBDOYODSA-N	0	3	337.467	3.173	20	30		EGEDHN
N#C[C@H]1CNCC12CC(C(=O)N1CCC[C@@H]1CC1CCCCC1)C2	ZINC000884110468	1302739083	/nfs/dbraw/zinc/73/90/83/1302739083.db2.gz	LERQDXWVWJKIIW-AGYKMIKPSA-N	0	3	329.488	3.087	20	30		EGEDHN
Cc1cccc(C)c1[C@@H]1CCCN1C(=O)C1CC2(C1)CNC[C@H]2C#N	ZINC000884398032	1302839542	/nfs/dbraw/zinc/83/95/42/1302839542.db2.gz	UMHPAWRRXWITCJ-IOBOIYPZSA-N	0	3	337.467	3.106	20	30		EGEDHN
C[C@@H]1CN(CCCCNc2nc3ccccc3cc2C#N)C[C@H](C)O1	ZINC000768532650	1302927438	/nfs/dbraw/zinc/92/74/38/1302927438.db2.gz	CUNSPXVFMCZWFO-IYBDPMFKSA-N	0	3	338.455	3.408	20	30		EGEDHN
C#CCCOc1ccc(CN(C)[C@@H](C)CNC(=O)OC(C)(C)C)cc1	ZINC000769400938	1303107674	/nfs/dbraw/zinc/10/76/74/1303107674.db2.gz	ASSSBKWSENUXBG-INIZCTEOSA-N	0	3	346.471	3.434	20	30		EGEDHN
COc1ccc(C(C)=NNC[C@H](C)C#N)cc1CN1CCCCC1	ZINC000771103831	1303360691	/nfs/dbraw/zinc/36/06/91/1303360691.db2.gz	QCTYKUMXLGVRMD-OAHLLOKOSA-N	0	3	328.460	3.154	20	30		EGEDHN
C=CCN(C(=O)Nc1ccc(N2CCN(CC)CC2)cc1)C1CC1	ZINC000772220621	1303505100	/nfs/dbraw/zinc/50/51/00/1303505100.db2.gz	ZXNVYLXDBQWHKD-UHFFFAOYSA-N	0	3	328.460	3.011	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)CC[C@H](C)SC	ZINC000773769714	1303737146	/nfs/dbraw/zinc/73/71/46/1303737146.db2.gz	KQMBZZYNLWZUOY-STQMWFEESA-N	0	3	334.441	3.264	20	30		EGEDHN
COc1ccc(OC)c([C@@H](O)CN[C@@H](CCC#N)c2ccccc2)c1	ZINC000775554227	1303983549	/nfs/dbraw/zinc/98/35/49/1303983549.db2.gz	VXWAZFNNQJNKRP-OALUTQOASA-N	0	3	340.423	3.372	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)Cc3cccc([N+](=O)[O-])c3)nc21	ZINC000777320154	1304282089	/nfs/dbraw/zinc/28/20/89/1304282089.db2.gz	DUIUMDXUZIKUGX-CQSZACIVSA-N	0	3	334.335	3.199	20	30		EGEDHN
CN(C)CCN(CC1CCCCC1)C(=O)Cc1ccccc1CC#N	ZINC000777367659	1304287401	/nfs/dbraw/zinc/28/74/01/1304287401.db2.gz	RHAISBNABBSYQP-UHFFFAOYSA-N	0	3	341.499	3.266	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)CCC1	ZINC000891247175	1304999426	/nfs/dbraw/zinc/99/94/26/1304999426.db2.gz	GOVBCVBFGQSTHJ-SFHVURJKSA-N	0	3	329.488	3.218	20	30		EGEDHN
N#CC1(NC(=O)CN[C@@H](c2ccccc2)C2CCCCC2)CCC1	ZINC000784348240	1305233508	/nfs/dbraw/zinc/23/35/08/1305233508.db2.gz	XGYNRCKPWGDIKM-IBGZPJMESA-N	0	3	325.456	3.460	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)Cc2nc(C)sc2C)cc1	ZINC000786311673	1305554675	/nfs/dbraw/zinc/55/46/75/1305554675.db2.gz	LQGZTLOLHMAARJ-HNNXBMFYSA-N	0	3	341.436	3.212	20	30		EGEDHN
Cc1cccc(CNC(=O)C(C#N)C(=O)Cc2cc3ccccc3o2)c1	ZINC000786550771	1305596324	/nfs/dbraw/zinc/59/63/24/1305596324.db2.gz	YPPABASYFSJOMK-SFHVURJKSA-N	0	3	346.386	3.309	20	30		EGEDHN
Cc1cccc(CNC(=O)C(C#N)C(=O)CCCc2ccccc2)c1	ZINC000786550412	1305596452	/nfs/dbraw/zinc/59/64/52/1305596452.db2.gz	PEQZYZAZKQDQBN-LJQANCHMSA-N	0	3	334.419	3.343	20	30		EGEDHN
CC[C@@H](NC(=O)C(C#N)C(=O)CCC(F)(F)F)c1ccccc1	ZINC000787039412	1305681660	/nfs/dbraw/zinc/68/16/60/1305681660.db2.gz	RVIIJARHLYLIER-QWHCGFSZSA-N	0	3	326.318	3.305	20	30		EGEDHN
CCc1cncc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)c1	ZINC000789404396	1306155050	/nfs/dbraw/zinc/15/50/50/1306155050.db2.gz	RRMKYNIOUYBEPC-CYBMUJFWSA-N	0	3	327.771	3.259	20	30		EGEDHN
CC(C)CN(CCN(C)C)C(=O)C#Cc1ccc(C(F)(F)F)cc1	ZINC000790589792	1306357534	/nfs/dbraw/zinc/35/75/34/1306357534.db2.gz	BPINWZUOWOLGGQ-UHFFFAOYSA-N	0	3	340.389	3.103	20	30		EGEDHN
N#Cc1cnc(NC(=O)c2cccc(CN3CCCCC3)c2)s1	ZINC000896494117	1309882894	/nfs/dbraw/zinc/88/28/94/1309882894.db2.gz	ZBVFIUWVJXPFNJ-UHFFFAOYSA-N	0	3	326.425	3.253	20	30		EGEDHN
C[C@H](NC[C@H](O)c1ccc(C#N)cc1)c1ccc(Br)cn1	ZINC000796498630	1310015140	/nfs/dbraw/zinc/01/51/40/1310015140.db2.gz	NMKCZAFTAJIHMU-ZBEGNZNMSA-N	0	3	346.228	3.100	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)[C@H]1CCC(F)(F)C1	ZINC000796638028	1310051789	/nfs/dbraw/zinc/05/17/89/1310051789.db2.gz	YNCDTAGUUDCDNF-NWDGAFQWSA-N	0	3	336.338	3.168	20	30		EGEDHN
COCCOC1CCC(C(=O)C(C#N)c2nc3ccccc3o2)CC1	ZINC000796654872	1310058526	/nfs/dbraw/zinc/05/85/26/1310058526.db2.gz	PYABYWGOSPLYNI-NRXISQOPSA-N	0	3	342.395	3.226	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@@H](C)Cn1ccc2ccccc21	ZINC000796779976	1310086475	/nfs/dbraw/zinc/08/64/75/1310086475.db2.gz	QXZRPJJFOAXPRL-RDJZCZTQSA-N	0	3	339.439	3.293	20	30		EGEDHN
CCN(CCO)c1ccc(C=NOCc2ccccc2OC)c(C)c1	ZINC000799118153	1310490473	/nfs/dbraw/zinc/49/04/73/1310490473.db2.gz	SSELXNJGDUFHLN-UHFFFAOYSA-N	0	3	342.439	3.373	20	30		EGEDHN
C#CCCCN1CCN(Cc2cc(Br)ccc2F)CC1	ZINC000799189135	1310502297	/nfs/dbraw/zinc/50/22/97/1310502297.db2.gz	JIRXZGZRBZUQRB-UHFFFAOYSA-N	0	3	339.252	3.119	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CN[C@H](CCO)Cc1ccccc1	ZINC000799349182	1310533832	/nfs/dbraw/zinc/53/38/32/1310533832.db2.gz	DPXNQIMXMYTPIW-QGZVFWFLSA-N	0	3	343.854	3.435	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)cc1C#N	ZINC000799686027	1310599905	/nfs/dbraw/zinc/59/99/05/1310599905.db2.gz	NPXLINVTKZHODO-JXFKEZNVSA-N	0	3	333.435	3.260	20	30		EGEDHN
N#C[C@@H]1CC[C@@H]([NH2+][C@H]2CCCN(Cc3cc(Cl)ccc3[O-])C2)C1	ZINC000799718043	1310604851	/nfs/dbraw/zinc/60/48/51/1310604851.db2.gz	ZJHBLONDNNOVLK-XYPHTWIQSA-N	0	3	333.863	3.292	20	30		EGEDHN
C[C@H](N[C@H]1CC[C@@H](C#N)C1)c1cc(F)ccc1N1CCC(O)CC1	ZINC000799717690	1310605182	/nfs/dbraw/zinc/60/51/82/1310605182.db2.gz	SSAXGCYIEOXYKD-LZWOXQAQSA-N	0	3	331.435	3.130	20	30		EGEDHN
C#CCOc1ccc(Br)cc1CNCC(C)(C)CC#N	ZINC000839163076	1320883007	/nfs/dbraw/zinc/88/30/07/1320883007.db2.gz	GWLQJJCUCPWGCG-UHFFFAOYSA-N	0	3	335.245	3.491	20	30		EGEDHN
C#C[C@@H](NCCC(=O)Nc1c(Cl)cccc1Cl)[C@H]1CCCO1	ZINC000839562590	1320938639	/nfs/dbraw/zinc/93/86/39/1320938639.db2.gz	APTULKCJFIJVIB-ZIAGYGMSSA-N	0	3	341.238	3.092	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H](NCc2cc(C)ccc2OC)C1	ZINC001019333974	1317172909	/nfs/dbraw/zinc/17/29/09/1317172909.db2.gz	HAJDKFHRUIEVSX-PXNSSMCTSA-N	0	3	330.472	3.296	20	30		EGEDHN
CC1(C)CC[C@@H](C(=O)N2CC[C@H](NCc3ccc(F)c(C#N)c3)C2)C1	ZINC001019347903	1317183767	/nfs/dbraw/zinc/18/37/67/1317183767.db2.gz	SKJWFDAAKBKOHD-WBVHZDCISA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](NCc3ccc(Cl)cc3OC)C2)C1	ZINC001019353466	1317189366	/nfs/dbraw/zinc/18/93/66/1317189366.db2.gz	LZLJBBGHHJKWFP-INIZCTEOSA-N	0	3	348.874	3.395	20	30		EGEDHN
Cc1cc(F)cc(C(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)c1	ZINC001019419606	1317228689	/nfs/dbraw/zinc/22/86/89/1317228689.db2.gz	JWEAIHTWMHNDTM-HNNXBMFYSA-N	0	3	343.427	3.072	20	30		EGEDHN
CCC1(C(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)CCCC1	ZINC001019587500	1317296654	/nfs/dbraw/zinc/29/66/54/1317296654.db2.gz	QYAJLRRUUBXEAY-AWEZNQCLSA-N	0	3	331.485	3.281	20	30		EGEDHN
C[C@H](CC(=O)N1CC[C@H](NCc2ccc(C#N)s2)C1)c1ccco1	ZINC001019667222	1317323983	/nfs/dbraw/zinc/32/39/83/1317323983.db2.gz	XDIXILUWVLECHA-KGLIPLIRSA-N	0	3	343.452	3.097	20	30		EGEDHN
CC(=O)N1CCC2(CCN(CC#Cc3cccc(Cl)c3)CC2)CC1	ZINC000957484434	1317392061	/nfs/dbraw/zinc/39/20/61/1317392061.db2.gz	RPADRXCXRYHACG-UHFFFAOYSA-N	0	3	344.886	3.416	20	30		EGEDHN
Cc1ccsc1C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001019940271	1317467817	/nfs/dbraw/zinc/46/78/17/1317467817.db2.gz	CRKXDBCYJKANKD-SHTZXODSSA-N	0	3	343.427	3.118	20	30		EGEDHN
C#C[C@H](CCC)NC(=O)Nc1ccc(CCN2CCSCC2)cc1	ZINC000806244250	1317474400	/nfs/dbraw/zinc/47/44/00/1317474400.db2.gz	ZDQCSHLEFWTHNW-QGZVFWFLSA-N	0	3	345.512	3.201	20	30		EGEDHN
C#Cc1cncc(C(=O)N(CC)[C@@H]2CCN([C@H](C)c3ccccc3)C2)c1	ZINC000807071654	1317548252	/nfs/dbraw/zinc/54/82/52/1317548252.db2.gz	QRXXQBXAGBPAIQ-DYESRHJHSA-N	0	3	347.462	3.361	20	30		EGEDHN
C#CCN(CC)C(=O)NC[C@@H](c1ccc(Cl)cc1)N(C)CCC	ZINC000807411073	1317565468	/nfs/dbraw/zinc/56/54/68/1317565468.db2.gz	DTBYLPDXCFAMTO-KRWDZBQOSA-N	0	3	335.879	3.388	20	30		EGEDHN
CC[C@@H](C)N[C@@H](CNC(=O)c1ccc(C)c(C#N)c1)c1ccco1	ZINC000807679187	1317576326	/nfs/dbraw/zinc/57/63/26/1317576326.db2.gz	GEGFGYYDMMYYEE-PBHICJAKSA-N	0	3	325.412	3.319	20	30		EGEDHN
C[C@@H]1CCC[C@@H]1CC(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001020185760	1317580853	/nfs/dbraw/zinc/58/08/53/1317580853.db2.gz	BLEWJTKJDVNSMS-MOIQIXESSA-N	0	3	343.446	3.260	20	30		EGEDHN
CC[C@H](NCc1ccccc1CS(C)(=O)=O)c1cccc(C#N)c1	ZINC000902833188	1317622128	/nfs/dbraw/zinc/62/21/28/1317622128.db2.gz	XLCMTAMTBMQRRR-IBGZPJMESA-N	0	3	342.464	3.344	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2csc(C(F)(F)F)c2)C1	ZINC001020348283	1317653628	/nfs/dbraw/zinc/65/36/28/1317653628.db2.gz	XEWHTQMKXYBNOH-MGCOHNPYSA-N	0	3	338.782	3.370	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](O)c2ccc(C(F)(F)F)cc2)s1	ZINC000808426159	1317675359	/nfs/dbraw/zinc/67/53/59/1317675359.db2.gz	LDFBKGCJYBXUFJ-CQSZACIVSA-N	0	3	326.343	3.462	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cnc3ccccc3c2C)C1	ZINC001020403670	1317682144	/nfs/dbraw/zinc/68/21/44/1317682144.db2.gz	YBJHGVKVKOZLMS-HDJSIYSDSA-N	0	3	329.831	3.146	20	30		EGEDHN
C[C@H]1CC[C@H](CC(=O)N[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)C1	ZINC001020482434	1317716344	/nfs/dbraw/zinc/71/63/44/1317716344.db2.gz	FQXYWGZZLSOJTI-USJZOSNVSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@H](NCc3ccc(Cl)cc3OC)C2)C1	ZINC001020562946	1317774847	/nfs/dbraw/zinc/77/48/47/1317774847.db2.gz	WUJICAGLLHGMQG-WKILWMFISA-N	0	3	348.874	3.442	20	30		EGEDHN
C=C(C)COc1cc(/C=C2/C(=O)c3ncnn3C2C)ccc1OC	ZINC000905080476	1317920963	/nfs/dbraw/zinc/92/09/63/1317920963.db2.gz	LFBINHWQHZGSTK-CWZJEYLYSA-N	0	3	325.368	3.083	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)[C@H]2CCCC[C@H]2CC)C1	ZINC001020843483	1317951375	/nfs/dbraw/zinc/95/13/75/1317951375.db2.gz	HOFUYXDTYYQADA-TUVASFSCSA-N	0	3	343.309	3.348	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(F)c(Cl)c1)C(=O)[C@@H]1CCCSC1	ZINC000810531208	1318018290	/nfs/dbraw/zinc/01/82/90/1318018290.db2.gz	KDFAQAJPKHGKPM-MWLCHTKSSA-N	0	3	340.807	3.270	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@H](NC(=O)C3CCC=CCC3)C2)c(F)c1	ZINC001021063304	1318065153	/nfs/dbraw/zinc/06/51/53/1318065153.db2.gz	DDSDFEDTMRLILN-IYARVYRRSA-N	0	3	341.430	3.181	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)[C@H]2C[C@H](C)C[C@H](C)C2)C1	ZINC001021102419	1318084779	/nfs/dbraw/zinc/08/47/79/1318084779.db2.gz	KYEFGSRAWAURSF-OPTZYUCBSA-N	0	3	343.309	3.204	20	30		EGEDHN
Cc1[nH]ccc1C(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1cccc(C#N)c1	ZINC001021222812	1318147677	/nfs/dbraw/zinc/14/76/77/1318147677.db2.gz	IZAMRLQARFZSQL-YQQQUEKLSA-N	0	3	348.450	3.120	20	30		EGEDHN
C[C@H](C(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1cccc(C#N)c1)C1CC1	ZINC001021222298	1318147831	/nfs/dbraw/zinc/14/78/31/1318147831.db2.gz	ZYDYJRCMZJYVLZ-LRLLJDFBSA-N	0	3	337.467	3.216	20	30		EGEDHN
CO[C@H](C)[C@@H](C)N[C@H](C)C(=O)/C=C1/N(C)c2ccccc2C1(C)C	ZINC000811637665	1318217074	/nfs/dbraw/zinc/21/70/74/1318217074.db2.gz	HHDQVZGFZNGGHX-BGIHOSOXSA-N	0	3	330.472	3.269	20	30		EGEDHN
CC(C)CC(=O)N1CCCC[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC000959860153	1318232022	/nfs/dbraw/zinc/23/20/22/1318232022.db2.gz	OYJXQCFSCYZANN-KRWDZBQOSA-N	0	3	331.435	3.214	20	30		EGEDHN
Cc1cccc(Cl)c1CNC[C@@H]1CCCCN1C(=O)[C@@H](C)C#N	ZINC000959920247	1318266100	/nfs/dbraw/zinc/26/61/00/1318266100.db2.gz	RUOGLTYQSBSFCV-GJZGRUSLSA-N	0	3	333.863	3.279	20	30		EGEDHN
Cc1[nH]ccc1C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)s1	ZINC000959948963	1318283569	/nfs/dbraw/zinc/28/35/69/1318283569.db2.gz	BZYQTGNBCDOTEW-AWEZNQCLSA-N	0	3	342.468	3.041	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC000959966192	1318293126	/nfs/dbraw/zinc/29/31/26/1318293126.db2.gz	JXXCFHVJOAHMRO-IRXDYDNUSA-N	0	3	343.446	3.214	20	30		EGEDHN
CC(C)(F)C(=O)N1CCC[C@H]2CN(Cc3ccc(C#N)cc3)CC[C@@H]21	ZINC001021497472	1318305040	/nfs/dbraw/zinc/30/50/40/1318305040.db2.gz	XXTBREMNRRFMPG-ROUUACIJSA-N	0	3	343.446	3.119	20	30		EGEDHN
C=C1CCC(C(=O)N2CCCC[C@H]2CNCc2cncc(F)c2)CC1	ZINC000960111442	1318363076	/nfs/dbraw/zinc/36/30/76/1318363076.db2.gz	LEYXVADMSSNGFV-IBGZPJMESA-N	0	3	345.462	3.438	20	30		EGEDHN
C=CCCC(=O)[C@H]1CCCN1C(=O)C[C@@H](c1ccccc1)N(C)C	ZINC000908658704	1318383642	/nfs/dbraw/zinc/38/36/42/1318383642.db2.gz	FKJPETGJGZYTOV-MSOLQXFVSA-N	0	3	328.456	3.206	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@@H](CCCN3C(=O)C3CC=CC3)C2)c1	ZINC001021548808	1318387575	/nfs/dbraw/zinc/38/75/75/1318387575.db2.gz	SBPCFMYGRRVBCG-LEWJYISDSA-N	0	3	349.478	3.337	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2scc(C)c2Cl)C1	ZINC001021586716	1318431632	/nfs/dbraw/zinc/43/16/32/1318431632.db2.gz	DARUGVZTAHLGIA-KBPBESRZSA-N	0	3	336.888	3.270	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cnc(C)s1	ZINC000960255638	1318432062	/nfs/dbraw/zinc/43/20/62/1318432062.db2.gz	RSKWXIRQKCZSNX-NVXWUHKLSA-N	0	3	327.453	3.013	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cccc(F)c2C)C1	ZINC001021594208	1318437649	/nfs/dbraw/zinc/43/76/49/1318437649.db2.gz	KETRLVUUABWDBV-LPHOPBHVSA-N	0	3	328.431	3.084	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2sc(C)cc2C)C1	ZINC001021595591	1318441130	/nfs/dbraw/zinc/44/11/30/1318441130.db2.gz	BSJFYYMZGZWIFB-IRXDYDNUSA-N	0	3	330.497	3.315	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1nc(Cl)sc1C	ZINC000960282404	1318443433	/nfs/dbraw/zinc/44/34/33/1318443433.db2.gz	HNCJVTGSTAUYLD-UKRRQHHQSA-N	0	3	347.871	3.276	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc(CC)s1	ZINC000960282235	1318443544	/nfs/dbraw/zinc/44/35/44/1318443544.db2.gz	YCOCMFZOEVETAI-SJLPKXTDSA-N	0	3	326.465	3.482	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2c(C)cccc2C)C1	ZINC001021604429	1318450175	/nfs/dbraw/zinc/45/01/75/1318450175.db2.gz	VXOLBPJMEWKJRO-PZJWPPBQSA-N	0	3	338.495	3.182	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1nc(Cl)cs1	ZINC000960299338	1318450758	/nfs/dbraw/zinc/45/07/58/1318450758.db2.gz	KRZBRPAPKCOGFV-UKRRQHHQSA-N	0	3	347.871	3.358	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(F)c(C)cc2F)C1	ZINC001021608480	1318454091	/nfs/dbraw/zinc/45/40/91/1318454091.db2.gz	QMEKLIDLTKLMCU-BEFAXECRSA-N	0	3	346.421	3.223	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc(C(F)F)o1	ZINC000960328702	1318463195	/nfs/dbraw/zinc/46/31/95/1318463195.db2.gz	CJPYMJOQNKFBOF-CZUORRHYSA-N	0	3	332.350	3.389	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1sccc1COC	ZINC000960326808	1318463468	/nfs/dbraw/zinc/46/34/68/1318463468.db2.gz	KWOJBARJAAXVHF-IAGOWNOFSA-N	0	3	342.464	3.066	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1sccc1CC	ZINC000960335422	1318468646	/nfs/dbraw/zinc/46/86/46/1318468646.db2.gz	ZIXYZYJDWFNAQU-IAGOWNOFSA-N	0	3	326.465	3.482	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2c(C)oc(C)c2C)C1	ZINC001021625849	1318476894	/nfs/dbraw/zinc/47/68/94/1318476894.db2.gz	AZOANHOTWCKDPF-ROUUACIJSA-N	0	3	328.456	3.155	20	30		EGEDHN
COC[C@H](C)[C@@H](C)C(=O)C(C#N)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000813059723	1318492878	/nfs/dbraw/zinc/49/28/78/1318492878.db2.gz	GTCLSLKCXPJZNW-UMNHJUIQSA-N	0	3	340.782	3.045	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc3c(cc(C)cc3C)[nH]2)C1	ZINC001021638669	1318495427	/nfs/dbraw/zinc/49/54/27/1318495427.db2.gz	GDDCNIZJGBGDQA-DYESRHJHSA-N	0	3	349.478	3.344	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)c1cccs1	ZINC000960376141	1318497928	/nfs/dbraw/zinc/49/79/28/1318497928.db2.gz	CZWAGXVPGBRDDP-QGZVFWFLSA-N	0	3	339.464	3.356	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2csc3ccccc23)C1	ZINC001021642720	1318499526	/nfs/dbraw/zinc/49/95/26/1318499526.db2.gz	RWWMXVRDQUEOFG-YJBOKZPZSA-N	0	3	338.476	3.461	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(C)ccc2F)C1	ZINC001021679525	1318548742	/nfs/dbraw/zinc/54/87/42/1318548742.db2.gz	OVBZOEJVLDIFQN-QFBILLFUSA-N	0	3	328.431	3.084	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2csc(C(C)C)n2)C1	ZINC001021692646	1318566490	/nfs/dbraw/zinc/56/64/90/1318566490.db2.gz	VQAGQUJVAKSUKR-WBVHZDCISA-N	0	3	345.512	3.216	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cccc(C)c2Cl)C1	ZINC001021693478	1318568163	/nfs/dbraw/zinc/56/81/63/1318568163.db2.gz	OSXCNMBUHAYDKU-WBVHZDCISA-N	0	3	330.859	3.208	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc3sccc3[nH]2)C1	ZINC001021706308	1318578540	/nfs/dbraw/zinc/57/85/40/1318578540.db2.gz	KJSWWBFIUZQRQF-WMLDXEAASA-N	0	3	341.480	3.179	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc3c(C)cccn3c2)C1	ZINC001021709663	1318586848	/nfs/dbraw/zinc/58/68/48/1318586848.db2.gz	CYCHRGNFLGNNRZ-UYAOXDASSA-N	0	3	349.478	3.198	20	30		EGEDHN
CCCOc1cccc(CN(C)C[C@@H]2CCCN2C(=O)[C@H](C)C#N)c1	ZINC000960502415	1318610735	/nfs/dbraw/zinc/61/07/35/1318610735.db2.gz	NGPNWAIVNRVFSU-AEFFLSMTSA-N	0	3	343.471	3.058	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(C)c(CC)s2)C1	ZINC001021728585	1318624434	/nfs/dbraw/zinc/62/44/34/1318624434.db2.gz	APMNCUITGLSBQA-CVEARBPZSA-N	0	3	330.497	3.179	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(C)c(F)c(C)c2)C1	ZINC001021734926	1318641292	/nfs/dbraw/zinc/64/12/92/1318641292.db2.gz	ATHFEIKJULCIJQ-WMZOPIPTSA-N	0	3	328.431	3.002	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cccc3c2CCC3)C1	ZINC001021742069	1318655957	/nfs/dbraw/zinc/65/59/57/1318655957.db2.gz	BTAPRXZOSKIMSP-GHTZIAJQSA-N	0	3	336.479	3.125	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)CC(C)(C)c2ccccc2)C1	ZINC001021743963	1318659431	/nfs/dbraw/zinc/65/94/31/1318659431.db2.gz	STLGYTORMONRJO-ICSRJNTNSA-N	0	3	338.495	3.300	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@@H](NC(=O)C=C3CCCCC3)C2)c1	ZINC001021880636	1318718906	/nfs/dbraw/zinc/71/89/06/1318718906.db2.gz	RXYLIKBFOQWRBR-HDICACEKSA-N	0	3	341.430	3.325	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)C1(F)CCCC1	ZINC000960715764	1318825776	/nfs/dbraw/zinc/82/57/76/1318825776.db2.gz	WSWHARPZCKWHDH-GOSISDBHSA-N	0	3	343.446	3.263	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)CC1(C)CC1	ZINC000960747285	1318848158	/nfs/dbraw/zinc/84/81/58/1318848158.db2.gz	GSGUYBHCVJVCFY-SFHVURJKSA-N	0	3	325.456	3.171	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2c(C)c(F)ccc2Cl)C1	ZINC001022329107	1318894658	/nfs/dbraw/zinc/89/46/58/1318894658.db2.gz	CMCADIFHWGEVGN-PHIMTYICSA-N	0	3	331.218	3.390	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@@H]2CN(C)C[C@@H]2CCCCO2)CC1	ZINC000960827450	1318953462	/nfs/dbraw/zinc/95/34/62/1318953462.db2.gz	BMFJGSNTZDKOIB-MOPGFXCFSA-N	0	3	334.504	3.225	20	30		EGEDHN
O=C(C1CC1)N1CCC[C@@H]([C@@H]2CCN(CC#Cc3ccccc3)C2)C1	ZINC000961075755	1319186320	/nfs/dbraw/zinc/18/63/20/1319186320.db2.gz	FEKHOAINCOHCDA-NHCUHLMSSA-N	0	3	336.479	3.009	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)C[C@@H]2CCc3ccccc3C2)C1	ZINC001023022234	1319226534	/nfs/dbraw/zinc/22/65/34/1319226534.db2.gz	IANAVMOHNINYKX-OLMNPRSZSA-N	0	3	332.875	3.171	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]([C@@H]2CCN(Cc3cc(C)no3)C2)C1	ZINC000961232662	1319363999	/nfs/dbraw/zinc/36/39/99/1319363999.db2.gz	UGCOSISZTWPNAP-DLBZAZTESA-N	0	3	345.487	3.256	20	30		EGEDHN
N#Cc1ccc(C(=O)NC[C@@H]2CCCN(C/C=C/c3ccccc3)C2)[nH]1	ZINC001023318394	1319443168	/nfs/dbraw/zinc/44/31/68/1319443168.db2.gz	IFXNRUKDGABRRR-PYJQOMOHSA-N	0	3	348.450	3.042	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](C2CCN(C(=O)c3cccnc3)CC2)C1	ZINC000961320298	1319477531	/nfs/dbraw/zinc/47/75/31/1319477531.db2.gz	LEVFTOHNXLFZFX-SFHVURJKSA-N	0	3	347.890	3.398	20	30		EGEDHN
C#CCN1CCC[C@H](CNC(=O)c2ccccc2C(C)(C)CC)C1	ZINC001023438047	1319533466	/nfs/dbraw/zinc/53/34/66/1319533466.db2.gz	NHBRJJNBVDCGHK-QGZVFWFLSA-N	0	3	326.484	3.449	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc3ccccc3cc2F)C1	ZINC001023484760	1319588656	/nfs/dbraw/zinc/58/86/56/1319588656.db2.gz	QNYSVLDZFMUONW-INIZCTEOSA-N	0	3	338.426	3.444	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2nsc3ccc(C)cc32)C1	ZINC001023529413	1319635480	/nfs/dbraw/zinc/63/54/80/1319635480.db2.gz	DDLRAAYJVUBNKK-HNNXBMFYSA-N	0	3	341.480	3.070	20	30		EGEDHN
CC[NH+](CC)Cc1cc(C(C)N=Nc2nc(C)cc(C)n2)ccc1[O-]	ZINC000916540262	1319667842	/nfs/dbraw/zinc/66/78/42/1319667842.db2.gz	SFUHYTQBRVLYOD-UHFFFAOYSA-N	0	3	341.459	3.477	20	30		EGEDHN
C=CCn1c(Cc2ccccc2)nnc1SC[C@@H]1CCCN1C	ZINC000916675057	1319694459	/nfs/dbraw/zinc/69/44/59/1319694459.db2.gz	XUEYWMMZNUGUGX-INIZCTEOSA-N	0	3	328.485	3.241	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@H](C#N)CCC#N)CC12CCC2	ZINC000819326234	1319698807	/nfs/dbraw/zinc/69/88/07/1319698807.db2.gz	LUQXKCRLYYYSBH-JKSUJKDBSA-N	0	3	346.475	3.342	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2[C@H]3CN(CCc4ccccc4F)C[C@H]32)CC1	ZINC000961687707	1319699800	/nfs/dbraw/zinc/69/98/00/1319699800.db2.gz	NUXFEVYFHCNRBH-RUYXUALKSA-N	0	3	342.458	3.161	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2[C@H]3CN(Cc4cc(F)ccc4C)C[C@H]32)C1	ZINC000961692195	1319702966	/nfs/dbraw/zinc/70/29/66/1319702966.db2.gz	WIXKXVKQALDQFL-PIIMJCKOSA-N	0	3	328.431	3.037	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)[C@@H](C)Oc2ccccc2F)c1	ZINC000916897781	1319721205	/nfs/dbraw/zinc/72/12/05/1319721205.db2.gz	SUYLLOYMGLVMLQ-UKRRQHHQSA-N	0	3	340.354	3.249	20	30		EGEDHN
CC(C)(C)n1cc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)cn1	ZINC000916911953	1319725195	/nfs/dbraw/zinc/72/51/95/1319725195.db2.gz	OMFVTQCKUVRZDQ-GFCCVEGCSA-N	0	3	344.802	3.253	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](CC)c2cc(F)ccc2OC)CC1	ZINC000917137444	1319761122	/nfs/dbraw/zinc/76/11/22/1319761122.db2.gz	PJYWEMBKJNXYSN-KRWDZBQOSA-N	0	3	349.450	3.235	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCCc2ccccc2SCC)CC1	ZINC000917142149	1319763323	/nfs/dbraw/zinc/76/33/23/1319763323.db2.gz	RSOKQEMOERVGSR-UHFFFAOYSA-N	0	3	347.528	3.291	20	30		EGEDHN
C=CCN1CCC[C@@H](CNC(=O)c2csc(-c3ccoc3)n2)C1	ZINC001023652378	1319772545	/nfs/dbraw/zinc/77/25/45/1319772545.db2.gz	HKIINDPRHMUTSO-ZDUSSCGKSA-N	0	3	331.441	3.031	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2[nH]ccc2-c2ccccc2)C1	ZINC001023696642	1319824246	/nfs/dbraw/zinc/82/42/46/1319824246.db2.gz	RNNUILXMCZEEMX-QGZVFWFLSA-N	0	3	335.451	3.147	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccccc2C(F)(F)F)C1	ZINC001023715922	1319846597	/nfs/dbraw/zinc/84/65/97/1319846597.db2.gz	DHIIGTSWEBKYPB-AWEZNQCLSA-N	0	3	338.373	3.171	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc(-c3cccs3)o2)C1	ZINC001023727548	1319864833	/nfs/dbraw/zinc/86/48/33/1319864833.db2.gz	MOGGAIUBFWFJTP-HNNXBMFYSA-N	0	3	342.464	3.473	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)C2CC(c3cccc(F)c3)C2)C1	ZINC001023774328	1319924901	/nfs/dbraw/zinc/92/49/01/1319924901.db2.gz	GUKOKLOUQOVXJC-IPJUCJBFSA-N	0	3	342.458	3.171	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@H]1CCCN(C(=O)C2CCCC2)C1	ZINC001023795967	1319941212	/nfs/dbraw/zinc/94/12/12/1319941212.db2.gz	AAYPVDLRIMPVMA-OAHLLOKOSA-N	0	3	343.446	3.216	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCN(C(=O)CC2CCCC2)C1	ZINC001023820216	1319966285	/nfs/dbraw/zinc/96/62/85/1319966285.db2.gz	GZQMTHSRIPOXOE-SFHVURJKSA-N	0	3	339.483	3.467	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCN(C(=O)c2ccsc2)C1	ZINC001023831120	1319974108	/nfs/dbraw/zinc/97/41/08/1319974108.db2.gz	HJFJUYLIXMSRJT-HNNXBMFYSA-N	0	3	339.464	3.262	20	30		EGEDHN
C#CC[C@@H](CO)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1	ZINC000821207771	1320003607	/nfs/dbraw/zinc/00/36/07/1320003607.db2.gz	XXVSBKKDLFXDKB-IBGZPJMESA-N	0	3	349.409	3.152	20	30		EGEDHN
C[C@@H]1CCN(Cc2cc(=O)n3c4ccccc4[nH]c3c2C#N)[C@H](C)C1	ZINC000823515536	1320185000	/nfs/dbraw/zinc/18/50/00/1320185000.db2.gz	LURUTUSSVBTKHR-IIAWOOMASA-N	0	3	334.423	3.344	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000823618134	1320192724	/nfs/dbraw/zinc/19/27/24/1320192724.db2.gz	NWSRZSGQAWPLON-ACJLOTCBSA-N	0	3	325.368	3.193	20	30		EGEDHN
COCCc1ccc(OC[C@H](C)NCc2cc(C#N)ccc2F)cc1	ZINC000825321247	1320327249	/nfs/dbraw/zinc/32/72/49/1320327249.db2.gz	VMMXJHBKDRXVSS-HNNXBMFYSA-N	0	3	342.414	3.443	20	30		EGEDHN
CN(C)CCN(Cc1ccsc1)C(=O)/C=C/c1ccccc1C#N	ZINC000838185182	1320742355	/nfs/dbraw/zinc/74/23/55/1320742355.db2.gz	VMWIQJNVFZBPJN-BQYQJAHWSA-N	0	3	339.464	3.223	20	30		EGEDHN
CCN(Cc1ccccc1)c1ccc(C=NN(C)C[C@H](C)O)cc1	ZINC000841653555	1321291892	/nfs/dbraw/zinc/29/18/92/1321291892.db2.gz	PAUDHZVLDXDSNY-KRWDZBQOSA-N	0	3	325.456	3.360	20	30		EGEDHN
CC1(C)C[C@@H](C(=O)C(C#N)C(=O)NC2CCCC2)c2ccccc2O1	ZINC000842292311	1321368661	/nfs/dbraw/zinc/36/86/61/1321368661.db2.gz	SJIMAFJQRLTVCM-CVEARBPZSA-N	0	3	340.423	3.099	20	30		EGEDHN
CC1(C)C[C@H](C(=O)C(C#N)C(=O)NC2CCCC2)c2ccccc2O1	ZINC000842292314	1321368805	/nfs/dbraw/zinc/36/88/05/1321368805.db2.gz	SJIMAFJQRLTVCM-JKSUJKDBSA-N	0	3	340.423	3.099	20	30		EGEDHN
CN(Cc1cccs1)c1ccc(CN2CC[C@](O)(CC#N)C2)cc1	ZINC000843425294	1321516362	/nfs/dbraw/zinc/51/63/62/1321516362.db2.gz	JONWDGFJBMWZTH-LJQANCHMSA-N	0	3	341.480	3.235	20	30		EGEDHN
CN(Cc1cccs1)c1ccc(CN2CC[C@@](O)(CC#N)C2)cc1	ZINC000843425293	1321516838	/nfs/dbraw/zinc/51/68/38/1321516838.db2.gz	JONWDGFJBMWZTH-IBGZPJMESA-N	0	3	341.480	3.235	20	30		EGEDHN
C#CCOc1ccc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)cc1	ZINC000844377646	1321595994	/nfs/dbraw/zinc/59/59/94/1321595994.db2.gz	HYCSMMKOZURWTH-GJZGRUSLSA-N	0	3	341.329	3.385	20	30		EGEDHN
CC(C)(C)N1CC[C@@H]1COC(=O)C(C)(C)c1cc(F)cc(C#N)c1	ZINC000845729479	1321737313	/nfs/dbraw/zinc/73/73/13/1321737313.db2.gz	OMKPGBVZCFMWES-MRXNPFEDSA-N	0	3	332.419	3.391	20	30		EGEDHN
N#CC1(CNC2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CCCC1	ZINC000846009911	1321762589	/nfs/dbraw/zinc/76/25/89/1321762589.db2.gz	FKNPHGVKLPAHPE-UHFFFAOYSA-N	0	3	328.416	3.237	20	30		EGEDHN
CC[C@H](CC#N)NCCCCCCN1C(=O)c2ccccc2C1=O	ZINC000846989245	1321830931	/nfs/dbraw/zinc/83/09/31/1321830931.db2.gz	ZEFCBEPBOOJNDB-OAHLLOKOSA-N	0	3	327.428	3.125	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2nc(Cl)sc2Cl)CC1	ZINC000847451674	1321872378	/nfs/dbraw/zinc/87/23/78/1321872378.db2.gz	LYHCRRSZZRRXGE-UHFFFAOYSA-N	0	3	334.272	3.220	20	30		EGEDHN
CC(C)(C)OCC(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847747893	1321900535	/nfs/dbraw/zinc/90/05/35/1321900535.db2.gz	SBPKVDMGFBVPTB-UHFFFAOYSA-N	0	3	344.455	3.151	20	30		EGEDHN
CCCCOCC(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847748781	1321900567	/nfs/dbraw/zinc/90/05/67/1321900567.db2.gz	IFAFXMYGSDJJJN-UHFFFAOYSA-N	0	3	344.455	3.152	20	30		EGEDHN
C#CCOc1ccc(CNCc2ccc(O[C@@H]3CCOC3)cc2)cc1	ZINC000850315441	1322226966	/nfs/dbraw/zinc/22/69/66/1322226966.db2.gz	CDPHLHYYPPXEGZ-OAQYLSRUSA-N	0	3	337.419	3.156	20	30		EGEDHN
C[C@@H](NCc1ccc(N2CCC(O)CC2)cc1)c1cccc(C#N)c1	ZINC000850567452	1322269809	/nfs/dbraw/zinc/26/98/09/1322269809.db2.gz	CIRNXYKFTLBNOF-MRXNPFEDSA-N	0	3	335.451	3.370	20	30		EGEDHN
CC[C@@H](NC(=O)C(C#N)C(=O)CCCc1cccnc1)c1ccccc1	ZINC000850978031	1322318738	/nfs/dbraw/zinc/31/87/38/1322318738.db2.gz	KDKUHUMCEFMTBD-RBUKOAKNSA-N	0	3	349.434	3.381	20	30		EGEDHN
CC(C)(C)C[C@@H](CO)NCc1cc(C#N)ccc1Br	ZINC000921915365	1322422468	/nfs/dbraw/zinc/42/24/68/1322422468.db2.gz	UMRRDKNRECTKDC-ZDUSSCGKSA-N	0	3	325.250	3.207	20	30		EGEDHN
CCOC(=O)c1c[nH]nc1[C@@H]1CCN([C@H](C)c2cccc(C#N)c2)C1	ZINC000931009833	1329028015	/nfs/dbraw/zinc/02/80/15/1329028015.db2.gz	IWSPXMUURHVXKJ-CZUORRHYSA-N	0	3	338.411	3.009	20	30		EGEDHN
CC(C)[C@H](O)C1(CNCc2cc(C#N)ccc2Br)CC1	ZINC000921969453	1322431622	/nfs/dbraw/zinc/43/16/22/1322431622.db2.gz	WOILZKMEMVXRGN-HNNXBMFYSA-N	0	3	337.261	3.207	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CCC[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001023929970	1323036894	/nfs/dbraw/zinc/03/68/94/1323036894.db2.gz	LYAAOLFNEXHGBN-AWEZNQCLSA-N	0	3	347.409	3.289	20	30		EGEDHN
CC(=O)N[C@@H](c1ccccc1F)[C@H](C)NCc1cccc(C#N)c1	ZINC000924639811	1323089446	/nfs/dbraw/zinc/08/94/46/1323089446.db2.gz	NENRCHNTOMCIEF-ORAYPTAESA-N	0	3	325.387	3.053	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H](CNCc3nc(C)c(C)s3)C2)C1	ZINC001024146123	1323171667	/nfs/dbraw/zinc/17/16/67/1323171667.db2.gz	NSGQWKIYFZVVQO-INIZCTEOSA-N	0	3	347.528	3.444	20	30		EGEDHN
CN(Cc1cc(Cl)ccc1OCC#N)[C@@H](CO)Cc1ccccc1	ZINC000852289305	1323174963	/nfs/dbraw/zinc/17/49/63/1323174963.db2.gz	NVSHZHAPYWXYMK-GOSISDBHSA-N	0	3	344.842	3.278	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCN(C(=O)C2(CF)CCC2)C1	ZINC001024163870	1323181606	/nfs/dbraw/zinc/18/16/06/1323181606.db2.gz	OZZMZTBVJMGQSC-MRXNPFEDSA-N	0	3	343.446	3.026	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)Cc2cscn2)cc1	ZINC000853099632	1323281857	/nfs/dbraw/zinc/28/18/57/1323281857.db2.gz	UHQWVMQOPQXCOP-INIZCTEOSA-N	0	3	341.436	3.376	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1cccc(C(F)F)c1F	ZINC001024440879	1323401177	/nfs/dbraw/zinc/40/11/77/1323401177.db2.gz	UHWSLPFUTCGVMH-ZDUSSCGKSA-N	0	3	338.373	3.371	20	30		EGEDHN
C=CCN1CCCC[C@H]1CNC(=O)c1cn(C)c2ccc(F)cc12	ZINC001024479157	1323432134	/nfs/dbraw/zinc/43/21/34/1323432134.db2.gz	APSRDFRJLYYZCI-HNNXBMFYSA-N	0	3	329.419	3.088	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1cccc2ccc(C)nc21	ZINC001024502411	1323450763	/nfs/dbraw/zinc/45/07/63/1323450763.db2.gz	NJIIJKKJTUBWJI-GOSISDBHSA-N	0	3	335.451	3.151	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCCCN2Cc2ccc(C)cc2)nc1	ZINC001024763557	1323663755	/nfs/dbraw/zinc/66/37/55/1323663755.db2.gz	IZGJRUOBOHYBCU-FQEVSTJZSA-N	0	3	347.462	3.156	20	30		EGEDHN
Cc1cc(C(=O)N2CCCC[C@@H]2CNCc2ccc(C#N)s2)co1	ZINC001024939859	1323793482	/nfs/dbraw/zinc/79/34/82/1323793482.db2.gz	UNGJRFIKZJFRHR-OAHLLOKOSA-N	0	3	343.452	3.306	20	30		EGEDHN
C[C@]1(C(=O)N2CCCC[C@@H]2CNCc2ccc(C#N)s2)C=CCC1	ZINC001025046036	1323849947	/nfs/dbraw/zinc/84/99/47/1323849947.db2.gz	HBEUSKWVPDNJSS-BEFAXECRSA-N	0	3	343.496	3.447	20	30		EGEDHN
C=C1CCC(C(=O)N2CCCC[C@@H]2CNCc2ccns2)CC1	ZINC001025069082	1323869606	/nfs/dbraw/zinc/86/96/06/1323869606.db2.gz	AVBMNTWANOLZOD-MRXNPFEDSA-N	0	3	333.501	3.360	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCCC[C@H]1CNCc1cccc(OC)n1	ZINC001025069906	1323870135	/nfs/dbraw/zinc/87/01/35/1323870135.db2.gz	RQTXTVLQZPBEQC-FXAWDEMLSA-N	0	3	345.487	3.163	20	30		EGEDHN
CCC1(C(=O)N2CCCC[C@@H]2CNCc2ccc(C#N)s2)CC1	ZINC001025071804	1323873199	/nfs/dbraw/zinc/87/31/99/1323873199.db2.gz	MKMAVQXAYMSCQZ-CQSZACIVSA-N	0	3	331.485	3.281	20	30		EGEDHN
CC(=O)N1CCCC[C@@H]1[C@@H]1CCCN1Cc1ccc(C#N)c(F)c1	ZINC001025178522	1323943448	/nfs/dbraw/zinc/94/34/48/1323943448.db2.gz	DCYSRLQZZQIMHE-RBUKOAKNSA-N	0	3	329.419	3.063	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)Cc1ccsc1	ZINC001025196641	1323979873	/nfs/dbraw/zinc/97/98/73/1323979873.db2.gz	XQRHJCVIMTYHRY-QZTJIDSGSA-N	0	3	330.497	3.159	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)C1(C(F)(F)F)CCC1	ZINC001025246694	1324046262	/nfs/dbraw/zinc/04/62/62/1324046262.db2.gz	YWVBVQNTSZKFCR-GJZGRUSLSA-N	0	3	342.405	3.198	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cn(C)c2ccccc12	ZINC001025247441	1324047497	/nfs/dbraw/zinc/04/74/97/1324047497.db2.gz	KYZLIMFHUWKWGT-SFTDATJTSA-N	0	3	349.478	3.271	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cccc2cccnc21	ZINC001025247519	1324047544	/nfs/dbraw/zinc/04/75/44/1324047544.db2.gz	LRKMSUZGXXKYCK-PMACEKPBSA-N	0	3	347.462	3.327	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc2cnccc2o1	ZINC001025248122	1324049354	/nfs/dbraw/zinc/04/93/54/1324049354.db2.gz	VPSOHKZHOZDHKI-SJORKVTESA-N	0	3	339.439	3.473	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ncc(C)cc1C	ZINC001025252092	1324056466	/nfs/dbraw/zinc/05/64/66/1324056466.db2.gz	MHPREUIOFWSNCQ-MOPGFXCFSA-N	0	3	339.483	3.181	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cccnc1C(F)F	ZINC001025252811	1324059158	/nfs/dbraw/zinc/05/91/58/1324059158.db2.gz	ZJSKHAIWDJVYQI-JKSUJKDBSA-N	0	3	347.409	3.112	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCCC[C@@H]2[C@@H]2CCCN2CC#CC)cc1	ZINC001025257918	1324065985	/nfs/dbraw/zinc/06/59/85/1324065985.db2.gz	GXAMKOIPXDYHMC-LEWJYISDSA-N	0	3	334.463	3.150	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)C1(C(F)F)CCCC1	ZINC001025261492	1324072415	/nfs/dbraw/zinc/07/24/15/1324072415.db2.gz	WGGZCTQBVHMXGA-HZPDHXFCSA-N	0	3	338.442	3.291	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1noc2c1CCCC2	ZINC001025274061	1324090839	/nfs/dbraw/zinc/09/08/39/1324090839.db2.gz	UAXOHYDSUQKHMG-DLBZAZTESA-N	0	3	343.471	3.199	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(CC(C)C)c[nH]1	ZINC001025287000	1324108846	/nfs/dbraw/zinc/10/88/46/1324108846.db2.gz	BIJRATUBAKVNEC-UXHICEINSA-N	0	3	341.499	3.306	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ncoc1C1CC1	ZINC001025288157	1324111267	/nfs/dbraw/zinc/11/12/67/1324111267.db2.gz	SLHZXJSHXUXZHE-HOTGVXAUSA-N	0	3	329.444	3.197	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)CCc1ccccc1	ZINC001025293477	1324120788	/nfs/dbraw/zinc/12/07/88/1324120788.db2.gz	RZJXZWQLYJSBCB-SFTDATJTSA-N	0	3	338.495	3.488	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc2c(c1)CCC2	ZINC001025294087	1324123117	/nfs/dbraw/zinc/12/31/17/1324123117.db2.gz	HUNAEIHDTGNFDM-NHCUHLMSSA-N	0	3	336.479	3.268	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc(Cl)cc1	ZINC001025294314	1324123161	/nfs/dbraw/zinc/12/31/61/1324123161.db2.gz	ZHOLUCRUFQDSPJ-MSOLQXFVSA-N	0	3	330.859	3.432	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)Cc1ccccc1Cl	ZINC001025295534	1324125800	/nfs/dbraw/zinc/12/58/00/1324125800.db2.gz	HFAPRGDWDAXEAH-RBUKOAKNSA-N	0	3	344.886	3.361	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1nc(C)c(C)s1	ZINC001025295035	1324125887	/nfs/dbraw/zinc/12/58/87/1324125887.db2.gz	NQTJUCZLCQRGLS-JKSUJKDBSA-N	0	3	333.501	3.405	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1c(C)onc1CC	ZINC001025297550	1324130166	/nfs/dbraw/zinc/13/01/66/1324130166.db2.gz	YJRASTALPTVIFV-IRXDYDNUSA-N	0	3	331.460	3.191	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1c(C)noc1CC	ZINC001025297569	1324130268	/nfs/dbraw/zinc/13/02/68/1324130268.db2.gz	YSEDWQKFGLZDON-CVEARBPZSA-N	0	3	331.460	3.191	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cccc(C(F)F)c2F)C1	ZINC001025424935	1324257358	/nfs/dbraw/zinc/25/73/58/1324257358.db2.gz	JXCJGCFOQVKEQO-CHWSQXEVSA-N	0	3	338.373	3.227	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2nc(C(C)(C)C)cs2)C1	ZINC001025445367	1324285914	/nfs/dbraw/zinc/28/59/14/1324285914.db2.gz	LWRSCXBSJAKUFJ-CABCVRRESA-N	0	3	347.528	3.294	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(C)c3ccccc3n2)C1	ZINC001025457754	1324299042	/nfs/dbraw/zinc/29/90/42/1324299042.db2.gz	FHAXZTOTRVYFQG-IRXDYDNUSA-N	0	3	335.451	3.007	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc3cc(Cl)ccc3[nH]2)C1	ZINC001025501708	1324350286	/nfs/dbraw/zinc/35/02/86/1324350286.db2.gz	JKECVWLQGYDOFN-ZIAGYGMSSA-N	0	3	343.858	3.285	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cccc(Cl)c2F)C1	ZINC001025519049	1324362727	/nfs/dbraw/zinc/36/27/27/1324362727.db2.gz	JLBMBCJSZHOXRX-UONOGXRCSA-N	0	3	336.838	3.333	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(F)c(Cl)c2F)C1	ZINC001025524132	1324370371	/nfs/dbraw/zinc/37/03/71/1324370371.db2.gz	SKKUXYIWRKFCSA-NWDGAFQWSA-N	0	3	340.801	3.082	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(C(F)F)c(F)c2)C1	ZINC001025527892	1324372812	/nfs/dbraw/zinc/37/28/12/1324372812.db2.gz	NIIPDCJSHBYMBT-GXTWGEPZSA-N	0	3	338.373	3.227	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(C3CC3)nc2C)C1	ZINC001025533485	1324379758	/nfs/dbraw/zinc/37/97/58/1324379758.db2.gz	FDKLNTRGVUBBGH-YJBOKZPZSA-N	0	3	339.483	3.121	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2scnc2C(C)(C)C)C1	ZINC001025556231	1324405461	/nfs/dbraw/zinc/40/54/61/1324405461.db2.gz	SXTKBFKTJIYITR-HUUCEWRRSA-N	0	3	347.528	3.294	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc3scnc3c2)C1	ZINC001025585335	1324427941	/nfs/dbraw/zinc/42/79/41/1324427941.db2.gz	OOVDHOMGKNOFRN-GOEBONIOSA-N	0	3	341.480	3.150	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(C)c(F)cc2Cl)C1	ZINC001025603252	1324452338	/nfs/dbraw/zinc/45/23/38/1324452338.db2.gz	SQMTWXNPBSDDAV-KGLIPLIRSA-N	0	3	336.838	3.251	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC001025603405	1324453244	/nfs/dbraw/zinc/45/32/44/1324453244.db2.gz	VTAUKOYOMUEQSW-UKRRQHHQSA-N	0	3	338.373	3.169	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2coc3ccc(F)cc23)C1	ZINC001025607895	1324458878	/nfs/dbraw/zinc/45/88/78/1324458878.db2.gz	JEUNHGBEEYXIEW-CABCVRRESA-N	0	3	342.414	3.426	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(F)cc2Cl)C1	ZINC001025613722	1324465670	/nfs/dbraw/zinc/46/56/70/1324465670.db2.gz	ZPWRFHQCIWZOCX-UONOGXRCSA-N	0	3	336.838	3.333	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(OC)c(Cl)c2)C1	ZINC001025615397	1324468336	/nfs/dbraw/zinc/46/83/36/1324468336.db2.gz	VAHAEHKNBMPTSU-GOEBONIOSA-N	0	3	348.874	3.202	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2sc(C(C)C)nc2C)C1	ZINC001025618427	1324470290	/nfs/dbraw/zinc/47/02/90/1324470290.db2.gz	BGQYNDSRFDSLLF-HIFRSBDPSA-N	0	3	333.501	3.038	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(OC3CCC3)cc2)C1	ZINC001025626554	1324476986	/nfs/dbraw/zinc/47/69/86/1324476986.db2.gz	DMDQTRNHNDKOKD-AEFFLSMTSA-N	0	3	340.467	3.081	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cscc2C(F)(F)F)C1	ZINC001025636948	1324488011	/nfs/dbraw/zinc/48/80/11/1324488011.db2.gz	JGISMOIGRFWZCD-RYUDHWBXSA-N	0	3	344.402	3.230	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H]2CC[C@@H](NCc3csc(CC)n3)[C@H]2C1	ZINC001026328214	1324729497	/nfs/dbraw/zinc/72/94/97/1324729497.db2.gz	LLCKWBYNSLYGMB-CWRNSKLLSA-N	0	3	347.528	3.244	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H]2CC[C@@H](NCc3nc(C)oc3C)[C@@H]2C1	ZINC001026330423	1324731071	/nfs/dbraw/zinc/73/10/71/1324731071.db2.gz	ISWJHNRFUGAPOJ-GVDBMIGSSA-N	0	3	345.487	3.220	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H]2CC[C@H](NCc3nc(C)oc3C)[C@@H]2C1	ZINC001026330422	1324731173	/nfs/dbraw/zinc/73/11/73/1324731173.db2.gz	ISWJHNRFUGAPOJ-BBWFWOEESA-N	0	3	345.487	3.220	20	30		EGEDHN
C=C1CC(C)(C(=O)NC2CCC(NCc3csnc3OC)CC2)C1	ZINC001026555776	1324892825	/nfs/dbraw/zinc/89/28/25/1324892825.db2.gz	LYMQZMNDWVHWBS-UHFFFAOYSA-N	0	3	349.500	3.025	20	30		EGEDHN
Cc1cscc1C(=O)N1CC[C@H](CNCc2ccccc2C#N)C1	ZINC001026759478	1325007144	/nfs/dbraw/zinc/00/71/44/1325007144.db2.gz	IRTRPNORCWFMHK-OAHLLOKOSA-N	0	3	339.464	3.180	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)c2[nH]ccc2C)C1	ZINC000963293255	1325079436	/nfs/dbraw/zinc/07/94/36/1325079436.db2.gz	LJBXRPQSMPOYOX-CVEARBPZSA-N	0	3	335.879	3.392	20	30		EGEDHN
N#Cc1ncc(Br)cc1N1CCN(C2CCCCC2)CC1	ZINC000853448809	1325094238	/nfs/dbraw/zinc/09/42/38/1325094238.db2.gz	KNXWHVRYJXUFKR-UHFFFAOYSA-N	0	3	349.276	3.170	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](CNCc3csc(C)n3)C2)CC1	ZINC001027036799	1325170580	/nfs/dbraw/zinc/17/05/80/1325170580.db2.gz	IBRYRBYBPHWRQX-OAHLLOKOSA-N	0	3	333.501	3.136	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001027038783	1325173775	/nfs/dbraw/zinc/17/37/75/1325173775.db2.gz	QUMZNCBLYVBDCS-FOIQADDNSA-N	0	3	343.446	3.238	20	30		EGEDHN
Cc1cccc(C)c1C(=O)N1CC[C@H](CNCc2ccccc2C#N)C1	ZINC001027084734	1325209637	/nfs/dbraw/zinc/20/96/37/1325209637.db2.gz	LADQGIHUFDRBQI-GOSISDBHSA-N	0	3	347.462	3.427	20	30		EGEDHN
CCC1(C(=O)N2CC[C@@H](CNCc3ccccc3C#N)C2)CCCC1	ZINC001027149907	1325254585	/nfs/dbraw/zinc/25/45/85/1325254585.db2.gz	NBGVCFSSKPLWEL-KRWDZBQOSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)C2CCC(NCc3cc(C)ncn3)CC2)C1	ZINC000963891672	1325424247	/nfs/dbraw/zinc/42/42/47/1325424247.db2.gz	YEEJLKZMYLNRLA-UHFFFAOYSA-N	0	3	342.487	3.001	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)C2CCC(NCc3conc3C)CC2)C1	ZINC000963891335	1325424438	/nfs/dbraw/zinc/42/44/38/1325424438.db2.gz	RNSFVVOGFAJBFR-UHFFFAOYSA-N	0	3	331.460	3.199	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)[C@H]2CC=CCC2)C1	ZINC001027294543	1325430007	/nfs/dbraw/zinc/43/00/07/1325430007.db2.gz	WMHPEAIQEXKWJL-VQTJNVASSA-N	0	3	337.467	3.337	20	30		EGEDHN
C[N@H+](Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)c2ccccc2[O-])C1	ZINC001027307850	1325454210	/nfs/dbraw/zinc/45/42/10/1325454210.db2.gz	YUNQOOVZYAOTJW-GOSISDBHSA-N	0	3	349.434	3.000	20	30		EGEDHN
C[N@@H+](Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)c2ccccc2[O-])C1	ZINC001027307850	1325454214	/nfs/dbraw/zinc/45/42/14/1325454214.db2.gz	YUNQOOVZYAOTJW-GOSISDBHSA-N	0	3	349.434	3.000	20	30		EGEDHN
CN(Cc1ccc(C#N)c(F)c1)[C@H]1CCCN(C(=O)/C=C/C2CC2)C1	ZINC001027340126	1325500032	/nfs/dbraw/zinc/50/00/32/1325500032.db2.gz	APOXSIDMEQZAQF-KOEDOTQGSA-N	0	3	341.430	3.086	20	30		EGEDHN
C[C@H](CC(C)(C)C#N)NCc1ccc(S(C)(=O)=O)c(Cl)c1	ZINC000926280778	1325502380	/nfs/dbraw/zinc/50/23/80/1325502380.db2.gz	GCBFNNPXMOQHCK-LLVKDONJSA-N	0	3	328.865	3.161	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC[C@@H](N(C)Cc2ccc(F)c(C#N)c2)C1	ZINC001027361034	1325543551	/nfs/dbraw/zinc/54/35/51/1325543551.db2.gz	XHKYIPLPWMFPOG-ZGKREOHOSA-N	0	3	329.419	3.086	20	30		EGEDHN
CC1CC(C(=O)N2CCC[C@H](N(C)Cc3cccc(C#N)c3)C2)C1	ZINC001027361414	1325546109	/nfs/dbraw/zinc/54/61/09/1325546109.db2.gz	IIUPGSBRTBJMPM-PPSBMQLTSA-N	0	3	325.456	3.027	20	30		EGEDHN
CN(Cc1ccc(C#N)c(F)c1)[C@@H]1CCCN(C(=O)C=C2CCC2)C1	ZINC001027363591	1325552104	/nfs/dbraw/zinc/55/21/04/1325552104.db2.gz	KCMHGSJSRIKMIS-GOSISDBHSA-N	0	3	341.430	3.230	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1ccn(CC)c1C)C2	ZINC000964645099	1327617881	/nfs/dbraw/zinc/61/78/81/1327617881.db2.gz	VIIRBUATIGJMPX-UHFFFAOYSA-N	0	3	335.879	3.200	20	30		EGEDHN
CC(C(=O)N1CCC[C@@H](N(C)Cc2cccc(C#N)c2)C1)=C1CCC1	ZINC001027404093	1327628993	/nfs/dbraw/zinc/62/89/93/1327628993.db2.gz	VFRSTBJOTDYSPM-HXUWFJFHSA-N	0	3	337.467	3.481	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)c2oc3ccc(F)cc3c2C)C1	ZINC001027443765	1327684025	/nfs/dbraw/zinc/68/40/25/1327684025.db2.gz	NRTGXACLKDRBBW-OAHLLOKOSA-N	0	3	328.387	3.050	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)C1CCC(F)CC1)C2	ZINC000964899276	1327756403	/nfs/dbraw/zinc/75/64/03/1327756403.db2.gz	BZONHHBVNZLZBP-UHFFFAOYSA-N	0	3	328.859	3.284	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](N(C)Cc2ccc(F)c(C#N)c2)C1	ZINC001027521690	1327794934	/nfs/dbraw/zinc/79/49/34/1327794934.db2.gz	JIOCSSRGILDDOH-QGZVFWFLSA-N	0	3	343.446	3.332	20	30		EGEDHN
CC(C)[C@H](F)C(=O)N1CCC[C@@H](N(C)Cc2ccc(F)c(C#N)c2)C1	ZINC001027532914	1327817647	/nfs/dbraw/zinc/81/76/47/1327817647.db2.gz	FNSYSUQAXNSVCD-AEFFLSMTSA-N	0	3	349.425	3.114	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)c2c(Cl)oc3ccccc32)C1	ZINC001027543044	1327846471	/nfs/dbraw/zinc/84/64/71/1327846471.db2.gz	YDWRJVLDIMCYTN-ZDUSSCGKSA-N	0	3	330.815	3.256	20	30		EGEDHN
CC[C@H](NCCNc1ccc(C#N)cn1)c1cccc(OC)c1OC	ZINC000927167069	1327903889	/nfs/dbraw/zinc/90/38/89/1327903889.db2.gz	GDTURRDUJMBPJY-INIZCTEOSA-N	0	3	340.427	3.123	20	30		EGEDHN
Cc1c[nH]cc1C(=O)NC1CC2(CC(NCc3ccccc3C#N)C2)C1	ZINC000965919284	1328104762	/nfs/dbraw/zinc/10/47/62/1328104762.db2.gz	YROYTDUJLAESSG-UHFFFAOYSA-N	0	3	348.450	3.026	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@@H](NCc3ccc(F)c(C#N)c3)C2)s1	ZINC000966361619	1328278723	/nfs/dbraw/zinc/27/87/23/1328278723.db2.gz	URGOLTQZWUFNCK-OAHLLOKOSA-N	0	3	343.427	3.072	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2cccc(NC(=O)CC)c2)C1	ZINC000966456382	1328302913	/nfs/dbraw/zinc/30/29/13/1328302913.db2.gz	ONQFQHHLDKCQRM-MAUKXSAKSA-N	0	3	343.471	3.051	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NC[C@@H]1CCCN1Cc1cccc(C)c1	ZINC001027888275	1328355302	/nfs/dbraw/zinc/35/53/02/1328355302.db2.gz	KSUKZXAZEOPJBL-ZCNNSNEGSA-N	0	3	342.483	3.057	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2conc2C2CCCC2)C1	ZINC000966672412	1328375301	/nfs/dbraw/zinc/37/53/01/1328375301.db2.gz	WRFYJOUWEKIZTN-WMLDXEAASA-N	0	3	331.460	3.349	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)Cc2cccc3cnccc32)C1	ZINC000966907861	1328468323	/nfs/dbraw/zinc/46/83/23/1328468323.db2.gz	HHLGPFWEAMBEQV-OXQOHEQNSA-N	0	3	337.467	3.180	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1cc(C(F)(F)F)ccc1Cl	ZINC000861837396	1329444619	/nfs/dbraw/zinc/44/46/19/1329444619.db2.gz	CBQIZXGIHPOJKH-UHFFFAOYSA-N	0	3	332.753	3.044	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)Cc3cc4ccccc4s3)C2)CC1	ZINC001050590845	1348295281	/nfs/dbraw/zinc/29/52/81/1348295281.db2.gz	KLQRMQNHKBVLLD-UHFFFAOYSA-N	0	3	338.476	3.001	20	30		EGEDHN
COc1ccc([C@H](CN(C)C)NC(=O)Nc2sccc2C#N)cc1	ZINC000931839867	1329765547	/nfs/dbraw/zinc/76/55/47/1329765547.db2.gz	XESZNOFTQWMFNR-HNNXBMFYSA-N	0	3	344.440	3.053	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc([N+](=O)[O-])ccc2SC)CC1	ZINC000932142437	1329788299	/nfs/dbraw/zinc/78/82/99/1329788299.db2.gz	CGXZXORAXMPSIA-UHFFFAOYSA-N	0	3	349.456	3.087	20	30		EGEDHN
N#Cc1ccc(S(=O)(=O)CCNC2(C3CCCCC3)CC2)cc1	ZINC000934787137	1330007083	/nfs/dbraw/zinc/00/70/83/1330007083.db2.gz	FJWWIQOGHKZEFA-UHFFFAOYSA-N	0	3	332.469	3.034	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CCN(CCC(F)(F)F)C[C@@H]1C	ZINC000942128706	1331840594	/nfs/dbraw/zinc/84/05/94/1331840594.db2.gz	GUWDWDXYMFHZRD-KBPBESRZSA-N	0	3	343.393	3.067	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccc3c2CCCCC3)[C@H](C)C1	ZINC000942157360	1331851119	/nfs/dbraw/zinc/85/11/19/1331851119.db2.gz	QJXNYJSCGWETEK-DYESRHJHSA-N	0	3	338.495	3.419	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)c(C)cc2Cl)[C@@H](C)C1	ZINC000942561937	1331976069	/nfs/dbraw/zinc/97/60/69/1331976069.db2.gz	DZJNLRNWRKEXTL-MAUKXSAKSA-N	0	3	332.875	3.420	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc3cccc(OC)c3o2)[C@H](C)C1	ZINC000942581961	1331988511	/nfs/dbraw/zinc/98/85/11/1331988511.db2.gz	PXOIEPAGUGACKQ-UKRRQHHQSA-N	0	3	328.412	3.068	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(F)c(Cl)cc2F)[C@H](C)C1	ZINC000942585460	1331990823	/nfs/dbraw/zinc/99/08/23/1331990823.db2.gz	FUHBAMBMAXZIMZ-BZNIZROVSA-N	0	3	340.801	3.082	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3cccc(C#N)c3)C[C@@H]2C)C1	ZINC000942603016	1332000450	/nfs/dbraw/zinc/00/04/50/1332000450.db2.gz	QUFQUAZPZINCLZ-LPHOPBHVSA-N	0	3	337.467	3.241	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc(F)c(Cl)c2F)[C@H](C)C1	ZINC000942602933	1332000608	/nfs/dbraw/zinc/00/06/08/1332000608.db2.gz	PQUFYGVZYNWBAC-MFKMUULPSA-N	0	3	328.790	3.244	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccc(F)c(Cl)c2F)[C@@H](C)C1	ZINC000942602932	1332000778	/nfs/dbraw/zinc/00/07/78/1332000778.db2.gz	PQUFYGVZYNWBAC-GXFFZTMASA-N	0	3	328.790	3.244	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(F)c3ncccc3c2)[C@H](C)C1	ZINC000943648629	1332228771	/nfs/dbraw/zinc/22/87/71/1332228771.db2.gz	VLCQJGVIINVHNQ-CXAGYDPISA-N	0	3	327.403	3.000	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(Cl)c(CCC)c2)[C@@H](C)C1	ZINC000944082737	1332323348	/nfs/dbraw/zinc/32/33/48/1332323348.db2.gz	ZPVRXXRBUXQLRE-KSSFIOAISA-N	0	3	332.875	3.366	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc(Cl)cc(Cl)c2)[C@H](C)C1	ZINC000944303328	1332367487	/nfs/dbraw/zinc/36/74/87/1332367487.db2.gz	CAEJWRAISJOKQU-IAQYHMDHSA-N	0	3	325.239	3.067	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2c(Cl)cccc2Cl)[C@@H](C)C1	ZINC000944304774	1332368275	/nfs/dbraw/zinc/36/82/75/1332368275.db2.gz	LAOLWAWSIYGDDK-WFASDCNBSA-N	0	3	339.266	3.457	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccsc2C(F)F)[C@H](C)C1	ZINC000944535781	1332416109	/nfs/dbraw/zinc/41/61/09/1332416109.db2.gz	ZBMJFEDGLSGAKW-DGCLKSJQSA-N	0	3	326.412	3.149	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2sc(C(C)(C)C)nc2C)[C@@H](C)C1	ZINC000945808990	1332679225	/nfs/dbraw/zinc/67/92/25/1332679225.db2.gz	QLVUMHVDTMHQTJ-GXTWGEPZSA-N	0	3	335.517	3.375	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3ccn(CC)c3C)CC[C@@H]2C1	ZINC000946735756	1332887849	/nfs/dbraw/zinc/88/78/49/1332887849.db2.gz	ONWDOSLTMCLOHE-CALCHBBNSA-N	0	3	349.906	3.353	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3ccc(OC)cc3)CC[C@@H]2C1	ZINC000946869509	1332920423	/nfs/dbraw/zinc/92/04/23/1332920423.db2.gz	UZNQJDBONZHPQJ-CALCHBBNSA-N	0	3	348.874	3.232	20	30		EGEDHN
Cc1cccc(C(=O)N[C@@H]2CCN(Cc3cccc(C#N)c3)[C@H](C)C2)n1	ZINC000947075318	1333003009	/nfs/dbraw/zinc/00/30/09/1333003009.db2.gz	PEDLXXOKXCZHMR-VQIMIIECSA-N	0	3	348.450	3.045	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)CC2CCC2)CCN1Cc1cccc(C#N)c1	ZINC000947162723	1333029910	/nfs/dbraw/zinc/02/99/10/1333029910.db2.gz	LYVSDKQWMUTTER-HNAYVOBHSA-N	0	3	325.456	3.218	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)CC2CCC2)CCN1Cc1ccc(C#N)cc1	ZINC000947166523	1333032881	/nfs/dbraw/zinc/03/28/81/1333032881.db2.gz	ORCRUBZPARNQAQ-KXBFYZLASA-N	0	3	325.456	3.218	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2c[nH]c(C#N)c2)CCN1C/C=C\c1ccccc1	ZINC000947206008	1333052222	/nfs/dbraw/zinc/05/22/22/1333052222.db2.gz	ZQLCYRAEBMXNSF-AZTIMDOBSA-N	0	3	348.450	3.182	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cscc2C(F)F)C[C@@H]1C	ZINC000947318193	1333086662	/nfs/dbraw/zinc/08/66/62/1333086662.db2.gz	FKFOONKSTSDJEJ-RYUDHWBXSA-N	0	3	326.412	3.292	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2c(C)cccc2Cl)C[C@H]1C	ZINC000947496451	1333146780	/nfs/dbraw/zinc/14/67/80/1333146780.db2.gz	BCQJBVUYRMNFRG-CVEARBPZSA-N	0	3	332.875	3.183	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2sc(C)nc2CC(C)C)C[C@@H]1C	ZINC000947506305	1333149776	/nfs/dbraw/zinc/14/97/76/1333149776.db2.gz	NLASSHRBISRVPS-HOCLYGCPSA-N	0	3	347.528	3.256	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cn(CC)c3ccccc23)C[C@@H]1C	ZINC000947523718	1333157246	/nfs/dbraw/zinc/15/72/46/1333157246.db2.gz	HSJCRFUMQFNARG-IRXDYDNUSA-N	0	3	337.467	3.267	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2c(C)occ2C(F)(F)F)C[C@H]1C	ZINC000947547674	1333167941	/nfs/dbraw/zinc/16/79/41/1333167941.db2.gz	SWVWVGHPXNIARR-ZYHUDNBSSA-N	0	3	330.350	3.376	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3c(ccc(C)c3C)[nH]2)C[C@H]1C	ZINC000947615582	1333193742	/nfs/dbraw/zinc/19/37/42/1333193742.db2.gz	JNDZJKGNOYSLMM-WBVHZDCISA-N	0	3	337.467	3.391	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3c(ccc(C)c3C)[nH]2)C[C@@H]1C	ZINC000947615581	1333193792	/nfs/dbraw/zinc/19/37/92/1333193792.db2.gz	JNDZJKGNOYSLMM-RDJZCZTQSA-N	0	3	337.467	3.391	20	30		EGEDHN
Cc1coc(C(=O)N[C@H]2CCN(Cc3ccc(C#N)cc3)[C@H](C)C2)c1	ZINC000947630273	1333201036	/nfs/dbraw/zinc/20/10/36/1333201036.db2.gz	XTHIHRCJJKZIND-QAPCUYQASA-N	0	3	337.423	3.243	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)[C@H]2C[C@H]3C[C@H]3C2)CCN1Cc1cccc(C#N)c1	ZINC000947639135	1333204230	/nfs/dbraw/zinc/20/42/30/1333204230.db2.gz	MOKVSVZJGQHWSE-YLLORCDKSA-N	0	3	337.467	3.073	20	30		EGEDHN
Cc1ncccc1C(=O)N[C@@H]1CCN(Cc2ccc(C#N)cc2)[C@@H](C)C1	ZINC000947670623	1333217076	/nfs/dbraw/zinc/21/70/76/1333217076.db2.gz	GVFFLIPCMXMIBW-HNAYVOBHSA-N	0	3	348.450	3.045	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccsc2C(F)F)C[C@@H]1C	ZINC000947983496	1333331236	/nfs/dbraw/zinc/33/12/36/1333331236.db2.gz	BDKRVQFBQHOQJF-NWDGAFQWSA-N	0	3	326.412	3.292	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2c[nH]c3c2cccc3CC)C[C@@H]1C	ZINC000948069187	1333363922	/nfs/dbraw/zinc/36/39/22/1333363922.db2.gz	DBDRJNVGMYOHCR-RDJZCZTQSA-N	0	3	337.467	3.336	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N(C)[C@@H]1CCCN(C/C=C/Cl)CC1	ZINC000948385014	1333504409	/nfs/dbraw/zinc/50/44/09/1333504409.db2.gz	HECBZAWFPDAHSG-PQEFCEBDSA-N	0	3	340.895	3.033	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2nsc3ccccc32)CC1	ZINC000948401433	1333511879	/nfs/dbraw/zinc/51/18/79/1333511879.db2.gz	MOEZFUDSCWTHLK-OAHLLOKOSA-N	0	3	341.480	3.246	20	30		EGEDHN
C=CCn1cccc1C(=O)N(C)[C@@H]1CCCN(C[C@H](F)CC)CC1	ZINC000948439544	1333525316	/nfs/dbraw/zinc/52/53/16/1333525316.db2.gz	RHDFMOBBTGERSI-IAGOWNOFSA-N	0	3	335.467	3.349	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)C2C3CC4CC(C3)CC2C4)CC1	ZINC000948439064	1333525410	/nfs/dbraw/zinc/52/54/10/1333525410.db2.gz	GUHRRMFUGTXZJJ-XIWZRWORSA-N	0	3	342.527	3.395	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2cc3c([nH]2)c(F)ccc3C)CC1	ZINC000948566549	1333578895	/nfs/dbraw/zinc/57/88/95/1333578895.db2.gz	PBUFZXSQAOTSDY-HNNXBMFYSA-N	0	3	341.430	3.175	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](N(C)C(=O)c2ccn3cncc3c2)CC1	ZINC000948593832	1333589202	/nfs/dbraw/zinc/58/92/02/1333589202.db2.gz	IMPGMFMYUQPMBG-MRXNPFEDSA-N	0	3	346.862	3.013	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2ccc(C)c3cccnc23)CC1	ZINC000948625481	1333602273	/nfs/dbraw/zinc/60/22/73/1333602273.db2.gz	PVXPHUDLHQWRAA-QGZVFWFLSA-N	0	3	335.451	3.103	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2oc3ccccc3c2OC)CC1	ZINC000948664976	1333619679	/nfs/dbraw/zinc/61/96/79/1333619679.db2.gz	CALXHTQBFAODGG-HNNXBMFYSA-N	0	3	340.423	3.001	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)C[C@H]2CCCC2(F)F)CC1	ZINC000948717272	1333645263	/nfs/dbraw/zinc/64/52/63/1333645263.db2.gz	QCFRYYYREPNCDT-HZPDHXFCSA-N	0	3	326.431	3.148	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2csc(C(C)(C)C)n2)CC1	ZINC000948857064	1333710851	/nfs/dbraw/zinc/71/08/51/1333710851.db2.gz	TXKUAXPDYAULKE-CQSZACIVSA-N	0	3	333.501	3.000	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@@H]1CNC(=O)c1cc[nH]c1CC	ZINC000948913575	1333732044	/nfs/dbraw/zinc/73/20/44/1333732044.db2.gz	VLBXTNCBFULZMW-FQEVSTJZSA-N	0	3	337.467	3.482	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@H]1CNC(=O)c1nocc1C	ZINC000948978405	1333755129	/nfs/dbraw/zinc/75/51/29/1333755129.db2.gz	LTCGOBDDNBSFMX-GOSISDBHSA-N	0	3	339.439	3.278	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccc(C)c(Cl)c1)CCO2	ZINC000949178132	1333789864	/nfs/dbraw/zinc/78/98/64/1333789864.db2.gz	YIYXCUJVQDXUKJ-UHFFFAOYSA-N	0	3	348.874	3.141	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccc(C3CC3)s1)CCO2	ZINC000949227445	1333798710	/nfs/dbraw/zinc/79/87/10/1333798710.db2.gz	YVKOAPOPZDAFIT-UHFFFAOYSA-N	0	3	346.496	3.119	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1sccc1C1CC1)CCO2	ZINC000949239888	1333801383	/nfs/dbraw/zinc/80/13/83/1333801383.db2.gz	ZGWJOQPDGUNCNR-UHFFFAOYSA-N	0	3	346.496	3.119	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C[C@H]3CCC[C@@H]3C)CC2)C1	ZINC000949369940	1333832627	/nfs/dbraw/zinc/83/26/27/1333832627.db2.gz	HPKYCRLJXASIJD-ZWKOTPCHSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@@H]3CCCC34CC4)CC2)C1	ZINC000949395053	1333836633	/nfs/dbraw/zinc/83/66/33/1333836633.db2.gz	LVUSCWNKBKOAPK-SFHVURJKSA-N	0	3	346.515	3.226	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@@H]3CCC[C@H](C)C3)CC2)C1	ZINC000949455234	1333851753	/nfs/dbraw/zinc/85/17/53/1333851753.db2.gz	XQEGHNDCOYBUMX-RBUKOAKNSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C3CCC(=C)CC3)CC2)C1	ZINC000949454345	1333851832	/nfs/dbraw/zinc/85/18/32/1333851832.db2.gz	IDAABZCQVYXNQH-UHFFFAOYSA-N	0	3	346.515	3.392	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@@H]3CCC[C@@H]3CC)CC2)C1	ZINC000949466843	1333855458	/nfs/dbraw/zinc/85/54/58/1333855458.db2.gz	UMJDQDSSZWFNDE-ZWKOTPCHSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@H]3CC[C@H](C)CC3)CC2)C1	ZINC000949515468	1333865067	/nfs/dbraw/zinc/86/50/67/1333865067.db2.gz	TWFNLOUFLYIFNE-WGSAOQKQSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3ccoc3C(C)C)CC2)C1	ZINC000949531381	1333869150	/nfs/dbraw/zinc/86/91/50/1333869150.db2.gz	HEOWQKOZWKHKDG-UHFFFAOYSA-N	0	3	346.471	3.286	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)C2CCc3ccccc3CC2)C1	ZINC000967054795	1335650213	/nfs/dbraw/zinc/65/02/13/1335650213.db2.gz	CIKHGPHKUHZKTM-LAUBAEHRSA-N	0	3	338.495	3.032	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2ccc3c(c2)C(C)(C)CO3)C1	ZINC000967319895	1335700567	/nfs/dbraw/zinc/70/05/67/1335700567.db2.gz	ZPVJWGKXLGTSPL-MAUKXSAKSA-N	0	3	342.483	3.373	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(C)nc2C2CC2)C1	ZINC000967438080	1335739277	/nfs/dbraw/zinc/73/92/77/1335739277.db2.gz	TYOWFZPOKCDNCJ-KDOFPFPSSA-N	0	3	327.472	3.284	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)C2(c3cccc(F)c3)CCC2)C1	ZINC000967654430	1335801102	/nfs/dbraw/zinc/80/11/02/1335801102.db2.gz	GIEFXQVYGPUQLD-VQIMIIECSA-N	0	3	342.458	3.097	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CN(Cc3ccccc3C)CC[C@H]2C)c1	ZINC000968318400	1335889021	/nfs/dbraw/zinc/88/90/21/1335889021.db2.gz	UQLOYAPVLSIGKS-UTKZUKDTSA-N	0	3	347.462	3.012	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2cccc(N3CC=CC3)c2)C1	ZINC000968364664	1335904266	/nfs/dbraw/zinc/90/42/66/1335904266.db2.gz	IPNKKOAONYTMFP-YLJYHZDGSA-N	0	3	339.483	3.079	20	30		EGEDHN
C=C(C)CCN1CC[C@H](C)[C@@H](NC(=O)c2scnc2C2CC2)C1	ZINC000968399658	1335919331	/nfs/dbraw/zinc/91/93/31/1335919331.db2.gz	GUHXUTIVZCEPRG-ZFWWWQNUSA-N	0	3	333.501	3.427	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)Cn2cc(C)c3ccccc32)C1	ZINC000968399989	1335920100	/nfs/dbraw/zinc/92/01/00/1335920100.db2.gz	KBKPOMCQSIYWFU-VQIMIIECSA-N	0	3	339.483	3.352	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2scnc2C(C)(C)C)C1	ZINC000968400216	1335920552	/nfs/dbraw/zinc/92/05/52/1335920552.db2.gz	NPBAHBSJOOZSTN-UONOGXRCSA-N	0	3	335.517	3.457	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)Cn2cc(C)c3ccccc32)C1	ZINC000968399988	1335920596	/nfs/dbraw/zinc/92/05/96/1335920596.db2.gz	KBKPOMCQSIYWFU-QFBILLFUSA-N	0	3	339.483	3.352	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2ccc3ccn(C)c3c2)C1	ZINC000968506086	1335946405	/nfs/dbraw/zinc/94/64/05/1335946405.db2.gz	RVWWBCLFHOGPKB-YJBOKZPZSA-N	0	3	325.456	3.195	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)CC2C3CC4CC(C3)CC2C4)C1	ZINC000968668409	1336002513	/nfs/dbraw/zinc/00/25/13/1336002513.db2.gz	BWZIYBWZXSMKPA-JJVFZAKESA-N	0	3	342.527	3.299	20	30		EGEDHN
N#Cc1cccc(CN2CCCCC[C@H]2CNC(=O)[C@H]2CC2(F)F)c1	ZINC000968853712	1336068636	/nfs/dbraw/zinc/06/86/36/1336068636.db2.gz	OSQGQENCJZLMAU-DLBZAZTESA-N	0	3	347.409	3.074	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cccc(NC(=O)CC)c1	ZINC000968877249	1336076233	/nfs/dbraw/zinc/07/62/33/1336076233.db2.gz	QQZOCDNIIXRMDG-GOSISDBHSA-N	0	3	343.471	3.196	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)[C@H]1CCc2ccc(OC)cc21	ZINC000968890602	1336081446	/nfs/dbraw/zinc/08/14/46/1336081446.db2.gz	LQKMQISQKOGVLX-MJGOQNOKSA-N	0	3	342.483	3.272	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1n[nH]c(CC)c1Cl	ZINC000968893128	1336083326	/nfs/dbraw/zinc/08/33/26/1336083326.db2.gz	GZQODMKNHDTQKB-ZDUSSCGKSA-N	0	3	338.883	3.176	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cnn2c1ccc(C)c2C	ZINC000968896630	1336084425	/nfs/dbraw/zinc/08/44/25/1336084425.db2.gz	WSUXZESZXDIHBE-KRWDZBQOSA-N	0	3	340.471	3.112	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1c(C)ccnc1OCC	ZINC000968965402	1336104020	/nfs/dbraw/zinc/10/40/20/1336104020.db2.gz	ODKHSGBVMHOXOB-KRWDZBQOSA-N	0	3	345.487	3.339	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)NC[C@@H]1CCCCCN1Cc1cccc(C#N)c1	ZINC000968982241	1336108350	/nfs/dbraw/zinc/10/83/50/1336108350.db2.gz	DTZXNMCINVKYNM-AYOQOUSVSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)NC[C@H]1CCCCCN1Cc1ccc(C#N)cc1	ZINC000968984366	1336108851	/nfs/dbraw/zinc/10/88/51/1336108851.db2.gz	AZBYYDIQFGVLHX-ATZDWAIDSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1c(F)cc(F)cc1F	ZINC000969007364	1336116284	/nfs/dbraw/zinc/11/62/84/1336116284.db2.gz	APOYIPBYDKJWFH-CYBMUJFWSA-N	0	3	326.362	3.264	20	30		EGEDHN
C#CCCN1CCCCC[C@H]1CNC(=O)c1c(F)cc(F)cc1F	ZINC000969007380	1336116313	/nfs/dbraw/zinc/11/63/13/1336116313.db2.gz	BCGKORMLNOMLQS-AWEZNQCLSA-N	0	3	338.373	3.102	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cc(F)c(F)c(F)c1	ZINC000969040066	1336123602	/nfs/dbraw/zinc/12/36/02/1336123602.db2.gz	YCYADFUMTNETGC-ZDUSSCGKSA-N	0	3	326.362	3.264	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1noc2c1CCCCC2	ZINC000969052839	1336129333	/nfs/dbraw/zinc/12/93/33/1336129333.db2.gz	AHBGFONNHASXHT-OAHLLOKOSA-N	0	3	331.460	3.104	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)[C@@H]1CCc2cccc(OC)c21	ZINC000969062174	1336134626	/nfs/dbraw/zinc/13/46/26/1336134626.db2.gz	KWEJMILDFNHEQE-ZWKOTPCHSA-N	0	3	342.483	3.272	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1cccc2c1ccn2C	ZINC000969072951	1336138246	/nfs/dbraw/zinc/13/82/46/1336138246.db2.gz	UZHSVQMVIOWRDM-QGZVFWFLSA-N	0	3	337.467	3.176	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1coc(C2CCCC2)n1	ZINC000969096645	1336140757	/nfs/dbraw/zinc/14/07/57/1336140757.db2.gz	AWOJYBJGWIJKFH-MRXNPFEDSA-N	0	3	331.460	3.493	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1c(C)nn(CCC)c1C	ZINC000969106284	1336145965	/nfs/dbraw/zinc/14/59/65/1336145965.db2.gz	WGTNDFUWDGUMBC-KRWDZBQOSA-N	0	3	332.492	3.070	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)[C@H]1Cc2ccc(Cl)cc21	ZINC000969136470	1336157378	/nfs/dbraw/zinc/15/73/78/1336157378.db2.gz	NBCDTOCUAYLRNZ-MJGOQNOKSA-N	0	3	344.886	3.364	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1cccc2cnccc21	ZINC000969145162	1336161116	/nfs/dbraw/zinc/16/11/16/1336161116.db2.gz	ZFVFXSPYJRPCMN-GOSISDBHSA-N	0	3	335.451	3.233	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccc(OC(C)C)cn1	ZINC000969169747	1336170569	/nfs/dbraw/zinc/17/05/69/1336170569.db2.gz	DZNSDTUNJDTAEP-INIZCTEOSA-N	0	3	331.460	3.029	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CC[C@@H](N[C@@H](C)c3ccccc3F)C2)cc1	ZINC000969548052	1336221506	/nfs/dbraw/zinc/22/15/06/1336221506.db2.gz	FBGGHEZSURWMBX-MAUKXSAKSA-N	0	3	336.410	3.372	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](NCc2ccc(OC)c(F)c2)C1	ZINC000969570454	1336224926	/nfs/dbraw/zinc/22/49/26/1336224926.db2.gz	QPVKFXXRROHEAX-OAHLLOKOSA-N	0	3	334.435	3.127	20	30		EGEDHN
C#CCCN1CC([C@@H](C)NC(=O)c2cc3ccc(F)cc3s2)C1	ZINC000970090125	1336279216	/nfs/dbraw/zinc/27/92/16/1336279216.db2.gz	PFSXQSJSUSSABQ-GFCCVEGCSA-N	0	3	330.428	3.114	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)c2cc3cc(Cl)ccc3[nH]2)C1	ZINC000970249940	1336291451	/nfs/dbraw/zinc/29/14/51/1336291451.db2.gz	DKXMMUVETOALDG-GFCCVEGCSA-N	0	3	331.847	3.448	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)c2ccccc2OC2CCC2)C1	ZINC000970393448	1336303256	/nfs/dbraw/zinc/30/32/56/1336303256.db2.gz	NWNWCKLLMQKPIA-HNNXBMFYSA-N	0	3	328.456	3.244	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)c2ccc(O[C@H](C)CC)cc2)C1	ZINC000970708570	1336334540	/nfs/dbraw/zinc/33/45/40/1336334540.db2.gz	NRARPWHMEOUHFR-CVEARBPZSA-N	0	3	330.472	3.490	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2sc(Cl)nc2C)CC1	ZINC001005444269	1336350788	/nfs/dbraw/zinc/35/07/88/1336350788.db2.gz	GFZNGCGUQRHSLA-UHFFFAOYSA-N	0	3	327.881	3.217	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2scnc2C(F)F)CC1	ZINC001005695660	1336394445	/nfs/dbraw/zinc/39/44/45/1336394445.db2.gz	QUPOGKCOSMDQPM-UHFFFAOYSA-N	0	3	329.416	3.193	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)C2CCN(CCOc3ccccc3)CC2)C1	ZINC001005971141	1336432117	/nfs/dbraw/zinc/43/21/17/1336432117.db2.gz	YRMSYGGMPSLPSD-UHFFFAOYSA-N	0	3	342.483	3.345	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2ccccc2OCC(C)C)CC1	ZINC001006147392	1336459686	/nfs/dbraw/zinc/45/96/86/1336459686.db2.gz	QTTKCJHXOAOSLJ-UHFFFAOYSA-N	0	3	330.472	3.444	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cccc(F)c2OCC)CC1	ZINC001006195431	1336465193	/nfs/dbraw/zinc/46/51/93/1336465193.db2.gz	DITUZTNCJKFLSQ-UHFFFAOYSA-N	0	3	334.435	3.337	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2ccc(C(F)(F)F)s2)CC1	ZINC001006464321	1336511927	/nfs/dbraw/zinc/51/19/27/1336511927.db2.gz	DPULKTPFQKDJSW-UHFFFAOYSA-N	0	3	332.391	3.489	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCCN(CC3CC(F)(F)C3)C2)CC1	ZINC001008414874	1336846596	/nfs/dbraw/zinc/84/65/96/1336846596.db2.gz	BXXOIBQZIQZFIJ-MRXNPFEDSA-N	0	3	326.431	3.359	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2ccc(F)c(Cl)c2F)C1	ZINC001008428913	1336850763	/nfs/dbraw/zinc/85/07/63/1336850763.db2.gz	OGXHZYZGQDKNMO-LLVKDONJSA-N	0	3	328.790	3.389	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2ccccc2OCC2CC2)C1	ZINC001009642841	1337051375	/nfs/dbraw/zinc/05/13/75/1337051375.db2.gz	KORLCXPMTOUIKE-QGZVFWFLSA-N	0	3	328.456	3.246	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCN(Cc3cccc(N(C)C)c3)C2)CC1	ZINC001015660006	1338239720	/nfs/dbraw/zinc/23/97/20/1338239720.db2.gz	PBQZCXPNRQHQCE-LJQANCHMSA-N	0	3	341.499	3.190	20	30		EGEDHN
C#CCCN1CC[C@@H](NC(=O)[C@@H]2C[C@H]2c2cccc3ccccc32)C1	ZINC001015866664	1338339683	/nfs/dbraw/zinc/33/96/83/1338339683.db2.gz	BJPLIZMQWKWRPY-JRGCBEDISA-N	0	3	332.447	3.157	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN([C@@H](C)c3cc(C)ccc3C)C2)cn1	ZINC001016032706	1338417686	/nfs/dbraw/zinc/41/76/86/1338417686.db2.gz	CPWSQHORVROPLN-PXNSSMCTSA-N	0	3	347.462	3.245	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@@H]1CCN(Cc2cccc(CC)c2)C1	ZINC001016114310	1338467024	/nfs/dbraw/zinc/46/70/24/1338467024.db2.gz	QTPQTBCXUOOQSF-JOCHJYFZSA-N	0	3	346.474	3.164	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2cc3sccc3s2)CC1	ZINC001016684882	1338689336	/nfs/dbraw/zinc/68/93/36/1338689336.db2.gz	JHMIYPDHJXJJDS-OAHLLOKOSA-N	0	3	330.478	3.180	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)Cc2ccc(C3CCC3)cc2)CC1	ZINC001016751720	1338712139	/nfs/dbraw/zinc/71/21/39/1338712139.db2.gz	NCMRWEZKKZFDLU-FQEVSTJZSA-N	0	3	336.479	3.101	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CC23CCN(Cc2ccccn2)CC3)CC1	ZINC001016804372	1338732315	/nfs/dbraw/zinc/73/23/15/1338732315.db2.gz	XGEURXNJBHNCGK-LJQANCHMSA-N	0	3	339.483	3.299	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)Cc2c[nH]c3c2cccc3C)CC1	ZINC001016856746	1338749122	/nfs/dbraw/zinc/74/91/22/1338749122.db2.gz	TUEWSOBYXSEUJZ-LJQANCHMSA-N	0	3	349.478	3.013	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(C)c(OCC)c2)CC1	ZINC001016862332	1338751546	/nfs/dbraw/zinc/75/15/46/1338751546.db2.gz	WIVUBCFLFKTCCW-IBGZPJMESA-N	0	3	340.467	3.001	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2cc(Cl)ccc2Cl)CC1	ZINC001016945928	1338779750	/nfs/dbraw/zinc/77/97/50/1338779750.db2.gz	FPRYGEDBCYZKGW-OAHLLOKOSA-N	0	3	337.250	3.211	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)[C@H](C)c2ccc(F)c(F)c2)CC1	ZINC001016985878	1338793132	/nfs/dbraw/zinc/79/31/32/1338793132.db2.gz	LITJEKPCIXANSU-KDOFPFPSSA-N	0	3	346.421	3.062	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccc(F)c3occc32)CC1	ZINC001016987527	1338794038	/nfs/dbraw/zinc/79/40/38/1338794038.db2.gz	VDRJOCNQPQICCN-QGZVFWFLSA-N	0	3	340.398	3.180	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCCN(C(=O)CC2CCC2)C1	ZINC001017089976	1338858620	/nfs/dbraw/zinc/85/86/20/1338858620.db2.gz	ABIAVUGHKAEOOO-MRXNPFEDSA-N	0	3	345.512	3.480	20	30		EGEDHN
C[C@H](c1ccccc1F)N(C)C[C@H]1CCCN(C(=O)C#CC2CC2)C1	ZINC001017121070	1338879176	/nfs/dbraw/zinc/87/91/76/1338879176.db2.gz	PNDQXCSYPWRDNN-SJLPKXTDSA-N	0	3	342.458	3.471	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCCN(C(=O)C2(CF)CC2)C1	ZINC001017204043	1338950104	/nfs/dbraw/zinc/95/01/04/1338950104.db2.gz	GPODBAARCXRBOI-CQSZACIVSA-N	0	3	349.475	3.040	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H](CN(C)Cc3cccnc3)C2)C1	ZINC001017205971	1338952550	/nfs/dbraw/zinc/95/25/50/1338952550.db2.gz	GLMLYHVHFPUSGS-GOSISDBHSA-N	0	3	327.472	3.108	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H]1CCC[C@H](OC)C1	ZINC001017605712	1339376310	/nfs/dbraw/zinc/37/63/10/1339376310.db2.gz	JHUSJYYSGLVJPP-YRXWBPOGSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1c(C)cccc1Cl	ZINC001017704251	1339396049	/nfs/dbraw/zinc/39/60/49/1339396049.db2.gz	QWDUSEXYWQUZSS-IYBDPMFKSA-N	0	3	332.875	3.442	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1C[C@H]1c1ccc(OC)cc1	ZINC001018042158	1339489025	/nfs/dbraw/zinc/48/90/25/1339489025.db2.gz	WBRZWGXNZHBEDP-KVPLUYHFSA-N	0	3	340.467	3.050	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccccc1OC(C)C	ZINC001018062733	1339493121	/nfs/dbraw/zinc/49/31/21/1339493121.db2.gz	BYEKICLKPPHFRZ-KDURUIRLSA-N	0	3	342.483	3.268	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)Cc1ccc(OC)cc1	ZINC001018293965	1339565902	/nfs/dbraw/zinc/56/59/02/1339565902.db2.gz	ZBXXOWAPHJRWEA-YTQUADARSA-N	0	3	342.483	3.125	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC[C@H](NC2c3ccccc3-c3ccccc32)C1	ZINC001018633272	1339688442	/nfs/dbraw/zinc/68/84/42/1339688442.db2.gz	VTIVHSBXWQXXSR-GJZGRUSLSA-N	0	3	331.419	3.107	20	30		EGEDHN
CC(C(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)C1)=C1CCCC1	ZINC001018699650	1339705839	/nfs/dbraw/zinc/70/58/39/1339705839.db2.gz	OIVBJLVUMGYHPG-SFHVURJKSA-N	0	3	341.430	3.278	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1cnn(C2CCCCC2)c1	ZINC001028247507	1340508540	/nfs/dbraw/zinc/50/85/40/1340508540.db2.gz	QHUZDWUDTPATKI-GOSISDBHSA-N	0	3	330.476	3.159	20	30		EGEDHN
Cc1sccc1C(=O)NC[C@H]1CCN(Cc2ccc(C#N)cc2)C1	ZINC001028532864	1340691526	/nfs/dbraw/zinc/69/15/26/1340691526.db2.gz	RIKGJDOEFHBZNU-QGZVFWFLSA-N	0	3	339.464	3.180	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)c2ccc(C(C)(C)CC)cc2)C1	ZINC001028617960	1340725901	/nfs/dbraw/zinc/72/59/01/1340725901.db2.gz	LBIDOEAUFBPKKT-QGZVFWFLSA-N	0	3	326.484	3.449	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H](CNC(=O)[C@@H]3CCCC34CC4)C2)c1	ZINC001028625898	1340730882	/nfs/dbraw/zinc/73/08/82/1340730882.db2.gz	ADFQWNKCMVPOKM-OALUTQOASA-N	0	3	337.467	3.077	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CCN(Cc3c(C)noc3CC)C2)CC1	ZINC001028778210	1340808552	/nfs/dbraw/zinc/80/85/52/1340808552.db2.gz	DHRASPNRTYNYTF-INIZCTEOSA-N	0	3	345.487	3.230	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)c2cc3cc(C)ccc3s2)C1	ZINC001028902047	1340879475	/nfs/dbraw/zinc/87/94/75/1340879475.db2.gz	NDBWCDYQXJUMQU-OAHLLOKOSA-N	0	3	326.465	3.285	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)c2ccc(Cl)c3occc32)C1	ZINC001028923569	1340885061	/nfs/dbraw/zinc/88/50/61/1340885061.db2.gz	FJSRQHIUNPTEFM-ZDUSSCGKSA-N	0	3	330.815	3.161	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)c2ccc(Cl)c3occc32)C1	ZINC001028923568	1340885138	/nfs/dbraw/zinc/88/51/38/1340885138.db2.gz	FJSRQHIUNPTEFM-CYBMUJFWSA-N	0	3	330.815	3.161	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)c2cccc(Cl)c2Cl)C1	ZINC001028950141	1340892080	/nfs/dbraw/zinc/89/20/80/1340892080.db2.gz	XSIZZDVBKOAHBM-LBPRGKRZSA-N	0	3	325.239	3.068	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC([C@@H](C)NCc2cc(C)no2)CC1	ZINC001029124424	1340935762	/nfs/dbraw/zinc/93/57/62/1340935762.db2.gz	GWSARLFBISVTKB-OAHLLOKOSA-N	0	3	333.476	3.302	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC([C@@H](C)NCc2cnc(C)cn2)CC1	ZINC001029124624	1340935898	/nfs/dbraw/zinc/93/58/98/1340935898.db2.gz	AHXDBBTZMFDZIQ-MRXNPFEDSA-N	0	3	344.503	3.104	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC([C@@H](C)NCc2ccccc2C#N)CC1	ZINC001029126377	1340936278	/nfs/dbraw/zinc/93/62/78/1340936278.db2.gz	RGFXGKUNZCHNPW-MRXNPFEDSA-N	0	3	339.483	3.487	20	30		EGEDHN
O=C(C#CC1CC1)N1C[C@H]2CC[C@@H](C1)N2CC[C@@H]1CCc2ccccc21	ZINC001029302885	1340969289	/nfs/dbraw/zinc/96/92/89/1340969289.db2.gz	VOUSFZAMYXLHJD-PCCBWWKXSA-N	0	3	348.490	3.195	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CC[C@@H](C1)N2C[C@H](O)C1CCCCC1	ZINC001029454319	1340993570	/nfs/dbraw/zinc/99/35/70/1340993570.db2.gz	YPUNMVJQEUUMIC-YOUFYPILSA-N	0	3	348.531	3.205	20	30		EGEDHN
Cc1occc1C(=O)N1CC[C@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001029639093	1341029872	/nfs/dbraw/zinc/02/98/72/1341029872.db2.gz	CHZZAFMJUUWHFR-CQSZACIVSA-N	0	3	343.452	3.115	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCN(C(=O)C[C@H]2C=CCC2)C1	ZINC001029642214	1341030799	/nfs/dbraw/zinc/03/07/99/1341030799.db2.gz	YGRAQUIZTZVSSV-JKSUJKDBSA-N	0	3	343.496	3.256	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](CN(C)Cc3oc(C)nc3C)C2)CC1	ZINC001029826894	1341088015	/nfs/dbraw/zinc/08/80/15/1341088015.db2.gz	WXISOBVQDSPBMJ-KRWDZBQOSA-N	0	3	345.487	3.318	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC(CN(C)Cc2c(C)noc2C)CC1	ZINC001029983963	1341143863	/nfs/dbraw/zinc/14/38/63/1341143863.db2.gz	VFSRMPSAMWTVND-UHFFFAOYSA-N	0	3	333.476	3.174	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC(CN(C)Cc3cnoc3C)CC2)C1	ZINC001029994211	1341150330	/nfs/dbraw/zinc/15/03/30/1341150330.db2.gz	ZLTYXACRMSXAGU-UHFFFAOYSA-N	0	3	331.460	3.010	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1	ZINC001032810878	1341623523	/nfs/dbraw/zinc/62/35/23/1341623523.db2.gz	MXUAURMVBSEGFF-CADBVGFASA-N	0	3	328.431	3.181	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(N(C)C(C)C)cc1	ZINC001032814944	1341625209	/nfs/dbraw/zinc/62/52/09/1341625209.db2.gz	QXGNPXGPRMUIKB-PMACEKPBSA-N	0	3	341.499	3.396	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2ccnc(-c3ccco3)c2)C1	ZINC001033177533	1341746581	/nfs/dbraw/zinc/74/65/81/1341746581.db2.gz	RIJUEOWGANWPKP-MRXNPFEDSA-N	0	3	325.412	3.064	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](N(C)C(=O)c2cnc(CC3CC3)s2)C1	ZINC001033295275	1341770292	/nfs/dbraw/zinc/77/02/92/1341770292.db2.gz	JSLADYXIDRMUFH-OAHLLOKOSA-N	0	3	333.501	3.208	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2nsc3ccc(C)cc32)C1	ZINC001033329856	1341783869	/nfs/dbraw/zinc/78/38/69/1341783869.db2.gz	WQTXATIFWQMSQD-CQSZACIVSA-N	0	3	329.469	3.327	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@@H]2CCN(Cc3cc(C)cc(C)c3)C2)cn1	ZINC001033596577	1341890030	/nfs/dbraw/zinc/89/00/30/1341890030.db2.gz	LYMDPGHEKDQJHL-OAQYLSRUSA-N	0	3	347.462	3.026	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cnn(C(C)(C)C)c2C)C1	ZINC001033847799	1342042840	/nfs/dbraw/zinc/04/28/40/1342042840.db2.gz	YEFDFSVFGXBTCD-MRXNPFEDSA-N	0	3	332.492	3.059	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@H]2CCc3cc(OC)ccc32)C1	ZINC001033853233	1342044794	/nfs/dbraw/zinc/04/47/94/1342044794.db2.gz	XHUFRQKJEJHULO-PXNSSMCTSA-N	0	3	342.483	3.224	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2cc(C)c3ccccc3n2)C1	ZINC001033875726	1342053777	/nfs/dbraw/zinc/05/37/77/1342053777.db2.gz	ZJYNSPAYZRVJFE-QGZVFWFLSA-N	0	3	335.451	3.103	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cccc3c2O[C@H](C)C3)C1	ZINC001033898994	1342071041	/nfs/dbraw/zinc/07/10/41/1342071041.db2.gz	FGPJXKCDMOJZCT-NVXWUHKLSA-N	0	3	328.456	3.123	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@H]2CCc3cc(F)ccc32)C1	ZINC001033902528	1342076255	/nfs/dbraw/zinc/07/62/55/1342076255.db2.gz	KFNNHADFNPHLDJ-HKUYNNGSSA-N	0	3	330.447	3.354	20	30		EGEDHN
C=CCCN1CC[C@H](N(CC)C(=O)c2cc3c(C)nn(C)c3s2)C1	ZINC001033910918	1342081923	/nfs/dbraw/zinc/08/19/23/1342081923.db2.gz	PKTMDUAFNRUNTL-AWEZNQCLSA-N	0	3	346.500	3.056	20	30		EGEDHN
C#Cc1cncc(C(=O)N(CC)[C@H]2CCN(Cc3cccc(C)c3)C2)c1	ZINC001033947761	1342107624	/nfs/dbraw/zinc/10/76/24/1342107624.db2.gz	VVXYQOLIPUGZGU-NRFANRHFSA-N	0	3	347.462	3.108	20	30		EGEDHN
C=CCCN1CC[C@H](N(CC)C(=O)c2cnc([C@H]3CCCO3)s2)C1	ZINC001033980540	1342128115	/nfs/dbraw/zinc/12/81/15/1342128115.db2.gz	UXFKRQXGLOUXPU-LSDHHAIUSA-N	0	3	349.500	3.107	20	30		EGEDHN
C=CCCN1CC[C@H](N(CC)C(=O)c2cc(Br)co2)C1	ZINC001033981495	1342128944	/nfs/dbraw/zinc/12/89/44/1342128944.db2.gz	SVQAKQUGYJCXHR-ZDUSSCGKSA-N	0	3	341.249	3.155	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccc3c(c2)C[C@H](C)O3)C1	ZINC001033991755	1342134333	/nfs/dbraw/zinc/13/43/33/1342134333.db2.gz	LNEFPGRYICKACG-YJBOKZPZSA-N	0	3	328.456	3.123	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cnn(C3CCCC3)c2C)C1	ZINC001034017968	1342154762	/nfs/dbraw/zinc/15/47/62/1342154762.db2.gz	VRBDWOJRGQGEIH-SFHVURJKSA-N	0	3	344.503	3.419	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccc3ncsc3c2)C1	ZINC001034036272	1342174864	/nfs/dbraw/zinc/17/48/64/1342174864.db2.gz	UXGWCNZEJRHLDW-HNNXBMFYSA-N	0	3	329.469	3.409	20	30		EGEDHN
Cc1cc(CN2CCCC[C@@H](NC(=O)c3cc(C#N)c[nH]3)C2)cs1	ZINC001034162989	1342287096	/nfs/dbraw/zinc/28/70/96/1342287096.db2.gz	FNLAGWIBKNLZMD-MRXNPFEDSA-N	0	3	342.468	3.041	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2cccc(C(F)F)c2F)C1	ZINC001034210702	1342320443	/nfs/dbraw/zinc/32/04/43/1342320443.db2.gz	SUHGICDTWZRTLY-ZDUSSCGKSA-N	0	3	338.373	3.371	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2csc([C@@H](C)OC)n2)C1	ZINC001034212638	1342321211	/nfs/dbraw/zinc/32/12/11/1342321211.db2.gz	ZJPAXDREXYQPIR-ZIAGYGMSSA-N	0	3	337.489	3.011	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)c2c(F)ccc3ccncc32)C1	ZINC001034218856	1342325258	/nfs/dbraw/zinc/32/52/58/1342325258.db2.gz	JJEUYJHBMSSNLG-HNNXBMFYSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc3nc(C)oc3c2)C1	ZINC001034253775	1342349187	/nfs/dbraw/zinc/34/91/87/1342349187.db2.gz	NFMFYYSGMFAGLA-INIZCTEOSA-N	0	3	327.428	3.297	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccnn2-c2ccccc2)C1	ZINC001034273474	1342364814	/nfs/dbraw/zinc/36/48/14/1342364814.db2.gz	ICSWRCSAUXQLGL-KRWDZBQOSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cc3c(cn2)CCCC3)C1	ZINC001034299722	1342382847	/nfs/dbraw/zinc/38/28/47/1342382847.db2.gz	IPPWIYSXHXPGFI-SFHVURJKSA-N	0	3	327.472	3.121	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@@H]2CCc3ccc(F)cc3O2)C1	ZINC001034306053	1342389447	/nfs/dbraw/zinc/38/94/47/1342389447.db2.gz	BLLGIVHYQYIDBK-ROUUACIJSA-N	0	3	346.446	3.066	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2cc3cccc(OC)c3o2)C1	ZINC001034372761	1342441559	/nfs/dbraw/zinc/44/15/59/1342441559.db2.gz	OBJOVOJPEJERSU-MRXNPFEDSA-N	0	3	340.423	3.049	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc(F)c(COC)c2)C1	ZINC001034393173	1342462264	/nfs/dbraw/zinc/46/22/64/1342462264.db2.gz	RZFCIUZYFXTTSE-QGZVFWFLSA-N	0	3	334.435	3.133	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cnn(C3CCCC3)c2C)C1	ZINC001034483329	1342540622	/nfs/dbraw/zinc/54/06/22/1342540622.db2.gz	LAYQKMVGZSCKDQ-QGZVFWFLSA-N	0	3	344.503	3.467	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc3ncsc3c2)C1	ZINC001034512757	1342571227	/nfs/dbraw/zinc/57/12/27/1342571227.db2.gz	QICLLCUECBUBCL-HNNXBMFYSA-N	0	3	329.469	3.457	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)c2ccc(OCC3CC3)cc2)C1	ZINC001034539824	1342598801	/nfs/dbraw/zinc/59/88/01/1342598801.db2.gz	ZGTYCVIWYONRJT-SFHVURJKSA-N	0	3	328.456	3.246	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC[C@H](NCc3oc(C)nc3C)CC2)C1	ZINC001034729526	1342724473	/nfs/dbraw/zinc/72/44/73/1342724473.db2.gz	OCQTXYPWHXLFDU-WKILWMFISA-N	0	3	331.460	3.165	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)[C@@H]2CC[C@H](C)C2)CC1	ZINC001034750104	1342737389	/nfs/dbraw/zinc/73/73/89/1342737389.db2.gz	YDLHKDSVDIZZME-ATGSNQNLSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)[C@@H]2C[C@]2(C)CC)CC1	ZINC001034765690	1342745182	/nfs/dbraw/zinc/74/51/82/1342745182.db2.gz	GWJHLFNYEYGNDN-YXWQFLTLSA-N	0	3	343.309	3.348	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)NCc1ccc(CNCc2ccc(C#N)cc2)cc1	ZINC001034807311	1342772849	/nfs/dbraw/zinc/77/28/49/1342772849.db2.gz	ODLRDTFGDSJOTF-YWZLYKJASA-N	0	3	333.435	3.120	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)C23CCC(CC2)C3)s1	ZINC001034974697	1342860990	/nfs/dbraw/zinc/86/09/90/1342860990.db2.gz	FGAMAXPHWHZWPE-XAUUPUKJSA-N	0	3	343.496	3.281	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]1CNCc1c(C)nsc1C	ZINC001035011862	1342874948	/nfs/dbraw/zinc/87/49/48/1342874948.db2.gz	KZZLSVPYBVIKDP-OAHLLOKOSA-N	0	3	335.517	3.443	20	30		EGEDHN
Cc1cc(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)s2)cs1	ZINC001035080290	1342917115	/nfs/dbraw/zinc/91/71/15/1342917115.db2.gz	GEAVLGIWTWLGOL-CQSZACIVSA-N	0	3	345.493	3.384	20	30		EGEDHN
CC(C)(F)C(=O)N1CCC2(CCN(Cc3ccc(C#N)s3)C2)CC1	ZINC001035149430	1342961163	/nfs/dbraw/zinc/96/11/63/1342961163.db2.gz	FJFJMAAPOXQTSU-UHFFFAOYSA-N	0	3	349.475	3.182	20	30		EGEDHN
CCCc1ccc(CN2CC3(C2)CCN(C(=O)[C@@H](C)C#N)CC3)cc1	ZINC001035670374	1343130580	/nfs/dbraw/zinc/13/05/80/1343130580.db2.gz	FAMIYUCJQIXUEN-KRWDZBQOSA-N	0	3	339.483	3.223	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)C[C@@H]1C[C@H]1c1ccccc1)CC2	ZINC001035710475	1343146022	/nfs/dbraw/zinc/14/60/22/1343146022.db2.gz	YWQHCXKXNOREPZ-PMACEKPBSA-N	0	3	336.479	3.128	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@H](c1ccncc1)C(C)C)CC2	ZINC001035779410	1343189885	/nfs/dbraw/zinc/18/98/85/1343189885.db2.gz	PRBRCJXUANSDOY-IBGZPJMESA-N	0	3	341.499	3.322	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cc1c(F)cccc1F)CC2	ZINC001035780427	1343190802	/nfs/dbraw/zinc/19/08/02/1343190802.db2.gz	HDFXUTJKNJVBBI-UHFFFAOYSA-N	0	3	334.410	3.008	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H](C)c1ccccc1F)CC2	ZINC001035819985	1343214407	/nfs/dbraw/zinc/21/44/07/1343214407.db2.gz	VFBSKSFYVFBTGA-INIZCTEOSA-N	0	3	330.447	3.430	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@H](c1cccnc1)C(C)C)CC2	ZINC001035824299	1343215816	/nfs/dbraw/zinc/21/58/16/1343215816.db2.gz	YGUOHQXSDZUUEW-IBGZPJMESA-N	0	3	341.499	3.322	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1c(C)nn(CCC)c1C)CC2	ZINC001035832860	1343220167	/nfs/dbraw/zinc/22/01/67/1343220167.db2.gz	SWOJWNWCWVDDIH-UHFFFAOYSA-N	0	3	344.503	3.024	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)CCc1c[nH]c3ccccc13)CC2	ZINC001035847040	1343227530	/nfs/dbraw/zinc/22/75/30/1343227530.db2.gz	FHNNLEJUCRCCQC-UHFFFAOYSA-N	0	3	349.478	3.048	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cc1ccc(OCC)cc1)CC2	ZINC001035847499	1343228035	/nfs/dbraw/zinc/22/80/35/1343228035.db2.gz	MHNPZTHAQHSEEG-UHFFFAOYSA-N	0	3	342.483	3.128	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccc(OC(C)C)cc1)CC2	ZINC001035848371	1343228590	/nfs/dbraw/zinc/22/85/90/1343228590.db2.gz	UKCOPWKOTACXGW-UHFFFAOYSA-N	0	3	340.467	3.035	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cc1ccc(C)c(C)c1)CC2	ZINC001035848253	1343228652	/nfs/dbraw/zinc/22/86/52/1343228652.db2.gz	SKHAYAUPWKSLJY-UHFFFAOYSA-N	0	3	326.484	3.346	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@@H](C)c1ccc(F)c(F)c1)CC2	ZINC001035855621	1343232502	/nfs/dbraw/zinc/23/25/02/1343232502.db2.gz	RCSDKOTYKBHFLW-HNNXBMFYSA-N	0	3	346.421	3.016	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@H](C)n1c(C)ccc1C)CC2	ZINC001035856109	1343232744	/nfs/dbraw/zinc/23/27/44/1343232744.db2.gz	INRZUCKPRCLCMV-SFHVURJKSA-N	0	3	329.488	3.166	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc(N(C)CC)cc1)CC2	ZINC001035859807	1343235816	/nfs/dbraw/zinc/23/58/16/1343235816.db2.gz	JISUABCMJAAPAE-UHFFFAOYSA-N	0	3	341.499	3.257	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@H](NCc3ccccc3C#N)[C@@H](C)C2)o1	ZINC001035897025	1343256887	/nfs/dbraw/zinc/25/68/87/1343256887.db2.gz	OKNSJVAXSFGBMG-KSSFIOAISA-N	0	3	337.423	3.100	20	30		EGEDHN
C[C@H]1CN(C(=O)CC(C)(C)C)CC[C@H]1NCc1cc(F)ccc1C#N	ZINC001035906165	1343263075	/nfs/dbraw/zinc/26/30/75/1343263075.db2.gz	APZIAUAGHZUAAA-KBXCAEBGSA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@@H]1CN(C(=O)C=C2CCC2)CC[C@@H]1NCc1cc(F)ccc1C#N	ZINC001035994859	1343305604	/nfs/dbraw/zinc/30/56/04/1343305604.db2.gz	ZNJUYGNVDHAFFB-KUHUBIRLSA-N	0	3	341.430	3.134	20	30		EGEDHN
Cc1cocc1C(=O)N1CC[C@H](NCc2ccccc2C#N)[C@@H](C)C1	ZINC001036139796	1343324415	/nfs/dbraw/zinc/32/44/15/1343324415.db2.gz	AOEKPTOKIYCKAQ-LIRRHRJNSA-N	0	3	337.423	3.100	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H]([C@@H](C)NCc2cc(OC)no2)C1	ZINC001036435653	1343485400	/nfs/dbraw/zinc/48/54/00/1343485400.db2.gz	AWMWPIHOCMWCPI-CABCVRRESA-N	0	3	349.475	3.002	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]([C@H](C)NCc3cscn3)C2)C1	ZINC001036441764	1343489870	/nfs/dbraw/zinc/48/98/70/1343489870.db2.gz	CWORPFMKSDFZOT-GJZGRUSLSA-N	0	3	333.501	3.216	20	30		EGEDHN
CCC(=O)N1CC[C@@H]2[C@@H](CCN2CC#Cc2ccc(Cl)cc2)C1	ZINC001036609024	1343572745	/nfs/dbraw/zinc/57/27/45/1343572745.db2.gz	UGAOQPLHLQHFRG-FUHWJXTLSA-N	0	3	330.859	3.024	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@@H]2CN(C(=O)C3CCCC3)CC[C@@H]21	ZINC001036621144	1343579596	/nfs/dbraw/zinc/57/95/96/1343579596.db2.gz	PMDOKTJCESNIRW-UXHICEINSA-N	0	3	337.467	3.171	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccc(F)c(C#N)c2)C1	ZINC001036628202	1343585420	/nfs/dbraw/zinc/58/54/20/1343585420.db2.gz	XQVVAEROHCHJQR-VQIMIIECSA-N	0	3	343.446	3.166	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@@H]2CN(C(=O)C3=CCCC3)CC[C@H]21	ZINC001036686798	1343630059	/nfs/dbraw/zinc/63/00/59/1343630059.db2.gz	SKZNABJYQWBVMO-WOJBJXKFSA-N	0	3	335.451	3.091	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2[C@H](CCN2Cc2cc(C)ns2)C1	ZINC001036789194	1343718903	/nfs/dbraw/zinc/71/89/03/1343718903.db2.gz	NMAXUUDMIHEADC-ZBFHGGJFSA-N	0	3	333.501	3.087	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCC[C@H]1NC(=O)C1CCCC1	ZINC001036923041	1343866932	/nfs/dbraw/zinc/86/69/32/1343866932.db2.gz	ZLKOHELCWIRTMQ-RBUKOAKNSA-N	0	3	325.456	3.123	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCC[C@H]2CNCc2ccn(CC)n2)CC1	ZINC001037070430	1343964046	/nfs/dbraw/zinc/96/40/46/1343964046.db2.gz	RBPCIAFDSLHBSV-PKOBYXMFSA-N	0	3	344.503	3.024	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](NCc2ccn(CC)n2)[C@@H](CC)C1	ZINC001037889748	1344163828	/nfs/dbraw/zinc/16/38/28/1344163828.db2.gz	GBSZLKGMYPBJPC-WMZOPIPTSA-N	0	3	346.519	3.222	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](NCc2nccs2)[C@H](CC)C1	ZINC001037906068	1344170644	/nfs/dbraw/zinc/17/06/44/1344170644.db2.gz	QDSSUNOBEIIHDX-HUUCEWRRSA-N	0	3	335.517	3.462	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@H]1CCN1CCCc1ccccc1	ZINC001038343897	1344387811	/nfs/dbraw/zinc/38/78/11/1344387811.db2.gz	CYRDINPJSFOOQT-LJQANCHMSA-N	0	3	337.467	3.111	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1ccnc(-c2ccco2)c1	ZINC001038383046	1344403771	/nfs/dbraw/zinc/40/37/71/1344403771.db2.gz	XUZFBKANVQJCGX-INIZCTEOSA-N	0	3	325.412	3.112	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)CC(C)(C)C)CC[C@H]1c1ccc(F)cc1	ZINC001079148866	1357196680	/nfs/dbraw/zinc/19/66/80/1357196680.db2.gz	PPGIZVGBXHVMNB-ZWKOTPCHSA-N	0	3	330.447	3.169	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C2(F)CCCC2)CC[C@H]1c1ccc(F)cc1	ZINC001079154591	1357198104	/nfs/dbraw/zinc/19/81/04/1357198104.db2.gz	LPAMIKBCORHLLA-ZWKOTPCHSA-N	0	3	346.421	3.015	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1cc(F)c(F)cc1Cl	ZINC001038984812	1344697545	/nfs/dbraw/zinc/69/75/45/1344697545.db2.gz	DPWQGYLDGOOACI-NSHDSACASA-N	0	3	328.790	3.389	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)c3ccccn3)CC2)C1	ZINC001039097678	1344769485	/nfs/dbraw/zinc/76/94/85/1344769485.db2.gz	NPHPCWFHZCBHAY-INIZCTEOSA-N	0	3	333.863	3.008	20	30		EGEDHN
CCC(=O)N1CCC([C@@H]2CCN(Cc3ccc(C#N)cc3F)C2)CC1	ZINC001039101372	1344773176	/nfs/dbraw/zinc/77/31/76/1344773176.db2.gz	HAPNRDUTPSQNQP-QGZVFWFLSA-N	0	3	343.446	3.168	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(Cl)o2)C1	ZINC001039193470	1344899480	/nfs/dbraw/zinc/89/94/80/1344899480.db2.gz	NRVLHDRAUIFPNI-GJZGRUSLSA-N	0	3	334.847	3.273	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccc3occc3c2)C1	ZINC001039209241	1344921452	/nfs/dbraw/zinc/92/14/52/1344921452.db2.gz	IQPWETUUCSCZNO-RBUKOAKNSA-N	0	3	336.435	3.383	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)C2CCC3(CC3)CC2)C1	ZINC001039217105	1344934214	/nfs/dbraw/zinc/93/42/14/1344934214.db2.gz	SMBAVSJWBYOJCB-RBUKOAKNSA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(CC)s2)C1	ZINC001039218083	1344935000	/nfs/dbraw/zinc/93/50/00/1344935000.db2.gz	KJEFVWLXRQDMSQ-WBVHZDCISA-N	0	3	330.497	3.260	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)Cc2ccccc2CC)C1	ZINC001039219727	1344937173	/nfs/dbraw/zinc/93/71/73/1344937173.db2.gz	UOYRKUNTMMTJIT-NHCUHLMSSA-N	0	3	338.495	3.128	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccoc2C2CC2)C1	ZINC001039225044	1344943116	/nfs/dbraw/zinc/94/31/16/1344943116.db2.gz	KZSQMZHNPHNTEP-FUHWJXTLSA-N	0	3	326.440	3.107	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2csc(C(C)C)n2)C1	ZINC001039232426	1344952897	/nfs/dbraw/zinc/95/28/97/1344952897.db2.gz	WDYCZVDUSNMYDE-WBVHZDCISA-N	0	3	345.512	3.216	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc3ccccn3c2)C1	ZINC001039235820	1344957491	/nfs/dbraw/zinc/95/74/91/1344957491.db2.gz	RGJOUCGDPDEZCZ-NQIIRXRSSA-N	0	3	349.478	3.279	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)Cc2ccc(C)c(C)c2)C1	ZINC001039237053	1344958655	/nfs/dbraw/zinc/95/86/55/1344958655.db2.gz	ATRVSQOSRFMICF-RTWAWAEBSA-N	0	3	338.495	3.182	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)CCc2cccs2)C1	ZINC001039237615	1344960829	/nfs/dbraw/zinc/96/08/29/1344960829.db2.gz	DHHAARUMDXFULY-FUHWJXTLSA-N	0	3	330.497	3.017	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccc3c(c2)CCC3)C1	ZINC001039238402	1344962102	/nfs/dbraw/zinc/96/21/02/1344962102.db2.gz	IDLSTICVYVHRIV-LEWJYISDSA-N	0	3	336.479	3.125	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(F)cc2F)C1	ZINC001039238528	1344962340	/nfs/dbraw/zinc/96/23/40/1344962340.db2.gz	IVSFUVOGEQZZNH-DNVCBOLYSA-N	0	3	346.421	3.305	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccc(Cl)cc2)C1	ZINC001039247591	1344977078	/nfs/dbraw/zinc/97/70/78/1344977078.db2.gz	XLZCIOPXVJBOAO-FUHWJXTLSA-N	0	3	330.859	3.290	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cccc3ccncc32)C1	ZINC001039258392	1344986649	/nfs/dbraw/zinc/98/66/49/1344986649.db2.gz	XCCPPRYODIHGTR-RXVVDRJESA-N	0	3	347.462	3.185	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H]2CC[C@@H](C1)N2C(=O)c1c[nH]c(C#N)c1	ZINC001039366018	1345030486	/nfs/dbraw/zinc/03/04/86/1345030486.db2.gz	KXDXWTOCNBJZEQ-YSGRDPCXSA-N	0	3	348.450	3.326	20	30		EGEDHN
Cc1ccc(C)c(CN2CC[C@H]3CC[C@@H](C2)N3C(=O)C#CC2CC2)c1	ZINC001039373119	1345032100	/nfs/dbraw/zinc/03/21/00/1345032100.db2.gz	FQLFAMAPILPHQQ-RTWAWAEBSA-N	0	3	336.479	3.282	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccc2ccc(C)nc21	ZINC001039391744	1345041581	/nfs/dbraw/zinc/04/15/81/1345041581.db2.gz	HXKROEJGBNFZOA-MOPGFXCFSA-N	0	3	347.462	3.245	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1c(C)cccc1Cl	ZINC001039399137	1345046686	/nfs/dbraw/zinc/04/66/86/1345046686.db2.gz	JFDOABCBHYQKRI-CVEARBPZSA-N	0	3	332.875	3.442	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](c1ccccc1)C1CC1	ZINC001039404662	1345050324	/nfs/dbraw/zinc/05/03/24/1345050324.db2.gz	NHCILWDWXWVERS-QHAWAJNXSA-N	0	3	336.479	3.269	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccc(OCC)c1	ZINC001039443110	1345069008	/nfs/dbraw/zinc/06/90/08/1345069008.db2.gz	GUGXRJUGGWTBFS-MSOLQXFVSA-N	0	3	328.456	3.340	20	30		EGEDHN
C=CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1sc(CC)nc1C	ZINC001039451883	1345075013	/nfs/dbraw/zinc/07/50/13/1345075013.db2.gz	SYMXFLTWLHEKKZ-CABCVRRESA-N	0	3	333.501	3.269	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1Cc2ccc(Cl)cc21	ZINC001039465124	1345082986	/nfs/dbraw/zinc/08/29/86/1345082986.db2.gz	OSUTYELYLLIMOG-ZIFCJYIRSA-N	0	3	342.870	3.068	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(OCC)cc1	ZINC001039465710	1345083438	/nfs/dbraw/zinc/08/34/38/1345083438.db2.gz	VNRFJVCXCBJOLC-MSOLQXFVSA-N	0	3	328.456	3.340	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)Oc1ccccc1	ZINC001039466390	1345083857	/nfs/dbraw/zinc/08/38/57/1345083857.db2.gz	HTYARMOZIRRQPV-KURKYZTESA-N	0	3	328.456	3.095	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)CCc1cccc(OCC)c1	ZINC001039475640	1345090095	/nfs/dbraw/zinc/09/00/95/1345090095.db2.gz	AVJLMCMXQMZXCD-MOPGFXCFSA-N	0	3	342.483	3.269	20	30		EGEDHN
CCCC(=O)N1CC[C@]2(C1)CCCN(Cc1cccc(C#N)c1)C2	ZINC001040037240	1345303218	/nfs/dbraw/zinc/30/32/18/1345303218.db2.gz	STWGPKLQFLOOQH-HXUWFJFHSA-N	0	3	325.456	3.173	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@]3(CCN(C(=O)CC4CC4)C3)C2)c1	ZINC001040038635	1345305011	/nfs/dbraw/zinc/30/50/11/1345305011.db2.gz	XGVOWFMPKGZABN-OAQYLSRUSA-N	0	3	337.467	3.173	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@]3(CCN(C(=O)c4ccco4)C3)C2)cc1	ZINC001040044060	1345308751	/nfs/dbraw/zinc/30/87/51/1345308751.db2.gz	PBJBASYUKCTBSI-OAQYLSRUSA-N	0	3	349.434	3.280	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@]3(CCN(C(=O)C4CC=CC4)C3)C2)cc1	ZINC001040130339	1345344642	/nfs/dbraw/zinc/34/46/42/1345344642.db2.gz	PQCLIYANZUZBST-QFIPXVFZSA-N	0	3	349.478	3.339	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3cccc(Cl)c3C)C2)C1	ZINC001040218141	1345379199	/nfs/dbraw/zinc/37/91/99/1345379199.db2.gz	XTTKZEXVDFWTNM-IBGZPJMESA-N	0	3	330.859	3.210	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ccc4cc(C)cn4c3)C2)C1	ZINC001040236473	1345389481	/nfs/dbraw/zinc/38/94/81/1345389481.db2.gz	NGFBGUBPQMPVLO-JOCHJYFZSA-N	0	3	349.478	3.199	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cn(C)c4ccccc34)C2)C1	ZINC001040281227	1345409864	/nfs/dbraw/zinc/40/98/64/1345409864.db2.gz	BDWCOHRGYRGDIG-JOCHJYFZSA-N	0	3	349.478	3.130	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ccc(Cl)cc3F)C2)C1	ZINC001040284404	1345412211	/nfs/dbraw/zinc/41/22/11/1345412211.db2.gz	VQUQVYYPQRJNDY-IBGZPJMESA-N	0	3	348.849	3.431	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3ccc4cc(C)ccc4n3)C2)C1	ZINC001040288791	1345413422	/nfs/dbraw/zinc/41/34/22/1345413422.db2.gz	IBXSHBHRZJILGO-QFIPXVFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@@H]3CC[C@@H]4C[C@@H]4CC3)C2)C1	ZINC001040308895	1345424421	/nfs/dbraw/zinc/42/44/21/1345424421.db2.gz	DZPCRQGKSNDFSR-WERVVEIQSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3ccc(C)nc3C(C)C)C2)C1	ZINC001040317090	1345427936	/nfs/dbraw/zinc/42/79/36/1345427936.db2.gz	KSKZPILLBFHCKA-NRFANRHFSA-N	0	3	339.483	3.075	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@]2(C1)CCCN(Cc1cccnc1)C2	ZINC001040328377	1345434789	/nfs/dbraw/zinc/43/47/89/1345434789.db2.gz	LLCISWDZZMJXHH-HXUWFJFHSA-N	0	3	327.472	3.108	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cncc4sccc43)C2)C1	ZINC001040352801	1345449060	/nfs/dbraw/zinc/44/90/60/1345449060.db2.gz	AUERSDRVZPFKAG-LJQANCHMSA-N	0	3	341.480	3.410	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)C3(C(F)F)CCCC3)C2)C1	ZINC001040353606	1345449591	/nfs/dbraw/zinc/44/95/91/1345449591.db2.gz	JUTMHVNOVCMYSD-SFHVURJKSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3ccc(C(F)F)cc3)C2)C1	ZINC001040446074	1345504500	/nfs/dbraw/zinc/50/45/00/1345504500.db2.gz	IQUJFYPVFBANBF-IBGZPJMESA-N	0	3	332.394	3.186	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)C[C@@H](C)c3ccccc3F)C2)C1	ZINC001040454449	1345508339	/nfs/dbraw/zinc/50/83/39/1345508339.db2.gz	VKTMBISAYNQLLN-UTKZUKDTSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@@H](C)c3ccc(C)s3)C2)C1	ZINC001040491999	1345517696	/nfs/dbraw/zinc/51/76/96/1345517696.db2.gz	KTDJPZSWUXLXBC-LPHOPBHVSA-N	0	3	330.497	3.108	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3ccc4c(c3)CCC=C4)C2)C1	ZINC001040493824	1345519668	/nfs/dbraw/zinc/51/96/68/1345519668.db2.gz	RBCPSXXYWQWTLY-QFIPXVFZSA-N	0	3	334.463	3.207	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cc(CC(C)C)c[nH]3)C2)C1	ZINC001040497452	1345520138	/nfs/dbraw/zinc/52/01/38/1345520138.db2.gz	SVAABJBXGJPFAY-OAQYLSRUSA-N	0	3	341.499	3.165	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3cccc4ccccc43)C2)C1	ZINC001040516581	1345529916	/nfs/dbraw/zinc/52/99/16/1345529916.db2.gz	WCRMRNZSOBUDPM-JOCHJYFZSA-N	0	3	332.447	3.401	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@@H](C)Cc3ccccc3)C2)C1	ZINC001040543253	1345538602	/nfs/dbraw/zinc/53/86/02/1345538602.db2.gz	MXZCAOCHGANKDU-UGKGYDQZSA-N	0	3	338.495	3.203	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@H](C)Cc3ccccc3C)C2)C1	ZINC001040546324	1345541233	/nfs/dbraw/zinc/54/12/33/1345541233.db2.gz	CJEHOLXKHNIAEE-KNQAVFIVSA-N	0	3	338.495	3.121	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@H]3C[C@]3(CC)C(C)C)C2)CC1	ZINC001040902566	1345597158	/nfs/dbraw/zinc/59/71/58/1345597158.db2.gz	WFSPOFMNGLCKAE-WIYYLYMNSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)C(C)(C)c3ccccc3)C2)CC1	ZINC001040930782	1345603702	/nfs/dbraw/zinc/60/37/02/1345603702.db2.gz	VJRRHZQCZNSLSZ-UHFFFAOYSA-N	0	3	338.495	3.302	20	30		EGEDHN
Cc1cc(Cl)ccc1CN1CC[C@]2(CCN(C(=O)[C@@H](C)C#N)C2)C1	ZINC001041146300	1345660601	/nfs/dbraw/zinc/66/06/01/1345660601.db2.gz	MBQXGIVLCOBRJZ-KXBFYZLASA-N	0	3	345.874	3.233	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@]3(CCN(C(=O)[C@H]4[C@@H]5CCC[C@@H]54)C3)C2)cc1	ZINC001041178760	1345667275	/nfs/dbraw/zinc/66/72/75/1345667275.db2.gz	NIHYDENZIGQUJQ-HIUFNZKISA-N	0	3	349.478	3.029	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccc(-c4ccco4)o3)C2)C1	ZINC001041465132	1345736232	/nfs/dbraw/zinc/73/62/32/1345736232.db2.gz	WTXKUWUMILYXMF-HXUWFJFHSA-N	0	3	338.407	3.101	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@]2(CCN(Cc3scnc3C)C2)C1	ZINC001041537476	1345755720	/nfs/dbraw/zinc/75/57/20/1345755720.db2.gz	XQHOTQGBIHTZGM-IBGZPJMESA-N	0	3	347.528	3.478	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@]2(CCN(Cc3c(C)nsc3C)C2)C1	ZINC001041545330	1345759531	/nfs/dbraw/zinc/75/95/31/1345759531.db2.gz	ULWHXXXFNXHLLL-LJQANCHMSA-N	0	3	347.528	3.397	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cccc(Cl)c3F)C2)C1	ZINC001041618355	1345796931	/nfs/dbraw/zinc/79/69/31/1345796931.db2.gz	TZKQRVZKDNEQHL-SFHVURJKSA-N	0	3	334.822	3.040	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@]2(CCN(Cc3cnc(C)s3)C2)C1	ZINC001041625932	1345800069	/nfs/dbraw/zinc/80/00/69/1345800069.db2.gz	MPUQHBTYBVKDCV-OALUTQOASA-N	0	3	347.528	3.478	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)[C@H](C)c3ccc(CC)cc3)C2)C1	ZINC001041742268	1345838730	/nfs/dbraw/zinc/83/87/30/1345838730.db2.gz	YZWAWEZTQXTRAP-XMSQKQJNSA-N	0	3	338.495	3.300	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3ccc(Cl)c(CCC)c3)C2)C1	ZINC001041783401	1345848939	/nfs/dbraw/zinc/84/89/39/1345848939.db2.gz	HFNGJZDGBUHMHI-FQEVSTJZSA-N	0	3	344.886	3.464	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccc(C4CC4)s3)C2)C1	ZINC001041787726	1345850569	/nfs/dbraw/zinc/85/05/69/1345850569.db2.gz	SRRQDAPBUWVYJA-LJQANCHMSA-N	0	3	328.481	3.187	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)[C@H]3CCCCc4ccccc43)C2)C1	ZINC001041847238	1345872204	/nfs/dbraw/zinc/87/22/04/1345872204.db2.gz	LWHJHNLLXQYUMU-RBBKRZOGSA-N	0	3	336.479	3.054	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3CCN(C(=O)c4ccccc4)C[C@H]32)c1	ZINC001041909998	1345892743	/nfs/dbraw/zinc/89/27/43/1345892743.db2.gz	LIQPXURCBLFEKZ-PZJWPPBQSA-N	0	3	345.446	3.295	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CCN(C(=O)CCC4CC4)C[C@@H]32)cc1	ZINC001041991165	1345914847	/nfs/dbraw/zinc/91/48/47/1345914847.db2.gz	YLDOSYOZBVEXFC-UXHICEINSA-N	0	3	337.467	3.171	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3CCN(C(=O)C=C4CCC4)C[C@@H]32)c1	ZINC001042006893	1345922630	/nfs/dbraw/zinc/92/26/30/1345922630.db2.gz	RMLZGKUMVRDYCD-PMACEKPBSA-N	0	3	335.451	3.091	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3ccn(C4CCCC4)n3)C[C@@H]21	ZINC001042079339	1345939566	/nfs/dbraw/zinc/93/95/66/1345939566.db2.gz	CAXJQMJORGAIAG-APWZRJJASA-N	0	3	342.487	3.111	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3ccn(C4CCCC4)n3)C[C@H]21	ZINC001042079342	1345939599	/nfs/dbraw/zinc/93/95/99/1345939599.db2.gz	CAXJQMJORGAIAG-VQIMIIECSA-N	0	3	342.487	3.111	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3conc3C3CCCC3)C[C@@H]21	ZINC001042091826	1345941713	/nfs/dbraw/zinc/94/17/13/1345941713.db2.gz	YMXCNYPWIYNFGH-YJBOKZPZSA-N	0	3	343.471	3.445	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CCN(C(=O)C4(C5CC5)CC4)C[C@H]32)c1	ZINC001042107513	1345945851	/nfs/dbraw/zinc/94/58/51/1345945851.db2.gz	RKXJGNVQESPXLQ-UYAOXDASSA-N	0	3	349.478	3.171	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cc4c(cc(C)cc4C)[nH]3)C[C@@H]21	ZINC001042168261	1345963718	/nfs/dbraw/zinc/96/37/18/1345963718.db2.gz	UKHRSSKCTZMKTF-UTKZUKDTSA-N	0	3	349.478	3.344	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C3(c4ccc(F)cc4)CCC3)C[C@@H]21	ZINC001042177102	1345968281	/nfs/dbraw/zinc/96/82/81/1345968281.db2.gz	UJTVORZJMHOHSX-LPHOPBHVSA-N	0	3	342.458	3.356	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2CCN(CCc3csc(C)n3)[C@H]2C1	ZINC001042181661	1345969831	/nfs/dbraw/zinc/96/98/31/1345969831.db2.gz	IEURLAGIEUVFNR-RDJZCZTQSA-N	0	3	347.528	3.129	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3c(F)ccc(C)c3F)C[C@@H]21	ZINC001042219767	1345991365	/nfs/dbraw/zinc/99/13/65/1345991365.db2.gz	ZLRKTLBPOKRISR-HOCLYGCPSA-N	0	3	334.410	3.386	20	30		EGEDHN
CCC1(C(=O)N2CC[C@H]3CCN(Cc4cccc(C#N)c4)[C@H]3C2)CC1	ZINC001042220767	1345992116	/nfs/dbraw/zinc/99/21/16/1345992116.db2.gz	FKUCUERGETZJMP-MOPGFXCFSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3noc4c3CCCCC4)C[C@@H]21	ZINC001042250824	1346006669	/nfs/dbraw/zinc/00/66/69/1346006669.db2.gz	DVKKHDXJOLNMSH-RDJZCZTQSA-N	0	3	343.471	3.056	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C34CCC(CC3)C4(C)C)C[C@@H]21	ZINC001042262918	1346010317	/nfs/dbraw/zinc/01/03/17/1346010317.db2.gz	QIEMNLBMSFGTJG-RAJLDSNDSA-N	0	3	328.500	3.149	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)C34CCC(CC3)C4(C)C)C[C@@H]21	ZINC001042262914	1346010329	/nfs/dbraw/zinc/01/03/29/1346010329.db2.gz	QIEMNLBMSFGTJG-LCUHEZEJSA-N	0	3	328.500	3.149	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)Cn3cc(C)c4ccccc43)C[C@H]21	ZINC001042262089	1346010389	/nfs/dbraw/zinc/01/03/89/1346010389.db2.gz	FREFOZSKRWDGEK-YLJYHZDGSA-N	0	3	337.467	3.059	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3csc(C(C)C)n3)C[C@@H]21	ZINC001042265240	1346012139	/nfs/dbraw/zinc/01/21/39/1346012139.db2.gz	DSOZJHRAGIIHQX-ZBFHGGJFSA-N	0	3	333.501	3.379	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C(C)(C)c3ccccc3F)C[C@@H]21	ZINC001042268544	1346013417	/nfs/dbraw/zinc/01/34/17/1346013417.db2.gz	DFRZDBQGBMCNRD-QAPCUYQASA-N	0	3	330.447	3.212	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cccn3C3CCCC3)C[C@@H]21	ZINC001042290001	1346018849	/nfs/dbraw/zinc/01/88/49/1346018849.db2.gz	NDWDLGJAOHFHJK-XLIONFOSSA-N	0	3	339.483	3.163	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3coc(C4CCCC4)n3)C[C@@H]21	ZINC001042294626	1346020165	/nfs/dbraw/zinc/02/01/65/1346020165.db2.gz	ODJSZYZRNDSARS-YJBOKZPZSA-N	0	3	343.471	3.445	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc4sccc4c3)C[C@H]21	ZINC001042296948	1346021631	/nfs/dbraw/zinc/02/16/31/1346021631.db2.gz	JOCLAHQYWYATNA-CRAIPNDOSA-N	0	3	338.476	3.461	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cccc4ccsc43)C[C@@H]21	ZINC001042301431	1346024505	/nfs/dbraw/zinc/02/45/05/1346024505.db2.gz	HZKCQWNBSQZFIF-YJBOKZPZSA-N	0	3	338.476	3.461	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C(C)(C)c3ccc(C)cc3)C[C@@H]21	ZINC001042315768	1346030178	/nfs/dbraw/zinc/03/01/78/1346030178.db2.gz	CDHVSEUNMFBZAC-QUCCMNQESA-N	0	3	338.495	3.219	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc4c(c3)CCC=C4)C[C@H]21	ZINC001042315757	1346030239	/nfs/dbraw/zinc/03/02/39/1346030239.db2.gz	BZTBERHGSYFQGV-WIYYLYMNSA-N	0	3	334.463	3.206	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C3(c4ccc(Cl)cc4)CC3)C[C@@H]21	ZINC001042340954	1346045897	/nfs/dbraw/zinc/04/58/97/1346045897.db2.gz	JOUARSBABQGTRN-YJBOKZPZSA-N	0	3	344.886	3.480	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc4c(c3)CCCC4)C[C@@H]21	ZINC001042343789	1346046526	/nfs/dbraw/zinc/04/65/26/1346046526.db2.gz	OKKSWEREVWPDHY-RXVVDRJESA-N	0	3	336.479	3.125	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cc(C)n(C(C)C)c3C)C[C@@H]21	ZINC001042345808	1346048079	/nfs/dbraw/zinc/04/80/79/1346048079.db2.gz	NQVRMRFKDUMPHO-ICSRJNTNSA-N	0	3	341.499	3.246	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(C)n(C(C)C)c3C)C[C@@H]21	ZINC001042346579	1346048091	/nfs/dbraw/zinc/04/80/91/1346048091.db2.gz	UZWTZPUPWRKIEY-HKUYNNGSSA-N	0	3	329.488	3.408	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(OCC4CC4)cc3)C[C@@H]21	ZINC001042354796	1346052999	/nfs/dbraw/zinc/05/29/99/1346052999.db2.gz	GWLYUMTVQCCUJE-XLIONFOSSA-N	0	3	340.467	3.198	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C3(c4cc(C)cc(C)c4)CC3)C[C@H]21	ZINC001042360141	1346054231	/nfs/dbraw/zinc/05/42/31/1346054231.db2.gz	NUUVQZIXMVCABX-UYAOXDASSA-N	0	3	338.495	3.444	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cc4ccccc4n3CC)C[C@@H]21	ZINC001042367233	1346058713	/nfs/dbraw/zinc/05/87/13/1346058713.db2.gz	CURCQRMDNUUMSM-UTKZUKDTSA-N	0	3	349.478	3.221	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3cc4cc(C)ccc4o3)C[C@@H]21	ZINC001042369159	1346060332	/nfs/dbraw/zinc/06/03/32/1346060332.db2.gz	UPJOPDSGWXPJBL-AEFFLSMTSA-N	0	3	336.435	3.301	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3csc(CC(C)C)n3)C[C@@H]21	ZINC001042373374	1346061767	/nfs/dbraw/zinc/06/17/67/1346061767.db2.gz	FWQMEQKZULPTBC-RDJZCZTQSA-N	0	3	347.528	3.454	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cccc4c3OCC4(C)C)C[C@H]21	ZINC001042382634	1346066044	/nfs/dbraw/zinc/06/60/44/1346066044.db2.gz	KIZPLFKCTMUPID-CRAIPNDOSA-N	0	3	340.467	3.079	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3cc(C)no3)C[C@@H]2C)CC1	ZINC001044730899	1346414956	/nfs/dbraw/zinc/41/49/56/1346414956.db2.gz	SBMHAJZZTHCSHB-DOTOQJQBSA-N	0	3	331.460	3.199	20	30		EGEDHN
Cc1ccccc1C(=O)N1CCC[C@H]1CNCc1ccc(C#N)s1	ZINC001044905156	1346459472	/nfs/dbraw/zinc/45/94/72/1346459472.db2.gz	HGFDOLZKALBERZ-HNNXBMFYSA-N	0	3	339.464	3.323	20	30		EGEDHN
CCC(CC)C(=O)N1CCC[C@H]1CNCc1cc(C#N)ccc1OC	ZINC001044929005	1346464988	/nfs/dbraw/zinc/46/49/88/1346464988.db2.gz	MJNXYROIHGBHMR-SFHVURJKSA-N	0	3	343.471	3.084	20	30		EGEDHN
C/C(=C\C(=O)N1CCC[C@H]1CNCc1ccc(C#N)c(F)c1)C1CC1	ZINC001044943029	1346467240	/nfs/dbraw/zinc/46/72/40/1346467240.db2.gz	IQRMGYAKLJYBFU-MXHVWWQHSA-N	0	3	341.430	3.134	20	30		EGEDHN
C[C@@]1(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)s2)CC=CCC1	ZINC001045050663	1346486589	/nfs/dbraw/zinc/48/65/89/1346486589.db2.gz	DTZLHWQUBOFBKU-HNAYVOBHSA-N	0	3	343.496	3.447	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H]1CNCc1ccc(C#N)s1)C(C)(C)C	ZINC001045093058	1346493533	/nfs/dbraw/zinc/49/35/33/1346493533.db2.gz	LPKBMTYNMMKOIP-KGLIPLIRSA-N	0	3	333.501	3.383	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H]1CNCc1ccnc(Cl)c1	ZINC001045146860	1346505186	/nfs/dbraw/zinc/50/51/86/1346505186.db2.gz	HXVRXSKUXWDQBP-HNNXBMFYSA-N	0	3	335.879	3.418	20	30		EGEDHN
Cc1ccncc1C(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045396219	1346582427	/nfs/dbraw/zinc/58/24/27/1346582427.db2.gz	OEXNPQCJCZRGSP-UHFFFAOYSA-N	0	3	348.450	3.046	20	30		EGEDHN
CC(C)[C@H]1C[C@@H]1C(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045607509	1346644957	/nfs/dbraw/zinc/64/49/57/1346644957.db2.gz	XIUUXBSXBYJESD-MOPGFXCFSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)[C@H]2C[C@@H]2c2cc(F)ccc2F)CC1	ZINC001045643381	1346656914	/nfs/dbraw/zinc/65/69/14/1346656914.db2.gz	ATVNHEUCRCHPIE-ZBFHGGJFSA-N	0	3	334.410	3.225	20	30		EGEDHN
C/C(=C\C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1cccc(C#N)c1)C1CC1	ZINC001045719598	1346679497	/nfs/dbraw/zinc/67/94/97/1346679497.db2.gz	IZKYJTMIVSLSKQ-ODOLEDHDSA-N	0	3	349.478	3.480	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc(C)s1)C2	ZINC001045908097	1346744733	/nfs/dbraw/zinc/74/47/33/1346744733.db2.gz	AXVBPUWKANEXDT-IBGZPJMESA-N	0	3	330.497	3.398	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc(Cl)c[nH]1)C2	ZINC001045910877	1346748725	/nfs/dbraw/zinc/74/87/25/1346748725.db2.gz	BUGTUBMPPSTUEF-SFHVURJKSA-N	0	3	333.863	3.010	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCCC[C@]2(CCN(CC#CC)C2)C1	ZINC001045944019	1346779816	/nfs/dbraw/zinc/77/98/16/1346779816.db2.gz	VBVHEPDLMIXDDK-OAQYLSRUSA-N	0	3	339.483	3.016	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H]1C[C@H]1C(C)(C)C)C2	ZINC001045953399	1346788811	/nfs/dbraw/zinc/78/88/11/1346788811.db2.gz	YNEMPTWOGVZFKL-DBXWQHBBSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)C1(C(F)F)CCC1)C2	ZINC001045960043	1346794841	/nfs/dbraw/zinc/79/48/41/1346794841.db2.gz	DUBDESYXNJBHJB-GOSISDBHSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc3[nH]ccc3c1)C2	ZINC001045962248	1346797849	/nfs/dbraw/zinc/79/78/49/1346797849.db2.gz	FSLKEIYNCAWYCE-OAQYLSRUSA-N	0	3	335.451	3.119	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1c(F)ccc(C)c1F)C2	ZINC001045964596	1346799726	/nfs/dbraw/zinc/79/97/26/1346799726.db2.gz	LZRIRCSWLMHCBK-FQEVSTJZSA-N	0	3	346.421	3.225	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H](C)c1cccs1)C2	ZINC001045966469	1346801090	/nfs/dbraw/zinc/80/10/90/1346801090.db2.gz	XHRGMECZUMINEQ-LPHOPBHVSA-N	0	3	330.497	3.189	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc(C(C)C)cn1)C2	ZINC001045966703	1346801800	/nfs/dbraw/zinc/80/18/00/1346801800.db2.gz	DEBRMOQGULQPKV-NRFANRHFSA-N	0	3	339.483	3.156	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc(C)c(F)c1F)C2	ZINC001045968164	1346802738	/nfs/dbraw/zinc/80/27/38/1346802738.db2.gz	KWPGJRZAFVUGOK-FQEVSTJZSA-N	0	3	346.421	3.225	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc(C)cc(F)c1)C2	ZINC001045967944	1346802822	/nfs/dbraw/zinc/80/28/22/1346802822.db2.gz	FWMREDXRKCBUKW-FQEVSTJZSA-N	0	3	328.431	3.086	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)CC[C@@H]1CCCCO1)C2	ZINC001045969502	1346804814	/nfs/dbraw/zinc/80/48/14/1346804814.db2.gz	ROVBINTUOBOYQR-PZJWPPBQSA-N	0	3	346.515	3.064	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1csc(Cl)c1)C2	ZINC001045971008	1346806789	/nfs/dbraw/zinc/80/67/89/1346806789.db2.gz	KZFBVWCECMLGAJ-KRWDZBQOSA-N	0	3	336.888	3.353	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc3ccccn3c1)C2	ZINC001045971855	1346807887	/nfs/dbraw/zinc/80/78/87/1346807887.db2.gz	TWAQVBLZDNYYGB-QFIPXVFZSA-N	0	3	349.478	3.281	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)C[C@@H](C)c1ccco1)C2	ZINC001045979845	1346817524	/nfs/dbraw/zinc/81/75/24/1346817524.db2.gz	KLWWTLIBHFBJEP-XLIONFOSSA-N	0	3	328.456	3.111	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)C(C)(C)C(F)(F)F)C2	ZINC001045980938	1346818928	/nfs/dbraw/zinc/81/89/28/1346818928.db2.gz	NEOPWYWOPIKCOI-QGZVFWFLSA-N	0	3	344.421	3.303	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)CCc1ccccc1)C2	ZINC001045982479	1346821745	/nfs/dbraw/zinc/82/17/45/1346821745.db2.gz	XXXFFHJXMPIIOZ-JOCHJYFZSA-N	0	3	338.495	3.347	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@H](C)c1ccccc1C)C2	ZINC001045985653	1346827177	/nfs/dbraw/zinc/82/71/77/1346827177.db2.gz	ZCTIDYZEXFISJX-DENIHFKCSA-N	0	3	338.495	3.436	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2cc(C)nn2C(CC)CC)C1	ZINC001046436417	1346975456	/nfs/dbraw/zinc/97/54/56/1346975456.db2.gz	PILMGBGKHOHOFU-LJQANCHMSA-N	0	3	332.492	3.323	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@]2(C)CCN(Cc3ccc(C)cc3C)C2)c1	ZINC001046605290	1347036519	/nfs/dbraw/zinc/03/65/19/1347036519.db2.gz	QWTDMURPZWWVBG-QFIPXVFZSA-N	0	3	347.462	3.074	20	30		EGEDHN
C#CCCN1CC[C@@](C)(NC(=O)c2cc3cccc(Cl)c3o2)C1	ZINC001046880550	1347143069	/nfs/dbraw/zinc/14/30/69/1347143069.db2.gz	KABJRKIXEURKSY-GOSISDBHSA-N	0	3	330.815	3.304	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2ccc(C)c(F)c2)C1	ZINC001046956068	1347164528	/nfs/dbraw/zinc/16/45/28/1347164528.db2.gz	LNLOQOJSPOQLPQ-OAHLLOKOSA-N	0	3	340.389	3.397	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2occ3c2CCC3)C1	ZINC001046956963	1347164795	/nfs/dbraw/zinc/16/47/95/1347164795.db2.gz	BZJIJTGCUUSFSV-CQSZACIVSA-N	0	3	338.398	3.031	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@H](CNC(=O)C23CCC(CC2)CC3)C1	ZINC001046993304	1347176310	/nfs/dbraw/zinc/17/63/10/1347176310.db2.gz	CHISNEQAKHTPLN-UPTPFMHGSA-N	0	3	338.442	3.054	20	30		EGEDHN
CC(C)C(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1ccc(Cl)cc1)C2	ZINC001047027893	1347191555	/nfs/dbraw/zinc/19/15/55/1347191555.db2.gz	AFVKFQKTNLOBDL-WDSOQIARSA-N	0	3	344.886	3.317	20	30		EGEDHN
O=C(N[C@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1ccccc1)C2)C1(C2CC2)CC1	ZINC001047090469	1347205583	/nfs/dbraw/zinc/20/55/83/1347205583.db2.gz	BRKLNDFWVJLRFK-JBACZVJFSA-N	0	3	348.490	3.197	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)[C@@H](C)n3cccc3)C2)CC1	ZINC001047236456	1347264095	/nfs/dbraw/zinc/26/40/95/1347264095.db2.gz	JZXQNWFGXMAYKJ-UYAOXDASSA-N	0	3	341.499	3.023	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)C(C)=C3CCC3)C2)CC1	ZINC001047240058	1347266560	/nfs/dbraw/zinc/26/65/60/1347266560.db2.gz	YOSXINAOVIGWFQ-HXUWFJFHSA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3ccn(CC)c3C)C2)CC1	ZINC001047249196	1347274337	/nfs/dbraw/zinc/27/43/37/1347274337.db2.gz	SMPOWMCMUBDBFD-IBGZPJMESA-N	0	3	341.499	3.014	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)C3(C)CC=CC3)C2)CC1	ZINC001047253045	1347277372	/nfs/dbraw/zinc/27/73/72/1347277372.db2.gz	QDSOOCSSKLSVPN-LJQANCHMSA-N	0	3	328.500	3.317	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@@H]3CCC(C)(C)C3)C2)CC1	ZINC001047255164	1347279322	/nfs/dbraw/zinc/27/93/22/1347279322.db2.gz	WIULENAZDMMXCC-MOPGFXCFSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@H](C)C3CCCC3)C2)CC1	ZINC001047263084	1347284004	/nfs/dbraw/zinc/28/40/04/1347284004.db2.gz	YRPSHRUUNAUNPJ-XLIONFOSSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)C(C)(C)C(F)(F)F)C2)CC1	ZINC001047264278	1347285548	/nfs/dbraw/zinc/28/55/48/1347285548.db2.gz	NXMKHEFIRFDUBA-HNNXBMFYSA-N	0	3	344.421	3.159	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@@H]([C@@H](C)NCc2ccccc2C#N)C1	ZINC001047788297	1347371599	/nfs/dbraw/zinc/37/15/99/1347371599.db2.gz	DFMIWFPTTSVMSG-RHSMWYFYSA-N	0	3	329.419	3.148	20	30		EGEDHN
C[C@H](NCc1cc(F)ccc1C#N)[C@H]1CCN(C(=O)C2=CCCC2)C1	ZINC001047800155	1347376522	/nfs/dbraw/zinc/37/65/22/1347376522.db2.gz	OVVNXHZVTIBVFH-YOEHRIQHSA-N	0	3	341.430	3.134	20	30		EGEDHN
CC(C(=O)N1CC[C@H]([C@H](C)NCc2ccccc2C#N)C1)=C1CCC1	ZINC001047840514	1347386361	/nfs/dbraw/zinc/38/63/61/1347386361.db2.gz	KKZSKBWIFWQCAH-JXFKEZNVSA-N	0	3	337.467	3.385	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]([C@H](C)NCc2nc(C)oc2C)C1	ZINC001047924308	1347411281	/nfs/dbraw/zinc/41/12/81/1347411281.db2.gz	MXWSDIQJTPMKFT-BBRMVZONSA-N	0	3	333.476	3.220	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)C2(C)CCCC2)C1	ZINC001047925318	1347411747	/nfs/dbraw/zinc/41/17/47/1347411747.db2.gz	LTBBVZZIUHZKEJ-APWZRJJASA-N	0	3	339.483	3.465	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]([C@H](C)NCc2cc(C3CC3)no2)C1	ZINC001047933849	1347415263	/nfs/dbraw/zinc/41/52/63/1347415263.db2.gz	ZPVZSYFLEIGLJP-DZGCQCFKSA-N	0	3	331.460	3.091	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)C2(C)CCC2)C1	ZINC001047939969	1347418269	/nfs/dbraw/zinc/41/82/69/1347418269.db2.gz	KGGWQPHQBOTXKT-YJBOKZPZSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H]([C@@H](C)NCc3cnc(C)o3)C2)CC1	ZINC001047962734	1347425909	/nfs/dbraw/zinc/42/59/09/1347425909.db2.gz	NJFPDAAUUFFFEZ-PBHICJAKSA-N	0	3	331.460	3.056	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]([C@H](C)NCc3cc(C4CC4)no3)C2)C1	ZINC001047965295	1347426992	/nfs/dbraw/zinc/42/69/92/1347426992.db2.gz	LVPGAUAOUHHFTB-HOCLYGCPSA-N	0	3	343.471	3.235	20	30		EGEDHN
CCC1(C(=O)N2CC[C@H]([C@@H](C)NCc3cc(F)ccc3C#N)C2)CC1	ZINC001047969940	1347428971	/nfs/dbraw/zinc/42/89/71/1347428971.db2.gz	ICMSFTPMZOIAOS-ZBFHGGJFSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]([C@H](C)NCc3nc(C)cs3)C2)C1	ZINC001047972036	1347430137	/nfs/dbraw/zinc/43/01/37/1347430137.db2.gz	OKOHNPZQWXBBQI-GJZGRUSLSA-N	0	3	333.501	3.134	20	30		EGEDHN
C/C(=C/C(=O)N1C[C@H](C)[C@H](CNCc2ccccc2C#N)C1)C1CC1	ZINC001048166665	1347485036	/nfs/dbraw/zinc/48/50/36/1347485036.db2.gz	UQJXLACOOBYYMQ-DVRFEWIASA-N	0	3	337.467	3.099	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](CNCc2nc(C)c(C)s2)[C@H](C)C1	ZINC001048341193	1347523618	/nfs/dbraw/zinc/52/36/18/1347523618.db2.gz	YSPPWLRDSGDIKX-IUODEOHRSA-N	0	3	335.517	3.156	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H]3CN(Cc4cccc(F)c4)C[C@H]3C2)CC1	ZINC001049028313	1347710392	/nfs/dbraw/zinc/71/03/92/1347710392.db2.gz	YCFWZZKSKUHIQT-KDURUIRLSA-N	0	3	342.458	3.462	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C[C@@H](C)c3ccc(CC)cc3)C[C@@H]2C1	ZINC001049056577	1347717348	/nfs/dbraw/zinc/71/73/48/1347717348.db2.gz	RBHXQRQLNIEFFB-UIFIKXQLSA-N	0	3	338.495	3.156	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1coc2c1cccc2OC	ZINC001049475739	1347867865	/nfs/dbraw/zinc/86/78/65/1347867865.db2.gz	VPVNWJCQXLNGQC-SJORKVTESA-N	0	3	340.423	3.306	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1cncc(Cl)c1C	ZINC001049533933	1347895445	/nfs/dbraw/zinc/89/54/45/1347895445.db2.gz	XOYWFVXLBGDSKI-SJORKVTESA-N	0	3	333.863	3.298	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@H]2CCCN3C(=O)C2(C3CC3)CC2)c1	ZINC001049541331	1347898878	/nfs/dbraw/zinc/89/88/78/1347898878.db2.gz	OIENYBZWABQQRZ-UXHICEINSA-N	0	3	349.478	3.314	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cccc2ccc(C)nc21	ZINC001049542870	1347899369	/nfs/dbraw/zinc/89/93/69/1347899369.db2.gz	YPJYOXADSZDYIZ-OALUTQOASA-N	0	3	335.451	3.408	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)C1(C)CCC(F)(F)CC1	ZINC001049556879	1347907751	/nfs/dbraw/zinc/90/77/51/1347907751.db2.gz	ZWKQNNSKYVQXPO-GJZGRUSLSA-N	0	3	326.431	3.453	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(F)cc2ccoc21	ZINC001049565856	1347912790	/nfs/dbraw/zinc/91/27/90/1347912790.db2.gz	XMUWLGXILQNSJG-SJORKVTESA-N	0	3	328.387	3.437	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cccc(-n2cccc2)c1	ZINC001049577314	1347918362	/nfs/dbraw/zinc/91/83/62/1347918362.db2.gz	PBNUYMQSBUWOGD-PMACEKPBSA-N	0	3	335.451	3.342	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H]1CCc2cc(F)ccc21	ZINC001049596648	1347928553	/nfs/dbraw/zinc/92/85/53/1347928553.db2.gz	VKJWPBLNPJXING-GUDVDZBRSA-N	0	3	328.431	3.107	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)[C@]23C[C@H]2CCC3)cc1	ZINC001049602339	1347931872	/nfs/dbraw/zinc/93/18/72/1347931872.db2.gz	QXUNGNUDWBTMBO-NXLVEIQXSA-N	0	3	349.478	3.314	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1cccc(C2CC2)c1	ZINC001049612098	1347935982	/nfs/dbraw/zinc/93/59/82/1347935982.db2.gz	LZHZELRITAZTKB-RTWAWAEBSA-N	0	3	336.479	3.195	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1c(C)ccnc1OCC	ZINC001049616644	1347936543	/nfs/dbraw/zinc/93/65/43/1347936543.db2.gz	YOYFHXGJWHLBTA-DLBZAZTESA-N	0	3	343.471	3.044	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(F)c(F)cc1F	ZINC001049676610	1347968202	/nfs/dbraw/zinc/96/82/02/1347968202.db2.gz	PITRVOQZPYIMCU-SJORKVTESA-N	0	3	338.373	3.359	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1c(Cl)cncc1Cl	ZINC001049688258	1347972230	/nfs/dbraw/zinc/97/22/30/1347972230.db2.gz	TZKPVCRACUFFQY-KBPBESRZSA-N	0	3	340.254	3.253	20	30		EGEDHN
CC1(C(=O)N2CCC[C@@H]3[C@H]2CCN3Cc2ccc(C#N)cc2)CC=CC1	ZINC001049690875	1347973812	/nfs/dbraw/zinc/97/38/12/1347973812.db2.gz	RTGSJYYJGFFKMJ-WOJBJXKFSA-N	0	3	349.478	3.480	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C[C@@H](C)c1cccc(F)c1	ZINC001049708130	1347984715	/nfs/dbraw/zinc/98/47/15/1347984715.db2.gz	OOHZLKNOJZPMPE-NSISKUIASA-N	0	3	342.458	3.408	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@H]2CCCN3C(=O)C2CC3(CC3)C2)cc1	ZINC001049711185	1347986197	/nfs/dbraw/zinc/98/61/97/1347986197.db2.gz	RQBIIPWCFUKDLT-UXHICEINSA-N	0	3	349.478	3.314	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)C(C)(C)c1cccc(F)c1	ZINC001049716558	1347989200	/nfs/dbraw/zinc/98/92/00/1347989200.db2.gz	FLGKRPUQKDVNQR-ROUUACIJSA-N	0	3	330.447	3.355	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ncsc1C1CC1	ZINC001049724775	1347991661	/nfs/dbraw/zinc/99/16/61/1347991661.db2.gz	TZAIZSDFMNZHAG-LSDHHAIUSA-N	0	3	331.485	3.276	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(F)c(F)c(F)c1	ZINC001049743603	1347996615	/nfs/dbraw/zinc/99/66/15/1347996615.db2.gz	QOGWDPJHLMIYQI-HZPDHXFCSA-N	0	3	338.373	3.359	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)[C@H]2CC23CCC3)c1	ZINC001049750934	1348000257	/nfs/dbraw/zinc/00/02/57/1348000257.db2.gz	AHVNTAPFIAAMNL-VAMGGRTRSA-N	0	3	349.478	3.314	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1noc2c1CCCCC2	ZINC001049759761	1348005296	/nfs/dbraw/zinc/00/52/96/1348005296.db2.gz	RVLLJKIIADZLCO-DLBZAZTESA-N	0	3	343.471	3.199	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](CC)Cc1ccccc1	ZINC001049763990	1348008576	/nfs/dbraw/zinc/00/85/76/1348008576.db2.gz	STEFJRGJGBARQQ-PWRODBHTSA-N	0	3	338.495	3.344	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1cnc(C(C)C)nc1C	ZINC001049768765	1348012372	/nfs/dbraw/zinc/01/23/72/1348012372.db2.gz	DPBRJXAMQNMVTR-MSOLQXFVSA-N	0	3	342.487	3.163	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cn1cc(C)c2ccccc21	ZINC001049777732	1348016559	/nfs/dbraw/zinc/01/65/59/1348016559.db2.gz	RMVRDEYVHCKCPF-UXHICEINSA-N	0	3	337.467	3.201	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccccc1OC	ZINC001049778852	1348017257	/nfs/dbraw/zinc/01/72/57/1348017257.db2.gz	ZFRMUZWOXOLBOS-WJFTUGDTSA-N	0	3	340.467	3.050	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cccc(F)c1OCC	ZINC001049817203	1348035351	/nfs/dbraw/zinc/03/53/51/1348035351.db2.gz	XHEZFSRSFBETPZ-ROUUACIJSA-N	0	3	346.446	3.479	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@](C)(OC)c1ccccc1	ZINC001049846608	1348055848	/nfs/dbraw/zinc/05/58/48/1348055848.db2.gz	KMPOFQOWGSULNP-ZVDOUQERSA-N	0	3	342.483	3.190	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)C12CC3CC(CC(C3)C1)C2	ZINC001049856676	1348063592	/nfs/dbraw/zinc/06/35/92/1348063592.db2.gz	GRNIFOUBEFCEKW-YWPYOKSTSA-N	0	3	328.500	3.454	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@]1(c2ccccc2)C[C@H](F)C1	ZINC001049874929	1348079951	/nfs/dbraw/zinc/07/99/51/1348079951.db2.gz	IGOZCJLYBZILQP-ANTGDGSKSA-N	0	3	342.458	3.308	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2cncc(-c3ccccc3)c2)C1	ZINC001079806448	1357387925	/nfs/dbraw/zinc/38/79/25/1357387925.db2.gz	HGYZUVCUBANTQK-OXQOHEQNSA-N	0	3	335.451	3.375	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](C)Oc1cccc(C)c1	ZINC001049881933	1348087488	/nfs/dbraw/zinc/08/74/88/1348087488.db2.gz	UIOFOZFKFUKATL-QXAKKESOSA-N	0	3	328.456	3.014	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(OC)c(Cl)c1	ZINC001049888744	1348092952	/nfs/dbraw/zinc/09/29/52/1348092952.db2.gz	KBEBRIVXRDRPHI-HOTGVXAUSA-N	0	3	334.847	3.214	20	30		EGEDHN
Cc1c[nH]cc1C(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1cccc(C#N)c1	ZINC001049890414	1348095347	/nfs/dbraw/zinc/09/53/47/1348095347.db2.gz	MWHUWXJTODOZFD-WOJBJXKFSA-N	0	3	348.450	3.074	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C[C@@H](C)c1ccc(F)cc1	ZINC001049907222	1348104922	/nfs/dbraw/zinc/10/49/22/1348104922.db2.gz	BOKZPZSXZOZXLQ-ATZDWAIDSA-N	0	3	328.431	3.018	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](C)Cc1ccc(OC)cc1	ZINC001049910913	1348107007	/nfs/dbraw/zinc/10/70/07/1348107007.db2.gz	WOWGQNWZXAKSGB-NSISKUIASA-N	0	3	342.483	3.125	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](F)Cc1ccccc1	ZINC001049912585	1348108085	/nfs/dbraw/zinc/10/80/85/1348108085.db2.gz	MTNWADQSPLBSTE-GUDVDZBRSA-N	0	3	330.447	3.209	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1	ZINC001049924700	1348116020	/nfs/dbraw/zinc/11/60/20/1348116020.db2.gz	SZRBRXPPZPJRPS-MANSERQUSA-N	0	3	328.431	3.181	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1csc(C2CC2)n1	ZINC001049928452	1348118732	/nfs/dbraw/zinc/11/87/32/1348118732.db2.gz	SGXUJRLFKFFFOL-HZPDHXFCSA-N	0	3	331.485	3.276	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cccnc1OC(C)C	ZINC001049936750	1348122003	/nfs/dbraw/zinc/12/20/03/1348122003.db2.gz	XMYODYDLZOUPRW-ROUUACIJSA-N	0	3	343.471	3.124	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1c[nH]c2ccc(F)cc12	ZINC001049937288	1348122758	/nfs/dbraw/zinc/12/27/58/1348122758.db2.gz	RKDYPKDZRSDYCL-RTBURBONSA-N	0	3	339.414	3.009	20	30		EGEDHN
C/C(=C\C(=O)N1CCC[C@H]2CN(Cc3cccc(C#N)c3)C[C@H]21)C1CC1	ZINC001049983763	1348144444	/nfs/dbraw/zinc/14/44/44/1348144444.db2.gz	OMRXLYVRJBLRRW-TUFRZFPLSA-N	0	3	349.478	3.337	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC[C@H]2CN(Cc3ccc(C(F)F)cc3)C[C@H]21	ZINC001049998155	1348148240	/nfs/dbraw/zinc/14/82/40/1348148240.db2.gz	CSJJDOYPYVPJSF-RRQGHBQHSA-N	0	3	347.409	3.207	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@H]2CN(C/C=C\c3ccccc3)C[C@H]21	ZINC001050044697	1348164157	/nfs/dbraw/zinc/16/41/57/1348164157.db2.gz	MTKWVMVDWHNCLV-FDCFBMCSSA-N	0	3	334.463	3.036	20	30		EGEDHN
C[C@H](c1ccc(F)cc1)N1C[C@@H]2CCCN(C(=O)C#CC3CC3)[C@@H]2C1	ZINC001050045861	1348164813	/nfs/dbraw/zinc/16/48/13/1348164813.db2.gz	MTUYZGWNUQSDRI-MOXGXCLJSA-N	0	3	340.442	3.223	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)[C@@H](CC)OC3CCCCC3)[C@@H]2C1	ZINC001050047743	1348165132	/nfs/dbraw/zinc/16/51/32/1348165132.db2.gz	PLJMRAHLUGVHGC-QXAKKESOSA-N	0	3	334.504	3.223	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)CCc3cccc(Cl)c3)[C@@H]2C1	ZINC001050103806	1348184216	/nfs/dbraw/zinc/18/42/16/1348184216.db2.gz	CEVIMEHNRAJJOJ-PKOBYXMFSA-N	0	3	344.886	3.219	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)[C@H](CC)Oc3ccccc3C)[C@@H]2C1	ZINC001050152206	1348197248	/nfs/dbraw/zinc/19/72/48/1348197248.db2.gz	CUQBLNPZGNSECY-OTWHNJEPSA-N	0	3	342.483	3.261	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)[C@@H]3C[C@H]3c3ccc(C)s3)[C@@H]2C1	ZINC001050160433	1348199603	/nfs/dbraw/zinc/19/96/03/1348199603.db2.gz	BOCQPELKGASUGG-BSDSXHPESA-N	0	3	342.508	3.106	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)[C@@H](C)c3ccc(CC)cc3)[C@@H]2C1	ZINC001050164882	1348201406	/nfs/dbraw/zinc/20/14/06/1348201406.db2.gz	NODZJKWYRMWQGQ-DZFGPLHGSA-N	0	3	338.495	3.299	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)C[C@H](C)c3ccccc3OC)[C@@H]2C1	ZINC001050184189	1348205086	/nfs/dbraw/zinc/20/50/86/1348205086.db2.gz	OEHWRVNKITVBDY-JENIJYKNSA-N	0	3	342.483	3.298	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)C4CCCC4)C3)CC2)c1	ZINC001050403992	1348253075	/nfs/dbraw/zinc/25/30/75/1348253075.db2.gz	FLKMJMOEYCVCPN-UHFFFAOYSA-N	0	3	337.467	3.173	20	30		EGEDHN
CC1CC(C(=O)N2CC3(C2)CCN(Cc2cccc(C#N)c2)CC3)C1	ZINC001050481380	1348276447	/nfs/dbraw/zinc/27/64/47/1348276447.db2.gz	LKLXRUOJIVBGFB-UHFFFAOYSA-N	0	3	337.467	3.029	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@@H]3CCC[C@H]3c3ccccc3)C2)CC1	ZINC001050587229	1348294599	/nfs/dbraw/zinc/29/45/99/1348294599.db2.gz	IANXBWCBBVFYDQ-VQTJNVASSA-N	0	3	336.479	3.128	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC2(C1)CCN(Cc1c(C)noc1C)CC2	ZINC001050613752	1348302861	/nfs/dbraw/zinc/30/28/61/1348302861.db2.gz	AHLUKVWWXCBBFC-UHFFFAOYSA-N	0	3	345.487	3.318	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cc4occc4s3)C2)CC1	ZINC001050663289	1348321393	/nfs/dbraw/zinc/32/13/93/1348321393.db2.gz	ORIQOAPOLCIXKP-UHFFFAOYSA-N	0	3	328.437	3.056	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3cc4cc(C)c(C)cc4o3)C2)CC1	ZINC001050731629	1348340049	/nfs/dbraw/zinc/34/00/49/1348340049.db2.gz	KLVBDUHSIOHVTR-UHFFFAOYSA-N	0	3	336.435	3.221	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cccc(C(F)F)c3)C2)CC1	ZINC001050732914	1348341163	/nfs/dbraw/zinc/34/11/63/1348341163.db2.gz	MQNSGSWYGSOAPU-UHFFFAOYSA-N	0	3	332.394	3.186	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc(CC(C)C)cc3)C2)CC1	ZINC001050751365	1348348321	/nfs/dbraw/zinc/34/83/21/1348348321.db2.gz	AIBVHUBLGRKUAU-UHFFFAOYSA-N	0	3	338.495	3.446	20	30		EGEDHN
C=C(C)CCN1CCN([C@@H]2CCN(C(=O)C3=CCCCCC3)C2)CC1	ZINC001052017805	1348497039	/nfs/dbraw/zinc/49/70/39/1348497039.db2.gz	VLAPNGWITWNXAM-HXUWFJFHSA-N	0	3	345.531	3.062	20	30		EGEDHN
C[C@@H](C(=O)N[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1)C1CCC1	ZINC001052484733	1348553070	/nfs/dbraw/zinc/55/30/70/1348553070.db2.gz	RYJRFZUJUFWDAU-OXQOHEQNSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2coc3cc(F)ccc23)CC1	ZINC001052511686	1348563077	/nfs/dbraw/zinc/56/30/77/1348563077.db2.gz	DBXWYSBBLHGMDP-HNNXBMFYSA-N	0	3	328.387	3.180	20	30		EGEDHN
CC(C)(C(=O)N[C@H]1CCCN(Cc2ccc(C#N)cc2)CC1)C1CC1	ZINC001052638140	1348606978	/nfs/dbraw/zinc/60/69/78/1348606978.db2.gz	SONIYRGCTDYEIV-IBGZPJMESA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)Cc2c[nH]c3c2cccc3C)CC1	ZINC001052766097	1348670788	/nfs/dbraw/zinc/67/07/88/1348670788.db2.gz	SDMWGRSLQWXBTJ-SFHVURJKSA-N	0	3	337.467	3.013	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cc(C(CC)CC)no2)CC1	ZINC001052772658	1348673452	/nfs/dbraw/zinc/67/34/52/1348673452.db2.gz	BRVYEFAEZWDJQU-MRXNPFEDSA-N	0	3	331.460	3.186	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc3nc(C)ccc3c2)CC1	ZINC001052811936	1348687412	/nfs/dbraw/zinc/68/74/12/1348687412.db2.gz	VCUBRXMMVZADNV-LJQANCHMSA-N	0	3	335.451	3.151	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2[nH]c3ccc(C)cc3c2C)CC1	ZINC001052836227	1348695133	/nfs/dbraw/zinc/69/51/33/1348695133.db2.gz	GVONYXHAJMJEKR-KRWDZBQOSA-N	0	3	337.467	3.392	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc(O[C@H](C)CC)cc2)CC1	ZINC001052849060	1348700722	/nfs/dbraw/zinc/70/07/22/1348700722.db2.gz	LFIRRCPMGLSGTK-MJGOQNOKSA-N	0	3	342.483	3.472	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)C2(c3ccc(Cl)cc3)CC2)CC1	ZINC001052916735	1348747028	/nfs/dbraw/zinc/74/70/28/1348747028.db2.gz	ULRCEYDABVTFSY-SFHVURJKSA-N	0	3	344.886	3.366	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc(CC(C)C)cc2)CC1	ZINC001052924348	1348750267	/nfs/dbraw/zinc/75/02/67/1348750267.db2.gz	ZVIJCBWOWGOJIU-HXUWFJFHSA-N	0	3	326.484	3.493	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cc3cccc(F)c3o2)CC1	ZINC001052948041	1348764576	/nfs/dbraw/zinc/76/45/76/1348764576.db2.gz	XGDYAUDKAGPKHG-HNNXBMFYSA-N	0	3	328.387	3.180	20	30		EGEDHN
CC(=O)N1CCC[C@H]([C@@H]2CCCN(Cc3ccc(C#N)c(F)c3)C2)C1	ZINC001052998334	1348795236	/nfs/dbraw/zinc/79/52/36/1348795236.db2.gz	XTJLVMBAACFAMF-MOPGFXCFSA-N	0	3	343.446	3.168	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)Cc2cccs2)C1	ZINC001053060120	1348869355	/nfs/dbraw/zinc/86/93/55/1348869355.db2.gz	CZCYNORIDHSICE-IEBWSBKVSA-N	0	3	344.524	3.407	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccc(C)n2C)C1	ZINC001053070277	1348885121	/nfs/dbraw/zinc/88/51/21/1348885121.db2.gz	WJSOWVZRGUTVGM-RBUKOAKNSA-N	0	3	341.499	3.064	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(CC)o2)C1	ZINC001053087707	1348912320	/nfs/dbraw/zinc/91/23/20/1348912320.db2.gz	NKIAYFIAGHXNHK-WMZOPIPTSA-N	0	3	328.456	3.182	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)CCc2ccsc2)C1	ZINC001053088683	1348914365	/nfs/dbraw/zinc/91/43/65/1348914365.db2.gz	ZECZHWOKSUMCCT-RTBURBONSA-N	0	3	344.524	3.407	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(F)c(C)c2)C1	ZINC001053091471	1348917241	/nfs/dbraw/zinc/91/72/41/1348917241.db2.gz	AKLIBGOJNMYRDN-QUCCMNQESA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccc(F)c(C)c2)C1	ZINC001053091469	1348917441	/nfs/dbraw/zinc/91/74/41/1348917441.db2.gz	AKLIBGOJNMYRDN-AZUAARDMSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(Cl)cn2C)C1	ZINC001053092485	1348919197	/nfs/dbraw/zinc/91/91/97/1348919197.db2.gz	RTDVYAHRHHVHRB-WBVHZDCISA-N	0	3	347.890	3.018	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)C2CCC(=C)CC2)C1	ZINC001053093939	1348923079	/nfs/dbraw/zinc/92/30/79/1348923079.db2.gz	AYWZQTWUNXHPRJ-VQTJNVASSA-N	0	3	328.500	3.459	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2occc2Cl)C1	ZINC001053096915	1348927432	/nfs/dbraw/zinc/92/74/32/1348927432.db2.gz	BFABDFPRSMDYOO-ZBFHGGJFSA-N	0	3	334.847	3.273	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)CC(C)(F)F)C1	ZINC001053097595	1348927798	/nfs/dbraw/zinc/92/77/98/1348927798.db2.gz	HFPYZMCMACXEHB-JKSUJKDBSA-N	0	3	326.431	3.148	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(F)cc2C)C1	ZINC001053105301	1348941876	/nfs/dbraw/zinc/94/18/76/1348941876.db2.gz	TYGMIXMTDSDTRL-XLIONFOSSA-N	0	3	342.458	3.474	20	30		EGEDHN
C=C(C)CCN1Cc2ccccc2C[C@@H]1CNC(=O)[C@H]1C[C@@H]1C(F)F	ZINC001054041500	1349136556	/nfs/dbraw/zinc/13/65/56/1349136556.db2.gz	MWMRVJDHFWRRTL-SQNIBIBYSA-N	0	3	348.437	3.397	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc3c(o1)CCCC3)C2	ZINC001054143685	1349154088	/nfs/dbraw/zinc/15/40/88/1349154088.db2.gz	HVECNOPXWIQOCQ-NRFANRHFSA-N	0	3	340.467	3.110	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc(F)c(C)cc1F)C2	ZINC001054148432	1349154831	/nfs/dbraw/zinc/15/48/31/1349154831.db2.gz	NYFVPEBIUAOMLP-HXUWFJFHSA-N	0	3	346.421	3.225	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@H]1CCCc3ccccc31)C2	ZINC001054153370	1349156546	/nfs/dbraw/zinc/15/65/46/1349156546.db2.gz	PWJJBWDZDZABAT-RBBKRZOGSA-N	0	3	336.479	3.054	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1cccc(-n3cccc3)c1)C2	ZINC001054160048	1349161833	/nfs/dbraw/zinc/16/18/33/1349161833.db2.gz	UCRBHEAACXVLIB-QFIPXVFZSA-N	0	3	347.462	3.039	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@@H]2CN(CC=C(C)C)C[C@H]2C)cc1	ZINC001079977816	1357447133	/nfs/dbraw/zinc/44/71/33/1357447133.db2.gz	KTGLQCVSPSJPQK-VQIMIIECSA-N	0	3	328.456	3.268	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc(C)ccc1C1CC1)C2	ZINC001054171298	1349173144	/nfs/dbraw/zinc/17/31/44/1349173144.db2.gz	NYIQBZJIKPYZAA-QFIPXVFZSA-N	0	3	336.479	3.434	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1occc1C(C)C)C2	ZINC001054184043	1349186895	/nfs/dbraw/zinc/18/68/95/1349186895.db2.gz	WKVWQWSGHLLNLW-FQEVSTJZSA-N	0	3	328.456	3.354	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1c(F)ccc(C)c1F)C2	ZINC001054189387	1349191691	/nfs/dbraw/zinc/19/16/91/1349191691.db2.gz	INHKBTMMEGCSLP-HXUWFJFHSA-N	0	3	346.421	3.225	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H](C)c1ccc(C)s1)C2	ZINC001054227111	1349220882	/nfs/dbraw/zinc/22/08/82/1349220882.db2.gz	IEWCGQLMVGDMIT-PXNSSMCTSA-N	0	3	344.524	3.498	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc3ccccc3o1)C2	ZINC001054236156	1349228253	/nfs/dbraw/zinc/22/82/53/1349228253.db2.gz	HRNCBWODWHFGJY-NRFANRHFSA-N	0	3	336.435	3.384	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(OC(C)C)cc1)C2	ZINC001054236425	1349229406	/nfs/dbraw/zinc/22/94/06/1349229406.db2.gz	KLESOEISVVNMJP-NRFANRHFSA-N	0	3	340.467	3.035	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cccn1C(C)C)C2	ZINC001054243177	1349236519	/nfs/dbraw/zinc/23/65/19/1349236519.db2.gz	YCNXSWGILSIMSV-FQEVSTJZSA-N	0	3	327.472	3.020	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)CC(C1CC1)C1CC1)C2	ZINC001054246051	1349240063	/nfs/dbraw/zinc/24/00/63/1349240063.db2.gz	LSJFDLYTJANLFA-NRFANRHFSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1coc3ccccc13)C2	ZINC001054248217	1349243486	/nfs/dbraw/zinc/24/34/86/1349243486.db2.gz	ODWRUFYLPVACMO-NRFANRHFSA-N	0	3	336.435	3.384	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@H]3CCCO[C@H]3C)cc2C1	ZINC001054262301	1349259618	/nfs/dbraw/zinc/25/96/18/1349259618.db2.gz	URKVIVAIXFOLCS-KXBFYZLASA-N	0	3	328.456	3.010	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@@H]3CCCO[C@H]3C)cc2C1	ZINC001054262202	1349260057	/nfs/dbraw/zinc/26/00/57/1349260057.db2.gz	OOABTKBHMGFIJS-OXJNMPFZSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3ccn4cncc4c3)cc2C1	ZINC001054272724	1349271988	/nfs/dbraw/zinc/27/19/88/1349271988.db2.gz	ADQFBYAUYHTGQV-UHFFFAOYSA-N	0	3	346.434	3.156	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3ncc4ccccn43)cc2C1	ZINC001054273860	1349273685	/nfs/dbraw/zinc/27/36/85/1349273685.db2.gz	FGRVEEFAFMWNMN-UHFFFAOYSA-N	0	3	346.434	3.156	20	30		EGEDHN
C#Cc1cncc(C(=O)NCc2ccc3c(c2)CN(CCC(C)C)C3)c1	ZINC001054281363	1349282227	/nfs/dbraw/zinc/28/22/27/1349282227.db2.gz	JPKOAOJOZNBQJO-UHFFFAOYSA-N	0	3	347.462	3.355	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cc(C(C)C)n[nH]3)cc2C1	ZINC001054282223	1349283250	/nfs/dbraw/zinc/28/32/50/1349283250.db2.gz	WJNZPIWZCXAASW-UHFFFAOYSA-N	0	3	338.455	3.355	20	30		EGEDHN
C#Cc1ccc(C(=O)NCc2ccc3c(c2)CN(CCC2CC2)C3)cn1	ZINC001054290692	1349294896	/nfs/dbraw/zinc/29/48/96/1349294896.db2.gz	TYRDLSHMDWDGSA-UHFFFAOYSA-N	0	3	345.446	3.109	20	30		EGEDHN
C[C@H]1CN(C(=O)c2ccsc2)C[C@H]1NCc1ccc(C#N)c(F)c1	ZINC001054366436	1349337022	/nfs/dbraw/zinc/33/70/22/1349337022.db2.gz	LOYUTUNGOMYWBI-YVEFUNNKSA-N	0	3	343.427	3.009	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2cc(C)n(C(CC)CC)n2)C1	ZINC001080009761	1357458649	/nfs/dbraw/zinc/45/86/49/1357458649.db2.gz	RIAZWMRSIFYUPU-RDTXWAMCSA-N	0	3	332.492	3.179	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@H](NCc2cnn(C(C)(C)C)c2)C1	ZINC001054971842	1349532948	/nfs/dbraw/zinc/53/29/48/1349532948.db2.gz	VCUZRUAIXOFKDH-NVXWUHKLSA-N	0	3	346.519	3.177	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)[C@H](NCc2cccc(C(C)C)n2)C1	ZINC001054975999	1349534139	/nfs/dbraw/zinc/53/41/39/1349534139.db2.gz	HRNILGSEEMJEOA-CRAIPNDOSA-N	0	3	329.488	3.354	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H](C)[C@H](NCc2ccccc2OC2CC2)C1	ZINC001054976888	1349534839	/nfs/dbraw/zinc/53/48/39/1349534839.db2.gz	QLMDZJJFTYAUHC-MAUKXSAKSA-N	0	3	342.483	3.377	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@H]2CCc3c2cccc3Cl)C1	ZINC001080142475	1357499584	/nfs/dbraw/zinc/49/95/84/1357499584.db2.gz	WFUYKUYZMHSSLN-RPVQJOFSSA-N	0	3	332.875	3.382	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2cc(F)c(Cl)cc2F)C1	ZINC001080359576	1357584270	/nfs/dbraw/zinc/58/42/70/1357584270.db2.gz	SDIVODIEJDVAHX-MEBBXXQBSA-N	0	3	328.790	3.244	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)CC(C)(C)C1CC1)C[C@@H](C)O2	ZINC001071164052	1354483126	/nfs/dbraw/zinc/48/31/26/1354483126.db2.gz	GVYXQPQXTFAWEL-UZLBHIALSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1ccc(C)c(F)c1)C[C@H](C)O2	ZINC001071185792	1354491707	/nfs/dbraw/zinc/49/17/07/1354491707.db2.gz	LYHRAZZELWPRNK-OXJNMPFZSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1cccc(Cl)c1)C[C@H](C)O2	ZINC001071232700	1354515765	/nfs/dbraw/zinc/51/57/65/1354515765.db2.gz	AIQVYONTYHJGBD-KXBFYZLASA-N	0	3	348.874	3.222	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1ccccc1Cl)C[C@H](C)O2	ZINC001071234098	1354518063	/nfs/dbraw/zinc/51/80/63/1354518063.db2.gz	TXPHHEYUVUNMTM-HNAYVOBHSA-N	0	3	348.874	3.222	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1cc(C)c(C)s1)C[C@@H](C)O2	ZINC001071238432	1354521655	/nfs/dbraw/zinc/52/16/55/1354521655.db2.gz	MMSRVOOAZWCILF-BEFAXECRSA-N	0	3	348.512	3.246	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1ccoc1C(C)C)C[C@@H](C)O2	ZINC001071245577	1354525959	/nfs/dbraw/zinc/52/59/59/1354525959.db2.gz	GEKLDPHMOUXTDI-UZLBHIALSA-N	0	3	346.471	3.285	20	30		EGEDHN
CC(C)CC1(C(=O)N2CC[C@@H](NCc3ccc(F)c(C#N)c3)C2)CC1	ZINC001183160991	1387269877	/nfs/dbraw/zinc/26/98/77/1387269877.db2.gz	ALEOBTQZPPCDNE-QGZVFWFLSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2ccc3c(c2)CCCO3)CC[C@@H]1C	ZINC001071589476	1354780884	/nfs/dbraw/zinc/78/08/84/1354780884.db2.gz	VGLHDKPQSPEWSY-LPHOPBHVSA-N	0	3	342.483	3.099	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(OC)c(OC)c2C)CC[C@@H]1C	ZINC001071597421	1354785723	/nfs/dbraw/zinc/78/57/23/1354785723.db2.gz	JALJKWMEWGRUJX-HOCLYGCPSA-N	0	3	346.471	3.171	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cccc3ccc(C)nc32)CC[C@H]1C	ZINC001071599985	1354787983	/nfs/dbraw/zinc/78/79/83/1354787983.db2.gz	CPRRVURZGZTIMP-AEFFLSMTSA-N	0	3	335.451	3.149	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccccc2-c2ccncc2)CC[C@H]1C	ZINC001071607644	1354792671	/nfs/dbraw/zinc/79/26/71/1354792671.db2.gz	RAGQVDNYXIPSMH-IEBWSBKVSA-N	0	3	347.462	3.355	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(OC)c(C(C)C)c2)CC[C@H]1C	ZINC001071653377	1354828712	/nfs/dbraw/zinc/82/87/12/1354828712.db2.gz	XKHQGWPWDKUWKZ-SJLPKXTDSA-N	0	3	342.483	3.425	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cn(C)c3ccccc23)CC[C@H]1C	ZINC001071657593	1354830480	/nfs/dbraw/zinc/83/04/80/1354830480.db2.gz	AIBJWLZMXCQSMO-HZPDHXFCSA-N	0	3	325.456	3.337	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2c(C)occ2C(F)(F)F)CC[C@H]1C	ZINC001071689164	1354852169	/nfs/dbraw/zinc/85/21/69/1354852169.db2.gz	GTJUNAQPBGOCPC-DGCLKSJQSA-N	0	3	342.361	3.213	20	30		EGEDHN
CC(C)CC1(C(=O)N2CC[C@@H](NCc3ccc(C#N)s3)C2)CC1	ZINC001183162981	1387270707	/nfs/dbraw/zinc/27/07/07/1387270707.db2.gz	UBALPLUISXIWEY-CQSZACIVSA-N	0	3	331.485	3.137	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc3cc(OC)ccc3[nH]2)CC[C@@H]1C	ZINC001071779029	1354926503	/nfs/dbraw/zinc/92/65/03/1354926503.db2.gz	DHZATCLBTZYKTQ-HOCLYGCPSA-N	0	3	341.455	3.335	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(C(C)C)nc2CC)CC[C@H]1C	ZINC001071828076	1354965509	/nfs/dbraw/zinc/96/55/09/1354965509.db2.gz	IPTYUEBUPCUPQR-IAGOWNOFSA-N	0	3	341.499	3.373	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)Cc2c[nH]c3c2cccc3C)CC[C@H]1C	ZINC001071873318	1354997928	/nfs/dbraw/zinc/99/79/28/1354997928.db2.gz	UQVCEJUWWXUZOG-WBVHZDCISA-N	0	3	325.456	3.174	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ncoc2-c2cccs2)CC[C@@H]1C	ZINC001071908241	1355019407	/nfs/dbraw/zinc/01/94/07/1355019407.db2.gz	PWHXZJQKKVXBJT-UONOGXRCSA-N	0	3	343.452	3.009	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CC[C@H](C)N(CC3=CCCCC3)C2)nc1	ZINC001072000641	1355066581	/nfs/dbraw/zinc/06/65/81/1355066581.db2.gz	XWUACDVCXMFTMY-QFBILLFUSA-N	0	3	337.467	3.146	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2ccc(OCC)cc2)CC[C@H]1C	ZINC001072049254	1355103772	/nfs/dbraw/zinc/10/37/72/1355103772.db2.gz	OLFMHQZAJXIGEL-AEFFLSMTSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(OCC3CC3)nc2)CC[C@@H]1C	ZINC001072098700	1355128524	/nfs/dbraw/zinc/12/85/24/1355128524.db2.gz	FAEVQUZLHUCNOM-MAUKXSAKSA-N	0	3	343.471	3.029	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2c[nH]c3ccc(F)cc23)CC[C@H]1C	ZINC001072119808	1355141104	/nfs/dbraw/zinc/14/11/04/1355141104.db2.gz	JZNNCMVARYNYPB-HIFRSBDPSA-N	0	3	329.419	3.466	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2c[nH]c3ccc(F)cc23)CC[C@H]1C	ZINC001072119809	1355141559	/nfs/dbraw/zinc/14/15/59/1355141559.db2.gz	JZNNCMVARYNYPB-UKRRQHHQSA-N	0	3	329.419	3.466	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc(NC(C)=O)ccc2C)CC[C@@H]1C	ZINC001072120702	1355142413	/nfs/dbraw/zinc/14/24/13/1355142413.db2.gz	XWFRJULTAFJKAC-YJBOKZPZSA-N	0	3	343.471	3.112	20	30		EGEDHN
C[C@@H]1CCN(C(=O)c2ccco2)C[C@H]1CNCc1ccccc1C#N	ZINC001072167373	1355163140	/nfs/dbraw/zinc/16/31/40/1355163140.db2.gz	PPFCAUPWFVAMNF-CRAIPNDOSA-N	0	3	337.423	3.039	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@@H](C)[C@H](CNCc2ccccc2C#N)C1	ZINC001072170128	1355165094	/nfs/dbraw/zinc/16/50/94/1355165094.db2.gz	CBNGPOBEHMYUDF-VQIMIIECSA-N	0	3	327.472	3.179	20	30		EGEDHN
C[C@H]1CCN(C(=O)C2=CCCC2)C[C@@H]1CNCc1ccccc1C#N	ZINC001072248405	1355206582	/nfs/dbraw/zinc/20/65/82/1355206582.db2.gz	QBDKTLIDKFKKNT-JXFKEZNVSA-N	0	3	337.467	3.243	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](C)[C@@H](CNCc2ncc(C)s2)C1	ZINC001072334988	1355244698	/nfs/dbraw/zinc/24/46/98/1355244698.db2.gz	KMZYXIQBNBAMRO-ZFWWWQNUSA-N	0	3	335.517	3.238	20	30		EGEDHN
C[C@H]1CCN(C(=O)C2(C)CCC2)C[C@@H]1CNCc1ccccc1C#N	ZINC001072338583	1355246233	/nfs/dbraw/zinc/24/62/33/1355246233.db2.gz	DMOGIULRVRZLTO-LPHOPBHVSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](C)[C@H](CNCc2ccccc2C#N)C1	ZINC001072338525	1355246310	/nfs/dbraw/zinc/24/63/10/1355246310.db2.gz	CMSHTZOHWJZTJD-VQIMIIECSA-N	0	3	339.483	3.345	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](C)[C@H](CNCc2ccccc2C#N)C1	ZINC001072338524	1355246353	/nfs/dbraw/zinc/24/63/53/1355246353.db2.gz	CMSHTZOHWJZTJD-QFBILLFUSA-N	0	3	339.483	3.345	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC2(C1)CCN(C/C=C/c1ccc(Cl)cc1)C2	ZINC001072551488	1355329974	/nfs/dbraw/zinc/32/99/74/1355329974.db2.gz	GBPMFHRMIRMYPG-FAAWYNLUSA-N	0	3	343.858	3.047	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)C[C@H]4C=CCCC4)C3)C2)c1	ZINC001072846246	1355462516	/nfs/dbraw/zinc/46/25/16/1355462516.db2.gz	PQGIIBWPDDYVKI-SFHVURJKSA-N	0	3	349.478	3.339	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3[nH]c4ccccc4c3Cl)C2)C1	ZINC001072894860	1355487291	/nfs/dbraw/zinc/48/72/91/1355487291.db2.gz	MAPPFVSBXFTSPO-UHFFFAOYSA-N	0	3	329.831	3.155	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001072944739	1355512455	/nfs/dbraw/zinc/51/24/55/1355512455.db2.gz	KEERPGFKCGEIIB-FQEVSTJZSA-N	0	3	337.467	3.195	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)Cc3ccc(C(C)(C)C)cc3)C2)C1	ZINC001073016452	1355549095	/nfs/dbraw/zinc/54/90/95/1355549095.db2.gz	ZJENIYHUAVTWTC-UHFFFAOYSA-N	0	3	326.484	3.247	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CN(C(=O)[C@H]4CC45CCCC5)C3)C2)cc1	ZINC001073102457	1355597446	/nfs/dbraw/zinc/59/74/46/1355597446.db2.gz	BBMQULKZHWXNLW-LJQANCHMSA-N	0	3	349.478	3.173	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H]3CCCCc4ccccc43)C2)C1	ZINC001073470125	1355803588	/nfs/dbraw/zinc/80/35/88/1355803588.db2.gz	ZNIPNQRMOGNNQR-FQEVSTJZSA-N	0	3	336.479	3.054	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3cscc3C(F)(F)F)C2)C1	ZINC001073493688	1355821845	/nfs/dbraw/zinc/82/18/45/1355821845.db2.gz	FHCQPWXOXAXWAL-UHFFFAOYSA-N	0	3	330.375	3.101	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCCN1C(=O)c1ccco1	ZINC001073931626	1355966273	/nfs/dbraw/zinc/96/62/73/1355966273.db2.gz	JCIJBBXLOWRZRB-GOSISDBHSA-N	0	3	337.423	3.278	20	30		EGEDHN
CC(C)CC(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(C#N)cc1	ZINC001073934098	1355970634	/nfs/dbraw/zinc/97/06/34/1355970634.db2.gz	GZGDBIZQMIWESF-LJQANCHMSA-N	0	3	327.472	3.417	20	30		EGEDHN
Cc1ccc(F)cc1CN(C)C[C@H]1CCCCN1C(=O)[C@@H](C)C#N	ZINC001073972780	1356003327	/nfs/dbraw/zinc/00/33/27/1356003327.db2.gz	DXAVLKQUNVXGJQ-MAUKXSAKSA-N	0	3	331.435	3.107	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCCN1C(=O)/C=C/C1CC1	ZINC001073979053	1356007463	/nfs/dbraw/zinc/00/74/63/1356007463.db2.gz	KOKXXKGPQZKZLT-CTDFXDFQSA-N	0	3	337.467	3.337	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(C#N)cc1	ZINC001074067579	1356064736	/nfs/dbraw/zinc/06/47/36/1356064736.db2.gz	GKGADBDZAKBCKH-VAMGGRTRSA-N	0	3	339.483	3.417	20	30		EGEDHN
C[C@@H](N[C@H]1CCN(C(=O)C#CC2CC2)[C@H]1C)c1ccccc1Cl	ZINC001074642655	1356219742	/nfs/dbraw/zinc/21/97/42/1356219742.db2.gz	CXATZPMDYLCMLK-GLJUWKHASA-N	0	3	330.859	3.393	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccc(-c4ccncc4)o3)[C@@H]2C1	ZINC001075880330	1356438583	/nfs/dbraw/zinc/43/85/83/1356438583.db2.gz	URGDWGSGZVWRKK-DLBZAZTESA-N	0	3	337.423	3.064	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)Cn3c(C)cc4ccccc43)[C@@H]2C1	ZINC001076010183	1356465597	/nfs/dbraw/zinc/46/55/97/1356465597.db2.gz	LZVDXBYSRCZKGH-AZUAARDMSA-N	0	3	337.467	3.059	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@]1(c3ccccc3)CC1(C)C)C2	ZINC001098090610	1363220118	/nfs/dbraw/zinc/22/01/18/1363220118.db2.gz	UEHTYFUEPLADLK-NXWNEQKCSA-N	0	3	336.479	3.099	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3ccc(Cl)c(Cl)c3)[C@@H]2C1	ZINC001076490113	1356592040	/nfs/dbraw/zinc/59/20/40/1356592040.db2.gz	XJODMWLZCXHBDJ-XJKSGUPXSA-N	0	3	337.250	3.163	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@H](C)Cc3ccc(C)cc3)[C@@H]2C1	ZINC001076614697	1356633009	/nfs/dbraw/zinc/63/30/09/1356633009.db2.gz	YGFGYCDMARGAME-YZGWKJHDSA-N	0	3	326.484	3.282	20	30		EGEDHN
C=CCCOCC(=O)NC[C@H]1CCC(C)(C)CN1Cc1ccccc1	ZINC001099364824	1363775218	/nfs/dbraw/zinc/77/52/18/1363775218.db2.gz	RUEZBJSCONRIQM-LJQANCHMSA-N	0	3	344.499	3.386	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)C2(c3ccccc3C)CCC2)C1	ZINC001080858382	1357754154	/nfs/dbraw/zinc/75/41/54/1357754154.db2.gz	NXRHKWHPDUDUSX-IEBWSBKVSA-N	0	3	326.484	3.429	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2ncc(Cl)s2)C12CCC2	ZINC001078680918	1357053192	/nfs/dbraw/zinc/05/31/92/1357053192.db2.gz	VDFVIYKMJJXRBO-ZJUUUORDSA-N	0	3	346.283	3.180	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ncc(Cl)s2)C12CCC2	ZINC001078680917	1357053262	/nfs/dbraw/zinc/05/32/62/1357053262.db2.gz	VDFVIYKMJJXRBO-VHSXEESVSA-N	0	3	346.283	3.180	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2cc3ncccc3o2)C12CCC2	ZINC001078683879	1357053778	/nfs/dbraw/zinc/05/37/78/1357053778.db2.gz	XXABNACDDOOCPF-CVEARBPZSA-N	0	3	345.830	3.211	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)Cc2ccsc2C)C12CCC2	ZINC001078742528	1357067885	/nfs/dbraw/zinc/06/78/85/1357067885.db2.gz	XOBACNFQGSGROK-LSDHHAIUSA-N	0	3	338.904	3.369	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C(F)=C2CCCC2)C[C@H]1c1ccccc1	ZINC001081106596	1357829634	/nfs/dbraw/zinc/82/96/34/1357829634.db2.gz	PDOBQVKOALMXKN-ZWKOTPCHSA-N	0	3	326.415	3.001	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2cccc3ccsc32)[C@H](OC)C1	ZINC001082300298	1358011058	/nfs/dbraw/zinc/01/10/58/1358011058.db2.gz	JXNHGQRXONXHAK-IAGOWNOFSA-N	0	3	344.480	3.297	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1C[C@@H](C)[C@H](NC2c3ccccc3-c3ccccc32)C1	ZINC001082451064	1358039539	/nfs/dbraw/zinc/03/95/39/1358039539.db2.gz	OZYGUKPGWRNLDQ-BXTJHSDWSA-N	0	3	345.446	3.353	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3c(C)occ3C(F)(F)F)[C@@H]2C1	ZINC001084525417	1358230830	/nfs/dbraw/zinc/23/08/30/1358230830.db2.gz	JBQSRMSHBOBEHA-TZMCWYRMSA-N	0	3	342.361	3.329	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3nc(Cl)sc3Cl)[C@@H]2C1	ZINC001084573347	1358240665	/nfs/dbraw/zinc/24/06/65/1358240665.db2.gz	PCANYARAPWMVGO-NXEZZACHSA-N	0	3	346.283	3.172	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)C[C@@H](C)c3cccc(OC)c3)[C@@H]2C1	ZINC001084860968	1358332659	/nfs/dbraw/zinc/33/26/59/1358332659.db2.gz	OWFYUDDMQZVCCT-YVWKXTFCSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3cnc(CC(C)C)s3)[C@@H]2C1	ZINC001084865833	1358335896	/nfs/dbraw/zinc/33/58/96/1358335896.db2.gz	URKZZQGBTBQAQX-HZPDHXFCSA-N	0	3	347.528	3.454	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@]3(c4ccccc4)CC3(C)C)C[C@@H]21	ZINC001085061328	1358380969	/nfs/dbraw/zinc/38/09/69/1358380969.db2.gz	AJLSCWMIAJSLKD-ZWCUEREDSA-N	0	3	338.495	3.463	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@@H](C)c3ccc(F)cc3F)C[C@@H]21	ZINC001085097345	1358389635	/nfs/dbraw/zinc/38/96/35/1358389635.db2.gz	CMNJRPUSXIFNNV-KHYOSLBOSA-N	0	3	346.421	3.014	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)C1(C)CC(=C)C1	ZINC001085324505	1358467585	/nfs/dbraw/zinc/46/75/85/1358467585.db2.gz	CIEKIUKEBUNGSJ-ZIAGYGMSSA-N	0	3	341.293	3.268	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccc2c(c1)C[C@H](C)O2	ZINC001085364899	1358479587	/nfs/dbraw/zinc/47/95/87/1358479587.db2.gz	YCBXJKCCSGTCSW-IAOVAPTHSA-N	0	3	348.874	3.393	20	30		EGEDHN
CN(C[C@@H]1CCN1CCCC1CCCC1)C(=O)c1ccc(C#N)[nH]1	ZINC001085553400	1358589626	/nfs/dbraw/zinc/58/96/26/1358589626.db2.gz	IBPAAENUUSFSEF-KRWDZBQOSA-N	0	3	328.460	3.003	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cnc2c(F)cccc2c1	ZINC001085724759	1358712840	/nfs/dbraw/zinc/71/28/40/1358712840.db2.gz	DSJBRHCBZMUZHP-KRWDZBQOSA-N	0	3	341.430	3.486	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1csc(C(F)(F)F)n1	ZINC001085909155	1358867778	/nfs/dbraw/zinc/86/77/78/1358867778.db2.gz	BSUFDHWAPJSFLN-LLVKDONJSA-N	0	3	347.406	3.274	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1ccc(OC2CCC2)cc1	ZINC001085981138	1358934048	/nfs/dbraw/zinc/93/40/48/1358934048.db2.gz	GAECVMYLPCKVAW-QGZVFWFLSA-N	0	3	328.456	3.340	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cccc2oc(C)nc21	ZINC001085993655	1358948162	/nfs/dbraw/zinc/94/81/62/1358948162.db2.gz	QYURRJFSLZRGFP-OAHLLOKOSA-N	0	3	327.428	3.249	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)c2ccccc2C)C1	ZINC001086017956	1358967705	/nfs/dbraw/zinc/96/77/05/1358967705.db2.gz	WCNDKJOFPMZYDS-OKILXGFUSA-N	0	3	337.261	3.002	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2C[C@@H](NCc3cc(C)ns3)C2)CC1	ZINC001086187754	1359020734	/nfs/dbraw/zinc/02/07/34/1359020734.db2.gz	OENGCAHHOZZPJA-FZNQNYSPSA-N	0	3	333.501	3.182	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)[C@@H]2CCC(C)(C)C2)C1	ZINC001086191638	1359022981	/nfs/dbraw/zinc/02/29/81/1359022981.db2.gz	BKEUKWSCFRBGHN-MCIONIFRSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)[C@@H]2C[C@@]2(C)C(C)C)C1	ZINC001086241792	1359039312	/nfs/dbraw/zinc/03/93/12/1359039312.db2.gz	UFHGYAJFNZMZEP-FQLMCAECSA-N	0	3	343.309	3.062	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)c2ccc(C)cc2)C1	ZINC001086259991	1359045543	/nfs/dbraw/zinc/04/55/43/1359045543.db2.gz	CFQCPLPGLVXFFV-OTVXOJSOSA-N	0	3	337.261	3.002	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc(F)c(F)cc2Cl)C1	ZINC001086265878	1359047633	/nfs/dbraw/zinc/04/76/33/1359047633.db2.gz	AWRZZTQJMBSNLM-AOOOYVTPSA-N	0	3	349.208	3.469	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2sc(C(C)C)nc2C)C1	ZINC001086270433	1359049939	/nfs/dbraw/zinc/04/99/39/1359049939.db2.gz	FKYTUYOIHVEGCP-BETUJISGSA-N	0	3	341.908	3.425	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@@H]2Cc3c2cccc3Cl)C1	ZINC001086282678	1359054736	/nfs/dbraw/zinc/05/47/36/1359054736.db2.gz	XWOHLCJQJSXKJW-TYNCELHUSA-N	0	3	339.266	3.217	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@@H]2CC[C@H](c3ccccc3)O2)C1	ZINC001086367727	1359078826	/nfs/dbraw/zinc/07/88/26/1359078826.db2.gz	BUBSYDJQTUZUKV-DDBAPUKQSA-N	0	3	348.874	3.144	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccoc2C(F)(F)F)C1	ZINC001086377142	1359082113	/nfs/dbraw/zinc/08/21/13/1359082113.db2.gz	WZOLSQRJOWKXTG-MGCOHNPYSA-N	0	3	336.741	3.149	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@H]2CCc3cc(F)ccc32)C1	ZINC001086429817	1359095414	/nfs/dbraw/zinc/09/54/14/1359095414.db2.gz	MFMSMDRJKYTSAL-NUTKFTJISA-N	0	3	336.838	3.092	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(C)c3cccnc23)C1	ZINC001086430884	1359095701	/nfs/dbraw/zinc/09/57/01/1359095701.db2.gz	MKOMNJABNCNGAQ-SHTZXODSSA-N	0	3	343.858	3.394	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@H]2CC[C@@H](C(F)(F)F)C2)C1	ZINC001086459737	1359104387	/nfs/dbraw/zinc/10/43/87/1359104387.db2.gz	WGKKABZBUKYCCI-RVMXOQNASA-N	0	3	338.801	3.202	20	30		EGEDHN
C=C(C)CN1C[C@@H](c2ccccc2)[C@H](NC(=O)C[C@@H]2CCCCO2)C1	ZINC001086582538	1359155035	/nfs/dbraw/zinc/15/50/35/1359155035.db2.gz	WFIMIHMFDWUWSG-SLFFLAALSA-N	0	3	342.483	3.106	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)C2=CCCCCC2)C1	ZINC001086584955	1359156544	/nfs/dbraw/zinc/15/65/44/1359156544.db2.gz	XLCDROQDEADLCV-LEWJYISDSA-N	0	3	336.479	3.484	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)C2(C3CC3)CCC2)C1	ZINC001086601819	1359161347	/nfs/dbraw/zinc/16/13/47/1359161347.db2.gz	PODVRZFIYVIQSE-VQTJNVASSA-N	0	3	336.479	3.174	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2cccn2C(C)C)C1	ZINC001086624814	1359169079	/nfs/dbraw/zinc/16/90/79/1359169079.db2.gz	VYPCCQLYXLZSLN-VQTJNVASSA-N	0	3	349.478	3.290	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cccc3[nH]c(C)nc32)C1	ZINC001086846664	1359212376	/nfs/dbraw/zinc/21/23/76/1359212376.db2.gz	JLOICVVJGLVMFG-UONOGXRCSA-N	0	3	346.862	3.112	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cc3c([nH]2)CCCC3)C1	ZINC001086848452	1359212970	/nfs/dbraw/zinc/21/29/70/1359212970.db2.gz	RPICPHOMBXLWHK-DZGCQCFKSA-N	0	3	335.879	3.134	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccc(C(F)F)o2)C1	ZINC001086865190	1359216782	/nfs/dbraw/zinc/21/67/82/1359216782.db2.gz	FRVYXBURCPFKKZ-WDEREUQCSA-N	0	3	332.778	3.458	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3ccoc3CC)C2)CC1	ZINC001086920656	1359248005	/nfs/dbraw/zinc/24/80/05/1359248005.db2.gz	VWQPVWVXYUXORD-INIZCTEOSA-N	0	3	328.456	3.182	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cc(F)ccc3CC)C2)CC1	ZINC001086930897	1359254884	/nfs/dbraw/zinc/25/48/84/1359254884.db2.gz	SUEGJVSKYVSUJS-INIZCTEOSA-N	0	3	342.458	3.338	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3coc(C(F)F)c3)C2)CC1	ZINC001086939501	1359262162	/nfs/dbraw/zinc/26/21/62/1359262162.db2.gz	RZTYWOARORHIQF-CYBMUJFWSA-N	0	3	336.382	3.167	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H](C)c3cc(C)oc3C)C2)CC1	ZINC001086949026	1359270115	/nfs/dbraw/zinc/27/01/15/1359270115.db2.gz	PIWRFUBYBWPPRL-WBVHZDCISA-N	0	3	342.483	3.336	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3oc(CC)cc3C)C2)CC1	ZINC001086953330	1359273923	/nfs/dbraw/zinc/27/39/23/1359273923.db2.gz	FRGLEZJEMDPAGZ-KRWDZBQOSA-N	0	3	342.483	3.490	20	30		EGEDHN
CC1(C)[C@H](NC(=O)C2CC2)[C@@H]2CCCN(Cc3ccc(C#N)cc3)[C@H]21	ZINC001087266788	1359338349	/nfs/dbraw/zinc/33/83/49/1359338349.db2.gz	QIZGVZJXOOMWEN-IPMKNSEASA-N	0	3	337.467	3.073	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)C(F)=C3CCCC3)C(C)(C)[C@H]21	ZINC001087281716	1359360957	/nfs/dbraw/zinc/36/09/57/1359360957.db2.gz	LFPJFKIEJWBXMS-NJAFHUGGSA-N	0	3	332.463	3.413	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(C)c(C)o3)C(C)(C)[C@@H]21	ZINC001087282804	1359362080	/nfs/dbraw/zinc/36/20/80/1359362080.db2.gz	DZRHJVTVKWKQOM-KBAYOESNSA-N	0	3	328.456	3.139	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc2occc2c1	ZINC001087288109	1359366866	/nfs/dbraw/zinc/36/68/66/1359366866.db2.gz	RLBCFFURAAABEP-NZSAHSFTSA-N	0	3	336.435	3.285	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cccc4cccnc43)C(C)(C)[C@H]21	ZINC001087294536	1359375126	/nfs/dbraw/zinc/37/51/26/1359375126.db2.gz	UYLFGGXGDACYTB-HOJAQTOUSA-N	0	3	347.462	3.087	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc4[nH]ccc4c3)C(C)(C)[C@H]21	ZINC001087299940	1359382267	/nfs/dbraw/zinc/38/22/67/1359382267.db2.gz	DPAIYWXTTKUFHO-RLLQIKCJSA-N	0	3	349.478	3.410	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc4cc[nH]c43)C(C)(C)[C@@H]21	ZINC001087304397	1359388192	/nfs/dbraw/zinc/38/81/92/1359388192.db2.gz	BLKCJOLKJGXJMP-MISYRCLQSA-N	0	3	349.478	3.410	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc(F)c3Cl)C(C)(C)[C@@H]21	ZINC001087304769	1359389095	/nfs/dbraw/zinc/38/90/95/1359389095.db2.gz	HMINMRRUULFHGJ-KBRIMQKVSA-N	0	3	348.849	3.331	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc2occc2s1	ZINC001087304951	1359389108	/nfs/dbraw/zinc/38/91/08/1359389108.db2.gz	KDFQHPNULSTICJ-OAUYIBNBSA-N	0	3	342.464	3.346	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cccc2[nH]ccc21	ZINC001087305207	1359390725	/nfs/dbraw/zinc/39/07/25/1359390725.db2.gz	ORRDIGRVYHSECI-YZGWKJHDSA-N	0	3	349.478	3.410	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cccc(Cl)c1	ZINC001087313940	1359402707	/nfs/dbraw/zinc/40/27/07/1359402707.db2.gz	CFVBOFKAXJYYHD-IXDOHACOSA-N	0	3	330.859	3.192	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccccc3Cl)C(C)(C)[C@H]21	ZINC001087314425	1359403406	/nfs/dbraw/zinc/40/34/06/1359403406.db2.gz	KVVJVCQGSKHNDF-PVAVHDDUSA-N	0	3	330.859	3.192	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cccc(C(F)F)c1	ZINC001087315329	1359404917	/nfs/dbraw/zinc/40/49/17/1359404917.db2.gz	ZTCQXALNDMCJRN-IXDOHACOSA-N	0	3	346.421	3.476	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3nc(C)c(C)s3)C(C)(C)[C@H]21	ZINC001087317599	1359408931	/nfs/dbraw/zinc/40/89/31/1359408931.db2.gz	KMGFIFBRCZUIMX-OAGGEKHMSA-N	0	3	345.512	3.002	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(C)c(CC)s3)C(C)(C)[C@H]21	ZINC001087317808	1359409089	/nfs/dbraw/zinc/40/90/89/1359409089.db2.gz	NEKDKSDALUNABR-OLMNPRSZSA-N	0	3	344.524	3.471	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)Cc1ccccc1C	ZINC001087317939	1359409749	/nfs/dbraw/zinc/40/97/49/1359409749.db2.gz	OYGKZNGIZGSVFM-HLAWJBBLSA-N	0	3	338.495	3.166	20	30		EGEDHN
CC(C)=CC(=O)N1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1CC#Cc1ccccc1	ZINC001087331850	1359421747	/nfs/dbraw/zinc/42/17/47/1359421747.db2.gz	CFROXNKEFXMGIA-LRSLUSHPSA-N	0	3	348.490	3.173	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(Cc2cncs2)C1	ZINC001087378213	1359438975	/nfs/dbraw/zinc/43/89/75/1359438975.db2.gz	KNLADLZAAOGYKB-HJWJTTGWSA-N	0	3	345.512	3.024	20	30		EGEDHN
C=CCCN1CC[C@H](c2cccc(F)c2)[C@H](NC(=O)C(C)(C)F)C1	ZINC001087451126	1359472237	/nfs/dbraw/zinc/47/22/37/1359472237.db2.gz	DGCGGPJYIISFTL-IAGOWNOFSA-N	0	3	336.426	3.424	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CN(CC)CC[C@@H]2c2ccc(F)cc2)C1	ZINC001087467735	1359480279	/nfs/dbraw/zinc/48/02/79/1359480279.db2.gz	MKEACZMKUFBCLR-QZTJIDSGSA-N	0	3	330.447	3.476	20	30		EGEDHN
CCCCOCC(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1Cl	ZINC001346039562	1390902360	/nfs/dbraw/zinc/90/23/60/1390902360.db2.gz	MRVQPFRHMCKFDR-LLVKDONJSA-N	0	3	343.210	3.457	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2nc(C(C)(C)C)cs2)[C@H]1CC	ZINC001087610752	1359553937	/nfs/dbraw/zinc/55/39/37/1359553937.db2.gz	BQBHTIQGTCZIGR-UONOGXRCSA-N	0	3	333.501	3.047	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cc(C(C)C)nn2CC)[C@H]1CC	ZINC001087639543	1359566445	/nfs/dbraw/zinc/56/64/45/1359566445.db2.gz	CIAFIBNVIFHVIP-DOTOQJQBSA-N	0	3	332.492	3.185	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2cc3cccc(OC)c3o2)[C@H]1CC	ZINC001087706629	1359601377	/nfs/dbraw/zinc/60/13/77/1359601377.db2.gz	BZEMONULWBQAIE-JKSUJKDBSA-N	0	3	340.423	3.047	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(Cl)c(F)c2)[C@H]1CC	ZINC001087740281	1359621032	/nfs/dbraw/zinc/62/10/32/1359621032.db2.gz	XRSMLXBYUNJFEJ-DLBZAZTESA-N	0	3	336.838	3.014	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cnccc2C(F)(F)F)[C@H]1CC	ZINC001087741180	1359621774	/nfs/dbraw/zinc/62/17/74/1359621774.db2.gz	UFWJZWHMNMSWRU-LSDHHAIUSA-N	0	3	341.377	3.259	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccn(C(CC)CC)n2)[C@H]1CC	ZINC001087750190	1359627565	/nfs/dbraw/zinc/62/75/65/1359627565.db2.gz	XLBRZWRAUUEUQZ-FUHWJXTLSA-N	0	3	332.492	3.403	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)[C@H](C)c2ccc(CC)cc2)[C@H]1CC	ZINC001087764510	1359633961	/nfs/dbraw/zinc/63/39/61/1359633961.db2.gz	TVRUKBWILHZYCZ-LSTHTHJFSA-N	0	3	326.484	3.345	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cccc(F)c2OCC)[C@H]1CC	ZINC001087776014	1359637802	/nfs/dbraw/zinc/63/78/02/1359637802.db2.gz	HFKWXQPDEQDZLB-DLBZAZTESA-N	0	3	334.435	3.383	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cccc(OCCC)c2)[C@H]1CC	ZINC001087789109	1359645235	/nfs/dbraw/zinc/64/52/35/1359645235.db2.gz	ZISABJKBGFPLJJ-VQTJNVASSA-N	0	3	342.483	3.010	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)C[C@H]2CCc3ccccc3C2)[C@H]1CC	ZINC001087808877	1359658545	/nfs/dbraw/zinc/65/85/45/1359658545.db2.gz	NPRXONBMIBBPAQ-FFZOFVMBSA-N	0	3	326.484	3.337	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)C(C)(C)c2ccc(OC)cc2)[C@H]1CC	ZINC001087837994	1359673172	/nfs/dbraw/zinc/67/31/72/1359673172.db2.gz	MOBHSFIXKPNBMK-ZWKOTPCHSA-N	0	3	330.472	3.128	20	30		EGEDHN
Cc1cccc(Cl)c1CN1CC[C@@H]2CN(C(=O)[C@@H](C)C#N)C[C@@H]2C1	ZINC001087912104	1359705037	/nfs/dbraw/zinc/70/50/37/1359705037.db2.gz	XJWYHLFDVRLQMC-XHSDSOJGSA-N	0	3	345.874	3.088	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CN(C(=O)CCC4CC4)C[C@@H]3C2)cc1	ZINC001087913181	1359705384	/nfs/dbraw/zinc/70/53/84/1359705384.db2.gz	AQCWRKJTOAVTMK-UXHICEINSA-N	0	3	337.467	3.029	20	30		EGEDHN
C[C@@H](c1cccc(F)c1)N1CC[C@@H]2CN(C(=O)C#CC3CC3)C[C@@H]2C1	ZINC001087959314	1359719608	/nfs/dbraw/zinc/71/96/08/1359719608.db2.gz	VCECWYMQZRPBHW-IPELMVKDSA-N	0	3	340.442	3.080	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3cc4c(cccc4C)o3)C[C@@H]2C1	ZINC001088216540	1359799085	/nfs/dbraw/zinc/79/90/85/1359799085.db2.gz	NLBRQXGBSPUUGR-SJORKVTESA-N	0	3	336.435	3.158	20	30		EGEDHN
C=CCN1CC[C@@H](OCC2CCN(C(=O)c3sccc3C)CC2)C1	ZINC001088225586	1359803470	/nfs/dbraw/zinc/80/34/70/1359803470.db2.gz	QWNMXOSJVHJUDS-QGZVFWFLSA-N	0	3	348.512	3.186	20	30		EGEDHN
C=CCN1CC[C@@H](OCC2CCN(C(=O)CC3CCCCC3)CC2)C1	ZINC001088227173	1359805974	/nfs/dbraw/zinc/80/59/74/1359805974.db2.gz	HTVJDDNZUFSCRY-HXUWFJFHSA-N	0	3	348.531	3.472	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](CNCc2csc(C)n2)[C@@H](C)C1	ZINC001184232790	1387418040	/nfs/dbraw/zinc/41/80/40/1387418040.db2.gz	XRUSVSTZWDMNQQ-RDJZCZTQSA-N	0	3	347.528	3.219	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)C[C@@H]2CC(C)(C)CO2)C1	ZINC001088346615	1359833506	/nfs/dbraw/zinc/83/35/06/1359833506.db2.gz	UKJVKYJGAAGKPP-HZPDHXFCSA-N	0	3	342.911	3.305	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2ncc3ccccn32)C1	ZINC001088347576	1359834478	/nfs/dbraw/zinc/83/44/78/1359834478.db2.gz	VKPOEIRDHWVSAT-OAHLLOKOSA-N	0	3	346.862	3.061	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCCC[C@@H](NCc2ccc(F)cn2)C1	ZINC001088360288	1359844129	/nfs/dbraw/zinc/84/41/29/1359844129.db2.gz	VITQWFWMDALXKA-QGZVFWFLSA-N	0	3	333.451	3.294	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)[C@@H]2CCc3cccnc32)C1	ZINC001088370100	1359852934	/nfs/dbraw/zinc/85/29/34/1359852934.db2.gz	AHGCJKREJDAZMB-IAGOWNOFSA-N	0	3	347.890	3.225	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)C2CCC(OC)CC2)C1	ZINC001088371701	1359853969	/nfs/dbraw/zinc/85/39/69/1359853969.db2.gz	MYXRXVRHGIPKIF-AQFXKWCLSA-N	0	3	342.911	3.305	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2ccc3nccn3c2)C1	ZINC001088412110	1359883342	/nfs/dbraw/zinc/88/33/42/1359883342.db2.gz	YHLMQYBTTQVLQE-MRXNPFEDSA-N	0	3	346.862	3.061	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)[C@@H](OC)C2CCCC2)C1	ZINC001088419524	1359889350	/nfs/dbraw/zinc/88/93/50/1359889350.db2.gz	RVHLWVFTBNECFD-SJORKVTESA-N	0	3	342.911	3.305	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2n[nH]c3ccccc32)C1	ZINC001088420710	1359890386	/nfs/dbraw/zinc/89/03/86/1359890386.db2.gz	WMHVYJCUVJEHKT-CQSZACIVSA-N	0	3	346.862	3.290	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](CNCc2csc(CC)n2)[C@@H](C)C1	ZINC001184313160	1387427709	/nfs/dbraw/zinc/42/77/09/1387427709.db2.gz	XGQMQNVBRRKZJA-HOTGVXAUSA-N	0	3	347.528	3.083	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(CCOc3ccc(C)cc3)[C@@H]2C)C1	ZINC001088844328	1360078044	/nfs/dbraw/zinc/07/80/44/1360078044.db2.gz	MQAZYNALWXQADK-MJGOQNOKSA-N	0	3	342.483	3.309	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(CCOc3ccccc3C)[C@@H]2C)C1	ZINC001088844143	1360078301	/nfs/dbraw/zinc/07/83/01/1360078301.db2.gz	DSILNFDKXRDUFU-MSOLQXFVSA-N	0	3	342.483	3.309	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cnn(C(C)C)c2C2CC2)[C@H]1C	ZINC001088968410	1360119018	/nfs/dbraw/zinc/11/90/18/1360119018.db2.gz	VHNCNIZZMCZRBO-PBHICJAKSA-N	0	3	330.476	3.110	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccc(N(CC)CC)cc2)[C@H]1C	ZINC001089001984	1360133182	/nfs/dbraw/zinc/13/31/82/1360133182.db2.gz	NCNLATOVCXLSOP-APWZRJJASA-N	0	3	329.488	3.302	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2csc3c2CC[C@@H](C)C3)[C@H]1C	ZINC001089020058	1360138913	/nfs/dbraw/zinc/13/89/13/1360138913.db2.gz	QCJAPXGHJFLIID-CPUCHLNUSA-N	0	3	330.497	3.089	20	30		EGEDHN
Cc1cnc(CNC[C@H]2CCN(C(=O)C#CC(C)(C)C)C[C@@H]2C)s1	ZINC001184368874	1387441660	/nfs/dbraw/zinc/44/16/60/1387441660.db2.gz	CURGCRUHTPVAEF-GOEBONIOSA-N	0	3	347.528	3.075	20	30		EGEDHN
Cc1cnc(CNC[C@@H]2CCN(C(=O)C#CC(C)(C)C)C[C@@H]2C)s1	ZINC001184368876	1387441818	/nfs/dbraw/zinc/44/18/18/1387441818.db2.gz	CURGCRUHTPVAEF-HOCLYGCPSA-N	0	3	347.528	3.075	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCc2sc(CNCC3CC(C)C3)nc2C1	ZINC001089278024	1360297539	/nfs/dbraw/zinc/29/75/39/1360297539.db2.gz	UBDXIBDWLFJDQB-UHFFFAOYSA-N	0	3	347.528	3.376	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccoc2C(F)(F)F)CC(C)(C)C1	ZINC001089398178	1360397938	/nfs/dbraw/zinc/39/79/38/1360397938.db2.gz	YCYMJVCZGQHBLW-LBPRGKRZSA-N	0	3	342.361	3.152	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc3cc(C)cn3c2)CC(C)(C)C1	ZINC001089402397	1360401857	/nfs/dbraw/zinc/40/18/57/1360401857.db2.gz	FYUHAPUUAGVSJV-SFHVURJKSA-N	0	3	337.467	3.101	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc3ccncc3s2)CC(C)(C)C1	ZINC001089405957	1360404509	/nfs/dbraw/zinc/40/45/09/1360404509.db2.gz	FZFCITLSSXGAHM-HNNXBMFYSA-N	0	3	341.480	3.150	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C[C@H]2CCCC2(F)F)CC(C)(C)C1	ZINC001089478231	1360460593	/nfs/dbraw/zinc/46/05/93/1360460593.db2.gz	SDRWJAQUMISAEI-HUUCEWRRSA-N	0	3	326.431	3.052	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C(C)(C)c2cccc(F)c2)CC(C)(C)C1	ZINC001089490814	1360469648	/nfs/dbraw/zinc/46/96/48/1360469648.db2.gz	FQABQUFOZSSCCB-SFHVURJKSA-N	0	3	344.474	3.343	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@@H](C)c2cccc(C)c2)CC(C)(C)C1	ZINC001089505375	1360477720	/nfs/dbraw/zinc/47/77/20/1360477720.db2.gz	FWIDFVXHVLKLSR-PKOBYXMFSA-N	0	3	326.484	3.339	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc3ccncc3c2)CC(C)(C)C1	ZINC001089531828	1360493256	/nfs/dbraw/zinc/49/32/56/1360493256.db2.gz	QKDTWAXQGIWOIG-IBGZPJMESA-N	0	3	335.451	3.088	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(OC(C)C)cc2)CC(C)(C)C1	ZINC001089553105	1360504622	/nfs/dbraw/zinc/50/46/22/1360504622.db2.gz	SZCFXKWNBPBPQK-GOSISDBHSA-N	0	3	342.483	3.327	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2sc(C)nc2C)CC(C)(C)C1	ZINC001089554029	1360505213	/nfs/dbraw/zinc/50/52/13/1360505213.db2.gz	CTRTZHAWPUMNNW-OAHLLOKOSA-N	0	3	333.501	3.004	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@@H]2Cc3ccc(Cl)cc32)CC(C)(C)C1	ZINC001089553576	1360505356	/nfs/dbraw/zinc/50/53/56/1360505356.db2.gz	WQBZRZJEPYKRRV-SJLPKXTDSA-N	0	3	344.886	3.220	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@@H](C)c2ccccc2C)CC(C)(C)C1	ZINC001089561708	1360509144	/nfs/dbraw/zinc/50/91/44/1360509144.db2.gz	SAAOPMNWGIJCMW-ROUUACIJSA-N	0	3	326.484	3.339	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cncc(COC)c1	ZINC001089653696	1360566818	/nfs/dbraw/zinc/56/68/18/1360566818.db2.gz	SKCYNSLUYYVDPR-SFHVURJKSA-N	0	3	345.487	3.025	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cnn(C(C)(C)C)c1	ZINC001089660538	1360571900	/nfs/dbraw/zinc/57/19/00/1360571900.db2.gz	KXGDBMUOQQHUOD-QGZVFWFLSA-N	0	3	346.519	3.435	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H]1C[C@H]1C1CCOCC1	ZINC001089667370	1360577262	/nfs/dbraw/zinc/57/72/62/1360577262.db2.gz	FCSUBLQXXMBHAY-CEXWTWQISA-N	0	3	348.531	3.232	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1c(C)cncc1C	ZINC001089668782	1360578525	/nfs/dbraw/zinc/57/85/25/1360578525.db2.gz	AGATYBFPGNYFTL-KRWDZBQOSA-N	0	3	329.488	3.495	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc2c(c1)CCOC2	ZINC001089669289	1360579305	/nfs/dbraw/zinc/57/93/05/1360579305.db2.gz	JULZHWACTBYWCW-LJQANCHMSA-N	0	3	342.483	3.166	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(F)c(COC)c1	ZINC001089690970	1360596889	/nfs/dbraw/zinc/59/68/89/1360596889.db2.gz	HFOVCQKBVOAQEV-QGZVFWFLSA-N	0	3	348.462	3.379	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccnc(OCC)c1	ZINC001089692746	1360598566	/nfs/dbraw/zinc/59/85/66/1360598566.db2.gz	BYUKCHNBHHASEK-QGZVFWFLSA-N	0	3	345.487	3.277	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(F)c(OC)c1	ZINC001089696468	1360600990	/nfs/dbraw/zinc/60/09/90/1360600990.db2.gz	CWXVCJMVSNNSRR-INIZCTEOSA-N	0	3	346.446	3.078	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc2cc[nH]c2c1	ZINC001089706413	1360609262	/nfs/dbraw/zinc/60/92/62/1360609262.db2.gz	TWEVEGIBCNOYPI-GOSISDBHSA-N	0	3	337.467	3.412	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cnn(CC2CC2)c1	ZINC001089722147	1360624651	/nfs/dbraw/zinc/62/46/51/1360624651.db2.gz	ROIKNXQMKQACTQ-SFHVURJKSA-N	0	3	344.503	3.090	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(C2CC2)cn1	ZINC001089729471	1360632947	/nfs/dbraw/zinc/63/29/47/1360632947.db2.gz	OTFWJDBSYKJWOU-GOSISDBHSA-N	0	3	339.483	3.203	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cccnc1OCC	ZINC001089730114	1360633406	/nfs/dbraw/zinc/63/34/06/1360633406.db2.gz	WHNMAXLLYIGZAY-MRXNPFEDSA-N	0	3	345.487	3.277	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(COC)cc1	ZINC001089731204	1360635111	/nfs/dbraw/zinc/63/51/11/1360635111.db2.gz	NAPZXYRAOZXWLX-SFHVURJKSA-N	0	3	330.472	3.239	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cn(C)nc1C(C)C	ZINC001089731877	1360635913	/nfs/dbraw/zinc/63/59/13/1360635913.db2.gz	XUNGAZHSLUZYGY-INIZCTEOSA-N	0	3	346.519	3.340	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cncnc1C(C)C	ZINC001089732478	1360636947	/nfs/dbraw/zinc/63/69/47/1360636947.db2.gz	TZWFVNKEXCQZCA-INIZCTEOSA-N	0	3	344.503	3.397	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1c(C)cccc1F	ZINC001089735634	1360640292	/nfs/dbraw/zinc/64/02/92/1360640292.db2.gz	HIIXVWZJFBSPRN-INIZCTEOSA-N	0	3	330.447	3.378	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1ccsc1	ZINC001089764245	1360654761	/nfs/dbraw/zinc/65/47/61/1360654761.db2.gz	NUFILPYLAOPXCX-XZDPQHSOSA-N	0	3	336.888	3.283	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)c2cccc(F)c2)C1	ZINC001089764829	1360655474	/nfs/dbraw/zinc/65/54/74/1360655474.db2.gz	UTHPZSODXLPKFJ-DKIMLUQUSA-N	0	3	348.849	3.361	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1cccc(F)c1	ZINC001089764832	1360655636	/nfs/dbraw/zinc/65/56/36/1360655636.db2.gz	UTHPZSODXLPKFJ-RANZSIQMSA-N	0	3	348.849	3.361	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](CNCc2nccs2)[C@@H](C)C1	ZINC001184461773	1387466533	/nfs/dbraw/zinc/46/65/33/1387466533.db2.gz	VOOBJSAYQGRGLZ-DOTOQJQBSA-N	0	3	347.528	3.486	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1(C2CC2)CCC1	ZINC001089841659	1360691625	/nfs/dbraw/zinc/69/16/25/1360691625.db2.gz	GKYOFOPCAWWEDV-OWLYRPNTSA-N	0	3	348.918	3.488	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](CNCc2nccn2CC)[C@H](C)C1	ZINC001184487589	1387470511	/nfs/dbraw/zinc/47/05/11/1387470511.db2.gz	RLKMRCZTKIIRCU-IAGOWNOFSA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2sc(C3CC3)nc2C)C1	ZINC001091026548	1360982624	/nfs/dbraw/zinc/98/26/24/1360982624.db2.gz	QFJBOGYFWSGDPE-UHFFFAOYSA-N	0	3	339.892	3.179	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cccc(OCCC)c2)C1	ZINC001091055072	1360987500	/nfs/dbraw/zinc/98/75/00/1360987500.db2.gz	CSUNKVIZCHOLIJ-UHFFFAOYSA-N	0	3	336.863	3.326	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(Cl)cc2OC)C1	ZINC001091205267	1361006961	/nfs/dbraw/zinc/00/69/61/1361006961.db2.gz	VTMJBLMPWSWBSL-UHFFFAOYSA-N	0	3	343.254	3.199	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc(F)c(Cl)cc2F)C1	ZINC001091208598	1361007817	/nfs/dbraw/zinc/00/78/17/1361007817.db2.gz	UGNBZIVJRRHDBO-UHFFFAOYSA-N	0	3	349.208	3.469	20	30		EGEDHN
C/C(=C/C(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@@]2(C)C1)C1CC1	ZINC001091508268	1361130379	/nfs/dbraw/zinc/13/03/79/1361130379.db2.gz	UBPPGBLOTGKTHG-AMKGYUBGSA-N	0	3	349.478	3.195	20	30		EGEDHN
C[C@@]12CN(Cc3ccc(C#N)cc3)C[C@@H]1CN(C(=O)C1(C3CC3)CC1)C2	ZINC001091767209	1361214918	/nfs/dbraw/zinc/21/49/18/1361214918.db2.gz	AKTCBKXZLWAARW-CTNGQTDRSA-N	0	3	349.478	3.029	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N1CC[C@@H](NCc2cc(C)ccc2F)C1	ZINC001184646232	1387502853	/nfs/dbraw/zinc/50/28/53/1387502853.db2.gz	SVLCHFTUZFNBDE-YLJYHZDGSA-N	0	3	348.462	3.053	20	30		EGEDHN
Cc1coc(C(=O)N2C[C@H]3CN(Cc4cccc(C#N)c4)C[C@@]3(C)C2)c1	ZINC001091938171	1361255439	/nfs/dbraw/zinc/25/54/39/1361255439.db2.gz	CGJOMKWTTNFCJQ-NQIIRXRSSA-N	0	3	349.434	3.054	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@H](CC)Cc3ccccc3)C[C@]2(C)C1	ZINC001092063049	1361286121	/nfs/dbraw/zinc/28/61/21/1361286121.db2.gz	JIBFLXASMFJYQF-SJBKTWHCSA-N	0	3	338.495	3.059	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C[C@H](C)C3CCCCC3)C[C@]2(C)C1	ZINC001092093103	1361299744	/nfs/dbraw/zinc/29/97/44/1361299744.db2.gz	MWYFUXDGJUFJEK-DSKINZAPSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@]3(C)CCC(C)=C(C)C3)C[C@]2(C)C1	ZINC001092311059	1361362439	/nfs/dbraw/zinc/36/24/39/1361362439.db2.gz	GNOGMNDVVHZIEA-NRSPTQNISA-N	0	3	328.500	3.317	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CN(Cc3cc(C)ns3)C[C@H]2C)CC1	ZINC001092940402	1361491293	/nfs/dbraw/zinc/49/12/93/1361491293.db2.gz	MAABBOSPSGARLB-RHSMWYFYSA-N	0	3	347.528	3.382	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CN(Cc3oc(C)nc3C)C[C@H]2C)CC1	ZINC001092940756	1361492070	/nfs/dbraw/zinc/49/20/70/1361492070.db2.gz	ZYTNPSDLTIAGMO-RDTXWAMCSA-N	0	3	345.487	3.222	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)c2ccc(F)cc2)CC1	ZINC001093353616	1361567796	/nfs/dbraw/zinc/56/77/96/1361567796.db2.gz	VBSGDDDMQXUFDP-IBGZPJMESA-N	0	3	340.442	3.166	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C23CCC(CC2)C3)CC1	ZINC001093371686	1361581467	/nfs/dbraw/zinc/58/14/67/1361581467.db2.gz	ASHDDZRGIFWXDQ-MOMVYJMYSA-N	0	3	340.511	3.293	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H](CNCc2csc(C)n2)[C@H](C)C1	ZINC001094018086	1361725417	/nfs/dbraw/zinc/72/54/17/1361725417.db2.gz	DPHASGDXROANBF-DDUZABMNSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3C[C@H]2CCCCO2)CC1	ZINC001095968204	1362314858	/nfs/dbraw/zinc/31/48/58/1362314858.db2.gz	NFHZKDYJQOQIAR-YRXWBPOGSA-N	0	3	332.488	3.023	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(OCC)c(C)c1)C2	ZINC001096095830	1362380427	/nfs/dbraw/zinc/38/04/27/1362380427.db2.gz	PGNSHGMEBSCTHT-SQNIBIBYSA-N	0	3	328.456	3.305	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc(F)cc3cccnc31)C2	ZINC001096098797	1362381337	/nfs/dbraw/zinc/38/13/37/1362381337.db2.gz	DFYKKSIAUXCNSA-NJAFHUGGSA-N	0	3	339.414	3.285	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1c[nH]nc1-c1ccsc1)C2	ZINC001096257095	1362449855	/nfs/dbraw/zinc/44/98/55/1362449855.db2.gz	IQMMLAVSFIFRKM-KBMXLJTQSA-N	0	3	342.468	3.049	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc(C)c(F)cc1Cl)C2	ZINC001096442175	1362513346	/nfs/dbraw/zinc/51/33/46/1362513346.db2.gz	IPRDWIBFCZWCDT-DQYPLSBCSA-N	0	3	334.822	3.146	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](N[C@@H](C)c2ccc(F)c(F)c2)C1	ZINC001185006784	1387588606	/nfs/dbraw/zinc/58/86/06/1387588606.db2.gz	GGXKUCWOSIBCDX-GOEBONIOSA-N	0	3	334.410	3.410	20	30		EGEDHN
Cc1ccc(CN2[C@@H]3CC[C@H]2[C@H](NC(=O)c2ccc(C#N)[nH]2)C3)cc1C	ZINC001096968227	1362797597	/nfs/dbraw/zinc/79/75/97/1362797597.db2.gz	DOWDJORKDCBOCA-RLLQIKCJSA-N	0	3	348.450	3.039	20	30		EGEDHN
Cc1cccc([C@@H](C)N2[C@@H]3CC[C@H]2[C@H](NC(=O)c2c[nH]c(C#N)c2)C3)c1	ZINC001096975218	1362800714	/nfs/dbraw/zinc/80/07/14/1362800714.db2.gz	RFVAAYOYPGNKDU-DMSXTEQDSA-N	0	3	348.450	3.291	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H]1CCCC[C@H]1C(F)(F)F)C2	ZINC001097253287	1362902856	/nfs/dbraw/zinc/90/28/56/1362902856.db2.gz	AHCNWGYTMMNBLO-QCODTGAPSA-N	0	3	342.405	3.100	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](CNCc2oc(CC)nc2C)[C@@H](C)C1	ZINC001185061763	1387604337	/nfs/dbraw/zinc/60/43/37/1387604337.db2.gz	PLBPKIKPSYSZOR-DOTOQJQBSA-N	0	3	347.503	3.476	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1sc(C)cc1OC)C2	ZINC001097970398	1363183822	/nfs/dbraw/zinc/18/38/22/1363183822.db2.gz	GMMFQSOOQFGQCU-KFWWJZLASA-N	0	3	334.485	3.366	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1csc(C(C)(C)C)n1)C2	ZINC001098038973	1363204089	/nfs/dbraw/zinc/20/40/89/1363204089.db2.gz	RQSSLUTXDSJMLP-NFAWXSAZSA-N	0	3	333.501	3.352	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](CNCc3cc(C)no3)[C@H](C)C2)CC1	ZINC001185094962	1387617409	/nfs/dbraw/zinc/61/74/09/1387617409.db2.gz	MTEKTQPFAFQANB-WBVHZDCISA-N	0	3	345.487	3.304	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(C)c(C)c1Cl)C2	ZINC001098214396	1363258075	/nfs/dbraw/zinc/25/80/75/1363258075.db2.gz	HHGOIRQELOFNQI-OIISXLGYSA-N	0	3	330.859	3.315	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C(C)(C)c1ccccc1Cl)C2	ZINC001098246901	1363268860	/nfs/dbraw/zinc/26/88/60/1363268860.db2.gz	ZTNPQUFFZWKZOR-OLMNPRSZSA-N	0	3	344.886	3.362	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1ccc3ccccc3c1)C2	ZINC001098350526	1363305675	/nfs/dbraw/zinc/30/56/75/1363305675.db2.gz	IYDGLQYVHMLPBP-NJYVYQBISA-N	0	3	332.447	3.127	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](C)c1ccc(F)cc1F)C2	ZINC001098441279	1363326829	/nfs/dbraw/zinc/32/68/29/1363326829.db2.gz	IRWQPJDWVLWSDQ-FOZNTRSISA-N	0	3	334.410	3.366	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@]1(C)CCc3ccccc3C1)C2	ZINC001098532203	1363357092	/nfs/dbraw/zinc/35/70/92/1363357092.db2.gz	WLWOSGHUGIYYGL-XWSHUIEDSA-N	0	3	338.495	3.479	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1CCCCCC1)C[C@H](C)O2	ZINC001098570619	1363382042	/nfs/dbraw/zinc/38/20/42/1363382042.db2.gz	JSHVRQRVCADRLK-KRWDZBQOSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@]1(C)CC=CCC1)C[C@H](C)O2	ZINC001098599738	1363393708	/nfs/dbraw/zinc/39/37/08/1363393708.db2.gz	KLOQKUAACMGKFB-HKUYNNGSSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H]1C[C@H]1CC(C)(C)C)C[C@H](C)O2	ZINC001098603857	1363395068	/nfs/dbraw/zinc/39/50/68/1363395068.db2.gz	ZWFDRXCALQGAPP-OKZBNKHCSA-N	0	3	348.531	3.327	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1(C3CCC3)CCC1)C[C@@H](C)O2	ZINC001098620217	1363401818	/nfs/dbraw/zinc/40/18/18/1363401818.db2.gz	UTDHNXHQZDNOAX-QGZVFWFLSA-N	0	3	346.515	3.225	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccc(F)c(C)c1)C[C@@H](C)O2	ZINC001098627035	1363405430	/nfs/dbraw/zinc/40/54/30/1363405430.db2.gz	HRZXRHZHCOXAQM-MRXNPFEDSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1cc[nH]c1C(C)C)C[C@H](C)O2	ZINC001098631360	1363406759	/nfs/dbraw/zinc/40/67/59/1363406759.db2.gz	VRHWSBBJNFYFAZ-INIZCTEOSA-N	0	3	345.487	3.020	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1(C)CCCCC1)C[C@@H](C)O2	ZINC001098632752	1363408017	/nfs/dbraw/zinc/40/80/17/1363408017.db2.gz	AJMXJKDCXTZCSI-QGZVFWFLSA-N	0	3	334.504	3.225	20	30		EGEDHN
C/C=C(\C)C(=O)N1CC[C@@H](n2cc(CNCCCCCCC)nn2)C1	ZINC001098650108	1363416994	/nfs/dbraw/zinc/41/69/94/1363416994.db2.gz	YKDNDDBBMGDURS-BDSVNUEJSA-N	0	3	347.507	3.078	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1(CC)CCCC1)C[C@H](C)O2	ZINC001098653926	1363419422	/nfs/dbraw/zinc/41/94/22/1363419422.db2.gz	RPGMMDRIOLTBHA-KRWDZBQOSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccc(CF)cc1)C[C@@H](C)O2	ZINC001098664670	1363426209	/nfs/dbraw/zinc/42/62/09/1363426209.db2.gz	VSVDCIFZIPQQQO-MRXNPFEDSA-N	0	3	346.446	3.038	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3CCC[C@]3(NC(=O)C3CCCC3)C2)cc1	ZINC001098684698	1363434420	/nfs/dbraw/zinc/43/44/20/1363434420.db2.gz	WZCFEMWJBJAOIW-FPOVZHCZSA-N	0	3	337.467	3.219	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CCC[C@]3(NC(=O)C=C3CCC3)C2)c1	ZINC001098788075	1363468321	/nfs/dbraw/zinc/46/83/21/1363468321.db2.gz	XYJWSXASBQDLMJ-FPOVZHCZSA-N	0	3	335.451	3.139	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(-c3ccncc3)o2)C1	ZINC001098872799	1363499948	/nfs/dbraw/zinc/49/99/48/1363499948.db2.gz	CDMKBFQAOYDHPY-JXFKEZNVSA-N	0	3	337.423	3.112	20	30		EGEDHN
C=CCCC(=O)NC[C@H]1CCC(C)(C)CN1CCn1nc(C)cc1C	ZINC001098966632	1363545260	/nfs/dbraw/zinc/54/52/60/1363545260.db2.gz	RPTMUOJEBZRTSL-GOSISDBHSA-N	0	3	346.519	3.073	20	30		EGEDHN
C=CCCC(=O)NC[C@@H]1CCC(C)(C)CN1Cc1ccc(CO)cc1	ZINC001098966876	1363545813	/nfs/dbraw/zinc/54/58/13/1363545813.db2.gz	VVIVAEPTIBMCKK-IBGZPJMESA-N	0	3	344.499	3.252	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC[C@@H]1CCC(C)(C)CN1CCOCC	ZINC001099093336	1363617812	/nfs/dbraw/zinc/61/78/12/1363617812.db2.gz	OQJBHUAOYDADQZ-SFHVURJKSA-N	0	3	336.520	3.398	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)C1(F)CCCC1	ZINC001099130859	1363643157	/nfs/dbraw/zinc/64/31/57/1363643157.db2.gz	TZHBFKHHTIGBNP-INIZCTEOSA-N	0	3	340.483	3.078	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)CCc1nc(C)cs1	ZINC001099139584	1363648862	/nfs/dbraw/zinc/64/88/62/1363648862.db2.gz	CIUNBERDGDIZNP-OAHLLOKOSA-N	0	3	335.517	3.177	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H](C)CC(F)F	ZINC001099145254	1363654178	/nfs/dbraw/zinc/65/41/78/1363654178.db2.gz	VUYACPMFBMAWGP-HUUCEWRRSA-N	0	3	346.462	3.087	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(C)n(C(C)C)c2C)C1	ZINC001099154462	1363660348	/nfs/dbraw/zinc/66/03/48/1363660348.db2.gz	FENTWALRVGNIQA-RXVVDRJESA-N	0	3	341.499	3.293	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H]1CCC(C)(C)CN1CCOC1CCC1	ZINC001099170285	1363668611	/nfs/dbraw/zinc/66/86/11/1363668611.db2.gz	FOGIJHHFHPHWJD-INIZCTEOSA-N	0	3	336.520	3.375	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H](C)c2ccc(F)c(F)c2)C1	ZINC001099171736	1363668872	/nfs/dbraw/zinc/66/88/72/1363668872.db2.gz	OCEHWEZBUXQYGO-UVFQYZLESA-N	0	3	346.421	3.062	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)C1(C(F)F)CCCC1	ZINC001099199386	1363688543	/nfs/dbraw/zinc/68/85/43/1363688543.db2.gz	MKFAWMTYFHIMTE-HNNXBMFYSA-N	0	3	340.458	3.442	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2cccc(F)c2C)C[C@H]1C(F)(F)F	ZINC001099254991	1363716790	/nfs/dbraw/zinc/71/67/90/1363716790.db2.gz	DWBRDLHBSXMPOM-UKRRQHHQSA-N	0	3	344.352	3.303	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H](C)CC(C)C	ZINC001099291307	1363734497	/nfs/dbraw/zinc/73/44/97/1363734497.db2.gz	GUYXUDPRPMSIHW-ROUUACIJSA-N	0	3	338.536	3.478	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)C1(CC)CCOCC1	ZINC001099290837	1363734771	/nfs/dbraw/zinc/73/47/71/1363734771.db2.gz	BPFIPRDWSCKNAI-QGZVFWFLSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H](C)Oc1ccccn1	ZINC001099316603	1363746609	/nfs/dbraw/zinc/74/66/09/1363746609.db2.gz	WTSMZJWMQKMCAI-IAGOWNOFSA-N	0	3	345.487	3.032	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)CC[C@H]1CC(C)(C)CO1	ZINC001099321060	1363749448	/nfs/dbraw/zinc/74/94/48/1363749448.db2.gz	PKRLVNBNYQRUDG-SJORKVTESA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2cc(Cl)ccc2C)C[C@H]1C(F)(F)F	ZINC001099322272	1363749834	/nfs/dbraw/zinc/74/98/34/1363749834.db2.gz	NNNDEZFRAKIELW-ZIAGYGMSSA-N	0	3	346.780	3.427	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)COc1ccccc1C	ZINC001099324698	1363751332	/nfs/dbraw/zinc/75/13/32/1363751332.db2.gz	QLGPNKPXEXWNJV-QGZVFWFLSA-N	0	3	330.472	3.167	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2cc(C(C)C)oc2C)C[C@H]1C(F)(F)F	ZINC001099327413	1363752874	/nfs/dbraw/zinc/75/28/74/1363752874.db2.gz	KSSVTLUOLPUGLK-ZIAGYGMSSA-N	0	3	344.377	3.490	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)COc1ccc(C)cc1	ZINC001099329872	1363753526	/nfs/dbraw/zinc/75/35/26/1363753526.db2.gz	WNZKVJYIHZRPKO-KRWDZBQOSA-N	0	3	330.472	3.167	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)COc1cccc(CC)c1	ZINC001099329818	1363753679	/nfs/dbraw/zinc/75/36/79/1363753679.db2.gz	UZSLGTAJLRDSCO-GOSISDBHSA-N	0	3	344.499	3.421	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)C[C@@H](C)n1nc(C)cc1C	ZINC001099338905	1363759169	/nfs/dbraw/zinc/75/91/69/1363759169.db2.gz	BWXXBQRQIMQRPN-QZTJIDSGSA-N	0	3	346.519	3.244	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@H]2CCCC(C)(C)C2)C[C@H]1C(F)(F)F	ZINC001099347452	1363763849	/nfs/dbraw/zinc/76/38/49/1363763849.db2.gz	LEGHLDSNIVBERT-BFHYXJOUSA-N	0	3	332.410	3.368	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)Cc1csc(CC)n1	ZINC001099354419	1363769169	/nfs/dbraw/zinc/76/91/69/1363769169.db2.gz	SAPHZBKGOHXLCQ-MRXNPFEDSA-N	0	3	349.544	3.431	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2cc(C)no2)C1	ZINC001099488721	1363817355	/nfs/dbraw/zinc/81/73/55/1363817355.db2.gz	PYAMICUMKLENME-VDGAXYAQSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)[C@@H](C)CCCC)CC2(CCOCC2)C1	ZINC001099579329	1363861948	/nfs/dbraw/zinc/86/19/48/1363861948.db2.gz	OZTRPCYXURWIBM-ROUUACIJSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)C[C@@H](C)CC(C)C)CC2(CCOCC2)C1	ZINC001099597017	1363879926	/nfs/dbraw/zinc/87/99/26/1363879926.db2.gz	QLVYQBGTMJKETE-ROUUACIJSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CCN(Cc2ccccc2C(C)C)C[C@@H]1O	ZINC001099959100	1363991139	/nfs/dbraw/zinc/99/11/39/1363991139.db2.gz	CGSOSHPJKVPHJQ-MOPGFXCFSA-N	0	3	344.499	3.074	20	30		EGEDHN
C=CCCC(=O)NCC1CC(N[C@H]2CCc3c2c(F)ccc3F)C1	ZINC001100176967	1364036121	/nfs/dbraw/zinc/03/61/21/1364036121.db2.gz	OPFOCHLAHOQJBE-FVKWTLKZSA-N	0	3	334.410	3.403	20	30		EGEDHN
CC(C)(C)/C=C\C(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100192962	1364040760	/nfs/dbraw/zinc/04/07/60/1364040760.db2.gz	QYWDWMHPZZRBOR-KHPPLWFESA-N	0	3	342.458	3.264	20	30		EGEDHN
CC(C)(C)/C=C/C(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1	ZINC001100192618	1364040916	/nfs/dbraw/zinc/04/09/16/1364040916.db2.gz	ILTGXSLNCDBBOA-VOTSOKGWSA-N	0	3	343.446	3.284	20	30		EGEDHN
C[C@H](C(=O)NCC1CC(NCC#Cc2ccc(Cl)cc2)C1)C1CC1	ZINC001100224197	1364049304	/nfs/dbraw/zinc/04/93/04/1364049304.db2.gz	GMHCRHPMGHZVLT-ASFAAARLSA-N	0	3	344.886	3.222	20	30		EGEDHN
O=C(CCC1CCC1)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100226822	1364050915	/nfs/dbraw/zinc/05/09/15/1364050915.db2.gz	SUNILGCAAZEMJB-UHFFFAOYSA-N	0	3	342.458	3.242	20	30		EGEDHN
CC[C@H](NC1CC(CNC(=O)C#CC2CC2)C1)c1ccc(F)cc1F	ZINC001100315121	1364077861	/nfs/dbraw/zinc/07/78/61/1364077861.db2.gz	UORPXSQNBPRYEI-KJXMEXGPSA-N	0	3	346.421	3.314	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCC1CC(NCc2c(C)onc2CC)C1	ZINC001100364464	1364092557	/nfs/dbraw/zinc/09/25/57/1364092557.db2.gz	GUUJDMLPTVUDIW-UHFFFAOYSA-N	0	3	333.476	3.132	20	30		EGEDHN
CC(C)C(C)(C)C(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1	ZINC001100365418	1364092940	/nfs/dbraw/zinc/09/29/40/1364092940.db2.gz	AGAJNTQWGHYZPP-UHFFFAOYSA-N	0	3	345.462	3.364	20	30		EGEDHN
C#CCC1(C(=O)NCC2CC(NCc3cccc(F)c3F)C2)CCC1	ZINC001100396896	1364101748	/nfs/dbraw/zinc/10/17/48/1364101748.db2.gz	ZGRYXYHSGSCDEL-UHFFFAOYSA-N	0	3	346.421	3.143	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)C[C@@H]2CC=CCC2)C1	ZINC001100572380	1364168621	/nfs/dbraw/zinc/16/86/21/1364168621.db2.gz	ASURWYRRPULGJT-WLYUNCDWSA-N	0	3	341.293	3.126	20	30		EGEDHN
CC#CCCCC(=O)NCC1CC(NCc2ccc(F)cc2F)C1	ZINC001100590321	1364177658	/nfs/dbraw/zinc/17/76/58/1364177658.db2.gz	UQTLPJOWTRFTMP-UHFFFAOYSA-N	0	3	334.410	3.143	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCC1CC(NCc2oc(CC)nc2C)C1	ZINC001100597433	1364181612	/nfs/dbraw/zinc/18/16/12/1364181612.db2.gz	VFXZPHAVJCVTHM-QQFBHYJXSA-N	0	3	333.476	3.132	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H](CCC)c2ccccn2)C1	ZINC001100610925	1364187877	/nfs/dbraw/zinc/18/78/77/1364187877.db2.gz	CCSVAITVAGANNJ-GPANFISMSA-N	0	3	335.879	3.202	20	30		EGEDHN
C=CCCCC(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100623612	1364194281	/nfs/dbraw/zinc/19/42/81/1364194281.db2.gz	XDIQVZVZZLECQW-UHFFFAOYSA-N	0	3	328.431	3.018	20	30		EGEDHN
CC(C)C1(C(=O)NCC2CC(NCc3ccc(C#N)cc3F)C2)CC1	ZINC001100658880	1364207300	/nfs/dbraw/zinc/20/73/00/1364207300.db2.gz	AQQDVDIZDLJNEW-UHFFFAOYSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)Cc2c[nH]c3ccc(F)cc23)C1	ZINC001100705655	1364228454	/nfs/dbraw/zinc/22/84/54/1364228454.db2.gz	OATBJBTTYZUKNA-UHFFFAOYSA-N	0	3	349.837	3.086	20	30		EGEDHN
CC[C@H](C)CCC(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100780353	1364259462	/nfs/dbraw/zinc/25/94/62/1364259462.db2.gz	NZPSOQBNLLTYEH-KKXNLOMOSA-N	0	3	326.484	3.349	20	30		EGEDHN
CC(C)C[C@@H](C)C(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100795572	1364265084	/nfs/dbraw/zinc/26/50/84/1364265084.db2.gz	ACNKGHZDKUTWIS-PPDQVPDSSA-N	0	3	344.474	3.344	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)C2(CC)CCCC2)C1	ZINC001100815278	1364275859	/nfs/dbraw/zinc/27/58/59/1364275859.db2.gz	QAQULMCGUPWZOL-UHFFFAOYSA-N	0	3	343.309	3.350	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)Cc2c(F)cccc2Cl)C1	ZINC001100909854	1364327230	/nfs/dbraw/zinc/32/72/30/1364327230.db2.gz	NPKOWYZDDOPQED-UHFFFAOYSA-N	0	3	345.245	3.259	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)CCOc2cccc(C)c2)C1	ZINC001100977966	1364354778	/nfs/dbraw/zinc/35/47/78/1364354778.db2.gz	CWURYFOLONCLQU-UHFFFAOYSA-N	0	3	336.863	3.001	20	30		EGEDHN
C=C(C)CN1CC[C@H](Oc2ccnc(CNC(=O)[C@H](C)C(C)C)c2)C1	ZINC001101097013	1364412647	/nfs/dbraw/zinc/41/26/47/1364412647.db2.gz	HBQRTMZEFBNJCG-APWZRJJASA-N	0	3	345.487	3.019	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@@]2(C)C1	ZINC001101327770	1364510418	/nfs/dbraw/zinc/51/04/18/1364510418.db2.gz	AYABGDXXQHGQQY-KOEQVJQHSA-N	0	3	349.478	3.361	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@H]2CN(CCC(F)(F)F)C[C@@]2(C)C1	ZINC001101338089	1364516499	/nfs/dbraw/zinc/51/64/99/1364516499.db2.gz	WSJZBGNNFYPYBF-LZWOXQAQSA-N	0	3	332.410	3.321	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@H]3CN(Cc4ccccn4)C[C@@]3(C)C2)CCC1	ZINC001101353681	1364523682	/nfs/dbraw/zinc/52/36/82/1364523682.db2.gz	DWPHTFYVVIBZQN-XLIONFOSSA-N	0	3	339.483	3.108	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)[C@@H](CC(C)C)c3ccccc3)C[C@]2(C)C1	ZINC001101386983	1364540479	/nfs/dbraw/zinc/54/04/79/1364540479.db2.gz	JRAODUSOXMCYSW-URVUXULASA-N	0	3	338.495	3.230	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC2(CN(CC3CCCCC3)C2)n2ccnc21	ZINC001101615305	1364656839	/nfs/dbraw/zinc/65/68/39/1364656839.db2.gz	GGCVXHUQOUUZIY-KRWDZBQOSA-N	0	3	342.487	3.002	20	30		EGEDHN
C=CCC[C@@H](C)N1CC2(C1)C[C@H](NC(=O)CCC(=C)C)c1nccn12	ZINC001101630329	1364662096	/nfs/dbraw/zinc/66/20/96/1364662096.db2.gz	DUENHBQPFRIZCI-SJORKVTESA-N	0	3	342.487	3.166	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CC2(CN(CCC(C)C)C2)n2ccnc21	ZINC001101645500	1364668539	/nfs/dbraw/zinc/66/85/39/1364668539.db2.gz	CNWMPLJUIJNVPK-MRXNPFEDSA-N	0	3	344.503	3.103	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1CNC(=O)C[C@H]1C=CCC1	ZINC001101713874	1364701065	/nfs/dbraw/zinc/70/10/65/1364701065.db2.gz	ZRWKGDVJYJWTEL-HLAWJBBLSA-N	0	3	336.479	3.079	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC[C@@H]1CN(Cc2cncs2)C[C@H]1C	ZINC001101997827	1364804651	/nfs/dbraw/zinc/80/46/51/1364804651.db2.gz	JGBROWWNAKFMGN-GDBMZVCRSA-N	0	3	333.501	3.096	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C	ZINC001102261284	1364973991	/nfs/dbraw/zinc/97/39/91/1364973991.db2.gz	ULHKKXIDXXHHES-QKNQBKEWSA-N	0	3	338.495	3.325	20	30		EGEDHN
CCC(C)(C)C(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001102299354	1364990106	/nfs/dbraw/zinc/99/01/06/1364990106.db2.gz	XZMIQUWUTCSRPT-ZIAGYGMSSA-N	0	3	333.501	3.240	20	30		EGEDHN
CCCCCCCCC(=O)NC[C@@H]1CN(Cc2cncn2C)C[C@H]1C	ZINC001102527272	1365100144	/nfs/dbraw/zinc/10/01/44/1365100144.db2.gz	QOVMIDNBEVUQFT-QZTJIDSGSA-N	0	3	348.535	3.355	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H]2CN(Cc3cncs3)C[C@H]2C)CCCC1	ZINC001102620987	1365140017	/nfs/dbraw/zinc/14/00/17/1365140017.db2.gz	DQFPTVDMOAGXOM-HZPDHXFCSA-N	0	3	347.528	3.464	20	30		EGEDHN
CCCC(=O)NCC[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1C	ZINC001102636962	1365147002	/nfs/dbraw/zinc/14/70/02/1365147002.db2.gz	GJFGKXCITHJDHG-GDBMZVCRSA-N	0	3	331.435	3.072	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2sccc2C)C1	ZINC001102640801	1365149334	/nfs/dbraw/zinc/14/93/34/1365149334.db2.gz	KXKABCAATSWZHA-TZMCWYRMSA-N	0	3	326.893	3.497	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)Cc2ccsc2)C1	ZINC001102646413	1365154022	/nfs/dbraw/zinc/15/40/22/1365154022.db2.gz	LXOLSAJTBFIONJ-IUODEOHRSA-N	0	3	326.893	3.117	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1CCNC(=O)C1CC=CC1	ZINC001102807741	1365229476	/nfs/dbraw/zinc/22/94/76/1365229476.db2.gz	AFIDDIIIEQXHTK-VQIMIIECSA-N	0	3	337.467	3.099	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cncc(CC)c2)C1	ZINC001103234052	1365447476	/nfs/dbraw/zinc/44/74/76/1365447476.db2.gz	YOYJSFXLZONSKN-CZUORRHYSA-N	0	3	335.879	3.084	20	30		EGEDHN
C=CC(C)(C)C(=O)NCC[C@@H]1CN([C@@H](C)c2ncc(C)o2)C[C@H]1C	ZINC001103311847	1365487479	/nfs/dbraw/zinc/48/74/79/1365487479.db2.gz	NXVXJQOKWUBZOS-VNQPRFMTSA-N	0	3	333.476	3.330	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cc[nH]c2CCC)C1	ZINC001103352019	1365514444	/nfs/dbraw/zinc/51/44/44/1365514444.db2.gz	VWMREPNLLZVHTC-UKRRQHHQSA-N	0	3	337.895	3.408	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)Cc2cccc(F)c2)C1	ZINC001103698101	1365736558	/nfs/dbraw/zinc/73/65/58/1365736558.db2.gz	GGRJGXJPQQZWOD-CZUORRHYSA-N	0	3	338.854	3.195	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cc(C)n(C)c2C)C1	ZINC001103707992	1365743678	/nfs/dbraw/zinc/74/36/78/1365743678.db2.gz	PVEFPBFRZHAPLZ-MLGOLLRUSA-N	0	3	337.895	3.082	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CN(C(=O)[C@@H](C)CC)C[C@H]1C	ZINC001103902874	1365828738	/nfs/dbraw/zinc/82/87/38/1365828738.db2.gz	VZFVYWNBTQXSFS-OUCADQQQSA-N	0	3	331.298	3.015	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CN(C(=O)CCCC)C[C@H]1C	ZINC001103892402	1365826267	/nfs/dbraw/zinc/82/62/67/1365826267.db2.gz	OZJLEQDNVQNUIS-TZMCWYRMSA-N	0	3	331.298	3.159	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cc(F)ccc2F)C[C@H]1C	ZINC001104293732	1365977612	/nfs/dbraw/zinc/97/76/12/1365977612.db2.gz	ARRDDSLFDHUFST-DGCLKSJQSA-N	0	3	342.817	3.405	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)C[C@H](C)c2ccncc2)C[C@H]1C	ZINC001104346932	1365982434	/nfs/dbraw/zinc/98/24/34/1365982434.db2.gz	LOBYGXNFDDNWLK-HDMKZQKVSA-N	0	3	349.906	3.402	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C(CC=C)CC=C)CC1	ZINC001105392351	1366441044	/nfs/dbraw/zinc/44/10/44/1366441044.db2.gz	YNMOEVOEMPJWQM-FQEVSTJZSA-N	0	3	340.511	3.481	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@@H](C)CC(C)C)CC1	ZINC001105396015	1366444467	/nfs/dbraw/zinc/44/44/67/1366444467.db2.gz	GZOJRHRZSGNYQD-HKUYNNGSSA-N	0	3	330.516	3.395	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(c2ccccc2)C[C@H](NC(=O)C(C)(F)F)C1	ZINC001105400937	1366448071	/nfs/dbraw/zinc/44/80/71/1366448071.db2.gz	JOIDCFWBOBTFBV-KDYLLFBJSA-N	0	3	342.817	3.200	20	30		EGEDHN
CCCCCCCNCc1cn([C@@H]2CCCN(C(=O)CCC)C2)nn1	ZINC001185842840	1387812797	/nfs/dbraw/zinc/81/27/97/1387812797.db2.gz	MSYSSPIRLHKZSF-GOSISDBHSA-N	0	3	349.523	3.302	20	30		EGEDHN
C#CCC[NH2+]CC1([C@@H]2CCCCN2C(=O)c2ccccc2[O-])CCC1	ZINC001105508581	1366499444	/nfs/dbraw/zinc/49/94/44/1366499444.db2.gz	FCVSORZTBAHMMJ-IBGZPJMESA-N	0	3	340.467	3.170	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](CNCc2csc(CCC)n2)[C@H](C)C1	ZINC001105926902	1366599627	/nfs/dbraw/zinc/59/96/27/1366599627.db2.gz	MWLNYZUWSXFWDC-HUUCEWRRSA-N	0	3	335.517	3.246	20	30		EGEDHN
CCC[C@H](C)C(=O)N1C[C@@H](CNCc2cc(F)ccc2C#N)[C@H](C)C1	ZINC001105958299	1366602051	/nfs/dbraw/zinc/60/20/51/1366602051.db2.gz	ANQFBTDFFKGUJJ-HDMKZQKVSA-N	0	3	345.462	3.318	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H](CNCc2csc(CC)n2)[C@H](C)C1	ZINC001106563544	1366737284	/nfs/dbraw/zinc/73/72/84/1366737284.db2.gz	DFDCPMYWSWSEJW-BZUAXINKSA-N	0	3	349.544	3.492	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@@H](CNCc2ncc(C)s2)[C@H](C)C1	ZINC001106567734	1366739697	/nfs/dbraw/zinc/73/96/97/1366739697.db2.gz	RBRQTZHSTQINMZ-VNQPRFMTSA-N	0	3	335.517	3.238	20	30		EGEDHN
CC[C@H](C)C(=O)NC[C@]12CCC[C@H]1N(CC#Cc1ccccc1)CC2	ZINC001107286465	1366916511	/nfs/dbraw/zinc/91/65/11/1366916511.db2.gz	IZQOGBRTXMSIDM-CZTZKLFOSA-N	0	3	338.495	3.445	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](N(C)Cc2cccc(OC(C)C)c2)C1	ZINC001189280761	1366975651	/nfs/dbraw/zinc/97/56/51/1366975651.db2.gz	WQYOKWALAQPBRL-SFHVURJKSA-N	0	3	330.472	3.473	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](N(C)CCOc2cc(C)cc(C)c2)C1	ZINC001189318589	1366988433	/nfs/dbraw/zinc/98/84/33/1366988433.db2.gz	MYXMGBIENPCRMU-GOSISDBHSA-N	0	3	330.472	3.181	20	30		EGEDHN
C=CCCCC(=O)NC[C@]12CCC[C@H]1N(Cc1ccccn1)CC2	ZINC001107524384	1367018909	/nfs/dbraw/zinc/01/89/09/1367018909.db2.gz	XFNYKGXXZQOOCQ-UYAOXDASSA-N	0	3	327.472	3.299	20	30		EGEDHN
C=CCOCCCC(=O)N1CC[C@H](N(C)[C@H](C)c2cccc(F)c2)C1	ZINC001189539256	1367048107	/nfs/dbraw/zinc/04/81/07/1367048107.db2.gz	YSRCLCPZVJTKPY-APWZRJJASA-N	0	3	348.462	3.402	20	30		EGEDHN
CC[C@H](CC(=O)NC[C@]12CCC[C@H]1N(CC#CCOC)CC2)C(C)C	ZINC001107611885	1367072103	/nfs/dbraw/zinc/07/21/03/1367072103.db2.gz	IKPUUMQBGPONKH-SFHLNBCPSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2cccc(F)c2)C1	ZINC001107706189	1367112354	/nfs/dbraw/zinc/11/23/54/1367112354.db2.gz	IHRKEIYLAGGOEG-HNAYVOBHSA-N	0	3	334.435	3.001	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](N(C)[C@@H]2CCc3c2cc(F)cc3F)C1	ZINC001189911279	1367130026	/nfs/dbraw/zinc/13/00/26/1367130026.db2.gz	ZUZIQKJBZQFHSK-HNAYVOBHSA-N	0	3	346.421	3.288	20	30		EGEDHN
CCCC[C@H](C)C(=O)N1CC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001189972178	1367142932	/nfs/dbraw/zinc/14/29/32/1367142932.db2.gz	FYBWAZSVQOJLNO-QFBILLFUSA-N	0	3	327.472	3.417	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCc1ccc(OC)c(F)c1)C2	ZINC001109515757	1367170891	/nfs/dbraw/zinc/17/08/91/1367170891.db2.gz	WUDGZSBMEZXIMF-NJAFHUGGSA-N	0	3	346.446	3.065	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2C[C@@H](OC)c1ccccc1	ZINC001109604278	1367227452	/nfs/dbraw/zinc/22/74/52/1367227452.db2.gz	BITLXVQXDNMGBQ-YDZRNGNQSA-N	0	3	342.483	3.308	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](N(C)C[C@@H](O)c2ccccc2)C1	ZINC001190354815	1367237130	/nfs/dbraw/zinc/23/71/30/1367237130.db2.gz	QQFZXLGFIOKRNU-VQTJNVASSA-N	0	3	342.483	3.021	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2ccc(CCC)s2)C1	ZINC001190388153	1367248565	/nfs/dbraw/zinc/24/85/65/1367248565.db2.gz	KZDBGGGRERPRLK-HNNXBMFYSA-N	0	3	336.501	3.050	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](N(C)CCOc2ccc(F)cc2)C1	ZINC001190388007	1367248690	/nfs/dbraw/zinc/24/86/90/1367248690.db2.gz	JXROAHJNJUZOSZ-KRWDZBQOSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)[C@@H](C)CCCc3ccccc3)[C@@H]2C1	ZINC001190400687	1367255532	/nfs/dbraw/zinc/25/55/32/1367255532.db2.gz	FLCFQTDMPPJNQI-YSIASYRMSA-N	0	3	326.484	3.364	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)Cc2ccc(C)cc2)C1	ZINC001108058687	1367261732	/nfs/dbraw/zinc/26/17/32/1367261732.db2.gz	FIBBADRSJMDVQH-GHTZIAJQSA-N	0	3	344.499	3.099	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](N(C)CCOCc2ccccc2)C1	ZINC001190436624	1367265251	/nfs/dbraw/zinc/26/52/51/1367265251.db2.gz	YQCKWPOFLHBIRA-IBGZPJMESA-N	0	3	330.472	3.092	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](N(C)Cc2ccc(OC)c(C)c2)C1	ZINC001190435931	1367265394	/nfs/dbraw/zinc/26/53/94/1367265394.db2.gz	MLTIRWSILFAKSR-SFHVURJKSA-N	0	3	330.472	3.393	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3C[C@H]2CCCCO2)CC1	ZINC001109681620	1367280129	/nfs/dbraw/zinc/28/01/29/1367280129.db2.gz	BHGXKUVIJLDHES-BDXSIMOUSA-N	0	3	332.488	3.023	20	30		EGEDHN
C=CCCCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1conc1CC)C2	ZINC001109689571	1367283273	/nfs/dbraw/zinc/28/32/73/1367283273.db2.gz	JPZRDVHNBMZLDX-JLSDUUJJSA-N	0	3	331.460	3.319	20	30		EGEDHN
CC(C)CC1(C(=O)N2CC[C@@H](N(C)Cc3ccc(C#N)cc3)C2)CC1	ZINC001190593604	1367301486	/nfs/dbraw/zinc/30/14/86/1367301486.db2.gz	BRLQOJWVZQAVIB-LJQANCHMSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2cc[nH]c2C2CC2)C1	ZINC001108164094	1367318510	/nfs/dbraw/zinc/31/85/10/1367318510.db2.gz	UBPXUMKFMXZYRM-YWZLYKJASA-N	0	3	345.487	3.068	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@]1(C)CN(C[C@H](C)CC(C)C)CCO1	ZINC001108246783	1367360425	/nfs/dbraw/zinc/36/04/25/1367360425.db2.gz	VECFYHZNMPCTIO-YLJYHZDGSA-N	0	3	338.536	3.478	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)CCc2ccccc2)C1	ZINC001108363111	1367412316	/nfs/dbraw/zinc/41/23/16/1367412316.db2.gz	WHNVNGDJTKCWBH-RXVVDRJESA-N	0	3	344.499	3.181	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)Cc2cccc(C(C)C)c2)C1	ZINC001191145605	1367432418	/nfs/dbraw/zinc/43/24/18/1367432418.db2.gz	XGDMCWCRNBBRPK-FQEVSTJZSA-N	0	3	344.499	3.088	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](C)CCC(C)(C)C)C2	ZINC001109981020	1367442012	/nfs/dbraw/zinc/44/20/12/1367442012.db2.gz	KUSNDAGOKRJLGB-MHORFTMASA-N	0	3	336.520	3.373	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc3nc(C)ccc3o1)C2	ZINC001110011311	1367457706	/nfs/dbraw/zinc/45/77/06/1367457706.db2.gz	ZVLPLTBPIZZGGM-VYDXJSESSA-N	0	3	339.439	3.438	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CN([C@H](C)c2cccc3ccccc32)C[C@H]1O	ZINC001191651881	1367554100	/nfs/dbraw/zinc/55/41/00/1367554100.db2.gz	LMMFTVNOERWZQQ-CDHQVMDDSA-N	0	3	338.451	3.028	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](N(C)CCOc2ccccc2F)C1	ZINC001191697083	1367563534	/nfs/dbraw/zinc/56/35/34/1367563534.db2.gz	RSJHRAKAGRCXRW-MRXNPFEDSA-N	0	3	348.462	3.340	20	30		EGEDHN
CC#CCN1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)CCC)C1	ZINC001186155929	1387884481	/nfs/dbraw/zinc/88/44/81/1387884481.db2.gz	KMOWCRMDJDTZEI-IEBWSBKVSA-N	0	3	330.447	3.171	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCN(C(=O)CCCC2CC2)C1	ZINC001191859677	1367616514	/nfs/dbraw/zinc/61/65/14/1367616514.db2.gz	PMMOGMSLEIZKRX-IBGZPJMESA-N	0	3	325.456	3.171	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H](N(C)Cc2cccc(OC)c2)C1	ZINC001191867717	1367620223	/nfs/dbraw/zinc/62/02/23/1367620223.db2.gz	HFCRNEJHAWTLQA-FUHWJXTLSA-N	0	3	330.472	3.330	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H](N(C)Cc2cccc(COC)c2)C1	ZINC001191867836	1367621193	/nfs/dbraw/zinc/62/11/93/1367621193.db2.gz	JMXMYZAOYFPFLX-FXAWDEMLSA-N	0	3	344.499	3.468	20	30		EGEDHN
CCCC(C)(C)C(=O)N1CC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001192082760	1367683268	/nfs/dbraw/zinc/68/32/68/1367683268.db2.gz	MSHCBBKJDHOTNX-GOSISDBHSA-N	0	3	327.472	3.417	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](N(C)CCOCc3ccccc3)C2)C1	ZINC001192256623	1367731656	/nfs/dbraw/zinc/73/16/56/1367731656.db2.gz	IKUIAUUUSGTHNJ-LJQANCHMSA-N	0	3	342.483	3.092	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)C[C@@H](C)CCC=C(C)C)C1	ZINC001192472025	1367791778	/nfs/dbraw/zinc/79/17/78/1367791778.db2.gz	JIIHHBZNETVOGJ-OALUTQOASA-N	0	3	336.520	3.494	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2[C@@H]1CCc2ccccc21	ZINC001110543880	1367821958	/nfs/dbraw/zinc/82/19/58/1367821958.db2.gz	MGBMVBGOYQUNQR-AFYVEPGGSA-N	0	3	336.479	3.445	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](N(C)CCc2csc(C)n2)C1	ZINC001192586351	1367827176	/nfs/dbraw/zinc/82/71/76/1367827176.db2.gz	MXFFJBUQWSRFBR-MRXNPFEDSA-N	0	3	335.517	3.129	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCc1cccc(OC)c1F)C2	ZINC001110638873	1367884215	/nfs/dbraw/zinc/88/42/15/1367884215.db2.gz	VWIBIQBBULBHKP-ZACQAIPSSA-N	0	3	346.446	3.065	20	30		EGEDHN
CCC[C@H](CC)C(=O)N1CC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001193109440	1367946630	/nfs/dbraw/zinc/94/66/30/1367946630.db2.gz	IFRQHQMXQAVUHJ-RBUKOAKNSA-N	0	3	327.472	3.417	20	30		EGEDHN
C=CCC[C@@H](O)CN(CCNC(=O)OC(C)(C)C)Cc1ccccc1	ZINC001193117408	1367948809	/nfs/dbraw/zinc/94/88/09/1367948809.db2.gz	NNKVODZDEGZATA-GOSISDBHSA-N	0	3	348.487	3.340	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@@H]2CCC(C)=C(C)C2)C1	ZINC001193159128	1367956651	/nfs/dbraw/zinc/95/66/51/1367956651.db2.gz	WYQDKZSGTDIGFP-GUDVDZBRSA-N	0	3	334.504	3.031	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCc1ccc(C)cc1	ZINC001110897367	1368071381	/nfs/dbraw/zinc/07/13/81/1368071381.db2.gz	KDKCGYFOBWFCRH-QRVBRYPASA-N	0	3	326.484	3.471	20	30		EGEDHN
C=CCCCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cnoc1CC)C2	ZINC001111076632	1368152951	/nfs/dbraw/zinc/15/29/51/1368152951.db2.gz	PZJKOOWEKZCBRJ-OIISXLGYSA-N	0	3	331.460	3.319	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1oc(C(C)C)nc1C)C2	ZINC001111119652	1368162270	/nfs/dbraw/zinc/16/22/70/1368162270.db2.gz	AFXDDNZYQBJMNU-OAGGEKHMSA-N	0	3	331.460	3.408	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)[C@@]2(C)CCC(C)=C(C)C2)C1	ZINC001194360395	1368243274	/nfs/dbraw/zinc/24/32/74/1368243274.db2.gz	ZOISNUGWSSVCEN-QUCCMNQESA-N	0	3	334.504	3.248	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@@H](N(C)CCOC3CCC3)C2)CCCCC1	ZINC001194367517	1368245266	/nfs/dbraw/zinc/24/52/66/1368245266.db2.gz	HXEFMDFGVAWRQV-GOSISDBHSA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(OCCCC)cc1)C2	ZINC001111397814	1368293851	/nfs/dbraw/zinc/29/38/51/1368293851.db2.gz	OPUBYBRUXKCMNB-RLLQIKCJSA-N	0	3	340.467	3.224	20	30		EGEDHN
C=CCCCN1C[C@@H](O)[C@H](NC(=O)c2ccc(C3CCCC3)cc2)C1	ZINC001194737085	1368314590	/nfs/dbraw/zinc/31/45/90/1368314590.db2.gz	JIOBMVXPKGEVIE-WOJBJXKFSA-N	0	3	342.483	3.085	20	30		EGEDHN
C#CCCN1CC[C@]2(C1)C[C@H](NC(=O)CCC=C)c1ccccc1O2	ZINC001111529641	1368328817	/nfs/dbraw/zinc/32/88/17/1368328817.db2.gz	NNSOHYPQDHZLAC-GHTZIAJQSA-N	0	3	338.451	3.060	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)C[C@@H](NC(=O)/C(C)=C\C)c1ccccc1O2	ZINC001111529812	1368329550	/nfs/dbraw/zinc/32/95/50/1368329550.db2.gz	QBNAJOOJOGTSQO-RYZNGDDQSA-N	0	3	338.451	3.060	20	30		EGEDHN
C#CCCCC(=O)N[C@]12CCC[C@H]1CN(C/C=C/c1ccccc1)C2	ZINC001111730102	1368431682	/nfs/dbraw/zinc/43/16/82/1368431682.db2.gz	VVMBLSCLSLDSTK-JUCHWSRGSA-N	0	3	336.479	3.474	20	30		EGEDHN
O=C(N[C@@H]1CCCc2ccccc21)N1CCC2SC(=O)C=C2C1	ZINC001186430297	1387940553	/nfs/dbraw/zinc/94/05/53/1387940553.db2.gz	BQXTZUWJJFFHEJ-CVEARBPZSA-N	0	3	328.437	3.048	20	30		EGEDHN
C#CCN1C[C@@H]2CCC[C@]2(NC(=O)C[C@@H](C)c2ccc(CC)cc2)C1	ZINC001111869655	1368516946	/nfs/dbraw/zinc/51/69/46/1368516946.db2.gz	CSNHEEDBHSFLGQ-AGHHOFFYSA-N	0	3	338.495	3.347	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2CN([C@H](CC)c3ccccc3)C[C@H]2O)CC1	ZINC001195932390	1368518737	/nfs/dbraw/zinc/51/87/37/1368518737.db2.gz	ORMKWHYCSAKXIZ-GUDVDZBRSA-N	0	3	342.483	3.045	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2ccnn2C(F)F)CC1	ZINC001195966735	1368524370	/nfs/dbraw/zinc/52/43/70/1368524370.db2.gz	UXYRVUFPYIWMMY-UHFFFAOYSA-N	0	3	342.434	3.397	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cnc3n[nH]cc3c2)CC1	ZINC001196260053	1368577548	/nfs/dbraw/zinc/57/75/48/1368577548.db2.gz	UELGKRHAYCEDTA-UHFFFAOYSA-N	0	3	343.475	3.076	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(C)c(C)s2)C1	ZINC001111973386	1368582929	/nfs/dbraw/zinc/58/29/29/1368582929.db2.gz	KAAKDERZUVXZEL-LPHOPBHVSA-N	0	3	348.512	3.152	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H](O)[C@H](NC(=O)c2cc(C(C)(C)C)oc2C)C1	ZINC001196453796	1368618244	/nfs/dbraw/zinc/61/82/44/1368618244.db2.gz	UYANEYVWNIPJAE-IAOVAPTHSA-N	0	3	348.487	3.015	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CN([C@H](C)c2cc(C)ccc2C)C[C@H]1O	ZINC001196481593	1368625108	/nfs/dbraw/zinc/62/51/08/1368625108.db2.gz	DALMWNJPCLYKCO-BHIYHBOVSA-N	0	3	344.499	3.128	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H](C)CCOc2ccccc2)C1	ZINC001112026726	1368625323	/nfs/dbraw/zinc/62/53/23/1368625323.db2.gz	CIQRELBEMIQVMX-WFXMLNOXSA-N	0	3	342.483	3.248	20	30		EGEDHN
C=CCCCN1C[C@@H](O)[C@H](NC(=O)[C@H](CCC)CC2CCCC2)C1	ZINC001196623316	1368651493	/nfs/dbraw/zinc/65/14/93/1368651493.db2.gz	IJVDSLPXWPFVBS-GUDVDZBRSA-N	0	3	336.520	3.111	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)[C@@H](C)CC2CCCC2)C[C@H]1C(F)(F)F	ZINC001112173699	1368700902	/nfs/dbraw/zinc/70/09/02/1368700902.db2.gz	KYXDETREJXZMOR-NUEKZKHPSA-N	0	3	344.421	3.205	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H]2CCC[C@]2(CNCc2nc(C)cs2)C1	ZINC001112281937	1368747068	/nfs/dbraw/zinc/74/70/68/1368747068.db2.gz	BDADJSKDZRYSDY-YJBOKZPZSA-N	0	3	333.501	3.136	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cc(CC)nn2C)CC1	ZINC001197536346	1368834977	/nfs/dbraw/zinc/83/49/77/1368834977.db2.gz	BDPHHVPMCYDEMZ-UHFFFAOYSA-N	0	3	334.508	3.101	20	30		EGEDHN
C[C@H](C#N)c1ccc(NC(=O)c2ccc(CN3CC[C@@H](O)C3)cc2)cc1	ZINC001197611419	1368854669	/nfs/dbraw/zinc/85/46/69/1368854669.db2.gz	XZLJVDIKJOLALG-FOIQADDNSA-N	0	3	349.434	3.133	20	30		EGEDHN
C=CCC[C@@H](C)N1CCCN(C(=O)c2sccc2COC)CC1	ZINC001197809605	1368903640	/nfs/dbraw/zinc/90/36/40/1368903640.db2.gz	CSRVBKBQQLXVCC-OAHLLOKOSA-N	0	3	336.501	3.397	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N1CCCN([C@@H](C)c2ccccc2C)CC1	ZINC001198344196	1369012808	/nfs/dbraw/zinc/01/28/08/1369012808.db2.gz	RASKVZQGEFXPBU-ZWKOTPCHSA-N	0	3	330.472	3.181	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N1CCCN(CCCc2ccccc2C)CC1	ZINC001198345008	1369013166	/nfs/dbraw/zinc/01/31/66/1369013166.db2.gz	YWISKVKCUCWGPV-LJQANCHMSA-N	0	3	344.499	3.053	20	30		EGEDHN
C=CCC[C@@H](C(=O)N1CCCN(C[C@@H](C)OC)CC1)c1ccccc1	ZINC001198423085	1369030055	/nfs/dbraw/zinc/03/00/55/1369030055.db2.gz	KAYDDXFHSUYUSN-UYAOXDASSA-N	0	3	344.499	3.306	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)c1cc(C)on1)c1ccccc1OC	ZINC001198515775	1369050993	/nfs/dbraw/zinc/05/09/93/1369050993.db2.gz	QPXKOIVXOGDQPK-QGZVFWFLSA-N	0	3	343.427	3.019	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)c1ncoc1C)c1ccccc1OC	ZINC001198584240	1369065906	/nfs/dbraw/zinc/06/59/06/1369065906.db2.gz	DJNSKJPUPZGKQL-MRXNPFEDSA-N	0	3	343.427	3.019	20	30		EGEDHN
COc1ccccc1[C@@H](CNC(=O)[C@H](C)C#N)NCCCC1CCC1	ZINC001198617798	1369074517	/nfs/dbraw/zinc/07/45/17/1369074517.db2.gz	SPWYBCYBJXZURA-CRAIPNDOSA-N	0	3	343.471	3.182	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)C[C@H](C)SC)c1ccccc1OC	ZINC001198668840	1369087263	/nfs/dbraw/zinc/08/72/63/1369087263.db2.gz	VWAIJQXKERHHMC-HOCLYGCPSA-N	0	3	336.501	3.160	20	30		EGEDHN
C#CCCCC(=O)NC[C@@H](NCC1CC(C)C1)c1ccccc1OC	ZINC001198694443	1369092590	/nfs/dbraw/zinc/09/25/90/1369092590.db2.gz	IPDBJKVFTFABCJ-FAFZWHIHSA-N	0	3	342.483	3.292	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)c1ccsn1)c1ccccc1OC	ZINC001198766647	1369108245	/nfs/dbraw/zinc/10/82/45/1369108245.db2.gz	FMFKMMYVGAGBSL-MRXNPFEDSA-N	0	3	345.468	3.179	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H](NCCC=C)c2ccccc2OC)cc1	ZINC001198826265	1369122836	/nfs/dbraw/zinc/12/28/36/1369122836.db2.gz	HVRJJCUCOMLOKK-FQEVSTJZSA-N	0	3	348.446	3.313	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@H](C)c1ccco1)c1ccccc1OC	ZINC001198894995	1369142375	/nfs/dbraw/zinc/14/23/75/1369142375.db2.gz	NLPHWVISVKBEOJ-WBVHZDCISA-N	0	3	342.439	3.415	20	30		EGEDHN
CCCCCCCC[C@H](C)C(=O)N[C@@H]1CN(CCCC)C[C@H]1O	ZINC001198904168	1369145235	/nfs/dbraw/zinc/14/52/35/1369145235.db2.gz	BNIBLVRWDCLICX-RCCFBDPRSA-N	0	3	326.525	3.335	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)CCc2ccc(N(C)C)cc2)CC1	ZINC001113078728	1369185140	/nfs/dbraw/zinc/18/51/40/1369185140.db2.gz	WVNWZBVSSFFUPN-GOSISDBHSA-N	0	3	343.515	3.184	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@@H](CCC)CC(C)C)C1	ZINC001199252590	1369198233	/nfs/dbraw/zinc/19/82/33/1369198233.db2.gz	DPABAIQFYVUQBL-IPMKNSEASA-N	0	3	338.536	3.357	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CC/C=C/CCC)C[C@H]2O)CCCC1	ZINC001199567701	1369238075	/nfs/dbraw/zinc/23/80/75/1369238075.db2.gz	YDNSHHOEDIUWBP-IKSUFZCESA-N	0	3	334.504	3.031	20	30		EGEDHN
CCC[C@@H](CC)C(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001186630390	1387990280	/nfs/dbraw/zinc/99/02/80/1387990280.db2.gz	IDRBZZBJUTWZHK-NVXWUHKLSA-N	0	3	331.435	3.214	20	30		EGEDHN
CCCCCCCN1CCN(C(=O)[C@@H]2C[C@H](C)Cc3c[nH]nc32)CC1	ZINC001113257083	1369296478	/nfs/dbraw/zinc/29/64/78/1369296478.db2.gz	OZORZWDCJHEDMA-SJLPKXTDSA-N	0	3	346.519	3.190	20	30		EGEDHN
C=CCCC(=O)N1CCCO[C@@H](CNCc2sccc2Cl)C1	ZINC001200083310	1369313611	/nfs/dbraw/zinc/31/36/11/1369313611.db2.gz	GJGWJQPOONHXTF-ZDUSSCGKSA-N	0	3	342.892	3.075	20	30		EGEDHN
C#CCCCCC(=O)N1CCC(NCc2nc3ccccc3o2)CC1	ZINC001200139452	1369319915	/nfs/dbraw/zinc/31/99/15/1369319915.db2.gz	ALJXZKKXQRSIHT-UHFFFAOYSA-N	0	3	339.439	3.102	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC(NCc2ncc(C)s2)CC1	ZINC001200747162	1369422549	/nfs/dbraw/zinc/42/25/49/1369422549.db2.gz	BGGNNVPRSGBNHX-UHFFFAOYSA-N	0	3	333.501	3.301	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001200816563	1369433266	/nfs/dbraw/zinc/43/32/66/1369433266.db2.gz	ZJTYVWBQVQHLMQ-UHFFFAOYSA-N	0	3	329.419	3.134	20	30		EGEDHN
C=C(Br)CNC1CCN(C(=O)[C@@](C)(F)CCCC)CC1	ZINC001201348982	1369524922	/nfs/dbraw/zinc/52/49/22/1369524922.db2.gz	QWQVFUSJKAUJKN-HNNXBMFYSA-N	0	3	349.288	3.394	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)CCc2cc(F)ccc2F)CC1	ZINC001113681135	1369563274	/nfs/dbraw/zinc/56/32/74/1369563274.db2.gz	GOADJYYKFJSXIS-OAHLLOKOSA-N	0	3	336.426	3.396	20	30		EGEDHN
COc1ccc(C#N)cc1Nc1ccc(CN2CCN(C)CC2)cc1	ZINC001201584035	1369582987	/nfs/dbraw/zinc/58/29/87/1369582987.db2.gz	KAZZNCXXBXAMLA-UHFFFAOYSA-N	0	3	336.439	3.058	20	30		EGEDHN
C=CCOCc1nn(C)c2c1CN(CCCc1ccccc1)CC2	ZINC001201662382	1369600137	/nfs/dbraw/zinc/60/01/37/1369600137.db2.gz	XNGMRVITXPCIDW-UHFFFAOYSA-N	0	3	325.456	3.114	20	30		EGEDHN
CCCCCCCCN1C[C@H]2C[C@H](C(=O)NCc3ccco3)[C@@H](C1)O2	ZINC001201826031	1369630192	/nfs/dbraw/zinc/63/01/92/1369630192.db2.gz	LAECREJQOMTOJC-CEXWTWQISA-N	0	3	348.487	3.346	20	30		EGEDHN
CCCCCCCCCCS(=O)(=O)N1C[C@H]2CCN(C)C[C@H]2C1	ZINC001201834929	1369631115	/nfs/dbraw/zinc/63/11/15/1369631115.db2.gz	ATSHZAQOSHJFTJ-MSOLQXFVSA-N	0	3	344.565	3.340	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC(NC/C(Cl)=C/Cl)CC2)cc1	ZINC001201925437	1369644023	/nfs/dbraw/zinc/64/40/23/1369644023.db2.gz	MSIZZJXMQOOEOO-PTNGSMBKSA-N	0	3	337.250	3.181	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC(NCc2nc(C)sc2C)CC1	ZINC001202107538	1369688419	/nfs/dbraw/zinc/68/84/19/1369688419.db2.gz	BDOKLCVNKSPOOZ-ZDUSSCGKSA-N	0	3	335.517	3.443	20	30		EGEDHN
C#CCNC[C@@H]1CN(C(=O)[C@@](C)(CC)CCCCCC)CCCO1	ZINC001202108058	1369688805	/nfs/dbraw/zinc/68/88/05/1369688805.db2.gz	DOBVDTYGXGLQBQ-QUCCMNQESA-N	0	3	336.520	3.213	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC(NCC(=C)Br)CC1	ZINC001202130730	1369695896	/nfs/dbraw/zinc/69/58/96/1369695896.db2.gz	PEWPCLWOKJGMNS-CYBMUJFWSA-N	0	3	329.282	3.078	20	30		EGEDHN
CC#CCNC[C@@H]1CN(C(=O)[C@@](C)(CC)CCCCC)CCCO1	ZINC001202174124	1369706849	/nfs/dbraw/zinc/70/68/49/1369706849.db2.gz	QNIBWBFYDDWFHD-QUCCMNQESA-N	0	3	336.520	3.213	20	30		EGEDHN
C=CCCCC(=O)N1CCC(NCc2csc([N+](=O)[O-])c2)CC1	ZINC001202245652	1369722262	/nfs/dbraw/zinc/72/22/62/1369722262.db2.gz	KKYDXVKNTQJIPV-UHFFFAOYSA-N	0	3	337.445	3.093	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(N[C@@H](C)c3cnc(C)cn3)CC2)CCC1	ZINC001202372264	1369753563	/nfs/dbraw/zinc/75/35/63/1369753563.db2.gz	PLCRKGWFWFOMKN-INIZCTEOSA-N	0	3	342.487	3.173	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC(NCc2ccn(C(C)C)n2)CC1	ZINC001202688137	1369852086	/nfs/dbraw/zinc/85/20/86/1369852086.db2.gz	GQONYEWGBIPEEA-UHFFFAOYSA-N	0	3	332.492	3.147	20	30		EGEDHN
Cc1cc[nH]c1C(=O)N[C@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202824748	1369902914	/nfs/dbraw/zinc/90/29/14/1369902914.db2.gz	SSYRRKKYQYAANO-MOPGFXCFSA-N	0	3	347.462	3.005	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1C[C@H](NCc2ccccc2F)C12CCC2	ZINC001202830759	1369904064	/nfs/dbraw/zinc/90/40/64/1369904064.db2.gz	ACVHNFVFJFDRBX-ROUUACIJSA-N	0	3	328.431	3.146	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1C[C@H](NCc2cccc(Cl)n2)C12CCC2	ZINC001202845732	1369906391	/nfs/dbraw/zinc/90/63/91/1369906391.db2.gz	DPWFLJJLNNFUBY-JKSUJKDBSA-N	0	3	345.874	3.056	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1C[C@@H](NCc2conc2C)C12CCC2	ZINC001202951632	1369934887	/nfs/dbraw/zinc/93/48/87/1369934887.db2.gz	SKXWXUPIRYENSP-MSOLQXFVSA-N	0	3	343.471	3.268	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1C[C@@H](NCc2c(C)noc2CC)C12CCC2	ZINC001202986111	1369946290	/nfs/dbraw/zinc/94/62/90/1369946290.db2.gz	GSJPBVQNGCNEJY-MSOLQXFVSA-N	0	3	345.487	3.419	20	30		EGEDHN
CC(C)C[C@H](C)CC(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001187004074	1388038630	/nfs/dbraw/zinc/03/86/30/1388038630.db2.gz	IFLOSFFAMSZJND-MAUKXSAKSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC(C)C[C@@H](C)C(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001203108975	1369986401	/nfs/dbraw/zinc/98/64/01/1369986401.db2.gz	OVXOIJKMOKRYGG-MRXNPFEDSA-N	0	3	327.472	3.321	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)COC2CCCCC2)C12CCC2	ZINC001203122914	1369990042	/nfs/dbraw/zinc/99/00/42/1369990042.db2.gz	LVQGJUBPINBQQJ-HOTGVXAUSA-N	0	3	340.895	3.105	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1[C@H]2CN(CCc3ccccc3F)C[C@H]21	ZINC001114681646	1370022386	/nfs/dbraw/zinc/02/23/86/1370022386.db2.gz	XARIEDOPQGVWEV-VQFNDLOPSA-N	0	3	330.447	3.017	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1[C@H]2CN(Cc3cccc(OC)c3C)C[C@H]21	ZINC001114724071	1370046292	/nfs/dbraw/zinc/04/62/92/1370046292.db2.gz	FWCWTJHKIOKZEA-QKUWSGOFSA-N	0	3	342.483	3.152	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1[C@H]2CN(CCOC3CCCCCC3)C[C@H]21	ZINC001114729176	1370051008	/nfs/dbraw/zinc/05/10/08/1370051008.db2.gz	NRAHIJJBELIQON-XFIJJGBISA-N	0	3	348.531	3.375	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1[C@H]2CN(Cc3ccc(OC)c(C)c3)C[C@H]21	ZINC001114729477	1370051633	/nfs/dbraw/zinc/05/16/33/1370051633.db2.gz	SFDSFKHQWWZMDW-OCQZMCQHSA-N	0	3	342.483	3.152	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(CF)cc3)C[C@H]21	ZINC001114792729	1370083303	/nfs/dbraw/zinc/08/33/03/1370083303.db2.gz	WGXHZBPDKMCPLZ-XFKSJGNHSA-N	0	3	330.447	3.305	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1C[C@@H](NCc2ncccc2C)C12CCC2	ZINC001203341607	1370090002	/nfs/dbraw/zinc/09/00/02/1370090002.db2.gz	RWPARMSOAYMRJH-QZTJIDSGSA-N	0	3	327.472	3.263	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1C[C@H](NCc2ncccc2C)C12CCC2	ZINC001203341609	1370090126	/nfs/dbraw/zinc/09/01/26/1370090126.db2.gz	RWPARMSOAYMRJH-ZWKOTPCHSA-N	0	3	327.472	3.263	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2C[C@@H](NCc3ccccn3)C23CCC3)CC1	ZINC001203375910	1370104740	/nfs/dbraw/zinc/10/47/40/1370104740.db2.gz	SCOFJXAAONFHRH-QZTJIDSGSA-N	0	3	339.483	3.345	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1C[C@H](NCc2ccccn2)C12CCC2	ZINC001203450611	1370130640	/nfs/dbraw/zinc/13/06/40/1370130640.db2.gz	CUCUHCMKPZABHR-DLBZAZTESA-N	0	3	327.472	3.201	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1C[C@@H](NCc2conc2C)C12CCC2	ZINC001203453029	1370132437	/nfs/dbraw/zinc/13/24/37/1370132437.db2.gz	QWYPZNDCSVRXSW-HZPDHXFCSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C(Br)CNC1CCN(C(=O)CCCCCC)CC1	ZINC001203574373	1370176159	/nfs/dbraw/zinc/17/61/59/1370176159.db2.gz	UWIPXTTYLFLGGB-UHFFFAOYSA-N	0	3	331.298	3.446	20	30		EGEDHN
Cc1c[nH]cc1C(=O)N[C@@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001203720469	1370234278	/nfs/dbraw/zinc/23/42/78/1370234278.db2.gz	DIGCSWURTZNNAE-WOJBJXKFSA-N	0	3	347.462	3.005	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CCN(Cc3cccc(O)c3)C2)C1	ZINC001203859180	1370291741	/nfs/dbraw/zinc/29/17/41/1370291741.db2.gz	HHCLETQJRSYGRH-IBGZPJMESA-N	0	3	330.428	3.003	20	30		EGEDHN
C=CCO[C@@H]1CO[C@@]2(C1)CCCN(Cc1ccc(OC)c(C)c1)C2	ZINC001203896154	1370304122	/nfs/dbraw/zinc/30/41/22/1370304122.db2.gz	HWQFDPWUMRAVFM-AZUAARDMSA-N	0	3	331.456	3.330	20	30		EGEDHN
CC[C@@H](CC(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1)C(C)C	ZINC001187208582	1388071944	/nfs/dbraw/zinc/07/19/44/1388071944.db2.gz	QBGLJJTWIOSWCQ-FUHWJXTLSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3c(C)[nH]c4ccccc43)C2)C1=O	ZINC001204290522	1370433023	/nfs/dbraw/zinc/43/30/23/1370433023.db2.gz	SKBINXKXKCKZBH-OAQYLSRUSA-N	0	3	337.467	3.477	20	30		EGEDHN
C=CCOc1ccc(CN2CCC[C@@]3(C[C@H](OCC)CO3)C2)cc1	ZINC001204299870	1370436071	/nfs/dbraw/zinc/43/60/71/1370436071.db2.gz	GHWSJNNLGZKYAS-VQTJNVASSA-N	0	3	331.456	3.411	20	30		EGEDHN
CC(C)C(=O)NCC1(NCC#Cc2ccc(F)cc2)CCCCC1	ZINC001115412283	1370441298	/nfs/dbraw/zinc/44/12/98/1370441298.db2.gz	YFXMSTUAHUXNDO-UHFFFAOYSA-N	0	3	330.447	3.242	20	30		EGEDHN
O=C(/C=C/C1CC1)NCC1(NCC#Cc2ccccc2)CCCCC1	ZINC001115464834	1370469612	/nfs/dbraw/zinc/46/96/12/1370469612.db2.gz	MZIIMAOAAJVKBY-BUHFOSPRSA-N	0	3	336.479	3.413	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)NCC1(NCC#Cc2ccccc2)CCCCC1	ZINC001115486362	1370490268	/nfs/dbraw/zinc/49/02/68/1370490268.db2.gz	OAAAYYYMJKYPHY-LJQANCHMSA-N	0	3	338.495	3.493	20	30		EGEDHN
COc1ccc(C#N)c(Nc2cccc(CN3CCN(C)CC3)c2)c1	ZINC001204565154	1370518005	/nfs/dbraw/zinc/51/80/05/1370518005.db2.gz	WQPWDVITAGFSSO-UHFFFAOYSA-N	0	3	336.439	3.058	20	30		EGEDHN
CN1CCN(Cc2cccc(Nc3ccc(F)c(CC#N)c3)c2)CC1	ZINC001204581493	1370522817	/nfs/dbraw/zinc/52/28/17/1370522817.db2.gz	XXDADCDRPYEZCL-UHFFFAOYSA-N	0	3	338.430	3.383	20	30		EGEDHN
CCSCCC(=O)N1CCC(CNCc2ccccc2C#N)CC1	ZINC001204624611	1370532191	/nfs/dbraw/zinc/53/21/91/1370532191.db2.gz	SFNKTZXGAPNCLT-UHFFFAOYSA-N	0	3	345.512	3.030	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H]2CC[C@H](CC)O2)CCCCC1	ZINC001115559950	1370560139	/nfs/dbraw/zinc/56/01/39/1370560139.db2.gz	MJKSTMWSXACWBT-LSDHHAIUSA-N	0	3	328.884	3.105	20	30		EGEDHN
C=CCCC(=O)N1CCC(CNCc2ccn(C3CCCC3)n2)CC1	ZINC001204748266	1370564686	/nfs/dbraw/zinc/56/46/86/1370564686.db2.gz	JJPCDXJAZXVXRX-UHFFFAOYSA-N	0	3	344.503	3.293	20	30		EGEDHN
Cc1cc(C#N)c(F)cc1Nc1ccc(CN2CCN(C)CC2)cc1	ZINC001204758908	1370569113	/nfs/dbraw/zinc/56/91/13/1370569113.db2.gz	OPGQUQFTEQESKY-UHFFFAOYSA-N	0	3	338.430	3.497	20	30		EGEDHN
C=CCCN1C[C@@H](O)[C@H](N(Cc2ccccc2)C(=O)CCCCC)C1	ZINC001205084846	1370646715	/nfs/dbraw/zinc/64/67/15/1370646715.db2.gz	CKISHOIZVJYRDC-WOJBJXKFSA-N	0	3	344.499	3.217	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCC1(NCc2conc2C)CCCCC1	ZINC001115679541	1370661874	/nfs/dbraw/zinc/66/18/74/1370661874.db2.gz	HRPSTCGCJNLGNA-HUUCEWRRSA-N	0	3	333.476	3.350	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC2(NCc3cncc(F)c3)CCCCC2)C1	ZINC001115723233	1370701652	/nfs/dbraw/zinc/70/16/52/1370701652.db2.gz	FWRZUGUZVDTVDX-UHFFFAOYSA-N	0	3	345.462	3.486	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC(CN[C@@H](C)c2cnc(C)cn2)CC1	ZINC001205397594	1370743158	/nfs/dbraw/zinc/74/31/58/1370743158.db2.gz	COLPXAVHMROFJQ-INIZCTEOSA-N	0	3	344.503	3.277	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H](C)CCCC)C[C@H]1c1cccc(F)c1	ZINC001205406060	1370745985	/nfs/dbraw/zinc/74/59/85/1370745985.db2.gz	CTOLBVAQTKAAJY-AYOQOUSVSA-N	0	3	330.447	3.169	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)CCC(C)(C)C)C[C@H]1c1cccc(F)c1	ZINC001205443653	1370757129	/nfs/dbraw/zinc/75/71/29/1370757129.db2.gz	SEZAPXTUUFOQDU-ZWKOTPCHSA-N	0	3	330.447	3.169	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)N1CCC(CNCc2oc(C)nc2C)CC1	ZINC001205953905	1370921823	/nfs/dbraw/zinc/92/18/23/1370921823.db2.gz	AZUDFJYCERNLBO-KGLIPLIRSA-N	0	3	333.476	3.078	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)N1CCC(CNCc2csc(CC)n2)CC1	ZINC001205961085	1370924000	/nfs/dbraw/zinc/92/40/00/1370924000.db2.gz	LMNGLKKPZGOIGD-GJZGRUSLSA-N	0	3	349.544	3.492	20	30		EGEDHN
CC#CCCCC(=O)N1CCC(CNCc2c(F)cccc2F)CC1	ZINC001205966280	1370924783	/nfs/dbraw/zinc/92/47/83/1370924783.db2.gz	QQVJCFLZFKSGSY-UHFFFAOYSA-N	0	3	348.437	3.487	20	30		EGEDHN
Cc1cc(O)cc(-c2nccnc2C(C#N)C(=O)OC(C)(C)C)c1	ZINC001206218710	1370996254	/nfs/dbraw/zinc/99/62/54/1370996254.db2.gz	FTRYORCDWYNPCF-AWEZNQCLSA-N	0	3	325.368	3.107	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CN(CC[C@H]2CC2(Cl)Cl)C[C@H]1C	ZINC001206885154	1371206366	/nfs/dbraw/zinc/20/63/66/1371206366.db2.gz	XIGALKCKQZMPIJ-QLFBSQMISA-N	0	3	345.314	3.200	20	30		EGEDHN
C[C@@H]1CN(Cc2cc3ccccc3s2)C[C@H]1NC(=O)C#CC1CC1	ZINC001206948294	1371240752	/nfs/dbraw/zinc/24/07/52/1371240752.db2.gz	COLWNWPIGKJDRN-RDTXWAMCSA-N	0	3	338.476	3.251	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cnc(C)s1)[C@H]2CC	ZINC001207059186	1371281795	/nfs/dbraw/zinc/28/17/95/1371281795.db2.gz	NHFGFYPEIFRQJT-WMZOPIPTSA-N	0	3	333.501	3.373	20	30		EGEDHN
O=C1C=C2CN(Cc3c(F)cccc3OC(F)F)CCC2S1	ZINC001207113721	1371298260	/nfs/dbraw/zinc/29/82/60/1371298260.db2.gz	CNRRDXVHQAXBNG-ZDUSSCGKSA-N	0	3	329.343	3.201	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN(Cc2ccc3c(c2)COC3)C[C@H]1C	ZINC001207190864	1371325953	/nfs/dbraw/zinc/32/59/53/1371325953.db2.gz	YIRGBJWIKRMWSD-DNVCBOLYSA-N	0	3	328.456	3.010	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001207363018	1371374873	/nfs/dbraw/zinc/37/48/73/1371374873.db2.gz	KTPZJJFVGFGKIG-RDJZCZTQSA-N	0	3	332.875	3.318	20	30		EGEDHN
CCCCC(=O)N1CCC[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207372134	1371378288	/nfs/dbraw/zinc/37/82/88/1371378288.db2.gz	BBYIBDXVAKSCML-SFHVURJKSA-N	0	3	332.875	3.462	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)C2(Cc3ccccc3)CCC2)C1	ZINC001207575829	1371440575	/nfs/dbraw/zinc/44/05/75/1371440575.db2.gz	WUWUJDVYUMCRED-IEBWSBKVSA-N	0	3	326.484	3.412	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H](N[C@H]2CCc3c2c(F)ccc3F)C1	ZINC001207654695	1371465313	/nfs/dbraw/zinc/46/53/13/1371465313.db2.gz	TVZFTPSPFHONIJ-GUYCJALGSA-N	0	3	334.410	3.499	20	30		EGEDHN
Cc1c[nH]cc1C(=O)NCC1(NCC#Cc2ccccc2)CCCCC1	ZINC001120128995	1371491345	/nfs/dbraw/zinc/49/13/45/1371491345.db2.gz	CCZBBBUNZISEQY-UHFFFAOYSA-N	0	3	349.478	3.397	20	30		EGEDHN
CCC(=CC(=O)N1CCC[C@@H](NCc2ccc(C#N)s2)C1)CC	ZINC001207785737	1371503057	/nfs/dbraw/zinc/50/30/57/1371503057.db2.gz	IAONRVZAQRDTDA-OAHLLOKOSA-N	0	3	331.485	3.447	20	30		EGEDHN
C#CCCCCC(=O)N1CCC[C@H](NCc2ccc(Cl)nc2)C1	ZINC001207860154	1371522479	/nfs/dbraw/zinc/52/24/79/1371522479.db2.gz	HYKLAPPYHLFBNI-INIZCTEOSA-N	0	3	333.863	3.009	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H]([C@H]2CCCN2Cc2snnc2C)C1	ZINC001120348323	1371542501	/nfs/dbraw/zinc/54/25/01/1371542501.db2.gz	UFGQCJHGUDIINP-HZPDHXFCSA-N	0	3	348.516	3.016	20	30		EGEDHN
CC(C(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1)=C1CCC1	ZINC001207998679	1371563106	/nfs/dbraw/zinc/56/31/06/1371563106.db2.gz	NQIJCRBUTJLSMO-FQEVSTJZSA-N	0	3	340.442	3.258	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N[C@@H]1CN(Cc2ccc(C)cc2)C[C@H]1C	ZINC001208129669	1371603604	/nfs/dbraw/zinc/60/36/04/1371603604.db2.gz	ZWTSODBVUOZIFC-YFVAEKQCSA-N	0	3	344.499	3.160	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC[C@H](NCc2ncccc2C)C1	ZINC001208194080	1371632802	/nfs/dbraw/zinc/63/28/02/1371632802.db2.gz	NCTFDBIGVRWQRF-SFHVURJKSA-N	0	3	327.472	3.239	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CN(C[C@H](OC)c2ccccc2)C[C@H]1C	ZINC001208295007	1371704775	/nfs/dbraw/zinc/70/47/75/1371704775.db2.gz	WUVQCRMPSPFOFZ-QRQLOZEOSA-N	0	3	344.499	3.413	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CN(CCOc2cccc(C)c2)C[C@H]1C	ZINC001208298543	1371705628	/nfs/dbraw/zinc/70/56/28/1371705628.db2.gz	RKCLTMYGZNOZQP-IEBWSBKVSA-N	0	3	344.499	3.413	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1CN(CCOc2ccc(C)cc2)C[C@H]1C	ZINC001208498399	1371788901	/nfs/dbraw/zinc/78/89/01/1371788901.db2.gz	UDBRDMLLKYJRCU-QFUCXCTJSA-N	0	3	344.499	3.413	20	30		EGEDHN
CC1(CC(=O)N2CCC[C@@H](NCC#Cc3cccc(Cl)c3)C2)CC1	ZINC001208594139	1371832492	/nfs/dbraw/zinc/83/24/92/1371832492.db2.gz	DOJGMSDSTKIROP-GOSISDBHSA-N	0	3	344.886	3.462	20	30		EGEDHN
CC/C(C)=C\C(=O)NC1CC2(CC(NCc3ccccc3C#N)C2)C1	ZINC001121071306	1371847234	/nfs/dbraw/zinc/84/72/34/1371847234.db2.gz	BDQCLGNMWFMXGM-NVNXTCNLSA-N	0	3	337.467	3.432	20	30		EGEDHN
CCOC(=O)[C@@H]1CCCc2sc(NC3=CCN(C)CC3)c(C#N)c21	ZINC001208720145	1371873013	/nfs/dbraw/zinc/87/30/13/1371873013.db2.gz	YMPKWXISKUXBEF-CYBMUJFWSA-N	0	3	345.468	3.234	20	30		EGEDHN
C=CCN(C)CCc1c(Br)ccnc1Br	ZINC001208808873	1371902786	/nfs/dbraw/zinc/90/27/86/1371902786.db2.gz	VBMNGVPBXVHPEU-UHFFFAOYSA-N	0	3	334.055	3.267	20	30		EGEDHN
CN(CCCc1cccc(C#N)c1)C1CN(C(=O)OC(C)(C)C)C1	ZINC001208853827	1371919391	/nfs/dbraw/zinc/91/93/91/1371919391.db2.gz	XXHMFWFOMXFJNI-UHFFFAOYSA-N	0	3	329.444	3.042	20	30		EGEDHN
C[C@H]1CN(CCc2ccc(C#N)cc2)CCN(C(=O)OC(C)(C)C)C1	ZINC001208920448	1371944759	/nfs/dbraw/zinc/94/47/59/1371944759.db2.gz	IRUZYWDGCSEGNM-INIZCTEOSA-N	0	3	343.471	3.290	20	30		EGEDHN
C[C@H]1CN(C(=O)OC(C)(C)C)CCCN1CCc1ccc(C#N)cc1	ZINC001208920327	1371945061	/nfs/dbraw/zinc/94/50/61/1371945061.db2.gz	FRPIOGORRGOUAN-INIZCTEOSA-N	0	3	343.471	3.432	20	30		EGEDHN
C[C@@H]1CCN(CCc2ccc(C#N)cc2)CCN1C(=O)OC(C)(C)C	ZINC001208925611	1371947007	/nfs/dbraw/zinc/94/70/07/1371947007.db2.gz	JPOQDDYLQBBFGY-MRXNPFEDSA-N	0	3	343.471	3.432	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H](CN2CCc2ccc(C#N)cc2)C1	ZINC001208925757	1371947691	/nfs/dbraw/zinc/94/76/91/1371947691.db2.gz	QAILHCBOQZRTLX-ZWKOTPCHSA-N	0	3	341.455	3.042	20	30		EGEDHN
C[C@]1(C(=O)N2CCC[C@@H](NCC#Cc3ccc(F)cc3)C2)C=CCC1	ZINC001209040651	1371981054	/nfs/dbraw/zinc/98/10/54/1371981054.db2.gz	XNPGWDCLTGYPFV-CTNGQTDRSA-N	0	3	340.442	3.114	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)[C@H](C)CC(F)(F)F)C2	ZINC001121462400	1371983133	/nfs/dbraw/zinc/98/31/33/1371983133.db2.gz	FLQBWHRUVHFEOT-UOIMRUQWSA-N	0	3	338.801	3.344	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC1CC2(CC(NCc3ocnc3C)C2)C1	ZINC001121616255	1372026209	/nfs/dbraw/zinc/02/62/09/1372026209.db2.gz	FMUJJSQKBHDQRF-XYLATYTLSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC1CC2(CC(NCc3cnoc3C)C2)C1	ZINC001121616403	1372027033	/nfs/dbraw/zinc/02/70/33/1372027033.db2.gz	JONFWIQPHWXFTI-UNSYWJDTSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@@H](NCc2cnn(C(C)(C)C)c2)C1	ZINC001209183026	1372028069	/nfs/dbraw/zinc/02/80/69/1372028069.db2.gz	KVBPNHCQBPRITF-SJLPKXTDSA-N	0	3	346.519	3.321	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)C[C@H](C)C(F)(F)F)C2	ZINC001121687504	1372046653	/nfs/dbraw/zinc/04/66/53/1372046653.db2.gz	PKBAGFAZDMAJOU-ZTBHGZPVSA-N	0	3	338.801	3.344	20	30		EGEDHN
C=CCCCN1C[C@@H](C)[C@H](NC(=O)c2cnc([C@@H]3CCCO3)s2)C1	ZINC001209255052	1372052075	/nfs/dbraw/zinc/05/20/75/1372052075.db2.gz	SMNLDYAUUWCENJ-KFWWJZLASA-N	0	3	349.500	3.011	20	30		EGEDHN
C=CCC1(C(=O)NC2CC3(CC(NCc4cnc(C)o4)C3)C2)CCC1	ZINC001121713709	1372056319	/nfs/dbraw/zinc/05/63/19/1372056319.db2.gz	MWGODANAQQGJOR-UHFFFAOYSA-N	0	3	343.471	3.246	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC1CC2(CC(NCc3ccn(CC)n3)C2)C1	ZINC001121714195	1372056647	/nfs/dbraw/zinc/05/66/47/1372056647.db2.gz	YZRSSIKBRHMEJK-SAOIUIGASA-N	0	3	344.503	3.022	20	30		EGEDHN
C[C@H](c1ccccc1)N(CCN1CCOCC1)Cc1cccc(C#N)c1	ZINC001209293111	1372060129	/nfs/dbraw/zinc/06/01/29/1372060129.db2.gz	DRKUSICJSNVASC-LJQANCHMSA-N	0	3	349.478	3.454	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@H](NCc2cc(F)ccc2OC)C1	ZINC001209346917	1372073362	/nfs/dbraw/zinc/07/33/62/1372073362.db2.gz	WYXVWFYSHZXEGD-KRWDZBQOSA-N	0	3	334.435	3.271	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccc(F)cc1OCC(F)(F)F	ZINC001121954458	1372133307	/nfs/dbraw/zinc/13/33/07/1372133307.db2.gz	BQBZLNARKVXPFC-LLVKDONJSA-N	0	3	334.313	3.389	20	30		EGEDHN
O=C([C@H]1CC12CC2)N1CCC[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001209809576	1372205538	/nfs/dbraw/zinc/20/55/38/1372205538.db2.gz	XDXPGIRQCWMGMC-ZWKOTPCHSA-N	0	3	342.870	3.072	20	30		EGEDHN
N#CC(C(=O)c1ccc2ncccc2c1)c1nc(N)c2ccccc2n1	ZINC001122499241	1372261004	/nfs/dbraw/zinc/26/10/04/1372261004.db2.gz	GAYFCSDEXPTKIB-OAHLLOKOSA-N	0	3	339.358	3.250	20	30		EGEDHN
C#CCCN1C[C@@H](C)[C@H](NC(=O)[C@H](CC)Cc2ccccc2C)C1	ZINC001210298293	1372318682	/nfs/dbraw/zinc/31/86/82/1372318682.db2.gz	OCVWSKVHISCMEG-QWFCFKBJSA-N	0	3	326.484	3.024	20	30		EGEDHN
F[C@H]1CNCCN(Cc2cc(C(F)(F)F)ccc2C(F)(F)F)C1	ZINC001210580484	1372384310	/nfs/dbraw/zinc/38/43/10/1372384310.db2.gz	JJDGFDOAYHRCAJ-NSHDSACASA-N	0	3	344.274	3.468	20	30		EGEDHN
C=CCC[C@H]1CCCN1C(=O)NC1CCN(CCOC(C)C)CC1	ZINC001123515911	1372493978	/nfs/dbraw/zinc/49/39/78/1372493978.db2.gz	XDHUONYMDHEBDX-SFHVURJKSA-N	0	3	337.508	3.016	20	30		EGEDHN
C=CCC1(C(=O)N2CCC[C@@H](NCc3cncn3C)C2)CCCCC1	ZINC001211212747	1372503826	/nfs/dbraw/zinc/50/38/26/1372503826.db2.gz	FZNNXDYVFFIVQG-QGZVFWFLSA-N	0	3	344.503	3.027	20	30		EGEDHN
C#CC[C@H](CC)c1nnc(N2CCN(C(C)(C)C)CC2)n1CC1CC1	ZINC001123614914	1372526513	/nfs/dbraw/zinc/52/65/13/1372526513.db2.gz	QGRHRQJHQRCVTL-KRWDZBQOSA-N	0	3	343.519	3.126	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)CC[C@@H](C)CC)C[C@H]1c1ccccc1	ZINC001211695239	1372603009	/nfs/dbraw/zinc/60/30/09/1372603009.db2.gz	SBMUWFIDLXUAEH-YSIASYRMSA-N	0	3	326.484	3.420	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C[C@@H](C)CC(C)C)C[C@H]1c1ccccc1	ZINC001211707359	1372606435	/nfs/dbraw/zinc/60/64/35/1372606435.db2.gz	OEZAQOUOQDVQPM-YSIASYRMSA-N	0	3	326.484	3.276	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)CC(C)(C)C2CC2)[C@H](OC)C1	ZINC001212234292	1372675385	/nfs/dbraw/zinc/67/53/85/1372675385.db2.gz	VFYSAZSVQYULDU-QZTJIDSGSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN(CCCc2ccc(C)cc2)C[C@H]1OC	ZINC001212347021	1372691510	/nfs/dbraw/zinc/69/15/10/1372691510.db2.gz	OQCDZLHGMWJRDV-WOJBJXKFSA-N	0	3	344.499	3.099	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)C[C@@H]2C=CCCC2)[C@H](OC)C1	ZINC001212451140	1372709207	/nfs/dbraw/zinc/70/92/07/1372709207.db2.gz	PCXLCDZGMHJQNW-GUDVDZBRSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](NCc3cncs3)C2)CCCCC1	ZINC001188052325	1388229183	/nfs/dbraw/zinc/22/91/83/1388229183.db2.gz	AAPJWQGSCAPCKC-OAHLLOKOSA-N	0	3	333.501	3.360	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CN(CCC2=CCCCC2)C[C@H]1OC	ZINC001213498159	1372914657	/nfs/dbraw/zinc/91/46/57/1372914657.db2.gz	ZQXPBJAZBVROHI-QZTJIDSGSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)[C@H](C)CC2CCCCC2)[C@H](OC)C1	ZINC001213524314	1372919171	/nfs/dbraw/zinc/91/91/71/1372919171.db2.gz	AAIOHTCFEJBKFD-BHIYHBOVSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)C2(CC(C)C)CCCC2)[C@H](OC)C1	ZINC001213591024	1372931406	/nfs/dbraw/zinc/93/14/06/1372931406.db2.gz	JPIOXPUFMMSERS-QZTJIDSGSA-N	0	3	336.520	3.375	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@@H]2CC23CCCC3)[C@H](OC)C1	ZINC001213671843	1372943356	/nfs/dbraw/zinc/94/33/56/1372943356.db2.gz	TXNPRBZBPVVGIM-RCCFBDPRSA-N	0	3	336.520	3.353	20	30		EGEDHN
CC(C)CCC(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001214122394	1373011383	/nfs/dbraw/zinc/01/13/83/1373011383.db2.gz	RLKLVOYLXUGOAV-VQIMIIECSA-N	0	3	330.447	3.050	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H]2CN(Cc3cccc(OC)c3)C[C@H]21	ZINC001188080307	1388237248	/nfs/dbraw/zinc/23/72/48/1388237248.db2.gz	BDCJNZDRTZRVHX-PKOBYXMFSA-N	0	3	328.456	3.084	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@@H](C)[C@H](N[C@@H](C)c2ccc(F)cc2F)C1	ZINC001214580147	1373084552	/nfs/dbraw/zinc/08/45/52/1373084552.db2.gz	TYRROUQPBNPZFO-QWQRMKEZSA-N	0	3	334.410	3.122	20	30		EGEDHN
C=CCCOCCCCC(=O)NCCNCc1cc2ccccc2o1	ZINC001127125475	1373091781	/nfs/dbraw/zinc/09/17/81/1373091781.db2.gz	YIXORJFBGBHRGM-UHFFFAOYSA-N	0	3	344.455	3.402	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H](C)[C@H](NCc2ncccc2C)C1	ZINC001214708247	1373105859	/nfs/dbraw/zinc/10/58/59/1373105859.db2.gz	XPKMSVLLVGVDOV-VQIMIIECSA-N	0	3	327.472	3.095	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H](C)[C@H](NCc2ccnc(Cl)c2)C1	ZINC001214707214	1373105949	/nfs/dbraw/zinc/10/59/49/1373105949.db2.gz	KBWIKFCUSNERAJ-RHSMWYFYSA-N	0	3	347.890	3.440	20	30		EGEDHN
CC[C@H](CC(F)F)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2)C1	ZINC001214833787	1373127259	/nfs/dbraw/zinc/12/72/59/1373127259.db2.gz	HIJZJFLKQINAAC-KBAYOESNSA-N	0	3	348.437	3.156	20	30		EGEDHN
C=C(C)CNCc1ccncc1O[C@H]1CCN(C(=O)/C(C)=C/CC)C1	ZINC001127883566	1373195188	/nfs/dbraw/zinc/19/51/88/1373195188.db2.gz	QCEBQXXSEHATND-SCFNNSENSA-N	0	3	343.471	3.083	20	30		EGEDHN
C=Cc1ccc(C(=O)N2C[C@@H](C)[C@H](NCC#Cc3ccccc3)C2)cc1	ZINC001215622110	1373220001	/nfs/dbraw/zinc/22/00/01/1373220001.db2.gz	NFFHRYWYVVMGGP-XMSQKQJNSA-N	0	3	344.458	3.431	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NCCNCc1ccc(C(C)C)nc1C	ZINC001128209048	1373235403	/nfs/dbraw/zinc/23/54/03/1373235403.db2.gz	MNODRZAWQHRNJD-UHFFFAOYSA-N	0	3	337.895	3.498	20	30		EGEDHN
CCCCCCCCCC(=O)N1C[C@@H](C)[C@H](NCc2cncn2C)C1	ZINC001216531217	1373314601	/nfs/dbraw/zinc/31/46/01/1373314601.db2.gz	WUJCWLHXZHOMGK-IEBWSBKVSA-N	0	3	348.535	3.497	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc(C3CCC3)cc2)s1	ZINC001128860021	1373318283	/nfs/dbraw/zinc/31/82/83/1373318283.db2.gz	ZOYSPVGIWKJQRA-UHFFFAOYSA-N	0	3	339.464	3.407	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)C[C@H]3C=CCC3)[C@H]2C1	ZINC001217249347	1373411096	/nfs/dbraw/zinc/41/10/96/1373411096.db2.gz	UYUMCKMIFAQQDX-GBESFXJTSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCO[C@@H]2CN(CCC3CCCCC3)C[C@@H]21	ZINC001217998186	1373530906	/nfs/dbraw/zinc/53/09/06/1373530906.db2.gz	VIFBOSJZCFGOGI-RBUKOAKNSA-N	0	3	348.531	3.471	20	30		EGEDHN
COc1ccccc1/C=C\C(=O)c1ccccc1O[C@@H]1CNC[C@@H]1F	ZINC001218000689	1373531166	/nfs/dbraw/zinc/53/11/66/1373531166.db2.gz	JOAXNAUOPMUXCA-IDTIXJOSSA-N	0	3	341.382	3.280	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)CCCC[C@@H](C)CC)[C@H]2C1	ZINC001218004992	1373532516	/nfs/dbraw/zinc/53/25/16/1373532516.db2.gz	XIZJHMAIXIORMG-GBESFXJTSA-N	0	3	336.520	3.471	20	30		EGEDHN
Fc1ccc(N=Cc2ccccc2O[C@H]2CC[C@@H]3NCCO[C@@H]32)cc1	ZINC001218119129	1373564394	/nfs/dbraw/zinc/56/43/94/1373564394.db2.gz	INOWZJSNZPNJIV-IHPCNDPISA-N	0	3	340.398	3.475	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)CCCC[C@H](C)CC)C[C@H]1c1cn(C)cn1	ZINC001130598988	1373567975	/nfs/dbraw/zinc/56/79/75/1373567975.db2.gz	BZKGABHCYJHITG-ZIFCJYIRSA-N	0	3	346.519	3.097	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)CCCC[C@@H](C)CC)C[C@H]1c1cn(C)cn1	ZINC001130598987	1373568107	/nfs/dbraw/zinc/56/81/07/1373568107.db2.gz	BZKGABHCYJHITG-JENIJYKNSA-N	0	3	346.519	3.097	20	30		EGEDHN
C#CCCCCCC(=O)N1CCO[C@@H]2CN(CCCCCC)C[C@@H]21	ZINC001218454580	1373616905	/nfs/dbraw/zinc/61/69/05/1373616905.db2.gz	HVIRUAVIGDDFFS-RBUKOAKNSA-N	0	3	334.504	3.062	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCO[C@@H]2CN(CCCC3CCC3)C[C@@H]21	ZINC001218522496	1373629628	/nfs/dbraw/zinc/62/96/28/1373629628.db2.gz	AGICMOXDJWGOLT-YTQUADARSA-N	0	3	334.504	3.081	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)[C@H](C)c3ccco3)[C@H]2C1	ZINC001218618883	1373637296	/nfs/dbraw/zinc/63/72/96/1373637296.db2.gz	YHUXHYDHBPJIHJ-ZIFCJYIRSA-N	0	3	348.487	3.265	20	30		EGEDHN
CC(C)=C[C@@H]1[C@@H](C(=O)NCCNCc2ccc(C#N)c(F)c2)C1(C)C	ZINC001131089063	1373640839	/nfs/dbraw/zinc/64/08/39/1373640839.db2.gz	WGMACXJDMKBKIU-AEFFLSMTSA-N	0	3	343.446	3.142	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)CC[C@H](C)c3ccccc3)[C@H]2C1	ZINC001218730222	1373647959	/nfs/dbraw/zinc/64/79/59/1373647959.db2.gz	RYQSHTYDIZHIOQ-YSIASYRMSA-N	0	3	342.483	3.058	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)c3csc(C)c3)[C@H]2C1	ZINC001218789272	1373654486	/nfs/dbraw/zinc/65/44/86/1373654486.db2.gz	DXJZOYYTUBFYJY-ZWKOTPCHSA-N	0	3	348.512	3.328	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)[C@@H]2CCC[C@H]2c2ccccc2)c1	ZINC001131157832	1373655331	/nfs/dbraw/zinc/65/53/31/1373655331.db2.gz	ZJVUWHHWINEBOW-LEWJYISDSA-N	0	3	347.462	3.348	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)[C@@H](C)CCC(C)(C)C)[C@H]2C1	ZINC001218977041	1373673407	/nfs/dbraw/zinc/67/34/07/1373673407.db2.gz	YCLGUHKKZHRMMO-OKZBNKHCSA-N	0	3	336.520	3.327	20	30		EGEDHN
Cc1cc(C#N)c(F)cc1NC(=O)[C@@](C)(N)Cc1ccc(F)cc1	ZINC001219112690	1373688578	/nfs/dbraw/zinc/68/85/78/1373688578.db2.gz	RASLSHKZIFQRSB-SFHVURJKSA-N	0	3	329.350	3.044	20	30		EGEDHN
CC(C)(C)c1ccc(C[C@@H](N)C(=O)N[C@H](C#N)c2ccccc2)cc1	ZINC001219557664	1373716171	/nfs/dbraw/zinc/71/61/71/1373716171.db2.gz	BUTYMGGZBYPPEZ-RTBURBONSA-N	0	3	335.451	3.235	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@@H](C)C(CC)CC)[C@@H](O)C1	ZINC001219917778	1373739597	/nfs/dbraw/zinc/73/95/97/1373739597.db2.gz	SAIFUOHFQUONJA-JQHSSLGASA-N	0	3	326.525	3.190	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)CC(C)(C)CC(F)F)[C@@H](O)C1	ZINC001220044587	1373748914	/nfs/dbraw/zinc/74/89/14/1373748914.db2.gz	PONJUVRGOSEKEN-CABCVRRESA-N	0	3	348.478	3.190	20	30		EGEDHN
C#CCCN1CC[C@]2(C1)CN(C(=O)CCCCC(C)(C)C)C[C@H](C)O2	ZINC001131661113	1373749210	/nfs/dbraw/zinc/74/92/10/1373749210.db2.gz	JPUGNHUYNNWZFT-RXVVDRJESA-N	0	3	348.531	3.308	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@H](C)O[C@]2(CCN(CC(=C)C)C2)C1	ZINC001131660996	1373749367	/nfs/dbraw/zinc/74/93/67/1373749367.db2.gz	INRMJURWIROQBH-PXNSSMCTSA-N	0	3	332.488	3.023	20	30		EGEDHN
C=CCCC1(C(=O)N2C[C@@H](C)O[C@]3(CCN(CC=C(C)C)C3)C2)CC1	ZINC001131688478	1373764162	/nfs/dbraw/zinc/76/41/62/1373764162.db2.gz	MRZDQLGGDCJWQL-NQIIRXRSSA-N	0	3	346.515	3.391	20	30		EGEDHN
C=CCCCCCN1CC[C@@H]2CN(C(=O)c3cnoc3CC)[C@@H]2C1	ZINC001221839852	1373796598	/nfs/dbraw/zinc/79/65/98/1373796598.db2.gz	NTMJRMIEUULBNF-NVXWUHKLSA-N	0	3	331.460	3.130	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@H](C)N(CCOc2cccc(C)c2)C1	ZINC001131896906	1375033685	/nfs/dbraw/zinc/03/36/85/1375033685.db2.gz	WZTUNCDNVMGZTF-ZWKOTPCHSA-N	0	3	330.472	3.309	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC[C@H](C)N(Cc2ccc(COC)cc2)C1	ZINC001131899675	1375036231	/nfs/dbraw/zinc/03/62/31/1375036231.db2.gz	NWSHOPHXXKFGQF-LPHOPBHVSA-N	0	3	330.472	3.268	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC[C@@H](C)N(Cc2cccc(N(C)C)c2)C1	ZINC001131900487	1375037738	/nfs/dbraw/zinc/03/77/38/1375037738.db2.gz	YUCPIRRTISVABX-AEFFLSMTSA-N	0	3	329.488	3.188	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@H](C)c2ccc(Cl)cc2)CC1	ZINC001224318931	1375063932	/nfs/dbraw/zinc/06/39/32/1375063932.db2.gz	OCFDXRMMXCQBNV-OAHLLOKOSA-N	0	3	332.875	3.295	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)C[C@@H](C)c2ccccc2C)CC1	ZINC001224746046	1375074228	/nfs/dbraw/zinc/07/42/28/1375074228.db2.gz	MDPRGPNZVQOWFR-GOSISDBHSA-N	0	3	326.484	3.340	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)C[C@@H]2CCCc3ccccc32)CC1	ZINC001225228740	1375098382	/nfs/dbraw/zinc/09/83/82/1375098382.db2.gz	YANZTKGELJUYNT-FQEVSTJZSA-N	0	3	338.495	3.348	20	30		EGEDHN
CCc1ccccc1CN1C[C@@H](NC(=O)C#CC(C)C)CC[C@H]1C	ZINC001132016003	1375099276	/nfs/dbraw/zinc/09/92/76/1375099276.db2.gz	CMLWDOBCDKAIKW-XLIONFOSSA-N	0	3	326.484	3.378	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)C2(c3cc(C)cc(C)c3)CC2)CC1	ZINC001225436189	1375110466	/nfs/dbraw/zinc/11/04/66/1375110466.db2.gz	XQGDABGGHXZWIX-UHFFFAOYSA-N	0	3	338.495	3.187	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2sc3nccn3c2C)CC[C@@H]1C	ZINC001132116872	1375157202	/nfs/dbraw/zinc/15/72/02/1375157202.db2.gz	XIJFOSUTIFPKKG-ZFWWWQNUSA-N	0	3	346.500	3.253	20	30		EGEDHN
O=C(/C=C/c1ccc[nH]1)N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1	ZINC001225884420	1375169093	/nfs/dbraw/zinc/16/90/93/1375169093.db2.gz	OFBOVTGVTBYBQR-YBYKEUDPSA-N	0	3	347.462	3.097	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2cc(C)sc2C)CC[C@@H]1C	ZINC001132157928	1375176448	/nfs/dbraw/zinc/17/64/48/1375176448.db2.gz	UXXJFTSMVBXEBD-XJKSGUPXSA-N	0	3	336.501	3.150	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCCOc2ccc(F)cc2)CC[C@@H]1C	ZINC001132214149	1375213028	/nfs/dbraw/zinc/21/30/28/1375213028.db2.gz	CLIDPOZZKFUUNW-RDJZCZTQSA-N	0	3	334.435	3.140	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CC[C@@H](C)N(CCOCCC(C)C)C1	ZINC001132223047	1375219160	/nfs/dbraw/zinc/21/91/60/1375219160.db2.gz	AXVTYUJDQAQKND-RTBURBONSA-N	0	3	336.520	3.212	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CC[C@@H](C)N(CCOCC2CCC2)C1	ZINC001132221563	1375219688	/nfs/dbraw/zinc/21/96/88/1375219688.db2.gz	KFXJECBIGRVDKO-SJLPKXTDSA-N	0	3	336.520	3.375	20	30		EGEDHN
CCN1CCC[C@H](Oc2nc(C)c(Br)c(C)c2C#N)C1	ZINC001226203208	1375220397	/nfs/dbraw/zinc/22/03/97/1375220397.db2.gz	FRDDKKRWVZTOEQ-LBPRGKRZSA-N	0	3	338.249	3.196	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCN[C@@H](C)c2ccc(F)c(F)c2)cc1	ZINC001132226730	1375221901	/nfs/dbraw/zinc/22/19/01/1375221901.db2.gz	MOIBFZOOIUNXFR-ZDUSSCGKSA-N	0	3	328.362	3.027	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1CC[C@H](C)N(CCc2scnc2C)C1	ZINC001132257470	1375250848	/nfs/dbraw/zinc/25/08/48/1375250848.db2.gz	WHJOUVSDAHDOIU-HOCLYGCPSA-N	0	3	335.517	3.319	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC1CCN(Cc2ccc(CC)cc2)CC1	ZINC001226446564	1375260229	/nfs/dbraw/zinc/26/02/29/1375260229.db2.gz	CZFXFENPWMCBTR-KRWDZBQOSA-N	0	3	344.499	3.311	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CC[C@@H](C)N(CCOCC3CCC3)C2)C1	ZINC001132273784	1375260275	/nfs/dbraw/zinc/26/02/75/1375260275.db2.gz	JXKJYOXSKVCMIF-SJLPKXTDSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCOCC(=O)NC1CCN([C@H]2CCc3ccc(Cl)cc32)CC1	ZINC001226599494	1375289573	/nfs/dbraw/zinc/28/95/73/1375289573.db2.gz	XOPPLYBYXNYFTF-SFHVURJKSA-N	0	3	348.874	3.111	20	30		EGEDHN
C#CCCCCCC(=O)NCCN[C@H]1CCc2c1cc(F)cc2F	ZINC001132402729	1375354751	/nfs/dbraw/zinc/35/47/51/1375354751.db2.gz	XGZBPOMJTBFVIN-SFHVURJKSA-N	0	3	334.410	3.242	20	30		EGEDHN
C=CCCCCCN1C[C@H](NC(=O)c2c[nH]c(C)cc2=O)CC[C@@H]1C	ZINC001132403370	1375355930	/nfs/dbraw/zinc/35/59/30/1375355930.db2.gz	VZHXFYBWYNDALX-DLBZAZTESA-N	0	3	345.487	3.012	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2cc3sccc3[nH]2)CC[C@H]1C	ZINC001132403265	1375356071	/nfs/dbraw/zinc/35/60/71/1375356071.db2.gz	UKHRXIKELSTUMI-ZIAGYGMSSA-N	0	3	347.484	3.015	20	30		EGEDHN
C#CCCCCC(=O)NC1CCN(C[C@H](OC)c2ccccc2)CC1	ZINC001226952088	1375369734	/nfs/dbraw/zinc/36/97/34/1375369734.db2.gz	RFHJXNFHVZOQGH-FQEVSTJZSA-N	0	3	342.483	3.148	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCc2c[nH]c3ccccc23)CC[C@@H]1C	ZINC001132463910	1375406324	/nfs/dbraw/zinc/40/63/24/1375406324.db2.gz	JZDNHKVGFVICEL-DOTOQJQBSA-N	0	3	325.456	3.256	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCOc2cccc(OC)c2)CC[C@@H]1C	ZINC001132521664	1375438320	/nfs/dbraw/zinc/43/83/20/1375438320.db2.gz	GWGBVHBHZNWBON-IRXDYDNUSA-N	0	3	346.471	3.009	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)CC1(C)CC1	ZINC001227603398	1375451580	/nfs/dbraw/zinc/45/15/80/1375451580.db2.gz	PGACTDDEWBWWCH-CHWSQXEVSA-N	0	3	329.282	3.102	20	30		EGEDHN
C#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)CCC(C)C)CC1	ZINC001132551246	1375456703	/nfs/dbraw/zinc/45/67/03/1375456703.db2.gz	COTQEKFMFRJNAH-FQEVSTJZSA-N	0	3	341.499	3.334	20	30		EGEDHN
C#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)CCC2CC2)CC1	ZINC001132554157	1375459781	/nfs/dbraw/zinc/45/97/81/1375459781.db2.gz	CKCSPYLWWWFGPP-HXUWFJFHSA-N	0	3	339.483	3.088	20	30		EGEDHN
C#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)CCC2CC2)CC1	ZINC001132554156	1375459860	/nfs/dbraw/zinc/45/98/60/1375459860.db2.gz	CKCSPYLWWWFGPP-FQEVSTJZSA-N	0	3	339.483	3.088	20	30		EGEDHN
CC#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)C(C)(C)C)CC1	ZINC001132555769	1375462660	/nfs/dbraw/zinc/46/26/60/1375462660.db2.gz	ZVEZQJGQRNNKKX-IBGZPJMESA-N	0	3	341.499	3.334	20	30		EGEDHN
CC#CCN1CC[C@@H](CN(Cc2scnc2C)C(=O)C(C)(C)C)C1	ZINC001132562075	1375468508	/nfs/dbraw/zinc/46/85/08/1375468508.db2.gz	DQVOOPGPMMBEHG-MRXNPFEDSA-N	0	3	347.528	3.171	20	30		EGEDHN
C=CCc1cc(OC)c(O[C@H]2CCCN(C(C)C)C2)c(C(=O)OC)c1	ZINC001228246345	1375532637	/nfs/dbraw/zinc/53/26/37/1375532637.db2.gz	QEAONARLJRVICB-INIZCTEOSA-N	0	3	347.455	3.462	20	30		EGEDHN
CC/C(C)=C\C(=O)N1CC[C@H](C)[C@@H](CNCc2ccccc2C#N)C1	ZINC001132804174	1375570175	/nfs/dbraw/zinc/57/01/75/1375570175.db2.gz	GKLGLFKODGZNET-CKTOVEOYSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](C)[C@H](CNCc2cc(C)no2)C1	ZINC001132843240	1375595886	/nfs/dbraw/zinc/59/58/86/1375595886.db2.gz	KDXYCGMVOSLVOZ-CRAIPNDOSA-N	0	3	345.487	3.326	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](C)[C@@H](CNCc2csc(C)n2)C1	ZINC001132866147	1375610937	/nfs/dbraw/zinc/61/09/37/1375610937.db2.gz	WMUOSWIAPQXLDN-ZBFHGGJFSA-N	0	3	335.517	3.382	20	30		EGEDHN
C#CCCCCCC(=O)NC1CCN(CCc2scnc2C)CC1	ZINC001228636710	1375623927	/nfs/dbraw/zinc/62/39/27/1375623927.db2.gz	APECWISSIHJVKH-UHFFFAOYSA-N	0	3	347.528	3.158	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccc(F)cc1	ZINC001228673707	1375637698	/nfs/dbraw/zinc/63/76/98/1375637698.db2.gz	CZXPILAWCFUTDC-VBSBHUPXSA-N	0	3	342.458	3.240	20	30		EGEDHN
CC#CCCCC(=O)NC1CCN(CCOc2ccc(C)cc2)CC1	ZINC001228711994	1375648900	/nfs/dbraw/zinc/64/89/00/1375648900.db2.gz	FEXUORCHTMXMSC-UHFFFAOYSA-N	0	3	342.483	3.148	20	30		EGEDHN
CC#CCCCC(=O)NC1CCN(CCO[C@@H]2CCCC[C@H]2C)CC1	ZINC001228712677	1375649017	/nfs/dbraw/zinc/64/90/17/1375649017.db2.gz	YMKCNMCXXGXWFA-UYAOXDASSA-N	0	3	348.531	3.356	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NC1CCN(CCOc2cccc(F)c2)CC1	ZINC001228749116	1375662736	/nfs/dbraw/zinc/66/27/36/1375662736.db2.gz	PTTHZLGOESJDOL-HZPDHXFCSA-N	0	3	348.462	3.243	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NC1CCN(Cc2ccc3c(c2)COC3)CC1	ZINC001228750178	1375663906	/nfs/dbraw/zinc/66/39/06/1375663906.db2.gz	XAYLTBRGYXKFIZ-HOTGVXAUSA-N	0	3	342.483	3.256	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC1CCN(CCc2scnc2C)CC1	ZINC001228801608	1375681512	/nfs/dbraw/zinc/68/15/12/1375681512.db2.gz	UJJNATSJRGYPOP-AWEZNQCLSA-N	0	3	335.517	3.177	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@H](C)[C@H](CNCc3cscn3)C2)CC1	ZINC001133105543	1375777833	/nfs/dbraw/zinc/77/78/33/1375777833.db2.gz	VCTQKIRZYHMDMX-JKSUJKDBSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](C)[C@@H](CNCc2ocnc2C)C1	ZINC001133142329	1375804303	/nfs/dbraw/zinc/80/43/03/1375804303.db2.gz	NPXLUHMYIIRQCY-ZBFHGGJFSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=CCCCC(=O)NCCNCc1cnc(-c2ccccc2)s1	ZINC001133154222	1375811638	/nfs/dbraw/zinc/81/16/38/1375811638.db2.gz	DTKVRBVLBIYMRU-UHFFFAOYSA-N	0	3	329.469	3.372	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@H]2CN(CCOCCC(C)C)C[C@H]21	ZINC001188896186	1388403870	/nfs/dbraw/zinc/40/38/70/1388403870.db2.gz	LAUWJAFEPOXQDN-GBESFXJTSA-N	0	3	336.520	3.184	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C12CCC(CC1)C2	ZINC001133399097	1375982842	/nfs/dbraw/zinc/98/28/42/1375982842.db2.gz	CGIZNZKCRSSSKM-UHFFFAOYSA-N	0	3	344.886	3.472	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H]1CCCC12CC2	ZINC001133399466	1375983302	/nfs/dbraw/zinc/98/33/02/1375983302.db2.gz	OSOZDJSXHIDFOF-SFHVURJKSA-N	0	3	344.886	3.472	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1cccn1CC	ZINC001133431796	1376003453	/nfs/dbraw/zinc/00/34/53/1376003453.db2.gz	KLRSDWDFFUXFAP-UHFFFAOYSA-N	0	3	343.858	3.027	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)c1ccccc1C	ZINC001133554275	1376082728	/nfs/dbraw/zinc/08/27/28/1376082728.db2.gz	AAWUVTGAAPTFES-UONOGXRCSA-N	0	3	339.277	3.390	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)c1cccs1)NCc1cc(F)ccc1C#N	ZINC001133580829	1376103782	/nfs/dbraw/zinc/10/37/82/1376103782.db2.gz	DCTLIFRRNMUJKH-CHWSQXEVSA-N	0	3	345.443	3.446	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)C1CCCCC1	ZINC001133590324	1376108343	/nfs/dbraw/zinc/10/83/43/1376108343.db2.gz	JEFGNGJDILZNAL-STQMWFEESA-N	0	3	331.298	3.348	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)c1ccsc1	ZINC001133633592	1376129117	/nfs/dbraw/zinc/12/91/17/1376129117.db2.gz	UVZYRDOVMQNTEF-WDEREUQCSA-N	0	3	331.279	3.143	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)C1C=CC=CC=C1)Cc1cccnc1	ZINC001230771714	1376147875	/nfs/dbraw/zinc/14/78/75/1376147875.db2.gz	PZGAHBBQBNCUCF-UHFFFAOYSA-N	0	3	337.467	3.264	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)c1ccc(Cl)[nH]1)Cc1cccnc1	ZINC001230840641	1376165463	/nfs/dbraw/zinc/16/54/63/1376165463.db2.gz	CWSWMCBWHAXRLJ-UHFFFAOYSA-N	0	3	346.862	3.261	20	30		EGEDHN
C#CC1CCN(Cc2ccc(OC(=O)C(C)C)c(OCC)c2)CC1	ZINC001231562191	1376264711	/nfs/dbraw/zinc/26/47/11/1376264711.db2.gz	RQLVJPVRJDCCJG-UHFFFAOYSA-N	0	3	329.440	3.492	20	30		EGEDHN
C=CCOc1cccc(CN2CC[C@H](Oc3cccc(OC)n3)C2)c1	ZINC001231624840	1376285968	/nfs/dbraw/zinc/28/59/68/1376285968.db2.gz	YGTUJEJPDZMYQV-SFHVURJKSA-N	0	3	340.423	3.308	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H]2CN(C[C@@H](OC)c3ccccc3)C[C@H]21	ZINC001189006284	1388434726	/nfs/dbraw/zinc/43/47/26/1388434726.db2.gz	BKKLPYFSWTWDAB-XUVXKRRUSA-N	0	3	342.483	3.263	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H](C)C[C@H](C)NCc1oc(CC)nc1C	ZINC001134119599	1376378455	/nfs/dbraw/zinc/37/84/55/1376378455.db2.gz	UKEZHJILJJTVQN-GJZGRUSLSA-N	0	3	333.476	3.112	20	30		EGEDHN
C#CCCCC(=O)N[C@@H](C)C[C@H](C)NCc1oc(CCC)nc1C	ZINC001134201269	1376415292	/nfs/dbraw/zinc/41/52/92/1376415292.db2.gz	NCQFUUNWZNPJPR-GJZGRUSLSA-N	0	3	333.476	3.112	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cc(F)ccc1N)[C@H]2CC	ZINC001232509387	1376471279	/nfs/dbraw/zinc/47/12/79/1376471279.db2.gz	WVLOMSREHDVCHR-ICSRJNTNSA-N	0	3	345.462	3.330	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H](C)C[C@H](C)NCc1nccn1CC	ZINC001134418289	1376522885	/nfs/dbraw/zinc/52/28/85/1376522885.db2.gz	IIOIOWOMKAYCCB-HOTGVXAUSA-N	0	3	332.492	3.044	20	30		EGEDHN
C=CCN1C(=O)CCC[C@]12CCCN(Cc1cc(C)cc(O)c1)C2	ZINC001232878620	1376528570	/nfs/dbraw/zinc/52/85/70/1376528570.db2.gz	QFXPNPODGJUMNG-HXUWFJFHSA-N	0	3	328.456	3.234	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)C(C)(C)C(C)C	ZINC001134440316	1376538519	/nfs/dbraw/zinc/53/85/19/1376538519.db2.gz	UERWPCYNDBXPIA-STQMWFEESA-N	0	3	333.314	3.450	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@H](C)C[C@@H](C)NCc1nccs1	ZINC001134457388	1376548435	/nfs/dbraw/zinc/54/84/35/1376548435.db2.gz	NHYJOBCXJBAMPB-GHMZBOCLSA-N	0	3	329.897	3.295	20	30		EGEDHN
Cc1cccc([C@@H](C)C(=O)NCCNCc2ccc(C#N)c(F)c2)c1	ZINC001134468991	1376553595	/nfs/dbraw/zinc/55/35/95/1376553595.db2.gz	SWYWUKHSGCCDOI-OAHLLOKOSA-N	0	3	339.414	3.015	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)C1C=CC=CC=C1)NCc1ccccc1C#N	ZINC001134476448	1376559637	/nfs/dbraw/zinc/55/96/37/1376559637.db2.gz	RUQMYNBWSFCINI-SJORKVTESA-N	0	3	335.451	3.230	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCC2(CC1)c1ccccc1NC2=O	ZINC001233080001	1376566052	/nfs/dbraw/zinc/56/60/52/1376566052.db2.gz	RZDMPSBTTPIWTK-UHFFFAOYSA-N	0	3	331.419	3.353	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cc3cc(F)ccc3o2)s1	ZINC001134578066	1376606407	/nfs/dbraw/zinc/60/64/07/1376606407.db2.gz	VMRYWKNZMAKSSM-UHFFFAOYSA-N	0	3	343.383	3.025	20	30		EGEDHN
Cc1ccccc1[C@H](C)CC(=O)NCCNCc1ccc(C#N)s1	ZINC001134727952	1376681520	/nfs/dbraw/zinc/68/15/20/1376681520.db2.gz	ZUOQGWZVDOHAAU-OAHLLOKOSA-N	0	3	341.480	3.328	20	30		EGEDHN
C=CCCCCCN1CC[C@@H]1CN(C)C(=O)C1(c2ccccn2)CC1	ZINC001234314170	1376803968	/nfs/dbraw/zinc/80/39/68/1376803968.db2.gz	SIYAULNBGSCYJO-GOSISDBHSA-N	0	3	341.499	3.392	20	30		EGEDHN
CCCCCCCN1CC[C@@H]1CN(C)C(=O)CCOCC(F)F	ZINC001234365824	1376819826	/nfs/dbraw/zinc/81/98/26/1376819826.db2.gz	HYPJTJWKWBOASU-OAHLLOKOSA-N	0	3	334.451	3.161	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)CCOc1ccc(C)cc1C	ZINC001235035454	1376832631	/nfs/dbraw/zinc/83/26/31/1376832631.db2.gz	BFMBINWKVUAGJX-GOSISDBHSA-N	0	3	330.472	3.181	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)c1cc(C)cc(F)c1	ZINC001753014883	1440268131	/nfs/dbraw/zinc/26/81/31/1440268131.db2.gz	SLMYNOZKPJWAQJ-GFCCVEGCSA-N	0	3	343.240	3.141	20	30		EGEDHN
Cc1ccc(-c2nccnc2C(C#N)C(=O)OC(C)(C)C)c2c[nH]nc21	ZINC001236486438	1376954228	/nfs/dbraw/zinc/95/42/28/1376954228.db2.gz	KBNAGIYMEFWWEP-ZDUSSCGKSA-N	0	3	349.394	3.277	20	30		EGEDHN
C=CC1(CC(=O)NCCNCc2ccc(Cl)nc2)CCCCC1	ZINC001135186522	1376959500	/nfs/dbraw/zinc/95/95/00/1376959500.db2.gz	GXVPMMNNFHPRTI-UHFFFAOYSA-N	0	3	335.879	3.467	20	30		EGEDHN
Fc1ccc(CN2CCNC[C@@H]2C(F)(F)F)c(F)c1C(F)(F)F	ZINC001236981241	1376969388	/nfs/dbraw/zinc/96/93/88/1376969388.db2.gz	LXBJLWJYFMICAT-SECBINFHSA-N	0	3	348.237	3.320	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)c1occc1CC	ZINC001135394528	1377071687	/nfs/dbraw/zinc/07/16/87/1377071687.db2.gz	IFWUOCBWCYPJAN-NWDGAFQWSA-N	0	3	343.265	3.237	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](C)C[C@@H](C)NCc2ccn(CC)n2)CC1	ZINC001135414600	1377081612	/nfs/dbraw/zinc/08/16/12/1377081612.db2.gz	BFXDIVMXJJIQTL-HZPDHXFCSA-N	0	3	332.492	3.022	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)C1(C)CC(=C)C1	ZINC001135420718	1377086657	/nfs/dbraw/zinc/08/66/57/1377086657.db2.gz	YVGZGNDJASHYCI-OLZOCXBDSA-N	0	3	329.282	3.124	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H](C)C[C@H](C)NCc2ccccc2C#N)C1	ZINC001135426674	1377089915	/nfs/dbraw/zinc/08/99/15/1377089915.db2.gz	GNGCAAWSHICWFU-HOTGVXAUSA-N	0	3	325.456	3.287	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H](C)C[C@H](C)NCc2nc(C)sc2C)C1	ZINC001135426985	1377090915	/nfs/dbraw/zinc/09/09/15/1377090915.db2.gz	KEIPTZWKJQMQQV-STQMWFEESA-N	0	3	335.517	3.489	20	30		EGEDHN
CCCn1cc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)c(C)n1	ZINC001263306633	1377134785	/nfs/dbraw/zinc/13/47/85/1377134785.db2.gz	DFDZDCKVOXGGCE-LBPRGKRZSA-N	0	3	344.802	3.216	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)c1cc(C)[nH]c1C	ZINC001135561570	1377145454	/nfs/dbraw/zinc/14/54/54/1377145454.db2.gz	SSXASZQVOHQKEI-MNOVXSKESA-N	0	3	342.281	3.027	20	30		EGEDHN
C[C@H](CNC(=O)c1c[nH]c2ccccc21)NCc1ccc(C#N)s1	ZINC001265797326	1377167170	/nfs/dbraw/zinc/16/71/70/1377167170.db2.gz	YUWSEDGQQOAKLD-GFCCVEGCSA-N	0	3	338.436	3.009	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)CCC1(C)CC1	ZINC001135840517	1377229030	/nfs/dbraw/zinc/22/90/30/1377229030.db2.gz	KEBZAUXTDMDYTR-OLZOCXBDSA-N	0	3	331.298	3.348	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3nc4ccccc4s3)C2)C1=O	ZINC001136950464	1377444945	/nfs/dbraw/zinc/44/49/45/1377444945.db2.gz	YWRUJXLEMMLZRH-IBGZPJMESA-N	0	3	341.480	3.297	20	30		EGEDHN
N#Cc1ccccc1OC1CCN(Cc2ccc3[nH]cnc3c2)CC1	ZINC001137047887	1377465900	/nfs/dbraw/zinc/46/59/00/1377465900.db2.gz	RUYGQZYNBABCIQ-UHFFFAOYSA-N	0	3	332.407	3.478	20	30		EGEDHN
N#Cc1ccccc1OC1CCN(Cc2ccc3nc[nH]c3c2)CC1	ZINC001137047887	1377465901	/nfs/dbraw/zinc/46/59/01/1377465901.db2.gz	RUYGQZYNBABCIQ-UHFFFAOYSA-N	0	3	332.407	3.478	20	30		EGEDHN
Cc1ccc(C2(O)CCN(Cc3ccc(OCC#N)cc3)CC2)cc1	ZINC001137114541	1377481201	/nfs/dbraw/zinc/48/12/01/1377481201.db2.gz	QCNZANUHSCRDHF-UHFFFAOYSA-N	0	3	336.435	3.381	20	30		EGEDHN
C=CCO[C@@H]1CO[C@]2(C1)CCCN(Cc1cc3ccccc3[nH]1)C2	ZINC001137317806	1377517482	/nfs/dbraw/zinc/51/74/82/1377517482.db2.gz	SSVTVLWHELTPIB-ICSRJNTNSA-N	0	3	326.440	3.494	20	30		EGEDHN
CC(C)(C(=O)N[C@H](CNCc1ccc(C#N)cc1F)C1CC1)C1CC1	ZINC001269103461	1377538855	/nfs/dbraw/zinc/53/88/55/1377538855.db2.gz	DMSKUDBEWXSPDR-GOSISDBHSA-N	0	3	343.446	3.118	20	30		EGEDHN
O=C1C=C2CN(Cc3c(F)cccc3Br)CCC2S1	ZINC001137464322	1377552229	/nfs/dbraw/zinc/55/22/29/1377552229.db2.gz	WDBCGMHXDUZYFY-ZDUSSCGKSA-N	0	3	342.233	3.362	20	30		EGEDHN
CCN1CCN(Cc2ccc(N(C)c3ccc(C#N)cc3)cc2)CC1	ZINC001137898251	1377640745	/nfs/dbraw/zinc/64/07/45/1377640745.db2.gz	LNWKJYPMQUOQRK-UHFFFAOYSA-N	0	3	334.467	3.464	20	30		EGEDHN
C#CCOc1ccc(CN2CCC(OC3CCC3)CC2)cc1OC	ZINC001138343705	1377706157	/nfs/dbraw/zinc/70/61/57/1377706157.db2.gz	OFZBRQZAWUDIAF-UHFFFAOYSA-N	0	3	329.440	3.241	20	30		EGEDHN
C#CCOc1ccc(CN2CCC(O)(c3ccc(C)cc3)CC2)cc1	ZINC001138555342	1377741583	/nfs/dbraw/zinc/74/15/83/1377741583.db2.gz	YNZDJWXAAANJSP-UHFFFAOYSA-N	0	3	335.447	3.491	20	30		EGEDHN
C=CCO[C@H]1CO[C@@]2(C1)CCCN(Cc1c[nH]nc1C(C)(C)C)C2	ZINC001138578950	1377746925	/nfs/dbraw/zinc/74/69/25/1377746925.db2.gz	HHSQHMIBIOUHSM-VQIMIIECSA-N	0	3	333.476	3.033	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCc3cc(C(=O)OC)ccc3C2)c1[O-]	ZINC001138625523	1377756096	/nfs/dbraw/zinc/75/60/96/1377756096.db2.gz	NPOOUAHVSYDWJD-UHFFFAOYSA-N	0	3	337.419	3.466	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCc3cc(C(=O)OC)ccc3C2)c1[O-]	ZINC001138625523	1377756098	/nfs/dbraw/zinc/75/60/98/1377756098.db2.gz	NPOOUAHVSYDWJD-UHFFFAOYSA-N	0	3	337.419	3.466	20	30		EGEDHN
C=C(C)COc1ccccc1CN1CCC2(CC(N(C)C)=NO2)CC1	ZINC001138661247	1377764622	/nfs/dbraw/zinc/76/46/22/1377764622.db2.gz	QOYFOKKHYNCLBD-UHFFFAOYSA-N	0	3	343.471	3.272	20	30		EGEDHN
CCCCc1nc(Cl)c(CN2CCC3SC(=O)C=C3C2)[nH]1	ZINC001139178577	1377844933	/nfs/dbraw/zinc/84/49/33/1377844933.db2.gz	VUSQSNYHIRSFGJ-GFCCVEGCSA-N	0	3	325.865	3.180	20	30		EGEDHN
N#Cc1ccnc(-c2ccc(CN3CCC4SC(=O)C=C4C3)cc2)c1	ZINC001139402456	1377879021	/nfs/dbraw/zinc/87/90/21/1377879021.db2.gz	RYMYLTNVVZXKGJ-IBGZPJMESA-N	0	3	347.443	3.394	20	30		EGEDHN
N#Cc1ccnc(-c2ccc(CN3CC[C@@H]4SC(=O)C=C4C3)cc2)c1	ZINC001139402456	1377879022	/nfs/dbraw/zinc/87/90/22/1377879022.db2.gz	RYMYLTNVVZXKGJ-IBGZPJMESA-N	0	3	347.443	3.394	20	30		EGEDHN
C[C@@H]1CN(C)[C@@H](C)CN1Cc1ccc(Oc2ccc(C#N)cc2)nc1	ZINC001139426118	1377882278	/nfs/dbraw/zinc/88/22/78/1377882278.db2.gz	FEDNMXJWIHUQDB-JKSUJKDBSA-N	0	3	336.439	3.270	20	30		EGEDHN
O=C1C=C2CN(Cc3cccc(Br)c3F)CCC2S1	ZINC001139533596	1377898822	/nfs/dbraw/zinc/89/88/22/1377898822.db2.gz	LFYSJEFXWMZVBM-LBPRGKRZSA-N	0	3	342.233	3.362	20	30		EGEDHN
Cc1ccc(CN2CC[C@@H]3[C@@H]2CCN3Cc2cc(C#N)ccc2F)o1	ZINC001139646336	1377925012	/nfs/dbraw/zinc/92/50/12/1377925012.db2.gz	PGOMCURMQSIQSV-UXHICEINSA-N	0	3	339.414	3.448	20	30		EGEDHN
CC(=O)N(C(C)C)C1CCN(Cc2c[nH]c3c2cccc3C#N)CC1	ZINC001139707088	1377938148	/nfs/dbraw/zinc/93/81/48/1377938148.db2.gz	PEXFPFBMIZIDNO-UHFFFAOYSA-N	0	3	338.455	3.261	20	30		EGEDHN
COc1cccc(O[C@@H]2CCN(Cc3c[nH]c4c3cccc4C#N)C2)n1	ZINC001139706665	1377938176	/nfs/dbraw/zinc/93/81/76/1377938176.db2.gz	DLCCGRKSCPQFKS-MRXNPFEDSA-N	0	3	348.406	3.096	20	30		EGEDHN
Cc1ccc(CN2C[C@@H]3CN(C(=O)c4ccccc4)C[C@@H]3C2)cc1C#N	ZINC001139724994	1377941948	/nfs/dbraw/zinc/94/19/48/1377941948.db2.gz	YOEWGRZGNXXMJH-OYRHEFFESA-N	0	3	345.446	3.071	20	30		EGEDHN
C=CCn1cc(CN(C[C@@H](O)c2ccccc2OC)C(C)C)cn1	ZINC001139772970	1377949378	/nfs/dbraw/zinc/94/93/78/1377949378.db2.gz	VSOBJYVWDVTCNC-GOSISDBHSA-N	0	3	329.444	3.022	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3cncc4ccccc43)C2)C1=O	ZINC001139894465	1377974242	/nfs/dbraw/zinc/97/42/42/1377974242.db2.gz	RGEZEGCVAKBBMJ-OAQYLSRUSA-N	0	3	335.451	3.235	20	30		EGEDHN
Cn1ncc2ccc(CN3CCC[C@@H](Oc4ccccc4C#N)C3)cc21	ZINC001139908012	1377975959	/nfs/dbraw/zinc/97/59/59/1377975959.db2.gz	VQECIXNQPYFMSW-LJQANCHMSA-N	0	3	346.434	3.488	20	30		EGEDHN
C=CCN1C(=O)CCC[C@]12CCC[N@@H+](Cc1cc(F)ccc1[O-])C2	ZINC001140062883	1377999540	/nfs/dbraw/zinc/99/95/40/1377999540.db2.gz	HMKXTBGVIHMWLQ-LJQANCHMSA-N	0	3	332.419	3.064	20	30		EGEDHN
C=CCN1C(=O)CCC[C@]12CCC[N@H+](Cc1cc(F)ccc1[O-])C2	ZINC001140062883	1377999543	/nfs/dbraw/zinc/99/95/43/1377999543.db2.gz	HMKXTBGVIHMWLQ-LJQANCHMSA-N	0	3	332.419	3.064	20	30		EGEDHN
Cc1cncnc1OC1CCN(Cc2c[nH]c3ccc(C#N)cc23)CC1	ZINC001140117309	1378011767	/nfs/dbraw/zinc/01/17/67/1378011767.db2.gz	PIEVBRDYNXAWTM-UHFFFAOYSA-N	0	3	347.422	3.181	20	30		EGEDHN
N#Cc1ccc2[nH]cc(CN3C[C@@H]4C[C@H]3CN4Cc3ccccc3)c2c1	ZINC001140115079	1378012117	/nfs/dbraw/zinc/01/21/17/1378012117.db2.gz	MHLINUTWPFAPEP-PMACEKPBSA-N	0	3	342.446	3.498	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@]3(CCN(C4CCCC4)C3=O)C2)c(F)c1	ZINC001273304035	1378096113	/nfs/dbraw/zinc/09/61/13/1378096113.db2.gz	QZBXVQIKSUUPLD-FQEVSTJZSA-N	0	3	341.430	3.064	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@]23CCN(CC(C)C)C3=O)c1[O-]	ZINC001273360528	1378099173	/nfs/dbraw/zinc/09/91/73/1378099173.db2.gz	QDXPRTURWNNBJX-OAQYLSRUSA-N	0	3	342.483	3.344	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@]23CCN(CC(C)C)C3=O)c1[O-]	ZINC001273360528	1378099174	/nfs/dbraw/zinc/09/91/74/1378099174.db2.gz	QDXPRTURWNNBJX-OAQYLSRUSA-N	0	3	342.483	3.344	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@@]23CCN([C@@H](C)CC)C3=O)c1[O-]	ZINC001273360224	1378099356	/nfs/dbraw/zinc/09/93/56/1378099356.db2.gz	JCZRFAVIROLLOV-KKSFZXQISA-N	0	3	342.483	3.486	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@@]23CCN([C@@H](C)CC)C3=O)c1[O-]	ZINC001273360224	1378099359	/nfs/dbraw/zinc/09/93/59/1378099359.db2.gz	JCZRFAVIROLLOV-KKSFZXQISA-N	0	3	342.483	3.486	20	30		EGEDHN
COC(=O)Cc1ccccc1CN1CCC(C#N)(c2ccccc2)CC1	ZINC001140651095	1378105558	/nfs/dbraw/zinc/10/55/58/1378105558.db2.gz	ZJWKXEGSNBOLAG-UHFFFAOYSA-N	0	3	348.446	3.459	20	30		EGEDHN
CCCCN1CC2(C1)SCC[C@@H]2C(=O)Nc1cc(C)ccc1C#N	ZINC001278218342	1378264737	/nfs/dbraw/zinc/26/47/37/1378264737.db2.gz	YONDKKOCROGIDC-MRXNPFEDSA-N	0	3	343.496	3.413	20	30		EGEDHN
CC(C)(C)[C@@H](CNCc1cc(C#N)ccc1F)NC(=O)[C@H]1CC1(C)C	ZINC001278956684	1378294049	/nfs/dbraw/zinc/29/40/49/1378294049.db2.gz	NULUZSDPMJKUNS-NVXWUHKLSA-N	0	3	345.462	3.364	20	30		EGEDHN
Cn1cc(CN2C[C@H]3C[C@@H](C2)N3CCCCc2ccccc2)cc1C#N	ZINC001279634690	1378317514	/nfs/dbraw/zinc/31/75/14/1378317514.db2.gz	PHHNLCHWMSJLIC-SZPZYZBQSA-N	0	3	348.494	3.178	20	30		EGEDHN
N#Cc1ccc2c(CN3CCC(Oc4ccccn4)CC3)c[nH]c2c1	ZINC001142921933	1378508962	/nfs/dbraw/zinc/50/89/62/1378508962.db2.gz	ZKEHEMWXLMQETG-UHFFFAOYSA-N	0	3	332.407	3.478	20	30		EGEDHN
C[C@@H](CNC(=O)C1(F)CCCCC1)N(C)Cc1ccc(C#N)cc1	ZINC001282478823	1378511113	/nfs/dbraw/zinc/51/11/13/1378511113.db2.gz	RAYVYJGGLHHFFE-HNNXBMFYSA-N	0	3	331.435	3.167	20	30		EGEDHN
Cc1cccnc1O[C@@H]1CCN(Cc2c[nH]c3cc(C#N)ccc23)C1	ZINC001142930790	1378511950	/nfs/dbraw/zinc/51/19/50/1378511950.db2.gz	MQXGFKVCYUCRSU-QGZVFWFLSA-N	0	3	332.407	3.396	20	30		EGEDHN
O=C1C=C2CN(Cc3ccc(F)c(OC(F)(F)F)c3)CCC2S1	ZINC001143443175	1378598046	/nfs/dbraw/zinc/59/80/46/1378598046.db2.gz	XIGUMINTWPIAJY-CYBMUJFWSA-N	0	3	347.333	3.498	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3cc(C)c(F)c(F)c3)C2)C1=O	ZINC001143599603	1378623170	/nfs/dbraw/zinc/62/31/70/1378623170.db2.gz	HSYLMSBCOLRODK-LJQANCHMSA-N	0	3	334.410	3.274	20	30		EGEDHN
COC(=O)[C@@H](c1ccccc1)[C@@H]1CCCCN1Cc1cncc(C#N)c1	ZINC001144083626	1378680888	/nfs/dbraw/zinc/68/08/88/1378680888.db2.gz	LXTNERDUIUOUJQ-PMACEKPBSA-N	0	3	349.434	3.265	20	30		EGEDHN
N#Cc1cccc(O[C@@H]2CCCN(Cc3ccc4cc[nH]c4n3)C2)c1	ZINC001144186508	1378694714	/nfs/dbraw/zinc/69/47/14/1378694714.db2.gz	WWAQFAKBPUARNR-LJQANCHMSA-N	0	3	332.407	3.478	20	30		EGEDHN
C#Cc1ccc(CN2CC[C@@H]3[C@@H](CN3C(=O)OC(C)(C)C)C2)cc1	ZINC001144568069	1378745686	/nfs/dbraw/zinc/74/56/86/1378745686.db2.gz	JRGBFPRSDPJIOS-QZTJIDSGSA-N	0	3	326.440	3.109	20	30		EGEDHN
C#Cc1ccc(CN2CCC(c3nc(-c4cccnc4)no3)CC2)cc1	ZINC001144573110	1378746778	/nfs/dbraw/zinc/74/67/78/1378746778.db2.gz	BGUQVDWBUBPCIC-UHFFFAOYSA-N	0	3	344.418	3.493	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2cc(C)ncn2)CCCC1	ZINC001146820463	1378927732	/nfs/dbraw/zinc/92/77/32/1378927732.db2.gz	GATMIRHVDAQXKH-WBVHZDCISA-N	0	3	344.503	3.294	20	30		EGEDHN
C=CCCC(=O)N1CC2(C1)CCN([C@H]1CCc3ccc(F)cc31)C2	ZINC001147188279	1378984397	/nfs/dbraw/zinc/98/43/97/1378984397.db2.gz	WQNQNPGWTKJNAV-SFHVURJKSA-N	0	3	328.431	3.314	20	30		EGEDHN
CC[C@H](CC(=O)NCCNCc1ccc(C#N)c(F)c1)C(C)(C)C	ZINC001147466363	1379026552	/nfs/dbraw/zinc/02/65/52/1379026552.db2.gz	JWJNDDUXJJRZJY-MRXNPFEDSA-N	0	3	333.451	3.366	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC2(C1)CCN(CCOc1ccccc1)C2	ZINC001148129507	1379122063	/nfs/dbraw/zinc/12/20/63/1379122063.db2.gz	GCHZUQINQMKAKP-SFHVURJKSA-N	0	3	342.483	3.202	20	30		EGEDHN
C=CCCC1(C(=O)N2CC3(C2)CCN(Cc2ccc(C#N)cc2)C3)CC1	ZINC001148263026	1379140882	/nfs/dbraw/zinc/14/08/82/1379140882.db2.gz	UIQGKONCUQWNOS-UHFFFAOYSA-N	0	3	349.478	3.339	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)C[C@@H]2CCCc3ccccc32)cc1	ZINC001148655609	1379234575	/nfs/dbraw/zinc/23/45/75/1379234575.db2.gz	PKEAGTHDGGCDLR-FQEVSTJZSA-N	0	3	347.462	3.274	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@H](C)CCc3cccc(F)c3)C2)C1	ZINC001148797011	1379269768	/nfs/dbraw/zinc/26/97/68/1379269768.db2.gz	BLUNYFOVBDDGAW-MRXNPFEDSA-N	0	3	330.447	3.115	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N1CC2(C1)CCN([C@@H](C)c1ccc(F)cc1)C2	ZINC001148899865	1379293758	/nfs/dbraw/zinc/29/37/58/1379293758.db2.gz	IFGUQTQMJWLEAH-HOTGVXAUSA-N	0	3	346.446	3.012	20	30		EGEDHN
CN1CCC[C@@H]2CN(C(=O)c3ccc(C(C)(C)CCC#N)cc3)C[C@@H]21	ZINC001148906684	1379296142	/nfs/dbraw/zinc/29/61/42/1379296142.db2.gz	WFAQKELQKQPBKQ-MJGOQNOKSA-N	0	3	339.483	3.434	20	30		EGEDHN
Cc1nc(-c2ccc3c(c2)CCN3C(=O)[C@@H](N)CCCC#N)cs1	ZINC001327855283	1388606757	/nfs/dbraw/zinc/60/67/57/1388606757.db2.gz	BDQZWVBKPPZCIT-HNNXBMFYSA-N	0	3	340.452	3.029	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@H]1CN([C@H](C)c2ccccc2)CCCO1	ZINC001150165483	1379507970	/nfs/dbraw/zinc/50/79/70/1379507970.db2.gz	LQRKLQWVAGZUMS-UYAOXDASSA-N	0	3	342.483	3.148	20	30		EGEDHN
C=CCCCC(=O)NC[C@H]1CN(Cc2cc(C)ccc2C)CCCO1	ZINC001150211820	1379516406	/nfs/dbraw/zinc/51/64/06/1379516406.db2.gz	LKMFQYGGAQFMGR-FQEVSTJZSA-N	0	3	344.499	3.367	20	30		EGEDHN
C#CCCN1CCCO[C@H](CNC(=O)[C@H](CCC)CC2CCCC2)C1	ZINC001150404579	1379549588	/nfs/dbraw/zinc/54/95/88/1379549588.db2.gz	ZMUQDVNIQPOHDW-WOJBJXKFSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)C[C@@H](C)C2CCCCC2)C1	ZINC001150436303	1379552219	/nfs/dbraw/zinc/55/22/19/1379552219.db2.gz	QTBKVKSDIRQKMV-IEBWSBKVSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)C[C@H](CC)c2ccccc2)C1	ZINC001150579127	1379572392	/nfs/dbraw/zinc/57/23/92/1379572392.db2.gz	KMKDSHYHDYOTHN-AZUAARDMSA-N	0	3	344.499	3.354	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)[C@H](F)CC2CCCCC2)C1	ZINC001150595854	1379575800	/nfs/dbraw/zinc/57/58/00/1379575800.db2.gz	DUUDXFLBQRXTFW-ZWKOTPCHSA-N	0	3	340.483	3.078	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)[C@H](F)CC2CCCCC2)C1	ZINC001150595852	1379575995	/nfs/dbraw/zinc/57/59/95/1379575995.db2.gz	DUUDXFLBQRXTFW-QZTJIDSGSA-N	0	3	340.483	3.078	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)[C@H](CC)c2ccc(F)cc2)C1	ZINC001150786985	1379614670	/nfs/dbraw/zinc/61/46/70/1379614670.db2.gz	HPJCIXLODYVVCY-RTBURBONSA-N	0	3	348.462	3.103	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)C(CC(C)C)CC(C)C)C1	ZINC001150787931	1379615113	/nfs/dbraw/zinc/61/51/13/1379615113.db2.gz	PHPMHNHTEJBLHS-IBGZPJMESA-N	0	3	338.536	3.478	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2cc(C)cs2)CC1	ZINC001151107735	1379662103	/nfs/dbraw/zinc/66/21/03/1379662103.db2.gz	IRDJENBDKXNDTI-UHFFFAOYSA-N	0	3	336.501	3.234	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2ccoc2C2CC2)CC1	ZINC001151266350	1379690360	/nfs/dbraw/zinc/69/03/60/1379690360.db2.gz	BDHWKVYVLRYSEP-UHFFFAOYSA-N	0	3	346.471	3.334	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2cccn2C(C)C)CC1	ZINC001151410312	1379713198	/nfs/dbraw/zinc/71/31/98/1379713198.db2.gz	ZCCOANOPNZHWGO-UHFFFAOYSA-N	0	3	347.503	3.246	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)C1CCCC1	ZINC001151482402	1379725661	/nfs/dbraw/zinc/72/56/61/1379725661.db2.gz	ZLAHTDIVXLRJRA-CQSZACIVSA-N	0	3	331.435	3.214	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)[C@@H]1CC=CCC1	ZINC001151829099	1379789535	/nfs/dbraw/zinc/78/95/35/1379789535.db2.gz	DINJZORRUJRMTM-NVXWUHKLSA-N	0	3	343.446	3.380	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)[C@@H]1CC=CCC1	ZINC001151830237	1379789550	/nfs/dbraw/zinc/78/95/50/1379789550.db2.gz	LXNJNHOCIRJLCU-VQIMIIECSA-N	0	3	325.456	3.241	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)CC(C)(C)CC(F)(F)F)CC1	ZINC001754631416	1440647946	/nfs/dbraw/zinc/64/79/46/1440647946.db2.gz	QGYHUWDMQWGRAQ-UHFFFAOYSA-N	0	3	332.410	3.349	20	30		EGEDHN
CC/C=C(/C)C(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)c(F)c1	ZINC001152189652	1379880769	/nfs/dbraw/zinc/88/07/69/1379880769.db2.gz	URLMSQHTUPKPNT-XIEDVDOYSA-N	0	3	331.435	3.380	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)[C@H]1[C@@H]2CCCC[C@@H]21	ZINC001152604778	1379956427	/nfs/dbraw/zinc/95/64/27/1379956427.db2.gz	SXGTVCXXWMIGGK-XCLNPWKQSA-N	0	3	339.483	3.321	20	30		EGEDHN
CCCC[C@H](C(=O)NCCNCc1ccc(F)c(C#N)c1)C(C)C	ZINC001152652942	1379963318	/nfs/dbraw/zinc/96/33/18/1379963318.db2.gz	OHNJYHRDJHVERD-KRWDZBQOSA-N	0	3	333.451	3.366	20	30		EGEDHN
CCN(Cc1cccc(Cl)c1)[C@H](C)CNC(=O)c1ccc(C#N)[nH]1	ZINC001152790526	1379981677	/nfs/dbraw/zinc/98/16/77/1379981677.db2.gz	RPRPJGDQOUJDSP-CYBMUJFWSA-N	0	3	344.846	3.180	20	30		EGEDHN
Cc1cc(CCC(=O)NCCNCc2cccc(C#N)c2)c(C)s1	ZINC001152884761	1379989941	/nfs/dbraw/zinc/98/99/41/1379989941.db2.gz	MARGTWMJMIALIQ-UHFFFAOYSA-N	0	3	341.480	3.075	20	30		EGEDHN
CC1(C)CCCC[C@H]1C(=O)NCCNCc1ccc(C#N)c(F)c1	ZINC001152911557	1379992949	/nfs/dbraw/zinc/99/29/49/1379992949.db2.gz	XAOOAXOFZPPOMN-INIZCTEOSA-N	0	3	331.435	3.120	20	30		EGEDHN
C[C@@H]1CCCC[C@H]1CC(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001153255323	1380045866	/nfs/dbraw/zinc/04/58/66/1380045866.db2.gz	ZNCXIDWRVJYREX-ZBFHGGJFSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=CCC1(C(=O)NCCNCc2ccc(C#N)c(F)c2)CCCC1	ZINC001153816280	1380135674	/nfs/dbraw/zinc/13/56/74/1380135674.db2.gz	BQDOOROKIHGWRX-UHFFFAOYSA-N	0	3	329.419	3.040	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)[C@H](C)CC(F)F	ZINC001154359628	1380264050	/nfs/dbraw/zinc/26/40/50/1380264050.db2.gz	DKCLCJUPIWOXMZ-ZIAGYGMSSA-N	0	3	337.414	3.176	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)CC1(C)CC1	ZINC001154373491	1380266724	/nfs/dbraw/zinc/26/67/24/1380266724.db2.gz	JXVMYTBBEYXNQQ-CQSZACIVSA-N	0	3	331.435	3.214	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)C[C@@H]1C[C@H]1C1CC1	ZINC001154385410	1380268451	/nfs/dbraw/zinc/26/84/51/1380268451.db2.gz	IMBNOGZYEHLKAY-XPGWFJOJSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@@H](C)N(CC)Cc1ccc2nonc2c1	ZINC001155072818	1380403483	/nfs/dbraw/zinc/40/34/83/1380403483.db2.gz	LSMKMUJYFNTQFT-AUUYWEPGSA-N	0	3	344.459	3.152	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1ccc(C(F)F)c(F)c1	ZINC001155217048	1380426116	/nfs/dbraw/zinc/42/61/16/1380426116.db2.gz	CCSHOPJRDRTWSO-GFCCVEGCSA-N	0	3	326.362	3.227	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)[C@@H]1C[C@H]1C1CC1	ZINC001155744671	1380488744	/nfs/dbraw/zinc/48/87/44/1380488744.db2.gz	ZMOCUFQHDKLYQC-JEBQAFNWSA-N	0	3	343.446	3.070	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)Cc1ccccc1C	ZINC001156819576	1380647533	/nfs/dbraw/zinc/64/75/33/1380647533.db2.gz	JYLXJSHDFYFSLO-GOSISDBHSA-N	0	3	349.478	3.436	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NC[C@@H](C)N(CC)Cc1cc(F)ccc1C	ZINC001157217648	1380813780	/nfs/dbraw/zinc/81/37/80/1380813780.db2.gz	UPZHUIBFAJKCSB-CVEARBPZSA-N	0	3	336.451	3.052	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)c1ccc(F)s1	ZINC001157255890	1380825112	/nfs/dbraw/zinc/82/51/12/1380825112.db2.gz	NZLDSIHLTJMXDA-CYBMUJFWSA-N	0	3	345.443	3.399	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc(-c2ccco2)on1	ZINC001158289257	1381186840	/nfs/dbraw/zinc/18/68/40/1381186840.db2.gz	ARCSYDSZZZTYOQ-CQSZACIVSA-N	0	3	329.400	3.047	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc(C(F)(F)F)cn1	ZINC001158304643	1381193874	/nfs/dbraw/zinc/19/38/74/1381193874.db2.gz	QDTXQEZLODKKNU-CQSZACIVSA-N	0	3	341.377	3.213	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCCC[C@@H]1CN(C)CCOCC1CC1	ZINC001158370190	1381221965	/nfs/dbraw/zinc/22/19/65/1381221965.db2.gz	QVPRAWDNEJZZRN-PKOBYXMFSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccnc(OC2CCC2)c1	ZINC001158661546	1381341238	/nfs/dbraw/zinc/34/12/38/1381341238.db2.gz	YMAWDBHVEXYINN-QGZVFWFLSA-N	0	3	343.471	3.125	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)[C@H]1CC[C@H](C)CC1	ZINC001158768559	1381390597	/nfs/dbraw/zinc/39/05/97/1381390597.db2.gz	XESDNEMCRBALGB-GUDVDZBRSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=C(Cl)CN(C)C[C@H]1CCCCN1C(=O)c1[nH]nc2ccccc21	ZINC001158818125	1381413303	/nfs/dbraw/zinc/41/33/03/1381413303.db2.gz	AVKGHELWCZGPIB-CQSZACIVSA-N	0	3	346.862	3.242	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)COc1ccccc1CC	ZINC001158819761	1381416360	/nfs/dbraw/zinc/41/63/60/1381416360.db2.gz	ZIGAXFHGOMQDAV-GOSISDBHSA-N	0	3	330.472	3.127	20	30		EGEDHN
C=C(C)CCC(=O)NCCCNCc1ccc(-c2ncco2)cc1F	ZINC001159032775	1381525240	/nfs/dbraw/zinc/52/52/40/1381525240.db2.gz	SWCVIHMSEIJESH-UHFFFAOYSA-N	0	3	345.418	3.433	20	30		EGEDHN
C[C@H](N)c1ncc(-c2ccccc2)n1-c1nc(Cl)c(C#N)cc1C#N	ZINC001159592571	1381839714	/nfs/dbraw/zinc/83/97/14/1381839714.db2.gz	YLTZQNMXMNQZCS-NSHDSACASA-N	0	3	348.797	3.351	20	30		EGEDHN
C#CCC1(C(=O)NCCCNCc2cc(F)ccc2Cl)CCC1	ZINC001159638526	1381856692	/nfs/dbraw/zinc/85/66/92/1381856692.db2.gz	WAQZWKLLRAOWAG-UHFFFAOYSA-N	0	3	336.838	3.269	20	30		EGEDHN
CN(Cc1ccc(NC(=N)c2ccc3ccccc3n2)nc1)C1CC1	ZINC001159904265	1381933638	/nfs/dbraw/zinc/93/36/38/1381933638.db2.gz	LMNOMIXSNMLPNV-UHFFFAOYSA-N	0	3	331.423	3.261	20	30		EGEDHN
C[C@@H]1CC(=O)C=C(Nc2ccc(Br)c3c2CNCC3)C1	ZINC001159942183	1381943695	/nfs/dbraw/zinc/94/36/95/1381943695.db2.gz	WFHQGKFQWPQYSV-JTQLQIEISA-N	0	3	335.245	3.390	20	30		EGEDHN
Cc1cccnc1CN1CC=C(CCNC(=O)C#CC(C)(C)C)CC1	ZINC001160084632	1381992733	/nfs/dbraw/zinc/99/27/33/1381992733.db2.gz	USCVDFFPIQTKEL-UHFFFAOYSA-N	0	3	339.483	3.078	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H](CC)OC2CCCCC2)CC1	ZINC001160131297	1382008652	/nfs/dbraw/zinc/00/86/52/1382008652.db2.gz	KIQVQXKIEQFCMB-HXUWFJFHSA-N	0	3	346.515	3.276	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc(C3CCCCC3)n[nH]2)CC1	ZINC001160374084	1382086335	/nfs/dbraw/zinc/08/63/35/1382086335.db2.gz	DFFGCGRUOJRKKE-UHFFFAOYSA-N	0	3	342.487	3.395	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc(C)n([C@H](C)C3CC3)n2)CC1	ZINC001160559087	1382141536	/nfs/dbraw/zinc/14/15/36/1382141536.db2.gz	CHSHVQHBAPHWMY-MRXNPFEDSA-N	0	3	342.487	3.101	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc(C)n(C(CC)CC)n2)CC1	ZINC001160580031	1382147719	/nfs/dbraw/zinc/14/77/19/1382147719.db2.gz	DZAJCHXRFVIQOD-UHFFFAOYSA-N	0	3	344.503	3.491	20	30		EGEDHN
N#C[C@@H]1CCCCN1C(=O)C[C@@H](N)c1ccc(Cl)cc1Cl	ZINC001160637119	1382158401	/nfs/dbraw/zinc/15/84/01/1382158401.db2.gz	KPGLVVQTZICGHW-SMDDNHRTSA-N	0	3	326.227	3.288	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)Cc2ccc(C(F)F)cc2)CC1	ZINC001160666052	1382165668	/nfs/dbraw/zinc/16/56/68/1382165668.db2.gz	PDVGDTZTLIVCOG-UHFFFAOYSA-N	0	3	334.410	3.491	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2F)CC1	ZINC001160748767	1382185552	/nfs/dbraw/zinc/18/55/52/1382185552.db2.gz	NTJWRYOZHLFVBY-ZWKOTPCHSA-N	0	3	346.421	3.393	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H]2CCCC[C@H]2C2CC2)CC1	ZINC001160778043	1382192944	/nfs/dbraw/zinc/19/29/44/1382192944.db2.gz	DBSFACIIEOXHNQ-VQTJNVASSA-N	0	3	328.500	3.365	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H](C)OCc2ccccc2C)CC1	ZINC001160792637	1382196894	/nfs/dbraw/zinc/19/68/94/1382196894.db2.gz	HOEYCXYXLTXGSI-GOSISDBHSA-N	0	3	342.483	3.225	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)c1ccccc1-c1ccncc1	ZINC001160932465	1382239381	/nfs/dbraw/zinc/23/93/81/1382239381.db2.gz	XWONFAWLEPMJAL-UHFFFAOYSA-N	0	3	329.831	3.211	20	30		EGEDHN
C#CC[C@H](N)C(=O)N(C)[C@@H](C)[C@H](Oc1ccccc1)c1ccccc1	ZINC001160998958	1382267832	/nfs/dbraw/zinc/26/78/32/1382267832.db2.gz	VQRRPWJVIGTDIL-VDGAXYAQSA-N	0	3	336.435	3.004	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc(C)c(F)c2F)CC1	ZINC001161300837	1382364644	/nfs/dbraw/zinc/36/46/44/1382364644.db2.gz	GLNACGUBSBODMN-UHFFFAOYSA-N	0	3	332.394	3.049	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCC1=CCN(CCOCC(C)C)CC1	ZINC001161343557	1382376438	/nfs/dbraw/zinc/37/64/38/1382376438.db2.gz	JHLMOBQDFBWBEB-UHFFFAOYSA-N	0	3	336.520	3.400	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2csc(C(F)(F)F)n2)CC1	ZINC001161645748	1382469301	/nfs/dbraw/zinc/46/93/01/1382469301.db2.gz	QHUJHSSXVSLXBC-UHFFFAOYSA-N	0	3	345.390	3.100	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C(C)(C)Cc2ccccc2)CC1	ZINC001161656369	1382472917	/nfs/dbraw/zinc/47/29/17/1382472917.db2.gz	UQDJQIMIDHKHHH-UHFFFAOYSA-N	0	3	338.495	3.417	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc(C3CC3)s2)CC1	ZINC001161698946	1382483676	/nfs/dbraw/zinc/48/36/76/1382483676.db2.gz	GVJFCFADQCEGJI-UHFFFAOYSA-N	0	3	328.481	3.401	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)Cc2c[nH]c3cccc(C)c23)CC1	ZINC001161709027	1382486823	/nfs/dbraw/zinc/48/68/23/1382486823.db2.gz	GACPBIRXJNVQTC-UHFFFAOYSA-N	0	3	349.478	3.181	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccccc2OC(C)C)CC1	ZINC001161755223	1382496146	/nfs/dbraw/zinc/49/61/46/1382496146.db2.gz	RGLUZFXBBBWWST-UHFFFAOYSA-N	0	3	328.456	3.412	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C2CCC(C3CC3)CC2)CC1	ZINC001161805474	1382512482	/nfs/dbraw/zinc/51/24/82/1382512482.db2.gz	KNEJFFAEPHROTK-UHFFFAOYSA-N	0	3	328.500	3.365	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc3c(s2)CCC3)CC1	ZINC001161818367	1382519347	/nfs/dbraw/zinc/51/93/47/1382519347.db2.gz	ULXNWGXBULNYIF-UHFFFAOYSA-N	0	3	328.481	3.012	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc3ccccc3n2CC)CC1	ZINC001161938391	1382561120	/nfs/dbraw/zinc/56/11/20/1382561120.db2.gz	KSWLHZCMEDYESA-UHFFFAOYSA-N	0	3	349.478	3.437	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H](CC)c2ccc(F)cc2)CC1	ZINC001161963640	1382573803	/nfs/dbraw/zinc/57/38/03/1382573803.db2.gz	OWOHMHXJVNUCLO-FQEVSTJZSA-N	0	3	342.458	3.481	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H]2Cc3c2cccc3Cl)CC1	ZINC001161982145	1382586808	/nfs/dbraw/zinc/58/68/08/1382586808.db2.gz	AUVDRJUDCTZHDM-QGZVFWFLSA-N	0	3	330.859	3.304	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC1(COC)CCN(C[C@H](F)CC)CC1	ZINC001162464793	1382764757	/nfs/dbraw/zinc/76/47/57/1382764757.db2.gz	VDPQOBUBLVBNNJ-SJLPKXTDSA-N	0	3	342.499	3.182	20	30		EGEDHN
CCOC(=O)c1cc(-n2c3ccccc3nc2[C@H](C)N)ccc1C#N	ZINC001162777010	1382869586	/nfs/dbraw/zinc/86/95/86/1382869586.db2.gz	ISFPLMUYACIHFL-LBPRGKRZSA-N	0	3	334.379	3.094	20	30		EGEDHN
C[C@H](N)c1nc2ccccc2n1-c1cc(Br)cc(C#N)n1	ZINC001162779353	1382870492	/nfs/dbraw/zinc/87/04/92/1382870492.db2.gz	YLBBPZFNZLWADG-VIFPVBQESA-N	0	3	342.200	3.074	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@H](C)C(C)(C)C	ZINC001162840939	1382891212	/nfs/dbraw/zinc/89/12/12/1382891212.db2.gz	JDFDFSOQEPXCDM-SFHVURJKSA-N	0	3	328.500	3.353	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CCCC12CC2	ZINC001162841159	1382891898	/nfs/dbraw/zinc/89/18/98/1382891898.db2.gz	OGSNKNZBKRMERK-FQEVSTJZSA-N	0	3	338.495	3.251	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CCC[C@H]1CCC	ZINC001162850709	1382894807	/nfs/dbraw/zinc/89/48/07/1382894807.db2.gz	PRFLPQPCNICEMP-NHCUHLMSSA-N	0	3	340.511	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C(C)(C)C(C)(C)C	ZINC001162879528	1382903715	/nfs/dbraw/zinc/90/37/15/1382903715.db2.gz	BGYFUILBJZWSOJ-UHFFFAOYSA-N	0	3	328.500	3.353	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@]1(C)CCC[C@@H]1C	ZINC001162918647	1382916279	/nfs/dbraw/zinc/91/62/79/1382916279.db2.gz	FWAQKQSTKJRDRG-GHTZIAJQSA-N	0	3	326.484	3.107	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H](C)c1cccs1	ZINC001162928347	1382918917	/nfs/dbraw/zinc/91/89/17/1382918917.db2.gz	HGOSCBJVLGVGHF-KRWDZBQOSA-N	0	3	340.492	3.146	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1C[C@]1(CC)C(C)C	ZINC001162970863	1382933006	/nfs/dbraw/zinc/93/30/06/1382933006.db2.gz	NOFGCIIUPRQFQA-RBBKRZOGSA-N	0	3	340.511	3.353	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H](C)C1CCCC1	ZINC001162977187	1382934941	/nfs/dbraw/zinc/93/49/41/1382934941.db2.gz	JMOVLACMTPGNLU-GOSISDBHSA-N	0	3	326.484	3.107	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1ccoc1CCC	ZINC001162982357	1382936715	/nfs/dbraw/zinc/93/67/15/1382936715.db2.gz	ARBQVVHOXAKMSO-UHFFFAOYSA-N	0	3	338.451	3.140	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C[C@H](C)CC(C)C	ZINC001162982793	1382936789	/nfs/dbraw/zinc/93/67/89/1382936789.db2.gz	PBLNYVUIHIJBCO-LJQANCHMSA-N	0	3	328.500	3.353	20	30		EGEDHN
C=CCCN1CCN(Cc2ccc(CNC(=O)CC(C)C)cc2)CC1	ZINC001163018533	1382949127	/nfs/dbraw/zinc/94/91/27/1382949127.db2.gz	SPLQALNUAWRVCN-UHFFFAOYSA-N	0	3	343.515	3.043	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)C2(C3CCC3)CCC2)c1	ZINC001163456031	1383055461	/nfs/dbraw/zinc/05/54/61/1383055461.db2.gz	REGGZEVUAOVWQP-UHFFFAOYSA-N	0	3	343.446	3.264	20	30		EGEDHN
CN1c2ccc(NC(=N)c3ccc(C(F)(F)F)cc3)cc2CNC1=O	ZINC001163684973	1383105429	/nfs/dbraw/zinc/10/54/29/1383105429.db2.gz	GDEUGEZCEKJQFB-UHFFFAOYSA-N	0	3	348.328	3.402	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCCNCc2nsc3ccccc32)cc1	ZINC001163729364	1383115207	/nfs/dbraw/zinc/11/52/07/1383115207.db2.gz	QTRWZENMOHBYQO-UHFFFAOYSA-N	0	3	349.459	3.187	20	30		EGEDHN
COc1ccc(CCNc2ccc(/N=C/N(C)C)c(C#N)c2)cc1O	ZINC001163731839	1383115829	/nfs/dbraw/zinc/11/58/29/1383115829.db2.gz	DLRCAIRGMTUGID-LPYMAVHISA-N	0	3	338.411	3.148	20	30		EGEDHN
C=CCCC(=O)NCCC1(CNCc2cnc(Cl)s2)CC1	ZINC001163762694	1383119297	/nfs/dbraw/zinc/11/92/97/1383119297.db2.gz	KFXWLXWVSQGAGT-UHFFFAOYSA-N	0	3	327.881	3.139	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCC1(CNCc2cccc(Cl)c2F)CC1	ZINC001163854921	1383129678	/nfs/dbraw/zinc/12/96/78/1383129678.db2.gz	VFUIBVGELURPST-LBPRGKRZSA-N	0	3	337.826	3.015	20	30		EGEDHN
C[C@H]1CC[C@@H](CC(=O)NCCCNCc2ccc(C#N)cc2F)C1	ZINC001164187293	1383164459	/nfs/dbraw/zinc/16/44/59/1383164459.db2.gz	HIBYRZHEOPMAPJ-LSDHHAIUSA-N	0	3	331.435	3.120	20	30		EGEDHN
CC#CCCCC(=O)NCCCNCc1cc(OC)ccc1Cl	ZINC001164244896	1383170849	/nfs/dbraw/zinc/17/08/49/1383170849.db2.gz	RLUAADPRGYVDHV-UHFFFAOYSA-N	0	3	336.863	3.138	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCC1(CN[C@@H](C)c2cnccn2)CC1	ZINC001164648425	1383213802	/nfs/dbraw/zinc/21/38/02/1383213802.db2.gz	KUXNPSVFKCBIBE-INIZCTEOSA-N	0	3	342.487	3.182	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NCCC1(CNCc2ccccn2)CC1	ZINC001164693379	1383218633	/nfs/dbraw/zinc/21/86/33/1383218633.db2.gz	TXUDZMQMLSFONR-UHFFFAOYSA-N	0	3	335.879	3.236	20	30		EGEDHN
C[C@H]1CCCC[C@H]1C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001165411637	1383290079	/nfs/dbraw/zinc/29/00/79/1383290079.db2.gz	VCNAPGNYHMWXDN-WMLDXEAASA-N	0	3	331.435	3.120	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2nc(C)sc2C)CC1	ZINC001165702511	1383327970	/nfs/dbraw/zinc/32/79/70/1383327970.db2.gz	AHFOXMKLBADEFQ-UHFFFAOYSA-N	0	3	327.881	3.002	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccnc(C3CC3)c2)CC1	ZINC001165985876	1383373895	/nfs/dbraw/zinc/37/38/95/1383373895.db2.gz	HAONMJQJFYMPMT-UHFFFAOYSA-N	0	3	333.863	3.201	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cccc3c2CCOC3)CC1	ZINC001166131156	1383393228	/nfs/dbraw/zinc/39/32/28/1383393228.db2.gz	LVXIQZLPKUKSIB-UHFFFAOYSA-N	0	3	348.874	3.002	20	30		EGEDHN
C[C@@H](C(=O)NCCCNCc1ccccc1C#N)c1ccsc1	ZINC001166497039	1383429571	/nfs/dbraw/zinc/42/95/71/1383429571.db2.gz	DZCOELDRWBEHEZ-CQSZACIVSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCC1(CNCc2oc(CC)nc2C)CC1	ZINC001166579794	1383441379	/nfs/dbraw/zinc/44/13/79/1383441379.db2.gz	SKMYVUXOKSOZFH-UHFFFAOYSA-N	0	3	333.476	3.134	20	30		EGEDHN
C[C@H]1C[C@@H]1CC(=O)NCCC1(CNCc2ccc(C#N)cc2F)CC1	ZINC001167013775	1383518668	/nfs/dbraw/zinc/51/86/68/1383518668.db2.gz	WXDACOLNBGGYRI-WMLDXEAASA-N	0	3	343.446	3.120	20	30		EGEDHN
C=CCC1(C(=O)NCCC2(CNCc3ccccn3)CC2)CCC1	ZINC001167035392	1383524634	/nfs/dbraw/zinc/52/46/34/1383524634.db2.gz	GCEVTIBIITUJRO-UHFFFAOYSA-N	0	3	327.472	3.204	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ncsc2C2CC2)CC1	ZINC001167207410	1383566956	/nfs/dbraw/zinc/56/69/56/1383566956.db2.gz	QHKCSVIAGAMNLY-UHFFFAOYSA-N	0	3	339.892	3.263	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)CCCC(F)(F)F)c1	ZINC001167252416	1383575927	/nfs/dbraw/zinc/57/59/27/1383575927.db2.gz	GDBBNPSDWUSJLX-UHFFFAOYSA-N	0	3	345.340	3.026	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cc(Cl)cn2CC)CC1	ZINC001168185600	1383837629	/nfs/dbraw/zinc/83/76/29/1383837629.db2.gz	IHPQCJPIHNCALV-UHFFFAOYSA-N	0	3	344.286	3.404	20	30		EGEDHN
C[C@H](CC(=O)NCCC1(CNCc2ccccc2C#N)CC1)C1CC1	ZINC001168354916	1383881031	/nfs/dbraw/zinc/88/10/31/1383881031.db2.gz	RJQQLPFYUVENPD-MRXNPFEDSA-N	0	3	339.483	3.371	20	30		EGEDHN
Cc1cc(N2CCN(C)C(C)(C)C2)n2c3ccccc3nc2c1C#N	ZINC001307155202	1383946659	/nfs/dbraw/zinc/94/66/59/1383946659.db2.gz	MKFOCOJQOXIHME-UHFFFAOYSA-N	0	3	333.439	3.198	20	30		EGEDHN
CC[C@@H]1CCN([C@H](C)C(=O)N(CCC#N)c2ccccc2OC)[C@@H]1C	ZINC001169494735	1384154161	/nfs/dbraw/zinc/15/41/61/1384154161.db2.gz	OKHBIIOWAACEBM-BRWVUGGUSA-N	0	3	343.471	3.451	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H](C)CCCCNCc2ncc(C)s2)CCC1	ZINC001171187289	1384463486	/nfs/dbraw/zinc/46/34/86/1384463486.db2.gz	RPIBRXBUSKQGQP-HNNXBMFYSA-N	0	3	347.528	3.410	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)NCCCNCc2cc(C#N)ccc2F)CC1	ZINC001171661827	1384594766	/nfs/dbraw/zinc/59/47/66/1384594766.db2.gz	WUWJWQOYZXGAJA-KOMQPUFPSA-N	0	3	331.435	3.120	20	30		EGEDHN
C[C@@H]1C[C@H](NC2(C#N)Cc3ccccc3C2)CN1Cc1ccccc1	ZINC001171742870	1384622690	/nfs/dbraw/zinc/62/26/90/1384622690.db2.gz	ZGPJWYSHJZQCCL-UTKZUKDTSA-N	0	3	331.463	3.300	20	30		EGEDHN
C=CCOC[C@@H]1c2c(ncn2C)CCN1C1CCC(OCCC)CC1	ZINC001173097593	1384914295	/nfs/dbraw/zinc/91/42/95/1384914295.db2.gz	CRFFRYGIJSPNFR-FAFZWHIHSA-N	0	3	347.503	3.260	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)CCC(C)C)CC1	ZINC001317215379	1384995311	/nfs/dbraw/zinc/99/53/11/1384995311.db2.gz	JZESEVKXWYLTLY-UHFFFAOYSA-N	0	3	331.298	3.348	20	30		EGEDHN
Cc1cnccc1Nc1ccc(C#N)cc1I	ZINC001174539434	1385117631	/nfs/dbraw/zinc/11/76/31/1385117631.db2.gz	DXVWNGWFWSTRHG-UHFFFAOYSA-N	0	3	335.148	3.032	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@H](C)CCCCNCc1ccn(CC)n1	ZINC001174833547	1385156746	/nfs/dbraw/zinc/15/67/46/1385156746.db2.gz	PNOKMSOJURYQLI-IAGOWNOFSA-N	0	3	334.508	3.270	20	30		EGEDHN
CCN(CCNC(=O)C1CCC(F)(F)CC1)Cc1cccc(C#N)c1	ZINC001317486744	1385184772	/nfs/dbraw/zinc/18/47/72/1385184772.db2.gz	HILCJCCYPZZOPJ-UHFFFAOYSA-N	0	3	349.425	3.322	20	30		EGEDHN
Cc1cc(C(=O)NCCCNCc2ccccc2C#N)sc1C	ZINC001175599831	1385345810	/nfs/dbraw/zinc/34/58/10/1385345810.db2.gz	KLVSOBFKBXCXMW-UHFFFAOYSA-N	0	3	327.453	3.146	20	30		EGEDHN
CCN1CCN(c2ccc(Nc3nc(C)c(C#N)cc3C#N)cc2)CC1	ZINC001175783179	1385404236	/nfs/dbraw/zinc/40/42/36/1385404236.db2.gz	GKWIYVIETDXNJP-UHFFFAOYSA-N	0	3	346.438	3.019	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@@H]1CCCC(C)(C)C1	ZINC001177156098	1385837007	/nfs/dbraw/zinc/83/70/07/1385837007.db2.gz	SRBYURQIOZNVDK-CYBMUJFWSA-N	0	3	331.298	3.207	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)c1cscc1C(F)(F)F	ZINC001177581428	1386000413	/nfs/dbraw/zinc/00/04/13/1386000413.db2.gz	KGVHONOTIPNKOP-UHFFFAOYSA-N	0	3	326.771	3.229	20	30		EGEDHN
Cc1nc2sccc2c(NC(=O)C(C#N)Cc2cccs2)n1	ZINC001177904766	1386079575	/nfs/dbraw/zinc/07/95/75/1386079575.db2.gz	SFIMQWGISIUSBM-JTQLQIEISA-N	0	3	328.422	3.382	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2c(C)nsc2C)CCCC1	ZINC001319389397	1386098570	/nfs/dbraw/zinc/09/85/70/1386098570.db2.gz	LOWYRYZNAVVKKP-UHFFFAOYSA-N	0	3	327.881	3.145	20	30		EGEDHN
C=CCCC(=O)NCCCCCCNCc1c(C)nn(C)c1Cl	ZINC001178017892	1386109495	/nfs/dbraw/zinc/10/94/95/1386109495.db2.gz	HRSSBBKOQCGKGS-UHFFFAOYSA-N	0	3	340.899	3.114	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccc(Cl)cc2)CCN1C(=O)CCC1CC1	ZINC001178391915	1386205375	/nfs/dbraw/zinc/20/53/75/1386205375.db2.gz	SLHFKIWSWRAZIR-KXBFYZLASA-N	0	3	344.886	3.461	20	30		EGEDHN
C/C=C(/C)C(=O)N1CC[C@H](NCC#Cc2cccc(Cl)c2)[C@@H]1C	ZINC001178442519	1386218987	/nfs/dbraw/zinc/21/89/87/1386218987.db2.gz	LDGBCVNCOMMQBD-PIUYJEMPSA-N	0	3	330.859	3.237	20	30		EGEDHN
C/C=C(\C)C(=O)N1CC[C@H](NCC#Cc2ccccc2Cl)[C@@H]1C	ZINC001178442382	1386219063	/nfs/dbraw/zinc/21/90/63/1386219063.db2.gz	JUKBBHFCKXWMID-ZGTQULCZSA-N	0	3	330.859	3.237	20	30		EGEDHN
CC1(C(=O)NCCCCCCNCc2cc(F)ccc2C#N)CC1	ZINC001178540389	1386244637	/nfs/dbraw/zinc/24/46/37/1386244637.db2.gz	WJFFSXZEIHFVDF-UHFFFAOYSA-N	0	3	331.435	3.264	20	30		EGEDHN
CC[C@@H](C)CC(=O)N1CC[C@H](NCc2cc(C#N)ccc2OC)[C@@H]1C	ZINC001178566541	1386250332	/nfs/dbraw/zinc/25/03/32/1386250332.db2.gz	GDZNMKNVPGJZMS-VKJFTORMSA-N	0	3	343.471	3.082	20	30		EGEDHN
CC[C@H](C)CC(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@@H]1C	ZINC001178567203	1386251022	/nfs/dbraw/zinc/25/10/22/1386251022.db2.gz	NBQQYKUBKVOEQC-BXWFABGCSA-N	0	3	330.447	3.192	20	30		EGEDHN
CC(C)c1cccc(CN[C@H]2CCN(C(=O)C#CC(C)(C)C)[C@H]2C)n1	ZINC001178671441	1386273635	/nfs/dbraw/zinc/27/36/35/1386273635.db2.gz	AGUMNNDUVJMJSU-LPHOPBHVSA-N	0	3	341.499	3.334	20	30		EGEDHN
COc1cc(C#N)ccc1CN1CCC[C@H]1CNc1cccc(C)n1	ZINC001319756807	1386282507	/nfs/dbraw/zinc/28/25/07/1386282507.db2.gz	PNRQVSZJJKJLCG-SFHVURJKSA-N	0	3	336.439	3.347	20	30		EGEDHN
C[C@H]1[C@@H](NCc2ccc(C#N)s2)CCN1C(=O)CCC(C)(F)F	ZINC001179025622	1386380574	/nfs/dbraw/zinc/38/05/74/1386380574.db2.gz	UQFLDZOJDAKYHB-FZMZJTMJSA-N	0	3	341.427	3.134	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)C1CC2(CC2)C1)NCc1cc(C#N)ccc1F	ZINC001319944409	1386407374	/nfs/dbraw/zinc/40/73/74/1386407374.db2.gz	PQWUZVPZAROIHV-GOSISDBHSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cc(Br)co1)C(C)C	ZINC001319948641	1386411858	/nfs/dbraw/zinc/41/18/58/1386411858.db2.gz	ZDJBWUBJBVPLTE-LLVKDONJSA-N	0	3	349.656	3.139	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1csc(CC(C)C)n1)C(C)C	ZINC001319967016	1386423583	/nfs/dbraw/zinc/42/35/83/1386423583.db2.gz	BSNRDTNXEWJHFH-CYBMUJFWSA-N	0	3	343.924	3.438	20	30		EGEDHN
C#CCCCCCC(=O)NCCCCCCNCc1cc(C)no1	ZINC001179235255	1386428292	/nfs/dbraw/zinc/42/82/92/1386428292.db2.gz	LVSGGXAFBNYEHT-UHFFFAOYSA-N	0	3	333.476	3.333	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CC[C@H](NCC#Cc2ccc(Cl)cc2)[C@@H]1C	ZINC001179314651	1386448600	/nfs/dbraw/zinc/44/86/00/1386448600.db2.gz	YSIJEZKDCXYRJC-XKQJLSEDSA-N	0	3	336.838	3.019	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCCCCCCN[C@@H](C)c1nnc(CC)[nH]1	ZINC001179339506	1386455800	/nfs/dbraw/zinc/45/58/00/1386455800.db2.gz	FYXNRUKUVILKIX-JKSUJKDBSA-N	0	3	349.523	3.297	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCC#Cc3ccccc3)[C@@H]2C)CC1	ZINC001179476167	1386493558	/nfs/dbraw/zinc/49/35/58/1386493558.db2.gz	NYOQYLKLZWTFQL-RXVVDRJESA-N	0	3	336.479	3.364	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCCCCCN[C@@H](C)c1nnc(CC)[nH]1	ZINC001179482601	1386494881	/nfs/dbraw/zinc/49/48/81/1386494881.db2.gz	XOKGGFJLVHKIEI-HNAYVOBHSA-N	0	3	349.523	3.297	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C)c1ccco1	ZINC001179530329	1386508119	/nfs/dbraw/zinc/50/81/19/1386508119.db2.gz	VTZWAFFWLBDQLG-LNLFQRSKSA-N	0	3	336.435	3.014	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1ccc(C)cc1OC)C1CC1	ZINC001698654355	1406304177	/nfs/dbraw/zinc/30/41/77/1406304177.db2.gz	SWJKXPDALYNWMR-GOSISDBHSA-N	0	3	336.863	3.244	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)Cc1c[nH]c2ccccc12)C1CC1	ZINC001698653690	1406303418	/nfs/dbraw/zinc/30/34/18/1406303418.db2.gz	QEPGIQUGCCUXNP-IBGZPJMESA-N	0	3	345.874	3.337	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)Cc2cncs2)CCCC[C@@H]1C	ZINC001698662492	1406313432	/nfs/dbraw/zinc/31/34/32/1406313432.db2.gz	RWYMKFOSOGTLHG-BLLLJJGKSA-N	0	3	341.908	3.093	20	30		EGEDHN
Cc1c[nH]cc1C(=O)NCCCCCCNCc1ccccc1C#N	ZINC001180259499	1386748591	/nfs/dbraw/zinc/74/85/91/1386748591.db2.gz	ITENWHCQVFOHOI-UHFFFAOYSA-N	0	3	338.455	3.275	20	30		EGEDHN
CC(C)=CC(=O)N1C[C@@H](C)[C@](C)(CNCc2ccccc2C#N)C1	ZINC001180482940	1386811518	/nfs/dbraw/zinc/81/15/18/1386811518.db2.gz	XSSPTJSOILSJCN-OXQOHEQNSA-N	0	3	325.456	3.099	20	30		EGEDHN
Cc1ccc(F)c(C(=O)N[C@H](C)CNCc2ccc(F)c(C#N)c2)c1	ZINC001321662752	1386952618	/nfs/dbraw/zinc/95/26/18/1386952618.db2.gz	YZDPLCMUPDRPBL-CYBMUJFWSA-N	0	3	343.377	3.053	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2csc(C)n2)C1	ZINC001181200334	1386957427	/nfs/dbraw/zinc/95/74/27/1386957427.db2.gz	SDIWMSCYJAPMRK-DNVCBOLYSA-N	0	3	347.528	3.219	20	30		EGEDHN
CC(C)[C@@H](C)CC(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001181527313	1387011080	/nfs/dbraw/zinc/01/10/80/1387011080.db2.gz	XJUCNRFPRHDSMX-WMLDXEAASA-N	0	3	331.435	3.070	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCC(F)F)C[C@@]1(C)CNCc1ccccc1C#N	ZINC001182131610	1387109718	/nfs/dbraw/zinc/10/97/18/1387109718.db2.gz	BNDMOZPZNZUTHS-AUUYWEPGSA-N	0	3	349.425	3.178	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2ccccc2C#N)C1	ZINC001182437674	1387166336	/nfs/dbraw/zinc/16/63/36/1387166336.db2.gz	LUXOWGZBTUXGKX-DYESRHJHSA-N	0	3	339.483	3.489	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CC[C@@H](N[C@H]2CCc3c2cc(F)cc3F)C1	ZINC001182450145	1387168406	/nfs/dbraw/zinc/16/84/06/1387168406.db2.gz	NOGLGIKCHUBOKW-KDOFPFPSSA-N	0	3	346.421	3.192	20	30		EGEDHN
CS[C@@H](C)CC(=O)N(C)CC(C)(C)CNCc1ccccc1C#N	ZINC001329280376	1389048603	/nfs/dbraw/zinc/04/86/03/1389048603.db2.gz	YUDCALZIOQHMCW-HNNXBMFYSA-N	0	3	347.528	3.274	20	30		EGEDHN
CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1ccc(C#N)cc1F	ZINC001336308828	1389064412	/nfs/dbraw/zinc/06/44/12/1389064412.db2.gz	SBASNDYMVFXZCW-UHFFFAOYSA-N	0	3	343.377	3.040	20	30		EGEDHN
N#Cc1ccc(C(=O)N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)c(F)c1	ZINC001336534021	1389117839	/nfs/dbraw/zinc/11/78/39/1389117839.db2.gz	KIUQJVZOULNOQG-FXAWDEMLSA-N	0	3	349.409	3.044	20	30		EGEDHN
CN(C)CCN(CCCc1ccccc1)C(=O)c1csc(C#N)c1	ZINC001330503740	1389436280	/nfs/dbraw/zinc/43/62/80/1389436280.db2.gz	GPLJUXZTJZEZAZ-UHFFFAOYSA-N	0	3	341.480	3.256	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN(CC)C(C)(C)C)cc1	ZINC001330600157	1389466410	/nfs/dbraw/zinc/46/64/10/1389466410.db2.gz	AQNFWHMQNOSYEF-UHFFFAOYSA-N	0	3	331.460	3.452	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N(C)C[C@@H](C)NCc1ccc(F)c(C#N)c1	ZINC001331458572	1389756635	/nfs/dbraw/zinc/75/66/35/1389756635.db2.gz	KZVVNMILOGUWQW-CQSZACIVSA-N	0	3	333.451	3.316	20	30		EGEDHN
N#CC1(c2ccccc2)CC(NC[C@H](O)c2cc(F)c(F)c(F)c2)C1	ZINC001333343032	1390286637	/nfs/dbraw/zinc/28/66/37/1390286637.db2.gz	LUHPGEIDNSBNQS-KGYZHSKHSA-N	0	3	346.352	3.351	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1cccc(Br)c1COC	ZINC001341492265	1390493615	/nfs/dbraw/zinc/49/36/15/1390493615.db2.gz	CMPHHTDSYUPCDZ-ZDUSSCGKSA-N	0	3	341.249	3.218	20	30		EGEDHN
Cn1ccnc1C(C#N)C(=O)CCCOc1ccc2c(c1)CCCC2	ZINC001342267815	1390593440	/nfs/dbraw/zinc/59/34/40/1390593440.db2.gz	GQIZWVNQTCXYQK-GOSISDBHSA-N	0	3	337.423	3.334	20	30		EGEDHN
CC1CCN(c2ccc(F)cc2NC(=O)[C@@H](N)CCCCC#N)CC1	ZINC001342807923	1390656746	/nfs/dbraw/zinc/65/67/46/1390656746.db2.gz	CXSOKHLDJUFQIO-INIZCTEOSA-N	0	3	346.450	3.412	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1ccc(OC)c(-c2ccccc2)c1	ZINC001344016911	1390750482	/nfs/dbraw/zinc/75/04/82/1390750482.db2.gz	OMVKQUSBCGFEEN-UHFFFAOYSA-N	0	3	336.435	3.047	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)C#Cc1cccs1	ZINC001344099699	1390755431	/nfs/dbraw/zinc/75/54/31/1390755431.db2.gz	RVLMZVSAZXZBMQ-KRWDZBQOSA-N	0	3	338.476	3.223	20	30		EGEDHN
N#CC(C(=O)CCc1nc(C2CCCC2)no1)c1cccc(F)n1	ZINC001347123700	1391004023	/nfs/dbraw/zinc/00/40/23/1391004023.db2.gz	MZTMMTACMDZNEQ-LBPRGKRZSA-N	0	3	328.347	3.070	20	30		EGEDHN
N#CC(C(=O)c1c[nH]c(Br)c1)c1cnc2ccccc2n1	ZINC001348139313	1391178386	/nfs/dbraw/zinc/17/83/86/1391178386.db2.gz	LGCFRHHFAXRVIS-SNVBAGLBSA-N	0	3	341.168	3.210	20	30		EGEDHN
CC[NH+](CC)Cc1cc(C(C)N=Nc2ccc(C#N)cn2)ccc1[O-]	ZINC001349839537	1391374456	/nfs/dbraw/zinc/37/44/56/1391374456.db2.gz	MKBBIRFOTKGGOO-UHFFFAOYSA-N	0	3	337.427	3.337	20	30		EGEDHN
C[C@H](CNCC#Cc1cccc(Cl)c1)N(C)C(=O)[C@H]1CC1(C)C	ZINC001698822578	1406514084	/nfs/dbraw/zinc/51/40/84/1406514084.db2.gz	NYNAFPNBJDCQBE-RHSMWYFYSA-N	0	3	332.875	3.174	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N1CC[C@H]2CCCC[C@H]2C1	ZINC001351542930	1391650165	/nfs/dbraw/zinc/65/01/65/1391650165.db2.gz	ABGFQWQBQJOVDK-SQNIBIBYSA-N	0	3	343.519	3.290	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)N(C)C(=O)c1ccc(F)c(F)c1	ZINC001698827993	1406521609	/nfs/dbraw/zinc/52/16/09/1406521609.db2.gz	JQKNZYDQLSLJDE-NSHDSACASA-N	0	3	349.406	3.148	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1ccccc1S[C@H](C)CC#N	ZINC001354579320	1392154027	/nfs/dbraw/zinc/15/40/27/1392154027.db2.gz	JPRBWOPBTRDAKQ-OAHLLOKOSA-N	0	3	344.484	3.157	20	30		EGEDHN
C=C(Br)CN[C@@H](C)[C@@H]1CCCCN1C(=O)C1=CCCC1	ZINC001479819432	1392410575	/nfs/dbraw/zinc/41/05/75/1392410575.db2.gz	BKAMSELSKIVITF-ZFWWWQNUSA-N	0	3	341.293	3.365	20	30		EGEDHN
CN(C(=O)CCC(C)(F)F)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001479890082	1392461054	/nfs/dbraw/zinc/46/10/54/1392461054.db2.gz	YNVBKUIQOGZUJB-UHFFFAOYSA-N	0	3	349.425	3.416	20	30		EGEDHN
N#Cc1ccc(CN[C@H](CNC(=O)CC2CCCC2)C2CC2)s1	ZINC001479999703	1392529625	/nfs/dbraw/zinc/52/96/25/1392529625.db2.gz	LYEZDZPBVSSKOB-QGZVFWFLSA-N	0	3	331.485	3.184	20	30		EGEDHN
CCC1(C(=O)NC[C@H](NCc2ccc(C#N)cc2F)C2CC2)CCC1	ZINC001480041036	1392546538	/nfs/dbraw/zinc/54/65/38/1392546538.db2.gz	MONODJKGAUKTKG-SFHVURJKSA-N	0	3	343.446	3.262	20	30		EGEDHN
CCCCC(=O)NC[C@@H]1CCCN(Cc2ccc(OCC#N)cc2)C1	ZINC001480242481	1392632185	/nfs/dbraw/zinc/63/21/85/1392632185.db2.gz	CSGDHPLQQDYEAH-SFHVURJKSA-N	0	3	343.471	3.107	20	30		EGEDHN
CC(F)(F)CCC(=O)N1CCCC[C@H]1CNCC#Cc1ccccc1	ZINC001480351267	1392700077	/nfs/dbraw/zinc/70/00/77/1392700077.db2.gz	HQJSVAPOBHPDLG-SFHVURJKSA-N	0	3	348.437	3.444	20	30		EGEDHN
CCN(CCNC(=O)[C@@H](C)C#N)[C@@H](C)c1ccc(F)c(Cl)c1	ZINC001480968388	1393054651	/nfs/dbraw/zinc/05/46/51/1393054651.db2.gz	WIKMLKBSTBJJRI-RYUDHWBXSA-N	0	3	325.815	3.138	20	30		EGEDHN
CC(C)CC(=O)NCC[C@@H]1CCN(Cc2ccc(F)c(C#N)c2)C1	ZINC001481415683	1394275465	/nfs/dbraw/zinc/27/54/65/1394275465.db2.gz	YAWKAUAGNUMYKZ-OAHLLOKOSA-N	0	3	331.435	3.072	20	30		EGEDHN
CCCCC(=O)N1CC[C@@H](CN(C)Cc2cc(C#N)ccc2OC)C1	ZINC001481476856	1394323550	/nfs/dbraw/zinc/32/35/50/1394323550.db2.gz	GZRYEVRGNYWRCH-KRWDZBQOSA-N	0	3	343.471	3.037	20	30		EGEDHN
C=CCCCCCN1CCC[C@H](NC(=O)c2cc(Cl)n(C)n2)C1	ZINC001481535878	1394394948	/nfs/dbraw/zinc/39/49/48/1394394948.db2.gz	FYJKFRBAEWJGRD-AWEZNQCLSA-N	0	3	338.883	3.014	20	30		EGEDHN
Cc1occc1C(=O)NC[C@@H](NCc1cc(C#N)ccc1F)C(C)C	ZINC001482515384	1395066461	/nfs/dbraw/zinc/06/64/61/1395066461.db2.gz	ROZZXFICKYHYQN-GOSISDBHSA-N	0	3	343.402	3.143	20	30		EGEDHN
CC(C)(C)C(=O)N1CCC[C@@H]1CNCC#Cc1cccc(Cl)c1	ZINC001483952283	1395159201	/nfs/dbraw/zinc/15/92/01/1395159201.db2.gz	SSNYZCVYHLOHLW-QGZVFWFLSA-N	0	3	332.875	3.318	20	30		EGEDHN
CCC(=O)NCc1ccc([C@@H](C)NCc2ccc(C#N)s2)cc1	ZINC001484557641	1395439413	/nfs/dbraw/zinc/43/94/13/1395439413.db2.gz	VNIPLASCNWAMCV-CYBMUJFWSA-N	0	3	327.453	3.497	20	30		EGEDHN
C=C(Br)CN[C@@H](C)CCNC(=O)c1cc(C)ccc1F	ZINC001503489762	1396256649	/nfs/dbraw/zinc/25/66/49/1396256649.db2.gz	NNZRYMCLAQPBTN-LBPRGKRZSA-N	0	3	343.240	3.141	20	30		EGEDHN
C#CCCCCC(=O)N1CCCC[C@H]1CNCc1ccccc1F	ZINC001505403916	1396290475	/nfs/dbraw/zinc/29/04/75/1396290475.db2.gz	WJESCLRSNMZGQE-SFHVURJKSA-N	0	3	330.447	3.490	20	30		EGEDHN
C[C@@H](CCNC(=O)[C@@H]1CCCC(F)(F)C1)NCc1ccccc1C#N	ZINC001492082974	1396303116	/nfs/dbraw/zinc/30/31/16/1396303116.db2.gz	HNRFYBGMCXFYCU-LSDHHAIUSA-N	0	3	349.425	3.368	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)Cn1cc(C)c2ccccc21	ZINC001492096975	1396304049	/nfs/dbraw/zinc/30/40/49/1396304049.db2.gz	WRLDNVTXVIADHF-OAHLLOKOSA-N	0	3	333.863	3.187	20	30		EGEDHN
CC(C)c1ccccc1CN(C)C[C@H](C)NC(=O)c1cc(C#N)c[nH]1	ZINC001498254355	1396947680	/nfs/dbraw/zinc/94/76/80/1396947680.db2.gz	KWJRKDQSTDKVLU-HNNXBMFYSA-N	0	3	338.455	3.260	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1csnc1C	ZINC001689899865	1404194212	/nfs/dbraw/zinc/19/42/12/1404194212.db2.gz	VIFRJFDOAXPMLQ-GXTWGEPZSA-N	0	3	327.881	3.177	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)CCc1cccnc1	ZINC001689904831	1404197815	/nfs/dbraw/zinc/19/78/15/1404197815.db2.gz	DCROOWHEMVLGSC-WBVHZDCISA-N	0	3	335.879	3.126	20	30		EGEDHN
Cc1cccc(CC(=O)NC[C@H](C)N(C)Cc2ccc(C#N)cc2)c1	ZINC001725180292	1425704175	/nfs/dbraw/zinc/70/41/75/1425704175.db2.gz	VFOOEYQMHSKXKR-KRWDZBQOSA-N	0	3	335.451	3.046	20	30		EGEDHN
C=C(Br)CN[C@@H](C)CCNC(=O)c1ccc(CC)s1	ZINC001690852046	1404777890	/nfs/dbraw/zinc/77/78/90/1404777890.db2.gz	QUEILCVRVAKPDC-NSHDSACASA-N	0	3	345.306	3.317	20	30		EGEDHN
CCCC(C)(C)C(=O)NC[C@@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC001691156679	1405090869	/nfs/dbraw/zinc/09/08/69/1405090869.db2.gz	DKXWDJDFQZDXRK-SFHVURJKSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)Cc2nsc3ccccc32)C1	ZINC001691757693	1405474849	/nfs/dbraw/zinc/47/48/49/1405474849.db2.gz	KUUGGQFBEAELOR-BETUJISGSA-N	0	3	349.887	3.076	20	30		EGEDHN
CCc1ccc(C(=O)NC[C@H](C)CNCc2ccccc2C#N)s1	ZINC001732348848	1428544036	/nfs/dbraw/zinc/54/40/36/1428544036.db2.gz	MICYOGMGCYRFLR-CQSZACIVSA-N	0	3	341.480	3.338	20	30		EGEDHN
C=Cc1ccc(C(=O)N[C@@H](C)CNCc2ccc(C#N)s2)cc1	ZINC001699419835	1412733571	/nfs/dbraw/zinc/73/35/71/1412733571.db2.gz	NGYAYFXDOZMFJX-ZDUSSCGKSA-N	0	3	325.437	3.171	20	30		EGEDHN
C=C(Cl)CN(CC1CC1)C1CCN(C(=O)c2cc(F)c[nH]2)CC1	ZINC001699688702	1413089960	/nfs/dbraw/zinc/08/99/60/1413089960.db2.gz	QMVXVTHOHYEHFI-UHFFFAOYSA-N	0	3	339.842	3.223	20	30		EGEDHN
C[C@@H](CCNC(=O)c1cccc2[nH]ccc21)NCc1ccccc1C#N	ZINC001700327122	1413797268	/nfs/dbraw/zinc/79/72/68/1413797268.db2.gz	QHZLEGMYRZYVLI-HNNXBMFYSA-N	0	3	346.434	3.338	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cc2c(cccc2OC)[nH]1)C(C)C	ZINC001732570967	1428766074	/nfs/dbraw/zinc/76/60/74/1428766074.db2.gz	UPLMSWKZCPKZFH-INIZCTEOSA-N	0	3	349.862	3.273	20	30		EGEDHN
Cc1coc(C)c1C(=O)NC[C@H](C)N(C)Cc1ccc(C#N)cc1	ZINC001700458289	1414052094	/nfs/dbraw/zinc/05/20/94/1414052094.db2.gz	XOOGWOZRSPKCCS-AWEZNQCLSA-N	0	3	325.412	3.018	20	30		EGEDHN
Cc1c(F)cccc1C(=O)N(C)C[C@@H](C)NCc1ccc(C#N)s1	ZINC001700751750	1414422193	/nfs/dbraw/zinc/42/21/93/1414422193.db2.gz	JKBHGAORBIJTJR-GFCCVEGCSA-N	0	3	345.443	3.318	20	30		EGEDHN
C[C@H](CN(C)C(=O)CCC1(C)CC1)NCc1ccc(F)c(C#N)c1	ZINC001700774469	1414453400	/nfs/dbraw/zinc/45/34/00/1414453400.db2.gz	WVUNQEACGMZVIF-CQSZACIVSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=C(Br)CNC1CC(N(C)C(=O)C(C)(C)C(C)C)C1	ZINC001701027551	1414689685	/nfs/dbraw/zinc/68/96/85/1414689685.db2.gz	KWIOASBLLDRNKP-UHFFFAOYSA-N	0	3	331.298	3.156	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCC[C@@H]1NC(=O)CCC1CC1	ZINC001732615079	1428878604	/nfs/dbraw/zinc/87/86/04/1428878604.db2.gz	IRMKQYUBJWVGSN-MOPGFXCFSA-N	0	3	325.456	3.123	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)Cc2ccc3c(c2)CCCC3)C1	ZINC001707088668	1417195132	/nfs/dbraw/zinc/19/51/32/1417195132.db2.gz	AHUUSTVLZXQTSY-RUCARUNLSA-N	0	3	346.902	3.345	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)C2(c3ccccc3C)CC2)C1	ZINC001707094108	1417198928	/nfs/dbraw/zinc/19/89/28/1417198928.db2.gz	RCODZGRWQMIUTJ-WKILWMFISA-N	0	3	332.875	3.264	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)CCc1cncs1	ZINC001707446291	1417350320	/nfs/dbraw/zinc/35/03/20/1417350320.db2.gz	VGEDYYPQLZSBEU-ZFWWWQNUSA-N	0	3	341.908	3.187	20	30		EGEDHN
N#Cc1ccc(CN[C@H](CNC(=O)CCC2CCC2)C2CC2)c(F)c1	ZINC001713106801	1417667188	/nfs/dbraw/zinc/66/71/88/1417667188.db2.gz	HMELLRWFTWTSBR-LJQANCHMSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)c1ccc(CF)cc1	ZINC001713423613	1418049934	/nfs/dbraw/zinc/04/99/34/1418049934.db2.gz	XTTFVBCJVOFGNI-GFCCVEGCSA-N	0	3	343.240	3.163	20	30		EGEDHN
CCN(CCNC(=O)[C@H]1CC12CCCC2)Cc1ccc(C#N)cc1	ZINC001713496153	1418205233	/nfs/dbraw/zinc/20/52/33/1418205233.db2.gz	KUJAINJNNMNSRC-GOSISDBHSA-N	0	3	325.456	3.077	20	30		EGEDHN
Cc1occc1C(=O)NCC[C@H]1CCN(Cc2ccccc2C#N)C1	ZINC001713724586	1418502652	/nfs/dbraw/zinc/50/26/52/1418502652.db2.gz	RZLYOZHETYYHHZ-INIZCTEOSA-N	0	3	337.423	3.102	20	30		EGEDHN
CCC(CC)CC(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001713962706	1418742658	/nfs/dbraw/zinc/74/26/58/1418742658.db2.gz	OYBXQNSEJWKUPE-QAQDUYKDSA-N	0	3	331.435	3.260	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2cc3ccccc3nn2)CCCC1	ZINC001714139201	1418941944	/nfs/dbraw/zinc/94/19/44/1418941944.db2.gz	KEOXUIMNGDCHDI-UHFFFAOYSA-N	0	3	344.846	3.015	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1cccc2ccncc21)C1CC1	ZINC001714174933	1418982708	/nfs/dbraw/zinc/98/27/08/1418982708.db2.gz	TUGINRWGTCCLCW-IBGZPJMESA-N	0	3	343.858	3.475	20	30		EGEDHN
Cc1c(F)cccc1C(=O)NC[C@H](C)NCc1ccc(F)c(C#N)c1	ZINC001714234619	1419025052	/nfs/dbraw/zinc/02/50/52/1419025052.db2.gz	LGZJUXAFSJJBFF-LBPRGKRZSA-N	0	3	343.377	3.053	20	30		EGEDHN
Cc1ccc(C(=O)NCC[C@@H](C)NCc2ccccc2C#N)cc1F	ZINC001714478834	1419201615	/nfs/dbraw/zinc/20/16/15/1419201615.db2.gz	XTRUIVIMIAPSTM-OAHLLOKOSA-N	0	3	339.414	3.304	20	30		EGEDHN
COc1ccc(C#N)cc1CNC1(CNC(=O)CC(C)C)CCCC1	ZINC001714484937	1419208510	/nfs/dbraw/zinc/20/85/10/1419208510.db2.gz	QSBDLMPCMKHKCG-UHFFFAOYSA-N	0	3	343.471	3.132	20	30		EGEDHN
CCN(CCNC(=O)[C@H](C)C1CCCC1)Cc1ccc(C#N)cc1	ZINC001714595885	1419348004	/nfs/dbraw/zinc/34/80/04/1419348004.db2.gz	CDZVNGJZTKIZPV-MRXNPFEDSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)Cc2ccsc2C)CCCC1	ZINC001715100256	1419840930	/nfs/dbraw/zinc/84/09/30/1419840930.db2.gz	GJFHVLNQAWHMFD-UHFFFAOYSA-N	0	3	326.893	3.370	20	30		EGEDHN
Cc1cocc1C(=O)NC[C@H](NCc1ccc(C#N)cc1F)C(C)C	ZINC001715738366	1420319258	/nfs/dbraw/zinc/31/92/58/1420319258.db2.gz	XDHBGWWWHMUUIG-SFHVURJKSA-N	0	3	343.402	3.143	20	30		EGEDHN
Cc1cc(C)cc(C(=O)N[C@H](C)CNCc2ccc(F)c(C#N)c2)c1	ZINC001715958310	1420424649	/nfs/dbraw/zinc/42/46/49/1420424649.db2.gz	QHPQYGPLUAEOFW-OAHLLOKOSA-N	0	3	339.414	3.222	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)CCC1CCCC1	ZINC001716013463	1420466758	/nfs/dbraw/zinc/46/67/58/1420466758.db2.gz	HMCCUHFUEVLASS-MRXNPFEDSA-N	0	3	327.472	3.465	20	30		EGEDHN
C[C@@H](CN(C)Cc1cccc(C#N)c1)NC(=O)CC(C)(C)C1CC1	ZINC001716020084	1420474648	/nfs/dbraw/zinc/47/46/48/1420474648.db2.gz	BRKZQUNHZJYQGT-HNNXBMFYSA-N	0	3	327.472	3.321	20	30		EGEDHN
CCCC[C@](C)(F)C(=O)NCC1(NCc2ccc(F)c(C#N)c2)CC1	ZINC001716685783	1420838992	/nfs/dbraw/zinc/83/89/92/1420838992.db2.gz	MUWNOMULTZCIIC-SFHVURJKSA-N	0	3	349.425	3.354	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)NCC2(NCc3ccc(C#N)cc3)CC2)CC1	ZINC001716698498	1420851401	/nfs/dbraw/zinc/85/14/01/1420851401.db2.gz	HDZYCCDEHSHXQE-RZDIXWSQSA-N	0	3	325.456	3.123	20	30		EGEDHN
C[C@]1(CNC(=O)CC2CCC2)CCCN(Cc2cccc(C#N)c2)C1	ZINC001716892652	1421018844	/nfs/dbraw/zinc/01/88/44/1421018844.db2.gz	GBQUBOSYIIVXDF-OAQYLSRUSA-N	0	3	339.483	3.467	20	30		EGEDHN
CC[C@H](C)CC(=O)NCC1(NCc2ccc(F)c(C#N)c2)CCC1	ZINC001717151284	1421141825	/nfs/dbraw/zinc/14/18/25/1421141825.db2.gz	ZJFPFQHZILLZAF-AWEZNQCLSA-N	0	3	331.435	3.262	20	30		EGEDHN
CCCC1(C(=O)NCC2(NCc3ccc(F)c(C#N)c3)CCC2)CC1	ZINC001717157912	1421147267	/nfs/dbraw/zinc/14/72/67/1421147267.db2.gz	FAWZPDRPMFTFGV-UHFFFAOYSA-N	0	3	343.446	3.406	20	30		EGEDHN
CCC1(C(=O)NCC2(NCc3ccc(F)c(C#N)c3)CCC2)CC1	ZINC001717158233	1421147834	/nfs/dbraw/zinc/14/78/34/1421147834.db2.gz	OSGJFNCIKSRLRH-UHFFFAOYSA-N	0	3	329.419	3.016	20	30		EGEDHN
CCC[C@H](C)C(=O)N(C)CCCN(C)Cc1ccc(F)c(C#N)c1	ZINC001717205873	1421176628	/nfs/dbraw/zinc/17/66/28/1421176628.db2.gz	XEFBTGNHEDVWCW-HNNXBMFYSA-N	0	3	333.451	3.414	20	30		EGEDHN
CCCCC(=O)N1CC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001733294052	1429475150	/nfs/dbraw/zinc/47/51/50/1429475150.db2.gz	MXLRCWOMJNZULI-HXUWFJFHSA-N	0	3	325.456	3.173	20	30		EGEDHN
C[C@H](CNC(=O)c1ccc2[nH]ccc2c1)N(C)Cc1cccc(C#N)c1	ZINC001717486028	1421422835	/nfs/dbraw/zinc/42/28/35/1421422835.db2.gz	YDFPSLRZUCZXIN-OAHLLOKOSA-N	0	3	346.434	3.290	20	30		EGEDHN
CN(CCCN(C)C(=O)CC(C)(F)F)Cc1ccc(F)c(C#N)c1	ZINC001724855995	1425227828	/nfs/dbraw/zinc/22/78/28/1425227828.db2.gz	PXYFCCSLDHWFFO-UHFFFAOYSA-N	0	3	341.377	3.023	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1ccc(C(F)F)nc1	ZINC001725142554	1425622244	/nfs/dbraw/zinc/62/22/44/1425622244.db2.gz	LLXUMESEUAWBPP-UHFFFAOYSA-N	0	3	345.821	3.460	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)Cc1ccc(OC)cc1	ZINC001725146774	1425629189	/nfs/dbraw/zinc/62/91/89/1425629189.db2.gz	OGMQYESYCBNOEQ-UHFFFAOYSA-N	0	3	338.879	3.064	20	30		EGEDHN
N#Cc1ccc(CN2CCCCC[C@@H]2CNC(=O)CC2CC2)cc1	ZINC001725242880	1425853158	/nfs/dbraw/zinc/85/31/58/1425853158.db2.gz	MVAOMEQHIUUCRQ-LJQANCHMSA-N	0	3	325.456	3.219	20	30		EGEDHN
CCC1(C(=O)N(C)[C@@H](CNCc2ccc(C#N)cc2F)C2CC2)CC1	ZINC001725463220	1426129420	/nfs/dbraw/zinc/12/94/20/1426129420.db2.gz	DOOGARXDGFUURM-SFHVURJKSA-N	0	3	343.446	3.214	20	30		EGEDHN
CC(C)(C(=O)N[C@@H]1CC[C@H](CNCc2ccccc2C#N)C1)C(F)F	ZINC001725660314	1426342683	/nfs/dbraw/zinc/34/26/83/1426342683.db2.gz	KSSOEOCFYFASJL-XJKSGUPXSA-N	0	3	349.425	3.224	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1cc2c[nH]ccc-2n1	ZINC001731292456	1427234824	/nfs/dbraw/zinc/23/48/24/1427234824.db2.gz	FETYVMSYZXVVOH-DYVFJYSZSA-N	0	3	346.862	3.288	20	30		EGEDHN
Cc1csc(C(=O)NCC[C@@H](C)NCc2cc(C#N)ccc2F)c1	ZINC001731724694	1427797282	/nfs/dbraw/zinc/79/72/82/1427797282.db2.gz	DKJOPLLSPRDAKW-CYBMUJFWSA-N	0	3	345.443	3.366	20	30		EGEDHN
CC(C)(C)CC(=O)NC[C@@H]1CCCN1Cc1ccc(OCC#N)cc1	ZINC001731822766	1428025545	/nfs/dbraw/zinc/02/55/45/1428025545.db2.gz	MKSKMUBCOPFEKN-KRWDZBQOSA-N	0	3	343.471	3.106	20	30		EGEDHN
CC1(CCC(=O)NC[C@H]2CCN(Cc3ccc(C#N)cc3)C2)CC1	ZINC001731859343	1428096870	/nfs/dbraw/zinc/09/68/70/1428096870.db2.gz	XKCKAZKYVDTWCJ-GOSISDBHSA-N	0	3	325.456	3.077	20	30		EGEDHN
C=C(Br)CN[C@@H](C)CCNC(=O)c1ccc(C)cc1	ZINC001733906477	1437724220	/nfs/dbraw/zinc/72/42/20/1437724220.db2.gz	ZWKYHRKRRBMCSP-ZDUSSCGKSA-N	0	3	325.250	3.002	20	30		EGEDHN
C[C@H](CNC(=O)c1ccc(F)c(F)c1)N(C)Cc1ccc(C#N)cc1	ZINC001734040684	1437828925	/nfs/dbraw/zinc/82/89/25/1437828925.db2.gz	LWORDDKOFJXVHC-CYBMUJFWSA-N	0	3	343.377	3.087	20	30		EGEDHN
Cc1cc(C(=O)NC[C@H](C)N(C)Cc2cccc(C#N)c2)c(C)s1	ZINC001734041743	1437829687	/nfs/dbraw/zinc/82/96/87/1437829687.db2.gz	DVQKEKCLYTYAEQ-ZDUSSCGKSA-N	0	3	341.480	3.487	20	30		EGEDHN
CN(C(=O)CCC1CC1)[C@@H](CNCc1cc(C#N)ccc1F)C1CC1	ZINC001734293506	1438024731	/nfs/dbraw/zinc/02/47/31/1438024731.db2.gz	DTQQVUDKWLGBDO-IBGZPJMESA-N	0	3	343.446	3.214	20	30		EGEDHN
CCC(CC)C(=O)N(C)C1CC(NCc2cc(C#N)ccc2F)C1	ZINC001734590921	1438179037	/nfs/dbraw/zinc/17/90/37/1438179037.db2.gz	NNBFODWIEWBBIW-UHFFFAOYSA-N	0	3	331.435	3.213	20	30		EGEDHN
C#CCN(CCCNC(=O)C(C)(C)c1ccc(CC)cc1)C1CC1	ZINC001752287376	1440165546	/nfs/dbraw/zinc/16/55/46/1440165546.db2.gz	OIZPVEUBWPXQSE-UHFFFAOYSA-N	0	3	326.484	3.131	20	30		EGEDHN
C#CCCCCCC(=O)N(C)C1CCN(CCc2ccns2)CC1	ZINC001752304606	1440168746	/nfs/dbraw/zinc/16/87/46/1440168746.db2.gz	RAXCSEUAFCLLAP-UHFFFAOYSA-N	0	3	347.528	3.192	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CC12CCN(Cc1ncccc1C)CC2	ZINC001752423030	1440176277	/nfs/dbraw/zinc/17/62/77/1440176277.db2.gz	FNCODNJUYBUGHR-GOSISDBHSA-N	0	3	341.499	3.463	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)CCc2ccc3[nH]ccc3c2)CC1	ZINC001752426201	1440177005	/nfs/dbraw/zinc/17/70/05/1440177005.db2.gz	GZOBDFJBFJDQKA-HXUWFJFHSA-N	0	3	349.478	3.095	20	30		EGEDHN
C=CCN1CCC(N(CCC)C(=O)[C@@H]2C[C@H]2c2cccnc2)CC1	ZINC001752440563	1440181400	/nfs/dbraw/zinc/18/14/00/1440181400.db2.gz	ZAFZGEXBRGWLQE-RBUKOAKNSA-N	0	3	327.472	3.074	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H](CNC(=O)c2ccsc2)C2CC2)c1	ZINC001752444592	1440181803	/nfs/dbraw/zinc/18/18/03/1440181803.db2.gz	JZXXGSBSMLPCBM-QGZVFWFLSA-N	0	3	343.427	3.057	20	30		EGEDHN
O=C(NC[C@@H](NCC#Cc1ccccc1)C1CC1)c1c[nH]cc1C1CC1	ZINC001752490013	1440186503	/nfs/dbraw/zinc/18/65/03/1440186503.db2.gz	JAZGUGJFQFJPCK-OAQYLSRUSA-N	0	3	347.462	3.042	20	30		EGEDHN
C=CCC1(C(=O)N2CCC[C@H](CN(C)Cc3ocnc3C)C2)CCC1	ZINC001752517994	1440191821	/nfs/dbraw/zinc/19/18/21/1440191821.db2.gz	LFMIWJOESYTKTK-QGZVFWFLSA-N	0	3	345.487	3.400	20	30		EGEDHN
C=CCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@H]1OCc2ccccc21	ZINC001752544918	1440194909	/nfs/dbraw/zinc/19/49/09/1440194909.db2.gz	IGLDJTWFLFCKBO-WSTZPKSXSA-N	0	3	340.467	3.289	20	30		EGEDHN
C=CCOCCCC(=O)N1CCC[C@@H]2CN(C/C=C/Cl)CC[C@@H]21	ZINC001752704288	1440202127	/nfs/dbraw/zinc/20/21/27/1440202127.db2.gz	CXADECYBTDTAPH-CAXWLTTCSA-N	0	3	340.895	3.035	20	30		EGEDHN
C[C@H](C(=O)NC[C@@H]1CCCN(Cc2cccc(C#N)c2)C1)C1CCC1	ZINC001752781936	1440209199	/nfs/dbraw/zinc/20/91/99/1440209199.db2.gz	BBHLCLNJNDLSHV-LPHOPBHVSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@H]2CCCN(Cc3cccnc3C)C2)C1	ZINC001752785994	1440211294	/nfs/dbraw/zinc/21/12/94/1440211294.db2.gz	IDQQWBYNLYLTKM-QGZVFWFLSA-N	0	3	327.472	3.075	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)C(C)(C)c2ccccc2C)C1	ZINC001752791864	1440213871	/nfs/dbraw/zinc/21/38/71/1440213871.db2.gz	ATWABVJASKTFIS-GOSISDBHSA-N	0	3	326.484	3.124	20	30		EGEDHN
CC#CCCCC(=O)N1CCCC[C@@H]1CNCc1c(C)onc1CC	ZINC001752829177	1440224938	/nfs/dbraw/zinc/22/49/38/1440224938.db2.gz	JCAMOHUMWVJDTN-QGZVFWFLSA-N	0	3	345.487	3.210	20	30		EGEDHN
C[C@H](CNC(=O)C1(C)C(C)(C)C1(C)C)NCc1ccc(C#N)c(F)c1	ZINC001752923339	1440249400	/nfs/dbraw/zinc/24/94/00/1440249400.db2.gz	CWZRIYHWNASKBN-CYBMUJFWSA-N	0	3	345.462	3.364	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2CCC[C@@H](NCc3ccn(CC)n3)C2)CCC1	ZINC001752976866	1440256373	/nfs/dbraw/zinc/25/63/73/1440256373.db2.gz	SEZJWFFRMXVGBP-SJORKVTESA-N	0	3	344.503	3.166	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@@H](N(C)Cc2ccc(C)nc2C)C1	ZINC001752997694	1440263026	/nfs/dbraw/zinc/26/30/26/1440263026.db2.gz	XNYYEUSOZBSVBG-LJQANCHMSA-N	0	3	329.488	3.478	20	30		EGEDHN
Cc1ccc(C(=O)NCC[C@@H](C)NCc2cc(C#N)ccc2F)s1	ZINC001753001953	1440264966	/nfs/dbraw/zinc/26/49/66/1440264966.db2.gz	QTKNWADTBIGEFG-GFCCVEGCSA-N	0	3	345.443	3.366	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)NCCN(CC)[C@@H](C)c1ccc(Cl)cc1	ZINC001753080689	1440293506	/nfs/dbraw/zinc/29/35/06/1440293506.db2.gz	FJDREJONNXSMPG-KSSFIOAISA-N	0	3	338.879	3.166	20	30		EGEDHN
CCN(CCNC(=O)C[C@@H](C)C(F)(F)F)Cc1ccc(C#N)cc1	ZINC001753086751	1440296933	/nfs/dbraw/zinc/29/69/33/1440296933.db2.gz	GBMHMHDSCBXIEF-CYBMUJFWSA-N	0	3	341.377	3.085	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H]2CCN(Cc3sc(C)nc3C)C2)CCC1	ZINC001753133151	1440317501	/nfs/dbraw/zinc/31/75/01/1440317501.db2.gz	HGDPNUNWUORHJP-INIZCTEOSA-N	0	3	347.528	3.444	20	30		EGEDHN
C#CCCN[C@@H](CNC(=O)c1scnc1C(C)C)c1ccccc1	ZINC001753310343	1440356348	/nfs/dbraw/zinc/35/63/48/1440356348.db2.gz	CAQICEQNCDLFPK-INIZCTEOSA-N	0	3	341.480	3.351	20	30		EGEDHN
C#CCCN1CC[C@H](N(CCC)C(=O)[C@H](C)Cc2ccccc2F)C1	ZINC001753329222	1440368292	/nfs/dbraw/zinc/36/82/92/1440368292.db2.gz	XHRKGNDEHLZYIB-MJGOQNOKSA-N	0	3	344.474	3.341	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)Cc2ccc3c(c2)CCCO3)C1	ZINC001753457175	1440408786	/nfs/dbraw/zinc/40/87/86/1440408786.db2.gz	LGEVAVFSLPCNQW-LJQANCHMSA-N	0	3	342.483	3.053	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC1(CNCc2cc(Cl)ccc2F)CCCC1	ZINC001753500789	1440423232	/nfs/dbraw/zinc/42/32/32/1440423232.db2.gz	NXMVPQLBEINWDX-LBPRGKRZSA-N	0	3	337.826	3.157	20	30		EGEDHN
C=C(C)CCC(=O)N[C@](C)(CN[C@H](C)c1cnc(C)cn1)C1CC1	ZINC001753518805	1440428006	/nfs/dbraw/zinc/42/80/06/1440428006.db2.gz	QEEZDWDOYJDXSV-DNVCBOLYSA-N	0	3	330.476	3.077	20	30		EGEDHN
C=CCCC(=O)N[C@]1(CNCc2cccc(OC)n2)CCCC[C@@H]1C	ZINC001753531426	1440431119	/nfs/dbraw/zinc/43/11/19/1440431119.db2.gz	HWIPJNFATSXDOQ-JXFKEZNVSA-N	0	3	345.487	3.211	20	30		EGEDHN
Cc1cccnc1CNC[C@@]1(NC(=O)C#CC(C)C)CCCC[C@H]1C	ZINC001753532991	1440431624	/nfs/dbraw/zinc/43/16/24/1440431624.db2.gz	VXFXSHXZUDWRIS-NQIIRXRSSA-N	0	3	341.499	3.204	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2nccs2)CCCC[C@H]1C	ZINC001753536210	1440432646	/nfs/dbraw/zinc/43/26/46/1440432646.db2.gz	RAXUWDDEAYWKJO-ABAIWWIYSA-N	0	3	327.881	3.164	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCCN(C(=O)CC#Cc2ccccc2)C1	ZINC001753562794	1440437151	/nfs/dbraw/zinc/43/71/51/1440437151.db2.gz	XOKWDFYTJZFYSB-LJQANCHMSA-N	0	3	344.886	3.399	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2CC[C@H](NCc3nccnc3C)CC2)CCC1	ZINC001753586434	1440441339	/nfs/dbraw/zinc/44/13/39/1440441339.db2.gz	ZZJFWMKIPPWLPF-QAQDUYKDSA-N	0	3	342.487	3.048	20	30		EGEDHN
CC#CCNCc1ccc(CNC(=O)c2cccc3oc(C)nc32)cc1	ZINC001753592649	1440443348	/nfs/dbraw/zinc/44/33/48/1440443348.db2.gz	WDURCSOUOBOBLG-UHFFFAOYSA-N	0	3	347.418	3.179	20	30		EGEDHN
C=CCC1(C(=O)NC[C@H](C)CNCc2ncc(C)s2)CCCC1	ZINC001753648013	1440456046	/nfs/dbraw/zinc/45/60/46/1440456046.db2.gz	XSQOAHNABYGUPN-CQSZACIVSA-N	0	3	335.517	3.430	20	30		EGEDHN
C=CC(C)(C)C(=O)NCC1(NCc2cc(CO)ccc2F)CCCC1	ZINC001753667349	1440460617	/nfs/dbraw/zinc/46/06/17/1440460617.db2.gz	UZOWTKUXCVZMQD-UHFFFAOYSA-N	0	3	348.462	3.049	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC1(N[C@H](C)c2n[nH]c(CC)n2)CCCC1	ZINC001753667929	1440460982	/nfs/dbraw/zinc/46/09/82/1440460982.db2.gz	OKDITCXPHQWTHI-KDOFPFPSSA-N	0	3	347.507	3.049	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H](CC)OC2CCCC2)CCCC1	ZINC001753669006	1440461301	/nfs/dbraw/zinc/46/13/01/1440461301.db2.gz	AYUJMZBQOKUEDT-INIZCTEOSA-N	0	3	342.911	3.495	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)CCOc1ccccc1F)CC2	ZINC001753677234	1440463585	/nfs/dbraw/zinc/46/35/85/1440463585.db2.gz	MVVQWUGFXQPHCF-UHFFFAOYSA-N	0	3	346.446	3.095	20	30		EGEDHN
COc1ccc(C#N)cc1CNC[C@@H](C)N(C)C(=O)CC1CCCC1	ZINC001753678155	1440463910	/nfs/dbraw/zinc/46/39/10/1440463910.db2.gz	XVKGNOOBDZHMIG-OAHLLOKOSA-N	0	3	343.471	3.084	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)N(C)C(=O)C1=CCCCCC1	ZINC001753684300	1440465216	/nfs/dbraw/zinc/46/52/16/1440465216.db2.gz	BWGAOJDDXUKIAG-AWEZNQCLSA-N	0	3	331.485	3.447	20	30		EGEDHN
C[C@@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)C12CCC(CC1)C2	ZINC001753698543	1440467955	/nfs/dbraw/zinc/46/79/55/1440467955.db2.gz	FTFALILFHYJGGX-BQTBQCLESA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccccc1)N(C)C(=O)[C@@H](C)C1CCCC1	ZINC001753719691	1440472699	/nfs/dbraw/zinc/47/26/99/1440472699.db2.gz	LFFYQSFYFANYCH-ROUUACIJSA-N	0	3	326.484	3.301	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H](CN[C@@H](C)c1n[nH]c(C)n1)C1CCCCC1	ZINC001753747446	1440481505	/nfs/dbraw/zinc/48/15/05/1440481505.db2.gz	QWZFNXJBYVFBJQ-BBRMVZONSA-N	0	3	347.507	3.041	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H]([C@H](C)NCc2nc(C)sc2C)C1	ZINC001753793254	1440489254	/nfs/dbraw/zinc/48/92/54/1440489254.db2.gz	WDKDNYQZIKOHRE-BBRMVZONSA-N	0	3	335.517	3.443	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H](C)[C@H]1CNCc1c(C)nsc1C	ZINC001753818972	1440495116	/nfs/dbraw/zinc/49/51/16/1440495116.db2.gz	OEEODBGNDFHMFC-RDTXWAMCSA-N	0	3	347.528	3.280	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H](C)[C@@H]1CNCc1c(C)noc1CC	ZINC001753820693	1440495589	/nfs/dbraw/zinc/49/55/89/1440495589.db2.gz	ZYJDASOANDXXMN-YJBOKZPZSA-N	0	3	345.487	3.066	20	30		EGEDHN
CCc1cccc(C(=O)NC[C@@H](NCC#Cc2ccccc2)C(C)C)n1	ZINC001753831709	1440499933	/nfs/dbraw/zinc/49/99/33/1440499933.db2.gz	ZDDJVFSOUUIWMD-OAQYLSRUSA-N	0	3	349.478	3.040	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1c(C)noc1C(F)F)C(C)C	ZINC001753832791	1440500212	/nfs/dbraw/zinc/50/02/12/1440500212.db2.gz	USSJOVKBWLPZRE-SNVBAGLBSA-N	0	3	335.782	3.017	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)C1(CCF)CC1)NCC#Cc1ccc(F)cc1	ZINC001753835509	1440500823	/nfs/dbraw/zinc/50/08/23/1440500823.db2.gz	SJFCRTPPAJFIAM-GOSISDBHSA-N	0	3	348.437	3.047	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H]2[C@H](CCN2Cc2cc(C)ns2)C1	ZINC001753873750	1440518321	/nfs/dbraw/zinc/51/83/21/1440518321.db2.gz	UUKLYYHYOHZIGI-AEFFLSMTSA-N	0	3	345.512	3.068	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CCC[C@H]1CNCc1nc(C)cs1	ZINC001753883888	1440520906	/nfs/dbraw/zinc/52/09/06/1440520906.db2.gz	BIARMVPOURRKRN-JKSUJKDBSA-N	0	3	333.501	3.020	20	30		EGEDHN
CCCCC(=O)N1CC[C@@H]2[C@H](CCN2CC#Cc2ccc(F)cc2)C1	ZINC001753886294	1440521312	/nfs/dbraw/zinc/52/13/12/1440521312.db2.gz	UXLATHXMIKMKMC-UYAOXDASSA-N	0	3	342.458	3.290	20	30		EGEDHN
CC#CCCCC(=O)N[C@H]1CCC[C@H]1CNCc1csc(C)n1	ZINC001753897119	1440523037	/nfs/dbraw/zinc/52/30/37/1440523037.db2.gz	ZZOIWMGECTYOHV-RDJZCZTQSA-N	0	3	333.501	3.020	20	30		EGEDHN
CCN(CCNCc1cccc(C#N)c1)C(=O)c1cccc(F)c1C	ZINC001754046250	1440535294	/nfs/dbraw/zinc/53/52/94/1440535294.db2.gz	URCFXSXZAAAVAX-UHFFFAOYSA-N	0	3	339.414	3.258	20	30		EGEDHN
CCN(CCNCc1ccc(F)c(C#N)c1)C(=O)[C@@H]1C[C@H]1C(C)(C)C	ZINC001754056622	1440536218	/nfs/dbraw/zinc/53/62/18/1440536218.db2.gz	LZTBMYFTYGGOBA-IAGOWNOFSA-N	0	3	345.462	3.318	20	30		EGEDHN
CCN(CCNCc1cccc(C#N)c1)C(=O)C1CCC(F)(F)CC1	ZINC001754069467	1440538071	/nfs/dbraw/zinc/53/80/71/1440538071.db2.gz	WVBUOTSEOXIUHH-UHFFFAOYSA-N	0	3	349.425	3.322	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC/C=C\CNCc1cccc2nsnc21	ZINC001754157155	1440545774	/nfs/dbraw/zinc/54/57/74/1440545774.db2.gz	SEAMFPQKSFDEGJ-WAYWQWQTSA-N	0	3	344.484	3.056	20	30		EGEDHN
C[C@H]1CC(C(=O)NC/C=C/CNCc2ccc(C#N)cc2)C[C@@H](C)C1	ZINC001754213958	1440551671	/nfs/dbraw/zinc/55/16/71/1440551671.db2.gz	OUKSKLSBZIAOFC-KCTWEOEISA-N	0	3	339.483	3.393	20	30		EGEDHN
C[C@H](CNCC#Cc1ccc(Cl)cc1)NC(=O)/C=C/C(C)(C)C	ZINC001754220251	1440552601	/nfs/dbraw/zinc/55/26/01/1440552601.db2.gz	CJIAHCNUNITQJY-AYJWMTRPSA-N	0	3	332.875	3.388	20	30		EGEDHN
CCCc1occc1C(=O)N[C@H](C)CNCC#Cc1ccc(F)cc1	ZINC001754249510	1440557646	/nfs/dbraw/zinc/55/76/46/1440557646.db2.gz	RCYTUPGICIUAIC-OAHLLOKOSA-N	0	3	342.414	3.131	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccc(F)cc1)NC(=O)CC(C1CC1)C1CC1	ZINC001754296615	1440566410	/nfs/dbraw/zinc/56/64/10/1440566410.db2.gz	SMYLMRFSYOIRPN-HNNXBMFYSA-N	0	3	342.458	3.098	20	30		EGEDHN
C[C@H](CN(C)Cc1cccc(C#N)c1)NC(=O)c1ccoc1Cl	ZINC001754308848	1440572474	/nfs/dbraw/zinc/57/24/74/1440572474.db2.gz	WWNAOIKNDRBFRL-GFCCVEGCSA-N	0	3	331.803	3.055	20	30		EGEDHN
CCc1ccccc1C(=O)N[C@H](C)CN(C)Cc1cccc(C#N)c1	ZINC001754324450	1440579880	/nfs/dbraw/zinc/57/98/80/1440579880.db2.gz	VNBBLLYHSPFRIT-MRXNPFEDSA-N	0	3	335.451	3.371	20	30		EGEDHN
C=C(Cl)CNCCCN(C)C(=O)c1cn(C)c2ccc(F)cc12	ZINC001754376996	1440593090	/nfs/dbraw/zinc/59/30/90/1440593090.db2.gz	SMLYYJBKTHZJDD-UHFFFAOYSA-N	0	3	337.826	3.122	20	30		EGEDHN
CN(CCCNCc1ccccc1C#N)C(=O)C[C@@H]1C=CCCC1	ZINC001754380722	1440593371	/nfs/dbraw/zinc/59/33/71/1440593371.db2.gz	YWTVMIRBAPTXAL-QGZVFWFLSA-N	0	3	325.456	3.243	20	30		EGEDHN
C#CCCCC(=O)N[C@H](CNCc1cccc(Cl)c1F)C1CC1	ZINC001754439618	1440598834	/nfs/dbraw/zinc/59/88/34/1440598834.db2.gz	GJWOXSQBLILSGZ-MRXNPFEDSA-N	0	3	336.838	3.267	20	30		EGEDHN
CC#CCCCC(=O)NCC1(NCc2ccc(Cl)c(OC)c2)CC1	ZINC001754522565	1440620068	/nfs/dbraw/zinc/62/00/68/1440620068.db2.gz	QKMPUAIGVDNGOF-UHFFFAOYSA-N	0	3	348.874	3.281	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)CC2(C(F)(F)F)CC2)C1	ZINC001754537756	1440625172	/nfs/dbraw/zinc/62/51/72/1440625172.db2.gz	CYPWJKBORVGGEO-HUUCEWRRSA-N	0	3	342.405	3.055	20	30		EGEDHN
C=C(Cl)CN(CC1CC1)C1CCN(C(=O)c2c[nH]cc2C)CC1	ZINC001754548837	1440629237	/nfs/dbraw/zinc/62/92/37/1440629237.db2.gz	IBXUTLLEWHUPKW-UHFFFAOYSA-N	0	3	335.879	3.392	20	30		EGEDHN
C=CCOCC(=O)N1C[C@H]2CCC[C@@H](C1)N2CC[C@H]1CCC[C@H](C)C1	ZINC001754549962	1440629662	/nfs/dbraw/zinc/62/96/62/1440629662.db2.gz	AZNZOFMVBAEXCS-ZGXWSNOMSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@H]2CCC[C@@H](C1)N2CCC[C@@H]1CCOC1	ZINC001754553069	1440630417	/nfs/dbraw/zinc/63/04/17/1440630417.db2.gz	STWAYKYTUOMYJZ-WTGUMLROSA-N	0	3	348.531	3.471	20	30		EGEDHN
C#CCN(C(=O)C1CC1)C1CCN(Cc2ccc3c(c2)CCC3)CC1	ZINC001754633627	1440648307	/nfs/dbraw/zinc/64/83/07/1440648307.db2.gz	DLSCYYRLYBPUSZ-UHFFFAOYSA-N	0	3	336.479	3.012	20	30		EGEDHN
C#CCNC[C@H](NC(=O)CCn1cccc1)c1ccc2ccccc2c1	ZINC001754643521	1440649463	/nfs/dbraw/zinc/64/94/63/1440649463.db2.gz	AMVOQWAORAYKTO-NRFANRHFSA-N	0	3	345.446	3.112	20	30		EGEDHN
CCC(=O)N[C@H](CNCC#Cc1cccc(Cl)c1)C1CCCC1	ZINC001754643924	1440649566	/nfs/dbraw/zinc/64/95/66/1440649566.db2.gz	KOLNAQJTVPVERE-GOSISDBHSA-N	0	3	332.875	3.366	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@](C)(CN[C@@H](C)c3cnccn3)C2)CC1	ZINC001754704971	1440668890	/nfs/dbraw/zinc/66/88/90/1440668890.db2.gz	SRZJDACIYMVDPB-JXFKEZNVSA-N	0	3	342.487	3.112	20	30		EGEDHN
C=CCCC(=O)NC[C@@]1(C)CCCN(Cc2ccc3c(c2)COC3)C1	ZINC001754724516	1440675313	/nfs/dbraw/zinc/67/53/13/1440675313.db2.gz	SMFRSQBRVVQGBD-OAQYLSRUSA-N	0	3	342.483	3.401	20	30		EGEDHN
CC#CCN1CCC[C@](C)(CNC(=O)C23CCC(CC2)C3(C)C)C1	ZINC001754731958	1440679812	/nfs/dbraw/zinc/67/98/12/1440679812.db2.gz	KUVFIEUPRSOIBB-TWMPVWRBSA-N	0	3	330.516	3.444	20	30		EGEDHN
C=CCN1CCC[C@](C)(CNC(=O)c2ccoc2Br)C1	ZINC001754732284	1440680269	/nfs/dbraw/zinc/68/02/69/1440680269.db2.gz	QYTIYHWMBNVAAA-OAHLLOKOSA-N	0	3	341.249	3.060	20	30		EGEDHN
C#CCCN[C@H](CNC(=O)c1[nH]c(C)cc1C)c1ccccc1CC	ZINC001754784185	1440687100	/nfs/dbraw/zinc/68/71/00/1440687100.db2.gz	BFRUSKYHTIBKHA-LJQANCHMSA-N	0	3	337.467	3.278	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(Cc1ocnc1C)C2	ZINC001754785694	1440687706	/nfs/dbraw/zinc/68/77/06/1440687706.db2.gz	PDTDKTIFFXVGTN-BZSNNMDCSA-N	0	3	343.471	3.036	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H]([C@H](C)NCc2csc(C3CC3)n2)C1	ZINC001754787645	1440688141	/nfs/dbraw/zinc/68/81/41/1440688141.db2.gz	MYFXORYWEZTVEZ-ZFWWWQNUSA-N	0	3	333.501	3.313	20	30		EGEDHN
C=CCN[C@H](CNC(=O)c1c[nH]nc1C1CC1)c1ccccc1CC	ZINC001754790536	1440688536	/nfs/dbraw/zinc/68/85/36/1440688536.db2.gz	QZYZULDLIRVVIC-GOSISDBHSA-N	0	3	338.455	3.096	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2Cc1conc1C	ZINC001754830383	1440694770	/nfs/dbraw/zinc/69/47/70/1440694770.db2.gz	ONLXVQPJGMMUFI-VBUUOAMHSA-N	0	3	345.487	3.445	20	30		EGEDHN
C=CCCC(=O)NC[C@H]1CC[C@H](CNCc2nc(C)oc2C)CC1	ZINC001754832675	1440695985	/nfs/dbraw/zinc/69/59/85/1440695985.db2.gz	VFDXMYWCINEIRP-QAQDUYKDSA-N	0	3	333.476	3.270	20	30		EGEDHN
Cc1conc1CNC[C@H]1CC[C@H](CNC(=O)C#CC(C)(C)C)CC1	ZINC001754833565	1440696378	/nfs/dbraw/zinc/69/63/78/1440696378.db2.gz	CSMRYIDZTGTBFI-QAQDUYKDSA-N	0	3	345.487	3.045	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC[C@H]2[C@H]1CCN2Cc1cncc(C)c1	ZINC001754864837	1440702312	/nfs/dbraw/zinc/70/23/12/1440702312.db2.gz	DUFZCNUGMAPRAS-RBUKOAKNSA-N	0	3	327.472	3.312	20	30		EGEDHN
C=CCOCCCC(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1ccsc1	ZINC001754864728	1440702347	/nfs/dbraw/zinc/70/23/47/1440702347.db2.gz	YGMFJKMKOZGSDL-MSOLQXFVSA-N	0	3	348.512	3.296	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)CCCc3ccc(C)cc3)[C@@H]2C1	ZINC001754873851	1440705984	/nfs/dbraw/zinc/70/59/84/1440705984.db2.gz	ZSRQQECTARRTCE-VQTJNVASSA-N	0	3	326.484	3.427	20	30		EGEDHN
C#CCN[C@H](C)c1ccc(CNC(=O)c2c(F)cccc2OC)cc1	ZINC001754948344	1440714141	/nfs/dbraw/zinc/71/41/41/1440714141.db2.gz	YLXVBWGZVGGSRJ-CQSZACIVSA-N	0	3	340.398	3.048	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)CC[C@H]3CCCO3)cccc2C1	ZINC001754975278	1440719726	/nfs/dbraw/zinc/71/97/26/1440719726.db2.gz	ZJPYJIQMOIPQCO-LJQANCHMSA-N	0	3	342.483	3.196	20	30		EGEDHN
CC#CCNC1(CNC(=O)[C@@H]2CCc3c2cccc3Cl)CCC1	ZINC001754983648	1440722033	/nfs/dbraw/zinc/72/20/33/1440722033.db2.gz	BCNSTEBAKUFUPB-MRXNPFEDSA-N	0	3	330.859	3.022	20	30		EGEDHN
CC1(CC(=O)NCC2(NCc3ccc(F)c(C#N)c3)CCC2)CC1	ZINC001754983834	1440722187	/nfs/dbraw/zinc/72/21/87/1440722187.db2.gz	KPYUQFTYIZHNSO-UHFFFAOYSA-N	0	3	329.419	3.016	20	30		EGEDHN
C=CCCCCCN1CCN([C@H]2CCN(C(=O)C3=CCCC3)C2)CC1	ZINC001755017008	1440726209	/nfs/dbraw/zinc/72/62/09/1440726209.db2.gz	JOTFWHFWUSIIHA-FQEVSTJZSA-N	0	3	345.531	3.062	20	30		EGEDHN
C=CCCCN1Cc2ccccc2C[C@H]1CNC(=O)c1ccncc1	ZINC001755073766	1440747692	/nfs/dbraw/zinc/74/76/92/1440747692.db2.gz	FENDVKQWCOOYLC-FQEVSTJZSA-N	0	3	335.451	3.205	20	30		EGEDHN
CC1(C)CC(CN2Cc3ccc(CNC(=O)C#CC4CC4)cc3C2)C1	ZINC001755101141	1440752346	/nfs/dbraw/zinc/75/23/46/1440752346.db2.gz	SXHIRTAEVCQZRV-UHFFFAOYSA-N	0	3	336.479	3.468	20	30		EGEDHN
C=CCCCN1Cc2ccc(CNC(=O)CCn3cccc3)cc2C1	ZINC001755101517	1440752732	/nfs/dbraw/zinc/75/27/32/1440752732.db2.gz	LXBRMMVNXVIWNK-UHFFFAOYSA-N	0	3	337.467	3.476	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1CCN(Cc2cccnc2C)CC1(C)C	ZINC001755139092	1440759589	/nfs/dbraw/zinc/75/95/89/1440759589.db2.gz	TURCESZBONSOCX-SFHVURJKSA-N	0	3	329.488	3.463	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCN1C(=O)c1cccc(Cl)c1	ZINC001755202049	1440780446	/nfs/dbraw/zinc/78/04/46/1440780446.db2.gz	YOFNCGFEKMEMDJ-QGZVFWFLSA-N	0	3	336.863	3.079	20	30		EGEDHN
C[C@H](NCC#Cc1cccc(Cl)c1)[C@H](C)NC(=O)CC1CCC1	ZINC001755229189	1440786556	/nfs/dbraw/zinc/78/65/56/1440786556.db2.gz	AAWKHTMVBPNNRK-GJZGRUSLSA-N	0	3	332.875	3.365	20	30		EGEDHN
C[C@@H](NC(=O)CCC(C)(F)F)[C@H](C)NCc1ccc(C#N)s1	ZINC001755239699	1440789319	/nfs/dbraw/zinc/78/93/19/1440789319.db2.gz	GFDUNEZCIJMURY-WDEREUQCSA-N	0	3	329.416	3.038	20	30		EGEDHN
CC#CCCCC(=O)N[C@H](C)[C@@H](C)NCc1cccc(C(C)C)n1	ZINC001755247509	1440790995	/nfs/dbraw/zinc/79/09/95/1440790995.db2.gz	BHVLGNPRAAUAFQ-IAGOWNOFSA-N	0	3	329.488	3.381	20	30		EGEDHN
CCCC[C@@H](CNCc1ccc(F)c(C#N)c1)NC(=O)c1cc[nH]c1	ZINC001755357722	1440830251	/nfs/dbraw/zinc/83/02/51/1440830251.db2.gz	HMTGAWJBKAIFST-KRWDZBQOSA-N	0	3	342.418	3.104	20	30		EGEDHN
C#CCCCC(=O)NC[C@H]1CCCCCN1Cc1cccc(F)c1	ZINC001755363171	1440832899	/nfs/dbraw/zinc/83/28/99/1440832899.db2.gz	CYLNYXJETNGILW-LJQANCHMSA-N	0	3	330.447	3.490	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)COc1c(C)cccc1C	ZINC001755367524	1440835313	/nfs/dbraw/zinc/83/53/13/1440835313.db2.gz	HRVQTTDGFWXRNE-SFHVURJKSA-N	0	3	330.472	3.229	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)[C@]1(C)CCc2ccccc21	ZINC001755371970	1440837481	/nfs/dbraw/zinc/83/74/81/1440837481.db2.gz	YJXLKZCPKZPOEI-SIKLNZKXSA-N	0	3	338.495	3.275	20	30		EGEDHN
C=CCCCC(=O)N[C@H](C)C1CN(Cc2cccc(N(C)C)c2)C1	ZINC001755381175	1440839275	/nfs/dbraw/zinc/83/92/75/1440839275.db2.gz	DUYAAJOKXIYGBP-MRXNPFEDSA-N	0	3	329.488	3.045	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCc2ncc(C(C)(C)C)o2)C(C)(C)C1	ZINC001755412662	1440847078	/nfs/dbraw/zinc/84/70/78/1440847078.db2.gz	PMOSFZWNULVDHS-HNNXBMFYSA-N	0	3	347.503	3.307	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CC[C@H](NC(=O)CCc3ccoc3)C[C@H]2C1	ZINC001755449168	1440852757	/nfs/dbraw/zinc/85/27/57/1440852757.db2.gz	CNJWAHVZBPLRPM-ULQDDVLXSA-N	0	3	336.863	3.181	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@@H]2CN(Cc3ncoc3C(C)C)C[C@H]2C1	ZINC001755449718	1440853113	/nfs/dbraw/zinc/85/31/13/1440853113.db2.gz	IXBPNTLZHMVEBN-BRWVUGGUSA-N	0	3	345.487	3.481	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@]2(C)CN(Cc3cnccc3C)C[C@@]2(C)C1	ZINC001755462104	1440857732	/nfs/dbraw/zinc/85/77/32/1440857732.db2.gz	MUFYMDOWTMWOIR-OYRHEFFESA-N	0	3	341.499	3.417	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1C[C@H](CNCc2ccn(C3CCCC3)n2)C1	ZINC001755472352	1440858912	/nfs/dbraw/zinc/85/89/12/1440858912.db2.gz	ZBERDSYJAJZPMY-SAABIXHNSA-N	0	3	344.503	3.339	20	30		EGEDHN
C=C(Cl)CNC[C@H]1C[C@H](NC(=O)C[C@H]2CCO[C@@H](C(C)C)C2)C1	ZINC001755481118	1440860071	/nfs/dbraw/zinc/86/00/71/1440860071.db2.gz	DQNUVXIKNQZJEG-LUKYLMHMSA-N	0	3	342.911	3.065	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H](C)CCCNCc2ccc(C#N)cc2F)C1	ZINC001755514566	1440864148	/nfs/dbraw/zinc/86/41/48/1440864148.db2.gz	KTGLHQURVITLDW-OAHLLOKOSA-N	0	3	343.446	3.428	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CCC(N(C)C/C=C\Cl)CC1)OCC	ZINC001755530289	1440866948	/nfs/dbraw/zinc/86/69/48/1440866948.db2.gz	ZGYKMDDLXNENHF-CXOKCQFOSA-N	0	3	328.884	3.033	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC(N(C)[C@@H](C)c2cnccn2)CC1	ZINC001755531979	1440867755	/nfs/dbraw/zinc/86/77/55/1440867755.db2.gz	CPHOKSWNNCYYKA-KRWDZBQOSA-N	0	3	342.487	3.044	20	30		EGEDHN
C=CCC1(C(=O)N(C)C[C@H](C)NCc2sc(C)nc2C)CCC1	ZINC001755605818	1440885504	/nfs/dbraw/zinc/88/55/04/1440885504.db2.gz	MBOYOTCBJYJLQP-ZDUSSCGKSA-N	0	3	335.517	3.443	20	30		EGEDHN
C[C@H]1[C@H](NCC#Cc2cccc(Cl)c2)CCN1C(=O)CCCF	ZINC001755658966	1440892456	/nfs/dbraw/zinc/89/24/56/1440892456.db2.gz	NDTJORGUPGFRDQ-WMLDXEAASA-N	0	3	336.838	3.020	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@H](NCc2ccc(C#N)s2)C[C@H]1C	ZINC001755675577	1440894392	/nfs/dbraw/zinc/89/43/92/1440894392.db2.gz	KRGBAPPWQAHPNZ-GDBMZVCRSA-N	0	3	343.496	3.467	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2ccc(F)c(F)c2)CN1C(=O)C#CC(C)(C)C	ZINC001755679289	1440894943	/nfs/dbraw/zinc/89/49/43/1440894943.db2.gz	VICVVPXTINUSKB-UKRRQHHQSA-N	0	3	334.410	3.093	20	30		EGEDHN
CC#CCN[C@H]1C[C@H](C)N(C(=O)c2cc3c(o2)c(F)ccc3C)C1	ZINC001755685507	1440895829	/nfs/dbraw/zinc/89/58/29/1440895829.db2.gz	YMEIHILYSMVNHB-KBPBESRZSA-N	0	3	328.387	3.096	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H]2CCC[C@H](NCc3nocc3C)[C@H]2C1	ZINC001755708697	1440903172	/nfs/dbraw/zinc/90/31/72/1440903172.db2.gz	NJUPXPZPTHOOPE-ULQDDVLXSA-N	0	3	331.460	3.056	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CC[C@@H](CNCc2nc(C)cs2)C1	ZINC001755726227	1440909479	/nfs/dbraw/zinc/90/94/79/1440909479.db2.gz	FJBATZKIPWZPMW-HZPDHXFCSA-N	0	3	333.501	3.020	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2CC[C@@H](CNCc3nccs3)C2)CCC1	ZINC001755742263	1440912002	/nfs/dbraw/zinc/91/20/02/1440912002.db2.gz	CJNQXVIVLJHKEY-CABCVRRESA-N	0	3	333.501	3.264	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1C[C@H](NCc2ccccc2F)C(C)(C)C1	ZINC001755752262	1440913430	/nfs/dbraw/zinc/91/34/30/1440913430.db2.gz	GAVNJCIRDMGYGN-YJBOKZPZSA-N	0	3	348.462	3.134	20	30		EGEDHN
CC(C)(C)[C@@H](CNCC#Cc1ccccc1)NC(=O)C1(F)CCCC1	ZINC001755827315	1440927639	/nfs/dbraw/zinc/92/76/39/1440927639.db2.gz	JLJFVMPWXXZPHD-GOSISDBHSA-N	0	3	344.474	3.441	20	30		EGEDHN
CC(C)(C)[C@H](CNCC#Cc1ccc(F)cc1)NC(=O)CCCF	ZINC001755829541	1440928343	/nfs/dbraw/zinc/92/83/43/1440928343.db2.gz	DSACBIJPACXIBC-KRWDZBQOSA-N	0	3	336.426	3.047	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@H](C)C1CCN(Cc2cn(C)nc2C)CC1	ZINC001755844663	1440932869	/nfs/dbraw/zinc/93/28/69/1440932869.db2.gz	FFAHPUYJGUOFFC-NVXWUHKLSA-N	0	3	346.519	3.048	20	30		EGEDHN
CN(C(=O)C1CCC1)C1CC(NCC#Cc2ccccc2Cl)C1	ZINC001755849296	1440934399	/nfs/dbraw/zinc/93/43/99/1440934399.db2.gz	GYUGOGWBPWOGMW-UHFFFAOYSA-N	0	3	330.859	3.071	20	30		EGEDHN
C=CCC(C)(C)C(=O)N(C)C1CC(N[C@H](C)c2cnc(C)cn2)C1	ZINC001755862240	1440936974	/nfs/dbraw/zinc/93/69/74/1440936974.db2.gz	BGJXCFJZDWHRSR-QQFBHYJXSA-N	0	3	330.476	3.027	20	30		EGEDHN
C=CC[C@@H]1[N@@H+](CCc2ccc(-c3nnn[n-]3)cc2)CCCC1(C)C	ZINC001573330026	947430348	/nfs/dbraw/zinc/43/03/48/947430348.db2.gz	SEPZQVWVBHQHRS-KRWDZBQOSA-N	0	3	325.460	3.476	20	30		EGEDHN
C=CC[C@@H]1[N@H+](CCc2ccc(-c3nnn[n-]3)cc2)CCCC1(C)C	ZINC001573330026	947430354	/nfs/dbraw/zinc/43/03/54/947430354.db2.gz	SEPZQVWVBHQHRS-KRWDZBQOSA-N	0	3	325.460	3.476	20	30		EGEDHN
C=CC[C@@H]1[N@@H+](CCc2ccc(-c3nn[n-]n3)cc2)CCCC1(C)C	ZINC001573330026	947430359	/nfs/dbraw/zinc/43/03/59/947430359.db2.gz	SEPZQVWVBHQHRS-KRWDZBQOSA-N	0	3	325.460	3.476	20	30		EGEDHN
C=CC[C@@H]1[N@H+](CCc2ccc(-c3nn[n-]n3)cc2)CCCC1(C)C	ZINC001573330026	947430366	/nfs/dbraw/zinc/43/03/66/947430366.db2.gz	SEPZQVWVBHQHRS-KRWDZBQOSA-N	0	3	325.460	3.476	20	30		EGEDHN
C=CCC[C@@H]1CCC[N@H+]1Cc1ccc(-c2nnn[n-]2)cc1OC(F)F	ZINC001573333697	947439663	/nfs/dbraw/zinc/43/96/63/947439663.db2.gz	CUIZOERKRHFMAJ-CQSZACIVSA-N	0	3	349.385	3.399	20	30		EGEDHN
C=CCC[C@@H]1CCC[N@@H+]1Cc1ccc(-c2nnn[n-]2)cc1OC(F)F	ZINC001573333697	947439668	/nfs/dbraw/zinc/43/96/68/947439668.db2.gz	CUIZOERKRHFMAJ-CQSZACIVSA-N	0	3	349.385	3.399	20	30		EGEDHN
C=CCC[C@@H]1CCC[N@H+]1Cc1ccc(-c2nn[n-]n2)cc1OC(F)F	ZINC001573333697	947439676	/nfs/dbraw/zinc/43/96/76/947439676.db2.gz	CUIZOERKRHFMAJ-CQSZACIVSA-N	0	3	349.385	3.399	20	30		EGEDHN
C=CCC[C@@H]1CCC[N@@H+]1Cc1ccc(-c2nn[n-]n2)cc1OC(F)F	ZINC001573333697	947439685	/nfs/dbraw/zinc/43/96/85/947439685.db2.gz	CUIZOERKRHFMAJ-CQSZACIVSA-N	0	3	349.385	3.399	20	30		EGEDHN
CN(C)c1cccc(CN(C)CCC(=O)Nc2ccccc2C#N)c1	ZINC000159849224	529789181	/nfs/dbraw/zinc/78/91/81/529789181.db2.gz	NRMGUVXMKYIALR-UHFFFAOYSA-N	0	3	336.439	3.085	20	30		EGEDHN
CN1CC[C@@H](CNC(=O)c2ccccc2Oc2ccccc2C#N)C1	ZINC000181405181	529793632	/nfs/dbraw/zinc/79/36/32/529793632.db2.gz	ZBLBNFNYBORRDB-HNNXBMFYSA-N	0	3	335.407	3.032	20	30		EGEDHN
CN1CC[C@H](CNC(=O)c2ccccc2Oc2ccccc2C#N)C1	ZINC000181405159	529804458	/nfs/dbraw/zinc/80/44/58/529804458.db2.gz	ZBLBNFNYBORRDB-OAHLLOKOSA-N	0	3	335.407	3.032	20	30		EGEDHN
CN1CCC[C@@H]1CNC(=O)c1ccccc1Oc1ccccc1C#N	ZINC000181812511	530057836	/nfs/dbraw/zinc/05/78/36/530057836.db2.gz	HXBCNBMCTROHJY-MRXNPFEDSA-N	0	3	335.407	3.175	20	30		EGEDHN
COc1ccc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)cc1	ZINC000103504392	219309036	/nfs/dbraw/zinc/30/90/36/219309036.db2.gz	BHDPERDZAFOXOR-ZDUSSCGKSA-N	0	3	328.755	3.310	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(C)cc2Br)CC1	ZINC000068918501	215345424	/nfs/dbraw/zinc/34/54/24/215345424.db2.gz	RZUIZVSPIIENQL-UHFFFAOYSA-N	0	3	335.245	3.041	20	30		EGEDHN
C[C@H](NCc1ccc(N2CCO[C@H](C)C2)nc1)c1ccc(C#N)cc1	ZINC000181510399	234211966	/nfs/dbraw/zinc/21/19/66/234211966.db2.gz	OVPHWTCIPMEMNL-CVEARBPZSA-N	0	3	336.439	3.029	20	30		EGEDHN
C[C@@H](NCc1ccc(CN2CCN(C)CC2)cc1)c1ccc(C#N)cc1	ZINC000181541572	234224794	/nfs/dbraw/zinc/22/47/94/234224794.db2.gz	KLPOXWAUVNTBLW-GOSISDBHSA-N	0	3	348.494	3.156	20	30		EGEDHN
Cn1cc(CN[C@@H]2CCN(c3ccc(Cl)c(F)c3)C2)cc1C#N	ZINC000191520341	239163180	/nfs/dbraw/zinc/16/31/80/239163180.db2.gz	YMOCIHVNRILQIA-CYBMUJFWSA-N	0	3	332.810	3.058	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCC2(c3ccccc3)CC2)CC1	ZINC000264346233	246382666	/nfs/dbraw/zinc/38/26/66/246382666.db2.gz	BUSOHIKTSLNYTC-UHFFFAOYSA-N	0	3	327.472	3.058	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)o1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000266195116	248164407	/nfs/dbraw/zinc/16/44/07/248164407.db2.gz	JMCINUNKDZCRJL-KGLIPLIRSA-N	0	3	333.432	3.276	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@@H](C)N1CC[C@H](COCc2ccccc2)C1	ZINC000266524089	248344630	/nfs/dbraw/zinc/34/46/30/248344630.db2.gz	APZMZVZPVQWWJC-QUCCMNQESA-N	0	3	342.483	3.114	20	30		EGEDHN
C[C@@H]1CCN(C[C@H](O)c2ccc(C#N)cc2)CCN1Cc1ccccc1	ZINC000268616605	252071196	/nfs/dbraw/zinc/07/11/96/252071196.db2.gz	MNLBXTACDTYPTP-GCJKJVERSA-N	0	3	349.478	3.188	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1CCC(OC2CCCC2)CC1	ZINC000157704698	533503707	/nfs/dbraw/zinc/50/37/07/533503707.db2.gz	DJXAKKQMLQQUAO-UHFFFAOYSA-N	0	3	344.455	3.369	20	30		EGEDHN
N#Cc1cc(F)ccc1NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000344473432	141160417	/nfs/dbraw/zinc/16/04/17/141160417.db2.gz	LQEFUUZDUJXAPV-KRWDZBQOSA-N	0	3	338.386	3.093	20	30		EGEDHN
COc1ccc([C@H](C)NCCOc2ccc(C#N)cc2OC)cc1	ZINC000341209647	155209278	/nfs/dbraw/zinc/20/92/78/155209278.db2.gz	MPFPMWVIPAKKDU-AWEZNQCLSA-N	0	3	326.396	3.305	20	30		EGEDHN
CN(CCOc1ccc(C(F)(F)F)cc1)Cc1cc(C#N)n(C)c1	ZINC000191543345	153205441	/nfs/dbraw/zinc/20/54/41/153205441.db2.gz	VFSVOKUCMYQXOE-UHFFFAOYSA-N	0	3	337.345	3.426	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN2CCC(c3c[nH]c4ncccc34)CC2)cc1	ZINC000305085022	154081988	/nfs/dbraw/zinc/08/19/88/154081988.db2.gz	SXQDZSRIPATRNJ-HXUWFJFHSA-N	0	3	346.434	3.348	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN[C@H](CCCO)c1ccccc1	ZINC000305772136	154116677	/nfs/dbraw/zinc/11/66/77/154116677.db2.gz	KTQLEYABQNAOCA-MRXNPFEDSA-N	0	3	343.452	3.052	20	30		EGEDHN
COc1ccc(C#N)cc1CN1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O	ZINC000326518644	154184049	/nfs/dbraw/zinc/18/40/49/154184049.db2.gz	UGXBNOAAKOEYPN-IPMKNSEASA-N	0	3	328.456	3.472	20	30		EGEDHN
C[C@H](N[C@@H]1CCCC[C@H]1OC(F)F)C(=O)Nc1cccc(C#N)c1	ZINC000337383071	154322331	/nfs/dbraw/zinc/32/23/31/154322331.db2.gz	DSABWNSHSNRNPK-NILFDRSVSA-N	0	3	337.370	3.025	20	30		EGEDHN
COc1ccc(CN(CCN(C)C)Cc2cccc(F)c2)cc1C#N	ZINC000349080212	156345999	/nfs/dbraw/zinc/34/59/99/156345999.db2.gz	SVGNKRHDUNEVMV-UHFFFAOYSA-N	0	3	341.430	3.270	20	30		EGEDHN
CCS[C@H]1CCCCN([C@@H]2CCN(c3ccc(C#N)cc3)C2=O)C1	ZINC000112089350	162162873	/nfs/dbraw/zinc/16/28/73/162162873.db2.gz	ILWORGYAAVLVCB-ZWKOTPCHSA-N	0	3	343.496	3.271	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1ccc(C#N)cc1	ZINC000248398810	163000370	/nfs/dbraw/zinc/00/03/70/163000370.db2.gz	USQKUBGCJKMQDS-HNAYVOBHSA-N	0	3	334.423	3.200	20	30		EGEDHN
C[C@H](CNc1nc2c(cc1C#N)CCC2)N1CCc2ccccc2C1	ZINC000338935729	163393542	/nfs/dbraw/zinc/39/35/42/163393542.db2.gz	BVOZRAFEHWLWRB-OAHLLOKOSA-N	0	3	332.451	3.301	20	30		EGEDHN
CN(CCc1ccccc1O)Cc1cn(C)nc1-c1ccc(C#N)cc1	ZINC000344167397	164118309	/nfs/dbraw/zinc/11/83/09/164118309.db2.gz	UJWXWAFBKVBBAR-UHFFFAOYSA-N	0	3	346.434	3.339	20	30		EGEDHN
Cc1cc(CN2CCC(NC(=O)c3ccccc3)CC2)ccc1C#N	ZINC000362955062	167868117	/nfs/dbraw/zinc/86/81/17/167868117.db2.gz	OSCULZZODIEOQF-UHFFFAOYSA-N	0	3	333.435	3.261	20	30		EGEDHN
C[C@H](N[C@H]1CCCN(c2ccc(C#N)cc2F)C1)c1cncs1	ZINC000160150515	225348141	/nfs/dbraw/zinc/34/81/41/225348141.db2.gz	WIYLRHYATNKFAS-JSGCOSHPSA-N	0	3	330.432	3.473	20	30		EGEDHN
COc1cccc(O[C@@H](C)CNCc2ccc(C#N)c(OC)c2)c1	ZINC000440823102	269794279	/nfs/dbraw/zinc/79/42/79/269794279.db2.gz	QVTNKJCSVFTXNG-AWEZNQCLSA-N	0	3	326.396	3.133	20	30		EGEDHN
C[C@@H](N[C@@H](COC(N)=O)Cc1ccccc1)c1ccc(C#N)c(F)c1	ZINC000496597112	269845207	/nfs/dbraw/zinc/84/52/07/269845207.db2.gz	UAKKYYXROCIYGF-CXAGYDPISA-N	0	3	341.386	3.469	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCN(CCOc3ccc(Cl)cc3)C2)nc1	ZINC000428794411	269967207	/nfs/dbraw/zinc/96/72/07/269967207.db2.gz	ROYKELQDPWSJRJ-QGZVFWFLSA-N	0	3	343.814	3.139	20	30		EGEDHN
CCN1CCN([C@@H](C)CNc2ccc(C#N)cc2C(F)(F)F)CC1	ZINC000301508892	270044016	/nfs/dbraw/zinc/04/40/16/270044016.db2.gz	HTNCRAHJRWBPNX-ZDUSSCGKSA-N	0	3	340.393	3.015	20	30		EGEDHN
CCCOc1cccc(CN2CC[C@H](Oc3ccc(C#N)cn3)C2)c1	ZINC000430184497	270050110	/nfs/dbraw/zinc/05/01/10/270050110.db2.gz	GBLMBWLFWRTXKS-IBGZPJMESA-N	0	3	337.423	3.395	20	30		EGEDHN
N#Cc1cccc(COc2cccc(CN[C@@H](CO)CC(F)F)c2)c1	ZINC000428645504	270050264	/nfs/dbraw/zinc/05/02/64/270050264.db2.gz	CPCAOKBKTTYFAV-QGZVFWFLSA-N	0	3	346.377	3.243	20	30		EGEDHN
Cn1ccnc1C[C@H]1CCCN(Cc2ccc(C#N)cc2Cl)C1	ZINC000439437760	270051891	/nfs/dbraw/zinc/05/18/91/270051891.db2.gz	IVVNDEJSWUGFFH-OAHLLOKOSA-N	0	3	328.847	3.400	20	30		EGEDHN
CC[C@@H](Cc1ccc(C)cc1)N(C)CC(=O)NCc1ccc(C#N)cc1	ZINC000441385340	270052188	/nfs/dbraw/zinc/05/21/88/270052188.db2.gz	ZMFIXRZZCJHPLT-NRFANRHFSA-N	0	3	349.478	3.436	20	30		EGEDHN
CCN(CC)[C@@H](CNc1ncc([N+](=O)[O-])cc1C#N)c1ccsc1	ZINC000298455777	266120214	/nfs/dbraw/zinc/12/02/14/266120214.db2.gz	JAIKUOCYXJJFKJ-HNNXBMFYSA-N	0	3	345.428	3.418	20	30		EGEDHN
CCOC(=O)Nc1ccc(NC(=O)[C@@H](C)NC(C)(C)CC)cc1C#N	ZINC000275056709	266267387	/nfs/dbraw/zinc/26/73/87/266267387.db2.gz	MOEOCGVTDYJKBE-GFCCVEGCSA-N	0	3	346.431	3.232	20	30		EGEDHN
CCc1cnccc1[C@@H](C)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000350824396	266445900	/nfs/dbraw/zinc/44/59/00/266445900.db2.gz	DWQPSIKLMFFYTE-RDTXWAMCSA-N	0	3	332.407	3.075	20	30		EGEDHN
C[C@@H]1CCN(CCC(=O)Nc2sc3c(c2C#N)CCC3)CCS1	ZINC000298529912	267021854	/nfs/dbraw/zinc/02/18/54/267021854.db2.gz	MCMAYOWXAIYOKQ-GFCCVEGCSA-N	0	3	349.525	3.264	20	30		EGEDHN
CCC[C@@H](C)NC(=O)[C@@H]1CCCN(Cc2ccc(C#N)c(C)c2)C1	ZINC000486674073	267031065	/nfs/dbraw/zinc/03/10/65/267031065.db2.gz	HTQFJALPXGPGRQ-VQIMIIECSA-N	0	3	327.472	3.384	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@H]1Nc1nc2ccccn2c1C#N	ZINC000302175220	267055275	/nfs/dbraw/zinc/05/52/75/267055275.db2.gz	NYTUHYAIWTWTCQ-NVXWUHKLSA-N	0	3	331.423	3.138	20	30		EGEDHN
C[C@H](CNC(=O)C(C#N)Cc1ccc(C#N)cc1)Cc1cccs1	ZINC000280528535	267161432	/nfs/dbraw/zinc/16/14/32/267161432.db2.gz	SFYSCESPQRLLBR-WMLDXEAASA-N	0	3	337.448	3.297	20	30		EGEDHN
CCOc1ccc2c(c1)CCN(CCC(=O)Nc1ccc(C#N)cc1)C2	ZINC000441101520	267172413	/nfs/dbraw/zinc/17/24/13/267172413.db2.gz	FWGCCLCDOAQGTA-UHFFFAOYSA-N	0	3	349.434	3.344	20	30		EGEDHN
C[C@H](NC(=O)NCc1cccc(C#N)c1)[C@H](c1ccccc1)N(C)C	ZINC000286944740	267174607	/nfs/dbraw/zinc/17/46/07/267174607.db2.gz	CPKOBGBQWACXFR-HNAYVOBHSA-N	0	3	336.439	3.049	20	30		EGEDHN
CCS[C@H]1CCCC[C@@H]1NCc1cccc(C(=O)OC)c1C#N	ZINC000527298738	267181554	/nfs/dbraw/zinc/18/15/54/267181554.db2.gz	ZTAJIPDPTBFNCC-IRXDYDNUSA-N	0	3	332.469	3.499	20	30		EGEDHN
CC[C@@H]1CCCN(C(C)(C)CNC(=O)c2ncc(C#N)cc2Cl)C1	ZINC000428048605	267201159	/nfs/dbraw/zinc/20/11/59/267201159.db2.gz	NLQLHHQNEKALDF-CYBMUJFWSA-N	0	3	348.878	3.237	20	30		EGEDHN
CC[C@H](Cc1ccc(C)cc1)N(C)CC(=O)NCc1cccc(C#N)c1	ZINC000441361256	267214169	/nfs/dbraw/zinc/21/41/69/267214169.db2.gz	UYIMVXZFBDWSCA-OAQYLSRUSA-N	0	3	349.478	3.436	20	30		EGEDHN
C[C@H]1CN(c2ncc(Br)cc2C#N)CCN(C2CCC2)C1	ZINC000295647483	267239307	/nfs/dbraw/zinc/23/93/07/267239307.db2.gz	FYAFFJCQNJGXEZ-GFCCVEGCSA-N	0	3	349.276	3.026	20	30		EGEDHN
CN(C(=O)/C=C\c1ccc(C#N)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000492130896	267270323	/nfs/dbraw/zinc/27/03/23/267270323.db2.gz	CXNJNXILQBLDOC-GMGKOPGTSA-N	0	3	345.446	3.304	20	30		EGEDHN
C[C@H](NCCC(=O)N1CCc2ccccc2C1)c1ccc(C#N)cc1	ZINC000275423127	267358593	/nfs/dbraw/zinc/35/85/93/267358593.db2.gz	GLSONRQDJGKTOB-INIZCTEOSA-N	0	3	333.435	3.184	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2[C@H]3CCO[C@H]3C23CCC3)c(Br)c1	ZINC000295878193	268076648	/nfs/dbraw/zinc/07/66/48/268076648.db2.gz	FZMPFUMLQHKHHL-FVQBIDKESA-N	0	3	347.256	3.368	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCCOC2CCCCCC2)cc1	ZINC000280277288	268085639	/nfs/dbraw/zinc/08/56/39/268085639.db2.gz	FRASBDHCRWGOHK-SFHVURJKSA-N	0	3	339.439	3.096	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCc2coc3ccccc23)cc1	ZINC000352387557	268087327	/nfs/dbraw/zinc/08/73/27/268087327.db2.gz	ZPVBPBZLKRQLQQ-INIZCTEOSA-N	0	3	329.359	3.303	20	30		EGEDHN
N#Cc1ccc(NC[C@@H]2CN(Cc3ccccc3)CCCO2)c(F)c1	ZINC000302796145	268156471	/nfs/dbraw/zinc/15/64/71/268156471.db2.gz	PMXLCNIANMXCEW-GOSISDBHSA-N	0	3	339.414	3.400	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCN(C[C@@H]3CCC4(CCCCC4)O3)C2)nc1	ZINC000330223039	268181754	/nfs/dbraw/zinc/18/17/54/268181754.db2.gz	ACHPVOMBYUYZGV-MSOLQXFVSA-N	0	3	341.455	3.288	20	30		EGEDHN
N#Cc1ccnc(N[C@@H](CN2CCCC2)c2ccccc2)c1Cl	ZINC000429215426	268194413	/nfs/dbraw/zinc/19/44/13/268194413.db2.gz	PJXRJMXEORHSMA-INIZCTEOSA-N	0	3	326.831	3.278	20	30		EGEDHN
N#Cc1ccc(CNC[C@]2(CO)C[C@H]2c2ccc(F)cc2)cc1F	ZINC000421391175	268233362	/nfs/dbraw/zinc/23/33/62/268233362.db2.gz	NBTBQRQLINRZJX-HKUYNNGSSA-N	0	3	328.362	3.092	20	30		EGEDHN
N#Cc1cccc(NC(=O)CN[C@H]2CCCC[C@H]2C(F)(F)F)c1	ZINC000519547464	268279730	/nfs/dbraw/zinc/27/97/30/268279730.db2.gz	QEINBUDFIZONMF-KGLIPLIRSA-N	0	3	325.334	3.207	20	30		EGEDHN
CCCN(CCN1CCCCC1)C(=O)NCc1ccc(C#N)c(F)c1	ZINC000459105584	269652346	/nfs/dbraw/zinc/65/23/46/269652346.db2.gz	CIRDKUAVUCERSQ-UHFFFAOYSA-N	0	3	346.450	3.105	20	30		EGEDHN
N#Cc1cccc(CNCCOc2ccc(Br)cc2)c1	ZINC000049596037	275149143	/nfs/dbraw/zinc/14/91/43/275149143.db2.gz	GBAOKBSSRKKPMH-UHFFFAOYSA-N	0	3	331.213	3.489	20	30		EGEDHN
COc1ccc(CN2CCC(CNc3cc(C#N)ccn3)CC2)cc1	ZINC000286062530	275946920	/nfs/dbraw/zinc/94/69/20/275946920.db2.gz	CNWYZEBABNMLCS-UHFFFAOYSA-N	0	3	336.439	3.286	20	30		EGEDHN
CS[C@@H]1CN(c2c(C#N)cnc3c(C)cc(F)cc32)C[C@H]1N(C)C	ZINC000340753529	278156733	/nfs/dbraw/zinc/15/67/33/278156733.db2.gz	LKEMNYMULRGRFC-HZPDHXFCSA-N	0	3	344.459	3.036	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)c1ccc2cc[nH]c2c1	ZINC000065930492	307360756	/nfs/dbraw/zinc/36/07/56/307360756.db2.gz	YZBSYXFXIXOSOW-UHFFFAOYSA-N	0	3	346.434	3.244	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)NCCCC(C)(C)C	ZINC000121294158	307517258	/nfs/dbraw/zinc/51/72/58/307517258.db2.gz	YCRRQCRWECXHCJ-UHFFFAOYSA-N	0	3	344.503	3.458	20	30		EGEDHN
N#Cc1ccc(CNCCOc2ncc(Cl)cc2Cl)s1	ZINC000134475455	307687976	/nfs/dbraw/zinc/68/79/76/307687976.db2.gz	UMNUKZSGSMGHNG-UHFFFAOYSA-N	0	3	328.224	3.490	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(Cc3ccc4[nH]cnc4c3)CC2)cc1	ZINC000536630916	314132760	/nfs/dbraw/zinc/13/27/60/314132760.db2.gz	MZYCOVISLAYSMG-UHFFFAOYSA-N	0	3	345.450	3.142	20	30		EGEDHN
C[C@@H](NCCOc1ccc([N+](=O)[O-])cc1)c1ccc(C#N)c(F)c1	ZINC000537408339	314179288	/nfs/dbraw/zinc/17/92/88/314179288.db2.gz	VMVKVKALICRLOR-GFCCVEGCSA-N	0	3	329.331	3.335	20	30		EGEDHN
C[C@H]1CCN(CCNC(=O)c2ccccc2Oc2ccccc2C#N)C1	ZINC000539771000	314335302	/nfs/dbraw/zinc/33/53/02/314335302.db2.gz	ZBDFCZAPMXYYFV-INIZCTEOSA-N	0	3	349.434	3.422	20	30		EGEDHN
CC[C@@H]1CN(Cc2cccc(OCc3ccccc3C#N)c2)C[C@H]1O	ZINC000539897032	314349219	/nfs/dbraw/zinc/34/92/19/314349219.db2.gz	VAELLGYFNOZKAK-DYESRHJHSA-N	0	3	336.435	3.340	20	30		EGEDHN
C[C@@H](NCCNc1ccc(-c2ccccc2)nn1)c1ccc(C#N)cc1	ZINC000540594219	314390857	/nfs/dbraw/zinc/39/08/57/314390857.db2.gz	PJWFGCFTAXKYJV-MRXNPFEDSA-N	0	3	343.434	3.200	20	30		EGEDHN
CN(C)CCOc1ccc(-c2noc(-c3ccc(C#N)cc3)n2)cc1	ZINC000545587262	314771342	/nfs/dbraw/zinc/77/13/42/314771342.db2.gz	WYWFDDQJAQJMMT-UHFFFAOYSA-N	0	3	334.379	3.216	20	30		EGEDHN
CCC[C@@H]1CCCC[C@H]1NCCS(=O)(=O)c1ccc(C#N)cc1	ZINC000548487627	315016243	/nfs/dbraw/zinc/01/62/43/315016243.db2.gz	ADIGYPGBSYWGES-SJLPKXTDSA-N	0	3	334.485	3.280	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CNCc2ccc(-c3ccccc3)o2)cc1	ZINC000549151782	315078550	/nfs/dbraw/zinc/07/85/50/315078550.db2.gz	FGGCQUTYFDFOAW-SFHVURJKSA-N	0	3	348.402	3.348	20	30		EGEDHN
CCOC(=O)C(C)(C)C1CCN(Cc2ccc(C#N)c(OC)c2)CC1	ZINC000554872327	315354157	/nfs/dbraw/zinc/35/41/57/315354157.db2.gz	XMGOZQWUEXGHPR-UHFFFAOYSA-N	0	3	344.455	3.368	20	30		EGEDHN
N#Cc1cccc(C(=O)N2CCN(c3ccnc4ccccc43)CC2)c1	ZINC000560490506	315697840	/nfs/dbraw/zinc/69/78/40/315697840.db2.gz	UXEPYWSXMVOKFC-UHFFFAOYSA-N	0	3	342.402	3.069	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccccc2Br)CC1	ZINC000106039659	454675423	/nfs/dbraw/zinc/67/54/23/454675423.db2.gz	XBJYJCCOPMEEOT-UHFFFAOYSA-N	0	3	337.261	3.219	20	30		EGEDHN
COc1ccc(CN(CCN(C)C)Cc2ccc(C#N)cc2)c(F)c1	ZINC000565084663	316263124	/nfs/dbraw/zinc/26/31/24/316263124.db2.gz	ZWYGFVXFAVKYDL-UHFFFAOYSA-N	0	3	341.430	3.270	20	30		EGEDHN
N#Cc1csc(CN2CC[C@@](CO)(Cc3ccc(F)cc3)C2)c1	ZINC000565272336	316301804	/nfs/dbraw/zinc/30/18/04/316301804.db2.gz	MAQHXMADLSXULW-GOSISDBHSA-N	0	3	330.428	3.186	20	30		EGEDHN
Cc1ccc(C2(CNCc3cnc4c(C#N)cnn4c3)CC2)c(C)c1	ZINC000565717290	316360848	/nfs/dbraw/zinc/36/08/48/316360848.db2.gz	VFAURCSLXLHXPF-UHFFFAOYSA-N	0	3	331.423	3.039	20	30		EGEDHN
CCN(Cc1ccc(CN(C)C)cc1)C(=O)Nc1cccc(C#N)n1	ZINC000567827549	316680378	/nfs/dbraw/zinc/68/03/78/316680378.db2.gz	NWWGPCKKXGQJLF-UHFFFAOYSA-N	0	3	337.427	3.069	20	30		EGEDHN
COC(=O)CC[C@@H](CC1CCCCC1)NCc1cc(C#N)n(C)c1	ZINC000572524253	317351085	/nfs/dbraw/zinc/35/10/85/317351085.db2.gz	XSPIAGDSGFPSKB-KRWDZBQOSA-N	0	3	331.460	3.279	20	30		EGEDHN
C[C@@H]1C[C@H]1N1CCN(C(=O)c2ccc(Cl)c(C#N)c2)C[C@@H](C)C1	ZINC000579020232	325051549	/nfs/dbraw/zinc/05/15/49/325051549.db2.gz	FMHJXXQFQFBECO-OGHNNQOOSA-N	0	3	331.847	3.014	20	30		EGEDHN
CC(C)[C@H]1CCC[C@H](NCCS(=O)(=O)c2ccc(C#N)cc2)C1	ZINC000580947694	325312746	/nfs/dbraw/zinc/31/27/46/325312746.db2.gz	YMEIDZJFKMHKLC-IRXDYDNUSA-N	0	3	334.485	3.136	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](C)Cc2cc(C)cc(C)c2)CC1	ZINC000173196896	455246118	/nfs/dbraw/zinc/24/61/18/455246118.db2.gz	MAHSFHODWKLKLJ-KRWDZBQOSA-N	0	3	329.488	3.184	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CN[C@H]1CCSc2ccccc21	ZINC000600714696	460575929	/nfs/dbraw/zinc/57/59/29/460575929.db2.gz	OWAAHINJPCPZFF-RDJZCZTQSA-N	0	3	340.448	3.125	20	30		EGEDHN
N#CC(C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F)c1ccccn1	ZINC000181410213	455331424	/nfs/dbraw/zinc/33/14/24/455331424.db2.gz	NRJNRYHKXDRXOZ-NSHDSACASA-N	0	3	333.250	3.081	20	30		EGEDHN
Cc1oc([N-]C(=O)C[NH2+][C@H](Cc2ccccc2)C2CC2)c(C#N)c1C	ZINC000181550795	455353621	/nfs/dbraw/zinc/35/36/21/455353621.db2.gz	QTUUIDLHYMJFPY-GOSISDBHSA-N	0	3	337.423	3.318	20	30		EGEDHN
Cc1oc(NC(=O)CN[C@H](Cc2ccccc2)C2CC2)c(C#N)c1C	ZINC000181550795	455353623	/nfs/dbraw/zinc/35/36/23/455353623.db2.gz	QTUUIDLHYMJFPY-GOSISDBHSA-N	0	3	337.423	3.318	20	30		EGEDHN
C[C@@]1(C#N)CCCN(C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)C1	ZINC000612364153	460606317	/nfs/dbraw/zinc/60/63/17/460606317.db2.gz	DYMJPLDBKWFJJP-PXNSSMCTSA-N	0	3	343.446	3.190	20	30		EGEDHN
N#Cc1cccc(CN2CCC(C(=O)Nc3ccccc3O)CC2)c1	ZINC000015045464	453553487	/nfs/dbraw/zinc/55/34/87/453553487.db2.gz	CRVCALJWWLUBBR-UHFFFAOYSA-N	0	3	335.407	3.115	20	30		EGEDHN
C[C@@H](c1ccc(F)cc1)N(C)C[C@@H](O)COc1ccc(CC#N)cc1	ZINC000025302304	453764621	/nfs/dbraw/zinc/76/46/21/453764621.db2.gz	SOEWMZBSQXOARZ-HNAYVOBHSA-N	0	3	342.414	3.324	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN(Cc2cccs2)C2CC2)cc1	ZINC000027108968	453811186	/nfs/dbraw/zinc/81/11/86/453811186.db2.gz	XHUZTQWYCGLRPN-MRXNPFEDSA-N	0	3	328.437	3.024	20	30		EGEDHN
Cc1ccc(C)c(OC[C@H](O)CN(C)Cc2cccc(C#N)c2)c1C	ZINC000027208277	453812921	/nfs/dbraw/zinc/81/29/21/453812921.db2.gz	RBILMSLLEAWWIQ-HXUWFJFHSA-N	0	3	338.451	3.355	20	30		EGEDHN
COc1ccc(C(=O)C(C#N)c2nc3ccccc3n2C(F)F)cn1	ZINC000041557824	453971145	/nfs/dbraw/zinc/97/11/45/453971145.db2.gz	ORQLCPZSCGNFTG-NSHDSACASA-N	0	3	342.305	3.325	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccc(Br)cc2)nc(C)n1	ZINC000041574392	453973062	/nfs/dbraw/zinc/97/30/62/453973062.db2.gz	HKSLAIMYQGEPQM-ZDUSSCGKSA-N	0	3	330.185	3.346	20	30		EGEDHN
CCOC(=O)c1csc(C(C#N)C(=O)c2ccc(C)cc2C)n1	ZINC000067895299	453978323	/nfs/dbraw/zinc/97/83/23/453978323.db2.gz	LJRJGZMBKKORTG-CYBMUJFWSA-N	0	3	328.393	3.427	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cccc(C#N)c1	ZINC000076388010	453995444	/nfs/dbraw/zinc/99/54/44/453995444.db2.gz	ZJSUOXDMTZVUGI-QGZVFWFLSA-N	0	3	333.435	3.295	20	30		EGEDHN
N#Cc1ccc(CNc2cccc(CN3CCC(CO)CC3)c2)cc1	ZINC000086258250	454046361	/nfs/dbraw/zinc/04/63/61/454046361.db2.gz	QUHMGZDSRCRILP-UHFFFAOYSA-N	0	3	335.451	3.375	20	30		EGEDHN
C=CCC[C@H](O)CN(C)[C@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O	ZINC000245982038	455408918	/nfs/dbraw/zinc/40/89/18/455408918.db2.gz	DDVVHYPWYPWORV-XZJROXQQSA-N	0	3	330.255	3.210	20	30		EGEDHN
COCCOc1ccccc1C([O-])=C(C#N)c1cnc2ccccc2n1	ZINC000190890692	455397993	/nfs/dbraw/zinc/39/79/93/455397993.db2.gz	VYQXGOINXHADHE-OAHLLOKOSA-N	0	3	347.374	3.145	20	30		EGEDHN
COCCOc1ccccc1C(=O)C(C#N)c1cnc2ccccc2n1	ZINC000190890692	455398000	/nfs/dbraw/zinc/39/80/00/455398000.db2.gz	VYQXGOINXHADHE-OAHLLOKOSA-N	0	3	347.374	3.145	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)cc2)CC[C@@H]1NC(=O)OC(C)(C)C	ZINC000265884943	455399531	/nfs/dbraw/zinc/39/95/31/455399531.db2.gz	ZVFXLQWSSKPAIE-PBHICJAKSA-N	0	3	329.444	3.293	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Nc1ccc2c(c1)OCO2)C(C)C	ZINC000045030086	454134161	/nfs/dbraw/zinc/13/41/61/454134161.db2.gz	AJRINBXMZHLFKL-MRXNPFEDSA-N	0	3	345.443	3.235	20	30		EGEDHN
N#CCc1ccc(C(=O)N2C[C@@H]3CCCN3Cc3ccccc32)cc1	ZINC000089422282	454148225	/nfs/dbraw/zinc/14/82/25/454148225.db2.gz	OANABGUENIBXMR-IBGZPJMESA-N	0	3	331.419	3.377	20	30		EGEDHN
C[C@H](N[C@H]1CCCN(Cc2ccccc2)C1=O)c1ccc(C#N)cc1	ZINC000089596479	454165756	/nfs/dbraw/zinc/16/57/56/454165756.db2.gz	CKAFSZYLXNKQEB-JXFKEZNVSA-N	0	3	333.435	3.400	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C1(C#N)CCCCC1	ZINC000119586023	454206376	/nfs/dbraw/zinc/20/63/76/454206376.db2.gz	HSCRKGYOCFJHMT-WMZOPIPTSA-N	0	3	325.456	3.097	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(N3CCCC3)c(Cl)c2)CC1	ZINC000071886717	454243485	/nfs/dbraw/zinc/24/34/85/454243485.db2.gz	UTDVDHAGQZCBJV-UHFFFAOYSA-N	0	3	345.874	3.224	20	30		EGEDHN
C#CCOc1ccc([C@H](C)N[C@H](CCO)c2ccc(OC)cc2)cc1	ZINC000120374229	454292639	/nfs/dbraw/zinc/29/26/39/454292639.db2.gz	RXEFNTCIBYQJBJ-HRAATJIYSA-N	0	3	339.435	3.482	20	30		EGEDHN
C=C(C)COCCN[C@H](C)c1ccc(OCc2nccn2C)cc1	ZINC000090451234	454307211	/nfs/dbraw/zinc/30/72/11/454307211.db2.gz	ABTLXYXFYWFZRY-MRXNPFEDSA-N	0	3	329.444	3.242	20	30		EGEDHN
CN(CC(=O)Nc1ccccc1SCC#N)C(C1CC1)C1CC1	ZINC000072584630	454313983	/nfs/dbraw/zinc/31/39/83/454313983.db2.gz	XGAXCEAXPMCTMK-UHFFFAOYSA-N	0	3	329.469	3.361	20	30		EGEDHN
C[C@@H]1CN(CCC(=O)Nc2sc3c(c2C#N)CCC3)C[C@H](C)S1	ZINC000072770104	454337763	/nfs/dbraw/zinc/33/77/63/454337763.db2.gz	ZQPBFPGQSXLJSB-TXEJJXNPSA-N	0	3	349.525	3.263	20	30		EGEDHN
C[C@@H]1C[C@@H](N(C)C(=O)c2ccc(C#N)cn2)CCN1Cc1ccccc1	ZINC000132447040	454339095	/nfs/dbraw/zinc/33/90/95/454339095.db2.gz	NTXBRRILDUKMPW-APWZRJJASA-N	0	3	348.450	3.078	20	30		EGEDHN
C[C@H]1CN(Cc2cccc(CNCc3cccc(C#N)c3)c2)CCO1	ZINC000063524327	454421570	/nfs/dbraw/zinc/42/15/70/454421570.db2.gz	MXIOSFAKRIJSIQ-KRWDZBQOSA-N	0	3	335.451	3.069	20	30		EGEDHN
CN1CCC(C(=O)N[C@H](C#N)c2ccc(Cl)c(Cl)c2)CC1	ZINC000073511012	454444317	/nfs/dbraw/zinc/44/43/17/454444317.db2.gz	INXGOCQUGVUJOL-CQSZACIVSA-N	0	3	326.227	3.016	20	30		EGEDHN
CCOC(=O)CC[C@H]1CCCN(Cc2ccc(C#N)cc2OC)C1	ZINC000121563638	454452518	/nfs/dbraw/zinc/45/25/18/454452518.db2.gz	LVJJHSIZQHDKLU-OAHLLOKOSA-N	0	3	330.428	3.122	20	30		EGEDHN
N#CC(C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc21)c1nc2ccccc2[nH]1	ZINC000048790234	454516223	/nfs/dbraw/zinc/51/62/23/454516223.db2.gz	FZVRVRQTROBCSN-GFCCVEGCSA-N	0	3	345.318	3.442	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(C(=O)OC(C)(C)C)cc2)CC1	ZINC000092415881	454563838	/nfs/dbraw/zinc/56/38/38/454563838.db2.gz	PPPVPCWKRQPEFU-UHFFFAOYSA-N	0	3	344.455	3.022	20	30		EGEDHN
CC(C)(CCC#N)CN1CCCN(C(=O)Cc2cccc(F)c2)CC1	ZINC000092535437	454583468	/nfs/dbraw/zinc/58/34/68/454583468.db2.gz	UMNOPRWPKUMJLF-UHFFFAOYSA-N	0	3	345.462	3.232	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)CN[C@H](c1ccc(F)cc1)C1CCC1	ZINC000104706120	454596580	/nfs/dbraw/zinc/59/65/80/454596580.db2.gz	NCAREDPPXXZWNF-RBUKOAKNSA-N	0	3	331.435	3.311	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(-c3csc(C)n3)c[nH]2)CC1	ZINC000106038438	454675853	/nfs/dbraw/zinc/67/58/53/454675853.db2.gz	ZRRDOPZAJJKIHN-UHFFFAOYSA-N	0	3	344.484	3.217	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)[C@H](C)c2ccc(OC)cc2)CC1	ZINC000106275908	454689569	/nfs/dbraw/zinc/68/95/69/454689569.db2.gz	FCOKEYDFWKZGJW-MRXNPFEDSA-N	0	3	345.487	3.438	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H]1CCN(C(=O)CCc2ccc(C#N)cc2)C1	ZINC000081126182	454690857	/nfs/dbraw/zinc/69/08/57/454690857.db2.gz	BBAAIAKLCUGJRV-OAQYLSRUSA-N	0	3	347.462	3.224	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C[C@@H](C)Cc2ccccc2OC)CC1	ZINC000107256375	454748162	/nfs/dbraw/zinc/74/81/62/454748162.db2.gz	MGZZJCDJLRVIOA-KRWDZBQOSA-N	0	3	344.499	3.421	20	30		EGEDHN
COCCOc1ccc(CN[C@@H](C)c2ccc(OCC#N)cc2)cc1	ZINC000107317716	454751677	/nfs/dbraw/zinc/75/16/77/454751677.db2.gz	SGYDQGJIEHGDNN-INIZCTEOSA-N	0	3	340.423	3.465	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC[C@@H](C)Oc2ccccc2C)CC1	ZINC000176497901	454752763	/nfs/dbraw/zinc/75/27/63/454752763.db2.gz	FBVIDRUEXFXCBF-QGZVFWFLSA-N	0	3	345.487	3.102	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC[C@@H](C)Oc2ccc(C)cc2)CC1	ZINC000176500771	454753033	/nfs/dbraw/zinc/75/30/33/454753033.db2.gz	ZUERWQIYSGULFA-QGZVFWFLSA-N	0	3	345.487	3.102	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)c2cccc(CC#N)c2)CN1Cc1ccccc1	ZINC000176802687	454784766	/nfs/dbraw/zinc/78/47/66/454784766.db2.gz	FHWZVIGJSVUPEH-OXJNMPFZSA-N	0	3	333.435	3.145	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(N(CC)C(C)C)cc2)CC1	ZINC000108711747	454809133	/nfs/dbraw/zinc/80/91/33/454809133.db2.gz	DJRDYYCRMNSOHY-UHFFFAOYSA-N	0	3	327.472	3.205	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN1CCS[C@@H]2CCCC[C@@H]21	ZINC000177185695	454834223	/nfs/dbraw/zinc/83/42/23/454834223.db2.gz	GSEHKYFOVYOAPM-UONOGXRCSA-N	0	3	335.498	3.308	20	30		EGEDHN
Cc1ccc(CN(C)C)cc1NC(=O)Cc1ccc(OCC#N)cc1	ZINC000177305927	454849033	/nfs/dbraw/zinc/84/90/33/454849033.db2.gz	LVIVBIWBNKPBQO-UHFFFAOYSA-N	0	3	337.423	3.140	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)C(=O)NC[C@H]1CCCCN1CC	ZINC000111512414	454867724	/nfs/dbraw/zinc/86/77/24/454867724.db2.gz	PYEFOVFNYKTAAF-LJQANCHMSA-N	0	3	342.487	3.354	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN(C)C2CCN(CCC)CC2)c1C	ZINC000177602377	454882299	/nfs/dbraw/zinc/88/22/99/454882299.db2.gz	WDVMLOWHBQZDDE-UHFFFAOYSA-N	0	3	331.504	3.280	20	30		EGEDHN
C[C@H](NCC(=O)N(CCC#N)CCC#N)c1cccc2ccccc21	ZINC000126665060	454909501	/nfs/dbraw/zinc/90/95/01/454909501.db2.gz	IFIUDXZUFIVOPP-INIZCTEOSA-N	0	3	334.423	3.146	20	30		EGEDHN
COc1ccc(C#N)cc1CN(CCCO)[C@H]1CCc2ccccc21	ZINC000154609873	454911898	/nfs/dbraw/zinc/91/18/98/454911898.db2.gz	NDFZSQCUAVHONZ-FQEVSTJZSA-N	0	3	336.435	3.439	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H]2CCC[C@H](SCC)C2)CC1	ZINC000175742293	455490496	/nfs/dbraw/zinc/49/04/96/455490496.db2.gz	AOBPSFADCKIULG-HOTGVXAUSA-N	0	3	325.522	3.000	20	30		EGEDHN
CC(C)(C#N)c1ccc(NC(=O)N2CC[C@H](N3CCCC3)C2)cc1	ZINC000170751359	454969636	/nfs/dbraw/zinc/96/96/36/454969636.db2.gz	NPGJDZQSUIFVER-KRWDZBQOSA-N	0	3	326.444	3.190	20	30		EGEDHN
Cc1ccc([N-]S(=O)(=O)c2cc(C#N)ccc2C)c(C[NH+](C)C)c1	ZINC000114850213	454983937	/nfs/dbraw/zinc/98/39/37/454983937.db2.gz	RSHPZNWCHWEBFU-UHFFFAOYSA-N	0	3	343.452	3.038	20	30		EGEDHN
CCC(CC)n1nccc1C(=O)C(C#N)c1nnc2n1CCCCC2	ZINC000151734869	455023001	/nfs/dbraw/zinc/02/30/01/455023001.db2.gz	LQHMNLGDHWKVJA-CQSZACIVSA-N	0	3	340.431	3.052	20	30		EGEDHN
C=CCOc1cccc(CN2CCC(C(=O)NCCCC)CC2)c1	ZINC000179330099	455034270	/nfs/dbraw/zinc/03/42/70/455034270.db2.gz	XHGXXHBWNZXTDE-UHFFFAOYSA-N	0	3	330.472	3.380	20	30		EGEDHN
C=CC[C@@H](C)NC(=O)N1CCCN(CCCc2ccccc2)CC1	ZINC000116973888	455076240	/nfs/dbraw/zinc/07/62/40/455076240.db2.gz	OJNNQVGLQMIGSS-GOSISDBHSA-N	0	3	329.488	3.301	20	30		EGEDHN
N#CCOc1ccc(CNCc2c[nH]nc2-c2ccc(F)cc2)cc1	ZINC000171769513	455092656	/nfs/dbraw/zinc/09/26/56/455092656.db2.gz	VGWSNPQZHBFXTD-UHFFFAOYSA-N	0	3	336.370	3.408	20	30		EGEDHN
C=CCNC(=O)NC(=O)[C@H](C)N[C@H](c1ccc(Cl)cc1)[C@H]1C[C@H]1C	ZINC000180022082	455117783	/nfs/dbraw/zinc/11/77/83/455117783.db2.gz	MPWJGJPVMGWHDU-GUYJKWIASA-N	0	3	349.862	3.027	20	30		EGEDHN
CCc1ccc(C(C)(C)NCC(=O)NC2(C#N)CCCCC2)cc1	ZINC000180104229	455132438	/nfs/dbraw/zinc/13/24/38/455132438.db2.gz	LJJLEOBGKYCQAW-UHFFFAOYSA-N	0	3	327.472	3.416	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(CCC)CCc2cccc(F)c2)CC1	ZINC000172265026	455141197	/nfs/dbraw/zinc/14/11/97/455141197.db2.gz	OFORYEJRCUZDLR-UHFFFAOYSA-N	0	3	347.478	3.440	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H]2CCC[C@H]2Cc2ccccc2)CC1	ZINC000172384111	455150317	/nfs/dbraw/zinc/15/03/17/455150317.db2.gz	IROADYXAFMMBQV-AZUAARDMSA-N	0	3	341.499	3.347	20	30		EGEDHN
C[C@@H](NCCC(=O)Nc1sccc1C#N)c1cccc([N+](=O)[O-])c1	ZINC000180413872	455165481	/nfs/dbraw/zinc/16/54/81/455165481.db2.gz	GDVAVJQKJSOKRV-LLVKDONJSA-N	0	3	344.396	3.207	20	30		EGEDHN
CCN(Cc1ccc(OCC#N)cc1)C[C@@H]1COc2ccccc2O1	ZINC000264172171	455193778	/nfs/dbraw/zinc/19/37/78/455193778.db2.gz	VUKWTHYAYIYILN-GOSISDBHSA-N	0	3	338.407	3.251	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)N[C@@H](CC)c1ccc2c(c1)OCCO2	ZINC000180642572	455215784	/nfs/dbraw/zinc/21/57/84/455215784.db2.gz	ZNYIEYFHSLQYQV-RDJZCZTQSA-N	0	3	344.455	3.088	20	30		EGEDHN
CN(C)CCN(Cc1cccs1)C(=O)c1ccc(C#N)c(Cl)c1	ZINC000158360755	455296561	/nfs/dbraw/zinc/29/65/61/455296561.db2.gz	ZRBTUJRVOPDYLT-UHFFFAOYSA-N	0	3	347.871	3.477	20	30		EGEDHN
COc1ccc2oc([C@@H](C)NCCC(=O)N(C)CCC#N)c(C)c2c1	ZINC000184335194	455371825	/nfs/dbraw/zinc/37/18/25/455371825.db2.gz	YUCKOLIWMPJXNM-CQSZACIVSA-N	0	3	343.427	3.163	20	30		EGEDHN
CCCN(CC(=O)Nc1sccc1C#N)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C	ZINC000265821308	455387737	/nfs/dbraw/zinc/38/77/37/455387737.db2.gz	ATTASWCRNBYTDB-NUEKZKHPSA-N	0	3	347.484	3.084	20	30		EGEDHN
CN(CCN1CCN(CCCC(C)(C)C#N)CC1)Cc1ccccc1	ZINC000174847260	455416077	/nfs/dbraw/zinc/41/60/77/455416077.db2.gz	QHTREFJWPQAJNC-UHFFFAOYSA-N	0	3	342.531	3.066	20	30		EGEDHN
C[C@@H](O)[C@H]1CCCCN1CC#Cc1ccc(OC(F)(F)F)cc1	ZINC000160056301	455424837	/nfs/dbraw/zinc/42/48/37/455424837.db2.gz	OBZNRXZDWYJIDX-CZUORRHYSA-N	0	3	327.346	3.172	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2sc(-c3ccccc3)nc2C)CC1	ZINC000182111264	455438591	/nfs/dbraw/zinc/43/85/91/455438591.db2.gz	ZGGDSAVRERTSTI-UHFFFAOYSA-N	0	3	339.464	3.402	20	30		EGEDHN
CN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)C#Cc1ccccc1	ZINC000267091776	455499954	/nfs/dbraw/zinc/49/99/54/455499954.db2.gz	KKJVDBXTLNAUAC-NRFANRHFSA-N	0	3	332.447	3.019	20	30		EGEDHN
CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)N[C@H](CCC#N)c1ccccc1	ZINC000246563439	455508057	/nfs/dbraw/zinc/50/80/57/455508057.db2.gz	KZKAHRVRTLOIHC-CEXWTWQISA-N	0	3	340.471	3.300	20	30		EGEDHN
N#Cc1ccc(N2CCCN(Cc3ccccc3)CC2)cc1[N+](=O)[O-]	ZINC000267931662	455566199	/nfs/dbraw/zinc/56/61/99/455566199.db2.gz	LWGDHODRCAATRR-UHFFFAOYSA-N	0	3	336.395	3.179	20	30		EGEDHN
CN(Cc1cn(CCC#N)nc1-c1ccccc1)C[C@@H]1CCC[C@H]1O	ZINC000271316730	455594619	/nfs/dbraw/zinc/59/46/19/455594619.db2.gz	XXTUKINBFPHLIS-PKOBYXMFSA-N	0	3	338.455	3.057	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2ccc(NCCC)cc2)CC1	ZINC000192444069	455618046	/nfs/dbraw/zinc/61/80/46/455618046.db2.gz	RJTFTHZQUPHZRX-UHFFFAOYSA-N	0	3	344.503	3.348	20	30		EGEDHN
C=CCN(C(=O)Nc1ccc(N2CCN(CC)CC2)cc1C)C1CC1	ZINC000271391869	455619571	/nfs/dbraw/zinc/61/95/71/455619571.db2.gz	HLVSIEKTWJJWNC-UHFFFAOYSA-N	0	3	342.487	3.319	20	30		EGEDHN
N#C[C@H]1CCC[C@H](NCc2ccc(N3CCC(CO)CC3)cc2)C1	ZINC000185795778	455622798	/nfs/dbraw/zinc/62/27/98/455622798.db2.gz	WWWXSZSMAYYHSC-OALUTQOASA-N	0	3	327.472	3.067	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2Cc3ccccc3O[C@H](C)C2)CC1	ZINC000292399102	455651743	/nfs/dbraw/zinc/65/17/43/455651743.db2.gz	UVAMGXOPIJQOSN-MRXNPFEDSA-N	0	3	343.471	3.020	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cccc(-c3cc[nH]n3)c2)CC1	ZINC000185928418	455654826	/nfs/dbraw/zinc/65/48/26/455654826.db2.gz	PJAFIWKQWHZDMD-UHFFFAOYSA-N	0	3	339.443	3.239	20	30		EGEDHN
CCCN(CCC(=O)N(C)CCC#N)[C@H](C)c1ccccc1OC	ZINC000271609051	455699962	/nfs/dbraw/zinc/69/99/62/455699962.db2.gz	VOCLTFQDRZHDRL-MRXNPFEDSA-N	0	3	331.460	3.230	20	30		EGEDHN
C[C@H](CN1CCCCCC1)NC(=O)c1cccc(SCC#N)c1	ZINC000186290541	455735883	/nfs/dbraw/zinc/73/58/83/455735883.db2.gz	PABSIQWWZQGCGF-OAHLLOKOSA-N	0	3	331.485	3.297	20	30		EGEDHN
C#CC[C@H](NCCCS(=O)(=O)c1ccccc1)c1ccccc1	ZINC000271752107	455746917	/nfs/dbraw/zinc/74/69/17/455746917.db2.gz	XRSQPBVBZVVCLX-IBGZPJMESA-N	0	3	327.449	3.205	20	30		EGEDHN
CC[C@H](CN(CC)CC(=O)N[C@](C)(C#N)C1CC1)c1ccccc1	ZINC000249430492	455756007	/nfs/dbraw/zinc/75/60/07/455756007.db2.gz	JOWPEZYDNSXKFE-OXQOHEQNSA-N	0	3	327.472	3.311	20	30		EGEDHN
CC(C)C[C@@H]1OCCC[C@@H]1NCC(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000186386598	455757281	/nfs/dbraw/zinc/75/72/81/455757281.db2.gz	GHXIJMFXDAFPQH-IRXDYDNUSA-N	0	3	349.862	3.333	20	30		EGEDHN
CCOC(=O)N1CCC([C@H](C)NCC#Cc2ccc(F)cc2)CC1	ZINC000186411734	455763388	/nfs/dbraw/zinc/76/33/88/455763388.db2.gz	WWTJLOPOMYPFGK-HNNXBMFYSA-N	0	3	332.419	3.024	20	30		EGEDHN
C=C(C)COc1cccc(NC(=O)N2CC[C@@]3(CCN(C)C3)C2)c1	ZINC000292868242	455763728	/nfs/dbraw/zinc/76/37/28/455763728.db2.gz	HJKYIGZGHGQPFA-LJQANCHMSA-N	0	3	329.444	3.201	20	30		EGEDHN
N#Cc1cccc(NC(=O)NC[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000193638516	455767886	/nfs/dbraw/zinc/76/78/86/455767886.db2.gz	OABMFYVWDGNIFW-GOSISDBHSA-N	0	3	334.423	3.202	20	30		EGEDHN
C[C@@H](NCC(=O)NCc1ccc(C#N)cc1)C(C)(C)c1ccccc1	ZINC000271824051	455775889	/nfs/dbraw/zinc/77/58/89/455775889.db2.gz	QNWIIIBJFLABEM-MRXNPFEDSA-N	0	3	335.451	3.130	20	30		EGEDHN
COC(=O)c1cccc(OCCNC2(c3cccc(C#N)c3)CC2)c1	ZINC000271838457	455781905	/nfs/dbraw/zinc/78/19/05/455781905.db2.gz	VMKULQOORHSWHV-UHFFFAOYSA-N	0	3	336.391	3.003	20	30		EGEDHN
Cc1ccc(CNC(=O)C2CCN([C@@H]3CC[C@@H](C#N)C3)CC2)cc1F	ZINC000293389337	455784942	/nfs/dbraw/zinc/78/49/42/455784942.db2.gz	GUAUGIATMPTGAV-CRAIPNDOSA-N	0	3	343.446	3.155	20	30		EGEDHN
CC[C@H](NCc1ccccc1Cn1cncn1)c1ccc(C#N)cc1	ZINC000278224947	455790589	/nfs/dbraw/zinc/79/05/89/455790589.db2.gz	JKBLWVXYHAVLDZ-FQEVSTJZSA-N	0	3	331.423	3.439	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1C(=O)NC[C@H]1CCCN(Cc2cccs2)C1	ZINC000278263028	455801604	/nfs/dbraw/zinc/80/16/04/455801604.db2.gz	AADCHIGHVDEHGN-KBAYOESNSA-N	0	3	348.512	3.058	20	30		EGEDHN
C[C@@H](CNC(=O)C(C)(C)c1cc(F)cc(C#N)c1)N1CCC(C)CC1	ZINC000285189267	455802583	/nfs/dbraw/zinc/80/25/83/455802583.db2.gz	RRPPSWFVNPXXCK-HNNXBMFYSA-N	0	3	345.462	3.212	20	30		EGEDHN
COc1ccc(CN(CCOCCC#N)CCc2ccccn2)cc1	ZINC000294072322	455805236	/nfs/dbraw/zinc/80/52/36/455805236.db2.gz	KRJPJHIVSCAYFQ-UHFFFAOYSA-N	0	3	339.439	3.065	20	30		EGEDHN
N#C[C@]1(C(=O)NC[C@H](c2ccccc2)N2CCCC2)CC12CCCC2	ZINC000294454201	455816347	/nfs/dbraw/zinc/81/63/47/455816347.db2.gz	PBQCAMNDTQEQFV-NQIIRXRSSA-N	0	3	337.467	3.414	20	30		EGEDHN
N#C[C@@H]1CCC[C@@H](NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000295027594	455835415	/nfs/dbraw/zinc/83/54/15/455835415.db2.gz	OEZXVADJJAGPNP-UKRRQHHQSA-N	0	3	340.876	3.176	20	30		EGEDHN
N#C[C@@]1(C(=O)NC[C@H]2CCCN2Cc2ccccc2)CC12CCCC2	ZINC000295062192	455837792	/nfs/dbraw/zinc/83/77/92/455837792.db2.gz	KTVXQAIRVIPFFV-WIYYLYMNSA-N	0	3	337.467	3.241	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N(C)CC2CCCC2)cc1	ZINC000278549128	455840226	/nfs/dbraw/zinc/84/02/26/455840226.db2.gz	HEHWHSKNTNJHDN-CYBMUJFWSA-N	0	3	349.456	3.026	20	30		EGEDHN
C=CCSCCNC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000194474902	455847671	/nfs/dbraw/zinc/84/76/71/455847671.db2.gz	FLTZNYQYFGBMAB-MRXNPFEDSA-N	0	3	336.476	3.073	20	30		EGEDHN
CC(C)C[C@@H](CN1CCCC1)NC(=O)c1c(F)cc(C#N)cc1F	ZINC000295457907	455849771	/nfs/dbraw/zinc/84/97/71/455849771.db2.gz	MNYXMOVXFXEUGZ-AWEZNQCLSA-N	0	3	335.398	3.077	20	30		EGEDHN
C[C@@H](Cc1ccccc1F)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000279378170	455863267	/nfs/dbraw/zinc/86/32/67/455863267.db2.gz	SMMWNTDGARUGJF-KBXCAEBGSA-N	0	3	335.382	3.127	20	30		EGEDHN
Cc1ccc(CN[C@H]2CCCN(c3ccc(C#N)cc3)C2=O)s1	ZINC000272175061	455867668	/nfs/dbraw/zinc/86/76/68/455867668.db2.gz	HBZMIOHRXPCNHR-KRWDZBQOSA-N	0	3	325.437	3.213	20	30		EGEDHN
CC(C)[C@@H]1CN(c2c(C#N)cnc3c(F)ccc(F)c32)CCN1C	ZINC000617000663	460697961	/nfs/dbraw/zinc/69/79/61/460697961.db2.gz	GXQHHZBEFXYFPC-HNNXBMFYSA-N	0	3	330.382	3.161	20	30		EGEDHN
CCN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)[C@](C)(C#N)CC	ZINC000285900089	455937928	/nfs/dbraw/zinc/93/79/28/455937928.db2.gz	BIDODMOCXIUOGH-QUCCMNQESA-N	0	3	327.472	3.297	20	30		EGEDHN
C=CCC[C@@H](NCCNC(=O)c1cccc(OC)c1)c1ccco1	ZINC000286277350	456014375	/nfs/dbraw/zinc/01/43/75/456014375.db2.gz	VOKJUFOAYKVXDT-QGZVFWFLSA-N	0	3	328.412	3.315	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@@H](C)N1CC[C@@](C)(COC)C1	ZINC000296834435	456048860	/nfs/dbraw/zinc/04/88/60/456048860.db2.gz	SKKINRMZNWSCJN-CRAIPNDOSA-N	0	3	336.501	3.010	20	30		EGEDHN
C=CC[C@@H](C)NC(=O)N1CC[C@]2(CCN(Cc3ccccc3)C2)C1	ZINC000286874575	456055685	/nfs/dbraw/zinc/05/56/85/456055685.db2.gz	YXZSOCORTOEKAW-XLIONFOSSA-N	0	3	327.472	3.259	20	30		EGEDHN
COc1ccc([C@@H](C)NC[C@H](O)c2ccc(C#N)cc2)c(C)c1OC	ZINC000287103810	456060947	/nfs/dbraw/zinc/06/09/47/456060947.db2.gz	XZHAHALXQIMXAV-KDOFPFPSSA-N	0	3	340.423	3.268	20	30		EGEDHN
C=CCN1CC[C@H](N[C@@H](C)c2ccc(Oc3cccnc3)cc2)C1=O	ZINC000287284412	456065947	/nfs/dbraw/zinc/06/59/47/456065947.db2.gz	RRIZKHMLRZFLNB-KXBFYZLASA-N	0	3	337.423	3.311	20	30		EGEDHN
C=CC[C@@H](CC)NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000280925334	456084062	/nfs/dbraw/zinc/08/40/62/456084062.db2.gz	FLLNYCJBNCXYBF-GOSISDBHSA-N	0	3	329.488	3.347	20	30		EGEDHN
C=CCS(=O)(=O)CCN[C@@H]1CCCc2c3ccccc3sc21	ZINC000272887842	456103230	/nfs/dbraw/zinc/10/32/30/456103230.db2.gz	RYNLSUDDIZGCJC-OAHLLOKOSA-N	0	3	335.494	3.469	20	30		EGEDHN
C#Cc1ccc(CNc2cccc(CN3CCC(CO)CC3)c2)cc1	ZINC000289516954	456128637	/nfs/dbraw/zinc/12/86/37/456128637.db2.gz	AZQVACKHQATWRT-UHFFFAOYSA-N	0	3	334.463	3.484	20	30		EGEDHN
C=CCn1c(C)nnc1N(C)[C@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000289664840	456134997	/nfs/dbraw/zinc/13/49/97/456134997.db2.gz	MNBTXODCZVLBJR-APWZRJJASA-N	0	3	339.487	3.262	20	30		EGEDHN
COc1cc(CNCCCC#N)cc(Br)c1OC(F)F	ZINC000273095102	456175912	/nfs/dbraw/zinc/17/59/12/456175912.db2.gz	UHSSLGQKFAGZAA-UHFFFAOYSA-N	0	3	349.175	3.452	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)Cc1ccc([N+](=O)[O-])cc1	ZINC000289979973	456203730	/nfs/dbraw/zinc/20/37/30/456203730.db2.gz	ZTPHJWUABNMHLF-UHFFFAOYSA-N	0	3	338.411	3.030	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H](CO)Cc2cccc(C)c2)cc1OC	ZINC000189027481	456203948	/nfs/dbraw/zinc/20/39/48/456203948.db2.gz	QRMRCILSBCNAKY-LJQANCHMSA-N	0	3	341.451	3.262	20	30		EGEDHN
C=CC[C@H](CO)N[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)c2ccccc21	ZINC000273378245	456226391	/nfs/dbraw/zinc/22/63/91/456226391.db2.gz	BRGULHGRDIPZSK-KBRIMQKVSA-N	0	3	332.444	3.224	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1CNC(=O)c1ccc(CN2CCCCC2)cc1	ZINC000281447404	456238098	/nfs/dbraw/zinc/23/80/98/456238098.db2.gz	OJWASKJFLJGSGU-VQTJNVASSA-N	0	3	342.483	3.384	20	30		EGEDHN
CCN(C(=O)c1ccc(C#N)[nH]1)[C@@H]1CCN([C@H](C)c2ccccc2)C1	ZINC000337372015	456349184	/nfs/dbraw/zinc/34/91/84/456349184.db2.gz	WTEYOQQYTBONND-CRAIPNDOSA-N	0	3	336.439	3.184	20	30		EGEDHN
N#Cc1c(F)cccc1NC[C@H]1CN(Cc2ccccc2)CCCO1	ZINC000302783825	456398109	/nfs/dbraw/zinc/39/81/09/456398109.db2.gz	LKMNENFSNIIMHO-KRWDZBQOSA-N	0	3	339.414	3.400	20	30		EGEDHN
N#CCSCCCN1CCN(c2cncc3ccccc32)CC1	ZINC000276454720	456485890	/nfs/dbraw/zinc/48/58/90/456485890.db2.gz	NJVANDCBHCNXKK-UHFFFAOYSA-N	0	3	326.469	3.004	20	30		EGEDHN
C=CCNC(=O)c1ccc(NC[C@H](c2ccc(C)cc2)N(C)C)nc1	ZINC000353000361	456439279	/nfs/dbraw/zinc/43/92/79/456439279.db2.gz	MVLYFMUOBBOCDP-GOSISDBHSA-N	0	3	338.455	3.021	20	30		EGEDHN
C=CCOCCCN1C[C@H](O)C[C@@H]1c1ccc(C(F)(F)F)cc1	ZINC000348047309	456444199	/nfs/dbraw/zinc/44/41/99/456444199.db2.gz	JWFOVHZVKWXAAN-HZPDHXFCSA-N	0	3	329.362	3.406	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCCc2ccc(C(C)(C)C)cc2)CC1	ZINC000303258029	456454034	/nfs/dbraw/zinc/45/40/34/456454034.db2.gz	CLIWLDJCLBWUEJ-UHFFFAOYSA-N	0	3	343.515	3.476	20	30		EGEDHN
CCN1CCN(c2ccc(F)cc2[C@@H](C)N[C@@H](C)CCC#N)CC1	ZINC000276364725	456457293	/nfs/dbraw/zinc/45/72/93/456457293.db2.gz	ZQOZHTSSRHDBDC-JKSUJKDBSA-N	0	3	332.467	3.310	20	30		EGEDHN
COc1cc(CN2CCC[C@@H]2C[C@@H](O)c2ccco2)ccc1C#N	ZINC000282384028	456496353	/nfs/dbraw/zinc/49/63/53/456496353.db2.gz	QVMNZMPJWFIIGB-IAGOWNOFSA-N	0	3	326.396	3.248	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N(CC)Cc1ccncc1)C(C)C	ZINC000298669991	456512302	/nfs/dbraw/zinc/51/23/02/456512302.db2.gz	MDTAFTOOQSQDCJ-IBGZPJMESA-N	0	3	344.503	3.312	20	30		EGEDHN
COc1cc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)ccc1C#N	ZINC000282507776	456535844	/nfs/dbraw/zinc/53/58/44/456535844.db2.gz	YQROFBPXBSSENY-SFHVURJKSA-N	0	3	349.434	3.052	20	30		EGEDHN
CCCCN(CC(=O)N(CC)C[C@@H](C)C#N)Cc1ccccc1O	ZINC000282557800	456552181	/nfs/dbraw/zinc/55/21/81/456552181.db2.gz	YAIOKLILHCSJTI-INIZCTEOSA-N	0	3	331.460	3.002	20	30		EGEDHN
CC(C)(C#N)CC(=O)N[C@H]1CCN(Cc2ccccc2)CC1(C)C	ZINC000282622689	456571337	/nfs/dbraw/zinc/57/13/37/456571337.db2.gz	CWXNOEIIYCMCRG-KRWDZBQOSA-N	0	3	327.472	3.343	20	30		EGEDHN
C=CCOc1ccc(CN[C@H]2CCO[C@H]2c2cccnc2)cc1OC	ZINC000343392533	456586201	/nfs/dbraw/zinc/58/62/01/456586201.db2.gz	PCPWCRPVPFPMSC-PXNSSMCTSA-N	0	3	340.423	3.275	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)Cc1ccc(C#N)cc1)c1c(C)noc1C	ZINC000348316218	456618193	/nfs/dbraw/zinc/61/81/93/456618193.db2.gz	DVXZZPGBNQPOBH-IRXDYDNUSA-N	0	3	336.395	3.113	20	30		EGEDHN
CS[C@H](CNC(=O)C(C#N)Cc1ccc(C#N)cc1)C(C)(C)C	ZINC000348428139	456684650	/nfs/dbraw/zinc/68/46/50/456684650.db2.gz	ZYAAYPNTFMVCAO-HZPDHXFCSA-N	0	3	329.469	3.134	20	30		EGEDHN
N#CC(C(=O)c1ccc(C(F)(F)F)cn1)c1nc2ccccc2[nH]1	ZINC000338187063	456692803	/nfs/dbraw/zinc/69/28/03/456692803.db2.gz	DNSIQJPXCQJHCU-JTQLQIEISA-N	0	3	330.269	3.467	20	30		EGEDHN
C=CCN(Cc1cccs1)[C@H](C)c1cccc(-n2cnnn2)c1	ZINC000353494013	456713642	/nfs/dbraw/zinc/71/36/42/456713642.db2.gz	XNIKCLZPWYIQQI-CQSZACIVSA-N	0	3	325.441	3.473	20	30		EGEDHN
O=C(NCc1cccc(N2CCC2=O)c1)[C@H]1CCCN1C1CCCC1	ZINC000328616482	456720669	/nfs/dbraw/zinc/72/06/69/456720669.db2.gz	SNKKJPJAHOQTFG-GOSISDBHSA-N	0	3	341.455	3.287	20	30		EGEDHN
C=CCOc1cccc(CN2CCC[C@@](COC)(C(=O)OCC)C2)c1	ZINC000343645508	456762084	/nfs/dbraw/zinc/76/20/84/456762084.db2.gz	XWRQDRWDIWCVRK-HXUWFJFHSA-N	0	3	347.455	3.043	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccccc2NCc2ccco2)CC1	ZINC000343684086	456765451	/nfs/dbraw/zinc/76/54/51/456765451.db2.gz	BSFSVIOXYYFREH-UHFFFAOYSA-N	0	3	339.439	3.272	20	30		EGEDHN
C[C@H](C(=O)NC1(C#N)CCCCC1)N1CC[C@@H](C2CCOCC2)C1	ZINC000328812088	456767349	/nfs/dbraw/zinc/76/73/49/456767349.db2.gz	FOMQTXBTYLLFTH-NVXWUHKLSA-N	0	3	333.476	3.306	20	30		EGEDHN
CC(C)N1CCCN(C(=O)Nc2ccc(OC3CCCC3)nc2)CC1	ZINC000328866138	456779813	/nfs/dbraw/zinc/77/98/13/456779813.db2.gz	GOKVFENORMLXQK-UHFFFAOYSA-N	0	3	346.475	3.365	20	30		EGEDHN
Cc1cc(C)cc(N(CCC#N)C(=O)CN2CC[C@H](C3CC3)C2)c1	ZINC000343997107	456787074	/nfs/dbraw/zinc/78/70/74/456787074.db2.gz	ACKAZIVKRCKYRJ-SFHVURJKSA-N	0	3	325.456	3.282	20	30		EGEDHN
CN1CCC2(CCCN2C(=O)Nc2ccc(C#N)cc2Cl)CC1	ZINC000329031071	456818758	/nfs/dbraw/zinc/81/87/58/456818758.db2.gz	AZDLOOIERHIILS-UHFFFAOYSA-N	0	3	332.835	3.317	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H](CCO)c2ccccc2)cc1OC	ZINC000344439118	456828320	/nfs/dbraw/zinc/82/83/20/456828320.db2.gz	LAGWMZZDCNXVSJ-SFHVURJKSA-N	0	3	327.424	3.473	20	30		EGEDHN
CC(=O)Nc1cccc(NC(=O)N2CCCC23CCN(C)CC3)c1	ZINC000329072552	456828977	/nfs/dbraw/zinc/82/89/77/456828977.db2.gz	OHEDKPILUKZTQV-UHFFFAOYSA-N	0	3	330.432	3.400	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1	ZINC000338758825	456855774	/nfs/dbraw/zinc/85/57/74/456855774.db2.gz	UKGDDLIQMXRDFY-INIZCTEOSA-N	0	3	331.847	3.360	20	30		EGEDHN
CC[C@H](C)n1ncc(NC(=O)N2C[C@@H](N3CCCC3)C[C@H]2C)c1C	ZINC000329229571	456858164	/nfs/dbraw/zinc/85/81/64/456858164.db2.gz	CTEFCRGZPJUXQM-LZWOXQAQSA-N	0	3	333.480	3.267	20	30		EGEDHN
C=CCOc1ccc(CN2CC[C@H](COC(F)F)C2)cc1OC	ZINC000348865275	456884958	/nfs/dbraw/zinc/88/49/58/456884958.db2.gz	DBFDTQRJHALGIQ-AWEZNQCLSA-N	0	3	327.371	3.321	20	30		EGEDHN
N#Cc1cc2c(nc1NCC1(N3CCSCC3)CCCC1)CCC2	ZINC000338996792	456892628	/nfs/dbraw/zinc/89/26/28/456892628.db2.gz	KUDOTHKREACKRI-UHFFFAOYSA-N	0	3	342.512	3.215	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)[C@H]1CC12CCCC2	ZINC000353772695	456900449	/nfs/dbraw/zinc/90/04/49/456900449.db2.gz	WBUGNSBZXGLKDH-GOSISDBHSA-N	0	3	325.456	3.029	20	30		EGEDHN
C[C@@H]1CCN(C)CCN1C(=O)Nc1cccc(C#Cc2ccccn2)c1	ZINC000345053374	456910306	/nfs/dbraw/zinc/91/03/06/456910306.db2.gz	FSYCROBOAITRMU-QGZVFWFLSA-N	0	3	348.450	3.039	20	30		EGEDHN
Cc1nc2ccccc2n1CCC(=O)N[C@@H]1C[C@@H](C)N(C2CC2)C1	ZINC000329580614	456911629	/nfs/dbraw/zinc/91/16/29/456911629.db2.gz	WXFIXJVRABREAQ-UKRRQHHQSA-N	0	3	326.444	3.317	20	30		EGEDHN
[O-]C(NC[C@@H]1CCc2nccn2C1)=[NH+][C@@H]1CCCCC12CCCC2	ZINC000329606899	456915043	/nfs/dbraw/zinc/91/50/43/456915043.db2.gz	IEZCLQFQPPQQCR-JKSUJKDBSA-N	0	3	330.476	3.452	20	30		EGEDHN
C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH+]=C([O-])N[C@@H]1CCc2nc[nH]c2C1	ZINC000329727693	456932847	/nfs/dbraw/zinc/93/28/47/456932847.db2.gz	OVNGZWNPTTYFAH-SEDUGSJDSA-N	0	3	342.418	3.233	20	30		EGEDHN
COc1cc(CN(CCN(C)C)Cc2cccc(C)c2)ccc1C#N	ZINC000349315571	456939187	/nfs/dbraw/zinc/93/91/87/456939187.db2.gz	LIYFTBIRQGQUIL-UHFFFAOYSA-N	0	3	337.467	3.439	20	30		EGEDHN
CC(C(=O)N[C@H](C)CC1CCCCC1)S(=O)(=O)C1CCOCC1	ZINC000329956374	456966459	/nfs/dbraw/zinc/96/64/59/456966459.db2.gz	PAIHCBWCIPWJJT-KGLIPLIRSA-N	0	3	345.505	3.284	20	30		EGEDHN
C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)c1cc(-c2ccc(F)cc2)on1	ZINC000330005537	456972851	/nfs/dbraw/zinc/97/28/51/456972851.db2.gz	BZDYOYZCEBCTAT-BZNIZROVSA-N	0	3	329.375	3.268	20	30		EGEDHN
C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)CCc1nc(C2CCCC2)no1	ZINC000330004346	456973066	/nfs/dbraw/zinc/97/30/66/456973066.db2.gz	AZGHXVMKBPDTEZ-DOMZBBRYSA-N	0	3	332.448	3.099	20	30		EGEDHN
CC(C)c1cnc(SCC(=O)NC2CCN(C3CC3)CC2)n1C	ZINC000330007687	456973715	/nfs/dbraw/zinc/97/37/15/456973715.db2.gz	GASGXIMKKAVVSS-UHFFFAOYSA-N	0	3	336.505	3.219	20	30		EGEDHN
Cc1nccc(NC(=O)NC2CCN([C@@H](C)c3ccccc3)CC2)n1	ZINC000330105185	456985585	/nfs/dbraw/zinc/98/55/85/456985585.db2.gz	IGARCJYPFDWLTO-AWEZNQCLSA-N	0	3	339.443	3.337	20	30		EGEDHN
CC(C)(C#N)CCN1CCC[C@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000345716521	456988937	/nfs/dbraw/zinc/98/89/37/456988937.db2.gz	SUOPOISNAKDTOF-ZDUSSCGKSA-N	0	3	334.851	3.325	20	30		EGEDHN
CC(C)CCn1ncc(NC(=O)N2CCN3CCC[C@@H]3C2)c1C(C)C	ZINC000330174887	456995698	/nfs/dbraw/zinc/99/56/98/456995698.db2.gz	IQASUOPNCXOTEN-MRXNPFEDSA-N	0	3	347.507	3.378	20	30		EGEDHN
C[C@H](CNC(=O)c1cn(CCCC#N)c2ccccc12)N(C)C1CC1	ZINC000345829824	456999418	/nfs/dbraw/zinc/99/94/18/456999418.db2.gz	MWFUWICYHBABSX-OAHLLOKOSA-N	0	3	338.455	3.158	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](Nc2ncc([N+](=O)[O-])cc2C#N)C1	ZINC000341925352	457005330	/nfs/dbraw/zinc/00/53/30/457005330.db2.gz	HSYWLPUYYRMQEE-CJNGLKHVSA-N	0	3	337.383	3.109	20	30		EGEDHN
O=C(Nc1ccccc1)[C@H]1CCCN(C(=O)[C@@H]2CCCN2C2CC2)C1	ZINC000330220274	457006936	/nfs/dbraw/zinc/00/69/36/457006936.db2.gz	QBURSQNRYPWEAR-YJBOKZPZSA-N	0	3	341.455	3.140	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2CCN([C@@H]3C[C@H]3C)C[C@H](C)C2)cc1	ZINC000346161857	457021207	/nfs/dbraw/zinc/02/12/07/457021207.db2.gz	NFLKAUGZIYMFQV-FRQCXROJSA-N	0	3	328.456	3.054	20	30		EGEDHN
C[C@@H](C#N)CN(C)C(=O)NC1CCN([C@H](C)c2ccccc2)CC1	ZINC000342001576	457053731	/nfs/dbraw/zinc/05/37/31/457053731.db2.gz	IXUZQBGMSXEVLB-JKSUJKDBSA-N	0	3	328.460	3.013	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N(CCN(C)C)Cc1cccc(C)c1)OCC	ZINC000339353312	457064223	/nfs/dbraw/zinc/06/42/23/457064223.db2.gz	VXKYMGJLSNLMOQ-IBGZPJMESA-N	0	3	332.488	3.257	20	30		EGEDHN
Cc1ccc([N+](=O)[O-])cc1NC(=O)N(C)[C@@H](C)C1CCN(C)CC1	ZINC000330690155	457070774	/nfs/dbraw/zinc/07/07/74/457070774.db2.gz	AIRHUJNKOALYTH-ZDUSSCGKSA-N	0	3	334.420	3.111	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)[C@@H](C)N1C[C@@H](c2ccccc2)C[C@H]1C	ZINC000330793963	457086831	/nfs/dbraw/zinc/08/68/31/457086831.db2.gz	CZSDEQBTRJTRQM-ZTRFORPCSA-N	0	3	327.472	3.307	20	30		EGEDHN
N#CCSCCCN[C@@H](CCO)c1ccccc1Br	ZINC000359538132	457092269	/nfs/dbraw/zinc/09/22/69/457092269.db2.gz	MHULUXMCGSTFOV-AWEZNQCLSA-N	0	3	343.290	3.109	20	30		EGEDHN
N#Cc1ccc(-c2nc(-c3ccc(OCCN4CCCC4)cc3)no2)[nH]1	ZINC000356669718	457112068	/nfs/dbraw/zinc/11/20/68/457112068.db2.gz	IMDXVSHPTVEXQC-UHFFFAOYSA-N	0	3	349.394	3.078	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(F)c(Cl)c1)c1ccc([N+](=O)[O-])cn1	ZINC000359915614	457145694	/nfs/dbraw/zinc/14/56/94/457145694.db2.gz	XOELLQTXEPIQED-JTQLQIEISA-N	0	3	334.694	3.028	20	30		EGEDHN
CC(C)(C)[C@@H](C#N)NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000331222956	457149334	/nfs/dbraw/zinc/14/93/34/457149334.db2.gz	YYPKVNUVXLICLU-NVXWUHKLSA-N	0	3	331.435	3.092	20	30		EGEDHN
CC[C@@H](C)N[C@H](CNC(=O)NCC#Cc1ccccc1)c1ccco1	ZINC000350125734	457165495	/nfs/dbraw/zinc/16/54/95/457165495.db2.gz	NDNLQNSWEFPFHA-SJLPKXTDSA-N	0	3	339.439	3.060	20	30		EGEDHN
N#CC1(NC(=O)CN[C@@H](CC2CCCC2)c2ccccc2)CCC1	ZINC000346966593	457193122	/nfs/dbraw/zinc/19/31/22/457193122.db2.gz	OMMDRRCJMIJOIS-SFHVURJKSA-N	0	3	325.456	3.460	20	30		EGEDHN
COCCN(C(=O)C(C)C#N)[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000347029944	457197270	/nfs/dbraw/zinc/19/72/70/457197270.db2.gz	BWOIYAPHHBMXDR-NEPJUHHUSA-N	0	3	328.334	3.401	20	30		EGEDHN
CCCOc1ccccc1Oc1ncccc1CNC(=O)C(C)C#N	ZINC000347080171	457219959	/nfs/dbraw/zinc/21/99/59/457219959.db2.gz	WIEMQQYLGINNGW-CQSZACIVSA-N	0	3	339.395	3.439	20	30		EGEDHN
COc1cc(CNC[C@H](CO)c2ccccc2Cl)ccc1C#N	ZINC000342309034	457228331	/nfs/dbraw/zinc/22/83/31/457228331.db2.gz	SRIMIIZADCIHAQ-OAHLLOKOSA-N	0	3	330.815	3.086	20	30		EGEDHN
CC(C#N)C(=O)NCc1ccccc1-c1ccc(Cn2cccn2)cc1	ZINC000347117596	457238444	/nfs/dbraw/zinc/23/84/44/457238444.db2.gz	VATRJUGMCKVHHO-INIZCTEOSA-N	0	3	344.418	3.374	20	30		EGEDHN
C=C(C)CN(Cc1ccc(CO)o1)C(=O)[C@@H]1CCCN1C1CCCC1	ZINC000342391109	457275659	/nfs/dbraw/zinc/27/56/59/457275659.db2.gz	FRONGEGZIOOZDY-IBGZPJMESA-N	0	3	346.471	3.084	20	30		EGEDHN
CC(C)[C@]1(CO)CCCN(C(=O)C(C#N)CCc2ccccc2)C1	ZINC000360170775	457286934	/nfs/dbraw/zinc/28/69/34/457286934.db2.gz	KRSUSDOAUTXNMI-UYAOXDASSA-N	0	3	328.456	3.016	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H](C)[C@@H]2OCCc3sccc32)CC1	ZINC000339998581	457319738	/nfs/dbraw/zinc/31/97/38/457319738.db2.gz	GROUECWJAINSGG-KSSFIOAISA-N	0	3	348.512	3.155	20	30		EGEDHN
CC[C@@H](CNC(=O)c1ccc(CC#N)cc1)N1CCc2ccccc2C1	ZINC000340072381	457326848	/nfs/dbraw/zinc/32/68/48/457326848.db2.gz	HXKXHPTZUGIXNR-NRFANRHFSA-N	0	3	347.462	3.319	20	30		EGEDHN
CCN(Cc1ccc(OC)c(C#N)c1)C[C@H]1COc2ccccc2O1	ZINC000340124032	457338206	/nfs/dbraw/zinc/33/82/06/457338206.db2.gz	BVUUXQJZAXUBMK-KRWDZBQOSA-N	0	3	338.407	3.229	20	30		EGEDHN
CCOC(=O)c1ccc(C(=O)C(C#N)c2nc3ccccc3n2C)cc1	ZINC000355112406	457342701	/nfs/dbraw/zinc/34/27/01/457342701.db2.gz	GNISVFNROHSDGP-HNNXBMFYSA-N	0	3	347.374	3.240	20	30		EGEDHN
C=C[C@H](CC(=O)NCC1(SC)CCN(C)CC1)c1ccccc1	ZINC000355438165	457373729	/nfs/dbraw/zinc/37/37/29/457373729.db2.gz	DIZDITXMRXFGEX-MRXNPFEDSA-N	0	3	332.513	3.290	20	30		EGEDHN
CC(=O)Nc1ccc(CN[C@@H]2CCCCc3cc(C#N)ccc32)cn1	ZINC000360881701	457403363	/nfs/dbraw/zinc/40/33/63/457403363.db2.gz	AHTRRJQDXFOUBN-LJQANCHMSA-N	0	3	334.423	3.469	20	30		EGEDHN
CC1(C)CCCN(CCNC(=O)CSCc2ccc(C#N)cc2)C1	ZINC000347419788	457417194	/nfs/dbraw/zinc/41/71/94/457417194.db2.gz	BKEBYTAUQTWQGZ-UHFFFAOYSA-N	0	3	345.512	3.030	20	30		EGEDHN
CN(C)CCN(C(=O)C[C@@H](CC#N)c1ccccc1)C1CCCC1	ZINC000356103489	457449132	/nfs/dbraw/zinc/44/91/32/457449132.db2.gz	YUWSUKUKKJOVQM-GOSISDBHSA-N	0	3	327.472	3.407	20	30		EGEDHN
CCCN(CCN1CCCCC1)C(=O)c1c(F)cc(C#N)cc1F	ZINC000342789577	457530540	/nfs/dbraw/zinc/53/05/40/457530540.db2.gz	CGSVTAHAGSAJHF-UHFFFAOYSA-N	0	3	335.398	3.175	20	30		EGEDHN
N#Cc1ccccc1-c1ccc(CN2CC[C@H](n3cncn3)C2)cc1	ZINC000364495152	457623502	/nfs/dbraw/zinc/62/35/02/457623502.db2.gz	MAYPFOZCRFVSGR-IBGZPJMESA-N	0	3	329.407	3.264	20	30		EGEDHN
CCOc1nc(C)ccc1C(=O)C(C#N)c1nc2ccccc2n1C	ZINC000361194469	457641065	/nfs/dbraw/zinc/64/10/65/457641065.db2.gz	SOYMYIJSVZKAKQ-CQSZACIVSA-N	0	3	334.379	3.166	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NC[C@]1(C)CCN(Cc2ccccc2)C1	ZINC000370590353	457678397	/nfs/dbraw/zinc/67/83/97/457678397.db2.gz	WAAXADLTGBVUIH-LEWJYISDSA-N	0	3	344.499	3.244	20	30		EGEDHN
CC(C#N)C(=O)N1CCC[C@@H]1C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000357797128	457694190	/nfs/dbraw/zinc/69/41/90/457694190.db2.gz	LEXUJMPSUNSHRJ-NOZJJQNGSA-N	0	3	340.210	3.083	20	30		EGEDHN
CCC[C@H](C#N)N(C)C(=O)[C@@H]1CN(C(C)(C)C)C[C@H]1C(F)(F)F	ZINC000410833838	457761027	/nfs/dbraw/zinc/76/10/27/457761027.db2.gz	IDWYOCYXAJBXAT-JHJVBQTASA-N	0	3	333.398	3.046	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCc1ccnc(N2CCCC2)c1	ZINC000433232895	457785271	/nfs/dbraw/zinc/78/52/71/457785271.db2.gz	NFWLNHLRDGRCFO-LJQANCHMSA-N	0	3	348.450	3.071	20	30		EGEDHN
CC(C)O[C@@H]1C[C@@H](N[C@H](C)C(=O)Nc2cccc(C#N)c2)C1(C)C	ZINC000361547269	457787524	/nfs/dbraw/zinc/78/75/24/457787524.db2.gz	DDQGJHJWELGMQP-KBRIMQKVSA-N	0	3	329.444	3.067	20	30		EGEDHN
N#Cc1ccc(OCCN[C@@H](c2ccccc2)C2(CO)CCC2)cc1	ZINC000433295733	457802768	/nfs/dbraw/zinc/80/27/68/457802768.db2.gz	QFAGNSLCYRVIEO-FQEVSTJZSA-N	0	3	336.435	3.431	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCCc1cc(F)cc(F)c1	ZINC000433342217	457815771	/nfs/dbraw/zinc/81/57/71/457815771.db2.gz	KDAYQFSPJKBSCB-INIZCTEOSA-N	0	3	328.362	3.396	20	30		EGEDHN
N#CCCN(C(=O)CN1CC[C@H]2CCC[C@@H]21)c1cccc(Cl)c1	ZINC000426474829	457837223	/nfs/dbraw/zinc/83/72/23/457837223.db2.gz	VWZAOGKROBSKHK-PBHICJAKSA-N	0	3	331.847	3.461	20	30		EGEDHN
Cc1cc(CNc2ccc(OC3CCN(C)CC3)nc2)ccc1C#N	ZINC000443996581	457838265	/nfs/dbraw/zinc/83/82/65/457838265.db2.gz	KCLDSRUIKSSWFO-UHFFFAOYSA-N	0	3	336.439	3.347	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN(C)CC[C@@H]2CCCCN2C)c1C	ZINC000444167279	457863282	/nfs/dbraw/zinc/86/32/82/457863282.db2.gz	DNLUHRMRPDUZBY-SFHVURJKSA-N	0	3	331.504	3.280	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1noc2c1C[C@@H](C)CC2)C(C)C	ZINC000433791365	457886802	/nfs/dbraw/zinc/88/68/02/457886802.db2.gz	CMSHGIJBEHTRDL-DOTOQJQBSA-N	0	3	345.487	3.228	20	30		EGEDHN
C[C@@H]1C[C@@H](c2cccnc2)N(CCC(=O)Nc2ccccc2C#N)C1	ZINC000411524425	457911386	/nfs/dbraw/zinc/91/13/86/457911386.db2.gz	KUFPKBNGVBILBX-BEFAXECRSA-N	0	3	334.423	3.365	20	30		EGEDHN
COc1cccc2c1C[C@H](NC(=O)C(C#N)CCc1ccccc1)C2	ZINC000458071948	457921638	/nfs/dbraw/zinc/92/16/38/457921638.db2.gz	CJJQDMJSYGPEBG-ZWKOTPCHSA-N	0	3	334.419	3.051	20	30		EGEDHN
COc1cccc2c1C[C@H](NC(=O)C(C#N)CCc1ccccc1)C2	ZINC000458071943	457922352	/nfs/dbraw/zinc/92/23/52/457922352.db2.gz	CJJQDMJSYGPEBG-QZTJIDSGSA-N	0	3	334.419	3.051	20	30		EGEDHN
C=CCN(C)CCN(CC)[C@H](C)c1nc(-c2ccc(OC)cc2)no1	ZINC000411641298	457936180	/nfs/dbraw/zinc/93/61/80/457936180.db2.gz	LTEBAGYNFAFNSX-OAHLLOKOSA-N	0	3	344.459	3.246	20	30		EGEDHN
C[C@@H](CCC#N)N1C[C@H]2CCC[C@@]2(c2nc(-c3cccnc3)no2)C1	ZINC000411639342	457936872	/nfs/dbraw/zinc/93/68/72/457936872.db2.gz	VQZGQALEOFHCEJ-ZSZQSSIHSA-N	0	3	337.427	3.177	20	30		EGEDHN
C=CCS(=O)(=O)CCN[C@H]1CCC[C@@H]1c1ccccc1Cl	ZINC000368319615	458025100	/nfs/dbraw/zinc/02/51/00/458025100.db2.gz	STMYHIGJGHPSMY-ZBFHGGJFSA-N	0	3	327.877	3.167	20	30		EGEDHN
CCN(CCC#N)C(=O)CN(C)[C@H]1CCCC[C@H]1c1ccccc1	ZINC000412007426	458043079	/nfs/dbraw/zinc/04/30/79/458043079.db2.gz	JDFSLMCJQVKZKV-OALUTQOASA-N	0	3	327.472	3.407	20	30		EGEDHN
CN(CCC#N)c1ccc(CN2CCC[C@H](OCC3CC3)C2)cc1	ZINC000368728523	458053866	/nfs/dbraw/zinc/05/38/66/458053866.db2.gz	MUXWSUSBFRAQNU-FQEVSTJZSA-N	0	3	327.472	3.427	20	30		EGEDHN
C[C@H]1C[C@H](N2CCCC2)CN1C(=O)c1cccc(SCC#N)c1	ZINC000375822493	458082072	/nfs/dbraw/zinc/08/20/72/458082072.db2.gz	FHFAQRWNWYJDIW-HOCLYGCPSA-N	0	3	329.469	3.001	20	30		EGEDHN
C=C(C)[C@H](NC(=O)NCC1(N(C)C)CCC1)c1ccc(F)c(F)c1	ZINC000445861359	458104385	/nfs/dbraw/zinc/10/43/85/458104385.db2.gz	AOZULIFYTUXOGX-INIZCTEOSA-N	0	3	337.414	3.366	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1	ZINC000371925887	458124769	/nfs/dbraw/zinc/12/47/69/458124769.db2.gz	CQVUKSPQRFSVPV-HDICACEKSA-N	0	3	348.531	3.493	20	30		EGEDHN
CC[C@H]1CCCCN1CCNC(=O)[C@H](C#N)CCc1ccccc1	ZINC000435928222	458225865	/nfs/dbraw/zinc/22/58/65/458225865.db2.gz	OVDURZDKTIMNEJ-OALUTQOASA-N	0	3	327.472	3.140	20	30		EGEDHN
C=CC(C)(C)CNC(=O)N(CCN(C)C)Cc1ccc(F)cc1F	ZINC000458986773	458236349	/nfs/dbraw/zinc/23/63/49/458236349.db2.gz	LADNTXJYVSRCKE-UHFFFAOYSA-N	0	3	339.430	3.250	20	30		EGEDHN
CCN(CCC#N)C(=O)CN1C[C@H](c2ccccc2)[C@H]2CCCC[C@@H]21	ZINC000362585072	458285047	/nfs/dbraw/zinc/28/50/47/458285047.db2.gz	BLBVSRNCYPHOIC-AQNXPRMDSA-N	0	3	339.483	3.407	20	30		EGEDHN
CC(C)[C@@]1(C)C[C@H]1NC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000459248373	458301070	/nfs/dbraw/zinc/30/10/70/458301070.db2.gz	MLIJBNFFZDUGHX-UYAOXDASSA-N	0	3	342.487	3.066	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)NCc1ccc(S(C)(=O)=O)s1	ZINC000414540030	458322833	/nfs/dbraw/zinc/32/28/33/458322833.db2.gz	TWQHQNZUSUEWKE-HNNXBMFYSA-N	0	3	335.494	3.429	20	30		EGEDHN
C=CCOc1cccc(NC(=O)N2C[C@@H](c3ccccc3)[C@H](N)C2)c1	ZINC000415021372	458326076	/nfs/dbraw/zinc/32/60/76/458326076.db2.gz	YLCKZDGPSZPHOF-RBUKOAKNSA-N	0	3	337.423	3.210	20	30		EGEDHN
C[C@@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1ccc(C#N)cc1	ZINC000436711758	458364445	/nfs/dbraw/zinc/36/44/45/458364445.db2.gz	BGMKXKSMSPDZJU-OAHLLOKOSA-N	0	3	349.434	3.219	20	30		EGEDHN
Cc1ccc(C(=O)NC2CCN(CCc3ccccc3)CC2)cc1C#N	ZINC000376754488	458384517	/nfs/dbraw/zinc/38/45/17/458384517.db2.gz	SEMIKVZWWMCGPZ-UHFFFAOYSA-N	0	3	347.462	3.304	20	30		EGEDHN
CC(C)N1CC[C@@H](N(C)C(=O)N[C@@H]2CCCc3cc(C#N)ccc32)C1	ZINC000419606481	458387325	/nfs/dbraw/zinc/38/73/25/458387325.db2.gz	FYLKOLXAGXEBRF-IEBWSBKVSA-N	0	3	340.471	3.060	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N=c1cc(C)n(C(C)C)[nH]1)C(C)C	ZINC000421181335	458409144	/nfs/dbraw/zinc/40/91/44/458409144.db2.gz	IITLMFHLZMOOIN-KRWDZBQOSA-N	0	3	347.507	3.014	20	30		EGEDHN
COc1ccc(CCNCc2ccc(C#N)c(F)c2)c(OC)c1OC	ZINC000421329536	458410665	/nfs/dbraw/zinc/41/06/65/458410665.db2.gz	VUQZSUZIBNIXOI-UHFFFAOYSA-N	0	3	344.386	3.055	20	30		EGEDHN
C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)NCc1ccc(C#N)s1	ZINC000421348663	458411321	/nfs/dbraw/zinc/41/13/21/458411321.db2.gz	GJBMECZMYDJDSN-LLVKDONJSA-N	0	3	344.396	3.035	20	30		EGEDHN
C[C@H](O)[C@](C)(CNCc1ccc(C#N)c(F)c1)Cc1ccccc1	ZINC000421402731	458413113	/nfs/dbraw/zinc/41/31/13/458413113.db2.gz	WMZJIDAHZPEJSC-YWZLYKJASA-N	0	3	326.415	3.417	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)[C@@]1(C#N)CC12CCCC2)C(C)C	ZINC000448974678	458417403	/nfs/dbraw/zinc/41/74/03/458417403.db2.gz	LUBLYGBDLGXHFI-XLIONFOSSA-N	0	3	329.488	3.275	20	30		EGEDHN
COc1ccc(CN[C@@H]2CCO[C@@H]2C2CC2)cc1OCCCC#N	ZINC000373179426	458420001	/nfs/dbraw/zinc/42/00/01/458420001.db2.gz	ZCQNULAVSXRNIB-VQIMIIECSA-N	0	3	330.428	3.035	20	30		EGEDHN
COc1ccc(CN2CC[C@@H](OC)[C@H](C)C2)cc1OCCCC#N	ZINC000449493987	458425157	/nfs/dbraw/zinc/42/51/57/458425157.db2.gz	FVPFUMQQTWZAEQ-NVXWUHKLSA-N	0	3	332.444	3.235	20	30		EGEDHN
C[C@@H](NC(=O)NCc1ccc(C#N)s1)[C@H](c1ccccc1)N(C)C	ZINC000422213421	458426524	/nfs/dbraw/zinc/42/65/24/458426524.db2.gz	YHUJVJNAFMNDBV-CXAGYDPISA-N	0	3	342.468	3.110	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C[C@H]2CSc3ccccc3O2)CC1	ZINC000449845873	458433554	/nfs/dbraw/zinc/43/35/54/458433554.db2.gz	SVHZJORRVHBZCZ-INIZCTEOSA-N	0	3	346.496	3.087	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)NCC(C)(C)CCC#N	ZINC000376977375	458433851	/nfs/dbraw/zinc/43/38/51/458433851.db2.gz	YUVDJYKGFNEVQF-AEFFLSMTSA-N	0	3	342.487	3.136	20	30		EGEDHN
C[C@H](NCC(=O)NCc1cccc(C#N)c1)c1cccc(C2CC2)c1	ZINC000451115349	458466234	/nfs/dbraw/zinc/46/62/34/458466234.db2.gz	OOHVVCIZRQPFHI-HNNXBMFYSA-N	0	3	333.435	3.403	20	30		EGEDHN
C[C@H](N[C@H](c1ccc(F)c(Cl)c1)C1CC1)C(=O)N(C)CCC#N	ZINC000451351137	458474797	/nfs/dbraw/zinc/47/47/97/458474797.db2.gz	FBHSFNWAXIAGMA-ZBEGNZNMSA-N	0	3	337.826	3.280	20	30		EGEDHN
N[C@H](CC(F)F)C(=O)Nc1ccc(OC(F)F)c(C(F)(F)F)c1	ZINC000423738793	458477561	/nfs/dbraw/zinc/47/75/61/458477561.db2.gz	CABXGLODRJQIKQ-SSDOTTSWSA-N	0	3	348.218	3.228	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC[S@](=O)c1cc(Cl)ccc1Cl	ZINC000451672815	458485540	/nfs/dbraw/zinc/48/55/40/458485540.db2.gz	IVVUUOWYNJIJKW-YPENRWOSSA-N	0	3	348.295	3.424	20	30		EGEDHN
CCOC(=O)[C@H](C)[C@H](C)NCC#Cc1ccc(C(F)(F)F)cc1	ZINC000460352125	458512750	/nfs/dbraw/zinc/51/27/50/458512750.db2.gz	VPGIKJZZAINUBC-OLZOCXBDSA-N	0	3	327.346	3.234	20	30		EGEDHN
C=CCC[C@H](CO)N[C@@H]1CCc2c1cc(Br)cc2F	ZINC000453365291	458524508	/nfs/dbraw/zinc/52/45/08/458524508.db2.gz	RKCWYVOENBQPOJ-IAQYHMDHSA-N	0	3	328.225	3.492	20	30		EGEDHN
CC(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)c2ccccc2C1	ZINC000453375149	458526326	/nfs/dbraw/zinc/52/63/26/458526326.db2.gz	HPFFMOQFOXJEMS-FQEVSTJZSA-N	0	3	337.398	3.280	20	30		EGEDHN
C=C(C)Cn1c(-c2ccccc2)nnc1N1CCCN(C(C)C)CC1	ZINC000453458186	458531692	/nfs/dbraw/zinc/53/16/92/458531692.db2.gz	ZIPWFQJHZFXLJJ-UHFFFAOYSA-N	0	3	339.487	3.442	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1ccc(OC)cc1C)C(C)C	ZINC000460993218	458545505	/nfs/dbraw/zinc/54/55/05/458545505.db2.gz	LZCDNMDVCYFPHK-IBGZPJMESA-N	0	3	330.472	3.432	20	30		EGEDHN
COc1ccc(N(Cc2ccccc2)C(=O)[C@H](N)CCCC#N)cc1	ZINC000424070338	458550725	/nfs/dbraw/zinc/55/07/25/458550725.db2.gz	XHJGWODIUOFDCK-LJQANCHMSA-N	0	3	337.423	3.250	20	30		EGEDHN
Cc1cc(-c2csc(NC(=O)[C@H](N)CCCC#N)n2)ccc1F	ZINC000424082974	458554773	/nfs/dbraw/zinc/55/47/73/458554773.db2.gz	MHYXFFWOXIJPLJ-CYBMUJFWSA-N	0	3	332.404	3.217	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N(Cc1ccccc1)Cc1ccccc1F	ZINC000424100710	458557765	/nfs/dbraw/zinc/55/77/65/458557765.db2.gz	XPPJNLXPTJQBLJ-IBGZPJMESA-N	0	3	339.414	3.376	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1ccc(COCc2ccccc2)cc1	ZINC000424122725	458564049	/nfs/dbraw/zinc/56/40/49/458564049.db2.gz	JREOXMGEHOTBHG-LJQANCHMSA-N	0	3	337.423	3.363	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1cccc(NC(=O)C2CCCCC2)c1	ZINC000424124806	458564567	/nfs/dbraw/zinc/56/45/67/458564567.db2.gz	PNIMYQLUEAOPIK-KRWDZBQOSA-N	0	3	342.443	3.165	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCC[C@@H]2CCc3ccccc32)CC1	ZINC000454555528	458566040	/nfs/dbraw/zinc/56/60/40/458566040.db2.gz	YEZJYNYZLNFFGI-KRWDZBQOSA-N	0	3	327.472	3.056	20	30		EGEDHN
C[C@@H]1c2c(Cl)cc(Cl)cc2CCN1C(=O)[C@@H](N)CCCC#N	ZINC000424153273	458572736	/nfs/dbraw/zinc/57/27/36/458572736.db2.gz	MVTRPBYMNNJAHN-YGRLFVJLSA-N	0	3	340.254	3.460	20	30		EGEDHN
C[C@H](Cc1c(Cl)cccc1Cl)NC(=O)[C@H](N)CCCC#N	ZINC000424172431	458576650	/nfs/dbraw/zinc/57/66/50/458576650.db2.gz	NXTSRCAYISUYRS-QMTHXVAHSA-N	0	3	328.243	3.062	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)NCc1ccc(Sc2ccccc2)cc1	ZINC000424175807	458577687	/nfs/dbraw/zinc/57/76/87/458577687.db2.gz	QSIJKTMOVGFTHA-SFHVURJKSA-N	0	3	339.464	3.475	20	30		EGEDHN
CN(CCNC(=O)C(C)(C)Cc1ccc(C#N)cc1)Cc1ccccc1	ZINC000454946669	458580449	/nfs/dbraw/zinc/58/04/49/458580449.db2.gz	APXCSZJIURRJMO-UHFFFAOYSA-N	0	3	349.478	3.375	20	30		EGEDHN
C=C(CC)CNC(=O)NC[C@H](c1ccc(OC)cc1)N1CCCC1	ZINC000455563509	458604144	/nfs/dbraw/zinc/60/41/44/458604144.db2.gz	UDFIGVUGETVUMH-GOSISDBHSA-N	0	3	331.460	3.098	20	30		EGEDHN
CC(C)C[C@@H](CN1CCCC1)NC(=O)Nc1cnc(C#N)c(Cl)c1	ZINC000455759967	458612546	/nfs/dbraw/zinc/61/25/46/458612546.db2.gz	LUDPLIOLIUSHHC-AWEZNQCLSA-N	0	3	349.866	3.239	20	30		EGEDHN
N#CCCC[C@H](N)c1nc(-c2cccc(CN3CCCCC3)c2)no1	ZINC000424337040	458619740	/nfs/dbraw/zinc/61/97/40/458619740.db2.gz	KMHQSPOBQAXXGK-KRWDZBQOSA-N	0	3	339.443	3.416	20	30		EGEDHN
C=CCC[C@@H](O)CN(CCOC)Cc1cc(Br)cs1	ZINC000494056627	458623024	/nfs/dbraw/zinc/62/30/24/458623024.db2.gz	AQYDEADMCMORSL-CYBMUJFWSA-N	0	3	348.306	3.286	20	30		EGEDHN
Cc1cc(C#N)cc(NC(=O)NC[C@H](Cc2ccccc2)N(C)C)c1	ZINC000455979043	458624656	/nfs/dbraw/zinc/62/46/56/458624656.db2.gz	DBQSKUIJNZLCEV-IBGZPJMESA-N	0	3	336.439	3.161	20	30		EGEDHN
Cc1cc(C)cc(N(CCC#N)C(=O)[C@H](C)N[C@]2(C)CCO[C@@H]2C)c1	ZINC000494277159	458653119	/nfs/dbraw/zinc/65/31/19/458653119.db2.gz	OQRVZFNSKRXAFN-SQGPQFPESA-N	0	3	343.471	3.096	20	30		EGEDHN
CC1(C)[C@H](O)C[C@H]1NCc1cccc(OCc2ccccc2C#N)c1	ZINC000494429287	458674663	/nfs/dbraw/zinc/67/46/63/458674663.db2.gz	WSKYDZDNULOXAP-WOJBJXKFSA-N	0	3	336.435	3.386	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)N[C@@H](C)CN1CCC[C@H](C)C1	ZINC000463518805	458707302	/nfs/dbraw/zinc/70/73/02/458707302.db2.gz	RPIQHNZUKDKPPE-HOTGVXAUSA-N	0	3	346.471	3.110	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)NCc1ccc(F)cc1)C(C)C	ZINC000503433200	458708399	/nfs/dbraw/zinc/70/83/99/458708399.db2.gz	BJRBJTHIGBGVLN-GOSISDBHSA-N	0	3	333.451	3.324	20	30		EGEDHN
C=C[C@@H]1CCCCN1C(=O)NCC1(N2CCSCC2)CCCC1	ZINC000494680931	458727243	/nfs/dbraw/zinc/72/72/43/458727243.db2.gz	JLBSKAWVNQNVPH-MRXNPFEDSA-N	0	3	337.533	3.098	20	30		EGEDHN
CC(C)CN1CCCC[C@@H]1CNC(=O)CSc1ccc(C#N)cc1	ZINC000439693830	458741372	/nfs/dbraw/zinc/74/13/72/458741372.db2.gz	HLMHCXBPRKMVOE-QGZVFWFLSA-N	0	3	345.512	3.277	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1SCC[C@H](C)F	ZINC000505455802	458743463	/nfs/dbraw/zinc/74/34/63/458743463.db2.gz	QPOLLHRTXYMNOJ-AWEZNQCLSA-N	0	3	326.485	3.333	20	30		EGEDHN
C=CCn1c(-c2sccc2C)nnc1N1CCN(C)[C@@H](C(C)C)C1	ZINC000508897322	458766895	/nfs/dbraw/zinc/76/68/95/458766895.db2.gz	WSFVKRJPODNNNN-OAHLLOKOSA-N	0	3	345.516	3.277	20	30		EGEDHN
C=CCSCCNC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000509201927	458769824	/nfs/dbraw/zinc/76/98/24/458769824.db2.gz	GKIRRXOTOVNXHR-SFHVURJKSA-N	0	3	347.528	3.212	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NC[C@H](CO)C1CCCCC1	ZINC000509887822	458773727	/nfs/dbraw/zinc/77/37/27/458773727.db2.gz	ZCTYBZPXZDRVSQ-RBUKOAKNSA-N	0	3	328.456	3.064	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)CN1CCC[C@@](C)(c2ccccc2)CC1	ZINC000510079915	458774361	/nfs/dbraw/zinc/77/43/61/458774361.db2.gz	QYONQUQHHWLSRZ-NHCUHLMSSA-N	0	3	341.499	3.485	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)C(=O)NC[C@@H]1CCCN1CCC	ZINC000511918718	458780629	/nfs/dbraw/zinc/78/06/29/458780629.db2.gz	HTERNYNQDFRFIF-SFHVURJKSA-N	0	3	345.487	3.267	20	30		EGEDHN
CCC[C@]1(NCC#Cc2ccc(OC(F)(F)F)cc2)CCOC1	ZINC000512280846	458783875	/nfs/dbraw/zinc/78/38/75/458783875.db2.gz	XYLLPQQHLGYJRQ-INIZCTEOSA-N	0	3	327.346	3.486	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CCS[C@H](C)CC1)C(C)C	ZINC000495050373	458788821	/nfs/dbraw/zinc/78/88/21/458788821.db2.gz	URVISIKADVCXOB-IAGOWNOFSA-N	0	3	339.549	3.222	20	30		EGEDHN
Cc1nc(CNC(=O)OC(C)(C)C)ccc1[C@H](C)NCCCC#N	ZINC000495177575	458805781	/nfs/dbraw/zinc/80/57/81/458805781.db2.gz	ZLSMVDSFYMEYSR-ZDUSSCGKSA-N	0	3	332.448	3.369	20	30		EGEDHN
CC(C)CC[C@H]1CCCCN1CC(=O)NCc1ccc(C#N)cc1	ZINC000472827373	458810393	/nfs/dbraw/zinc/81/03/93/458810393.db2.gz	OLSJQWSQPNCCTL-LJQANCHMSA-N	0	3	327.472	3.465	20	30		EGEDHN
C[C@H]1[C@@H](Nc2ccc(Cl)c(C#N)n2)CCN1Cc1ccccc1	ZINC000516506421	458818594	/nfs/dbraw/zinc/81/85/94/458818594.db2.gz	CWYGCGWOZQBRLW-BBRMVZONSA-N	0	3	326.831	3.103	20	30		EGEDHN
COc1cc(CNC[C@H](C)N2CCc3ccccc3C2)ccc1C#N	ZINC000440807624	458855502	/nfs/dbraw/zinc/85/55/02/458855502.db2.gz	OQMMKYDWAWWWCT-INIZCTEOSA-N	0	3	335.451	3.103	20	30		EGEDHN
C=C(C)Cn1c(-c2ccccc2)nnc1N1CCN(C)[C@@H](C(C)C)C1	ZINC000549271253	458879572	/nfs/dbraw/zinc/87/95/72/458879572.db2.gz	CEFZGCLRTKCWGS-GOSISDBHSA-N	0	3	339.487	3.298	20	30		EGEDHN
C[C@@H]1CN(Cc2cn(CCC#N)nc2-c2ccncc2)C[C@@H](C)S1	ZINC000518671369	458884563	/nfs/dbraw/zinc/88/45/63/458884563.db2.gz	OMIAUUFHIUGZQR-HUUCEWRRSA-N	0	3	341.484	3.185	20	30		EGEDHN
CC1(C)CCCN(C(=O)[C@H]2CCN(Cc3ccccc3)C2)[C@@H]1C#N	ZINC000553578698	458895940	/nfs/dbraw/zinc/89/59/40/458895940.db2.gz	VUGORMKCOILJLF-ZWKOTPCHSA-N	0	3	325.456	3.049	20	30		EGEDHN
CCN1CCCN(C(=O)c2ccc(C#Cc3ccccc3)cc2)CC1	ZINC000554283581	458897855	/nfs/dbraw/zinc/89/78/55/458897855.db2.gz	PUWDJWUOUARIIR-UHFFFAOYSA-N	0	3	332.447	3.254	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@@H](CCNC[C@H](C#N)CCC#N)C1	ZINC000495645691	458907711	/nfs/dbraw/zinc/90/77/11/458907711.db2.gz	UNCYRSJDSATVLX-HOTGVXAUSA-N	0	3	334.464	3.057	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@]1(C)CCN(Cc2ccc(CC#N)cc2)C1	ZINC000495658087	458910565	/nfs/dbraw/zinc/91/05/65/458910565.db2.gz	NOAONVDMPZDUOD-FQEVSTJZSA-N	0	3	343.471	3.489	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)CN(C[C@H]1CCCO1)C1CCC(C)CC1	ZINC000441469145	458950300	/nfs/dbraw/zinc/95/03/00/458950300.db2.gz	XCPJCVPNYNYDOP-SMRJSYMMSA-N	0	3	349.519	3.101	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000457453658	458962809	/nfs/dbraw/zinc/96/28/09/458962809.db2.gz	SMGNHTBOUPCWCW-UFYCRDLUSA-N	0	3	342.483	3.139	20	30		EGEDHN
N#CC1(CCN2CCC[C@H](c3nnc4n3CCC4)C2)CCCCC1	ZINC000556811692	459013781	/nfs/dbraw/zinc/01/37/81/459013781.db2.gz	VAYXAHZXZOFFDY-INIZCTEOSA-N	0	3	327.476	3.268	20	30		EGEDHN
N#C[C@H]1CC[C@H](NCc2ccc(OCCOc3ccccc3)nc2)C1	ZINC000442721778	459026577	/nfs/dbraw/zinc/02/65/77/459026577.db2.gz	ULVLFPSPBNHCFO-WMZOPIPTSA-N	0	3	337.423	3.321	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H]2CN(Cc3cccc(C#N)c3)C[C@H]2C1	ZINC000496027730	459041945	/nfs/dbraw/zinc/04/19/45/459041945.db2.gz	IXIOBKYTPBOIRV-ROUUACIJSA-N	0	3	341.455	3.247	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)[C@H]1COc2ccccc2C1)C(C)C	ZINC000496029668	459042816	/nfs/dbraw/zinc/04/28/16/459042816.db2.gz	RQEPOAJZLHDIMO-RTBURBONSA-N	0	3	342.483	3.053	20	30		EGEDHN
C[C@H](CNC(=O)c1ccc(C#Cc2ccccc2)cc1)N(C)C1CC1	ZINC000589965744	459058875	/nfs/dbraw/zinc/05/88/75/459058875.db2.gz	OZTDAHHYELLIMH-QGZVFWFLSA-N	0	3	332.447	3.299	20	30		EGEDHN
CC1(C)c2ccccc2CCN1C[C@H](O)COc1ccc(C#N)cc1	ZINC000557342240	459065581	/nfs/dbraw/zinc/06/55/81/459065581.db2.gz	NOZMOJAKKAVVMB-SFHVURJKSA-N	0	3	336.435	3.091	20	30		EGEDHN
N#Cc1ccc(N2CCC(NCc3noc4ccccc34)CC2)cc1	ZINC000594521836	459078588	/nfs/dbraw/zinc/07/85/88/459078588.db2.gz	UUVSDUUDSNFABK-UHFFFAOYSA-N	0	3	332.407	3.458	20	30		EGEDHN
Cc1csc(NC(=O)NC[C@H](c2ccccc2)N(C)C)c1C#N	ZINC000577765739	459092051	/nfs/dbraw/zinc/09/20/51/459092051.db2.gz	KZLFNJSQGCBDHA-OAHLLOKOSA-N	0	3	328.441	3.353	20	30		EGEDHN
CO[C@H](C)c1nc(CN2CCCN([C@@H]3CC[C@H](C#N)C3)CC2)cs1	ZINC000590161289	459095392	/nfs/dbraw/zinc/09/53/92/459095392.db2.gz	SODBCHSYFCAKOQ-HLLBOEOZSA-N	0	3	348.516	3.050	20	30		EGEDHN
Cc1ccc(Cl)c(OC[C@H](O)CNCc2ccc(C#N)c(F)c2)c1	ZINC000520797166	459095709	/nfs/dbraw/zinc/09/57/09/459095709.db2.gz	APNYNPBWLJSRCE-OAHLLOKOSA-N	0	3	348.805	3.189	20	30		EGEDHN
C[C@H](C(=O)Nc1cccc(C#N)c1)N1CC[C@@H](Cc2ccccc2)C1	ZINC000532971121	459167970	/nfs/dbraw/zinc/16/79/70/459167970.db2.gz	ACLOUUKIVKVZIK-APWZRJJASA-N	0	3	333.435	3.450	20	30		EGEDHN
CC(C)OC1CCN(CCC(=O)Nc2ccc(C#N)c(Cl)c2)CC1	ZINC000533017135	459175489	/nfs/dbraw/zinc/17/54/89/459175489.db2.gz	FVTQCGHQXBFVRR-UHFFFAOYSA-N	0	3	349.862	3.430	20	30		EGEDHN
N#CC(C(=O)c1cnn2c1CCC2)c1nc2ccccc2n1C(F)F	ZINC000521973380	459197534	/nfs/dbraw/zinc/19/75/34/459197534.db2.gz	AURVFPCUGCBORL-JTQLQIEISA-N	0	3	341.321	3.064	20	30		EGEDHN
C=CCCS(=O)(=O)NC[C@H](CC(C)C)N[C@@H](C)c1ccccc1	ZINC000480975884	459226170	/nfs/dbraw/zinc/22/61/70/459226170.db2.gz	CVTDARNXNHIEBV-WMZOPIPTSA-N	0	3	338.517	3.247	20	30		EGEDHN
C=C(C)Cn1c(CC2CCCCC2)nnc1N1CCN2CCC[C@H]2C1	ZINC000558984429	459227757	/nfs/dbraw/zinc/22/77/57/459227757.db2.gz	VCYBLRQIXQSFBJ-SFHVURJKSA-N	0	3	343.519	3.261	20	30		EGEDHN
C=CCCSCCN[C@H](C)c1ccc(S(C)(=O)=O)c(OC)c1	ZINC000595058290	459230880	/nfs/dbraw/zinc/23/08/80/459230880.db2.gz	GSNRUVBWWAUBIC-CYBMUJFWSA-N	0	3	343.514	3.059	20	30		EGEDHN
CC(C)C[C@@H](CN1CCCC1)NC(=O)NCc1ccc(C#N)cc1F	ZINC000590829872	459236665	/nfs/dbraw/zinc/23/66/65/459236665.db2.gz	FGOJBLHNHBGKBA-KRWDZBQOSA-N	0	3	346.450	3.007	20	30		EGEDHN
N#CCC[C@H](C#N)CNc1ccc(CCN2CCSCC2)cc1	ZINC000579337698	459245221	/nfs/dbraw/zinc/24/52/21/459245221.db2.gz	VABIMRUHKPLVNY-QGZVFWFLSA-N	0	3	328.485	3.133	20	30		EGEDHN
COc1cccc2c1CN(C(=O)C(C#N)CCc1ccccc1)CC2	ZINC000590876621	459254930	/nfs/dbraw/zinc/25/49/30/459254930.db2.gz	BITMMPIQAXIOHS-SFHVURJKSA-N	0	3	334.419	3.352	20	30		EGEDHN
C[C@H]1C[C@@H](NC2CCN(Cc3ccc(C#N)cc3)CC2)c2nccn21	ZINC000568355103	459272565	/nfs/dbraw/zinc/27/25/65/459272565.db2.gz	ORWWRXSSCJRHEQ-HNAYVOBHSA-N	0	3	335.455	3.015	20	30		EGEDHN
C=CCCCCN1CC[C@@H](OC)C[C@H]1CNC(=O)OC(C)(C)C	ZINC000496676022	459282411	/nfs/dbraw/zinc/28/24/11/459282411.db2.gz	BAYZXTHDRSTWBQ-JKSUJKDBSA-N	0	3	326.481	3.347	20	30		EGEDHN
C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NCc1ccc(F)cc1C#N	ZINC000496776193	459319733	/nfs/dbraw/zinc/31/97/33/459319733.db2.gz	NVBNKQZWGQKVKP-CXAGYDPISA-N	0	3	347.434	3.432	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(Cc2ccccn2)C(C)C)CC1	ZINC000534346538	459319667	/nfs/dbraw/zinc/31/96/67/459319667.db2.gz	OIUBOZBDGHZSRC-UHFFFAOYSA-N	0	3	330.476	3.042	20	30		EGEDHN
CC#CCCNC(=O)NC[C@@H](c1ccccc1)N1CCC(C)CC1	ZINC000482891280	459329831	/nfs/dbraw/zinc/32/98/31/459329831.db2.gz	PSLRPELALLKXFG-IBGZPJMESA-N	0	3	327.472	3.172	20	30		EGEDHN
C[C@H](NC1CCN(CC#N)CC1)c1csc(-c2ccccc2)n1	ZINC000591239043	459339541	/nfs/dbraw/zinc/33/95/41/459339541.db2.gz	MGZLVTVKUFYVAL-AWEZNQCLSA-N	0	3	326.469	3.449	20	30		EGEDHN
CCCOc1ccc(C(C)(C)NCC(=O)N[C@@](C)(C#N)C(C)C)cc1	ZINC000483274972	459356895	/nfs/dbraw/zinc/35/68/95/459356895.db2.gz	ZXVVBLYLQIMDTE-FQEVSTJZSA-N	0	3	345.487	3.355	20	30		EGEDHN
N#CC[C@@H]1CCCN(C[C@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000595613783	459369023	/nfs/dbraw/zinc/36/90/23/459369023.db2.gz	HIZDXCLXTCTCNJ-ZFWWWQNUSA-N	0	3	342.361	3.071	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@H](CN[C@@H]1CCc2ccc(C#N)cc21)C1CC1	ZINC000496983875	459395395	/nfs/dbraw/zinc/39/53/95/459395395.db2.gz	ZURIUZXCSNXUDU-MSOLQXFVSA-N	0	3	341.455	3.438	20	30		EGEDHN
C[C@H](NC1CCN(c2ccc(C#N)cn2)CC1)c1ccncc1Cl	ZINC000591531630	459396845	/nfs/dbraw/zinc/39/68/45/459396845.db2.gz	TZULVRRKOMOASG-ZDUSSCGKSA-N	0	3	341.846	3.321	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](O)CO[C@@H]2CCCc3ccccc32)cc1	ZINC000591725162	459425617	/nfs/dbraw/zinc/42/56/17/459425617.db2.gz	DTFQVZXMINMMCF-PZJWPPBQSA-N	0	3	336.435	3.103	20	30		EGEDHN
CC(C)C[C@@H](NC[C@@H](O)CN(C)CCC#N)c1ccc(Cl)cc1	ZINC000591742311	459428554	/nfs/dbraw/zinc/42/85/54/459428554.db2.gz	JHGCCPCMYKHWIC-QZTJIDSGSA-N	0	3	337.895	3.223	20	30		EGEDHN
N#Cc1ccc2c(c1)CC[C@@H]2NC[C@H](O)COc1cccc2[nH]ccc21	ZINC000591764356	459431405	/nfs/dbraw/zinc/43/14/05/459431405.db2.gz	HBJGSKASJKZYJX-JXFKEZNVSA-N	0	3	347.418	3.056	20	30		EGEDHN
C[C@H](CN1CCC(C)CC1)NC(=O)N(C)[C@H](C)c1cccc(C#N)c1	ZINC000595786002	459439504	/nfs/dbraw/zinc/43/95/04/459439504.db2.gz	OUNMFAZYAAFJNE-IAGOWNOFSA-N	0	3	342.487	3.381	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N1CCOC2(CCCC2)C1)C(C)C	ZINC000485566806	459460188	/nfs/dbraw/zinc/46/01/88/459460188.db2.gz	WMVZAROJWJJZRH-SFHVURJKSA-N	0	3	349.519	3.040	20	30		EGEDHN
C=CCn1c(-c2ccccc2)nnc1N1C[C@@H](C)N(CC)C[C@@H]1C	ZINC000569511419	459464023	/nfs/dbraw/zinc/46/40/23/459464023.db2.gz	ZDTQXFMQKVUWSW-CVEARBPZSA-N	0	3	325.460	3.050	20	30		EGEDHN
C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NCc1cccc(C#N)c1F	ZINC000497172714	459472231	/nfs/dbraw/zinc/47/22/31/459472231.db2.gz	NLGIVBIBPSXEST-CJNGLKHVSA-N	0	3	347.434	3.432	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@@H](Nc2nc(C#N)c(Cl)s2)C1	ZINC000596088599	459516335	/nfs/dbraw/zinc/51/63/35/459516335.db2.gz	LNBQHCCUJURTQA-DGCLKSJQSA-N	0	3	332.860	3.337	20	30		EGEDHN
N#CCC1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)CC1	ZINC000541978549	459516764	/nfs/dbraw/zinc/51/67/64/459516764.db2.gz	TVFRWQBXFWFWRV-UHFFFAOYSA-N	0	3	325.456	3.051	20	30		EGEDHN
N#Cc1nc(NC[C@H]2CCCN(Cc3ccccc3)C2)sc1Cl	ZINC000596091998	459517374	/nfs/dbraw/zinc/51/73/74/459517374.db2.gz	HCVZANNDAHVBKM-CQSZACIVSA-N	0	3	346.887	3.414	20	30		EGEDHN
CC(C)[C@H]1CN(c2c(C#N)cnc3c(F)cc(F)cc32)CCN1C	ZINC000487105395	459526139	/nfs/dbraw/zinc/52/61/39/459526139.db2.gz	UTJJMWBGMKEZCG-MRXNPFEDSA-N	0	3	330.382	3.161	20	30		EGEDHN
C=CCN(CCc1ccco1)C(=O)N[C@@H](C)CN1CCC[C@H](C)C1	ZINC000497368336	459529331	/nfs/dbraw/zinc/52/93/31/459529331.db2.gz	LDUAKRPAWSFRRE-IRXDYDNUSA-N	0	3	333.476	3.140	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@H](CC)N1CCc2ccccc2C1	ZINC000488386238	459543398	/nfs/dbraw/zinc/54/33/98/459543398.db2.gz	LKLWWNGFURRPEV-IBGZPJMESA-N	0	3	337.467	3.241	20	30		EGEDHN
C=CC1CCN(C[C@H](O)COc2ccccc2C(F)(F)F)CC1	ZINC000542281088	459544195	/nfs/dbraw/zinc/54/41/95/459544195.db2.gz	UVZQNASAMSDWFU-AWEZNQCLSA-N	0	3	329.362	3.343	20	30		EGEDHN
COc1ccc(CN2CCN(C)[C@@H](C(C)C)C2)cc1OCCCC#N	ZINC000488540712	459545920	/nfs/dbraw/zinc/54/59/20/459545920.db2.gz	HCCNOMWYJDIEPL-GOSISDBHSA-N	0	3	345.487	3.150	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1	ZINC000488737835	459550685	/nfs/dbraw/zinc/55/06/85/459550685.db2.gz	SQYVTSGYTSOOSW-GOSISDBHSA-N	0	3	337.467	3.411	20	30		EGEDHN
CC(C)[C@@H](NC(=O)C(C#N)CCc1ccccc1)C1(CO)CCC1	ZINC000571579280	459570008	/nfs/dbraw/zinc/57/00/08/459570008.db2.gz	DEYPJCHWZNDSML-QZTJIDSGSA-N	0	3	328.456	3.062	20	30		EGEDHN
COCCOc1ccc(CNCc2ccc(CC#N)cc2)cc1OC	ZINC000583693020	459581699	/nfs/dbraw/zinc/58/16/99/459581699.db2.gz	UUBRZVTVOOWIGG-UHFFFAOYSA-N	0	3	340.423	3.076	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1)C(=O)/C=C\c1ccc(C#N)cc1	ZINC000490919986	459590239	/nfs/dbraw/zinc/59/02/39/459590239.db2.gz	USBNXQUUCUTSKX-SEYXRHQNSA-N	0	3	333.435	3.162	20	30		EGEDHN
C[C@H]1C[C@H](Nc2c(C#N)cnc3ccc(Cl)cc32)CN1C1CC1	ZINC000583845062	459604831	/nfs/dbraw/zinc/60/48/31/459604831.db2.gz	ULHLZHRURMHCJD-FZMZJTMJSA-N	0	3	326.831	3.219	20	30		EGEDHN
C#CCN(C)CCCNC(=O)NC(c1cccs1)c1cccs1	ZINC000491256033	459609747	/nfs/dbraw/zinc/60/97/47/459609747.db2.gz	YZMRTEHXLIMSHO-UHFFFAOYSA-N	0	3	347.509	3.153	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)[C@]2(C#N)CC23CCCC3)N(C)C)cc1	ZINC000573069586	459619863	/nfs/dbraw/zinc/61/98/63/459619863.db2.gz	ORFADVKFGAAKRR-WIYYLYMNSA-N	0	3	339.483	3.442	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCc2cc3ccccc3o2)cc1	ZINC000527321641	459627969	/nfs/dbraw/zinc/62/79/69/459627969.db2.gz	QEAHZERRNYPJJT-QGZVFWFLSA-N	0	3	329.359	3.303	20	30		EGEDHN
Cc1ccccc1[C@H]([C@@H](C)NC(=O)N1CCC[C@@H](CC#N)C1)N(C)C	ZINC000596598677	459692767	/nfs/dbraw/zinc/69/27/67/459692767.db2.gz	KRXWNGVOBXLRKG-AOIWGVFYSA-N	0	3	342.487	3.322	20	30		EGEDHN
N#CC1CCC(CNCc2ncc(Br)cc2F)CC1	ZINC000527703140	459707226	/nfs/dbraw/zinc/70/72/26/459707226.db2.gz	LUHDNTNZUZFHOJ-UHFFFAOYSA-N	0	3	326.213	3.403	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NC(=O)N[C@@H](C)[C@H](c1ccccc1C)N(C)C	ZINC000563064671	459708220	/nfs/dbraw/zinc/70/82/20/459708220.db2.gz	UDVOAHBFQZLXPH-WZGPROSRSA-N	0	3	345.487	3.019	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N[C@H](CCO)c1ccccc1F	ZINC000592879445	459710507	/nfs/dbraw/zinc/71/05/07/459710507.db2.gz	AWXVOLKZTIUMPN-VQIMIIECSA-N	0	3	340.398	3.138	20	30		EGEDHN
C=CCN(CC=C)C(=O)NC[C@@H](CC)N1CCc2ccccc2C1	ZINC000501387510	459725554	/nfs/dbraw/zinc/72/55/54/459725554.db2.gz	NWLSAEMMJGAZGY-LJQANCHMSA-N	0	3	327.472	3.207	20	30		EGEDHN
CC(C)(C)N1CC[C@@H](NC(=O)N(Cc2ccc(C#N)cc2)C2CC2)C1	ZINC000596681441	459725653	/nfs/dbraw/zinc/72/56/53/459725653.db2.gz	USQYCNUCIKUJCY-QGZVFWFLSA-N	0	3	340.471	3.105	20	30		EGEDHN
C[C@@H]1C[C@@H](c2ccccc2)[C@H](C)N1Cc1cnc2c(C#N)cnn2c1	ZINC000573802477	459738099	/nfs/dbraw/zinc/73/80/99/459738099.db2.gz	JRRPNEAGUUPUAR-ZRGWGRIASA-N	0	3	331.423	3.367	20	30		EGEDHN
CN(C)CCN(Cc1ccsc1)C(=O)/C=C\c1ccc(C#N)cc1	ZINC000493496753	459747199	/nfs/dbraw/zinc/74/71/99/459747199.db2.gz	OYLPQNJWSCVJGW-FPLPWBNLSA-N	0	3	339.464	3.223	20	30		EGEDHN
COC[C@@H](NCC(=O)Nc1ccccc1SC[C@H](C)C#N)C(C)C	ZINC000544414207	459757950	/nfs/dbraw/zinc/75/79/50/459757950.db2.gz	CYRIRPUNMABGSR-GDBMZVCRSA-N	0	3	349.500	3.137	20	30		EGEDHN
C[C@H](C#N)CSc1ccccc1NC(=O)CNC1(C2CC2)CC1	ZINC000544415082	459758747	/nfs/dbraw/zinc/75/87/47/459758747.db2.gz	GPRYUVAOXNPVCM-CYBMUJFWSA-N	0	3	329.469	3.409	20	30		EGEDHN
C[C@@H](NC1(C2CCC2)CC1)C(=O)N(CCC#N)c1ccc(F)cc1	ZINC000593080377	459767157	/nfs/dbraw/zinc/76/71/57/459767157.db2.gz	MJMMMFKCJICEED-CQSZACIVSA-N	0	3	329.419	3.383	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N[C@H]1CCO[C@@H](c2ccncc2)C1	ZINC000564637049	459775245	/nfs/dbraw/zinc/77/52/45/459775245.db2.gz	DWRHEOOHFYKDPG-SLFFLAALSA-N	0	3	349.434	3.190	20	30		EGEDHN
CC(C)Oc1ccc([C@@H](CNC[C@H](C#N)CCC#N)N(C)C)cc1	ZINC000564868900	459777884	/nfs/dbraw/zinc/77/78/84/459777884.db2.gz	KGKASTXYBYBPTR-QFBILLFUSA-N	0	3	328.460	3.110	20	30		EGEDHN
C[C@@H](C(=O)NC1(C#N)CCC1)N1CCC[C@@H](c2ccc(F)cc2)CC1	ZINC000565456366	459784843	/nfs/dbraw/zinc/78/48/43/459784843.db2.gz	TUDWRFPNRQTEGG-JKSUJKDBSA-N	0	3	343.446	3.346	20	30		EGEDHN
C[C@H]1CC[C@H](N(CC#Cc2ccc(OC(F)(F)F)cc2)CCO)C1	ZINC000565919523	459789712	/nfs/dbraw/zinc/78/97/12/459789712.db2.gz	DBICXAZVCBGXST-HOCLYGCPSA-N	0	3	341.373	3.420	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H]2CC[C@H]2c2ccc(F)cc2)CC1	ZINC000528446609	459807547	/nfs/dbraw/zinc/80/75/47/459807547.db2.gz	BMGRTKJQLWWQPD-RBUKOAKNSA-N	0	3	330.447	3.476	20	30		EGEDHN
CN(CCOCc1ccc(C#N)cc1)CCOc1ccc(F)cc1	ZINC000574434971	459818608	/nfs/dbraw/zinc/81/86/08/459818608.db2.gz	MUUVAVWLLXYQHV-UHFFFAOYSA-N	0	3	328.387	3.225	20	30		EGEDHN
C[C@H](NC[C@H]1CNc2c(C#N)cnn2C1)c1cc2cccc(F)c2o1	ZINC000566243268	459828015	/nfs/dbraw/zinc/82/80/15/459828015.db2.gz	RSEOTPOAEGDHAX-RYUDHWBXSA-N	0	3	339.374	3.033	20	30		EGEDHN
CCOC(=O)COc1ccc(CN2CCC(CCC#N)CC2)cc1	ZINC000566248054	459829286	/nfs/dbraw/zinc/82/92/86/459829286.db2.gz	JSLHWWQPBKIQPH-UHFFFAOYSA-N	0	3	330.428	3.144	20	30		EGEDHN
CC[C@H](NC1CCN(c2ccc(C#N)cn2)CC1)c1ccc(F)cn1	ZINC000585794082	459848510	/nfs/dbraw/zinc/84/85/10/459848510.db2.gz	BPGVFOLQDVPLAD-KRWDZBQOSA-N	0	3	339.418	3.197	20	30		EGEDHN
CN(C(=O)[C@H]1CCN(Cc2ccccc2)C1)c1ccc(C#N)cc1F	ZINC000602253594	459878549	/nfs/dbraw/zinc/87/85/49/459878549.db2.gz	LRBBMKJQGPBVQM-KRWDZBQOSA-N	0	3	337.398	3.182	20	30		EGEDHN
CC(C)N(CCC#N)C(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000608814390	459885703	/nfs/dbraw/zinc/88/57/03/459885703.db2.gz	RUTDQEJZJZJDJK-QGZVFWFLSA-N	0	3	331.435	3.188	20	30		EGEDHN
N#C[C@H]1CC[C@@H](NC[C@@H](O)COc2ccc(-c3ccccc3)cc2)C1	ZINC000575053248	459917534	/nfs/dbraw/zinc/91/75/34/459917534.db2.gz	DDZSTVVAKZIIHD-PWIZWCRZSA-N	0	3	336.435	3.375	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN1CCCc2sccc2C1	ZINC000609322791	459943341	/nfs/dbraw/zinc/94/33/41/459943341.db2.gz	LLJTWPVQZFRLLU-UHFFFAOYSA-N	0	3	331.466	3.458	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN1CC[C@H](OCCCc2ccccc2)C1	ZINC000598591748	459955150	/nfs/dbraw/zinc/95/51/50/459955150.db2.gz	AZZMMYDQYJKUNN-MOPGFXCFSA-N	0	3	330.472	3.011	20	30		EGEDHN
COc1cc([C@H](C)NC[C@@H](O)CC(C)(C)C#N)ccc1OC(C)C	ZINC000598599515	459959282	/nfs/dbraw/zinc/95/92/82/459959282.db2.gz	BVMVTBDPDDBFDC-HOCLYGCPSA-N	0	3	334.460	3.434	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN1CCC(OCc2ccccc2F)CC1	ZINC000598601137	459959351	/nfs/dbraw/zinc/95/93/51/459959351.db2.gz	QRQGWBLJJQKISA-INIZCTEOSA-N	0	3	334.435	3.107	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000598616605	459965669	/nfs/dbraw/zinc/96/56/69/459965669.db2.gz	NIAHYGVWCYPAHW-HNNXBMFYSA-N	0	3	335.879	3.153	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN(Cc1ccccc1)[C@@H]1COC(C)(C)C1	ZINC000598626033	459968216	/nfs/dbraw/zinc/96/82/16/459968216.db2.gz	XPKDTBDEBVRSNB-ROUUACIJSA-N	0	3	330.472	3.357	20	30		EGEDHN
C[C@H](NC(=O)N1CCC[C@](C)(C#N)C1)[C@@H](c1ccccc1)N(C)C	ZINC000588721189	459975462	/nfs/dbraw/zinc/97/54/62/459975462.db2.gz	XXJRRPSLRIYVEP-VDZJLULYSA-N	0	3	328.460	3.013	20	30		EGEDHN
CCC(=O)Nc1cccc(CN[C@@H](C)CC2(C#N)CCOCC2)c1	ZINC000602516390	459978600	/nfs/dbraw/zinc/97/86/00/459978600.db2.gz	KNWXIDLPFBBOIY-HNNXBMFYSA-N	0	3	329.444	3.224	20	30		EGEDHN
C[C@@H](NCC1(c2ccccc2)CCCCC1)C(=O)N(C)CCC#N	ZINC000609574369	459984805	/nfs/dbraw/zinc/98/48/05/459984805.db2.gz	NCSZBWZBPCSGFC-QGZVFWFLSA-N	0	3	327.472	3.239	20	30		EGEDHN
N#Cc1cccc(CNCC2(c3ccccc3Cl)CCOCC2)n1	ZINC000602537632	459987987	/nfs/dbraw/zinc/98/79/87/459987987.db2.gz	ACDFPDPSUNQDDW-UHFFFAOYSA-N	0	3	341.842	3.445	20	30		EGEDHN
CC[C@H](NCc1cccc(C#N)n1)[C@H](c1ccc(C)cc1)n1cncn1	ZINC000602576135	460004166	/nfs/dbraw/zinc/00/41/66/460004166.db2.gz	MQAMBAHFEDHGBH-PMACEKPBSA-N	0	3	346.438	3.011	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CNCc1cccc(NC(=O)C2CCCC2)c1	ZINC000598718368	460004731	/nfs/dbraw/zinc/00/47/31/460004731.db2.gz	AKSZVMDHQJTLNE-GOSISDBHSA-N	0	3	343.471	3.206	20	30		EGEDHN
CC(C)(C)OC(=O)c1cccc(CNC[C@H](O)CC(C)(C)C#N)c1	ZINC000598722926	460005867	/nfs/dbraw/zinc/00/58/67/460005867.db2.gz	BSNSXJLJJINFSO-MRXNPFEDSA-N	0	3	332.444	3.032	20	30		EGEDHN
O=C(c1ccc(C#Cc2ccccc2)cc1)N1CC[C@H](N2CCCC2)C1	ZINC000589140413	460037547	/nfs/dbraw/zinc/03/75/47/460037547.db2.gz	IGYQTEBGCWOCOR-QFIPXVFZSA-N	0	3	344.458	3.397	20	30		EGEDHN
Cc1cc(CNCc2cccc(OCc3cccc(C#N)c3)c2)n[nH]1	ZINC000610010163	460050522	/nfs/dbraw/zinc/05/05/22/460050522.db2.gz	ZZKDTINNNBKHNW-UHFFFAOYSA-N	0	3	332.407	3.459	20	30		EGEDHN
C[C@H](CCC#N)CN1CCN(c2cc(-c3ccc(C#N)cc3)[nH]n2)CC1	ZINC000602710376	460078067	/nfs/dbraw/zinc/07/80/67/460078067.db2.gz	UDSXQONHDDJHOF-MRXNPFEDSA-N	0	3	348.454	3.010	20	30		EGEDHN
N#Cc1ccccc1OC1CCC(NCc2ccc(CO)o2)CC1	ZINC000610270976	460100568	/nfs/dbraw/zinc/10/05/68/460100568.db2.gz	JIBLOZPFDNGXMO-UHFFFAOYSA-N	0	3	326.396	3.123	20	30		EGEDHN
C[C@@H](NC(=O)NCC(C)(C)N1CCCCC1)c1cccc(C#N)c1	ZINC000610346345	460127449	/nfs/dbraw/zinc/12/74/49/460127449.db2.gz	AXBHDWKIBJEUDI-OAHLLOKOSA-N	0	3	328.460	3.183	20	30		EGEDHN
CC[C@@H](NCc1cccc(NC(=O)COC)c1)c1ccc(C#N)cc1	ZINC000576427674	460138851	/nfs/dbraw/zinc/13/88/51/460138851.db2.gz	JHSZOHOVJCKHQM-LJQANCHMSA-N	0	3	337.423	3.384	20	30		EGEDHN
C[C@@H](CC#N)Sc1ccccc1NC(=O)NCC1(N(C)C)CC1	ZINC000602843192	460155851	/nfs/dbraw/zinc/15/58/51/460155851.db2.gz	WDUYXQOKYZUTHI-ZDUSSCGKSA-N	0	3	332.473	3.297	20	30		EGEDHN
N#CCC[C@H](NC(=O)N[C@@H]1CCCN2CCCC[C@@H]12)c1ccccc1	ZINC000594228768	460160685	/nfs/dbraw/zinc/16/06/85/460160685.db2.gz	DLOHKPYUZQWOAW-OTWHNJEPSA-N	0	3	340.471	3.348	20	30		EGEDHN
CCC(C)(C)N1CCN(C(=O)NCc2ccc(C#N)c(Cl)c2)CC1	ZINC000594249750	460172028	/nfs/dbraw/zinc/17/20/28/460172028.db2.gz	WCQKMGGKXRGBSB-UHFFFAOYSA-N	0	3	348.878	3.227	20	30		EGEDHN
CN(C)[C@H](CNC(=O)N[C@@H]1CCc2cc(C#N)ccc21)c1ccccc1	ZINC000618795258	460177978	/nfs/dbraw/zinc/17/79/78/460177978.db2.gz	LRVUBWRMIXSTTR-WOJBJXKFSA-N	0	3	348.450	3.148	20	30		EGEDHN
CN(CCc1ccccc1)[C@@H]1CCN(C(=O)c2ccc(C#N)s2)C1	ZINC000598195131	460200066	/nfs/dbraw/zinc/20/00/66/460200066.db2.gz	KYGLYNBXQMIJEM-MRXNPFEDSA-N	0	3	339.464	3.009	20	30		EGEDHN
N#CCc1ccc(OC[C@H](O)CNC2(c3ccccc3)CCC2)cc1	ZINC000610967520	460267507	/nfs/dbraw/zinc/26/75/07/460267507.db2.gz	ZCXJPULWINGZMP-LJQANCHMSA-N	0	3	336.435	3.161	20	30		EGEDHN
C[C@@H]1CN(CCc2ccc(C#N)cc2)CC[C@@H]1C(=O)OC(C)(C)C	ZINC000599585126	460280625	/nfs/dbraw/zinc/28/06/25/460280625.db2.gz	XGVAYAPXCXYHLA-QAPCUYQASA-N	0	3	328.456	3.400	20	30		EGEDHN
CCC[C@@H](C#N)NC(=O)c1ccccc1OCCN1CCCC[C@@H]1C	ZINC000611286024	460328789	/nfs/dbraw/zinc/32/87/89/460328789.db2.gz	AJIVDHGJPZWTAK-IRXDYDNUSA-N	0	3	343.471	3.362	20	30		EGEDHN
C[C@H](N[C@H](CCC#N)c1ccccc1)c1cccc(-n2cnnn2)c1	ZINC000611337083	460339676	/nfs/dbraw/zinc/33/96/76/460339676.db2.gz	VJPLRMGTZZDAFX-HNAYVOBHSA-N	0	3	332.411	3.358	20	30		EGEDHN
CCNC(=O)c1ccc(CN[C@H]2CCCc3cc(C#N)ccc32)cc1	ZINC000611390731	460352389	/nfs/dbraw/zinc/35/23/89/460352389.db2.gz	RBNXUSCAYFWEFS-FQEVSTJZSA-N	0	3	333.435	3.475	20	30		EGEDHN
CN(C[C@@H](O)COc1ccc(CC#N)cc1)[C@H]1CCc2ccccc21	ZINC000599969847	460364916	/nfs/dbraw/zinc/36/49/16/460364916.db2.gz	FSPYLORDWVMIOP-NQIIRXRSSA-N	0	3	336.435	3.112	20	30		EGEDHN
N#CCN1CCC(NCc2cc(Cl)ccc2OCC2CC2)CC1	ZINC000619529889	460376203	/nfs/dbraw/zinc/37/62/03/460376203.db2.gz	XZAMIUZQHGPHHT-UHFFFAOYSA-N	0	3	333.863	3.206	20	30		EGEDHN
C[C@H](NC(=O)c1c(Cl)cc(C#N)cc1Cl)C1=CCN(C)CC1	ZINC000611583093	460409772	/nfs/dbraw/zinc/40/97/72/460409772.db2.gz	RDNWCZSPLQAOED-JTQLQIEISA-N	0	3	338.238	3.245	20	30		EGEDHN
N#Cc1cccnc1OC1CCC(NCc2cnc(C3CC3)o2)CC1	ZINC000600152929	460409859	/nfs/dbraw/zinc/40/98/59/460409859.db2.gz	BMNHGKRPGNSXMD-UHFFFAOYSA-N	0	3	338.411	3.298	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)c(Cl)c1)c1cccc(-n2cnnn2)c1	ZINC000619755152	460432432	/nfs/dbraw/zinc/43/24/32/460432432.db2.gz	UPMSQKFPPUSLKA-GFCCVEGCSA-N	0	3	338.802	3.038	20	30		EGEDHN
C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)NCc1ccc(C#N)c(Cl)c1	ZINC000619759480	460434986	/nfs/dbraw/zinc/43/49/86/460434986.db2.gz	NKGCIOSNXDDZNV-KGLIPLIRSA-N	0	3	348.878	3.131	20	30		EGEDHN
N#CCc1ccccc1C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000601540816	460827830	/nfs/dbraw/zinc/82/78/30/460827830.db2.gz	KSOVLTIZMFADGX-SFHVURJKSA-N	0	3	333.435	3.005	20	30		EGEDHN
C=CCN(C(=O)c1ccc(CN2CCCCC2)cc1)[C@@H](C)COC	ZINC000617575931	460916181	/nfs/dbraw/zinc/91/61/81/460916181.db2.gz	ILURPVLQGGVUOE-KRWDZBQOSA-N	0	3	330.472	3.336	20	30		EGEDHN
C=CCN(C(=O)NC[C@H](N)c1ccc(C(C)C)cc1)[C@@H](C)COC	ZINC000659510905	461369180	/nfs/dbraw/zinc/36/91/80/461369180.db2.gz	CMHXRLWGMPIOPH-YJBOKZPZSA-N	0	3	333.476	3.042	20	30		EGEDHN
C=CC[C@@H]1CCCN(C(=O)NCc2ccc(OCCN(C)C)cc2)C1	ZINC000660385908	461745747	/nfs/dbraw/zinc/74/57/47/461745747.db2.gz	BSCHSJVDDHSLJG-GOSISDBHSA-N	0	3	345.487	3.125	20	30		EGEDHN
C=CCN(CCC(=O)N[C@@H]1CCCc2ccccc21)[C@@H](C)COC	ZINC000661245399	462168855	/nfs/dbraw/zinc/16/88/55/462168855.db2.gz	ZZZFNFMSTYWNBN-QFBILLFUSA-N	0	3	330.472	3.093	20	30		EGEDHN
COc1cccc([C@H](CNCc2ccc(C#N)o2)N2CCCC2)c1	ZINC000174242020	533782042	/nfs/dbraw/zinc/78/20/42/533782042.db2.gz	FCRUZMRLLXZAPT-IBGZPJMESA-N	0	3	325.412	3.087	20	30		EGEDHN
C[C@H](N[C@@H]1CN(Cc2ccccc2)CC[C@@H]1CO)c1ccc(C#N)cc1	ZINC000181784500	533991279	/nfs/dbraw/zinc/99/12/79/533991279.db2.gz	GLFDUJFRQLJVEU-MTNREXPMSA-N	0	3	349.478	3.092	20	30		EGEDHN
Cc1nc(C(=O)NCC(C)(C)N[C@@H](C)c2ccccc2)ccc1C#N	ZINC000171926970	534872423	/nfs/dbraw/zinc/87/24/23/534872423.db2.gz	ATDNFSXAUALNNJ-HNNXBMFYSA-N	0	3	336.439	3.121	20	30		EGEDHN
Cc1nc(C(=O)NCC(C)(C)N[C@H](C)c2ccccc2)ccc1C#N	ZINC000171926974	534873042	/nfs/dbraw/zinc/87/30/42/534873042.db2.gz	ATDNFSXAUALNNJ-OAHLLOKOSA-N	0	3	336.439	3.121	20	30		EGEDHN
CC(C)C[C@@H]1OCCC[C@H]1NCC(=O)Nc1cc(Cl)ccc1C#N	ZINC000186323317	528421027	/nfs/dbraw/zinc/42/10/27/528421027.db2.gz	UPPQVLFVBMJQGK-WBVHZDCISA-N	0	3	349.862	3.333	20	30		EGEDHN
CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C[C@H](O)c1ccc(C#N)cc1	ZINC000177997733	528941799	/nfs/dbraw/zinc/94/17/99/528941799.db2.gz	LRVRHQDUXMHABS-IBGZPJMESA-N	0	3	339.395	3.410	20	30		EGEDHN
CCN(C(=O)Cc1ccc(C#N)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000186297054	535670284	/nfs/dbraw/zinc/67/02/84/535670284.db2.gz	RLDDJASNVASTDT-OAQYLSRUSA-N	0	3	347.462	3.224	20	30		EGEDHN
Cn1cc(C(=O)NC2CCN(C3CC3)CC2)c(C2CCCCC2)n1	ZINC000328745140	547484531	/nfs/dbraw/zinc/48/45/31/547484531.db2.gz	KUZWTDBRCFAVIK-UHFFFAOYSA-N	0	3	330.476	3.399	20	30		EGEDHN
N#C[C@@H]1CCC[C@@H](N[C@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)C1	ZINC000329574617	547501816	/nfs/dbraw/zinc/50/18/16/547501816.db2.gz	ASLSDXNCHDDJFD-UPJWGTAASA-N	0	3	335.810	3.256	20	30		EGEDHN
CC1(C)CCCN(CCNC(=O)Cc2ccc3c(c2)NC(=O)C3)C1	ZINC000329891862	547510836	/nfs/dbraw/zinc/51/08/36/547510836.db2.gz	ILZOHLQHQUKHEQ-UHFFFAOYSA-N	0	3	329.444	3.452	20	30		EGEDHN
N#C[C@H]1CCC[C@@H]1NC(=O)NCCN1CCC2(CCCCC2)CC1	ZINC000333029004	547527515	/nfs/dbraw/zinc/52/75/15/547527515.db2.gz	BTUZRPUREJOJDA-SJORKVTESA-N	0	3	332.492	3.024	20	30		EGEDHN
C=CCc1ccc(OC[C@@H](O)CN2CCC3(CC3)CC2)c(OC)c1	ZINC000677717036	549315700	/nfs/dbraw/zinc/31/57/00/549315700.db2.gz	BYYYUJUCYSOHIF-KRWDZBQOSA-N	0	3	331.456	3.039	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N[C@@H]1CCN(CC2CC2)C1)c1ccc(F)c(F)c1	ZINC000681311054	549981030	/nfs/dbraw/zinc/98/10/30/549981030.db2.gz	NJDIRORNTVKZRT-QAPCUYQASA-N	0	3	349.425	3.366	20	30		EGEDHN
CN(C)C[C@@H]1CCCCN1C(=S)Nc1ccc(C#N)c(Cl)c1	ZINC000726483341	574558781	/nfs/dbraw/zinc/55/87/81/574558781.db2.gz	UEBSNFXPBMDCLO-AWEZNQCLSA-N	0	3	336.892	3.325	20	30		EGEDHN
C=C(C)CN1CCC(NC(=S)Nc2ccc(OC)c(F)c2)CC1	ZINC000729943132	574897937	/nfs/dbraw/zinc/89/79/37/574897937.db2.gz	ZXYOUPALUBWOSU-UHFFFAOYSA-N	0	3	337.464	3.161	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNc1nccc(N2CCCC2)n1)C(C)C	ZINC000730106547	574919953	/nfs/dbraw/zinc/91/99/53/574919953.db2.gz	BHVKDALWPACKBO-KRWDZBQOSA-N	0	3	329.492	3.187	20	30		EGEDHN
C#CCOc1cccc(NC(=O)N2CCN(CCC(C)(C)C)CC2)c1	ZINC000731111550	575055074	/nfs/dbraw/zinc/05/50/74/575055074.db2.gz	UQFGUYDSBOODBP-UHFFFAOYSA-N	0	3	343.471	3.284	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cc(F)ccc1[N+](=O)[O-])C(C)C	ZINC000733161171	575312428	/nfs/dbraw/zinc/31/24/28/575312428.db2.gz	MDDMGODWHVNYIZ-KRWDZBQOSA-N	0	3	349.406	3.162	20	30		EGEDHN
CCN1CCN(c2ccc(Nc3ncc(C#N)cc3Cl)cc2)CC1	ZINC000734141324	575440847	/nfs/dbraw/zinc/44/08/47/575440847.db2.gz	IITAROBUKIWKJC-UHFFFAOYSA-N	0	3	341.846	3.492	20	30		EGEDHN
C[C@H]1CN(Cc2ccccn2)CCC1N=Nc1nc2ccccc2[nH]1	ZINC000734361731	575473589	/nfs/dbraw/zinc/47/35/89/575473589.db2.gz	HZXXYAPQTISZJL-AWEZNQCLSA-N	0	3	334.427	3.268	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)c1cc2occc2s1	ZINC000737323626	576205613	/nfs/dbraw/zinc/20/56/13/576205613.db2.gz	WCJDJDODGSNSAA-JTQLQIEISA-N	0	3	340.360	3.464	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)c2cc3occc3s2)cc1	ZINC000737322870	576205701	/nfs/dbraw/zinc/20/57/01/576205701.db2.gz	MTDZZMCQZVDKCO-LBPRGKRZSA-N	0	3	340.360	3.464	20	30		EGEDHN
N#Cc1ccc([C@H](NCc2ccc(C[NH+]3CCCC3)cc2)C(=O)[O-])cc1	ZINC000739106355	576378210	/nfs/dbraw/zinc/37/82/10/576378210.db2.gz	LQDUJQXXTITCTL-FQEVSTJZSA-N	0	3	349.434	3.070	20	30		EGEDHN
C[C@@H](Cc1ccccc1F)C(=O)C(C#N)C(=O)NC1CCCCC1	ZINC000739153294	576379891	/nfs/dbraw/zinc/37/98/91/576379891.db2.gz	AITFYWBUNXZNFR-XJKSGUPXSA-N	0	3	330.403	3.162	20	30		EGEDHN
CC[C@H](C)c1ccc(NC(=O)C(C#N)C(=O)C[C@@H]2CCOC2)cc1	ZINC000740534804	576593768	/nfs/dbraw/zinc/59/37/68/576593768.db2.gz	IBJZRBKPTUQCTF-GRDNDAEWSA-N	0	3	328.412	3.274	20	30		EGEDHN
CC[C@H](C)c1ccc(NC(=O)C(C#N)C(=O)C[C@@H]2CCOC2)cc1	ZINC000740534813	576593803	/nfs/dbraw/zinc/59/38/03/576593803.db2.gz	IBJZRBKPTUQCTF-ZQIUZPCESA-N	0	3	328.412	3.274	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2cc3c(s2)CCCCC3)CC1	ZINC000740736289	576621687	/nfs/dbraw/zinc/62/16/87/576621687.db2.gz	MWJGGPMMZUYCMR-UHFFFAOYSA-N	0	3	330.497	3.235	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2cc(CC)c(CCC)s2)CC1	ZINC000740737182	576621743	/nfs/dbraw/zinc/62/17/43/576621743.db2.gz	CRFXGNXOTFLTMT-UHFFFAOYSA-N	0	3	332.513	3.481	20	30		EGEDHN
N=C(N)NN=C(CCSc1ccc(F)cc1)c1ccc(F)cc1	ZINC000741451203	576687389	/nfs/dbraw/zinc/68/73/89/576687389.db2.gz	MHXFXHZZNQIFOM-UHFFFAOYSA-N	0	3	334.395	3.334	20	30		EGEDHN
C#Cc1cccc(NC(=S)NCC2(N(C)C)Cc3ccccc3C2)c1	ZINC000741481641	576690122	/nfs/dbraw/zinc/69/01/22/576690122.db2.gz	DYSOAFYNRCYKDY-UHFFFAOYSA-N	0	3	349.503	3.054	20	30		EGEDHN
C#CCOc1ccc(C(=O)NC[C@@H]2CCCCN2CCCC)cc1	ZINC000741680261	576710721	/nfs/dbraw/zinc/71/07/21/576710721.db2.gz	GZBSBFBBCASAKH-SFHVURJKSA-N	0	3	328.456	3.083	20	30		EGEDHN
C#CCCN1CCC(NC(=O)CCc2ccc(OCCC)cc2)CC1	ZINC000743493109	576810361	/nfs/dbraw/zinc/81/03/61/576810361.db2.gz	HPKIXHHIYQTBDR-UHFFFAOYSA-N	0	3	342.483	3.012	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)Cc2cc(F)ccc2F)c1	ZINC000744027892	576819084	/nfs/dbraw/zinc/81/90/84/576819084.db2.gz	CJVFGRHQVYFWRB-HNNXBMFYSA-N	0	3	328.318	3.163	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)[C@@H](C)c2ccc(C)o2)c1	ZINC000744027047	576819086	/nfs/dbraw/zinc/81/90/86/576819086.db2.gz	GRNQXOXNYDECDA-SWLSCSKDSA-N	0	3	326.352	3.048	20	30		EGEDHN
C[C@H](C(=O)C(C#N)C(=O)NCc1ccccc1)c1cccc(Cl)c1	ZINC000744027272	576819124	/nfs/dbraw/zinc/81/91/24/576819124.db2.gz	OMOVOLDAGZQQJR-SUMWQHHRSA-N	0	3	340.810	3.469	20	30		EGEDHN
C[C@@H](C(=O)C(C#N)C(=O)Nc1ccccn1)c1cccc(Cl)c1	ZINC000744039378	576819383	/nfs/dbraw/zinc/81/93/83/576819383.db2.gz	OGIPDKUNBOFVRF-BXUZGUMPSA-N	0	3	327.771	3.186	20	30		EGEDHN
C=CCCC[C@@H](C)[NH+]1CCC(Oc2ccc(-c3nnn[n-]3)cc2)CC1	ZINC000823894194	608391747	/nfs/dbraw/zinc/39/17/47/608391747.db2.gz	JTQWXPMLQVQITP-OAHLLOKOSA-N	0	3	341.459	3.455	20	30		EGEDHN
C=CCCC[C@@H](C)[NH+]1CCC(Oc2ccc(-c3nn[n-]n3)cc2)CC1	ZINC000823894194	608391749	/nfs/dbraw/zinc/39/17/49/608391749.db2.gz	JTQWXPMLQVQITP-OAHLLOKOSA-N	0	3	341.459	3.455	20	30		EGEDHN
C#CCCN(CCOC)Cc1cc(Cl)c(OCC)c(OC)c1	ZINC000827818833	1292381889	/nfs/dbraw/zinc/38/18/89/1292381889.db2.gz	VSQUGPZCWRQAMB-UHFFFAOYSA-N	0	3	325.836	3.219	20	30		EGEDHN
CCCOc1ccc(CCC(=O)C(C#N)C(=O)NC2CCCC2)cc1	ZINC000076838934	1292445155	/nfs/dbraw/zinc/44/51/55/1292445155.db2.gz	YNYDHANXVHPAFJ-SFHVURJKSA-N	0	3	342.439	3.176	20	30		EGEDHN
CC[C@@H](NCc1ccc(C#N)cn1)[C@@H]1CCCN1C(=O)OC(C)(C)C	ZINC000834773605	1293145247	/nfs/dbraw/zinc/14/52/47/1293145247.db2.gz	HVEAHZUVQBRDKM-SJORKVTESA-N	0	3	344.459	3.221	20	30		EGEDHN
CC[C@@H](NCc1ccc(C#N)cn1)[C@H]1CCCN1C(=O)OC(C)(C)C	ZINC000834773603	1293145531	/nfs/dbraw/zinc/14/55/31/1293145531.db2.gz	HVEAHZUVQBRDKM-IAGOWNOFSA-N	0	3	344.459	3.221	20	30		EGEDHN
CC[C@H](C#N)Oc1cccc(CNCc2c[nH]nc2-c2cccnc2)c1	ZINC000113961094	1293160334	/nfs/dbraw/zinc/16/03/34/1293160334.db2.gz	SCGRVLPJXQRQFL-GOSISDBHSA-N	0	3	347.422	3.442	20	30		EGEDHN
CC[C@H](CC(F)(F)F)C(=O)C(C#N)C(=O)Nc1cccc(OC)c1	ZINC000835060554	1293195627	/nfs/dbraw/zinc/19/56/27/1293195627.db2.gz	FRPOIGFYILTTAC-ZWNOBZJWSA-N	0	3	342.317	3.321	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)[C@@H](CCC)OC)cc1	ZINC000835062271	1293196514	/nfs/dbraw/zinc/19/65/14/1293196514.db2.gz	NKAKQSBIZVYAOK-IAGOWNOFSA-N	0	3	330.428	3.492	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)CCCC(=O)C(C)(C)C	ZINC000835064143	1293196885	/nfs/dbraw/zinc/19/68/85/1293196885.db2.gz	BQNGWPNDPUGJSB-ZDUSSCGKSA-N	0	3	344.411	3.128	20	30		EGEDHN
CCC[C@@H](OC)C(=O)C(C#N)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000835066227	1293197480	/nfs/dbraw/zinc/19/74/80/1293197480.db2.gz	XAQRVKFBJGXIDT-CHWSQXEVSA-N	0	3	343.210	3.456	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)C[C@H]3COc4ccccc4O3)nc21	ZINC000835174656	1293226174	/nfs/dbraw/zinc/22/61/74/1293226174.db2.gz	VXPWGZWGRWKELO-KBPBESRZSA-N	0	3	347.374	3.278	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)C[C@@H]3COc4ccccc4O3)nc21	ZINC000835174659	1293226284	/nfs/dbraw/zinc/22/62/84/1293226284.db2.gz	VXPWGZWGRWKELO-KGLIPLIRSA-N	0	3	347.374	3.278	20	30		EGEDHN
C[C@H](SCc1ccccc1)C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000125220468	1293500087	/nfs/dbraw/zinc/50/00/87/1293500087.db2.gz	TUJBZDZRBZWMAZ-DZGCQCFKSA-N	0	3	339.420	3.051	20	30		EGEDHN
COc1ccc(CCCC(=O)C(C#N)C(=O)Nc2ccccc2)cc1	ZINC000127888433	1293576800	/nfs/dbraw/zinc/57/68/00/1293576800.db2.gz	IEPDJVSHTKXCIL-SFHVURJKSA-N	0	3	336.391	3.365	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)c1ccc(F)c(F)c1	ZINC000128956970	1293609194	/nfs/dbraw/zinc/60/91/94/1293609194.db2.gz	UURZJXSDEOYWBL-LBPRGKRZSA-N	0	3	344.317	3.325	20	30		EGEDHN
CC(C)OCCC(=O)C(C#N)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000130499763	1293659046	/nfs/dbraw/zinc/65/90/46/1293659046.db2.gz	GNVXCZYVQSZDKJ-ZDUSSCGKSA-N	0	3	343.210	3.456	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)CCc1ccc(Cl)cc1Cl	ZINC000130950809	1293674308	/nfs/dbraw/zinc/67/43/08/1293674308.db2.gz	VXTULUFMWMINFO-LBPRGKRZSA-N	0	3	327.211	3.159	20	30		EGEDHN
N#CC(C(=O)CCc1cc(Cl)cs1)C(=O)Nc1ccccn1	ZINC000131068859	1293678402	/nfs/dbraw/zinc/67/84/02/1293678402.db2.gz	GREKTXDLXUYBSJ-LBPRGKRZSA-N	0	3	333.800	3.077	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1)C(=O)c1cnc(-c2ccccc2)nc1	ZINC000159767052	1294246905	/nfs/dbraw/zinc/24/69/05/1294246905.db2.gz	CKPWNLZTODODOU-QGZVFWFLSA-N	0	3	342.358	3.105	20	30		EGEDHN
CC(=O)CSCC(=O)C(C#N)c1nc(-c2ccccc2)cs1	ZINC000176748645	1294628863	/nfs/dbraw/zinc/62/88/63/1294628863.db2.gz	NUIRSQPMNWWOFE-CYBMUJFWSA-N	0	3	330.434	3.309	20	30		EGEDHN
N#Cc1ccc(CNCc2ccc(N3CCSCC3)cc2)s1	ZINC000176950646	1294644128	/nfs/dbraw/zinc/64/41/28/1294644128.db2.gz	YYFGKHATBKHYNF-UHFFFAOYSA-N	0	3	329.494	3.463	20	30		EGEDHN
CC(C)c1cc(C(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)nn1C	ZINC000177596587	1294678950	/nfs/dbraw/zinc/67/89/50/1294678950.db2.gz	GDSFXWIMXXDJOX-ZDUSSCGKSA-N	0	3	344.802	3.158	20	30		EGEDHN
COCCOc1ccc([C@H](C)NCc2ccc(OCC#N)cc2)cc1	ZINC000180552871	1294898287	/nfs/dbraw/zinc/89/82/87/1294898287.db2.gz	OVTBOIZGIJPDEZ-INIZCTEOSA-N	0	3	340.423	3.465	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@@H](C)Oc1cccc(Cl)c1	ZINC000193371810	1295858557	/nfs/dbraw/zinc/85/85/57/1295858557.db2.gz	LEHLFHXPVWGRSK-DOMZBBRYSA-N	0	3	336.819	3.123	20	30		EGEDHN
N#CC(C(=O)COc1ccc(F)cc1Cl)C(=O)Nc1ccccc1	ZINC000193444299	1295871440	/nfs/dbraw/zinc/87/14/40/1295871440.db2.gz	AZLBZWSENVJROW-ZDUSSCGKSA-N	0	3	346.745	3.205	20	30		EGEDHN
CO[C@H](C)CC(=O)C(C#N)C(=O)Nc1ccc(SC(F)F)cc1	ZINC000195491980	1296072691	/nfs/dbraw/zinc/07/26/91/1296072691.db2.gz	JEJFRXXYWQHIRN-SKDRFNHKSA-N	0	3	342.367	3.074	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]\CCCN2CCCCCC2=O)c([O-])c1	ZINC000255132615	1296502701	/nfs/dbraw/zinc/50/27/01/1296502701.db2.gz	BSEJROYDNCMHCE-PGMHBOJBSA-N	0	3	345.487	3.450	20	30		EGEDHN
C[C@H](NC[C@@H](O)c1c(F)cccc1F)c1ccc(OCC#N)cc1	ZINC000305787313	1297051710	/nfs/dbraw/zinc/05/17/10/1297051710.db2.gz	YPDSUIGVYQNRNQ-YVEFUNNKSA-N	0	3	332.350	3.251	20	30		EGEDHN
C#CCOc1ccccc1CNC[C@H]1CCCN1C(=O)OC(C)(C)C	ZINC000310653165	1297099202	/nfs/dbraw/zinc/09/92/02/1297099202.db2.gz	KSCLXEOXLZPHAY-QGZVFWFLSA-N	0	3	344.455	3.188	20	30		EGEDHN
CN(CCC#N)c1ccc(CNCc2ccc3oc(=O)[nH]c3c2)cc1	ZINC000873172784	1297322589	/nfs/dbraw/zinc/32/25/89/1297322589.db2.gz	GOYXFSODQDHKQF-UHFFFAOYSA-N	0	3	336.395	3.173	20	30		EGEDHN
Cc1nc(C#N)cc(N2CCN(Cc3ccccc3)[C@@H](C(C)C)C2)n1	ZINC000707578617	1298231081	/nfs/dbraw/zinc/23/10/81/1298231081.db2.gz	YAWAMLLBSLJQEX-LJQANCHMSA-N	0	3	335.455	3.004	20	30		EGEDHN
C=C(Br)CN[C@@H]1CC[C@@H](CNC(=O)OC(C)(C)C)C1	ZINC000724068134	1298346927	/nfs/dbraw/zinc/34/69/27/1298346927.db2.gz	JYLRBFIOIVXHMT-VXGBXAGGSA-N	0	3	333.270	3.178	20	30		EGEDHN
CC(=NNC(=S)NC1CCN(Cc2ccccc2)CC1)C1CCC1	ZINC000747627257	1298813082	/nfs/dbraw/zinc/81/30/82/1298813082.db2.gz	DTQAXJKRLUGMLM-UHFFFAOYSA-N	0	3	344.528	3.291	20	30		EGEDHN
C=C(Cl)C[C@H](N)C(=O)N1CCCC[C@H]1Cc1ccc(OC)cc1	ZINC000876949578	1299083340	/nfs/dbraw/zinc/08/33/40/1299083340.db2.gz	ZBPOEOZRQIRUEC-RDJZCZTQSA-N	0	3	336.863	3.089	20	30		EGEDHN
CCc1ccc([C@@H](CN2CCOCC2)NCc2ccc(C#N)cc2)cc1	ZINC000753619730	1299993478	/nfs/dbraw/zinc/99/34/78/1299993478.db2.gz	QZXGSCCOEGLKBV-JOCHJYFZSA-N	0	3	349.478	3.284	20	30		EGEDHN
C[C@H]1C[C@H](NC(=S)Nc2ccc(C#N)c(Cl)c2)CN1C1CC1	ZINC000753958817	1300052121	/nfs/dbraw/zinc/05/21/21/1300052121.db2.gz	AOXRPKOTPYLPTE-GWCFXTLKSA-N	0	3	334.876	3.123	20	30		EGEDHN
Cc1ccc2c(c1)CC[C@@H]2N[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000754105597	1300088330	/nfs/dbraw/zinc/08/83/30/1300088330.db2.gz	OOQKXQMVBPAMBV-SFTDATJTSA-N	0	3	345.446	3.245	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc(N(C)C)c(F)c2)CC1	ZINC000880918549	1301333556	/nfs/dbraw/zinc/33/35/56/1301333556.db2.gz	XKIXBGJQKLUELF-UHFFFAOYSA-N	0	3	334.439	3.054	20	30		EGEDHN
CCO[C@H](CC(=O)C(C#N)C(=O)Nc1ccc(CC)cc1)C(C)C	ZINC000761037756	1301387437	/nfs/dbraw/zinc/38/74/37/1301387437.db2.gz	OEJKJQZQGXRHEU-SJLPKXTDSA-N	0	3	330.428	3.348	20	30		EGEDHN
CCc1nn(C)c(OC)c1C/[NH+]=C\c1ccc(N(CC)CC)cc1[O-]	ZINC000763360468	1301885849	/nfs/dbraw/zinc/88/58/49/1301885849.db2.gz	BOOBLMCJKFUVLU-NDENLUEZSA-N	0	3	344.459	3.162	20	30		EGEDHN
CC[C@@H](C)N1CCN(c2nccc(Oc3cccc(C#N)c3)n2)CC1	ZINC000882428386	1301959972	/nfs/dbraw/zinc/95/99/72/1301959972.db2.gz	RFBNVUSXRAWPCL-OAHLLOKOSA-N	0	3	337.427	3.061	20	30		EGEDHN
Cc1ccc(N(CCC#N)C(=O)[C@H](C)N2CC[C@H](C3CC3)C2)cc1	ZINC000764482902	1302071326	/nfs/dbraw/zinc/07/13/26/1302071326.db2.gz	COUZGFDOPXDTQT-WMZOPIPTSA-N	0	3	325.456	3.362	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)CCc1cncc2ccccc21	ZINC000765589531	1302287310	/nfs/dbraw/zinc/28/73/10/1302287310.db2.gz	XXAOSULOMUXWBW-GOSISDBHSA-N	0	3	337.423	3.183	20	30		EGEDHN
C=CC[C@@H](N[C@@H](C)c1cccc(NS(C)(=O)=O)c1)c1ccncc1	ZINC000766017382	1302371533	/nfs/dbraw/zinc/37/15/33/1302371533.db2.gz	AYDLMCAQTXYUAS-KBXCAEBGSA-N	0	3	345.468	3.421	20	30		EGEDHN
N#CCSc1ccccc1C(=O)N1CCN(C2CCCCC2)CC1	ZINC000766370315	1302439413	/nfs/dbraw/zinc/43/94/13/1302439413.db2.gz	RCSWRQQNRZGJCX-UHFFFAOYSA-N	0	3	343.496	3.393	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCC2(SC)CCCCC2)CC1	ZINC000884131723	1302747692	/nfs/dbraw/zinc/74/76/92/1302747692.db2.gz	TZRNUOVVOUQOTL-UHFFFAOYSA-N	0	3	339.549	3.392	20	30		EGEDHN
CC(C)N(CC(=O)C(C#N)c1nc2ccccc2s1)CC(F)F	ZINC000767907512	1302782911	/nfs/dbraw/zinc/78/29/11/1302782911.db2.gz	VQSQLTJVFBIXJU-NSHDSACASA-N	0	3	337.395	3.448	20	30		EGEDHN
C=CCC1(O)CC[NH+](Cc2c([O-])ccc3ccc(OC)cc32)CC1	ZINC000884477949	1302874182	/nfs/dbraw/zinc/87/41/82/1302874182.db2.gz	MNZYRTYREFKJHO-UHFFFAOYSA-N	0	3	327.424	3.457	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@](C)(NCc1cccc(C#N)c1F)C1CC1	ZINC000769163865	1303060175	/nfs/dbraw/zinc/06/01/75/1303060175.db2.gz	GFBNKMXLCGJOJL-IBGZPJMESA-N	0	3	347.434	3.480	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)[C@@H](F)c1ccccc1	ZINC000769280680	1303084074	/nfs/dbraw/zinc/08/40/74/1303084074.db2.gz	BXJRXZQFDJMBHG-YOEHRIQHSA-N	0	3	340.354	3.443	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@H](C)N1CCC(c2nc(C)c(C)[nH]2)CC1	ZINC000886668397	1303547740	/nfs/dbraw/zinc/54/77/40/1303547740.db2.gz	RVIAYPXRVLAWRT-INIZCTEOSA-N	0	3	332.492	3.019	20	30		EGEDHN
N#Cc1cccc(OCCCN2CC[C@](O)(c3ccc(F)cc3)C2)c1	ZINC000777728425	1304340249	/nfs/dbraw/zinc/34/02/49/1304340249.db2.gz	AEUQKOMWGBSMRG-HXUWFJFHSA-N	0	3	340.398	3.060	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)c2cc(C)nc(Cl)c2)c1	ZINC000778605529	1304473246	/nfs/dbraw/zinc/47/32/46/1304473246.db2.gz	RHVXAEOVEOPZHH-CQSZACIVSA-N	0	3	343.770	3.013	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)[C@H]1CCCCS1	ZINC000783352974	1305082566	/nfs/dbraw/zinc/08/25/66/1305082566.db2.gz	NZKOUKZJOOMTQA-IUODEOHRSA-N	0	3	332.425	3.018	20	30		EGEDHN
N#Cc1ccc(N2CCC([NH2+]Cc3cc([O-])cc(Cl)c3)CC2)nc1	ZINC000892861733	1305582791	/nfs/dbraw/zinc/58/27/91/1305582791.db2.gz	XBJVTPUBJOBZMU-UHFFFAOYSA-N	0	3	342.830	3.071	20	30		EGEDHN
CSCCCCC(=O)C(C#N)C(=O)NCc1cccc(Cl)c1	ZINC000786533529	1305591441	/nfs/dbraw/zinc/59/14/41/1305591441.db2.gz	FJRGOHDMQJNOES-AWEZNQCLSA-N	0	3	338.860	3.198	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)CCc1nccs1)c1ccccc1	ZINC000787040469	1305681488	/nfs/dbraw/zinc/68/14/88/1305681488.db2.gz	LRGMUYLXPCANAC-CABCVRRESA-N	0	3	341.436	3.052	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)CC[C@@H](C)SC)c1ccccc1	ZINC000787042542	1305683220	/nfs/dbraw/zinc/68/32/20/1305683220.db2.gz	WZNOFTGMCKWGJZ-BMFZPTHFSA-N	0	3	332.469	3.494	20	30		EGEDHN
CC(C)N1CCC[C@@H](NC(=O)C#Cc2ccc(C(F)(F)F)cc2)C1	ZINC000790899008	1308882464	/nfs/dbraw/zinc/88/24/64/1308882464.db2.gz	LMMJWSFAYOTBIJ-MRXNPFEDSA-N	0	3	338.373	3.046	20	30		EGEDHN
O=C1[C@H]([NH2+][C@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)CCCN1[O-]	ZINC000895162443	1309218101	/nfs/dbraw/zinc/21/81/01/1309218101.db2.gz	ZOADIKPNDFJNDT-VHDGCEQUSA-N	0	3	342.361	3.311	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN2CCN(C)[C@@H](Cc3ccccc3)C2)cc1	ZINC000793621473	1309419267	/nfs/dbraw/zinc/41/92/67/1309419267.db2.gz	WYLTUEKVAOOPQP-RXVVDRJESA-N	0	3	349.478	3.336	20	30		EGEDHN
C=CCC1(O)CCN(Cc2ccc(Oc3cnccn3)cc2)CC1	ZINC000895835744	1309545973	/nfs/dbraw/zinc/54/59/73/1309545973.db2.gz	NMGMGQDQNZMVRT-UHFFFAOYSA-N	0	3	325.412	3.172	20	30		EGEDHN
COc1ccc(CN2CC(C)(C)CC[C@H]2CO)cc1OCCCC#N	ZINC000895926088	1309594910	/nfs/dbraw/zinc/59/49/10/1309594910.db2.gz	VOHFJVZQCUZXQI-KRWDZBQOSA-N	0	3	346.471	3.361	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc3c(cncc3Cl)s2)CC1	ZINC000896208423	1309744342	/nfs/dbraw/zinc/74/43/42/1309744342.db2.gz	HGIXOBXQFBTLDZ-UHFFFAOYSA-N	0	3	335.860	3.330	20	30		EGEDHN
CCC#C[C@H](C)N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000796466081	1310008370	/nfs/dbraw/zinc/00/83/70/1310008370.db2.gz	PLOXRGRTJLMWKO-HKUYNNGSSA-N	0	3	328.456	3.427	20	30		EGEDHN
COC(=O)Nc1cccc(CNCc2ccc(OC)c(C#N)c2)c1	ZINC000796490072	1310012974	/nfs/dbraw/zinc/01/29/74/1310012974.db2.gz	IIJQXGUBGWIYBE-UHFFFAOYSA-N	0	3	325.368	3.035	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(Cl)cc1)C(=O)[C@H]1CCC(F)(F)C1	ZINC000796633742	1310052644	/nfs/dbraw/zinc/05/26/44/1310052644.db2.gz	RNIAPHLDIAUECH-CABZTGNLSA-N	0	3	326.730	3.423	20	30		EGEDHN
N#Cc1ccc(NCCNCc2cnc(C3CCCC3)s2)nc1	ZINC000897398365	1310320915	/nfs/dbraw/zinc/32/09/15/1310320915.db2.gz	BTVUOZIBXYWKOD-UHFFFAOYSA-N	0	3	327.457	3.269	20	30		EGEDHN
C#C[C@H](NC(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1)C(C)C	ZINC000798553734	1310389211	/nfs/dbraw/zinc/38/92/11/1310389211.db2.gz	XQDMJYBCVQRGLD-RBUKOAKNSA-N	0	3	327.472	3.089	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc(Cl)ccc2Cl)C1	ZINC001023717978	1319851527	/nfs/dbraw/zinc/85/15/27/1319851527.db2.gz	NGZWFFTVAAKXLW-ZDUSSCGKSA-N	0	3	339.266	3.459	20	30		EGEDHN
COc1cc(CN(CCO[C@H](C)C#N)C2CC2)ccc1OC(F)F	ZINC000801910563	1316963811	/nfs/dbraw/zinc/96/38/11/1316963811.db2.gz	UTYLAFFMFMBKDH-GFCCVEGCSA-N	0	3	340.370	3.190	20	30		EGEDHN
Cc1nsc(N2CCCN(CCCCC3(C#N)CCC3)CC2)n1	ZINC000929730705	1328681111	/nfs/dbraw/zinc/68/11/11/1328681111.db2.gz	IUGHGBVQKLMLEB-UHFFFAOYSA-N	0	3	333.505	3.223	20	30		EGEDHN
CCN(C)C(=O)OC[C@H]1CCCCN1Cc1ccc(CC#N)cc1	ZINC000805760271	1317417648	/nfs/dbraw/zinc/41/76/48/1317417648.db2.gz	BRNPBJWFLBDPIB-GOSISDBHSA-N	0	3	329.444	3.195	20	30		EGEDHN
C#CCN(Cc1ccccc1)C(=O)NC[C@@H](c1ccccc1)N(C)C	ZINC000806289177	1317477330	/nfs/dbraw/zinc/47/73/30/1317477330.db2.gz	GQZOTLYGZBGCOU-FQEVSTJZSA-N	0	3	335.451	3.134	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)CC2CCCCC2)C1	ZINC001019974811	1317482094	/nfs/dbraw/zinc/48/20/94/1317482094.db2.gz	KRBHZXCKMHUOON-HDJSIYSDSA-N	0	3	329.282	3.102	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC(CN(CC)Cc2ocnc2C)CC1	ZINC000957737642	1317600917	/nfs/dbraw/zinc/60/09/17/1317600917.db2.gz	RKXSNYJQGFLDIS-UHFFFAOYSA-N	0	3	333.476	3.256	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)[C@H]2CCC[C@@H]2CCC)C1	ZINC001020326350	1317645485	/nfs/dbraw/zinc/64/54/85/1317645485.db2.gz	NWWJDFILMLUFTK-AJNGGQMLSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc3c([nH]2)c(F)ccc3C)C1	ZINC001020329056	1317647279	/nfs/dbraw/zinc/64/72/79/1317647279.db2.gz	XVJMLRSNKSGZHM-HAQNSBGRSA-N	0	3	335.810	3.218	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N2CCN(CCC(C)(C)C)CC2)cc1	ZINC000957819700	1317652721	/nfs/dbraw/zinc/65/27/21/1317652721.db2.gz	QJJBNKJJKHSNBR-UHFFFAOYSA-N	0	3	344.499	3.374	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N2CCN(CC(CC)CC)CC2)cc1	ZINC000957820096	1317652949	/nfs/dbraw/zinc/65/29/49/1317652949.db2.gz	YNTDPRAPBKJKRJ-UHFFFAOYSA-N	0	3	344.499	3.374	20	30		EGEDHN
C[C@@H](NCC1(NC(=O)OC(C)(C)C)CC1)c1ccc(C#N)cc1F	ZINC000903240177	1317680562	/nfs/dbraw/zinc/68/05/62/1317680562.db2.gz	UHXXTSWQYIIUHX-GFCCVEGCSA-N	0	3	333.407	3.405	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H]2CC[C@@H]2c2ccc(F)cc2)C1	ZINC001020428325	1317691670	/nfs/dbraw/zinc/69/16/70/1317691670.db2.gz	DQJXHUPMIYOJOF-QBPKDAKJSA-N	0	3	336.838	3.309	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@H](NC(=O)C3CC4(CCC4)C3)C2)c(F)c1	ZINC001020487542	1317721118	/nfs/dbraw/zinc/72/11/18/1317721118.db2.gz	DDYCYYZXLWOVBE-QAQDUYKDSA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@H](NCc3ccc(F)cc3F)C2)CC1	ZINC001020544764	1317758561	/nfs/dbraw/zinc/75/85/61/1317758561.db2.gz	XKDGLJLGNZRIBR-QAQDUYKDSA-N	0	3	334.410	3.448	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2c2c(F)cccc2F)C1	ZINC001020569869	1317780458	/nfs/dbraw/zinc/78/04/58/1317780458.db2.gz	MLQSPCQUXAKEHA-FDYHWXHSSA-N	0	3	340.801	3.058	20	30		EGEDHN
CC(C)(C#N)CNCC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000809639340	1317854307	/nfs/dbraw/zinc/85/43/07/1317854307.db2.gz	JPZZQQLYRJLITB-UHFFFAOYSA-N	0	3	329.444	3.175	20	30		EGEDHN
CCOc1cc(/C=C2\C(=O)c3ncnn3C2C)ccc1OC(F)F	ZINC000905080256	1317920670	/nfs/dbraw/zinc/92/06/70/1317920670.db2.gz	JPAWUCKWTHSLJJ-ISAHRAOESA-N	0	3	335.310	3.119	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)c1ccc(C(C)C)cn1	ZINC000810532464	1318019514	/nfs/dbraw/zinc/01/95/14/1318019514.db2.gz	TXLRQCDGIIZZLJ-CQSZACIVSA-N	0	3	337.379	3.175	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)c2ccc(CC)cc2)C1	ZINC001021003741	1318039042	/nfs/dbraw/zinc/03/90/42/1318039042.db2.gz	QVTYNYHVNOZPMZ-SHTZXODSSA-N	0	3	337.261	3.008	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@H]2CCCCc3ccccc32)C1	ZINC001021103115	1318083686	/nfs/dbraw/zinc/08/36/86/1318083686.db2.gz	QGQKZHHIPLVFRB-BQFCYCMXSA-N	0	3	332.875	3.486	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C2CCC(C)(C)CC2)C1	ZINC001021106917	1318088322	/nfs/dbraw/zinc/08/83/22/1318088322.db2.gz	VLEIZWUGJWAIRD-HDJSIYSDSA-N	0	3	343.309	3.348	20	30		EGEDHN
C#C[C@@H](C)N(C)C(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1	ZINC000811993222	1318303442	/nfs/dbraw/zinc/30/34/42/1318303442.db2.gz	SOJAWNUQEAFMAS-CVEARBPZSA-N	0	3	333.501	3.184	20	30		EGEDHN
CC(F)(F)C(=O)N1CCC[C@H]2CN(Cc3cccc(C#N)c3)CC[C@H]21	ZINC001021500595	1318312430	/nfs/dbraw/zinc/31/24/30/1318312430.db2.gz	ZMHYVQOQQOGSAD-DLBZAZTESA-N	0	3	347.409	3.026	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)C(=O)N1CCN(C)C2(CCCCC2)C1	ZINC000908575632	1318368835	/nfs/dbraw/zinc/36/88/35/1318368835.db2.gz	QZOAGVNVZQZRGN-KRWDZBQOSA-N	0	3	339.483	3.214	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@@H]2CN(Cc3ccc(F)cc3)CC[C@@H]21	ZINC001021582707	1318427225	/nfs/dbraw/zinc/42/72/25/1318427225.db2.gz	YRNYVZJOHZZVFV-QUCCMNQESA-N	0	3	340.442	3.052	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)Cc2c(C)cccc2C)C1	ZINC001021604430	1318449580	/nfs/dbraw/zinc/44/95/80/1318449580.db2.gz	VXOLBPJMEWKJRO-TZIWHRDSSA-N	0	3	338.495	3.182	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCC[C@@H]2CN(C/C=C/Cl)CC[C@H]21	ZINC001021604814	1318451409	/nfs/dbraw/zinc/45/14/09/1318451409.db2.gz	GTEGTMNSXSJHOU-AQBSSDIKSA-N	0	3	347.890	3.353	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc(C2CC2)nc1C	ZINC000960305628	1318453352	/nfs/dbraw/zinc/45/33/52/1318453352.db2.gz	CVHUWEZYXAWOEW-NHCUHLMSSA-N	0	3	347.462	3.439	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ncccc1Cl	ZINC000960326142	1318462068	/nfs/dbraw/zinc/46/20/68/1318462068.db2.gz	UIIBFZNHJLLCMG-IAGOWNOFSA-N	0	3	341.842	3.297	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(C)n(CC)c2C)C1	ZINC001021623952	1318474425	/nfs/dbraw/zinc/47/44/25/1318474425.db2.gz	QLPBXUCYPABYAU-QUCCMNQESA-N	0	3	341.499	3.075	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(Cl)ccc2F)C1	ZINC001021627298	1318479180	/nfs/dbraw/zinc/47/91/80/1318479180.db2.gz	NHBYKGYIGPAALY-KBXCAEBGSA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2c[nH]c3ccccc23)C1	ZINC001021628766	1318481919	/nfs/dbraw/zinc/48/19/19/1318481919.db2.gz	XRUMTYHGEHDQHZ-OXJNMPFZSA-N	0	3	335.451	3.118	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc2n(c1)CCCC2	ZINC000960360315	1318483105	/nfs/dbraw/zinc/48/31/05/1318483105.db2.gz	WILBEWTYVCHMMZ-NHCUHLMSSA-N	0	3	349.478	3.386	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)CCc2ccc(Cl)cc2)C1	ZINC001021638551	1318495453	/nfs/dbraw/zinc/49/54/53/1318495453.db2.gz	FWYHYXTYFOJYHZ-MJGOQNOKSA-N	0	3	344.886	3.219	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc3ncccc3c2)C1	ZINC001021666362	1318526706	/nfs/dbraw/zinc/52/67/06/1318526706.db2.gz	SOHNPQQXGFAAOL-CTNGQTDRSA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(C)c(F)c2F)C1	ZINC001021673111	1318537029	/nfs/dbraw/zinc/53/70/29/1318537029.db2.gz	GEBPEQOKKPXKRL-RDJZCZTQSA-N	0	3	346.421	3.223	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(C)cc(F)c2)C1	ZINC001021675842	1318541734	/nfs/dbraw/zinc/54/17/34/1318541734.db2.gz	GQAIPZVEQXRNMJ-VQIMIIECSA-N	0	3	328.431	3.084	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccsc2Cl)C1	ZINC001021681889	1318553603	/nfs/dbraw/zinc/55/36/03/1318553603.db2.gz	JTRHUMGXUSASIM-DZGCQCFKSA-N	0	3	336.888	3.351	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccoc2CCC)C1	ZINC001021714577	1318593494	/nfs/dbraw/zinc/59/34/94/1318593494.db2.gz	XOMCOVLYMJFLJH-AEFFLSMTSA-N	0	3	328.456	3.182	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(F)cc2C)C1	ZINC001021718764	1318601674	/nfs/dbraw/zinc/60/16/74/1318601674.db2.gz	JNXSIAOWFMNGGE-QFBILLFUSA-N	0	3	328.431	3.084	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)Cc2cc(C)ccc2F)C1	ZINC001021720915	1318606587	/nfs/dbraw/zinc/60/65/87/1318606587.db2.gz	ZUVMEBKYERWKMI-XLIONFOSSA-N	0	3	342.458	3.013	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(Cl)s2)C1	ZINC001021728120	1318626048	/nfs/dbraw/zinc/62/60/48/1318626048.db2.gz	RKSQRFPNZWNYAD-UONOGXRCSA-N	0	3	336.888	3.351	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cccc3cnccc32)C1	ZINC001021737354	1318643813	/nfs/dbraw/zinc/64/38/13/1318643813.db2.gz	SXUHYFIDGQYAQO-RXVVDRJESA-N	0	3	347.462	3.185	20	30		EGEDHN
Cc1cccc(C(=O)N[C@H]2C[C@@H](NCc3cc(C#N)ccc3F)C2)c1	ZINC001021800588	1318692217	/nfs/dbraw/zinc/69/22/17/1318692217.db2.gz	GFSNJAAXUQHEFN-HDICACEKSA-N	0	3	337.398	3.056	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)/C=C\c1ccc[nH]1	ZINC000960581951	1318712390	/nfs/dbraw/zinc/71/23/90/1318712390.db2.gz	QHYYQBIVVXHMJM-PISNEZEASA-N	0	3	348.450	3.023	20	30		EGEDHN
C[C@H](c1cccc(F)c1)N(C)C[C@@H]1CCCN1C(=O)C#CC1CC1	ZINC000960624892	1318749761	/nfs/dbraw/zinc/74/97/61/1318749761.db2.gz	ROIJZMMXNGUWPB-BEFAXECRSA-N	0	3	328.431	3.223	20	30		EGEDHN
C[C@@H]1CCC[C@@H]1CC(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001022121272	1318801760	/nfs/dbraw/zinc/80/17/60/1318801760.db2.gz	BLEWJTKJDVNSMS-UWIFEVILSA-N	0	3	343.446	3.260	20	30		EGEDHN
FC(F)(F)[C@@H]1C=C(NNc2cncc(Br)c2)CCO1	ZINC000814886936	1318839512	/nfs/dbraw/zinc/83/95/12/1318839512.db2.gz	KQDGUJDZZYORRT-JTQLQIEISA-N	0	3	338.127	3.353	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)CC1(C)CC1	ZINC000960746791	1318848582	/nfs/dbraw/zinc/84/85/82/1318848582.db2.gz	DZTBZPPVZYAGDX-SFHVURJKSA-N	0	3	325.456	3.171	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccc(C(=O)N2CCCC[C@H]2C)cc1	ZINC000912309888	1318864849	/nfs/dbraw/zinc/86/48/49/1318864849.db2.gz	ARWIQUFWGTYGFO-CRAIPNDOSA-N	0	3	343.471	3.323	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cn(CC)c3ccccc23)C1	ZINC001022397020	1318921154	/nfs/dbraw/zinc/92/11/54/1318921154.db2.gz	PYVCWRHEHFSEHU-OKILXGFUSA-N	0	3	331.847	3.264	20	30		EGEDHN
Cc1coc(C(=O)N2CCC[C@H]2CN(C)Cc2ccc(C#N)cc2)c1	ZINC000960811452	1318930975	/nfs/dbraw/zinc/93/09/75/1318930975.db2.gz	ZHRPKKYBYHUMFV-SFHVURJKSA-N	0	3	337.423	3.196	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)C2(C)CCCCC2)C1	ZINC001022644616	1319037835	/nfs/dbraw/zinc/03/78/35/1319037835.db2.gz	SHKYHKYOBAQLRE-BETUJISGSA-N	0	3	329.282	3.102	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@@H](NCc3c(C)onc3CC)C2)CC1	ZINC001022647985	1319038425	/nfs/dbraw/zinc/03/84/25/1319038425.db2.gz	HEIOCVHDJIIMAM-IYBDPMFKSA-N	0	3	331.460	3.029	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)[C@@H]2CCC[C@@H](OC)C2)cc1	ZINC000815907794	1319071637	/nfs/dbraw/zinc/07/16/37/1319071637.db2.gz	KPJVCTMDOCXJCL-DJIMGWMZSA-N	0	3	328.412	3.102	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N1CCC[C@@H]1CN(C)Cc1ccccc1	ZINC000960927753	1319072161	/nfs/dbraw/zinc/07/21/61/1319072161.db2.gz	NFTPDKMVZUSJEI-AABGKKOBSA-N	0	3	342.483	3.091	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)CCc1cncs1)c1ccccc1	ZINC000816038566	1319092685	/nfs/dbraw/zinc/09/26/85/1319092685.db2.gz	ATARHBMBCZFDMR-HOTGVXAUSA-N	0	3	341.436	3.052	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2csc(-c3ccoc3)n2)C1	ZINC001022863956	1319142645	/nfs/dbraw/zinc/14/26/45/1319142645.db2.gz	RRLQETQZLDHRHL-TXEJJXNPSA-N	0	3	337.832	3.006	20	30		EGEDHN
C[C@H](CC(=O)N1CCC[C@H]1CN(C)Cc1cccc(C#N)c1)C1CC1	ZINC000961038250	1319162430	/nfs/dbraw/zinc/16/24/30/1319162430.db2.gz	QRWUIVPXKFHDBV-UZLBHIALSA-N	0	3	339.483	3.417	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]([C@@H]3CCCN(C(=O)C4CC4)C3)C2)s1	ZINC000961082314	1319194165	/nfs/dbraw/zinc/19/41/65/1319194165.db2.gz	RRJRCWBMISQKSB-HZPDHXFCSA-N	0	3	343.496	3.090	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc(OC3CCC3)cc2)C1	ZINC001023112606	1319266100	/nfs/dbraw/zinc/26/61/00/1319266100.db2.gz	KZSASFNNYUWMIW-GASCZTMLSA-N	0	3	334.847	3.221	20	30		EGEDHN
N#Cc1ccc(CN2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)C2CCC3(CC3)CC2)cc1	ZINC000961190932	1319306316	/nfs/dbraw/zinc/30/63/16/1319306316.db2.gz	RCIKPYYDMFOBHK-PMOLBWCYSA-N	0	3	349.478	3.075	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@H](CNC(=O)c3ccsc3)C2)c1	ZINC001023219918	1319356838	/nfs/dbraw/zinc/35/68/38/1319356838.db2.gz	UMFSEURNYDLNEP-KRWDZBQOSA-N	0	3	339.464	3.262	20	30		EGEDHN
CC[C@H]1CCCN(Cc2cc(=O)n3c4ccccc4[nH]c3c2C#N)C1	ZINC000915218520	1319446712	/nfs/dbraw/zinc/44/67/12/1319446712.db2.gz	FBFPWEMGFFFPDA-HOCLYGCPSA-N	0	3	334.423	3.346	20	30		EGEDHN
CC1(C)CC(C(=O)NC[C@H]2CCCN(Cc3cccc(C#N)c3)C2)C1	ZINC001023349273	1319464144	/nfs/dbraw/zinc/46/41/44/1319464144.db2.gz	ULPQTODVGDTWCI-GOSISDBHSA-N	0	3	339.483	3.323	20	30		EGEDHN
CC1(C)CC(C(=O)NC[C@H]2CCCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001023351483	1319464988	/nfs/dbraw/zinc/46/49/88/1319464988.db2.gz	WVDNGKCHPLBRDF-GOSISDBHSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](C2CCN(C(=O)c3ccncc3)CC2)C1	ZINC000961324642	1319481957	/nfs/dbraw/zinc/48/19/57/1319481957.db2.gz	YFOSSXNGAWWMAX-GOSISDBHSA-N	0	3	347.890	3.398	20	30		EGEDHN
C#CCN1CCC[C@H](CNC(=O)c2ccc(C(C)(C)CC)cc2)C1	ZINC001023438274	1319533796	/nfs/dbraw/zinc/53/37/96/1319533796.db2.gz	RJVNDOTXXLOGQH-QGZVFWFLSA-N	0	3	326.484	3.449	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1cc2c(ccc(Cl)c2Cl)[nH]1	ZINC000818602720	1319566504	/nfs/dbraw/zinc/56/65/04/1319566504.db2.gz	AEVAOJAVSQTVTB-UHFFFAOYSA-N	0	3	338.238	3.160	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1cc(C2CC2)nc2ccc(C)cc21	ZINC000818599306	1319567174	/nfs/dbraw/zinc/56/71/74/1319567174.db2.gz	ISQSENSOCHUTLL-UHFFFAOYSA-N	0	3	335.451	3.106	20	30		EGEDHN
C#CCN(C)CCCNC(=O)CCCc1csc2ccccc12	ZINC000818606623	1319568417	/nfs/dbraw/zinc/56/84/17/1319568417.db2.gz	ZZSKOAGBKBTNMX-UHFFFAOYSA-N	0	3	328.481	3.295	20	30		EGEDHN
N#Cc1ccc([C@H](O)CNCc2ccnc(OC3CCCC3)c2)cc1	ZINC000818953640	1319587002	/nfs/dbraw/zinc/58/70/02/1319587002.db2.gz	LFRSPKFXHMEMLJ-LJQANCHMSA-N	0	3	337.423	3.098	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc3cscc3s2)C1	ZINC001023496988	1319603338	/nfs/dbraw/zinc/60/33/38/1319603338.db2.gz	UNNHLWMIKZMMOA-ZDUSSCGKSA-N	0	3	332.494	3.428	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc(C)c(Cl)c2F)C1	ZINC001023507171	1319614086	/nfs/dbraw/zinc/61/40/86/1319614086.db2.gz	PJJGKMKNHUEAMZ-AWEZNQCLSA-N	0	3	336.838	3.253	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCCN(Cc3cncc(C)c3)C2)cc1	ZINC001023527566	1319633666	/nfs/dbraw/zinc/63/36/66/1319633666.db2.gz	XOARQGYWAVRLPW-LJQANCHMSA-N	0	3	347.462	3.013	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCCN(CCC(F)(F)F)C2)cc1	ZINC001023527591	1319634256	/nfs/dbraw/zinc/63/42/56/1319634256.db2.gz	YILPBUDDAMOZJG-HNNXBMFYSA-N	0	3	338.373	3.062	20	30		EGEDHN
Cc1coc(C(=O)NC[C@@H]2CCCN(Cc3ccc(C#N)cc3)C2)c1	ZINC001023547079	1319656309	/nfs/dbraw/zinc/65/63/09/1319656309.db2.gz	CDTPGPLLKPKRRY-SFHVURJKSA-N	0	3	337.423	3.102	20	30		EGEDHN
N#CC(C(=O)CCc1nc2ccccc2o1)C(=O)Nc1ccccc1	ZINC000916898805	1319721944	/nfs/dbraw/zinc/72/19/44/1319721944.db2.gz	JWROFBWWORRUQS-AWEZNQCLSA-N	0	3	333.347	3.108	20	30		EGEDHN
Cc1nc(C)c(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)s1	ZINC000916907198	1319723610	/nfs/dbraw/zinc/72/36/10/1319723610.db2.gz	VHVIOJPOVDYMJD-JTQLQIEISA-N	0	3	333.800	3.375	20	30		EGEDHN
CC(C)(C)c1cc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)n[nH]1	ZINC000916913569	1319725383	/nfs/dbraw/zinc/72/53/83/1319725383.db2.gz	XAUWRHAHKRJRGO-SNVBAGLBSA-N	0	3	344.802	3.322	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)c1cc2c3ccccc3n(C)c2s1	ZINC000916946692	1319727622	/nfs/dbraw/zinc/72/76/22/1319727622.db2.gz	FYKLIVJESXWWJP-CYBMUJFWSA-N	0	3	339.420	3.240	20	30		EGEDHN
C#CCN(C[C@@H](O)COc1ccc(F)cc1)[C@H]1CCc2ccccc21	ZINC000917116995	1319759015	/nfs/dbraw/zinc/75/90/15/1319759015.db2.gz	CQKJPGCPXYSVPJ-NQIIRXRSSA-N	0	3	339.410	3.188	20	30		EGEDHN
N#Cc1ccccc1CNCC1CC(NC(=O)C[C@@H]2CC=CCC2)C1	ZINC000962177315	1319844376	/nfs/dbraw/zinc/84/43/76/1319844376.db2.gz	OTIZCLGBIICKPS-ZRZPHAQCSA-N	0	3	337.467	3.289	20	30		EGEDHN
C=C1CCC(C(=O)NC2CC(CNCc3nc(C)sc3C)C2)CC1	ZINC000962259346	1319886114	/nfs/dbraw/zinc/88/61/14/1319886114.db2.gz	GZCHFKNKAPEDNF-UHFFFAOYSA-N	0	3	347.528	3.491	20	30		EGEDHN
C#CCNC(=O)[C@H](C)N[C@@H](Cc1ccc(Cl)cc1)c1ccccc1	ZINC000918198469	1319933122	/nfs/dbraw/zinc/93/31/22/1319933122.db2.gz	KOYBLHHXTCNLBT-KXBFYZLASA-N	0	3	340.854	3.351	20	30		EGEDHN
C#C[C@@H](NC(=O)N(CCN(C)C)C(C)C)c1ccc(Cl)cc1F	ZINC000820743933	1319943371	/nfs/dbraw/zinc/94/33/71/1319943371.db2.gz	ANXPYMFWLLVDLQ-MRXNPFEDSA-N	0	3	339.842	3.135	20	30		EGEDHN
Cc1ccc(C)c(C(=O)N[C@@H]2[C@H]3CN(Cc4ccc(C#N)cc4)C[C@H]32)c1	ZINC000962392749	1319947692	/nfs/dbraw/zinc/94/76/92/1319947692.db2.gz	KMCLEOXVPDQMSZ-AERCQKQUSA-N	0	3	345.446	3.035	20	30		EGEDHN
C#Cc1cccc(CNC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)c1	ZINC000838586062	1320793258	/nfs/dbraw/zinc/79/32/58/1320793258.db2.gz	BKXUKWUMKFFIGF-OXJNMPFZSA-N	0	3	335.451	3.159	20	30		EGEDHN
Cc1ccc(CN(C)Cc2ccc(N3CCOCC3)cc2)cc1C#N	ZINC000859060014	1328915649	/nfs/dbraw/zinc/91/56/49/1328915649.db2.gz	MRPYYYVIHGSXFD-UHFFFAOYSA-N	0	3	335.451	3.335	20	30		EGEDHN
Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@@H]1N2C(=O)c1ncc(C#N)cc1C	ZINC000839232596	1320896611	/nfs/dbraw/zinc/89/66/11/1320896611.db2.gz	OPFDODALNKKZOB-HKUYNNGSSA-N	0	3	346.434	3.018	20	30		EGEDHN
N#CC(C(=O)NC1CCCCC1)C(=O)[C@H]1CCSc2ccccc21	ZINC000842289512	1321368102	/nfs/dbraw/zinc/36/81/02/1321368102.db2.gz	RIGNXFBPOZWNJU-JKSUJKDBSA-N	0	3	342.464	3.424	20	30		EGEDHN
C[C@@H](NC(=O)c1ccccc1)C(=O)C(C#N)c1nc(C2CC2)cs1	ZINC000842940203	1321451110	/nfs/dbraw/zinc/45/11/10/1321451110.db2.gz	YSBVMALSORQTAX-BXUZGUMPSA-N	0	3	339.420	3.015	20	30		EGEDHN
C[C@H](NC(=O)C1CCCCC1)C(=O)C(C#N)c1nc(C2CC2)cs1	ZINC000842941038	1321451605	/nfs/dbraw/zinc/45/16/05/1321451605.db2.gz	GXUIAIXLTDUQNN-FZMZJTMJSA-N	0	3	345.468	3.282	20	30		EGEDHN
CC(C)(C)N1CC[C@H]1COC(=O)c1cc2ccccc2n1CC#N	ZINC000845742583	1321740814	/nfs/dbraw/zinc/74/08/14/1321740814.db2.gz	YVHHEZBLQYPSQO-HNNXBMFYSA-N	0	3	325.412	3.194	20	30		EGEDHN
COc1cccc(/C=N\CC2CCN(Cc3ccncc3)CC2)c1O	ZINC000849169489	1322093619	/nfs/dbraw/zinc/09/36/19/1322093619.db2.gz	DDXXIMLYYWNVTI-HMAPJEAMSA-N	0	3	339.439	3.127	20	30		EGEDHN
C=CCCn1cc(CNCCc2ccc(N3CCCCC3)cc2)nn1	ZINC000850042565	1322187116	/nfs/dbraw/zinc/18/71/16/1322187116.db2.gz	ZICCYZPNZZXNCT-UHFFFAOYSA-N	0	3	339.487	3.177	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)CC2(C#N)CCCCC2)cc1	ZINC000850761399	1322285662	/nfs/dbraw/zinc/28/56/62/1322285662.db2.gz	LZFKSTHTNLLUCQ-INIZCTEOSA-N	0	3	339.395	3.207	20	30		EGEDHN
CC(=O)N[C@H](CCC(C)C)C(=O)C(C#N)c1nc(C(C)C)cs1	ZINC000850872824	1322304542	/nfs/dbraw/zinc/30/45/42/1322304542.db2.gz	GNFQOHNIIXXZQF-ZIAGYGMSSA-N	0	3	335.473	3.384	20	30		EGEDHN
Cc1n[nH]cc1CCCNCc1cc(C#N)ccc1Br	ZINC000921519788	1322337448	/nfs/dbraw/zinc/33/74/48/1322337448.db2.gz	FZJPDKZEAZXWHF-UHFFFAOYSA-N	0	3	333.233	3.075	20	30		EGEDHN
Cc1noc(C)c1CCNCc1cc(C#N)ccc1Br	ZINC000921707176	1322381621	/nfs/dbraw/zinc/38/16/21/1322381621.db2.gz	MMJDKVARTIFHTE-UHFFFAOYSA-N	0	3	334.217	3.258	20	30		EGEDHN
C#CCN(C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C)C(C)C	ZINC000922640767	1322577672	/nfs/dbraw/zinc/57/76/72/1322577672.db2.gz	ZCNSPFWEQJHHKD-KRWDZBQOSA-N	0	3	333.501	3.064	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCN(C(=O)CCC2CC2)C1	ZINC001023898557	1323011846	/nfs/dbraw/zinc/01/18/46/1323011846.db2.gz	AHGOBOVQIFUUGB-QGZVFWFLSA-N	0	3	325.456	3.077	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCN(C(=O)CCC2CC2)C1	ZINC001023898555	1323012231	/nfs/dbraw/zinc/01/22/31/1323012231.db2.gz	AHGOBOVQIFUUGB-KRWDZBQOSA-N	0	3	325.456	3.077	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@H]1CCCN(C(=O)C=C2CCC2)C1	ZINC001023927847	1323033995	/nfs/dbraw/zinc/03/39/95/1323033995.db2.gz	HCXVMLXZGFEIQS-MRXNPFEDSA-N	0	3	341.430	3.136	20	30		EGEDHN
CC(C)NC(=O)OC[C@H]1CCCCN1CCc1ccc(C#N)cc1	ZINC000852047214	1323138786	/nfs/dbraw/zinc/13/87/86/1323138786.db2.gz	YJCUEAQUOAMBMB-GOSISDBHSA-N	0	3	329.444	3.090	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H](CNCc2csc(C)n2)C1	ZINC001024138048	1323162978	/nfs/dbraw/zinc/16/29/78/1323162978.db2.gz	YTNGGBUJXRCGRU-CRAIPNDOSA-N	0	3	335.517	3.382	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001024167487	1323182353	/nfs/dbraw/zinc/18/23/53/1323182353.db2.gz	RTIWLZBZPPQCFK-SPYBWZPUSA-N	0	3	343.446	3.072	20	30		EGEDHN
CN(C(=O)c1ccoc1)C1CCC(NCc2ccccc2C#N)CC1	ZINC000963075693	1323201068	/nfs/dbraw/zinc/20/10/68/1323201068.db2.gz	NTHWXTHVKGFWIG-UHFFFAOYSA-N	0	3	337.423	3.324	20	30		EGEDHN
Cc1cc(C)cc([C@H](NC2CCN(CC#N)CC2)c2cccnc2)c1	ZINC000925001839	1323242483	/nfs/dbraw/zinc/24/24/83/1323242483.db2.gz	HJJYYGFZMSLGDJ-OAQYLSRUSA-N	0	3	334.467	3.365	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ncn2cc(Cl)ccc12	ZINC001024448259	1323407752	/nfs/dbraw/zinc/40/77/52/1323407752.db2.gz	GYAGZBYFLUIKOO-OAHLLOKOSA-N	0	3	346.862	3.148	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cnn(C(C)(C)C)c1C	ZINC001024466464	1323421824	/nfs/dbraw/zinc/42/18/24/1323421824.db2.gz	GLDMTPFEEJBHPN-INIZCTEOSA-N	0	3	332.492	3.107	20	30		EGEDHN
C=CCCN1CCCC[C@@H]1CNC(=O)c1ccc(-c2cc[nH]n2)s1	ZINC001024498565	1323446593	/nfs/dbraw/zinc/44/65/93/1323446593.db2.gz	XHYCOLKQHQYKGE-CQSZACIVSA-N	0	3	344.484	3.299	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1cc(C)c2ccccc2n1	ZINC001024511456	1323460317	/nfs/dbraw/zinc/46/03/17/1323460317.db2.gz	FXIQZPRPDWCWSI-KRWDZBQOSA-N	0	3	335.451	3.151	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cc(C)n([C@H](C)C2CC2)n1	ZINC001024518005	1323466938	/nfs/dbraw/zinc/46/69/38/1323466938.db2.gz	DYMXZRBUMFZAOO-AEFFLSMTSA-N	0	3	344.503	3.323	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccc2cc(C)ccc2n1	ZINC001024545996	1323486999	/nfs/dbraw/zinc/48/69/99/1323486999.db2.gz	SSTNURPRUFBUQH-GOSISDBHSA-N	0	3	335.451	3.151	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccc(C)nc1C1CC1	ZINC001024574977	1323511332	/nfs/dbraw/zinc/51/13/32/1323511332.db2.gz	GKVSUKRMMPQWDJ-KRWDZBQOSA-N	0	3	327.472	3.428	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccc2nc(C)n(C)c2c1	ZINC001024587739	1323523665	/nfs/dbraw/zinc/52/36/65/1323523665.db2.gz	POCKIIRTWPILSC-KRWDZBQOSA-N	0	3	340.471	3.042	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1ccccc1CC	ZINC001024624478	1323551955	/nfs/dbraw/zinc/55/19/55/1323551955.db2.gz	SKBTYDUQONTCIU-HLAWJBBLSA-N	0	3	338.495	3.347	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cn(CC)nc1C(C)C	ZINC001024685518	1323600267	/nfs/dbraw/zinc/60/02/67/1323600267.db2.gz	KCEQNSBLKYKOQB-INIZCTEOSA-N	0	3	332.492	3.187	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cccc(F)c1OCC	ZINC001024732994	1323633977	/nfs/dbraw/zinc/63/39/77/1323633977.db2.gz	YWZMFPAINCSRBB-OAHLLOKOSA-N	0	3	334.435	3.385	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1cc2ccccc2n1CC	ZINC001024810587	1323713188	/nfs/dbraw/zinc/71/31/88/1323713188.db2.gz	HDZKJOXLOXUSOW-GOSISDBHSA-N	0	3	337.467	3.269	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)[C@H]1CCCCc2ccccc21	ZINC001024816704	1323719904	/nfs/dbraw/zinc/71/99/04/1323719904.db2.gz	OOXJIPRQLCCWTP-CTNGQTDRSA-N	0	3	338.495	3.491	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)CC(F)(F)F)s1	ZINC001024887232	1323765742	/nfs/dbraw/zinc/76/57/42/1323765742.db2.gz	NTGNIRIYCHHMPV-LLVKDONJSA-N	0	3	345.390	3.043	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)c(F)c1	ZINC001024931853	1323790520	/nfs/dbraw/zinc/79/05/20/1323790520.db2.gz	JXXCFHVJOAHMRO-IAGOWNOFSA-N	0	3	343.446	3.214	20	30		EGEDHN
CC(C)(C)C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)c(F)c1	ZINC001025144700	1323920983	/nfs/dbraw/zinc/92/09/83/1323920983.db2.gz	BKLVQKAUIKMORR-MRXNPFEDSA-N	0	3	331.435	3.214	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc(F)cc1	ZINC001025190782	1323969539	/nfs/dbraw/zinc/96/95/39/1323969539.db2.gz	AZFVRUCXRFOAEL-OALUTQOASA-N	0	3	328.431	3.308	20	30		EGEDHN
C=CCC[N@H+]1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccccc1[O-]	ZINC001025202260	1323988787	/nfs/dbraw/zinc/98/87/87/1323988787.db2.gz	WHLBVEDBJWCIQI-MSOLQXFVSA-N	0	3	328.456	3.427	20	30		EGEDHN
C=CCC[N@@H+]1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccccc1[O-]	ZINC001025202260	1323988789	/nfs/dbraw/zinc/98/87/89/1323988789.db2.gz	WHLBVEDBJWCIQI-MSOLQXFVSA-N	0	3	328.456	3.427	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cnc(C)s1	ZINC001025209447	1323998145	/nfs/dbraw/zinc/99/81/45/1323998145.db2.gz	LTRWYNJVEHSLLH-HOTGVXAUSA-N	0	3	333.501	3.487	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cnc(C)s1	ZINC001025209449	1323999342	/nfs/dbraw/zinc/99/93/42/1323999342.db2.gz	LTRWYNJVEHSLLH-JKSUJKDBSA-N	0	3	333.501	3.487	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccoc1Cl	ZINC001025223999	1324011026	/nfs/dbraw/zinc/01/10/26/1324011026.db2.gz	KEVVVVPACLVSIF-HZPDHXFCSA-N	0	3	334.847	3.415	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc(C(F)F)nc1	ZINC001025238662	1324029548	/nfs/dbraw/zinc/02/95/48/1324029548.db2.gz	ULFHKSXSODCXFO-IRXDYDNUSA-N	0	3	347.409	3.112	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)CCc1ccsc1	ZINC001025239358	1324031911	/nfs/dbraw/zinc/03/19/11/1324031911.db2.gz	DLXKJDZMZPRKKF-ROUUACIJSA-N	0	3	330.497	3.159	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ncc(C)cc1OC	ZINC001025241149	1324036027	/nfs/dbraw/zinc/03/60/27/1324036027.db2.gz	VBEHYYZLLHXCCY-DLBZAZTESA-N	0	3	343.471	3.044	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cccnc1C1CC1	ZINC001025247719	1324047223	/nfs/dbraw/zinc/04/72/23/1324047223.db2.gz	PKMJFAOJEZQISD-MOPGFXCFSA-N	0	3	337.467	3.051	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(C)sc1C	ZINC001025248453	1324048730	/nfs/dbraw/zinc/04/87/30/1324048730.db2.gz	ZYIJESWTKYYPPU-ROUUACIJSA-N	0	3	330.497	3.457	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(OC)cs1	ZINC001025258409	1324066431	/nfs/dbraw/zinc/06/64/31/1324066431.db2.gz	JWWIDASLVLMWKS-HOTGVXAUSA-N	0	3	334.485	3.402	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(OC)cs1	ZINC001025258415	1324066574	/nfs/dbraw/zinc/06/65/74/1324066574.db2.gz	JWWIDASLVLMWKS-JKSUJKDBSA-N	0	3	334.485	3.402	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1nccc2ccccc21	ZINC001025261075	1324071533	/nfs/dbraw/zinc/07/15/33/1324071533.db2.gz	SXPUDKPNEIRCNK-VQTJNVASSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc(F)c(C)c1	ZINC001025261894	1324073701	/nfs/dbraw/zinc/07/37/01/1324073701.db2.gz	YZLHMNPRDNZCTE-OALUTQOASA-N	0	3	328.431	3.226	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)CCc1ccccc1C	ZINC001025273173	1324089182	/nfs/dbraw/zinc/08/91/82/1324089182.db2.gz	OFXKATIXQDZXFV-NHCUHLMSSA-N	0	3	338.495	3.406	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc(C)nc1OC	ZINC001025277798	1324099892	/nfs/dbraw/zinc/09/98/92/1324099892.db2.gz	PQYZEFDYPUJKJQ-MSOLQXFVSA-N	0	3	343.471	3.044	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ncoc1C(C)C	ZINC001025283948	1324103939	/nfs/dbraw/zinc/10/39/39/1324103939.db2.gz	CUIBBLTWCUAVQZ-HZPDHXFCSA-N	0	3	331.460	3.443	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ncoc1C(C)C	ZINC001025283950	1324104008	/nfs/dbraw/zinc/10/40/08/1324104008.db2.gz	CUIBBLTWCUAVQZ-JKSUJKDBSA-N	0	3	331.460	3.443	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cnoc1C1CC1	ZINC001025284208	1324105181	/nfs/dbraw/zinc/10/51/81/1324105181.db2.gz	FHLSVYGBMXOZEE-DLBZAZTESA-N	0	3	329.444	3.197	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cnoc1C1CC1	ZINC001025284209	1324105696	/nfs/dbraw/zinc/10/56/96/1324105696.db2.gz	FHLSVYGBMXOZEE-IAGOWNOFSA-N	0	3	329.444	3.197	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1coc(CC2CC2)n1	ZINC001025288152	1324110630	/nfs/dbraw/zinc/11/06/30/1324110630.db2.gz	SKKQFFGHCOEMDX-MSOLQXFVSA-N	0	3	343.471	3.272	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc(F)cc1F	ZINC001025295837	1324126605	/nfs/dbraw/zinc/12/66/05/1324126605.db2.gz	HOCYCWLNNYAQPL-MSOLQXFVSA-N	0	3	332.394	3.057	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)Cc1ccc(C)s1	ZINC001025301466	1324135758	/nfs/dbraw/zinc/13/57/58/1324135758.db2.gz	KEUMCQKAJATLAI-ROUUACIJSA-N	0	3	330.497	3.078	20	30		EGEDHN
C[C@H](NC(=O)c1ccco1)[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001025320605	1324158185	/nfs/dbraw/zinc/15/81/85/1324158185.db2.gz	NQQLDZAEFWWYJK-MAUKXSAKSA-N	0	3	337.423	3.182	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(C(F)F)ccc2F)C1	ZINC001025423422	1324256704	/nfs/dbraw/zinc/25/67/04/1324256704.db2.gz	RSRLALQQNPMVJS-TZMCWYRMSA-N	0	3	338.373	3.227	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cccc3ccc(C)nc32)C1	ZINC001025457273	1324298512	/nfs/dbraw/zinc/29/85/12/1324298512.db2.gz	ULCFVTZVWLROOM-FUHWJXTLSA-N	0	3	335.451	3.007	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(C)n(C(CC)CC)n2)C1	ZINC001025460649	1324306429	/nfs/dbraw/zinc/30/64/29/1324306429.db2.gz	KPCPYZLWGRCQPF-IRXDYDNUSA-N	0	3	344.503	3.016	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(C)n(C(CC)CC)n2)C1	ZINC001025460647	1324306633	/nfs/dbraw/zinc/30/66/33/1324306633.db2.gz	KPCPYZLWGRCQPF-DLBZAZTESA-N	0	3	344.503	3.016	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(C)nn2C(CC)CC)C1	ZINC001025462060	1324307497	/nfs/dbraw/zinc/30/74/97/1324307497.db2.gz	AHZLMWJRJPBGHS-DLBZAZTESA-N	0	3	344.503	3.016	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2sc(C)nc2CC(C)C)C1	ZINC001025472214	1324318281	/nfs/dbraw/zinc/31/82/81/1324318281.db2.gz	OKNMXYFSIFRORZ-HOCLYGCPSA-N	0	3	347.528	3.114	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccccc2-n2cccc2)C1	ZINC001025521652	1324365065	/nfs/dbraw/zinc/36/50/65/1324365065.db2.gz	CUAXWBJAQXIUBB-MOPGFXCFSA-N	0	3	349.478	3.331	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(F)cc(Cl)c2)C1	ZINC001025539555	1324386056	/nfs/dbraw/zinc/38/60/56/1324386056.db2.gz	OYQREFWYVQCQAP-UONOGXRCSA-N	0	3	336.838	3.333	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC001025605780	1324454456	/nfs/dbraw/zinc/45/44/56/1324454456.db2.gz	CFSGORHNLDXNBQ-WMZOPIPTSA-N	0	3	326.484	3.448	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(F)c(F)cc2Cl)C1	ZINC001025609735	1324460200	/nfs/dbraw/zinc/46/02/00/1324460200.db2.gz	HOYASLIJIIEAFU-NEPJUHHUSA-N	0	3	340.801	3.082	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2coc3ccc(F)cc23)C1	ZINC001025609346	1324460463	/nfs/dbraw/zinc/46/04/63/1324460463.db2.gz	NYGSANQWJCVLEJ-UONOGXRCSA-N	0	3	328.387	3.035	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(OCC(C)C)cc2)C1	ZINC001025611599	1324464111	/nfs/dbraw/zinc/46/41/11/1324464111.db2.gz	MTRAWGUDRDHZBV-MJGOQNOKSA-N	0	3	342.483	3.185	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(F)c3occc32)C1	ZINC001025623577	1324473283	/nfs/dbraw/zinc/47/32/83/1324473283.db2.gz	FRHMJWKBIOFZTM-GJZGRUSLSA-N	0	3	342.414	3.426	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc3cccc(F)c3o2)C1	ZINC001025624262	1324474459	/nfs/dbraw/zinc/47/44/59/1324474459.db2.gz	CFPIXWJYMQVBEP-ZFWWWQNUSA-N	0	3	328.387	3.035	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(C)c3c2CCC3)C1	ZINC001025629767	1324481335	/nfs/dbraw/zinc/48/13/35/1324481335.db2.gz	KJYIYAFXFDWSCN-QZTJIDSGSA-N	0	3	338.495	3.337	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)C23CC(C(C)(C)C)(C2)C3)C1	ZINC001025632685	1324484870	/nfs/dbraw/zinc/48/48/70/1324484870.db2.gz	NEJPLVPYEAPITA-FBIZOPLVSA-N	0	3	330.516	3.443	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2c[nH]c3ccc(F)cc23)C1	ZINC001025635608	1324487961	/nfs/dbraw/zinc/48/79/61/1324487961.db2.gz	SSFXXNAINQPNQM-HUUCEWRRSA-N	0	3	341.430	3.161	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(C(C)(F)F)cc2)C1	ZINC001025637505	1324489531	/nfs/dbraw/zinc/48/95/31/1324489531.db2.gz	UYXGKLFNPJBKBM-GDBMZVCRSA-N	0	3	334.410	3.262	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H]3CC[C@H](NCc4cscn4)[C@@H]3C2)CC1	ZINC001026346151	1324743014	/nfs/dbraw/zinc/74/30/14/1324743014.db2.gz	FAJDSVMWKWUZRQ-JQHSSLGASA-N	0	3	345.512	3.216	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)[C@]23C[C@H]2CCC3)CC1	ZINC001026530740	1324870852	/nfs/dbraw/zinc/87/08/52/1324870852.db2.gz	DRLUXDAPCWNTMC-UWLZSVRSSA-N	0	3	341.293	3.102	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCN(C(=O)CC2CCCC2)C1	ZINC001026656805	1324955140	/nfs/dbraw/zinc/95/51/40/1324955140.db2.gz	WPZUYAKSQXIZTR-QGZVFWFLSA-N	0	3	325.456	3.077	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCN(C(=O)C=C2CCCCC2)C1	ZINC001026718339	1324990879	/nfs/dbraw/zinc/99/08/79/1324990879.db2.gz	XPHUNDFOOICQJR-GOSISDBHSA-N	0	3	337.467	3.387	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)CC(F)(F)F)C1	ZINC000963272031	1325050847	/nfs/dbraw/zinc/05/08/47/1325050847.db2.gz	RBYPXSGVLJZLPT-QWHCGFSZSA-N	0	3	338.801	3.394	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1CC[C@@H](CNCc2ccccc2C#N)C1	ZINC001026864696	1325052716	/nfs/dbraw/zinc/05/27/16/1325052716.db2.gz	NDHKXBGRYSVQRW-INIZCTEOSA-N	0	3	327.472	3.179	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@@H](CNCc2cc(F)ccc2C#N)C1)C(C)(C)C	ZINC001026921254	1325084116	/nfs/dbraw/zinc/08/41/16/1325084116.db2.gz	PEOPTGRKEJQHRZ-GJZGRUSLSA-N	0	3	345.462	3.318	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)C[C@@H]2CC=CCC2)C1	ZINC001026999311	1325137700	/nfs/dbraw/zinc/13/77/00/1325137700.db2.gz	SPANAYIIGQQQKZ-MSOLQXFVSA-N	0	3	337.467	3.243	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCN(C(=O)c2cc[nH]c2C2CC2)C1	ZINC001027024998	1325161176	/nfs/dbraw/zinc/16/11/76/1325161176.db2.gz	UDKUAAJVCDZQLG-OAHLLOKOSA-N	0	3	348.450	3.016	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](CNCc2nc(C)sc2C)C1	ZINC001027037878	1325172275	/nfs/dbraw/zinc/17/22/75/1325172275.db2.gz	DDDZVIHXKKATBV-MAUKXSAKSA-N	0	3	335.517	3.300	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](CNCc2nc(C)c(C)s2)C1	ZINC001027039073	1325173254	/nfs/dbraw/zinc/17/32/54/1325173254.db2.gz	VGBGZZBKXFFCRV-MAUKXSAKSA-N	0	3	335.517	3.300	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H](CNCc2cc(C3CC3)no2)C1	ZINC001027041103	1325176075	/nfs/dbraw/zinc/17/60/75/1325176075.db2.gz	PGBAYVCQEZXOOM-AUUYWEPGSA-N	0	3	331.460	3.092	20	30		EGEDHN
CC(C)C1(C(=O)N2CC[C@H](CNCc3cc(F)ccc3C#N)C2)CC1	ZINC001027051011	1325189002	/nfs/dbraw/zinc/18/90/02/1325189002.db2.gz	PAPVZLWEATUSJE-OAHLLOKOSA-N	0	3	343.446	3.072	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCN(C(=O)c2c[nH]cc2C2CC2)C1	ZINC001027148643	1325252557	/nfs/dbraw/zinc/25/25/57/1325252557.db2.gz	INQRHMDIMQLONO-OAHLLOKOSA-N	0	3	348.450	3.016	20	30		EGEDHN
C#C[C@](C)(CC)NC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F	ZINC000854704441	1325297082	/nfs/dbraw/zinc/29/70/82/1325297082.db2.gz	SDPRWPAZPAPEAR-FUHWJXTLSA-N	0	3	334.410	3.062	20	30		EGEDHN
C[C@H](CC(C)(C)C#N)N[C@@H]1CCCN(Cc2ccc(F)cc2F)C1=O	ZINC000926255906	1325493166	/nfs/dbraw/zinc/49/31/66/1325493166.db2.gz	NKHIZLGROIVVJX-CXAGYDPISA-N	0	3	349.425	3.374	20	30		EGEDHN
C=CC[C@@H](NCc1cc(C(=O)OC)c2n1CCCC2)c1ccncc1	ZINC000856771009	1325521615	/nfs/dbraw/zinc/52/16/15/1325521615.db2.gz	VSTNAQQXRHNEBF-GOSISDBHSA-N	0	3	339.439	3.413	20	30		EGEDHN
CN(Cc1ccc(C#N)c(F)c1)[C@H]1CCCN(C(=O)[C@H]2CC2(C)C)C1	ZINC001027373240	1325567149	/nfs/dbraw/zinc/56/71/49/1325567149.db2.gz	IUEOSVBLYSNYRU-DLBZAZTESA-N	0	3	343.446	3.166	20	30		EGEDHN
C[C@]1(C(=O)NC2CC3(CC(NCc4ccccc4C#N)C3)C2)C=CCC1	ZINC000964617463	1325582075	/nfs/dbraw/zinc/58/20/75/1325582075.db2.gz	JWGQTZHEYDJHKO-UWBXQEPYSA-N	0	3	349.478	3.432	20	30		EGEDHN
C[C@H]1O[C@@H](C)[C@@H](C)[C@H]1C(=O)C(C#N)C(=O)Nc1ccccc1Cl	ZINC000860469573	1329321317	/nfs/dbraw/zinc/32/13/17/1329321317.db2.gz	IUGQMCVQIXDUDP-VNUHZKFNSA-N	0	3	334.803	3.047	20	30		EGEDHN
CCC[C@H](OCC)C(=O)C(C#N)C(=O)N[C@H](CC)c1ccccc1	ZINC000860696109	1329345332	/nfs/dbraw/zinc/34/53/32/1329345332.db2.gz	YHKVPLIQJWDMFP-ZACQAIPSSA-N	0	3	330.428	3.168	20	30		EGEDHN
Cc1cc(CN(C)[C@H]2CCCN(C(=O)C#CC3CC3)C2)c(C)s1	ZINC001027401113	1327622299	/nfs/dbraw/zinc/62/22/99/1327622299.db2.gz	AVQXEYDEJYLPBX-SFHVURJKSA-N	0	3	330.497	3.201	20	30		EGEDHN
CN(Cc1cccc(C(F)F)c1)[C@H]1CCCN(C(=O)C#CC2CC2)C1	ZINC001027406422	1327631651	/nfs/dbraw/zinc/63/16/51/1327631651.db2.gz	RCXFATZXLWIFOH-SFHVURJKSA-N	0	3	346.421	3.460	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)C2(F)CCCC2)C1	ZINC001027469694	1327724965	/nfs/dbraw/zinc/72/49/65/1327724965.db2.gz	HRALLFOYGLQRCB-GOSISDBHSA-N	0	3	343.446	3.263	20	30		EGEDHN
C[C@H]1C[C@H]1CC(=O)NC1CC2(CC(NCc3ccccc3C#N)C2)C1	ZINC000964853834	1327730927	/nfs/dbraw/zinc/73/09/27/1327730927.db2.gz	QIPNCXZFBHNIMQ-RXFSGBHDSA-N	0	3	337.467	3.121	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](N(C)Cc2ccccc2N(C)C)C1	ZINC001027522599	1327795303	/nfs/dbraw/zinc/79/53/03/1327795303.db2.gz	XZMFHPUTLZFNGL-GOSISDBHSA-N	0	3	343.515	3.388	20	30		EGEDHN
C=C1CC(C)(C(=O)NC2CC3(CC(NCc4ncc(C)s4)C3)C2)C1	ZINC000964960816	1327796136	/nfs/dbraw/zinc/79/61/36/1327796136.db2.gz	RHBJZEBTYCQAFV-UHFFFAOYSA-N	0	3	345.512	3.325	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1cc(CCC)on1)C2	ZINC000965699419	1328021214	/nfs/dbraw/zinc/02/12/14/1328021214.db2.gz	ZFCKOXZVUZKVDG-UHFFFAOYSA-N	0	3	337.851	3.010	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)c2csc3c2CC[C@@H](C)C3)C1	ZINC001027669839	1328064111	/nfs/dbraw/zinc/06/41/11/1328064111.db2.gz	DJLRMRGAGDOGMY-CABCVRRESA-N	0	3	330.497	3.043	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H]1CNC(=O)c1cnc([C@@H](C)OC)s1	ZINC001027886226	1328353973	/nfs/dbraw/zinc/35/39/73/1328353973.db2.gz	PJWHDPGYNKRKEE-ZIAGYGMSSA-N	0	3	337.489	3.011	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1cc(F)cc2ccncc21	ZINC001027890134	1328356398	/nfs/dbraw/zinc/35/63/98/1328356398.db2.gz	QDEIBTOOWSPZJJ-MRXNPFEDSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2ccccc2-c2cn[nH]c2)C1	ZINC000966637856	1328363821	/nfs/dbraw/zinc/36/38/21/1328363821.db2.gz	ZFUWSHLINXFGSR-BEFAXECRSA-N	0	3	338.455	3.093	20	30		EGEDHN
C#CCCN1CCC[C@H]1CNC(=O)c1ccccc1CC(C)(C)C	ZINC001027956817	1328426943	/nfs/dbraw/zinc/42/69/43/1328426943.db2.gz	OSGJNVQXSIICQF-SFHVURJKSA-N	0	3	326.484	3.493	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1ccc(-c2cnco2)cc1	ZINC001027972471	1328445961	/nfs/dbraw/zinc/44/59/61/1328445961.db2.gz	BJFYELOYNUKOLG-KRWDZBQOSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2nc(C(C)(C)C)cs2)C1	ZINC000966874131	1328447486	/nfs/dbraw/zinc/44/74/86/1328447486.db2.gz	CSVSJVVEJYSLOM-KBPBESRZSA-N	0	3	335.517	3.457	20	30		EGEDHN
OCCN1CCC(N=Nc2ccc(OCc3ccccc3)cc2)CC1	ZINC000863160715	1329531321	/nfs/dbraw/zinc/53/13/21/1329531321.db2.gz	PRMNYIXROLHQKY-UHFFFAOYSA-N	0	3	339.439	3.122	20	30		EGEDHN
Cc1ccc(C#N)cc1C(=O)Nc1cccc(CN2CCC(O)CC2)c1	ZINC000934193728	1329954010	/nfs/dbraw/zinc/95/40/10/1329954010.db2.gz	METAGAXDSXQOHN-UHFFFAOYSA-N	0	3	349.434	3.076	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@@H](N[C@@H](c3ccncc3)C3CC3)C2=O)cc1	ZINC000934695926	1330000611	/nfs/dbraw/zinc/00/06/11/1330000611.db2.gz	DUDBFSCCQUPLOP-WOJBJXKFSA-N	0	3	346.434	3.190	20	30		EGEDHN
N#C[C@H]1CC[C@H](N2CCC(NC(=O)OCc3ccccc3)CC2)C1	ZINC000866592635	1330130525	/nfs/dbraw/zinc/13/05/25/1330130525.db2.gz	RHYLLNKYVNQDQX-WMZOPIPTSA-N	0	3	327.428	3.069	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cc(C(F)(F)F)c(F)cc2C)CC1	ZINC000868532459	1330290992	/nfs/dbraw/zinc/29/09/92/1330290992.db2.gz	OLHGNXOCAHUAPD-UHFFFAOYSA-N	0	3	342.336	3.437	20	30		EGEDHN
CC(C)C1(C(=O)N2C[C@@H](C)[C@H](NCc3ccc(C#N)c(F)c3)C2)CC1	ZINC000939098949	1330376211	/nfs/dbraw/zinc/37/62/11/1330376211.db2.gz	XZZOVBQPYRHYDL-RDTXWAMCSA-N	0	3	343.446	3.070	20	30		EGEDHN
CC1(C(=O)N[C@H]2CCN(Cc3ccc(C#N)cc3)CC2(C)C)CC1	ZINC000940769280	1331184546	/nfs/dbraw/zinc/18/45/46/1331184546.db2.gz	UFGFHVGTMLRSDE-KRWDZBQOSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@@H]1CN(Cc2cccc(C#N)c2)CC[C@@H]1NC(=O)C1(C2CC2)CC1	ZINC000942161820	1331853202	/nfs/dbraw/zinc/85/32/02/1331853202.db2.gz	SVLUHFPWHOZGQV-BEFAXECRSA-N	0	3	337.467	3.075	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc3ccc(C)nc32)[C@H](C)C1	ZINC000942168658	1331857450	/nfs/dbraw/zinc/85/74/50/1331857450.db2.gz	YBSYPUHPIQTPKE-BEFAXECRSA-N	0	3	335.451	3.007	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2c(C)occ2C(F)(F)F)[C@H](C)C1	ZINC000942518107	1331950339	/nfs/dbraw/zinc/95/03/39/1331950339.db2.gz	MEYCAFMJIKQNHH-ZWNOBZJWSA-N	0	3	330.350	3.233	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3cccc(F)c3)CCC2)[C@H](C)C1	ZINC000942546835	1331968225	/nfs/dbraw/zinc/96/82/25/1331968225.db2.gz	BGOYOPRFNJCLOQ-VQIMIIECSA-N	0	3	342.458	3.097	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(CCC(F)(F)F)C[C@@H]2C)cc1	ZINC000942553852	1331970905	/nfs/dbraw/zinc/97/09/05/1331970905.db2.gz	UXEKIQOUPLPCHK-XJKSGUPXSA-N	0	3	338.373	3.061	20	30		EGEDHN
C[C@@H]1CN(Cc2cccc(C#N)c2)CC[C@@H]1NC(=O)C(C)(C)C1CC1	ZINC000942572556	1331982786	/nfs/dbraw/zinc/98/27/86/1331982786.db2.gz	VLDSKCUQHBHMHZ-BEFAXECRSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccc(F)c3ccncc23)[C@@H](C)C1	ZINC000942574897	1331984070	/nfs/dbraw/zinc/98/40/70/1331984070.db2.gz	OGJYPLHXSCUEBD-SCLBCKFNSA-N	0	3	327.403	3.000	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCN(Cc3cnccc3C)C[C@H]2C)CC1	ZINC000942599628	1331996408	/nfs/dbraw/zinc/99/64/08/1331996408.db2.gz	BZQPFWZXZQMWHF-XLIONFOSSA-N	0	3	341.499	3.463	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccccc2OC2CCC2)[C@H](C)C1	ZINC000942700126	1332022236	/nfs/dbraw/zinc/02/22/36/1332022236.db2.gz	NBEQRHKBXFANNW-VQIMIIECSA-N	0	3	340.467	3.081	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2c(F)ccc(F)c2Cl)[C@H](C)C1	ZINC000942959757	1332067306	/nfs/dbraw/zinc/06/73/06/1332067306.db2.gz	NPHHCLYYXAMMMP-ZWNOBZJWSA-N	0	3	328.790	3.244	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ncc(Cl)cc2Cl)[C@@H](C)C1	ZINC000943767064	1332259228	/nfs/dbraw/zinc/25/92/28/1332259228.db2.gz	QLCNUVVVULZETE-GXFFZTMASA-N	0	3	328.243	3.015	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnn(C3CCCCC3)c2)[C@@H](C)C1	ZINC000944016738	1332308547	/nfs/dbraw/zinc/30/85/47/1332308547.db2.gz	NJNICVPQCQCHOY-YJBOKZPZSA-N	0	3	330.476	3.015	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccccc2C(F)(F)F)[C@H](C)C1	ZINC000944266207	1332357808	/nfs/dbraw/zinc/35/78/08/1332357808.db2.gz	XRGXWWCEDBFCGB-CJNGLKHVSA-N	0	3	338.373	3.169	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C23CC4CC(CC(C4)C2)C3)[C@@H](C)C1	ZINC000944282797	1332362897	/nfs/dbraw/zinc/36/28/97/1332362897.db2.gz	YZVRJHTZPAMGMP-VJRVKHOTSA-N	0	3	328.500	3.053	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C23CC4CC(CC(C4)C2)C3)[C@H](C)C1	ZINC000944282794	1332362970	/nfs/dbraw/zinc/36/29/70/1332362970.db2.gz	YZVRJHTZPAMGMP-AGWGEYTISA-N	0	3	328.500	3.053	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(F)c(F)cc2Cl)[C@@H](C)C1	ZINC000944617943	1332417898	/nfs/dbraw/zinc/41/78/98/1332417898.db2.gz	ABYLTUQQXYKRER-ZUZCIYMTSA-N	0	3	328.790	3.244	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(F)c3occc32)[C@@H](C)C1	ZINC000945030133	1332481418	/nfs/dbraw/zinc/48/14/18/1332481418.db2.gz	WMWVFCXTXKEGPJ-GUYCJALGSA-N	0	3	328.387	3.035	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2coc(C3CCCCC3)n2)[C@H](C)C1	ZINC000945219708	1332534114	/nfs/dbraw/zinc/53/41/14/1332534114.db2.gz	DLTIXOBRHAEAAY-WBVHZDCISA-N	0	3	343.471	3.186	20	30		EGEDHN
N#Cc1ccccc1CN1C[C@@H]2CCN(C(=O)[C@H]3CC34CC4)CC[C@@H]2C1	ZINC000946797761	1332900855	/nfs/dbraw/zinc/90/08/55/1332900855.db2.gz	JIHLZWSEQRFQSS-HSALFYBXSA-N	0	3	349.478	3.029	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3cnoc3C3CC3)CC[C@@H]2C1	ZINC000946846314	1332913615	/nfs/dbraw/zinc/91/36/15/1332913615.db2.gz	VTDZBQKIHNYROC-GASCZTMLSA-N	0	3	349.862	3.089	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)C2CCCC2)CCN1Cc1ccc(C#N)cc1	ZINC000946972108	1332949459	/nfs/dbraw/zinc/94/94/59/1332949459.db2.gz	WKWJZJZNWWQOOB-BEFAXECRSA-N	0	3	325.456	3.218	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2ccc(C#N)[nH]2)CCN1C/C=C\c1ccccc1	ZINC000947215880	1333053885	/nfs/dbraw/zinc/05/38/85/1333053885.db2.gz	BOWYACLFGNVZCM-YZJPHSQXSA-N	0	3	348.450	3.182	20	30		EGEDHN
Cc1cc(C(=O)N[C@H]2CCN(Cc3ccc(C#N)cc3)[C@@H](C)C2)co1	ZINC000947245269	1333063465	/nfs/dbraw/zinc/06/34/65/1333063465.db2.gz	ROOPOSPABRBZID-LIRRHRJNSA-N	0	3	337.423	3.243	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ncoc2-c2ccccc2)C[C@H]1C	ZINC000947371550	1333107116	/nfs/dbraw/zinc/10/71/16/1333107116.db2.gz	ZWHOTIDSSFLKOV-GDBMZVCRSA-N	0	3	325.412	3.110	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cn(C)c3ccc(F)cc23)C[C@@H]1C	ZINC000947399575	1333115480	/nfs/dbraw/zinc/11/54/80/1333115480.db2.gz	HGZPRVAYUGVGDA-DZGCQCFKSA-N	0	3	329.419	3.086	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccc(-c3cnco3)cc2)C[C@@H]1C	ZINC000947450766	1333133537	/nfs/dbraw/zinc/13/35/37/1333133537.db2.gz	YNXFBCRWWCFHDZ-WMLDXEAASA-N	0	3	325.412	3.110	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccc3c(C)c(C)[nH]c32)C[C@@H]1C	ZINC000947454169	1333134002	/nfs/dbraw/zinc/13/40/02/1333134002.db2.gz	FSEDOFPBWZGIOS-WMLDXEAASA-N	0	3	337.467	3.391	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2coc3ccc(OC)cc23)C[C@@H]1C	ZINC000947536993	1333161724	/nfs/dbraw/zinc/16/17/24/1333161724.db2.gz	KPXNDQQHXHOEMZ-LSDHHAIUSA-N	0	3	340.423	3.047	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc(C3CCC3)cc2)C[C@@H]1C	ZINC000947584024	1333181792	/nfs/dbraw/zinc/18/17/92/1333181792.db2.gz	COYXXGBIOUEVHB-LAUBAEHRSA-N	0	3	338.495	3.489	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3ccc(F)cc3)CCC2)C[C@H]1C	ZINC000947597466	1333187969	/nfs/dbraw/zinc/18/79/69/1333187969.db2.gz	HHLKWCFIDGMMDH-VQIMIIECSA-N	0	3	342.458	3.240	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2sccc2-n2cccc2)C[C@@H]1C	ZINC000947597545	1333188301	/nfs/dbraw/zinc/18/83/01/1333188301.db2.gz	ICDWOCBSONZFEW-LSDHHAIUSA-N	0	3	329.469	3.308	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2nc(Cl)sc2Cl)C[C@@H]1C	ZINC000947610940	1333191222	/nfs/dbraw/zinc/19/12/22/1333191222.db2.gz	DAYACAGIAZHURA-IUCAKERBSA-N	0	3	334.272	3.219	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3cccnc3C)[C@@H](C)C2)C1	ZINC000947703457	1333233700	/nfs/dbraw/zinc/23/37/00/1333233700.db2.gz	YVODJMNEPVCAJL-YJBOKZPZSA-N	0	3	327.472	3.215	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3scnc3C)[C@H](C)C2)C1	ZINC000947702891	1333233884	/nfs/dbraw/zinc/23/38/84/1333233884.db2.gz	UJNBSZHTJWPQKV-UKRRQHHQSA-N	0	3	333.501	3.277	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cccc(Cl)c2F)C[C@@H]1C	ZINC000947751477	1333250929	/nfs/dbraw/zinc/25/09/29/1333250929.db2.gz	YDCHYVWYUTWRBG-ZFWWWQNUSA-N	0	3	336.838	3.014	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2csc(C(C)(C)C)n2)C[C@H]1C	ZINC000947810578	1333267761	/nfs/dbraw/zinc/26/77/61/1333267761.db2.gz	MLEXNQPROQIYOL-KGLIPLIRSA-N	0	3	333.501	3.047	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc3nc(C)ccc3c2)C[C@H]1C	ZINC000947845201	1333276707	/nfs/dbraw/zinc/27/67/07/1333276707.db2.gz	GOLPHQCIGKOKTI-APWZRJJASA-N	0	3	335.451	3.149	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnn(CCCC)c2CC)C[C@@H]1C	ZINC000947908219	1333302124	/nfs/dbraw/zinc/30/21/24/1333302124.db2.gz	QCTARMSTLOASEP-JKSUJKDBSA-N	0	3	332.492	3.014	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2[nH]ccc2-c2ccccc2)C[C@H]1C	ZINC000947916363	1333306375	/nfs/dbraw/zinc/30/63/75/1333306375.db2.gz	QMWZNILNXQVTJO-AEFFLSMTSA-N	0	3	335.451	3.288	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3ccccc3F)CCC2)C[C@H]1C	ZINC000947917342	1333306562	/nfs/dbraw/zinc/30/65/62/1333306562.db2.gz	VYOAFPVVJGUPIC-SJORKVTESA-N	0	3	342.458	3.240	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2c[nH]c3cccc(C)c23)C[C@@H]1C	ZINC000947934279	1333311423	/nfs/dbraw/zinc/31/14/23/1333311423.db2.gz	KBBYXNONCYKODW-WMZOPIPTSA-N	0	3	337.467	3.011	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2c[nH]c3cccc(C)c23)C[C@H]1C	ZINC000947934278	1333311429	/nfs/dbraw/zinc/31/14/29/1333311429.db2.gz	KBBYXNONCYKODW-SJLPKXTDSA-N	0	3	337.467	3.011	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)C[C@@H]1C	ZINC000947963260	1333322803	/nfs/dbraw/zinc/32/28/03/1333322803.db2.gz	SJJPGMHEEOIQHN-SWLSCSKDSA-N	0	3	326.362	3.474	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C23CC4CC(CC(C4)C2)C3)C[C@H]1C	ZINC000947966434	1333323437	/nfs/dbraw/zinc/32/34/37/1333323437.db2.gz	ASNZERARSDUTPH-AGWGEYTISA-N	0	3	328.500	3.195	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3ccc(Cl)cc3)CC2)C[C@H]1C	ZINC000948001630	1333337875	/nfs/dbraw/zinc/33/78/75/1333337875.db2.gz	CNMLKZFZDHDRAM-CRAIPNDOSA-N	0	3	344.886	3.364	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3c(s2)CCCC3)C[C@H]1C	ZINC000948001737	1333338463	/nfs/dbraw/zinc/33/84/63/1333338463.db2.gz	FAAXAILKVLAOPJ-ZBFHGGJFSA-N	0	3	330.497	3.233	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2csc3c2CCCC3)C[C@H]1C	ZINC000948008136	1333340437	/nfs/dbraw/zinc/34/04/37/1333340437.db2.gz	ZYHSOPGKXHEFKJ-HUUCEWRRSA-N	0	3	330.497	3.233	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3cccc(F)c3o2)C[C@H]1C	ZINC000948064435	1333361019	/nfs/dbraw/zinc/36/10/19/1333361019.db2.gz	CNWIMVNMIAHVBP-HIFRSBDPSA-N	0	3	328.387	3.178	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(Cl)cc3c2OCC3)C[C@@H]1C	ZINC000948079132	1333368755	/nfs/dbraw/zinc/36/87/55/1333368755.db2.gz	UCRXKVJDYHISEL-WFASDCNBSA-N	0	3	334.847	3.044	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(N(C)CCC)cc2)C[C@H]1C	ZINC000948095305	1333373110	/nfs/dbraw/zinc/37/31/10/1333373110.db2.gz	VCHDDGYRSUOFSO-MJGOQNOKSA-N	0	3	341.499	3.139	20	30		EGEDHN
CN(C(=O)c1cccnc1)[C@@H]1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC000948128071	1333382076	/nfs/dbraw/zinc/38/20/76/1333382076.db2.gz	IJVIHCZRVBOAAW-HXUWFJFHSA-N	0	3	348.450	3.080	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2ccc(C(C)(C)C)cn2)CC1	ZINC000948382258	1333503584	/nfs/dbraw/zinc/50/35/84/1333503584.db2.gz	YKJRHURKDAUSAX-GOSISDBHSA-N	0	3	341.499	3.329	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)Cc2ccc3cccnc3c2)CC1	ZINC000948543429	1333565372	/nfs/dbraw/zinc/56/53/72/1333565372.db2.gz	ZLMJBHNZEVGQSC-HXUWFJFHSA-N	0	3	349.478	3.114	20	30		EGEDHN
C=CCOc1ccc(C(=O)N(C)[C@@H]2CCCN(CC#CC)CC2)cc1	ZINC000948560446	1333576671	/nfs/dbraw/zinc/57/66/71/1333576671.db2.gz	BAYCNIPVDHGHTI-LJQANCHMSA-N	0	3	340.467	3.201	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cc(C)n([C@@H](C)CC)n2)CC1	ZINC000948570230	1333580096	/nfs/dbraw/zinc/58/00/96/1333580096.db2.gz	ITAOLTKUCUQJCW-FUHWJXTLSA-N	0	3	344.503	3.112	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2cn(CC)c3ccccc23)CC1	ZINC000948602893	1333592705	/nfs/dbraw/zinc/59/27/05/1333592705.db2.gz	XPBPYQIKXWBSHJ-QGZVFWFLSA-N	0	3	337.467	3.221	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2coc3ccc(OC)cc23)CC1	ZINC000948605800	1333593892	/nfs/dbraw/zinc/59/38/92/1333593892.db2.gz	UYEHVMDIFJYRAK-OAHLLOKOSA-N	0	3	340.423	3.001	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)[C@H](C)c2c(F)cccc2F)CC1	ZINC000948620808	1333599967	/nfs/dbraw/zinc/59/99/67/1333599967.db2.gz	IQFHQXIZFMOKKL-CABCVRRESA-N	0	3	334.410	3.014	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cnc3ccccc3c2C)CC1	ZINC000948625687	1333601886	/nfs/dbraw/zinc/60/18/86/1333601886.db2.gz	SHWZNYSLUMSETK-GOSISDBHSA-N	0	3	349.478	3.493	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2ccc(C)nc2C(C)C)CC1	ZINC000948656358	1333616025	/nfs/dbraw/zinc/61/60/25/1333616025.db2.gz	XKVXVQGMWWRIAK-GOSISDBHSA-N	0	3	341.499	3.463	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2sccc2-n2cccc2)CC1	ZINC000948659253	1333616715	/nfs/dbraw/zinc/61/67/15/1333616715.db2.gz	VTACSDRADZCKAR-INIZCTEOSA-N	0	3	341.480	3.099	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2ccc(C(C)C)cn2)CC1	ZINC000948775443	1333673781	/nfs/dbraw/zinc/67/37/81/1333673781.db2.gz	IRCIVOJRAKUDEG-GOSISDBHSA-N	0	3	327.472	3.155	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)C(C)(C)c2ccccc2F)CC1	ZINC000948861628	1333713150	/nfs/dbraw/zinc/71/31/50/1333713150.db2.gz	QKWXKHKRALUSQO-MRXNPFEDSA-N	0	3	330.447	3.049	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2ccc3cccnc3c2)CC1	ZINC000948864325	1333713791	/nfs/dbraw/zinc/71/37/91/1333713791.db2.gz	CHNOWNSJBUJFNI-IBGZPJMESA-N	0	3	335.451	3.185	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)C[C@H]2CCc3ccccc32)CC1	ZINC000948868543	1333715240	/nfs/dbraw/zinc/71/52/40/1333715240.db2.gz	ONAUJUAAFPGSKV-WOJBJXKFSA-N	0	3	338.495	3.443	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@@H]1CNC(=O)c1cccn1C	ZINC000948889583	1333720463	/nfs/dbraw/zinc/72/04/63/1333720463.db2.gz	AOLISPVVNQHYMY-FQEVSTJZSA-N	0	3	337.467	3.321	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@@H]1CNC(=O)c1cnc(C)[nH]1	ZINC000948899554	1333725181	/nfs/dbraw/zinc/72/51/81/1333725181.db2.gz	ZGZYKUBUFLRXNS-IBGZPJMESA-N	0	3	338.455	3.014	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@H]1CNC(=O)c1ccn(C)c1C	ZINC000948958213	1333747525	/nfs/dbraw/zinc/74/75/25/1333747525.db2.gz	LSPAWNJIFWYUBX-HXUWFJFHSA-N	0	3	337.467	3.239	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@@H]1CNC(=O)c1ccnc(C)c1	ZINC000948974561	1333753047	/nfs/dbraw/zinc/75/30/47/1333753047.db2.gz	ICUQFESADIKTGD-FQEVSTJZSA-N	0	3	335.451	3.295	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1CCCC[C@@H]1C1CC1)CCO2	ZINC000949141446	1333783696	/nfs/dbraw/zinc/78/36/96/1333783696.db2.gz	CBSGGKWBQCOMAQ-MOPGFXCFSA-N	0	3	346.515	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)c3sccc3C)CC2)C1	ZINC000949282362	1333814181	/nfs/dbraw/zinc/81/41/81/1333814181.db2.gz	DOYJGJQUKINMIR-UHFFFAOYSA-N	0	3	348.512	3.330	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C3CCCCCC3)CC2)C1	ZINC000949317193	1333823262	/nfs/dbraw/zinc/82/32/62/1333823262.db2.gz	HSALQLKJVRAXQK-UHFFFAOYSA-N	0	3	334.504	3.226	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC2(CC1)CN(CCC(C)C)CCO2	ZINC000949433489	1333845879	/nfs/dbraw/zinc/84/58/79/1333845879.db2.gz	WWUWEGRYFFRQIL-UHFFFAOYSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3ccc(F)c(C)c3)CC2)C1	ZINC000949451439	1333850462	/nfs/dbraw/zinc/85/04/62/1333850462.db2.gz	ZERZHRVOQGYPIR-UHFFFAOYSA-N	0	3	346.446	3.017	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@@H]3CC[C@H](C)C3)CC2)C1	ZINC000949486822	1333859779	/nfs/dbraw/zinc/85/97/79/1333859779.db2.gz	IFCJOANKTJMKED-ZWKOTPCHSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@@H](C)c3ccccc3)CC2)C1	ZINC000949512193	1333863990	/nfs/dbraw/zinc/86/39/90/1333863990.db2.gz	PUPVMWJPXMCNML-SFHVURJKSA-N	0	3	342.483	3.060	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2cc(C)n(C(CC)CC)n2)C1	ZINC000967082589	1335658087	/nfs/dbraw/zinc/65/80/87/1335658087.db2.gz	DJIIFWLEJMQWDX-HNAYVOBHSA-N	0	3	344.503	3.016	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cc(C)n(C(CC)CC)n2)C1	ZINC000967082582	1335658408	/nfs/dbraw/zinc/65/84/08/1335658408.db2.gz	DJIIFWLEJMQWDX-BEFAXECRSA-N	0	3	344.503	3.016	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)Cc2c(C)cccc2Cl)C1	ZINC000967231349	1335677254	/nfs/dbraw/zinc/67/72/54/1335677254.db2.gz	PTZZTYJNKYPGHK-YJBOKZPZSA-N	0	3	332.875	3.041	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2[nH]c3ccccc3c2Cl)C1	ZINC000967231586	1335677366	/nfs/dbraw/zinc/67/73/66/1335677366.db2.gz	QPAUMCFDQNMRJJ-BBRMVZONSA-N	0	3	343.858	3.285	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)Cc2ccc(C(F)F)cc2)C1	ZINC000967332332	1335703601	/nfs/dbraw/zinc/70/36/01/1335703601.db2.gz	DCRVAJYJCCKCEL-PBHICJAKSA-N	0	3	334.410	3.017	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2cc3cc(C)ccc3[nH]2)C1	ZINC000967661384	1335803120	/nfs/dbraw/zinc/80/31/20/1335803120.db2.gz	YNPJMZAEVQQGNV-DNVCBOLYSA-N	0	3	325.456	3.493	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](C)[C@H](NC(=O)c2ocnc2C(F)F)C1	ZINC000968331098	1335892111	/nfs/dbraw/zinc/89/21/11/1335892111.db2.gz	KCLLFDIUAVDNHF-VXGBXAGGSA-N	0	3	327.375	3.019	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2cc(F)cc3cccnc32)C1	ZINC000968369716	1335906817	/nfs/dbraw/zinc/90/68/17/1335906817.db2.gz	PGYRRMNJHGSCPA-KDOFPFPSSA-N	0	3	341.430	3.390	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2scnc2C(C)(C)C)C1	ZINC000968400217	1335920115	/nfs/dbraw/zinc/92/01/15/1335920115.db2.gz	NPBAHBSJOOZSTN-ZIAGYGMSSA-N	0	3	335.517	3.457	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2cc(Cl)cc(OC)c2)C1	ZINC000968456472	1335930545	/nfs/dbraw/zinc/93/05/45/1335930545.db2.gz	YWNGCQKDJLQZQA-CXAGYDPISA-N	0	3	336.863	3.365	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2cccn2C2CCCC2)C1	ZINC000968477581	1335935860	/nfs/dbraw/zinc/93/58/60/1335935860.db2.gz	UMWYJPOSUGSXTL-SJLPKXTDSA-N	0	3	327.472	3.067	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2sc(CC3CC3)nc2C)C1	ZINC000968477795	1335935873	/nfs/dbraw/zinc/93/58/73/1335935873.db2.gz	WMPARBARKUXICD-CZUORRHYSA-N	0	3	347.528	3.420	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2[nH]c3ccc(C)cc3c2C)C1	ZINC000968488772	1335938906	/nfs/dbraw/zinc/93/89/06/1335938906.db2.gz	LSDXBAWPJOTHEM-KXBFYZLASA-N	0	3	337.467	3.248	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccoc2Br)C1	ZINC000968503894	1335944604	/nfs/dbraw/zinc/94/46/04/1335944604.db2.gz	CAFBUHNQPXDRHH-YPMHNXCESA-N	0	3	341.249	3.058	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2ccc3ccn(C)c3c2)C1	ZINC000968506083	1335946114	/nfs/dbraw/zinc/94/61/14/1335946114.db2.gz	RVWWBCLFHOGPKB-CRAIPNDOSA-N	0	3	325.456	3.195	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)Cc2c(C)nn(C(C)C)c2C)C1	ZINC000968528917	1335954813	/nfs/dbraw/zinc/95/48/13/1335954813.db2.gz	INNYTIBWOIJZOV-HNAYVOBHSA-N	0	3	346.519	3.026	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2cc(C)c(F)cc2Cl)C1	ZINC000968592493	1335976158	/nfs/dbraw/zinc/97/61/58/1335976158.db2.gz	NHPRWSDQIDZHLT-SJKOYZFVSA-N	0	3	336.838	3.251	20	30		EGEDHN
C[C@H](N[C@@H]1CCN(C(=O)C#CC2CC2)C1)c1ccc(F)c(Cl)c1	ZINC000968617937	1335985279	/nfs/dbraw/zinc/98/52/79/1335985279.db2.gz	QADNLVRAUHSMSZ-SWLSCSKDSA-N	0	3	334.822	3.144	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2cc3c(cccc3OC)[nH]2)C1	ZINC000968643624	1335995271	/nfs/dbraw/zinc/99/52/71/1335995271.db2.gz	OFGGDNJTQNIOQW-KSSFIOAISA-N	0	3	341.455	3.193	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)CC2C3CC4CC(C3)CC2C4)C1	ZINC000968668411	1336002672	/nfs/dbraw/zinc/00/26/72/1336002672.db2.gz	BWZIYBWZXSMKPA-LWZPZBHMSA-N	0	3	342.527	3.299	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2ccc(OCC3CC3)cc2)C1	ZINC000968669325	1336003535	/nfs/dbraw/zinc/00/35/35/1336003535.db2.gz	LFHZYPYFHXXRPC-OXQOHEQNSA-N	0	3	342.483	3.492	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2ccc(C(C)(F)F)cc2)C1	ZINC000968710645	1336020096	/nfs/dbraw/zinc/02/00/96/1336020096.db2.gz	RWAROMGJJNGYGA-WMLDXEAASA-N	0	3	334.410	3.262	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1cccc2scnc21	ZINC000968859047	1336070875	/nfs/dbraw/zinc/07/08/75/1336070875.db2.gz	KZZRGDVDBRNOQH-OAHLLOKOSA-N	0	3	341.480	3.294	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1c(Cl)n[nH]c1CC	ZINC000968884947	1336080037	/nfs/dbraw/zinc/08/00/37/1336080037.db2.gz	HNSUAEWMBAAPLR-ZDUSSCGKSA-N	0	3	338.883	3.176	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cc(C)n([C@H](C)C2CC2)n1	ZINC000968923596	1336091482	/nfs/dbraw/zinc/09/14/82/1336091482.db2.gz	XYFNCWMWBLGTRA-SJLPKXTDSA-N	0	3	344.503	3.323	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CC[C@@H](NCc2cc3ccccc3o2)C1	ZINC000968924509	1336091641	/nfs/dbraw/zinc/09/16/41/1336091641.db2.gz	NKLHLWBDUSLCEK-QGZVFWFLSA-N	0	3	349.434	3.425	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cc(C)cc(OC)c1C	ZINC000968936652	1336096545	/nfs/dbraw/zinc/09/65/45/1336096545.db2.gz	NEOHOPYFSKPZRZ-QGZVFWFLSA-N	0	3	330.472	3.472	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1nccc2ccccc21	ZINC000969008450	1336116603	/nfs/dbraw/zinc/11/66/03/1336116603.db2.gz	RUNJQQCJSZWAEQ-SFHVURJKSA-N	0	3	335.451	3.233	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cc(F)c(F)cc1F	ZINC000969007954	1336116734	/nfs/dbraw/zinc/11/67/34/1336116734.db2.gz	JPDMXMJUOAUCRA-LBPRGKRZSA-N	0	3	326.362	3.264	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1noc2c1CCCCC2	ZINC000969052837	1336129231	/nfs/dbraw/zinc/12/92/31/1336129231.db2.gz	AHBGFONNHASXHT-HNNXBMFYSA-N	0	3	331.460	3.104	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1ccc(OCC)c(C)c1	ZINC000969056721	1336131590	/nfs/dbraw/zinc/13/15/90/1336131590.db2.gz	LFWPLUHYTRMKBU-IBGZPJMESA-N	0	3	342.483	3.391	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1ccc(N(C)CC)cc1	ZINC000969164689	1336168655	/nfs/dbraw/zinc/16/86/55/1336168655.db2.gz	MZLFOZBJJVDPQQ-FQEVSTJZSA-N	0	3	341.499	3.140	20	30		EGEDHN
C[C@@H](NC(=O)c1c[nH]c(C#N)c1)C1CN(Cc2ccc(C3CC3)cc2)C1	ZINC000969526481	1336220342	/nfs/dbraw/zinc/22/03/42/1336220342.db2.gz	MOIFHOBRHBQONV-CQSZACIVSA-N	0	3	348.450	3.014	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H](C)C1CN(Cc2ccccc2C)C1	ZINC000969836660	1336252699	/nfs/dbraw/zinc/25/26/99/1336252699.db2.gz	NUUOJUBGLJAVGN-QGZVFWFLSA-N	0	3	337.467	3.233	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(C(=O)[C@H](F)c3ccccc3)C2)s1	ZINC000970112148	1336280906	/nfs/dbraw/zinc/28/09/06/1336280906.db2.gz	OCDLRMKSAOYROV-RHSMWYFYSA-N	0	3	343.427	3.021	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)N2CC[C@@H](NCc3ccc(C#N)c(F)c3)C2)CC1	ZINC000970528268	1336318006	/nfs/dbraw/zinc/31/80/06/1336318006.db2.gz	MNMJLAJKYDWTFY-QGPMSJSTSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccnn2C2CCCC2)CC1	ZINC001005458179	1336354001	/nfs/dbraw/zinc/35/40/01/1336354001.db2.gz	IGTVVSUMGNFFBR-UHFFFAOYSA-N	0	3	330.476	3.111	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cc(C)n([C@H](C)C3CC3)n2)CC1	ZINC001005628100	1336384613	/nfs/dbraw/zinc/38/46/13/1336384613.db2.gz	BDKJTMVLXOCFOV-MRXNPFEDSA-N	0	3	344.503	3.275	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cnn(C3CCCC3)c2C)CC1	ZINC001006268682	1336479138	/nfs/dbraw/zinc/47/91/38/1336479138.db2.gz	ZIWWRTJMUYOSGQ-UHFFFAOYSA-N	0	3	344.503	3.419	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cc3ccccc3n2CC)CC1	ZINC001006444119	1336507431	/nfs/dbraw/zinc/50/74/31/1336507431.db2.gz	RTQNBZZZTGHVTI-UHFFFAOYSA-N	0	3	325.456	3.384	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2c(C)nn(C(C)(C)C)c2C)C1	ZINC001007459409	1336651785	/nfs/dbraw/zinc/65/17/85/1336651785.db2.gz	HYTIYEAUXCVVBH-INIZCTEOSA-N	0	3	332.492	3.025	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)C[C@@H]2C[C@H]2c2ccc(OC)cc2)C1	ZINC001007527192	1336664350	/nfs/dbraw/zinc/66/43/50/1336664350.db2.gz	LCAGLLRJMQJMKV-BJLQDIEVSA-N	0	3	342.483	3.346	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2cc(C)nn2C(CC)CC)C1	ZINC001007722401	1336690773	/nfs/dbraw/zinc/69/07/73/1336690773.db2.gz	HWYDRZXGHYNWOA-MRXNPFEDSA-N	0	3	332.492	3.323	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)Cn2cc(C)c3ccccc32)C1	ZINC001008837264	1336932928	/nfs/dbraw/zinc/93/29/28/1336932928.db2.gz	ZYADKJSCTKQRRO-KRWDZBQOSA-N	0	3	325.456	3.106	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCN(CCCC3CCCC3)C2)nc1	ZINC001009256292	1336992466	/nfs/dbraw/zinc/99/24/66/1336992466.db2.gz	YNEBWFSBZVUNKZ-IBGZPJMESA-N	0	3	339.483	3.228	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2cc(F)c(F)c(F)c2F)C1	ZINC001009299370	1337000732	/nfs/dbraw/zinc/00/07/32/1337000732.db2.gz	BDVIAYLQOMEYOI-SNVBAGLBSA-N	0	3	330.325	3.013	20	30		EGEDHN
CC(C)c1ccccc1CN1CC[C@@H](NC(=O)c2c[nH]c(C#N)c2)C1	ZINC001010695954	1337242567	/nfs/dbraw/zinc/24/25/67/1337242567.db2.gz	FLPOFFDOJLFKNT-QGZVFWFLSA-N	0	3	336.439	3.014	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CCN(Cc2ccc(C)cc2C)C1	ZINC001014731379	1337889903	/nfs/dbraw/zinc/88/99/03/1337889903.db2.gz	LILAIVAOISFJRJ-LJQANCHMSA-N	0	3	337.467	3.295	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(CCc3ccc(Cl)cc3)C2)C1	ZINC001015676854	1338254008	/nfs/dbraw/zinc/25/40/08/1338254008.db2.gz	PTZYLQLBZOZBMP-QGZVFWFLSA-N	0	3	332.875	3.429	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@H]3NC(=O)C[C@H]3C=CCC3)CC2)c1	ZINC001016501398	1338628332	/nfs/dbraw/zinc/62/83/32/1338628332.db2.gz	ZQZRDFCNXZIFBJ-FXAWDEMLSA-N	0	3	349.478	3.385	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)Cc2ccc(CC(C)C)cc2)CC1	ZINC001016715541	1338700779	/nfs/dbraw/zinc/70/07/79/1338700779.db2.gz	NDKXPUKMJSOYFY-FQEVSTJZSA-N	0	3	338.495	3.032	20	30		EGEDHN
CC1(C(=O)N[C@@H]2CC23CCN(Cc2cccc(C#N)c2)CC3)CC=CC1	ZINC001016811421	1338734656	/nfs/dbraw/zinc/73/46/56/1338734656.db2.gz	SJMYERQSMOLTCQ-LJQANCHMSA-N	0	3	349.478	3.385	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccc3c(c2)C=CCC3)CC1	ZINC001016870076	1338753268	/nfs/dbraw/zinc/75/32/68/1338753268.db2.gz	LBXKVNOCQQSHPW-FQEVSTJZSA-N	0	3	334.463	3.254	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cccn2C2CCCC2)CC1	ZINC001016903073	1338764480	/nfs/dbraw/zinc/76/44/80/1338764480.db2.gz	VQFWYVVAHIVBRR-LJQANCHMSA-N	0	3	339.483	3.211	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)C2(c3ccccc3C)CCC2)CC1	ZINC001016949389	1338781687	/nfs/dbraw/zinc/78/16/87/1338781687.db2.gz	DJANRZHTZYLACE-IBGZPJMESA-N	0	3	336.479	3.021	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCCN(C(=O)C2CCCC2)C1	ZINC001017013046	1338805977	/nfs/dbraw/zinc/80/59/77/1338805977.db2.gz	GGKBWOJSDHFCJI-OAHLLOKOSA-N	0	3	345.512	3.480	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCCN(C(=O)C2(C)CC2)C1	ZINC001017137056	1338890198	/nfs/dbraw/zinc/89/01/98/1338890198.db2.gz	DAPVJEVIGSQTPD-AWEZNQCLSA-N	0	3	331.485	3.090	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCCN(C(=O)[C@@H]2CC23CC3)C1	ZINC001017217360	1338958923	/nfs/dbraw/zinc/95/89/23/1338958923.db2.gz	HXKZJUOGJOJSHN-YOEHRIQHSA-N	0	3	343.496	3.090	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)Oc1ccccc1F	ZINC001017576941	1339370507	/nfs/dbraw/zinc/37/05/07/1339370507.db2.gz	GLQBDTSWJXBHEZ-YESZJQIVSA-N	0	3	346.446	3.234	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CCC[C@H]1C(F)F	ZINC001017616793	1339377984	/nfs/dbraw/zinc/37/79/84/1339377984.db2.gz	IDRYFEQOSCULEI-QKPAOTATSA-N	0	3	326.431	3.309	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H](C)c1c(C)noc1C	ZINC001017670889	1339388341	/nfs/dbraw/zinc/38/83/41/1339388341.db2.gz	KWEFSJHTOPOXKQ-XYPHTWIQSA-N	0	3	331.460	3.036	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cccc2c1O[C@H](C)C2	ZINC001017742471	1339408484	/nfs/dbraw/zinc/40/84/84/1339408484.db2.gz	QHKOJBUBLSFWMM-NXHRZFHOSA-N	0	3	340.467	3.265	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1cc(F)c(C)cc1F	ZINC001017767337	1339413999	/nfs/dbraw/zinc/41/39/99/1339413999.db2.gz	LMAGAOSBQYFBAJ-CALCHBBNSA-N	0	3	348.437	3.457	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@H]1CCO[C@@H](CC)C1	ZINC001018155991	1339517412	/nfs/dbraw/zinc/51/74/12/1339517412.db2.gz	IESPFPSAXCKJNG-OKYOBFRVSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CCc1ccc(OC)cc1	ZINC001018245273	1339548019	/nfs/dbraw/zinc/54/80/19/1339548019.db2.gz	IESXUZVHAVRXAA-KDURUIRLSA-N	0	3	342.483	3.269	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)CCc1nc2ccccc2o1	ZINC001018253665	1339550630	/nfs/dbraw/zinc/55/06/30/1339550630.db2.gz	JGVWLRZMOQTFFW-IYBDPMFKSA-N	0	3	339.439	3.012	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@H](C)c1ccc(OC)cc1	ZINC001018293251	1339565260	/nfs/dbraw/zinc/56/52/60/1339565260.db2.gz	SUROVDJIPCSJRL-YTQUADARSA-N	0	3	342.483	3.440	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)CCC3CCCC3)C2)s1	ZINC001018448314	1339623738	/nfs/dbraw/zinc/62/37/38/1339623738.db2.gz	OGDYDOAWUIEQCJ-HNNXBMFYSA-N	0	3	331.485	3.281	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)C3=CCCCCC3)C2)cc1F	ZINC001018762092	1339720943	/nfs/dbraw/zinc/72/09/43/1339720943.db2.gz	HOIRNEGKCWYLNJ-SFHVURJKSA-N	0	3	341.430	3.278	20	30		EGEDHN
C#CCCN1CCC[C@@H]1CNC(=O)c1cc2cc(Cl)ccc2[nH]1	ZINC001028065252	1340405366	/nfs/dbraw/zinc/40/53/66/1340405366.db2.gz	BIJYYBMJRWNRLK-OAHLLOKOSA-N	0	3	329.831	3.039	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCCN2Cc2cccc(C)c2)cc1	ZINC001028066525	1340406521	/nfs/dbraw/zinc/40/65/21/1340406521.db2.gz	CKJLPKHACMMROM-OAQYLSRUSA-N	0	3	332.447	3.371	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1cnn(C(C)C)c1C1CC1	ZINC001028253093	1340514449	/nfs/dbraw/zinc/51/44/49/1340514449.db2.gz	OIYURZOAWCXDSP-INIZCTEOSA-N	0	3	330.476	3.112	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](CNC(=O)C3CCCCC3)C2)cc1	ZINC001028381893	1340609874	/nfs/dbraw/zinc/60/98/74/1340609874.db2.gz	NMWUXZGNQJMWMC-GOSISDBHSA-N	0	3	325.456	3.077	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H](CNC(=O)C3CC4(CCC4)C3)C2)c1	ZINC001028747063	1340786845	/nfs/dbraw/zinc/78/68/45/1340786845.db2.gz	WNDCBTLJLQSLJD-SFHVURJKSA-N	0	3	337.467	3.077	20	30		EGEDHN
CC1(C)CCC[C@@H]1C(=O)NC[C@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC001028747027	1340787399	/nfs/dbraw/zinc/78/73/99/1340787399.db2.gz	WARMIOSYQZIQGI-RTBURBONSA-N	0	3	339.483	3.323	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](CNC(=O)C3CCC=CCC3)C2)cc1	ZINC001028990030	1340902261	/nfs/dbraw/zinc/90/22/61/1340902261.db2.gz	CLKRUVXCHCZGFG-IBGZPJMESA-N	0	3	337.467	3.243	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCC([C@@H](C)NCc2ccccc2C#N)CC1	ZINC001029147036	1340942610	/nfs/dbraw/zinc/94/26/10/1340942610.db2.gz	YPVHPPYQCIKVPN-JXXFODFXSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CC[C@@H](C1)N2CC1CC(F)(F)C1	ZINC001029454050	1340993630	/nfs/dbraw/zinc/99/36/30/1340993630.db2.gz	RKKNJJPGYQQRAO-UXLLHSPISA-N	0	3	326.431	3.309	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc3c(cc(C)cc3C)[nH]2)CC[C@H]1C	ZINC001071712982	1354870960	/nfs/dbraw/zinc/87/09/60/1354870960.db2.gz	WZTWYAOSOQMRFF-SJORKVTESA-N	0	3	337.467	3.391	20	30		EGEDHN
Cc1coc(C(=O)N2CC[C@@H](CN(C)Cc3ccc(C#N)s3)C2)c1	ZINC001029813519	1341083162	/nfs/dbraw/zinc/08/31/62/1341083162.db2.gz	WWLOOOSPWBAFFG-AWEZNQCLSA-N	0	3	343.452	3.115	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](CN(C)Cc3ncccc3C)C2)CC1	ZINC001029825935	1341087117	/nfs/dbraw/zinc/08/71/17/1341087117.db2.gz	JUEIQIUORKMCSS-GOSISDBHSA-N	0	3	341.499	3.417	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](CN(C)Cc3c(C)noc3C)C2)CC1	ZINC001029826720	1341087551	/nfs/dbraw/zinc/08/75/51/1341087551.db2.gz	UTGDBGOXWZUDSD-QGZVFWFLSA-N	0	3	345.487	3.318	20	30		EGEDHN
CCC1(C(=O)N2CC[C@H](CN(C)Cc3ccc(C#N)s3)C2)CC1	ZINC001029829474	1341089374	/nfs/dbraw/zinc/08/93/74/1341089374.db2.gz	GBAPXHGLMSDPQN-CQSZACIVSA-N	0	3	331.485	3.090	20	30		EGEDHN
C#CCCN1CCC[C@H](N(Cc2ccccc2)C(=O)c2[nH]ccc2C)C1	ZINC001029919775	1341119536	/nfs/dbraw/zinc/11/95/36/1341119536.db2.gz	HWVQAFSTHKMANY-FQEVSTJZSA-N	0	3	349.478	3.453	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC(CN(C)Cc2scnc2C)CC1	ZINC001029985187	1341144661	/nfs/dbraw/zinc/14/46/61/1341144661.db2.gz	UDQRAQQTZPUFCY-UHFFFAOYSA-N	0	3	335.517	3.334	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2ccc(Br)o2)CC[C@H]1C	ZINC001072019199	1355082517	/nfs/dbraw/zinc/08/25/17/1355082517.db2.gz	DZSGCWRISGBTDC-NEPJUHHUSA-N	0	3	341.249	3.201	20	30		EGEDHN
CC(C)(C)C(=O)N[C@@H]1C[C@H](NCc2cc(C#N)ccc2F)C12CCC2	ZINC001078788277	1357083853	/nfs/dbraw/zinc/08/38/53/1357083853.db2.gz	FFHVLAHYLVKFLG-DLBZAZTESA-N	0	3	343.446	3.260	20	30		EGEDHN
C#Cc1ccc(C(=O)NCC2CN([C@@H](C)c3cccc(C)c3)C2)cc1	ZINC001031892113	1341417542	/nfs/dbraw/zinc/41/75/42/1341417542.db2.gz	NCLDLBRLKIDMDT-KRWDZBQOSA-N	0	3	332.447	3.399	20	30		EGEDHN
C=C1CCC(C(=O)NCC2CN(CCCc3ccsc3)C2)CC1	ZINC001031951505	1341430088	/nfs/dbraw/zinc/43/00/88/1341430088.db2.gz	JXNPMLKZBPRDEZ-UHFFFAOYSA-N	0	3	332.513	3.475	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cc2ccccc2nc1C	ZINC001032431106	1341511620	/nfs/dbraw/zinc/51/16/20/1341511620.db2.gz	RYKJTNQQPQILLK-ROUUACIJSA-N	0	3	335.451	3.408	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1cccc(C)c1Cl	ZINC001032516184	1341528725	/nfs/dbraw/zinc/52/87/25/1341528725.db2.gz	KTVKASTUYWTVQM-IRXDYDNUSA-N	0	3	332.875	3.442	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1sccc1-n1cccc1	ZINC001032550656	1341538294	/nfs/dbraw/zinc/53/82/94/1341538294.db2.gz	AUBCJJHYKATTCA-HOTGVXAUSA-N	0	3	341.480	3.404	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H]1C[C@H]1c1c(F)cccc1F	ZINC001032619776	1341562237	/nfs/dbraw/zinc/56/22/37/1341562237.db2.gz	FGVRPCSULBFZBF-CAOSSQGBSA-N	0	3	346.421	3.320	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccccc1OC(C)C	ZINC001032745362	1341599350	/nfs/dbraw/zinc/59/93/50/1341599350.db2.gz	QVZORHJOCFJOSK-IRXDYDNUSA-N	0	3	328.456	3.339	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H](CC)c1ccc(OC)cc1	ZINC001032795856	1341616100	/nfs/dbraw/zinc/61/61/00/1341616100.db2.gz	PRSIYUKVQIIRJU-LNLFQRSKSA-N	0	3	328.456	3.050	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H](C)Cc1ccc(OC)cc1	ZINC001032795753	1341616155	/nfs/dbraw/zinc/61/61/55/1341616155.db2.gz	UZMLZQHKCSMZAR-NEWSRXKRSA-N	0	3	342.483	3.125	20	30		EGEDHN
C=C1CCC(C(=O)N(C)[C@@H]2CCN(CCOc3ccccc3)C2)CC1	ZINC001033394930	1341812155	/nfs/dbraw/zinc/81/21/55/1341812155.db2.gz	GKQOGDBXHYRGLC-LJQANCHMSA-N	0	3	342.483	3.345	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)[C@@]2(C)CCCc3ccccc32)C1	ZINC001033510826	1341852567	/nfs/dbraw/zinc/85/25/67/1341852567.db2.gz	WXJRHYHJMQHBPK-RXVVDRJESA-N	0	3	326.484	3.389	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cn(C)c3ccc(F)cc23)C1	ZINC001033855027	1342046276	/nfs/dbraw/zinc/04/62/76/1342046276.db2.gz	GFYMWYASGBBDNX-INIZCTEOSA-N	0	3	343.446	3.430	20	30		EGEDHN
C=CCOc1ccc(C(=O)N(CC)[C@@H]2CCN(CC(=C)C)C2)cc1	ZINC001033881363	1342057312	/nfs/dbraw/zinc/05/73/12/1342057312.db2.gz	QCCTUSTXVWPRHB-GOSISDBHSA-N	0	3	328.456	3.364	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2coc3ccc(OC)cc23)C1	ZINC001033894763	1342067139	/nfs/dbraw/zinc/06/71/39/1342067139.db2.gz	KDONPKUDSMTNBC-HNNXBMFYSA-N	0	3	340.423	3.001	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2cc3cc(Cl)ccc3[nH]2)C1	ZINC001033916976	1342086176	/nfs/dbraw/zinc/08/61/76/1342086176.db2.gz	QWNAKCVPRWKKDD-MRXNPFEDSA-N	0	3	343.858	3.381	20	30		EGEDHN
C=C1CCC(C(=O)N(CC)[C@H]2CCN(C[C@H]3CCCCO3)C2)CC1	ZINC001033948955	1342108840	/nfs/dbraw/zinc/10/88/40/1342108840.db2.gz	CYKJBXUXWFHTKK-RBUKOAKNSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@H]2CCc3cccc(OC)c32)C1	ZINC001033979070	1342127547	/nfs/dbraw/zinc/12/75/47/1342127547.db2.gz	FTVHNSVMTBJPOT-ROUUACIJSA-N	0	3	342.483	3.224	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)[C@@H]2C[C@H]2c2ccc(C)s2)C1	ZINC001033985218	1342130100	/nfs/dbraw/zinc/13/01/00/1342130100.db2.gz	KAQCCRRXNKZRKL-BRWVUGGUSA-N	0	3	330.497	3.106	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccc(-c3cn[nH]c3)cc2)C1	ZINC001033989675	1342133532	/nfs/dbraw/zinc/13/35/32/1342133532.db2.gz	NOKOKXKODHYKOX-IBGZPJMESA-N	0	3	338.455	3.189	20	30		EGEDHN
C#Cc1ccc(C(=O)N(CC)[C@H]2CCN(Cc3ccc(C)cc3)C2)cn1	ZINC001034027504	1342166428	/nfs/dbraw/zinc/16/64/28/1342166428.db2.gz	WAJDWZQNPYRETA-NRFANRHFSA-N	0	3	347.462	3.108	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@H]2Cc3ccc(Cl)cc32)C1	ZINC001034037843	1342177445	/nfs/dbraw/zinc/17/74/45/1342177445.db2.gz	SGTYDNHVIWCHMU-AEFFLSMTSA-N	0	3	332.875	3.479	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cccc3scnc32)C1	ZINC001034203606	1342313763	/nfs/dbraw/zinc/31/37/63/1342313763.db2.gz	FSIXJTPEXJQYHP-CQSZACIVSA-N	0	3	329.469	3.457	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2oc(CC3CC3)nc2C)C1	ZINC001034209588	1342319197	/nfs/dbraw/zinc/31/91/97/1342319197.db2.gz	FSWVIZYTEFXMET-MRXNPFEDSA-N	0	3	331.460	3.096	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2coc(Br)c2)C1	ZINC001034233980	1342336737	/nfs/dbraw/zinc/33/67/37/1342336737.db2.gz	JVKARTFQRAKTFF-ZDUSSCGKSA-N	0	3	341.249	3.203	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@@H]2CCN(C)c3ccccc32)C1	ZINC001034247887	1342345660	/nfs/dbraw/zinc/34/56/60/1342345660.db2.gz	VSPSGOLJGAXYLF-PKOBYXMFSA-N	0	3	341.499	3.157	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc(N(C)C)cc2F)C1	ZINC001034250767	1342347782	/nfs/dbraw/zinc/34/77/82/1342347782.db2.gz	SJJPJRDHMQHGKL-OAHLLOKOSA-N	0	3	333.451	3.052	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc(OC)c(OC)c2C)C1	ZINC001034262780	1342354747	/nfs/dbraw/zinc/35/47/47/1342354747.db2.gz	QVEXMGDYTQYPOD-MRXNPFEDSA-N	0	3	346.471	3.173	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)C[C@@H]2CCOc3ccccc32)C1	ZINC001034347405	1342417237	/nfs/dbraw/zinc/41/72/37/1342417237.db2.gz	YQEWVXYYNWBULP-DLBZAZTESA-N	0	3	328.456	3.100	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cnc(C(C)C)nc2C)C1	ZINC001034430785	1342492610	/nfs/dbraw/zinc/49/26/10/1342492610.db2.gz	ZPFRRWYRMNKZED-INIZCTEOSA-N	0	3	330.476	3.069	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cnn(CCC)c2C2CC2)C1	ZINC001034483972	1342541878	/nfs/dbraw/zinc/54/18/78/1342541878.db2.gz	OXOMQFWTBJSWIW-QGZVFWFLSA-N	0	3	344.503	3.331	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)c2cc(C)n(CC3CC3)c2C)C1	ZINC001034489307	1342547342	/nfs/dbraw/zinc/54/73/42/1342547342.db2.gz	BBXXUGSRKHSOTL-SFHVURJKSA-N	0	3	329.488	3.285	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2csc3c2CCCC3)C1	ZINC001034522539	1342580865	/nfs/dbraw/zinc/58/08/65/1342580865.db2.gz	WKHFFEVCMFRIGC-OAHLLOKOSA-N	0	3	330.497	3.235	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2c(C)nn(CC)c2Cl)C1	ZINC001034530474	1342587231	/nfs/dbraw/zinc/58/72/31/1342587231.db2.gz	DCRIPUTZYFZZST-CQSZACIVSA-N	0	3	338.883	3.025	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)C1	ZINC001034544824	1342606079	/nfs/dbraw/zinc/60/60/79/1342606079.db2.gz	KJXAEJYCXFGYJI-CEXWTWQISA-N	0	3	330.447	3.476	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)C2CC3(CC3)C2)CC1	ZINC001034728739	1342723645	/nfs/dbraw/zinc/72/36/45/1342723645.db2.gz	XPRBCZKNDDOITE-HDJSIYSDSA-N	0	3	341.293	3.102	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CC[C@H](NCc3nccs3)CC2)CC1	ZINC001034722482	1342716237	/nfs/dbraw/zinc/71/62/37/1342716237.db2.gz	AFKRZVVZNCNLCV-WKILWMFISA-N	0	3	333.501	3.407	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)c2ccsc2)c(F)c1	ZINC001034854030	1342805067	/nfs/dbraw/zinc/80/50/67/1342805067.db2.gz	TYSNYBQOIDFYOZ-MRXNPFEDSA-N	0	3	343.427	3.153	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)[C@H]2[C@@H]3CCCC[C@@H]32)s1	ZINC001034897361	1342826226	/nfs/dbraw/zinc/82/62/26/1342826226.db2.gz	NRFHMCXPQUXQTF-ZSGPHXLJSA-N	0	3	343.496	3.137	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)c(F)c1)C1CCC1	ZINC001034969577	1342856291	/nfs/dbraw/zinc/85/62/91/1342856291.db2.gz	HFWZVMULWADIDK-KBXCAEBGSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2nc(C)c(C)s2)C12CCC2	ZINC001078812006	1357093948	/nfs/dbraw/zinc/09/39/48/1357093948.db2.gz	CJIKPZFKEBOVSZ-OLZOCXBDSA-N	0	3	339.892	3.143	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)s1	ZINC001035042935	1342895295	/nfs/dbraw/zinc/89/52/95/1342895295.db2.gz	DWCCPMWMAMOYOF-CKEIUWERSA-N	0	3	331.485	3.137	20	30		EGEDHN
N#Cc1ccccc1CN1CCC2(C1)CCN(C(=O)CC1CC1)CC2	ZINC001035151173	1342965396	/nfs/dbraw/zinc/96/53/96/1342965396.db2.gz	VVCZNOQNHVURDP-UHFFFAOYSA-N	0	3	337.467	3.173	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC2(CN(Cc3ccccc3C3CC3)C2)CC1	ZINC001035701296	1343143138	/nfs/dbraw/zinc/14/31/38/1343143138.db2.gz	WPKLTJCVCBDOBC-UHFFFAOYSA-N	0	3	348.490	3.402	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C[C@@H](C)c1c(C)noc1C)CC2	ZINC001035734277	1343160345	/nfs/dbraw/zinc/16/03/45/1343160345.db2.gz	BCHMFIJKCVGTNM-OAHLLOKOSA-N	0	3	345.487	3.286	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccnc3ccccc31)CC2	ZINC001035744957	1343165467	/nfs/dbraw/zinc/16/54/67/1343165467.db2.gz	XYEPRWYMHACHBE-UHFFFAOYSA-N	0	3	335.451	3.349	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC2(CN(C[C@@H]3CC(C)(C)CO3)C2)CC1	ZINC001035784945	1343195003	/nfs/dbraw/zinc/19/50/03/1343195003.db2.gz	MINJGDHKOUZLFV-FXAWDEMLSA-N	0	3	348.531	3.328	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC2(CN(C[C@H]3CCCCO3)C2)CC1	ZINC001035785508	1343196550	/nfs/dbraw/zinc/19/65/50/1343196550.db2.gz	ULZSPKBDDKQUJJ-MJGOQNOKSA-N	0	3	334.504	3.082	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@@]1(C)C[C@@H]1c1ccccc1)CC2	ZINC001035814497	1343212968	/nfs/dbraw/zinc/21/29/68/1343212968.db2.gz	NEPDBKOFRODVGS-CTNGQTDRSA-N	0	3	336.479	3.128	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cc1ccc(Cl)s1)CC2	ZINC001035814489	1343213020	/nfs/dbraw/zinc/21/30/20/1343213020.db2.gz	QBKFZXNRDJAJTA-UHFFFAOYSA-N	0	3	338.904	3.445	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)C[C@H]1CCc3ccccc31)CC2	ZINC001035822967	1343215626	/nfs/dbraw/zinc/21/56/26/1343215626.db2.gz	ZBLMUZUTIXGJET-LJQANCHMSA-N	0	3	336.479	3.054	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C[C@@H]1CCO[C@@H](CC)C1)CC2	ZINC001035832661	1343220109	/nfs/dbraw/zinc/22/01/09/1343220109.db2.gz	NTOZVELVYQSGEP-MSOLQXFVSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cc1sc(C)cc1C)CC2	ZINC001035842863	1343225078	/nfs/dbraw/zinc/22/50/78/1343225078.db2.gz	HAMQFIIRDNJNRG-UHFFFAOYSA-N	0	3	332.513	3.408	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@H](C)c1cccc(F)c1)CC2	ZINC001035855691	1343232700	/nfs/dbraw/zinc/23/27/00/1343232700.db2.gz	UQUPNTLUOCHUGA-MRXNPFEDSA-N	0	3	330.447	3.430	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](NCc2nc3ccccc3o2)[C@H](C)C1	ZINC001036145253	1343327554	/nfs/dbraw/zinc/32/75/54/1343327554.db2.gz	XZOPMAHJBNICQV-CABCVRRESA-N	0	3	341.455	3.367	20	30		EGEDHN
C[C@H](NCc1cc(F)ccc1C#N)[C@H]1CCCN(C(=O)C2CCC2)C1	ZINC001036340203	1343425789	/nfs/dbraw/zinc/42/57/89/1343425789.db2.gz	PRVCVBZUJKHBKJ-YOEHRIQHSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCCN(C(=O)C2=CCCC2)C1	ZINC001036389130	1343459653	/nfs/dbraw/zinc/45/96/53/1343459653.db2.gz	QVPQCULSLXNPKL-OXQOHEQNSA-N	0	3	337.467	3.385	20	30		EGEDHN
C[C@H]1CCCN(C(=O)C2CC=CC2)[C@@H]1CNCc1ccc(C#N)s1	ZINC001036526963	1343535902	/nfs/dbraw/zinc/53/59/02/1343535902.db2.gz	XHUHCGMJGWMCGR-KBXCAEBGSA-N	0	3	343.496	3.303	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)C2=CCCC2)[C@H]1CNCc1ccc(C#N)s1	ZINC001036535580	1343543059	/nfs/dbraw/zinc/54/30/59/1343543059.db2.gz	XJJXSQXZTMKAFA-KDOFPFPSSA-N	0	3	343.496	3.447	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@@H]2[C@H](CCN2CC#Cc2ccccc2)C1	ZINC001036651804	1343600762	/nfs/dbraw/zinc/60/07/62/1343600762.db2.gz	JTJBZEACDWMVOU-NHCUHLMSSA-N	0	3	338.495	3.397	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CN(C(=O)CCC4CC4)CC[C@@H]32)s1	ZINC001036670501	1343613790	/nfs/dbraw/zinc/61/37/90/1343613790.db2.gz	VHIZOHPFLDXGOW-QAPCUYQASA-N	0	3	343.496	3.233	20	30		EGEDHN
C/C=C(/C)C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccc(C#N)c(F)c2)C1	ZINC001036682517	1343623999	/nfs/dbraw/zinc/62/39/99/1343623999.db2.gz	FFFCGOMYSCVWIA-PKXYKUNZSA-N	0	3	341.430	3.086	20	30		EGEDHN
C/C=C(/C)C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccc(F)c(C#N)c2)C1	ZINC001036683464	1343626153	/nfs/dbraw/zinc/62/61/53/1343626153.db2.gz	SVBGGBZWYLDQSS-NOWNMOOPSA-N	0	3	341.430	3.086	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2[C@@H](CCN2Cc2cnc(C)o2)C1	ZINC001036793497	1343725421	/nfs/dbraw/zinc/72/54/21/1343725421.db2.gz	GIGMQDPOHZJTAV-RDJZCZTQSA-N	0	3	331.460	3.008	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2cnoc2C)C1	ZINC001036794415	1343727201	/nfs/dbraw/zinc/72/72/01/1343727201.db2.gz	USZAANPARFYPJR-DOTOQJQBSA-N	0	3	331.460	3.008	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]3[C@H](CCN3Cc3cc(C)ns3)C2)C1	ZINC001036816350	1343755044	/nfs/dbraw/zinc/75/50/44/1343755044.db2.gz	TUSLUQCZSFUWFT-WBVHZDCISA-N	0	3	345.512	3.231	20	30		EGEDHN
Cc1coc(C(=O)N[C@@H]2CCC[C@H]2CNCc2ccccc2C#N)c1	ZINC001037061022	1343956694	/nfs/dbraw/zinc/95/66/94/1343956694.db2.gz	WVPKRJSJUGXIGV-ZWKOTPCHSA-N	0	3	337.423	3.148	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCC[C@@H]2CNCc2nc(C)sc2C)C1	ZINC001037075531	1343968557	/nfs/dbraw/zinc/96/85/57/1343968557.db2.gz	QWUBXYWUWWUZCF-CVEARBPZSA-N	0	3	347.528	3.491	20	30		EGEDHN
CC1(C(=O)N[C@H]2CCCC[C@@H]2CNCc2ccccc2C#N)CC1	ZINC001037189695	1344028776	/nfs/dbraw/zinc/02/87/76/1344028776.db2.gz	DBYNCUMBIYKCDL-MSOLQXFVSA-N	0	3	325.456	3.123	20	30		EGEDHN
CC1(C(=O)N[C@H]2CCCC[C@H]2CNCc2cc(F)ccc2C#N)CC1	ZINC001037189782	1344029129	/nfs/dbraw/zinc/02/91/29/1344029129.db2.gz	FAICPIJEDGXJNN-YJBOKZPZSA-N	0	3	343.446	3.262	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@](C)(C=C)CC)CC[C@H]1c1ccc(F)cc1	ZINC001079157803	1357198355	/nfs/dbraw/zinc/19/83/55/1357198355.db2.gz	BZQUBPFFSCBDTF-QKNQBKEWSA-N	0	3	342.458	3.335	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1cccc(C(F)(F)F)c1	ZINC001038961412	1344684102	/nfs/dbraw/zinc/68/41/02/1344684102.db2.gz	VSIHGUVOBQWEJR-OAHLLOKOSA-N	0	3	326.362	3.476	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)[C@H]3C[C@@H]3C(F)F)CC2)C1	ZINC001039123686	1344798764	/nfs/dbraw/zinc/79/87/64/1344798764.db2.gz	FJQDELLEYHOJIT-KKUMJFAQSA-N	0	3	346.849	3.201	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)C3CC4(CC4)C3)CC2)C1	ZINC001039163610	1344848935	/nfs/dbraw/zinc/84/89/35/1344848935.db2.gz	DJJGIPJXZCNEFA-INIZCTEOSA-N	0	3	336.907	3.490	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]([C@H]3CCCCN3C(=O)C3CC3)C2)s1	ZINC001039183522	1344882381	/nfs/dbraw/zinc/88/23/81/1344882381.db2.gz	LBDPGBDHMWSSED-CRAIPNDOSA-N	0	3	343.496	3.233	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc(C)cc(C)n2)C1	ZINC001039210486	1344924550	/nfs/dbraw/zinc/92/45/50/1344924550.db2.gz	AVVKMCUUVFRJSZ-UYAOXDASSA-N	0	3	339.483	3.038	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccc(F)c(F)c2)C1	ZINC001039215014	1344930954	/nfs/dbraw/zinc/93/09/54/1344930954.db2.gz	ROWMWZDZBHUKAK-QFBILLFUSA-N	0	3	346.421	3.305	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cccc(C(C)C)n2)C1	ZINC001039218185	1344936141	/nfs/dbraw/zinc/93/61/41/1344936141.db2.gz	KYBJUGYJMQHOFQ-YLJYHZDGSA-N	0	3	339.483	3.155	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc[nH]c2C(C)C)C1	ZINC001039224929	1344943194	/nfs/dbraw/zinc/94/31/94/1344943194.db2.gz	KYCRPDBXBBXMTJ-MJGOQNOKSA-N	0	3	341.499	3.478	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccc(F)c(C)c2)C1	ZINC001039226523	1344945804	/nfs/dbraw/zinc/94/58/04/1344945804.db2.gz	XWXCSXKTMWFBLX-AZUAARDMSA-N	0	3	342.458	3.474	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2occc2Cl)C1	ZINC001039233066	1344952945	/nfs/dbraw/zinc/95/29/45/1344952945.db2.gz	ZREKUNGRUJYQSF-GOEBONIOSA-N	0	3	334.847	3.273	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cccc(F)c2Cl)C1	ZINC001039237829	1344960362	/nfs/dbraw/zinc/96/03/62/1344960362.db2.gz	LAHHOFYECIWVQU-YOEHRIQHSA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)C2CCC(F)(F)CC2)C1	ZINC001039238342	1344962274	/nfs/dbraw/zinc/96/22/74/1344962274.db2.gz	NDSXKMOZXOURJF-IAGOWNOFSA-N	0	3	338.442	3.148	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cccc3[nH]ccc32)C1	ZINC001039240868	1344965656	/nfs/dbraw/zinc/96/56/56/1344965656.db2.gz	ZZSOPPHKOZNBOE-OXQOHEQNSA-N	0	3	335.451	3.118	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc[nH]c2C(C)C)C1	ZINC001039242142	1344968117	/nfs/dbraw/zinc/96/81/17/1344968117.db2.gz	ANCDADNFMCGGDJ-WMZOPIPTSA-N	0	3	327.472	3.088	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2oc(CC)cc2C)C1	ZINC001039242294	1344968548	/nfs/dbraw/zinc/96/85/48/1344968548.db2.gz	AOTADEMKXLYTDZ-WMZOPIPTSA-N	0	3	328.456	3.100	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc[nH]c2C2CC2)C1	ZINC001039242790	1344969724	/nfs/dbraw/zinc/96/97/24/1344969724.db2.gz	FFNWZHQABJYNQH-MJGOQNOKSA-N	0	3	339.483	3.232	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc(CC(C)C)c[nH]2)C1	ZINC001039247828	1344977806	/nfs/dbraw/zinc/97/78/06/1344977806.db2.gz	XYWXBFLYQWZAQR-ICSRJNTNSA-N	0	3	341.499	3.163	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(C(F)F)o2)C1	ZINC001039248939	1344979465	/nfs/dbraw/zinc/97/94/65/1344979465.db2.gz	FUNQRWBEMLGTLO-KGLIPLIRSA-N	0	3	336.382	3.167	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cncc(Cl)c1C	ZINC001039389558	1345040112	/nfs/dbraw/zinc/04/01/12/1345040112.db2.gz	YRYVADQAARSFJQ-CABCVRRESA-N	0	3	333.863	3.298	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cnn(CC)c1C1CC1	ZINC001039459226	1345078330	/nfs/dbraw/zinc/07/83/30/1345078330.db2.gz	LSDCKJWTFDXICU-SJORKVTESA-N	0	3	342.487	3.035	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](OC)c1ccccc1	ZINC001039461498	1345080123	/nfs/dbraw/zinc/08/01/23/1345080123.db2.gz	UKLQSUOPCFGIKM-CEXWTWQISA-N	0	3	328.456	3.016	20	30		EGEDHN
C=CCn1cccc1C(=O)N1C[C@H]2CCC[C@@H](C1)N2C[C@@H](C)CC	ZINC001039644852	1345153042	/nfs/dbraw/zinc/15/30/42/1345153042.db2.gz	YUNFYHIVCVJAOR-OKZBNKHCSA-N	0	3	329.488	3.399	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H]3CCC[C@@H](C2)N3C[C@H]2CCCOC2)CC1	ZINC001039890764	1345233799	/nfs/dbraw/zinc/23/37/99/1345233799.db2.gz	BZJJSPCKBQBYOJ-RLLQIKCJSA-N	0	3	346.515	3.225	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3c(C)noc3C(C)C)C2)C1	ZINC001040253702	1345396840	/nfs/dbraw/zinc/39/68/40/1345396840.db2.gz	PXGUOWSMSRSTRA-HXUWFJFHSA-N	0	3	343.471	3.058	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3ccc(Cl)cc3F)C2)C1	ZINC001040281156	1345409661	/nfs/dbraw/zinc/40/96/61/1345409661.db2.gz	AJFYKLXAXPCIGN-SFHVURJKSA-N	0	3	334.822	3.040	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cc(C)n(CC)c3C)C2)C1	ZINC001040283854	1345411264	/nfs/dbraw/zinc/41/12/64/1345411264.db2.gz	OZLZYDQMBHIQQY-NRFANRHFSA-N	0	3	341.499	3.076	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@]2(C1)CCCN(Cc1ccccn1)C2	ZINC001040327132	1345433251	/nfs/dbraw/zinc/43/32/51/1345433251.db2.gz	DMNGGGOUXSSSLJ-HXUWFJFHSA-N	0	3	327.472	3.108	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)N1CC[C@]2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001040331155	1345436550	/nfs/dbraw/zinc/43/65/50/1345436550.db2.gz	JEYLXJFLNYXBPP-OZOXKJRCSA-N	0	3	337.467	3.029	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CC[C@@]2(C1)CCCN(Cc1cccc(C#N)c1)C2	ZINC001040337540	1345440398	/nfs/dbraw/zinc/44/03/98/1345440398.db2.gz	NEZJLIGIGDUPRK-QUCCMNQESA-N	0	3	343.446	3.121	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3ccc(F)c(Cl)c3)C2)C1	ZINC001040360631	1345453529	/nfs/dbraw/zinc/45/35/29/1345453529.db2.gz	MGHJYUVAZRVJOX-SFHVURJKSA-N	0	3	334.822	3.040	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@H](C)c3cc(C)oc3C)C2)C1	ZINC001040451613	1345507419	/nfs/dbraw/zinc/50/74/19/1345507419.db2.gz	GBJJVYZSHZMWKE-UTKZUKDTSA-N	0	3	342.483	3.338	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3cc(Cl)ccc3C)C2)C1	ZINC001040455701	1345509295	/nfs/dbraw/zinc/50/92/95/1345509295.db2.gz	FUOSTPKKQLAFIF-IBGZPJMESA-N	0	3	330.859	3.210	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3coc(C4CCCC4)n3)C2)C1	ZINC001040474518	1345512285	/nfs/dbraw/zinc/51/22/85/1345512285.db2.gz	MYUGLLVWEVIWQC-FQEVSTJZSA-N	0	3	343.471	3.446	20	30		EGEDHN
C=C[C@@H](C(=O)N1CC[C@@]2(C1)CCCN(CC#CC)C2)c1ccccc1	ZINC001040538109	1345535853	/nfs/dbraw/zinc/53/58/53/1345535853.db2.gz	GFBRPQAAOWJNLF-IRLDBZIGSA-N	0	3	336.479	3.294	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@H](C)Cc3ccc(C)cc3)C2)C1	ZINC001040542864	1345538305	/nfs/dbraw/zinc/53/83/05/1345538305.db2.gz	MKLJXLVJQQDNRO-DENIHFKCSA-N	0	3	338.495	3.121	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)CCc3ccc(Cl)cc3)C2)CC1	ZINC001040791151	1345578298	/nfs/dbraw/zinc/57/82/98/1345578298.db2.gz	GYFTUGXZVBILAN-UHFFFAOYSA-N	0	3	344.886	3.220	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccc(C(C)C)nc3C)C2)CC1	ZINC001040852662	1345588284	/nfs/dbraw/zinc/58/82/84/1345588284.db2.gz	BIJBMZAQAXCGDI-UHFFFAOYSA-N	0	3	339.483	3.075	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccc(C(F)F)o3)C2)CC1	ZINC001040924523	1345601243	/nfs/dbraw/zinc/60/12/43/1345601243.db2.gz	OBIFROIQVZPANY-UHFFFAOYSA-N	0	3	336.382	3.169	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3csc4c3CCCC4)C2)CC1	ZINC001040929776	1345603296	/nfs/dbraw/zinc/60/32/96/1345603296.db2.gz	BIHAGCJDBGXOEV-UHFFFAOYSA-N	0	3	342.508	3.188	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@]3(C)CC=C(C)CC3)C2)CC1	ZINC001040946669	1345607024	/nfs/dbraw/zinc/60/70/24/1345607024.db2.gz	ZEWIYGGHKVDXAI-HXUWFJFHSA-N	0	3	328.500	3.461	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3c(C)cccc3F)C2)CC1	ZINC001040956938	1345610283	/nfs/dbraw/zinc/61/02/83/1345610283.db2.gz	LHUUNHIWFRZJKD-UHFFFAOYSA-N	0	3	328.431	3.086	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@]3(CCN(C(=O)[C@H]4CC=CCC4)C3)C2)cc1	ZINC001041064247	1345640720	/nfs/dbraw/zinc/64/07/20/1345640720.db2.gz	QBDUAWGASLJTQO-UNMCSNQZSA-N	0	3	349.478	3.339	20	30		EGEDHN
CC(C(=O)N1CC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1)=C1CCC1	ZINC001041275049	1345691262	/nfs/dbraw/zinc/69/12/62/1345691262.db2.gz	CCVVUMZXKXTISQ-JOCHJYFZSA-N	0	3	349.478	3.483	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cccc(Cl)c3C)C2)C1	ZINC001041318085	1345701030	/nfs/dbraw/zinc/70/10/30/1345701030.db2.gz	QIRIAWFOHPGTDS-IBGZPJMESA-N	0	3	330.859	3.210	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3scc(C)c3Cl)C2)C1	ZINC001041316949	1345701112	/nfs/dbraw/zinc/70/11/12/1345701112.db2.gz	LRVUMBOLZAWCIU-KRWDZBQOSA-N	0	3	336.888	3.271	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)C(C3CCC3)C3CCC3)C2)C1	ZINC001041605837	1345790215	/nfs/dbraw/zinc/79/02/15/1345790215.db2.gz	NFVSOSMLHBYWRW-OAQYLSRUSA-N	0	3	328.500	3.151	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@]2(CCN(Cc3ncccc3C)C2)C1	ZINC001041624794	1345800040	/nfs/dbraw/zinc/80/00/40/1345800040.db2.gz	CPYILAGVAIGNEP-SFTDATJTSA-N	0	3	341.499	3.417	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccc(Cl)c(C)c3)C2)C1	ZINC001041625474	1345800583	/nfs/dbraw/zinc/80/05/83/1345800583.db2.gz	IJMXQSWWEDGVEU-LJQANCHMSA-N	0	3	330.859	3.210	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)Cc3c(C)cc(C)cc3C)C2)C1	ZINC001041633867	1345804036	/nfs/dbraw/zinc/80/40/36/1345804036.db2.gz	ZTICUXQQHWXOEN-QFIPXVFZSA-N	0	3	338.495	3.102	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@]3(CCN(Cc4cnc(C)s4)C3)C2)C1	ZINC001041652594	1345811132	/nfs/dbraw/zinc/81/11/32/1345811132.db2.gz	KYJFGGSSNDSGQP-IBGZPJMESA-N	0	3	345.512	3.232	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001041719305	1345829999	/nfs/dbraw/zinc/82/99/99/1345829999.db2.gz	AMLXCABWPCOMDM-DYESRHJHSA-N	0	3	339.483	3.275	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)C[C@@H]3CCc4ccccc43)C2)C1	ZINC001041750290	1345839908	/nfs/dbraw/zinc/83/99/08/1345839908.db2.gz	TVRVFZSRQJWROW-UGKGYDQZSA-N	0	3	336.479	3.054	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)CC34CC5CC(CC(C5)C3)C4)C2)C1	ZINC001041804107	1345856690	/nfs/dbraw/zinc/85/66/90/1345856690.db2.gz	QGBRAHMDQSCPDW-OTNIWXAGSA-N	0	3	340.511	3.151	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3csc4c3CC[C@@H](C)C4)C2)C1	ZINC001041816324	1345861208	/nfs/dbraw/zinc/86/12/08/1345861208.db2.gz	MQSDSPAIEJXDHU-QRWLVFNGSA-N	0	3	342.508	3.044	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccc(OC(C)C)cc3)C2)C1	ZINC001041816879	1345861394	/nfs/dbraw/zinc/86/13/94/1345861394.db2.gz	RBXFFAZOTUBZFG-NRFANRHFSA-N	0	3	340.467	3.035	20	30		EGEDHN
C=CCN1CC[C@]2(CCN(C(=O)c3cc(C4CCCC4)no3)C2)C1	ZINC001041837729	1345868027	/nfs/dbraw/zinc/86/80/27/1345868027.db2.gz	MJXCVYCZACDSGI-IBGZPJMESA-N	0	3	329.444	3.056	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)[C@H](C)c3cccc(Cl)c3)C2)C1	ZINC001041841643	1345869637	/nfs/dbraw/zinc/86/96/37/1345869637.db2.gz	QUPMXXTZHBVPAI-BEFAXECRSA-N	0	3	330.859	3.001	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@H]2C1	ZINC001041950844	1345906143	/nfs/dbraw/zinc/90/61/43/1345906143.db2.gz	WBLIAPJMWCUZCM-PMACEKPBSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3nc(C(C)C)oc3C)C[C@@H]21	ZINC001042059890	1345932659	/nfs/dbraw/zinc/93/26/59/1345932659.db2.gz	FSUWSQWJCCNBKY-CVEARBPZSA-N	0	3	331.460	3.219	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cccc4scnc43)C[C@H]21	ZINC001042060113	1345932742	/nfs/dbraw/zinc/93/27/42/1345932742.db2.gz	HUTGTGKTGVKMAU-UKRRQHHQSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3coc4c3cccc4OC)C[C@@H]21	ZINC001042064783	1345933608	/nfs/dbraw/zinc/93/36/08/1345933608.db2.gz	JLVXFQUOZRJGKP-YOEHRIQHSA-N	0	3	340.423	3.164	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(C(F)F)ccc3F)C[C@@H]21	ZINC001042065544	1345934581	/nfs/dbraw/zinc/93/45/81/1345934581.db2.gz	VXGSCIHDLYLSLW-WBMJQRKESA-N	0	3	338.373	3.486	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CCN(C(=O)C4(C5CC5)CC4)C[C@H]32)cc1	ZINC001042106392	1345945824	/nfs/dbraw/zinc/94/58/24/1345945824.db2.gz	BWPQBYMMVYBUKT-UYAOXDASSA-N	0	3	349.478	3.171	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(C)n(C(CC)CC)n3)C[C@@H]21	ZINC001042125445	1345950798	/nfs/dbraw/zinc/95/07/98/1345950798.db2.gz	UHBXSKMOPBAPPS-APWZRJJASA-N	0	3	344.503	3.275	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)Cc3cccc(C)c3Cl)C[C@H]21	ZINC001042150023	1345957354	/nfs/dbraw/zinc/95/73/54/1345957354.db2.gz	VUTOQZIYQMCIQR-SJLPKXTDSA-N	0	3	344.886	3.137	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc(C)c4cccnc34)C[C@@H]21	ZINC001042154863	1345957716	/nfs/dbraw/zinc/95/77/16/1345957716.db2.gz	GHEMGIYIYLWZNS-PXNSSMCTSA-N	0	3	347.462	3.103	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)CCc3ccc(C)c(Cl)c3)C[C@H]21	ZINC001042168358	1345963943	/nfs/dbraw/zinc/96/39/43/1345963943.db2.gz	USJIMOKJJJIGHH-IEBWSBKVSA-N	0	3	344.886	3.137	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cc4ccc(C)cc4[nH]3)C[C@H]21	ZINC001042168009	1345964066	/nfs/dbraw/zinc/96/40/66/1345964066.db2.gz	QPKJYEQFOCTXLY-OXQOHEQNSA-N	0	3	335.451	3.036	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3ncccc3C)[C@H]2C1	ZINC001042188574	1345975376	/nfs/dbraw/zinc/97/53/76/1345975376.db2.gz	UPSOHXOBZNFFFQ-AEFFLSMTSA-N	0	3	327.472	3.025	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3c(F)ccc(F)c3F)C[C@H]21	ZINC001042207788	1345986296	/nfs/dbraw/zinc/98/62/96/1345986296.db2.gz	UHJQCLWHMQRQPW-SWLSCSKDSA-N	0	3	338.373	3.216	20	30		EGEDHN
CCC1(C(=O)N2CC[C@@H]3CCN(Cc4cccc(C#N)c4)[C@@H]3C2)CC1	ZINC001042220769	1345991887	/nfs/dbraw/zinc/99/18/87/1345991887.db2.gz	FKUCUERGETZJMP-RBUKOAKNSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]3CCN(Cc4ccc(C#N)cc4)[C@H]3C2)C1	ZINC001042224311	1345994530	/nfs/dbraw/zinc/99/45/30/1345994530.db2.gz	LKEMDJRSLCFCNI-UXHICEINSA-N	0	3	349.478	3.337	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]3CCN(Cc4cccc(C#N)c4)[C@H]3C2)C1	ZINC001042227034	1345996009	/nfs/dbraw/zinc/99/60/09/1345996009.db2.gz	HMOPMOXZJILMGS-UXHICEINSA-N	0	3	349.478	3.337	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3ccc(C)c(F)c3F)C[C@@H]21	ZINC001042240236	1346000790	/nfs/dbraw/zinc/00/07/90/1346000790.db2.gz	KOEAPGFQNNWBSP-HOCLYGCPSA-N	0	3	334.410	3.386	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ncoc3-c3cccs3)C[C@H]21	ZINC001042271981	1346014749	/nfs/dbraw/zinc/01/47/49/1346014749.db2.gz	JKQBNLCGZZESPM-ZIAGYGMSSA-N	0	3	343.452	3.126	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc4nc(C)ccc4c3)C[C@@H]21	ZINC001042278476	1346015323	/nfs/dbraw/zinc/01/53/23/1346015323.db2.gz	VVTUAAPKLGGNFT-UTKZUKDTSA-N	0	3	347.462	3.103	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccsc3C(F)F)C[C@@H]21	ZINC001042334546	1346041411	/nfs/dbraw/zinc/04/14/11/1346041411.db2.gz	GJQRMONTUKXXRJ-AAEUAGOBSA-N	0	3	326.412	3.408	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3oc4ccccc4c3C)C[C@@H]21	ZINC001042343464	1346046663	/nfs/dbraw/zinc/04/66/63/1346046663.db2.gz	MQJIXJBSENOKOP-WMZOPIPTSA-N	0	3	336.435	3.301	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cc(C)n(C(C)C)c3C)C[C@H]21	ZINC001042345811	1346047793	/nfs/dbraw/zinc/04/77/93/1346047793.db2.gz	NQVRMRFKDUMPHO-UYAOXDASSA-N	0	3	341.499	3.246	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3csc4c3CCCC4)C[C@@H]21	ZINC001042346292	1346048099	/nfs/dbraw/zinc/04/80/99/1346048099.db2.gz	RKUWFLQBJKBTND-PBHICJAKSA-N	0	3	330.497	3.349	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(OC)c(Cl)c3)C[C@@H]21	ZINC001042349747	1346050575	/nfs/dbraw/zinc/05/05/75/1346050575.db2.gz	TUMRWPFYKGDVTA-BBRMVZONSA-N	0	3	334.847	3.071	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3cc(C4CCCC4)no3)C[C@H]21	ZINC001042363471	1346057086	/nfs/dbraw/zinc/05/70/86/1346057086.db2.gz	UIGZFXHHSAMMSI-SJLPKXTDSA-N	0	3	343.471	3.445	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(F)c4occc43)C[C@H]21	ZINC001042363753	1346057134	/nfs/dbraw/zinc/05/71/34/1346057134.db2.gz	XMVVTORZNZRAOB-SUMWQHHRSA-N	0	3	328.387	3.294	20	30		EGEDHN
C#CCN1CC[C@H]2CCN(C(=O)CC3C4CC5CC(C4)CC3C5)C[C@@H]21	ZINC001042366841	1346058694	/nfs/dbraw/zinc/05/86/94/1346058694.db2.gz	YJKSWHMKAVUOGZ-XXRSJGDJSA-N	0	3	340.511	3.005	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)CC(C)(C)c3ccccc3)C[C@@H]21	ZINC001042367843	1346059230	/nfs/dbraw/zinc/05/92/30/1346059230.db2.gz	MCNPHNIEUOCOFG-QUCCMNQESA-N	0	3	338.495	3.300	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3c(Cl)cccc3OC)C[C@@H]21	ZINC001042369701	1346060071	/nfs/dbraw/zinc/06/00/71/1346060071.db2.gz	AAOJASGGLFBUGY-HIFRSBDPSA-N	0	3	334.847	3.071	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3cc4cccc(C)c4o3)C[C@H]21	ZINC001042370180	1346060296	/nfs/dbraw/zinc/06/02/96/1346060296.db2.gz	CHXPVXDZNKTLHJ-SJLPKXTDSA-N	0	3	336.435	3.301	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C34CC(C(C)(C)C)(C3)C4)C[C@@H]21	ZINC001042375130	1346062445	/nfs/dbraw/zinc/06/24/45/1346062445.db2.gz	SMABLZRYTJWFLM-UUBYJMPYSA-N	0	3	328.500	3.149	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)CCc3cc(C)sc3C)C[C@@H]21	ZINC001042374522	1346062965	/nfs/dbraw/zinc/06/29/65/1346062965.db2.gz	IQTFVYVHAFHNRM-MJGOQNOKSA-N	0	3	344.524	3.244	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N(C)C1CN(CC2CCCCCC2)C1	ZINC001044038735	1346237887	/nfs/dbraw/zinc/23/78/87/1346237887.db2.gz	HHIDUHNOSPLPJZ-OALUTQOASA-N	0	3	334.504	3.081	20	30		EGEDHN
C[C@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)c1ccsc1	ZINC001044436783	1346331052	/nfs/dbraw/zinc/33/10/52/1346331052.db2.gz	IXKXTSKNVYAIGF-KBXCAEBGSA-N	0	3	339.464	3.403	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)c1ccsc1	ZINC001044436786	1346331171	/nfs/dbraw/zinc/33/11/71/1346331171.db2.gz	IXKXTSKNVYAIGF-RDTXWAMCSA-N	0	3	339.464	3.403	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2cc(F)ccc2C#N)CCN1C(=O)CC1CCC1	ZINC001044532951	1346360125	/nfs/dbraw/zinc/36/01/25/1346360125.db2.gz	UKFPRCBGLQHNIN-AUUYWEPGSA-N	0	3	343.446	3.357	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)/C=C\c1ccc[nH]1	ZINC001044570488	1346371506	/nfs/dbraw/zinc/37/15/06/1346371506.db2.gz	IQPPMZOVJZOPEV-YEPKGFQBSA-N	0	3	348.450	3.069	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3cnc(C)cn3)C[C@@H]2C)CC1	ZINC001044728606	1346413556	/nfs/dbraw/zinc/41/35/56/1346413556.db2.gz	APCSXTQEKHMWLB-FUHWJXTLSA-N	0	3	342.487	3.001	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@@H](NCc3ccccc3C#N)C[C@@H]2C)ccn1	ZINC001044786130	1346428317	/nfs/dbraw/zinc/42/83/17/1346428317.db2.gz	ZLESAZOUBSCYDR-OXJNMPFZSA-N	0	3	348.450	3.045	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)C2(F)CCCC2)c(F)c1	ZINC001045098101	1346494696	/nfs/dbraw/zinc/49/46/96/1346494696.db2.gz	WJPAFSCBTMNIHC-INIZCTEOSA-N	0	3	347.409	3.060	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H]1C(=O)N1CCC[C@H]1CNCc1ccc(C#N)s1	ZINC001045209282	1346529859	/nfs/dbraw/zinc/52/98/59/1346529859.db2.gz	VAQISRVYPWRADP-RVKKMQEKSA-N	0	3	345.512	3.383	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)C2CCC=CCC2)s1	ZINC001045314139	1346556984	/nfs/dbraw/zinc/55/69/84/1346556984.db2.gz	YYOFBAVLLNXCQS-INIZCTEOSA-N	0	3	343.496	3.447	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2ccc3c(c2)C(C)(C)CO3)CC1	ZINC001045499510	1346610694	/nfs/dbraw/zinc/61/06/94/1346610694.db2.gz	BXYSALYCNMGCEP-UHFFFAOYSA-N	0	3	328.456	3.127	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2cnc3c(F)cccc3c2)CC1	ZINC001045504417	1346611949	/nfs/dbraw/zinc/61/19/49/1346611949.db2.gz	NGFCBIRHJQTSCE-UHFFFAOYSA-N	0	3	327.403	3.144	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)NC2(C)CCN(Cc3cccc(C#N)c3)CC2)C1	ZINC001045577249	1346634592	/nfs/dbraw/zinc/63/45/92/1346634592.db2.gz	LSBPFVFLNSTOGN-LPHOPBHVSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2cccc(OCC(C)C)c2)CC1	ZINC001045635889	1346655034	/nfs/dbraw/zinc/65/50/34/1346655034.db2.gz	YJDMUPKJOMVIMY-UHFFFAOYSA-N	0	3	330.472	3.492	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc3c(o1)CCCC3)C2	ZINC001045945108	1346780518	/nfs/dbraw/zinc/78/05/18/1346780518.db2.gz	UAZIJUPESQQCKP-NRFANRHFSA-N	0	3	340.467	3.110	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)C[C@@H]1C[C@H]1C1CC1)C2	ZINC001045953998	1346789370	/nfs/dbraw/zinc/78/93/70/1346789370.db2.gz	OQTFPDIGPHHBIK-ZJOUEHCJSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)Cc1cc(C)ccc1C)C2	ZINC001045960654	1346795612	/nfs/dbraw/zinc/79/56/12/1346795612.db2.gz	PGEHBOBNNCYJHI-JOCHJYFZSA-N	0	3	338.495	3.184	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1c(F)ccc(C)c1F)C2	ZINC001045964597	1346799628	/nfs/dbraw/zinc/79/96/28/1346799628.db2.gz	LZRIRCSWLMHCBK-HXUWFJFHSA-N	0	3	346.421	3.225	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H]1C[C@H]1CC(C)C)C2	ZINC001045968269	1346802883	/nfs/dbraw/zinc/80/28/83/1346802883.db2.gz	MGVYJHDSAYNPNM-SBHAEUEKSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@H](C)Cc1cccs1)C2	ZINC001045968600	1346802996	/nfs/dbraw/zinc/80/29/96/1346802996.db2.gz	DHCYFEQIKRZWEZ-XLIONFOSSA-N	0	3	344.524	3.265	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc(C)cc1F)C2	ZINC001045969369	1346804734	/nfs/dbraw/zinc/80/47/34/1346804734.db2.gz	PJECHZABCOPFAZ-HXUWFJFHSA-N	0	3	328.431	3.086	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H](C)c1cccc(C)c1)C2	ZINC001045969497	1346804917	/nfs/dbraw/zinc/80/49/17/1346804917.db2.gz	RNLPJVORXJVRJS-UGKGYDQZSA-N	0	3	338.495	3.436	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H](F)c1ccccc1)C2	ZINC001045972360	1346808813	/nfs/dbraw/zinc/80/88/13/1346808813.db2.gz	ZBXUCGUJXPFMJH-ICSRJNTNSA-N	0	3	328.431	3.035	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccoc1CCC)C2	ZINC001045978714	1346815437	/nfs/dbraw/zinc/81/54/37/1346815437.db2.gz	GMOSUQVYTRFYPX-FQEVSTJZSA-N	0	3	328.456	3.184	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H](C)n1c(C)ccc1C)C2	ZINC001045986637	1346828464	/nfs/dbraw/zinc/82/84/64/1346828464.db2.gz	WSEXHZKXQWMOKP-CTNGQTDRSA-N	0	3	341.499	3.004	20	30		EGEDHN
C#CCCN1CC[C@@](C)(NC(=O)c2oc3c(cccc3F)c2C)C1	ZINC001046377430	1346955272	/nfs/dbraw/zinc/95/52/72/1346955272.db2.gz	LETMROFVTBSHIB-LJQANCHMSA-N	0	3	328.387	3.098	20	30		EGEDHN
C#CCCN1CC[C@](C)(NC(=O)c2cc3cc(Cl)ccc3o2)C1	ZINC001046457695	1346980310	/nfs/dbraw/zinc/98/03/10/1346980310.db2.gz	IVMYMPLGRGMQMV-SFHVURJKSA-N	0	3	330.815	3.304	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)[C@@H]2C[C@H]2c2c(F)cccc2F)C1	ZINC001046605225	1347036225	/nfs/dbraw/zinc/03/62/25/1347036225.db2.gz	PILNMIMLFNZAPH-LPMFXHHGSA-N	0	3	334.410	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2cccc(-c3cnco3)c2)C1	ZINC001046740525	1347078428	/nfs/dbraw/zinc/07/84/28/1347078428.db2.gz	ADGOQBAVNQYXRH-IBGZPJMESA-N	0	3	325.412	3.112	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@]2(C)CCN(Cc3ccc(C)cc3C)C2)cn1	ZINC001046779664	1347096948	/nfs/dbraw/zinc/09/69/48/1347096948.db2.gz	XHSHYQGSVJQJAA-JOCHJYFZSA-N	0	3	347.462	3.074	20	30		EGEDHN
C#CCCN1CC[C@@](C)(NC(=O)c2cccc(Cl)c2Cl)C1	ZINC001046791841	1347104799	/nfs/dbraw/zinc/10/47/99/1347104799.db2.gz	NGJZRKYBYNSHMR-MRXNPFEDSA-N	0	3	325.239	3.211	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2cccc(OCC(C)C)c2)C1	ZINC001046822743	1347119563	/nfs/dbraw/zinc/11/95/63/1347119563.db2.gz	UUWHJZLAGZQTSP-HXUWFJFHSA-N	0	3	330.472	3.492	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2ccoc2C2CC2)C1	ZINC001046971477	1347172187	/nfs/dbraw/zinc/17/21/87/1347172187.db2.gz	QHPIQEAXFNTGES-CQSZACIVSA-N	0	3	338.398	3.420	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@@H](CNC(=O)c2c(C)cc(C)cc2C)C1	ZINC001046997061	1347179931	/nfs/dbraw/zinc/17/99/31/1347179931.db2.gz	SNPSEXQGZWQIJI-KRWDZBQOSA-N	0	3	348.437	3.322	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@H]3C[C@@H](C2)N(Cc2cc(C)no2)C3)CC1	ZINC001047139054	1347217576	/nfs/dbraw/zinc/21/75/76/1347217576.db2.gz	KNZTXTRXBRYZMO-SZMVWBNQSA-N	0	3	343.471	3.199	20	30		EGEDHN
C=C(C)CN1CCC([C@@H]2CCCN(C(=O)C(=O)C(C)(C)C)C2)CC1	ZINC001047231988	1347261197	/nfs/dbraw/zinc/26/11/97/1347261197.db2.gz	REHLMXLEOCPYJM-QGZVFWFLSA-N	0	3	334.504	3.128	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3cc[nH]c3C3CC3)C2)CC1	ZINC001047247142	1347272276	/nfs/dbraw/zinc/27/22/76/1347272276.db2.gz	CTBFCGWDSIRCFB-GOSISDBHSA-N	0	3	339.483	3.090	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@@H]3CC[C@@H]4C[C@@H]4CC3)C2)CC1	ZINC001047251648	1347276698	/nfs/dbraw/zinc/27/66/98/1347276698.db2.gz	UPPJIXQSTRGMFQ-BURNTYAHSA-N	0	3	342.527	3.397	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3cc4ccccn4c3)C2)CC1	ZINC001047258368	1347281154	/nfs/dbraw/zinc/28/11/54/1347281154.db2.gz	BDBHQSNONVGKSY-LJQANCHMSA-N	0	3	349.478	3.137	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3csc(C)c3)C2)CC1	ZINC001047260773	1347282645	/nfs/dbraw/zinc/28/26/45/1347282645.db2.gz	WDUATODVKPYDRS-QGZVFWFLSA-N	0	3	330.497	3.254	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)C[C@@H](C)n3cccc3)C2)CC1	ZINC001047263914	1347284825	/nfs/dbraw/zinc/28/48/25/1347284825.db2.gz	KNFSMPWFRWIWDQ-UYAOXDASSA-N	0	3	341.499	3.023	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)C[C@H](C)n3cccc3)C2)CC1	ZINC001047263909	1347285140	/nfs/dbraw/zinc/28/51/40/1347285140.db2.gz	KNFSMPWFRWIWDQ-AZUAARDMSA-N	0	3	341.499	3.023	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)C(C)(C)C(C)(F)F)C2)CC1	ZINC001047264249	1347285565	/nfs/dbraw/zinc/28/55/65/1347285565.db2.gz	NAKWDHPHHUSJBJ-MRXNPFEDSA-N	0	3	340.458	3.252	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3c(F)cccc3F)C2)CC1	ZINC001047265362	1347286521	/nfs/dbraw/zinc/28/65/21/1347286521.db2.gz	QEANCCOQXJMFMC-INIZCTEOSA-N	0	3	346.421	3.162	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)c3ccc(F)s3)C2)CC1	ZINC001047265349	1347286628	/nfs/dbraw/zinc/28/66/28/1347286628.db2.gz	GWDAKNLRGQONFB-MRXNPFEDSA-N	0	3	348.487	3.475	20	30		EGEDHN
C[C@H]1CN(C(=O)c2cccs2)C[C@H]1CNCc1ccccc1C#N	ZINC001048118699	1347472888	/nfs/dbraw/zinc/47/28/88/1347472888.db2.gz	MUFVJEHQGKMURW-WMLDXEAASA-N	0	3	339.464	3.118	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2CCCC2)C[C@H]1CNCc1ccccc1C#N	ZINC001048122012	1347474365	/nfs/dbraw/zinc/47/43/65/1347474365.db2.gz	KCGGFIZMVMHWFN-OXQOHEQNSA-N	0	3	339.483	3.323	20	30		EGEDHN
CC(C(=O)N1C[C@H](C)[C@H](CNCc2ccccc2C#N)C1)=C1CCC1	ZINC001048246803	1347501666	/nfs/dbraw/zinc/50/16/66/1347501666.db2.gz	DDDMELLFYKNEBE-MGPUTAFESA-N	0	3	337.467	3.243	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2C=CC=CC=C2)C[C@@H]1CNCc1ccccc1C#N	ZINC001048268712	1347506983	/nfs/dbraw/zinc/50/69/83/1347506983.db2.gz	ZPBDTFILGBWCNA-UTKZUKDTSA-N	0	3	347.462	3.041	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@@H](CNCc2csc(CC)n2)C1	ZINC001048337698	1347522438	/nfs/dbraw/zinc/52/24/38/1347522438.db2.gz	FIVNOUJZGSOUFC-CABCVRRESA-N	0	3	349.544	3.492	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H](C)[C@@H](CNCc2csc(CCC)n2)C1	ZINC001048344654	1347524913	/nfs/dbraw/zinc/52/49/13/1347524913.db2.gz	QTOPBSIJPRQPJQ-GJZGRUSLSA-N	0	3	349.544	3.492	20	30		EGEDHN
C[C@H]1CN(C(=O)C(C)(C)C2CC2)C[C@@H]1CNCc1ccccc1C#N	ZINC001048347430	1347526314	/nfs/dbraw/zinc/52/63/14/1347526314.db2.gz	DDJLYIAPLMPSFF-YJBOKZPZSA-N	0	3	339.483	3.179	20	30		EGEDHN
CC(C)C1(C(=O)N2C[C@H](C)[C@H](CNCc3ccccc3C#N)C2)CC1	ZINC001048374854	1347535127	/nfs/dbraw/zinc/53/51/27/1347535127.db2.gz	RTCFVSFLUOAPQP-QFBILLFUSA-N	0	3	339.483	3.179	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)[C@@H]2CC[C@H](C)C2)CC1	ZINC001048626525	1347624546	/nfs/dbraw/zinc/62/45/46/1347624546.db2.gz	RRIKZJWFSDQVBF-ZWKOTPCHSA-N	0	3	341.499	3.497	20	30		EGEDHN
C[C@@H](c1ccccc1Cl)N1C[C@@H]2CN(C(=O)C#CC3CC3)C[C@@H]2C1	ZINC001048812105	1347663092	/nfs/dbraw/zinc/66/30/92/1347663092.db2.gz	AFSAXDHYBHDPFB-BHYGNILZSA-N	0	3	342.870	3.205	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3coc4cc(C)c(C)cc34)C[C@@H]2C1	ZINC001048959857	1347692072	/nfs/dbraw/zinc/69/20/72/1347692072.db2.gz	OCLRSPGBSIXOLH-CALCHBBNSA-N	0	3	336.435	3.077	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CN(Cc4c(C)nsc4C)C[C@H]3C2)C1	ZINC001049045821	1347715059	/nfs/dbraw/zinc/71/50/59/1347715059.db2.gz	CKNNGJIUUCYTQO-IYBDPMFKSA-N	0	3	345.512	3.006	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3oc4c(cccc4C)c3C)C[C@@H]2C1	ZINC001049233361	1347752963	/nfs/dbraw/zinc/75/29/63/1347752963.db2.gz	NDENSBCEKWTXGY-CALCHBBNSA-N	0	3	336.435	3.077	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)C[C@@H]2C=CCC2)cc1	ZINC001049316234	1347787843	/nfs/dbraw/zinc/78/78/43/1347787843.db2.gz	UQQAIFVMSOBJHE-JRGCBEDISA-N	0	3	349.478	3.480	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)C2=CCCC2)c1	ZINC001049414179	1347837018	/nfs/dbraw/zinc/83/70/18/1347837018.db2.gz	BTRHNBNXDTXANM-WOJBJXKFSA-N	0	3	335.451	3.234	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@H]2[C@H]1CCN2Cc1cc2ccccc2o1	ZINC001049466177	1347861924	/nfs/dbraw/zinc/86/19/24/1347861924.db2.gz	BQPFKCOTDBJLDY-VQTJNVASSA-N	0	3	348.446	3.412	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@@H]2[C@@H]1CCN2Cc1ccc(CF)cc1	ZINC001049466891	1347863293	/nfs/dbraw/zinc/86/32/93/1347863293.db2.gz	LGLJJJRDPAROFP-UXHICEINSA-N	0	3	340.442	3.135	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1nc(C(C)C)oc1C	ZINC001049468405	1347863663	/nfs/dbraw/zinc/86/36/63/1347863663.db2.gz	HNGDMRLCFRVKPI-HOTGVXAUSA-N	0	3	331.460	3.361	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(C(C)(C)C)cn1	ZINC001049488629	1347872584	/nfs/dbraw/zinc/87/25/84/1347872584.db2.gz	YYDHOAJHYZNQLZ-ROUUACIJSA-N	0	3	327.472	3.244	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(C)c(OC)c(C)c1	ZINC001049493408	1347875801	/nfs/dbraw/zinc/87/58/01/1347875801.db2.gz	YYEWJJIWENKIBM-MOPGFXCFSA-N	0	3	340.467	3.014	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(C2CC2)n(CC)n1	ZINC001049516661	1347887903	/nfs/dbraw/zinc/88/79/03/1347887903.db2.gz	DZZCHFTXBGONOX-QZTJIDSGSA-N	0	3	342.487	3.035	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cccc2ccc(C)nc21	ZINC001049541555	1347898884	/nfs/dbraw/zinc/89/88/84/1347898884.db2.gz	RGVTWLWIIRZLFI-UXHICEINSA-N	0	3	347.462	3.245	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1CCC[C@H]2[C@@H]1CCN2CC=C	ZINC001049554604	1347907247	/nfs/dbraw/zinc/90/72/47/1347907247.db2.gz	GUNRQDVIYGGWTQ-ROUUACIJSA-N	0	3	326.440	3.116	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1c(C)occ1C(F)(F)F	ZINC001049597596	1347929394	/nfs/dbraw/zinc/92/93/94/1347929394.db2.gz	FENOJGOAFKJKNU-UONOGXRCSA-N	0	3	342.361	3.472	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1c(C)occ1C(F)(F)F	ZINC001049597595	1347929498	/nfs/dbraw/zinc/92/94/98/1347929498.db2.gz	FENOJGOAFKJKNU-KGLIPLIRSA-N	0	3	342.361	3.472	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc2ccc(OC)cc2[nH]1	ZINC001049632625	1347944631	/nfs/dbraw/zinc/94/46/31/1347944631.db2.gz	ZLNATUJGDURGRO-MOPGFXCFSA-N	0	3	339.439	3.041	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cncc(OC(C)C)c1	ZINC001049635934	1347946609	/nfs/dbraw/zinc/94/66/09/1347946609.db2.gz	WWBUVLSTOPKOOL-OALUTQOASA-N	0	3	343.471	3.124	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccccc1-n1cccc1	ZINC001049685862	1347971698	/nfs/dbraw/zinc/97/16/98/1347971698.db2.gz	BQCGVFJYIORPJT-RTWAWAEBSA-N	0	3	347.462	3.180	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]3[C@H]2CCN3Cc2cnccc2C)C1	ZINC001049706750	1347983455	/nfs/dbraw/zinc/98/34/55/1347983455.db2.gz	KEZLMWJQNPEHJC-RBUKOAKNSA-N	0	3	339.483	3.312	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(C(C)C)nc1C	ZINC001049729882	1347992181	/nfs/dbraw/zinc/99/21/81/1347992181.db2.gz	YBNFXCQETJHLHY-OALUTQOASA-N	0	3	327.472	3.378	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C1[C@H]2CCCCCC[C@H]12	ZINC001049749270	1347999245	/nfs/dbraw/zinc/99/92/45/1347999245.db2.gz	QXXZHLMYJPIYMY-CADBVGFASA-N	0	3	328.500	3.291	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1cccc2sccc21	ZINC001049762636	1348007789	/nfs/dbraw/zinc/00/77/89/1348007789.db2.gz	QWCQVNZISPIFPP-ZWKOTPCHSA-N	0	3	338.476	3.142	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)C1(Cc2ccc(F)cc2)CC1	ZINC001049772937	1348014914	/nfs/dbraw/zinc/01/49/14/1348014914.db2.gz	MFDHDRJRCOKDQD-MOPGFXCFSA-N	0	3	342.458	3.400	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1oc(C2CC2)nc1C	ZINC001049773988	1348015371	/nfs/dbraw/zinc/01/53/71/1348015371.db2.gz	ULCCHRGQHZYXNL-HOTGVXAUSA-N	0	3	329.444	3.115	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccccc1F	ZINC001049782196	1348019196	/nfs/dbraw/zinc/01/91/96/1348019196.db2.gz	OOBYVRBFOLXSMX-CUDHKJQZSA-N	0	3	340.442	3.018	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccc(C)s1	ZINC001049783300	1348019903	/nfs/dbraw/zinc/01/99/03/1348019903.db2.gz	SXOKIKQORCIYTM-BDXSIMOUSA-N	0	3	342.508	3.249	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](C)c1cc(C)oc1C	ZINC001049791268	1348023842	/nfs/dbraw/zinc/02/38/42/1348023842.db2.gz	RMMUBQDSQKOGST-AYOQOUSVSA-N	0	3	328.456	3.089	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cccc(OC)c1F	ZINC001049800073	1348026427	/nfs/dbraw/zinc/02/64/27/1348026427.db2.gz	AGWJOQQOKPMOGA-HOTGVXAUSA-N	0	3	332.419	3.089	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cccc(OC(C)C)n1	ZINC001049827792	1348043533	/nfs/dbraw/zinc/04/35/33/1348043533.db2.gz	LYLGMNXFWHYSJA-QZTJIDSGSA-N	0	3	343.471	3.124	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(C2CC2)cn1	ZINC001049872737	1348077922	/nfs/dbraw/zinc/07/79/22/1348077922.db2.gz	XYRZXEUXKZLSIX-RTBURBONSA-N	0	3	325.456	3.214	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1sccc1C(F)F	ZINC001049875308	1348080527	/nfs/dbraw/zinc/08/05/27/1348080527.db2.gz	IQHZWIQBZVRSLO-ZIAGYGMSSA-N	0	3	338.423	3.388	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1c[nH]cc1-c1ccccc1	ZINC001049898014	1348099179	/nfs/dbraw/zinc/09/91/79/1348099179.db2.gz	VQOOEOVIMIEGJV-LEWJYISDSA-N	0	3	347.462	3.384	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](C)c1cccc(F)c1	ZINC001049905187	1348103607	/nfs/dbraw/zinc/10/36/07/1348103607.db2.gz	VWFRMKJXQSQFGC-ZYSHUDEJSA-N	0	3	328.431	3.018	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)CC[C@H]1CCc2ccccc21	ZINC001049910851	1348107026	/nfs/dbraw/zinc/10/70/26/1348107026.db2.gz	WJTBKTPZHWWCJN-HLAWJBBLSA-N	0	3	336.479	3.195	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H]1Cc2c1cccc2Cl	ZINC001049920972	1348113538	/nfs/dbraw/zinc/11/35/38/1348113538.db2.gz	DBJXEEASZTXASU-NZSAHSFTSA-N	0	3	342.870	3.068	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](C)Cc1cccc(F)c1	ZINC001049923513	1348115317	/nfs/dbraw/zinc/11/53/17/1348115317.db2.gz	MZNCIHHUADRJOT-ATZDWAIDSA-N	0	3	330.447	3.256	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1csc(CC(C)C)n1	ZINC001049927490	1348118008	/nfs/dbraw/zinc/11/80/08/1348118008.db2.gz	LCQROPINIXCZTQ-HOTGVXAUSA-N	0	3	333.501	3.207	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1cnc(C(C)(C)C)nc1	ZINC001049927318	1348118141	/nfs/dbraw/zinc/11/81/41/1348118141.db2.gz	JCFATPKZBNQWSP-SJORKVTESA-N	0	3	342.487	3.029	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3ccn(C4CCCC4)n3)[C@@H]2C1	ZINC001050059827	1348168991	/nfs/dbraw/zinc/16/89/91/1348168991.db2.gz	KCQYUTDJACWVNF-QFBILLFUSA-N	0	3	342.487	3.111	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3ccc(F)c4ccncc34)[C@@H]2C1	ZINC001050123175	1348189401	/nfs/dbraw/zinc/18/94/01/1348189401.db2.gz	PCCRNTBWZMRSQI-IFXJQAMLSA-N	0	3	339.414	3.096	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001050484199	1348277407	/nfs/dbraw/zinc/27/74/07/1348277407.db2.gz	IUKCCQHTMGFEPK-GOSISDBHSA-N	0	3	337.467	3.029	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cccc4c3CCCC4)C2)CC1	ZINC001050530205	1348284321	/nfs/dbraw/zinc/28/43/21/1348284321.db2.gz	SRYHHWPOHCDRJE-UHFFFAOYSA-N	0	3	336.479	3.127	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@@H](CC)C3CCC(C)CC3)C2)CC1	ZINC001050539134	1348286182	/nfs/dbraw/zinc/28/61/82/1348286182.db2.gz	NXOVYEQYLOIVDC-ACBHZAAOSA-N	0	3	330.516	3.397	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC2(C1)CCN(Cc1scnc1C)CC2	ZINC001050614021	1348302800	/nfs/dbraw/zinc/30/28/00/1348302800.db2.gz	JNZPAEBXUDCXFT-UHFFFAOYSA-N	0	3	347.528	3.478	20	30		EGEDHN
C=C1CCC(C(=O)N2CC3(C2)CCN(Cc2ccccn2)CC3)CC1	ZINC001050643863	1348313112	/nfs/dbraw/zinc/31/31/12/1348313112.db2.gz	TWXYMSMNBXJMSY-UHFFFAOYSA-N	0	3	339.483	3.252	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cc4cc(F)ccc4o3)C2)CC1	ZINC001050683401	1348325614	/nfs/dbraw/zinc/32/56/14/1348325614.db2.gz	IEJWEQQMSHZHGM-UHFFFAOYSA-N	0	3	340.398	3.133	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3ccc(O[C@H](C)CC)cc3)C2)CC1	ZINC001050720815	1348336789	/nfs/dbraw/zinc/33/67/89/1348336789.db2.gz	URLKGWUELSGFRE-QGZVFWFLSA-N	0	3	340.467	3.035	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cc(C)c(F)cc3Cl)C2)CC1	ZINC001050740704	1348344591	/nfs/dbraw/zinc/34/45/91/1348344591.db2.gz	UCEJSPQXYCOJPV-UHFFFAOYSA-N	0	3	348.849	3.349	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3cc4c(s3)CC[C@H](C)C4)C2)CC1	ZINC001050750261	1348348221	/nfs/dbraw/zinc/34/82/21/1348348221.db2.gz	FMWIFDJVJZJDAH-HNNXBMFYSA-N	0	3	342.508	3.044	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)CC(C)(C)c3ccccc3)C2)CC1	ZINC001050765449	1348352134	/nfs/dbraw/zinc/35/21/34/1348352134.db2.gz	QMCNCNQKNYZYIH-UHFFFAOYSA-N	0	3	338.495	3.302	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc(C(C)C)s3)C2)CC1	ZINC001050767580	1348353530	/nfs/dbraw/zinc/35/35/30/1348353530.db2.gz	GBVSTICCPGGEMG-UHFFFAOYSA-N	0	3	330.497	3.433	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3ccccc3F)cccc2C1	ZINC001051278097	1348414999	/nfs/dbraw/zinc/41/49/99/1348414999.db2.gz	HPAYUVUEOFQZDK-UHFFFAOYSA-N	0	3	336.410	3.137	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3ccnc(F)c3)cccc2C1	ZINC001051283035	1348416961	/nfs/dbraw/zinc/41/69/61/1348416961.db2.gz	BMCGMAPLSBPHMX-UHFFFAOYSA-N	0	3	339.414	3.085	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3occ4c3CCC4)cccc2C1	ZINC001051294299	1348423229	/nfs/dbraw/zinc/42/32/29/1348423229.db2.gz	GUNQLGWIBZLKHP-UHFFFAOYSA-N	0	3	348.446	3.080	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3csc(C)n3)cccc2C1	ZINC001051298304	1348423853	/nfs/dbraw/zinc/42/38/53/1348423853.db2.gz	KSXQCAKPUJJWMT-UHFFFAOYSA-N	0	3	341.480	3.316	20	30		EGEDHN
C=C(C)CCN1CCN([C@H]2CCN(C(=O)C3=CCCCCC3)C2)CC1	ZINC001052017804	1348497000	/nfs/dbraw/zinc/49/70/00/1348497000.db2.gz	VLAPNGWITWNXAM-FQEVSTJZSA-N	0	3	345.531	3.062	20	30		EGEDHN
C=CCCN1CCN([C@@H]2CCN(C(=O)CC3CCCCCC3)C2)CC1	ZINC001052086528	1348501685	/nfs/dbraw/zinc/50/16/85/1348501685.db2.gz	ULKNNKUCCYKSPA-HXUWFJFHSA-N	0	3	347.547	3.142	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cccc(-n3cccc3)c2)CC1	ZINC001052534732	1348568810	/nfs/dbraw/zinc/56/88/10/1348568810.db2.gz	NFWVMNGFWOIDJN-LJQANCHMSA-N	0	3	335.451	3.085	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2ccc3c4c(cccc42)CC3)CC1	ZINC001052540558	1348572421	/nfs/dbraw/zinc/57/24/21/1348572421.db2.gz	INVBGPPXGPMHTA-GOSISDBHSA-N	0	3	332.447	3.156	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cc(-c3cccs3)on2)CC1	ZINC001052600971	1348591179	/nfs/dbraw/zinc/59/11/79/1348591179.db2.gz	COWAXXGWROCZBF-AWEZNQCLSA-N	0	3	343.452	3.011	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)s2)CC1	ZINC001052653221	1348614987	/nfs/dbraw/zinc/61/49/87/1348614987.db2.gz	ISRYXLQQQWQNAI-BFHYXJOUSA-N	0	3	336.888	3.109	20	30		EGEDHN
C=C(C)CCN1C[C@@H](C)[C@H](NC(=O)c2nc(C(C)(C)C)cs2)C1	ZINC001079897683	1357417733	/nfs/dbraw/zinc/41/77/33/1357417733.db2.gz	KGNXMTNMVBZPIS-ZIAGYGMSSA-N	0	3	335.517	3.457	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)Cc2c(C)cc(C)cc2C)CC1	ZINC001052676675	1348626084	/nfs/dbraw/zinc/62/60/84/1348626084.db2.gz	JADFWOSKSFMHGA-LJQANCHMSA-N	0	3	326.484	3.148	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCCN(CCc3csc(C)n3)CC2)C1	ZINC001052691896	1348634834	/nfs/dbraw/zinc/63/48/34/1348634834.db2.gz	YXISKHOUYLEQML-INIZCTEOSA-N	0	3	347.528	3.321	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc(C(F)F)c(F)c2)CC1	ZINC001052707516	1348643799	/nfs/dbraw/zinc/64/37/99/1348643799.db2.gz	FUDGYXBOZFQBSA-CQSZACIVSA-N	0	3	338.373	3.371	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2ccccc2O[C@H](C)CC)CC1	ZINC001052754624	1348664811	/nfs/dbraw/zinc/66/48/11/1348664811.db2.gz	OFPPBQRJSHCNRC-SJORKVTESA-N	0	3	328.456	3.081	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)Cc2c(F)cccc2Cl)CC1	ZINC001052891423	1348727897	/nfs/dbraw/zinc/72/78/97/1348727897.db2.gz	SIBGUPUJZQFWKG-AWEZNQCLSA-N	0	3	336.838	3.016	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2cc3c(cccc3F)s2)CC1	ZINC001052921811	1348749113	/nfs/dbraw/zinc/74/91/13/1348749113.db2.gz	KQUOZWWIPRDVTI-CYBMUJFWSA-N	0	3	330.428	3.258	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2cc3c(s2)CC[C@H](C)C3)CC1	ZINC001052923803	1348750629	/nfs/dbraw/zinc/75/06/29/1348750629.db2.gz	MPWMAAVTHDVHFU-HOCLYGCPSA-N	0	3	330.497	3.090	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc(COC(C)C)cc2)CC1	ZINC001052923869	1348750824	/nfs/dbraw/zinc/75/08/24/1348750824.db2.gz	OQXQSIDQBXFFKF-FQEVSTJZSA-N	0	3	342.483	3.219	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)C2(c3ccc(C)cc3)CCC2)CC1	ZINC001052965581	1348776348	/nfs/dbraw/zinc/77/63/48/1348776348.db2.gz	PLPQHYSDOJIWDN-HXUWFJFHSA-N	0	3	338.495	3.411	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc(C(C)(F)F)cc2)CC1	ZINC001052983336	1348788007	/nfs/dbraw/zinc/78/80/07/1348788007.db2.gz	JJJHZCPPRYYBTO-KRWDZBQOSA-N	0	3	334.410	3.406	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)/C=C/c2ccco2)C1	ZINC001053060067	1348868962	/nfs/dbraw/zinc/86/89/62/1348868962.db2.gz	CRRYOAKHLPXIRD-VMSVZYTISA-N	0	3	326.440	3.019	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)/C=C\c2ccco2)C1	ZINC001053061068	1348870320	/nfs/dbraw/zinc/87/03/20/1348870320.db2.gz	MJMJXBLZSHUFNR-IACUCBDGSA-N	0	3	340.467	3.409	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)Cc2ccsc2)C1	ZINC001053061695	1348871149	/nfs/dbraw/zinc/87/11/49/1348871149.db2.gz	UNLMTLSKBPIDAG-MOPGFXCFSA-N	0	3	344.524	3.407	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cc(C)oc2C)C1	ZINC001053067375	1348879959	/nfs/dbraw/zinc/87/99/59/1348879959.db2.gz	RCPRARORQFNJDN-HKUYNNGSSA-N	0	3	328.456	3.236	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2occc2C)C1	ZINC001053067554	1348881466	/nfs/dbraw/zinc/88/14/66/1348881466.db2.gz	RUAYUFKHDKKDMU-MSOLQXFVSA-N	0	3	328.456	3.318	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cc(C)c(C)o2)C1	ZINC001053079686	1348900382	/nfs/dbraw/zinc/90/03/82/1348900382.db2.gz	KSBDKGFTIWIPPX-ROUUACIJSA-N	0	3	328.456	3.236	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cc(C)cs2)C1	ZINC001053082773	1348904090	/nfs/dbraw/zinc/90/40/90/1348904090.db2.gz	GPJTWFCKJILJPO-DLBZAZTESA-N	0	3	330.497	3.396	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cc[nH]c2CC)C1	ZINC001053083340	1348904457	/nfs/dbraw/zinc/90/44/57/1348904457.db2.gz	KEXWEWHZUKJXPN-PXNSSMCTSA-N	0	3	341.499	3.307	20	30		EGEDHN
O=C(C#CC1CC1)N1CCCC[C@@H]1[C@H]1CCCN(C/C=C/Cl)C1	ZINC001053087413	1348910551	/nfs/dbraw/zinc/91/05/51/1348910551.db2.gz	SYEOTPWLGLTSKE-XYFLWFSWSA-N	0	3	334.891	3.245	20	30		EGEDHN
O=C(C#CC1CC1)N1CCCC[C@@H]1[C@@H]1CCCN(C/C=C\Cl)C1	ZINC001053087411	1348910816	/nfs/dbraw/zinc/91/08/16/1348910816.db2.gz	SYEOTPWLGLTSKE-PMLHVVFWSA-N	0	3	334.891	3.245	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2nc(C)sc2C)C1	ZINC001053088203	1348913426	/nfs/dbraw/zinc/91/34/26/1348913426.db2.gz	QWOQDUPJYCMFMO-IAGOWNOFSA-N	0	3	345.512	3.100	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cc(C)c(CC)o2)C1	ZINC001053103639	1348937583	/nfs/dbraw/zinc/93/75/83/1348937583.db2.gz	JNKOVHWCADAFMH-ZWKOTPCHSA-N	0	3	342.483	3.490	20	30		EGEDHN
C=C(C)CCN1Cc2ccccc2C[C@@H]1CNC(=O)c1[nH]ccc1C	ZINC001054040069	1349135453	/nfs/dbraw/zinc/13/54/53/1349135453.db2.gz	APLWJDLOQOYEAN-LJQANCHMSA-N	0	3	337.467	3.446	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cn(C)c3ccccc13)C2	ZINC001054160972	1349162969	/nfs/dbraw/zinc/16/29/69/1349162969.db2.gz	UJQNNSFVRVEICE-JOCHJYFZSA-N	0	3	349.478	3.130	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)C(C)(C)c1cccs1)C2	ZINC001054174385	1349175359	/nfs/dbraw/zinc/17/53/59/1349175359.db2.gz	OAUVSCRABYWJRP-HXUWFJFHSA-N	0	3	344.524	3.364	20	30		EGEDHN
CC[C@H](F)C(=O)N1CCC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001054176083	1349177797	/nfs/dbraw/zinc/17/77/97/1349177797.db2.gz	BIMRFNFQHNVOTL-ICSRJNTNSA-N	0	3	343.446	3.121	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1coc(C(F)F)c1)C2	ZINC001054186597	1349189117	/nfs/dbraw/zinc/18/91/17/1349189117.db2.gz	WSSSKNULZJTZHR-SFHVURJKSA-N	0	3	336.382	3.169	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@]2(CCN(Cc3ocnc3C)C2)C1	ZINC001054191282	1349193521	/nfs/dbraw/zinc/19/35/21/1349193521.db2.gz	DXMNJWZHSUGCAH-WOJBJXKFSA-N	0	3	345.487	3.400	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)C[C@@H](C)c1cccc(F)c1)C2	ZINC001054194696	1349198023	/nfs/dbraw/zinc/19/80/23/1349198023.db2.gz	UPUUSXHZWJVUET-DYESRHJHSA-N	0	3	342.458	3.267	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc(C)ccc1F)C2	ZINC001054204671	1349206221	/nfs/dbraw/zinc/20/62/21/1349206221.db2.gz	ADXTUVXNHBRREW-HXUWFJFHSA-N	0	3	328.431	3.086	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cnc3ccccc3c1)C2	ZINC001054205900	1349207895	/nfs/dbraw/zinc/20/78/95/1349207895.db2.gz	ZTTITHOIGLIKRV-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc(Cl)ccc1C)C2	ZINC001054216285	1349214792	/nfs/dbraw/zinc/21/47/92/1349214792.db2.gz	ROLXUUHJJZOLLO-IBGZPJMESA-N	0	3	330.859	3.210	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)Cc1cccc3ccccc31)C2	ZINC001054231711	1349225425	/nfs/dbraw/zinc/22/54/25/1349225425.db2.gz	YHUXNNNXQIRXEG-HSZRJFAPSA-N	0	3	346.474	3.330	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccsc1C(F)F)C2	ZINC001054234930	1349226653	/nfs/dbraw/zinc/22/66/53/1349226653.db2.gz	MYVCORRGQWIKRW-QGZVFWFLSA-N	0	3	338.423	3.247	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cncc3ccccc31)C2	ZINC001054245578	1349239700	/nfs/dbraw/zinc/23/97/00/1349239700.db2.gz	VYAMPVOSFYSNPI-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C=C(C)CN1Cc2ccc(CNC(=O)c3ccn4cncc4c3)cc2C1	ZINC001054273110	1349273064	/nfs/dbraw/zinc/27/30/64/1349273064.db2.gz	UWFCLXWFCSBXAD-UHFFFAOYSA-N	0	3	346.434	3.156	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cnoc3CC)cc2C1	ZINC001054283855	1349285132	/nfs/dbraw/zinc/28/51/32/1349285132.db2.gz	TYIMQOPVMRQTMM-UHFFFAOYSA-N	0	3	325.412	3.059	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cnn(C(F)F)c3)cc2C1	ZINC001054287434	1349290044	/nfs/dbraw/zinc/29/00/44/1349290044.db2.gz	KSVMSPQSNGKEMQ-UHFFFAOYSA-N	0	3	346.381	3.100	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3c[nH]nc3C3CC3)cc2C1	ZINC001054288137	1349291268	/nfs/dbraw/zinc/29/12/68/1349291268.db2.gz	LIQVRKIUUQMRDD-UHFFFAOYSA-N	0	3	336.439	3.109	20	30		EGEDHN
CCc1ccc(C(=O)N2C[C@@H](C)[C@@H](NCc3ccc(C#N)s3)C2)o1	ZINC001054812404	1349473700	/nfs/dbraw/zinc/47/37/00/1349473700.db2.gz	JNBTZHKHUWNAPN-WBMJQRKESA-N	0	3	343.452	3.025	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](NCc2cccc(Cl)n2)[C@@H](C)C1	ZINC001054970809	1349531133	/nfs/dbraw/zinc/53/11/33/1349531133.db2.gz	ITNYGPPTEOUGOG-ZFWWWQNUSA-N	0	3	335.879	3.274	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CN(CCc3scnc3C)C[C@H]2C)CC1	ZINC001080391629	1357601395	/nfs/dbraw/zinc/60/13/95/1357601395.db2.gz	UWGNLGWACJEYMG-RHSMWYFYSA-N	0	3	347.528	3.177	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CN(Cc3ccc(OC)c(C)c3)C[C@H]2C)C1	ZINC001080404700	1357608816	/nfs/dbraw/zinc/60/88/16/1357608816.db2.gz	VSHHKQGDZUWPBT-SJLPKXTDSA-N	0	3	342.483	3.296	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2ccc(C(F)F)c(F)c2)C1	ZINC001080435307	1357619123	/nfs/dbraw/zinc/61/91/23/1357619123.db2.gz	YKFQTRWJCSMVCX-IAQYHMDHSA-N	0	3	326.362	3.390	20	30		EGEDHN
C#CCCN1C[C@@H](C)[C@H](NC(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC001080478142	1357636702	/nfs/dbraw/zinc/63/67/02/1357636702.db2.gz	IKTQTNKVRXLFEQ-CWJKEVGVSA-N	0	3	338.495	3.420	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2cc(F)cc3cccnc32)C1	ZINC001080549800	1357673204	/nfs/dbraw/zinc/67/32/04/1357673204.db2.gz	PAJPBWIYTNDGGB-CXAGYDPISA-N	0	3	327.403	3.000	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C(C)(C)C1CCCC1)C[C@H](C)O2	ZINC001071178653	1354488832	/nfs/dbraw/zinc/48/88/32/1354488832.db2.gz	UGULKUZCDMBEGO-UWJYYQICSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2c[nH]nc2C2CCCCC2)C1	ZINC001080757218	1357733815	/nfs/dbraw/zinc/73/38/15/1357733815.db2.gz	PHMFSQYRYBWNIJ-RHSMWYFYSA-N	0	3	330.476	3.084	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2nsc3ccccc32)CC[C@H]1C	ZINC001071525106	1354744916	/nfs/dbraw/zinc/74/49/16/1354744916.db2.gz	KBSICEALTDECKX-ZIAGYGMSSA-N	0	3	329.469	3.455	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2c(C)nn(C(C)(C)C)c2C)CC[C@@H]1C	ZINC001071547606	1354760200	/nfs/dbraw/zinc/76/02/00/1354760200.db2.gz	WQOWXMDYBVOSBX-YOEHRIQHSA-N	0	3	346.519	3.414	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N[C@H]1CC[C@@H](C)N(CC(=C)C)C1	ZINC001071620066	1354802855	/nfs/dbraw/zinc/80/28/55/1354802855.db2.gz	ZLDPUCFIISJQMW-SJORKVTESA-N	0	3	328.456	3.410	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2coc3cc(F)ccc23)CC[C@@H]1C	ZINC001071631650	1354813287	/nfs/dbraw/zinc/81/32/87/1354813287.db2.gz	PQSIFXVLQHLMFJ-ZFWWWQNUSA-N	0	3	328.387	3.178	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)Cc2c[nH]c3ccc(F)cc23)[C@H]1C	ZINC001088881862	1360087698	/nfs/dbraw/zinc/08/76/98/1360087698.db2.gz	KNJOJZOSWFMHCJ-DYVFJYSZSA-N	0	3	329.419	3.005	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2ccc3cnccc3c2)CC[C@H]1C	ZINC001071678033	1354845055	/nfs/dbraw/zinc/84/50/55/1354845055.db2.gz	XYCNGIKCUQOEAK-OXQOHEQNSA-N	0	3	337.467	3.323	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)Cc2cc3ccccc3s2)CC[C@@H]1C	ZINC001071681151	1354848436	/nfs/dbraw/zinc/84/84/36/1354848436.db2.gz	ZAQRRQAHRMQHRI-DOTOQJQBSA-N	0	3	340.492	3.436	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2nc3ccccc3cc2C)CC[C@@H]1C	ZINC001071696220	1354857796	/nfs/dbraw/zinc/85/77/96/1354857796.db2.gz	XHCRSSJAFRSQAG-FUHWJXTLSA-N	0	3	335.451	3.149	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cncc(OC(C)C)c2)CC[C@H]1C	ZINC001071739030	1354889110	/nfs/dbraw/zinc/88/91/10/1354889110.db2.gz	MAYWJCWGYPEQGY-WBVHZDCISA-N	0	3	331.460	3.028	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2cn(C)c3ccccc23)CC[C@@H]1C	ZINC001071779724	1354928092	/nfs/dbraw/zinc/92/80/92/1354928092.db2.gz	ODYMRLIRHWIWMT-FUHWJXTLSA-N	0	3	339.483	3.266	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CC[C@H](C)N(CCc3scnc3C)C2)C1	ZINC001071808245	1354951711	/nfs/dbraw/zinc/95/17/11/1354951711.db2.gz	YIDWMHNBFIDJMX-GOEBONIOSA-N	0	3	347.528	3.319	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(F)c(COC)c2)CC[C@H]1C	ZINC001071820051	1354960671	/nfs/dbraw/zinc/96/06/71/1354960671.db2.gz	ZJNHJRSKDARXLT-PBHICJAKSA-N	0	3	334.435	3.131	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(C(F)F)c(F)c2)CC[C@@H]1C	ZINC001071822611	1354962450	/nfs/dbraw/zinc/96/24/50/1354962450.db2.gz	ZELARKXMEOWXHU-GXTWGEPZSA-N	0	3	338.373	3.369	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(C(C)C)nc2C)CC[C@@H]1C	ZINC001071827725	1354964544	/nfs/dbraw/zinc/96/45/44/1354964544.db2.gz	CCPWLUWBZZEQEO-RDJZCZTQSA-N	0	3	327.472	3.119	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2noc3ccc(F)cc23)CC[C@H]1C	ZINC001071884032	1355004660	/nfs/dbraw/zinc/00/46/60/1355004660.db2.gz	WOYZNTZODOSSLE-HIFRSBDPSA-N	0	3	345.418	3.055	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2csc(-c3ccoc3)n2)CC[C@H]1C	ZINC001071908597	1355018923	/nfs/dbraw/zinc/01/89/23/1355018923.db2.gz	YYMSKDQHLOEUNZ-UKRRQHHQSA-N	0	3	343.452	3.009	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ncoc2-c2cccs2)CC[C@H]1C	ZINC001071908240	1355019127	/nfs/dbraw/zinc/01/91/27/1355019127.db2.gz	PWHXZJQKKVXBJT-KGLIPLIRSA-N	0	3	343.452	3.009	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc3nc(C)sc3c2)CC[C@@H]1C	ZINC001071960815	1355044353	/nfs/dbraw/zinc/04/43/53/1355044353.db2.gz	IHLKGYAVTHEABB-BBRMVZONSA-N	0	3	341.480	3.211	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cnn(CCC)c2C2CC2)CC[C@H]1C	ZINC001071976582	1355055426	/nfs/dbraw/zinc/05/54/26/1355055426.db2.gz	FGVAVHOFVHMNBO-WBVHZDCISA-N	0	3	344.503	3.329	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CC[C@H](C)N(Cc3ccccc3C)C2)nc1	ZINC001072000692	1355066511	/nfs/dbraw/zinc/06/65/11/1355066511.db2.gz	ZBGYVESEIBYYTO-PXNSSMCTSA-N	0	3	347.462	3.154	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc(C)n(CC3CC3)c2C)CC[C@@H]1C	ZINC001072002726	1355068438	/nfs/dbraw/zinc/06/84/38/1355068438.db2.gz	NYHNXJZDZYUTJW-KXBFYZLASA-N	0	3	341.499	3.121	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(COC)c(F)c2)CC[C@H]1C	ZINC001072023628	1355086151	/nfs/dbraw/zinc/08/61/51/1355086151.db2.gz	UNPOPZBUQUNAKI-RHSMWYFYSA-N	0	3	334.435	3.131	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccsc2C(F)(F)F)CC[C@H]1C	ZINC001072026106	1355088046	/nfs/dbraw/zinc/08/80/46/1355088046.db2.gz	CMWDBEGYLYIEAF-VXGBXAGGSA-N	0	3	344.402	3.373	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2coc3ccc(F)cc23)CC[C@@H]1C	ZINC001072027514	1355088323	/nfs/dbraw/zinc/08/83/23/1355088323.db2.gz	ZUISLBNGDGFYGY-ZFWWWQNUSA-N	0	3	328.387	3.178	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](NC(=O)c2cccc(CN(C)C)c2)CC[C@@H]1C	ZINC001072095062	1355126629	/nfs/dbraw/zinc/12/66/29/1355126629.db2.gz	FWPDEMIJDBLSQS-YJBOKZPZSA-N	0	3	349.906	3.083	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2cc3ccccc3n2C)CC[C@@H]1C	ZINC001072101276	1355130676	/nfs/dbraw/zinc/13/06/76/1355130676.db2.gz	FOUKCVMTSODZOL-FUHWJXTLSA-N	0	3	339.483	3.266	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2cccc(OCC)c2)CC[C@@H]1C	ZINC001072101461	1355130868	/nfs/dbraw/zinc/13/08/68/1355130868.db2.gz	HBHGQCDRPFRERQ-FUHWJXTLSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2[nH]c3ccccc3c2OC)CC[C@H]1C	ZINC001072104946	1355133070	/nfs/dbraw/zinc/13/30/70/1355133070.db2.gz	FIYSLUIWUVVTOP-HUUCEWRRSA-N	0	3	341.455	3.335	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C(C)(C)c2ccccc2C)CC[C@H]1C	ZINC001072113383	1355139112	/nfs/dbraw/zinc/13/91/12/1355139112.db2.gz	ULMQXFWWPGZERZ-MSOLQXFVSA-N	0	3	326.484	3.265	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2N(Cc2ccsc2)C(=O)[C@H]2C[C@@H]2C)CC1	ZINC001072137562	1355149480	/nfs/dbraw/zinc/14/94/80/1355149480.db2.gz	QEPJFAAGMNMFGZ-SZMVWBNQSA-N	0	3	342.508	3.220	20	30		EGEDHN
C[C@H]1CCN(C(=O)c2ccco2)C[C@H]1CNCc1ccccc1C#N	ZINC001072167374	1355162952	/nfs/dbraw/zinc/16/29/52/1355162952.db2.gz	PPFCAUPWFVAMNF-MAUKXSAKSA-N	0	3	337.423	3.039	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](C)[C@H](CNCc2nccs2)C1	ZINC001072337388	1355245551	/nfs/dbraw/zinc/24/55/51/1355245551.db2.gz	XTYHEAUXSORPOK-LSDHHAIUSA-N	0	3	335.517	3.320	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](C)[C@@H](CNCc3nccs3)C2)CC1	ZINC001072356295	1355254839	/nfs/dbraw/zinc/25/48/39/1355254839.db2.gz	JFVCQXXFTWYADI-RDJZCZTQSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](C)[C@@H](CNCc3nccs3)C2)C1	ZINC001072360509	1355256791	/nfs/dbraw/zinc/25/67/91/1355256791.db2.gz	RCHSEZRPVQCSCD-CABCVRRESA-N	0	3	333.501	3.074	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001072944925	1355513222	/nfs/dbraw/zinc/51/32/22/1355513222.db2.gz	OODDXFSDWVFJKI-HXUWFJFHSA-N	0	3	337.467	3.195	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC3(C2)CCN(Cc2sc(C)nc2C)C3)C1	ZINC001072964207	1355526826	/nfs/dbraw/zinc/52/68/26/1355526826.db2.gz	NQDRZTZPMNARAU-UHFFFAOYSA-N	0	3	345.512	3.151	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3ccc(OCC(C)C)cc3)C2)C1	ZINC001073404395	1355759246	/nfs/dbraw/zinc/75/92/46/1355759246.db2.gz	UYGWUDMRFYCZHP-UHFFFAOYSA-N	0	3	328.456	3.055	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2ccccc2C2CCC2)C1	ZINC001073872525	1355930533	/nfs/dbraw/zinc/93/05/33/1355930533.db2.gz	SEUKKRAJBYBGOC-SFHVURJKSA-N	0	3	342.483	3.351	20	30		EGEDHN
Cc1ccc(CN(C)C[C@H]2CCCCN2C(=O)[C@@H](C)C#N)cc1F	ZINC001073970373	1356003710	/nfs/dbraw/zinc/00/37/10/1356003710.db2.gz	LUZPZVSKJZXKQQ-DOTOQJQBSA-N	0	3	331.435	3.107	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCCN1C(=O)[C@@H]1CC1(F)F	ZINC001074010479	1356033928	/nfs/dbraw/zinc/03/39/28/1356033928.db2.gz	ZGJCIEJKTJYGGH-SJORKVTESA-N	0	3	347.409	3.026	20	30		EGEDHN
CC(C)[C@H](F)C(=O)N1CCCC[C@@H]1CN(C)Cc1cccc(C#N)c1	ZINC001074053563	1356057166	/nfs/dbraw/zinc/05/71/66/1356057166.db2.gz	XZVFPMTZMRSHEF-MOPGFXCFSA-N	0	3	345.462	3.365	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)COc3cccc(C(C)C)c3)[C@@H]2C1	ZINC001075823603	1356428688	/nfs/dbraw/zinc/42/86/88/1356428688.db2.gz	UPUJTNRCOAZKBK-AZUAARDMSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccc4c(c3)C(C)(C)CO4)[C@@H]2C1	ZINC001076029193	1356469360	/nfs/dbraw/zinc/46/93/60/1356469360.db2.gz	HKEWAVULDVPGNE-FUHWJXTLSA-N	0	3	340.467	3.079	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1sc(CC3CC3)nc1C)C2	ZINC001098108449	1363224293	/nfs/dbraw/zinc/22/42/93/1363224293.db2.gz	QPDVCYPNBZHZSE-OAGGEKHMSA-N	0	3	345.512	3.315	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3nc4ccccc4cc3C)[C@@H]2C1	ZINC001076061715	1356479145	/nfs/dbraw/zinc/47/91/45/1356479145.db2.gz	WYDGBSAJBLKEHB-PKOBYXMFSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cc4cccc(OC)c4o3)[C@@H]2C1	ZINC001076190576	1356516178	/nfs/dbraw/zinc/51/61/78/1356516178.db2.gz	MDJTZISEJYSNAI-JKSUJKDBSA-N	0	3	340.423	3.164	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ncoc3-c3cccs3)[C@@H]2C1	ZINC001076370421	1356561418	/nfs/dbraw/zinc/56/14/18/1356561418.db2.gz	VBVPOFWVOPDHED-UONOGXRCSA-N	0	3	343.452	3.126	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3cc(Cl)cc(Cl)c3)[C@@H]2C1	ZINC001076494501	1356595981	/nfs/dbraw/zinc/59/59/81/1356595981.db2.gz	CLKKBXSEEYNBTF-BLLLJJGKSA-N	0	3	337.250	3.163	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3cc4c(s3)CCCCC4)[C@@H]2C1	ZINC001076531461	1356607209	/nfs/dbraw/zinc/60/72/09/1356607209.db2.gz	MFDCPYLUBXPLBW-DLBZAZTESA-N	0	3	342.508	3.187	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CN([C@H](CC)c3ccccc3)C[C@H]2O)CC1	ZINC001077618452	1356811079	/nfs/dbraw/zinc/81/10/79/1356811079.db2.gz	IWFNNKBJALWAHT-VAMGGRTRSA-N	0	3	342.483	3.045	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2cccc(F)c2F)C[C@H]1C(F)(F)F	ZINC001099298154	1363737239	/nfs/dbraw/zinc/73/72/39/1363737239.db2.gz	RNIIDSLEKMOQST-DGCLKSJQSA-N	0	3	348.315	3.133	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)C1(C)CC(F)(F)C1	ZINC001099304241	1363739996	/nfs/dbraw/zinc/73/99/96/1363739996.db2.gz	NFXSBCMCKHFBJO-CQSZACIVSA-N	0	3	326.431	3.052	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@@H](NC(=O)C3CCC3)C23CCC3)c1	ZINC001078524658	1356993425	/nfs/dbraw/zinc/99/34/25/1356993425.db2.gz	VMBDEPFVELQFIS-ZWKOTPCHSA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@@H](NC(=O)C2(C)CCC2)C12CCC2	ZINC001078701258	1357061992	/nfs/dbraw/zinc/06/19/92/1357061992.db2.gz	YVCOFCGSUDXOGK-CHWSQXEVSA-N	0	3	341.293	3.102	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2cc[nH]c2CCC)C12CCC2	ZINC001078704730	1357062423	/nfs/dbraw/zinc/06/24/23/1357062423.db2.gz	BRQBMHSQXCHUNM-CVEARBPZSA-N	0	3	335.879	3.350	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2occc2Cl)C12CCC2	ZINC001078718005	1357063418	/nfs/dbraw/zinc/06/34/18/1357063418.db2.gz	JOLPJPPPOBGZEY-NEPJUHHUSA-N	0	3	329.227	3.316	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2occc2Cl)C12CCC2	ZINC001078718007	1357063527	/nfs/dbraw/zinc/06/35/27/1357063527.db2.gz	JOLPJPPPOBGZEY-RYUDHWBXSA-N	0	3	329.227	3.316	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2C[C@H](NCc3ccc(F)cn3)C23CCC3)C1	ZINC001078720638	1357065753	/nfs/dbraw/zinc/06/57/53/1357065753.db2.gz	OGTRWGBSILAHDF-DLBZAZTESA-N	0	3	343.446	3.094	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2oc(C3CC3)nc2C)C12CCC2	ZINC001078744398	1357069301	/nfs/dbraw/zinc/06/93/01/1357069301.db2.gz	TUJZFYQTXMAXLL-ZIAGYGMSSA-N	0	3	349.862	3.244	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2cncc(Cl)c2)C12CCC2	ZINC001078746171	1357070182	/nfs/dbraw/zinc/07/01/82/1357070182.db2.gz	ILBUEINAHNFPPH-ZIAGYGMSSA-N	0	3	340.254	3.118	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C2(C(F)F)CCCC2)C[C@H]1c1ccccc1	ZINC001081168226	1357846979	/nfs/dbraw/zinc/84/69/79/1357846979.db2.gz	MYGJYHKKQKDUNL-DLBZAZTESA-N	0	3	346.421	3.029	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H](C)c2ccccc2)C[C@H]1c1ccccc1	ZINC001081215677	1357849625	/nfs/dbraw/zinc/84/96/25/1357849625.db2.gz	QWUNPFOHWHTNRR-JRGCBEDISA-N	0	3	332.447	3.008	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2cccc(C3CCC3)c2)[C@H](OC)C1	ZINC001082326559	1358018208	/nfs/dbraw/zinc/01/82/08/1358018208.db2.gz	JFOVTMCEPKMTMA-WOJBJXKFSA-N	0	3	342.483	3.349	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2ccccc2C2CCC2)[C@H](OC)C1	ZINC001082349115	1358022108	/nfs/dbraw/zinc/02/21/08/1358022108.db2.gz	KCLUDPBJFBHNJD-WOJBJXKFSA-N	0	3	342.483	3.349	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1C[C@@H](C)[C@H](NCc2ccc(Cl)cc2Cl)C1	ZINC001082448279	1358039121	/nfs/dbraw/zinc/03/91/21/1358039121.db2.gz	KMWIRNFOSVNTOH-FIXISWKDSA-N	0	3	340.254	3.090	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CCC(F)CC2)C[C@H]1NCc1ccc(C#N)s1	ZINC001082723010	1358080543	/nfs/dbraw/zinc/08/05/43/1358080543.db2.gz	SVHZPBYBNABKTR-QROZZAMVSA-N	0	3	349.475	3.085	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)c3cccc(Cl)c3C)[C@H]2C1	ZINC001083090083	1358118375	/nfs/dbraw/zinc/11/83/75/1358118375.db2.gz	GJJVAWSUDWFAHU-ZWKOTPCHSA-N	0	3	348.874	3.140	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)c3cc(C(C)C)oc3C)[C@H]2C1	ZINC001083238108	1358125290	/nfs/dbraw/zinc/12/52/90/1358125290.db2.gz	LWWIPPVNNLOXKW-PKOBYXMFSA-N	0	3	346.471	3.203	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)c3cccc(C4CCC4)c3)[C@H]2C1	ZINC001083249052	1358126959	/nfs/dbraw/zinc/12/69/59/1358126959.db2.gz	KCDLMKGPIMUPQW-VQTJNVASSA-N	0	3	340.467	3.055	20	30		EGEDHN
Cc1cccc([C@H](C)N2CC[C@@H]3CN(C(=O)c4c[nH]c(C#N)c4)[C@@H]3C2)c1	ZINC001084294492	1358186522	/nfs/dbraw/zinc/18/65/22/1358186522.db2.gz	SQBBBMKFRLZQGA-XAUMDUMWSA-N	0	3	348.450	3.102	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)c3cn(C)c4ccc(F)cc34)[C@@H]2C1	ZINC001084413726	1358209804	/nfs/dbraw/zinc/20/98/04/1358209804.db2.gz	DHJVHJFAENZQAH-AUUYWEPGSA-N	0	3	341.430	3.040	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)[C@H]3CC[C@H](C4CCC4)CC3)[C@@H]2C1	ZINC001084422768	1358211150	/nfs/dbraw/zinc/21/11/50/1358211150.db2.gz	HGZKHWVEYIBMMA-UAFMIMERSA-N	0	3	328.500	3.149	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@H]3CCc4c3cccc4Cl)[C@@H]2C1	ZINC001084523894	1358230530	/nfs/dbraw/zinc/23/05/30/1358230530.db2.gz	BERZPRXHIHWCQA-DKSSEZFCSA-N	0	3	344.886	3.479	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CCN(Cc3ccc4c(c3)CCC4)C[C@H]21	ZINC001084578243	1358242491	/nfs/dbraw/zinc/24/24/91/1358242491.db2.gz	RNMPQYSHPGGBKB-WOJBJXKFSA-N	0	3	338.495	3.420	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)c3ccc(F)c4ccncc34)[C@@H]2C1	ZINC001084598353	1358252346	/nfs/dbraw/zinc/25/23/46/1358252346.db2.gz	UXIKAEYGSVKBEW-AUUYWEPGSA-N	0	3	339.414	3.096	20	30		EGEDHN
N#Cc1oc2ccccc2c1NC(=O)C(C#N)Cc1ccc(O)cc1	ZINC001183606118	1387323551	/nfs/dbraw/zinc/32/35/51/1387323551.db2.gz	XBUBBVIYEUQLPS-ZDUSSCGKSA-N	0	3	331.331	3.331	20	30		EGEDHN
CC(C)P(CCNC(=O)[C@@H](C#N)Cc1ccc(O)cc1)C(C)C	ZINC001183615800	1387324569	/nfs/dbraw/zinc/32/45/69/1387324569.db2.gz	HDGVELMVVAUADS-MRXNPFEDSA-N	0	3	334.400	3.489	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H]2CCN(CCc3ccns3)[C@H]2C1	ZINC001085024453	1358370897	/nfs/dbraw/zinc/37/08/97/1358370897.db2.gz	XZWMVMKTWJJLIN-AYBZRNKSSA-N	0	3	347.528	3.211	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@H](C)Cc3ccccc3F)C[C@@H]21	ZINC001085029896	1358372055	/nfs/dbraw/zinc/37/20/55/1358372055.db2.gz	FBXAKVDKZXJNTI-FCEWJHQRSA-N	0	3	330.447	3.113	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C3CC(c4ccc(F)cc4)C3)C[C@@H]21	ZINC001085106994	1358393214	/nfs/dbraw/zinc/39/32/14/1358393214.db2.gz	FJSHCJRFYPYJMM-KMEYYKJISA-N	0	3	342.458	3.428	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1c(C)noc1CCC	ZINC001085196515	1358430863	/nfs/dbraw/zinc/43/08/63/1358430863.db2.gz	CBLXOQSZJOAYRN-ZIAGYGMSSA-N	0	3	339.867	3.319	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccc2cccnc2n1	ZINC001085205124	1358432998	/nfs/dbraw/zinc/43/29/98/1358432998.db2.gz	DBKGVTFVPFMYBB-HUUCEWRRSA-N	0	3	344.846	3.013	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)Cc1nc(C)sc1C	ZINC001085244612	1358442845	/nfs/dbraw/zinc/44/28/45/1358442845.db2.gz	MYRBGMHAGNPBPS-ZIAGYGMSSA-N	0	3	341.908	3.072	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1oc(C2CC2)nc1C	ZINC001085357901	1358478093	/nfs/dbraw/zinc/47/80/93/1358478093.db2.gz	XHBKPVGZTUAWCV-ZIAGYGMSSA-N	0	3	337.851	3.244	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccc(N(C)C)cc1	ZINC001085405012	1358491930	/nfs/dbraw/zinc/49/19/30/1358491930.db2.gz	NGNJYRLIOZMVMG-IAGOWNOFSA-N	0	3	335.879	3.136	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)C1(c2ccccc2)CC1	ZINC001085413984	1358493726	/nfs/dbraw/zinc/49/37/26/1358493726.db2.gz	XHZHCVRYDZDUJW-IAGOWNOFSA-N	0	3	332.875	3.488	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1nc(C)c(C)s1	ZINC001085427492	1358497153	/nfs/dbraw/zinc/49/71/53/1358497153.db2.gz	GBTYHDDRNOVJPB-CHWSQXEVSA-N	0	3	327.881	3.143	20	30		EGEDHN
CC[C@H](c1ccccc1)N1CC[C@H]1CN(C)C(=O)c1c[nH]c(C#N)c1	ZINC001085553200	1358589688	/nfs/dbraw/zinc/58/96/88/1358589688.db2.gz	ZAHYAIZDTFCWCJ-RBUKOAKNSA-N	0	3	336.439	3.184	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccnn1C1CCCC1	ZINC001085623161	1358642322	/nfs/dbraw/zinc/64/23/22/1358642322.db2.gz	MJCUSAPGHIFSQC-QGZVFWFLSA-N	0	3	330.476	3.111	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc(N(C)C)cc1F	ZINC001085639372	1358653341	/nfs/dbraw/zinc/65/33/41/1358653341.db2.gz	NNICGQFNIQXQNK-MRXNPFEDSA-N	0	3	333.451	3.004	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc(-c2ccccc2)n[nH]1	ZINC001085708528	1358700588	/nfs/dbraw/zinc/70/05/88/1358700588.db2.gz	KKVBAUBWHMIWSF-KRWDZBQOSA-N	0	3	338.455	3.189	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc2c(cn1)CCCC2	ZINC001085710281	1358703810	/nfs/dbraw/zinc/70/38/10/1358703810.db2.gz	FAMKQIDQENGLNL-GOSISDBHSA-N	0	3	327.472	3.073	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@@H]1CCc2cc(C)ccc2O1	ZINC001085722976	1358711623	/nfs/dbraw/zinc/71/16/23/1358711623.db2.gz	KYGXNDWKPBFEQS-ICSRJNTNSA-N	0	3	342.483	3.188	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@@H]1CCc2ccc(F)cc2O1	ZINC001085723309	1358712472	/nfs/dbraw/zinc/71/24/72/1358712472.db2.gz	UGQVELHYKNVUQS-MSOLQXFVSA-N	0	3	346.446	3.018	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc2cc(OC)ccc2[nH]1	ZINC001085792861	1358768221	/nfs/dbraw/zinc/76/82/21/1358768221.db2.gz	VRFJAONAARMRJK-MRXNPFEDSA-N	0	3	341.455	3.289	20	30		EGEDHN
C=C1CCC(C(=O)N(C)C[C@@H]2CCN2CCCC2CCOCC2)CC1	ZINC001085800696	1358775641	/nfs/dbraw/zinc/77/56/41/1358775641.db2.gz	AEKDLXAOSCOYMG-FQEVSTJZSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc(-c2cccs2)n[nH]1	ZINC001085829610	1358797577	/nfs/dbraw/zinc/79/75/77/1358797577.db2.gz	CELFIEAKSNBTFT-AWEZNQCLSA-N	0	3	344.484	3.251	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@@H](CNC(=O)C3CCCCC3)C2)c(F)c1	ZINC001086016603	1358965786	/nfs/dbraw/zinc/96/57/86/1358965786.db2.gz	APNADLCXBIYAMD-RHNCMZPLSA-N	0	3	343.446	3.262	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@@H](CNC(=O)[C@H]3CC=CCC3)C2)c(F)c1	ZINC001086027503	1358971710	/nfs/dbraw/zinc/97/17/10/1358971710.db2.gz	VKJBKWJYTNUOIP-XYJFISCASA-N	0	3	341.430	3.038	20	30		EGEDHN
CCCCC(=O)N1CC[C@@H](CNCc2cc(F)ccc2C#N)[C@H](C)C1	ZINC001183899481	1387368887	/nfs/dbraw/zinc/36/88/87/1387368887.db2.gz	POBWSJHWVSTOQC-WBVHZDCISA-N	0	3	345.462	3.462	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc(-c3ccccc3)on2)C1	ZINC001086142278	1359007105	/nfs/dbraw/zinc/00/71/05/1359007105.db2.gz	QNZPIYQVSFTHOT-OTVXOJSOSA-N	0	3	345.830	3.192	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2c(F)ccc(F)c2Cl)C1	ZINC001086207670	1359026770	/nfs/dbraw/zinc/02/67/70/1359026770.db2.gz	FIRRIKWVNGFFCQ-AOOOYVTPSA-N	0	3	349.208	3.469	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc3nc(C)ccc3c2)C1	ZINC001086228841	1359033534	/nfs/dbraw/zinc/03/35/34/1359033534.db2.gz	IYFRDSJKVFRBHB-KDYLLFBJSA-N	0	3	343.858	3.394	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2c[nH]c3ccc(F)cc23)C1	ZINC001086286737	1359055818	/nfs/dbraw/zinc/05/58/18/1359055818.db2.gz	TZHWXTBPVFNZIM-BJHJDKERSA-N	0	3	335.810	3.158	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(-c3cnco3)cc2)C1	ZINC001086403484	1359089138	/nfs/dbraw/zinc/08/91/38/1359089138.db2.gz	OREMUGOWDYZCDK-SAZUREKKSA-N	0	3	345.830	3.192	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cn(C)c3ccccc23)C1	ZINC001086420346	1359091979	/nfs/dbraw/zinc/09/19/79/1359091979.db2.gz	PPNIYYLSZUJONW-HDJSIYSDSA-N	0	3	331.847	3.029	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2nc3ccccc3cc2C)C1	ZINC001086431474	1359096329	/nfs/dbraw/zinc/09/63/29/1359096329.db2.gz	ONMITAVTUDLAPS-KOMQPUFPSA-N	0	3	343.858	3.394	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc([C@@H](C)CC)no2)C1	ZINC001086498957	1359121238	/nfs/dbraw/zinc/12/12/38/1359121238.db2.gz	LEDGYMFPRJPSHP-DRZSPHRISA-N	0	3	325.840	3.039	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cncc3ccccc32)C1	ZINC001086558233	1359145221	/nfs/dbraw/zinc/14/52/21/1359145221.db2.gz	XIOVIQQPIPNBFD-CTYIDZIISA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C(C)CN1C[C@@H](c2ccccc2)[C@H](NC(=O)Cc2ccncc2C)C1	ZINC001086588291	1359157406	/nfs/dbraw/zinc/15/74/06/1359157406.db2.gz	NTRJAMOEYQGZLB-LEWJYISDSA-N	0	3	349.478	3.093	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@H]2CC[C@@H](NCc3ccccc3C#N)C2)o1	ZINC001086639527	1359174188	/nfs/dbraw/zinc/17/41/88/1359174188.db2.gz	TUQDLPXUXVQECE-MAUKXSAKSA-N	0	3	337.423	3.148	20	30		EGEDHN
Cc1ccoc1C(=O)NC[C@H]1CC[C@@H](NCc2ccccc2C#N)C1	ZINC001086644798	1359176265	/nfs/dbraw/zinc/17/62/65/1359176265.db2.gz	NRZXHYDYNHOCFO-MAUKXSAKSA-N	0	3	337.423	3.148	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccc(C(C)C)nc2)C1	ZINC001086717091	1359190871	/nfs/dbraw/zinc/19/08/71/1359190871.db2.gz	GJODZVWHJWUIIY-GOEBONIOSA-N	0	3	335.879	3.446	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cc3ccccn3c2)C1	ZINC001086819536	1359208250	/nfs/dbraw/zinc/20/82/50/1359208250.db2.gz	NOGPDEWPCPELOM-GOEBONIOSA-N	0	3	331.847	3.180	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccc(COC)cc2)C1	ZINC001086872694	1359218648	/nfs/dbraw/zinc/21/86/48/1359218648.db2.gz	UEZQBEHNWQVQNN-DOTOQJQBSA-N	0	3	336.863	3.074	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC2(C[C@H]1C)CCN(Cc1ccccc1F)CC2	ZINC001086910184	1359237647	/nfs/dbraw/zinc/23/76/47/1359237647.db2.gz	NPIFPAMUAOPCJY-JKSUJKDBSA-N	0	3	343.446	3.188	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3ccsc3C)C2)CC1	ZINC001086923354	1359249401	/nfs/dbraw/zinc/24/94/01/1359249401.db2.gz	PIMLRXDLWCMGOV-HNNXBMFYSA-N	0	3	330.497	3.396	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)Cc3ccc(C)cc3)C2)CC1	ZINC001086931184	1359255309	/nfs/dbraw/zinc/25/53/09/1359255309.db2.gz	BFQQDUQKAKXFNA-LJQANCHMSA-N	0	3	338.495	3.264	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc(CC)s3)C2)CC1	ZINC001086931657	1359255761	/nfs/dbraw/zinc/25/57/61/1359255761.db2.gz	NZUBIIAZEKDRQX-HNNXBMFYSA-N	0	3	330.497	3.260	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccn(C(C)C)c3C)C2)CC1	ZINC001086938191	1359260429	/nfs/dbraw/zinc/26/04/29/1359260429.db2.gz	KTDIFFGBVRGFLP-QGZVFWFLSA-N	0	3	341.499	3.327	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3ccn(CC)c3C)C2)CC1	ZINC001086938580	1359260962	/nfs/dbraw/zinc/26/09/62/1359260962.db2.gz	UUXSWYLVYOWONU-KRWDZBQOSA-N	0	3	341.499	3.156	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3cc[nH]c3C3CC3)C2)CC1	ZINC001086939363	1359261625	/nfs/dbraw/zinc/26/16/25/1359261625.db2.gz	OUWVYFMYDSQGRS-INIZCTEOSA-N	0	3	339.483	3.232	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc4ccccc4n3C)C2)CC1	ZINC001086940276	1359262175	/nfs/dbraw/zinc/26/21/75/1359262175.db2.gz	NNLAAGJQBVQHHM-QGZVFWFLSA-N	0	3	349.478	3.128	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H](C=C)c3ccccc3)C2)CC1	ZINC001086955965	1359276599	/nfs/dbraw/zinc/27/65/99/1359276599.db2.gz	AQWGHLHRRIHNTL-QUCCMNQESA-N	0	3	336.479	3.292	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H](C)Cc3ccccc3)C2)CC1	ZINC001086957124	1359278436	/nfs/dbraw/zinc/27/84/36/1359278436.db2.gz	FNGGZUNODOZEKL-RBUKOAKNSA-N	0	3	338.495	3.201	20	30		EGEDHN
N#Cc1cccc(CNC2(CNC(=O)CCCC(F)(F)F)CC2)c1	ZINC001323555669	1387387356	/nfs/dbraw/zinc/38/73/56/1387387356.db2.gz	CRKOVEWBNLYLEN-UHFFFAOYSA-N	0	3	339.361	3.029	20	30		EGEDHN
C[C@@H]1CCN(C(=O)c2ccco2)[C@H](CNCc2ccc(C#N)s2)C1	ZINC001087111672	1359290361	/nfs/dbraw/zinc/29/03/61/1359290361.db2.gz	SGKFLUQKOFTOAT-KGLIPLIRSA-N	0	3	343.452	3.243	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccc(C#N)cc1F	ZINC001087115052	1359293139	/nfs/dbraw/zinc/29/31/39/1359293139.db2.gz	SLYILEZETGFCCL-QAPCUYQASA-N	0	3	343.446	3.380	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc(F)cc1	ZINC001087267335	1359338729	/nfs/dbraw/zinc/33/87/29/1359338729.db2.gz	ZJXKFIXILFIVTK-FGTMMUONSA-N	0	3	328.431	3.068	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(F)cc3)C(C)(C)[C@@H]21	ZINC001087267337	1359339124	/nfs/dbraw/zinc/33/91/24/1359339124.db2.gz	ZJXKFIXILFIVTK-KZNAEPCWSA-N	0	3	328.431	3.068	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3csc(C)c3C)C(C)(C)[C@H]21	ZINC001087288078	1359366504	/nfs/dbraw/zinc/36/65/04/1359366504.db2.gz	QZGBIISUBNGYKV-PVAVHDDUSA-N	0	3	330.497	3.217	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc(F)ccc3CC)C(C)(C)[C@H]21	ZINC001087294037	1359374056	/nfs/dbraw/zinc/37/40/56/1359374056.db2.gz	NEJSAWZPWVLKDM-NEWSRXKRSA-N	0	3	342.458	3.240	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccn(C(C)C)c1C	ZINC001087300230	1359382098	/nfs/dbraw/zinc/38/20/98/1359382098.db2.gz	HZGCQKKWPWKEBL-CEXWTWQISA-N	0	3	341.499	3.229	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cccc(Cl)c1F	ZINC001087304238	1359387977	/nfs/dbraw/zinc/38/79/77/1359387977.db2.gz	ZIFIVJGRQQCWKW-XOKHGSTOSA-N	0	3	348.849	3.331	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cccc(F)c3Cl)C(C)(C)[C@H]21	ZINC001087304768	1359389805	/nfs/dbraw/zinc/38/98/05/1359389805.db2.gz	HMINMRRUULFHGJ-COXVUDFISA-N	0	3	348.849	3.331	20	30		EGEDHN
C=CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(C(C)C)no3)C(C)(C)[C@@H]21	ZINC001087305457	1359390192	/nfs/dbraw/zinc/39/01/92/1359390192.db2.gz	SSEPFUBDQPRYKR-KBRIMQKVSA-N	0	3	331.460	3.203	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc4ccccn4c3)C(C)(C)[C@@H]21	ZINC001087305419	1359390589	/nfs/dbraw/zinc/39/05/89/1359390589.db2.gz	SDEYLNAVMPALQK-VAMGGRTRSA-N	0	3	349.478	3.181	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(Cl)c(F)c3)C(C)(C)[C@H]21	ZINC001087305423	1359390641	/nfs/dbraw/zinc/39/06/41/1359390641.db2.gz	SEDYMEMIRVPIRK-XYPHTWIQSA-N	0	3	348.849	3.331	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc(C)c(CC)o1	ZINC001087312531	1359400799	/nfs/dbraw/zinc/40/07/99/1359400799.db2.gz	GSEUHLASIZTJHQ-AYOQOUSVSA-N	0	3	342.483	3.393	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc(F)cc1C	ZINC001087314094	1359402774	/nfs/dbraw/zinc/40/27/74/1359402774.db2.gz	FOUCRMZNTZNQNZ-CEXWTWQISA-N	0	3	342.458	3.376	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccccc3Cl)C(C)(C)[C@@H]21	ZINC001087314422	1359403745	/nfs/dbraw/zinc/40/37/45/1359403745.db2.gz	KVVJVCQGSKHNDF-DJIMGWMZSA-N	0	3	330.859	3.192	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(CC)cc3)C(C)(C)[C@@H]21	ZINC001087315716	1359406073	/nfs/dbraw/zinc/40/60/73/1359406073.db2.gz	HFDLEFVBOPATRK-VAMGGRTRSA-N	0	3	338.495	3.491	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc2ccccc2[nH]1	ZINC001087318283	1359410224	/nfs/dbraw/zinc/41/02/24/1359410224.db2.gz	UWPQJVVDTCNBJA-AYOQOUSVSA-N	0	3	335.451	3.020	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)[C@H]2CC=CCC2)C1	ZINC001087421005	1359458279	/nfs/dbraw/zinc/45/82/79/1359458279.db2.gz	IHBWDZVSZBDJIO-PWRODBHTSA-N	0	3	336.479	3.340	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)C2C=CC=CC=C2)C1	ZINC001087429019	1359462316	/nfs/dbraw/zinc/46/23/16/1359462316.db2.gz	MINCQEBCVSBAFC-FGZHOGPDSA-N	0	3	346.474	3.282	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccc(F)cc2)[C@H](NC(=O)C=C2CCC2)C1	ZINC001087463829	1359478295	/nfs/dbraw/zinc/47/82/95/1359478295.db2.gz	BSHMGIXEYAHOAW-WOJBJXKFSA-N	0	3	340.442	3.233	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)c2cc(C#N)c[nH]2)CCN1C/C=C\c1ccccc1	ZINC001087534769	1359518173	/nfs/dbraw/zinc/51/81/73/1359518173.db2.gz	JALPRHWOKRXOIF-LZYRERBLSA-N	0	3	348.450	3.182	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)Cn2c(C)cc3ccccc32)[C@H]1CC	ZINC001087647849	1359570943	/nfs/dbraw/zinc/57/09/43/1359570943.db2.gz	LCQOVBCJYUIQLR-ZWKOTPCHSA-N	0	3	325.456	3.105	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cc3c(cn2)CCCC3)[C@H]1CC	ZINC001087650702	1359571397	/nfs/dbraw/zinc/57/13/97/1359571397.db2.gz	ZSZZETISYLAPGN-PKOBYXMFSA-N	0	3	327.472	3.119	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(F)c(Cl)cc2F)[C@H]1CC	ZINC001087708081	1359601586	/nfs/dbraw/zinc/60/15/86/1359601586.db2.gz	QLIZXCOZCQHTEF-LSDHHAIUSA-N	0	3	328.790	3.387	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)Cc2cccc(OCCC)c2)[C@H]1CC	ZINC001087788819	1359644893	/nfs/dbraw/zinc/64/48/93/1359644893.db2.gz	JYNRDKJTBYXZIS-RBUKOAKNSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cnn(CCCC)c2CC)[C@H]1CC	ZINC001087790628	1359647636	/nfs/dbraw/zinc/64/76/36/1359647636.db2.gz	WPCIUWOYJAORIY-PKOBYXMFSA-N	0	3	346.519	3.404	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cc(F)c(F)c(F)c2F)[C@H]1CC	ZINC001087806002	1359655319	/nfs/dbraw/zinc/65/53/19/1359655319.db2.gz	HYRAJUFJRXRAHP-QWHCGFSZSA-N	0	3	344.352	3.402	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc3ccccc3n2CC)[C@H]1CC	ZINC001087839606	1359674240	/nfs/dbraw/zinc/67/42/40/1359674240.db2.gz	KIQRUTJLLLFKIP-DLBZAZTESA-N	0	3	325.456	3.430	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CCN(Cc4ccc(F)cc4)C[C@H]3C2)C1	ZINC001088097906	1359754304	/nfs/dbraw/zinc/75/43/04/1359754304.db2.gz	NRDKWCKPVYOAEZ-MSOLQXFVSA-N	0	3	342.458	3.462	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CCN(Cc4ccsc4)C[C@H]3C2)C1	ZINC001088098724	1359756076	/nfs/dbraw/zinc/75/60/76/1359756076.db2.gz	YNRWMMFWEXAFJW-SJORKVTESA-N	0	3	330.497	3.385	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)Cc3cccc4ccccc43)C[C@@H]2C1	ZINC001088177926	1359782328	/nfs/dbraw/zinc/78/23/28/1359782328.db2.gz	IIRQCSPSXVQRTM-RTWAWAEBSA-N	0	3	346.474	3.186	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3csc4c3CCCC4)C[C@@H]2C1	ZINC001088193413	1359789938	/nfs/dbraw/zinc/78/99/38/1359789938.db2.gz	BDGWWJDIVHKVBU-CVEARBPZSA-N	0	3	342.508	3.044	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3cc4c(cccc4F)s3)C[C@@H]2C1	ZINC001088195252	1359790328	/nfs/dbraw/zinc/79/03/28/1359790328.db2.gz	VPFHUZIEPYHDTB-KGLIPLIRSA-N	0	3	342.439	3.068	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3ccc4[nH]c(C)c(C)c4c3)C[C@@H]2C1	ZINC001088196457	1359791385	/nfs/dbraw/zinc/79/13/85/1359791385.db2.gz	IPBYGPXEHXHOPF-MOPGFXCFSA-N	0	3	349.478	3.202	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3cc4cccc(Cl)c4o3)C[C@@H]2C1	ZINC001088224481	1359802748	/nfs/dbraw/zinc/80/27/48/1359802748.db2.gz	ZSDRXXBJAOXBEF-CABCVRRESA-N	0	3	342.826	3.113	20	30		EGEDHN
C=CCN1CC[C@H](OCC2CCN(C(=O)C3CCCCC3)CC2)C1	ZINC001088228460	1359808292	/nfs/dbraw/zinc/80/82/92/1359808292.db2.gz	QQEDECZJNWQKSG-IBGZPJMESA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2occ3c2CCC3)C1	ZINC001088354402	1359838011	/nfs/dbraw/zinc/83/80/11/1359838011.db2.gz	XGZJKXMBKWEWOH-OAHLLOKOSA-N	0	3	336.863	3.495	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2cnc(C3CC3)nc2)C1	ZINC001088394515	1359871139	/nfs/dbraw/zinc/87/11/39/1359871139.db2.gz	IMOBVPRIYHIRHZ-INIZCTEOSA-N	0	3	348.878	3.081	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2nc(C)oc2C)C1	ZINC001088403700	1359875904	/nfs/dbraw/zinc/87/59/04/1359875904.db2.gz	BLOQMYKGWPROLG-CQSZACIVSA-N	0	3	325.840	3.018	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)COc2ccsc2)C1	ZINC001088413802	1359884782	/nfs/dbraw/zinc/88/47/82/1359884782.db2.gz	PONPWBSRANGQJS-CQSZACIVSA-N	0	3	342.892	3.240	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3cccc(CC)c3)[C@@H]2C)nc1	ZINC001088988278	1360125754	/nfs/dbraw/zinc/12/57/54/1360125754.db2.gz	NILRTMCUXVWONM-UZLBHIALSA-N	0	3	347.462	3.018	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N1CCCC[C@H]1CN(C)Cc1ccc(C#N)cc1	ZINC001089213652	1360259291	/nfs/dbraw/zinc/25/92/91/1360259291.db2.gz	QFFKJHNSRFUVPQ-SNRMKQJTSA-N	0	3	325.456	3.027	20	30		EGEDHN
CCC(=O)N[C@@H]1CCN(Cc2cc(C#N)ccc2OC)CC(C)(C)C1	ZINC001089283139	1360301647	/nfs/dbraw/zinc/30/16/47/1360301647.db2.gz	GKHQWBYWJDVWAY-QGZVFWFLSA-N	0	3	343.471	3.084	20	30		EGEDHN
CC(C)(F)C(=O)N[C@H]1CCN(CC#Cc2ccccc2)CC(C)(C)C1	ZINC001089293968	1360311315	/nfs/dbraw/zinc/31/13/15/1360311315.db2.gz	VTFBCNBHDBYMFX-SFHVURJKSA-N	0	3	344.474	3.393	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccnn2C(CC)CC)CC(C)(C)C1	ZINC001089402114	1360401150	/nfs/dbraw/zinc/40/11/50/1360401150.db2.gz	CHGURNJMXKRVAI-MRXNPFEDSA-N	0	3	344.503	3.098	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2cccc3cnccc32)CC(C)(C)C1	ZINC001089419724	1360413864	/nfs/dbraw/zinc/41/38/64/1360413864.db2.gz	HGOBKDVVDYTPMG-IBGZPJMESA-N	0	3	349.478	3.017	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C2(c3ccccc3)CCC2)CC(C)(C)C1	ZINC001089434996	1360426164	/nfs/dbraw/zinc/42/61/64/1360426164.db2.gz	AYZVYHZWTDIWGB-IBGZPJMESA-N	0	3	338.495	3.348	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@H](c2ccccc2)C2CC2)CC(C)(C)C1	ZINC001089439818	1360430058	/nfs/dbraw/zinc/43/00/58/1360430058.db2.gz	UHQVTIIZMGICSO-VQTJNVASSA-N	0	3	338.495	3.420	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N[C@H]1CCN(CC#Cc2ccccc2)CC(C)(C)C1	ZINC001089467336	1360451379	/nfs/dbraw/zinc/45/13/79/1360451379.db2.gz	RKRGJYHBZPHPSC-IHPCNDPISA-N	0	3	338.495	3.301	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2nccc3ccccc32)CC(C)(C)C1	ZINC001089476508	1360458901	/nfs/dbraw/zinc/45/89/01/1360458901.db2.gz	ODPLWKBDYHSMTF-GOSISDBHSA-N	0	3	349.478	3.479	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc(C)s2)CC(C)(C)C1	ZINC001089510950	1360482148	/nfs/dbraw/zinc/48/21/48/1360482148.db2.gz	IQTXNTMKTNBKAD-BRWVUGGUSA-N	0	3	344.524	3.400	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2oc(CC(C)C)nc2C)CC(C)(C)C1	ZINC001089515062	1360485357	/nfs/dbraw/zinc/48/53/57/1360485357.db2.gz	SPIBGYHHYSIWGM-INIZCTEOSA-N	0	3	345.487	3.035	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(C(F)F)cc2)CC(C)(C)C1	ZINC001089516557	1360486564	/nfs/dbraw/zinc/48/65/64/1360486564.db2.gz	GLHWISUKCWCSER-MRXNPFEDSA-N	0	3	334.410	3.478	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(C/C=C/Cl)CC(C)(C)C2)nc1	ZINC001089544468	1360499836	/nfs/dbraw/zinc/49/98/36/1360499836.db2.gz	SUEFYGYDIGXFTF-DXWDOBMASA-N	0	3	345.874	3.036	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C(C)(C)c2ccccc2)CC(C)(C)C1	ZINC001089554879	1360505568	/nfs/dbraw/zinc/50/55/68/1360505568.db2.gz	FMIUEWPIVHMDBW-GOSISDBHSA-N	0	3	326.484	3.204	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc(Cl)cn2CC)CC(C)(C)C1	ZINC001089563093	1360510967	/nfs/dbraw/zinc/51/09/67/1360510967.db2.gz	OWXJBZBROJUOKF-HNNXBMFYSA-N	0	3	335.879	3.015	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ccnn1CCC	ZINC001089648850	1360561712	/nfs/dbraw/zinc/56/17/12/1360561712.db2.gz	SVHNOVNPXIGCTR-INIZCTEOSA-N	0	3	332.492	3.090	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(C2CC2)nn1C	ZINC001089650358	1360563742	/nfs/dbraw/zinc/56/37/42/1360563742.db2.gz	YUFTZYTVNGFVGJ-INIZCTEOSA-N	0	3	344.503	3.094	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1nc(C)sc1C	ZINC001089657062	1360568729	/nfs/dbraw/zinc/56/87/29/1360568729.db2.gz	QGNLKKGXELZNFQ-HNNXBMFYSA-N	0	3	333.501	3.004	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1n[nH]c2c1CCCC2	ZINC001089663302	1360573183	/nfs/dbraw/zinc/57/31/83/1360573183.db2.gz	LVPBCHVBVLZYNH-HNNXBMFYSA-N	0	3	344.503	3.085	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1sc(C)cc1OC	ZINC001089707767	1360611270	/nfs/dbraw/zinc/61/12/70/1360611270.db2.gz	SMQUHFYNVWGYKP-HNNXBMFYSA-N	0	3	348.512	3.309	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1c(C)nn(CC)c1C	ZINC001089711389	1360614626	/nfs/dbraw/zinc/61/46/26/1360614626.db2.gz	SNRIXNUOYUYVNS-QGZVFWFLSA-N	0	3	346.519	3.316	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(CCC)on1	ZINC001089718439	1360620156	/nfs/dbraw/zinc/62/01/56/1360620156.db2.gz	PYZAKPXJHCBMMX-OAHLLOKOSA-N	0	3	333.476	3.424	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc2ccncc2c1	ZINC001089719513	1360621436	/nfs/dbraw/zinc/62/14/36/1360621436.db2.gz	FEYTUTSJRACVEB-HXUWFJFHSA-N	0	3	349.478	3.479	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc2sccc2[nH]1	ZINC001089719947	1360622776	/nfs/dbraw/zinc/62/27/76/1360622776.db2.gz	OLGFWPBTTWRMNI-AWEZNQCLSA-N	0	3	343.496	3.473	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1oc(CCC)nc1C	ZINC001089722458	1360625989	/nfs/dbraw/zinc/62/59/89/1360625989.db2.gz	ZSOIDCSEJWEKDF-INIZCTEOSA-N	0	3	345.487	3.179	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(OCC)cc1	ZINC001089729247	1360632016	/nfs/dbraw/zinc/63/20/16/1360632016.db2.gz	IRIRWASPKQVMQV-KRWDZBQOSA-N	0	3	330.472	3.492	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc2c(c1)N(C)CC2	ZINC001089729519	1360632684	/nfs/dbraw/zinc/63/26/84/1360632684.db2.gz	PZLJTDVKHFTBIH-GOSISDBHSA-N	0	3	341.499	3.085	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(C)nc1C	ZINC001089734445	1360639672	/nfs/dbraw/zinc/63/96/72/1360639672.db2.gz	QKEVOCGTTYUZFI-KRWDZBQOSA-N	0	3	329.488	3.495	20	30		EGEDHN
C=C(C)CC[N@H+]1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)c2ccccc2[O-])C1	ZINC001089776663	1360659552	/nfs/dbraw/zinc/65/95/52/1360659552.db2.gz	GMSXJQMTUPQIDW-WNHJNPCNSA-N	0	3	340.467	3.141	20	30		EGEDHN
C=C(C)CC[N@@H+]1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)c2ccccc2[O-])C1	ZINC001089776663	1360659554	/nfs/dbraw/zinc/65/95/54/1360659554.db2.gz	GMSXJQMTUPQIDW-WNHJNPCNSA-N	0	3	340.467	3.141	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1(CF)CCC1	ZINC001089867443	1360709615	/nfs/dbraw/zinc/70/96/15/1360709615.db2.gz	JFOSIRSMPTYRFH-JJXSEGSLSA-N	0	3	340.870	3.048	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cccc(F)c2)CC2(CCOCC2)C1	ZINC001089921227	1360745489	/nfs/dbraw/zinc/74/54/89/1360745489.db2.gz	YLLKAVHSYAJILV-SFHVURJKSA-N	0	3	346.446	3.003	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccc(C3CCCC3)cc2)[C@@H](O)C1	ZINC001090435719	1360896270	/nfs/dbraw/zinc/89/62/70/1360896270.db2.gz	JWYFPFUFHLMOKZ-PMACEKPBSA-N	0	3	342.483	3.085	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccnc3ccccc32)C1	ZINC001091129503	1360994934	/nfs/dbraw/zinc/99/49/34/1360994934.db2.gz	MTBZNHANGPYZJV-UHFFFAOYSA-N	0	3	329.831	3.085	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3csc4ccccc34)C[C@]2(C)C1	ZINC001091892639	1361241972	/nfs/dbraw/zinc/24/19/72/1361241972.db2.gz	WXFBCUOQSDWXIA-QRWLVFNGSA-N	0	3	338.476	3.319	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3c(Cl)oc4ccccc43)C[C@]2(C)C1	ZINC001091942411	1361256483	/nfs/dbraw/zinc/25/64/83/1361256483.db2.gz	ARGQCLRLEZMXKL-YJYMSZOUSA-N	0	3	342.826	3.113	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc(Cl)c(C)c3)C[C@]2(C)C1	ZINC001091974413	1361263987	/nfs/dbraw/zinc/26/39/87/1361263987.db2.gz	FKMWJOODOKMHJP-APWZRJJASA-N	0	3	330.859	3.066	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)C(C)(C)c3ccc(Cl)cc3)C[C@]2(C)C1	ZINC001091973871	1361264021	/nfs/dbraw/zinc/26/40/21/1361264021.db2.gz	IVUAUXKPARSJBW-UZLBHIALSA-N	0	3	344.886	3.031	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CN(Cc3c(C)noc3C)C[C@@]2(C)C1	ZINC001091975748	1361264290	/nfs/dbraw/zinc/26/42/90/1361264290.db2.gz	WLGNVXKFAYCTCJ-UXPWSPDFSA-N	0	3	345.487	3.174	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@@H](F)CC3CCCCC3)C[C@]2(C)C1	ZINC001092202388	1361321620	/nfs/dbraw/zinc/32/16/20/1361321620.db2.gz	KDIXLAQMDXBTEX-HBFSDRIKSA-N	0	3	334.479	3.099	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3cc(Cl)cc(Cl)c3)C[C@]2(C)C1	ZINC001092228475	1361332726	/nfs/dbraw/zinc/33/27/26/1361332726.db2.gz	CFKBWYWBKSAODD-DYVFJYSZSA-N	0	3	337.250	3.021	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C[C@H](C)c3ccc(F)cc3)C[C@]2(C)C1	ZINC001092296918	1361357856	/nfs/dbraw/zinc/35/78/56/1361357856.db2.gz	MFQUTLSASGWMPW-CDXJDZJCSA-N	0	3	342.458	3.123	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)CCC2CCC2)CC1	ZINC001093363073	1361574784	/nfs/dbraw/zinc/57/47/84/1361574784.db2.gz	FHOOXXNYWJOEDX-FQEVSTJZSA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)[C@@](C)(C=C)CC)CC1	ZINC001093377915	1361588515	/nfs/dbraw/zinc/58/85/15/1361588515.db2.gz	YRPWRSWROLANBH-QUCCMNQESA-N	0	3	328.500	3.315	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@]23CCC[C@H]2N(C/C=C\Cl)CC3)cc1	ZINC001094485427	1361825143	/nfs/dbraw/zinc/82/51/43/1361825143.db2.gz	RRPRSFJAWHRNCU-AWZQTFBISA-N	0	3	342.870	3.395	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3ccccc3-n3cccc3)CCC[C@@H]12	ZINC001094501798	1361833707	/nfs/dbraw/zinc/83/37/07/1361833707.db2.gz	RNCCSZPPXWSNOS-IFMALSPDSA-N	0	3	347.462	3.085	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3ccc(C4CC4)s3)CCC[C@@H]12	ZINC001094560009	1361859678	/nfs/dbraw/zinc/85/96/78/1361859678.db2.gz	KBQNYAQXEURMTO-IEBWSBKVSA-N	0	3	328.481	3.233	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cnc(C(C)(C)C)s3)CCC[C@@H]12	ZINC001094585344	1361871339	/nfs/dbraw/zinc/87/13/39/1361871339.db2.gz	SYDUPWNGJHVVQO-DNVCBOLYSA-N	0	3	345.512	3.048	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1C[C@H]2C[C@@H](C1)N(C(=O)C1CC3(CC3)C1)C2	ZINC001095001278	1361985157	/nfs/dbraw/zinc/98/51/57/1361985157.db2.gz	TZALLORYIYTMIN-BEVDRBHNSA-N	0	3	349.478	3.218	20	30		EGEDHN
Cc1ccc(CN2[C@@H]3CC[C@H]2[C@@H](NC(=O)c2cc(C#N)c[nH]2)C3)c(C)c1	ZINC001095283233	1362082815	/nfs/dbraw/zinc/08/28/15/1362082815.db2.gz	LGPRNDAIRUOHLY-HBFSDRIKSA-N	0	3	348.450	3.039	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](NCc2cc(C)ccc2OC)C1	ZINC001184883507	1387554623	/nfs/dbraw/zinc/55/46/23/1387554623.db2.gz	BNHRPMQKRDXCAU-LJQANCHMSA-N	0	3	342.483	3.278	20	30		EGEDHN
Cc1ccc(CN2[C@@H]3CC[C@H]2[C@@H](NC(=O)c2c[nH]c(C#N)c2)C3)cc1C	ZINC001095337275	1362105751	/nfs/dbraw/zinc/10/57/51/1362105751.db2.gz	NKSZOOGBZDLDNX-AABGKKOBSA-N	0	3	348.450	3.039	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1nc(Cl)sc1C)C2	ZINC001095739879	1362218551	/nfs/dbraw/zinc/21/85/51/1362218551.db2.gz	NBIMDGBGCZSPLK-WOPDTQHZSA-N	0	3	325.865	3.016	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1)C2	ZINC001096132909	1362399761	/nfs/dbraw/zinc/39/97/61/1362399761.db2.gz	YXQYGJRXFRWFIY-XZEJUNMKSA-N	0	3	340.467	3.096	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(F)c(C(F)F)c1)C2	ZINC001097089250	1362838642	/nfs/dbraw/zinc/83/86/42/1362838642.db2.gz	PKDBZBCTODXZHP-WQVCFCJDSA-N	0	3	336.357	3.122	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cnc(-c3ccccc3)o1)C2	ZINC001097274876	1362909839	/nfs/dbraw/zinc/90/98/39/1362909839.db2.gz	COZJMBHPYBOACV-ZACQAIPSSA-N	0	3	337.423	3.253	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H]1CC[C@@H](c3ccccc3)C1)C2	ZINC001097322790	1362932247	/nfs/dbraw/zinc/93/22/47/1362932247.db2.gz	BFKPIHONSJXRLF-ONUIULTDSA-N	0	3	336.479	3.315	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](CNCc2cc(C3CC3)no2)[C@@H](C)C1	ZINC001185062052	1387605372	/nfs/dbraw/zinc/60/53/72/1387605372.db2.gz	QHXNQGYUSDKMPH-RDJZCZTQSA-N	0	3	345.487	3.483	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ncc(Cl)s1)C2	ZINC001097537099	1363045100	/nfs/dbraw/zinc/04/51/00/1363045100.db2.gz	YKTPKIKIGHIMRC-UTUOFQBUSA-N	0	3	325.865	3.098	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc3c(c1)[C@@H](C)CO3)C2	ZINC001097687206	1363101197	/nfs/dbraw/zinc/10/11/97/1363101197.db2.gz	LSGRWWYPBVCROG-NZPGVSJUSA-N	0	3	326.440	3.094	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C1(c3cccc(OC)c3)CC1)C2	ZINC001097947607	1363175799	/nfs/dbraw/zinc/17/57/99/1363175799.db2.gz	BXLVQZGFLAIMFO-QRQLOZEOSA-N	0	3	340.467	3.024	20	30		EGEDHN
O=C(C#Cc1cccs1)NC[C@@H]1CCCN(Cc2cccs2)C1	ZINC001324379499	1387614552	/nfs/dbraw/zinc/61/45/52/1387614552.db2.gz	WDFNOZKFEPHJKF-HNNXBMFYSA-N	0	3	344.505	3.190	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](CNCc3ocnc3C)[C@@H](C)C2)CCC1	ZINC001185095615	1387617610	/nfs/dbraw/zinc/61/76/10/1387617610.db2.gz	QZASOGZGSCRFES-RDJZCZTQSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(CN(CC)CC)o1)C2	ZINC001098482772	1363339202	/nfs/dbraw/zinc/33/92/02/1363339202.db2.gz	BANLKPCSLGADSZ-NXHRZFHOSA-N	0	3	345.487	3.033	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1(C)C(C)(C)C1(C)C)C[C@@H](C)O2	ZINC001098668651	1363428291	/nfs/dbraw/zinc/42/82/91/1363428291.db2.gz	SCJOFMCERUKFLQ-MRXNPFEDSA-N	0	3	348.531	3.327	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2cncc(Cl)c2C)C1	ZINC001098886175	1363505036	/nfs/dbraw/zinc/50/50/36/1363505036.db2.gz	ZISPSENZEXNFQS-KSSFIOAISA-N	0	3	333.863	3.204	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2ccn(C(CC)CC)n2)C1	ZINC001099061051	1363601095	/nfs/dbraw/zinc/60/10/95/1363601095.db2.gz	GRPKMNXZFQKNOE-JXFKEZNVSA-N	0	3	344.503	3.405	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)C[C@@H](C)n1ccnc1CC	ZINC001099080122	1363611935	/nfs/dbraw/zinc/61/19/35/1363611935.db2.gz	MOVKKUUWNAPQHU-IAGOWNOFSA-N	0	3	346.519	3.189	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)C(C)(C)n1cnc(C)c1	ZINC001099121723	1363636032	/nfs/dbraw/zinc/63/60/32/1363636032.db2.gz	NRHKTUZGMVURMU-QGZVFWFLSA-N	0	3	346.519	3.110	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)CCc1cccc(OC)c1	ZINC001099140537	1363650559	/nfs/dbraw/zinc/65/05/59/1363650559.db2.gz	ZMTVICMVAZEQOJ-GOSISDBHSA-N	0	3	344.499	3.421	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)C[C@H]1CCC(C)(C)CO1	ZINC001099144405	1363652897	/nfs/dbraw/zinc/65/28/97/1363652897.db2.gz	HCYOGHLGZGQKOX-IAGOWNOFSA-N	0	3	336.520	3.375	20	30		EGEDHN
CN1CCC[C@@H](CNC(=O)C#Cc2cccs2)[C@@H]1c1cccs1	ZINC001324476954	1387636555	/nfs/dbraw/zinc/63/65/55/1387636555.db2.gz	YRZGPCPBRTZJKC-KBXCAEBGSA-N	0	3	344.505	3.360	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H](C)c2ccc(F)c(F)c2)C1	ZINC001099172293	1363670050	/nfs/dbraw/zinc/67/00/50/1363670050.db2.gz	USKBEJFIPGZOTR-WTANOLMUSA-N	0	3	334.410	3.225	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@@H]1CCC(C)(C)CN1CCn1cccn1	ZINC001099193449	1363684673	/nfs/dbraw/zinc/68/46/73/1363684673.db2.gz	BWCJGJKTESSWKE-MSOLQXFVSA-N	0	3	346.519	3.092	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@H]1CCC(C)(C)CN1CCn1cccn1	ZINC001099193450	1363684779	/nfs/dbraw/zinc/68/47/79/1363684779.db2.gz	BWCJGJKTESSWKE-QZTJIDSGSA-N	0	3	346.519	3.092	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)C1(C(F)F)CCC1	ZINC001099199270	1363688956	/nfs/dbraw/zinc/68/89/56/1363688956.db2.gz	JUEZTNSQWIPPED-AWEZNQCLSA-N	0	3	326.431	3.052	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)C[C@H](C)c1cccnc1	ZINC001099258487	1363719791	/nfs/dbraw/zinc/71/97/91/1363719791.db2.gz	RIERBVFRISMCOY-FUHWJXTLSA-N	0	3	329.488	3.368	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)C[C@H]2C=CCCC2)C[C@H]1C(F)(F)F	ZINC001099268989	1363724599	/nfs/dbraw/zinc/72/45/99/1363724599.db2.gz	VSSQQVPIMPUEOC-RRFJBIMHSA-N	0	3	330.394	3.288	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)C[C@@H]2C=CCCC2)C[C@H]1C(F)(F)F	ZINC001099268988	1363724623	/nfs/dbraw/zinc/72/46/23/1363724623.db2.gz	VSSQQVPIMPUEOC-RBSFLKMASA-N	0	3	330.394	3.288	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)CCc2ccc(C)cc2)C[C@H]1C(F)(F)F	ZINC001099278454	1363729079	/nfs/dbraw/zinc/72/90/79/1363729079.db2.gz	BTUYKGXCHRNQRE-HZPDHXFCSA-N	0	3	340.389	3.093	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2cc(Cl)cs2)C[C@H]1C(F)(F)F	ZINC001099316719	1363746178	/nfs/dbraw/zinc/74/61/78/1363746178.db2.gz	BGZXVWQCWHBQKR-NXEZZACHSA-N	0	3	338.782	3.180	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)COc1ccc(CC)cc1	ZINC001099328353	1363752910	/nfs/dbraw/zinc/75/29/10/1363752910.db2.gz	BQVWICKLJQVUQJ-GOSISDBHSA-N	0	3	344.499	3.421	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2ccc(C)cc2C)C[C@H]1C(F)(F)F	ZINC001099339146	1363758906	/nfs/dbraw/zinc/75/89/06/1363758906.db2.gz	PAENUQAPEOTAQI-HZPDHXFCSA-N	0	3	340.389	3.472	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)COc1ccccc1F	ZINC001099339375	1363759608	/nfs/dbraw/zinc/75/96/08/1363759608.db2.gz	HXEOVSGEJNJQTD-INIZCTEOSA-N	0	3	348.462	3.387	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)[C@H](C)n1nc(C)cc1C	ZINC001099372204	1363777530	/nfs/dbraw/zinc/77/75/30/1363777530.db2.gz	LVDCVECYQBDUIO-ROUUACIJSA-N	0	3	346.519	3.244	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)CSCCC)C1	ZINC001099424856	1363794414	/nfs/dbraw/zinc/79/44/14/1363794414.db2.gz	MFVONZNFBXTGGY-VGWMRTNUSA-N	0	3	342.936	3.051	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@H]1CN(CC(=C)C)CC2(CCOCC2)C1	ZINC001099588906	1363870789	/nfs/dbraw/zinc/87/07/89/1363870789.db2.gz	LTQHQXVJSTVQJL-QZTJIDSGSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)[C@H](C)CC(C)(C)C)CC2(CCOCC2)C1	ZINC001099592666	1363874377	/nfs/dbraw/zinc/87/43/77/1363874377.db2.gz	HPPVQMGGQTUMKU-IAGOWNOFSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1CCN(Cc2ccc(C(C)C)cc2)C[C@H]1O	ZINC001099855154	1363965416	/nfs/dbraw/zinc/96/54/16/1363965416.db2.gz	CZAXKXUYJKXFAF-VQTJNVASSA-N	0	3	344.499	3.218	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1CCN(Cc2ccc(CCC)cc2)C[C@H]1O	ZINC001099977350	1363995660	/nfs/dbraw/zinc/99/56/60/1363995660.db2.gz	XMBQTOHQJKRZPA-VQTJNVASSA-N	0	3	344.499	3.047	20	30		EGEDHN
Cc1ccc(CNC2CC(CNC(=O)C#CC(C)C)C2)c(Cl)c1	ZINC001100310534	1364076753	/nfs/dbraw/zinc/07/67/53/1364076753.db2.gz	WHPXIAIFHRENOR-UHFFFAOYSA-N	0	3	332.875	3.292	20	30		EGEDHN
CC1(C(=O)NCC2CC(NCc3cc(C#N)ccc3F)C2)CCCC1	ZINC001100548402	1364156623	/nfs/dbraw/zinc/15/66/23/1364156623.db2.gz	UDZPOGBIPMBQMO-UHFFFAOYSA-N	0	3	343.446	3.262	20	30		EGEDHN
CC1(C(=O)NCC2CC(NCC#Cc3ccc(Cl)cc3)C2)CCC1	ZINC001100576153	1364170375	/nfs/dbraw/zinc/17/03/75/1364170375.db2.gz	OANLYANPDGCEEK-UHFFFAOYSA-N	0	3	344.886	3.366	20	30		EGEDHN
CC1(C)CC[C@@H]1C(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100586116	1364175759	/nfs/dbraw/zinc/17/57/59/1364175759.db2.gz	NOGQJWJDNMLYLU-NKELODKYSA-N	0	3	342.458	3.098	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC1CC(NCc2cccc(Cl)n2)C1	ZINC001100644724	1364202010	/nfs/dbraw/zinc/20/20/10/1364202010.db2.gz	DOYLHANNOBCPMJ-LEHRNKBSSA-N	0	3	335.879	3.322	20	30		EGEDHN
CC(C)C[C@@H](C)C(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1	ZINC001100796108	1364265362	/nfs/dbraw/zinc/26/53/62/1364265362.db2.gz	UKHDPROZKBWAGZ-MXWWQKGMSA-N	0	3	345.462	3.364	20	30		EGEDHN
CCC(C)(CC)C(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001101005220	1364368018	/nfs/dbraw/zinc/36/80/18/1364368018.db2.gz	ZMEOLNLJFKZRTP-UHFFFAOYSA-N	0	3	344.474	3.488	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@H](OCC)c2ccccc2)C1	ZINC001101062344	1364397172	/nfs/dbraw/zinc/39/71/72/1364397172.db2.gz	MADZPXLSJDTEJO-BDVYOWHSSA-N	0	3	336.863	3.001	20	30		EGEDHN
C=CCN1CC[C@@H](Oc2ccnc(CNC(=O)C=C(CC)CC)c2)C1	ZINC001101091768	1364409232	/nfs/dbraw/zinc/40/92/32/1364409232.db2.gz	HICBEWXTWLYYFE-LJQANCHMSA-N	0	3	343.471	3.083	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1C[C@H]2CN(Cc3ccsc3)C[C@@]2(C)C1	ZINC001101162010	1364439677	/nfs/dbraw/zinc/43/96/77/1364439677.db2.gz	ZXPUAZYDFNNGLJ-SUMDDJOVSA-N	0	3	348.512	3.010	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@H]2CN(Cc3scnc3C)C[C@@]2(C)C1	ZINC001101251841	1364486640	/nfs/dbraw/zinc/48/66/40/1364486640.db2.gz	OBICUIJYGDGYIF-BEFAXECRSA-N	0	3	347.528	3.334	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)CC[C@H](C)c3ccccc3)C[C@]2(C)C1	ZINC001101383582	1364538943	/nfs/dbraw/zinc/53/89/43/1364538943.db2.gz	PRDDNYMWEZYCKM-DWLFOUALSA-N	0	3	338.495	3.374	20	30		EGEDHN
C=C(C)C[NH2+]CC(C)(C)C1CCN(C(=O)c2ccccc2[O-])CC1	ZINC001101511604	1364590770	/nfs/dbraw/zinc/59/07/70/1364590770.db2.gz	KTGBFOSEJLRGGD-UHFFFAOYSA-N	0	3	330.472	3.436	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC2(CN(CCC3CCCC3)C2)n2ccnc21	ZINC001101615332	1364656403	/nfs/dbraw/zinc/65/64/03/1364656403.db2.gz	HDYZSQGKADJMSJ-QGZVFWFLSA-N	0	3	342.487	3.002	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1CC2(CN(CCC(C)C)C2)n2ccnc21	ZINC001101645497	1364668925	/nfs/dbraw/zinc/66/89/25/1364668925.db2.gz	CNWMPLJUIJNVPK-INIZCTEOSA-N	0	3	344.503	3.103	20	30		EGEDHN
CC[C@@H](C)C(=O)NC[C@@H]1CN(CC#Cc2cccc(Cl)c2)C[C@H]1C	ZINC001101731906	1364707125	/nfs/dbraw/zinc/70/71/25/1364707125.db2.gz	NJOHKFYQBPAANA-JFIYKMOQSA-N	0	3	346.902	3.422	20	30		EGEDHN
CCCCC(=O)NC[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1C	ZINC001101734676	1364707585	/nfs/dbraw/zinc/70/75/85/1364707585.db2.gz	QIWAITXEVTYRKK-RHSMWYFYSA-N	0	3	331.435	3.072	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@@H]1CN(Cc2c(C)onc2CC)C[C@H]1C	ZINC001102005218	1364808574	/nfs/dbraw/zinc/80/85/74/1364808574.db2.gz	ZLBPIGTXYNXRPC-GDBMZVCRSA-N	0	3	347.503	3.332	20	30		EGEDHN
C[C@H](C(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C)C1CCC1	ZINC001102079966	1364841926	/nfs/dbraw/zinc/84/19/26/1364841926.db2.gz	MAZZHXZZTBDWQJ-LVCYWYKZSA-N	0	3	338.495	3.158	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H]1CN(Cc2cc(F)ccc2OC)C[C@H]1C	ZINC001102297749	1364988644	/nfs/dbraw/zinc/98/86/44/1364988644.db2.gz	BBZBFDQWWNWZSB-NVXWUHKLSA-N	0	3	348.462	3.375	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H]2CN(Cc3cccnc3)C[C@H]2C)CCC1	ZINC001102330249	1365005346	/nfs/dbraw/zinc/00/53/46/1365005346.db2.gz	KQBGFPJESSXNSR-SJLPKXTDSA-N	0	3	327.472	3.012	20	30		EGEDHN
CC(C)C1(C(=O)NC[C@@H]2CN(Cc3ccc(C#N)s3)C[C@H]2C)CC1	ZINC001102346590	1365013966	/nfs/dbraw/zinc/01/39/66/1365013966.db2.gz	UOMGFGKYFMHAQI-HUUCEWRRSA-N	0	3	345.512	3.240	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001102422920	1365047354	/nfs/dbraw/zinc/04/73/54/1365047354.db2.gz	GKOWVIXMLGQYOR-RBSFLKMASA-N	0	3	333.501	3.096	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1CCNC(=O)c1ccco1	ZINC001102639669	1365148964	/nfs/dbraw/zinc/14/89/64/1365148964.db2.gz	HRYAICPGHMVZRA-NVXWUHKLSA-N	0	3	337.423	3.039	20	30		EGEDHN
CC(C)CC(=O)NCC[C@@H]1CN(Cc2cc(C#N)ccc2F)C[C@H]1C	ZINC001102642821	1365151023	/nfs/dbraw/zinc/15/10/23/1365151023.db2.gz	SACUXSPTFOQSML-NVXWUHKLSA-N	0	3	345.462	3.318	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CCNC(=O)/C=C\C1CC1	ZINC001102822516	1365236644	/nfs/dbraw/zinc/23/66/44/1365236644.db2.gz	ONGRYNPMNUPYBL-TZPOZWHTSA-N	0	3	343.496	3.160	20	30		EGEDHN
C/C=C(\C)C(=O)NCC[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1C	ZINC001102842009	1365247121	/nfs/dbraw/zinc/24/71/21/1365247121.db2.gz	PUXDFDKMFPKHTK-FZGIQDKVSA-N	0	3	343.446	3.238	20	30		EGEDHN
CC(C)=C(F)C(=O)NCC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001102854944	1365254701	/nfs/dbraw/zinc/25/47/01/1365254701.db2.gz	BVQNTWHMOTVJDT-ZIAGYGMSSA-N	0	3	349.475	3.457	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCC[C@@H]1CN(Cc2ccns2)C[C@H]1C	ZINC001103344106	1365509856	/nfs/dbraw/zinc/50/98/56/1365509856.db2.gz	CXLCNNYBOVUENA-ARFHVFGLSA-N	0	3	335.517	3.320	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCC[C@@H]1CN(Cc2ccc(F)cn2)C[C@H]1C	ZINC001103346337	1365511170	/nfs/dbraw/zinc/51/11/70/1365511170.db2.gz	ICGXFPXESOFENL-IXDOHACOSA-N	0	3	347.478	3.397	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC[C@@H]1CN(Cc2cncc(F)c2)C[C@H]1C	ZINC001103401460	1365537283	/nfs/dbraw/zinc/53/72/83/1365537283.db2.gz	CCMJWTUNEZZNLW-MDYRTPRTSA-N	0	3	347.478	3.397	20	30		EGEDHN
C=CCCC1(C(=O)NCC[C@@H]2CN(Cc3cncs3)C[C@H]2C)CC1	ZINC001103403645	1365539332	/nfs/dbraw/zinc/53/93/32/1365539332.db2.gz	KOLPYFLHGQIYQU-HZPDHXFCSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=CCCC1(C(=O)NCC[C@@H]2CN(Cc3ccns3)C[C@H]2C)CC1	ZINC001103403629	1365539514	/nfs/dbraw/zinc/53/95/14/1365539514.db2.gz	JEYDTULTBYRNHP-HZPDHXFCSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)C2(CC)CCOCC2)C1	ZINC001103584114	1365652500	/nfs/dbraw/zinc/65/25/00/1365652500.db2.gz	CKLFPSHIWMAWQA-GDBMZVCRSA-N	0	3	342.911	3.020	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cc(CCC)on2)C1	ZINC001103596280	1365661323	/nfs/dbraw/zinc/66/13/23/1365661323.db2.gz	NCUXXXXEPYGWKH-TZMCWYRMSA-N	0	3	339.867	3.067	20	30		EGEDHN
CC[C@H](C)C(=O)N1C[C@@H](C)[C@H](CCNCc2ccccc2C#N)C1	ZINC001103904344	1365829228	/nfs/dbraw/zinc/82/92/28/1365829228.db2.gz	ABDHAGOLZZOGPE-FRQCXROJSA-N	0	3	327.472	3.179	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@@H]2CC2(C)C)C[C@H]1CCNCc1ccccc1C#N	ZINC001104084165	1365905472	/nfs/dbraw/zinc/90/54/72/1365905472.db2.gz	YRWXRHAHKNTRFR-LZQZEXGQSA-N	0	3	339.483	3.179	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2sccc2F)C[C@H]1C	ZINC001104154941	1365929601	/nfs/dbraw/zinc/92/96/01/1365929601.db2.gz	IQDZDGSWBZZYSA-ZYHUDNBSSA-N	0	3	330.856	3.328	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)C[C@@H](OCC)C(C)C)C[C@H]1C	ZINC001104287253	1365976403	/nfs/dbraw/zinc/97/64/03/1365976403.db2.gz	ZQBDVMMZHZYAAH-DJIMGWMZSA-N	0	3	344.927	3.264	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2ccc(F)c(F)c2)C[C@H]1C	ZINC001104292301	1365977803	/nfs/dbraw/zinc/97/78/03/1365977803.db2.gz	UDTIFICVNYJULB-BXUZGUMPSA-N	0	3	342.817	3.405	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@H](CCNCc2cc(C)no2)C1	ZINC001104485982	1366045604	/nfs/dbraw/zinc/04/56/04/1366045604.db2.gz	WUPKZQIPDONOFX-GDBMZVCRSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CN(C(=O)C2(C)CCC2)C[C@H]1C	ZINC001104500046	1366050429	/nfs/dbraw/zinc/05/04/29/1366050429.db2.gz	BPDZLSITLMJSTQ-TZMCWYRMSA-N	0	3	343.309	3.159	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H](C)[C@H](CCNCc3cnoc3C)C2)CC1	ZINC001104629851	1366108899	/nfs/dbraw/zinc/10/88/99/1366108899.db2.gz	NYOIILOORBIJOW-CRAIPNDOSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)Cc2ccccc2F)C[C@H]1C	ZINC001104971644	1366249111	/nfs/dbraw/zinc/24/91/11/1366249111.db2.gz	RNBBGRWJPBRHKS-CZUORRHYSA-N	0	3	338.854	3.195	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(c2ccccc2)C[C@H](NC(=O)C2CCC2)C1	ZINC001105401120	1366448518	/nfs/dbraw/zinc/44/85/18/1366448518.db2.gz	NIGXZUVOBSWUQC-IZAXUBKRSA-N	0	3	332.875	3.345	20	30		EGEDHN
C=CCCC1(C(=O)N2C[C@@H](CNCc3nc(C)cs3)[C@H](C)C2)CC1	ZINC001106633143	1366761200	/nfs/dbraw/zinc/76/12/00/1366761200.db2.gz	AROQSLLYBYBEJH-GDBMZVCRSA-N	0	3	347.528	3.382	20	30		EGEDHN
C#CCCCCC(=O)NC[C@]12CCC[C@H]1N(Cc1cnoc1C)CC2	ZINC001107372467	1366945818	/nfs/dbraw/zinc/94/58/18/1366945818.db2.gz	HWKPPNLGWUVKSA-UYAOXDASSA-N	0	3	343.471	3.037	20	30		EGEDHN
CC1(C(=O)NC[C@]23CCC[C@H]2N(Cc2ccc(C#N)s2)CC3)CC1	ZINC001107416782	1366958443	/nfs/dbraw/zinc/95/84/43/1366958443.db2.gz	SHZUKTKLTSKXIA-VQIMIIECSA-N	0	3	343.496	3.281	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](N(C)CCOc2cccc(Cl)c2)C1	ZINC001189318652	1366988062	/nfs/dbraw/zinc/98/80/62/1366988062.db2.gz	NNKNFAYEDLLVEP-INIZCTEOSA-N	0	3	336.863	3.218	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@]12CCC[C@H]1N(Cc1oc(C)nc1C)CC2	ZINC001107502454	1367000311	/nfs/dbraw/zinc/00/03/11/1367000311.db2.gz	IQSYMGVYOYMWAZ-YLJYHZDGSA-N	0	3	345.487	3.364	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@]12CCC[C@H]1N(Cc1cnoc1C)CC2	ZINC001107503081	1367001169	/nfs/dbraw/zinc/00/11/69/1367001169.db2.gz	RKZUJEVWXYUJJU-VQIMIIECSA-N	0	3	331.460	3.056	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)C[C@H](C)C3CCCCC3)[C@@H]2C1	ZINC001189398937	1367011784	/nfs/dbraw/zinc/01/17/84/1367011784.db2.gz	TZQSDQRXCAZGDE-YSIASYRMSA-N	0	3	348.531	3.328	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@]12CCC[C@H]1N(Cc1cc(C)no1)CC2	ZINC001107514562	1367012612	/nfs/dbraw/zinc/01/26/12/1367012612.db2.gz	MDVYGACITPVXEI-XFQXTVEOSA-N	0	3	345.487	3.446	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CC/C=C/c1ccccc1	ZINC001109248593	1367025317	/nfs/dbraw/zinc/02/53/17/1367025317.db2.gz	RXAVDHLIKWNPGY-KQOSPKRVSA-N	0	3	336.479	3.471	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1sc(Cl)nc1C)C2	ZINC001109339256	1367065850	/nfs/dbraw/zinc/06/58/50/1367065850.db2.gz	AKLLMJHLHSFRCK-AGIUHOORSA-N	0	3	339.892	3.406	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](N(C)[C@H](C)c2ccc(F)c(F)c2)C1	ZINC001189925986	1367132417	/nfs/dbraw/zinc/13/24/17/1367132417.db2.gz	JLJQFYDBUASGRQ-ZBFHGGJFSA-N	0	3	334.410	3.362	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](N(C)CCOc2cc(C)cc(C)c2)C1	ZINC001189925584	1367132562	/nfs/dbraw/zinc/13/25/62/1367132562.db2.gz	CHUVPVAVHBLFIU-LJQANCHMSA-N	0	3	342.483	3.018	20	30		EGEDHN
Cc1ccc(CN(C)[C@H]2CCN(C(=O)C#CC(C)(C)C)C2)cc1F	ZINC001190083881	1367169050	/nfs/dbraw/zinc/16/90/50/1367169050.db2.gz	HGGOIZXBZPTLFC-KRWDZBQOSA-N	0	3	330.447	3.216	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)C(C)=C2CCCC2)C1	ZINC001107859894	1367179504	/nfs/dbraw/zinc/17/95/04/1367179504.db2.gz	GKSBHPSQXDKUKV-OXQOHEQNSA-N	0	3	334.504	3.439	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)C(F)=C2CCCC2)C1	ZINC001107868630	1367184550	/nfs/dbraw/zinc/18/45/50/1367184550.db2.gz	VFMITVVJWLLLJM-KXBFYZLASA-N	0	3	338.467	3.346	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](N(C)Cc2ccc(OC)cc2)C1	ZINC001190398284	1367254536	/nfs/dbraw/zinc/25/45/36/1367254536.db2.gz	UTKQSNUXHNAFGT-KRWDZBQOSA-N	0	3	330.472	3.330	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](N(C)CCOc2cccc(C)c2)C1	ZINC001190435891	1367265542	/nfs/dbraw/zinc/26/55/42/1367265542.db2.gz	LGKIEJBLZNDBFP-SFHVURJKSA-N	0	3	330.472	3.263	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@]1(C)CN(C[C@@H](C)CC(C)C)CCO1	ZINC001108114518	1367287910	/nfs/dbraw/zinc/28/79/10/1367287910.db2.gz	FYARAGFPRAYLGY-FXAWDEMLSA-N	0	3	338.536	3.478	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@H](N(C)CCc3ccccc3F)C2)CCC1	ZINC001190603474	1367304956	/nfs/dbraw/zinc/30/49/56/1367304956.db2.gz	CXPSCLOTOQMUFT-SFHVURJKSA-N	0	3	342.458	3.095	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@@H](N(C)Cc3ccc(C)c(F)c3)C2)CCC1	ZINC001190605767	1367306723	/nfs/dbraw/zinc/30/67/23/1367306723.db2.gz	ZRZGARYQWCHNPV-GOSISDBHSA-N	0	3	342.458	3.360	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@]1(C)CN(CC2CCCCC2)CCO1	ZINC001108150560	1367311597	/nfs/dbraw/zinc/31/15/97/1367311597.db2.gz	FAQRONCHPKRYEQ-YLJYHZDGSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCCCC(=O)NC[C@]1(C)CN(CC2CCC(C)CC2)CCO1	ZINC001108168732	1367320532	/nfs/dbraw/zinc/32/05/32/1367320532.db2.gz	DCPMMKAVKYQXOD-AFMYVXGZSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2cc(C)cc(F)c2)C1	ZINC001108236911	1367354513	/nfs/dbraw/zinc/35/45/13/1367354513.db2.gz	UFUKISHONXGFFV-OXJNMPFZSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=CCC1(S(=O)(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)CC1	ZINC001190822526	1367360734	/nfs/dbraw/zinc/36/07/34/1367360734.db2.gz	YXZDORLQDYQIOP-WMZOPIPTSA-N	0	3	348.512	3.068	20	30		EGEDHN
C=CCCCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ncccc1F)C2	ZINC001109878301	1367377341	/nfs/dbraw/zinc/37/73/41/1367377341.db2.gz	QNBMFBODLSHBLC-PVAVHDDUSA-N	0	3	331.435	3.302	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2cccn2C(C)C)C1	ZINC001108400559	1367434414	/nfs/dbraw/zinc/43/44/14/1367434414.db2.gz	JHCRQPGFDDLMSR-FXAWDEMLSA-N	0	3	347.503	3.244	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2ccc(CF)cc2)C1	ZINC001108429002	1367452825	/nfs/dbraw/zinc/45/28/25/1367452825.db2.gz	DURMYMNQFWBQTN-OXQOHEQNSA-N	0	3	348.462	3.332	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3CCC[C@H](C)O)CCCCC1	ZINC001110135553	1367518059	/nfs/dbraw/zinc/51/80/59/1367518059.db2.gz	IRVHJESCCRFHGX-RDGPPVDQSA-N	0	3	348.531	3.396	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N1CC[C@@H](N(C)Cc2ccc(F)cc2)C1	ZINC001191577858	1367533498	/nfs/dbraw/zinc/53/34/98/1367533498.db2.gz	XFLKKSPBPVMFPA-QUCCMNQESA-N	0	3	348.462	3.087	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccc(C)cc1C	ZINC001110180878	1367549940	/nfs/dbraw/zinc/54/99/40/1367549940.db2.gz	GMMIDTKSTQHWLC-AABGKKOBSA-N	0	3	342.483	3.118	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccc(C)c(C)c1	ZINC001110184365	1367552952	/nfs/dbraw/zinc/55/29/52/1367552952.db2.gz	GZEXXLFCYMZWKE-LMCOJAPRSA-N	0	3	342.483	3.116	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C1(CCc3ccccc3)CC1)C2	ZINC001110222124	1367574253	/nfs/dbraw/zinc/57/42/53/1367574253.db2.gz	ADNYTTZICKWFPK-AABGKKOBSA-N	0	3	336.479	3.144	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](N(C)CCOc2cccc(C)c2)C1	ZINC001191868635	1367621969	/nfs/dbraw/zinc/62/19/69/1367621969.db2.gz	XFLBDEQWHNRGPF-LJQANCHMSA-N	0	3	342.483	3.100	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@H](N(C)Cc2cccc(OC)c2)C1	ZINC001191911254	1367635761	/nfs/dbraw/zinc/63/57/61/1367635761.db2.gz	DCDQDGPWWZADJK-WMZOPIPTSA-N	0	3	330.472	3.330	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)CCCc2ccc(C)cc2)C1	ZINC001192152128	1367701705	/nfs/dbraw/zinc/70/17/05/1367701705.db2.gz	FPDJYWJYRRTNTB-HXUWFJFHSA-N	0	3	344.499	3.053	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H](N(C)CCOc2ccccc2F)C1	ZINC001192160232	1367704321	/nfs/dbraw/zinc/70/43/21/1367704321.db2.gz	CBPHTVPMNVNSIL-JXFKEZNVSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](N(C)Cc3cccc(C#N)c3)C2)CCC1	ZINC001192217038	1367720408	/nfs/dbraw/zinc/72/04/08/1367720408.db2.gz	BTNFTOPHDSJRMQ-IBGZPJMESA-N	0	3	337.467	3.337	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](N(C)C[C@@H](OC)c3ccccc3)C2)C1	ZINC001192257403	1367733270	/nfs/dbraw/zinc/73/32/70/1367733270.db2.gz	ODAABEMFVRWKNH-RBUKOAKNSA-N	0	3	342.483	3.263	20	30		EGEDHN
C=CCOCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccccc1C(C)C	ZINC001109071335	1367750221	/nfs/dbraw/zinc/75/02/21/1367750221.db2.gz	WWJOMQFQAPTQHS-HOJAQTOUSA-N	0	3	342.483	3.234	20	30		EGEDHN
CC(C)c1ccccc1CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](C)C#N)C2	ZINC001109087792	1367760294	/nfs/dbraw/zinc/76/02/94/1367760294.db2.gz	BYUVDFPNGICBNN-JZGRTCEGSA-N	0	3	325.456	3.191	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCCc1cccc(F)c1	ZINC001110533768	1367814270	/nfs/dbraw/zinc/81/42/70/1367814270.db2.gz	FSMJMJLAOBJZJS-AQNXPRMDSA-N	0	3	342.458	3.139	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)[C@H](c2ccccc2)C(C)C)C1	ZINC001192560641	1367816858	/nfs/dbraw/zinc/81/68/58/1367816858.db2.gz	RRECQFMVFITLDT-UXHICEINSA-N	0	3	344.499	3.162	20	30		EGEDHN
C=CCCOCCCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CC=C(C)C	ZINC001110559766	1367832802	/nfs/dbraw/zinc/83/28/02/1367832802.db2.gz	LBKZADFMYUWOBU-QRVBRYPASA-N	0	3	334.504	3.437	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)[C@@H](C)CC2CCCCC2)C1	ZINC001192641575	1367840796	/nfs/dbraw/zinc/84/07/96/1367840796.db2.gz	LNHHEFPPJXRPTO-HKUYNNGSSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)C[C@@H](C)C2CCCCC2)C1	ZINC001192800826	1367876915	/nfs/dbraw/zinc/87/69/15/1367876915.db2.gz	IYDXFDUTMYANLV-MJGOQNOKSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)C[C@@H](C)C2CCCCC2)C1	ZINC001192800823	1367877511	/nfs/dbraw/zinc/87/75/11/1367877511.db2.gz	IYDXFDUTMYANLV-IEBWSBKVSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CC1(CC(=O)N2CC[C@@H](N(C)CCOCC3CC3)C2)CCCCC1	ZINC001192826293	1367882971	/nfs/dbraw/zinc/88/29/71/1367882971.db2.gz	PKAUPDZVKABIRP-LJQANCHMSA-N	0	3	348.531	3.472	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C1(Cc3ccccc3)CCC1)C2	ZINC001110678348	1367921341	/nfs/dbraw/zinc/92/13/41/1367921341.db2.gz	VCZFLEFCRQNLIF-AQNXPRMDSA-N	0	3	336.479	3.144	20	30		EGEDHN
CC(C)C[C@H](C)C(=O)N1CC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001193099182	1367943370	/nfs/dbraw/zinc/94/33/70/1367943370.db2.gz	KJWSJVZYXACPPK-LPHOPBHVSA-N	0	3	327.472	3.273	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)[C@@H](CCC)c2ccccc2)C1	ZINC001193877895	1368137797	/nfs/dbraw/zinc/13/77/97/1368137797.db2.gz	JSNVXRDIRFGQQP-UXHICEINSA-N	0	3	344.499	3.306	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](C)Cc1ccccc1F)C2	ZINC001111021860	1368146027	/nfs/dbraw/zinc/14/60/27/1368146027.db2.gz	HBLITCVNPGAPJL-OPNNQBFTSA-N	0	3	330.447	3.302	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)[C@H](CC=C)c2ccccc2)C1	ZINC001194174364	1368198931	/nfs/dbraw/zinc/19/89/31/1368198931.db2.gz	RWPHVIFXGLEZSN-VQTJNVASSA-N	0	3	342.483	3.082	20	30		EGEDHN
C=CCOC(=O)N(C)C[C@@H]1CCCCN1Cc1ccc(OC)cc1	ZINC001194311558	1368229428	/nfs/dbraw/zinc/22/94/28/1368229428.db2.gz	RFEIBLDAFDAKAK-KRWDZBQOSA-N	0	3	332.444	3.304	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)[C@@]2(C)CCC(C)=C(C)C2)C1	ZINC001194360394	1368243249	/nfs/dbraw/zinc/24/32/49/1368243249.db2.gz	ZOISNUGWSSVCEN-ICSRJNTNSA-N	0	3	334.504	3.248	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](N(C)CCOCC3CCC3)C2)CCCC1	ZINC001194555542	1368285597	/nfs/dbraw/zinc/28/55/97/1368285597.db2.gz	NDXZWSBOCBLMBE-IBGZPJMESA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@H](C)c1ccc(OC)cc1)C2	ZINC001111439408	1368307487	/nfs/dbraw/zinc/30/74/87/1368307487.db2.gz	YLRZAORMMPSLGC-ZSXHRAQDSA-N	0	3	342.483	3.486	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1cc(C)ccc1C	ZINC001111482479	1368318845	/nfs/dbraw/zinc/31/88/45/1368318845.db2.gz	MCCOTKHOGYETBR-AQNXPRMDSA-N	0	3	342.483	3.118	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@@H](C)CC(C)C)C[C@@H](C)O2	ZINC001111552603	1368343647	/nfs/dbraw/zinc/34/36/47/1368343647.db2.gz	IWSZNLPYKSGVCY-ZWKOTPCHSA-N	0	3	336.520	3.327	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CCCN(Cc2cc(C)ccc2C)CC1	ZINC001195174726	1368393375	/nfs/dbraw/zinc/39/33/75/1368393375.db2.gz	RVLWSXJTXBEKFK-LJQANCHMSA-N	0	3	344.499	3.319	20	30		EGEDHN
C#CCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1c(C)nsc1C)C2	ZINC001111729857	1368432233	/nfs/dbraw/zinc/43/22/33/1368432233.db2.gz	HZABBHFBHDJUAO-LPHOPBHVSA-N	0	3	345.512	3.034	20	30		EGEDHN
Cc1cc(C#N)cc(C(=O)N2CCN(CC3CCCCC3)CC2)c1	ZINC001195402229	1368432839	/nfs/dbraw/zinc/43/28/39/1368432839.db2.gz	VEDZMIUHTJWCSC-UHFFFAOYSA-N	0	3	325.456	3.205	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)C(C2CCC2)C2CCC2)C1	ZINC001195634046	1368462660	/nfs/dbraw/zinc/46/26/60/1368462660.db2.gz	NRWUPSORTVWFAG-RTBURBONSA-N	0	3	348.531	3.111	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H](C)OC2CCCCCC2)C1	ZINC001111867300	1368515661	/nfs/dbraw/zinc/51/56/61/1368515661.db2.gz	FMLPYJVFZCLRRK-UWVAXJGDSA-N	0	3	334.504	3.271	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H](CC)Oc2cccc(C)c2)C1	ZINC001111899017	1368543637	/nfs/dbraw/zinc/54/36/37/1368543637.db2.gz	AJMYBMDEJGYSGZ-CUWPLCDZSA-N	0	3	342.483	3.309	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2n[nH]c3c2CCCC3)CC1	ZINC001196395571	1368606383	/nfs/dbraw/zinc/60/63/83/1368606383.db2.gz	UJZFFRKLPKYVDN-UHFFFAOYSA-N	0	3	346.519	3.407	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2ccc(OC)nc2)CC1	ZINC001196454918	1368618210	/nfs/dbraw/zinc/61/82/10/1368618210.db2.gz	PKBVDWCZNDGHJK-UHFFFAOYSA-N	0	3	333.476	3.209	20	30		EGEDHN
CC#CCCCC(=O)N1CCCN(Cc2ccc3cc[nH]c3c2)CC1	ZINC001196838887	1368695350	/nfs/dbraw/zinc/69/53/50/1368695350.db2.gz	MDPGVVQOYUFPCH-UHFFFAOYSA-N	0	3	337.467	3.396	20	30		EGEDHN
C=CCC[C@H](C)N1CCCN(C(=O)c2sccc2COC)CC1	ZINC001197809604	1368903835	/nfs/dbraw/zinc/90/38/35/1368903835.db2.gz	CSRVBKBQQLXVCC-HNNXBMFYSA-N	0	3	336.501	3.397	20	30		EGEDHN
CC#CCCCC(=O)N1C[C@@H]2CCC[C@]2(CNCc2cscn2)C1	ZINC001112513819	1368908830	/nfs/dbraw/zinc/90/88/30/1368908830.db2.gz	RECVTWCDRVKFQO-LPHOPBHVSA-N	0	3	345.512	3.055	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@@H]2CCC[C@]2(CNCc2cc(C)no2)C1	ZINC001112514944	1368908881	/nfs/dbraw/zinc/90/88/81/1368908881.db2.gz	PEMMRNRVJJJTBN-ZWOKBUDYSA-N	0	3	345.487	3.304	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@H](C)c2ccc(C)cc2)C1	ZINC001197859205	1368914933	/nfs/dbraw/zinc/91/49/33/1368914933.db2.gz	JSPIEWTVDNETBI-MISYRCLQSA-N	0	3	346.515	3.230	20	30		EGEDHN
CCCCCCCCC(=O)N[C@@H]1CN(CCCC(C)C)C[C@H]1O	ZINC001198080330	1368956347	/nfs/dbraw/zinc/95/63/47/1368956347.db2.gz	DWXIQJVSXJTNRT-QZTJIDSGSA-N	0	3	326.525	3.335	20	30		EGEDHN
C=CCCOCCCCC(=O)N1CCN(C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1	ZINC001112851105	1369045390	/nfs/dbraw/zinc/04/53/90/1369045390.db2.gz	VESZTSSLXBYNMP-AQNXPRMDSA-N	0	3	348.531	3.330	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)c1ccco1)c1ccccc1OC	ZINC001198499914	1369047179	/nfs/dbraw/zinc/04/71/79/1369047179.db2.gz	TYVZXEWDXMAADN-INIZCTEOSA-N	0	3	328.412	3.315	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)C[C@H]1C=CCC1)c1ccccc1OC	ZINC001198522328	1369051147	/nfs/dbraw/zinc/05/11/47/1369051147.db2.gz	JTKCTUYNXKWOKC-FUHWJXTLSA-N	0	3	328.456	3.375	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)/C=C\C1CC1)c1ccccc1OC	ZINC001198637668	1369079098	/nfs/dbraw/zinc/07/90/98/1369079098.db2.gz	SHAOIVZROYARAL-MENFKHAKSA-N	0	3	328.456	3.375	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)CC[C@@H](C)OC)c1ccccc1OC	ZINC001198677395	1369088511	/nfs/dbraw/zinc/08/85/11/1369088511.db2.gz	MVEFUBJGMFAXAP-SJLPKXTDSA-N	0	3	348.487	3.223	20	30		EGEDHN
COc1ccccc1[C@@H](CNC(=O)C#CC(C)C)NCC1CC(C)C1	ZINC001198713098	1369097388	/nfs/dbraw/zinc/09/73/88/1369097388.db2.gz	MUHMTWXIWQMRFN-FAFZWHIHSA-N	0	3	342.483	3.148	20	30		EGEDHN
COc1ccccc1[C@H](CNC(=O)C#CC1CC1)NCCC(C)(C)C	ZINC001198723873	1369099469	/nfs/dbraw/zinc/09/94/69/1369099469.db2.gz	LQEUTAVCZGERGQ-SFHVURJKSA-N	0	3	342.483	3.292	20	30		EGEDHN
C=CCC[C@@H](C)N[C@@H](CNC(=O)c1cc[nH]c1)c1ccccc1OC	ZINC001198743467	1369103535	/nfs/dbraw/zinc/10/35/35/1369103535.db2.gz	ZLZROPSTMNSCEN-QAPCUYQASA-N	0	3	341.455	3.439	20	30		EGEDHN
C#CCC1(C(=O)NC[C@@H](NCCC)c2ccccc2OC)CCC1	ZINC001198752509	1369105468	/nfs/dbraw/zinc/10/54/68/1369105468.db2.gz	QWLGQTYPTAUGAV-QGZVFWFLSA-N	0	3	328.456	3.046	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)[C@H]1C[C@H]2C[C@H]2C1)c1ccccc1OC	ZINC001198857580	1369132198	/nfs/dbraw/zinc/13/21/98/1369132198.db2.gz	RPXXWCHYLGEWHZ-VUHPKUFZSA-N	0	3	342.483	3.454	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@@H](NCCCOC)c1ccccc1OC	ZINC001198857710	1369132230	/nfs/dbraw/zinc/13/22/30/1369132230.db2.gz	WHALFHHNKFQGMT-FUHWJXTLSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)CC(C)(F)F)c1ccccc1OC	ZINC001198886018	1369140395	/nfs/dbraw/zinc/14/03/95/1369140395.db2.gz	WXXZHSHEKYILTF-CQSZACIVSA-N	0	3	326.387	3.064	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@@H]1C[C@H]1C1CCC1)c1ccccc1OC	ZINC001198932996	1369151770	/nfs/dbraw/zinc/15/17/70/1369151770.db2.gz	WUBQIYCRQCYYHS-OTWHNJEPSA-N	0	3	342.483	3.454	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)Cc2ccc3cnccc3c2)CC1	ZINC001113095650	1369199220	/nfs/dbraw/zinc/19/92/20/1369199220.db2.gz	XRPJXGFGUMRIQM-KRWDZBQOSA-N	0	3	337.467	3.276	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001199883549	1369284125	/nfs/dbraw/zinc/28/41/25/1369284125.db2.gz	KSQAVMIBYSLDEL-CQSZACIVSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=CCCC(=O)N1CCCO[C@H](CNCc2ccc(Cl)s2)C1	ZINC001200084782	1369314458	/nfs/dbraw/zinc/31/44/58/1369314458.db2.gz	ZQXGUNBVWYIMOG-CYBMUJFWSA-N	0	3	342.892	3.075	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCCO[C@H](CNCc2ccccc2F)C1	ZINC001201209668	1369496637	/nfs/dbraw/zinc/49/66/37/1369496637.db2.gz	CAQXXFLEZATZAG-FUHWJXTLSA-N	0	3	348.462	3.135	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCCO[C@@H](CNCc2ccccc2F)C1	ZINC001201209667	1369496850	/nfs/dbraw/zinc/49/68/50/1369496850.db2.gz	CAQXXFLEZATZAG-AEFFLSMTSA-N	0	3	348.462	3.135	20	30		EGEDHN
C=CCCCC(=O)N1CCCO[C@@H](CN[C@@H](C)c2ccccc2F)C1	ZINC001201284500	1369510224	/nfs/dbraw/zinc/51/02/24/1369510224.db2.gz	UZBWMPOITGZGDE-IRXDYDNUSA-N	0	3	348.462	3.450	20	30		EGEDHN
C#CCNC[C@H]1CN(C(=O)CCCCCCCCCC)CCCO1	ZINC001201932187	1369645443	/nfs/dbraw/zinc/64/54/43/1369645443.db2.gz	UCNUNXNGKMSZJA-IBGZPJMESA-N	0	3	336.520	3.358	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC(NCc2oc(CC)nc2C)CC1	ZINC001202122460	1369691579	/nfs/dbraw/zinc/69/15/79/1369691579.db2.gz	BRVQRDASFDKFHY-AWEZNQCLSA-N	0	3	333.476	3.228	20	30		EGEDHN
C#CCNC[C@@H]1CN(C(=O)[C@@H](C)CCCCCCCC)CCCO1	ZINC001202142566	1369700427	/nfs/dbraw/zinc/70/04/27/1369700427.db2.gz	XPFKWBKYWAYMRJ-RBUKOAKNSA-N	0	3	336.520	3.213	20	30		EGEDHN
CCCC(=O)N[C@@H]1C[C@@H](NCc2ccc(C#N)cc2F)C12CCC2	ZINC001202334310	1369741105	/nfs/dbraw/zinc/74/11/05/1369741105.db2.gz	BRAPAQKUMMZBNB-IAGOWNOFSA-N	0	3	329.419	3.014	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(NCc3ncc(C)s3)CC2)CCC1	ZINC001202371641	1369753247	/nfs/dbraw/zinc/75/32/47/1369753247.db2.gz	HGRNCGDNOBQHGZ-UHFFFAOYSA-N	0	3	333.501	3.279	20	30		EGEDHN
CC(C)CCC(=O)N[C@@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202448536	1369775102	/nfs/dbraw/zinc/77/51/02/1369775102.db2.gz	RICCTUCDSMQMEF-WOJBJXKFSA-N	0	3	338.495	3.491	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@H](NC(=O)C(CC)CC)C12CCC2	ZINC001202520711	1369797854	/nfs/dbraw/zinc/79/78/54/1369797854.db2.gz	KLDOSEOENJSWSZ-KGLIPLIRSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C12CCC2	ZINC001202598509	1369818463	/nfs/dbraw/zinc/81/84/63/1369818463.db2.gz	GZRSRBPPKGBDAR-MSOLQXFVSA-N	0	3	341.430	3.181	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@@H](NCc2oc(CC)nc2C)C12CCC2	ZINC001202615949	1369825206	/nfs/dbraw/zinc/82/52/06/1369825206.db2.gz	CCRLXLQYGDXSAL-CVEARBPZSA-N	0	3	331.460	3.029	20	30		EGEDHN
C=CCOCC(=O)N[C@H]1C[C@H](NCc2ccccc2Cl)C12CCC2	ZINC001202633690	1369831974	/nfs/dbraw/zinc/83/19/74/1369831974.db2.gz	PCBWVAOXIIVRIU-IRXDYDNUSA-N	0	3	348.874	3.060	20	30		EGEDHN
C=CCOCC(=O)N[C@@H]1C[C@H](NCc2ccccc2Cl)C12CCC2	ZINC001202633688	1369832077	/nfs/dbraw/zinc/83/20/77/1369832077.db2.gz	PCBWVAOXIIVRIU-DLBZAZTESA-N	0	3	348.874	3.060	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC(NCC(=C)Br)CC1	ZINC001202693634	1369853301	/nfs/dbraw/zinc/85/33/01/1369853301.db2.gz	AFGNOPOMUZWFHO-UHFFFAOYSA-N	0	3	329.282	3.078	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC(NCc2ccncc2Cl)CC1	ZINC001202694889	1369854407	/nfs/dbraw/zinc/85/44/07/1369854407.db2.gz	USLZMHJVICYDHO-UHFFFAOYSA-N	0	3	335.879	3.418	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1[C@H]2CN(CC[C@@H]3CC3(Cl)Cl)C[C@H]21	ZINC001114340293	1369900736	/nfs/dbraw/zinc/90/07/36/1369900736.db2.gz	DMTZQBWQXHMTIP-CXTNEJHOSA-N	0	3	345.314	3.219	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1C[C@H](NCc2nc(C)c(C)s2)C12CCC2	ZINC001202844800	1369906016	/nfs/dbraw/zinc/90/60/16/1369906016.db2.gz	AAXXEUWFZMLMSX-HOTGVXAUSA-N	0	3	345.512	3.080	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1C[C@H](NCc2cnoc2C)C12CCC2	ZINC001202970740	1369942356	/nfs/dbraw/zinc/94/23/56/1369942356.db2.gz	ZBGJIVLNZWVVSV-JKSUJKDBSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1C[C@H](NCc2ccc(F)cn2)C12CCC2	ZINC001202988231	1369947411	/nfs/dbraw/zinc/94/74/11/1369947411.db2.gz	RKKKEBMWMGWPQT-IRXDYDNUSA-N	0	3	331.435	3.094	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)COC2CCCCC2)C12CCC2	ZINC001203122915	1369989835	/nfs/dbraw/zinc/98/98/35/1369989835.db2.gz	LVQGJUBPINBQQJ-HZPDHXFCSA-N	0	3	340.895	3.105	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1[C@H]2CN(CCOc3ccc(C)cc3)C[C@H]21	ZINC001114720111	1370044595	/nfs/dbraw/zinc/04/45/95/1370044595.db2.gz	QNQQNLXMCUCYQJ-RBAQFSTRSA-N	0	3	342.483	3.023	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1C[C@H](NCc2cnoc2C)C12CCC2	ZINC001203259547	1370046037	/nfs/dbraw/zinc/04/60/37/1370046037.db2.gz	XJCOWOUQEFEYGY-JKSUJKDBSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1[C@H]2CN(CCOC3CCCCCC3)C[C@H]21	ZINC001114724575	1370047332	/nfs/dbraw/zinc/04/73/32/1370047332.db2.gz	PGARRUDJKLAHPI-IJXRJRJASA-N	0	3	348.531	3.375	20	30		EGEDHN
Cc1cocc1C(=O)N[C@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001203266896	1370050727	/nfs/dbraw/zinc/05/07/27/1370050727.db2.gz	WRAJBCONWOUVJQ-PMACEKPBSA-N	0	3	348.446	3.270	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1[C@H]2CN(Cc3cccc(OC)c3C)C[C@H]21	ZINC001114729593	1370051572	/nfs/dbraw/zinc/05/15/72/1370051572.db2.gz	VFYMRGCPNVCUQP-DZKDUJFISA-N	0	3	342.483	3.152	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1[C@H]2CN(Cc3ccc(OC)c(C)c3)C[C@H]21	ZINC001114729474	1370051678	/nfs/dbraw/zinc/05/16/78/1370051678.db2.gz	SFDSFKHQWWZMDW-DZKDUJFISA-N	0	3	342.483	3.152	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1[C@H]2CN(CCOc3cccc(Cl)c3)C[C@H]21	ZINC001114760053	1370065499	/nfs/dbraw/zinc/06/54/99/1370065499.db2.gz	SSXXLYORLJXRAB-DZFIZOCASA-N	0	3	348.874	3.122	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1C[C@H](NCc2ocnc2C)C12CCC2	ZINC001203297038	1370070379	/nfs/dbraw/zinc/07/03/79/1370070379.db2.gz	WNWNONDXOQTBQJ-ZWKOTPCHSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1[C@H]2CN(CCc3ccccc3F)C[C@H]21	ZINC001114791658	1370082921	/nfs/dbraw/zinc/08/29/21/1370082921.db2.gz	INABQQFSIJZFQC-NDUPCHFUSA-N	0	3	330.447	3.017	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1C[C@H](NCc2oc(CC)nc2C)C12CCC2	ZINC001203338624	1370088899	/nfs/dbraw/zinc/08/88/99/1370088899.db2.gz	CKXXZPJFTZEYLF-IRXDYDNUSA-N	0	3	345.487	3.419	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2C[C@H](NCC#Cc3ccccc3)C23CCC3)C1	ZINC001203375085	1370104237	/nfs/dbraw/zinc/10/42/37/1370104237.db2.gz	OCUZESXVMDFBBV-VQTJNVASSA-N	0	3	348.490	3.411	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1C[C@@H](NCc2oc(C)nc2C)C12CCC2	ZINC001203451604	1370131255	/nfs/dbraw/zinc/13/12/55/1370131255.db2.gz	KCTGMZLLGGGYCI-SJORKVTESA-N	0	3	345.487	3.411	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1C[C@H](NCc2ocnc2C)C12CCC2	ZINC001203451030	1370131544	/nfs/dbraw/zinc/13/15/44/1370131544.db2.gz	HQQUDMSJTBGUDM-HOTGVXAUSA-N	0	3	331.460	3.102	20	30		EGEDHN
CCCCCCCCC(=O)N1CCC(NCc2nccn2C)CC1	ZINC001203467947	1370136321	/nfs/dbraw/zinc/13/63/21/1370136321.db2.gz	JXXTWQRYERITSJ-UHFFFAOYSA-N	0	3	334.508	3.251	20	30		EGEDHN
CCCCCCCCC(=O)N1CCC(NCc2ccn(C)n2)CC1	ZINC001203468275	1370136415	/nfs/dbraw/zinc/13/64/15/1370136415.db2.gz	MHZXEJYTVSMNFH-UHFFFAOYSA-N	0	3	334.508	3.251	20	30		EGEDHN
COc1ccc(C[N@@H+]2CCC[C@@H](Oc3ccc(C#N)cc3)C2)c([O-])c1	ZINC001203635164	1370195391	/nfs/dbraw/zinc/19/53/91/1370195391.db2.gz	MEPVBLAVHAOJIU-LJQANCHMSA-N	0	3	338.407	3.316	20	30		EGEDHN
COc1ccc(C[N@H+]2CCC[C@@H](Oc3ccc(C#N)cc3)C2)c([O-])c1	ZINC001203635164	1370195394	/nfs/dbraw/zinc/19/53/94/1370195394.db2.gz	MEPVBLAVHAOJIU-LJQANCHMSA-N	0	3	338.407	3.316	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(NCc3ccn(CC)n3)CC2)CCCC1	ZINC001204157186	1370393233	/nfs/dbraw/zinc/39/32/33/1370393233.db2.gz	PGMBORLSTIPGJX-UHFFFAOYSA-N	0	3	344.503	3.120	20	30		EGEDHN
CC(C)C#CC(=O)NCC1(NCc2ccccc2F)CCCCC1	ZINC001115521735	1370520707	/nfs/dbraw/zinc/52/07/07/1370520707.db2.gz	AHKNALUSADPLTG-UHFFFAOYSA-N	0	3	330.447	3.394	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccnn2C(C)C)CCCCC1	ZINC001115554411	1370551353	/nfs/dbraw/zinc/55/13/53/1370551353.db2.gz	DKLPBAJXUQXUAG-UHFFFAOYSA-N	0	3	338.883	3.239	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H](C)[C@@H](C)COC)CCCCC1	ZINC001115567529	1370568116	/nfs/dbraw/zinc/56/81/16/1370568116.db2.gz	KRSHONUVQYEKNF-DZGCQCFKSA-N	0	3	330.900	3.066	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCC1(NCc2nccnc2C)CCCCC1	ZINC001115679618	1370662617	/nfs/dbraw/zinc/66/26/17/1370662617.db2.gz	KMGJUHWZZOHNRS-CVEARBPZSA-N	0	3	344.503	3.152	20	30		EGEDHN
CC#CCCCC(=O)NCC1(NCc2oc(C)nc2C)CCCCC1	ZINC001115679666	1370662802	/nfs/dbraw/zinc/66/28/02/1370662802.db2.gz	MDUAKEOCTNKNTH-UHFFFAOYSA-N	0	3	345.487	3.394	20	30		EGEDHN
CC/C(C)=C\C(=O)N1CCC(CNCc2ccccc2C#N)CC1	ZINC001205202125	1370677677	/nfs/dbraw/zinc/67/76/77/1370677677.db2.gz	BTHRAUPBYQVCAH-VBKFSLOCSA-N	0	3	325.456	3.243	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)/C=C\C2CC2)CC[C@H]1c1ccc(F)cc1	ZINC001205262883	1370699680	/nfs/dbraw/zinc/69/96/80/1370699680.db2.gz	FJIWSNCOPFNXEE-RNDZGNHASA-N	0	3	340.442	3.089	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ocnc2C(F)F)CCCCC1	ZINC001115733219	1370716536	/nfs/dbraw/zinc/71/65/36/1370716536.db2.gz	UKSBRXUOCKZJMO-UHFFFAOYSA-N	0	3	347.793	3.387	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N1C[C@@H](c2cccc(F)c2)[C@H](NCC#CC)C1	ZINC001205427292	1370751426	/nfs/dbraw/zinc/75/14/26/1370751426.db2.gz	WNARLKXCFHVSIP-MKJCWTSCSA-N	0	3	340.442	3.255	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C2(CCCC)CC2)C[C@H]1c1cccc(F)c1	ZINC001205432329	1370753177	/nfs/dbraw/zinc/75/31/77/1370753177.db2.gz	KXTCTBNHTSASBL-RBUKOAKNSA-N	0	3	342.458	3.313	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C(C)(C)CCC)C[C@H]1c1cccc(F)c1	ZINC001205432108	1370753520	/nfs/dbraw/zinc/75/35/20/1370753520.db2.gz	CVTRMORQTMDSIB-ZWKOTPCHSA-N	0	3	330.447	3.169	20	30		EGEDHN
CCCCCCCCCC(=O)N1CC[C@@H](NCc2cnn(C)c2)C1	ZINC001187367348	1388099784	/nfs/dbraw/zinc/09/97/84/1388099784.db2.gz	MXXKZIAHPFOGGQ-GOSISDBHSA-N	0	3	334.508	3.251	20	30		EGEDHN
C[C@@H](C#N)C(=O)N[C@@H]1CN(Cc2ccc(C3CCC3)cc2)C[C@H]1C	ZINC001206659169	1371124228	/nfs/dbraw/zinc/12/42/28/1371124228.db2.gz	DWUSHQVUOGIQEX-QMTMVMCOSA-N	0	3	325.456	3.050	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CN(Cc2ccc(CF)cc2)C[C@H]1C	ZINC001206884899	1371205881	/nfs/dbraw/zinc/20/58/81/1371205881.db2.gz	LAWDDNLXATVFRC-VQIMIIECSA-N	0	3	330.447	3.286	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CN(Cc2ccc3c(c2)CCC3)C[C@H]1C	ZINC001206884828	1371205906	/nfs/dbraw/zinc/20/59/06/1371205906.db2.gz	HOXKAKAVUCDETK-DYESRHJHSA-N	0	3	338.495	3.305	20	30		EGEDHN
C=CCN(CCN1CC[C@@H](c2cccnc2)C1)C(=O)OC(C)(C)C	ZINC001207205775	1371328712	/nfs/dbraw/zinc/32/87/12/1371328712.db2.gz	NXLNBTBTXFIQQV-QGZVFWFLSA-N	0	3	331.460	3.294	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN(C[C@H](OC)c2ccccc2)C[C@H]1C	ZINC001207215235	1371331465	/nfs/dbraw/zinc/33/14/65/1371331465.db2.gz	DNPQQTBPAUONCS-QRQLOZEOSA-N	0	3	330.472	3.167	20	30		EGEDHN
CC(C)(C)/C=C\C(=O)N1CCC[C@@H](NCc2ccc(C#N)s2)C1	ZINC001207710956	1371482230	/nfs/dbraw/zinc/48/22/30/1371482230.db2.gz	VELVERJPVFTAQK-QIAWRQBBSA-N	0	3	331.485	3.303	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207718460	1371485346	/nfs/dbraw/zinc/48/53/46/1371485346.db2.gz	QMBHKCZTZVTNMM-APWZRJJASA-N	0	3	330.447	3.194	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001207764420	1371497859	/nfs/dbraw/zinc/49/78/59/1371497859.db2.gz	OUKDDPARBCHOJO-PWTCPNTCSA-N	0	3	330.859	3.238	20	30		EGEDHN
O=C(C=C1CCC1)N1CCC[C@@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207777399	1371501225	/nfs/dbraw/zinc/50/12/25/1371501225.db2.gz	PDEFZXLNPZQRKY-LJQANCHMSA-N	0	3	342.870	3.382	20	30		EGEDHN
O=C(C1=CCCC1)N1CCC[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001207789830	1371505235	/nfs/dbraw/zinc/50/52/35/1371505235.db2.gz	OPXKAIXKACKRFT-SFHVURJKSA-N	0	3	342.870	3.382	20	30		EGEDHN
Cc1cc(C(=O)N2CCC[C@@H](NCC#Cc3ccccc3)C2)oc1C	ZINC001207796049	1371505934	/nfs/dbraw/zinc/50/59/34/1371505934.db2.gz	OBDXJWWEWNTSIY-LJQANCHMSA-N	0	3	336.435	3.142	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H](C)C[C@H]2CCCO2)CCCCC1	ZINC001120226446	1371509292	/nfs/dbraw/zinc/50/92/92/1371509292.db2.gz	MCKMZIVREDNSQK-GOEBONIOSA-N	0	3	342.911	3.353	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H]2CCCC[C@@H]2OC)CCCCC1	ZINC001120226288	1371509329	/nfs/dbraw/zinc/50/93/29/1371509329.db2.gz	JEMVLHKFBJDRJQ-CVEARBPZSA-N	0	3	342.911	3.353	20	30		EGEDHN
CC/C(C)=C\C(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001208002982	1371564808	/nfs/dbraw/zinc/56/48/08/1371564808.db2.gz	ZYQUEMRBBUNTHT-WLGQOEQESA-N	0	3	328.431	3.114	20	30		EGEDHN
C#CCOCCC(=O)N1CCC[C@@H](N[C@@H](C)c2ccccc2Cl)C1	ZINC001208029494	1371574344	/nfs/dbraw/zinc/57/43/44/1371574344.db2.gz	XKRFOMCVGSXABV-JKSUJKDBSA-N	0	3	348.874	3.022	20	30		EGEDHN
CC1(C(=O)N2CCC[C@@H](NCC#Cc3cccc(Cl)c3)C2)CC1	ZINC001208101840	1371595794	/nfs/dbraw/zinc/59/57/94/1371595794.db2.gz	XPAURCRJAPNGPQ-QGZVFWFLSA-N	0	3	330.859	3.072	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC[C@@H](NCc2cncc(C)c2)C1	ZINC001208193179	1371633429	/nfs/dbraw/zinc/63/34/29/1371633429.db2.gz	BXAHSZNZFXCSEB-LJQANCHMSA-N	0	3	327.472	3.239	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)c2csc3ccccc32)C1	ZINC001208207616	1371647572	/nfs/dbraw/zinc/64/75/72/1371647572.db2.gz	XIJQECAFPZOAEM-RHSMWYFYSA-N	0	3	344.480	3.154	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001208241290	1371675663	/nfs/dbraw/zinc/67/56/63/1371675663.db2.gz	VSNZQSDTEWVEIX-KRWDZBQOSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN(Cc2ccc3cc[nH]c3c2)C[C@H]1C	ZINC001208315140	1371712805	/nfs/dbraw/zinc/71/28/05/1371712805.db2.gz	MEEPUORWBLWOBA-RDTXWAMCSA-N	0	3	325.456	3.317	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN(CCOc2ccc(C)cc2)C[C@H]1C	ZINC001208318384	1371715080	/nfs/dbraw/zinc/71/50/80/1371715080.db2.gz	WCTCWBPFMUWRML-SJLPKXTDSA-N	0	3	330.472	3.023	20	30		EGEDHN
CC[C@H](CC(F)F)C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001208321923	1371717142	/nfs/dbraw/zinc/71/71/42/1371717142.db2.gz	NWJYANQYLBIWCI-QZTJIDSGSA-N	0	3	348.437	3.300	20	30		EGEDHN
C=CCCC(=O)NC1CC2(CC(NCc3csc([N+](=O)[O-])c3)C2)C1	ZINC001120787874	1371758938	/nfs/dbraw/zinc/75/89/38/1371758938.db2.gz	WKSKROSJLMILGR-UHFFFAOYSA-N	0	3	349.456	3.140	20	30		EGEDHN
C#CCCCCC(=O)NC1CC2(CC(NCc3ccccc3C#N)C2)C1	ZINC001120968264	1371824811	/nfs/dbraw/zinc/82/48/11/1371824811.db2.gz	HLKJWTQELFQGJF-UHFFFAOYSA-N	0	3	349.478	3.269	20	30		EGEDHN
CN(CCCc1ccc(C#N)cc1)C1CN(C(=O)OC(C)(C)C)C1	ZINC001208862937	1371923331	/nfs/dbraw/zinc/92/33/31/1371923331.db2.gz	TVTRMEHWHOIYRQ-UHFFFAOYSA-N	0	3	329.444	3.042	20	30		EGEDHN
CCOc1ccc(N2CCN(CCc3ccc(C#N)cc3)CC2)cc1	ZINC001208928464	1371949004	/nfs/dbraw/zinc/94/90/04/1371949004.db2.gz	CLCKNDGEVAQWTE-UHFFFAOYSA-N	0	3	335.451	3.322	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N1CCC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001209054140	1371984542	/nfs/dbraw/zinc/98/45/42/1371984542.db2.gz	YGVWWGBRVDUSER-PRWGNSRSSA-N	0	3	341.430	3.300	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CC2(CC(NCc3cc(C4CC4)no3)C2)C1	ZINC001121534320	1372002148	/nfs/dbraw/zinc/00/21/48/1372002148.db2.gz	DVHUZLWKYARJEL-UHFFFAOYSA-N	0	3	343.471	3.281	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001209147391	1372014785	/nfs/dbraw/zinc/01/47/85/1372014785.db2.gz	WRHUHCWSWUPXBL-YJBOKZPZSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=CCCCN1Cc2ccnn2C[C@@H](COCc2csc(C)n2)C1	ZINC001209161512	1372020370	/nfs/dbraw/zinc/02/03/70/1372020370.db2.gz	MFAFUNNQJFSAHH-INIZCTEOSA-N	0	3	346.500	3.263	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC1CC2(CC(NCc3nccn3CC)C2)C1	ZINC001121616175	1372025900	/nfs/dbraw/zinc/02/59/00/1372025900.db2.gz	CDOLQCUCUOCYLV-UEBDJUODSA-N	0	3	344.503	3.022	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC[C@H](NCc2ccnc(Cl)c2)C1	ZINC001209183063	1372028942	/nfs/dbraw/zinc/02/89/42/1372028942.db2.gz	LFGSSQAOGNHQJS-ZBFHGGJFSA-N	0	3	335.879	3.418	20	30		EGEDHN
O=C(c1cc[nH]c1C1CC1)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001209269530	1372055912	/nfs/dbraw/zinc/05/59/12/1372055912.db2.gz	JAQFBUDDKQCHMW-IBGZPJMESA-N	0	3	347.462	3.138	20	30		EGEDHN
C=CCCCCCCCN1CCCn2c(=O)cc(CN(C)C)nc2C1	ZINC001209439030	1372106487	/nfs/dbraw/zinc/10/64/87/1372106487.db2.gz	GFLTWRLGZYMAKZ-UHFFFAOYSA-N	0	3	346.519	3.037	20	30		EGEDHN
O=C(c1occc1Cl)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001209476332	1372116289	/nfs/dbraw/zinc/11/62/89/1372116289.db2.gz	UWYMEWOJDCXGRV-MRXNPFEDSA-N	0	3	342.826	3.179	20	30		EGEDHN
CCCC1(C(=O)N2CCC[C@@H](NCC#Cc3ccc(F)cc3)C2)CC1	ZINC001209537514	1372131567	/nfs/dbraw/zinc/13/15/67/1372131567.db2.gz	UJRAWMRREJHJCN-LJQANCHMSA-N	0	3	342.458	3.338	20	30		EGEDHN
Cn1nc2ccccc2c1CN1CCC[C@@H](Oc2ccc(C#N)cc2)C1	ZINC001209539378	1372131870	/nfs/dbraw/zinc/13/18/70/1372131870.db2.gz	JZRKOJCXSVVEGB-GOSISDBHSA-N	0	3	346.434	3.488	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CCCN(Cc3cncs3)C2)CC1	ZINC001209544673	1372132689	/nfs/dbraw/zinc/13/26/89/1372132689.db2.gz	GCZYJOHYFIFJOG-UHFFFAOYSA-N	0	3	335.473	3.144	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H]1C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001209716795	1372177054	/nfs/dbraw/zinc/17/70/54/1372177054.db2.gz	YLMXXZLMACRSKC-NJDAHSKKSA-N	0	3	338.495	3.301	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)CCCn1cccc1)C2	ZINC001122231747	1372207310	/nfs/dbraw/zinc/20/73/10/1372207310.db2.gz	WEXVVHRXYUHOAR-UHFFFAOYSA-N	0	3	335.879	3.038	20	30		EGEDHN
CCOc1ccc(C([O-])=C(C#N)C(=O)Nc2ccccc2Cl)cn1	ZINC001122415559	1372244515	/nfs/dbraw/zinc/24/45/15/1372244515.db2.gz	WSPYRKNEVSRAGD-LBPRGKRZSA-N	0	3	343.770	3.095	20	30		EGEDHN
CCOc1ccc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)cn1	ZINC001122415559	1372244521	/nfs/dbraw/zinc/24/45/21/1372244521.db2.gz	WSPYRKNEVSRAGD-LBPRGKRZSA-N	0	3	343.770	3.095	20	30		EGEDHN
N#CC(C(=O)C1CCSCC1)c1nccn1Cc1ccccc1	ZINC001122605736	1372282096	/nfs/dbraw/zinc/28/20/96/1372282096.db2.gz	AXCUHLKNVAVMRX-MRXNPFEDSA-N	0	3	325.437	3.251	20	30		EGEDHN
CC(C)C[C@H](C)C(=O)N1CCC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001210358751	1372331719	/nfs/dbraw/zinc/33/17/19/1372331719.db2.gz	NXIVEKXRQBSNBX-YJBOKZPZSA-N	0	3	345.462	3.460	20	30		EGEDHN
CCCCCCCCC(=O)N[C@@H]1CN(CCc2ccnn2C)C[C@H]1C	ZINC001210546834	1372375548	/nfs/dbraw/zinc/37/55/48/1372375548.db2.gz	AQHYXTDKKIWXKW-IEBWSBKVSA-N	0	3	348.535	3.150	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)c2ccc(C(C)C)cc2)C1	ZINC001210555484	1372377646	/nfs/dbraw/zinc/37/76/46/1372377646.db2.gz	XVLCLHNNAXMCKD-VQIMIIECSA-N	0	3	330.472	3.063	20	30		EGEDHN
CCc1c(C(=O)C(C#N)c2ncc(Cl)n2C)cnn1CCC(C)C	ZINC001123232891	1372403141	/nfs/dbraw/zinc/40/31/41/1372403141.db2.gz	DKGDSMQBYWBOIC-GFCCVEGCSA-N	0	3	347.850	3.369	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCc1ccc(OC)c(Cl)c1	ZINC001123232926	1372403381	/nfs/dbraw/zinc/40/33/81/1372403381.db2.gz	DWRANCHDTMAZHE-ZDUSSCGKSA-N	0	3	331.803	3.374	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CCOC(C)C)C[C@H]2C)CCCCC1	ZINC001211234871	1372508601	/nfs/dbraw/zinc/50/86/01/1372508601.db2.gz	AMSXBXNKXLZFTF-QZTJIDSGSA-N	0	3	336.520	3.375	20	30		EGEDHN
C#CCCN1C[C@@H](C)[C@H](NC(=O)[C@H](C)CCCc2ccccc2)C1	ZINC001211396937	1372550650	/nfs/dbraw/zinc/55/06/50/1372550650.db2.gz	GPPDGYTZXBMAIT-QWFCFKBJSA-N	0	3	326.484	3.105	20	30		EGEDHN
C=CCC[C@H](C(=O)N[C@@H]1CN(CCOCC)C[C@H]1C)c1ccccc1	ZINC001211495491	1372568420	/nfs/dbraw/zinc/56/84/20/1372568420.db2.gz	NVQFEMBIAOMBKC-YZGWKJHDSA-N	0	3	344.499	3.209	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2sccc2C)C[C@H]1c1ccccc1	ZINC001211516666	1372571452	/nfs/dbraw/zinc/57/14/52/1372571452.db2.gz	AWGGCXQAVCQMFL-ZWKOTPCHSA-N	0	3	338.476	3.278	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2ccoc2CC)C[C@H]1c1ccccc1	ZINC001211588042	1372586079	/nfs/dbraw/zinc/58/60/79/1372586079.db2.gz	CDIVCOWUBHQLIQ-RBUKOAKNSA-N	0	3	336.435	3.063	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C2(CC(C)C)CC2)C[C@H]1c1ccccc1	ZINC001211613530	1372591132	/nfs/dbraw/zinc/59/11/32/1372591132.db2.gz	TXUDWOFVBKYADY-VQTJNVASSA-N	0	3	338.495	3.420	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C2CC3(CCC3)C2)C[C@H]1c1ccccc1	ZINC001211655053	1372596691	/nfs/dbraw/zinc/59/66/91/1372596691.db2.gz	AEOGJXUYUCVGKZ-VQTJNVASSA-N	0	3	336.479	3.174	20	30		EGEDHN
C=CC[C@H](C(=O)N1CC[C@@H](NCc2cccnc2)C1)c1ccccc1	ZINC001188001681	1388209997	/nfs/dbraw/zinc/20/99/97/1388209997.db2.gz	ICNKBFNCEGYHIP-UXHICEINSA-N	0	3	335.451	3.132	20	30		EGEDHN
CC[C@@H](c1ccccc1)N1C[C@@H](NC(=O)C#CC(C)(C)C)[C@H](OC)C1	ZINC001212248409	1372679220	/nfs/dbraw/zinc/67/92/20/1372679220.db2.gz	CRTPLPRRUDPMMF-CEXWTWQISA-N	0	3	342.483	3.003	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CN(Cc2ccccc2CC)C[C@H]1OC	ZINC001212325207	1372686975	/nfs/dbraw/zinc/68/69/75/1372686975.db2.gz	RIMNCCHXFZGBSO-RTBURBONSA-N	0	3	344.499	3.167	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN([C@@H]2CCCc3ccccc32)C[C@H]1OC	ZINC001212344923	1372691492	/nfs/dbraw/zinc/69/14/92/1372691492.db2.gz	SJFKUNKZDGLRCC-VAMGGRTRSA-N	0	3	342.483	3.236	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)CCCC[C@@H](C)CC)[C@@H]2C1	ZINC001188043913	1388227433	/nfs/dbraw/zinc/22/74/33/1388227433.db2.gz	PHMUYPIQZHLRDG-GBESFXJTSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2cc[nH]c2C(C)C)[C@H](OC)C1	ZINC001213317307	1372882973	/nfs/dbraw/zinc/88/29/73/1372882973.db2.gz	DQUAVYNKTAFAKA-QZTJIDSGSA-N	0	3	347.503	3.314	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN([C@@H](CC)c2ccccc2)C[C@H]1OC	ZINC001213350576	1372889527	/nfs/dbraw/zinc/88/95/27/1372889527.db2.gz	VRRBHSZBXFMJAI-CEXWTWQISA-N	0	3	330.472	3.309	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)[C@@H](CC(C)C)c2ccccc2)[C@H](OC)C1	ZINC001213549127	1372924638	/nfs/dbraw/zinc/92/46/38/1372924638.db2.gz	CARXDNJQLTUSFM-XUVXKRRUSA-N	0	3	344.499	3.208	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2ccc3c(c2)CCC=C3)[C@H](OC)C1	ZINC001213734400	1372954144	/nfs/dbraw/zinc/95/41/44/1372954144.db2.gz	WLOKRYAVSCOMRN-WOJBJXKFSA-N	0	3	340.467	3.041	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)CCCc2cc(C)ccc2C)[C@H](OC)C1	ZINC001213895335	1372976225	/nfs/dbraw/zinc/97/62/25/1372976225.db2.gz	UKFFDICOBZNDCM-WOJBJXKFSA-N	0	3	344.499	3.018	20	30		EGEDHN
C=C[C@@H](C(=O)N[C@@H]1CN(CCCCCC)C[C@H]1OC)c1ccccc1	ZINC001213900326	1372977751	/nfs/dbraw/zinc/97/77/51/1372977751.db2.gz	XCFZZSVGXJBWGE-VAMGGRTRSA-N	0	3	344.499	3.352	20	30		EGEDHN
C=C[C@H](C(=O)N[C@@H]1CN(CC/C=C/CC)C[C@H]1OC)c1ccccc1	ZINC001213900214	1372978022	/nfs/dbraw/zinc/97/80/22/1372978022.db2.gz	VNAWFPQDRWLBCI-AHYCVCGYSA-N	0	3	342.483	3.128	20	30		EGEDHN
CC[C@@H](C)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001214158671	1373016906	/nfs/dbraw/zinc/01/69/06/1373016906.db2.gz	RIMAUVSNUHSTIG-IIDMSEBBSA-N	0	3	332.875	3.174	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@H](NCc2cc(OC)ccc2Cl)C1	ZINC001214304168	1373040668	/nfs/dbraw/zinc/04/06/68/1373040668.db2.gz	KFPBHOLUWUYCSK-CXAGYDPISA-N	0	3	336.863	3.251	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@@H](C)[C@H](NCc2ccc(F)c(F)c2)C1	ZINC001214466818	1373066716	/nfs/dbraw/zinc/06/67/16/1373066716.db2.gz	ZLOUEXXONORGNE-RDTXWAMCSA-N	0	3	334.410	3.095	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC(C)(C)C2CC2)C[C@H]1NCC#Cc1ccccc1	ZINC001214559431	1373080694	/nfs/dbraw/zinc/08/06/94/1373080694.db2.gz	IUTJQOBTEHIMRJ-YLJYHZDGSA-N	0	3	338.495	3.301	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001214727475	1373110368	/nfs/dbraw/zinc/11/03/68/1373110368.db2.gz	CDESNJPGLAZDSO-VQIMIIECSA-N	0	3	342.458	3.216	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001214727460	1373110478	/nfs/dbraw/zinc/11/04/78/1373110478.db2.gz	BIRHBORPGZDOCG-CZUORRHYSA-N	0	3	331.485	3.159	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NCCNCc1ccc(Cl)c(OC)c1	ZINC001128190474	1373232213	/nfs/dbraw/zinc/23/22/13/1373232213.db2.gz	RDRBOCGZLUSFTP-UHFFFAOYSA-N	0	3	345.270	3.333	20	30		EGEDHN
CCC(C)(CC)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2)C1	ZINC001216795908	1373343968	/nfs/dbraw/zinc/34/39/68/1373343968.db2.gz	ZQECQPDIXGMBGE-IEBWSBKVSA-N	0	3	326.484	3.301	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)c3ccsc3)[C@H]2C1	ZINC001217248478	1373410438	/nfs/dbraw/zinc/41/04/38/1373410438.db2.gz	INEDCSJJBNMKQZ-DLBZAZTESA-N	0	3	334.485	3.020	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)C/C=C\c2ccc(F)cc2)s1	ZINC001130172162	1373470096	/nfs/dbraw/zinc/47/00/96/1373470096.db2.gz	YQEUZJUVGLODGI-UPHRSURJSA-N	0	3	343.427	3.068	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)C[C@H](C)SC)[C@H]2C1	ZINC001217654970	1373482937	/nfs/dbraw/zinc/48/29/37/1373482937.db2.gz	NSZNBOKROYJHBR-YESZJQIVSA-N	0	3	342.549	3.010	20	30		EGEDHN
CC(C)=C[C@@H]1[C@H](C(=O)NCCNCc2ccc(F)c(C#N)c2)C1(C)C	ZINC001131087237	1373639325	/nfs/dbraw/zinc/63/93/25/1373639325.db2.gz	BFNCBMXZWKGBJJ-SJLPKXTDSA-N	0	3	343.446	3.142	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)C[C@@H](C)CC(C)(C)C)[C@H]2C1	ZINC001218682471	1373644068	/nfs/dbraw/zinc/64/40/68/1373644068.db2.gz	DVEZFECLKSDVSU-FGTMMUONSA-N	0	3	336.520	3.327	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)Nc1ccn(CC)c1C(=O)OCC	ZINC001218719110	1373647672	/nfs/dbraw/zinc/64/76/72/1373647672.db2.gz	WYBHPJQOMHJQSV-AWEZNQCLSA-N	0	3	335.448	3.087	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)CCCCCC(C)C)[C@H]2C1	ZINC001218737532	1373649265	/nfs/dbraw/zinc/64/92/65/1373649265.db2.gz	NDPWOPRZBCSMMY-RBUKOAKNSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)Nc1ccc(-c2nc(C)no2)cc1	ZINC001218954921	1373670565	/nfs/dbraw/zinc/67/05/65/1373670565.db2.gz	HHBJVKUUEYMHDJ-INIZCTEOSA-N	0	3	328.416	3.447	20	30		EGEDHN
C=C[C@@H](C(=O)N1CCO[C@@H]2CN(CCCCC)C[C@@H]21)c1ccccc1	ZINC001219043573	1373682746	/nfs/dbraw/zinc/68/27/46/1373682746.db2.gz	DFHIIZMIKYCOFN-HSALFYBXSA-N	0	3	342.483	3.058	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCO[C@H]1C1CCN(C(=O)CCC(C)C)CC1	ZINC001131418951	1373693173	/nfs/dbraw/zinc/69/31/73/1373693173.db2.gz	IAVRCYNXCKIUQJ-AEFFLSMTSA-N	0	3	342.911	3.161	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCO[C@H]1C1CCN(C(=O)C[C@H](C)CC)CC1	ZINC001131495772	1373711300	/nfs/dbraw/zinc/71/13/00/1373711300.db2.gz	DNKPUJOYKUNSFE-QBIMZIAESA-N	0	3	342.911	3.161	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)O[C@]2(CCN(Cc3cccc(C)c3)C2)C1	ZINC001131645161	1373741354	/nfs/dbraw/zinc/74/13/54/1373741354.db2.gz	BYNJRWXWRHVMAV-NQIIRXRSSA-N	0	3	342.483	3.153	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C(C)(C)CC(C)C)C[C@H](C)O2	ZINC001131691829	1373765630	/nfs/dbraw/zinc/76/56/30/1373765630.db2.gz	AMOADXYPXNGQFT-PXNSSMCTSA-N	0	3	336.520	3.327	20	30		EGEDHN
C#CCCN1CC[C@]2(C1)CN(C(=O)C(C)(C)CC(C)(C)C)C[C@H](C)O2	ZINC001131701156	1373770972	/nfs/dbraw/zinc/77/09/72/1373770972.db2.gz	PREIWORNPMRFIF-UWJYYQICSA-N	0	3	348.531	3.164	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)C[C@@H](OCC)C3=CCCC3)[C@@H]2C1	ZINC001221553195	1373780323	/nfs/dbraw/zinc/78/03/23/1373780323.db2.gz	WQQFLGWIUMDRKK-GUDVDZBRSA-N	0	3	332.488	3.001	20	30		EGEDHN
CCCCCCCN1CC[C@@H]2CN(C(=O)c3cnoc3CC)[C@@H]2C1	ZINC001221842066	1373795689	/nfs/dbraw/zinc/79/56/89/1373795689.db2.gz	UTFOQSXKSWXAFH-NVXWUHKLSA-N	0	3	333.476	3.354	20	30		EGEDHN
C=CCCCN1CC[C@@H]2CN(C(=O)c3sc(C)cc3OC)[C@@H]2C1	ZINC001221848386	1373797330	/nfs/dbraw/zinc/79/73/30/1373797330.db2.gz	MOPBEOFVIVUAES-HUUCEWRRSA-N	0	3	334.485	3.178	20	30		EGEDHN
Cc1ccc(CN2C[C@H](NC(=O)CSCC#N)CC[C@@H]2C)c(C)c1	ZINC001131830306	1373827589	/nfs/dbraw/zinc/82/75/89/1373827589.db2.gz	PSNCAIGOPFVNAD-FUHWJXTLSA-N	0	3	345.512	3.029	20	30		EGEDHN
CC/C=C(/C)C(=O)N1CC[C@H]2CCN(Cc3cccc(C#N)c3)[C@H]2C1	ZINC001222377534	1373827860	/nfs/dbraw/zinc/82/78/60/1373827860.db2.gz	CQAQUCULAWQLSY-YVFJBRIVSA-N	0	3	337.467	3.337	20	30		EGEDHN
CC[C@H](SC)C(=O)NCC1CCN(Cc2cccc(C#N)c2)CC1	ZINC001222856100	1373890826	/nfs/dbraw/zinc/89/08/26/1373890826.db2.gz	DABQGSSUWNVDCS-SFHVURJKSA-N	0	3	345.512	3.028	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC[C@@H](C)N(Cc2ccc(OC)c(C)c2)C1	ZINC001131894655	1375032879	/nfs/dbraw/zinc/03/28/79/1375032879.db2.gz	BALRJZMLWXJTCY-AEFFLSMTSA-N	0	3	330.472	3.439	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@H](C)N(Cc2cccc(N(C)C)c2)C1	ZINC001131900488	1375037218	/nfs/dbraw/zinc/03/72/18/1375037218.db2.gz	YUCPIRRTISVABX-FUHWJXTLSA-N	0	3	329.488	3.188	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H]2CCN(CCc3ccns3)[C@H]2C1	ZINC001223595121	1375040277	/nfs/dbraw/zinc/04/02/77/1375040277.db2.gz	SDWKRRQDHNYIMQ-WBVHZDCISA-N	0	3	347.528	3.211	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)CCCc3sccc3C)C[C@@H]21	ZINC001224008533	1375051292	/nfs/dbraw/zinc/05/12/92/1375051292.db2.gz	BENJSNGMZCZMEQ-MSOLQXFVSA-N	0	3	344.524	3.325	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N[C@@H]1CCCC[C@H]1NCC=C(Cl)Cl	ZINC001225246623	1375099101	/nfs/dbraw/zinc/09/91/01/1375099101.db2.gz	GDXMFOUAWLJWMD-MGPQQGTHSA-N	0	3	349.302	3.304	20	30		EGEDHN
CCc1ccccc1CCN1C[C@H](NC(=O)C#CC(C)C)CC[C@H]1C	ZINC001132022164	1375103431	/nfs/dbraw/zinc/10/34/31/1375103431.db2.gz	VTPYIJMBFSKJOL-WIYYLYMNSA-N	0	3	340.511	3.420	20	30		EGEDHN
Cc1cc(CN2C[C@@H](NC(=O)C#CC(C)C)CC[C@@H]2C)c(C)s1	ZINC001132025847	1375105640	/nfs/dbraw/zinc/10/56/40/1375105640.db2.gz	WLPVSHRXVKINFO-KSSFIOAISA-N	0	3	332.513	3.493	20	30		EGEDHN
Cc1cc(CN2C[C@H](NC(=O)C#CC3CC3)CC[C@H]2C)c(C)s1	ZINC001132034745	1375109822	/nfs/dbraw/zinc/10/98/22/1375109822.db2.gz	UTWPDWKICKYXNE-FZKQIMNGSA-N	0	3	330.497	3.247	20	30		EGEDHN
CC[C@@H](F)CN1CCC(CNC(=O)CC#Cc2ccccc2)CC1	ZINC001225525947	1375118558	/nfs/dbraw/zinc/11/85/58/1375118558.db2.gz	SRIXRMOASPTWDE-LJQANCHMSA-N	0	3	330.447	3.005	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1CC[C@@H](C)N(CCOCC2CC2)C1	ZINC001132056664	1375122449	/nfs/dbraw/zinc/12/24/49/1375122449.db2.gz	BDXXFLCKLAUXBO-VQIMIIECSA-N	0	3	334.504	3.151	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1CC[C@H](C)N(CCOC2CCC2)C1	ZINC001132057310	1375123218	/nfs/dbraw/zinc/12/32/18/1375123218.db2.gz	NAJPWFAOMIDZTB-FUHWJXTLSA-N	0	3	334.504	3.293	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCOc2cccc(C)c2C)CC[C@@H]1C	ZINC001132094148	1375142234	/nfs/dbraw/zinc/14/22/34/1375142234.db2.gz	HUYZTARMJUHKHI-FUHWJXTLSA-N	0	3	330.472	3.227	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)CCc2ccc(C)cc2)CC[C@H]1C	ZINC001132168618	1375182785	/nfs/dbraw/zinc/18/27/85/1375182785.db2.gz	FENKXMCBLVDKBW-UYAOXDASSA-N	0	3	344.499	3.099	20	30		EGEDHN
C=CCCCN1C[C@H](NC(=O)c2ocnc2C(F)(F)F)CC[C@@H]1C	ZINC001132195812	1375201595	/nfs/dbraw/zinc/20/15/95/1375201595.db2.gz	VWTRZNJAJFGWJX-NWDGAFQWSA-N	0	3	345.365	3.242	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1CC[C@H](C)N(CCOCCCC)C1	ZINC001132241102	1375236741	/nfs/dbraw/zinc/23/67/41/1375236741.db2.gz	QRDMOCIWVVGMMU-RBUKOAKNSA-N	0	3	336.520	3.356	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@H](C)OCc3ccccc3C)[C@@H]2C1	ZINC001188715439	1388366370	/nfs/dbraw/zinc/36/63/70/1388366370.db2.gz	RAHYFFAWDYORFJ-CMKODMSKSA-N	0	3	342.483	3.009	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2CC[C@H](C)N(CCOC3CCC3)C2)CC1	ZINC001132277112	1375260662	/nfs/dbraw/zinc/26/06/62/1375260662.db2.gz	BANVJMAETDPDFH-DLBZAZTESA-N	0	3	334.504	3.271	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC1CCN(Cc2ccc(C)cc2)CC1	ZINC001226455668	1375262476	/nfs/dbraw/zinc/26/24/76/1375262476.db2.gz	HICNKZQDDHVFEG-QGZVFWFLSA-N	0	3	330.472	3.057	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCN2CCC(Cc3ccccc3)CC2)cc1	ZINC001188735458	1388369953	/nfs/dbraw/zinc/36/99/53/1388369953.db2.gz	WKVJODHSPNAAES-UHFFFAOYSA-N	0	3	346.474	3.352	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCc2cc(Cl)cs2)CC[C@@H]1C	ZINC001132330391	1375310851	/nfs/dbraw/zinc/31/08/51/1375310851.db2.gz	GOKFOQLMMDEFPA-GXTWGEPZSA-N	0	3	326.893	3.489	20	30		EGEDHN
C=CCOCCCC(=O)NC1CCN([C@H](C)c2cccc(F)c2)CC1	ZINC001226778485	1375332349	/nfs/dbraw/zinc/33/23/49/1375332349.db2.gz	NTAYJSUKDVRCAW-MRXNPFEDSA-N	0	3	348.462	3.450	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCCOc2ccccc2)CC[C@@H]1C	ZINC001132464369	1375407591	/nfs/dbraw/zinc/40/75/91/1375407591.db2.gz	RSFSLYRZQXPQII-ZWKOTPCHSA-N	0	3	330.472	3.391	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCOc2ccccc2F)CC[C@H]1C	ZINC001132472113	1375411905	/nfs/dbraw/zinc/41/19/05/1375411905.db2.gz	BKTWRJVUJCKRJM-HZPDHXFCSA-N	0	3	334.435	3.140	20	30		EGEDHN
COc1cccc([C@@H](C)N2CCC(NC(=O)C#CC(C)(C)C)CC2)c1	ZINC001227290327	1375416568	/nfs/dbraw/zinc/41/65/68/1375416568.db2.gz	UOFHODYCLODSHQ-MRXNPFEDSA-N	0	3	342.483	3.386	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCOCc2ccccc2)CC[C@@H]1C	ZINC001132496612	1375425198	/nfs/dbraw/zinc/42/51/98/1375425198.db2.gz	LTFNSEPBWYMRFM-HKUYNNGSSA-N	0	3	330.472	3.139	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2cccc(C3CC3)c2)CC[C@H]1C	ZINC001132522972	1375439650	/nfs/dbraw/zinc/43/96/50/1375439650.db2.gz	VVKNWMSRFQQRNJ-OXQOHEQNSA-N	0	3	342.483	3.349	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)C23CC(C(C)(C)C)(C2)C3)CC[C@H]1C	ZINC001132525200	1375441271	/nfs/dbraw/zinc/44/12/71/1375441271.db2.gz	OYSOPKKHKOFGJR-FBIZOPLVSA-N	0	3	348.531	3.375	20	30		EGEDHN
C#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)/C(C)=C/CC)CC1	ZINC001132551936	1375457523	/nfs/dbraw/zinc/45/75/23/1375457523.db2.gz	OVPSETZVYLTLDO-KYSILRCISA-N	0	3	339.483	3.254	20	30		EGEDHN
C#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)C2(C)CCC2)CC1	ZINC001132554107	1375459627	/nfs/dbraw/zinc/45/96/27/1375459627.db2.gz	CCNWXIBLFMPMMM-LJQANCHMSA-N	0	3	339.483	3.088	20	30		EGEDHN
CC#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)CCC)CC1	ZINC001132555611	1375463320	/nfs/dbraw/zinc/46/33/20/1375463320.db2.gz	XHBKQULJBNPUJC-IBGZPJMESA-N	0	3	327.472	3.088	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](C)[C@@H](CNCc2nc(C)cs2)C1	ZINC001132864866	1375607907	/nfs/dbraw/zinc/60/79/07/1375607907.db2.gz	DGWHIVLRSQVQMV-HOCLYGCPSA-N	0	3	335.517	3.382	20	30		EGEDHN
CC#CCCCC(=O)NC1CCN(Cc2ccc3c(c2)CCC3)CC1	ZINC001228719257	1375651881	/nfs/dbraw/zinc/65/18/81/1375651881.db2.gz	XVCHVOFOISXKMZ-UHFFFAOYSA-N	0	3	338.495	3.450	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NC1CCN(CCOc2cccc(C)c2)CC1	ZINC001228748879	1375661961	/nfs/dbraw/zinc/66/19/61/1375661961.db2.gz	NXEHBIFZNKALFA-QZTJIDSGSA-N	0	3	344.499	3.413	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NC1CCN(Cc2ccc(OC)cc2)CC1	ZINC001228750233	1375663620	/nfs/dbraw/zinc/66/36/20/1375663620.db2.gz	YAEPAFCAXKOBHD-HZPDHXFCSA-N	0	3	330.472	3.234	20	30		EGEDHN
C=CCCCC(=O)NC1CCN(Cc2ccc(OC)c(C)c2)CC1	ZINC001228927859	1375718330	/nfs/dbraw/zinc/71/83/30/1375718330.db2.gz	NHFSWHRZPRKDRS-UHFFFAOYSA-N	0	3	330.472	3.441	20	30		EGEDHN
C=CCC1(C(=O)NC2CCN(CCOc3ccccc3)CC2)CCC1	ZINC001229025349	1375742515	/nfs/dbraw/zinc/74/25/15/1375742515.db2.gz	YQKBOFPUSABWSD-UHFFFAOYSA-N	0	3	342.483	3.392	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](C)[C@@H](CNCc3nccs3)C2)CC1	ZINC001133105516	1375778828	/nfs/dbraw/zinc/77/88/28/1375778828.db2.gz	UTQCPXFUYMWIOB-CVEARBPZSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](C)[C@@H](CNCc2nccn2CC)C1	ZINC001133142865	1375803768	/nfs/dbraw/zinc/80/37/68/1375803768.db2.gz	PSGIMDYFWKENGR-SJORKVTESA-N	0	3	346.519	3.080	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)[C@H](C)c2ccc(CC)cc2)CC1	ZINC001229616858	1375865872	/nfs/dbraw/zinc/86/58/72/1375865872.db2.gz	UUTWJYVJHBSKFC-QGZVFWFLSA-N	0	3	344.499	3.136	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2cccc(C)c2Cl)CC1	ZINC001229670883	1375874837	/nfs/dbraw/zinc/87/48/37/1375874837.db2.gz	OYMGOZHJYJSFPB-UHFFFAOYSA-N	0	3	336.863	3.045	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CCCC[C@H]2NCC(=C)Cl)CCOCC1	ZINC001229969454	1375924240	/nfs/dbraw/zinc/92/42/40/1375924240.db2.gz	APJKKAWHJKGXGH-HZPDHXFCSA-N	0	3	340.895	3.129	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)C[C@H](CC)c2ccccc2)CC1	ZINC001230017022	1375931436	/nfs/dbraw/zinc/93/14/36/1375931436.db2.gz	SISDFBVHBISDBL-SFHVURJKSA-N	0	3	344.499	3.354	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2oc3ccccc3c2C)CC1	ZINC001230184271	1375956858	/nfs/dbraw/zinc/95/68/58/1375956858.db2.gz	ASVLSEVMTIBHBH-UHFFFAOYSA-N	0	3	342.439	3.138	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)/C=C/c1ccco1	ZINC001133377488	1375958487	/nfs/dbraw/zinc/95/84/87/1375958487.db2.gz	VBRYBHOLLVCJKI-CMDGGOBGSA-N	0	3	342.826	3.198	20	30		EGEDHN
CC(=O)N(CCNCc1cccc(C#N)c1)Cc1cccc(Cl)c1	ZINC001133379958	1375961810	/nfs/dbraw/zinc/96/18/10/1375961810.db2.gz	PGWSQNSCVUKSEH-UHFFFAOYSA-N	0	3	341.842	3.350	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)Cc1ccc(C)o1	ZINC001133393015	1375978762	/nfs/dbraw/zinc/97/87/62/1375978762.db2.gz	XYCUQDLOPWDHRG-UHFFFAOYSA-N	0	3	344.842	3.036	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@H](C)CC(F)F	ZINC001133399498	1375984467	/nfs/dbraw/zinc/98/44/67/1375984467.db2.gz	QGBVLVGQRQBRSS-CYBMUJFWSA-N	0	3	342.817	3.183	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C1(C(C)C)CC1	ZINC001133403646	1375988091	/nfs/dbraw/zinc/98/80/91/1375988091.db2.gz	CBQMLRVZAZMHRE-UHFFFAOYSA-N	0	3	332.875	3.328	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H]1CC12CCC2	ZINC001133405693	1375991125	/nfs/dbraw/zinc/99/11/25/1375991125.db2.gz	LOBKWEIKDTYXSM-KRWDZBQOSA-N	0	3	330.859	3.082	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)Cc1cccs1)NCc1ccccc1C#N	ZINC001133521500	1376055652	/nfs/dbraw/zinc/05/56/52/1376055652.db2.gz	SLFXIIKHIAKQJA-CABCVRRESA-N	0	3	341.480	3.235	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)c1cc(C)oc1C	ZINC001133640492	1376131013	/nfs/dbraw/zinc/13/10/13/1376131013.db2.gz	IIIGHGMQILFMEB-WDEREUQCSA-N	0	3	343.265	3.292	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCCN(CC[C@H](C)F)Cc2cccnc2)C1	ZINC001230840658	1376164731	/nfs/dbraw/zinc/16/47/31/1376164731.db2.gz	DGSNWLLAYONWQD-KRWDZBQOSA-N	0	3	347.478	3.494	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc(C(F)F)c(F)c2)cc1	ZINC001133757025	1376191702	/nfs/dbraw/zinc/19/17/02/1376191702.db2.gz	FDPWOEHRVGPPCQ-UHFFFAOYSA-N	0	3	347.340	3.155	20	30		EGEDHN
Cc1ncsc1C(=O)N[C@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001133784043	1376206089	/nfs/dbraw/zinc/20/60/89/1376206089.db2.gz	FFBNRYVRXHMCGJ-CHWSQXEVSA-N	0	3	342.468	3.010	20	30		EGEDHN
C=CCOCC(=O)N[C@@H](C)C[C@@H](C)NCc1cccc(F)c1Cl	ZINC001133910059	1376260752	/nfs/dbraw/zinc/26/07/52/1376260752.db2.gz	VIYUPKGIQHLKLL-OLZOCXBDSA-N	0	3	342.842	3.055	20	30		EGEDHN
COc1cc(C#N)ccc1CN1CCC2(COc3ccccc32)CC1	ZINC001231620562	1376282327	/nfs/dbraw/zinc/28/23/27/1376282327.db2.gz	FABHGSJTHUGAAI-UHFFFAOYSA-N	0	3	334.419	3.493	20	30		EGEDHN
N#Cc1cccc(O[C@H]2CCCN(Cc3cc4cc[nH]c4cn3)C2)c1	ZINC001231669733	1376300707	/nfs/dbraw/zinc/30/07/07/1376300707.db2.gz	OBICNVQYAUJUAJ-IBGZPJMESA-N	0	3	332.407	3.478	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)c1oc(C)cc1C	ZINC001134042114	1376328024	/nfs/dbraw/zinc/32/80/24/1376328024.db2.gz	KZZIMHZMIFAWJB-NWDGAFQWSA-N	0	3	343.265	3.292	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1cc(F)ccc1C#N)NC(=O)C1=CCCC1	ZINC001134119320	1376378256	/nfs/dbraw/zinc/37/82/56/1376378256.db2.gz	PHGDEANOEDXKNN-UONOGXRCSA-N	0	3	329.419	3.181	20	30		EGEDHN
C#CCCCC(=O)N[C@H](C)C[C@H](C)NCc1cc(O)ccc1Cl	ZINC001134206415	1376417688	/nfs/dbraw/zinc/41/76/88/1376417688.db2.gz	UNPOSWXYODBKJF-UONOGXRCSA-N	0	3	336.863	3.222	20	30		EGEDHN
CN(CCCN(C)C(=O)[C@H]1CC1(C)C)Cc1ccc(F)c(C#N)c1	ZINC001327202193	1388441754	/nfs/dbraw/zinc/44/17/54/1388441754.db2.gz	NISHNDUNSFOQMS-MRXNPFEDSA-N	0	3	331.435	3.024	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)c1ccoc1CC	ZINC001134248687	1376432888	/nfs/dbraw/zinc/43/28/88/1376432888.db2.gz	SXXXFQZQVYGCRF-VXGBXAGGSA-N	0	3	343.265	3.237	20	30		EGEDHN
Cc1cc[nH]c1C(=O)N[C@@H](C)C[C@@H](C)NCc1cc(F)ccc1C#N	ZINC001134273695	1376450111	/nfs/dbraw/zinc/45/01/11/1376450111.db2.gz	ITSZPNSODTXKMT-KGLIPLIRSA-N	0	3	342.418	3.021	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cc(F)ccc1N)[C@@H]2CC	ZINC001232509388	1376471033	/nfs/dbraw/zinc/47/10/33/1376471033.db2.gz	WVLOMSREHDVCHR-QUCCMNQESA-N	0	3	345.462	3.330	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)C#CC(C)(C)C)NCc1cc(F)ccc1C#N	ZINC001134330088	1376480438	/nfs/dbraw/zinc/48/04/38/1376480438.db2.gz	VLJNYDHAHOOLTB-GJZGRUSLSA-N	0	3	343.446	3.120	20	30		EGEDHN
CC(C)(C)c1ccc(CC(=O)NCCNCc2cccc(C#N)c2)cc1	ZINC001134417319	1376522691	/nfs/dbraw/zinc/52/26/91/1376522691.db2.gz	SFTFPZGUKZUIQQ-UHFFFAOYSA-N	0	3	349.478	3.304	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H](C)C[C@H](C)NCc1ccn(CC)n1	ZINC001134447415	1376542277	/nfs/dbraw/zinc/54/22/77/1376542277.db2.gz	HUOCNZNBTYDVHQ-STQMWFEESA-N	0	3	340.899	3.055	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H](C)C[C@H](C)NCc1conc1CC	ZINC001134456762	1376548061	/nfs/dbraw/zinc/54/80/61/1376548061.db2.gz	CWQKILNYZLHRDE-RYUDHWBXSA-N	0	3	341.883	3.389	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H](C)C[C@@H](C)NCc1nccs1	ZINC001134457389	1376548577	/nfs/dbraw/zinc/54/85/77/1376548577.db2.gz	NHYJOBCXJBAMPB-MNOVXSKESA-N	0	3	329.897	3.295	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CC[C@@]2(CCCN2C(=O)C(C)C)C1	ZINC001233081308	1376567494	/nfs/dbraw/zinc/56/74/94/1376567494.db2.gz	UNPDKOAUIDUBQE-FQEVSTJZSA-N	0	3	325.456	3.090	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CC[C@]2(CCCN2C(=O)C(C)C)C1	ZINC001233081311	1376568462	/nfs/dbraw/zinc/56/84/62/1376568462.db2.gz	UNPDKOAUIDUBQE-HXUWFJFHSA-N	0	3	325.456	3.090	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2nc(C)c(C)s2)CCC1	ZINC001134587700	1376610520	/nfs/dbraw/zinc/61/05/20/1376610520.db2.gz	GDZBRYMHDUNTMU-ZIAGYGMSSA-N	0	3	347.528	3.326	20	30		EGEDHN
COc1ccc(CNCCNC(=O)CCCCCC(C)C)cc1C#N	ZINC001134789210	1376722274	/nfs/dbraw/zinc/72/22/74/1376722274.db2.gz	SRCOLWMJYSTCKX-UHFFFAOYSA-N	0	3	345.487	3.379	20	30		EGEDHN
C#CCCCC(=O)N(C)C[C@@H]1CCN1CCCc1ccccc1C	ZINC001233948380	1376742024	/nfs/dbraw/zinc/74/20/24/1376742024.db2.gz	VKSDPIUKIQFMJY-FQEVSTJZSA-N	0	3	326.484	3.264	20	30		EGEDHN
CN(C[C@@H]1CCN1CCCCC1CCOCC1)C(=O)C#CC(C)(C)C	ZINC001234216666	1376788402	/nfs/dbraw/zinc/78/84/02/1376788402.db2.gz	ZWSQCFSRGUFLDN-IBGZPJMESA-N	0	3	348.531	3.166	20	30		EGEDHN
C=CCCCN1CC[C@H]1CN(C)C(=O)c1csc([C@H]2CCCO2)n1	ZINC001234333456	1376812744	/nfs/dbraw/zinc/81/27/44/1376812744.db2.gz	KKQBZFIKHJJYFV-GOEBONIOSA-N	0	3	349.500	3.107	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](C)C[C@H](C)NCc1ncc(Cl)n1C	ZINC001135181086	1376953379	/nfs/dbraw/zinc/95/33/79/1376953379.db2.gz	MCUFEGOKHGFTKY-STQMWFEESA-N	0	3	340.899	3.049	20	30		EGEDHN
Cc1cocc1C(=O)N[C@@H](C)C[C@H](C)NCc1cc(F)ccc1C#N	ZINC001135202786	1376973145	/nfs/dbraw/zinc/97/31/45/1376973145.db2.gz	IIWYOUANDAMSEY-KBPBESRZSA-N	0	3	343.402	3.286	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N[C@H](C)C[C@@H](C)NCC(=C)Br	ZINC001135243316	1376997620	/nfs/dbraw/zinc/99/76/20/1376997620.db2.gz	JRPQFAGUIBFLJO-VAZNYKRKSA-N	0	3	329.282	3.290	20	30		EGEDHN
CCc1cc(CN2CC[C@]3(CCCN3C(=O)C(C)C)C2)ccc1C#N	ZINC001238776990	1377001488	/nfs/dbraw/zinc/00/14/88/1377001488.db2.gz	YGIGEXNUWNWVTQ-OAQYLSRUSA-N	0	3	339.483	3.344	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)C1(CC)CCC1	ZINC001135256769	1377006921	/nfs/dbraw/zinc/00/69/21/1377006921.db2.gz	WPANUGADZSWIJF-CHWSQXEVSA-N	0	3	331.298	3.348	20	30		EGEDHN
COc1ccc(-c2cccc3cc([C@@H]4CNCCO4)cn32)cc1C#N	ZINC001244710437	1377039500	/nfs/dbraw/zinc/03/95/00/1377039500.db2.gz	ZCLZBGOZKFDGGZ-FQEVSTJZSA-N	0	3	333.391	3.147	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1ccccc1C#N)NC(=O)c1occc1Cl	ZINC001135399351	1377073707	/nfs/dbraw/zinc/07/37/07/1377073707.db2.gz	QXTZGLWXTKSDMV-QWHCGFSZSA-N	0	3	345.830	3.491	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)c1ccc(Cl)[nH]1)NCc1ccccc1C#N	ZINC001135435831	1377095835	/nfs/dbraw/zinc/09/58/35/1377095835.db2.gz	WTGUCDVVNAHYHJ-CHWSQXEVSA-N	0	3	344.846	3.226	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H](C)C[C@@H](C)NCc1csnc1OC	ZINC001135565202	1377148058	/nfs/dbraw/zinc/14/80/58/1377148058.db2.gz	QVTNLTSNYSXTGO-CHWSQXEVSA-N	0	3	339.505	3.127	20	30		EGEDHN
N#CC[C@H](C(=O)N[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1	ZINC001135797678	1377213607	/nfs/dbraw/zinc/21/36/07/1377213607.db2.gz	PQOJOZIIKZCAGW-PMACEKPBSA-N	0	3	333.435	3.075	20	30		EGEDHN
C=CCO[C@@H]1CO[C@@]2(C1)CCCN(Cc1ccc3c(c1)COC3)C2	ZINC001137025370	1377460504	/nfs/dbraw/zinc/46/05/04/1377460504.db2.gz	BTLYCOCPEDJNQF-VQTJNVASSA-N	0	3	329.440	3.043	20	30		EGEDHN
COC(=O)c1ccc2c(CN(C)Cc3cccc(C#N)c3)c[nH]c2c1	ZINC001138268700	1377696311	/nfs/dbraw/zinc/69/63/11/1377696311.db2.gz	DISDHKGVVSTKGF-UHFFFAOYSA-N	0	3	333.391	3.458	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@@H](c3nc(CC)no3)C2)c1[O-]	ZINC001138627633	1377756904	/nfs/dbraw/zinc/75/69/04/1377756904.db2.gz	CVEUJBHRHIVFLR-MRXNPFEDSA-N	0	3	327.428	3.446	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@@H](c3nc(CC)no3)C2)c1[O-]	ZINC001138627633	1377756905	/nfs/dbraw/zinc/75/69/05/1377756905.db2.gz	CVEUJBHRHIVFLR-MRXNPFEDSA-N	0	3	327.428	3.446	20	30		EGEDHN
C=CCc1cccc(C[N@H+](CC)CCNC(=O)OC(C)(C)C)c1[O-]	ZINC001138630505	1377758381	/nfs/dbraw/zinc/75/83/81/1377758381.db2.gz	XZEPAICXNAPYOH-UHFFFAOYSA-N	0	3	334.460	3.467	20	30		EGEDHN
C=CCc1cccc(C[N@@H+](CC)CCNC(=O)OC(C)(C)C)c1[O-]	ZINC001138630505	1377758384	/nfs/dbraw/zinc/75/83/84/1377758384.db2.gz	XZEPAICXNAPYOH-UHFFFAOYSA-N	0	3	334.460	3.467	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CCC(Oc3cc(C)ncn3)CC2)c1[O-]	ZINC001138631266	1377758397	/nfs/dbraw/zinc/75/83/97/1377758397.db2.gz	MZNAGRZTCKQVQP-UHFFFAOYSA-N	0	3	339.439	3.263	20	30		EGEDHN
C=CCOc1ccccc1CN1CC[C@H]2[C@H](CCN2C(=O)C(C)C)C1	ZINC001139032587	1377820392	/nfs/dbraw/zinc/82/03/92/1377820392.db2.gz	PWYDKMSEZVDITA-MJGOQNOKSA-N	0	3	342.483	3.330	20	30		EGEDHN
C=CCOC(=O)N[C@H]1CCCN(Cc2ccc3cc(O)ccc3c2)C1	ZINC001139340145	1377870898	/nfs/dbraw/zinc/87/08/98/1377870898.db2.gz	JHCFAFMNDBGBKC-SFHVURJKSA-N	0	3	340.423	3.422	20	30		EGEDHN
N#Cc1ccc(Oc2ccc(CN3CC[C@H]4OCC[C@H]4C3)cn2)cc1	ZINC001139427688	1377882322	/nfs/dbraw/zinc/88/23/22/1377882322.db2.gz	NQFUBEOSIAXBBC-PKOBYXMFSA-N	0	3	335.407	3.356	20	30		EGEDHN
N#Cc1ccc(Oc2ccc(CN3CC[C@@]4(CCOC4)C3)cn2)cc1	ZINC001139426725	1377882328	/nfs/dbraw/zinc/88/23/28/1377882328.db2.gz	KMPGQBICQYGWEH-HXUWFJFHSA-N	0	3	335.407	3.358	20	30		EGEDHN
C=CCn1cc(CN2C[C@H]3CCC[C@@]3(COc3cccnc3)C2)cn1	ZINC001139769941	1377948349	/nfs/dbraw/zinc/94/83/49/1377948349.db2.gz	WBNMZUMYWUHGDM-QUCCMNQESA-N	0	3	338.455	3.145	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@H]1CCN(Cc1ccc(O)cc1F)C2	ZINC001140127303	1378013788	/nfs/dbraw/zinc/01/37/88/1378013788.db2.gz	YWPVSZKEWHDWIQ-OALUTQOASA-N	0	3	335.419	3.105	20	30		EGEDHN
C=CCN1C(=O)CC[C@@]12CCCN(Cc1ccc(O)cc1F)CC2	ZINC001140125667	1378013814	/nfs/dbraw/zinc/01/38/14/1378013814.db2.gz	GCIMZNQYXUHCRG-LJQANCHMSA-N	0	3	332.419	3.064	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CC2)C(=O)N[C@H]3c2ccccc2)c(F)c1	ZINC001140137787	1378017721	/nfs/dbraw/zinc/01/77/21/1378017721.db2.gz	ZDEJLRNZGOQYQY-IBGZPJMESA-N	0	3	349.409	3.151	20	30		EGEDHN
C=CCN1CCC2(CCN(Cc3ccc4ncccc4c3)CC2)C1=O	ZINC001273303967	1378095843	/nfs/dbraw/zinc/09/58/43/1378095843.db2.gz	PQMIZSTVIGXIPU-UHFFFAOYSA-N	0	3	335.451	3.235	20	30		EGEDHN
C#CCN1CC[C@]2(CCCN(Cc3cccc4cccnc43)CC2)C1=O	ZINC001275532357	1378141414	/nfs/dbraw/zinc/14/14/14/1378141414.db2.gz	JWOQVVSGVBHNDX-JOCHJYFZSA-N	0	3	347.462	3.073	20	30		EGEDHN
Cc1cc(O[C@@H]2CCCN(Cc3c[nH]c4cc(C#N)ccc34)C2)ncn1	ZINC001142931632	1378511857	/nfs/dbraw/zinc/51/18/57/1378511857.db2.gz	SOIFQIPXDZLNNL-QGZVFWFLSA-N	0	3	347.422	3.181	20	30		EGEDHN
CCOc1ccc(F)c(F)c1CN1CCC2SC(=O)C=C2C1	ZINC001143489185	1378603791	/nfs/dbraw/zinc/60/37/91/1378603791.db2.gz	YQTYCDORVPQGFS-CQSZACIVSA-N	0	3	325.380	3.138	20	30		EGEDHN
CN(Cc1ccc(C#N)cn1)CC1CCN(C(=O)OC(C)(C)C)CC1	ZINC001144157271	1378689168	/nfs/dbraw/zinc/68/91/68/1378689168.db2.gz	AZQUNGBCGWPAAY-UHFFFAOYSA-N	0	3	344.459	3.032	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)c1ccc(F)s1)NCc1ccccc1C#N	ZINC001146735632	1378910924	/nfs/dbraw/zinc/91/09/24/1378910924.db2.gz	PGSCCVIEBAVVQJ-STQMWFEESA-N	0	3	345.443	3.446	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2ocnc2C)CCCC1	ZINC001146819439	1378926954	/nfs/dbraw/zinc/92/69/54/1378926954.db2.gz	AHJVMJXRQNJNFD-HUUCEWRRSA-N	0	3	333.476	3.492	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2cnns2)CCCC1	ZINC001146822345	1378928523	/nfs/dbraw/zinc/92/85/23/1378928523.db2.gz	QJHDRLMRIGCQIS-KBPBESRZSA-N	0	3	336.505	3.048	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)N1CC2(C1)CCN(CCc1ccccc1F)C2	ZINC001148095595	1379116895	/nfs/dbraw/zinc/11/68/95/1379116895.db2.gz	MMMHHRUOIKPECG-DLBZAZTESA-N	0	3	344.474	3.361	20	30		EGEDHN
C=CCCCC(=O)N1CC2(C1)CCN(Cc1ccc(C)nc1C)C2	ZINC001148193717	1379131501	/nfs/dbraw/zinc/13/15/01/1379131501.db2.gz	FKYMHNVPHZVMPH-UHFFFAOYSA-N	0	3	327.472	3.089	20	30		EGEDHN
CCN1CCN(c2ccc(C(=O)Nc3ccsc3C#N)cc2)CC1	ZINC001148997621	1379309492	/nfs/dbraw/zinc/30/94/92/1379309492.db2.gz	JUJWCLAYMMXCOX-UHFFFAOYSA-N	0	3	340.452	3.014	20	30		EGEDHN
C=CCC1(C(=O)NC[C@H]2CN(CC3=CCCCC3)CCCO2)CCC1	ZINC001150268274	1379525134	/nfs/dbraw/zinc/52/51/34/1379525134.db2.gz	TYYRELKFXQKWFH-IBGZPJMESA-N	0	3	346.515	3.440	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@H]2CN(Cc3ccc(C)cc3)CCCO2)C1	ZINC001150299877	1379529930	/nfs/dbraw/zinc/52/99/30/1379529930.db2.gz	WJNQDPCUEPYLAE-IBGZPJMESA-N	0	3	342.483	3.058	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@@H]1CN(CC2=CCCCC2)CCCO1	ZINC001150379983	1379542278	/nfs/dbraw/zinc/54/22/78/1379542278.db2.gz	NGFJBLSFXAMAFE-GOSISDBHSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)[C@H](CC)Cc2ccccc2)C1	ZINC001150393219	1379545698	/nfs/dbraw/zinc/54/56/98/1379545698.db2.gz	BHLWIIQYJKMMPX-WOJBJXKFSA-N	0	3	344.499	3.039	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)C/C=C/c2ccc(C)cc2)C1	ZINC001150848069	1379621457	/nfs/dbraw/zinc/62/14/57/1379621457.db2.gz	DFHANTUMPOBWEZ-PEAOBZDDSA-N	0	3	342.483	3.182	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)C[C@H]2CCC[C@H]2C)CC1	ZINC001151131929	1379664766	/nfs/dbraw/zinc/66/47/66/1379664766.db2.gz	JUDLDTROLQBIDM-QZTJIDSGSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2cc[nH]c2C2CC2)CC1	ZINC001151275589	1379692127	/nfs/dbraw/zinc/69/21/27/1379692127.db2.gz	SBBICKVQZIKLHR-UHFFFAOYSA-N	0	3	345.487	3.069	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@H](C=C)c2ccccc2)CC1	ZINC001151410145	1379713505	/nfs/dbraw/zinc/71/35/05/1379713505.db2.gz	QWCSPZGEDGIZQF-LJQANCHMSA-N	0	3	342.483	3.130	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@H]2CC3CCC2CC3)CC1	ZINC001151412521	1379714073	/nfs/dbraw/zinc/71/40/73/1379714073.db2.gz	HIJBVCCBQWQDBJ-ACBHZAAOSA-N	0	3	348.531	3.376	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)CCC(C)C	ZINC001151767110	1379775988	/nfs/dbraw/zinc/77/59/88/1379775988.db2.gz	VZXNYSNQWRSPFR-OAHLLOKOSA-N	0	3	333.451	3.460	20	30		EGEDHN
C=CC[C@H](C(=O)NCCNCc1ccnc(Cl)c1)c1ccccc1	ZINC001151838093	1379793382	/nfs/dbraw/zinc/79/33/82/1379793382.db2.gz	JCODIJPTTGTBPF-KRWDZBQOSA-N	0	3	343.858	3.301	20	30		EGEDHN
CCCCCCCC[C@H](C)C(=O)NCCN[C@@H](CCCC)C(N)=O	ZINC001151847910	1379798858	/nfs/dbraw/zinc/79/88/58/1379798858.db2.gz	BZULRJORWTZTQT-IRXDYDNUSA-N	0	3	341.540	3.123	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)CSC(C)C	ZINC001151960068	1379826225	/nfs/dbraw/zinc/82/62/25/1379826225.db2.gz	GQIRBMWGSKJZNW-OAHLLOKOSA-N	0	3	333.501	3.026	20	30		EGEDHN
CCC1(C(=O)NCCNCc2ccc(OC)c(C#N)c2)CCCCC1	ZINC001152053915	1379852178	/nfs/dbraw/zinc/85/21/78/1379852178.db2.gz	JIQQJBDXFPRTHT-UHFFFAOYSA-N	0	3	343.471	3.133	20	30		EGEDHN
CC(C)c1ccsc1C(=O)NCCNCc1ccc(C#N)cc1	ZINC001152127029	1379867515	/nfs/dbraw/zinc/86/75/15/1379867515.db2.gz	SPGXFCQSKCJJLO-UHFFFAOYSA-N	0	3	327.453	3.263	20	30		EGEDHN
C[C@H](CCCc1ccccc1)C(=O)NCCNCc1ccc(C#N)cc1	ZINC001152769192	1379980105	/nfs/dbraw/zinc/98/01/05/1379980105.db2.gz	DHZGTAKZQONZNY-GOSISDBHSA-N	0	3	349.478	3.423	20	30		EGEDHN
CC1=C(C)C[C@](C)(C(=O)NCCNCc2ccc(C#N)c(F)c2)CC1	ZINC001152933987	1379995951	/nfs/dbraw/zinc/99/59/51/1379995951.db2.gz	CSDRMNXZWOVURZ-HXUWFJFHSA-N	0	3	343.446	3.430	20	30		EGEDHN
C=C(Cl)CNC[C@H](NC(=O)c1ccn2cc(C)nc2c1)C(C)(C)C	ZINC001284623692	1380024215	/nfs/dbraw/zinc/02/42/15/1380024215.db2.gz	ASBHHKKLPDLZGA-HNNXBMFYSA-N	0	3	348.878	3.129	20	30		EGEDHN
Cc1ccc(/C=C\CC(=O)NCCNCc2ccc(C#N)s2)cc1	ZINC001153979385	1380167830	/nfs/dbraw/zinc/16/78/30/1380167830.db2.gz	AMALIWRACBWFBO-IHWYPQMZSA-N	0	3	339.464	3.238	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@H](C)N(CC)C[C@H](OC)c1ccccc1	ZINC001154747370	1380344381	/nfs/dbraw/zinc/34/43/81/1380344381.db2.gz	OIIDWDLZWHTOKC-QUCCMNQESA-N	0	3	344.499	3.394	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@@H](C)N(CC)CCc1csc(C)n1	ZINC001154750955	1380345978	/nfs/dbraw/zinc/34/59/78/1380345978.db2.gz	HCAGWLVRNGPZAF-ZBFHGGJFSA-N	0	3	337.533	3.423	20	30		EGEDHN
C=CCOCCCC(=O)NCCCNCc1ccc(F)cc1Cl	ZINC001156160014	1380533296	/nfs/dbraw/zinc/53/32/96/1380533296.db2.gz	LFLCNPLXACIIFA-UHFFFAOYSA-N	0	3	342.842	3.058	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@@H](C)c1cc2ccccc2o1	ZINC001156277447	1380551867	/nfs/dbraw/zinc/55/18/67/1380551867.db2.gz	UUHRMZLXFUCPAA-CVEARBPZSA-N	0	3	326.440	3.386	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H](C)N(CC)C/C=C/c2ccccc2)nc1	ZINC001156475974	1380581282	/nfs/dbraw/zinc/58/12/82/1380581282.db2.gz	ZMEXMBQNYMTOMG-ZPHJMFTNSA-N	0	3	347.462	3.217	20	30		EGEDHN
N#Cc1c(Cl)nccc1C(F)(F)n1nc(CN)c2ccccc21	ZINC001156856064	1380695656	/nfs/dbraw/zinc/69/56/56/1380695656.db2.gz	OPTUAUPGRURYTD-UHFFFAOYSA-N	0	3	333.729	3.013	20	30		EGEDHN
C#CCCCC(=O)NCCCNCc1nc2cc(C)ccc2s1	ZINC001157170472	1380793976	/nfs/dbraw/zinc/79/39/76/1380793976.db2.gz	IIYOFFIYRYRFSZ-UHFFFAOYSA-N	0	3	329.469	3.004	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NC[C@@H](C)N(CC)Cc1cccc(Cl)c1	ZINC001157216952	1380813158	/nfs/dbraw/zinc/81/31/58/1380813158.db2.gz	DKRRCOQRVIDPNL-HUUCEWRRSA-N	0	3	338.879	3.258	20	30		EGEDHN
C=CCCC(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(C#N)cc1	ZINC001157705807	1381009611	/nfs/dbraw/zinc/00/96/11/1381009611.db2.gz	KILFELBELDZNJQ-LJQANCHMSA-N	0	3	325.456	3.337	20	30		EGEDHN
C#CCCCC(=O)N1CCCC[C@@H]1CN(C)CCc1scnc1C	ZINC001157902592	1381066027	/nfs/dbraw/zinc/06/60/27/1381066027.db2.gz	JRPYVYGKEXTSDQ-QGZVFWFLSA-N	0	3	347.528	3.110	20	30		EGEDHN
CCCCOCCN(C)C[C@H]1CCCCN1C(=O)C#CC(C)(C)C	ZINC001157920092	1381071594	/nfs/dbraw/zinc/07/15/94/1381071594.db2.gz	QXWVKPFCFWWLMU-GOSISDBHSA-N	0	3	336.520	3.166	20	30		EGEDHN
N#Cc1ccc2c(c1)CCN(C(=O)[C@H]1CCC[C@H](c3ccccc3)N1)C2	ZINC001157936432	1381075802	/nfs/dbraw/zinc/07/58/02/1381075802.db2.gz	FYRCXKXFCFJCSR-NHCUHLMSSA-N	0	3	345.446	3.326	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1oc(CC2CC2)nc1C	ZINC001157988623	1381094634	/nfs/dbraw/zinc/09/46/34/1381094634.db2.gz	FPXXJSZBYAMNSO-MRXNPFEDSA-N	0	3	331.460	3.048	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCCC[C@@H]1CN(C)CCOCC1CC1	ZINC001158005299	1381101108	/nfs/dbraw/zinc/10/11/08/1381101108.db2.gz	NNDZWUSWSMJWEW-GOSISDBHSA-N	0	3	336.520	3.328	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)[C@H]2CCCC3(CC3)C2)c1	ZINC001158011203	1381101692	/nfs/dbraw/zinc/10/16/92/1381101692.db2.gz	RQLLSAMXPGGKPW-INIZCTEOSA-N	0	3	343.446	3.264	20	30		EGEDHN
CC#CCCCC(=O)N1CCCC[C@@H]1CN(C)CCOC1CCC1	ZINC001158357414	1381216157	/nfs/dbraw/zinc/21/61/57/1381216157.db2.gz	GVFYIGSRTKQYBN-GOSISDBHSA-N	0	3	334.504	3.062	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCCC[C@@H]1CN(C)CCOC1CCC1	ZINC001158377490	1381225479	/nfs/dbraw/zinc/22/54/79/1381225479.db2.gz	MUFIKCWAKCFESD-ZWKOTPCHSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1ccc2occc2c1	ZINC001158549192	1381292504	/nfs/dbraw/zinc/29/25/04/1381292504.db2.gz	RQWJEODCCBZNMP-UHFFFAOYSA-N	0	3	337.217	3.051	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1c[nH]c(=O)c2ccccc12	ZINC001158553909	1381295276	/nfs/dbraw/zinc/29/52/76/1381295276.db2.gz	CEVCISVJQBAHBN-OAHLLOKOSA-N	0	3	339.439	3.053	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccnc(C(F)(F)F)c1	ZINC001158689716	1381355115	/nfs/dbraw/zinc/35/51/15/1381355115.db2.gz	OKBAGKHBXZMEPQ-CQSZACIVSA-N	0	3	341.377	3.213	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCCNCc1cc(O)ccc1Cl	ZINC001158746655	1381380204	/nfs/dbraw/zinc/38/02/04/1381380204.db2.gz	DZCVCVOBKXBROE-UHFFFAOYSA-N	0	3	336.863	3.410	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H](CC)Oc1ccccc1F	ZINC001158758433	1381386280	/nfs/dbraw/zinc/38/62/80/1381386280.db2.gz	OCODRMCKLXGNEB-SJLPKXTDSA-N	0	3	348.462	3.482	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc(F)c(F)c(F)c1F	ZINC001158773352	1381393492	/nfs/dbraw/zinc/39/34/92/1381393492.db2.gz	GTVWFAXBUGAABW-LLVKDONJSA-N	0	3	344.352	3.356	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H](C)Oc1cccc(C)c1	ZINC001158829614	1381421846	/nfs/dbraw/zinc/42/18/46/1381421846.db2.gz	CKIDVXWEZAEJRS-ZWKOTPCHSA-N	0	3	330.472	3.261	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)Cn1ccc2ccccc21	ZINC001158885823	1381449298	/nfs/dbraw/zinc/44/92/98/1381449298.db2.gz	CLHWUPVGTOKAJP-GOSISDBHSA-N	0	3	325.456	3.140	20	30		EGEDHN
C=C(C)CCC(=O)NCCCNCc1nc2ccc(OC)cc2s1	ZINC001159021138	1381512983	/nfs/dbraw/zinc/51/29/83/1381512983.db2.gz	NOOMXQXLZRSVJT-UHFFFAOYSA-N	0	3	347.484	3.257	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)[C@H](C)CCc1ccc(F)cc1	ZINC001159559240	1381830165	/nfs/dbraw/zinc/83/01/65/1381830165.db2.gz	FJFZVIDNXNJADB-CYBMUJFWSA-N	0	3	326.843	3.243	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCC1=CCN(Cc2cc3ccccc3o2)CC1	ZINC001159586613	1381836771	/nfs/dbraw/zinc/83/67/71/1381836771.db2.gz	AFMKHYWKJQEXKC-HNNXBMFYSA-N	0	3	337.423	3.231	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)[C@H](C)Cc1cccc(F)c1	ZINC001328459769	1388751439	/nfs/dbraw/zinc/75/14/39/1388751439.db2.gz	SOEJVORDEGTTAE-OCCSQVGLSA-N	0	3	326.843	3.241	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)CCc1cc(F)ccc1F	ZINC001328460065	1388751515	/nfs/dbraw/zinc/75/15/15/1388751515.db2.gz	XECUUKNTYHJPRF-LBPRGKRZSA-N	0	3	330.806	3.134	20	30		EGEDHN
C=CCOC(=O)[C@@H](N)CCCCNc1nccc2cccc(C)c21	ZINC001159924295	1381939401	/nfs/dbraw/zinc/93/94/01/1381939401.db2.gz	LTOWDBLDJNHUKR-INIZCTEOSA-N	0	3	327.428	3.182	20	30		EGEDHN
C#CCCCC(=O)NCCC1=CCN(Cc2cccc(OC)c2)CC1	ZINC001159957507	1381949618	/nfs/dbraw/zinc/94/96/18/1381949618.db2.gz	FOWOUWSDYMVWOG-UHFFFAOYSA-N	0	3	340.467	3.137	20	30		EGEDHN
C=C(C)CCC(=O)NCCC1=CCN(C[C@@H](O)c2ccccc2)CC1	ZINC001160264585	1382054782	/nfs/dbraw/zinc/05/47/82/1382054782.db2.gz	SIBSOXSYVPXFEH-HXUWFJFHSA-N	0	3	342.483	3.215	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc3ccccc3nc2C)CC1	ZINC001160296499	1382065090	/nfs/dbraw/zinc/06/50/90/1382065090.db2.gz	QIVOKEMLXFEXQD-UHFFFAOYSA-N	0	3	347.462	3.319	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ocnc2-c2ccccc2)CC1	ZINC001160336836	1382076826	/nfs/dbraw/zinc/07/68/26/1382076826.db2.gz	ATYWPJPRVXHJIO-UHFFFAOYSA-N	0	3	337.423	3.280	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cnc(-c3ccccc3)o2)CC1	ZINC001160415727	1382098287	/nfs/dbraw/zinc/09/82/87/1382098287.db2.gz	CCFQLMWXRAJIGO-UHFFFAOYSA-N	0	3	349.434	3.117	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc(-c3cnco3)cc2)CC1	ZINC001160508559	1382126300	/nfs/dbraw/zinc/12/63/00/1382126300.db2.gz	PKXBLNUELPMFIA-UHFFFAOYSA-N	0	3	337.423	3.280	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc(C)c3ccccc3n2)CC1	ZINC001160536164	1382135111	/nfs/dbraw/zinc/13/51/11/1382135111.db2.gz	AYOAWGJVPSNFHU-UHFFFAOYSA-N	0	3	335.451	3.481	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc(C)c3cccnc23)CC1	ZINC001160699180	1382173786	/nfs/dbraw/zinc/17/37/86/1382173786.db2.gz	DKJJTJQRPVKFNW-UHFFFAOYSA-N	0	3	347.462	3.319	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H](C)OCc2ccc(C)cc2)CC1	ZINC001160792795	1382197315	/nfs/dbraw/zinc/19/73/15/1382197315.db2.gz	KRTODKBFOFOPMQ-SFHVURJKSA-N	0	3	342.483	3.225	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCC1=CCN(CCOCC2CCC2)CC1	ZINC001160940714	1382243478	/nfs/dbraw/zinc/24/34/78/1382243478.db2.gz	FXBYDBYPQQKWMD-ZWKOTPCHSA-N	0	3	348.531	3.400	20	30		EGEDHN
C=CCN1CCC[C@H]1CNc1nc(Cl)ccc1CN1CCCC1	ZINC001160953544	1382250470	/nfs/dbraw/zinc/25/04/70/1382250470.db2.gz	DPDHANVOMHJTRU-INIZCTEOSA-N	0	3	334.895	3.393	20	30		EGEDHN
C=CCCCC(=O)NCCC1=CCN(C[C@@H](O)c2ccccc2)CC1	ZINC001161057000	1382285833	/nfs/dbraw/zinc/28/58/33/1382285833.db2.gz	WYYGODVLPHKLHO-HXUWFJFHSA-N	0	3	342.483	3.215	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN2CC(Cc3ccsc3)C2)c1	ZINC001328569903	1388776923	/nfs/dbraw/zinc/77/69/23/1388776923.db2.gz	HJTUHLYOMLKMNG-UHFFFAOYSA-N	0	3	325.437	3.123	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCC2=CCN(Cc3cccnc3C)CC2)C1	ZINC001161178490	1382327398	/nfs/dbraw/zinc/32/73/98/1382327398.db2.gz	SGJKCAISCAQRAC-UHFFFAOYSA-N	0	3	339.483	3.385	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCC2=CCN(Cc3ncccc3C)CC2)C1	ZINC001161178375	1382327512	/nfs/dbraw/zinc/32/75/12/1382327512.db2.gz	PVHCBIZQAPUJQE-UHFFFAOYSA-N	0	3	339.483	3.385	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)NCCC1=CCN(Cc2ccc(C#N)cc2)CC1	ZINC001161368739	1382385710	/nfs/dbraw/zinc/38/57/10/1382385710.db2.gz	IYJBFWMLZQZWJG-QGZVFWFLSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)CC1	ZINC001161426973	1382406829	/nfs/dbraw/zinc/40/68/29/1382406829.db2.gz	DSEOVRHCJPHXSM-VQTJNVASSA-N	0	3	340.467	3.123	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2coc(-c3ccccc3)n2)CC1	ZINC001161709132	1382486548	/nfs/dbraw/zinc/48/65/48/1382486548.db2.gz	OUSFJQBLJAVNIR-UHFFFAOYSA-N	0	3	337.423	3.280	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@]2(C)CCc3ccccc32)CC1	ZINC001161972541	1382579105	/nfs/dbraw/zinc/57/91/05/1382579105.db2.gz	FPEJKPMWDZIPFK-QFIPXVFZSA-N	0	3	336.479	3.052	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H](C)Cc2ccc(F)cc2)CC1	ZINC001161983207	1382585979	/nfs/dbraw/zinc/58/59/79/1382585979.db2.gz	WDUVGEKTHQCCBA-KRWDZBQOSA-N	0	3	342.458	3.166	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@@H]1[C@H](C=C(C)C)C1(C)C	ZINC001162150164	1382639990	/nfs/dbraw/zinc/63/99/90/1382639990.db2.gz	JMBRZUDDCUAIIO-KBPBESRZSA-N	0	3	343.309	3.229	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1ccccc1CCC	ZINC001162209019	1382657142	/nfs/dbraw/zinc/65/71/42/1382657142.db2.gz	CGFGAAIWLWXLHP-UHFFFAOYSA-N	0	3	339.277	3.257	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)C2CCCCCCC2)(COC)CC1	ZINC001162351957	1382738163	/nfs/dbraw/zinc/73/81/63/1382738163.db2.gz	ZTEDBUYQKCUPDM-UHFFFAOYSA-N	0	3	348.531	3.215	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)/C=C\C(C)(C)C	ZINC001162747013	1382857130	/nfs/dbraw/zinc/85/71/30/1382857130.db2.gz	LIFDQUUFLAFQOC-OWBHPGMISA-N	0	3	326.484	3.273	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)c1ccoc1CC	ZINC001162790579	1382873770	/nfs/dbraw/zinc/87/37/70/1382873770.db2.gz	LJGWHRAMMMICCE-UHFFFAOYSA-N	0	3	338.451	3.140	20	30		EGEDHN
CC[C@H](F)CNCCN(CCc1ccccc1)C(=O)C#CC(C)C	ZINC001162806875	1382879093	/nfs/dbraw/zinc/87/90/93/1382879093.db2.gz	MWTNEKOXYRHGKH-IBGZPJMESA-N	0	3	332.463	3.055	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C1(C)CCCC1	ZINC001162876335	1382902232	/nfs/dbraw/zinc/90/22/32/1382902232.db2.gz	DYZLXOUZQRMOEP-UHFFFAOYSA-N	0	3	326.484	3.251	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1cc(F)ccc1C	ZINC001162876277	1382902322	/nfs/dbraw/zinc/90/23/22/1382902322.db2.gz	CNNPKPYZKPATAJ-UHFFFAOYSA-N	0	3	338.426	3.042	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N(CCNCC#CC)CCc1ccccc1	ZINC001162897732	1382909208	/nfs/dbraw/zinc/90/92/08/1382909208.db2.gz	HDWDETNJJYQABF-LJQANCHMSA-N	0	3	326.484	3.273	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CCC[C@@H]1CC	ZINC001162918886	1382916090	/nfs/dbraw/zinc/91/60/90/1382916090.db2.gz	IGGFAMWXRCTQGJ-VQTJNVASSA-N	0	3	326.484	3.107	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1C[C@H]1CCC	ZINC001162924131	1382918405	/nfs/dbraw/zinc/91/84/05/1382918405.db2.gz	IHRZOAXDFUWAQW-WOJBJXKFSA-N	0	3	326.484	3.107	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@H](C)c1ccco1	ZINC001162928839	1382919164	/nfs/dbraw/zinc/91/91/64/1382919164.db2.gz	PNUGLEXCPZDMID-GOSISDBHSA-N	0	3	338.451	3.067	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1C[C@@]1(C)C(C)C	ZINC001162970752	1382931861	/nfs/dbraw/zinc/93/18/61/1382931861.db2.gz	JPKFTJVUJUUMGX-UNMCSNQZSA-N	0	3	340.511	3.353	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)c1c[nH]cc1C1CC1	ZINC001162971053	1382932945	/nfs/dbraw/zinc/93/29/45/1382932945.db2.gz	VDIASZCHLGFZCH-UHFFFAOYSA-N	0	3	349.478	3.190	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C[C@@H](CC)C(C)C	ZINC001162983099	1382937184	/nfs/dbraw/zinc/93/71/84/1382937184.db2.gz	YMFOKIVGBFBJTM-HXUWFJFHSA-N	0	3	328.500	3.353	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C[C@@H](C)C1CC1	ZINC001163006298	1382945683	/nfs/dbraw/zinc/94/56/83/1382945683.db2.gz	CDOLWZMMVYREHC-GOSISDBHSA-N	0	3	326.484	3.107	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)[C@H]2CC[C@@H]3C[C@@H]3CC2)c1	ZINC001163008214	1382947551	/nfs/dbraw/zinc/94/75/51/1382947551.db2.gz	XZAIDTYADRAQMR-BJWYYQGGSA-N	0	3	343.446	3.120	20	30		EGEDHN
O=C(CC1CC1)NCCC1(CNCC#Cc2ccccc2Cl)CC1	ZINC001163138519	1382975047	/nfs/dbraw/zinc/97/50/47/1382975047.db2.gz	UJIADNKOHMJFPD-UHFFFAOYSA-N	0	3	344.886	3.368	20	30		EGEDHN
N#Cc1ccccc1CNCC1(CCNC(=O)c2cccs2)CC1	ZINC001163216826	1382995768	/nfs/dbraw/zinc/99/57/68/1382995768.db2.gz	QBVQTMWEIBVOHN-UHFFFAOYSA-N	0	3	339.464	3.310	20	30		EGEDHN
CCCSCC(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001163604064	1383086947	/nfs/dbraw/zinc/08/69/47/1383086947.db2.gz	NGTXFUIBXAQQHW-UHFFFAOYSA-N	0	3	345.512	3.078	20	30		EGEDHN
N#Cc1ccc(F)c(CNCC2(CCNC(=O)/C=C/C3CC3)CC2)c1	ZINC001163939883	1383137766	/nfs/dbraw/zinc/13/77/66/1383137766.db2.gz	GSYMZJSPVNYRMZ-GQCTYLIASA-N	0	3	341.430	3.040	20	30		EGEDHN
CC#CCCCC(=O)NCCCNCc1ccn(C(CC)CC)n1	ZINC001164268571	1383173190	/nfs/dbraw/zinc/17/31/90/1383173190.db2.gz	MJVXBMATSXGPBT-UHFFFAOYSA-N	0	3	332.492	3.034	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCCCNCc1ccn(C2CCCC2)n1	ZINC001164323608	1383177622	/nfs/dbraw/zinc/17/76/22/1383177622.db2.gz	ITZZYCAVZFWLGI-INIZCTEOSA-N	0	3	332.492	3.196	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)C2CC(C)(C)C2)CC1	ZINC001164404038	1383184826	/nfs/dbraw/zinc/18/48/26/1383184826.db2.gz	ZPJSRRUKVOBFIA-UHFFFAOYSA-N	0	3	343.309	3.207	20	30		EGEDHN
CC(C)(C)C#CC(=O)NCCC1(CNCC=C(Cl)Cl)CC1	ZINC001164471685	1383189995	/nfs/dbraw/zinc/18/99/95/1383189995.db2.gz	NPWQJBYGVHMXQR-UHFFFAOYSA-N	0	3	331.287	3.231	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCC1(CNCc2conc2C)CC1	ZINC001164649534	1383214212	/nfs/dbraw/zinc/21/42/12/1383214212.db2.gz	UUOSGSWBJZCJFA-UHFFFAOYSA-N	0	3	331.460	3.128	20	30		EGEDHN
C=CCCCC(=O)NCCCNCc1cc(-c2ccc(F)cc2)no1	ZINC001165535213	1383307792	/nfs/dbraw/zinc/30/77/92/1383307792.db2.gz	DVMXMIPHPZLWII-UHFFFAOYSA-N	0	3	345.418	3.433	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)Cc1cccc(Cl)c1	ZINC001165650660	1383320119	/nfs/dbraw/zinc/32/01/19/1383320119.db2.gz	ILFOMDUPRIQWPP-UHFFFAOYSA-N	0	3	341.842	3.050	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)Cc2ccccc2CC)CC1	ZINC001165702647	1383327931	/nfs/dbraw/zinc/32/79/31/1383327931.db2.gz	CXYVHWIUAJVZSZ-UHFFFAOYSA-N	0	3	334.891	3.420	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)CCc2ccc(F)cc2)CC1	ZINC001166006160	1383376749	/nfs/dbraw/zinc/37/67/49/1383376749.db2.gz	YCUBDJJUCUJVBX-UHFFFAOYSA-N	0	3	338.854	3.387	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCCNCc2nsc3ccccc32)C1	ZINC001166245861	1383406774	/nfs/dbraw/zinc/40/67/74/1383406774.db2.gz	SYAULRAGUSXLJQ-UHFFFAOYSA-N	0	3	329.469	3.249	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCC1(CNCc2c(C)noc2C)CC1	ZINC001166693188	1383461808	/nfs/dbraw/zinc/46/18/08/1383461808.db2.gz	GWSBICKGPSBWDN-UONOGXRCSA-N	0	3	333.476	3.126	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)[C@@H]2CCC2(C)C)CC1	ZINC001166729976	1383468393	/nfs/dbraw/zinc/46/83/93/1383468393.db2.gz	UASXVGRKMMMMFC-ZDUSSCGKSA-N	0	3	343.309	3.207	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCCC1(CNCc2ccc(F)cn2)CC1	ZINC001166755807	1383472650	/nfs/dbraw/zinc/47/26/50/1383472650.db2.gz	MZPDRMAEAXPJQZ-HNNXBMFYSA-N	0	3	333.451	3.199	20	30		EGEDHN
C[C@H]1C[C@H]1CC(=O)NCCC1(CNCc2cc(C#N)ccc2F)CC1	ZINC001167011067	1383516608	/nfs/dbraw/zinc/51/66/08/1383516608.db2.gz	AAVXSGIQFCBPRY-HOCLYGCPSA-N	0	3	343.446	3.120	20	30		EGEDHN
CN(CC1CCCCC1)c1nccnc1C(C#N)C(=O)OC(C)(C)C	ZINC001167097323	1383538408	/nfs/dbraw/zinc/53/84/08/1383538408.db2.gz	WBXBRQMOPGVSGQ-HNNXBMFYSA-N	0	3	344.459	3.442	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)[C@H]2CC[C@H](C)C2)CC1	ZINC001167376673	1383614885	/nfs/dbraw/zinc/61/48/85/1383614885.db2.gz	DSTYMNCVKPCJGZ-JSGCOSHPSA-N	0	3	343.309	3.207	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@@H]2CCO[C@@H](CCC)C2)CC1	ZINC001167540039	1383660940	/nfs/dbraw/zinc/66/09/40/1383660940.db2.gz	NBLALUVODCNFCW-CVEARBPZSA-N	0	3	342.911	3.210	20	30		EGEDHN
C[C@H](CC1CCCC1)C(=O)NCCCNCc1ccccc1C#N	ZINC001167557823	1383668240	/nfs/dbraw/zinc/66/82/40/1383668240.db2.gz	WVEOHUMZVHHYQS-MRXNPFEDSA-N	0	3	327.472	3.371	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)[C@H]2C[C@@H]2C(C)C)CC1	ZINC001167579903	1383676994	/nfs/dbraw/zinc/67/69/94/1383676994.db2.gz	WRAFDICOWKBQPF-KGLIPLIRSA-N	0	3	343.309	3.063	20	30		EGEDHN
CC(C)N1CCN(c2ccc(NCc3ccccc3C#N)cn2)CC1	ZINC001167634245	1383694391	/nfs/dbraw/zinc/69/43/91/1383694391.db2.gz	AOROTYWVNRYGAJ-UHFFFAOYSA-N	0	3	335.455	3.096	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)c1ccncc1	ZINC001168797343	1384009759	/nfs/dbraw/zinc/00/97/59/1384009759.db2.gz	XZWOMADMSUKTEZ-INIZCTEOSA-N	0	3	336.439	3.032	20	30		EGEDHN
CC(C)N1CCN(c2ccc(NCc3ccc(C#N)s3)cn2)CC1	ZINC001170199940	1384262085	/nfs/dbraw/zinc/26/20/85/1384262085.db2.gz	MOBZBNKBPCFPQL-UHFFFAOYSA-N	0	3	341.484	3.157	20	30		EGEDHN
CO[C@@H]1[C@H](C)[C@H](NCc2cc(C#N)ccc2Br)C1(C)C	ZINC001170399147	1384307966	/nfs/dbraw/zinc/30/79/66/1384307966.db2.gz	HPRZORFWZHFFJC-WKPIXPDZSA-N	0	3	337.261	3.470	20	30		EGEDHN
C=C[C@H]1C[C@]1(Nc1ccc(F)c(CN2CCCC2)c1)C(=O)OCC	ZINC001170927239	1384413146	/nfs/dbraw/zinc/41/31/46/1384413146.db2.gz	JGSZKDIAFQVQFK-HNAYVOBHSA-N	0	3	332.419	3.341	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@H](C)c1ccc(C)s1	ZINC001171115301	1384448796	/nfs/dbraw/zinc/44/87/96/1384448796.db2.gz	IVLSHBLBFVXYHM-GFCCVEGCSA-N	0	3	345.306	3.165	20	30		EGEDHN
CCCc1occc1C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001171116119	1384448830	/nfs/dbraw/zinc/44/88/30/1384448830.db2.gz	WEBIFFLKVBYFMI-UHFFFAOYSA-N	0	3	343.402	3.153	20	30		EGEDHN
C[C@@H](Cc1cccc(C#N)c1)NCc1cccnc1Br	ZINC001171193995	1384465326	/nfs/dbraw/zinc/46/53/26/1384465326.db2.gz	FFFNMYXYZSCFDR-LBPRGKRZSA-N	0	3	330.229	3.437	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1CCC[C@H](NC(=O)OC(C)(C)C)C1	ZINC001171204095	1384467822	/nfs/dbraw/zinc/46/78/22/1384467822.db2.gz	SXKNXGSYKBRYJS-QAPCUYQASA-N	0	3	343.471	3.478	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1C[C@@H]2CN(C(=O)OC(C)(C)C)[C@H]2C1	ZINC001171232472	1384475327	/nfs/dbraw/zinc/47/53/27/1384475327.db2.gz	STKVSKJSEDFSJZ-OLMNPRSZSA-N	0	3	341.455	3.040	20	30		EGEDHN
N#Cc1cccc(N2CCN([C@H]3CCc4c(F)cccc4C3)CC2)c1	ZINC001171443089	1384525148	/nfs/dbraw/zinc/52/51/48/1384525148.db2.gz	WKPDCUJMGJJMOY-IBGZPJMESA-N	0	3	335.426	3.377	20	30		EGEDHN
CCCCCCCCC(=O)NCCCNCc1cccnc1OC	ZINC001171822539	1384651212	/nfs/dbraw/zinc/65/12/12/1384651212.db2.gz	HVEQPCPIGXNONP-UHFFFAOYSA-N	0	3	335.492	3.437	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC001172318714	1384769170	/nfs/dbraw/zinc/76/91/70/1384769170.db2.gz	HXCNCSCLHKCASY-SFHVURJKSA-N	0	3	331.463	3.307	20	30		EGEDHN
C[C@H](CCCC#N)N1CCO[C@]2(CCC[C@H]2COc2cccnc2)C1	ZINC001172498940	1384805650	/nfs/dbraw/zinc/80/56/50/1384805650.db2.gz	PLRACSHGPMDNIT-WSTZPKSXSA-N	0	3	343.471	3.414	20	30		EGEDHN
CC[C@H](N[C@H]1CCN(C(=O)OC(C)(C)C)[C@H](C#N)C1)c1ccncc1	ZINC001172976796	1384894374	/nfs/dbraw/zinc/89/43/74/1384894374.db2.gz	VFTWCPPETPPAAF-ULQDDVLXSA-N	0	3	344.459	3.414	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H](NCc2cc(C#N)cs2)C[C@H]1C#N	ZINC001172978599	1384894727	/nfs/dbraw/zinc/89/47/27/1384894727.db2.gz	NVUSKOOIQVBLAD-KGLIPLIRSA-N	0	3	346.456	3.001	20	30		EGEDHN
CC[C@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C#N)C1)c1ccncc1	ZINC001172976794	1384894747	/nfs/dbraw/zinc/89/47/47/1384894747.db2.gz	VFTWCPPETPPAAF-IKGGRYGDSA-N	0	3	344.459	3.414	20	30		EGEDHN
CCCCCCCC[C@@H](CCC)N1CC(N2CCN(C)C(=O)C2)C1	ZINC001173310136	1384955617	/nfs/dbraw/zinc/95/56/17/1384955617.db2.gz	QMYCAMLZFBBVBD-GOSISDBHSA-N	0	3	337.552	3.364	20	30		EGEDHN
CCOC(=O)[C@H]1CCCc2sc(Nc3ccncc3C)c(C#N)c21	ZINC001174537112	1385117577	/nfs/dbraw/zinc/11/75/77/1385117577.db2.gz	XDJDDGBOBMJUBK-LBPRGKRZSA-N	0	3	341.436	3.472	20	30		EGEDHN
CCC[C@@H](OC)C(=O)N[C@@H](C)CCCCNCc1ccccc1C#N	ZINC001174649889	1385130005	/nfs/dbraw/zinc/13/00/05/1385130005.db2.gz	KWNCOVDWWKILDR-QFBILLFUSA-N	0	3	345.487	3.138	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H](C)CCCCNCc1cn(C(C)C)nn1	ZINC001174849185	1385159788	/nfs/dbraw/zinc/15/97/88/1385159788.db2.gz	KOJAKSRFUPJRNG-SJORKVTESA-N	0	3	349.523	3.226	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](C)CCCCN[C@@H](C)c2nnc(C)[nH]2)CC1	ZINC001175073823	1385189666	/nfs/dbraw/zinc/18/96/66/1385189666.db2.gz	ITYPANTVUOHFCL-CABCVRRESA-N	0	3	347.507	3.185	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H](C)CCCCNCc2ccn(CC)n2)CC1	ZINC001175083096	1385191984	/nfs/dbraw/zinc/19/19/84/1385191984.db2.gz	VBWOIGRQBSSHRN-KRWDZBQOSA-N	0	3	346.519	3.414	20	30		EGEDHN
Cc1ccc(C(=O)NCCCNCc2ccc(C#N)cc2F)cc1C	ZINC001175134184	1385200362	/nfs/dbraw/zinc/20/03/62/1385200362.db2.gz	HICGGSAEJVCJKT-UHFFFAOYSA-N	0	3	339.414	3.224	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H](C)CCCCN[C@H](C)c2nnc(CC)[nH]2)C1	ZINC001175158990	1385207744	/nfs/dbraw/zinc/20/77/44/1385207744.db2.gz	MLLXVZKFTBYQFM-LSDHHAIUSA-N	0	3	347.507	3.049	20	30		EGEDHN
C[C@@H](CCCCNCc1cc(F)ccc1C#N)NC(=O)C1(CF)CC1	ZINC001175189675	1385215605	/nfs/dbraw/zinc/21/56/05/1385215605.db2.gz	HCVTXVHOKZRSLH-AWEZNQCLSA-N	0	3	349.425	3.212	20	30		EGEDHN
CC(C)CCC(=O)NCC[C@H]1CCN(Cc2ccc(F)c(C#N)c2)C1	ZINC001317774937	1385468228	/nfs/dbraw/zinc/46/82/28/1385468228.db2.gz	MLPGWKGPGOWXIU-INIZCTEOSA-N	0	3	345.462	3.462	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1cc(C)c(F)c(C)c1	ZINC001176303752	1385545289	/nfs/dbraw/zinc/54/52/89/1385545289.db2.gz	YYGSDBUORRUDIZ-UHFFFAOYSA-N	0	3	343.240	3.061	20	30		EGEDHN
O=C(CC#Cc1ccccc1)NCCCNCc1cccc(F)c1F	ZINC001176768393	1385690081	/nfs/dbraw/zinc/69/00/81/1385690081.db2.gz	VECHSVANDPOKCO-UHFFFAOYSA-N	0	3	342.389	3.003	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)C1C[C@H](C)C[C@@H](C)C1	ZINC001177131705	1385826683	/nfs/dbraw/zinc/82/66/83/1385826683.db2.gz	NRKMPRXWKXZDPB-VXGBXAGGSA-N	0	3	331.298	3.063	20	30		EGEDHN
Cc1ccccc1C[C@@H](C)C(=O)NCCCNCc1ccccc1C#N	ZINC001177169258	1385842473	/nfs/dbraw/zinc/84/24/73/1385842473.db2.gz	HDBNSGXIIKUPAG-GOSISDBHSA-N	0	3	349.478	3.341	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)c1nocc1C	ZINC001177460069	1385964419	/nfs/dbraw/zinc/96/44/19/1385964419.db2.gz	OGOAUZPOWOVVPQ-UHFFFAOYSA-N	0	3	339.867	3.348	20	30		EGEDHN
Cn1nc(NC(=O)C(C#N)Cc2cccs2)c2ccc(Cl)nc21	ZINC001177904404	1386079657	/nfs/dbraw/zinc/07/96/57/1386079657.db2.gz	PEPYULZSQKZOAG-SECBINFHSA-N	0	3	345.815	3.004	20	30		EGEDHN
CCCc1nc(CNCCCCCCNC(=O)C#CC2CC2)cs1	ZINC001178438841	1386217573	/nfs/dbraw/zinc/21/75/73/1386217573.db2.gz	YYWHNPTWKZEKCR-UHFFFAOYSA-N	0	3	347.528	3.275	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@@H](NCc3ccc4cc[nH]c4c3)C2=O)cc1	ZINC001178468798	1386227491	/nfs/dbraw/zinc/22/74/91/1386227491.db2.gz	FMDHCFWQVOAWME-LJQANCHMSA-N	0	3	344.418	3.325	20	30		EGEDHN
C[C@@H](NCc1cccc(OCC#N)c1)c1ccc(-n2cncn2)cc1	ZINC001319783881	1386295292	/nfs/dbraw/zinc/29/52/92/1386295292.db2.gz	IMSVJUPKIZYWDH-OAHLLOKOSA-N	0	3	333.395	3.020	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)CC1CC(F)(F)C1	ZINC001179009234	1386375312	/nfs/dbraw/zinc/37/53/12/1386375312.db2.gz	DSNFQYQJJZBQGW-YJBOKZPZSA-N	0	3	346.421	3.053	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCCCCCN[C@@H](C)c1nnc(CC)[nH]1	ZINC001179212815	1386424951	/nfs/dbraw/zinc/42/49/51/1386424951.db2.gz	XWJZPQOBGCUULZ-HNNXBMFYSA-N	0	3	349.523	3.297	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCCCCCCNCc1nccn1CC	ZINC001179340120	1386456690	/nfs/dbraw/zinc/45/66/90/1386456690.db2.gz	TXSAMKUDEJCXBW-QGZVFWFLSA-N	0	3	334.508	3.272	20	30		EGEDHN
C=CCC1(C(=O)NCCCCCCNCc2cnns2)CCC1	ZINC001179492964	1386497472	/nfs/dbraw/zinc/49/74/72/1386497472.db2.gz	WCKKEKFPYNEKKL-UHFFFAOYSA-N	0	3	336.505	3.051	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1cc2c(C)cccn2c1)C1CC1	ZINC001698654814	1406304808	/nfs/dbraw/zinc/30/48/08/1406304808.db2.gz	XQBHHLSMWKUEMW-LJQANCHMSA-N	0	3	345.874	3.488	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)CCc1ccccc1	ZINC001179994631	1386663238	/nfs/dbraw/zinc/66/32/38/1386663238.db2.gz	VSZAICYHQOFDTH-UGKGYDQZSA-N	0	3	346.474	3.250	20	30		EGEDHN
CCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2cc(F)ccc2C#N)C1	ZINC001180407181	1386787792	/nfs/dbraw/zinc/78/77/92/1386787792.db2.gz	GNKGRGFWDDFKPS-AUUYWEPGSA-N	0	3	331.435	3.072	20	30		EGEDHN
CC(C)c1ncsc1C(=O)N[C@H](C)CNCc1ccc(C#N)s1	ZINC001321674422	1386954750	/nfs/dbraw/zinc/95/47/50/1386954750.db2.gz	QWDGYNXBAKGUNF-LLVKDONJSA-N	0	3	348.497	3.108	20	30		EGEDHN
Cc1cnc(CNC[C@]2(C)CN(C(=O)C#CC(C)(C)C)C[C@H]2C)s1	ZINC001181419740	1386991042	/nfs/dbraw/zinc/99/10/42/1386991042.db2.gz	OVMVBHSYSLFFAA-AUUYWEPGSA-N	0	3	347.528	3.075	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](N[C@@H](C)c2ccc(F)c(F)c2)C1	ZINC001182112846	1387107074	/nfs/dbraw/zinc/10/70/74/1387107074.db2.gz	HHSRNSBWNYFLMR-GOEBONIOSA-N	0	3	334.410	3.410	20	30		EGEDHN
CC#CCCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2ncc(C)s2)C1	ZINC001182294452	1387140767	/nfs/dbraw/zinc/14/07/67/1387140767.db2.gz	UDNRMNYWMRJXHJ-DNVCBOLYSA-N	0	3	347.528	3.219	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](C)[C@](C)(CNCc3csc(C)n3)C2)C1	ZINC001182565198	1387188565	/nfs/dbraw/zinc/18/85/65/1387188565.db2.gz	RKDBKNGMAGHPAZ-AUUYWEPGSA-N	0	3	347.528	3.382	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](NCc2ccc(Cl)c(OC)c2)C1	ZINC001182940514	1387249370	/nfs/dbraw/zinc/24/93/70/1387249370.db2.gz	UCBJEWDWFZMEKS-OAHLLOKOSA-N	0	3	336.863	3.395	20	30		EGEDHN
CN1CCC(N(Cc2ccco2)C(=O)c2ccc(C#N)cc2F)CC1	ZINC001336434250	1389099233	/nfs/dbraw/zinc/09/92/33/1389099233.db2.gz	XGRIGHLGUXFFCI-UHFFFAOYSA-N	0	3	341.386	3.027	20	30		EGEDHN
C[C@H](CN(C)C(=O)C1CC(C)(C)C1)NCc1ccc(F)c(C#N)c1	ZINC001331441537	1389750263	/nfs/dbraw/zinc/75/02/63/1389750263.db2.gz	NGSAYFNFBHOSCF-CYBMUJFWSA-N	0	3	331.435	3.070	20	30		EGEDHN
C[C@@H](CNCc1ccccc1C#N)CNC(=O)CCc1ccsc1	ZINC001698749526	1406400437	/nfs/dbraw/zinc/40/04/37/1406400437.db2.gz	VXWCUOLTHUBYIS-HNNXBMFYSA-N	0	3	341.480	3.094	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N1CC[C@@H](C(C)(C)C)C1	ZINC001339483378	1390042560	/nfs/dbraw/zinc/04/25/60/1390042560.db2.gz	IQEMDCBNZFSEGK-JKSUJKDBSA-N	0	3	331.508	3.146	20	30		EGEDHN
C[C@@H](CNCc1ccccc1C#N)CNC(=O)c1cc(Cl)cs1	ZINC001698764921	1406420670	/nfs/dbraw/zinc/42/06/70/1406420670.db2.gz	FZMOJTBNGBVSAV-LBPRGKRZSA-N	0	3	347.871	3.429	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1cc(F)ccc1OC[C@H]1CCCO1	ZINC001339924086	1390190922	/nfs/dbraw/zinc/19/09/22/1390190922.db2.gz	XLBSVNPRRJSLJK-CABCVRRESA-N	0	3	336.407	3.006	20	30		EGEDHN
N#Cc1c2[nH]c3ccccc3n2c(=O)cc1CN1CC2CCC1CC2	ZINC001341666021	1390515407	/nfs/dbraw/zinc/51/54/07/1390515407.db2.gz	IVPTXVTYXPQYKQ-BCLQGDPASA-N	0	3	332.407	3.098	20	30		EGEDHN
CCCn1ncc(C(=O)C(C#N)c2nccn2Cc2ccccc2)c1C	ZINC001342270801	1390593751	/nfs/dbraw/zinc/59/37/51/1390593751.db2.gz	ZCZIDPWDXFPAGO-KRWDZBQOSA-N	0	3	347.422	3.336	20	30		EGEDHN
N#CC(C(=O)c1cc(C2CC2)[nH]n1)c1nccn1Cc1ccccc1	ZINC001342604339	1390631033	/nfs/dbraw/zinc/63/10/33/1390631033.db2.gz	OSAOFZNKMCTKPG-HNNXBMFYSA-N	0	3	331.379	3.022	20	30		EGEDHN
C=CCN1CCC(Nc2ncc(Br)c3cccnc32)CC1	ZINC001342897918	1390669657	/nfs/dbraw/zinc/66/96/57/1390669657.db2.gz	LESLRVJWLILKJK-UHFFFAOYSA-N	0	3	347.260	3.455	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N1CCC[C@@H]1c1nc2ccccc2n1CC	ZINC001343410396	1390712185	/nfs/dbraw/zinc/71/21/85/1390712185.db2.gz	YMUMKZKJESAELO-MAUKXSAKSA-N	0	3	340.471	3.403	20	30		EGEDHN
N#CC(C(=O)CCCc1ccccn1)C(=O)Nc1ccccc1Cl	ZINC001343457087	1390715360	/nfs/dbraw/zinc/71/53/60/1390715360.db2.gz	YHBZIJAHUDNRMP-AWEZNQCLSA-N	0	3	341.798	3.405	20	30		EGEDHN
Cc1cc(CCC(=O)C(C#N)C(=O)Nc2ccc(F)c(Cl)c2)no1	ZINC001343599162	1390725609	/nfs/dbraw/zinc/72/56/09/1390725609.db2.gz	KMNNWVOKOHVZPL-GFCCVEGCSA-N	0	3	349.749	3.056	20	30		EGEDHN
C=C(C)Cn1c([C@H]2C[C@@H]2C)nnc1N1CCN(C2CCCC2)CC1	ZINC001343639496	1390728055	/nfs/dbraw/zinc/72/80/55/1390728055.db2.gz	RQBXWECVKQHWAK-RDJZCZTQSA-N	0	3	329.492	3.042	20	30		EGEDHN
N#Cc1ccc(F)c(CNC2(CNC(=O)C3CCCC3)CCCC2)c1	ZINC001698793641	1406458579	/nfs/dbraw/zinc/45/85/79/1406458579.db2.gz	NALOCZWEAQYDPB-UHFFFAOYSA-N	0	3	343.446	3.406	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCCCOc1cccc(C#N)c1	ZINC001344325759	1390782250	/nfs/dbraw/zinc/78/22/50/1390782250.db2.gz	JHSVGGDHCSGCLS-QGZVFWFLSA-N	0	3	336.395	3.200	20	30		EGEDHN
N#CC(C(=O)CCOCC(F)F)c1nc2c(cccc2Cl)[nH]1	ZINC001344930882	1390825790	/nfs/dbraw/zinc/82/57/90/1390825790.db2.gz	PXCDXNVVFSQQHO-QMMMGPOBSA-N	0	3	327.718	3.064	20	30		EGEDHN
C=CCC[C@@H]1CCCN1c1nnc([C@H]2CCCN(C)C2)n1CC1CC1	ZINC001345100008	1390837183	/nfs/dbraw/zinc/83/71/83/1390837183.db2.gz	RVPYTEBBIIFRCH-ZWKOTPCHSA-N	0	3	343.519	3.432	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)c1cnn(CC(C)C)c1C(F)F	ZINC001345645924	1390871943	/nfs/dbraw/zinc/87/19/43/1390871943.db2.gz	CIICEQXXZMVYCM-NSHDSACASA-N	0	3	335.358	3.183	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)Cc1cccc(OC(F)(F)F)c1	ZINC001346095999	1390907213	/nfs/dbraw/zinc/90/72/13/1390907213.db2.gz	MEGOWXCVMBKOAM-ZDUSSCGKSA-N	0	3	337.301	3.221	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H]2Cc3ccc(F)cc32)CCCC1	ZINC001698800513	1406474946	/nfs/dbraw/zinc/47/49/46/1406474946.db2.gz	LTDQHZICAIDCPT-INIZCTEOSA-N	0	3	336.838	3.237	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)[C@@H]1C[C@H]1c1ccc(OC(F)F)cc1	ZINC001347337816	1391056737	/nfs/dbraw/zinc/05/67/37/1391056737.db2.gz	MIDKNXOXOSFIJZ-RRFJBIMHSA-N	0	3	345.349	3.484	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)[C@@H]1C[C@H]1c1ccc(OC(F)F)cc1	ZINC001347337820	1391057110	/nfs/dbraw/zinc/05/71/10/1391057110.db2.gz	MIDKNXOXOSFIJZ-ZNMIVQPWSA-N	0	3	345.349	3.484	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)Nc1nnc([C@@H]2CCCO2)s1	ZINC001354536587	1392151059	/nfs/dbraw/zinc/15/10/59/1392151059.db2.gz	OMTSNRSAYJTLAE-OLZOCXBDSA-N	0	3	340.493	3.406	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N1CCC[C@@H](c2nc3c(s2)CCC3)C1	ZINC001354842113	1392172251	/nfs/dbraw/zinc/17/22/51/1392172251.db2.gz	RXQCEEALRVDCAX-ZIAGYGMSSA-N	0	3	333.501	3.021	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)Cc2cccc3cccnc32)C1	ZINC001479386985	1392230816	/nfs/dbraw/zinc/23/08/16/1392230816.db2.gz	WWBCIAIIDVNNPL-CZIWCDLHSA-N	0	3	343.858	3.014	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1cccc(OC)c1	ZINC001479834222	1392419971	/nfs/dbraw/zinc/41/99/71/1392419971.db2.gz	OAKGEWXONJCMFK-RHSMWYFYSA-N	0	3	336.863	3.421	20	30		EGEDHN
CCCN(C(=O)[C@H](C)C#N)C1CCN(Cc2cccc(OC)c2)CC1	ZINC001479992169	1392523816	/nfs/dbraw/zinc/52/38/16/1392523816.db2.gz	WSFMQJDMSHOGOV-MRXNPFEDSA-N	0	3	343.471	3.058	20	30		EGEDHN
CCCCC(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)c(F)c1	ZINC001480337972	1392695044	/nfs/dbraw/zinc/69/50/44/1392695044.db2.gz	GPHJBPQQKRAZHR-QGZVFWFLSA-N	0	3	331.435	3.358	20	30		EGEDHN
C[C@H](CNC(=O)CC(C1CC1)C1CC1)NCc1ccc(F)c(C#N)c1	ZINC001480600366	1392814335	/nfs/dbraw/zinc/81/43/35/1392814335.db2.gz	XEHIUHKHHUNTSC-CYBMUJFWSA-N	0	3	343.446	3.118	20	30		EGEDHN
CC(C)C[C@H](CNCc1ccc(C#N)s1)NC(=O)C1CC2(CC2)C1	ZINC001698874245	1406596369	/nfs/dbraw/zinc/59/63/69/1406596369.db2.gz	SOKYMJYZCGZWNT-OAHLLOKOSA-N	0	3	345.512	3.430	20	30		EGEDHN
C=C(Br)CN[C@@H](CNC(=O)c1ccc(C)s1)C(C)C	ZINC001698957167	1406707856	/nfs/dbraw/zinc/70/78/56/1406707856.db2.gz	NZOAUIPVBRDJOG-LBPRGKRZSA-N	0	3	345.306	3.309	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cccc(OC)c2C)CCCC1	ZINC001482231917	1394826100	/nfs/dbraw/zinc/82/61/00/1394826100.db2.gz	MSKSNUYXLZMZCU-UHFFFAOYSA-N	0	3	336.863	3.388	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cc(Cl)cc(OC)c1)C(C)C	ZINC001698972653	1406737182	/nfs/dbraw/zinc/73/71/82/1406737182.db2.gz	GMNJQWOIHAEYQV-HNNXBMFYSA-N	0	3	345.270	3.445	20	30		EGEDHN
C[C@H](C(=O)NCC1(NCc2ccc(C#N)s2)CCC1)c1ccco1	ZINC001484650929	1395462540	/nfs/dbraw/zinc/46/25/40/1395462540.db2.gz	KCDBDEWTEZOBTA-ZDUSSCGKSA-N	0	3	343.452	3.145	20	30		EGEDHN
C=C(Br)CN[C@H](CNC(=O)c1cccc(F)c1)C(C)C	ZINC001496522307	1396712932	/nfs/dbraw/zinc/71/29/32/1396712932.db2.gz	YMGAPRMHONMFMU-CQSZACIVSA-N	0	3	343.240	3.078	20	30		EGEDHN
C[C@@H](CNCc1ccc(F)c(C#N)c1)NC(=O)c1ccccc1Cl	ZINC001498168948	1396930813	/nfs/dbraw/zinc/93/08/13/1396930813.db2.gz	UPZINXZNHIAKNZ-LBPRGKRZSA-N	0	3	345.805	3.259	20	30		EGEDHN
CCCN(CCNC(=O)CC1(C)CC1)Cc1ccc(F)c(C#N)c1	ZINC001691186332	1405124290	/nfs/dbraw/zinc/12/42/90/1405124290.db2.gz	NSXPYPXLPSYETH-UHFFFAOYSA-N	0	3	331.435	3.216	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](CCNC(=O)CC3CCC3)C2)s1	ZINC001691880926	1405604794	/nfs/dbraw/zinc/60/47/94/1405604794.db2.gz	YJXBCQQXPHMEHY-OAHLLOKOSA-N	0	3	331.485	3.138	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CCN(CCc2ccc(OC)cc2)C1	ZINC001698553018	1406150317	/nfs/dbraw/zinc/15/03/17/1406150317.db2.gz	WOHJNLIZRQLNSG-QGZVFWFLSA-N	0	3	330.472	3.031	20	30		EGEDHN
C=C(Br)CNCC1(NC(=O)C2=CCCC2)CCCC1	ZINC001732227157	1428475245	/nfs/dbraw/zinc/47/52/45/1428475245.db2.gz	GHYWATRJSYEKJJ-UHFFFAOYSA-N	0	3	327.266	3.024	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1cnc(C2CC2)s1)C1CC1	ZINC001732251864	1428493766	/nfs/dbraw/zinc/49/37/66/1428493766.db2.gz	TVNISRHYQHLEGK-INIZCTEOSA-N	0	3	339.892	3.261	20	30		EGEDHN
C[C@H](CNCc1ccc(F)c(C#N)c1)NC(=O)CCC1CCCC1	ZINC001699353396	1412660923	/nfs/dbraw/zinc/66/09/23/1412660923.db2.gz	ZGKDPMAKDNAKET-CQSZACIVSA-N	0	3	331.435	3.262	20	30		EGEDHN
COc1ccc(C#N)cc1CNC[C@@H](C)NC(=O)C1CCCCCC1	ZINC001699357433	1412665012	/nfs/dbraw/zinc/66/50/12/1412665012.db2.gz	ARXORIDLEGOGCD-OAHLLOKOSA-N	0	3	343.471	3.132	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H](C)CNCc2ccc(C#N)s2)c(F)cc1F	ZINC001699407691	1412721205	/nfs/dbraw/zinc/72/12/05/1412721205.db2.gz	IJDOZYSMZVNXEZ-NSHDSACASA-N	0	3	349.406	3.115	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)C(C)(C)C1CCC1	ZINC001699452491	1412794396	/nfs/dbraw/zinc/79/43/96/1412794396.db2.gz	JEMSLKBXRKUCTG-OAHLLOKOSA-N	0	3	327.472	3.321	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](NC(=O)C2=CCCC2)C2CCCC2)s1	ZINC001699794014	1413201830	/nfs/dbraw/zinc/20/18/30/1413201830.db2.gz	YBHXYKRTFOKKTN-SFHVURJKSA-N	0	3	343.496	3.495	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1ccc2cccnc2c1)C(C)C	ZINC001732567559	1428760920	/nfs/dbraw/zinc/76/09/20/1428760920.db2.gz	JAFKAGXRYOFFQA-KRWDZBQOSA-N	0	3	331.847	3.331	20	30		EGEDHN
C=C(Br)CNC1CCC(N(C)C(=O)CCC2CC2)CC1	ZINC001700431903	1413995450	/nfs/dbraw/zinc/99/54/50/1413995450.db2.gz	DUEJTURQIAOZMV-UHFFFAOYSA-N	0	3	343.309	3.444	20	30		EGEDHN
COc1ccc(C#N)cc1CNC[C@H](NC(=O)CC(C)C)C(C)(C)C	ZINC001700978427	1414617000	/nfs/dbraw/zinc/61/70/00/1414617000.db2.gz	KKZQAKDWCATJQH-SFHVURJKSA-N	0	3	345.487	3.233	20	30		EGEDHN
Cc1cscc1C(=O)NC[C@@H](NCc1ccc(C#N)s1)C1CC1	ZINC001713107601	1417668044	/nfs/dbraw/zinc/66/80/44/1417668044.db2.gz	NMPPWFQGDMELRH-MRXNPFEDSA-N	0	3	345.493	3.288	20	30		EGEDHN
CC(C)CC(=O)N[C@@H](C)[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001713270846	1417882836	/nfs/dbraw/zinc/88/28/36/1417882836.db2.gz	FMAXMLRCKFDZSF-LPHOPBHVSA-N	0	3	327.472	3.321	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)Cc1ccc(F)c(Cl)c1	ZINC001713418875	1418043073	/nfs/dbraw/zinc/04/30/73/1418043073.db2.gz	MFIWTMWJVCFQNO-LLVKDONJSA-N	0	3	333.234	3.259	20	30		EGEDHN
C[C@H](CC(=O)N(C)C1CCN(Cc2ccc(C#N)cc2)CC1)C1CC1	ZINC001713785558	1418602540	/nfs/dbraw/zinc/60/25/40/1418602540.db2.gz	UBMOOFOYIBMSEH-MRXNPFEDSA-N	0	3	339.483	3.417	20	30		EGEDHN
CCC[C@@H](CC)C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001713963237	1418743293	/nfs/dbraw/zinc/74/32/93/1418743293.db2.gz	YLIDSUVWLOSWEN-DJIMGWMZSA-N	0	3	331.435	3.260	20	30		EGEDHN
CC[C@H](N[C@@H](C)CNC(=O)c1cc(C#N)c[nH]1)c1ccc(F)cc1F	ZINC001714222601	1419017178	/nfs/dbraw/zinc/01/71/78/1419017178.db2.gz	LJGLGKWNXKXTSD-ZBEGNZNMSA-N	0	3	346.381	3.024	20	30		EGEDHN
Cc1ccc(C(=O)NCC[C@@H](C)NCc2ccccc2C#N)s1	ZINC001714456442	1419188858	/nfs/dbraw/zinc/18/88/58/1419188858.db2.gz	VDHUZUDBHZPTHN-CYBMUJFWSA-N	0	3	327.453	3.226	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1cnn(C2CCCCC2)c1	ZINC001714494581	1419218516	/nfs/dbraw/zinc/21/85/16/1419218516.db2.gz	HQDXYKNCNXKDNG-AWEZNQCLSA-N	0	3	338.883	3.239	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)C2(CCOC)CCCC2)CCCC1	ZINC001714514504	1419241934	/nfs/dbraw/zinc/24/19/34/1419241934.db2.gz	ZLOLDOXCSMHWHZ-UHFFFAOYSA-N	0	3	342.911	3.354	20	30		EGEDHN
CCCN(CCNC(=O)c1cocc1C)Cc1ccc(F)c(C#N)c1	ZINC001714655418	1419436157	/nfs/dbraw/zinc/43/61/57/1419436157.db2.gz	DCCMDSVJECDGGX-UHFFFAOYSA-N	0	3	343.402	3.241	20	30		EGEDHN
CCCN(CCNC(=O)C1(C)CCC1)Cc1ccc(OC)c(C#N)c1	ZINC001714656316	1419437955	/nfs/dbraw/zinc/43/79/55/1419437955.db2.gz	PKAYKAFNSMZMCX-UHFFFAOYSA-N	0	3	343.471	3.085	20	30		EGEDHN
C[C@](CNCc1ccc(C#N)cc1F)(NC(=O)CC1(C)CC1)C1CC1	ZINC001715120665	1419865378	/nfs/dbraw/zinc/86/53/78/1419865378.db2.gz	WXODUXUBTKRWMD-HXUWFJFHSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)CCc1ccc(F)cc1)C1CC1	ZINC001715120651	1419865544	/nfs/dbraw/zinc/86/55/44/1419865544.db2.gz	WTAJETNBFFDROA-GOSISDBHSA-N	0	3	338.854	3.385	20	30		EGEDHN
C=C(Br)CN[C@@H](CNC(=O)C(C1CC1)C1CC1)C(C)C	ZINC001715689678	1420296013	/nfs/dbraw/zinc/29/60/13/1420296013.db2.gz	FRGDCGAEAVBJNM-AWEZNQCLSA-N	0	3	343.309	3.062	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cc2nc(C)ccc2o1)C(C)C	ZINC001715709712	1420304893	/nfs/dbraw/zinc/30/48/93/1420304893.db2.gz	CNDVJGOEYRZMDC-AWEZNQCLSA-N	0	3	335.835	3.233	20	30		EGEDHN
CN(CCN(C)C(=O)c1cc(C#N)c[nH]1)Cc1ccc(C(F)F)cc1	ZINC001715793724	1420346238	/nfs/dbraw/zinc/34/62/38/1420346238.db2.gz	QRMUFDXQJQESKH-UHFFFAOYSA-N	0	3	346.381	3.028	20	30		EGEDHN
C[C@H](CN(C)Cc1cccc(C#N)c1)NC(=O)c1cccnc1C1CC1	ZINC001716032548	1420491602	/nfs/dbraw/zinc/49/16/02/1420491602.db2.gz	RRZCEZWAGSBCIJ-OAHLLOKOSA-N	0	3	348.450	3.081	20	30		EGEDHN
C[C@H](CNCc1ccc(F)c(C#N)c1)NC(=O)c1cccc(Cl)c1	ZINC001716421036	1420648515	/nfs/dbraw/zinc/64/85/15/1420648515.db2.gz	SKUGMAURQBWFIK-GFCCVEGCSA-N	0	3	345.805	3.259	20	30		EGEDHN
CC(C)c1ncc(C(=O)N[C@@H](C)CNCc2ccc(C#N)s2)s1	ZINC001716466874	1420679872	/nfs/dbraw/zinc/67/98/72/1420679872.db2.gz	BJMJIEKYBRTLFM-NSHDSACASA-N	0	3	348.497	3.108	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)c2ccns2)CC1	ZINC001717355448	1421290141	/nfs/dbraw/zinc/29/01/41/1421290141.db2.gz	MWESUSBPLRFNEY-UHFFFAOYSA-N	0	3	327.881	3.070	20	30		EGEDHN
C=C(Br)CNCC(C)(C)CN(C)C(=O)[C@@H](C)C1CC1	ZINC001717451848	1421381805	/nfs/dbraw/zinc/38/18/05/1421381805.db2.gz	JKUDUOKQKVXFPE-LBPRGKRZSA-N	0	3	331.298	3.015	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@@](C)(CNCc2ccccc2C#N)C1	ZINC001733433491	1429640883	/nfs/dbraw/zinc/64/08/83/1429640883.db2.gz	AFSZWDAROQIZNS-FQEVSTJZSA-N	0	3	327.472	3.323	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@](C)(CNCc2ccccc2C#N)C1	ZINC001733433493	1429640977	/nfs/dbraw/zinc/64/09/77/1429640977.db2.gz	AFSZWDAROQIZNS-HXUWFJFHSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)c2cc(CC)on2)CC1	ZINC001725026040	1425445198	/nfs/dbraw/zinc/44/51/98/1425445198.db2.gz	NPMAABIFKBPKAH-UHFFFAOYSA-N	0	3	339.867	3.164	20	30		EGEDHN
CCCC(=O)N1CCCC[C@H]1CNCC#Cc1ccccc1Cl	ZINC001725027749	1425448137	/nfs/dbraw/zinc/44/81/37/1425448137.db2.gz	LBDKVWDXNJJBFH-KRWDZBQOSA-N	0	3	332.875	3.462	20	30		EGEDHN
C[C@@H](CNC(=O)C12CCC(CC1)CC2)N(C)Cc1cccc(C#N)c1	ZINC001725195481	1425748217	/nfs/dbraw/zinc/74/82/17/1425748217.db2.gz	OEDBDFWSOQQXPI-BQJIDLTASA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C(Br)CNC[C@H](C1CC1)N(C)C(=O)CC1CCCC1	ZINC001725448339	1426113074	/nfs/dbraw/zinc/11/30/74/1426113074.db2.gz	FIEKTVPCGGWPOL-OAHLLOKOSA-N	0	3	343.309	3.302	20	30		EGEDHN
C[C@H](CNC(=O)C1CCC2(CC2)CC1)NCc1ccc(F)c(C#N)c1	ZINC001731607533	1427652844	/nfs/dbraw/zinc/65/28/44/1427652844.db2.gz	VATQFQUSHXYMSK-CQSZACIVSA-N	0	3	343.446	3.262	20	30		EGEDHN
C[C@H](CNC(=O)[C@@H]1CC[C@@H](C)CC1)NCc1ccc(F)c(C#N)c1	ZINC001731632134	1427685823	/nfs/dbraw/zinc/68/58/23/1427685823.db2.gz	ZTCKOTFNZBWCNG-IIAWOOMASA-N	0	3	331.435	3.118	20	30		EGEDHN
C[C@H](CCNC(=O)c1ccc(Cl)o1)NCc1cc(C#N)ccc1F	ZINC001731722843	1427795241	/nfs/dbraw/zinc/79/52/41/1427795241.db2.gz	KLKJTQAMYLDJDI-LLVKDONJSA-N	0	3	349.793	3.242	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)C(C)(C)c1cccc(OC)c1	ZINC001731738154	1427821695	/nfs/dbraw/zinc/82/16/95/1427821695.db2.gz	NWKPRHUYZYCYIA-AWEZNQCLSA-N	0	3	338.879	3.210	20	30		EGEDHN
C[C@@H](N[C@@H](C)CCNC(=O)C#CC(C)(C)C)c1nc2ccccc2o1	ZINC001733905466	1437723484	/nfs/dbraw/zinc/72/34/84/1437723484.db2.gz	IIKWPAZPQRZVJW-LSDHHAIUSA-N	0	3	341.455	3.423	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1cnn(C(F)F)c1	ZINC001752156871	1440147369	/nfs/dbraw/zinc/14/73/69/1440147369.db2.gz	IDSUETMQNOEANF-DGCLKSJQSA-N	0	3	346.809	3.004	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)CCc1cscn1	ZINC001752159262	1440148514	/nfs/dbraw/zinc/14/85/14/1440148514.db2.gz	ZEZLABUOSFIKMT-HIFRSBDPSA-N	0	3	341.908	3.187	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCCN(CC)Cc2ccc([N+](=O)[O-])cc2)C1	ZINC001752212814	1440155263	/nfs/dbraw/zinc/15/52/63/1440155263.db2.gz	RFORUTPBNQBJOU-UHFFFAOYSA-N	0	3	345.443	3.279	20	30		EGEDHN
CCN(CCCNC(=O)CC#Cc1ccccc1)Cc1ncccc1C	ZINC001752230235	1440158300	/nfs/dbraw/zinc/15/83/00/1440158300.db2.gz	SGQOVJSCODXFCT-UHFFFAOYSA-N	0	3	349.478	3.160	20	30		EGEDHN
CC[C@@H](C)C(=O)NCCCN(Cc1ccc(F)c(C#N)c1)C1CC1	ZINC001752244648	1440159923	/nfs/dbraw/zinc/15/99/23/1440159923.db2.gz	ZRCVISVYHDNJCI-CQSZACIVSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=C1CCC(C(=O)N(C)C2CCN(CCOCC3CCC3)CC2)CC1	ZINC001752308341	1440168914	/nfs/dbraw/zinc/16/89/14/1440168914.db2.gz	MXJBYSXSASARHD-UHFFFAOYSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1CC12CCN(Cc1cccnc1)CC2	ZINC001752426241	1440176967	/nfs/dbraw/zinc/17/69/67/1440176967.db2.gz	ICXFOAGYQVIGGF-LJQANCHMSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1CC12CCN(Cc1cccnc1)CC2	ZINC001752426240	1440176991	/nfs/dbraw/zinc/17/69/91/1440176991.db2.gz	ICXFOAGYQVIGGF-IBGZPJMESA-N	0	3	339.483	3.321	20	30		EGEDHN
C=C(C)CN1CCC(N(CCC)C(=O)c2cc(N(C)C)ccn2)CC1	ZINC001752442642	1440181671	/nfs/dbraw/zinc/18/16/71/1440181671.db2.gz	XMWCDWWMUPVPCI-UHFFFAOYSA-N	0	3	344.503	3.040	20	30		EGEDHN
C#CCCCC(=O)NC[C@@H](NCc1ccc(F)cc1Cl)C1CC1	ZINC001752459411	1440183602	/nfs/dbraw/zinc/18/36/02/1440183602.db2.gz	QHSHGBDEWLSTON-QGZVFWFLSA-N	0	3	336.838	3.267	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@@H](CN(C)Cc2ocnc2C)C1	ZINC001752508425	1440190062	/nfs/dbraw/zinc/19/00/62/1440190062.db2.gz	SZSAWKHDKUPZLY-INIZCTEOSA-N	0	3	333.476	3.256	20	30		EGEDHN
C=CCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H](C)c1ccncc1	ZINC001752536577	1440194334	/nfs/dbraw/zinc/19/43/34/1440194334.db2.gz	ZOPXOTRWXFAOBA-QRQLOZEOSA-N	0	3	327.472	3.217	20	30		EGEDHN
C=CCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)CO[C@H]1CCCC[C@@H]1C	ZINC001752565197	1440195417	/nfs/dbraw/zinc/19/54/17/1440195417.db2.gz	LLBMYALRPQEZTD-OKYOBFRVSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N[C@H]1C[C@H](N[C@H](C)c2ccccc2F)C1)OCC	ZINC001752634856	1440197267	/nfs/dbraw/zinc/19/72/67/1440197267.db2.gz	QYYVMFNQIVHVJJ-YKTARERQSA-N	0	3	348.462	3.495	20	30		EGEDHN
O=C(N[C@H]1C[C@@H](NCC#Cc2ccccc2)C1)[C@@H]1CC[C@@H]2C[C@@H]2CC1	ZINC001752746621	1440204862	/nfs/dbraw/zinc/20/48/62/1440204862.db2.gz	UCSGWZHEOJHCQW-CMMDMPAISA-N	0	3	336.479	3.101	20	30		EGEDHN
CCC(=CC(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2OC)C1)CC	ZINC001752752373	1440205034	/nfs/dbraw/zinc/20/50/34/1440205034.db2.gz	VXVKZXDMOOBWFT-HDICACEKSA-N	0	3	341.455	3.050	20	30		EGEDHN
CCCCC1(C(=O)N[C@H]2C[C@@H](NCc3ccc(C#N)cc3F)C2)CC1	ZINC001752758229	1440205250	/nfs/dbraw/zinc/20/52/50/1440205250.db2.gz	PXZRHSFVSZWBKZ-CALCHBBNSA-N	0	3	343.446	3.405	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@H]1CCCN(CC[C@H]2CC2(Cl)Cl)C1	ZINC001752780707	1440208599	/nfs/dbraw/zinc/20/85/99/1440208599.db2.gz	DPWZSIIWAUUWDD-CABCVRRESA-N	0	3	345.314	3.058	20	30		EGEDHN
C#CCCCC(=O)NC[C@H]1CCCN(Cc2cc(F)ccc2C)C1	ZINC001752781688	1440209065	/nfs/dbraw/zinc/20/90/65/1440209065.db2.gz	XEWFXCJXDGAOMO-QGZVFWFLSA-N	0	3	330.447	3.266	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)COC[C@@H](C)c1ccccc1	ZINC001752825283	1440223401	/nfs/dbraw/zinc/22/34/01/1440223401.db2.gz	OXGHJECFZIGMLJ-QUCCMNQESA-N	0	3	344.499	3.354	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H]1CCCCN1C[C@@H]1CC(C)(C)CO1	ZINC001752826662	1440223914	/nfs/dbraw/zinc/22/39/14/1440223914.db2.gz	ALOPROUUJYLYSY-IRXDYDNUSA-N	0	3	336.520	3.375	20	30		EGEDHN
C#CCCCCC(=O)NC1CCC(NCc2nc(C)c(C)s2)CC1	ZINC001752849813	1440233306	/nfs/dbraw/zinc/23/33/06/1440233306.db2.gz	XXTKHDMQBCLYJB-UHFFFAOYSA-N	0	3	347.528	3.471	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H](C)NCc2ccccc2OC2CC2)cc1	ZINC001752893102	1440241206	/nfs/dbraw/zinc/24/12/06/1440241206.db2.gz	ASHFDFORTRJQFW-MRXNPFEDSA-N	0	3	348.446	3.117	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccoc1C1CC1)NCc1ccc(C#N)c(F)c1	ZINC001752893549	1440241363	/nfs/dbraw/zinc/24/13/63/1440241363.db2.gz	CEBYIIVEDGRLAR-LBPRGKRZSA-N	0	3	341.386	3.076	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H](C)NCc2cn(C(C)C)nc2C)CCC1	ZINC001752899420	1440242498	/nfs/dbraw/zinc/24/24/98/1440242498.db2.gz	PPQIRJIGCAVOBP-OAHLLOKOSA-N	0	3	332.492	3.113	20	30		EGEDHN
CC#CCN(C)[C@H]1CCCN(C(=O)c2csc3c2CC[C@@H](C)C3)C1	ZINC001753001146	1440264576	/nfs/dbraw/zinc/26/45/76/1440264576.db2.gz	XOBRVHVJHGZULU-CVEARBPZSA-N	0	3	344.524	3.433	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H]2CCCNC(=O)CC2CC2)c(F)c1	ZINC001753023293	1440270671	/nfs/dbraw/zinc/27/06/71/1440270671.db2.gz	QMZAUUGKMHSHEO-SFHVURJKSA-N	0	3	343.446	3.358	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)NCCC[C@H]1CCCN1Cc1ccccc1C#N	ZINC001753026552	1440271492	/nfs/dbraw/zinc/27/14/92/1440271492.db2.gz	QRNJGINIUZVXKD-OALUTQOASA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCN(C)[C@H]1CCc2c1cc(Cl)cc2Cl	ZINC001753043522	1440277260	/nfs/dbraw/zinc/27/72/60/1440277260.db2.gz	DDTLVGJTQXYQIR-BONVTDFDSA-N	0	3	340.254	3.188	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H]1CCCN1CCOc1cccc(F)c1	ZINC001753107188	1440306719	/nfs/dbraw/zinc/30/67/19/1440306719.db2.gz	ZJPHIUGUIGDSAT-KRWDZBQOSA-N	0	3	334.435	3.141	20	30		EGEDHN
CC#CCCCC(=O)NC[C@H]1CCN(Cc2ccc(C)c(F)c2)C1	ZINC001753132340	1440317225	/nfs/dbraw/zinc/31/72/25/1440317225.db2.gz	MXOGIAFUXQULBS-GOSISDBHSA-N	0	3	330.447	3.266	20	30		EGEDHN
CCCN(CCNC(=O)C1(C(F)F)CCC1)Cc1ccc(C#N)cc1	ZINC001753146592	1440324641	/nfs/dbraw/zinc/32/46/41/1440324641.db2.gz	AKCFAWBLDYOOJK-UHFFFAOYSA-N	0	3	349.425	3.322	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCN(CCC)Cc2ccc(F)c(C#N)c2)C1	ZINC001753147421	1440325303	/nfs/dbraw/zinc/32/53/03/1440325303.db2.gz	CPJNMEHVRRGBLQ-UHFFFAOYSA-N	0	3	343.446	3.382	20	30		EGEDHN
C=C(C)CN(CCNC(=O)Cc1c(C)oc2ccccc21)C1CC1	ZINC001753165608	1440335885	/nfs/dbraw/zinc/33/58/85/1440335885.db2.gz	ZVPSYRYXNCBBGW-UHFFFAOYSA-N	0	3	326.440	3.440	20	30		EGEDHN
C[C@@H]1CCCC[C@H]1C(=O)N(C)CCNCc1ccc(C#N)c(F)c1	ZINC001753223991	1440340341	/nfs/dbraw/zinc/34/03/41/1440340341.db2.gz	TYSJEURPOAPLOC-RHSMWYFYSA-N	0	3	331.435	3.072	20	30		EGEDHN
CN(CCNCc1ccc(C#N)c(F)c1)C(=O)C1CCC(C)(C)CC1	ZINC001753266545	1440344936	/nfs/dbraw/zinc/34/49/36/1440344936.db2.gz	RIVDHIHPPIHPAE-UHFFFAOYSA-N	0	3	345.462	3.462	20	30		EGEDHN
CC(C)COCCN[C@@H](CNC(=O)C#CC(C)(C)C)c1ccccc1	ZINC001753298495	1440353223	/nfs/dbraw/zinc/35/32/23/1440353223.db2.gz	IRMMPQDNDIFVIU-IBGZPJMESA-N	0	3	344.499	3.156	20	30		EGEDHN
C=CCN[C@@H](CNC(=O)c1ccc(C(F)F)nc1)c1ccccc1	ZINC001753298879	1440353289	/nfs/dbraw/zinc/35/32/89/1440353289.db2.gz	OEWPWFNABFIBSO-INIZCTEOSA-N	0	3	331.366	3.266	20	30		EGEDHN
C#CCCN[C@@H](CNC(=O)c1cc2ccsc2[nH]1)c1ccccc1	ZINC001753299909	1440353548	/nfs/dbraw/zinc/35/35/48/1440353548.db2.gz	JJMITAQLDUDXKB-KRWDZBQOSA-N	0	3	337.448	3.313	20	30		EGEDHN
C#CCCN[C@@H](CNC(=O)c1cnc2ccsc2c1)c1ccccc1	ZINC001753302045	1440354451	/nfs/dbraw/zinc/35/44/51/1440354451.db2.gz	SQSRPVKSZZEMOJ-SFHVURJKSA-N	0	3	349.459	3.380	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@H]3CC[C@@H](C2)N3CCCOC)CCCCC1	ZINC001753311453	1440356690	/nfs/dbraw/zinc/35/66/90/1440356690.db2.gz	AZURQHRAVICOHL-HDICACEKSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCN[C@H](CNC(=O)[C@H]1CCc2ccccc2O1)c1ccccc1	ZINC001753311416	1440356814	/nfs/dbraw/zinc/35/68/14/1440356814.db2.gz	NHPRVTPSQDPKOS-UYAOXDASSA-N	0	3	336.435	3.013	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](N(CCC)C(=O)c2[nH]nc3ccccc32)C1	ZINC001753323498	1440365166	/nfs/dbraw/zinc/36/51/66/1440365166.db2.gz	NXOBWNIEZBUCDZ-AWEZNQCLSA-N	0	3	346.862	3.242	20	30		EGEDHN
C[C@H](C(=O)NCC[C@@H]1CCN(Cc2ccc(F)c(C#N)c2)C1)C1CC1	ZINC001753325079	1440366141	/nfs/dbraw/zinc/36/61/41/1440366141.db2.gz	PBDCDOWTQYHGPZ-LSDHHAIUSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=CCCCCCN1C[C@@H]2C[C@H]1CN2C(=O)CC1CC(F)(F)C1	ZINC001753422478	1440395798	/nfs/dbraw/zinc/39/57/98/1440395798.db2.gz	YMGHMRUFBLQORO-HOTGVXAUSA-N	0	3	326.431	3.453	20	30		EGEDHN
C[C@H](C#N)C(=O)N(C)[C@@H]1CCN(Cc2ccc(C(C)(C)C)cc2)C1	ZINC001753434456	1440399617	/nfs/dbraw/zinc/39/96/17/1440399617.db2.gz	WBIDNWFBZLEZEZ-CRAIPNDOSA-N	0	3	327.472	3.176	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N(C)[C@H]1CCN(Cc2cccc(N(C)C)c2)C1	ZINC001753441668	1440402011	/nfs/dbraw/zinc/40/20/11/1440402011.db2.gz	NNXXWGJCPZIYLE-XLIONFOSSA-N	0	3	343.515	3.388	20	30		EGEDHN
C=CCOCCN1CC[C@H](N(C)C(=O)C[C@@H](C)c2ccccc2C)C1	ZINC001753445534	1440403817	/nfs/dbraw/zinc/40/38/17/1440403817.db2.gz	OADSKFHMKGIUFH-MOPGFXCFSA-N	0	3	344.499	3.224	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)[C@@H](CC)OC2CCCCC2)C1	ZINC001753455382	1440408087	/nfs/dbraw/zinc/40/80/87/1440408087.db2.gz	JHDSNQPFOVHNAA-PKOBYXMFSA-N	0	3	334.504	3.060	20	30		EGEDHN
CCN(C(=O)C#CC(C)C)[C@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC001753456024	1440408222	/nfs/dbraw/zinc/40/82/22/1440408222.db2.gz	QINIXTBNZIVYMO-IBGZPJMESA-N	0	3	346.902	3.465	20	30		EGEDHN
CC[C@@H](CNC(=O)[C@@H](C)C1CC1)NCC#Cc1ccccc1Cl	ZINC001753469103	1440413535	/nfs/dbraw/zinc/41/35/35/1440413535.db2.gz	TZBUXQLKTKAYJC-YOEHRIQHSA-N	0	3	332.875	3.222	20	30		EGEDHN
CC[C@H](CNC(=O)C1(C2CC2)CC1)NCC#Cc1cccc(Cl)c1	ZINC001753478540	1440415944	/nfs/dbraw/zinc/41/59/44/1440415944.db2.gz	LQJKBYMEFULBGD-GOSISDBHSA-N	0	3	344.886	3.366	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC1(CNCc2cc(OC)ccn2)CCCC1	ZINC001753503602	1440424004	/nfs/dbraw/zinc/42/40/04/1440424004.db2.gz	LYQJSOGKMNRLEO-UHFFFAOYSA-N	0	3	345.487	3.211	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2ccnc(C3CC3)c2)CCCC1	ZINC001753505002	1440424192	/nfs/dbraw/zinc/42/41/92/1440424192.db2.gz	PBXVWIDRYVPIDB-UHFFFAOYSA-N	0	3	333.863	3.344	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](CCNCc2conc2CC)C1	ZINC001753552506	1440435323	/nfs/dbraw/zinc/43/53/23/1440435323.db2.gz	WUFOPRSKRLTEIF-HNNXBMFYSA-N	0	3	333.476	3.168	20	30		EGEDHN
CC#CCNCc1ccc(CNC(=O)[C@H](C)c2cccc(F)c2)cc1	ZINC001753592548	1440443413	/nfs/dbraw/zinc/44/34/13/1440443413.db2.gz	SABDCWACCJRWEP-MRXNPFEDSA-N	0	3	338.426	3.359	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC2(CN(CCOCC(C)C)C2)CC1	ZINC001753674948	1440463077	/nfs/dbraw/zinc/46/30/77/1440463077.db2.gz	MHOBAGIRLXUSHN-LJQANCHMSA-N	0	3	336.520	3.186	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N(C)[C@@H](C)CNCC#Cc1ccc(F)cc1	ZINC001753710617	1440470533	/nfs/dbraw/zinc/47/05/33/1440470533.db2.gz	GKQMQEBNNUFICH-KVSKMBFKSA-N	0	3	330.447	3.050	20	30		EGEDHN
Cc1cc(F)cc(C(=O)N(C)[C@H](C)CNCc2ccc(C#N)s2)c1	ZINC001753714641	1440471409	/nfs/dbraw/zinc/47/14/09/1440471409.db2.gz	GHHJTGZEMCQCBS-CYBMUJFWSA-N	0	3	345.443	3.318	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCCC[C@@H]1CCNCc1cnc(C)cn1	ZINC001753777984	1440486853	/nfs/dbraw/zinc/48/68/53/1440486853.db2.gz	XUDZJFFNOPZOKF-GOSISDBHSA-N	0	3	344.503	3.248	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@@H]([C@H](C)NCc2ccn(CC)n2)C1	ZINC001753799726	1440490573	/nfs/dbraw/zinc/49/05/73/1440490573.db2.gz	QGKHZPDYOUGTSU-DLBZAZTESA-N	0	3	346.519	3.222	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H](C)[C@@H]1CNCc1ccc(Cl)nc1	ZINC001753819607	1440495307	/nfs/dbraw/zinc/49/53/07/1440495307.db2.gz	VRJMDARYXREPAP-RDJZCZTQSA-N	0	3	347.890	3.255	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1c(F)cc(C)cc1F)C(C)C	ZINC001753834445	1440500517	/nfs/dbraw/zinc/50/05/17/1440500517.db2.gz	MCBRTBKFXVJRBP-CQSZACIVSA-N	0	3	330.806	3.370	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)c1ccc(Cl)[nH]1)NCC#Cc1ccccc1	ZINC001753838512	1440501815	/nfs/dbraw/zinc/50/18/15/1440501815.db2.gz	RPLGRMCTYAVYJS-QGZVFWFLSA-N	0	3	343.858	3.064	20	30		EGEDHN
CCCC1(C(=O)N(CC)CCNCc2ccc(C#N)cc2)CCC1	ZINC001754063002	1440537153	/nfs/dbraw/zinc/53/71/53/1440537153.db2.gz	XPCXLWRUTPDNIE-UHFFFAOYSA-N	0	3	327.472	3.467	20	30		EGEDHN
CC[C@H](Cc1ccccc1)C(=O)N[C@H](C)CNCC#Cc1ccccc1	ZINC001754243199	1440556252	/nfs/dbraw/zinc/55/62/52/1440556252.db2.gz	CVIZRUFFSPEAIK-DENIHFKCSA-N	0	3	348.490	3.401	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](C)CNCC#Cc1cccc(Cl)c1	ZINC001754278181	1440562562	/nfs/dbraw/zinc/56/25/62/1440562562.db2.gz	OARMCSZZOHQEPA-HNNXBMFYSA-N	0	3	332.875	3.388	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccc(F)cc1)NC(=O)C1CC(C(C)(C)C)C1	ZINC001754297092	1440566619	/nfs/dbraw/zinc/56/66/19/1440566619.db2.gz	DZUMZMSXKUEBIX-ZLPCBKJTSA-N	0	3	344.474	3.344	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H](C)CN(C)Cc1ccccc1C(F)(F)F	ZINC001754310795	1440573001	/nfs/dbraw/zinc/57/30/01/1440573001.db2.gz	KNQRLZQZAYNJDT-CQSZACIVSA-N	0	3	340.389	3.301	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](C)CN(C)C[C@@H](O)c1ccc(CC)cc1	ZINC001754317770	1440576427	/nfs/dbraw/zinc/57/64/27/1440576427.db2.gz	BHHSRYXFAMLYLA-QFBILLFUSA-N	0	3	346.515	3.321	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H](C)CN(C)Cc1ccc2c(c1)CCC2	ZINC001754322027	1440578447	/nfs/dbraw/zinc/57/84/47/1440578447.db2.gz	XJEFQHZJIZASSC-KRWDZBQOSA-N	0	3	326.484	3.305	20	30		EGEDHN
C[C@H]1CCCC[C@H]1C(=O)N(C)CCCNCc1ccccc1C#N	ZINC001754397065	1440594676	/nfs/dbraw/zinc/59/46/76/1440594676.db2.gz	IVCCGWKPMBXZPC-QFBILLFUSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NC[C@H]1CCN1Cc1c(C)cccc1C)OCC	ZINC001754484404	1440608452	/nfs/dbraw/zinc/60/84/52/1440608452.db2.gz	AHSLPSHJBKDSNT-UYAOXDASSA-N	0	3	344.499	3.365	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NC[C@@H]1CCN1Cc1c(C)cccc1C)OCC	ZINC001754484401	1440608473	/nfs/dbraw/zinc/60/84/73/1440608473.db2.gz	AHSLPSHJBKDSNT-AZUAARDMSA-N	0	3	344.499	3.365	20	30		EGEDHN
C=CCC[C@H](C)N1CC[C@H]1CNC(=O)c1cnccc1C(F)(F)F	ZINC001754494932	1440611707	/nfs/dbraw/zinc/61/17/07/1440611707.db2.gz	AYLKIXPWCGPIDC-STQMWFEESA-N	0	3	341.377	3.259	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NC[C@H]1CCN1[C@@H](C)c1ccccc1C	ZINC001754501889	1440614694	/nfs/dbraw/zinc/61/46/94/1440614694.db2.gz	ZXOPCAQNQQTGBO-GHTZIAJQSA-N	0	3	346.474	3.471	20	30		EGEDHN
CCC[C@H](C)C(=O)N1CC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001754563543	1440634442	/nfs/dbraw/zinc/63/44/42/1440634442.db2.gz	LQGABUXZAODKTR-LAUBAEHRSA-N	0	3	339.483	3.419	20	30		EGEDHN
O=C(CCc1ccccc1)N1CCC[C@H]1CNCC#Cc1ccccc1	ZINC001754619677	1440645149	/nfs/dbraw/zinc/64/51/49/1440645149.db2.gz	CNCLFWATHTVLGK-QFIPXVFZSA-N	0	3	346.474	3.252	20	30		EGEDHN
C[C@H](C(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1)C(C)(F)F	ZINC001754629105	1440647185	/nfs/dbraw/zinc/64/71/85/1440647185.db2.gz	RAOMOPBPHFUMSH-CQSZACIVSA-N	0	3	349.425	3.320	20	30		EGEDHN
C#CCN(C(=O)[C@H](C)c1ccsc1)C1CCN(CC(=C)C)CC1	ZINC001754640582	1440649068	/nfs/dbraw/zinc/64/90/68/1440649068.db2.gz	XHIDRUFWLRKFKY-MRXNPFEDSA-N	0	3	330.497	3.354	20	30		EGEDHN
C#CCNC[C@H](NC(=O)[C@@H](F)C(C)C)c1ccc2ccccc2c1	ZINC001754644157	1440649761	/nfs/dbraw/zinc/64/97/61/1440649761.db2.gz	PEWMMEBUYYHPBF-OALUTQOASA-N	0	3	326.415	3.214	20	30		EGEDHN
C=C[C@@H](CC(=O)N1CC[C@H]2CC[C@@H](C1)N2CC#CC)c1ccccc1	ZINC001754660750	1440654803	/nfs/dbraw/zinc/65/48/03/1440654803.db2.gz	NCMRQMDNHWPXIW-TYPHKJRUSA-N	0	3	336.479	3.435	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@](C)(CNCc2oc(CC)nc2C)C1	ZINC001754693629	1440666583	/nfs/dbraw/zinc/66/65/83/1440666583.db2.gz	VPGYXHKUDFECFH-HXUWFJFHSA-N	0	3	345.487	3.067	20	30		EGEDHN
C=CCCC(=O)NC[C@]1(C)CCCN(Cc2ccc(C#N)cc2)C1	ZINC001754724931	1440675586	/nfs/dbraw/zinc/67/55/86/1440675586.db2.gz	WBHDNKZNQIGFHD-FQEVSTJZSA-N	0	3	325.456	3.243	20	30		EGEDHN
C=CCN1CCC[C@](C)(CNC(=O)Cc2coc3ccccc23)C1	ZINC001754731250	1440679462	/nfs/dbraw/zinc/67/94/62/1440679462.db2.gz	DWTXEADPWGRTLZ-HXUWFJFHSA-N	0	3	326.440	3.380	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(Cc1ocnc1C)C2	ZINC001754785695	1440687636	/nfs/dbraw/zinc/68/76/36/1440687636.db2.gz	PDTDKTIFFXVGTN-KSZLIROESA-N	0	3	343.471	3.036	20	30		EGEDHN
C#CCC[NH2+][C@@H](CNC(=O)c1ccccc1[O-])c1ccccc1CC	ZINC001754786342	1440687857	/nfs/dbraw/zinc/68/78/57/1440687857.db2.gz	XNLBMYXVAIHJQE-IBGZPJMESA-N	0	3	336.435	3.039	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H]([C@H](C)NCc3nc(C)oc3C)C2)CCC1	ZINC001754800320	1440690380	/nfs/dbraw/zinc/69/03/80/1440690380.db2.gz	TVBVEHZECAWUHT-WMLDXEAASA-N	0	3	345.487	3.364	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1ccc(C)nc1C	ZINC001754863973	1440701882	/nfs/dbraw/zinc/70/18/82/1440701882.db2.gz	RTIKIIMXTBLHHH-RTBURBONSA-N	0	3	327.472	3.230	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1ncccc1C	ZINC001754868979	1440704227	/nfs/dbraw/zinc/70/42/27/1440704227.db2.gz	REUJBEFMYWECJM-OALUTQOASA-N	0	3	327.472	3.312	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H]2CN(Cc3ccc4c(c3)COC4)C[C@H]21	ZINC001754871165	1440705115	/nfs/dbraw/zinc/70/51/15/1440705115.db2.gz	PPXUCSBPLCOYKM-FXAWDEMLSA-N	0	3	340.467	3.106	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](CCNCc2oc(C)nc2C)C1	ZINC001754917875	1440708905	/nfs/dbraw/zinc/70/89/05/1440708905.db2.gz	ZDRQYDZCJKWVJQ-MRXNPFEDSA-N	0	3	333.476	3.222	20	30		EGEDHN
N#Cc1ccccc1CNCC[C@H]1CCN(C(=O)C2(F)CCCC2)C1	ZINC001754920408	1440709185	/nfs/dbraw/zinc/70/91/85/1440709185.db2.gz	BCUXOCCLJNTHEY-INIZCTEOSA-N	0	3	343.446	3.169	20	30		EGEDHN
COCC#CCN[C@H](C)c1ccc(CNC(=O)[C@H](C)C(C)(C)C)cc1	ZINC001754947296	1440713683	/nfs/dbraw/zinc/71/36/83/1440713683.db2.gz	JEOGFPZPKDRCMD-DLBZAZTESA-N	0	3	344.499	3.285	20	30		EGEDHN
C#CCN[C@H](C)c1ccc(CNC(=O)[C@@H]2CCCc3cccnc32)cc1	ZINC001754948824	1440714253	/nfs/dbraw/zinc/71/42/53/1440714253.db2.gz	PYDVUMORBPHINP-OXQOHEQNSA-N	0	3	347.462	3.102	20	30		EGEDHN
C#CCN[C@@H](C)c1ccc(CNC(=O)C2(c3ccccc3)CC2)cc1	ZINC001754951175	1440715116	/nfs/dbraw/zinc/71/51/16/1440715116.db2.gz	LDIVTYBHNICVJK-KRWDZBQOSA-N	0	3	332.447	3.318	20	30		EGEDHN
COCC#CCN[C@@H](C)c1ccc(CNC(=O)/C=C\C(C)(C)C)cc1	ZINC001754954377	1440715928	/nfs/dbraw/zinc/71/59/28/1440715928.db2.gz	RWCHKYRCYDZVAK-QOHRORDFSA-N	0	3	342.483	3.206	20	30		EGEDHN
Cc1ccc(CN2CCc3c(CNC(=O)[C@@H](C)C#N)cccc3C2)cc1	ZINC001754973483	1440719238	/nfs/dbraw/zinc/71/92/38/1440719238.db2.gz	CDZMIPIGJLZGKF-KRWDZBQOSA-N	0	3	347.462	3.329	20	30		EGEDHN
CC[C@H](C)CC(=O)NCC1(NCc2ccc(C#N)c(F)c2)CCC1	ZINC001754981104	1440721311	/nfs/dbraw/zinc/72/13/11/1440721311.db2.gz	DFCNIWUOJRRXBL-AWEZNQCLSA-N	0	3	331.435	3.262	20	30		EGEDHN
CC#CCNC1(CNC(=O)c2cc3c(s2)CC[C@@H](C)C3)CCC1	ZINC001754992953	1440725105	/nfs/dbraw/zinc/72/51/05/1440725105.db2.gz	XVMLTLXRACBWQX-CQSZACIVSA-N	0	3	330.497	3.138	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](N2CCN(CCCC(C)C)CC2)C1	ZINC001755020079	1440726640	/nfs/dbraw/zinc/72/66/40/1440726640.db2.gz	XQIKCWDCOBOVAW-LJQANCHMSA-N	0	3	349.563	3.243	20	30		EGEDHN
CCCCC[C@H](CC)C(=O)N[C@@H]1CCCN(CC#CCOC)CC1	ZINC001755033798	1440733141	/nfs/dbraw/zinc/73/31/41/1440733141.db2.gz	FHEKTGZCULOBMN-RBUKOAKNSA-N	0	3	336.520	3.213	20	30		EGEDHN
CN(CCCN(C)C(=O)[C@]1(C)C=CCC1)Cc1ccc(F)c(C#N)c1	ZINC001755043073	1440738741	/nfs/dbraw/zinc/73/87/41/1440738741.db2.gz	YWUARSMEZFMESA-HXUWFJFHSA-N	0	3	343.446	3.334	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)CCCC(F)(F)F)C1	ZINC001755047039	1440741706	/nfs/dbraw/zinc/74/17/06/1440741706.db2.gz	LFMFYICUIDGUBO-HZPDHXFCSA-N	0	3	344.421	3.445	20	30		EGEDHN
C=C(C)CCN1Cc2ccccc2C[C@@H]1CNC(=O)CC[C@@H](C)OC	ZINC001755075590	1440748287	/nfs/dbraw/zinc/74/82/87/1440748287.db2.gz	JRYNCTWNSUJAEH-YLJYHZDGSA-N	0	3	344.499	3.311	20	30		EGEDHN
C=CCOCCCC(=O)N1CCC[C@]2(CCN(C/C=C\Cl)C2)C1	ZINC001755077081	1440749182	/nfs/dbraw/zinc/74/91/82/1440749182.db2.gz	NOYTZUGELRULQO-JIGZGPPQSA-N	0	3	340.895	3.036	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC[C@]2(CCN(Cc3ccccn3)C2)C1	ZINC001755078040	1440749777	/nfs/dbraw/zinc/74/97/77/1440749777.db2.gz	HLJSSOHIPYVZTE-HXUWFJFHSA-N	0	3	327.472	3.252	20	30		EGEDHN
CC1(C)CN(Cc2ccc(CF)cc2)CC[C@@H]1NC(=O)C#CC1CC1	ZINC001755137891	1440758982	/nfs/dbraw/zinc/75/89/82/1440758982.db2.gz	GHKDJZCFPYBBDA-IBGZPJMESA-N	0	3	342.458	3.286	20	30		EGEDHN
C=CCC[C@@H](C)N1CC(N2CCN(C(=O)CC3(C)CCCC3)CC2)C1	ZINC001755145256	1440762649	/nfs/dbraw/zinc/76/26/49/1440762649.db2.gz	HWEUSMRGJKDULL-GOSISDBHSA-N	0	3	347.547	3.140	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCN(C2CN(CCCC(C)(C)C)C2)CC1	ZINC001755146790	1440762880	/nfs/dbraw/zinc/76/28/80/1440762880.db2.gz	XVYALNJGKWRYRY-UHFFFAOYSA-N	0	3	349.563	3.243	20	30		EGEDHN
CC/C(C)=C/C(=O)N[C@@H]1CCN(Cc2cccc(C#N)c2)[C@H](C)C1	ZINC001755159171	1440763974	/nfs/dbraw/zinc/76/39/74/1440763974.db2.gz	DJRZBQGUSDWOOD-LNCHUYFUSA-N	0	3	325.456	3.384	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@H](C)CCCCC)CCO2	ZINC001755173734	1440770204	/nfs/dbraw/zinc/77/02/04/1440770204.db2.gz	HGMREVUGIVMTNR-GOSISDBHSA-N	0	3	336.520	3.472	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)c2nccs2)CC1	ZINC001755184711	1440772591	/nfs/dbraw/zinc/77/25/91/1440772591.db2.gz	DLQPMCRVEFAZTO-UHFFFAOYSA-N	0	3	327.881	3.070	20	30		EGEDHN
Cc1ccc(F)cc1CN(C)C[C@H]1CCCN1C(=O)C#CC(C)C	ZINC001755192239	1440775011	/nfs/dbraw/zinc/77/50/11/1440775011.db2.gz	BIAUBUXWVAXGMK-LJQANCHMSA-N	0	3	330.447	3.216	20	30		EGEDHN
CN(Cc1ccc(F)cc1)C[C@H]1CCCN1C(=O)C#CC(C)(C)C	ZINC001755193342	1440775553	/nfs/dbraw/zinc/77/55/53/1440775553.db2.gz	WKHLSNFMZMRLPX-GOSISDBHSA-N	0	3	330.447	3.298	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@H]1CN(C)C[C@@H](O)c1ccccc1	ZINC001755195812	1440777012	/nfs/dbraw/zinc/77/70/12/1440777012.db2.gz	YQLVCOQCJVYLOU-RBUKOAKNSA-N	0	3	344.499	3.245	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H](C)[C@@H](C)NCC#Cc2cccc(Cl)c2)co1	ZINC001755235120	1440787953	/nfs/dbraw/zinc/78/79/53/1440787953.db2.gz	YMYZQHHLXUPDNN-CABCVRRESA-N	0	3	344.842	3.390	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)s1)[C@H](C)NC(=O)CCc1ccsc1	ZINC001755237575	1440788681	/nfs/dbraw/zinc/78/86/81/1440788681.db2.gz	NPEHHCXVWAOIBQ-STQMWFEESA-N	0	3	347.509	3.297	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)s1)[C@H](C)NC(=O)CCC(C)(F)F	ZINC001755239697	1440789114	/nfs/dbraw/zinc/78/91/14/1440789114.db2.gz	GFDUNEZCIJMURY-MNOVXSKESA-N	0	3	329.416	3.038	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H](C)[C@@H](C)NCC#Cc2ccccc2)ccc1F	ZINC001755250201	1440791643	/nfs/dbraw/zinc/79/16/43/1440791643.db2.gz	QMOHBHUXNLEPKJ-SJORKVTESA-N	0	3	338.426	3.282	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N(C)C1CCC(NCc2conc2C)CC1	ZINC001755274736	1440798693	/nfs/dbraw/zinc/79/86/93/1440798693.db2.gz	HLJODRXCNZPJII-UHFFFAOYSA-N	0	3	333.476	3.445	20	30		EGEDHN
C[C@H](CNC(=O)[C@H]1CCC(C)(C)C1)N(C)Cc1ccc(C#N)cc1	ZINC001755314305	1440814925	/nfs/dbraw/zinc/81/49/25/1440814925.db2.gz	FFVUGFOKNRTIRP-QAPCUYQASA-N	0	3	327.472	3.321	20	30		EGEDHN
CCCC[C@H](CNCc1ccc(C#N)s1)NC(=O)C1=CCCC1	ZINC001755358379	1440830622	/nfs/dbraw/zinc/83/06/22/1440830622.db2.gz	RBLVDPXNBZCRQE-OAHLLOKOSA-N	0	3	331.485	3.495	20	30		EGEDHN
C/C=C(/C)C(=O)NC[C@@H]1CCCCCN1Cc1ccc(C#N)cc1	ZINC001755364930	1440833741	/nfs/dbraw/zinc/83/37/41/1440833741.db2.gz	MOSCDXYWJLCMJP-RPYYPOKISA-N	0	3	325.456	3.385	20	30		EGEDHN
C=CCOCCN1CCCCC[C@@H]1CNC(=O)c1c(C)coc1C	ZINC001755364819	1440833966	/nfs/dbraw/zinc/83/39/66/1440833966.db2.gz	YYILPQKIHOCMDU-QGZVFWFLSA-N	0	3	334.460	3.073	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)[C@]1(c2ccccc2)CCCO1	ZINC001755367493	1440835526	/nfs/dbraw/zinc/83/55/26/1440835526.db2.gz	HFWPELRMDNNJOY-PZJWPPBQSA-N	0	3	342.483	3.239	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@@H]1CN(Cc2cc3ccccc3s2)CC1(C)C	ZINC001755407362	1440844728	/nfs/dbraw/zinc/84/47/28/1440844728.db2.gz	OGBNNASBZMJXQE-CXAGYDPISA-N	0	3	341.480	3.388	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)[C@H](CC)Cc2cccc(C)c2)C(C)(C)C1	ZINC001755412765	1440847063	/nfs/dbraw/zinc/84/70/63/1440847063.db2.gz	XMUUKQLDCMEVTL-WOJBJXKFSA-N	0	3	340.511	3.414	20	30		EGEDHN
CC#CCN1C[C@@H]2[C@@H](CNC(=O)CCC(C)(C)c3ccccc3)[C@@H]2C1	ZINC001755435508	1440851808	/nfs/dbraw/zinc/85/18/08/1440851808.db2.gz	HMKCXAYVSAENKZ-OWZKRDHZSA-N	0	3	338.495	3.062	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@H]2CN(Cc3ccccc3C#N)C[C@@H]2C1	ZINC001755453751	1440854808	/nfs/dbraw/zinc/85/48/08/1440854808.db2.gz	SDTMUYJCTINPLY-PCCBWWKXSA-N	0	3	349.478	3.078	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CC[C@@H](NC(=O)C(C)(C)C(F)F)C[C@H]2C1	ZINC001755454211	1440855004	/nfs/dbraw/zinc/85/50/04/1440855004.db2.gz	YJTFWRGLGFGLIM-RWMBFGLXSA-N	0	3	334.838	3.247	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1C[C@H](CNCc2c(F)cccc2Cl)C1	ZINC001755469886	1440858677	/nfs/dbraw/zinc/85/86/77/1440858677.db2.gz	GKZPXKCKYKHJCG-HDJSIYSDSA-N	0	3	336.838	3.267	20	30		EGEDHN
C=C(Cl)CNCCC[C@H](C)NC(=O)CC1(C(F)(F)F)CC1	ZINC001755501188	1440862644	/nfs/dbraw/zinc/86/26/44/1440862644.db2.gz	ALELHXGQNQIWJH-NSHDSACASA-N	0	3	326.790	3.346	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](C)CCCN[C@H](C)c2cnccn2)CC1	ZINC001755515434	1440864224	/nfs/dbraw/zinc/86/42/24/1440864224.db2.gz	SKAHXZWZKCHQFD-JKSUJKDBSA-N	0	3	330.476	3.159	20	30		EGEDHN
C=C(Cl)CNCCC[C@@H](NC(=O)c1[nH]cnc1C)c1ccccc1	ZINC001755546965	1440870716	/nfs/dbraw/zinc/87/07/16/1440870716.db2.gz	AGSAACCKILUXKG-MRXNPFEDSA-N	0	3	346.862	3.312	20	30		EGEDHN
CCC(C)(C)C(=O)N(C)[C@@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001755566180	1440875796	/nfs/dbraw/zinc/87/57/96/1440875796.db2.gz	NVAMVJCODMAMFX-INIZCTEOSA-N	0	3	333.501	3.383	20	30		EGEDHN
C[C@H](CN(C)C(=O)CCc1ccsc1)NCC#Cc1ccccc1	ZINC001755590278	1440881358	/nfs/dbraw/zinc/88/13/58/1440881358.db2.gz	LDIIYLKBDBBYMF-QGZVFWFLSA-N	0	3	340.492	3.169	20	30		EGEDHN
C[C@@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)C1(F)CCCCC1	ZINC001755662935	1440892969	/nfs/dbraw/zinc/89/29/69/1440892969.db2.gz	BRTWYMFCCBVOMJ-MJGOQNOKSA-N	0	3	342.458	3.290	20	30		EGEDHN
CC#CCN[C@@H]1C[C@@H](C)N(C(=O)Cc2ccc(CCCC)cc2)C1	ZINC001755682470	1440895266	/nfs/dbraw/zinc/89/52/66/1440895266.db2.gz	SLHQDLIMZBPNSD-YLJYHZDGSA-N	0	3	326.484	3.174	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@]12CCC[C@@H]1N(CCc1ccccc1Cl)CC2	ZINC001755696089	1440898015	/nfs/dbraw/zinc/89/80/15/1440898015.db2.gz	KTMZJTMBPRKUEG-LJHODMEESA-N	0	3	345.874	3.155	20	30		EGEDHN
C#CCN1CC[C@]2(NC(=O)CCCc3sccc3C)CCC[C@@H]12	ZINC001755704064	1440901676	/nfs/dbraw/zinc/90/16/76/1440901676.db2.gz	HFKLEESNRXHRNX-IEBWSBKVSA-N	0	3	330.497	3.126	20	30		EGEDHN
C=C(Cl)CN[C@@H](CCNC(=O)C#CC(C)(C)C)Cc1ccccc1	ZINC001755721977	1440907697	/nfs/dbraw/zinc/90/76/97/1440907697.db2.gz	DJODPSGXGKJMHC-SFHVURJKSA-N	0	3	346.902	3.496	20	30		EGEDHN
C=C(Cl)CN[C@@H](CCNC(=O)c1ocnc1C)Cc1ccccc1	ZINC001755722026	1440908000	/nfs/dbraw/zinc/90/80/00/1440908000.db2.gz	DTSADCSBIGJGOJ-INIZCTEOSA-N	0	3	347.846	3.056	20	30		EGEDHN
C=C(Cl)CN[C@H](CCNC(=O)c1ocnc1C)Cc1ccccc1	ZINC001755722028	1440908074	/nfs/dbraw/zinc/90/80/74/1440908074.db2.gz	DTSADCSBIGJGOJ-MRXNPFEDSA-N	0	3	347.846	3.056	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](NCc2cnn(C(C)(C)C)c2)C(C)(C)C1	ZINC001755757662	1440914347	/nfs/dbraw/zinc/91/43/47/1440914347.db2.gz	PMUYSGLZGYWABN-QGZVFWFLSA-N	0	3	346.519	3.321	20	30		EGEDHN
CCCCC[C@@H](CC)C(=O)N1C[C@H](NCC#CCOC)C(C)(C)C1	ZINC001755765971	1440916170	/nfs/dbraw/zinc/91/61/70/1440916170.db2.gz	AEWHQRVAGZKXLU-MSOLQXFVSA-N	0	3	336.520	3.069	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@@H](NCc2cncc(C)c2)C(C)(C)C1	ZINC001755772578	1440917010	/nfs/dbraw/zinc/91/70/10/1440917010.db2.gz	DOTYCNYXVTVURO-FUHWJXTLSA-N	0	3	329.488	3.319	20	30		EGEDHN
C=C[C@@](C)(O)CC(=O)N(CCN(C)Cc1c(C)cccc1C)C(C)C	ZINC001755810945	1440920338	/nfs/dbraw/zinc/92/03/38/1440920338.db2.gz	RAAGEHPZSLOFKF-OAQYLSRUSA-N	0	3	346.515	3.299	20	30		EGEDHN
C[C@@H](C(=O)N[C@@H](CNCC#Cc1ccccc1)C(C)(C)C)C1CC1	ZINC001755820953	1440925633	/nfs/dbraw/zinc/92/56/33/1440925633.db2.gz	VYRRSFGWCFNPCZ-APWZRJJASA-N	0	3	326.484	3.205	20	30		EGEDHN
C=CCOCC(=O)N[C@H](CNCc1ccccc1Cl)C(C)(C)C	ZINC001755821936	1440925943	/nfs/dbraw/zinc/92/59/43/1440925943.db2.gz	QYEJTKHNHMJQCR-MRXNPFEDSA-N	0	3	338.879	3.163	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@H](C)C1CCN(Cc2ccccn2)CC1	ZINC001755844974	1440932890	/nfs/dbraw/zinc/93/28/90/1440932890.db2.gz	REDYDGZUJHQPFQ-SJORKVTESA-N	0	3	329.488	3.401	20	30		EGEDHN
C#CCOCCC(=O)N(C)C1CC(N[C@H](C)c2ccccc2Cl)C1	ZINC001755856677	1440935919	/nfs/dbraw/zinc/93/59/19/1440935919.db2.gz	IKYNASCOSOKJQL-QQFBHYJXSA-N	0	3	348.874	3.020	20	30		EGEDHN
C=CCNCc1ccc(CNC(=O)C[C@@H]2CC[C@H](C3CC3)O2)c(F)c1	ZINC001755901707	1440944170	/nfs/dbraw/zinc/94/41/70/1440944170.db2.gz	ALMGMNIUGUPSMJ-PKOBYXMFSA-N	0	3	346.446	3.065	20	30		EGEDHN
C=CCNCc1ccc(CNC(=O)[C@@H](C)Cc2ccco2)c(F)c1	ZINC001755902202	1440944302	/nfs/dbraw/zinc/94/43/02/1440944302.db2.gz	OHRDHXNAKAXLGJ-AWEZNQCLSA-N	0	3	330.403	3.189	20	30		EGEDHN
Cc1cc(C#N)ccc1CN[C@H](Cc1ccccc1)[C@@H](O)C(F)(F)F	ZINC001648156198	1126250219	/nfs/dbraw/zinc/25/02/19/1126250219.db2.gz	RHOVQLZYRFMZAV-QZTJIDSGSA-N	0	3	348.368	3.491	20	30		EGEDHN
Cc1ccc(C#N)c(N2C[C@H]3CCN(Cc4ccccc4)C[C@H]3C2)n1	ZINC000368130297	168314582	/nfs/dbraw/zinc/31/45/82/168314582.db2.gz	AOCSWDFUJCKVGE-UXHICEINSA-N	0	3	332.451	3.220	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)NC1CCN(C2CC2)CC1	ZINC000066176646	215019313	/nfs/dbraw/zinc/01/93/13/215019313.db2.gz	VMWITITZWSGIGC-UHFFFAOYSA-N	0	3	340.471	3.105	20	30		EGEDHN
C[C@@H]1CN(Cc2cccc(CNCc3cccc(C#N)c3)c2)CCO1	ZINC000067976607	215265300	/nfs/dbraw/zinc/26/53/00/215265300.db2.gz	MXIOSFAKRIJSIQ-QGZVFWFLSA-N	0	3	335.451	3.069	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN[C@@H]2CCO[C@@H]2c2ccc(Cl)cc2)cc1	ZINC000192041475	283188838	/nfs/dbraw/zinc/18/88/38/283188838.db2.gz	WPDLKPQFHHCBSP-GUDVDZBRSA-N	0	3	342.826	3.365	20	30		EGEDHN
Cn1cc(CN[C@H]2CCO[C@@H]2c2ccc(Cl)c(F)c2)cc1C#N	ZINC000191550482	239179650	/nfs/dbraw/zinc/17/96/50/239179650.db2.gz	NUOVRCSUXBHUGY-DLBZAZTESA-N	0	3	333.794	3.309	20	30		EGEDHN
C=CCOCCCC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000079608651	217244186	/nfs/dbraw/zinc/24/41/86/217244186.db2.gz	OMIGRBAFFQYDMJ-UHFFFAOYSA-N	0	3	330.472	3.058	20	30		EGEDHN
C=CCOCCCC(=O)Nc1ccccc1NC1CCN(C)CC1	ZINC000079924780	217265126	/nfs/dbraw/zinc/26/51/26/217265126.db2.gz	TWHZUTNHUKFIGX-UHFFFAOYSA-N	0	3	331.460	3.114	20	30		EGEDHN
CC(C)Oc1ccc(C#N)cc1NC(=O)N1CC[C@H]2CC[C@@H](C1)N2C	ZINC000081063996	217358199	/nfs/dbraw/zinc/35/81/99/217358199.db2.gz	BJOXVIYZTXYBHJ-CVEARBPZSA-N	0	3	342.443	3.046	20	30		EGEDHN
N#Cc1ccc(CNC(=O)CN[C@@H](c2ccccc2)C2CCC2)cc1	ZINC000264229280	246215303	/nfs/dbraw/zinc/21/53/03/246215303.db2.gz	YCMMYWPPLGMHTR-NRFANRHFSA-N	0	3	333.435	3.305	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(Cc2ccco2)Cc2ccco2)CC1	ZINC000264332315	246362624	/nfs/dbraw/zinc/36/26/24/246362624.db2.gz	FORVJRAIEJBHGD-UHFFFAOYSA-N	0	3	343.427	3.235	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)o1)Oc1cccc(Br)c1	ZINC000266143713	248128163	/nfs/dbraw/zinc/12/81/63/248128163.db2.gz	IABMWRTWMNGHSI-NSHDSACASA-N	0	3	335.201	3.471	20	30		EGEDHN
C=C(C)CN1CCC(Nc2ncccc2C(=O)N2CCCCC2)CC1	ZINC000266373197	248270833	/nfs/dbraw/zinc/27/08/33/248270833.db2.gz	MCJKZUQVNAQVHC-UHFFFAOYSA-N	0	3	342.487	3.160	20	30		EGEDHN
CCN(Cc1ccc(OC)cc1OC)C[C@H](O)c1ccc(C#N)cc1	ZINC000268697373	252149471	/nfs/dbraw/zinc/14/94/71/252149471.db2.gz	QJUKOQHUOUVITA-IBGZPJMESA-N	0	3	340.423	3.131	20	30		EGEDHN
C#CCOc1ccc([C@@H](C)NC[C@@H](O)c2ccc(OC)cc2)cc1	ZINC000268761615	252211232	/nfs/dbraw/zinc/21/12/32/252211232.db2.gz	OBVJTVHVKFGFBB-FOIQADDNSA-N	0	3	325.408	3.091	20	30		EGEDHN
CN(C)Cc1cccc(CNC(=O)Nc2ccc(F)cc2C#N)c1	ZINC000097472809	219027082	/nfs/dbraw/zinc/02/70/82/219027082.db2.gz	RSUMLHBGSQFJBY-UHFFFAOYSA-N	0	3	326.375	3.081	20	30		EGEDHN
Cc1sc(NC(=O)CN[C@@H]2CCCO[C@@H]2CC(C)C)c(C#N)c1C	ZINC000186389041	144131973	/nfs/dbraw/zinc/13/19/73/144131973.db2.gz	CJAYCMSBZDOGID-HZPDHXFCSA-N	0	3	349.500	3.358	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCN2CC[C@]3(C2)OCc2ccccc23)cc1	ZINC000186704572	144142021	/nfs/dbraw/zinc/14/20/21/144142021.db2.gz	YSCWGSHYWYEIFE-OAQYLSRUSA-N	0	3	347.418	3.018	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCN2CCOCC3(CCC3)C2)cc1Cl	ZINC000363903153	144375011	/nfs/dbraw/zinc/37/50/11/144375011.db2.gz	JIWWKPRQGBKGMG-UHFFFAOYSA-N	0	3	347.846	3.043	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)c1ccnc(C2CC2)c1	ZINC000341087820	155151119	/nfs/dbraw/zinc/15/11/19/155151119.db2.gz	PXDPYJREZFHCRN-UHFFFAOYSA-N	0	3	348.450	3.035	20	30		EGEDHN
CCCc1cccc(CN[C@H]2CCN(Cc3ccc(C#N)cc3)C2=O)c1	ZINC000192241454	153246987	/nfs/dbraw/zinc/24/69/87/153246987.db2.gz	YNBWIMDNFTVVDE-NRFANRHFSA-N	0	3	347.462	3.401	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CCN1CCOc1cccc(C#N)c1	ZINC000303706639	154054201	/nfs/dbraw/zinc/05/42/01/154054201.db2.gz	BVZGGQKIBVQSBS-GOSISDBHSA-N	0	3	335.451	3.143	20	30		EGEDHN
COc1ccc(C)cc1CN(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000348892129	156277056	/nfs/dbraw/zinc/27/70/56/156277056.db2.gz	HWSBLQHZYJHAPF-UHFFFAOYSA-N	0	3	337.467	3.439	20	30		EGEDHN
COCc1cccc(CN(CCN(C)C)Cc2ccc(C#N)cc2)c1	ZINC000348931397	156292125	/nfs/dbraw/zinc/29/21/25/156292125.db2.gz	BBGFQXCDZYPDJY-UHFFFAOYSA-N	0	3	337.467	3.268	20	30		EGEDHN
C[C@]1(O)CCCN(Cc2cccc(OCc3cccc(C#N)c3)c2)C1	ZINC000129537426	162359285	/nfs/dbraw/zinc/35/92/85/162359285.db2.gz	XDVMXMFJRLNYHW-NRFANRHFSA-N	0	3	336.435	3.484	20	30		EGEDHN
CN(C)C[C@H](NC(=O)c1cccc(C#N)c1)c1ccc(Cl)cc1	ZINC000338754854	163338829	/nfs/dbraw/zinc/33/88/29/163338829.db2.gz	OXNQUCCAWMZUOV-KRWDZBQOSA-N	0	3	327.815	3.244	20	30		EGEDHN
C[C@@H](NCCNC(=O)c1ccc(Cl)cc1)c1cccc(C#N)c1	ZINC000344021050	164084715	/nfs/dbraw/zinc/08/47/15/164084715.db2.gz	NFUSVIMZOJMDSD-CYBMUJFWSA-N	0	3	327.815	3.292	20	30		EGEDHN
C[C@@H]1C[C@@H]1N1CCN(C(=O)c2cc(C#N)ccc2Cl)C[C@@H](C)C1	ZINC000346175914	164357493	/nfs/dbraw/zinc/35/74/93/164357493.db2.gz	DVVSULIBJQOIMR-AHIWAGSCSA-N	0	3	331.847	3.014	20	30		EGEDHN
C[C@@H](CN1CCCCCC1)NC(=O)C1(c2cc(F)cc(C#N)c2)CC1	ZINC000354875952	166053485	/nfs/dbraw/zinc/05/34/85/166053485.db2.gz	JLUAHVXFHKGFPC-HNNXBMFYSA-N	0	3	343.446	3.110	20	30		EGEDHN
CCN(CC)C(=O)[C@H](NCCc1cccc(C#N)c1)c1ccccc1	ZINC000355686821	166283442	/nfs/dbraw/zinc/28/34/42/166283442.db2.gz	VPRZILPRJJVEAN-HXUWFJFHSA-N	0	3	335.451	3.300	20	30		EGEDHN
N#Cc1cnc2ccccc2c1NCCCN1CCc2ccccc2C1	ZINC000359679602	167208374	/nfs/dbraw/zinc/20/83/74/167208374.db2.gz	QIYVFLHGRBPIKO-UHFFFAOYSA-N	0	3	342.446	3.389	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)N1C[C@H]2CCN(Cc3ccccc3)C[C@H]2C1	ZINC000365728736	168039370	/nfs/dbraw/zinc/03/93/70/168039370.db2.gz	WADSPTPFXSYZHM-MSOLQXFVSA-N	0	3	349.434	3.054	20	30		EGEDHN
C[C@@H](C(=O)N1CC=C(c2ccc(C#N)cc2)CC1)N1[C@H](C)CC[C@@H]1C	ZINC000367228863	168196492	/nfs/dbraw/zinc/19/64/92/168196492.db2.gz	NOXXCUCPKWNNGJ-BBWFWOEESA-N	0	3	337.467	3.435	20	30		EGEDHN
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNCc1ccc(C#N)s1	ZINC000368061879	168305886	/nfs/dbraw/zinc/30/58/86/168305886.db2.gz	JDHRRIDIZGOQSM-RYUDHWBXSA-N	0	3	339.436	3.057	20	30		EGEDHN
COc1cc(C#N)ccc1NC(=O)NC[C@@H]1CCN1C1CCCCC1	ZINC000529061686	269765732	/nfs/dbraw/zinc/76/57/32/269765732.db2.gz	BVPOIFKOCFGGJP-INIZCTEOSA-N	0	3	342.443	3.095	20	30		EGEDHN
COc1ccc(CN[C@@H](C)C[C@H](O)c2ccc(F)cc2)cc1C#N	ZINC000130731405	533685033	/nfs/dbraw/zinc/68/50/33/533685033.db2.gz	WITQOYQUWPAGMC-UGSOOPFHSA-N	0	3	328.387	3.308	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)c(OC(F)F)c1	ZINC000451506681	269962051	/nfs/dbraw/zinc/96/20/51/269962051.db2.gz	UZRLXFGCAUHZRX-IMJJTQAJSA-N	0	3	334.366	3.207	20	30		EGEDHN
N#Cc1ccc(OC2CCN(Cc3ccc4[nH]cnc4c3)CC2)cc1	ZINC000525998416	270059601	/nfs/dbraw/zinc/05/96/01/270059601.db2.gz	ATQJQKOIHZLSHH-UHFFFAOYSA-N	0	3	332.407	3.478	20	30		EGEDHN
N#Cc1ccc(OC2CCN(Cc3ccc4nc[nH]c4c3)CC2)cc1	ZINC000525998416	270059602	/nfs/dbraw/zinc/05/96/02/270059602.db2.gz	ATQJQKOIHZLSHH-UHFFFAOYSA-N	0	3	332.407	3.478	20	30		EGEDHN
CCC(F)(F)C(C)(C)CN[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000527699062	270059677	/nfs/dbraw/zinc/05/96/77/270059677.db2.gz	GESSTOBRRWISTJ-INIZCTEOSA-N	0	3	349.425	3.320	20	30		EGEDHN
CCN(Cc1ccc(CN(C)C)cc1)C(=O)c1cccc(F)c1C#N	ZINC000189042694	266136473	/nfs/dbraw/zinc/13/64/73/266136473.db2.gz	DSQUSNVWTRLKQF-UHFFFAOYSA-N	0	3	339.414	3.421	20	30		EGEDHN
CN(C)CCN(Cc1ccc(F)cc1)c1nc(Cl)c(C#N)s1	ZINC000287760509	266498514	/nfs/dbraw/zinc/49/85/14/266498514.db2.gz	HHNWFUZIHONFKS-UHFFFAOYSA-N	0	3	338.839	3.375	20	30		EGEDHN
C[C@H](N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O)c1ccc(C#N)cc1	ZINC000272190951	266789173	/nfs/dbraw/zinc/78/91/73/266789173.db2.gz	KHLNIOMSUZXYJE-MGPUTAFESA-N	0	3	344.418	3.276	20	30		EGEDHN
N#Cc1cc(F)c(NCc2ccccc2CN2CC[C@@H](O)C2)c(F)c1	ZINC000273268241	267009293	/nfs/dbraw/zinc/00/92/93/267009293.db2.gz	WPTAUWIDRVNGHR-MRXNPFEDSA-N	0	3	343.377	3.015	20	30		EGEDHN
CCCN(Cc1ccc(F)cc1)C[C@H](O)COc1ccc(C#N)cc1	ZINC000519908156	267015330	/nfs/dbraw/zinc/01/53/30/267015330.db2.gz	JWTILBWWNPXAJZ-IBGZPJMESA-N	0	3	342.414	3.349	20	30		EGEDHN
CCN(C[C@@H]1CCN(Cc2ccccc2)C1)c1ncc(C#N)cc1F	ZINC000413165523	267068010	/nfs/dbraw/zinc/06/80/10/267068010.db2.gz	HFVSSKKPBPBZES-QGZVFWFLSA-N	0	3	338.430	3.441	20	30		EGEDHN
CCOC(=O)N1CCC([C@@H](C)NCc2cccc(F)c2C#N)CC1	ZINC000497189337	267122223	/nfs/dbraw/zinc/12/22/23/267122223.db2.gz	GBBZKSSZOYSSEX-CYBMUJFWSA-N	0	3	333.407	3.044	20	30		EGEDHN
CC[C@@H]1CCC[C@@H]1C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000448725300	267201797	/nfs/dbraw/zinc/20/17/97/267201797.db2.gz	KKQDQIKIHYYLDL-MOPGFXCFSA-N	0	3	327.472	3.275	20	30		EGEDHN
CC[C@H](CNC(=O)C(C#N)Cc1ccc(C#N)cc1)CC(F)(F)F	ZINC000412656288	267212537	/nfs/dbraw/zinc/21/25/37/267212537.db2.gz	MMPDZLSQRQZZLU-SWLSCSKDSA-N	0	3	337.345	3.335	20	30		EGEDHN
CC[C@H]1CCC[C@@H]1C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000448725301	267227602	/nfs/dbraw/zinc/22/76/02/267227602.db2.gz	KKQDQIKIHYYLDL-OALUTQOASA-N	0	3	327.472	3.275	20	30		EGEDHN
CCO[C@@H]1C[C@@H](NC2(c3cccc(C#N)c3)CC2)C12CCOCC2	ZINC000274514025	267249577	/nfs/dbraw/zinc/24/95/77/267249577.db2.gz	XAXWEZACKDNRJO-QZTJIDSGSA-N	0	3	326.440	3.111	20	30		EGEDHN
C[C@@H](NC(=O)c1c(F)cc(C#N)cc1F)[C@H](c1ccccc1)N(C)C	ZINC000274617067	267262676	/nfs/dbraw/zinc/26/26/76/267262676.db2.gz	LHCBQOGAHXPXSK-KZULUSFZSA-N	0	3	343.377	3.258	20	30		EGEDHN
Cc1cc2ncn(C[C@@H](O)CN[C@H](C)c3ccc(C#N)cc3)c2cc1C	ZINC000298750190	267367079	/nfs/dbraw/zinc/36/70/79/267367079.db2.gz	VVCNWRNXFONDMP-APWZRJJASA-N	0	3	348.450	3.237	20	30		EGEDHN
COC(=O)[C@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@@H]1c1ccccc1	ZINC000452007330	267387208	/nfs/dbraw/zinc/38/72/08/267387208.db2.gz	QFXFYTNJKSUSHC-MSOLQXFVSA-N	0	3	338.382	3.086	20	30		EGEDHN
N#CCc1ccc(CN2CCCN(c3ccccc3C#N)CC2)cc1	ZINC000342766866	267944241	/nfs/dbraw/zinc/94/42/41/267944241.db2.gz	YFDSQZNWZXCPLW-UHFFFAOYSA-N	0	3	330.435	3.337	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CC[C@H](c3ccc(F)cc3)C2)cc1	ZINC000280199788	268083296	/nfs/dbraw/zinc/08/32/96/268083296.db2.gz	UPEIODBMKLQGRI-OALUTQOASA-N	0	3	347.393	3.396	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@H]2C[C@H]2c2cccc(F)c2)cc1	ZINC000279453545	268092198	/nfs/dbraw/zinc/09/21/98/268092198.db2.gz	ZQKHFSQDNHZEDB-NEWSRXKRSA-N	0	3	333.366	3.052	20	30		EGEDHN
N#Cc1ccc(Cl)cc1NC(=O)CN[C@@H]1CCCC12CCOCC2	ZINC000282004145	268099880	/nfs/dbraw/zinc/09/98/80/268099880.db2.gz	IZWPZJIVMQOXGT-MRXNPFEDSA-N	0	3	347.846	3.089	20	30		EGEDHN
N#Cc1ccc(N2CCC(NCc3cccc4c3OCO4)CC2)cc1	ZINC000299327554	268108454	/nfs/dbraw/zinc/10/84/54/268108454.db2.gz	BAJABQJNYXLOJE-UHFFFAOYSA-N	0	3	335.407	3.046	20	30		EGEDHN
N#Cc1ccc(N2CC[C@@H](N[C@H](c3ccccc3)C3CC3)C2=O)cc1	ZINC000269718563	268124258	/nfs/dbraw/zinc/12/42/58/268124258.db2.gz	WQJMPUQZSSUZBE-WOJBJXKFSA-N	0	3	331.419	3.404	20	30		EGEDHN
N#Cc1cc(Br)ccc1CN[C@@H]1[C@@H]2CCO[C@H]2C12CCC2	ZINC000451487714	268174813	/nfs/dbraw/zinc/17/48/13/268174813.db2.gz	HNBBSTLJKSAODL-ARFHVFGLSA-N	0	3	347.256	3.368	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN2CC[C@@H](Oc3ccc(Cl)cc3)C2)cc1	ZINC000293030062	268212112	/nfs/dbraw/zinc/21/21/12/268212112.db2.gz	LFGFDBPDOISGSZ-MOPGFXCFSA-N	0	3	342.826	3.398	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CN[C@H]1CCc2sc(Cl)cc21	ZINC000530234655	268298506	/nfs/dbraw/zinc/29/85/06/268298506.db2.gz	SFJJGHBGTAEOBA-JSGCOSHPSA-N	0	3	348.855	3.290	20	30		EGEDHN
N#Cc1ncc(NC(=O)NC[C@H]2CCN2C2CCCCC2)cc1Cl	ZINC000529107322	268323041	/nfs/dbraw/zinc/32/30/41/268323041.db2.gz	AUKWEXNBEBPPRK-CQSZACIVSA-N	0	3	347.850	3.135	20	30		EGEDHN
CS[C@@H]1CN(c2ccc(C#N)c(C(F)(F)F)c2)C[C@H]1N(C)C	ZINC000340740917	274182400	/nfs/dbraw/zinc/18/24/00/274182400.db2.gz	IOUHHUREMPFTSX-ZIAGYGMSSA-N	0	3	329.391	3.059	20	30		EGEDHN
CS[C@H]1CN(c2c(C#N)cnc3c(C)cc(C)cc32)C[C@@H]1N(C)C	ZINC000340732509	274186352	/nfs/dbraw/zinc/18/63/52/274186352.db2.gz	AMLIUZXCYXOAEN-IRXDYDNUSA-N	0	3	340.496	3.205	20	30		EGEDHN
C[C@@H]1CCN(C(=O)c2ccc(C#N)cc2)CCN1Cc1ccccc1	ZINC000173505036	274299493	/nfs/dbraw/zinc/29/94/93/274299493.db2.gz	QEODBSKVAVCDHB-QGZVFWFLSA-N	0	3	333.435	3.295	20	30		EGEDHN
N#Cc1ccc(C(F)(F)F)nc1N1CCC[C@@H]1CN1CCCCC1	ZINC000189067915	274922219	/nfs/dbraw/zinc/92/22/19/274922219.db2.gz	XYMHFLMLTRIVOW-CQSZACIVSA-N	0	3	338.377	3.427	20	30		EGEDHN
C[C@@H]1CCC[C@@H](NC(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)C1	ZINC000047034929	275140196	/nfs/dbraw/zinc/14/01/96/275140196.db2.gz	PTXNHNNQAOSEMO-VQIMIIECSA-N	0	3	342.487	3.210	20	30		EGEDHN
CCN1CCCC[C@H]1CNC(=O)N(Cc1ccc(C#N)cc1)C(C)C	ZINC000111883443	275185762	/nfs/dbraw/zinc/18/57/62/275185762.db2.gz	CIPQAGCTXYLZGT-IBGZPJMESA-N	0	3	342.487	3.353	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@H](NCc1ccc(C#N)c(F)c1)C1CC1	ZINC000192177983	275223659	/nfs/dbraw/zinc/22/36/59/275223659.db2.gz	NTNVVIUQRFYVOE-MRXNPFEDSA-N	0	3	333.407	3.090	20	30		EGEDHN
CC(C)(CO)[C@H](NCCOc1ccc(C#N)cc1)c1cccs1	ZINC000289264354	276313216	/nfs/dbraw/zinc/31/32/16/276313216.db2.gz	DIZKTWGHCIKXHW-QGZVFWFLSA-N	0	3	330.453	3.348	20	30		EGEDHN
CS[C@@H]1CN(c2c(C#N)cnc3ccc(Cl)cc32)C[C@H]1N(C)C	ZINC000340741009	278156873	/nfs/dbraw/zinc/15/68/73/278156873.db2.gz	IUYMREPJXQYIEV-HZPDHXFCSA-N	0	3	346.887	3.242	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)NC[C@@H](C)N(C)C1CC1	ZINC000339852043	280261526	/nfs/dbraw/zinc/26/15/26/280261526.db2.gz	YLBCCXGORFOWOY-LLVKDONJSA-N	0	3	327.453	3.294	20	30		EGEDHN
C[C@H](N[C@@H]1CCN(c2ncccc2F)C1)c1ccc(C#N)c(F)c1	ZINC000537406305	314179379	/nfs/dbraw/zinc/17/93/79/314179379.db2.gz	CLFZSJGAVNFYNN-SWLSCSKDSA-N	0	3	328.366	3.161	20	30		EGEDHN
C[C@@H]1CN(Cc2cn(C)nc2-c2ccc(C#N)cc2)C[C@H](C)S1	ZINC000537612880	314196321	/nfs/dbraw/zinc/19/63/21/314196321.db2.gz	HVQAUIXHKGHFFY-OKILXGFUSA-N	0	3	326.469	3.285	20	30		EGEDHN
CN(C)CCOc1cccc(-c2noc(-c3ccc(C#N)s3)n2)c1	ZINC000545685901	314776229	/nfs/dbraw/zinc/77/62/29/314776229.db2.gz	IHJJZAQRVWVEMA-UHFFFAOYSA-N	0	3	340.408	3.277	20	30		EGEDHN
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NCc1ccc(F)c(C#N)c1	ZINC000560182620	315666076	/nfs/dbraw/zinc/66/60/76/315666076.db2.gz	NFCUZOOXMIYFTE-KSSFIOAISA-N	0	3	340.398	3.207	20	30		EGEDHN
Cc1ccc(C(C)(C)CNCc2cnc3c(C#N)cnn3c2)c(C)c1	ZINC000564985562	316241893	/nfs/dbraw/zinc/24/18/93/316241893.db2.gz	KOQNPXRHUXNHAS-UHFFFAOYSA-N	0	3	333.439	3.285	20	30		EGEDHN
Cc1cc(NC[C@H]2CCCN(C)[C@H]2c2cccs2)c(C#N)cn1	ZINC000571635484	317226919	/nfs/dbraw/zinc/22/69/19/317226919.db2.gz	HMJCPCFNIHCSFP-RDTXWAMCSA-N	0	3	326.469	3.240	20	30		EGEDHN
Cc1cc(CN[C@@H](C)[C@H]2CN(Cc3ccccc3)CCO2)ccc1C#N	ZINC000574714075	317628603	/nfs/dbraw/zinc/62/86/03/317628603.db2.gz	YFCOEQAXPGKJJL-PGRDOPGGSA-N	0	3	349.478	3.246	20	30		EGEDHN
Cc1nn(-c2ccc(Br)cc2)cc1CNCCCC#N	ZINC000273051541	456160203	/nfs/dbraw/zinc/16/02/03/456160203.db2.gz	KLANTEIVWVMQOT-UHFFFAOYSA-N	0	3	333.233	3.337	20	30		EGEDHN
N#Cc1cnn2cc(CN3CCC[C@@H](c4ccccc4)CC3)cnc12	ZINC000580834664	325300456	/nfs/dbraw/zinc/30/04/56/325300456.db2.gz	QRAPYTQXYOMHKA-GOSISDBHSA-N	0	3	331.423	3.371	20	30		EGEDHN
O=C(NC[C@H]1CCCCN1CCO)c1ccc(Cl)c(Cl)c1	ZINC000331331620	457168068	/nfs/dbraw/zinc/16/80/68/457168068.db2.gz	OVKFVQQFIVXWOX-GFCCVEGCSA-N	0	3	331.243	3.145	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc3ccc(F)cc3nc2C)CC1	ZINC000264512412	455227518	/nfs/dbraw/zinc/22/75/18/455227518.db2.gz	UDUIRDYKSNAKQU-UHFFFAOYSA-N	0	3	341.430	3.453	20	30		EGEDHN
CC(C)(C)O[C@@H]1C[C@H](NCC(=O)Nc2sccc2C#N)C1(C)C	ZINC000412061728	458074646	/nfs/dbraw/zinc/07/46/46/458074646.db2.gz	BGHTUJLXHHEJEV-QWHCGFSZSA-N	0	3	335.473	3.130	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@H](C)N[C@H](C)c1cccc(-n2cccn2)c1	ZINC000173206569	455247941	/nfs/dbraw/zinc/24/79/41/455247941.db2.gz	SLMHMXCQNIOEFY-SJORKVTESA-N	0	3	340.471	3.336	20	30		EGEDHN
C[C@H](N[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccc(OCC#N)cc1	ZINC000183317603	455276660	/nfs/dbraw/zinc/27/66/60/455276660.db2.gz	XTVQICWMAHDDGL-HOCLYGCPSA-N	0	3	345.443	3.249	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@@H](C)C2(CO)CC2)cc1OC	ZINC000623564196	460615211	/nfs/dbraw/zinc/61/52/11/460615211.db2.gz	VJDIJNXMGDAEQN-LBPRGKRZSA-N	0	3	325.836	3.164	20	30		EGEDHN
N#CCc1ccc(OC[C@H](O)CN[C@H](c2ccccc2)C2CC2)cc1	ZINC000023678815	453715371	/nfs/dbraw/zinc/71/53/71/453715371.db2.gz	ZHKRJPQPOAYZKL-TZIWHRDSSA-N	0	3	336.435	3.233	20	30		EGEDHN
CC(C)[C@@H](NC[C@H](O)COc1ccc(C#N)cc1)c1ccc(F)cc1	ZINC000023678039	453715403	/nfs/dbraw/zinc/71/54/03/453715403.db2.gz	CZATWODAYBBWGI-AZUAARDMSA-N	0	3	342.414	3.424	20	30		EGEDHN
CN(CCCCN1C(=O)c2ccccc2C1=O)Cc1cccc(C#N)c1	ZINC000026327487	453796790	/nfs/dbraw/zinc/79/67/90/453796790.db2.gz	RASAECXHPMGMOR-UHFFFAOYSA-N	0	3	347.418	3.066	20	30		EGEDHN
CN(CCOc1ccccc1F)CCC(=O)Nc1cccc(C#N)c1	ZINC000026337166	453797098	/nfs/dbraw/zinc/79/70/98/453797098.db2.gz	PFEFOQPDIGTENB-UHFFFAOYSA-N	0	3	341.386	3.037	20	30		EGEDHN
C[C@@H](c1cccs1)N(C)C[C@@H](O)COc1ccc(CC#N)cc1	ZINC000028694670	453824380	/nfs/dbraw/zinc/82/43/80/453824380.db2.gz	LEEJJUHRURJSRH-GOEBONIOSA-N	0	3	330.453	3.247	20	30		EGEDHN
N#CCC[C@@H](C#N)CNCC1(c2cccc(Cl)c2)CCOCC1	ZINC000066483777	453848333	/nfs/dbraw/zinc/84/83/33/453848333.db2.gz	ZYVRTIBJMSPVSW-HNNXBMFYSA-N	0	3	331.847	3.421	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H](C)c2ccccc2C(F)(F)F)CC1	ZINC000066922353	453885459	/nfs/dbraw/zinc/88/54/59/453885459.db2.gz	PNWKDTACZJYRJG-CYBMUJFWSA-N	0	3	338.373	3.228	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(Oc3ccccc3)nc2)CC1	ZINC000067237303	453913769	/nfs/dbraw/zinc/91/37/69/453913769.db2.gz	PRXKCXDPQGUPJS-UHFFFAOYSA-N	0	3	335.407	3.158	20	30		EGEDHN
CCC[C@H](C)N(C)CC(=O)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000075703513	453919544	/nfs/dbraw/zinc/91/95/44/453919544.db2.gz	FYOXXPUORVWKNV-AWEZNQCLSA-N	0	3	340.389	3.294	20	30		EGEDHN
N#Cc1cccc(NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)c1	ZINC000075984683	453945555	/nfs/dbraw/zinc/94/55/55/453945555.db2.gz	MOHWDLRFGCPWKF-LJQANCHMSA-N	0	3	334.423	3.344	20	30		EGEDHN
COc1ccccc1CN[C@@H]1CCCN(c2ccc(C#N)cc2F)C1	ZINC000068991419	454070459	/nfs/dbraw/zinc/07/04/59/454070459.db2.gz	QQHUTVAYAQOVGV-QGZVFWFLSA-N	0	3	339.414	3.465	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc3c(c2)OC2(CCCC2)O3)CC1	ZINC000057152784	454106701	/nfs/dbraw/zinc/10/67/01/454106701.db2.gz	YKVDMCAIBUFEMG-UHFFFAOYSA-N	0	3	340.423	3.012	20	30		EGEDHN
CN(C)Cc1ccc(CNC(=O)Nc2ccc(F)c(C#N)c2)cc1	ZINC000077500229	454114055	/nfs/dbraw/zinc/11/40/55/454114055.db2.gz	PXNKTASJZAEWPL-UHFFFAOYSA-N	0	3	326.375	3.081	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)C2(C#N)CCCCC2)C1	ZINC000057398022	454125265	/nfs/dbraw/zinc/12/52/65/454125265.db2.gz	IHMOYHLEJGBQHJ-AEFFLSMTSA-N	0	3	325.456	3.412	20	30		EGEDHN
C=CCOc1ccccc1CNC1CCN(Cc2ccccn2)CC1	ZINC000069710692	454136443	/nfs/dbraw/zinc/13/64/43/454136443.db2.gz	GSJRXKUOXAVBLT-UHFFFAOYSA-N	0	3	337.467	3.401	20	30		EGEDHN
COc1ccc(CN2CCC(CNc3cnccc3C#N)CC2)cc1	ZINC000094151320	454189689	/nfs/dbraw/zinc/18/96/89/454189689.db2.gz	XJGLALCHJPXKNX-UHFFFAOYSA-N	0	3	336.439	3.286	20	30		EGEDHN
C=C[C@H](CC(=O)NC1CCN(CCOC(C)C)CC1)c1ccccc1	ZINC000119480070	454198518	/nfs/dbraw/zinc/19/85/18/454198518.db2.gz	KMYNRDCOISOEIV-GOSISDBHSA-N	0	3	344.499	3.352	20	30		EGEDHN
Cc1ccc(C(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)cc1F	ZINC000047011242	454318791	/nfs/dbraw/zinc/31/87/91/454318791.db2.gz	MKWUVFXJEWRTQN-UHFFFAOYSA-N	0	3	339.414	3.210	20	30		EGEDHN
COc1ccc(CNCc2ccc(N(C)CCC#N)cc2)cc1OC	ZINC000072659260	454323631	/nfs/dbraw/zinc/32/36/31/454323631.db2.gz	OOCCAWZANOHJAF-UHFFFAOYSA-N	0	3	339.439	3.343	20	30		EGEDHN
C[C@H]1C[C@H](N(C)C(=O)C2(C#N)CCC2)CCN1Cc1ccccc1	ZINC000132303815	454328546	/nfs/dbraw/zinc/32/85/46/454328546.db2.gz	OOROTCVQSLKIAV-FUHWJXTLSA-N	0	3	325.456	3.192	20	30		EGEDHN
C=CCN(CCOC)CCC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000191102575	455443234	/nfs/dbraw/zinc/44/32/34/455443234.db2.gz	UOTXFYLIJJDNLN-UHFFFAOYSA-N	0	3	330.350	3.168	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N1CCC2(C1)CCOCC2	ZINC000072898784	454360197	/nfs/dbraw/zinc/36/01/97/454360197.db2.gz	CUDWLKBPHSCYGW-INIZCTEOSA-N	0	3	348.512	3.154	20	30		EGEDHN
CN(C)[C@@H](CNC(=O)N(C)Cc1cccc(C#N)c1)c1ccccc1	ZINC000079121272	454372034	/nfs/dbraw/zinc/37/20/34/454372034.db2.gz	WLNYVELSZKFXJE-IBGZPJMESA-N	0	3	336.439	3.003	20	30		EGEDHN
C=CCOc1ccc(CN2CCC[C@H](c3cc[nH]n3)C2)cc1OC	ZINC000121236754	454410077	/nfs/dbraw/zinc/41/00/77/454410077.db2.gz	QRDLVFDOJZKTGK-INIZCTEOSA-N	0	3	327.428	3.363	20	30		EGEDHN
N#CC(C(=O)c1cccc(-n2cccn2)n1)c1ccc2ccccc2n1	ZINC000606145668	460636503	/nfs/dbraw/zinc/63/65/03/460636503.db2.gz	JALLEFMWBRLROR-HNNXBMFYSA-N	0	3	339.358	3.306	20	30		EGEDHN
C#CCCN1CCN(c2ccnc3ccc(Br)cc32)CC1	ZINC000091480557	454439989	/nfs/dbraw/zinc/43/99/89/454439989.db2.gz	NMXIQHLLDIBMGJ-UHFFFAOYSA-N	0	3	344.256	3.143	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN(C)[C@H](C)C2CC2)cc1	ZINC000073800503	454484562	/nfs/dbraw/zinc/48/45/62/454484562.db2.gz	FKCWDQKTJYREIZ-OAHLLOKOSA-N	0	3	329.444	3.062	20	30		EGEDHN
C=CCCC(=O)N(CCN(C)C)Cc1ccc(Br)cc1	ZINC000102342468	454500607	/nfs/dbraw/zinc/50/06/07/454500607.db2.gz	IQSGAEAOQLLHED-UHFFFAOYSA-N	0	3	339.277	3.306	20	30		EGEDHN
C=CCOc1ccc(CN2CCC[C@H](c3ncc[nH]3)C2)cc1OC	ZINC000092072804	454515681	/nfs/dbraw/zinc/51/56/81/454515681.db2.gz	WMLZRFIJZOSVRN-INIZCTEOSA-N	0	3	327.428	3.363	20	30		EGEDHN
C[C@@H]1CN(CC2CCN(Cc3ccc(F)cc3C#N)CC2)C[C@H](C)O1	ZINC000103142418	454539713	/nfs/dbraw/zinc/53/97/13/454539713.db2.gz	APHSXHWQBNXDFV-IYBDPMFKSA-N	0	3	345.462	3.019	20	30		EGEDHN
COC1CCN(CCNc2c(C#N)cnc3c(C)cc(F)cc32)CC1	ZINC000080249982	454556992	/nfs/dbraw/zinc/55/69/92/454556992.db2.gz	SZEBCUSZXFKTGI-UHFFFAOYSA-N	0	3	342.418	3.077	20	30		EGEDHN
Cc1ccccc1CN1CCCN(C(=O)c2cccc(CC#N)c2)CC1	ZINC000049704168	454557825	/nfs/dbraw/zinc/55/78/25/454557825.db2.gz	LFCWWNIITSKNOO-UHFFFAOYSA-N	0	3	347.462	3.409	20	30		EGEDHN
N#CC(C(=O)COc1ccc(F)cc1)C(=O)Nc1ccccc1Cl	ZINC000103504487	454561626	/nfs/dbraw/zinc/56/16/26/454561626.db2.gz	PRYGVDCWVGOCLN-ZDUSSCGKSA-N	0	3	346.745	3.205	20	30		EGEDHN
N#CC1(NC(=O)CN[C@H](c2ccccc2)C2CCC2)CCCCC1	ZINC000104701542	454596657	/nfs/dbraw/zinc/59/66/57/454596657.db2.gz	XFLIFZWHFWCWQI-LJQANCHMSA-N	0	3	325.456	3.460	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)COc2cccc(Cl)c2C)CC1	ZINC000134862387	454599366	/nfs/dbraw/zinc/59/93/66/454599366.db2.gz	CVGVQNMXHGBFSU-UHFFFAOYSA-N	0	3	336.863	3.184	20	30		EGEDHN
O=C(C#Cc1ccccc1)NC[C@H]1CCCN(Cc2cccs2)C1	ZINC000080610738	454606174	/nfs/dbraw/zinc/60/61/74/454606174.db2.gz	CWEGSGWHFKKVHE-GOSISDBHSA-N	0	3	338.476	3.128	20	30		EGEDHN
CN(C)CCN(Cc1cccs1)c1snc(Cl)c1C#N	ZINC000092683931	454609876	/nfs/dbraw/zinc/60/98/76/454609876.db2.gz	CRAGFPXRGDQQNL-UHFFFAOYSA-N	0	3	326.878	3.298	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc3cccc(OC)c3o2)CC1	ZINC000106036545	454674470	/nfs/dbraw/zinc/67/44/70/454674470.db2.gz	PNCZHDFCRWDNBM-UHFFFAOYSA-N	0	3	328.412	3.212	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCOc2cccc(C)c2C)CC1	ZINC000106037446	454674571	/nfs/dbraw/zinc/67/45/71/454674571.db2.gz	AMQQXMYNNIAEPO-UHFFFAOYSA-N	0	3	330.472	3.229	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C2(c3ccc(C)c(OC)c3)CC2)CC1	ZINC000106035289	454674840	/nfs/dbraw/zinc/67/48/40/454674840.db2.gz	ZCHOQSJKZWANJB-UHFFFAOYSA-N	0	3	342.483	3.192	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)/C=C/c2ccc3ccccc3n2)CC1	ZINC000106040160	454676016	/nfs/dbraw/zinc/67/60/16/454676016.db2.gz	LHQLHXSPHQACRZ-MDZDMXLPSA-N	0	3	335.451	3.405	20	30		EGEDHN
CN(CCC#N)c1ccc(CN(CCCO)Cc2ccccc2)cc1	ZINC000093102168	454683365	/nfs/dbraw/zinc/68/33/65/454683365.db2.gz	DMMNAOABDXOLHW-UHFFFAOYSA-N	0	3	337.467	3.421	20	30		EGEDHN
C=C(C)CN1CCC(NCc2csc(-c3ccccn3)n2)CC1	ZINC000106245540	454687415	/nfs/dbraw/zinc/68/74/15/454687415.db2.gz	NSGJURCEJJITTP-UHFFFAOYSA-N	0	3	328.485	3.335	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](C)c2cc(F)ccc2OC)CC1	ZINC000106261324	454688640	/nfs/dbraw/zinc/68/86/40/454688640.db2.gz	GFKVALRTLXHCBG-AWEZNQCLSA-N	0	3	349.450	3.235	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2cc3ccccc3o2)CC1	ZINC000106265074	454688827	/nfs/dbraw/zinc/68/88/27/454688827.db2.gz	KSDHDZQTAKFCGA-UHFFFAOYSA-N	0	3	327.428	3.273	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)[C@@H](C)c2ccc(OC)cc2)CC1	ZINC000106275907	454689371	/nfs/dbraw/zinc/68/93/71/454689371.db2.gz	FCOKEYDFWKZGJW-INIZCTEOSA-N	0	3	345.487	3.438	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc(NC(=O)CC)cc2)CC1	ZINC000106320920	454690269	/nfs/dbraw/zinc/69/02/69/454690269.db2.gz	XICNSCDJTQYWLE-UHFFFAOYSA-N	0	3	344.459	3.197	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cccc(COCC)c2)CC1	ZINC000106324831	454690999	/nfs/dbraw/zinc/69/09/99/454690999.db2.gz	OFJKYENEZKAMJH-UHFFFAOYSA-N	0	3	331.460	3.385	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc(C(=O)CC)cc2)CC1	ZINC000626737051	460648869	/nfs/dbraw/zinc/64/88/69/460648869.db2.gz	RCQMGDGHHRUFHV-UHFFFAOYSA-N	0	3	329.444	3.441	20	30		EGEDHN
C=CC1CCN(Cc2ccccc2OCC(=O)N2CCCC2)CC1	ZINC000093359301	454708473	/nfs/dbraw/zinc/70/84/73/454708473.db2.gz	XQIRERGRPUHGEW-UHFFFAOYSA-N	0	3	328.456	3.086	20	30		EGEDHN
Cc1ccc(C(=O)N(CCN(C)C)Cc2cccc(C#N)c2)c(F)c1	ZINC000176245920	454716803	/nfs/dbraw/zinc/71/68/03/454716803.db2.gz	JSVCFDCPUXOSPQ-UHFFFAOYSA-N	0	3	339.414	3.210	20	30		EGEDHN
N#Cc1ccc([C@H](NCC2(Cc3ccccc3)CCC2)C(N)=O)cc1	ZINC000124397787	454728363	/nfs/dbraw/zinc/72/83/63/454728363.db2.gz	VEUTUIBCXJCFFW-IBGZPJMESA-N	0	3	333.435	3.087	20	30		EGEDHN
C=CCOc1ccc(CN2CC[C@@H](COCCOC)C2)cc1Cl	ZINC000093754147	454731855	/nfs/dbraw/zinc/73/18/55/454731855.db2.gz	NHGGKYSNTKWMPN-MRXNPFEDSA-N	0	3	339.863	3.390	20	30		EGEDHN
COc1ccc(CNCCc2c(C)noc2C)cc1OCCCC#N	ZINC000107321101	454751505	/nfs/dbraw/zinc/75/15/05/454751505.db2.gz	XZWCTVFWNHNXRL-UHFFFAOYSA-N	0	3	343.427	3.315	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC[C@@H](C)Oc2cccc(C)c2)CC1	ZINC000176501380	454752502	/nfs/dbraw/zinc/75/25/02/454752502.db2.gz	GQPWCLZWUSEJFO-QGZVFWFLSA-N	0	3	345.487	3.102	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H](CCNCc2ccc(C#N)s2)C1	ZINC000176965655	454804960	/nfs/dbraw/zinc/80/49/60/454804960.db2.gz	WNPHYJVQUBOIBY-CYBMUJFWSA-N	0	3	335.473	3.356	20	30		EGEDHN
N#Cc1ccc(CNc2ccc(CCN3CCSCC3)cc2)o1	ZINC000125336157	454815578	/nfs/dbraw/zinc/81/55/78/454815578.db2.gz	RGCBQBXMDMMXIO-UHFFFAOYSA-N	0	3	327.453	3.355	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)C2(C#N)CCCC2)N2CCCC2)cc1	ZINC000143190750	454841967	/nfs/dbraw/zinc/84/19/67/454841967.db2.gz	WXRURXCFRRMMLP-SFHVURJKSA-N	0	3	325.456	3.332	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](C)c2csc(CC)n2)CC1	ZINC000111495970	454867420	/nfs/dbraw/zinc/86/74/20/454867420.db2.gz	RTMIMAUHUPBZGR-ZDUSSCGKSA-N	0	3	336.505	3.106	20	30		EGEDHN
CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccc(SCC#N)c1	ZINC000177808932	454908901	/nfs/dbraw/zinc/90/89/01/454908901.db2.gz	UNAWDPCWXSSTJI-CVEARBPZSA-N	0	3	329.469	3.001	20	30		EGEDHN
CC#CCCNCc1cc(Br)c(OCC)c(OC)c1	ZINC000166295864	454909532	/nfs/dbraw/zinc/90/95/32/454909532.db2.gz	GKGBTLGMLAWEAK-UHFFFAOYSA-N	0	3	326.234	3.359	20	30		EGEDHN
CCN1CCCC[C@H]1C(=O)NCC#Cc1ccc(C(F)(F)F)cc1	ZINC000175717677	455487038	/nfs/dbraw/zinc/48/70/38/455487038.db2.gz	KYJBMECVIRBOSN-INIZCTEOSA-N	0	3	338.373	3.048	20	30		EGEDHN
C=CCc1cc(CNC[C@H](O)c2ccc(C)cc2)cc(OC)c1O	ZINC000113326176	454923183	/nfs/dbraw/zinc/92/31/83/454923183.db2.gz	CGMFIMOUKLXGHX-SFHVURJKSA-N	0	3	327.424	3.261	20	30		EGEDHN
C[C@@H](CN1CCC[C@H](C)C1)NC(=O)c1cccc(SCC#N)c1	ZINC000246433700	455490293	/nfs/dbraw/zinc/49/02/93/455490293.db2.gz	CUPQDCFXKJSIOO-GJZGRUSLSA-N	0	3	331.485	3.152	20	30		EGEDHN
CCN(CCC#N)C(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000127331969	454954839	/nfs/dbraw/zinc/95/48/39/454954839.db2.gz	HJLPDABLFOFZDQ-UHFFFAOYSA-N	0	3	344.459	3.319	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](C)c2cccc(F)c2F)CC1	ZINC000127356507	454957121	/nfs/dbraw/zinc/95/71/21/454957121.db2.gz	YAGYCSOIOSLXJN-ZDUSSCGKSA-N	0	3	337.414	3.366	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(OC)cc2OCCC)CC1	ZINC000191547149	455495639	/nfs/dbraw/zinc/49/56/39/455495639.db2.gz	RWUZAOWYAXOZCI-UHFFFAOYSA-N	0	3	346.471	3.254	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000155412065	454999271	/nfs/dbraw/zinc/99/92/71/454999271.db2.gz	FYCIOAZZNMFEBY-KRWDZBQOSA-N	0	3	346.471	3.471	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000128281303	455041585	/nfs/dbraw/zinc/04/15/85/455041585.db2.gz	LHZQKSNNGVNFCW-CRAIPNDOSA-N	0	3	330.428	3.143	20	30		EGEDHN
C[C@@H]1CCC[C@@](C#N)(NC(=O)[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000116808671	455071239	/nfs/dbraw/zinc/07/12/39/455071239.db2.gz	UHMRTEAPKFDUNJ-YFVAEKQCSA-N	0	3	339.483	3.487	20	30		EGEDHN
C=CC[C@@H](C)NC(=O)NC[C@H](c1cccc(OC)c1)N1CCCC1	ZINC000117026308	455077754	/nfs/dbraw/zinc/07/77/54/455077754.db2.gz	JNRMXZZOYDHUEQ-CRAIPNDOSA-N	0	3	331.460	3.096	20	30		EGEDHN
C=CCN1CCC(NC(=O)CCCc2nc3ccccc3s2)CC1	ZINC000171727617	455089607	/nfs/dbraw/zinc/08/96/07/455089607.db2.gz	FWTJMYCAIJZMGS-UHFFFAOYSA-N	0	3	343.496	3.386	20	30		EGEDHN
COc1ccc(F)cc1[C@H](C)NCCC(=O)Nc1sccc1C#N	ZINC000179928174	455100598	/nfs/dbraw/zinc/10/05/98/455100598.db2.gz	BSFRLQAHOXRMMB-NSHDSACASA-N	0	3	347.415	3.447	20	30		EGEDHN
C=CCC[C@@H](NCC(=O)NC(=O)NC1CCCC1)c1ccccc1	ZINC000180042605	455121035	/nfs/dbraw/zinc/12/10/35/455121035.db2.gz	ZXQMFJLKTWCUHG-QGZVFWFLSA-N	0	3	329.444	3.052	20	30		EGEDHN
Cc1ccccc1[C@H](NCC(=O)N(CCC#N)CCC#N)C(C)(C)C	ZINC000180094182	455131059	/nfs/dbraw/zinc/13/10/59/455131059.db2.gz	SVQPIMLELXEQPD-IBGZPJMESA-N	0	3	340.471	3.328	20	30		EGEDHN
C[C@H]1CN(CCC2CCN(Cc3ccc(C#N)s3)CC2)C[C@H](C)O1	ZINC000180181794	455145380	/nfs/dbraw/zinc/14/53/80/455145380.db2.gz	MQFFYRDAEGWJDQ-HOTGVXAUSA-N	0	3	347.528	3.331	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCC(C)(C)Cc2ccccc2)CC1	ZINC000172336161	455147074	/nfs/dbraw/zinc/14/70/74/455147074.db2.gz	DEFFJBYVBZRBSZ-UHFFFAOYSA-N	0	3	329.488	3.205	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2CCCN(C3CCCC3)CC2)cc1	ZINC000172417053	455152475	/nfs/dbraw/zinc/15/24/75/455152475.db2.gz	CRZFGAIDFFMAFZ-UHFFFAOYSA-N	0	3	328.456	3.342	20	30		EGEDHN
CC[C@@H](N[C@@H](C)C(=O)NC1(C#N)CCCCC1)c1ccc(OC)cc1	ZINC000157029741	455162052	/nfs/dbraw/zinc/16/20/52/455162052.db2.gz	QLCLWSRJGHHWQT-MAUKXSAKSA-N	0	3	343.471	3.467	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H]2C[C@@H]2c2cccc(F)c2)CC1	ZINC000264382464	455201410	/nfs/dbraw/zinc/20/14/10/455201410.db2.gz	LPJQJWVQPDFWSI-MSOLQXFVSA-N	0	3	331.435	3.021	20	30		EGEDHN
N#Cc1nccnc1NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000264391870	455203759	/nfs/dbraw/zinc/20/37/59/455203759.db2.gz	KRRZPCOTLCUCJB-UHFFFAOYSA-N	0	3	341.846	3.326	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCC2(Cc3ccccc3)CC2)CC1	ZINC000158186190	455278521	/nfs/dbraw/zinc/27/85/21/455278521.db2.gz	BJDOHTVLGWEYIY-UHFFFAOYSA-N	0	3	341.499	3.349	20	30		EGEDHN
C=CCNC(=O)Nc1ccc(NC(=O)[C@@H](C)N2[C@H](C)CC[C@@H]2C)cc1	ZINC000245202873	455280318	/nfs/dbraw/zinc/28/03/18/455280318.db2.gz	WUGJMSCMQGNJHU-QLFBSQMISA-N	0	3	344.459	3.194	20	30		EGEDHN
CCCCCCCC(=O)NCc1ccccc1CN1CC[C@H](O)C1	ZINC000183461810	455295776	/nfs/dbraw/zinc/29/57/76/455295776.db2.gz	UUGNUUZPFLODCE-IBGZPJMESA-N	0	3	332.488	3.230	20	30		EGEDHN
C#CCOc1ccccc1CNCc1ccc(N(C)CCC#N)cc1	ZINC000265199086	455302412	/nfs/dbraw/zinc/30/24/12/455302412.db2.gz	PLDZMZXKQYVTBM-UHFFFAOYSA-N	0	3	333.435	3.338	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN(C)C[C@H](C)c1nccs1	ZINC000183932052	455340462	/nfs/dbraw/zinc/34/04/62/455340462.db2.gz	DGGRHRRJRPTYPQ-RDJZCZTQSA-N	0	3	346.496	3.347	20	30		EGEDHN
C[C@@H](CCc1ccccc1)N[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000190613072	455353262	/nfs/dbraw/zinc/35/32/62/455353262.db2.gz	NHIJFKRBHXJZMJ-UWJYYQICSA-N	0	3	347.462	3.270	20	30		EGEDHN
Cc1ccc([C@@H](C)N[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)cc1	ZINC000190631825	455356664	/nfs/dbraw/zinc/35/66/64/455356664.db2.gz	ZVTTXJGBVVZAOD-OXQOHEQNSA-N	0	3	333.435	3.318	20	30		EGEDHN
C=C(C)CN(C)C(=O)Nc1ccc(CCN2CCSCC2)cc1	ZINC000181662089	455369724	/nfs/dbraw/zinc/36/97/24/455369724.db2.gz	DNQVALPXAHUKOQ-UHFFFAOYSA-N	0	3	333.501	3.318	20	30		EGEDHN
N#CC(C(=O)c1ccc(N2CCCC2)nc1)c1cnc2ccccc2n1	ZINC000190883549	455397778	/nfs/dbraw/zinc/39/77/78/455397778.db2.gz	VIWPQDLMAKBMKQ-HNNXBMFYSA-N	0	3	343.390	3.115	20	30		EGEDHN
N#CC(C(=O)c1ccc2c(c1)CCC(=O)N2)c1cnc2ccccc2n1	ZINC000190894168	455399673	/nfs/dbraw/zinc/39/96/73/455399673.db2.gz	NRPCXMGLMPOSOL-CQSZACIVSA-N	0	3	342.358	3.005	20	30		EGEDHN
N#CC(C(=O)c1ccc(-n2cccn2)cc1)c1cnc2ccccc2n1	ZINC000190910418	455403350	/nfs/dbraw/zinc/40/33/50/455403350.db2.gz	HRPGQQLWLQWJKY-MRXNPFEDSA-N	0	3	339.358	3.306	20	30		EGEDHN
COc1ccc(CN2CCN(C)C[C@@H]2C(C)C)cc1OCCCC#N	ZINC000184740818	455440429	/nfs/dbraw/zinc/44/04/29/455440429.db2.gz	QRQBBJODUVKPAD-GOSISDBHSA-N	0	3	345.487	3.150	20	30		EGEDHN
CC(C)CN(CCN(C)C)C(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000160532839	455470987	/nfs/dbraw/zinc/47/09/87/455470987.db2.gz	WEIKEBGEPUSIAX-SFHVURJKSA-N	0	3	330.476	3.261	20	30		EGEDHN
CC[C@H](NCC(=O)N(CCC#N)c1cc(C)cc(C)c1)[C@@H]1CCCO1	ZINC000182304231	455483767	/nfs/dbraw/zinc/48/37/67/455483767.db2.gz	CYXZBIUGKUNRIV-OALUTQOASA-N	0	3	343.471	3.097	20	30		EGEDHN
COc1cc(CN2CCN(CCCC(C)(C)C#N)CC2)cc(OC)c1	ZINC000267019209	455493503	/nfs/dbraw/zinc/49/35/03/455493503.db2.gz	JTGBWKFUAWGZTR-UHFFFAOYSA-N	0	3	345.487	3.151	20	30		EGEDHN
C[C@@](C#N)(NC(=O)CN1CCC[C@H]1CCCc1ccccc1)C1CC1	ZINC000246560175	455507524	/nfs/dbraw/zinc/50/75/24/455507524.db2.gz	BJLFWSOFGLLQDT-CTNGQTDRSA-N	0	3	339.483	3.282	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)Cc2ccc(C#N)cc2)CCN1Cc1ccccc1	ZINC000176105278	455540526	/nfs/dbraw/zinc/54/05/26/455540526.db2.gz	HSWWEPMERFFFIR-UWJYYQICSA-N	0	3	347.462	3.270	20	30		EGEDHN
C#CCC(C)(C)C(=O)Nc1ccc(N(C)C2CCN(C)CC2)cc1	ZINC000185436041	455557995	/nfs/dbraw/zinc/55/79/95/455557995.db2.gz	JGAINXSUFZDKEH-UHFFFAOYSA-N	0	3	327.472	3.205	20	30		EGEDHN
N#Cc1cccc(OCCN[C@H]2CCO[C@H]2c2ccc(F)c(F)c2)c1	ZINC000192138708	455563049	/nfs/dbraw/zinc/56/30/49/455563049.db2.gz	UWENXAAKNGUWCA-OALUTQOASA-N	0	3	344.361	3.335	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N1CCC[C@H](N(C)C)C1)c1ccc(F)c(F)c1	ZINC000185836801	455632623	/nfs/dbraw/zinc/63/26/23/455632623.db2.gz	YDAYZWCHJPLEEQ-YOEHRIQHSA-N	0	3	337.414	3.318	20	30		EGEDHN
C=CCN1CCC(NCc2c(F)cccc2Br)CC1	ZINC000192539480	455639222	/nfs/dbraw/zinc/63/92/22/455639222.db2.gz	SHZMPSZVVAWZDI-UHFFFAOYSA-N	0	3	327.241	3.328	20	30		EGEDHN
N#CCN(C[C@H]1CN(Cc2ccccc2)CCCO1)C1CCCC1	ZINC000284286561	455663247	/nfs/dbraw/zinc/66/32/47/455663247.db2.gz	YHRGYBDXJBMAFD-HXUWFJFHSA-N	0	3	327.472	3.046	20	30		EGEDHN
C=CCOCCCC(=O)N(C)CCC1CCN(c2ccncc2)CC1	ZINC000271512483	455665689	/nfs/dbraw/zinc/66/56/89/455665689.db2.gz	JAISAOFSDJYYQU-UHFFFAOYSA-N	0	3	345.487	3.129	20	30		EGEDHN
C[C@@H](C1CC1)N(CC(=O)N[C@](C)(C#N)C1CC1)Cc1ccccc1	ZINC000268807829	455713623	/nfs/dbraw/zinc/71/36/23/455713623.db2.gz	FQVAZZISMSYGFQ-MGPUTAFESA-N	0	3	325.456	3.096	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCC[C@@H](c2nnc3ccccn32)C1	ZINC000186236697	455723315	/nfs/dbraw/zinc/72/33/15/455723315.db2.gz	VAERVESMCGIMLY-GOSISDBHSA-N	0	3	331.423	3.289	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN2CCC[C@@H](Cc3nccn3C)C2)cc1	ZINC000248905534	455737982	/nfs/dbraw/zinc/73/79/82/455737982.db2.gz	YHKQNHCUNXMEMP-WMZOPIPTSA-N	0	3	338.455	3.166	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(O)ccc2C(F)(F)F)CC1	ZINC000193175741	455745871	/nfs/dbraw/zinc/74/58/71/455745871.db2.gz	WZQUZTMLGQGFMM-UHFFFAOYSA-N	0	3	342.361	3.181	20	30		EGEDHN
COc1ccc([C@H](NCC(=O)Nc2ccc(C#N)cc2)C2CC2)cc1	ZINC000193344421	455754212	/nfs/dbraw/zinc/75/42/12/455754212.db2.gz	BMHUMHCXHQTUJC-HXUWFJFHSA-N	0	3	335.407	3.246	20	30		EGEDHN
Cc1ccc(CN(C)C)cc1NC(=O)c1cc(C#N)cc(N(C)C)c1	ZINC000293265058	455779925	/nfs/dbraw/zinc/77/99/25/455779925.db2.gz	GBIZJLFATXAOEU-UHFFFAOYSA-N	0	3	336.439	3.247	20	30		EGEDHN
N#CCCCOc1cccc(CN2CCSC3(CCOCC3)C2)c1	ZINC000186496515	455782066	/nfs/dbraw/zinc/78/20/66/455782066.db2.gz	BQROJBPNXPRDMW-UHFFFAOYSA-N	0	3	346.496	3.467	20	30		EGEDHN
CCc1ccc([C@H](C#N)NC(=O)C2C[C@@H](c3ccccc3)OC2=O)cc1	ZINC000293406835	455786143	/nfs/dbraw/zinc/78/61/43/455786143.db2.gz	MXTVJJJLBNCIRN-FHWLQOOXSA-N	0	3	348.402	3.234	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)c1sccc1Cl	ZINC000285078900	455786017	/nfs/dbraw/zinc/78/60/17/455786017.db2.gz	KONXIQDDXYNERE-UHFFFAOYSA-N	0	3	347.871	3.477	20	30		EGEDHN
C#CCOc1ccccc1CN[C@H](C)C1CN(C(=O)OC(C)(C)C)C1	ZINC000293742785	455795509	/nfs/dbraw/zinc/79/55/09/455795509.db2.gz	XKFWDUFMCRKMOW-OAHLLOKOSA-N	0	3	344.455	3.044	20	30		EGEDHN
C#CCN(C)CCCNC(=O)CCCCc1nc2ccccc2s1	ZINC000293864578	455799452	/nfs/dbraw/zinc/79/94/52/455799452.db2.gz	BMQUGJNCSHMZDI-UHFFFAOYSA-N	0	3	343.496	3.080	20	30		EGEDHN
Cc1cccc(OC[C@@H](O)CN[C@@H](C)c2ccc(C#N)c(F)c2)c1	ZINC000271944346	455801225	/nfs/dbraw/zinc/80/12/25/455801225.db2.gz	PNQMIUXTHJMCQC-YOEHRIQHSA-N	0	3	328.387	3.096	20	30		EGEDHN
C[C@@H](NCc1ccccc1OCCN(C)C)c1ccc(C#N)c(F)c1	ZINC000271955788	455803829	/nfs/dbraw/zinc/80/38/29/455803829.db2.gz	PSNFVXVRGPVZHL-OAHLLOKOSA-N	0	3	341.430	3.489	20	30		EGEDHN
CCC[C@@H](CNCc1cn(CCC#N)nc1-c1ccccc1)OC	ZINC000295043508	455836414	/nfs/dbraw/zinc/83/64/14/455836414.db2.gz	FBAGNFZWOTULCO-SFHVURJKSA-N	0	3	326.444	3.368	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(Cl)c3ccccc3n2)CC1	ZINC000295111029	455839015	/nfs/dbraw/zinc/83/90/15/455839015.db2.gz	LCHHJSNFFCLSQG-UHFFFAOYSA-N	0	3	329.831	3.268	20	30		EGEDHN
CC[C@@H](NC[C@@H](O)c1cc(OC)cc(OC)c1)c1ccc(C#N)cc1	ZINC000278668018	455844030	/nfs/dbraw/zinc/84/40/30/455844030.db2.gz	JBGBIELILPRZTP-WOJBJXKFSA-N	0	3	340.423	3.350	20	30		EGEDHN
CC[C@@H](NC[C@H](O)COc1ccc(F)c(F)c1)c1ccc(C#N)cc1	ZINC000278672715	455844377	/nfs/dbraw/zinc/84/43/77/455844377.db2.gz	JGKZNHSALKIBLI-HNAYVOBHSA-N	0	3	346.377	3.317	20	30		EGEDHN
CC[C@H](N[C@H]1CCN(c2ccccc2OC)C1=O)c1ccc(C#N)cc1	ZINC000278891937	455851228	/nfs/dbraw/zinc/85/12/28/455851228.db2.gz	YRIHGNDSSWLYFT-ROUUACIJSA-N	0	3	349.434	3.413	20	30		EGEDHN
C=CC[C@H](C(=O)N1CCN(C2CCOCC2)C[C@@H]1C)c1ccccc1	ZINC000278898540	455852296	/nfs/dbraw/zinc/85/22/96/455852296.db2.gz	RIGYWYWRDPZPAS-PXNSSMCTSA-N	0	3	342.483	3.058	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN[C@H](c1ccc(F)c(C)c1)C1CC1	ZINC000272125030	455852846	/nfs/dbraw/zinc/85/28/46/455852846.db2.gz	UTTRFIORDIOGHP-DJJJIMSYSA-N	0	3	331.435	3.183	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@@H]1[C@H]2CCO[C@@H]2C1(C)C	ZINC000296059544	455868109	/nfs/dbraw/zinc/86/81/09/455868109.db2.gz	GDPVPELOYCFLAL-XWIAVFTESA-N	0	3	346.496	3.306	20	30		EGEDHN
C=CCN1CCC(NC(=O)/C=C\c2cnc(C(C)(C)C)s2)CC1	ZINC000255723738	455872633	/nfs/dbraw/zinc/87/26/33/455872633.db2.gz	MWDAUHKXGWPASP-SREVYHEPSA-N	0	3	333.501	3.220	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)/C=C\c2nc3ccccc3s2)CC1	ZINC000255905461	455875419	/nfs/dbraw/zinc/87/54/19/455875419.db2.gz	ZHJYXSXMNXAIDF-FPLPWBNLSA-N	0	3	341.480	3.466	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)C(C#N)Cc1ccc(C#N)cc1)c1cccnc1	ZINC000280048827	455881680	/nfs/dbraw/zinc/88/16/80/455881680.db2.gz	MBDDBMQIQKUKHH-VQTJNVASSA-N	0	3	346.434	3.192	20	30		EGEDHN
Cc1cc(CN(C)C)cc(NC(=O)Cc2ccc(OCC#N)cc2)c1	ZINC000270346609	455934595	/nfs/dbraw/zinc/93/45/95/455934595.db2.gz	ANAVFRMWYMTGMS-UHFFFAOYSA-N	0	3	337.423	3.140	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2Cc3ccccc3C(C)(C)C2)CC1	ZINC000270378453	455942034	/nfs/dbraw/zinc/94/20/34/455942034.db2.gz	XQICEJAKHQHZPW-UHFFFAOYSA-N	0	3	327.472	3.140	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cc(-c3ccccc3)cnc2C)CC1	ZINC000270469444	455961925	/nfs/dbraw/zinc/96/19/25/455961925.db2.gz	BITJLBSQDVSAKS-UHFFFAOYSA-N	0	3	333.435	3.341	20	30		EGEDHN
C[C@H](OC[C@@H](O)CN1CCC(C)(C#N)CC1)c1ccc(Cl)cc1	ZINC000272505117	455974405	/nfs/dbraw/zinc/97/44/05/455974405.db2.gz	FEKJGWJUMJHZOD-YOEHRIQHSA-N	0	3	336.863	3.404	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NCC(C)(C)N1CCC[C@@H](C)C1	ZINC000195612069	455991470	/nfs/dbraw/zinc/99/14/70/455991470.db2.gz	YZGKOTDDMBQUSR-MRXNPFEDSA-N	0	3	330.472	3.492	20	30		EGEDHN
Cc1nsc(N2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)c1C#N	ZINC000286294876	456018071	/nfs/dbraw/zinc/01/80/71/456018071.db2.gz	JASXKGVOCOTJSO-LJQANCHMSA-N	0	3	338.480	3.426	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2C[C@@H](C)Oc3ccccc32)CC1	ZINC000296725040	456019808	/nfs/dbraw/zinc/01/98/08/456019808.db2.gz	UJHRPKKLVFPVBG-CRAIPNDOSA-N	0	3	343.471	3.238	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1CNCc1cc2c(cc1OC(F)F)OCO2	ZINC000280678519	456028682	/nfs/dbraw/zinc/02/86/82/456028682.db2.gz	QLBVZPXQDBJQRY-MEDUHNTESA-N	0	3	341.354	3.088	20	30		EGEDHN
N#Cc1ccc(Cl)c(C(=O)N2CCCN(C3CCCC3)CC2)c1	ZINC000286384063	456037573	/nfs/dbraw/zinc/03/75/73/456037573.db2.gz	INSVFNQLTDUTMC-UHFFFAOYSA-N	0	3	331.847	3.302	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1	ZINC000280749478	456044679	/nfs/dbraw/zinc/04/46/79/456044679.db2.gz	MCKQUSVIAWNXNU-IBGZPJMESA-N	0	3	337.423	3.335	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN2CC[C@@H](N3CCCC3)[C@@H]2C)c1C	ZINC000286813620	456054116	/nfs/dbraw/zinc/05/41/16/456054116.db2.gz	JTOWRBLNFTUKLA-PKOBYXMFSA-N	0	3	329.488	3.032	20	30		EGEDHN
CN(Cc1ccc(Br)cc1C#N)C1CCC(CO)CC1	ZINC000287672625	456075336	/nfs/dbraw/zinc/07/53/36/456075336.db2.gz	HTCHDWBIIZRFNM-UHFFFAOYSA-N	0	3	337.261	3.304	20	30		EGEDHN
C[C@@H](CN(C)C)NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1	ZINC000287161462	456062418	/nfs/dbraw/zinc/06/24/18/456062418.db2.gz	WNQAHQFOIJBAGB-AWEZNQCLSA-N	0	3	338.411	3.422	20	30		EGEDHN
CC[C@](C)(C#N)C(=O)N1CC[C@@]2(CCN(Cc3ccccc3)C2)C1	ZINC000287982249	456083539	/nfs/dbraw/zinc/08/35/39/456083539.db2.gz	AOCXUPSGWABCJC-WOJBJXKFSA-N	0	3	325.456	3.051	20	30		EGEDHN
CC(C)Oc1ccc([C@H](CNCc2cc(C#N)n(C)c2)N(C)C)cc1	ZINC000288495004	456097507	/nfs/dbraw/zinc/09/75/07/456097507.db2.gz	RJMUBCNBVFACOW-FQEVSTJZSA-N	0	3	340.471	3.076	20	30		EGEDHN
C#CCC(C)(C)c1nc(-c2ccc3c(c2)C(SC)C(=O)N3)no1	ZINC000288888005	456108262	/nfs/dbraw/zinc/10/82/62/456108262.db2.gz	IGJOTSILPHCHTK-ZDUSSCGKSA-N	0	3	327.409	3.394	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cnc(C)nc1C1CC1)C(C)C	ZINC000281169171	456152349	/nfs/dbraw/zinc/15/23/49/456152349.db2.gz	GTKZTOCQLTUMOU-SFHVURJKSA-N	0	3	342.487	3.091	20	30		EGEDHN
C#C[C@H](NC(=O)N(CC)C[C@H]1CCN(Cc2ccccc2)C1)C(C)C	ZINC000281179257	456155233	/nfs/dbraw/zinc/15/52/33/456155233.db2.gz	YMYJWGVSOHWUFV-PMACEKPBSA-N	0	3	341.499	3.198	20	30		EGEDHN
C=C(C)COc1cc(CNCCc2nnc(C)s2)ccc1OC	ZINC000289912207	456178294	/nfs/dbraw/zinc/17/82/94/456178294.db2.gz	RSLMAOIZDMULNY-UHFFFAOYSA-N	0	3	333.457	3.142	20	30		EGEDHN
C=CC[C@@H](CC)NC(=O)N(Cc1ccncc1)C[C@@H]1CCCN1CC	ZINC000281342044	456206882	/nfs/dbraw/zinc/20/68/82/456206882.db2.gz	MADCDABPILEEIY-MOPGFXCFSA-N	0	3	344.503	3.432	20	30		EGEDHN
Cc1ccc([O-])c([C@@H](C)[NH2+][C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)c1	ZINC000273495113	456235303	/nfs/dbraw/zinc/23/53/03/456235303.db2.gz	XQJNSHDKANTWPD-DNVCBOLYSA-N	0	3	349.434	3.419	20	30		EGEDHN
Cc1ccc(O)c([C@@H](C)N[C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)c1	ZINC000273495113	456235310	/nfs/dbraw/zinc/23/53/10/456235310.db2.gz	XQJNSHDKANTWPD-DNVCBOLYSA-N	0	3	349.434	3.419	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@H]1CCCC[C@H]1OC	ZINC000275285999	456272027	/nfs/dbraw/zinc/27/20/27/456272027.db2.gz	WXXPWAWIKRPJOR-GOEBONIOSA-N	0	3	334.485	3.450	20	30		EGEDHN
N#Cc1c(NC(=O)[C@@H]2CCCN(Cc3ccccc3)C2)n[nH]c1C1CC1	ZINC000290290432	456280773	/nfs/dbraw/zinc/28/07/73/456280773.db2.gz	BNFXPHAQCOHGRO-MRXNPFEDSA-N	0	3	349.438	3.009	20	30		EGEDHN
CN1CCN(CCNc2ccc(C(F)(F)F)cc2C#N)CC1(C)C	ZINC000281720212	456301364	/nfs/dbraw/zinc/30/13/64/456301364.db2.gz	VJQWWLLRJYPODH-UHFFFAOYSA-N	0	3	340.393	3.015	20	30		EGEDHN
C=CCN1CC[C@@H](N[C@H](Cc2ccccc2)c2cccs2)C1=O	ZINC000337205216	456338169	/nfs/dbraw/zinc/33/81/69/456338169.db2.gz	KAQIPWXDBJCBPR-IAGOWNOFSA-N	0	3	326.465	3.408	20	30		EGEDHN
CC1(C)CN(Cc2cn(CCC#N)nc2-c2ccccc2)CC[C@@H]1O	ZINC000276027710	456374134	/nfs/dbraw/zinc/37/41/34/456374134.db2.gz	RHAOKPBQNXOTBY-SFHVURJKSA-N	0	3	338.455	3.057	20	30		EGEDHN
Cc1sc(NC(=O)C(C#N)Cc2ccc(C#N)cc2)c(C#N)c1C	ZINC000347976750	456433531	/nfs/dbraw/zinc/43/35/31/456433531.db2.gz	ZIBLOHUDJRAMTK-HNNXBMFYSA-N	0	3	334.404	3.429	20	30		EGEDHN
CC1(C)CN(Cc2ccccc2)CC[C@H]1NC(=O)NCCCCC#N	ZINC000282389033	456497759	/nfs/dbraw/zinc/49/77/59/456497759.db2.gz	JPNSEJMEPSHGJW-GOSISDBHSA-N	0	3	342.487	3.280	20	30		EGEDHN
C[C@H](CNC(=O)NCC(C)(C)CCC#N)N(C)Cc1ccccc1	ZINC000353115187	456500154	/nfs/dbraw/zinc/50/01/54/456500154.db2.gz	UVFHPAYENJGHMI-MRXNPFEDSA-N	0	3	330.476	3.136	20	30		EGEDHN
C=CC1CCN(C[C@H](O)COc2ccc(/C=C\C)cc2OC)CC1	ZINC000348179774	456518454	/nfs/dbraw/zinc/51/84/54/456518454.db2.gz	HISAKNAIWNHXAE-SUZKBHRPSA-N	0	3	331.456	3.366	20	30		EGEDHN
CCC(CC)(CCO)NCC(=O)N(CCC#N)c1ccc(C)c(C)c1	ZINC000282486802	456530888	/nfs/dbraw/zinc/53/08/88/456530888.db2.gz	PIKLMGIXBXMFMY-UHFFFAOYSA-N	0	3	345.487	3.081	20	30		EGEDHN
CN(C)C[C@H](NC(=O)Nc1ccc(CC#N)cc1)c1ccc(F)cc1	ZINC000348224228	456547697	/nfs/dbraw/zinc/54/76/97/456547697.db2.gz	IFQWMVXDCRKALT-SFHVURJKSA-N	0	3	340.402	3.316	20	30		EGEDHN
COc1cc(CN[C@H]2CCN([C@@H](C)c3ccccc3)C2)ccc1C#N	ZINC000353194354	456550983	/nfs/dbraw/zinc/55/09/83/456550983.db2.gz	TVUHDSAVBPIKRV-JXFKEZNVSA-N	0	3	335.451	3.492	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN1CC[C@@H](c2ccc(C)cc2C)C1	ZINC000348306470	456612159	/nfs/dbraw/zinc/61/21/59/456612159.db2.gz	MGQMTJWWTCEJBF-FUHWJXTLSA-N	0	3	327.472	3.101	20	30		EGEDHN
C[C@H]1[C@@H](NC(=O)c2ccccc2-c2ccccc2C#N)CCCN1C	ZINC000343431096	456616070	/nfs/dbraw/zinc/61/60/70/456616070.db2.gz	JPHAJIMSEDGLCP-YWZLYKJASA-N	0	3	333.435	3.438	20	30		EGEDHN
C[C@H](NC[C@@H](O)COc1ccccc1C#N)c1ccccc1Cl	ZINC000320417411	456630125	/nfs/dbraw/zinc/63/01/25/456630125.db2.gz	RVQZYLLVFCBKHZ-DZGCQCFKSA-N	0	3	330.815	3.302	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@@H](NCc1cccc(CN3CCOCC3)c1)CC2	ZINC000353390866	456669220	/nfs/dbraw/zinc/66/92/20/456669220.db2.gz	VMEZDBINAXDUJM-QFIPXVFZSA-N	0	3	347.462	3.168	20	30		EGEDHN
C[C@H](CCNCCS(=O)(=O)c1ccc(C#N)cc1)c1ccccc1	ZINC000325815025	456688195	/nfs/dbraw/zinc/68/81/95/456688195.db2.gz	QEMCTOSYKFGXEL-MRXNPFEDSA-N	0	3	342.464	3.115	20	30		EGEDHN
CN1CC[C@@]2(CCN(c3nc4c(c(C#N)c3C#N)CCCCCC4)C2)C1	ZINC000291621707	456698407	/nfs/dbraw/zinc/69/84/07/456698407.db2.gz	AVSOEDUDXBLCJJ-OAQYLSRUSA-N	0	3	349.482	3.016	20	30		EGEDHN
CN(Cc1cccc2[nH]ccc21)C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000348504958	456719610	/nfs/dbraw/zinc/71/96/10/456719610.db2.gz	ACARAUFIVLAIIH-GOSISDBHSA-N	0	3	342.402	3.380	20	30		EGEDHN
CC(C)[C@@H](C(=O)NCc1cccc(N2CCC2=O)c1)N1CCCCC1	ZINC000328621003	456720526	/nfs/dbraw/zinc/72/05/26/456720526.db2.gz	XGRQNPYOYZKZHR-IBGZPJMESA-N	0	3	343.471	3.390	20	30		EGEDHN
CN(Cc1ccccn1)[C@@H]1CCCN(C(=O)N[C@H]2C=CCCC2)CC1	ZINC000328632922	456724513	/nfs/dbraw/zinc/72/45/13/456724513.db2.gz	LOZVCTYBHNEOKH-PKOBYXMFSA-N	0	3	342.487	3.391	20	30		EGEDHN
O=C(CN[C@H]1CCC(=O)NC12CCC2)Nc1nc2c(s1)CCCC2	ZINC000328688859	456738523	/nfs/dbraw/zinc/73/85/23/456738523.db2.gz	HWKZRYPQHLGJLO-ZDUSSCGKSA-N	0	3	348.472	3.241	20	30		EGEDHN
O=C(N[C@H](CN1CCCC1)c1ccccc1)c1cn2c(n1)CCCC2	ZINC000328690353	456738620	/nfs/dbraw/zinc/73/86/20/456738620.db2.gz	DKJVXFFENAHVSF-QGZVFWFLSA-N	0	3	338.455	3.361	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2sc([C@H]3CCCOC3)nc2C)CC1	ZINC000328794645	456762504	/nfs/dbraw/zinc/76/25/04/456762504.db2.gz	BOXBPNPIQPVMJT-AWEZNQCLSA-N	0	3	349.500	3.301	20	30		EGEDHN
CN(CCCN(C)Cc1cn2ccccc2c1C#N)Cc1ccco1	ZINC000353564559	456765116	/nfs/dbraw/zinc/76/51/16/456765116.db2.gz	CYBURXSQILFYLJ-UHFFFAOYSA-N	0	3	336.439	3.358	20	30		EGEDHN
Cc1cccc(NC(=O)[C@H](C)N2CCC[C@@H]2[C@@H]2COCC[C@@H]2O)c1C	ZINC000328829724	456769985	/nfs/dbraw/zinc/76/99/85/456769985.db2.gz	QXZKSEPNWHCEMY-DKKFBQAASA-N	0	3	346.471	3.142	20	30		EGEDHN
COc1ccccc1CNC(=O)[C@H](C)N1CC[C@H](C2CCOCC2)C1	ZINC000328829081	456770076	/nfs/dbraw/zinc/77/00/76/456770076.db2.gz	KBPYIPIVGWXHNZ-YJBOKZPZSA-N	0	3	346.471	3.289	20	30		EGEDHN
O=C(CC1CCCC1)NC1CCN(Cc2c[nH]c3nccnc23)CC1	ZINC000328852452	456776828	/nfs/dbraw/zinc/77/68/28/456776828.db2.gz	VSMXCAQXHAKBAB-UHFFFAOYSA-N	0	3	341.459	3.411	20	30		EGEDHN
Cc1cccc(NC(=O)[C@H](C)N2CCC[C@@H]2[C@@H]2COCC[C@]2(C)O)c1	ZINC000328995428	456808567	/nfs/dbraw/zinc/80/85/67/456808567.db2.gz	WIAZCQMRODIAIE-BOLBYERCSA-N	0	3	346.471	3.223	20	30		EGEDHN
C=CCN1CCC(Nc2nc(-c3ccncc3)nc3c2CCC3)CC1	ZINC000301161640	456810920	/nfs/dbraw/zinc/81/09/20/456810920.db2.gz	GDZMEFZKZWEYRS-UHFFFAOYSA-N	0	3	335.455	3.090	20	30		EGEDHN
C=CCSCCNC(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1	ZINC000338466507	456829523	/nfs/dbraw/zinc/82/95/23/456829523.db2.gz	SZIBXMXVSJRRDH-NVXWUHKLSA-N	0	3	333.501	3.040	20	30		EGEDHN
CSCC[C@](C)(C#N)NC(=O)c1ccc(CN2CCCCC2)cc1	ZINC000344663777	456845281	/nfs/dbraw/zinc/84/52/81/456845281.db2.gz	HUGDTFAIBLEFNL-LJQANCHMSA-N	0	3	345.512	3.438	20	30		EGEDHN
COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1C[C@H]1CCCOC1	ZINC000329174117	456849408	/nfs/dbraw/zinc/84/94/08/456849408.db2.gz	AWRZSHXSIIINPZ-WBVHZDCISA-N	0	3	332.444	3.483	20	30		EGEDHN
O=C(N[C@H]1CC(=O)N(c2ccccc2)C1)[C@@H]1CCCN1C1CCCC1	ZINC000329249262	456860912	/nfs/dbraw/zinc/86/09/12/456860912.db2.gz	WZFUIDXOWQASIS-YJBOKZPZSA-N	0	3	341.455	3.155	20	30		EGEDHN
C=C(C)Cn1c(C2CCC2)nnc1N1CC[C@@H](N2CCCCC2)C1	ZINC000338845231	456863121	/nfs/dbraw/zinc/86/31/21/456863121.db2.gz	FOVURULRSYCYJH-QGZVFWFLSA-N	0	3	329.492	3.186	20	30		EGEDHN
Cn1cc2c(n1)CCC[C@@H]2C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000329310011	456870526	/nfs/dbraw/zinc/87/05/26/456870526.db2.gz	ZIAXNFMXKCZGMN-SJORKVTESA-N	0	3	338.455	3.071	20	30		EGEDHN
O=C(NCc1ccccc1CN1CCC[C@H]1CO)C1CCSCC1	ZINC000329332415	456873255	/nfs/dbraw/zinc/87/32/55/456873255.db2.gz	MTMAKLGTMPHQRI-SFHVURJKSA-N	0	3	348.512	3.243	20	30		EGEDHN
C[C@H](Cn1cccn1)N[C@@H](C)C(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000329409692	456886204	/nfs/dbraw/zinc/88/62/04/456886204.db2.gz	CSJLTJPIDRRBMD-IWTAEOLZSA-N	0	3	330.476	3.175	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C2CCOCC2)CCO1	ZINC000329490771	456899861	/nfs/dbraw/zinc/89/98/61/456899861.db2.gz	SPFJLRRMXSEUAK-KBAYOESNSA-N	0	3	338.492	3.180	20	30		EGEDHN
Cc1cc(NCCCN2CCN(C)C[C@@H]2c2ccccc2)cc(C#N)n1	ZINC000341747397	456926353	/nfs/dbraw/zinc/92/63/53/456926353.db2.gz	ZUNLNHNJQPKBES-OAQYLSRUSA-N	0	3	349.482	3.052	20	30		EGEDHN
Cc1cc2cc(CNC(=O)N3CCN(C4CCCC4)CC3)ccc2[nH]1	ZINC000329703449	456929823	/nfs/dbraw/zinc/92/98/23/456929823.db2.gz	ITBLPBYOIMLXGP-UHFFFAOYSA-N	0	3	340.471	3.451	20	30		EGEDHN
Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000329713989	456930750	/nfs/dbraw/zinc/93/07/50/456930750.db2.gz	SHVHXEADQIQZDD-WBVHZDCISA-N	0	3	345.491	3.094	20	30		EGEDHN
[O-]C(N[C@@H]1CCc2nc[nH]c2C1)=[NH+][C@H]1CCc2c1cccc2Cl	ZINC000329743313	456934784	/nfs/dbraw/zinc/93/47/84/456934784.db2.gz	XCZNWPUPPCRAIC-YGRLFVJLSA-N	0	3	330.819	3.112	20	30		EGEDHN
[O-]C(N[C@@H]1CCc2[nH]cnc2C1)=[NH+][C@H]1CCc2c1cccc2Cl	ZINC000329743313	456934787	/nfs/dbraw/zinc/93/47/87/456934787.db2.gz	XCZNWPUPPCRAIC-YGRLFVJLSA-N	0	3	330.819	3.112	20	30		EGEDHN
CC(C#N)C(=O)N(CCCn1ccnc1)Cc1c(F)cccc1Cl	ZINC000345156505	456945764	/nfs/dbraw/zinc/94/57/64/456945764.db2.gz	DWLFNSMFIQAJQN-CYBMUJFWSA-N	0	3	348.809	3.254	20	30		EGEDHN
[O-]C(NCC1C2CC3CC(C2)CC1C3)=[NH+]C[C@H]1CCc2nccn2C1	ZINC000329894622	456957779	/nfs/dbraw/zinc/95/77/79/456957779.db2.gz	KBKMSMHVGFVLKN-RGYNNNPXSA-N	0	3	342.487	3.021	20	30		EGEDHN
Cc1cnc(NC(=O)NCC2(N3CCSCC3)CCCCC2)o1	ZINC000330037122	456977468	/nfs/dbraw/zinc/97/74/68/456977468.db2.gz	YVRAGZGYOLCWMU-UHFFFAOYSA-N	0	3	338.477	3.061	20	30		EGEDHN
CC[C@H](C)n1ncc(NC(=O)N2CC[C@@H](N3CCCCC3)C2)c1C	ZINC000330133107	456989870	/nfs/dbraw/zinc/98/98/70/456989870.db2.gz	QWWJVNRXSMTYON-GOEBONIOSA-N	0	3	333.480	3.268	20	30		EGEDHN
C[C@@H]1C[C@@H]1N1CCN(C(=O)c2ccc(C3(C#N)CC3)cc2)C[C@@H](C)C1	ZINC000346221308	457024419	/nfs/dbraw/zinc/02/44/19/457024419.db2.gz	VPDZGZVXQRJGCD-FCEWJHQRSA-N	0	3	337.467	3.044	20	30		EGEDHN
[O-]C(=[NH+]C[C@@H]1[C@@H]2Cc3ccccc3[C@H]12)N1CCC(c2c[nH]cn2)CC1	ZINC000330324906	457028366	/nfs/dbraw/zinc/02/83/66/457028366.db2.gz	UIXRMHRDUMGSCM-SCTDSRPQSA-N	0	3	336.439	3.089	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN1CCC[C@@H]1Cc1ccccc1C	ZINC000358962270	457043425	/nfs/dbraw/zinc/04/34/25/457043425.db2.gz	BPQWTLUGQSZLDZ-QFBILLFUSA-N	0	3	327.472	3.010	20	30		EGEDHN
CC(C)C[C@](C)(C#N)NC(=O)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000330484763	457049021	/nfs/dbraw/zinc/04/90/21/457049021.db2.gz	YUPJBNDRKUAWHS-AZUAARDMSA-N	0	3	327.472	3.343	20	30		EGEDHN
COc1cc(CN[C@@H]2CC[C@H](C#N)C2)ccc1OCC(F)(F)F	ZINC000349803191	457058913	/nfs/dbraw/zinc/05/89/13/457058913.db2.gz	QBYIKVLCOZUWCJ-WCQYABFASA-N	0	3	328.334	3.418	20	30		EGEDHN
CC(C)(C)C(=O)NC[C@H]1CCCN(Cc2ccc(CC#N)cc2)C1	ZINC000330864617	457096286	/nfs/dbraw/zinc/09/62/86/457096286.db2.gz	YJUCXCRSYBBTNH-GOSISDBHSA-N	0	3	327.472	3.127	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)[C@@H](C)N1CC[C@@H](c2ccccc2)[C@H]1C	ZINC000331236426	457150912	/nfs/dbraw/zinc/15/09/12/457150912.db2.gz	KRRRTPQWPHEJAD-QQTQMKHKSA-N	0	3	327.472	3.307	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)[C@@H](C)N1CC[C@H](c2ccccc2)[C@@H]1C	ZINC000331236427	457151400	/nfs/dbraw/zinc/15/14/00/457151400.db2.gz	KRRRTPQWPHEJAD-WBQJQJEBSA-N	0	3	327.472	3.307	20	30		EGEDHN
C=CCOc1ccc(CNC[C@](C)(CO)c2ccccc2)cc1OC	ZINC000342184572	457155055	/nfs/dbraw/zinc/15/50/55/457155055.db2.gz	CQBRTOQXTQSFOG-OAQYLSRUSA-N	0	3	341.451	3.300	20	30		EGEDHN
CCCCN1CCCC[C@@H]1CNC(=O)c1cc(C#N)cc(N(C)C)c1	ZINC000339607679	457171331	/nfs/dbraw/zinc/17/13/31/457171331.db2.gz	CAVPPESNHAYRIO-GOSISDBHSA-N	0	3	342.487	3.009	20	30		EGEDHN
C=CCNC(=O)Nc1ccc(NC(=O)[C@H](CCC)NC(C)C)cc1	ZINC000350396158	457178135	/nfs/dbraw/zinc/17/81/35/457178135.db2.gz	CUDDCFBJYCKTEX-INIZCTEOSA-N	0	3	332.448	3.099	20	30		EGEDHN
CC(C#N)C(=O)N[C@H]1CCCN(c2ccc(Cl)cc2Cl)C1	ZINC000356846754	457182328	/nfs/dbraw/zinc/18/23/28/457182328.db2.gz	PNYOEPCGYLOZMU-JQWIXIFHSA-N	0	3	326.227	3.238	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)[C@@H](C)C#N)c1ccc(C(F)(F)F)cc1	ZINC000347038432	457197918	/nfs/dbraw/zinc/19/79/18/457197918.db2.gz	OZZAZISMZWDNOL-WFASDCNBSA-N	0	3	341.377	3.364	20	30		EGEDHN
CCO[C@@H]1C[C@@H](N(C)CCOc2ccc(C#N)cc2OC)C1(C)C	ZINC000354424894	457213873	/nfs/dbraw/zinc/21/38/73/457213873.db2.gz	HADBTBYXNHOPOS-QZTJIDSGSA-N	0	3	332.444	3.081	20	30		EGEDHN
CCCOc1ccc(Oc2ncccc2CNC(=O)C(C)C#N)cc1	ZINC000347080976	457221319	/nfs/dbraw/zinc/22/13/19/457221319.db2.gz	WULBRVHPHOTHOE-CQSZACIVSA-N	0	3	339.395	3.439	20	30		EGEDHN
CC1(C#N)CCN(C[C@H](O)CO[C@H]2CCCc3ccccc32)CC1	ZINC000331668375	457228479	/nfs/dbraw/zinc/22/84/79/457228479.db2.gz	NZWWCBXKVAELCD-HKUYNNGSSA-N	0	3	328.456	3.067	20	30		EGEDHN
CC(C#N)C(=O)NC[C@H](C)Sc1ccc(Br)cc1	ZINC000347102739	457229692	/nfs/dbraw/zinc/22/96/92/457229692.db2.gz	HZPZJJBKUOWYBZ-UWVGGRQHSA-N	0	3	327.247	3.206	20	30		EGEDHN
CC[C@H]1Cc2ccccc2CN1C[C@@H](O)COc1ccc(C#N)cc1	ZINC000342350199	457250558	/nfs/dbraw/zinc/25/05/58/457250558.db2.gz	SOKBTTMZXDBQND-VQTJNVASSA-N	0	3	336.435	3.135	20	30		EGEDHN
C=CCCCCCN(C)[C@H](C)C(=O)NC[C@H]1COc2ccccc2O1	ZINC000351913955	457323513	/nfs/dbraw/zinc/32/35/13/457323513.db2.gz	XOHJLNAZNTZPLL-SJORKVTESA-N	0	3	346.471	3.009	20	30		EGEDHN
CCN(CCC#N)C(=O)CN1CCC[C@@](C)(c2ccccc2)CC1	ZINC000352188254	457346649	/nfs/dbraw/zinc/34/66/49/457346649.db2.gz	XQLMXPAELCXZNV-HXUWFJFHSA-N	0	3	327.472	3.192	20	30		EGEDHN
CC(=O)Nc1c[nH]nc1[C@@H]1CCCN([C@H](C)c2ccc(C#N)cc2)C1	ZINC000332316474	457347095	/nfs/dbraw/zinc/34/70/95/457347095.db2.gz	KLTVFGPNCQMTBQ-CXAGYDPISA-N	0	3	337.427	3.180	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CC[C@H](N(C)Cc2ccccc2)C1)OCC	ZINC000360777285	457347640	/nfs/dbraw/zinc/34/76/40/457347640.db2.gz	XSVQUCYYWBHAOM-RBUKOAKNSA-N	0	3	330.472	3.091	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cn2cc(C)nc2s1)C(C)C	ZINC000355404961	457370700	/nfs/dbraw/zinc/37/07/00/457370700.db2.gz	XCQLVIIHSDTJCT-HNNXBMFYSA-N	0	3	346.500	3.133	20	30		EGEDHN
CC[C@@H]1CN(CCCOc2cccc(C#N)c2)[C@@H](CC)CN1C(C)=O	ZINC000357319468	457444214	/nfs/dbraw/zinc/44/42/14/457444214.db2.gz	VNLXGBXDUVEQJR-RBUKOAKNSA-N	0	3	343.471	3.048	20	30		EGEDHN
CCO[C@@H]1C[C@H](NCC(=O)Nc2cccc(C#N)c2)C1(CC)CC	ZINC000360946528	457454489	/nfs/dbraw/zinc/45/44/89/457454489.db2.gz	KBQKILIIXMUYRD-DLBZAZTESA-N	0	3	329.444	3.070	20	30		EGEDHN
CCO[C@@H]1C[C@@H](NCc2cccc(OCCCC#N)c2)[C@@]12CCCO2	ZINC000363979896	457471038	/nfs/dbraw/zinc/47/10/38/457471038.db2.gz	OWKJGAZSGHDZEH-AQNXPRMDSA-N	0	3	344.455	3.185	20	30		EGEDHN
COc1cc(CN2CCC[C@@H](C(=O)Nc3ccccc3)C2)ccc1C#N	ZINC000374214502	457526663	/nfs/dbraw/zinc/52/66/63/457526663.db2.gz	ZWFKGAWLGDZYRX-GOSISDBHSA-N	0	3	349.434	3.418	20	30		EGEDHN
CN(CC(=O)N(C)C1(C#N)CCCCC1)C1CCC(F)(F)CC1	ZINC000347597605	457538124	/nfs/dbraw/zinc/53/81/24/457538124.db2.gz	JUPURZOYYWHOMQ-UHFFFAOYSA-N	0	3	327.419	3.181	20	30		EGEDHN
COC(=O)c1cc(CN(Cc2ccc(C#N)cc2)C(C)C)cn1C	ZINC000347612495	457550677	/nfs/dbraw/zinc/55/06/77/457550677.db2.gz	OEBFAXTXEUKSMS-UHFFFAOYSA-N	0	3	325.412	3.094	20	30		EGEDHN
C=CCN(C(=O)c1ccc2c(c1)CNC2)c1nc2c(s1)CCCC2	ZINC000347644733	457571656	/nfs/dbraw/zinc/57/16/56/457571656.db2.gz	BXAAQVRMTWTKGZ-UHFFFAOYSA-N	0	3	339.464	3.458	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)C[C@@H](O)COCc1ccccc1F	ZINC000425540122	457590232	/nfs/dbraw/zinc/59/02/32/457590232.db2.gz	UVJQDZULIQMKKC-DNVCBOLYSA-N	0	3	342.414	3.268	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN[C@H](C)c1cncc(F)c1	ZINC000361132629	457601780	/nfs/dbraw/zinc/60/17/80/457601780.db2.gz	QXIWXDJXQPFFTI-RDTXWAMCSA-N	0	3	330.403	3.040	20	30		EGEDHN
CCOc1cccc(CN2CCC(C#N)(c3ccccn3)CC2)c1O	ZINC000370533663	457668161	/nfs/dbraw/zinc/66/81/61/457668161.db2.gz	OMYKNEXDPIJMRA-UHFFFAOYSA-N	0	3	337.423	3.243	20	30		EGEDHN
CC(C#N)C(=O)NCc1cn(Cc2ccccc2)nc1-c1ccccc1	ZINC000357834781	457705425	/nfs/dbraw/zinc/70/54/25/457705425.db2.gz	SDICCPLTVSMLAI-MRXNPFEDSA-N	0	3	344.418	3.374	20	30		EGEDHN
Cc1ccccc1[C@@H]([C@H](C)NC(=O)c1cccc(F)c1C#N)N(C)C	ZINC000357879209	457721526	/nfs/dbraw/zinc/72/15/26/457721526.db2.gz	VJXNBBJXRZOYTN-IFXJQAMLSA-N	0	3	339.414	3.427	20	30		EGEDHN
CN(C)[C@H](CNC(=O)[C@H](C#N)CCc1ccccc1)c1ccccc1	ZINC000433112518	457759799	/nfs/dbraw/zinc/75/97/99/457759799.db2.gz	BEGUTRPFTUJCGX-VQTJNVASSA-N	0	3	335.451	3.178	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N1CCC[C@H]1CSC)C(C)C	ZINC000426027011	457763009	/nfs/dbraw/zinc/76/30/09/457763009.db2.gz	FDVISKVLHYTYHE-IRXDYDNUSA-N	0	3	339.549	3.222	20	30		EGEDHN
C=CCCN[C@H](C)c1ccc(Br)cc1OCCCO	ZINC000361520268	457767130	/nfs/dbraw/zinc/76/71/30/457767130.db2.gz	ULLNNOUMWBJASK-GFCCVEGCSA-N	0	3	328.250	3.437	20	30		EGEDHN
C=CCCN[C@@H](C)c1ccc(Br)cc1OCCCO	ZINC000361520269	457767202	/nfs/dbraw/zinc/76/72/02/457767202.db2.gz	ULLNNOUMWBJASK-LBPRGKRZSA-N	0	3	328.250	3.437	20	30		EGEDHN
C=CCOc1ccc(CN2CCC[C@@H](c3nccn3C)C2)cc1OC	ZINC000365821703	457778624	/nfs/dbraw/zinc/77/86/24/457778624.db2.gz	QWKOIPXOCNRMIR-QGZVFWFLSA-N	0	3	341.455	3.373	20	30		EGEDHN
CC(C)O[C@@H]1C[C@H](N[C@H](C)C(=O)Nc2cccc(C#N)c2)C1(C)C	ZINC000361547273	457787309	/nfs/dbraw/zinc/78/73/09/457787309.db2.gz	DDQGJHJWELGMQP-XOKHGSTOSA-N	0	3	329.444	3.067	20	30		EGEDHN
N#CC1(CCCN2Cc3ccc(O)cc3C3(CC3)C2)CCOCC1	ZINC000361574459	457799997	/nfs/dbraw/zinc/79/99/97/457799997.db2.gz	XCRAKAAHBLEZAG-UHFFFAOYSA-N	0	3	326.440	3.340	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCCc1c(F)cccc1F	ZINC000433322280	457810380	/nfs/dbraw/zinc/81/03/80/457810380.db2.gz	ZRNGLPMQERBKAG-HNNXBMFYSA-N	0	3	328.362	3.396	20	30		EGEDHN
C[C@H](CNC(=O)C(C#N)CCc1ccccc1)Oc1cccc(F)c1	ZINC000433362931	457821144	/nfs/dbraw/zinc/82/11/44/457821144.db2.gz	LCSMMZJDUSCUQS-WBVHZDCISA-N	0	3	340.398	3.482	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N[C@H](CCCO)c1ccccc1	ZINC000433370121	457822631	/nfs/dbraw/zinc/82/26/31/457822631.db2.gz	CQNQSTZVMSJOIW-VQTJNVASSA-N	0	3	336.435	3.389	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCC1(CCO)CCCCC1	ZINC000433379171	457824849	/nfs/dbraw/zinc/82/48/49/457824849.db2.gz	XQUZFWGAHZUWJM-GOSISDBHSA-N	0	3	328.456	3.208	20	30		EGEDHN
Cc1cc(CNCc2cccc(CN3CCCC3=O)c2)ccc1C#N	ZINC000443959669	457830095	/nfs/dbraw/zinc/83/00/95/457830095.db2.gz	BVIJPLPMPNDWTF-UHFFFAOYSA-N	0	3	333.435	3.279	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN2CC[C@@H]3CCC[C@@H]32)cc1	ZINC000426455618	457833413	/nfs/dbraw/zinc/83/34/13/457833413.db2.gz	CMSYKFJNKVHOEL-LPHOPBHVSA-N	0	3	341.455	3.206	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cnc([C@H](C)OCC)s2)CC1	ZINC000361783848	457857326	/nfs/dbraw/zinc/85/73/26/457857326.db2.gz	YGSZPPUJTNZFPQ-ZDUSSCGKSA-N	0	3	337.489	3.011	20	30		EGEDHN
CO[C@@H](C)c1nc(CN2CCCN([C@@H](C)CCC#N)CC2)cs1	ZINC000411334716	457859181	/nfs/dbraw/zinc/85/91/81/457859181.db2.gz	PMZLRGKSDRDEGI-GJZGRUSLSA-N	0	3	336.505	3.050	20	30		EGEDHN
COc1ccc(C2(NCCC(=O)Nc3cccc(C#N)c3)CC2)cc1	ZINC000411463781	457895151	/nfs/dbraw/zinc/89/51/51/457895151.db2.gz	SGYWCYWKNRGGPP-UHFFFAOYSA-N	0	3	335.407	3.174	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCNC2(c3cccc(C#N)c3)CC2)c1	ZINC000411470698	457896507	/nfs/dbraw/zinc/89/65/07/457896507.db2.gz	OYFOAMGRBBPCIB-UHFFFAOYSA-N	0	3	330.391	3.037	20	30		EGEDHN
CCCN(CCc1cccs1)[C@H](C)C(=O)N[C@@](C)(C#N)C(C)C	ZINC000411557910	457918874	/nfs/dbraw/zinc/91/88/74/457918874.db2.gz	VOEZUYADFXTKMU-QAPCUYQASA-N	0	3	335.517	3.446	20	30		EGEDHN
CN(C)CCN(Cc1ccsc1)C(=O)c1ccc(CC#N)cc1	ZINC000458219486	457974509	/nfs/dbraw/zinc/97/45/09/457974509.db2.gz	HXDGPARMJXXSDO-UHFFFAOYSA-N	0	3	327.453	3.018	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)Nc1ccc(OCCN(C)C)c(F)c1	ZINC000458284947	458001131	/nfs/dbraw/zinc/00/11/31/458001131.db2.gz	ZALVZTJOUHQCBT-UHFFFAOYSA-N	0	3	341.386	3.199	20	30		EGEDHN
C=C(CC)CNC(=O)NCC1(N[C@H](C)c2ccccc2)CCOCC1	ZINC000458377047	458028817	/nfs/dbraw/zinc/02/88/17/458028817.db2.gz	QSKQWOKNSATFNL-QGZVFWFLSA-N	0	3	345.487	3.152	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CCC(NC(=O)NCC(C)(C)CC#N)CC1	ZINC000458393688	458033678	/nfs/dbraw/zinc/03/36/78/458033678.db2.gz	BJABEZAKIMYCFO-INIZCTEOSA-N	0	3	342.487	3.451	20	30		EGEDHN
C[C@H](CN1CCOCC1)N(C)Cc1ccc(-c2ccccc2C#N)cc1	ZINC000434708533	458040005	/nfs/dbraw/zinc/04/00/05/458040005.db2.gz	CNIQMNFNOACWME-GOSISDBHSA-N	0	3	349.478	3.378	20	30		EGEDHN
C=CCN1CC[C@@H](N[C@H](c2ccccc2)C2(CO)CCCCC2)C1=O	ZINC000412004159	458041241	/nfs/dbraw/zinc/04/12/41/458041241.db2.gz	BRFCADTWHGQSSO-RTBURBONSA-N	0	3	342.483	3.047	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN(C)[C@H]2CCN(CC)[C@H](C)C2)c1C	ZINC000362252382	458056565	/nfs/dbraw/zinc/05/65/65/458056565.db2.gz	PLAVQZTYVFQJJP-QAPCUYQASA-N	0	3	331.504	3.278	20	30		EGEDHN
C=C[C@@H]1CCCCN1C(=O)CCN1CCN(c2cccc(C)c2)CC1	ZINC000428042514	458071456	/nfs/dbraw/zinc/07/14/56/458071456.db2.gz	CGGJBMUMGIPWEZ-LJQANCHMSA-N	0	3	341.499	3.074	20	30		EGEDHN
CC(C#N)C(=O)N1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC000358557756	458075234	/nfs/dbraw/zinc/07/52/34/458075234.db2.gz	DDOIPRMVBFURRB-LBPRGKRZSA-N	0	3	340.345	3.482	20	30		EGEDHN
Cc1nn(C)cc1[C@@H]1CCCN1Cc1ccc(N(C)CCC#N)cc1	ZINC000375852227	458096755	/nfs/dbraw/zinc/09/67/55/458096755.db2.gz	WKBMAMYFHNXBAX-FQEVSTJZSA-N	0	3	337.471	3.416	20	30		EGEDHN
CCN(CCC#N)C(=O)CN(CC)[C@H](Cc1ccc(F)cc1)C(C)C	ZINC000362385030	458141344	/nfs/dbraw/zinc/14/13/44/458141344.db2.gz	QJEJALHDBQJFHD-LJQANCHMSA-N	0	3	347.478	3.477	20	30		EGEDHN
C=C(C)CS(=O)(=O)NCC1(N[C@@H](C)c2ccccc2)CCCC1	ZINC000435438394	458148627	/nfs/dbraw/zinc/14/86/27/458148627.db2.gz	PMQNMBMUPNNRGC-INIZCTEOSA-N	0	3	336.501	3.146	20	30		EGEDHN
C[C@H]1CN(Cc2cccc(OCc3ccccc3C#N)c2)CC[C@@H]1O	ZINC000428461750	458149200	/nfs/dbraw/zinc/14/92/00/458149200.db2.gz	JCYYKOAEDRVMJF-KKSFZXQISA-N	0	3	336.435	3.340	20	30		EGEDHN
COCC1(C)CCN([C@@H](C)C(=O)N(C)C2(C#N)CCC(C)CC2)CC1	ZINC000358743944	458186245	/nfs/dbraw/zinc/18/62/45/458186245.db2.gz	LJKBUTDPGKJOGE-GNZRSQJKSA-N	0	3	349.519	3.054	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CCC(C)(OCC)CC1	ZINC000428718235	458198168	/nfs/dbraw/zinc/19/81/68/458198168.db2.gz	MHQSTBVEYVUELJ-SFHVURJKSA-N	0	3	333.472	3.046	20	30		EGEDHN
CC(C#N)C(=O)N1CCC[C@H]1c1ccc(Br)c(F)c1	ZINC000435971460	458231648	/nfs/dbraw/zinc/23/16/48/458231648.db2.gz	YPYIRQNGUBFZLI-RNCFNFMXSA-N	0	3	325.181	3.411	20	30		EGEDHN
CC[C@H](N[C@H]1CCCN(C(=O)N2CCCC2)C1)c1ccc(C#N)cc1	ZINC000376141343	458210572	/nfs/dbraw/zinc/21/05/72/458210572.db2.gz	BZYHEUDCXAYNKE-OALUTQOASA-N	0	3	340.471	3.279	20	30		EGEDHN
C=CCOc1ccc(CN[C@@]2(CCOC)CCOC2)cc1Cl	ZINC000447067392	458259033	/nfs/dbraw/zinc/25/90/33/458259033.db2.gz	NWJSSCNTPNIESJ-KRWDZBQOSA-N	0	3	325.836	3.190	20	30		EGEDHN
C=C(CC)CNC(=O)N(Cc1ccncc1)C[C@@H]1CCCN1CC	ZINC000459087055	458262739	/nfs/dbraw/zinc/26/27/39/458262739.db2.gz	WKVCJDNCZGIWAQ-SFHVURJKSA-N	0	3	330.476	3.044	20	30		EGEDHN
C=C(C)CN1CCC(Nc2ncc([N+](=O)[O-])cc2C(F)(F)F)CC1	ZINC000413131629	458293700	/nfs/dbraw/zinc/29/37/00/458293700.db2.gz	SPYQUGYMMRPNMS-UHFFFAOYSA-N	0	3	344.337	3.461	20	30		EGEDHN
CCc1ccc([C@H](CN2CCOCC2)NCC(C)(C)CC#N)cc1	ZINC000414170395	458316092	/nfs/dbraw/zinc/31/60/92/458316092.db2.gz	SULUONKWWMWUCN-IBGZPJMESA-N	0	3	329.488	3.152	20	30		EGEDHN
N#Cc1csc(CN[C@@H](c2ccccc2)C2(CO)CCOCC2)c1	ZINC000414543443	458322550	/nfs/dbraw/zinc/32/25/50/458322550.db2.gz	TXYKYGDDTCKZSR-SFHVURJKSA-N	0	3	342.464	3.240	20	30		EGEDHN
C=CCOc1ccc(CNC[C@@H]2NCCc3ccccc32)cc1OC	ZINC000414957031	458326462	/nfs/dbraw/zinc/32/64/62/458326462.db2.gz	PFMWPUMBGCFCNB-IBGZPJMESA-N	0	3	338.451	3.237	20	30		EGEDHN
CC(C#N)C(=O)N1CCC(Nc2cccc(Br)c2)CC1	ZINC000447696481	458331450	/nfs/dbraw/zinc/33/14/50/458331450.db2.gz	SNZRTERJSBZYRX-LLVKDONJSA-N	0	3	336.233	3.012	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)Nc1ccc2c(c1)CNCC2	ZINC000415879753	458334263	/nfs/dbraw/zinc/33/42/63/458334263.db2.gz	CLJAEZAQAGHMST-UHFFFAOYSA-N	0	3	337.423	3.219	20	30		EGEDHN
N#CCCN(Cc1ccco1)C(=O)Nc1ccc2c(c1F)CCNC2	ZINC000415961118	458335634	/nfs/dbraw/zinc/33/56/34/458335634.db2.gz	QQRAPNDPJNHAFM-UHFFFAOYSA-N	0	3	342.374	3.012	20	30		EGEDHN
C=CCN(C)CCN(CC)Cc1ccn(-c2c(F)cccc2F)n1	ZINC000429704291	458359977	/nfs/dbraw/zinc/35/99/77/458359977.db2.gz	VHEFLMFXQRGJJW-UHFFFAOYSA-N	0	3	334.414	3.090	20	30		EGEDHN
N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)NC[C@H](N)c1ccccc1	ZINC000418429477	458375204	/nfs/dbraw/zinc/37/52/04/458375204.db2.gz	NPOSMPBQWXXTTO-HSALFYBXSA-N	0	3	348.450	3.168	20	30		EGEDHN
C=CCC[C@@H]1NC(=O)N(C[C@@H](c2ccc(C)cc2)N2CCCC2)C1=O	ZINC000419957174	458395018	/nfs/dbraw/zinc/39/50/18/458395018.db2.gz	VABOPVLXDZUDBV-ROUUACIJSA-N	0	3	341.455	3.019	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN(C)C1CC(OC(C)(C)C)C1	ZINC000421012827	458406185	/nfs/dbraw/zinc/40/61/85/458406185.db2.gz	QQWGNYPQVLMBAY-UHFFFAOYSA-N	0	3	332.444	3.224	20	30		EGEDHN
C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)C[C@H]1CCCN1C	ZINC000421061173	458406911	/nfs/dbraw/zinc/40/69/11/458406911.db2.gz	LMICKHKYHBDTFQ-LSDHHAIUSA-N	0	3	346.500	3.496	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)[C@]1(C#N)CC12CCCC2)C(C)C	ZINC000448974679	458417336	/nfs/dbraw/zinc/41/73/36/458417336.db2.gz	LUBLYGBDLGXHFI-YLJYHZDGSA-N	0	3	329.488	3.275	20	30		EGEDHN
C=C(C)C[NH+]1CCC(NC(=O)c2ccc(OCCCC)cc2[O-])CC1	ZINC000436991011	458419428	/nfs/dbraw/zinc/41/94/28/458419428.db2.gz	SDUQBDSBYQYWEU-UHFFFAOYSA-N	0	3	346.471	3.341	20	30		EGEDHN
Cc1cc(CNCc2cn(CCC#N)nc2-c2ccccc2)ccn1	ZINC000449404362	458423567	/nfs/dbraw/zinc/42/35/67/458423567.db2.gz	UXQQLBXVRTXEIV-UHFFFAOYSA-N	0	3	331.423	3.457	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CCC[C@@H](CC(F)(F)F)C2)cc1	ZINC000421970716	458424386	/nfs/dbraw/zinc/42/43/86/458424386.db2.gz	SWTLFWRLLJLURT-JKSUJKDBSA-N	0	3	349.356	3.432	20	30		EGEDHN
COc1ccc(CN2CC[C@@H](OC)[C@@H](C)C2)cc1OCCCC#N	ZINC000449493982	458425110	/nfs/dbraw/zinc/42/51/10/458425110.db2.gz	FVPFUMQQTWZAEQ-DOTOQJQBSA-N	0	3	332.444	3.235	20	30		EGEDHN
COC[C@H]1CCCCN1Cc1ccc(OC)c(OCCCC#N)c1	ZINC000449761044	458431493	/nfs/dbraw/zinc/43/14/93/458431493.db2.gz	UEWKHFWLRACGOU-QGZVFWFLSA-N	0	3	332.444	3.379	20	30		EGEDHN
Cc1cc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)ccc1C#N	ZINC000430288139	458436376	/nfs/dbraw/zinc/43/63/76/458436376.db2.gz	CRPWPBLONXBQRZ-LJQANCHMSA-N	0	3	333.435	3.352	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)CN(C)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000459669803	458442381	/nfs/dbraw/zinc/44/23/81/458442381.db2.gz	DXDPWCZQEKBMLY-HBFSDRIKSA-N	0	3	327.472	3.309	20	30		EGEDHN
Cn1cc(CNCC(C)(C)CC#N)c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000459707031	458452971	/nfs/dbraw/zinc/45/29/71/458452971.db2.gz	ZNVULOKDSMSTQC-UHFFFAOYSA-N	0	3	327.388	3.025	20	30		EGEDHN
C[C@@H]1C[C@H](c2ccccc2)[C@H](C)N1CC(=O)NCc1cccc(C#N)c1	ZINC000451194555	458469221	/nfs/dbraw/zinc/46/92/21/458469221.db2.gz	ZDVOYACNACSATA-WWMYMODYSA-N	0	3	347.462	3.441	20	30		EGEDHN
CCN(C(=O)c1ccc(CC#N)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000373381233	458476339	/nfs/dbraw/zinc/47/63/39/458476339.db2.gz	BBVOZPYDGRUDTJ-NRFANRHFSA-N	0	3	347.462	3.489	20	30		EGEDHN
CC(C)O[C@@H]1C[C@H](NCC(=O)N(CCC#N)c2ccccc2)C1(C)C	ZINC000451492998	458478648	/nfs/dbraw/zinc/47/86/48/458478648.db2.gz	IVKLXYBHOFTOQR-ZWKOTPCHSA-N	0	3	343.471	3.115	20	30		EGEDHN
CCCN(C)[C@H](CNC(=O)[C@]1(C#N)C[C@@H]1C)c1ccc(Cl)cc1	ZINC000451655352	458484446	/nfs/dbraw/zinc/48/44/46/458484446.db2.gz	XRULJUOXBFKXPW-XCRHUMRWSA-N	0	3	333.863	3.389	20	30		EGEDHN
CC[C@H](C)N[C@H](CNC(=O)[C@@]1(C#N)CC12CCCC2)c1ccco1	ZINC000451670462	458484609	/nfs/dbraw/zinc/48/46/09/458484609.db2.gz	CTPMOKHWPAUOFU-KHYOSLBOSA-N	0	3	329.444	3.299	20	30		EGEDHN
COC[C@]1(CO)CCN(Cc2ccc(-c3ccccc3C#N)cc2)C1	ZINC000451938290	458491349	/nfs/dbraw/zinc/49/13/49/458491349.db2.gz	VEYWPTAFQICPOG-OAQYLSRUSA-N	0	3	336.435	3.056	20	30		EGEDHN
CC(C)OCCOC1CCN(CCCOc2cccc(C#N)c2)CC1	ZINC000451949491	458491708	/nfs/dbraw/zinc/49/17/08/458491708.db2.gz	CHDULLCJUOSTQD-UHFFFAOYSA-N	0	3	346.471	3.233	20	30		EGEDHN
C=CCC1(C(=O)Nc2cccc(CN3CC[C@H](O)C3)c2)CCCC1	ZINC000452197729	458496995	/nfs/dbraw/zinc/49/69/95/458496995.db2.gz	SZEGKLYITPGAFE-SFHVURJKSA-N	0	3	328.456	3.328	20	30		EGEDHN
C=CCn1c(CC(C)(C)C)nnc1N1CCN([C@@H]2C[C@@H]2C)C[C@@H](C)C1	ZINC000453428107	458528665	/nfs/dbraw/zinc/52/86/65/458528665.db2.gz	ZMXOYCZSGYAHKB-IXDOHACOSA-N	0	3	345.535	3.219	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)NCCC(c1ccccc1)c1ccccc1	ZINC000424085812	458556177	/nfs/dbraw/zinc/55/61/77/458556177.db2.gz	ZRUOGGLLQOBIGE-HXUWFJFHSA-N	0	3	335.451	3.346	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)NCC1(c2ccc(Cl)cc2)CCCC1	ZINC000424101294	458559121	/nfs/dbraw/zinc/55/91/21/458559121.db2.gz	JKTADJYPFYMWIR-MRXNPFEDSA-N	0	3	333.863	3.289	20	30		EGEDHN
C=CCN1CC[C@H](NCC2(c3ccc(OC)cc3)CCCCC2)C1=O	ZINC000493769109	458560054	/nfs/dbraw/zinc/56/00/54/458560054.db2.gz	ZZLFVDPNFNIHHY-IBGZPJMESA-N	0	3	342.483	3.274	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N[C@@H](Cc1ccccc1)c1cccs1	ZINC000424120849	458562972	/nfs/dbraw/zinc/56/29/72/458562972.db2.gz	HKGWPTKMBNMLES-HOTGVXAUSA-N	0	3	327.453	3.169	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1ccc(CN2CCc3ccccc32)cc1	ZINC000424156106	458573029	/nfs/dbraw/zinc/57/30/29/458573029.db2.gz	NPFXYBPLNDBKPE-LJQANCHMSA-N	0	3	348.450	3.209	20	30		EGEDHN
C[C@@H](C(=O)N[C@H]1CCCN(Cc2ccccc2)C1)c1cccc(C#N)c1	ZINC000461903817	458578354	/nfs/dbraw/zinc/57/83/54/458578354.db2.gz	UYTBKUVKRQFXAT-UTKZUKDTSA-N	0	3	347.462	3.443	20	30		EGEDHN
CC(C)C[C@@H](CN(C)C)NC(=O)C(C)(C)Cc1ccc(C#N)cc1	ZINC000455021340	458583587	/nfs/dbraw/zinc/58/35/87/458583587.db2.gz	TYRCJNMOOSQFQT-SFHVURJKSA-N	0	3	329.488	3.219	20	30		EGEDHN
CN(CCN1CCCC1)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1	ZINC000438643351	458608561	/nfs/dbraw/zinc/60/85/61/458608561.db2.gz	FCSFFIKXYCBDMV-UHFFFAOYSA-N	0	3	340.349	3.137	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(C(=O)C(C)C)cc2)CC1	ZINC000455826102	458617209	/nfs/dbraw/zinc/61/72/09/458617209.db2.gz	UGQVSNNTFJXKJW-UHFFFAOYSA-N	0	3	329.444	3.297	20	30		EGEDHN
C=CCN(CC=C)C[C@H](O)COc1cc(F)cc(Br)c1	ZINC000438846509	458620562	/nfs/dbraw/zinc/62/05/62/458620562.db2.gz	KHFAKSYFCZLVBH-AWEZNQCLSA-N	0	3	344.224	3.002	20	30		EGEDHN
C[C@@H]1[C@H](NC(=O)c2ccc(F)c(C#N)c2)CCN1Cc1ccccc1	ZINC000494052234	458620558	/nfs/dbraw/zinc/62/05/58/458620558.db2.gz	WYFHOJRHDDLXDB-AUUYWEPGSA-N	0	3	337.398	3.090	20	30		EGEDHN
C=CCN(Cc1ccccc1)C(=O)NCC1(SC)CCN(C)CC1	ZINC000462516936	458628791	/nfs/dbraw/zinc/62/87/91/458628791.db2.gz	ZGDGXGOGDOPIPO-UHFFFAOYSA-N	0	3	347.528	3.212	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)[C@@H]1CC2CCC1CC2	ZINC000431840144	458632800	/nfs/dbraw/zinc/63/28/00/458632800.db2.gz	KJDLLPQAUJBZET-RRWXTXHCSA-N	0	3	339.483	3.275	20	30		EGEDHN
Cc1ccccc1OC[C@H](O)CN1CC=C(c2ccc(C#N)cc2)CC1	ZINC000502527203	458655374	/nfs/dbraw/zinc/65/53/74/458655374.db2.gz	FPIDJXPXWGGMCM-OAQYLSRUSA-N	0	3	348.446	3.396	20	30		EGEDHN
CN(C)CCOc1ccc(-c2noc(C3(C#N)CCCC3)n2)cc1	ZINC000546998052	458692391	/nfs/dbraw/zinc/69/23/91/458692391.db2.gz	ICVVUVOCIOSJBX-UHFFFAOYSA-N	0	3	326.400	3.012	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@H](Nc3ccnc4ccccc43)C2=O)cc1	ZINC000503279344	458700724	/nfs/dbraw/zinc/70/07/24/458700724.db2.gz	HKYPSVUHZHNSBS-FQEVSTJZSA-N	0	3	342.402	3.136	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CCn2cccc2[C@@H]1C)C(C)C	ZINC000503441881	458708227	/nfs/dbraw/zinc/70/82/27/458708227.db2.gz	ZWJXQGFIIAMDLP-PKOBYXMFSA-N	0	3	344.503	3.273	20	30		EGEDHN
C[C@@H](C(=O)N1C[C@@H](N(C)C)Cc2ccccc21)c1cccc(C#N)c1	ZINC000463778622	458718780	/nfs/dbraw/zinc/71/87/80/458718780.db2.gz	ZGNBUMFRVYVZEF-BEFAXECRSA-N	0	3	333.435	3.181	20	30		EGEDHN
C=CCOc1ccc(CN[C@H](Cc2ccc(Cl)cc2)C(N)=O)cc1	ZINC000506630371	458750986	/nfs/dbraw/zinc/75/09/86/458750986.db2.gz	KHMRAWSVBGIISX-GOSISDBHSA-N	0	3	344.842	3.091	20	30		EGEDHN
C=C[C@@H]1CCCCN1C(=O)[C@@H]1CN(C(C)(C)C)C[C@H]1C(F)(F)F	ZINC000508643820	458761642	/nfs/dbraw/zinc/76/16/42/458761642.db2.gz	PJFVNGQQSWQEFS-MGPQQGTHSA-N	0	3	332.410	3.462	20	30		EGEDHN
Cc1ccccc1[C@@H]([C@@H](C)NC(=O)N1CCC(C)(C#N)CC1)N(C)C	ZINC000508878939	458766064	/nfs/dbraw/zinc/76/60/64/458766064.db2.gz	IMSFXRRNDHVDET-SJLPKXTDSA-N	0	3	342.487	3.322	20	30		EGEDHN
CCN(Cc1ccc(C(=O)NCC#Cc2ccccc2)cc1)C1CC1	ZINC000510933881	458776046	/nfs/dbraw/zinc/77/60/46/458776046.db2.gz	XYOAKTKBMAMRSK-UHFFFAOYSA-N	0	3	332.447	3.452	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N1CCS[C@H](C)CC1)C(C)C	ZINC000495050375	458788690	/nfs/dbraw/zinc/78/86/90/458788690.db2.gz	URVISIKADVCXOB-SJORKVTESA-N	0	3	339.549	3.222	20	30		EGEDHN
Cc1cccc2c1CC[C@@H]2NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000547768164	458789096	/nfs/dbraw/zinc/78/90/96/458789096.db2.gz	REGQKPFNJFSFET-XLIONFOSSA-N	0	3	329.403	3.353	20	30		EGEDHN
C[C@H](NC[C@@H](C#N)CCC#N)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000495269183	458823729	/nfs/dbraw/zinc/82/37/29/458823729.db2.gz	CKCFLNUNGTXUKC-XHSDSOJGSA-N	0	3	334.464	3.055	20	30		EGEDHN
C=CCn1c(SCCN2CCC(C)CC2)nc2ccccc2c1=O	ZINC000465474183	458826115	/nfs/dbraw/zinc/82/61/15/458826115.db2.gz	YZQYVJXPLOOVGH-UHFFFAOYSA-N	0	3	343.496	3.407	20	30		EGEDHN
Cc1csc(NC(=O)CN[C@@H](CCCC#N)c2ccccc2)n1	ZINC000433030150	458829133	/nfs/dbraw/zinc/82/91/33/458829133.db2.gz	VHPKOJUSMZDBOW-HNNXBMFYSA-N	0	3	328.441	3.415	20	30		EGEDHN
COc1cc(CNC[C@@](C)(Cc2ccccc2)[C@H](C)O)ccc1C#N	ZINC000440643024	458836978	/nfs/dbraw/zinc/83/69/78/458836978.db2.gz	ZEFCPNVYXJPMBU-HRAATJIYSA-N	0	3	338.451	3.286	20	30		EGEDHN
N#CCc1ccc(CN2CCC(c3nnc4n3CCCC4)CC2)cc1	ZINC000548496305	458872572	/nfs/dbraw/zinc/87/25/72/458872572.db2.gz	HWMNZAQECJMYNO-UHFFFAOYSA-N	0	3	335.455	3.060	20	30		EGEDHN
CC(C)[C@H](Cc1ccc(F)cc1)NCC(=O)Nc1cccc(C#N)c1	ZINC000495515076	458872813	/nfs/dbraw/zinc/87/28/13/458872813.db2.gz	JYPOTFWBPNSXIZ-IBGZPJMESA-N	0	3	339.414	3.493	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1C[C@H](c2ccccc2)C(C)(C)C1	ZINC000441097067	458887904	/nfs/dbraw/zinc/88/79/04/458887904.db2.gz	YGHWCYXHFSMGMP-SJLPKXTDSA-N	0	3	327.472	3.120	20	30		EGEDHN
N#C[C@@H]1CC[C@H](N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)C1	ZINC000495592096	458892973	/nfs/dbraw/zinc/89/29/73/458892973.db2.gz	HTHDLXRXTJUFHS-QYZOEREBSA-N	0	3	341.455	3.317	20	30		EGEDHN
CO[C@]1(C)C[C@@H](N(C)C(=O)C(C#N)CCc2ccccc2)C1(C)C	ZINC000555556506	458906781	/nfs/dbraw/zinc/90/67/81/458906781.db2.gz	VHPXFWBUQGUVME-MBOZVWFJSA-N	0	3	328.456	3.421	20	30		EGEDHN
CC[C@H](Cc1ccc(C)cc1)N(CC)CC(=O)N(CC)CCC#N	ZINC000441322611	458918889	/nfs/dbraw/zinc/91/88/89/458918889.db2.gz	KDCFYDYIOQYVCD-LJQANCHMSA-N	0	3	329.488	3.400	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@@H](C)N1CCC[C@H]1c1cccc(N(C)C)c1	ZINC000441347511	458925242	/nfs/dbraw/zinc/92/52/42/458925242.db2.gz	ALJNTDTTYJCICI-XLIONFOSSA-N	0	3	341.499	3.479	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N1CCC[C@H](c2nc3ccccc3s2)C1	ZINC000519391523	458942793	/nfs/dbraw/zinc/94/27/93/458942793.db2.gz	DXKSCSHMIRXQAW-KBPBESRZSA-N	0	3	342.468	3.023	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)cn1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000495777053	458950200	/nfs/dbraw/zinc/95/02/00/458950200.db2.gz	YHDSFINPWAJCIT-HOCLYGCPSA-N	0	3	344.459	3.078	20	30		EGEDHN
C=CCNC(=O)CN[C@@H]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1	ZINC000442829275	459043996	/nfs/dbraw/zinc/04/39/96/459043996.db2.gz	UMPFCNHOOQROOO-UKRRQHHQSA-N	0	3	326.362	3.233	20	30		EGEDHN
CC1CC(C#N)(C(=O)N2CCCN(CCCc3ccccc3)CC2)C1	ZINC000532326827	459067547	/nfs/dbraw/zinc/06/75/47/459067547.db2.gz	JDFHGRMYHWADOD-UHFFFAOYSA-N	0	3	339.483	3.093	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2N[C@H]1CCc2ccccc2NC1=O	ZINC000594510350	459069482	/nfs/dbraw/zinc/06/94/82/459069482.db2.gz	IXCNWZCGXNLUKM-UXHICEINSA-N	0	3	331.419	3.479	20	30		EGEDHN
N#CC1(NC(=O)CN[C@H](Cc2ccccc2)c2cccs2)CCC1	ZINC000567301129	459080755	/nfs/dbraw/zinc/08/07/55/459080755.db2.gz	OGFIKXKMVXHCTH-MRXNPFEDSA-N	0	3	339.464	3.184	20	30		EGEDHN
C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NCc1cc(C#N)ccc1F	ZINC000496144522	459086182	/nfs/dbraw/zinc/08/61/82/459086182.db2.gz	YMVMMVJHEYAQOD-DYVFJYSZSA-N	0	3	347.434	3.432	20	30		EGEDHN
N#Cc1c(N[C@@H]2CCCN3CCCC[C@@H]23)nc2cc(Cl)ccn21	ZINC000594600005	459105331	/nfs/dbraw/zinc/10/53/31/459105331.db2.gz	KYWANCYDFJQASW-KGLIPLIRSA-N	0	3	329.835	3.288	20	30		EGEDHN
O=C(N[C@H]1CCN(CC2CC2)C1)c1ccc(C#Cc2ccccc2)cc1	ZINC000594640513	459118697	/nfs/dbraw/zinc/11/86/97/459118697.db2.gz	HQYQBXYYUGLNJU-QFIPXVFZSA-N	0	3	344.458	3.301	20	30		EGEDHN
N#Cc1ccc(CCNc2ccccc2CN2CCC(CO)CC2)cc1	ZINC000594700076	459133623	/nfs/dbraw/zinc/13/36/23/459133623.db2.gz	FDDAWEGYPHOVNX-UHFFFAOYSA-N	0	3	349.478	3.417	20	30		EGEDHN
CCC[C@H]1CN(Cc2ccc(C#N)cn2)CCN1Cc1ccccc1	ZINC000567911575	459189099	/nfs/dbraw/zinc/18/90/99/459189099.db2.gz	UROYHHCALQUVOD-NRFANRHFSA-N	0	3	334.467	3.440	20	30		EGEDHN
C[C@H](N[C@H](c1ccc(F)c(Cl)c1)C1CC1)C(=O)NC1(C#N)CCC1	ZINC000590751379	459204113	/nfs/dbraw/zinc/20/41/13/459204113.db2.gz	VCRDCXXJWUIFMV-ZBEGNZNMSA-N	0	3	349.837	3.471	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2	ZINC000558734134	459206583	/nfs/dbraw/zinc/20/65/83/459206583.db2.gz	NFZMMMQXKTZBAL-FFGOWVMKSA-N	0	3	339.483	3.405	20	30		EGEDHN
Cc1ccc(CN(C)C[C@H](O)COc2ccc(CC#N)cc2)cc1C	ZINC000590764964	459208100	/nfs/dbraw/zinc/20/81/00/459208100.db2.gz	JSZHFSWKRXOZHU-FQEVSTJZSA-N	0	3	338.451	3.241	20	30		EGEDHN
C[C@@H](NC(=O)N1CCC(CCC#N)CC1)[C@@H](c1ccccc1)N(C)C	ZINC000578502324	459211524	/nfs/dbraw/zinc/21/15/24/459211524.db2.gz	MGFVFMYUNRZZDC-APWZRJJASA-N	0	3	342.487	3.403	20	30		EGEDHN
C=C(C)CN1CCC(N[C@H](C)c2ccc([N+](=O)[O-])cc2OC)CC1	ZINC000595014472	459215662	/nfs/dbraw/zinc/21/56/62/459215662.db2.gz	VUUYKOCQGLISNC-CQSZACIVSA-N	0	3	333.432	3.295	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Nc1cnc(C2CC2)nc1)C(C)C	ZINC000590827483	459236106	/nfs/dbraw/zinc/23/61/06/459236106.db2.gz	RWWRTCBEIHUCPJ-QGZVFWFLSA-N	0	3	343.475	3.174	20	30		EGEDHN
C[C@H](NC(=O)[C@@]1(C#N)CC12CCCC2)[C@H](c1ccccc1)N(C)C	ZINC000579076089	459242670	/nfs/dbraw/zinc/24/26/70/459242670.db2.gz	UGDVUWKSHZICPL-VPWXQRGCSA-N	0	3	325.456	3.268	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NC(=O)N1CC[C@H](N2CCCC2)C1	ZINC000579086346	459242696	/nfs/dbraw/zinc/24/26/96/459242696.db2.gz	TWJLBMBKMNFDAL-MOPGFXCFSA-N	0	3	327.472	3.054	20	30		EGEDHN
CC(C)C[C@@H](CN1CCCC1)NC(=O)N1CCC(CCC#N)CC1	ZINC000580188170	459256852	/nfs/dbraw/zinc/25/68/52/459256852.db2.gz	GEVAAGBIBOMHGA-SFHVURJKSA-N	0	3	334.508	3.222	20	30		EGEDHN
CC(C)C[C@@](C)(C#N)NC(=O)[C@@H]1CN(C(C)(C)C)C[C@H]1C(F)(F)F	ZINC000559369896	459257040	/nfs/dbraw/zinc/25/70/40/459257040.db2.gz	JXJNGMWSURVXNZ-IOASZLSFSA-N	0	3	347.425	3.340	20	30		EGEDHN
C=CCCSCCNC(=O)N[C@@H](CN)c1ccc2ccccc2c1	ZINC000595265092	459264131	/nfs/dbraw/zinc/26/41/31/459264131.db2.gz	JPUXYLIAIQPMDP-SFHVURJKSA-N	0	3	343.496	3.448	20	30		EGEDHN
CCNc1ccc(C#N)cc1NC(=O)C1CN(C2CCCCC2)C1	ZINC000590907341	459264557	/nfs/dbraw/zinc/26/45/57/459264557.db2.gz	HQSGNZOBOCIAMU-UHFFFAOYSA-N	0	3	326.444	3.193	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)C2CCN(CCc3ccc(C#N)cc3)CC2)C1	ZINC000595292845	459269322	/nfs/dbraw/zinc/26/93/22/459269322.db2.gz	BRELKOSEMHODQX-QGZVFWFLSA-N	0	3	339.483	3.071	20	30		EGEDHN
N#Cc1c2c(sc1NC(=O)CCN1C[C@@H]3CCCC[C@@H]31)CCC2	ZINC000595565331	459348417	/nfs/dbraw/zinc/34/84/17/459348417.db2.gz	GESBMFCSJFTQOW-WFASDCNBSA-N	0	3	329.469	3.311	20	30		EGEDHN
C[C@]1(C#N)CCCN(C(=O)Nc2cc(CN)cc(C(F)(F)F)c2)C1	ZINC000591311148	459351673	/nfs/dbraw/zinc/35/16/73/459351673.db2.gz	HRDVQVZRKZMUOX-OAHLLOKOSA-N	0	3	340.349	3.322	20	30		EGEDHN
CC[C@H](C)N(CC)CC(=O)Nc1c(C#N)c(C)c(C)n1CCCOC	ZINC000595592910	459358082	/nfs/dbraw/zinc/35/80/82/459358082.db2.gz	KDMIRCRAJKNZCW-AWEZNQCLSA-N	0	3	348.491	3.072	20	30		EGEDHN
C=CCc1ccc(OC[C@H](O)CN2CCC(C)=C(C)C2)c(OC)c1	ZINC000483384940	459365002	/nfs/dbraw/zinc/36/50/02/459365002.db2.gz	OUNOFSANUOAGKY-GOSISDBHSA-N	0	3	331.456	3.206	20	30		EGEDHN
N#CC[C@H]1CCCN(C[C@@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000595619562	459372187	/nfs/dbraw/zinc/37/21/87/459372187.db2.gz	DFEICHDIULRBDI-HIFRSBDPSA-N	0	3	326.362	3.234	20	30		EGEDHN
C=CC[C@@H](CO)CNCc1cn(-c2ccccc2)nc1C(C)(C)C	ZINC000540324937	459380192	/nfs/dbraw/zinc/38/01/92/459380192.db2.gz	DUMQLEIOSFAUQW-MRXNPFEDSA-N	0	3	327.472	3.444	20	30		EGEDHN
Cc1ccccc1[C@H](N[C@H](C)C(=O)N[C@](C)(C#N)C(C)C)C1CC1	ZINC000540589822	459382535	/nfs/dbraw/zinc/38/25/35/459382535.db2.gz	AMBWBWWCLQOKCC-XFQXTVEOSA-N	0	3	327.472	3.479	20	30		EGEDHN
C=CCN(CC(=O)NCc1ccc2c(c1)OCO2)CC1CCCCC1	ZINC000484545170	459419219	/nfs/dbraw/zinc/41/92/19/459419219.db2.gz	UEDMMAPBRMHLOI-UHFFFAOYSA-N	0	3	344.455	3.100	20	30		EGEDHN
COC(=O)Nc1cccc(CNCc2ccc(O[C@@H](C)C#N)cc2)c1	ZINC000497074975	459428155	/nfs/dbraw/zinc/42/81/55/459428155.db2.gz	XANIGKTVPOQSHE-AWEZNQCLSA-N	0	3	339.395	3.446	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)s1)[C@@H]1CCCN1C(=O)OC(C)(C)C	ZINC000497081109	459430518	/nfs/dbraw/zinc/43/05/18/459430518.db2.gz	MAANJSUUFZKAFF-WFASDCNBSA-N	0	3	335.473	3.497	20	30		EGEDHN
C[C@H](CC1CCCCC1)NCCS(=O)(=O)c1ccc(C#N)cc1	ZINC000569333198	459434247	/nfs/dbraw/zinc/43/42/47/459434247.db2.gz	XKNXVUXRUKKLJL-OAHLLOKOSA-N	0	3	334.485	3.280	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc3c(c2)C(=O)CCCC3)CC1	ZINC000561478738	459456117	/nfs/dbraw/zinc/45/61/17/459456117.db2.gz	QFYODFQLAXQMET-UHFFFAOYSA-N	0	3	341.455	3.368	20	30		EGEDHN
CN(C(=O)CN1CC[C@H](Cc2ccccc2)C1)C1(C#N)CCCCC1	ZINC000525640019	459470851	/nfs/dbraw/zinc/47/08/51/459470851.db2.gz	LXJQDXYHVQWMJS-LJQANCHMSA-N	0	3	339.483	3.236	20	30		EGEDHN
CN1CC[C@@]2(CCN(C(=O)c3ccc(C#Cc4ccccc4)cc3)C2)C1	ZINC000561772925	459482934	/nfs/dbraw/zinc/48/29/34/459482934.db2.gz	CIVJBRIZXSIFOW-HSZRJFAPSA-N	0	3	344.458	3.254	20	30		EGEDHN
C=CCC[C@H](C)Nc1ccc2nc(CCN3CCOCC3)[nH]c2c1	ZINC000541760322	459488804	/nfs/dbraw/zinc/48/88/04/459488804.db2.gz	HADFNJXBOQSDSB-HNNXBMFYSA-N	0	3	328.460	3.204	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H](C)Oc2ccc3c(c2)CCC3)CC1	ZINC000592075685	459520279	/nfs/dbraw/zinc/52/02/79/459520279.db2.gz	SWIYBOBIFSORAG-INIZCTEOSA-N	0	3	342.483	3.099	20	30		EGEDHN
N#Cc1cnnc(N2CCN(Cc3ccccc3)C3(CCCCC3)C2)c1	ZINC000596154565	459539772	/nfs/dbraw/zinc/53/97/72/459539772.db2.gz	BUXWELGFJIPIKV-UHFFFAOYSA-N	0	3	347.466	3.373	20	30		EGEDHN
Cc1ccc(NC(=O)C2(CNC(=O)C(C)C#N)CCCC2)cc1C	ZINC000488244259	459541201	/nfs/dbraw/zinc/54/12/01/459541201.db2.gz	BUUPDLWUBIYQLF-OAHLLOKOSA-N	0	3	327.428	3.078	20	30		EGEDHN
C[C@H]1C[C@@H]1N1CCN(c2nc(C(F)(F)F)ccc2C#N)C[C@@H](C)C1	ZINC000488738387	459549970	/nfs/dbraw/zinc/54/99/70/459549970.db2.gz	YXNMCRPEJUVPTH-OBJOEFQTSA-N	0	3	338.377	3.139	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC[C@H]2CCCCC(F)(F)C2)CC1	ZINC000488821305	459552974	/nfs/dbraw/zinc/55/29/74/459552974.db2.gz	VMGSRFSWSBORSF-AWEZNQCLSA-N	0	3	329.435	3.152	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CCC[C@H](c3ccncc3)C2)cc1	ZINC000570969572	459562798	/nfs/dbraw/zinc/56/27/98/459562798.db2.gz	FNRKKQJCGLXDFD-VQTJNVASSA-N	0	3	344.418	3.042	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)Nc1cccc2c1CCNC2	ZINC000571157711	459564977	/nfs/dbraw/zinc/56/49/77/459564977.db2.gz	IVMMZFASKPRCSA-UHFFFAOYSA-N	0	3	338.407	3.158	20	30		EGEDHN
CC(C)(CO)[C@@H](NCC#Cc1ccc(OC(F)(F)F)cc1)C1CC1	ZINC000571533681	459569499	/nfs/dbraw/zinc/56/94/99/459569499.db2.gz	AUMWRENPQYZFJO-INIZCTEOSA-N	0	3	341.373	3.323	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN[C@@H](C)c1cnn(C(C)C)c1	ZINC000542574860	459572149	/nfs/dbraw/zinc/57/21/49/459572149.db2.gz	XTRDKZFOPDDDBD-AWEZNQCLSA-N	0	3	328.416	3.074	20	30		EGEDHN
C=CCN1CC[C@@H](N2CC[C@@H](Cc3ccc(C(C)C)cc3)C2)C1=O	ZINC000499635568	459642921	/nfs/dbraw/zinc/64/29/21/459642921.db2.gz	YCFHQAGFCIFFDU-AZUAARDMSA-N	0	3	326.484	3.461	20	30		EGEDHN
C#CCCN1CCC(NC(=O)/C=C/c2cccc3ccccc23)CC1	ZINC000491923358	459685015	/nfs/dbraw/zinc/68/50/15/459685015.db2.gz	DCKQWWPSVXWUJI-VAWYXSNFSA-N	0	3	332.447	3.457	20	30		EGEDHN
C[C@H](O)[C@H]1CCCN(Cc2cn(CCC#N)nc2-c2ccccc2)C1	ZINC000543748516	459693897	/nfs/dbraw/zinc/69/38/97/459693897.db2.gz	TZRGCVWOCUZKRX-WMZOPIPTSA-N	0	3	338.455	3.057	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@@H](CO)C1CCCCC1	ZINC000543839964	459706619	/nfs/dbraw/zinc/70/66/19/459706619.db2.gz	OTBFDGCUEMATEV-KRWDZBQOSA-N	0	3	348.512	3.434	20	30		EGEDHN
C#CCCN1CCC(NC(=O)/C=C\c2ccc(OCC)c(C)c2)CC1	ZINC000492575474	459711726	/nfs/dbraw/zinc/71/17/26/459711726.db2.gz	KNJJKGZGDWOUEG-NTMALXAHSA-N	0	3	340.467	3.011	20	30		EGEDHN
C[C@H](NC(=O)OC(C)(C)C)[C@@H](Cc1ccccc1)NCCCC#N	ZINC000492791626	459720958	/nfs/dbraw/zinc/72/09/58/459720958.db2.gz	NROKCLMEFTZVJX-DOTOQJQBSA-N	0	3	331.460	3.404	20	30		EGEDHN
CSc1ccc(OC[C@H](O)CN2CCC(CCC#N)CC2)cc1	ZINC000573718356	459723581	/nfs/dbraw/zinc/72/35/81/459723581.db2.gz	LZEDNJADDYWNKX-MRXNPFEDSA-N	0	3	334.485	3.164	20	30		EGEDHN
CC[C@](C)(C#N)C(=O)N(C)C[C@H]1CCN(Cc2ccc(C)s2)C1	ZINC000563266341	459750424	/nfs/dbraw/zinc/75/04/24/459750424.db2.gz	NCLFEWRLNXAPOR-CRAIPNDOSA-N	0	3	333.501	3.277	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)c1ccsc1Cl	ZINC000596830100	459772952	/nfs/dbraw/zinc/77/29/52/459772952.db2.gz	XOJXVIBFFMKNMG-UHFFFAOYSA-N	0	3	347.871	3.477	20	30		EGEDHN
C=CCn1c(-c2ccccc2F)nnc1N1C[C@@H](C)N(CC)C[C@H]1C	ZINC000564384507	459773579	/nfs/dbraw/zinc/77/35/79/459773579.db2.gz	OTXOWZDIRIUEPW-HUUCEWRRSA-N	0	3	343.450	3.189	20	30		EGEDHN
C[C@@H]1CCC[C@](C#N)(NC(=O)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000565186301	459782608	/nfs/dbraw/zinc/78/26/08/459782608.db2.gz	UPWTYVFSKALABR-KPFFTGBYSA-N	0	3	325.456	3.097	20	30		EGEDHN
CCC(C#N)(CC)c1nc(-c2ccccc2OCCN(C)C)no1	ZINC000528124750	459798969	/nfs/dbraw/zinc/79/89/69/459798969.db2.gz	JSDHYPCXMAUJOQ-UHFFFAOYSA-N	0	3	328.416	3.258	20	30		EGEDHN
C=CCOc1ccc(CNC[C@@H](O)COc2ccccc2Cl)cc1	ZINC000566131284	459811125	/nfs/dbraw/zinc/81/11/25/459811125.db2.gz	YLJMTEMMGQFPRN-MRXNPFEDSA-N	0	3	347.842	3.434	20	30		EGEDHN
Cc1c2ccccc2oc1[C@H](NC[C@@H](O)CN(C)CCC#N)C(C)C	ZINC000584834298	459811205	/nfs/dbraw/zinc/81/12/05/459811205.db2.gz	ICBCESWMQNKSPZ-VQIMIIECSA-N	0	3	343.471	3.234	20	30		EGEDHN
CCC(C#N)(CC)C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1	ZINC000528799166	459814266	/nfs/dbraw/zinc/81/42/66/459814266.db2.gz	PJNDBBFQCHTQEY-CALCHBBNSA-N	0	3	349.519	3.054	20	30		EGEDHN
Cn1cc([C@@H]2N(C(=O)C(C#N)CCc3ccccc3)CC2(C)C)cn1	ZINC000574762974	459868397	/nfs/dbraw/zinc/86/83/97/459868397.db2.gz	CBPHGKVWJZHFJY-WMZOPIPTSA-N	0	3	336.439	3.102	20	30		EGEDHN
CCCN1CC[C@H](NC(=O)c2ccccc2-c2ccccc2C#N)C1	ZINC000598343761	459873457	/nfs/dbraw/zinc/87/34/57/459873457.db2.gz	XDDFLAQPIRISPW-KRWDZBQOSA-N	0	3	333.435	3.439	20	30		EGEDHN
CN(CCN1CCCCC1)C(=O)N[C@@H]1CCCc2cc(C#N)ccc21	ZINC000593414942	459882331	/nfs/dbraw/zinc/88/23/31/459882331.db2.gz	CSHMIMDKHVPMCY-LJQANCHMSA-N	0	3	340.471	3.063	20	30		EGEDHN
CCCN(C(=O)[C@@H](C#N)CC)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000593446152	459892540	/nfs/dbraw/zinc/89/25/40/459892540.db2.gz	LSFNYSNIGSRZED-RTBURBONSA-N	0	3	327.472	3.439	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN2CCC[C@@H]2C2CC2)cc1	ZINC000609133702	459908189	/nfs/dbraw/zinc/90/81/89/459908189.db2.gz	VKLNAHBRUYQZLF-LJQANCHMSA-N	0	3	341.455	3.206	20	30		EGEDHN
CN1CCC(Oc2ccc(CNC(=O)CCCCCC#N)cc2)CC1	ZINC000588166422	459924692	/nfs/dbraw/zinc/92/46/92/459924692.db2.gz	VNCAUXJLIHTCRN-UHFFFAOYSA-N	0	3	343.471	3.250	20	30		EGEDHN
CC[C@H](C#N)C(=O)Nc1cc(C)cc(N2CCN(C(C)C)CC2)c1	ZINC000593652110	459941500	/nfs/dbraw/zinc/94/15/00/459941500.db2.gz	RSDKEUGXWYYDEQ-MRXNPFEDSA-N	0	3	328.460	3.014	20	30		EGEDHN
CN(C)CCN(Cc1cccc(O)c1)C(=O)CC1(C#N)CCCCC1	ZINC000597408491	459943479	/nfs/dbraw/zinc/94/34/79/459943479.db2.gz	XLBMNBFHBCPTTO-UHFFFAOYSA-N	0	3	343.471	3.147	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN1CCC(Oc2ccc(F)cc2F)CC1	ZINC000598586709	459953836	/nfs/dbraw/zinc/95/38/36/459953836.db2.gz	WXQCPZNKRBRVCX-AWEZNQCLSA-N	0	3	338.398	3.109	20	30		EGEDHN
C[C@@H](NC1CCN(Cc2cccc(C#N)c2)CC1)c1cncc(F)c1	ZINC000593693433	459954644	/nfs/dbraw/zinc/95/46/44/459954644.db2.gz	ZDEYBCQFNDXVMI-OAHLLOKOSA-N	0	3	338.430	3.408	20	30		EGEDHN
C[C@@H](CCC#N)CN1CCN(C(=O)Cc2cccc(Cl)c2)[C@H](C)C1	ZINC000602475012	459957368	/nfs/dbraw/zinc/95/73/68/459957368.db2.gz	HCZRTKYIDOTZBJ-JKSUJKDBSA-N	0	3	347.890	3.355	20	30		EGEDHN
COC(=O)c1cc(CN[C@@H](C)c2ccc(C#N)cc2)n2c1CCCC2	ZINC000598629016	459968712	/nfs/dbraw/zinc/96/87/12/459968712.db2.gz	AASHGCCKKZDUTG-AWEZNQCLSA-N	0	3	337.423	3.333	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN(Cc1ccccc1)[C@@H]1COC(C)(C)C1	ZINC000598626034	459969164	/nfs/dbraw/zinc/96/91/64/459969164.db2.gz	XPKDTBDEBVRSNB-ZWKOTPCHSA-N	0	3	330.472	3.357	20	30		EGEDHN
CC[C@H](C)N[C@@H](CNC(=O)N1CCC[C@](C)(C#N)C1)c1ccco1	ZINC000588724795	459975922	/nfs/dbraw/zinc/97/59/22/459975922.db2.gz	YTJTVUXQEOWTNU-RLFYNMQTSA-N	0	3	332.448	3.044	20	30		EGEDHN
C[C@@H](CC1(C#N)CCOCC1)NCc1ccccc1Cn1ccnc1	ZINC000602511200	459976736	/nfs/dbraw/zinc/97/67/36/459976736.db2.gz	NDEOLLNUYBDCSA-KRWDZBQOSA-N	0	3	338.455	3.120	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CNCc1cc(Cl)cc(Br)c1	ZINC000598727512	460009037	/nfs/dbraw/zinc/00/90/37/460009037.db2.gz	JBNGVSASKYDZFO-CYBMUJFWSA-N	0	3	345.668	3.493	20	30		EGEDHN
Cc1ccc2[nH]c(-c3ccccc3NC(=O)[C@@H](N)CCCC#N)nc2c1	ZINC000593912712	460015645	/nfs/dbraw/zinc/01/56/45/460015645.db2.gz	RUGIBURYZWXOKA-HNNXBMFYSA-N	0	3	347.422	3.498	20	30		EGEDHN
Cc1ccc2nc(-c3ccccc3NC(=O)[C@@H](N)CCCC#N)[nH]c2c1	ZINC000593912712	460015652	/nfs/dbraw/zinc/01/56/52/460015652.db2.gz	RUGIBURYZWXOKA-HNNXBMFYSA-N	0	3	347.422	3.498	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000593949122	460023407	/nfs/dbraw/zinc/02/34/07/460023407.db2.gz	WCHQSTPDNWPRII-UWJYYQICSA-N	0	3	347.462	3.128	20	30		EGEDHN
CC[C@@H]1CN(C(=O)C(C)C)CC[C@@H]1NCc1cc(C#N)ccc1F	ZINC000614204237	460047282	/nfs/dbraw/zinc/04/72/82/460047282.db2.gz	ZBFLMCQYWGBLPC-QAPCUYQASA-N	0	3	331.435	3.070	20	30		EGEDHN
Cc1cc(C)c(C#N)c(NC(=O)[C@@H]2CCCN(Cc3ccccc3)C2)n1	ZINC000598851963	460067679	/nfs/dbraw/zinc/06/76/79/460067679.db2.gz	FBNHRXUKWXKONM-GOSISDBHSA-N	0	3	348.450	3.421	20	30		EGEDHN
N#Cc1cccc(CN2CCC(NCc3cccc(F)c3N)CC2)c1	ZINC000602703677	460074616	/nfs/dbraw/zinc/07/46/16/460074616.db2.gz	ATQGKZGYFQFBEW-UHFFFAOYSA-N	0	3	338.430	3.034	20	30		EGEDHN
N#CC[C@@H]1CCCN(C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)C1	ZINC000597911390	460105470	/nfs/dbraw/zinc/10/54/70/460105470.db2.gz	LGCAPJXEEDRZNU-FUHWJXTLSA-N	0	3	343.446	3.190	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H](C)OCc2ccc(C)cc2)CC1	ZINC000625323162	460127946	/nfs/dbraw/zinc/12/79/46/460127946.db2.gz	QPNNDRYFVKBMLY-QGZVFWFLSA-N	0	3	330.472	3.057	20	30		EGEDHN
CC[C@H](NCc1cccc(NC(=O)COC)c1)c1ccc(C#N)cc1	ZINC000576427670	460138583	/nfs/dbraw/zinc/13/85/83/460138583.db2.gz	JHSZOHOVJCKHQM-IBGZPJMESA-N	0	3	337.423	3.384	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)C(=O)NCc1cccc(CN(C)C)c1	ZINC000594220727	460158018	/nfs/dbraw/zinc/15/80/18/460158018.db2.gz	YINSRUCHOAAWMW-MRXNPFEDSA-N	0	3	335.451	3.115	20	30		EGEDHN
CC(C)(C)N1C[C@@H](C(=O)N[C@@H]2CCCC[C@H]2C#N)[C@H](C(F)(F)F)C1	ZINC000598094131	460171835	/nfs/dbraw/zinc/17/18/35/460171835.db2.gz	COZVDPRRHAMLAA-REWJHTLYSA-N	0	3	345.409	3.094	20	30		EGEDHN
CN(CCc1ccccc1)[C@H]1CCN(C(=O)c2sccc2C#N)C1	ZINC000598195604	460200713	/nfs/dbraw/zinc/20/07/13/460200713.db2.gz	PFLBNAPEQWDBMN-KRWDZBQOSA-N	0	3	339.464	3.009	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CCC[C@@H](OC2CCC2)C1	ZINC000594390899	460203070	/nfs/dbraw/zinc/20/30/70/460203070.db2.gz	YCGPSAWVEMCDKO-IEBWSBKVSA-N	0	3	326.440	3.319	20	30		EGEDHN
C[C@H](c1ccc(F)cc1)N(C)C[C@H](O)COc1ccccc1C#N	ZINC000599249742	460207177	/nfs/dbraw/zinc/20/71/77/460207177.db2.gz	GQFASPYSZCFEIV-KDOFPFPSSA-N	0	3	328.387	3.130	20	30		EGEDHN
Cc1cccc([C@H](NC(=O)[C@@H](N)CCCCC#N)C(F)(F)F)c1	ZINC000594435802	460219819	/nfs/dbraw/zinc/21/98/19/460219819.db2.gz	DYBZWZCTCKZFGV-KBPBESRZSA-N	0	3	327.350	3.126	20	30		EGEDHN
N#CCCCC[C@H](N)C(=O)Nc1ccc(Oc2ccc(F)cc2)nc1	ZINC000594440468	460221342	/nfs/dbraw/zinc/22/13/42/460221342.db2.gz	CTTKNFWHDAZKHI-INIZCTEOSA-N	0	3	342.374	3.363	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@@H](N)CCCCC#N)CCc2ccc(Cl)cc21	ZINC000594452189	460225261	/nfs/dbraw/zinc/22/52/61/460225261.db2.gz	DVFZEAQCYXWNGQ-DYVFJYSZSA-N	0	3	333.863	3.239	20	30		EGEDHN
CC[C@H](CN1CCCC1)NC(=O)N(Cc1ccc(C#N)cc1)C(C)C	ZINC000610721310	460225927	/nfs/dbraw/zinc/22/59/27/460225927.db2.gz	PWVZBMLQRQETAL-LJQANCHMSA-N	0	3	342.487	3.353	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CN[C@H](c1cccs1)C1CC1	ZINC000599348762	460234580	/nfs/dbraw/zinc/23/45/80/460234580.db2.gz	LNEXIXGLANLRPF-QAPCUYQASA-N	0	3	328.437	3.100	20	30		EGEDHN
CN(C)CCN(Cc1ccsc1)C(=O)Nc1cc(F)cc(C#N)c1	ZINC000603070118	460235824	/nfs/dbraw/zinc/23/58/24/460235824.db2.gz	GQKNZJRFTGEXBG-UHFFFAOYSA-N	0	3	346.431	3.355	20	30		EGEDHN
Cc1cc([C@@H](C)NC[C@@H](O)COc2ccccc2C#N)ccc1F	ZINC000599355144	460236651	/nfs/dbraw/zinc/23/66/51/460236651.db2.gz	VAHZZQBMTBLIOP-RHSMWYFYSA-N	0	3	328.387	3.096	20	30		EGEDHN
Cc1ccc(CN(CC(=O)N[C@@](C)(C#N)C2CC2)C(C)(C)C)cc1	ZINC000599527269	460267402	/nfs/dbraw/zinc/26/74/02/460267402.db2.gz	JFDXGBVPPCQLPB-FQEVSTJZSA-N	0	3	327.472	3.404	20	30		EGEDHN
Cc1ccc(CN(CC(=O)N[C@](C)(C#N)C2CC2)C(C)(C)C)cc1	ZINC000599527270	460267799	/nfs/dbraw/zinc/26/77/99/460267799.db2.gz	JFDXGBVPPCQLPB-HXUWFJFHSA-N	0	3	327.472	3.404	20	30		EGEDHN
CC(C)[C@H]1CN(Cc2ccccc2)CCN1C[C@@H](O)CC(C)(C)C#N	ZINC000599536679	460270373	/nfs/dbraw/zinc/27/03/73/460270373.db2.gz	OMCYEOYRCVLFCY-VQTJNVASSA-N	0	3	343.515	3.130	20	30		EGEDHN
COCc1cc(C#N)ccc1NC[C@@H](c1cccc(OC)c1)N(C)C	ZINC000603271812	460275045	/nfs/dbraw/zinc/27/50/45/460275045.db2.gz	COOFJYGAZRXJEW-FQEVSTJZSA-N	0	3	339.439	3.428	20	30		EGEDHN
Cc1c(Cl)cnc(N(C)CCCN(C)Cc2ccncc2)c1C#N	ZINC000603402982	460298050	/nfs/dbraw/zinc/29/80/50/460298050.db2.gz	UBQGFRZDCCMVRZ-UHFFFAOYSA-N	0	3	343.862	3.268	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2[NH2+]CCCNC(=O)c1cccc([O-])c1	ZINC000611392334	460354099	/nfs/dbraw/zinc/35/40/99/460354099.db2.gz	MKSHKKXZZWSLHA-HXUWFJFHSA-N	0	3	349.434	3.051	20	30		EGEDHN
C[C@@H](C(=O)N(C)CCC#N)N1CCC[C@H](c2cc3ccccc3[nH]2)C1	ZINC000603890046	460356021	/nfs/dbraw/zinc/35/60/21/460356021.db2.gz	MKHLCCQMPPOKEG-RDJZCZTQSA-N	0	3	338.455	3.108	20	30		EGEDHN
CCC(C#N)(CC)C(=O)NC[C@H](CN(C)C)c1ccc(Cl)cc1	ZINC000599937600	460361880	/nfs/dbraw/zinc/36/18/80/460361880.db2.gz	XTHXHCMSRPCSTR-OAHLLOKOSA-N	0	3	335.879	3.431	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@@H](NCc3cc4ccccc4[nH]3)C2=O)cc1	ZINC000611509120	460381893	/nfs/dbraw/zinc/38/18/93/460381893.db2.gz	YJPOKALOJCJFCP-HXUWFJFHSA-N	0	3	344.418	3.325	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@H]2CCN(C3CC3)C2)cc1OC	ZINC000623403523	460530504	/nfs/dbraw/zinc/53/05/04/460530504.db2.gz	ZFZNAJUITAUQOI-AWEZNQCLSA-N	0	3	336.863	3.240	20	30		EGEDHN
C[C@H](NCc1ccnc(N2CCSCC2)c1)c1cccc(C#N)c1	ZINC000601302170	460781478	/nfs/dbraw/zinc/78/14/78/460781478.db2.gz	ITHACDXRQFDGQV-HNNXBMFYSA-N	0	3	338.480	3.357	20	30		EGEDHN
Cc1cccc(CN2CC[C@H](NC(=O)c3ccc(CC#N)cc3)C2)c1	ZINC000601849900	460924903	/nfs/dbraw/zinc/92/49/03/460924903.db2.gz	LXWVLELWWPGBDJ-FQEVSTJZSA-N	0	3	333.435	3.065	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(C(F)(F)F)c(OC)c2)CC1	ZINC000668370541	461259446	/nfs/dbraw/zinc/25/94/46/461259446.db2.gz	ZNFYZQMDSYJZNN-UHFFFAOYSA-N	0	3	342.361	3.094	20	30		EGEDHN
O=C(NC1CCN(C2CC2)CC1)c1ccc(C#Cc2ccccc2)cc1	ZINC000641886363	461406795	/nfs/dbraw/zinc/40/67/95/461406795.db2.gz	MWEUCCLPRYMAJY-UHFFFAOYSA-N	0	3	344.458	3.443	20	30		EGEDHN
C=CCC1(NC(=O)NCc2cccc(OCCN(C)C)c2)CCCC1	ZINC000663584869	461712376	/nfs/dbraw/zinc/71/23/76/461712376.db2.gz	BGKQAZUZAHWEJP-UHFFFAOYSA-N	0	3	345.487	3.315	20	30		EGEDHN
C=C1CC(C)(C(=O)NC2CCN(CCOc3ccc(F)cc3)CC2)C1	ZINC000631398330	461752796	/nfs/dbraw/zinc/75/27/96/461752796.db2.gz	ZHLRQLMOIGDTNT-UHFFFAOYSA-N	0	3	346.446	3.141	20	30		EGEDHN
N#CC(C(=O)c1ccc2[nH]c(=O)oc2c1)c1cc(C(F)(F)F)ccn1	ZINC000643779402	461803528	/nfs/dbraw/zinc/80/35/28/461803528.db2.gz	RXGKYKGETYNFFH-JTQLQIEISA-N	0	3	347.252	3.437	20	30		EGEDHN
C=CC[C@@H]1CCCN(CC(=O)N[C@H](C)c2cc(OC)ccc2OC)C1	ZINC000661377760	462223524	/nfs/dbraw/zinc/22/35/24/462223524.db2.gz	UCAJOCXJAUAFBX-HZPDHXFCSA-N	0	3	346.471	3.169	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H](C)Cc2ccc(OCC)cc2)CC1	ZINC000665243173	462365800	/nfs/dbraw/zinc/36/58/00/462365800.db2.gz	FEEDCORLWALXPY-QGZVFWFLSA-N	0	3	344.499	3.421	20	30		EGEDHN
C=CCN(CC(=O)N[C@@H](C)c1cc(OC)c(OC)cc1C)C(C)(C)C	ZINC000661756914	462399204	/nfs/dbraw/zinc/39/92/04/462399204.db2.gz	XJVZQEKTRFQJSX-HNNXBMFYSA-N	0	3	348.487	3.476	20	30		EGEDHN
C=CCC1(NCc2nc(-c3ccc4c(c3)OCO4)no2)CCCC1	ZINC000661849655	462437564	/nfs/dbraw/zinc/43/75/64/462437564.db2.gz	YEGRPJDDOWCLOY-UHFFFAOYSA-N	0	3	327.384	3.444	20	30		EGEDHN
C=CCNC(=O)CN(CC)[C@@H](C)Cc1ccc(C(F)(F)F)cc1	ZINC000662159049	462532977	/nfs/dbraw/zinc/53/29/77/462532977.db2.gz	YRPXSOPNQYLCNT-ZDUSSCGKSA-N	0	3	328.378	3.261	20	30		EGEDHN
C=CCN1CCC(NC(=O)Cc2nc(-c3cccs3)oc2C)CC1	ZINC000171719930	526423415	/nfs/dbraw/zinc/42/34/15/526423415.db2.gz	NZFBLSZHUABDFJ-UHFFFAOYSA-N	0	3	345.468	3.021	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCCCc2c[nH]c3ccccc23)CC1	ZINC000171686946	526432829	/nfs/dbraw/zinc/43/28/29/526432829.db2.gz	LFRXOOXGDAIVAU-UHFFFAOYSA-N	0	3	340.471	3.050	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCCc2csc3ccccc23)CC1	ZINC000171717905	526434335	/nfs/dbraw/zinc/43/43/35/526434335.db2.gz	ZEGGCGVYBCLGKE-UHFFFAOYSA-N	0	3	343.496	3.393	20	30		EGEDHN
C=CCC[C@H](NC(=O)NC1CCN(CCOC)CC1)c1ccccc1	ZINC000159127393	527477248	/nfs/dbraw/zinc/47/72/48/527477248.db2.gz	GFCRKWVLESNSBY-IBGZPJMESA-N	0	3	345.487	3.104	20	30		EGEDHN
C[C@@H](C(=O)NC1(C#N)CCCCC1)N1CC[C@@H](Cc2ccccc2)C1	ZINC000246617291	547282167	/nfs/dbraw/zinc/28/21/67/547282167.db2.gz	GYRQUKWXVNCRQS-HKUYNNGSSA-N	0	3	339.483	3.282	20	30		EGEDHN
CCN1CCCC[C@@H]1CNC(=O)[C@H]1CCCN(C(=O)C(C)(C)C)C1	ZINC000329436535	547497059	/nfs/dbraw/zinc/49/70/59/547497059.db2.gz	JIWPXAIVCRTNFX-JKSUJKDBSA-N	0	3	337.508	3.102	20	30		EGEDHN
COc1ccc(NC(=O)NC(=O)CN2CCC[C@H](C3CC3)C2)cc1	ZINC000329673843	547505056	/nfs/dbraw/zinc/50/50/56/547505056.db2.gz	VCKBVPMCWCGWGY-AWEZNQCLSA-N	0	3	331.416	3.306	20	30		EGEDHN
CCO[C@@H]1C[C@@H](N[C@H](C)C(=O)NC2(C#N)CCCCC2)C12CCCC2	ZINC000332880911	547523509	/nfs/dbraw/zinc/52/35/09/547523509.db2.gz	LDGMXBSFPLOUDE-BRWVUGGUSA-N	0	3	347.503	3.045	20	30		EGEDHN
C=C(C)COCCNC(=O)N[C@@H](CN1CCCCC1)c1ccccc1	ZINC000675575317	548940035	/nfs/dbraw/zinc/94/00/35/548940035.db2.gz	QOEWQMGGMFOXMT-IBGZPJMESA-N	0	3	345.487	3.106	20	30		EGEDHN
Cc1cc(C(=O)C(C#N)c2nc3cc(F)ccc3s2)cc(=O)[nH]1	ZINC000679883647	549785673	/nfs/dbraw/zinc/78/56/73/549785673.db2.gz	ZOLQFGSKKFTQBN-NSHDSACASA-N	0	3	327.340	3.335	20	30		EGEDHN
C=C(C)CN(Cc1ccccc1)C(=O)N[C@H]1CCN(CC2CC2)C1	ZINC000684266703	550311404	/nfs/dbraw/zinc/31/14/04/550311404.db2.gz	CPIUIZNJIKMZAS-IBGZPJMESA-N	0	3	327.472	3.259	20	30		EGEDHN
CC(N=Nc1cnc2ccccc2n1)c1cccc(OCCN(C)C)c1	ZINC000727257636	574656375	/nfs/dbraw/zinc/65/63/75/574656375.db2.gz	VPONBHZPBGFTTC-UHFFFAOYSA-N	0	3	349.438	3.406	20	30		EGEDHN
N#CC(C(=O)CCCn1cccn1)c1nc2ccccc2n1C(F)F	ZINC000729892186	574894378	/nfs/dbraw/zinc/89/43/78/574894378.db2.gz	TXRYOVMVYUXLLJ-GFCCVEGCSA-N	0	3	343.337	3.285	20	30		EGEDHN
CN1CCC(N(C(=O)c2ccccc2OCC#N)c2ccccc2)CC1	ZINC000732733125	575285363	/nfs/dbraw/zinc/28/53/63/575285363.db2.gz	ZAGMFWZYQSYNKC-UHFFFAOYSA-N	0	3	349.434	3.330	20	30		EGEDHN
C[C@@H]1SCCN(CC(=O)C(C#N)c2nc3ccccc3s2)[C@H]1C	ZINC000735673403	575698336	/nfs/dbraw/zinc/69/83/36/575698336.db2.gz	BCALNQMXEOVZQN-AVGNSLFASA-N	0	3	345.493	3.298	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2cc(Cl)sc2Cl)CC1	ZINC000740737336	576621834	/nfs/dbraw/zinc/62/18/34/576621834.db2.gz	LSEBPXYRVQHRQK-UHFFFAOYSA-N	0	3	331.268	3.272	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cc1	ZINC000741551082	576700099	/nfs/dbraw/zinc/70/00/99/576700099.db2.gz	SPQANFZUSCZVNW-XLIONFOSSA-N	0	3	348.446	3.264	20	30		EGEDHN
C#CCOc1ccc(F)cc1NC(=O)NC[C@@H](C)N1CCC[C@H](C)C1	ZINC000743201516	576803322	/nfs/dbraw/zinc/80/33/22/576803322.db2.gz	XAGKIYFCXFBAKJ-LSDHHAIUSA-N	0	3	347.434	3.080	20	30		EGEDHN
C#CCCN1CCC(NC(=O)[C@H](CC)Sc2ccccc2)CC1	ZINC000743492273	576810300	/nfs/dbraw/zinc/81/03/00/576810300.db2.gz	RSLONLUZISSWHJ-SFHVURJKSA-N	0	3	330.497	3.161	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2cccc(Oc3ccncc3)c2)CC1	ZINC000743491212	576810323	/nfs/dbraw/zinc/81/03/23/576810323.db2.gz	COLXOOGTKKZAAV-UHFFFAOYSA-N	0	3	349.434	3.091	20	30		EGEDHN
C#CCCN1CCC(NC(=O)C[C@@H](CC)c2ccc(C)cc2)CC1	ZINC000743493404	576810385	/nfs/dbraw/zinc/81/03/85/576810385.db2.gz	QYMPGTUWOUZNKG-GOSISDBHSA-N	0	3	326.484	3.483	20	30		EGEDHN
C=CCNC(=O)C(C#N)C(=O)[C@@H]1C[C@H]1c1cc(Cl)cc(Cl)c1	ZINC000744031115	576819233	/nfs/dbraw/zinc/81/92/33/576819233.db2.gz	QTEPABNQFLVSGD-BFHYXJOUSA-N	0	3	337.206	3.108	20	30		EGEDHN
C#CCN(C(=O)NC[C@H](c1ccccc1)N(C)C)C1CCCCC1	ZINC000744812067	576835040	/nfs/dbraw/zinc/83/50/40/576835040.db2.gz	DQCBSSWDJVQNHS-LJQANCHMSA-N	0	3	327.472	3.267	20	30		EGEDHN
N#CC(C(=O)CCc1cccc(Cl)c1)C(=O)NC1CCCCC1	ZINC000050682330	1291655067	/nfs/dbraw/zinc/65/50/67/1291655067.db2.gz	FVEURCMCIATGJR-MRXNPFEDSA-N	0	3	332.831	3.430	20	30		EGEDHN
CCCC(=O)N1CCC[C@@H](C(=O)C(C#N)c2nc3ccccc3o2)C1	ZINC000066516609	1292119591	/nfs/dbraw/zinc/11/95/91/1292119591.db2.gz	YFFRTJNRYOPVFP-KGLIPLIRSA-N	0	3	339.395	3.043	20	30		EGEDHN
CCOc1ccc(CCC(=O)C(C#N)C(=O)NC2CCCCC2)cc1	ZINC000066507614	1292119987	/nfs/dbraw/zinc/11/99/87/1292119987.db2.gz	XSVPHDRWGQOCFS-SFHVURJKSA-N	0	3	342.439	3.176	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cccc(OCCC(C)C)c2)CC1	ZINC000068363048	1292198555	/nfs/dbraw/zinc/19/85/55/1292198555.db2.gz	QHUBCEHMJYHCLS-UHFFFAOYSA-N	0	3	328.456	3.395	20	30		EGEDHN
N#Cc1ccc(F)c(C(=O)NC[C@H]2CCCN2Cc2ccccc2)c1	ZINC000827826614	1292383501	/nfs/dbraw/zinc/38/35/01/1292383501.db2.gz	JHTUOFYUIOBHAO-QGZVFWFLSA-N	0	3	337.398	3.092	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@](C)(NCc2ccc(C#N)c(F)c2)C1	ZINC000827970746	1292413343	/nfs/dbraw/zinc/41/33/43/1292413343.db2.gz	JSSFNNWKQFTWEC-SFHVURJKSA-N	0	3	333.407	3.186	20	30		EGEDHN
CCCOc1ccc(CCC(=O)C(C#N)C(=O)NC2CCCC2)cc1	ZINC000076838932	1292445876	/nfs/dbraw/zinc/44/58/76/1292445876.db2.gz	YNYDHANXVHPAFJ-GOSISDBHSA-N	0	3	342.439	3.176	20	30		EGEDHN
CN(C)C(=O)O[C@H]1CCN(Cc2ccc(-c3ccccc3C#N)cc2)C1	ZINC000830503855	1292725200	/nfs/dbraw/zinc/72/52/00/1292725200.db2.gz	AMCYJNXFXSHREW-IBGZPJMESA-N	0	3	349.434	3.498	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCc1cc(=O)oc2cc(CC)c(Cl)cc12	ZINC000831678866	1292905308	/nfs/dbraw/zinc/90/53/08/1292905308.db2.gz	JLVAOPPXPHYJAT-CVEARBPZSA-N	0	3	333.815	3.442	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)c1sc(C)nc1C	ZINC000104380531	1293021738	/nfs/dbraw/zinc/02/17/38/1293021738.db2.gz	QVWDEURHCUWPFS-GFCCVEGCSA-N	0	3	343.408	3.120	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)C[C@H]1CCc2ccccc21	ZINC000115904696	1293196692	/nfs/dbraw/zinc/19/66/92/1293196692.db2.gz	XVRFKPAWWMHLDP-WBVHZDCISA-N	0	3	348.402	3.463	20	30		EGEDHN
Cc1cc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)nn1C(C)C	ZINC000835062945	1293196773	/nfs/dbraw/zinc/19/67/73/1293196773.db2.gz	GTXOGONNYIDDFQ-GFCCVEGCSA-N	0	3	344.802	3.387	20	30		EGEDHN
CN(C)Cc1cccc(C(=O)O[C@@H](C#N)Cc2ccc(F)cc2F)c1	ZINC000835295441	1293255067	/nfs/dbraw/zinc/25/50/67/1293255067.db2.gz	OWVSCWCZRVAKBA-QGZVFWFLSA-N	0	3	344.361	3.318	20	30		EGEDHN
C[C@@H]1CCc2sc(C(=O)C(C#N)C(=O)Nc3ccccn3)cc2C1	ZINC000125110420	1293495791	/nfs/dbraw/zinc/49/57/91/1293495791.db2.gz	BLJHJEBADULXJU-YPMHNXCESA-N	0	3	339.420	3.229	20	30		EGEDHN
C=C(Br)CNC1CCC2(CC1)C(=O)Nc1ccccc12	ZINC000125141909	1293496450	/nfs/dbraw/zinc/49/64/50/1293496450.db2.gz	XYBWELDWSNYQRP-UHFFFAOYSA-N	0	3	335.245	3.317	20	30		EGEDHN
N#CC(C(=O)CCSc1ccc(F)cc1)C(=O)Nc1ccccn1	ZINC000125118661	1293496638	/nfs/dbraw/zinc/49/66/38/1293496638.db2.gz	ULVVLDPLNNMUGY-CQSZACIVSA-N	0	3	343.383	3.050	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000128360048	1293589928	/nfs/dbraw/zinc/58/99/28/1293589928.db2.gz	YVTRHGSXBPALKN-MRXNPFEDSA-N	0	3	337.335	3.118	20	30		EGEDHN
CC(C)Cc1ccc(C(=O)CCC(=O)C(C#N)C(=O)NC(C)C)cc1	ZINC000130998665	1293675503	/nfs/dbraw/zinc/67/55/03/1293675503.db2.gz	ABFRHSLJJFHLDJ-QGZVFWFLSA-N	0	3	342.439	3.081	20	30		EGEDHN
CC[C@H](C)OCC(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000152351336	1293965509	/nfs/dbraw/zinc/96/55/09/1293965509.db2.gz	RKLULJVBFVRTNC-ONGXEEELSA-N	0	3	343.210	3.456	20	30		EGEDHN
C[C@@H](Cc1ccccc1Cl)C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000155197042	1294088496	/nfs/dbraw/zinc/08/84/96/1294088496.db2.gz	DZOSORIYZSYKSE-JSGCOSHPSA-N	0	3	341.798	3.261	20	30		EGEDHN
C[C@H](CC(=O)C(C#N)C(=O)Nc1ccccn1)c1ccccc1F	ZINC000170673425	1294376033	/nfs/dbraw/zinc/37/60/33/1294376033.db2.gz	KGWCNTQRUOTMBJ-OCCSQVGLSA-N	0	3	325.343	3.062	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)C(=O)Nc1ccccn1)c1ccccc1F	ZINC000170673415	1294376607	/nfs/dbraw/zinc/37/66/07/1294376607.db2.gz	KGWCNTQRUOTMBJ-GXTWGEPZSA-N	0	3	325.343	3.062	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](O)c2cccc(C(F)(F)F)c2)s1	ZINC000176965839	1294646143	/nfs/dbraw/zinc/64/61/43/1294646143.db2.gz	DNQFVPPMRDPXRS-CQSZACIVSA-N	0	3	326.343	3.462	20	30		EGEDHN
CC[C@H](NC(C)=O)C(=O)C(C#N)c1nc2cc(Cl)ccc2s1	ZINC000870161093	1295711350	/nfs/dbraw/zinc/71/13/50/1295711350.db2.gz	WXDKMGOZBWZRBP-QWRGUYRKSA-N	0	3	335.816	3.041	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)C[C@@H]2CCCO2)cc1	ZINC000193451773	1295870357	/nfs/dbraw/zinc/87/03/57/1295870357.db2.gz	AYBGQSLYQGATBO-DLBZAZTESA-N	0	3	328.412	3.246	20	30		EGEDHN
C#C[C@@H](CC)NCc1cc(Br)c(OCC)c(OC)c1	ZINC000229885635	1296159616	/nfs/dbraw/zinc/15/96/16/1296159616.db2.gz	QTMPGJXDHIWNTJ-LBPRGKRZSA-N	0	3	326.234	3.358	20	30		EGEDHN
N#Cc1sc(N[C@@H]2[C@H]3CN(Cc4ccccc4)C[C@H]32)nc1Cl	ZINC000306690853	1297067368	/nfs/dbraw/zinc/06/73/68/1297067368.db2.gz	PUQPCRHEXLHTQV-IMRBUKKESA-N	0	3	330.844	3.210	20	30		EGEDHN
N#Cc1cc(F)c(NCCN2CCCCC2)cc1Br	ZINC000311414516	1297108476	/nfs/dbraw/zinc/10/84/76/1297108476.db2.gz	MHZDZHQFZHIZEZ-UHFFFAOYSA-N	0	3	326.213	3.358	20	30		EGEDHN
CC[C@@H](Cc1cccc(C)c1)C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000873499091	1297544829	/nfs/dbraw/zinc/54/48/29/1297544829.db2.gz	KVVUSGTVQBMHEW-IRXDYDNUSA-N	0	3	335.407	3.306	20	30		EGEDHN
C[C@@H]1CC[C@H](NCc2ccc(C#N)s2)CN1C(=O)OC(C)(C)C	ZINC000690966931	1298131884	/nfs/dbraw/zinc/13/18/84/1298131884.db2.gz	NGEPXZACOQOISR-OLZOCXBDSA-N	0	3	335.473	3.497	20	30		EGEDHN
C[C@H]1CCN(Cc2ccccc2)C[C@@H]1NC(=O)Cc1ccc(C#N)cc1	ZINC000716273165	1298295897	/nfs/dbraw/zinc/29/58/97/1298295897.db2.gz	UJKVPJBNGCEHLS-UWJYYQICSA-N	0	3	347.462	3.128	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cccc3c(Cl)c(C)cnc23)CC1	ZINC000875837463	1298493574	/nfs/dbraw/zinc/49/35/74/1298493574.db2.gz	CMPBVPSDMHTNNM-UHFFFAOYSA-N	0	3	341.842	3.480	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccccc2C#Cc2ccccc2)CC1	ZINC000746547470	1298610318	/nfs/dbraw/zinc/61/03/18/1298610318.db2.gz	MOBFJJCYPVNNGL-UHFFFAOYSA-N	0	3	342.442	3.370	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)[C@@H](C)c1ccc(Cl)c(Cl)c1	ZINC000747108829	1298727564	/nfs/dbraw/zinc/72/75/64/1298727564.db2.gz	KEZKOHMITNAONW-GXSJLCMTSA-N	0	3	327.211	3.330	20	30		EGEDHN
C=C(Cl)C[C@H](N)C(=O)N1CCC(OC2CCC(C)CC2)CC1	ZINC000876651571	1298898320	/nfs/dbraw/zinc/89/83/20/1298898320.db2.gz	GFDOOPVCOYDLAU-PXCJXSSVSA-N	0	3	328.884	3.043	20	30		EGEDHN
N#Cc1cccc(C2(NCc3ccc(N4CCC(O)CC4)cc3)CC2)c1	ZINC000877117036	1299164190	/nfs/dbraw/zinc/16/41/90/1299164190.db2.gz	ZSOLFBBWUMLVKH-UHFFFAOYSA-N	0	3	347.462	3.298	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(-c3ccc(CC)cc3)on2)CC1	ZINC000878750793	1300172683	/nfs/dbraw/zinc/17/26/83/1300172683.db2.gz	NPIYZDRMXYXDON-UHFFFAOYSA-N	0	3	339.439	3.284	20	30		EGEDHN
CC(=O)[C@](C#N)(CCN1CC[C@@H](c2cccnc2)C1)c1ccccc1	ZINC000878761180	1300178573	/nfs/dbraw/zinc/17/85/73/1300178573.db2.gz	UMOLNWNYXMNWHA-TZIWHRDSSA-N	0	3	333.435	3.312	20	30		EGEDHN
COC(=O)[C@@H](C)[C@H](NCc1ccc(OCC#N)cc1)c1ccccc1	ZINC000756893373	1300584045	/nfs/dbraw/zinc/58/40/45/1300584045.db2.gz	YDJAOXODYPGIFS-KXBFYZLASA-N	0	3	338.407	3.229	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)c1cc(Cl)cs1	ZINC000758074755	1300781009	/nfs/dbraw/zinc/78/10/09/1300781009.db2.gz	HADJEBUPALDASF-UHFFFAOYSA-N	0	3	347.871	3.477	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)C[C@H](OCC)C(C)C	ZINC000761038194	1301387522	/nfs/dbraw/zinc/38/75/22/1301387522.db2.gz	ROOVNDYMAIVVBX-KSSFIOAISA-N	0	3	346.427	3.184	20	30		EGEDHN
CSc1ccc([C@@H](CNc2cc(C#N)nc(C)n2)N(C)C)cc1	ZINC000882403734	1301950732	/nfs/dbraw/zinc/95/07/32/1301950732.db2.gz	AVVDMTQKRIRQFG-MRXNPFEDSA-N	0	3	327.457	3.093	20	30		EGEDHN
CN(CCCN(C)c1snc(Cl)c1C#N)Cc1ccncc1	ZINC000882520798	1302002051	/nfs/dbraw/zinc/00/20/51/1302002051.db2.gz	UWCMLYXRHOWQOK-UHFFFAOYSA-N	0	3	335.864	3.021	20	30		EGEDHN
C#CC[C@@H](CO)NCc1cc(Cl)c(OCCC)c(OCC)c1	ZINC000883123330	1302260843	/nfs/dbraw/zinc/26/08/43/1302260843.db2.gz	UTMXOAMBIXFNGL-AWEZNQCLSA-N	0	3	325.836	3.001	20	30		EGEDHN
C#CCOc1ccc(CN(C)CCOc2ccccc2OC)cc1	ZINC000768821550	1302987431	/nfs/dbraw/zinc/98/74/31/1302987431.db2.gz	BYZHIKFACGSFSF-UHFFFAOYSA-N	0	3	325.408	3.218	20	30		EGEDHN
C#CCCCCNC(=O)N[C@H](CN(C)Cc1ccccc1)C(C)C	ZINC000768948937	1303019544	/nfs/dbraw/zinc/01/95/44/1303019544.db2.gz	AKDKKJYQOCXEGH-LJQANCHMSA-N	0	3	329.488	3.246	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1C[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C1	ZINC000769883311	1303188122	/nfs/dbraw/zinc/18/81/22/1303188122.db2.gz	IUVLXQCQCUZZCT-PBHICJAKSA-N	0	3	329.444	3.212	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)CCCC(F)(F)F)c1	ZINC000771257564	1303382415	/nfs/dbraw/zinc/38/24/15/1303382415.db2.gz	BNYABJIOXMIJCD-GFCCVEGCSA-N	0	3	328.290	3.075	20	30		EGEDHN
C=CCC1(O)CCN(Cc2cc(=O)oc3cc(C)c(C)cc23)CC1	ZINC000886769051	1303591698	/nfs/dbraw/zinc/59/16/98/1303591698.db2.gz	OASFPRHWMUBDIM-UHFFFAOYSA-N	0	3	327.424	3.313	20	30		EGEDHN
C#CCCCCC(=O)NCC1(N2CCOC(C)(C)C2)CCCCC1	ZINC000773355885	1303667867	/nfs/dbraw/zinc/66/78/67/1303667867.db2.gz	JAHHKKIIBHWWOL-UHFFFAOYSA-N	0	3	334.504	3.110	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)CC[C@@H](C)SC	ZINC000773769709	1303737554	/nfs/dbraw/zinc/73/75/54/1303737554.db2.gz	KQMBZZYNLWZUOY-OLZOCXBDSA-N	0	3	334.441	3.264	20	30		EGEDHN
CN(CC(=O)C(C#N)c1nc2cc(F)ccc2s1)[C@@H]1CCSC1	ZINC000774073143	1303771593	/nfs/dbraw/zinc/77/15/93/1303771593.db2.gz	SCFOZKRNQSXMIW-VXGBXAGGSA-N	0	3	349.456	3.049	20	30		EGEDHN
C[C@H](NCc1ccc(F)c(C#N)c1)c1ccc(N2CCOCC2)cc1	ZINC000775255415	1303931086	/nfs/dbraw/zinc/93/10/86/1303931086.db2.gz	OVNXFSBWCGXVMX-HNNXBMFYSA-N	0	3	339.414	3.385	20	30		EGEDHN
C[C@@H](NCC(=O)N(C)C1(C#N)CCCCC1)c1ccc(N(C)C)cc1	ZINC000775836091	1304047687	/nfs/dbraw/zinc/04/76/87/1304047687.db2.gz	YVMHEPOGZDWBPK-MRXNPFEDSA-N	0	3	342.487	3.088	20	30		EGEDHN
C[C@@H](N[C@H]1CCN(C2CCCCC2)C1=O)c1ccc(OCC#N)cc1	ZINC000776168314	1304106131	/nfs/dbraw/zinc/10/61/31/1304106131.db2.gz	IOQRXLQUZBQFSF-BEFAXECRSA-N	0	3	341.455	3.173	20	30		EGEDHN
CN(C)c1ccncc1C=[NH+][N-]c1ccc(Br)cc1F	ZINC000776179812	1304107478	/nfs/dbraw/zinc/10/74/78/1304107478.db2.gz	FMDAIRDGWAZSBP-UHFFFAOYSA-N	0	3	337.196	3.495	20	30		EGEDHN
CN(C)c1ccncc1C=NNC(=S)Nc1cccc(Cl)c1	ZINC000776179032	1304107566	/nfs/dbraw/zinc/10/75/66/1304107566.db2.gz	KBQTXNNZCUFEHJ-UHFFFAOYSA-N	0	3	333.848	3.122	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N1CCC[C@H](C(=O)Nc2ccccn2)C1	ZINC000777711814	1304337371	/nfs/dbraw/zinc/33/73/71/1304337371.db2.gz	XYDGJOCIMJEIOU-YJBOKZPZSA-N	0	3	334.423	3.365	20	30		EGEDHN
COc1ccc(CN[C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)cc1C	ZINC000778545592	1304462840	/nfs/dbraw/zinc/46/28/40/1304462840.db2.gz	XPAONMQGOPRJCP-LJQANCHMSA-N	0	3	349.434	3.161	20	30		EGEDHN
C#C[C@H]([NH2+][C@@H](C)c1cc(Br)cc(C)c1[O-])[C@H]1CCCO1	ZINC000779052387	1304522590	/nfs/dbraw/zinc/52/25/90/1304522590.db2.gz	PKJMUEWJVGWLPG-TUKIKUTGSA-N	0	3	338.245	3.295	20	30		EGEDHN
N#CCC1CCN(CC(=O)C(C#N)c2nc3ccccc3s2)CC1	ZINC000782087466	1304913741	/nfs/dbraw/zinc/91/37/41/1304913741.db2.gz	FNVLYPYHVZTOFB-CQSZACIVSA-N	0	3	338.436	3.098	20	30		EGEDHN
C=CCS(=O)(=O)CCN[C@@H](CC)CSc1ccc(Cl)cc1	ZINC000783536895	1305105162	/nfs/dbraw/zinc/10/51/62/1305105162.db2.gz	QPCWMNUWIKPOKT-AWEZNQCLSA-N	0	3	347.933	3.401	20	30		EGEDHN
N#CCC[C@H](NC(=O)NC[C@@H]1Cc2ccccc2CN1)c1ccccc1	ZINC000891703675	1305139930	/nfs/dbraw/zinc/13/99/30/1305139930.db2.gz	DLXGCEQYNHYVBF-PMACEKPBSA-N	0	3	348.450	3.045	20	30		EGEDHN
C#CCOc1ccc(CN[C@H]2CCCN(C3CCCCC3)C2=O)cc1	ZINC000785549103	1305375790	/nfs/dbraw/zinc/37/57/90/1305375790.db2.gz	RZJBNUVLFLJPLI-FQEVSTJZSA-N	0	3	340.467	3.112	20	30		EGEDHN
CC(F)(F)CCC(=O)C(C#N)C(=O)NCc1cccc(Cl)c1	ZINC000786531658	1305591360	/nfs/dbraw/zinc/59/13/60/1305591360.db2.gz	SLQXFGGWZOHBHB-GFCCVEGCSA-N	0	3	328.746	3.100	20	30		EGEDHN
N#Cc1ccc(OC2CCC([NH2+]Cc3ccc([O-])c(F)c3)CC2)nc1	ZINC000893218700	1305767928	/nfs/dbraw/zinc/76/79/28/1305767928.db2.gz	CTTIEUKDJKRVME-UHFFFAOYSA-N	0	3	341.386	3.278	20	30		EGEDHN
N#CC(C(=O)c1ccc(-n2cccc2)nc1)c1cnc2ccccc2n1	ZINC000792111080	1309122329	/nfs/dbraw/zinc/12/23/29/1309122329.db2.gz	PXIJXYWUMZUAJV-OAHLLOKOSA-N	0	3	339.358	3.306	20	30		EGEDHN
COc1ccc(C2=NO[C@@H](CN[C@H](C)CC(C)(C)C#N)C2)cc1F	ZINC000895977433	1309624177	/nfs/dbraw/zinc/62/41/77/1309624177.db2.gz	NVYCRSCNOFARNY-TZMCWYRMSA-N	0	3	333.407	3.245	20	30		EGEDHN
CC(C)(C)S(=O)(=O)CCN[C@H]1CCCCc2cc(C#N)ccc21	ZINC000795803479	1309838067	/nfs/dbraw/zinc/83/80/67/1309838067.db2.gz	PYRZUUZIQNJSHG-KRWDZBQOSA-N	0	3	334.485	3.129	20	30		EGEDHN
C[C@@H]1C(=O)CC[C@H]1CC(=O)C(C#N)C(=O)Nc1cccc2ccccc21	ZINC000796633587	1310050776	/nfs/dbraw/zinc/05/07/76/1310050776.db2.gz	GAGUGQDAHAPBGC-JLJPHGGASA-N	0	3	348.402	3.492	20	30		EGEDHN
C#CCC[C@@H](O)CNc1c(C)c(C)nc2ccc(Br)cc21	ZINC000798419993	1310359799	/nfs/dbraw/zinc/35/97/99/1310359799.db2.gz	YDRHBKFFMJQIQT-CQSZACIVSA-N	0	3	347.256	3.222	20	30		EGEDHN
COC(=O)c1cc(CN2CCC(c3ccc(C#N)cc3)CC2)cn1C	ZINC000897588488	1310395681	/nfs/dbraw/zinc/39/56/81/1310395681.db2.gz	DHIYRQDHGLZVMQ-UHFFFAOYSA-N	0	3	337.423	3.063	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)[C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000798817313	1310445715	/nfs/dbraw/zinc/44/57/15/1310445715.db2.gz	WUEMBZBUAPXYOL-GWCFXTLKSA-N	0	3	326.318	3.042	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)CCCC2CCOCC2)c1	ZINC000798817544	1310445992	/nfs/dbraw/zinc/44/59/92/1310445992.db2.gz	ZUJWGQYEJSQMBN-KRWDZBQOSA-N	0	3	328.412	3.239	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)[C@@H]1CCCC(F)(F)C1	ZINC000800386489	1310747402	/nfs/dbraw/zinc/74/74/02/1310747402.db2.gz	KTIDHGVSKLUYPT-VXGBXAGGSA-N	0	3	336.338	3.168	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)[C@@H]2O[C@H](C)C[C@@H]2C)cc1	ZINC000800384767	1310747510	/nfs/dbraw/zinc/74/75/10/1310747510.db2.gz	JUXVBKNAIXGHSZ-FCZZECIWSA-N	0	3	342.439	3.490	20	30		EGEDHN
C=CCC[C@@H](NCCS(C)(=O)=O)c1ccc(C(F)(F)F)cc1	ZINC000839542887	1320934900	/nfs/dbraw/zinc/93/49/00/1320934900.db2.gz	GREWSUJMOTWVTJ-CQSZACIVSA-N	0	3	335.391	3.347	20	30		EGEDHN
Cc1cc(F)ccc1C(=O)N1CC[C@H](NCc2ccc(C#N)s2)C1	ZINC001019685501	1317332338	/nfs/dbraw/zinc/33/23/38/1317332338.db2.gz	GXGSADOWMFQWDA-AWEZNQCLSA-N	0	3	343.427	3.072	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC2(CCN(C/C(Cl)=C\Cl)CC2)CC1	ZINC000957520088	1317421229	/nfs/dbraw/zinc/42/12/29/1317421229.db2.gz	NXENMCVEYAYKMH-LFGHMXSPSA-N	0	3	344.286	3.170	20	30		EGEDHN
CCC(C)(CC)C(=O)N1CC[C@H](NCc2ccc(OC)c(C#N)c2)C1	ZINC001019794100	1317425013	/nfs/dbraw/zinc/42/50/13/1317425013.db2.gz	PGHMLYAMGVPMLE-KRWDZBQOSA-N	0	3	343.471	3.084	20	30		EGEDHN
CCC(=O)N1CCC(CN(CC)Cc2cc(C#N)ccc2F)CC1	ZINC000957656443	1317527197	/nfs/dbraw/zinc/52/71/97/1317527197.db2.gz	FFYINQVPMDIBJP-UHFFFAOYSA-N	0	3	331.435	3.168	20	30		EGEDHN
CCN(Cc1ccccc1C#N)CC1CCN(C(=O)[C@H]2C[C@@H]2C)CC1	ZINC000957670484	1317541953	/nfs/dbraw/zinc/54/19/53/1317541953.db2.gz	UWNYFCGNOPLQKI-JXFKEZNVSA-N	0	3	339.483	3.275	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2coc3c2cccc3OC)C1	ZINC001020161675	1317569245	/nfs/dbraw/zinc/56/92/45/1317569245.db2.gz	LGWRTMQQCIRDGW-HAQNSBGRSA-N	0	3	334.803	3.044	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)[C@@H]2CCC(C)=C(C)C2)C1	ZINC001020189468	1317584788	/nfs/dbraw/zinc/58/47/88/1317584788.db2.gz	ZSBCOSYQTQQORN-RBSFLKMASA-N	0	3	341.293	3.268	20	30		EGEDHN
CC[C@H]1CCC1=NNC(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000807949072	1317603733	/nfs/dbraw/zinc/60/37/33/1317603733.db2.gz	UYRZFSVWKWSAER-INIZCTEOSA-N	0	3	344.528	3.291	20	30		EGEDHN
CC[C@H](NCc1ccc(N2CCOCC2)nc1)c1cccc(C#N)c1	ZINC000902735668	1317610810	/nfs/dbraw/zinc/61/08/10/1317610810.db2.gz	HSLDFKBAMREBNQ-IBGZPJMESA-N	0	3	336.439	3.031	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@H](NC(=O)C34CCC(CC3)C4)C2)c(F)c1	ZINC001020298811	1317634398	/nfs/dbraw/zinc/63/43/98/1317634398.db2.gz	XWDPQFXSUFTLSQ-IAVKICJISA-N	0	3	341.430	3.014	20	30		EGEDHN
C#C[C@@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)C(C)(C)C	ZINC000808316680	1317660907	/nfs/dbraw/zinc/66/09/07/1317660907.db2.gz	VZZMTMWMOMTNBE-ZWKOTPCHSA-N	0	3	327.472	3.171	20	30		EGEDHN
CC1(C(=O)N[C@H]2C[C@H](NCc3ccc(C#N)cc3F)C2)CCCC1	ZINC001020445098	1317701166	/nfs/dbraw/zinc/70/11/66/1317701166.db2.gz	BVBWHGADYJQFOE-WKILWMFISA-N	0	3	329.419	3.014	20	30		EGEDHN
C[C@@H]1CC[C@H](CC(=O)N[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)C1	ZINC001020482433	1317716307	/nfs/dbraw/zinc/71/63/07/1317716307.db2.gz	FQXYWGZZLSOJTI-LTCOOKNTSA-N	0	3	343.446	3.260	20	30		EGEDHN
C[C@H]1CCCC[C@@H]1C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001020525912	1317746245	/nfs/dbraw/zinc/74/62/45/1317746245.db2.gz	NHRIOOLMCJNISU-MGHWNKPDSA-N	0	3	343.446	3.260	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)c2cnc(C(C)(C)C)nc2)c1	ZINC000808979848	1317756248	/nfs/dbraw/zinc/75/62/48/1317756248.db2.gz	NUHMRIWHUVGOEA-OAHLLOKOSA-N	0	3	336.395	3.044	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@H](NCc3c(C)onc3CC)C2)CC1	ZINC001020544044	1317757192	/nfs/dbraw/zinc/75/71/92/1317757192.db2.gz	HEIOCVHDJIIMAM-WKILWMFISA-N	0	3	331.460	3.029	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc(F)c(Cl)c2F)C1	ZINC001020545144	1317759524	/nfs/dbraw/zinc/75/95/24/1317759524.db2.gz	OOKGXOABAIDGTQ-KYZUINATSA-N	0	3	335.181	3.221	20	30		EGEDHN
CC[C@H]1CCC[C@H]1C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001020554094	1317765997	/nfs/dbraw/zinc/76/59/97/1317765997.db2.gz	KTTKABXABKQFDC-LEUOFYLZSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@H](NCc3oc(C(C)C)nc3C)C2)C1	ZINC001020562596	1317774210	/nfs/dbraw/zinc/77/42/10/1317774210.db2.gz	GFCFDAARPUSNMI-SHTZXODSSA-N	0	3	331.460	3.200	20	30		EGEDHN
C=C(C)COc1cc(/C=C2\C(=O)c3ncnn3C2C)ccc1OC	ZINC000905080475	1317920806	/nfs/dbraw/zinc/92/08/06/1317920806.db2.gz	LFBINHWQHZGSTK-AISSWFOISA-N	0	3	325.368	3.083	20	30		EGEDHN
N#Cc1sccc1C(=O)NC[C@H](c1ccccc1)N1CCCC1	ZINC000905395555	1317953891	/nfs/dbraw/zinc/95/38/91/1317953891.db2.gz	OHWUSRYBATXCLZ-MRXNPFEDSA-N	0	3	325.437	3.187	20	30		EGEDHN
N#Cc1sccc1C(=O)NC[C@@H](c1ccccc1)N1CCCC1	ZINC000905395554	1317954034	/nfs/dbraw/zinc/95/40/34/1317954034.db2.gz	OHWUSRYBATXCLZ-INIZCTEOSA-N	0	3	325.437	3.187	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc(C)nc3ccccc32)C1	ZINC001021011511	1318043756	/nfs/dbraw/zinc/04/37/56/1318043756.db2.gz	ZCIJATOQXZPEOI-HDJSIYSDSA-N	0	3	329.831	3.146	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1cccc(-c2nc(C)c(C)o2)c1	ZINC000929930573	1328740777	/nfs/dbraw/zinc/74/07/77/1328740777.db2.gz	XJYQZBWWYYKYKL-UHFFFAOYSA-N	0	3	340.427	3.035	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)Cc2ccc3ccccc3c2)C1	ZINC001021030913	1318053973	/nfs/dbraw/zinc/05/39/73/1318053973.db2.gz	ZIWLITRRBACWOU-IYARVYRRSA-N	0	3	328.843	3.372	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2sc(C(C)C)nc2C)C1	ZINC001021051279	1318059928	/nfs/dbraw/zinc/05/99/28/1318059928.db2.gz	HDAHCHQUKHPTCH-HAQNSBGRSA-N	0	3	327.881	3.178	20	30		EGEDHN
CC[C@@H](C#N)Oc1cccc(CNC(=O)C(C)(C)N2CCCCC2)c1	ZINC000906696733	1318137742	/nfs/dbraw/zinc/13/77/42/1318137742.db2.gz	IPVNDEJDGQZMSP-KRWDZBQOSA-N	0	3	343.471	3.248	20	30		EGEDHN
C[C@@H](C(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1cccc(C#N)c1)C1CC1	ZINC001021222299	1318147624	/nfs/dbraw/zinc/14/76/24/1318147624.db2.gz	ZYDYJRCMZJYVLZ-PHHCVGHBSA-N	0	3	337.467	3.216	20	30		EGEDHN
C=CCn1cccc1C(=O)NC1C[C@H]2CC[C@@H](C1)N2C[C@@H](F)CC	ZINC001021281667	1318170791	/nfs/dbraw/zinc/17/07/91/1318170791.db2.gz	LUGRXIDEQSXTFW-XYTVBORESA-N	0	3	333.451	3.147	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCCC[C@H]1CNCc1sccc1Cl	ZINC000959924381	1318268476	/nfs/dbraw/zinc/26/84/76/1318268476.db2.gz	KCZRRODHMJWOMD-NEPJUHHUSA-N	0	3	325.865	3.032	20	30		EGEDHN
C=CCc1cc(OC)cc(CN2CC[C@@H](n3cc(Cl)cn3)C2)c1O	ZINC000811802070	1318269032	/nfs/dbraw/zinc/26/90/32/1318269032.db2.gz	RPMPGWNTNLRHCN-MRXNPFEDSA-N	0	3	347.846	3.426	20	30		EGEDHN
C#C[C@H](C)N(C)C(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1	ZINC000811993224	1318303744	/nfs/dbraw/zinc/30/37/44/1318303744.db2.gz	SOJAWNUQEAFMAS-HOTGVXAUSA-N	0	3	333.501	3.184	20	30		EGEDHN
CN(CCCCC1(C#N)CCC1)[C@@H]1CCCC[C@@H]1S(C)(=O)=O	ZINC000930000032	1328761388	/nfs/dbraw/zinc/76/13/88/1328761388.db2.gz	LUQCARNVQMIMEG-CVEARBPZSA-N	0	3	326.506	3.138	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC[C@@H]2CN(Cc3cccc(C#N)c3)CC[C@H]21	ZINC001021552498	1318394419	/nfs/dbraw/zinc/39/44/19/1318394419.db2.gz	BLOXXIKHKYNIQP-PSTDOWKUSA-N	0	3	337.467	3.337	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@H]1CCC(F)(F)C1	ZINC000960271631	1318437591	/nfs/dbraw/zinc/43/75/91/1318437591.db2.gz	RISYHGHANXRWHY-USXIJHARSA-N	0	3	334.410	3.370	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cccc(Cl)c2C)C1	ZINC001021594924	1318439157	/nfs/dbraw/zinc/43/91/57/1318439157.db2.gz	RPLMZRABXYATFM-YJBOKZPZSA-N	0	3	330.859	3.208	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(C(C)C)nc2)C1	ZINC001021602781	1318447450	/nfs/dbraw/zinc/44/74/50/1318447450.db2.gz	JBIPFACEMPRBDN-UYAOXDASSA-N	0	3	339.483	3.155	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)Cc1cccc(Cl)c1	ZINC000960300613	1318450444	/nfs/dbraw/zinc/45/04/44/1318450444.db2.gz	XLWKVFQTDMCKSP-UYAOXDASSA-N	0	3	340.854	3.440	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc[nH]c1C1CCC1	ZINC000960308196	1318453137	/nfs/dbraw/zinc/45/31/37/1318453137.db2.gz	QJJPGUCSOGAVBF-UYAOXDASSA-N	0	3	335.451	3.454	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1nccc2[nH]ccc21	ZINC000960309960	1318454744	/nfs/dbraw/zinc/45/47/44/1318454744.db2.gz	YJLMHGGYYBYMNU-RTBURBONSA-N	0	3	346.434	3.124	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2oc(C(F)F)cc2C)C1	ZINC001021609218	1318456592	/nfs/dbraw/zinc/45/65/92/1318456592.db2.gz	XBMWJHPDKDLIMO-KBPBESRZSA-N	0	3	336.382	3.085	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cccc2ccncc21	ZINC000960319113	1318460402	/nfs/dbraw/zinc/46/04/02/1318460402.db2.gz	XYHWNJRPUJEGSD-NHCUHLMSSA-N	0	3	343.430	3.406	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1oc(CC)nc1C	ZINC000960324716	1318461390	/nfs/dbraw/zinc/46/13/90/1318461390.db2.gz	PQDSLDQEUKAJNQ-SJLPKXTDSA-N	0	3	339.439	3.107	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cccc2c1CCC2	ZINC000960332944	1318466139	/nfs/dbraw/zinc/46/61/39/1318466139.db2.gz	JFIFXFJMILZIBW-NHCUHLMSSA-N	0	3	332.447	3.347	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cccc(-n3cccc3)c2)C1	ZINC001021627071	1318478634	/nfs/dbraw/zinc/47/86/34/1318478634.db2.gz	LBPBQUSMIVNPEI-FPOVZHCZSA-N	0	3	347.462	3.037	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cccc3ncccc32)C1	ZINC001021644983	1318501829	/nfs/dbraw/zinc/50/18/29/1318501829.db2.gz	JUFBXNPAGPEALX-DYESRHJHSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc3c(ccc(C)c3C)[nH]2)C1	ZINC001021651761	1318511875	/nfs/dbraw/zinc/51/18/75/1318511875.db2.gz	FOGXHENDPNDKPF-UTKZUKDTSA-N	0	3	349.478	3.344	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2csc(C(C)(C)C)n2)C1	ZINC001021689744	1318564937	/nfs/dbraw/zinc/56/49/37/1318564937.db2.gz	ZRWFLEFIZJTYHC-HOCLYGCPSA-N	0	3	345.512	3.000	20	30		EGEDHN
C[C@](C#N)(NC(=O)C1C[C@@H](c2ccccc2)OC1=O)C1CCCCC1	ZINC000813453384	1318567369	/nfs/dbraw/zinc/56/73/69/1318567369.db2.gz	IVYDLTGICYJDKF-FUHIMQAGSA-N	0	3	340.423	3.270	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(C3CC3)s2)C1	ZINC001021712935	1318590197	/nfs/dbraw/zinc/59/01/97/1318590197.db2.gz	BRNXKOMQRAWPHH-JKSUJKDBSA-N	0	3	328.481	3.185	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccsc2C(F)F)C1	ZINC001021724930	1318616950	/nfs/dbraw/zinc/61/69/50/1318616950.db2.gz	PJDIFAXHOOFYKK-JSGCOSHPSA-N	0	3	338.423	3.245	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc3ccccc3n2CC)C1	ZINC001021738873	1318646590	/nfs/dbraw/zinc/64/65/90/1318646590.db2.gz	CQAHKRWJUQBUAV-ICSRJNTNSA-N	0	3	349.478	3.221	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(Cl)cn2CC)C1	ZINC001021738845	1318647054	/nfs/dbraw/zinc/64/70/54/1318647054.db2.gz	CKPOJYZSRLMSHF-NVXWUHKLSA-N	0	3	347.890	3.111	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)[C@@H]1CC1(C)C	ZINC000960564965	1318697386	/nfs/dbraw/zinc/69/73/86/1318697386.db2.gz	RRFUUELTNRXPDE-ROUUACIJSA-N	0	3	325.456	3.027	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)Cc1ccccc1	ZINC000960704819	1318807810	/nfs/dbraw/zinc/80/78/10/1318807810.db2.gz	SZJVFYSNWMKQLB-NRFANRHFSA-N	0	3	347.462	3.224	20	30		EGEDHN
CC(N=Nc1ccnc2ccccc12)c1cccc(-n2cnnc2)c1	ZINC000814841273	1318829748	/nfs/dbraw/zinc/82/97/48/1318829748.db2.gz	JPIWSCCUCFKIEM-UHFFFAOYSA-N	0	3	328.379	3.074	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)C(C)(C)C2CCCC2)C1	ZINC001022212279	1318846263	/nfs/dbraw/zinc/84/62/63/1318846263.db2.gz	WDQJWBWJOSLEMX-OKILXGFUSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N1CCC[C@@H]1c1ccc(OC)c(OC)c1	ZINC000912197119	1318846490	/nfs/dbraw/zinc/84/64/90/1318846490.db2.gz	PFULFSPXFLEHQA-JKSUJKDBSA-N	0	3	332.444	3.051	20	30		EGEDHN
CCN(C)c1ccc(CN2CC[C@@H](Oc3ccc(C#N)cn3)C2)cc1	ZINC000815120111	1318899415	/nfs/dbraw/zinc/89/94/15/1318899415.db2.gz	AYKLRVOZSIUFJW-LJQANCHMSA-N	0	3	336.439	3.063	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@H]2CN(C)C[C@@H]2CCCCO2)CC1	ZINC000960827453	1318952298	/nfs/dbraw/zinc/95/22/98/1318952298.db2.gz	BMFJGSNTZDKOIB-OALUTQOASA-N	0	3	334.504	3.225	20	30		EGEDHN
C[C@H]1CCN(Cc2ccccc2)C[C@@H]1NC(=O)CCCCCC#N	ZINC000913096035	1318971368	/nfs/dbraw/zinc/97/13/68/1318971368.db2.gz	BKBLTUSEAKYJHL-HKUYNNGSSA-N	0	3	327.472	3.487	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@H]2CN(C)Cc2ccc(C#N)cc2)CC1	ZINC000960843782	1318981011	/nfs/dbraw/zinc/98/10/11/1318981011.db2.gz	KFQXPNGMXMBRJI-SFHVURJKSA-N	0	3	325.456	3.171	20	30		EGEDHN
CC(C)C1(C(=O)N2CCC[C@@H]2CN(C)Cc2ccc(C#N)cc2)CC1	ZINC000960845864	1318982006	/nfs/dbraw/zinc/98/20/06/1318982006.db2.gz	HJDPKSFQURAXMW-LJQANCHMSA-N	0	3	339.483	3.417	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N1CCC[C@H]1CN(C)Cc1ccc(C#N)cc1	ZINC000960847555	1318985109	/nfs/dbraw/zinc/98/51/09/1318985109.db2.gz	PRCYRKKDBWGTMJ-HSALFYBXSA-N	0	3	339.483	3.417	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)C1CC2(CC2)C1	ZINC000960853371	1318997011	/nfs/dbraw/zinc/99/70/11/1318997011.db2.gz	RQWKKGCPSOENJE-LJQANCHMSA-N	0	3	337.467	3.171	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@@H]1CN(C)Cc1ccc(C#N)cc1)C(C)(F)F	ZINC000960870841	1319014099	/nfs/dbraw/zinc/01/40/99/1319014099.db2.gz	UEDTXCBJAUVWMF-WMLDXEAASA-N	0	3	349.425	3.272	20	30		EGEDHN
C[C@H]1CCC[C@H](C(=O)N[C@H]2C[C@@H](NCc3cc(C#N)ccc3F)C2)C1	ZINC001022623946	1319025513	/nfs/dbraw/zinc/02/55/13/1319025513.db2.gz	ZWHVWUDSXXDKIT-QXRTWZOPSA-N	0	3	343.446	3.260	20	30		EGEDHN
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001022667283	1319057704	/nfs/dbraw/zinc/05/77/04/1319057704.db2.gz	XGFQJNNEQUEYSD-PJKMLTEKSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)Cc2cccc3sccc32)C1	ZINC001022810430	1319121388	/nfs/dbraw/zinc/12/13/88/1319121388.db2.gz	UFRVYIZHUIIFEK-OKILXGFUSA-N	0	3	334.872	3.433	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccccc2OCC(C)C)C1	ZINC001022862917	1319142860	/nfs/dbraw/zinc/14/28/60/1319142860.db2.gz	ONVKFWYCGNUNPH-GASCZTMLSA-N	0	3	336.863	3.324	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC001023054175	1319241484	/nfs/dbraw/zinc/24/14/84/1319241484.db2.gz	YNGWTKGXGUACDD-BETUJISGSA-N	0	3	349.228	3.192	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)[C@]2(C)CC=C(C)CC2)C1	ZINC001023117397	1319267131	/nfs/dbraw/zinc/26/71/31/1319267131.db2.gz	SPUKYMLMAZHGRK-IJEWVQPXSA-N	0	3	341.293	3.268	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)C2CC(C(C)(C)C)C2)C1	ZINC001023147362	1319293899	/nfs/dbraw/zinc/29/38/99/1319293899.db2.gz	LUFCHLIQCBISNG-LLZFXZEUSA-N	0	3	343.309	3.204	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc(C(C)(F)F)cc2)C1	ZINC001023180866	1319310100	/nfs/dbraw/zinc/31/01/00/1319310100.db2.gz	SGXWBOOVODACGE-OKILXGFUSA-N	0	3	328.790	3.401	20	30		EGEDHN
C[NH+](C)C1CCC(/N=C/c2cc(Br)ccc2[O-])CC1	ZINC000817708139	1319426470	/nfs/dbraw/zinc/42/64/70/1319426470.db2.gz	UMYAFIMDUPYCNM-LICLKQGHSA-N	0	3	325.250	3.446	20	30		EGEDHN
Cc1cc(C(=O)NC[C@H]2CCCN(Cc3ccc(C#N)cc3)C2)co1	ZINC001023323305	1319447265	/nfs/dbraw/zinc/44/72/65/1319447265.db2.gz	IBLIQNXEUDBJLA-GOSISDBHSA-N	0	3	337.423	3.102	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](C2CCN(C(=O)c3cc[nH]c3)CC2)C1	ZINC000961373764	1319529799	/nfs/dbraw/zinc/52/97/99/1319529799.db2.gz	OLLHOGCGNLYEKU-QGZVFWFLSA-N	0	3	335.879	3.331	20	30		EGEDHN
C#CCN1CCC[C@@H](CNC(=O)c2ccccc2CC(C)(C)C)C1	ZINC001023437371	1319530567	/nfs/dbraw/zinc/53/05/67/1319530567.db2.gz	AEXDTBFSIMMOER-KRWDZBQOSA-N	0	3	326.484	3.350	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cccc3ccc(C)nc32)C1	ZINC001023440579	1319535904	/nfs/dbraw/zinc/53/59/04/1319535904.db2.gz	IZADCDIEGVRXOM-KRWDZBQOSA-N	0	3	335.451	3.008	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc(C)nn2C(CC)CC)C1	ZINC001023451075	1319553819	/nfs/dbraw/zinc/55/38/19/1319553819.db2.gz	DXMKFHNGBFCHAU-QGZVFWFLSA-N	0	3	344.503	3.018	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](C2CCN(C(=O)[C@H](F)CC)CC2)C1	ZINC000961400381	1319555616	/nfs/dbraw/zinc/55/56/16/1319555616.db2.gz	IZGLJCMPIXFLKI-HZPDHXFCSA-N	0	3	330.875	3.438	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1cccc(OCc2cccs2)c1	ZINC000818596041	1319566099	/nfs/dbraw/zinc/56/60/99/1319566099.db2.gz	ZNMOLKYAGGQNDA-UHFFFAOYSA-N	0	3	342.464	3.012	20	30		EGEDHN
C#CCN(C)CCCNC(=O)C1(c2ccc(F)cc2)CCCCC1	ZINC000818609377	1319570568	/nfs/dbraw/zinc/57/05/68/1319570568.db2.gz	SBHOUTBEQLYPHE-UHFFFAOYSA-N	0	3	330.447	3.099	20	30		EGEDHN
N#Cc1ccc(F)c(CNCC2CC(NC(=O)c3cccs3)C2)c1	ZINC000961501837	1319620443	/nfs/dbraw/zinc/62/04/43/1319620443.db2.gz	AQBHXIRTDJVFQU-UHFFFAOYSA-N	0	3	343.427	3.057	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)c1cc2c3ccccc3n(C)c2s1	ZINC000916946693	1319727266	/nfs/dbraw/zinc/72/72/66/1319727266.db2.gz	FYKLIVJESXWWJP-ZDUSSCGKSA-N	0	3	339.420	3.240	20	30		EGEDHN
C=CCN(Cc1ccccc1)C[C@@H](O)c1cc(OC)ccc1OC	ZINC000917001400	1319734537	/nfs/dbraw/zinc/73/45/37/1319734537.db2.gz	QDMRUTYHKABAET-LJQANCHMSA-N	0	3	327.424	3.425	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@H](CNC(=O)[C@@H]3CC34CCC4)C2)c1	ZINC001023620464	1319738622	/nfs/dbraw/zinc/73/86/22/1319738622.db2.gz	VFDWSYGNAGHUHP-OALUTQOASA-N	0	3	337.467	3.077	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2)C1	ZINC001023637148	1319757941	/nfs/dbraw/zinc/75/79/41/1319757941.db2.gz	FGXSVXQFNGHVIR-ZYSHUDEJSA-N	0	3	344.886	3.295	20	30		EGEDHN
C=CCn1c(COc2ccccc2)nnc1SC[C@@H]1CCCN1C	ZINC000917241857	1319774284	/nfs/dbraw/zinc/77/42/84/1319774284.db2.gz	GLZJEHXGDZWGLC-HNNXBMFYSA-N	0	3	344.484	3.229	20	30		EGEDHN
C=CCOc1ccc(-c2nnc(SC[C@@H]3CCCN3C)o2)cc1	ZINC000917307510	1319784233	/nfs/dbraw/zinc/78/42/33/1319784233.db2.gz	ITTLLFMKALVJNR-AWEZNQCLSA-N	0	3	331.441	3.488	20	30		EGEDHN
N#Cc1ccccc1CNCC1CC(NC(=O)C2(C3CC3)CCC2)C1	ZINC000962132096	1319831402	/nfs/dbraw/zinc/83/14/02/1319831402.db2.gz	UQIRRCIUHDXWAA-UHFFFAOYSA-N	0	3	337.467	3.123	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccsc2C(F)F)C1	ZINC001023727993	1319866450	/nfs/dbraw/zinc/86/64/50/1319866450.db2.gz	XKYDAXJPNIKOEQ-GFCCVEGCSA-N	0	3	326.412	3.151	20	30		EGEDHN
C=C1CC(C)(C(=O)NC2CC(CNCc3cc(C#N)ccc3F)C2)C1	ZINC000962284649	1319901053	/nfs/dbraw/zinc/90/10/53/1319901053.db2.gz	YWIQIUKFOIUVFO-UHFFFAOYSA-N	0	3	341.430	3.038	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)[C@H]2CCCCc3ccccc32)C1	ZINC001023764340	1319910785	/nfs/dbraw/zinc/91/07/85/1319910785.db2.gz	BAVAHLBLYDFSPJ-NQIIRXRSSA-N	0	3	338.495	3.348	20	30		EGEDHN
N#CCOc1ccc(CNCc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000822284673	1320067976	/nfs/dbraw/zinc/06/79/76/1320067976.db2.gz	UIYVGMIHKGSECL-UHFFFAOYSA-N	0	3	349.434	3.115	20	30		EGEDHN
CN1CCC(N(Cc2ccccc2)C(=O)C#Cc2cccs2)CC1	ZINC000826890206	1320412069	/nfs/dbraw/zinc/41/20/69/1320412069.db2.gz	JQWSOKNIFNNGKL-UHFFFAOYSA-N	0	3	338.476	3.223	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N(C)Cc1ccc(Cl)cc1Cl	ZINC000836487349	1320493690	/nfs/dbraw/zinc/49/36/90/1320493690.db2.gz	NGUKHTOWGRFIBS-UHFFFAOYSA-N	0	3	342.270	3.090	20	30		EGEDHN
C#CCN(C)CCCNC(=S)Nc1ccc(Cl)c(Cl)c1	ZINC000840757343	1321141836	/nfs/dbraw/zinc/14/18/36/1321141836.db2.gz	HMJUEFSBZSWYON-UHFFFAOYSA-N	0	3	330.284	3.235	20	30		EGEDHN
C[C@@H](N[C@@H]1CCc2ccc(C#N)cc21)c1ccc(N2CCNC2=O)cc1	ZINC000842903416	1321448707	/nfs/dbraw/zinc/44/87/07/1321448707.db2.gz	ROZSCEYZBBHYQX-JLTOFOAXSA-N	0	3	346.434	3.426	20	30		EGEDHN
C/C(=C\c1ccco1)C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000846822277	1321813076	/nfs/dbraw/zinc/81/30/76/1321813076.db2.gz	XRAHANZXQSBDFJ-DTQAZKPQSA-N	0	3	337.423	3.145	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CNC[C@@H](OC2CCCC2)C(F)(F)F)cc1	ZINC000849328835	1322113028	/nfs/dbraw/zinc/11/30/28/1322113028.db2.gz	QRBHLOFNSMGWLP-JKSUJKDBSA-N	0	3	342.361	3.071	20	30		EGEDHN
CN1CCC(NC(=S)Nc2cccc(C#Cc3ccccc3)c2)CC1	ZINC000920308452	1322162128	/nfs/dbraw/zinc/16/21/28/1322162128.db2.gz	OOYIKLADNYOQED-UHFFFAOYSA-N	0	3	349.503	3.467	20	30		EGEDHN
C=CCCOCC(=O)C(C#N)C(=O)Nc1c(CC)cccc1CC	ZINC000920789790	1322222930	/nfs/dbraw/zinc/22/29/30/1322222930.db2.gz	FHWLLPBGQUBVOY-INIZCTEOSA-N	0	3	328.412	3.051	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@@H]1C[C@H]1c1ccc(OC)cc1	ZINC000850753213	1322284699	/nfs/dbraw/zinc/28/46/99/1322284699.db2.gz	ZXKWWMLZAGPOAZ-RCCFBDPRSA-N	0	3	342.439	3.204	20	30		EGEDHN
N#Cc1ccc(Br)c(CN[C@@H]2CCO[C@H](C3CC3)C2)c1	ZINC000921999699	1322437423	/nfs/dbraw/zinc/43/74/23/1322437423.db2.gz	GPOXDCCDMHTCTA-ZBFHGGJFSA-N	0	3	335.245	3.368	20	30		EGEDHN
CC1CC(C(=O)N2CCC[C@@H](CNCc3cc(F)ccc3C#N)C2)C1	ZINC001023926401	1323031911	/nfs/dbraw/zinc/03/19/11/1323031911.db2.gz	GNPQXDSCGACMNO-CKDBGZEDSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](CNCc2oc(CC)nc2C)C1	ZINC001024094331	1323125265	/nfs/dbraw/zinc/12/52/65/1323125265.db2.gz	IZIJDJGHUQULGI-HNNXBMFYSA-N	0	3	333.476	3.086	20	30		EGEDHN
C[C@]1(C(=O)N2CCC[C@H](CNCc3ccccc3C#N)C2)C=CCC1	ZINC001024105315	1323137366	/nfs/dbraw/zinc/13/73/66/1323137366.db2.gz	IBGAWKYUEJRHKJ-UTKZUKDTSA-N	0	3	337.467	3.243	20	30		EGEDHN
C[C@@]1(C(=O)N2CCC[C@H](CNCc3ccccc3C#N)C2)C=CCC1	ZINC001024105313	1323137925	/nfs/dbraw/zinc/13/79/25/1323137925.db2.gz	IBGAWKYUEJRHKJ-DYESRHJHSA-N	0	3	337.467	3.243	20	30		EGEDHN
CC1(C)CC[C@H]1C(=O)N1CCC[C@@H](CNCc2ccccc2C#N)C1	ZINC001024111226	1323143817	/nfs/dbraw/zinc/14/38/17/1323143817.db2.gz	IVMKWWKKFZHWQW-LPHOPBHVSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)c2ccccc2O)C1	ZINC000963252414	1323263237	/nfs/dbraw/zinc/26/32/37/1323263237.db2.gz	VJJYMBHVEMIEKW-WBVHZDCISA-N	0	3	348.874	3.461	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)c2ccc(C)nc2)C1	ZINC000963260338	1323272203	/nfs/dbraw/zinc/27/22/03/1323272203.db2.gz	SRGUBAFOLYZWPJ-ZWKOTPCHSA-N	0	3	347.890	3.459	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cn(C(C)(C)C)nc1C	ZINC001024436178	1323396034	/nfs/dbraw/zinc/39/60/34/1323396034.db2.gz	ABKLMQBAZDZVEA-INIZCTEOSA-N	0	3	332.492	3.107	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@@H]1COc2ccc(Cl)cc21	ZINC001024555816	1323495316	/nfs/dbraw/zinc/49/53/16/1323495316.db2.gz	ZPJNOGRJXUZFQX-NVXWUHKLSA-N	0	3	348.874	3.363	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccc(C)nc1C1CC1	ZINC001024574981	1323511507	/nfs/dbraw/zinc/51/15/07/1323511507.db2.gz	GKVSUKRMMPQWDJ-QGZVFWFLSA-N	0	3	327.472	3.428	20	30		EGEDHN
C=C(C)CCN1CCCC[C@H]1CNC(=O)c1ocnc1C(F)(F)F	ZINC001024576356	1323512453	/nfs/dbraw/zinc/51/24/53/1323512453.db2.gz	RHTZUUYJIVAHGC-LBPRGKRZSA-N	0	3	345.365	3.244	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@H]1COc2cc(C)c(C)cc21	ZINC001024576260	1323512701	/nfs/dbraw/zinc/51/27/01/1323512701.db2.gz	QHGOPPRCOOOFOI-HKUYNNGSSA-N	0	3	342.483	3.326	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)NC[C@H]1CCCCN1Cc1cccc(C)c1	ZINC001024659538	1323575976	/nfs/dbraw/zinc/57/59/76/1323575976.db2.gz	FBYWLIBPRNGRSA-AQNXPRMDSA-N	0	3	342.483	3.057	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccc(O[C@H](C)CC)cc1	ZINC001024750054	1323652491	/nfs/dbraw/zinc/65/24/91/1323652491.db2.gz	KPKMEBHEERFGBV-IEBWSBKVSA-N	0	3	342.483	3.472	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccc(OC)c(OCC)c1	ZINC001024790519	1323696183	/nfs/dbraw/zinc/69/61/83/1323696183.db2.gz	KKWXOSQNSMZBAE-KRWDZBQOSA-N	0	3	346.471	3.254	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccc(F)c2occc21	ZINC001024807357	1323710947	/nfs/dbraw/zinc/71/09/47/1323710947.db2.gz	BPEVSFWSKHOWEY-CQSZACIVSA-N	0	3	328.387	3.180	20	30		EGEDHN
N#Cc1cccc(C[NH2+]C[C@H]2CCCCN2C(=O)c2ccccc2[O-])c1	ZINC001024875606	1323761334	/nfs/dbraw/zinc/76/13/34/1323761334.db2.gz	BCAOXNUWYFQQFI-GOSISDBHSA-N	0	3	349.434	3.048	20	30		EGEDHN
CC1CC(C(=O)N2CCCC[C@@H]2CNCc2ccc(C#N)s2)C1	ZINC001024920983	1323783726	/nfs/dbraw/zinc/78/37/26/1323783726.db2.gz	AMVPNPUHUJXHAH-YMAMQOFZSA-N	0	3	331.485	3.137	20	30		EGEDHN
C[C@H](NC[C@H]1CCCCN1C(=O)C#CC1CC1)c1cc(F)ccc1F	ZINC001024957571	1323799948	/nfs/dbraw/zinc/79/99/48/1323799948.db2.gz	FSGAJDROBMMUPZ-WMLDXEAASA-N	0	3	346.421	3.410	20	30		EGEDHN
C[C@@H](NC[C@H]1CCCCN1C(=O)C#CC1CC1)c1ccccc1F	ZINC001024958550	1323801046	/nfs/dbraw/zinc/80/10/46/1323801046.db2.gz	YTAJVOYYDQADMH-NVXWUHKLSA-N	0	3	328.431	3.271	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCCC[C@H]1CNCc1cncc(F)c1	ZINC001025037427	1323840931	/nfs/dbraw/zinc/84/09/31/1323840931.db2.gz	DIYINYPCXQWNQN-KRWDZBQOSA-N	0	3	333.451	3.294	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCCC[C@@H]1CNCc1cncc(C)c1	ZINC001025069877	1323870230	/nfs/dbraw/zinc/87/02/30/1323870230.db2.gz	RHIDTQXBBVJYMW-QUCCMNQESA-N	0	3	329.488	3.463	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1c(F)cccc1OC	ZINC001025233300	1324019635	/nfs/dbraw/zinc/01/96/35/1324019635.db2.gz	WWUJMVCLCIGEGB-IRXDYDNUSA-N	0	3	346.446	3.479	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc(F)c(F)c1	ZINC001025239890	1324032517	/nfs/dbraw/zinc/03/25/17/1324032517.db2.gz	JXCDXRVJQHGCPM-ROUUACIJSA-N	0	3	332.394	3.057	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccn2ccccc12	ZINC001025252552	1324056814	/nfs/dbraw/zinc/05/68/14/1324056814.db2.gz	XUYKLYHAVXURGM-WOJBJXKFSA-N	0	3	335.451	3.032	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(F)ccc1OC	ZINC001025254519	1324061909	/nfs/dbraw/zinc/06/19/09/1324061909.db2.gz	KDPNPEHEBBROSC-MSOLQXFVSA-N	0	3	346.446	3.479	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc2ccsc2[nH]1	ZINC001025256691	1324064049	/nfs/dbraw/zinc/06/40/49/1324064049.db2.gz	ZIOPPCIZRKOUQL-SJORKVTESA-N	0	3	341.480	3.322	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)C1(c2cc(C)no2)CC1	ZINC001025259486	1324069702	/nfs/dbraw/zinc/06/97/02/1324069702.db2.gz	NWNVIQFOMYXMKL-IRXDYDNUSA-N	0	3	343.471	3.046	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)Cc1cccc(Cl)c1	ZINC001025263241	1324073178	/nfs/dbraw/zinc/07/31/78/1324073178.db2.gz	JROYBMYCNOISMW-RBUKOAKNSA-N	0	3	344.886	3.361	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)Cc1ccsc1C	ZINC001025273616	1324088863	/nfs/dbraw/zinc/08/88/63/1324088863.db2.gz	FUHZVIBLRWMBQA-QZTJIDSGSA-N	0	3	330.497	3.078	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(C(C)C)no1	ZINC001025273892	1324089900	/nfs/dbraw/zinc/08/99/00/1324089900.db2.gz	IATDDNADDLYSQG-DLBZAZTESA-N	0	3	331.460	3.443	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc2ccccn2c1	ZINC001025275219	1324095141	/nfs/dbraw/zinc/09/51/41/1324095141.db2.gz	UUHXSAJVKOOQEU-UXHICEINSA-N	0	3	335.451	3.032	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cnoc1C1CC1	ZINC001025284210	1324105743	/nfs/dbraw/zinc/10/57/43/1324105743.db2.gz	FHLSVYGBMXOZEE-IRXDYDNUSA-N	0	3	329.444	3.197	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)C(C)(C)C(F)(F)F	ZINC001025294324	1324122839	/nfs/dbraw/zinc/12/28/39/1324122839.db2.gz	ZJPSVOBHHHTBTB-UONOGXRCSA-N	0	3	330.394	3.054	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)CCc1ccccc1F	ZINC001025294475	1324123911	/nfs/dbraw/zinc/12/39/11/1324123911.db2.gz	KIYBROSOCOPWHQ-VQTJNVASSA-N	0	3	342.458	3.237	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)Cc1ccccc1Cl	ZINC001025295532	1324125516	/nfs/dbraw/zinc/12/55/16/1324125516.db2.gz	HFAPRGDWDAXEAH-MOPGFXCFSA-N	0	3	344.886	3.361	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ncccc1OCC	ZINC001025303510	1324137833	/nfs/dbraw/zinc/13/78/33/1324137833.db2.gz	HZMAZOQERJKAAW-IRXDYDNUSA-N	0	3	343.471	3.125	20	30		EGEDHN
C#CCCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc(F)s1	ZINC001025303561	1324137921	/nfs/dbraw/zinc/13/79/21/1324137921.db2.gz	IJRIYTJBSVRFCT-LSDHHAIUSA-N	0	3	334.460	3.370	20	30		EGEDHN
C[C@@H](NC(=O)C1CC=CC1)[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001025373685	1324214858	/nfs/dbraw/zinc/21/48/58/1324214858.db2.gz	UZISGORCJYTIGA-UZLBHIALSA-N	0	3	337.467	3.241	20	30		EGEDHN
C[C@H](NC(=O)C1=CCCC1)[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001025375335	1324216644	/nfs/dbraw/zinc/21/66/44/1324216644.db2.gz	MKGGQUDFANGIOK-JXFKEZNVSA-N	0	3	337.467	3.385	20	30		EGEDHN
C[C@@H](NC(=O)C1=CCCC1)[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001025375338	1324216943	/nfs/dbraw/zinc/21/69/43/1324216943.db2.gz	MKGGQUDFANGIOK-OXQOHEQNSA-N	0	3	337.467	3.385	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(F)c3ccccc3c2)C1	ZINC001025437504	1324276370	/nfs/dbraw/zinc/27/63/70/1324276370.db2.gz	WSZMZVWUPVXKGK-NVXWUHKLSA-N	0	3	338.426	3.442	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(C(C)C)nc2)C1	ZINC001025443768	1324284275	/nfs/dbraw/zinc/28/42/75/1324284275.db2.gz	UHXDXEGKMQHHMG-WMZOPIPTSA-N	0	3	327.472	3.059	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(F)c(C)cc2F)C1	ZINC001025449983	1324291627	/nfs/dbraw/zinc/29/16/27/1324291627.db2.gz	AXUKFOSLGIXBBK-CABCVRRESA-N	0	3	334.410	3.127	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2c(C)c(F)ccc2Cl)C1	ZINC001025459620	1324302728	/nfs/dbraw/zinc/30/27/28/1324302728.db2.gz	PRXNUEWTTLJWSS-UONOGXRCSA-N	0	3	336.838	3.251	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2coc3cc(F)ccc23)C1	ZINC001025461872	1324307882	/nfs/dbraw/zinc/30/78/82/1324307882.db2.gz	XNEPPOPJVVRXPS-KBPBESRZSA-N	0	3	328.387	3.035	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cccc3cccnc32)C1	ZINC001025473018	1324318174	/nfs/dbraw/zinc/31/81/74/1324318174.db2.gz	YAQNPHAHSHRDEB-AEFFLSMTSA-N	0	3	335.451	3.088	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(C)c3cccnc23)C1	ZINC001025491596	1324341599	/nfs/dbraw/zinc/34/15/99/1324341599.db2.gz	ZLKSHVYTHHEIDM-ROUUACIJSA-N	0	3	349.478	3.397	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(C(C)C)nc2C)C1	ZINC001025530475	1324375809	/nfs/dbraw/zinc/37/58/09/1324375809.db2.gz	IRYIHZPKOLRSNC-WMZOPIPTSA-N	0	3	341.499	3.367	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc3occc3s2)C1	ZINC001025534919	1324382399	/nfs/dbraw/zinc/38/23/99/1324382399.db2.gz	RDIVXGUCVSIVAF-KBPBESRZSA-N	0	3	330.453	3.348	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(F)cc(Cl)c2)C1	ZINC001025539553	1324386157	/nfs/dbraw/zinc/38/61/57/1324386157.db2.gz	OYQREFWYVQCQAP-KBPBESRZSA-N	0	3	336.838	3.333	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(-c3ccccc3)o2)C1	ZINC001025539880	1324387485	/nfs/dbraw/zinc/38/74/85/1324387485.db2.gz	QOXDWHDOVCZLBY-SJLPKXTDSA-N	0	3	336.435	3.410	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc3cccnc3c2)C1	ZINC001025563502	1324410004	/nfs/dbraw/zinc/41/00/04/1324410004.db2.gz	CTIBEHWDCDAUHL-LPHOPBHVSA-N	0	3	335.451	3.088	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2coc(C3CCCC3)n2)C1	ZINC001025582437	1324422770	/nfs/dbraw/zinc/42/27/70/1324422770.db2.gz	UCICHHRCYCVTEW-NVXWUHKLSA-N	0	3	343.471	3.186	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2coc(C3CCCC3)n2)C1	ZINC001025582439	1324422885	/nfs/dbraw/zinc/42/28/85/1324422885.db2.gz	UCICHHRCYCVTEW-WBVHZDCISA-N	0	3	343.471	3.186	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cccc3ccncc32)C1	ZINC001025583114	1324425221	/nfs/dbraw/zinc/42/52/21/1324425221.db2.gz	XVSJAWLPALCPLJ-AEFFLSMTSA-N	0	3	335.451	3.088	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(C3CC3)s2)C1	ZINC001025593246	1324440738	/nfs/dbraw/zinc/44/07/38/1324440738.db2.gz	AGKHVKIWWLLERB-GOEBONIOSA-N	0	3	330.497	3.479	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2coc3ccc(F)cc23)C1	ZINC001025609340	1324459932	/nfs/dbraw/zinc/45/99/32/1324459932.db2.gz	NYGSANQWJCVLEJ-KGLIPLIRSA-N	0	3	328.387	3.035	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2c(Cl)cccc2Cl)C1	ZINC001025610497	1324462327	/nfs/dbraw/zinc/46/23/27/1324462327.db2.gz	WWQXVCAHWYFJEK-CHWSQXEVSA-N	0	3	339.266	3.457	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2c(Cl)cccc2OC)C1	ZINC001025630097	1324482197	/nfs/dbraw/zinc/48/21/97/1324482197.db2.gz	OWRBSJJDZRVIFO-HUUCEWRRSA-N	0	3	348.874	3.202	20	30		EGEDHN
Cc1occc1C(=O)N1C[C@@H]2CC[C@@H](NCc3ccccc3C#N)[C@H]2C1	ZINC001026193672	1324656110	/nfs/dbraw/zinc/65/61/10/1324656110.db2.gz	SZHHIWBKHQDYTH-YSIASYRMSA-N	0	3	349.434	3.100	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)[C@H]2CC=CCC2)CC1	ZINC001026451532	1324815135	/nfs/dbraw/zinc/81/51/35/1324815135.db2.gz	VSUTWHWPABQWJQ-NFOMZHRRSA-N	0	3	341.293	3.268	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@H]1CCN(C(=O)CC2CCCC2)C1	ZINC001026656986	1324955133	/nfs/dbraw/zinc/95/51/33/1324955133.db2.gz	AOHAVGNIDQGSMO-MRXNPFEDSA-N	0	3	343.446	3.216	20	30		EGEDHN
CC(C)(C)CC(=O)N1CC[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001026687534	1324976427	/nfs/dbraw/zinc/97/64/27/1324976427.db2.gz	VFMHFMTVCIIBNQ-CQSZACIVSA-N	0	3	331.435	3.072	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)c2ccn(C)c2)C1	ZINC000963285371	1325068516	/nfs/dbraw/zinc/06/85/16/1325068516.db2.gz	GGNARZDURCVKGT-RDJZCZTQSA-N	0	3	335.879	3.094	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H](CNCc2nc(C)sc2C)C1	ZINC001027037877	1325172495	/nfs/dbraw/zinc/17/24/95/1325172495.db2.gz	DDDZVIHXKKATBV-CRAIPNDOSA-N	0	3	335.517	3.300	20	30		EGEDHN
C#C[C@@](C)(CC)NC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F	ZINC000854704443	1325297453	/nfs/dbraw/zinc/29/74/53/1325297453.db2.gz	SDPRWPAZPAPEAR-WMZOPIPTSA-N	0	3	334.410	3.062	20	30		EGEDHN
CCc1ccc(C(=O)N2CC[C@@H](CNCc3ccccc3C#N)C2)cc1	ZINC001027199226	1325297858	/nfs/dbraw/zinc/29/78/58/1325297858.db2.gz	QYDZYKWQATYUAL-SFHVURJKSA-N	0	3	347.462	3.373	20	30		EGEDHN
C[C@@H](CC(C)(C)C#N)Nc1ccc(OCCN2CCN(C)CC2)cc1	ZINC000926009361	1325387692	/nfs/dbraw/zinc/38/76/92/1325387692.db2.gz	PKCNZFQGWGUMSB-KRWDZBQOSA-N	0	3	344.503	3.053	20	30		EGEDHN
Cc1occc1C(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001027290225	1325423939	/nfs/dbraw/zinc/42/39/39/1325423939.db2.gz	RBNXDXQDGCDKJS-SFHVURJKSA-N	0	3	337.423	3.196	20	30		EGEDHN
CN(Cc1ccc(F)c(C#N)c1)[C@H]1CCCN(C(=O)c2ccoc2)C1	ZINC001027297445	1325437450	/nfs/dbraw/zinc/43/74/50/1325437450.db2.gz	FYYPLLKCDLLILK-KRWDZBQOSA-N	0	3	341.386	3.027	20	30		EGEDHN
Cc1ccoc1C(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001027300543	1325440609	/nfs/dbraw/zinc/44/06/09/1325440609.db2.gz	UPGMPHSRVHVVRX-SFHVURJKSA-N	0	3	337.423	3.196	20	30		EGEDHN
C[C@@H](CC(C)(C)C#N)NCc1ccc(S(C)(=O)=O)c(Cl)c1	ZINC000926280783	1325502597	/nfs/dbraw/zinc/50/25/97/1325502597.db2.gz	GCBFNNPXMOQHCK-NSHDSACASA-N	0	3	328.865	3.161	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H](N(C)Cc2ccc(F)c(C#N)c2)C1)C1CC1	ZINC001027351667	1325520376	/nfs/dbraw/zinc/52/03/76/1325520376.db2.gz	MDLZIDAGUVVQAK-KSSFIOAISA-N	0	3	343.446	3.166	20	30		EGEDHN
CN(Cc1ccc(F)c(C#N)c1)[C@H]1CCCN(C(=O)C2=CCCC2)C1	ZINC001027365941	1325557153	/nfs/dbraw/zinc/55/71/53/1325557153.db2.gz	ZRZIYJFRULXJBR-SFHVURJKSA-N	0	3	341.430	3.230	20	30		EGEDHN
CC(=O)N[C@H](CC(C)C)C(=O)C(C#N)c1ncc(C(C)(C)C)s1	ZINC000860732569	1329349377	/nfs/dbraw/zinc/34/93/77/1329349377.db2.gz	LCFJWMKYSIPVRL-CHWSQXEVSA-N	0	3	335.473	3.168	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)C2(C(F)F)CC2)C1	ZINC001027412533	1327638835	/nfs/dbraw/zinc/63/88/35/1327638835.db2.gz	CYRRMJAKNVRNCO-MRXNPFEDSA-N	0	3	347.409	3.026	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)[C@H]1Cc3ccccc31)C2	ZINC000964774949	1327689747	/nfs/dbraw/zinc/68/97/47/1327689747.db2.gz	FAPLPRFFIGMXOW-GXMUVECYSA-N	0	3	330.859	3.096	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)C2(CC)CCC(F)(F)CC2)C1	ZINC001027465945	1327719197	/nfs/dbraw/zinc/71/91/97/1327719197.db2.gz	GLESBWGWAWQRRF-HNNXBMFYSA-N	0	3	326.431	3.148	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)CC2(C)CC2)C1	ZINC001027495859	1327757669	/nfs/dbraw/zinc/75/76/69/1327757669.db2.gz	HQDUGUAHIZAFFF-SFHVURJKSA-N	0	3	325.456	3.171	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)C2(C)CCC2)C1	ZINC001027530098	1327812108	/nfs/dbraw/zinc/81/21/08/1327812108.db2.gz	RGUGIFDUGYCYPA-GOSISDBHSA-N	0	3	325.456	3.171	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)N1CCC[C@@H](N(C)Cc2ccc(F)c(C#N)c2)C1	ZINC001027532916	1327818107	/nfs/dbraw/zinc/81/81/07/1327818107.db2.gz	FNSYSUQAXNSVCD-SJLPKXTDSA-N	0	3	349.425	3.114	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)C[C@@H](C)c2ccc(CC)cc2)C1	ZINC001027573045	1327908889	/nfs/dbraw/zinc/90/88/89/1327908889.db2.gz	YFMWGNJFKDJVNV-YLJYHZDGSA-N	0	3	326.484	3.299	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)[C@H]2CC23CCC3)C1	ZINC001027596594	1327945407	/nfs/dbraw/zinc/94/54/07/1327945407.db2.gz	XBNQCRORJYZRJE-RBUKOAKNSA-N	0	3	337.467	3.171	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)C(C)(C)c2ccccc2Cl)C1	ZINC001027656821	1328040292	/nfs/dbraw/zinc/04/02/92/1328040292.db2.gz	ZUOKTIFMYSEHRF-OAHLLOKOSA-N	0	3	332.875	3.174	20	30		EGEDHN
CN(Cc1ccc(C#N)c(F)c1)[C@H]1CCCN(C(=O)C(C)(C)C)C1	ZINC001027658220	1328042320	/nfs/dbraw/zinc/04/23/20/1328042320.db2.gz	FRECGSVRAGCBAL-INIZCTEOSA-N	0	3	331.435	3.166	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1ccc(N(C)C)cc1)C2	ZINC000965886804	1328078445	/nfs/dbraw/zinc/07/84/45/1328078445.db2.gz	VMYUMXXPFCYIJV-UHFFFAOYSA-N	0	3	347.890	3.136	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2cccc3scnc32)C1	ZINC000966077640	1328171006	/nfs/dbraw/zinc/17/10/06/1328171006.db2.gz	QORHBGYSARDEPD-ZFWWWQNUSA-N	0	3	329.469	3.313	20	30		EGEDHN
C=CCCN1CCC[C@@H]1CNC(=O)c1snc(Cl)c1Cl	ZINC001027908305	1328381536	/nfs/dbraw/zinc/38/15/36/1328381536.db2.gz	CDNXLSFYBDKPEA-SECBINFHSA-N	0	3	334.272	3.220	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccnc(-c3ccco3)c2)CC1	ZINC000932143398	1329788490	/nfs/dbraw/zinc/78/84/90/1329788490.db2.gz	BYFOWZKUJBDSSB-UHFFFAOYSA-N	0	3	325.412	3.112	20	30		EGEDHN
C(#CCN[C@H](c1ccccn1)C1CC1)CN[C@@H](c1ccccn1)C1CC1	ZINC000932384830	1329810691	/nfs/dbraw/zinc/81/06/91/1329810691.db2.gz	WXQNASHSHIJJDC-SZPZYZBQSA-N	0	3	346.478	3.262	20	30		EGEDHN
CC(C)(C)OC(=O)NCC[C@@H]1CCN(Cc2ccccc2C#N)C1	ZINC000932697607	1329834441	/nfs/dbraw/zinc/83/44/41/1329834441.db2.gz	TUDADQAVLNZTTR-OAHLLOKOSA-N	0	3	329.444	3.295	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000933219461	1329872604	/nfs/dbraw/zinc/87/26/04/1329872604.db2.gz	QYMQBTLJHMDPCM-MRXNPFEDSA-N	0	3	348.462	3.387	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H](C)[C@H](NCc3ccc(C#N)s3)C2)CC1	ZINC000939055429	1330365759	/nfs/dbraw/zinc/36/57/59/1330365759.db2.gz	YTXLBMFGHRHRDL-RDTXWAMCSA-N	0	3	343.496	3.303	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(CC(C)C)s2)[C@@H](C)C1	ZINC000942138281	1331843698	/nfs/dbraw/zinc/84/36/98/1331843698.db2.gz	WMBZIBBXFUSBHY-RDJZCZTQSA-N	0	3	332.513	3.410	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc(CCCC)cc2)[C@@H](C)C1	ZINC000942270843	1331891817	/nfs/dbraw/zinc/89/18/17/1331891817.db2.gz	GHRHKJZKPZZMOC-GHTZIAJQSA-N	0	3	340.511	3.422	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2c(C)occ2C(F)(F)F)[C@@H](C)C1	ZINC000942518105	1331950533	/nfs/dbraw/zinc/95/05/33/1331950533.db2.gz	MEYCAFMJIKQNHH-GXFFZTMASA-N	0	3	330.350	3.233	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(-c3cccs3)on2)[C@H](C)C1	ZINC000942538195	1331962928	/nfs/dbraw/zinc/96/29/28/1331962928.db2.gz	MBLPHNGMEUPJDJ-OLZOCXBDSA-N	0	3	331.441	3.029	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3cc(Cl)ccc3[nH]2)[C@@H](C)C1	ZINC000942556287	1331971874	/nfs/dbraw/zinc/97/18/74/1331971874.db2.gz	YRTDXTFVIOYYIM-BBRMVZONSA-N	0	3	343.858	3.285	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3cccc(OC)c3)C[C@@H]2C)C1	ZINC000942608104	1332004426	/nfs/dbraw/zinc/00/44/26/1332004426.db2.gz	PNCJPMCAIFIWPA-LPHOPBHVSA-N	0	3	342.483	3.378	20	30		EGEDHN
C[C@H]1CN(Cc2cccc(C#N)c2)CC[C@@H]1NC(=O)C1CC2(CC2)C1	ZINC000942698495	1332022535	/nfs/dbraw/zinc/02/25/35/1332022535.db2.gz	HRSIEKNZJJOVKE-KXBFYZLASA-N	0	3	337.467	3.075	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccc(C(F)F)c(F)c2)[C@H](C)C1	ZINC000942822404	1332042981	/nfs/dbraw/zinc/04/29/81/1332042981.db2.gz	KJSVYGUPOGYWRQ-IAQYHMDHSA-N	0	3	326.362	3.390	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2[nH]c3ccc(C)cc3c2C)[C@@H](C)C1	ZINC000943813797	1332271340	/nfs/dbraw/zinc/27/13/40/1332271340.db2.gz	FKJNYNVROMZXAM-YJBOKZPZSA-N	0	3	337.467	3.248	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(Cl)c3occc32)[C@@H](C)C1	ZINC000944135109	1332333093	/nfs/dbraw/zinc/33/30/93/1332333093.db2.gz	IPGHEAFCWXTXFI-LRDDRELGSA-N	0	3	330.815	3.160	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(Cl)c3occc32)[C@H](C)C1	ZINC000944135110	1332333355	/nfs/dbraw/zinc/33/33/55/1332333355.db2.gz	IPGHEAFCWXTXFI-MLGOLLRUSA-N	0	3	330.815	3.160	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C(C)(C)c2ccccc2Cl)[C@H](C)C1	ZINC000944215820	1332347503	/nfs/dbraw/zinc/34/75/03/1332347503.db2.gz	VSSZSSFCOQLNQA-PBHICJAKSA-N	0	3	332.875	3.077	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(Cl)cc2Cl)[C@H](C)C1	ZINC000944304846	1332367853	/nfs/dbraw/zinc/36/78/53/1332367853.db2.gz	LQLFZKKYFAKVEL-IAQYHMDHSA-N	0	3	325.239	3.067	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2c3ccccc3oc2CC)[C@H](C)C1	ZINC000945178712	1332525825	/nfs/dbraw/zinc/52/58/25/1332525825.db2.gz	GMYXQLZLUFLSHZ-NVXWUHKLSA-N	0	3	338.451	3.459	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2oc3ccccc3c2CC)[C@@H](C)C1	ZINC000945365873	1332568251	/nfs/dbraw/zinc/56/82/51/1332568251.db2.gz	MGGGPXAZRCISFN-MAUKXSAKSA-N	0	3	338.451	3.459	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(CC)c(CC)c2)[C@H](C)C1	ZINC000946309620	1332783869	/nfs/dbraw/zinc/78/38/69/1332783869.db2.gz	CFKSOHTZEYQIOT-UZLBHIALSA-N	0	3	326.484	3.275	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cscc2C(F)(F)F)[C@@H](C)C1	ZINC000946316006	1332786571	/nfs/dbraw/zinc/78/65/71/1332786571.db2.gz	ZHPQFCWSNHQLSQ-FZMZJTMJSA-N	0	3	344.402	3.230	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)Cc3cccs3)CC[C@@H]2C1	ZINC000946449083	1332831196	/nfs/dbraw/zinc/83/11/96/1332831196.db2.gz	PMMXSQNUYDEUTL-GASCZTMLSA-N	0	3	338.904	3.214	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H]2CCN(Cc3ccc(C#N)cc3)[C@@H](C)C2)o1	ZINC000947025496	1332978864	/nfs/dbraw/zinc/97/88/64/1332978864.db2.gz	DZLMVPPZQPMHQY-KSSFIOAISA-N	0	3	337.423	3.243	20	30		EGEDHN
Cc1cccnc1C(=O)N[C@@H]1CCN(Cc2cccc(C#N)c2)[C@H](C)C1	ZINC000947157463	1333028430	/nfs/dbraw/zinc/02/84/30/1333028430.db2.gz	PLLUKTHJSORXFY-VQIMIIECSA-N	0	3	348.450	3.045	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C(F)F)ccc2F)C[C@@H]1C	ZINC000947319492	1333087105	/nfs/dbraw/zinc/08/71/05/1333087105.db2.gz	RSMAYDRUTMETGL-GXTWGEPZSA-N	0	3	338.373	3.369	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)C2(F)CCCC2)CCN1Cc1cccc(C#N)c1	ZINC000947464142	1333138509	/nfs/dbraw/zinc/13/85/09/1333138509.db2.gz	RPOAHLBDVJRTBT-CRAIPNDOSA-N	0	3	343.446	3.310	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)C2(F)CCCC2)CCN1Cc1ccc(C#N)cc1	ZINC000947464608	1333138632	/nfs/dbraw/zinc/13/86/32/1333138632.db2.gz	WPUFDEKQLCTMOH-YJBOKZPZSA-N	0	3	343.446	3.310	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2c(C)occ2C(F)(F)F)C[C@H]1C	ZINC000947547896	1333167706	/nfs/dbraw/zinc/16/77/06/1333167706.db2.gz	VGOCCFUUADVAFN-DGCLKSJQSA-N	0	3	342.361	3.213	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3cccc(F)c3)CCC2)C[C@H]1C	ZINC000947599649	1333189205	/nfs/dbraw/zinc/18/92/05/1333189205.db2.gz	XDCFMDOJAXHZAO-VQIMIIECSA-N	0	3	342.458	3.240	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(Cc3cccnc3C)[C@@H](C)C2)cc1	ZINC000947611686	1333191537	/nfs/dbraw/zinc/19/15/37/1333191537.db2.gz	OVLVPZMBLRBQFL-HRAATJIYSA-N	0	3	347.462	3.154	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)C2(C)CCC2)CCN1Cc1cccc(C#N)c1	ZINC000947612719	1333192703	/nfs/dbraw/zinc/19/27/03/1333192703.db2.gz	XNFIITHCSRZECQ-MAUKXSAKSA-N	0	3	325.456	3.218	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(F)cc2Cl)C[C@H]1C	ZINC000947690417	1333225038	/nfs/dbraw/zinc/22/50/38/1333225038.db2.gz	WMQNDEQXEBYYHW-CJNGLKHVSA-N	0	3	336.838	3.014	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)oc2C(F)(F)F)C[C@@H]1C	ZINC000947757804	1333252947	/nfs/dbraw/zinc/25/29/47/1333252947.db2.gz	FTSQNINLUMXYTN-WCQYABFASA-N	0	3	342.361	3.213	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnn(C(C)C)c2C2CC2)C[C@H]1C	ZINC000947913072	1333304280	/nfs/dbraw/zinc/30/42/80/1333304280.db2.gz	VCERIDWANDFEKW-GDBMZVCRSA-N	0	3	330.476	3.110	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccccc2OC(C)C)C[C@H]1C	ZINC000947948138	1333315326	/nfs/dbraw/zinc/31/53/26/1333315326.db2.gz	KZMSUWPZPFOLKF-IAGOWNOFSA-N	0	3	328.456	3.080	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2cccc3ccccc32)C[C@@H]1C	ZINC000947956892	1333319447	/nfs/dbraw/zinc/31/94/47/1333319447.db2.gz	GFXDZRIFJSLYMC-FXAWDEMLSA-N	0	3	334.463	3.375	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)CC23CC4CC(CC(C4)C2)C3)C[C@@H]1C	ZINC000947966501	1333323296	/nfs/dbraw/zinc/32/32/96/1333323296.db2.gz	BZAWGDHGECXZNN-VJRVKHOTSA-N	0	3	328.500	3.195	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](NC(=O)c2cccc(CN(C)C)c2)C[C@@H]1C	ZINC000948057687	1333358530	/nfs/dbraw/zinc/35/85/30/1333358530.db2.gz	XSUUSPKRQIOMKX-YJBOKZPZSA-N	0	3	349.906	3.083	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cscc2C(F)(F)F)C[C@@H]1C	ZINC000948105214	1333375671	/nfs/dbraw/zinc/37/56/71/1333375671.db2.gz	SFHPAYBVAKWZJU-NWDGAFQWSA-N	0	3	344.402	3.373	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(CC)c(CC)c2)C[C@H]1C	ZINC000948105304	1333375832	/nfs/dbraw/zinc/37/58/32/1333375832.db2.gz	UNUAGZRQCIZUBJ-UZLBHIALSA-N	0	3	326.484	3.417	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2ccc(Cl)cn2)C12CCC2	ZINC001078786434	1357081966	/nfs/dbraw/zinc/08/19/66/1357081966.db2.gz	VQXDSFUILNYKOF-KGLIPLIRSA-N	0	3	340.254	3.118	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)Cc2c(C)cccc2Cl)CC1	ZINC000948587182	1333585950	/nfs/dbraw/zinc/58/59/50/1333585950.db2.gz	SJIZXECHOHCQCS-INIZCTEOSA-N	0	3	332.875	3.137	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cncc3sccc32)CC1	ZINC000948711843	1333643250	/nfs/dbraw/zinc/64/32/50/1333643250.db2.gz	UXEJJUJZJJLAQG-HNNXBMFYSA-N	0	3	341.480	3.246	20	30		EGEDHN
CN(C(=O)[C@H]1CC12CC2)[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948809085	1333690317	/nfs/dbraw/zinc/69/03/17/1333690317.db2.gz	LTHAZYYIMYJFRN-RTBURBONSA-N	0	3	337.467	3.171	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2ccc(Cl)c(OC)c2)CC1	ZINC000948832774	1333702473	/nfs/dbraw/zinc/70/24/73/1333702473.db2.gz	AMRBUYPOFLYQDV-MRXNPFEDSA-N	0	3	348.874	3.298	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)[C@@H](C)c2ccc(CC)cc2)CC1	ZINC000948861844	1333713282	/nfs/dbraw/zinc/71/32/82/1333713282.db2.gz	UWPAHMXUPFKKGI-PXNSSMCTSA-N	0	3	326.484	3.299	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@@H]1CNC(=O)C1CC(F)(F)C1	ZINC000948906657	1333729046	/nfs/dbraw/zinc/72/90/46/1333729046.db2.gz	PVDQNVXYCSQKKW-KRWDZBQOSA-N	0	3	334.410	3.323	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@H]1CNC(=O)[C@H]1CC[C@@H](C)O1	ZINC000948960127	1333748464	/nfs/dbraw/zinc/74/84/64/1333748464.db2.gz	BOUGYSLZIAJGTI-NSISKUIASA-N	0	3	342.483	3.236	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccc(C3CC3)cc1)CCO2	ZINC000949247624	1333802921	/nfs/dbraw/zinc/80/29/21/1333802921.db2.gz	AQHNQFBOYQHBMK-UHFFFAOYSA-N	0	3	340.467	3.057	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H]1CCCC(C)(C)C1)CCO2	ZINC000949253951	1333804648	/nfs/dbraw/zinc/80/46/48/1333804648.db2.gz	RSYJWLCWAHZVLJ-QGZVFWFLSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@]3(C)CC=CCC3)CC2)C1	ZINC000949375980	1333833628	/nfs/dbraw/zinc/83/36/28/1333833628.db2.gz	LRBLGOAZBXWVGT-HXUWFJFHSA-N	0	3	346.515	3.392	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3ccc(C=C)cc3)CC2)C1	ZINC000949475046	1333858668	/nfs/dbraw/zinc/85/86/68/1333858668.db2.gz	VRDDOVYSQNKEFR-UHFFFAOYSA-N	0	3	340.467	3.213	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C3(C)C(C)(C)C3(C)C)CC2)C1	ZINC000949533858	1333869717	/nfs/dbraw/zinc/86/97/17/1333869717.db2.gz	IEXMQDNGWFYVJP-UHFFFAOYSA-N	0	3	348.531	3.328	20	30		EGEDHN
CCCCCCCCCCNC(=S)NC1CCN(CCO)CC1	ZINC001200217900	1369330871	/nfs/dbraw/zinc/33/08/71/1369330871.db2.gz	YTFMDSQYOVNEBQ-UHFFFAOYSA-N	0	3	343.581	3.048	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2ccc(OC)c(C(C)C)c2)C1	ZINC000967265000	1335681690	/nfs/dbraw/zinc/68/16/90/1335681690.db2.gz	RRXJWWWHWTYJBZ-QFBILLFUSA-N	0	3	342.483	3.282	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)Cc2cc3ccccc3s2)C1	ZINC000967331757	1335702838	/nfs/dbraw/zinc/70/28/38/1335702838.db2.gz	COBMJWOYWPNGOC-QAPCUYQASA-N	0	3	340.492	3.294	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)C2(c3cccc(F)c3)CCC2)C1	ZINC000967654429	1335800935	/nfs/dbraw/zinc/80/09/35/1335800935.db2.gz	GIEFXQVYGPUQLD-QFBILLFUSA-N	0	3	342.458	3.097	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC[C@@H](NC2c3ccccc3-c3ccccc32)C1	ZINC000967945327	1335832334	/nfs/dbraw/zinc/83/23/34/1335832334.db2.gz	VTIVHSBXWQXXSR-LSDHHAIUSA-N	0	3	331.419	3.107	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccccc2OC2CCC2)C1	ZINC000968316053	1335888089	/nfs/dbraw/zinc/88/80/89/1335888089.db2.gz	DAVICYMOOXDJCE-APWZRJJASA-N	0	3	340.467	3.081	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccc(C(F)F)c(F)c2)C1	ZINC000968327976	1335891598	/nfs/dbraw/zinc/89/15/98/1335891598.db2.gz	VPSRUQXRMYLEPQ-LRDDRELGSA-N	0	3	338.373	3.227	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccc(C(C)C)nc2CC)C1	ZINC000968334830	1335892543	/nfs/dbraw/zinc/89/25/43/1335892543.db2.gz	KZFYNFFFHCWIIR-JXFKEZNVSA-N	0	3	341.499	3.231	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)Cc2ccc(F)c(Cl)c2)C1	ZINC000968354389	1335899695	/nfs/dbraw/zinc/89/96/95/1335899695.db2.gz	RYNVLXBYNNIRHI-SUMWQHHRSA-N	0	3	338.854	3.424	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)Cc2ccc(Cl)s2)C1	ZINC000968387033	1335914517	/nfs/dbraw/zinc/91/45/17/1335914517.db2.gz	TTWZHLPOLNCJGT-OCCSQVGLSA-N	0	3	326.893	3.347	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2ccc(Cl)c(OC)c2)C1	ZINC000968389892	1335916255	/nfs/dbraw/zinc/91/62/55/1335916255.db2.gz	BWRSVPYRBOYGKO-BBRMVZONSA-N	0	3	336.863	3.365	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2scnc2C(C)(C)C)C1	ZINC000968400215	1335920377	/nfs/dbraw/zinc/92/03/77/1335920377.db2.gz	NPBAHBSJOOZSTN-KGLIPLIRSA-N	0	3	335.517	3.457	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2csc(-c3ccoc3)n2)C1	ZINC000968430848	1335927693	/nfs/dbraw/zinc/92/76/93/1335927693.db2.gz	GHNMEPZAYDSXTN-HIFRSBDPSA-N	0	3	345.468	3.419	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)C(C)(C)c2ccc(CC)cc2)C1	ZINC000968520490	1335952569	/nfs/dbraw/zinc/95/25/69/1335952569.db2.gz	JPHDPGOEQAVFNS-YLJYHZDGSA-N	0	3	340.511	3.377	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CN(CC3=CCCCC3)CC[C@@H]2C)nc1	ZINC000968549419	1335960067	/nfs/dbraw/zinc/96/00/67/1335960067.db2.gz	QNGKEAMKYILDCO-OXJNMPFZSA-N	0	3	337.467	3.004	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(F)c3occc32)C1	ZINC000968677996	1336006674	/nfs/dbraw/zinc/00/66/74/1336006674.db2.gz	MUYYWYGIOOGLCX-DYVFJYSZSA-N	0	3	328.387	3.035	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)C(C)(C)c2ccccc2C)C1	ZINC000968698704	1336016048	/nfs/dbraw/zinc/01/60/48/1336016048.db2.gz	QTNSDIANVWYGFS-HKUYNNGSSA-N	0	3	326.484	3.123	20	30		EGEDHN
C#CCCN1CCCCC[C@H]1CNC(=O)c1sc(C2CC2)nc1C	ZINC000968855900	1336069213	/nfs/dbraw/zinc/06/92/13/1336069213.db2.gz	BUEINEYADVBVLG-INIZCTEOSA-N	0	3	345.512	3.327	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1ccc2cccnc2n1	ZINC000968861031	1336071546	/nfs/dbraw/zinc/07/15/46/1336071546.db2.gz	DYPUNZBYVHQQGP-KRWDZBQOSA-N	0	3	338.455	3.180	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1c(F)cccc1OC	ZINC000968869456	1336072948	/nfs/dbraw/zinc/07/29/48/1336072948.db2.gz	QSKAMYLJXIAFIQ-OAHLLOKOSA-N	0	3	334.435	3.385	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccc2c(c1)OCCCO2	ZINC000968890570	1336081357	/nfs/dbraw/zinc/08/13/57/1336081357.db2.gz	KQTXQDDBXOBBMX-KRWDZBQOSA-N	0	3	344.455	3.008	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CC[C@@H](N[C@H](C)c2ccccc2F)C1	ZINC000968919854	1336089346	/nfs/dbraw/zinc/08/93/46/1336089346.db2.gz	AJUWGLNXEVGKPA-HZPDHXFCSA-N	0	3	341.430	3.379	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1ncoc1[C@@H]1CCCO1	ZINC000968972952	1336105854	/nfs/dbraw/zinc/10/58/54/1336105854.db2.gz	BJCDOYADOKBWLL-HOTGVXAUSA-N	0	3	347.459	3.077	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1cc(F)ccc1OC	ZINC000968974076	1336106509	/nfs/dbraw/zinc/10/65/09/1336106509.db2.gz	NSXCJODHCVNCRL-INIZCTEOSA-N	0	3	334.435	3.385	20	30		EGEDHN
C#CCCN1CCCCC[C@@H]1CNC(=O)c1c(F)cc(F)cc1F	ZINC000969007381	1336116343	/nfs/dbraw/zinc/11/63/43/1336116343.db2.gz	BCGKORMLNOMLQS-CQSZACIVSA-N	0	3	338.373	3.102	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1cc[nH]c1C1CCC1	ZINC000969025558	1336121129	/nfs/dbraw/zinc/12/11/29/1336121129.db2.gz	PVGZGCBAPZZAFD-KRWDZBQOSA-N	0	3	327.472	3.280	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1c[nH]c(=O)c2ccccc12	ZINC000969060261	1336133565	/nfs/dbraw/zinc/13/35/65/1336133565.db2.gz	XZVZAEVKVYTVSX-HNNXBMFYSA-N	0	3	339.439	3.101	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1ccc(OC)cc1	ZINC000969064476	1336136264	/nfs/dbraw/zinc/13/62/64/1336136264.db2.gz	IAGXMANCGLQVFJ-YZGWKJHDSA-N	0	3	342.483	3.346	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1nc(C2CC2)oc1C	ZINC000969097385	1336141392	/nfs/dbraw/zinc/14/13/92/1336141392.db2.gz	KVTWATRHFWBNHO-INIZCTEOSA-N	0	3	331.460	3.411	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1cncnc1C(C)C	ZINC000969144541	1336161378	/nfs/dbraw/zinc/16/13/78/1336161378.db2.gz	OBKUSRQUVYVXNS-MRXNPFEDSA-N	0	3	330.476	3.151	20	30		EGEDHN
CC1(C)CCC[C@@H]1C(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC000969622100	1336229743	/nfs/dbraw/zinc/22/97/43/1336229743.db2.gz	GWDIFRCNPFGRKA-IAGOWNOFSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)c2cc(C(F)F)ccc2F)C1	ZINC000969676756	1336236155	/nfs/dbraw/zinc/23/61/55/1336236155.db2.gz	IGPKFOHLUUAMIF-LLVKDONJSA-N	0	3	326.362	3.390	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)C2CCc3ccccc3CC2)C1	ZINC000970012442	1336271927	/nfs/dbraw/zinc/27/19/27/1336271927.db2.gz	MRKJCHMIWJKSGK-INIZCTEOSA-N	0	3	326.484	3.194	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)c2cc3c(ccc(C)c3C)[nH]2)C1	ZINC000970269491	1336291673	/nfs/dbraw/zinc/29/16/73/1336291673.db2.gz	XJURXIDIMASVCN-HNNXBMFYSA-N	0	3	325.456	3.411	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H](C)C2CN([C@@H](C)c3cccc(C)c3)C2)c1	ZINC000970400903	1336303950	/nfs/dbraw/zinc/30/39/50/1336303950.db2.gz	HSZKDIIDRUASOS-SJORKVTESA-N	0	3	347.462	3.183	20	30		EGEDHN
C#CCCN1CC([C@@H](C)NC(=O)c2cc3cc(C)ccc3s2)C1	ZINC000970676469	1336332885	/nfs/dbraw/zinc/33/28/85/1336332885.db2.gz	PXTBNRYKUGGSKU-CQSZACIVSA-N	0	3	326.465	3.283	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cncc(-c3ccccc3)c2)CC1	ZINC001005478039	1336358332	/nfs/dbraw/zinc/35/83/32/1336358332.db2.gz	UJKSPDPPKSPHFH-UHFFFAOYSA-N	0	3	335.451	3.471	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cc(-c3ccccc3)on2)CC1	ZINC001005687930	1336393171	/nfs/dbraw/zinc/39/31/71/1336393171.db2.gz	CWOUCTPLIUCRBL-UHFFFAOYSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cc(Cl)cc(OC)c2)CC1	ZINC001006174264	1336462656	/nfs/dbraw/zinc/46/26/56/1336462656.db2.gz	RVNGKPLRQJXJLR-UHFFFAOYSA-N	0	3	336.863	3.461	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cccc(-c3cnco3)c2)CC1	ZINC001006222728	1336470071	/nfs/dbraw/zinc/47/00/71/1336470071.db2.gz	LQSAGIUJIKRDSH-UHFFFAOYSA-N	0	3	339.439	3.454	20	30		EGEDHN
CC[C@H](c1ccccc1)N1CCC[C@@H](NC(=O)c2cc(C#N)c[nH]2)C1	ZINC001007031034	1336628348	/nfs/dbraw/zinc/62/83/48/1336628348.db2.gz	UOHPBKVXRUBEKP-IEBWSBKVSA-N	0	3	336.439	3.232	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@@H]2CCCN(CC[C@H](C)F)C2)cc1	ZINC001007668613	1336686442	/nfs/dbraw/zinc/68/64/42/1336686442.db2.gz	JKBRQBAFVXLFOG-DOTOQJQBSA-N	0	3	334.435	3.194	20	30		EGEDHN
C#CCCN1CCC[C@@H](NC(=O)c2ccc(OC)c(C(C)C)c2)C1	ZINC001007816179	1336706170	/nfs/dbraw/zinc/70/61/70/1336706170.db2.gz	UFXRLEGHDZDBSX-QGZVFWFLSA-N	0	3	328.456	3.036	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)c2cn(CC)c3ccccc23)C1	ZINC001007846975	1336716443	/nfs/dbraw/zinc/71/64/43/1336716443.db2.gz	SWVHVAPUSKEDQA-MRXNPFEDSA-N	0	3	325.456	3.432	20	30		EGEDHN
C#CCCN1CCC[C@H](NC(=O)c2cc3cc(Cl)ccc3[nH]2)C1	ZINC001008137962	1336777746	/nfs/dbraw/zinc/77/77/46/1336777746.db2.gz	HORKGRRFSJKZSJ-HNNXBMFYSA-N	0	3	329.831	3.039	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN(Cc3ccccc3C)C2)cc1	ZINC001008150326	1336780571	/nfs/dbraw/zinc/78/05/71/1336780571.db2.gz	TZALLGJPJBVGAH-OAQYLSRUSA-N	0	3	332.447	3.371	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CCCN([C@@H](C)c3ccccc3)C2)c1	ZINC001008468376	1336864283	/nfs/dbraw/zinc/86/42/83/1336864283.db2.gz	LAWSXTBLPBMYTB-OXJNMPFZSA-N	0	3	333.435	3.018	20	30		EGEDHN
C#CCCN1CCC[C@H](NC(=O)C(C)(C)c2cccc(Cl)c2)C1	ZINC001008708515	1336915284	/nfs/dbraw/zinc/91/52/84/1336915284.db2.gz	GCQVKPQLOXVNDJ-KRWDZBQOSA-N	0	3	332.875	3.222	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)Cc2c[nH]c3c2cccc3C)C1	ZINC001008760125	1336920995	/nfs/dbraw/zinc/92/09/95/1336920995.db2.gz	IOLYELNUJMUUTG-QGZVFWFLSA-N	0	3	325.456	3.176	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)Cc2c[nH]c3cc(C)ccc23)C1	ZINC001008839680	1336932623	/nfs/dbraw/zinc/93/26/23/1336932623.db2.gz	KDNLENAZUPZTJW-QGZVFWFLSA-N	0	3	325.456	3.176	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)Cc2cccc(OC(C)C)c2)C1	ZINC001009690679	1337061194	/nfs/dbraw/zinc/06/11/94/1337061194.db2.gz	LAPDRHZXRBOQKJ-SFHVURJKSA-N	0	3	330.472	3.173	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(CC[C@@H]3CCCC3(F)F)C2)cc1	ZINC001015481774	1338155385	/nfs/dbraw/zinc/15/53/85/1338155385.db2.gz	HMIJNAOEFCJYBH-ROUUACIJSA-N	0	3	346.421	3.298	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN([C@H](CC)c3ccccc3)C2)cn1	ZINC001016016820	1338407668	/nfs/dbraw/zinc/40/76/68/1338407668.db2.gz	OCUIVGYPMQFMSC-VQTJNVASSA-N	0	3	333.435	3.018	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@@H]1CCN(Cc2ccccc2CC)C1	ZINC001016115334	1338467083	/nfs/dbraw/zinc/46/70/83/1338467083.db2.gz	XOKSNDQZGRLWFC-JOCHJYFZSA-N	0	3	346.474	3.164	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@@H]3NC(=O)CC3CCC3)CC2)c1	ZINC001016544722	1338640475	/nfs/dbraw/zinc/64/04/75/1338640475.db2.gz	GQLJLLIFANPOJN-IBGZPJMESA-N	0	3	337.467	3.219	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2oc(C(F)F)cc2C)CC1	ZINC001016669342	1338686090	/nfs/dbraw/zinc/68/60/90/1338686090.db2.gz	AQLHOCBGIDIFPS-AWEZNQCLSA-N	0	3	336.382	3.133	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)CC2CC(c3ccccc3)C2)CC1	ZINC001016693034	1338693748	/nfs/dbraw/zinc/69/37/48/1338693748.db2.gz	FXKSTJDIBXQYRJ-LYBXBRPPSA-N	0	3	336.479	3.174	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)Cc2cccc(C(F)F)c2)CC1	ZINC001016722644	1338702577	/nfs/dbraw/zinc/70/25/77/1338702577.db2.gz	BIJWQYMPNBDPGE-KRWDZBQOSA-N	0	3	346.421	3.161	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2cc3cc(Cl)ccc3[nH]2)CC1	ZINC001016762219	1338716039	/nfs/dbraw/zinc/71/60/39/1338716039.db2.gz	GZEFCVNGINOCST-KRWDZBQOSA-N	0	3	341.842	3.039	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccccc2C2(C)CC2)CC1	ZINC001016821340	1338738678	/nfs/dbraw/zinc/73/86/78/1338738678.db2.gz	ZWOYLPCVEBLGDH-IBGZPJMESA-N	0	3	336.479	3.346	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(C)cc2Cl)CC1	ZINC001016833921	1338740517	/nfs/dbraw/zinc/74/05/17/1338740517.db2.gz	VMKQZFNVHQWLSA-KRWDZBQOSA-N	0	3	330.859	3.256	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cc(F)cc(Cl)c2)CC1	ZINC001016841714	1338743296	/nfs/dbraw/zinc/74/32/96/1338743296.db2.gz	DSAZDJFQJYMOLC-INIZCTEOSA-N	0	3	334.822	3.087	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@H]3NC(=O)[C@@H]3CC34CCC4)CC2)c1	ZINC001016857502	1338748979	/nfs/dbraw/zinc/74/89/79/1338748979.db2.gz	ZZTYUCGPGSGGGN-RBUKOAKNSA-N	0	3	349.478	3.219	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)[C@@H]2C[C@H]2c2ccc(C)c(C)c2)CC1	ZINC001016871612	1338754146	/nfs/dbraw/zinc/75/41/46/1338754146.db2.gz	YBDFDSJVXYVTFR-ZCNNSNEGSA-N	0	3	336.479	3.011	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)CC23CC4CC(CC(C4)C2)C3)CC1	ZINC001016946196	1338779627	/nfs/dbraw/zinc/77/96/27/1338779627.db2.gz	KSCIYAQMXSEMSM-TWJKGYNYSA-N	0	3	340.511	3.197	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cc(C)nc3ccccc32)CC1	ZINC001016955040	1338783352	/nfs/dbraw/zinc/78/33/52/1338783352.db2.gz	GMKIZCNFXXXRTC-HXUWFJFHSA-N	0	3	347.462	3.151	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2cc3c(s2)CC[C@@H](C)C3)CC1	ZINC001016964148	1338786311	/nfs/dbraw/zinc/78/63/11/1338786311.db2.gz	YYTYTRLCEKTZBC-RDTXWAMCSA-N	0	3	342.508	3.090	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2cc(CC)c(CCC)s2)CC1	ZINC001016967409	1338786851	/nfs/dbraw/zinc/78/68/51/1338786851.db2.gz	HHMAAOGTZBATGW-GOSISDBHSA-N	0	3	344.524	3.481	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@H](CN(C)Cc2ccc(Cl)s2)C1	ZINC001017070503	1338846941	/nfs/dbraw/zinc/84/69/41/1338846941.db2.gz	GIDGNJSHLBSWGT-CHWSQXEVSA-N	0	3	339.892	3.232	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](CN(C)[C@@H](C)c2cnc(C)cn2)C1	ZINC001017179159	1338923088	/nfs/dbraw/zinc/92/30/88/1338923088.db2.gz	FEJQELXBMOGOCA-DLBZAZTESA-N	0	3	344.503	3.229	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](CN(C)Cc2oc(C)nc2C)C1	ZINC001017179775	1338923801	/nfs/dbraw/zinc/92/38/01/1338923801.db2.gz	OIAJGVZVUBRYAF-MRXNPFEDSA-N	0	3	333.476	3.174	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@H](CN(C)Cc3cnoc3C)C2)CC1	ZINC001017197005	1338942140	/nfs/dbraw/zinc/94/21/40/1338942140.db2.gz	LZUNHFXMWWNNLW-QGZVFWFLSA-N	0	3	345.487	3.400	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001017219920	1338961212	/nfs/dbraw/zinc/96/12/12/1338961212.db2.gz	MQQJPAJQNSNYEL-IIDMSEBBSA-N	0	3	345.512	3.336	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1cc(F)ccc1F	ZINC001017860651	1339432104	/nfs/dbraw/zinc/43/21/04/1339432104.db2.gz	HCOWMNZTLGXLAB-CALCHBBNSA-N	0	3	334.410	3.149	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cc2sccc2[nH]1	ZINC001018141486	1339512213	/nfs/dbraw/zinc/51/22/13/1339512213.db2.gz	ADXLWKAJGXIXMV-OKILXGFUSA-N	0	3	329.469	3.484	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@H]1CCO[C@@H](C(C)C)C1	ZINC001018161449	1339518762	/nfs/dbraw/zinc/51/87/62/1339518762.db2.gz	ZHTKANVCUURJMP-VNTMZGSJSA-N	0	3	348.531	3.469	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)COc1cccc(CC)c1	ZINC001018240359	1339544689	/nfs/dbraw/zinc/54/46/89/1339544689.db2.gz	GTXJFNSHDHFZFD-KDURUIRLSA-N	0	3	342.483	3.269	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(F)c2occc21	ZINC001018284796	1339562018	/nfs/dbraw/zinc/56/20/18/1339562018.db2.gz	GRJOMYJVKSYTSA-OKILXGFUSA-N	0	3	328.387	3.437	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)c1ccc(F)c(F)c1	ZINC001018289568	1339564335	/nfs/dbraw/zinc/56/43/35/1339564335.db2.gz	SDQBFXAWOGQVKQ-BMFZPTHFSA-N	0	3	334.410	3.320	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1C[C@H]1c1cccc(F)c1F	ZINC001018293954	1339565949	/nfs/dbraw/zinc/56/59/49/1339565949.db2.gz	YOZUEQCSQGLXBW-HDEZJCGLSA-N	0	3	346.421	3.320	20	30		EGEDHN
Cc1csc(C(=O)N2CC[C@H](NCc3ccc(F)c(C#N)c3)C2)c1	ZINC001018815098	1339733329	/nfs/dbraw/zinc/73/33/29/1339733329.db2.gz	DUJSRQIABIOUOM-HNNXBMFYSA-N	0	3	343.427	3.072	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CCCN2CCOc2ccccc2)CC1	ZINC001028117691	1340438282	/nfs/dbraw/zinc/43/82/82/1340438282.db2.gz	RYVVAUSHMZCREI-IBGZPJMESA-N	0	3	342.483	3.392	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCCN2Cc2ccc(C)cc2C)nc1	ZINC001028271965	1340524549	/nfs/dbraw/zinc/52/45/49/1340524549.db2.gz	QQULBEUDSJVQBC-HXUWFJFHSA-N	0	3	347.462	3.074	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1ccc(N(C)C(C)C)cc1	ZINC001028347234	1340586678	/nfs/dbraw/zinc/58/66/78/1340586678.db2.gz	RAOLREVDFQLSPM-IBGZPJMESA-N	0	3	329.488	3.302	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](CNC(=O)C3=CCCCCC3)C2)cc1	ZINC001028502183	1340674726	/nfs/dbraw/zinc/67/47/26/1340674726.db2.gz	RSOXDXUCQINBHM-LJQANCHMSA-N	0	3	337.467	3.387	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CCN(Cc3c(C)nsc3C)C2)CC1	ZINC001028780525	1340812989	/nfs/dbraw/zinc/81/29/89/1340812989.db2.gz	KKHXCUAXRKRMAI-MRXNPFEDSA-N	0	3	347.528	3.444	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)c2ccc(Cl)cc2Cl)C1	ZINC001028948371	1340890953	/nfs/dbraw/zinc/89/09/53/1340890953.db2.gz	LYGZIUYHVGNDHP-LBPRGKRZSA-N	0	3	325.239	3.068	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC([C@H](C)NCc2csc(C)n2)CC1	ZINC001029124840	1340935915	/nfs/dbraw/zinc/93/59/15/1340935915.db2.gz	CDLVZMPPZZOIKE-ZDUSSCGKSA-N	0	3	335.517	3.380	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC([C@@H](C)NCc3cnns3)CC2)CC1	ZINC001029136377	1340939796	/nfs/dbraw/zinc/93/97/96/1340939796.db2.gz	FWVVIHUKOSMLDS-CQSZACIVSA-N	0	3	348.516	3.001	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC([C@@H](C)NCc3cnc(C)o3)CC2)CC1	ZINC001029137214	1340940139	/nfs/dbraw/zinc/94/01/39/1340940139.db2.gz	TYFVCCJJHRMPGY-OAHLLOKOSA-N	0	3	345.487	3.446	20	30		EGEDHN
C=C[C@H](C(=O)N1C[C@H]2CC[C@@H](C1)N2CC[C@@H](C)F)c1ccccc1	ZINC001029594676	1341018270	/nfs/dbraw/zinc/01/82/70/1341018270.db2.gz	UCPRTJNWXCSSRV-YSHGAJCASA-N	0	3	330.447	3.380	20	30		EGEDHN
Cc1ccc(CN(C)C[C@H]2CCN(C(=O)[C@H](C)C#N)C2)c(Cl)c1	ZINC001029677045	1341040539	/nfs/dbraw/zinc/04/05/39/1341040539.db2.gz	IGKYHVUSNZLFOF-HUUCEWRRSA-N	0	3	333.863	3.088	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCN(C(=O)C2(C3CC3)CC2)C1	ZINC001029763752	1341065634	/nfs/dbraw/zinc/06/56/34/1341065634.db2.gz	LWDFSERYBLOYMJ-CQSZACIVSA-N	0	3	343.496	3.090	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](CN(C)Cc2c(C)onc2CC)C1	ZINC001029801277	1341077254	/nfs/dbraw/zinc/07/72/54/1341077254.db2.gz	KFYWYRPIKGAMRV-HNNXBMFYSA-N	0	3	333.476	3.038	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCN(C(=O)C2(C)CC=CC2)C1	ZINC001029828199	1341088200	/nfs/dbraw/zinc/08/82/00/1341088200.db2.gz	VYTKLZNBZGGKRI-HNNXBMFYSA-N	0	3	343.496	3.256	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)CC1CCN(C(=O)C2CCCC2)CC1	ZINC001029926287	1341122402	/nfs/dbraw/zinc/12/24/02/1341122402.db2.gz	HDLKMNHGZXJZHR-UHFFFAOYSA-N	0	3	345.512	3.480	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC(CN(C)[C@@H](C)c2cnc(C)cn2)CC1	ZINC001029984538	1341144094	/nfs/dbraw/zinc/14/40/94/1341144094.db2.gz	IGPBTOWHSYGUND-INIZCTEOSA-N	0	3	344.503	3.229	20	30		EGEDHN
C[C@@H]1C[C@H]1CC(=O)N1CCC(CN(C)Cc2ccc(C#N)s2)CC1	ZINC001029991238	1341148442	/nfs/dbraw/zinc/14/84/42/1341148442.db2.gz	VTESKZVERHRDJM-ZBFHGGJFSA-N	0	3	345.512	3.336	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC(CN(C)[C@@H](C)c3cnccn3)CC2)C1	ZINC001029993559	1341150218	/nfs/dbraw/zinc/15/02/18/1341150218.db2.gz	JAZSMLPZMSASCR-INIZCTEOSA-N	0	3	342.487	3.064	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](C)[C@H](CNCc2csc(CC)n2)C1	ZINC001072336885	1355244965	/nfs/dbraw/zinc/24/49/65/1355244965.db2.gz	VCUNPUPFUHAYLB-HUUCEWRRSA-N	0	3	349.544	3.492	20	30		EGEDHN
C#Cc1cncc(C(=O)NCC2CN([C@H](C)c3cc(C)ccc3C)C2)c1	ZINC001031963560	1341433148	/nfs/dbraw/zinc/43/31/48/1341433148.db2.gz	OTJXZCQXRNUWRC-QGZVFWFLSA-N	0	3	347.462	3.103	20	30		EGEDHN
C#CCCN1CC(CNC(=O)[C@@H]2C[C@H]2c2cccc3ccccc32)C1	ZINC001032058560	1341446666	/nfs/dbraw/zinc/44/66/66/1341446666.db2.gz	GWYWXGJZMODVGD-LEWJYISDSA-N	0	3	332.447	3.015	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1C[C@@H]2C[C@H]1CN2C[C@@H](C)CC	ZINC001032483494	1341521082	/nfs/dbraw/zinc/52/10/82/1341521082.db2.gz	DJWVBNVCIMPDNO-ULQDDVLXSA-N	0	3	328.456	3.196	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1cccc2ncccc12	ZINC001032517173	1341529247	/nfs/dbraw/zinc/52/92/47/1341529247.db2.gz	JLEVMXMBOMNEHB-ROUUACIJSA-N	0	3	335.451	3.029	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)CCc1ccc(C)cc1C	ZINC001032547553	1341537758	/nfs/dbraw/zinc/53/77/58/1341537758.db2.gz	FKRLXKPLBAZMMB-PMACEKPBSA-N	0	3	326.484	3.487	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H]2C[C@H]1CN2C[C@H](OC)C1CCCC1	ZINC001032557855	1341539489	/nfs/dbraw/zinc/53/94/89/1341539489.db2.gz	SZZURSCBKFALDD-BZSNNMDCSA-N	0	3	334.504	3.079	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1	ZINC001032678635	1341580073	/nfs/dbraw/zinc/58/00/73/1341580073.db2.gz	ZOCDCVMXVRPWNR-XLAORIBOSA-N	0	3	330.859	3.305	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1ccccc1OC(C)C	ZINC001032681534	1341580408	/nfs/dbraw/zinc/58/04/08/1341580408.db2.gz	BAFNLQMPCBKMNC-OALUTQOASA-N	0	3	342.483	3.268	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)C[C@@H](C)c1ccccc1OC	ZINC001032739174	1341596250	/nfs/dbraw/zinc/59/62/50/1341596250.db2.gz	LUCGZBJIECUKLO-IKGGRYGDSA-N	0	3	328.456	3.050	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H](C)Cc1ccc(OC)cc1	ZINC001032795754	1341616169	/nfs/dbraw/zinc/61/61/69/1341616169.db2.gz	UZMLZQHKCSMZAR-WDSOQIARSA-N	0	3	342.483	3.125	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@@H]2CCN(Cc3cccc(C)c3)C2)cc1	ZINC001033318792	1341779924	/nfs/dbraw/zinc/77/99/24/1341779924.db2.gz	PPUZHGQFYBAIHL-OAQYLSRUSA-N	0	3	332.447	3.323	20	30		EGEDHN
C=CCCN1CC[C@H](N(C)C(=O)c2nc(Cl)sc2Cl)C1	ZINC001033321749	1341780546	/nfs/dbraw/zinc/78/05/46/1341780546.db2.gz	NHLRHTKYKMSILY-VIFPVBQESA-N	0	3	334.272	3.172	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@@H]2CCN(Cc3cccc(N(C)C)c3)C2)C1	ZINC001033400046	1341814165	/nfs/dbraw/zinc/81/41/65/1341814165.db2.gz	RXUMUIXYXHRUAG-LJQANCHMSA-N	0	3	341.499	3.142	20	30		EGEDHN
C#Cc1cncc(C(=O)N(C)[C@@H]2CCN(Cc3ccc(C)cc3C)C2)c1	ZINC001033405372	1341816966	/nfs/dbraw/zinc/81/69/66/1341816966.db2.gz	LXOSQSJTJOFRQN-OAQYLSRUSA-N	0	3	347.462	3.026	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)[C@@]2(C)CCCc3ccccc32)C1	ZINC001033510824	1341852379	/nfs/dbraw/zinc/85/23/79/1341852379.db2.gz	WXJRHYHJMQHBPK-NQIIRXRSSA-N	0	3	326.484	3.389	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cccc(NC(=O)CC)c2)C1	ZINC001033847858	1342042870	/nfs/dbraw/zinc/04/28/70/1342042870.db2.gz	ZDXJUPWBNOAWNP-GOSISDBHSA-N	0	3	343.471	3.148	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccc3c(c2)C(C)(C)CO3)C1	ZINC001033897451	1342069750	/nfs/dbraw/zinc/06/97/50/1342069750.db2.gz	NWTMVQCZHGFZDM-KRWDZBQOSA-N	0	3	342.483	3.469	20	30		EGEDHN
C=C1CCC(C(=O)N(CC)[C@@H]2CCN(C[C@@H]3CCCCO3)C2)CC1	ZINC001033948953	1342108124	/nfs/dbraw/zinc/10/81/24/1342108124.db2.gz	CYKJBXUXWFHTKK-MOPGFXCFSA-N	0	3	334.504	3.225	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2coc3ccc(F)cc23)C1	ZINC001034027382	1342166136	/nfs/dbraw/zinc/16/61/36/1342166136.db2.gz	BTGLPVVYWZRVMI-HNNXBMFYSA-N	0	3	328.387	3.132	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2ccc(-c3ccccc3)[nH]2)C1	ZINC001034056526	1342198153	/nfs/dbraw/zinc/19/81/53/1342198153.db2.gz	LBULKGCUYKHOMW-GOSISDBHSA-N	0	3	335.451	3.241	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cccc(NC(=O)CC)c2)C1	ZINC001034230106	1342334945	/nfs/dbraw/zinc/33/49/45/1342334945.db2.gz	BPZAMIHGQQBCAD-GOSISDBHSA-N	0	3	343.471	3.196	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc(-n3cccn3)cc2)C1	ZINC001034247301	1342345000	/nfs/dbraw/zinc/34/50/00/1342345000.db2.gz	LXBQEJBNFSQLKF-SFHVURJKSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cncc(OC(C)C)c2)C1	ZINC001034347058	1342417030	/nfs/dbraw/zinc/41/70/30/1342417030.db2.gz	VYEVJDDXRGTQBG-QGZVFWFLSA-N	0	3	331.460	3.029	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCCN(C[C@@H](O)c3ccccc3)C2)C1	ZINC001034390397	1342459830	/nfs/dbraw/zinc/45/98/30/1342459830.db2.gz	ZSRAFJOGLOPDED-RTBURBONSA-N	0	3	342.483	3.047	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@H]2CCc3ccccc3C2)C1	ZINC001034413792	1342475708	/nfs/dbraw/zinc/47/57/08/1342475708.db2.gz	QCNFVTILUPAYGH-VQTJNVASSA-N	0	3	326.484	3.338	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2cc(C)oc2C(F)(F)F)C1	ZINC001034423818	1342485135	/nfs/dbraw/zinc/48/51/35/1342485135.db2.gz	LKWOPJXYYFEWRR-ZDUSSCGKSA-N	0	3	342.361	3.214	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@@H]2CCO[C@H]2c2ccccc2)C1	ZINC001034437735	1342500082	/nfs/dbraw/zinc/50/00/82/1342500082.db2.gz	BXMMZMTVKGOAQU-ZCNNSNEGSA-N	0	3	342.483	3.311	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@H]2CCCc3sc(C)nc32)C1	ZINC001034494372	1342550039	/nfs/dbraw/zinc/55/00/39/1342550039.db2.gz	YJLKCEBOVPYEOD-CVEARBPZSA-N	0	3	347.528	3.418	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2ccccc2C(F)(F)F)C1	ZINC001034498413	1342555596	/nfs/dbraw/zinc/55/55/96/1342555596.db2.gz	MJFWWNIAPJJHCM-CQSZACIVSA-N	0	3	338.373	3.313	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)C[C@@H]2C=CCC2)CC1	ZINC001034589109	1342634154	/nfs/dbraw/zinc/63/41/54/1342634154.db2.gz	CJVAFUKZWAFYPZ-RBSFLKMASA-N	0	3	341.293	3.268	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)[C@@H]2CCC2(C)C)CC1	ZINC001034709458	1342705213	/nfs/dbraw/zinc/70/52/13/1342705213.db2.gz	HDHNMOKPJCEOKI-IHRRRGAJSA-N	0	3	343.309	3.348	20	30		EGEDHN
N#Cc1cccc(CNCc2ccc(CNC(=O)C3CCC3)cc2)c1	ZINC001034805717	1342770251	/nfs/dbraw/zinc/77/02/51/1342770251.db2.gz	JUYMLVWCVFPLDZ-UHFFFAOYSA-N	0	3	333.435	3.264	20	30		EGEDHN
N#Cc1cccc(CNCc2ccc(CNC(=O)c3ccoc3)cc2)c1	ZINC001034807493	1342772503	/nfs/dbraw/zinc/77/25/03/1342772503.db2.gz	LNZRJSYTHVFEKX-UHFFFAOYSA-N	0	3	345.402	3.371	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)[C@H]2CC=CCC2)c(F)c1	ZINC001034858701	1342808658	/nfs/dbraw/zinc/80/86/58/1342808658.db2.gz	KEVGMXUEMOARSN-FUHWJXTLSA-N	0	3	341.430	3.134	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)c2ccc(Cl)o2)s1	ZINC001034859683	1342809187	/nfs/dbraw/zinc/80/91/87/1342809187.db2.gz	LBDMKHRRMZHZKE-LLVKDONJSA-N	0	3	349.843	3.261	20	30		EGEDHN
C/C(=C\C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)c(F)c1)C1CC1	ZINC001034873461	1342815835	/nfs/dbraw/zinc/81/58/35/1342815835.db2.gz	IQRMGYAKLJYBFU-MOVXZBDNSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]2CNCc2ccc(F)cc2F)C1	ZINC001035041412	1342893879	/nfs/dbraw/zinc/89/38/79/1342893879.db2.gz	LRJQSILTJPUIGN-MRXNPFEDSA-N	0	3	334.410	3.402	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)c(F)c1	ZINC001035066986	1342908546	/nfs/dbraw/zinc/90/85/46/1342908546.db2.gz	ITPYYDQLEJTQJK-WMLDXEAASA-N	0	3	331.435	3.070	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cccn2C(C)C)C12CCC2	ZINC001078816168	1357096454	/nfs/dbraw/zinc/09/64/54/1357096454.db2.gz	IRAPUKZWWCFFKV-HOTGVXAUSA-N	0	3	335.879	3.452	20	30		EGEDHN
C[C@H]1C[C@H]1C(=O)N1CCC2(CCN(CC#Cc3ccccc3)C2)CC1	ZINC001035156966	1342972205	/nfs/dbraw/zinc/97/22/05/1342972205.db2.gz	OSMVDFOGJOTCJT-AZUAARDMSA-N	0	3	336.479	3.009	20	30		EGEDHN
CC(C)C(=O)N1CCC2(CCN(CC#Cc3ccc(F)cc3)C2)CC1	ZINC001035159062	1342975476	/nfs/dbraw/zinc/97/54/76/1342975476.db2.gz	YERJTJFGRMNSFC-UHFFFAOYSA-N	0	3	342.458	3.148	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CCC2(CCN(CC#Cc3ccccc3)C2)CC1	ZINC001035218489	1343038158	/nfs/dbraw/zinc/03/81/58/1343038158.db2.gz	QSSDUSCYWWEBSS-LJQANCHMSA-N	0	3	342.458	3.101	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC2(CN(Cc3ccc(C4CC4)cc3)C2)CC1	ZINC001035671757	1343130763	/nfs/dbraw/zinc/13/07/63/1343130763.db2.gz	ZMTUEGLHPYZAFX-INIZCTEOSA-N	0	3	337.467	3.148	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@H]1CCC[C@@H]1C(F)F)CC2	ZINC001035721263	1343152175	/nfs/dbraw/zinc/15/21/75/1343152175.db2.gz	SUUCIASDMSKWOA-GJZGRUSLSA-N	0	3	326.431	3.168	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1c(C)[nH]c3ccccc31)CC2	ZINC001035747087	1343167188	/nfs/dbraw/zinc/16/71/88/1343167188.db2.gz	JJLMOZLELJZSAU-UHFFFAOYSA-N	0	3	335.451	3.038	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccc(C)nc1C(C)C)CC2	ZINC001035759763	1343174155	/nfs/dbraw/zinc/17/41/55/1343174155.db2.gz	GOOOAAGHNZUTOU-UHFFFAOYSA-N	0	3	339.483	3.075	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC2(CN(C[C@@H]3CC(C)(C)CO3)C2)CC1	ZINC001035784948	1343194773	/nfs/dbraw/zinc/19/47/73/1343194773.db2.gz	MINJGDHKOUZLFV-PXNSSMCTSA-N	0	3	348.531	3.328	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@@H]1C[C@H]1c1cccc(C)c1)CC2	ZINC001035817781	1343213946	/nfs/dbraw/zinc/21/39/46/1343213946.db2.gz	SZWVXSNZILAVRI-VQTJNVASSA-N	0	3	336.479	3.046	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)CC[C@H]1CC(C)(C)CO1)CC2	ZINC001035841846	1343224444	/nfs/dbraw/zinc/22/44/44/1343224444.db2.gz	MNQQXELAYNKQEU-KRWDZBQOSA-N	0	3	334.504	3.082	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1coc3ccc(F)cc13)CC2	ZINC001035844080	1343225852	/nfs/dbraw/zinc/22/58/52/1343225852.db2.gz	NTGYGQJFEWBJGP-UHFFFAOYSA-N	0	3	340.398	3.133	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc(C3CC3)cn1)CC2	ZINC001035844826	1343226082	/nfs/dbraw/zinc/22/60/82/1343226082.db2.gz	QPTPHLOQJLUBBK-UHFFFAOYSA-N	0	3	325.456	3.073	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1)CC2	ZINC001035858991	1343235193	/nfs/dbraw/zinc/23/51/93/1343235193.db2.gz	OCRIPCVBFDVAEX-RBUKOAKNSA-N	0	3	342.458	3.430	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CCCC2)CC[C@H]1NCc1ccccc1C#N	ZINC001035881325	1343245765	/nfs/dbraw/zinc/24/57/65/1343245765.db2.gz	VWBSPARTDVKXKA-DNVCBOLYSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCCN(C(=O)C=C2CCC2)C1	ZINC001036380486	1343453123	/nfs/dbraw/zinc/45/31/23/1343453123.db2.gz	CMYYCPOSYBKBNV-OXJNMPFZSA-N	0	3	337.467	3.385	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]([C@H](C)NCc2ncc(C)s2)C1	ZINC001036427210	1343480388	/nfs/dbraw/zinc/48/03/88/1343480388.db2.gz	JUEMWGSEKPZOGM-GJZGRUSLSA-N	0	3	335.517	3.380	20	30		EGEDHN
C[C@H]1CCCN(C(=O)C2CCC2)[C@H]1CNCc1ccc(C#N)s1	ZINC001036485340	1343509463	/nfs/dbraw/zinc/50/94/63/1343509463.db2.gz	HMZVBPGEBPEDHD-GUYCJALGSA-N	0	3	331.485	3.137	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccccc2C#N)C1	ZINC001036804189	1343738791	/nfs/dbraw/zinc/73/87/91/1343738791.db2.gz	FTSHETHYLDFJTC-RBUKOAKNSA-N	0	3	339.483	3.417	20	30		EGEDHN
CC1(C(=O)N2CC[C@@H]3[C@H](CCN3CC#Cc3ccccc3)C2)CC=CC1	ZINC001036813508	1343749702	/nfs/dbraw/zinc/74/97/02/1343749702.db2.gz	YINYVNMQYWESOY-NHCUHLMSSA-N	0	3	348.490	3.317	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@H]2CN(C(=O)C3CC4(CC4)C3)CC[C@H]21	ZINC001036818971	1343756914	/nfs/dbraw/zinc/75/69/14/1343756914.db2.gz	LMXIDOAISRZKQU-AZUAARDMSA-N	0	3	349.478	3.171	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@H]2[C@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001036875908	1343814846	/nfs/dbraw/zinc/81/48/46/1343814846.db2.gz	IDEMQHKSSFCKDT-CJNGLKHVSA-N	0	3	331.485	3.089	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccc(F)c(C#N)c2)C1	ZINC001036876699	1343816150	/nfs/dbraw/zinc/81/61/50/1343816150.db2.gz	UKKHLIVRJHSKQC-CRAIPNDOSA-N	0	3	343.446	3.166	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H]2CCC[C@@H]2CNCc2ccccc2C#N)co1	ZINC001036995060	1343917302	/nfs/dbraw/zinc/91/73/02/1343917302.db2.gz	ZVZPITFCHWMPAV-IEBWSBKVSA-N	0	3	337.423	3.148	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCC[C@@H]2CNCc2ccn(CC)n2)CC1	ZINC001037070428	1343964171	/nfs/dbraw/zinc/96/41/71/1343964171.db2.gz	RBPCIAFDSLHBSV-IEBWSBKVSA-N	0	3	344.503	3.024	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCC[C@@H]2CNCc2ccn(C(C)C)n2)C1	ZINC001037071721	1343965416	/nfs/dbraw/zinc/96/54/16/1343965416.db2.gz	KZVHMCGMEWEDHS-SJLPKXTDSA-N	0	3	344.503	3.195	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCC[C@H]2CNCc2ncc(C)s2)C1	ZINC001037074738	1343968113	/nfs/dbraw/zinc/96/81/13/1343968113.db2.gz	FZESKNFTPNGECF-LSDHHAIUSA-N	0	3	333.501	3.182	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCC[C@@H]1NC(=O)c1ccco1	ZINC001037145524	1343995137	/nfs/dbraw/zinc/99/51/37/1343995137.db2.gz	CQZBWUZUMQRYGL-ROUUACIJSA-N	0	3	337.423	3.230	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCC[C@@H]1NC(=O)c1cccnc1	ZINC001037157375	1344007975	/nfs/dbraw/zinc/00/79/75/1344007975.db2.gz	UXEQPPMTDYTUHZ-ICSRJNTNSA-N	0	3	348.450	3.032	20	30		EGEDHN
CC(C)(C)C(=O)N[C@H]1CCCC[C@@H]1CNCc1ccccc1C#N	ZINC001037265762	1344070001	/nfs/dbraw/zinc/07/00/01/1344070001.db2.gz	SNHWPJQFASRASJ-MSOLQXFVSA-N	0	3	327.472	3.369	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](NCc2ccn(CC)n2)[C@@H](CC)C1	ZINC001037889741	1344164176	/nfs/dbraw/zinc/16/41/76/1344164176.db2.gz	GBSZLKGMYPBJPC-FUHWJXTLSA-N	0	3	346.519	3.222	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1coc2ccc(OC)cc12	ZINC001038496190	1344452159	/nfs/dbraw/zinc/45/21/59/1344452159.db2.gz	GEENOHWJFQJLQB-CQSZACIVSA-N	0	3	328.412	3.212	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CCN2C[C@H](OC)C2CCCC2)CC1	ZINC001038667856	1344532405	/nfs/dbraw/zinc/53/24/05/1344532405.db2.gz	QBWHJXJTOKBTER-OALUTQOASA-N	0	3	334.504	3.129	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)/C=C(\C)C2CC2)CC[C@H]1c1ccc(F)cc1	ZINC001079149287	1357196788	/nfs/dbraw/zinc/19/67/88/1357196788.db2.gz	LHECMVBEGDGNCW-VIDFKJSCSA-N	0	3	340.442	3.089	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCN2CC2CCC(C)(C)CC2)cn1	ZINC001038934586	1344660810	/nfs/dbraw/zinc/66/08/10/1344660810.db2.gz	ZOPUTRXQLJTIGM-LJQANCHMSA-N	0	3	339.483	3.083	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1ccc(OCC(C)C)cc1	ZINC001038986601	1344699279	/nfs/dbraw/zinc/69/92/79/1344699279.db2.gz	UNOWVONSMHCVHP-GOSISDBHSA-N	0	3	330.472	3.492	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)C1CC(c2ccc(F)cc2)C1	ZINC001039083657	1344760253	/nfs/dbraw/zinc/76/02/53/1344760253.db2.gz	BGUHCJALYHYZKG-FAFZWHIHSA-N	0	3	330.447	3.476	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)C3(C4CC4)CC3)CC2)C1	ZINC001039205318	1344916585	/nfs/dbraw/zinc/91/65/85/1344916585.db2.gz	POPKGELQXJYROX-INIZCTEOSA-N	0	3	336.907	3.490	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(C)cc(C)n2)C1	ZINC001039210485	1344924498	/nfs/dbraw/zinc/92/44/98/1344924498.db2.gz	AVVKMCUUVFRJSZ-QUCCMNQESA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2sccc2Cl)C1	ZINC001039212985	1344928623	/nfs/dbraw/zinc/92/86/23/1344928623.db2.gz	ZJIQDJIIPKDVJC-HIFRSBDPSA-N	0	3	336.888	3.351	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)Cc2ccccc2CC)C1	ZINC001039219728	1344937156	/nfs/dbraw/zinc/93/71/56/1344937156.db2.gz	UOYRKUNTMMTJIT-RTWAWAEBSA-N	0	3	338.495	3.128	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2c(C)coc2C)C1	ZINC001039221124	1344938878	/nfs/dbraw/zinc/93/88/78/1344938878.db2.gz	KPERNYPXYXLATJ-ROUUACIJSA-N	0	3	328.456	3.236	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)CCc2cccc(C)c2)C1	ZINC001039224379	1344941681	/nfs/dbraw/zinc/94/16/81/1344941681.db2.gz	FQRYFCUKYXAMIJ-LEWJYISDSA-N	0	3	338.495	3.264	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(F)c(C)c2)C1	ZINC001039226526	1344945233	/nfs/dbraw/zinc/94/52/33/1344945233.db2.gz	XWXCSXKTMWFBLX-UYAOXDASSA-N	0	3	342.458	3.474	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cncc(Cl)c2)C1	ZINC001039229981	1344949185	/nfs/dbraw/zinc/94/91/85/1344949185.db2.gz	HFFFJHCJOAMRQG-MAUKXSAKSA-N	0	3	345.874	3.075	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2csc(C(C)C)n2)C1	ZINC001039232424	1344952464	/nfs/dbraw/zinc/95/24/64/1344952464.db2.gz	WDYCZVDUSNMYDE-NVXWUHKLSA-N	0	3	345.512	3.216	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc(F)cc(Cl)c2)C1	ZINC001039240552	1344965725	/nfs/dbraw/zinc/96/57/25/1344965725.db2.gz	XZARZRBZHPMSTR-KSSFIOAISA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cccn2C(C)C)C1	ZINC001039242758	1344969943	/nfs/dbraw/zinc/96/99/43/1344969943.db2.gz	QTZSYURPHFPCNN-ZWKOTPCHSA-N	0	3	327.472	3.019	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccccc2OC)C1	ZINC001039244323	1344971780	/nfs/dbraw/zinc/97/17/80/1344971780.db2.gz	IDCQCJRDTGOFQV-MJGOQNOKSA-N	0	3	340.467	3.035	20	30		EGEDHN
CCc1cccc(CN2CC[C@H]3CC[C@@H](C2)N3C(=O)C#CC2CC2)c1	ZINC001039373957	1345032456	/nfs/dbraw/zinc/03/24/56/1345032456.db2.gz	WBDBNTJJGOKJBC-RTWAWAEBSA-N	0	3	336.479	3.228	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccc2cccnc21	ZINC001039400850	1345047120	/nfs/dbraw/zinc/04/71/20/1345047120.db2.gz	ZLTILUNLCUJZBJ-MSOLQXFVSA-N	0	3	335.451	3.490	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(Cl)cc1F	ZINC001039402200	1345048259	/nfs/dbraw/zinc/04/82/59/1345048259.db2.gz	MSCLPXRHDTWPMG-CABCVRRESA-N	0	3	334.822	3.181	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccc(C)c1Cl	ZINC001039403979	1345049560	/nfs/dbraw/zinc/04/95/60/1345049560.db2.gz	ZRVXIPFIKUOPBR-SJORKVTESA-N	0	3	332.875	3.442	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)Cc1cccs1	ZINC001039445682	1345070546	/nfs/dbraw/zinc/07/05/46/1345070546.db2.gz	CSGRXCYNODYESQ-BBWFWOEESA-N	0	3	330.497	3.015	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1C[C@H]1c1cccc(C)c1	ZINC001039452859	1345075974	/nfs/dbraw/zinc/07/59/74/1345075974.db2.gz	SPCISVCHXYOHTO-IVAOSVALSA-N	0	3	336.479	3.187	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)CCc1ccccc1F	ZINC001039469790	1345086674	/nfs/dbraw/zinc/08/66/74/1345086674.db2.gz	PABDYUZHGMOGML-MSOLQXFVSA-N	0	3	330.447	3.400	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cncc2ccccc21	ZINC001039473962	1345088538	/nfs/dbraw/zinc/08/85/38/1345088538.db2.gz	KVEISEJDFKIBNU-MSOLQXFVSA-N	0	3	335.451	3.490	20	30		EGEDHN
C=C(C)CCC(=O)NCCNCc1cc(F)cc(Br)c1	ZINC001128414332	1373264112	/nfs/dbraw/zinc/26/41/12/1373264112.db2.gz	YKJAGQJCALFBAU-UHFFFAOYSA-N	0	3	343.240	3.150	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CCC[C@@H](C1)N2C[C@H]1C[C@@]12CCOC2	ZINC001039823046	1345199885	/nfs/dbraw/zinc/19/98/85/1345199885.db2.gz	NRLMABZFJZXCIX-DCXXXQMHSA-N	0	3	346.515	3.081	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@]3(CCN(C(=O)CC4CC4)C3)C2)cc1	ZINC001040037839	1345304683	/nfs/dbraw/zinc/30/46/83/1345304683.db2.gz	IWKOGDOAHFRJFZ-NRFANRHFSA-N	0	3	337.467	3.173	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@]2(C1)CCCN(Cc1cccc(C#N)c1)C2	ZINC001040048546	1345311056	/nfs/dbraw/zinc/31/10/56/1345311056.db2.gz	YJICWPUEZTVNNZ-OAQYLSRUSA-N	0	3	339.483	3.419	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3oc(CC4CC4)nc3C)C2)C1	ZINC001040202977	1345373985	/nfs/dbraw/zinc/37/39/85/1345373985.db2.gz	VCJXSQXBHFWEMF-FQEVSTJZSA-N	0	3	343.471	3.050	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cccc(C)c3F)C2)C1	ZINC001040217663	1345378807	/nfs/dbraw/zinc/37/88/07/1345378807.db2.gz	WBMMHBKTUBVANR-HXUWFJFHSA-N	0	3	328.431	3.086	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3cccc(Cl)c3C)C2)C1	ZINC001040218142	1345378911	/nfs/dbraw/zinc/37/89/11/1345378911.db2.gz	XTTKZEXVDFWTNM-LJQANCHMSA-N	0	3	330.859	3.210	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3ccn(C4CCCC4)n3)C2)C1	ZINC001040233406	1345387710	/nfs/dbraw/zinc/38/77/10/1345387710.db2.gz	UJEDULXDUBVVIX-HXUWFJFHSA-N	0	3	342.487	3.112	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3nccc4ccsc43)C2)C1	ZINC001040252210	1345395743	/nfs/dbraw/zinc/39/57/43/1345395743.db2.gz	FBSFGJPUOZXZJB-LJQANCHMSA-N	0	3	341.480	3.410	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3nccc4ccsc43)C2)C1	ZINC001040252208	1345396168	/nfs/dbraw/zinc/39/61/68/1345396168.db2.gz	FBSFGJPUOZXZJB-IBGZPJMESA-N	0	3	341.480	3.410	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cc(F)ccc3CC)C2)C1	ZINC001040281364	1345409607	/nfs/dbraw/zinc/40/96/07/1345409607.db2.gz	NNCGINOXWRGQKG-OAQYLSRUSA-N	0	3	342.458	3.340	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(C)c(Cl)c3F)C2)C1	ZINC001040310650	1345424976	/nfs/dbraw/zinc/42/49/76/1345424976.db2.gz	QDGYTFHVNIRUOB-LJQANCHMSA-N	0	3	348.849	3.349	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(C)nc3C(C)C)C2)C1	ZINC001040317094	1345427697	/nfs/dbraw/zinc/42/76/97/1345427697.db2.gz	KSKZPILLBFHCKA-OAQYLSRUSA-N	0	3	339.483	3.075	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)C[C@H](C)c3cccc(F)c3)C2)C1	ZINC001040383150	1345467896	/nfs/dbraw/zinc/46/78/96/1345467896.db2.gz	GFTPDSYRGTZJFU-UWJYYQICSA-N	0	3	342.458	3.267	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@H]3CCCC(F)(F)C3)C2)C1	ZINC001040392047	1345472977	/nfs/dbraw/zinc/47/29/77/1345472977.db2.gz	SPZMINLTCXOOBJ-FUHWJXTLSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cc(F)cc(Cl)c3)C2)C1	ZINC001040417569	1345485765	/nfs/dbraw/zinc/48/57/65/1345485765.db2.gz	GMUVZVZQRMHNQL-LJQANCHMSA-N	0	3	348.849	3.431	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)Cc3ccc(CC)cc3)C2)C1	ZINC001040426665	1345491803	/nfs/dbraw/zinc/49/18/03/1345491803.db2.gz	XMBXKMHUDQRIQD-JOCHJYFZSA-N	0	3	338.495	3.129	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@@H](CC)OC3CCCC3)C2)C1	ZINC001040432294	1345494567	/nfs/dbraw/zinc/49/45/67/1345494567.db2.gz	RTMSQURBSAZAKM-CTNGQTDRSA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)CCc3cc(C)cc(C)c3)C2)C1	ZINC001040485150	1345516240	/nfs/dbraw/zinc/51/62/40/1345516240.db2.gz	WXJCEKWDLYZZEM-JOCHJYFZSA-N	0	3	338.495	3.184	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ccccc3Cl)C2)C1	ZINC001040503454	1345523503	/nfs/dbraw/zinc/52/35/03/1345523503.db2.gz	UACSJBYIMODIDD-IBGZPJMESA-N	0	3	330.859	3.291	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)CCc3ccccc3Cl)C2)C1	ZINC001040521586	1345531574	/nfs/dbraw/zinc/53/15/74/1345531574.db2.gz	AQETZRDVOZRZKL-FQEVSTJZSA-N	0	3	344.886	3.220	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3csc4c3CCCC4)C2)C1	ZINC001040523553	1345532593	/nfs/dbraw/zinc/53/25/93/1345532593.db2.gz	YVLDUSQHOQVOEC-HXUWFJFHSA-N	0	3	342.508	3.188	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@H](C)c3cccc(Cl)c3)C2)C1	ZINC001040537530	1345536424	/nfs/dbraw/zinc/53/64/24/1345536424.db2.gz	ATMWSAFLUNBAPA-UZLBHIALSA-N	0	3	344.886	3.391	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(-c4ccccc4)[nH]3)C2)C1	ZINC001040552173	1345544176	/nfs/dbraw/zinc/54/41/76/1345544176.db2.gz	XLSYQBXDCDOPJY-JOCHJYFZSA-N	0	3	347.462	3.243	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3c(C)cc(F)cc3C)C2)CC1	ZINC001040801313	1345579463	/nfs/dbraw/zinc/57/94/63/1345579463.db2.gz	SSAGYLPSDKTDBN-UHFFFAOYSA-N	0	3	328.431	3.004	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC2(C1)CCN(Cc1ocnc1C)CC2	ZINC001040836098	1345585597	/nfs/dbraw/zinc/58/55/97/1345585597.db2.gz	PYMFEWOMFUZFQF-LJQANCHMSA-N	0	3	345.487	3.400	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cccc4c3ccn4C)C2)CC1	ZINC001040882892	1345594195	/nfs/dbraw/zinc/59/41/95/1345594195.db2.gz	MYSYAGWIXMDZTR-UHFFFAOYSA-N	0	3	349.478	3.130	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccc(F)cc3C)C2)CC1	ZINC001040920286	1345600223	/nfs/dbraw/zinc/60/02/23/1345600223.db2.gz	LWPHDBVBCMGINE-UHFFFAOYSA-N	0	3	328.431	3.086	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)C34CC5CC(CC(C5)C3)C4)C2)CC1	ZINC001040923854	1345601303	/nfs/dbraw/zinc/60/13/03/1345601303.db2.gz	QXEOYMCXVGCIDW-UHFFFAOYSA-N	0	3	340.511	3.151	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3oc4ccccc4c3C)C2)CC1	ZINC001040930920	1345603947	/nfs/dbraw/zinc/60/39/47/1345603947.db2.gz	AGUYWOHRHBKXDO-UHFFFAOYSA-N	0	3	336.435	3.303	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC[C@@]2(CCN(Cc3cccc(C(F)F)c3)C2)C1	ZINC001041136669	1345658266	/nfs/dbraw/zinc/65/82/66/1345658266.db2.gz	NFFSJYSIJJNNPR-IFXJQAMLSA-N	0	3	347.409	3.208	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@]2(CCN(Cc3cccnc3)C2)C1	ZINC001041322723	1345703039	/nfs/dbraw/zinc/70/30/39/1345703039.db2.gz	WEEGWIWLRMOJKH-LJQANCHMSA-N	0	3	347.890	3.285	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3cccc4c3CCCCC4)C2)C1	ZINC001041388377	1345714157	/nfs/dbraw/zinc/71/41/57/1345714157.db2.gz	WJBDYVZCRNZYJE-JOCHJYFZSA-N	0	3	336.479	3.127	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3ccccc3CC(C)(C)C)C2)C1	ZINC001041389384	1345714587	/nfs/dbraw/zinc/71/45/87/1345714587.db2.gz	KHSSVEQFCOVCSP-JOCHJYFZSA-N	0	3	338.495	3.446	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)C3(c4ccccc4)CCC3)C2)C1	ZINC001041452272	1345731592	/nfs/dbraw/zinc/73/15/92/1345731592.db2.gz	BJMKZGWVDNXYFC-NRFANRHFSA-N	0	3	336.479	3.056	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cc4c(cc(C)cc4C)[nH]3)C2)C1	ZINC001041515066	1345748943	/nfs/dbraw/zinc/74/89/43/1345748943.db2.gz	NTCZJNDKKGFDOC-JOCHJYFZSA-N	0	3	349.478	3.346	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)[C@@H](C)c3ccc(Cl)cc3)C2)C1	ZINC001041629574	1345802036	/nfs/dbraw/zinc/80/20/36/1345802036.db2.gz	BMMCBQJVEZNWHO-OXJNMPFZSA-N	0	3	344.886	3.391	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001041698053	1345821700	/nfs/dbraw/zinc/82/17/00/1345821700.db2.gz	PIJGOLSBMFBRCA-SFHLNBCPSA-N	0	3	337.467	3.029	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)[C@H](C)Cc3ccccc3Cl)C2)C1	ZINC001041714969	1345828640	/nfs/dbraw/zinc/82/86/40/1345828640.db2.gz	AXDPSYYXYXIYHM-UZLBHIALSA-N	0	3	344.886	3.076	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001041719308	1345830003	/nfs/dbraw/zinc/83/00/03/1345830003.db2.gz	AMLXCABWPCOMDM-UWJYYQICSA-N	0	3	339.483	3.275	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cccc(C(F)F)c3)C2)C1	ZINC001041794113	1345852882	/nfs/dbraw/zinc/85/28/82/1345852882.db2.gz	QFNAFFHYVUJXFR-LJQANCHMSA-N	0	3	332.394	3.186	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)C3CCC(C4CC4)CC3)C2)C1	ZINC001041809346	1345858072	/nfs/dbraw/zinc/85/80/72/1345858072.db2.gz	HZXFQSAHLXRRMS-GRERDSQWSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccc(F)c4occc43)C2)C1	ZINC001041839312	1345868715	/nfs/dbraw/zinc/86/87/15/1345868715.db2.gz	LLEHVWXZNMBEAF-FQEVSTJZSA-N	0	3	340.398	3.133	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)CC(C)(C)c3ccccc3)C2)C1	ZINC001041842467	1345869715	/nfs/dbraw/zinc/86/97/15/1345869715.db2.gz	GNBXVSXJOWBTOA-JOCHJYFZSA-N	0	3	338.495	3.302	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)C3(C(F)(F)F)CCCCC3)C2)C1	ZINC001041855763	1345875089	/nfs/dbraw/zinc/87/50/89/1345875089.db2.gz	NXOVJTAXBWMYFR-INIZCTEOSA-N	0	3	342.405	3.057	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)[C@H](C)Cc3cccc(Cl)c3)C2)C1	ZINC001041856009	1345875159	/nfs/dbraw/zinc/87/51/59/1345875159.db2.gz	WAHOSPMBOHRPDL-OXQOHEQNSA-N	0	3	344.886	3.076	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@@H]2CCN(Cc3cccc(C#N)c3)[C@H]2C1	ZINC001041906189	1345889900	/nfs/dbraw/zinc/88/99/00/1345889900.db2.gz	FOVXBRNWNNDXSD-OALUTQOASA-N	0	3	325.456	3.027	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@H]2CCN(Cc3cccc(C#N)c3)[C@@H]2C1	ZINC001041948947	1345906003	/nfs/dbraw/zinc/90/60/03/1345906003.db2.gz	AHOFFFHBNHYHIU-WOJBJXKFSA-N	0	3	339.483	3.417	20	30		EGEDHN
C/C(=C\C(=O)N1CC[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@@H]2C1)C1CC1	ZINC001041962096	1345907603	/nfs/dbraw/zinc/90/76/03/1345907603.db2.gz	QIJPCQHZWKDTNI-JVZHIWDNSA-N	0	3	349.478	3.337	20	30		EGEDHN
C/C(=C/C(=O)N1CC[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@H]2C1)C1CC1	ZINC001041962099	1345907690	/nfs/dbraw/zinc/90/76/90/1345907690.db2.gz	QIJPCQHZWKDTNI-UMOOWGPGSA-N	0	3	349.478	3.337	20	30		EGEDHN
CC(C(=O)N1CC[C@@H]2CCN(Cc3cccc(C#N)c3)[C@@H]2C1)=C1CCC1	ZINC001042054056	1345932168	/nfs/dbraw/zinc/93/21/68/1345932168.db2.gz	GKSSBFQMYAPJIX-LEWJYISDSA-N	0	3	349.478	3.481	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cccc4scnc43)C[C@H]21	ZINC001042060108	1345932938	/nfs/dbraw/zinc/93/29/38/1345932938.db2.gz	HUTGTGKTGVKMAU-DZGCQCFKSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cccc4scnc43)C[C@@H]21	ZINC001042060115	1345933091	/nfs/dbraw/zinc/93/30/91/1345933091.db2.gz	HUTGTGKTGVKMAU-ZFWWWQNUSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(C(C)(C)C)cn3)C[C@H]21	ZINC001042065076	1345934049	/nfs/dbraw/zinc/93/40/49/1345934049.db2.gz	OJWUYFFJXAWTFP-CRAIPNDOSA-N	0	3	327.472	3.102	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3c(C)noc3C(F)F)C[C@H]21	ZINC001042100458	1345944097	/nfs/dbraw/zinc/94/40/97/1345944097.db2.gz	GGRVVGHRLGVBSA-QWHCGFSZSA-N	0	3	339.386	3.033	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CCN(C(=O)C4(C5CC5)CC4)C[C@@H]32)cc1	ZINC001042106391	1345945794	/nfs/dbraw/zinc/94/57/94/1345945794.db2.gz	BWPQBYMMVYBUKT-QUCCMNQESA-N	0	3	349.478	3.171	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(C)n(C(CC)CC)n3)C[C@H]21	ZINC001042125447	1345950792	/nfs/dbraw/zinc/95/07/92/1345950792.db2.gz	UHBXSKMOPBAPPS-QFBILLFUSA-N	0	3	344.503	3.275	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(-c4ccccc4)on3)C[C@H]21	ZINC001042141709	1345954515	/nfs/dbraw/zinc/95/45/15/1345954515.db2.gz	IMUCSXYFASLICF-MAUKXSAKSA-N	0	3	337.423	3.064	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cn(CC)c4ccccc34)C[C@@H]21	ZINC001042142059	1345955156	/nfs/dbraw/zinc/95/51/56/1345955156.db2.gz	KVOFYNYPZSCQMB-UTKZUKDTSA-N	0	3	349.478	3.221	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3c(C)[nH]c4ccccc43)C[C@@H]21	ZINC001042142025	1345955178	/nfs/dbraw/zinc/95/51/78/1345955178.db2.gz	KPSYNXZRZBRVKB-APWZRJJASA-N	0	3	335.451	3.036	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)CCc3ccc(C(C)C)cc3)C[C@@H]21	ZINC001042150730	1345957205	/nfs/dbraw/zinc/95/72/05/1345957205.db2.gz	YXLHHTYOCAJLEW-RTWAWAEBSA-N	0	3	338.495	3.299	20	30		EGEDHN
C#CCN1CC[C@H]2CCN(C(=O)Cc3ccc(C4CCC4)cc3)C[C@@H]21	ZINC001042167428	1345963293	/nfs/dbraw/zinc/96/32/93/1345963293.db2.gz	LSDWOOHGKWJEMV-SFTDATJTSA-N	0	3	336.479	3.053	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3c(C)cc(F)cc3C)C[C@@H]21	ZINC001042184010	1345971676	/nfs/dbraw/zinc/97/16/76/1345971676.db2.gz	SHMLDWVVTYMLEM-WMZOPIPTSA-N	0	3	328.431	3.002	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3cnccc3C)[C@@H]2C1	ZINC001042186836	1345974385	/nfs/dbraw/zinc/97/43/85/1345974385.db2.gz	JVPPKDRPMFGQAE-FUHWJXTLSA-N	0	3	327.472	3.025	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3cc(F)c(F)cc3F)C[C@@H]21	ZINC001042207559	1345985513	/nfs/dbraw/zinc/98/55/13/1345985513.db2.gz	RNJIZQFKOQHFEA-PXAZEXFGSA-N	0	3	338.373	3.216	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc(Cl)c(C)c3)C[C@H]21	ZINC001042214970	1345989194	/nfs/dbraw/zinc/98/91/94/1345989194.db2.gz	WSDCNBZBKROQHH-CRAIPNDOSA-N	0	3	330.859	3.208	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(F)cc4cccnc43)C[C@@H]21	ZINC001042254635	1346007168	/nfs/dbraw/zinc/00/71/68/1346007168.db2.gz	MUTPFTHUYZZNTN-KDOFPFPSSA-N	0	3	339.414	3.096	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cccc(N4CCCC4)c3)C[C@@H]21	ZINC001042286764	1346017881	/nfs/dbraw/zinc/01/78/81/1346017881.db2.gz	CLQJLEXPGZQWRQ-PXNSSMCTSA-N	0	3	339.483	3.009	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C34CC5CC(CC(C5)C3)C4)C[C@H]21	ZINC001042325596	1346034244	/nfs/dbraw/zinc/03/42/44/1346034244.db2.gz	DQDBEJYYPSJWBE-GELQRLDPSA-N	0	3	328.500	3.312	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(C)n(C(C)C)c3C)C[C@@H]21	ZINC001042346590	1346048477	/nfs/dbraw/zinc/04/84/77/1346048477.db2.gz	UZWTZPUPWRKIEY-MJGOQNOKSA-N	0	3	329.488	3.408	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc4[nH]c(C)c(C)c4c3)C[C@H]21	ZINC001042348194	1346049083	/nfs/dbraw/zinc/04/90/83/1346049083.db2.gz	HFEGPZSQGVABSR-DYESRHJHSA-N	0	3	349.478	3.344	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C(C)(C)c3ccc(OC)cc3)C[C@H]21	ZINC001042362041	1346055548	/nfs/dbraw/zinc/05/55/48/1346055548.db2.gz	GXYXDAPYFDGMPE-VQIMIIECSA-N	0	3	342.483	3.082	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3sccc3C(C)C)C[C@H]21	ZINC001042368268	1346059138	/nfs/dbraw/zinc/05/91/38/1346059138.db2.gz	OYNFTUDYWIYMSR-NVXWUHKLSA-N	0	3	330.497	3.431	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3sccc3C(C)C)C[C@@H]21	ZINC001042368272	1346059226	/nfs/dbraw/zinc/05/92/26/1346059226.db2.gz	OYNFTUDYWIYMSR-RDJZCZTQSA-N	0	3	330.497	3.431	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3cc4c(cccc4C)o3)C[C@@H]21	ZINC001042373918	1346062239	/nfs/dbraw/zinc/06/22/39/1346062239.db2.gz	DZEMHWFFTSEELV-AEFFLSMTSA-N	0	3	336.435	3.301	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C34CC(c5ccccc5)(C3)C4)C[C@H]21	ZINC001042376046	1346063104	/nfs/dbraw/zinc/06/31/04/1346063104.db2.gz	NSKFPGUNJGJDLU-AZIUHJDESA-N	0	3	336.479	3.217	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C3(C(F)(F)F)CCCC3)C[C@H]21	ZINC001042379157	1346064848	/nfs/dbraw/zinc/06/48/48/1346064848.db2.gz	HFRSTOSQEOGUDK-HUUCEWRRSA-N	0	3	342.405	3.055	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc(CC)c(CC)c3)C[C@@H]21	ZINC001042378943	1346064941	/nfs/dbraw/zinc/06/49/41/1346064941.db2.gz	CHLUVEPMOLSMMZ-CTNGQTDRSA-N	0	3	338.495	3.371	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)C1CCCC1	ZINC001044413168	1346321272	/nfs/dbraw/zinc/32/12/72/1346321272.db2.gz	NNRFRAZSXFZPIU-BEFAXECRSA-N	0	3	325.456	3.218	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)/C=C\c1ccco1	ZINC001044430956	1346328321	/nfs/dbraw/zinc/32/83/21/1346328321.db2.gz	KKAMLHBANLDIRN-RQUZMNLWSA-N	0	3	349.434	3.334	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@H](NCc2cc(F)ccc2C#N)C[C@H]1C	ZINC001044433949	1346329347	/nfs/dbraw/zinc/32/93/47/1346329347.db2.gz	VPQJRPCYXFMZDR-KDOFPFPSSA-N	0	3	329.419	3.133	20	30		EGEDHN
C[C@@H]1C[C@@H]([NH2+]Cc2ccc(C#N)cc2)CCN1C(=O)c1ccccc1[O-]	ZINC001044477226	1346344097	/nfs/dbraw/zinc/34/40/97/1346344097.db2.gz	ZXNACIYOXXQECJ-QAPCUYQASA-N	0	3	349.434	3.047	20	30		EGEDHN
C[C@H]1C[C@H](NCc2cc(F)ccc2C#N)CCN1C(=O)C1=CCCC1	ZINC001044544781	1346365836	/nfs/dbraw/zinc/36/58/36/1346365836.db2.gz	VYOYXGDKQKVFBT-IFXJQAMLSA-N	0	3	341.430	3.277	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3nccnc3C)C[C@H]2C)CC1	ZINC001044730251	1346414600	/nfs/dbraw/zinc/41/46/00/1346414600.db2.gz	OJPGIBSNVBRNDY-QAPCUYQASA-N	0	3	342.487	3.001	20	30		EGEDHN
CC(C(=O)N1CCC[C@H]1CNCc1ccc(C#N)cc1F)=C1CCC1	ZINC001045034352	1346483773	/nfs/dbraw/zinc/48/37/73/1346483773.db2.gz	QAYWCYNSYGLSLW-SFHVURJKSA-N	0	3	341.430	3.278	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H]1CNCc1ccc(C#N)c(F)c1)C(C)(C)C	ZINC001045093595	1346493910	/nfs/dbraw/zinc/49/39/10/1346493910.db2.gz	ZMBCAUDKVHLDHP-PBHICJAKSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC1(C)CC[C@H]1C(=O)N1CCC[C@H]1CNCc1ccc(C#N)s1	ZINC001045159875	1346510285	/nfs/dbraw/zinc/51/02/85/1346510285.db2.gz	HPLNXALWZNQLNR-BBRMVZONSA-N	0	3	331.485	3.137	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@H]2CNCc2c(C)noc2C)CC1	ZINC001045182780	1346517495	/nfs/dbraw/zinc/51/74/95/1346517495.db2.gz	ZJKVFXFQRJVZNG-KRWDZBQOSA-N	0	3	331.460	3.118	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H]1CNCc1c(C)onc1CC	ZINC001045182228	1346517778	/nfs/dbraw/zinc/51/77/78/1346517778.db2.gz	PEIUAHHIPBGPCZ-KXBFYZLASA-N	0	3	333.476	3.228	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H]1CNCc1c(C)nsc1C	ZINC001045186015	1346522120	/nfs/dbraw/zinc/52/21/20/1346522120.db2.gz	UJNBLBQFMLWMAS-YJBOKZPZSA-N	0	3	335.517	3.443	20	30		EGEDHN
Cc1cc(CN2CCC(C)(NC(=O)c3cc(C#N)c[nH]3)CC2)cs1	ZINC001045400912	1346583877	/nfs/dbraw/zinc/58/38/77/1346583877.db2.gz	HHVKKYAQFOPDEF-UHFFFAOYSA-N	0	3	342.468	3.041	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)[C@H]2CCC[C@H](C(F)(F)F)C2)CC1	ZINC001045482526	1346605108	/nfs/dbraw/zinc/60/51/08/1346605108.db2.gz	NHAMIQBHZCGUOI-GJZGRUSLSA-N	0	3	344.421	3.349	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)[C@@H]2C[C@H]2c2cccc(F)c2F)CC1	ZINC001045643446	1346656834	/nfs/dbraw/zinc/65/68/34/1346656834.db2.gz	DRWDOYAYJMNVIU-JKSUJKDBSA-N	0	3	346.421	3.062	20	30		EGEDHN
CCC(=O)N1CCCC[C@@]2(CCN(Cc3ccc(C#N)s3)C2)C1	ZINC001045902346	1346739840	/nfs/dbraw/zinc/73/98/40/1346739840.db2.gz	AATRRBNVDWOOSN-SFHVURJKSA-N	0	3	331.485	3.234	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc(C)sc1C)C2	ZINC001045950612	1346785684	/nfs/dbraw/zinc/78/56/84/1346785684.db2.gz	HJLPTVIQUFAPLJ-LJQANCHMSA-N	0	3	330.497	3.316	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1occc1C(C)C)C2	ZINC001045961122	1346796407	/nfs/dbraw/zinc/79/64/07/1346796407.db2.gz	HBMXZLYHLACVOF-FQEVSTJZSA-N	0	3	328.456	3.354	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)Cc1cccc(Cl)c1)C2	ZINC001045963367	1346798062	/nfs/dbraw/zinc/79/80/62/1346798062.db2.gz	YFDILMUVGAMPKZ-HXUWFJFHSA-N	0	3	344.886	3.220	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)C1(C(C)(F)F)CC1)C2	ZINC001045967001	1346802111	/nfs/dbraw/zinc/80/21/11/1346802111.db2.gz	KYTOVOSIDWSVCI-SFHVURJKSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cccc3[nH]ccc31)C2	ZINC001045967748	1346803424	/nfs/dbraw/zinc/80/34/24/1346803424.db2.gz	BXQMXDBNHIWXAZ-OAQYLSRUSA-N	0	3	335.451	3.119	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc(F)ccc1Cl)C2	ZINC001045970778	1346806076	/nfs/dbraw/zinc/80/60/76/1346806076.db2.gz	LFVVJDITKAVOQR-IBGZPJMESA-N	0	3	348.849	3.431	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@H]1C[C@@H]1c1ccccc1)C2	ZINC001045972731	1346808873	/nfs/dbraw/zinc/80/88/73/1346808873.db2.gz	HMDHDLKXDOJWKT-URVUXULASA-N	0	3	336.479	3.128	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)Cc1ccsc1C)C2	ZINC001045972866	1346809498	/nfs/dbraw/zinc/80/94/98/1346809498.db2.gz	JMELJINVQZLKGH-HXUWFJFHSA-N	0	3	344.524	3.327	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1occ3c1CCCC3)C2	ZINC001045982018	1346821296	/nfs/dbraw/zinc/82/12/96/1346821296.db2.gz	LWWQICOTURXDHC-OAQYLSRUSA-N	0	3	340.467	3.110	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc3c(c1)CCC3)C2	ZINC001045982739	1346821772	/nfs/dbraw/zinc/82/17/72/1346821772.db2.gz	DYXHEZSYBMPMPH-JOCHJYFZSA-N	0	3	336.479	3.127	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H]1CC3CCC1CC3)C2	ZINC001045986407	1346827723	/nfs/dbraw/zinc/82/77/23/1346827723.db2.gz	PTDZDVBDGUJKEV-BRAJZSMUSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc(CF)cc1)C2	ZINC001045986691	1346828479	/nfs/dbraw/zinc/82/84/79/1346828479.db2.gz	YJTFRDGSDLMKCF-NRFANRHFSA-N	0	3	342.458	3.498	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@H](C)Cc1ccccc1)C2	ZINC001045986645	1346828782	/nfs/dbraw/zinc/82/87/82/1346828782.db2.gz	WXHLOMITWQDTSA-DENIHFKCSA-N	0	3	338.495	3.203	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)C1(C)C(C)(C)C1(C)C)C2	ZINC001045987527	1346829074	/nfs/dbraw/zinc/82/90/74/1346829074.db2.gz	USNKXZTUHKNBFK-NRFANRHFSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1c(C)cccc1F)C2	ZINC001045987662	1346829172	/nfs/dbraw/zinc/82/91/72/1346829172.db2.gz	YGJOMKHMDOEPTK-HXUWFJFHSA-N	0	3	328.431	3.086	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc(F)s1)C2	ZINC001045987692	1346829213	/nfs/dbraw/zinc/82/92/13/1346829213.db2.gz	YZJOEBQBJGEWFQ-SFHVURJKSA-N	0	3	334.460	3.229	20	30		EGEDHN
C#CCCN1CC[C@](C)(NC(=O)c2csc3cc(C)ccc23)C1	ZINC001046354974	1346947432	/nfs/dbraw/zinc/94/74/32/1346947432.db2.gz	IAJMXIXJYCCNHZ-IBGZPJMESA-N	0	3	326.465	3.427	20	30		EGEDHN
C#CCCN1CC[C@](C)(NC(=O)c2cc(Cl)sc2Cl)C1	ZINC001046378791	1346955778	/nfs/dbraw/zinc/95/57/78/1346955778.db2.gz	YPPLEKBIGSHWJG-AWEZNQCLSA-N	0	3	331.268	3.272	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2cc3c([nH]2)c(F)ccc3C)C1	ZINC001046437256	1346975494	/nfs/dbraw/zinc/97/54/94/1346975494.db2.gz	UROPYJRBRXQPGP-IBGZPJMESA-N	0	3	329.419	3.386	20	30		EGEDHN
C=C(C)CCN1CC[C@](C)(NC(=O)c2cnc(CC3CC3)s2)C1	ZINC001046510747	1346999946	/nfs/dbraw/zinc/99/99/46/1346999946.db2.gz	YNKZGCWDLNZSEQ-SFHVURJKSA-N	0	3	333.501	3.256	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@]2(C)CCN(Cc3ccc(C)cc3)C2)cc1	ZINC001046532634	1347007139	/nfs/dbraw/zinc/00/71/39/1347007139.db2.gz	YSTHKQSBNARNFD-JOCHJYFZSA-N	0	3	332.447	3.371	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2cccc(N3CCCC3)c2)C1	ZINC001046725883	1347074068	/nfs/dbraw/zinc/07/40/68/1347074068.db2.gz	GFFNKYPIIDNIGC-FQEVSTJZSA-N	0	3	327.472	3.057	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2ccc(C(F)(F)F)cc2)C1	ZINC001046792035	1347104964	/nfs/dbraw/zinc/10/49/64/1347104964.db2.gz	BHEMOICBUCEOFX-INIZCTEOSA-N	0	3	326.362	3.476	20	30		EGEDHN
C#CCCN1CC[C@@](C)(NC(=O)c2cc(Cl)cc(Cl)c2)C1	ZINC001046799987	1347109862	/nfs/dbraw/zinc/10/98/62/1347109862.db2.gz	XGLOZJOOLJOYRZ-MRXNPFEDSA-N	0	3	325.239	3.211	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@H](CNC(=O)[C@H]2CCCC3(CC3)C2)C1	ZINC001046939166	1347157917	/nfs/dbraw/zinc/15/79/17/1347157917.db2.gz	KJKCRAZTGKFYJM-JKSUJKDBSA-N	0	3	338.442	3.054	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2cc[nH]c2C2CC2)C1	ZINC001046971862	1347171913	/nfs/dbraw/zinc/17/19/13/1347171913.db2.gz	SQOITMWTYXUJQI-CQSZACIVSA-N	0	3	337.414	3.155	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)c3cccs3)C2)CC1	ZINC001047220930	1347252708	/nfs/dbraw/zinc/25/27/08/1347252708.db2.gz	KSBLMUTWEGGYCQ-KRWDZBQOSA-N	0	3	330.497	3.336	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)c3cccc(F)c3)C2)CC1	ZINC001047222349	1347253620	/nfs/dbraw/zinc/25/36/20/1347253620.db2.gz	XGTBZJAZIFPOCD-LJQANCHMSA-N	0	3	342.458	3.413	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)C[C@@H]3C=CCC3)C2)CC1	ZINC001047224016	1347254156	/nfs/dbraw/zinc/25/41/56/1347254156.db2.gz	UKTZQCXBBXVPNN-UYAOXDASSA-N	0	3	328.500	3.317	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)c3scnc3C)C2)CC1	ZINC001047227508	1347258394	/nfs/dbraw/zinc/25/83/94/1347258394.db2.gz	GTZHIDVDJDDHHN-KRWDZBQOSA-N	0	3	345.512	3.039	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@]3(C)CC=CCC3)C2)CC1	ZINC001047240109	1347266142	/nfs/dbraw/zinc/26/61/42/1347266142.db2.gz	ZZFURDYPUKMYBC-PZJWPPBQSA-N	0	3	328.500	3.317	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3cccc(F)c3F)C2)CC1	ZINC001047247683	1347273022	/nfs/dbraw/zinc/27/30/22/1347273022.db2.gz	IEGNTJUONYITRP-MRXNPFEDSA-N	0	3	346.421	3.162	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)C(C)(C)C(F)F)C2)CC1	ZINC001047253987	1347278291	/nfs/dbraw/zinc/27/82/91/1347278291.db2.gz	LQOUCENMWJAKQK-INIZCTEOSA-N	0	3	340.458	3.252	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)C3CC4(CC4)C3)C2)CC1	ZINC001047256992	1347280231	/nfs/dbraw/zinc/28/02/31/1347280231.db2.gz	OJCDSRFRCNMGHV-GOSISDBHSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@@H]3C[C@H]3C3CCC3)C2)CC1	ZINC001047256788	1347280289	/nfs/dbraw/zinc/28/02/89/1347280289.db2.gz	CDQHCXCZCLQCHA-HSALFYBXSA-N	0	3	328.500	3.006	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3oc(CC)cc3C)C2)CC1	ZINC001047265320	1347286411	/nfs/dbraw/zinc/28/64/11/1347286411.db2.gz	YOFBPSALYPWSMJ-GOSISDBHSA-N	0	3	342.483	3.348	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)CCC2CCC2)C1	ZINC001047787969	1347371620	/nfs/dbraw/zinc/37/16/20/1347371620.db2.gz	VAPGQHUHNCEHFY-UZLBHIALSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@@H]([C@@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001047791343	1347373446	/nfs/dbraw/zinc/37/34/46/1347373446.db2.gz	URQSTSWVOIGUCI-UKRRQHHQSA-N	0	3	347.409	3.287	20	30		EGEDHN
CC(C)=C(F)C(=O)N1C[C@H](C)[C@@H](CNCc2ccccc2C#N)C1	ZINC001048203849	1347493039	/nfs/dbraw/zinc/49/30/39/1347493039.db2.gz	KXIDRRSKXHEITE-YOEHRIQHSA-N	0	3	329.419	3.006	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001048268914	1347506960	/nfs/dbraw/zinc/50/69/60/1347506960.db2.gz	HLSAMCOYNWWSAB-VQIMIIECSA-N	0	3	341.499	3.425	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1C[C@H](C)[C@H](CNCc2ccccc2C#N)C1	ZINC001048268913	1347506972	/nfs/dbraw/zinc/50/69/72/1347506972.db2.gz	HLSAMCOYNWWSAB-QFBILLFUSA-N	0	3	341.499	3.425	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](CNCc2cc(C3CC3)no2)[C@H](C)C1	ZINC001048340823	1347523786	/nfs/dbraw/zinc/52/37/86/1347523786.db2.gz	UJKVVJURJUWRDI-GDBMZVCRSA-N	0	3	345.487	3.338	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H](C)[C@@H](CNCc2csc(C3CC3)n2)C1	ZINC001048341882	1347524202	/nfs/dbraw/zinc/52/42/02/1347524202.db2.gz	FPPIEBOTHNRRQE-ZFWWWQNUSA-N	0	3	347.528	3.417	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1C#N	ZINC001048500053	1347569294	/nfs/dbraw/zinc/56/92/94/1347569294.db2.gz	WYAYLEBVNCALMF-LXWRTIBQSA-N	0	3	337.467	3.073	20	30		EGEDHN
N#Cc1ccccc1CN1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)c1ccc[nH]1)C2	ZINC001048505360	1347571645	/nfs/dbraw/zinc/57/16/45/1347571645.db2.gz	QRIVAGZDDAKYED-IDHPPYADSA-N	0	3	348.450	3.059	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)[C@H]2CC=CCC2)CC1	ZINC001048625258	1347623510	/nfs/dbraw/zinc/62/35/10/1347623510.db2.gz	RYVMZQAXRLRMNS-SFHVURJKSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H]3CN(CCC(F)(F)F)C[C@H]3C2)CC1	ZINC001049028716	1347710975	/nfs/dbraw/zinc/71/09/75/1347710975.db2.gz	JHDRJHGZPUPWSO-GASCZTMLSA-N	0	3	330.394	3.075	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc4cc(C)c(C)cc4o3)C[C@@H]2C1	ZINC001049173748	1347738692	/nfs/dbraw/zinc/73/86/92/1347738692.db2.gz	GAXNOKNGLANVSH-HDICACEKSA-N	0	3	336.435	3.077	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)C2CCCC2)cc1	ZINC001049280375	1347767884	/nfs/dbraw/zinc/76/78/84/1347767884.db2.gz	ODGVPRHQPDQRNX-VQTJNVASSA-N	0	3	337.467	3.314	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@H]2[C@H]1CCN2Cc1cccc(C#N)c1	ZINC001049294579	1347776544	/nfs/dbraw/zinc/77/65/44/1347776544.db2.gz	AQVVUDFKQPJMPE-RBUKOAKNSA-N	0	3	325.456	3.170	20	30		EGEDHN
C/C(=C\C(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1cccc(C#N)c1)C1CC1	ZINC001049337903	1347796485	/nfs/dbraw/zinc/79/64/85/1347796485.db2.gz	CEHHBJQTLLUUNZ-VEKUPORPSA-N	0	3	349.478	3.480	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@H]2CCCN3C(=O)C=C2CCC2)c1	ZINC001049414653	1347836839	/nfs/dbraw/zinc/83/68/39/1347836839.db2.gz	WOWHFTLPSXBPII-UXHICEINSA-N	0	3	335.451	3.234	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)[C@H](F)CCCCCC)CC1	ZINC001230052703	1375936342	/nfs/dbraw/zinc/93/63/42/1375936342.db2.gz	HUFLZKGRYYZHLR-QGZVFWFLSA-N	0	3	328.472	3.078	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@H]2[C@@H]1CCN2Cc1ccc(CF)cc1	ZINC001049466890	1347862932	/nfs/dbraw/zinc/86/29/32/1347862932.db2.gz	LGLJJJRDPAROFP-PMACEKPBSA-N	0	3	340.442	3.135	20	30		EGEDHN
Cc1cc(CN2CC[C@H]3[C@@H]2CCCN3C(=O)C#CC2CC2)cs1	ZINC001049468767	1347863811	/nfs/dbraw/zinc/86/38/11/1347863811.db2.gz	XXWBSSHNZPJSJD-ROUUACIJSA-N	0	3	328.481	3.035	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1sccc1CN(C)C	ZINC001049510443	1347885066	/nfs/dbraw/zinc/88/50/66/1347885066.db2.gz	GHAYXYJSCZCXEX-DLBZAZTESA-N	0	3	347.528	3.065	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1sccc1CN(C)C	ZINC001049510444	1347885258	/nfs/dbraw/zinc/88/52/58/1347885258.db2.gz	GHAYXYJSCZCXEX-IAGOWNOFSA-N	0	3	347.528	3.065	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1nc(C(C)(C)C)cs1	ZINC001049531233	1347894260	/nfs/dbraw/zinc/89/42/60/1347894260.db2.gz	IPGAHADGAARSCS-CABCVRRESA-N	0	3	345.512	3.143	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1ccc(CC(C)C)cc1	ZINC001049583529	1347922268	/nfs/dbraw/zinc/92/22/68/1347922268.db2.gz	WMDDVGPCCOEMQV-SFTDATJTSA-N	0	3	338.495	3.126	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc2cc(C)ccc2n1	ZINC001049586961	1347923777	/nfs/dbraw/zinc/92/37/77/1347923777.db2.gz	ZLRMVZLUIVOFHO-WOJBJXKFSA-N	0	3	335.451	3.408	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](c1ccccc1)C1CC1	ZINC001049594151	1347927661	/nfs/dbraw/zinc/92/76/61/1347927661.db2.gz	PHYIQDYOJPKMEF-PWRODBHTSA-N	0	3	336.479	3.269	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1noc2c1CC(C)(C)CC2	ZINC001049614174	1347936163	/nfs/dbraw/zinc/93/61/63/1347936163.db2.gz	WDIBDYMIMFIQDC-CVEARBPZSA-N	0	3	343.471	3.054	20	30		EGEDHN
CC1(C(=O)N2CCC[C@@H]3[C@@H]2CCN3Cc2ccc(C#N)cc2)CC=CC1	ZINC001049690873	1347973519	/nfs/dbraw/zinc/97/35/19/1347973519.db2.gz	RTGSJYYJGFFKMJ-UXHICEINSA-N	0	3	349.478	3.480	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]3[C@H]2CCN3CCc2ccns2)C1	ZINC001049704412	1347982448	/nfs/dbraw/zinc/98/24/48/1347982448.db2.gz	XZLAFMOWZFJSLZ-DLBZAZTESA-N	0	3	345.512	3.107	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(C)oc1C(F)(F)F	ZINC001049754956	1348003168	/nfs/dbraw/zinc/00/31/68/1348003168.db2.gz	PDQGKICXFMSYJC-UONOGXRCSA-N	0	3	342.361	3.472	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1cccc(C#N)c1	ZINC001049766803	1348010447	/nfs/dbraw/zinc/01/04/47/1348010447.db2.gz	DWWKBNZJEVPUKC-DBVUQKKJSA-N	0	3	339.483	3.416	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1ccc(Cl)s1	ZINC001049771062	1348013533	/nfs/dbraw/zinc/01/35/33/1348013533.db2.gz	VQOKCNKCWZVABQ-LSDHHAIUSA-N	0	3	336.888	3.033	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](C)c1ccccc1F	ZINC001049799120	1348025777	/nfs/dbraw/zinc/02/57/77/1348025777.db2.gz	SZKPDHWCUZYPHK-ZYSHUDEJSA-N	0	3	328.431	3.018	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)CCc1cc(C)cc(C)c1	ZINC001049832242	1348045679	/nfs/dbraw/zinc/04/56/79/1348045679.db2.gz	UTDBYYDWJJYSIV-SFTDATJTSA-N	0	3	338.495	3.325	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1[nH]ccc1-c1ccccc1	ZINC001049840187	1348052111	/nfs/dbraw/zinc/05/21/11/1348052111.db2.gz	GKJWGMGKWKRDJA-UXHICEINSA-N	0	3	347.462	3.384	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc2ccccc2n1	ZINC001049865414	1348071733	/nfs/dbraw/zinc/07/17/33/1348071733.db2.gz	VKXGKDOXYHUBDQ-WOJBJXKFSA-N	0	3	335.451	3.490	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc2ncsc2c1	ZINC001049871799	1348077021	/nfs/dbraw/zinc/07/70/21/1348077021.db2.gz	NZHULUQKUUWFNX-CVEARBPZSA-N	0	3	327.453	3.161	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)CCc1c[nH]c2ccccc12	ZINC001049876722	1348082026	/nfs/dbraw/zinc/08/20/26/1348082026.db2.gz	LRENFHBXPXIKEH-SFTDATJTSA-N	0	3	349.478	3.189	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](C)Oc1cccc(C)c1	ZINC001049881931	1348087570	/nfs/dbraw/zinc/08/75/70/1348087570.db2.gz	UIOFOZFKFUKATL-BHIYHBOVSA-N	0	3	328.456	3.014	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(OC)c(Cl)c1	ZINC001049888745	1348092898	/nfs/dbraw/zinc/09/28/98/1348092898.db2.gz	KBEBRIVXRDRPHI-HZPDHXFCSA-N	0	3	334.847	3.214	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](C)c1ccc(F)cc1F	ZINC001049903188	1348102757	/nfs/dbraw/zinc/10/27/57/1348102757.db2.gz	GGKWUGLUDNHZDS-FSPWUOQZSA-N	0	3	334.410	3.320	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](CC)c1ccc(OC)cc1	ZINC001049907252	1348104790	/nfs/dbraw/zinc/10/47/90/1348104790.db2.gz	CBTRNFKRBZYVAT-VAMGGRTRSA-N	0	3	342.483	3.440	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc2cc(C)ccc2o1	ZINC001049915169	1348109831	/nfs/dbraw/zinc/10/98/31/1348109831.db2.gz	TYXLRJKPVSIQGP-QZTJIDSGSA-N	0	3	336.435	3.443	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(C)c2c1CCC2	ZINC001049918149	1348111449	/nfs/dbraw/zinc/11/14/49/1348111449.db2.gz	PZKFLTOYOWQMII-LEWJYISDSA-N	0	3	336.479	3.186	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1[nH]c2ccccc2c1OC	ZINC001049919918	1348112594	/nfs/dbraw/zinc/11/25/94/1348112594.db2.gz	YPSZPXVVUGNPPZ-IAGOWNOFSA-N	0	3	339.439	3.041	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1	ZINC001049920304	1348112876	/nfs/dbraw/zinc/11/28/76/1348112876.db2.gz	AQIIXMBZJDRVBG-NMLBUPMWSA-N	0	3	340.442	3.018	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cccc2oc(C)nc21	ZINC001049924133	1348115839	/nfs/dbraw/zinc/11/58/39/1348115839.db2.gz	QFVCSJXBBBMVRA-CVEARBPZSA-N	0	3	325.412	3.001	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](C)Cc1ccc(F)cc1	ZINC001049926303	1348116807	/nfs/dbraw/zinc/11/68/07/1348116807.db2.gz	NGZIXSFKVXKQMR-ZYSHUDEJSA-N	0	3	330.447	3.256	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC[C@H]2CN(Cc3cccc(C#N)c3)C[C@H]21	ZINC001049979228	1348143343	/nfs/dbraw/zinc/14/33/43/1348143343.db2.gz	KKUQKFLUORVPCG-AYOQOUSVSA-N	0	3	325.456	3.027	20	30		EGEDHN
CC(C(=O)N1CCC[C@H]2CN(Cc3cccc(C#N)c3)C[C@H]21)=C1CCC1	ZINC001050044618	1348164364	/nfs/dbraw/zinc/16/43/64/1348164364.db2.gz	YVUWPZZSPDCKCW-LEWJYISDSA-N	0	3	349.478	3.481	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cncc(-c4ccccc4)c3)[C@@H]2C1	ZINC001050060268	1348169393	/nfs/dbraw/zinc/16/93/93/1348169393.db2.gz	SDJXJIYGUSALIA-GHTZIAJQSA-N	0	3	347.462	3.471	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cc(C)c4ccccc4n3)[C@@H]2C1	ZINC001050076992	1348174823	/nfs/dbraw/zinc/17/48/23/1348174823.db2.gz	MGTMOXIYXKLYMY-OXJNMPFZSA-N	0	3	335.451	3.266	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@H]2CN(Cc3cccc(C#N)c3)C[C@H]21	ZINC001050145333	1348195362	/nfs/dbraw/zinc/19/53/62/1348195362.db2.gz	PMHHQICNNOZGMH-IYWMVGAKSA-N	0	3	337.467	3.027	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)[C@@H](CC)Cc3ccccc3)[C@@H]2C1	ZINC001050154480	1348198978	/nfs/dbraw/zinc/19/89/78/1348198978.db2.gz	QZAAZTYOQXXXNC-SLFFLAALSA-N	0	3	326.484	3.364	20	30		EGEDHN
C#CCCN1C[C@@H]2CCCN(C(=O)c3oc4ccccc4c3C)[C@@H]2C1	ZINC001050196569	1348207460	/nfs/dbraw/zinc/20/74/60/1348207460.db2.gz	IIOHSZLYSIVMSW-FUHWJXTLSA-N	0	3	336.435	3.301	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H]3[C@@H](C=C(C)C)C3(C)C)C2)CC1	ZINC001050584355	1348293699	/nfs/dbraw/zinc/29/36/99/1348293699.db2.gz	CRHJVPCDHIKJPL-MSOLQXFVSA-N	0	3	328.500	3.173	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc(C)c(Cl)c3)C2)CC1	ZINC001050644799	1348313260	/nfs/dbraw/zinc/31/32/60/1348313260.db2.gz	RSYOIFZSQWIOOH-UHFFFAOYSA-N	0	3	330.859	3.210	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1oc(C)nc1C)CC2	ZINC001050645683	1348313656	/nfs/dbraw/zinc/31/36/56/1348313656.db2.gz	UVGAHTNCVSKVOD-LJQANCHMSA-N	0	3	345.487	3.318	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3ccc(Cl)c4occc43)C2)CC1	ZINC001050726973	1348339232	/nfs/dbraw/zinc/33/92/32/1348339232.db2.gz	YMNNPZPUFZNOSY-UHFFFAOYSA-N	0	3	342.826	3.257	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)C[C@H]3CCCc4ccccc43)C2)CC1	ZINC001050734761	1348341485	/nfs/dbraw/zinc/34/14/85/1348341485.db2.gz	VUSPPOQAXZCZTD-LJQANCHMSA-N	0	3	336.479	3.054	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H](C)c3cccc(Cl)c3)C2)CC1	ZINC001050759710	1348350350	/nfs/dbraw/zinc/35/03/50/1348350350.db2.gz	QMOOQDLGCQRUJV-INIZCTEOSA-N	0	3	344.886	3.391	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3cc(C)oc3C)cccc2C1	ZINC001051280754	1348415974	/nfs/dbraw/zinc/41/59/74/1348415974.db2.gz	XVYRIKPZPFOZDV-UHFFFAOYSA-N	0	3	336.435	3.208	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)[C@H]3CC[C@H](CC)O3)cccc2C1	ZINC001051290614	1348420702	/nfs/dbraw/zinc/42/07/02/1348420702.db2.gz	ZFWOAFMZVDDNQZ-AZUAARDMSA-N	0	3	342.483	3.195	20	30		EGEDHN
C=C1CCC(C(=O)NCc2cccc3c2CCN(CCOC)C3)CC1	ZINC001051298054	1348423576	/nfs/dbraw/zinc/42/35/76/1348423576.db2.gz	AESCEWIDYBLTSE-UHFFFAOYSA-N	0	3	342.483	3.054	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)[C@H]3CC[C@H](F)C3)cccc2C1	ZINC001051298375	1348424061	/nfs/dbraw/zinc/42/40/61/1348424061.db2.gz	NYDUJYCIMWQRBD-YJBOKZPZSA-N	0	3	330.447	3.375	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3ccn(C)c3C)cccc2C1	ZINC001051299124	1348424564	/nfs/dbraw/zinc/42/45/64/1348424564.db2.gz	WOZZQNZFMMCZPW-UHFFFAOYSA-N	0	3	337.467	3.198	20	30		EGEDHN
C=C(C)CCN1CCN([C@@H]2CCN(C(=O)C(C)(C)C(C)(C)C)C2)CC1	ZINC001052060682	1348500361	/nfs/dbraw/zinc/50/03/61/1348500361.db2.gz	JZBCDKKWTGKNBF-GOSISDBHSA-N	0	3	349.563	3.243	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)C2(C)CCC(F)(F)CC2)CC1	ZINC001052494941	1348557569	/nfs/dbraw/zinc/55/75/69/1348557569.db2.gz	GJKICTYAGDLKCD-HNNXBMFYSA-N	0	3	326.431	3.196	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@H](NC(=O)Cc3ccccc3)CC2)c1	ZINC001052496486	1348558364	/nfs/dbraw/zinc/55/83/64/1348558364.db2.gz	HNQQVUIGERAFRE-NRFANRHFSA-N	0	3	347.462	3.272	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2c(C)occ2C(F)(F)F)CC1	ZINC001052567334	1348581391	/nfs/dbraw/zinc/58/13/91/1348581391.db2.gz	YRVVPTBXYNALOJ-ZDUSSCGKSA-N	0	3	342.361	3.214	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2F)CC1	ZINC001052581871	1348585759	/nfs/dbraw/zinc/58/57/59/1348585759.db2.gz	BAAUZFLYJKUQSB-BPQIPLTHSA-N	0	3	346.421	3.062	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2cc3c(o2)c(F)ccc3C)CC1	ZINC001052588679	1348587851	/nfs/dbraw/zinc/58/78/51/1348587851.db2.gz	YSCRLXMPRAEDIQ-AWEZNQCLSA-N	0	3	328.387	3.098	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)C2(c3ccc(F)cc3)CCC2)CC1	ZINC001052609627	1348596270	/nfs/dbraw/zinc/59/62/70/1348596270.db2.gz	XCJSGZUNCOHMPN-LJQANCHMSA-N	0	3	342.458	3.241	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)Cc2ccc(F)cc2Cl)CC1	ZINC001052681388	1348628051	/nfs/dbraw/zinc/62/80/51/1348628051.db2.gz	AGJYFASSFKEDRA-INIZCTEOSA-N	0	3	336.838	3.016	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccccc2OC2CCC2)CC1	ZINC001052692763	1348636001	/nfs/dbraw/zinc/63/60/01/1348636001.db2.gz	AHZRSCNKRFTAJA-QGZVFWFLSA-N	0	3	340.467	3.226	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@H]2CCCN(C[C@H](F)CC)CC2)cc1	ZINC001052771746	1348672641	/nfs/dbraw/zinc/67/26/41/1348672641.db2.gz	OHBTXBDRURLTTA-MSOLQXFVSA-N	0	3	346.446	3.031	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)Cc2cccc(OCCC)c2)CC1	ZINC001052849533	1348701129	/nfs/dbraw/zinc/70/11/29/1348701129.db2.gz	XMUCLXKFVCTUOC-LJQANCHMSA-N	0	3	342.483	3.012	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)Cc2c[nH]c3cccc(C)c23)CC1	ZINC001052870636	1348711851	/nfs/dbraw/zinc/71/18/51/1348711851.db2.gz	WCUOHPJKXMPBRD-GOSISDBHSA-N	0	3	337.467	3.013	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2coc3ccc(Cl)cc23)CC1	ZINC001052900645	1348734657	/nfs/dbraw/zinc/73/46/57/1348734657.db2.gz	JCYILEYIGYXDNA-AWEZNQCLSA-N	0	3	330.815	3.304	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2cc3cc(F)ccc3s2)CC1	ZINC001052923446	1348749569	/nfs/dbraw/zinc/74/95/69/1348749569.db2.gz	DDFZADLWOSBACR-HNNXBMFYSA-N	0	3	330.428	3.258	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)C2CC(c3cccc(F)c3)C2)CC1	ZINC001052970481	1348780662	/nfs/dbraw/zinc/78/06/62/1348780662.db2.gz	NJNNEMNBSYFSGX-QLOJAFMTSA-N	0	3	342.458	3.313	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@@]2(C)CCc3ccccc3C2)CC1	ZINC001052983339	1348788013	/nfs/dbraw/zinc/78/80/13/1348788013.db2.gz	JNHNPTOMSLLVKM-IRLDBZIGSA-N	0	3	338.495	3.176	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@H]([C@H]2CCCN(C/C=C/Cl)C2)C1	ZINC001053023307	1348821397	/nfs/dbraw/zinc/82/13/97/1348821397.db2.gz	HYBHZAZADRPGHG-KDDSDRDSSA-N	0	3	334.891	3.103	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(F)cc2)C1	ZINC001053063430	1348875123	/nfs/dbraw/zinc/87/51/23/1348875123.db2.gz	MUONUBLDVMGPFF-HKUYNNGSSA-N	0	3	328.431	3.166	20	30		EGEDHN
C=C(C)CN1CCC[C@H]([C@H]2CCCCN2C(=O)C(=O)C(C)(C)C)C1	ZINC001053077441	1348897042	/nfs/dbraw/zinc/89/70/42/1348897042.db2.gz	JTYLRGKGXRNOBT-DLBZAZTESA-N	0	3	334.504	3.271	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2coc(C)c2)C1	ZINC001053080552	1348901479	/nfs/dbraw/zinc/90/14/79/1348901479.db2.gz	PZGYUHUKAMVZHR-MJGOQNOKSA-N	0	3	328.456	3.318	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccncc2C)C1	ZINC001053081736	1348903212	/nfs/dbraw/zinc/90/32/12/1348903212.db2.gz	XRNQZXZCTFFTBG-QUCCMNQESA-N	0	3	339.483	3.120	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2[nH]ccc2C)C1	ZINC001053083702	1348905464	/nfs/dbraw/zinc/90/54/64/1348905464.db2.gz	LMAREJMECNHUGQ-ROUUACIJSA-N	0	3	327.472	3.053	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCCC[C@H]2[C@@H]2CCCN(CC#CC)C2)cc1	ZINC001053092482	1348919112	/nfs/dbraw/zinc/91/91/12/1348919112.db2.gz	HDSJLHQGQDKRKW-YADHBBJMSA-N	0	3	348.490	3.398	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cc(Cl)cn2C)C1	ZINC001053092483	1348919209	/nfs/dbraw/zinc/91/92/09/1348919209.db2.gz	RTDVYAHRHHVHRB-RDJZCZTQSA-N	0	3	347.890	3.018	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cc(C)c(C)cn2)C1	ZINC001053092288	1348919275	/nfs/dbraw/zinc/91/92/75/1348919275.db2.gz	QSLFXZOADOTGCB-ICSRJNTNSA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)CC2CC(F)(F)C2)C1	ZINC001053093156	1348920015	/nfs/dbraw/zinc/92/00/15/1348920015.db2.gz	WEVZUHSQWKHFFV-SJORKVTESA-N	0	3	338.442	3.148	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)C2CCC(=C)CC2)C1	ZINC001053093937	1348922460	/nfs/dbraw/zinc/92/24/60/1348922460.db2.gz	AYWZQTWUNXHPRJ-UXHICEINSA-N	0	3	328.500	3.459	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2csc(C)n2)C1	ZINC001053095569	1348926061	/nfs/dbraw/zinc/92/60/61/1348926061.db2.gz	KALUTTHPMAMOSK-AEFFLSMTSA-N	0	3	345.512	3.182	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)C2CC3(CC3)C2)C1	ZINC001053098927	1348930611	/nfs/dbraw/zinc/93/06/11/1348930611.db2.gz	RBDKNTQPQGELBY-MJGOQNOKSA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(Cl)cn2)C1	ZINC001053103547	1348937651	/nfs/dbraw/zinc/93/76/51/1348937651.db2.gz	HXUMDNYSPPBVMQ-YJBOKZPZSA-N	0	3	345.874	3.075	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2oc(CC)cc2C)C1	ZINC001053105019	1348940993	/nfs/dbraw/zinc/94/09/93/1348940993.db2.gz	LAESVYDQNDYKFS-MJGOQNOKSA-N	0	3	342.483	3.490	20	30		EGEDHN
C=CCCN1Cc2ccccc2C[C@H]1CNC(=O)C1CC(F)(F)C1	ZINC001054036809	1349132686	/nfs/dbraw/zinc/13/26/86/1349132686.db2.gz	QWEQNRRMTYMWDG-KRWDZBQOSA-N	0	3	334.410	3.151	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1nc(C(C)(C)C)cs1)C2	ZINC001054148231	1349154646	/nfs/dbraw/zinc/15/46/46/1349154646.db2.gz	JXVATDVWPLMSOS-LJQANCHMSA-N	0	3	345.512	3.002	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1c(C)[nH]c3ccccc31)C2	ZINC001054161499	1349163418	/nfs/dbraw/zinc/16/34/18/1349163418.db2.gz	HHLCBTVVIFCAML-JOCHJYFZSA-N	0	3	349.478	3.428	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H](C)c1ccc(Cl)cc1)C2	ZINC001054188681	1349191680	/nfs/dbraw/zinc/19/16/80/1349191680.db2.gz	RCFGDNOXFBKLRW-JXFKEZNVSA-N	0	3	344.886	3.391	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(C)c(Cl)c1)C2	ZINC001054188729	1349191809	/nfs/dbraw/zinc/19/18/09/1349191809.db2.gz	SPUJBNPXEGYAIB-IBGZPJMESA-N	0	3	330.859	3.210	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@]2(CCN(Cc3ccccn3)C2)C1	ZINC001054192288	1349193850	/nfs/dbraw/zinc/19/38/50/1349193850.db2.gz	TZABTCUCYCHNLZ-NHCUHLMSSA-N	0	3	341.499	3.498	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@]3(C2)CCCN(C(=O)[C@@H]2CC24CC4)C3)c1	ZINC001054204389	1349206434	/nfs/dbraw/zinc/20/64/34/1349206434.db2.gz	UNHCIIJQRYNHKZ-PZJWPPBQSA-N	0	3	349.478	3.173	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)C(C)(C)c1ccc(F)cc1)C2	ZINC001054228707	1349222575	/nfs/dbraw/zinc/22/25/75/1349222575.db2.gz	XUUSONHAYWKAHJ-OAQYLSRUSA-N	0	3	342.458	3.051	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc(C)nc3ccccc31)C2	ZINC001054237433	1349230662	/nfs/dbraw/zinc/23/06/62/1349230662.db2.gz	XHZXYSZOCQOXKO-JOCHJYFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H](C)Cc1ccc(C)cc1)C2	ZINC001054246371	1349241384	/nfs/dbraw/zinc/24/13/84/1349241384.db2.gz	XMKLNCFIMKCFSX-SIKLNZKXSA-N	0	3	338.495	3.121	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cnc(C(C)C)s1)C2	ZINC001054249610	1349245304	/nfs/dbraw/zinc/24/53/04/1349245304.db2.gz	ARISZAMKTMWHIK-IBGZPJMESA-N	0	3	345.512	3.218	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3c(C)noc3C)cc2C1	ZINC001054254975	1349250954	/nfs/dbraw/zinc/25/09/54/1349250954.db2.gz	QXIITMOLXMFSBW-UHFFFAOYSA-N	0	3	325.412	3.113	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@H]3CCCOC3)cc2C1	ZINC001054258637	1349255002	/nfs/dbraw/zinc/25/50/02/1349255002.db2.gz	VZKOHGDRRIJCCW-SFHVURJKSA-N	0	3	328.456	3.011	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NCc1ccc2c(c1)CN(CC1CC1)C2	ZINC001054265451	1349262823	/nfs/dbraw/zinc/26/28/23/1349262823.db2.gz	OSKKLUYISPYLRQ-UXHICEINSA-N	0	3	340.467	3.010	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3c[nH]nc3CCC)cc2C1	ZINC001054272585	1349272312	/nfs/dbraw/zinc/27/23/12/1349272312.db2.gz	YJFYPNBOOXULQX-UHFFFAOYSA-N	0	3	338.455	3.184	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@H]3CCO[C@H]3C(=C)C)cc2C1	ZINC001054285282	1349287281	/nfs/dbraw/zinc/28/72/81/1349287281.db2.gz	BCHWQQVJPFXSLW-PMACEKPBSA-N	0	3	340.467	3.176	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NCc1ccc2c(c1)CN(CCC)C2	ZINC001054285737	1349287804	/nfs/dbraw/zinc/28/78/04/1349287804.db2.gz	XHDBDJDSTYAAPV-OALUTQOASA-N	0	3	328.456	3.010	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@H]3CCO[C@H]3C)cc2C1	ZINC001054286507	1349289322	/nfs/dbraw/zinc/28/93/22/1349289322.db2.gz	INNAMLUZRVWQRW-KXBFYZLASA-N	0	3	328.456	3.010	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@@H]3CCO[C@H]3C)cc2C1	ZINC001054286506	1349289558	/nfs/dbraw/zinc/28/95/58/1349289558.db2.gz	INNAMLUZRVWQRW-HNAYVOBHSA-N	0	3	328.456	3.010	20	30		EGEDHN
Cc1ccc(C(=O)N2C[C@H](C)[C@H](NCc3ccc(C#N)s3)C2)s1	ZINC001054340680	1349320460	/nfs/dbraw/zinc/32/04/60/1349320460.db2.gz	WIHWNPIUFWZHSZ-XHDPSFHLSA-N	0	3	345.493	3.240	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC(C)(C)C)C[C@H]1NCc1ccc(C#N)c(F)c1	ZINC001054387248	1349344884	/nfs/dbraw/zinc/34/48/84/1349344884.db2.gz	CIJSUMHAORIFSM-CXAGYDPISA-N	0	3	331.435	3.070	20	30		EGEDHN
CCC(CC)C(=O)N1C[C@@H](C)[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001054410454	1349353097	/nfs/dbraw/zinc/35/30/97/1349353097.db2.gz	JFNQJIVSQAMMFE-ACJLOTCBSA-N	0	3	331.435	3.070	20	30		EGEDHN
C[C@H]1CN(C(=O)C=C2CCCCC2)C[C@H]1NCc1ccc(C#N)s1	ZINC001054447484	1349362259	/nfs/dbraw/zinc/36/22/59/1349362259.db2.gz	GNJFVPNCCCBISP-KBXCAEBGSA-N	0	3	343.496	3.447	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)[C@H](NCc2cc(C)ccc2OC)C1	ZINC001054966301	1349529718	/nfs/dbraw/zinc/52/97/18/1349529718.db2.gz	LYXXCZKVVCHKNV-NVXWUHKLSA-N	0	3	330.472	3.152	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)C2(c3ccc(F)cc3)CCC2)C1	ZINC001080234455	1357532981	/nfs/dbraw/zinc/53/29/81/1357532981.db2.gz	DGPCFOXZDVUJJO-CRAIPNDOSA-N	0	3	330.447	3.260	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CN(Cc3ccc4cc[nH]c4c3)C[C@H]2C)C1	ZINC001080403550	1357608084	/nfs/dbraw/zinc/60/80/84/1357608084.db2.gz	VYGWUCLXSVACOB-DNVCBOLYSA-N	0	3	337.467	3.461	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@@]2(c3ccccc3)CC2(C)C)C1	ZINC001080658027	1357716749	/nfs/dbraw/zinc/71/67/49/1357716749.db2.gz	AATWCGDKNVLWRI-BLIXFSHQSA-N	0	3	326.484	3.367	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@@H]2CCCC2(C)C)C[C@H]1NCc1ccc(C#N)s1	ZINC001082692335	1358075465	/nfs/dbraw/zinc/07/54/65/1358075465.db2.gz	REOAOWFEARJXCO-XOKHGSTOSA-N	0	3	345.512	3.383	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1c(C)oc(C)c1C)C[C@H](C)O2	ZINC001071190432	1354494829	/nfs/dbraw/zinc/49/48/29/1354494829.db2.gz	ZGOVANKMICLVDB-VBKZILBWSA-N	0	3	346.471	3.086	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C(C)(C)C1CCC1)C[C@H](C)O2	ZINC001071195081	1354496559	/nfs/dbraw/zinc/49/65/59/1354496559.db2.gz	RTFVOPNBABMHGN-JXFKEZNVSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1ccc(C)cc1F)C[C@H](C)O2	ZINC001071213934	1354508689	/nfs/dbraw/zinc/50/86/89/1354508689.db2.gz	MMFWXZKTKBMGEK-OXJNMPFZSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C1(CC)CCCC1)C[C@H](C)O2	ZINC001071225816	1354513724	/nfs/dbraw/zinc/51/37/24/1354513724.db2.gz	QGMJUXHLRRTXDC-PXNSSMCTSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1cc(C)c(CC)o1)C[C@H](C)O2	ZINC001071227711	1354514394	/nfs/dbraw/zinc/51/43/94/1354514394.db2.gz	IWGPDIOTAYWMQM-OXJNMPFZSA-N	0	3	346.471	3.032	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1ccc(Cl)cc1)C[C@@H](C)O2	ZINC001071234405	1354517672	/nfs/dbraw/zinc/51/76/72/1354517672.db2.gz	YRZFMFFJSRCNHD-DNVCBOLYSA-N	0	3	348.874	3.222	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2sc(Cl)nc2C)CC[C@@H]1C	ZINC001071533640	1354750629	/nfs/dbraw/zinc/75/06/29/1354750629.db2.gz	IZOLKCRGUOUELN-CMPLNLGQSA-N	0	3	327.881	3.264	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc3ccccc3nc2C)CC[C@@H]1C	ZINC001071546948	1354759019	/nfs/dbraw/zinc/75/90/19/1354759019.db2.gz	PCYZVNJQJJRBGP-MAUKXSAKSA-N	0	3	335.451	3.149	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2c(C)nn(C(C)(C)C)c2C)CC[C@@H]1C	ZINC001071547605	1354759977	/nfs/dbraw/zinc/75/99/77/1354759977.db2.gz	WQOWXMDYBVOSBX-WMLDXEAASA-N	0	3	346.519	3.414	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc(C3CC3)[nH]c2C2CC2)CC[C@@H]1C	ZINC001071607846	1354792999	/nfs/dbraw/zinc/79/29/99/1354792999.db2.gz	SXHUEKOFIAWBBT-YOEHRIQHSA-N	0	3	339.483	3.376	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@@H]2CC[C@@H](C)N(CC(=C)C)C2)cc1	ZINC001071620085	1354802820	/nfs/dbraw/zinc/80/28/20/1354802820.db2.gz	ZRZZYSUNRIOATP-SJLPKXTDSA-N	0	3	328.456	3.410	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc(C)nn2C(CC)CC)CC[C@H]1C	ZINC001071631640	1354813395	/nfs/dbraw/zinc/81/33/95/1354813395.db2.gz	PNYCPURDCFWJKF-IAGOWNOFSA-N	0	3	344.503	3.159	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2[nH]nc3ccc(C)cc32)CC[C@@H]1C	ZINC001071642134	1354821063	/nfs/dbraw/zinc/82/10/63/1354821063.db2.gz	KXRJQDUTRPODIL-LSDHHAIUSA-N	0	3	326.444	3.030	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2csc(C(F)(F)F)c2)CC[C@@H]1C	ZINC001071645881	1354823634	/nfs/dbraw/zinc/82/36/34/1354823634.db2.gz	ORBLECUWHVILDU-WCQYABFASA-N	0	3	344.402	3.373	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc3c(cn2)CCCC3)CC[C@@H]1C	ZINC001071665222	1354837849	/nfs/dbraw/zinc/83/78/49/1354837849.db2.gz	BWIQUQBIYDBTBL-YJBOKZPZSA-N	0	3	327.472	3.119	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cn(CC)nc2C(C)C)CC[C@@H]1C	ZINC001071854640	1354982548	/nfs/dbraw/zinc/98/25/48/1354982548.db2.gz	DASQZUBUXHAZKD-HOTGVXAUSA-N	0	3	332.492	3.185	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2csc(C3CC3)n2)CC[C@@H]1C	ZINC001071879455	1355002073	/nfs/dbraw/zinc/00/20/73/1355002073.db2.gz	CZSYRUJHQUPOIW-DZGCQCFKSA-N	0	3	333.501	3.108	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(C(C)C)[nH]c2=O)CC[C@H]1C	ZINC001071879537	1355002244	/nfs/dbraw/zinc/00/22/44/1355002244.db2.gz	FJNCOFBEWBZUJK-HUUCEWRRSA-N	0	3	331.460	3.069	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccccc2NC(=O)CC)CC[C@@H]1C	ZINC001071908432	1355019141	/nfs/dbraw/zinc/01/91/41/1355019141.db2.gz	VQMNYTXLWKTIHS-HOTGVXAUSA-N	0	3	343.471	3.194	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc3nc(C)sc3c2)CC[C@H]1C	ZINC001071960824	1355045319	/nfs/dbraw/zinc/04/53/19/1355045319.db2.gz	IHLKGYAVTHEABB-CZUORRHYSA-N	0	3	341.480	3.211	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cnn(CCCC)c2C)CC[C@@H]1C	ZINC001071976611	1355055837	/nfs/dbraw/zinc/05/58/37/1355055837.db2.gz	FQLCEUITVNITFM-DOTOQJQBSA-N	0	3	332.492	3.150	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CC[C@H](C)N(CC3=CCCCC3)C2)nc1	ZINC001072000640	1355066267	/nfs/dbraw/zinc/06/62/67/1355066267.db2.gz	XWUACDVCXMFTMY-LPHOPBHVSA-N	0	3	337.467	3.146	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2coc3ccc(F)cc23)CC[C@@H]1C	ZINC001072027511	1355089119	/nfs/dbraw/zinc/08/91/19/1355089119.db2.gz	ZUISLBNGDGFYGY-DZGCQCFKSA-N	0	3	328.387	3.178	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccsc2C(F)F)CC[C@@H]1C	ZINC001072032561	1355092302	/nfs/dbraw/zinc/09/23/02/1355092302.db2.gz	DZLOGOLHKHWUPM-RYUDHWBXSA-N	0	3	326.412	3.292	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)Cc2ccc3c(c2)CCCC3)CC[C@H]1C	ZINC001072065321	1355110019	/nfs/dbraw/zinc/11/00/19/1355110019.db2.gz	BYHDVWZJZWLBTG-OXQOHEQNSA-N	0	3	326.484	3.263	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc(OC)c(OC)cc2C)CC[C@@H]1C	ZINC001072091468	1355123368	/nfs/dbraw/zinc/12/33/68/1355123368.db2.gz	BMBLYNDTEDSXQA-HOTGVXAUSA-N	0	3	346.471	3.171	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)Cc2cccc(OC(C)C)c2)CC[C@@H]1C	ZINC001072102662	1355131110	/nfs/dbraw/zinc/13/11/10/1355131110.db2.gz	QHKWNOMSRSVRBW-WMZOPIPTSA-N	0	3	330.472	3.171	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)CC[C@@H]1C	ZINC001072102156	1355131699	/nfs/dbraw/zinc/13/16/99/1355131699.db2.gz	NKHZSHDEOOTEAA-XJKSGUPXSA-N	0	3	343.431	3.008	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)Cc2c(C)oc3ccccc32)CC[C@@H]1C	ZINC001072128623	1355144699	/nfs/dbraw/zinc/14/46/99/1355144699.db2.gz	CZHUPAHDDAGKCO-DOTOQJQBSA-N	0	3	338.451	3.276	20	30		EGEDHN
CCCC(=O)N1CC[C@H](C)[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001072162900	1355160218	/nfs/dbraw/zinc/16/02/18/1355160218.db2.gz	GMAHHAFDWWRDEP-YOEHRIQHSA-N	0	3	331.435	3.072	20	30		EGEDHN
C[C@H]1CCN(C(=O)CC2(C)CC2)C[C@H]1CNCc1ccccc1C#N	ZINC001072322903	1355236784	/nfs/dbraw/zinc/23/67/84/1355236784.db2.gz	QAHLHUDOBLLTHJ-QFBILLFUSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](C)[C@@H](CNCc2nccs2)C1	ZINC001072337386	1355245524	/nfs/dbraw/zinc/24/55/24/1355245524.db2.gz	XTYHEAUXSORPOK-GJZGRUSLSA-N	0	3	335.517	3.320	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)C[C@@H]4C=CCCC4)C3)C2)c1	ZINC001072846245	1355462309	/nfs/dbraw/zinc/46/23/09/1355462309.db2.gz	PQGIIBWPDDYVKI-GOSISDBHSA-N	0	3	349.478	3.339	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1cccnc1C)C2	ZINC001072944659	1355512391	/nfs/dbraw/zinc/51/23/91/1355512391.db2.gz	IPEFXQDKHLWORP-LJQANCHMSA-N	0	3	327.472	3.027	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3c(Cl)cccc3Cl)C2)C1	ZINC001073147697	1355625595	/nfs/dbraw/zinc/62/55/95/1355625595.db2.gz	KEFPQTPDXRFULF-UHFFFAOYSA-N	0	3	325.239	3.327	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)CC3C4CC5CC(C4)CC3C5)C2)C1	ZINC001073447013	1355783188	/nfs/dbraw/zinc/78/31/88/1355783188.db2.gz	ALOHPPQSCSDKAR-UHFFFAOYSA-N	0	3	340.511	3.006	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2cc(C)n(C(C)C)c2C)C1	ZINC001073883759	1355940094	/nfs/dbraw/zinc/94/00/94/1355940094.db2.gz	XCLAGWUBXQXVSY-SFHVURJKSA-N	0	3	347.503	3.083	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2ccc(CC)c(CC)c2)C1	ZINC001073911630	1355951296	/nfs/dbraw/zinc/95/12/96/1355951296.db2.gz	WXBIYTCVOUQLLG-FQEVSTJZSA-N	0	3	344.499	3.208	20	30		EGEDHN
C[C@@H]1CN(C(=O)C(C)(C)C)C[C@@]1(C)CNCc1ccccc1C#N	ZINC001183248589	1387284810	/nfs/dbraw/zinc/28/48/10/1387284810.db2.gz	MYOLKKNBQNBJDR-FOIQADDNSA-N	0	3	327.472	3.179	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](C2CCN(C(=O)[C@@H](C)C#N)CC2)CC1	ZINC001075448229	1356380634	/nfs/dbraw/zinc/38/06/34/1356380634.db2.gz	RBSPPYSZNZOSHR-HOCLYGCPSA-N	0	3	337.895	3.239	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cc(C4CCCCC4)n[nH]3)[C@@H]2C1	ZINC001075892020	1356441492	/nfs/dbraw/zinc/44/14/92/1356441492.db2.gz	BESHNUCLLGUVMK-QFBILLFUSA-N	0	3	342.487	3.180	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cc(-c4ccccc4)on3)[C@@H]2C1	ZINC001076016147	1356466769	/nfs/dbraw/zinc/46/67/69/1356466769.db2.gz	JSEKVMXYDKSRGQ-FUHWJXTLSA-N	0	3	337.423	3.064	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccc(C(F)(F)F)cc3)[C@@H]2C1	ZINC001076487614	1356591335	/nfs/dbraw/zinc/59/13/35/1356591335.db2.gz	FXUUSOXBAQWTEI-GOEBONIOSA-N	0	3	338.373	3.428	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)COc3c(C)cc(C)cc3C)[C@@H]2C1	ZINC001076531311	1356607153	/nfs/dbraw/zinc/60/71/53/1356607153.db2.gz	DAWFJFCWHPYVCK-RBUKOAKNSA-N	0	3	342.483	3.099	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)C[C@@H](C)C(C)C	ZINC001098961236	1363542381	/nfs/dbraw/zinc/54/23/81/1363542381.db2.gz	WDYANLNWJBVSDG-QZTJIDSGSA-N	0	3	338.536	3.478	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2cc(Cl)cn2C)C12CCC2	ZINC001078676569	1357050871	/nfs/dbraw/zinc/05/08/71/1357050871.db2.gz	YLWCXBODGVWZNN-KGLIPLIRSA-N	0	3	342.270	3.062	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2c(C)noc2C2CC2)C12CCC2	ZINC001078683884	1357053870	/nfs/dbraw/zinc/05/38/70/1357053870.db2.gz	XXNSEYJQRVTZNX-KGLIPLIRSA-N	0	3	349.862	3.244	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@@H](NCc3cncs3)C23CCC3)C1	ZINC001078720482	1357064862	/nfs/dbraw/zinc/06/48/62/1357064862.db2.gz	LTQSHLGFVBEBJX-CABCVRRESA-N	0	3	331.485	3.016	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@@H](NCc3oc(C)nc3C)C23CCC3)C1	ZINC001078721065	1357065941	/nfs/dbraw/zinc/06/59/41/1357065941.db2.gz	VMHBELFBRLFVJD-SJORKVTESA-N	0	3	343.471	3.165	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2coc(CC3CC3)n2)C12CCC2	ZINC001078766445	1357073082	/nfs/dbraw/zinc/07/30/82/1357073082.db2.gz	DPKHBKFBVQLYMS-CABCVRRESA-N	0	3	349.862	3.010	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2coc(C3CCC3)n2)C12CCC2	ZINC001078773541	1357078017	/nfs/dbraw/zinc/07/80/17/1357078017.db2.gz	JDLXALTZQILDKS-CABCVRRESA-N	0	3	349.862	3.325	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)Cc2cccc(OC(C)C)c2)C1	ZINC001081025886	1357785490	/nfs/dbraw/zinc/78/54/90/1357785490.db2.gz	CGOFDAMZZBYSIU-VQIMIIECSA-N	0	3	330.472	3.029	20	30		EGEDHN
CN(CCN(C)C(=O)C1(c2ccccc2C#N)CC1)Cc1ccccc1	ZINC001183293539	1387292224	/nfs/dbraw/zinc/29/22/24/1387292224.db2.gz	OVIQXZMYRUTZKP-UHFFFAOYSA-N	0	3	347.462	3.180	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2ccn(C(C)C)c2C)C[C@H]1c1ccccc1	ZINC001081166057	1357846024	/nfs/dbraw/zinc/84/60/24/1357846024.db2.gz	OOTYFQXTSGDXHM-LEWJYISDSA-N	0	3	349.478	3.208	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2cc3[nH]ccc3s2)C[C@H]1c1ccccc1	ZINC001081219132	1357850588	/nfs/dbraw/zinc/85/05/88/1357850588.db2.gz	MNDUQJQSKBCKQG-DOTOQJQBSA-N	0	3	349.459	3.060	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2ccccc2C(C)(C)CC)[C@H](OC)C1	ZINC001081831562	1357868960	/nfs/dbraw/zinc/86/89/60/1357868960.db2.gz	KRUFFVMIURNAAI-RTBURBONSA-N	0	3	344.499	3.379	20	30		EGEDHN
C[C@H](C#N)C(=O)N1C[C@@H](C)[C@H](NCc2ccc(Cl)cc2Cl)C1	ZINC001082448280	1358039117	/nfs/dbraw/zinc/03/91/17/1358039117.db2.gz	KMWIRNFOSVNTOH-UEKVPHQBSA-N	0	3	340.254	3.090	20	30		EGEDHN
C[C@@H](C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1)C1CCCC1	ZINC001082852666	1358098704	/nfs/dbraw/zinc/09/87/04/1358098704.db2.gz	PCFATTMMMUKBNT-HBUWYVDXSA-N	0	3	345.512	3.383	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)CCc3cccc(Cl)c3)[C@@H]2C1	ZINC001084554674	1358237456	/nfs/dbraw/zinc/23/74/56/1358237456.db2.gz	AHBGJFHVYUKGEW-SJLPKXTDSA-N	0	3	332.875	3.381	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CCN(Cc3ccccc3CC)C[C@H]21	ZINC001084577936	1358241761	/nfs/dbraw/zinc/24/17/61/1358241761.db2.gz	BDAGVSQKCSPXEP-RTBURBONSA-N	0	3	326.484	3.494	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CCN(Cc3cccc(CC)c3)C[C@H]21	ZINC001084578236	1358242339	/nfs/dbraw/zinc/24/23/39/1358242339.db2.gz	RBYJWRRNAJKHDO-RTBURBONSA-N	0	3	326.484	3.494	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)Cc3ccc(F)c(Cl)c3)[C@@H]2C1	ZINC001084682574	1358277066	/nfs/dbraw/zinc/27/70/66/1358277066.db2.gz	OWGADCMNCLRGOC-RHSMWYFYSA-N	0	3	336.838	3.130	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3coc(-c4ccccc4)n3)[C@@H]2C1	ZINC001084781269	1358308065	/nfs/dbraw/zinc/30/80/65/1358308065.db2.gz	SEBUCLRTBCBCCB-SJLPKXTDSA-N	0	3	337.423	3.064	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@H](C)Cc3cccc(F)c3)[C@@H]2C1	ZINC001084862747	1358333914	/nfs/dbraw/zinc/33/39/14/1358333914.db2.gz	ABTMCLAOAZRURP-SZVBFZGTSA-N	0	3	330.447	3.113	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC[C@H]2CCN(Cc3cc4ccccc4o3)[C@H]2C1	ZINC001084906347	1358344216	/nfs/dbraw/zinc/34/42/16/1358344216.db2.gz	NDXFTWDMWGQGBM-RKVPGOIHSA-N	0	3	337.423	3.015	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@H]2CCN(C/C=C\c3ccccc3)[C@H]2C1	ZINC001084937646	1358352219	/nfs/dbraw/zinc/35/22/19/1358352219.db2.gz	OXKGONFPBJTINQ-RMBIOTAASA-N	0	3	334.463	3.036	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@]3(C)CCc4ccccc4C3)C[C@@H]21	ZINC001085109948	1358393838	/nfs/dbraw/zinc/39/38/38/1358393838.db2.gz	VNMSXEJVELJWRA-CBQOVEMMSA-N	0	3	338.495	3.290	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccc(C)o1	ZINC001085125601	1358403068	/nfs/dbraw/zinc/40/30/68/1358403068.db2.gz	YCYIHKWIJLCYSU-CHWSQXEVSA-N	0	3	341.249	3.127	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cccnc1C1CC1	ZINC001085259399	1358446062	/nfs/dbraw/zinc/44/60/62/1358446062.db2.gz	JEXWQHSQQZMTHO-HZPDHXFCSA-N	0	3	333.863	3.342	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccc2[nH]nc(C)c2c1	ZINC001085269947	1358447987	/nfs/dbraw/zinc/44/79/87/1358447987.db2.gz	BVXZOFFXBWEZIY-IAGOWNOFSA-N	0	3	346.862	3.254	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cc(-c2ccco2)n[nH]1	ZINC001085341212	1358471312	/nfs/dbraw/zinc/47/13/12/1358471312.db2.gz	IQIRQLCIMFIJAM-CHWSQXEVSA-N	0	3	348.834	3.053	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cnnc2ccccc21	ZINC001085345449	1358473238	/nfs/dbraw/zinc/47/32/38/1358473238.db2.gz	XZWFMFMQMAZOGT-IAGOWNOFSA-N	0	3	344.846	3.013	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1sccc1OC	ZINC001085401253	1358489614	/nfs/dbraw/zinc/48/96/14/1358489614.db2.gz	FWZISKFNMBNHFP-VXGBXAGGSA-N	0	3	328.865	3.140	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cccc(N(C)C)c1	ZINC001085404577	1358492183	/nfs/dbraw/zinc/49/21/83/1358492183.db2.gz	SGEBPAKKICOWTH-IAGOWNOFSA-N	0	3	335.879	3.136	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccc(C2CC2)cn1	ZINC001085409614	1358492700	/nfs/dbraw/zinc/49/27/00/1358492700.db2.gz	FHLHXIGWORZHMG-HZPDHXFCSA-N	0	3	333.863	3.342	20	30		EGEDHN
CC[C@@H](c1ccccc1)N1CC[C@@H]1CN(C)C(=O)c1c[nH]c(C#N)c1	ZINC001085553198	1358589484	/nfs/dbraw/zinc/58/94/84/1358589484.db2.gz	ZAHYAIZDTFCWCJ-MOPGFXCFSA-N	0	3	336.439	3.184	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N(C)C[C@@H]1CCN1CCCC1CCC1	ZINC001085601456	1358625860	/nfs/dbraw/zinc/62/58/60/1358625860.db2.gz	XKYYNSKKRWMSPE-OTWHNJEPSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc(OC)c(OC)c1C	ZINC001085662428	1358666675	/nfs/dbraw/zinc/66/66/75/1358666675.db2.gz	ZIHIWJFSZXDTEG-INIZCTEOSA-N	0	3	346.471	3.125	20	30		EGEDHN
CCCC[C@](C)(F)C(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001183801977	1387351735	/nfs/dbraw/zinc/35/17/35/1387351735.db2.gz	XANIEWOKNGOZFJ-APWZRJJASA-N	0	3	349.425	3.306	20	30		EGEDHN
C=C1CCC(C(=O)N(C)C[C@H]2CCN2CCCC2CCOCC2)CC1	ZINC001085800697	1358776447	/nfs/dbraw/zinc/77/64/47/1358776447.db2.gz	AEKDLXAOSCOYMG-HXUWFJFHSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C1CCC(C(=O)N(C)C[C@H]2CCN2CC2CC(OCC)C2)CC1	ZINC001085800863	1358776633	/nfs/dbraw/zinc/77/66/33/1358776633.db2.gz	DKRDOWPHNLUMDS-CUYAVPTFSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C1CCC(C(=O)N(C)C[C@H]2CCN2CCC[C@H]2CCOC2)CC1	ZINC001085801487	1358777561	/nfs/dbraw/zinc/77/75/61/1358777561.db2.gz	UIOAVNOLPQYJHC-PKOBYXMFSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N(C)C[C@@H]1CCN1CCC1=CCCCC1	ZINC001085827042	1358795426	/nfs/dbraw/zinc/79/54/26/1358795426.db2.gz	GKZXYVQBSPTTJD-OTWHNJEPSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cn(CC)nc1C(C)C	ZINC001085845481	1358813678	/nfs/dbraw/zinc/81/36/78/1358813678.db2.gz	MZRTZUDDTVPJKZ-MRXNPFEDSA-N	0	3	332.492	3.139	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc(Br)co1	ZINC001085856747	1358824813	/nfs/dbraw/zinc/82/48/13/1358824813.db2.gz	HMFZPGRMHQHCBB-ZDUSSCGKSA-N	0	3	341.249	3.155	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1cc(F)c2ncccc2c1	ZINC001085876113	1358840506	/nfs/dbraw/zinc/84/05/06/1358840506.db2.gz	RYQAATZIGFQCKC-MRXNPFEDSA-N	0	3	327.403	3.096	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cnn(CCC)c1C1CC1	ZINC001085917410	1358877840	/nfs/dbraw/zinc/87/78/40/1358877840.db2.gz	YZSAIXXYMAUCMI-QGZVFWFLSA-N	0	3	344.503	3.283	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1coc(-c2ccccc2)n1	ZINC001085930152	1358887329	/nfs/dbraw/zinc/88/73/29/1358887329.db2.gz	PMMCKZSJFDGIQL-KRWDZBQOSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc(COC)c(F)c1	ZINC001085944635	1358902891	/nfs/dbraw/zinc/90/28/91/1358902891.db2.gz	OHXFAHZDIFEYQM-QGZVFWFLSA-N	0	3	334.435	3.085	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(C3CC3)nc2C)C1	ZINC001086200793	1359024885	/nfs/dbraw/zinc/02/48/85/1359024885.db2.gz	RJFWQVWOXKCJNC-OTVXOJSOSA-N	0	3	333.863	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cnc3ccccc3c2)C1	ZINC001086211021	1359028110	/nfs/dbraw/zinc/02/81/10/1359028110.db2.gz	IMGOIJUWRFDONO-AKAXFMLLSA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc3c(C)cccn3c2)C1	ZINC001086252994	1359042495	/nfs/dbraw/zinc/04/24/95/1359042495.db2.gz	KTTBCPYWNHCOIA-FZNQNYSPSA-N	0	3	331.847	3.098	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc3ncccc3s2)C1	ZINC001086445600	1359098787	/nfs/dbraw/zinc/09/87/87/1359098787.db2.gz	DROVNDQQFIXYEE-HAQNSBGRSA-N	0	3	335.860	3.147	20	30		EGEDHN
C=C(C)CN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2c(C)ccn2C)C1	ZINC001086584326	1359155582	/nfs/dbraw/zinc/15/55/82/1359155582.db2.gz	QSSJRXFMZPCVIV-RBUKOAKNSA-N	0	3	337.467	3.107	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)C2CCC(=C)CC2)C1	ZINC001086607809	1359163117	/nfs/dbraw/zinc/16/31/17/1359163117.db2.gz	ULYKJOWPZKRIIG-LEWJYISDSA-N	0	3	336.479	3.340	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cc([C@@H](C)CC)no2)C1	ZINC001086823254	1359209007	/nfs/dbraw/zinc/20/90/07/1359209007.db2.gz	UUDBYDKXHHAPIW-FPMFFAJLSA-N	0	3	339.867	3.429	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)C3C(C)(C)C3(C)C)C2)CC1	ZINC001086913625	1359240964	/nfs/dbraw/zinc/24/09/64/1359240964.db2.gz	UKJZQZSPVUZOIN-INIZCTEOSA-N	0	3	330.516	3.395	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3cc(C)cs3)C2)CC1	ZINC001086921382	1359248452	/nfs/dbraw/zinc/24/84/52/1359248452.db2.gz	OBXZXXPSYUMBLL-INIZCTEOSA-N	0	3	330.497	3.396	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)C[C@@H]3CCC(F)(F)C3)C2)CC1	ZINC001086925713	1359250849	/nfs/dbraw/zinc/25/08/49/1359250849.db2.gz	FMZXFYCDSRMLPY-HOTGVXAUSA-N	0	3	338.442	3.148	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc(C)c(C)n3)C2)CC1	ZINC001086932219	1359256093	/nfs/dbraw/zinc/25/60/93/1359256093.db2.gz	DTZBQZGKUVOBNX-QGZVFWFLSA-N	0	3	339.483	3.038	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)C[C@@H]3C[C@H]3C3CC3)C2)CC1	ZINC001086933384	1359257188	/nfs/dbraw/zinc/25/71/88/1359257188.db2.gz	LSMQAUFKLINHPT-WDSOQIARSA-N	0	3	328.500	3.149	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3cccc(F)c3F)C2)CC1	ZINC001086938444	1359261045	/nfs/dbraw/zinc/26/10/45/1359261045.db2.gz	QGKSYAAVMRVLRN-HNNXBMFYSA-N	0	3	346.421	3.305	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@H](C)c3ccsc3)C2)CC1	ZINC001086941391	1359263046	/nfs/dbraw/zinc/26/30/46/1359263046.db2.gz	SIDWJHPNICJIBK-HZPDHXFCSA-N	0	3	330.497	3.188	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@H]3CCCC(F)(F)C3)C2)CC1	ZINC001086941084	1359263321	/nfs/dbraw/zinc/26/33/21/1359263321.db2.gz	IPYZLPHMCROVES-HOTGVXAUSA-N	0	3	338.442	3.148	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cccc4[nH]ccc43)C2)CC1	ZINC001086944473	1359265478	/nfs/dbraw/zinc/26/54/78/1359265478.db2.gz	ZZRFMFDPEYSVMA-INIZCTEOSA-N	0	3	335.451	3.118	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc(Cl)c(F)c3)C2)CC1	ZINC001086944696	1359266060	/nfs/dbraw/zinc/26/60/60/1359266060.db2.gz	GQXQVGLMWDWFHN-CQSZACIVSA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cc(F)ccc3Cl)C2)CC1	ZINC001086945339	1359266318	/nfs/dbraw/zinc/26/63/18/1359266318.db2.gz	YUWWCFQTNSUNNG-AWEZNQCLSA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H](C)Cc3ccco3)C2)CC1	ZINC001086947509	1359269211	/nfs/dbraw/zinc/26/92/11/1359269211.db2.gz	AARSQJREGGVZPI-ZWKOTPCHSA-N	0	3	342.483	3.185	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3ncccc3Cl)C2)CC1	ZINC001086953244	1359273052	/nfs/dbraw/zinc/27/30/52/1359273052.db2.gz	BOJNZPBBBXAFLD-HNNXBMFYSA-N	0	3	345.874	3.075	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](CNCc2oc(CCC)nc2C)[C@@H](C)C1	ZINC001184078431	1387388801	/nfs/dbraw/zinc/38/88/01/1387388801.db2.gz	OMJTVASKSIYDQF-DOTOQJQBSA-N	0	3	347.503	3.476	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccc(C#N)cc1F	ZINC001087200462	1359319142	/nfs/dbraw/zinc/31/91/42/1359319142.db2.gz	YBEWZTPGRQBXES-XOKHGSTOSA-N	0	3	349.425	3.162	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc(C)cs3)C(C)(C)[C@H]21	ZINC001087285422	1359364115	/nfs/dbraw/zinc/36/41/15/1359364115.db2.gz	YFFJLBWBHFVUDU-PVAVHDDUSA-N	0	3	330.497	3.299	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc(CC)o1	ZINC001087291920	1359372632	/nfs/dbraw/zinc/37/26/32/1359372632.db2.gz	CJAVDOABBFGDGR-BPQIPLTHSA-N	0	3	328.456	3.084	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)CC1CC(C)(C)C1	ZINC001087301948	1359385265	/nfs/dbraw/zinc/38/52/65/1359385265.db2.gz	LGPDBYPOBLOLMS-NZSAHSFTSA-N	0	3	330.516	3.441	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(C)cc(F)c3)C(C)(C)[C@@H]21	ZINC001087304493	1359388808	/nfs/dbraw/zinc/38/88/08/1359388808.db2.gz	CPJRWFZSYIBJJY-GUDVDZBRSA-N	0	3	342.458	3.376	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccsc3Cl)C(C)(C)[C@H]21	ZINC001087306791	1359393732	/nfs/dbraw/zinc/39/37/32/1359393732.db2.gz	OLWCUMKLYNUPOL-XBFCOCLRSA-N	0	3	336.888	3.254	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc(C)c(CC)o3)C(C)(C)[C@H]21	ZINC001087312339	1359400825	/nfs/dbraw/zinc/40/08/25/1359400825.db2.gz	CTZLLLVOPQDOKX-JLSDUUJJSA-N	0	3	328.456	3.002	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)Cc1ccc(Cl)cc1	ZINC001087315542	1359406034	/nfs/dbraw/zinc/40/60/34/1359406034.db2.gz	DMVGKCMOVHSBLE-NZSAHSFTSA-N	0	3	344.886	3.121	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3occ4c3CCCC4)C(C)(C)[C@@H]21	ZINC001087316661	1359407685	/nfs/dbraw/zinc/40/76/85/1359407685.db2.gz	VXJYYWJFOSQESN-BHIYHBOVSA-N	0	3	340.467	3.010	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)C34CC(C(C)(C)C)(C3)C4)C(C)(C)[C@@H]21	ZINC001087318747	1359410710	/nfs/dbraw/zinc/41/07/10/1359410710.db2.gz	CBQHIWQFIQRGIM-VQHMHIIYSA-N	0	3	342.527	3.441	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc4c3CCC4)C(C)(C)[C@@H]21	ZINC001087320021	1359413022	/nfs/dbraw/zinc/41/30/22/1359413022.db2.gz	XSGANMDPIHTOSQ-VAMGGRTRSA-N	0	3	336.479	3.027	20	30		EGEDHN
C=CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)c2ccncc2)C1	ZINC001087418770	1359456472	/nfs/dbraw/zinc/45/64/72/1359456472.db2.gz	XUCOOLJIYUGXLN-WOJBJXKFSA-N	0	3	335.451	3.246	20	30		EGEDHN
C=CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)c2cccnc2)C1	ZINC001087420093	1359457255	/nfs/dbraw/zinc/45/72/55/1359457255.db2.gz	LHYOQFRZBLVREY-WOJBJXKFSA-N	0	3	335.451	3.246	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2csc([C@H]3CCCO3)n2)[C@H]1CC	ZINC001087571643	1359537028	/nfs/dbraw/zinc/53/70/28/1359537028.db2.gz	DJIVOPYKPGTOSA-NUEKZKHPSA-N	0	3	349.500	3.153	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)Cc2coc3ccc(C)cc23)[C@H]1CC	ZINC001087589705	1359545811	/nfs/dbraw/zinc/54/58/11/1359545811.db2.gz	QSDHOURRNJIBOX-ZWKOTPCHSA-N	0	3	326.440	3.439	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2c(C)noc2C(F)F)[C@H]1CC	ZINC001087618828	1359556908	/nfs/dbraw/zinc/55/69/08/1359556908.db2.gz	LZQFGFOZMKUIGS-NWDGAFQWSA-N	0	3	327.375	3.079	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N[C@H]1CCN(CC(=C)C)[C@@H]1CC	ZINC001087628453	1359563416	/nfs/dbraw/zinc/56/34/16/1359563416.db2.gz	WHPOAJVZDNKNTN-ZWKOTPCHSA-N	0	3	328.456	3.410	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc(F)c3ccncc23)[C@H]1CC	ZINC001087696357	1359596919	/nfs/dbraw/zinc/59/69/19/1359596919.db2.gz	RXVCTOVZYKVYQY-ZWKOTPCHSA-N	0	3	327.403	3.143	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cc(Br)co2)[C@H]1CC	ZINC001087749566	1359626242	/nfs/dbraw/zinc/62/62/42/1359626242.db2.gz	PXGGWVOMPPNAKP-QWHCGFSZSA-N	0	3	341.249	3.201	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2sc(CC3CC3)nc2C)[C@H]1CC	ZINC001087775619	1359637876	/nfs/dbraw/zinc/63/78/76/1359637876.db2.gz	RLRNSLVGNYVLNL-JKSUJKDBSA-N	0	3	345.512	3.010	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc3nc(C)sc3c2)[C@H]1CC	ZINC001087784130	1359643187	/nfs/dbraw/zinc/64/31/87/1359643187.db2.gz	NMNAJJRYBSSBTI-GOEBONIOSA-N	0	3	329.469	3.373	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2cc3c(s2)CCCC3)[C@H]1CC	ZINC001087819041	1359662834	/nfs/dbraw/zinc/66/28/34/1359662834.db2.gz	AVRXPHBZDXMZJX-JKSUJKDBSA-N	0	3	330.497	3.233	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3cc(C)ccc3C3CC3)C[C@@H]2C1	ZINC001088052205	1359735438	/nfs/dbraw/zinc/73/54/38/1359735438.db2.gz	CICOKRNFGIQBSS-MOPGFXCFSA-N	0	3	336.479	3.290	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)C[C@@H](C)c3ccccc3C)C[C@@H]2C1	ZINC001088128928	1359767672	/nfs/dbraw/zinc/76/76/72/1359767672.db2.gz	PAVNPXOZWRERNC-AQNXPRMDSA-N	0	3	338.495	3.292	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)C[C@@H]3CCCC(C)(C)C3)C[C@@H]2C1	ZINC001088170322	1359779677	/nfs/dbraw/zinc/77/96/77/1359779677.db2.gz	NLYCDTCEYYLGPM-OTWHNJEPSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)C[C@@H](C)c3ccc(F)cc3)C[C@@H]2C1	ZINC001088210118	1359796179	/nfs/dbraw/zinc/79/61/79/1359796179.db2.gz	YBEGTPIIIUKOJU-QRQLOZEOSA-N	0	3	342.458	3.123	20	30		EGEDHN
C=CCN1CC[C@H](OCC2CCN(C(=O)[C@@H]3CC34CCCC4)CC2)C1	ZINC001088239686	1359810460	/nfs/dbraw/zinc/81/04/60/1359810460.db2.gz	CXJOFFYPKHUNHO-OALUTQOASA-N	0	3	346.515	3.082	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2cc(CCC)n[nH]2)C1	ZINC001088357007	1359841165	/nfs/dbraw/zinc/84/11/65/1359841165.db2.gz	QKQJLCNTPRJVRO-HNNXBMFYSA-N	0	3	338.883	3.089	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCCCC[C@H](NCc3cncs3)C2)C1	ZINC001088378309	1359861407	/nfs/dbraw/zinc/86/14/07/1359861407.db2.gz	DWBJMTLEXHYJON-HNNXBMFYSA-N	0	3	333.501	3.360	20	30		EGEDHN
C=C(Br)CN[C@H]1CCCCCN(C(=O)C2(CF)CC2)C1	ZINC001088379946	1359863062	/nfs/dbraw/zinc/86/30/62/1359863062.db2.gz	UQHHQYJXPMZEQY-ZDUSSCGKSA-N	0	3	347.272	3.006	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2ocnc2C2CC2)C1	ZINC001088380452	1359864496	/nfs/dbraw/zinc/86/44/96/1359864496.db2.gz	IIXNKOVZTJWNOF-CQSZACIVSA-N	0	3	337.851	3.279	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2cc(C3CC3)n[nH]2)C1	ZINC001088388214	1359866515	/nfs/dbraw/zinc/86/65/15/1359866515.db2.gz	PLYKNHNNHMIEEH-CQSZACIVSA-N	0	3	336.867	3.014	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2ncoc2C2CC2)C1	ZINC001088409558	1359880799	/nfs/dbraw/zinc/88/07/99/1359880799.db2.gz	MLTXCCXNLAQBMG-CQSZACIVSA-N	0	3	337.851	3.279	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2cc3c([nH]2)CCC3)C1	ZINC001088413176	1359884333	/nfs/dbraw/zinc/88/43/33/1359884333.db2.gz	ZQTQBFXKNSUCOT-OAHLLOKOSA-N	0	3	335.879	3.230	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cn(CC)c3ccccc23)[C@H]1C	ZINC001088724771	1360022605	/nfs/dbraw/zinc/02/26/05/1360022605.db2.gz	XCIULPCBWQQEGQ-QAPCUYQASA-N	0	3	325.456	3.430	20	30		EGEDHN
C=C(C)CCN1CC[C@H](NC(=O)c2scnc2C(F)F)[C@H]1C	ZINC001088737980	1360025432	/nfs/dbraw/zinc/02/54/32/1360025432.db2.gz	OBZXRVABBMTOJY-MNOVXSKESA-N	0	3	329.416	3.240	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccc(F)c3ccncc23)[C@H]1C	ZINC001088809302	1360059304	/nfs/dbraw/zinc/05/93/04/1360059304.db2.gz	MWJQBNOBHHYXSH-ACJLOTCBSA-N	0	3	327.403	3.143	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cnoc2-c2ccccc2)[C@H]1C	ZINC001088950632	1360111943	/nfs/dbraw/zinc/11/19/43/1360111943.db2.gz	ZORCWSPIRQDSJY-PBHICJAKSA-N	0	3	325.412	3.110	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3ccc(C)cc3C)[C@@H]2C)nc1	ZINC001088990534	1360126572	/nfs/dbraw/zinc/12/65/72/1360126572.db2.gz	BXFXWOJOASHRMX-XLIONFOSSA-N	0	3	347.462	3.073	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCCN1C(=O)c1ccoc1	ZINC001089119384	1360182717	/nfs/dbraw/zinc/18/27/17/1360182717.db2.gz	SBMRVONILMKROO-IBGZPJMESA-N	0	3	337.423	3.278	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2cncc3ccccc32)CC(C)(C)C1	ZINC001089410146	1360408629	/nfs/dbraw/zinc/40/86/29/1360408629.db2.gz	NURMWUAPHKLJLQ-IBGZPJMESA-N	0	3	349.478	3.017	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc(C)n([C@H](C)CC)n2)CC(C)(C)C1	ZINC001089427433	1360419777	/nfs/dbraw/zinc/41/97/77/1360419777.db2.gz	QHSYFKHMJQMEIO-NVXWUHKLSA-N	0	3	344.503	3.016	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3ocnc3C)CC(C)(C)C2)C1	ZINC001089485139	1360465479	/nfs/dbraw/zinc/46/54/79/1360465479.db2.gz	HYKUDBDMKMZXMU-MRXNPFEDSA-N	0	3	345.487	3.446	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2oc(CC)cc2C)CC(C)(C)C1	ZINC001089538458	1360496842	/nfs/dbraw/zinc/49/68/42/1360496842.db2.gz	BXSBDRBXQPLDAP-MRXNPFEDSA-N	0	3	330.472	3.394	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2sc(C)cc2C)CC(C)(C)C1	ZINC001089548636	1360502191	/nfs/dbraw/zinc/50/21/91/1360502191.db2.gz	OBNUWWPOUYJIFR-INIZCTEOSA-N	0	3	332.513	3.147	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2c(F)cccc2F)CC(C)(C)C1	ZINC001089548713	1360502250	/nfs/dbraw/zinc/50/22/50/1360502250.db2.gz	PIDINJHKZGVPIT-CQSZACIVSA-N	0	3	334.410	3.209	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2scnc2Cl)CC(C)(C)C1	ZINC001089562397	1360510033	/nfs/dbraw/zinc/51/00/33/1360510033.db2.gz	DCOAEEFITHNHPX-GFCCVEGCSA-N	0	3	339.892	3.040	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cnc2[nH]ccc2c1	ZINC001089653043	1360566201	/nfs/dbraw/zinc/56/62/01/1360566201.db2.gz	NLMXZNFBGLOHCG-QGZVFWFLSA-N	0	3	340.471	3.311	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccnc(CCC)c1	ZINC001089653864	1360566393	/nfs/dbraw/zinc/56/63/93/1360566393.db2.gz	CVLAGFIEOBXYNN-IBGZPJMESA-N	0	3	341.499	3.278	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc2n(n1)CCCC2	ZINC001089654707	1360567187	/nfs/dbraw/zinc/56/71/87/1360567187.db2.gz	KYOZDWCIZKBYHS-QGZVFWFLSA-N	0	3	344.503	3.016	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cccc(COC)c1	ZINC001089665815	1360575793	/nfs/dbraw/zinc/57/57/93/1360575793.db2.gz	GEPBTBAJWVXVST-IBGZPJMESA-N	0	3	342.483	3.077	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1cccc(COC)c1	ZINC001089666203	1360576310	/nfs/dbraw/zinc/57/63/10/1360576310.db2.gz	MOKBZRRSLOYERL-SFHVURJKSA-N	0	3	330.472	3.239	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1c(C)onc1C1CC1	ZINC001089671391	1360581517	/nfs/dbraw/zinc/58/15/17/1360581517.db2.gz	QQABWJHJUFJHNQ-INIZCTEOSA-N	0	3	343.471	3.104	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H]1CCc2cccnc21	ZINC001089687070	1360593167	/nfs/dbraw/zinc/59/31/67/1360593167.db2.gz	DTBOARCSZMBLME-ZWKOTPCHSA-N	0	3	341.499	3.294	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc([C@@H](C)CC)no1	ZINC001089707782	1360611718	/nfs/dbraw/zinc/61/17/18/1360611718.db2.gz	SZRZVFGECXPLTF-JKSUJKDBSA-N	0	3	345.487	3.432	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1coc(C2CCC2)n1	ZINC001089720970	1360623177	/nfs/dbraw/zinc/62/31/77/1360623177.db2.gz	BDXCZXLVBNUSLK-MRXNPFEDSA-N	0	3	343.471	3.186	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1[nH]c(C)cc1C	ZINC001089825533	1360682031	/nfs/dbraw/zinc/68/20/31/1360682031.db2.gz	CKVCCJFGIVHUON-HZMVEIRTSA-N	0	3	347.890	3.166	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C(C1CC1)C1CC1	ZINC001089885402	1360719407	/nfs/dbraw/zinc/71/94/07/1360719407.db2.gz	GBABMVOWMNVEMP-MHORFTMASA-N	0	3	348.918	3.344	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)C2CCC3(CC3)CC2)CC2(CCOCC2)C1	ZINC001089946696	1360758502	/nfs/dbraw/zinc/75/85/02/1360758502.db2.gz	NDJMFPKQRQTOAY-SFHVURJKSA-N	0	3	346.515	3.130	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C2CCC(=C)CC2)CC2(CCOCC2)C1	ZINC001089950973	1360760738	/nfs/dbraw/zinc/76/07/38/1360760738.db2.gz	DRFHOVVRSXGQNR-IBGZPJMESA-N	0	3	346.515	3.296	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)[C@H]2CCCC2(C)C)CC2(CCOCC2)C1	ZINC001089952029	1360761488	/nfs/dbraw/zinc/76/14/88/1360761488.db2.gz	ROFBCPQTOVVIII-QZTJIDSGSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)[C@@H](C)C2CCCC2)CC2(CCOCC2)C1	ZINC001089965113	1360770097	/nfs/dbraw/zinc/77/00/97/1360770097.db2.gz	VCXUXBRSJVLDIP-PKOBYXMFSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)[C@@H]2CC23CCCC3)CC2(CCOCC2)C1	ZINC001089965385	1360770124	/nfs/dbraw/zinc/77/01/24/1360770124.db2.gz	ZGLKAXVWZDHIDE-MSOLQXFVSA-N	0	3	346.515	3.130	20	30		EGEDHN
CC(C)N(C)CC(=O)N[C@@H](C)CCCCNc1cccc(F)c1C#N	ZINC001090095817	1360823568	/nfs/dbraw/zinc/82/35/68/1360823568.db2.gz	YDNLKXIAGUJBHP-HNNXBMFYSA-N	0	3	348.466	3.124	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc3nccc(C)c3c2)C1	ZINC001091047277	1360985741	/nfs/dbraw/zinc/98/57/41/1360985741.db2.gz	ATTOTPBDJPZWDA-UHFFFAOYSA-N	0	3	343.858	3.394	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(Cl)cc2C)C1	ZINC001091214016	1361009840	/nfs/dbraw/zinc/00/98/40/1361009840.db2.gz	XYTNOBPCJLQMLM-UHFFFAOYSA-N	0	3	327.255	3.499	20	30		EGEDHN
C[C@@]12CN(Cc3ccc(C#N)cc3)C[C@@H]1CN(C(=O)[C@@H]1CC=CCC1)C2	ZINC001091475143	1361111900	/nfs/dbraw/zinc/11/19/00/1361111900.db2.gz	ZCQUZNYBPRBTNC-SJBKTWHCSA-N	0	3	349.478	3.195	20	30		EGEDHN
CC(C)(C)CC(=O)N1C[C@H]2CN(Cc3ccc(C#N)cc3)C[C@@]2(C)C1	ZINC001091487132	1361118586	/nfs/dbraw/zinc/11/85/86/1361118586.db2.gz	LTYDJFSSORMDLA-NQIIRXRSSA-N	0	3	339.483	3.275	20	30		EGEDHN
CC(C(=O)N1C[C@H]2CN(Cc3ccc(C#N)cc3)C[C@@]2(C)C1)=C1CCC1	ZINC001091657014	1361171406	/nfs/dbraw/zinc/17/14/06/1361171406.db2.gz	MWTVCJOHCAAIJC-IRLDBZIGSA-N	0	3	349.478	3.339	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc(CC(C)C)s3)C[C@]2(C)C1	ZINC001091745747	1361207742	/nfs/dbraw/zinc/20/77/42/1361207742.db2.gz	WWAOVFSWROVWQY-UZLBHIALSA-N	0	3	344.524	3.364	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3ccccc3CC(C)(C)C)C[C@]2(C)C1	ZINC001091768347	1361215355	/nfs/dbraw/zinc/21/53/55/1361215355.db2.gz	AFLNJVSDSQHNJX-GCJKJVERSA-N	0	3	338.495	3.302	20	30		EGEDHN
C[C@@]12CN(Cc3cccc(C#N)c3)C[C@@H]1CN(C(=O)[C@]13C[C@H]1CCC3)C2	ZINC001091869175	1361238850	/nfs/dbraw/zinc/23/88/50/1361238850.db2.gz	QENFVEHSKURLOU-KRXUUXHPSA-N	0	3	349.478	3.029	20	30		EGEDHN
C[C@@]12CN(Cc3ccc(C#N)cc3)C[C@@H]1CN(C(=O)[C@]13C[C@H]1CCC3)C2	ZINC001091868915	1361239036	/nfs/dbraw/zinc/23/90/36/1361239036.db2.gz	BVIWOAWERMVEGM-KRXUUXHPSA-N	0	3	349.478	3.029	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc(C)c(C)cc3Cl)C[C@]2(C)C1	ZINC001091912874	1361244847	/nfs/dbraw/zinc/24/48/47/1361244847.db2.gz	LQAUCPYSGOBOBP-UZLBHIALSA-N	0	3	344.886	3.374	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@@H](C)c3ccc(Cl)cc3)C[C@]2(C)C1	ZINC001091974905	1361264168	/nfs/dbraw/zinc/26/41/68/1361264168.db2.gz	XYOCUZOSMTZUFR-VPWXQRGCSA-N	0	3	344.886	3.247	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CN(Cc4cccc(C#N)c4)C[C@@]3(C)C2)C1	ZINC001091995581	1361269795	/nfs/dbraw/zinc/26/97/95/1361269795.db2.gz	HBVOLNUJIMCSJO-KNQAVFIVSA-N	0	3	349.478	3.195	20	30		EGEDHN
N#CCOc1ccc(NC(=O)N2CCN(C3CCCCC3)CC2)cc1	ZINC001323991661	1387505532	/nfs/dbraw/zinc/50/55/32/1387505532.db2.gz	RLSBXZTUEKBSKI-UHFFFAOYSA-N	0	3	342.443	3.071	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C3CCC(C4CC4)CC3)C[C@]2(C)C1	ZINC001092241211	1361337160	/nfs/dbraw/zinc/33/71/60/1361337160.db2.gz	SAWYJNXJSDVAEE-BRAJZSMUSA-N	0	3	328.500	3.006	20	30		EGEDHN
C=C[C@H](COC)N[C@H]1C[C@@H](NC(=O)OC(C)(C)C)c2ccccc21	ZINC001324020749	1387512023	/nfs/dbraw/zinc/51/20/23/1387512023.db2.gz	BCHUSNZMRUYJEI-XOKHGSTOSA-N	0	3	332.444	3.488	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)CC2CCCC2)CC1	ZINC001093353032	1361566836	/nfs/dbraw/zinc/56/68/36/1361566836.db2.gz	PKBLSXKFOGPLBA-FQEVSTJZSA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)c2ccc(F)cc2)CC1	ZINC001093353619	1361567420	/nfs/dbraw/zinc/56/74/20/1361567420.db2.gz	VBSGDDDMQXUFDP-LJQANCHMSA-N	0	3	340.442	3.166	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C[C@@H]2C=CCC2)CC1	ZINC001093353559	1361567692	/nfs/dbraw/zinc/56/76/92/1361567692.db2.gz	AVIRJMPFDNIFFR-YLJYHZDGSA-N	0	3	326.484	3.069	20	30		EGEDHN
C=CC[N@@H+]1CC2(CCC2)[C@H]1C1CCN(C(=O)c2ccccc2[O-])CC1	ZINC001093353896	1361568527	/nfs/dbraw/zinc/56/85/27/1361568527.db2.gz	DEQKBWSQRSXULH-LJQANCHMSA-N	0	3	340.467	3.285	20	30		EGEDHN
C=CC[N@H+]1CC2(CCC2)[C@H]1C1CCN(C(=O)c2ccccc2[O-])CC1	ZINC001093353896	1361568530	/nfs/dbraw/zinc/56/85/30/1361568530.db2.gz	DEQKBWSQRSXULH-LJQANCHMSA-N	0	3	340.467	3.285	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C[C@@H]2CC=CCC2)CC1	ZINC001093376800	1361586837	/nfs/dbraw/zinc/58/68/37/1361586837.db2.gz	OGVUPRHSLVBHOY-NQIIRXRSSA-N	0	3	340.511	3.459	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@@]2(C)C=CCC2)CC1	ZINC001093377085	1361587438	/nfs/dbraw/zinc/58/74/38/1361587438.db2.gz	PVAXTCMHIYMATC-ICSRJNTNSA-N	0	3	326.484	3.069	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C(C)(C)C2CC2)CC1	ZINC001093377624	1361588402	/nfs/dbraw/zinc/58/84/02/1361588402.db2.gz	VPGYUYVWLXPRPT-SFHVURJKSA-N	0	3	328.500	3.149	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)c2ccc(C)cc2)CC1	ZINC001093383552	1361595289	/nfs/dbraw/zinc/59/52/89/1361595289.db2.gz	NFFPGYXZSUAMBN-HXUWFJFHSA-N	0	3	336.479	3.335	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H](CNCc2cc(C3CC3)no2)[C@H](C)C1	ZINC001094018559	1361725217	/nfs/dbraw/zinc/72/52/17/1361725217.db2.gz	UMAIOGPSJRJVIW-AKCHCHLHSA-N	0	3	345.487	3.338	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3sc(C(C)C)nc3C)CCC[C@@H]12	ZINC001094577346	1361868077	/nfs/dbraw/zinc/86/80/77/1361868077.db2.gz	HGKWUDQLGHIGAL-DNVCBOLYSA-N	0	3	345.512	3.183	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(C(F)F)c(F)c1)C2	ZINC001096004773	1362331214	/nfs/dbraw/zinc/33/12/14/1362331214.db2.gz	PHPHLCFPGBRURU-KCXAZCMYSA-N	0	3	336.357	3.122	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc3cccnc3s1)C2	ZINC001096280707	1362453932	/nfs/dbraw/zinc/45/39/32/1362453932.db2.gz	CTEHKKTXDRLDSV-ILXRZTDVSA-N	0	3	327.453	3.208	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1nsc3ccccc31)C2	ZINC001096589432	1362589281	/nfs/dbraw/zinc/58/92/81/1362589281.db2.gz	XAEIXEMRZZPDMM-COXVUDFISA-N	0	3	341.480	3.136	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(-c3ccncc3)o1)C2	ZINC001097213485	1362887963	/nfs/dbraw/zinc/88/79/63/1362887963.db2.gz	GERYVDVZFQSQCN-ZACQAIPSSA-N	0	3	337.423	3.253	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](CNCc2oc(C)nc2C)[C@@H](C)C1	ZINC001185062785	1387605447	/nfs/dbraw/zinc/60/54/47/1387605447.db2.gz	VLALCVACNTZNMD-YOEHRIQHSA-N	0	3	333.476	3.222	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1)C2	ZINC001098003783	1363194400	/nfs/dbraw/zinc/19/44/00/1363194400.db2.gz	ACZVPPKFLVKRSP-ZRSRNVLSSA-N	0	3	342.870	3.188	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1c[nH]c3cccc(C)c13)C2	ZINC001098230675	1363263016	/nfs/dbraw/zinc/26/30/16/1363263016.db2.gz	NCSYUTOCMCATML-QRQLOZEOSA-N	0	3	337.467	3.316	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc(C)n(CC3CC3)c1C)C2	ZINC001098232526	1363263392	/nfs/dbraw/zinc/26/33/92/1363263392.db2.gz	VMFBIIAGVUJCKH-RLLQIKCJSA-N	0	3	341.499	3.426	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc(C)nc3ccccc31)C2	ZINC001098328229	1363300134	/nfs/dbraw/zinc/30/01/34/1363300134.db2.gz	KXSKADBXGSPNHD-YSGRDPCXSA-N	0	3	335.451	3.454	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1ccc(OC(C)C)cc1)C2	ZINC001098451522	1363329237	/nfs/dbraw/zinc/32/92/37/1363329237.db2.gz	LQJROBPPYLKGNQ-RLLQIKCJSA-N	0	3	342.483	3.314	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(N(C)C(C)C)cc1)C2	ZINC001098491226	1363342251	/nfs/dbraw/zinc/34/22/51/1363342251.db2.gz	LMCWDSFERRHKSQ-AQNXPRMDSA-N	0	3	341.499	3.442	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1CCCC3(CC3)C1)C[C@H](C)O2	ZINC001098600350	1363394202	/nfs/dbraw/zinc/39/42/02/1363394202.db2.gz	ZFJQARHLOBKVGQ-ROUUACIJSA-N	0	3	346.515	3.225	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H]1CCCC1(C)C)C[C@@H](C)O2	ZINC001098627113	1363405881	/nfs/dbraw/zinc/40/58/81/1363405881.db2.gz	JHRYERFWZSTFDZ-SJORKVTESA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H](C)CC1CCCC1)C[C@H](C)O2	ZINC001098642912	1363413356	/nfs/dbraw/zinc/41/33/56/1363413356.db2.gz	PAGATGNKEFGFJM-ROUUACIJSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccc(C)cc1F)C[C@@H](C)O2	ZINC001098643075	1363413759	/nfs/dbraw/zinc/41/37/59/1363413759.db2.gz	RWUAIFMDVPGPAY-MRXNPFEDSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](n2cc(CNCCCCCC)nn2)C1	ZINC001098710705	1363445060	/nfs/dbraw/zinc/44/50/60/1363445060.db2.gz	JXYIBLBYDINJKU-GOSISDBHSA-N	0	3	347.507	3.078	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)C(F)=C(C)C	ZINC001099017904	1363578275	/nfs/dbraw/zinc/57/82/75/1363578275.db2.gz	ZIKVUCRKJWZISY-OAHLLOKOSA-N	0	3	326.456	3.059	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccoc1CC	ZINC001099039175	1363587899	/nfs/dbraw/zinc/58/78/99/1363587899.db2.gz	UIHRYSFKEQESTR-INIZCTEOSA-N	0	3	348.487	3.265	20	30		EGEDHN
C#CCCCC(=O)NC[C@@H]1CCC(C)(C)CN1CCOCC(C)C	ZINC001099042829	1363589954	/nfs/dbraw/zinc/58/99/54/1363589954.db2.gz	CJZYJFMZIKEOSD-SFHVURJKSA-N	0	3	336.520	3.069	20	30		EGEDHN
CC(C)OCCN1CC(C)(C)CC[C@@H]1CNC(=O)C#CC(C)(C)C	ZINC001099069616	1363605991	/nfs/dbraw/zinc/60/59/91/1363605991.db2.gz	JYDRIILIALKSPL-QGZVFWFLSA-N	0	3	336.520	3.068	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H]2C[C@H]2c2ccccc2C)C1	ZINC001099074925	1363610005	/nfs/dbraw/zinc/61/00/05/1363610005.db2.gz	DWOPURMPGWYCMF-KMQSCTNJSA-N	0	3	336.479	3.093	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(Cl)cc(OC)c2)C1	ZINC001099089667	1363616681	/nfs/dbraw/zinc/61/66/81/1363616681.db2.gz	KYABWRRJUTVDNX-KSSFIOAISA-N	0	3	334.847	3.119	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)C[C@H]2CCc3ccccc32)C1	ZINC001099088277	1363616810	/nfs/dbraw/zinc/61/68/10/1363616810.db2.gz	FDKOZZOOTYQCJL-DXIQSLLYSA-N	0	3	336.479	3.101	20	30		EGEDHN
CN1CCC(N(Cc2ccccc2)C(=O)c2csc(C#N)c2)CC1	ZINC001324473522	1387635697	/nfs/dbraw/zinc/63/56/97/1387635697.db2.gz	CRVCMZHUSFPYKA-UHFFFAOYSA-N	0	3	339.464	3.356	20	30		EGEDHN
C#CCCN1C[C@@H]2CCC[C@]2(NC(=O)c2sccc2C(F)F)C1	ZINC001099142589	1363652139	/nfs/dbraw/zinc/65/21/39/1363652139.db2.gz	UQDUPMIGEZNBLW-SJCJKPOMSA-N	0	3	338.423	3.293	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)c2c[nH]c3c2cccc3CC)C1	ZINC001099176484	1363673180	/nfs/dbraw/zinc/67/31/80/1363673180.db2.gz	VTXDEDVNWAFHLO-JTSKRJEESA-N	0	3	349.478	3.338	20	30		EGEDHN
C#CCCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(C(C)C)s2)C1	ZINC001099178266	1363675221	/nfs/dbraw/zinc/67/52/21/1363675221.db2.gz	IEBOTIHGUOWAQY-KXBFYZLASA-N	0	3	330.497	3.479	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@](C)(C=C)CC	ZINC001099214169	1363694931	/nfs/dbraw/zinc/69/49/31/1363694931.db2.gz	HPLJYTBXRJGUQI-FXAWDEMLSA-N	0	3	336.520	3.398	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)C1(C(C)(F)F)CC1	ZINC001099239488	1363708540	/nfs/dbraw/zinc/70/85/40/1363708540.db2.gz	FNHVOGXLJLKILP-CQSZACIVSA-N	0	3	326.431	3.052	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)C1(C(C)(F)F)CC1	ZINC001099239487	1363708385	/nfs/dbraw/zinc/70/83/85/1363708385.db2.gz	FNHVOGXLJLKILP-AWEZNQCLSA-N	0	3	326.431	3.052	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)CCn1ccnc1C(C)C	ZINC001099259133	1363720509	/nfs/dbraw/zinc/72/05/09/1363720509.db2.gz	XOBHZMLZVHHOPA-QGZVFWFLSA-N	0	3	346.519	3.189	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2ccc(CC)cc2)C[C@H]1C(F)(F)F	ZINC001099338706	1363758889	/nfs/dbraw/zinc/75/88/89/1363758889.db2.gz	GOTJOHBPITWIHB-HUUCEWRRSA-N	0	3	326.362	3.028	20	30		EGEDHN
C#CCC1(C(=O)NC[C@@H]2CCC(C)(C)CN2CCOC)CCCCC1	ZINC001099358162	1363771071	/nfs/dbraw/zinc/77/10/71/1363771071.db2.gz	FRIMITVTCFOPGJ-SFHVURJKSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)CCCC#CC	ZINC001099513496	1363828542	/nfs/dbraw/zinc/82/85/42/1363828542.db2.gz	PXRMZHVCWCHXLC-MLHJIOFPSA-N	0	3	334.891	3.101	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)/C=C\C(C)(C)C)CC2(CCOCC2)C1	ZINC001099572134	1363856668	/nfs/dbraw/zinc/85/66/68/1363856668.db2.gz	SMOJLXCXHZPRAU-JTGQJZMRSA-N	0	3	334.504	3.152	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1CN(CC(=C)C)CC2(CCOCC2)C1	ZINC001099587121	1363868142	/nfs/dbraw/zinc/86/81/42/1363868142.db2.gz	QHFLIGXZVGENHQ-IBGZPJMESA-N	0	3	346.515	3.134	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1CCN(Cc2ccccc2C(C)C)C[C@H]1O	ZINC001099959104	1363991090	/nfs/dbraw/zinc/99/10/90/1363991090.db2.gz	CGSOSHPJKVPHJQ-RBUKOAKNSA-N	0	3	344.499	3.074	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1CCN(Cc2ccc(CCC)cc2)C[C@@H]1O	ZINC001099977347	1363995374	/nfs/dbraw/zinc/99/53/74/1363995374.db2.gz	XMBQTOHQJKRZPA-PMACEKPBSA-N	0	3	344.499	3.047	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H](C)CCCC)C[C@H]1c1ccc(OC)cc1	ZINC001100158854	1364031476	/nfs/dbraw/zinc/03/14/76/1364031476.db2.gz	NSZGGWMHRFKKOF-FFZOFVMBSA-N	0	3	342.483	3.039	20	30		EGEDHN
CC[C@@H](C)CC(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1	ZINC001100282408	1364066704	/nfs/dbraw/zinc/06/67/04/1364066704.db2.gz	KTVMTCOSPTVEJV-BZOOQXSSSA-N	0	3	331.435	3.118	20	30		EGEDHN
C#CCCCC(=O)NCC1CC(NCc2cccc(Cl)c2F)C1	ZINC001100283302	1364067187	/nfs/dbraw/zinc/06/71/87/1364067187.db2.gz	IWCMCNHOIZXKGB-UHFFFAOYSA-N	0	3	336.838	3.267	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)[C@@]2(C)CC=CCC2)C1	ZINC001100359845	1364090723	/nfs/dbraw/zinc/09/07/23/1364090723.db2.gz	OFCOHXZNUBBTRR-XUJLQICISA-N	0	3	341.293	3.126	20	30		EGEDHN
O=C(NCC1CC(NCC#Cc2ccccc2)C1)c1[nH]ccc1C1CC1	ZINC001100392748	1364100050	/nfs/dbraw/zinc/10/00/50/1364100050.db2.gz	XRVRHLUBPMVKPZ-UHFFFAOYSA-N	0	3	347.462	3.042	20	30		EGEDHN
C[C@@]1(C(=O)NCC2CC(NCc3ccc(C#N)cc3F)C2)C=CCC1	ZINC001100585371	1364175139	/nfs/dbraw/zinc/17/51/39/1364175139.db2.gz	ZCOHGXHHMNEKKH-MKJPBZQASA-N	0	3	341.430	3.038	20	30		EGEDHN
CC#CCCCC(=O)NCC1CC(NCc2cc(F)ccc2F)C1	ZINC001100590127	1364177769	/nfs/dbraw/zinc/17/77/69/1364177769.db2.gz	KULKNUHSFGKEEK-UHFFFAOYSA-N	0	3	334.410	3.143	20	30		EGEDHN
C=CCCC1(C(=O)NCC2CC(NCC(=C)Br)C2)CC1	ZINC001100642516	1364201318	/nfs/dbraw/zinc/20/13/18/1364201318.db2.gz	AQKRVGMMOYLDOJ-UHFFFAOYSA-N	0	3	341.293	3.126	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@]2(C)C[C@@H]2c2ccccc2)C1	ZINC001100748514	1364246019	/nfs/dbraw/zinc/24/60/19/1364246019.db2.gz	OGWRWWFVKACGFH-SYARIVLMSA-N	0	3	332.875	3.417	20	30		EGEDHN
O=C(NCC1CC(NCC#Cc2ccccc2)C1)c1c[nH]cc1C1CC1	ZINC001100805013	1364271603	/nfs/dbraw/zinc/27/16/03/1364271603.db2.gz	HODGCISCTOOWRY-UHFFFAOYSA-N	0	3	347.462	3.042	20	30		EGEDHN
CCCCCCCCC(=O)NCC1CC(NCc2cnnn2CC)C1	ZINC001100906458	1364324890	/nfs/dbraw/zinc/32/48/90/1364324890.db2.gz	HVTPXYVILIMOLY-UHFFFAOYSA-N	0	3	349.523	3.033	20	30		EGEDHN
CCCCCCCCC(=O)NCC1CC(N[C@H](C)c2n[nH]c(C)n2)C1	ZINC001100906540	1364325004	/nfs/dbraw/zinc/32/50/04/1364325004.db2.gz	MQLAMDHHDDPSQF-ODIFPOPNSA-N	0	3	349.523	3.409	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H](OCC)c2ccccc2)C1	ZINC001101062345	1364397315	/nfs/dbraw/zinc/39/73/15/1364397315.db2.gz	MADZPXLSJDTEJO-PREGVCBESA-N	0	3	336.863	3.001	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)CCc2cccc(F)c2F)C1	ZINC001101074160	1364400905	/nfs/dbraw/zinc/40/09/05/1364400905.db2.gz	BIRBTOWUCDXMFB-UHFFFAOYSA-N	0	3	342.817	3.134	20	30		EGEDHN
C=CCCC(=O)NCc1cc(O[C@H]2CCN(CC=C(C)C)C2)ccn1	ZINC001101090878	1364408264	/nfs/dbraw/zinc/40/82/64/1364408264.db2.gz	QKAQJHXVMLJBAO-IBGZPJMESA-N	0	3	343.471	3.083	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@H]2CN(C/C=C\c3ccccc3)C[C@@]2(C)C1	ZINC001101229248	1364476043	/nfs/dbraw/zinc/47/60/43/1364476043.db2.gz	QRVJKACZIDTHDJ-GODSMEOCSA-N	0	3	336.479	3.140	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@H]2CN(Cc3ccc(C#N)cc3)C[C@@]2(C)C1	ZINC001101253832	1364487023	/nfs/dbraw/zinc/48/70/23/1364487023.db2.gz	ZJKRLXZVYREMPR-CTNGQTDRSA-N	0	3	337.467	3.195	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC(C(C)(C)CNCc2ccon2)CC1	ZINC001101562389	1364620580	/nfs/dbraw/zinc/62/05/80/1364620580.db2.gz	AFPLVZGSEDQDNV-UHFFFAOYSA-N	0	3	333.476	3.241	20	30		EGEDHN
C=CCC[C@@H](C)N1CC2(C1)C[C@H](NC(=O)C(CC)CC)c1nccn12	ZINC001101610110	1364654944	/nfs/dbraw/zinc/65/49/44/1364654944.db2.gz	GUQZPBVYPYKUJK-WBVHZDCISA-N	0	3	344.503	3.246	20	30		EGEDHN
C=CCC[C@H](C)N1CC2(C1)C[C@@H](NC(=O)/C=C(/C)CC)c1nccn12	ZINC001101627886	1364661496	/nfs/dbraw/zinc/66/14/96/1364661496.db2.gz	PSTWJNCBHWJYHG-CZAONCGOSA-N	0	3	342.487	3.166	20	30		EGEDHN
C/C(=C/C(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C)C1CC1	ZINC001101772485	1364721288	/nfs/dbraw/zinc/72/12/88/1364721288.db2.gz	GPDJLRIFIZIRLH-LNCDNJPKSA-N	0	3	336.479	3.079	20	30		EGEDHN
CC[C@H](C)CC(=O)NC[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1C	ZINC001101917921	1364773499	/nfs/dbraw/zinc/77/34/99/1364773499.db2.gz	CQRIVBNHTNPMBM-HDMKZQKVSA-N	0	3	345.462	3.318	20	30		EGEDHN
CC/C(C)=C\C(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001101943457	1364784177	/nfs/dbraw/zinc/78/41/77/1364784177.db2.gz	VNCRFSABMPGJQQ-KWLXYHDNSA-N	0	3	331.485	3.160	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H]1CN(Cc2cc(F)ccc2OC)C[C@H]1C	ZINC001102228082	1364944637	/nfs/dbraw/zinc/94/46/37/1364944637.db2.gz	SDOWOMQZJXFABT-GDBMZVCRSA-N	0	3	348.462	3.231	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@@H]1CN(Cc2oc(C)nc2C)C[C@H]1C	ZINC001102260770	1364973420	/nfs/dbraw/zinc/97/34/20/1364973420.db2.gz	CQUFFHLFIWKEIE-CKEIUWERSA-N	0	3	333.476	3.078	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](NCc3ccccc3N(C)C)C2)CC1	ZINC001185439687	1387717640	/nfs/dbraw/zinc/71/76/40/1387717640.db2.gz	VQUCECLCZHYRMH-GOSISDBHSA-N	0	3	341.499	3.190	20	30		EGEDHN
CCCC(=O)NCC[C@@H]1CN(Cc2ccc(C#N)cc2F)C[C@H]1C	ZINC001102637847	1365148330	/nfs/dbraw/zinc/14/83/30/1365148330.db2.gz	XMRYJZLXQGMVHP-GDBMZVCRSA-N	0	3	331.435	3.072	20	30		EGEDHN
C=CCCC(=O)NCC[C@@H]1CN(Cc2nc(C)c(C)s2)C[C@H]1C	ZINC001102760269	1365205718	/nfs/dbraw/zinc/20/57/18/1365205718.db2.gz	NBPUBXYXZOBYBJ-CZUORRHYSA-N	0	3	335.517	3.300	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCC[C@@H]1CN(Cc2sccc2Cl)C[C@H]1C	ZINC001102784082	1365216613	/nfs/dbraw/zinc/21/66/13/1365216613.db2.gz	LKHXBGIXUKMMBO-YNEHKIRRSA-N	0	3	339.892	3.135	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CCNC(=O)[C@@H]1CC1(C)C	ZINC001102869954	1365261596	/nfs/dbraw/zinc/26/15/96/1365261596.db2.gz	NWVMDFHEJZORDV-CPUCHLNUSA-N	0	3	345.512	3.240	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2ccoc2Cl)C1	ZINC001102920160	1365292623	/nfs/dbraw/zinc/29/26/23/1365292623.db2.gz	UYVIUUPJMJOKOE-ZYHUDNBSSA-N	0	3	331.243	3.373	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCC[C@@H]1CN(Cc2ccns2)C[C@H]1C	ZINC001103022104	1365341563	/nfs/dbraw/zinc/34/15/63/1365341563.db2.gz	YORZPGRFMYYSSV-NVXWUHKLSA-N	0	3	347.528	3.486	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cc(C)cc(C)n2)C1	ZINC001103171653	1365419845	/nfs/dbraw/zinc/41/98/45/1365419845.db2.gz	MYNJUNFQNYAZGG-CZUORRHYSA-N	0	3	335.879	3.139	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)CC[C@@H]2CCCCO2)C1	ZINC001103483474	1365590274	/nfs/dbraw/zinc/59/02/74/1365590274.db2.gz	DHXZRPYPOVZCEM-OIISXLGYSA-N	0	3	342.911	3.162	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)[C@H](C)c2cccnc2)C1	ZINC001103652246	1365703404	/nfs/dbraw/zinc/70/34/04/1365703404.db2.gz	WCRGQFJRENLOFZ-FRFSOERESA-N	0	3	335.879	3.012	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)C(C)(C)C(C)(F)F)C1	ZINC001103679105	1365723686	/nfs/dbraw/zinc/72/36/86/1365723686.db2.gz	CZBKCNGMAZYMBJ-DGCLKSJQSA-N	0	3	336.854	3.495	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)[C@H]2[C@H]3[C@@H]2[C@@H]2CC[C@H]3C2)C1	ZINC001103766853	1365772718	/nfs/dbraw/zinc/77/27/18/1365772718.db2.gz	MSHYWYOWWRAXON-HFFDDPIYSA-N	0	3	336.907	3.105	20	30		EGEDHN
Cc1cnc2ccccc2c1N1CCN(c2cnccc2C#N)CC1	ZINC001324767388	1387764498	/nfs/dbraw/zinc/76/44/98/1387764498.db2.gz	IOTLEKPPPPXFHG-UHFFFAOYSA-N	0	3	329.407	3.137	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cc3occc3[nH]2)C[C@H]1C	ZINC001104253983	1365969534	/nfs/dbraw/zinc/96/95/34/1365969534.db2.gz	MHVNDPMLFWKPGJ-DGCLKSJQSA-N	0	3	335.835	3.201	20	30		EGEDHN
C=CCn1cccc1C(=O)N1C[C@@H](C)[C@H](CCNCC(=C)Cl)C1	ZINC001104293772	1365977541	/nfs/dbraw/zinc/97/75/41/1365977541.db2.gz	CSQCSBYSZUTPJO-GDBMZVCRSA-N	0	3	335.879	3.114	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@H](CCNCc2c(C)noc2C)C1	ZINC001104485698	1366045188	/nfs/dbraw/zinc/04/51/88/1366045188.db2.gz	JHCZLAGKMVMNET-RHSMWYFYSA-N	0	3	347.503	3.468	20	30		EGEDHN
CC[C@@H](F)C(=O)N1C[C@@H](C)[C@H](CCNCc2ccc(C#N)cc2F)C1	ZINC001104500428	1366050989	/nfs/dbraw/zinc/05/09/89/1366050989.db2.gz	QBMGPERPTKXWJY-KBRIMQKVSA-N	0	3	349.425	3.020	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CN(C(=O)C(C)(C)CC)C[C@H]1C	ZINC001104608636	1366100475	/nfs/dbraw/zinc/10/04/75/1366100475.db2.gz	ODDOLZCCNFLCQU-TZMCWYRMSA-N	0	3	345.325	3.405	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H](C)[C@H](CCNCc2ccc(F)cn2)C1	ZINC001104631388	1366110204	/nfs/dbraw/zinc/11/02/04/1366110204.db2.gz	LFCDTKXJWCWZBW-JXXFODFXSA-N	0	3	347.478	3.397	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)CCCOC(C)C)C[C@H]1C	ZINC001105100397	1366328049	/nfs/dbraw/zinc/32/80/49/1366328049.db2.gz	QKAPWVIHVOBNMC-GDBMZVCRSA-N	0	3	330.900	3.018	20	30		EGEDHN
CCC(=O)N[C@H]1C[C@@](CNCc2ccccc2C#N)(c2ccccc2)C1	ZINC001105398268	1366446468	/nfs/dbraw/zinc/44/64/68/1366446468.db2.gz	RMCCOTZECLGRBM-GRGXKFILSA-N	0	3	347.462	3.274	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1C[C@@](CNCC(=C)Cl)(c2ccccc2)C1	ZINC001105419966	1366458044	/nfs/dbraw/zinc/45/80/44/1366458044.db2.gz	YOBAFNONKONVAS-PUZFROQSSA-N	0	3	344.886	3.349	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](CNCc2nc(C)cs2)[C@H](C)C1	ZINC001106183845	1366617361	/nfs/dbraw/zinc/61/73/61/1366617361.db2.gz	QYHKFSGSMZXUDL-UKRRQHHQSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@@H](CNCc2ccn(C(C)C)n2)[C@H](C)C1	ZINC001106567579	1366739798	/nfs/dbraw/zinc/73/97/98/1366739798.db2.gz	KZOBGKJVMAHZAW-KZNAEPCWSA-N	0	3	346.519	3.250	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H](CNCc2csc(C)n2)[C@H](C)C1	ZINC001106710825	1366778204	/nfs/dbraw/zinc/77/82/04/1366778204.db2.gz	XMQRAQSKOLFUER-UKRRQHHQSA-N	0	3	335.517	3.238	20	30		EGEDHN
Cc1cc(N2CCN(C)[C@@H](C)[C@@H]2C)n2c3ccccc3nc2c1C#N	ZINC001185967803	1387837292	/nfs/dbraw/zinc/83/72/92/1387837292.db2.gz	CCZWVXYIERNRRV-GJZGRUSLSA-N	0	3	333.439	3.196	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](N(C)CCOc2ccc(Cl)cc2)C1	ZINC001189319419	1366988078	/nfs/dbraw/zinc/98/80/78/1366988078.db2.gz	ZDVMGAJDBQEUMS-MRXNPFEDSA-N	0	3	336.863	3.218	20	30		EGEDHN
CC(C)[C@H](C)CC(=O)N1CC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001189326038	1366992060	/nfs/dbraw/zinc/99/20/60/1366992060.db2.gz	CJQCRUUIAQWCDS-VQIMIIECSA-N	0	3	327.472	3.273	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@]12CCC[C@H]1N(Cc1cc(C)no1)CC2	ZINC001107536254	1367028216	/nfs/dbraw/zinc/02/82/16/1367028216.db2.gz	JQQYBINSZLTSKN-YZGWKJHDSA-N	0	3	345.487	3.446	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2cccc(C)c2)C1	ZINC001107711642	1367113738	/nfs/dbraw/zinc/11/37/38/1367113738.db2.gz	JGVZRYWOEPHXFG-FXAWDEMLSA-N	0	3	330.472	3.170	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@H](C)c1c(C)noc1C)C2	ZINC001109462849	1367136298	/nfs/dbraw/zinc/13/62/98/1367136298.db2.gz	SZESIJUGNVGAOT-IEAZIUSSSA-N	0	3	331.460	3.083	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)CC2=CCCCC2)C1	ZINC001107813103	1367157391	/nfs/dbraw/zinc/15/73/91/1367157391.db2.gz	NOXTXUCCGXNGLM-FXAWDEMLSA-N	0	3	334.504	3.439	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@]1(C)CN(C[C@H](C)CC(C)C)CCO1	ZINC001107883159	1367191138	/nfs/dbraw/zinc/19/11/38/1367191138.db2.gz	MIVFLPPJRFJYLN-QUCCMNQESA-N	0	3	336.520	3.069	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2ccoc2CC)C1	ZINC001107910697	1367197577	/nfs/dbraw/zinc/19/75/77/1367197577.db2.gz	MKSDVBDVVDFFFW-DNVCBOLYSA-N	0	3	334.460	3.017	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2cccc(F)c2C)C1	ZINC001107957915	1367216473	/nfs/dbraw/zinc/21/64/73/1367216473.db2.gz	QGCGPKHHGXMBMH-QRWLVFNGSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2scc(C)c2Cl)C1	ZINC001190320033	1367225832	/nfs/dbraw/zinc/22/58/32/1367225832.db2.gz	VIYDUZSQWFEWSG-ZDUSSCGKSA-N	0	3	342.892	3.059	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2[nH]ccc2C2CC2)C1	ZINC001107990145	1367231901	/nfs/dbraw/zinc/23/19/01/1367231901.db2.gz	AWFDFKBTXYGNLW-QRWLVFNGSA-N	0	3	345.487	3.068	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](N(C)C[C@H]2CC(C)(C)CO2)C1	ZINC001190353645	1367235506	/nfs/dbraw/zinc/23/55/06/1367235506.db2.gz	BBHAEANLQJCMSE-ZWKOTPCHSA-N	0	3	334.504	3.103	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)C23CCC(CC2)C3)C1	ZINC001108030148	1367249927	/nfs/dbraw/zinc/24/99/27/1367249927.db2.gz	BBGQZTVWCOFSQJ-PYXOFJJQSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3CCCOC(C)C)CC1	ZINC001109675705	1367275481	/nfs/dbraw/zinc/27/54/81/1367275481.db2.gz	FBRIFKTTWACMBO-QYZOEREBSA-N	0	3	334.504	3.269	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)C2(C3CC3)CCC2)C1	ZINC001108101923	1367282644	/nfs/dbraw/zinc/28/26/44/1367282644.db2.gz	VPMGNJRYKLWBRZ-VQIMIIECSA-N	0	3	334.504	3.129	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@@H](N(C)Cc3ccc(F)cc3C)C2)CCC1	ZINC001190603838	1367305509	/nfs/dbraw/zinc/30/55/09/1367305509.db2.gz	KCLJXXKBZIRKSA-LJQANCHMSA-N	0	3	342.458	3.360	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc([C@@H](C)CC)no1)C2	ZINC001109816420	1367338863	/nfs/dbraw/zinc/33/88/63/1367338863.db2.gz	UXDCRQROICKYJR-FSDCSDTHSA-N	0	3	331.460	3.489	20	30		EGEDHN
CC(C)C1CCN([C@H]2CCCN(c3ccc(C#N)cc3)C2=O)CC1	ZINC001191013831	1367402253	/nfs/dbraw/zinc/40/22/53/1367402253.db2.gz	PIYQFDUOZVAJSG-IBGZPJMESA-N	0	3	325.456	3.422	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)C(C)(C)C(C)(F)F)C1	ZINC001108369231	1367418730	/nfs/dbraw/zinc/41/87/30/1367418730.db2.gz	NBHOJPAQYJCDBI-WMLDXEAASA-N	0	3	346.462	3.230	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](N(C)CCc2scnc2C)C1	ZINC001191763450	1367580126	/nfs/dbraw/zinc/58/01/26/1367580126.db2.gz	LPFPOHRFCCBUCJ-KRWDZBQOSA-N	0	3	347.528	3.110	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](N(C)CCOc2ccc(C)cc2)C1	ZINC001191867791	1367621184	/nfs/dbraw/zinc/62/11/84/1367621184.db2.gz	IQQCIINRHMFVPH-LJQANCHMSA-N	0	3	342.483	3.100	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@@H](N(C)CCOc2ccccc2)C1	ZINC001191911451	1367635534	/nfs/dbraw/zinc/63/55/34/1367635534.db2.gz	GDQZONZGQPXAAB-QZTJIDSGSA-N	0	3	330.472	3.200	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@H](N(C)Cc2ccc(COC)cc2)C1	ZINC001191913012	1367636406	/nfs/dbraw/zinc/63/64/06/1367636406.db2.gz	VFPNGKTYSXVXJA-PXNSSMCTSA-N	0	3	344.499	3.468	20	30		EGEDHN
CC#CCN1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)/C(C)=C/C)C1	ZINC001186180749	1387891313	/nfs/dbraw/zinc/89/13/13/1387891313.db2.gz	QDGXBKUMBAYYRF-KAKWSUSISA-N	0	3	342.458	3.337	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2[C@H](C)c1cccc(OC)c1	ZINC001110380003	1367680999	/nfs/dbraw/zinc/68/09/99/1367680999.db2.gz	IXCIOFKOQDNLLO-OPNNQBFTSA-N	0	3	328.456	3.444	20	30		EGEDHN
C=CCOCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccccc1C(C)C	ZINC001110390645	1367685473	/nfs/dbraw/zinc/68/54/73/1367685473.db2.gz	WWJOMQFQAPTQHS-RLLQIKCJSA-N	0	3	342.483	3.234	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)CCCCc2ccccc2)C1	ZINC001192114851	1367692310	/nfs/dbraw/zinc/69/23/10/1367692310.db2.gz	NWISISDMVHVXCD-HXUWFJFHSA-N	0	3	344.499	3.135	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@H](N(C)Cc3cccc(OC)c3)C2)CC1	ZINC001192180879	1367708424	/nfs/dbraw/zinc/70/84/24/1367708424.db2.gz	NWIRQXXJSVAXBW-SFHVURJKSA-N	0	3	342.483	3.474	20	30		EGEDHN
CCCC1(C(=O)N2CC[C@H](N(C)Cc3ccc(C#N)cc3)C2)CC1	ZINC001192256368	1367731808	/nfs/dbraw/zinc/73/18/08/1367731808.db2.gz	GVOWKIWVCIZKGF-SFHVURJKSA-N	0	3	325.456	3.171	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2C[C@@H](OC)c1ccccc1	ZINC001109054896	1367741541	/nfs/dbraw/zinc/74/15/41/1367741541.db2.gz	DYUUUQWCSRKRGN-YDZRNGNQSA-N	0	3	328.456	3.062	20	30		EGEDHN
CCCCCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C1(F)CCOCC1)C2	ZINC001110639312	1367885093	/nfs/dbraw/zinc/88/50/93/1367885093.db2.gz	FZVHYOJCMRDHTO-ZACQAIPSSA-N	0	3	340.483	3.197	20	30		EGEDHN
CC(C)C[C@H](C)C(=O)N1CC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001193088172	1367940948	/nfs/dbraw/zinc/94/09/48/1367940948.db2.gz	RVYMQHYKSIBURE-QFBILLFUSA-N	0	3	327.472	3.273	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)Cc1c(C)nc2ccccc2c1C	ZINC001186279995	1387914058	/nfs/dbraw/zinc/91/40/58/1387914058.db2.gz	WJMHYDFSSYDJLQ-KRWDZBQOSA-N	0	3	337.467	3.161	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC001193651744	1368085406	/nfs/dbraw/zinc/08/54/06/1368085406.db2.gz	LLIFLIUUMJNCTK-LJQANCHMSA-N	0	3	344.499	3.333	20	30		EGEDHN
N#Cc1cccc([C@H](O)CN2CC[C@@H](Oc3ccc(Cl)cc3)C2)c1	ZINC001194633358	1368299721	/nfs/dbraw/zinc/29/97/21/1368299721.db2.gz	RYMQPPHADQDTFV-RTBURBONSA-N	0	3	342.826	3.398	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](CCCC)C(C)C)C2	ZINC001111475099	1368314374	/nfs/dbraw/zinc/31/43/74/1368314374.db2.gz	XIVNAVBTUWLZOA-HCXYKTFWSA-N	0	3	336.520	3.373	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](CC)c1ccc(F)cc1)C2	ZINC001111479114	1368316897	/nfs/dbraw/zinc/31/68/97/1368316897.db2.gz	HENDTFMSHZZNPY-HCXYKTFWSA-N	0	3	328.431	3.064	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)C[C@@H](NC(=O)CCCF)c1ccccc1O2	ZINC001111531645	1368330763	/nfs/dbraw/zinc/33/07/63/1368330763.db2.gz	GHOJZCNGKADYER-YLJYHZDGSA-N	0	3	346.446	3.397	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@](C)(F)CCCC)C[C@H](C)O2	ZINC001111546123	1368339190	/nfs/dbraw/zinc/33/91/90/1368339190.db2.gz	XWWKZHDHLBGSII-WMZOPIPTSA-N	0	3	340.483	3.173	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@@H](C)C(C)(C)C)C[C@@H](C)O2	ZINC001111553073	1368344427	/nfs/dbraw/zinc/34/44/27/1368344427.db2.gz	UDEQSGCHMKWLGX-IAGOWNOFSA-N	0	3	336.520	3.327	20	30		EGEDHN
C=CCCC(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(OC)cc1)C2	ZINC001111648936	1368411049	/nfs/dbraw/zinc/41/10/49/1368411049.db2.gz	VWSYYMBNLDSJFS-PXNSSMCTSA-N	0	3	328.456	3.132	20	30		EGEDHN
C=C(C)CCC(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(C#N)cc1)C2	ZINC001111764049	1368450438	/nfs/dbraw/zinc/45/04/38/1368450438.db2.gz	WBIYHVAPHZRSSH-FPOVZHCZSA-N	0	3	337.467	3.385	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H](C)OCc2ccc(C)cc2)C1	ZINC001111822632	1368482967	/nfs/dbraw/zinc/48/29/67/1368482967.db2.gz	IJVQQDQDRAHUMY-LMNJBCLMSA-N	0	3	342.483	3.057	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@]12CCC[C@H]1CN(Cc1ncccc1C)C2	ZINC001111848773	1368502530	/nfs/dbraw/zinc/50/25/30/1368502530.db2.gz	SPQMYKMWKHYZQS-WFXMLNOXSA-N	0	3	341.499	3.463	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@]12CCC[C@H]1CN(Cc1cccnc1C)C2	ZINC001111848757	1368502589	/nfs/dbraw/zinc/50/25/89/1368502589.db2.gz	RYRPCICPQWSAFI-PBEJRMEISA-N	0	3	341.499	3.463	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H](CCC)c2ccccn2)C1	ZINC001111853340	1368506165	/nfs/dbraw/zinc/50/61/65/1368506165.db2.gz	ULBLKONSKGAXIZ-ZWOKBUDYSA-N	0	3	327.472	3.122	20	30		EGEDHN
C#CCN1C[C@@H]2CCC[C@]2(NC(=O)C[C@H](C)c2ccc(CC)cc2)C1	ZINC001111869656	1368516958	/nfs/dbraw/zinc/51/69/58/1368516958.db2.gz	CSNHEEDBHSFLGQ-XJABCFGWSA-N	0	3	338.495	3.347	20	30		EGEDHN
C#CCC1(C(=O)N2CCCN(CC/C=C\CCC)CC2)CCOCC1	ZINC001196107212	1368549322	/nfs/dbraw/zinc/54/93/22/1368549322.db2.gz	KBTSMQKPAFOGQH-SREVYHEPSA-N	0	3	346.515	3.087	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cnc(Cl)n2C)CC1	ZINC001196499814	1368627618	/nfs/dbraw/zinc/62/76/18/1368627618.db2.gz	FLODRNDGETZJLV-UHFFFAOYSA-N	0	3	340.899	3.192	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2occ3c2CCOC3)CC1	ZINC001196649361	1368655423	/nfs/dbraw/zinc/65/54/23/1368655423.db2.gz	SNRAMYMFXWEYOQ-UHFFFAOYSA-N	0	3	346.471	3.247	20	30		EGEDHN
C=CCCCC(=O)N1CCCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC001197000071	1368729101	/nfs/dbraw/zinc/72/91/01/1368729101.db2.gz	JHQRKSIUESAGAN-FQEVSTJZSA-N	0	3	344.499	3.135	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2nnn(C(C)C)c2C)CC1	ZINC001197606061	1368853062	/nfs/dbraw/zinc/85/30/62/1368853062.db2.gz	MGSVQCZMQTWUOP-UHFFFAOYSA-N	0	3	349.523	3.286	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@@H]2CCC[C@]2(CNCc2nccs2)C1	ZINC001112515521	1368909799	/nfs/dbraw/zinc/90/97/99/1368909799.db2.gz	OEGPDFIEAUVQPG-GJYPPUQNSA-N	0	3	347.528	3.464	20	30		EGEDHN
CCCCCCCCC(=O)N[C@@H]1CN(CCCCCC)C[C@H]1O	ZINC001198087666	1368957703	/nfs/dbraw/zinc/95/77/03/1368957703.db2.gz	ILLQBTGWCNSQGB-QZTJIDSGSA-N	0	3	326.525	3.479	20	30		EGEDHN
C=C[C@H](CC(=O)N1CCCN(C[C@@H](CC)OC)CC1)c1ccccc1	ZINC001198214576	1368982186	/nfs/dbraw/zinc/98/21/86/1368982186.db2.gz	QXYMWPMGSGLFCR-UYAOXDASSA-N	0	3	344.499	3.306	20	30		EGEDHN
C=CCCOCC(=O)N1CCCN([C@@H](CC)c2ccccc2)CC1	ZINC001198336376	1369010846	/nfs/dbraw/zinc/01/08/46/1369010846.db2.gz	AWSZUKVTZBJESX-IBGZPJMESA-N	0	3	330.472	3.265	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N1CCCN([C@H](C)c2cc(C)ccc2C)CC1	ZINC001198344201	1369012722	/nfs/dbraw/zinc/01/27/22/1369012722.db2.gz	RDFJUVBVETZANR-MOPGFXCFSA-N	0	3	344.499	3.490	20	30		EGEDHN
C=CCC[C@H](C)N[C@H](CNC(=O)C(F)F)c1ccccc1OC	ZINC001198472319	1369039956	/nfs/dbraw/zinc/03/99/56/1369039956.db2.gz	OYKYNKKOQOAKPM-GXTWGEPZSA-N	0	3	326.387	3.062	20	30		EGEDHN
C[C@@H](NCc1cc(=O)n2ncc(C#N)c2[nH]1)c1csc2ccccc21	ZINC001198516832	1369051025	/nfs/dbraw/zinc/05/10/25/1369051025.db2.gz	DMDMASDGKVTHFJ-LLVKDONJSA-N	0	3	349.419	3.372	20	30		EGEDHN
C=CCCC(=O)NC[C@@H](NCCCOC(C)C)c1ccccc1OC	ZINC001198594900	1369068641	/nfs/dbraw/zinc/06/86/41/1369068641.db2.gz	FCGCCMWKBRJQLN-GOSISDBHSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCC(=O)NC[C@H](NCC1CC(C)C1)c1ccccc1OC	ZINC001198597500	1369070113	/nfs/dbraw/zinc/07/01/13/1369070113.db2.gz	ZORIBFGBFFXKRI-HTWSVDAQSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)c1ccn(C)c1)c1ccccc1OC	ZINC001198655350	1369083034	/nfs/dbraw/zinc/08/30/34/1369083034.db2.gz	CNRXIWFCJIZRPK-GOSISDBHSA-N	0	3	341.455	3.061	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)c1cc(C)sn1)c1ccccc1OC	ZINC001198694027	1369092971	/nfs/dbraw/zinc/09/29/71/1369092971.db2.gz	FHQLVOMHTOMGNW-MRXNPFEDSA-N	0	3	345.468	3.097	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)c1[nH]ccc1C)c1ccccc1OC	ZINC001198706917	1369096058	/nfs/dbraw/zinc/09/60/58/1369096058.db2.gz	ZHCVRXUVBTWSKX-QGZVFWFLSA-N	0	3	341.455	3.359	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)c2cc3ccccc3c(=O)[nH]2)CC1	ZINC001112967260	1369114415	/nfs/dbraw/zinc/11/44/15/1369114415.db2.gz	GQOILJCGGLIUKD-OAHLLOKOSA-N	0	3	339.439	3.053	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)[C@@H](CCC)OC)c1ccccc1OC	ZINC001198827019	1369122329	/nfs/dbraw/zinc/12/23/29/1369122329.db2.gz	PBLGAGXHBJIKPW-IEBWSBKVSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@@H](NCCCOC)c1ccccc1OC	ZINC001198885116	1369139364	/nfs/dbraw/zinc/13/93/64/1369139364.db2.gz	AWUUJKALKDCEER-YLJYHZDGSA-N	0	3	348.487	3.081	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)c2ccc(C3CC3)cc2)C1	ZINC001198904889	1369145151	/nfs/dbraw/zinc/14/51/51/1369145151.db2.gz	QCQFEHDKUPOEOA-WOJBJXKFSA-N	0	3	344.499	3.309	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)C[C@H](C)c2c(C)n[nH]c2C)CC1	ZINC001113032982	1369153316	/nfs/dbraw/zinc/15/33/16/1369153316.db2.gz	TVLWGAZRSRQWBH-GJZGRUSLSA-N	0	3	332.492	3.019	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)C2(C)CCC(C)CC2)C1	ZINC001199227151	1369194540	/nfs/dbraw/zinc/19/45/40/1369194540.db2.gz	RQUHQCJILHKPDH-SFANZJOMSA-N	0	3	338.536	3.335	20	30		EGEDHN
C=CCNC(=S)N([C@H](C)c1ccccc1)[C@@H]1CN2CCC1CC2	ZINC001200292454	1369342548	/nfs/dbraw/zinc/34/25/48/1369342548.db2.gz	GYMHEWYTBLMGQI-CRAIPNDOSA-N	0	3	329.513	3.204	20	30		EGEDHN
C#CCC1(C(=O)N2CCC(NCc3c(F)cccc3F)CC2)CCC1	ZINC001201002612	1369465359	/nfs/dbraw/zinc/46/53/59/1369465359.db2.gz	RRZFOYNVMLHNDH-UHFFFAOYSA-N	0	3	346.421	3.239	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)[C@H](c2ccccc2)N(C)CC)CC1	ZINC001113529057	1369479811	/nfs/dbraw/zinc/47/98/11/1369479811.db2.gz	BUOXKCLCXVFFOA-ICSRJNTNSA-N	0	3	343.515	3.178	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCCO[C@H](CNCc2ccsc2)C1	ZINC001201233179	1369501525	/nfs/dbraw/zinc/50/15/25/1369501525.db2.gz	LZUQMOLHBNFUND-DOTOQJQBSA-N	0	3	336.501	3.058	20	30		EGEDHN
CCCCCCCCN1CC[C@@]2(CC(C(=O)N(C)C(C)C)=NO2)C1	ZINC001201815170	1369628334	/nfs/dbraw/zinc/62/83/34/1369628334.db2.gz	YGONFMBZALRJEB-LJQANCHMSA-N	0	3	337.508	3.435	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC(NCc2ccncc2Cl)CC1	ZINC001201997648	1369662724	/nfs/dbraw/zinc/66/27/24/1369662724.db2.gz	FTJSESISKBLNPZ-UHFFFAOYSA-N	0	3	347.890	3.399	20	30		EGEDHN
C#CCNC[C@H]1CN(C(=O)[C@@](C)(CC)CCCCCC)CCCO1	ZINC001202107996	1369688379	/nfs/dbraw/zinc/68/83/79/1369688379.db2.gz	DOBVDTYGXGLQBQ-ICSRJNTNSA-N	0	3	336.520	3.213	20	30		EGEDHN
C=CCC1(C(=O)N2CCCO[C@@H](CNC[C@H](F)CC)C2)CCCC1	ZINC001202243629	1369721932	/nfs/dbraw/zinc/72/19/32/1369721932.db2.gz	OSTKBVVQWGSKEB-SJORKVTESA-N	0	3	340.483	3.078	20	30		EGEDHN
CC(C)=CC(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C12CCC2	ZINC001202384015	1369756499	/nfs/dbraw/zinc/75/64/99/1369756499.db2.gz	PPQOTWNNVTZZFV-MSOLQXFVSA-N	0	3	341.430	3.181	20	30		EGEDHN
Cc1occc1C(=O)N[C@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202383971	1369756762	/nfs/dbraw/zinc/75/67/62/1369756762.db2.gz	ONDYTGBNUUKWDV-PMACEKPBSA-N	0	3	348.446	3.270	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1[C@H]2CN(CCc3ccccc3Cl)C[C@H]21	ZINC001114161833	1369770048	/nfs/dbraw/zinc/77/00/48/1369770048.db2.gz	NBGPSPPULPUVMI-YRWFTTLQSA-N	0	3	344.886	3.123	20	30		EGEDHN
CCC(CC)C(=O)N[C@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202522946	1369798683	/nfs/dbraw/zinc/79/86/83/1369798683.db2.gz	RLAXPCPVYKCKAV-UXHICEINSA-N	0	3	338.495	3.491	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@@H](NCc2cccc(F)c2F)C12CCC2	ZINC001202597731	1369818622	/nfs/dbraw/zinc/81/86/22/1369818622.db2.gz	ATYRPTNIVQZUAK-HZPDHXFCSA-N	0	3	334.410	3.448	20	30		EGEDHN
O=C(C#CC1CC1)N[C@@H]1[C@H]2CN(Cc3ccc(C4CCCC4)cc3)C[C@H]21	ZINC001114255226	1369831137	/nfs/dbraw/zinc/83/11/37/1369831137.db2.gz	DYUAOPVMDFORBQ-SGRGSNTQSA-N	0	3	348.490	3.304	20	30		EGEDHN
O=C(CC1CCC1)N[C@@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202696381	1369855096	/nfs/dbraw/zinc/85/50/96/1369855096.db2.gz	YZSCEFMMUHKGLV-WOJBJXKFSA-N	0	3	336.479	3.245	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1C[C@H](NCc2conc2CC)C12CCC2	ZINC001202959352	1369936590	/nfs/dbraw/zinc/93/65/90/1369936590.db2.gz	CLLANLUNPWUMKT-IRXDYDNUSA-N	0	3	345.487	3.356	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1C[C@H](NCc2conc2C)C12CCC2	ZINC001202959900	1369937146	/nfs/dbraw/zinc/93/71/46/1369937146.db2.gz	IAVWKQBBGIIZRT-JKSUJKDBSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1C[C@@H](NCc2ccccn2)C12CCC2	ZINC001202961409	1369938004	/nfs/dbraw/zinc/93/80/04/1369938004.db2.gz	XIWUAAHGAMDWRN-SJORKVTESA-N	0	3	327.472	3.201	20	30		EGEDHN
C=C(Br)CNC1CCN(C(=O)[C@@H](C)[C@H](C)CC)CC1	ZINC001203092037	1369979982	/nfs/dbraw/zinc/97/99/82/1369979982.db2.gz	IMQCGQPDTBXEIC-YPMHNXCESA-N	0	3	331.298	3.158	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1[nH]c(CC)nc1C)[C@H]2CC	ZINC001203236281	1370034145	/nfs/dbraw/zinc/03/41/45/1370034145.db2.gz	IAAUELJTDCFSTQ-PXNSSMCTSA-N	0	3	344.503	3.202	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1C[C@@H](NCc2ccccn2)C12CCC2	ZINC001203259980	1370047337	/nfs/dbraw/zinc/04/73/37/1370047337.db2.gz	ZMDFSTRQPUQERC-SJORKVTESA-N	0	3	327.472	3.201	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1[C@H]2CN(CCCCC(F)(F)F)C[C@H]21	ZINC001114727378	1370049617	/nfs/dbraw/zinc/04/96/17/1370049617.db2.gz	VHANFSAKVUMCLG-TTZDDIAXSA-N	0	3	332.410	3.368	20	30		EGEDHN
Cc1cocc1C(=O)N[C@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001203266897	1370050559	/nfs/dbraw/zinc/05/05/59/1370050559.db2.gz	WRAJBCONWOUVJQ-UXHICEINSA-N	0	3	348.446	3.270	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)CCCC(F)(F)F)C12CCC2	ZINC001203428627	1370122334	/nfs/dbraw/zinc/12/23/34/1370122334.db2.gz	ZEWAUVADTFETIZ-NWDGAFQWSA-N	0	3	338.801	3.489	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1C[C@H](NCc2cncs2)C12CCC2	ZINC001203450892	1370131440	/nfs/dbraw/zinc/13/14/40/1370131440.db2.gz	GGMLJJRMUFSSLQ-GJZGRUSLSA-N	0	3	333.501	3.262	20	30		EGEDHN
COc1ccc(C[N@@H+]2CCC[C@H](Oc3cccc(C#N)c3)C2)c([O-])c1	ZINC001203629118	1370193189	/nfs/dbraw/zinc/19/31/89/1370193189.db2.gz	REDNYMVZLFWBBA-IBGZPJMESA-N	0	3	338.407	3.316	20	30		EGEDHN
COc1ccc(C[N@H+]2CCC[C@H](Oc3cccc(C#N)c3)C2)c([O-])c1	ZINC001203629118	1370193190	/nfs/dbraw/zinc/19/31/90/1370193190.db2.gz	REDNYMVZLFWBBA-IBGZPJMESA-N	0	3	338.407	3.316	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)COc2ccccc2C)C12CCC2	ZINC001203679249	1370214403	/nfs/dbraw/zinc/21/44/03/1370214403.db2.gz	TXTBDODWGTUIQU-DLBZAZTESA-N	0	3	348.874	3.143	20	30		EGEDHN
CC(C)COC[C@H]1CC[C@@H]2[C@@H](CCN2Cc2cccc(C#N)c2)O1	ZINC001203762017	1370253916	/nfs/dbraw/zinc/25/39/16/1370253916.db2.gz	JSLDFUKEFLNQMI-VAMGGRTRSA-N	0	3	328.456	3.353	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC001203762638	1370254536	/nfs/dbraw/zinc/25/45/36/1370254536.db2.gz	MPPXGNQMXIMMEG-QGZVFWFLSA-N	0	3	329.444	3.437	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@]3(CC(=O)N(c4ccsc4)C3)C2)c1	ZINC001203762187	1370254769	/nfs/dbraw/zinc/25/47/69/1370254769.db2.gz	MWBFYDBGRAUGJT-IBGZPJMESA-N	0	3	337.448	3.249	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)C[C@H]1CN(Cc2ccccc2)CCO1	ZINC001203763553	1370255622	/nfs/dbraw/zinc/25/56/22/1370255622.db2.gz	BVFUPJPMPPALOG-QFIPXVFZSA-N	0	3	349.478	3.281	20	30		EGEDHN
CC[C@@H](CC(C)C)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001115090915	1370271975	/nfs/dbraw/zinc/27/19/75/1370271975.db2.gz	FYRHRKNQSLPZNM-VNTMZGSJSA-N	0	3	339.483	3.177	20	30		EGEDHN
N#Cc1ccc(CN2CCc3ncnc(-c4ccoc4)c3CC2)cc1	ZINC001203901110	1370306532	/nfs/dbraw/zinc/30/65/32/1370306532.db2.gz	GCMDXLLCBXWTHQ-UHFFFAOYSA-N	0	3	330.391	3.209	20	30		EGEDHN
Cc1ccc(N2C[C@@]3(CCN(Cc4ccc(C#N)cc4)C3)CC2=O)cc1	ZINC001203903938	1370308654	/nfs/dbraw/zinc/30/86/54/1370308654.db2.gz	NMOQPWPAHUFDKA-QFIPXVFZSA-N	0	3	345.446	3.496	20	30		EGEDHN
CC(C)(F)C(=O)NCC1(NCc2cc(C#N)ccc2F)CCCCC1	ZINC001115380240	1370418978	/nfs/dbraw/zinc/41/89/78/1370418978.db2.gz	RUSCKNDZZUJGOA-UHFFFAOYSA-N	0	3	349.425	3.354	20	30		EGEDHN
C=CCOc1ccc(CN2C[C@@H]3[C@H](NC(=O)OC(C)(C)C)[C@@H]3C2)cc1	ZINC001204297818	1370434902	/nfs/dbraw/zinc/43/49/02/1370434902.db2.gz	SUQIKFWPLHUKFR-BCDXTJNWSA-N	0	3	344.455	3.206	20	30		EGEDHN
C=CCOc1ccc(CN2CCC(NC(=O)C(C)(C)C)CC2)cc1	ZINC001204302106	1370437426	/nfs/dbraw/zinc/43/74/26/1370437426.db2.gz	BQAGFKLKIWSGAK-UHFFFAOYSA-N	0	3	330.472	3.378	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)[C@H](C)C2CC2)CCCCC1	ZINC001115466186	1370472352	/nfs/dbraw/zinc/47/23/52/1370472352.db2.gz	FLDFUDVXDSWHOZ-CYBMUJFWSA-N	0	3	343.309	3.350	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CC[C@H]2CN(Cc3cccc(C)c3)C[C@H]21	ZINC001187216781	1388074308	/nfs/dbraw/zinc/07/43/08/1388074308.db2.gz	GQANPTINPXZABD-YZGWKJHDSA-N	0	3	342.483	3.009	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)/C(C)=C\C)CCCCC1	ZINC001115473210	1370479440	/nfs/dbraw/zinc/47/94/40/1370479440.db2.gz	QXLZIGCLEZAJJJ-QCDXTXTGSA-N	0	3	329.282	3.270	20	30		EGEDHN
C=CCN1C(=O)CCC[C@]12CCCN(Cc1ccc3c(c1)CCO3)C2	ZINC001204489148	1370490265	/nfs/dbraw/zinc/49/02/65/1370490265.db2.gz	HMMJIGQFFCFRDV-OAQYLSRUSA-N	0	3	340.467	3.155	20	30		EGEDHN
CC(=O)c1ccc(Nc2cccc(CN3CCN(C)CC3)c2)c(C#N)c1	ZINC001204574997	1370521586	/nfs/dbraw/zinc/52/15/86/1370521586.db2.gz	VDMWITUAEPWENI-UHFFFAOYSA-N	0	3	348.450	3.252	20	30		EGEDHN
Cc1cc(CNC2(CNC(=O)C#CC(C)C)CCCCC2)sn1	ZINC001115522370	1370521712	/nfs/dbraw/zinc/52/17/12/1370521712.db2.gz	OLCGBPBMEQLUNA-UHFFFAOYSA-N	0	3	333.501	3.020	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H]2CN(Cc3ccc(C)c(OC)c3)C[C@H]21	ZINC001187240710	1388079326	/nfs/dbraw/zinc/07/93/26/1388079326.db2.gz	YCJQSMNESMKJFK-ZWKOTPCHSA-N	0	3	328.456	3.003	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1CCC(CNCc2ccccc2C#N)CC1	ZINC001204828033	1370585504	/nfs/dbraw/zinc/58/55/04/1370585504.db2.gz	SWZXKDRPEQZZAY-MRXNPFEDSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cc(C3CC3)on2)CCCCC1	ZINC001115653558	1370640324	/nfs/dbraw/zinc/64/03/24/1370640324.db2.gz	IYBQBFGPXIACEA-UHFFFAOYSA-N	0	3	337.851	3.327	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC1(NCc2nccnc2C)CCCCC1	ZINC001115663660	1370646549	/nfs/dbraw/zinc/64/65/49/1370646549.db2.gz	VXGOYHYZKJBWOG-UHFFFAOYSA-N	0	3	344.503	3.296	20	30		EGEDHN
C=CC(C)(C)C(=O)NCC1(NCc2ccc(F)cn2)CCCCC1	ZINC001115667140	1370649223	/nfs/dbraw/zinc/64/92/23/1370649223.db2.gz	XGHZACVEZKGMBX-UHFFFAOYSA-N	0	3	333.451	3.342	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCC1(NCc2cc(C)ncn2)CCCCC1	ZINC001115679888	1370662889	/nfs/dbraw/zinc/66/28/89/1370662889.db2.gz	RBINYYIJJJYIIR-DOTOQJQBSA-N	0	3	344.503	3.152	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCC1(NCc2cnoc2C)CCCCC1	ZINC001115680228	1370663417	/nfs/dbraw/zinc/66/34/17/1370663417.db2.gz	WBMNRRAUUKMWOZ-LSDHHAIUSA-N	0	3	333.476	3.350	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)Cc2ccc(CC)cn2)CCCCC1	ZINC001115738800	1370720511	/nfs/dbraw/zinc/72/05/11/1370720511.db2.gz	CMWYANUCMCSJEP-UHFFFAOYSA-N	0	3	349.906	3.348	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)CC(C)(C)C)C[C@H]1c1cccc(F)c1	ZINC001205360984	1370731644	/nfs/dbraw/zinc/73/16/44/1370731644.db2.gz	LGOKLVXDCOKDRY-ZWKOTPCHSA-N	0	3	330.447	3.169	20	30		EGEDHN
CC[C@@H](F)CN[C@@H]1CN(C(=O)C#CC(C)C)C[C@H]1c1cccc(F)c1	ZINC001205407878	1370747114	/nfs/dbraw/zinc/74/71/14/1370747114.db2.gz	JGTCWPHMQLVGGG-NZSAHSFTSA-N	0	3	348.437	3.117	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C(C)(C)C2CC2)C[C@H]1c1cccc(F)c1	ZINC001205426677	1370751756	/nfs/dbraw/zinc/75/17/56/1370751756.db2.gz	MDKRCEVKUIYMPM-RBUKOAKNSA-N	0	3	342.458	3.169	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)CCCC(C)C)C[C@H]1c1cccc(F)c1	ZINC001205439991	1370755944	/nfs/dbraw/zinc/75/59/44/1370755944.db2.gz	UUBXVWPGCVICKR-RBUKOAKNSA-N	0	3	330.447	3.169	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C[C@@H](CC)C(C)C)C[C@H]1c1cccc(F)c1	ZINC001205452417	1370759847	/nfs/dbraw/zinc/75/98/47/1370759847.db2.gz	FKCQOEJNEDAOTP-LSTHTHJFSA-N	0	3	344.474	3.415	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1ccc(F)c(C#N)c1)CC2	ZINC001205472740	1370765859	/nfs/dbraw/zinc/76/58/59/1370765859.db2.gz	HWCRSKNMUZSVRT-FQEVSTJZSA-N	0	3	341.430	3.230	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC(CNCc2ccccc2C#N)CC1	ZINC001205989508	1370931494	/nfs/dbraw/zinc/93/14/94/1370931494.db2.gz	VWVPDBCJTIHRSZ-KRWDZBQOSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC(CNCc2cc(C3CC3)no2)CC1	ZINC001205998254	1370933990	/nfs/dbraw/zinc/93/39/90/1370933990.db2.gz	MDLRJBIMWCVJSI-HNNXBMFYSA-N	0	3	345.487	3.483	20	30		EGEDHN
C=C(CN1CCCC1)c1nc(-c2ncccc2Br)no1	ZINC001206101008	1370960465	/nfs/dbraw/zinc/96/04/65/1370960465.db2.gz	YXOUUZDOZAJRMQ-UHFFFAOYSA-N	0	3	335.205	3.003	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC(CNC/C(Cl)=C/Cl)CC2)C1	ZINC001206213585	1370995560	/nfs/dbraw/zinc/99/55/60/1370995560.db2.gz	XUHVWUODFYPXDI-ZROIWOOFSA-N	0	3	331.287	3.490	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CN([C@@H]2CCc3c2cccc3F)C[C@H]1C	ZINC001206886969	1371207748	/nfs/dbraw/zinc/20/77/48/1371207748.db2.gz	PGCHNEAJHOGEBQ-CDHQVMDDSA-N	0	3	342.458	3.443	20	30		EGEDHN
C[C@@H]1CN(CCOC2CCCCCC2)C[C@H]1NC(=O)C#CC(C)(C)C	ZINC001206949534	1371240818	/nfs/dbraw/zinc/24/08/18/1371240818.db2.gz	HEQDRVZMKVPNLF-IEBWSBKVSA-N	0	3	348.531	3.212	20	30		EGEDHN
CN(Cc1ccccc1F)C1CCN(Cc2cc(C#N)n(C)c2)CC1	ZINC001207110430	1371296608	/nfs/dbraw/zinc/29/66/08/1371296608.db2.gz	LVOXCOJIKPPEST-UHFFFAOYSA-N	0	3	340.446	3.132	20	30		EGEDHN
CN(Cc1cc(C#N)n(C)c1)[C@H]1CCCC[C@H]1NC(=O)OC(C)(C)C	ZINC001207110192	1371297153	/nfs/dbraw/zinc/29/71/53/1371297153.db2.gz	GHHSSAGWSYBLPY-SJORKVTESA-N	0	3	346.475	3.164	20	30		EGEDHN
C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)[C@@H]1CCCN(C)C1	ZINC001119776012	1371403748	/nfs/dbraw/zinc/40/37/48/1371403748.db2.gz	FNAWMQNNDKULAY-LSDHHAIUSA-N	0	3	346.500	3.496	20	30		EGEDHN
C[C@H](C#N)CSc1ccccc1NC(=O)N(C)[C@H]1CCCN(C)C1	ZINC001119776009	1371403940	/nfs/dbraw/zinc/40/39/40/1371403940.db2.gz	FNAWMQNNDKULAY-CABCVRRESA-N	0	3	346.500	3.496	20	30		EGEDHN
CC/C=C(\C)C(=O)N1CCC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001207567371	1371438241	/nfs/dbraw/zinc/43/82/41/1371438241.db2.gz	ZHIVFNYCFQVGEC-DRESWSQNSA-N	0	3	329.419	3.134	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CC[C@H]2CC[C@H](C)O2)CCCCC1	ZINC001120176320	1371500300	/nfs/dbraw/zinc/50/03/00/1371500300.db2.gz	KHYHUDQTHSRFOC-JKSUJKDBSA-N	0	3	342.911	3.495	20	30		EGEDHN
O=C(C=C1CCC1)N1CCC[C@@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207785943	1371503071	/nfs/dbraw/zinc/50/30/71/1371503071.db2.gz	MUMBHVRQIDYMAM-LJQANCHMSA-N	0	3	342.870	3.382	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)CCSC)C1	ZINC001120320379	1371532581	/nfs/dbraw/zinc/53/25/81/1371532581.db2.gz	OCAKBKPNKCFDGS-GJZGRUSLSA-N	0	3	330.925	3.195	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)COC(C)(C)C)C1	ZINC001120362372	1371547769	/nfs/dbraw/zinc/54/77/69/1371547769.db2.gz	FHJICTXMGLMANP-JKSUJKDBSA-N	0	3	342.911	3.257	20	30		EGEDHN
CC/C(C)=C\C(=O)N1CCC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001208002204	1371563986	/nfs/dbraw/zinc/56/39/86/1371563986.db2.gz	PUVRAELGJPDWBD-DZXKJOIRSA-N	0	3	329.419	3.134	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CCC[C@@H](NCc2ccc(F)c(F)c2)C1	ZINC001208011091	1371567320	/nfs/dbraw/zinc/56/73/20/1371567320.db2.gz	VISUZHJVCUNOOU-OAHLLOKOSA-N	0	3	334.410	3.095	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)c2cc(C)ccc2C2CC2)C1	ZINC001208059018	1371582791	/nfs/dbraw/zinc/58/27/91/1371582791.db2.gz	NTYLTYSWXOYAEX-OXQOHEQNSA-N	0	3	342.483	3.125	20	30		EGEDHN
CCCC(=O)NC1CC2(CC(NCc3cc(F)ccc3C#N)C2)C1	ZINC001120529598	1371600655	/nfs/dbraw/zinc/60/06/55/1371600655.db2.gz	JZVMHZZXSOMOLI-UHFFFAOYSA-N	0	3	329.419	3.014	20	30		EGEDHN
C=CCOCc1nn(CC2CC2)c2c1CN(CC[C@H](C)SC)CC2	ZINC001208141810	1371608266	/nfs/dbraw/zinc/60/82/66/1371608266.db2.gz	LFXQBWFEBNGHDB-HNNXBMFYSA-N	0	3	349.544	3.495	20	30		EGEDHN
C=C(C)[C@@H]1CC=C(CN2CCc3ncc(C(=O)OCC)n3CC2)CC1	ZINC001208178613	1371619051	/nfs/dbraw/zinc/61/90/51/1371619051.db2.gz	TXQSCUAHNCZZBN-QGZVFWFLSA-N	0	3	343.471	3.221	20	30		EGEDHN
C=C(Br)CNC1CC2(C1)CC(NC(=O)CCCC)C2	ZINC001120639614	1371675121	/nfs/dbraw/zinc/67/51/21/1371675121.db2.gz	ITNHNHMJDBERON-UHFFFAOYSA-N	0	3	329.282	3.102	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CN(Cc2ccc(COC)cc2)C[C@H]1C	ZINC001208294659	1371704419	/nfs/dbraw/zinc/70/44/19/1371704419.db2.gz	MFNJOAJGWQZRON-VQIMIIECSA-N	0	3	344.499	3.372	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CN(CCCCC(F)(F)F)C[C@H]1C	ZINC001208374209	1371741193	/nfs/dbraw/zinc/74/11/93/1371741193.db2.gz	DNOINGZOEFNSQG-HUUCEWRRSA-N	0	3	332.410	3.349	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CN(Cc2ccc(COC)cc2)C[C@H]1C	ZINC001208388921	1371748135	/nfs/dbraw/zinc/74/81/35/1371748135.db2.gz	SPHAPJPROZJAJK-SQGPQFPESA-N	0	3	344.499	3.372	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CN(CCOCc2ccccc2)C[C@H]1C	ZINC001208391011	1371749565	/nfs/dbraw/zinc/74/95/65/1371749565.db2.gz	HXJNCACTAXKXDH-NLWGTHIKSA-N	0	3	344.499	3.242	20	30		EGEDHN
C=C(Br)CNC1CC2(C1)CC(NC(=O)CCC1CC1)C2	ZINC001120869375	1371789448	/nfs/dbraw/zinc/78/94/48/1371789448.db2.gz	ITIUYHVQKJNDJS-UHFFFAOYSA-N	0	3	341.293	3.102	20	30		EGEDHN
N#Cc1cccc(CCCN2CCC[C@@H](C(F)(F)F)[C@H]2CO)c1	ZINC001208843934	1371915468	/nfs/dbraw/zinc/91/54/68/1371915468.db2.gz	BRQBHJHONBAVNI-HZPDHXFCSA-N	0	3	326.362	3.126	20	30		EGEDHN
N#Cc1cccc(CCCN2CCN(c3nccc4occc43)CC2)c1	ZINC001208853103	1371918263	/nfs/dbraw/zinc/91/82/63/1371918263.db2.gz	CVMOOEUFRQXCNO-UHFFFAOYSA-N	0	3	346.434	3.454	20	30		EGEDHN
COc1cccc(CN2CCN(CCCc3ccc(C#N)cc3)CC2)c1	ZINC001208862294	1371922677	/nfs/dbraw/zinc/92/26/77/1371922677.db2.gz	HDXYKOMWQGXQIL-UHFFFAOYSA-N	0	3	349.478	3.317	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)COC1CCCCC1)C2	ZINC001121341125	1371942618	/nfs/dbraw/zinc/94/26/18/1371942618.db2.gz	RZMANWWRZPERGT-UHFFFAOYSA-N	0	3	340.895	3.105	20	30		EGEDHN
N#Cc1ccc(CCN2CCc3c(cnn3-c3ccccc3)C2)cc1	ZINC001208926178	1371947059	/nfs/dbraw/zinc/94/70/59/1371947059.db2.gz	IEHNWSYUMXMHDL-UHFFFAOYSA-N	0	3	328.419	3.345	20	30		EGEDHN
CC1(C(=O)N2CCC[C@@H](NCC#Cc3cccc(Cl)c3)C2)CCC1	ZINC001209005318	1371973085	/nfs/dbraw/zinc/97/30/85/1371973085.db2.gz	UZUCADUGBOYXDI-GOSISDBHSA-N	0	3	344.886	3.462	20	30		EGEDHN
C=CCN(CCN1CCC(c2ccc(C#N)cc2)CC1)C(=O)OCC	ZINC001209021346	1371976787	/nfs/dbraw/zinc/97/67/87/1371976787.db2.gz	YLNFOMJKRKXDBD-UHFFFAOYSA-N	0	3	341.455	3.382	20	30		EGEDHN
CC(C)=C(C)CC(=O)N1CCC[C@H](NCc2ccc(C#N)s2)C1	ZINC001209030122	1371978232	/nfs/dbraw/zinc/97/82/32/1371978232.db2.gz	MSQKDXWTTUJOHF-HNNXBMFYSA-N	0	3	331.485	3.447	20	30		EGEDHN
C=CCN1C(=O)CCC12CCN(CCc1cc(F)cc(F)c1)CC2	ZINC001209130286	1372007984	/nfs/dbraw/zinc/00/79/84/1372007984.db2.gz	KGZDCGQVNOEGHO-UHFFFAOYSA-N	0	3	334.410	3.150	20	30		EGEDHN
CC#CCCCC(=O)NC1CC2(CC(NCc3oc(C)nc3C)C2)C1	ZINC001121587487	1372017368	/nfs/dbraw/zinc/01/73/68/1372017368.db2.gz	AJDMRZWACRLRKO-UHFFFAOYSA-N	0	3	343.471	3.002	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC1CC2(CC(NCc3ccn(CC)n3)C2)C1	ZINC001121616994	1372026917	/nfs/dbraw/zinc/02/69/17/1372026917.db2.gz	ROSOVJOQHODCHU-WIOLVWRCSA-N	0	3	344.503	3.022	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC[C@H](NCc2cc(CO)ccc2F)C1	ZINC001209183786	1372028841	/nfs/dbraw/zinc/02/88/41/1372028841.db2.gz	PVNIRQRHIGGAAC-QAPCUYQASA-N	0	3	348.462	3.001	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC[C@@H](NCc2cnn(C(C)(C)C)c2)C1	ZINC001209185757	1372030527	/nfs/dbraw/zinc/03/05/27/1372030527.db2.gz	XJBBEQHIIVVKAF-SJLPKXTDSA-N	0	3	346.519	3.321	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC[C@H](NCc2ccc(C#N)s2)C1	ZINC001209192927	1372033456	/nfs/dbraw/zinc/03/34/56/1372033456.db2.gz	DTYFQPZDZHMAJW-CABCVRRESA-N	0	3	331.485	3.303	20	30		EGEDHN
C=CCCCCN1CCO[C@@H]2[C@@H](COCc3nccs3)CC[C@@H]21	ZINC001209204130	1372037306	/nfs/dbraw/zinc/03/73/06/1372037306.db2.gz	ZOPPXBXGTGWVML-SOLBZPMBSA-N	0	3	336.501	3.495	20	30		EGEDHN
C=CCCCC(=O)NC1CC2(CC(NCc3oc(CC)nc3C)C2)C1	ZINC001121666849	1372039996	/nfs/dbraw/zinc/03/99/96/1372039996.db2.gz	AKRQEHJKPXKTSB-UHFFFAOYSA-N	0	3	345.487	3.419	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)NC1CC2(CC(NCc3ccccc3C#N)C2)C1	ZINC001121860768	1372106038	/nfs/dbraw/zinc/10/60/38/1372106038.db2.gz	ORBUCVMBBYDVNW-FMXIARGQSA-N	0	3	339.483	3.367	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001209456358	1372110942	/nfs/dbraw/zinc/11/09/42/1372110942.db2.gz	ZWORHNGVGLYDDH-FPOVZHCZSA-N	0	3	342.458	3.360	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N1CCc2cc(Br)ccc2C1	ZINC001121962650	1372135578	/nfs/dbraw/zinc/13/55/78/1372135578.db2.gz	BLVPEDMWNJFIDB-OAHLLOKOSA-N	0	3	337.261	3.017	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)NCc1ccc(Oc2cccnc2)c(F)c1	ZINC001121988130	1372146722	/nfs/dbraw/zinc/14/67/22/1372146722.db2.gz	JEDSFJHOUJNGQQ-KRWDZBQOSA-N	0	3	343.402	3.313	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)c2cccc(C3CCC3)c2)C1	ZINC001210283114	1372314294	/nfs/dbraw/zinc/31/42/94/1372314294.db2.gz	GFFSYGVJBJYYDH-OXQOHEQNSA-N	0	3	342.483	3.207	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)C[C@@H](C)Cc3cccc(F)c3)[C@@H]2C1	ZINC001187930538	1388192713	/nfs/dbraw/zinc/19/27/13/1388192713.db2.gz	VNHBWRIFVKXBPY-VDZJLULYSA-N	0	3	330.447	3.113	20	30		EGEDHN
CC(C)C[C@@H](C)C(=O)N1CCC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001210358882	1372331704	/nfs/dbraw/zinc/33/17/04/1372331704.db2.gz	QISCAOBNXNPUNO-CRAIPNDOSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC(C)C[C@@H](C)C(=O)N1CCC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001210358750	1372332331	/nfs/dbraw/zinc/33/23/31/1372332331.db2.gz	NXIVEKXRQBSNBX-QAPCUYQASA-N	0	3	345.462	3.460	20	30		EGEDHN
CC(C)(C)C(=O)N1CCC[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001210788392	1372426751	/nfs/dbraw/zinc/42/67/51/1372426751.db2.gz	CPGNTDRPRGHMKW-KRWDZBQOSA-N	0	3	332.875	3.318	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)Cc1ccc(C)c(Br)c1	ZINC001123337714	1372431415	/nfs/dbraw/zinc/43/14/15/1372431415.db2.gz	TUTQMEDFWUDUDV-CYBMUJFWSA-N	0	3	346.228	3.393	20	30		EGEDHN
C#CCCN1C[C@@H](C)[C@H](NC(=O)C(CC)(CC)c2ccccc2)C1	ZINC001211223632	1372506648	/nfs/dbraw/zinc/50/66/48/1372506648.db2.gz	AAAOFBULSLJDDL-IEBWSBKVSA-N	0	3	326.484	3.204	20	30		EGEDHN
N#Cc1cc(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)cs1	ZINC001326473569	1388206133	/nfs/dbraw/zinc/20/61/33/1388206133.db2.gz	UYCXRXVZSPICHS-INIZCTEOSA-N	0	3	325.437	3.014	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2ccccc2C)C[C@H]1c1ccccc1	ZINC001211519032	1372572260	/nfs/dbraw/zinc/57/22/60/1372572260.db2.gz	IOEKSXBEXOIWMN-LEWJYISDSA-N	0	3	332.447	3.216	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C[C@@H]2C[C@H]2C2CC2)C[C@H]1c1ccccc1	ZINC001211636957	1372593530	/nfs/dbraw/zinc/59/35/30/1372593530.db2.gz	GBKQFXCXHUEBPB-XSDIEEQYSA-N	0	3	336.479	3.030	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@](C)(CC)CCC)C[C@H]1c1ccccc1	ZINC001211698439	1372604376	/nfs/dbraw/zinc/60/43/76/1372604376.db2.gz	NYXSMCVHETWDOL-ZVDOUQERSA-N	0	3	326.484	3.420	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@](C)(CC)CCC)C[C@H]1c1ccccc1	ZINC001211698438	1372604516	/nfs/dbraw/zinc/60/45/16/1372604516.db2.gz	NYXSMCVHETWDOL-QKNQBKEWSA-N	0	3	326.484	3.420	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)CC2=CCCCC2)[C@H](OC)C1	ZINC001212022445	1372648765	/nfs/dbraw/zinc/64/87/65/1372648765.db2.gz	QYHQSDIMLHRWPS-RTBURBONSA-N	0	3	334.504	3.439	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)CCC(C)(F)F)[C@H](OC)C1	ZINC001212479301	1372712991	/nfs/dbraw/zinc/71/29/91/1372712991.db2.gz	QLRAEGOBPHNEFS-HUUCEWRRSA-N	0	3	334.451	3.208	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)CCC[C@H](C)CCC)[C@@H]2C1	ZINC001188043999	1388226713	/nfs/dbraw/zinc/22/67/13/1388226713.db2.gz	TWXDZBMHBWQQOD-CEXWTWQISA-N	0	3	336.520	3.328	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1CN(Cc2ccccc2CC)C[C@H]1OC	ZINC001213322207	1372884381	/nfs/dbraw/zinc/88/43/81/1372884381.db2.gz	DHBGNPZOMFLVDK-NSISKUIASA-N	0	3	344.499	3.167	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2ccn(CC)c2C)[C@H](OC)C1	ZINC001213323021	1372884615	/nfs/dbraw/zinc/88/46/15/1372884615.db2.gz	ZTQUZZWCLPLVDN-RTBURBONSA-N	0	3	349.519	3.216	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN(Cc2c(C)cc(C)cc2C)C[C@H]1OC	ZINC001213350053	1372889251	/nfs/dbraw/zinc/88/92/51/1372889251.db2.gz	DVNQYFNVMZDYHI-WOJBJXKFSA-N	0	3	344.499	3.284	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)[C@H](CC(C)C)c2ccccc2)[C@H](OC)C1	ZINC001213549126	1372924519	/nfs/dbraw/zinc/92/45/19/1372924519.db2.gz	CARXDNJQLTUSFM-VAMGGRTRSA-N	0	3	344.499	3.208	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)[C@@H](C)c2ccc(CC)cc2)[C@H](OC)C1	ZINC001213576852	1372928466	/nfs/dbraw/zinc/92/84/66/1372928466.db2.gz	YRRBQYAMZNBOJC-PWIZWCRZSA-N	0	3	344.499	3.134	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H](NC(=O)c2cc(CC)c(CC)o2)[C@H](OC)C1	ZINC001213725857	1372952684	/nfs/dbraw/zinc/95/26/84/1372952684.db2.gz	LFFRCXLWWVYTRW-IDHHARJASA-N	0	3	348.487	3.188	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@H](C)c2ccccc2)[C@H](OC)C1	ZINC001213751394	1372956149	/nfs/dbraw/zinc/95/61/49/1372956149.db2.gz	DVSVGHIWQLPYII-MISYRCLQSA-N	0	3	344.499	3.352	20	30		EGEDHN
C#CCCCC(=O)NCCNCc1ccccc1Oc1ccccc1	ZINC001126343791	1372958478	/nfs/dbraw/zinc/95/84/78/1372958478.db2.gz	HZPGRIFCLBVMTG-UHFFFAOYSA-N	0	3	336.435	3.488	20	30		EGEDHN
O=C(C#CC1CC1)NCCNCc1sc2ccccc2c1Cl	ZINC001126885412	1373046944	/nfs/dbraw/zinc/04/69/44/1373046944.db2.gz	FZTOLYJHUNGTGM-UHFFFAOYSA-N	0	3	332.856	3.174	20	30		EGEDHN
C[C@@H](C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(Cl)cc2)C1)C1CC1	ZINC001214400302	1373055027	/nfs/dbraw/zinc/05/50/27/1373055027.db2.gz	BKAVDNQFULCCTJ-SPYBWZPUSA-N	0	3	344.886	3.174	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H]2CN(Cc3cc(C)ccc3OC)C[C@H]21	ZINC001188086981	1388240042	/nfs/dbraw/zinc/24/00/42/1388240042.db2.gz	JKJLEUQCWMJUEH-PKOBYXMFSA-N	0	3	342.483	3.393	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](C)[C@H](NCc2c(C)cccc2Cl)C1	ZINC001214524757	1373074147	/nfs/dbraw/zinc/07/41/47/1373074147.db2.gz	NMLQKSCWRKEJMX-CRAIPNDOSA-N	0	3	332.875	3.388	20	30		EGEDHN
CCC(C)(C)CC(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001214710815	1373106997	/nfs/dbraw/zinc/10/69/97/1373106997.db2.gz	QJXMELSJDLEUCG-VQIMIIECSA-N	0	3	344.474	3.440	20	30		EGEDHN
CCc1ccc2occ(C(=O)NCCNCc3cccc(C#N)c3)c2c1	ZINC001127408967	1373124490	/nfs/dbraw/zinc/12/44/90/1373124490.db2.gz	RAFMQISDPNKGAQ-UHFFFAOYSA-N	0	3	347.418	3.386	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cc(C(F)F)ccc2F)cc1	ZINC001127485402	1373130925	/nfs/dbraw/zinc/13/09/25/1373130925.db2.gz	BRHNGZJIUYEDIQ-UHFFFAOYSA-N	0	3	347.340	3.155	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc(F)c(C(F)F)c2)cc1	ZINC001127503041	1373132235	/nfs/dbraw/zinc/13/22/35/1373132235.db2.gz	GPTVRVKXCQHOMM-UHFFFAOYSA-N	0	3	347.340	3.155	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCNCc1ccc(OC)c(Cl)c1	ZINC001128085269	1373216665	/nfs/dbraw/zinc/21/66/65/1373216665.db2.gz	RERDZTNIGQKAQG-UHFFFAOYSA-N	0	3	336.863	3.323	20	30		EGEDHN
CCC[C@H](CC)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2)C1	ZINC001216104773	1373264461	/nfs/dbraw/zinc/26/44/61/1373264461.db2.gz	KJKPDRNSCOGBFX-YZGWKJHDSA-N	0	3	326.484	3.301	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCC2(C)CC2)C[C@H]1NCC#Cc1ccc(F)cc1	ZINC001216182092	1373276138	/nfs/dbraw/zinc/27/61/38/1373276138.db2.gz	PRTLEACFHSUZKH-VQIMIIECSA-N	0	3	342.458	3.194	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)C[C@H](C)CC)[C@@H](n2ccnn2)C1	ZINC001128953107	1373327148	/nfs/dbraw/zinc/32/71/48/1373327148.db2.gz	LUCKNPOTKWMPAW-KURKYZTESA-N	0	3	349.523	3.026	20	30		EGEDHN
CCCCCCCCOCC(=O)NCCNCc1ccsc1	ZINC001129522532	1373393899	/nfs/dbraw/zinc/39/38/99/1373393899.db2.gz	CMNAMEXHDWDDRB-UHFFFAOYSA-N	0	3	326.506	3.331	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)[C@@H](CCCC)C(C)C)C1	ZINC001130450404	1373544719	/nfs/dbraw/zinc/54/47/19/1373544719.db2.gz	NTPHTPGSQPIXKG-AEFFLSMTSA-N	0	3	346.519	3.464	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)[C@@H](C)CC(F)F)[C@H]2C1	ZINC001218314323	1373593693	/nfs/dbraw/zinc/59/36/93/1373593693.db2.gz	ZAGJMBYXMVNBSA-HRCADAONSA-N	0	3	346.462	3.160	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCO[C@@H]2CN(CCC3=CCCCC3)C[C@@H]21	ZINC001218516873	1373627638	/nfs/dbraw/zinc/62/76/38/1373627638.db2.gz	GTHRDGKQTWOKPK-YSIASYRMSA-N	0	3	346.515	3.391	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)c3cc(C)[nH]c3C)[C@H]2C1	ZINC001218697207	1373645033	/nfs/dbraw/zinc/64/50/33/1373645033.db2.gz	PXWYVLLRJVLZNG-RBUKOAKNSA-N	0	3	347.503	3.127	20	30		EGEDHN
C[C@H]1CCN[C@H](C(=O)Nc2nc(-c3ccc(C#N)s3)cs2)C1	ZINC001218787941	1373654887	/nfs/dbraw/zinc/65/48/87/1373654887.db2.gz	OIPBDHYICLRCQY-ONGXEEELSA-N	0	3	332.454	3.070	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)[C@H]2CCC[C@H]2c2ccccc2)c1	ZINC001131157835	1373655771	/nfs/dbraw/zinc/65/57/71/1373655771.db2.gz	ZJVUWHHWINEBOW-SFTDATJTSA-N	0	3	347.462	3.348	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)NCc1ccc(C(F)(F)F)n1C	ZINC001219698966	1373727609	/nfs/dbraw/zinc/72/76/09/1373727609.db2.gz	LOHUEHOAJICFHB-ZDUSSCGKSA-N	0	3	331.382	3.124	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@H]2CCC=CCCC2)[C@@H](O)C1	ZINC001219862986	1373736980	/nfs/dbraw/zinc/73/69/80/1373736980.db2.gz	WXVHDQCEZRUTJB-OTWHNJEPSA-N	0	3	334.504	3.031	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H](C)O[C@]2(CCN(CC(=C)C)C2)C1	ZINC001131660997	1373749327	/nfs/dbraw/zinc/74/93/27/1373749327.db2.gz	INRMJURWIROQBH-XLIONFOSSA-N	0	3	332.488	3.023	20	30		EGEDHN
C=CCCCC(=O)N1C[C@H](C)O[C@]2(CCN(Cc3ccccc3)C2)C1	ZINC001131677196	1373758296	/nfs/dbraw/zinc/75/82/96/1373758296.db2.gz	JOFDHFLJTNMMHJ-RXVVDRJESA-N	0	3	342.483	3.235	20	30		EGEDHN
C#CCCN1CC[C@]2(C1)CN(C(=O)CCCCCCCC)C[C@@H](C)O2	ZINC001131697285	1373768304	/nfs/dbraw/zinc/76/83/04/1373768304.db2.gz	ISOSJEIGSXZZLI-CTNGQTDRSA-N	0	3	348.531	3.452	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)CN(C(=O)CCCC1CCCC1)C[C@H](C)O2	ZINC001131701355	1373770792	/nfs/dbraw/zinc/77/07/92/1373770792.db2.gz	SRKRCFGLINWQDD-GHTZIAJQSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=CCC[C@@H](C)N1CC[C@@H]2CN(C(=O)c3scnc3CC)[C@@H]2C1	ZINC001221600174	1373782853	/nfs/dbraw/zinc/78/28/53/1373782853.db2.gz	LGPIDLGDKXJEDF-IIAWOOMASA-N	0	3	333.501	3.207	20	30		EGEDHN
C=CCCCCCN1CC[C@@H]2CN(C(=O)c3onc(C)c3C)[C@@H]2C1	ZINC001221635890	1373785100	/nfs/dbraw/zinc/78/51/00/1373785100.db2.gz	DBEOWQUYIGAPLD-IAGOWNOFSA-N	0	3	331.460	3.184	20	30		EGEDHN
C=CC[C@H](C(=O)N1C[C@H]2CCN(CCCF)C[C@H]21)c1ccccc1	ZINC001222037042	1373813617	/nfs/dbraw/zinc/81/36/17/1373813617.db2.gz	OJEOSVIOAPBVNJ-CEXWTWQISA-N	0	3	330.447	3.239	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3ncccc3C)[C@H]2C1	ZINC001223587110	1375038836	/nfs/dbraw/zinc/03/88/36/1375038836.db2.gz	OBRHPTRMLFNFNV-MJGOQNOKSA-N	0	3	341.499	3.415	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCC1CCN(Cc2cncc(C)c2)CC1	ZINC001224165091	1375057955	/nfs/dbraw/zinc/05/79/55/1375057955.db2.gz	GEKMKHPAERTXOU-SJORKVTESA-N	0	3	329.488	3.176	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCC1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001224187473	1375060826	/nfs/dbraw/zinc/06/08/26/1375060826.db2.gz	QJUAVBQHQULZRM-KRWDZBQOSA-N	0	3	339.483	3.489	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1CC[C@@H](C)N(CCOc2ccccc2)C1	ZINC001131975533	1375078161	/nfs/dbraw/zinc/07/81/61/1375078161.db2.gz	BCKHZHCJQPEOGJ-MOPGFXCFSA-N	0	3	342.483	3.228	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2cc(OC)no2)CC[C@@H]1C	ZINC001131981427	1375080610	/nfs/dbraw/zinc/08/06/10/1375080610.db2.gz	WGZOJAHZKYGAJC-GJZGRUSLSA-N	0	3	337.464	3.236	20	30		EGEDHN
Cc1cc(C)cc(CN2C[C@H](NC(=O)C#CC(C)C)CC[C@H]2C)c1	ZINC001132015932	1375099295	/nfs/dbraw/zinc/09/92/95/1375099295.db2.gz	BQZZWGZSEBPZTJ-UYAOXDASSA-N	0	3	326.484	3.432	20	30		EGEDHN
Cc1ccc(CN2C[C@@H](NC(=O)C#CC(C)C)CC[C@@H]2C)cc1C	ZINC001132021958	1375102220	/nfs/dbraw/zinc/10/22/20/1375102220.db2.gz	SIZFNTCCCUVBJQ-ICSRJNTNSA-N	0	3	326.484	3.432	20	30		EGEDHN
C[C@H]1CC[C@H](NC(=O)C#CC2CC2)CN1Cc1ccccc1C1CC1	ZINC001132033402	1375107275	/nfs/dbraw/zinc/10/72/75/1375107275.db2.gz	FXCHMYZUGBBDNT-JXFKEZNVSA-N	0	3	336.479	3.447	20	30		EGEDHN
C[C@@H]1CC[C@H](NC(=O)C#CC2CC2)CN1CCCc1ccsc1	ZINC001132045153	1375115136	/nfs/dbraw/zinc/11/51/36/1375115136.db2.gz	AUEGXYAROJOZKP-QAPCUYQASA-N	0	3	330.497	3.063	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2ccc3occc3c2)CC[C@H]1C	ZINC001132051196	1375119045	/nfs/dbraw/zinc/11/90/45/1375119045.db2.gz	YUSVRCHOWIGTDQ-CRAIPNDOSA-N	0	3	342.439	3.218	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1CC[C@@H](C)N(CCOCC(C)C)C1	ZINC001132057235	1375123432	/nfs/dbraw/zinc/12/34/32/1375123432.db2.gz	LTAABIRGVYFETQ-MJGOQNOKSA-N	0	3	336.520	3.397	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCCC[C@H]2NC(=O)/C=C/C2CC2)c(F)c1	ZINC001225570217	1375126074	/nfs/dbraw/zinc/12/60/74/1375126074.db2.gz	PTQJFHDSHUIKPV-HLKZIGTNSA-N	0	3	341.430	3.181	20	30		EGEDHN
C#CCN1CCC(CNC(=O)[C@@H](c2ccc(F)cc2)C(C)C)CC1	ZINC001225596734	1375129954	/nfs/dbraw/zinc/12/99/54/1375129954.db2.gz	ITFIONFWNBQROV-LJQANCHMSA-N	0	3	330.447	3.027	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCOc2cc(C)cc(C)c2)CC[C@@H]1C	ZINC001132097264	1375145181	/nfs/dbraw/zinc/14/51/81/1375145181.db2.gz	HRXAUGUMXCTAJH-ROUUACIJSA-N	0	3	330.472	3.227	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2cc(F)ccc2CC)CC[C@H]1C	ZINC001132148967	1375170602	/nfs/dbraw/zinc/17/06/02/1375170602.db2.gz	DRUMLZVJSXOBPL-CRAIPNDOSA-N	0	3	348.462	3.173	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)C2(CC(C)C)CCC2)CC[C@@H]1C	ZINC001132169646	1375184485	/nfs/dbraw/zinc/18/44/85/1375184485.db2.gz	RTVQVRZXBURJHX-ZWKOTPCHSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2cc3ccsc3[nH]2)CC[C@@H]1C	ZINC001132207382	1375210577	/nfs/dbraw/zinc/21/05/77/1375210577.db2.gz	UEDJGYAZYIDHMZ-DZGCQCFKSA-N	0	3	347.484	3.015	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCCOc2ccccc2C)CC[C@@H]1C	ZINC001132212449	1375212606	/nfs/dbraw/zinc/21/26/06/1375212606.db2.gz	YOCZFDUIBOEFCS-ZWKOTPCHSA-N	0	3	330.472	3.309	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CC[C@H](C)N(CCc2scnc2C)C1	ZINC001132235908	1375231646	/nfs/dbraw/zinc/23/16/46/1375231646.db2.gz	VJSOYDLGPZODKJ-DOTOQJQBSA-N	0	3	347.528	3.157	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC1CCN([C@@H](C)c2cccc(F)c2)CC1	ZINC001226446472	1375260155	/nfs/dbraw/zinc/26/01/55/1375260155.db2.gz	BTROFIUSPFURAL-JKSUJKDBSA-N	0	3	348.462	3.449	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H]2CC[C@H](C)N(CCOCC3CC3)C2)CC1	ZINC001132277623	1375261600	/nfs/dbraw/zinc/26/16/00/1375261600.db2.gz	HVQMRPUDCIFWKH-WMZOPIPTSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H]1CCCC[C@H]1NCc1cnoc1C	ZINC001226468138	1375263903	/nfs/dbraw/zinc/26/39/03/1375263903.db2.gz	GLBWQGNWFLLKCW-HUUCEWRRSA-N	0	3	339.867	3.279	20	30		EGEDHN
C=CCOCC(=O)NC1CCN(Cc2ccc(C3CCC3)cc2)CC1	ZINC001226599012	1375289353	/nfs/dbraw/zinc/28/93/53/1375289353.db2.gz	PAODCLNASSMXKB-UHFFFAOYSA-N	0	3	342.483	3.237	20	30		EGEDHN
C[C@H](C#N)C(=O)NC1CCN([C@H]2CCc3c2cccc3Cl)CC1	ZINC001226626239	1375295657	/nfs/dbraw/zinc/29/56/57/1375295657.db2.gz	WJDILYSGXJUFKO-PXAZEXFGSA-N	0	3	331.847	3.068	20	30		EGEDHN
C#CCCCCC(=O)NC1CCN(CC[C@H]2CC2(Cl)Cl)CC1	ZINC001226951798	1375368438	/nfs/dbraw/zinc/36/84/38/1375368438.db2.gz	JASUOHVNKGWNPE-AWEZNQCLSA-N	0	3	345.314	3.345	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)[C@H]2CC[C@H](CC)CC2)CC[C@@H]1C	ZINC001132429813	1375376952	/nfs/dbraw/zinc/37/69/52/1375376952.db2.gz	PXAHXNOQIBLDAW-CADBVGFASA-N	0	3	336.520	3.375	20	30		EGEDHN
C#CCCCC(=O)NC1CCN(Cc2cccc(OC(C)C)c2)CC1	ZINC001227076914	1375385503	/nfs/dbraw/zinc/38/55/03/1375385503.db2.gz	TYMRKHKGJBROEW-UHFFFAOYSA-N	0	3	342.483	3.358	20	30		EGEDHN
Cc1cccc(OCCN2CCC(NC(=O)C#CC(C)(C)C)CC2)c1	ZINC001227290512	1375416747	/nfs/dbraw/zinc/41/67/47/1375416747.db2.gz	ZXAIJEJXZHSMEZ-UHFFFAOYSA-N	0	3	342.483	3.004	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCOc2cccc(C)c2)CC[C@@H]1C	ZINC001132500505	1375426943	/nfs/dbraw/zinc/42/69/43/1375426943.db2.gz	PCJNTTROUBLEKK-ROUUACIJSA-N	0	3	330.472	3.309	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)C23CCC(CC2)CC3)CC[C@H]1C	ZINC001132501113	1375427016	/nfs/dbraw/zinc/42/70/16/1375427016.db2.gz	UWIZWIRLSOSNPB-BHASAWDCSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1CC[C@H](C)N(Cc2ccc(C)cc2)C1	ZINC001132528299	1375443010	/nfs/dbraw/zinc/44/30/10/1375443010.db2.gz	BHKURXGVVJCGKQ-PKOBYXMFSA-N	0	3	330.472	3.057	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1CC[C@@H](C)N(Cc2ccccc2C)C1	ZINC001132530327	1375444490	/nfs/dbraw/zinc/44/44/90/1375444490.db2.gz	WQZCJHNZSMSQIC-MJGOQNOKSA-N	0	3	330.472	3.057	20	30		EGEDHN
C=CCCC(=O)N(Cc1ccccn1)[C@@H]1CCCN(CC#CC)CC1	ZINC001132551037	1375457018	/nfs/dbraw/zinc/45/70/18/1375457018.db2.gz	AHHHZOBQAHGMNJ-HXUWFJFHSA-N	0	3	339.483	3.254	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)CCCF)CC1	ZINC001132555604	1375463102	/nfs/dbraw/zinc/46/31/02/1375463102.db2.gz	XDGJBJGASKZDEP-LJQANCHMSA-N	0	3	345.462	3.038	20	30		EGEDHN
C#CCC1(C(=O)NC2CCN(C/C=C\c3ccccc3)CC2)CCC1	ZINC001227755013	1375472124	/nfs/dbraw/zinc/47/21/24/1375472124.db2.gz	WGOAQXKZEGGRBG-POHAHGRESA-N	0	3	336.479	3.474	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCCNCc1csc(Br)c1	ZINC001132671148	1375507410	/nfs/dbraw/zinc/50/74/10/1375507410.db2.gz	JXZIZGJRQQWJCG-LLVKDONJSA-N	0	3	345.306	3.319	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CCCC[C@H]1NCc1conc1CC	ZINC001228111746	1375519041	/nfs/dbraw/zinc/51/90/41/1375519041.db2.gz	DYVICFUVBANSQJ-BMGDILEWSA-N	0	3	333.476	3.356	20	30		EGEDHN
Cc1cnc(CNC[C@H]2CN(C(=O)C#CC(C)(C)C)CC[C@@H]2C)s1	ZINC001132820411	1375582528	/nfs/dbraw/zinc/58/25/28/1375582528.db2.gz	VFWNFZQIAWPOEE-HOCLYGCPSA-N	0	3	347.528	3.075	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](C)[C@H](CNCc2ocnc2C)C1	ZINC001132843005	1375594955	/nfs/dbraw/zinc/59/49/55/1375594955.db2.gz	GXKPMHPIZQPGNV-CRAIPNDOSA-N	0	3	345.487	3.326	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC1CCN(Cc2ccc3c(c2)COC3)CC1	ZINC001228580726	1375605005	/nfs/dbraw/zinc/60/50/05/1375605005.db2.gz	ZVDGBYDJLXLYKH-UHFFFAOYSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](C)[C@H](CNCc2nc(C)cs2)C1	ZINC001132864865	1375607632	/nfs/dbraw/zinc/60/76/32/1375607632.db2.gz	DGWHIVLRSQVQMV-GOEBONIOSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](C)[C@H](CNCc2csc(C)n2)C1	ZINC001132866145	1375609906	/nfs/dbraw/zinc/60/99/06/1375609906.db2.gz	WMUOSWIAPQXLDN-GOEBONIOSA-N	0	3	335.517	3.382	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@@H]1Oc1cc([N+](=O)[O-])ccc1C#N	ZINC001228926648	1375717554	/nfs/dbraw/zinc/71/75/54/1375717554.db2.gz	NUTNOLLHAAAKAA-LIRRHRJNSA-N	0	3	337.379	3.366	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC1CCN(C[C@@H](O)c2ccc(F)cc2)CC1	ZINC001229017483	1375740754	/nfs/dbraw/zinc/74/07/54/1375740754.db2.gz	TXKMDEJZSCMFKX-UYAOXDASSA-N	0	3	348.462	3.042	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](C)[C@@H](CNCc3cscn3)C2)CC1	ZINC001133105540	1375778779	/nfs/dbraw/zinc/77/87/79/1375778779.db2.gz	VCTQKIRZYHMDMX-CVEARBPZSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](C)[C@@H](CNCc2cc(C)no2)C1	ZINC001133137928	1375798867	/nfs/dbraw/zinc/79/88/67/1375798867.db2.gz	AAJRQFHKATZVQJ-ZBFHGGJFSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)CC[C@@H](C)c2ccccc2)CC1	ZINC001229476721	1375842255	/nfs/dbraw/zinc/84/22/55/1375842255.db2.gz	NQQBQYGZNGGYKX-GOSISDBHSA-N	0	3	344.499	3.354	20	30		EGEDHN
CC(C)(C)C#CC(=O)N(CCNCCF)Cc1cccc(Cl)c1	ZINC001133396046	1375979370	/nfs/dbraw/zinc/97/93/70/1375979370.db2.gz	ODPVBRNEWAENIB-UHFFFAOYSA-N	0	3	338.854	3.277	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H]1C[C@H]1CCC	ZINC001133403907	1375988674	/nfs/dbraw/zinc/98/86/74/1375988674.db2.gz	OUZXUIOQEXBFQY-SJLPKXTDSA-N	0	3	332.875	3.328	20	30		EGEDHN
CC#CCCCC(=O)N(CCNCCF)Cc1cccc(Cl)c1	ZINC001133403889	1375988807	/nfs/dbraw/zinc/98/88/07/1375988807.db2.gz	OCBFSWBVSNNYNE-UHFFFAOYSA-N	0	3	338.854	3.421	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@H]1C[C@H]1C(C)C	ZINC001133407572	1375992543	/nfs/dbraw/zinc/99/25/43/1375992543.db2.gz	JHIBGJDUQVMXRM-ROUUACIJSA-N	0	3	332.875	3.184	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1c[nH]cc1C	ZINC001133410488	1375994339	/nfs/dbraw/zinc/99/43/39/1375994339.db2.gz	JADONRFKHGCTNX-UHFFFAOYSA-N	0	3	343.858	3.232	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N[C@@H]1CCCC[C@H]1NCc1cc(C)ccc1F	ZINC001230324632	1375998124	/nfs/dbraw/zinc/99/81/24/1375998124.db2.gz	QRGZIXWSPIIAGV-KFKAGJAMSA-N	0	3	348.462	3.242	20	30		EGEDHN
C#CC[C@@H](CC(=O)N[C@@H]1CCCC[C@H]1NCCF)c1ccccc1	ZINC001230373854	1376009468	/nfs/dbraw/zinc/00/94/68/1376009468.db2.gz	QIJAGWPMCWIADY-IPMKNSEASA-N	0	3	330.447	3.170	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1C1CCN(C(=O)CCCCOC)CC1	ZINC001230522177	1376052490	/nfs/dbraw/zinc/05/24/90/1376052490.db2.gz	IQRUSKBUCFKXBE-QGZVFWFLSA-N	0	3	342.911	3.259	20	30		EGEDHN
C=CCCC(=O)N1CCC([C@@H]2CCCN2Cc2nocc2C)CC1	ZINC001230537757	1376061359	/nfs/dbraw/zinc/06/13/59/1376061359.db2.gz	JSRAQROONCHDBM-SFHVURJKSA-N	0	3	331.460	3.152	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)c1ccc(C)s1	ZINC001133536197	1376068590	/nfs/dbraw/zinc/06/85/90/1376068590.db2.gz	RTBZRBLXGCVCFR-QWRGUYRKSA-N	0	3	345.306	3.452	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)c1c(C)coc1C)Cc1cccnc1	ZINC001230747467	1376138052	/nfs/dbraw/zinc/13/80/52/1376138052.db2.gz	DUUVHCIRZNKJKY-UHFFFAOYSA-N	0	3	341.455	3.490	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)[C@H]1CC[C@@H](F)C1)Cc1cccnc1	ZINC001230824543	1376160786	/nfs/dbraw/zinc/16/07/86/1376160786.db2.gz	FHOIZXONGOIZKP-ZWKOTPCHSA-N	0	3	333.451	3.104	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)[C@@H]1C[C@H]1C(C)C)Cc1cccnc1	ZINC001230882058	1376175870	/nfs/dbraw/zinc/17/58/70/1376175870.db2.gz	MGJNQPGQNRBAFU-RBUKOAKNSA-N	0	3	329.488	3.258	20	30		EGEDHN
C#CCC1(C(=O)NCCCN(CC)Cc2cccnc2)CCCCC1	ZINC001230940004	1376184761	/nfs/dbraw/zinc/18/47/61/1376184761.db2.gz	MAOQKMZJUUUHAG-UHFFFAOYSA-N	0	3	341.499	3.384	20	30		EGEDHN
CC/C=C(\C)C(=O)N[C@H](C)C[C@H](C)NCc1cc(F)ccc1C#N	ZINC001133839340	1376225977	/nfs/dbraw/zinc/22/59/77/1376225977.db2.gz	FHKHEUHOEKGSKT-ZCIHOMHXSA-N	0	3	331.435	3.427	20	30		EGEDHN
CN(CCCNC(=O)CC1CCCC1)Cc1ccc(F)c(C#N)c1	ZINC001231379519	1376234115	/nfs/dbraw/zinc/23/41/15/1376234115.db2.gz	TXFCYRNAAPBWEX-UHFFFAOYSA-N	0	3	331.435	3.216	20	30		EGEDHN
C#CCCCC(=O)N[C@@H](C)C[C@H](C)NCc1nsc2ccccc12	ZINC001134206494	1376418260	/nfs/dbraw/zinc/41/82/60/1376418260.db2.gz	VRCBLAPIUFENOR-GJZGRUSLSA-N	0	3	343.496	3.473	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)C#CC1CC1)NCc1cccc(F)c1Cl	ZINC001134321663	1376475575	/nfs/dbraw/zinc/47/55/75/1376475575.db2.gz	KPCBGDXWRSYXDM-STQMWFEESA-N	0	3	336.838	3.265	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cccc(CF)n1)[C@H]2CC	ZINC001232533373	1376477781	/nfs/dbraw/zinc/47/77/81/1376477781.db2.gz	NGQXBRQQQWWVFN-ICSRJNTNSA-N	0	3	345.462	3.473	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H](C)C[C@@H](C)NCc1nccn1CC	ZINC001134418290	1376523020	/nfs/dbraw/zinc/52/30/20/1376523020.db2.gz	IIOIOWOMKAYCCB-HZPDHXFCSA-N	0	3	332.492	3.044	20	30		EGEDHN
N#Cc1cccc(CN2CCCC3(CN(Cc4ccccc4)C3)C2)n1	ZINC001232927086	1376537897	/nfs/dbraw/zinc/53/78/97/1376537897.db2.gz	QDNAGLCWYJZRTM-UHFFFAOYSA-N	0	3	332.451	3.051	20	30		EGEDHN
CN(Cc1cccc(C#N)n1)[C@H]1CC[C@H](NC(=O)OC(C)(C)C)CC1	ZINC001232926276	1376538481	/nfs/dbraw/zinc/53/84/81/1376538481.db2.gz	GIRCFFZLZLBOTF-CZIWCDLHSA-N	0	3	344.459	3.221	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H](C)C[C@H](C)NCC(=C)Br	ZINC001134447071	1376542210	/nfs/dbraw/zinc/54/22/10/1376542210.db2.gz	FYNBGSAVMRWHPP-QWHCGFSZSA-N	0	3	331.298	3.370	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@H](C)C[C@H](C)NCc1conc1C	ZINC001134450074	1376544253	/nfs/dbraw/zinc/54/42/53/1376544253.db2.gz	ZMNJULRTCHFBJX-WDEREUQCSA-N	0	3	327.856	3.135	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)C[C@H](C)NCc2ccn(C(C)C)n2)CCC1	ZINC001134566979	1376599629	/nfs/dbraw/zinc/59/96/29/1376599629.db2.gz	ITHZETQLCJTVSA-DLBZAZTESA-N	0	3	344.503	3.031	20	30		EGEDHN
COc1ccc(C#N)c(C(=O)N(C2CCCC2)C2CCN(C)CC2)c1	ZINC001189084469	1388454309	/nfs/dbraw/zinc/45/43/09/1388454309.db2.gz	ORSUXNORZGRNRE-UHFFFAOYSA-N	0	3	341.455	3.046	20	30		EGEDHN
C[C@H](CC1CCCCC1)C(=O)NCCNCc1cccc(C#N)c1	ZINC001134677911	1376651480	/nfs/dbraw/zinc/65/14/80/1376651480.db2.gz	LUQDPONEGXRDKC-MRXNPFEDSA-N	0	3	327.472	3.371	20	30		EGEDHN
Cc1ccccc1[C@H](C)CC(=O)NCCNCc1ccc(C#N)cc1	ZINC001134727342	1376679375	/nfs/dbraw/zinc/67/93/75/1376679375.db2.gz	GGACMJUVBOVECG-QGZVFWFLSA-N	0	3	335.451	3.266	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)C1(F)CCCC1)NCc1cc(F)ccc1C#N	ZINC001134792153	1376726578	/nfs/dbraw/zinc/72/65/78/1376726578.db2.gz	ZBDMCRUHGITMKB-KGLIPLIRSA-N	0	3	349.425	3.353	20	30		EGEDHN
CN(C[C@@H]1CCN1C[C@H]1CCCC(F)(F)C1)C(=O)C#CC(C)(C)C	ZINC001234215561	1376787505	/nfs/dbraw/zinc/78/75/05/1376787505.db2.gz	MORGWZGHHBDZJE-HOTGVXAUSA-N	0	3	340.458	3.394	20	30		EGEDHN
C=CCCCCCN1CC[C@@H]1CN(C)C(=O)[C@H]1OCC[C@H]1C(C)C	ZINC001234378452	1376824640	/nfs/dbraw/zinc/82/46/40/1376824640.db2.gz	RDPVDIWVKFTQKI-QYZOEREBSA-N	0	3	336.520	3.327	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H](C)C[C@@H](C)NCC(=C)Br	ZINC001135183976	1376957367	/nfs/dbraw/zinc/95/73/67/1376957367.db2.gz	AEBLHBCIDPGRTI-CHWSQXEVSA-N	0	3	331.298	3.370	20	30		EGEDHN
C[C@@H](CC(=O)NCCNCc1ccc(C#N)cc1)C1CCCCC1	ZINC001135227563	1376988068	/nfs/dbraw/zinc/98/80/68/1376988068.db2.gz	GHJAHCVDWGUULB-INIZCTEOSA-N	0	3	327.472	3.371	20	30		EGEDHN
C[C@@H](CC(=O)NCCNCc1cccc(C#N)c1)C1CCCCC1	ZINC001135227715	1376989029	/nfs/dbraw/zinc/98/90/29/1376989029.db2.gz	LLFPVRCRPINOID-INIZCTEOSA-N	0	3	327.472	3.371	20	30		EGEDHN
CCc1cc(CN2CC[C@@]3(C[C@H](OCC4CC4)CO3)C2)ccc1C#N	ZINC001238776329	1377001180	/nfs/dbraw/zinc/00/11/80/1377001180.db2.gz	VEPPAXCDBNFBHN-LEWJYISDSA-N	0	3	340.467	3.281	20	30		EGEDHN
CCc1cc(CN2CC[C@@]3(C[C@@H](OCC4CC4)CO3)C2)ccc1C#N	ZINC001238776331	1377001461	/nfs/dbraw/zinc/00/14/61/1377001461.db2.gz	VEPPAXCDBNFBHN-NHCUHLMSSA-N	0	3	340.467	3.281	20	30		EGEDHN
CCc1cc(CN2CC[C@H](CNC(=O)OC(C)(C)C)C2)ccc1C#N	ZINC001238778568	1377001880	/nfs/dbraw/zinc/00/18/80/1377001880.db2.gz	OOALUEMSDBNWNR-MRXNPFEDSA-N	0	3	343.471	3.467	20	30		EGEDHN
C=CCCCC(=O)N[C@H](C)C[C@H](C)NCc1nccn1C(F)F	ZINC001135353204	1377049146	/nfs/dbraw/zinc/04/91/46/1377049146.db2.gz	DDIJYQWNNYOOSY-QWHCGFSZSA-N	0	3	328.407	3.007	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H](C)C[C@@H](C)NCc2ccccc2C#N)C1	ZINC001135426675	1377090097	/nfs/dbraw/zinc/09/00/97/1377090097.db2.gz	GNGCAAWSHICWFU-HZPDHXFCSA-N	0	3	325.456	3.287	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H](C)C[C@@H](C)NCc2oc(CC)nc2C)C1	ZINC001135426610	1377090117	/nfs/dbraw/zinc/09/01/17/1377090117.db2.gz	FTFGIGPUDZJEIJ-ZIAGYGMSSA-N	0	3	333.476	3.275	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)C(C)(C)C(F)F	ZINC001135427302	1377091016	/nfs/dbraw/zinc/09/10/16/1377091016.db2.gz	PFEMHVPADCOYRX-NXEZZACHSA-N	0	3	341.240	3.059	20	30		EGEDHN
Cc1ccoc1CC(=O)N[C@@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001135447349	1377100971	/nfs/dbraw/zinc/10/09/71/1377100971.db2.gz	VKMUAHXWDVYCPG-CVEARBPZSA-N	0	3	339.439	3.075	20	30		EGEDHN
C[C@@H]1CCCN(CCNC(=O)c2c(Cl)cc(C#N)cc2Cl)C1	ZINC001136225110	1377365664	/nfs/dbraw/zinc/36/56/64/1377365664.db2.gz	RZRLNWVAZNDQGL-LLVKDONJSA-N	0	3	340.254	3.327	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CC[C@@H](N(C)C/C=C/c2ccccc2)C1	ZINC001189243337	1388494279	/nfs/dbraw/zinc/49/42/79/1388494279.db2.gz	VATFCKZBMVVPMV-IEYVCLCVSA-N	0	3	342.483	3.214	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@@H](CCNC(=O)CCCC2CC2)C1	ZINC001267560632	1377456556	/nfs/dbraw/zinc/45/65/56/1377456556.db2.gz	BICYGQQRDWVVOG-GOSISDBHSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1ccc(COC)c(F)c1)C(C)C	ZINC001268227625	1377498368	/nfs/dbraw/zinc/49/83/68/1377498368.db2.gz	VRAHIWPJPWEGMZ-MRXNPFEDSA-N	0	3	342.842	3.069	20	30		EGEDHN
CC(C)(C(=O)N[C@@H](CNCc1ccc(C#N)cc1F)C1CC1)C1CC1	ZINC001269103462	1377538893	/nfs/dbraw/zinc/53/88/93/1377538893.db2.gz	DMSKUDBEWXSPDR-SFHVURJKSA-N	0	3	343.446	3.118	20	30		EGEDHN
C#CCOc1ccc(CN2CCC(c3ccncc3)CC2)cc1OC	ZINC001138345746	1377706206	/nfs/dbraw/zinc/70/62/06/1377706206.db2.gz	OBAVQNVYMRMVEA-UHFFFAOYSA-N	0	3	336.435	3.482	20	30		EGEDHN
C#CCOc1ccc(CN2CCN3CCc4ccccc4[C@@H]3C2)cc1	ZINC001138560379	1377741914	/nfs/dbraw/zinc/74/19/14/1377741914.db2.gz	UPDNUQQHUKWWLU-QFIPXVFZSA-N	0	3	332.447	3.114	20	30		EGEDHN
COc1cc(CN2CCC3SC(=O)C=C3C2)ccc1OC(C)C	ZINC001138572443	1377745160	/nfs/dbraw/zinc/74/51/60/1377745160.db2.gz	SGEXXYAHXNGIOK-KRWDZBQOSA-N	0	3	333.453	3.257	20	30		EGEDHN
C=CCc1cccc(CN2Cc3cnn(CC)c3[C@H](COC)C2)c1O	ZINC001138626904	1377755935	/nfs/dbraw/zinc/75/59/35/1377755935.db2.gz	SGBHEZAPFLUXBG-SFHVURJKSA-N	0	3	341.455	3.083	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCCC[C@@H]2C(=O)N2CCCC2)c1[O-]	ZINC001138629090	1377756561	/nfs/dbraw/zinc/75/65/61/1377756561.db2.gz	NOFXUIWRIFSOPY-GOSISDBHSA-N	0	3	328.456	3.098	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCCC[C@@H]2C(=O)N2CCCC2)c1[O-]	ZINC001138629090	1377756562	/nfs/dbraw/zinc/75/65/62/1377756562.db2.gz	NOFXUIWRIFSOPY-GOSISDBHSA-N	0	3	328.456	3.098	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@H](CNC(=O)OC(C)(C)C)C2)c1[O-]	ZINC001138628018	1377756631	/nfs/dbraw/zinc/75/66/31/1377756631.db2.gz	LXYCKRWYSMCUKB-OAHLLOKOSA-N	0	3	346.471	3.467	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@H](CNC(=O)OC(C)(C)C)C2)c1[O-]	ZINC001138628018	1377756635	/nfs/dbraw/zinc/75/66/35/1377756635.db2.gz	LXYCKRWYSMCUKB-OAHLLOKOSA-N	0	3	346.471	3.467	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@@H]3OCCC[C@@]3(COC)C2)c1[O-]	ZINC001138627802	1377756923	/nfs/dbraw/zinc/75/69/23/1377756923.db2.gz	PDVHTGLXIRRLMN-ICSRJNTNSA-N	0	3	331.456	3.138	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@@H]3OCCC[C@@]3(COC)C2)c1[O-]	ZINC001138627802	1377756924	/nfs/dbraw/zinc/75/69/24/1377756924.db2.gz	PDVHTGLXIRRLMN-ICSRJNTNSA-N	0	3	331.456	3.138	20	30		EGEDHN
C=C(C)COc1ccccc1CN1CC[C@@H]2[C@@H](CCC(=O)N2C)C1	ZINC001138666177	1377765097	/nfs/dbraw/zinc/76/50/97/1377765097.db2.gz	LAPFPAOFECHZEL-FUHWJXTLSA-N	0	3	328.456	3.084	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCCN(Cc3cnc4[nH]ccc4c3)C2)cc1	ZINC001138744043	1377778525	/nfs/dbraw/zinc/77/85/25/1377778525.db2.gz	JAJYJPVIKLJMBY-IBGZPJMESA-N	0	3	332.407	3.478	20	30		EGEDHN
N#CC1(c2ccccc2)CCN(Cc2ccc(-n3cncn3)cc2)CC1	ZINC001139329699	1377868915	/nfs/dbraw/zinc/86/89/15/1377868915.db2.gz	GJTWGBJDMFCRHW-UHFFFAOYSA-N	0	3	343.434	3.325	20	30		EGEDHN
N#Cc1ccc(Oc2ccc(CN3CC(N4CCCCC4)C3)cn2)cc1	ZINC001139427287	1377882263	/nfs/dbraw/zinc/88/22/63/1377882263.db2.gz	BBKASOMLGQENOW-UHFFFAOYSA-N	0	3	348.450	3.416	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CC2)C(=O)N[C@H]3c2ccccc2)cc1F	ZINC001139527742	1377897182	/nfs/dbraw/zinc/89/71/82/1377897182.db2.gz	OPFLGRGGUXBHEH-IBGZPJMESA-N	0	3	349.409	3.151	20	30		EGEDHN
N#Cc1cccc2c(CN3C[C@@H]4C[C@H]3CN4Cc3ccccc3)c[nH]c21	ZINC001139704036	1377937695	/nfs/dbraw/zinc/93/76/95/1377937695.db2.gz	ZKAHJOSPFAIVJN-PMACEKPBSA-N	0	3	342.446	3.498	20	30		EGEDHN
N#Cc1cccc2c(CN3CCC[C@H](Oc4cccnc4)C3)c[nH]c21	ZINC001139702997	1377937826	/nfs/dbraw/zinc/93/78/26/1377937826.db2.gz	FZBZULMYUYPNGX-SFHVURJKSA-N	0	3	332.407	3.478	20	30		EGEDHN
Cc1ccc(CN2CC[C@H]3O[C@@H](COCC4CC4)CC[C@H]32)cc1C#N	ZINC001139725178	1377941916	/nfs/dbraw/zinc/94/19/16/1377941916.db2.gz	FZQPRDPRGUXDKP-NJDAHSKKSA-N	0	3	340.467	3.415	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCC[N@@H+](Cc3cc(F)ccc3[O-])C2)cc1	ZINC001140059913	1377998441	/nfs/dbraw/zinc/99/84/41/1377998441.db2.gz	ANFMVZHIQCLHIW-SFHVURJKSA-N	0	3	326.371	3.446	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCC[N@H+](Cc3cc(F)ccc3[O-])C2)cc1	ZINC001140059913	1377998442	/nfs/dbraw/zinc/99/84/42/1377998442.db2.gz	ANFMVZHIQCLHIW-SFHVURJKSA-N	0	3	326.371	3.446	20	30		EGEDHN
N#Cc1cccc(O[C@H]2CCCN(Cc3ccc4n[nH]cc4c3)C2)c1	ZINC001140388021	1378056286	/nfs/dbraw/zinc/05/62/86/1378056286.db2.gz	FSOYTXGBHZHOCX-IBGZPJMESA-N	0	3	332.407	3.478	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3nc(Cl)ccc3C)C2)C1=O	ZINC001140444377	1378063777	/nfs/dbraw/zinc/06/37/77/1378063777.db2.gz	HNEDCMGUDSVUCL-GOSISDBHSA-N	0	3	333.863	3.044	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cc(F)cc(OC)c1)CC2	ZINC001140480543	1378070428	/nfs/dbraw/zinc/07/04/28/1378070428.db2.gz	LYHZUTPEZXNYGN-FQEVSTJZSA-N	0	3	346.446	3.367	20	30		EGEDHN
C=CCNC(=O)[C@H]1CC12CCN(CCc1cccc(Cl)c1)CC2	ZINC001272894042	1378082775	/nfs/dbraw/zinc/08/27/75/1378082775.db2.gz	UJALGOATDJMOOJ-QGZVFWFLSA-N	0	3	332.875	3.287	20	30		EGEDHN
CN(Cc1ccccc1F)C1CCN(Cc2ccc(C#N)nc2)CC1	ZINC001140546292	1378082923	/nfs/dbraw/zinc/08/29/23/1378082923.db2.gz	CDHRADDRJVJLQB-UHFFFAOYSA-N	0	3	338.430	3.189	20	30		EGEDHN
C=C(C)CN1CCC2(CCN(Cc3cccc(OCC)c3)CC2)C1=O	ZINC001273303654	1378095932	/nfs/dbraw/zinc/09/59/32/1378095932.db2.gz	NIFXUKAXZRPPJK-UHFFFAOYSA-N	0	3	342.483	3.476	20	30		EGEDHN
Cc1cnc2n1CCC21CCN(Cc2cc(F)c(C#N)c(F)c2)CC1	ZINC001140752546	1378129379	/nfs/dbraw/zinc/12/93/79/1378129379.db2.gz	VMAFDXFVTXPTBF-UHFFFAOYSA-N	0	3	342.393	3.279	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3ccc(OC)cc3Cl)C2)C1=O	ZINC001140819784	1378150782	/nfs/dbraw/zinc/15/07/82/1378150782.db2.gz	JUDWXEGTPGEDEC-IBGZPJMESA-N	0	3	348.874	3.349	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CCN(Cc3[nH]cc(C)c3C)C2)C1	ZINC001140855746	1378159631	/nfs/dbraw/zinc/15/96/31/1378159631.db2.gz	BJRURFOIYOMNFR-IBGZPJMESA-N	0	3	331.460	3.242	20	30		EGEDHN
COc1ccc(CN2CCC[C@H](Oc3ccc(C#N)cc3)C2)cc1N	ZINC001140903519	1378177265	/nfs/dbraw/zinc/17/72/65/1378177265.db2.gz	WFRRLDUPYSGEKP-SFHVURJKSA-N	0	3	337.423	3.192	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@H]1CCN(Cc1sccc1OC)C2	ZINC001141323363	1378301438	/nfs/dbraw/zinc/30/14/38/1378301438.db2.gz	WWVSYESOAZJUPH-ROUUACIJSA-N	0	3	337.485	3.330	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@@H]1CCN(Cc1sccc1OC)C2	ZINC001141323361	1378301802	/nfs/dbraw/zinc/30/18/02/1378301802.db2.gz	WWVSYESOAZJUPH-MSOLQXFVSA-N	0	3	337.485	3.330	20	30		EGEDHN
N#Cc1ccc2cc(CN3CC4(C3)CCN(Cc3ccc[nH]3)C4)[nH]c2c1	ZINC001279981900	1378325989	/nfs/dbraw/zinc/32/59/89/1378325989.db2.gz	SIKMHZREQSYAKS-UHFFFAOYSA-N	0	3	345.450	3.076	20	30		EGEDHN
CC(C)(C)C(=O)NC[C@@H]1CCCCCN1Cc1ccc(C#N)cc1	ZINC001282677983	1378549313	/nfs/dbraw/zinc/54/93/13/1378549313.db2.gz	LOKYUDPPWAQYKS-SFHVURJKSA-N	0	3	327.472	3.465	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1ccc(OC)cn1)[C@@H]2CC	ZINC001144424047	1378729569	/nfs/dbraw/zinc/72/95/69/1378729569.db2.gz	UZSJHHBZJBHJCB-QUCCMNQESA-N	0	3	343.471	3.012	20	30		EGEDHN
C#Cc1ccc(CN(C)C[C@@H]2CCCN2C(=O)OC(C)(C)C)cc1	ZINC001144578702	1378747323	/nfs/dbraw/zinc/74/73/23/1378747323.db2.gz	JSROGABZNYMOBQ-SFHVURJKSA-N	0	3	328.456	3.499	20	30		EGEDHN
Cc1c2cc(C)ccc2[nH]c1C(=O)NCCNCc1cccc(C#N)c1	ZINC001146280885	1378809108	/nfs/dbraw/zinc/80/91/08/1378809108.db2.gz	JVXCBMCLVINWCF-UHFFFAOYSA-N	0	3	346.434	3.176	20	30		EGEDHN
CCn1cccc1C(=O)N[C@@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001146350758	1378824686	/nfs/dbraw/zinc/82/46/86/1378824686.db2.gz	SSYBSXTZFVPSIZ-HOTGVXAUSA-N	0	3	338.455	3.066	20	30		EGEDHN
Cc1cc(C)cc(CCC(=O)NCCNCc2cccc(C#N)c2)c1	ZINC001146754440	1378913634	/nfs/dbraw/zinc/91/36/34/1378913634.db2.gz	RNYQRSHYDHYKAZ-UHFFFAOYSA-N	0	3	335.451	3.014	20	30		EGEDHN
Cc1cc(C)cc(CCC(=O)NCCNCc2ccc(C#N)s2)c1	ZINC001146752752	1378913654	/nfs/dbraw/zinc/91/36/54/1378913654.db2.gz	GFNFGSLSIVIBGT-UHFFFAOYSA-N	0	3	341.480	3.075	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C[C@H](C)NCc2cc(C)no2)CCCC1	ZINC001146830965	1378931741	/nfs/dbraw/zinc/93/17/41/1378931741.db2.gz	PHBOBKMJJOEZGN-LSDHHAIUSA-N	0	3	333.476	3.492	20	30		EGEDHN
C=CCCC(=O)N1CC2(C1)CCN([C@@H]1CCc3ccc(F)cc31)C2	ZINC001147188276	1378983895	/nfs/dbraw/zinc/98/38/95/1378983895.db2.gz	WQNQNPGWTKJNAV-GOSISDBHSA-N	0	3	328.431	3.314	20	30		EGEDHN
C#CCCCCC(=O)N1CC2(C1)CCN(C/C=C/c1ccccc1)C2	ZINC001147374898	1379011240	/nfs/dbraw/zinc/01/12/40/1379011240.db2.gz	USCFTANQDSCVRX-FMIVXFBMSA-N	0	3	336.479	3.428	20	30		EGEDHN
C#CCCCC(=O)N1CC2(C1)CCN([C@@H](C)c1cccc(F)c1)C2	ZINC001147462057	1379024756	/nfs/dbraw/zinc/02/47/56/1379024756.db2.gz	MRCKISQTEJVNLS-INIZCTEOSA-N	0	3	328.431	3.225	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc3c(c2)CCC=C3)cc1	ZINC001148057850	1379110865	/nfs/dbraw/zinc/11/08/65/1379110865.db2.gz	NRCJCEYIYSVNRQ-UHFFFAOYSA-N	0	3	331.419	3.037	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC2(C1)CCN(Cc1cccc(OC)c1)C2	ZINC001148129752	1379122751	/nfs/dbraw/zinc/12/27/51/1379122751.db2.gz	IGZBDGOHZQHZLY-QGZVFWFLSA-N	0	3	342.483	3.332	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001148137879	1379123111	/nfs/dbraw/zinc/12/31/11/1379123111.db2.gz	HEUGUIWAOBWZCI-IRXDYDNUSA-N	0	3	337.467	3.051	20	30		EGEDHN
C[C@@H](CN(C)C(=O)[C@@H]1CC[C@@H](C)CC1)NCc1ccc(C#N)s1	ZINC001283703567	1379128548	/nfs/dbraw/zinc/12/85/48/1379128548.db2.gz	HUJMQKZTJNUZMK-KKUMJFAQSA-N	0	3	333.501	3.383	20	30		EGEDHN
C[C@H](CN(C)C(=O)c1ccc(CF)cc1)NCc1ccc(C#N)s1	ZINC001283720218	1379141232	/nfs/dbraw/zinc/14/12/32/1379141232.db2.gz	AIYDZKZVGDOVAB-CYBMUJFWSA-N	0	3	345.443	3.340	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC2(C1)CCN(Cc1cnccc1C)C2	ZINC001148357292	1379156144	/nfs/dbraw/zinc/15/61/44/1379156144.db2.gz	HWSKDNCTVUHNQX-UHFFFAOYSA-N	0	3	327.472	3.027	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)C2(C3CCCCC3)CC2)cc1F	ZINC001149135443	1379330311	/nfs/dbraw/zinc/33/03/11/1379330311.db2.gz	ZRSSHTXOQLBJDG-UHFFFAOYSA-N	0	3	343.446	3.264	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@H]1CN(Cc2cccc(C)c2)CCCO1	ZINC001149772002	1379442805	/nfs/dbraw/zinc/44/28/05/1379442805.db2.gz	LECRGGWNSOIOLZ-IBGZPJMESA-N	0	3	344.499	3.304	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)C/C=C\c2ccc(F)cc2)C1	ZINC001149882166	1379459511	/nfs/dbraw/zinc/45/95/11/1379459511.db2.gz	YGERIKSZWAHBES-UABKOXTMSA-N	0	3	346.446	3.012	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H]1CN(Cc2ccccc2C)CCCO1	ZINC001150079283	1379491525	/nfs/dbraw/zinc/49/15/25/1379491525.db2.gz	QPNNQWPMPLYSBT-LJQANCHMSA-N	0	3	344.499	3.304	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)C2(c3ccccc3)CCCC2)c1	ZINC001150104024	1379495393	/nfs/dbraw/zinc/49/53/93/1379495393.db2.gz	HFQKQMSJELDVQR-UHFFFAOYSA-N	0	3	347.462	3.276	20	30		EGEDHN
C=CCCCC(=O)NC[C@H]1CN(Cc2ccccc2C)CCCO1	ZINC001150210268	1379516151	/nfs/dbraw/zinc/51/61/51/1379516151.db2.gz	CPCLAJAAGWWHJR-IBGZPJMESA-N	0	3	330.472	3.058	20	30		EGEDHN
C=C[C@@H](C(=O)NC[C@@H]1CN(CC=C(C)C)CCCO1)c1ccccc1	ZINC001150751536	1379606585	/nfs/dbraw/zinc/60/65/85/1379606585.db2.gz	GQINSQXXPNEVTK-WOJBJXKFSA-N	0	3	342.483	3.130	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2ccc(Cl)cc2)CC1	ZINC001151402212	1379711378	/nfs/dbraw/zinc/71/13/78/1379711378.db2.gz	BATSHFHGFXQEMT-UHFFFAOYSA-N	0	3	336.863	3.127	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)CCc2ccccc2)CC1	ZINC001151405884	1379712177	/nfs/dbraw/zinc/71/21/77/1379712177.db2.gz	MXEHZOOBOHVAAX-UHFFFAOYSA-N	0	3	344.499	3.183	20	30		EGEDHN
CCN(Cc1ccc(OC)c(C#N)c1)[C@H](C)CNC(=O)C1CCCC1	ZINC001151481854	1379725711	/nfs/dbraw/zinc/72/57/11/1379725711.db2.gz	QAIFYWYKLBTPSR-OAHLLOKOSA-N	0	3	343.471	3.084	20	30		EGEDHN
C[C@H](C(=O)NCCNCc1cccc(C#N)c1)c1cccc(Cl)c1	ZINC001151641482	1379753807	/nfs/dbraw/zinc/75/38/07/1379753807.db2.gz	OCGCCLPKYNKBAE-AWEZNQCLSA-N	0	3	341.842	3.221	20	30		EGEDHN
C=CC[C@@H](C(=O)NCCNCc1sc(C)nc1C)c1ccccc1	ZINC001151838147	1379793732	/nfs/dbraw/zinc/79/37/32/1379793732.db2.gz	KNXIGWSKBVFQRX-QGZVFWFLSA-N	0	3	343.496	3.326	20	30		EGEDHN
CC1=CC[C@](C)(C(=O)NCCNCc2ccc(F)c(C#N)c2)CC1	ZINC001151913106	1379814968	/nfs/dbraw/zinc/81/49/68/1379814968.db2.gz	DZMGGDKOUSEZHE-IBGZPJMESA-N	0	3	329.419	3.040	20	30		EGEDHN
C=C[C@@H](C(=O)NCCNCc1cc(C)ccc1OC)c1ccccc1	ZINC001152003962	1379836313	/nfs/dbraw/zinc/83/63/13/1379836313.db2.gz	YFMNAQOEXGGTCX-LJQANCHMSA-N	0	3	338.451	3.179	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)CCc1ccoc1	ZINC001152660127	1379964752	/nfs/dbraw/zinc/96/47/52/1379964752.db2.gz	ZALICIWZKUMKMI-MRXNPFEDSA-N	0	3	339.439	3.111	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)C[C@H](C)SC	ZINC001152820258	1379983325	/nfs/dbraw/zinc/98/33/25/1379983325.db2.gz	AXFQXHUTAQNGMD-CABCVRRESA-N	0	3	333.501	3.026	20	30		EGEDHN
C=CCCOCC(=O)NCCNC1c2ccccc2-c2ccccc21	ZINC001153085459	1380017721	/nfs/dbraw/zinc/01/77/21/1380017721.db2.gz	BKHFCWIKOSEAMS-UHFFFAOYSA-N	0	3	336.435	3.055	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1ccc2c3c(cccc31)CC2	ZINC001154247812	1380239858	/nfs/dbraw/zinc/23/98/58/1380239858.db2.gz	LFVSDYYBLPVWIH-MRXNPFEDSA-N	0	3	334.463	3.402	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)Cc1cc2ccccc2s1	ZINC001154298972	1380251087	/nfs/dbraw/zinc/25/10/87/1380251087.db2.gz	ZSCDLHZQFLQUOR-OAHLLOKOSA-N	0	3	328.481	3.294	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@@H](C)N(CC)Cc1ccc2nonc2c1	ZINC001154742905	1380343991	/nfs/dbraw/zinc/34/39/91/1380343991.db2.gz	OGTWAFLDJKNSGY-HUUCEWRRSA-N	0	3	344.459	3.152	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)C1(C)CC=CC1	ZINC001155005470	1380389134	/nfs/dbraw/zinc/38/91/34/1380389134.db2.gz	NRIDIRXVVQKVSA-OAHLLOKOSA-N	0	3	343.446	3.380	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)C1(CC)CC1	ZINC001155056126	1380400126	/nfs/dbraw/zinc/40/01/26/1380400126.db2.gz	KKEMGLQPNUMWBF-CQSZACIVSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@H](C)N(CC)CCOc2ccccc2F)C1	ZINC001155127055	1380413881	/nfs/dbraw/zinc/41/38/81/1380413881.db2.gz	RHWCMRLWGMWWPJ-MRXNPFEDSA-N	0	3	348.462	3.387	20	30		EGEDHN
C[C@H](N)c1nc2ccccc2n1-c1ccc(C2(C#N)CCOCC2)cn1	ZINC001155257280	1380429922	/nfs/dbraw/zinc/42/99/22/1380429922.db2.gz	FAEBSQXCDSRWEU-AWEZNQCLSA-N	0	3	347.422	3.012	20	30		EGEDHN
CCCc1cc(C#N)c(N[C@H]2CCCC[C@@]23CNCCO3)nc1Cl	ZINC001155826810	1380496170	/nfs/dbraw/zinc/49/61/70/1380496170.db2.gz	UCWGZZMYTWIMRA-MAUKXSAKSA-N	0	3	348.878	3.272	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C[C@H](C)c1ccccc1OC	ZINC001156448672	1380577290	/nfs/dbraw/zinc/57/72/90/1380577290.db2.gz	KDHJTOIZJDRMDR-DLBZAZTESA-N	0	3	330.472	3.039	20	30		EGEDHN
N#Cc1ccc([N+](=O)[O-])c(NC[C@H](c2ccccc2)N2CCCC2)n1	ZINC001156532587	1380589420	/nfs/dbraw/zinc/58/94/20/1380589420.db2.gz	XWWWPLIUBWRQDW-QGZVFWFLSA-N	0	3	337.383	3.110	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)C(=O)NC[C@@H](C)N(CC)CC#CC	ZINC001157063117	1380765787	/nfs/dbraw/zinc/76/57/87/1380765787.db2.gz	PWHLHWNBQMEYLS-QUCCMNQESA-N	0	3	326.484	3.271	20	30		EGEDHN
CN1CCC[C@@H]2CN(c3nc4ccccc4c(Cl)c3C#N)C[C@H]21	ZINC001157271875	1380829179	/nfs/dbraw/zinc/82/91/79/1380829179.db2.gz	KJVXFUDVHGWMHU-MLGOLLRUSA-N	0	3	326.831	3.290	20	30		EGEDHN
N#Cc1cc(Cl)c(Cl)nc1N1CCN[C@H](c2ccccc2)C1	ZINC001157758632	1381024396	/nfs/dbraw/zinc/02/43/96/1381024396.db2.gz	AFNHMRCQAYDWMT-AWEZNQCLSA-N	0	3	333.222	3.411	20	30		EGEDHN
COc1ccc(CN(C)C[C@H]2CCCCN2C(=O)C#CC(C)C)cc1	ZINC001157939794	1381076625	/nfs/dbraw/zinc/07/66/25/1381076625.db2.gz	MNDZBEKLJURXCA-LJQANCHMSA-N	0	3	342.483	3.168	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc(Cl)c(Cl)n1C	ZINC001158044170	1381110208	/nfs/dbraw/zinc/11/02/08/1381110208.db2.gz	RBCDUODOEKXLMQ-GFCCVEGCSA-N	0	3	344.286	3.444	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)Cn1c(C)cc2ccccc21	ZINC001158195071	1381155565	/nfs/dbraw/zinc/15/55/65/1381155565.db2.gz	PQGFJLIWKVBYGE-LJQANCHMSA-N	0	3	339.483	3.449	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)C1CCC(=C)CC1	ZINC001158434414	1381244085	/nfs/dbraw/zinc/24/40/85/1381244085.db2.gz	KPYCEYYHYYSQNJ-LJQANCHMSA-N	0	3	334.504	3.248	20	30		EGEDHN
CCN1CCN(c2ccc([C@H](C#N)c3ccc(C)cc3)nn2)C(C)(C)C1	ZINC001158561782	1381301208	/nfs/dbraw/zinc/30/12/08/1381301208.db2.gz	WCAXSXKNHKPOIJ-GOSISDBHSA-N	0	3	349.482	3.361	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc(CCCCC)n[nH]1	ZINC001158597429	1381312660	/nfs/dbraw/zinc/31/26/60/1381312660.db2.gz	BXBZRAKNXIZQBR-QGZVFWFLSA-N	0	3	332.492	3.255	20	30		EGEDHN
C=C(Cl)CN(C)C[C@H]1CCCCN1C(=O)c1cccc2[nH]cnc21	ZINC001158654311	1381337980	/nfs/dbraw/zinc/33/79/80/1381337980.db2.gz	TWZUOPBAVIDTDD-CQSZACIVSA-N	0	3	346.862	3.242	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccnc(C2CCCC2)n1	ZINC001158704538	1381360051	/nfs/dbraw/zinc/36/00/51/1381360051.db2.gz	OXFYOOLLQUNCLW-QGZVFWFLSA-N	0	3	342.487	3.247	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)C[C@H](C)c1ccco1	ZINC001158750552	1381383216	/nfs/dbraw/zinc/38/32/16/1381383216.db2.gz	MLHKAQUKSOLGHS-ZWKOTPCHSA-N	0	3	348.487	3.289	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc(COC)c(F)c1	ZINC001158794029	1381401802	/nfs/dbraw/zinc/40/18/02/1381401802.db2.gz	DQUYPOCTITZUIX-QGZVFWFLSA-N	0	3	334.435	3.085	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)Cc1cccc(OCC)c1	ZINC001158927875	1381469548	/nfs/dbraw/zinc/46/95/48/1381469548.db2.gz	GRYYYVTUDBMUCB-GOSISDBHSA-N	0	3	330.472	3.127	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H](OC)c1ccc(F)cc1	ZINC001158942510	1381474417	/nfs/dbraw/zinc/47/44/17/1381474417.db2.gz	KAWSUTIUQREPSJ-MSOLQXFVSA-N	0	3	334.435	3.012	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCC1=CCN([C@@H](C)c2ccc(F)cc2)CC1	ZINC001159594384	1381840430	/nfs/dbraw/zinc/84/04/30/1381840430.db2.gz	PWJXXKGYVLGAHM-GJZGRUSLSA-N	0	3	329.419	3.185	20	30		EGEDHN
C[C@H](N)c1ncc(-c2ccccc2)n1-c1[nH]ccc2ncc(C#N)c1-2	ZINC001159594265	1381841071	/nfs/dbraw/zinc/84/10/71/1381841071.db2.gz	CANKCCJZLZOJDE-LBPRGKRZSA-N	0	3	328.379	3.307	20	30		EGEDHN
Cc1cc(C(=O)NCCC2=CCN(Cc3ccc(C#N)cc3)CC2)co1	ZINC001159928635	1381940569	/nfs/dbraw/zinc/94/05/69/1381940569.db2.gz	SCQXJNLQPAIHNY-UHFFFAOYSA-N	0	3	349.434	3.412	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)CC(C)(C)c1ccc(F)cc1	ZINC001159981937	1381958597	/nfs/dbraw/zinc/95/85/97/1381958597.db2.gz	SRHYPEPMEBYSPW-UHFFFAOYSA-N	0	3	326.843	3.342	20	30		EGEDHN
Cc1nc(C)c(CN2CC=C(CCNC(=O)C#CC(C)C)CC2)s1	ZINC001160055284	1381983236	/nfs/dbraw/zinc/98/32/36/1381983236.db2.gz	XQBKJWFFHFIUIB-UHFFFAOYSA-N	0	3	345.512	3.058	20	30		EGEDHN
Cc1ccc(C#N)cc1C(=O)N[C@@H](CN1CCCC1)c1ccccc1	ZINC001290115979	1382061667	/nfs/dbraw/zinc/06/16/67/1382061667.db2.gz	LPEZUYJWBXLDCW-FQEVSTJZSA-N	0	3	333.435	3.434	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cnc3c(F)cccc3c2)CC1	ZINC001160677055	1382168064	/nfs/dbraw/zinc/16/80/64/1382168064.db2.gz	ONPMGLZKHOVEKG-UHFFFAOYSA-N	0	3	339.414	3.312	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@H]2CCCC[C@H]2C2CC2)CC1	ZINC001160778041	1382193069	/nfs/dbraw/zinc/19/30/69/1382193069.db2.gz	DBSFACIIEOXHNQ-PMACEKPBSA-N	0	3	328.500	3.365	20	30		EGEDHN
CC#CCCCC(=O)NCCC1=CCN(CCc2ccns2)CC1	ZINC001160954294	1382250512	/nfs/dbraw/zinc/25/05/12/1382250512.db2.gz	PGTQGZCJBLMOCY-UHFFFAOYSA-N	0	3	345.512	3.018	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccccc2-n2cccc2)CC1	ZINC001161084892	1382294309	/nfs/dbraw/zinc/29/43/09/1382294309.db2.gz	VASHAJQKVDVXBR-UHFFFAOYSA-N	0	3	335.451	3.415	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc(Cl)c(F)c2)CC1	ZINC001161336163	1382373690	/nfs/dbraw/zinc/37/36/90/1382373690.db2.gz	MTXBKTODIZNODW-UHFFFAOYSA-N	0	3	334.822	3.254	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cccnc2C(F)(F)F)CC1	ZINC001161349806	1382378588	/nfs/dbraw/zinc/37/85/88/1382378588.db2.gz	UOGQUEVHUHEILK-UHFFFAOYSA-N	0	3	339.361	3.038	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C[C@H](C)c2ccccc2F)CC1	ZINC001161497005	1382423834	/nfs/dbraw/zinc/42/38/34/1382423834.db2.gz	NYPHYXCNZNWGRG-KRWDZBQOSA-N	0	3	342.458	3.481	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc3nc(C)ccc3c2)CC1	ZINC001161524019	1382429798	/nfs/dbraw/zinc/42/97/98/1382429798.db2.gz	DJFNGDRATIOKNS-UHFFFAOYSA-N	0	3	347.462	3.319	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cccc(-c3cnco3)c2)CC1	ZINC001161623071	1382463183	/nfs/dbraw/zinc/46/31/83/1382463183.db2.gz	ZYMSDRRAVSKZFV-UHFFFAOYSA-N	0	3	337.423	3.280	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc(-c3c[nH]cn3)cc2)CC1	ZINC001161640031	1382467170	/nfs/dbraw/zinc/46/71/70/1382467170.db2.gz	PNSYFDKZPRZPHB-UHFFFAOYSA-N	0	3	336.439	3.015	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cnn(CCC(C)C)c2C)CC1	ZINC001161683054	1382480007	/nfs/dbraw/zinc/48/00/07/1382480007.db2.gz	KIFGMNIQDJVCCP-UHFFFAOYSA-N	0	3	344.503	3.176	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H](C)c2ccc(C)s2)CC1	ZINC001161699270	1382483955	/nfs/dbraw/zinc/48/39/55/1382483955.db2.gz	QLCMJTKABZHVCL-INIZCTEOSA-N	0	3	330.497	3.322	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H](C)OCc2ccc(F)cc2)CC1	ZINC001161801422	1382510607	/nfs/dbraw/zinc/51/06/07/1382510607.db2.gz	IXTQJGKWAJYJJC-INIZCTEOSA-N	0	3	346.446	3.055	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc(C)nc3ccccc32)CC1	ZINC001161818180	1382518255	/nfs/dbraw/zinc/51/82/55/1382518255.db2.gz	QJICPSPALQRSNA-UHFFFAOYSA-N	0	3	335.451	3.481	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CCc2c[nH]c3ccccc23)CC1	ZINC001161818107	1382518554	/nfs/dbraw/zinc/51/85/54/1382518554.db2.gz	MWUVZYSCNKOHDN-UHFFFAOYSA-N	0	3	337.467	3.425	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)COc2cccc(Cl)c2)CC1	ZINC001161834692	1382524992	/nfs/dbraw/zinc/52/49/92/1382524992.db2.gz	RAJVOOALSCJSRG-UHFFFAOYSA-N	0	3	334.847	3.043	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CCc2nc3ccccc3o2)CC1	ZINC001161853489	1382530580	/nfs/dbraw/zinc/53/05/80/1382530580.db2.gz	RLFIVHDUVQZPOS-UHFFFAOYSA-N	0	3	339.439	3.085	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H](C)Cc2ccc(C)cc2)CC1	ZINC001161963458	1382573888	/nfs/dbraw/zinc/57/38/88/1382573888.db2.gz	GWUULOCIKPRFAW-SFHVURJKSA-N	0	3	326.484	3.498	20	30		EGEDHN
Cc1oc(C)c(C(=O)NCCCNCc2ccc(C#N)cc2F)c1C	ZINC001162104031	1382630042	/nfs/dbraw/zinc/63/00/42/1382630042.db2.gz	UPESVUXWBRLSNK-UHFFFAOYSA-N	0	3	343.402	3.125	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)CC2(C)CCCCC2)(COC)CC1	ZINC001162350994	1382738274	/nfs/dbraw/zinc/73/82/74/1382738274.db2.gz	JOVMMPOMVASTSU-UHFFFAOYSA-N	0	3	348.531	3.215	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)CC2CCCCCC2)(COC)CC1	ZINC001162512805	1382777408	/nfs/dbraw/zinc/77/74/08/1382777408.db2.gz	FKBQYCVVSPHJIH-UHFFFAOYSA-N	0	3	348.531	3.215	20	30		EGEDHN
CC[C@@H](F)CNCCN(CCc1ccccc1)C(=O)C#CC(C)(C)C	ZINC001162806704	1382879168	/nfs/dbraw/zinc/87/91/68/1382879168.db2.gz	JPWWLBDSXXZGLV-LJQANCHMSA-N	0	3	346.490	3.445	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1cccc(C)c1F	ZINC001162817241	1382884771	/nfs/dbraw/zinc/88/47/71/1382884771.db2.gz	QZVUMKPEZOJZGQ-UHFFFAOYSA-N	0	3	338.426	3.042	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)c1cc2occc2[nH]1	ZINC001162822572	1382886652	/nfs/dbraw/zinc/88/66/52/1382886652.db2.gz	SEXKJRCCLZUPSH-UHFFFAOYSA-N	0	3	349.434	3.059	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CCC[C@@H]1CCC	ZINC001162850712	1382894609	/nfs/dbraw/zinc/89/46/09/1382894609.db2.gz	PRFLPQPCNICEMP-SFTDATJTSA-N	0	3	340.511	3.497	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)N(CCNCC#CC)CCc1ccccc1	ZINC001162892045	1382906917	/nfs/dbraw/zinc/90/69/17/1382906917.db2.gz	FIAJZQMEDMUTTJ-RBUKOAKNSA-N	0	3	326.484	3.129	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CCCC1(C)C	ZINC001162892973	1382907641	/nfs/dbraw/zinc/90/76/41/1382907641.db2.gz	ZGDVOLKAFFNYCA-HXUWFJFHSA-N	0	3	340.511	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@](C)(CC)CCC	ZINC001162964620	1382929923	/nfs/dbraw/zinc/92/99/23/1382929923.db2.gz	ZTYOPGKZZCOKNI-OAQYLSRUSA-N	0	3	328.500	3.497	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C1(F)CCCCC1	ZINC001162977182	1382935184	/nfs/dbraw/zinc/93/51/84/1382935184.db2.gz	JFYBYACLVCBESD-UHFFFAOYSA-N	0	3	344.474	3.343	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)CCc1ccccc1	ZINC001162992438	1382940169	/nfs/dbraw/zinc/94/01/69/1382940169.db2.gz	ORYUBKFXBPVVEX-UHFFFAOYSA-N	0	3	348.490	3.303	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1sccc1CC	ZINC001163001554	1382943433	/nfs/dbraw/zinc/94/34/33/1382943433.db2.gz	JHPJVKLJBPALLG-UHFFFAOYSA-N	0	3	340.492	3.218	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C1C[C@H](C)C[C@@H](C)C1	ZINC001163006998	1382946753	/nfs/dbraw/zinc/94/67/53/1382946753.db2.gz	MFJYRIDKAKPIJX-RTBURBONSA-N	0	3	340.511	3.353	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C[C@@H]1CCCC[C@@H]1C	ZINC001163007734	1382947273	/nfs/dbraw/zinc/94/72/73/1382947273.db2.gz	XZIUIIKJDIQLKI-FPOVZHCZSA-N	0	3	340.511	3.497	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCc1ccc(CN2CCN(CC)CC2)cc1	ZINC001163024232	1382949890	/nfs/dbraw/zinc/94/98/90/1382949890.db2.gz	FQUAJAGLKDZZCU-SFHVURJKSA-N	0	3	343.515	3.043	20	30		EGEDHN
C=CC(C)(C)C(=O)NCc1ccc(CN2CCN(CCC)CC2)cc1	ZINC001163024048	1382950558	/nfs/dbraw/zinc/95/05/58/1382950558.db2.gz	BACWPVMGRCYMAZ-UHFFFAOYSA-N	0	3	343.515	3.043	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)NCCC1(CNCC#Cc2cccc(Cl)c2)CC1	ZINC001163235299	1383001897	/nfs/dbraw/zinc/00/18/97/1383001897.db2.gz	HNOPXXYQSYUVSN-CRAIPNDOSA-N	0	3	344.886	3.224	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCCNCC(=O)Nc1ccc(C(C)C)cc1	ZINC001163952865	1383139094	/nfs/dbraw/zinc/13/90/94/1383139094.db2.gz	BUSKJDRPZUSKLH-UHFFFAOYSA-N	0	3	345.487	3.057	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCCNCc1cnc(-c2ccccc2)o1	ZINC001164223881	1383167946	/nfs/dbraw/zinc/16/79/46/1383167946.db2.gz	XFUAISUQZSUESN-HZPDHXFCSA-N	0	3	341.455	3.396	20	30		EGEDHN
N#Cc1cnc(N2C[C@H]3[C@@H](CCN3Cc3ccccc3)C2)c(Cl)c1	ZINC001165082058	1383224312	/nfs/dbraw/zinc/22/43/12/1383224312.db2.gz	ANTONCCNERKNST-WMZOPIPTSA-N	0	3	338.842	3.317	20	30		EGEDHN
CCc1ccccc1C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001165328627	1383274275	/nfs/dbraw/zinc/27/42/75/1383274275.db2.gz	UAACOXCLCKDMTC-UHFFFAOYSA-N	0	3	339.414	3.169	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cc3c(o2)CCCC3)CC1	ZINC001165422108	1383292628	/nfs/dbraw/zinc/29/26/28/1383292628.db2.gz	QVNIXHARMQQZFZ-UHFFFAOYSA-N	0	3	336.863	3.401	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C[C@@H]2CCC[C@@H](OC)C2)CC1	ZINC001165440523	1383296984	/nfs/dbraw/zinc/29/69/84/1383296984.db2.gz	ILXBUZVKSQTZLZ-HZPDHXFCSA-N	0	3	342.911	3.210	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@@H]2CCC[C@@H]2C(F)F)CC1	ZINC001165465084	1383299064	/nfs/dbraw/zinc/29/90/64/1383299064.db2.gz	SKPDWQMTAKHQEP-QWHCGFSZSA-N	0	3	334.838	3.296	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1ccc(Cl)c(C)c1	ZINC001165721673	1383332637	/nfs/dbraw/zinc/33/26/37/1383332637.db2.gz	NCYLJGCDHLGDII-UHFFFAOYSA-N	0	3	345.668	3.267	20	30		EGEDHN
CCCCC1(C(=O)NCCCNCc2cc(C#N)ccc2F)CC1	ZINC001165895225	1383358873	/nfs/dbraw/zinc/35/88/73/1383358873.db2.gz	JBEZKDRGJZZXDQ-UHFFFAOYSA-N	0	3	331.435	3.264	20	30		EGEDHN
C[C@@H]1CCC[C@@]1(C)C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001166053460	1383383160	/nfs/dbraw/zinc/38/31/60/1383383160.db2.gz	DDEDVLAXFOQEPC-AUUYWEPGSA-N	0	3	331.435	3.120	20	30		EGEDHN
CC(C)N(CC1CC1)c1nccnc1C(C#N)C(=O)OC(C)(C)C	ZINC001166620156	1383448068	/nfs/dbraw/zinc/44/80/68/1383448068.db2.gz	PCLFXZYYBIHVTC-CQSZACIVSA-N	0	3	330.432	3.050	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCC1(CNCC(=C)Br)CC1	ZINC001166693683	1383461783	/nfs/dbraw/zinc/46/17/83/1383461783.db2.gz	JEQQUARGYXBQGH-JSGCOSHPSA-N	0	3	343.309	3.229	20	30		EGEDHN
C=CCCCC(=O)NCCC1(CNCc2ccncc2Cl)CC1	ZINC001166910252	1383498631	/nfs/dbraw/zinc/49/86/31/1383498631.db2.gz	OVSMGGFBCMVEJR-UHFFFAOYSA-N	0	3	335.879	3.467	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)Cc2cc(C)ccc2C)CC1	ZINC001166987412	1383510032	/nfs/dbraw/zinc/51/00/32/1383510032.db2.gz	SRVDOGCAAJTSFU-UHFFFAOYSA-N	0	3	334.891	3.475	20	30		EGEDHN
C=C1CCC(C(=O)NCCC2(CNCc3conc3CC)CC2)CC1	ZINC001167011309	1383517097	/nfs/dbraw/zinc/51/70/97/1383517097.db2.gz	DKWBVMVCLRAUPT-UHFFFAOYSA-N	0	3	345.487	3.360	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCC1(CNCc2conc2CC)CC1	ZINC001167019307	1383520919	/nfs/dbraw/zinc/52/09/19/1383520919.db2.gz	ZKUNUOACFKNZPU-GOSISDBHSA-N	0	3	333.476	3.215	20	30		EGEDHN
Cc1ccccc1CCC(=O)NCCCNCc1ccccc1C#N	ZINC001167292109	1383586022	/nfs/dbraw/zinc/58/60/22/1383586022.db2.gz	BZTKVMQSPMNAAU-UHFFFAOYSA-N	0	3	335.451	3.095	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)[C@H](C)[C@H](C)CC)CC1	ZINC001167557061	1383667507	/nfs/dbraw/zinc/66/75/07/1383667507.db2.gz	PGJLTWDPIGBHPL-TZMCWYRMSA-N	0	3	345.325	3.453	20	30		EGEDHN
C=C(Cl)Cn1c(C(C)C)nnc1N1CCN(C(C)(C)C)CC1	ZINC001301018165	1383690458	/nfs/dbraw/zinc/69/04/58/1383690458.db2.gz	WDPCDJISKGZYCP-UHFFFAOYSA-N	0	3	325.888	3.075	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)CCCc2ccccn2)CC1	ZINC001167819945	1383747628	/nfs/dbraw/zinc/74/76/28/1383747628.db2.gz	CXFRCSMDZIZZNZ-UHFFFAOYSA-N	0	3	335.879	3.033	20	30		EGEDHN
C[Si](C)(C)C#Cc1ccc(N(C(=N)N)c2ccc(F)cc2)cn1	ZINC001167994892	1383791323	/nfs/dbraw/zinc/79/13/23/1383791323.db2.gz	RMRGBDNNXBQOFX-UHFFFAOYSA-N	0	3	326.451	3.481	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)COc2ccc(C)cc2)CC1	ZINC001167997089	1383793506	/nfs/dbraw/zinc/79/35/06/1383793506.db2.gz	VSHVPROJKYVMMX-UHFFFAOYSA-N	0	3	336.863	3.002	20	30		EGEDHN
C[C@@H](C(=O)NCCCNCc1ccccc1C#N)c1ccccc1F	ZINC001168700145	1383972317	/nfs/dbraw/zinc/97/23/17/1383972317.db2.gz	FVVQEFZNEJZBJA-OAHLLOKOSA-N	0	3	339.414	3.097	20	30		EGEDHN
C[C@H](CCCCNCc1cc(F)ccc1C#N)NC(=O)CC1CC1	ZINC001168739608	1383987120	/nfs/dbraw/zinc/98/71/20/1383987120.db2.gz	QDMBODXCTHIIFX-CQSZACIVSA-N	0	3	331.435	3.262	20	30		EGEDHN
C[C@H](CCCCNCc1cc(F)ccc1C#N)NC(=O)c1ccoc1	ZINC001169166250	1384118446	/nfs/dbraw/zinc/11/84/46/1384118446.db2.gz	METKEETZKZHEAM-CQSZACIVSA-N	0	3	343.402	3.369	20	30		EGEDHN
Cc1oc(C(C)C)cc1C(=O)NCCCNCc1ccccc1C#N	ZINC001169931490	1384199985	/nfs/dbraw/zinc/19/99/85/1384199985.db2.gz	RNURGHVPWBWDBY-UHFFFAOYSA-N	0	3	339.439	3.493	20	30		EGEDHN
C#CCCCC(=O)N[C@H](C)CCCCNCc1ccn(C(C)C)n1	ZINC001170453133	1384322807	/nfs/dbraw/zinc/32/28/07/1384322807.db2.gz	IMODFLRDOQNZBA-QGZVFWFLSA-N	0	3	332.492	3.032	20	30		EGEDHN
COc1ccc(-n2c(-c3ccccc3)cnc2[C@H](C)N)nc1CC#N	ZINC001170681660	1384364113	/nfs/dbraw/zinc/36/41/13/1384364113.db2.gz	TXPYFRYDKMJKDK-ZDUSSCGKSA-N	0	3	333.395	3.029	20	30		EGEDHN
COC[C@@H](NC[C@@H](O)c1cccc(C#N)c1)c1cccc(Cl)c1	ZINC001170864519	1384400907	/nfs/dbraw/zinc/40/09/07/1384400907.db2.gz	YFNQGNQAWDOZND-QZTJIDSGSA-N	0	3	330.815	3.222	20	30		EGEDHN
C=CCC[C@H](C)[NH2+]CCCC[C@H](C)NC(=O)c1cccc2n[n-]nc21	ZINC001170963735	1384419205	/nfs/dbraw/zinc/41/92/05/1384419205.db2.gz	SRKCUKJTBPTFBH-GJZGRUSLSA-N	0	3	343.475	3.191	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H](C)CCCCN[C@H](C)c1nnc(C)[nH]1	ZINC001170963530	1384419266	/nfs/dbraw/zinc/41/92/66/1384419266.db2.gz	QCDQORHPZMCBAB-HUUCEWRRSA-N	0	3	347.507	3.207	20	30		EGEDHN
C=CCOC(=O)[C@@H](N)CCCCNc1cc(C)c2ccc(C)cc2n1	ZINC001171067493	1384440603	/nfs/dbraw/zinc/44/06/03/1384440603.db2.gz	HJRDZIREURZIPW-KRWDZBQOSA-N	0	3	341.455	3.490	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@@H](C)CCC(C)(C)C	ZINC001171152420	1384455986	/nfs/dbraw/zinc/45/59/86/1384455986.db2.gz	CXWAXGCAYALLTP-LBPRGKRZSA-N	0	3	333.314	3.453	20	30		EGEDHN
C=CCOc1ccccc1[C@@H](C)Nc1nncc2c1OCCN2C	ZINC001171373254	1384504528	/nfs/dbraw/zinc/50/45/28/1384504528.db2.gz	QZSDDQAIUWSAOV-CYBMUJFWSA-N	0	3	326.400	3.043	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)c2ccccc2Cl)c1	ZINC001171813391	1384648055	/nfs/dbraw/zinc/64/80/55/1384648055.db2.gz	MTKSQWCTASJVSB-UHFFFAOYSA-N	0	3	345.805	3.260	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CCCN(CC/C=C\CCC)C2)c1	ZINC001316946336	1384719115	/nfs/dbraw/zinc/71/91/15/1384719115.db2.gz	ANEMURTVARTICM-RURPWVQCSA-N	0	3	325.456	3.004	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)n1nc(C(F)(F)F)c2c1CNCC2	ZINC001172310982	1384766355	/nfs/dbraw/zinc/76/63/55/1384766355.db2.gz	MVAQXWMBNSFUPZ-LLVKDONJSA-N	0	3	334.345	3.223	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)N1CC[C@@H](C)[C@](O)(C(F)(F)F)C1	ZINC001172316299	1384768168	/nfs/dbraw/zinc/76/81/68/1384768168.db2.gz	RLFAAMMDDLLTNO-IOASZLSFSA-N	0	3	326.362	3.124	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)N1CC(CN(C)C(=O)OC(C)(C)C)C1	ZINC001172315046	1384768231	/nfs/dbraw/zinc/76/82/31/1384768231.db2.gz	NENAKQVVOUTXOP-OAHLLOKOSA-N	0	3	343.471	3.288	20	30		EGEDHN
CCCCCCC[C@H](CC)N1CCN(CC(=O)NC(C)C)CC1	ZINC001172353628	1384776609	/nfs/dbraw/zinc/77/66/09/1384776609.db2.gz	ADDKNSMEKABSKJ-SFHVURJKSA-N	0	3	325.541	3.268	20	30		EGEDHN
C=CCOC[C@@H]1CCC[C@@]12CN([C@@H](C)CCOC(C)C)CCO2	ZINC001172452833	1384795534	/nfs/dbraw/zinc/79/55/34/1384795534.db2.gz	VNMPUICUPMGXOO-GBESFXJTSA-N	0	3	325.493	3.264	20	30		EGEDHN
C[C@H](CCCC#N)NCC(=O)c1ccc(Br)c(F)c1	ZINC001172483094	1384803074	/nfs/dbraw/zinc/80/30/74/1384803074.db2.gz	NFSVJJPPTXYTMC-SNVBAGLBSA-N	0	3	327.197	3.443	20	30		EGEDHN
C[C@@H](CCCC#N)N1CCC(n2c3ccccc3n(C)c2=O)CC1	ZINC001172507231	1384807730	/nfs/dbraw/zinc/80/77/30/1384807730.db2.gz	QWWCMTMXVLGHSA-HNNXBMFYSA-N	0	3	326.444	3.059	20	30		EGEDHN
COc1ccc(CN[C@H]2CCN(C(=O)OC(C)(C)C)[C@H](C#N)C2)cc1	ZINC001172971274	1384892857	/nfs/dbraw/zinc/89/28/57/1384892857.db2.gz	NVSHVOGXSPEQFL-HOTGVXAUSA-N	0	3	345.443	3.076	20	30		EGEDHN
CN(Cc1ccccc1)[C@H]1CCN(C(=O)OC(C)(C)C)[C@H](C#N)C1	ZINC001172977707	1384894740	/nfs/dbraw/zinc/89/47/40/1384894740.db2.gz	DXPKNRWECXOJPM-IRXDYDNUSA-N	0	3	329.444	3.410	20	30		EGEDHN
C=CCOC[C@@H]1CCC[C@@]12CN([C@@H]1CCc3ncsc3C1)CCO2	ZINC001173137138	1384921484	/nfs/dbraw/zinc/92/14/84/1384921484.db2.gz	JDCSHBCLGILLJK-FRQCXROJSA-N	0	3	348.512	3.074	20	30		EGEDHN
C[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=N)c1ccc2ccccc2n1	ZINC001173219319	1384938258	/nfs/dbraw/zinc/93/82/58/1384938258.db2.gz	NAZNZSGWOJDLJY-CYBMUJFWSA-N	0	3	334.379	3.480	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](C)CCCCN[C@@H](C)c1nnc(CC)[nH]1	ZINC001174672845	1385132416	/nfs/dbraw/zinc/13/24/16/1385132416.db2.gz	RDDFTDYQRBRIST-GJZGRUSLSA-N	0	3	349.523	3.295	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@H](C)CCCCNCc1cc(OC)no1	ZINC001174848798	1385159269	/nfs/dbraw/zinc/15/92/69/1385159269.db2.gz	IESUUWNMJXEKTQ-HUUCEWRRSA-N	0	3	337.464	3.050	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@H](C)CCCCNCc1nnc(C(C)C)[nH]1	ZINC001174848634	1385159361	/nfs/dbraw/zinc/15/93/61/1385159361.db2.gz	FJBNJOBGIANULE-CVEARBPZSA-N	0	3	349.523	3.295	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](C)CCCCN[C@H](C)c2nnc(C)[nH]2)CC1	ZINC001175073826	1385189657	/nfs/dbraw/zinc/18/96/57/1385189657.db2.gz	ITYPANTVUOHFCL-HUUCEWRRSA-N	0	3	347.507	3.185	20	30		EGEDHN
C[C@H](CCCCNCc1cc(F)ccc1C#N)NC(=O)C1(CF)CC1	ZINC001175189676	1385215395	/nfs/dbraw/zinc/21/53/95/1385215395.db2.gz	HCVTXVHOKZRSLH-CQSZACIVSA-N	0	3	349.425	3.212	20	30		EGEDHN
Cc1ccoc1C(=O)NCC[C@@H]1CCN(Cc2ccccc2C#N)C1	ZINC001317776094	1385470558	/nfs/dbraw/zinc/47/05/58/1385470558.db2.gz	XYMPOIMLRGSJIJ-MRXNPFEDSA-N	0	3	337.423	3.102	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1CCCN(CCc2scnc2C)C1	ZINC001317970659	1385593147	/nfs/dbraw/zinc/59/31/47/1385593147.db2.gz	HJRVTYCYZYTCAW-HNNXBMFYSA-N	0	3	335.517	3.177	20	30		EGEDHN
C=CC[C@@H](C(=O)NCCCNCc1ccc(F)cn1)c1ccccc1	ZINC001176698630	1385662876	/nfs/dbraw/zinc/66/28/76/1385662876.db2.gz	UTRQTVROLNOZIB-LJQANCHMSA-N	0	3	341.430	3.177	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)C23CCC(CC2)CC3)c1	ZINC001176706554	1385665919	/nfs/dbraw/zinc/66/59/19/1385665919.db2.gz	HVTKUIAIDVXOCG-UHFFFAOYSA-N	0	3	343.446	3.264	20	30		EGEDHN
C=CCC1(C(=O)NCCCNCc2conc2CC)CCCCC1	ZINC001176785946	1385697307	/nfs/dbraw/zinc/69/73/07/1385697307.db2.gz	RPVMGRCIMRZSOR-UHFFFAOYSA-N	0	3	333.476	3.360	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)[C@H]2CC3CCC2CC3)c(F)c1	ZINC001177073956	1385796263	/nfs/dbraw/zinc/79/62/63/1385796263.db2.gz	ISCFCILISYEJDD-PVARCSIZSA-N	0	3	343.446	3.120	20	30		EGEDHN
CC[C@H](CNC(=O)[C@H](C)c1ccccc1)NCc1ccc(C#N)s1	ZINC001698618799	1406254399	/nfs/dbraw/zinc/25/43/99/1406254399.db2.gz	LCFUKEUTSAZXQX-GDBMZVCRSA-N	0	3	341.480	3.408	20	30		EGEDHN
C=CCCC(=O)N(CCCNCc1cc(C)n(C)n1)CC1CCCC1	ZINC001177246087	1385882672	/nfs/dbraw/zinc/88/26/72/1385882672.db2.gz	XCOKQBMJQXRNAI-UHFFFAOYSA-N	0	3	346.519	3.193	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)c1cnco1	ZINC001177375968	1385934904	/nfs/dbraw/zinc/93/49/04/1385934904.db2.gz	TXAJNLZEBCODNZ-UHFFFAOYSA-N	0	3	325.840	3.039	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)[C@H](C)Cc1cccc(Cl)c1	ZINC001177535705	1385989438	/nfs/dbraw/zinc/98/94/38/1385989438.db2.gz	QTTUFVGFLURSRQ-GFCCVEGCSA-N	0	3	329.271	3.367	20	30		EGEDHN
C=CCC1(C(=O)NCCCN[C@@H](C)c2cnc(C)cn2)CCCC1	ZINC001177548097	1385993034	/nfs/dbraw/zinc/99/30/34/1385993034.db2.gz	PIOFSTJDTJZHPF-INIZCTEOSA-N	0	3	330.476	3.078	20	30		EGEDHN
CC[C@@H](CNC(=O)CCc1cccs1)NCc1ccc(C#N)s1	ZINC001698624886	1406265633	/nfs/dbraw/zinc/26/56/33/1406265633.db2.gz	HZSMFIKYCIGHIE-ZDUSSCGKSA-N	0	3	347.509	3.298	20	30		EGEDHN
N#Cc1ccccc1CNCCCCCCNC(=O)c1ccccn1	ZINC001177754040	1386034231	/nfs/dbraw/zinc/03/42/31/1386034231.db2.gz	BVNBZBVJPDFKJC-UHFFFAOYSA-N	0	3	336.439	3.033	20	30		EGEDHN
C[C@@H](CNCc1ccccc1C#N)CNC(=O)[C@@H](C)Cc1ccccc1	ZINC001319281391	1386040109	/nfs/dbraw/zinc/04/01/09/1386040109.db2.gz	JVIONRUCKOQBSB-ROUUACIJSA-N	0	3	349.478	3.279	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccc(F)cc2)CCN1C(=O)C[C@@H]1C=CCC1	ZINC001178086633	1386125753	/nfs/dbraw/zinc/12/57/53/1386125753.db2.gz	YSTSCAPQYYARLM-HQRMLTQVSA-N	0	3	340.442	3.113	20	30		EGEDHN
N#Cc1ccc(F)cc1CNCCCCCCNC(=O)C1CC=CC1	ZINC001178089256	1386126748	/nfs/dbraw/zinc/12/67/48/1386126748.db2.gz	KUQYKAJJYYUJSM-UHFFFAOYSA-N	0	3	343.446	3.430	20	30		EGEDHN
CS[C@@H](C)CC(=O)NCCCCCCNCc1ccccc1C#N	ZINC001178240916	1386169892	/nfs/dbraw/zinc/16/98/92/1386169892.db2.gz	WBPFXITVSXEBLZ-INIZCTEOSA-N	0	3	347.528	3.466	20	30		EGEDHN
CO[C@H](C)CCC(=O)NCCCCCCNCc1ccccc1C#N	ZINC001178270886	1386177736	/nfs/dbraw/zinc/17/77/36/1386177736.db2.gz	UCBDNRYWJMQEJU-QGZVFWFLSA-N	0	3	345.487	3.140	20	30		EGEDHN
CC(C)[C@H](C)CC(=O)N1CC[C@H](NCc2ccc(C#N)s2)[C@@H]1C	ZINC001178311390	1386185538	/nfs/dbraw/zinc/18/55/38/1386185538.db2.gz	BDGIAIXTPUULNA-KEYYUXOJSA-N	0	3	333.501	3.381	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2Cl)CCN1C(=O)CCC1CC1	ZINC001178391771	1386205189	/nfs/dbraw/zinc/20/51/89/1386205189.db2.gz	QMZXVYKTYFRBKZ-KXBFYZLASA-N	0	3	344.886	3.461	20	30		EGEDHN
C=C(C)CCC(=O)NCCCCCCNCc1nnc(C)n1C1CC1	ZINC001178596173	1386258492	/nfs/dbraw/zinc/25/84/92/1386258492.db2.gz	HGKVDBXCRJUNSG-UHFFFAOYSA-N	0	3	347.507	3.044	20	30		EGEDHN
CC(C)[C@H](CNC(=O)C1CC2(CC2)C1)NCc1cc(C#N)ccc1F	ZINC001319944410	1386407729	/nfs/dbraw/zinc/40/77/29/1386407729.db2.gz	PQWUZVPZAROIHV-SFHVURJKSA-N	0	3	343.446	3.118	20	30		EGEDHN
CCC[C@@H](OC)C(=O)NCCCCCCNCc1ccccc1C#N	ZINC001179220189	1386425933	/nfs/dbraw/zinc/42/59/33/1386425933.db2.gz	QVBISRCOXUOBPS-LJQANCHMSA-N	0	3	345.487	3.140	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)C[C@H]1CC=CCC1	ZINC001179322618	1386451570	/nfs/dbraw/zinc/45/15/70/1386451570.db2.gz	RXPHJHLZWKHKTN-JBACZVJFSA-N	0	3	336.479	3.364	20	30		EGEDHN
C=CCCC1(C(=O)NCCCCCCNCc2cc(OC)no2)CC1	ZINC001179481403	1386494528	/nfs/dbraw/zinc/49/45/28/1386494528.db2.gz	DTOYWCBUBBTLLY-UHFFFAOYSA-N	0	3	349.475	3.196	20	30		EGEDHN
C=CCC1(C(=O)NCCCCCCNCc2ccn(C)n2)CCCC1	ZINC001180515181	1386820560	/nfs/dbraw/zinc/82/05/60/1386820560.db2.gz	NJEIAZNSUCCFKJ-UHFFFAOYSA-N	0	3	346.519	3.323	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)[C@](C)(CNCc2oc(C)nc2C)C1	ZINC001181629516	1387025962	/nfs/dbraw/zinc/02/59/62/1387025962.db2.gz	KEWVSQSSHIPXPD-AUUYWEPGSA-N	0	3	333.476	3.222	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)[C@](C)(CNCc2cc(C3CC3)no2)C1	ZINC001181629990	1387027341	/nfs/dbraw/zinc/02/73/41/1387027341.db2.gz	QXUSKFZBMWFWTE-FOIQADDNSA-N	0	3	345.487	3.483	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](N[C@@H](CC)c2ccc(F)cc2F)C1	ZINC001182220650	1387123497	/nfs/dbraw/zinc/12/34/97/1387123497.db2.gz	OIDXMERHNMJDAN-QAPCUYQASA-N	0	3	334.410	3.410	20	30		EGEDHN
CC(C)c1ccccc1CN(C)[C@@H](C)CNC(=O)c1cc(C#N)c[nH]1	ZINC001329407392	1389099769	/nfs/dbraw/zinc/09/97/69/1389099769.db2.gz	DBUTUQFXOSMFJU-HNNXBMFYSA-N	0	3	338.455	3.260	20	30		EGEDHN
Cc1ccc(CC(=O)NC[C@H](C)N(C)Cc2cccc(C#N)c2)cc1C	ZINC001329611149	1389183764	/nfs/dbraw/zinc/18/37/64/1389183764.db2.gz	ZPXBKRAPYLMCCF-SFHVURJKSA-N	0	3	349.478	3.354	20	30		EGEDHN
C[C@H](N[C@@H]1CCC[C@H](C#N)C1)C(=O)Nc1cccc(N2CCCC2)c1	ZINC001331567095	1389805125	/nfs/dbraw/zinc/80/51/25/1389805125.db2.gz	UUZGWCUGJUUFBF-YESZJQIVSA-N	0	3	340.471	3.286	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)c1cc(Cl)cs1	ZINC001698764914	1406420463	/nfs/dbraw/zinc/42/04/63/1406420463.db2.gz	FZMOJTBNGBVSAV-GFCCVEGCSA-N	0	3	347.871	3.429	20	30		EGEDHN
C=CCn1c([C@@H](C)OC(C)(C)C)nnc1N1CCN([C@H](C)CC)CC1	ZINC001339775579	1390139624	/nfs/dbraw/zinc/13/96/24/1390139624.db2.gz	WMBVYYXXZOXDJH-HZPDHXFCSA-N	0	3	349.523	3.261	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc(OCc2ccncc2)cc1	ZINC001340077570	1390221791	/nfs/dbraw/zinc/22/17/91/1390221791.db2.gz	QHTYPLDBXVZLTM-SFHVURJKSA-N	0	3	325.412	3.283	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N1CCc2cccc(C(F)(F)F)c2C1	ZINC001340847604	1390383664	/nfs/dbraw/zinc/38/36/64/1390383664.db2.gz	LJVFYLLMTNIRBY-HNNXBMFYSA-N	0	3	326.362	3.274	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1cccc(Br)c1COC	ZINC001341492264	1390493715	/nfs/dbraw/zinc/49/37/15/1390493715.db2.gz	CMPHHTDSYUPCDZ-CYBMUJFWSA-N	0	3	341.249	3.218	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1cccc(C[S@](=O)C(C)(C)C)c1	ZINC001341568127	1390503562	/nfs/dbraw/zinc/50/35/62/1390503562.db2.gz	WUMLJPLNFLCEGF-HJPURHCSSA-N	0	3	336.501	3.356	20	30		EGEDHN
CC(C)NC(=O)Nc1ccccc1C(=O)C(C#N)c1cccc(F)n1	ZINC001342638332	1390635235	/nfs/dbraw/zinc/63/52/35/1390635235.db2.gz	BMUWULKXUVXVCB-ZDUSSCGKSA-N	0	3	340.358	3.241	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)[C@@H]2CCC[C@@H]2OC)cc1	ZINC001343590163	1390724818	/nfs/dbraw/zinc/72/48/18/1390724818.db2.gz	LODGWTMBSOKVMN-KURKYZTESA-N	0	3	342.439	3.492	20	30		EGEDHN
N#CC(C(=O)[C@H]1CCCSC1)c1nccn1Cc1ccccc1	ZINC001343703943	1390731985	/nfs/dbraw/zinc/73/19/85/1390731985.db2.gz	FQVZISDVVWOLOE-JKSUJKDBSA-N	0	3	325.437	3.251	20	30		EGEDHN
Cn1cc(CCC(=O)C(C#N)c2ncc(Cl)n2C)c2ccccc21	ZINC001344322556	1390782103	/nfs/dbraw/zinc/78/21/03/1390782103.db2.gz	RPQCBQXOENZKGB-CQSZACIVSA-N	0	3	340.814	3.374	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N1CCC[C@H]1c1cccc(Cl)c1	ZINC001344551274	1390799192	/nfs/dbraw/zinc/79/91/92/1390799192.db2.gz	DWPRAIRPUFBDEO-KRWDZBQOSA-N	0	3	333.863	3.142	20	30		EGEDHN
CCc1c(C(=O)C(C#N)c2nccn2CC)cnn1-c1ccc(C)cc1	ZINC001344875132	1390821007	/nfs/dbraw/zinc/82/10/07/1390821007.db2.gz	KSFFTLGISJLJSJ-INIZCTEOSA-N	0	3	347.422	3.450	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)N1CC(C)(C)[C@@H]1c1nccn1C	ZINC001354355481	1392139750	/nfs/dbraw/zinc/13/97/50/1392139750.db2.gz	AEKWNAJXRYSZIM-CVEARBPZSA-N	0	3	334.508	3.408	20	30		EGEDHN
CC(C)(C(=O)NC[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1)C1CC1	ZINC001479314710	1392211965	/nfs/dbraw/zinc/21/19/65/1392211965.db2.gz	UCSRWQCNXKXRJN-KDYLLFBJSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@H](OCC)c2ccccc2)C1	ZINC001479418500	1392240292	/nfs/dbraw/zinc/24/02/92/1392240292.db2.gz	MADZPXLSJDTEJO-DJIMGWMZSA-N	0	3	336.863	3.001	20	30		EGEDHN
CN(C(=O)CC1(C)CC1)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001479888375	1392459684	/nfs/dbraw/zinc/45/96/84/1392459684.db2.gz	DWAGYRPQZHIHCY-UHFFFAOYSA-N	0	3	325.456	3.171	20	30		EGEDHN
N#Cc1ccc(CN[C@@H](CNC(=O)c2cccs2)C2CC2)c(F)c1	ZINC001479999988	1392530275	/nfs/dbraw/zinc/53/02/75/1392530275.db2.gz	NZUJUXGPKFBHDO-INIZCTEOSA-N	0	3	343.427	3.057	20	30		EGEDHN
CCN(CCNC(=O)CCCC(F)(F)F)Cc1cccc(C#N)c1	ZINC001481001922	1393080668	/nfs/dbraw/zinc/08/06/68/1393080668.db2.gz	WSDAHYFXNSRCOF-UHFFFAOYSA-N	0	3	341.377	3.229	20	30		EGEDHN
C[C@H](CNC(=O)c1cccc2c1CCC2)NCc1ccc(C#N)s1	ZINC001491691740	1394527185	/nfs/dbraw/zinc/52/71/85/1394527185.db2.gz	HSSKBHBGOVTOMF-CYBMUJFWSA-N	0	3	339.464	3.017	20	30		EGEDHN
Cc1cccc(C(=O)N(C)[C@H](C)CNCc2ccc(C#N)s2)c1F	ZINC001482288355	1394869388	/nfs/dbraw/zinc/86/93/88/1394869388.db2.gz	KHYIPMDRWWOBGR-CYBMUJFWSA-N	0	3	345.443	3.318	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1ccc2ncccc2c1)C(C)C	ZINC001698971377	1406735864	/nfs/dbraw/zinc/73/58/64/1406735864.db2.gz	IGBYHRSJINHYDE-KRWDZBQOSA-N	0	3	331.847	3.331	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)COc1ccccc1C	ZINC001485265846	1395750112	/nfs/dbraw/zinc/75/01/12/1395750112.db2.gz	BHURAYLAUGEFMA-UHFFFAOYSA-N	0	3	338.879	3.201	20	30		EGEDHN
CC(C)CC(=O)NC[C@H]1CCCCCN1Cc1ccc(C#N)cc1	ZINC001485472848	1395949382	/nfs/dbraw/zinc/94/93/82/1395949382.db2.gz	LIPWFMMHZUJDTG-LJQANCHMSA-N	0	3	327.472	3.465	20	30		EGEDHN
CCCc1occc1C(=O)N(C)C[C@H](C)NCc1ccc(C#N)s1	ZINC001485944204	1396171660	/nfs/dbraw/zinc/17/16/60/1396171660.db2.gz	BMGJLDUDBJBZAS-ZDUSSCGKSA-N	0	3	345.468	3.416	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)Cc1csc(C(C)(C)C)n1	ZINC001492098794	1396304265	/nfs/dbraw/zinc/30/42/65/1396304265.db2.gz	LQSGTFNJPYGYHK-LBPRGKRZSA-N	0	3	343.924	3.220	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)c2cccnc2C)CC1	ZINC001505398437	1396285909	/nfs/dbraw/zinc/28/59/09/1396285909.db2.gz	IRTMMFJRQZSJHI-UHFFFAOYSA-N	0	3	335.879	3.317	20	30		EGEDHN
CCN(CCNC(=O)c1cc(C)cs1)Cc1ccc(C#N)cc1	ZINC001691017933	1404932762	/nfs/dbraw/zinc/93/27/62/1404932762.db2.gz	ZDVVLJNJZWBLGO-UHFFFAOYSA-N	0	3	327.453	3.180	20	30		EGEDHN
CC(C)C(C)(C)C(=O)NC[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001691098142	1405035605	/nfs/dbraw/zinc/03/56/05/1405035605.db2.gz	AGAJNTQWGHYZPP-WOVMCDHWSA-N	0	3	345.462	3.364	20	30		EGEDHN
CC(C)C(C)(C)C(=O)NC[C@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC001691143099	1405076425	/nfs/dbraw/zinc/07/64/25/1405076425.db2.gz	KEOIPWPJOSQUGV-GOSISDBHSA-N	0	3	327.472	3.179	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)[C@H](C)C(C)(C)C)C1	ZINC001691506862	1405310481	/nfs/dbraw/zinc/31/04/81/1405310481.db2.gz	YPYXHEUESFTHQB-AVGNSLFASA-N	0	3	331.298	3.062	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)Cc2cc3ccccc3o2)C1	ZINC001691514867	1405314524	/nfs/dbraw/zinc/31/45/24/1405314524.db2.gz	WEQMJARHQRLOFI-CTYIDZIISA-N	0	3	332.831	3.212	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@@H](CCNC(=O)c2ccccc2)C1	ZINC001691869149	1405590265	/nfs/dbraw/zinc/59/02/65/1405590265.db2.gz	AQXYSALOEBWLBR-QGZVFWFLSA-N	0	3	333.435	3.200	20	30		EGEDHN
CC[C@@H](CNC(=O)c1cc(C)c(C)o1)NCc1ccc(C#N)s1	ZINC001732195501	1428446929	/nfs/dbraw/zinc/44/69/29/1428446929.db2.gz	JAWCLYFOCOANOQ-ZDUSSCGKSA-N	0	3	331.441	3.128	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)C1CCC(F)(F)CC1)C1CC1	ZINC001732248444	1428491210	/nfs/dbraw/zinc/49/12/10/1428491210.db2.gz	RRAQMYSQVINDPK-HNNXBMFYSA-N	0	3	334.838	3.439	20	30		EGEDHN
CC(C)CC(=O)NCC1(NCc2ccc(C#N)cc2F)CCCC1	ZINC001732389999	1428559668	/nfs/dbraw/zinc/55/96/68/1428559668.db2.gz	ZUXKEWZVYFGPDH-UHFFFAOYSA-N	0	3	331.435	3.262	20	30		EGEDHN
C[C@@H](CNCc1ccc(F)c(C#N)c1)NC(=O)C1=CCCCCC1	ZINC001699402294	1412715184	/nfs/dbraw/zinc/71/51/84/1412715184.db2.gz	QCAAREKUOZDQNP-AWEZNQCLSA-N	0	3	329.419	3.182	20	30		EGEDHN
CCC(C)(C)C(=O)N[C@@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001699595388	1412955683	/nfs/dbraw/zinc/95/56/83/1412955683.db2.gz	YWDGVODRWVUADC-KRWDZBQOSA-N	0	3	331.435	3.118	20	30		EGEDHN
Cc1ccc(F)cc1C(=O)NCC1(NCc2cccc(C#N)c2)CC1	ZINC001699660728	1413043601	/nfs/dbraw/zinc/04/36/01/1413043601.db2.gz	GALQWXMDOSBCQK-UHFFFAOYSA-N	0	3	337.398	3.058	20	30		EGEDHN
CC1(C)CC[C@H]1C(=O)N1CCC[C@@H]1CNCC#Cc1ccc(F)cc1	ZINC001699756939	1413163260	/nfs/dbraw/zinc/16/32/60/1413163260.db2.gz	JVHOIJWCJPDBDM-MOPGFXCFSA-N	0	3	342.458	3.194	20	30		EGEDHN
C=C(Br)CN[C@@H](CNC(=O)C(C)(C)CCC)C(C)C	ZINC001732564573	1428755649	/nfs/dbraw/zinc/75/56/49/1428755649.db2.gz	HFVNZPXBIREKQR-ZDUSSCGKSA-N	0	3	333.314	3.452	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccc(F)cc1F)N(C)Cc1cccc(C#N)c1	ZINC001700484634	1414127434	/nfs/dbraw/zinc/12/74/34/1414127434.db2.gz	PUMXAOUTWANWDU-ZDUSSCGKSA-N	0	3	343.377	3.087	20	30		EGEDHN
CCC(C)(C)C(=O)N(C)[C@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001700729350	1414391971	/nfs/dbraw/zinc/39/19/71/1414391971.db2.gz	JKOXTOGTYIKECG-GOSISDBHSA-N	0	3	345.462	3.460	20	30		EGEDHN
CCc1ccc(C(=O)N[C@H](C)CNCc2ccc(F)c(C#N)c2)s1	ZINC001732962886	1429087540	/nfs/dbraw/zinc/08/75/40/1429087540.db2.gz	PKTNHXJXPNSJFR-GFCCVEGCSA-N	0	3	345.443	3.229	20	30		EGEDHN
CC(C)CC(C)(C)C(=O)N[C@@H](C)CNCc1ccc(F)c(C#N)c1	ZINC001733019466	1429138471	/nfs/dbraw/zinc/13/84/71/1429138471.db2.gz	UYCQRMXGUHLIQF-AWEZNQCLSA-N	0	3	333.451	3.364	20	30		EGEDHN
C=C(Cl)Cn1c(C2CCC2)nnc1N1C[C@H](C)N(CC)C[C@H]1C	ZINC001705753079	1417133715	/nfs/dbraw/zinc/13/37/15/1417133715.db2.gz	PIOUJBFQDTWXAL-UONOGXRCSA-N	0	3	337.899	3.217	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)CCc2ccc3[nH]ccc3c2)C1	ZINC001707069006	1417182247	/nfs/dbraw/zinc/18/22/47/1417182247.db2.gz	XBFLZSPNHNPJIE-WOVMCDHWSA-N	0	3	345.874	3.337	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)C(C)(C)C2CCC2)C1	ZINC001707085036	1417192421	/nfs/dbraw/zinc/19/24/21/1417192421.db2.gz	JQWDAQRWZFLDMJ-MQMHXKEQSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1scnc1C	ZINC001712995297	1417546633	/nfs/dbraw/zinc/54/66/33/1417546633.db2.gz	XAJKOVHAACYAFH-AAEUAGOBSA-N	0	3	327.881	3.177	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)CCc1cc(C)on1	ZINC001713001284	1417554216	/nfs/dbraw/zinc/55/42/16/1417554216.db2.gz	YSELTONDXPTMJJ-ZBFHGGJFSA-N	0	3	339.867	3.027	20	30		EGEDHN
CC1(C(=O)NC[C@H]2CCN(Cc3ccc(C#N)cc3)C2)CCCC1	ZINC001713533743	1418284960	/nfs/dbraw/zinc/28/49/60/1418284960.db2.gz	JOFBIAZFIYFCCQ-GOSISDBHSA-N	0	3	325.456	3.077	20	30		EGEDHN
C#CCCCC(=O)N1CCCC[C@H]1CNCc1cc(F)ccc1OC	ZINC001714126608	1418931094	/nfs/dbraw/zinc/93/10/94/1418931094.db2.gz	YNUJFNXXIYXHSD-SFHVURJKSA-N	0	3	346.446	3.109	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)Cc1cccc(F)c1F)C1CC1	ZINC001714172762	1418980291	/nfs/dbraw/zinc/98/02/91/1418980291.db2.gz	CBNCGXDDEJTEGB-KRWDZBQOSA-N	0	3	342.817	3.134	20	30		EGEDHN
CCN(CCNC(=O)c1cccc(Cl)c1)Cc1cccc(C#N)c1	ZINC001714597682	1419351409	/nfs/dbraw/zinc/35/14/09/1419351409.db2.gz	XFCWOUVVNLLWIG-UHFFFAOYSA-N	0	3	341.842	3.464	20	30		EGEDHN
CCN(CCNC(=O)c1cccc2c1CCC2)Cc1cccc(C#N)c1	ZINC001714601770	1419358796	/nfs/dbraw/zinc/35/87/96/1419358796.db2.gz	NWFDTYWJVXUHEP-UHFFFAOYSA-N	0	3	347.462	3.299	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@H](CCNC(=O)C2CCCC2)C1	ZINC001714860086	1419581202	/nfs/dbraw/zinc/58/12/02/1419581202.db2.gz	FNXVYIGZQHXRDK-INIZCTEOSA-N	0	3	325.456	3.077	20	30		EGEDHN
CC(C)C[C@@H](CNCc1ccc(C#N)s1)NC(=O)c1cscn1	ZINC001714905423	1419648151	/nfs/dbraw/zinc/64/81/51/1419648151.db2.gz	KTCUNMZRVARWGG-LBPRGKRZSA-N	0	3	348.497	3.011	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2ncoc2C)CCCC[C@H]1C	ZINC001715133352	1419882713	/nfs/dbraw/zinc/88/27/13/1419882713.db2.gz	WMFFHSCBUYDEJG-BZNIZROVSA-N	0	3	325.840	3.004	20	30		EGEDHN
C=C(Br)CN[C@@H](CNC(=O)c1ccccc1C)C(C)C	ZINC001715484783	1420165290	/nfs/dbraw/zinc/16/52/90/1420165290.db2.gz	BWTVESGOCBTABV-HNNXBMFYSA-N	0	3	339.277	3.248	20	30		EGEDHN
CC(C)SCC(=O)N[C@H]1CCC[C@H]1CNCc1ccccc1C#N	ZINC001715546439	1420243357	/nfs/dbraw/zinc/24/33/57/1420243357.db2.gz	IEOZZBPMOOQKPZ-ROUUACIJSA-N	0	3	345.512	3.074	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)[C@H](F)c3ccccc3)CC2)cc1	ZINC001733257448	1429408692	/nfs/dbraw/zinc/40/86/92/1429408692.db2.gz	NRBUZOUIKKPZTO-GOSISDBHSA-N	0	3	337.398	3.007	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N[C@H](CNCc1ccc(C#N)s1)C1CCCC1	ZINC001716817418	1420943731	/nfs/dbraw/zinc/94/37/31/1420943731.db2.gz	YVIZBIGYUVRWGQ-IAGOWNOFSA-N	0	3	345.512	3.430	20	30		EGEDHN
CCC[C@H](C(=O)NCC1(NCc2cccc(C#N)c2)CC1)C(C)C	ZINC001723569267	1424468651	/nfs/dbraw/zinc/46/86/51/1424468651.db2.gz	BLUVUXRZUQCGRT-SFHVURJKSA-N	0	3	327.472	3.369	20	30		EGEDHN
CCc1ccc(C(=O)NC[C@@H](C)N(C)Cc2ccc(C#N)cc2)s1	ZINC001725173405	1425685129	/nfs/dbraw/zinc/68/51/29/1425685129.db2.gz	PHZTYAZSHOAZRB-CQSZACIVSA-N	0	3	341.480	3.432	20	30		EGEDHN
CN(C(=O)CC1CCC1)[C@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001725451987	1426117660	/nfs/dbraw/zinc/11/76/60/1426117660.db2.gz	DEXQVGKLMUPRLD-LJQANCHMSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(Br)CN[C@@H](C)CCNC(=O)c1cc(C)cc(F)c1	ZINC001733906063	1437723707	/nfs/dbraw/zinc/72/37/07/1437723707.db2.gz	SLMYNOZKPJWAQJ-LBPRGKRZSA-N	0	3	343.240	3.141	20	30		EGEDHN
CCN(CCNC(=O)[C@@H]1CCCC1(C)C)Cc1cccc(C#N)c1	ZINC001731809982	1427989240	/nfs/dbraw/zinc/98/92/40/1427989240.db2.gz	YLWGWJBGSVNIHR-SFHVURJKSA-N	0	3	327.472	3.323	20	30		EGEDHN
CCCCC(=O)N[C@@H]1CCN(Cc2ccc(OCC#N)cc2)[C@H](C)C1	ZINC001733897213	1437714823	/nfs/dbraw/zinc/71/48/23/1437714823.db2.gz	ZUQURBPRDDSWTQ-SJLPKXTDSA-N	0	3	343.471	3.248	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)CC[C@@H]1CCCCO1	ZINC001734021050	1437810026	/nfs/dbraw/zinc/81/00/26/1437810026.db2.gz	ZKVCIVCLRRDOCD-HNNXBMFYSA-N	0	3	330.900	3.162	20	30		EGEDHN
CN(C(=O)CCC1CC1)[C@H](CNCc1cc(C#N)ccc1F)C1CC1	ZINC001734293508	1438024696	/nfs/dbraw/zinc/02/46/96/1438024696.db2.gz	DTQQVUDKWLGBDO-LJQANCHMSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@H](CN(C)C(=O)C1C(C)(C)C1(C)C)NCc1ccc(C#N)s1	ZINC001734317776	1438046240	/nfs/dbraw/zinc/04/62/40/1438046240.db2.gz	CFSFWQXTRBUWTP-GFCCVEGCSA-N	0	3	333.501	3.238	20	30		EGEDHN
Cc1cc(C)cc(C(=O)N(C)C[C@H](C)NCc2ccc(C#N)s2)c1	ZINC001734352290	1438069977	/nfs/dbraw/zinc/06/99/77/1438069977.db2.gz	LXPHAOJMCXMOMN-HNNXBMFYSA-N	0	3	341.480	3.487	20	30		EGEDHN
C=C(Br)CNC1CC(N(C)C(=O)CCCC2CC2)C1	ZINC001734598983	1438182118	/nfs/dbraw/zinc/18/21/18/1438182118.db2.gz	JHSZXKPHPDKBFG-UHFFFAOYSA-N	0	3	329.282	3.054	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)CCc1ccccn1	ZINC001752146251	1440146112	/nfs/dbraw/zinc/14/61/12/1440146112.db2.gz	ZFZIMGKWGZERAV-RDJZCZTQSA-N	0	3	335.879	3.126	20	30		EGEDHN
CCN(CC#Cc1cccc(Cl)c1)CCCNC(=O)C(C)(C)F	ZINC001752156571	1440147402	/nfs/dbraw/zinc/14/74/02/1440147402.db2.gz	YPPCERLEAXUFJL-UHFFFAOYSA-N	0	3	338.854	3.268	20	30		EGEDHN
CCN(CC#Cc1ccc(F)cc1)CCCNC(=O)[C@@H](C)C1CCC1	ZINC001752189105	1440152223	/nfs/dbraw/zinc/15/22/23/1440152223.db2.gz	MQELDHZQZCCPSQ-KRWDZBQOSA-N	0	3	344.474	3.442	20	30		EGEDHN
CC#CCN(CCCNC(=O)C[C@H](C)c1ccccc1F)C1CC1	ZINC001752283437	1440164703	/nfs/dbraw/zinc/16/47/03/1440164703.db2.gz	LIIADTHOZSTDEM-INIZCTEOSA-N	0	3	330.447	3.313	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC12CCN(CCc1ccc(F)c(F)c1)CC2	ZINC001752420511	1440175579	/nfs/dbraw/zinc/17/55/79/1440175579.db2.gz	FTAKKLDNJVNOQY-SFHVURJKSA-N	0	3	348.437	3.444	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC[C@H](CN(C)CC#Cc2ccccc2)C1	ZINC001752498315	1440187869	/nfs/dbraw/zinc/18/78/69/1440187869.db2.gz	XYWNXGUYUBTFNY-UYAOXDASSA-N	0	3	326.484	3.255	20	30		EGEDHN
Cc1ncc(CN(C)C[C@@H]2CCCN(C(=O)C#CC(C)(C)C)C2)s1	ZINC001752506884	1440189453	/nfs/dbraw/zinc/18/94/53/1440189453.db2.gz	YALVGSTWOYDQLG-INIZCTEOSA-N	0	3	347.528	3.171	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)c1cccc(OC)c1F	ZINC001752543964	1440195021	/nfs/dbraw/zinc/19/50/21/1440195021.db2.gz	YQZQLWSVCCFBMA-HRCADAONSA-N	0	3	346.446	3.478	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@H]1C[C@H](NCc2cc(F)ccc2OC)C1	ZINC001752654642	1440198090	/nfs/dbraw/zinc/19/80/90/1440198090.db2.gz	BTCOJQBXSAIZKS-KBRIMQKVSA-N	0	3	334.435	3.173	20	30		EGEDHN
CC#CCCCC(=O)N[C@H]1C[C@H](NCc2cc(Cl)ccc2OC)C1	ZINC001752654906	1440198195	/nfs/dbraw/zinc/19/81/95/1440198195.db2.gz	GJXTXOXWUNIYDF-QAQDUYKDSA-N	0	3	348.874	3.279	20	30		EGEDHN
CCCCC1(C(=O)N[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)CC1	ZINC001752660276	1440198405	/nfs/dbraw/zinc/19/84/05/1440198405.db2.gz	FTGDVGMUQJVHAC-QAQDUYKDSA-N	0	3	343.446	3.405	20	30		EGEDHN
CC#CCCCC(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1conc1CC	ZINC001752697431	1440201036	/nfs/dbraw/zinc/20/10/36/1440201036.db2.gz	CNFKQKVCYOOGAA-AYHJJNSGSA-N	0	3	343.471	3.042	20	30		EGEDHN
CC[C@H](C)CC(=O)N[C@H]1C[C@@H](NCC#Cc2ccccc2Cl)C1	ZINC001752723367	1440203832	/nfs/dbraw/zinc/20/38/32/1440203832.db2.gz	ODQGWSIQTWQKJX-BHYGNILZSA-N	0	3	332.875	3.365	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H]1CCCN(CCOc2ccccc2F)C1	ZINC001752784431	1440210488	/nfs/dbraw/zinc/21/04/88/1440210488.db2.gz	BVQJJVLVRGFVRQ-INIZCTEOSA-N	0	3	348.462	3.245	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)CCc2cc(C)cc(C)c2)C1	ZINC001752788917	1440212921	/nfs/dbraw/zinc/21/29/21/1440212921.db2.gz	TZTODDDKUJFDFM-FQEVSTJZSA-N	0	3	326.484	3.088	20	30		EGEDHN
C#CCCCCC(=O)N1CCC[C@@H](CNCc2c(F)cccc2F)C1	ZINC001752797348	1440214535	/nfs/dbraw/zinc/21/45/35/1440214535.db2.gz	ZGFYKEPRDZAXAB-INIZCTEOSA-N	0	3	348.437	3.487	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC[C@@H](CNCc2ncc(C)s2)C1	ZINC001752804372	1440215537	/nfs/dbraw/zinc/21/55/37/1440215537.db2.gz	GBUGTATVPLGDOX-KRWDZBQOSA-N	0	3	347.528	3.363	20	30		EGEDHN
CCCCCCCN1CCCC[C@@H]1CNC(=O)c1c[nH]c(C)cc1=O	ZINC001752823924	1440222455	/nfs/dbraw/zinc/22/24/55/1440222455.db2.gz	MSTUAKJDMMWSET-QGZVFWFLSA-N	0	3	347.503	3.238	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H](C)[C@@H]1CCCN(Cc2cncc(C)c2)C1	ZINC001752839195	1440229605	/nfs/dbraw/zinc/22/96/05/1440229605.db2.gz	CGFFABHFJMIWDY-SJLPKXTDSA-N	0	3	329.488	3.319	20	30		EGEDHN
C[C@@H](CNC(=O)C#CC1CC1)NCc1ccc(Cl)c(Cl)c1	ZINC001752869744	1440237005	/nfs/dbraw/zinc/23/70/05/1440237005.db2.gz	NQYGYUYXDCWQTL-NSHDSACASA-N	0	3	325.239	3.001	20	30		EGEDHN
C[C@@H](CNC(=O)CC(C)(C)C1CC1)NCc1ccc(F)c(C#N)c1	ZINC001752869943	1440237100	/nfs/dbraw/zinc/23/71/00/1440237100.db2.gz	HLGVTSADIOOWIU-ZDUSSCGKSA-N	0	3	331.435	3.118	20	30		EGEDHN
Cc1oc(C)c(C(=O)NC[C@H](C)NCc2ccc(C#N)s2)c1C	ZINC001752886706	1440239975	/nfs/dbraw/zinc/23/99/75/1440239975.db2.gz	IOIYMCWKIBADPE-JTQLQIEISA-N	0	3	331.441	3.046	20	30		EGEDHN
CC1=CC[C@@](C)(C(=O)NC[C@@H](C)NCc2ccc(C#N)c(F)c2)CC1	ZINC001752920780	1440248388	/nfs/dbraw/zinc/24/83/88/1440248388.db2.gz	GMVTWKDFJMWSSV-FOIQADDNSA-N	0	3	343.446	3.428	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](CNCc2csc(C3CC3)n2)C1	ZINC001752937413	1440250524	/nfs/dbraw/zinc/25/05/24/1440250524.db2.gz	FDKUQZSWJNTHEQ-AWEZNQCLSA-N	0	3	333.501	3.315	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1CCC[C@H](NCc2cnc(C)o2)C1	ZINC001752975777	1440255921	/nfs/dbraw/zinc/25/59/21/1440255921.db2.gz	FYLLDSAVOPMOKZ-IRXDYDNUSA-N	0	3	331.460	3.084	20	30		EGEDHN
CC#CCN(C)[C@H]1CCCN(C(=O)C[C@H](C)c2ccccc2F)C1	ZINC001752998832	1440263396	/nfs/dbraw/zinc/26/33/96/1440263396.db2.gz	NSHGCNCBDFOEGC-IRXDYDNUSA-N	0	3	330.447	3.265	20	30		EGEDHN
C[C@H](CCNC(=O)c1cccs1)NCc1cc(C#N)ccc1F	ZINC001753001545	1440264799	/nfs/dbraw/zinc/26/47/99/1440264799.db2.gz	DDBGJGIPHZOONU-GFCCVEGCSA-N	0	3	331.416	3.057	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)[C@H](C)Cc1cccc(F)c1	ZINC001753020592	1440269990	/nfs/dbraw/zinc/26/99/90/1440269990.db2.gz	SOEJVORDEGTTAE-TZMCWYRMSA-N	0	3	326.843	3.241	20	30		EGEDHN
CC(C)C#CC(=O)NCCC[C@H]1CCCN1Cc1cc(F)cc(F)c1	ZINC001753028665	1440272270	/nfs/dbraw/zinc/27/22/70/1440272270.db2.gz	LRPLVTBPOGHGNN-IBGZPJMESA-N	0	3	348.437	3.485	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCN(C)[C@H]1CCc2c1cc(Cl)cc2Cl	ZINC001753043521	1440277138	/nfs/dbraw/zinc/27/71/38/1440277138.db2.gz	DDTLVGJTQXYQIR-BMIGLBTASA-N	0	3	340.254	3.188	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)NCCN(C)[C@H](C)c1ccc(Cl)cc1	ZINC001753064765	1440285053	/nfs/dbraw/zinc/28/50/53/1440285053.db2.gz	VUCFECJVPWKMRJ-XYPHTWIQSA-N	0	3	336.863	3.040	20	30		EGEDHN
CC(C)(C)C#CC(=O)NC[C@H]1CCCN1Cc1cccc2cccnc21	ZINC001753102414	1440304785	/nfs/dbraw/zinc/30/47/85/1440304785.db2.gz	JOGYXOAODCLRMH-LJQANCHMSA-N	0	3	349.478	3.365	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NC[C@H]1CCN(Cc2ccccc2F)C1)OCC	ZINC001753129551	1440315991	/nfs/dbraw/zinc/31/59/91/1440315991.db2.gz	OLHCHLSNYBNPHQ-APWZRJJASA-N	0	3	348.462	3.135	20	30		EGEDHN
CC[C@H]1CCC[C@H]1C(=O)N(C)CCNCc1ccc(F)c(C#N)c1	ZINC001753227974	1440340876	/nfs/dbraw/zinc/34/08/76/1440340876.db2.gz	HBKNLURAMUCRBT-DOTOQJQBSA-N	0	3	331.435	3.072	20	30		EGEDHN
C=C(C)CN[C@H](CNC(=O)c1cc(Cl)cn1C)c1ccccc1	ZINC001753299982	1440353655	/nfs/dbraw/zinc/35/36/55/1440353655.db2.gz	LJPPWJWNPSYCMY-MRXNPFEDSA-N	0	3	331.847	3.315	20	30		EGEDHN
C=CCN[C@@H](CNC(=O)c1ccnc(OC(C)C)c1)c1ccccc1	ZINC001753311252	1440356642	/nfs/dbraw/zinc/35/66/42/1440356642.db2.gz	KLLDZPHDHZGDHL-SFHVURJKSA-N	0	3	339.439	3.116	20	30		EGEDHN
C=CCOCCN1CC[C@@H](N(CCC)C(=O)[C@@H]2CCCC2(C)C)C1	ZINC001753318278	1440360958	/nfs/dbraw/zinc/36/09/58/1440360958.db2.gz	GSJAJMOOQJPHQM-MSOLQXFVSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCOCCN1CC[C@H](N(CCC)C(=O)[C@@H]2CC23CCCC3)C1	ZINC001753319880	1440362623	/nfs/dbraw/zinc/36/26/23/1440362623.db2.gz	OPHXWZLUOINJLS-ROUUACIJSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CCC)C(=O)[C@@H]2CCc3ccccc3O2)C1	ZINC001753319884	1440362826	/nfs/dbraw/zinc/36/28/26/1440362826.db2.gz	OQESQSYTPPIAIO-QUCCMNQESA-N	0	3	342.483	3.269	20	30		EGEDHN
C=CCOCCN1CC[C@@H](N(CCC)C(=O)C2CCC=CCC2)C1	ZINC001753321529	1440363856	/nfs/dbraw/zinc/36/38/56/1440363856.db2.gz	ASYJVPAPUAVCEF-LJQANCHMSA-N	0	3	334.504	3.248	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CCC)C(=O)[C@@H](C)c2cccc(OC)c2)C1	ZINC001753323135	1440364992	/nfs/dbraw/zinc/36/49/92/1440364992.db2.gz	LVTPYXTUSUIDCG-PKOBYXMFSA-N	0	3	342.483	3.135	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NCC1CN([C@H](C)c2cccc(C)c2)C1	ZINC001753407312	1440392119	/nfs/dbraw/zinc/39/21/19/1440392119.db2.gz	DDLYTTKNHIRHNV-DYESRHJHSA-N	0	3	344.499	3.333	20	30		EGEDHN
C=CCCCCCN1C[C@@H]2C[C@H]1CN2C(=O)CCC1CCOCC1	ZINC001753425193	1440396654	/nfs/dbraw/zinc/39/66/54/1440396654.db2.gz	PEZPJZKMLABDLN-OALUTQOASA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCCCCCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H](C)c1c(C)noc1C	ZINC001753425606	1440396753	/nfs/dbraw/zinc/39/67/53/1440396753.db2.gz	SNLKCSOPJLWUJB-WBAXXEDZSA-N	0	3	345.487	3.426	20	30		EGEDHN
CC#CCCCC(=O)N(C)[C@H]1CCN(Cc2cccc3cccnc32)C1	ZINC001753442286	1440402379	/nfs/dbraw/zinc/40/23/79/1440402379.db2.gz	ZKZTZQSUKBMEMP-FQEVSTJZSA-N	0	3	349.478	3.461	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)COc2ccccc2Cl)C1	ZINC001753462259	1440411481	/nfs/dbraw/zinc/41/14/81/1440411481.db2.gz	UKMYKRHXEDDCLR-OAHLLOKOSA-N	0	3	336.863	3.218	20	30		EGEDHN
CC[C@@H](CNC(=O)c1cc(C)cs1)NCc1ccc(C#N)s1	ZINC001753471493	1440413986	/nfs/dbraw/zinc/41/39/86/1440413986.db2.gz	NWLFVWOPJAPXDT-LBPRGKRZSA-N	0	3	333.482	3.288	20	30		EGEDHN
C=CCOCC(=O)NC1(CNCc2ccccc2Cl)CCCC1	ZINC001753501598	1440423490	/nfs/dbraw/zinc/42/34/90/1440423490.db2.gz	RBWSFROGIZXQTL-UHFFFAOYSA-N	0	3	336.863	3.061	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)[C@@H]1C[C@H]1c1ccsc1)C1CC1	ZINC001753521225	1440428526	/nfs/dbraw/zinc/42/85/26/1440428526.db2.gz	FAGVTHDSOFQIRA-ZMSDIMECSA-N	0	3	338.904	3.479	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N[C@](C)(CNCc1ccc(C#N)cc1F)C1CC1	ZINC001753524771	1440429364	/nfs/dbraw/zinc/42/93/64/1440429364.db2.gz	LGHZHRQAEPSGBD-VBKZILBWSA-N	0	3	345.462	3.364	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2nccs2)CCCC[C@@H]1C	ZINC001753536213	1440432603	/nfs/dbraw/zinc/43/26/03/1440432603.db2.gz	RAXUWDDEAYWKJO-XHDPSFHLSA-N	0	3	327.881	3.164	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2ccc(OC)o2)CCCC[C@H]1C	ZINC001753536248	1440432725	/nfs/dbraw/zinc/43/27/25/1440432725.db2.gz	RMEZCVMFPAJZLR-SJKOYZFVSA-N	0	3	340.851	3.309	20	30		EGEDHN
CC#CCNCc1ccc(CNC(=O)CC2(C(F)(F)F)CC2)cc1	ZINC001753589084	1440442293	/nfs/dbraw/zinc/44/22/93/1440442293.db2.gz	MPTMMPPRQFCSDM-UHFFFAOYSA-N	0	3	338.373	3.148	20	30		EGEDHN
CCCCc1nc(CNC[C@@H](C)CNC(=O)C#CC(C)(C)C)cs1	ZINC001753613125	1440449238	/nfs/dbraw/zinc/44/92/38/1440449238.db2.gz	QKJXOEMZVNEZBT-OAHLLOKOSA-N	0	3	349.544	3.377	20	30		EGEDHN
C[C@@H](NC1(CNC(=O)C#CC2CC2)CCCC1)c1cc(F)ccc1F	ZINC001753664304	1440459731	/nfs/dbraw/zinc/45/97/31/1440459731.db2.gz	RHSQSULHVYDGPV-CQSZACIVSA-N	0	3	346.421	3.458	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)CCCc1csc(C)n1)CC2	ZINC001753673328	1440462783	/nfs/dbraw/zinc/46/27/83/1440462783.db2.gz	FPYPCSUDLKFOKX-UHFFFAOYSA-N	0	3	347.528	3.275	20	30		EGEDHN
C=CC1(CC(=O)N2CCC3(CN([C@@H](C)COC)C3)CC2)CCCCC1	ZINC001753674664	1440463026	/nfs/dbraw/zinc/46/30/26/1440463026.db2.gz	BHPSGGLJSIOTPV-SFHVURJKSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@H](C)CNCC#Cc2cccc(Cl)c2)C1	ZINC001753712986	1440471158	/nfs/dbraw/zinc/47/11/58/1440471158.db2.gz	WDQJEHUAJPONSN-MRXNPFEDSA-N	0	3	344.886	3.484	20	30		EGEDHN
Cc1ccc(C(=O)N(C)[C@@H](C)CNCC#Cc2ccc(F)cc2)cc1	ZINC001753723223	1440473753	/nfs/dbraw/zinc/47/37/53/1440473753.db2.gz	HQDDYJYCVUJNHQ-KRWDZBQOSA-N	0	3	338.426	3.236	20	30		EGEDHN
Cc1cccc(C(=O)N[C@@H](CNCC#Cc2ccccc2)CC(C)C)n1	ZINC001753734127	1440477128	/nfs/dbraw/zinc/47/71/28/1440477128.db2.gz	VNOQYGOTLHGQDO-HXUWFJFHSA-N	0	3	349.478	3.176	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H](CNCc1cn(C)nc1C)C1CCCCC1	ZINC001753746436	1440481105	/nfs/dbraw/zinc/48/11/05/1440481105.db2.gz	VZWSLTVEZBQKFR-IBGZPJMESA-N	0	3	346.519	3.240	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CCCCN1C(=O)CC1CCC1	ZINC001753775360	1440486405	/nfs/dbraw/zinc/48/64/05/1440486405.db2.gz	KVLSONUMKFXDPZ-HNNXBMFYSA-N	0	3	343.309	3.446	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H](C)[C@@H]1CNCc1ccnc(Cl)c1	ZINC001753818952	1440495028	/nfs/dbraw/zinc/49/50/28/1440495028.db2.gz	NYULBRNTJZCHBZ-WBVHZDCISA-N	0	3	347.890	3.255	20	30		EGEDHN
C=CCCCC(=O)NC[C@H](NCC#Cc1ccc(F)cc1)C(C)C	ZINC001753838003	1440501647	/nfs/dbraw/zinc/50/16/47/1440501647.db2.gz	QJJMRFJHRIHFIY-IBGZPJMESA-N	0	3	330.447	3.264	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)[C@@H](F)Cc1ccccc1)C(C)C	ZINC001753846085	1440504471	/nfs/dbraw/zinc/50/44/71/1440504471.db2.gz	YTIUCRIBULQCBG-HOTGVXAUSA-N	0	3	326.843	3.050	20	30		EGEDHN
CCCSCC(=O)N[C@@H]1CCC[C@@H]1CNCc1ccccc1C#N	ZINC001753880622	1440520504	/nfs/dbraw/zinc/52/05/04/1440520504.db2.gz	RIGOKWAZHHNGCJ-QZTJIDSGSA-N	0	3	345.512	3.076	20	30		EGEDHN
C=C(Cl)CNCC[C@@H](C)NC(=O)c1c(Cl)cncc1Cl	ZINC001753997605	1440529718	/nfs/dbraw/zinc/52/97/18/1440529718.db2.gz	ZLRFSFGPMIUKLM-SECBINFHSA-N	0	3	336.650	3.239	20	30		EGEDHN
C=C(Cl)CNCC[C@@H](C)NC(=O)c1cnc2ccc(F)cc2c1	ZINC001754010737	1440531177	/nfs/dbraw/zinc/53/11/77/1440531177.db2.gz	HDIDKCKHTSIUGH-GFCCVEGCSA-N	0	3	335.810	3.224	20	30		EGEDHN
C=C(Cl)CNCC[C@H](C)NC(=O)c1cnc2ccc(F)cc2c1	ZINC001754010738	1440531222	/nfs/dbraw/zinc/53/12/22/1440531222.db2.gz	HDIDKCKHTSIUGH-LBPRGKRZSA-N	0	3	335.810	3.224	20	30		EGEDHN
C=C[C@@H](C(=O)N[C@H](C)CCNCc1ncc(C)s1)c1ccccc1	ZINC001754024338	1440533008	/nfs/dbraw/zinc/53/30/08/1440533008.db2.gz	OQFZGLYJCVXNMO-RHSMWYFYSA-N	0	3	343.496	3.406	20	30		EGEDHN
CCCC1(C(=O)NC/C=C\CNCc2ccc(C#N)c(F)c2)CCC1	ZINC001754159664	1440545793	/nfs/dbraw/zinc/54/57/93/1440545793.db2.gz	VLZHXVPAUYQWRS-ARJAWSKDSA-N	0	3	343.446	3.430	20	30		EGEDHN
C=C[C@H](C(=O)NC/C=C/CNCc1cccc(C#N)c1)c1ccccc1	ZINC001754209116	1440551048	/nfs/dbraw/zinc/55/10/48/1440551048.db2.gz	DWKSCLGWVJZDQH-BXKJMJEDSA-N	0	3	345.446	3.290	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H](C)CN[C@H](C)C(=O)Nc1ccc(C)cc1C	ZINC001754228052	1440553490	/nfs/dbraw/zinc/55/34/90/1440553490.db2.gz	ZZWPCIFLTILCOP-IAGOWNOFSA-N	0	3	345.487	3.081	20	30		EGEDHN
C[C@H](CNCC#Cc1ccccc1)NC(=O)C[C@H](C)c1ccccc1	ZINC001754251353	1440558115	/nfs/dbraw/zinc/55/81/15/1440558115.db2.gz	WTKUXQMIJGLNPI-RBUKOAKNSA-N	0	3	334.463	3.326	20	30		EGEDHN
CN(CCCNCc1cc(C#N)ccc1F)C(=O)[C@@H]1CCC1(C)C	ZINC001754390989	1440594156	/nfs/dbraw/zinc/59/41/56/1440594156.db2.gz	LAKHMZXCWVUBNJ-INIZCTEOSA-N	0	3	331.435	3.072	20	30		EGEDHN
CN(CCCNCc1ccccc1C#N)C(=O)c1cccc(F)c1F	ZINC001754397173	1440594726	/nfs/dbraw/zinc/59/47/26/1440594726.db2.gz	LLSYXUREFSXAGF-UHFFFAOYSA-N	0	3	343.377	3.088	20	30		EGEDHN
C=CCCCN1CC[C@@H]1CNC(=O)c1ccc(-c2cnco2)cc1	ZINC001754487182	1440609230	/nfs/dbraw/zinc/60/92/30/1440609230.db2.gz	DLGSTOMNVJJZEI-QGZVFWFLSA-N	0	3	325.412	3.112	20	30		EGEDHN
CC(C)c1ccc(CNC2(CNC(=O)c3c[nH]c(C#N)c3)CC2)cc1	ZINC001754512489	1440617888	/nfs/dbraw/zinc/61/78/88/1440617888.db2.gz	LNGZYKLTLIWMDG-UHFFFAOYSA-N	0	3	336.439	3.062	20	30		EGEDHN
C=CCOCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C(F)=C1CCCC1	ZINC001754542244	1440626303	/nfs/dbraw/zinc/62/63/03/1440626303.db2.gz	KLPFVSZPDBJLQC-SJORKVTESA-N	0	3	336.451	3.052	20	30		EGEDHN
Cc1ncc(CN(CCNC(=O)[C@@H](C)C#N)C2CCCCCC2)s1	ZINC001754546798	1440627946	/nfs/dbraw/zinc/62/79/46/1440627946.db2.gz	TXFVLSHNRYIUPZ-AWEZNQCLSA-N	0	3	348.516	3.252	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@]2(CCN(Cc3cnc(C)s3)C2)C1	ZINC001754565685	1440635400	/nfs/dbraw/zinc/63/54/00/1440635400.db2.gz	MYXSCQNVEFQTGN-SFHVURJKSA-N	0	3	333.501	3.232	20	30		EGEDHN
CC1CC(C(=O)N2CCC[C@H]2CNCC#Cc2ccc(Cl)cc2)C1	ZINC001754608287	1440643497	/nfs/dbraw/zinc/64/34/97/1440643497.db2.gz	UTZIRERQBXGTAO-KVWWFHCMSA-N	0	3	344.886	3.318	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)C[C@H](C)c2cccc(F)c2)CC1	ZINC001754629012	1440647145	/nfs/dbraw/zinc/64/71/45/1440647145.db2.gz	OEOOMRASHDVXBY-INIZCTEOSA-N	0	3	330.447	3.313	20	30		EGEDHN
C#CCN(C(=O)[C@@H]1CC[C@H](F)C1)C1CCN(Cc2ccccc2)CC1	ZINC001754640178	1440649060	/nfs/dbraw/zinc/64/90/60/1440649060.db2.gz	JRKRDRVYBYWUOW-MOPGFXCFSA-N	0	3	342.458	3.251	20	30		EGEDHN
C#CCNC[C@H](NC(=O)[C@@H]1CC12CCC2)c1ccc2ccccc2c1	ZINC001754644837	1440649849	/nfs/dbraw/zinc/64/98/49/1440649849.db2.gz	YFLNKXQUICHLHK-PMACEKPBSA-N	0	3	332.447	3.410	20	30		EGEDHN
C[C@]1(CNCc2ccccc2C#N)CCN(C(=O)CCC2CCC2)C1	ZINC001754693786	1440666641	/nfs/dbraw/zinc/66/66/41/1440666641.db2.gz	YCORFJKFEXTCIA-OAQYLSRUSA-N	0	3	339.483	3.467	20	30		EGEDHN
C#CCN1CCC(C)(CNC(=O)COc2cccc(C(C)C)c2)CC1	ZINC001754715781	1440671400	/nfs/dbraw/zinc/67/14/00/1440671400.db2.gz	FLZMQZGBNPSYFS-UHFFFAOYSA-N	0	3	342.483	3.040	20	30		EGEDHN
C#CCN1CCC(C)(CNC(=O)c2ccc3[nH]c(C)c(C)c3c2)CC1	ZINC001754722189	1440673741	/nfs/dbraw/zinc/67/37/41/1440673741.db2.gz	OEOCYVQRWUWKGQ-UHFFFAOYSA-N	0	3	337.467	3.250	20	30		EGEDHN
C/C=C(\C)C(=O)NC[C@@]1(C)CCCN(Cc2cccc(C#N)c2)C1	ZINC001754725259	1440675505	/nfs/dbraw/zinc/67/55/05/1440675505.db2.gz	KINJFQTZKVQKHH-WYLMYDOGSA-N	0	3	325.456	3.243	20	30		EGEDHN
CC#CCN1CCC[C@@](C)(CNC(=O)c2ccc(C(C)C)cn2)C1	ZINC001754730715	1440679139	/nfs/dbraw/zinc/67/91/39/1440679139.db2.gz	LNPQCZGNJWUWOU-FQEVSTJZSA-N	0	3	327.472	3.060	20	30		EGEDHN
CC#CCN1CCC[C@](C)(CNC(=O)[C@H](CC)CC(F)(F)F)C1	ZINC001754731359	1440679318	/nfs/dbraw/zinc/67/93/18/1440679318.db2.gz	FBMIFHPPAVHMJW-GDBMZVCRSA-N	0	3	332.410	3.207	20	30		EGEDHN
C=CCN1CCC[C@@](C)(CNC(=O)Cc2c[nH]c3cc(C)ccc23)C1	ZINC001754732117	1440680207	/nfs/dbraw/zinc/68/02/07/1440680207.db2.gz	NTJHAWWKWUGLLX-NRFANRHFSA-N	0	3	339.483	3.423	20	30		EGEDHN
C=CCN1CCC[C@@](C)(CNC(=O)[C@@]2(C)CCc3ccccc32)C1	ZINC001754733686	1440681354	/nfs/dbraw/zinc/68/13/54/1440681354.db2.gz	FIZHWBXYMWAXKW-SFTDATJTSA-N	0	3	326.484	3.295	20	30		EGEDHN
C=CCN[C@@H](CNC(=O)[C@H](C)n1cccc1)c1ccccc1CC	ZINC001754786307	1440687970	/nfs/dbraw/zinc/68/79/70/1440687970.db2.gz	WUNGICVTRZBIDF-LPHOPBHVSA-N	0	3	325.456	3.245	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H]([C@H](C)NCc2csc(C3CC3)n2)C1	ZINC001754787642	1440688115	/nfs/dbraw/zinc/68/81/15/1440688115.db2.gz	MYFXORYWEZTVEZ-DZGCQCFKSA-N	0	3	333.501	3.313	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H](C)[C@@H](CNC/C(Cl)=C\Cl)C2)C1	ZINC001754822662	1440693161	/nfs/dbraw/zinc/69/31/61/1440693161.db2.gz	NRQOWVWWZWBALU-GVHCQATPSA-N	0	3	331.287	3.346	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@]1(CO)CCCN(Cc2cccc(C)c2)C1	ZINC001754857296	1440700433	/nfs/dbraw/zinc/70/04/33/1440700433.db2.gz	DIFNYDWBZRWOCU-GHTZIAJQSA-N	0	3	344.499	3.040	20	30		EGEDHN
CC/C=C(/C)C(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1cccc(C#N)c1	ZINC001754863265	1440701801	/nfs/dbraw/zinc/70/18/01/1440701801.db2.gz	UXLJBPKZFHJIIG-PXYUVIMYSA-N	0	3	337.467	3.480	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1ncccc1C	ZINC001754868978	1440704080	/nfs/dbraw/zinc/70/40/80/1440704080.db2.gz	REUJBEFMYWECJM-MOPGFXCFSA-N	0	3	327.472	3.312	20	30		EGEDHN
C#CCN[C@H](C)c1ccc(CNC(=O)[C@@H]2Cc3ccc(F)cc32)cc1	ZINC001754948592	1440714329	/nfs/dbraw/zinc/71/43/29/1440714329.db2.gz	LDNNGAQQNUHHCT-JLTOFOAXSA-N	0	3	336.410	3.066	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)CCC(F)(F)F)cccc2C1	ZINC001754974721	1440719624	/nfs/dbraw/zinc/71/96/24/1440719624.db2.gz	RXSXJFBAJTZDGH-UHFFFAOYSA-N	0	3	338.373	3.027	20	30		EGEDHN
C=C(C)CCC(=O)N(C)CCCN(C)Cc1ccc(F)c(C#N)c1	ZINC001755038314	1440735593	/nfs/dbraw/zinc/73/55/93/1440735593.db2.gz	UFFBINVEUDEOCU-UHFFFAOYSA-N	0	3	331.435	3.334	20	30		EGEDHN
CC#CCCCC(=O)N1CCC(CNCCF)(c2ccccc2)CC1	ZINC001755146427	1440762814	/nfs/dbraw/zinc/76/28/14/1440762814.db2.gz	JHCPDOHJBKIHBT-UHFFFAOYSA-N	0	3	344.474	3.300	20	30		EGEDHN
COc1cccc(CN2CC[C@H](NC(=O)C#CC(C)(C)C)C[C@@H]2C)c1	ZINC001755159468	1440764262	/nfs/dbraw/zinc/76/42/62/1440764262.db2.gz	HFPVJRNQUQLTNY-WMZOPIPTSA-N	0	3	342.483	3.214	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)COc2cccc(C(C)C)c2)C[C@H]1C	ZINC001755161112	1440764718	/nfs/dbraw/zinc/76/47/18/1440764718.db2.gz	UTSJHUYDVUUACG-IEBWSBKVSA-N	0	3	342.483	3.181	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)CCOc2cccc(C)c2C)C[C@H]1C	ZINC001755162716	1440765494	/nfs/dbraw/zinc/76/54/94/1440765494.db2.gz	YMYNXPRGXLJQJS-MJGOQNOKSA-N	0	3	342.483	3.065	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1CCN(Cc2ncccc2C)[C@@H](C)C1	ZINC001755166900	1440767685	/nfs/dbraw/zinc/76/76/85/1440767685.db2.gz	HOCABAYSPLDTCS-IRXDYDNUSA-N	0	3	329.488	3.461	20	30		EGEDHN
C=CCCCN1CCOC2(CCN(C(=O)C(C)(CC)CC)CC2)C1	ZINC001755174351	1440770375	/nfs/dbraw/zinc/77/03/75/1440770375.db2.gz	PGDGUBUZUDBASN-UHFFFAOYSA-N	0	3	336.520	3.472	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)C[C@@H](C)C(F)(F)F	ZINC001755187104	1440773430	/nfs/dbraw/zinc/77/34/30/1440773430.db2.gz	VPJWBIGTRGRWTL-DJSGYFEHSA-N	0	3	326.362	3.133	20	30		EGEDHN
C#CCCN[C@@H]1c2ccccc2C[C@H]1NC(=O)C[C@@H]1CCCC1(F)F	ZINC001755186975	1440773456	/nfs/dbraw/zinc/77/34/56/1440773456.db2.gz	OTJDZNTXVOSAOY-KVSKMBFKSA-N	0	3	346.421	3.207	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]2CN(C)CCOc2ccccc2)C1	ZINC001755199456	1440778718	/nfs/dbraw/zinc/77/87/18/1440778718.db2.gz	WWYZCGXXXCGXBI-GOSISDBHSA-N	0	3	342.483	3.345	20	30		EGEDHN
C=C(Br)CNCC1CC(NC(=O)C=C(CC)CC)C1	ZINC001755208214	1440782631	/nfs/dbraw/zinc/78/26/31/1440782631.db2.gz	JFSYYMCZERRDPA-UHFFFAOYSA-N	0	3	329.282	3.126	20	30		EGEDHN
COc1ccc(C#N)cc1CN[C@@H](C)[C@@H](C)NC(=O)C(C)(C)C(C)C	ZINC001755238951	1440788963	/nfs/dbraw/zinc/78/89/63/1440788963.db2.gz	YUSKPGCLGNRHCA-LSDHHAIUSA-N	0	3	345.487	3.232	20	30		EGEDHN
C[C@@H](NC(=O)C#CC(C)(C)C)[C@H](C)NCC#Cc1ccc(Cl)cc1	ZINC001755254431	1440792872	/nfs/dbraw/zinc/79/28/72/1440792872.db2.gz	QDWYHHQMCDLXSI-JKSUJKDBSA-N	0	3	344.886	3.224	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1ccnn1C1CCC1	ZINC001755280918	1440800566	/nfs/dbraw/zinc/80/05/66/1440800566.db2.gz	RGHDUEMQRVZXAL-UHFFFAOYSA-N	0	3	338.883	3.048	20	30		EGEDHN
CN(CC(C)(C)CNCc1ccccc1C#N)C(=O)CC1(C)CC1	ZINC001755283902	1440801395	/nfs/dbraw/zinc/80/13/95/1440801395.db2.gz	ZVRLNVIHADGLOK-UHFFFAOYSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C(Br)CNCC(C)(C)CN(C)C(=O)[C@@H]1CCC1(C)C	ZINC001755284323	1440801505	/nfs/dbraw/zinc/80/15/05/1440801505.db2.gz	OBJKMJUHHOYDIQ-ZDUSSCGKSA-N	0	3	345.325	3.405	20	30		EGEDHN
CCCc1[nH]ccc1C(=O)NC[C@@H](C)N(C)Cc1cccc(C#N)c1	ZINC001755312516	1440814202	/nfs/dbraw/zinc/81/42/02/1440814202.db2.gz	GJDGDVPHCHMXBQ-OAHLLOKOSA-N	0	3	338.455	3.089	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NC[C@H](C)N(C)Cc1ccccc1CC	ZINC001755324596	1440820734	/nfs/dbraw/zinc/82/07/34/1440820734.db2.gz	OINAQQXLFKGFNT-SFHVURJKSA-N	0	3	348.490	3.410	20	30		EGEDHN
C[C@H](CNC(=O)[C@@H](C)Cc1ccccc1)N(C)Cc1cccc(C#N)c1	ZINC001755327210	1440822476	/nfs/dbraw/zinc/82/24/76/1440822476.db2.gz	FIEQXQPDZKWCNK-ZWKOTPCHSA-N	0	3	349.478	3.374	20	30		EGEDHN
CC(C)C#CC(=O)NC1(CNCc2ccccc2F)CCCCC1	ZINC001755351146	1440827787	/nfs/dbraw/zinc/82/77/87/1440827787.db2.gz	RMYOIWAUZSWMEY-UHFFFAOYSA-N	0	3	330.447	3.394	20	30		EGEDHN
CCCC[C@@H](CNCC#Cc1ccccc1)NC(=O)c1ccncc1	ZINC001755356070	1440829521	/nfs/dbraw/zinc/82/95/21/1440829521.db2.gz	DYOXAKJDGJXFII-FQEVSTJZSA-N	0	3	335.451	3.012	20	30		EGEDHN
CCCC[C@H](CNCc1ccc(F)c(C#N)c1)NC(=O)C#CC(C)C	ZINC001755357250	1440830108	/nfs/dbraw/zinc/83/01/08/1440830108.db2.gz	GXCJHOVIFUWZFY-GOSISDBHSA-N	0	3	343.446	3.121	20	30		EGEDHN
CCCC[C@H](CNCC#CCOC)NC(=O)C1CCC(C)(C)CC1	ZINC001755361628	1440831760	/nfs/dbraw/zinc/83/17/60/1440831760.db2.gz	XJURSSIVOXWCFF-GOSISDBHSA-N	0	3	336.520	3.117	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)C(C)(C)c1ccc(F)cc1	ZINC001755367904	1440835904	/nfs/dbraw/zinc/83/59/04/1440835904.db2.gz	KWQHGDWMNUUEFM-LJQANCHMSA-N	0	3	344.474	3.487	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H](C)C2CN(Cc3cccc(OC)c3C)C2)C1	ZINC001755387042	1440840913	/nfs/dbraw/zinc/84/09/13/1440840913.db2.gz	XUHIDLRGNIHMGI-MRXNPFEDSA-N	0	3	342.483	3.296	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@]2(CCN(C(=O)c3cccc(F)c3)C2)C1	ZINC001755399792	1440842886	/nfs/dbraw/zinc/84/28/86/1440842886.db2.gz	QIROMPMNZUDCDP-JXFKEZNVSA-N	0	3	346.446	3.097	20	30		EGEDHN
C=CCOCCCC(=O)N1CC2(C1)CCCN(Cc1ccsc1)C2	ZINC001755455743	1440855317	/nfs/dbraw/zinc/85/53/17/1440855317.db2.gz	XFVQUBQFICJHSC-UHFFFAOYSA-N	0	3	348.512	3.155	20	30		EGEDHN
C=C(Cl)CNC[C@H]1C[C@H](NC(=O)c2ccc3c(c2)CCCC3)C1	ZINC001755482805	1440860456	/nfs/dbraw/zinc/86/04/56/1440860456.db2.gz	KSZFHZZLWSCMTH-PPUGGXLSSA-N	0	3	332.875	3.416	20	30		EGEDHN
CC(=O)N(CCCNCc1ccc(C#N)cc1F)Cc1ccccc1	ZINC001755537613	1440870086	/nfs/dbraw/zinc/87/00/86/1440870086.db2.gz	UFVOBMXLYVQVFR-UHFFFAOYSA-N	0	3	339.414	3.226	20	30		EGEDHN
CCCSCC(=O)N(C)[C@@H](CNCC#Cc1ccccc1)C1CC1	ZINC001755558424	1440873939	/nfs/dbraw/zinc/87/39/39/1440873939.db2.gz	YEGQNOVHEHTUQV-IBGZPJMESA-N	0	3	344.524	3.008	20	30		EGEDHN
C[C@@H](CN(C)C(=O)C(F)=C1CCCC1)NCc1ccc(F)c(C#N)c1	ZINC001755581746	1440879479	/nfs/dbraw/zinc/87/94/79/1440879479.db2.gz	NJSRJFOTZUSULB-ZDUSSCGKSA-N	0	3	347.409	3.431	20	30		EGEDHN
C=CCC(C)(C)C(=O)N(C)C[C@@H](C)NCC#Cc1ccc(F)cc1	ZINC001755608130	1440886333	/nfs/dbraw/zinc/88/63/33/1440886333.db2.gz	ZCCZGQLGGWEXOZ-MRXNPFEDSA-N	0	3	330.447	3.216	20	30		EGEDHN
C[C@H](CN(C)C(=O)[C@@H]1C[C@H]1c1ccccc1)NCC#Cc1ccccc1	ZINC001755614965	1440888488	/nfs/dbraw/zinc/88/84/88/1440888488.db2.gz	RWWAGQSMGDDRIP-BVYCBKJFSA-N	0	3	346.474	3.278	20	30		EGEDHN
C[C@H]1[C@H](NCc2ccc(C#N)c(F)c2)CCN1C(=O)CCC1(C)CC1	ZINC001755665234	1440893378	/nfs/dbraw/zinc/89/33/78/1440893378.db2.gz	UWSOTBDTSDOKAF-KBXCAEBGSA-N	0	3	343.446	3.357	20	30		EGEDHN
C[C@H]1C[C@H](NCc2ccc(F)c(F)c2)CN1C(=O)C#CC(C)(C)C	ZINC001755679290	1440894924	/nfs/dbraw/zinc/89/49/24/1440894924.db2.gz	VICVVPXTINUSKB-ZFWWWQNUSA-N	0	3	334.410	3.093	20	30		EGEDHN
C#CCN1CC[C@@]2(NC(=O)CC(C3CCC3)C3CCC3)CCC[C@@H]12	ZINC001755700809	1440900071	/nfs/dbraw/zinc/90/00/71/1440900071.db2.gz	LACZUMPKMCECLM-CTNGQTDRSA-N	0	3	328.500	3.339	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H]3CCC[C@@H](NCc4ccon4)[C@H]3C2)CCC1	ZINC001755709917	1440903401	/nfs/dbraw/zinc/90/34/01/1440903401.db2.gz	XBPITDMURSEGKI-RYQLBKOJSA-N	0	3	343.471	3.138	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)CC(F)(F)C(F)(F)F)[C@H]1C	ZINC001755721788	1440907829	/nfs/dbraw/zinc/90/78/29/1440907829.db2.gz	CYHFAKFJNICQMF-MNOVXSKESA-N	0	3	328.325	3.119	20	30		EGEDHN
C=CCOCCN1CCC[C@H](NC(=O)C2CCC(C)(C)CC2)[C@@H]1C	ZINC001755724378	1440908852	/nfs/dbraw/zinc/90/88/52/1440908852.db2.gz	XAEPMEPZKFSNDU-WMZOPIPTSA-N	0	3	336.520	3.375	20	30		EGEDHN
CC1(C)CN(C(=O)[C@@]2(C)C=CCC2)C[C@H]1NCC#Cc1ccccc1	ZINC001755773841	1440917154	/nfs/dbraw/zinc/91/71/54/1440917154.db2.gz	JZYSHELKSQZZFG-KNQAVFIVSA-N	0	3	336.479	3.221	20	30		EGEDHN
CC[C@@H](C)C(=O)N[C@@H](CNCc1cc(C#N)ccc1OC)C(C)(C)C	ZINC001755818590	1440924918	/nfs/dbraw/zinc/92/49/18/1440924918.db2.gz	OVGBEKXBAPAFIG-KDOFPFPSSA-N	0	3	345.487	3.233	20	30		EGEDHN
C#CCCCC(=O)N[C@H](CNCc1cccc(Cl)n1)C(C)(C)C	ZINC001755823668	1440926498	/nfs/dbraw/zinc/92/64/98/1440926498.db2.gz	KJFLXCZPGFNSEB-OAHLLOKOSA-N	0	3	335.879	3.159	20	30		EGEDHN
C=C(Br)CNC[C@H](NC(=O)C1(F)CCCC1)C(C)(C)C	ZINC001755827158	1440927612	/nfs/dbraw/zinc/92/76/12/1440927612.db2.gz	GPPRFMYGQUEEJA-LBPRGKRZSA-N	0	3	349.288	3.298	20	30		EGEDHN
CC#CCN1CCC([C@@H](C)NC(=O)[C@@]2(C)C[C@@H]2c2ccccc2)CC1	ZINC001755845099	1440933013	/nfs/dbraw/zinc/93/30/13/1440933013.db2.gz	WHRMYTODVGPBGR-ZNLUXHQJSA-N	0	3	338.495	3.420	20	30		EGEDHN
CC(C)c1cccc(CN2CCC([C@H](C)NC(=O)[C@H](C)C#N)CC2)n1	ZINC001755847606	1440933769	/nfs/dbraw/zinc/93/37/69/1440933769.db2.gz	MZYFAJRMLMWLJC-CVEARBPZSA-N	0	3	342.487	3.081	20	30		EGEDHN
C=CCOCCN1CC=C(CNC(=O)c2ccc(Cl)cc2C)CC1	ZINC001755892350	1440941730	/nfs/dbraw/zinc/94/17/30/1440941730.db2.gz	GVDVSXCNNIGYLU-UHFFFAOYSA-N	0	3	348.874	3.213	20	30		EGEDHN
COc1cccc([C@H](CNCc2cccc(C#N)c2)N2CCCC2)c1	ZINC000053096462	214163448	/nfs/dbraw/zinc/16/34/48/214163448.db2.gz	QKJQPDITRNHMPQ-NRFANRHFSA-N	0	3	335.451	3.494	20	30		EGEDHN
CN(C(=O)Cc1ccc(C#N)cc1)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000173700455	231009444	/nfs/dbraw/zinc/00/94/44/231009444.db2.gz	DPPQYTADKMSSNB-OAQYLSRUSA-N	0	3	347.462	3.224	20	30		EGEDHN
C[C@H](NCCCS(=O)(=O)Cc1ccccc1)c1cccc(C#N)c1	ZINC000181543579	234224535	/nfs/dbraw/zinc/22/45/35/234224535.db2.gz	NSTWNFCYEOYQSI-INIZCTEOSA-N	0	3	342.464	3.214	20	30		EGEDHN
Cn1cc(CNc2ccc(CCN3CCSCC3)cc2)cc1C#N	ZINC000191417923	239100181	/nfs/dbraw/zinc/10/01/81/239100181.db2.gz	SKXLGYJFWOWGGW-UHFFFAOYSA-N	0	3	340.496	3.100	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(Cc3ccc(C#N)cc3)CC2)cc1	ZINC000022804761	212324863	/nfs/dbraw/zinc/32/48/63/212324863.db2.gz	MWYPYULOMHRJCP-UHFFFAOYSA-N	0	3	330.435	3.138	20	30		EGEDHN
C[C@H](C(=O)N(CCN(C)C)Cc1cccc(C#N)c1)c1cccs1	ZINC000078121372	217024522	/nfs/dbraw/zinc/02/45/22/217024522.db2.gz	FSMJUUJBPNGMCK-HNNXBMFYSA-N	0	3	341.480	3.314	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(Cc2cccc(F)c2)C(C)C)CC1	ZINC000264340008	246374102	/nfs/dbraw/zinc/37/41/02/246374102.db2.gz	IGNAWZHJVNZFJC-UHFFFAOYSA-N	0	3	333.451	3.396	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(CC)Cc2c(F)cccc2F)CC1	ZINC000264346404	246382045	/nfs/dbraw/zinc/38/20/45/246382045.db2.gz	KLYWYVAKZBNAFD-UHFFFAOYSA-N	0	3	337.414	3.147	20	30		EGEDHN
Cc1ccccc1CN1CCCN(C[C@@H](O)c2ccc(C#N)cc2)CC1	ZINC000378150309	169077002	/nfs/dbraw/zinc/07/70/02/169077002.db2.gz	OCRFTWHYZKFALZ-JOCHJYFZSA-N	0	3	349.478	3.108	20	30		EGEDHN
N#Cc1c2c(sc1NC(=O)CCN1CC3CCC1CC3)CCC2	ZINC000378377605	169109669	/nfs/dbraw/zinc/10/96/69/169109669.db2.gz	CJVBKTWDTMGMLY-UHFFFAOYSA-N	0	3	329.469	3.311	20	30		EGEDHN
CC[C@@H](N[C@H]1CCN(c2sccc2C#N)C1=O)c1ccccc1	ZINC000267683603	251252075	/nfs/dbraw/zinc/25/20/75/251252075.db2.gz	MXVLRNMZQCYUEW-CVEARBPZSA-N	0	3	325.437	3.466	20	30		EGEDHN
COc1ccc(CNCCc2nc3c(s2)CCCC3)cc1C#N	ZINC000174388575	533665512	/nfs/dbraw/zinc/66/55/12/533665512.db2.gz	VOHFZXOYNSWOGA-UHFFFAOYSA-N	0	3	327.453	3.234	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N(CCN(C)C)Cc1ccc(F)cc1	ZINC000337848309	141066260	/nfs/dbraw/zinc/06/62/60/141066260.db2.gz	IKJVTVFHYPUBNH-UHFFFAOYSA-N	0	3	339.414	3.210	20	30		EGEDHN
COCCn1cc(CN(Cc2ccc(C#N)cc2)CC(C)C)cn1	ZINC000350626575	141257011	/nfs/dbraw/zinc/25/70/11/141257011.db2.gz	AMPMBJWTCCQVBZ-UHFFFAOYSA-N	0	3	326.444	3.059	20	30		EGEDHN
C[C@@H](NCc1ccc(N2CCO[C@H](C)C2)nc1)c1cccc(C#N)c1	ZINC000245843760	142602743	/nfs/dbraw/zinc/60/27/43/142602743.db2.gz	FCYXQPWOVHEPTN-HZPDHXFCSA-N	0	3	336.439	3.029	20	30		EGEDHN
COc1ccc(C2CCN(C[C@H](O)c3ccc(C#N)cc3)CC2)cc1	ZINC000363836305	144370235	/nfs/dbraw/zinc/37/02/35/144370235.db2.gz	XOHKDCWEQTZEGQ-NRFANRHFSA-N	0	3	336.435	3.480	20	30		EGEDHN
COCC#CCN1CCN(C2c3ccccc3-c3ccccc32)CC1	ZINC000677819714	549337800	/nfs/dbraw/zinc/33/78/00/549337800.db2.gz	NGILJSQEKUUPDW-UHFFFAOYSA-N	0	3	332.447	3.024	20	30		EGEDHN
COc1cc(C#N)ccc1CN(Cc1ccccc1)[C@H](CO)C1CC1	ZINC000121587687	152359679	/nfs/dbraw/zinc/35/96/79/152359679.db2.gz	PYASIKAZFGFFKC-HXUWFJFHSA-N	0	3	336.435	3.340	20	30		EGEDHN
CC[C@@H](N[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O)c1cccs1	ZINC000190603744	153150626	/nfs/dbraw/zinc/15/06/26/153150626.db2.gz	MKAHUPVECVACBF-IAGOWNOFSA-N	0	3	339.464	3.462	20	30		EGEDHN
Cn1cc(CNCc2cc3cc(Br)ccc3[nH]2)cc1C#N	ZINC000191611248	153212185	/nfs/dbraw/zinc/21/21/85/153212185.db2.gz	KVPVESFGRWMBHS-UHFFFAOYSA-N	0	3	343.228	3.430	20	30		EGEDHN
Cc1cccc([C@H](O)CNCc2cn(C)nc2-c2ccc(C#N)cc2)c1	ZINC000305820822	154131772	/nfs/dbraw/zinc/13/17/72/154131772.db2.gz	QHMSAJNRSYTVDX-HXUWFJFHSA-N	0	3	346.434	3.090	20	30		EGEDHN
C[C@H](CNC(=O)Nc1ccc(C#N)c(Cl)c1)N1CCC[C@H](C)C1	ZINC000337372845	154315047	/nfs/dbraw/zinc/31/50/47/154315047.db2.gz	PPRSNQLUCIYKTA-QWHCGFSZSA-N	0	3	334.851	3.454	20	30		EGEDHN
Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@@H]1N2C(=O)c1ccc(C#N)cc1	ZINC000010045348	292354621	/nfs/dbraw/zinc/35/46/21/292354621.db2.gz	QYMDIFHQTYTRQT-ICSRJNTNSA-N	0	3	331.419	3.315	20	30		EGEDHN
CCN(C[C@@H]1CCN(Cc2cc(C#N)cs2)C1)CC(F)(F)F	ZINC000093771197	162024954	/nfs/dbraw/zinc/02/49/54/162024954.db2.gz	AESXVOSSLBTTKI-LBPRGKRZSA-N	0	3	331.407	3.326	20	30		EGEDHN
C[C@H](CNC(=O)CCc1ccc(C#N)cc1)N(C)Cc1ccccc1	ZINC000110349522	162124909	/nfs/dbraw/zinc/12/49/09/162124909.db2.gz	YLQDHRKWDLKZEB-QGZVFWFLSA-N	0	3	335.451	3.128	20	30		EGEDHN
Cc1ccc([O-])c(C[NH2+]C2CCC(Oc3ccccc3C#N)CC2)n1	ZINC000111408711	162154572	/nfs/dbraw/zinc/15/45/72/162154572.db2.gz	GNPALJRISBATIF-UHFFFAOYSA-N	0	3	337.423	3.447	20	30		EGEDHN
Cc1cccc(C(=O)N(CCN(C)C)Cc2cccc(C#N)c2)c1C	ZINC000112821132	162191983	/nfs/dbraw/zinc/19/19/83/162191983.db2.gz	FEWAWLPJZKVOEP-UHFFFAOYSA-N	0	3	335.451	3.379	20	30		EGEDHN
CCN(C)CCNC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1	ZINC000112925397	162198143	/nfs/dbraw/zinc/19/81/43/162198143.db2.gz	ADJHIEUFUFJYOH-UHFFFAOYSA-N	0	3	341.386	3.171	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN(C)CCN(C)c1ccccc1	ZINC000354376244	166012915	/nfs/dbraw/zinc/01/29/15/166012915.db2.gz	BAVUKYAZPYWCMC-UHFFFAOYSA-N	0	3	339.439	3.014	20	30		EGEDHN
C[C@@H](NC[C@@H](c1cccs1)N1CCOCC1)c1cccc(C#N)c1	ZINC000181397786	287032283	/nfs/dbraw/zinc/03/22/83/287032283.db2.gz	JTSQAFJXBCMFNN-QAPCUYQASA-N	0	3	341.480	3.344	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)N[C@@H](C)C1=CCN(C)CC1	ZINC000346105351	164337250	/nfs/dbraw/zinc/33/72/50/164337250.db2.gz	GORHZVIDYCTTFC-ZDUSSCGKSA-N	0	3	339.464	3.462	20	30		EGEDHN
CC[C@H]1CCCCN1CCNC(=O)N[C@@H](C)c1ccc(C#N)cc1	ZINC000354865995	166050960	/nfs/dbraw/zinc/05/09/60/166050960.db2.gz	YTWWOEMXNQWEAA-YJBOKZPZSA-N	0	3	328.460	3.183	20	30		EGEDHN
Cn1cc(CNCc2ccc3c(c2)COC3)c(-c2ccc(C#N)cc2)n1	ZINC000350342339	165032565	/nfs/dbraw/zinc/03/25/65/165032565.db2.gz	OPEOYQFVUQXJSR-UHFFFAOYSA-N	0	3	344.418	3.279	20	30		EGEDHN
C[C@H]1[C@@H](NC(=O)Nc2ccc(C#N)cc2)CCN1Cc1ccccc1	ZINC000359021712	167041290	/nfs/dbraw/zinc/04/12/90/167041290.db2.gz	UFCOVUHVKMPQNS-KXBFYZLASA-N	0	3	334.423	3.343	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H]1C	ZINC000359832652	167244311	/nfs/dbraw/zinc/24/43/11/167244311.db2.gz	LREULJUOMYMMCA-OXQOHEQNSA-N	0	3	333.435	3.260	20	30		EGEDHN
C[C@]1(CNC(=O)c2cc(C#N)cs2)CCN(Cc2ccccc2)C1	ZINC000367179936	168190114	/nfs/dbraw/zinc/19/01/14/168190114.db2.gz	IMQVAESGDPWXGL-LJQANCHMSA-N	0	3	339.464	3.262	20	30		EGEDHN
COc1cc(CNCc2ccccc2-c2cnn(C)c2)ccc1C#N	ZINC000367261302	168199908	/nfs/dbraw/zinc/19/99/08/168199908.db2.gz	YJNMTGKNHBLMLB-UHFFFAOYSA-N	0	3	332.407	3.257	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)NCc2cccc(C#N)c2)CN1Cc1ccccc1	ZINC000123089902	222213836	/nfs/dbraw/zinc/21/38/36/222213836.db2.gz	XPHVBZGGZZMZFI-JXFKEZNVSA-N	0	3	348.450	3.020	20	30		EGEDHN
C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)NCc1ccc(C#N)s1	ZINC000421348664	269830517	/nfs/dbraw/zinc/83/05/17/269830517.db2.gz	GJBMECZMYDJDSN-NSHDSACASA-N	0	3	344.396	3.035	20	30		EGEDHN
N#Cc1cnc2ccccc2c1N1CCN(CCc2ccccc2)CC1	ZINC000301134287	270043440	/nfs/dbraw/zinc/04/34/40/270043440.db2.gz	WZBCMJFIPKUDEQ-UHFFFAOYSA-N	0	3	342.446	3.471	20	30		EGEDHN
N#Cc1nc(NCC2(N3CCSCC3)CCCC2)ccc1Cl	ZINC000301169209	270043675	/nfs/dbraw/zinc/04/36/75/270043675.db2.gz	JAYUXFNNBMUXAQ-UHFFFAOYSA-N	0	3	336.892	3.380	20	30		EGEDHN
N#Cc1ccc(CN2CCC(N[C@H]3COCc4ccccc43)CC2)cc1	ZINC000417367624	270047977	/nfs/dbraw/zinc/04/79/77/270047977.db2.gz	PXYKXLYXWMWPLV-QFIPXVFZSA-N	0	3	347.462	3.384	20	30		EGEDHN
CCC[C@H](CCc1ccccc1)N[C@H](C(N)=O)c1ccc(C#N)cc1	ZINC000439602075	270051851	/nfs/dbraw/zinc/05/18/51/270051851.db2.gz	FBOFVWYGDDTPQI-UXHICEINSA-N	0	3	335.451	3.476	20	30		EGEDHN
CCCN(C)[C@H](CNc1nccc(C#N)n1)c1ccc(Cl)cc1	ZINC000450522128	270053001	/nfs/dbraw/zinc/05/30/01/270053001.db2.gz	WKOKDJAZABKRFC-MRXNPFEDSA-N	0	3	329.835	3.497	20	30		EGEDHN
CC[C@H](C)N(CC(=O)NCc1ccc(C#N)cc1)Cc1ccccc1	ZINC000507706460	270058930	/nfs/dbraw/zinc/05/89/30/270058930.db2.gz	IOMMZGKBQHQUIA-KRWDZBQOSA-N	0	3	335.451	3.475	20	30		EGEDHN
N#Cc1ccccc1OCCN[C@@H]1CCO[C@@H]1c1ccc(F)c(F)c1	ZINC000192137641	265948623	/nfs/dbraw/zinc/94/86/23/265948623.db2.gz	IYJSHLOUKNBILI-IEBWSBKVSA-N	0	3	344.361	3.335	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)c1cc(C#N)oc1C)c1ccsc1	ZINC000280526418	266119924	/nfs/dbraw/zinc/11/99/24/266119924.db2.gz	GICQGBQLYJGIBF-INIZCTEOSA-N	0	3	331.441	3.334	20	30		EGEDHN
CCN(C[C@@H](O)COCc1ccco1)[C@@H](C)c1ccc(C#N)cc1	ZINC000193726964	266131878	/nfs/dbraw/zinc/13/18/78/266131878.db2.gz	PRAIWGFBDZGIEW-MAUKXSAKSA-N	0	3	328.412	3.112	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)Cc1ccc(C#N)cc1)c1ccccc1	ZINC000194714895	266139018	/nfs/dbraw/zinc/13/90/18/266139018.db2.gz	VUYALLUSDZNSJW-FQEVSTJZSA-N	0	3	335.451	3.300	20	30		EGEDHN
CCN1CCO[C@@H](CNCc2ccc(C#N)s2)[C@@H]1c1ccccc1	ZINC000284781603	266153862	/nfs/dbraw/zinc/15/38/62/266153862.db2.gz	QKZHPJNWCDEWSH-OALUTQOASA-N	0	3	341.480	3.171	20	30		EGEDHN
CCCCNC(=O)[C@H]1CC[C@@H](C)N(Cc2ccc(C#N)c(C)c2)C1	ZINC000486702495	267009671	/nfs/dbraw/zinc/00/96/71/267009671.db2.gz	BTMSFETWFHXZPL-APWZRJJASA-N	0	3	327.472	3.384	20	30		EGEDHN
C[C@@H]1CC/C(=C\C(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)C1	ZINC000267852824	267011773	/nfs/dbraw/zinc/01/17/73/267011773.db2.gz	LQAVDLCRDSODFM-CXDFQFJYSA-N	0	3	325.456	3.195	20	30		EGEDHN
CCCc1[nH]ccc1C(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000421757741	267040076	/nfs/dbraw/zinc/04/00/76/267040076.db2.gz	OPKLFGNQOMPFBG-UHFFFAOYSA-N	0	3	338.455	3.043	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)N(C)[C@@H](C)C1CCN(C)CC1	ZINC000273499376	267049130	/nfs/dbraw/zinc/04/91/30/267049130.db2.gz	QFHNPGWOMWBEFF-AWEZNQCLSA-N	0	3	344.459	3.151	20	30		EGEDHN
C[C@H](NC(=O)C(C#N)Cc1ccc(C#N)cc1)c1cccc([N+](=O)[O-])c1	ZINC000348125462	267175712	/nfs/dbraw/zinc/17/57/12/267175712.db2.gz	WMDCGKOJPOCKHJ-SUMWQHHRSA-N	0	3	348.362	3.026	20	30		EGEDHN
C[C@H](NC(=O)c1c(F)cc(C#N)cc1F)[C@H](c1ccccc1)N(C)C	ZINC000274617065	267262394	/nfs/dbraw/zinc/26/23/94/267262394.db2.gz	LHCBQOGAHXPXSK-KPZWWZAWSA-N	0	3	343.377	3.258	20	30		EGEDHN
CN(C)CCOc1cccc(NC(=O)C2(c3cccc(C#N)c3)CC2)c1	ZINC000435040092	267281401	/nfs/dbraw/zinc/28/14/01/267281401.db2.gz	KCWVOAPNSYUSRV-UHFFFAOYSA-N	0	3	349.434	3.169	20	30		EGEDHN
CN(C)CCOc1ccc(CNc2c(C#N)cccc2[N+](=O)[O-])cc1	ZINC000425206009	267281493	/nfs/dbraw/zinc/28/14/93/267281493.db2.gz	KIKNGSGMNDNQHQ-UHFFFAOYSA-N	0	3	340.383	3.019	20	30		EGEDHN
CN(C)[C@@H](CNC(=O)C1(c2cccc(C#N)c2)CC1)c1ccccc1	ZINC000435032414	267286406	/nfs/dbraw/zinc/28/64/06/267286406.db2.gz	FOISPTRPVIBXCP-IBGZPJMESA-N	0	3	333.435	3.009	20	30		EGEDHN
Cc1cc(NC2CCN(Cc3ccc(C#N)cc3)CC2)ccc1C(N)=O	ZINC000280794416	267347722	/nfs/dbraw/zinc/34/77/22/267347722.db2.gz	RIWSDJHPGGVLKQ-UHFFFAOYSA-N	0	3	348.450	3.042	20	30		EGEDHN
COC(=O)[C@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@@H]1c1ccccc1	ZINC000452006324	267389541	/nfs/dbraw/zinc/38/95/41/267389541.db2.gz	NWXPVAJCCDYHEU-MSOLQXFVSA-N	0	3	338.382	3.086	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@@H]2C[C@@H]2c2cccc(F)c2)cc1	ZINC000279453541	268092026	/nfs/dbraw/zinc/09/20/26/268092026.db2.gz	ZQKHFSQDNHZEDB-BHIYHBOVSA-N	0	3	333.366	3.052	20	30		EGEDHN
Cc1oc(NC(=O)CN[C@H](C)CCCc2cccnc2)c(C#N)c1C	ZINC000459642014	268105193	/nfs/dbraw/zinc/10/51/93/268105193.db2.gz	MZAJPULYLAZPEX-CYBMUJFWSA-N	0	3	340.427	3.103	20	30		EGEDHN
Cc1oc([N-]C(=O)C[NH2+][C@H](C)CCCc2cccnc2)c(C#N)c1C	ZINC000459642014	268105195	/nfs/dbraw/zinc/10/51/95/268105195.db2.gz	MZAJPULYLAZPEX-CYBMUJFWSA-N	0	3	340.427	3.103	20	30		EGEDHN
N#Cc1cccc([N+](=O)[O-])c1N1CCCN(Cc2ccccc2)CC1	ZINC000425206476	268292518	/nfs/dbraw/zinc/29/25/18/268292518.db2.gz	JWQWNANJTXIJIP-UHFFFAOYSA-N	0	3	336.395	3.179	20	30		EGEDHN
N#Cc1cccc2c1CCN2C(=O)C1CCN(Cc2ccccc2)CC1	ZINC000421649437	268293999	/nfs/dbraw/zinc/29/39/99/268293999.db2.gz	CZLISTVNRLHHTQ-UHFFFAOYSA-N	0	3	345.446	3.360	20	30		EGEDHN
CC(C)[C@@H]1CN(Cc2cn(C)nc2-c2ccc(C#N)cc2)CCCO1	ZINC000293297357	269631091	/nfs/dbraw/zinc/63/10/91/269631091.db2.gz	WIIYOTPEXHCQFX-IBGZPJMESA-N	0	3	338.455	3.206	20	30		EGEDHN
CCN1CCCC[C@@H]1CNc1cc(C#N)c2cc([N+](=O)[O-])ccc2n1	ZINC000301546311	269654729	/nfs/dbraw/zinc/65/47/29/269654729.db2.gz	PBPRTXHCWWFIAZ-OAHLLOKOSA-N	0	3	339.399	3.301	20	30		EGEDHN
CN1CCC2(CCCN2C(=O)Nc2ccc(C#N)c(Cl)c2)CC1	ZINC000361156465	273872739	/nfs/dbraw/zinc/87/27/39/273872739.db2.gz	HQWAGUYJGOYFFW-UHFFFAOYSA-N	0	3	332.835	3.304	20	30		EGEDHN
CN(C)[C@@H](CNC(=O)CSc1ccc(C#N)cc1)c1ccccc1	ZINC000065829935	307360253	/nfs/dbraw/zinc/36/02/53/307360253.db2.gz	GDEGBJNIFOILTR-SFHVURJKSA-N	0	3	339.464	3.069	20	30		EGEDHN
CC[C@@H](C)C[C@H](C)NC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000074788176	307395929	/nfs/dbraw/zinc/39/59/29/307395929.db2.gz	ATPNZMFISQZPRS-SJORKVTESA-N	0	3	344.503	3.456	20	30		EGEDHN
CC[C@H](C)C[C@@H](C)NC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000074788172	307395971	/nfs/dbraw/zinc/39/59/71/307395971.db2.gz	ATPNZMFISQZPRS-DLBZAZTESA-N	0	3	344.503	3.456	20	30		EGEDHN
COC(=O)[C@@H](C)[C@@H](NCCOc1cccc(C#N)c1)c1ccccc1	ZINC000079923779	307429923	/nfs/dbraw/zinc/42/99/23/307429923.db2.gz	OIFNSZQUDMWETF-HNAYVOBHSA-N	0	3	338.407	3.077	20	30		EGEDHN
Cc1ccc(NC(=O)/C=C\c2cccc(C#N)c2)c(OCCN(C)C)c1	ZINC000255660644	308056979	/nfs/dbraw/zinc/05/69/79/308056979.db2.gz	SHXCWOPYZJTQQO-NTMALXAHSA-N	0	3	349.434	3.459	20	30		EGEDHN
CN(C)[C@H](CNc1nc2c(cc1C#N)CCCC2)Cc1ccccc1	ZINC000535254103	314034427	/nfs/dbraw/zinc/03/44/27/314034427.db2.gz	BINHOVPICFBODE-IBGZPJMESA-N	0	3	334.467	3.417	20	30		EGEDHN
Cc1ccc(NC(=O)CCN[C@H]2CCCc3cc(C#N)ccc32)nc1	ZINC000553293903	315255428	/nfs/dbraw/zinc/25/54/28/315255428.db2.gz	OQTGBHZUNYWPOC-SFHVURJKSA-N	0	3	334.423	3.258	20	30		EGEDHN
C[C@@H](OC[C@H](O)CNCc1ccc(C#N)cc1)c1ccc(Cl)cc1	ZINC000564845081	316216644	/nfs/dbraw/zinc/21/66/44/316216644.db2.gz	PTPOYPGYKPFINW-AUUYWEPGSA-N	0	3	344.842	3.440	20	30		EGEDHN
Cc1ccc(Cl)c(OC[C@@H](O)CNCc2ccc(C#N)s2)c1	ZINC000564856532	316219861	/nfs/dbraw/zinc/21/98/61/316219861.db2.gz	HMFONFHXEVARBT-LBPRGKRZSA-N	0	3	336.844	3.111	20	30		EGEDHN
CCC[C@H]1CN(c2ccc(C#N)c(N)n2)CCN1Cc1ccccc1	ZINC000565372617	316316535	/nfs/dbraw/zinc/31/65/35/316316535.db2.gz	PPYLTJHCVXIKAS-SFHVURJKSA-N	0	3	335.455	3.026	20	30		EGEDHN
CN(C)CCOc1ccccc1CNc1ccc2cc(C#N)ccc2n1	ZINC000568339170	316760391	/nfs/dbraw/zinc/76/03/91/316760391.db2.gz	ZALDCLPBHZAFBB-UHFFFAOYSA-N	0	3	346.434	3.081	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN[C@H]2CCSc3ccccc32)cc1	ZINC000568971724	316847747	/nfs/dbraw/zinc/84/77/47/316847747.db2.gz	IUABNRKJYGLVFN-QAPCUYQASA-N	0	3	340.448	3.125	20	30		EGEDHN
N#Cc1ccc([C@H](N[C@@H]2CCC[C@H](c3ccccc3)C2)C(N)=O)cc1	ZINC000574738982	317631529	/nfs/dbraw/zinc/63/15/29/317631529.db2.gz	GUVDXMXROXRJNH-ZCNNSNEGSA-N	0	3	333.435	3.401	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)o1)Oc1ccccc1Br	ZINC000176990700	323335364	/nfs/dbraw/zinc/33/53/64/323335364.db2.gz	GVPGWXJNVDYGQY-LLVKDONJSA-N	0	3	335.201	3.471	20	30		EGEDHN
CC(F)(F)c1ccc(CNC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000581812065	325390918	/nfs/dbraw/zinc/39/09/18/325390918.db2.gz	MDHSHPRDPZECNA-KRWDZBQOSA-N	0	3	346.377	3.199	20	30		EGEDHN
CC(F)(F)c1ccc(CNC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000581812066	325391022	/nfs/dbraw/zinc/39/10/22/325391022.db2.gz	MDHSHPRDPZECNA-QGZVFWFLSA-N	0	3	346.377	3.199	20	30		EGEDHN
CC(C#N)C(=O)N1CCO[C@H](c2cc(F)c(Cl)cc2Cl)C1	ZINC000347138484	457251952	/nfs/dbraw/zinc/25/19/52/457251952.db2.gz	QXKZUPDOJBNULO-SDBXPKJASA-N	0	3	331.174	3.192	20	30		EGEDHN
C=CCS(=O)(=O)CCN[C@@H]1CCC[C@@H]1c1ccccc1Cl	ZINC000368319612	458025620	/nfs/dbraw/zinc/02/56/20/458025620.db2.gz	STMYHIGJGHPSMY-GDBMZVCRSA-N	0	3	327.877	3.167	20	30		EGEDHN
C=CCN1CCC(NC(=O)COc2cc(Cl)cc(Cl)c2)CC1	ZINC000173101650	455232061	/nfs/dbraw/zinc/23/20/61/455232061.db2.gz	XBTDRYVZPZRNMQ-UHFFFAOYSA-N	0	3	343.254	3.139	20	30		EGEDHN
C=CCCSCCN[C@@H](C)c1ccc(S(C)(=O)=O)c(OC)c1	ZINC000595058291	459230077	/nfs/dbraw/zinc/23/00/77/459230077.db2.gz	GSNRUVBWWAUBIC-ZDUSSCGKSA-N	0	3	343.514	3.059	20	30		EGEDHN
C=CC[C@@H](C)[C@@H](C)NCc1ccc(S(=O)(=O)N(CC)CC)s1	ZINC000539083317	459374594	/nfs/dbraw/zinc/37/45/94/459374594.db2.gz	LLILZHSXJPVDAS-ZIAGYGMSSA-N	0	3	344.546	3.469	20	30		EGEDHN
Cc1ccccc1[C@H](CC(C)C)NCC(=O)N[C@@](C)(C#N)C1CC1	ZINC000183238778	455258385	/nfs/dbraw/zinc/25/83/85/455258385.db2.gz	QXPLUKAIJGGMJO-ICSRJNTNSA-N	0	3	327.472	3.480	20	30		EGEDHN
C#CCCCNC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000173318344	455264674	/nfs/dbraw/zinc/26/46/74/455264674.db2.gz	FMIURECGSYJRGX-PKOBYXMFSA-N	0	3	327.472	3.094	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1NCc1ccc(OCC#N)cc1	ZINC000183318033	455276392	/nfs/dbraw/zinc/27/63/92/455276392.db2.gz	UKVAQIZYMVFVCS-DLBZAZTESA-N	0	3	345.443	3.124	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1NCc1ccc(OCC#N)cc1	ZINC000183318056	455276616	/nfs/dbraw/zinc/27/66/16/455276616.db2.gz	UKVAQIZYMVFVCS-IRXDYDNUSA-N	0	3	345.443	3.124	20	30		EGEDHN
CN(CC#Cc1ccc(OC(F)(F)F)cc1)CCCn1ccnc1	ZINC000181109907	455289071	/nfs/dbraw/zinc/28/90/71/455289071.db2.gz	XDJXVSKBDVBVSZ-UHFFFAOYSA-N	0	3	337.345	3.155	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CCS[C@H](C)[C@H]1C)C(C)C	ZINC000605349497	460569126	/nfs/dbraw/zinc/56/91/26/460569126.db2.gz	YOZXRKJXHFGGTN-BRWVUGGUSA-N	0	3	339.549	3.220	20	30		EGEDHN
Cc1ccsc1[C@@H](C)N[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000190633553	455357662	/nfs/dbraw/zinc/35/76/62/455357662.db2.gz	PJPBJESYPHCXLX-PBHICJAKSA-N	0	3	339.464	3.380	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)N2CCC[C@@](C)(C#N)C2)N(C)C)cc1	ZINC000612357987	460604341	/nfs/dbraw/zinc/60/43/41/460604341.db2.gz	YXALQNOFXPQWSZ-QUCCMNQESA-N	0	3	342.487	3.187	20	30		EGEDHN
COc1ccccc1CN1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC000022850420	453699914	/nfs/dbraw/zinc/69/99/14/453699914.db2.gz	ODGSUTUOTVYPGR-UHFFFAOYSA-N	0	3	335.451	3.275	20	30		EGEDHN
CCOc1ccc(OC[C@H](O)CN[C@H](C)c2ccc(C#N)cc2)cc1	ZINC000030532888	453836425	/nfs/dbraw/zinc/83/64/25/453836425.db2.gz	RNGRSADPFMJMPU-CRAIPNDOSA-N	0	3	340.423	3.047	20	30		EGEDHN
C[C@@H](C(=O)NC1(C#N)CCCCC1)N(C)CCCc1ccccc1	ZINC000052802568	453845177	/nfs/dbraw/zinc/84/51/77/453845177.db2.gz	SWAZYBYLHKOWCE-KRWDZBQOSA-N	0	3	327.472	3.282	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)c1ccc(C#N)cc1)c1ccsc1	ZINC000031987620	453860365	/nfs/dbraw/zinc/86/03/65/453860365.db2.gz	FRVKETHODXYICF-QGZVFWFLSA-N	0	3	327.453	3.433	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(c3ccccc3Br)C2)o1	ZINC000174381962	455384007	/nfs/dbraw/zinc/38/40/07/455384007.db2.gz	JGNGMPHUAIHWHY-LBPRGKRZSA-N	0	3	346.228	3.282	20	30		EGEDHN
C#CCN1CCC(C(=O)NC2(c3ccc(Cl)cc3)CCC2)CC1	ZINC000067233901	453914004	/nfs/dbraw/zinc/91/40/04/453914004.db2.gz	OEGBTLNXGWAXJN-UHFFFAOYSA-N	0	3	330.859	3.181	20	30		EGEDHN
COCCN(CCc1ccc2c(c1)CCO2)Cc1ccc(C#N)cc1	ZINC000075674703	453916836	/nfs/dbraw/zinc/91/68/36/453916836.db2.gz	WUVKCDYEZQXMPJ-UHFFFAOYSA-N	0	3	336.435	3.184	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)c1cc(C#N)cs1	ZINC000084182696	453975389	/nfs/dbraw/zinc/97/53/89/453975389.db2.gz	HUQLERQWVVAIMX-PBHICJAKSA-N	0	3	339.464	3.260	20	30		EGEDHN
C=CCOCCCC(=O)N(Cc1ccccc1)C1CCN(C)CC1	ZINC000084259299	453981293	/nfs/dbraw/zinc/98/12/93/453981293.db2.gz	DFJMQGRICZFUCX-UHFFFAOYSA-N	0	3	330.472	3.092	20	30		EGEDHN
CCCN(CC(=O)Nc1sccc1C#N)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C	ZINC000077321927	454091575	/nfs/dbraw/zinc/09/15/75/454091575.db2.gz	ATTASWCRNBYTDB-IMJJTQAJSA-N	0	3	347.484	3.084	20	30		EGEDHN
COCCOc1ccccc1C([O-])=C(C#N)c1cnc2ccccc2n1	ZINC000190890676	455398511	/nfs/dbraw/zinc/39/85/11/455398511.db2.gz	VYQXGOINXHADHE-HNNXBMFYSA-N	0	3	347.374	3.145	20	30		EGEDHN
COCCOc1ccccc1C(=O)C(C#N)c1cnc2ccccc2n1	ZINC000190890676	455398516	/nfs/dbraw/zinc/39/85/16/455398516.db2.gz	VYQXGOINXHADHE-HNNXBMFYSA-N	0	3	347.374	3.145	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)cc1)C[C@@H](O)COCc1cccs1	ZINC000069520436	454116270	/nfs/dbraw/zinc/11/62/70/454116270.db2.gz	OTEFMLWOOFJGAQ-GOSISDBHSA-N	0	3	344.480	3.408	20	30		EGEDHN
C#CCCCCNC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000160023292	455422885	/nfs/dbraw/zinc/42/28/85/455422885.db2.gz	RLNMXMZLEGSWMC-UHFFFAOYSA-N	0	3	327.472	3.062	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H](C)CC(C)(C)c2ccccc2)CC1	ZINC000070884813	454181554	/nfs/dbraw/zinc/18/15/54/454181554.db2.gz	QREJTVQYARCGMQ-KRWDZBQOSA-N	0	3	326.484	3.204	20	30		EGEDHN
Cc1nc(COc2ccc(CN(C)Cc3ccc(C#N)cc3)cc2)no1	ZINC000131198897	454241172	/nfs/dbraw/zinc/24/11/72/454241172.db2.gz	GJKIPISYXLMODF-UHFFFAOYSA-N	0	3	348.406	3.461	20	30		EGEDHN
CC(C)c1csc(C(C#N)C(=O)c2ccc(-n3ccnn3)cc2)n1	ZINC000089980063	454251869	/nfs/dbraw/zinc/25/18/69/454251869.db2.gz	KBOWTBHVCNBONP-CQSZACIVSA-N	0	3	337.408	3.337	20	30		EGEDHN
C=CCN(CCCN1C(=O)c2ccccc2C1=O)CCc1ccccc1	ZINC000062364245	454375720	/nfs/dbraw/zinc/37/57/20/454375720.db2.gz	JHDHARUUKHZSSI-UHFFFAOYSA-N	0	3	348.446	3.403	20	30		EGEDHN
C[C@@H](C#N)CN(C)C(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1	ZINC000079220260	454383772	/nfs/dbraw/zinc/38/37/72/454383772.db2.gz	KNABULMRUBDGBQ-HOTGVXAUSA-N	0	3	348.516	3.322	20	30		EGEDHN
CN(Cc1cc(C#N)cs1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000091948714	454493254	/nfs/dbraw/zinc/49/32/54/454493254.db2.gz	NMPSMTSOJPVAOE-UHFFFAOYSA-N	0	3	335.473	3.451	20	30		EGEDHN
CCCN(CC(=O)N[C@@](C)(C#N)C1CC1)[C@H]1CCc2ccccc2C1	ZINC000064632614	454495530	/nfs/dbraw/zinc/49/55/30/454495530.db2.gz	HHOVNPNFZKHZHV-FPOVZHCZSA-N	0	3	339.483	3.064	20	30		EGEDHN
C[C@@H](CNC(=O)N[C@@H](C)c1cccc(C#N)c1)N1CCC(C)CC1	ZINC000073897910	454498495	/nfs/dbraw/zinc/49/84/95/454498495.db2.gz	GUERIKXWLSGRPV-HOTGVXAUSA-N	0	3	328.460	3.039	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1SCCCCC#N	ZINC000122177021	454511893	/nfs/dbraw/zinc/51/18/93/454511893.db2.gz	FIPKKKUEQSUJGE-UHFFFAOYSA-N	0	3	333.505	3.278	20	30		EGEDHN
Cc1c(C(=O)C(C#N)c2cc(C)nc(C)n2)cnn1-c1ccccc1C	ZINC000049407081	454546911	/nfs/dbraw/zinc/54/69/11/454546911.db2.gz	MYJHDMUHWXHNPH-MRXNPFEDSA-N	0	3	345.406	3.386	20	30		EGEDHN
Cc1nnc(N[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)c(C#N)c1C	ZINC000080230635	454552805	/nfs/dbraw/zinc/55/28/05/454552805.db2.gz	ZXJKOQPIYLCZMP-KDOFPFPSSA-N	0	3	335.455	3.430	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)NC[C@H](C)N1CCC(C)CC1	ZINC000065417087	454562922	/nfs/dbraw/zinc/56/29/22/454562922.db2.gz	AYULDSNQMXYSGW-HNNXBMFYSA-N	0	3	344.459	3.199	20	30		EGEDHN
COc1ccc(CN(C)C[C@@H]2CCCCO2)cc1OCCCC#N	ZINC000092428668	454564669	/nfs/dbraw/zinc/56/46/69/454564669.db2.gz	YNQSGLFFPXHXHG-KRWDZBQOSA-N	0	3	332.444	3.379	20	30		EGEDHN
CN(Cc1cn(CCC#N)nc1-c1ccccc1)C[C@H]1CCCCO1	ZINC000092427496	454565385	/nfs/dbraw/zinc/56/53/85/454565385.db2.gz	MWHSUXIPZCSWJE-LJQANCHMSA-N	0	3	338.455	3.465	20	30		EGEDHN
C=CCOc1ccc(CNCc2ccc([S@](C)=O)cc2)cc1OC	ZINC000080343218	454568527	/nfs/dbraw/zinc/56/85/27/454568527.db2.gz	JTHNZLFGEMFPEX-XMMPIXPASA-N	0	3	345.464	3.287	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)OC(C)(C)C)CCN1Cc1ccc(C#N)cc1	ZINC000134641554	454573129	/nfs/dbraw/zinc/57/31/29/454573129.db2.gz	JBFHLCWEXSORQD-WMLDXEAASA-N	0	3	329.444	3.436	20	30		EGEDHN
CC(C)c1csc(C(C#N)C(=O)c2ccc(NC(N)=O)cc2)n1	ZINC000080450962	454583487	/nfs/dbraw/zinc/58/34/87/454583487.db2.gz	VGXOGVKYOJTLIO-LBPRGKRZSA-N	0	3	328.397	3.247	20	30		EGEDHN
Cc1nnc(NC[C@@H](c2ccc(Cl)cc2)N(C)C)c(C#N)c1C	ZINC000080699654	454621551	/nfs/dbraw/zinc/62/15/51/454621551.db2.gz	KIOJKOZVQZRPOP-INIZCTEOSA-N	0	3	329.835	3.333	20	30		EGEDHN
Cc1nc(C(C)C)sc1[C@H](C)N(C)CCC(=O)N(C)CCC#N	ZINC000092807650	454636941	/nfs/dbraw/zinc/63/69/41/454636941.db2.gz	XKQMOKXPMIJBKQ-AWEZNQCLSA-N	0	3	336.505	3.330	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)CCCc1ccccc1	ZINC000065930475	454640676	/nfs/dbraw/zinc/64/06/76/454640676.db2.gz	GDEQHEOGJVHHPK-UHFFFAOYSA-N	0	3	349.478	3.471	20	30		EGEDHN
COc1ccc(CN2CC[C@H]3[C@H](CCCN3C3CC3)C2)cc1C#N	ZINC000135217580	454648456	/nfs/dbraw/zinc/64/84/56/454648456.db2.gz	MLRRCRHILBKALL-APWZRJJASA-N	0	3	325.456	3.016	20	30		EGEDHN
N#Cc1cccc(OCCN2CCC[C@H](C(=O)Nc3ccccc3)C2)c1	ZINC000052315308	454667634	/nfs/dbraw/zinc/66/76/34/454667634.db2.gz	OSDWATBSZXSGMI-SFHVURJKSA-N	0	3	349.434	3.288	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Cc2coc(-c3cccs3)n2)CC1	ZINC000106035152	454674307	/nfs/dbraw/zinc/67/43/07/454674307.db2.gz	CDNOEEMXWIAHPB-UHFFFAOYSA-N	0	3	345.468	3.102	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(OC(F)(F)F)cc2)CC1	ZINC000106040085	454675883	/nfs/dbraw/zinc/67/58/83/454675883.db2.gz	ZUIHVWNHLLNCNB-UHFFFAOYSA-N	0	3	342.361	3.356	20	30		EGEDHN
COCC1CCN(Cc2ccc(OC)c(OCCCC#N)c2)CC1	ZINC000093103782	454683438	/nfs/dbraw/zinc/68/34/38/454683438.db2.gz	XERSIWNESJVIPL-UHFFFAOYSA-N	0	3	332.444	3.236	20	30		EGEDHN
C=CCN(C)C(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1	ZINC000161690549	454714658	/nfs/dbraw/zinc/71/46/58/454714658.db2.gz	UONGIGDULPVKSD-INIZCTEOSA-N	0	3	326.362	3.085	20	30		EGEDHN
COc1ccccc1N(CCC#N)C(=O)[C@@H](C)N1C[C@H]2CCC[C@@H]2C1	ZINC000152764624	454722278	/nfs/dbraw/zinc/72/22/78/454722278.db2.gz	XDQVNLQTRNJQKX-BRWVUGGUSA-N	0	3	341.455	3.062	20	30		EGEDHN
COc1ccccc1N(CCC#N)C(=O)[C@H](C)N1C[C@H]2CCC[C@@H]2C1	ZINC000152764507	454722782	/nfs/dbraw/zinc/72/27/82/454722782.db2.gz	XDQVNLQTRNJQKX-GVDBMIGSSA-N	0	3	341.455	3.062	20	30		EGEDHN
CCN1CCC[C@@H]1CN(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000176293137	454724075	/nfs/dbraw/zinc/72/40/75/454724075.db2.gz	IZULUFYZNDPUEM-QGZVFWFLSA-N	0	3	328.460	3.436	20	30		EGEDHN
COCCOc1ccc(CN[C@H](C)c2ccc(OCC#N)cc2)cc1	ZINC000107317719	454751493	/nfs/dbraw/zinc/75/14/93/454751493.db2.gz	SGYDQGJIEHGDNN-MRXNPFEDSA-N	0	3	340.423	3.465	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCc2ccc(C)cc2SC)CC1	ZINC000176586816	454761673	/nfs/dbraw/zinc/76/16/73/454761673.db2.gz	RPTCFFQEQPBYLJ-UHFFFAOYSA-N	0	3	333.501	3.167	20	30		EGEDHN
CN(CCCc1[nH]nc(N)c1C#N)Cc1ccc(Cl)c(Cl)c1	ZINC000153286735	454778480	/nfs/dbraw/zinc/77/84/80/454778480.db2.gz	VTGUVTGDIOWLPM-UHFFFAOYSA-N	0	3	338.242	3.235	20	30		EGEDHN
COc1ccc([C@@H](CNCc2ccc(C#N)s2)N(C)C)cc1OC	ZINC000176941668	454801054	/nfs/dbraw/zinc/80/10/54/454801054.db2.gz	AWSIVZAGFFIVFE-MRXNPFEDSA-N	0	3	345.468	3.029	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC[C@H]1CCCN(Cc2cccs2)C1	ZINC000139955457	454813714	/nfs/dbraw/zinc/81/37/14/454813714.db2.gz	FPLQYTCCQJDSBM-HZPDHXFCSA-N	0	3	336.501	3.058	20	30		EGEDHN
Cc1cccc([C@H]2CCCN2CCC(=O)Nc2ccc(C#N)cc2)n1	ZINC000140286383	454818740	/nfs/dbraw/zinc/81/87/40/454818740.db2.gz	ULEHCKRSFIEFOR-LJQANCHMSA-N	0	3	334.423	3.427	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)NCc2ccc(C#N)cc2)CN1Cc1ccccc1	ZINC000177210957	454837585	/nfs/dbraw/zinc/83/75/85/454837585.db2.gz	SZQDZNXGYWQDFV-UZLBHIALSA-N	0	3	348.450	3.020	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CCC[C@@H]1c1ccncc1	ZINC000154033466	454858989	/nfs/dbraw/zinc/85/89/89/454858989.db2.gz	DPMFLFMOAOEKRO-WOJBJXKFSA-N	0	3	338.451	3.387	20	30		EGEDHN
O=C(NCCN1CCCCC1)Nc1cccc(C#Cc2ccccn2)c1	ZINC000111770411	454875353	/nfs/dbraw/zinc/87/53/53/454875353.db2.gz	NBPRBCVJKOKYLE-UHFFFAOYSA-N	0	3	348.450	3.089	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)C(=O)NC[C@H]1CCCCN1CC	ZINC000111883745	454877453	/nfs/dbraw/zinc/87/74/53/454877453.db2.gz	FLRSOFCFOHFHAO-GOSISDBHSA-N	0	3	345.487	3.267	20	30		EGEDHN
N#Cc1cc(N2CCN(c3ccncc3)CC2)ccc1C(F)(F)F	ZINC000165169518	454896132	/nfs/dbraw/zinc/89/61/32/454896132.db2.gz	CPVLGZRWLAISBQ-UHFFFAOYSA-N	0	3	332.329	3.299	20	30		EGEDHN
C=CCOc1cccc(NC(=O)N2[C@@H]3CC[C@H]2CN(CC)CC3)c1	ZINC000177798293	454906682	/nfs/dbraw/zinc/90/66/82/454906682.db2.gz	VBDGKPQQSKYAQN-SJORKVTESA-N	0	3	329.444	3.342	20	30		EGEDHN
CN(CCNc1ccc([N+](=O)[O-])c(C#N)c1)Cc1ccc(F)cc1	ZINC000167009345	454917555	/nfs/dbraw/zinc/91/75/55/454917555.db2.gz	KTKLTYWITZWKAY-UHFFFAOYSA-N	0	3	328.347	3.149	20	30		EGEDHN
C#CCCOc1ccc(CN[C@H](C)c2ccc(NC(N)=O)cc2)cc1	ZINC000113351764	454924037	/nfs/dbraw/zinc/92/40/37/454924037.db2.gz	YCUGKHFWZFLIPD-OAHLLOKOSA-N	0	3	337.423	3.430	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCc1ccccc1CN1CCC(O)CC1	ZINC000151065901	454931992	/nfs/dbraw/zinc/93/19/92/454931992.db2.gz	BLVHWKAOOBMBFZ-UHFFFAOYSA-N	0	3	342.483	3.028	20	30		EGEDHN
N#Cc1cccc(NC(=O)NC[C@H]2CCCN2Cc2ccccc2)c1	ZINC000114778769	454977769	/nfs/dbraw/zinc/97/77/69/454977769.db2.gz	VFFOKDVPRXUPBH-LJQANCHMSA-N	0	3	334.423	3.344	20	30		EGEDHN
N#Cc1ccc(CN(C[C@@H](O)c2cccc([N+](=O)[O-])c2)C2CC2)cc1	ZINC000178857972	454985327	/nfs/dbraw/zinc/98/53/27/454985327.db2.gz	WIXOLPLIRNUBIF-LJQANCHMSA-N	0	3	337.379	3.164	20	30		EGEDHN
COC(=O)[C@H](C)[C@@H](NCCOc1ccccc1C#N)c1ccccc1	ZINC000152136910	455077998	/nfs/dbraw/zinc/07/79/98/455077998.db2.gz	IKOQSSQMQGMLOA-DNVCBOLYSA-N	0	3	338.407	3.077	20	30		EGEDHN
Cn1cc(CN2CCC[C@@H](c3cc[nH]n3)C2)c(-c2ccc(C#N)cc2)n1	ZINC000179944435	455103464	/nfs/dbraw/zinc/10/34/64/455103464.db2.gz	RHQIFXJEBGPEPN-QGZVFWFLSA-N	0	3	346.438	3.061	20	30		EGEDHN
CCCCNC(=O)[C@@H]1CC[C@@H](C)N(Cc2cc(C#N)ccc2OC)C1	ZINC000156359889	455109448	/nfs/dbraw/zinc/10/94/48/455109448.db2.gz	ZODFPCYJFKEHLP-NVXWUHKLSA-N	0	3	343.471	3.084	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1CC[C@H](c2ccccc2)[C@H](C)C1	ZINC000129846697	455129092	/nfs/dbraw/zinc/12/90/92/455129092.db2.gz	LXBUOKFIMMRFAP-LMMKCTJWSA-N	0	3	327.472	3.120	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN2CCC(OCC3CCCC3)CC2)cc1	ZINC000156673868	455143402	/nfs/dbraw/zinc/14/34/02/455143402.db2.gz	GETXBTCOCDQBLO-FQEVSTJZSA-N	0	3	328.456	3.263	20	30		EGEDHN
C[C@H]1CSCCN1CCC(=O)Nc1sc2c(c1C#N)CCCC2	ZINC000172596068	455164303	/nfs/dbraw/zinc/16/43/03/455164303.db2.gz	FXFGXQFXVUYQCP-LBPRGKRZSA-N	0	3	349.525	3.264	20	30		EGEDHN
Cc1nc(C)c(CN2CCCN(Cc3ccc(C#N)cc3)CC2)s1	ZINC000172742729	455180481	/nfs/dbraw/zinc/18/04/81/455180481.db2.gz	XCXSMTUMMUOWOV-UHFFFAOYSA-N	0	3	340.496	3.340	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC[C@H](Cc2ccccc2)C(C)C)CC1	ZINC000189405446	455191284	/nfs/dbraw/zinc/19/12/84/455191284.db2.gz	IEWFUFPNDIPIDX-IBGZPJMESA-N	0	3	343.515	3.451	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)Cc2c(F)cccc2Cl)CC1	ZINC000264380441	455201556	/nfs/dbraw/zinc/20/15/56/455201556.db2.gz	UHZBXLOQEHQUAB-UHFFFAOYSA-N	0	3	339.842	3.271	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(CC)CCc2cccs2)CC1	ZINC000264393142	455204308	/nfs/dbraw/zinc/20/43/08/455204308.db2.gz	NLKVGCZRZHHQCJ-UHFFFAOYSA-N	0	3	335.517	3.363	20	30		EGEDHN
Cc1nc(C)c([C@H](C)N(C)C[C@@H](O)COc2ccc(C#N)cc2)s1	ZINC000264398465	455205047	/nfs/dbraw/zinc/20/50/47/455205047.db2.gz	HBQYMNVDGDUWNS-XJKSGUPXSA-N	0	3	345.468	3.064	20	30		EGEDHN
N#Cc1ccc(NC(=O)CN[C@@H](C[C@@H]2CCOC2)c2ccccc2)cc1	ZINC000181215541	455303664	/nfs/dbraw/zinc/30/36/64/455303664.db2.gz	AUXCSWHIYYHLKI-PXNSSMCTSA-N	0	3	349.434	3.254	20	30		EGEDHN
C=CCCC[C@@H](C)NC(=O)NCC1CCN(c2ccncc2)CC1	ZINC000181397415	455328604	/nfs/dbraw/zinc/32/86/04/455328604.db2.gz	UTNCDYIKAASJOX-MRXNPFEDSA-N	0	3	330.476	3.342	20	30		EGEDHN
Cn1cc(CNC[C@H](c2cccc(Cl)c2)N2CCCC2)cc1C#N	ZINC000190756437	455378314	/nfs/dbraw/zinc/37/83/14/455378314.db2.gz	JHKHOSYGZDKNPK-LJQANCHMSA-N	0	3	342.874	3.477	20	30		EGEDHN
COc1ccc(CN(C[C@H]2CCCO2)[C@H]2CCSC2)cc1C#N	ZINC000245911998	455396687	/nfs/dbraw/zinc/39/66/87/455396687.db2.gz	RIIXKMGOBHHTLB-DLBZAZTESA-N	0	3	332.469	3.053	20	30		EGEDHN
C[C@@H](CNC(=O)N[C@H](CCC#N)c1ccccc1)N1CCC[C@@H](C)C1	ZINC000245922609	455400501	/nfs/dbraw/zinc/40/05/01/455400501.db2.gz	GUIOGTZJHXKBHU-ZIFCJYIRSA-N	0	3	342.487	3.451	20	30		EGEDHN
C=C(C)[C@@H](NC(=O)NC[C@H]1CCCN(C)C1)c1ccc(F)c(F)c1	ZINC000184697526	455430345	/nfs/dbraw/zinc/43/03/45/455430345.db2.gz	MUQZOVXHELXVHN-CXAGYDPISA-N	0	3	337.414	3.223	20	30		EGEDHN
C=CCn1c(SC[C@@H]2CCN(C)C2)nnc1-c1ccc(C)cc1	ZINC000191194288	455461499	/nfs/dbraw/zinc/46/14/99/455461499.db2.gz	HEZGSVXMPDRCPR-OAHLLOKOSA-N	0	3	328.485	3.483	20	30		EGEDHN
CC[C@H](N[C@@H](C)C(=O)N(CCC#N)c1ccc(F)cc1)[C@H]1CCCO1	ZINC000182275727	455478677	/nfs/dbraw/zinc/47/86/77/455478677.db2.gz	OYRHHNGWHKURHQ-JCGIZDLHSA-N	0	3	347.434	3.008	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccccc2CC#N)C1	ZINC000601009780	460674405	/nfs/dbraw/zinc/67/44/05/460674405.db2.gz	IMDKANYNDFOZLH-QFBILLFUSA-N	0	3	333.435	3.318	20	30		EGEDHN
CCS[C@@H]1CCCCN([C@H](C)C(=O)NC2(C#N)CCCCC2)C1	ZINC000246684754	455517508	/nfs/dbraw/zinc/51/75/08/455517508.db2.gz	VUYSQTIKEDCRKV-HZPDHXFCSA-N	0	3	337.533	3.325	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N1CC[C@@H]2OCCC[C@H]2C1	ZINC000246788123	455524856	/nfs/dbraw/zinc/52/48/56/455524856.db2.gz	RDOXCRVYFDIKNG-BQFCYCMXSA-N	0	3	348.512	3.152	20	30		EGEDHN
Cc1nnc(-c2cccc(C(=O)C(C#N)c3nc4ccccc4[nH]3)c2)o1	ZINC000161175795	455544458	/nfs/dbraw/zinc/54/44/58/455544458.db2.gz	VAAXVBSROQXWNX-CQSZACIVSA-N	0	3	343.346	3.411	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN[C@@H]2CCO[C@@H]2c2ccc(Cl)cc2)cc1	ZINC000192041482	455547876	/nfs/dbraw/zinc/54/78/76/455547876.db2.gz	WPDLKPQFHHCBSP-CEXWTWQISA-N	0	3	342.826	3.365	20	30		EGEDHN
CCCCNC(=O)C1(NCc2ccc(OCC#N)cc2)CCCCC1	ZINC000267919382	455564451	/nfs/dbraw/zinc/56/44/51/455564451.db2.gz	ILJRXYGRZJZFDT-UHFFFAOYSA-N	0	3	343.471	3.298	20	30		EGEDHN
COc1cccc([C@H](CNc2ccc(C#N)c([N+](=O)[O-])c2)N(C)C)c1	ZINC000267924030	455564867	/nfs/dbraw/zinc/56/48/67/455564867.db2.gz	JUPVIKRDJJKDKK-SFHVURJKSA-N	0	3	340.383	3.190	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CN(Cc3ccccc3)CCCO2)s1	ZINC000192355035	455596031	/nfs/dbraw/zinc/59/60/31/455596031.db2.gz	TYKRHEKYWIRVAQ-KRWDZBQOSA-N	0	3	341.480	3.000	20	30		EGEDHN
CCOc1ccnc(N2CCCN(CCCCC(C)(C)C#N)CC2)n1	ZINC000277586064	455605913	/nfs/dbraw/zinc/60/59/13/455605913.db2.gz	CUNWJNMCZXUKKE-UHFFFAOYSA-N	0	3	345.491	3.107	20	30		EGEDHN
CCN1CCN(Cc2ccc(N[C@@H]3CCC[C@H](C#N)C3)cc2)CC1	ZINC000185726425	455607646	/nfs/dbraw/zinc/60/76/46/455607646.db2.gz	AZYBRJQHFXAQOQ-AZUAARDMSA-N	0	3	326.488	3.318	20	30		EGEDHN
N#C[C@H]1CCC[C@H](NCc2ccc(C(=O)N3CCCCC3)cc2)C1	ZINC000185801357	455624109	/nfs/dbraw/zinc/62/41/09/455624109.db2.gz	XBUAKFBUDBHUHO-HKUYNNGSSA-N	0	3	325.456	3.485	20	30		EGEDHN
N#Cc1cccc(OCCN2CCC[C@@H]2C[C@H](O)c2ccco2)c1	ZINC000268247701	455629766	/nfs/dbraw/zinc/62/97/66/455629766.db2.gz	ILQJDHSDHSMXRN-AEFFLSMTSA-N	0	3	326.396	3.118	20	30		EGEDHN
C=CCCOCCN[C@H](C)c1ccc(OCc2nccn2C)cc1	ZINC000271500934	455661440	/nfs/dbraw/zinc/66/14/40/455661440.db2.gz	MBDSXTWAJRNWCH-MRXNPFEDSA-N	0	3	329.444	3.242	20	30		EGEDHN
C=CCNC(=O)CN[C@@H]1CCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000284343461	455672005	/nfs/dbraw/zinc/67/20/05/455672005.db2.gz	MWOGTTBKXSOAKG-LSDHHAIUSA-N	0	3	326.362	3.233	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)CN1CCC[C@@]1(C)Cc1ccccc1	ZINC000186041574	455682905	/nfs/dbraw/zinc/68/29/05/455682905.db2.gz	OFSWKEXLMWKOJD-PMACEKPBSA-N	0	3	327.472	3.138	20	30		EGEDHN
C#CC[C@H](N[C@H](C)Cn1cc(Br)cn1)c1ccccc1	ZINC000271579720	455691679	/nfs/dbraw/zinc/69/16/79/455691679.db2.gz	WUXUDWGSHWKFRJ-CJNGLKHVSA-N	0	3	332.245	3.388	20	30		EGEDHN
CN(C(=O)/C=C/c1ccc(C#N)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000268509013	455702488	/nfs/dbraw/zinc/70/24/88/455702488.db2.gz	CXNJNXILQBLDOC-VIOKTNGOSA-N	0	3	345.446	3.304	20	30		EGEDHN
C[C@@H](NC(=O)c1ccc(F)c(C#N)c1)[C@H](c1ccccc1)N(C)C	ZINC000284594987	455710896	/nfs/dbraw/zinc/71/08/96/455710896.db2.gz	HDWHZVNRSCYSRD-FZKQIMNGSA-N	0	3	325.387	3.119	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCc3cc(F)ccc3[C@H]2C)CC1	ZINC000606501141	460687721	/nfs/dbraw/zinc/68/77/21/460687721.db2.gz	JSKZXHOHOKZEOK-OAHLLOKOSA-N	0	3	345.462	3.495	20	30		EGEDHN
COc1cccc(C2(NCCOc3ccc(C#N)cc3OC)CC2)c1	ZINC000271701018	455726929	/nfs/dbraw/zinc/72/69/29/455726929.db2.gz	LCPZHRLOLMTZLI-UHFFFAOYSA-N	0	3	338.407	3.233	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000248729959	455727509	/nfs/dbraw/zinc/72/75/09/455727509.db2.gz	MGJPHMKQOMZBCJ-HKUYNNGSSA-N	0	3	330.472	3.091	20	30		EGEDHN
C=CCC(C)(C)CNC(=O)NCC1CCN(c2ccncc2)CC1	ZINC000292808696	455762209	/nfs/dbraw/zinc/76/22/09/455762209.db2.gz	NZXYOSNCMXYSJJ-UHFFFAOYSA-N	0	3	330.476	3.200	20	30		EGEDHN
C=CCc1cc(CN[C@H]2CCO[C@@H]2c2cccnc2)cc(OC)c1O	ZINC000284966690	455769272	/nfs/dbraw/zinc/76/92/72/455769272.db2.gz	KLBTYLANYABQLE-FXAWDEMLSA-N	0	3	340.423	3.144	20	30		EGEDHN
C=C(Br)CNC1(Cc2cccc(F)c2)CCOCC1	ZINC000292993867	455770555	/nfs/dbraw/zinc/77/05/55/455770555.db2.gz	MMGPROVRPWSXNI-UHFFFAOYSA-N	0	3	328.225	3.416	20	30		EGEDHN
Cc1ccc(CNC(=O)C2CCN([C@H]3CC[C@H](C#N)C3)CC2)cc1F	ZINC000293389349	455784523	/nfs/dbraw/zinc/78/45/23/455784523.db2.gz	GUAUGIATMPTGAV-YJBOKZPZSA-N	0	3	343.446	3.155	20	30		EGEDHN
CC[C@@H](NC[C@@H](O)c1cc(OC)ccc1OC)c1ccc(C#N)cc1	ZINC000278220584	455790054	/nfs/dbraw/zinc/79/00/54/455790054.db2.gz	IZJBTNGQDRNFIH-RTBURBONSA-N	0	3	340.423	3.350	20	30		EGEDHN
CCO[C@@H]1C[C@@](CO)(NCc2cccc(OCCCC#N)c2)C1(C)C	ZINC000186582623	455797982	/nfs/dbraw/zinc/79/79/82/455797982.db2.gz	KCZGJFBGFPKSSZ-QUCCMNQESA-N	0	3	346.471	3.025	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H](C)Cn2ccc3ccccc32)CC1	ZINC000285242145	455811467	/nfs/dbraw/zinc/81/14/67/455811467.db2.gz	BVIVRIYACPPTHW-KRWDZBQOSA-N	0	3	339.483	3.434	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N[C@@H]2CCC[C@@H](C)C2)cc1	ZINC000278680857	455844633	/nfs/dbraw/zinc/84/46/33/455844633.db2.gz	ROPZVTQIHQRYHG-VNHYZAJKSA-N	0	3	349.456	3.073	20	30		EGEDHN
Cc1cccc(C)c1OCCNC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000279296682	455862097	/nfs/dbraw/zinc/86/20/97/455862097.db2.gz	LPMFCFNFVUGJAQ-LJQANCHMSA-N	0	3	347.418	3.053	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)Cc1ccc(C#N)cc1)c1nc(C)cs1	ZINC000279453356	455865720	/nfs/dbraw/zinc/86/57/20/455865720.db2.gz	ZOKWZKGJGPFHKO-HOTGVXAUSA-N	0	3	338.436	3.273	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@@H]1[C@@H]2CCO[C@H]2C1(C)C	ZINC000296059534	455868338	/nfs/dbraw/zinc/86/83/38/455868338.db2.gz	GDPVPELOYCFLAL-MORSLUCNSA-N	0	3	346.496	3.306	20	30		EGEDHN
COc1ccc(CN[C@@H](CO)CC2CCC2)cc1OCCCC#N	ZINC000279661612	455869398	/nfs/dbraw/zinc/86/93/98/455869398.db2.gz	GLZLADBLHMDRGM-QGZVFWFLSA-N	0	3	332.444	3.018	20	30		EGEDHN
C[C@H](CNC(=O)c1ccc(C(C)(C)C#N)cc1)N1CCC(C)CC1	ZINC000279665114	455870502	/nfs/dbraw/zinc/87/05/02/455870502.db2.gz	MLCFKFBUBYDMSB-MRXNPFEDSA-N	0	3	327.472	3.338	20	30		EGEDHN
C=CCN(CC=C)[C@H](CN[C@H](c1ncc[nH]1)c1cccnc1)C(C)C	ZINC000279985115	455879513	/nfs/dbraw/zinc/87/95/13/455879513.db2.gz	DVXJASIFYDAOLH-MOPGFXCFSA-N	0	3	339.487	3.182	20	30		EGEDHN
C[C@H](CN[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O)c1ccccc1	ZINC000194891946	455897353	/nfs/dbraw/zinc/89/73/53/455897353.db2.gz	NLWLKNMEXQZXKE-UZLBHIALSA-N	0	3	333.435	3.052	20	30		EGEDHN
Cc1ccccc1CN1CCC(NC(=O)c2ccc(CC#N)cc2)CC1	ZINC000270205631	455902023	/nfs/dbraw/zinc/90/20/23/455902023.db2.gz	DDIGNEJIPGZZRV-UHFFFAOYSA-N	0	3	347.462	3.456	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1C[C@@H]2CCCN2Cc2ccccc21)OCC	ZINC000270372844	455941397	/nfs/dbraw/zinc/94/13/97/455941397.db2.gz	ULTUPLRVOWGVBP-HKUYNNGSSA-N	0	3	328.456	3.369	20	30		EGEDHN
C#CC[C@@H](NC(=O)N1CCN(C2CCCC2)CC1)c1ccccc1	ZINC000270384116	455944546	/nfs/dbraw/zinc/94/45/46/455944546.db2.gz	WNOJUHPUAQJCAQ-LJQANCHMSA-N	0	3	325.456	3.021	20	30		EGEDHN
COCC1(O)CCN(Cc2ccc(-c3ccccc3C#N)cc2)CC1	ZINC000270387267	455945580	/nfs/dbraw/zinc/94/55/80/455945580.db2.gz	RKDTWWLHHOBGKH-UHFFFAOYSA-N	0	3	336.435	3.199	20	30		EGEDHN
CN(C(=O)C(C#N)Cc1ccc(C#N)cc1)[C@H]1CCc2ccccc2C1	ZINC000280482826	455980132	/nfs/dbraw/zinc/98/01/32/455980132.db2.gz	PRRGSPBFXKEBSP-SFTDATJTSA-N	0	3	343.430	3.256	20	30		EGEDHN
COc1ccc([C@@H](CNc2snc(C)c2C#N)N(C)C)cc1OC	ZINC000287160505	456062974	/nfs/dbraw/zinc/06/29/74/456062974.db2.gz	YJDUMTFNNFOCAE-CQSZACIVSA-N	0	3	346.456	3.055	20	30		EGEDHN
C=CCN1CC[C@H](N[C@H](C)c2ccc(Oc3cccnc3)cc2)C1=O	ZINC000287284395	456065307	/nfs/dbraw/zinc/06/53/07/456065307.db2.gz	RRIZKHMLRZFLNB-BEFAXECRSA-N	0	3	337.423	3.311	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)[C@H](CC)c2cccc(OC)c2)CC1	ZINC000287649044	456075093	/nfs/dbraw/zinc/07/50/93/456075093.db2.gz	KEXYSKOIINJWDO-LJQANCHMSA-N	0	3	345.487	3.438	20	30		EGEDHN
C=CCS(=O)(=O)CCN[C@@H](C)C(c1ccccc1)c1ccccc1	ZINC000272869945	456096238	/nfs/dbraw/zinc/09/62/38/456096238.db2.gz	OMVBAFMGSTWTSA-KRWDZBQOSA-N	0	3	343.492	3.397	20	30		EGEDHN
C#Cc1ccc(CNCc2cccc(CN3CCO[C@@H](C)C3)c2)cc1	ZINC000289221426	456118102	/nfs/dbraw/zinc/11/81/02/456118102.db2.gz	JIWIFGFIOJYQOS-SFHVURJKSA-N	0	3	334.463	3.178	20	30		EGEDHN
C=CC[C@H]1N(C(=O)Nc2ccnn2CCN(C)C)CCCC1(C)C	ZINC000297157697	456136479	/nfs/dbraw/zinc/13/64/79/456136479.db2.gz	GPPGBDRQBRYWKA-OAHLLOKOSA-N	0	3	333.480	3.043	20	30		EGEDHN
C=CCOc1ccc(CN2CCCC[C@@H]2CCC(=O)NC)cc1OC	ZINC000289863919	456158884	/nfs/dbraw/zinc/15/88/84/456158884.db2.gz	VNRHBIXNTCYLTM-QGZVFWFLSA-N	0	3	346.471	3.141	20	30		EGEDHN
N#CCCCNCc1cc(Br)c2c(c1)OCCCO2	ZINC000273063290	456164666	/nfs/dbraw/zinc/16/46/66/456164666.db2.gz	MZQHUVLJCDAFJI-UHFFFAOYSA-N	0	3	325.206	3.004	20	30		EGEDHN
Cc1ccc(C[C@@H](CO)NCc2cccc(OCCCC#N)c2)cc1	ZINC000188985588	456189715	/nfs/dbraw/zinc/18/97/15/456189715.db2.gz	UVWSSRZGUYEPSG-FQEVSTJZSA-N	0	3	338.451	3.371	20	30		EGEDHN
C=CCC(CC=C)c1nc(-c2ccnc(OCCN(C)C)c2)no1	ZINC000273871214	456247710	/nfs/dbraw/zinc/24/77/10/456247710.db2.gz	HRWJZZSAKURZKD-UHFFFAOYSA-N	0	3	328.416	3.308	20	30		EGEDHN
COc1ccc(CN[C@@H](CN(C)C)c2ccc(F)cc2)cc1C#N	ZINC000290141385	456251056	/nfs/dbraw/zinc/25/10/56/456251056.db2.gz	NWPLAAMZGAZRAQ-SFHVURJKSA-N	0	3	327.403	3.098	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NC[C@H](c1ccccc1)N1CCCC1	ZINC000275643686	456278251	/nfs/dbraw/zinc/27/82/51/456278251.db2.gz	AWTKDBRACWNJOS-UYAOXDASSA-N	0	3	330.472	3.169	20	30		EGEDHN
N#Cc1c(NC[C@H]2CCCN2Cc2ccccc2)nc2ccccn12	ZINC000302115138	456291430	/nfs/dbraw/zinc/29/14/30/456291430.db2.gz	VWGVNHBXBHVMSK-QGZVFWFLSA-N	0	3	331.423	3.282	20	30		EGEDHN
C#CCOc1ccc(CN(Cc2ccco2)C2CCN(C)CC2)cc1	ZINC000290368247	456307030	/nfs/dbraw/zinc/30/70/30/456307030.db2.gz	HGSLYWUIQGFQNP-UHFFFAOYSA-N	0	3	338.451	3.388	20	30		EGEDHN
C=C(CN[C@H]1CCCc2cc(S(N)(=O)=O)ccc21)c1ccccc1	ZINC000340207850	456315197	/nfs/dbraw/zinc/31/51/97/456315197.db2.gz	YKGNAIQQTBOONN-IBGZPJMESA-N	0	3	342.464	3.014	20	30		EGEDHN
COc1cc(CN[C@@H](C)c2ccc3c(c2)CCC(=O)N3)ccc1C#N	ZINC000281838286	456336044	/nfs/dbraw/zinc/33/60/44/456336044.db2.gz	YGBONCJYROXWNQ-ZDUSSCGKSA-N	0	3	335.407	3.302	20	30		EGEDHN
C#C[C@H](NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1)C(C)C	ZINC000298134160	456371146	/nfs/dbraw/zinc/37/11/46/456371146.db2.gz	YZBFWCCFHBUGEA-RLLQIKCJSA-N	0	3	341.499	3.339	20	30		EGEDHN
C=C(C)COc1cc(CN(C)CCOCCOCC)ccc1OC	ZINC000276133972	456396000	/nfs/dbraw/zinc/39/60/00/456396000.db2.gz	DAWWNDUDZRHMBS-UHFFFAOYSA-N	0	3	337.460	3.135	20	30		EGEDHN
CN(C)Cc1c2ccccc2oc1C(=O)Nc1n[nH]c(C2CC2)c1C#N	ZINC000290717349	456412393	/nfs/dbraw/zinc/41/23/93/456412393.db2.gz	XNRHSJRQBPUPBT-UHFFFAOYSA-N	0	3	349.394	3.219	20	30		EGEDHN
C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCN(C)CC[C@H]1C	ZINC000340385841	456431646	/nfs/dbraw/zinc/43/16/46/456431646.db2.gz	YUNUXLFWOZSYLM-LSDHHAIUSA-N	0	3	346.500	3.496	20	30		EGEDHN
C[C@@H](NC(=O)C(C#N)Cc1ccc(C#N)cc1)c1ccc(F)cc1F	ZINC000348009350	456436439	/nfs/dbraw/zinc/43/64/39/456436439.db2.gz	YSXSOAOURXBANA-DOMZBBRYSA-N	0	3	339.345	3.396	20	30		EGEDHN
CCC[C@H](C)C(=O)NCCN[C@@H]1CCCCc2cc(C#N)ccc21	ZINC000340420916	456450205	/nfs/dbraw/zinc/45/02/05/456450205.db2.gz	SAGJCIMICMGWIT-HNAYVOBHSA-N	0	3	327.472	3.468	20	30		EGEDHN
CC(C)CC[C@H](O)CN1CCC(Oc2ccc(C#N)cc2F)CC1	ZINC000353033752	456452020	/nfs/dbraw/zinc/45/20/20/456452020.db2.gz	ZZZLCENZTPZADT-INIZCTEOSA-N	0	3	334.435	3.338	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)NC[C@H](C)N1CCC[C@H](C)C1	ZINC000303474411	456461967	/nfs/dbraw/zinc/46/19/67/456461967.db2.gz	OKXCDMZKOOXBMA-IRXDYDNUSA-N	0	3	345.487	3.171	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)N[C@@H](C)CN1CCC[C@@H](C)C1	ZINC000303467157	456462218	/nfs/dbraw/zinc/46/22/18/456462218.db2.gz	MVQFDZFYTUBXHZ-SJORKVTESA-N	0	3	345.487	3.171	20	30		EGEDHN
C=CCCN(C)CC(=O)N1CCC[C@@H]1c1ccc2c(c1)OCCCO2	ZINC000276402862	456470001	/nfs/dbraw/zinc/47/00/01/456470001.db2.gz	KSTKCCLPMKPGGM-QGZVFWFLSA-N	0	3	344.455	3.019	20	30		EGEDHN
C[C@@H](NC(=O)C(C#N)Cc1ccc(C#N)cc1)c1c(F)cccc1F	ZINC000348090420	456471201	/nfs/dbraw/zinc/47/12/01/456471201.db2.gz	TYRSZWOXXCYISD-IUODEOHRSA-N	0	3	339.345	3.396	20	30		EGEDHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)C1(c2cccc(C#N)c2)CC1	ZINC000343246831	456479598	/nfs/dbraw/zinc/47/95/98/456479598.db2.gz	IROKDEZMMYBOFN-QGZVFWFLSA-N	0	3	347.462	3.227	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)CCc1scnc1C)C(C)C	ZINC000298758743	456533480	/nfs/dbraw/zinc/53/34/80/456533480.db2.gz	WZVQBRQTKIHKDE-INIZCTEOSA-N	0	3	335.517	3.199	20	30		EGEDHN
C[C@@H](NCC(C)(C)CCC#N)c1ccc(S(C)(=O)=O)c(F)c1	ZINC000348215370	456541639	/nfs/dbraw/zinc/54/16/39/456541639.db2.gz	MNNIKAQDQAFDMN-GFCCVEGCSA-N	0	3	326.437	3.210	20	30		EGEDHN
N#CCCn1cc(CN2CC[C@H](n3cccn3)C2)c(-c2ccccc2)n1	ZINC000291220800	456568674	/nfs/dbraw/zinc/56/86/74/456568674.db2.gz	JMYBDOGYPDVSEZ-IBGZPJMESA-N	0	3	346.438	3.107	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1	ZINC000337877283	456583044	/nfs/dbraw/zinc/58/30/44/456583044.db2.gz	RLNBDJNMVMKTPG-QFBILLFUSA-N	0	3	333.435	3.432	20	30		EGEDHN
CN(Cc1cc(C#N)n(C)c1)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1	ZINC000276809931	456587285	/nfs/dbraw/zinc/58/72/85/456587285.db2.gz	XQCMMBIXFGHGHZ-PKOBYXMFSA-N	0	3	327.403	3.388	20	30		EGEDHN
COc1cc(OC)cc(OCCN[C@H]2CCc3ccc(C#N)cc32)c1	ZINC000353266022	456598524	/nfs/dbraw/zinc/59/85/24/456598524.db2.gz	NPLZAYHWLSUGIY-FQEVSTJZSA-N	0	3	338.407	3.231	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Nc1ccn2ccnc2c1)C(C)C	ZINC000353337300	456644864	/nfs/dbraw/zinc/64/48/64/456644864.db2.gz	LUIAPNGFIYXNET-KRWDZBQOSA-N	0	3	341.459	3.154	20	30		EGEDHN
Cc1c([C@H](C)NCCc2cccc(C#N)c2)nnn1-c1ccc(F)cc1	ZINC000343508376	456668705	/nfs/dbraw/zinc/66/87/05/456668705.db2.gz	ICDPBVFGYLNFHY-AWEZNQCLSA-N	0	3	349.413	3.480	20	30		EGEDHN
CC[C@@H](c1ccccc1)N(CC)CC(=O)N(CCC#N)CCC#N	ZINC000299402749	456681653	/nfs/dbraw/zinc/68/16/53/456681653.db2.gz	MQVXFTQCBPXEEP-SFHVURJKSA-N	0	3	326.444	3.116	20	30		EGEDHN
C[C@@H](CCNCCS(=O)(=O)c1ccc(C#N)cc1)c1ccccc1	ZINC000325815023	456688018	/nfs/dbraw/zinc/68/80/18/456688018.db2.gz	QEMCTOSYKFGXEL-INIZCTEOSA-N	0	3	342.464	3.115	20	30		EGEDHN
N#CCN(C(=O)[C@@H]1CCCN(Cc2ccccc2)C1)C1CCCC1	ZINC000348466049	456699043	/nfs/dbraw/zinc/69/90/43/456699043.db2.gz	PALSOESHSHLOAM-GOSISDBHSA-N	0	3	325.456	3.193	20	30		EGEDHN
C=CCN(Cc1cccc(C#N)c1)[C@@H](C)c1cccc(-n2cnnn2)c1	ZINC000353493332	456713338	/nfs/dbraw/zinc/71/33/38/456713338.db2.gz	SOGUKIQRYBPVGD-INIZCTEOSA-N	0	3	344.422	3.283	20	30		EGEDHN
CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)NCCC1=CCCC1	ZINC000328626937	456722683	/nfs/dbraw/zinc/72/26/83/456722683.db2.gz	MFODBBIOFYGMKD-OALUTQOASA-N	0	3	342.487	3.421	20	30		EGEDHN
N#Cc1ccccc1-c1ccc(CN2CC[C@@H](N3CCCC3=O)C2)cc1	ZINC000299548267	456724736	/nfs/dbraw/zinc/72/47/36/456724736.db2.gz	FWUDIUVJUZVXSL-HXUWFJFHSA-N	0	3	345.446	3.422	20	30		EGEDHN
CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@H](C)CCC#N)cc1	ZINC000299550211	456725310	/nfs/dbraw/zinc/72/53/10/456725310.db2.gz	FZYZZVKHZVRNOE-HUUCEWRRSA-N	0	3	337.489	3.060	20	30		EGEDHN
Cc1nc(NC(=O)[C@H](C)N[C@@H]2[C@H]3CCO[C@H]3C23CCC3)sc1C	ZINC000328676111	456735374	/nfs/dbraw/zinc/73/53/74/456735374.db2.gz	LEOFYWXIHXKRGW-IGHBBLSQSA-N	0	3	335.473	3.284	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)NC[C@@H](C)N1CCCC[C@H]1C	ZINC000348571928	456771629	/nfs/dbraw/zinc/77/16/29/456771629.db2.gz	UNQCEXBIVAKVAT-IAGOWNOFSA-N	0	3	345.487	3.314	20	30		EGEDHN
C[C@@H](C(=O)Nc1ccc2c(c1)OCO2)N1CC[C@@H](C2CCOCC2)C1	ZINC000328855912	456777086	/nfs/dbraw/zinc/77/70/86/456777086.db2.gz	UCLOSFYXFJHCTC-DZGCQCFKSA-N	0	3	346.427	3.140	20	30		EGEDHN
C[C@H]1CN(C)CCN1Cc1cccc(OCc2ccccc2C#N)c1	ZINC000353585199	456784193	/nfs/dbraw/zinc/78/41/93/456784193.db2.gz	PWVWNZGZXBTFLQ-KRWDZBQOSA-N	0	3	335.451	3.273	20	30		EGEDHN
C=CC[C@H](CO)CNCc1c(C)nn(Cc2ccc(C)cc2)c1C	ZINC000341258880	456826961	/nfs/dbraw/zinc/82/69/61/456826961.db2.gz	LMWBKCUXBAPJHM-IBGZPJMESA-N	0	3	327.472	3.131	20	30		EGEDHN
CC(=O)N1CCC(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)CC1	ZINC000329143963	456842957	/nfs/dbraw/zinc/84/29/57/456842957.db2.gz	VYNMZRAUVKJTLD-HNAYVOBHSA-N	0	3	343.471	3.037	20	30		EGEDHN
Cc1nc([C@@H]2CCCOC2)sc1C(=O)NC1(CN(C)C)CCC1	ZINC000329163150	456846123	/nfs/dbraw/zinc/84/61/23/456846123.db2.gz	GGHCMVUYUZTTMU-CYBMUJFWSA-N	0	3	337.489	3.134	20	30		EGEDHN
C=CC[C@@H](CO)CNCc1cc(Cl)ccc1OC[C@H]1CCCO1	ZINC000341326943	456849043	/nfs/dbraw/zinc/84/90/43/456849043.db2.gz	ZDCNSWCJQULGGF-RHSMWYFYSA-N	0	3	339.863	3.172	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCC2(C(F)(F)F)CCC2)CC1	ZINC000344766569	456857011	/nfs/dbraw/zinc/85/70/11/456857011.db2.gz	QVHGEISTPJBOAR-UHFFFAOYSA-N	0	3	333.398	3.059	20	30		EGEDHN
Cc1nnc([C@@H]2CCCN([C@@H](C)C(=O)NCC3CCCCC3)C2)[nH]1	ZINC000329452554	456893485	/nfs/dbraw/zinc/89/34/85/456893485.db2.gz	NJBPARJTKQHHBB-XJKSGUPXSA-N	0	3	333.480	3.218	20	30		EGEDHN
O=C(CN1CCC[C@@H](c2n[nH]c(C3CCCCC3)n2)C1)NCC1CC1	ZINC000329491981	456899369	/nfs/dbraw/zinc/89/93/69/456899369.db2.gz	VVJDOCRXZACZKG-MRXNPFEDSA-N	0	3	345.491	3.398	20	30		EGEDHN
CC(C)Oc1ccc([C@H](C)N[C@@H](C)C(=O)NC2(C#N)CCC2)cc1	ZINC000345040034	456906613	/nfs/dbraw/zinc/90/66/13/456906613.db2.gz	ZDDWLUPCHSTHAY-GJZGRUSLSA-N	0	3	329.444	3.075	20	30		EGEDHN
C[C@@H]1CC[C@H](C)N1CC(=O)N[C@@H](CN1CCCC1=O)c1ccccc1	ZINC000329554397	456908362	/nfs/dbraw/zinc/90/83/62/456908362.db2.gz	GSMSEGZVZTYBSK-JZXOWHBKSA-N	0	3	343.471	3.179	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CN1C(=O)N[C@@H](c2cccs2)C1=O)C(C)C	ZINC000349230957	456918053	/nfs/dbraw/zinc/91/80/53/456918053.db2.gz	AJRWBICAEMTNCE-HOCLYGCPSA-N	0	3	347.484	3.040	20	30		EGEDHN
Cc1cccc(N2CCN(CCCCNc3ccnc(C#N)c3)CC2)c1	ZINC000341743245	456924326	/nfs/dbraw/zinc/92/43/26/456924326.db2.gz	PBXWNNMNXHWBNS-UHFFFAOYSA-N	0	3	349.482	3.276	20	30		EGEDHN
[O-]C(NC[C@@H]1CCC[C@H](C(F)(F)F)C1)=[NH+][C@@H]1CCc2nc[nH]c2C1	ZINC000329689715	456927669	/nfs/dbraw/zinc/92/76/69/456927669.db2.gz	GJXQVISEFNHQDB-GRYCIOLGSA-N	0	3	344.381	3.139	20	30		EGEDHN
[O-]C(NC[C@@H]1CCC[C@H](C(F)(F)F)C1)=[NH+][C@@H]1CCc2[nH]cnc2C1	ZINC000329689715	456927674	/nfs/dbraw/zinc/92/76/74/456927674.db2.gz	GJXQVISEFNHQDB-GRYCIOLGSA-N	0	3	344.381	3.139	20	30		EGEDHN
CC[C@H]1CCCCN1CCNC(=O)c1coc(C2CCOCC2)n1	ZINC000329924740	456961836	/nfs/dbraw/zinc/96/18/36/456961836.db2.gz	HTVCMQNNQJUVKZ-HNNXBMFYSA-N	0	3	335.448	3.138	20	30		EGEDHN
CC(C(=O)N[C@H](C)CC1CCCCC1)S(=O)(=O)C1CCOCC1	ZINC000329956376	456966821	/nfs/dbraw/zinc/96/68/21/456966821.db2.gz	PAIHCBWCIPWJJT-ZIAGYGMSSA-N	0	3	345.505	3.284	20	30		EGEDHN
C[C@H](NC(=O)NC[C@H]1CCC2(CCCCC2)O1)C1=CCN(C)CC1	ZINC000330082012	456982258	/nfs/dbraw/zinc/98/22/58/456982258.db2.gz	GYGHILZEKYRBEF-DOTOQJQBSA-N	0	3	335.492	3.022	20	30		EGEDHN
Cc1ccccc1[C@H]1CCCN1CC(=O)NCc1ccc(C#N)cc1	ZINC000339210365	456994109	/nfs/dbraw/zinc/99/41/09/456994109.db2.gz	BFUDKJKAXCZVPD-HXUWFJFHSA-N	0	3	333.435	3.320	20	30		EGEDHN
CCn1ccnc1[C@@H]1CCCCN1C(=O)NCCN1CCC[C@@H](C)C1	ZINC000330243920	457010730	/nfs/dbraw/zinc/01/07/30/457010730.db2.gz	CWROGDSMAJZJCG-SJORKVTESA-N	0	3	347.507	3.076	20	30		EGEDHN
CCc1nocc1CN[C@@H]1CCCN(c2ccc(C#N)cc2F)C1	ZINC000339246098	457015136	/nfs/dbraw/zinc/01/51/36/457015136.db2.gz	BECLQYRCBULIKN-OAHLLOKOSA-N	0	3	328.391	3.006	20	30		EGEDHN
CN(C)Cc1ccccc1C(=O)N1C[C@@H](C#N)[C@@H](c2ccccc2)C1	ZINC000346396939	457040666	/nfs/dbraw/zinc/04/06/66/457040666.db2.gz	LNHRZNOPZSMDCV-UYAOXDASSA-N	0	3	333.435	3.128	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@@H]1c1nc(-c2cccc(OCCN(C)C)c2)no1	ZINC000346529712	457048999	/nfs/dbraw/zinc/04/89/99/457048999.db2.gz	JELMIGXZZAGCAE-DLBZAZTESA-N	0	3	343.427	3.126	20	30		EGEDHN
CCN1CCC(NC(=O)c2cnn(C(C)(C)C)c2C(F)(F)F)CC1	ZINC000330523459	457053411	/nfs/dbraw/zinc/05/34/11/457053411.db2.gz	BDWRMFMTDFFWKV-UHFFFAOYSA-N	0	3	346.397	3.446	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)OCC	ZINC000339452035	457124411	/nfs/dbraw/zinc/12/44/11/457124411.db2.gz	UEHRFQCFCQGSDI-MOPGFXCFSA-N	0	3	330.472	3.091	20	30		EGEDHN
COc1cc([N+](=O)[O-])ccc1C(=O)NCC(C)(C)N1CCC[C@@H](C)C1	ZINC000331178119	457142004	/nfs/dbraw/zinc/14/20/04/457142004.db2.gz	XXJRLLRQXOHVRI-CYBMUJFWSA-N	0	3	349.431	3.419	20	30		EGEDHN
CC[C@H]1CN(CC(=O)N(CC)CCC#N)CC[C@H]1c1ccccc1	ZINC000350040976	457152435	/nfs/dbraw/zinc/15/24/35/457152435.db2.gz	LZBWNXBJHQKDQX-PKOBYXMFSA-N	0	3	327.472	3.264	20	30		EGEDHN
N#Cc1cccc(CNCCCS(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000339589764	457158734	/nfs/dbraw/zinc/15/87/34/457158734.db2.gz	VINCTMJLOYBMMG-UHFFFAOYSA-N	0	3	348.855	3.165	20	30		EGEDHN
CN(C)CCOc1cccc(-c2noc(CCCCCC#N)n2)c1	ZINC000350062063	457159914	/nfs/dbraw/zinc/15/99/14/457159914.db2.gz	QUJHTPOZQRBFAJ-UHFFFAOYSA-N	0	3	328.416	3.303	20	30		EGEDHN
C[C@@H](CN1C[C@H](C)C[C@H](C)C1)NC(=O)c1cc(C#N)ccc1Cl	ZINC000350074204	457161691	/nfs/dbraw/zinc/16/16/91/457161691.db2.gz	KXDXCRFDTXBHBK-MJBXVCDLSA-N	0	3	333.863	3.308	20	30		EGEDHN
CCN(C)C(=O)c1cccc(C(=O)NCCN2CCCC(C)(C)C2)c1	ZINC000331311213	457164635	/nfs/dbraw/zinc/16/46/35/457164635.db2.gz	ZHCAKDYVNUIWRG-UHFFFAOYSA-N	0	3	345.487	3.205	20	30		EGEDHN
CCN(CCC#N)C(=O)CN1CCC[C@@H]1CCCc1ccccc1	ZINC000362955289	457172917	/nfs/dbraw/zinc/17/29/17/457172917.db2.gz	QCPLUYCSYNIKJU-IBGZPJMESA-N	0	3	327.472	3.236	20	30		EGEDHN
CCOc1ccccc1Oc1ccc(CNC(=O)C(C)C#N)cn1	ZINC000347070035	457215180	/nfs/dbraw/zinc/21/51/80/457215180.db2.gz	NSRHVVRYDPQMSP-CYBMUJFWSA-N	0	3	325.368	3.048	20	30		EGEDHN
CCCOc1ccc(Oc2ncccc2CNC(=O)C(C)C#N)cc1	ZINC000347080975	457220758	/nfs/dbraw/zinc/22/07/58/457220758.db2.gz	WULBRVHPHOTHOE-AWEZNQCLSA-N	0	3	339.395	3.439	20	30		EGEDHN
Cc1ccc(CNC(=O)C2CCN([C@@H]3CC[C@@H](C#N)C3)CC2)cc1	ZINC000331936393	457275963	/nfs/dbraw/zinc/27/59/63/457275963.db2.gz	MDJWNZSUKCUNHK-IEBWSBKVSA-N	0	3	325.456	3.016	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)[C@H]1CC12CCCCC2	ZINC000357064475	457305335	/nfs/dbraw/zinc/30/53/35/457305335.db2.gz	BWXMOVRHYACONC-LJQANCHMSA-N	0	3	339.483	3.419	20	30		EGEDHN
CC(C)(C)N1C[C@@H](C(=O)NCC(C)(C)CCC#N)[C@H](C(F)(F)F)C1	ZINC000354974957	457332835	/nfs/dbraw/zinc/33/28/35/457332835.db2.gz	KGINJZPZRKTSGG-CHWSQXEVSA-N	0	3	347.425	3.341	20	30		EGEDHN
CC(C)Cc1ccc([C@H](CNC(=O)NCCCC#N)N(C)C)cc1	ZINC000355075725	457340238	/nfs/dbraw/zinc/34/02/38/457340238.db2.gz	FOXFFZCVEZKQGF-SFHVURJKSA-N	0	3	330.476	3.091	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CC[C@@H](N(C)Cc2ccccc2)C1)OCC	ZINC000360777287	457346663	/nfs/dbraw/zinc/34/66/63/457346663.db2.gz	XSVQUCYYWBHAOM-RTBURBONSA-N	0	3	330.472	3.091	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CC[C@@H](N(C)Cc2ccccc2)C1)OCC	ZINC000360777279	457346880	/nfs/dbraw/zinc/34/68/80/457346880.db2.gz	XSVQUCYYWBHAOM-MOPGFXCFSA-N	0	3	330.472	3.091	20	30		EGEDHN
C[C@@H]1C[C@H](Nc2nccc(C#N)c2Cl)CCN1Cc1ccccc1	ZINC000342566801	457369327	/nfs/dbraw/zinc/36/93/27/457369327.db2.gz	LTVLNQWVJRTJNC-RHSMWYFYSA-N	0	3	340.858	3.494	20	30		EGEDHN
C=CCn1cccc1C(=O)N1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1	ZINC000425017569	457406627	/nfs/dbraw/zinc/40/66/27/457406627.db2.gz	ZGWPCFWDQARWCN-AZUAARDMSA-N	0	3	335.451	3.021	20	30		EGEDHN
N#Cc1ccc(C(F)(F)F)c(NC2CCN([C@@H]3CCOC3)CC2)c1	ZINC000363704966	457421993	/nfs/dbraw/zinc/42/19/93/457421993.db2.gz	VWRARFYJDBCPAY-CQSZACIVSA-N	0	3	339.361	3.242	20	30		EGEDHN
C=CC[C@H](C)NC(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000342666499	457441436	/nfs/dbraw/zinc/44/14/36/457441436.db2.gz	UXTQIDHBUVQZIL-HNNXBMFYSA-N	0	3	325.522	3.002	20	30		EGEDHN
C=CCOc1ccc(C(=O)NCCN2CCCC(C)(C)C2)cc1OC	ZINC000347488818	457460807	/nfs/dbraw/zinc/46/08/07/457460807.db2.gz	RLAJWUJEFGYFRK-UHFFFAOYSA-N	0	3	346.471	3.112	20	30		EGEDHN
Cc1cc(NC[C@@H]2CCCN(Cc3cccs3)C2)c(C#N)cn1	ZINC000425227649	457464872	/nfs/dbraw/zinc/46/48/72/457464872.db2.gz	RVQVLWIMXLHSRN-HNNXBMFYSA-N	0	3	326.469	3.069	20	30		EGEDHN
N#Cc1ccc(N2CC[C@@]3(C2)CCCN(Cc2ccccc2)C3)nc1	ZINC000374198102	457520053	/nfs/dbraw/zinc/52/00/53/457520053.db2.gz	HCWPVGDFVMYQAZ-NRFANRHFSA-N	0	3	332.451	3.446	20	30		EGEDHN
C=CCOc1cccc(CN2CCC[C@@H]2C[C@@H](O)c2cnn(C)c2)c1	ZINC000374254942	457547837	/nfs/dbraw/zinc/54/78/37/457547837.db2.gz	HCQHHYSADJINSQ-UYAOXDASSA-N	0	3	341.455	3.073	20	30		EGEDHN
CN(C)CCN(Cc1ccc(F)cc1)c1ccc(C#N)cc1[N+](=O)[O-]	ZINC000347621798	457554105	/nfs/dbraw/zinc/55/41/05/457554105.db2.gz	DQKBSPNKQHMZRY-UHFFFAOYSA-N	0	3	342.374	3.174	20	30		EGEDHN
C=CC[C@H](CO)CNCc1cnn(-c2ccc(C(F)(F)F)cc2)c1	ZINC000352735636	457568650	/nfs/dbraw/zinc/56/86/50/457568650.db2.gz	DAIBSHQBDMYZEK-ZDUSSCGKSA-N	0	3	339.361	3.165	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC[C@@H]2CCCC(F)(F)C2)CC1	ZINC000409609756	457609374	/nfs/dbraw/zinc/60/93/74/457609374.db2.gz	CJRVYWHQEVWWPC-CQSZACIVSA-N	0	3	329.435	3.152	20	30		EGEDHN
C=C(C)COc1cccc(NC(=O)N2CCC[C@H]3CN(C)C[C@H]32)c1	ZINC000425658779	457624485	/nfs/dbraw/zinc/62/44/85/457624485.db2.gz	VTTRPWRVDUIOPM-MAUKXSAKSA-N	0	3	329.444	3.199	20	30		EGEDHN
Cn1cc([C@H](NCCCOc2cccc(C#N)c2)c2ccccc2)cn1	ZINC000374633270	457677062	/nfs/dbraw/zinc/67/70/62/457677062.db2.gz	XMERXNWEAZZVPA-OAQYLSRUSA-N	0	3	346.434	3.440	20	30		EGEDHN
CC(C)(O)CN1CCc2c(cccc2NCc2ccc(C#N)s2)C1	ZINC000374645191	457679399	/nfs/dbraw/zinc/67/93/99/457679399.db2.gz	IXFNCBOLPNOWRG-UHFFFAOYSA-N	0	3	341.480	3.361	20	30		EGEDHN
CO[C@H]1CCCN([C@@H](C)C(=O)N(CCC#N)c2ccc(C)cc2)CC1	ZINC000374696412	457688661	/nfs/dbraw/zinc/68/86/61/457688661.db2.gz	XKPQOHIAVKJWSX-HKUYNNGSSA-N	0	3	343.471	3.131	20	30		EGEDHN
CC(C#N)C(=O)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1	ZINC000357793833	457692548	/nfs/dbraw/zinc/69/25/48/457692548.db2.gz	IZFMQDCZDILYJE-CQSZACIVSA-N	0	3	348.381	3.454	20	30		EGEDHN
N#Cc1ccccc1OCCN(CCO)[C@H]1CCCc2ccccc21	ZINC000357885160	457723980	/nfs/dbraw/zinc/72/39/80/457723980.db2.gz	FPIXERUKNLDOBI-FQEVSTJZSA-N	0	3	336.435	3.309	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@@H]1CCO[C@H]1C1CC1	ZINC000365340328	457744432	/nfs/dbraw/zinc/74/44/32/457744432.db2.gz	ARKIBPMBYABKFX-QAPCUYQASA-N	0	3	332.469	3.060	20	30		EGEDHN
C[C@H]1C[C@H](c2ccccc2)CN1CC(=O)NCc1cccc(C#N)c1	ZINC000365340445	457745462	/nfs/dbraw/zinc/74/54/62/457745462.db2.gz	VTDBEWDLISGXML-JXFKEZNVSA-N	0	3	333.435	3.052	20	30		EGEDHN
COc1ccc(CNC(=O)C(C#N)CCc2ccccc2)cc1OC	ZINC000433122554	457761811	/nfs/dbraw/zinc/76/18/11/457761811.db2.gz	RESJMJKJOBHIQG-KRWDZBQOSA-N	0	3	338.407	3.093	20	30		EGEDHN
N#CC(C(=O)c1ccc2nccnc2c1)c1cnc2ccccc2n1	ZINC000361530957	457775039	/nfs/dbraw/zinc/77/50/39/457775039.db2.gz	NEPGLKBUASCTTL-CYBMUJFWSA-N	0	3	325.331	3.063	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCc1ccc(-n2cccn2)cc1	ZINC000433223674	457783589	/nfs/dbraw/zinc/78/35/89/457783589.db2.gz	RPOQTYKDVWAYKT-LJQANCHMSA-N	0	3	344.418	3.261	20	30		EGEDHN
COc1ccc(CNC(=O)C(C#N)CCc2ccccc2)c(OC)c1	ZINC000433222424	457784205	/nfs/dbraw/zinc/78/42/05/457784205.db2.gz	VEJYJPZLWMTDTJ-MRXNPFEDSA-N	0	3	338.407	3.093	20	30		EGEDHN
CC(C)(CC#N)CNC(=O)N[C@@H](CN1CCCC1)c1ccccc1	ZINC000457765823	457821156	/nfs/dbraw/zinc/82/11/56/457821156.db2.gz	XUHPXOVFPOWCOT-KRWDZBQOSA-N	0	3	328.460	3.063	20	30		EGEDHN
CC(C)(CC#N)CNC(=O)NCC(C)(C)N1CCc2ccccc2C1	ZINC000457794776	457832090	/nfs/dbraw/zinc/83/20/90/457832090.db2.gz	CZIDKXJQFSDGEU-UHFFFAOYSA-N	0	3	342.487	3.062	20	30		EGEDHN
CCCN(CCc1cccc(F)c1)[C@H](C)C(=O)NC1(C#N)CCC1	ZINC000411277081	457847722	/nfs/dbraw/zinc/84/77/22/457847722.db2.gz	HUHJXOIFEUIZJF-OAHLLOKOSA-N	0	3	331.435	3.031	20	30		EGEDHN
CCOC(=O)CC(C)(C)CCN1CCC(C#N)(c2ccccn2)CC1	ZINC000367890945	457993143	/nfs/dbraw/zinc/99/31/43/457993143.db2.gz	IDGRAWQFZFDBFW-UHFFFAOYSA-N	0	3	343.471	3.308	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cnc([C@H](C)CC)nc2)CC1	ZINC000434535091	458013965	/nfs/dbraw/zinc/01/39/65/458013965.db2.gz	YPBGCEDZOAHXOY-CQSZACIVSA-N	0	3	331.464	3.152	20	30		EGEDHN
CN(CCNc1c(C#N)nnc2ccccc21)Cc1ccc(F)cc1	ZINC000362131720	458032915	/nfs/dbraw/zinc/03/29/15/458032915.db2.gz	YROCWXIZMSQGMS-UHFFFAOYSA-N	0	3	335.386	3.184	20	30		EGEDHN
N#CC(C(=O)c1ccc2oc(=O)[nH]c2c1)c1cc(C(F)(F)F)ccn1	ZINC000362128050	458033300	/nfs/dbraw/zinc/03/33/00/458033300.db2.gz	CKNMBGMTPJHVGL-SNVBAGLBSA-N	0	3	347.252	3.437	20	30		EGEDHN
COC1([C@@H](C)NCC(=O)N(CCC#N)c2cccc(C)c2C)CCC1	ZINC000412017600	458046647	/nfs/dbraw/zinc/04/66/47/458046647.db2.gz	AGJGJENSVOMSMA-QGZVFWFLSA-N	0	3	343.471	3.097	20	30		EGEDHN
CCN1CCC[C@H]1CNc1c(C#N)cnc2ccc(OC(F)F)cc21	ZINC000358527657	458055976	/nfs/dbraw/zinc/05/59/76/458055976.db2.gz	HRPCABLXSYKGSX-ZDUSSCGKSA-N	0	3	346.381	3.026	20	30		EGEDHN
CCN(CCC#N)C(=O)CN1CC[C@@](C)(CCc2ccccc2)C1	ZINC000434903684	458064726	/nfs/dbraw/zinc/06/47/26/458064726.db2.gz	KIOBPOJSSACTDB-HXUWFJFHSA-N	0	3	327.472	3.093	20	30		EGEDHN
C=CCC[C@@H](N[C@H]1CCN(c2ccccc2C(N)=O)C1)c1ccco1	ZINC000375789143	458064881	/nfs/dbraw/zinc/06/48/81/458064881.db2.gz	KJARUKQBQDATKQ-DOTOQJQBSA-N	0	3	339.439	3.254	20	30		EGEDHN
N#CCCN(CC1CC1)C(=O)c1cccc(CN2CCCCC2)c1	ZINC000412179897	458118557	/nfs/dbraw/zinc/11/85/57/458118557.db2.gz	OSZMRCFAKPNVEC-UHFFFAOYSA-N	0	3	325.456	3.438	20	30		EGEDHN
CN(CCC#N)c1ccc(CN2CC[C@@H](Oc3ccncc3)C2)cc1	ZINC000375918049	458125322	/nfs/dbraw/zinc/12/53/22/458125322.db2.gz	TXTYWHCMFHNUKB-HXUWFJFHSA-N	0	3	336.439	3.085	20	30		EGEDHN
CC#CCCN1CCC(c2nc(-c3ccccc3OC)no2)CC1	ZINC000369313423	458169217	/nfs/dbraw/zinc/16/92/17/458169217.db2.gz	ALJNYWLGHHHRPU-UHFFFAOYSA-N	0	3	325.412	3.338	20	30		EGEDHN
CC(C)N(Cc1cc(C#N)cs1)C[C@H](O)COc1ccccc1	ZINC000446852703	458238086	/nfs/dbraw/zinc/23/80/86/458238086.db2.gz	LQEWOYOJMCQZRZ-INIZCTEOSA-N	0	3	330.453	3.270	20	30		EGEDHN
Cc1ccc(C(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)cc1C#N	ZINC000376384998	458285014	/nfs/dbraw/zinc/28/50/14/458285014.db2.gz	LCIQGQYTPUVFPQ-INIZCTEOSA-N	0	3	348.450	3.217	20	30		EGEDHN
C#C[C@H](NC(=O)NC1CCN([C@@H](C)c2ccccc2)CC1)C(C)C	ZINC000369617639	458290510	/nfs/dbraw/zinc/29/05/10/458290510.db2.gz	PPROTKNHEIPLLE-LPHOPBHVSA-N	0	3	327.472	3.169	20	30		EGEDHN
N#CCCn1cc(CN[C@@H]2C[C@H]2c2ccco2)c(-c2ccncc2)n1	ZINC000414563507	458323574	/nfs/dbraw/zinc/32/35/74/458323574.db2.gz	BXMXVEOTLPIDPS-IAGOWNOFSA-N	0	3	333.395	3.097	20	30		EGEDHN
C[C@H](C(=O)N[C@@H]1CCCc2cc(C#N)ccc21)N1[C@H](C)CC[C@@H]1C	ZINC000416343335	458342411	/nfs/dbraw/zinc/34/24/11/458342411.db2.gz	RLALXVTWBDGDPQ-NXEZDXNNSA-N	0	3	325.456	3.313	20	30		EGEDHN
CN(c1ccccc1CNCC1(C#N)CCC1)C1CCN(C)CC1	ZINC000418138678	458371702	/nfs/dbraw/zinc/37/17/02/458371702.db2.gz	GVXJDBYDCPJRFC-UHFFFAOYSA-N	0	3	326.488	3.000	20	30		EGEDHN
CN(C)C(=O)c1ccccc1CN[C@H]1CCCc2cc(C#N)ccc21	ZINC000418146107	458372680	/nfs/dbraw/zinc/37/26/80/458372680.db2.gz	OSLOXMMLOCGNGP-FQEVSTJZSA-N	0	3	333.435	3.427	20	30		EGEDHN
N#C[C@@H]1CCC[C@@H](N[C@@H](CO)c2ccc(Br)c(F)c2)C1	ZINC000430114430	458402985	/nfs/dbraw/zinc/40/29/85/458402985.db2.gz	CMRRPFAKCJIRDU-HCKVZZMMSA-N	0	3	341.224	3.294	20	30		EGEDHN
N#C[C@@H]1CCC[C@H](N[C@H](CO)c2ccc(Br)c(F)c2)C1	ZINC000430114432	458403656	/nfs/dbraw/zinc/40/36/56/458403656.db2.gz	CMRRPFAKCJIRDU-IFUGULHKSA-N	0	3	341.224	3.294	20	30		EGEDHN
C[C@@H]1C[C@@]1(C#N)C(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1	ZINC000448768236	458408659	/nfs/dbraw/zinc/40/86/59/458408659.db2.gz	PQFRJJPXUSSANA-POAQFYNOSA-N	0	3	325.456	3.126	20	30		EGEDHN
Cc1[nH]c(C#N)cc1C(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1	ZINC000448827941	458412015	/nfs/dbraw/zinc/41/20/15/458412015.db2.gz	HNUFQICVHKDSKG-LJQANCHMSA-N	0	3	336.439	3.070	20	30		EGEDHN
COc1cc(OC)cc(OCCCNCc2ccc(C#N)c(F)c2)c1	ZINC000421367738	458412053	/nfs/dbraw/zinc/41/20/53/458412053.db2.gz	UDFLYKRGHJEPRG-UHFFFAOYSA-N	0	3	344.386	3.273	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)N(C)C[C@@H]1CCCN1C	ZINC000421715821	458419879	/nfs/dbraw/zinc/41/98/79/458419879.db2.gz	ZBPVAFFDBZBNHV-AWEZNQCLSA-N	0	3	327.453	3.248	20	30		EGEDHN
C=CCc1cc(CNC[C@H](Cc2ccccc2)OC)cc(OC)c1O	ZINC000449392202	458423538	/nfs/dbraw/zinc/42/35/38/458423538.db2.gz	HOWNMNPIQPOVQO-IBGZPJMESA-N	0	3	341.451	3.477	20	30		EGEDHN
CC[C@@H]1CN(CC)CCN1Cc1ccc(OC)c(OCCCC#N)c1	ZINC000449565005	458427397	/nfs/dbraw/zinc/42/73/97/458427397.db2.gz	FPKAADULOPNIFP-GOSISDBHSA-N	0	3	345.487	3.294	20	30		EGEDHN
CC(C)(C)CN(CCCO)Cc1ccc(C#N)cc1OC(F)F	ZINC000437142663	458429870	/nfs/dbraw/zinc/42/98/70/458429870.db2.gz	JQLSJWPMWDXQJA-UHFFFAOYSA-N	0	3	326.387	3.390	20	30		EGEDHN
COC(=O)[C@@H]1CN(Cc2ccc(C#N)s2)C[C@@H]1c1ccccc1	ZINC000449752220	458430569	/nfs/dbraw/zinc/43/05/69/458430569.db2.gz	BSTOZMKCLXYYTF-IAGOWNOFSA-N	0	3	326.421	3.008	20	30		EGEDHN
CCCCO[C@H]1C[C@@H](NCC(=O)Nc2oc(C)c(C)c2C#N)C1(C)C	ZINC000450976669	458461401	/nfs/dbraw/zinc/46/14/01/458461401.db2.gz	ZVVAKFXZSZVAFS-CVEARBPZSA-N	0	3	347.459	3.280	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN[C@H]1CCc2c1cccc2O	ZINC000451177806	458469002	/nfs/dbraw/zinc/46/90/02/458469002.db2.gz	XMPXRIKAFXSDNH-APWZRJJASA-N	0	3	339.435	3.138	20	30		EGEDHN
CC(C)(C)c1cnc(C(C#N)C(=O)c2ccnn2CC(F)F)s1	ZINC000430636048	458474389	/nfs/dbraw/zinc/47/43/89/458474389.db2.gz	XGZGCYOZYCDBTO-VIFPVBQESA-N	0	3	338.383	3.392	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2ccc(C#N)s2)CCN1Cc1ccccc1	ZINC000430662529	458476788	/nfs/dbraw/zinc/47/67/88/458476788.db2.gz	JRDJHUYAWOUEDV-ZBFHGGJFSA-N	0	3	339.464	3.403	20	30		EGEDHN
CC(C)(CCC#N)CNC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000377169212	458480985	/nfs/dbraw/zinc/48/09/85/458480985.db2.gz	MBTZYUXHMLATIW-KRWDZBQOSA-N	0	3	345.462	3.484	20	30		EGEDHN
CCN(CC)S(=O)(=O)c1ccc([C@@H](C)NCC2(CC#N)CC2)cc1	ZINC000430744952	458487562	/nfs/dbraw/zinc/48/75/62/458487562.db2.gz	WTTVIJOVEYPYOQ-OAHLLOKOSA-N	0	3	349.500	3.062	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@@H](C)N[C@@H]1CCC[C@H]1OCC	ZINC000452011681	458492888	/nfs/dbraw/zinc/49/28/88/458492888.db2.gz	HDHWKGJHOWTCCH-DJIMGWMZSA-N	0	3	336.501	3.198	20	30		EGEDHN
CC[C@H](COCC(F)(F)F)NC(=O)C(C#N)CCc1ccccc1	ZINC000452746163	458508583	/nfs/dbraw/zinc/50/85/83/458508583.db2.gz	PAMJOIZOPFBJTL-HUUCEWRRSA-N	0	3	342.361	3.233	20	30		EGEDHN
COc1cc2c(cc1OC)[C@H](NCc1ccc(C#N)c(F)c1)CC2	ZINC000453370193	458525719	/nfs/dbraw/zinc/52/57/19/458525719.db2.gz	FRPNNTZKOXVWFA-QGZVFWFLSA-N	0	3	326.371	3.492	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)c(F)c1)c1cccc(N2CCOCC2)c1	ZINC000453370154	458526190	/nfs/dbraw/zinc/52/61/90/458526190.db2.gz	FQBSZZXIYGVUDL-OAHLLOKOSA-N	0	3	339.414	3.385	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)Nc2cccc(C#Cc3ccccn3)c2)CCN1C	ZINC000438071200	458527558	/nfs/dbraw/zinc/52/75/58/458527558.db2.gz	HQDRJYOGTTYGRJ-OXQOHEQNSA-N	0	3	348.450	3.086	20	30		EGEDHN
C=CCn1c(CC2CCCC2)nnc1N1CCCN(C(C)C)CC1	ZINC000453426126	458527675	/nfs/dbraw/zinc/52/76/75/458527675.db2.gz	QGPWMCIHJYUMRU-UHFFFAOYSA-N	0	3	331.508	3.117	20	30		EGEDHN
C=C(C)Cn1c([C@@H]2CCCCO2)nnc1N1C[C@@H](C)N(CC)C[C@@H]1C	ZINC000453467248	458534656	/nfs/dbraw/zinc/53/46/56/458534656.db2.gz	QRUPKYISLDGIAJ-IKGGRYGDSA-N	0	3	347.507	3.015	20	30		EGEDHN
COc1ccc(NC(=O)[C@@H](N)CCCC#N)cc1Cc1ccccc1	ZINC000424068585	458550973	/nfs/dbraw/zinc/55/09/73/458550973.db2.gz	ZPAFMKXGCNDDGO-SFHVURJKSA-N	0	3	337.423	3.246	20	30		EGEDHN
Cc1nc(NC(=O)[C@@H](N)CCCC#N)sc1Cc1ccc(F)cc1	ZINC000424094356	458556815	/nfs/dbraw/zinc/55/68/15/458556815.db2.gz	UEKSIWLGTSBGAP-AWEZNQCLSA-N	0	3	346.431	3.141	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)NCC1(c2ccc(F)cc2)CCCCC1	ZINC000424104863	458559831	/nfs/dbraw/zinc/55/98/31/458559831.db2.gz	PSQLIUSUJGHQQT-KRWDZBQOSA-N	0	3	331.435	3.165	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N(CCc1ccc(F)cc1)C1CCCC1	ZINC000424127120	458565240	/nfs/dbraw/zinc/56/52/40/458565240.db2.gz	ANGHBMPMJJBKHT-SFHVURJKSA-N	0	3	331.435	3.161	20	30		EGEDHN
CC(C)(Cc1ccc(C#N)cc1)C(=O)NCCN1CCCCCC1	ZINC000454647816	458570165	/nfs/dbraw/zinc/57/01/65/458570165.db2.gz	AYMQXJCFJKGNPS-UHFFFAOYSA-N	0	3	327.472	3.119	20	30		EGEDHN
Cc1cccc(C)c1OC[C@H](NC(=O)[C@@H](N)CCCC#N)C(C)(C)C	ZINC000424145870	458570652	/nfs/dbraw/zinc/57/06/52/458570652.db2.gz	ZTNWCXUFUFECDA-IRXDYDNUSA-N	0	3	345.487	3.234	20	30		EGEDHN
CC(C)CCN1Cc2cccc(NC(=O)[C@@H](N)CCCC#N)c2C1	ZINC000424163963	458575517	/nfs/dbraw/zinc/57/55/17/458575517.db2.gz	YKCXHHGMAWAMCL-KRWDZBQOSA-N	0	3	328.460	3.008	20	30		EGEDHN
C=C(C)CCNC(=O)NC[C@H](c1ccc(OC)cc1)N1CCCC1	ZINC000455304694	458592595	/nfs/dbraw/zinc/59/25/95/458592595.db2.gz	CMUYFFPEDMHDSR-GOSISDBHSA-N	0	3	331.460	3.098	20	30		EGEDHN
N#CCc1ccc(NC(=O)N2CC[C@H](N3CCCCC3)C2)c(Cl)c1	ZINC000455694978	458607030	/nfs/dbraw/zinc/60/70/30/458607030.db2.gz	ANHPAVVNRXEOHW-HNNXBMFYSA-N	0	3	346.862	3.498	20	30		EGEDHN
C[C@H]1CN(C(=O)C(C)(C)Cc2ccc(C#N)cc2)CCN(C2CC2)C1	ZINC000456032641	458628742	/nfs/dbraw/zinc/62/87/42/458628742.db2.gz	OKZKJDRQTWBWEE-MRXNPFEDSA-N	0	3	339.483	3.070	20	30		EGEDHN
C=CCOCCCN(C)CCOc1ccc(Br)cc1	ZINC000470720865	458646439	/nfs/dbraw/zinc/64/64/39/458646439.db2.gz	AEUHKULOASKEKX-UHFFFAOYSA-N	0	3	328.250	3.352	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCCc2cccc(Cl)c2)cc1	ZINC000470741366	458647395	/nfs/dbraw/zinc/64/73/95/458647395.db2.gz	WJHIFZZFTRLPIC-QGZVFWFLSA-N	0	3	337.810	3.253	20	30		EGEDHN
C=Cc1ccc(CCNC(=O)NC2CCN(CC(=C)C)CC2)cc1	ZINC000463338985	458691423	/nfs/dbraw/zinc/69/14/23/458691423.db2.gz	FWZHJBPAUVLHAB-UHFFFAOYSA-N	0	3	327.472	3.212	20	30		EGEDHN
C=CCC(C)(C)CNC(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000432362818	458724384	/nfs/dbraw/zinc/72/43/84/458724384.db2.gz	PHSOVTQUDBUPEV-GOSISDBHSA-N	0	3	329.488	3.410	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCSC(CC)(CC)C2)CC1	ZINC000464362082	458748302	/nfs/dbraw/zinc/74/83/02/458748302.db2.gz	IMYIJMHQCOAUOQ-UHFFFAOYSA-N	0	3	339.549	3.344	20	30		EGEDHN
Cc1cc(C)cc(N(CCC#N)C(=O)[C@H](C)N[C@@H]2CSC[C@H]2C)c1	ZINC000507252140	458754224	/nfs/dbraw/zinc/75/42/24/458754224.db2.gz	LTAFDEVUAZDGHA-SOLBZPMBSA-N	0	3	345.512	3.280	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCCc2cc3ccccc3o2)cc1	ZINC000472209210	458774144	/nfs/dbraw/zinc/77/41/44/458774144.db2.gz	UAQQZUYISHQYFS-SFHVURJKSA-N	0	3	343.386	3.346	20	30		EGEDHN
C=C(CNC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1)c1ccccc1	ZINC000512677088	458786790	/nfs/dbraw/zinc/78/67/90/458786790.db2.gz	HLEMOZVLZDYLMB-IBGZPJMESA-N	0	3	341.430	3.441	20	30		EGEDHN
C[C@@H]1C[C@H](c2ccccc2)N(CC(=O)NCc2ccc(C#N)cc2)C1	ZINC000513227085	458792872	/nfs/dbraw/zinc/79/28/72/458792872.db2.gz	AKXQUXHKAINKCW-OXQOHEQNSA-N	0	3	333.435	3.258	20	30		EGEDHN
CCCN(CC(=O)N(CC)C[C@H](C)C#N)[C@H]1CCc2ccccc2C1	ZINC000513632676	458794848	/nfs/dbraw/zinc/79/48/48/458794848.db2.gz	FGJRGJPXVDVZHT-XLIONFOSSA-N	0	3	341.499	3.264	20	30		EGEDHN
CN1CCC[C@H](CNC(=O)N[C@@H]2CC[C@H](C#N)C2)[C@H]1c1cccs1	ZINC000515469286	458809844	/nfs/dbraw/zinc/80/98/44/458809844.db2.gz	YWBKEZZEOIQAPT-HWMZRRJGSA-N	0	3	346.500	3.122	20	30		EGEDHN
CN(CC(=O)N[C@](C)(C#N)C1CC1)[C@H]1CCCC[C@H]1c1ccccc1	ZINC000516417111	458817761	/nfs/dbraw/zinc/81/77/61/458817761.db2.gz	XPPRZDOJMYLEFP-IRFCIJBXSA-N	0	3	339.483	3.453	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1N[C@@H](C)C(=O)N[C@@H](C)c1ccc2ccccc2c1	ZINC000517217293	458826132	/nfs/dbraw/zinc/82/61/32/458826132.db2.gz	JDIGASDWCHFFIA-QPAVJXABSA-N	0	3	338.451	3.339	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)[C@@H](C)SCCN(C)Cc1ccccc1	ZINC000433018642	458826802	/nfs/dbraw/zinc/82/68/02/458826802.db2.gz	IIZIEZUUEDBMEZ-VQIMIIECSA-N	0	3	347.528	3.295	20	30		EGEDHN
COc1cc(CNCc2ccc(CN(C)C)c(F)c2)ccc1C#N	ZINC000440615784	458833441	/nfs/dbraw/zinc/83/34/41/458833441.db2.gz	QPTIZCKXZOZWAY-UHFFFAOYSA-N	0	3	327.403	3.057	20	30		EGEDHN
COc1cc(CNCc2ccc(Cn3cccn3)cc2)ccc1C#N	ZINC000440803236	458855491	/nfs/dbraw/zinc/85/54/91/458855491.db2.gz	GCCGMPURUAFLKA-UHFFFAOYSA-N	0	3	332.407	3.101	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC(CC(F)(F)F)CC2)CC1	ZINC000551654286	458888565	/nfs/dbraw/zinc/88/85/65/458888565.db2.gz	DHPCWKULVFXEBW-UHFFFAOYSA-N	0	3	333.398	3.011	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CCC[C@H]1c1ccccn1	ZINC000531440555	458919336	/nfs/dbraw/zinc/91/93/36/458919336.db2.gz	NBKYRVKDOTVUNN-QUCCMNQESA-N	0	3	338.451	3.387	20	30		EGEDHN
CCN(CCC#N)C(=O)CN(C)[C@H]1CCC[C@H]1c1ccc(C)cc1	ZINC000441339771	458923871	/nfs/dbraw/zinc/92/38/71/458923871.db2.gz	IEJLQFIFQJTLIO-OALUTQOASA-N	0	3	327.472	3.325	20	30		EGEDHN
C[C@@H](NC[C@H]1CN(C)C(=O)O1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000495726432	458931072	/nfs/dbraw/zinc/93/10/72/458931072.db2.gz	HFADSHGBQPSJCM-KUHUBIRLSA-N	0	3	335.407	3.326	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](C)c2ccccc2OC(C)C)CC1	ZINC000519292773	458932731	/nfs/dbraw/zinc/93/27/31/458932731.db2.gz	GSFKHUWLEOTRDZ-INIZCTEOSA-N	0	3	345.487	3.484	20	30		EGEDHN
C=CC(C)(C)CNC(=O)NC[C@H](c1cccc(OC)c1)N1CCCC1	ZINC000457483856	458973848	/nfs/dbraw/zinc/97/38/48/458973848.db2.gz	MKBUWQUYZYQCOB-GOSISDBHSA-N	0	3	345.487	3.344	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@H]1CC[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC000495916291	459005448	/nfs/dbraw/zinc/00/54/48/459005448.db2.gz	VAEJZGYJNOCJGH-GOEBONIOSA-N	0	3	347.434	3.480	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cc(C)cc([N+](=O)[O-])c1)C(C)C	ZINC000495980790	459026452	/nfs/dbraw/zinc/02/64/52/459026452.db2.gz	GQGKYNOBCVRYPD-SFHVURJKSA-N	0	3	345.443	3.332	20	30		EGEDHN
Cc1ccc([C@@H]2C[C@H](C)N([C@H](C)C(=O)NC3(C#N)CCC3)C2)cc1	ZINC000567049871	459040678	/nfs/dbraw/zinc/04/06/78/459040678.db2.gz	CELFGAWMVKMTRC-LZLYRXPVSA-N	0	3	325.456	3.124	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)[C@@H]1COc2ccccc2C1)C(C)C	ZINC000496029667	459042830	/nfs/dbraw/zinc/04/28/30/459042830.db2.gz	RQEPOAJZLHDIMO-RBUKOAKNSA-N	0	3	342.483	3.053	20	30		EGEDHN
Cc1cc(CN[C@H]2CC[C@@H](C#N)C2)ccc1I	ZINC000442854322	459046019	/nfs/dbraw/zinc/04/60/19/459046019.db2.gz	ADLQWNSZZXIKHU-YPMHNXCESA-N	0	3	340.208	3.382	20	30		EGEDHN
C[C@@H]1CN(C(=O)C(C#N)Cc2ccc(C#N)cc2)[C@H]1c1ccccc1	ZINC000577517805	459046136	/nfs/dbraw/zinc/04/61/36/459046136.db2.gz	RVFYGZJGXZVEQO-UIAACRFSSA-N	0	3	329.403	3.460	20	30		EGEDHN
CN1CCC[C@@H](CNC(=O)NCC2(C#N)CCC2)[C@H]1c1cccs1	ZINC000567097457	459047233	/nfs/dbraw/zinc/04/72/33/459047233.db2.gz	ILXGOIZBMRMIHZ-HOCLYGCPSA-N	0	3	346.500	3.124	20	30		EGEDHN
CC(C)c1ccc([C@@H](N)CNC(=O)N2CCC(CC#N)CC2)cc1	ZINC000577606505	459060650	/nfs/dbraw/zinc/06/06/50/459060650.db2.gz	RJJXJTDANFJETK-SFHVURJKSA-N	0	3	328.460	3.145	20	30		EGEDHN
C=CCc1ccc(OC[C@H](O)CN[C@@H]2CCCC[C@H]2F)c(OC)c1	ZINC000577742409	459087550	/nfs/dbraw/zinc/08/75/50/459087550.db2.gz	PPUSHNWZGHSPJP-BRWVUGGUSA-N	0	3	337.435	3.034	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)NCCN2CCCC[C@H]2CC)cc1	ZINC000557853801	459114133	/nfs/dbraw/zinc/11/41/33/459114133.db2.gz	LWOXBPNVHAWBMG-GOSISDBHSA-N	0	3	345.487	3.315	20	30		EGEDHN
CN(CCN1CCCN(c2ccccc2C#N)CC1)c1ccccc1	ZINC000478957271	459116347	/nfs/dbraw/zinc/11/63/47/459116347.db2.gz	KCQCIYCTIFMBGB-UHFFFAOYSA-N	0	3	334.467	3.207	20	30		EGEDHN
C=CC1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)CC1	ZINC000557885839	459116519	/nfs/dbraw/zinc/11/65/19/459116519.db2.gz	WAQUIGNZNJMCCJ-APWZRJJASA-N	0	3	327.472	3.257	20	30		EGEDHN
CCN1CC[C@H](N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)C1=O	ZINC000594712160	459137133	/nfs/dbraw/zinc/13/71/33/459137133.db2.gz	ZMUVTFVDOKRCNR-YWZLYKJASA-N	0	3	333.435	3.497	20	30		EGEDHN
N#CCc1ccc(OC[C@@H](O)CNCc2ccc3occc3c2)cc1	ZINC000594718999	459138796	/nfs/dbraw/zinc/13/87/96/459138796.db2.gz	YCUCUOIRSANHJV-SFHVURJKSA-N	0	3	336.391	3.028	20	30		EGEDHN
CC(C)(CO)[C@@H](NCCCOc1cccc(C#N)c1)c1cccnc1	ZINC000590599693	459157598	/nfs/dbraw/zinc/15/75/98/459157598.db2.gz	FVNCCHLQDHDYCO-IBGZPJMESA-N	0	3	339.439	3.072	20	30		EGEDHN
C=CC[C@@H](C)NCc1cc(I)cc([N+](=O)[O-])c1	ZINC000558485545	459165783	/nfs/dbraw/zinc/16/57/83/459165783.db2.gz	DNZGCFATKOOAES-SECBINFHSA-N	0	3	346.168	3.254	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CCC[C@H]1[C@H]1CCCO1)C(C)C	ZINC000480515940	459202239	/nfs/dbraw/zinc/20/22/39/459202239.db2.gz	IHHRIYLKOZOSSW-IPMKNSEASA-N	0	3	349.519	3.038	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC2(CC(NCc3ccc(C#N)c(F)c3)C2)C1	ZINC000496506757	459219167	/nfs/dbraw/zinc/21/91/67/459219167.db2.gz	UZXLRIONDUJHEM-UHFFFAOYSA-N	0	3	345.418	3.186	20	30		EGEDHN
CC(C)(C)OC(=O)NC1(CNCc2ccc(C#N)c(F)c2)CCC1	ZINC000496733483	459304714	/nfs/dbraw/zinc/30/47/14/459304714.db2.gz	AXANHPICGRRSGE-UHFFFAOYSA-N	0	3	333.407	3.234	20	30		EGEDHN
N#Cc1ccc(CCN2CCN(c3cncc4ccccc43)CC2)cc1	ZINC000595454256	459308172	/nfs/dbraw/zinc/30/81/72/459308172.db2.gz	GACFABXJEFUTAM-UHFFFAOYSA-N	0	3	342.446	3.471	20	30		EGEDHN
N#CCc1ccc(C(=O)N(CCN2CCCC2)c2ccccc2)cc1	ZINC000534683512	459345888	/nfs/dbraw/zinc/34/58/88/459345888.db2.gz	WERRIXYANMRLFA-UHFFFAOYSA-N	0	3	333.435	3.495	20	30		EGEDHN
CC(C)(C)[C@@H]1CCCN([C@H]2CCN(c3ccc(C#N)cc3)C2=O)C1	ZINC000483243788	459352599	/nfs/dbraw/zinc/35/25/99/459352599.db2.gz	YKYIXOAEANSJTD-AEFFLSMTSA-N	0	3	325.456	3.422	20	30		EGEDHN
C[C@@H](C(=O)NC1(C#N)CCC1)N1CCC[C@@](C)(c2ccccc2)CC1	ZINC000560470429	459352651	/nfs/dbraw/zinc/35/26/51/459352651.db2.gz	WDDCQMMVFHKFTL-FXAWDEMLSA-N	0	3	339.483	3.381	20	30		EGEDHN
C[C@H](OC[C@@H](O)CN1CCC[C@@H](CC#N)C1)c1ccc(Cl)cc1	ZINC000595610476	459365753	/nfs/dbraw/zinc/36/57/53/459365753.db2.gz	ZLCFHEZXGAVKTR-MPGHIAIKSA-N	0	3	336.863	3.404	20	30		EGEDHN
C=CC1CCN(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)CC1	ZINC000524640388	459377601	/nfs/dbraw/zinc/37/76/01/459377601.db2.gz	OLQRMVOVUMCRFS-LPHOPBHVSA-N	0	3	327.472	3.430	20	30		EGEDHN
CO[C@H]1CCCC[C@H]1NCC#Cc1ccc(OC(F)(F)F)cc1	ZINC000483699575	459383427	/nfs/dbraw/zinc/38/34/27/459383427.db2.gz	MWCNRRPRZZSWHT-CVEARBPZSA-N	0	3	327.346	3.484	20	30		EGEDHN
C[C@H]1CCN(CCNC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)C1	ZINC000524721467	459383653	/nfs/dbraw/zinc/38/36/53/459383653.db2.gz	MFJVDHMGFOOXPM-INIZCTEOSA-N	0	3	349.434	3.422	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC[C@@H]2CCCC[C@@H]2C(F)(F)F)CC1	ZINC000483740508	459387941	/nfs/dbraw/zinc/38/79/41/459387941.db2.gz	GNCWBPIDVVTOMT-ZFWWWQNUSA-N	0	3	347.425	3.305	20	30		EGEDHN
Cc1ccc(OC[C@H](O)CN[C@H]2CCc3cc(C#N)ccc32)c(C)c1	ZINC000591763952	459431349	/nfs/dbraw/zinc/43/13/49/459431349.db2.gz	SOGJLNFLTRKOOW-QUCCMNQESA-N	0	3	336.435	3.192	20	30		EGEDHN
N#Cc1ccc2c(c1)CC[C@@H]2NCCC(=O)Nc1cc(F)cc(F)c1	ZINC000591764906	459431709	/nfs/dbraw/zinc/43/17/09/459431709.db2.gz	SAFCJYVTSUSGSR-SFHVURJKSA-N	0	3	341.361	3.442	20	30		EGEDHN
Cc1ccccc1OC[C@@H](O)CNCc1ccc(C#N)c(Cl)c1	ZINC000591765891	459431911	/nfs/dbraw/zinc/43/19/11/459431911.db2.gz	OUGAEOFTAHKYLF-INIZCTEOSA-N	0	3	330.815	3.050	20	30		EGEDHN
C[C@@]1(NCC#Cc2ccc(OC(F)(F)F)cc2)CCO[C@H]1C1CC1	ZINC000541384349	459451154	/nfs/dbraw/zinc/45/11/54/459451154.db2.gz	UILOMVBSXSDTGF-DLBZAZTESA-N	0	3	339.357	3.484	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N(C)Cc1cccc(NS(C)(=O)=O)c1	ZINC000591839082	459452557	/nfs/dbraw/zinc/45/25/57/459452557.db2.gz	DIKDCJDVXSNQQC-AWEZNQCLSA-N	0	3	343.452	3.123	20	30		EGEDHN
CC(C)[C@@H]1N(C(=O)C(C#N)CCc2ccccc2)CC12CCOCC2	ZINC000569555107	459471001	/nfs/dbraw/zinc/47/10/01/459471001.db2.gz	YHGLEWDQQKJVRL-OALUTQOASA-N	0	3	340.467	3.423	20	30		EGEDHN
COc1ccc2ncc(C#N)c(N3CCN(C4CCCC4)CC3)c2c1	ZINC000591894681	459471234	/nfs/dbraw/zinc/47/12/34/459471234.db2.gz	AGYYECIMLJGZGR-UHFFFAOYSA-N	0	3	336.439	3.180	20	30		EGEDHN
C=CCn1c(-c2sccc2C)nnc1N1C[C@H](C)N(CC)C[C@H]1C	ZINC000583052544	459472668	/nfs/dbraw/zinc/47/26/68/459472668.db2.gz	DNUKNDBGFMJRJN-LSDHHAIUSA-N	0	3	345.516	3.420	20	30		EGEDHN
C=CCn1c(-c2sccc2C)nnc1N1C[C@@H](C)N(CC)C[C@H]1C	ZINC000583052543	459472940	/nfs/dbraw/zinc/47/29/40/459472940.db2.gz	DNUKNDBGFMJRJN-HUUCEWRRSA-N	0	3	345.516	3.420	20	30		EGEDHN
C=CCOc1ccccc1CNC[C@H](O)COc1ccccc1Cl	ZINC000583317636	459519801	/nfs/dbraw/zinc/51/98/01/459519801.db2.gz	RIWQAVOZLGAGOW-INIZCTEOSA-N	0	3	347.842	3.434	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1CCC[C@H]1CCCc1ccccc1	ZINC000486809507	459522623	/nfs/dbraw/zinc/52/26/23/459522623.db2.gz	OAMSGQLLBSSIKX-UYAOXDASSA-N	0	3	341.499	3.482	20	30		EGEDHN
CCCN(CCN1CCCCC1)C(=O)Nc1ccc(C#N)cc1OC	ZINC000562253078	459524029	/nfs/dbraw/zinc/52/40/29/459524029.db2.gz	SCNDUHZCYMMNOS-UHFFFAOYSA-N	0	3	344.459	3.297	20	30		EGEDHN
C=CCOc1ccc(CNCCN2CCO[C@H](CC)C2)cc1Cl	ZINC000487169737	459526843	/nfs/dbraw/zinc/52/68/43/459526843.db2.gz	VKDJHDLDWXGIKR-MRXNPFEDSA-N	0	3	338.879	3.105	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N1CCSC[C@@H](C)C1)C(C)C	ZINC000487371939	459529939	/nfs/dbraw/zinc/52/99/39/459529939.db2.gz	GCRQFLGVKYHJMB-IRXDYDNUSA-N	0	3	339.549	3.080	20	30		EGEDHN
C=C(CN[C@@H](CCCC)C(=O)Nc1cc(C)on1)c1ccccc1	ZINC000487901875	459535790	/nfs/dbraw/zinc/53/57/90/459535790.db2.gz	WRGIWEWUZRBFHN-KRWDZBQOSA-N	0	3	327.428	3.205	20	30		EGEDHN
Cc1nc(NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)ccc1C#N	ZINC000488038235	459536885	/nfs/dbraw/zinc/53/68/85/459536885.db2.gz	ZDXACGOJEYKTTQ-IBGZPJMESA-N	0	3	338.455	3.186	20	30		EGEDHN
C[C@@H]1C[C@@H]1N1CCN(c2nc(C(F)(F)F)ccc2C#N)C[C@@H](C)C1	ZINC000488738389	459550552	/nfs/dbraw/zinc/55/05/52/459550552.db2.gz	YXNMCRPEJUVPTH-SCRDCRAPSA-N	0	3	338.377	3.139	20	30		EGEDHN
C=CCn1cccc1C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1	ZINC000489039703	459558400	/nfs/dbraw/zinc/55/84/00/459558400.db2.gz	KCAUAJALDCRKRW-INIZCTEOSA-N	0	3	338.455	3.025	20	30		EGEDHN
CCCN(CCN1CCCCCC1)C(=O)Nc1cccc(C#N)n1	ZINC000592263705	459563332	/nfs/dbraw/zinc/56/33/32/459563332.db2.gz	TXZVDPYZFOVDSB-UHFFFAOYSA-N	0	3	329.448	3.073	20	30		EGEDHN
C=CCN1CCC(N=c2[nH]oc3ccc(Br)cc32)CC1	ZINC000571012341	459563800	/nfs/dbraw/zinc/56/38/00/459563800.db2.gz	JVMDNPQEPHRCQP-UHFFFAOYSA-N	0	3	336.233	3.075	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](CCC)c2ccccn2)CC1	ZINC000592295930	459572236	/nfs/dbraw/zinc/57/22/36/459572236.db2.gz	MRUQRBZGRIQKCW-GOSISDBHSA-N	0	3	330.476	3.263	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N[C@@H](c1cccs1)c1ccc(F)cc1	ZINC000583687811	459580364	/nfs/dbraw/zinc/58/03/64/459580364.db2.gz	YTULPMLUGPMMNP-GDBMZVCRSA-N	0	3	331.416	3.114	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H](CCCCOC)c2ccccc2)CC1	ZINC000490739800	459585726	/nfs/dbraw/zinc/58/57/26/459585726.db2.gz	KZFCQSZVTHCDBJ-HXUWFJFHSA-N	0	3	342.483	3.006	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@]2(c3ccc(Cl)cc3)C[C@H]2C)CC1	ZINC000491047506	459595542	/nfs/dbraw/zinc/59/55/42/459595542.db2.gz	UXYGZRHQYZDBLT-AUUYWEPGSA-N	0	3	330.859	3.037	20	30		EGEDHN
C[C@@H](NCC(=O)NC1(C#N)CCC1)C1(c2ccccc2)CCCC1	ZINC000527128323	459596830	/nfs/dbraw/zinc/59/68/30/459596830.db2.gz	VOXBOAOHIPHCHI-MRXNPFEDSA-N	0	3	325.456	3.039	20	30		EGEDHN
C#C[C@H](NC(=O)C1CCN(C2CC2)CC1)c1ccc(Cl)cc1F	ZINC000491126392	459600914	/nfs/dbraw/zinc/60/09/14/459600914.db2.gz	NTAOEFAHYWJOLL-KRWDZBQOSA-N	0	3	334.822	3.144	20	30		EGEDHN
C[C@H](NC(C)(C)CNC(=O)N1CCC(CC#N)CC1)c1ccccc1	ZINC000542896185	459608295	/nfs/dbraw/zinc/60/82/95/459608295.db2.gz	LXSGUAKSPJFLJT-INIZCTEOSA-N	0	3	342.487	3.451	20	30		EGEDHN
CCN1C[C@@H](C)N(CC#Cc2ccc(OC(F)(F)F)cc2)C[C@@H]1C	ZINC000498904892	459610120	/nfs/dbraw/zinc/61/01/20/459610120.db2.gz	LNIKHHXCAFRAED-LSDHHAIUSA-N	0	3	340.389	3.351	20	30		EGEDHN
C#CCN(C)CCCNC(=S)Nc1ccc(Cl)cc1Cl	ZINC000491635224	459643371	/nfs/dbraw/zinc/64/33/71/459643371.db2.gz	RMFADPBFGRFXJL-UHFFFAOYSA-N	0	3	330.284	3.235	20	30		EGEDHN
C[C@H](N[C@@H](C)c1ccc2c(c1)CCCC2)C(=O)NC1(C#N)CCC1	ZINC000527298910	459625126	/nfs/dbraw/zinc/62/51/26/459625126.db2.gz	SGYOBCQKVSUNQA-GJZGRUSLSA-N	0	3	325.456	3.167	20	30		EGEDHN
C#CCN1CCC(C(=O)NC[C@@H]2CCCC[C@H]2c2ccccc2)CC1	ZINC000491622603	459641368	/nfs/dbraw/zinc/64/13/68/459641368.db2.gz	GODNAQLSSNZGBG-SFTDATJTSA-N	0	3	338.495	3.422	20	30		EGEDHN
C=CCN1CC[C@H](N2CC[C@H](c3cccc(C(F)(F)F)c3)C2)C1=O	ZINC000499618824	459642627	/nfs/dbraw/zinc/64/26/27/459642627.db2.gz	KVUOTERZMVLZNI-HOCLYGCPSA-N	0	3	338.373	3.282	20	30		EGEDHN
C[C@H](CCc1ccc(I)cc1)NC[C@H](C)C#N	ZINC000527526563	459655468	/nfs/dbraw/zinc/65/54/68/459655468.db2.gz	IOBRMVPBUOERKN-VXGBXAGGSA-N	0	3	342.224	3.362	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1c[nH]cc1-c1ccc(Cl)s1	ZINC000491718819	459661131	/nfs/dbraw/zinc/66/11/31/459661131.db2.gz	WKTUHTCNAUGJTP-UHFFFAOYSA-N	0	3	335.860	3.082	20	30		EGEDHN
C#CCNC(=O)C1CCN(Cc2ccc(-c3ccc(F)cc3)o2)CC1	ZINC000491733175	459663297	/nfs/dbraw/zinc/66/32/97/459663297.db2.gz	IBTHSYMXXAZXMC-UHFFFAOYSA-N	0	3	340.398	3.047	20	30		EGEDHN
Cc1ccc(C)c(OC[C@H](O)CN2CCC(CCC#N)CC2)c1C	ZINC000563068192	459709574	/nfs/dbraw/zinc/70/95/74/459709574.db2.gz	LOUOTYMGWWZESI-LJQANCHMSA-N	0	3	330.472	3.367	20	30		EGEDHN
C=CCCC[C@@H](C)NC(=O)N[C@H](CN(C)C)c1ccc(OC)cc1	ZINC000501551519	459735789	/nfs/dbraw/zinc/73/57/89/459735789.db2.gz	GWNYEKZNQBITRG-CRAIPNDOSA-N	0	3	333.476	3.342	20	30		EGEDHN
CC(C)Cc1ccc([C@H](CNC(=O)NCC(C)(C)C#N)N(C)C)cc1	ZINC000501822791	459747561	/nfs/dbraw/zinc/74/75/61/459747561.db2.gz	KJKINBULZNLFIJ-SFHVURJKSA-N	0	3	344.503	3.337	20	30		EGEDHN
CC(C)[C@H](Cc1ccc(F)cc1)NCC(=O)Nc1ccc(C#N)cc1	ZINC000544438695	459760472	/nfs/dbraw/zinc/76/04/72/459760472.db2.gz	UAJVUIRIDHADEY-IBGZPJMESA-N	0	3	339.414	3.493	20	30		EGEDHN
N#CCSCC(=O)Nc1ccc(SCCN2CCCCC2)cc1	ZINC000573970239	459763374	/nfs/dbraw/zinc/76/33/74/459763374.db2.gz	XCAKYKCBJKSXCR-UHFFFAOYSA-N	0	3	349.525	3.460	20	30		EGEDHN
Cc1ccc(CN2CC[C@H](CN(C)C(=O)C3(C#N)CCCC3)C2)s1	ZINC000564059314	459770324	/nfs/dbraw/zinc/77/03/24/459770324.db2.gz	HGVZJAFGMSBHRO-MRXNPFEDSA-N	0	3	345.512	3.421	20	30		EGEDHN
CN(CCN1CCCCC1)Cc1cc(C#N)ccc1Br	ZINC000593112074	459776128	/nfs/dbraw/zinc/77/61/28/459776128.db2.gz	JKBNTEWRUHYPPE-UHFFFAOYSA-N	0	3	336.277	3.238	20	30		EGEDHN
CC(C)OC1CCN(Cc2cn(C)nc2-c2ccc(C#N)cc2)CC1	ZINC000574110267	459780320	/nfs/dbraw/zinc/78/03/20/459780320.db2.gz	VXLFHRQYTUVDMK-UHFFFAOYSA-N	0	3	338.455	3.348	20	30		EGEDHN
CCN1CCN(c2ccc(C(=O)Nc3ccccc3CC#N)cc2)CC1	ZINC000565204110	459782190	/nfs/dbraw/zinc/78/21/90/459782190.db2.gz	MASCDAUGEDZEIV-UHFFFAOYSA-N	0	3	348.450	3.147	20	30		EGEDHN
N#C[C@H]1CC[C@H](NCc2cccc(NC(=O)NCc3ccncc3)c2)C1	ZINC000565636972	459786583	/nfs/dbraw/zinc/78/65/83/459786583.db2.gz	DBKIMMIXWFWZCJ-WMZOPIPTSA-N	0	3	349.438	3.185	20	30		EGEDHN
Cc1oc(C)c(C(=O)N(CCN(C)C)Cc2cccc(C#N)c2)c1C	ZINC000585698225	459834799	/nfs/dbraw/zinc/83/47/99/459834799.db2.gz	FPKIGLKVGYIGPG-UHFFFAOYSA-N	0	3	339.439	3.281	20	30		EGEDHN
C[C@@H](CN1CCC(C)CC1)NC(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000598262394	459841680	/nfs/dbraw/zinc/84/16/80/459841680.db2.gz	ZJNBQKNTTCJWKP-INIZCTEOSA-N	0	3	327.472	3.338	20	30		EGEDHN
CN(C)Cc1ccc(NC(=O)[C@H]2CCCN2c2ccc(C#N)cc2)cc1	ZINC000609100866	459905446	/nfs/dbraw/zinc/90/54/46/459905446.db2.gz	FPWHNCLECCZQLZ-HXUWFJFHSA-N	0	3	348.450	3.227	20	30		EGEDHN
CC[C@@H](CNC(=O)CCCCCC#N)N1CCc2ccccc2C1	ZINC000588149589	459919601	/nfs/dbraw/zinc/91/96/01/459919601.db2.gz	DMPFAJRDDFXTOK-IBGZPJMESA-N	0	3	327.472	3.414	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(Cc3cc4cnccc4o3)CC2)cc1	ZINC000593568497	459924176	/nfs/dbraw/zinc/92/41/76/459924176.db2.gz	UDKCUDKIQRSPGW-UHFFFAOYSA-N	0	3	346.434	3.407	20	30		EGEDHN
COC[C@@H](CC(C)(C)C)N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000593614864	459933974	/nfs/dbraw/zinc/93/39/74/459933974.db2.gz	XVLOJHQJCBJHTK-AEFFLSMTSA-N	0	3	343.471	3.094	20	30		EGEDHN
CN(Cc1ccccc1OC(F)(F)F)C[C@@H](O)CC(C)(C)C#N	ZINC000598587485	459954386	/nfs/dbraw/zinc/95/43/86/459954386.db2.gz	RDGJQFNYRZHSOP-ZDUSSCGKSA-N	0	3	330.350	3.318	20	30		EGEDHN
N#CC1(c2ccccn2)CCN(CCN2CCc3ccccc32)CC1	ZINC000575239227	459954623	/nfs/dbraw/zinc/95/46/23/459954623.db2.gz	MGKFNDJSLCPAOX-UHFFFAOYSA-N	0	3	332.451	3.001	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN1CC[C@H](OCCCc2ccccc2)C1	ZINC000598591749	459955545	/nfs/dbraw/zinc/95/55/45/459955545.db2.gz	AZZMMYDQYJKUNN-OALUTQOASA-N	0	3	330.472	3.011	20	30		EGEDHN
Cc1ccccc1[C@H]([C@H](C)NC(=O)N1CCC[C@](C)(C#N)C1)N(C)C	ZINC000588722071	459975314	/nfs/dbraw/zinc/97/53/14/459975314.db2.gz	SWSJBRJNBCRKEH-XKGZKEIXSA-N	0	3	342.487	3.322	20	30		EGEDHN
CC[C@H](C)C(=O)Nc1cccc(CNC[C@H](O)CC(C)(C)C#N)c1	ZINC000598700412	459998793	/nfs/dbraw/zinc/99/87/93/459998793.db2.gz	NEGXWFPAHAZYQR-WMLDXEAASA-N	0	3	331.460	3.062	20	30		EGEDHN
N#Cc1cccc(CN[C@@H](Cc2ccccc2)[C@@H](O)C(F)(F)F)c1	ZINC000609707813	460009419	/nfs/dbraw/zinc/00/94/19/460009419.db2.gz	YYZNPLXLPGQNEX-DLBZAZTESA-N	0	3	334.341	3.182	20	30		EGEDHN
N#Cc1ccc(CN[C@H](Cc2ccccc2)[C@@H](O)C(F)(F)F)cc1	ZINC000609707683	460009698	/nfs/dbraw/zinc/00/96/98/460009698.db2.gz	RXMXNHWOWWDVBC-IAGOWNOFSA-N	0	3	334.341	3.182	20	30		EGEDHN
COc1nc(C)cc(C)c1CNC(=O)C(C#N)CCc1ccccc1	ZINC000597657627	460020217	/nfs/dbraw/zinc/02/02/17/460020217.db2.gz	RKVYXWFDMIONTN-KRWDZBQOSA-N	0	3	337.423	3.096	20	30		EGEDHN
COCCN(CCc1noc2ccccc21)Cc1ccc(C#N)cc1	ZINC000593952081	460024958	/nfs/dbraw/zinc/02/49/58/460024958.db2.gz	FRYHZCCYLXDXFS-UHFFFAOYSA-N	0	3	335.407	3.391	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CNCc1cc(F)cc(OC)c1	ZINC000575916491	460031463	/nfs/dbraw/zinc/03/14/63/460031463.db2.gz	JUMDQSGMTLXHPL-GOSISDBHSA-N	0	3	345.414	3.092	20	30		EGEDHN
Cc1cc(CN[C@@H](C)CC2(C#N)CCOCC2)cc(N2CCCC2)n1	ZINC000602667607	460056427	/nfs/dbraw/zinc/05/64/27/460056427.db2.gz	QQCKXWUATHBFSZ-KRWDZBQOSA-N	0	3	342.487	3.179	20	30		EGEDHN
N#CCc1cccc(C(=O)N(CCN2CCCC2)c2ccccc2)c1	ZINC000610051398	460056748	/nfs/dbraw/zinc/05/67/48/460056748.db2.gz	QXJGEEGQWKAIRN-UHFFFAOYSA-N	0	3	333.435	3.495	20	30		EGEDHN
CCCN(CCN1CCCC1)C(=O)[C@@H](C)Cc1ccc(C#N)cc1	ZINC000594023274	460060755	/nfs/dbraw/zinc/06/07/55/460060755.db2.gz	PGFVKOZBEQTELN-KRWDZBQOSA-N	0	3	327.472	3.071	20	30		EGEDHN
COC(=O)CC[C@@H](CC1CCCCC1)NCc1cccc(C#N)n1	ZINC000602702046	460074514	/nfs/dbraw/zinc/07/45/14/460074514.db2.gz	NANFEVSFQIVEGT-INIZCTEOSA-N	0	3	329.444	3.335	20	30		EGEDHN
N#Cc1ccc2c(c1)CCCC[C@H]2NCc1ccc(CC(N)=O)cc1	ZINC000589344807	460076806	/nfs/dbraw/zinc/07/68/06/460076806.db2.gz	KFWOFPMBVDPIKI-HXUWFJFHSA-N	0	3	333.435	3.143	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccc3c(c2)CCCCC3=O)nc(C)n1	ZINC000576199893	460088651	/nfs/dbraw/zinc/08/86/51/460088651.db2.gz	UASXPJVTCJMZMU-KRWDZBQOSA-N	0	3	333.391	3.493	20	30		EGEDHN
CN1CCC(n2ncc3cc(-c4cccc(F)c4C#N)cnc32)CC1	ZINC000598929872	460092960	/nfs/dbraw/zinc/09/29/60/460092960.db2.gz	JWPDXTAHSINPGH-UHFFFAOYSA-N	0	3	335.386	3.376	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H]1CCN(c2nc3c(cc2C#N)CCC3)C1	ZINC000610281732	460106218	/nfs/dbraw/zinc/10/62/18/460106218.db2.gz	CKZYECYQWQCADY-LJQANCHMSA-N	0	3	332.451	3.153	20	30		EGEDHN
CN(C)Cc1c2ccccc2oc1C(=O)N1CCC[C@@H](CC#N)C1	ZINC000597911713	460107532	/nfs/dbraw/zinc/10/75/32/460107532.db2.gz	BKHHVWJVTZFCND-AWEZNQCLSA-N	0	3	325.412	3.260	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H](C)OCc2ccccc2C)CC1	ZINC000625323142	460126866	/nfs/dbraw/zinc/12/68/66/460126866.db2.gz	OYANCAUYGYGDDZ-KRWDZBQOSA-N	0	3	330.472	3.057	20	30		EGEDHN
N#CCC1(CN2CCC(NC(=O)Nc3ccc(F)cc3)CC2)CC1	ZINC000602790480	460128279	/nfs/dbraw/zinc/12/82/79/460128279.db2.gz	GINHOAODSONXLZ-UHFFFAOYSA-N	0	3	330.407	3.105	20	30		EGEDHN
CC(C)(COc1ncccc1Br)NCC1(CC#N)CC1	ZINC000602797487	460130928	/nfs/dbraw/zinc/13/09/28/460130928.db2.gz	JPOXGXNDLKHPAU-UHFFFAOYSA-N	0	3	338.249	3.285	20	30		EGEDHN
CC(C)(C(=O)N[C@H]1CCCN2CCCC[C@@H]12)c1cc(F)cc(C#N)c1	ZINC000594196800	460143428	/nfs/dbraw/zinc/14/34/28/460143428.db2.gz	MUPFVQHQLOBGCM-ROUUACIJSA-N	0	3	343.446	3.108	20	30		EGEDHN
N#CCCCCCC(=O)Nc1cccc(CN2CCC(O)CC2)c1	ZINC000589840698	460148984	/nfs/dbraw/zinc/14/89/84/460148984.db2.gz	UZCGDNYDISNHGY-UHFFFAOYSA-N	0	3	329.444	3.056	20	30		EGEDHN
N#Cc1ccccc1OCCN[C@H](Cn1cccn1)c1ccccc1	ZINC000610432956	460150829	/nfs/dbraw/zinc/15/08/29/460150829.db2.gz	KUKBPUPHTFVYFK-LJQANCHMSA-N	0	3	332.407	3.165	20	30		EGEDHN
CN(Cc1ccccc1)[C@H]1CCN(CCOc2ccccc2C#N)C1	ZINC000610433438	460151450	/nfs/dbraw/zinc/15/14/50/460151450.db2.gz	KSLBBJOVBSALEH-FQEVSTJZSA-N	0	3	335.451	3.143	20	30		EGEDHN
CC(C)(C)N1C[C@@H](C(=O)N[C@H]2CCCC[C@H]2C#N)[C@H](C(F)(F)F)C1	ZINC000598094130	460171326	/nfs/dbraw/zinc/17/13/26/460171326.db2.gz	COZVDPRRHAMLAA-DGAVXFQQSA-N	0	3	345.409	3.094	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN[C@H]([C@@H]1CCCO1)C1(CO)CCC1	ZINC000602890278	460173410	/nfs/dbraw/zinc/17/34/10/460173410.db2.gz	GCHCCAPXGPDHSH-RBUKOAKNSA-N	0	3	342.483	3.288	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)C(=O)N[C@@H]1CCCN2CCCC[C@@H]12	ZINC000594282882	460179377	/nfs/dbraw/zinc/17/93/77/460179377.db2.gz	AXENVRSOSUEPCM-LZQZEXGQSA-N	0	3	340.471	3.278	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)C(=O)N1CCN(C2CCC2)C[C@H](C)C1	ZINC000594363257	460195933	/nfs/dbraw/zinc/19/59/33/460195933.db2.gz	OXXAHBJXKYOSRZ-IRXDYDNUSA-N	0	3	339.483	3.070	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CCC[C@H](OC2CCC2)C1	ZINC000594390898	460203669	/nfs/dbraw/zinc/20/36/69/460203669.db2.gz	YCGPSAWVEMCDKO-HKUYNNGSSA-N	0	3	326.440	3.319	20	30		EGEDHN
CC(C)[C@@H](C(=O)N[C@H]1CCc2cc(C#N)ccc21)N1CCCCC1	ZINC000618892794	460210641	/nfs/dbraw/zinc/21/06/41/460210641.db2.gz	QGEWINGRNHAENA-OALUTQOASA-N	0	3	325.456	3.172	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N[C@H]1COc2cc(F)ccc2C1	ZINC000598222348	460211121	/nfs/dbraw/zinc/21/11/21/460211121.db2.gz	XDWFUHFLQZFVRH-FUHWJXTLSA-N	0	3	338.382	3.018	20	30		EGEDHN
N#CCCCC[C@@H](N)C(=O)Nc1ccccc1NCC(F)(F)F	ZINC000594440241	460221556	/nfs/dbraw/zinc/22/15/56/460221556.db2.gz	ARLVWMBFJUFNNH-LLVKDONJSA-N	0	3	328.338	3.011	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@H](N)CCCCC#N)CCc2ccc(Cl)cc21	ZINC000594452187	460224694	/nfs/dbraw/zinc/22/46/94/460224694.db2.gz	DVFZEAQCYXWNGQ-CXAGYDPISA-N	0	3	333.863	3.239	20	30		EGEDHN
C[C@@]1(NC[C@H](O)COc2ccccc2C#N)CCCc2ccccc21	ZINC000599327314	460229430	/nfs/dbraw/zinc/22/94/30/460229430.db2.gz	RGNKSOXEJUDGRP-GHTZIAJQSA-N	0	3	336.435	3.139	20	30		EGEDHN
CSc1ccccc1[C@@H](C)NC[C@@H](O)COc1ccccc1C#N	ZINC000599399433	460247333	/nfs/dbraw/zinc/24/73/33/460247333.db2.gz	SBOHIHDHOFVNQU-GDBMZVCRSA-N	0	3	342.464	3.371	20	30		EGEDHN
CCN(C(=O)Nc1ccnc(C#N)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000603135598	460250427	/nfs/dbraw/zinc/25/04/27/460250427.db2.gz	RHDAGBQQHQQBRW-IBGZPJMESA-N	0	3	349.438	3.082	20	30		EGEDHN
Cc1ncc([C@@H](C)N2CCCN(Cc3ccc(C#N)cc3)CC2)c(C)n1	ZINC000614963557	460253668	/nfs/dbraw/zinc/25/36/68/460253668.db2.gz	HLMCAPZNYZAYMC-QGZVFWFLSA-N	0	3	349.482	3.234	20	30		EGEDHN
CC(C)C(NC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1)C(C)C	ZINC000610908068	460258673	/nfs/dbraw/zinc/25/86/73/460258673.db2.gz	UPNLHSMHJGLTFT-UHFFFAOYSA-N	0	3	344.503	3.312	20	30		EGEDHN
C=CCC1(NC(=O)[C@H]2CCCN(Cc3cccnc3)C2)CCCC1	ZINC000619104784	460269858	/nfs/dbraw/zinc/26/98/58/460269858.db2.gz	WKLYENMIAZXEDT-SFHVURJKSA-N	0	3	327.472	3.299	20	30		EGEDHN
N#CCN1CCC(NCc2cc(C(F)(F)F)ccc2Cl)CC1	ZINC000611080824	460286420	/nfs/dbraw/zinc/28/64/20/460286420.db2.gz	PMTIGHZYIOBQGX-UHFFFAOYSA-N	0	3	331.769	3.436	20	30		EGEDHN
COc1cc(NC(=O)NC[C@@H](C)N2CCCC[C@H]2C)c(F)cc1C#N	ZINC000599818712	460340938	/nfs/dbraw/zinc/34/09/38/460340938.db2.gz	ZDWMLMWOOWRHKH-CHWSQXEVSA-N	0	3	348.422	3.090	20	30		EGEDHN
C[C@H](C(=O)N(C)CCC#N)N1CCC[C@@H](c2cc3ccccc3[nH]2)C1	ZINC000603890045	460356339	/nfs/dbraw/zinc/35/63/39/460356339.db2.gz	MKHLCCQMPPOKEG-NVXWUHKLSA-N	0	3	338.455	3.108	20	30		EGEDHN
CC1CCN([C@@H](CNC(=O)NCC2(C#N)CC2)c2cccs2)CC1	ZINC000619525785	460374355	/nfs/dbraw/zinc/37/43/55/460374355.db2.gz	KNOWZIJBDAREBS-HNNXBMFYSA-N	0	3	346.500	3.124	20	30		EGEDHN
COc1ccc([C@H](NC2CCN(CC#N)CC2)c2ccccc2)cc1	ZINC000611519341	460386110	/nfs/dbraw/zinc/38/61/10/460386110.db2.gz	WPBTYHAUDCPHAU-OAQYLSRUSA-N	0	3	335.451	3.362	20	30		EGEDHN
C=C[C@H](NCc1ccccc1-c1ccc(CN(C)C)cc1)C(=O)OC	ZINC000619700490	460418664	/nfs/dbraw/zinc/41/86/64/460418664.db2.gz	ZBZATYHKWLMMGQ-FQEVSTJZSA-N	0	3	338.451	3.232	20	30		EGEDHN
CCOC(=O)c1csc(C(C#N)C(=O)c2cc3ccsc3[nH]2)n1	ZINC000604433354	460426879	/nfs/dbraw/zinc/42/68/79/460426879.db2.gz	JDQQWPKHKVGILB-SECBINFHSA-N	0	3	345.405	3.353	20	30		EGEDHN
N#CCCn1cc(CN2CCCC(F)(F)CC2)c(-c2ccncc2)n1	ZINC000600187020	460427106	/nfs/dbraw/zinc/42/71/06/460427106.db2.gz	AFSNNMCHGOVYGY-UHFFFAOYSA-N	0	3	345.397	3.480	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@H](CO)CC(C)C)cc1OC	ZINC000623372989	460515271	/nfs/dbraw/zinc/51/52/71/460515271.db2.gz	OJSQQQZBJGKRAM-AWEZNQCLSA-N	0	3	327.852	3.410	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)N1CCC[C@@](C)(C#N)C1)c1ccsc1	ZINC000612100118	460540986	/nfs/dbraw/zinc/54/09/86/460540986.db2.gz	ZDQRUDISBCRQNJ-WMZOPIPTSA-N	0	3	348.516	3.466	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1ccccc1CC#N)C(C)C	ZINC000601165456	460737007	/nfs/dbraw/zinc/73/70/07/460737007.db2.gz	PCNJTGDRGIHFLL-IBGZPJMESA-N	0	3	325.456	3.181	20	30		EGEDHN
Cc1cccc2c1CC[C@@H]2N[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000617099082	460742965	/nfs/dbraw/zinc/74/29/65/460742965.db2.gz	PWGHAOKUTZYXNR-SFTDATJTSA-N	0	3	345.446	3.245	20	30		EGEDHN
CC(C)[C@H](N[C@H]1CCCc2cc(C#N)ccc21)[C@H](O)C(F)(F)F	ZINC000601301384	460781155	/nfs/dbraw/zinc/78/11/55/460781155.db2.gz	ZGNIFAKILFKRQN-JYJNAYRXSA-N	0	3	326.362	3.473	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H]2C[C@@]2(C)c2ccccc2)CC1	ZINC000608426150	461060030	/nfs/dbraw/zinc/06/00/30/461060030.db2.gz	DSRAHQQOKQRVSP-ICSRJNTNSA-N	0	3	327.472	3.056	20	30		EGEDHN
C=CCCC(C)(C)NC(=O)C(=O)Nc1cccc(CN(CC)CC)c1	ZINC000658976889	461121639	/nfs/dbraw/zinc/12/16/39/461121639.db2.gz	NJQLVSZNSLJZQW-UHFFFAOYSA-N	0	3	345.487	3.328	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1S[C@H](C)C#CCC	ZINC000665685893	461207026	/nfs/dbraw/zinc/20/70/26/461207026.db2.gz	YINDEPHPDCCGPY-MRXNPFEDSA-N	0	3	332.517	3.387	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@@H]1CNCc1cc(OC)c(OC)cc1Cl	ZINC000631127760	461573758	/nfs/dbraw/zinc/57/37/58/461573758.db2.gz	VHUPBYZAGQCSRC-SJKOYZFVSA-N	0	3	325.836	3.428	20	30		EGEDHN
C=CCN(C(=O)N[C@H](CN1CCCC1)c1ccccc1)[C@@H](C)COC	ZINC000663644521	461732909	/nfs/dbraw/zinc/73/29/09/461732909.db2.gz	XMQRYQHKGROPID-PKOBYXMFSA-N	0	3	345.487	3.056	20	30		EGEDHN
C=CC[C@H]1CCCN(C(=O)NCc2cccc(OCCN(C)C)c2)C1	ZINC000660386978	461745401	/nfs/dbraw/zinc/74/54/01/461745401.db2.gz	SNDWKJJAXOCKPM-KRWDZBQOSA-N	0	3	345.487	3.125	20	30		EGEDHN
C=CCN1CCC(NC(=O)COc2ccccc2C(C)(C)C)CC1	ZINC000171722834	526422260	/nfs/dbraw/zinc/42/22/60/526422260.db2.gz	NRPMIQDLVJOMFB-UHFFFAOYSA-N	0	3	330.472	3.130	20	30		EGEDHN
C=CCN1CCC(NC(=O)Cc2coc3c2ccc(C)c3C)CC1	ZINC000171726427	526424205	/nfs/dbraw/zinc/42/42/05/526424205.db2.gz	HLBYPKLYHZWDKY-UHFFFAOYSA-N	0	3	326.440	3.359	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(OCCC)c(OCC)c2)CC1	ZINC000171721723	526448025	/nfs/dbraw/zinc/44/80/25/526448025.db2.gz	JEZNEABMJVRGRX-UHFFFAOYSA-N	0	3	346.471	3.254	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cccc(OC3CCCC3)c2)CC1	ZINC000171716614	526449845	/nfs/dbraw/zinc/44/98/45/526449845.db2.gz	OXWOUHODNNZYTA-UHFFFAOYSA-N	0	3	328.456	3.388	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H]2SCCc3sccc32)CC1	ZINC000173102280	526597899	/nfs/dbraw/zinc/59/78/99/526597899.db2.gz	QMKGBWKUCHFIRY-MRXNPFEDSA-N	0	3	336.526	3.235	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cc(Cl)ccc2NC2CC2)CC1	ZINC000174490412	526931970	/nfs/dbraw/zinc/93/19/70/526931970.db2.gz	FYOSVQCZQRMYIH-UHFFFAOYSA-N	0	3	331.847	3.198	20	30		EGEDHN
C/C=C(\C=C\C(=O)N(CCN(C)C)Cc1cccc(C#N)c1)CC	ZINC000178610236	527566829	/nfs/dbraw/zinc/56/68/29/527566829.db2.gz	IYOJWVJLSFISMY-QAXYGIPHSA-N	0	3	325.456	3.361	20	30		EGEDHN
CCN(CC)[C@@H](CNCc1ccc(C#N)o1)c1cccc(OC)c1	ZINC000174251892	528245630	/nfs/dbraw/zinc/24/56/30/528245630.db2.gz	PRUGWTNYZMMOTN-IBGZPJMESA-N	0	3	327.428	3.333	20	30		EGEDHN
CCOc1ccc(C2(CNCc3ccc(C#N)o3)CCOCC2)cc1	ZINC000174303097	528412692	/nfs/dbraw/zinc/41/26/92/528412692.db2.gz	CUXARICKPSFYPX-UHFFFAOYSA-N	0	3	340.423	3.388	20	30		EGEDHN
CCCn1ccnc1CCCN(C)Cc1ccc(OC)c(C#N)c1	ZINC000191509164	528866797	/nfs/dbraw/zinc/86/67/97/528866797.db2.gz	OBXSNRFGLXNJJJ-UHFFFAOYSA-N	0	3	326.444	3.238	20	30		EGEDHN
CCO[C@H]1C[C@@](CO)(NCc2cccc(OCCCC#N)c2)C1(C)C	ZINC000186582640	547130923	/nfs/dbraw/zinc/13/09/23/547130923.db2.gz	KCZGJFBGFPKSSZ-ICSRJNTNSA-N	0	3	346.471	3.025	20	30		EGEDHN
O=C(N[C@@H]1CCN(Cc2ccccc2)C1)N[C@@H]1CCCc2occc21	ZINC000328660961	547482786	/nfs/dbraw/zinc/48/27/86/547482786.db2.gz	WHNGVGZYWLYRHY-SJLPKXTDSA-N	0	3	339.439	3.435	20	30		EGEDHN
O=C(NCC1CCN(c2ccncc2)CC1)[C@@H]1CCc2cccnc21	ZINC000329219357	547492089	/nfs/dbraw/zinc/49/20/89/547492089.db2.gz	SKWQTRHWGDYCIU-GOSISDBHSA-N	0	3	336.439	3.380	20	30		EGEDHN
CCN1CCC[C@@H]1CNC(=O)N[C@@H]1CCCOc2ccc(F)cc21	ZINC000329801471	547508133	/nfs/dbraw/zinc/50/81/33/547508133.db2.gz	JPWVMJDDKCIMKB-GDBMZVCRSA-N	0	3	335.423	3.027	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1c(C)noc1C(F)F)C(C)C	ZINC000673669338	548593478	/nfs/dbraw/zinc/59/34/78/548593478.db2.gz	IWWKTFSLXZFDBN-ZDUSSCGKSA-N	0	3	341.402	3.349	20	30		EGEDHN
C#Cc1cccc(NC(=S)N2CCN(CCC(C)(C)C)CC2)c1	ZINC000726473656	574559568	/nfs/dbraw/zinc/55/95/68/574559568.db2.gz	SFGHAHYXFJAGSO-UHFFFAOYSA-N	0	3	329.513	3.419	20	30		EGEDHN
CCC(=O)N[C@H](C)C(=O)C(C#N)c1nc(-c2ccc(C)cc2)cs1	ZINC000729069964	574810432	/nfs/dbraw/zinc/81/04/32/574810432.db2.gz	JKRDZPOFOIAWFU-TZMCWYRMSA-N	0	3	341.436	3.210	20	30		EGEDHN
C=CCN1CCC(NC(=S)Nc2ccc(OC(C)C)cc2)CC1	ZINC000729942844	574897950	/nfs/dbraw/zinc/89/79/50/574897950.db2.gz	UXADVVQXOSGWNT-UHFFFAOYSA-N	0	3	333.501	3.411	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(CCc2ccccc2)C2CC2)CC1	ZINC000730125599	574922212	/nfs/dbraw/zinc/92/22/12/574922212.db2.gz	WXWULLLVKDAQHI-UHFFFAOYSA-N	0	3	327.472	3.054	20	30		EGEDHN
C#CCOc1ccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000731113186	575055363	/nfs/dbraw/zinc/05/53/63/575055363.db2.gz	LNZDFKAWDNXOOL-LJQANCHMSA-N	0	3	349.434	3.095	20	30		EGEDHN
N#CC1CCN(C(=O)N[C@H](CN2CCCCC2)c2ccccc2)CC1	ZINC000734279695	575461431	/nfs/dbraw/zinc/46/14/31/575461431.db2.gz	BUQUXJWIHBLLRC-LJQANCHMSA-N	0	3	340.471	3.159	20	30		EGEDHN
C=CC[C@@H](NC(=O)N1CCCN(C(C)(C)C)CC1)c1ccncc1	ZINC000734678805	575540950	/nfs/dbraw/zinc/54/09/50/575540950.db2.gz	IOVCOUJWNHDKHD-QGZVFWFLSA-N	0	3	330.476	3.215	20	30		EGEDHN
COCC#CCN[C@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000678756309	576170291	/nfs/dbraw/zinc/17/02/91/576170291.db2.gz	BRAGWXLLULZKGI-OAHLLOKOSA-N	0	3	340.398	3.378	20	30		EGEDHN
C=C(C)CNC(=S)N(C)[C@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000737458544	576232772	/nfs/dbraw/zinc/23/27/72/576232772.db2.gz	WPBFQXCUCZPDAS-AEFFLSMTSA-N	0	3	331.529	3.422	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@@H](C)Cc1ccccc1F	ZINC000739143376	576379591	/nfs/dbraw/zinc/37/95/91/576379591.db2.gz	KDWCBDXFPKOUIP-GOEBONIOSA-N	0	3	332.419	3.410	20	30		EGEDHN
C[C@H](Cc1ccccc1F)C(=O)C(C#N)C(=O)NC1CCCCC1	ZINC000739153292	576379889	/nfs/dbraw/zinc/37/98/89/576379889.db2.gz	AITFYWBUNXZNFR-CZUORRHYSA-N	0	3	330.403	3.162	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2ccc(Cl)cc2Cl)CC1	ZINC000740735694	576621377	/nfs/dbraw/zinc/62/13/77/576621377.db2.gz	MQIREFLBJUMEQE-UHFFFAOYSA-N	0	3	325.239	3.211	20	30		EGEDHN
C#CCCN1CCC(NC(=O)C(c2ccccc2)c2ccccc2)CC1	ZINC000740737818	576622120	/nfs/dbraw/zinc/62/21/20/576622120.db2.gz	KGVKFUMYXXXSBG-UHFFFAOYSA-N	0	3	346.474	3.422	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2csc3c2CC[C@@H](C)C3)CC1	ZINC000740748799	576623104	/nfs/dbraw/zinc/62/31/04/576623104.db2.gz	YZPHSVCGUUWBBH-CQSZACIVSA-N	0	3	330.497	3.090	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)C[C@@H]3c4ccccc4NC3=O)nc21	ZINC000741122411	576656510	/nfs/dbraw/zinc/65/65/10/576656510.db2.gz	QMUGCVYXVSCGBF-KGLIPLIRSA-N	0	3	344.374	3.174	20	30		EGEDHN
C=CCNC(=O)C(C#N)C(=O)C[C@H](C)c1ccccc1C(F)(F)F	ZINC000744030853	576819222	/nfs/dbraw/zinc/81/92/22/576819222.db2.gz	NEFMSPMTFWVWJQ-AAEUAGOBSA-N	0	3	338.329	3.210	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)[C@H](C)c2ccco2)cc1Cl	ZINC000744031936	576819246	/nfs/dbraw/zinc/81/92/46/576819246.db2.gz	DHCGLTSCXCETKV-ZYHUDNBSSA-N	0	3	346.770	3.393	20	30		EGEDHN
CC[C@H]1CN(CC(=O)C(C#N)c2nc3ccccc3s2)CCS1	ZINC000744424801	576827874	/nfs/dbraw/zinc/82/78/74/576827874.db2.gz	VTDRNGNUXWIDOD-QWHCGFSZSA-N	0	3	345.493	3.300	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)CCSc1ccc(F)cc1	ZINC000049231713	1291625257	/nfs/dbraw/zinc/62/52/57/1291625257.db2.gz	PFCFADVWMSXKOK-HNNXBMFYSA-N	0	3	336.432	3.323	20	30		EGEDHN
C=CCOc1c(Br)cc(CNCCOC)cc1OCC	ZINC000057901136	1291867389	/nfs/dbraw/zinc/86/73/89/1291867389.db2.gz	KVYCVTBACIHDNW-UHFFFAOYSA-N	0	3	344.249	3.149	20	30		EGEDHN
COC(=O)COc1c(C)cc(CNCc2cccc(C#N)c2)cc1C	ZINC000066971931	1292137129	/nfs/dbraw/zinc/13/71/29/1292137129.db2.gz	URSRCSWGHSJFEU-UHFFFAOYSA-N	0	3	338.407	3.017	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)CCc1nc2ccccc2s1	ZINC000069911299	1292253619	/nfs/dbraw/zinc/25/36/19/1292253619.db2.gz	CZPXMLCZFHHFKK-ZDUSSCGKSA-N	0	3	343.452	3.244	20	30		EGEDHN
Cc1cc(C#N)ccc1CN[C@H](C)c1ccc(N2CCNC2=O)cc1	ZINC000829750788	1292613903	/nfs/dbraw/zinc/61/39/03/1292613903.db2.gz	DJHKYXBRGXERBQ-OAHLLOKOSA-N	0	3	334.423	3.247	20	30		EGEDHN
CC[C@H](C#N)Oc1cccc(CNCc2ccc([S@](C)=O)cc2)c1	ZINC000085324369	1292720350	/nfs/dbraw/zinc/72/03/50/1292720350.db2.gz	OOMCYBNPZFOLLC-MZNJEOGPSA-N	0	3	342.464	3.395	20	30		EGEDHN
CC[C@@H](C#N)Oc1cccc(CNCc2ccc([S@](C)=O)cc2)c1	ZINC000085324367	1292720513	/nfs/dbraw/zinc/72/05/13/1292720513.db2.gz	OOMCYBNPZFOLLC-BXKMTCNYSA-N	0	3	342.464	3.395	20	30		EGEDHN
C#CCOc1ccc([C@@H](C)NCc2ccc([S@](C)=O)cc2)cc1	ZINC000090221438	1292791101	/nfs/dbraw/zinc/79/11/01/1292791101.db2.gz	TXTJIRVTXNKUBO-IQMFZBJNSA-N	0	3	327.449	3.287	20	30		EGEDHN
C#Cc1cccc(CN[C@@H](CN2CCOCC2)c2ccccc2C)c1	ZINC000834904638	1293171310	/nfs/dbraw/zinc/17/13/10/1293171310.db2.gz	ZXJXTRFMBYSQAX-QFIPXVFZSA-N	0	3	334.463	3.139	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)C[C@@H]1CCc2ccccc21	ZINC000115904689	1293196348	/nfs/dbraw/zinc/19/63/48/1293196348.db2.gz	XVRFKPAWWMHLDP-RDJZCZTQSA-N	0	3	348.402	3.463	20	30		EGEDHN
COCCCNC(=O)C(C#N)C(=O)C[C@@H](C)c1ccc(C(C)C)cc1	ZINC000121595606	1293380381	/nfs/dbraw/zinc/38/03/81/1293380381.db2.gz	KSSSSDPOEOGIRG-CRAIPNDOSA-N	0	3	344.455	3.165	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cnn(C3CCCC3)c2C)CC1	ZINC000121634221	1293381071	/nfs/dbraw/zinc/38/10/71/1293381071.db2.gz	BCMHCJKFZXBCEZ-UHFFFAOYSA-N	0	3	330.476	3.077	20	30		EGEDHN
C[C@H](CC(=O)C(C#N)C(=O)NC1CC1)c1cccc(C(F)(F)F)c1	ZINC000121739130	1293386768	/nfs/dbraw/zinc/38/67/68/1293386768.db2.gz	AABXYRXAOORBQE-YGRLFVJLSA-N	0	3	338.329	3.186	20	30		EGEDHN
C#CCNC(=O)[C@H](C)N1CCC(c2c[nH]c3c2cccc3CC)CC1	ZINC000125001223	1293491752	/nfs/dbraw/zinc/49/17/52/1293491752.db2.gz	UCGUNTDJWJLCDF-HNNXBMFYSA-N	0	3	337.467	3.048	20	30		EGEDHN
CCCSCC(=O)C(C#N)C(=O)Nc1ccc(OC)c(Cl)c1	ZINC000125591882	1293512129	/nfs/dbraw/zinc/51/21/29/1293512129.db2.gz	LCQHRUCTDMDWKX-NSHDSACASA-N	0	3	340.832	3.139	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/CCC(=O)N2CCCCC2)c([O-])c1	ZINC000127990627	1293579222	/nfs/dbraw/zinc/57/92/22/1293579222.db2.gz	PWLBXDZOFMRZPM-HMMYKYKNSA-N	0	3	331.460	3.060	20	30		EGEDHN
CC[C@@H](C)OCC(=O)C(C#N)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000152367339	1293965249	/nfs/dbraw/zinc/96/52/49/1293965249.db2.gz	ZPYMRVOZPJFVGK-NOZJJQNGSA-N	0	3	343.210	3.456	20	30		EGEDHN
C=CCc1cc(CN(C)[C@H]2CCCc3c2cnn3C)c(O)c(OC)c1	ZINC000164540548	1294350131	/nfs/dbraw/zinc/35/01/31/1294350131.db2.gz	JCBLSYFFPUBFNK-KRWDZBQOSA-N	0	3	341.455	3.372	20	30		EGEDHN
N#CC(C(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)[C@H]1CCCOC1	ZINC000171037131	1294392233	/nfs/dbraw/zinc/39/22/33/1294392233.db2.gz	ZDJOHBUIQFYFES-TVQRCGJNSA-N	0	3	341.194	3.067	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)C[C@H](C)c1ccccc1OC	ZINC000171401916	1294406088	/nfs/dbraw/zinc/40/60/88/1294406088.db2.gz	FGZYERNZARYHIB-HOCLYGCPSA-N	0	3	330.428	3.204	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)CC[C@H]2CC[C@H](C)O2)cc1	ZINC000173968402	1294474529	/nfs/dbraw/zinc/47/45/29/1294474529.db2.gz	ASPOIJXVXLYAFR-IAOVAPTHSA-N	0	3	328.412	3.244	20	30		EGEDHN
N#CC(C(=O)CC[C@@H]1CCOC1)c1nc2ccccc2n1C(F)F	ZINC000176100167	1294590362	/nfs/dbraw/zinc/59/03/62/1294590362.db2.gz	QGABUFOTFUMPAO-VXGBXAGGSA-N	0	3	333.338	3.424	20	30		EGEDHN
C=CCOc1ccc(CN2CCC[C@H](C3OCCO3)C2)cc1Cl	ZINC000179366232	1294788647	/nfs/dbraw/zinc/78/86/47/1294788647.db2.gz	XVIXOQLWZOXWRG-HNNXBMFYSA-N	0	3	337.847	3.490	20	30		EGEDHN
C=CCNC(=O)CN[C@@H]1CCCc2cc(SC(F)F)ccc21	ZINC000180037721	1294854580	/nfs/dbraw/zinc/85/45/80/1294854580.db2.gz	YXWDPRZJPNGARE-CQSZACIVSA-N	0	3	326.412	3.271	20	30		EGEDHN
C#CCN1CCC(C(=O)NCC2(c3cccc(Cl)c3)CCC2)CC1	ZINC000871570137	1296433647	/nfs/dbraw/zinc/43/36/47/1296433647.db2.gz	HPQCMRRYKWBYMQ-UHFFFAOYSA-N	0	3	344.886	3.223	20	30		EGEDHN
CCO[C@@H]1C[C@H]1C(=O)C(C#N)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000249739392	1296451490	/nfs/dbraw/zinc/45/14/90/1296451490.db2.gz	XGSSOMZOYOMXGV-FRRDWIJNSA-N	0	3	341.194	3.066	20	30		EGEDHN
CN(C)[C@@H]1Cc2ccccc2N(C(=O)/C=C\c2ccccc2C#N)C1	ZINC000255265687	1296512331	/nfs/dbraw/zinc/51/23/31/1296512331.db2.gz	HYDVCKSOUBUOTM-YAINUAMHSA-N	0	3	331.419	3.091	20	30		EGEDHN
C#CCCCNCc1c(F)ccc(I)c1F	ZINC000309585903	1297074244	/nfs/dbraw/zinc/07/42/44/1297074244.db2.gz	SENDEOKNOMFNSX-UHFFFAOYSA-N	0	3	335.135	3.072	20	30		EGEDHN
C[C@H]1CC[C@@H](NCc2cc(C#N)cs2)CN1C(=O)OC(C)(C)C	ZINC000690964298	1298131685	/nfs/dbraw/zinc/13/16/85/1298131685.db2.gz	IUGKZFVHWLLZBR-GXTWGEPZSA-N	0	3	335.473	3.497	20	30		EGEDHN
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@H](C)CCC#N	ZINC000876828114	1299019122	/nfs/dbraw/zinc/01/91/22/1299019122.db2.gz	LWODFLKXCJBFDW-MRXNPFEDSA-N	0	3	330.476	3.189	20	30		EGEDHN
CC(=O)[C@@](C#N)(CCN1CCc2ccc(O)cc2CC1)c1ccccc1	ZINC000878233171	1299847818	/nfs/dbraw/zinc/84/78/18/1299847818.db2.gz	RSSDRFXQBXYVSK-QFIPXVFZSA-N	0	3	348.446	3.233	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=S)Nc2ccc(C#N)c(Cl)c2)CN1C1CC1	ZINC000753958830	1300053238	/nfs/dbraw/zinc/05/32/38/1300053238.db2.gz	AOXRPKOTPYLPTE-ZWNOBZJWSA-N	0	3	334.876	3.123	20	30		EGEDHN
CC(=O)[C@@](C#N)(CCN1CCC2(CCOCC2)CC1)c1ccccc1	ZINC000878573857	1300086441	/nfs/dbraw/zinc/08/64/41/1300086441.db2.gz	MYHJGIQOJLKHCJ-NRFANRHFSA-N	0	3	340.467	3.320	20	30		EGEDHN
COC(=O)C12CCC(C(=O)C(C#N)c3nc4ccccc4o3)(CC1)C2	ZINC000759439760	1301092364	/nfs/dbraw/zinc/09/23/64/1301092364.db2.gz	BJDQIAJPRJLSQC-RMEHTXHKSA-N	0	3	338.363	3.128	20	30		EGEDHN
COc1ccc(-n2c(C)cc(C(=O)C(C#N)c3ccncn3)c2C)cc1	ZINC000760337973	1301256835	/nfs/dbraw/zinc/25/68/35/1301256835.db2.gz	CMHVRKZMISCUGI-SFHVURJKSA-N	0	3	346.390	3.383	20	30		EGEDHN
Cc1cc(CNCc2ccc(C(=O)N3CCCC3)cc2)ccc1C#N	ZINC000767661888	1302737876	/nfs/dbraw/zinc/73/78/76/1302737876.db2.gz	HCWVFRJMPCHVGG-UHFFFAOYSA-N	0	3	333.435	3.393	20	30		EGEDHN
N#C[C@H]1CNCC12CC(C(=O)N1CCC[C@H]1CC1CCCCC1)C2	ZINC000884110470	1302738787	/nfs/dbraw/zinc/73/87/87/1302738787.db2.gz	LERQDXWVWJKIIW-NRGCRIOASA-N	0	3	329.488	3.087	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN(C)Cc2ccc3c(c2)OCCO3)cc1	ZINC000768184999	1302849263	/nfs/dbraw/zinc/84/92/63/1302849263.db2.gz	VZJBJDOBPMQIPU-OAHLLOKOSA-N	0	3	338.407	3.381	20	30		EGEDHN
C#CCNC(=O)C1CC[NH+](Cc2cc(-c3ccccc3)ccc2[O-])CC1	ZINC000769022972	1303033037	/nfs/dbraw/zinc/03/30/37/1303033037.db2.gz	XJNGDRKZZGXXJW-UHFFFAOYSA-N	0	3	348.446	3.021	20	30		EGEDHN
C=CCN(C(=O)Nc1cccc(N2CCN(CC)CC2)c1)C(C)C	ZINC000771273719	1303384683	/nfs/dbraw/zinc/38/46/83/1303384683.db2.gz	RYYZTQTWASDPLJ-UHFFFAOYSA-N	0	3	330.476	3.257	20	30		EGEDHN
C=CCC1(O)CCN(Cc2ccc3oc(C(=O)OC)cc3c2)CC1	ZINC000886766042	1303590024	/nfs/dbraw/zinc/59/00/24/1303590024.db2.gz	APXGFKVNTABQNO-UHFFFAOYSA-N	0	3	329.396	3.122	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(C[NH2+]Cc2nnc(-c3ccccc3)[n-]2)cc1	ZINC000774816225	1303862094	/nfs/dbraw/zinc/86/20/94/1303862094.db2.gz	VLRLDTJLOKUKKS-CQSZACIVSA-N	0	3	333.395	3.052	20	30		EGEDHN
CCN1CCCC[C@@H]1C(=O)N1CCC(c2ccc(C#N)cc2)CC1	ZINC000887704487	1303901253	/nfs/dbraw/zinc/90/12/53/1303901253.db2.gz	HRLMMYFFGMIKIX-LJQANCHMSA-N	0	3	325.456	3.139	20	30		EGEDHN
N#CCCNC(=O)CN[C@H](Cc1ccccc1Cl)c1ccccc1	ZINC000775297398	1303936059	/nfs/dbraw/zinc/93/60/59/1303936059.db2.gz	RIVINPVWQVVDOV-GOSISDBHSA-N	0	3	341.842	3.243	20	30		EGEDHN
N#Cc1cccc(C2(NC[C@@H](O)COc3ccc(Cl)cc3)CC2)c1	ZINC000775430714	1303962619	/nfs/dbraw/zinc/96/26/19/1303962619.db2.gz	HSACUPLPZFCMDM-QGZVFWFLSA-N	0	3	342.826	3.230	20	30		EGEDHN
C#CCNC(=O)CN[C@H](C)c1ccccc1-c1ccc(Cl)cc1	ZINC000775453029	1303965734	/nfs/dbraw/zinc/96/57/34/1303965734.db2.gz	AIPQPRNHWLNMSS-CQSZACIVSA-N	0	3	326.827	3.407	20	30		EGEDHN
C#C[C@H](N[C@@H](C)CC(=O)Nc1cc(Cl)ccc1C)[C@@H]1CCCO1	ZINC000775574361	1303988545	/nfs/dbraw/zinc/98/85/45/1303988545.db2.gz	PHNWIRIYBSIMRX-QRTARXTBSA-N	0	3	334.847	3.136	20	30		EGEDHN
C#CCOc1ccccc1CN[C@H]1CCN(c2ccc(F)cc2F)C1	ZINC000776701130	1304185494	/nfs/dbraw/zinc/18/54/94/1304185494.db2.gz	OVJCFIHFPCRADD-KRWDZBQOSA-N	0	3	342.389	3.345	20	30		EGEDHN
N#Cc1cccn(CN2C[C@H](c3ccccc3)[C@@H]3CCCC[C@H]32)c1=O	ZINC000776771238	1304196198	/nfs/dbraw/zinc/19/61/98/1304196198.db2.gz	GWRAXYKLUCKQNG-XUVXKRRUSA-N	0	3	333.435	3.336	20	30		EGEDHN
C#CCCCCCC(=O)Nc1cccc2c1CCN(CC(C)(C)O)C2	ZINC000784730946	1305278003	/nfs/dbraw/zinc/27/80/03/1305278003.db2.gz	CPADUMBRRMPVEB-UHFFFAOYSA-N	0	3	342.483	3.338	20	30		EGEDHN
N#CC(C(=O)Nc1cccc2ccccc21)C(=O)[C@@H]1OC[C@@H]2CCC[C@@H]21	ZINC000892490285	1305402569	/nfs/dbraw/zinc/40/25/69/1305402569.db2.gz	RTXSDCDVFUCDLD-JWWIWJDOSA-N	0	3	348.402	3.302	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(Cl)cc1)C(=O)[C@@H]1CCOC2(CCC2)C1	ZINC000892493778	1305405767	/nfs/dbraw/zinc/40/57/67/1305405767.db2.gz	RWWRDHQROPDMJE-IUODEOHRSA-N	0	3	346.814	3.337	20	30		EGEDHN
C[C@H](CC(=O)C(C#N)C(=O)NC1CCCC1)c1c[nH]c2ccccc21	ZINC000786320829	1305556011	/nfs/dbraw/zinc/55/60/11/1305556011.db2.gz	CVBKAYHTFUFKMH-CZUORRHYSA-N	0	3	337.423	3.429	20	30		EGEDHN
C[C@H](CC(=O)C(C#N)C(=O)Nc1ccccn1)c1c[nH]c2ccccc21	ZINC000786329046	1305557125	/nfs/dbraw/zinc/55/71/25/1305557125.db2.gz	KSYJWAQQNYLACY-HIFRSBDPSA-N	0	3	346.390	3.404	20	30		EGEDHN
Cc1c(CC(=O)C(C#N)c2nc3ccccc3o2)cccc1[N+](=O)[O-]	ZINC000788080547	1305861074	/nfs/dbraw/zinc/86/10/74/1305861074.db2.gz	DNIAKYITPTTYAV-CYBMUJFWSA-N	0	3	335.319	3.463	20	30		EGEDHN
C=CCCSCCNCc1sc(N2CCOCC2)nc1Cl	ZINC000895244333	1309256472	/nfs/dbraw/zinc/25/64/72/1309256472.db2.gz	UQXKRORBTKEJEL-UHFFFAOYSA-N	0	3	347.937	3.032	20	30		EGEDHN
C#CCCCCNCc1c(F)ccc(I)c1F	ZINC000793008473	1309281267	/nfs/dbraw/zinc/28/12/67/1309281267.db2.gz	GOHVVDJRPCTCPF-UHFFFAOYSA-N	0	3	349.162	3.463	20	30		EGEDHN
CCC#C[C@@H](C)N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000796466084	1310007675	/nfs/dbraw/zinc/00/76/75/1310007675.db2.gz	PLOXRGRTJLMWKO-MJGOQNOKSA-N	0	3	328.456	3.427	20	30		EGEDHN
C[C@@H]1C(=O)CC[C@@H]1CC(=O)C(C#N)C(=O)Nc1cccc2ccccc21	ZINC000796633600	1310050441	/nfs/dbraw/zinc/05/04/41/1310050441.db2.gz	GAGUGQDAHAPBGC-LXZKKBNFSA-N	0	3	348.402	3.492	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@H](C)Cn1ccc2ccccc21	ZINC000796779975	1310086789	/nfs/dbraw/zinc/08/67/89/1310086789.db2.gz	QXZRPJJFOAXPRL-NVXWUHKLSA-N	0	3	339.439	3.293	20	30		EGEDHN
C[C@@H](NC(=O)c1ccoc1)C(=O)C(C#N)c1ncc(C(C)(C)C)s1	ZINC000797570950	1310214351	/nfs/dbraw/zinc/21/43/51/1310214351.db2.gz	MDKMNPRHSBCXPD-ZYHUDNBSSA-N	0	3	345.424	3.028	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)c1	ZINC000798283205	1310336446	/nfs/dbraw/zinc/33/64/46/1310336446.db2.gz	WGWPSIJFPZQSGE-OAQYLSRUSA-N	0	3	347.462	3.266	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)cc1C#N	ZINC000799319842	1310523549	/nfs/dbraw/zinc/52/35/49/1310523549.db2.gz	RQOVOBDHLLCVIP-UZLBHIALSA-N	0	3	333.435	3.432	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@H]2CCCN2Cc2ccccc2)cc1C#N	ZINC000799335923	1310527282	/nfs/dbraw/zinc/52/72/82/1310527282.db2.gz	LKILKVCJYCEULB-HXUWFJFHSA-N	0	3	333.435	3.261	20	30		EGEDHN
Cc1ccc(C(=O)N(CCN(C)C)Cc2ccccc2F)cc1C#N	ZINC000799337874	1310527483	/nfs/dbraw/zinc/52/74/83/1310527483.db2.gz	SJPFYKFMKJVVGG-UHFFFAOYSA-N	0	3	339.414	3.210	20	30		EGEDHN
COc1cc(CNC[C@H](O)c2c(F)cccc2Cl)ccc1C#N	ZINC000799338299	1310529343	/nfs/dbraw/zinc/52/93/43/1310529343.db2.gz	JQEZUNKQLAOSAC-HNNXBMFYSA-N	0	3	334.778	3.183	20	30		EGEDHN
C#CCN1CCC[C@H](CNC(=O)c2ccc(Cl)c(Cl)c2)C1	ZINC001023717510	1319852243	/nfs/dbraw/zinc/85/22/43/1319852243.db2.gz	HDRLLEAMBGJSKW-GFCCVEGCSA-N	0	3	325.239	3.068	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc(C(C)(F)F)cc2)C1	ZINC001023781735	1319930593	/nfs/dbraw/zinc/93/05/93/1319930593.db2.gz	SYWQFYPNIUVAQG-HNNXBMFYSA-N	0	3	334.410	3.263	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N1CCC[C@H]1c1ccc(Cl)cc1	ZINC000836488790	1320494202	/nfs/dbraw/zinc/49/42/02/1320494202.db2.gz	RAEBHBSCXDLZCH-KRWDZBQOSA-N	0	3	333.863	3.142	20	30		EGEDHN
C=CCC1(O)CCN(C(=O)c2cccc(CN3CCCCC3)c2)CC1	ZINC000899594496	1317104727	/nfs/dbraw/zinc/10/47/27/1317104727.db2.gz	AKPPZGCEHOKIKA-UHFFFAOYSA-N	0	3	342.483	3.216	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CC[C@H](NCc3ccc(Cl)s3)C2)cc1	ZINC001019223042	1317110866	/nfs/dbraw/zinc/11/08/66/1317110866.db2.gz	CHSYPKCUVFRGRO-HNNXBMFYSA-N	0	3	344.867	3.387	20	30		EGEDHN
CC1(C)C(C)(C)C1(C)C(=O)N1CC[C@H](NCc2ccc(C#N)s2)C1	ZINC001019889326	1317457151	/nfs/dbraw/zinc/45/71/51/1317457151.db2.gz	LQNWQGOSTJSSCO-ZDUSSCGKSA-N	0	3	345.512	3.383	20	30		EGEDHN
C#CCOc1cccc(NC(=O)N(CCC)CCN2CCCCC2)c1	ZINC000806262486	1317474857	/nfs/dbraw/zinc/47/48/57/1317474857.db2.gz	JIVFWOOCUQAUOY-UHFFFAOYSA-N	0	3	343.471	3.428	20	30		EGEDHN
C#CCCCCNC(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000806960531	1317539983	/nfs/dbraw/zinc/53/99/83/1317539983.db2.gz	ZPCHZQJJKVOOOZ-IBGZPJMESA-N	0	3	345.487	3.179	20	30		EGEDHN
CC[C@@H](C)N[C@H](CNC(=O)c1ccc(C)c(C#N)c1)c1ccco1	ZINC000807679188	1317576215	/nfs/dbraw/zinc/57/62/15/1317576215.db2.gz	GEGFGYYDMMYYEE-RHSMWYFYSA-N	0	3	325.412	3.319	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)cc1C#N	ZINC000807738787	1317582092	/nfs/dbraw/zinc/58/20/92/1317582092.db2.gz	GVKPKQQCVMBSSN-JXFKEZNVSA-N	0	3	333.435	3.260	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)c2sc(C)cc2C)C1	ZINC001020200273	1317591094	/nfs/dbraw/zinc/59/10/94/1317591094.db2.gz	PHXNVVSEBSUODM-HAQNSBGRSA-N	0	3	343.290	3.124	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC(CN(CC)Cc2nccnc2C)CC1	ZINC000957737472	1317601585	/nfs/dbraw/zinc/60/15/85/1317601585.db2.gz	JGQYHTPNIIXMQZ-UHFFFAOYSA-N	0	3	344.503	3.058	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1C[C@H](N[C@@H](C)c2ccccc2F)C1	ZINC001020241511	1317605773	/nfs/dbraw/zinc/60/57/73/1317605773.db2.gz	NWHMNDBIHQMDJZ-JYJNAYRXSA-N	0	3	341.430	3.425	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC(CN(CC)Cc3cnc(C)o3)CC2)C1	ZINC000957751438	1317620503	/nfs/dbraw/zinc/62/05/03/1317620503.db2.gz	UFIVONXASHUKQN-UHFFFAOYSA-N	0	3	345.487	3.400	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C2(C3CCC3)CCC2)C1	ZINC001020441556	1317699476	/nfs/dbraw/zinc/69/94/76/1317699476.db2.gz	BAOUTGXTJIRDIQ-HDJSIYSDSA-N	0	3	341.293	3.102	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2C[C@H](NCc3cccc(C(C)C)n3)C2)cc1	ZINC001020456625	1317705141	/nfs/dbraw/zinc/70/51/41/1317705141.db2.gz	YTBKJPOXDHGLNO-MXVIHJGJSA-N	0	3	347.462	3.237	20	30		EGEDHN
CCCCOc1ccc(/C=C2\C(=O)c3ncnn3C2C)cc1OC	ZINC000905080914	1317920878	/nfs/dbraw/zinc/92/08/78/1317920878.db2.gz	OFOBKHVPMDSBJC-CJAAZZPWSA-N	0	3	327.384	3.307	20	30		EGEDHN
CC[C@H](C)Oc1cc(/C=C2/C(=O)c3ncnn3C2C)ccc1OC	ZINC000905082769	1317921541	/nfs/dbraw/zinc/92/15/41/1317921541.db2.gz	WXPZVIHBTNHJJP-WBAVQSHJSA-N	0	3	327.384	3.305	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)Cc1cccc(Cl)c1F	ZINC000810526685	1318018426	/nfs/dbraw/zinc/01/84/26/1318018426.db2.gz	DQBNSQUCKLGXGZ-ZDUSSCGKSA-N	0	3	338.810	3.427	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)Cc3cccc(OCC#N)c3)nc21	ZINC000810591012	1318027407	/nfs/dbraw/zinc/02/74/07/1318027407.db2.gz	WCJCMBGYHDGPCF-INIZCTEOSA-N	0	3	344.374	3.193	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000811055508	1318097971	/nfs/dbraw/zinc/09/79/71/1318097971.db2.gz	AVGKUHOBXIQDIV-QFIPXVFZSA-N	0	3	346.474	3.333	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)c2ccsc2C#N)CN1Cc1ccccc1	ZINC000906971164	1318169845	/nfs/dbraw/zinc/16/98/45/1318169845.db2.gz	HESAXRWXZUWCIP-ZFWWWQNUSA-N	0	3	325.437	3.013	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)cc1F	ZINC000959888184	1318253001	/nfs/dbraw/zinc/25/30/01/1318253001.db2.gz	LFMYDVBNBPTJRH-PBHICJAKSA-N	0	3	331.435	3.214	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCCC[C@H]1CNCc1ccc(Cl)cc1F	ZINC000959923130	1318266978	/nfs/dbraw/zinc/26/69/78/1318266978.db2.gz	GAIICBZLEDPKGP-WFASDCNBSA-N	0	3	337.826	3.109	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)C2CC=CC2)c(F)c1	ZINC000959933344	1318272510	/nfs/dbraw/zinc/27/25/10/1318272510.db2.gz	JRNJEYYQOHHVAG-SFHVURJKSA-N	0	3	341.430	3.134	20	30		EGEDHN
CC1CC(C(=O)N2CCCC[C@H]2CNCc2ccc(C#N)s2)C1	ZINC000959946182	1318280735	/nfs/dbraw/zinc/28/07/35/1318280735.db2.gz	AMVPNPUHUJXHAH-NRXISQOPSA-N	0	3	331.485	3.137	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C[C@H]2CCC[C@@H](C)C2)OC)CC1	ZINC000812032960	1318313352	/nfs/dbraw/zinc/31/33/52/1318313352.db2.gz	VGUNKANRDWZQIH-SJORKVTESA-N	0	3	337.508	3.426	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@H](CCCN3C(=O)c3ccco3)C2)c1	ZINC001021507415	1318325305	/nfs/dbraw/zinc/32/53/05/1318325305.db2.gz	YTYKKWQDXIEBFG-MOPGFXCFSA-N	0	3	349.434	3.278	20	30		EGEDHN
C=CCSc1nc2ccccc2n1CN1CC[C@H](n2cccn2)C1	ZINC000812293976	1318360660	/nfs/dbraw/zinc/36/06/60/1318360660.db2.gz	BYBWPGBNCBMDLY-HNNXBMFYSA-N	0	3	339.468	3.415	20	30		EGEDHN
C=C(C)CC[N@@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccccc2[O-])C1	ZINC001021529287	1318367061	/nfs/dbraw/zinc/36/70/61/1318367061.db2.gz	LYVXGBRTQRWYAJ-FUHWJXTLSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=C(C)CC[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccccc2[O-])C1	ZINC001021529287	1318367069	/nfs/dbraw/zinc/36/70/69/1318367069.db2.gz	LYVXGBRTQRWYAJ-FUHWJXTLSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc(Cl)c[nH]1	ZINC000960245470	1318427956	/nfs/dbraw/zinc/42/79/56/1318427956.db2.gz	HBIUKEINAQEMQE-NVXWUHKLSA-N	0	3	329.831	3.230	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@H](CCCN3C(=O)c3cc[nH]c3)C2)c1	ZINC001021592434	1318437849	/nfs/dbraw/zinc/43/78/49/1318437849.db2.gz	RPLHKTVVCMZYAA-WOJBJXKFSA-N	0	3	348.450	3.013	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@@H](CCCN3C(=O)c3cc[nH]c3)C2)c1	ZINC001021592430	1318438052	/nfs/dbraw/zinc/43/80/52/1318438052.db2.gz	RPLHKTVVCMZYAA-PMACEKPBSA-N	0	3	348.450	3.013	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc2cc(F)ccc2[nH]1	ZINC000960293740	1318448473	/nfs/dbraw/zinc/44/84/73/1318448473.db2.gz	QVXZFEOREXKKMY-UYAOXDASSA-N	0	3	349.409	3.478	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2nc(C(C)(C)C)cs2)C1	ZINC001021606068	1318452554	/nfs/dbraw/zinc/45/25/54/1318452554.db2.gz	GPWYELWCBZZSTA-CABCVRRESA-N	0	3	345.512	3.000	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cccc3ccc(C)nc32)C1	ZINC001021615071	1318463697	/nfs/dbraw/zinc/46/36/97/1318463697.db2.gz	UUPJWIXQSGWFMK-ICSRJNTNSA-N	0	3	347.462	3.103	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cccc2oc(C)nc21	ZINC000960333354	1318466255	/nfs/dbraw/zinc/46/62/55/1318466255.db2.gz	JEMOQILISVKRAE-IEBWSBKVSA-N	0	3	347.418	3.308	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)Cc2cccc(C(C)C)c2)C1	ZINC001021623703	1318474309	/nfs/dbraw/zinc/47/43/09/1318474309.db2.gz	KXSAMDSORUBSND-NHCUHLMSSA-N	0	3	338.495	3.299	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(F)ccc2CC)C1	ZINC001021625365	1318475893	/nfs/dbraw/zinc/47/58/93/1318475893.db2.gz	PCOMALIPOKXUCF-YLJYHZDGSA-N	0	3	342.458	3.338	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc3ccccc3s2)C1	ZINC001021626311	1318476778	/nfs/dbraw/zinc/47/67/78/1318476778.db2.gz	FHUYVTSWRREXHT-IRXDYDNUSA-N	0	3	338.476	3.461	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2nc3ccccc3cc2C)C1	ZINC001021635622	1318490596	/nfs/dbraw/zinc/49/05/96/1318490596.db2.gz	LFNRDAVIVFQUSU-QUCCMNQESA-N	0	3	347.462	3.103	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc3ccc(C)cc3[nH]2)C1	ZINC001021637786	1318492951	/nfs/dbraw/zinc/49/29/51/1318492951.db2.gz	AFPVLKMJAZBXBC-FXAWDEMLSA-N	0	3	335.451	3.036	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2csc(Cl)c2)C1	ZINC001021677112	1318546517	/nfs/dbraw/zinc/54/65/17/1318546517.db2.gz	OLPRYDOMADPOKV-HIFRSBDPSA-N	0	3	336.888	3.351	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(F)cc(Cl)c2)C1	ZINC001021678588	1318547857	/nfs/dbraw/zinc/54/78/57/1318547857.db2.gz	YYJZABUYPNMDRG-SUMWQHHRSA-N	0	3	334.822	3.039	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(C(F)F)o2)C1	ZINC001021723986	1318614353	/nfs/dbraw/zinc/61/43/53/1318614353.db2.gz	HRAMJJKIBZQCTG-KGLIPLIRSA-N	0	3	336.382	3.167	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)CCc2ccccc2Cl)C1	ZINC001021726524	1318620082	/nfs/dbraw/zinc/62/00/82/1318620082.db2.gz	CYQBHKMNPYCJKK-PKOBYXMFSA-N	0	3	344.886	3.219	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc3ccccc3o2)C1	ZINC001021726667	1318620844	/nfs/dbraw/zinc/62/08/44/1318620844.db2.gz	FFBZKPBVBAPFKO-ROUUACIJSA-N	0	3	336.435	3.383	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(CC)c(C)s2)C1	ZINC001021728371	1318625367	/nfs/dbraw/zinc/62/53/67/1318625367.db2.gz	SURRQENFRRARKS-DLBZAZTESA-N	0	3	330.497	3.179	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)[C@H]1[C@@H]2CCC[C@@H]21	ZINC000960524139	1318636495	/nfs/dbraw/zinc/63/64/95/1318636495.db2.gz	CFBPSAKLUVWJBO-ZRNYENFQSA-N	0	3	337.467	3.027	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc3[nH]c(C)c(C)c3c2)C1	ZINC001021733880	1318639530	/nfs/dbraw/zinc/63/95/30/1318639530.db2.gz	SLDPSQLUCOBHFZ-NQIIRXRSSA-N	0	3	349.478	3.344	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@@H](NC(=O)C=C3CCCCC3)C2)c(F)c1	ZINC001021880950	1318719472	/nfs/dbraw/zinc/71/94/72/1318719472.db2.gz	ZXUMONJOWAAEBH-HDICACEKSA-N	0	3	341.430	3.325	20	30		EGEDHN
Cc1cc(C(=O)N2CCC[C@@H]2CN(C)Cc2cccc(C#N)c2)co1	ZINC000960592344	1318720974	/nfs/dbraw/zinc/72/09/74/1318720974.db2.gz	VEARKHHOCDUTSG-LJQANCHMSA-N	0	3	337.423	3.196	20	30		EGEDHN
C[C@]1(C(=O)N[C@H]2C[C@@H](NCc3cc(C#N)ccc3F)C2)CC=CCC1	ZINC001022132877	1318814053	/nfs/dbraw/zinc/81/40/53/1318814053.db2.gz	UAQIHNWXURLOOC-QKLQHJQFSA-N	0	3	341.430	3.181	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1cc(Cl)ccc1C(=O)NCCC	ZINC000912304714	1318865134	/nfs/dbraw/zinc/86/51/34/1318865134.db2.gz	UQHHNWDWXOLPPU-AWEZNQCLSA-N	0	3	337.851	3.102	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC[C@@H]2CN(C)Cc2ccccc2)cc1	ZINC000960783701	1318886126	/nfs/dbraw/zinc/88/61/26/1318886126.db2.gz	OKUCTVYYVYUNCT-OAQYLSRUSA-N	0	3	332.447	3.405	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]1CN(C)Cc1ccc(COC)cc1	ZINC000960786193	1318888461	/nfs/dbraw/zinc/88/84/61/1318888461.db2.gz	CCEFTMFQIQZELZ-IBGZPJMESA-N	0	3	344.499	3.468	20	30		EGEDHN
C#CCNC(=O)CCN1CCC[C@H]1c1ccc(Br)c(C)c1	ZINC000815106314	1318894278	/nfs/dbraw/zinc/89/42/78/1318894278.db2.gz	XNRGGWRISPJVQE-INIZCTEOSA-N	0	3	349.272	3.034	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]1CN(C)Cc1cccc(OC)c1	ZINC000960792795	1318899589	/nfs/dbraw/zinc/89/95/89/1318899589.db2.gz	WGXNEINYABVEJQ-QGZVFWFLSA-N	0	3	330.472	3.330	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@H]2CCC[C@@H](C(F)(F)F)C2)C1	ZINC001022343535	1318901071	/nfs/dbraw/zinc/90/10/71/1318901071.db2.gz	PISKDCDCTFXZJP-QNWHQSFQSA-N	0	3	338.801	3.344	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@@H](NC(=O)C3(C4CC4)CCC3)C2)c(F)c1	ZINC001022502240	1318969182	/nfs/dbraw/zinc/96/91/82/1318969182.db2.gz	KFSYJPVMGINVMG-CALCHBBNSA-N	0	3	341.430	3.014	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@@H](NC(=O)C[C@H]3CC=CCC3)C2)c1	ZINC001022550148	1318984160	/nfs/dbraw/zinc/98/41/60/1318984160.db2.gz	VEFCHHWHLOTRSE-JCGIZDLHSA-N	0	3	341.430	3.181	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)C1CC2(CC2)C1	ZINC000960853370	1318995777	/nfs/dbraw/zinc/99/57/77/1318995777.db2.gz	RQWKKGCPSOENJE-IBGZPJMESA-N	0	3	337.467	3.171	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)C(C)(C)C(F)F	ZINC000960855367	1318999692	/nfs/dbraw/zinc/99/96/92/1318999692.db2.gz	YIIYCCVVEAXTRN-MRXNPFEDSA-N	0	3	349.425	3.272	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCC[C@H]1CN(C)Cc1cccc(C#N)c1	ZINC000960904501	1319046695	/nfs/dbraw/zinc/04/66/95/1319046695.db2.gz	HBQWUMSPJUDKKY-LPHOPBHVSA-N	0	3	327.472	3.273	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@H](C)c2ccc(Cl)s2)C1	ZINC001022951601	1319185451	/nfs/dbraw/zinc/18/54/51/1319185451.db2.gz	BNHMVBTXPZANII-MXWKQRLJSA-N	0	3	333.284	3.494	20	30		EGEDHN
CC(=O)N1CCC[C@H]([C@H]2CCN(CC#Cc3cccc(Cl)c3)C2)C1	ZINC000961079929	1319192519	/nfs/dbraw/zinc/19/25/19/1319192519.db2.gz	RFUGWFMYMRZZHZ-OALUTQOASA-N	0	3	344.886	3.272	20	30		EGEDHN
C=CCC[N@H+]1CC[C@H]([C@@H]2CCCN(C(=O)c3ccccc3[O-])C2)C1	ZINC000961092961	1319204412	/nfs/dbraw/zinc/20/44/12/1319204412.db2.gz	MHRCBKVQFKISGC-SJORKVTESA-N	0	3	328.456	3.142	20	30		EGEDHN
C=CCC[N@@H+]1CC[C@H]([C@@H]2CCCN(C(=O)c3ccccc3[O-])C2)C1	ZINC000961092961	1319204422	/nfs/dbraw/zinc/20/44/22/1319204422.db2.gz	MHRCBKVQFKISGC-SJORKVTESA-N	0	3	328.456	3.142	20	30		EGEDHN
CCCC(=O)N1CCC[C@@H]([C@H]2CCN(CC#Cc3ccccc3)C2)C1	ZINC000961101325	1319210988	/nfs/dbraw/zinc/21/09/88/1319210988.db2.gz	RVCXLHYSCCZAHM-RTWAWAEBSA-N	0	3	338.495	3.399	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@@H]2c2cc(F)ccc2F)C1	ZINC001023105906	1319262918	/nfs/dbraw/zinc/26/29/18/1319262918.db2.gz	NRGNPJKVOCTPSC-QVHKTLOISA-N	0	3	340.801	3.058	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@H](C)c2ccc(F)c(F)c2)C1	ZINC001023110250	1319264628	/nfs/dbraw/zinc/26/46/28/1319264628.db2.gz	UZSZHNQFBHLQDD-RTXFEEFZSA-N	0	3	328.790	3.058	20	30		EGEDHN
C[C@@H]1CC[C@H](C(=O)OC(C)(C)C)CN1C[C@@H](O)c1ccc(C#N)cc1	ZINC000817280074	1319312173	/nfs/dbraw/zinc/31/21/73/1319312173.db2.gz	YMDYKJAWSBEDCY-FHLIZLRMSA-N	0	3	344.455	3.034	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@H](CNC(=O)c3cccs3)C2)c1	ZINC001023213321	1319348518	/nfs/dbraw/zinc/34/85/18/1319348518.db2.gz	GBBCFJWYICFXDG-QGZVFWFLSA-N	0	3	339.464	3.262	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H](CNC(=O)c3cccs3)C2)cc1	ZINC001023213266	1319349123	/nfs/dbraw/zinc/34/91/23/1319349123.db2.gz	DRKHNCFVBUQISB-KRWDZBQOSA-N	0	3	339.464	3.262	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H](CNC(=O)c3ccsc3)C2)cc1	ZINC001023218947	1319353461	/nfs/dbraw/zinc/35/34/61/1319353461.db2.gz	GQSDQWVBFIOJNK-KRWDZBQOSA-N	0	3	339.464	3.262	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]([C@@H]2CCN(Cc3cncs3)C2)C1	ZINC000961229174	1319357117	/nfs/dbraw/zinc/35/71/17/1319357117.db2.gz	LQJZRGXJJVXPQT-JKSUJKDBSA-N	0	3	347.528	3.416	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]([C@@H]2CCN(Cc3cnc(C)o3)C2)C1	ZINC000961229643	1319360416	/nfs/dbraw/zinc/36/04/16/1319360416.db2.gz	NCYHDNXEJMQPJI-IAGOWNOFSA-N	0	3	345.487	3.256	20	30		EGEDHN
CC(=O)N[C@@H](C)C(=O)C(C#N)c1nc(-c2ccc(Cl)cc2)cs1	ZINC000915101822	1319423141	/nfs/dbraw/zinc/42/31/41/1319423141.db2.gz	LUOYPVWHPXHDGD-ZANVPECISA-N	0	3	347.827	3.164	20	30		EGEDHN
CC1(C)CC(C(=O)NC[C@@H]2CCCN(Cc3cccc(C#N)c3)C2)C1	ZINC001023349274	1319464068	/nfs/dbraw/zinc/46/40/68/1319464068.db2.gz	ULPQTODVGDTWCI-SFHVURJKSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=CCN1CCC[C@@H](CNC(=O)c2snc(Cl)c2Cl)C1	ZINC001023394150	1319501267	/nfs/dbraw/zinc/50/12/67/1319501267.db2.gz	ODHMCJROQMDYQD-VIFPVBQESA-N	0	3	334.272	3.078	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1ccc(Oc2ccc(F)cc2)cc1	ZINC000818584175	1319563197	/nfs/dbraw/zinc/56/31/97/1319563197.db2.gz	GEFRWUFGWFDPOU-UHFFFAOYSA-N	0	3	340.398	3.303	20	30		EGEDHN
C#CCN(C)CCCNC(=O)CSc1cc(Cl)ccc1Cl	ZINC000818602729	1319566864	/nfs/dbraw/zinc/56/68/64/1319566864.db2.gz	ATBSOXVRKVOALZ-UHFFFAOYSA-N	0	3	345.295	3.157	20	30		EGEDHN
Cc1ccc(C(=O)NC2CC(CNCc3ccccc3C#N)C2)s1	ZINC000961498618	1319618121	/nfs/dbraw/zinc/61/81/21/1319618121.db2.gz	VWZPAGJCANZYKZ-UHFFFAOYSA-N	0	3	339.464	3.226	20	30		EGEDHN
CC[C@@H](C#N)Oc1cccc(CNC[C@H](O)c2c(F)cccc2F)c1	ZINC000819067468	1319626230	/nfs/dbraw/zinc/62/62/30/1319626230.db2.gz	LFISQURPCMWMDI-KSSFIOAISA-N	0	3	346.377	3.469	20	30		EGEDHN
CC1(C)CC[C@H]1C(=O)NC[C@H]1CCCN(Cc2ccc(C#N)cc2)C1	ZINC001023537678	1319644754	/nfs/dbraw/zinc/64/47/54/1319644754.db2.gz	MPEXLWFYZPGGAC-MOPGFXCFSA-N	0	3	339.483	3.323	20	30		EGEDHN
CCOc1ccc2c(c1)[C@@H](NC[C@@H](O)c1ccc(C#N)cc1)CCO2	ZINC000819242057	1319679024	/nfs/dbraw/zinc/67/90/24/1319679024.db2.gz	IPHDWXHGLMSLLO-RBUKOAKNSA-N	0	3	338.407	3.104	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CCCN(CCc3ccns3)C2)CC1	ZINC001023572386	1319688021	/nfs/dbraw/zinc/68/80/21/1319688021.db2.gz	BHFCJVUCBQVQJJ-MRXNPFEDSA-N	0	3	347.528	3.260	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc(C(C)C)nc2CC)C1	ZINC001023591718	1319711146	/nfs/dbraw/zinc/71/11/46/1319711146.db2.gz	IUSCNKMFMHWAAW-KRWDZBQOSA-N	0	3	341.499	3.233	20	30		EGEDHN
CN(CC(=O)C(C#N)c1nc2ccccc2s1)Cc1ccco1	ZINC000917030770	1319741363	/nfs/dbraw/zinc/74/13/63/1319741363.db2.gz	ZDCPQDJFFJIKLG-ZDUSSCGKSA-N	0	3	325.393	3.198	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cnn(C3CCCC3)c2)CC1	ZINC000917097585	1319755867	/nfs/dbraw/zinc/75/58/67/1319755867.db2.gz	BVDWCYYLXZPEPR-UHFFFAOYSA-N	0	3	331.464	3.160	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)[C@@H]2C[C@H]2c2ccc(C)s2)C1	ZINC001023639223	1319758983	/nfs/dbraw/zinc/75/89/83/1319758983.db2.gz	FKLYFDFMPZFOOI-BRWVUGGUSA-N	0	3	330.497	3.012	20	30		EGEDHN
C=CCN1CCC[C@H](CNC(=O)c2cnc(CC(C)(C)C)s2)C1	ZINC001023690256	1319810683	/nfs/dbraw/zinc/81/06/83/1319810683.db2.gz	XZWKRGQQTQMUNA-CQSZACIVSA-N	0	3	335.517	3.360	20	30		EGEDHN
C=CCN1CCC[C@H](CNC(=O)c2sc(Cl)nc2Cl)C1	ZINC001023751140	1319897209	/nfs/dbraw/zinc/89/72/09/1319897209.db2.gz	CIYWRUFXKXDQOE-SECBINFHSA-N	0	3	334.272	3.078	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)NC1CC(CNCc2cc(C#N)ccc2F)C1	ZINC000962279222	1319898126	/nfs/dbraw/zinc/89/81/26/1319898126.db2.gz	UPIRCXVWQZSRRZ-XPJGSDBHSA-N	0	3	343.446	3.118	20	30		EGEDHN
COC(=O)[C@]1(C(F)(F)F)CCN(CCCCC2(C#N)CCC2)C1	ZINC000930451792	1328858418	/nfs/dbraw/zinc/85/84/18/1328858418.db2.gz	TXVHLPMCSGIMPN-HNNXBMFYSA-N	0	3	332.366	3.278	20	30		EGEDHN
C#C[C@@H](NC(=O)N1CCN(C2CC2)C[C@@H](C)C1)c1ccc(Cl)cc1	ZINC000820560741	1319911937	/nfs/dbraw/zinc/91/19/37/1319911937.db2.gz	YSEGDHLPEVAFMF-RDTXWAMCSA-N	0	3	345.874	3.140	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2coc(C3CCCCC3)n2)C1	ZINC001023769737	1319918492	/nfs/dbraw/zinc/91/84/92/1319918492.db2.gz	DQIRORVNPPLTRM-MRXNPFEDSA-N	0	3	343.471	3.187	20	30		EGEDHN
Cc1cccc(C(=O)N[C@@H]2[C@H]3CN(Cc4ccc(C#N)cc4)C[C@H]32)c1C	ZINC000962441816	1319963845	/nfs/dbraw/zinc/96/38/45/1319963845.db2.gz	ISDAIPKCJYBOQH-AERCQKQUSA-N	0	3	345.446	3.035	20	30		EGEDHN
CN(C)Cc1cccc(C(=O)OC[C@@H](C#N)Cc2ccc(F)cc2)c1	ZINC000821623019	1320023166	/nfs/dbraw/zinc/02/31/66/1320023166.db2.gz	ZUUFJNLCPAHAHD-QGZVFWFLSA-N	0	3	340.398	3.427	20	30		EGEDHN
CC(C)C#CC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1	ZINC000824381700	1320253018	/nfs/dbraw/zinc/25/30/18/1320253018.db2.gz	YSGPZEBLRBNPHD-UHFFFAOYSA-N	0	3	340.389	3.255	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCN(C3CC(OCc4ccccc4)C3)C2)nc1	ZINC000930543135	1328890526	/nfs/dbraw/zinc/89/05/26/1328890526.db2.gz	MFCLGHXZJZIBDA-IOJLRTSASA-N	0	3	349.434	3.154	20	30		EGEDHN
C=C(Cl)CNC(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C	ZINC000838624616	1320795864	/nfs/dbraw/zinc/79/58/64/1320795864.db2.gz	HEFCEBMWQCKNPV-AWEZNQCLSA-N	0	3	327.881	3.063	20	30		EGEDHN
C=CCc1cc(C[N@@H+]2CCC[C@@H]2[C@H]2CCC[C@@H]2O)c([O-])c(OC)c1	ZINC000840121013	1321032009	/nfs/dbraw/zinc/03/20/09/1321032009.db2.gz	QDJHYHWYMNUYEC-KURKYZTESA-N	0	3	331.456	3.255	20	30		EGEDHN
C=CCc1cc(C[N@H+]2CCC[C@@H]2[C@H]2CCC[C@@H]2O)c([O-])c(OC)c1	ZINC000840121013	1321032011	/nfs/dbraw/zinc/03/20/11/1321032011.db2.gz	QDJHYHWYMNUYEC-KURKYZTESA-N	0	3	331.456	3.255	20	30		EGEDHN
C=C[C@H](C)ONC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1	ZINC000844283933	1321584821	/nfs/dbraw/zinc/58/48/21/1321584821.db2.gz	KDJIHXAPJZJCJW-LSDHHAIUSA-N	0	3	337.489	3.326	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(Cl)nc(C3CC3)c2)CC1	ZINC000847451973	1321872442	/nfs/dbraw/zinc/87/24/42/1321872442.db2.gz	OXLSEAAYYKKDGR-UHFFFAOYSA-N	0	3	333.863	3.383	20	30		EGEDHN
Cc1nn(C(C)C)cc1C(=O)C(C#N)C(=O)Nc1ccccc1Cl	ZINC000847624843	1321885700	/nfs/dbraw/zinc/88/57/00/1321885700.db2.gz	XXZOOKKYVORQPU-GFCCVEGCSA-N	0	3	344.802	3.387	20	30		EGEDHN
Cc1ccncc1C(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847749280	1321900203	/nfs/dbraw/zinc/90/02/03/1321900203.db2.gz	QROOELCVXIBPHZ-UHFFFAOYSA-N	0	3	349.434	3.353	20	30		EGEDHN
COC(C)(C)CC(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847747913	1321900633	/nfs/dbraw/zinc/90/06/33/1321900633.db2.gz	SJWYMMQZUCQKRS-UHFFFAOYSA-N	0	3	344.455	3.151	20	30		EGEDHN
CC(C)OCCC(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847745788	1321900727	/nfs/dbraw/zinc/90/07/27/1321900727.db2.gz	PJBNSEZJEWDGCY-UHFFFAOYSA-N	0	3	344.455	3.151	20	30		EGEDHN
C/C(=C\C(=O)N1CCC[C@H](CNCc2ccccc2C#N)C1)C1CC1	ZINC001023869058	1321988541	/nfs/dbraw/zinc/98/85/41/1321988541.db2.gz	VXSOUGJBOXBTGT-ABPVARSCSA-N	0	3	337.467	3.243	20	30		EGEDHN
N#Cc1ccc([C@H](O)CNC[C@@H](OC2CCCC2)C(F)(F)F)cc1	ZINC000849328834	1322112885	/nfs/dbraw/zinc/11/28/85/1322112885.db2.gz	QRBHLOFNSMGWLP-HZPDHXFCSA-N	0	3	342.361	3.071	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@@H]1C[C@H]1c1ccc(C)c(C)c1	ZINC000850752920	1322284464	/nfs/dbraw/zinc/28/44/64/1322284464.db2.gz	UUQHQEBQXYWFTB-RCCFBDPRSA-N	0	3	326.440	3.422	20	30		EGEDHN
CC[C@@H](NC(=O)C(C#N)C(=O)[C@@H]1C[C@H]1OC(C)(C)C)c1ccccc1	ZINC000850977904	1322318914	/nfs/dbraw/zinc/31/89/14/1322318914.db2.gz	GPNOOQVYHRGJDW-YYIAUSFCSA-N	0	3	342.439	3.166	20	30		EGEDHN
N#C[C@@H](NC(=O)c1cccc(CN2CCCCC2)c1)C1CCCC1	ZINC000921551735	1322350570	/nfs/dbraw/zinc/35/05/70/1322350570.db2.gz	VBNSVMUVLOTCCI-LJQANCHMSA-N	0	3	325.456	3.485	20	30		EGEDHN
N#Cc1ccc(Br)c(CN[C@H]2CCO[C@H](C3CC3)C2)c1	ZINC000921999698	1322437394	/nfs/dbraw/zinc/43/73/94/1322437394.db2.gz	GPOXDCCDMHTCTA-HOCLYGCPSA-N	0	3	335.245	3.368	20	30		EGEDHN
CCOC(=O)c1c[nH]nc1[C@H]1CCN([C@H](C)c2cccc(C#N)c2)C1	ZINC000931009831	1329027549	/nfs/dbraw/zinc/02/75/49/1329027549.db2.gz	IWSPXMUURHVXKJ-CJNGLKHVSA-N	0	3	338.411	3.009	20	30		EGEDHN
C=C(C)COc1cc(CNCc2cc(N(C)C)ccn2)ccc1OC	ZINC000922477723	1322537493	/nfs/dbraw/zinc/53/74/93/1322537493.db2.gz	DRSSPMMKOMYTNY-UHFFFAOYSA-N	0	3	341.455	3.401	20	30		EGEDHN
CC(=O)N[C@H](c1ccccc1F)[C@H](C)NCc1cccc(C#N)c1	ZINC000924639806	1323088710	/nfs/dbraw/zinc/08/87/10/1323088710.db2.gz	NENRCHNTOMCIEF-DJJJIMSYSA-N	0	3	325.387	3.053	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCN(C(=O)C2(F)CCCC2)C1	ZINC001024045333	1323096141	/nfs/dbraw/zinc/09/61/41/1323096141.db2.gz	GKPREUBXCCIMKB-MRXNPFEDSA-N	0	3	343.446	3.169	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001024094196	1323125658	/nfs/dbraw/zinc/12/56/58/1323125658.db2.gz	GIJVYDPIYBSFFX-OAHLLOKOSA-N	0	3	343.446	3.238	20	30		EGEDHN
C[C@@H](CC(C)(C)C#N)NCc1cccc(C(=O)NC[C@H]2CCCO2)c1	ZINC000924787730	1323163329	/nfs/dbraw/zinc/16/33/29/1323163329.db2.gz	ZVSYPTTUKWVVBN-MAUKXSAKSA-N	0	3	343.471	3.013	20	30		EGEDHN
CC(C)C(=O)N(C)C1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC000963075785	1323201232	/nfs/dbraw/zinc/20/12/32/1323201232.db2.gz	KKOOCEBCMJFIFF-UHFFFAOYSA-N	0	3	331.435	3.213	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)c2ccccn2)C1	ZINC000963236451	1323247737	/nfs/dbraw/zinc/24/77/37/1323247737.db2.gz	RRLAGBJPSNMATQ-DOTOQJQBSA-N	0	3	333.863	3.151	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccn(C2CCCC2)n1	ZINC001024467415	1323423136	/nfs/dbraw/zinc/42/31/36/1323423136.db2.gz	FRSUAICAQAIAPA-QGZVFWFLSA-N	0	3	330.476	3.159	20	30		EGEDHN
C=CCCN1CCCC[C@H]1CNC(=O)c1conc1C1CCCC1	ZINC001024478969	1323431207	/nfs/dbraw/zinc/43/12/07/1323431207.db2.gz	WTQQPIKTZWGJGJ-INIZCTEOSA-N	0	3	331.460	3.493	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cnn2cccc(Cl)c12	ZINC001024542679	1323484918	/nfs/dbraw/zinc/48/49/18/1323484918.db2.gz	ZTLFFDPPVWIOAF-AWEZNQCLSA-N	0	3	346.862	3.148	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cccc2c1O[C@@H](C)C2	ZINC001024561815	1323502959	/nfs/dbraw/zinc/50/29/59/1323502959.db2.gz	YYCYKVLHJGSUPR-RDJZCZTQSA-N	0	3	328.456	3.170	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccc(C)c(Cl)c1F	ZINC001024573266	1323511648	/nfs/dbraw/zinc/51/16/48/1323511648.db2.gz	ZMJPXUXEUOVLFO-AWEZNQCLSA-N	0	3	336.838	3.395	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cnc(-c2ccccc2)[nH]1	ZINC001024685657	1323600895	/nfs/dbraw/zinc/60/08/95/1323600895.db2.gz	LDHDHWPOSVXXHG-KRWDZBQOSA-N	0	3	338.455	3.237	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cccc(C(F)(F)F)n1	ZINC001024722542	1323625132	/nfs/dbraw/zinc/62/51/32/1323625132.db2.gz	VVMIECXVTRANPQ-ZDUSSCGKSA-N	0	3	341.377	3.261	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1cc(-c2ccccc2)ccn1	ZINC001024731109	1323631191	/nfs/dbraw/zinc/63/11/91/1323631191.db2.gz	DHLWQFNTFZBBNL-HXUWFJFHSA-N	0	3	347.462	3.356	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccc(-c2c[nH]cn2)cc1	ZINC001024743747	1323643876	/nfs/dbraw/zinc/64/38/76/1323643876.db2.gz	RRTDHVKLNYFNRF-SFHVURJKSA-N	0	3	338.455	3.237	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccnc(O[C@@H](C)CC)c1	ZINC001024746930	1323648066	/nfs/dbraw/zinc/64/80/66/1323648066.db2.gz	JGUDTTVJICYHKA-WMZOPIPTSA-N	0	3	345.487	3.419	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1cccc(C(F)(F)F)c1	ZINC001024773713	1323674935	/nfs/dbraw/zinc/67/49/35/1323674935.db2.gz	KBFZFVRVIVWLQK-INIZCTEOSA-N	0	3	338.373	3.313	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cc2c(cccc2OC)[nH]1	ZINC001024796434	1323702478	/nfs/dbraw/zinc/70/24/78/1323702478.db2.gz	AOWRUMUNXYZGOM-OAHLLOKOSA-N	0	3	341.455	3.337	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccccc1CC(C)C	ZINC001024816583	1323719560	/nfs/dbraw/zinc/71/95/60/1323719560.db2.gz	MPUBQKLZELMUHT-IBGZPJMESA-N	0	3	326.484	3.493	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)C1CC(c2cccc(F)c2)C1	ZINC001024825025	1323729041	/nfs/dbraw/zinc/72/90/41/1323729041.db2.gz	OWXLVDFJLGQJGZ-AFMYVXGZSA-N	0	3	342.458	3.313	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCCC[C@@H]1CNCc1ccc(F)cc1Cl	ZINC001024902135	1323772792	/nfs/dbraw/zinc/77/27/92/1323772792.db2.gz	IKLISWBNUJJXLA-IUODEOHRSA-N	0	3	337.826	3.109	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)/C=C/C2CC2)s1	ZINC001024910324	1323776287	/nfs/dbraw/zinc/77/62/87/1323776287.db2.gz	MLXQXAHWLRSXLI-RZIFZGNASA-N	0	3	329.469	3.057	20	30		EGEDHN
CC1CC(C(=O)N2CCCC[C@@H]2CNCc2ccc(C#N)c(F)c2)C1	ZINC001024921342	1323785269	/nfs/dbraw/zinc/78/52/69/1323785269.db2.gz	GUBKIBQCJMKAFR-IUPXNIOVSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCCC[C@H]1CNCc1c(C)noc1C	ZINC001025038134	1323840360	/nfs/dbraw/zinc/84/03/60/1323840360.db2.gz	SCQUYOQTBLSLHJ-INIZCTEOSA-N	0	3	333.476	3.364	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCCC[C@@H]1CNCc1ccnc(OC)c1	ZINC001025069757	1323870240	/nfs/dbraw/zinc/87/02/40/1323870240.db2.gz	ODCTZNRNPOLTLD-XLIONFOSSA-N	0	3	345.487	3.163	20	30		EGEDHN
CCC1(C(=O)N2CCCC[C@H]2CNCc2ccc(C#N)c(F)c2)CC1	ZINC001025071156	1323872080	/nfs/dbraw/zinc/87/20/80/1323872080.db2.gz	DCKAEGAGOKDGCM-KRWDZBQOSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCCC[C@H]2CNCc2cncc(C)c2)C1	ZINC001025075230	1323877549	/nfs/dbraw/zinc/87/75/49/1323877549.db2.gz	YKFWTSLDELVQLP-SFHVURJKSA-N	0	3	327.472	3.217	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)Cc1ccsc1	ZINC001025196643	1323979370	/nfs/dbraw/zinc/97/93/70/1323979370.db2.gz	XQRHJCVIMTYHRY-ZWKOTPCHSA-N	0	3	330.497	3.159	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)CCc1ccco1	ZINC001025200613	1323985582	/nfs/dbraw/zinc/98/55/82/1323985582.db2.gz	FNZUXTMJFNSJKP-MOPGFXCFSA-N	0	3	328.456	3.081	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cccc(F)c1C	ZINC001025235036	1324023671	/nfs/dbraw/zinc/02/36/71/1324023671.db2.gz	MRQWOKUVGHCDNO-OALUTQOASA-N	0	3	328.431	3.226	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1conc1C(C)C	ZINC001025236099	1324025223	/nfs/dbraw/zinc/02/52/23/1324025223.db2.gz	DGAWWRNUDBHAHW-IRXDYDNUSA-N	0	3	331.460	3.443	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1csc(C)c1C	ZINC001025236441	1324025838	/nfs/dbraw/zinc/02/58/38/1324025838.db2.gz	USUBELMFHHAVRJ-QZTJIDSGSA-N	0	3	330.497	3.457	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc2cc(C)cn2c1	ZINC001025238616	1324029283	/nfs/dbraw/zinc/02/92/83/1324029283.db2.gz	UAHZYWPFRQJNPR-LEWJYISDSA-N	0	3	349.478	3.340	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccncc1CC	ZINC001025244417	1324041839	/nfs/dbraw/zinc/04/18/39/1324041839.db2.gz	JLOCCAUGDGGJBN-VQTJNVASSA-N	0	3	339.483	3.126	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cccc2cccnc21	ZINC001025247521	1324046889	/nfs/dbraw/zinc/04/68/89/1324046889.db2.gz	LRKMSUZGXXKYCK-VQTJNVASSA-N	0	3	347.462	3.327	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc2cnccc2o1	ZINC001025248119	1324048536	/nfs/dbraw/zinc/04/85/36/1324048536.db2.gz	VPSOHKZHOZDHKI-DLBZAZTESA-N	0	3	339.439	3.473	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ocnc1C1CC1	ZINC001025268899	1324081397	/nfs/dbraw/zinc/08/13/97/1324081397.db2.gz	HWWKDVTYQFAZRD-HOTGVXAUSA-N	0	3	329.444	3.197	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc(C)c(F)c1F	ZINC001025269508	1324081784	/nfs/dbraw/zinc/08/17/84/1324081784.db2.gz	RQXIXPJYWHCSQU-IRXDYDNUSA-N	0	3	346.421	3.366	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1csc2cncn21	ZINC001025273268	1324089250	/nfs/dbraw/zinc/08/92/50/1324089250.db2.gz	CFKUFZIRCJRRBE-GJZGRUSLSA-N	0	3	344.484	3.041	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cccc(OC)c1F	ZINC001025283332	1324104060	/nfs/dbraw/zinc/10/40/60/1324104060.db2.gz	FPFLIDLENFDUPJ-SJORKVTESA-N	0	3	346.446	3.479	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ncccc1Cl	ZINC001025293047	1324118836	/nfs/dbraw/zinc/11/88/36/1324118836.db2.gz	OYNWWYDVJADQAX-JKSUJKDBSA-N	0	3	333.863	3.380	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)Cc1c[nH]c2ccccc12	ZINC001025293675	1324122021	/nfs/dbraw/zinc/12/20/21/1324122021.db2.gz	UFFUMNHKRPDHAI-NHCUHLMSSA-N	0	3	349.478	3.189	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc(Cl)cc1	ZINC001025294315	1324122563	/nfs/dbraw/zinc/12/25/63/1324122563.db2.gz	ZHOLUCRUFQDSPJ-QZTJIDSGSA-N	0	3	330.859	3.432	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1sc(C)nc1C	ZINC001025294399	1324123666	/nfs/dbraw/zinc/12/36/66/1324123666.db2.gz	AOLKCCBBPJNXSU-CVEARBPZSA-N	0	3	333.501	3.405	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(F)cc(F)c1	ZINC001025294449	1324124259	/nfs/dbraw/zinc/12/42/59/1324124259.db2.gz	BGCSCFIKZXREJU-RTBURBONSA-N	0	3	346.421	3.447	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc2ccccc2[nH]1	ZINC001025297420	1324128820	/nfs/dbraw/zinc/12/88/20/1324128820.db2.gz	PUWIDQROESDNSZ-UXHICEINSA-N	0	3	335.451	3.260	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc2ccccc2[nH]1	ZINC001025297422	1324129290	/nfs/dbraw/zinc/12/92/90/1324129290.db2.gz	PUWIDQROESDNSZ-WOJBJXKFSA-N	0	3	335.451	3.260	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cccnc1OCC	ZINC001025298274	1324131753	/nfs/dbraw/zinc/13/17/53/1324131753.db2.gz	VSBNKKNVUWVAPA-ZWKOTPCHSA-N	0	3	343.471	3.125	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(C)n(C(C)C)n1	ZINC001025304153	1324139109	/nfs/dbraw/zinc/13/91/09/1324139109.db2.gz	MJTVAYSAGYPXFO-RTBURBONSA-N	0	3	344.503	3.418	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2sc(C3CC3)nc2C)C1	ZINC001025418925	1324250730	/nfs/dbraw/zinc/25/07/30/1324250730.db2.gz	GFRTZDHHTLVREP-CZUORRHYSA-N	0	3	345.512	3.183	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(C)c(OC)c(C)c2)C1	ZINC001025419951	1324253536	/nfs/dbraw/zinc/25/35/36/1324253536.db2.gz	QOXWLXLJKNVBBC-QZTJIDSGSA-N	0	3	342.483	3.166	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2conc2C2CCCC2)C1	ZINC001025437768	1324276995	/nfs/dbraw/zinc/27/69/95/1324276995.db2.gz	AKXORYNDEDIQPE-NVXWUHKLSA-N	0	3	343.471	3.186	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N[C@@H](C)[C@@H]1CCCN(CC#CC)C1	ZINC001025460428	1324304152	/nfs/dbraw/zinc/30/41/52/1324304152.db2.gz	HYBLBCQPEUVZSK-ZWKOTPCHSA-N	0	3	340.467	3.105	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(C)cc(OC)c2C)C1	ZINC001025472187	1324317938	/nfs/dbraw/zinc/31/79/38/1324317938.db2.gz	NXXRZKQBWPBMDQ-ZWKOTPCHSA-N	0	3	342.483	3.166	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(Cl)ccc2F)C1	ZINC001025480227	1324327540	/nfs/dbraw/zinc/32/75/40/1324327540.db2.gz	RJEGOZAGKBWCSD-ZIAGYGMSSA-N	0	3	336.838	3.333	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2c(C)occ2C(F)(F)F)C1	ZINC001025484210	1324331935	/nfs/dbraw/zinc/33/19/35/1324331935.db2.gz	APORYUJCKFCHGS-YPMHNXCESA-N	0	3	342.361	3.070	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc3ccccc3n2C)C1	ZINC001025518837	1324363007	/nfs/dbraw/zinc/36/30/07/1324363007.db2.gz	INHZWNJZRURJRC-FUHWJXTLSA-N	0	3	337.467	3.032	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](C)[C@H]2CCCN(Cc3ocnc3C)C2)CC1	ZINC001025523028	1324367847	/nfs/dbraw/zinc/36/78/47/1324367847.db2.gz	LFJIYEFRRZBSGA-QAPCUYQASA-N	0	3	345.487	3.446	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(CCC)cc2)C1	ZINC001025522886	1324369096	/nfs/dbraw/zinc/36/90/96/1324369096.db2.gz	IPDYEOWIIKDTLT-XLIONFOSSA-N	0	3	326.484	3.493	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(C(C)C)nc2CC)C1	ZINC001025530610	1324375886	/nfs/dbraw/zinc/37/58/86/1324375886.db2.gz	JUXFNESPHVHVMZ-DLBZAZTESA-N	0	3	341.499	3.231	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(OC)c(C3CC3)c2)C1	ZINC001025578423	1324417931	/nfs/dbraw/zinc/41/79/31/1324417931.db2.gz	IDSATLITFJGUDT-QAPCUYQASA-N	0	3	340.467	3.036	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2occ3c2CCCC3)C1	ZINC001025602567	1324450170	/nfs/dbraw/zinc/45/01/70/1324450170.db2.gz	IMRQUISPBRAPKG-HOTGVXAUSA-N	0	3	328.456	3.012	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(F)cc2Cl)C1	ZINC001025613720	1324465995	/nfs/dbraw/zinc/46/59/95/1324465995.db2.gz	ZPWRFHQCIWZOCX-KBPBESRZSA-N	0	3	336.838	3.333	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H]2CC[C@@H](NCc3ncc(C)s3)[C@@H]2C1	ZINC001026330910	1324731215	/nfs/dbraw/zinc/73/12/15/1324731215.db2.gz	MYQLJDXFPYKHSB-ARFHVFGLSA-N	0	3	347.528	3.380	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H]3CC[C@@H](NCc4cscn4)[C@H]3C2)CC1	ZINC001026346152	1324743380	/nfs/dbraw/zinc/74/33/80/1324743380.db2.gz	FAJDSVMWKWUZRQ-RYQLBKOJSA-N	0	3	345.512	3.216	20	30		EGEDHN
C[C@@H](C(=O)NC1CCC(NCc2ccccc2C#N)CC1)C1CC1	ZINC001026472465	1324830314	/nfs/dbraw/zinc/83/03/14/1324830314.db2.gz	GZMMOPGXTIXRJQ-FTXHTYHOSA-N	0	3	325.456	3.121	20	30		EGEDHN
CC(C(=O)N1CC[C@H](CNCc2ccccc2C#N)C1)=C1CCCC1	ZINC001026770856	1325014536	/nfs/dbraw/zinc/01/45/36/1325014536.db2.gz	KZPPGSVIPKNXTA-QGZVFWFLSA-N	0	3	337.467	3.387	20	30		EGEDHN
Cc1coc(C)c1C(=O)N1CC[C@@H](CNCc2ccccc2C#N)C1	ZINC001026820188	1325033440	/nfs/dbraw/zinc/03/34/40/1325033440.db2.gz	HKKBIBOHBBAUMD-INIZCTEOSA-N	0	3	337.423	3.020	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)C[C@H]2C=CCCC2)C1	ZINC001026914116	1325076946	/nfs/dbraw/zinc/07/69/46/1325076946.db2.gz	RVIQRFCNZWPULN-ROUUACIJSA-N	0	3	337.467	3.243	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)[C@H]2C[C@H]3C[C@H]3C2)C1	ZINC000963349026	1325140704	/nfs/dbraw/zinc/14/07/04/1325140704.db2.gz	NIMMWZQUJSEJRX-ZBRFXRBCSA-N	0	3	336.907	3.488	20	30		EGEDHN
CC1(C)CC[C@H]1C(=O)N1CC[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001027009123	1325148585	/nfs/dbraw/zinc/14/85/85/1325148585.db2.gz	WRWSDPZKVUDZDT-KDOFPFPSSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](CNCc3cc(O)ccc3Cl)C2)C1	ZINC001027050666	1325189042	/nfs/dbraw/zinc/18/90/42/1325189042.db2.gz	HWQPCQIECWSEQE-AWEZNQCLSA-N	0	3	348.874	3.340	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](CNCc3csc(C4CC4)n3)C2)C1	ZINC001027051096	1325190398	/nfs/dbraw/zinc/19/03/98/1325190398.db2.gz	QZIDTJTTZJGKCF-AWEZNQCLSA-N	0	3	345.512	3.315	20	30		EGEDHN
CCC(C#N)C(=O)N1[C@H](C(=O)OCc2ccccc2)C[C@@H]2CCC[C@@H]21	ZINC000925559350	1325209883	/nfs/dbraw/zinc/20/98/83/1325209883.db2.gz	XTELILVPBWYDIT-OWSLCNJRSA-N	0	3	340.423	3.049	20	30		EGEDHN
C[C@H](CC(C)(C)C#N)N[C@@H](CO)c1ccc(Br)cc1	ZINC000925674590	1325258410	/nfs/dbraw/zinc/25/84/10/1325258410.db2.gz	SFCMLBICKOHQJV-RISCZKNCSA-N	0	3	325.250	3.400	20	30		EGEDHN
N#Cc1ccccc1CNC1CC2(C1)CC(NC(=O)C1CCCC1)C2	ZINC000963476743	1325273617	/nfs/dbraw/zinc/27/36/17/1325273617.db2.gz	RTZZPRZTDJHHPT-UHFFFAOYSA-N	0	3	337.467	3.265	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCN(C(=O)c2ccc(F)s2)C1	ZINC001027244886	1325343894	/nfs/dbraw/zinc/34/38/94/1325343894.db2.gz	YSPRMMIAWFZIPN-CYBMUJFWSA-N	0	3	343.427	3.011	20	30		EGEDHN
CN(Cc1ccc(F)c(C#N)c1)[C@@H]1CCCN(C(=O)c2ccco2)C1	ZINC001027274197	1325382215	/nfs/dbraw/zinc/38/22/15/1325382215.db2.gz	SSMXWNMHGMYBDO-MRXNPFEDSA-N	0	3	341.386	3.027	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc3ccn(C(F)F)c3c2)CC1	ZINC000855532745	1325393003	/nfs/dbraw/zinc/39/30/03/1325393003.db2.gz	ZZJVZSFPSMBLDW-UHFFFAOYSA-N	0	3	331.366	3.320	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)[C@H]2CC=CCC2)C1	ZINC001027294662	1325429608	/nfs/dbraw/zinc/42/96/08/1325429608.db2.gz	YWYKDNXVFHHJNQ-VQTJNVASSA-N	0	3	337.467	3.337	20	30		EGEDHN
Cc1ccc(CO[C@H](C)C(=O)C(C#N)C(=O)Nc2ccccc2)cc1	ZINC000860468693	1329321084	/nfs/dbraw/zinc/32/10/84/1329321084.db2.gz	FMCUNCJORJESIS-QAPCUYQASA-N	0	3	336.391	3.248	20	30		EGEDHN
N#CC(C(=O)CCc1ccc(Cl)c(F)c1)C(=O)NC1CCCC1	ZINC000860478342	1329322529	/nfs/dbraw/zinc/32/25/29/1329322529.db2.gz	WCAQHROFAMMLFQ-CYBMUJFWSA-N	0	3	336.794	3.179	20	30		EGEDHN
Cc1coc(C(=O)N2CCC[C@H](N(C)Cc3cccc(C#N)c3)C2)c1	ZINC001027538546	1327834765	/nfs/dbraw/zinc/83/47/65/1327834765.db2.gz	FOWHGJFAEUKVMR-SFHVURJKSA-N	0	3	337.423	3.196	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N1CCC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001027564780	1327889487	/nfs/dbraw/zinc/88/94/87/1327889487.db2.gz	KROIKDURVXZYHK-HSALFYBXSA-N	0	3	339.483	3.417	20	30		EGEDHN
CC(C)C1(C(=O)N2CCC[C@H](N(C)Cc3ccc(C#N)cc3)C2)CC1	ZINC001027567761	1327897789	/nfs/dbraw/zinc/89/77/89/1327897789.db2.gz	ZYNFNDFBGHYOCU-IBGZPJMESA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N1CCC[C@@H](N(C)Cc2csc(C)c2)C1	ZINC001027586396	1327925583	/nfs/dbraw/zinc/92/55/83/1327925583.db2.gz	ZWIDHECJWUYFBU-KURKYZTESA-N	0	3	348.512	3.070	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)[C@H](CC)Cc2cccc(C)c2)C1	ZINC001027604945	1327961536	/nfs/dbraw/zinc/96/15/36/1327961536.db2.gz	TXUOULYRUACLHZ-WOJBJXKFSA-N	0	3	326.484	3.120	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)c2cc3cc(F)ccc3s2)C1	ZINC001027675501	1328072237	/nfs/dbraw/zinc/07/22/37/1328072237.db2.gz	DNVSVSQKNGSJDV-OAHLLOKOSA-N	0	3	330.428	3.210	20	30		EGEDHN
Cc1ccsc1C(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC000966319078	1328271078	/nfs/dbraw/zinc/27/10/78/1328271078.db2.gz	RFRIBXWNCJXFNU-OAHLLOKOSA-N	0	3	343.427	3.072	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(-c3cc[nH]n3)s2)C1	ZINC000966884370	1328451268	/nfs/dbraw/zinc/45/12/68/1328451268.db2.gz	LDZLZNNZAIVDJT-HIFRSBDPSA-N	0	3	344.484	3.155	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(SC(F)(F)F)o2)CC1	ZINC000865193527	1329675676	/nfs/dbraw/zinc/67/56/76/1329675676.db2.gz	MKPOTIAAHYSBFW-UHFFFAOYSA-N	0	3	334.363	3.272	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC2(C1)CCN(Cc1cncc(C)c1)CC2	ZINC001050617954	1348304185	/nfs/dbraw/zinc/30/41/85/1348304185.db2.gz	QKJKVYXQNDTPQQ-UHFFFAOYSA-N	0	3	327.472	3.027	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC2(C1)CCN(Cc1c(C)nsc1C)CC2	ZINC001050618705	1348304260	/nfs/dbraw/zinc/30/42/60/1348304260.db2.gz	YXCJMKHFVIHUMN-UHFFFAOYSA-N	0	3	347.528	3.397	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3cc(C)c(C)cc3Cl)C2)CC1	ZINC001050617707	1348304403	/nfs/dbraw/zinc/30/44/03/1348304403.db2.gz	MXIQGPVGLLWHCK-UHFFFAOYSA-N	0	3	330.859	3.128	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN[C@@H](c1ccccn1)C1CC1	ZINC000932375348	1329809657	/nfs/dbraw/zinc/80/96/57/1329809657.db2.gz	OPJOIUQWWBAORE-MRXNPFEDSA-N	0	3	326.425	3.084	20	30		EGEDHN
C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)[C@H]1CCCN1C(C)C	ZINC000935942839	1330097395	/nfs/dbraw/zinc/09/73/95/1330097395.db2.gz	HFWZHDZXMQEEQM-GOSISDBHSA-N	0	3	332.492	3.242	20	30		EGEDHN
N#C[C@@H]1CC[C@H](N2CCC(NC(=O)OCc3ccccc3)CC2)C1	ZINC000866592624	1330130394	/nfs/dbraw/zinc/13/03/94/1330130394.db2.gz	RHYLLNKYVNQDQX-AEFFLSMTSA-N	0	3	327.428	3.069	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](NC(=O)c2n[nH]c3ccccc32)C(C)(C)C1	ZINC000941200333	1331383057	/nfs/dbraw/zinc/38/30/57/1331383057.db2.gz	DSUZANDUJJWPJU-HNNXBMFYSA-N	0	3	346.862	3.146	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CCN(Cc2ccsc2)C[C@H]1C	ZINC000942128132	1331840672	/nfs/dbraw/zinc/84/06/72/1331840672.db2.gz	CDKWFYRVRMTYSO-WBVHZDCISA-N	0	3	343.496	3.376	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccc3ccc(C)nc32)[C@@H](C)C1	ZINC000942168660	1331857823	/nfs/dbraw/zinc/85/78/23/1331857823.db2.gz	YBSYPUHPIQTPKE-HNAYVOBHSA-N	0	3	335.451	3.007	20	30		EGEDHN
C[C@@H]1CN(Cc2cccc(C#N)c2)CC[C@H]1NC(=O)C1(F)CCCC1	ZINC000942195163	1331874285	/nfs/dbraw/zinc/87/42/85/1331874285.db2.gz	GSLHVMLEZFFAFL-CRAIPNDOSA-N	0	3	343.446	3.167	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2csc(C(F)(F)F)c2)[C@@H](C)C1	ZINC000942260025	1331889954	/nfs/dbraw/zinc/88/99/54/1331889954.db2.gz	WBGQWGJARNLRNP-JQWIXIFHSA-N	0	3	332.391	3.393	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(-c3ccco3)o2)[C@H](C)C1	ZINC000942442950	1331935155	/nfs/dbraw/zinc/93/51/55/1331935155.db2.gz	BNSDFPGSIQHBJC-HUUCEWRRSA-N	0	3	326.396	3.003	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C)c(Cl)c2F)[C@H](C)C1	ZINC000942527799	1331957801	/nfs/dbraw/zinc/95/78/01/1331957801.db2.gz	RRYYEPVPHOPMLT-HIFRSBDPSA-N	0	3	336.838	3.251	20	30		EGEDHN
C[C@@H]1CN(Cc2cccc(C#N)c2)CC[C@H]1NC(=O)C1(C)CCCC1	ZINC000942540211	1331964553	/nfs/dbraw/zinc/96/45/53/1331964553.db2.gz	HWGLMLXJVCVEQY-VQIMIIECSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3c(ccc(C)c3C)[nH]2)[C@@H](C)C1	ZINC000942557846	1331972757	/nfs/dbraw/zinc/97/27/57/1331972757.db2.gz	NXBKYQGSGXYRSR-MAUKXSAKSA-N	0	3	337.467	3.248	20	30		EGEDHN
Cc1cocc1C(=O)N[C@H]1CCN(Cc2ccc(C#N)cc2)C[C@@H]1C	ZINC000942558314	1331972985	/nfs/dbraw/zinc/97/29/85/1331972985.db2.gz	VHOMWBQUMMNJNQ-LIRRHRJNSA-N	0	3	337.423	3.100	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)cc2)CC[C@H]1NC(=O)C1(C)CCC1	ZINC000942560594	1331974859	/nfs/dbraw/zinc/97/48/59/1331974859.db2.gz	SMVJBZYZLCSQDE-CRAIPNDOSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2nc(Cl)sc2Cl)[C@@H](C)C1	ZINC000942561007	1331975981	/nfs/dbraw/zinc/97/59/81/1331975981.db2.gz	ZYTRFELHGBZDKV-DTWKUNHWSA-N	0	3	334.272	3.076	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(CCc3csc(C)n3)C[C@H]2C)C1	ZINC000942608632	1332004278	/nfs/dbraw/zinc/00/42/78/1332004278.db2.gz	XWSNDVQVKQYQNC-RHSMWYFYSA-N	0	3	347.528	3.177	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(F)c3ccccc23)[C@H](C)C1	ZINC000942938722	1332062961	/nfs/dbraw/zinc/06/29/61/1332062961.db2.gz	MHVWAFWILKFNRN-QRWLVFNGSA-N	0	3	338.426	3.442	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccccc2OCC(C)C)[C@H](C)C1	ZINC000943690509	1332239672	/nfs/dbraw/zinc/23/96/72/1332239672.db2.gz	SWSKFRRSFCEKLO-SJLPKXTDSA-N	0	3	330.472	3.348	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc(C(C)(C)C)c2)[C@H](C)C1	ZINC000943744694	1332251820	/nfs/dbraw/zinc/25/18/20/1332251820.db2.gz	LVJVBPLJQDQDJW-APWZRJJASA-N	0	3	326.484	3.448	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C(F)F)cc2F)[C@@H](C)C1	ZINC000943756861	1332255425	/nfs/dbraw/zinc/25/54/25/1332255425.db2.gz	XAKWBORQBOFEML-BLLLJJGKSA-N	0	3	338.373	3.227	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(OC)c(C3CC3)c2)[C@H](C)C1	ZINC000943778892	1332264238	/nfs/dbraw/zinc/26/42/38/1332264238.db2.gz	XNLDMFCDKIXSQD-BEFAXECRSA-N	0	3	340.467	3.036	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc3nc(C)sc3c2)[C@H](C)C1	ZINC000943985990	1332304154	/nfs/dbraw/zinc/30/41/54/1332304154.db2.gz	CCYMCFSSFJDFPQ-DOMZBBRYSA-N	0	3	329.469	3.231	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2cccc3ccccc32)[C@@H](C)C1	ZINC000944262784	1332356027	/nfs/dbraw/zinc/35/60/27/1332356027.db2.gz	CVKGRTZEBWJKCU-LAUBAEHRSA-N	0	3	334.463	3.232	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(Cl)c(Cl)c2)[C@@H](C)C1	ZINC000944306529	1332368822	/nfs/dbraw/zinc/36/88/22/1332368822.db2.gz	SGQNMLVSEPHFTB-BLLLJJGKSA-N	0	3	339.266	3.457	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccccc2OCC2CC2)[C@@H](C)C1	ZINC000945094382	1332499160	/nfs/dbraw/zinc/49/91/60/1332499160.db2.gz	WTDUKYZMIZRXTO-MAUKXSAKSA-N	0	3	328.456	3.102	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccccc2CC(C)C)[C@H](C)C1	ZINC000945365129	1332567726	/nfs/dbraw/zinc/56/77/26/1332567726.db2.gz	ILOSGMARIZNNRM-YLJYHZDGSA-N	0	3	326.484	3.349	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3ccc(C)cc3)CCC2)[C@@H](C)C1	ZINC000945365621	1332568005	/nfs/dbraw/zinc/56/80/05/1332568005.db2.gz	LHJVIVNDJVIUKI-ICSRJNTNSA-N	0	3	338.495	3.267	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3cc(C)c(C)cn3)CC[C@@H]2C1	ZINC000946691151	1332878046	/nfs/dbraw/zinc/87/80/46/1332878046.db2.gz	ZFVNURCBIYDLQX-CALCHBBNSA-N	0	3	347.890	3.235	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3ccc(Cl)[nH]3)CC[C@@H]2C1	ZINC000946764901	1332895231	/nfs/dbraw/zinc/89/52/31/1332895231.db2.gz	DNVKPCXXCQQBOR-BETUJISGSA-N	0	3	342.270	3.205	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@@H](C)c3cccnc3)CC[C@@H]2C1	ZINC000946858928	1332917667	/nfs/dbraw/zinc/91/76/67/1332917667.db2.gz	GYCGPZRPTJJIDB-RYQLBKOJSA-N	0	3	347.890	3.108	20	30		EGEDHN
Cc1ccncc1C(=O)N[C@@H]1CCN(Cc2cccc(C#N)c2)[C@H](C)C1	ZINC000947157981	1333028488	/nfs/dbraw/zinc/02/84/88/1333028488.db2.gz	STDZKRXHTPOUDN-VQIMIIECSA-N	0	3	348.450	3.045	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)C2(F)CCCC2)CCN1Cc1ccc(C#N)cc1	ZINC000947464602	1333138625	/nfs/dbraw/zinc/13/86/25/1333138625.db2.gz	WPUFDEKQLCTMOH-CRAIPNDOSA-N	0	3	343.446	3.310	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2[nH]c3ccccc3c2Cl)C[C@@H]1C	ZINC000947479301	1333143674	/nfs/dbraw/zinc/14/36/74/1333143674.db2.gz	LXYNZAJRLOZJCG-STQMWFEESA-N	0	3	329.831	3.037	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(-n3cccc3)cc2)C[C@@H]1C	ZINC000947512065	1333151451	/nfs/dbraw/zinc/15/14/51/1333151451.db2.gz	TUHOZXUJMGSRMR-HKUYNNGSSA-N	0	3	335.451	3.083	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2c(C)occ2C(F)(F)F)C[C@@H]1C	ZINC000947547895	1333167745	/nfs/dbraw/zinc/16/77/45/1333167745.db2.gz	VGOCCFUUADVAFN-AAEUAGOBSA-N	0	3	342.361	3.213	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)[C@H]2C[C@H]3C[C@H]3C2)CCN1Cc1ccc(C#N)cc1	ZINC000947639287	1333203848	/nfs/dbraw/zinc/20/38/48/1333203848.db2.gz	OYKUAWQJTZMYGU-YLLORCDKSA-N	0	3	337.467	3.073	20	30		EGEDHN
Cc1ncccc1C(=O)N[C@@H]1CCN(Cc2cccc(C#N)c2)[C@H](C)C1	ZINC000947669954	1333216358	/nfs/dbraw/zinc/21/63/58/1333216358.db2.gz	ANHGOVJAWCMIME-DNVCBOLYSA-N	0	3	348.450	3.045	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2c(Cl)cncc2Cl)C[C@@H]1C	ZINC000947689902	1333225268	/nfs/dbraw/zinc/22/52/68/1333225268.db2.gz	NMXVFCFTBGAJSP-QWRGUYRKSA-N	0	3	328.243	3.157	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)C2(C)CC=CC2)CCN1Cc1cccc(C#N)c1	ZINC000947694433	1333228671	/nfs/dbraw/zinc/22/86/71/1333228671.db2.gz	XXLVKRDUQYGOJV-VQIMIIECSA-N	0	3	337.467	3.384	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3cccc(C#N)c3)[C@@H](C)C2)C1	ZINC000947702346	1333232356	/nfs/dbraw/zinc/23/23/56/1333232356.db2.gz	MVXGBBRCXOIMRV-LPHOPBHVSA-N	0	3	337.467	3.384	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2c(F)ccc(F)c2Cl)C[C@H]1C	ZINC000947734574	1333244645	/nfs/dbraw/zinc/24/46/45/1333244645.db2.gz	BJEAXQWSUVVINN-GHMZBOCLSA-N	0	3	328.790	3.387	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cccc(OCCC)c2)C[C@@H]1C	ZINC000947912948	1333304325	/nfs/dbraw/zinc/30/43/25/1333304325.db2.gz	SVILKUMZHYSHCE-HKUYNNGSSA-N	0	3	342.483	3.010	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccsc2C(F)(F)F)C[C@H]1C	ZINC000947975171	1333328920	/nfs/dbraw/zinc/32/89/20/1333328920.db2.gz	KWBWTIPLFREEFO-VXGBXAGGSA-N	0	3	344.402	3.373	20	30		EGEDHN
CN(C(=O)c1cccnc1)[C@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948129322	1333383182	/nfs/dbraw/zinc/38/31/82/1333383182.db2.gz	SZBOZXJKYVEJIH-FQEVSTJZSA-N	0	3	348.450	3.080	20	30		EGEDHN
CN(C(=O)c1c[nH]c(C#N)c1)[C@H]1CCCN(Cc2ccsc2)CC1	ZINC000948316602	1333476881	/nfs/dbraw/zinc/47/68/81/1333476881.db2.gz	RIUMWKUKKLYUGW-KRWDZBQOSA-N	0	3	342.468	3.075	20	30		EGEDHN
C=CCn1cccc1C(=O)N(C)[C@@H]1CCCN(C/C=C/Cl)CC1	ZINC000948439590	1333526375	/nfs/dbraw/zinc/52/63/75/1333526375.db2.gz	SFUFYJWJDHBADL-VGZDNEPHSA-N	0	3	335.879	3.353	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2cc(C3CCCCC3)n[nH]2)CC1	ZINC000948441550	1333527016	/nfs/dbraw/zinc/52/70/16/1333527016.db2.gz	ARPMVELMRPVMIU-KRWDZBQOSA-N	0	3	342.487	3.017	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2ccc3oc(C)nc3c2)CC1	ZINC000948470765	1333538316	/nfs/dbraw/zinc/53/83/16/1333538316.db2.gz	IJRJXWLYQSXIIZ-QGZVFWFLSA-N	0	3	339.439	3.086	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2cccc3ccc(C)nc32)CC1	ZINC000948471442	1333538739	/nfs/dbraw/zinc/53/87/39/1333538739.db2.gz	SFCVESYTDPWENT-GOSISDBHSA-N	0	3	335.451	3.103	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)Cc2c(C)cccc2Cl)CC1	ZINC000948587183	1333585809	/nfs/dbraw/zinc/58/58/09/1333585809.db2.gz	SJIZXECHOHCQCS-MRXNPFEDSA-N	0	3	332.875	3.137	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cccc(C(C)C)n2)CC1	ZINC000948590253	1333587771	/nfs/dbraw/zinc/58/77/71/1333587771.db2.gz	KTPWUPMODDLPRM-KRWDZBQOSA-N	0	3	327.472	3.155	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2ccc(-n3cccc3)cc2)CC1	ZINC000948591352	1333587879	/nfs/dbraw/zinc/58/78/79/1333587879.db2.gz	VPZSLKPVFLQMRD-FQEVSTJZSA-N	0	3	349.478	3.427	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2nc(Cl)sc2C)CC1	ZINC000948608196	1333595078	/nfs/dbraw/zinc/59/50/78/1333595078.db2.gz	MEKSPRCPTSBMCV-CYBMUJFWSA-N	0	3	339.892	3.055	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)[C@H](C)c2c(F)cccc2F)CC1	ZINC000948621587	1333600750	/nfs/dbraw/zinc/60/07/50/1333600750.db2.gz	RAHJTKKBIFOORZ-CVEARBPZSA-N	0	3	348.437	3.405	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)Cc2cc(F)c(C)cc2F)CC1	ZINC000948642470	1333608032	/nfs/dbraw/zinc/60/80/32/1333608032.db2.gz	IICHDKUFGIJSNS-QGZVFWFLSA-N	0	3	348.437	3.152	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2sccc2-n2cccc2)CC1	ZINC000948659254	1333616959	/nfs/dbraw/zinc/61/69/59/1333616959.db2.gz	VTACSDRADZCKAR-MRXNPFEDSA-N	0	3	341.480	3.099	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)C[C@@H]2CCCC2(F)F)CC1	ZINC000948717273	1333645567	/nfs/dbraw/zinc/64/55/67/1333645567.db2.gz	QCFRYYYREPNCDT-JKSUJKDBSA-N	0	3	326.431	3.148	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)Cc2cccc(Cl)c2)CC1	ZINC000948732275	1333651194	/nfs/dbraw/zinc/65/11/94/1333651194.db2.gz	ACSZAQXGWLCSCG-GOSISDBHSA-N	0	3	332.875	3.219	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)[C@@H]2C[C@H]2c2c(F)cccc2F)CC1	ZINC000948754544	1333663116	/nfs/dbraw/zinc/66/31/16/1333663116.db2.gz	YZURQHPWZXXDNK-ARFHVFGLSA-N	0	3	346.421	3.014	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2ccccc2OC2CCC2)CC1	ZINC000948762719	1333666622	/nfs/dbraw/zinc/66/66/22/1333666622.db2.gz	QRNOVFOLJORQAA-KRWDZBQOSA-N	0	3	340.467	3.178	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cc[nH]c2C2CCC2)CC1	ZINC000948775668	1333674935	/nfs/dbraw/zinc/67/49/35/1333674935.db2.gz	NZBBKFKLCNCVLD-QGZVFWFLSA-N	0	3	327.472	3.232	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)C2CCC(F)(F)CC2)CC1	ZINC000948809671	1333690971	/nfs/dbraw/zinc/69/09/71/1333690971.db2.gz	RAEJYRLJTQLEJF-INIZCTEOSA-N	0	3	326.431	3.148	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)[C@@H]2CCc3ccccc3C2)CC1	ZINC000948813161	1333694242	/nfs/dbraw/zinc/69/42/42/1333694242.db2.gz	VQCHMOGLWYIZGY-NHCUHLMSSA-N	0	3	338.495	3.128	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)[C@]2(C)CCCc3ccccc32)CC1	ZINC000948852132	1333709176	/nfs/dbraw/zinc/70/91/76/1333709176.db2.gz	IHPYNMVFTDAHOI-SIKLNZKXSA-N	0	3	338.495	3.227	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@@H]1CNC(=O)c1cncc(C)c1	ZINC000948906111	1333727862	/nfs/dbraw/zinc/72/78/62/1333727862.db2.gz	IXXJJQGAGLSPKX-FQEVSTJZSA-N	0	3	335.451	3.295	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@@H]3CCC[C@@H]3CC)CC2)C1	ZINC000949466994	1333855910	/nfs/dbraw/zinc/85/59/10/1333855910.db2.gz	YHNSWWPATFWDCC-RBUKOAKNSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)Cc2cccc3ncccc23)C1	ZINC000967290967	1335692077	/nfs/dbraw/zinc/69/20/77/1335692077.db2.gz	GJQMBFQHFMAKOJ-OXJNMPFZSA-N	0	3	337.467	3.180	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)Cc2ccc3cnccc3c2)C1	ZINC000967293182	1335692393	/nfs/dbraw/zinc/69/23/93/1335692393.db2.gz	VGBRUUFRHHLBBW-OXJNMPFZSA-N	0	3	337.467	3.180	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)Cc2ccc(C(F)F)cc2)C1	ZINC000967332335	1335703461	/nfs/dbraw/zinc/70/34/61/1335703461.db2.gz	DCRVAJYJCCKCEL-RHSMWYFYSA-N	0	3	334.410	3.017	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2nc3ccccc3cc2C)C1	ZINC000967415978	1335731195	/nfs/dbraw/zinc/73/11/95/1335731195.db2.gz	YZJHAVWIXVQIIH-KXBFYZLASA-N	0	3	335.451	3.007	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](C)[C@H](NC(=O)c2ocnc2C(F)(F)F)C1	ZINC000967435888	1335738607	/nfs/dbraw/zinc/73/86/07/1335738607.db2.gz	OSSXDTXEKMSCBN-VXGBXAGGSA-N	0	3	345.365	3.100	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2sccc2-n2cccc2)C1	ZINC000967619205	1335793658	/nfs/dbraw/zinc/79/36/58/1335793658.db2.gz	BTZIJDNMPSVBHA-HOTGVXAUSA-N	0	3	341.480	3.002	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2ccccc2-n2cccc2)C1	ZINC000968193700	1335869249	/nfs/dbraw/zinc/86/92/49/1335869249.db2.gz	WKQUQLYURKZNON-HKUYNNGSSA-N	0	3	337.467	3.494	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2ccccc2-n2cccc2)C1	ZINC000968193703	1335869513	/nfs/dbraw/zinc/86/95/13/1335869513.db2.gz	WKQUQLYURKZNON-MJGOQNOKSA-N	0	3	337.467	3.494	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2c(Cl)cncc2Cl)C1	ZINC000968211442	1335872908	/nfs/dbraw/zinc/87/29/08/1335872908.db2.gz	KZJQRSXGNFERAL-BXUZGUMPSA-N	0	3	342.270	3.405	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)Cc2ccc(F)cc2Cl)C1	ZINC000968212526	1335873296	/nfs/dbraw/zinc/87/32/96/1335873296.db2.gz	NEPDFQXYPHOAAI-CXAGYDPISA-N	0	3	338.854	3.424	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(OC)c(C3CC3)c2)C1	ZINC000968484714	1335937626	/nfs/dbraw/zinc/93/76/26/1335937626.db2.gz	TXHFPMJBKQOPJB-BEFAXECRSA-N	0	3	340.467	3.036	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2coc(C3CCCC3)n2)C1	ZINC000968486867	1335938133	/nfs/dbraw/zinc/93/81/33/1335938133.db2.gz	AOKHCYWEVKEYFM-ZBFHGGJFSA-N	0	3	331.460	3.349	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2ccc3nc(C)sc3c2)C1	ZINC000968503906	1335944371	/nfs/dbraw/zinc/94/43/71/1335944371.db2.gz	CEEYUFHAEVXCQJ-SUMWQHHRSA-N	0	3	341.480	3.068	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C)[C@@H](NC(=O)c2cccc3nc(C)[nH]c32)C1	ZINC000968508550	1335947384	/nfs/dbraw/zinc/94/73/84/1335947384.db2.gz	AZKBIOQTXNQNAC-ZBEGNZNMSA-N	0	3	346.862	3.064	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)Cc2c[nH]c3ccccc23)C1	ZINC000968569512	1335963657	/nfs/dbraw/zinc/96/36/57/1335963657.db2.gz	JTHUNYCKSWPYPB-HNAYVOBHSA-N	0	3	325.456	3.113	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC000968579808	1335970354	/nfs/dbraw/zinc/97/03/54/1335970354.db2.gz	QKSCBSWUSYOBHP-CJNGLKHVSA-N	0	3	338.373	3.169	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000968584712	1335974654	/nfs/dbraw/zinc/97/46/54/1335974654.db2.gz	ZWDWRYDUDVTKDW-QFBILLFUSA-N	0	3	326.484	3.448	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cc(F)c(F)cc2Cl)C1	ZINC000968609648	1335982301	/nfs/dbraw/zinc/98/23/01/1335982301.db2.gz	JZBHEAOWUKXHDV-BZNIZROVSA-N	0	3	340.801	3.082	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)Cc2ccc(OCC)cc2)C1	ZINC000968618676	1335985152	/nfs/dbraw/zinc/98/51/52/1335985152.db2.gz	HWLXYJSXEGLNRC-LPHOPBHVSA-N	0	3	330.472	3.031	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2ccc(OC)c(OCC)c2)C1	ZINC000968624162	1335988042	/nfs/dbraw/zinc/98/80/42/1335988042.db2.gz	OKKOWDAMWMXFRF-NVXWUHKLSA-N	0	3	346.471	3.110	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2cc(OC)c(OC)cc2C)C1	ZINC000968664818	1336002131	/nfs/dbraw/zinc/00/21/31/1336002131.db2.gz	JJQMSURGWZRMFA-RHSMWYFYSA-N	0	3	346.471	3.029	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)Cn2ccc3ccccc32)C1	ZINC000968664968	1336002179	/nfs/dbraw/zinc/00/21/79/1336002179.db2.gz	KULWWJPMFVWKDN-WMZOPIPTSA-N	0	3	325.456	3.044	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N[C@@H]2CN(CC(=C)C)CC[C@@H]2C)cc1	ZINC000968685248	1336010827	/nfs/dbraw/zinc/01/08/27/1336010827.db2.gz	PJXSGLARGVYHOZ-FXAWDEMLSA-N	0	3	342.483	3.197	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2cnc(CC(C)C)s2)C1	ZINC000968695739	1336015778	/nfs/dbraw/zinc/01/57/78/1336015778.db2.gz	VJILIHUBLVVJGA-GJZGRUSLSA-N	0	3	335.517	3.358	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1csc([C@@H]2CCCO2)n1	ZINC000968856112	1336069540	/nfs/dbraw/zinc/06/95/40/1336069540.db2.gz	DYSSEMBXSUKQFP-ZBFHGGJFSA-N	0	3	349.500	3.155	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cnn(CC(C)C)c1CC	ZINC000968856846	1336070054	/nfs/dbraw/zinc/07/00/54/1336070054.db2.gz	PLRWGPXHFDNTAK-KRWDZBQOSA-N	0	3	346.519	3.262	20	30		EGEDHN
N#Cc1cccc(CN2CCCCC[C@@H]2CNC(=O)c2cc[nH]c2)c1	ZINC000968869104	1336073128	/nfs/dbraw/zinc/07/31/28/1336073128.db2.gz	IJDKGGDLZFUCSX-LJQANCHMSA-N	0	3	336.439	3.061	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccnn1C1CCCC1	ZINC000968879638	1336077348	/nfs/dbraw/zinc/07/73/48/1336077348.db2.gz	IVASIANJDAUJPV-KRWDZBQOSA-N	0	3	330.476	3.159	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccnn1C1CCCC1	ZINC000968879639	1336077588	/nfs/dbraw/zinc/07/75/88/1336077588.db2.gz	IVASIANJDAUJPV-QGZVFWFLSA-N	0	3	330.476	3.159	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccc(C(F)(F)F)cn1	ZINC000968971723	1336105645	/nfs/dbraw/zinc/10/56/45/1336105645.db2.gz	RQBANPRIHNBWCR-CQSZACIVSA-N	0	3	341.377	3.261	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cncc(OC(C)C)c1	ZINC000968974083	1336106345	/nfs/dbraw/zinc/10/63/45/1336106345.db2.gz	NZCCHCMKQRXFAD-QGZVFWFLSA-N	0	3	331.460	3.029	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1cc[nH]c1C1CCC1	ZINC000969025560	1336122024	/nfs/dbraw/zinc/12/20/24/1336122024.db2.gz	PVGZGCBAPZZAFD-QGZVFWFLSA-N	0	3	327.472	3.280	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cnc(C(C)C)nc1C	ZINC000969059701	1336133111	/nfs/dbraw/zinc/13/31/11/1336133111.db2.gz	QYEYIFJSWINNLA-INIZCTEOSA-N	0	3	330.476	3.069	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1cccc(OC)c1F	ZINC000969087446	1336139179	/nfs/dbraw/zinc/13/91/79/1336139179.db2.gz	ASJBRMSCNHTPLJ-HNNXBMFYSA-N	0	3	334.435	3.385	20	30		EGEDHN
C#CCCN1CCCCC[C@@H]1CNC(=O)c1coc(C2CCCC2)n1	ZINC000969097122	1336141346	/nfs/dbraw/zinc/14/13/46/1336141346.db2.gz	HLRQKIJQNBDQCO-QGZVFWFLSA-N	0	3	343.471	3.330	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ncccc1C(F)(F)F	ZINC000969103512	1336144817	/nfs/dbraw/zinc/14/48/17/1336144817.db2.gz	VTXYDOCIHXEXOR-ZDUSSCGKSA-N	0	3	341.377	3.261	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1sccc1COC	ZINC000969110862	1336147539	/nfs/dbraw/zinc/14/75/39/1336147539.db2.gz	FBUDHXCSAOMLOO-MRXNPFEDSA-N	0	3	336.501	3.445	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cccnc1OCC(C)C	ZINC000969118152	1336150134	/nfs/dbraw/zinc/15/01/34/1336150134.db2.gz	GRYRYUKUFREKFI-KRWDZBQOSA-N	0	3	345.487	3.277	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cc(C)n(C(C)(C)C)n1	ZINC000969144484	1336161371	/nfs/dbraw/zinc/16/13/71/1336161371.db2.gz	MXJSXGXYJKSYLC-INIZCTEOSA-N	0	3	332.492	3.107	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cccc2oc(C)nc21	ZINC000969160502	1336167458	/nfs/dbraw/zinc/16/74/58/1336167458.db2.gz	FLTUODCRGYNLJW-HNNXBMFYSA-N	0	3	327.428	3.297	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)[C@@H]1Cc2c1cccc2Cl	ZINC000969165535	1336169075	/nfs/dbraw/zinc/16/90/75/1336169075.db2.gz	ZWHAMIOPOVEZGV-MAUKXSAKSA-N	0	3	344.886	3.364	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1ncccc1OCC	ZINC000969173586	1336171145	/nfs/dbraw/zinc/17/11/45/1336171145.db2.gz	NHVCYLUOLZUZIP-MRXNPFEDSA-N	0	3	331.460	3.031	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H](C)C1CN(Cc2ccccc2C)C1	ZINC000969836659	1336252695	/nfs/dbraw/zinc/25/26/95/1336252695.db2.gz	NUUOJUBGLJAVGN-KRWDZBQOSA-N	0	3	337.467	3.233	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)c2cn(CC)c3ccccc23)C1	ZINC000970105650	1336280344	/nfs/dbraw/zinc/28/03/44/1336280344.db2.gz	RGWYDJVGBJQGNX-HNNXBMFYSA-N	0	3	325.456	3.287	20	30		EGEDHN
CCc1cc(C)c(C(=O)N2CC[C@@H](NCc3ccc(C#N)s3)C2)o1	ZINC000970490763	1336312144	/nfs/dbraw/zinc/31/21/44/1336312144.db2.gz	AIDSTGPHTKPAHB-CYBMUJFWSA-N	0	3	343.452	3.088	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2)C1	ZINC000970567004	1336322597	/nfs/dbraw/zinc/32/25/97/1336322597.db2.gz	NFULSLMUFFYVRL-JEBQAFNWSA-N	0	3	332.875	3.456	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2c(C)nn(C(C)(C)C)c2C)CC1	ZINC001005470392	1336356963	/nfs/dbraw/zinc/35/69/63/1336356963.db2.gz	PZNWVFNZMASHOR-UHFFFAOYSA-N	0	3	346.519	3.367	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2scnc2C(F)(F)F)CC1	ZINC001005520020	1336366291	/nfs/dbraw/zinc/36/62/91/1336366291.db2.gz	CAJDYKNJZXXIMV-UHFFFAOYSA-N	0	3	347.406	3.274	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cc(C)n([C@H](C)CC)n2)CC1	ZINC001005632205	1336385806	/nfs/dbraw/zinc/38/58/06/1336385806.db2.gz	MBMFIAAPBTXDSU-OAHLLOKOSA-N	0	3	332.492	3.275	20	30		EGEDHN
CN(C(=O)[C@@H]1CC[C@@H](F)C1)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001005893324	1336417538	/nfs/dbraw/zinc/41/75/38/1336417538.db2.gz	WBXCWXWSPSSBOB-QZTJIDSGSA-N	0	3	343.446	3.119	20	30		EGEDHN
CN(C(=O)C1CC2(CC2)C1)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001005976279	1336432781	/nfs/dbraw/zinc/43/27/81/1336432781.db2.gz	UFYGEHJFNCPZMR-UHFFFAOYSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)C2(c3cc(C)cc(C)c3)CC2)CC1	ZINC001006415209	1336501700	/nfs/dbraw/zinc/50/17/00/1336501700.db2.gz	FGMIKWMSMOPFFX-UHFFFAOYSA-N	0	3	326.484	3.444	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2c[nH]c3ccc(F)cc32)CC1	ZINC001006479238	1336514682	/nfs/dbraw/zinc/51/46/82/1336514682.db2.gz	WHDKTNKNNKPZCF-UHFFFAOYSA-N	0	3	329.419	3.420	20	30		EGEDHN
Cc1ccccc1[C@H](C)N1CCC[C@@H](NC(=O)c2cc(C#N)c[nH]2)C1	ZINC001007031656	1336629260	/nfs/dbraw/zinc/62/92/60/1336629260.db2.gz	XECBZXWUGBGXLL-DOTOQJQBSA-N	0	3	336.439	3.150	20	30		EGEDHN
C=C(C)CCN1CCC[C@H](NC(=O)c2cc3ccncc3s2)C1	ZINC001007501615	1336659360	/nfs/dbraw/zinc/65/93/60/1336659360.db2.gz	ZSWQQTDVAXFECH-HNNXBMFYSA-N	0	3	329.469	3.457	20	30		EGEDHN
C=C(C)CCN1CCC[C@H](NC(=O)c2ccc(-c3cc[nH]n3)s2)C1	ZINC001007545072	1336666737	/nfs/dbraw/zinc/66/67/37/1336666737.db2.gz	DHMNIMOVRXVDMF-AWEZNQCLSA-N	0	3	344.484	3.299	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H](NC(=O)c2noc3c2CC(C)(C)CC3)C1	ZINC001008048129	1336758352	/nfs/dbraw/zinc/75/83/52/1336758352.db2.gz	QVIJALZXWHHYQZ-OAHLLOKOSA-N	0	3	345.487	3.350	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)C[C@@H]2CCOc3ccccc32)C1	ZINC001008180443	1336785894	/nfs/dbraw/zinc/78/58/94/1336785894.db2.gz	ZZPBKTGMYPPARU-IRXDYDNUSA-N	0	3	328.456	3.100	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCCN(CC3CC(F)(F)C3)C2)CC1	ZINC001008414868	1336846276	/nfs/dbraw/zinc/84/62/76/1336846276.db2.gz	BXXOIBQZIQZFIJ-INIZCTEOSA-N	0	3	326.431	3.359	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2csc(-c3ccoc3)n2)C1	ZINC001008907118	1336941758	/nfs/dbraw/zinc/94/17/58/1336941758.db2.gz	ZXGKATWLSFHSKR-CQSZACIVSA-N	0	3	331.441	3.173	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2c[nH]nc2C2CCCCC2)C1	ZINC001009153831	1336977674	/nfs/dbraw/zinc/97/76/74/1336977674.db2.gz	NLDCXYRCQGJDHK-MRXNPFEDSA-N	0	3	330.476	3.228	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2ccccc2C(F)(F)F)C1	ZINC001009308501	1337002921	/nfs/dbraw/zinc/00/29/21/1337002921.db2.gz	NZCRQMQKHXWVDK-CYBMUJFWSA-N	0	3	326.362	3.476	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)C[C@@H]2CCc3ccccc3C2)C1	ZINC001009325093	1337006978	/nfs/dbraw/zinc/00/69/78/1337006978.db2.gz	HTKABRHAKVGMSC-XLIONFOSSA-N	0	3	326.484	3.338	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3ccc(C)cc3C)C2)cc1	ZINC001015481782	1338155268	/nfs/dbraw/zinc/15/52/68/1338155268.db2.gz	HPUHPISSOADFQS-NRFANRHFSA-N	0	3	332.447	3.289	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)[C@@H]2CCCO[C@H]2c2ccc(C)cc2)C1	ZINC001015826665	1338328910	/nfs/dbraw/zinc/32/89/10/1338328910.db2.gz	HQSKYKKHYNKKAF-ZCNNSNEGSA-N	0	3	342.483	3.229	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@H]3NC(=O)C[C@@H]3C=CCC3)CC2)c1	ZINC001016501401	1338628147	/nfs/dbraw/zinc/62/81/47/1338628147.db2.gz	ZQZRDFCNXZIFBJ-YLJYHZDGSA-N	0	3	349.478	3.385	20	30		EGEDHN
Cc1ccoc1C(=O)N[C@@H]1CC12CCN(Cc1cccc(C#N)c1)CC2	ZINC001016505105	1338629758	/nfs/dbraw/zinc/62/97/58/1338629758.db2.gz	LMNPCAABVRQTHC-GOSISDBHSA-N	0	3	349.434	3.244	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2cccc3c(C)c(C)[nH]c32)CC1	ZINC001016690654	1338692323	/nfs/dbraw/zinc/69/23/23/1338692323.db2.gz	OQNWLZVLBPSLSQ-GOSISDBHSA-N	0	3	335.451	3.002	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cc(Cl)ccc2F)CC1	ZINC001016719882	1338702179	/nfs/dbraw/zinc/70/21/79/1338702179.db2.gz	TVYUSZYRYZCSRN-MRXNPFEDSA-N	0	3	334.822	3.087	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2cc(C)c(C)cc2Cl)CC1	ZINC001016761216	1338715395	/nfs/dbraw/zinc/71/53/95/1338715395.db2.gz	HUNLUNVDMKXZJH-QGZVFWFLSA-N	0	3	330.859	3.174	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)s2)CC1	ZINC001016791154	1338728251	/nfs/dbraw/zinc/72/82/51/1338728251.db2.gz	KSZFMZQGQCMXFL-NFAWXSAZSA-N	0	3	348.899	3.109	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cccc(Cl)c2F)CC1	ZINC001016800443	1338731051	/nfs/dbraw/zinc/73/10/51/1338731051.db2.gz	RURRNVKSRIIGHD-HNNXBMFYSA-N	0	3	334.822	3.087	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2cccc(Cl)c2Cl)CC1	ZINC001016946916	1338780145	/nfs/dbraw/zinc/78/01/45/1338780145.db2.gz	RINFEBOIXXKYPR-CQSZACIVSA-N	0	3	337.250	3.211	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2c[nH]c3ccc(C)cc23)CC1	ZINC001016991119	1338796001	/nfs/dbraw/zinc/79/60/01/1338796001.db2.gz	XYSYVPVLTUAXTJ-LJQANCHMSA-N	0	3	335.451	3.084	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(C3=CCCC3)cc2)CC1	ZINC001017003232	1338801101	/nfs/dbraw/zinc/80/11/01/1338801101.db2.gz	JZGMAGSTQHKBGJ-FQEVSTJZSA-N	0	3	334.463	3.471	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCCN(C(=O)C2CC=CC2)C1	ZINC001017083621	1338852957	/nfs/dbraw/zinc/85/29/57/1338852957.db2.gz	FIEXDTXTMAYAEV-HNNXBMFYSA-N	0	3	343.496	3.256	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCCN(C(=O)C=C2CCC2)C1	ZINC001017101936	1338868118	/nfs/dbraw/zinc/86/81/18/1338868118.db2.gz	OSMJIDSBCFQMGU-MRXNPFEDSA-N	0	3	343.496	3.400	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCCN(C(=O)[C@H]2CC2(C)C)C1	ZINC001017106467	1338870536	/nfs/dbraw/zinc/87/05/36/1338870536.db2.gz	HVTIASHCWFZGPG-WMLDXEAASA-N	0	3	345.512	3.336	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](CN(C)Cc2cnc(C)s2)C1	ZINC001017179712	1338923548	/nfs/dbraw/zinc/92/35/48/1338923548.db2.gz	NHBYODRLLYMBST-HNNXBMFYSA-N	0	3	335.517	3.334	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](CN(C)Cc2c(C)noc2CC)C1	ZINC001017180082	1338924107	/nfs/dbraw/zinc/92/41/07/1338924107.db2.gz	RKMGBJJSUAWTQX-INIZCTEOSA-N	0	3	347.503	3.428	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H](CN(C)Cc3ncccc3C)C2)C1	ZINC001017206494	1338953143	/nfs/dbraw/zinc/95/31/43/1338953143.db2.gz	IYKZNQWVSPPAGZ-SFHVURJKSA-N	0	3	341.499	3.417	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1CCCO[C@H]1C(C)C	ZINC001017564751	1339368426	/nfs/dbraw/zinc/36/84/26/1339368426.db2.gz	SDHGIUNZUHBCPP-RDGPPVDQSA-N	0	3	334.504	3.079	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@H]1CCC[C@@H](OC)C1	ZINC001017605710	1339376371	/nfs/dbraw/zinc/37/63/71/1339376371.db2.gz	JHUSJYYSGLVJPP-INDMIFKZSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1cc(C)cc(C)c1	ZINC001017883168	1339439418	/nfs/dbraw/zinc/43/94/18/1339439418.db2.gz	AHLWIWPETUFVFB-BGYRXZFFSA-N	0	3	326.484	3.487	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1cc(F)ccc1OC	ZINC001018090630	1339500501	/nfs/dbraw/zinc/50/05/01/1339500501.db2.gz	VWTCNESNOKCCQN-HDICACEKSA-N	0	3	346.446	3.018	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cc2c([nH]1)CCCC2	ZINC001018146742	1339513942	/nfs/dbraw/zinc/51/39/42/1339513942.db2.gz	IHHXAHJEGBQYQN-CALCHBBNSA-N	0	3	327.472	3.149	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cnn([C@H](C)CC)c1C	ZINC001018153868	1339517063	/nfs/dbraw/zinc/51/70/63/1339517063.db2.gz	ARDDMQIFIQBDGD-NXHRZFHOSA-N	0	3	344.503	3.418	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H]1CCC2(CCC2)CO1	ZINC001018203040	1339531061	/nfs/dbraw/zinc/53/10/61/1339531061.db2.gz	QPYPVEQSHADMFL-OTWHNJEPSA-N	0	3	346.515	3.367	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)c1cccc(OC)c1	ZINC001018312853	1339572471	/nfs/dbraw/zinc/57/24/71/1339572471.db2.gz	ISYDVJCOPBEJKD-RYQLBKOJSA-N	0	3	328.456	3.050	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)C3CCCCCC3)C2)s1	ZINC001018609298	1339680754	/nfs/dbraw/zinc/68/07/54/1339680754.db2.gz	DCOFMCBSASGZKH-HNNXBMFYSA-N	0	3	331.485	3.281	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)CC3=CCCCC3)C2)s1	ZINC001018621878	1339684441	/nfs/dbraw/zinc/68/44/41/1339684441.db2.gz	NEIAXYTZRHBSOG-HNNXBMFYSA-N	0	3	329.469	3.201	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@H]2CCCN2[C@H](C)c2ccccc2)c1	ZINC001028129219	1340447341	/nfs/dbraw/zinc/44/73/41/1340447341.db2.gz	MUCVDTVKPOGBHH-OXQOHEQNSA-N	0	3	333.435	3.018	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NC[C@H]1CCCN1Cc1csc(C)c1	ZINC001028195329	1340479627	/nfs/dbraw/zinc/47/96/27/1340479627.db2.gz	NRHKBUDUYDBKDR-SQNIBIBYSA-N	0	3	348.512	3.118	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1ccccc1OCC(C)C	ZINC001028204424	1340483223	/nfs/dbraw/zinc/48/32/23/1340483223.db2.gz	UOWJFKCXZJUOHK-KRWDZBQOSA-N	0	3	330.472	3.492	20	30		EGEDHN
C#CCCN1CCC[C@@H]1CNC(=O)c1ccc(O[C@H](C)CC)cc1	ZINC001028247074	1340508320	/nfs/dbraw/zinc/50/83/20/1340508320.db2.gz	GEAQZHNJMMNSKH-SJLPKXTDSA-N	0	3	328.456	3.081	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)[C@@H]1CCCc2sc(C)nc21	ZINC001028259272	1340517163	/nfs/dbraw/zinc/51/71/63/1340517163.db2.gz	LYYVZAVNCGRQCC-LSDHHAIUSA-N	0	3	333.501	3.028	20	30		EGEDHN
C#CCCN1CCC[C@H]1CNC(=O)c1cc2c(s1)CCCCC2	ZINC001028300784	1340549233	/nfs/dbraw/zinc/54/92/33/1340549233.db2.gz	HHOZJHLGMNUJBJ-INIZCTEOSA-N	0	3	330.497	3.235	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](CNC(=O)[C@@H]3C[C@@H]4C=C[C@H]3CC4)C2)cc1	ZINC001028553494	1340698104	/nfs/dbraw/zinc/69/81/04/1340698104.db2.gz	IWKGIYQWWMPMMH-RZXSNQJFSA-N	0	3	349.478	3.099	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@H]1CCN(Cc2cccc(F)c2)C1	ZINC001028592741	1340717757	/nfs/dbraw/zinc/71/77/57/1340717757.db2.gz	BHLXZAYOIFEPCT-QGZVFWFLSA-N	0	3	341.430	3.065	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC001028814970	1340832827	/nfs/dbraw/zinc/83/28/27/1340832827.db2.gz	JCOVWZXYASJOAS-HMXCVIKNSA-N	0	3	338.495	3.422	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](CNC(=O)c3c[nH]cc3C3CC3)C2)cc1	ZINC001028900479	1340878551	/nfs/dbraw/zinc/87/85/51/1340878551.db2.gz	DQEHGVCHLCRZTN-QGZVFWFLSA-N	0	3	348.450	3.016	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)c2cc3cccc(Cl)c3o2)C1	ZINC001029027020	1340912509	/nfs/dbraw/zinc/91/25/09/1340912509.db2.gz	GVWROSJQVSQDDS-ZDUSSCGKSA-N	0	3	330.815	3.161	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC([C@H](C)NCc2ccccc2C#N)CC1	ZINC001029054367	1340920103	/nfs/dbraw/zinc/92/01/03/1340920103.db2.gz	UGEIGFMZLRNLNB-CVEARBPZSA-N	0	3	327.472	3.321	20	30		EGEDHN
C[C@H](NCc1c(F)cccc1F)C1CCN(C(=O)C#CC2CC2)CC1	ZINC001029097747	1340929576	/nfs/dbraw/zinc/92/95/76/1340929576.db2.gz	IIMIPJDCPYITNW-AWEZNQCLSA-N	0	3	346.421	3.095	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1C[C@H]2CC[C@@H](C1)N2CCC1CC1	ZINC001029364527	1340978221	/nfs/dbraw/zinc/97/82/21/1340978221.db2.gz	BXCMEXHPLTZSOJ-HDICACEKSA-N	0	3	340.467	3.340	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CC[C@@H](C1)N2C[C@@H](OC)C1CCC1	ZINC001029456436	1340994474	/nfs/dbraw/zinc/99/44/74/1340994474.db2.gz	CKGGXMSNDDFTKH-AJYBTWMASA-N	0	3	334.504	3.079	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCN(C(=O)C=C2CCC2)C1	ZINC001029700691	1341048894	/nfs/dbraw/zinc/04/88/94/1341048894.db2.gz	MLLIJLNDRYVKQN-OAHLLOKOSA-N	0	3	329.469	3.010	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCN(C(=O)CC2(C)CC2)C1	ZINC001029786759	1341072942	/nfs/dbraw/zinc/07/29/42/1341072942.db2.gz	ZFOFGVUXTFABNZ-AWEZNQCLSA-N	0	3	331.485	3.090	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001029823633	1341086162	/nfs/dbraw/zinc/08/61/62/1341086162.db2.gz	VOFPYXDLSRFWGI-CQSZACIVSA-N	0	3	333.501	3.336	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H](CN(C)Cc2ccc(F)cn2)C1	ZINC001029826301	1341087703	/nfs/dbraw/zinc/08/77/03/1341087703.db2.gz	OQHPAYOSHJUWAL-BEFAXECRSA-N	0	3	333.451	3.103	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](CN(C)Cc2cnc(C)s2)C1	ZINC001029826760	1341088168	/nfs/dbraw/zinc/08/81/68/1341088168.db2.gz	VIWHURQQGQUSCW-MAUKXSAKSA-N	0	3	335.517	3.334	20	30		EGEDHN
Cc1ccc(CN(C)CC2CCN(C(=O)[C@@H](C)C#N)CC2)c(Cl)c1	ZINC001029946253	1341130709	/nfs/dbraw/zinc/13/07/09/1341130709.db2.gz	JBSBNEKRFMEQAX-HNNXBMFYSA-N	0	3	347.890	3.479	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)CC1CCN(C(=O)[C@@H]2CC2(C)C)CC1	ZINC001029957960	1341135152	/nfs/dbraw/zinc/13/51/52/1341135152.db2.gz	YMCLHAILEDHTPS-KRWDZBQOSA-N	0	3	345.512	3.336	20	30		EGEDHN
CC[C@H](F)C(=O)N1CCC(CN(C)Cc2ccc(C#N)s2)CC1	ZINC001029985501	1341144879	/nfs/dbraw/zinc/14/48/79/1341144879.db2.gz	ZTPNMAMERCLBCI-INIZCTEOSA-N	0	3	337.464	3.038	20	30		EGEDHN
CCC1(C(=O)N2CCC(CN(C)Cc3ccc(C#N)s3)CC2)CC1	ZINC001029992136	1341149073	/nfs/dbraw/zinc/14/90/73/1341149073.db2.gz	JWKSTSOQVAAYCK-UHFFFAOYSA-N	0	3	345.512	3.480	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cnc2ccccc2c1C	ZINC001032525801	1341531890	/nfs/dbraw/zinc/53/18/90/1341531890.db2.gz	GGRRGWIHYIDRKJ-IRXDYDNUSA-N	0	3	335.451	3.408	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccccc1OC1CCC1	ZINC001032618320	1341561641	/nfs/dbraw/zinc/56/16/41/1341561641.db2.gz	SAKDTNUYHZWADZ-IRXDYDNUSA-N	0	3	340.467	3.483	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)Cc2coc3cc(F)ccc23)C1	ZINC001033082776	1341718807	/nfs/dbraw/zinc/71/88/07/1341718807.db2.gz	REZPJEVXCTYKFV-INIZCTEOSA-N	0	3	330.403	3.223	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N(C)[C@H]1CCN(Cc2cccc(C)c2)C1	ZINC001033086338	1341719646	/nfs/dbraw/zinc/71/96/46/1341719646.db2.gz	HIWDCLBGWORLMF-ZCNNSNEGSA-N	0	3	342.483	3.009	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2cc(Cl)c(Cl)n2C)C1	ZINC001033131716	1341735561	/nfs/dbraw/zinc/73/55/61/1341735561.db2.gz	OMEBTDJJHDKYGB-LLVKDONJSA-N	0	3	330.259	3.054	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccc(F)cc2F)C1	ZINC001033295253	1341770273	/nfs/dbraw/zinc/77/02/73/1341770273.db2.gz	SDUZWNFZYBGMKN-HYVNUMGLSA-N	0	3	334.410	3.177	20	30		EGEDHN
C#CCCN1CC[C@@H](N(C)C(=O)c2ccc(Cl)c(Cl)c2)C1	ZINC001033604920	1341895188	/nfs/dbraw/zinc/89/51/88/1341895188.db2.gz	AKROSEYCHZDUDH-CYBMUJFWSA-N	0	3	325.239	3.163	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)Cc2cccc(OC(C)C)c2)C1	ZINC001033698909	1341965616	/nfs/dbraw/zinc/96/56/16/1341965616.db2.gz	FRTMFAPNJHRHJP-GOSISDBHSA-N	0	3	330.472	3.125	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N1CC[C@H](NCc2ccccc2Cl)[C@@H]1C	ZINC001074895593	1356281175	/nfs/dbraw/zinc/28/11/75/1356281175.db2.gz	AFSXGDRJKQMWSQ-DHXZDTOLSA-N	0	3	348.874	3.010	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccnn2C(CC)CC)C1	ZINC001033853444	1342045661	/nfs/dbraw/zinc/04/56/61/1342045661.db2.gz	BFXPUHVZHPKVER-QGZVFWFLSA-N	0	3	332.492	3.357	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2[nH]nc(C3CC3)c2Cl)C1	ZINC001033886653	1342059944	/nfs/dbraw/zinc/05/99/44/1342059944.db2.gz	ZPXHJODXVOUJNO-ZDUSSCGKSA-N	0	3	336.867	3.053	20	30		EGEDHN
C=CCCN1CC[C@H](N(CC)C(=O)c2cc(-c3ccccc3)no2)C1	ZINC001033891447	1342065340	/nfs/dbraw/zinc/06/53/40/1342065340.db2.gz	NZCDYJSFRYNGLT-KRWDZBQOSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cc3c(cn2)CCCC3)C1	ZINC001033893746	1342066658	/nfs/dbraw/zinc/06/66/58/1342066658.db2.gz	RCMBRGUZDYAZLW-GOSISDBHSA-N	0	3	327.472	3.073	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2cc3c(cc(C)cc3C)[nH]2)C1	ZINC001033915342	1342084500	/nfs/dbraw/zinc/08/45/00/1342084500.db2.gz	CCIAFLKCVLAHGT-KRWDZBQOSA-N	0	3	337.467	3.344	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2cc3c(ccc(C)c3C)[nH]2)C1	ZINC001033923630	1342090160	/nfs/dbraw/zinc/09/01/60/1342090160.db2.gz	SOWCHKMWJIZWHH-KRWDZBQOSA-N	0	3	337.467	3.344	20	30		EGEDHN
C#Cc1ccc(C(=O)N(CC)[C@H]2CCN(Cc3ccccc3C)C2)cn1	ZINC001034023008	1342160034	/nfs/dbraw/zinc/16/00/34/1342160034.db2.gz	MQAVZCFTJHHKJI-NRFANRHFSA-N	0	3	347.462	3.108	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2csc3c2CC[C@H](C)C3)C1	ZINC001034032629	1342172073	/nfs/dbraw/zinc/17/20/73/1342172073.db2.gz	UKSCTMUSTQELGU-HOTGVXAUSA-N	0	3	344.524	3.433	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2[nH]c3ccccc3c2OC)C1	ZINC001034050448	1342191421	/nfs/dbraw/zinc/19/14/21/1342191421.db2.gz	MNWXJIHMABKGLC-HNNXBMFYSA-N	0	3	341.455	3.289	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccnn2C2CCCC2)C1	ZINC001034229746	1342333817	/nfs/dbraw/zinc/33/38/17/1342333817.db2.gz	VWVHTOYFTBNVBS-MRXNPFEDSA-N	0	3	330.476	3.159	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@@H]2CCc3ccc(F)cc3O2)C1	ZINC001034306049	1342389187	/nfs/dbraw/zinc/38/91/87/1342389187.db2.gz	BLLGIVHYQYIDBK-MSOLQXFVSA-N	0	3	346.446	3.066	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc(C(F)(F)F)nc2)C1	ZINC001034334773	1342409630	/nfs/dbraw/zinc/40/96/30/1342409630.db2.gz	MCCVJQHPSDTRRI-AWEZNQCLSA-N	0	3	341.377	3.261	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2ccc(C)nc2C(C)C)C1	ZINC001034335590	1342410152	/nfs/dbraw/zinc/41/01/52/1342410152.db2.gz	WCPWPNQFPFFRDU-QGZVFWFLSA-N	0	3	327.472	3.121	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cc3ccccc3n2C)C1	ZINC001034368547	1342438543	/nfs/dbraw/zinc/43/85/43/1342438543.db2.gz	LBNHKXSJVNSBPG-KRWDZBQOSA-N	0	3	325.456	3.339	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cnc(-c3ccccc3)[nH]2)C1	ZINC001034421862	1342483674	/nfs/dbraw/zinc/48/36/74/1342483674.db2.gz	QXUVSOMVDTYSDL-KRWDZBQOSA-N	0	3	338.455	3.237	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)C2(c3ccccc3F)CC2)C1	ZINC001034474843	1342529546	/nfs/dbraw/zinc/52/95/46/1342529546.db2.gz	MVYZIACRWJUWSE-MRXNPFEDSA-N	0	3	330.447	3.404	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2c[nH]nc2C2CCCCC2)C1	ZINC001034487404	1342546055	/nfs/dbraw/zinc/54/60/55/1342546055.db2.gz	NAWSVJPKUDRAKC-KRWDZBQOSA-N	0	3	342.487	3.065	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)C[C@H]2CCc3ccccc3C2)C1	ZINC001034501645	1342559872	/nfs/dbraw/zinc/55/98/72/1342559872.db2.gz	YIJRDUNYRBKJRS-FXAWDEMLSA-N	0	3	326.484	3.338	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@]2(c3ccccc3)CCCO2)C1	ZINC001034501707	1342560026	/nfs/dbraw/zinc/56/00/26/1342560026.db2.gz	ZJIFKRATIJCVHV-PZJWPPBQSA-N	0	3	342.483	3.239	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2[nH]c3ccccc3c2OC)C1	ZINC001034546120	1342609622	/nfs/dbraw/zinc/60/96/22/1342609622.db2.gz	GSUPWSCWJUZYFQ-HNNXBMFYSA-N	0	3	341.455	3.337	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1CC[C@H](NC(=O)C2CCCC2)CC1	ZINC001034580166	1342626754	/nfs/dbraw/zinc/62/67/54/1342626754.db2.gz	DBIPKSFPWLHTTB-WGSAOQKQSA-N	0	3	325.456	3.265	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1CC[C@H](NC(=O)[C@H]2CC=CCC2)CC1	ZINC001034591878	1342636725	/nfs/dbraw/zinc/63/67/25/1342636725.db2.gz	IWFLGTDCQBZAKZ-VDGAXYAQSA-N	0	3	337.467	3.432	20	30		EGEDHN
C[C@@H](C(=O)N[C@H]1CC[C@H](NCc2ccccc2C#N)CC1)C1CC1	ZINC001034615149	1342649301	/nfs/dbraw/zinc/64/93/01/1342649301.db2.gz	GZMMOPGXTIXRJQ-NIKGAXFTSA-N	0	3	325.456	3.121	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)C2CC(C)(C)C2)CC1	ZINC001034638223	1342664959	/nfs/dbraw/zinc/66/49/59/1342664959.db2.gz	KSWLRGKTALYKPH-HDJSIYSDSA-N	0	3	343.309	3.348	20	30		EGEDHN
C[C@H]1C[C@H]1CC(=O)N[C@H]1CC[C@H](NCc2cc(F)ccc2C#N)CC1	ZINC001034724410	1342718194	/nfs/dbraw/zinc/71/81/94/1342718194.db2.gz	MABZYDYDRWZUIK-BMIPRAEKSA-N	0	3	343.446	3.260	20	30		EGEDHN
N#Cc1ccc(CNCc2ccc(CNC(=O)[C@H]3CC34CC4)cc2)cc1	ZINC001034830612	1342791269	/nfs/dbraw/zinc/79/12/69/1342791269.db2.gz	XXSVIHHPJFEYAQ-HXUWFJFHSA-N	0	3	345.446	3.264	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2ccccc2OCC)C12CCC2	ZINC001078798432	1357090848	/nfs/dbraw/zinc/09/08/48/1357090848.db2.gz	QDCIPWJLAZNALV-IAGOWNOFSA-N	0	3	348.874	3.468	20	30		EGEDHN
CCC(CC)C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)c(F)c1	ZINC001034869674	1342814837	/nfs/dbraw/zinc/81/48/37/1342814837.db2.gz	YJMVAUUIBIUCNM-QGZVFWFLSA-N	0	3	331.435	3.214	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@@H]1CNCc1c(Cl)oc2ccccc21	ZINC001034886307	1342821660	/nfs/dbraw/zinc/82/16/60/1342821660.db2.gz	ISBSZGCULDVLBB-CHWSQXEVSA-N	0	3	345.830	3.326	20	30		EGEDHN
CC(C)(C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)c(F)c1)C1CC1	ZINC001035023472	1342882074	/nfs/dbraw/zinc/88/20/74/1342882074.db2.gz	FADOIFWTZGWXDQ-QGZVFWFLSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001035036201	1342889892	/nfs/dbraw/zinc/88/98/92/1342889892.db2.gz	YHKQQUBRWGPQIX-YLJYHZDGSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H]1CNCc1c(C)noc1CC	ZINC001035037041	1342890392	/nfs/dbraw/zinc/89/03/92/1342890392.db2.gz	MYRVPJRIJQCBSM-DNVCBOLYSA-N	0	3	333.476	3.228	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)C2CCC=CCC2)s1	ZINC001035129498	1342946067	/nfs/dbraw/zinc/94/60/67/1342946067.db2.gz	YYOFBAVLLNXCQS-MRXNPFEDSA-N	0	3	343.496	3.447	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC2(CCN(CC#Cc3ccccc3)C2)CC1	ZINC001035159060	1342975736	/nfs/dbraw/zinc/97/57/36/1342975736.db2.gz	YCMQGKIOEGQDRL-IBGZPJMESA-N	0	3	338.495	3.399	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC2(CCN(Cc3ocnc3C)C2)CC1	ZINC001035212833	1343031418	/nfs/dbraw/zinc/03/14/18/1343031418.db2.gz	ABFDBXNEPBKNFT-UHFFFAOYSA-N	0	3	345.487	3.400	20	30		EGEDHN
Cc1cc(C)cc(CN2CC3(C2)CCN(C(=O)C#CC2CC2)CC3)c1	ZINC001035701258	1343142775	/nfs/dbraw/zinc/14/27/75/1343142775.db2.gz	VLWDAEIUBMTWQS-UHFFFAOYSA-N	0	3	336.479	3.141	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cccc3scnc31)CC2	ZINC001035706429	1343144535	/nfs/dbraw/zinc/14/45/35/1343144535.db2.gz	LJWYYWYHPUBEIW-UHFFFAOYSA-N	0	3	341.480	3.410	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)CCc1ccc3[nH]ccc3c1)CC2	ZINC001035749881	1343168674	/nfs/dbraw/zinc/16/86/74/1343168674.db2.gz	GRUCEOUJRGIYMM-UHFFFAOYSA-N	0	3	349.478	3.048	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC2(CN(C[C@H]3CCCCO3)C2)CC1	ZINC001035767531	1343179439	/nfs/dbraw/zinc/17/94/39/1343179439.db2.gz	SUERXVVOTCUYJT-QGZVFWFLSA-N	0	3	334.504	3.082	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@@H](C)c1ccc(Cl)cc1)CC2	ZINC001035785802	1343196590	/nfs/dbraw/zinc/19/65/90/1343196590.db2.gz	NKFGTTILPQKNDE-INIZCTEOSA-N	0	3	344.886	3.391	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cc1ccc(CC)cc1)CC2	ZINC001035803965	1343206426	/nfs/dbraw/zinc/20/64/26/1343206426.db2.gz	DFZROLSZNLRZDR-UHFFFAOYSA-N	0	3	326.484	3.292	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1oc(C(C)C)nc1C)CC2	ZINC001035811807	1343211356	/nfs/dbraw/zinc/21/13/56/1343211356.db2.gz	BAHQDMRWIDNRRM-UHFFFAOYSA-N	0	3	331.460	3.221	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1sc(C(C)C)nc1C)CC2	ZINC001035852714	1343230952	/nfs/dbraw/zinc/23/09/52/1343230952.db2.gz	SOSZOLJFGCBFQS-UHFFFAOYSA-N	0	3	345.512	3.136	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@@H](C)c1cccc(Cl)c1)CC2	ZINC001035854799	1343232040	/nfs/dbraw/zinc/23/20/40/1343232040.db2.gz	DWPJLIKWKOQLDV-INIZCTEOSA-N	0	3	344.886	3.391	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@H](C)Cc1ccccc1)CC2	ZINC001035856045	1343232749	/nfs/dbraw/zinc/23/27/49/1343232749.db2.gz	IQVPGPZZPQVDNE-GOSISDBHSA-N	0	3	326.484	3.366	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@]1(C)CCc3ccccc31)CC2	ZINC001035860386	1343236398	/nfs/dbraw/zinc/23/63/98/1343236398.db2.gz	LYYONLSAXDFZCC-NRFANRHFSA-N	0	3	338.495	3.391	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)COC1CCC(C)CC1)CC2	ZINC001035861124	1343236876	/nfs/dbraw/zinc/23/68/76/1343236876.db2.gz	NUINDERKQMGNJY-UHFFFAOYSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](NCc2nc(C)oc2C)[C@H](C)C1	ZINC001036139436	1343324258	/nfs/dbraw/zinc/32/42/58/1343324258.db2.gz	ZHXFEKFPAXDJJO-CZUORRHYSA-N	0	3	333.476	3.220	20	30		EGEDHN
C[C@H]1CN(C(=O)C(C)(C)C2CC2)CC[C@H]1NCc1ccccc1C#N	ZINC001036143296	1343325895	/nfs/dbraw/zinc/32/58/95/1343325895.db2.gz	BOJFHINWFCCBKS-HNAYVOBHSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](NCc2nc(C)sc2C)[C@H](C)C1	ZINC001036142800	1343326320	/nfs/dbraw/zinc/32/63/20/1343326320.db2.gz	LNSPPEPQVZVTST-IUODEOHRSA-N	0	3	335.517	3.299	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3nccs3)[C@H](C)C2)CC1	ZINC001036163284	1343338314	/nfs/dbraw/zinc/33/83/14/1343338314.db2.gz	CZBSMOOCZDWWGQ-GDBMZVCRSA-N	0	3	333.501	3.216	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2(C)CC=CC2)CC[C@H]1NCc1ccccc1C#N	ZINC001036173733	1343346112	/nfs/dbraw/zinc/34/61/12/1343346112.db2.gz	NZKHMMFIOGTUDT-VQIMIIECSA-N	0	3	337.467	3.241	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2(C)CC=CC2)CC[C@@H]1NCc1ccccc1C#N	ZINC001036173717	1343346145	/nfs/dbraw/zinc/34/61/45/1343346145.db2.gz	NZKHMMFIOGTUDT-APWZRJJASA-N	0	3	337.467	3.241	20	30		EGEDHN
CCCC(=O)N1CCC[C@H]([C@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001036337031	1343421928	/nfs/dbraw/zinc/42/19/28/1343421928.db2.gz	WYTFPSXBLOPBDO-HOCLYGCPSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]([C@H](C)NCc3nccs3)C2)C1	ZINC001036444134	1343491567	/nfs/dbraw/zinc/49/15/67/1343491567.db2.gz	IJIAYWSITCHEEK-LSDHHAIUSA-N	0	3	333.501	3.216	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@H](C)[C@@H]1CNCc1cc(C#N)ccc1F	ZINC001036492269	1343515195	/nfs/dbraw/zinc/51/51/95/1343515195.db2.gz	JODVKMJQOJUTHC-KXBFYZLASA-N	0	3	345.462	3.460	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@@H](C)[C@H]1CNCc1ccc(C#N)cc1F	ZINC001036511349	1343526570	/nfs/dbraw/zinc/52/65/70/1343526570.db2.gz	SSHNUVDHBRROLT-RDTXWAMCSA-N	0	3	331.435	3.070	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC[C@H](C)[C@H]1CNCc1cc(C#N)ccc1F	ZINC001036533544	1343541139	/nfs/dbraw/zinc/54/11/39/1343541139.db2.gz	SVZMZOVLKDSEQY-GODMXEIXSA-N	0	3	343.446	3.380	20	30		EGEDHN
C[C@H]1CCCN(C(=O)C#CC2CC2)[C@@H]1CNCc1cc(F)ccc1F	ZINC001036550436	1343549547	/nfs/dbraw/zinc/54/95/47/1343549547.db2.gz	VJKKPHGGIJLDIC-IFXJQAMLSA-N	0	3	346.421	3.095	20	30		EGEDHN
CC(C)C(=O)N1CC[C@H]2[C@H](CCN2CC#Cc2ccc(Cl)cc2)C1	ZINC001036649173	1343599225	/nfs/dbraw/zinc/59/92/25/1343599225.db2.gz	SRECQZBIAGUUTO-MJGOQNOKSA-N	0	3	344.886	3.270	20	30		EGEDHN
O=C(CC1CCC1)N1CC[C@H]2[C@@H](CCN2CC#Cc2ccccc2)C1	ZINC001036677666	1343618092	/nfs/dbraw/zinc/61/80/92/1343618092.db2.gz	FOTHNISOSFCLPC-SFTDATJTSA-N	0	3	336.479	3.151	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001036805288	1343741116	/nfs/dbraw/zinc/74/11/16/1343741116.db2.gz	XLGPSMKGYJEIFR-RHSMWYFYSA-N	0	3	345.512	3.479	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]3[C@H](CCN3CC#Cc3ccccc3)C2)C1	ZINC001036815248	1343752025	/nfs/dbraw/zinc/75/20/25/1343752025.db2.gz	BGMCQBBQLCNBIO-NHCUHLMSSA-N	0	3	348.490	3.317	20	30		EGEDHN
O=C(C1CC2(CC2)C1)N1CC[C@H]2[C@H](CCN2CC#Cc2ccccc2)C1	ZINC001036818539	1343756831	/nfs/dbraw/zinc/75/68/31/1343756831.db2.gz	CVVFUZZDYBEQRU-CTNGQTDRSA-N	0	3	348.490	3.151	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2cc(F)c(F)cc2Cl)C1	ZINC001080885270	1357758364	/nfs/dbraw/zinc/75/83/64/1357758364.db2.gz	HFWKEWOXRBZKPN-MEBBXXQBSA-N	0	3	328.790	3.244	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCC[C@@H]2CNCc2ocnc2C)C1	ZINC001037242938	1344064322	/nfs/dbraw/zinc/06/43/22/1344064322.db2.gz	SXIAGNTVPTTXFQ-HZPDHXFCSA-N	0	3	331.460	3.104	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](NCc3nc(C)oc3C)[C@H](CC)C2)C1	ZINC001037914875	1344175769	/nfs/dbraw/zinc/17/57/69/1344175769.db2.gz	NNEAKJHJJLITLP-IAGOWNOFSA-N	0	3	345.487	3.364	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3nocc3C)[C@H](CC)C2)CC1	ZINC001037917134	1344177388	/nfs/dbraw/zinc/17/73/88/1344177388.db2.gz	ATZWDLMKSNFZIU-AEFFLSMTSA-N	0	3	345.487	3.446	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3nocc3C)[C@H](CC)C2)CC1	ZINC001037917151	1344177831	/nfs/dbraw/zinc/17/78/31/1344177831.db2.gz	ATZWDLMKSNFZIU-SJLPKXTDSA-N	0	3	345.487	3.446	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3cnns3)[C@@H](CC)C2)CC1	ZINC001037924305	1344184491	/nfs/dbraw/zinc/18/44/91/1344184491.db2.gz	LPBJSVOVKIXJBS-WMLDXEAASA-N	0	3	348.516	3.001	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1c(F)cccc1F	ZINC001038682881	1344540929	/nfs/dbraw/zinc/54/09/29/1344540929.db2.gz	XWMHWSGKVDXAEM-RBSFLKMASA-N	0	3	334.410	3.225	20	30		EGEDHN
C=CCCN1CC[C@@H]1CNC(=O)[C@@H]1CCCO[C@H]1c1ccc(C)cc1	ZINC001038789585	1344585449	/nfs/dbraw/zinc/58/54/49/1344585449.db2.gz	JHKFHBHLIOAZRV-AQNXPRMDSA-N	0	3	342.483	3.229	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCN2CC2CCC(C)(C)CC2)nc1	ZINC001038934057	1344660632	/nfs/dbraw/zinc/66/06/32/1344660632.db2.gz	ZTJOYUFDUIBYPC-SFHVURJKSA-N	0	3	339.483	3.083	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C(C)(C)C(C)C)CC[C@H]1c1ccc(F)cc1	ZINC001079152628	1357198083	/nfs/dbraw/zinc/19/80/83/1357198083.db2.gz	WESVHKKRNULPGR-RBUKOAKNSA-N	0	3	344.474	3.415	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](c3ccc(F)cc3)[C@H](NCCF)C2)C1	ZINC001079158195	1357198503	/nfs/dbraw/zinc/19/85/03/1357198503.db2.gz	XBXOCPORSJJKEZ-ZWKOTPCHSA-N	0	3	348.437	3.426	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1ccc(N(C)C(C)C)cc1	ZINC001039073299	1344754926	/nfs/dbraw/zinc/75/49/26/1344754926.db2.gz	LSIMRCGIBIJOTR-LJQANCHMSA-N	0	3	329.488	3.302	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)c3ccccn3)CC2)C1	ZINC001039097681	1344769367	/nfs/dbraw/zinc/76/93/67/1344769367.db2.gz	NPHPCWFHZCBHAY-MRXNPFEDSA-N	0	3	333.863	3.008	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)c3ncccc3C)CC2)C1	ZINC001039124718	1344800981	/nfs/dbraw/zinc/80/09/81/1344800981.db2.gz	VEDQLWKSNOMWBW-KRWDZBQOSA-N	0	3	347.890	3.317	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)[C@@H]3CCC3(F)F)CC2)C1	ZINC001039142851	1344824568	/nfs/dbraw/zinc/82/45/68/1344824568.db2.gz	OXOMTTYMSGGYPN-GJZGRUSLSA-N	0	3	346.849	3.345	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2oc(C)cc2C)C1	ZINC001039203563	1344913934	/nfs/dbraw/zinc/91/39/34/1344913934.db2.gz	QKYYEVMIOAVTNB-ROUUACIJSA-N	0	3	328.456	3.236	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc(F)ccc2F)C1	ZINC001039212432	1344927179	/nfs/dbraw/zinc/92/71/79/1344927179.db2.gz	FZZYUYKPRRCNDU-DNVCBOLYSA-N	0	3	346.421	3.305	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cccc(C)c2F)C1	ZINC001039213052	1344928566	/nfs/dbraw/zinc/92/85/66/1344928566.db2.gz	ZRGALQAPKNSDMS-AEFFLSMTSA-N	0	3	328.431	3.084	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)CCc2ccsc2)C1	ZINC001039214965	1344931076	/nfs/dbraw/zinc/93/10/76/1344931076.db2.gz	RFYACAKHLUPUFV-RBUKOAKNSA-N	0	3	344.524	3.407	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cccc3cccnc32)C1	ZINC001039217248	1344934052	/nfs/dbraw/zinc/93/40/52/1344934052.db2.gz	GOHZKFNXWVVPDC-ICSRJNTNSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc3ccsc3[nH]2)C1	ZINC001039224335	1344942067	/nfs/dbraw/zinc/94/20/67/1344942067.db2.gz	DSSWKTUBYKZKSX-DOTOQJQBSA-N	0	3	341.480	3.179	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)Cc2cccc(Cl)c2)C1	ZINC001039229822	1344949130	/nfs/dbraw/zinc/94/91/30/1344949130.db2.gz	MUVCXQQQPDQVJK-MJGOQNOKSA-N	0	3	344.886	3.219	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cncc(Cl)c2)C1	ZINC001039229978	1344949153	/nfs/dbraw/zinc/94/91/53/1344949153.db2.gz	HFFFJHCJOAMRQG-CRAIPNDOSA-N	0	3	345.874	3.075	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(Cl)c(F)c2)C1	ZINC001039239455	1344963959	/nfs/dbraw/zinc/96/39/59/1344963959.db2.gz	SUXCABPSTALJHU-YJBOKZPZSA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccc3ccccc3n2)C1	ZINC001039242616	1344969174	/nfs/dbraw/zinc/96/91/74/1344969174.db2.gz	BYOAVOVMKUUZEL-RXVVDRJESA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc(Cl)cn2CC)C1	ZINC001039243755	1344971309	/nfs/dbraw/zinc/97/13/09/1344971309.db2.gz	WBWXSVQXMQWZPC-DOTOQJQBSA-N	0	3	347.890	3.111	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc(C)c(CC)o2)C1	ZINC001039244188	1344972124	/nfs/dbraw/zinc/97/21/24/1344972124.db2.gz	HPVAAKYBOGXFHB-IRXDYDNUSA-N	0	3	328.456	3.100	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2oc(CC)cc2C)C1	ZINC001039247181	1344976932	/nfs/dbraw/zinc/97/69/32/1344976932.db2.gz	UTVJKEPJKQBTGJ-PKOBYXMFSA-N	0	3	342.483	3.490	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccc3cccnc3c2)C1	ZINC001039248135	1344977721	/nfs/dbraw/zinc/97/77/21/1344977721.db2.gz	RFZXSVCDSOEGSX-TZIWHRDSSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc3ccccc3o2)C1	ZINC001039250831	1344982363	/nfs/dbraw/zinc/98/23/63/1344982363.db2.gz	QJBOBARWEWVCSN-ROUUACIJSA-N	0	3	336.435	3.383	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CCc2cc(F)ccc21	ZINC001039405868	1345051036	/nfs/dbraw/zinc/05/10/36/1345051036.db2.gz	MNMJMJOUNANWBR-WSTZPKSXSA-N	0	3	342.458	3.497	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(C)c2cccnc12	ZINC001039408191	1345052360	/nfs/dbraw/zinc/05/23/60/1345052360.db2.gz	FBBYLYYJLFHMBU-MSOLQXFVSA-N	0	3	347.462	3.245	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1nccc2occc21	ZINC001039409316	1345053102	/nfs/dbraw/zinc/05/31/02/1345053102.db2.gz	KJDASGNQFWYBRS-CABCVRRESA-N	0	3	325.412	3.083	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@H]1CCOc2ccccc21	ZINC001039415967	1345056806	/nfs/dbraw/zinc/05/68/06/1345056806.db2.gz	CZLVBARWEDFDPO-KURKYZTESA-N	0	3	340.467	3.194	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(F)c(OC)c1	ZINC001039441187	1345067726	/nfs/dbraw/zinc/06/77/26/1345067726.db2.gz	SHKIIKBDGOECOL-CVEARBPZSA-N	0	3	332.419	3.089	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C1CCC(F)(F)CC1	ZINC001039443830	1345069694	/nfs/dbraw/zinc/06/96/94/1345069694.db2.gz	JYKKJTVKEKCTDG-CVEARBPZSA-N	0	3	326.431	3.453	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1c(C)csc1Cl	ZINC001039464675	1345082264	/nfs/dbraw/zinc/08/22/64/1345082264.db2.gz	ROOFJBBTOQLQAZ-KGLIPLIRSA-N	0	3	336.888	3.412	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1Cc2ccc(Cl)cc21	ZINC001039465123	1345083056	/nfs/dbraw/zinc/08/30/56/1345083056.db2.gz	OSUTYELYLLIMOG-AOIWGVFYSA-N	0	3	342.870	3.068	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2[nH]c(C)c(C)c2c1	ZINC001039468270	1345085840	/nfs/dbraw/zinc/08/58/40/1345085840.db2.gz	CCQAYENABGMRHZ-MOPGFXCFSA-N	0	3	349.478	3.487	20	30		EGEDHN
C=C(C)CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1scnc1Cl	ZINC001039472436	1345088209	/nfs/dbraw/zinc/08/82/09/1345088209.db2.gz	SEWFDILFBYQNBY-OLZOCXBDSA-N	0	3	339.892	3.442	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1Cc2c1cccc2Cl	ZINC001039476175	1345090929	/nfs/dbraw/zinc/09/09/29/1345090929.db2.gz	FQVIQULGRJBZKW-VKJFTORMSA-N	0	3	342.870	3.068	20	30		EGEDHN
CCC(=O)N1CCC(N(Cc2cc(F)ccc2C#N)CC2CC2)CC1	ZINC001039480369	1345094697	/nfs/dbraw/zinc/09/46/97/1345094697.db2.gz	RABRLCBNGFBNFP-UHFFFAOYSA-N	0	3	343.446	3.310	20	30		EGEDHN
N#Cc1cc(C(=O)N2C[C@H]3CCC[C@@H](C2)N3CCC2CCCC2)c[nH]1	ZINC001039552129	1345140955	/nfs/dbraw/zinc/14/09/55/1345140955.db2.gz	RAMTUVXSYLUZRM-KDURUIRLSA-N	0	3	340.471	3.146	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CCC[C@@H](C1)N2CCC1CCOCC1	ZINC001039896817	1345239559	/nfs/dbraw/zinc/23/95/59/1345239559.db2.gz	QOZQVEZPWOGCBR-SVFBPWRDSA-N	0	3	348.531	3.471	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3nc(C(C)C)oc3C)C2)C1	ZINC001040201192	1345373133	/nfs/dbraw/zinc/37/31/33/1345373133.db2.gz	KRTTYFSBJYVYID-FQEVSTJZSA-N	0	3	343.471	3.058	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3nc(C(C)C)oc3C)C2)C1	ZINC001040203057	1345374384	/nfs/dbraw/zinc/37/43/84/1345374384.db2.gz	WFLYOOLUPQRLPI-IBGZPJMESA-N	0	3	331.460	3.221	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3sc(Cl)nc3C)C2)C1	ZINC001040227319	1345385520	/nfs/dbraw/zinc/38/55/20/1345385520.db2.gz	DQPKPGKDJPNEAP-MRXNPFEDSA-N	0	3	339.892	3.219	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ccc4cc(C)cn4c3)C2)C1	ZINC001040236475	1345389522	/nfs/dbraw/zinc/38/95/22/1345389522.db2.gz	NGFBGUBPQMPVLO-QFIPXVFZSA-N	0	3	349.478	3.199	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)C3C4CC5CC(C4)CC3C5)C2)C1	ZINC001040241435	1345391265	/nfs/dbraw/zinc/39/12/65/1345391265.db2.gz	OOSPDOUMIQJKNL-DSVYFTGISA-N	0	3	340.511	3.006	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CC[C@]2(C1)CCCN(C[C@H](F)CC)C2	ZINC001040241596	1345391367	/nfs/dbraw/zinc/39/13/67/1345391367.db2.gz	PRTRNQLTZPMUJY-YLJYHZDGSA-N	0	3	347.478	3.350	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cc(C)ccc3OC)C2)C1	ZINC001040281242	1345409403	/nfs/dbraw/zinc/40/94/03/1345409403.db2.gz	BDENOMCCKDMMQY-FQEVSTJZSA-N	0	3	328.456	3.118	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3c(C)[nH]c4ccccc43)C2)C1	ZINC001040282377	1345410505	/nfs/dbraw/zinc/41/05/05/1345410505.db2.gz	IIXFFTIBYYZKFJ-JOCHJYFZSA-N	0	3	349.478	3.428	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3cc4ccc(C)cc4[nH]3)C2)C1	ZINC001040314142	1345426641	/nfs/dbraw/zinc/42/66/41/1345426641.db2.gz	ABNFWBDWWDXZEI-NRFANRHFSA-N	0	3	335.451	3.038	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@]2(C1)CCCN(Cc1ncccc1C)C2	ZINC001040329705	1345434724	/nfs/dbraw/zinc/43/47/24/1345434724.db2.gz	XABHQGAOMRNVOE-NRFANRHFSA-N	0	3	341.499	3.417	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cc(F)c(F)cc3F)C2)C1	ZINC001040353128	1345449076	/nfs/dbraw/zinc/44/90/76/1345449076.db2.gz	GFCWIJAIACGARN-SFHVURJKSA-N	0	3	338.373	3.218	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@]2(C1)CCCN(Cc1cccnc1)C2	ZINC001040370905	1345459962	/nfs/dbraw/zinc/45/99/62/1345459962.db2.gz	FKWRHVJPPHZJRS-LEWJYISDSA-N	0	3	341.499	3.498	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ccc(C)c(F)c3F)C2)C1	ZINC001040416508	1345485442	/nfs/dbraw/zinc/48/54/42/1345485442.db2.gz	WOIKIFHXMMBGDZ-FQEVSTJZSA-N	0	3	346.421	3.225	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)C3[C@@H]4CCCCCC[C@@H]34)C2)C1	ZINC001040418169	1345486796	/nfs/dbraw/zinc/48/67/96/1345486796.db2.gz	MJJINWXHTNAFJC-OPYAIIAOSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ccc(C)cc3F)C2)C1	ZINC001040419900	1345487220	/nfs/dbraw/zinc/48/72/20/1345487220.db2.gz	ZEJCEXQTQWIQDK-FQEVSTJZSA-N	0	3	328.431	3.086	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@]3(C)CC[C@H](C)C3(C)C)C2)C1	ZINC001040433157	1345496628	/nfs/dbraw/zinc/49/66/28/1345496628.db2.gz	TVWCNIIURKXROL-DZFGPLHGSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@@H](C)c3ccc(CC)cc3)C2)C1	ZINC001040451135	1345507167	/nfs/dbraw/zinc/50/71/67/1345507167.db2.gz	BELWUKDDTNKLRV-PGRDOPGGSA-N	0	3	338.495	3.300	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3csc(C(C)C)n3)C2)C1	ZINC001040454418	1345508387	/nfs/dbraw/zinc/50/83/87/1345508387.db2.gz	UXFZLZOSTXRLPK-GOSISDBHSA-N	0	3	333.501	3.381	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cnn([C@@H](C)CC)c3C)C2)C1	ZINC001040493134	1345519109	/nfs/dbraw/zinc/51/91/09/1345519109.db2.gz	YYKZCGIZKRUXEH-JXFKEZNVSA-N	0	3	344.503	3.277	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3ccc4ccccc4n3)C2)C1	ZINC001040502897	1345523582	/nfs/dbraw/zinc/52/35/82/1345523582.db2.gz	QDCODNBQJXLOKD-NRFANRHFSA-N	0	3	335.451	3.349	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)C(C)(C)C(C)(F)F)C2)C1	ZINC001040513485	1345527375	/nfs/dbraw/zinc/52/73/75/1345527375.db2.gz	NBCKCJMIFDKYTL-GOSISDBHSA-N	0	3	326.431	3.006	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(F)cc3Cl)C2)C1	ZINC001040515940	1345528816	/nfs/dbraw/zinc/52/88/16/1345528816.db2.gz	QLMBBCILIQOIPY-LJQANCHMSA-N	0	3	348.849	3.431	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)CCc3cc(C)sc3C)C2)C1	ZINC001040546846	1345540965	/nfs/dbraw/zinc/54/09/65/1345540965.db2.gz	HIADLLDDZRHXOK-FQEVSTJZSA-N	0	3	344.524	3.245	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(CC)c(CC)c3)C2)C1	ZINC001040556980	1345545518	/nfs/dbraw/zinc/54/55/18/1345545518.db2.gz	ULNIXBBFOGVMBS-JOCHJYFZSA-N	0	3	338.495	3.373	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CCN(C(=O)c4ccc[nH]4)C3)CC2)c1	ZINC001040602653	1345554070	/nfs/dbraw/zinc/55/40/70/1345554070.db2.gz	LGPGLIBTHOXGBP-UHFFFAOYSA-N	0	3	348.450	3.015	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CCN(C(=O)C4=CCCC4)C3)CC2)c1	ZINC001040668518	1345563874	/nfs/dbraw/zinc/56/38/74/1345563874.db2.gz	AVFFDARGTTXVAH-UHFFFAOYSA-N	0	3	349.478	3.483	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cccc(C(C)C)n3)C2)CC1	ZINC001040760009	1345575911	/nfs/dbraw/zinc/57/59/11/1345575911.db2.gz	FWSAZINMFIUQRK-UHFFFAOYSA-N	0	3	339.483	3.156	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccc(CC)s3)C2)CC1	ZINC001040764106	1345576323	/nfs/dbraw/zinc/57/63/23/1345576323.db2.gz	UNIWCLADKCGMTA-UHFFFAOYSA-N	0	3	330.497	3.262	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)CCc3cccc(Cl)c3)C2)CC1	ZINC001040791504	1345578541	/nfs/dbraw/zinc/57/85/41/1345578541.db2.gz	NGMTWWYMNJKDBS-UHFFFAOYSA-N	0	3	344.886	3.220	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC2(C1)CCN(Cc1ccccn1)CC2	ZINC001040830843	1345583930	/nfs/dbraw/zinc/58/39/30/1345583930.db2.gz	OUEUHILNYJIARV-HXUWFJFHSA-N	0	3	341.499	3.498	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CCN(C(=O)[C@H]4CC45CC5)C3)CC2)c1	ZINC001040865008	1345589805	/nfs/dbraw/zinc/58/98/05/1345589805.db2.gz	NJUARGQSUKEPLH-LJQANCHMSA-N	0	3	349.478	3.173	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@@H](c3ccccc3)C(C)C)C2)CC1	ZINC001040870114	1345591306	/nfs/dbraw/zinc/59/13/06/1345591306.db2.gz	UJIYQGFXWMVVEM-HXUWFJFHSA-N	0	3	338.495	3.374	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cc(Cl)cs3)C2)CC1	ZINC001040875309	1345592556	/nfs/dbraw/zinc/59/25/56/1345592556.db2.gz	YBCBRUCLTHDAQM-UHFFFAOYSA-N	0	3	336.888	3.353	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N1CC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001041216869	1345679648	/nfs/dbraw/zinc/67/96/48/1345679648.db2.gz	XKLBCGYLRWNUHG-WIYYLYMNSA-N	0	3	337.467	3.029	20	30		EGEDHN
C[C@H](c1cccc(F)c1)N1CC[C@@]2(CCN(C(=O)C#CC3CC3)C2)C1	ZINC001041266710	1345690701	/nfs/dbraw/zinc/69/07/01/1345690701.db2.gz	VGOKSWZBBNHHRE-IIBYNOLFSA-N	0	3	340.442	3.225	20	30		EGEDHN
CC(C(=O)N1CC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1)=C1CCC1	ZINC001041275091	1345691719	/nfs/dbraw/zinc/69/17/19/1345691719.db2.gz	DCUQTQISQNVAPP-JOCHJYFZSA-N	0	3	349.478	3.483	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)CC3CC(c4ccccc4)C3)C2)C1	ZINC001041422736	1345724482	/nfs/dbraw/zinc/72/44/82/1345724482.db2.gz	PLNYLDCDJMUAQY-ZOGYUUGASA-N	0	3	336.479	3.128	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cc4ccccc4s3)C2)C1	ZINC001041447666	1345730121	/nfs/dbraw/zinc/73/01/21/1345730121.db2.gz	BZFJLJCMXNTALI-FQEVSTJZSA-N	0	3	338.476	3.463	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3occc3-c3ccccc3)C2)C1	ZINC001041453464	1345732351	/nfs/dbraw/zinc/73/23/51/1345732351.db2.gz	DZGXTZAOVPUTQZ-NRFANRHFSA-N	0	3	334.419	3.118	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@]2(CCN(Cc3ccc(C)nc3C)C2)C1	ZINC001041542537	1345757159	/nfs/dbraw/zinc/75/71/59/1345757159.db2.gz	DMZAQTKKULOBBH-OAQYLSRUSA-N	0	3	341.499	3.335	20	30		EGEDHN
CCC1(C(=O)N2CC[C@]3(CCN(Cc4ccc(C#N)cc4)C3)C2)CC1	ZINC001041643884	1345808929	/nfs/dbraw/zinc/80/89/29/1345808929.db2.gz	YSLRSDKZBCXPFY-FQEVSTJZSA-N	0	3	337.467	3.173	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)C34CCC(CC3)C4(C)C)C2)C1	ZINC001041728418	1345833738	/nfs/dbraw/zinc/83/37/38/1345833738.db2.gz	HWWSUVWFCKIUEE-SGDIKTSBSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)C(C)(C)c3ccccc3Cl)C2)C1	ZINC001041793318	1345852288	/nfs/dbraw/zinc/85/22/88/1345852288.db2.gz	JAXFQUFTBZHSAF-HXUWFJFHSA-N	0	3	344.886	3.175	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cc4cc(C)ccc4o3)C2)C1	ZINC001041844422	1345870961	/nfs/dbraw/zinc/87/09/61/1345870961.db2.gz	HTNQZWJCOITTKS-OAQYLSRUSA-N	0	3	336.435	3.303	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)C34CC(C(C)(C)C)(C3)C4)C2)C1	ZINC001041851605	1345873207	/nfs/dbraw/zinc/87/32/07/1345873207.db2.gz	JVJGDFPDFGGGAG-MWXLCCTBSA-N	0	3	328.500	3.151	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3CCN(C(=O)C4=CCCC4)C[C@@H]32)c1	ZINC001042010916	1345924251	/nfs/dbraw/zinc/92/42/51/1345924251.db2.gz	RWDJMXHTRZCONZ-ICSRJNTNSA-N	0	3	335.451	3.091	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(C(C)(C)C)cn3)C[C@@H]21	ZINC001042065078	1345933684	/nfs/dbraw/zinc/93/36/84/1345933684.db2.gz	OJWUYFFJXAWTFP-QAPCUYQASA-N	0	3	327.472	3.102	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(F)c(C(F)F)c3)C[C@H]21	ZINC001042065587	1345934618	/nfs/dbraw/zinc/93/46/18/1345934618.db2.gz	WMIHKNYHCXXZLR-MLGOLLRUSA-N	0	3	338.373	3.486	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cscc3C(F)F)C[C@H]21	ZINC001042065629	1345934641	/nfs/dbraw/zinc/93/46/41/1345934641.db2.gz	XHVACJPDFOUQBM-BXUZGUMPSA-N	0	3	326.412	3.408	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(C4CCCCC4)n[nH]3)C[C@H]21	ZINC001042099252	1345943571	/nfs/dbraw/zinc/94/35/71/1345943571.db2.gz	YXYSZYCBSCMLBK-QFBILLFUSA-N	0	3	342.487	3.180	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3cc(F)c(C)cc3F)C[C@@H]21	ZINC001042104047	1345945533	/nfs/dbraw/zinc/94/55/33/1345945533.db2.gz	ZWSRZBBEUFBOGA-KDOFPFPSSA-N	0	3	334.410	3.386	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3c(F)cc(C)cc3F)C[C@@H]21	ZINC001042146061	1345956864	/nfs/dbraw/zinc/95/68/64/1345956864.db2.gz	KVMFLCLSKQTUQR-PBHICJAKSA-N	0	3	334.410	3.386	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3cccnc3C)[C@H]2C1	ZINC001042183843	1345971255	/nfs/dbraw/zinc/97/12/55/1345971255.db2.gz	NXGKJKWVPDZZSS-HKUYNNGSSA-N	0	3	341.499	3.415	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3c(F)ccc(F)c3F)C[C@@H]21	ZINC001042207789	1345986534	/nfs/dbraw/zinc/98/65/34/1345986534.db2.gz	UHJQCLWHMQRQPW-WFASDCNBSA-N	0	3	338.373	3.216	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C(C)(C)c3cccc(F)c3)C[C@H]21	ZINC001042229674	1345997194	/nfs/dbraw/zinc/99/71/94/1345997194.db2.gz	HABLBEQSMYEWFW-CRAIPNDOSA-N	0	3	330.447	3.212	20	30		EGEDHN
C#CCN1CC[C@H]2CCN(C(=O)CC(C3CCC3)C3CCC3)C[C@@H]21	ZINC001042237061	1345999512	/nfs/dbraw/zinc/99/95/12/1345999512.db2.gz	FQFSNBQGDJVTOF-ICSRJNTNSA-N	0	3	328.500	3.149	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3c(F)ccc(F)c3Cl)C[C@@H]21	ZINC001042245632	1346002983	/nfs/dbraw/zinc/00/29/83/1346002983.db2.gz	RFIAHAROSVDYBN-FZMZJTMJSA-N	0	3	340.801	3.341	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3coc(C4CCCC4)n3)C[C@H]21	ZINC001042294613	1346020102	/nfs/dbraw/zinc/02/01/02/1346020102.db2.gz	ODJSZYZRNDSARS-CRAIPNDOSA-N	0	3	343.471	3.445	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cc(C)nc4ccccc43)C[C@H]21	ZINC001042339517	1346044285	/nfs/dbraw/zinc/04/42/85/1346044285.db2.gz	XUMXDYRGQLVYPC-DYESRHJHSA-N	0	3	347.462	3.103	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3csc4c3CCCC4)C[C@H]21	ZINC001042346293	1346048263	/nfs/dbraw/zinc/04/82/63/1346048263.db2.gz	RKUWFLQBJKBTND-RHSMWYFYSA-N	0	3	330.497	3.349	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3c[nH]cc3-c3ccccc3)C[C@@H]21	ZINC001042358756	1346053670	/nfs/dbraw/zinc/05/36/70/1346053670.db2.gz	USIXFCVXIUZIOV-NQIIRXRSSA-N	0	3	347.462	3.241	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3c[nH]cc3-c3ccccc3)C[C@@H]21	ZINC001042358757	1346053684	/nfs/dbraw/zinc/05/36/84/1346053684.db2.gz	USIXFCVXIUZIOV-RXVVDRJESA-N	0	3	347.462	3.241	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3c(Cl)cccc3OC)C[C@@H]21	ZINC001042369703	1346060363	/nfs/dbraw/zinc/06/03/63/1346060363.db2.gz	AAOJASGGLFBUGY-ZFWWWQNUSA-N	0	3	334.847	3.071	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)C1CCCC1	ZINC001044413170	1346321436	/nfs/dbraw/zinc/32/14/36/1346321436.db2.gz	NNRFRAZSXFZPIU-DNVCBOLYSA-N	0	3	325.456	3.218	20	30		EGEDHN
C[C@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)C1CC(F)(F)C1	ZINC001044545466	1346366465	/nfs/dbraw/zinc/36/64/65/1346366465.db2.gz	QGSGYHOAJWNQOO-GUYCJALGSA-N	0	3	347.409	3.073	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3snnc3C)C[C@@H]2C)CC1	ZINC001044729169	1346414046	/nfs/dbraw/zinc/41/40/46/1346414046.db2.gz	FOQPKZVPLWGELN-BBRMVZONSA-N	0	3	348.516	3.062	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3ocnc3C)C[C@@H]2C)CC1	ZINC001044732036	1346415380	/nfs/dbraw/zinc/41/53/80/1346415380.db2.gz	ZAVBQVZASWYNSF-YOEHRIQHSA-N	0	3	331.460	3.199	20	30		EGEDHN
C/C(=C\C(=O)N1CCC[C@H]1CNCc1ccc(C#N)s1)C1CC1	ZINC001044943459	1346467092	/nfs/dbraw/zinc/46/70/92/1346467092.db2.gz	NVHMKCCJLJZAKX-GLNPCMGASA-N	0	3	329.469	3.057	20	30		EGEDHN
C/C(=C/C(=O)N1CCC[C@H]1CNCc1ccc(C#N)s1)C1CC1	ZINC001044943456	1346467143	/nfs/dbraw/zinc/46/71/43/1346467143.db2.gz	NVHMKCCJLJZAKX-CTXBLAANSA-N	0	3	329.469	3.057	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC[C@H]1CNC1c2ccccc2-c2ccccc21	ZINC001044963225	1346471002	/nfs/dbraw/zinc/47/10/02/1346471002.db2.gz	YFFVHPGSUWIWLD-HOTGVXAUSA-N	0	3	345.446	3.497	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1CCC[C@H]1CNCc1ccc(C#N)cc1F	ZINC001045049511	1346486297	/nfs/dbraw/zinc/48/62/97/1346486297.db2.gz	OHLIUHLRNRMKSI-KRWDZBQOSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC[C@H]1CNCc1c(C)noc1C	ZINC001045052160	1346487337	/nfs/dbraw/zinc/48/73/37/1346487337.db2.gz	PVPPOBRLUNNWMN-AWEZNQCLSA-N	0	3	339.867	3.151	20	30		EGEDHN
CC1(NC(=O)[C@H]2CCC2(F)F)CCN(Cc2cccc(C#N)c2)CC1	ZINC001045475245	1346602538	/nfs/dbraw/zinc/60/25/38/1346602538.db2.gz	HHCDNXRWAVWAEW-MRXNPFEDSA-N	0	3	347.409	3.074	20	30		EGEDHN
C#Cc1ccc(C(=O)NC2(C)CCN(Cc3cccnc3C)CC2)cc1	ZINC001045520693	1346616101	/nfs/dbraw/zinc/61/61/01/1346616101.db2.gz	PXCPQSCEZWEFTP-UHFFFAOYSA-N	0	3	347.462	3.156	20	30		EGEDHN
CC1(NC(=O)[C@@H]2C[C@H]2C2CC2)CCN(Cc2cccc(C#N)c2)CC1	ZINC001045584528	1346637277	/nfs/dbraw/zinc/63/72/77/1346637277.db2.gz	FTYGDQPMTASOSH-RBUKOAKNSA-N	0	3	337.467	3.075	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc(F)cc1)C2	ZINC001045909086	1346746153	/nfs/dbraw/zinc/74/61/53/1346746153.db2.gz	MUOXOOSUNAFGFI-FQEVSTJZSA-N	0	3	328.431	3.167	20	30		EGEDHN
CC(C)C(=O)N1CCCC[C@@]2(CCN(Cc3ccc(C#N)s3)C2)C1	ZINC001045918503	1346755726	/nfs/dbraw/zinc/75/57/26/1346755726.db2.gz	KSEVRNDPNQYEKF-IBGZPJMESA-N	0	3	345.512	3.480	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)C[C@H]1CCC(F)(F)C1)C2	ZINC001045944284	1346780151	/nfs/dbraw/zinc/78/01/51/1346780151.db2.gz	JGUPVRQIGZUMIO-SJLPKXTDSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1[nH]ccc1C1CC1)C2	ZINC001045945605	1346781618	/nfs/dbraw/zinc/78/16/18/1346781618.db2.gz	ZFHSATXCNJECTA-OAQYLSRUSA-N	0	3	339.483	3.234	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1c(F)cc(C)cc1F)C2	ZINC001045953191	1346788054	/nfs/dbraw/zinc/78/80/54/1346788054.db2.gz	UTBVRZNEGKOCTA-FQEVSTJZSA-N	0	3	346.421	3.225	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@H]1CCCCC1(F)F)C2	ZINC001045954871	1346789865	/nfs/dbraw/zinc/78/98/65/1346789865.db2.gz	JOFZAOJHNGZZOC-SJLPKXTDSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H]1C[C@@H]3CCCC[C@H]13)C2	ZINC001045955112	1346790062	/nfs/dbraw/zinc/79/00/62/1346790062.db2.gz	OQIJVQFFICTRAA-HUUJSLGLSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1c(C)cc(F)cc1C)C2	ZINC001045956662	1346791099	/nfs/dbraw/zinc/79/10/99/1346791099.db2.gz	SACBFPLXMOUHPW-OAQYLSRUSA-N	0	3	342.458	3.394	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)C(C)(C)c1cccs1)C2	ZINC001045958415	1346793292	/nfs/dbraw/zinc/79/32/92/1346793292.db2.gz	RZWCSSQWYBNPCR-FQEVSTJZSA-N	0	3	344.524	3.364	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)C1CCC(F)(F)CC1)C2	ZINC001045969282	1346804929	/nfs/dbraw/zinc/80/49/29/1346804929.db2.gz	NIXQQYHWHFRXGH-GOSISDBHSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H](C)c1ccc(C)o1)C2	ZINC001045973310	1346809016	/nfs/dbraw/zinc/80/90/16/1346809016.db2.gz	OLYPAPKBPIHLBQ-RXVVDRJESA-N	0	3	342.483	3.419	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc3cccnc3c1)C2	ZINC001045973309	1346809171	/nfs/dbraw/zinc/80/91/71/1346809171.db2.gz	KQLZBFCFWBZEMS-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C[C@@]1(NC(=O)c2ccc(C#N)[nH]2)CCN(Cc2ccc(C3CC3)cc2)C1	ZINC001046247823	1346908488	/nfs/dbraw/zinc/90/84/88/1346908488.db2.gz	JRINKXUCROERTE-OAQYLSRUSA-N	0	3	348.450	3.158	20	30		EGEDHN
C[C@@]1(NC(=O)c2c[nH]c(C#N)c2)CCN(Cc2ccc(C3CC3)cc2)C1	ZINC001046253373	1346909734	/nfs/dbraw/zinc/90/97/34/1346909734.db2.gz	XEZKUJKRBCGPLN-OAQYLSRUSA-N	0	3	348.450	3.158	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2ccc(Cl)o2)C1	ZINC001046917353	1347152486	/nfs/dbraw/zinc/15/24/86/1347152486.db2.gz	OQTMRURUMCZSJJ-NSHDSACASA-N	0	3	332.778	3.196	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2cscc2C)C1	ZINC001046927080	1347155167	/nfs/dbraw/zinc/15/51/67/1347155167.db2.gz	SXIKOPRRXRPODZ-CYBMUJFWSA-N	0	3	328.428	3.320	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2c[nH]c3ccccc23)C1	ZINC001046954895	1347163754	/nfs/dbraw/zinc/16/37/54/1347163754.db2.gz	VFSUZJYUWBFDEB-CQSZACIVSA-N	0	3	347.409	3.431	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2cc(C(C)C)on2)C1	ZINC001046963008	1347167836	/nfs/dbraw/zinc/16/78/36/1347167836.db2.gz	QJDNTQNGOIMTSB-CYBMUJFWSA-N	0	3	341.402	3.061	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2cc(F)ccc2C)C1	ZINC001046964069	1347168448	/nfs/dbraw/zinc/16/84/48/1347168448.db2.gz	YZZRWPVDNJJREN-AWEZNQCLSA-N	0	3	340.389	3.397	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3cc[nH]c3CCC)C2)CC1	ZINC001047248933	1347273644	/nfs/dbraw/zinc/27/36/44/1347273644.db2.gz	PSONBJZCWWXNDX-SFHVURJKSA-N	0	3	341.499	3.165	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3c(C)oc(C)c3C)C2)CC1	ZINC001047250911	1347275154	/nfs/dbraw/zinc/27/51/54/1347275154.db2.gz	LACTWPWZMVRMOU-LJQANCHMSA-N	0	3	342.483	3.402	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3c[nH]cc3C3CC3)C2)CC1	ZINC001047261964	1347283422	/nfs/dbraw/zinc/28/34/22/1347283422.db2.gz	KRXAAOPXRPPVCC-SFHVURJKSA-N	0	3	339.483	3.090	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)/C=C/c2ccco2)C1	ZINC001047689774	1347332462	/nfs/dbraw/zinc/33/24/62/1347332462.db2.gz	BNMFZGZLOHHZSS-WRKUDEPPSA-N	0	3	349.434	3.191	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@H]([C@@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001047791341	1347373290	/nfs/dbraw/zinc/37/32/90/1347373290.db2.gz	URQSTSWVOIGUCI-HIFRSBDPSA-N	0	3	347.409	3.287	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)Cc2ccccc2)C1	ZINC001047883472	1347398728	/nfs/dbraw/zinc/39/87/28/1347398728.db2.gz	AMMJKNNFYZMQSM-UWJYYQICSA-N	0	3	347.462	3.128	20	30		EGEDHN
C[C@H](NCc1cc(F)ccc1C#N)[C@H]1CCN(C(=O)CC2(C)CC2)C1	ZINC001047908021	1347405323	/nfs/dbraw/zinc/40/53/23/1347405323.db2.gz	HPHVIYRRAQZJJF-HOCLYGCPSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)CC2(C)CC2)C1	ZINC001047909872	1347406175	/nfs/dbraw/zinc/40/61/75/1347406175.db2.gz	ONOBAOMLVXZNHY-CRAIPNDOSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]([C@H](C)NCc2cc(C3CC3)no2)C1	ZINC001047924104	1347411353	/nfs/dbraw/zinc/41/13/53/1347411353.db2.gz	LLXOEHZARAEZAG-GOEBONIOSA-N	0	3	345.487	3.481	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]([C@@H](C)NCc2ncc(C)s2)C1	ZINC001047928867	1347413237	/nfs/dbraw/zinc/41/32/37/1347413237.db2.gz	OVOKTADZEZTFFC-CABCVRRESA-N	0	3	335.517	3.380	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2CCC2)C[C@H]1CNCc1cc(F)ccc1C#N	ZINC001048191261	1347488776	/nfs/dbraw/zinc/48/87/76/1347488776.db2.gz	BWCXNLZKGJGDKB-RDTXWAMCSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](CNCc3ccccc3C#N)[C@H](C)C2)C1	ZINC001048372571	1347533945	/nfs/dbraw/zinc/53/39/45/1347533945.db2.gz	ABOPUPXAGIJWQD-VQIMIIECSA-N	0	3	337.467	3.099	20	30		EGEDHN
N#Cc1ccccc1CN1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)C1CCC1)C2	ZINC001048494237	1347565952	/nfs/dbraw/zinc/56/59/52/1347565952.db2.gz	ADRYYOLZDWGXFA-VVNNIFPWSA-N	0	3	337.467	3.218	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)[C@H]2CCC2(C)C)CC1	ZINC001048626212	1347624534	/nfs/dbraw/zinc/62/45/34/1347624534.db2.gz	FHIVYOHTJIMWDN-LJQANCHMSA-N	0	3	341.499	3.497	20	30		EGEDHN
Cc1ccccc1C(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@H]2C1	ZINC001048653686	1347632524	/nfs/dbraw/zinc/63/25/24/1347632524.db2.gz	OJSHHLKXLUUAIX-BGYRXZFFSA-N	0	3	345.446	3.071	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CN(Cc3cccc(F)c3)C[C@H]2C1	ZINC001049034621	1347711666	/nfs/dbraw/zinc/71/16/66/1347711666.db2.gz	GYUCEGRVVQZIJP-FUHIMQAGSA-N	0	3	330.447	3.318	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)CC2CCC2)c1	ZINC001049392376	1347817332	/nfs/dbraw/zinc/81/73/32/1347817332.db2.gz	YVVRJPAWYIRFAH-VQTJNVASSA-N	0	3	337.467	3.314	20	30		EGEDHN
Cc1[nH]ccc1C(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1cccc(C#N)c1	ZINC001049405695	1347828112	/nfs/dbraw/zinc/82/81/12/1347828112.db2.gz	ISJHDXFRGJKWDY-UXHICEINSA-N	0	3	348.450	3.074	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@@H]2[C@@H]1CCN2Cc1cc2ccccc2o1	ZINC001049466175	1347861973	/nfs/dbraw/zinc/86/19/73/1347861973.db2.gz	BQPFKCOTDBJLDY-UXHICEINSA-N	0	3	348.446	3.412	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@@H]2[C@H]1CCN2C/C=C\c1ccccc1	ZINC001049469993	1347864405	/nfs/dbraw/zinc/86/44/05/1347864405.db2.gz	FPHJPARYGPQPHQ-VEZITOEXSA-N	0	3	334.463	3.179	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H]1CC[C@H](c2ccccc2)O1	ZINC001049480800	1347870105	/nfs/dbraw/zinc/87/01/05/1347870105.db2.gz	QJYBYBHSYSQAHG-NMLBUPMWSA-N	0	3	340.467	3.158	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cccc2c1CCCC2	ZINC001049496760	1347877646	/nfs/dbraw/zinc/87/76/46/1347877646.db2.gz	CXDQHWYJLWXSTH-LEWJYISDSA-N	0	3	336.479	3.268	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccnc(-c2ccco2)c1	ZINC001049544701	1347900307	/nfs/dbraw/zinc/90/03/07/1347900307.db2.gz	OOTZKTOFLDXFQR-ROUUACIJSA-N	0	3	337.423	3.207	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1ccc(C)cc1Cl	ZINC001049554928	1347907276	/nfs/dbraw/zinc/90/72/76/1347907276.db2.gz	IPNWNSAOECLGLJ-RTBURBONSA-N	0	3	344.886	3.280	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cnoc1-c1ccco1	ZINC001049556886	1347907801	/nfs/dbraw/zinc/90/78/01/1347907801.db2.gz	CRLSNSGXZJWKAQ-HOTGVXAUSA-N	0	3	341.411	3.190	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(COC)cs1	ZINC001049572226	1347915868	/nfs/dbraw/zinc/91/58/68/1347915868.db2.gz	JVOZPIVJSYURFC-HOTGVXAUSA-N	0	3	334.485	3.150	20	30		EGEDHN
C=CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ncc(Cl)s1	ZINC001049588934	1347924918	/nfs/dbraw/zinc/92/49/18/1347924918.db2.gz	INZJYSOEWHUUCW-RYUDHWBXSA-N	0	3	325.865	3.052	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](c1ccccc1)C1CC1	ZINC001049594133	1347927635	/nfs/dbraw/zinc/92/76/35/1347927635.db2.gz	PHYIQDYOJPKMEF-HBMCJLEFSA-N	0	3	336.479	3.269	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1cnccc1C	ZINC001049635679	1347946378	/nfs/dbraw/zinc/94/63/78/1347946378.db2.gz	MAVGVDZKDGWULN-QZTJIDSGSA-N	0	3	327.472	3.168	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1nsc2ccc(C)cc21	ZINC001049640532	1347949039	/nfs/dbraw/zinc/94/90/39/1347949039.db2.gz	VZYOYNZYUQNKIG-HOTGVXAUSA-N	0	3	341.480	3.470	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]2[C@@H]1CCN2CCc1csc(C)n1	ZINC001049643093	1347950857	/nfs/dbraw/zinc/95/08/57/1347950857.db2.gz	CPFTVDSJFMQUIX-IRXDYDNUSA-N	0	3	347.528	3.272	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(F)c(F)c1F	ZINC001049676794	1347967934	/nfs/dbraw/zinc/96/79/34/1347967934.db2.gz	QPONQJKBPBJEMN-GJZGRUSLSA-N	0	3	338.373	3.359	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)C1(c2cccnc2)CCCC1	ZINC001049680902	1347969852	/nfs/dbraw/zinc/96/98/52/1347969852.db2.gz	UBPIIRQBNOFGDS-OALUTQOASA-N	0	3	339.483	3.145	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1c(C)cc(C)cc1C	ZINC001049691863	1347974418	/nfs/dbraw/zinc/97/44/18/1347974418.db2.gz	CDKSQXHJOQVURY-RTWAWAEBSA-N	0	3	338.495	3.243	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]3[C@@H]2CCN3Cc2cccc(C#N)c2)C1	ZINC001049708172	1347984783	/nfs/dbraw/zinc/98/47/83/1347984783.db2.gz	OQFYQNTYBOOVIQ-UXHICEINSA-N	0	3	349.478	3.480	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1oc(C2CC2)nc1C	ZINC001049773990	1348015110	/nfs/dbraw/zinc/01/51/10/1348015110.db2.gz	ULCCHRGQHZYXNL-JKSUJKDBSA-N	0	3	329.444	3.115	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](C)c1ccc(CC)cc1	ZINC001049789522	1348023419	/nfs/dbraw/zinc/02/34/19/1348023419.db2.gz	ASKDQCXBWFLMMH-DZFGPLHGSA-N	0	3	338.495	3.441	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ncc(Cl)cc1Cl	ZINC001049807108	1348029463	/nfs/dbraw/zinc/02/94/63/1348029463.db2.gz	RDLZAVAZNNASFX-UONOGXRCSA-N	0	3	340.254	3.253	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1cccc(OC(C)C)n1	ZINC001049827790	1348043425	/nfs/dbraw/zinc/04/34/25/1348043425.db2.gz	LYLGMNXFWHYSJA-MSOLQXFVSA-N	0	3	343.471	3.124	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cnn(C2CCCC2)c1C	ZINC001049837472	1348050426	/nfs/dbraw/zinc/05/04/26/1348050426.db2.gz	PRYGOWGNCRJFNH-MOPGFXCFSA-N	0	3	342.487	3.172	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)C1CCC(C2CC2)CC1	ZINC001049869604	1348075597	/nfs/dbraw/zinc/07/55/97/1348075597.db2.gz	IJUOQDBVAAUGJH-GUMHCPJTSA-N	0	3	328.500	3.291	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(C)nc2ccccc21	ZINC001049869492	1348075712	/nfs/dbraw/zinc/07/57/12/1348075712.db2.gz	CENQPSDHRUETME-LEWJYISDSA-N	0	3	347.462	3.245	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc2c(c1)CCCC2	ZINC001049878827	1348083591	/nfs/dbraw/zinc/08/35/91/1348083591.db2.gz	VQKPPTODMUKNTB-SFTDATJTSA-N	0	3	336.479	3.268	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(Cl)ccc1OC	ZINC001049878394	1348083863	/nfs/dbraw/zinc/08/38/63/1348083863.db2.gz	TUTFQNCGKJDDQV-JKSUJKDBSA-N	0	3	334.847	3.214	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C[C@@H](C)c1ccc(F)cc1	ZINC001049913348	1348108202	/nfs/dbraw/zinc/10/82/02/1348108202.db2.gz	WFQQUZXLLNDMKM-LSTHTHJFSA-N	0	3	342.458	3.408	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1c[nH]c2c1cccc2CC	ZINC001049921708	1348113765	/nfs/dbraw/zinc/11/37/65/1348113765.db2.gz	XRIYIJQQHOCJHG-PMACEKPBSA-N	0	3	349.478	3.433	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1csc(C2CC2)n1	ZINC001049928450	1348118615	/nfs/dbraw/zinc/11/86/15/1348118615.db2.gz	SGXUJRLFKFFFOL-HOTGVXAUSA-N	0	3	331.485	3.276	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CCCN(C(=O)C4CCCC4)[C@@H]3C2)c1	ZINC001049946596	1348127223	/nfs/dbraw/zinc/12/72/23/1348127223.db2.gz	QRPZCIGAEFTSPG-VQTJNVASSA-N	0	3	337.467	3.171	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3CCCN(C(=O)C[C@@H]4C=CCC4)[C@@H]3C2)cc1	ZINC001049965359	1348136801	/nfs/dbraw/zinc/13/68/01/1348136801.db2.gz	LSKPVHHHGYWZMB-JRGCBEDISA-N	0	3	349.478	3.337	20	30		EGEDHN
CC(C)(C)CC(=O)N1CCC[C@H]2CN(Cc3cccc(C#N)c3)C[C@H]21	ZINC001049974041	1348140788	/nfs/dbraw/zinc/14/07/88/1348140788.db2.gz	WFLLWCVSFXCUOV-RBUKOAKNSA-N	0	3	339.483	3.417	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@H]2CN(Cc3cc4ccccc4o3)C[C@H]21	ZINC001050000367	1348148655	/nfs/dbraw/zinc/14/86/55/1348148655.db2.gz	VNHHNTWJTKEUQR-UWWQBHOKSA-N	0	3	337.423	3.015	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N1CCC[C@H]2CN(Cc3cccc(C#N)c3)C[C@H]21	ZINC001050023852	1348159025	/nfs/dbraw/zinc/15/90/25/1348159025.db2.gz	XHFJLXPGSWIWGS-GBESFXJTSA-N	0	3	337.467	3.027	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cccc(C(F)F)c3F)[C@@H]2C1	ZINC001050048238	1348165177	/nfs/dbraw/zinc/16/51/77/1348165177.db2.gz	MJYLIOUUHCONGL-SWLSCSKDSA-N	0	3	338.373	3.486	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)[C@@H]3CCCc4ccccc43)[C@@H]2C1	ZINC001050077267	1348174856	/nfs/dbraw/zinc/17/48/56/1348174856.db2.gz	POYSIBFGEINQPI-CEWLAPEOSA-N	0	3	336.479	3.053	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)Cc3cccc(C(C)C)c3)[C@@H]2C1	ZINC001050085503	1348177549	/nfs/dbraw/zinc/17/75/49/1348177549.db2.gz	GCCIIFGDMOLNJH-VQTJNVASSA-N	0	3	326.484	3.461	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3ccc(C4CC4)nc3C)[C@@H]2C1	ZINC001050143263	1348194630	/nfs/dbraw/zinc/19/46/30/1348194630.db2.gz	QBCWNVQZTZNPCS-FXAWDEMLSA-N	0	3	339.483	3.380	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cscc3C(F)F)C2)CC1	ZINC001050519702	1348282951	/nfs/dbraw/zinc/28/29/51/1348282951.db2.gz	XRRQTBGLXLDELE-UHFFFAOYSA-N	0	3	338.423	3.247	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3cc(C)c(Cl)cc3C)C2)CC1	ZINC001050618913	1348304725	/nfs/dbraw/zinc/30/47/25/1348304725.db2.gz	XFSNHHZUDBPSFE-UHFFFAOYSA-N	0	3	330.859	3.128	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1ncccc1C)CC2	ZINC001050645572	1348314031	/nfs/dbraw/zinc/31/40/31/1348314031.db2.gz	QYQUVTLWSVZGRX-FQEVSTJZSA-N	0	3	341.499	3.417	20	30		EGEDHN
C[C@H]1C[C@@H]1CC(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001050647818	1348315463	/nfs/dbraw/zinc/31/54/63/1348315463.db2.gz	SBQVCWJEUHFCCR-QFBILLFUSA-N	0	3	337.467	3.029	20	30		EGEDHN
CCC1(C(=O)N2CC3(C2)CCN(Cc2cccc(C#N)c2)CC3)CC1	ZINC001050649776	1348316338	/nfs/dbraw/zinc/31/63/38/1348316338.db2.gz	XEWAVYZHAVCMLE-UHFFFAOYSA-N	0	3	337.467	3.173	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc(Cl)c(F)c3)C2)CC1	ZINC001050676674	1348323445	/nfs/dbraw/zinc/32/34/45/1348323445.db2.gz	CHODEKKYZMRCBI-UHFFFAOYSA-N	0	3	334.822	3.040	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001050685081	1348326303	/nfs/dbraw/zinc/32/63/03/1348326303.db2.gz	WYJDUVBNOBTTDU-QGZVFWFLSA-N	0	3	339.483	3.275	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3cccc(Cl)c3Cl)C2)CC1	ZINC001050738331	1348343789	/nfs/dbraw/zinc/34/37/89/1348343789.db2.gz	VXGMVEODCYENKJ-UHFFFAOYSA-N	0	3	337.250	3.165	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc4[nH]c(C)c(C)c4c3)C2)CC1	ZINC001050751917	1348348514	/nfs/dbraw/zinc/34/85/14/1348348514.db2.gz	GREFJLKZSPMRNM-UHFFFAOYSA-N	0	3	349.478	3.346	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3c[nH]c4ccc(C)cc34)C2)CC1	ZINC001050767865	1348353574	/nfs/dbraw/zinc/35/35/74/1348353574.db2.gz	MFBRUPUZKBBCMN-UHFFFAOYSA-N	0	3	335.451	3.038	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3cnc(C)s3)cccc2C1	ZINC001051284000	1348417419	/nfs/dbraw/zinc/41/74/19/1348417419.db2.gz	VOANAPQRTMPMJD-UHFFFAOYSA-N	0	3	341.480	3.316	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3cc(C)sn3)cccc2C1	ZINC001051284691	1348417790	/nfs/dbraw/zinc/41/77/90/1348417790.db2.gz	BKBYMVFTVYDUOF-UHFFFAOYSA-N	0	3	341.480	3.316	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)[C@@H]3CC[C@@H](CC)O3)cccc2C1	ZINC001051290618	1348420425	/nfs/dbraw/zinc/42/04/25/1348420425.db2.gz	ZFWOAFMZVDDNQZ-QUCCMNQESA-N	0	3	342.483	3.195	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3cc(C)cc(C)n3)cccc2C1	ZINC001051291827	1348421266	/nfs/dbraw/zinc/42/12/66/1348421266.db2.gz	BHEQVFKXBGUMHH-UHFFFAOYSA-N	0	3	347.462	3.010	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H](NC(=O)c3cccs3)CC2)cc1	ZINC001052172234	1348509301	/nfs/dbraw/zinc/50/93/01/1348509301.db2.gz	YJOHWQQUNCDUBJ-KRWDZBQOSA-N	0	3	339.464	3.404	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cccc(C(F)F)c2F)CC1	ZINC001052387059	1348537868	/nfs/dbraw/zinc/53/78/68/1348537868.db2.gz	WJUVMCPQQVWNET-ZDUSSCGKSA-N	0	3	338.373	3.371	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cc(C3CCCCC3)n[nH]2)CC1	ZINC001052453395	1348545314	/nfs/dbraw/zinc/54/53/14/1348545314.db2.gz	OKULRUUPFUQTLG-QGZVFWFLSA-N	0	3	342.487	3.065	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)Cc2c(C)cc(C)cc2C)CC1	ZINC001052676674	1348625784	/nfs/dbraw/zinc/62/57/84/1348625784.db2.gz	JADFWOSKSFMHGA-IBGZPJMESA-N	0	3	326.484	3.148	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N[C@@H]1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC001052728665	1348650293	/nfs/dbraw/zinc/65/02/93/1348650293.db2.gz	MJLRQDOVRRVVCD-GUDVDZBRSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(C)c(C)c2)CC1	ZINC001052777448	1348675397	/nfs/dbraw/zinc/67/53/97/1348675397.db2.gz	CODCCOXJPXWYKH-PCCBWWKXSA-N	0	3	338.495	3.401	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2)CC1	ZINC001052784252	1348677889	/nfs/dbraw/zinc/67/78/89/1348677889.db2.gz	OLMLOYDVMXLKBU-OKZBNKHCSA-N	0	3	330.859	3.047	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@]2(C)CCCc3ccccc32)CC1	ZINC001052795807	1348683219	/nfs/dbraw/zinc/68/32/19/1348683219.db2.gz	NLEHDSHUGXEDHQ-DENIHFKCSA-N	0	3	338.495	3.275	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2csc3c2CC[C@H](C)C3)CC1	ZINC001052911891	1348744603	/nfs/dbraw/zinc/74/46/03/1348744603.db2.gz	PYUHOOYAIJSOQR-LSDHHAIUSA-N	0	3	330.497	3.090	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cccc(OCC(C)C)c2)CC1	ZINC001052920962	1348749128	/nfs/dbraw/zinc/74/91/28/1348749128.db2.gz	GAGZENZLHQGLSK-IBGZPJMESA-N	0	3	342.483	3.329	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc(-c3ccccc3)[nH]2)CC1	ZINC001052973040	1348781316	/nfs/dbraw/zinc/78/13/16/1348781316.db2.gz	ZMEYTMDBAMSNGF-SFHVURJKSA-N	0	3	335.451	3.289	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2cc3cccc(Cl)c3o2)CC1	ZINC001052983326	1348787534	/nfs/dbraw/zinc/78/75/34/1348787534.db2.gz	JCYYLDFPVKOSMF-AWEZNQCLSA-N	0	3	330.815	3.304	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cc(Cl)c[nH]2)C1	ZINC001053066567	1348879400	/nfs/dbraw/zinc/87/94/00/1348879400.db2.gz	AZPYKXYGLDYPHK-MAUKXSAKSA-N	0	3	347.890	3.398	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)CCc2ccco2)C1	ZINC001053067780	1348881438	/nfs/dbraw/zinc/88/14/38/1348881438.db2.gz	JEHTVOWXDBGZIF-AZUAARDMSA-N	0	3	342.483	3.329	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2oc(C)cc2C)C1	ZINC001053075981	1348894820	/nfs/dbraw/zinc/89/48/20/1348894820.db2.gz	KNDGWEGWVZHBBC-ZWKOTPCHSA-N	0	3	328.456	3.236	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccoc2Cl)C1	ZINC001053082114	1348903354	/nfs/dbraw/zinc/90/33/54/1348903354.db2.gz	ZBLFRROOXBYLHQ-ZBFHGGJFSA-N	0	3	334.847	3.273	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cc[nH]c2CC)C1	ZINC001053083342	1348903969	/nfs/dbraw/zinc/90/39/69/1348903969.db2.gz	KEXWEWHZUKJXPN-YLJYHZDGSA-N	0	3	341.499	3.307	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccoc2CC)C1	ZINC001053085353	1348907558	/nfs/dbraw/zinc/90/75/58/1348907558.db2.gz	FMNNIOKLNYLXNE-AEFFLSMTSA-N	0	3	328.456	3.182	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)C2(F)CCCC2)C1	ZINC001053087534	1348911381	/nfs/dbraw/zinc/91/13/81/1348911381.db2.gz	LVCDIPKXUTYWOZ-ZWKOTPCHSA-N	0	3	334.479	3.385	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)C2(F)CCCC2)C1	ZINC001053087528	1348911541	/nfs/dbraw/zinc/91/15/41/1348911541.db2.gz	LVCDIPKXUTYWOZ-MSOLQXFVSA-N	0	3	334.479	3.385	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)CCc2ccsc2)C1	ZINC001053088680	1348913981	/nfs/dbraw/zinc/91/39/81/1348913981.db2.gz	ZECZHWOKSUMCCT-MOPGFXCFSA-N	0	3	344.524	3.407	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)Cc2ccc(C)s2)C1	ZINC001053103863	1348938202	/nfs/dbraw/zinc/93/82/02/1348938202.db2.gz	AMTGAIYRDIEAMK-PKOBYXMFSA-N	0	3	344.524	3.325	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)CCc2ccccc2)C1	ZINC001053104140	1348939170	/nfs/dbraw/zinc/93/91/70/1348939170.db2.gz	COWGGYCQRJZMIU-SFTDATJTSA-N	0	3	338.495	3.346	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2sc(C)nc2C)C1	ZINC001053104189	1348939290	/nfs/dbraw/zinc/93/92/90/1348939290.db2.gz	CSNHHSOXQZCXDZ-IRXDYDNUSA-N	0	3	345.512	3.100	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(F)cc(F)c2)C1	ZINC001053106609	1348944574	/nfs/dbraw/zinc/94/45/74/1348944574.db2.gz	UWESKCJEYTUATR-BEFAXECRSA-N	0	3	346.421	3.305	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)[C@H]2[C@H]3[C@@H]2[C@@H]2CC[C@H]3C2)C1	ZINC001053107907	1348947523	/nfs/dbraw/zinc/94/75/23/1348947523.db2.gz	NBPPUTAWWQEALD-WZGFBNHNSA-N	0	3	340.511	3.005	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cnc3ccccc3c1C)C2	ZINC001054165976	1349168895	/nfs/dbraw/zinc/16/88/95/1349168895.db2.gz	RPQIGSKEFMXILU-JOCHJYFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@H]1CC[C@@H]3C[C@@H]3CC1)C2	ZINC001054168847	1349170309	/nfs/dbraw/zinc/17/03/09/1349170309.db2.gz	JGRLTPGKDRVAEX-JTJHWIPRSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H]1C[C@@H]3CCCC[C@H]13)C2	ZINC001054169010	1349170645	/nfs/dbraw/zinc/17/06/45/1349170645.db2.gz	OCALQMAUDZEGAW-CTAFRAEOSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1c(C)cc(F)cc1C)C2	ZINC001054174470	1349175077	/nfs/dbraw/zinc/17/50/77/1349175077.db2.gz	QTHPZYQPMHWAIX-FQEVSTJZSA-N	0	3	328.431	3.004	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)Cc1cc(C)ccc1C)C2	ZINC001054190227	1349192210	/nfs/dbraw/zinc/19/22/10/1349192210.db2.gz	FDKIWQRUBVEIJD-QFIPXVFZSA-N	0	3	338.495	3.184	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(Cl)c(F)c1)C2	ZINC001054204026	1349205414	/nfs/dbraw/zinc/20/54/14/1349205414.db2.gz	ZBCPTUOMFOZZTO-LJQANCHMSA-N	0	3	348.849	3.431	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H](C)c1cccc(C)c1)C2	ZINC001054206467	1349209082	/nfs/dbraw/zinc/20/90/82/1349209082.db2.gz	JCUJUCJQYLHYHX-SIKLNZKXSA-N	0	3	338.495	3.436	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H](C)c1ccc(C)s1)C2	ZINC001054226910	1349220769	/nfs/dbraw/zinc/22/07/69/1349220769.db2.gz	GEPDEOYEWMYGKV-LPHOPBHVSA-N	0	3	330.497	3.108	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc(C)c(C)s1)C2	ZINC001054237844	1349232024	/nfs/dbraw/zinc/23/20/24/1349232024.db2.gz	FCXQEEMDMGQBLL-LJQANCHMSA-N	0	3	330.497	3.316	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3ccnc(F)c3)cc2C1	ZINC001054258707	1349254775	/nfs/dbraw/zinc/25/47/75/1349254775.db2.gz	YOKKZYQCQVCRJK-UHFFFAOYSA-N	0	3	325.387	3.042	20	30		EGEDHN
CC(C)CCN1Cc2ccc(CNC(=O)c3ccc(C#N)[nH]3)cc2C1	ZINC001054261384	1349259118	/nfs/dbraw/zinc/25/91/18/1349259118.db2.gz	APYVSKOAGNJYIA-UHFFFAOYSA-N	0	3	336.439	3.178	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3ccnn3CCC)cc2C1	ZINC001054267156	1349263436	/nfs/dbraw/zinc/26/34/36/1349263436.db2.gz	DFQFONZAPBFEOV-UHFFFAOYSA-N	0	3	338.455	3.115	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@@H]3CC[C@@H](CC)O3)cc2C1	ZINC001054267492	1349264625	/nfs/dbraw/zinc/26/46/25/1349264625.db2.gz	XMRBZKUGEAYQJO-MOPGFXCFSA-N	0	3	328.456	3.152	20	30		EGEDHN
C=CCN1Cc2ccc(CNC(=O)c3[nH]nc(CC)c3Cl)cc2C1	ZINC001054268121	1349266132	/nfs/dbraw/zinc/26/61/32/1349266132.db2.gz	RHRSKWQUBKPUDX-UHFFFAOYSA-N	0	3	344.846	3.057	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3nc(CC)oc3C)cc2C1	ZINC001054285063	1349286678	/nfs/dbraw/zinc/28/66/78/1349286678.db2.gz	RDPZVYFRHWCRCF-UHFFFAOYSA-N	0	3	339.439	3.367	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3ccc4nccn4c3)cc2C1	ZINC001054288795	1349291979	/nfs/dbraw/zinc/29/19/79/1349291979.db2.gz	JQLKZOOBTAKHED-UHFFFAOYSA-N	0	3	346.434	3.156	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@H]3CCCC[C@@H]3OC)cc2C1	ZINC001054293277	1349300009	/nfs/dbraw/zinc/30/00/09/1349300009.db2.gz	ZCBSREZVNVURRB-PMACEKPBSA-N	0	3	342.483	3.400	20	30		EGEDHN
C[C@@H]1CN(C(=O)C=C2CCCCC2)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054447485	1349362344	/nfs/dbraw/zinc/36/23/44/1349362344.db2.gz	GNJFVPNCCCBISP-KDOFPFPSSA-N	0	3	343.496	3.447	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@@H](C)CC(F)(F)F)CC1	ZINC001166964994	1383505987	/nfs/dbraw/zinc/50/59/87/1383505987.db2.gz	JHXJDKYUUWWKAJ-JTQLQIEISA-N	0	3	326.790	3.204	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3csc(CC(C)C)n3)[C@@H]2C1	ZINC001084865587	1358334947	/nfs/dbraw/zinc/33/49/47/1358334947.db2.gz	FLWSVYYGFAXOMQ-GDBMZVCRSA-N	0	3	333.501	3.064	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)c2occc2C(C)C)C1	ZINC001070421459	1354343584	/nfs/dbraw/zinc/34/35/84/1354343584.db2.gz	KYCIRTFVKDBOKP-AWEZNQCLSA-N	0	3	342.443	3.031	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C1CCCCCC1)C[C@H](C)O2	ZINC001071142818	1354475285	/nfs/dbraw/zinc/47/52/85/1354475285.db2.gz	UZHHDHBTMSNXMO-FXAWDEMLSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C1=CCCCCC1)C[C@H](C)O2	ZINC001071161298	1354482643	/nfs/dbraw/zinc/48/26/43/1354482643.db2.gz	IADILRHCHZAYMW-FXAWDEMLSA-N	0	3	332.488	3.145	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)CC1(C)CCCC1)C[C@H](C)O2	ZINC001071164121	1354484509	/nfs/dbraw/zinc/48/45/09/1354484509.db2.gz	HMQPXAUIRKOYPQ-FXAWDEMLSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1ccoc1CCC)C[C@@H](C)O2	ZINC001071228444	1354514288	/nfs/dbraw/zinc/51/42/88/1354514288.db2.gz	UUZNPBGEZNAJGQ-OXQOHEQNSA-N	0	3	346.471	3.114	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)[C@H]1CC[C@H](CC)CC1)C[C@H](C)O2	ZINC001071233301	1354516961	/nfs/dbraw/zinc/51/69/61/1354516961.db2.gz	GYGDYIDUCDNOAH-IWFBPKFRSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C2(c3ccc(F)cc3)CC2)CC[C@@H]1C	ZINC001071543984	1354757019	/nfs/dbraw/zinc/75/70/19/1354757019.db2.gz	QXVGTMXGUBCCDO-MAUKXSAKSA-N	0	3	330.447	3.403	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2c(C)noc2C(F)F)CC[C@H]1C	ZINC001071601466	1354788573	/nfs/dbraw/zinc/78/85/73/1354788573.db2.gz	AGNOINFAELOSHC-ZYHUDNBSSA-N	0	3	327.375	3.079	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2cc(C)c(Cl)cn2)CC[C@H]1C	ZINC001071601774	1354789106	/nfs/dbraw/zinc/78/91/06/1354789106.db2.gz	DSFGTSRKULIKFN-HUUCEWRRSA-N	0	3	335.879	3.131	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2cccc3cnccc32)CC[C@H]1C	ZINC001071609045	1354794226	/nfs/dbraw/zinc/79/42/26/1354794226.db2.gz	GLULCHSLAPJZCH-APWZRJJASA-N	0	3	337.467	3.323	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cccc3c(C)c(C)[nH]c32)CC[C@@H]1C	ZINC001071612613	1354797346	/nfs/dbraw/zinc/79/73/46/1354797346.db2.gz	KZFPBNODPWJYPC-WMLDXEAASA-N	0	3	337.467	3.391	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2scnc2C(F)F)CC[C@@H]1C	ZINC001071675730	1354843914	/nfs/dbraw/zinc/84/39/14/1354843914.db2.gz	GSUOVIDVTMTSLX-WDEREUQCSA-N	0	3	329.416	3.240	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)c2ccc(F)c3ccncc23)CC[C@@H]1C	ZINC001071759387	1354907513	/nfs/dbraw/zinc/90/75/13/1354907513.db2.gz	HDPUMJILBYKQAR-KBPBESRZSA-N	0	3	327.403	3.143	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C2(c3cccnc3)CCCC2)CC[C@H]1C	ZINC001071773165	1354921076	/nfs/dbraw/zinc/92/10/76/1354921076.db2.gz	XGRXHKVMPPNLSN-MJGOQNOKSA-N	0	3	341.499	3.439	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(F)c(COC)c2)CC[C@@H]1C	ZINC001071820054	1354961231	/nfs/dbraw/zinc/96/12/31/1354961231.db2.gz	ZJNHJRSKDARXLT-YOEHRIQHSA-N	0	3	334.435	3.131	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C2(c3cccc(F)c3)CC2)CC[C@@H]1C	ZINC001071855490	1354983857	/nfs/dbraw/zinc/98/38/57/1354983857.db2.gz	QJUSSUQQLYIGSF-YJBOKZPZSA-N	0	3	330.447	3.403	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2csc(C3CC3)n2)CC[C@H]1C	ZINC001071879456	1355002406	/nfs/dbraw/zinc/00/24/06/1355002406.db2.gz	CZSYRUJHQUPOIW-HIFRSBDPSA-N	0	3	333.501	3.108	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cn2cc(C)c3ccccc32)CC[C@@H]1C	ZINC001071883358	1355004791	/nfs/dbraw/zinc/00/47/91/1355004791.db2.gz	JYWOHCQKAMHGQZ-ZWKOTPCHSA-N	0	3	339.483	3.495	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc(C)cc3c[nH]nc32)CC[C@H]1C	ZINC001071890194	1355008365	/nfs/dbraw/zinc/00/83/65/1355008365.db2.gz	IGTBFLMESPZJHH-ZBFHGGJFSA-N	0	3	326.444	3.030	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(-c3ccccc3)nc2)CC[C@H]1C	ZINC001071928197	1355029317	/nfs/dbraw/zinc/02/93/17/1355029317.db2.gz	ZGODELGKRFUEAE-XLIONFOSSA-N	0	3	347.462	3.355	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cccn2C2CCCC2)CC[C@H]1C	ZINC001071937366	1355034308	/nfs/dbraw/zinc/03/43/08/1355034308.db2.gz	AMJBAVFLJXYFDI-SJORKVTESA-N	0	3	327.472	3.209	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2cc3cccnc3s2)CC[C@@H]1C	ZINC001071957207	1355042573	/nfs/dbraw/zinc/04/25/73/1355042573.db2.gz	FHXCYVLURHQZOU-DZGCQCFKSA-N	0	3	329.469	3.455	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccnc(C(F)(F)F)c2)CC[C@@H]1C	ZINC001071961711	1355046033	/nfs/dbraw/zinc/04/60/33/1355046033.db2.gz	VDMPMAVCVOVMFH-GXTWGEPZSA-N	0	3	341.377	3.259	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccnc(C(F)(F)F)c2)CC[C@@H]1C	ZINC001071961712	1355046201	/nfs/dbraw/zinc/04/62/01/1355046201.db2.gz	VDMPMAVCVOVMFH-JSGCOSHPSA-N	0	3	341.377	3.259	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2[nH]ccc2-c2ccccc2)CC[C@@H]1C	ZINC001071986688	1355060335	/nfs/dbraw/zinc/06/03/35/1355060335.db2.gz	XKCQSYGIGZJFCC-FUHWJXTLSA-N	0	3	335.451	3.288	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2sccc2COC)CC[C@@H]1C	ZINC001071993657	1355063885	/nfs/dbraw/zinc/06/38/85/1355063885.db2.gz	VKPVBTUNYRWEOI-HOCLYGCPSA-N	0	3	336.501	3.443	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)Cc2c(F)cccc2Cl)CC[C@@H]1C	ZINC001072019135	1355081078	/nfs/dbraw/zinc/08/10/78/1355081078.db2.gz	DBLSXLWOPBUEGP-KBPBESRZSA-N	0	3	336.838	3.014	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(COC)c(F)c2)CC[C@@H]1C	ZINC001072023630	1355086160	/nfs/dbraw/zinc/08/61/60/1355086160.db2.gz	UNPOPZBUQUNAKI-YOEHRIQHSA-N	0	3	334.435	3.131	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(OC)c(OCC)c2)CC[C@@H]1C	ZINC001072049643	1355103315	/nfs/dbraw/zinc/10/33/15/1355103315.db2.gz	QKERLQCKDDADAY-DOTOQJQBSA-N	0	3	346.471	3.253	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(OCC)c(OC)c2)CC[C@H]1C	ZINC001072058912	1355107940	/nfs/dbraw/zinc/10/79/40/1355107940.db2.gz	UWYAEPUJVMIABH-NVXWUHKLSA-N	0	3	346.471	3.253	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2cc(C3CCCC3)no2)CC[C@H]1C	ZINC001072087863	1355120949	/nfs/dbraw/zinc/12/09/49/1355120949.db2.gz	CJMKVGBQVHRWBO-GDBMZVCRSA-N	0	3	331.460	3.491	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cnnc2ccccc21	ZINC001089704290	1360607228	/nfs/dbraw/zinc/60/72/28/1360607228.db2.gz	VAHGKYXJWUUDNO-OAHLLOKOSA-N	0	3	338.455	3.036	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc(Cl)cc3c2OCC3)CC[C@@H]1C	ZINC001072109914	1355136459	/nfs/dbraw/zinc/13/64/59/1355136459.db2.gz	PDTUYNIMUYIEKS-XJKSGUPXSA-N	0	3	348.874	3.434	20	30		EGEDHN
CCC(CC)C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001072490580	1355309464	/nfs/dbraw/zinc/30/94/64/1355309464.db2.gz	BJCAJRFCSAIOJR-UHFFFAOYSA-N	0	3	325.456	3.029	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3cc4ccc(F)cc4s3)C2)C1	ZINC001072901415	1355489362	/nfs/dbraw/zinc/48/93/62/1355489362.db2.gz	PRXLXYQBWJOZSA-UHFFFAOYSA-N	0	3	330.428	3.374	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc(C4=CCCC4)cc3)C2)C1	ZINC001073499213	1355826307	/nfs/dbraw/zinc/82/63/07/1355826307.db2.gz	GIVJDMVNIHTZIR-UHFFFAOYSA-N	0	3	334.463	3.425	20	30		EGEDHN
CCCC(C)(C)C(=O)N[C@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001323069245	1387282644	/nfs/dbraw/zinc/28/26/44/1387282644.db2.gz	ZTZMZMDSCUWGJD-MRXNPFEDSA-N	0	3	333.501	3.430	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2cccc(C3CCC3)c2)C1	ZINC001073853297	1355918848	/nfs/dbraw/zinc/91/88/48/1355918848.db2.gz	ANMSWMBMRXEBTH-FQEVSTJZSA-N	0	3	342.483	3.351	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCCN1C(=O)c1ccccn1	ZINC001073925663	1355958848	/nfs/dbraw/zinc/95/88/48/1355958848.db2.gz	MPQAONZMZGTPHT-LJQANCHMSA-N	0	3	348.450	3.080	20	30		EGEDHN
Cc1cc(CN(C)C[C@H]2CCCCN2C(=O)[C@@H](C)C#N)c(C)s1	ZINC001073970498	1356003314	/nfs/dbraw/zinc/00/33/14/1356003314.db2.gz	QYHCQCUQCMCABJ-SUMWQHHRSA-N	0	3	333.501	3.338	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCCN1C(=O)/C=C\C1CC1	ZINC001073979263	1356008116	/nfs/dbraw/zinc/00/81/16/1356008116.db2.gz	SVSXHXXEDRYLIR-ZCPJJFRWSA-N	0	3	337.467	3.337	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2ccc(C(F)(F)F)cc2)C1	ZINC001080832203	1357747910	/nfs/dbraw/zinc/74/79/10/1357747910.db2.gz	XJIDYWLZRDOPTL-IUODEOHRSA-N	0	3	326.362	3.332	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC001080831904	1357748006	/nfs/dbraw/zinc/74/80/06/1357748006.db2.gz	HJEDXXOBWOYCTN-IUODEOHRSA-N	0	3	326.362	3.332	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N1CCCC[C@@H]1CN(C)Cc1ccccc1	ZINC001074067717	1356064244	/nfs/dbraw/zinc/06/42/44/1356064244.db2.gz	NPVJAMQFAQCSAZ-AQNXPRMDSA-N	0	3	342.483	3.091	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC[C@H](NCc2ccc(Cl)cc2Cl)[C@@H]1C	ZINC001074561523	1356209510	/nfs/dbraw/zinc/20/95/10/1356209510.db2.gz	CNIAQSYEHIGRBW-PGUXBMHVSA-N	0	3	340.254	3.232	20	30		EGEDHN
CC[C@H](N[C@H]1CCN(C(=O)C#CC2CC2)[C@H]1C)c1ccc(F)cc1F	ZINC001074647050	1356220260	/nfs/dbraw/zinc/22/02/60/1356220260.db2.gz	QZGXYDZRMMVSAU-AGRHKRQWSA-N	0	3	346.421	3.408	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1c[nH]c3cc(C)ccc13)C2	ZINC001098022683	1363199393	/nfs/dbraw/zinc/19/93/93/1363199393.db2.gz	BYNCHPAFXUCXRL-AHRSYUTCSA-N	0	3	337.467	3.316	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccnc(-c4ccco4)c3)[C@@H]2C1	ZINC001075927304	1356446871	/nfs/dbraw/zinc/44/68/71/1356446871.db2.gz	JRIFGIDBUSCSRU-FUHWJXTLSA-N	0	3	337.423	3.064	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)c3ccc(OC)c(C(C)C)c3)[C@@H]2C1	ZINC001075994273	1356463736	/nfs/dbraw/zinc/46/37/36/1356463736.db2.gz	LHZJLHXQMKODLD-FUHWJXTLSA-N	0	3	328.456	3.151	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3ccc(-c4cccs4)o3)[C@@H]2C1	ZINC001076519008	1356601437	/nfs/dbraw/zinc/60/14/37/1356601437.db2.gz	JYCITZIVHARUKX-LSDHHAIUSA-N	0	3	340.448	3.178	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc(C(C)C)on2)C12CCC2	ZINC001078688983	1357054275	/nfs/dbraw/zinc/05/42/75/1357054275.db2.gz	ZDINQHQYQDDSEI-GJZGRUSLSA-N	0	3	337.851	3.181	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc(CCC)on2)C12CCC2	ZINC001078768692	1357074690	/nfs/dbraw/zinc/07/46/90/1357074690.db2.gz	VBSKTDWQNIOSHX-LSDHHAIUSA-N	0	3	337.851	3.010	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc3c([nH]2)CCCC3)C12CCC2	ZINC001078773863	1357078576	/nfs/dbraw/zinc/07/85/76/1357078576.db2.gz	OZZIYGLUSIEBGP-IRXDYDNUSA-N	0	3	347.890	3.277	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2cc3c([nH]2)CCCC3)C12CCC2	ZINC001078773864	1357078584	/nfs/dbraw/zinc/07/85/84/1357078584.db2.gz	OZZIYGLUSIEBGP-SJORKVTESA-N	0	3	347.890	3.277	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2ccc(C)cc2OC)C12CCC2	ZINC001078785326	1357080830	/nfs/dbraw/zinc/08/08/30/1357080830.db2.gz	BRHPGDLFJBQPEY-IAGOWNOFSA-N	0	3	348.874	3.387	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2cnn(C(CC)CC)c2C)C1	ZINC001080749692	1357731626	/nfs/dbraw/zinc/73/16/26/1357731626.db2.gz	ZDHQGJBLWXWRDX-RDTXWAMCSA-N	0	3	332.492	3.179	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2ccccc2OCC2CC2)C1	ZINC001080990469	1357775491	/nfs/dbraw/zinc/77/54/91/1357775491.db2.gz	ICQBUZLBPOPEJW-CRAIPNDOSA-N	0	3	328.456	3.102	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2cscc2C(F)(F)F)C1	ZINC001081058653	1357804220	/nfs/dbraw/zinc/80/42/20/1357804220.db2.gz	MSFUMZQACMMNHT-ZWNOBZJWSA-N	0	3	332.391	3.393	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@@]2(C)CCc3ccccc3C2)C1	ZINC001081066689	1357807266	/nfs/dbraw/zinc/80/72/66/1357807266.db2.gz	CCWSJRUVWLLVML-BSIFCXSSSA-N	0	3	326.484	3.194	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2ccc(Cl)c3occc32)[C@H](OC)C1	ZINC001082322162	1358018090	/nfs/dbraw/zinc/01/80/90/1358018090.db2.gz	FRFMHPBXEXFSAA-HZPDHXFCSA-N	0	3	348.830	3.091	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)c3ccc(Cl)cc3C)[C@H]2C1	ZINC001083182067	1358121644	/nfs/dbraw/zinc/12/16/44/1358121644.db2.gz	LGHWGIKUSUDFGU-ZWKOTPCHSA-N	0	3	348.874	3.140	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)C3CCC(CCCC)CC3)[C@H]2C1	ZINC001083267349	1358128060	/nfs/dbraw/zinc/12/80/60/1358128060.db2.gz	WPJXCQQWBNIDQB-GHBBCFCZSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2ccc(C(C)(C)CC)cc2)[C@@H](O)C1	ZINC001083553376	1358132347	/nfs/dbraw/zinc/13/23/47/1358132347.db2.gz	AJODNAHKWOOSOL-MOPGFXCFSA-N	0	3	344.499	3.115	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3nc4ccccc4cc3C)[C@@H]2C1	ZINC001084530557	1358232816	/nfs/dbraw/zinc/23/28/16/1358232816.db2.gz	DGNFYCQWAVYNGT-IEBWSBKVSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@@H]3C[C@H]3c3cccc(F)c3F)[C@@H]2C1	ZINC001084842019	1358325117	/nfs/dbraw/zinc/32/51/17/1358325117.db2.gz	XGDMAIBRHDVOFD-NOVWEMISSA-N	0	3	346.421	3.177	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3cc(C4CCCC4)no3)[C@@H]2C1	ZINC001084840681	1358325558	/nfs/dbraw/zinc/32/55/58/1358325558.db2.gz	ORFYYYHKKIIPRQ-SJLPKXTDSA-N	0	3	343.471	3.445	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C3[C@@H]4CCCCCC[C@@H]34)C[C@@H]21	ZINC001085042243	1358374208	/nfs/dbraw/zinc/37/42/08/1358374208.db2.gz	VCWOZUBOKCKHOH-MKXGPGLRSA-N	0	3	328.500	3.149	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C3CCC(C(F)F)CC3)C[C@@H]21	ZINC001085085131	1358387258	/nfs/dbraw/zinc/38/72/58/1358387258.db2.gz	YTYXQOMZPRFJIZ-LMPOIIKSSA-N	0	3	326.431	3.167	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cc(C(C)(C)C)n[nH]1	ZINC001085255620	1358445241	/nfs/dbraw/zinc/44/52/41/1358445241.db2.gz	NFIIQLVCGWAOFQ-CHWSQXEVSA-N	0	3	338.883	3.090	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1C[C@H]1CCC	ZINC001085324286	1358466866	/nfs/dbraw/zinc/46/68/66/1358466866.db2.gz	VREHCYRAGDYCFH-KBUPBQIOSA-N	0	3	343.309	3.348	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@@H]2CCCC[C@H]2NC(=O)[C@@H]2CC23CC3)c1	ZINC001085344131	1358473080	/nfs/dbraw/zinc/47/30/80/1358473080.db2.gz	QNWCLKKLKXKSOL-CGTJXYLNSA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccc(Cl)cn1	ZINC001085400149	1358489146	/nfs/dbraw/zinc/48/91/46/1358489146.db2.gz	YDCBJOCZHANZTH-CHWSQXEVSA-N	0	3	328.243	3.118	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1c(F)cccc1F	ZINC001085404237	1358491130	/nfs/dbraw/zinc/49/11/30/1358491130.db2.gz	ADBNBXLJFNRMQB-ZIAGYGMSSA-N	0	3	328.790	3.348	20	30		EGEDHN
CN(C[C@@H]1CCN1[C@@H]1CCCc2ccccc21)C(=O)c1c[nH]c(C#N)c1	ZINC001085556744	1358592192	/nfs/dbraw/zinc/59/21/92/1358592192.db2.gz	YURJRPTZLDLRJW-AZUAARDMSA-N	0	3	348.450	3.110	20	30		EGEDHN
CN(C[C@@H]1CCN1CCC1CCCCCC1)C(=O)c1c[nH]c(C#N)c1	ZINC001085556570	1358592416	/nfs/dbraw/zinc/59/24/16/1358592416.db2.gz	UQJHCDDFLRWOFF-IBGZPJMESA-N	0	3	342.487	3.393	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc(-c2cnco2)cc1	ZINC001085675882	1358680315	/nfs/dbraw/zinc/68/03/15/1358680315.db2.gz	BXEUHRROWORTPF-GOSISDBHSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@H]1CCc2cc(C)ccc2O1	ZINC001085722978	1358712526	/nfs/dbraw/zinc/71/25/26/1358712526.db2.gz	KYGXNDWKPBFEQS-UYAOXDASSA-N	0	3	342.483	3.188	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cccc2c1O[C@@H](C)C2	ZINC001085729733	1358718023	/nfs/dbraw/zinc/71/80/23/1358718023.db2.gz	FRXOALXSRJVUDE-DOTOQJQBSA-N	0	3	328.456	3.123	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cnc2ccsc2c1	ZINC001085761989	1358740327	/nfs/dbraw/zinc/74/03/27/1358740327.db2.gz	YKZMDMRWCCEEJH-OAHLLOKOSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc2c(c1)C[C@H](C)O2	ZINC001085875395	1358839624	/nfs/dbraw/zinc/83/96/24/1358839624.db2.gz	ZKOYKZGWQSBJCF-YJBOKZPZSA-N	0	3	328.456	3.123	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1c(C)nn(CCC)c1C	ZINC001085916378	1358876211	/nfs/dbraw/zinc/87/62/11/1358876211.db2.gz	YHIDEHDQXOKTMQ-QGZVFWFLSA-N	0	3	332.492	3.022	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@@H]1CCCc2sc(C)nc21	ZINC001085923501	1358882426	/nfs/dbraw/zinc/88/24/26/1358882426.db2.gz	ZNUQVSRMLAOSCA-HZPDHXFCSA-N	0	3	347.528	3.370	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2conc2C2CCCC2)C1	ZINC001086105960	1358998624	/nfs/dbraw/zinc/99/86/24/1358998624.db2.gz	KTRPERVGHCDRTA-XBXGTLAGSA-N	0	3	337.851	3.183	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc3c([nH]2)c(F)ccc3C)C1	ZINC001086132045	1359005323	/nfs/dbraw/zinc/00/53/23/1359005323.db2.gz	ZIJZZNYCWYXLSA-BETUJISGSA-N	0	3	349.837	3.466	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2C[C@@H](NCc3oc(CC)nc3C)C2)CC1	ZINC001086187521	1359020683	/nfs/dbraw/zinc/02/06/83/1359020683.db2.gz	ALYQYLOZTBRICT-WOVMCDHWSA-N	0	3	345.487	3.276	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc3cnccc3c2)C1	ZINC001086246318	1359041048	/nfs/dbraw/zinc/04/10/48/1359041048.db2.gz	VTHINGHKVLEASQ-XFHMXUHZSA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)c2ccsc2C)C1	ZINC001086361094	1359077510	/nfs/dbraw/zinc/07/75/10/1359077510.db2.gz	GZIBRKRPSRNUFM-HAQNSBGRSA-N	0	3	343.290	3.063	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc(Cl)ccc2F)C1	ZINC001086422303	1359093114	/nfs/dbraw/zinc/09/31/14/1359093114.db2.gz	ZAWRHNMDQUBOED-UMSPYCQHSA-N	0	3	331.218	3.330	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@@H]2COc3cc(C)c(C)cc32)C1	ZINC001086438941	1359097279	/nfs/dbraw/zinc/09/72/79/1359097279.db2.gz	KTOQFYIHSBVNJC-BFYDXBDKSA-N	0	3	348.874	3.016	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2C[C@H](NCc3ccccc3F)C2)cc1	ZINC001086444424	1359098592	/nfs/dbraw/zinc/09/85/92/1359098592.db2.gz	WCCZFWJRHJYJNW-RUCARUNLSA-N	0	3	336.410	3.105	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)[C@H]2CCC[C@H](C)C2)C1	ZINC001086462408	1359106095	/nfs/dbraw/zinc/10/60/95/1359106095.db2.gz	MSTFKFBRQCYLDE-MXAVVETBSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2C[C@H](NCc3cc(C)ns3)C2)CC1	ZINC001086467651	1359108376	/nfs/dbraw/zinc/10/83/76/1359108376.db2.gz	OENGCAHHOZZPJA-KOMQPUFPSA-N	0	3	333.501	3.182	20	30		EGEDHN
C[C@H]1CC[C@@H](C(=O)NC[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)C1	ZINC001086496098	1359120125	/nfs/dbraw/zinc/12/01/25/1359120125.db2.gz	NAYYXABQHCGBCF-SCNOPHJPSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(OC)cc2Cl)C1	ZINC001086506356	1359123298	/nfs/dbraw/zinc/12/32/98/1359123298.db2.gz	TZJYBEACESCGBO-HAQNSBGRSA-N	0	3	343.254	3.199	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)CC2=CCCCC2)C1	ZINC001086579797	1359154348	/nfs/dbraw/zinc/15/43/48/1359154348.db2.gz	YANFTEGWMJVPLU-LEWJYISDSA-N	0	3	336.479	3.484	20	30		EGEDHN
Cc1occc1C(=O)NC[C@H]1CC[C@@H](NCc2ccccc2C#N)C1	ZINC001086639793	1359174090	/nfs/dbraw/zinc/17/40/90/1359174090.db2.gz	HNMPWDBUGNXIAM-MAUKXSAKSA-N	0	3	337.423	3.148	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccc3ccn(C)c3c2)C1	ZINC001086845038	1359212198	/nfs/dbraw/zinc/21/21/98/1359212198.db2.gz	HMEINCGMZSBBKE-WMLDXEAASA-N	0	3	345.874	3.419	20	30		EGEDHN
C[C@H]1CC2(CN1C(=O)C1CC1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001086895766	1359225164	/nfs/dbraw/zinc/22/51/64/1359225164.db2.gz	SYNMJHHXODSRRY-INIZCTEOSA-N	0	3	337.467	3.171	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)CCc3ccc(C)cc3)C2)CC1	ZINC001086931454	1359255423	/nfs/dbraw/zinc/25/54/23/1359255423.db2.gz	JGDAMLVJICJLIR-LJQANCHMSA-N	0	3	338.495	3.264	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H]3Cc4ccccc43)C2)CC1	ZINC001086938797	1359260890	/nfs/dbraw/zinc/26/08/90/1359260890.db2.gz	AIBBMJTUFIRSIB-FXAWDEMLSA-N	0	3	336.479	3.053	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc(F)ccc3Cl)C2)CC1	ZINC001086945340	1359266248	/nfs/dbraw/zinc/26/62/48/1359266248.db2.gz	YUWWCFQTNSUNNG-CQSZACIVSA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cccc(OCC)c3)C2)CC1	ZINC001086945467	1359266333	/nfs/dbraw/zinc/26/63/33/1359266333.db2.gz	BYFCYPBWZMLWLB-KRWDZBQOSA-N	0	3	340.467	3.035	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cccc(F)c3Cl)C2)CC1	ZINC001086945613	1359266605	/nfs/dbraw/zinc/26/66/05/1359266605.db2.gz	FTGARBDPQNWGCO-AWEZNQCLSA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc(Cl)cn3)C2)CC1	ZINC001086953356	1359273862	/nfs/dbraw/zinc/27/38/62/1359273862.db2.gz	GJZJNSAYDKWYGN-HNNXBMFYSA-N	0	3	345.874	3.075	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3sc(C)nc3C)C2)CC1	ZINC001086955191	1359275651	/nfs/dbraw/zinc/27/56/51/1359275651.db2.gz	GRCMBOWNMARUQL-AWEZNQCLSA-N	0	3	345.512	3.100	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cc4c(s3)CCC4)C2)CC1	ZINC001086955089	1359275720	/nfs/dbraw/zinc/27/57/20/1359275720.db2.gz	CUOSWKHLDDAKGN-HNNXBMFYSA-N	0	3	342.508	3.187	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cc(C)c(F)c(C)c3)C2)CC1	ZINC001086956331	1359277271	/nfs/dbraw/zinc/27/72/71/1359277271.db2.gz	KXDNKYGHCWENKN-KRWDZBQOSA-N	0	3	342.458	3.392	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cccc4c3CCC4)C2)CC1	ZINC001086958245	1359279280	/nfs/dbraw/zinc/27/92/80/1359279280.db2.gz	JUIZOZRPVVVHHV-KRWDZBQOSA-N	0	3	336.479	3.125	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3sccc3CC)C2)CC1	ZINC001086958718	1359279744	/nfs/dbraw/zinc/27/97/44/1359279744.db2.gz	ZJTNFPFHMMABLN-OAHLLOKOSA-N	0	3	330.497	3.260	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc(CF)cc3)C2)CC1	ZINC001086959258	1359279826	/nfs/dbraw/zinc/27/98/26/1359279826.db2.gz	WXEUQODYPZGEFX-QGZVFWFLSA-N	0	3	342.458	3.496	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccccc1F	ZINC001087267115	1359338221	/nfs/dbraw/zinc/33/82/21/1359338221.db2.gz	VWUMHZJGHMJUPW-BPQIPLTHSA-N	0	3	328.431	3.068	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1sccc1F	ZINC001087284925	1359363925	/nfs/dbraw/zinc/36/39/25/1359363925.db2.gz	QCNYINATMOWKOJ-UHOFOFEASA-N	0	3	334.460	3.129	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)Cc1c(C)cccc1C	ZINC001087287348	1359365660	/nfs/dbraw/zinc/36/56/60/1359365660.db2.gz	GFIGRQBCWYRXRB-JRGCBEDISA-N	0	3	338.495	3.084	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1csc(C)c1C	ZINC001087288076	1359367146	/nfs/dbraw/zinc/36/71/46/1359367146.db2.gz	QZGBIISUBNGYKV-HYVNUMGLSA-N	0	3	330.497	3.217	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc4c(o3)CCCC4)C(C)(C)[C@H]21	ZINC001087289682	1359368674	/nfs/dbraw/zinc/36/86/74/1359368674.db2.gz	QMHVXKFRUSOQSE-MNEFBYGVSA-N	0	3	340.467	3.010	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1nc(C)sc1C	ZINC001087291341	1359370365	/nfs/dbraw/zinc/37/03/65/1359370365.db2.gz	SIJJDDIURIJKLM-HYVNUMGLSA-N	0	3	345.512	3.002	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)Cc3cccc(CC)c3)C(C)(C)[C@H]21	ZINC001087293188	1359373188	/nfs/dbraw/zinc/37/31/88/1359373188.db2.gz	ZTNKHKWWHHPLPL-GIVPXCGWSA-N	0	3	338.495	3.030	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc(CC)s3)C(C)(C)[C@H]21	ZINC001087294607	1359374903	/nfs/dbraw/zinc/37/49/03/1359374903.db2.gz	VZBUPBPYXMARCZ-PVAVHDDUSA-N	0	3	330.497	3.163	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc(C(C)C)no3)C(C)(C)[C@H]21	ZINC001087304965	1359389642	/nfs/dbraw/zinc/38/96/42/1359389642.db2.gz	KLCQOEBAFROHHJ-JLSDUUJJSA-N	0	3	343.471	3.040	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc2cc[nH]c2c1	ZINC001087307370	1359394686	/nfs/dbraw/zinc/39/46/86/1359394686.db2.gz	YTYJGBMCJFTYQP-NZSAHSFTSA-N	0	3	335.451	3.020	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cccc4c3ccn4C)C(C)(C)[C@H]21	ZINC001087309045	1359395978	/nfs/dbraw/zinc/39/59/78/1359395978.db2.gz	ZOTHSXBCNFPYKK-HOJAQTOUSA-N	0	3	349.478	3.030	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)Cc3ccccc3Cl)C(C)(C)[C@H]21	ZINC001087315776	1359405860	/nfs/dbraw/zinc/40/58/60/1359405860.db2.gz	HWSKDDPVXSPKFV-MNEFBYGVSA-N	0	3	344.886	3.121	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)Cc1sc(C)cc1C	ZINC001087315525	1359405876	/nfs/dbraw/zinc/40/58/76/1359405876.db2.gz	DHNWJUQUCBXJRR-AYOQOUSVSA-N	0	3	344.524	3.146	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)Cc3ccc(C)s3)C(C)(C)[C@H]21	ZINC001087318279	1359409662	/nfs/dbraw/zinc/40/96/62/1359409662.db2.gz	UVUNSLNTORDEFB-NEWSRXKRSA-N	0	3	344.524	3.228	20	30		EGEDHN
CCCC(=O)N1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1Cc1ccc(C#N)s1	ZINC001087329617	1359419106	/nfs/dbraw/zinc/41/91/06/1359419106.db2.gz	RPDXBCKACJXPMI-RUGDWHBFSA-N	0	3	343.496	3.089	20	30		EGEDHN
CC1(C(=O)N2C[C@@H]3[C@@H](C2)[C@@H]2CC[C@H]3CN2CC#Cc2ccccc2)CC1	ZINC001087360487	1359433766	/nfs/dbraw/zinc/43/37/66/1359433766.db2.gz	MIADDHRDLYCLOU-BURNTYAHSA-N	0	3	348.490	3.007	20	30		EGEDHN
Cc1cc(C)cc(C(=O)NCC2(NCc3cccc(C#N)c3)CC2)c1	ZINC001323601589	1387402636	/nfs/dbraw/zinc/40/26/36/1387402636.db2.gz	GJCIELVXVYIMFL-UHFFFAOYSA-N	0	3	333.435	3.227	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)[C@@H](C)C2CCC2)CCN1Cc1ccc(C#N)cc1	ZINC001087620244	1359558198	/nfs/dbraw/zinc/55/81/98/1359558198.db2.gz	XHWKZYHAQMLBLZ-RYGJVYDSSA-N	0	3	339.483	3.464	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)Cc2c(C)[nH]c3ccccc32)[C@H]1CC	ZINC001087709364	1359603196	/nfs/dbraw/zinc/60/31/96/1359603196.db2.gz	UTWWJSWDVUHJCB-RBUKOAKNSA-N	0	3	325.456	3.174	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N[C@H]1CCN(Cc2ccsc2)[C@@H]1CC	ZINC001087758604	1359631533	/nfs/dbraw/zinc/63/15/33/1359631533.db2.gz	CBPBELWGGYKWHS-FJIDUMEYSA-N	0	3	348.512	3.198	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2coc(C3CCCC3)n2)[C@H]1CC	ZINC001087779312	1359640029	/nfs/dbraw/zinc/64/00/29/1359640029.db2.gz	XBPYMKOFQNFLOK-DOTOQJQBSA-N	0	3	331.460	3.491	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cc(C(F)(F)F)ccn2)[C@H]1CC	ZINC001087783392	1359641882	/nfs/dbraw/zinc/64/18/82/1359641882.db2.gz	YYTIZQADBRHFFD-DZGCQCFKSA-N	0	3	341.377	3.259	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cnn(CCCC)c2C)[C@H]1CC	ZINC001087790618	1359647282	/nfs/dbraw/zinc/64/72/82/1359647282.db2.gz	WMQIYELFFBMMRF-ZWKOTPCHSA-N	0	3	332.492	3.150	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CN(C(=O)c4ccccc4)C[C@@H]3C2)cc1	ZINC001087869878	1359691163	/nfs/dbraw/zinc/69/11/63/1359691163.db2.gz	LLSFVLQHGRNKSZ-RTWAWAEBSA-N	0	3	345.446	3.152	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CCN(Cc3ccc(C)nc3C)C[C@H]2C1	ZINC001088066237	1359739714	/nfs/dbraw/zinc/73/97/14/1359739714.db2.gz	CFSLYBHJBKTUSX-MOPGFXCFSA-N	0	3	341.499	3.191	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H]3CCN(Cc4ccccn4)C[C@H]3C2)CC1	ZINC001088090779	1359752191	/nfs/dbraw/zinc/75/21/91/1359752191.db2.gz	GDSJUJBXUBMUDD-MOPGFXCFSA-N	0	3	339.483	3.108	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3cccc(C4CCCC4)c3)C[C@@H]2C1	ZINC001088170158	1359779328	/nfs/dbraw/zinc/77/93/28/1359779328.db2.gz	HBGQKLDDRLWZIJ-RTWAWAEBSA-N	0	3	336.479	3.371	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3ccccc3CC(C)C)C[C@@H]2C1	ZINC001088216491	1359799342	/nfs/dbraw/zinc/79/93/42/1359799342.db2.gz	KNVQLBSYPPTWMK-UXHICEINSA-N	0	3	338.495	3.302	20	30		EGEDHN
C=CCN1CC[C@H](OCC2CCN(C(=O)C=C3CCCCC3)CC2)C1	ZINC001088229732	1359808528	/nfs/dbraw/zinc/80/85/28/1359808528.db2.gz	YAMWYSUBFHQCRY-FQEVSTJZSA-N	0	3	346.515	3.392	20	30		EGEDHN
C=CCN1CC[C@@H](OCC2CCN(C(=O)[C@@H](C)C3CCCC3)CC2)C1	ZINC001088240425	1359811984	/nfs/dbraw/zinc/81/19/84/1359811984.db2.gz	YQUZXXWSHYVYMU-FXAWDEMLSA-N	0	3	348.531	3.328	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)C2(c3cccnc3)CC2)C1	ZINC001088367742	1359852016	/nfs/dbraw/zinc/85/20/16/1359852016.db2.gz	SAUZITMJBKMXOM-QGZVFWFLSA-N	0	3	347.890	3.227	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)COc2ccsc2)C1	ZINC001088413801	1359885014	/nfs/dbraw/zinc/88/50/14/1359885014.db2.gz	PONPWBSRANGQJS-AWEZNQCLSA-N	0	3	342.892	3.240	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2ncccc2Cl)C1	ZINC001088416272	1359885774	/nfs/dbraw/zinc/88/57/74/1359885774.db2.gz	JHCHOLTXELFOGE-ZDUSSCGKSA-N	0	3	342.270	3.462	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2ccccc2OC)C1	ZINC001088416758	1359886689	/nfs/dbraw/zinc/88/66/89/1359886689.db2.gz	XEDHUNPSVCEQPP-OAHLLOKOSA-N	0	3	336.863	3.422	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)C2(c3ccccc3F)CCC2)[C@H]1C	ZINC001088974909	1360121044	/nfs/dbraw/zinc/12/10/44/1360121044.db2.gz	SOKGEXROOCJGTC-QAPCUYQASA-N	0	3	330.447	3.403	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)[C@]2(C)CCc3ccccc3C2)[C@H]1C	ZINC001089089936	1360163156	/nfs/dbraw/zinc/16/31/56/1360163156.db2.gz	BDTVINNQQWXYJS-LKUPVBHCSA-N	0	3	326.484	3.337	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cccc3c2OCC3(C)C)[C@H]1C	ZINC001089084678	1360163318	/nfs/dbraw/zinc/16/33/18/1360163318.db2.gz	ZCBJGKCPCOERQX-PBHICJAKSA-N	0	3	328.456	3.125	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCCN1C(=O)[C@@H]1CC1(F)F	ZINC001089173163	1360226745	/nfs/dbraw/zinc/22/67/45/1360226745.db2.gz	ADKBPNXPLPRPHC-IRXDYDNUSA-N	0	3	347.409	3.026	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCc2sc(CNCC3CC3)nc2C1	ZINC001089278327	1360298565	/nfs/dbraw/zinc/29/85/65/1360298565.db2.gz	CLWCJJCIHDDNOJ-SFHVURJKSA-N	0	3	333.501	3.130	20	30		EGEDHN
CC(C)C(=O)N[C@@H]1CCN(CC#Cc2ccccc2)CC(C)(C)C1	ZINC001089320641	1360339268	/nfs/dbraw/zinc/33/92/68/1360339268.db2.gz	LKHKHCDDTPGRBD-LJQANCHMSA-N	0	3	326.484	3.301	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cccc3c2CCCC3)CC(C)(C)C1	ZINC001089397207	1360397067	/nfs/dbraw/zinc/39/70/67/1360397067.db2.gz	LSOZJJRMDWCJDD-GOSISDBHSA-N	0	3	338.495	3.419	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc3ccccc3nc2C)CC(C)(C)C1	ZINC001089399452	1360399400	/nfs/dbraw/zinc/39/94/00/1360399400.db2.gz	ZADFVXYWKQINGA-GOSISDBHSA-N	0	3	349.478	3.397	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccnc2C(F)F)CC(C)(C)C1	ZINC001089435198	1360426019	/nfs/dbraw/zinc/42/60/19/1360426019.db2.gz	FNFLMKDQPACIRL-AWEZNQCLSA-N	0	3	349.425	3.263	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc(Cl)c(Cl)[nH]2)CC(C)(C)C1	ZINC001089451831	1360439388	/nfs/dbraw/zinc/43/93/88/1360439388.db2.gz	YHQYBCNJJGRQGV-NSHDSACASA-N	0	3	342.270	3.175	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(F)c(Cl)c2)CC(C)(C)C1	ZINC001089476252	1360458861	/nfs/dbraw/zinc/45/88/61/1360458861.db2.gz	LVAJOVZSQLZDKC-AWEZNQCLSA-N	0	3	336.838	3.333	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2csc(C(C)C)n2)CC(C)(C)C1	ZINC001089518819	1360487785	/nfs/dbraw/zinc/48/77/85/1360487785.db2.gz	HJJHYTZODJLSDH-CQSZACIVSA-N	0	3	333.501	3.120	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc(Cl)cc(OC)c2)CC(C)(C)C1	ZINC001089522477	1360489102	/nfs/dbraw/zinc/48/91/02/1360489102.db2.gz	YHHUKSKXAWKEED-INIZCTEOSA-N	0	3	348.874	3.202	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C2CCC(C(F)F)CC2)CC(C)(C)C1	ZINC001089548092	1360502129	/nfs/dbraw/zinc/50/21/29/1360502129.db2.gz	GSEXJGCUHNRDGC-GPANFISMSA-N	0	3	340.458	3.298	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2occ3c2CCCC3)CC(C)(C)C1	ZINC001089548404	1360502269	/nfs/dbraw/zinc/50/22/69/1360502269.db2.gz	LABVLMDIXGPYGP-KRWDZBQOSA-N	0	3	342.483	3.402	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(C)c3c2CCC3)CC(C)(C)C1	ZINC001089565615	1360512099	/nfs/dbraw/zinc/51/20/99/1360512099.db2.gz	UOKXDZQTTUDSHG-QGZVFWFLSA-N	0	3	338.495	3.337	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2csc(C3CC3)n2)CC(C)(C)C1	ZINC001089568753	1360513940	/nfs/dbraw/zinc/51/39/40/1360513940.db2.gz	OKEHXVACXSYGDB-OAHLLOKOSA-N	0	3	345.512	3.264	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NC[C@H]1CCC(C)(C)CN1CC(=C)C	ZINC001089642907	1360556001	/nfs/dbraw/zinc/55/60/01/1360556001.db2.gz	POSQIDCFNYDKSP-KURKYZTESA-N	0	3	334.504	3.151	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccnn1CCC	ZINC001089648851	1360561863	/nfs/dbraw/zinc/56/18/63/1360561863.db2.gz	SVHNOVNPXIGCTR-MRXNPFEDSA-N	0	3	332.492	3.090	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1nccc2cccnc21	ZINC001089652136	1360565320	/nfs/dbraw/zinc/56/53/20/1360565320.db2.gz	XTZJTPYKDRWKKZ-INIZCTEOSA-N	0	3	338.455	3.036	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cccc2nccn21	ZINC001089667460	1360577226	/nfs/dbraw/zinc/57/72/26/1360577226.db2.gz	IBBWICTYWKTIKO-INIZCTEOSA-N	0	3	340.471	3.131	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1nc(C)n2ccccc12	ZINC001089668804	1360578430	/nfs/dbraw/zinc/57/84/30/1360578430.db2.gz	AVILNKQGBHXISL-INIZCTEOSA-N	0	3	340.471	3.049	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc2ncccc2o1	ZINC001089669183	1360578841	/nfs/dbraw/zinc/57/88/41/1360578841.db2.gz	IIRZCCCHRSJIEE-HNNXBMFYSA-N	0	3	339.439	3.072	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)C1CCC(OC)CC1	ZINC001089689824	1360595256	/nfs/dbraw/zinc/59/52/56/1360595256.db2.gz	JMZDKKVZASHDCV-ADKAHSJRSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccnc(C2CC2)n1	ZINC001089706374	1360608956	/nfs/dbraw/zinc/60/89/56/1360608956.db2.gz	RTSDFJQECLQKCY-MRXNPFEDSA-N	0	3	342.487	3.151	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cccnc1OCC	ZINC001089730112	1360633215	/nfs/dbraw/zinc/63/32/15/1360633215.db2.gz	WHNMAXLLYIGZAY-INIZCTEOSA-N	0	3	345.487	3.277	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1c(C)cccc1F	ZINC001089735635	1360640368	/nfs/dbraw/zinc/64/03/68/1360640368.db2.gz	HIIXVWZJFBSPRN-MRXNPFEDSA-N	0	3	330.447	3.378	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)CCc1ccoc1	ZINC001089790134	1360664540	/nfs/dbraw/zinc/66/45/40/1360664540.db2.gz	QMQYWMYRKAMUAD-MLHJIOFPSA-N	0	3	348.874	3.134	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1cc[nH]c1CC	ZINC001089809730	1360672960	/nfs/dbraw/zinc/67/29/60/1360672960.db2.gz	TUAYVPCHBWVDHQ-DNMXQMFDSA-N	0	3	347.890	3.112	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](CNCc2oc(C)nc2C)[C@H](C)C1	ZINC001184471610	1387467567	/nfs/dbraw/zinc/46/75/67/1387467567.db2.gz	GBYIRTSBVWODQI-PBHICJAKSA-N	0	3	347.503	3.468	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1(C(C)C)CC1	ZINC001089861832	1360706462	/nfs/dbraw/zinc/70/64/62/1360706462.db2.gz	KJQUIZWQHMEANW-YVSFHVDLSA-N	0	3	336.907	3.344	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C2(C)CCCC2)CC2(CCOCC2)C1	ZINC001089950386	1360760319	/nfs/dbraw/zinc/76/03/19/1360760319.db2.gz	TXFUEYKCIYBOHH-QGZVFWFLSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](CNCc2oc(C)nc2C)[C@H](C)C1	ZINC001184499378	1387474630	/nfs/dbraw/zinc/47/46/30/1387474630.db2.gz	ZERSEEVJGIYMIL-RHSMWYFYSA-N	0	3	333.476	3.222	20	30		EGEDHN
C=C(C)CN1CC[C@@H](NC(=O)c2ccc(C3CCCC3)cc2)[C@@H](O)C1	ZINC001090435720	1360896785	/nfs/dbraw/zinc/89/67/85/1360896785.db2.gz	JWYFPFUFHLMOKZ-UXHICEINSA-N	0	3	342.483	3.085	20	30		EGEDHN
CC1(C)CC(C(=O)NCC2CC(NCc3ccc(C#N)cc3F)C2)C1	ZINC001091011128	1360977915	/nfs/dbraw/zinc/97/79/15/1360977915.db2.gz	UUZFGPKDXRNSLE-UHFFFAOYSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(C(C)(C)C)cn2)C1	ZINC001091033848	1360983483	/nfs/dbraw/zinc/98/34/83/1360983483.db2.gz	IXWQIXKJULNAGE-UHFFFAOYSA-N	0	3	335.879	3.230	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H]2C[C@H]2c2ccc(OC)cc2)C1	ZINC001091272946	1361028208	/nfs/dbraw/zinc/02/82/08/1361028208.db2.gz	BANUTHRXIKYXKI-NWCILSHNSA-N	0	3	348.874	3.036	20	30		EGEDHN
C[C@@]12CN(Cc3cccc(C#N)c3)C[C@@H]1CN(C(=O)[C@@H]1CC=CCC1)C2	ZINC001091473676	1361111695	/nfs/dbraw/zinc/11/16/95/1361111695.db2.gz	CBBUGRDTCJIGIL-SJBKTWHCSA-N	0	3	349.478	3.195	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@H]2CN(C[C@H](F)CC)C[C@@]2(C)C1	ZINC001091702461	1361185999	/nfs/dbraw/zinc/18/59/99/1361185999.db2.gz	ZWNHXMZZSSMQBW-CPUCHLNUSA-N	0	3	330.875	3.294	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3sc4ccccc4c3C)C[C@]2(C)C1	ZINC001091834761	1361232654	/nfs/dbraw/zinc/23/26/54/1361232654.db2.gz	ZTAMMWLKGUUJHH-QRWLVFNGSA-N	0	3	338.476	3.237	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3cc4ccccc4cc3F)C[C@]2(C)C1	ZINC001091845377	1361234393	/nfs/dbraw/zinc/23/43/93/1361234393.db2.gz	WJBCOWLKHONYFR-UTKZUKDTSA-N	0	3	336.410	3.006	20	30		EGEDHN
C[C@@]12CN(Cc3cccc(C#N)c3)C[C@@H]1CN(C(=O)[C@H]1CC13CCC3)C2	ZINC001092054127	1361284706	/nfs/dbraw/zinc/28/47/06/1361284706.db2.gz	LIGPQPZODPAMAW-SBHAEUEKSA-N	0	3	349.478	3.029	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3cc4cc(C)ccc4s3)C[C@]2(C)C1	ZINC001092157714	1361313929	/nfs/dbraw/zinc/31/39/29/1361313929.db2.gz	NGARMOSSMQWFQI-UZLBHIALSA-N	0	3	338.476	3.237	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3ccc(-c4ccco4)s3)C[C@]2(C)C1	ZINC001092157594	1361314075	/nfs/dbraw/zinc/31/40/75/1361314075.db2.gz	GBEBGSBBECPGQL-KUHUBIRLSA-N	0	3	340.448	3.035	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C[C@H]3CCCC(C)(C)C3)C[C@]2(C)C1	ZINC001092200086	1361321089	/nfs/dbraw/zinc/32/10/89/1361321089.db2.gz	CWFFIWZWNQZKHF-OPYAIIAOSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C[C@@H]3CCCCC3(C)C)C[C@]2(C)C1	ZINC001092327021	1361365939	/nfs/dbraw/zinc/36/59/39/1361365939.db2.gz	WZXVVDQSFIXENT-UEXGIBASSA-N	0	3	330.516	3.397	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CNC(=O)c1ccsc1	ZINC001092452801	1361387904	/nfs/dbraw/zinc/38/79/04/1361387904.db2.gz	DJAVZIDFKKRUES-TZMCWYRMSA-N	0	3	345.493	3.179	20	30		EGEDHN
C#CCN1C[C@@H](CNC(=O)c2oc3ccccc3c2Cl)[C@H](C)C1	ZINC001093121306	1361533773	/nfs/dbraw/zinc/53/37/73/1361533773.db2.gz	CAADLGSUUTUMKA-CHWSQXEVSA-N	0	3	330.815	3.017	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)c2cscc2C)CC1	ZINC001093364120	1361575218	/nfs/dbraw/zinc/57/52/18/1361575218.db2.gz	MKVWDBYQEKAUFT-GOSISDBHSA-N	0	3	342.508	3.396	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C2CC(C)(C)C2)CC1	ZINC001093369712	1361578421	/nfs/dbraw/zinc/57/84/21/1361578421.db2.gz	JZOYTZCGXYUPBZ-SFHVURJKSA-N	0	3	328.500	3.149	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C2C=CC=CC=C2)CC1	ZINC001093369524	1361578686	/nfs/dbraw/zinc/57/86/86/1361578686.db2.gz	BMVHUXXJXVROIB-FQEVSTJZSA-N	0	3	336.479	3.011	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C[C@@H]2C[C@H]2C2CC2)CC1	ZINC001093374140	1361583723	/nfs/dbraw/zinc/58/37/23/1361583723.db2.gz	AVKIGCSDOCQJOO-IRFCIJBXSA-N	0	3	340.511	3.149	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C(C2CC2)C2CC2)CC1	ZINC001093381763	1361593423	/nfs/dbraw/zinc/59/34/23/1361593423.db2.gz	UOATTYOREHZJBQ-HXUWFJFHSA-N	0	3	340.511	3.149	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)c2ccc(F)s2)CC1	ZINC001093384272	1361596029	/nfs/dbraw/zinc/59/60/29/1361596029.db2.gz	XKGYXOJXDSPHDJ-QGZVFWFLSA-N	0	3	346.471	3.227	20	30		EGEDHN
C[C@@H](C(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1)C(C)(C)C	ZINC001093862121	1361707807	/nfs/dbraw/zinc/70/78/07/1361707807.db2.gz	GJEOCJWDIYLWSZ-JTDSTZFVSA-N	0	3	341.499	3.425	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cccc(C)c3Cl)CCC[C@@H]12	ZINC001094541260	1361851131	/nfs/dbraw/zinc/85/11/31/1361851131.db2.gz	AOZOZFVMARSIRN-VQIMIIECSA-N	0	3	330.859	3.256	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1C[C@H]2C[C@@H](C1)N(C(=O)c1ccccc1)C2	ZINC001094847470	1361924655	/nfs/dbraw/zinc/92/46/55/1361924655.db2.gz	DWRIGXLZLBBWMT-DQLDELGASA-N	0	3	345.446	3.341	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc(C)c(OC)c(C)c1)C2	ZINC001095450180	1362144954	/nfs/dbraw/zinc/14/49/54/1362144954.db2.gz	OQFJKOJFDWYWIL-SQNIBIBYSA-N	0	3	328.456	3.223	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1cc3ccccc3s1)C2	ZINC001095750759	1362221245	/nfs/dbraw/zinc/22/12/45/1362221245.db2.gz	GNPMJJILQYEGPK-NJAFHUGGSA-N	0	3	338.476	3.189	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1c(C)noc1C1CC1)C2	ZINC001095774074	1362225246	/nfs/dbraw/zinc/22/52/46/1362225246.db2.gz	PHVKMJDFHYDELU-PMPSAXMXSA-N	0	3	329.444	3.162	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3Cc2ccccc2)cc1	ZINC001095853983	1362256469	/nfs/dbraw/zinc/25/64/69/1362256469.db2.gz	GAPTXSKONGZNGV-HKBOAZHASA-N	0	3	330.431	3.203	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1c(C)[nH]c3ccccc31)C2	ZINC001095949286	1362301760	/nfs/dbraw/zinc/30/17/60/1362301760.db2.gz	KUQZFPDRPNMXDF-XPGWFJOJSA-N	0	3	337.467	3.316	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](CNCc2nccs2)[C@H](C)C1	ZINC001184943913	1387567354	/nfs/dbraw/zinc/56/73/54/1387567354.db2.gz	BIGIHYURFAMFCZ-IAGOWNOFSA-N	0	3	347.528	3.301	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1cccc3sccc31)C2	ZINC001096105970	1362385322	/nfs/dbraw/zinc/38/53/22/1362385322.db2.gz	GMEXEBKBICIYKB-NJAFHUGGSA-N	0	3	338.476	3.189	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(C(F)F)cc1F)C2	ZINC001096239975	1362448472	/nfs/dbraw/zinc/44/84/72/1362448472.db2.gz	PTNIUGHENOJDPD-KCXAZCMYSA-N	0	3	336.357	3.122	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1sc(CC3CC3)nc1C)C2	ZINC001096244588	1362450215	/nfs/dbraw/zinc/45/02/15/1362450215.db2.gz	QPDVCYPNBZHZSE-PMPSAXMXSA-N	0	3	345.512	3.315	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3[C@@H](C)c2ccccc2)nc1	ZINC001096380724	1362479221	/nfs/dbraw/zinc/47/92/21/1362479221.db2.gz	QLLIJHYBLBCVDF-MTOHEIAKSA-N	0	3	345.446	3.159	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1csc3c1CC[C@@H](C)C3)C2	ZINC001096481330	1362530351	/nfs/dbraw/zinc/53/03/51/1362530351.db2.gz	VJKKAUYANNBDIW-KNCCTNLNSA-N	0	3	342.508	3.231	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C(C)(C)c1cccc(Cl)c1)C2	ZINC001097946290	1363175080	/nfs/dbraw/zinc/17/50/80/1363175080.db2.gz	OGGRNCBGLLYUIS-KURKYZTESA-N	0	3	344.886	3.362	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](C)c1ccc(F)c(F)c1)C2	ZINC001098441332	1363327025	/nfs/dbraw/zinc/32/70/25/1363327025.db2.gz	KHYKEEBZSDGFJM-FOZNTRSISA-N	0	3	334.410	3.366	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(C(C)(F)F)cc1)C2	ZINC001098537930	1363358626	/nfs/dbraw/zinc/35/86/26/1363358626.db2.gz	XBICAKXRPDPIKI-ZACQAIPSSA-N	0	3	332.394	3.157	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)C[C@@H](NC(=O)C(C)(C)F)c1ccccc1O2	ZINC001098541244	1363362508	/nfs/dbraw/zinc/36/25/08/1363362508.db2.gz	JJSVNDHANPXAFM-UZLBHIALSA-N	0	3	346.446	3.395	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)C[C@@H](NC(=O)C(C)C)c1ccccc1O2	ZINC001098541910	1363364770	/nfs/dbraw/zinc/36/47/70/1363364770.db2.gz	TVRQOXCSZLWKMA-YLJYHZDGSA-N	0	3	328.456	3.303	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1csc(C)c1C)C[C@H](C)O2	ZINC001098600044	1363394111	/nfs/dbraw/zinc/39/41/11/1363394111.db2.gz	RXWQHZVMGMRJIP-AWEZNQCLSA-N	0	3	348.512	3.246	20	30		EGEDHN
C=CCC[C@@H](C)NCc1cn([C@H]2CCN(C(=O)CCCCC)C2)nn1	ZINC001098615016	1363399970	/nfs/dbraw/zinc/39/99/70/1363399970.db2.gz	GZRQEFZYWOAMJO-AEFFLSMTSA-N	0	3	347.507	3.076	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1CCC(=C)CC1)C[C@@H](C)O2	ZINC001098633193	1363408282	/nfs/dbraw/zinc/40/82/82/1363408282.db2.gz	FWVSWRYTLHMKFI-QGZVFWFLSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C(CC)(CC)CC)C[C@H](C)O2	ZINC001098650268	1363417022	/nfs/dbraw/zinc/41/70/22/1363417022.db2.gz	MFJQEEVDUYGNBV-KRWDZBQOSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccc(Cl)cc1)C[C@@H](C)O2	ZINC001098655519	1363420876	/nfs/dbraw/zinc/42/08/76/1363420876.db2.gz	LJCKCGKRXUNJQS-OAHLLOKOSA-N	0	3	348.874	3.222	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccc(C)c(C)c1)C[C@@H](C)O2	ZINC001098658284	1363422352	/nfs/dbraw/zinc/42/23/52/1363422352.db2.gz	BMVZTTXLKNPJGP-GOSISDBHSA-N	0	3	342.483	3.185	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CCC[C@]3(NC(=O)C3=CCCC3)C2)c1	ZINC001098789526	1363469181	/nfs/dbraw/zinc/46/91/81/1363469181.db2.gz	ICFIOLLHYQHNEC-FPOVZHCZSA-N	0	3	335.451	3.139	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(C#N)cc1)C2	ZINC001098796690	1363471463	/nfs/dbraw/zinc/47/14/63/1363471463.db2.gz	ZZAUELBHBHIFBK-WFXMLNOXSA-N	0	3	337.467	3.075	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2nccc3ccsc32)C1	ZINC001098886117	1363504602	/nfs/dbraw/zinc/50/46/02/1363504602.db2.gz	WKIOZUWEGDNLQN-KSSFIOAISA-N	0	3	327.453	3.067	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(-c3cccs3)on2)C1	ZINC001098964572	1363544407	/nfs/dbraw/zinc/54/44/07/1363544407.db2.gz	IRKWJVJXIMGECT-UGSOOPFHSA-N	0	3	343.452	3.173	20	30		EGEDHN
C=CCOCC(=O)NC[C@H]1CCC(C)(C)CN1Cc1ccc(C)cc1	ZINC001098972283	1363548480	/nfs/dbraw/zinc/54/84/80/1363548480.db2.gz	ZAHBBLHWEIDYPY-LJQANCHMSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)CCc1ccoc1	ZINC001099011891	1363572165	/nfs/dbraw/zinc/57/21/65/1363572165.db2.gz	FAXBLSAWFMAZJO-GOSISDBHSA-N	0	3	348.487	3.022	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(C(C)C)cn2)C1	ZINC001099027639	1363583494	/nfs/dbraw/zinc/58/34/94/1363583494.db2.gz	OCSQTTHNTUGCPT-PXNSSMCTSA-N	0	3	327.472	3.365	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(OC(C)C)cc2)C1	ZINC001099149140	1363656044	/nfs/dbraw/zinc/65/60/44/1363656044.db2.gz	SUXPROLOYDLMCO-RXVVDRJESA-N	0	3	340.467	3.081	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)C1(C2CC2)CCOCC1	ZINC001099153411	1363659215	/nfs/dbraw/zinc/65/92/15/1363659215.db2.gz	KJBTUXQGWUBSLI-SFHVURJKSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NC[C@@H]1CCC(C)(C)CN1CC(=C)C	ZINC001099157988	1363661918	/nfs/dbraw/zinc/66/19/18/1363661918.db2.gz	CAECSGODBZFRMU-PXNSSMCTSA-N	0	3	336.520	3.398	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)C1(C)CC(=C)C1	ZINC001099228841	1363701710	/nfs/dbraw/zinc/70/17/10/1363701710.db2.gz	BLXJXRVIZHLUGH-QGZVFWFLSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)C[C@@H]2CC=CCC2)C[C@H]1C(F)(F)F	ZINC001099293501	1363735759	/nfs/dbraw/zinc/73/57/59/1363735759.db2.gz	PPSNNDJAGHEKHR-RBSFLKMASA-N	0	3	330.394	3.288	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)COc1ccsc1	ZINC001099310317	1363743014	/nfs/dbraw/zinc/74/30/14/1363743014.db2.gz	JQXGRIAQJQAOSF-HNNXBMFYSA-N	0	3	336.501	3.310	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)Cc1csc(C)n1	ZINC001099329950	1363753709	/nfs/dbraw/zinc/75/37/09/1363753709.db2.gz	YZVDMRWVBASAFY-INIZCTEOSA-N	0	3	335.517	3.177	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)COc1c(C)cccc1C	ZINC001099335323	1363757325	/nfs/dbraw/zinc/75/73/25/1363757325.db2.gz	VMRYWYUQVGRNFL-GOSISDBHSA-N	0	3	344.499	3.475	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2ccc(Cl)s2)C[C@H]1C(F)(F)F	ZINC001099339502	1363759793	/nfs/dbraw/zinc/75/97/93/1363759793.db2.gz	SJHAUSPSJNCTQP-RKDXNWHRSA-N	0	3	338.782	3.180	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@@]2(C)CC=C(C)CC2)C[C@H]1C(F)(F)F	ZINC001099346932	1363763571	/nfs/dbraw/zinc/76/35/71/1363763571.db2.gz	WJYZRVIYNJGODA-FMKPAKJESA-N	0	3	330.394	3.288	20	30		EGEDHN
CC(C)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2cc(F)ccc2C#N)C1	ZINC001099378056	1363779800	/nfs/dbraw/zinc/77/98/00/1363779800.db2.gz	JHHAVVLNZXWPHE-PXNSSMCTSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2cscn2)C1	ZINC001099489887	1363817791	/nfs/dbraw/zinc/81/77/91/1363817791.db2.gz	VRBUBPGZMGMBSO-IPELMVKDSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N[C@@H]1CN(CC(=C)C)CC2(CCOCC2)C1	ZINC001099586713	1363868579	/nfs/dbraw/zinc/86/85/79/1363868579.db2.gz	GCKABQCEPRWXHE-VNSQOFGGSA-N	0	3	332.488	3.072	20	30		EGEDHN
C=CC1(CC(=O)N[C@@H]2CCN(CC=C(C)C)C[C@H]2O)CCCCC1	ZINC001100034524	1364003256	/nfs/dbraw/zinc/00/32/56/1364003256.db2.gz	RVRDJAUSICOCNF-QZTJIDSGSA-N	0	3	334.504	3.031	20	30		EGEDHN
C=CCCC(=O)NCC1CC(NCC#Cc2ccc(Cl)cc2)C1	ZINC001100170207	1364035013	/nfs/dbraw/zinc/03/50/13/1364035013.db2.gz	CHNUHYXIVHMHGM-UHFFFAOYSA-N	0	3	330.859	3.142	20	30		EGEDHN
O=C(/C=C\C1CC1)NCC1CC(NCC#Cc2ccc(Cl)cc2)C1	ZINC001100217542	1364046562	/nfs/dbraw/zinc/04/65/62/1364046562.db2.gz	SXQLTNQVRGBZOX-YFHOEESVSA-N	0	3	342.870	3.142	20	30		EGEDHN
O=C(/C=C/C1CC1)NCC1CC(NCC#Cc2ccccc2Cl)C1	ZINC001100219189	1364046865	/nfs/dbraw/zinc/04/68/65/1364046865.db2.gz	SSDOLVAVCXMMNI-MDZDMXLPSA-N	0	3	342.870	3.142	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)NCC1CC(NCC#Cc2cccc(Cl)c2)C1	ZINC001100245983	1364056973	/nfs/dbraw/zinc/05/69/73/1364056973.db2.gz	MIHWXLZRNMLAHZ-VJFUWPCTSA-N	0	3	344.886	3.222	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)[C@H](C)CCCC)C1	ZINC001100296420	1364071316	/nfs/dbraw/zinc/07/13/16/1364071316.db2.gz	CZVJHIRLYAMZLR-LMWSTFAQSA-N	0	3	331.298	3.206	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)C[C@@H]2C=CCCC2)C1	ZINC001100439304	1364115310	/nfs/dbraw/zinc/11/53/10/1364115310.db2.gz	WBBNMMIATZUKQE-WLYUNCDWSA-N	0	3	341.293	3.126	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)Cc2ccc(C)c(Cl)c2)C1	ZINC001100439926	1364115316	/nfs/dbraw/zinc/11/53/16/1364115316.db2.gz	BAQVUNOZRWGUIE-UHFFFAOYSA-N	0	3	341.282	3.428	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC2CC(NCc3oc(C(C)C)nc3C)C2)C1	ZINC001100661409	1364208151	/nfs/dbraw/zinc/20/81/51/1364208151.db2.gz	SABRXNIBZSTDLV-UHFFFAOYSA-N	0	3	345.487	3.447	20	30		EGEDHN
CCC(CC)CC(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100794159	1364264571	/nfs/dbraw/zinc/26/45/71/1364264571.db2.gz	JMKNBXPATLDREM-UHFFFAOYSA-N	0	3	344.474	3.488	20	30		EGEDHN
CC(C)C[C@H](C)C(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1	ZINC001100796109	1364265423	/nfs/dbraw/zinc/26/54/23/1364265423.db2.gz	UKHDPROZKBWAGZ-NXVRBGIVSA-N	0	3	345.462	3.364	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@H](C)Cc2ccc(C)cc2)C1	ZINC001101047888	1364391063	/nfs/dbraw/zinc/39/10/63/1364391063.db2.gz	PWAFPCQEUIXGRO-RWBZWWBESA-N	0	3	334.891	3.411	20	30		EGEDHN
C=CCC1(C(=O)NCC2CC(NCc3cncc(F)c3)C2)CCCC1	ZINC001101080414	1364403985	/nfs/dbraw/zinc/40/39/85/1364403985.db2.gz	OHRCPHISLPGLSG-UHFFFAOYSA-N	0	3	345.462	3.342	20	30		EGEDHN
C=C(C)CN1CC[C@@H](Oc2ccnc(CNC(=O)/C=C(/C)CC)c2)C1	ZINC001101093659	1364410255	/nfs/dbraw/zinc/41/02/55/1364410255.db2.gz	GXPYWFKBEYJAIX-NXIIHZOPSA-N	0	3	343.471	3.083	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@H]2CN(CCC(F)(F)F)C[C@@]2(C)C1	ZINC001101252196	1364487031	/nfs/dbraw/zinc/48/70/31/1364487031.db2.gz	FDOAWHOIBJGHON-CJNGLKHVSA-N	0	3	332.410	3.321	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@H]2CN(Cc3scnc3C)C[C@@]2(C)C1	ZINC001101253790	1364487354	/nfs/dbraw/zinc/48/73/54/1364487354.db2.gz	XIPMAEDFWDUBSY-QAPCUYQASA-N	0	3	333.501	3.088	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@H]2CN(Cc3ncccc3C)C[C@@]2(C)C1	ZINC001101333350	1364513437	/nfs/dbraw/zinc/51/34/37/1364513437.db2.gz	REPMOOHVDJSEDO-OPYAIIAOSA-N	0	3	341.499	3.273	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@H]2CN(Cc3c(C)noc3C)C[C@@]2(C)C1	ZINC001101337951	1364516282	/nfs/dbraw/zinc/51/62/82/1364516282.db2.gz	RMSJLUPCKINZBU-QKLQHJQFSA-N	0	3	345.487	3.174	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@H]2CN(Cc3ncccc3C)C[C@@]2(C)C1	ZINC001101337958	1364516633	/nfs/dbraw/zinc/51/66/33/1364516633.db2.gz	RQEDAXFPBOUQDB-OPYAIIAOSA-N	0	3	341.499	3.273	20	30		EGEDHN
C=CCCCC(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@@]2(C)C1	ZINC001101346748	1364520054	/nfs/dbraw/zinc/52/00/54/1364520054.db2.gz	FKMCJCDNCINTLN-CTNGQTDRSA-N	0	3	337.467	3.195	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1CC2(CN(CC(CC)CC)C2)n2ccnc21	ZINC001101641623	1364667266	/nfs/dbraw/zinc/66/72/66/1364667266.db2.gz	VQNCSYRFEMSADQ-KRWDZBQOSA-N	0	3	344.503	3.248	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1CNC(=O)CCC1CC1	ZINC001101830783	1364743095	/nfs/dbraw/zinc/74/30/95/1364743095.db2.gz	AUBIUUUIVJVCNX-VQIMIIECSA-N	0	3	342.458	3.052	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@@H]1CN(Cc2oc(C)nc2C)C[C@H]1C	ZINC001102228597	1364945376	/nfs/dbraw/zinc/94/53/76/1364945376.db2.gz	HGLUVOJOOMNMJX-CRAIPNDOSA-N	0	3	345.487	3.059	20	30		EGEDHN
CC(C)=C(C)CC(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C	ZINC001102236959	1364953811	/nfs/dbraw/zinc/95/38/11/1364953811.db2.gz	WKNRGWMFQCZBTG-TZIWHRDSSA-N	0	3	338.495	3.469	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C	ZINC001102261285	1364974135	/nfs/dbraw/zinc/97/41/35/1364974135.db2.gz	ULHKKXIDXXHHES-SFHLNBCPSA-N	0	3	338.495	3.325	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@@H]1CN(Cc2cc(C)ns2)C[C@H]1C	ZINC001102261204	1364974245	/nfs/dbraw/zinc/97/42/45/1364974245.db2.gz	RFQNZBNHDXABAU-SQWLQELKSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=CCCC(=O)NCC[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1C	ZINC001102760012	1365205534	/nfs/dbraw/zinc/20/55/34/1365205534.db2.gz	ANHTXZPLEBUMAV-IEBWSBKVSA-N	0	3	342.458	3.218	20	30		EGEDHN
C[C@H](C(=O)NCC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C)C1CC1	ZINC001102826764	1365239857	/nfs/dbraw/zinc/23/98/57/1365239857.db2.gz	XITJZFJOYWKYJF-IJEWVQPXSA-N	0	3	345.512	3.240	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)C[C@@H](OCC)C(=C)C)C1	ZINC001103052548	1365356730	/nfs/dbraw/zinc/35/67/30/1365356730.db2.gz	DPAKPBDMZMEULH-DJIMGWMZSA-N	0	3	342.911	3.184	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)[C@H](C)CC(F)(F)F)C1	ZINC001103261180	1365461144	/nfs/dbraw/zinc/46/11/44/1365461144.db2.gz	LHRZRSZBWXDICU-NQBHXWOUSA-N	0	3	340.817	3.402	20	30		EGEDHN
C=CC[C@@H](C(=O)NCC[C@@H]1CN(CCF)C[C@H]1C)c1ccccc1	ZINC001103743765	1365759697	/nfs/dbraw/zinc/75/96/97/1365759697.db2.gz	RJNZKVJMWZHCDG-BHIYHBOVSA-N	0	3	332.463	3.390	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CN(C(=O)[C@H](C)CCC)C[C@H]1C	ZINC001104008366	1365872001	/nfs/dbraw/zinc/87/20/01/1365872001.db2.gz	DWNBECJYIPSIHO-UMVBOHGHSA-N	0	3	345.325	3.405	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](C)[C@H](CCN[C@H](C)c2cnccn2)C1	ZINC001104239876	1365965825	/nfs/dbraw/zinc/96/58/25/1365965825.db2.gz	UYUGSXRAXPLYJG-BRWVUGGUSA-N	0	3	344.503	3.214	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](C)[C@H](CCNCc2ocnc2C)C1	ZINC001104239853	1365966124	/nfs/dbraw/zinc/96/61/24/1365966124.db2.gz	UEUIUODCAIPYOZ-GDBMZVCRSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)C[C@@H](C)c2ccncc2)C[C@H]1C	ZINC001104346933	1365982396	/nfs/dbraw/zinc/98/23/96/1365982396.db2.gz	LOBYGXNFDDNWLK-IIDMSEBBSA-N	0	3	349.906	3.402	20	30		EGEDHN
CC(C)[C@H](F)C(=O)N1C[C@@H](C)[C@H](CCNCc2ccccc2C#N)C1	ZINC001104521029	1366060158	/nfs/dbraw/zinc/06/01/58/1366060158.db2.gz	PDOBFDDIVRHYFY-LZQZEXGQSA-N	0	3	345.462	3.127	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@@H](C)[C@H](CCNCc2ccc(F)cn2)C1	ZINC001104561885	1366077159	/nfs/dbraw/zinc/07/71/59/1366077159.db2.gz	BAFSRYIQAQUYLL-BRWVUGGUSA-N	0	3	347.478	3.397	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](C)[C@H](CCNCC(=C)Br)C1	ZINC001104606717	1366098716	/nfs/dbraw/zinc/09/87/16/1366098716.db2.gz	BVXFLOQPIKONDW-UKRRQHHQSA-N	0	3	343.309	3.326	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)C[C@@H](C)C(F)(F)F)C[C@H]1C	ZINC001104620301	1366104446	/nfs/dbraw/zinc/10/44/46/1366104446.db2.gz	FNUJNRZRIZBVRJ-NQBHXWOUSA-N	0	3	340.817	3.402	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H](C)[C@H](CCNCc2ccn(CC)n2)C1	ZINC001104631504	1366110266	/nfs/dbraw/zinc/11/02/66/1366110266.db2.gz	PWGHNDQJSKAOCK-HLIPFELVSA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2ccc(N(C)C)cc2)C[C@H]1C	ZINC001104948941	1366238227	/nfs/dbraw/zinc/23/82/27/1366238227.db2.gz	WNKXFAJEBHRKQM-RHSMWYFYSA-N	0	3	349.906	3.193	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)[C@@H](OC)C2CCCC2)C[C@H]1C	ZINC001104958426	1366242070	/nfs/dbraw/zinc/24/20/70/1366242070.db2.gz	UWCZSEZYGKMOAT-XYPHTWIQSA-N	0	3	342.911	3.018	20	30		EGEDHN
C=CC[NH2+]CC1([C@H]2CCCCN2C(=O)c2ccccc2[O-])CCC1	ZINC001105508465	1366499565	/nfs/dbraw/zinc/49/95/65/1366499565.db2.gz	CXEMDPWZPVBUSA-GOSISDBHSA-N	0	3	328.456	3.333	20	30		EGEDHN
CC/C=C(\C)C(=O)N1C[C@@H](CNCc2cc(F)ccc2C#N)[C@H](C)C1	ZINC001105895826	1366597081	/nfs/dbraw/zinc/59/70/81/1366597081.db2.gz	JATOBUMHSUIWML-ISXDEVHMSA-N	0	3	343.446	3.238	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](CNCc2csc(CC)n2)[C@H](C)C1	ZINC001106191959	1366619833	/nfs/dbraw/zinc/61/98/33/1366619833.db2.gz	TXVTXJQHJQNPPZ-HUUCEWRRSA-N	0	3	335.517	3.246	20	30		EGEDHN
CC[C@H](F)C(=O)NC[C@]12CCC[C@H]1N(Cc1ccc(C#N)s1)CC2	ZINC001107507561	1367008153	/nfs/dbraw/zinc/00/81/53/1367008153.db2.gz	CZANBQPHOFNWKZ-LZLYRXPVSA-N	0	3	349.475	3.229	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC[C@H](N(C)C/C=C/c2ccc(Cl)cc2)C1	ZINC001189400598	1367012735	/nfs/dbraw/zinc/01/27/35/1367012735.db2.gz	MGBZHHAMURGEGT-FHPLJQIUSA-N	0	3	331.847	3.046	20	30		EGEDHN
CCc1ccccc1CCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C#CC(C)C)C2	ZINC001109246154	1367024460	/nfs/dbraw/zinc/02/44/60/1367024460.db2.gz	QGPMCFUAXSHXOX-HKBOAZHASA-N	0	3	338.495	3.172	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@]12CCC[C@H]1N(Cc1ocnc1C)CC2	ZINC001107560824	1367043086	/nfs/dbraw/zinc/04/30/86/1367043086.db2.gz	YHURHNMJMKPJIC-YLJYHZDGSA-N	0	3	345.487	3.446	20	30		EGEDHN
COCC#CCN1CC[C@@]2(CNC(=O)CCCCC(C)C)CCC[C@@H]12	ZINC001107582696	1367057402	/nfs/dbraw/zinc/05/74/02/1367057402.db2.gz	QFNJDXRXYBLOLE-TZIWHRDSSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=CCOCCCC(=O)N1CC[C@H](N(C)Cc2csc(C)c2)C1	ZINC001189573154	1367057602	/nfs/dbraw/zinc/05/76/02/1367057602.db2.gz	CISDKJJYCXNRAO-KRWDZBQOSA-N	0	3	336.501	3.072	20	30		EGEDHN
CCC(=CC(=O)N1CC[C@@H](N(C)Cc2ccc(C#N)cc2)C1)CC	ZINC001189632301	1367074717	/nfs/dbraw/zinc/07/47/17/1367074717.db2.gz	NCTMGFXTNMFXJN-LJQANCHMSA-N	0	3	325.456	3.337	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)CCCCCCCC)[C@@H]2C1	ZINC001189936957	1367134725	/nfs/dbraw/zinc/13/47/25/1367134725.db2.gz	QFERQFVTDPCHQB-RBUKOAKNSA-N	0	3	336.520	3.472	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc(COC)cs1)C2	ZINC001109489068	1367155803	/nfs/dbraw/zinc/15/58/03/1367155803.db2.gz	DLDXHCRUAVRDLJ-PMPSAXMXSA-N	0	3	334.485	3.196	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C1CCCCCCC1)C2	ZINC001109505806	1367164036	/nfs/dbraw/zinc/16/40/36/1367164036.db2.gz	FYPIQEQDPIJLKG-QYZOEREBSA-N	0	3	334.504	3.271	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CC1(C)CCCCC1)C2	ZINC001109509809	1367167496	/nfs/dbraw/zinc/16/74/96/1367167496.db2.gz	QYIGAXNHZVYDKW-SQNIBIBYSA-N	0	3	334.504	3.271	20	30		EGEDHN
Cc1cc(CN(C)[C@H]2CCN(C(=O)C#CC(C)(C)C)C2)c(C)s1	ZINC001190084255	1367168491	/nfs/dbraw/zinc/16/84/91/1367168491.db2.gz	LQZYLVBDDGRLDK-KRWDZBQOSA-N	0	3	332.513	3.447	20	30		EGEDHN
C#CCCCCC(=O)NC[C@]1(C)CN(C[C@@H](C)CC(C)C)CCO1	ZINC001107883157	1367190746	/nfs/dbraw/zinc/19/07/46/1367190746.db2.gz	MIVFLPPJRFJYLN-AZUAARDMSA-N	0	3	336.520	3.069	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NC[C@@]1(C)CN(CCC(C)(C)C)CCO1	ZINC001107970563	1367224701	/nfs/dbraw/zinc/22/47/01/1367224701.db2.gz	CHUJEQSHOSNUBS-SFHVURJKSA-N	0	3	344.927	3.408	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001190329878	1367228782	/nfs/dbraw/zinc/22/87/82/1367228782.db2.gz	VMPQNORGTCOYBZ-HXUWFJFHSA-N	0	3	337.467	3.359	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2[nH]ccc2C2CC2)C1	ZINC001107990144	1367232056	/nfs/dbraw/zinc/23/20/56/1367232056.db2.gz	AWFDFKBTXYGNLW-MGPUTAFESA-N	0	3	345.487	3.068	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](N(C)CCc2csc(C)n2)C1	ZINC001190355161	1367236786	/nfs/dbraw/zinc/23/67/86/1367236786.db2.gz	UZJIWERFNXDIRL-GOSISDBHSA-N	0	3	347.528	3.295	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCc1scnc1C	ZINC001109632850	1367252305	/nfs/dbraw/zinc/25/23/05/1367252305.db2.gz	FWYFWWHYNRUWMH-SIXLDLHFSA-N	0	3	347.528	3.318	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@@H](C)c1cccc(F)c1)C2	ZINC001109706853	1367287708	/nfs/dbraw/zinc/28/77/08/1367287708.db2.gz	XENNWHRFZZGVMH-OAOYMFHYSA-N	0	3	328.431	3.064	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H]1[C@@H]3CCCCCC[C@@H]31)C2	ZINC001109759003	1367305529	/nfs/dbraw/zinc/30/55/29/1367305529.db2.gz	JJLBFTHWHVNGRV-MILMJNAHSA-N	0	3	346.515	3.127	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2ccccc2C(C)(C)C)C1	ZINC001190830362	1367362256	/nfs/dbraw/zinc/36/22/56/1367362256.db2.gz	WTQUNGGFZWYAST-QGZVFWFLSA-N	0	3	344.499	3.333	20	30		EGEDHN
CCCCCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1coc(COC)n1)C2	ZINC001109902510	1367393614	/nfs/dbraw/zinc/39/36/14/1367393614.db2.gz	NJSPPRGOEJXKNP-VYDXJSESSA-N	0	3	349.475	3.127	20	30		EGEDHN
CC(C)C1CCN([C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)CC1	ZINC001191013832	1367402126	/nfs/dbraw/zinc/40/21/26/1367402126.db2.gz	PIYQFDUOZVAJSG-LJQANCHMSA-N	0	3	325.456	3.422	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2cccc(C)c2C)C1	ZINC001108374380	1367422484	/nfs/dbraw/zinc/42/24/84/1367422484.db2.gz	KQYGPXIIGYWOOR-UTKZUKDTSA-N	0	3	344.499	3.479	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](C)Cc1ccc(OC)cc1)C2	ZINC001110131060	1367515644	/nfs/dbraw/zinc/51/56/44/1367515644.db2.gz	RGPAKJUQVDUJJY-BEKAIBRUSA-N	0	3	342.483	3.171	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](CC=C)Cc1ccccc1)C2	ZINC001110132065	1367516218	/nfs/dbraw/zinc/51/62/18/1367516218.db2.gz	UAJJACMIBYKOIP-WOZUAGRISA-N	0	3	336.479	3.166	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H]1CCCC(C)(C)C1)C2	ZINC001110172707	1367543452	/nfs/dbraw/zinc/54/34/52/1367543452.db2.gz	HVSBUPBPQXTYPO-BDXSIMOUSA-N	0	3	334.504	3.127	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](C)Cc1cccc(Cl)c1)C2	ZINC001110207523	1367564195	/nfs/dbraw/zinc/56/41/95/1367564195.db2.gz	FJQIXYPZSRRGPL-VLQPXKRTSA-N	0	3	344.886	3.263	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](N(C)CCOc2ccccc2F)C1	ZINC001191697082	1367564213	/nfs/dbraw/zinc/56/42/13/1367564213.db2.gz	RSJHRAKAGRCXRW-INIZCTEOSA-N	0	3	348.462	3.340	20	30		EGEDHN
CN(CCN(C)C(=O)c1c(F)cc(C#N)cc1F)Cc1ccccc1	ZINC001191927934	1367642441	/nfs/dbraw/zinc/64/24/41/1367642441.db2.gz	NTHZRCDLYUSKOM-UHFFFAOYSA-N	0	3	343.377	3.040	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCCc1ccccc1OC	ZINC001110378767	1367678910	/nfs/dbraw/zinc/67/89/10/1367678910.db2.gz	HDYGGBRRMQJPKA-QRVBRYPASA-N	0	3	342.483	3.316	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](N(C)Cc2ccc(OC)cc2)C1	ZINC001192586657	1367826894	/nfs/dbraw/zinc/82/68/94/1367826894.db2.gz	SUXZJAKNQOHCGO-QGZVFWFLSA-N	0	3	330.472	3.330	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)[C@H](C)c2ccc(CC)cc2)C1	ZINC001192875750	1367893936	/nfs/dbraw/zinc/89/39/36/1367893936.db2.gz	DXLKPPBNSAHGQL-YLJYHZDGSA-N	0	3	344.499	3.088	20	30		EGEDHN
CC(C)C[C@@H](C)C(=O)N1CC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001193088173	1367941129	/nfs/dbraw/zinc/94/11/29/1367941129.db2.gz	RVYMQHYKSIBURE-VQIMIIECSA-N	0	3	327.472	3.273	20	30		EGEDHN
C=CCC[C@H](O)CN(CCNC(=O)OC(C)(C)C)Cc1ccccc1	ZINC001193117410	1367948757	/nfs/dbraw/zinc/94/87/57/1367948757.db2.gz	NNKVODZDEGZATA-SFHVURJKSA-N	0	3	348.487	3.340	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@H](C)c1ccc(CC)cc1)C2	ZINC001111019977	1368144556	/nfs/dbraw/zinc/14/45/56/1368144556.db2.gz	YRVBDNVEMPOYKS-ZXNZYJFHSA-N	0	3	338.495	3.487	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@H](C)c1ccccc1F)C2	ZINC001111158786	1368169718	/nfs/dbraw/zinc/16/97/18/1368169718.db2.gz	CMMCMCHZRPHNPT-SFUIVIKGSA-N	0	3	328.431	3.064	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](N(C)CCOCC3CC3)C2)CCCC1	ZINC001194568535	1368288605	/nfs/dbraw/zinc/28/86/05/1368288605.db2.gz	SXVJFUFHEIEMHQ-GOSISDBHSA-N	0	3	334.504	3.082	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](c1ccc(F)cc1)C(C)C)C2	ZINC001111476206	1368316030	/nfs/dbraw/zinc/31/60/30/1368316030.db2.gz	UTZQFCBEJUVWQE-YSTOQKLRSA-N	0	3	342.458	3.310	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3CCC[C@@H](C)O)CCCC1	ZINC001111523039	1368325288	/nfs/dbraw/zinc/32/52/88/1368325288.db2.gz	PHVSHLJZWAKMBW-TVFCKZIOSA-N	0	3	334.504	3.005	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)C[C@H](NC(=O)CC(C)C)c1ccccc1O2	ZINC001111530671	1368330588	/nfs/dbraw/zinc/33/05/88/1368330588.db2.gz	XTNVYOATEWFVQD-RXVVDRJESA-N	0	3	340.467	3.140	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@@H](C)C(C)(C)C)C[C@H](C)O2	ZINC001111553075	1368344566	/nfs/dbraw/zinc/34/45/66/1368344566.db2.gz	UDEQSGCHMKWLGX-SJORKVTESA-N	0	3	336.520	3.327	20	30		EGEDHN
CCCCCCCCCCOC(=O)NCCCN1CCN(C)CC1	ZINC001194923930	1368348368	/nfs/dbraw/zinc/34/83/68/1368348368.db2.gz	WRYPYIVYMWLIMQ-UHFFFAOYSA-N	0	3	341.540	3.491	20	30		EGEDHN
O=C(Oc1ccccc1C(F)(F)F)N1CCC2SC(=O)C=C2C1	ZINC001195177261	1368394354	/nfs/dbraw/zinc/39/43/54/1368394354.db2.gz	YZPNUDFLWZQLEL-GFCCVEGCSA-N	0	3	343.326	3.478	20	30		EGEDHN
C=C(C)CCC(=O)N[C@]12CCC[C@H]1CN(Cc1cncc(C)c1)C2	ZINC001111763747	1368449999	/nfs/dbraw/zinc/44/99/99/1368449999.db2.gz	FSOYZRYGEVJQRZ-ICSRJNTNSA-N	0	3	327.472	3.217	20	30		EGEDHN
C#CCCCC(=O)N1CCCN(Cc2cccc3cccnc32)CC1	ZINC001195645340	1368464649	/nfs/dbraw/zinc/46/46/49/1368464649.db2.gz	PRQKINBQZOASDG-UHFFFAOYSA-N	0	3	335.451	3.073	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2ccnn2C(C)C)CC1	ZINC001195958118	1368522909	/nfs/dbraw/zinc/52/29/09/1368522909.db2.gz	PGSIFESSQXROAZ-UHFFFAOYSA-N	0	3	332.492	3.358	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2ccnn2C(F)F)CC1	ZINC001195966755	1368524993	/nfs/dbraw/zinc/52/49/93/1368524993.db2.gz	VXCCOUROVJQLGT-UHFFFAOYSA-N	0	3	340.418	3.173	20	30		EGEDHN
C=C(C)CCC(=O)N1CCCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC001196018481	1368537247	/nfs/dbraw/zinc/53/72/47/1368537247.db2.gz	WEESOXPURNUDQN-AZUAARDMSA-N	0	3	344.499	3.042	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2ncc(F)cc2F)CC1	ZINC001196294948	1368585348	/nfs/dbraw/zinc/58/53/48/1368585348.db2.gz	GEWMGZQJQCQQST-UHFFFAOYSA-N	0	3	339.430	3.478	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2cc(-c3ccccc3)no2)CC1	ZINC001196394135	1368606102	/nfs/dbraw/zinc/60/61/02/1368606102.db2.gz	ACGQOPKEQLOXQF-UHFFFAOYSA-N	0	3	339.439	3.456	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)[C@@H]2Cc3ccccc3O2)CC1	ZINC001196444962	1368616816	/nfs/dbraw/zinc/61/68/16/1368616816.db2.gz	AZPIYNXSVXZVEM-FQEVSTJZSA-N	0	3	344.499	3.495	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2onc3c2CCCC3)CC1	ZINC001196500516	1368628401	/nfs/dbraw/zinc/62/84/01/1368628401.db2.gz	LRKOHZJERUKYDL-UHFFFAOYSA-N	0	3	345.487	3.448	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCCN(C[C@H](O)C2CCCCC2)CC1	ZINC001196881239	1368705966	/nfs/dbraw/zinc/70/59/66/1368705966.db2.gz	RDZGYZQQXBGBOC-MJGOQNOKSA-N	0	3	336.520	3.064	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)C[C@H](CC)C(C)C)C[C@H]1C(F)(F)F	ZINC001112196600	1368709323	/nfs/dbraw/zinc/70/93/23/1368709323.db2.gz	TVZJGSNQAJTJCY-RRFJBIMHSA-N	0	3	332.410	3.061	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)CCCC2CCCC2)C[C@H]1C(F)(F)F	ZINC001112213055	1368721730	/nfs/dbraw/zinc/72/17/30/1368721730.db2.gz	BDJDUVKFYQPRLQ-HZPDHXFCSA-N	0	3	344.421	3.349	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2ccc3nonc3c2)CC1	ZINC001196984862	1368726430	/nfs/dbraw/zinc/72/64/30/1368726430.db2.gz	SZQCZLUSWAPMLW-UHFFFAOYSA-N	0	3	342.443	3.117	20	30		EGEDHN
C=CCCC1(C(=O)N2CCCN(CCC[C@@H]3CCOC3)CC2)CC1	ZINC001197062368	1368737313	/nfs/dbraw/zinc/73/73/13/1368737313.db2.gz	PAKPOSKOAHPBHI-GOSISDBHSA-N	0	3	334.504	3.084	20	30		EGEDHN
C#CCCN1CCCN(C(=O)CCCCCc2cccs2)CC1	ZINC001197477931	1368822729	/nfs/dbraw/zinc/82/27/29/1368822729.db2.gz	OXJIRKBUTKXNOZ-UHFFFAOYSA-N	0	3	332.513	3.409	20	30		EGEDHN
C=CCCCN1C[C@@H](O)[C@H](NC(=O)CC(C)(C)C2CCCCC2)C1	ZINC001197805640	1368902381	/nfs/dbraw/zinc/90/23/81/1368902381.db2.gz	UVJBMDZUKQZNCP-QZTJIDSGSA-N	0	3	336.520	3.111	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@@H]2CCC[C@]2(CNCc2nccs2)C1	ZINC001112515520	1368909782	/nfs/dbraw/zinc/90/97/82/1368909782.db2.gz	OEGPDFIEAUVQPG-BXWFABGCSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=CCC1(C(=O)N2CCCN(C[C@H](CC)OC)CC2)CCCCC1	ZINC001198221850	1368983864	/nfs/dbraw/zinc/98/38/64/1368983864.db2.gz	OXUYLFVRTFTFPY-SFHVURJKSA-N	0	3	336.520	3.472	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)Cc1ccsc1)c1ccccc1OC	ZINC001198507073	1369048064	/nfs/dbraw/zinc/04/80/64/1369048064.db2.gz	IYKSKBCPCLLACA-KRWDZBQOSA-N	0	3	344.480	3.322	20	30		EGEDHN
C=CCC[C@@H](C)N[C@H](CNC(=O)CSC)c1ccccc1OC	ZINC001198516213	1369050977	/nfs/dbraw/zinc/05/09/77/1369050977.db2.gz	VTLRDWRWBQRXCG-GDBMZVCRSA-N	0	3	336.501	3.160	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)c1ccoc1C)c1ccccc1OC	ZINC001198522338	1369051203	/nfs/dbraw/zinc/05/12/03/1369051203.db2.gz	JYYGWSOJSOBNFB-QGZVFWFLSA-N	0	3	328.412	3.233	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@H]1CC=CCC1)c1ccccc1OC	ZINC001198523328	1369052215	/nfs/dbraw/zinc/05/22/15/1369052215.db2.gz	VQCXNSHOZSWHRF-WMZOPIPTSA-N	0	3	328.456	3.375	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)c1cncs1)c1ccccc1OC	ZINC001198577712	1369064495	/nfs/dbraw/zinc/06/44/95/1369064495.db2.gz	LCVZYOPTWCRRRN-OAHLLOKOSA-N	0	3	345.468	3.179	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)c1cncs1)c1ccccc1OC	ZINC001198576660	1369064528	/nfs/dbraw/zinc/06/45/28/1369064528.db2.gz	DVHOCZCSBGYFKK-OAHLLOKOSA-N	0	3	345.468	3.179	20	30		EGEDHN
COc1ccccc1[C@H](CNC(=O)[C@@H](C)C#N)NCCCC(C)C	ZINC001198617324	1369074424	/nfs/dbraw/zinc/07/44/24/1369074424.db2.gz	NFYXWTRDCPCEOQ-RDJZCZTQSA-N	0	3	331.460	3.038	20	30		EGEDHN
COc1ccccc1[C@@H](CNC(=O)[C@H](C)C#N)NCCC1CCCC1	ZINC001198618098	1369074882	/nfs/dbraw/zinc/07/48/82/1369074882.db2.gz	WPLLHRJHWKJVDY-CRAIPNDOSA-N	0	3	343.471	3.182	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@@H](C)CSC)c1ccccc1OC	ZINC001198618279	1369075096	/nfs/dbraw/zinc/07/50/96/1369075096.db2.gz	XQQYXQCDPOLEGX-HOCLYGCPSA-N	0	3	336.501	3.017	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)[C@@H]1CC1(C)C)c1ccccc1OC	ZINC001198667186	1369086578	/nfs/dbraw/zinc/08/65/78/1369086578.db2.gz	DPRXDMJGCPTSRH-IRXDYDNUSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)c1coc(C)n1)c1ccccc1OC	ZINC001198685658	1369091371	/nfs/dbraw/zinc/09/13/71/1369091371.db2.gz	CMQQHPBDBYDGGT-MRXNPFEDSA-N	0	3	343.427	3.019	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)CCc2cccc(OC)c2F)CC1	ZINC001112929906	1369094433	/nfs/dbraw/zinc/09/44/33/1369094433.db2.gz	UBCZOTGJZQPYGU-MRXNPFEDSA-N	0	3	348.462	3.266	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)[C@@H]2CCc3cc(OC)ccc32)CC1	ZINC001112929852	1369094576	/nfs/dbraw/zinc/09/45/76/1369094576.db2.gz	PXNHYOQDRPWZRY-OXJNMPFZSA-N	0	3	342.483	3.224	20	30		EGEDHN
COc1ccccc1[C@@H](CNC(=O)C#CC(C)C)NCCCCCF	ZINC001198713092	1369096949	/nfs/dbraw/zinc/09/69/49/1369096949.db2.gz	MABARYNMWLUDLM-GOSISDBHSA-N	0	3	348.462	3.241	20	30		EGEDHN
CC/C=C\CCN[C@H](CNC(=O)C#CC1CC1)c1ccccc1OC	ZINC001198723408	1369099563	/nfs/dbraw/zinc/09/95/63/1369099563.db2.gz	GOZYFWUVIDMRSA-PHWHVTFISA-N	0	3	340.467	3.212	20	30		EGEDHN
C#CCC1(C(=O)NC[C@H](NCC2CC2)c2ccccc2OC)CCC1	ZINC001198752451	1369105296	/nfs/dbraw/zinc/10/52/96/1369105296.db2.gz	PVDSHEIHXGHCRI-SFHVURJKSA-N	0	3	340.467	3.046	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@H](NCC1CCC1)c1ccccc1OC	ZINC001198834622	1369125231	/nfs/dbraw/zinc/12/52/31/1369125231.db2.gz	MBAVCRZGKAWALH-KRWDZBQOSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)c1conc1C)c1ccccc1OC	ZINC001198875876	1369137381	/nfs/dbraw/zinc/13/73/81/1369137381.db2.gz	LCOXEAHNAIZRMW-KRWDZBQOSA-N	0	3	343.427	3.019	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H](O)[C@H](NC(=O)c2sccc2C(C)C)C1	ZINC001198990127	1369166521	/nfs/dbraw/zinc/16/65/21/1369166521.db2.gz	PGQDUTLPXCJLMQ-FVQBIDKESA-N	0	3	336.501	3.001	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)[C@@H]2CCc3cc(F)ccc32)CC1	ZINC001113111388	1369209804	/nfs/dbraw/zinc/20/98/04/1369209804.db2.gz	VRKPIQAQJSIYGW-DNVCBOLYSA-N	0	3	330.447	3.354	20	30		EGEDHN
N#Cc1c(F)c(Cl)ccc1NC(=S)NCCN1CCCCC1	ZINC001200433955	1369367373	/nfs/dbraw/zinc/36/73/73/1369367373.db2.gz	YQFMQLYMYJIPIZ-UHFFFAOYSA-N	0	3	340.855	3.123	20	30		EGEDHN
C=CCOc1ccccc1[C@H](C)NC(=S)NCCN1CCCCC1	ZINC001200440698	1369368331	/nfs/dbraw/zinc/36/83/31/1369368331.db2.gz	UQFNKFUANOYDIB-INIZCTEOSA-N	0	3	347.528	3.262	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC(N[C@H](C)c2cnc(C)cn2)CC1	ZINC001200748215	1369422841	/nfs/dbraw/zinc/42/28/41/1369422841.db2.gz	WMIIVLQSRASIRH-MRXNPFEDSA-N	0	3	342.487	3.195	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCCO[C@@H](CNCc2cccc(F)c2)C1	ZINC001201209606	1369496244	/nfs/dbraw/zinc/49/62/44/1369496244.db2.gz	BOZGYVLASWOERW-LPHOPBHVSA-N	0	3	348.462	3.135	20	30		EGEDHN
CC1CCC(CN2CCN(C(=O)CC#Cc3ccccc3)CC2)CC1	ZINC001113668491	1369556438	/nfs/dbraw/zinc/55/64/38/1369556438.db2.gz	KWECEWVXVKKSTG-UHFFFAOYSA-N	0	3	338.495	3.399	20	30		EGEDHN
C#CCNC[C@@H]1CN(C(=O)[C@@H](CCC)CC2CCCCC2)CCCO1	ZINC001201548751	1369573497	/nfs/dbraw/zinc/57/34/97/1369573497.db2.gz	ZDLKKJJVPQKNMB-VQTJNVASSA-N	0	3	348.531	3.213	20	30		EGEDHN
CCCCCCCN1CCO[C@H]2[C@H](OCCCn3cccn3)CC[C@@H]21	ZINC001201776294	1369622195	/nfs/dbraw/zinc/62/21/95/1369622195.db2.gz	ALMWSFOGRXASAN-XUVXKRRUSA-N	0	3	349.519	3.492	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001202107593	1369688310	/nfs/dbraw/zinc/68/83/10/1369688310.db2.gz	BMQXMXVORNNXRP-OAHLLOKOSA-N	0	3	343.446	3.380	20	30		EGEDHN
Cc1ccoc1C(=O)N[C@@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202446666	1369774734	/nfs/dbraw/zinc/77/47/34/1369774734.db2.gz	FRVYDYFEYCABCO-RTBURBONSA-N	0	3	348.446	3.270	20	30		EGEDHN
C=CCNC(=O)NCC1CN(C(c2ccccc2)c2ccccc2)C1	ZINC001202573457	1369810002	/nfs/dbraw/zinc/81/00/02/1369810002.db2.gz	LYEXFMWZTWIKPR-UHFFFAOYSA-N	0	3	335.451	3.193	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1[C@H]2CN(Cc3sc(C)nc3C)C[C@H]21	ZINC001114319986	1369881403	/nfs/dbraw/zinc/88/14/03/1369881403.db2.gz	QKEOEKFVIDEZKD-VQFNDLOPSA-N	0	3	345.512	3.075	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1C[C@@H](NCc2cc(OC)ns2)C12CCC2	ZINC001202988114	1369946993	/nfs/dbraw/zinc/94/69/93/1369946993.db2.gz	QRGPPTQEOKHKDV-HUUCEWRRSA-N	0	3	349.500	3.025	20	30		EGEDHN
CC(C)C[C@@H](C)CC(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001187004715	1388038772	/nfs/dbraw/zinc/03/87/72/1388038772.db2.gz	UZEKLDYJXWYDNL-CRAIPNDOSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1[C@H]2CN([C@H](C)c3cccc(F)c3)C[C@H]21	ZINC001114711687	1370039803	/nfs/dbraw/zinc/03/98/03/1370039803.db2.gz	ZCXNASLCOPTEKC-QKUWSGOFSA-N	0	3	328.431	3.127	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1C[C@H](NCc2ccc(F)cn2)C12CCC2	ZINC001203255684	1370043203	/nfs/dbraw/zinc/04/32/03/1370043203.db2.gz	DNDAOAXKDUKQBH-DLBZAZTESA-N	0	3	345.462	3.340	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1C[C@H](NCc2cncs2)C12CCC2	ZINC001203255502	1370043275	/nfs/dbraw/zinc/04/32/75/1370043275.db2.gz	BWGCKEUWGNFWLZ-GJZGRUSLSA-N	0	3	333.501	3.262	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1C[C@@H](NCc2ccccn2)C12CCC2	ZINC001203259978	1370046532	/nfs/dbraw/zinc/04/65/32/1370046532.db2.gz	ZMDFSTRQPUQERC-IAGOWNOFSA-N	0	3	327.472	3.201	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1[C@H]2CN(Cc3cccc(OC)c3C)C[C@H]21	ZINC001114729596	1370051289	/nfs/dbraw/zinc/05/12/89/1370051289.db2.gz	VFYMRGCPNVCUQP-OCQZMCQHSA-N	0	3	342.483	3.152	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1C[C@H](NCc2ccncc2Cl)C12CCC2	ZINC001203273251	1370054188	/nfs/dbraw/zinc/05/41/88/1370054188.db2.gz	HUSGXMSISUJNHH-HOTGVXAUSA-N	0	3	347.890	3.464	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)C2(C(F)F)CCC2)C12CCC2	ZINC001203311274	1370076508	/nfs/dbraw/zinc/07/65/08/1370076508.db2.gz	MMHQWPAEUHLCIS-VXGBXAGGSA-N	0	3	332.822	3.191	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@H](NC(=O)C(C)(C)CC)C12CCC2	ZINC001203332836	1370086323	/nfs/dbraw/zinc/08/63/23/1370086323.db2.gz	QAEQKRLFYYZYBJ-OLZOCXBDSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1C[C@@H](NCc2oc(C)nc2C)C12CCC2	ZINC001203339512	1370088843	/nfs/dbraw/zinc/08/88/43/1370088843.db2.gz	HZXRUYRKBKEZHN-SJORKVTESA-N	0	3	331.460	3.165	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1C[C@@H](NCc2oc(C)nc2C)C12CCC2	ZINC001203339508	1370089163	/nfs/dbraw/zinc/08/91/63/1370089163.db2.gz	HZXRUYRKBKEZHN-IAGOWNOFSA-N	0	3	331.460	3.165	20	30		EGEDHN
CC1(C(=O)N[C@@H]2C[C@H](NCC#Cc3ccccc3)C23CCC3)CC=CC1	ZINC001203341520	1370089874	/nfs/dbraw/zinc/08/98/74/1370089874.db2.gz	RMRUZPOONWACAW-VQTJNVASSA-N	0	3	348.490	3.411	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCC[N@@H+](Cc1ccccc1[O-])[C@@H]2CC	ZINC001203551309	1370166622	/nfs/dbraw/zinc/16/66/22/1370166622.db2.gz	BRIKUSVPZQXQSJ-QUCCMNQESA-N	0	3	328.456	3.314	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCC[N@H+](Cc1ccccc1[O-])[C@@H]2CC	ZINC001203551309	1370166627	/nfs/dbraw/zinc/16/66/27/1370166627.db2.gz	BRIKUSVPZQXQSJ-QUCCMNQESA-N	0	3	328.456	3.314	20	30		EGEDHN
COc1ccc(C[N@@H+]2CCC[C@@H](Oc3ccccc3C#N)C2)c([O-])c1	ZINC001203629300	1370193286	/nfs/dbraw/zinc/19/32/86/1370193286.db2.gz	WCAKRMZMFQIFQG-GOSISDBHSA-N	0	3	338.407	3.316	20	30		EGEDHN
COc1ccc(C[N@H+]2CCC[C@@H](Oc3ccccc3C#N)C2)c([O-])c1	ZINC001203629300	1370193287	/nfs/dbraw/zinc/19/32/87/1370193287.db2.gz	WCAKRMZMFQIFQG-GOSISDBHSA-N	0	3	338.407	3.316	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)COc2ccccc2C)C12CCC2	ZINC001203679251	1370214664	/nfs/dbraw/zinc/21/46/64/1370214664.db2.gz	TXTBDODWGTUIQU-IRXDYDNUSA-N	0	3	348.874	3.143	20	30		EGEDHN
Cc1c[nH]cc1C(=O)N[C@@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001203720467	1370234365	/nfs/dbraw/zinc/23/43/65/1370234365.db2.gz	DIGCSWURTZNNAE-VQTJNVASSA-N	0	3	347.462	3.005	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)COc2cccc(C)c2)C12CCC2	ZINC001203737554	1370241384	/nfs/dbraw/zinc/24/13/84/1370241384.db2.gz	HYIPUKKITGZDNX-SJORKVTESA-N	0	3	348.874	3.143	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@]12CCC[C@@H]1CN(Cc1cccc(C#N)c1)C2	ZINC001203758112	1370251704	/nfs/dbraw/zinc/25/17/04/1370251704.db2.gz	ZNMMZLXOGQHCHD-YLJYHZDGSA-N	0	3	341.455	3.437	20	30		EGEDHN
C=CCN1C(=O)CCC[C@]12CCCN(Cc1cccc(OC)c1)C2	ZINC001203821930	1370278241	/nfs/dbraw/zinc/27/82/41/1370278241.db2.gz	ZILLAVUMVUMAIZ-HXUWFJFHSA-N	0	3	328.456	3.228	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3O[C@H](COc4cccnc4)CC[C@H]32)cc1	ZINC001203902296	1370306716	/nfs/dbraw/zinc/30/67/16/1370306716.db2.gz	ZFUUUUQWQCNADC-PWRODBHTSA-N	0	3	349.434	3.154	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3O[C@@H](COCC4CC4)CC[C@H]32)cc1	ZINC001203901872	1370306832	/nfs/dbraw/zinc/30/68/32/1370306832.db2.gz	SVXHYWJADSJGNG-VAMGGRTRSA-N	0	3	326.440	3.107	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CN(c4cccc(F)c4)C3=O)CC2)cc1	ZINC001203904001	1370308950	/nfs/dbraw/zinc/30/89/50/1370308950.db2.gz	PFPOCSVXWCKSTO-UHFFFAOYSA-N	0	3	349.409	3.326	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2[C@H]3CN(CCOCC(C)C)C[C@H]32)CCCCC1	ZINC001115277750	1370356401	/nfs/dbraw/zinc/35/64/01/1370356401.db2.gz	GTCVRYOXPOMXDU-BWTSREIZSA-N	0	3	348.531	3.232	20	30		EGEDHN
C=C[C@@H](C(=O)N[C@@H]1[C@H]2CN(Cc3ccsc3)C[C@H]21)c1ccccc1	ZINC001115278799	1370356606	/nfs/dbraw/zinc/35/66/06/1370356606.db2.gz	YELLVXVUTVKFTM-YRXWBPOGSA-N	0	3	338.476	3.264	20	30		EGEDHN
CC(F)(F)C(=O)NCC1(NCC#Cc2ccccc2)CCCCC1	ZINC001115378691	1370418090	/nfs/dbraw/zinc/41/80/90/1370418090.db2.gz	BONWJYROUSEMLD-UHFFFAOYSA-N	0	3	334.410	3.102	20	30		EGEDHN
C=CCCC(=O)NCC1(NCC(=O)Nc2ccccc2)CCCCC1	ZINC001115441434	1370453953	/nfs/dbraw/zinc/45/39/53/1370453953.db2.gz	GCGVOMJAEFOORH-UHFFFAOYSA-N	0	3	343.471	3.000	20	30		EGEDHN
C[C@H](C#N)C(=O)NCC1(NCc2sccc2Cl)CCCCC1	ZINC001115451949	1370460173	/nfs/dbraw/zinc/46/01/73/1370460173.db2.gz	LZOAXNANVZKUII-GFCCVEGCSA-N	0	3	339.892	3.470	20	30		EGEDHN
C#CCCCC(=O)NCC1(NCc2oc(C)nc2C)CCCCC1	ZINC001115506298	1370506241	/nfs/dbraw/zinc/50/62/41/1370506241.db2.gz	BUQPYRMSDBFJPA-UHFFFAOYSA-N	0	3	331.460	3.004	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccnn2C(F)F)CCCCC1	ZINC001115555784	1370553394	/nfs/dbraw/zinc/55/33/94/1370553394.db2.gz	VULMVMQPSBQHQZ-UHFFFAOYSA-N	0	3	346.809	3.053	20	30		EGEDHN
C=C(C)CCC(=O)NCC1(NCc2cc(C)ncn2)CCCCC1	ZINC001115556866	1370554748	/nfs/dbraw/zinc/55/47/48/1370554748.db2.gz	GLAXUCQESGCJOE-UHFFFAOYSA-N	0	3	330.476	3.050	20	30		EGEDHN
COc1cccc(Nc2ccc(CN3CCN(C)CC3)cc2)c1C#N	ZINC001204759293	1370569624	/nfs/dbraw/zinc/56/96/24/1370569624.db2.gz	XQSKBIASMFUMON-UHFFFAOYSA-N	0	3	336.439	3.058	20	30		EGEDHN
C=CCn1cccc1C(=O)NCC1(NCC(=C)Cl)CCCCC1	ZINC001115573848	1370576780	/nfs/dbraw/zinc/57/67/80/1370576780.db2.gz	VYIQHOPTOIYRPO-UHFFFAOYSA-N	0	3	335.879	3.449	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC1(NCc2cnoc2C)CCCCC1	ZINC001115661500	1370645727	/nfs/dbraw/zinc/64/57/27/1370645727.db2.gz	CGQYMRKZNLEOEA-UHFFFAOYSA-N	0	3	333.476	3.494	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCC1(NCc2cnc(C)cn2)CCCCC1	ZINC001115685183	1370668912	/nfs/dbraw/zinc/66/89/12/1370668912.db2.gz	XKTKGAFNPURNII-INIZCTEOSA-N	0	3	344.503	3.296	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C[C@@H](C)C(C)C)CC[C@H]1c1ccc(F)cc1	ZINC001205263091	1370699294	/nfs/dbraw/zinc/69/92/94/1370699294.db2.gz	KEHUBOPUFQZXFR-LSTHTHJFSA-N	0	3	344.474	3.415	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC(CN[C@@H](C)c2cnc(C)cn2)CC1	ZINC001205407566	1370747119	/nfs/dbraw/zinc/74/71/19/1370747119.db2.gz	RBJCJVNMSYPWAQ-INIZCTEOSA-N	0	3	330.476	3.031	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N1C[C@@H](c2cccc(F)c2)[C@H](NCC#CC)C1	ZINC001205427293	1370752029	/nfs/dbraw/zinc/75/20/29/1370752029.db2.gz	WNARLKXCFHVSIP-RKCOZNTMSA-N	0	3	340.442	3.255	20	30		EGEDHN
N#Cc1cc(CN2CCC3(CC2)C(=O)N[C@@H]3c2ccccc2)ccc1F	ZINC001205478946	1370767394	/nfs/dbraw/zinc/76/73/94/1370767394.db2.gz	JKWNSIDNBFZURO-LJQANCHMSA-N	0	3	349.409	3.151	20	30		EGEDHN
CCCN1CCCC[C@@H]1C(=O)NCc1cccc(O[C@@H](C#N)CC)c1	ZINC001116060166	1370829619	/nfs/dbraw/zinc/82/96/19/1370829619.db2.gz	BSMBSBPZGIWNTR-IEBWSBKVSA-N	0	3	343.471	3.248	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)N1CCC(CNCc2oc(C)nc2C)CC1	ZINC001205953907	1370921498	/nfs/dbraw/zinc/92/14/98/1370921498.db2.gz	AZUDFJYCERNLBO-ZIAGYGMSSA-N	0	3	333.476	3.078	20	30		EGEDHN
N#Cc1ccccc1CNCC1CCN(C(=O)CCCC2CC2)CC1	ZINC001205961413	1370923768	/nfs/dbraw/zinc/92/37/68/1370923768.db2.gz	USENDBUVGKKWPJ-UHFFFAOYSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC(CNCc2ncc(C)s2)CC1	ZINC001205988306	1370930733	/nfs/dbraw/zinc/93/07/33/1370930733.db2.gz	DSQUZQSDMWSWJV-HNNXBMFYSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C(CN1CCCC1)c1nc(-c2ncc(Br)cc2C)no1	ZINC001206099771	1370959729	/nfs/dbraw/zinc/95/97/29/1370959729.db2.gz	DCTNWRJXXSJJSX-UHFFFAOYSA-N	0	3	349.232	3.312	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC(CNCc2csc(C)n2)CC1	ZINC001206428155	1371051515	/nfs/dbraw/zinc/05/15/15/1371051515.db2.gz	UYGBLNXYMGMYKP-UHFFFAOYSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CN(Cc2cccc(OCCC)c2)C[C@H]1C	ZINC001206537421	1371086341	/nfs/dbraw/zinc/08/63/41/1371086341.db2.gz	SXAWFDMBSYYHBC-VQIMIIECSA-N	0	3	330.472	3.378	20	30		EGEDHN
C=CCO[C@H]1CO[C@]2(C1)CCCN(Cc1ccc(C)cc1OC)C2	ZINC001206762656	1371157055	/nfs/dbraw/zinc/15/70/55/1371157055.db2.gz	OJECNWDTIBUFQJ-QUCCMNQESA-N	0	3	331.456	3.330	20	30		EGEDHN
C=C[C@H](COC)NC[C@H](O)COc1cc(C)c(Cl)cc1C(C)C	ZINC001326156314	1388120244	/nfs/dbraw/zinc/12/02/44/1388120244.db2.gz	OJDRLLQQTYCWLH-CABCVRRESA-N	0	3	341.879	3.302	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1CN(CCCc2ccccc2Cl)C[C@H]1C	ZINC001206946348	1371240109	/nfs/dbraw/zinc/24/01/09/1371240109.db2.gz	VDCBBAUFDWBEDK-VQIMIIECSA-N	0	3	346.902	3.369	20	30		EGEDHN
C=CCCOCCCCC(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC001206967769	1371251805	/nfs/dbraw/zinc/25/18/05/1371251805.db2.gz	ARKHRZUTVXHVOK-UYAOXDASSA-N	0	3	344.499	3.386	20	30		EGEDHN
CC(C)(F)C(=O)N1CCC[C@@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207046435	1371276623	/nfs/dbraw/zinc/27/66/23/1371276623.db2.gz	AORGEUILHMIZHX-MRXNPFEDSA-N	0	3	336.838	3.020	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cnc(C)s1)[C@@H]2CC	ZINC001207059183	1371280949	/nfs/dbraw/zinc/28/09/49/1371280949.db2.gz	NHFGFYPEIFRQJT-AEFFLSMTSA-N	0	3	333.501	3.373	20	30		EGEDHN
Cc1ccc(C(=O)N2CCC[C@H](NCC#Cc3ccccc3)C2)s1	ZINC001207083319	1371288536	/nfs/dbraw/zinc/28/85/36/1371288536.db2.gz	YOCBKVFUYOURAX-SFHVURJKSA-N	0	3	338.476	3.302	20	30		EGEDHN
C=CCN(CCN1CCC(OC2CCC2)CC1)C(=O)OC(C)(C)C	ZINC001207198757	1371328101	/nfs/dbraw/zinc/32/81/01/1371328101.db2.gz	IXXLVMWGPZXQQM-UHFFFAOYSA-N	0	3	338.492	3.443	20	30		EGEDHN
C=CCN(CCN1CC[C@H](c2cccnc2)C1)C(=O)OC(C)(C)C	ZINC001207205773	1371328956	/nfs/dbraw/zinc/32/89/56/1371328956.db2.gz	NXLNBTBTXFIQQV-KRWDZBQOSA-N	0	3	331.460	3.294	20	30		EGEDHN
CC/C=C(/C)C(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207566824	1371437525	/nfs/dbraw/zinc/43/75/25/1371437525.db2.gz	VIWRWOADSBDPAK-ICRRLBEQSA-N	0	3	328.431	3.114	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)C(C)(C)C)CCCCC1	ZINC001120045636	1371467033	/nfs/dbraw/zinc/46/70/33/1371467033.db2.gz	AVGLCXZPFCIORP-UHFFFAOYSA-N	0	3	331.298	3.350	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)C2(CCOC)CCC2)CCCCC1	ZINC001120062256	1371473906	/nfs/dbraw/zinc/47/39/06/1371473906.db2.gz	JRVPRRDTSGMGLT-UHFFFAOYSA-N	0	3	342.911	3.354	20	30		EGEDHN
CCC[C@H](C)C(=O)N1CCC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001207718471	1371485252	/nfs/dbraw/zinc/48/52/52/1371485252.db2.gz	QNGXJGVXJGSHAR-YOEHRIQHSA-N	0	3	331.435	3.214	20	30		EGEDHN
O=C(/C=C\C1CC1)N1CCC[C@@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207742266	1371490805	/nfs/dbraw/zinc/49/08/05/1371490805.db2.gz	UIZNWQDKWAVNOC-OEIFXAAASA-N	0	3	342.870	3.238	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC[C@@H](NCC#Cc2ccccc2Cl)C1	ZINC001207764419	1371497867	/nfs/dbraw/zinc/49/78/67/1371497867.db2.gz	OUKDDPARBCHOJO-NYXJMVDZSA-N	0	3	330.859	3.238	20	30		EGEDHN
CC[C@H](C)CC(=O)N1CCC[C@@H](NCc2cc(C#N)ccc2OC)C1	ZINC001207915530	1371538010	/nfs/dbraw/zinc/53/80/10/1371538010.db2.gz	XUZUKAMWPKYXBN-MAUKXSAKSA-N	0	3	343.471	3.084	20	30		EGEDHN
CC[C@H](C)CC(=O)N1CCC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001207915849	1371538615	/nfs/dbraw/zinc/53/86/15/1371538615.db2.gz	ZRZGSIJWSYBKGS-YOEHRIQHSA-N	0	3	331.435	3.214	20	30		EGEDHN
CCCC[C@H](C)C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001207979905	1371559133	/nfs/dbraw/zinc/55/91/33/1371559133.db2.gz	PRZUUEWIVMJTHK-ICSRJNTNSA-N	0	3	326.484	3.445	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC[C@H](NCc2ccc(Cl)cc2F)C1	ZINC001207995848	1371562376	/nfs/dbraw/zinc/56/23/76/1371562376.db2.gz	QZDQXLOGXRZEHF-INIZCTEOSA-N	0	3	336.838	3.219	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N2CCC[C@H](NC[C@H](F)CC)C2)cc1	ZINC001208029249	1371574229	/nfs/dbraw/zinc/57/42/29/1371574229.db2.gz	RQZGWSYMZRIUSP-MSOLQXFVSA-N	0	3	346.446	3.031	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H]2CN(CCc3ccccc3Cl)C[C@H]21	ZINC001187706867	1388147431	/nfs/dbraw/zinc/14/74/31/1388147431.db2.gz	TVISGDJRZWUWPX-PKOBYXMFSA-N	0	3	344.886	3.219	20	30		EGEDHN
C=CCOCc1nn(C)c2c1CN(C[C@@H]1CCC(C)=C[C@H]1C)CC2	ZINC001208171161	1371616319	/nfs/dbraw/zinc/61/63/19/1371616319.db2.gz	SODGJQYPHPEOPC-SJORKVTESA-N	0	3	329.488	3.473	20	30		EGEDHN
C=C(C)[C@@H]1CC=C(CN2CC[C@H](Oc3ncc(OC)cn3)C2)CC1	ZINC001208179173	1371623111	/nfs/dbraw/zinc/62/31/11/1371623111.db2.gz	PUUFQYLBYDRTCC-SJORKVTESA-N	0	3	329.444	3.241	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001208241114	1371676089	/nfs/dbraw/zinc/67/60/89/1371676089.db2.gz	TYEUOSYDKSAURK-KRWDZBQOSA-N	0	3	343.446	3.380	20	30		EGEDHN
CC[C@H](C)C(=O)NC1CC2(CC(NCc3cc(F)ccc3C#N)C2)C1	ZINC001120650217	1371683696	/nfs/dbraw/zinc/68/36/96/1371683696.db2.gz	AYYRJGWSGZBUGK-SNYCQEGUSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN(CCOc2cc(C)ccc2C)C[C@H]1C	ZINC001208318187	1371715296	/nfs/dbraw/zinc/71/52/96/1371715296.db2.gz	NZBYCVYGXUEBDW-QZTJIDSGSA-N	0	3	344.499	3.331	20	30		EGEDHN
C=C(Br)CNC1CC2(C1)CC(NC(=O)/C(C)=C/CC)C2	ZINC001120746901	1371739170	/nfs/dbraw/zinc/73/91/70/1371739170.db2.gz	GFQOBOSQVCWEQT-VZUCSPMQSA-N	0	3	341.293	3.268	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CN(CCOc2ccccc2C)C[C@H]1C	ZINC001208391167	1371748816	/nfs/dbraw/zinc/74/88/16/1371748816.db2.gz	KKUFMYVUFCAULR-IPMKNSEASA-N	0	3	344.499	3.413	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1CN(CCc2scnc2C)C[C@H]1C	ZINC001208392752	1371750546	/nfs/dbraw/zinc/75/05/46/1371750546.db2.gz	CVGUZRQIUUCMMM-VNQPRFMTSA-N	0	3	335.517	3.033	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN(CC[C@H]2CC2(Cl)Cl)C[C@H]1C	ZINC001208455074	1371772470	/nfs/dbraw/zinc/77/24/70/1371772470.db2.gz	ADJUUZUOYYLFSJ-HZSPNIEDSA-N	0	3	333.303	3.363	20	30		EGEDHN
C[C@H](C#N)C(=O)NC1CC2(CC(NCc3c(F)cccc3Cl)C2)C1	ZINC001120835110	1371777943	/nfs/dbraw/zinc/77/79/43/1371777943.db2.gz	WJNPCMLXQVKNDS-AZTHMUBRSA-N	0	3	349.837	3.156	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N1CCC[C@@H](NCC=C(Cl)Cl)C1	ZINC001208796864	1371899575	/nfs/dbraw/zinc/89/95/75/1371899575.db2.gz	OCXHXRYCRRQUPE-CJNGLKHVSA-N	0	3	349.302	3.115	20	30		EGEDHN
CN(CC1CN(CCCc2ccc(C#N)cc2)C1)C(=O)OC(C)(C)C	ZINC001208856774	1371920106	/nfs/dbraw/zinc/92/01/06/1371920106.db2.gz	SOTSOEXEHYWUPH-UHFFFAOYSA-N	0	3	343.471	3.290	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001208919556	1371944722	/nfs/dbraw/zinc/94/47/22/1371944722.db2.gz	UDCTVTLEQKSOON-LJQANCHMSA-N	0	3	342.458	3.360	20	30		EGEDHN
C[C@@H]1CCN(C(=O)OC(C)(C)C)CCN1CCc1ccc(C#N)cc1	ZINC001208920837	1371945103	/nfs/dbraw/zinc/94/51/03/1371945103.db2.gz	QYVFSNCXCPJFNA-MRXNPFEDSA-N	0	3	343.471	3.432	20	30		EGEDHN
C[C@H]1CCN(CCc2ccc(C#N)cc2)CCN1C(=O)OC(C)(C)C	ZINC001208925610	1371947330	/nfs/dbraw/zinc/94/73/30/1371947330.db2.gz	JPOQDDYLQBBFGY-INIZCTEOSA-N	0	3	343.471	3.432	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)CN(CCc2ccc(C#N)cc2)C1	ZINC001208927423	1371949035	/nfs/dbraw/zinc/94/90/35/1371949035.db2.gz	HSTZDQNHKDJMII-CRAIPNDOSA-N	0	3	343.471	3.336	20	30		EGEDHN
CC1(C(=O)N2CCC[C@H](NCC#Cc3ccc(Cl)cc3)C2)CCC1	ZINC001208993152	1371969948	/nfs/dbraw/zinc/96/99/48/1371969948.db2.gz	GYSASXMLKNUSFM-SFHVURJKSA-N	0	3	344.886	3.462	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC[C@H](NCc2ncccc2C)C1	ZINC001209005317	1371972898	/nfs/dbraw/zinc/97/28/98/1371972898.db2.gz	UZTABDNFKLMVOX-SFHVURJKSA-N	0	3	327.472	3.054	20	30		EGEDHN
C=CCN(CCN1CCC[C@@H]1c1ccccc1OC)C(=O)OCC	ZINC001209021722	1371977162	/nfs/dbraw/zinc/97/71/62/1371977162.db2.gz	DFSVXQOCWONOFU-QGZVFWFLSA-N	0	3	332.444	3.477	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)C[C@H](C)c2ccccc2C)C1	ZINC001209157012	1372018006	/nfs/dbraw/zinc/01/80/06/1372018006.db2.gz	GXOHSSDTZSYVPA-NLWGTHIKSA-N	0	3	344.499	3.128	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NC1CC2(CC(NCc3nccs3)C2)C1	ZINC001121611487	1372024271	/nfs/dbraw/zinc/02/42/71/1372024271.db2.gz	RQHBHJDGNZNWRV-ACXWVAMESA-N	0	3	333.501	3.118	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC1CC2(CC(NCc3cnc(C)o3)C2)C1	ZINC001121616345	1372025877	/nfs/dbraw/zinc/02/58/77/1372025877.db2.gz	IBCAZZXKGORZPH-XYLATYTLSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=CCCCC(=O)NC1CC2(C1)CC(N[C@@H](C)c1cnc(C)cn1)C2	ZINC001121668500	1372040689	/nfs/dbraw/zinc/04/06/89/1372040689.db2.gz	SINCUPURMGDCKC-AKJOHPPZSA-N	0	3	342.487	3.219	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC1CC2(CC(NCc3oc(C)nc3C)C2)C1	ZINC001121713538	1372056011	/nfs/dbraw/zinc/05/60/11/1372056011.db2.gz	JNXQNLAAQCFDIE-PUFPBPQXSA-N	0	3	345.487	3.411	20	30		EGEDHN
CCOC(=O)CCCCCCN1CCN(c2cccc(C#N)c2)CC1	ZINC001209351210	1372074525	/nfs/dbraw/zinc/07/45/25/1372074525.db2.gz	VGWUIPWJHLHWPG-UHFFFAOYSA-N	0	3	343.471	3.194	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)CC2(C=C)CCCCC2)C1	ZINC001209405843	1372095117	/nfs/dbraw/zinc/09/51/17/1372095117.db2.gz	DMJVNOJTLHGSQD-QZTJIDSGSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=CCCCCCCN1CCO[C@@H]2[C@@H](COc3ncccn3)CC[C@@H]21	ZINC001209436896	1372106463	/nfs/dbraw/zinc/10/64/63/1372106463.db2.gz	ZFHANEIBNWDBQR-CEXWTWQISA-N	0	3	345.487	3.471	20	30		EGEDHN
C=CCC1(C(=O)N2CCC[C@H](NCc3ccc(C#N)s3)C2)CCC1	ZINC001209503857	1372122474	/nfs/dbraw/zinc/12/24/74/1372122474.db2.gz	MTUJOZNDXJLDFG-HNNXBMFYSA-N	0	3	343.496	3.447	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)N1CCC[C@H]1c1cn(C)nc1C	ZINC001121925548	1372124472	/nfs/dbraw/zinc/12/44/72/1372124472.db2.gz	AKWJSENCMLJSNG-ROUUACIJSA-N	0	3	334.508	3.470	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1	ZINC001121966258	1372136622	/nfs/dbraw/zinc/13/66/22/1372136622.db2.gz	CUTUNAVGBPCAHK-MRXNPFEDSA-N	0	3	332.835	3.207	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)[C@H](C)Oc1ccccc1)C2	ZINC001122140380	1372185344	/nfs/dbraw/zinc/18/53/44/1372185344.db2.gz	CJOZDBLEZYTTBH-DKWICNMVSA-N	0	3	348.874	3.223	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)[C@@H](C)OCCC(C)C)C2	ZINC001122275304	1372219618	/nfs/dbraw/zinc/21/96/18/1372219618.db2.gz	YTKUHZJXXKIEOD-XOGYLQAWSA-N	0	3	342.911	3.207	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)c2cccc(C(C)C)c2)C1	ZINC001210002617	1372253070	/nfs/dbraw/zinc/25/30/70/1372253070.db2.gz	YXXJJHWDZNUTKF-VQIMIIECSA-N	0	3	330.472	3.063	20	30		EGEDHN
CC1(CCC(=O)N2CCC[C@@H](NCc3ccc(C#N)c(F)c3)C2)CC1	ZINC001210465666	1372360126	/nfs/dbraw/zinc/36/01/26/1372360126.db2.gz	VMOKGRJYBZQLFW-QGZVFWFLSA-N	0	3	343.446	3.358	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)C[C@@H](C)C(=O)c1cccc(F)c1	ZINC001123338033	1372431333	/nfs/dbraw/zinc/43/13/33/1372431333.db2.gz	RKZDMNSSGWICLT-DOMZBBRYSA-N	0	3	327.359	3.127	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)C(=O)N[C@@H]1CN(CC(=C)C)C[C@H]1C	ZINC001211218260	1372505701	/nfs/dbraw/zinc/50/57/01/1372505701.db2.gz	QYUDFEHQIWOPMH-MISYRCLQSA-N	0	3	326.484	3.434	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N[C@@H]1CN(Cc2ccc(C3CC3)cc2)C[C@H]1C	ZINC001211427111	1372556615	/nfs/dbraw/zinc/55/66/15/1372556615.db2.gz	AXZLUXNIVAPRLZ-JXXFODFXSA-N	0	3	342.483	3.092	20	30		EGEDHN
C=C(CN1CCCCC1)c1nc(-c2ccc(-n3cccn3)cc2)no1	ZINC001211436408	1372558545	/nfs/dbraw/zinc/55/85/45/1372558545.db2.gz	KBJMTARXZCRLCU-UHFFFAOYSA-N	0	3	335.411	3.421	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)c2ccc(CC)c(CC)c2)C1	ZINC001211502033	1372570065	/nfs/dbraw/zinc/57/00/65/1372570065.db2.gz	RUJCRPQAEQVQTJ-OXQOHEQNSA-N	0	3	344.499	3.064	20	30		EGEDHN
CC(C)C(=O)N1C[C@@H](c2ccccc2)[C@H](NCC#Cc2ccccc2)C1	ZINC001211532038	1372573978	/nfs/dbraw/zinc/57/39/78/1372573978.db2.gz	HSYWQDWDZVXFDO-FCHUYYIVSA-N	0	3	346.474	3.278	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@@H](CC)CC(F)F)[C@H](OC)C1	ZINC001212401026	1372700618	/nfs/dbraw/zinc/70/06/18/1372700618.db2.gz	BOPCRRGDWXCIHS-ARFHVFGLSA-N	0	3	348.478	3.454	20	30		EGEDHN
CCCCCCCCS(=O)(=O)NC1CCN(CC2CC2)CC1	ZINC001188030041	1388221658	/nfs/dbraw/zinc/22/16/58/1388221658.db2.gz	FSIINDFMMHPEAO-UHFFFAOYSA-N	0	3	330.538	3.141	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2ccc(CCCC)cc2)[C@H](OC)C1	ZINC001213141052	1372848230	/nfs/dbraw/zinc/84/82/30/1372848230.db2.gz	BWRMSQPFOWBNSR-WOJBJXKFSA-N	0	3	344.499	3.424	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)CCc2ccc(C(C)C)cc2)[C@H](OC)C1	ZINC001213162531	1372851195	/nfs/dbraw/zinc/85/11/95/1372851195.db2.gz	PCPIDSXMOBIADM-WOJBJXKFSA-N	0	3	344.499	3.134	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2ncc(C)cc2C)[C@H](OC)C1	ZINC001213201214	1372859560	/nfs/dbraw/zinc/85/95/60/1372859560.db2.gz	MFBFYNBUPOGMRR-QZTJIDSGSA-N	0	3	347.503	3.098	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@@H]2CCCC2(C)C)[C@H](OC)C1	ZINC001213290716	1372876915	/nfs/dbraw/zinc/87/69/15/1372876915.db2.gz	YLHZIOZILLOVFS-RCCFBDPRSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1CN(Cc2c(C)cccc2C)C[C@H]1OC	ZINC001213389668	1372899180	/nfs/dbraw/zinc/89/91/80/1372899180.db2.gz	DIFUTZYVOOBHQR-SBHAEUEKSA-N	0	3	344.499	3.221	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@@]23C[C@@H]2CCCC3)[C@H](OC)C1	ZINC001213418932	1372904036	/nfs/dbraw/zinc/90/40/36/1372904036.db2.gz	AKOXBFOORAAWJU-XFKSJGNHSA-N	0	3	336.520	3.353	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@@H]2C[C@H]2CC(C)C)[C@H](OC)C1	ZINC001213462716	1372908719	/nfs/dbraw/zinc/90/87/19/1372908719.db2.gz	MYMBQWVLAQXTGM-NCXUSEDFSA-N	0	3	338.536	3.454	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H](NC(=O)c2csc(Cl)c2)[C@H](OC)C1	ZINC001213534454	1372921167	/nfs/dbraw/zinc/92/11/67/1372921167.db2.gz	BWAGAWCRRGENRX-IACUBPJLSA-N	0	3	342.892	3.185	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@H](C)CC(C)C)[C@H](OC)C1	ZINC001213636446	1372938393	/nfs/dbraw/zinc/93/83/93/1372938393.db2.gz	NXBZWZYYHDQBET-KZNAEPCWSA-N	0	3	326.525	3.454	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2oc(CC)cc2C)[C@H](OC)C1	ZINC001213721190	1372950968	/nfs/dbraw/zinc/95/09/68/1372950968.db2.gz	FBNVKKDNOWTCDG-QZTJIDSGSA-N	0	3	348.487	3.326	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)C[C@H](C)n2cccc2)[C@H](OC)C1	ZINC001213753710	1372956481	/nfs/dbraw/zinc/95/64/81/1372956481.db2.gz	LMGSYEIBSQOUBV-IPMKNSEASA-N	0	3	347.503	3.001	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)C2CCC=CCC2)[C@H](OC)C1	ZINC001213865857	1372972008	/nfs/dbraw/zinc/97/20/08/1372972008.db2.gz	KBHARWXWERGUPV-RTBURBONSA-N	0	3	334.504	3.295	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccoc2)C[C@H]1NCC#Cc1cccc(Cl)c1	ZINC001214132064	1373013125	/nfs/dbraw/zinc/01/31/25/1373013125.db2.gz	IAFOXXUYAFFFCF-RDTXWAMCSA-N	0	3	342.826	3.035	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H]2CN(Cc3ccc(C)c(OC)c3)C[C@H]21	ZINC001188080374	1388237420	/nfs/dbraw/zinc/23/74/20/1388237420.db2.gz	CWVMLNVESPZUDU-RBUKOAKNSA-N	0	3	342.483	3.393	20	30		EGEDHN
O=C(C#CC1CC1)NCCNCc1ccccc1Oc1ccccc1	ZINC001126885844	1373046759	/nfs/dbraw/zinc/04/67/59/1373046759.db2.gz	LPYBTFLJQGXYBK-UHFFFAOYSA-N	0	3	334.419	3.098	20	30		EGEDHN
CCC[C@H](C)C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001214363788	1373049336	/nfs/dbraw/zinc/04/93/36/1373049336.db2.gz	BBUBGQHMNVIOCI-PMUMKWKESA-N	0	3	331.435	3.070	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCC2CC2)C[C@H]1NCC#Cc1cccc(Cl)c1	ZINC001214368599	1373050717	/nfs/dbraw/zinc/05/07/17/1373050717.db2.gz	FEPYJFDZRBGYDW-DNVCBOLYSA-N	0	3	344.886	3.318	20	30		EGEDHN
C/C=C(\C)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001214413723	1373057268	/nfs/dbraw/zinc/05/72/68/1373057268.db2.gz	KIVLLBHHCCDKOH-UPJFGJQXSA-N	0	3	330.859	3.094	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](C)[C@H](NCc2cccc(Cl)c2F)C1	ZINC001214529311	1373074787	/nfs/dbraw/zinc/07/47/87/1373074787.db2.gz	RDJBWTRJSYCTJY-CZUORRHYSA-N	0	3	336.838	3.219	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2(C)CC2)C[C@H]1NCC#Cc1cccc(Cl)c1	ZINC001215175046	1373182826	/nfs/dbraw/zinc/18/28/26/1373182826.db2.gz	AAAJOVSELKXMAQ-CRAIPNDOSA-N	0	3	344.886	3.318	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001215312071	1373197444	/nfs/dbraw/zinc/19/74/44/1373197444.db2.gz	PBFDCVOUAYIRLM-CRAIPNDOSA-N	0	3	344.886	3.340	20	30		EGEDHN
C=CC[C@@H](C(=O)N1C[C@@H](C)[C@H](NCc2cccnc2)C1)c1ccccc1	ZINC001216806523	1373345063	/nfs/dbraw/zinc/34/50/63/1373345063.db2.gz	RSSPBWRDOYNXKL-DUXKGJEZSA-N	0	3	349.478	3.378	20	30		EGEDHN
C#Cc1cc(C#C)cc(-c2nc(-c3ccc(CN(C)C)cc3)no2)c1	ZINC001217033964	1373380735	/nfs/dbraw/zinc/38/07/35/1373380735.db2.gz	NDQRSHNJHMJGIH-UHFFFAOYSA-N	0	3	327.387	3.428	20	30		EGEDHN
CC(C)(C(=O)NCCNCc1ccc(F)c(C#N)c1)C1CCCC1	ZINC001129624812	1373404368	/nfs/dbraw/zinc/40/43/68/1373404368.db2.gz	REKLPTRDDLIGKS-UHFFFAOYSA-N	0	3	331.435	3.120	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)C/C=C/c2cccc(F)c2)s1	ZINC001129731464	1373417407	/nfs/dbraw/zinc/41/74/07/1373417407.db2.gz	JQDKZYQCVITRCL-DUXPYHPUSA-N	0	3	343.427	3.068	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)C/C=C\c2cccc(F)c2)s1	ZINC001129731465	1373417810	/nfs/dbraw/zinc/41/78/10/1373417810.db2.gz	JQDKZYQCVITRCL-RQOWECAXSA-N	0	3	343.427	3.068	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)[C@@H]2CCC=CCCC2)cc1F	ZINC001130163696	1373466756	/nfs/dbraw/zinc/46/67/56/1373466756.db2.gz	YNWWNENWPFYHGQ-MRXNPFEDSA-N	0	3	329.419	3.040	20	30		EGEDHN
COc1ccccc1/C=C/C(=O)c1ccccc1O[C@H]1CNC[C@@H]1F	ZINC001218016822	1373538464	/nfs/dbraw/zinc/53/84/64/1373538464.db2.gz	JOAXNAUOPMUXCA-LHZNOMQLSA-N	0	3	341.382	3.280	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)C[C@H](C)C(C)(C)C)C1	ZINC001130442887	1373542077	/nfs/dbraw/zinc/54/20/77/1373542077.db2.gz	PGSYPKXOXXVTBE-GJZGRUSLSA-N	0	3	332.492	3.074	20	30		EGEDHN
CC(C)c1cccc(CC(=O)NCCNCc2cccc(C#N)c2)c1	ZINC001130826027	1373595903	/nfs/dbraw/zinc/59/59/03/1373595903.db2.gz	ZCSSQEBIVLIVQD-UHFFFAOYSA-N	0	3	335.451	3.130	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCO[C@@H]2CN(CCCC3CCC3)C[C@@H]21	ZINC001218518181	1373629289	/nfs/dbraw/zinc/62/92/89/1373629289.db2.gz	UHHSZFYJHDYJIB-NZSAHSFTSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCO[C@@H]2CN(CCCC3CCCC3)C[C@@H]21	ZINC001218522510	1373630019	/nfs/dbraw/zinc/63/00/19/1373630019.db2.gz	AQKWEKYCCNQSGT-YSIASYRMSA-N	0	3	348.531	3.471	20	30		EGEDHN
CC(C)=C[C@H]1[C@H](C(=O)NCCNCc2cccc(C#N)c2)C1(C)C	ZINC001131070751	1373636811	/nfs/dbraw/zinc/63/68/11/1373636811.db2.gz	HDZJJZJTBYHUEO-ZWKOTPCHSA-N	0	3	325.456	3.002	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)[C@@H](C)c3ccco3)[C@H]2C1	ZINC001218618882	1373637119	/nfs/dbraw/zinc/63/71/19/1373637119.db2.gz	YHUXHYDHBPJIHJ-JENIJYKNSA-N	0	3	348.487	3.265	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)Nc1ncnc2cccc(OC)c21	ZINC001218788054	1373654326	/nfs/dbraw/zinc/65/43/26/1373654326.db2.gz	KELZVEAPZMYEFS-ZDUSSCGKSA-N	0	3	328.416	3.041	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)c3cc(Cl)ccc3C)[C@H]2C1	ZINC001218810192	1373655189	/nfs/dbraw/zinc/65/51/89/1373655189.db2.gz	VIJATBHAMVWPAN-ZWKOTPCHSA-N	0	3	348.874	3.140	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)[C@@H](C)C3CCCC3)[C@H]2C1	ZINC001218941654	1373668955	/nfs/dbraw/zinc/66/89/55/1373668955.db2.gz	GPIGPVCLAPXIEQ-YSIASYRMSA-N	0	3	348.531	3.471	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)Cc2cc3ccccc3s2)c1	ZINC001131262775	1373671638	/nfs/dbraw/zinc/67/16/38/1373671638.db2.gz	LSMLIDVVOWOFSZ-UHFFFAOYSA-N	0	3	349.459	3.221	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2ccccc2CC(C)(C)C)[C@@H](O)C1	ZINC001219855293	1373735991	/nfs/dbraw/zinc/73/59/91/1373735991.db2.gz	VHWPSSUFTGSMGA-MOPGFXCFSA-N	0	3	344.499	3.016	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)CCCC(C)(C)C)C[C@H](C)O2	ZINC001131642564	1373740830	/nfs/dbraw/zinc/74/08/30/1373740830.db2.gz	RRKRLKYBWAXZLN-PXNSSMCTSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@H](C)O[C@@]2(CCN(CC=C(C)C)C2)C1	ZINC001131661275	1373748879	/nfs/dbraw/zinc/74/88/79/1373748879.db2.gz	LZDFIGNIRHDFHI-GHTZIAJQSA-N	0	3	346.515	3.413	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](C)O[C@]3(CCN(CC=C(C)C)C3)C2)CCC1	ZINC001131681626	1373759633	/nfs/dbraw/zinc/75/96/33/1373759633.db2.gz	FRXXCDCCPDBQSD-NQIIRXRSSA-N	0	3	346.515	3.391	20	30		EGEDHN
C=CCC[C@@H](C(=O)N[C@@H]1CN(CCCCC)C[C@@H]1O)c1ccccc1	ZINC001221199246	1373768243	/nfs/dbraw/zinc/76/82/43/1373768243.db2.gz	RYUFRLNCAFOXHJ-AQNXPRMDSA-N	0	3	344.499	3.088	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)[C@H]2CCCC[C@H]2C2CC2)s1	ZINC001131742039	1373781032	/nfs/dbraw/zinc/78/10/32/1373781032.db2.gz	PTTWEYFFJRZLEI-IRXDYDNUSA-N	0	3	331.485	3.042	20	30		EGEDHN
C=CCCCCCN1CC[C@@H]2CN(C(=O)c3ccc(COC)o3)[C@@H]2C1	ZINC001221678679	1373788664	/nfs/dbraw/zinc/78/86/64/1373788664.db2.gz	VRFNGPFZWPHKQJ-SJLPKXTDSA-N	0	3	346.471	3.319	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)C(=O)N1C[C@H]2CCN(CCCF)C[C@H]21	ZINC001222037214	1373812562	/nfs/dbraw/zinc/81/25/62/1373812562.db2.gz	WEGRWKGMFFYCDR-VAMGGRTRSA-N	0	3	344.474	3.314	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)c1ccc(Oc2cccnc2)cc1	ZINC001188630775	1388347638	/nfs/dbraw/zinc/34/76/38/1388347638.db2.gz	PGCRLYCYDFJYDC-KRWDZBQOSA-N	0	3	337.423	3.254	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CC[C@@H](C)N(CCOc2ccc(C)cc2)C1	ZINC001131996913	1375089571	/nfs/dbraw/zinc/08/95/71/1375089571.db2.gz	ZSTPYCHNMALVJN-MOPGFXCFSA-N	0	3	342.483	3.146	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@@H](C)N(Cc2cccc(OC)c2C)C1	ZINC001132003210	1375094423	/nfs/dbraw/zinc/09/44/23/1375094423.db2.gz	REASBICIASXGFJ-VQIMIIECSA-N	0	3	342.483	3.276	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H]1CC[C@H](C)N(CCCc2ccsc2)C1	ZINC001132022148	1375103188	/nfs/dbraw/zinc/10/31/88/1375103188.db2.gz	VOQDELFBVYZGSF-WMZOPIPTSA-N	0	3	332.513	3.309	20	30		EGEDHN
C[C@@H]1CC[C@@H](NC(=O)C#CC2CC2)CN1Cc1ccccc1C1CC1	ZINC001132033404	1375107265	/nfs/dbraw/zinc/10/72/65/1375107265.db2.gz	FXCHMYZUGBBDNT-OXQOHEQNSA-N	0	3	336.479	3.447	20	30		EGEDHN
C[C@H]1CC[C@@H](NC(=O)C#CC(C)(C)C)CN1CC1CC(F)(F)C1	ZINC001132037423	1375109743	/nfs/dbraw/zinc/10/97/43/1375109743.db2.gz	BRNNMMUIDACCCW-DZGCQCFKSA-N	0	3	326.431	3.050	20	30		EGEDHN
CC[C@H](F)CN1CCC(CNC(=O)CC#Cc2ccccc2)CC1	ZINC001225525945	1375118834	/nfs/dbraw/zinc/11/88/34/1375118834.db2.gz	SRIXRMOASPTWDE-IBGZPJMESA-N	0	3	330.447	3.005	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COCc2ccc(C)cc2)CC[C@H]1C	ZINC001132082395	1375136834	/nfs/dbraw/zinc/13/68/34/1375136834.db2.gz	GOGXSICELAYZSG-IEBWSBKVSA-N	0	3	330.472	3.057	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2cn3cc(C)nc3s2)CC[C@@H]1C	ZINC001132097271	1375145292	/nfs/dbraw/zinc/14/52/92/1375145292.db2.gz	HUKLASLUOUKYKZ-GJZGRUSLSA-N	0	3	346.500	3.253	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCOc2ccc(C)c(C)c2)CC[C@@H]1C	ZINC001132097609	1375146288	/nfs/dbraw/zinc/14/62/88/1375146288.db2.gz	MBYSOIWJFGOPJK-ZWKOTPCHSA-N	0	3	330.472	3.227	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)C[C@H](C)CC	ZINC001225898485	1375171911	/nfs/dbraw/zinc/17/19/11/1375171911.db2.gz	IAPGTPYWFZKETQ-MRVWCRGKSA-N	0	3	331.298	3.348	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2cc3ccsc3[nH]2)CC[C@H]1C	ZINC001132207383	1375210375	/nfs/dbraw/zinc/21/03/75/1375210375.db2.gz	UEDJGYAZYIDHMZ-HIFRSBDPSA-N	0	3	347.484	3.015	20	30		EGEDHN
CCCCCCC[N@@H+]1C[C@@H](NC(=O)c2c(C)nc[n-]c2=O)CC[C@@H]1C	ZINC001132235686	1375230221	/nfs/dbraw/zinc/23/02/21/1375230221.db2.gz	ROKUPACLVQGOMW-HOCLYGCPSA-N	0	3	348.491	3.044	20	30		EGEDHN
CCCCCCC[N@H+]1C[C@@H](NC(=O)c2c(C)nc[n-]c2=O)CC[C@@H]1C	ZINC001132235686	1375230228	/nfs/dbraw/zinc/23/02/28/1375230228.db2.gz	ROKUPACLVQGOMW-HOCLYGCPSA-N	0	3	348.491	3.044	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1CC[C@H](C)N(CCOCC(C)C)C1	ZINC001132240361	1375234739	/nfs/dbraw/zinc/23/47/39/1375234739.db2.gz	FTVXQXKGAFGJQR-OALUTQOASA-N	0	3	336.520	3.212	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCCOCc2ccccc2)CC[C@@H]1C	ZINC001132261131	1375253405	/nfs/dbraw/zinc/25/34/05/1375253405.db2.gz	KRVJGLKUNBOUKV-HKUYNNGSSA-N	0	3	330.472	3.139	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCc2cc(Cl)cs2)CC[C@H]1C	ZINC001132330393	1375309669	/nfs/dbraw/zinc/30/96/69/1375309669.db2.gz	GOKFOQLMMDEFPA-OCCSQVGLSA-N	0	3	326.893	3.489	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCc2cc(Cl)cs2)CC[C@@H]1C	ZINC001132330392	1375310583	/nfs/dbraw/zinc/31/05/83/1375310583.db2.gz	GOKFOQLMMDEFPA-JSGCOSHPSA-N	0	3	326.893	3.489	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2CCCC[C@H]2NCc2c(C)noc2C)CCC1	ZINC001226720207	1375317213	/nfs/dbraw/zinc/31/72/13/1375317213.db2.gz	GCIOVGNOEYFROR-QZTJIDSGSA-N	0	3	343.471	3.002	20	30		EGEDHN
C#CCCCCC(=O)NC1CCN(CCc2ccccc2F)CC1	ZINC001226952096	1375368843	/nfs/dbraw/zinc/36/88/43/1375368843.db2.gz	RKAUTCXXVSWEEM-UHFFFAOYSA-N	0	3	330.447	3.142	20	30		EGEDHN
C#CCCCC(=O)NC1CCN(CCOc2c(C)cccc2C)CC1	ZINC001227108140	1375391209	/nfs/dbraw/zinc/39/12/09/1375391209.db2.gz	MLFGKYWQYCSTNN-UHFFFAOYSA-N	0	3	342.483	3.066	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CC[C@@H](C)N(CC=C(C)C)C2)CCOCC1	ZINC001132454044	1375396671	/nfs/dbraw/zinc/39/66/71/1375396671.db2.gz	VGLVFCCIAGZGCS-QZTJIDSGSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COc2ccc(Cl)cc2)CC[C@H]1C	ZINC001132457924	1375399755	/nfs/dbraw/zinc/39/97/55/1375399755.db2.gz	NKLNZUBOFUOULZ-GDBMZVCRSA-N	0	3	336.863	3.264	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COc2cccc(Cl)c2)CC[C@H]1C	ZINC001132468019	1375410531	/nfs/dbraw/zinc/41/05/31/1375410531.db2.gz	LIAHQHQVVVWAIK-ZBFHGGJFSA-N	0	3	336.863	3.264	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCc2ccccc2OC)CC[C@@H]1C	ZINC001132469966	1375412144	/nfs/dbraw/zinc/41/21/44/1375412144.db2.gz	ZIAICZKXBRVDGG-FUHWJXTLSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1CC[C@H](C)N(Cc2ccc(C)cc2C)C1	ZINC001132532462	1375444279	/nfs/dbraw/zinc/44/42/79/1375444279.db2.gz	DIUCSWNFLVUYIL-ICSRJNTNSA-N	0	3	344.499	3.365	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC1CCN(CCOc2ccccc2)CC1	ZINC001227570690	1375445541	/nfs/dbraw/zinc/44/55/41/1375445541.db2.gz	POWOQTFGBPJRDF-UHFFFAOYSA-N	0	3	330.472	3.248	20	30		EGEDHN
C=C(C)CCC(=O)NC1CCN(Cc2cccc(N(C)C)c2)CC1	ZINC001227588930	1375449152	/nfs/dbraw/zinc/44/91/52/1375449152.db2.gz	ZKADRJMZOZIUSL-UHFFFAOYSA-N	0	3	329.488	3.190	20	30		EGEDHN
C#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)/C(C)=C\CC)CC1	ZINC001132551933	1375458126	/nfs/dbraw/zinc/45/81/26/1375458126.db2.gz	OVPSETZVYLTLDO-BFHGZXLWSA-N	0	3	339.483	3.254	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2(CCc3ccccc3)CC2)CC[C@H]1C	ZINC001132551540	1375458149	/nfs/dbraw/zinc/45/81/49/1375458149.db2.gz	JAABMSDOJVLVFM-QUCCMNQESA-N	0	3	338.495	3.392	20	30		EGEDHN
C#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)C(C)(C)CC)CC1	ZINC001132554758	1375460987	/nfs/dbraw/zinc/46/09/87/1375460987.db2.gz	LPIVUVOFPVRJAK-LJQANCHMSA-N	0	3	341.499	3.334	20	30		EGEDHN
C#CCN1CC[C@@H](CN(Cc2scnc2C)C(=O)C[C@H](C)CC)C1	ZINC001132557807	1375463911	/nfs/dbraw/zinc/46/39/11/1375463911.db2.gz	DOIUTUYEJAQMIK-NVXWUHKLSA-N	0	3	347.528	3.171	20	30		EGEDHN
C#CCN1CC[C@@H](CN(Cc2scnc2C)C(=O)[C@H](C)C(C)C)C1	ZINC001132562061	1375468437	/nfs/dbraw/zinc/46/84/37/1375468437.db2.gz	DNIJEGZJDMAIKX-NVXWUHKLSA-N	0	3	347.528	3.027	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2N(Cc2ccsc2)C(=O)CC2CC2)CC1	ZINC001132563338	1375469262	/nfs/dbraw/zinc/46/92/62/1375469262.db2.gz	RIVZXEHRPURDDR-SFHVURJKSA-N	0	3	342.508	3.365	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2N(Cc2nccs2)C(=O)C(C)(C)C)CC1	ZINC001132583389	1375475912	/nfs/dbraw/zinc/47/59/12/1375475912.db2.gz	ZMIDIJMTUMAWTK-HNNXBMFYSA-N	0	3	345.512	3.006	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CCCC[C@H]1NCc1cnn(C(C)(C)C)c1	ZINC001227973073	1375496708	/nfs/dbraw/zinc/49/67/08/1375496708.db2.gz	LMZMJGHGRKZAOO-IAGOWNOFSA-N	0	3	346.519	3.367	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCCNCc1ccc(Br)s1	ZINC001132667843	1375505360	/nfs/dbraw/zinc/50/53/60/1375505360.db2.gz	UUDKOSPMBZXIIT-NSHDSACASA-N	0	3	345.306	3.319	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCCNCc1ccc(Br)s1	ZINC001132671370	1375507081	/nfs/dbraw/zinc/50/70/81/1375507081.db2.gz	PMUFKQJBJNZSLO-LLVKDONJSA-N	0	3	345.306	3.319	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](C)[C@@H](CNCc2cnc(C)o2)C1	ZINC001132845897	1375597229	/nfs/dbraw/zinc/59/72/29/1375597229.db2.gz	CJETVLXVDWNZMJ-HOCLYGCPSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](C)[C@@H](CNCc2cc(C)no2)C1	ZINC001132847467	1375599654	/nfs/dbraw/zinc/59/96/54/1375599654.db2.gz	YJZAQDPONDMJSX-HOCLYGCPSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC1CCN(Cc2ccc3c(c2)COC3)CC1	ZINC001228786403	1375675745	/nfs/dbraw/zinc/67/57/45/1375675745.db2.gz	ISXGFBDFTRGYKV-MRXNPFEDSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](C)[C@H](CNCc2nc(C)cs2)C1	ZINC001133090736	1375768508	/nfs/dbraw/zinc/76/85/08/1375768508.db2.gz	KWCXHIMLCQWOLU-GOEBONIOSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](C)[C@H](CNCc2nc(C)cs2)C1	ZINC001133090735	1375768669	/nfs/dbraw/zinc/76/86/69/1375768669.db2.gz	KWCXHIMLCQWOLU-GDBMZVCRSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](C)[C@H](CNCc3cnc(C)o3)C2)CCC1	ZINC001133104785	1375777529	/nfs/dbraw/zinc/77/75/29/1375777529.db2.gz	KCYFOESLJPQXCD-NVXWUHKLSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](C)[C@H](CNCc3cscn3)C2)CC1	ZINC001133105542	1375778441	/nfs/dbraw/zinc/77/84/41/1375778441.db2.gz	VCTQKIRZYHMDMX-HZPDHXFCSA-N	0	3	347.528	3.464	20	30		EGEDHN
Oc1ccccc1/C=N/N=C/c1ccccc1O[C@@H]1CN2CCC1CC2	ZINC001229294455	1375805010	/nfs/dbraw/zinc/80/50/10/1375805010.db2.gz	PDXAJMWIHKGNLY-OXFCDLJJSA-N	0	3	349.434	3.318	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC1CCN(CCc2scnc2C)CC1	ZINC001229376750	1375822545	/nfs/dbraw/zinc/82/25/45/1375822545.db2.gz	IDUKSBMHPUEBEW-UHFFFAOYSA-N	0	3	335.517	3.177	20	30		EGEDHN
Cc1cc(C(=O)NCCNCc2ccc(C#N)c(F)c2)ccc1Cl	ZINC001133244829	1375866086	/nfs/dbraw/zinc/86/60/86/1375866086.db2.gz	PQJYMJHXCPGUJK-UHFFFAOYSA-N	0	3	345.805	3.179	20	30		EGEDHN
Cc1ccc(C(=O)NCCNCc2ccc(C#N)s2)cc1Cl	ZINC001133261228	1375875842	/nfs/dbraw/zinc/87/58/42/1375875842.db2.gz	GDDPGHNAXUGVKB-UHFFFAOYSA-N	0	3	333.844	3.101	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc(F)c(Cl)c2F)cc1	ZINC001133318158	1375919056	/nfs/dbraw/zinc/91/90/56/1375919056.db2.gz	HPTKCRYTKDCXGQ-UHFFFAOYSA-N	0	3	349.768	3.009	20	30		EGEDHN
C=CCCC1(C(=O)NCCNCc2ccccc2OC(C)C)CC1	ZINC001133375791	1375955238	/nfs/dbraw/zinc/95/52/38/1375955238.db2.gz	JAHDGNPJTSDGED-UHFFFAOYSA-N	0	3	330.472	3.426	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)/C=C/C1CC1	ZINC001133391089	1375976178	/nfs/dbraw/zinc/97/61/78/1375976178.db2.gz	WYZDAGSKYODDOH-MDZDMXLPSA-N	0	3	330.859	3.248	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H](c1ccccc1)N(C)C	ZINC001230280396	1375982374	/nfs/dbraw/zinc/98/23/74/1375982374.db2.gz	WHDIGOPHJKENDF-KURKYZTESA-N	0	3	349.906	3.059	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H](c1ccccc1)N(C)C	ZINC001230280398	1375982446	/nfs/dbraw/zinc/98/24/46/1375982446.db2.gz	WHDIGOPHJKENDF-KZNAEPCWSA-N	0	3	349.906	3.059	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C1(C2CC2)CCC1	ZINC001133401798	1375987154	/nfs/dbraw/zinc/98/71/54/1375987154.db2.gz	NVAFVJCUDLDUQP-UHFFFAOYSA-N	0	3	344.886	3.472	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@H](F)C(C)C	ZINC001133403761	1375988657	/nfs/dbraw/zinc/98/86/57/1375988657.db2.gz	HJBSWDOTVDUURB-QGZVFWFLSA-N	0	3	338.854	3.276	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H]1C[C@]1(C)CC	ZINC001133407529	1375992660	/nfs/dbraw/zinc/99/26/60/1375992660.db2.gz	IXHVZKYBQOPGEU-HKUYNNGSSA-N	0	3	332.875	3.328	20	30		EGEDHN
Cc1occc1C(=O)N[C@H](C)C[C@@H](C)NCc1cc(F)ccc1C#N	ZINC001133627653	1376125887	/nfs/dbraw/zinc/12/58/87/1376125887.db2.gz	IFZWBUZQLJHULD-CHWSQXEVSA-N	0	3	343.402	3.286	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)[C@@H](C)C(F)(F)F)Cc1cccnc1	ZINC001230813742	1376156559	/nfs/dbraw/zinc/15/65/59/1376156559.db2.gz	FBSLFEZXUWPHBO-CQSZACIVSA-N	0	3	343.393	3.164	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)[C@@H]1CC[C@@H](F)C1)Cc1cccnc1	ZINC001230824541	1376159927	/nfs/dbraw/zinc/15/99/27/1376159927.db2.gz	FHOIZXONGOIZKP-QZTJIDSGSA-N	0	3	333.451	3.104	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)CC/C=C/c2ccccc2)c1	ZINC001133700838	1376164503	/nfs/dbraw/zinc/16/45/03/1376164503.db2.gz	UFWZGVGEVFWNEG-RUDMXATFSA-N	0	3	333.435	3.258	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)c1cc(C)[nH]c1C)Cc1cccnc1	ZINC001230859832	1376166783	/nfs/dbraw/zinc/16/67/83/1376166783.db2.gz	RPQFDLWAWFOFCA-UHFFFAOYSA-N	0	3	340.471	3.225	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H]2CN(CCOc3cccc(F)c3)C[C@H]21	ZINC001188985226	1388427777	/nfs/dbraw/zinc/42/77/77/1388427777.db2.gz	AUULUFMNSMASRH-QFBILLFUSA-N	0	3	346.446	3.094	20	30		EGEDHN
CCSCCC(=O)N[C@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001133806982	1376213465	/nfs/dbraw/zinc/21/34/65/1376213465.db2.gz	DWCUYOWVONVNRW-HUUCEWRRSA-N	0	3	333.501	3.074	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H]2CN(Cc3ccc(C)c(OC)c3)C[C@H]21	ZINC001189007661	1388434539	/nfs/dbraw/zinc/43/45/39/1388434539.db2.gz	YCLNWJSNIWAKFT-RBUKOAKNSA-N	0	3	342.483	3.393	20	30		EGEDHN
C=CCOCCCC(=O)N[C@H](C)C[C@H](C)NC/C(Cl)=C\Cl	ZINC001134019121	1376315949	/nfs/dbraw/zinc/31/59/49/1376315949.db2.gz	RUKIKFMLSKRIPH-NNQLKGDCSA-N	0	3	337.291	3.161	20	30		EGEDHN
C#CCCCCC(=O)N[C@H](C)C[C@H](C)NCc1cc(C2CC2)no1	ZINC001134119317	1376378047	/nfs/dbraw/zinc/37/80/47/1376378047.db2.gz	PFQODQIXGVESHP-LSDHHAIUSA-N	0	3	331.460	3.119	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)C1=CCCC1)NCc1cc(F)ccc1C#N	ZINC001134119319	1376378102	/nfs/dbraw/zinc/37/81/02/1376378102.db2.gz	PHGDEANOEDXKNN-KGLIPLIRSA-N	0	3	329.419	3.181	20	30		EGEDHN
Cc1coc(C)c1C(=O)N[C@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001134256553	1376439948	/nfs/dbraw/zinc/43/99/48/1376439948.db2.gz	LQOFHYLBKAABLB-HUUCEWRRSA-N	0	3	339.439	3.455	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)c1ccsc1C	ZINC001134319428	1376474042	/nfs/dbraw/zinc/47/40/42/1376474042.db2.gz	ZUBNFGHXZRVZJT-QWRGUYRKSA-N	0	3	345.306	3.452	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H]3CN(CCOCC4CCC4)C[C@H]32)CC1	ZINC001189040450	1388444414	/nfs/dbraw/zinc/44/44/14/1388444414.db2.gz	BSRAZVNCGYXAKI-VQTJNVASSA-N	0	3	346.515	3.082	20	30		EGEDHN
O=C1C=C2CN(Cc3ccc(-n4cccn4)cc3Cl)CCC2S1	ZINC001232594015	1376484957	/nfs/dbraw/zinc/48/49/57/1376484957.db2.gz	FMGYCKXDSNIGJJ-INIZCTEOSA-N	0	3	345.855	3.300	20	30		EGEDHN
CCC[C@H](COC)N(CCC(=O)OCC)Cc1ccc(C#N)s1	ZINC001232847385	1376523876	/nfs/dbraw/zinc/52/38/76/1376523876.db2.gz	VSVZLCNUQFUAQL-CQSZACIVSA-N	0	3	338.473	3.190	20	30		EGEDHN
C=CCN1C(=O)CCC[C@@]12CCCN(Cc1cc(C)cc(O)c1)C2	ZINC001232878618	1376529048	/nfs/dbraw/zinc/52/90/48/1376529048.db2.gz	QFXPNPODGJUMNG-FQEVSTJZSA-N	0	3	328.456	3.234	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H](C)C[C@@H](C)NCc1cc(F)ccc1C#N	ZINC001134470781	1376555514	/nfs/dbraw/zinc/55/55/14/1376555514.db2.gz	SFFVGNNEZDJKTJ-CABCVRRESA-N	0	3	331.435	3.427	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CC[C@]2(C[C@@H](Oc3cccnc3)CO2)C1	ZINC001233081296	1376568097	/nfs/dbraw/zinc/56/80/97/1376568097.db2.gz	BWUQTMYBTVZBKZ-RTWAWAEBSA-N	0	3	349.434	3.074	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CC(CCNC(=O)OC(C)(C)C)C1	ZINC001233083031	1376568382	/nfs/dbraw/zinc/56/83/82/1376568382.db2.gz	PWONTDWAWXSZRD-UHFFFAOYSA-N	0	3	329.444	3.213	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)CCC(C)(F)F)NCc1ccccc1C#N	ZINC001134761705	1376706729	/nfs/dbraw/zinc/70/67/29/1376706729.db2.gz	RZTJLADJOUJCJE-KBPBESRZSA-N	0	3	337.414	3.367	20	30		EGEDHN
CC(C)C#CC(=O)N(C)C[C@@H]1CCN1CC1CCC(F)(F)CC1	ZINC001234162556	1376781282	/nfs/dbraw/zinc/78/12/82/1376781282.db2.gz	SZGJASZBZNALDR-INIZCTEOSA-N	0	3	326.431	3.004	20	30		EGEDHN
C=CCC[C@H](C)N1CC[C@H]1CN(C)C(=O)c1coc(C(C)(C)C)n1	ZINC001234265086	1376794120	/nfs/dbraw/zinc/79/41/20/1376794120.db2.gz	HBODPBXIXBQDJH-GJZGRUSLSA-N	0	3	333.476	3.473	20	30		EGEDHN
C=CCCOCCCCC(=O)N(C)C[C@@H]1CCN1CC[C@@H](C)F	ZINC001234276204	1376797885	/nfs/dbraw/zinc/79/78/85/1376797885.db2.gz	JZFQNZFITSTAJL-SJORKVTESA-N	0	3	328.472	3.030	20	30		EGEDHN
C=CCCCCCN1CC[C@@H]1CN(C)C(=O)Cc1ccncc1C	ZINC001234358297	1376818379	/nfs/dbraw/zinc/81/83/79/1376818379.db2.gz	ZMXWDGFBIFXNGC-LJQANCHMSA-N	0	3	329.488	3.212	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@](C)(OC)c1ccccc1F	ZINC001235124083	1376854228	/nfs/dbraw/zinc/85/42/28/1376854228.db2.gz	OIANYKVYIZVBRO-OXQOHEQNSA-N	0	3	348.462	3.186	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@@](C)(OC)c1ccccc1F	ZINC001235124084	1376855223	/nfs/dbraw/zinc/85/52/23/1376855223.db2.gz	OIANYKVYIZVBRO-UZLBHIALSA-N	0	3	348.462	3.186	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)[C@H]1C[C@H]2C[C@H]2C1)NCc1cc(F)ccc1C#N	ZINC001135247134	1377000417	/nfs/dbraw/zinc/00/04/17/1377000417.db2.gz	QHLGLPXNZCJWQS-ZLVKTETGSA-N	0	3	343.446	3.116	20	30		EGEDHN
CCC1(C(=O)N[C@H](C)C[C@H](C)NCc2cc(F)ccc2C#N)CC1	ZINC001135391075	1377069682	/nfs/dbraw/zinc/06/96/82/1377069682.db2.gz	QKJFDOQVYKKVHM-UONOGXRCSA-N	0	3	331.435	3.260	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)CC(C)(F)F)NCc1cc(F)ccc1C#N	ZINC001135402561	1377076298	/nfs/dbraw/zinc/07/62/98/1377076298.db2.gz	OELNFMJXSAYKPT-RYUDHWBXSA-N	0	3	341.377	3.116	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1ccccc1C#N)NC(=O)c1ccc(Cl)[nH]1	ZINC001135435833	1377097293	/nfs/dbraw/zinc/09/72/93/1377097293.db2.gz	WTGUCDVVNAHYHJ-QWHCGFSZSA-N	0	3	344.846	3.226	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)C[C@@H](C)CCC=C(C)C)[C@@H]2C1	ZINC001189212922	1388485558	/nfs/dbraw/zinc/48/55/58/1388485558.db2.gz	QLONTWUYAVDOAU-SLFFLAALSA-N	0	3	348.531	3.494	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)c1ccc(C)cc1	ZINC001136006163	1377296552	/nfs/dbraw/zinc/29/65/52/1377296552.db2.gz	JCCAEGLRMKMEPV-KBPBESRZSA-N	0	3	339.277	3.390	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CC[C@H](N(C)Cc2csc(C)c2)C1	ZINC001189241574	1388493748	/nfs/dbraw/zinc/49/37/48/1388493748.db2.gz	AMNWWACSCBFPPR-WBVHZDCISA-N	0	3	336.501	3.070	20	30		EGEDHN
CC(F)(F)CCC(=O)NC[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001266754549	1377376932	/nfs/dbraw/zinc/37/69/32/1377376932.db2.gz	DBQFIRFPLIDEHV-QGZVFWFLSA-N	0	3	349.425	3.322	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CC[C@H](N(C)C/C=C\c2ccccc2)C1	ZINC001189243336	1388494449	/nfs/dbraw/zinc/49/44/49/1388494449.db2.gz	VATFCKZBMVVPMV-HCFXTEOXSA-N	0	3	342.483	3.214	20	30		EGEDHN
N#CCOc1ccc(CN2CC[C@@H](Oc3ccc(F)cc3)C2)cc1	ZINC001137119297	1377481613	/nfs/dbraw/zinc/48/16/13/1377481613.db2.gz	DTTPYUKREQVZLX-LJQANCHMSA-N	0	3	326.371	3.381	20	30		EGEDHN
N#Cc1ccccc1O[C@@H]1CCCN(Cc2c[nH]c3ncccc23)C1	ZINC001137404955	1377541462	/nfs/dbraw/zinc/54/14/62/1377541462.db2.gz	XSJXVYJNBZIZEU-QGZVFWFLSA-N	0	3	332.407	3.478	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CN(Cc3ccc(N(C)C)s3)C2)CC1	ZINC001138488963	1377731779	/nfs/dbraw/zinc/73/17/79/1377731779.db2.gz	AEPMSCZEGJHXRS-UHFFFAOYSA-N	0	3	349.500	3.035	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCCC[C@](O)(C(F)(F)F)C2)c1[O-]	ZINC001138625948	1377755507	/nfs/dbraw/zinc/75/55/07/1377755507.db2.gz	XYGCEFBUUGJPJW-MRXNPFEDSA-N	0	3	329.362	3.400	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCCC[C@](O)(C(F)(F)F)C2)c1[O-]	ZINC001138625948	1377755510	/nfs/dbraw/zinc/75/55/10/1377755510.db2.gz	XYGCEFBUUGJPJW-MRXNPFEDSA-N	0	3	329.362	3.400	20	30		EGEDHN
C=CCc1cccc(C[NH+]2C[C@@H]3CN(Cc4cccnc4)C[C@H]3C2)c1[O-]	ZINC001138626596	1377755800	/nfs/dbraw/zinc/75/58/00/1377755800.db2.gz	LJASTBLBPSKGNR-SFTDATJTSA-N	0	3	349.478	3.080	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@H]3OCCC[C@@]3(COC)C2)c1[O-]	ZINC001138627804	1377756592	/nfs/dbraw/zinc/75/65/92/1377756592.db2.gz	PDVHTGLXIRRLMN-QUCCMNQESA-N	0	3	331.456	3.138	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@H]3OCCC[C@@]3(COC)C2)c1[O-]	ZINC001138627804	1377756593	/nfs/dbraw/zinc/75/65/93/1377756593.db2.gz	PDVHTGLXIRRLMN-QUCCMNQESA-N	0	3	331.456	3.138	20	30		EGEDHN
C=CCN(CC=C)CCN1CCN(Cc2ccc3occc3c2)CC1	ZINC001138825610	1377792793	/nfs/dbraw/zinc/79/27/93/1377792793.db2.gz	CPLGHWVYVPSTOP-UHFFFAOYSA-N	0	3	339.483	3.224	20	30		EGEDHN
COC(=O)c1cc(CN2CCC(c3cccc(C#N)c3)CC2)cn1C	ZINC001139372901	1377875895	/nfs/dbraw/zinc/87/58/95/1377875895.db2.gz	NLVMBLHVFWBAOL-UHFFFAOYSA-N	0	3	337.423	3.063	20	30		EGEDHN
N#Cc1ccc(Oc2ccc(CN3CC[C@H]4COC[C@@H]4C3)cn2)cc1	ZINC001139427837	1377883439	/nfs/dbraw/zinc/88/34/39/1377883439.db2.gz	UBMMODBTCGLYCZ-ROUUACIJSA-N	0	3	335.407	3.214	20	30		EGEDHN
CCOC(=O)C1(C)CCN(Cc2c[nH]c3c2cccc3C#N)CC1	ZINC001139703032	1377937566	/nfs/dbraw/zinc/93/75/66/1377937566.db2.gz	HDFLGXCQNNACKO-UHFFFAOYSA-N	0	3	325.412	3.205	20	30		EGEDHN
CN(CCN(C)C(=O)OC(C)(C)C)Cc1c[nH]c2ccc(C#N)cc12	ZINC001140110052	1378009238	/nfs/dbraw/zinc/00/92/38/1378009238.db2.gz	AWEMRSZQQVWUKK-UHFFFAOYSA-N	0	3	342.443	3.338	20	30		EGEDHN
COC(=O)N1CCC2(CCN(Cc3ccc(C#N)cc3F)CC2)CC1	ZINC001140134998	1378016832	/nfs/dbraw/zinc/01/68/32/1378016832.db2.gz	MTSURMZXNBZXGC-UHFFFAOYSA-N	0	3	345.418	3.142	20	30		EGEDHN
N#Cc1c(F)cc(CN2CC[C@H](N3CCCCC3)[C@@H](F)C2)cc1F	ZINC001140755420	1378130844	/nfs/dbraw/zinc/13/08/44/1378130844.db2.gz	FCRJQRKJWAGWOG-ROUUACIJSA-N	0	3	337.389	3.235	20	30		EGEDHN
CC(=O)NC1CCN(Cc2ccc(Oc3ccc(C#N)cc3)cc2)CC1	ZINC001141287541	1378292565	/nfs/dbraw/zinc/29/25/65/1378292565.db2.gz	HCRBVOFLAUKQMX-UHFFFAOYSA-N	0	3	349.434	3.451	20	30		EGEDHN
COc1ccc(F)c(CN2CCC3SC(=O)C=C3C2)c1Cl	ZINC001143363920	1378587493	/nfs/dbraw/zinc/58/74/93/1378587493.db2.gz	YSXLEOXJTMSKJG-CYBMUJFWSA-N	0	3	327.808	3.262	20	30		EGEDHN
C=CCN1C(=O)CCC[C@]12CCCN(Cc1cccc(O)c1C)C2	ZINC001144110327	1378683114	/nfs/dbraw/zinc/68/31/14/1378683114.db2.gz	KNCSKCYWGLLKLJ-HXUWFJFHSA-N	0	3	328.456	3.234	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)C[C@H](C)NCc2conc2C)CCCCC1	ZINC001146702625	1378902736	/nfs/dbraw/zinc/90/27/36/1378902736.db2.gz	YHDOUAZPGIBKTP-JKSUJKDBSA-N	0	3	345.487	3.330	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2cnc(C)o2)CCCC1	ZINC001146819606	1378927420	/nfs/dbraw/zinc/92/74/20/1378927420.db2.gz	BFYIMGVTSIDLGQ-GJZGRUSLSA-N	0	3	333.476	3.492	20	30		EGEDHN
CN(C(=O)CC1CCC1)[C@@H](CNCc1cc(C#N)ccc1F)C1CC1	ZINC001283491309	1378983710	/nfs/dbraw/zinc/98/37/10/1378983710.db2.gz	ACXFATCASOMHEG-IBGZPJMESA-N	0	3	343.446	3.214	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001147250914	1378998124	/nfs/dbraw/zinc/99/81/24/1378998124.db2.gz	PFVUHCUNNIPCFW-MRXNPFEDSA-N	0	3	325.456	3.029	20	30		EGEDHN
C=C(C)CCC(=O)N1CC2(C1)CCN(Cc1ccc(C)nc1C)C2	ZINC001147639996	1379054017	/nfs/dbraw/zinc/05/40/17/1379054017.db2.gz	LDEMNACZLURDKO-UHFFFAOYSA-N	0	3	327.472	3.089	20	30		EGEDHN
C[C@H](CCC(C)(C)C)C(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001147786452	1379078631	/nfs/dbraw/zinc/07/86/31/1379078631.db2.gz	DVSUNWZSSCZXGK-CQSZACIVSA-N	0	3	333.451	3.366	20	30		EGEDHN
CC1(C)CCC[C@@H](CC(=O)NCCNCc2ccc(C#N)s2)C1	ZINC001147856104	1379091035	/nfs/dbraw/zinc/09/10/35/1379091035.db2.gz	HCFCENGZKYXULZ-AWEZNQCLSA-N	0	3	333.501	3.432	20	30		EGEDHN
CC(C)[C@H]1CN(C(=O)c2cccc(Nc3ccc(C#N)cc3)c2)CCN1	ZINC001148128474	1379122221	/nfs/dbraw/zinc/12/22/21/1379122221.db2.gz	IQXOYLKAEGATHK-HXUWFJFHSA-N	0	3	348.450	3.372	20	30		EGEDHN
C=CCCCC(=O)N1CC2(C1)CCN(CCO[C@H]1CCCC[C@H]1C)C2	ZINC001148180865	1379128577	/nfs/dbraw/zinc/12/85/77/1379128577.db2.gz	FQBIJPNVTPJPIS-MOPGFXCFSA-N	0	3	348.531	3.472	20	30		EGEDHN
CC(C)n1cccc1C(=O)N(C)C[C@@H](C)NCc1ccc(C#N)s1	ZINC001283715701	1379139206	/nfs/dbraw/zinc/13/92/06/1379139206.db2.gz	VKGJAOHLRPFXEP-CQSZACIVSA-N	0	3	344.484	3.252	20	30		EGEDHN
C=CCC1(C(=O)N2CC3(C2)CCN(CCOCC2CCC2)C3)CCC1	ZINC001148248517	1379139231	/nfs/dbraw/zinc/13/92/31/1379139231.db2.gz	AEQLIABDXXQNBA-UHFFFAOYSA-N	0	3	346.515	3.084	20	30		EGEDHN
CCCCCCCCCC(=O)NCCN[C@@H](C)C(=O)NC(C)(C)C	ZINC001148823755	1379276758	/nfs/dbraw/zinc/27/67/58/1379276758.db2.gz	DSCXREKVXKITSY-INIZCTEOSA-N	0	3	341.540	3.136	20	30		EGEDHN
C=CCC1(C(=O)NCCNCc2cc3ccccc3o2)CCOCC1	ZINC001149305865	1379362785	/nfs/dbraw/zinc/36/27/85/1379362785.db2.gz	KKSPMHSGYSVOEY-UHFFFAOYSA-N	0	3	342.439	3.012	20	30		EGEDHN
C[C@H](c1ccccc1)N1CCCO[C@H](CNC(=O)C#CC(C)(C)C)C1	ZINC001149686656	1379428016	/nfs/dbraw/zinc/42/80/16/1379428016.db2.gz	FYDTUXPECPXQAV-IEBWSBKVSA-N	0	3	342.483	3.004	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H]1CN(Cc2ccccc2CC)CCCO1	ZINC001149787925	1379445794	/nfs/dbraw/zinc/44/57/94/1379445794.db2.gz	BGXPMFBIJOZIKF-HXUWFJFHSA-N	0	3	344.499	3.312	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@H]1CN([C@@H](C)c2cccc(C)c2)CCCO1	ZINC001150086153	1379493116	/nfs/dbraw/zinc/49/31/16/1379493116.db2.gz	XVHXNZXPVFDJGC-HKUYNNGSSA-N	0	3	344.499	3.475	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@@H]1CN(Cc2ccc(C)cc2)CCCO1	ZINC001150140165	1379501282	/nfs/dbraw/zinc/50/12/82/1379501282.db2.gz	QMFNAMLJUZULML-AZUAARDMSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@H]1CN(Cc2cccc(C)c2)CCCO1	ZINC001150246616	1379521689	/nfs/dbraw/zinc/52/16/89/1379521689.db2.gz	GMRZQQUYCQQYOL-FPOVZHCZSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)C[C@H](C)c2cccc(F)c2)C1	ZINC001150282676	1379528387	/nfs/dbraw/zinc/52/83/87/1379528387.db2.gz	PHXGUXHKBHPZBR-QFBILLFUSA-N	0	3	348.462	3.103	20	30		EGEDHN
C=CC1(CC(=O)NC[C@@H]2CN(CC(=C)C)CCCO2)CCCCC1	ZINC001150436474	1379552567	/nfs/dbraw/zinc/55/25/67/1379552567.db2.gz	SJCIBCMXGDTHOB-GOSISDBHSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)[C@@H](F)CCCCCC)C1	ZINC001150588024	1379574452	/nfs/dbraw/zinc/57/44/52/1379574452.db2.gz	LYURJPAETZERIE-IRXDYDNUSA-N	0	3	328.472	3.078	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)C[C@H]2CCCC(C)(C)C2)C1	ZINC001150590111	1379574952	/nfs/dbraw/zinc/57/49/52/1379574952.db2.gz	YVJIFFANIUGDCY-QZTJIDSGSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C[C@@H](CC(=O)NC[C@@H]1CN(CC(=C)C)CCCO1)c1ccccc1	ZINC001150770375	1379611089	/nfs/dbraw/zinc/61/10/89/1379611089.db2.gz	FHHIYPGTDFYRNJ-AZUAARDMSA-N	0	3	342.483	3.130	20	30		EGEDHN
C#CCCN1CCCO[C@@H](CNC(=O)[C@@](C)(CC)CCCCC)C1	ZINC001150796854	1379617013	/nfs/dbraw/zinc/61/70/13/1379617013.db2.gz	XVIAGOSZWKAHLY-ICSRJNTNSA-N	0	3	336.520	3.213	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2c[nH]cc2-c2ccccc2)c1	ZINC001151073484	1379657679	/nfs/dbraw/zinc/65/76/79/1379657679.db2.gz	MSTZJHPUUWYOTD-UHFFFAOYSA-N	0	3	344.418	3.073	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2csc(C)c2C)CC1	ZINC001151145827	1379667823	/nfs/dbraw/zinc/66/78/23/1379667823.db2.gz	YVEIEELNNBLUCF-UHFFFAOYSA-N	0	3	336.501	3.152	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@@H]2CCC[C@@H]2CCC)CC1	ZINC001151210253	1379677166	/nfs/dbraw/zinc/67/71/66/1379677166.db2.gz	RWCVCDRYQSAJJU-ZWKOTPCHSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2occc2CC)CC1	ZINC001151294615	1379694850	/nfs/dbraw/zinc/69/48/50/1379694850.db2.gz	NCGMXNDXPGFITK-UHFFFAOYSA-N	0	3	334.460	3.019	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2cc[nH]c2C2CCC2)CC1	ZINC001151326401	1379699580	/nfs/dbraw/zinc/69/95/80/1379699580.db2.gz	ANRDTUKYBXJQKS-UHFFFAOYSA-N	0	3	345.487	3.069	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@H]2CCCC[C@@H]2CC)CC1	ZINC001151382133	1379709494	/nfs/dbraw/zinc/70/94/94/1379709494.db2.gz	YJJRBZMSZQOFKT-ROUUACIJSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2cc3c(s2)CCC3)CC1	ZINC001151406319	1379712419	/nfs/dbraw/zinc/71/24/19/1379712419.db2.gz	BOJJXUIQYYLEKC-UHFFFAOYSA-N	0	3	348.512	3.024	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)CCc2ccc(C)o2)CC1	ZINC001151413239	1379714901	/nfs/dbraw/zinc/71/49/01/1379714901.db2.gz	SGBYBUUQNZPBHX-UHFFFAOYSA-N	0	3	348.487	3.084	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)Cc1ccsc1	ZINC001151670713	1379761247	/nfs/dbraw/zinc/76/12/47/1379761247.db2.gz	UVSWTVOMFQNYOR-OAHLLOKOSA-N	0	3	341.480	3.189	20	30		EGEDHN
C=CC[C@@H](C(=O)NCCNCc1ccc(C#N)cc1)c1ccccc1	ZINC001151837697	1379793613	/nfs/dbraw/zinc/79/36/13/1379793613.db2.gz	ADQPCEZZEDGBKJ-HXUWFJFHSA-N	0	3	333.435	3.124	20	30		EGEDHN
CC(C)(C)c1ccc(C(=O)NCCNCc2ccc(C#N)s2)s1	ZINC001151947485	1379823162	/nfs/dbraw/zinc/82/31/62/1379823162.db2.gz	ZJGXGQOMAZXOLH-UHFFFAOYSA-N	0	3	347.509	3.498	20	30		EGEDHN
CCC(CC)C(=O)NC[C@@H](C)N(CC)Cc1ccc(F)c(C#N)c1	ZINC001151981188	1379830968	/nfs/dbraw/zinc/83/09/68/1379830968.db2.gz	UBDOZGDTQWGTSE-CQSZACIVSA-N	0	3	333.451	3.460	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)c1cc(C)c(C)o1	ZINC001152764095	1379979716	/nfs/dbraw/zinc/97/97/16/1379979716.db2.gz	UWACBUILKXOZAR-OAHLLOKOSA-N	0	3	339.439	3.409	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)c1cc(C)c(C)o1	ZINC001152768878	1379980043	/nfs/dbraw/zinc/98/00/43/1379980043.db2.gz	GLYGCJCPPSQKHB-OAHLLOKOSA-N	0	3	339.439	3.409	20	30		EGEDHN
Cc1cc(CCC(=O)NCCNCc2ccc(C#N)s2)c(C)s1	ZINC001152884976	1379989973	/nfs/dbraw/zinc/98/99/73/1379989973.db2.gz	NYECUKBMZIQFJE-UHFFFAOYSA-N	0	3	347.509	3.137	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NCCNC1c2ccccc2-c2ccccc21	ZINC001153135494	1380026750	/nfs/dbraw/zinc/02/67/50/1380026750.db2.gz	VFRAQHZULIBEPC-HNNXBMFYSA-N	0	3	336.435	3.053	20	30		EGEDHN
Cc1ccccc1C(C)(C)C(=O)NCCNCc1ccc(C#N)s1	ZINC001153648965	1380110498	/nfs/dbraw/zinc/11/04/98/1380110498.db2.gz	FPSRBDKUOYKOQX-UHFFFAOYSA-N	0	3	341.480	3.112	20	30		EGEDHN
C#CC[C@@H](CC(=O)NCCNCc1cccc(F)c1)c1ccccc1	ZINC001153713900	1380117297	/nfs/dbraw/zinc/11/72/97/1380117297.db2.gz	BJAXLSBNFLRXKT-IBGZPJMESA-N	0	3	338.426	3.229	20	30		EGEDHN
Cc1ccc(/C=C\CC(=O)NCCNCc2cccc(C#N)c2)cc1	ZINC001153974193	1380165835	/nfs/dbraw/zinc/16/58/35/1380165835.db2.gz	LHVWKFJQQAKSDG-ARJAWSKDSA-N	0	3	333.435	3.176	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)C1(C)CCCC1	ZINC001154516042	1380295024	/nfs/dbraw/zinc/29/50/24/1380295024.db2.gz	ODRZSDBXXHBXOE-MRXNPFEDSA-N	0	3	327.472	3.465	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@@H](C)N(CC)CCc1csc(C)n1	ZINC001154609611	1380316959	/nfs/dbraw/zinc/31/69/59/1380316959.db2.gz	PKUZFTHQOFHJGU-MRXNPFEDSA-N	0	3	349.544	3.404	20	30		EGEDHN
CCC[C@@H](OCC)C(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)cc1	ZINC001154757970	1380347449	/nfs/dbraw/zinc/34/74/49/1380347449.db2.gz	WVHDIUVBNIAJEL-VQIMIIECSA-N	0	3	345.487	3.090	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)C1(C(F)F)CCC1	ZINC001154812934	1380357233	/nfs/dbraw/zinc/35/72/33/1380357233.db2.gz	DMZDKNYCERWSGW-CQSZACIVSA-N	0	3	349.425	3.320	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H](C)N(CC)Cc1cccc(NC(C)=O)c1	ZINC001154958029	1380381134	/nfs/dbraw/zinc/38/11/34/1380381134.db2.gz	XDMFKPMOONFEEE-MRXNPFEDSA-N	0	3	345.487	3.328	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)[C@]12C[C@H]1CCCC2	ZINC001155120433	1380412437	/nfs/dbraw/zinc/41/24/37/1380412437.db2.gz	RFOGQEZXFBPDTQ-OZOXKJRCSA-N	0	3	339.483	3.465	20	30		EGEDHN
N#Cc1cnc(-n2nccc2CN)c2cc(-c3ccccc3)sc21	ZINC001155125278	1380413523	/nfs/dbraw/zinc/41/35/23/1380413523.db2.gz	NFBUEUYQBIJCBW-UHFFFAOYSA-N	0	3	331.404	3.479	20	30		EGEDHN
C=C(Cl)CNCC1(O)CCN(C(=O)[C@@H](CCC)CC(C)C)CC1	ZINC001755156033	1440763156	/nfs/dbraw/zinc/76/31/56/1440763156.db2.gz	MGHJQDLTZWAJNJ-INIZCTEOSA-N	0	3	344.927	3.144	20	30		EGEDHN
CC(C(=O)NCCCNCc1cc(C#N)ccc1F)=C1CCCC1	ZINC001156429550	1380574971	/nfs/dbraw/zinc/57/49/71/1380574971.db2.gz	CLAZWEKQTLZLDF-UHFFFAOYSA-N	0	3	329.419	3.184	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)COc1ccccc1C(C)C	ZINC001156773292	1380631866	/nfs/dbraw/zinc/63/18/66/1380631866.db2.gz	GVUWXCQMARKXSW-QGZVFWFLSA-N	0	3	330.472	3.039	20	30		EGEDHN
Cc1c(Cl)c(Cl)nc(-n2nc(CN)c3ccccc32)c1C#N	ZINC001156855416	1380696668	/nfs/dbraw/zinc/69/66/68/1380696668.db2.gz	IJWUBNGBYBQBBJ-UHFFFAOYSA-N	0	3	332.194	3.366	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)CC[C@H]1CCc2ccccc21	ZINC001157053178	1380761675	/nfs/dbraw/zinc/76/16/75/1380761675.db2.gz	OEYLLDCSAZTNLH-IEBWSBKVSA-N	0	3	326.484	3.347	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C1(c2ccc(C)cc2)CCC1	ZINC001157190817	1380803549	/nfs/dbraw/zinc/80/35/49/1380803549.db2.gz	SRCUICLZEWMWAD-GOSISDBHSA-N	0	3	326.484	3.267	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc2ccccc2c(=O)[nH]1	ZINC001158061898	1381116740	/nfs/dbraw/zinc/11/67/40/1381116740.db2.gz	UQALUKIZUXVUFS-MRXNPFEDSA-N	0	3	339.439	3.053	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)C[C@H]1C=CCCC1	ZINC001158113822	1381131519	/nfs/dbraw/zinc/13/15/19/1381131519.db2.gz	XAIATPALVCTMSS-RBUKOAKNSA-N	0	3	334.504	3.248	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1COc2ccc(Cl)cc21	ZINC001158221173	1381163617	/nfs/dbraw/zinc/16/36/17/1381163617.db2.gz	LJDFICDALLQQKS-NVXWUHKLSA-N	0	3	348.874	3.315	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H]1CCCc2cccnc21	ZINC001158363948	1381219004	/nfs/dbraw/zinc/21/90/04/1381219004.db2.gz	OEGMFBBWKCBEFH-MSOLQXFVSA-N	0	3	327.472	3.000	20	30		EGEDHN
CN1CCN(C(F)(F)c2cnc(Cl)c(C#N)c2)C2(CCCC2)C1	ZINC001158410229	1381236104	/nfs/dbraw/zinc/23/61/04/1381236104.db2.gz	OCONZLIYUGKMCD-UHFFFAOYSA-N	0	3	340.805	3.216	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc(F)c(F)c(F)c1	ZINC001158512752	1381274713	/nfs/dbraw/zinc/27/47/13/1381274713.db2.gz	WYIHKUZCSGHCEE-CYBMUJFWSA-N	0	3	326.362	3.216	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1sccc1Cl	ZINC001158560549	1381299801	/nfs/dbraw/zinc/29/98/01/1381299801.db2.gz	NSOHZAADVXDFCA-UHFFFAOYSA-N	0	3	333.844	3.183	20	30		EGEDHN
C[C@@H]1CCC[C@H]1CC(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001158620021	1381324866	/nfs/dbraw/zinc/32/48/66/1381324866.db2.gz	ZGPVYPKGENWIOR-ZBFHGGJFSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc2cccnc2s1	ZINC001158689542	1381353905	/nfs/dbraw/zinc/35/39/05/1381353905.db2.gz	MOFZRMQAIWUILM-OAHLLOKOSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc(C(F)(F)F)ccn1	ZINC001158697067	1381357086	/nfs/dbraw/zinc/35/70/86/1381357086.db2.gz	MQEWMYNDIHPUDK-CQSZACIVSA-N	0	3	341.377	3.213	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NCCCNCc1cccc(Cl)n1	ZINC001158856883	1381437827	/nfs/dbraw/zinc/43/78/27/1381437827.db2.gz	IXDLMIOLVLMYFS-UHFFFAOYSA-N	0	3	330.259	3.110	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)CCc1cc(F)ccc1F	ZINC001158914306	1381460897	/nfs/dbraw/zinc/46/08/97/1381460897.db2.gz	MNNNRVQZFVESBM-QGZVFWFLSA-N	0	3	336.426	3.396	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1ccc(C)c2cccnc12	ZINC001328376604	1388732381	/nfs/dbraw/zinc/73/23/81/1388732381.db2.gz	PBCYUWDBLBHADW-AWEZNQCLSA-N	0	3	331.847	3.394	20	30		EGEDHN
CCOC(=O)[C@@H]1CCCc2sc(NC3=CNCCC3)c(C#N)c21	ZINC001159167080	1381695084	/nfs/dbraw/zinc/69/50/84/1381695084.db2.gz	JCQFPNRNKNQWIF-GFCCVEGCSA-N	0	3	331.441	3.239	20	30		EGEDHN
N#Cc1cnn(-c2ccc(Br)cc2)c1NC1=CNCCC1	ZINC001159268819	1381748115	/nfs/dbraw/zinc/74/81/15/1381748115.db2.gz	RCEZRSSDUGYMPO-UHFFFAOYSA-N	0	3	344.216	3.143	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc(Cl)c(Cl)n2C)CC1	ZINC001160296251	1382065360	/nfs/dbraw/zinc/06/53/60/1382065360.db2.gz	DSFRTIAWWRRVTM-UHFFFAOYSA-N	0	3	342.270	3.270	20	30		EGEDHN
N#Cc1ccc(CN2CC=C(CCNC(=O)C3(C4CC4)CC3)CC2)cc1	ZINC001160437551	1382103359	/nfs/dbraw/zinc/10/33/59/1382103359.db2.gz	AHPNUASYSDEJJW-UHFFFAOYSA-N	0	3	349.478	3.387	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H]2CCOc3c(F)cccc32)CC1	ZINC001160640913	1382158721	/nfs/dbraw/zinc/15/87/21/1382158721.db2.gz	BSJYWUSIIGMSNO-QGZVFWFLSA-N	0	3	344.430	3.016	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C2([C@H]3CCCCO3)CCC2)CC1	ZINC001160658191	1382162301	/nfs/dbraw/zinc/16/23/01/1382162301.db2.gz	RYIRCOPEBCGPDE-GOSISDBHSA-N	0	3	332.488	3.050	20	30		EGEDHN
CC(C)(C)c1ccc(C[C@@H](N)C(=O)N(CC#N)Cc2ccccc2)cc1	ZINC001160670341	1382166135	/nfs/dbraw/zinc/16/61/35/1382166135.db2.gz	XEVNJOBHWDHRIL-HXUWFJFHSA-N	0	3	349.478	3.406	20	30		EGEDHN
C#CCCCCCC(=O)NCCC1=CCN(CCOCC(C)C)CC1	ZINC001160915201	1382232829	/nfs/dbraw/zinc/23/28/29/1382232829.db2.gz	NQXCEGBWYUNTIA-UHFFFAOYSA-N	0	3	348.531	3.381	20	30		EGEDHN
C=CCN1CCC[C@H]1CNc1nc(Cl)nc2c1ncn2C(C)C	ZINC001160954462	1382249786	/nfs/dbraw/zinc/24/97/86/1382249786.db2.gz	VBLGZWZIUDLJBR-LBPRGKRZSA-N	0	3	334.855	3.123	20	30		EGEDHN
C=CCN1CCC[C@H]1CNc1cncc(Oc2cccc(OC)c2)n1	ZINC001160954164	1382250322	/nfs/dbraw/zinc/25/03/22/1382250322.db2.gz	PZPPEBQEAPHJPK-HNNXBMFYSA-N	0	3	340.427	3.340	20	30		EGEDHN
C=CCN1CCC[C@H]1CNc1ncccc1C(=O)NC1CCCCC1	ZINC001160953176	1382250360	/nfs/dbraw/zinc/25/03/60/1382250360.db2.gz	VDIXPFVBMYXNRM-KRWDZBQOSA-N	0	3	342.487	3.206	20	30		EGEDHN
N#Cc1cnc(NCC2CCN(Cc3ccccc3F)CC2)c(C#N)c1	ZINC001161193869	1382335944	/nfs/dbraw/zinc/33/59/44/1382335944.db2.gz	HGGFOPQTQSIITF-UHFFFAOYSA-N	0	3	349.413	3.288	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CCCc2ccc(F)cc2)CC1	ZINC001161314178	1382368319	/nfs/dbraw/zinc/36/83/19/1382368319.db2.gz	NNBOECPOWXLNSF-UHFFFAOYSA-N	0	3	330.447	3.473	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccncc2C(F)(F)F)CC1	ZINC001161627278	1382464201	/nfs/dbraw/zinc/46/42/01/1382464201.db2.gz	FFDWGSWWCYGERF-UHFFFAOYSA-N	0	3	339.361	3.038	20	30		EGEDHN
N#C[C@@H](Nc1cccc2cc([C@H]3CNCCO3)cn21)c1ccccc1	ZINC001161721163	1382489059	/nfs/dbraw/zinc/48/90/59/1382489059.db2.gz	LIXKPLDWOQKJME-RTBURBONSA-N	0	3	332.407	3.277	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)CCCc2cccs2)CC1	ZINC001161834486	1382524647	/nfs/dbraw/zinc/52/46/47/1382524647.db2.gz	LHZCHCYAAAYCFW-UHFFFAOYSA-N	0	3	330.497	3.233	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc(OC)c(OCC)c2)CC1	ZINC001161834723	1382524881	/nfs/dbraw/zinc/52/48/81/1382524881.db2.gz	SEGWCMNOJVWUGA-UHFFFAOYSA-N	0	3	344.455	3.032	20	30		EGEDHN
C=CCCOCC(=O)NCCC1=CCN(Cc2csc(C)c2)CC1	ZINC001161978499	1382585674	/nfs/dbraw/zinc/58/56/74/1382585674.db2.gz	WLINZTHWCQWLSW-UHFFFAOYSA-N	0	3	348.512	3.288	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C2(c3ccccc3OC)CC2)CC1	ZINC001162002344	1382596141	/nfs/dbraw/zinc/59/61/41/1382596141.db2.gz	GOOYMYGLBKWQRO-UHFFFAOYSA-N	0	3	340.467	3.051	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1cc(Cl)ccc1F	ZINC001162092103	1382626805	/nfs/dbraw/zinc/62/68/05/1382626805.db2.gz	CULXEENOFNANRB-UHFFFAOYSA-N	0	3	349.631	3.097	20	30		EGEDHN
C=CCCC(=O)NCC1(COC)CCN(Cc2ccsc2)CC1	ZINC001162160454	1382644020	/nfs/dbraw/zinc/64/40/20/1382644020.db2.gz	ADXPKHUXURDXCY-UHFFFAOYSA-N	0	3	336.501	3.059	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)c1ccoc1Cl	ZINC001162790387	1382873599	/nfs/dbraw/zinc/87/35/99/1382873599.db2.gz	IGGDJKXTQGUKKR-UHFFFAOYSA-N	0	3	344.842	3.231	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1ccc(C(C)C)nc1	ZINC001162832387	1382889866	/nfs/dbraw/zinc/88/98/66/1382889866.db2.gz	QPDICNFTWJHKNK-UHFFFAOYSA-N	0	3	349.478	3.113	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CCC[C@H]1CC	ZINC001162918900	1382917143	/nfs/dbraw/zinc/91/71/43/1382917143.db2.gz	ILQGWWVOLGYQFX-RTWAWAEBSA-N	0	3	340.511	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1ccc(C(C)C)cn1	ZINC001162928046	1382919374	/nfs/dbraw/zinc/91/93/74/1382919374.db2.gz	BSPQXNZAEBJUKA-UHFFFAOYSA-N	0	3	349.478	3.113	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C1CCC=CCC1	ZINC001162997106	1382941724	/nfs/dbraw/zinc/94/17/24/1382941724.db2.gz	KUJCCMNZXPGILG-UHFFFAOYSA-N	0	3	338.495	3.417	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1ccc(C2CC2)cc1	ZINC001163002199	1382944438	/nfs/dbraw/zinc/94/44/38/1382944438.db2.gz	ZBGMNJMUNWYVDK-UHFFFAOYSA-N	0	3	346.474	3.472	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CCCCC1(C)C	ZINC001163007740	1382947152	/nfs/dbraw/zinc/94/71/52/1382947152.db2.gz	YECYVLMPBFRHTC-FQEVSTJZSA-N	0	3	340.511	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C1(CC=C)CCCC1	ZINC001163013445	1382948352	/nfs/dbraw/zinc/94/83/52/1382948352.db2.gz	OYTFDTUVAPSASR-UHFFFAOYSA-N	0	3	338.495	3.417	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCC1(CN[C@@H](C)c2c(F)cccc2F)CC1	ZINC001163841005	1383128060	/nfs/dbraw/zinc/12/80/60/1383128060.db2.gz	LHVKNVRUJHJSOK-STQMWFEESA-N	0	3	335.398	3.062	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCC1(CNCc2ccc(F)cc2Cl)CC1	ZINC001163853862	1383129880	/nfs/dbraw/zinc/12/98/80/1383129880.db2.gz	FDSRZQMOPUREED-LBPRGKRZSA-N	0	3	337.826	3.015	20	30		EGEDHN
CC#CCCCC(=O)NCCCNCc1cccc(OC)c1Cl	ZINC001164245208	1383170790	/nfs/dbraw/zinc/17/07/90/1383170790.db2.gz	WJQPFGPQSCXTAG-UHFFFAOYSA-N	0	3	336.863	3.138	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCCCNCc1ccn(C(CC)CC)n1	ZINC001164345506	1383179152	/nfs/dbraw/zinc/17/91/52/1383179152.db2.gz	AOGAIRGEPJXXOJ-INIZCTEOSA-N	0	3	334.508	3.442	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc(C)c(OC)c2)CC1	ZINC001166051304	1383382359	/nfs/dbraw/zinc/38/23/59/1383382359.db2.gz	SWJPWFBNWINOOD-UHFFFAOYSA-N	0	3	336.863	3.246	20	30		EGEDHN
C[C@@H]1CCC[C@]1(C)C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001166053462	1383383025	/nfs/dbraw/zinc/38/30/25/1383383025.db2.gz	DDEDVLAXFOQEPC-KUHUBIRLSA-N	0	3	331.435	3.120	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1cc2occc2s1	ZINC001166544720	1383436691	/nfs/dbraw/zinc/43/66/91/1383436691.db2.gz	RCJPRYOGOCKEER-UHFFFAOYSA-N	0	3	339.420	3.276	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCC1(CNCc2cc(F)ccc2OC)CC1	ZINC001166589011	1383442126	/nfs/dbraw/zinc/44/21/26/1383442126.db2.gz	NQMRAMRAOCLUEK-UHFFFAOYSA-N	0	3	348.462	3.423	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCC1(CNCc2oc(CC)nc2C)CC1	ZINC001166703976	1383463871	/nfs/dbraw/zinc/46/38/71/1383463871.db2.gz	LUEBDYQJTLZXCQ-HUUCEWRRSA-N	0	3	347.503	3.380	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCCC1(CNCc2cccc(OC)n2)CC1	ZINC001166755587	1383472276	/nfs/dbraw/zinc/47/22/76/1383472276.db2.gz	LXJKUYQPXVPGFO-INIZCTEOSA-N	0	3	345.487	3.069	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCCC1(CNCc2ccc(F)cn2)CC1	ZINC001166755808	1383472563	/nfs/dbraw/zinc/47/25/63/1383472563.db2.gz	MZPDRMAEAXPJQZ-OAHLLOKOSA-N	0	3	333.451	3.199	20	30		EGEDHN
C=CCCCC(=O)NCCC1(CNCc2cccc(OCC)n2)CC1	ZINC001166910533	1383498473	/nfs/dbraw/zinc/49/84/73/1383498473.db2.gz	XJLUDJKBOMRWIX-UHFFFAOYSA-N	0	3	345.487	3.213	20	30		EGEDHN
C=CCCCC(=O)NCCC1(CNCc2cccc(Cl)n2)CC1	ZINC001166910088	1383498609	/nfs/dbraw/zinc/49/86/09/1383498609.db2.gz	MGDCOFJLRGHRLG-UHFFFAOYSA-N	0	3	335.879	3.467	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCC1(CNCC(=C)Br)CC1	ZINC001167026266	1383522634	/nfs/dbraw/zinc/52/26/34/1383522634.db2.gz	XUOBWAIZEQNYEW-HNNXBMFYSA-N	0	3	343.309	3.373	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)CCCC(F)(F)F)c(F)c1	ZINC001167252742	1383576167	/nfs/dbraw/zinc/57/61/67/1383576167.db2.gz	VCWXXAPWBKSDMP-UHFFFAOYSA-N	0	3	345.340	3.026	20	30		EGEDHN
Cc1cc(F)cc(C(=O)NCCCNCc2cc(C#N)ccc2F)c1	ZINC001167260325	1383578016	/nfs/dbraw/zinc/57/80/16/1383578016.db2.gz	RSGJWFXCBBQHCX-UHFFFAOYSA-N	0	3	343.377	3.055	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)[C@H]1[C@@H]2CCCCCC[C@@H]21	ZINC001167296347	1383588138	/nfs/dbraw/zinc/58/81/38/1383588138.db2.gz	NWAWDQNHUBIIDY-PMOLBWCYSA-N	0	3	339.483	3.371	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc(OCC)cc2)CC1	ZINC001167946580	1383775957	/nfs/dbraw/zinc/77/59/57/1383775957.db2.gz	PXWQSPBYQHHWSD-UHFFFAOYSA-N	0	3	336.863	3.328	20	30		EGEDHN
CNCc1cc(NC2=C(c3ccccc3)C(=O)c3ccccc32)ncn1	ZINC001168411390	1383899653	/nfs/dbraw/zinc/89/96/53/1383899653.db2.gz	VCVGIDAYTCMQCL-UHFFFAOYSA-N	0	3	342.402	3.373	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@@H](OC)C2CCCCC2)CC1	ZINC001168700049	1383971919	/nfs/dbraw/zinc/97/19/19/1383971919.db2.gz	FWICNVWJEVOPJV-INIZCTEOSA-N	0	3	342.911	3.210	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2ccc(F)c(C#N)c2)CN1C(=O)OC(C)(C)C	ZINC001168813762	1384015462	/nfs/dbraw/zinc/01/54/62/1384015462.db2.gz	ASEBZUMSKBWJMK-IUODEOHRSA-N	0	3	333.407	3.185	20	30		EGEDHN
N#Cc1c[nH]c2nc(Cl)cc(N3CCCc4ccc(CN)nc43)c12	ZINC001169583360	1384161787	/nfs/dbraw/zinc/16/17/87/1384161787.db2.gz	DRRHOEWEBUELLY-UHFFFAOYSA-N	0	3	338.802	3.026	20	30		EGEDHN
C=CC[C@@H](Nc1ncc(C2=CCN(CC)CC2)cc1C)C(=O)OC	ZINC001169837232	1384190177	/nfs/dbraw/zinc/19/01/77/1384190177.db2.gz	ZOEBWDCTMNMJRD-QGZVFWFLSA-N	0	3	329.444	3.029	20	30		EGEDHN
Cc1ccc(NCC2CN(C)C2)cc1NC(=O)c1cccc(C#N)c1	ZINC001170254465	1384277058	/nfs/dbraw/zinc/27/70/58/1384277058.db2.gz	MBCJBYBCISOUEN-UHFFFAOYSA-N	0	3	334.423	3.093	20	30		EGEDHN
C#CCCCC(=O)N[C@@H](C)CCCCNCc1cc(F)ccc1C#N	ZINC001170424587	1384315541	/nfs/dbraw/zinc/31/55/41/1384315541.db2.gz	BVQCYKCPHDTHRN-INIZCTEOSA-N	0	3	343.446	3.265	20	30		EGEDHN
C#CCCCC(=O)N[C@@H](C)CCCCNCc1ccccc1C#N	ZINC001170425385	1384315692	/nfs/dbraw/zinc/31/56/92/1384315692.db2.gz	MXTQJVGHWQFTGQ-KRWDZBQOSA-N	0	3	325.456	3.126	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H](C)CCCCNCc1c(F)cccc1F	ZINC001170649024	1384356432	/nfs/dbraw/zinc/35/64/32/1384356432.db2.gz	RGABRTWUFVIPCX-HNNXBMFYSA-N	0	3	336.426	3.389	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1CCN2CCc3ccccc3[C@@H]2C1	ZINC001171227841	1384474335	/nfs/dbraw/zinc/47/43/35/1384474335.db2.gz	AYPMZWNCKTYRMF-VGSWGCGISA-N	0	3	331.463	3.404	20	30		EGEDHN
C[C@H](CC(=O)NCCCNCc1cc(C#N)ccc1F)c1ccco1	ZINC001171385678	1384508686	/nfs/dbraw/zinc/50/86/86/1384508686.db2.gz	RZYPNVJXZHURNJ-CQSZACIVSA-N	0	3	343.402	3.080	20	30		EGEDHN
CCOC(=O)C1(C#N)CCN([C@@H](C)CCc2ccc(C)cc2)CC1	ZINC001171679556	1384600565	/nfs/dbraw/zinc/60/05/65/1384600565.db2.gz	LJWUPRBFOAZKPY-KRWDZBQOSA-N	0	3	328.456	3.485	20	30		EGEDHN
C[C@H]1C[C@@H](NC2(C#N)Cc3ccccc3C2)CN1Cc1ccccc1	ZINC001171742869	1384622810	/nfs/dbraw/zinc/62/28/10/1384622810.db2.gz	ZGPJWYSHJZQCCL-LAUBAEHRSA-N	0	3	331.463	3.300	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1c(F)cccc1Cl	ZINC001171834029	1384655396	/nfs/dbraw/zinc/65/53/96/1384655396.db2.gz	BYRJTLNSFUPUBS-UHFFFAOYSA-N	0	3	349.631	3.097	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)c2cccc(Cl)c2)c(F)c1	ZINC001171844172	1384658349	/nfs/dbraw/zinc/65/83/49/1384658349.db2.gz	DYDSWWRHBPBFCF-UHFFFAOYSA-N	0	3	345.805	3.260	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1coc(C2CC2)n1	ZINC001316883752	1384666711	/nfs/dbraw/zinc/66/67/11/1384666711.db2.gz	YTCGNKXDSOIFOE-IUODEOHRSA-N	0	3	337.851	3.277	20	30		EGEDHN
C=CCOC(=O)N[C@@H]1CCCN([C@H]2CSc3ccccc3C2)C1	ZINC001172207605	1384748608	/nfs/dbraw/zinc/74/86/08/1384748608.db2.gz	HXVFSYUCVQPLKB-HZPDHXFCSA-N	0	3	332.469	3.080	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)N1CCCN(C(=O)c2ccccc2)CC1	ZINC001172311692	1384765988	/nfs/dbraw/zinc/76/59/88/1384765988.db2.gz	WALAKBATYIMXQG-SFHVURJKSA-N	0	3	347.462	3.337	20	30		EGEDHN
C[C@@H](CCCC#N)N1CCO[C@]2(CCC[C@H]2COc2ccccn2)C1	ZINC001172494466	1384803892	/nfs/dbraw/zinc/80/38/92/1384803892.db2.gz	HCZZIPMSDBDBAY-CMKODMSKSA-N	0	3	343.471	3.414	20	30		EGEDHN
Cc1cc(N2CCN([C@@H](C)CCCC#N)CC2)n(-c2ccccc2)n1	ZINC001172498052	1384805425	/nfs/dbraw/zinc/80/54/25/1384805425.db2.gz	INBGJDSKHMASGY-SFHVURJKSA-N	0	3	337.471	3.385	20	30		EGEDHN
C[C@H](CCCC#N)N1CCO[C@@H]2[C@@H](COCc3cccnc3)CC[C@H]21	ZINC001172498261	1384805908	/nfs/dbraw/zinc/80/59/08/1384805908.db2.gz	KFUMRPQRWXDYNG-VBSBHUPXSA-N	0	3	343.471	3.160	20	30		EGEDHN
CC[C@@H](N[C@H]1CCN(C(=O)OC(C)(C)C)[C@H](C#N)C1)c1ccncc1	ZINC001172976797	1384894639	/nfs/dbraw/zinc/89/46/39/1384894639.db2.gz	VFTWCPPETPPAAF-YESZJQIVSA-N	0	3	344.459	3.414	20	30		EGEDHN
CC(C)C[C@H]([NH2+][C@H](C)Cc1ccc(OC(F)(F)F)cc1)C(=O)N[O-]	ZINC001173089716	1384911446	/nfs/dbraw/zinc/91/14/46/1384911446.db2.gz	IEENGIQIMXTLJC-RISCZKNCSA-N	0	3	348.365	3.026	20	30		EGEDHN
COC(=O)C1(C#N)CCN(C2CCC(Oc3ccccc3)CC2)CC1	ZINC001173209345	1384936502	/nfs/dbraw/zinc/93/65/02/1384936502.db2.gz	XOINPJDTYKGWFC-UHFFFAOYSA-N	0	3	342.439	3.155	20	30		EGEDHN
C=CCOC1CCC(N2CCN(c3ccc(C#N)cc3F)CC2)CC1	ZINC001173322993	1384958529	/nfs/dbraw/zinc/95/85/29/1384958529.db2.gz	AOCDUAMKCUPNHQ-UHFFFAOYSA-N	0	3	343.446	3.333	20	30		EGEDHN
CCCCN(CCC#N)C1CCN(C(=O)c2ccc(C#N)cc2)CC1	ZINC001173431689	1384970136	/nfs/dbraw/zinc/97/01/36/1384970136.db2.gz	LOBLHSNQSOVDKH-UHFFFAOYSA-N	0	3	338.455	3.179	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H](C)CCCCNCc1nccn1CC	ZINC001174694682	1385135709	/nfs/dbraw/zinc/13/57/09/1385135709.db2.gz	VOGVSGUWTHBGSQ-GOSISDBHSA-N	0	3	346.519	3.251	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H](C)CCCCNCc1csc(C)n1	ZINC001174798522	1385150380	/nfs/dbraw/zinc/15/03/80/1385150380.db2.gz	NMHWBJPOJXTKGK-HNNXBMFYSA-N	0	3	335.517	3.410	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@H](C)CCCCNCc1nccn1CC	ZINC001174849496	1385159777	/nfs/dbraw/zinc/15/97/77/1385159777.db2.gz	NQYUNWPAYDSYLW-DLBZAZTESA-N	0	3	334.508	3.270	20	30		EGEDHN
C=CCCCCC[NH2+]CCCC[C@@H](C)NC(=O)c1c(C)nc[n-]c1=O	ZINC001174874582	1385163528	/nfs/dbraw/zinc/16/35/28/1385163528.db2.gz	RFCGVMRRHZYUBR-OAHLLOKOSA-N	0	3	348.491	3.115	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H](C)CCCCN[C@@H](C)c2nnc(C)[nH]2)CC1	ZINC001175081715	1385191463	/nfs/dbraw/zinc/19/14/63/1385191463.db2.gz	IFFHHBZNJOFGCI-CABCVRRESA-N	0	3	347.507	3.185	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1ccc(F)cc1Cl	ZINC001175156431	1385206502	/nfs/dbraw/zinc/20/65/02/1385206502.db2.gz	JEJKEXIRCMUFQU-UHFFFAOYSA-N	0	3	345.805	3.260	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCN(C/C=C/c1ccc(Cl)cc1)C1CC1	ZINC001317549369	1385304529	/nfs/dbraw/zinc/30/45/29/1385304529.db2.gz	RXMLJMCCEQOARV-BAABZTOOSA-N	0	3	331.847	3.093	20	30		EGEDHN
CCCCCCCN1CCC[C@@H](NC(=O)c2cccnc2OC)C1	ZINC001317943486	1385578663	/nfs/dbraw/zinc/57/86/63/1385578663.db2.gz	LKXVOPCLFKRXKC-MRXNPFEDSA-N	0	3	333.476	3.255	20	30		EGEDHN
CC(C)[C@H]1CC[C@@H](C)C[C@@H]1CN[C@H](C(N)=O)c1ccc(C#N)cc1	ZINC001318632159	1385806600	/nfs/dbraw/zinc/80/66/00/1385806600.db2.gz	XQCQATUTXGFATC-AXUOBQJMSA-N	0	3	327.472	3.383	20	30		EGEDHN
Cc1ccc(C[C@H](C)C(=O)NCCCNCc2ccccc2C#N)cc1	ZINC001177099823	1385811137	/nfs/dbraw/zinc/81/11/37/1385811137.db2.gz	SEKXPVYIIZZZCE-SFHVURJKSA-N	0	3	349.478	3.341	20	30		EGEDHN
Cc1ccc(C(=O)NCCCNCc2ccccc2C#N)c2c1CCC2	ZINC001177131115	1385825847	/nfs/dbraw/zinc/82/58/47/1385825847.db2.gz	DYMLAWXLOTYWPV-UHFFFAOYSA-N	0	3	347.462	3.265	20	30		EGEDHN
C[C@@](CNCc1ccc(C#N)cc1F)(NC(=O)C1CCCC1)C1CC1	ZINC001318677122	1385834690	/nfs/dbraw/zinc/83/46/90/1385834690.db2.gz	ZNRNZNMETCRLFI-FQEVSTJZSA-N	0	3	343.446	3.262	20	30		EGEDHN
CC(=O)N(CCCNCc1cc(C#N)ccc1F)CC1CCCC1	ZINC001177174609	1385845550	/nfs/dbraw/zinc/84/55/50/1385845550.db2.gz	LDUGJLBRAYHLNJ-UHFFFAOYSA-N	0	3	331.435	3.216	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)C12CC(C(C)(C)C)(C1)C2	ZINC001177212536	1385866467	/nfs/dbraw/zinc/86/64/67/1385866467.db2.gz	ZXLVDYVZJHAPSF-UHFFFAOYSA-N	0	3	343.309	3.207	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)CCCOC	ZINC001177226137	1385874817	/nfs/dbraw/zinc/87/48/17/1385874817.db2.gz	WHQWXDIGWOCKMQ-UHFFFAOYSA-N	0	3	330.900	3.164	20	30		EGEDHN
C=CCCOCC(=O)NCCCNCc1c(Cl)cccc1Cl	ZINC001177260511	1385887813	/nfs/dbraw/zinc/88/78/13/1385887813.db2.gz	OZUGNBFBBIXPSV-UHFFFAOYSA-N	0	3	345.270	3.182	20	30		EGEDHN
C#CCCCC(=O)N(CCCNCc1cc(C)no1)CC1CCCC1	ZINC001177305066	1385905535	/nfs/dbraw/zinc/90/55/35/1385905535.db2.gz	SKFJQCISGZUTJC-UHFFFAOYSA-N	0	3	345.487	3.285	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)C[C@@H](C)COC	ZINC001177455856	1385962437	/nfs/dbraw/zinc/96/24/37/1385962437.db2.gz	KSZALIDPIPDPLP-OAHLLOKOSA-N	0	3	344.927	3.410	20	30		EGEDHN
C=CCC1(C(=O)NCCCNCc2cc(C3CC3)no2)CCCC1	ZINC001177547847	1385992267	/nfs/dbraw/zinc/99/22/67/1385992267.db2.gz	FXBOCVFDQVQELT-UHFFFAOYSA-N	0	3	331.460	3.284	20	30		EGEDHN
CC(F)(F)C(=O)NCCCCCCNCc1cc(F)ccc1C#N	ZINC001177734570	1386030449	/nfs/dbraw/zinc/03/04/49/1386030449.db2.gz	SCIUOCQVUWDOAH-UHFFFAOYSA-N	0	3	341.377	3.119	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)[C@H](C)c1ccccc1	ZINC001319270597	1386033513	/nfs/dbraw/zinc/03/35/13/1386033513.db2.gz	PXUWYDUCRPOMAJ-IAGOWNOFSA-N	0	3	335.451	3.204	20	30		EGEDHN
N#Cc1ccccc1CNCCCCCCNC(=O)c1cccnc1	ZINC001177767805	1386039225	/nfs/dbraw/zinc/03/92/25/1386039225.db2.gz	QGDOLDYDULLAGM-UHFFFAOYSA-N	0	3	336.439	3.033	20	30		EGEDHN
N#CC(Cc1cccs1)C(=O)Nc1cnc(Cl)nc1Cl	ZINC001177903606	1386078605	/nfs/dbraw/zinc/07/86/05/1386078605.db2.gz	IUSVIFFCQCWZOY-ZETCQYMHSA-N	0	3	327.196	3.166	20	30		EGEDHN
Cc1nc2sccc2c(NC(=O)C(C#N)Cc2cccs2)n1	ZINC001177904770	1386078952	/nfs/dbraw/zinc/07/89/52/1386078952.db2.gz	SFIMQWGISIUSBM-SNVBAGLBSA-N	0	3	328.422	3.382	20	30		EGEDHN
Cc1cc(C)c(C(=O)N(C)[C@@H](C)CNCc2ccc(C#N)s2)o1	ZINC001319439925	1386122397	/nfs/dbraw/zinc/12/23/97/1386122397.db2.gz	QBYUSUHAFPLOPE-LBPRGKRZSA-N	0	3	331.441	3.080	20	30		EGEDHN
CC[C@@H](C)OCC(=O)NCCCCCCNCc1ccccc1C#N	ZINC001178227765	1386165742	/nfs/dbraw/zinc/16/57/42/1386165742.db2.gz	KBEBDFOLHQPLKG-QGZVFWFLSA-N	0	3	345.487	3.140	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)Cc2csc(CC)n2)CCCC1	ZINC001698635864	1406281163	/nfs/dbraw/zinc/28/11/63/1406281163.db2.gz	HZBLYRXJIMWJLD-UHFFFAOYSA-N	0	3	341.908	3.019	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](NCc2cc(OC)ccc2Cl)[C@@H]1C	ZINC001178582334	1386255678	/nfs/dbraw/zinc/25/56/78/1386255678.db2.gz	WWVJGZNBTFMQRP-KSSFIOAISA-N	0	3	348.874	3.231	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](NCc2cc(C#N)ccc2OC)[C@@H]1C	ZINC001178802666	1386309803	/nfs/dbraw/zinc/30/98/03/1386309803.db2.gz	TVHJIYHQIOLCEB-YJBOKZPZSA-N	0	3	341.455	3.002	20	30		EGEDHN
CC[C@@H](CC(F)F)C(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C	ZINC001178865436	1386333226	/nfs/dbraw/zinc/33/32/26/1386333226.db2.gz	JGVQUNNMAZRGNR-SZMVWBNQSA-N	0	3	348.437	3.299	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCCCCCNCc2cnc(C)o2)cc1	ZINC001179203695	1386423755	/nfs/dbraw/zinc/42/37/55/1386423755.db2.gz	KORGIJOJUXXSDV-UHFFFAOYSA-N	0	3	339.439	3.044	20	30		EGEDHN
CC[C@H](F)C(=O)NCCCCCCNCc1cc(F)ccc1C#N	ZINC001179264784	1386433917	/nfs/dbraw/zinc/43/39/17/1386433917.db2.gz	BBCVGIAVARWJBE-KRWDZBQOSA-N	0	3	337.414	3.212	20	30		EGEDHN
C=CCCC1(C(=O)NCCCCCCNCc2cc(C)n(C)n2)CC1	ZINC001179481394	1386494650	/nfs/dbraw/zinc/49/46/50/1386494650.db2.gz	DOATZKUTSRNOPQ-UHFFFAOYSA-N	0	3	346.519	3.241	20	30		EGEDHN
C=CCC1(C(=O)NCCCCCCNCc2ccn(CC)n2)CCC1	ZINC001179492445	1386496771	/nfs/dbraw/zinc/49/67/71/1386496771.db2.gz	FVEYLGPDGSFSAM-UHFFFAOYSA-N	0	3	346.519	3.416	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCCCCCNCc1cc(C)n(C)n1	ZINC001179692424	1386556142	/nfs/dbraw/zinc/55/61/42/1386556142.db2.gz	HWJBDBNHPUBXGN-UHFFFAOYSA-N	0	3	334.508	3.097	20	30		EGEDHN
CCN(CCN[C@@H](C)c1ccc(F)c(Cl)c1)C(=O)[C@@H](C)C#N	ZINC001320694503	1386694542	/nfs/dbraw/zinc/69/45/42/1386694542.db2.gz	NUCHZYFZDBWMQX-RYUDHWBXSA-N	0	3	325.815	3.138	20	30		EGEDHN
CC(C)n1cccc1C(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C	ZINC001180138335	1386710438	/nfs/dbraw/zinc/71/04/38/1386710438.db2.gz	CGWRRQRUCRDKRX-ICSRJNTNSA-N	0	3	349.478	3.313	20	30		EGEDHN
C=CCCOCC(=O)NCCCCCCNC/C(Cl)=C\Cl	ZINC001180427330	1386793602	/nfs/dbraw/zinc/79/36/02/1386793602.db2.gz	DIRWZZIKULBSED-SDNWHVSQSA-N	0	3	337.291	3.164	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](C)[C@](C)(CNCc2cnc(C)o2)C1	ZINC001181594301	1387021836	/nfs/dbraw/zinc/02/18/36/1387021836.db2.gz	LCTWKVYEHVDQPA-AUUYWEPGSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)[C@](C)(CNCc2csc(C)n2)C1	ZINC001181629831	1387026288	/nfs/dbraw/zinc/02/62/88/1387026288.db2.gz	MQZRBEYSWOSSOO-RDTXWAMCSA-N	0	3	335.517	3.382	20	30		EGEDHN
CCC(=CC(=O)N1CC[C@@H](NCc2ccc(OC)c(C#N)c2)C1)CC	ZINC001181989523	1387088106	/nfs/dbraw/zinc/08/81/06/1387088106.db2.gz	QYPUJLWBUHOCAI-GOSISDBHSA-N	0	3	341.455	3.004	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)c1cc(F)ccc1F	ZINC001322177099	1387089769	/nfs/dbraw/zinc/08/97/69/1387089769.db2.gz	SSNISJBLGIDKES-CYBMUJFWSA-N	0	3	343.377	3.087	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](NCc2ccccc2OC2CC2)C1	ZINC001182113093	1387107096	/nfs/dbraw/zinc/10/70/96/1387107096.db2.gz	KUTITJKIDVPWDR-GOSISDBHSA-N	0	3	340.467	3.112	20	30		EGEDHN
N#Cc1cccnc1NCCNCc1cnc(-c2cccs2)s1	ZINC001331365606	1389719697	/nfs/dbraw/zinc/71/96/97/1389719697.db2.gz	XLWWMSVJSNCDQF-UHFFFAOYSA-N	0	3	341.465	3.340	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccc(C#N)cc2F)C1	ZINC001338804847	1389772428	/nfs/dbraw/zinc/77/24/28/1389772428.db2.gz	MBAGLLMKLRYZSI-YOEHRIQHSA-N	0	3	337.398	3.263	20	30		EGEDHN
C=CCN(CC=C)C(=O)c1ccc(NC(=O)[C@@H](N)C[C@H](C)CC)cc1	ZINC001339858880	1390177200	/nfs/dbraw/zinc/17/72/00/1390177200.db2.gz	VIVHRDOQBDKUMN-QAPCUYQASA-N	0	3	343.471	3.203	20	30		EGEDHN
C=C(Br)CNC[C@@H](NC(=O)C1=CCCC1)C(C)(C)C	ZINC001332791049	1390189362	/nfs/dbraw/zinc/18/93/62/1390189362.db2.gz	XGCMUCXWUVMHQW-CYBMUJFWSA-N	0	3	329.282	3.126	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N(CC)Cc1ccccc1	ZINC001340207032	1390250203	/nfs/dbraw/zinc/25/02/03/1390250203.db2.gz	IDRVACRAKCJAOO-SFHVURJKSA-N	0	3	339.487	3.300	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccccc1Sc1nccn1C	ZINC001341399508	1390482286	/nfs/dbraw/zinc/48/22/86/1390482286.db2.gz	SKRKKJJDEAHTMK-CYBMUJFWSA-N	0	3	330.457	3.193	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N1CC[C@H](CC(C)C)C1	ZINC001342020800	1390562684	/nfs/dbraw/zinc/56/26/84/1390562684.db2.gz	QKRWIWNDDKGSNW-SJORKVTESA-N	0	3	331.508	3.146	20	30		EGEDHN
Cn1ccnc1C(C#N)C(=O)[C@@H]1C[C@H]1c1ccc(OC(F)(F)F)cc1	ZINC001342267581	1390593139	/nfs/dbraw/zinc/59/31/39/1390593139.db2.gz	BXBDZLMIPPCUFR-MJBXVCDLSA-N	0	3	349.312	3.299	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccc(Sc2nncs2)cc1	ZINC001343206028	1390699907	/nfs/dbraw/zinc/69/99/07/1390699907.db2.gz	WLBVCWQRDXAMEZ-CYBMUJFWSA-N	0	3	334.470	3.311	20	30		EGEDHN
Cn1c(C(=O)C(C#N)c2nc(N)c3ccccc3n2)cc2ccccc21	ZINC001343290889	1390705280	/nfs/dbraw/zinc/70/52/80/1390705280.db2.gz	BUQONGXEGCNXDL-AWEZNQCLSA-N	0	3	341.374	3.194	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N1CCC(c2nc3c(s2)CCCC3)CC1	ZINC001343722793	1390733239	/nfs/dbraw/zinc/73/32/39/1390733239.db2.gz	UHQIEGLCMPHCIW-HNNXBMFYSA-N	0	3	347.528	3.412	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CCCN(C)C2)nnc1N1CC[C@@H](C)[C@H](C)C1	ZINC001343786606	1390736936	/nfs/dbraw/zinc/73/69/36/1390736936.db2.gz	GGLFCPYMJWILNY-ZACQAIPSSA-N	0	3	331.508	3.146	20	30		EGEDHN
Cn1cc(CCC(=O)C(C#N)c2ncc(Cl)n2C)c2ccccc21	ZINC001344322555	1390782065	/nfs/dbraw/zinc/78/20/65/1390782065.db2.gz	RPQCBQXOENZKGB-AWEZNQCLSA-N	0	3	340.814	3.374	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN[C@@H](c2ccccc2)[C@@H]2CCCO2)c1	ZINC001345606404	1390868212	/nfs/dbraw/zinc/86/82/12/1390868212.db2.gz	PIISLZZJQFUNGB-FPOVZHCZSA-N	0	3	349.434	3.397	20	30		EGEDHN
Cn1c(Cl)cnc1C(C#N)=C([O-])c1ccc(C[NH+]2CCCC2)cc1	ZINC001346095737	1390907031	/nfs/dbraw/zinc/90/70/31/1390907031.db2.gz	IMXLRAHAWPRAPJ-HNNXBMFYSA-N	0	3	342.830	3.159	20	30		EGEDHN
Cn1c(Cl)cnc1[C@@H](C#N)C(=O)c1ccc(CN2CCCC2)cc1	ZINC001346095737	1390907032	/nfs/dbraw/zinc/90/70/32/1390907032.db2.gz	IMXLRAHAWPRAPJ-HNNXBMFYSA-N	0	3	342.830	3.159	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)c1cn(CC(C)C)nc1C(F)F	ZINC001346096162	1390907385	/nfs/dbraw/zinc/90/73/85/1390907385.db2.gz	NOCJVWHXCBBTIZ-LLVKDONJSA-N	0	3	335.358	3.183	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H]2Cc3ccc(F)cc32)CCCC1	ZINC001698800515	1406474953	/nfs/dbraw/zinc/47/49/53/1406474953.db2.gz	LTDQHZICAIDCPT-MRXNPFEDSA-N	0	3	336.838	3.237	20	30		EGEDHN
CCC1(C(=O)NC[C@H]2C[C@H](NCc3ccc(C#N)cc3F)C2)CCC1	ZINC001479390983	1392232145	/nfs/dbraw/zinc/23/21/45/1392232145.db2.gz	WRWSQNCDMOXZMY-JCNLHEQBSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)Cc2cccc(Cl)c2)C1	ZINC001479392172	1392232243	/nfs/dbraw/zinc/23/22/43/1392232243.db2.gz	UZKCUEKEEPWJLU-CTYIDZIISA-N	0	3	327.255	3.119	20	30		EGEDHN
C[C@H](NC(=O)CCCF)[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001480384678	1392728769	/nfs/dbraw/zinc/72/87/69/1392728769.db2.gz	XJKDXCFRUBKDGT-MAUKXSAKSA-N	0	3	331.435	3.025	20	30		EGEDHN
CCCN(CCNC(=O)[C@H]1CC1(C)C)Cc1ccc(F)c(C#N)c1	ZINC001481134587	1393129302	/nfs/dbraw/zinc/12/93/02/1393129302.db2.gz	PGDUDRXULIOELW-MRXNPFEDSA-N	0	3	331.435	3.072	20	30		EGEDHN
CCCCC(=O)N1CC[C@H](CN(C)Cc2cc(C#N)ccc2OC)C1	ZINC001481476857	1394323909	/nfs/dbraw/zinc/32/39/09/1394323909.db2.gz	GZRYEVRGNYWRCH-QGZVFWFLSA-N	0	3	343.471	3.037	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1c(F)ccc2ccncc21)C(C)C	ZINC001698962313	1406716586	/nfs/dbraw/zinc/71/65/86/1406716586.db2.gz	PWFRERAHDNACOF-INIZCTEOSA-N	0	3	349.837	3.470	20	30		EGEDHN
C[C@@H](NC1(CNC(=O)[C@@H](C)C#N)CCCC1)c1ccc(F)cc1F	ZINC001482213657	1394807488	/nfs/dbraw/zinc/80/74/88/1394807488.db2.gz	UTTOUGAKRJCUBQ-QWHCGFSZSA-N	0	3	335.398	3.204	20	30		EGEDHN
CC(C)C[C@H](CNCc1ccc(C#N)s1)NC(=O)c1ccsn1	ZINC001482388050	1394949064	/nfs/dbraw/zinc/94/90/64/1394949064.db2.gz	RSKGHPSXXWAGGZ-GFCCVEGCSA-N	0	3	348.497	3.011	20	30		EGEDHN
C=C(Br)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1ccco1	ZINC001689897361	1404192227	/nfs/dbraw/zinc/19/22/27/1404192227.db2.gz	XCQIXZKUMGJEAS-QWHCGFSZSA-N	0	3	341.249	3.161	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1csnc1C	ZINC001689899868	1404194326	/nfs/dbraw/zinc/19/43/26/1404194326.db2.gz	VIFRJFDOAXPMLQ-TZMCWYRMSA-N	0	3	327.881	3.177	20	30		EGEDHN
CCC1(C(=O)NC[C@H]2CCN(Cc3ccc(C#N)cc3)C2)CCC1	ZINC001691153648	1405087576	/nfs/dbraw/zinc/08/75/76/1405087576.db2.gz	BGLDVLDEDKYTOY-GOSISDBHSA-N	0	3	325.456	3.077	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)Cc2cccc(Cl)c2F)C1	ZINC001691466646	1405287387	/nfs/dbraw/zinc/28/73/87/1405287387.db2.gz	MSXXLKFHMMITJA-BJHJDKERSA-N	0	3	345.245	3.259	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@@H](C)Cc2ccccc2C)C1	ZINC001691540800	1405331163	/nfs/dbraw/zinc/33/11/63/1405331163.db2.gz	HFMVFXLIUWBFPR-ZVZYQTTQSA-N	0	3	334.891	3.411	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H](CNC(=O)C3(F)CCCCC3)C2)c1	ZINC001731857551	1428092892	/nfs/dbraw/zinc/09/28/92/1428092892.db2.gz	MUYZLSZRLKLIEU-SFHVURJKSA-N	0	3	343.446	3.169	20	30		EGEDHN
C[C@@H](N[C@@H]1CC[C@@H](NC(=O)[C@@H](C)C#N)CC1)c1c(F)cccc1F	ZINC001732306071	1428521886	/nfs/dbraw/zinc/52/18/86/1428521886.db2.gz	LGJHXMBJLHQFBC-CRWXNKLISA-N	0	3	335.398	3.202	20	30		EGEDHN
C[C@H](C#N)C(=O)NCc1ccc(CNCc2ccc(Cl)cc2)cc1	ZINC001732315755	1428527137	/nfs/dbraw/zinc/52/71/37/1428527137.db2.gz	QYMDMKPNFCHZOQ-CQSZACIVSA-N	0	3	341.842	3.406	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)c3ccco3)CCCC2)c(F)c1	ZINC001732389886	1428559737	/nfs/dbraw/zinc/55/97/37/1428559737.db2.gz	WUWFEKXANZUCHZ-UHFFFAOYSA-N	0	3	341.386	3.123	20	30		EGEDHN
C=C(Cl)CN(CC1CC1)C1CCN(C(=O)c2oncc2C)CC1	ZINC001699689407	1413092812	/nfs/dbraw/zinc/09/28/12/1413092812.db2.gz	QZNPMIKJXWFTDJ-UHFFFAOYSA-N	0	3	337.851	3.052	20	30		EGEDHN
C[C@H](CC(=O)N(C)CCCN(C)Cc1ccc(F)c(C#N)c1)C1CC1	ZINC001700195547	1413634886	/nfs/dbraw/zinc/63/48/86/1413634886.db2.gz	QPLRXTYBVYBWPR-OAHLLOKOSA-N	0	3	345.462	3.414	20	30		EGEDHN
CCC(CC)C(=O)N[C@H]1CCN(Cc2cccc(C#N)c2)[C@@H](C)C1	ZINC001700312601	1413767244	/nfs/dbraw/zinc/76/72/44/1413767244.db2.gz	VHFBZAYVYITSRG-KXBFYZLASA-N	0	3	327.472	3.464	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1cc(F)ccc1F	ZINC001700442102	1414014885	/nfs/dbraw/zinc/01/48/85/1414014885.db2.gz	MQXJZVIDAMTNKE-UHFFFAOYSA-N	0	3	330.806	3.405	20	30		EGEDHN
C[C@H]1C[C@@H](NCc2ccc(C#N)s2)CN1C(=O)CCCC1CC1	ZINC001700843130	1414492338	/nfs/dbraw/zinc/49/23/38/1414492338.db2.gz	SZTYAFBMCGTJRY-DZGCQCFKSA-N	0	3	331.485	3.279	20	30		EGEDHN
C=C(Br)CNC[C@H](NC(=O)[C@H]1CC1(C)C)C(C)(C)C	ZINC001700988925	1414632395	/nfs/dbraw/zinc/63/23/95/1414632395.db2.gz	DVEHABLQSCVAST-NEPJUHHUSA-N	0	3	331.298	3.062	20	30		EGEDHN
C[C@H](c1ccc(Cl)cc1)N(C)C[C@H](C)NC(=O)c1cc(C#N)c[nH]1	ZINC001733035021	1429159103	/nfs/dbraw/zinc/15/91/03/1429159103.db2.gz	ZONXIUZZIKYHRY-QWHCGFSZSA-N	0	3	344.846	3.351	20	30		EGEDHN
CCc1ccccc1C(=O)N[C@@H](C)CN(C)Cc1ccc(C#N)cc1	ZINC001733048183	1429182262	/nfs/dbraw/zinc/18/22/62/1429182262.db2.gz	AFYXOFPULDEUMJ-INIZCTEOSA-N	0	3	335.451	3.371	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@H](C)CCc2ccc(F)cc2)C1	ZINC001713159562	1417735698	/nfs/dbraw/zinc/73/56/98/1417735698.db2.gz	DXDPDNNLPJICDI-CSMYWGQOSA-N	0	3	338.854	3.384	20	30		EGEDHN
C[C@@H](C(=O)N[C@@H](C)CN(C)Cc1ccc(C#N)cc1)c1ccccc1	ZINC001733060254	1429207880	/nfs/dbraw/zinc/20/78/80/1429207880.db2.gz	AGWPHDVROIDEFX-DLBZAZTESA-N	0	3	335.451	3.298	20	30		EGEDHN
CC(C)(C(=O)NC[C@@H]1CCN(Cc2ccc(C#N)cc2)C1)C1CCC1	ZINC001713533416	1418284600	/nfs/dbraw/zinc/28/46/00/1418284600.db2.gz	FVQAGTTXWAAUOY-SFHVURJKSA-N	0	3	339.483	3.323	20	30		EGEDHN
CC1(CCC(=O)N[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)CC1	ZINC001713963357	1418743386	/nfs/dbraw/zinc/74/33/86/1418743386.db2.gz	BACFOBIHBKYQNR-WKILWMFISA-N	0	3	329.419	3.014	20	30		EGEDHN
C[C@@H](C#N)C(=O)N[C@@H]1CCN(Cc2ccc(-c3ccccc3)cc2)C1	ZINC001713967579	1418746880	/nfs/dbraw/zinc/74/68/80/1418746880.db2.gz	IFKQBQWVFNFFMQ-OXJNMPFZSA-N	0	3	333.435	3.204	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1csc(C2CC2)n1)C1CC1	ZINC001714177415	1418984878	/nfs/dbraw/zinc/98/48/78/1418984878.db2.gz	HKYJBXNEMGIPAQ-INIZCTEOSA-N	0	3	339.892	3.261	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2ocnc2C)CCCC[C@H]1C	ZINC001714179722	1418988038	/nfs/dbraw/zinc/98/80/38/1418988038.db2.gz	FUERZZUCOZZKJS-BZNIZROVSA-N	0	3	325.840	3.004	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2ocnc2C)CCCC[C@H]1C	ZINC001714179721	1418988207	/nfs/dbraw/zinc/98/82/07/1418988207.db2.gz	FUERZZUCOZZKJS-BDJLRTHQSA-N	0	3	325.840	3.004	20	30		EGEDHN
CC(C)CC(C)(C)C(=O)NC[C@H](C)CNCc1ccccc1C#N	ZINC001714444029	1419175918	/nfs/dbraw/zinc/17/59/18/1419175918.db2.gz	KMNGWMRMPXVVLT-MRXNPFEDSA-N	0	3	329.488	3.472	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)c1sccc1CC	ZINC001714500670	1419226589	/nfs/dbraw/zinc/22/65/89/1419226589.db2.gz	QBNJXBHTVQKNBW-LLVKDONJSA-N	0	3	345.306	3.317	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H]2CCCc3cccnc32)CCCC1	ZINC001714501594	1419227732	/nfs/dbraw/zinc/22/77/32/1419227732.db2.gz	KXSIJPVMSHSCJG-MRXNPFEDSA-N	0	3	347.890	3.273	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@@H](CCNC(=O)C2CCCC2)C1	ZINC001714860091	1419580659	/nfs/dbraw/zinc/58/06/59/1419580659.db2.gz	FNXVYIGZQHXRDK-MRXNPFEDSA-N	0	3	325.456	3.077	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)C[C@@H](C)c2ccc(OC)cc2)C1	ZINC001714923214	1419676520	/nfs/dbraw/zinc/67/65/20/1419676520.db2.gz	JRLOAZUKBCPMIE-SJLPKXTDSA-N	0	3	330.472	3.346	20	30		EGEDHN
C=C(Br)CNCC1(NC(=O)C[C@H](C)CC)CCCC1	ZINC001715093911	1419834648	/nfs/dbraw/zinc/83/46/48/1419834648.db2.gz	ZCALELHZCMCPPH-GFCCVEGCSA-N	0	3	331.298	3.350	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)c2ccoc2C)CCCC1	ZINC001715294488	1420001531	/nfs/dbraw/zinc/00/15/31/1420001531.db2.gz	FUZBGGNWAZGORH-UHFFFAOYSA-N	0	3	341.249	3.129	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cn3c(cccc3C)n2)CCCC1	ZINC001715309756	1420019142	/nfs/dbraw/zinc/01/91/42/1420019142.db2.gz	KKFCJMPRFPUEMU-UHFFFAOYSA-N	0	3	346.862	3.027	20	30		EGEDHN
C=C(Br)CN[C@H](CNC(=O)C(C)(CC)CC)C(C)C	ZINC001715731538	1420316249	/nfs/dbraw/zinc/31/62/49/1420316249.db2.gz	UONOSIABMRZZNX-CYBMUJFWSA-N	0	3	333.314	3.452	20	30		EGEDHN
C[C@@]1(CNC(=O)CC2CCC2)CCCN(Cc2cccc(C#N)c2)C1	ZINC001716892651	1421018979	/nfs/dbraw/zinc/01/89/79/1421018979.db2.gz	GBQUBOSYIIVXDF-NRFANRHFSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1cnc2cc[nH]c2c1	ZINC001717453913	1421383457	/nfs/dbraw/zinc/38/34/57/1421383457.db2.gz	IMWNQTYYKQWZOK-UHFFFAOYSA-N	0	3	334.851	3.003	20	30		EGEDHN
Cc1ccc(C)c(C(=O)NC[C@@H](C)N(C)Cc2cccc(C#N)c2)c1	ZINC001717496606	1421437694	/nfs/dbraw/zinc/43/76/94/1421437694.db2.gz	MTQKEHLXTJAZQP-QGZVFWFLSA-N	0	3	335.451	3.425	20	30		EGEDHN
C[C@@H](CNC(=O)CC(C1CC1)C1CC1)N(C)Cc1ccc(C#N)cc1	ZINC001717500381	1421443916	/nfs/dbraw/zinc/44/39/16/1421443916.db2.gz	SCRPJAFBSXNIRQ-HNNXBMFYSA-N	0	3	339.483	3.321	20	30		EGEDHN
CCCC[C@H](CNCc1ccc(C#N)s1)NC(=O)c1ccco1	ZINC001717529473	1421465790	/nfs/dbraw/zinc/46/57/90/1421465790.db2.gz	VBWRGWLQZMPXKX-CYBMUJFWSA-N	0	3	331.441	3.291	20	30		EGEDHN
CN(C(=O)C(C)(C)C1CC1)[C@@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001717734781	1421599535	/nfs/dbraw/zinc/59/95/35/1421599535.db2.gz	JUXYOWZUAFLIBT-KRWDZBQOSA-N	0	3	345.512	3.383	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1	ZINC001733359928	1429542948	/nfs/dbraw/zinc/54/29/48/1429542948.db2.gz	NAXXXISZGFRJPC-QGZVFWFLSA-N	0	3	331.435	3.023	20	30		EGEDHN
Cc1ccc(C)c(C(=O)N[C@H](C)CN(C)Cc2ccc(C#N)cc2)c1	ZINC001722904556	1424229775	/nfs/dbraw/zinc/22/97/75/1424229775.db2.gz	DXVOTQHZQKARHC-QGZVFWFLSA-N	0	3	335.451	3.425	20	30		EGEDHN
CC(C)(C(=O)N[C@H](CNCc1ccc(C#N)s1)C1CC1)C1CC1	ZINC001723322297	1424349608	/nfs/dbraw/zinc/34/96/08/1424349608.db2.gz	FFQOKDRGDLSFBW-MRXNPFEDSA-N	0	3	331.485	3.040	20	30		EGEDHN
Cc1ccc(C)c(CC(=O)NCC2(NCc3ccc(C#N)cc3)CC2)c1	ZINC001723553424	1424461385	/nfs/dbraw/zinc/46/13/85/1424461385.db2.gz	DIQPLBZVZAZFPU-UHFFFAOYSA-N	0	3	347.462	3.156	20	30		EGEDHN
C=CCC1(C(=O)N2CCC[C@@H]2CNCc2ccnn2C)CCCCC1	ZINC001723982506	1424617717	/nfs/dbraw/zinc/61/77/17/1424617717.db2.gz	YRMNOQOEKBNQRF-GOSISDBHSA-N	0	3	344.503	3.027	20	30		EGEDHN
CC(C)CCC(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1	ZINC001723998096	1424621823	/nfs/dbraw/zinc/62/18/23/1424621823.db2.gz	YPWSBKUVTRZHLX-UHFFFAOYSA-N	0	3	327.472	3.465	20	30		EGEDHN
C[C@H](CNC(=O)c1ccc(Cl)cc1)NCc1ccc(F)c(C#N)c1	ZINC001731630783	1427682833	/nfs/dbraw/zinc/68/28/33/1427682833.db2.gz	KUWMXLOUGKURNG-GFCCVEGCSA-N	0	3	345.805	3.259	20	30		EGEDHN
CC(C)CCC(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001731706872	1427760031	/nfs/dbraw/zinc/76/00/31/1427760031.db2.gz	AHNUCAYFMXCGRI-IBGZPJMESA-N	0	3	327.472	3.417	20	30		EGEDHN
CCCN(CCNC(=O)[C@H](C)c1ccco1)Cc1ccc(C#N)cc1	ZINC001731868785	1428120720	/nfs/dbraw/zinc/12/07/20/1428120720.db2.gz	GFHIAHCQIOHIRO-MRXNPFEDSA-N	0	3	339.439	3.283	20	30		EGEDHN
N#Cc1cc(CNC2(CNC(=O)c3ccccc3)CCC2)ccc1F	ZINC001733712243	1429928706	/nfs/dbraw/zinc/92/87/06/1429928706.db2.gz	RHRVOJHHXHRTFH-UHFFFAOYSA-N	0	3	337.398	3.140	20	30		EGEDHN
C[C@H](CC(=O)NCC1(NCc2ccc(C#N)s2)CCC1)C1CC1	ZINC001733727935	1429956769	/nfs/dbraw/zinc/95/67/69/1429956769.db2.gz	CNWONVWRJSTELI-CYBMUJFWSA-N	0	3	331.485	3.184	20	30		EGEDHN
C=C(Br)CNCC(C)(C)CN(C)C(=O)C[C@@H](C)CC	ZINC001734016943	1437807161	/nfs/dbraw/zinc/80/71/61/1437807161.db2.gz	ULEGBTMRXAKBJK-LBPRGKRZSA-N	0	3	333.314	3.405	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1cccc(COC)c1	ZINC001734019498	1437808803	/nfs/dbraw/zinc/80/88/03/1437808803.db2.gz	HLBVYJPMHZQIKI-UHFFFAOYSA-N	0	3	338.879	3.273	20	30		EGEDHN
C=C(Br)CN[C@@H](C)[C@@H]1CCCCN1C(=O)C=C1CCC1	ZINC001752138727	1440144239	/nfs/dbraw/zinc/14/42/39/1440144239.db2.gz	DZSZJLVCJAQZLC-ZFWWWQNUSA-N	0	3	341.293	3.365	20	30		EGEDHN
C=C1CCC(C(=O)NCCCN(CC)[C@@H](C)c2cnccn2)CC1	ZINC001752209638	1440154873	/nfs/dbraw/zinc/15/48/73/1440154873.db2.gz	BENYFIYTWOVTGR-INIZCTEOSA-N	0	3	330.476	3.112	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCCN(Cc1cccnc1C)C1CC1	ZINC001752267717	1440162717	/nfs/dbraw/zinc/16/27/17/1440162717.db2.gz	UAOAEWXDARDJNF-UHFFFAOYSA-N	0	3	329.488	3.463	20	30		EGEDHN
CC#CCN(CCCNC(=O)C(C)(C)Cc1ccccc1)C1CC1	ZINC001752286989	1440165579	/nfs/dbraw/zinc/16/55/79/1440165579.db2.gz	KPGDAFIAGNOHMM-UHFFFAOYSA-N	0	3	326.484	3.249	20	30		EGEDHN
COCC#CCN(CCCNC(=O)[C@]1(C)CCC(C)=C(C)C1)C1CC1	ZINC001752290741	1440165948	/nfs/dbraw/zinc/16/59/48/1440165948.db2.gz	TXEAKGGUHOZCBB-OAQYLSRUSA-N	0	3	346.515	3.134	20	30		EGEDHN
COCC#CCN1CCC2(C[C@@H]2NC(=O)[C@H](C)CCC(C)(C)C)CC1	ZINC001752434676	1440179951	/nfs/dbraw/zinc/17/99/51/1440179951.db2.gz	IUSCKIAZGVVWJA-MSOLQXFVSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=C(C)CN1CCC(N(CCC)C(=O)c2cccc3nccn32)CC1	ZINC001752439809	1440180878	/nfs/dbraw/zinc/18/08/78/1440180878.db2.gz	KFIHOENVLDZNIC-UHFFFAOYSA-N	0	3	340.471	3.227	20	30		EGEDHN
O=C(NC[C@H](NCC#Cc1ccc(Cl)cc1)C1CC1)c1ccco1	ZINC001752446843	1440182055	/nfs/dbraw/zinc/18/20/55/1440182055.db2.gz	ZUQITZYQOLDDLL-KRWDZBQOSA-N	0	3	342.826	3.083	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H](CN(C)Cc2c(C)noc2CC)C1	ZINC001752502615	1440188573	/nfs/dbraw/zinc/18/85/73/1440188573.db2.gz	GURJQCHIXICGKJ-INIZCTEOSA-N	0	3	333.476	3.182	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)c1cc(CCC)on1	ZINC001752543738	1440194865	/nfs/dbraw/zinc/19/48/65/1440194865.db2.gz	UGZJSPFXQUQSHC-HRCADAONSA-N	0	3	331.460	3.271	20	30		EGEDHN
Cc1cocc1C(=O)N[C@H]1C[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001752651698	1440197962	/nfs/dbraw/zinc/19/79/62/1440197962.db2.gz	ROWNVMCPWRONTO-WKILWMFISA-N	0	3	342.826	3.144	20	30		EGEDHN
O=C(N[C@H]1C[C@H](NCC#Cc2cccc(Cl)c2)C1)[C@H]1CC12CCC2	ZINC001752668859	1440198825	/nfs/dbraw/zinc/19/88/25/1440198825.db2.gz	FNRWWYOUIIRKPO-KZNAEPCWSA-N	0	3	342.870	3.119	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@H]2CN(Cc3c(C)noc3C)CC[C@H]21	ZINC001752705761	1440202228	/nfs/dbraw/zinc/20/22/28/1440202228.db2.gz	BKUDMQZOWGICME-PKOBYXMFSA-N	0	3	345.487	3.461	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1C[C@@H](NCc2cc(-c3ccccc3)no2)C1	ZINC001752753456	1440205080	/nfs/dbraw/zinc/20/50/80/1440205080.db2.gz	PDHNADALWYYKNW-IYBDPMFKSA-N	0	3	339.439	3.291	20	30		EGEDHN
CC[C@H](C)CCC(=O)N[C@H]1C[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001752771388	1440206050	/nfs/dbraw/zinc/20/60/50/1440206050.db2.gz	PFQBSEAYQSDLNY-ZYSHUDEJSA-N	0	3	330.447	3.240	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC[C@@H]1CCCN(Cc2cccnc2C)C1	ZINC001752784094	1440210118	/nfs/dbraw/zinc/21/01/18/1440210118.db2.gz	VWEBWZOFQDWLOJ-SFHVURJKSA-N	0	3	341.499	3.487	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)C[C@H](C)c1c(C)noc1C	ZINC001752821615	1440220984	/nfs/dbraw/zinc/22/09/84/1440220984.db2.gz	PKAZAVZANWKREA-YOEHRIQHSA-N	0	3	333.476	3.332	20	30		EGEDHN
C=CCOCCN1CCCC[C@H]1CNC(=O)[C@H]1[C@@H]2CCCCCC[C@@H]21	ZINC001752822252	1440221196	/nfs/dbraw/zinc/22/11/96/1440221196.db2.gz	CTHNNLRNAQHEIE-VNTMZGSJSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@H]1CCCCN1C[C@@H]1CC(C)(C)CO1	ZINC001752826663	1440224043	/nfs/dbraw/zinc/22/40/43/1440224043.db2.gz	ALOPROUUJYLYSY-SJORKVTESA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H](C)[C@H]1CCCN(Cc2cncc(C)c2)C1	ZINC001752839193	1440229396	/nfs/dbraw/zinc/22/93/96/1440229396.db2.gz	CGFFABHFJMIWDY-AEFFLSMTSA-N	0	3	329.488	3.319	20	30		EGEDHN
CN(Cc1cccc(F)c1)[C@H]1CCCN(C(=O)C#CC(C)(C)C)C1	ZINC001752991435	1440259613	/nfs/dbraw/zinc/25/96/13/1440259613.db2.gz	RPFMGYBIHMFDGV-SFHVURJKSA-N	0	3	330.447	3.298	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)NCCC[C@@H]1CCCN1Cc1ccc(C#N)cc1F	ZINC001753032004	1440273070	/nfs/dbraw/zinc/27/30/70/1440273070.db2.gz	HLQLVGDAVBKRKF-ZTFGCOKTSA-N	0	3	343.446	3.214	20	30		EGEDHN
C#CCCCCC(=O)NCCN(C)[C@@H]1CCCc2ccc(F)cc21	ZINC001753046139	1440277629	/nfs/dbraw/zinc/27/76/29/1440277629.db2.gz	NIXNGJOMBGUYHQ-LJQANCHMSA-N	0	3	330.447	3.445	20	30		EGEDHN
CCN(CCNC(=O)c1cc(C#N)c[nH]1)Cc1ccccc1C(C)C	ZINC001753079905	1440293311	/nfs/dbraw/zinc/29/33/11/1440293311.db2.gz	DDMNCPDECGMRKS-UHFFFAOYSA-N	0	3	338.455	3.262	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@H]1CCCN1CCOc1cccc(F)c1	ZINC001753107189	1440306790	/nfs/dbraw/zinc/30/67/90/1440306790.db2.gz	ZJPHIUGUIGDSAT-QGZVFWFLSA-N	0	3	334.435	3.141	20	30		EGEDHN
C=C(C)CN[C@@H](CNC(=O)c1c(F)cccc1OC)c1ccccc1	ZINC001753298329	1440353033	/nfs/dbraw/zinc/35/30/33/1440353033.db2.gz	DJZRMXAEELNYPB-KRWDZBQOSA-N	0	3	342.414	3.471	20	30		EGEDHN
C=CCN[C@@H](CNC(=O)CCc1nc2ccccc2o1)c1ccccc1	ZINC001753303034	1440354638	/nfs/dbraw/zinc/35/46/38/1440354638.db2.gz	NXIZVLCWFFDEAB-SFHVURJKSA-N	0	3	349.434	3.394	20	30		EGEDHN
CCCN(C(=O)C#CC1CC1)[C@@H]1CCN(CCCc2ccsc2)C1	ZINC001753315597	1440359367	/nfs/dbraw/zinc/35/93/67/1440359367.db2.gz	BQYJUPGPDJEWNN-LJQANCHMSA-N	0	3	344.524	3.407	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CCC)C(=O)c2ccc3c(c2)ncn3C)C1	ZINC001753317935	1440360733	/nfs/dbraw/zinc/36/07/33/1440360733.db2.gz	YSWIIBQQQRAXCP-QGZVFWFLSA-N	0	3	340.471	3.076	20	30		EGEDHN
C=C(C)CCC(=O)NCC[C@@H]1CCN(Cc2ccc(F)c(C#N)c2)C1	ZINC001753332861	1440370496	/nfs/dbraw/zinc/37/04/96/1440370496.db2.gz	XCWPDVOBJSDXPQ-MRXNPFEDSA-N	0	3	343.446	3.382	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC[C@H]2CCN(Cc3cc(C)ns3)C2)C1	ZINC001753335546	1440372095	/nfs/dbraw/zinc/37/20/95/1440372095.db2.gz	RUDGVMAPUSAIGN-HNNXBMFYSA-N	0	3	333.501	3.136	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NCC1CN([C@@H](C)c2cccc(C)c2)C1	ZINC001753407313	1440392332	/nfs/dbraw/zinc/39/23/32/1440392332.db2.gz	DDLYTTKNHIRHNV-LAUBAEHRSA-N	0	3	344.499	3.333	20	30		EGEDHN
CCCCCCCN1C[C@@H]2C[C@H]1CN2C(=O)CCc1cccnc1	ZINC001753423696	1440396089	/nfs/dbraw/zinc/39/60/89/1440396089.db2.gz	VKWKSCHYMBEQOY-OALUTQOASA-N	0	3	329.488	3.270	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(C(C)C)cn1	ZINC001753425437	1440396564	/nfs/dbraw/zinc/39/65/64/1440396564.db2.gz	WCMHEXGSBADITF-NJAFHUGGSA-N	0	3	327.472	3.458	20	30		EGEDHN
CCN(C(=O)[C@H](C)C#N)[C@H]1CCN(Cc2cc3ccccc3s2)C1	ZINC001753453917	1440407385	/nfs/dbraw/zinc/40/73/85/1440407385.db2.gz	ZJGYQOMIMUJUAG-ZBFHGGJFSA-N	0	3	341.480	3.484	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)CCc2cccc(OC)c2)C1	ZINC001753461350	1440411073	/nfs/dbraw/zinc/41/10/73/1440411073.db2.gz	KKKFZSQPPOQMLF-GOSISDBHSA-N	0	3	330.472	3.127	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)[C@@H](C)Cc2ccc(C)cc2)C1	ZINC001753463957	1440412027	/nfs/dbraw/zinc/41/20/27/1440412027.db2.gz	LETQSEHQSJFLQR-ICSRJNTNSA-N	0	3	326.484	3.120	20	30		EGEDHN
CC[C@H](CNC(=O)[C@H]1CC=CCC1)NCc1ccc(C#N)c(F)c1	ZINC001753466426	1440412860	/nfs/dbraw/zinc/41/28/60/1440412860.db2.gz	KQBIGHIVCFDWAR-DOTOQJQBSA-N	0	3	329.419	3.038	20	30		EGEDHN
CC[C@H](CNC(=O)c1oc(C)cc1C)NCc1ccc(C#N)s1	ZINC001753470396	1440413841	/nfs/dbraw/zinc/41/38/41/1440413841.db2.gz	RUHGFVBNIDGUOQ-CYBMUJFWSA-N	0	3	331.441	3.128	20	30		EGEDHN
CC[C@H](CNC(=O)CC(C)(C)C1CC1)NCC#Cc1ccc(F)cc1	ZINC001753471045	1440413972	/nfs/dbraw/zinc/41/39/72/1440413972.db2.gz	DRXCDPGOZXIMBT-LJQANCHMSA-N	0	3	344.474	3.488	20	30		EGEDHN
CC[C@H](CNC(=O)Cc1ccoc1)NCC#Cc1ccc(Cl)cc1	ZINC001753474048	1440414670	/nfs/dbraw/zinc/41/46/70/1440414670.db2.gz	XKOSRZOPNGUBRH-GOSISDBHSA-N	0	3	344.842	3.012	20	30		EGEDHN
C=C(Br)CNCC1(NC(=O)CCC2CC2)CCCC1	ZINC001753500536	1440423229	/nfs/dbraw/zinc/42/32/29/1440423229.db2.gz	JHMLIXUQYFYLGD-UHFFFAOYSA-N	0	3	329.282	3.104	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2cccc3c2O[C@H](C)C3)CCCC1	ZINC001753504708	1440424154	/nfs/dbraw/zinc/42/41/54/1440424154.db2.gz	CYOJWPFYHPYLEW-CQSZACIVSA-N	0	3	348.874	3.395	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2ncoc2CC)CCCC[C@@H]1C	ZINC001753531769	1440431260	/nfs/dbraw/zinc/43/12/60/1440431260.db2.gz	MOLYYHUDMJUBHG-YVEFUNNKSA-N	0	3	339.867	3.258	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2ncoc2CC)CCCC[C@H]1C	ZINC001753531766	1440431268	/nfs/dbraw/zinc/43/12/68/1440431268.db2.gz	MOLYYHUDMJUBHG-PXAZEXFGSA-N	0	3	339.867	3.258	20	30		EGEDHN
C#CCCCCC(=O)N1CCC[C@@H](CCNCc2c(C)noc2C)C1	ZINC001753542838	1440433809	/nfs/dbraw/zinc/43/38/09/1440433809.db2.gz	ALEMRNARHNJECL-SFHVURJKSA-N	0	3	345.487	3.203	20	30		EGEDHN
CC(C)(F)C(=O)N1CCC(CCNCc2cc(F)ccc2C#N)CC1	ZINC001753563154	1440437237	/nfs/dbraw/zinc/43/72/37/1440437237.db2.gz	LGBFYHRQGVFLNA-UHFFFAOYSA-N	0	3	349.425	3.164	20	30		EGEDHN
C[C@H]1C[C@H]1C(=O)NCc1ccc(CNCC#Cc2ccccc2)cc1	ZINC001753588619	1440442164	/nfs/dbraw/zinc/44/21/64/1440442164.db2.gz	UMWHMGZFTGRCAQ-LAUBAEHRSA-N	0	3	332.447	3.100	20	30		EGEDHN
C=CCCC(=O)NCc1ccc(CNCC#Cc2ccccc2)cc1	ZINC001753598260	1440445526	/nfs/dbraw/zinc/44/55/26/1440445526.db2.gz	UMJHBNNENOOQJL-UHFFFAOYSA-N	0	3	332.447	3.410	20	30		EGEDHN
CC(C(=O)NC[C@@H](C)CNCc1cc(F)ccc1C#N)=C1CCC1	ZINC001753613499	1440449181	/nfs/dbraw/zinc/44/91/81/1440449181.db2.gz	YPHGIJAGFHPYBZ-ZDUSSCGKSA-N	0	3	329.419	3.040	20	30		EGEDHN
C[C@@H](CNCc1ccccc1C#N)CNC(=O)c1cc2ccccc2[nH]1	ZINC001753642174	1440454718	/nfs/dbraw/zinc/45/47/18/1440454718.db2.gz	KEIUYYOKLNNFDF-HNNXBMFYSA-N	0	3	346.434	3.195	20	30		EGEDHN
Cc1ccc(F)c(CNC2(CNC(=O)C#CC3CC3)CCCC2)c1	ZINC001753664145	1440459538	/nfs/dbraw/zinc/45/95/38/1440459538.db2.gz	PUAUNWOJPZARBV-UHFFFAOYSA-N	0	3	328.431	3.066	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)[C@@H](C)C2CCC2)CCCC1	ZINC001753665217	1440459988	/nfs/dbraw/zinc/45/99/88/1440459988.db2.gz	UBJSRSKDFUKWPT-ZDUSSCGKSA-N	0	3	343.309	3.350	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CO[C@@H]2CCCC[C@@H]2C)CCCC1	ZINC001753669466	1440461460	/nfs/dbraw/zinc/46/14/60/1440461460.db2.gz	SNJHRVWGFJBLRF-GOEBONIOSA-N	0	3	342.911	3.353	20	30		EGEDHN
C=CCOCCN1CC2(C1)CCN(C(=O)c1cc(C)c(C)s1)CC2	ZINC001753677327	1440463660	/nfs/dbraw/zinc/46/36/60/1440463660.db2.gz	OTNKERIYTCSSJE-UHFFFAOYSA-N	0	3	348.512	3.106	20	30		EGEDHN
C[C@H](CNCC#Cc1ccccc1Cl)N(C)C(=O)c1ccco1	ZINC001753677822	1440463681	/nfs/dbraw/zinc/46/36/81/1440463681.db2.gz	RYRXYCLWRUGCSA-CQSZACIVSA-N	0	3	330.815	3.035	20	30		EGEDHN
C[C@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)CC1CCCC1	ZINC001753677484	1440463712	/nfs/dbraw/zinc/46/37/12/1440463712.db2.gz	PIEVXIVVXLYWSQ-CQSZACIVSA-N	0	3	331.435	3.214	20	30		EGEDHN
C[C@H](CNCC#Cc1ccccc1)N(C)C(=O)c1ccc(Cl)o1	ZINC001753678991	1440464245	/nfs/dbraw/zinc/46/42/45/1440464245.db2.gz	HCBBOLZXEMLBDN-CQSZACIVSA-N	0	3	330.815	3.035	20	30		EGEDHN
CC(C)C[C@@H](CNCC#Cc1ccc(F)cc1)NC(=O)C=C1CCC1	ZINC001753732568	1440476512	/nfs/dbraw/zinc/47/65/12/1440476512.db2.gz	GXQODRNKZUQSLP-FQEVSTJZSA-N	0	3	342.458	3.408	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCCCN1C(=O)c1cnc(C)s1	ZINC001753773773	1440486092	/nfs/dbraw/zinc/48/60/92/1440486092.db2.gz	TZISJQUUHOBFHD-ZDUSSCGKSA-N	0	3	327.881	3.178	20	30		EGEDHN
C[C@H]1CCCN(C(=O)C2=CCCC2)[C@@H]1CNCC#Cc1ccccc1	ZINC001753804126	1440491482	/nfs/dbraw/zinc/49/14/82/1440491482.db2.gz	FBZRRPMNMMJOEX-GHTZIAJQSA-N	0	3	336.479	3.365	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@@H]([C@H](C)NCc2nnc(C(C)C)[nH]2)C1	ZINC001753815333	1440493677	/nfs/dbraw/zinc/49/36/77/1440493677.db2.gz	LMDLGQOVIVWEAD-JKSUJKDBSA-N	0	3	347.507	3.001	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@H](C)[C@H]1CNCc1cncs1	ZINC001753819166	1440495199	/nfs/dbraw/zinc/49/51/99/1440495199.db2.gz	PGUPGHVGOUDDDP-GOEBONIOSA-N	0	3	335.517	3.462	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@@H](NCc2cc(C#N)ccc2F)C(C)C)o1	ZINC001753822709	1440496808	/nfs/dbraw/zinc/49/68/08/1440496808.db2.gz	ORFZFKAXUBMMOT-QGZVFWFLSA-N	0	3	343.402	3.143	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)[C@H](C)Cc1ccccc1F)C(C)C	ZINC001753837593	1440501559	/nfs/dbraw/zinc/50/15/59/1440501559.db2.gz	GRSYXPGLWGBFJQ-CXAGYDPISA-N	0	3	340.870	3.487	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)Cc1ccccc1Cl)C(C)C	ZINC001753841594	1440502927	/nfs/dbraw/zinc/50/29/27/1440502927.db2.gz	BIBJWXNWYXJGJH-OAHLLOKOSA-N	0	3	329.271	3.365	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cccc(F)c1OCC)C(C)C	ZINC001753842282	1440503108	/nfs/dbraw/zinc/50/31/08/1440503108.db2.gz	JWIJXZJXEYANQL-OAHLLOKOSA-N	0	3	342.842	3.321	20	30		EGEDHN
C[C@@H](CCNCc1c(Cl)cccc1Cl)NC(=O)C#CC1CC1	ZINC001753965168	1440526481	/nfs/dbraw/zinc/52/64/81/1440526481.db2.gz	WBWSDODXYQXGLF-LBPRGKRZSA-N	0	3	339.266	3.391	20	30		EGEDHN
N#Cc1cccc(CNC/C=C\CNC(=O)[C@@H]2CCCC3(CC3)C2)c1	ZINC001754119255	1440542524	/nfs/dbraw/zinc/54/25/24/1440542524.db2.gz	JGWLPRFNWVIHOW-COLJXDCZSA-N	0	3	337.467	3.291	20	30		EGEDHN
CC(C)c1[nH]ccc1C(=O)NC/C=C/CNCc1ccc(C#N)cc1	ZINC001754160917	1440545986	/nfs/dbraw/zinc/54/59/86/1440545986.db2.gz	STWKWCWIAIWLTM-ONEGZZNKSA-N	0	3	336.439	3.086	20	30		EGEDHN
C[C@@H](CN(C)Cc1cccc(C#N)c1)NC(=O)c1ccoc1Cl	ZINC001754308849	1440572411	/nfs/dbraw/zinc/57/24/11/1440572411.db2.gz	WWNAOIKNDRBFRL-LBPRGKRZSA-N	0	3	331.803	3.055	20	30		EGEDHN
C[C@H]1CCCC[C@@H]1C(=O)N(C)CCCNCc1ccccc1C#N	ZINC001754397064	1440594771	/nfs/dbraw/zinc/59/47/71/1440594771.db2.gz	IVCCGWKPMBXZPC-LPHOPBHVSA-N	0	3	327.472	3.323	20	30		EGEDHN
C[C@H]1CC[C@@H](C(=O)N(C)CCCNCc2ccc(C#N)cc2F)C1	ZINC001754400893	1440595206	/nfs/dbraw/zinc/59/52/06/1440595206.db2.gz	KHNVIZGNEDVKET-GOEBONIOSA-N	0	3	331.435	3.072	20	30		EGEDHN
C=CCC[C@H](C)N1CC[C@@H]1CNC(=O)c1c(C)nn(CCC)c1C	ZINC001754498015	1440612889	/nfs/dbraw/zinc/61/28/89/1440612889.db2.gz	RNUYATIVTOPHNT-WMLDXEAASA-N	0	3	332.492	3.069	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NC[C@H]1CCN1[C@H](C)c1ccccc1C	ZINC001754501892	1440614700	/nfs/dbraw/zinc/61/47/00/1440614700.db2.gz	ZXOPCAQNQQTGBO-WIYYLYMNSA-N	0	3	346.474	3.471	20	30		EGEDHN
O=C(CC#Cc1ccccc1)NC[C@@H]1CCN1CC1CC2(CCC2)C1	ZINC001754504219	1440615717	/nfs/dbraw/zinc/61/57/17/1440615717.db2.gz	DFKIXRGFPJNHFM-FQEVSTJZSA-N	0	3	336.479	3.199	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@]2(C1)CCCN(Cc1cccc(C#N)c1)C2	ZINC001754556232	1440631721	/nfs/dbraw/zinc/63/17/21/1440631721.db2.gz	XINOIEWILFAZBR-JOCHJYFZSA-N	0	3	349.478	3.176	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](NCc2ccn(C(C)C)n2)C[C@H]1C	ZINC001754596374	1440641544	/nfs/dbraw/zinc/64/15/44/1440641544.db2.gz	VZQLVUZSOLORSO-IAGOWNOFSA-N	0	3	332.492	3.289	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1CCC[C@H]1CNCc1cc(C#N)ccc1OC	ZINC001754606946	1440643310	/nfs/dbraw/zinc/64/33/10/1440643310.db2.gz	KEQCUAOKBMJSDJ-QAPCUYQASA-N	0	3	343.471	3.084	20	30		EGEDHN
C#CCNC[C@@H](NC(=O)[C@@H](F)C(C)C)c1ccc2ccccc2c1	ZINC001754644156	1440649699	/nfs/dbraw/zinc/64/96/99/1440649699.db2.gz	PEWMMEBUYYHPBF-MOPGFXCFSA-N	0	3	326.415	3.214	20	30		EGEDHN
CC#CCNC[C@@H](NC(=O)C(C)(C)F)c1ccc2ccccc2c1	ZINC001754644926	1440650089	/nfs/dbraw/zinc/65/00/89/1440650089.db2.gz	YVLDIDNXBHLWGR-GOSISDBHSA-N	0	3	326.415	3.358	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)CCOc2ccc(C)cc2C)C1	ZINC001754674164	1440659274	/nfs/dbraw/zinc/65/92/74/1440659274.db2.gz	OOXMYWPDGNSIJU-HXUWFJFHSA-N	0	3	330.472	3.229	20	30		EGEDHN
C#CCCCCC(=O)NC[C@]1(C)CCCN(Cc2cccnc2C)C1	ZINC001754725009	1440675446	/nfs/dbraw/zinc/67/54/46/1440675446.db2.gz	IXRKFGVEKLVWAM-NRFANRHFSA-N	0	3	341.499	3.302	20	30		EGEDHN
C#CCCCC(=O)NC[C@@]1(C)CCCN(Cc2ccc(C)nc2C)C1	ZINC001754726194	1440676291	/nfs/dbraw/zinc/67/62/91/1440676291.db2.gz	VVLRUWWXTOOZOI-OAQYLSRUSA-N	0	3	341.499	3.220	20	30		EGEDHN
C=CCN1CCC[C@](C)(CNC(=O)C2C3CC4CC(C3)CC2C4)C1	ZINC001754727012	1440676597	/nfs/dbraw/zinc/67/65/97/1440676597.db2.gz	DGHWCKYISUUJHU-XWYJBKDPSA-N	0	3	330.516	3.463	20	30		EGEDHN
C=CCN1CCC[C@](C)(CNC(=O)c2ccc(-c3cn[nH]c3)cc2)C1	ZINC001754732238	1440680074	/nfs/dbraw/zinc/68/00/74/1440680074.db2.gz	QIIKMUNOFOQNAR-HXUWFJFHSA-N	0	3	338.455	3.095	20	30		EGEDHN
CC#CCN1CCC[C@](C)(CNC(=O)c2ccc(C)nc2C(C)C)C1	ZINC001754736891	1440682598	/nfs/dbraw/zinc/68/25/98/1440682598.db2.gz	VITFEGMWIHCOLJ-OAQYLSRUSA-N	0	3	341.499	3.369	20	30		EGEDHN
CC1(CC(=O)N[C@@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2C#N)C3)CC1	ZINC001754784891	1440687344	/nfs/dbraw/zinc/68/73/44/1440687344.db2.gz	HVMDTAFGFXKLDY-IPELMVKDSA-N	0	3	337.467	3.218	20	30		EGEDHN
C#CCCN[C@@H](CNC(=O)C(C)(C)C1CC1)c1ccccc1CC	ZINC001754786132	1440687850	/nfs/dbraw/zinc/68/78/50/1440687850.db2.gz	VDWOVOUNUVMSHZ-IBGZPJMESA-N	0	3	326.484	3.455	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NC[C@H](NCC=C)c1ccccc1CC	ZINC001754788827	1440688310	/nfs/dbraw/zinc/68/83/10/1440688310.db2.gz	HEUSGMGQTCKUKE-QFIPXVFZSA-N	0	3	346.474	3.406	20	30		EGEDHN
CC(C)(C)C#CC(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2Cc1cncs1	ZINC001754830105	1440694621	/nfs/dbraw/zinc/69/46/21/1440694621.db2.gz	DZJDTOYIUNFRIR-MUJYYYPQSA-N	0	3	345.512	3.052	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)/C=C(\C)C2CC2)CC1	ZINC001754839411	1440697499	/nfs/dbraw/zinc/69/74/99/1440697499.db2.gz	POUDOTIDJQLHPY-BMRADRMJSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=CCCN1CCC[C@](CO)(NC(=O)c2ccc3sccc3c2)C1	ZINC001754859358	1440700736	/nfs/dbraw/zinc/70/07/36/1440700736.db2.gz	VMZBPJTXZUTJFO-IBGZPJMESA-N	0	3	344.480	3.034	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1cncc(C)c1	ZINC001754864838	1440702524	/nfs/dbraw/zinc/70/25/24/1440702524.db2.gz	DUFZCNUGMAPRAS-RTBURBONSA-N	0	3	327.472	3.312	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](OCC)c1ccccc1	ZINC001754871244	1440705121	/nfs/dbraw/zinc/70/51/21/1440705121.db2.gz	GNXPKSAFNNPHNZ-QRVBRYPASA-N	0	3	328.456	3.016	20	30		EGEDHN
C=CCN(C)Cc1ccccc1CNC(=O)c1cnc(C2CC2)o1	ZINC001754945855	1440712940	/nfs/dbraw/zinc/71/29/40/1440712940.db2.gz	LGJOUXGXHZIYFI-UHFFFAOYSA-N	0	3	325.412	3.100	20	30		EGEDHN
C#CCCCC(=O)N1CC2(C1)CCN(Cc1cc(C)ccc1F)CC2	ZINC001754959924	1440717303	/nfs/dbraw/zinc/71/73/03/1440717303.db2.gz	QELSVGZQSVXTOJ-UHFFFAOYSA-N	0	3	342.458	3.362	20	30		EGEDHN
CC#CCNC1(CNC(=O)c2ccc(-c3ccccc3)nc2)CCC1	ZINC001754988611	1440723549	/nfs/dbraw/zinc/72/35/49/1440723549.db2.gz	DEMKZYWQZZFQSG-UHFFFAOYSA-N	0	3	333.435	3.014	20	30		EGEDHN
CC#CCNC[C@H]1CN(C(=O)[C@@H](CCC)CC2CCCCC2)CCO1	ZINC001755009654	1440725911	/nfs/dbraw/zinc/72/59/11/1440725911.db2.gz	PCYGTNJCKKFCTA-PMACEKPBSA-N	0	3	348.531	3.213	20	30		EGEDHN
CCCCCN1Cc2ccc(CNC(=O)c3ccc(C#N)[nH]3)cc2C1	ZINC001755101210	1440752374	/nfs/dbraw/zinc/75/23/74/1440752374.db2.gz	WCHKPQNOPSQEAI-UHFFFAOYSA-N	0	3	336.439	3.322	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@@H](OC)C3CCC3)cc2C1	ZINC001755102272	1440753520	/nfs/dbraw/zinc/75/35/20/1440753520.db2.gz	OUEMPGSZSCORPF-FQEVSTJZSA-N	0	3	342.483	3.400	20	30		EGEDHN
CC1(C)CN(Cc2cccc(C#N)c2)CC[C@H]1NC(=O)CCC1CC1	ZINC001755138632	1440759420	/nfs/dbraw/zinc/75/94/20/1440759420.db2.gz	BSRPLJMXTCZERN-LJQANCHMSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC(C)CCC(=O)N[C@@H]1CCN(Cc2cccc(C#N)c2)[C@@H](C)C1	ZINC001755157407	1440763394	/nfs/dbraw/zinc/76/33/94/1440763394.db2.gz	IDDFFDPIMPHJHZ-QFBILLFUSA-N	0	3	327.472	3.464	20	30		EGEDHN
CC#CCCCC(=O)N[C@H]1CCN(Cc2scnc2C)[C@H](C)C1	ZINC001755164505	1440766358	/nfs/dbraw/zinc/76/63/58/1440766358.db2.gz	WOMFEONFZNJNTN-ZBFHGGJFSA-N	0	3	333.501	3.114	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@@H]1CNC(=O)C1(C)CCOCC1	ZINC001755171521	1440769141	/nfs/dbraw/zinc/76/91/41/1440769141.db2.gz	XIKZCLVOVCWANQ-IBGZPJMESA-N	0	3	342.483	3.095	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)[C@H]2CC[C@H](CC)O2)CC1	ZINC001755183317	1440771793	/nfs/dbraw/zinc/77/17/93/1440771793.db2.gz	HRQMIAYCXIAFQL-DLBZAZTESA-N	0	3	342.911	3.257	20	30		EGEDHN
C#CCCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc[nH]c1C(C)C	ZINC001755186625	1440773353	/nfs/dbraw/zinc/77/33/53/1440773353.db2.gz	CPZYIFUCOTXQSM-UYAOXDASSA-N	0	3	335.451	3.147	20	30		EGEDHN
C#CCCN[C@@H]1c2ccccc2C[C@H]1NC(=O)C1CCC(F)(F)CC1	ZINC001755187061	1440773492	/nfs/dbraw/zinc/77/34/92/1440773492.db2.gz	TYIBPFKNRYGUMF-QZTJIDSGSA-N	0	3	346.421	3.207	20	30		EGEDHN
C=CCN(C)C[C@@H]1CCCN1C(=O)[C@H](C)OCc1ccc(C)cc1	ZINC001755196686	1440777137	/nfs/dbraw/zinc/77/71/37/1440777137.db2.gz	RJYAKZXTHHMQDC-HKUYNNGSSA-N	0	3	330.472	3.009	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](C2CCN(C(=O)COC(C)C)CC2)C1	ZINC001755204115	1440781542	/nfs/dbraw/zinc/78/15/42/1440781542.db2.gz	HDWCKFFATBKKAI-KRWDZBQOSA-N	0	3	342.911	3.115	20	30		EGEDHN
C=C(Cl)CNCC1CC(NC(=O)C/C=C/c2ccc(F)cc2)C1	ZINC001755213881	1440783662	/nfs/dbraw/zinc/78/36/62/1440783662.db2.gz	XSRNDCIJIABZGO-NSCUHMNNSA-N	0	3	336.838	3.466	20	30		EGEDHN
C=C(Cl)CNCC1CC(NC(=O)C[C@@H]2CCc3ccccc3C2)C1	ZINC001755221377	1440784741	/nfs/dbraw/zinc/78/47/41/1440784741.db2.gz	WBGUVKBVQMFSJN-MDCZIUGASA-N	0	3	346.902	3.419	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H](C)N(C)[C@@H]1CCc2ccc(F)cc21	ZINC001755296740	1440806547	/nfs/dbraw/zinc/80/65/47/1440806547.db2.gz	QKNOQGWDXGNYLX-DNVCBOLYSA-N	0	3	330.447	3.443	20	30		EGEDHN
COc1cccc([C@H](C)N(C)[C@@H](C)CNC(=O)C#CC(C)(C)C)c1	ZINC001755299326	1440807822	/nfs/dbraw/zinc/80/78/22/1440807822.db2.gz	AIGPZWNSRPFFSU-HOTGVXAUSA-N	0	3	330.472	3.242	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@H](C)N(C)[C@@H]1CCc2c1cccc2F	ZINC001755314990	1440815313	/nfs/dbraw/zinc/81/53/13/1440815313.db2.gz	ZUUHQKCRUJLSJF-DNVCBOLYSA-N	0	3	330.447	3.443	20	30		EGEDHN
C[C@@H](C(=O)NC[C@@H]1CCCCCN1Cc1ccc(C#N)cc1)C1CC1	ZINC001755365015	1440833889	/nfs/dbraw/zinc/83/38/89/1440833889.db2.gz	OEBDJENGVCBIER-UZLBHIALSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C2CN(CC3CC(F)(F)C3)C2)CCC1	ZINC001755383997	1440840125	/nfs/dbraw/zinc/84/01/25/1440840125.db2.gz	YZQRIPSMCHUHQQ-ZDUSSCGKSA-N	0	3	326.431	3.215	20	30		EGEDHN
C#CCCCCCC(=O)N1C[C@@]2(C)CN(C[C@H](F)CC)C[C@@]2(C)C1	ZINC001755461710	1440857685	/nfs/dbraw/zinc/85/76/85/1440857685.db2.gz	DNYPRLUCRYTGGG-RLLQIKCJSA-N	0	3	336.495	3.489	20	30		EGEDHN
C=C(Cl)CNC[C@@H]1CC2(CO1)CCN(C(=O)CCCCC)CC2	ZINC001755464206	1440858063	/nfs/dbraw/zinc/85/80/63/1440858063.db2.gz	JULFRUKCUJJJEN-INIZCTEOSA-N	0	3	342.911	3.307	20	30		EGEDHN
C=C(Cl)CNCCC[C@@H](C)NC(=O)c1cc2nc(C)ccc2o1	ZINC001755521385	1440864930	/nfs/dbraw/zinc/86/49/30/1440864930.db2.gz	HEOZVLOYOLLBOQ-GFCCVEGCSA-N	0	3	335.835	3.377	20	30		EGEDHN
C=C(C)CCC(=O)N(C)[C@@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001755562350	1440874831	/nfs/dbraw/zinc/87/48/31/1440874831.db2.gz	METNFJPZZDEXKI-KRWDZBQOSA-N	0	3	331.485	3.303	20	30		EGEDHN
C=C(Br)CNC[C@@H](C1CC1)N(C)C(=O)C1(CC)CCC1	ZINC001755564202	1440875303	/nfs/dbraw/zinc/87/53/03/1440875303.db2.gz	HOEMYIOADWMMAU-AWEZNQCLSA-N	0	3	343.309	3.302	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@@H](CO)NCc1ccc(C(C)(C)C)cc1	ZINC001755640642	1440890856	/nfs/dbraw/zinc/89/08/56/1440890856.db2.gz	NRXIJCGEAMKOLU-SFHVURJKSA-N	0	3	346.515	3.153	20	30		EGEDHN
C[C@H]1[C@H](NCc2ccc(C#N)s2)CCN1C(=O)CCCC1CC1	ZINC001755659583	1440892470	/nfs/dbraw/zinc/89/24/70/1440892470.db2.gz	SSPPGTNCVGOLSM-SUMWQHHRSA-N	0	3	331.485	3.279	20	30		EGEDHN
C#CCN1CC[C@]2(NC(=O)C[C@@H](C)c3ccc(CC)cc3)CCC[C@@H]12	ZINC001755699927	1440899561	/nfs/dbraw/zinc/89/95/61/1440899561.db2.gz	DGEUFXYGYVCXLL-NQSCKRDGSA-N	0	3	338.495	3.489	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CCCN(CCOc2ccc(OC)cc2)[C@H]1C	ZINC001755713784	1440904242	/nfs/dbraw/zinc/90/42/42/1440904242.db2.gz	DCTNCXOSFPLNOA-LPHOPBHVSA-N	0	3	346.471	3.009	20	30		EGEDHN
Cc1cc(C)cc(CN2CCC[C@@H](NC(=O)CSCC#N)[C@H]2C)c1	ZINC001755715125	1440904923	/nfs/dbraw/zinc/90/49/23/1440904923.db2.gz	UQQRZTJMFGLNLV-SJLPKXTDSA-N	0	3	345.512	3.029	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CCCN(Cc2ccc3cc[nH]c3c2)[C@@H]1C	ZINC001755731238	1440910296	/nfs/dbraw/zinc/91/02/96/1440910296.db2.gz	OGTAVKDEAMEUIW-VQIMIIECSA-N	0	3	337.467	3.441	20	30		EGEDHN
CCC[C@H](C)C(=O)N1C[C@H](NCc2ccc(C#N)c(F)c2)C(C)(C)C1	ZINC001755753641	1440913506	/nfs/dbraw/zinc/91/35/06/1440913506.db2.gz	NXGCOXUSNWJKKE-KSSFIOAISA-N	0	3	345.462	3.460	20	30		EGEDHN
CO[C@@H](CN(C)CCN(C(=O)C#CC(C)(C)C)C(C)C)C1CCC1	ZINC001755810927	1440920147	/nfs/dbraw/zinc/92/01/47/1440920147.db2.gz	QSTSYEGGPOKEPX-SFHVURJKSA-N	0	3	336.520	3.020	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)N(CCN(C)Cc1c(C)cccc1C)C(C)C	ZINC001755810943	1440920413	/nfs/dbraw/zinc/92/04/13/1440920413.db2.gz	RAAGEHPZSLOFKF-NRFANRHFSA-N	0	3	346.515	3.299	20	30		EGEDHN
C=CCN(C)CCN(C(=O)Cc1ccc(Cl)c(F)c1)C(C)C	ZINC001755814982	1440922933	/nfs/dbraw/zinc/92/29/33/1440922933.db2.gz	WMSYAKKMNWAUHV-UHFFFAOYSA-N	0	3	326.843	3.376	20	30		EGEDHN
C#CCCN(C)CCN(C(=O)[C@H]1C[C@H]1c1cc(F)ccc1F)C(C)C	ZINC001755815459	1440923303	/nfs/dbraw/zinc/92/33/03/1440923303.db2.gz	LJDHNLOVYMYXIM-WMZOPIPTSA-N	0	3	348.437	3.260	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@H](C)C1CCN(Cc2ccccn2)CC1	ZINC001755844973	1440933022	/nfs/dbraw/zinc/93/30/22/1440933022.db2.gz	REDYDGZUJHQPFQ-IAGOWNOFSA-N	0	3	329.488	3.401	20	30		EGEDHN
CC#CCN1CCC([C@@H](C)NC(=O)C[C@@H]2CCc3ccccc32)CC1	ZINC001755845910	1440933210	/nfs/dbraw/zinc/93/32/10/1440933210.db2.gz	DTWABRZNCJHPGE-XLIONFOSSA-N	0	3	338.495	3.347	20	30		EGEDHN
CC[C@H](C)C(=O)N(C)C1CC(NCC#Cc2ccccc2Cl)C1	ZINC001755853024	1440935293	/nfs/dbraw/zinc/93/52/93/1440935293.db2.gz	IPTAFUMELXKMRI-OOHWJJMZSA-N	0	3	332.875	3.317	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N(C)C1CC(NCc2cc(C#N)ccc2F)C1	ZINC001755859565	1440936375	/nfs/dbraw/zinc/93/63/75/1440936375.db2.gz	XUZBBNMRMCLCLE-UHFFFAOYSA-N	0	3	343.446	3.379	20	30		EGEDHN
Cc1nsc(N2C[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C2)c1C#N	ZINC000368185112	168321642	/nfs/dbraw/zinc/32/16/42/168321642.db2.gz	QBFVMPDXIPBEEI-DLBZAZTESA-N	0	3	338.480	3.282	20	30		EGEDHN
N#Cc1cccc(NC(=O)CN[C@H](C[C@@H]2CCOC2)c2ccccc2)c1	ZINC000181183214	234109553	/nfs/dbraw/zinc/10/95/53/234109553.db2.gz	FPLVQWHYQMDLJF-FXAWDEMLSA-N	0	3	349.434	3.254	20	30		EGEDHN
C[C@H](NCc1cccc(CN2CCOCC2)c1)c1ccc(C#N)cc1	ZINC000181530450	234220238	/nfs/dbraw/zinc/22/02/38/234220238.db2.gz	JGOJDJBTGCUCHN-KRWDZBQOSA-N	0	3	335.451	3.241	20	30		EGEDHN
Cc1nsc(N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)c1C#N	ZINC000368545547	242001633	/nfs/dbraw/zinc/00/16/33/242001633.db2.gz	NJAOLTMBJNBWOC-KBPBESRZSA-N	0	3	348.516	3.039	20	30		EGEDHN
COc1cc(C#N)ccc1CN1CC[C@H]2[C@@H](CCCN2C2CC2)C1	ZINC000246058864	243187940	/nfs/dbraw/zinc/18/79/40/243187940.db2.gz	YCQIXDUQMXRODH-LPHOPBHVSA-N	0	3	325.456	3.016	20	30		EGEDHN
N#Cc1ccc(CNC(=O)CN[C@H](c2ccccc2)C2CCC2)cc1	ZINC000264229281	246215697	/nfs/dbraw/zinc/21/56/97/246215697.db2.gz	YCMMYWPPLGMHTR-OAQYLSRUSA-N	0	3	333.435	3.305	20	30		EGEDHN
C[C@H](NC(=O)N1CCC[C@H]1CN1CCCCC1)c1ccc(C#N)cc1	ZINC000264280882	246286496	/nfs/dbraw/zinc/28/64/96/246286496.db2.gz	ROEVFXLLDHATJC-LPHOPBHVSA-N	0	3	340.471	3.279	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC2CC(C)(c3ccccc3)C2)CC1	ZINC000264350155	246387626	/nfs/dbraw/zinc/38/76/26/246387626.db2.gz	LQIPCJMDAZJCAQ-UHFFFAOYSA-N	0	3	327.472	3.056	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN2CC[C@@]3(C2)CCc2ccccc2O3)cc1	ZINC000377657922	169056177	/nfs/dbraw/zinc/05/61/77/169056177.db2.gz	IRRVDCFYOUFLIY-PZJWPPBQSA-N	0	3	334.419	3.061	20	30		EGEDHN
CN(C)Cc1ccc(NC(=O)C(C)(C)Oc2ccc(C#N)cc2)cc1	ZINC000268712638	252161903	/nfs/dbraw/zinc/16/19/03/252161903.db2.gz	FGIPCUSVVDQFIG-UHFFFAOYSA-N	0	3	337.423	3.416	20	30		EGEDHN
C[C@H]1SCCN(CCC(=O)Nc2sc3c(c2C#N)CCC3)[C@@H]1C	ZINC000118415281	221148417	/nfs/dbraw/zinc/14/84/17/221148417.db2.gz	LCJUWFRQCKDOQT-VXGBXAGGSA-N	0	3	349.525	3.263	20	30		EGEDHN
C[C@@H](c1ccc(C#N)cc1)N1CCC[C@H](CNC(=O)c2ccco2)C1	ZINC000338375412	141111567	/nfs/dbraw/zinc/11/15/67/141111567.db2.gz	FONINRKNPSUGRO-DOTOQJQBSA-N	0	3	337.423	3.354	20	30		EGEDHN
CO[C@@H]1[C@H](C)[C@@H](N[C@H](C)C(=O)Nc2ccc(C#N)c(Cl)c2)C1(C)C	ZINC000344471376	141159661	/nfs/dbraw/zinc/15/96/61/141159661.db2.gz	UWTYEWFSSRPXAL-HOJOPBEUSA-N	0	3	349.862	3.188	20	30		EGEDHN
N#Cc1ccc(CNCCCC(=O)N2Cc3ccccc3C2)c(F)c1	ZINC000344482976	141162551	/nfs/dbraw/zinc/16/25/51/141162551.db2.gz	KXVBNBIXYQRKSO-UHFFFAOYSA-N	0	3	337.398	3.110	20	30		EGEDHN
CCO[C@H]1C[C@@H](NCC(=O)Nc2oc(C)c(C)c2C#N)C1(CC)CC	ZINC000187051723	144151470	/nfs/dbraw/zinc/15/14/70/144151470.db2.gz	RYEFEKLWECVRAR-CVEARBPZSA-N	0	3	347.459	3.280	20	30		EGEDHN
CCO[C@H]1C[C@H](NCc2cc(C#N)cs2)[C@@H]1Oc1ccccc1	ZINC000187637598	144162377	/nfs/dbraw/zinc/16/23/77/144162377.db2.gz	HTKBSLHUTGZMHC-BZSNNMDCSA-N	0	3	328.437	3.334	20	30		EGEDHN
CC1CCC(N2CCN(CCOc3cccc(C#N)c3)CC2)CC1	ZINC000115565989	152020144	/nfs/dbraw/zinc/02/01/44/152020144.db2.gz	UNJUWWWYZOPXFV-UHFFFAOYSA-N	0	3	327.472	3.133	20	30		EGEDHN
CC[C@@H](Cc1ccccc1)N[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000190619679	153151858	/nfs/dbraw/zinc/15/18/58/153151858.db2.gz	JPWGSWIUZPYGNI-LEWJYISDSA-N	0	3	347.462	3.270	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN2CCC(c3c[nH]c4ncccc34)CC2)cc1	ZINC000305085019	154082214	/nfs/dbraw/zinc/08/22/14/154082214.db2.gz	SXQDZSRIPATRNJ-FQEVSTJZSA-N	0	3	346.434	3.348	20	30		EGEDHN
N#Cc1cc2c(nc1N1CCCN(Cc3ccccc3)CC1)CCC2	ZINC000323659403	154172133	/nfs/dbraw/zinc/17/21/33/154172133.db2.gz	LRUPMQQBROCHHU-UHFFFAOYSA-N	0	3	332.451	3.154	20	30		EGEDHN
CCN1C[C@H](C)N(Cc2ccc(Br)cc2C#N)C[C@H]1C	ZINC000346979488	156228168	/nfs/dbraw/zinc/22/81/68/156228168.db2.gz	LQXVCACWOAVJSU-OLZOCXBDSA-N	0	3	336.277	3.235	20	30		EGEDHN
Cc1nc(C(=O)NC[C@H]2CCCCN2Cc2ccccc2)ccc1C#N	ZINC000109303398	162097853	/nfs/dbraw/zinc/09/78/53/162097853.db2.gz	KDQRHJAWBMLXOW-LJQANCHMSA-N	0	3	348.450	3.046	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN1CC[C@H](c2ccccc2)C1	ZINC000123358133	162255599	/nfs/dbraw/zinc/25/55/99/162255599.db2.gz	XVVCEFLGHFNUNF-INIZCTEOSA-N	0	3	325.437	3.438	20	30		EGEDHN
Cc1ccccc1OCCNCc1cn(C)nc1-c1ccc(C#N)cc1	ZINC000180097052	162723138	/nfs/dbraw/zinc/72/31/38/162723138.db2.gz	ROMMDCSYJMQMNN-UHFFFAOYSA-N	0	3	346.434	3.436	20	30		EGEDHN
CSc1ccc([C@@H](CNc2cc(C#N)cc(C)n2)N(C)C)cc1	ZINC000338835018	163358985	/nfs/dbraw/zinc/35/89/85/163358985.db2.gz	GLWGUJPBOCMRBX-QGZVFWFLSA-N	0	3	326.469	3.120	20	30		EGEDHN
C[C@H](NCCNC(=O)c1ccc(Cl)cc1)c1ccc(C#N)cc1	ZINC000344026710	164085683	/nfs/dbraw/zinc/08/56/83/164085683.db2.gz	UUYXANKNCITRSS-ZDUSSCGKSA-N	0	3	327.815	3.292	20	30		EGEDHN
C[C@@H](NCc1ccc(CN2CCOCC2)cc1)c1ccc(C#N)cc1	ZINC000344102873	164102963	/nfs/dbraw/zinc/10/29/63/164102963.db2.gz	UPLQIMJDABZABU-QGZVFWFLSA-N	0	3	335.451	3.241	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N(C)CCn1cc(Br)cn1	ZINC000344222925	164130113	/nfs/dbraw/zinc/13/01/13/164130113.db2.gz	MBUPPNFFKXVGBO-LBPRGKRZSA-N	0	3	333.233	3.210	20	30		EGEDHN
N#Cc1csc(CN[C@H]2CCCN(c3ccc(C#N)cc3F)C2)c1	ZINC000344238258	164134085	/nfs/dbraw/zinc/13/40/85/164134085.db2.gz	IIUVVGDTWUXOGX-HNNXBMFYSA-N	0	3	340.427	3.389	20	30		EGEDHN
CN(CCCN1CCN(c2ccccc2)CC1)Cc1cccc(C#N)c1	ZINC000352102265	165236648	/nfs/dbraw/zinc/23/66/48/165236648.db2.gz	KVERODGPHIJTTR-UHFFFAOYSA-N	0	3	348.494	3.202	20	30		EGEDHN
N#Cc1cccc(OCCCN2CC3(CCC3)[C@@H]2[C@H]2CCCO2)c1	ZINC000352423408	165394053	/nfs/dbraw/zinc/39/40/53/165394053.db2.gz	NXGMUMPESDTGRN-MOPGFXCFSA-N	0	3	326.440	3.361	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@@H](N[C@H](CN1CCOCC1)c1ccccc1)CC2	ZINC000353411124	165760373	/nfs/dbraw/zinc/76/03/73/165760373.db2.gz	JSPJVJHRGSAYJX-FCHUYYIVSA-N	0	3	347.462	3.209	20	30		EGEDHN
COc1ccc(C#N)cc1CN1CCC[C@@]1(CO)Cc1ccccc1	ZINC000355778724	166306691	/nfs/dbraw/zinc/30/66/91/166306691.db2.gz	YKIDHSJWPGUNRW-NRFANRHFSA-N	0	3	336.435	3.136	20	30		EGEDHN
CC[C@H](C)N[C@H](CNC(=O)c1c(F)cc(C#N)cc1F)c1ccco1	ZINC000359564636	167195349	/nfs/dbraw/zinc/19/53/49/167195349.db2.gz	UEOZAKUBMIUERR-XHDPSFHLSA-N	0	3	347.365	3.289	20	30		EGEDHN
C[C@H](NC[C@@H](O)Cn1cccn1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000359856008	167250459	/nfs/dbraw/zinc/25/04/59/167250459.db2.gz	CAINBJMQNALCJB-HRAATJIYSA-N	0	3	346.434	3.133	20	30		EGEDHN
Cc1nc(NCc2ccc(OCCN(C)C)cc2)c(Cl)cc1C#N	ZINC000359881303	167256071	/nfs/dbraw/zinc/25/60/71/167256071.db2.gz	QTCJEOCMOXGPSV-UHFFFAOYSA-N	0	3	344.846	3.468	20	30		EGEDHN
C[C@H](C(=O)N(CCN(C)C)Cc1cccs1)c1cccc(C#N)c1	ZINC000360302325	167294358	/nfs/dbraw/zinc/29/43/58/167294358.db2.gz	FKCFHRDKKBNJEV-HNNXBMFYSA-N	0	3	341.480	3.314	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@@H](C)N(CC)C[C@@H]1CCOC1	ZINC000677885894	549351437	/nfs/dbraw/zinc/35/14/37/549351437.db2.gz	MLSXKQUMNPLUMQ-CVEARBPZSA-N	0	3	336.501	3.010	20	30		EGEDHN
Cc1ncncc1[C@H](C)N[C@@H]1CCCN(c2ccc(C#N)cc2F)C1	ZINC000516490806	269925186	/nfs/dbraw/zinc/92/51/86/269925186.db2.gz	OBSQNJVNJDJHLG-GOEBONIOSA-N	0	3	339.418	3.115	20	30		EGEDHN
COc1ccc(O)c(CN2CCC(Oc3cccc(C#N)c3)CC2)c1	ZINC000179778755	270038626	/nfs/dbraw/zinc/03/86/26/270038626.db2.gz	QVJVESLTRYUAEA-UHFFFAOYSA-N	0	3	338.407	3.316	20	30		EGEDHN
CC(C)(CO)[C@H](NCc1cc(C#N)ccc1Br)C1CC1	ZINC000293030055	270042418	/nfs/dbraw/zinc/04/24/18/270042418.db2.gz	LFBNTJUPUXXAMH-OAHLLOKOSA-N	0	3	337.261	3.207	20	30		EGEDHN
N#Cc1ccc2nc(N3CCN(CCc4ccccc4)CC3)ccc2c1	ZINC000301816862	270044354	/nfs/dbraw/zinc/04/43/54/270044354.db2.gz	JSOWMLONPFMILO-UHFFFAOYSA-N	0	3	342.446	3.471	20	30		EGEDHN
N#Cc1ccnc(N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)n1	ZINC000450328763	270053249	/nfs/dbraw/zinc/05/32/49/270053249.db2.gz	DEYGHNDQGJMYIZ-OAHLLOKOSA-N	0	3	347.344	3.053	20	30		EGEDHN
CCC(CC)(CNC(=O)C(C#N)Cc1ccc(C#N)cc1)SC	ZINC000280296201	266000947	/nfs/dbraw/zinc/00/09/47/266000947.db2.gz	FLECOUWXHXQMQP-INIZCTEOSA-N	0	3	329.469	3.279	20	30		EGEDHN
CCS[C@@H]1CCC[C@H]1NCC(=O)Nc1sc(C)c(C)c1C#N	ZINC000286205138	266346027	/nfs/dbraw/zinc/34/60/27/266346027.db2.gz	QFTLRTDIHLNHSK-ZIAGYGMSSA-N	0	3	337.514	3.439	20	30		EGEDHN
COc1cccc([C@@H](CNCc2ccc(C#N)c(F)c2)N(C)C)c1	ZINC000403978861	266890078	/nfs/dbraw/zinc/89/00/78/266890078.db2.gz	AKHZLQDNLZTLNX-LJQANCHMSA-N	0	3	327.403	3.098	20	30		EGEDHN
CCCN1CCC[C@H]1CNC(=O)N(Cc1ccc(C#N)cc1)C(C)C	ZINC000511902676	267018757	/nfs/dbraw/zinc/01/87/57/267018757.db2.gz	WJRHGPVXHRHDIA-IBGZPJMESA-N	0	3	342.487	3.353	20	30		EGEDHN
C[C@@H]1C[C@H](c2cccnc2)N(CCC(=O)Nc2ccc(C#N)cc2)C1	ZINC000359867963	267092613	/nfs/dbraw/zinc/09/26/13/267092613.db2.gz	HDIVNIRRQIYZCU-DNVCBOLYSA-N	0	3	334.423	3.365	20	30		EGEDHN
C[C@H](CCc1ccccc1)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000279504477	267152844	/nfs/dbraw/zinc/15/28/44/267152844.db2.gz	QTKZUUNZNAWMIJ-UZLBHIALSA-N	0	3	331.419	3.378	20	30		EGEDHN
CC(C)O[C@@H]1C[C@@H](N[C@@H](C)C(=O)Nc2ccccc2C#N)C1(C)C	ZINC000274206605	267198447	/nfs/dbraw/zinc/19/84/47/267198447.db2.gz	OERIYPGPXJYGEH-IAOVAPTHSA-N	0	3	329.444	3.067	20	30		EGEDHN
C[C@H]1CCSCCN1CCC(=O)Nc1sc2c(c1C#N)CCC2	ZINC000279169452	267220978	/nfs/dbraw/zinc/22/09/78/267220978.db2.gz	BUILTBGYRNRONB-LBPRGKRZSA-N	0	3	349.525	3.264	20	30		EGEDHN
CC[C@H](NCCC(=O)Nc1ccccc1C#N)c1c(C)noc1C	ZINC000411513386	267220933	/nfs/dbraw/zinc/22/09/33/267220933.db2.gz	DDEKCWBGXPTARX-HNNXBMFYSA-N	0	3	326.400	3.233	20	30		EGEDHN
CN(C)CCOc1cccc(NC(=O)c2c(F)cc(C#N)cc2F)c1	ZINC000445811070	267281621	/nfs/dbraw/zinc/28/16/21/267281621.db2.gz	OXSMWUYANIFKMY-UHFFFAOYSA-N	0	3	345.349	3.029	20	30		EGEDHN
CO[C@@H]1CCCC[C@@H]1N[C@H](C)C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000275253304	267336066	/nfs/dbraw/zinc/33/60/66/267336066.db2.gz	QLPVSHCICZGPCI-XFBWCDHKSA-N	0	3	335.835	3.086	20	30		EGEDHN
Cc1cc2ncn(C[C@H](O)CN[C@@H](C)c3ccc(C#N)cc3)c2cc1C	ZINC000298750199	267366965	/nfs/dbraw/zinc/36/69/65/267366965.db2.gz	VVCNWRNXFONDMP-QFBILLFUSA-N	0	3	348.450	3.237	20	30		EGEDHN
Cc1ccc(OCCNC(=O)C(C#N)Cc2ccc(C#N)cc2)c(C)c1	ZINC000525830558	268041686	/nfs/dbraw/zinc/04/16/86/268041686.db2.gz	ULZJOYNHQMBJJV-LJQANCHMSA-N	0	3	347.418	3.053	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCCCc2ccccc2F)cc1	ZINC000280317844	268084838	/nfs/dbraw/zinc/08/48/38/268084838.db2.gz	UQUDFXNLKWFPEF-SFHVURJKSA-N	0	3	335.382	3.129	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCC2(c3ccccc3)CCC2)cc1	ZINC000280891607	268084890	/nfs/dbraw/zinc/08/48/90/268084890.db2.gz	SIUGBQJRATXUNE-IBGZPJMESA-N	0	3	343.430	3.479	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CCS[C@@H]3CCCC[C@H]32)cc1	ZINC000279915381	268089840	/nfs/dbraw/zinc/08/98/40/268089840.db2.gz	FDKLZOAQMIHDCB-KZNAEPCWSA-N	0	3	339.464	3.127	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCCc2cc3ccccc3[nH]2)cc1	ZINC000348323127	268091176	/nfs/dbraw/zinc/09/11/76/268091176.db2.gz	HIEYUJGLPRAQBE-GOSISDBHSA-N	0	3	342.402	3.081	20	30		EGEDHN
N#Cc1cc(Br)ccc1CN[C@@H]1[C@H]2CCO[C@@H]2C12CCC2	ZINC000451487716	268174516	/nfs/dbraw/zinc/17/45/16/268174516.db2.gz	HNBBSTLJKSAODL-OAGGEKHMSA-N	0	3	347.256	3.368	20	30		EGEDHN
N#Cc1ccc(C(=O)NC[C@H]2CCCN2CC2CCCCC2)s1	ZINC000487250204	268199309	/nfs/dbraw/zinc/19/93/09/268199309.db2.gz	AGDHGUOIDFZENP-OAHLLOKOSA-N	0	3	331.485	3.394	20	30		EGEDHN
N#Cc1ccc([N+](=O)[O-])c(NCC2CCN(c3ccncc3)CC2)c1	ZINC000302217825	268216797	/nfs/dbraw/zinc/21/67/97/268216797.db2.gz	QFKROKGOVWKGMM-UHFFFAOYSA-N	0	3	337.383	3.190	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)c(OC(F)F)c1	ZINC000451426485	268219146	/nfs/dbraw/zinc/21/91/46/268219146.db2.gz	VAYOGWRFDBVPGI-XHSDSOJGSA-N	0	3	336.382	3.285	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H]2[C@H]2CCC[C@H]2O)c(Br)c1	ZINC000451415649	268219237	/nfs/dbraw/zinc/21/92/37/268219237.db2.gz	FOJQMLYXVYUCPW-DJIMGWMZSA-N	0	3	349.272	3.446	20	30		EGEDHN
N#Cc1ccc(CNC[C@]2(O)CCC[C@@H](C(F)(F)F)C2)c(F)c1	ZINC000436398781	268233378	/nfs/dbraw/zinc/23/33/78/268233378.db2.gz	BALJGQHSNDXNBM-HIFRSBDPSA-N	0	3	330.325	3.271	20	30		EGEDHN
N#Cc1cccc(/C=C\C(=O)N2CCCN(Cc3ccccc3)CC2)c1	ZINC000490704058	268267389	/nfs/dbraw/zinc/26/73/89/268267389.db2.gz	UUDFWTIBNSBROL-KHPPLWFESA-N	0	3	345.446	3.306	20	30		EGEDHN
N#Cc1cccc2c1CCN2C(=O)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000421650092	268294719	/nfs/dbraw/zinc/29/47/19/268294719.db2.gz	FUQGKWFBKPBCLN-IBGZPJMESA-N	0	3	345.446	3.360	20	30		EGEDHN
N#Cc1ccccc1-c1ccc(CN2C[C@@H]3CCC[C@@H]3[C@@H]2C(N)=O)cc1	ZINC000527056172	268295370	/nfs/dbraw/zinc/29/53/70/268295370.db2.gz	SQDDHLOHOULSTF-SESVDKBCSA-N	0	3	345.446	3.311	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccc(F)cc1C#N	ZINC000179671379	274212794	/nfs/dbraw/zinc/21/27/94/274212794.db2.gz	SBUJLNDITOIMBS-AWEZNQCLSA-N	0	3	340.402	3.339	20	30		EGEDHN
Cc1ccc(CN[C@H]2CCc3ccc(C#N)cc32)c(N2CCOCC2)c1	ZINC000353248020	274743291	/nfs/dbraw/zinc/74/32/91/274743291.db2.gz	ADSOMJSDJWFAKJ-NRFANRHFSA-N	0	3	347.462	3.480	20	30		EGEDHN
CC(C)(CO)[C@H](NCCOc1ccccc1C#N)c1cccs1	ZINC000289459726	276342334	/nfs/dbraw/zinc/34/23/34/276342334.db2.gz	YDBDIWYOOFDMMH-QGZVFWFLSA-N	0	3	330.453	3.348	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H](c1cccc(OC)c1)N1CCCC1	ZINC000179644751	276775775	/nfs/dbraw/zinc/77/57/75/276775775.db2.gz	XVJWUOAGQTXYLB-IBGZPJMESA-N	0	3	328.456	3.142	20	30		EGEDHN
C[C@H](CN1C[C@H](C)C[C@H](C)C1)NC(=O)CSc1ccc(C#N)cc1	ZINC000343384704	279322635	/nfs/dbraw/zinc/32/26/35/279322635.db2.gz	ARSHERLBQJCADD-OWCLPIDISA-N	0	3	345.512	3.133	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@@H](N[C@H](COC(N)=O)Cc1ccccc1)CC2	ZINC000495884859	311626882	/nfs/dbraw/zinc/62/68/82/311626882.db2.gz	JNUGNQAEFFFMLP-HKUYNNGSSA-N	0	3	335.407	3.256	20	30		EGEDHN
CCC(CC)[C@@H](CN[C@@H](C)c1ccc(C#N)c(F)c1)N1CCOCC1	ZINC000538510640	314251015	/nfs/dbraw/zinc/25/10/15/314251015.db2.gz	AFWRUBGJGVSOCB-MGPUTAFESA-N	0	3	347.478	3.485	20	30		EGEDHN
C[C@@H]1CN(c2nccnc2C#N)CCN1C[C@H]1CCCC(C)(C)C1	ZINC000538808963	314277541	/nfs/dbraw/zinc/27/75/41/314277541.db2.gz	DIBGWTPKVBXMOE-CVEARBPZSA-N	0	3	327.476	3.075	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@@H](N[C@@H]3CCc4c3cccc4F)C2=O)cc1	ZINC000540953414	314423592	/nfs/dbraw/zinc/42/35/92/314423592.db2.gz	BDFYAHSMYXUCSW-WOJBJXKFSA-N	0	3	349.409	3.470	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@@H](N[C@@H]1CCCN(C3CCCCC3)C1=O)CC2	ZINC000555002991	315361293	/nfs/dbraw/zinc/36/12/93/315361293.db2.gz	MQECROHOUUXEDX-VQTJNVASSA-N	0	3	337.467	3.459	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN1CCC[C@@]2(CCSC2)C1	ZINC000563597133	316043946	/nfs/dbraw/zinc/04/39/46/316043946.db2.gz	DPKTTXMFDXIDDH-MRXNPFEDSA-N	0	3	335.498	3.167	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CN[C@H]2CCc3sc(Cl)cc32)cc1	ZINC000564651117	316182530	/nfs/dbraw/zinc/18/25/30/316182530.db2.gz	KFEIMZXOGGXDBA-WFASDCNBSA-N	0	3	348.855	3.290	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN1CCSC[C@@H]1C1CCC1	ZINC000571777937	317247493	/nfs/dbraw/zinc/24/74/93/317247493.db2.gz	JVRMTPFOIJRYJH-CQSZACIVSA-N	0	3	335.498	3.166	20	30		EGEDHN
Cc1nc2ccccc2c(N2CCN(c3cnccc3C#N)CC2)c1C	ZINC000574254836	317577622	/nfs/dbraw/zinc/57/76/22/317577622.db2.gz	NQCCDOBOWFQDMN-UHFFFAOYSA-N	0	3	343.434	3.445	20	30		EGEDHN
CC[C@H](N[C@@H](C)C(=O)Nc1ccc(C#N)c(Cl)c1)[C@@H]1CCCO1	ZINC000182280789	323539966	/nfs/dbraw/zinc/53/99/66/323539966.db2.gz	ZUIAHMFWCSABCL-UVBJJODRSA-N	0	3	335.835	3.086	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@H]1CC[C@@H](NCc2ccc(C#N)s2)C1	ZINC000382483520	324251796	/nfs/dbraw/zinc/25/17/96/324251796.db2.gz	YCANATOBECSGKK-QWHCGFSZSA-N	0	3	335.473	3.403	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1CCCc2sccc21	ZINC000390722732	324283525	/nfs/dbraw/zinc/28/35/25/324283525.db2.gz	MCSFCPBGYNGJHO-GDBMZVCRSA-N	0	3	328.437	3.027	20	30		EGEDHN
Fc1cc(CNCCOC(F)(F)F)ccc1OCC(F)(F)F	ZINC000353205230	456558339	/nfs/dbraw/zinc/55/83/39/456558339.db2.gz	IBDDQXZNAVBHQR-UHFFFAOYSA-N	0	3	335.219	3.393	20	30		EGEDHN
COC(=O)COc1ccc([C@@H](C)NCc2ccc(C#N)s2)cc1	ZINC000579001021	325048704	/nfs/dbraw/zinc/04/87/04/325048704.db2.gz	OMJOFJPGPXQKAG-GFCCVEGCSA-N	0	3	330.409	3.022	20	30		EGEDHN
CN1CCC[C@]2(CCN(c3nc4c(cc3C#N)CCCC4(C)C)C2)C1	ZINC000579499184	325119886	/nfs/dbraw/zinc/11/98/86/325119886.db2.gz	DHHDDODJSIHTCV-NRFANRHFSA-N	0	3	338.499	3.489	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCC[C@H]2OC(F)F)c(OC(F)F)c1	ZINC000348443875	456688872	/nfs/dbraw/zinc/68/88/72/456688872.db2.gz	AKMRZOQCTXRYCO-NWDGAFQWSA-N	0	3	332.297	3.410	20	30		EGEDHN
CC(C#N)C(=O)N[C@H](c1ccc(OC(F)(F)F)cc1)C(F)(F)F	ZINC000360800015	457359797	/nfs/dbraw/zinc/35/97/97/457359797.db2.gz	VDFZVXLMZNWAFP-OIBJUYFYSA-N	0	3	340.223	3.464	20	30		EGEDHN
C#CC[C@H](CC(F)(F)F)N[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000496208297	459108455	/nfs/dbraw/zinc/10/84/55/459108455.db2.gz	URIAGXPQSCVTSI-OLZOCXBDSA-N	0	3	334.382	3.320	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC[C@@H](c3ccccc3)[C@H](C)C2)CC1	ZINC000173199160	455246207	/nfs/dbraw/zinc/24/62/07/455246207.db2.gz	FEAIJVUGASOOSD-YLJYHZDGSA-N	0	3	341.499	3.472	20	30		EGEDHN
C=CCOc1ccc(CN2CCC[C@H](C3(C)OCCO3)C2)cc1OC	ZINC000183244387	455259545	/nfs/dbraw/zinc/25/95/45/455259545.db2.gz	GUMOCGFSJIVWOF-KRWDZBQOSA-N	0	3	347.455	3.235	20	30		EGEDHN
CCc1nn(C)cc1C(=O)C(C#N)C(=O)Nc1cccc2ccccc21	ZINC000181252636	455308049	/nfs/dbraw/zinc/30/80/49/455308049.db2.gz	XZQUETHCXFWMGV-HNNXBMFYSA-N	0	3	346.390	3.097	20	30		EGEDHN
CS[C@@H]1CCCCN([C@H]2CCCN(c3ccc(C#N)cc3)C2=O)C1	ZINC000245531699	455323370	/nfs/dbraw/zinc/32/33/70/455323370.db2.gz	UBBMHZAVPHJEDD-MSOLQXFVSA-N	0	3	343.496	3.271	20	30		EGEDHN
N#CCCN(CCC#N)C(=O)CN1CCCC2(C1)CCCCCC2	ZINC000173765798	455332610	/nfs/dbraw/zinc/33/26/10/455332610.db2.gz	SWRYGENHLDTPFD-UHFFFAOYSA-N	0	3	330.476	3.079	20	30		EGEDHN
C=CCNC(=O)[C@H](C)N[C@H](C)[C@H](C)c1ccccc1C(F)(F)F	ZINC000159110631	455353172	/nfs/dbraw/zinc/35/31/72/455353172.db2.gz	WGDODHQVFIVZQT-XQQFMLRXSA-N	0	3	328.378	3.478	20	30		EGEDHN
Cc1ccsc1[C@H](C)N[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000190633536	455357384	/nfs/dbraw/zinc/35/73/84/455357384.db2.gz	PJPBJESYPHCXLX-WMLDXEAASA-N	0	3	339.464	3.380	20	30		EGEDHN
C=CCOc1c(Cl)cc(CNC[C@@H](OC)C2CC2)cc1OC	ZINC000623533597	460599949	/nfs/dbraw/zinc/59/99/49/460599949.db2.gz	HOXALZAFDGVCFV-MRXNPFEDSA-N	0	3	325.836	3.428	20	30		EGEDHN
CCc1ccc(CN(C)C[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000025866942	453788452	/nfs/dbraw/zinc/78/84/52/453788452.db2.gz	IGFXZQNJYGCBSS-HXUWFJFHSA-N	0	3	338.451	3.187	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(c3nc4ccccc4o3)CC2)cc1	ZINC000026082991	453792151	/nfs/dbraw/zinc/79/21/51/453792151.db2.gz	HGXNMUGKXBGNIO-UHFFFAOYSA-N	0	3	332.407	3.412	20	30		EGEDHN
C[C@H](CNc1ccc([N+](=O)[O-])cc1C#N)N1CCc2ccccc2C1	ZINC000026729778	453804644	/nfs/dbraw/zinc/80/46/44/453804644.db2.gz	VQSFRJIFDZGDQK-CQSZACIVSA-N	0	3	336.395	3.325	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)CCc2ccc(C#N)cc2)N(C)C)cc1	ZINC000027597708	453819409	/nfs/dbraw/zinc/81/94/09/453819409.db2.gz	UNYDZDIASRRPMI-OAQYLSRUSA-N	0	3	349.478	3.472	20	30		EGEDHN
C[C@H](c1cccs1)N(C)C[C@H](O)COc1ccc(CC#N)cc1	ZINC000053430043	453878593	/nfs/dbraw/zinc/87/85/93/453878593.db2.gz	LEEJJUHRURJSRH-ZBFHGGJFSA-N	0	3	330.453	3.247	20	30		EGEDHN
Cc1ccccc1CN1CCC(NC(=O)c2cccc(CC#N)c2)CC1	ZINC000053968517	453903166	/nfs/dbraw/zinc/90/31/66/453903166.db2.gz	YQNWBQGEHBTKRH-UHFFFAOYSA-N	0	3	347.462	3.456	20	30		EGEDHN
Cc1cccc(N2CCN(CCCCNc3ccc(C#N)cn3)CC2)c1	ZINC000075668918	453915547	/nfs/dbraw/zinc/91/55/47/453915547.db2.gz	CHDNEEFKXWAJIS-UHFFFAOYSA-N	0	3	349.482	3.276	20	30		EGEDHN
C[C@@H](NC(=O)NCCN(C)Cc1ccccc1)c1ccc(C#N)cc1	ZINC000054764237	453945952	/nfs/dbraw/zinc/94/59/52/453945952.db2.gz	OPHSYMGTKRQGCW-MRXNPFEDSA-N	0	3	336.439	3.050	20	30		EGEDHN
Cc1ccc2c(c1)[C@H]1CN(C)CC[C@@H]1N2C(=O)c1cc(C#N)cs1	ZINC000084073456	453967449	/nfs/dbraw/zinc/96/74/49/453967449.db2.gz	VBESFAKUVBVCNP-WBVHZDCISA-N	0	3	337.448	3.376	20	30		EGEDHN
N#CC(C(=O)c1cnn(Cc2ccccc2Cl)c1)c1ccccn1	ZINC000041492257	453969306	/nfs/dbraw/zinc/96/93/06/453969306.db2.gz	QFFPUBOHABCXKU-HNNXBMFYSA-N	0	3	336.782	3.470	20	30		EGEDHN
COc1cccc([C@H](CNc2c(C#N)nnc3ccccc32)N(C)C)c1	ZINC000076323926	453988833	/nfs/dbraw/zinc/98/88/33/453988833.db2.gz	YKINCRAGVYSTKO-IBGZPJMESA-N	0	3	347.422	3.225	20	30		EGEDHN
C#CCN(C(=O)NCc1ccc(CN(C)C)cc1)C1CCCCC1	ZINC000068567218	454037571	/nfs/dbraw/zinc/03/75/71/454037571.db2.gz	RHZBEEKUGCZKBU-UHFFFAOYSA-N	0	3	327.472	3.226	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](C)c2ccc(F)cc2Cl)CC1	ZINC000076978048	454056140	/nfs/dbraw/zinc/05/61/40/454056140.db2.gz	VTQZIYVJEZPVGR-LBPRGKRZSA-N	0	3	339.842	3.490	20	30		EGEDHN
N#Cc1cccc(NC(=O)NCCCN2CCc3ccccc3C2)c1	ZINC000043329561	454056604	/nfs/dbraw/zinc/05/66/04/454056604.db2.gz	GMGMJZQJVRQNLZ-UHFFFAOYSA-N	0	3	334.423	3.128	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN1CCC[C@@H]1CCc1ccccc1	ZINC000077194311	454073465	/nfs/dbraw/zinc/07/34/65/454073465.db2.gz	RVPYCMYHOXCINR-PKOBYXMFSA-N	0	3	327.472	3.092	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(OC(C)C)c(Cl)c2)CC1	ZINC000057156014	454107233	/nfs/dbraw/zinc/10/72/33/454107233.db2.gz	ZEORTNIBYIVIBE-UHFFFAOYSA-N	0	3	334.847	3.411	20	30		EGEDHN
N#CCCN(CCC#N)C(=O)CN1CCC[C@@H]1CC1CCCCC1	ZINC000057871325	454153065	/nfs/dbraw/zinc/15/30/65/454153065.db2.gz	HRAXULUYVLFEPA-GOSISDBHSA-N	0	3	330.476	3.077	20	30		EGEDHN
C=C(C)COCCNC(=O)NC1CCN([C@@H](C)c2ccccc2)CC1	ZINC000130473251	454199972	/nfs/dbraw/zinc/19/99/72/454199972.db2.gz	YRNSLGSCTGNKQL-KRWDZBQOSA-N	0	3	345.487	3.104	20	30		EGEDHN
C=CCn1c(SCCN2CCC(C)CC2)nnc1-c1ccncc1	ZINC000130655799	454211144	/nfs/dbraw/zinc/21/11/44/454211144.db2.gz	IEJOTSOIJHWUML-UHFFFAOYSA-N	0	3	343.500	3.350	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cc(F)c(OC)c(F)c2)CC1	ZINC000071880050	454240981	/nfs/dbraw/zinc/24/09/81/454240981.db2.gz	GRXRNTNFGZHIAK-UHFFFAOYSA-N	0	3	339.386	3.135	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cnn(C(C)(C)C)c1)C(C)C	ZINC000120086038	454255631	/nfs/dbraw/zinc/25/56/31/454255631.db2.gz	HDDBPUPMUHAJSP-QGZVFWFLSA-N	0	3	332.492	3.067	20	30		EGEDHN
CN(CCC(C)(C)C#N)C[C@H](O)COc1ccccc1C(F)(F)F	ZINC000131619860	454269685	/nfs/dbraw/zinc/26/96/85/454269685.db2.gz	RCGBLCJNQQQMRH-ZDUSSCGKSA-N	0	3	344.377	3.317	20	30		EGEDHN
C=CCOc1ccccc1C(=O)Nc1ccc(OCCN(C)C)cc1	ZINC000046724159	454277559	/nfs/dbraw/zinc/27/75/59/454277559.db2.gz	ORKUHFWLLLJHFN-UHFFFAOYSA-N	0	3	340.423	3.444	20	30		EGEDHN
C[C@H](NCCOc1ccc(C#N)cc1)c1cccc(N2CCCC2=O)c1	ZINC000090107194	454279920	/nfs/dbraw/zinc/27/99/20/454279920.db2.gz	BQGLIIHBVUYJRI-INIZCTEOSA-N	0	3	349.434	3.415	20	30		EGEDHN
CC[C@H](NCCOc1ccc(C#N)cc1)c1ccc2c(c1)OCCO2	ZINC000090107202	454280097	/nfs/dbraw/zinc/28/00/97/454280097.db2.gz	PBOUETHIDMUKLJ-SFHVURJKSA-N	0	3	338.407	3.449	20	30		EGEDHN
C=CCOc1ccc(CNC[C@H](c2ccco2)N(C)C)cc1OC	ZINC000072670308	454326343	/nfs/dbraw/zinc/32/63/43/454326343.db2.gz	QIZYQTWKEMXMJJ-MRXNPFEDSA-N	0	3	330.428	3.246	20	30		EGEDHN
CN1CCN(C)c2cc(NC(=O)Nc3cccc(C#N)c3)ccc2C1	ZINC000091043456	454370360	/nfs/dbraw/zinc/37/03/60/454370360.db2.gz	SPPGLDSYKSVWTQ-UHFFFAOYSA-N	0	3	335.411	3.084	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Cc1noc2ccccc12)C(C)C	ZINC000047633858	454392323	/nfs/dbraw/zinc/39/23/23/454392323.db2.gz	PARIRQXYCQGLOM-SFHVURJKSA-N	0	3	341.455	3.185	20	30		EGEDHN
C=CCOCCCC(=O)N1CCCN(Cc2ccccc2C)CC1	ZINC000079532423	454431613	/nfs/dbraw/zinc/43/16/13/454431613.db2.gz	GNWQOPPQCUTUHW-UHFFFAOYSA-N	0	3	330.472	3.012	20	30		EGEDHN
CN(C)CCN(Cc1ccc(F)cc1)C(=O)Nc1cccc(C#N)c1	ZINC000048052665	454437076	/nfs/dbraw/zinc/43/70/76/454437076.db2.gz	CIYLCPNZOQWCER-UHFFFAOYSA-N	0	3	340.402	3.293	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)C(=O)Nc1ccccn1)c1ccc(F)cc1	ZINC000103717461	454565061	/nfs/dbraw/zinc/56/50/61/454565061.db2.gz	PNMKKOHWQDTUTQ-SWLSCSKDSA-N	0	3	325.343	3.062	20	30		EGEDHN
COc1cc(CN[C@@H](C)c2ccc(C#N)cc2)cc(OC)c1OC	ZINC000074336442	454566621	/nfs/dbraw/zinc/56/66/21/454566621.db2.gz	IVKMXKHZCKIBCC-ZDUSSCGKSA-N	0	3	326.396	3.435	20	30		EGEDHN
COc1ccc(C#N)cc1NC(=O)N1CCN(CCC(C)(C)C)CC1	ZINC000050089950	454572295	/nfs/dbraw/zinc/57/22/95/454572295.db2.gz	CAFPVQLGYWKBAG-UHFFFAOYSA-N	0	3	344.459	3.153	20	30		EGEDHN
CN(C)Cc1c2ccccc2oc1C(=O)NCc1ccc(C#N)cc1	ZINC000074435490	454581087	/nfs/dbraw/zinc/58/10/87/454581087.db2.gz	GHRCLFFXDBEDCQ-UHFFFAOYSA-N	0	3	333.391	3.296	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN[C@H](c1ccc(F)cc1)C1CCC1	ZINC000104702989	454596080	/nfs/dbraw/zinc/59/60/80/454596080.db2.gz	ICWFJMKPAUSDTI-LIRRHRJNSA-N	0	3	331.435	3.265	20	30		EGEDHN
C#CCCOc1ccc(CN2CCC[C@H](CNC(=O)CCC)C2)cc1	ZINC000092707789	454615168	/nfs/dbraw/zinc/61/51/68/454615168.db2.gz	UIXBUEPMWISQJP-LJQANCHMSA-N	0	3	342.483	3.217	20	30		EGEDHN
CCCCNC(=O)[C@@H]1CC[C@@H](C)N(Cc2ccc(OC)c(C#N)c2)C1	ZINC000135005343	454623505	/nfs/dbraw/zinc/62/35/05/454623505.db2.gz	CIBOQHCVIJVEGX-NVXWUHKLSA-N	0	3	343.471	3.084	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)N2CCC(C#N)CC2)N2CCCC2)cc1	ZINC000105207742	454628344	/nfs/dbraw/zinc/62/83/44/454628344.db2.gz	MTWPSOJSSAURFP-IBGZPJMESA-N	0	3	340.471	3.077	20	30		EGEDHN
N#Cc1ccsc1C(=O)NC[C@@H]1CCCN(Cc2cccs2)C1	ZINC000052050679	454651720	/nfs/dbraw/zinc/65/17/20/454651720.db2.gz	ZULGTZZCAOJILB-ZDUSSCGKSA-N	0	3	345.493	3.323	20	30		EGEDHN
C[C@H](NC(=O)N1CCN(CCC(C)(C)C)CC1)c1cccc(C#N)c1	ZINC000074916865	454658484	/nfs/dbraw/zinc/65/84/84/454658484.db2.gz	DWBUJOVJNFGKTD-INIZCTEOSA-N	0	3	342.487	3.383	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H](C)Oc2ccccc2Cl)CC1	ZINC000106036818	454674626	/nfs/dbraw/zinc/67/46/26/454674626.db2.gz	ZRVATAJISJLHAC-AWEZNQCLSA-N	0	3	336.863	3.264	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc(OC)c(OCC)c2)CC1	ZINC000106321551	454690238	/nfs/dbraw/zinc/69/02/38/454690238.db2.gz	ORENYCKRURHJPW-UHFFFAOYSA-N	0	3	347.459	3.256	20	30		EGEDHN
C#CCCOc1ccc(CN(C)[C@H](CO)c2ccc(OC)cc2)cc1	ZINC000093415610	454713743	/nfs/dbraw/zinc/71/37/43/454713743.db2.gz	XDKHQQMZHCZWKZ-OAQYLSRUSA-N	0	3	339.435	3.263	20	30		EGEDHN
CC(=O)NC1CCC(NCC#Cc2ccc(C(F)(F)F)cc2)CC1	ZINC000161804756	454725452	/nfs/dbraw/zinc/72/54/52/454725452.db2.gz	YCCQCXOVRAXREF-UHFFFAOYSA-N	0	3	338.373	3.094	20	30		EGEDHN
C[C@@H](C(=O)N(CCC#N)c1ccc(F)cc1)N1C[C@@H]2CCC[C@@H]2C1	ZINC000152848482	454732774	/nfs/dbraw/zinc/73/27/74/454732774.db2.gz	UYCFKZRATWTNNK-HRCADAONSA-N	0	3	329.419	3.193	20	30		EGEDHN
N#CCCCOc1cccc(CN2CC[C@@H](Oc3ccncc3)C2)c1	ZINC000093865889	454742203	/nfs/dbraw/zinc/74/22/03/454742203.db2.gz	WQUHXFHCUWLECG-HXUWFJFHSA-N	0	3	337.423	3.417	20	30		EGEDHN
N#CCCCN1CCC[C@H](c2nnc3ccc(C(F)(F)F)cn32)C1	ZINC000153252185	454775452	/nfs/dbraw/zinc/77/54/52/454775452.db2.gz	IBRWXPORIUOMMT-LBPRGKRZSA-N	0	3	337.349	3.231	20	30		EGEDHN
N#CC1CCN(CCC(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000177029056	454813234	/nfs/dbraw/zinc/81/32/34/454813234.db2.gz	UKZFTLQLYVJDSE-UHFFFAOYSA-N	0	3	325.334	3.270	20	30		EGEDHN
N#Cc1ccccc1OCCN1CCC[C@H](C(=O)Nc2ccccc2)C1	ZINC000125613462	454835632	/nfs/dbraw/zinc/83/56/32/454835632.db2.gz	YRCNNEUQAFNNIE-SFHVURJKSA-N	0	3	349.434	3.288	20	30		EGEDHN
C=CC1CCN([C@H](C)C(=O)N[C@H](C)c2cc(OC)ccc2OC)CC1	ZINC000111258565	454859840	/nfs/dbraw/zinc/85/98/40/454859840.db2.gz	XECMKAYFBDLKIZ-HUUCEWRRSA-N	0	3	346.471	3.168	20	30		EGEDHN
C=CCNC(=O)[C@@H](C)N1CCC(c2c[nH]c3cc(F)ccc32)CC1	ZINC000111260895	454860328	/nfs/dbraw/zinc/86/03/28/454860328.db2.gz	QWUJVHQLYQJAFT-CYBMUJFWSA-N	0	3	329.419	3.177	20	30		EGEDHN
C[C@H](c1ccccc1)[C@H](C)N[C@@H](C)C(=O)NC1(C#N)CCCCC1	ZINC000177481765	454868747	/nfs/dbraw/zinc/86/87/47/454868747.db2.gz	VASGPOWVADEIQG-ULQDDVLXSA-N	0	3	327.472	3.499	20	30		EGEDHN
CCC1(CC)[C@@H](NCC(=O)N(CCC#N)c2ccccc2)C[C@@H]1OC	ZINC000191380963	455482165	/nfs/dbraw/zinc/48/21/65/455482165.db2.gz	NPSQTSQYDZPNEQ-ROUUACIJSA-N	0	3	343.471	3.117	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1ccc(NC(C)=O)cc1)C(C)C	ZINC000112919943	454905939	/nfs/dbraw/zinc/90/59/39/454905939.db2.gz	XXYVWSZSHNBGIB-IBGZPJMESA-N	0	3	343.471	3.073	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCN(C(=O)OC(C)(C)C)CC1	ZINC000167444637	454921502	/nfs/dbraw/zinc/92/15/02/454921502.db2.gz	ZVHKRDFXUKWBLZ-GFCCVEGCSA-N	0	3	333.270	3.274	20	30		EGEDHN
C[C@H](O)CN(CC(=O)Nc1ccc(C#N)c(Cl)c1)C1CCCCC1	ZINC000170691561	454958004	/nfs/dbraw/zinc/95/80/04/454958004.db2.gz	GOJKQNAGFSYNRQ-ZDUSSCGKSA-N	0	3	349.862	3.166	20	30		EGEDHN
C=CCOc1ccc(CNC[C@@](C)(O)c2ccccc2)cc1OC	ZINC000114508242	454958955	/nfs/dbraw/zinc/95/89/55/454958955.db2.gz	RZMOCWINEQQTIN-HXUWFJFHSA-N	0	3	327.424	3.257	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(C)c(-c3ncco3)c2)CC1	ZINC000178716485	454968989	/nfs/dbraw/zinc/96/89/89/454968989.db2.gz	NPLQRXQKCYSRLD-UHFFFAOYSA-N	0	3	340.427	3.422	20	30		EGEDHN
CN(Cc1ccccc1)CC(C)(C)NC(=O)c1cccc(CC#N)c1	ZINC000178948961	454992333	/nfs/dbraw/zinc/99/23/33/454992333.db2.gz	COSMCLJTUXTXGE-UHFFFAOYSA-N	0	3	335.451	3.393	20	30		EGEDHN
CN(CCCNC(=O)c1c(F)cc(C#N)cc1F)Cc1ccccc1	ZINC000151682421	455016417	/nfs/dbraw/zinc/01/64/17/455016417.db2.gz	JNGMOQIOYAVEAK-UHFFFAOYSA-N	0	3	343.377	3.088	20	30		EGEDHN
C[C@@H](N[C@@H]1CCCN(Cc2ccccc2)C1=O)c1cccc(C#N)c1	ZINC000179244710	455024140	/nfs/dbraw/zinc/02/41/40/455024140.db2.gz	RQXNOBLQOGXRLB-OXQOHEQNSA-N	0	3	333.435	3.400	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)CN[C@H](C)c1ccc2c(c1)CCCC2	ZINC000128209906	455035680	/nfs/dbraw/zinc/03/56/80/455035680.db2.gz	JFIVHRNYLIRIHE-QRWLVFNGSA-N	0	3	327.472	3.270	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CCC(NC(=O)NCCCCC#N)CC1	ZINC000172123473	455125340	/nfs/dbraw/zinc/12/53/40/455125340.db2.gz	OFOLJPZCJKIHMO-INIZCTEOSA-N	0	3	328.460	3.205	20	30		EGEDHN
CCOC[C@@H]1CCCN(Cc2cn(C)nc2-c2ccc(C#N)cc2)C1	ZINC000180158992	455141733	/nfs/dbraw/zinc/14/17/33/455141733.db2.gz	JVXOUFWNQAJPLN-QGZVFWFLSA-N	0	3	338.455	3.207	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Cc1ccc(C#N)cc1	ZINC000172580025	455162888	/nfs/dbraw/zinc/16/28/88/455162888.db2.gz	DFPBTYTYTWVPDP-SFHVURJKSA-N	0	3	347.462	3.224	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccccc2OCC2CC2)CC1	ZINC000172587803	455163682	/nfs/dbraw/zinc/16/36/82/455163682.db2.gz	MJNBGRJGDYFYRR-UHFFFAOYSA-N	0	3	329.444	3.247	20	30		EGEDHN
C=C(C)CN1CCC(N[C@H](c2cnn(C)c2)c2cccc(F)c2)CC1	ZINC000180489954	455180938	/nfs/dbraw/zinc/18/09/38/455180938.db2.gz	KTZMEZWLHHALEP-FQEVSTJZSA-N	0	3	342.462	3.279	20	30		EGEDHN
N#CC(C(=O)NCc1ccccc1)c1nc2ccccc2n1C(F)F	ZINC000180512224	455186810	/nfs/dbraw/zinc/18/68/10/455186810.db2.gz	OIOHSNLFVXWGHG-ZDUSSCGKSA-N	0	3	340.333	3.355	20	30		EGEDHN
Cc1ccccc1NC(=O)C[C@@H](C)NCc1ccc(OCC#N)cc1	ZINC000180552791	455195537	/nfs/dbraw/zinc/19/55/37/455195537.db2.gz	NCHJGCUUMMJKNF-MRXNPFEDSA-N	0	3	337.423	3.404	20	30		EGEDHN
COCCCOc1cccc(CNCc2ccc(OCC#N)cc2)c1	ZINC000264362165	455198246	/nfs/dbraw/zinc/19/82/46/455198246.db2.gz	IVXXDVLAVUIVIF-UHFFFAOYSA-N	0	3	340.423	3.294	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2C[C@@H](C)C[C@H]2c2cccnc2)CC1	ZINC000183344482	455280240	/nfs/dbraw/zinc/28/02/40/455280240.db2.gz	VMWIZHGZCJTYHO-LPHOPBHVSA-N	0	3	342.487	3.215	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/[C@H]2CCC[C@H](C(=O)N(C)C)C2)c([O-])c1	ZINC000265114293	455301110	/nfs/dbraw/zinc/30/11/10/455301110.db2.gz	FJSUMQXBEKHGPU-PIXZRJEVSA-N	0	3	345.487	3.304	20	30		EGEDHN
C[C@@H](CN(C)CCC(=O)Nc1sccc1C#N)c1nccs1	ZINC000183946605	455342599	/nfs/dbraw/zinc/34/25/99/455342599.db2.gz	FWZFNINUZJOHAB-NSHDSACASA-N	0	3	334.470	3.140	20	30		EGEDHN
CC(C)(C)C[C@@H](NCCNC(=O)C1N=CC=CC1=O)c1ccccc1	ZINC000181964306	455406154	/nfs/dbraw/zinc/40/61/54/455406154.db2.gz	UNXLDOJYCQXOPL-OZNQOIHVSA-N	0	3	341.455	3.280	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN2CCC[C@H]2C[C@H](O)c2cccs2)cc1	ZINC000246106169	455427672	/nfs/dbraw/zinc/42/76/72/455427672.db2.gz	WYJQVVLTUPRZKW-OKZBNKHCSA-N	0	3	342.464	3.241	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC(OCC3CCCC3)CC2)CC1	ZINC000175439515	455449014	/nfs/dbraw/zinc/44/90/14/455449014.db2.gz	AUNJSADCCDEKCQ-UHFFFAOYSA-N	0	3	349.519	3.018	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccccc2CC#N)C1	ZINC000601009778	460674123	/nfs/dbraw/zinc/67/41/23/460674123.db2.gz	IMDKANYNDFOZLH-APWZRJJASA-N	0	3	333.435	3.318	20	30		EGEDHN
Cc1nnc(N[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)c(C#N)c1C	ZINC000267208734	455516776	/nfs/dbraw/zinc/51/67/76/455516776.db2.gz	LGFKYWZEWILRSI-AUUYWEPGSA-N	0	3	335.455	3.288	20	30		EGEDHN
C[C@H](CN1CCC[C@H](C)C1)NC(=O)c1cccc(SCC#N)c1	ZINC000176030311	455530471	/nfs/dbraw/zinc/53/04/71/455530471.db2.gz	CUPQDCFXKJSIOO-LSDHHAIUSA-N	0	3	331.485	3.152	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1	ZINC000246847069	455530496	/nfs/dbraw/zinc/53/04/96/455530496.db2.gz	QYNODRJOMZPDCU-MSOLQXFVSA-N	0	3	330.472	3.091	20	30		EGEDHN
N#Cc1ccc(OCCN[C@H]2CCO[C@@H]2c2ccc(F)c(F)c2)cc1	ZINC000192142823	455564299	/nfs/dbraw/zinc/56/42/99/455564299.db2.gz	MCRMKHXVCKPEKL-RBUKOAKNSA-N	0	3	344.361	3.335	20	30		EGEDHN
C#CCOc1ccccc1CNC1CCC(O)(c2cccnc2)CC1	ZINC000185691232	455597835	/nfs/dbraw/zinc/59/78/35/455597835.db2.gz	QDOAJXXYLQCMRM-UHFFFAOYSA-N	0	3	336.435	3.014	20	30		EGEDHN
C#CCCCCC(=O)N(Cc1ccncc1)C[C@@H]1CCCN1CC	ZINC000271428871	455633268	/nfs/dbraw/zinc/63/32/68/455633268.db2.gz	NPKQUFIPJYDYQO-IBGZPJMESA-N	0	3	327.472	3.088	20	30		EGEDHN
CN(C(=O)CN[C@@H](c1ccccc1)C1CC1)C1(C#N)CCCCC1	ZINC000192504756	455633567	/nfs/dbraw/zinc/63/35/67/455633567.db2.gz	VBQPIJAQDHVLBK-IBGZPJMESA-N	0	3	325.456	3.412	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CC(C)(C)[C@H]2c2cccnc2)CC1	ZINC000292459328	455669208	/nfs/dbraw/zinc/66/92/08/455669208.db2.gz	ZWGRTSMPIBKVQT-GOSISDBHSA-N	0	3	342.487	3.215	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N1CCCN(C(C)C)CC1	ZINC000292592041	455706626	/nfs/dbraw/zinc/70/66/26/455706626.db2.gz	VGOODMLFLNDAHK-KRWDZBQOSA-N	0	3	349.544	3.067	20	30		EGEDHN
C[C@H]1CN(C(=O)Nc2ccc(CC#N)cc2)CCN(C2CCC2)C1	ZINC000292596282	455707625	/nfs/dbraw/zinc/70/76/25/455707625.db2.gz	JJZWEPZSYXZJBM-OAHLLOKOSA-N	0	3	326.444	3.091	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H]2C[C@H](c3ccc(F)cc3)C2)CC1	ZINC000292695395	455733607	/nfs/dbraw/zinc/73/36/07/455733607.db2.gz	NTHYEFVZLIDVJU-RZDIXWSQSA-N	0	3	331.435	3.021	20	30		EGEDHN
C#CC[C@@H](NC[C@@H](O)COCc1ccccc1F)c1ccccc1	ZINC000271762448	455750516	/nfs/dbraw/zinc/75/05/16/455750516.db2.gz	ZWLRWIAAPPLERI-UYAOXDASSA-N	0	3	327.399	3.057	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC[C@H](c2ccccc2)C2CC2)CC1	ZINC000292765763	455752205	/nfs/dbraw/zinc/75/22/05/455752205.db2.gz	SFSXOHKXGFJIMD-LJQANCHMSA-N	0	3	327.472	3.130	20	30		EGEDHN
CCN1CCN(c2ccc(NC(=O)[C@](C)(C#N)CC)c(C)c2)CC1	ZINC000284867015	455755392	/nfs/dbraw/zinc/75/53/92/455755392.db2.gz	DXPNXIKPZPCYSC-IBGZPJMESA-N	0	3	328.460	3.015	20	30		EGEDHN
Cc1c2cccc(Cl)c2sc1CNCCn1cnc(C#N)n1	ZINC000292877493	455764879	/nfs/dbraw/zinc/76/48/79/455764879.db2.gz	DSJJIIILIIUEMN-UHFFFAOYSA-N	0	3	331.832	3.116	20	30		EGEDHN
COc1ccccc1[C@@H](CC(C)C)NCCC(=O)N(C)CCC#N	ZINC000271811410	455769673	/nfs/dbraw/zinc/76/96/73/455769673.db2.gz	RTDIDINMCAWZQJ-QGZVFWFLSA-N	0	3	331.460	3.134	20	30		EGEDHN
CC[C@H](NCc1ccc(N2CCOCC2)nc1)c1ccc(C#N)cc1	ZINC000278197151	455784197	/nfs/dbraw/zinc/78/41/97/455784197.db2.gz	GDMLLYRFJNIMGG-IBGZPJMESA-N	0	3	336.439	3.031	20	30		EGEDHN
C#CC[C@@H](NCc1ccc(O[C@H](C)C(=O)OC)cc1)c1ccccc1	ZINC000271868092	455793654	/nfs/dbraw/zinc/79/36/54/455793654.db2.gz	WQCXUHHHWZVABG-OXQOHEQNSA-N	0	3	337.419	3.481	20	30		EGEDHN
Cc1nc(C(=O)NC[C@]2(C)CCCN2Cc2ccccc2)ccc1C#N	ZINC000186571103	455795667	/nfs/dbraw/zinc/79/56/67/455795667.db2.gz	SRGADFLCESOITR-NRFANRHFSA-N	0	3	348.450	3.046	20	30		EGEDHN
C=C(C)[C@H](NC(=O)NC[C@H]1CCCN1CC)c1ccc(F)c(F)c1	ZINC000251879538	455797832	/nfs/dbraw/zinc/79/78/32/455797832.db2.gz	UTRYGYGJRAHLKF-PBHICJAKSA-N	0	3	337.414	3.366	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1C(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C	ZINC000278262328	455801355	/nfs/dbraw/zinc/80/13/55/455801355.db2.gz	DCNMCALRNWFXLE-DFQSSKMNSA-N	0	3	342.483	3.091	20	30		EGEDHN
N#CCCn1cc(CN2CCC[C@H](CO)CC2)c(-c2ccccc2)n1	ZINC000294197036	455808009	/nfs/dbraw/zinc/80/80/09/455808009.db2.gz	XOVZWDUCJJVJOJ-KRWDZBQOSA-N	0	3	338.455	3.058	20	30		EGEDHN
Cc1ccccc1[C@H](NCC(=O)NCc1ccc(C#N)cc1)C1CC1	ZINC000272000296	455816739	/nfs/dbraw/zinc/81/67/39/455816739.db2.gz	IDZWHDZMGGNVIS-OAQYLSRUSA-N	0	3	333.435	3.224	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(-c3ccco3)cc2F)CC1	ZINC000278385714	455835355	/nfs/dbraw/zinc/83/53/55/455835355.db2.gz	DGSZHZUWQVDBMO-UHFFFAOYSA-N	0	3	326.371	3.369	20	30		EGEDHN
CN1CCC(Nc2c(C#N)cnc3ccc(OC(F)F)cc32)CC1	ZINC000269344756	455840038	/nfs/dbraw/zinc/84/00/38/455840038.db2.gz	HWRFATISSMEUIT-UHFFFAOYSA-N	0	3	332.354	3.214	20	30		EGEDHN
Cc1ccccc1CCN(C)C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000295331284	455846019	/nfs/dbraw/zinc/84/60/19/455846019.db2.gz	FAOXRUXPJYMSLD-FQEVSTJZSA-N	0	3	331.419	3.250	20	30		EGEDHN
N#Cc1ccc(CN(C[C@H](O)COc2ccccc2F)C2CC2)cc1	ZINC000194539845	455855356	/nfs/dbraw/zinc/85/53/56/455855356.db2.gz	GARNGDMOISVWOJ-SFHVURJKSA-N	0	3	340.398	3.102	20	30		EGEDHN
C=CCN1CCC(NC(=O)/C=C\c2ccc(C(F)(F)F)cc2)CC1	ZINC000254989910	455857579	/nfs/dbraw/zinc/85/75/79/455857579.db2.gz	PRWFLHWLWSWCNE-YVMONPNESA-N	0	3	338.373	3.485	20	30		EGEDHN
Cc1ccccc1OCCN(C)C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000279585647	455868581	/nfs/dbraw/zinc/86/85/81/455868581.db2.gz	CVHKGIWVACHWQX-LJQANCHMSA-N	0	3	347.418	3.086	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)Cc2ccc(C#N)cc2)N(C)C)cc1	ZINC000194839987	455889226	/nfs/dbraw/zinc/88/92/26/455889226.db2.gz	FFKCWRXIHMKVJQ-FQEVSTJZSA-N	0	3	335.451	3.082	20	30		EGEDHN
C=CCC[C@@H](NCc1ccnc(N2CCN(C)CC2)c1)c1ccco1	ZINC000285818428	455922567	/nfs/dbraw/zinc/92/25/67/455922567.db2.gz	WFUBMDIETWYXEA-GOSISDBHSA-N	0	3	340.471	3.224	20	30		EGEDHN
COc1cc(CNCCCCC#N)c([N+](=O)[O-])cc1OCC(F)F	ZINC000272355252	455923803	/nfs/dbraw/zinc/92/38/03/455923803.db2.gz	DTTNEDIOQGFZBX-UHFFFAOYSA-N	0	3	343.330	3.031	20	30		EGEDHN
CN1CCCN(c2ccc(NC(=O)c3ccc(CC#N)cc3)cc2)CC1	ZINC000270302310	455923911	/nfs/dbraw/zinc/92/39/11/455923911.db2.gz	ZGBXUMVZPKTEQH-UHFFFAOYSA-N	0	3	348.450	3.147	20	30		EGEDHN
Cc1cccc(CN(CCN(C)C)C(=O)c2ccc(CC#N)cc2)c1	ZINC000270337564	455931908	/nfs/dbraw/zinc/93/19/08/455931908.db2.gz	ZNFZUURBGLGGRF-UHFFFAOYSA-N	0	3	335.451	3.265	20	30		EGEDHN
C#CC[C@@H](NC(=O)NC1CCN(CC(=C)C)CC1)c1ccccc1	ZINC000270467431	455961982	/nfs/dbraw/zinc/96/19/82/455961982.db2.gz	UYUXTZUBQRFUCF-LJQANCHMSA-N	0	3	325.456	3.091	20	30		EGEDHN
C#CCOc1ccccc1CNC1CCN(CCC(F)(F)F)CC1	ZINC000272483972	455965472	/nfs/dbraw/zinc/96/54/72/455965472.db2.gz	BKWFAOICQMERFP-UHFFFAOYSA-N	0	3	340.389	3.205	20	30		EGEDHN
CCOC[C@@H](NCC(=O)N(CCC#N)c1cccc(C)c1C)C(C)C	ZINC000286086055	455974478	/nfs/dbraw/zinc/97/44/78/455974478.db2.gz	KISPMPRODQILPU-GOSISDBHSA-N	0	3	345.487	3.201	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)C[C@H](C)c1c(C)n[nH]c1C)C(C)C	ZINC000270648904	456004221	/nfs/dbraw/zinc/00/42/21/456004221.db2.gz	AXWIXHHRAXIPFI-YJBOKZPZSA-N	0	3	346.519	3.335	20	30		EGEDHN
CC(C)Oc1ccc(NC(=O)N[C@@H](C)C2=CCN(C)CC2)cc1C#N	ZINC000272651006	456025673	/nfs/dbraw/zinc/02/56/73/456025673.db2.gz	FCFDKBHWNQGOHK-AWEZNQCLSA-N	0	3	342.443	3.117	20	30		EGEDHN
C=CCC[C@@H](O)CN[C@H](CO)c1ccc(Cl)cc1C(F)(F)F	ZINC000280732905	456040797	/nfs/dbraw/zinc/04/07/97/456040797.db2.gz	LKDIKKULYFNPAS-BXUZGUMPSA-N	0	3	337.769	3.309	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)C1=CCN(C)CC1	ZINC000272858390	456092458	/nfs/dbraw/zinc/09/24/58/456092458.db2.gz	HZOLPQBSVNTUNC-INIZCTEOSA-N	0	3	340.471	3.129	20	30		EGEDHN
CC(C)(C)OC(=O)N1C[C@H]2CCN(Cc3cccc(C#N)c3)C[C@H]2C1	ZINC000289509192	456128771	/nfs/dbraw/zinc/12/87/71/456128771.db2.gz	KQPDSCRWXILZIH-MSOLQXFVSA-N	0	3	341.455	3.247	20	30		EGEDHN
COc1ccc(CN[C@]2(C)CCO[C@@H]2C2CC2)cc1OCCCC#N	ZINC000273046129	456158733	/nfs/dbraw/zinc/15/87/33/456158733.db2.gz	BNGJEMBDZZZMAT-WOJBJXKFSA-N	0	3	344.455	3.425	20	30		EGEDHN
C=CCc1ccc(OCC(=O)Nc2cccc(CNC)c2)c(OC)c1	ZINC000237215367	456248951	/nfs/dbraw/zinc/24/89/51/456248951.db2.gz	JWNCDVQBMVOJCU-UHFFFAOYSA-N	0	3	340.423	3.161	20	30		EGEDHN
C=CCCOCCNCc1cc(OC)c(OCC(F)F)c(OC)c1	ZINC000290151068	456252800	/nfs/dbraw/zinc/25/28/00/456252800.db2.gz	OZJQCEBTIVNYNO-UHFFFAOYSA-N	0	3	345.386	3.030	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@@H]1CCCC[C@@H]1OC	ZINC000275286003	456271920	/nfs/dbraw/zinc/27/19/20/456271920.db2.gz	WXXPWAWIKRPJOR-ZBFHGGJFSA-N	0	3	334.485	3.450	20	30		EGEDHN
C=C[C@@H](CC(=O)NCC(C)(C)N1CCC(OC)CC1)c1ccccc1	ZINC000340159825	456284694	/nfs/dbraw/zinc/28/46/94/456284694.db2.gz	OFQYRCWJFJQFNN-KRWDZBQOSA-N	0	3	344.499	3.352	20	30		EGEDHN
C[C@H](Oc1ccc(C#N)cc1)C(=O)Nc1ccccc1CCN(C)C	ZINC000275707574	456290958	/nfs/dbraw/zinc/29/09/58/456290958.db2.gz	UGHPIEIJKQSRBF-HNNXBMFYSA-N	0	3	337.423	3.068	20	30		EGEDHN
CN1CCN(CCNc2ccc(C#N)c(C(F)(F)F)c2)CC1(C)C	ZINC000281684301	456293242	/nfs/dbraw/zinc/29/32/42/456293242.db2.gz	REFPVUYNADUHEC-UHFFFAOYSA-N	0	3	340.393	3.015	20	30		EGEDHN
C=CCN1CC[C@@H](N(Cc2ccc(OC)cc2)[C@H](C)C2CC2)C1=O	ZINC000337143868	456330902	/nfs/dbraw/zinc/33/09/02/456330902.db2.gz	VVLPOOQBHNVWNZ-DNVCBOLYSA-N	0	3	328.456	3.083	20	30		EGEDHN
C=CCN1CC[C@H](N2CCC(Cc3ccc(F)c(F)c3)CC2)C1=O	ZINC000337206922	456337898	/nfs/dbraw/zinc/33/78/98/456337898.db2.gz	NLBNHVQEOWQCCE-SFHVURJKSA-N	0	3	334.410	3.006	20	30		EGEDHN
C=CCN1CC[C@@H](N2CCC(Cc3ccc(F)c(F)c3)CC2)C1=O	ZINC000337206921	456338510	/nfs/dbraw/zinc/33/85/10/456338510.db2.gz	NLBNHVQEOWQCCE-GOSISDBHSA-N	0	3	334.410	3.006	20	30		EGEDHN
C=CCc1cc(CN[C@@H]2CCC[C@@H]2OC(F)F)cc(OC)c1O	ZINC000337318840	456346767	/nfs/dbraw/zinc/34/67/67/456346767.db2.gz	YOYIRWKEMZZDRF-KGLIPLIRSA-N	0	3	327.371	3.379	20	30		EGEDHN
CN(CCCSCC#N)C[C@@H](O)c1cccc(Br)c1	ZINC000298094595	456362071	/nfs/dbraw/zinc/36/20/71/456362071.db2.gz	IKQOPTPIVLARQH-CQSZACIVSA-N	0	3	343.290	3.061	20	30		EGEDHN
C[C@H]1C[C@@H](Nc2cc(C#N)c3cc([N+](=O)[O-])ccc3n2)CN1C1CC1	ZINC000302702868	456379759	/nfs/dbraw/zinc/37/97/59/456379759.db2.gz	XTKHVBCQCYXERO-WCQYABFASA-N	0	3	337.383	3.052	20	30		EGEDHN
C=CCOc1cccc(CN[C@H]2CCCN(C(=O)N3CCCC3)C2)c1	ZINC000353039080	456455334	/nfs/dbraw/zinc/45/53/34/456455334.db2.gz	ONFBRGIGTVYLLD-SFHVURJKSA-N	0	3	343.471	3.021	20	30		EGEDHN
C=CC1CCN(CC(=O)N(C)CCOc2ccc(Cl)cc2)CC1	ZINC000348189331	456525619	/nfs/dbraw/zinc/52/56/19/456525619.db2.gz	QMSQZNSSIPIIPM-UHFFFAOYSA-N	0	3	336.863	3.075	20	30		EGEDHN
CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(CC2(C#N)CC2)[C@H]2CCCC[C@@H]12	ZINC000343328159	456534151	/nfs/dbraw/zinc/53/41/51/456534151.db2.gz	XEVPPCNSHQTWKZ-TXTZMMAHSA-N	0	3	331.504	3.474	20	30		EGEDHN
C=CCn1c(C2CCC2)nnc1N1CCN(CCC(C)(C)C)CC1	ZINC000337805628	456558352	/nfs/dbraw/zinc/55/83/52/456558352.db2.gz	HPDHCPIAAPUAQB-UHFFFAOYSA-N	0	3	331.508	3.290	20	30		EGEDHN
N#CCCCOc1cccc(CN[C@H]2CCO[C@@H]2c2cccnc2)c1	ZINC000343392787	456587287	/nfs/dbraw/zinc/58/72/87/456587287.db2.gz	VQVMDXKGCYEJLG-VQTJNVASSA-N	0	3	337.423	3.384	20	30		EGEDHN
CN(Cc1cc(C#N)n(C)c1)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1	ZINC000276809927	456587517	/nfs/dbraw/zinc/58/75/17/456587517.db2.gz	XQCMMBIXFGHGHZ-MJGOQNOKSA-N	0	3	327.403	3.388	20	30		EGEDHN
C[C@@H](C#N)CN(C)C(=O)N[C@@H]1CCN(Cc2ccccc2)CC1(C)C	ZINC000282758207	456616182	/nfs/dbraw/zinc/61/61/82/456616182.db2.gz	BVYJZAWINXMTRH-FUHWJXTLSA-N	0	3	342.487	3.088	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@H](C)Cc2cncc3ccccc32)CC1	ZINC000353318326	456634835	/nfs/dbraw/zinc/63/48/35/456634835.db2.gz	ZMADISGRMRKPOJ-MRXNPFEDSA-N	0	3	337.467	3.180	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N[C@H]1CCCC[C@@H]1OC	ZINC000277008819	456651719	/nfs/dbraw/zinc/65/17/19/456651719.db2.gz	PHKPRCZQAKPHBC-XIRDDKMYSA-N	0	3	336.501	3.198	20	30		EGEDHN
CS[C@H]1CN(c2ccc(C#N)c(C(F)(F)F)c2)C[C@H]1N(C)C	ZINC000340740914	456661709	/nfs/dbraw/zinc/66/17/09/456661709.db2.gz	IOUHHUREMPFTSX-KGLIPLIRSA-N	0	3	329.391	3.059	20	30		EGEDHN
CN(C)CCOc1ccccc1CN[C@@H]1CCc2ccc(C#N)cc21	ZINC000353394365	456672132	/nfs/dbraw/zinc/67/21/32/456672132.db2.gz	CAKGAQADUCOYJE-HXUWFJFHSA-N	0	3	335.451	3.276	20	30		EGEDHN
N#CCc1ccc(CN2CCC[C@@H](CNC(=O)c3ccccc3)C2)cc1	ZINC000343529487	456687188	/nfs/dbraw/zinc/68/71/88/456687188.db2.gz	BQCUDSXWHRJJEX-FQEVSTJZSA-N	0	3	347.462	3.395	20	30		EGEDHN
CCN(Cc1ccc(CC#N)cc1)Cc1ccc(C(=O)N(C)C)cc1	ZINC000343549661	456701110	/nfs/dbraw/zinc/70/11/10/456701110.db2.gz	KFUJFDCKPDSJGL-UHFFFAOYSA-N	0	3	335.451	3.477	20	30		EGEDHN
CCOC[C@H](N[C@@H](C)C(=O)Nc1sc2c(c1C#N)CCC2)C(C)C	ZINC000348467734	456701567	/nfs/dbraw/zinc/70/15/67/456701567.db2.gz	JAACMBAQQWFCER-WFASDCNBSA-N	0	3	349.500	3.086	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000338225993	456716365	/nfs/dbraw/zinc/71/63/65/456716365.db2.gz	LNEOSNQVAARZBV-ICSRJNTNSA-N	0	3	348.450	3.027	20	30		EGEDHN
O=C(NC[C@H]1CCCn2ccnc21)N1CCc2c(F)ccc(F)c2C1	ZINC000328605574	456716604	/nfs/dbraw/zinc/71/66/04/456716604.db2.gz	JSOBUPPOXFVGPX-GFCCVEGCSA-N	0	3	346.381	3.011	20	30		EGEDHN
COc1cc(CN[C@H]2CCN(c3ccccc3F)C2)ccc1C#N	ZINC000291690844	456722401	/nfs/dbraw/zinc/72/24/01/456722401.db2.gz	JAAWSEXQJJBWPD-INIZCTEOSA-N	0	3	325.387	3.074	20	30		EGEDHN
C=CC[C@@H](CO)CNc1ccnc2cc(OCC)c(OCC)cc21	ZINC000340892947	456745319	/nfs/dbraw/zinc/74/53/19/456745319.db2.gz	WTSWKUYDNFUOGI-CQSZACIVSA-N	0	3	330.428	3.051	20	30		EGEDHN
O=C(CC1CCCCC1)NCC(=O)N1CCCN(CC2CCC2)CC1	ZINC000328795713	456762633	/nfs/dbraw/zinc/76/26/33/456762633.db2.gz	UGSVDPRSAPPEOS-UHFFFAOYSA-N	0	3	349.519	3.248	20	30		EGEDHN
O=C(CCN1CCC[C@H]2C(=O)NC[C@H]21)N[C@@H]1CCCc2ccccc21	ZINC000328814093	456767665	/nfs/dbraw/zinc/76/76/65/456767665.db2.gz	NHYVSGNXGNCRTD-KZNAEPCWSA-N	0	3	341.455	3.461	20	30		EGEDHN
COC(=O)C[C@](C)(NCCCC(C)(C)C#N)c1cccc(OC)c1	ZINC000344033874	456789783	/nfs/dbraw/zinc/78/97/83/456789783.db2.gz	FZRKKGSLZYUGQM-IBGZPJMESA-N	0	3	332.444	3.393	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2ccc3c(c2)NC(=O)C3(C)C)CN1C1CC1	ZINC000328930413	456793325	/nfs/dbraw/zinc/79/33/25/456793325.db2.gz	ZCBSLGVJZXHENR-YPMHNXCESA-N	0	3	327.428	3.496	20	30		EGEDHN
CC[C@H](C)n1ncc(NC(=O)N2CCN3CCC[C@@H]3C2)c1C1CC1	ZINC000328944633	456796658	/nfs/dbraw/zinc/79/66/58/456796658.db2.gz	UTSHTCIILMPTBV-DZGCQCFKSA-N	0	3	331.464	3.057	20	30		EGEDHN
CCN1CCC[C@@H]1CNC(=O)[C@@H]1CCN(c2ccc(Cl)cc2)C1=O	ZINC000328978175	456805611	/nfs/dbraw/zinc/80/56/11/456805611.db2.gz	CGMSTKZILOWGBR-CVEARBPZSA-N	0	3	349.862	3.134	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN(C)C[C@@H](C)CC)cc1	ZINC000341004797	456808002	/nfs/dbraw/zinc/80/80/02/456808002.db2.gz	BYXCIOBZHYNYSF-INIZCTEOSA-N	0	3	331.460	3.310	20	30		EGEDHN
CC[C@H]1CCCCN1CCNC(=O)[C@@H]1CCCO[C@H]1c1ccnn1C	ZINC000329000384	456810062	/nfs/dbraw/zinc/81/00/62/456810062.db2.gz	GQISHMNDABQMMF-LZLYRXPVSA-N	0	3	348.491	3.109	20	30		EGEDHN
CN1CCN(Cc2ccc(CNc3cccc(F)c3C#N)cc2)CC1	ZINC000301177702	456814444	/nfs/dbraw/zinc/81/44/44/456814444.db2.gz	ZQPPZCMFGKJVHQ-UHFFFAOYSA-N	0	3	338.430	3.057	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H]2CSc3ccccc32)CC1	ZINC000344624375	456843238	/nfs/dbraw/zinc/84/32/38/456843238.db2.gz	IXELRLNJHGJEKU-INIZCTEOSA-N	0	3	331.485	3.173	20	30		EGEDHN
CC(C)CN1CCN(c2c(C#N)cnc3c(F)c(F)c(F)cc32)CC1	ZINC000341364154	456856777	/nfs/dbraw/zinc/85/67/77/456856777.db2.gz	HWZNPIIYHRJMJQ-UHFFFAOYSA-N	0	3	348.372	3.302	20	30		EGEDHN
CC(C#N)C(=O)NCc1ccc(-n2cnc3ccccc32)cc1Cl	ZINC000344777546	456857964	/nfs/dbraw/zinc/85/79/64/456857964.db2.gz	SPNQIQNQUHDMMD-GFCCVEGCSA-N	0	3	338.798	3.455	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cccnc1C1CC1)C(C)C	ZINC000344781041	456858363	/nfs/dbraw/zinc/85/83/63/456858363.db2.gz	QXDBRADYLGXGFN-SFHVURJKSA-N	0	3	327.472	3.387	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H](c2cccc(Cl)c2)N(C)C)CC1	ZINC000348817056	456869579	/nfs/dbraw/zinc/86/95/79/456869579.db2.gz	KBDMMGURWVKBKH-SFHVURJKSA-N	0	3	349.906	3.099	20	30		EGEDHN
Cc1nn(CC(C)C)c(C)c1CC(=O)N[C@H](C)C1=CCN(C)CC1	ZINC000329352409	456877471	/nfs/dbraw/zinc/87/74/71/456877471.db2.gz	UNNQCMXYZXTIGY-CQSZACIVSA-N	0	3	332.492	3.305	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(F)c(C(F)(F)F)cc2F)CC1	ZINC000341591005	456878162	/nfs/dbraw/zinc/87/81/62/456878162.db2.gz	IURIAJLHCPNOKV-UHFFFAOYSA-N	0	3	348.315	3.364	20	30		EGEDHN
CC[C@@H](NCCCC#N)c1ccccc1OCC(=O)N1CCCC1	ZINC000341658450	456887830	/nfs/dbraw/zinc/88/78/30/456887830.db2.gz	MOARNOWRSIKMSK-QGZVFWFLSA-N	0	3	329.444	3.032	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN2CCC[C@H]2C2CCOCC2)c1C	ZINC000348947190	456889907	/nfs/dbraw/zinc/88/99/07/456889907.db2.gz	IQYQPVASHBNHPG-IBGZPJMESA-N	0	3	330.472	3.365	20	30		EGEDHN
C[C@@H](C(=O)NCc1ccc2c(c1)C(=O)NCC2)N1CCCCCC1	ZINC000329438738	456890243	/nfs/dbraw/zinc/89/02/43/456890243.db2.gz	MKLCRKWDRRWOIJ-AWEZNQCLSA-N	0	3	329.444	3.268	20	30		EGEDHN
Cc1nc2ccccc2n1CCC(=O)N[C@@H]1CN(C2CC2)C[C@@H]1C	ZINC000329538641	456905904	/nfs/dbraw/zinc/90/59/04/456905904.db2.gz	MMVRZCJYOABJLD-SUMWQHHRSA-N	0	3	326.444	3.174	20	30		EGEDHN
C[C@@H]1CC[C@H](C)N1CC(=O)N[C@H](CN1CCCC1=O)c1ccccc1	ZINC000329554399	456907843	/nfs/dbraw/zinc/90/78/43/456907843.db2.gz	GSMSEGZVZTYBSK-SOLBZPMBSA-N	0	3	343.471	3.179	20	30		EGEDHN
[O-]C(N[C@H]1CCSc2c(F)cccc21)=[NH+][C@@H]1CCc2nc[nH]c2C1	ZINC000329611856	456915563	/nfs/dbraw/zinc/91/55/63/456915563.db2.gz	OFRJMBGENHNBBY-MFKMUULPSA-N	0	3	346.431	3.147	20	30		EGEDHN
[O-]C(N[C@H]1CCSc2c(F)cccc21)=[NH+][C@@H]1CCc2[nH]cnc2C1	ZINC000329611856	456915566	/nfs/dbraw/zinc/91/55/66/456915566.db2.gz	OFRJMBGENHNBBY-MFKMUULPSA-N	0	3	346.431	3.147	20	30		EGEDHN
C=CCOCCN[C@@H](C)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000339068003	456925544	/nfs/dbraw/zinc/92/55/44/456925544.db2.gz	OZOLWODTZXYVCA-HNNXBMFYSA-N	0	3	325.412	3.187	20	30		EGEDHN
C=CCOCCN[C@H](C)c1ccc(NC(=O)c2ccncc2)cc1	ZINC000339068004	456926159	/nfs/dbraw/zinc/92/61/59/456926159.db2.gz	OZOLWODTZXYVCA-OAHLLOKOSA-N	0	3	325.412	3.187	20	30		EGEDHN
C[C@@H]1CCC[C@](CNC(=O)[C@H]2CCC(=O)c3cccn32)(N(C)C)C1	ZINC000329859553	456952011	/nfs/dbraw/zinc/95/20/11/456952011.db2.gz	OWLALKTWHFFLEU-OGWOLHLISA-N	0	3	331.460	3.473	20	30		EGEDHN
COC(=O)[C@H]1CC12CCN(Cc1cccc(OCCCC#N)c1)CC2	ZINC000353901724	456958545	/nfs/dbraw/zinc/95/85/45/456958545.db2.gz	RTIMIIHMCANEQU-GOSISDBHSA-N	0	3	342.439	3.144	20	30		EGEDHN
CC(C)C[C@H]1OCCC[C@@H]1NCC(=O)Nc1nc2c(s1)CCC2	ZINC000330136797	456989973	/nfs/dbraw/zinc/98/99/73/456989973.db2.gz	HQUKQWGXLGEZCR-GXTWGEPZSA-N	0	3	337.489	3.403	20	30		EGEDHN
CC[C@@H](C)n1ncc(NC(=O)N2CCCC23CCN(C)CC3)c1C	ZINC000330141590	456990689	/nfs/dbraw/zinc/99/06/89/456990689.db2.gz	XSPXYLIXLGDOJH-CQSZACIVSA-N	0	3	333.480	3.268	20	30		EGEDHN
CCN1CCCC[C@H]1CNC(=O)NC[C@H]1CCO[C@@H]1c1ccccc1	ZINC000330163139	456994123	/nfs/dbraw/zinc/99/41/23/456994123.db2.gz	SMVBJKBIRJNZRW-CEXWTWQISA-N	0	3	345.487	3.142	20	30		EGEDHN
COc1cccc([C@H](NC(=O)C(C)C#N)c2cc(F)ccc2OC)c1	ZINC000349612485	456995358	/nfs/dbraw/zinc/99/53/58/456995358.db2.gz	QXHNKUBTFJPWME-SGTLLEGYSA-N	0	3	342.370	3.208	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NC[C@@H]1CCCN1Cc1ccccc1)OCC	ZINC000339220856	456998480	/nfs/dbraw/zinc/99/84/80/456998480.db2.gz	VATUGKNBNNDKJS-OALUTQOASA-N	0	3	330.472	3.139	20	30		EGEDHN
CN1CC[C@@H]2[C@H](CCCN2C(=O)C[C@H](CC#N)c2ccccc2)C1	ZINC000356464982	457001939	/nfs/dbraw/zinc/00/19/39/457001939.db2.gz	UZDRPRLLBHQCEV-IPMKNSEASA-N	0	3	325.456	3.017	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)N(C)C	ZINC000358851047	457005154	/nfs/dbraw/zinc/00/51/54/457005154.db2.gz	IXVZFGRVBFFSNA-ZDUSSCGKSA-N	0	3	341.386	3.170	20	30		EGEDHN
CN(C)Cc1ccccc1C(=O)N1C[C@H](C#N)[C@H](c2ccccc2)C1	ZINC000346396937	457040537	/nfs/dbraw/zinc/04/05/37/457040537.db2.gz	LNHRZNOPZSMDCV-ICSRJNTNSA-N	0	3	333.435	3.128	20	30		EGEDHN
C=CCOc1ccc(OC[C@H](O)CN2CCc3ccccc3C2)cc1	ZINC000339338638	457058966	/nfs/dbraw/zinc/05/89/66/457058966.db2.gz	PAEHROBKCDZOLQ-LJQANCHMSA-N	0	3	339.435	3.049	20	30		EGEDHN
CN(CCN(C)C1CC1)C(=O)c1cn(CCCC#N)c2ccccc12	ZINC000346592864	457064667	/nfs/dbraw/zinc/06/46/67/457064667.db2.gz	KGFBNJXBRLWLRE-UHFFFAOYSA-N	0	3	338.455	3.111	20	30		EGEDHN
CCOCC(C)(C)NCC(=O)Nc1ccccc1SC[C@H](C)C#N	ZINC000339374949	457074924	/nfs/dbraw/zinc/07/49/24/457074924.db2.gz	NRXPOBKKRQNEDH-CQSZACIVSA-N	0	3	349.500	3.282	20	30		EGEDHN
CCOc1cc(NC(=O)N(C)[C@@H](C)C2CCN(C)CC2)ccc1OC	ZINC000330717907	457075508	/nfs/dbraw/zinc/07/55/08/457075508.db2.gz	VFQKLGNIFFOOOL-AWEZNQCLSA-N	0	3	349.475	3.302	20	30		EGEDHN
Cc1ccc(Cl)cc1NC(=O)C(C#N)c1ccc([N+](=O)[O-])cn1	ZINC000359919770	457148142	/nfs/dbraw/zinc/14/81/42/457148142.db2.gz	WARRFADTTMRSMU-LBPRGKRZSA-N	0	3	330.731	3.198	20	30		EGEDHN
COCCN(C(=O)C(C)C#N)[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000347029980	457196898	/nfs/dbraw/zinc/19/68/98/457196898.db2.gz	BWOIYAPHHBMXDR-RYUDHWBXSA-N	0	3	328.334	3.401	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)[C@H](C)C#N)c1ccc(C(F)(F)F)cc1	ZINC000347038428	457197710	/nfs/dbraw/zinc/19/77/10/457197710.db2.gz	OZZAZISMZWDNOL-DOMZBBRYSA-N	0	3	341.377	3.364	20	30		EGEDHN
C=CCn1c(C(C)C)nnc1N(C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000350742253	457203326	/nfs/dbraw/zinc/20/33/26/457203326.db2.gz	VDPGUKGXMVHYFN-SFHVURJKSA-N	0	3	339.487	3.298	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2cc3cnn(C(C)C)c3nc2C)nc(C)n1	ZINC000350948107	457212871	/nfs/dbraw/zinc/21/28/71/457212871.db2.gz	HHIXEDSUKZIVFO-INIZCTEOSA-N	0	3	348.410	3.218	20	30		EGEDHN
C=CCN(C(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F)C1CC1	ZINC000354465477	457240696	/nfs/dbraw/zinc/24/06/96/457240696.db2.gz	XYKFDTKHRHLHME-KRWDZBQOSA-N	0	3	334.410	3.321	20	30		EGEDHN
CCCOc1c(Cl)cc(C(=O)C(C#N)c2ccncn2)cc1OC	ZINC000354476291	457247833	/nfs/dbraw/zinc/24/78/33/457247833.db2.gz	ZDEYZZMSIJTCIU-GFCCVEGCSA-N	0	3	345.786	3.417	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)N1CCC[C@H](N(C)C)C1	ZINC000339799368	457276372	/nfs/dbraw/zinc/27/63/72/457276372.db2.gz	XIFXGUOVZINHNB-AWEZNQCLSA-N	0	3	327.453	3.248	20	30		EGEDHN
C[C@@H](CNC(=O)C[C@@H](CC#N)c1ccccc1)N1CCCC[C@H]1C	ZINC000354559795	457288231	/nfs/dbraw/zinc/28/82/31/457288231.db2.gz	BSBRLDYBVZJPNT-ZIFCJYIRSA-N	0	3	327.472	3.453	20	30		EGEDHN
CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)CCCC#N	ZINC000360348352	457305913	/nfs/dbraw/zinc/30/59/13/457305913.db2.gz	VWFYOXZTVYKHFJ-GOSISDBHSA-N	0	3	327.472	3.269	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1ccc(CC)nc1C)C(C)C	ZINC000354720102	457316064	/nfs/dbraw/zinc/31/60/64/457316064.db2.gz	XKHWKCPOHXXKGT-IBGZPJMESA-N	0	3	329.488	3.381	20	30		EGEDHN
C[C@@H](C(=O)N(C)CCC#N)N1CCC[C@@](C)(c2ccccc2)CC1	ZINC000352211312	457348616	/nfs/dbraw/zinc/34/86/16/457348616.db2.gz	JTQHBBUDKYRCJH-FXAWDEMLSA-N	0	3	327.472	3.191	20	30		EGEDHN
N#CCSc1cccc(C(=O)NC[C@@H]2CCCCN2C2CC2)c1	ZINC000347348385	457367342	/nfs/dbraw/zinc/36/73/42/457367342.db2.gz	XKZQNVZNIANBOM-INIZCTEOSA-N	0	3	329.469	3.049	20	30		EGEDHN
COc1cc2c(c(OC)c1OC)CCN(CCCC(C)(C)C#N)CC2	ZINC000378193252	457382655	/nfs/dbraw/zinc/38/26/55/457382655.db2.gz	RUXDAJROJMGFJU-UHFFFAOYSA-N	0	3	346.471	3.443	20	30		EGEDHN
CN(C)[C@@H](CNc1ccc(C#N)c([N+](=O)[O-])c1)c1ccc(F)cc1	ZINC000357327718	457448616	/nfs/dbraw/zinc/44/86/16/457448616.db2.gz	KHQFOLHTUWTWJA-KRWDZBQOSA-N	0	3	328.347	3.320	20	30		EGEDHN
CN(C)[C@H](CNc1ccc(C#N)c([N+](=O)[O-])c1)c1ccc(F)cc1	ZINC000357328901	457449495	/nfs/dbraw/zinc/44/94/95/457449495.db2.gz	KHQFOLHTUWTWJA-QGZVFWFLSA-N	0	3	328.347	3.320	20	30		EGEDHN
COC(=O)[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1c1ccccc1	ZINC000374074850	457470500	/nfs/dbraw/zinc/47/05/00/457470500.db2.gz	NWXPVAJCCDYHEU-ZWKOTPCHSA-N	0	3	338.382	3.086	20	30		EGEDHN
COc1ccc(C#N)cc1CN1CCC(CCCn2ccnc2)CC1	ZINC000361062498	457556297	/nfs/dbraw/zinc/55/62/97/457556297.db2.gz	MHHATDFFPFUJAX-UHFFFAOYSA-N	0	3	338.455	3.456	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)CCCN1C(=O)c2ccccc2C1=O	ZINC000425531787	457587588	/nfs/dbraw/zinc/58/75/88/457587588.db2.gz	HYOHKOARWUJYFS-OAHLLOKOSA-N	0	3	347.418	3.237	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)C[C@@H](O)COCc1cccs1	ZINC000425538145	457589334	/nfs/dbraw/zinc/58/93/34/457589334.db2.gz	ROXJPMQFTJLTEL-RHSMWYFYSA-N	0	3	330.453	3.190	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN[C@H](C)c1ccncc1CC	ZINC000361130712	457600759	/nfs/dbraw/zinc/60/07/59/457600759.db2.gz	HATSZDWVKCZAFI-APWZRJJASA-N	0	3	340.467	3.463	20	30		EGEDHN
CSc1ccc([C@H](CNC(=O)N[C@@H]2CC[C@H](C#N)C2)N(C)C)cc1	ZINC000425765810	457641110	/nfs/dbraw/zinc/64/11/10/457641110.db2.gz	IAYOPASYUDUMQA-LXZKKBNFSA-N	0	3	346.500	3.003	20	30		EGEDHN
C=CCNC(=O)c1ccc(N[C@H](C)[C@@H](c2ccccc2)N(C)C)nc1	ZINC000357663007	457645682	/nfs/dbraw/zinc/64/56/82/457645682.db2.gz	PVPQRKIHFLYLDC-BEFAXECRSA-N	0	3	338.455	3.101	20	30		EGEDHN
C=CCOc1cccc(CN[C@H]2CC(=O)N(c3ccccc3F)C2)c1	ZINC000361251430	457667112	/nfs/dbraw/zinc/66/71/12/457667112.db2.gz	NNTVTZIRLHPMIQ-INIZCTEOSA-N	0	3	340.398	3.286	20	30		EGEDHN
N#CCCCc1nc(-c2ccc(OCCN3CCCC3)cc2)no1	ZINC000361261108	457670639	/nfs/dbraw/zinc/67/06/39/457670639.db2.gz	GBLSVHJIHYMAIK-UHFFFAOYSA-N	0	3	326.400	3.057	20	30		EGEDHN
CC(C#N)C(=O)N1CCCC[C@H]1c1nc(-c2cccc(F)c2)c[nH]1	ZINC000357802469	457695374	/nfs/dbraw/zinc/69/53/74/457695374.db2.gz	KMEYZSPYCFSMRV-LRDDRELGSA-N	0	3	326.375	3.429	20	30		EGEDHN
N#Cc1ccncc1N1CC[C@@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000364906712	457716845	/nfs/dbraw/zinc/71/68/45/457716845.db2.gz	USHJIBFXAZYQTJ-NRFANRHFSA-N	0	3	332.451	3.446	20	30		EGEDHN
Cc1ccccc1[C@@H]([C@@H](C)NC(=O)c1cccc(CC#N)c1)N(C)C	ZINC000357866716	457717625	/nfs/dbraw/zinc/71/76/25/457717625.db2.gz	JXNSVBBYAZZPDF-OXQOHEQNSA-N	0	3	335.451	3.482	20	30		EGEDHN
Cc1ccccc1[C@H]([C@@H](C)NC(=O)c1ccc(CC#N)cc1)N(C)C	ZINC000357875076	457720214	/nfs/dbraw/zinc/72/02/14/457720214.db2.gz	RNQKIFNJKNBMMI-UZLBHIALSA-N	0	3	335.451	3.482	20	30		EGEDHN
N#CC(C(=O)c1ccccc1-n1cccn1)c1cnc2ccccc2n1	ZINC000361524008	457770058	/nfs/dbraw/zinc/77/00/58/457770058.db2.gz	IHGRSSAVJUVEGN-HNNXBMFYSA-N	0	3	339.358	3.306	20	30		EGEDHN
Cc1nc(NC(=O)c2ccc(CN3CCCCC3)cc2)ccc1C#N	ZINC000411055640	457787484	/nfs/dbraw/zinc/78/74/84/457787484.db2.gz	WZYPYGNIGNJPHT-UHFFFAOYSA-N	0	3	334.423	3.500	20	30		EGEDHN
N#CCCn1cc(CNCc2ccc(F)cc2)c(-c2ccncc2)n1	ZINC000433304162	457804504	/nfs/dbraw/zinc/80/45/04/457804504.db2.gz	KEGOHFAOXATEPC-UHFFFAOYSA-N	0	3	335.386	3.288	20	30		EGEDHN
Cc1noc(C)c1[C@H](C)CNC(=O)C(C#N)CCc1ccccc1	ZINC000433378973	457824289	/nfs/dbraw/zinc/82/42/89/457824289.db2.gz	WRHGBXIKCVTTFB-CXAGYDPISA-N	0	3	325.412	3.284	20	30		EGEDHN
CO[C@H](C)c1nc(CN2CCCN([C@H](C)CCC#N)CC2)cs1	ZINC000411334717	457859107	/nfs/dbraw/zinc/85/91/07/457859107.db2.gz	PMZLRGKSDRDEGI-HUUCEWRRSA-N	0	3	336.505	3.050	20	30		EGEDHN
CC[C@H](N[C@H](C)CCC#N)c1ccccc1OCC(=O)N1CCCC1	ZINC000411457650	457893701	/nfs/dbraw/zinc/89/37/01/457893701.db2.gz	WOOUQPMJOOHTLB-AEFFLSMTSA-N	0	3	343.471	3.421	20	30		EGEDHN
CCCN1CCC[C@H]1CNC(=O)N(Cc1ccc(C#N)cc1)C1CC1	ZINC000358270757	457901166	/nfs/dbraw/zinc/90/11/66/457901166.db2.gz	FRTKDRPHXSVQGA-IBGZPJMESA-N	0	3	340.471	3.107	20	30		EGEDHN
C=CCOc1ccc(CN[C@H]2CCCO[C@@H]2c2nccn2CC)cc1	ZINC000433946587	457917612	/nfs/dbraw/zinc/91/76/12/457917612.db2.gz	UFFHMXNOFOTWFK-OALUTQOASA-N	0	3	341.455	3.478	20	30		EGEDHN
C=CCN(C)CCN(CC)CC(=O)N1CCc2sccc2[C@@H]1CC	ZINC000411634680	457934969	/nfs/dbraw/zinc/93/49/69/457934969.db2.gz	ANAWVBFMVPUBNI-KRWDZBQOSA-N	0	3	349.544	3.024	20	30		EGEDHN
CN(C)c1noc([C@H]2CCCN(CCC3(C#N)CCCCC3)C2)n1	ZINC000411685236	457950257	/nfs/dbraw/zinc/95/02/57/457950257.db2.gz	ALBASANVGUTKLT-HNNXBMFYSA-N	0	3	331.464	3.179	20	30		EGEDHN
N#CC(C(=O)c1ccnn1CC(F)F)c1cc(C(F)(F)F)ccn1	ZINC000362127625	458033150	/nfs/dbraw/zinc/03/31/50/458033150.db2.gz	AZTHPYZXZZWMFF-VIFPVBQESA-N	0	3	344.243	3.052	20	30		EGEDHN
COC1([C@H](C)NCC(=O)N(CCC#N)c2cccc(Cl)c2)CCC1	ZINC000412020714	458047536	/nfs/dbraw/zinc/04/75/36/458047536.db2.gz	LVKPNFYYHROUSO-AWEZNQCLSA-N	0	3	349.862	3.134	20	30		EGEDHN
C[C@@H](CNC(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1)N(C)Cc1ccccc1	ZINC000412102364	458092622	/nfs/dbraw/zinc/09/26/22/458092622.db2.gz	WTMFFLGPEAULFF-ORYQWCPZSA-N	0	3	347.462	3.298	20	30		EGEDHN
N#CCCn1cc(CN2CCC(C(F)F)CC2)c(-c2ccncc2)n1	ZINC000435126632	458097379	/nfs/dbraw/zinc/09/73/79/458097379.db2.gz	OYPJQFYETQTLSF-UHFFFAOYSA-N	0	3	345.397	3.336	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1	ZINC000371925888	458124042	/nfs/dbraw/zinc/12/40/42/458124042.db2.gz	CQVUKSPQRFSVPV-QZTJIDSGSA-N	0	3	348.531	3.493	20	30		EGEDHN
CC(C)CN(Cc1ccc(C#N)cc1)C(=O)NCC1(N(C)C)CCC1	ZINC000445981973	458125245	/nfs/dbraw/zinc/12/52/45/458125245.db2.gz	RYHPYWNCXGECQL-UHFFFAOYSA-N	0	3	342.487	3.210	20	30		EGEDHN
C=C(C)CS(=O)(=O)NCc1ccccc1CN1CCCCCC1	ZINC000435439857	458148208	/nfs/dbraw/zinc/14/82/08/458148208.db2.gz	XMWLOGRNDXEQBS-UHFFFAOYSA-N	0	3	336.501	3.058	20	30		EGEDHN
COC(=O)[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1c1ccccc1	ZINC000375997520	458155895	/nfs/dbraw/zinc/15/58/95/458155895.db2.gz	BSTOZMKCLXYYTF-DLBZAZTESA-N	0	3	326.421	3.008	20	30		EGEDHN
CCCCOC1CCN(CCC(=O)Nc2sccc2C#N)CC1	ZINC000362451956	458187935	/nfs/dbraw/zinc/18/79/35/458187935.db2.gz	MHQXZEUATNMJKR-UHFFFAOYSA-N	0	3	335.473	3.229	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCN(CCSc3ccccc3)C2)nc1	ZINC000428774139	458209102	/nfs/dbraw/zinc/20/91/02/458209102.db2.gz	UENXUAZUZAWIFQ-MRXNPFEDSA-N	0	3	325.437	3.199	20	30		EGEDHN
CC[C@@H](N[C@H]1CCCN(C(=O)N2CCCC2)C1)c1ccc(C#N)cc1	ZINC000376141344	458210140	/nfs/dbraw/zinc/21/01/40/458210140.db2.gz	BZYHEUDCXAYNKE-RBUKOAKNSA-N	0	3	340.471	3.279	20	30		EGEDHN
CC(C#N)C(=O)N[C@H]1C[C@H](c2ccc(F)c(Br)c2)C1	ZINC000435994013	458234456	/nfs/dbraw/zinc/23/44/56/458234456.db2.gz	NIHWTYPRLOUAOO-LSJOCFKGSA-N	0	3	325.181	3.110	20	30		EGEDHN
C#C[C@@H](NC(=O)NC1CCN([C@@H](C)c2ccccc2)CC1)C(C)C	ZINC000369617640	458290529	/nfs/dbraw/zinc/29/05/29/458290529.db2.gz	PPROTKNHEIPLLE-QFBILLFUSA-N	0	3	327.472	3.169	20	30		EGEDHN
COc1ccc([C@@H](CN2CCCC2)Nc2ncc(C#N)cc2F)cc1	ZINC000413231921	458295918	/nfs/dbraw/zinc/29/59/18/458295918.db2.gz	KAQYQHMPTSAFDO-GOSISDBHSA-N	0	3	340.402	3.350	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@]2(C1)CCCN(C)C2	ZINC000413825676	458308256	/nfs/dbraw/zinc/30/82/56/458308256.db2.gz	GSWPYOBDTGVEKF-PZJWPPBQSA-N	0	3	341.499	3.301	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NC(=O)N1CCN(C2CC2)C[C@@H](C)C1	ZINC000413836163	458310111	/nfs/dbraw/zinc/31/01/11/458310111.db2.gz	ORGVWSIVWNYPIG-IEBWSBKVSA-N	0	3	341.499	3.300	20	30		EGEDHN
CC[C@@H](NCC(C)(C)CC#N)c1ccccc1OCC(=O)N(C)C	ZINC000414162197	458315758	/nfs/dbraw/zinc/31/57/58/458315758.db2.gz	GRYLGEKSXXLLSC-MRXNPFEDSA-N	0	3	331.460	3.134	20	30		EGEDHN
CC[C@@H](NCC(=O)N[C@@H]1CCOc2ccccc21)c1ccc(C#N)cc1	ZINC000376573178	458341844	/nfs/dbraw/zinc/34/18/44/458341844.db2.gz	VCZYNJVRHYJBKC-RTBURBONSA-N	0	3	349.434	3.239	20	30		EGEDHN
CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)NCC1(C#N)CCC1	ZINC000419478403	458383680	/nfs/dbraw/zinc/38/36/80/458383680.db2.gz	JOIDXVJWGZEWNL-GOSISDBHSA-N	0	3	342.487	3.136	20	30		EGEDHN
CC(=O)Nc1c[nH]nc1[C@@H]1CCCN(CCCCC(C)(C)C#N)C1	ZINC000373074404	458392302	/nfs/dbraw/zinc/39/23/02/458392302.db2.gz	MMLZCNRFYYCUCN-OAHLLOKOSA-N	0	3	331.464	3.268	20	30		EGEDHN
CC1(C)CN(Cc2cccc(OCc3cccc(C#N)c3)c2)C[C@@H]1O	ZINC000448354861	458400383	/nfs/dbraw/zinc/40/03/83/458400383.db2.gz	LSACHKMLENZZRF-FQEVSTJZSA-N	0	3	336.435	3.340	20	30		EGEDHN
C=C(C)[C@@H](NC(=O)N(C)C[C@H]1CCCN1C)c1ccc(F)c(F)c1	ZINC000420826385	458402776	/nfs/dbraw/zinc/40/27/76/458402776.db2.gz	AHRPCBGGZNNECF-RHSMWYFYSA-N	0	3	337.414	3.318	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)[C@@H]1CC12CCSCC2)C(C)C	ZINC000448974632	458417417	/nfs/dbraw/zinc/41/74/17/458417417.db2.gz	LKYXYWIONNGEFY-DLBZAZTESA-N	0	3	336.545	3.335	20	30		EGEDHN
CN1CCN(Cc2cccc(NC3CCC(C)(C#N)CC3)c2)CC1	ZINC000449040855	458419880	/nfs/dbraw/zinc/41/98/80/458419880.db2.gz	JVIWPEZFVPWXLP-UHFFFAOYSA-N	0	3	326.488	3.318	20	30		EGEDHN
C=C(C)CCNCc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-]	ZINC000449473277	458424836	/nfs/dbraw/zinc/42/48/36/458424836.db2.gz	HKMCXMVQKIVBKB-UHFFFAOYSA-N	0	3	330.331	3.303	20	30		EGEDHN
C=CC(C)(C)C(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1	ZINC000449940699	458434893	/nfs/dbraw/zinc/43/48/93/458434893.db2.gz	MZAWDUKDCUITQO-QGZVFWFLSA-N	0	3	343.471	3.004	20	30		EGEDHN
C=CC(C)(C)C(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1	ZINC000449940698	458435178	/nfs/dbraw/zinc/43/51/78/458435178.db2.gz	MZAWDUKDCUITQO-KRWDZBQOSA-N	0	3	343.471	3.004	20	30		EGEDHN
Cc1ccc(CNC2CCN(Cc3ccc(C#N)cc3)CC2)nc1C	ZINC000459666613	458441021	/nfs/dbraw/zinc/44/10/21/458441021.db2.gz	LQICEPNTLBRLIJ-UHFFFAOYSA-N	0	3	334.467	3.324	20	30		EGEDHN
COCCN(Cc1ccc(C#N)cc1)C[C@@H](O)[C@H](C)c1ccccc1	ZINC000450312846	458445138	/nfs/dbraw/zinc/44/51/38/458445138.db2.gz	JFULNAAISGXNKG-DYESRHJHSA-N	0	3	338.451	3.171	20	30		EGEDHN
C[C@@H](c1ccccc1)[C@@H](O)CN(C)CCOCc1ccc(C#N)cc1	ZINC000451037422	458463925	/nfs/dbraw/zinc/46/39/25/458463925.db2.gz	OZTSLVGWLTVROH-UWJYYQICSA-N	0	3	338.451	3.171	20	30		EGEDHN
C[C@H]1[C@H](NC(=O)CCc2ccc(C#N)cc2)CCN1Cc1ccccc1	ZINC000377106466	458463904	/nfs/dbraw/zinc/46/39/04/458463904.db2.gz	SIOHFYPJBHICPW-LAUBAEHRSA-N	0	3	347.462	3.270	20	30		EGEDHN
CC(C)O[C@@H]1C[C@H](NCC(=O)Nc2cc(Cl)ccc2C#N)C1(C)C	ZINC000451496883	458478966	/nfs/dbraw/zinc/47/89/66/458478966.db2.gz	KUMIIKNFUKJVOQ-JKSUJKDBSA-N	0	3	349.862	3.332	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCC(=O)Nc1ccccc1Cc1ccccc1	ZINC000451605944	458482539	/nfs/dbraw/zinc/48/25/39/458482539.db2.gz	LPAQRNRKWDNCFK-UXHICEINSA-N	0	3	336.435	3.149	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCc1cccc(Br)c1OC(F)F	ZINC000451611024	458483327	/nfs/dbraw/zinc/48/33/27/458483327.db2.gz	VVVGHPPQDYULED-NEPJUHHUSA-N	0	3	348.187	3.484	20	30		EGEDHN
CC(C)(C)N1C[C@@H](C(=O)Nc2ccccc2C#N)[C@H](C(F)(F)F)C1	ZINC000459828719	458486113	/nfs/dbraw/zinc/48/61/13/458486113.db2.gz	FJTVTGWEWOPRCX-CHWSQXEVSA-N	0	3	339.361	3.406	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1C(=O)NC[C@H]1CCCN(C)[C@@H]1c1cccs1	ZINC000377465393	458500927	/nfs/dbraw/zinc/50/09/27/458500927.db2.gz	QTCMXEXHOSKAOV-XYVMCAHJSA-N	0	3	348.512	3.228	20	30		EGEDHN
C=C(C)Cn1c([C@@H]2CC[C@H](C)O2)nnc1N1C[C@@H](C)N(CC)C[C@H]1C	ZINC000453462641	458532946	/nfs/dbraw/zinc/53/29/46/458532946.db2.gz	PNHBDOIKXZLLRB-NCOADZHNSA-N	0	3	347.507	3.013	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N1Cc2ccccc2[C@H](c2ccccc2)C1	ZINC000424085349	458554029	/nfs/dbraw/zinc/55/40/29/458554029.db2.gz	PLDXHDBHOGXQHA-VQTJNVASSA-N	0	3	333.435	3.182	20	30		EGEDHN
C=CC(C)(C)CNC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C	ZINC000454272531	458557139	/nfs/dbraw/zinc/55/71/39/458557139.db2.gz	OOZQDELNFJVOOX-UHFFFAOYSA-N	0	3	344.503	3.471	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N(Cc1ccc(C(F)(F)F)cc1)C1CC1	ZINC000424106198	458559777	/nfs/dbraw/zinc/55/97/77/458559777.db2.gz	XCKAMLUFTQQKIV-OAHLLOKOSA-N	0	3	339.361	3.218	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1ccc(OCc2ccccc2F)cc1	ZINC000424111124	458561070	/nfs/dbraw/zinc/56/10/70/458561070.db2.gz	FRERCLMRKYAHBD-SFHVURJKSA-N	0	3	341.386	3.364	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N(Cc1c(F)cccc1F)C1CCCC1	ZINC000424118663	458563276	/nfs/dbraw/zinc/56/32/76/458563276.db2.gz	CBJLDRHYBYSAIR-QGZVFWFLSA-N	0	3	335.398	3.257	20	30		EGEDHN
C[C@@H]1[C@@H](NC(=O)N[C@H](CCCC#N)c2ccccc2)CCCN1C	ZINC000431457562	458575693	/nfs/dbraw/zinc/57/56/93/458575693.db2.gz	JKNDZBTZSFAAAJ-BPQIPLTHSA-N	0	3	328.460	3.203	20	30		EGEDHN
C=CCC[C@@H](NC[C@]1(N2CCOCC2)CCSC1)c1ccco1	ZINC000373700957	458576979	/nfs/dbraw/zinc/57/69/79/458576979.db2.gz	PFBMMKCEXQLPAF-SJLPKXTDSA-N	0	3	336.501	3.084	20	30		EGEDHN
C[C@@H](C(=O)Nc1ccc(OCCN(C)C)cc1)c1cccc(C#N)c1	ZINC000461938620	458580490	/nfs/dbraw/zinc/58/04/90/458580490.db2.gz	TXQCEZNBEYZXLE-OAHLLOKOSA-N	0	3	337.423	3.241	20	30		EGEDHN
N#Cc1cccnc1OC1CCC(NCc2ccn(C(F)F)n2)CC1	ZINC000438476044	458582239	/nfs/dbraw/zinc/58/22/39/458582239.db2.gz	DVBBIIKUWQOXDD-UHFFFAOYSA-N	0	3	347.369	3.025	20	30		EGEDHN
N#CCc1ccc(NC(=O)NCCN2CCCCCC2)c(Cl)c1	ZINC000455749132	458610668	/nfs/dbraw/zinc/61/06/68/458610668.db2.gz	JTBKTGRSOADXCT-UHFFFAOYSA-N	0	3	334.851	3.404	20	30		EGEDHN
C[C@@H]1CCN(CC(=O)NCc2ccc(C#N)cc2)CC12CCCCC2	ZINC000462453938	458622465	/nfs/dbraw/zinc/62/24/65/458622465.db2.gz	HMBUZQVPHHVPFO-QGZVFWFLSA-N	0	3	339.483	3.467	20	30		EGEDHN
CC(C)(CNC(=O)C(C#N)Cc1ccc(C#N)cc1)c1ccccc1	ZINC000470782918	458650503	/nfs/dbraw/zinc/65/05/03/458650503.db2.gz	FKNZHOZTEMJAPT-SFHVURJKSA-N	0	3	331.419	3.335	20	30		EGEDHN
C[C@@H]1CCCN(CCNc2c(C#N)cnc3c(F)c(F)c(F)cc32)C1	ZINC000439096481	458653485	/nfs/dbraw/zinc/65/34/85/458653485.db2.gz	KKGOYOJRXHUQDN-LLVKDONJSA-N	0	3	348.372	3.089	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCCc2ccc(Cl)c(C)c2)CC1	ZINC000463315280	458689748	/nfs/dbraw/zinc/68/97/48/458689748.db2.gz	KPNZCXPHBFXOCN-UHFFFAOYSA-N	0	3	335.879	3.141	20	30		EGEDHN
COc1cc(C#N)ccc1NC(=O)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000547415632	458734731	/nfs/dbraw/zinc/73/47/31/458734731.db2.gz	ATAFTTNONIAURW-GOSISDBHSA-N	0	3	349.434	3.418	20	30		EGEDHN
CC(C)Oc1ccc(C#N)cc1NC(=O)N[C@@H](C)CN1CCCCC1	ZINC000505667515	458746570	/nfs/dbraw/zinc/74/65/70/458746570.db2.gz	ZTUOIHAZDAKYDI-HNNXBMFYSA-N	0	3	344.459	3.341	20	30		EGEDHN
C=CCN(CC=C)C(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000512896756	458788742	/nfs/dbraw/zinc/78/87/42/458788742.db2.gz	OLEYKNVKOPTMFP-LJQANCHMSA-N	0	3	345.487	3.460	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN(CCC)[C@H]1CCc2ccccc2C1	ZINC000513634221	458794878	/nfs/dbraw/zinc/79/48/78/458794878.db2.gz	XWZHLHMLFJGEDS-FQEVSTJZSA-N	0	3	326.484	3.457	20	30		EGEDHN
C[C@H](C(=O)N(C)CCC#N)N1CCC[C@]2(CCCc3ccccc32)C1	ZINC000440314696	458802572	/nfs/dbraw/zinc/80/25/72/458802572.db2.gz	LAHCFVOLRHTKRS-DYESRHJHSA-N	0	3	339.483	3.117	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N1CCS[C@H](CC)C1)C(C)C	ZINC000465539317	458831882	/nfs/dbraw/zinc/83/18/82/458831882.db2.gz	CSLNLQQPSHKEMI-SJORKVTESA-N	0	3	339.549	3.222	20	30		EGEDHN
C[C@H](NCCOCCC#N)c1ccc(OCc2cccnc2)cc1	ZINC000549925362	458884719	/nfs/dbraw/zinc/88/47/19/458884719.db2.gz	SXLKGBYRVWHXST-INIZCTEOSA-N	0	3	325.412	3.241	20	30		EGEDHN
Cc1ccc(CN2CC[C@H](CN(C)C(=O)C3(C#N)CCC3)C2)s1	ZINC000552134326	458891035	/nfs/dbraw/zinc/89/10/35/458891035.db2.gz	ITSQTWBJLZFYQB-OAHLLOKOSA-N	0	3	331.485	3.031	20	30		EGEDHN
N#CC1(CCN2CCC(C(=O)NCC(F)(F)F)CC2)CCCCC1	ZINC000519104892	458915304	/nfs/dbraw/zinc/91/53/04/458915304.db2.gz	JFSACKRROULDND-UHFFFAOYSA-N	0	3	345.409	3.241	20	30		EGEDHN
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCc1ccc(C#N)c(F)c1	ZINC000556514733	458967862	/nfs/dbraw/zinc/96/78/62/458967862.db2.gz	HZZCXUVTUMEIRM-RDTXWAMCSA-N	0	3	340.398	3.207	20	30		EGEDHN
CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2N[C@@H]1CCc2ccc(C#N)cc21	ZINC000495876115	458989311	/nfs/dbraw/zinc/98/93/11/458989311.db2.gz	NMMMOSYVBSSICM-XDNAFOTISA-N	0	3	339.439	3.000	20	30		EGEDHN
C[C@@H](N[C@@H](C)CC(=O)NCCc1ccccc1)c1ccc(C#N)cc1	ZINC000531951465	459005924	/nfs/dbraw/zinc/00/59/24/459005924.db2.gz	BYPFGBFYWQJCMP-DLBZAZTESA-N	0	3	335.451	3.346	20	30		EGEDHN
O[C@H](CNCC#Cc1cccc(C(F)(F)F)c1)Cc1ccccc1	ZINC000519825047	459011893	/nfs/dbraw/zinc/01/18/93/459011893.db2.gz	UCKPQQMRSKPXEH-SFHVURJKSA-N	0	3	333.353	3.250	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(CN[C@@H]3CC[C@@H](C#N)C3)cc2)C[C@@H](C)O1	ZINC000442722341	459027369	/nfs/dbraw/zinc/02/73/69/459027369.db2.gz	VDMLHHYCSIDDJX-XNFNUYLZSA-N	0	3	327.472	3.078	20	30		EGEDHN
CC(C)CN(CCc1ccccc1)CC(=O)NCc1cccc(C#N)c1	ZINC000520168550	459034985	/nfs/dbraw/zinc/03/49/85/459034985.db2.gz	GAPYXQGLJYHEGU-UHFFFAOYSA-N	0	3	349.478	3.375	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@@H](C)N[C@@H](c1ccc(OC)cc1)C1CC1	ZINC000477336373	459040857	/nfs/dbraw/zinc/04/08/57/459040857.db2.gz	HHOAIHSEHUVLTG-DNVCBOLYSA-N	0	3	328.456	3.325	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)C1=Cc2ccccc2OC1)C(C)C	ZINC000496026105	459042201	/nfs/dbraw/zinc/04/22/01/459042201.db2.gz	BHSCQBDCQCXXRK-LJQANCHMSA-N	0	3	340.467	3.277	20	30		EGEDHN
CN1CCCC(C)(C)[C@@H]1CNC(=O)C(C)(C)c1cc(F)cc(C#N)c1	ZINC000557040922	459045163	/nfs/dbraw/zinc/04/51/63/459045163.db2.gz	UWDPBCDZDMJMCB-KRWDZBQOSA-N	0	3	345.462	3.212	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN(C)Cc1cccc(F)c1	ZINC000520619254	459079895	/nfs/dbraw/zinc/07/98/95/459079895.db2.gz	OVENCNCQXJEAER-LJQANCHMSA-N	0	3	329.415	3.426	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2NC[C@H](O)COCc1ccccc1	ZINC000520797974	459095680	/nfs/dbraw/zinc/09/56/80/459095680.db2.gz	MILNNMHDYINJTC-PZJWPPBQSA-N	0	3	336.435	3.103	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CC2(CCOCC2)[C@@H]1C1CC1	ZINC000520871297	459101990	/nfs/dbraw/zinc/10/19/90/459101990.db2.gz	FNAMHZVHCCPRCI-OALUTQOASA-N	0	3	338.451	3.177	20	30		EGEDHN
C[C@@H](CN(C)[C@H]1CCN(c2ccc(C#N)cc2)C1=O)c1ccccc1	ZINC000532517922	459104184	/nfs/dbraw/zinc/10/41/84/459104184.db2.gz	GFBNKTSKCLWZDV-JXFKEZNVSA-N	0	3	333.435	3.399	20	30		EGEDHN
CC[C@H]1CCCC[C@@H]1CNCCS(=O)(=O)c1ccc(C#N)cc1	ZINC000577860302	459109017	/nfs/dbraw/zinc/10/90/17/459109017.db2.gz	WCLGGJQMMLUFIR-DLBZAZTESA-N	0	3	334.485	3.138	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)OCc3ccccc3)C2)s1	ZINC000496223329	459114486	/nfs/dbraw/zinc/11/44/86/459114486.db2.gz	DJXOYSWBLYNRAZ-HNNXBMFYSA-N	0	3	341.436	3.120	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CC[C@@H](c2cccnc2)C1	ZINC000578010079	459131839	/nfs/dbraw/zinc/13/18/39/459131839.db2.gz	VVQWAXBQTKPCIK-WOJBJXKFSA-N	0	3	338.451	3.039	20	30		EGEDHN
N#CCSCCCN1CCC[C@@H]1COC(=O)NC1CCCCC1	ZINC000496382046	459172802	/nfs/dbraw/zinc/17/28/02/459172802.db2.gz	MVBCIDPLATXCAF-MRXNPFEDSA-N	0	3	339.505	3.157	20	30		EGEDHN
CN1CCC[C@@H](CNC(=O)c2ccc(C#Cc3ccccc3)cc2)C1	ZINC000521726858	459174181	/nfs/dbraw/zinc/17/41/81/459174181.db2.gz	RDICMBOSOJLBHO-FQEVSTJZSA-N	0	3	332.447	3.158	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CCC[C@H]1[C@@H]1CCCO1)C(C)C	ZINC000480515941	459201978	/nfs/dbraw/zinc/20/19/78/459201978.db2.gz	IHHRIYLKOZOSSW-OTWHNJEPSA-N	0	3	349.519	3.038	20	30		EGEDHN
CO[C@@H](CNCc1cn(C)nc1-c1ccc(C#N)cc1)C1CCCC1	ZINC000594995302	459208761	/nfs/dbraw/zinc/20/87/61/459208761.db2.gz	RAUHKYSAODNVMM-IBGZPJMESA-N	0	3	338.455	3.254	20	30		EGEDHN
CN1CC[C@@H]2CN(C(=O)c3ccccc3Oc3ccccc3C#N)C[C@@H]21	ZINC000590776508	459212901	/nfs/dbraw/zinc/21/29/01/459212901.db2.gz	AJSYEYPSBHMZBO-AEFFLSMTSA-N	0	3	347.418	3.127	20	30		EGEDHN
N#Cc1ccccc1-c1ccc(C[N@@H+]2CC[C@H](c3nnc[n-]3)C2)cc1	ZINC000578620521	459232247	/nfs/dbraw/zinc/23/22/47/459232247.db2.gz	BYALUKUZEMZDLJ-SFHVURJKSA-N	0	3	329.407	3.333	20	30		EGEDHN
N#Cc1ccccc1-c1ccc(C[N@H+]2CC[C@H](c3nnc[n-]3)C2)cc1	ZINC000578620521	459232254	/nfs/dbraw/zinc/23/22/54/459232254.db2.gz	BYALUKUZEMZDLJ-SFHVURJKSA-N	0	3	329.407	3.333	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1NCc1ccc(C#N)c(F)c1	ZINC000496602838	459255448	/nfs/dbraw/zinc/25/54/48/459255448.db2.gz	ISRKGRQQXPOVNG-HOTGVXAUSA-N	0	3	333.407	3.233	20	30		EGEDHN
CN(CC(C)(C)C#N)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000590918465	459267383	/nfs/dbraw/zinc/26/73/83/459267383.db2.gz	DTIGBYNQHNWCCD-GOSISDBHSA-N	0	3	342.487	3.090	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN[C@H](C)C1(c2ccccc2)CCCC1	ZINC000481825668	459277455	/nfs/dbraw/zinc/27/74/55/459277455.db2.gz	PULVOLWHSQXMTE-ZWKOTPCHSA-N	0	3	341.499	3.485	20	30		EGEDHN
N#Cc1ccc(CCN2CCCC[C@@H]2CNC(=O)c2ccccc2)cc1	ZINC000595335972	459280331	/nfs/dbraw/zinc/28/03/31/459280331.db2.gz	FIAKONSYWQDZHL-OAQYLSRUSA-N	0	3	347.462	3.385	20	30		EGEDHN
C[C@@](O)(C1CCN(CCc2ccc(C#N)cc2)CC1)C(F)(F)F	ZINC000595437067	459301967	/nfs/dbraw/zinc/30/19/67/459301967.db2.gz	CHXOWLDYBDDJRF-MRXNPFEDSA-N	0	3	326.362	3.126	20	30		EGEDHN
C[C@H](CN1CCC(C)CC1)NC(=O)NCc1ccc(C#N)c(Cl)c1	ZINC000595599785	459360369	/nfs/dbraw/zinc/36/03/69/459360369.db2.gz	CHTHJTDRGJORAQ-CQSZACIVSA-N	0	3	348.878	3.131	20	30		EGEDHN
CC#CCCNC(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000483419124	459368263	/nfs/dbraw/zinc/36/82/63/459368263.db2.gz	HGBJPICPJMWPET-HKUYNNGSSA-N	0	3	327.472	3.094	20	30		EGEDHN
C=CCCC[C@H](C)NC(=O)CCCN1CCN(c2ccccc2)CC1	ZINC000538331007	459370970	/nfs/dbraw/zinc/37/09/70/459370970.db2.gz	HNKNKCNFQQXEEM-IBGZPJMESA-N	0	3	343.515	3.450	20	30		EGEDHN
C[C@@H](NCC(=O)NCC#N)c1ccc(-c2ccc(Cl)cc2)s1	ZINC000582513456	459376577	/nfs/dbraw/zinc/37/65/77/459376577.db2.gz	FSEGAVSTWOXUFJ-LLVKDONJSA-N	0	3	333.844	3.359	20	30		EGEDHN
C[C@@H]1CCN(CCNC(=O)c2cccc(Nc3ccc(C#N)cc3)c2)C1	ZINC000524720272	459383718	/nfs/dbraw/zinc/38/37/18/459383718.db2.gz	GMSJFNJEGDSBRK-MRXNPFEDSA-N	0	3	348.450	3.373	20	30		EGEDHN
N#Cc1ccc([C@H](NC[C@H]2CCC[C@@H]2c2ccccc2)C(N)=O)cc1	ZINC000569094568	459394696	/nfs/dbraw/zinc/39/46/96/459394696.db2.gz	WBZOAHHWKQFDCE-AQNXPRMDSA-N	0	3	333.435	3.258	20	30		EGEDHN
C=CCN(CCOC)C[C@@H](O)Cn1c2ccccc2c2ccccc21	ZINC000484581622	459421100	/nfs/dbraw/zinc/42/11/00/459421100.db2.gz	HKLDWLLWFQDZGB-QGZVFWFLSA-N	0	3	338.451	3.290	20	30		EGEDHN
N#Cc1ccc(OCCN2CC[C@H](c3ccccc3)[C@H](CO)C2)cc1	ZINC000595746518	459423133	/nfs/dbraw/zinc/42/31/33/459423133.db2.gz	AVQSBSGRSSFPPW-PZJWPPBQSA-N	0	3	336.435	3.035	20	30		EGEDHN
Cc1cccc(C)c1OC[C@H](O)CN[C@H]1CCc2cc(C#N)ccc21	ZINC000591763768	459430277	/nfs/dbraw/zinc/43/02/77/459430277.db2.gz	IFJPTNKSCNDDRC-QUCCMNQESA-N	0	3	336.435	3.192	20	30		EGEDHN
N#Cc1ccc2c(c1)CC[C@H]2NC[C@H](O)COc1cccc2[nH]ccc21	ZINC000591764357	459431130	/nfs/dbraw/zinc/43/11/30/459431130.db2.gz	HBJGSKASJKZYJX-OXJNMPFZSA-N	0	3	347.418	3.056	20	30		EGEDHN
N#Cc1ccc2c(c1)CC[C@H]2NC[C@H](O)COc1ccccc1Cl	ZINC000591764221	459431183	/nfs/dbraw/zinc/43/11/83/459431183.db2.gz	XSZCNFWQTGCNLY-MAUKXSAKSA-N	0	3	342.826	3.228	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CCC=C(c2ccncc2)C1	ZINC000561427690	459452512	/nfs/dbraw/zinc/45/25/12/459452512.db2.gz	XSFKTYJWFLPOBT-IBGZPJMESA-N	0	3	331.419	3.470	20	30		EGEDHN
C[C@H]1CN(C(=O)c2ccc(Cl)c(C#N)c2)CCN(C2CCC2)C1	ZINC000561531549	459462878	/nfs/dbraw/zinc/46/28/78/459462878.db2.gz	BAEQJBDOECYPQR-CYBMUJFWSA-N	0	3	331.847	3.158	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H]2CN(Cc3ccc(C#N)cc3)C[C@H]2C1	ZINC000497215255	459489895	/nfs/dbraw/zinc/48/98/95/459489895.db2.gz	QJHPBNOCVBVYLF-MSOLQXFVSA-N	0	3	341.455	3.247	20	30		EGEDHN
N#CC1(NC(=O)CN(CCc2cccc(F)c2)C2CCCC2)CCC1	ZINC000525886363	459511981	/nfs/dbraw/zinc/51/19/81/459511981.db2.gz	HTSINYRSCDTQID-UHFFFAOYSA-N	0	3	343.446	3.175	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)COc2cc(C)ccc2Cl)CC1	ZINC000592080262	459520630	/nfs/dbraw/zinc/52/06/30/459520630.db2.gz	VWGHQXGJJXFMCU-UHFFFAOYSA-N	0	3	336.863	3.184	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Cc2ccc(-n3cccc3)cc2)CC1	ZINC000592075646	459521081	/nfs/dbraw/zinc/52/10/81/459521081.db2.gz	RCTCKXCUNACPRD-UHFFFAOYSA-N	0	3	337.467	3.177	20	30		EGEDHN
CCc1nc(C#N)cc(N2C[C@@H](C)N(Cc3ccccc3)C[C@@H]2C)n1	ZINC000596176258	459549148	/nfs/dbraw/zinc/54/91/48/459549148.db2.gz	BWCUSRAXNHEZOQ-CVEARBPZSA-N	0	3	335.455	3.010	20	30		EGEDHN
C[C@@H](Nc1nc(C#N)c(Cl)s1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000596185939	459553039	/nfs/dbraw/zinc/55/30/39/459553039.db2.gz	HLRWLTDIFOPOAQ-OCCSQVGLSA-N	0	3	346.887	3.413	20	30		EGEDHN
C[C@H]([C@@H](C)c1ccc(Cl)cc1)N(C)CC(=O)NC1(C#N)CCC1	ZINC000526135422	459554237	/nfs/dbraw/zinc/55/42/37/459554237.db2.gz	BYYIYKHWGJXOIA-ZIAGYGMSSA-N	0	3	333.863	3.326	20	30		EGEDHN
CCN(CC(=O)NC1(C#N)CCC1)[C@@H](Cc1ccc(F)cc1)C(C)C	ZINC000526291195	459555481	/nfs/dbraw/zinc/55/54/81/459555481.db2.gz	PVACPWFTEHJFNT-SFHVURJKSA-N	0	3	345.462	3.277	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)CN(C)[C@H]1CC[C@@H](C(F)(F)F)CC1	ZINC000570431083	459556939	/nfs/dbraw/zinc/55/69/39/459556939.db2.gz	TYUVZHKSYYXIKN-GUTXKFCHSA-N	0	3	333.398	3.094	20	30		EGEDHN
C[C@@]1(NC(=O)c2cccc(CC#N)c2)CCN(Cc2ccccc2)C1	ZINC000570519222	459557537	/nfs/dbraw/zinc/55/75/37/459557537.db2.gz	QYTWZDBMOYMIDJ-OAQYLSRUSA-N	0	3	333.435	3.147	20	30		EGEDHN
C=C[C@@H]1CCCCN1CCC(=O)Nc1ccc(N2CCCC2=O)cc1	ZINC000489433600	459563659	/nfs/dbraw/zinc/56/36/59/459563659.db2.gz	SAPFWGABPVSWFB-QGZVFWFLSA-N	0	3	341.455	3.183	20	30		EGEDHN
N#C[C@H]1CC[C@H](NCCNc2ncc(C(F)(F)F)cc2Cl)C1	ZINC000571743665	459572231	/nfs/dbraw/zinc/57/22/31/459572231.db2.gz	BOBUOVBECLIFAG-ONGXEEELSA-N	0	3	332.757	3.448	20	30		EGEDHN
CC(=O)Nc1ccc(C(=O)C(C#N)c2nc3ccccc3[nH]2)cc1F	ZINC000562497021	459573004	/nfs/dbraw/zinc/57/30/04/459573004.db2.gz	WHDAUAOHVURCCZ-LBPRGKRZSA-N	0	3	336.326	3.150	20	30		EGEDHN
C=CCN1CCC(NC(=O)CCCCCc2ccc(O)cc2)CC1	ZINC000592313351	459573236	/nfs/dbraw/zinc/57/32/36/459573236.db2.gz	FECVBAACDSEYOY-UHFFFAOYSA-N	0	3	330.472	3.262	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N1CCC(c2c[nH]c3cc(F)ccc32)CC1	ZINC000572537133	459581027	/nfs/dbraw/zinc/58/10/27/459581027.db2.gz	ZKZUXQVXKVCXSZ-QGZVFWFLSA-N	0	3	342.418	3.034	20	30		EGEDHN
Cc1cccc(OC[C@@H](O)CN[C@H]2CCCc3cc(C#N)ccc32)c1	ZINC000572865824	459587326	/nfs/dbraw/zinc/58/73/26/459587326.db2.gz	FCJJLWWMVVGOQA-RXVVDRJESA-N	0	3	336.435	3.274	20	30		EGEDHN
N#CC(C(=O)c1cc2ccccc2n1CC(F)(F)F)c1ccncn1	ZINC000490936884	459591241	/nfs/dbraw/zinc/59/12/41/459591241.db2.gz	JPRCXHBYKSGOLJ-GFCCVEGCSA-N	0	3	344.296	3.484	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H](c2cccc(C)c2)C(F)(F)F)CC1	ZINC000490933628	459591442	/nfs/dbraw/zinc/59/14/42/459591442.db2.gz	FJXCCPZYPXAOMR-MRXNPFEDSA-N	0	3	338.373	3.060	20	30		EGEDHN
C#CCN1CCC(C(=O)NC(C)(C)c2cc(Cl)ccc2OC)CC1	ZINC000491485982	459630928	/nfs/dbraw/zinc/63/09/28/459630928.db2.gz	RVXPSKWYRHBSQU-UHFFFAOYSA-N	0	3	348.874	3.045	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC[C@@H](SC)C(C)(C)C)CC1	ZINC000543184264	459632165	/nfs/dbraw/zinc/63/21/65/459632165.db2.gz	KFCXXCAJCFHUCT-OAHLLOKOSA-N	0	3	327.538	3.104	20	30		EGEDHN
N#Cc1ccc(CN(C(=O)Nc2cccc3c2CCNC3)C2CC2)cc1	ZINC000562767758	459642521	/nfs/dbraw/zinc/64/25/21/459642521.db2.gz	NXVHQLULTBGKBH-UHFFFAOYSA-N	0	3	346.434	3.400	20	30		EGEDHN
C=CCN1CC[C@H](N2CC[C@H](Cc3ccc(C(C)C)cc3)C2)C1=O	ZINC000499635570	459643267	/nfs/dbraw/zinc/64/32/67/459643267.db2.gz	YCFHQAGFCIFFDU-QUCCMNQESA-N	0	3	326.484	3.461	20	30		EGEDHN
C=CCN1CC[C@@H](N2CCC(C)(c3ccc(Cl)cc3)CC2)C1=O	ZINC000499771766	459651124	/nfs/dbraw/zinc/65/11/24/459651124.db2.gz	IYWLNLGUAXTRQK-QGZVFWFLSA-N	0	3	332.875	3.480	20	30		EGEDHN
CN(C)C/C=C/C(=O)Nc1ccccc1COc1ccc(CC#N)cc1	ZINC000491875480	459683718	/nfs/dbraw/zinc/68/37/18/459683718.db2.gz	YSHOLTLCXSIKBN-VMPITWQZSA-N	0	3	349.434	3.388	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N1CCC(CC#N)CC1)C(C)C	ZINC000543822046	459703624	/nfs/dbraw/zinc/70/36/24/459703624.db2.gz	JMRAYNGXTYBPCW-SFHVURJKSA-N	0	3	332.492	3.020	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CCC(CC#N)CC1)C(C)C	ZINC000543822042	459704245	/nfs/dbraw/zinc/70/42/45/459704245.db2.gz	JMRAYNGXTYBPCW-GOSISDBHSA-N	0	3	332.492	3.020	20	30		EGEDHN
Cc1ccc(C(=O)C(C#N)c2nc3cc(F)ccc3s2)c(=O)[nH]1	ZINC000592973622	459726048	/nfs/dbraw/zinc/72/60/48/459726048.db2.gz	CKSDHCQHXFLAMY-LLVKDONJSA-N	0	3	327.340	3.335	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cc(C)n(C(C)(C)C)n1)C(C)C	ZINC000493095943	459733441	/nfs/dbraw/zinc/73/34/41/459733441.db2.gz	HSXVNZLYYHWKAG-GOSISDBHSA-N	0	3	346.519	3.375	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)/C=C/C1CCCC1	ZINC000493424818	459744604	/nfs/dbraw/zinc/74/46/04/459744604.db2.gz	SIWHHGWYWVLBJH-ZHACJKMWSA-N	0	3	325.456	3.195	20	30		EGEDHN
C[C@H](C(=O)N(C)CCC#N)N1CCC2(CCc3ccccc3C2)CC1	ZINC000593038498	459751071	/nfs/dbraw/zinc/75/10/71/459751071.db2.gz	YZWNSMVIACGLAO-QGZVFWFLSA-N	0	3	339.483	3.018	20	30		EGEDHN
CCCN1CC[C@@H](NC(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)C1	ZINC000596777997	459760536	/nfs/dbraw/zinc/76/05/36/459760536.db2.gz	UWSDDKSCQPQYEB-CYBMUJFWSA-N	0	3	340.349	3.183	20	30		EGEDHN
N#Cc1cc(F)ccc1NC(=O)C(C[C@@H]1CCCO1)C(F)(F)F	ZINC000593083878	459767648	/nfs/dbraw/zinc/76/76/48/459767648.db2.gz	CQZWBLFVQQTFBV-RYUDHWBXSA-N	0	3	330.281	3.383	20	30		EGEDHN
Cc1ccc(CN2CC[C@@H](CN(C)C(=O)C3(C#N)CCCC3)C2)s1	ZINC000564059313	459770364	/nfs/dbraw/zinc/77/03/64/459770364.db2.gz	HGVZJAFGMSBHRO-INIZCTEOSA-N	0	3	345.512	3.421	20	30		EGEDHN
CN(C(=O)C(C[C@H]1CCCO1)C(F)(F)F)c1ccccc1C#N	ZINC000593095902	459771918	/nfs/dbraw/zinc/77/19/18/459771918.db2.gz	IUSOWFMTQMAIRR-CHWSQXEVSA-N	0	3	326.318	3.269	20	30		EGEDHN
Cc1cccc(C)c1[C@@H](C)NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000564494391	459774390	/nfs/dbraw/zinc/77/43/90/459774390.db2.gz	FBKNGXPDBPDQIU-IEBWSBKVSA-N	0	3	338.451	3.460	20	30		EGEDHN
C[C@@H]1CCC[C@@](C#N)(NC(=O)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000565186303	459782217	/nfs/dbraw/zinc/78/22/17/459782217.db2.gz	UPWTYVFSKALABR-YVWKXTFCSA-N	0	3	325.456	3.097	20	30		EGEDHN
C[C@@H](NC[C@H](O)CN(C)CCC#N)c1ccc(Cl)c2ccccc21	ZINC000565300103	459783276	/nfs/dbraw/zinc/78/32/76/459783276.db2.gz	TWWOJXHJLZPDBP-CABCVRRESA-N	0	3	345.874	3.350	20	30		EGEDHN
CCC(C#N)(CC)c1nc(-c2ccc(OCCN(C)C)cc2)no1	ZINC000528100356	459798630	/nfs/dbraw/zinc/79/86/30/459798630.db2.gz	YQZZOMPIEDIRRH-UHFFFAOYSA-N	0	3	328.416	3.258	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)s1	ZINC000566118422	459809817	/nfs/dbraw/zinc/80/98/17/459809817.db2.gz	BRKOGFLWFQRRFB-ZDUSSCGKSA-N	0	3	340.370	3.332	20	30		EGEDHN
C[C@@H]1C[C@H](c2ccccc2)CCN1Cc1cnc2c(C#N)cnn2c1	ZINC000584840282	459811966	/nfs/dbraw/zinc/81/19/66/459811966.db2.gz	VFIVEMQJGWHWKA-CRAIPNDOSA-N	0	3	331.423	3.369	20	30		EGEDHN
CC[C@@H](c1nnc(NC(=O)[C@@H](N)CCCC#N)s1)c1ccccc1	ZINC000566179247	459820040	/nfs/dbraw/zinc/82/00/40/459820040.db2.gz	IWXBWEBHSZKNSS-KGLIPLIRSA-N	0	3	343.456	3.040	20	30		EGEDHN
CN(Cc1cn(CCC#N)nc1-c1ccccc1)CC1=CCCOC1	ZINC000597205764	459876867	/nfs/dbraw/zinc/87/68/67/459876867.db2.gz	IJBAQKRDBOXSMV-UHFFFAOYSA-N	0	3	336.439	3.242	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CCc2nc(C3CC3)ncc2C1	ZINC000529925809	459879916	/nfs/dbraw/zinc/87/99/16/459879916.db2.gz	MTFOVJAUAKBHMK-QGZVFWFLSA-N	0	3	346.434	3.011	20	30		EGEDHN
C[C@H](CNC(=O)c1cc2ccccc2n1CC#N)N1CCC[C@@H](C)C1	ZINC000609163464	459916410	/nfs/dbraw/zinc/91/64/10/459916410.db2.gz	MHDJDQYDKCRCEK-HZPDHXFCSA-N	0	3	338.455	3.015	20	30		EGEDHN
C[C@H](C#N)CN(C)C(=O)c1ccccc1OCCN1CCCC[C@H]1C	ZINC000609201097	459923171	/nfs/dbraw/zinc/92/31/71/459923171.db2.gz	MQKVDGADGBFIIM-IAGOWNOFSA-N	0	3	343.471	3.171	20	30		EGEDHN
C[C@@H](C#N)CN(C)C(=O)c1ccccc1OCCN1CCCC[C@H]1C	ZINC000609201094	459923380	/nfs/dbraw/zinc/92/33/80/459923380.db2.gz	MQKVDGADGBFIIM-DLBZAZTESA-N	0	3	343.471	3.171	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN2CCCO[C@H](c3ccccc3)C2)c1	ZINC000609233350	459928923	/nfs/dbraw/zinc/92/89/23/459928923.db2.gz	DJQAZTVYRDWJPI-FQEVSTJZSA-N	0	3	349.434	3.350	20	30		EGEDHN
COc1ccc(CN(C)C[C@H](O)CC(C)(C)C#N)cc1OC(F)F	ZINC000598585365	459954334	/nfs/dbraw/zinc/95/43/34/459954334.db2.gz	BIHXZPCYACIMQQ-CYBMUJFWSA-N	0	3	342.386	3.029	20	30		EGEDHN
CC(C)C1CCC(N2CCN(C[C@H](O)CC(C)(C)C#N)CC2)CC1	ZINC000598593093	459955805	/nfs/dbraw/zinc/95/58/05/459955805.db2.gz	PNTSTSMAZPTZIP-CTWPCTMYSA-N	0	3	335.536	3.120	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN1CCC(OCc2ccc(F)cc2)CC1	ZINC000598599947	459959020	/nfs/dbraw/zinc/95/90/20/459959020.db2.gz	LNRLSETTZVQSQL-QGZVFWFLSA-N	0	3	334.435	3.107	20	30		EGEDHN
CN(Cc1ccc(Br)c(F)c1)C[C@H](O)CC(C)(C)C#N	ZINC000598609823	459962936	/nfs/dbraw/zinc/96/29/36/459962936.db2.gz	KLEVNBAMGXIZDV-GFCCVEGCSA-N	0	3	343.240	3.321	20	30		EGEDHN
Cc1cc(CN2CCSCC2)ccc1NCc1cccc(C#N)n1	ZINC000602492207	459966670	/nfs/dbraw/zinc/96/66/70/459966670.db2.gz	VHPVLUJGHWSYAA-UHFFFAOYSA-N	0	3	338.480	3.423	20	30		EGEDHN
CC(C)N1CCN(c2cccc(NCc3cccc(C#N)n3)c2)CC1	ZINC000602492076	459966686	/nfs/dbraw/zinc/96/66/86/459966686.db2.gz	LPVUTBOEMJMCMW-UHFFFAOYSA-N	0	3	335.455	3.096	20	30		EGEDHN
CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)CCCCCC#N	ZINC000588751339	459977158	/nfs/dbraw/zinc/97/71/58/459977158.db2.gz	UNBMNGFZJOZEGB-LJQANCHMSA-N	0	3	342.487	3.369	20	30		EGEDHN
COc1cc(Br)c(CNC[C@H](C)CCC#N)cc1OC	ZINC000602542957	459990196	/nfs/dbraw/zinc/99/01/96/459990196.db2.gz	BTCQEARYDNVKNX-LLVKDONJSA-N	0	3	341.249	3.496	20	30		EGEDHN
N#Cc1cccc(CNCC2(c3ccc(Cl)cc3)CCOCC2)n1	ZINC000602520169	459980015	/nfs/dbraw/zinc/98/00/15/459980015.db2.gz	GCENKRBTGQXZFP-UHFFFAOYSA-N	0	3	341.842	3.445	20	30		EGEDHN
C[C@@H](Cc1cccc(Br)c1)NCc1cccc(C#N)n1	ZINC000602520770	459982037	/nfs/dbraw/zinc/98/20/37/459982037.db2.gz	JEXXIJQAXHSHBG-LBPRGKRZSA-N	0	3	330.229	3.437	20	30		EGEDHN
CC1(C)[C@@H](c2cccc(F)c2)CCN1C(=O)[C@@H](N)CCCCC#N	ZINC000602552333	459994301	/nfs/dbraw/zinc/99/43/01/459994301.db2.gz	OKNFPEJYSDEXAJ-SJORKVTESA-N	0	3	331.435	3.331	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CNCc1ccc(Oc2ccccc2)nc1	ZINC000598721135	460006607	/nfs/dbraw/zinc/00/66/07/460006607.db2.gz	STXBDTANHYMQAJ-MRXNPFEDSA-N	0	3	325.412	3.264	20	30		EGEDHN
C[C@H](CCC#N)CN[C@H](CCO)c1ccccc1Br	ZINC000602596092	460015474	/nfs/dbraw/zinc/01/54/74/460015474.db2.gz	GMZDIPKNGZBNIW-IUODEOHRSA-N	0	3	325.250	3.402	20	30		EGEDHN
C[C@@H](CCC#N)CN[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000602616370	460025045	/nfs/dbraw/zinc/02/50/45/460025045.db2.gz	NAJRYSDCEOHJAA-GXTWGEPZSA-N	0	3	339.361	3.340	20	30		EGEDHN
CCOC(=O)C[C@@H](c1ccccc1)C1CCN(C(=O)C(C)C#N)CC1	ZINC000609920249	460039882	/nfs/dbraw/zinc/03/98/82/460039882.db2.gz	WOYJHCISLFXILL-YJBOKZPZSA-N	0	3	342.439	3.122	20	30		EGEDHN
CCOC(=O)C[C@H](c1ccccc1)C1CCN(C(=O)C(C)C#N)CC1	ZINC000609920247	460040153	/nfs/dbraw/zinc/04/01/53/460040153.db2.gz	WOYJHCISLFXILL-MAUKXSAKSA-N	0	3	342.439	3.122	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)C(=O)N(CCN(C)C)C1CCCC1	ZINC000593988799	460042623	/nfs/dbraw/zinc/04/26/23/460042623.db2.gz	HCMHQNCAYAXDJK-MRXNPFEDSA-N	0	3	327.472	3.070	20	30		EGEDHN
COc1cc(CNC[C@H](C)CCC#N)c(Br)cc1O	ZINC000602702388	460074227	/nfs/dbraw/zinc/07/42/27/460074227.db2.gz	KRYOSOPQGKURMZ-SNVBAGLBSA-N	0	3	327.222	3.193	20	30		EGEDHN
N#Cc1cccc(CN[C@]2(Cc3ccc(Cl)cc3)CCCOC2)n1	ZINC000602709893	460077613	/nfs/dbraw/zinc/07/76/13/460077613.db2.gz	JLOOOQHKYKEFCZ-IBGZPJMESA-N	0	3	341.842	3.488	20	30		EGEDHN
COc1cccc2c1OCC[C@H]2N[C@H](C)CC1(C#N)CCOCC1	ZINC000602712970	460080535	/nfs/dbraw/zinc/08/05/35/460080535.db2.gz	XBHIMFGQNGWXAW-GDBMZVCRSA-N	0	3	330.428	3.207	20	30		EGEDHN
N#Cc1cccc(CN[C@H]2CCN(c3ccc(Cl)cc3F)C2)n1	ZINC000602723363	460085491	/nfs/dbraw/zinc/08/54/91/460085491.db2.gz	FNVDSBPKMVQRKK-HNNXBMFYSA-N	0	3	330.794	3.114	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)C(=O)NCc1cccc(CN(C)C)c1	ZINC000594220726	460158343	/nfs/dbraw/zinc/15/83/43/460158343.db2.gz	YINSRUCHOAAWMW-INIZCTEOSA-N	0	3	335.451	3.115	20	30		EGEDHN
CCC(C)(C)N1CCN(C(=O)N[C@@H](C)c2cccc(C#N)c2)CC1	ZINC000594227377	460161340	/nfs/dbraw/zinc/16/13/40/460161340.db2.gz	NGXDFJBSZJGPSH-HNNXBMFYSA-N	0	3	328.460	3.135	20	30		EGEDHN
N#Cc1ccc(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)s1	ZINC000610520759	460174281	/nfs/dbraw/zinc/17/42/81/460174281.db2.gz	IIAYPBMRAPWLQZ-MRXNPFEDSA-N	0	3	339.464	3.262	20	30		EGEDHN
CN(CCc1ccccc1)[C@H]1CCN(C(=O)c2cc(C#N)cs2)C1	ZINC000598194378	460199944	/nfs/dbraw/zinc/19/99/44/460199944.db2.gz	GMBKOPJBCZOJRL-KRWDZBQOSA-N	0	3	339.464	3.009	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)C[C@H](O)COc1ccccc1C#N	ZINC000599264292	460210088	/nfs/dbraw/zinc/21/00/88/460210088.db2.gz	RXJIYAMWEMGDSO-FQEVSTJZSA-N	0	3	349.434	3.082	20	30		EGEDHN
N#CCCCC[C@H](N)C(=O)NCC1(c2ccccc2)CCCCC1	ZINC000594426825	460215873	/nfs/dbraw/zinc/21/58/73/460215873.db2.gz	FNTOHBDMYYIMHA-SFHVURJKSA-N	0	3	327.472	3.416	20	30		EGEDHN
CC(C)CCN1Cc2cccc(NC(=O)[C@@H](N)CCCCC#N)c2C1	ZINC000594437219	460219640	/nfs/dbraw/zinc/21/96/40/460219640.db2.gz	JHAPSPPYHYTKQV-SFHVURJKSA-N	0	3	342.487	3.398	20	30		EGEDHN
CC[C@@H](NC[C@H](O)COc1ccccc1C#N)c1ccc(OC)cc1	ZINC000599344213	460233151	/nfs/dbraw/zinc/23/31/51/460233151.db2.gz	AOGCRPYZEJJEAW-PKOBYXMFSA-N	0	3	340.423	3.047	20	30		EGEDHN
N#CCN1CCC(NCc2ccc(Cl)cc2Br)CC1	ZINC000610898846	460258426	/nfs/dbraw/zinc/25/84/26/460258426.db2.gz	KNSBMTWHUNZXTL-UHFFFAOYSA-N	0	3	342.668	3.180	20	30		EGEDHN
Cc1nc([C@@H](C)NC2CCN(c3ccc(C#N)cn3)CC2)c(C)s1	ZINC000610946383	460263777	/nfs/dbraw/zinc/26/37/77/460263777.db2.gz	NFEULZLKQRMROA-GFCCVEGCSA-N	0	3	341.484	3.346	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Nc1cccc(N)c1C)C(C)C	ZINC000625922020	460304226	/nfs/dbraw/zinc/30/42/26/460304226.db2.gz	HJPHVVZJTVRDGY-GOSISDBHSA-N	0	3	330.476	3.397	20	30		EGEDHN
CC(C)(CCC#N)CN1CCN([C@H](CO)c2ccc(Cl)cc2)CC1	ZINC000611271080	460324108	/nfs/dbraw/zinc/32/41/08/460324108.db2.gz	UXRIYPPFVQZFCC-GOSISDBHSA-N	0	3	349.906	3.321	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2NCCNC(=O)c1ccccc1F	ZINC000611390899	460352247	/nfs/dbraw/zinc/35/22/47/460352247.db2.gz	JUXJEVGRFGRNIZ-LJQANCHMSA-N	0	3	337.398	3.094	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2NCc1ccccc1Cn1cncn1	ZINC000611390726	460353005	/nfs/dbraw/zinc/35/30/05/460353005.db2.gz	QOYSLDFMCGTXJT-OAQYLSRUSA-N	0	3	343.434	3.365	20	30		EGEDHN
C[C@H]1CCc2c(C#N)c(NC(=O)CCN3CC=CCC3)sc2C1	ZINC000611517470	460384425	/nfs/dbraw/zinc/38/44/25/460384425.db2.gz	FWVOVIMKZTZMOD-ZDUSSCGKSA-N	0	3	329.469	3.335	20	30		EGEDHN
Cn1cc(CNCc2ccc(C#N)c(Cl)c2)c(-c2ccncc2)n1	ZINC000619748372	460429242	/nfs/dbraw/zinc/42/92/42/460429242.db2.gz	BZRBYDJZBDEAEL-UHFFFAOYSA-N	0	3	337.814	3.297	20	30		EGEDHN
C[C@H](CNC(=O)NCc1ccc(C#N)c(Cl)c1)N1CCC[C@@H](C)C1	ZINC000619757461	460433581	/nfs/dbraw/zinc/43/35/81/460433581.db2.gz	BQKQULGFUJOZDG-ZIAGYGMSSA-N	0	3	348.878	3.131	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCc2ccc(C#N)c(Cl)c2)cc1	ZINC000619764707	460436710	/nfs/dbraw/zinc/43/67/10/460436710.db2.gz	FSADJEDQRHIJQL-QGZVFWFLSA-N	0	3	348.793	3.082	20	30		EGEDHN
CN(C)Cc1cccc(C(=O)NCc2ccc(C#N)c(Cl)c2)c1	ZINC000619780289	460441727	/nfs/dbraw/zinc/44/17/27/460441727.db2.gz	JZPLAVRDUBLLQZ-UHFFFAOYSA-N	0	3	327.815	3.203	20	30		EGEDHN
C=CCOc1c(Cl)cc(CNC[C@@](C)(O)C2CC2)cc1OC	ZINC000623415347	460536871	/nfs/dbraw/zinc/53/68/71/460536871.db2.gz	IVOREFQXPGRGIP-QGZVFWFLSA-N	0	3	325.836	3.164	20	30		EGEDHN
C[C@]1(C#N)CCCN(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)C1	ZINC000612099458	460540181	/nfs/dbraw/zinc/54/01/81/460540181.db2.gz	XAGOUZHWKOITHC-AZUAARDMSA-N	0	3	340.471	3.159	20	30		EGEDHN
CC(C)(C)[C@@](C)(C#N)NC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000613365872	460922975	/nfs/dbraw/zinc/92/29/75/460922975.db2.gz	DGIPYYNFEMUWJU-HXUWFJFHSA-N	0	3	327.472	3.343	20	30		EGEDHN
C=CC[C@H]1CCCN(Cc2cnn3cc(Br)cnc23)C1	ZINC000639308228	461854879	/nfs/dbraw/zinc/85/48/79/461854879.db2.gz	DFDJJUIUSVKJIX-LBPRGKRZSA-N	0	3	335.249	3.280	20	30		EGEDHN
C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H]1CCN(CCC)C1	ZINC000666922221	461870924	/nfs/dbraw/zinc/87/09/24/461870924.db2.gz	MJHFSYBDZKEDHW-SFHVURJKSA-N	0	3	347.507	3.036	20	30		EGEDHN
C=CC[C@H]1CCCN(C(=O)NCC2CCN(c3ccncc3)CC2)C1	ZINC000664578058	462113214	/nfs/dbraw/zinc/11/32/14/462113214.db2.gz	WDVHFVZAYGHYFH-SFHVURJKSA-N	0	3	342.487	3.296	20	30		EGEDHN
C=CC[C@H]1CCCN(CC(=O)N(C)Cc2ccc(OC)c(F)c2)C1	ZINC000661376375	462223801	/nfs/dbraw/zinc/22/38/01/462223801.db2.gz	BGOUOLOFHFZFDY-HNNXBMFYSA-N	0	3	334.435	3.081	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)N[C@@H]2CCCN3CCCC[C@H]23)cc1	ZINC000654561297	462285682	/nfs/dbraw/zinc/28/56/82/462285682.db2.gz	HMFMFJCEEARVCQ-RTBURBONSA-N	0	3	343.471	3.068	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)N[C@@H]1CCCN2CCCC[C@H]12	ZINC000654726624	462355056	/nfs/dbraw/zinc/35/50/56/462355056.db2.gz	XFWWNZYXWVMLIM-IAGOWNOFSA-N	0	3	333.501	3.463	20	30		EGEDHN
C=CCC1(NC(=O)C(=O)Nc2cc(CN(C)C)ccc2C)CCCC1	ZINC000658728324	462513430	/nfs/dbraw/zinc/51/34/30/462513430.db2.gz	PNMGYISGQIDQFD-UHFFFAOYSA-N	0	3	343.471	3.000	20	30		EGEDHN
Cc1nc(NCCCN2CCN(C)C[C@H]2c2ccccc2)ccc1C#N	ZINC000487911324	468059343	/nfs/dbraw/zinc/05/93/43/468059343.db2.gz	PORKBQZAXOJHDJ-FQEVSTJZSA-N	0	3	349.482	3.052	20	30		EGEDHN
CCc1ccc(OCC(=O)C(C#N)c2nc3ccccc3n2C)cc1	ZINC000012564880	524005198	/nfs/dbraw/zinc/00/51/98/524005198.db2.gz	QSTWIYHSTDSFHM-INIZCTEOSA-N	0	3	333.391	3.391	20	30		EGEDHN
C=CCN1CCC(NC(=O)Cc2cccc(C(F)(F)F)c2)CC1	ZINC000171724976	526423345	/nfs/dbraw/zinc/42/33/45/526423345.db2.gz	GRJMCCQNOOMEDR-UHFFFAOYSA-N	0	3	326.362	3.015	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCCOc2ccccc2C(C)C)CC1	ZINC000171907780	526433871	/nfs/dbraw/zinc/43/38/71/526433871.db2.gz	ZFMAPSBTSZEVMM-UHFFFAOYSA-N	0	3	345.487	3.138	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](C)C(C)(C)c2ccccc2)CC1	ZINC000171733594	526436441	/nfs/dbraw/zinc/43/64/41/526436441.db2.gz	GHHROWFANXPDSY-INIZCTEOSA-N	0	3	329.488	3.302	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc3oc(CC)nc3c2)CC1	ZINC000171740980	526442026	/nfs/dbraw/zinc/44/20/26/526442026.db2.gz	KERPYRDLGOCBAP-UHFFFAOYSA-N	0	3	328.416	3.162	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@@H](C)N[C@H](C)c1cccc(-n2cccn2)c1	ZINC000173206555	526538795	/nfs/dbraw/zinc/53/87/95/526538795.db2.gz	SLMHMXCQNIOEFY-IAGOWNOFSA-N	0	3	340.471	3.336	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCC2(c3cccc(F)c3)CC2)CC1	ZINC000154187057	526588075	/nfs/dbraw/zinc/58/80/75/526588075.db2.gz	GZGRZHJCVBCZCP-UHFFFAOYSA-N	0	3	345.462	3.197	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)N[C@@H](C)c1ccc(-n2cccn2)cc1	ZINC000174367802	527635731	/nfs/dbraw/zinc/63/57/31/527635731.db2.gz	MHIJOVGDAQVHRG-IRXDYDNUSA-N	0	3	338.455	3.112	20	30		EGEDHN
C#CCCOc1ccc(CN[C@H](C)[C@@H](O)c2cccc(F)c2)cc1	ZINC000267147990	537702859	/nfs/dbraw/zinc/70/28/59/537702859.db2.gz	BLLVCCCEWHHINF-FOIQADDNSA-N	0	3	327.399	3.440	20	30		EGEDHN
FC(F)(F)c1ccc(C#CCN2CCN(c3ccncc3)CC2)cc1	ZINC000151347398	546854281	/nfs/dbraw/zinc/85/42/81/546854281.db2.gz	GISVWOSIQODLGS-UHFFFAOYSA-N	0	3	345.368	3.274	20	30		EGEDHN
Cc1c(Cl)cccc1C(=O)C(C#N)c1nnc2n1CCCCC2	ZINC000193820060	547215870	/nfs/dbraw/zinc/21/58/70/547215870.db2.gz	PURLTIRFLSCVGY-CYBMUJFWSA-N	0	3	328.803	3.456	20	30		EGEDHN
C[C@H](NC(=O)N[C@@H]1CCN(C2CC2)C1)c1ccc2c(c1)CCC(=O)N2	ZINC000329284572	547494105	/nfs/dbraw/zinc/49/41/05/547494105.db2.gz	GDAQWAYXLOKJNI-SWLSCSKDSA-N	0	3	342.443	3.022	20	30		EGEDHN
C[C@@H]1CC[C@H](C)N1CC(=O)N1CCC(NC(=O)C2CCCCC2)CC1	ZINC000329587328	547501864	/nfs/dbraw/zinc/50/18/64/547501864.db2.gz	RXRKLCAXXMIVDY-IYBDPMFKSA-N	0	3	349.519	3.387	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N(c1ccccc1)C1CCN(C)CC1)OCC	ZINC000677378924	549260173	/nfs/dbraw/zinc/26/01/73/549260173.db2.gz	CTYMWOFZAQLBJD-LJQANCHMSA-N	0	3	330.472	3.485	20	30		EGEDHN
C=C[C@H](CC(=O)N1CCCN(C[C@H]2CCCO2)CC1)c1ccccc1	ZINC000677528387	549286347	/nfs/dbraw/zinc/28/63/47/549286347.db2.gz	VTIBOMAABJWSBQ-UYAOXDASSA-N	0	3	342.483	3.060	20	30		EGEDHN
C=CCCOC(=O)C1CCN(c2ccc(Cl)c(Cl)c2)C1=O	ZINC000729074121	574811023	/nfs/dbraw/zinc/81/10/23/574811023.db2.gz	CIBJZYLPZAABHU-NSHDSACASA-N	0	3	328.195	3.466	20	30		EGEDHN
C=CCSCCNCc1cc2ccccc2nc1N1CCOCC1	ZINC000729683057	574878443	/nfs/dbraw/zinc/87/84/43/574878443.db2.gz	SYFDTXWPKFIJCE-UHFFFAOYSA-N	0	3	343.496	3.080	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](CC)c2ccccc2OC)CC1	ZINC000730116839	574923341	/nfs/dbraw/zinc/92/33/41/574923341.db2.gz	GOTLUZUELWCSQZ-KRWDZBQOSA-N	0	3	331.460	3.096	20	30		EGEDHN
N#Cc1ccc(NC(=S)N2CC[C@@H](N3CCCCC3)C2)cc1Cl	ZINC000730735320	575014257	/nfs/dbraw/zinc/01/42/57/575014257.db2.gz	PXYXEOCJZQGSIY-OAHLLOKOSA-N	0	3	348.903	3.469	20	30		EGEDHN
C[C@H](CNC(=O)OC(C)(C)C)N(C)CCCOc1ccc(C#N)cc1	ZINC000732207629	575244875	/nfs/dbraw/zinc/24/48/75/575244875.db2.gz	XUHGEAUPZNVMGI-OAHLLOKOSA-N	0	3	347.459	3.172	20	30		EGEDHN
C[C@@H]1CCC[C@H](OCC(=O)C(C#N)c2nc3ccccc3n2C)C1	ZINC000733053100	575303748	/nfs/dbraw/zinc/30/37/48/575303748.db2.gz	JEBLJTJZNOMMNI-ILXRZTDVSA-N	0	3	325.412	3.345	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)/C=C\c1cncc(F)c1)C(C)C	ZINC000733162511	575311879	/nfs/dbraw/zinc/31/18/79/575311879.db2.gz	ZPIJQYZANLYVPA-ZEVQVBBLSA-N	0	3	331.435	3.049	20	30		EGEDHN
C#CCCOc1ccc(CNCCN(C)C(=O)OC(C)(C)C)cc1	ZINC000733327331	575328025	/nfs/dbraw/zinc/32/80/25/575328025.db2.gz	SJAQGFFERYWPGY-UHFFFAOYSA-N	0	3	332.444	3.045	20	30		EGEDHN
C=CC[C@@H](NC(=O)NC[C@@H](c1ccccc1)N(C)C)c1ccncc1	ZINC000734652856	575531821	/nfs/dbraw/zinc/53/18/21/575531821.db2.gz	UOHZNALVIVSNNS-MOPGFXCFSA-N	0	3	338.455	3.301	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)[C@@H]3COc4ccccc4C3)nc21	ZINC000735792354	575715014	/nfs/dbraw/zinc/71/50/14/575715014.db2.gz	KVZYWBBNHUPUPK-GJZGRUSLSA-N	0	3	331.375	3.299	20	30		EGEDHN
C#CCCN1CCC(NC(=O)CSc2ccc(Cl)cc2)CC1	ZINC000740735837	576621369	/nfs/dbraw/zinc/62/13/69/576621369.db2.gz	QYXTUUHXNIDRRP-UHFFFAOYSA-N	0	3	336.888	3.036	20	30		EGEDHN
C#CCCN1CCC(NC(=O)COc2ccccc2[C@@H](C)CC)CC1	ZINC000740737454	576621630	/nfs/dbraw/zinc/62/16/30/576621630.db2.gz	NOWDSGJLGNJELW-KRWDZBQOSA-N	0	3	342.483	3.183	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2oc3ccc(F)cc3c2C)CC1	ZINC000740737163	576621649	/nfs/dbraw/zinc/62/16/49/576621649.db2.gz	CCBXTLXMHOXQSC-UHFFFAOYSA-N	0	3	328.387	3.098	20	30		EGEDHN
CCOC(=O)C1(C/[NH+]=C/c2ccc(N(CC)CC)cc2[O-])CCC1	ZINC000740763775	576624170	/nfs/dbraw/zinc/62/41/70/576624170.db2.gz	OXDSVONKNVFBGX-DEDYPNTBSA-N	0	3	332.444	3.391	20	30		EGEDHN
C#CCOc1ccc(C(=O)N2CCN(CC3CCCCC3)CC2)cc1	ZINC000741548025	576699482	/nfs/dbraw/zinc/69/94/82/576699482.db2.gz	INFZEEXLJAENAC-UHFFFAOYSA-N	0	3	340.467	3.037	20	30		EGEDHN
C=CC[C@@H](C)[C@H](C)[NH2+]CCSCc1ccccc1-c1nnn[n-]1	ZINC000819729788	607017532	/nfs/dbraw/zinc/01/75/32/607017532.db2.gz	MTIJERIPVKHGIN-KGLIPLIRSA-N	0	3	331.489	3.290	20	30		EGEDHN
C=CC[C@@H](C)[C@H](C)[NH2+]CCSCc1ccccc1-c1nn[n-]n1	ZINC000819729788	607017533	/nfs/dbraw/zinc/01/75/33/607017533.db2.gz	MTIJERIPVKHGIN-KGLIPLIRSA-N	0	3	331.489	3.290	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@H](C)SCc1ccccc1	ZINC000049252957	1291625220	/nfs/dbraw/zinc/62/52/20/1291625220.db2.gz	NNIHSWOGCGFHOE-GOEBONIOSA-N	0	3	332.469	3.324	20	30		EGEDHN
CC(C)(C)C(=O)NCC(=O)C(C#N)c1nc2cc(Cl)ccc2s1	ZINC000076606961	1292433179	/nfs/dbraw/zinc/43/31/79/1292433179.db2.gz	JDUBZKPHXLUVSY-JTQLQIEISA-N	0	3	349.843	3.288	20	30		EGEDHN
C#CCCOc1ccc(CN2CCC(OCCCOC)CC2)cc1	ZINC000093561477	1292925963	/nfs/dbraw/zinc/92/59/63/1292925963.db2.gz	IZBGBVXUEVHUHF-UHFFFAOYSA-N	0	3	331.456	3.106	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CON=C(N)Cc2ccccc2)c1C	ZINC000108038544	1293074304	/nfs/dbraw/zinc/07/43/04/1293074304.db2.gz	ZMGONTIFNVDUOY-UHFFFAOYSA-N	0	3	325.412	3.005	20	30		EGEDHN
C#CCOc1ccc(CN[C@H]2CCN(C(C)=O)Cc3ccccc32)cc1	ZINC000834893211	1293166422	/nfs/dbraw/zinc/16/64/22/1293166422.db2.gz	UAUIERLJRVKKPR-QFIPXVFZSA-N	0	3	348.446	3.282	20	30		EGEDHN
Cc1ccccc1[C@@H](C)CC(=O)C(C#N)C(=O)NCCCOC(C)C	ZINC000116591931	1293207904	/nfs/dbraw/zinc/20/79/04/1293207904.db2.gz	XPTURKKOQIVGGM-WMZOPIPTSA-N	0	3	344.455	3.129	20	30		EGEDHN
C[C@H](CC(=O)C(C#N)C(=O)NC1CC1)c1ccc(C(F)(F)F)cc1	ZINC000121321733	1293366024	/nfs/dbraw/zinc/36/60/24/1293366024.db2.gz	YRHWUNBYXXYONS-YGRLFVJLSA-N	0	3	338.329	3.186	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)c1ccnc(Cl)c1	ZINC000123430908	1293443957	/nfs/dbraw/zinc/44/39/57/1293443957.db2.gz	UOACRVNHSBFWKM-LBPRGKRZSA-N	0	3	343.770	3.095	20	30		EGEDHN
CCCCSCCC(=O)C(C#N)C(=O)Nc1ccccc1OC	ZINC000124070194	1293466377	/nfs/dbraw/zinc/46/63/77/1293466377.db2.gz	QFPVIDRJCHYQDP-CYBMUJFWSA-N	0	3	334.441	3.266	20	30		EGEDHN
C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)C(C#N)C(=O)N1CCCC1	ZINC000124735942	1293484515	/nfs/dbraw/zinc/48/45/15/1293484515.db2.gz	BPHSFEGCUZQDCH-RHSMWYFYSA-N	0	3	342.439	3.083	20	30		EGEDHN
CC[C@@](C)(CC(=O)OC)NCC#Cc1ccc(OC(F)(F)F)cc1	ZINC000130032932	1293642761	/nfs/dbraw/zinc/64/27/61/1293642761.db2.gz	MYVWKUOFPLOYLA-INIZCTEOSA-N	0	3	343.345	3.258	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)CCc1ccc(F)cc1F	ZINC000152183726	1293957661	/nfs/dbraw/zinc/95/76/61/1293957661.db2.gz	AOQMQKNUBPVKGK-OAHLLOKOSA-N	0	3	336.382	3.303	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H](O)c1ccccc1Br	ZINC000152764752	1293983880	/nfs/dbraw/zinc/98/38/80/1293983880.db2.gz	QFXSCFQGVNVOQU-QGZVFWFLSA-N	0	3	345.240	3.486	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)[C@H](C)c2c(C)noc2C)cc1	ZINC000159769816	1294246299	/nfs/dbraw/zinc/24/62/99/1294246299.db2.gz	GBUMHHIAWKNUQH-BDJLRTHQSA-N	0	3	339.395	3.305	20	30		EGEDHN
C=CCc1cc(OC)cc(CN(C)[C@@H]2CCCc3c2cnn3C)c1O	ZINC000164540680	1294349725	/nfs/dbraw/zinc/34/97/25/1294349725.db2.gz	PSDLUHUGDRUQJA-GOSISDBHSA-N	0	3	341.455	3.372	20	30		EGEDHN
C=CCc1cc(OC)cc(CN(C)[C@H]2CCCc3c2cnn3C)c1O	ZINC000164540799	1294350228	/nfs/dbraw/zinc/35/02/28/1294350228.db2.gz	PSDLUHUGDRUQJA-SFHVURJKSA-N	0	3	341.455	3.372	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)[C@H]2CCCOC2)cc1	ZINC000171036278	1294390863	/nfs/dbraw/zinc/39/08/63/1294390863.db2.gz	NYDSFGYWNAFDNC-RDJZCZTQSA-N	0	3	328.412	3.103	20	30		EGEDHN
Cc1cccc(CN(CCN(C)C)C(=O)/C=C/c2ccccc2C#N)c1	ZINC000171338117	1294403093	/nfs/dbraw/zinc/40/30/93/1294403093.db2.gz	CXJRBPDNMKPULU-VAWYXSNFSA-N	0	3	347.462	3.470	20	30		EGEDHN
COc1ccc(CN(C)CCCOc2ccc(C#N)cc2)cc1O	ZINC000177219605	1294660000	/nfs/dbraw/zinc/66/00/00/1294660000.db2.gz	GQJNJOFVDFHYLK-UHFFFAOYSA-N	0	3	326.396	3.173	20	30		EGEDHN
C#CCOc1ccc(CNCc2cn(C)nc2-c2ccccc2)cc1	ZINC000181823590	1294995104	/nfs/dbraw/zinc/99/51/04/1294995104.db2.gz	KYZCFPAFYIPBKV-UHFFFAOYSA-N	0	3	331.419	3.389	20	30		EGEDHN
Cc1cccc(CO[C@H](C)C(=O)C(C#N)C(=O)Nc2ccccc2)c1	ZINC000870136610	1295694926	/nfs/dbraw/zinc/69/49/26/1295694926.db2.gz	MAVFRSPOIPOOBU-QAPCUYQASA-N	0	3	336.391	3.248	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)CCOc1ccc(C)cc1C	ZINC000193380444	1295859681	/nfs/dbraw/zinc/85/96/81/1295859681.db2.gz	CPAGCOXLVPEOGW-INIZCTEOSA-N	0	3	330.428	3.088	20	30		EGEDHN
N#CC(C(=O)C[C@@H]1CCCO1)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000193467748	1295872653	/nfs/dbraw/zinc/87/26/53/1295872653.db2.gz	KFUSBVHQZPEOIL-QWRGUYRKSA-N	0	3	341.194	3.210	20	30		EGEDHN
C[C@@H]1CC[C@H](CCC(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)O1	ZINC000246539625	1296360187	/nfs/dbraw/zinc/36/01/87/1296360187.db2.gz	JMMUOGWXPCQNQN-DFBGVHRSSA-N	0	3	334.803	3.335	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]\C[C@H](C(C)C)N2CCOCC2)c([O-])c1	ZINC000255449058	1296535647	/nfs/dbraw/zinc/53/56/47/1296535647.db2.gz	CLAJOFZVGMBMJE-BWCLHNGZSA-N	0	3	347.503	3.014	20	30		EGEDHN
Cc1nc(C#N)cc(N2C[C@H](C)N(Cc3ccccc3)[C@H](C)[C@H]2C)n1	ZINC000404416488	1297751997	/nfs/dbraw/zinc/75/19/97/1297751997.db2.gz	GOYXQKLVIHDMDB-ARFHVFGLSA-N	0	3	335.455	3.144	20	30		EGEDHN
CCCC[C@@H](CNC(=O)OC(C)(C)C)NCc1cccc(C#N)n1	ZINC000877158101	1299185036	/nfs/dbraw/zinc/18/50/36/1299185036.db2.gz	DSOPUCMNLVURAQ-HNNXBMFYSA-N	0	3	332.448	3.126	20	30		EGEDHN
CCN1CCN(c2ccc(NC(=O)c3ccc(C#N)s3)cc2)CC1	ZINC000749318951	1299191849	/nfs/dbraw/zinc/19/18/49/1299191849.db2.gz	TXWSMQMOLPXWIE-UHFFFAOYSA-N	0	3	340.452	3.014	20	30		EGEDHN
C=CCNC(=S)N(CCC)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000751022786	1299499412	/nfs/dbraw/zinc/49/94/12/1299499412.db2.gz	AQZHETFUQDCZCP-SFHVURJKSA-N	0	3	331.529	3.424	20	30		EGEDHN
C[C@@H]([NH2+]Cc1cn(CCC#N)nc1-c1ccncc1)c1ccccc1[O-]	ZINC000877755927	1299532337	/nfs/dbraw/zinc/53/23/37/1299532337.db2.gz	TUEVYHPYZMXSJG-OAHLLOKOSA-N	0	3	347.422	3.415	20	30		EGEDHN
CCc1ccc([C@H](CN2CCOCC2)NCc2ccc(C#N)cc2)cc1	ZINC000753619731	1299993265	/nfs/dbraw/zinc/99/32/65/1299993265.db2.gz	QZXGSCCOEGLKBV-QFIPXVFZSA-N	0	3	349.478	3.284	20	30		EGEDHN
C[C@@H]1CC(N=Nc2ncnc3sc4c(c32)CCC4)CN1C1CC1	ZINC000753955642	1300053544	/nfs/dbraw/zinc/05/35/44/1300053544.db2.gz	RUEUWBXZWKHDFY-SNVBAGLBSA-N	0	3	327.457	3.205	20	30		EGEDHN
CC(=O)[C@](C#N)(CCN1CCC[C@@H]1[C@H]1CCCO1)c1ccccc1	ZINC000878573380	1300086743	/nfs/dbraw/zinc/08/67/43/1300086743.db2.gz	SPMBWJJAWYRAPF-VAMGGRTRSA-N	0	3	326.440	3.070	20	30		EGEDHN
CCOC1CC2(C1)CCN(CC[C@](C#N)(C(C)=O)c1ccccc1)C2	ZINC000878611916	1300106527	/nfs/dbraw/zinc/10/65/27/1300106527.db2.gz	XHWCBYXZJIZVIU-CBNMVNINSA-N	0	3	340.467	3.318	20	30		EGEDHN
C#CCOc1ccc(CN[C@@H](C)c2ccc([S@](C)=O)cc2)cc1	ZINC000756033361	1300429634	/nfs/dbraw/zinc/42/96/34/1300429634.db2.gz	LJEXJJJRTREEEL-WNSKOXEYSA-N	0	3	327.449	3.287	20	30		EGEDHN
C#CC[C@@H](NC(=O)N1CCN(C2CCCCC2)CC1)c1ccccc1	ZINC000757766651	1300726376	/nfs/dbraw/zinc/72/63/76/1300726376.db2.gz	CGFRYUVZFFAGNU-HXUWFJFHSA-N	0	3	339.483	3.411	20	30		EGEDHN
COC(=O)C12CCC(C(=O)C(C#N)c3nc4ccccc4o3)(CC1)C2	ZINC000759439758	1301092883	/nfs/dbraw/zinc/09/28/83/1301092883.db2.gz	BJDQIAJPRJLSQC-PIHIASKNSA-N	0	3	338.363	3.128	20	30		EGEDHN
CSc1ccc([C@H](CNc2cc(C#N)nc(C)n2)N(C)C)cc1	ZINC000882403733	1301950756	/nfs/dbraw/zinc/95/07/56/1301950756.db2.gz	AVVDMTQKRIRQFG-INIZCTEOSA-N	0	3	327.457	3.093	20	30		EGEDHN
CC#CC(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1	ZINC000764456800	1302066059	/nfs/dbraw/zinc/06/60/59/1302066059.db2.gz	JZFRGMAUYAAJOM-UHFFFAOYSA-N	0	3	339.266	3.441	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2NCc1ccc(N2CCNC2=O)cc1	ZINC000883286405	1302363774	/nfs/dbraw/zinc/36/37/74/1302363774.db2.gz	RNFUJJHOCRICFK-FQEVSTJZSA-N	0	3	346.434	3.255	20	30		EGEDHN
C[C@@H]1CCN(Cc2cc(=O)n3c4ccccc4[nH]c3c2C#N)C[C@@H]1C	ZINC000766984520	1302557948	/nfs/dbraw/zinc/55/79/48/1302557948.db2.gz	MKTZYSMFKCAOFF-YCPHGPKFSA-N	0	3	334.423	3.202	20	30		EGEDHN
CSC[C@H]1CCCN1CC(=O)C(C#N)c1nc2ccccc2s1	ZINC000767905501	1302781843	/nfs/dbraw/zinc/78/18/43/1302781843.db2.gz	HJXKHEDSDRKHDU-OLZOCXBDSA-N	0	3	345.493	3.300	20	30		EGEDHN
C=C(C)CN(CC)Cc1cc2ccccc2nc1N1CCOCC1	ZINC000768140766	1302833238	/nfs/dbraw/zinc/83/32/38/1302833238.db2.gz	VWTBPTFDXKQJPD-UHFFFAOYSA-N	0	3	325.456	3.469	20	30		EGEDHN
N#CC(C(=O)Cc1ccco1)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000772639706	1303557187	/nfs/dbraw/zinc/55/71/87/1303557187.db2.gz	KBXVMMRYBMIFGF-ZDUSSCGKSA-N	0	3	337.162	3.476	20	30		EGEDHN
CCN1CCN(c2ccc(NCc3ccc(C#N)cc3F)cc2)CC1	ZINC000772919677	1303595503	/nfs/dbraw/zinc/59/55/03/1303595503.db2.gz	WFKRIVYUPIHSLG-UHFFFAOYSA-N	0	3	338.430	3.451	20	30		EGEDHN
CC[C@H](C)[C@H](NCCC(C#N)(c1ccccc1)c1ccccc1)C(N)=O	ZINC000887057489	1303661238	/nfs/dbraw/zinc/66/12/38/1303661238.db2.gz	IBYIZNVAGSNNNV-PXNSSMCTSA-N	0	3	349.478	3.376	20	30		EGEDHN
COC(=O)Cc1ccccc1CN[C@@H](C)c1ccc(OCC#N)cc1	ZINC000775336360	1303941957	/nfs/dbraw/zinc/94/19/57/1303941957.db2.gz	IAFCCOASSLVYPY-HNNXBMFYSA-N	0	3	338.407	3.155	20	30		EGEDHN
C#C[C@H](N[C@H](C)CC(=O)Nc1cc(Cl)ccc1C)[C@@H]1CCCO1	ZINC000775574359	1303988286	/nfs/dbraw/zinc/98/82/86/1303988286.db2.gz	PHNWIRIYBSIMRX-KMFMINBZSA-N	0	3	334.847	3.136	20	30		EGEDHN
C[C@H](N[C@@H]1CCN(C2CCCCC2)C1=O)c1ccc(OCC#N)cc1	ZINC000776168318	1304106291	/nfs/dbraw/zinc/10/62/91/1304106291.db2.gz	IOQRXLQUZBQFSF-HNAYVOBHSA-N	0	3	341.455	3.173	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N1CCC[C@H](C(=O)Nc2ccccn2)C1	ZINC000777711813	1304337760	/nfs/dbraw/zinc/33/77/60/1304337760.db2.gz	XYDGJOCIMJEIOU-QAPCUYQASA-N	0	3	334.423	3.365	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CN1CCC[C@H](c2n[nH]c(C)n2)C1	ZINC000779164892	1304537077	/nfs/dbraw/zinc/53/70/77/1304537077.db2.gz	VAQYPAPYYDNLPC-AWEZNQCLSA-N	0	3	344.846	3.158	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CN1CCC[C@H](c2nc(C)n[nH]2)C1	ZINC000779164892	1304537081	/nfs/dbraw/zinc/53/70/81/1304537081.db2.gz	VAQYPAPYYDNLPC-AWEZNQCLSA-N	0	3	344.846	3.158	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CN1CCC[C@H](c2nnc(C)[nH]2)C1	ZINC000779164892	1304537083	/nfs/dbraw/zinc/53/70/83/1304537083.db2.gz	VAQYPAPYYDNLPC-AWEZNQCLSA-N	0	3	344.846	3.158	20	30		EGEDHN
C#CCN(Cc1ccc(OCC(=O)OC)cc1)[C@@H]1CCc2ccccc21	ZINC000783370837	1305083890	/nfs/dbraw/zinc/08/38/90/1305083890.db2.gz	COLGFBPDCAAZGR-OAQYLSRUSA-N	0	3	349.430	3.361	20	30		EGEDHN
CC(=O)N(CC(=O)C(C#N)c1nc(C(C)C)cs1)c1ccccc1	ZINC000892803932	1305559255	/nfs/dbraw/zinc/55/92/55/1305559255.db2.gz	XCTJCWGISWTIGF-HNNXBMFYSA-N	0	3	341.436	3.496	20	30		EGEDHN
N#CC(C(=O)CCC(F)(F)F)C(=O)NCc1cccc(Cl)c1	ZINC000786538727	1305592863	/nfs/dbraw/zinc/59/28/63/1305592863.db2.gz	OMSDXDRECAFHJU-LLVKDONJSA-N	0	3	332.709	3.008	20	30		EGEDHN
CCO[C@H](CC(=O)C(C#N)C(=O)N[C@H](CC)c1ccccc1)C(C)C	ZINC000787036593	1305680072	/nfs/dbraw/zinc/68/00/72/1305680072.db2.gz	PAPHBDDZPJBRHL-ZHALLVOQSA-N	0	3	344.455	3.414	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)[C@@H]1CCCCS1)c1ccccc1	ZINC000787046202	1305683350	/nfs/dbraw/zinc/68/33/50/1305683350.db2.gz	PPYZWBLBDYEAEY-PMPSAXMXSA-N	0	3	330.453	3.248	20	30		EGEDHN
C=CCC1(O)CCN(Cc2c(C)nn(Cc3ccccc3)c2C)CC1	ZINC000895835740	1309546125	/nfs/dbraw/zinc/54/61/25/1309546125.db2.gz	NISVLTDFHYMUHK-UHFFFAOYSA-N	0	3	339.483	3.451	20	30		EGEDHN
C=CCOc1cccc(CN2CCC(Cc3noc(C)n3)CC2)c1	ZINC000896550875	1309911956	/nfs/dbraw/zinc/91/19/56/1309911956.db2.gz	GCKFTRWHHHBTIJ-UHFFFAOYSA-N	0	3	327.428	3.398	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)Cc1c(C)nn(C(C)C)c1C	ZINC000796741791	1310076590	/nfs/dbraw/zinc/07/65/90/1310076590.db2.gz	SZAQETAAUVPGQG-QGZVFWFLSA-N	0	3	346.475	3.029	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1	ZINC000798288134	1310337531	/nfs/dbraw/zinc/33/75/31/1310337531.db2.gz	TWDHXXFUBQIPEN-BBWFWOEESA-N	0	3	330.403	3.335	20	30		EGEDHN
CC(C)(C#N)CCCC[NH+]1CCC(C[N-]C(=O)C(F)(F)F)CC1	ZINC000799173553	1310498468	/nfs/dbraw/zinc/49/84/68/1310498468.db2.gz	VEFNEDANUDCFHH-UHFFFAOYSA-N	0	3	333.398	3.097	20	30		EGEDHN
CSCCCN(C)CC(=O)C(C#N)c1nc2ccccc2s1	ZINC000799200612	1310512314	/nfs/dbraw/zinc/51/23/14/1310512314.db2.gz	MCIISTANEZJNDG-GFCCVEGCSA-N	0	3	333.482	3.157	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N(C)Cc1c(Cl)cccc1Cl	ZINC000836488780	1320493816	/nfs/dbraw/zinc/49/38/16/1320493816.db2.gz	QUHTVZXCSWCVBM-UHFFFAOYSA-N	0	3	342.270	3.090	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N(CCC)[C@@H](C)c1ccccc1OC	ZINC000836489406	1320494249	/nfs/dbraw/zinc/49/42/49/1320494249.db2.gz	ZRHSVGQCAXQFIG-KRWDZBQOSA-N	0	3	345.487	3.133	20	30		EGEDHN
Cc1cccc(CNC(=O)C(C#N)C(=O)Cc2ccc(Cl)s2)c1	ZINC000802213103	1316988326	/nfs/dbraw/zinc/98/83/26/1316988326.db2.gz	OPQNGGIUVTVKIK-CQSZACIVSA-N	0	3	346.839	3.278	20	30		EGEDHN
Cc1oc(C)c(C(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)c1C	ZINC001019115393	1317053615	/nfs/dbraw/zinc/05/36/15/1317053615.db2.gz	DBAYOOHDPJODFS-AWEZNQCLSA-N	0	3	343.452	3.142	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)C3CCC=CCC3)C2)s1	ZINC001019787130	1317420489	/nfs/dbraw/zinc/42/04/89/1317420489.db2.gz	DOLBZZGFSWLGRK-HNNXBMFYSA-N	0	3	329.469	3.057	20	30		EGEDHN
CCOC1CC(C(=O)C(C#N)C(=O)Nc2cccc3ccccc32)C1	ZINC000805856259	1317431871	/nfs/dbraw/zinc/43/18/71/1317431871.db2.gz	SNVIYVKFFVHHCQ-DQPZFDDXSA-N	0	3	336.391	3.302	20	30		EGEDHN
C[C@@H](Cc1cncc2ccccc21)C(=O)C(C#N)C(=O)NC1CCCC1	ZINC000805858530	1317433040	/nfs/dbraw/zinc/43/30/40/1317433040.db2.gz	RQRQCUKLBUKSNK-LIRRHRJNSA-N	0	3	349.434	3.181	20	30		EGEDHN
CCN(Cc1cc(C#N)ccc1F)CC1CCN(C(=O)C2CC2)CC1	ZINC000957661259	1317531805	/nfs/dbraw/zinc/53/18/05/1317531805.db2.gz	QMYZZORGRZKIEK-UHFFFAOYSA-N	0	3	343.446	3.168	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H]2CCc3c2cccc3Cl)C1	ZINC001020400342	1317680306	/nfs/dbraw/zinc/68/03/06/1317680306.db2.gz	OEGXTVREOPRCRY-LALPHHSUSA-N	0	3	339.266	3.359	20	30		EGEDHN
C#C[C@@H]([NH2+]Cc1cc(Br)cc(OC)c1[O-])C(C)(C)C	ZINC000809781309	1317899659	/nfs/dbraw/zinc/89/96/59/1317899659.db2.gz	ORBLIQGRSIRTIQ-CYBMUJFWSA-N	0	3	326.234	3.301	20	30		EGEDHN
CC(C)[C@]1(C)C[C@@H]1C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001020859655	1317968524	/nfs/dbraw/zinc/96/85/24/1317968524.db2.gz	CTJPMWKTAHKTSH-VIPLHTEESA-N	0	3	343.446	3.116	20	30		EGEDHN
Cc1ccc(C#N)cc1C(=O)N1c2ccccc2CC[C@@H]1CN(C)C	ZINC000905727686	1317986383	/nfs/dbraw/zinc/98/63/83/1317986383.db2.gz	QAAIGNDPYJJDEY-GOSISDBHSA-N	0	3	333.435	3.390	20	30		EGEDHN
C[C@H](COCC1CCCCC1)N[C@@H](C)C(=O)Nc1ccccc1C#N	ZINC000905857811	1318009305	/nfs/dbraw/zinc/00/93/05/1318009305.db2.gz	IEVVGXIBLITEJH-CVEARBPZSA-N	0	3	343.471	3.460	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccsc2C(F)(F)F)C1	ZINC001020976895	1318027077	/nfs/dbraw/zinc/02/70/77/1318027077.db2.gz	OCMBNJDKXRVNHP-KYZUINATSA-N	0	3	338.782	3.370	20	30		EGEDHN
COc1ccc(C(C)=NNC[C@@H]2CCSC2)cc1CN1CCCC1	ZINC000811658566	1318221637	/nfs/dbraw/zinc/22/16/37/1318221637.db2.gz	LURYEOLBJLEYNV-INIZCTEOSA-N	0	3	347.528	3.358	20	30		EGEDHN
Cc1ccc(C(=O)/C=C\C(=O)N2CCCC3(CCN(C)CC3)C2)cc1	ZINC000907959830	1318285275	/nfs/dbraw/zinc/28/52/75/1318285275.db2.gz	MJBUXISCRYLLLZ-HJWRWDBZSA-N	0	3	340.467	3.068	20	30		EGEDHN
CC(C)(F)C(=O)N1CCC[C@H]2CN(Cc3cccc(C#N)c3)CC[C@@H]21	ZINC001021494394	1318296875	/nfs/dbraw/zinc/29/68/75/1318296875.db2.gz	AXHMFTFZQBMHAQ-ROUUACIJSA-N	0	3	343.446	3.119	20	30		EGEDHN
C#C[C@@H](C)N(C)C(=O)NC[C@H](c1cccs1)N1CCC(C)CC1	ZINC000811993289	1318304268	/nfs/dbraw/zinc/30/42/68/1318304268.db2.gz	SOJAWNUQEAFMAS-HZPDHXFCSA-N	0	3	333.501	3.184	20	30		EGEDHN
CC1=C(C)C[C@@H](C(=O)N[C@@H]2[C@H]3CN(Cc4ccc(C#N)cc4)C[C@H]32)CC1	ZINC000960052192	1318331832	/nfs/dbraw/zinc/33/18/32/1318331832.db2.gz	NPDPFCUTGVIKKG-UWHLTILDSA-N	0	3	349.478	3.241	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@H]2CN(Cc3cccc(F)c3)CC[C@H]21	ZINC001021582130	1318426268	/nfs/dbraw/zinc/42/62/68/1318426268.db2.gz	TYECKOUDLODHFK-AZUAARDMSA-N	0	3	340.442	3.052	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cnc2[nH]ccc2c1	ZINC000960275987	1318438996	/nfs/dbraw/zinc/43/89/96/1318438996.db2.gz	LMWJJHOGPTUDRO-RTBURBONSA-N	0	3	346.434	3.076	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc2nc(C)oc2c1	ZINC000960279846	1318442045	/nfs/dbraw/zinc/44/20/45/1318442045.db2.gz	WPXLCZRJSAONGW-UYAOXDASSA-N	0	3	347.418	3.308	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc3ccccc3nc2C)C1	ZINC001021599576	1318442683	/nfs/dbraw/zinc/44/26/83/1318442683.db2.gz	HVHSUOMSQRGLRD-WIYYLYMNSA-N	0	3	347.462	3.103	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)CC2(c3ccccc3)CC2)C1	ZINC001021601015	1318444352	/nfs/dbraw/zinc/44/43/52/1318444352.db2.gz	BKXVLGBVDMMGPB-ICSRJNTNSA-N	0	3	336.479	3.054	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)C[C@@H]1CC(C)(C)CO1	ZINC000960287403	1318445975	/nfs/dbraw/zinc/44/59/75/1318445975.db2.gz	ILIKRLKRHIUETP-YVWKXTFCSA-N	0	3	342.483	3.140	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)Cc1cccc(C)c1	ZINC000960299259	1318450722	/nfs/dbraw/zinc/45/07/22/1318450722.db2.gz	HJSHUHQRXBZDPW-IFMALSPDSA-N	0	3	334.463	3.485	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(C)c(F)cc2F)C1	ZINC001021609892	1318456946	/nfs/dbraw/zinc/45/69/46/1318456946.db2.gz	BDKLWGUHJUUTEZ-BEFAXECRSA-N	0	3	346.421	3.223	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc(C)cc2c[nH]nc21	ZINC000960316816	1318457704	/nfs/dbraw/zinc/45/77/04/1318457704.db2.gz	KXECHVWMLPUFAB-UYAOXDASSA-N	0	3	346.434	3.043	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1[nH]nc2ccccc21	ZINC000960335186	1318468859	/nfs/dbraw/zinc/46/88/59/1318468859.db2.gz	PGLPAOPMZHAUKU-RTBURBONSA-N	0	3	346.434	3.124	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cccc3cccnc32)C1	ZINC001021621378	1318470117	/nfs/dbraw/zinc/47/01/17/1318470117.db2.gz	ARZKBORSHYLQEK-ICSRJNTNSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)Cc2c(C)cccc2Cl)C1	ZINC001021625374	1318475146	/nfs/dbraw/zinc/47/51/46/1318475146.db2.gz	PMFXIXUAXFHPOF-APWZRJJASA-N	0	3	344.886	3.137	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)C1CCCC1	ZINC000960360301	1318482595	/nfs/dbraw/zinc/48/25/95/1318482595.db2.gz	IGOBCEDKBMMOIZ-IBGZPJMESA-N	0	3	325.456	3.171	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)/C=C/c1ccco1	ZINC000960370820	1318492916	/nfs/dbraw/zinc/49/29/16/1318492916.db2.gz	BOPYZXAENBBBKR-YXBWYFRISA-N	0	3	349.434	3.287	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(C)c3cccnc23)C1	ZINC001021638934	1318496186	/nfs/dbraw/zinc/49/61/86/1318496186.db2.gz	KZGDKYORDMARSO-XLIONFOSSA-N	0	3	347.462	3.103	20	30		EGEDHN
N#Cc1cccc(OCC(=O)C(C#N)c2cc(C(F)(F)F)ccn2)c1	ZINC000813217549	1318516228	/nfs/dbraw/zinc/51/62/28/1318516228.db2.gz	MMJWEAOJAQAXGL-CQSZACIVSA-N	0	3	345.280	3.227	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cccc(C)c2Cl)C1	ZINC001021693475	1318568374	/nfs/dbraw/zinc/56/83/74/1318568374.db2.gz	OSXCNMBUHAYDKU-DOTOQJQBSA-N	0	3	330.859	3.208	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc3sccc3c2)C1	ZINC001021706625	1318579968	/nfs/dbraw/zinc/57/99/68/1318579968.db2.gz	MSNYJKIBEUNCRX-QZTJIDSGSA-N	0	3	338.476	3.461	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc3ccccc3c2)C1	ZINC001021721312	1318605487	/nfs/dbraw/zinc/60/54/87/1318605487.db2.gz	DXKHCLLUXNZVEC-LEWJYISDSA-N	0	3	332.447	3.400	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2occ3c2CCCC3)C1	ZINC001021723462	1318612171	/nfs/dbraw/zinc/61/21/71/1318612171.db2.gz	UVXBWQXDRXOAAH-QFBILLFUSA-N	0	3	340.467	3.108	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(Cl)s2)C1	ZINC001021728121	1318626476	/nfs/dbraw/zinc/62/64/76/1318626476.db2.gz	RKSQRFPNZWNYAD-ZIAGYGMSSA-N	0	3	336.888	3.351	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(C)n(C(C)C)c2C)C1	ZINC001021731574	1318635053	/nfs/dbraw/zinc/63/50/53/1318635053.db2.gz	WMTDUBRMDXMAGM-AZUAARDMSA-N	0	3	341.499	3.246	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)CCc2ccc(CC)cc2)C1	ZINC001021733293	1318638954	/nfs/dbraw/zinc/63/89/54/1318638954.db2.gz	LOHKNPNYHFKVPZ-NHCUHLMSSA-N	0	3	338.495	3.128	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cccc3cnccc32)C1	ZINC001021737355	1318644186	/nfs/dbraw/zinc/64/41/86/1318644186.db2.gz	SXUHYFIDGQYAQO-WIYYLYMNSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc3cccc(F)c3o2)C1	ZINC001021740979	1318649610	/nfs/dbraw/zinc/64/96/10/1318649610.db2.gz	XTUNATGCWFYFMA-NVXWUHKLSA-N	0	3	340.398	3.132	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)CCc2cc(C)sc2C)C1	ZINC001021742575	1318655807	/nfs/dbraw/zinc/65/58/07/1318655807.db2.gz	GDFSSNHXSBLDFU-OALUTQOASA-N	0	3	344.524	3.244	20	30		EGEDHN
CC(=O)N(C)c1ccc(CN[C@@H](C)c2ccc(OCC#N)cc2)cc1	ZINC000858496140	1328779873	/nfs/dbraw/zinc/77/98/73/1328779873.db2.gz	NVAZNWZXPKFXBZ-HNNXBMFYSA-N	0	3	337.423	3.422	20	30		EGEDHN
CC(C(=O)N1CCC[C@H]1CN(C)Cc1cccc(C#N)c1)=C1CCC1	ZINC000960613988	1318741544	/nfs/dbraw/zinc/74/15/44/1318741544.db2.gz	PDSRPCIECNHMGN-FQEVSTJZSA-N	0	3	337.467	3.481	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc(C(=O)N2CCCC[C@H]2C)cc1	ZINC000912309890	1318864473	/nfs/dbraw/zinc/86/44/73/1318864473.db2.gz	ARWIQUFWGTYGFO-QAPCUYQASA-N	0	3	343.471	3.323	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)C1(C)CCC1	ZINC000960794216	1318902888	/nfs/dbraw/zinc/90/28/88/1318902888.db2.gz	YGLDWQXEAXLRGN-GOSISDBHSA-N	0	3	325.456	3.171	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2sc(C)nc2CC(C)C)C1	ZINC001022374683	1318911247	/nfs/dbraw/zinc/91/12/47/1318911247.db2.gz	LIMJSCKPWATRNE-BETUJISGSA-N	0	3	341.908	3.253	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)C(C)(C)C1CC1	ZINC000960809150	1318924196	/nfs/dbraw/zinc/92/41/96/1318924196.db2.gz	MGDDQJRUBARPEH-LJQANCHMSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@@H]2CN(C)C[C@H]2CCCCO2)CC1	ZINC000960827459	1318953285	/nfs/dbraw/zinc/95/32/85/1318953285.db2.gz	BMFJGSNTZDKOIB-RTBURBONSA-N	0	3	334.504	3.225	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2C[C@@H](N[C@@H](C)c3ccccc3F)C2)cc1	ZINC001022526317	1318978537	/nfs/dbraw/zinc/97/85/37/1318978537.db2.gz	DOTYIUMELXZBPD-JCGIZDLHSA-N	0	3	336.410	3.419	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@@H](NC(=O)C[C@@H]3CC=CCC3)C2)c1	ZINC001022550149	1318982969	/nfs/dbraw/zinc/98/29/69/1318982969.db2.gz	VEFCHHWHLOTRSE-OLMNPRSZSA-N	0	3	341.430	3.181	20	30		EGEDHN
C=CCC(C)(C)c1noc([C@@]2(O)CCN(Cc3ccccc3)C2)n1	ZINC000815708446	1319045592	/nfs/dbraw/zinc/04/55/92/1319045592.db2.gz	VVRHDWFNZCZJKM-LJQANCHMSA-N	0	3	327.428	3.017	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)[C@@H]1CC12CCC2	ZINC000960913761	1319060223	/nfs/dbraw/zinc/06/02/23/1319060223.db2.gz	SFQNVNROJJPQJR-MOPGFXCFSA-N	0	3	337.467	3.171	20	30		EGEDHN
CC1(C)CC[C@@H](C(=O)N[C@H]2C[C@@H](NCc3ccc(C#N)cc3F)C2)C1	ZINC001022675643	1319060731	/nfs/dbraw/zinc/06/07/31/1319060731.db2.gz	MZWCCPBBZFQHDD-OIISXLGYSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N[C@H]1C[C@@H](N[C@@H](C)c2ccccc2Cl)C1	ZINC001022738316	1319084589	/nfs/dbraw/zinc/08/45/89/1319084589.db2.gz	ZFDLQMFQUQOBTE-BHUQQCALSA-N	0	3	348.874	3.229	20	30		EGEDHN
C=Cc1ccc(C(=O)N[C@H]2C[C@@H](NCc3cc(C#N)ccc3F)C2)cc1	ZINC001022756561	1319090781	/nfs/dbraw/zinc/09/07/81/1319090781.db2.gz	YMQFKSIQXHWVBV-KDURUIRLSA-N	0	3	349.409	3.391	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)[C@H]2CCCC[C@@H]2CC)C1	ZINC001022904217	1319156224	/nfs/dbraw/zinc/15/62/24/1319156224.db2.gz	HOFUYXDTYYQADA-XQLPTFJDSA-N	0	3	343.309	3.348	20	30		EGEDHN
C[C@H](NC[C@H](O)CC#N)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000930210256	1328812614	/nfs/dbraw/zinc/81/26/14/1328812614.db2.gz	FXZCUKOXUIQFBA-SCLBCKFNSA-N	0	3	341.386	3.003	20	30		EGEDHN
COc1cccc([C@@H](Cc2cc(C)cc(C)c2)NC[C@H](O)CC#N)c1	ZINC000930226196	1328816066	/nfs/dbraw/zinc/81/60/66/1328816066.db2.gz	QNHYOUFFMLKCKF-TZIWHRDSSA-N	0	3	338.451	3.460	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cscc2C(F)(F)F)C1	ZINC001023175770	1319308079	/nfs/dbraw/zinc/30/80/79/1319308079.db2.gz	DKRWVHOHVBGORY-DTORHVGOSA-N	0	3	338.782	3.370	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@H](CNC(=O)C3CCCC3)C2)c1	ZINC001023196162	1319320241	/nfs/dbraw/zinc/32/02/41/1319320241.db2.gz	NQXJXZCGJVPEQC-SFHVURJKSA-N	0	3	325.456	3.077	20	30		EGEDHN
Cc1occc1C(=O)NC[C@@H]1CCCN(Cc2ccc(C#N)cc2)C1	ZINC001023223622	1319360807	/nfs/dbraw/zinc/36/08/07/1319360807.db2.gz	RJCHPVXPISTDMN-SFHVURJKSA-N	0	3	337.423	3.102	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]([C@H]2CCN(Cc3cc(C)no3)C2)C1	ZINC000961232666	1319363599	/nfs/dbraw/zinc/36/35/99/1319363599.db2.gz	UGCOSISZTWPNAP-IRXDYDNUSA-N	0	3	345.487	3.256	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)[C@@H]2C[C@H]2c2sccc2C)C1	ZINC001023368706	1319482756	/nfs/dbraw/zinc/48/27/56/1319482756.db2.gz	UKSNYNGBNSOQDM-BRWVUGGUSA-N	0	3	330.497	3.012	20	30		EGEDHN
C#CCN1CCC[C@H](CNC(=O)c2ccccc2CC(C)(C)C)C1	ZINC001023437377	1319532027	/nfs/dbraw/zinc/53/20/27/1319532027.db2.gz	AEXDTBFSIMMOER-QGZVFWFLSA-N	0	3	326.484	3.350	20	30		EGEDHN
N#Cc1ccc(CN2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)C2(C3CCC3)CCC2)cc1	ZINC000961386553	1319542539	/nfs/dbraw/zinc/54/25/39/1319542539.db2.gz	JOVGTRCUUXGDMM-PMOLBWCYSA-N	0	3	349.478	3.075	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NC[C@@H]1CCCN(C[C@H](F)CC)C1	ZINC001023447999	1319549357	/nfs/dbraw/zinc/54/93/57/1319549357.db2.gz	BYTYJBGQYIKSAS-DLBZAZTESA-N	0	3	348.462	3.441	20	30		EGEDHN
C#CCN(C)CCCNC(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl	ZINC000818593346	1319565245	/nfs/dbraw/zinc/56/52/45/1319565245.db2.gz	VFMWETHSTUGKKS-LSDHHAIUSA-N	0	3	339.266	3.168	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc3c(o2)c(F)ccc3C)C1	ZINC001023507510	1319615183	/nfs/dbraw/zinc/61/51/83/1319615183.db2.gz	SIANYCWBWSELFO-HNNXBMFYSA-N	0	3	342.414	3.345	20	30		EGEDHN
C=CCN1CCC[C@H](CNC(=O)c2nc(Cl)sc2Cl)C1	ZINC001023527937	1319634440	/nfs/dbraw/zinc/63/44/40/1319634440.db2.gz	CZARZBWCNQNFMH-SECBINFHSA-N	0	3	334.272	3.078	20	30		EGEDHN
C=C(C)CN1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1c(Cl)oc2ccccc21	ZINC000961551448	1319648791	/nfs/dbraw/zinc/64/87/91/1319648791.db2.gz	QAMGIIHZOZXECK-VIKVFOODSA-N	0	3	330.815	3.322	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CCCN(Cc3cccnc3C)C2)CC1	ZINC001023573130	1319691382	/nfs/dbraw/zinc/69/13/82/1319691382.db2.gz	SZMIDWUXYAQGRN-GOSISDBHSA-N	0	3	341.499	3.465	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)COc2ccc(C)cc2)cc1	ZINC000916910370	1319722576	/nfs/dbraw/zinc/72/25/76/1319722576.db2.gz	PLDCPEDEXZYBAP-SFHVURJKSA-N	0	3	336.391	3.284	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1Cl)C(=O)c1cccc([N+](=O)[O-])c1	ZINC000916907538	1319723373	/nfs/dbraw/zinc/72/33/73/1319723373.db2.gz	BSLPHUIWRHKFEC-LBPRGKRZSA-N	0	3	343.726	3.209	20	30		EGEDHN
Cc1ccccc1CN1CCN(CCCOc2ccc(C#N)cc2)CC1	ZINC000916977026	1319729665	/nfs/dbraw/zinc/72/96/65/1319729665.db2.gz	HAXMDOSVNXGHBM-UHFFFAOYSA-N	0	3	349.478	3.453	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc(OC)c(C3CC3)c2)C1	ZINC001023672187	1319787779	/nfs/dbraw/zinc/78/77/79/1319787779.db2.gz	WUVDTILKSNHGKA-INIZCTEOSA-N	0	3	340.467	3.038	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc(OCC(C)C)cc2)C1	ZINC001023735349	1319877495	/nfs/dbraw/zinc/87/74/95/1319877495.db2.gz	LVPPKKKGGSNQPR-GOSISDBHSA-N	0	3	342.483	3.187	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCN(C(=O)[C@H]2CC=CCC2)C1	ZINC001023837429	1319979109	/nfs/dbraw/zinc/97/91/09/1319979109.db2.gz	WQVMULNQQZKBRW-MSOLQXFVSA-N	0	3	337.467	3.243	20	30		EGEDHN
COc1ccc(OC)c([C@@H](O)CN(C)[C@@H](C)c2cccc(C#N)c2)c1	ZINC000823618133	1320192740	/nfs/dbraw/zinc/19/27/40/1320192740.db2.gz	NTPVUHHXJVHIFP-LIRRHRJNSA-N	0	3	340.423	3.302	20	30		EGEDHN
Cc1ccc(C#N)cc1C(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1	ZINC000930508134	1328881586	/nfs/dbraw/zinc/88/15/86/1328881586.db2.gz	NVCOUYRROYJYNS-VQIMIIECSA-N	0	3	333.435	3.432	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(Cl)nc(C(F)(F)F)c2)CC1	ZINC000826656858	1320393829	/nfs/dbraw/zinc/39/38/29/1320393829.db2.gz	ZWYZIQWIBIJHJX-UHFFFAOYSA-N	0	3	347.768	3.134	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCC[C@@]2(C)CC2(Cl)Cl)CC1	ZINC000836288088	1320469129	/nfs/dbraw/zinc/46/91/29/1320469129.db2.gz	SYAUCZNAWUPSKL-HNNXBMFYSA-N	0	3	348.318	3.300	20	30		EGEDHN
C#CCCCNC(=O)Nc1cc(Cl)ccc1OC1CCN(C)CC1	ZINC000836764163	1320531369	/nfs/dbraw/zinc/53/13/69/1320531369.db2.gz	IULOIFVYIHXQLY-UHFFFAOYSA-N	0	3	349.862	3.348	20	30		EGEDHN
C=CCNc1ncc(C(=O)OCCN(C)Cc2ccccc2)s1	ZINC000837586706	1320648508	/nfs/dbraw/zinc/64/85/08/1320648508.db2.gz	BBVOVQHQBSABSW-UHFFFAOYSA-N	0	3	331.441	3.030	20	30		EGEDHN
Cc1ccc(CN(C)[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1C#N	ZINC000859152277	1328932988	/nfs/dbraw/zinc/93/29/88/1328932988.db2.gz	JGCBCZDWVWOOGF-KRWDZBQOSA-N	0	3	329.444	3.308	20	30		EGEDHN
CCN(Cc1ccccc1)c1ccc(C=NN(C)C[C@@H](C)O)cc1	ZINC000841653559	1321292092	/nfs/dbraw/zinc/29/20/92/1321292092.db2.gz	PAUDHZVLDXDSNY-QGZVFWFLSA-N	0	3	325.456	3.360	20	30		EGEDHN
CC[C@@H](NC[C@@H](O)COc1ccccc1C#N)c1ccccc1OC	ZINC000859228619	1328951290	/nfs/dbraw/zinc/95/12/90/1328951290.db2.gz	UTWDBXUJAFCSDG-SJLPKXTDSA-N	0	3	340.423	3.047	20	30		EGEDHN
CCOc1ccc(C[C@H](C)C(=O)C(C#N)C(=O)NC2CCCC2)cc1	ZINC000842291330	1321367986	/nfs/dbraw/zinc/36/79/86/1321367986.db2.gz	IMZWDNJFBCYKLW-KBXCAEBGSA-N	0	3	342.439	3.032	20	30		EGEDHN
CC[C@H](OC1CCCC1)C(=O)C(C#N)C(=O)Nc1ccc(OC)cc1	ZINC000842290480	1321368092	/nfs/dbraw/zinc/36/80/92/1321368092.db2.gz	ZFJCMDMNLBRELS-SJORKVTESA-N	0	3	344.411	3.080	20	30		EGEDHN
C[C@@H](C(=O)C(C#N)c1nc(C2CC2)cs1)N(C)CC(F)(F)F	ZINC000842945730	1321452522	/nfs/dbraw/zinc/45/25/22/1321452522.db2.gz	RQDZSRNVYKBFLQ-WCBMZHEXSA-N	0	3	331.363	3.079	20	30		EGEDHN
N#CCOc1cccc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)c1	ZINC000844339037	1321590855	/nfs/dbraw/zinc/59/08/55/1321590855.db2.gz	WILGKTKQFIGZGV-KGLIPLIRSA-N	0	3	342.317	3.275	20	30		EGEDHN
CC(C)(C)N1CC[C@@H]1COC(=O)C(C)(C)Oc1ccc(C#N)cc1	ZINC000845731884	1321738566	/nfs/dbraw/zinc/73/85/66/1321738566.db2.gz	BYZFLWDELLZOMA-OAHLLOKOSA-N	0	3	330.428	3.132	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-]	ZINC000845876004	1321748946	/nfs/dbraw/zinc/74/89/46/1321748946.db2.gz	PEHZAZAJGWWCKX-YWPYICTPSA-N	0	3	325.336	3.056	20	30		EGEDHN
CC(C)(C)OC(=O)NCCC1CC(NCc2cc(C#N)ccc2F)C1	ZINC000845944070	1321756856	/nfs/dbraw/zinc/75/68/56/1321756856.db2.gz	LWLOBVGHMNPDAI-UHFFFAOYSA-N	0	3	347.434	3.480	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@@H]1CCCc2ccc(OC)cc21	ZINC000847622340	1321885035	/nfs/dbraw/zinc/88/50/35/1321885035.db2.gz	IIXWGSVSQCHIQO-AEFFLSMTSA-N	0	3	342.439	3.130	20	30		EGEDHN
C[C@H](COC(=O)CSCc1ccc(C#N)cc1)N1CCCCC1	ZINC000847958479	1321915868	/nfs/dbraw/zinc/91/58/68/1321915868.db2.gz	AZJUZMUVMKWBOS-OAHLLOKOSA-N	0	3	332.469	3.209	20	30		EGEDHN
C#CCOc1ccc([C@@H](C)N[C@@H]2CCc3ccccc3NC2=O)cc1	ZINC000848557305	1321975967	/nfs/dbraw/zinc/97/59/67/1321975967.db2.gz	DTUOCNRQWRKXEY-FOIQADDNSA-N	0	3	334.419	3.303	20	30		EGEDHN
C#CCOc1ccc([C@@H](C)NCC2(S(C)(=O)=O)CCCCC2)cc1	ZINC000850531286	1322261422	/nfs/dbraw/zinc/26/14/22/1322261422.db2.gz	ISIMKSQPAFFRTJ-MRXNPFEDSA-N	0	3	349.496	3.097	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@@H](NCc1ccc(N3CCCNC3=O)cc1)CC2	ZINC000850575196	1322271145	/nfs/dbraw/zinc/27/11/45/1322271145.db2.gz	RXNKTQVOWMLNOB-FQEVSTJZSA-N	0	3	346.434	3.255	20	30		EGEDHN
CC(C)(C)O[C@@H]1C[C@H]1C(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1	ZINC000850755610	1322285015	/nfs/dbraw/zinc/28/50/15/1322285015.db2.gz	GOMOTPKYDDMJRN-MGPQQGTHSA-N	0	3	334.803	3.191	20	30		EGEDHN
C#CCCN1CC[C@H](C(F)(F)F)[C@@H](CNC(=O)OC(C)(C)C)C1	ZINC000859606287	1329033130	/nfs/dbraw/zinc/03/31/30/1329033130.db2.gz	LZTNNHOELZWDQO-STQMWFEESA-N	0	3	334.382	3.035	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H](c2cnn(C)c2)C(C)C)cc1OC	ZINC000922891521	1322642397	/nfs/dbraw/zinc/64/23/97/1322642397.db2.gz	JIOZTONCHUKYDH-LJQANCHMSA-N	0	3	329.444	3.480	20	30		EGEDHN
Cc1cocc1C(=O)N1CCC[C@@H](CNCc2ccccc2C#N)C1	ZINC001024100965	1323132536	/nfs/dbraw/zinc/13/25/36/1323132536.db2.gz	DKGBTDJMPJSMSB-INIZCTEOSA-N	0	3	337.423	3.102	20	30		EGEDHN
CCCNC(=O)OC[C@H]1CCCCN1CCc1ccc(C#N)cc1	ZINC000852049376	1323138500	/nfs/dbraw/zinc/13/85/00/1323138500.db2.gz	VJTOEOAYSRUPAX-GOSISDBHSA-N	0	3	329.444	3.091	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H](CNCc2ncc(C)s2)C1	ZINC001024137921	1323162672	/nfs/dbraw/zinc/16/26/72/1323162672.db2.gz	VXORISZRNIFSCR-YJBOKZPZSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=CCCCCCCCNC(=O)NC1CCN([C@H]2CCOC2)CC1	ZINC000852343383	1323180127	/nfs/dbraw/zinc/18/01/27/1323180127.db2.gz	BXRODBJZNJXAPD-SFHVURJKSA-N	0	3	337.508	3.066	20	30		EGEDHN
C[C@H](CC(C)(C)C#N)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000924882383	1323199162	/nfs/dbraw/zinc/19/91/62/1323199162.db2.gz	QDQGCBSREDAEHD-AEFFLSMTSA-N	0	3	327.472	3.138	20	30		EGEDHN
CCC(=O)N1CCC[C@H]([C@@H]2CCCN2Cc2ccc(C#N)cc2F)C1	ZINC000963213635	1323239894	/nfs/dbraw/zinc/23/98/94/1323239894.db2.gz	BYCGENKYJFSDEM-HKUYNNGSSA-N	0	3	343.446	3.310	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@H]2CCCCN2CCCF)cc1	ZINC001024511719	1323462058	/nfs/dbraw/zinc/46/20/58/1323462058.db2.gz	KTTFZQKFPWMIQF-QGZVFWFLSA-N	0	3	334.435	3.195	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)C1CCc2ccccc2CC1	ZINC001024516329	1323468032	/nfs/dbraw/zinc/46/80/32/1323468032.db2.gz	HXBOKXJSARUWLW-OAQYLSRUSA-N	0	3	338.495	3.176	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cc(-c2ccccc2)n[nH]1	ZINC001024540361	1323481274	/nfs/dbraw/zinc/48/12/74/1323481274.db2.gz	JWHRKJFXCWHPKT-QGZVFWFLSA-N	0	3	338.455	3.237	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cccc2c1O[C@H](C)C2	ZINC001024561816	1323502646	/nfs/dbraw/zinc/50/26/46/1323502646.db2.gz	YYCYKVLHJGSUPR-WBVHZDCISA-N	0	3	328.456	3.170	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@H]1CCCc2cccnc21	ZINC001024615458	1323543107	/nfs/dbraw/zinc/54/31/07/1323543107.db2.gz	SUEYFDHQYDSSGO-MSOLQXFVSA-N	0	3	327.472	3.048	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cccc(-n2cccn2)c1	ZINC001024706025	1323616355	/nfs/dbraw/zinc/61/63/55/1323616355.db2.gz	QXTKTQVKPOJZRE-IBGZPJMESA-N	0	3	338.455	3.033	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccnc(C(F)(F)F)c1	ZINC001024744076	1323642552	/nfs/dbraw/zinc/64/25/52/1323642552.db2.gz	XGATZWPHKKUKDI-AWEZNQCLSA-N	0	3	341.377	3.261	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCCCN2CC2=CCCCC2)cn1	ZINC001024769710	1323669025	/nfs/dbraw/zinc/66/90/25/1323669025.db2.gz	LHWXUMCVMNZHBP-FQEVSTJZSA-N	0	3	337.467	3.148	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@H]1Cc2cc(C)c(C)cc2O1	ZINC001024809204	1323711708	/nfs/dbraw/zinc/71/17/08/1323711708.db2.gz	QYYAAIFEOXKFKA-AZUAARDMSA-N	0	3	342.483	3.154	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)[C@@H]1CCCCc2ccccc21	ZINC001024816708	1323719329	/nfs/dbraw/zinc/71/93/29/1323719329.db2.gz	OOXJIPRQLCCWTP-PZJWPPBQSA-N	0	3	338.495	3.491	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)[C@@H]1CCCCc2ccccc21	ZINC001024816710	1323719634	/nfs/dbraw/zinc/71/96/34/1323719634.db2.gz	OOXJIPRQLCCWTP-TZIWHRDSSA-N	0	3	338.495	3.491	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)C2=CCCC2)cc1F	ZINC001024926234	1323787258	/nfs/dbraw/zinc/78/72/58/1323787258.db2.gz	VQWGFOMGUNRKJV-GOSISDBHSA-N	0	3	341.430	3.278	20	30		EGEDHN
CC1(C(=O)N2CCCC[C@@H]2CNCc2ccc(C#N)s2)CCC1	ZINC001025045283	1323848834	/nfs/dbraw/zinc/84/88/34/1323848834.db2.gz	WADKZXMPDVCGHH-CQSZACIVSA-N	0	3	331.485	3.281	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCCC[C@@H]1CNCc1cncc(F)c1	ZINC001025069359	1323871419	/nfs/dbraw/zinc/87/14/19/1323871419.db2.gz	IVDHHIQJIJCDHN-MJGOQNOKSA-N	0	3	333.451	3.294	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001025105335	1323898635	/nfs/dbraw/zinc/89/86/35/1323898635.db2.gz	UJDKQDPRZGLZST-CRAIPNDOSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1oc(C)cc1C	ZINC001025215759	1324007948	/nfs/dbraw/zinc/00/79/48/1324007948.db2.gz	CIZYZESWFAFUNP-ZWKOTPCHSA-N	0	3	328.456	3.379	20	30		EGEDHN
N#Cc1ccc(C(=O)N2CCCC[C@@H]2[C@@H]2CCCN2C/C=C/Cl)[nH]1	ZINC001025225073	1324013367	/nfs/dbraw/zinc/01/33/67/1324013367.db2.gz	YBCVKCDWVCTNHE-MWXKITEQSA-N	0	3	346.862	3.098	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc(C(F)F)nc1	ZINC001025238663	1324030026	/nfs/dbraw/zinc/03/00/26/1324030026.db2.gz	ULFHKSXSODCXFO-SJORKVTESA-N	0	3	347.409	3.112	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1c(F)cncc1F	ZINC001025238586	1324030199	/nfs/dbraw/zinc/03/01/99/1324030199.db2.gz	SSOBPCCXEMZPDO-HZPDHXFCSA-N	0	3	335.398	3.005	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)C12CCC(CC1)C2	ZINC001025243992	1324040301	/nfs/dbraw/zinc/04/03/01/1324040301.db2.gz	GGWJFZLSKWYBON-KYBDOYODSA-N	0	3	328.500	3.436	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ncccc1CC	ZINC001025244697	1324041233	/nfs/dbraw/zinc/04/12/33/1324041233.db2.gz	JSFPTPWCUALVFV-MSOLQXFVSA-N	0	3	327.472	3.289	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cccnc1C1CC1	ZINC001025247721	1324047408	/nfs/dbraw/zinc/04/74/08/1324047408.db2.gz	PKMJFAOJEZQISD-RBUKOAKNSA-N	0	3	337.467	3.051	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(Cl)cn1C	ZINC001025250224	1324049681	/nfs/dbraw/zinc/04/96/81/1324049681.db2.gz	IICFZPBOEURYEV-DLBZAZTESA-N	0	3	347.890	3.161	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)C1(C(F)F)CCC1	ZINC001025258543	1324067162	/nfs/dbraw/zinc/06/71/62/1324067162.db2.gz	HFHNXXOBYAQTOT-JKSUJKDBSA-N	0	3	338.442	3.291	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1occc1CC	ZINC001025266441	1324077702	/nfs/dbraw/zinc/07/77/02/1324077702.db2.gz	JSVLWGPXAZGXPQ-ROUUACIJSA-N	0	3	328.456	3.324	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccn(C(C)C)n1	ZINC001025275684	1324097409	/nfs/dbraw/zinc/09/74/09/1324097409.db2.gz	YJBDJOHYXAHXSP-QZTJIDSGSA-N	0	3	330.476	3.109	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cncc(Cl)c1	ZINC001025278401	1324099297	/nfs/dbraw/zinc/09/92/97/1324099297.db2.gz	SHJUPUWFLMEZCM-ROUUACIJSA-N	0	3	345.874	3.217	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc2cccnc2c1	ZINC001025278766	1324100523	/nfs/dbraw/zinc/10/05/23/1324100523.db2.gz	VGJNDMCIEPNMCF-NHCUHLMSSA-N	0	3	347.462	3.327	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ncoc1C(C)C	ZINC001025283947	1324103951	/nfs/dbraw/zinc/10/39/51/1324103951.db2.gz	CUIBBLTWCUAVQZ-HOTGVXAUSA-N	0	3	331.460	3.443	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)C12CCC(CC1)CC2	ZINC001025302914	1324136768	/nfs/dbraw/zinc/13/67/68/1324136768.db2.gz	YWXXBXCNOXAGBC-KYBDOYODSA-N	0	3	328.500	3.436	20	30		EGEDHN
C[C@H](NC(=O)c1ccco1)[C@H]1CCCN(Cc2ccc(C#N)cc2)C1	ZINC001025320824	1324158202	/nfs/dbraw/zinc/15/82/02/1324158202.db2.gz	QTDGJZIVQYJXII-YJBOKZPZSA-N	0	3	337.423	3.182	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccoc2C(F)(F)F)C1	ZINC001025432072	1324269294	/nfs/dbraw/zinc/26/92/94/1324269294.db2.gz	RTKILOLWWRMERQ-CHWSQXEVSA-N	0	3	342.361	3.152	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2oc(C(F)F)cc2C)C1	ZINC001025445401	1324286805	/nfs/dbraw/zinc/28/68/05/1324286805.db2.gz	MYBUTTKKBZGGOQ-UONOGXRCSA-N	0	3	338.398	3.379	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(C)c3ccccc3n2)C1	ZINC001025458056	1324299023	/nfs/dbraw/zinc/29/90/23/1324299023.db2.gz	GUALGVMMAXDITH-ZWKOTPCHSA-N	0	3	349.478	3.397	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2c(C)c(F)ccc2Cl)C1	ZINC001025459621	1324302259	/nfs/dbraw/zinc/30/22/59/1324302259.db2.gz	PRXNUEWTTLJWSS-ZIAGYGMSSA-N	0	3	336.838	3.251	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2c(C)c(F)ccc2Cl)C1	ZINC001025459618	1324302289	/nfs/dbraw/zinc/30/22/89/1324302289.db2.gz	PRXNUEWTTLJWSS-KBPBESRZSA-N	0	3	336.838	3.251	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(C)nn2C(CC)CC)C1	ZINC001025462062	1324307586	/nfs/dbraw/zinc/30/75/86/1324307586.db2.gz	AHZLMWJRJPBGHS-IRXDYDNUSA-N	0	3	344.503	3.016	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc3cc(C)ccc3n2)C1	ZINC001025477849	1324322575	/nfs/dbraw/zinc/32/25/75/1324322575.db2.gz	JPSJHSQESZWFRO-FUHWJXTLSA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(-c3ccco3)o2)C1	ZINC001025481135	1324329637	/nfs/dbraw/zinc/32/96/37/1324329637.db2.gz	FHKXARXPDOSQMI-CVEARBPZSA-N	0	3	340.423	3.393	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(Cl)c(F)c2)C1	ZINC001025544484	1324391534	/nfs/dbraw/zinc/39/15/34/1324391534.db2.gz	WDCUWYNWTGNJRH-DZGCQCFKSA-N	0	3	336.838	3.333	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cccc(F)c2OCC)C1	ZINC001025577587	1324417050	/nfs/dbraw/zinc/41/70/50/1324417050.db2.gz	CYEFQKQMMCASSA-JKSUJKDBSA-N	0	3	346.446	3.078	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(C)c(F)cc2Cl)C1	ZINC001025603251	1324452360	/nfs/dbraw/zinc/45/23/60/1324452360.db2.gz	SQMTWXNPBSDDAV-KBPBESRZSA-N	0	3	336.838	3.251	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cccc(Cl)c2Cl)C1	ZINC001025606868	1324457531	/nfs/dbraw/zinc/45/75/31/1324457531.db2.gz	GVUZWGFBAUHXPA-QWHCGFSZSA-N	0	3	339.266	3.457	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(Cl)cc(Cl)c2)C1	ZINC001025609250	1324460210	/nfs/dbraw/zinc/46/02/10/1324460210.db2.gz	NGMLCPIHKMRSQB-OLZOCXBDSA-N	0	3	339.266	3.457	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(Cl)ccc2Cl)C1	ZINC001025610087	1324461142	/nfs/dbraw/zinc/46/11/42/1324461142.db2.gz	RIVKXCFYNZUWBX-CHWSQXEVSA-N	0	3	339.266	3.457	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc3ccccc3n2CC)C1	ZINC001025629703	1324480638	/nfs/dbraw/zinc/48/06/38/1324480638.db2.gz	JBEZNBSEGQOIDU-FUHWJXTLSA-N	0	3	337.467	3.125	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(-c3ccccc3)[nH]2)C1	ZINC001025633011	1324484800	/nfs/dbraw/zinc/48/48/00/1324484800.db2.gz	RNUZTDZGDXKDAP-AEFFLSMTSA-N	0	3	335.451	3.145	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CC[C@H]2CN(C(=O)CC3CCC3)C[C@@H]21	ZINC001026229728	1324673119	/nfs/dbraw/zinc/67/31/19/1324673119.db2.gz	QAAYFNZJWZAQIG-SLFFLAALSA-N	0	3	337.467	3.075	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H]2CC[C@H](NCc3cc(C4CC4)no3)[C@@H]2C1	ZINC001026329052	1324729450	/nfs/dbraw/zinc/72/94/50/1324729450.db2.gz	UXMWBOJEAWGMNL-UAGQMJEPSA-N	0	3	343.471	3.091	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H]2CC[C@@H](NCc3csc(C)n3)[C@@H]2C1	ZINC001026330843	1324731248	/nfs/dbraw/zinc/73/12/48/1324731248.db2.gz	LZGQLIASCILLKF-USXIJHARSA-N	0	3	347.528	3.380	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CC[C@@H]2CN(C(=O)C3CC4(CC4)C3)C[C@H]12	ZINC001026357840	1324750701	/nfs/dbraw/zinc/75/07/01/1324750701.db2.gz	KMDRBRDZLRAZRC-YZGWKJHDSA-N	0	3	349.478	3.075	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)C(C)=C2CCC2)CC1	ZINC001026491659	1324845061	/nfs/dbraw/zinc/84/50/61/1324845061.db2.gz	GRMRKWVXGYKBAJ-UHFFFAOYSA-N	0	3	341.293	3.412	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)C2(C)CCCC2)CC1	ZINC001026536804	1324875698	/nfs/dbraw/zinc/87/56/98/1324875698.db2.gz	YXBHAYJGSYZNAA-UHFFFAOYSA-N	0	3	343.309	3.492	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)[C@@]2(C)C=CCC2)CC1	ZINC001026542617	1324879931	/nfs/dbraw/zinc/87/99/31/1324879931.db2.gz	SXJZKBGPPFRKGE-XUJLQICISA-N	0	3	341.293	3.268	20	30		EGEDHN
C=C1CCC(C(=O)NC2CCC(N[C@@H](C)c3cnccn3)CC2)CC1	ZINC001026553975	1324890548	/nfs/dbraw/zinc/89/05/48/1324890548.db2.gz	AFXJUJPRRYEFKU-ZLPCBKJTSA-N	0	3	342.487	3.301	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC[C@H](CNCc2c(Cl)cccc2Cl)C1	ZINC001026728328	1324994190	/nfs/dbraw/zinc/99/41/90/1324994190.db2.gz	FWODYRSHTQLEDI-NWDGAFQWSA-N	0	3	340.254	3.091	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)c2ocnc2C)C1	ZINC000963283932	1325066838	/nfs/dbraw/zinc/06/68/38/1325066838.db2.gz	YDHJPNBWUTVQAF-CABCVRRESA-N	0	3	337.851	3.052	20	30		EGEDHN
C#Cc1cccnc1NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000853434586	1325091123	/nfs/dbraw/zinc/09/11/23/1325091123.db2.gz	HHKYUWUJECBJKV-UHFFFAOYSA-N	0	3	339.414	3.157	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](CNCc2ccn(C3CCCC3)n2)C1	ZINC001026994666	1325132060	/nfs/dbraw/zinc/13/20/60/1325132060.db2.gz	WEHOENPRHDPUDP-MRXNPFEDSA-N	0	3	344.503	3.149	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)[C@H]2C[C@H]3C[C@H]3C2)C1	ZINC000963349025	1325140934	/nfs/dbraw/zinc/14/09/34/1325140934.db2.gz	NIMMWZQUJSEJRX-QXDIGNSFSA-N	0	3	336.907	3.488	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)N2CC[C@@H](CNCc3ccccc3C#N)C2)CC1	ZINC001027180478	1325278685	/nfs/dbraw/zinc/27/86/85/1325278685.db2.gz	UZGIEWHYDAXXGM-BZSNNMDCSA-N	0	3	339.483	3.323	20	30		EGEDHN
C[C@H](CC(=O)N1CC[C@@H](CNCc2cc(F)ccc2C#N)C1)C1CC1	ZINC001027237583	1325330864	/nfs/dbraw/zinc/33/08/64/1325330864.db2.gz	QOYSJQSNUQWKDG-CABCVRRESA-N	0	3	343.446	3.072	20	30		EGEDHN
N#Cc1ccccc1CNC1CC2(C1)CC(NC(=O)C1CC=CC1)C2	ZINC000963656797	1325361430	/nfs/dbraw/zinc/36/14/30/1325361430.db2.gz	VLJZCKHNTXKRAR-UHFFFAOYSA-N	0	3	335.451	3.041	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cc(Cl)ccc2NC(C)C)CC1	ZINC000855236141	1325365808	/nfs/dbraw/zinc/36/58/08/1325365808.db2.gz	XABFKVLFNLNGFZ-UHFFFAOYSA-N	0	3	333.863	3.444	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)[C@@H]1CCC[C@H](F)C1)C2	ZINC000963790261	1325401600	/nfs/dbraw/zinc/40/16/00/1325401600.db2.gz	ICUSKYJWIWILPW-AEPRKOQYSA-N	0	3	328.859	3.284	20	30		EGEDHN
C/C(=C/C(=O)N1CCC[C@@H](N(C)Cc2cccc(C#N)c2)C1)C1CC1	ZINC001027313384	1325465675	/nfs/dbraw/zinc/46/56/75/1325465675.db2.gz	DRWLNEBERAZTQQ-TUOAVLBBSA-N	0	3	337.467	3.337	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC[C@H](N(C)Cc2ccc(F)c(Cl)c2)C1	ZINC001027335078	1325493676	/nfs/dbraw/zinc/49/36/76/1325493676.db2.gz	BNFXZWXTRHCVJB-JSGCOSHPSA-N	0	3	337.826	3.062	20	30		EGEDHN
CN(Cc1ccc(F)c(C#N)c1)[C@H]1CCCN(C(=O)CC2CCC2)C1	ZINC001027346365	1325510788	/nfs/dbraw/zinc/51/07/88/1325510788.db2.gz	FFJICLTZRFKBCW-SFHVURJKSA-N	0	3	343.446	3.310	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CCC[C@@H](N(C)Cc2ccc(F)c(C#N)c2)C1	ZINC001027365448	1325555865	/nfs/dbraw/zinc/55/58/65/1325555865.db2.gz	UCZGIDJSADIEIF-MRXNPFEDSA-N	0	3	347.409	3.384	20	30		EGEDHN
CC[C@H](SC)C(=O)N1CCC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001027371781	1325565997	/nfs/dbraw/zinc/56/59/97/1325565997.db2.gz	IZQZDAHLHSSPQG-ROUUACIJSA-N	0	3	345.512	3.123	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)[C@H]2CC2(C)C)C1	ZINC001027374781	1325571765	/nfs/dbraw/zinc/57/17/65/1325571765.db2.gz	JGFSEBHKTYYYBD-ZWKOTPCHSA-N	0	3	325.456	3.027	20	30		EGEDHN
Cc1ccccc1C[C@H](C)C(=O)C(C#N)C(=O)NC1CCCCC1	ZINC000860468031	1329320867	/nfs/dbraw/zinc/32/08/67/1329320867.db2.gz	HWZWGKYEHMQJPC-YJBOKZPZSA-N	0	3	326.440	3.331	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)[C@@H]1Cc3ccccc31)C2	ZINC000964774950	1327689213	/nfs/dbraw/zinc/68/92/13/1327689213.db2.gz	FAPLPRFFIGMXOW-IDWHDZOISA-N	0	3	330.859	3.096	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H](N(C)Cc2cccc(C#N)c2)C1)C1CCC1	ZINC001027460840	1327707351	/nfs/dbraw/zinc/70/73/51/1327707351.db2.gz	PJTIYXWZFREQOF-UZLBHIALSA-N	0	3	339.483	3.417	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)C(C)(C)C(F)F)C1	ZINC001027568486	1327897908	/nfs/dbraw/zinc/89/79/08/1327897908.db2.gz	JUHSRNBNHRTVDL-MRXNPFEDSA-N	0	3	349.425	3.272	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)C(C)(C)C(F)F)C1	ZINC001027568485	1327897990	/nfs/dbraw/zinc/89/79/90/1327897990.db2.gz	JUHSRNBNHRTVDL-INIZCTEOSA-N	0	3	349.425	3.272	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)C2CC3(CC3)C2)C1	ZINC001027571078	1327904531	/nfs/dbraw/zinc/90/45/31/1327904531.db2.gz	QRBYJTGRVIICGB-LJQANCHMSA-N	0	3	337.467	3.171	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)c2ccc(O[C@H](C)CC)cc2)C1	ZINC001027640337	1328013673	/nfs/dbraw/zinc/01/36/73/1328013673.db2.gz	QURIQGSZEXXWMH-AEFFLSMTSA-N	0	3	328.456	3.034	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)c2oc3ccccc3c2Cl)C1	ZINC001027646048	1328021071	/nfs/dbraw/zinc/02/10/71/1328021071.db2.gz	RDCUKFWTPUMDCG-ZDUSSCGKSA-N	0	3	330.815	3.256	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1ncccc1Cl)C2	ZINC000965862419	1328058633	/nfs/dbraw/zinc/05/86/33/1328058633.db2.gz	ZTECMQRHOVUBAM-UHFFFAOYSA-N	0	3	340.254	3.118	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1cc(Cl)c(Cl)n1C	ZINC001027919418	1328397848	/nfs/dbraw/zinc/39/78/48/1328397848.db2.gz	YBEDJKNOMDIWKP-NSHDSACASA-N	0	3	330.259	3.102	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)[C@@H]1CCCO[C@H]1c1ccccc1	ZINC001027940074	1328416805	/nfs/dbraw/zinc/41/68/05/1328416805.db2.gz	GEIUPOGQWYSBHW-ZCNNSNEGSA-N	0	3	342.483	3.311	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2nc(C(C)(C)C)cs2)C1	ZINC000966874132	1328447866	/nfs/dbraw/zinc/44/78/66/1328447866.db2.gz	CSVSJVVEJYSLOM-KGLIPLIRSA-N	0	3	335.517	3.457	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3cccc4c3CCCCC4)C2)CC1	ZINC001050556046	1348288876	/nfs/dbraw/zinc/28/88/76/1348288876.db2.gz	PKEOCXXYUHANEX-UHFFFAOYSA-N	0	3	336.479	3.127	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1SCOCC(C)C	ZINC000865349519	1329688041	/nfs/dbraw/zinc/68/80/41/1329688041.db2.gz	TUSKMYXCTVSMOP-UHFFFAOYSA-N	0	3	338.521	3.215	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(N3CCCCCC3)cc2)CC1	ZINC000932140435	1329788347	/nfs/dbraw/zinc/78/83/47/1329788347.db2.gz	BJGKVLIWAUCGFZ-UHFFFAOYSA-N	0	3	341.499	3.447	20	30		EGEDHN
C[C@@H](Cc1cccnc1)NCc1cc(C#N)ccc1Br	ZINC000934231086	1329957305	/nfs/dbraw/zinc/95/73/05/1329957305.db2.gz	LNSLQABLTZESNB-LBPRGKRZSA-N	0	3	330.229	3.437	20	30		EGEDHN
CC1(C)CN(Cc2ccc(C#N)cc2)CC[C@H]1NC(=O)C1=CCCC1	ZINC000940673174	1331152798	/nfs/dbraw/zinc/15/27/98/1331152798.db2.gz	MPJFUPYKQPAKDQ-LJQANCHMSA-N	0	3	337.467	3.385	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3sccc3s2)[C@H](C)C1	ZINC000942183741	1331866730	/nfs/dbraw/zinc/86/67/30/1331866730.db2.gz	LERFSKKCIGUNMJ-CHWSQXEVSA-N	0	3	332.494	3.426	20	30		EGEDHN
C[C@H]1CN(Cc2cccc(C#N)c2)CC[C@@H]1NC(=O)Cc1ccccc1	ZINC000942188592	1331869549	/nfs/dbraw/zinc/86/95/49/1331869549.db2.gz	LMYNAWUJBGCSNO-UWJYYQICSA-N	0	3	347.462	3.128	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(C)CCC(F)(F)CC2)[C@@H](C)C1	ZINC000942192217	1331871932	/nfs/dbraw/zinc/87/19/32/1331871932.db2.gz	MMUFLNODIPGFRE-LSDHHAIUSA-N	0	3	326.431	3.052	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2coc3cc(F)ccc23)[C@@H](C)C1	ZINC000942203919	1331877269	/nfs/dbraw/zinc/87/72/69/1331877269.db2.gz	LOENZKNGRDWEJN-GUYCJALGSA-N	0	3	328.387	3.035	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2csc(C(F)(F)F)c2)[C@H](C)C1	ZINC000942260039	1331891444	/nfs/dbraw/zinc/89/14/44/1331891444.db2.gz	WFBWGOOTFNLFHV-YPMHNXCESA-N	0	3	344.402	3.230	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2scnc2C2CCCC2)[C@@H](C)C1	ZINC000942304783	1331898945	/nfs/dbraw/zinc/89/89/45/1331898945.db2.gz	RLYGULGAWWHAOY-ZFWWWQNUSA-N	0	3	333.501	3.427	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2occc2-c2ccccc2)[C@H](C)C1	ZINC000942392704	1331922732	/nfs/dbraw/zinc/92/27/32/1331922732.db2.gz	KAQLKMGWQQDUEG-VQIMIIECSA-N	0	3	336.435	3.410	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3ccccc3cc2F)[C@H](C)C1	ZINC000942442914	1331935066	/nfs/dbraw/zinc/93/50/66/1331935066.db2.gz	BGYRZCHFXQNCJV-QRWLVFNGSA-N	0	3	338.426	3.442	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C)c3cccnc23)[C@H](C)C1	ZINC000942522987	1331953846	/nfs/dbraw/zinc/95/38/46/1331953846.db2.gz	JSRXWGICQKOHMQ-VQIMIIECSA-N	0	3	335.451	3.007	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(CCC(F)(F)F)C[C@H]2C)cc1	ZINC000942553851	1331970507	/nfs/dbraw/zinc/97/05/07/1331970507.db2.gz	UXEKIQOUPLPCHK-CZUORRHYSA-N	0	3	338.373	3.061	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3c(ccc(C)c3C)[nH]2)[C@@H](C)C1	ZINC000942557848	1331972174	/nfs/dbraw/zinc/97/21/74/1331972174.db2.gz	NXBKYQGSGXYRSR-YJBOKZPZSA-N	0	3	337.467	3.248	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(F)c(Cl)cc2F)[C@H](C)C1	ZINC000942585459	1331990659	/nfs/dbraw/zinc/99/06/59/1331990659.db2.gz	FUHBAMBMAXZIMZ-BDJLRTHQSA-N	0	3	340.801	3.082	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3c(C)nsc3C)C[C@H]2C)C1	ZINC000942602887	1332000787	/nfs/dbraw/zinc/00/07/87/1332000787.db2.gz	OSXPFINCVOGINL-CXAGYDPISA-N	0	3	347.528	3.443	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3cccnc3C)C[C@H]2C)C1	ZINC000942603389	1332001523	/nfs/dbraw/zinc/00/15/23/1332001523.db2.gz	WUFWSXKRPIYSRJ-CRAIPNDOSA-N	0	3	327.472	3.073	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnc(-c3ccco3)s2)[C@H](C)C1	ZINC000944243242	1332352949	/nfs/dbraw/zinc/35/29/49/1332352949.db2.gz	ZUELCZWQPBHLHT-CHWSQXEVSA-N	0	3	331.441	3.029	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2sccc2C(F)F)[C@H](C)C1	ZINC000944530951	1332414168	/nfs/dbraw/zinc/41/41/68/1332414168.db2.gz	HPZCQQYHBZBWGP-DGCLKSJQSA-N	0	3	326.412	3.149	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2sccc2C(F)F)[C@H](C)C1	ZINC000944530953	1332414235	/nfs/dbraw/zinc/41/42/35/1332414235.db2.gz	HPZCQQYHBZBWGP-YPMHNXCESA-N	0	3	326.412	3.149	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(COC(C)C)cc2)[C@@H](C)C1	ZINC000944810301	1332426659	/nfs/dbraw/zinc/42/66/59/1332426659.db2.gz	HONHCFGRKWYEHD-FXAWDEMLSA-N	0	3	342.483	3.075	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3cc(C)cc(C)c3)CC2)[C@@H](C)C1	ZINC000944980937	1332468908	/nfs/dbraw/zinc/46/89/08/1332468908.db2.gz	YBZBTQZKDNVXBU-AZUAARDMSA-N	0	3	338.495	3.185	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cscc2C(F)(F)F)[C@@H](C)C1	ZINC000946316008	1332786490	/nfs/dbraw/zinc/78/64/90/1332786490.db2.gz	ZHPQFCWSNHQLSQ-SMDDNHRTSA-N	0	3	344.402	3.230	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3cc(Cl)c[nH]3)CC[C@@H]2C1	ZINC000946474403	1332838687	/nfs/dbraw/zinc/83/86/87/1332838687.db2.gz	IXUYNBKXIFFUEU-BETUJISGSA-N	0	3	342.270	3.205	20	30		EGEDHN
C/C=C(/C)C(=O)N1CC[C@H]2CN(Cc3ccccc3C#N)C[C@H]2CC1	ZINC000946542706	1332851199	/nfs/dbraw/zinc/85/11/99/1332851199.db2.gz	XUNHTKNNYCPVOJ-IHBSLASKSA-N	0	3	337.467	3.195	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)C3(C)CC(F)(F)C3)CC[C@@H]2C1	ZINC000946856938	1332917373	/nfs/dbraw/zinc/91/73/73/1332917373.db2.gz	URCOYQJDPIYRLP-OKILXGFUSA-N	0	3	346.849	3.345	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3cc(C)n(C)c3C)CC[C@@H]2C1	ZINC000946887470	1332925181	/nfs/dbraw/zinc/92/51/81/1332925181.db2.gz	JKJKULLKHLPHQV-CALCHBBNSA-N	0	3	349.906	3.178	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H]2CCN(Cc3ccc(C#N)cc3)[C@@H](C)C2)cn1	ZINC000947053232	1332992095	/nfs/dbraw/zinc/99/20/95/1332992095.db2.gz	WSBIKWQQODCWNX-JXFKEZNVSA-N	0	3	348.450	3.045	20	30		EGEDHN
Cc1cccc(C(=O)N[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@@H](C)C2)n1	ZINC000947075289	1333003112	/nfs/dbraw/zinc/00/31/12/1333003112.db2.gz	ORSKFLLBVFYXQV-QFBILLFUSA-N	0	3	348.450	3.045	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C(F)F)ccc2F)C[C@@H]1C	ZINC000947319493	1333087586	/nfs/dbraw/zinc/08/75/86/1333087586.db2.gz	RSMAYDRUTMETGL-JSGCOSHPSA-N	0	3	338.373	3.369	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2oc3ccc(F)cc3c2C)C[C@@H]1C	ZINC000947390787	1333112301	/nfs/dbraw/zinc/11/23/01/1333112301.db2.gz	ABFYTWJQVIOGCL-BBRMVZONSA-N	0	3	342.414	3.486	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2C3CC4CC(C3)CC2C4)C[C@@H]1C	ZINC000947396527	1333114465	/nfs/dbraw/zinc/11/44/65/1333114465.db2.gz	WNQMILILQXOOCE-XVSCRIFDSA-N	0	3	328.500	3.051	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2C3CC4CC(C3)CC2C4)C[C@H]1C	ZINC000947396526	1333114554	/nfs/dbraw/zinc/11/45/54/1333114554.db2.gz	WNQMILILQXOOCE-RJBHSWFSSA-N	0	3	328.500	3.051	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2C3CC4CC(C3)CC2C4)C[C@H]1C	ZINC000947396524	1333114671	/nfs/dbraw/zinc/11/46/71/1333114671.db2.gz	WNQMILILQXOOCE-NJKWNDLUSA-N	0	3	328.500	3.051	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccc3ccc(C)nc32)C[C@@H]1C	ZINC000947432939	1333126532	/nfs/dbraw/zinc/12/65/32/1333126532.db2.gz	CUCMWMTWHPARLS-FUHWJXTLSA-N	0	3	335.451	3.149	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(-c3cccs3)on2)C[C@H]1C	ZINC000947584894	1333183030	/nfs/dbraw/zinc/18/30/30/1333183030.db2.gz	OFTVYDBDGVSCRH-CHWSQXEVSA-N	0	3	331.441	3.172	20	30		EGEDHN
Cc1coc(C(=O)N[C@H]2CCN(Cc3ccc(C#N)cc3)[C@@H](C)C2)c1	ZINC000947630274	1333200845	/nfs/dbraw/zinc/20/08/45/1333200845.db2.gz	XTHIHRCJJKZIND-YJBOKZPZSA-N	0	3	337.423	3.243	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)C2(C)CC=CC2)CCN1Cc1ccc(C#N)cc1	ZINC000947693117	1333226861	/nfs/dbraw/zinc/22/68/61/1333226861.db2.gz	HDLKYVQZZVDIOJ-VQIMIIECSA-N	0	3	337.467	3.384	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2c(F)ccc(F)c2Cl)C[C@@H]1C	ZINC000947734576	1333244838	/nfs/dbraw/zinc/24/48/38/1333244838.db2.gz	BJEAXQWSUVVINN-QWRGUYRKSA-N	0	3	328.790	3.387	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(F)cc3cccnc32)C[C@@H]1C	ZINC000947767179	1333254954	/nfs/dbraw/zinc/25/49/54/1333254954.db2.gz	METCKJUPNJGIGL-XJKSGUPXSA-N	0	3	327.403	3.143	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2c[nH]c3c2cccc3C)C[C@@H]1C	ZINC000947776864	1333258324	/nfs/dbraw/zinc/25/83/24/1333258324.db2.gz	ZSMYUXCUVMMCHZ-FUHWJXTLSA-N	0	3	337.467	3.011	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cccc3ccccc32)C[C@@H]1C	ZINC000947956894	1333319558	/nfs/dbraw/zinc/31/95/58/1333319558.db2.gz	GFXDZRIFJSLYMC-PXNSSMCTSA-N	0	3	334.463	3.375	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3ccccc3C)CCC2)C[C@H]1C	ZINC000947974836	1333328817	/nfs/dbraw/zinc/32/88/17/1333328817.db2.gz	HJMJMUVDFUJRKO-MOPGFXCFSA-N	0	3	338.495	3.409	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)c(F)cc2Cl)C[C@H]1C	ZINC000947975303	1333329632	/nfs/dbraw/zinc/32/96/32/1333329632.db2.gz	LZJSQGUFGANLEC-ZIAGYGMSSA-N	0	3	336.838	3.394	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)[C@@]2(c3ccccc3)C[C@H](F)C2)C[C@@H]1C	ZINC000947980972	1333330951	/nfs/dbraw/zinc/33/09/51/1333330951.db2.gz	SLLWDUZAEZGOCX-WBKMXMRLSA-N	0	3	342.458	3.049	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3ccc(Cl)cc3)CC2)C[C@@H]1C	ZINC000948001633	1333337747	/nfs/dbraw/zinc/33/77/47/1333337747.db2.gz	CNMLKZFZDHDRAM-YJBOKZPZSA-N	0	3	344.886	3.364	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(OCC3CC3)cc2)C[C@@H]1C	ZINC000948039466	1333349779	/nfs/dbraw/zinc/34/97/79/1333349779.db2.gz	HLVONKNRSYULFO-QFBILLFUSA-N	0	3	340.467	3.081	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(F)c3occc32)C[C@H]1C	ZINC000948044294	1333352333	/nfs/dbraw/zinc/35/23/33/1333352333.db2.gz	OUPJDKIPPRETIF-ZIAGYGMSSA-N	0	3	328.387	3.178	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2coc3c2cccc3OC)CC1	ZINC000948368881	1333497591	/nfs/dbraw/zinc/49/75/91/1333497591.db2.gz	STJBFVURMRSJRG-OAHLLOKOSA-N	0	3	340.423	3.001	20	30		EGEDHN
C=CCOc1ccc(C(=O)N(C)[C@H]2CCCN(CC#CC)CC2)cc1	ZINC000948560445	1333576805	/nfs/dbraw/zinc/57/68/05/1333576805.db2.gz	BAYCNIPVDHGHTI-IBGZPJMESA-N	0	3	340.467	3.201	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)C2(c3ccccc3)CCC2)CC1	ZINC000948602529	1333592346	/nfs/dbraw/zinc/59/23/46/1333592346.db2.gz	NJUVRTSYAWYAIL-HXUWFJFHSA-N	0	3	338.495	3.445	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccc(F)cc2F)CC1	ZINC000948642809	1333609070	/nfs/dbraw/zinc/60/90/70/1333609070.db2.gz	OANDYBMMVAPUQI-BPQIPLTHSA-N	0	3	346.421	3.014	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)[C@H]2CCCCC2(F)F)CC1	ZINC000948648781	1333612300	/nfs/dbraw/zinc/61/23/00/1333612300.db2.gz	WAYPJTODLCUBBM-JKSUJKDBSA-N	0	3	326.431	3.148	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2oc3ccccc3c2OC)CC1	ZINC000948664977	1333619657	/nfs/dbraw/zinc/61/96/57/1333619657.db2.gz	CALXHTQBFAODGG-OAHLLOKOSA-N	0	3	340.423	3.001	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2ccc(F)c(Cl)c2)CC1	ZINC000948729085	1333649515	/nfs/dbraw/zinc/64/95/15/1333649515.db2.gz	AMEAILQOQKQOIU-OAHLLOKOSA-N	0	3	336.838	3.429	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2cc3cccc(OC)c3o2)CC1	ZINC000948729460	1333650229	/nfs/dbraw/zinc/65/02/29/1333650229.db2.gz	KMQWOTNWYIVSOW-INIZCTEOSA-N	0	3	340.423	3.001	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@H]2CCCN(Cc3ccccn3)CC2)C1	ZINC000948747169	1333657385	/nfs/dbraw/zinc/65/73/85/1333657385.db2.gz	QHOPIAGWWDMPMJ-SFHVURJKSA-N	0	3	327.472	3.251	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@@H]2CCCN(Cc3conc3CC)CC2)C1	ZINC000948753433	1333662089	/nfs/dbraw/zinc/66/20/89/1333662089.db2.gz	KDXHYRWOGGZAHM-QGZVFWFLSA-N	0	3	345.487	3.406	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)C(C)(C)c2cccc(F)c2)CC1	ZINC000948772635	1333672106	/nfs/dbraw/zinc/67/21/06/1333672106.db2.gz	ZSKGNTVHVQNHJX-SFHVURJKSA-N	0	3	330.447	3.049	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccc(C)c(C)c2)CC1	ZINC000948840785	1333705274	/nfs/dbraw/zinc/70/52/74/1333705274.db2.gz	MLYXQOCULVQNCA-QHAWAJNXSA-N	0	3	338.495	3.353	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2ccc3cccnc3c2)CC1	ZINC000948864326	1333713838	/nfs/dbraw/zinc/71/38/38/1333713838.db2.gz	CHNOWNSJBUJFNI-LJQANCHMSA-N	0	3	335.451	3.185	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@H]1CNC(=O)c1ccc(C)nc1	ZINC000948890420	1333721067	/nfs/dbraw/zinc/72/10/67/1333721067.db2.gz	QYPXNTIKNBGVJJ-HXUWFJFHSA-N	0	3	335.451	3.295	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@H]1CNC(=O)c1cncc(C)c1	ZINC000948906112	1333728032	/nfs/dbraw/zinc/72/80/32/1333728032.db2.gz	IXXJJQGAGLSPKX-HXUWFJFHSA-N	0	3	335.451	3.295	20	30		EGEDHN
N#Cc1cc(C(=O)NC[C@@H]2c3ccccc3CCN2CCC2CC2)c[nH]1	ZINC000948906479	1333728050	/nfs/dbraw/zinc/72/80/50/1333728050.db2.gz	NHVYZYBZRKKXKZ-HXUWFJFHSA-N	0	3	348.450	3.016	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1sccc1C(C)C)CCO2	ZINC000949248249	1333802800	/nfs/dbraw/zinc/80/28/00/1333802800.db2.gz	PGZINBBQECQHTC-UHFFFAOYSA-N	0	3	348.512	3.365	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)CCC3CCCC3)CC2)C1	ZINC000949285671	1333815129	/nfs/dbraw/zinc/81/51/29/1333815129.db2.gz	RCLDOHZXKMOFHA-UHFFFAOYSA-N	0	3	334.504	3.226	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)CC(C)(C)C3CC3)CC2)C1	ZINC000949358516	1333829844	/nfs/dbraw/zinc/82/98/44/1333829844.db2.gz	YHSJPILNLBUOQZ-UHFFFAOYSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C[C@@H]3CCC[C@H]3C)CC2)C1	ZINC000949369937	1333832574	/nfs/dbraw/zinc/83/25/74/1333832574.db2.gz	HPKYCRLJXASIJD-MSOLQXFVSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C(C)(C)C(=C)Cl)CC2)C1	ZINC000949375750	1333833729	/nfs/dbraw/zinc/83/37/29/1333833729.db2.gz	KUXKSJPPEBSZHC-UHFFFAOYSA-N	0	3	340.895	3.035	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C[C@H]3C=CCCC3)CC2)C1	ZINC000949394703	1333835707	/nfs/dbraw/zinc/83/57/07/1333835707.db2.gz	AHPACDDBRARPKF-SFHVURJKSA-N	0	3	332.488	3.002	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@@H]3CCCC[C@@H]3C)CC2)C1	ZINC000949450749	1333850773	/nfs/dbraw/zinc/85/07/73/1333850773.db2.gz	ITBJPMDCXWPHLX-RBUKOAKNSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3ccc(F)cc3C)CC2)C1	ZINC000949515435	1333864934	/nfs/dbraw/zinc/86/49/34/1333864934.db2.gz	RNQKLMZTKVRBQG-UHFFFAOYSA-N	0	3	346.446	3.017	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccc3c4c(cccc42)CC3)C1	ZINC000967287050	1335689696	/nfs/dbraw/zinc/68/96/96/1335689696.db2.gz	CRVGEZQXXVCSKH-IIBYNOLFSA-N	0	3	346.474	3.402	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)Cc2cccc(C)c2Cl)C1	ZINC000967340515	1335707405	/nfs/dbraw/zinc/70/74/05/1335707405.db2.gz	WOEASKITYHYMIY-WMLDXEAASA-N	0	3	332.875	3.041	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2c[nH]nc2-c2ccccc2)C1	ZINC000967553433	1335775772	/nfs/dbraw/zinc/77/57/72/1335775772.db2.gz	APXNRLQHPXLLCO-CRAIPNDOSA-N	0	3	338.455	3.093	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2oc3ccccc3c2OC)C1	ZINC000967726504	1335808065	/nfs/dbraw/zinc/80/80/65/1335808065.db2.gz	VYURUSISCKSYNB-HOCLYGCPSA-N	0	3	342.439	3.458	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2c(F)cc(F)cc2F)C1	ZINC000968076292	1335853455	/nfs/dbraw/zinc/85/34/55/1335853455.db2.gz	CVAZDVXMOSIEDE-NHYWBVRUSA-N	0	3	326.362	3.120	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)Cc2cn(C)c3ccccc23)C1	ZINC000968104610	1335857412	/nfs/dbraw/zinc/85/74/12/1335857412.db2.gz	GMYSYPJJNRMGDK-VQIMIIECSA-N	0	3	339.483	3.124	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccc(F)c3ccccc23)C1	ZINC000968346573	1335896338	/nfs/dbraw/zinc/89/63/38/1335896338.db2.gz	XSYLJZXSTWGMTI-FOIQADDNSA-N	0	3	338.426	3.442	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)Cc2ccc(C(C)(C)C)cc2)C1	ZINC000968354462	1335899911	/nfs/dbraw/zinc/89/99/11/1335899911.db2.gz	SZOKSPGQAQDAER-FXAWDEMLSA-N	0	3	340.511	3.377	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2ccc(C)c(OCC)c2)C1	ZINC000968382791	1335912479	/nfs/dbraw/zinc/91/24/79/1335912479.db2.gz	VUVCCCWDWLIJDL-YJBOKZPZSA-N	0	3	330.472	3.410	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)Cc2csc(C(C)(C)C)n2)C1	ZINC000968412802	1335923678	/nfs/dbraw/zinc/92/36/78/1335923678.db2.gz	DNQFOSMLIUUCST-GDBMZVCRSA-N	0	3	349.544	3.386	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)Cc2cccc3ccccc32)C1	ZINC000968568546	1335962763	/nfs/dbraw/zinc/96/27/63/1335962763.db2.gz	ASDSZMSPSNEVBF-UWJYYQICSA-N	0	3	334.463	3.232	20	30		EGEDHN
CC1(CC(=O)N2CC[C@@H](NCc3ccc(F)c(C#N)c3)C2)CCCC1	ZINC000968577402	1335968365	/nfs/dbraw/zinc/96/83/65/1335968365.db2.gz	AZGLPAGQKCZRGP-QGZVFWFLSA-N	0	3	343.446	3.358	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cccc(Cl)c2Cl)C1	ZINC000968584149	1335973534	/nfs/dbraw/zinc/97/35/34/1335973534.db2.gz	SZGSCTDTYRZIBM-DOMZBBRYSA-N	0	3	339.266	3.457	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(CC(C)C)cc2)C1	ZINC000968628530	1335990265	/nfs/dbraw/zinc/99/02/65/1335990265.db2.gz	ZZKGSBJHQHNIAM-XLIONFOSSA-N	0	3	326.484	3.349	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2cc(C)n(C(C)C)c2C)C1	ZINC000968630695	1335990572	/nfs/dbraw/zinc/99/05/72/1335990572.db2.gz	APWIQJAHTANGTR-HNAYVOBHSA-N	0	3	329.488	3.149	20	30		EGEDHN
C=C(C)CCN1CC[C@H](C)[C@@H](NC(=O)c2scnc2Cl)C1	ZINC000968651045	1335996005	/nfs/dbraw/zinc/99/60/05/1335996005.db2.gz	COAFSRIRCNECDB-RYUDHWBXSA-N	0	3	327.881	3.203	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)C(C)(C)c2ccccc2OC)C1	ZINC000968697774	1336016276	/nfs/dbraw/zinc/01/62/76/1336016276.db2.gz	IVWGTZFROCAHII-AEFFLSMTSA-N	0	3	344.499	3.376	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)Cc2c(C)oc3ccccc32)C1	ZINC000968713568	1336021593	/nfs/dbraw/zinc/02/15/93/1336021593.db2.gz	SLSBKADPJKGJAE-DNVCBOLYSA-N	0	3	338.451	3.134	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)C1C2CC3CC(C2)CC1C3	ZINC000968890758	1336082024	/nfs/dbraw/zinc/08/20/24/1336082024.db2.gz	MYNBDYADRVOSSI-OPFHRDBUSA-N	0	3	342.527	3.443	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cc(-c2ccccc2)n[nH]1	ZINC000968941626	1336097624	/nfs/dbraw/zinc/09/76/24/1336097624.db2.gz	POPVGULLCDFKDE-KRWDZBQOSA-N	0	3	338.455	3.237	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1c(C)[nH]c2ccccc21	ZINC000968942812	1336099273	/nfs/dbraw/zinc/09/92/73/1336099273.db2.gz	ZWGNEOMFQPGKAH-QGZVFWFLSA-N	0	3	337.467	3.474	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)[C@H]1COc2cc(C)c(C)cc21	ZINC000968965644	1336104092	/nfs/dbraw/zinc/10/40/92/1336104092.db2.gz	UPPLHQXHIDLFDH-MJGOQNOKSA-N	0	3	342.483	3.326	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccc(F)c(F)c1F	ZINC000969008201	1336116914	/nfs/dbraw/zinc/11/69/14/1336116914.db2.gz	OEXWQJDLWZHRQR-GFCCVEGCSA-N	0	3	326.362	3.264	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cccc(C(F)(F)F)n1	ZINC000969087830	1336139145	/nfs/dbraw/zinc/13/91/45/1336139145.db2.gz	GEOCONZYYVGDMS-CYBMUJFWSA-N	0	3	341.377	3.261	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccc2ccn(C)c2c1	ZINC000969097687	1336142158	/nfs/dbraw/zinc/14/21/58/1336142158.db2.gz	OGGHNDVTXSDYOF-GOSISDBHSA-N	0	3	325.456	3.339	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)[C@H]1Cc2cc(C)c(C)cc2O1	ZINC000969153147	1336164746	/nfs/dbraw/zinc/16/47/46/1336164746.db2.gz	AZVOZUPXRWGNTO-UYAOXDASSA-N	0	3	342.483	3.154	20	30		EGEDHN
C#CCCN1CCCCC[C@@H]1CNC(=O)c1cnc(C(C)C)s1	ZINC000969173854	1336171318	/nfs/dbraw/zinc/17/13/18/1336171318.db2.gz	QYZCSKCVOVQWSA-OAHLLOKOSA-N	0	3	333.501	3.264	20	30		EGEDHN
Cc1cccc([C@H](C)N2CC([C@@H](C)NC(=O)c3ccc(C#N)[nH]3)C2)c1	ZINC000969506013	1336220035	/nfs/dbraw/zinc/22/00/35/1336220035.db2.gz	LDQSBEHFPJIEQB-CABCVRRESA-N	0	3	336.439	3.006	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](NCc3cc(C)ccc3OC)C2)C1	ZINC000969883441	1336257111	/nfs/dbraw/zinc/25/71/11/1336257111.db2.gz	ROOZJPGOTNJABH-QGZVFWFLSA-N	0	3	328.456	3.050	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C1)c1ccsc1	ZINC000969924172	1336261429	/nfs/dbraw/zinc/26/14/29/1336261429.db2.gz	OGYGWWWPWNMNAP-GXTWGEPZSA-N	0	3	345.493	3.175	20	30		EGEDHN
CN(C(=O)C1(F)CCCC1)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001005625620	1336384140	/nfs/dbraw/zinc/38/41/40/1336384140.db2.gz	LXPBVRSDZQTTPQ-UHFFFAOYSA-N	0	3	343.446	3.263	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cc(C)nn2C(CC)CC)CC1	ZINC001005632195	1336385861	/nfs/dbraw/zinc/38/58/61/1336385861.db2.gz	LUKXERAIKRFLMY-UHFFFAOYSA-N	0	3	332.492	3.275	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccc(C(F)(F)F)nc2)CC1	ZINC001005794305	1336402402	/nfs/dbraw/zinc/40/24/02/1336402402.db2.gz	GYVWRVMWLDSWBI-UHFFFAOYSA-N	0	3	341.377	3.213	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2c(F)ccc(F)c2OC)CC1	ZINC001005812428	1336404063	/nfs/dbraw/zinc/40/40/63/1336404063.db2.gz	UQBPETPZYLWDGU-UHFFFAOYSA-N	0	3	338.398	3.086	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2c(F)cc(F)cc2F)CC1	ZINC001005916573	1336421747	/nfs/dbraw/zinc/42/17/47/1336421747.db2.gz	DMVGRHAUWDMNJR-UHFFFAOYSA-N	0	3	326.362	3.216	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cccc3c2ccn3C)CC1	ZINC001006144520	1336459104	/nfs/dbraw/zinc/45/91/04/1336459104.db2.gz	GINDJRXNVNEMOL-UHFFFAOYSA-N	0	3	325.456	3.291	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cc(F)c3ncccc3c2)CC1	ZINC001006152155	1336461045	/nfs/dbraw/zinc/46/10/45/1336461045.db2.gz	PQSWOIZNIDTCNT-UHFFFAOYSA-N	0	3	327.403	3.096	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)Cc2c(C)oc3ccccc32)CC1	ZINC001006492643	1336516588	/nfs/dbraw/zinc/51/65/88/1336516588.db2.gz	YJMNBPRIMLBZKY-UHFFFAOYSA-N	0	3	326.440	3.393	20	30		EGEDHN
CC[C@@H](c1ccccc1)N1CCC[C@@H](NC(=O)c2cc(C#N)c[nH]2)C1	ZINC001007031035	1336628671	/nfs/dbraw/zinc/62/86/71/1336628671.db2.gz	UOHPBKVXRUBEKP-MJGOQNOKSA-N	0	3	336.439	3.232	20	30		EGEDHN
C#CCCN1CCC[C@@H](NC(=O)c2ccc3c4c(cccc42)CC3)C1	ZINC001007866090	1336722079	/nfs/dbraw/zinc/72/20/79/1336722079.db2.gz	BOABPYDGAHMHKF-GOSISDBHSA-N	0	3	332.447	3.156	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2nc(Cl)sc2Cl)C1	ZINC001008170724	1336783773	/nfs/dbraw/zinc/78/37/73/1336783773.db2.gz	PKTQYPMACVMANB-VIFPVBQESA-N	0	3	334.272	3.220	20	30		EGEDHN
C#CCCN1CCC[C@H](NC(=O)Cc2cccc3sccc32)C1	ZINC001008746069	1336919150	/nfs/dbraw/zinc/91/91/50/1336919150.db2.gz	HCMLSEQWOHUDCZ-INIZCTEOSA-N	0	3	326.465	3.048	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN([C@@H](CC)c3ccccc3)C2)nc1	ZINC001009270815	1336994387	/nfs/dbraw/zinc/99/43/87/1336994387.db2.gz	TYZROJOIKYZTKQ-CTNGQTDRSA-N	0	3	347.462	3.408	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN(Cc3ccccc3CC)C2)cn1	ZINC001009272653	1336995025	/nfs/dbraw/zinc/99/50/25/1336995025.db2.gz	YRQADGHRCVXQBY-OAQYLSRUSA-N	0	3	347.462	3.020	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2ccccc2OCC2CC2)C1	ZINC001009642840	1337051256	/nfs/dbraw/zinc/05/12/56/1337051256.db2.gz	KORLCXPMTOUIKE-KRWDZBQOSA-N	0	3	328.456	3.246	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(CC[C@@H]3CCCC3(F)F)C2)cc1	ZINC001015481775	1338155140	/nfs/dbraw/zinc/15/51/40/1338155140.db2.gz	HMIJNAOEFCJYBH-ZWKOTPCHSA-N	0	3	346.421	3.298	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2oc3ccc(F)cc3c2C)CC1	ZINC001016661547	1338682608	/nfs/dbraw/zinc/68/26/08/1338682608.db2.gz	FTPMETAEOYKWLP-QGZVFWFLSA-N	0	3	340.398	3.098	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)Cc2c(C)cccc2Cl)CC1	ZINC001016707782	1338697434	/nfs/dbraw/zinc/69/74/34/1338697434.db2.gz	AQPIKVRCRGYKFD-GOSISDBHSA-N	0	3	344.886	3.185	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)C23CCC(CC2)C3(C)C)CC1	ZINC001016865373	1338752088	/nfs/dbraw/zinc/75/20/88/1338752088.db2.gz	BJJHRQNNWFKKKG-BATSVXPKSA-N	0	3	328.500	3.197	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cc(C(CC)CC)no2)CC1	ZINC001016868902	1338753606	/nfs/dbraw/zinc/75/36/06/1338753606.db2.gz	ZGHARPGVRSYOQI-SFHVURJKSA-N	0	3	343.471	3.186	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2cc3cc(C)ccc3s2)CC1	ZINC001016910668	1338767230	/nfs/dbraw/zinc/76/72/30/1338767230.db2.gz	YJVVXXABOVBLNN-SFHVURJKSA-N	0	3	338.476	3.427	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)[C@H](C)c2ccc(C)s2)CC1	ZINC001016926924	1338773042	/nfs/dbraw/zinc/77/30/42/1338773042.db2.gz	OFADGIGFVVZWPV-WBVHZDCISA-N	0	3	330.497	3.154	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)C(C)(C)c2ccc(F)cc2)CC1	ZINC001016933551	1338773857	/nfs/dbraw/zinc/77/38/57/1338773857.db2.gz	KOZGENARACJOKW-GOSISDBHSA-N	0	3	342.458	3.097	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H](CN(C)Cc2ccccn2)C1	ZINC001017201350	1338945626	/nfs/dbraw/zinc/94/56/26/1338945626.db2.gz	IHHOWCATYICVTC-PXNSSMCTSA-N	0	3	329.488	3.354	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H](CN(C)Cc3ccccn3)C2)C1	ZINC001017206950	1338953088	/nfs/dbraw/zinc/95/30/88/1338953088.db2.gz	KSLQSWXILDXDJG-QGZVFWFLSA-N	0	3	327.472	3.108	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1nccc2occc21	ZINC001017758111	1339412774	/nfs/dbraw/zinc/41/27/74/1339412774.db2.gz	LSJGEBCVKCYCCF-GASCZTMLSA-N	0	3	325.412	3.083	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccc2cccnc21	ZINC001017782670	1339419699	/nfs/dbraw/zinc/41/96/99/1339419699.db2.gz	FKNLWDMQEZAGCB-BGYRXZFFSA-N	0	3	349.478	3.419	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1cc(C)ccc1C	ZINC001017884234	1339439472	/nfs/dbraw/zinc/43/94/72/1339439472.db2.gz	VWSBKSXXMXWXCR-BGYRXZFFSA-N	0	3	326.484	3.487	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@H]1OCCc2ccsc21	ZINC001018191499	1339526541	/nfs/dbraw/zinc/52/65/41/1339526541.db2.gz	AVEAIIOQASOERK-IXDOHACOSA-N	0	3	346.496	3.003	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H]1OCc2ccccc21	ZINC001018225203	1339539442	/nfs/dbraw/zinc/53/94/42/1339539442.db2.gz	APQPPQNQTVBPMH-NSHGMRRFSA-N	0	3	340.467	3.289	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)Cc1cccc(F)c1	ZINC001018336022	1339582588	/nfs/dbraw/zinc/58/25/88/1339582588.db2.gz	XALQVROCQBBDBZ-LZQZEXGQSA-N	0	3	330.447	3.256	20	30		EGEDHN
C[C@@]1(C(=O)N2CC[C@H](NCc3ccc(C#N)c(F)c3)C2)CC=CCC1	ZINC001018904805	1339748123	/nfs/dbraw/zinc/74/81/23/1339748123.db2.gz	FMYHKMMTBHBPDQ-FXAWDEMLSA-N	0	3	341.430	3.134	20	30		EGEDHN
C#CCCN1CCC[C@@H]1CNC(=O)c1c(Cl)oc2ccccc21	ZINC001028093036	1340421537	/nfs/dbraw/zinc/42/15/37/1340421537.db2.gz	BKVLTCZUESATAF-CYBMUJFWSA-N	0	3	330.815	3.304	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CCCN2C[C@@H](O)c2ccccc2)CC1	ZINC001028117192	1340438229	/nfs/dbraw/zinc/43/82/29/1340438229.db2.gz	NBDXQBFDQUXKIG-WOJBJXKFSA-N	0	3	342.483	3.047	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1cc(F)cc2cccnc21	ZINC001028178455	1340469688	/nfs/dbraw/zinc/46/96/88/1340469688.db2.gz	RDKNDIJIZWYVCY-MRXNPFEDSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1ccc2nc(C)sc2c1	ZINC001028242095	1340502850	/nfs/dbraw/zinc/50/28/50/1340502850.db2.gz	BPUZCDYVKJBLMS-OAHLLOKOSA-N	0	3	329.469	3.375	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCCN2[C@@H](C)c2ccccc2)nc1	ZINC001028271324	1340524414	/nfs/dbraw/zinc/52/44/14/1340524414.db2.gz	FBHPNDVVYASYSS-QFBILLFUSA-N	0	3	333.435	3.018	20	30		EGEDHN
C=CCCN1CCC[C@H]1CNC(=O)c1sc(Cl)nc1Cl	ZINC001028320628	1340562419	/nfs/dbraw/zinc/56/24/19/1340562419.db2.gz	SUUQAGHUWGVMKB-VIFPVBQESA-N	0	3	334.272	3.220	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1cc2ccccc2n1CC	ZINC001028334325	1340571044	/nfs/dbraw/zinc/57/10/44/1340571044.db2.gz	WKSMMWPDPDIVHT-KRWDZBQOSA-N	0	3	325.456	3.432	20	30		EGEDHN
Cc1cc(C)c(C(=O)NC[C@H]2CCN(Cc3cccc(C#N)c3)C2)o1	ZINC001028463110	1340653412	/nfs/dbraw/zinc/65/34/12/1340653412.db2.gz	QMMMFWBSJFFUPC-GOSISDBHSA-N	0	3	337.423	3.020	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)c2cc3cccc(C)c3s2)C1	ZINC001028643554	1340739115	/nfs/dbraw/zinc/73/91/15/1340739115.db2.gz	PVHLFYLPCDIXNI-OAHLLOKOSA-N	0	3	326.465	3.285	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC([C@H](C)NCc2ccn(C(C)C)n2)CC1	ZINC001029125645	1340936130	/nfs/dbraw/zinc/93/61/30/1340936130.db2.gz	FUDZZWVRGJIRRW-INIZCTEOSA-N	0	3	346.519	3.393	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC([C@@H](C)NCc3cnc(C)o3)CC2)C1	ZINC001029142702	1340941856	/nfs/dbraw/zinc/94/18/56/1340941856.db2.gz	VKVBCSOUFXRUGT-CQSZACIVSA-N	0	3	331.460	3.056	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1C[C@H]2CC[C@@H](C1)N2Cc1cccc2ccccc21	ZINC001029244425	1340960635	/nfs/dbraw/zinc/96/06/35/1340960635.db2.gz	GFDYTUJZTBASGB-ZYSHUDEJSA-N	0	3	333.435	3.175	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCN(C(=O)[C@]23C[C@H]2CCC3)C1	ZINC001029789233	1341073327	/nfs/dbraw/zinc/07/33/27/1341073327.db2.gz	NTCKUMUOHSFFQM-QMTMVMCOSA-N	0	3	343.496	3.090	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](CN(C)Cc2cncc(F)c2)C1	ZINC001029797812	1341076218	/nfs/dbraw/zinc/07/62/18/1341076218.db2.gz	BBNOXYDNEIRUDE-HNNXBMFYSA-N	0	3	333.451	3.103	20	30		EGEDHN
C=C[C@H](C(=O)N1CC[C@@H](CN(C)Cc2cccnc2)C1)c1ccccc1	ZINC001029906832	1341111662	/nfs/dbraw/zinc/11/16/62/1341111662.db2.gz	AFGSYIKOVZJZID-FPOVZHCZSA-N	0	3	349.478	3.332	20	30		EGEDHN
CCN1CCC[C@@H](N(Cc2ccccc2)C(=O)c2ccc(C#N)[nH]2)C1	ZINC001029918302	1341118586	/nfs/dbraw/zinc/11/85/86/1341118586.db2.gz	BDVHTMRGCXKGSZ-GOSISDBHSA-N	0	3	336.439	3.013	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N(Cc1ccccc1)[C@H]1CCCN(CC)C1	ZINC001029921712	1341120632	/nfs/dbraw/zinc/12/06/32/1341120632.db2.gz	PTVHNRZOHFILLR-ZCNNSNEGSA-N	0	3	342.483	3.091	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)CC1CCN(C(=O)CC2CC2)CC1	ZINC001029925187	1341121772	/nfs/dbraw/zinc/12/17/72/1341121772.db2.gz	HTWRZKSDPAOGOQ-UHFFFAOYSA-N	0	3	331.485	3.090	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC(CN(C)Cc2cc(C)ncn2)CC1	ZINC001029982457	1341143532	/nfs/dbraw/zinc/14/35/32/1341143532.db2.gz	AEOOXNYVDYEEPM-UHFFFAOYSA-N	0	3	344.503	3.058	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC(CN(C)Cc3conc3C)CC2)CC1	ZINC001029990272	1341147997	/nfs/dbraw/zinc/14/79/97/1341147997.db2.gz	IXNMIMMBMGFIDI-UHFFFAOYSA-N	0	3	345.487	3.400	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC(CN(C)Cc2cnc(C)o2)CC1	ZINC001029992340	1341149443	/nfs/dbraw/zinc/14/94/43/1341149443.db2.gz	UNRVAJKDIIDMHM-IBGZPJMESA-N	0	3	333.476	3.256	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCCN(C(=O)[C@]34C[C@H]3CCCC4)C2)s1	ZINC001030021066	1341159822	/nfs/dbraw/zinc/15/98/22/1341159822.db2.gz	BAZCQLXJRAEVCE-ZRGWGRIASA-N	0	3	343.496	3.281	20	30		EGEDHN
C=CCn1cccc1C(=O)NCC1CN([C@@H](C)c2cccc(C)c2)C1	ZINC001031733770	1341395126	/nfs/dbraw/zinc/39/51/26/1341395126.db2.gz	NHGGOMGJEUBMFE-KRWDZBQOSA-N	0	3	337.467	3.405	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NCC1CN([C@@H](C)c2ccccc2C)C1	ZINC001032047169	1341445311	/nfs/dbraw/zinc/44/53/11/1341445311.db2.gz	CAGUKLGEYGOCES-VDGAXYAQSA-N	0	3	342.483	3.085	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(Cl)c(OC)c1	ZINC001032666469	1341576458	/nfs/dbraw/zinc/57/64/58/1341576458.db2.gz	QJXHMIDKGJNKKC-GJZGRUSLSA-N	0	3	334.847	3.214	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H](C)Oc1cccc(C)c1	ZINC001032770613	1341608993	/nfs/dbraw/zinc/60/89/93/1341608993.db2.gz	GRKAHNARCLNNNY-BZSNNMDCSA-N	0	3	328.456	3.014	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](N(C)C(=O)c2cc3c(C)nn(C)c3s2)C1	ZINC001033309794	1341777109	/nfs/dbraw/zinc/77/71/09/1341777109.db2.gz	QJBWQVXKFSLFRA-CQSZACIVSA-N	0	3	346.500	3.056	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)Cn2cc(C)c3ccccc32)C1	ZINC001033496473	1341846478	/nfs/dbraw/zinc/84/64/78/1341846478.db2.gz	ZNUNIPNTHWTNKU-QGZVFWFLSA-N	0	3	325.456	3.059	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@H]2CCN(Cc3ccc(C)c(C)c3)C2)nc1	ZINC001033596256	1341889838	/nfs/dbraw/zinc/88/98/38/1341889838.db2.gz	JHQFYMWSPRAVAO-FQEVSTJZSA-N	0	3	347.462	3.026	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@@H]2CCN([C@H](C)c3cccc(C)c3)C2)cn1	ZINC001033597705	1341889884	/nfs/dbraw/zinc/88/98/84/1341889884.db2.gz	USVJUSCESJTNDA-DYESRHJHSA-N	0	3	347.462	3.279	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@@H]2CCN([C@@H](C)c3cccc(C)c3)C2)cn1	ZINC001033597706	1341889923	/nfs/dbraw/zinc/88/99/23/1341889923.db2.gz	USVJUSCESJTNDA-LAUBAEHRSA-N	0	3	347.462	3.279	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)Cc2c[nH]c3cccc(C)c23)C1	ZINC001033597261	1341889958	/nfs/dbraw/zinc/88/99/58/1341889958.db2.gz	QJDZMGASUOVQQQ-QGZVFWFLSA-N	0	3	325.456	3.128	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2ccc(OCC(C)C)cc2)C1	ZINC001033639177	1341921834	/nfs/dbraw/zinc/92/18/34/1341921834.db2.gz	DBSHCUACJIWYFO-GOSISDBHSA-N	0	3	330.472	3.444	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2ccc(OC3CCC3)cc2)C1	ZINC001033674566	1341939998	/nfs/dbraw/zinc/93/99/98/1341939998.db2.gz	AKMRYFQSOJZCQV-QGZVFWFLSA-N	0	3	328.456	3.340	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](N(C)C(=O)c2ccc(P(C)(C)=O)cc2)C1	ZINC001033684805	1341951236	/nfs/dbraw/zinc/95/12/36/1341951236.db2.gz	MDUDOPVFPOPERW-QGZVFWFLSA-N	0	3	348.427	3.047	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@@H]2CC[C@H](c3ccccc3)O2)C1	ZINC001033829914	1342030152	/nfs/dbraw/zinc/03/01/52/1342030152.db2.gz	CNCUVJTWDFTXNR-ZCNNSNEGSA-N	0	3	342.483	3.406	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccnn2C2CCCC2)C1	ZINC001033844548	1342039882	/nfs/dbraw/zinc/03/98/82/1342039882.db2.gz	WAHRNNRULRMPLV-QGZVFWFLSA-N	0	3	330.476	3.111	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2cccc(OCCC)c2)C1	ZINC001033844656	1342040300	/nfs/dbraw/zinc/04/03/00/1342040300.db2.gz	APSAFEMTXNUIIV-SFHVURJKSA-N	0	3	328.456	3.035	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2cc(C3CCCCC3)n[nH]2)C1	ZINC001033855852	1342046252	/nfs/dbraw/zinc/04/62/52/1342046252.db2.gz	KOJZBIJZOZHJPM-KRWDZBQOSA-N	0	3	342.487	3.017	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)C2C3CC4CC(C3)CC2C4)C1	ZINC001033857258	1342046892	/nfs/dbraw/zinc/04/68/92/1342046892.db2.gz	BWMLUBKLRRYLFE-BIKXEMDZSA-N	0	3	328.500	3.005	20	30		EGEDHN
C=CCOc1ccc(C(=O)N(CC)[C@@H]2CCN(CCCF)C2)cc1	ZINC001033879940	1342057148	/nfs/dbraw/zinc/05/71/48/1342057148.db2.gz	IEIMIBGACRWQEV-QGZVFWFLSA-N	0	3	334.435	3.147	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2nsc3ccc(C)cc32)C1	ZINC001033920114	1342089251	/nfs/dbraw/zinc/08/92/51/1342089251.db2.gz	PUSAVGKCAFVJLI-HNNXBMFYSA-N	0	3	341.480	3.164	20	30		EGEDHN
C#Cc1cncc(C(=O)N(CC)[C@H]2CCN(Cc3ccc(C)cc3)C2)c1	ZINC001033946593	1342106726	/nfs/dbraw/zinc/10/67/26/1342106726.db2.gz	ICOVDIBINKAMBC-NRFANRHFSA-N	0	3	347.462	3.108	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cccc(N3CC=CC3)c2)C1	ZINC001033972438	1342123200	/nfs/dbraw/zinc/12/32/00/1342123200.db2.gz	QRVOQQMIXADUJG-HXUWFJFHSA-N	0	3	339.483	3.175	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cccc(N3CCCC3)c2)C1	ZINC001033996055	1342137097	/nfs/dbraw/zinc/13/70/97/1342137097.db2.gz	AVEBMQONIIHEEX-HXUWFJFHSA-N	0	3	341.499	3.399	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2cc(-c3ccccc3)ccn2)C1	ZINC001033997691	1342138126	/nfs/dbraw/zinc/13/81/26/1342138126.db2.gz	DTCJGIVTBILXKE-HXUWFJFHSA-N	0	3	347.462	3.308	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cnn([C@H](C)CC)c2C)C1	ZINC001034017265	1342155474	/nfs/dbraw/zinc/15/54/74/1342155474.db2.gz	QSYAZTBVAYVJIT-NVXWUHKLSA-N	0	3	332.492	3.275	20	30		EGEDHN
C#Cc1ccc(C(=O)N(CC)[C@H]2CCN(CC3=CCCCC3)C2)nc1	ZINC001034022046	1342159116	/nfs/dbraw/zinc/15/91/16/1342159116.db2.gz	AVWOAALVFWIOCC-IBGZPJMESA-N	0	3	337.467	3.100	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccc(-c4ccccc4)nc3)[C@@H]2C1	ZINC001076393598	1356567184	/nfs/dbraw/zinc/56/71/84/1356567184.db2.gz	MWBLJAUQPLNCGA-PZJWPPBQSA-N	0	3	347.462	3.471	20	30		EGEDHN
N#Cc1ccc(CN2CCCC[C@H](NC(=O)CC3CCC3)C2)cc1	ZINC001034139490	1342266421	/nfs/dbraw/zinc/26/64/21/1342266421.db2.gz	YKTONLXQFMOISF-IBGZPJMESA-N	0	3	325.456	3.219	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cc(C)n([C@H](C)CC)n2)C1	ZINC001034281792	1342371647	/nfs/dbraw/zinc/37/16/47/1342371647.db2.gz	KIXMNMNXDUNYLN-WBVHZDCISA-N	0	3	332.492	3.323	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc3[nH]nc(C)c3c2)C1	ZINC001034304130	1342386576	/nfs/dbraw/zinc/38/65/76/1342386576.db2.gz	PDJZZKPSQZTCFW-INIZCTEOSA-N	0	3	326.444	3.032	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccncc2OC(C)C)C1	ZINC001034331586	1342406068	/nfs/dbraw/zinc/40/60/68/1342406068.db2.gz	TZEOVIPZHJRCAU-MRXNPFEDSA-N	0	3	331.460	3.029	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cc(-c3ccco3)on2)C1	ZINC001034338285	1342412877	/nfs/dbraw/zinc/41/28/77/1342412877.db2.gz	VWCJPDYURFZQCB-AWEZNQCLSA-N	0	3	329.400	3.095	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cnc3ccsc3c2)C1	ZINC001034340339	1342413409	/nfs/dbraw/zinc/41/34/09/1342413409.db2.gz	NQLIEBPCZOWHMI-HNNXBMFYSA-N	0	3	329.469	3.457	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc3nc(C)n(C)c3c2)C1	ZINC001034345521	1342416128	/nfs/dbraw/zinc/41/61/28/1342416128.db2.gz	SZVCRDMVCULMQB-QGZVFWFLSA-N	0	3	340.471	3.042	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2c(F)cc(F)cc2F)C1	ZINC001034374436	1342443402	/nfs/dbraw/zinc/44/34/02/1342443402.db2.gz	BQQRLVJYSISNFU-ZDUSSCGKSA-N	0	3	326.362	3.264	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2ccc(C(F)F)c(F)c2)C1	ZINC001034397066	1342465250	/nfs/dbraw/zinc/46/52/50/1342465250.db2.gz	HUUIRKBDJKIHGE-CQSZACIVSA-N	0	3	338.373	3.371	20	30		EGEDHN
C=C(C)CCN1CCCC[C@H](NC(=O)c2snnc2C(C)C)C1	ZINC001034454134	1342512629	/nfs/dbraw/zinc/51/26/29/1342512629.db2.gz	SKDKIUZVGPDDGZ-AWEZNQCLSA-N	0	3	336.505	3.212	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)c2cccc(N3CCCC3)c2)C1	ZINC001034462523	1342518627	/nfs/dbraw/zinc/51/86/27/1342518627.db2.gz	OQSVIELXTQGYES-SFHVURJKSA-N	0	3	327.472	3.057	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cnn([C@H](C)CC)c2C)C1	ZINC001034482556	1342539828	/nfs/dbraw/zinc/53/98/28/1342539828.db2.gz	CVSGUKMLWFPHOQ-NVXWUHKLSA-N	0	3	332.492	3.323	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2cc3c(s2)CC[C@@H](C)C3)C1	ZINC001034522694	1342580532	/nfs/dbraw/zinc/58/05/32/1342580532.db2.gz	VTZDCFWRGACQKZ-WBVHZDCISA-N	0	3	344.524	3.481	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cc(Cl)cc3c2OCC3)C1	ZINC001034540070	1342598551	/nfs/dbraw/zinc/59/85/51/1342598551.db2.gz	DUJRNPHTHDYUSW-MRXNPFEDSA-N	0	3	348.874	3.435	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)C1	ZINC001034542876	1342602819	/nfs/dbraw/zinc/60/28/19/1342602819.db2.gz	CLWYOYSJONSHEJ-INIZCTEOSA-N	0	3	343.431	3.009	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC[C@@H]1CNCc1ccc(Cl)cc1Cl	ZINC001034879338	1342818798	/nfs/dbraw/zinc/81/87/98/1342818798.db2.gz	CKTCLAQBFBUWFT-SMDDNHRTSA-N	0	3	340.254	3.234	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC[C@@H]1CNCc1ccns1	ZINC001034947000	1342847833	/nfs/dbraw/zinc/84/78/33/1342847833.db2.gz	JXZLEEHUHPXBMQ-GFCCVEGCSA-N	0	3	327.881	3.002	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc(C)nc2C)C12CCC2	ZINC001078819168	1357099204	/nfs/dbraw/zinc/09/92/04/1357099204.db2.gz	JIZOUDGVGLHGCE-JKSUJKDBSA-N	0	3	333.863	3.082	20	30		EGEDHN
N#Cc1ccccc1CN1CCC2(C1)CCN(C(=O)c1ccoc1)CC2	ZINC001035158526	1342975814	/nfs/dbraw/zinc/97/58/14/1342975814.db2.gz	MNHFLRQRGXWCRR-UHFFFAOYSA-N	0	3	349.434	3.280	20	30		EGEDHN
N#Cc1ccccc1CN1CCC2(C1)CCN(C(=O)/C=C\C1CC1)CC2	ZINC001035171820	1342987683	/nfs/dbraw/zinc/98/76/83/1342987683.db2.gz	ILCWDZXYBJQZNM-FPLPWBNLSA-N	0	3	349.478	3.339	20	30		EGEDHN
CC1(C(=O)N2CCC3(CCN(Cc4ccccc4C#N)C3)CC2)CC1	ZINC001035192653	1343006537	/nfs/dbraw/zinc/00/65/37/1343006537.db2.gz	YHXZKLVWCFLZDC-UHFFFAOYSA-N	0	3	337.467	3.173	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC2(CCN(Cc3cc(C)ns3)C2)CC1	ZINC001035210656	1343029987	/nfs/dbraw/zinc/02/99/87/1343029987.db2.gz	BDJYJWVUESNZIR-UHFFFAOYSA-N	0	3	347.528	3.478	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC2(CCN([C@H](C)c3cnccn3)C2)CC1	ZINC001035212858	1343031990	/nfs/dbraw/zinc/03/19/90/1343031990.db2.gz	ALSLOSILFNBAIO-MRXNPFEDSA-N	0	3	342.487	3.064	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1coc3c1cccc3C)CC2	ZINC001035722632	1343152687	/nfs/dbraw/zinc/15/26/87/1343152687.db2.gz	XUBLQCNTROQOSL-UHFFFAOYSA-N	0	3	336.435	3.303	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)CCc1ccc(C)cc1)CC2	ZINC001035749181	1343168493	/nfs/dbraw/zinc/16/84/93/1343168493.db2.gz	KOXRPKCNGXWPEK-UHFFFAOYSA-N	0	3	326.484	3.428	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cc1ccc(C)c(OC)c1)CC2	ZINC001035749865	1343168882	/nfs/dbraw/zinc/16/88/82/1343168882.db2.gz	UHOFPNPIFYAFRF-UHFFFAOYSA-N	0	3	342.483	3.047	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@@H](C)c1c(F)cccc1F)CC2	ZINC001035750643	1343169727	/nfs/dbraw/zinc/16/97/27/1343169727.db2.gz	PNXNOWJKMMNHMX-HNNXBMFYSA-N	0	3	346.421	3.016	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC2(CN(C[C@H]3CC(C)(C)CO3)C2)CC1	ZINC001035784951	1343195261	/nfs/dbraw/zinc/19/52/61/1343195261.db2.gz	MINJGDHKOUZLFV-XLIONFOSSA-N	0	3	348.531	3.328	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cnc3ccccc3c1)CC2	ZINC001035803858	1343206008	/nfs/dbraw/zinc/20/60/08/1343206008.db2.gz	HVLOCUYDRQGATH-UHFFFAOYSA-N	0	3	335.451	3.349	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)CCc1cc(F)ccc1F)CC2	ZINC001035855930	1343232316	/nfs/dbraw/zinc/23/23/16/1343232316.db2.gz	CZDSYEAOOJISKX-UHFFFAOYSA-N	0	3	348.437	3.398	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H]1Oc3ccccc3[C@H]1C)CC2	ZINC001035867159	1343239583	/nfs/dbraw/zinc/23/95/83/1343239583.db2.gz	YDAPPOPDPYYLDO-VQIMIIECSA-N	0	3	340.467	3.052	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](NCc2nc(C)sc2C)[C@@H](C)C1	ZINC001036142805	1343326013	/nfs/dbraw/zinc/32/60/13/1343326013.db2.gz	LNSPPEPQVZVTST-WFASDCNBSA-N	0	3	335.517	3.299	20	30		EGEDHN
CCC1(C(=O)N2CC[C@@H](NCc3cc(F)ccc3C#N)[C@@H](C)C2)CC1	ZINC001036163966	1343338746	/nfs/dbraw/zinc/33/87/46/1343338746.db2.gz	DJROSZWBDFBEBA-KBXCAEBGSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](NCc3ccn(C(C)C)n3)[C@H](C)C2)C1	ZINC001036170751	1343343653	/nfs/dbraw/zinc/34/36/53/1343343653.db2.gz	UDEZBGHFKCKHGM-SJLPKXTDSA-N	0	3	344.503	3.147	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]([C@@H](C)NCc2csc(C)n2)C1	ZINC001036429955	1343482475	/nfs/dbraw/zinc/48/24/75/1343482475.db2.gz	XSZLHCXLOYZKFH-UKRRQHHQSA-N	0	3	335.517	3.380	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@@H]([C@H](C)NCc3cnc(C)o3)C2)CC1	ZINC001036431737	1343483583	/nfs/dbraw/zinc/48/35/83/1343483583.db2.gz	VLFTWMRUNGFQOX-MAUKXSAKSA-N	0	3	345.487	3.446	20	30		EGEDHN
C[C@H]1CCCN(C(=O)c2ccco2)[C@H]1CNCc1ccc(C#N)s1	ZINC001036490273	1343513301	/nfs/dbraw/zinc/51/33/01/1343513301.db2.gz	FKBVQACSEYDUGD-BBRMVZONSA-N	0	3	343.452	3.243	20	30		EGEDHN
C[C@H]1CCCN(C(=O)C#CC2CC2)[C@H]1CNCc1cc(F)cc(F)c1	ZINC001036550566	1343549598	/nfs/dbraw/zinc/54/95/98/1343549598.db2.gz	XQAOMNQEWSXDMW-LIRRHRJNSA-N	0	3	346.421	3.095	20	30		EGEDHN
O=C(C1CC1)N1CC[C@H]2[C@H](CCN2CC#Cc2ccc(Cl)cc2)C1	ZINC001036613501	1343574598	/nfs/dbraw/zinc/57/45/98/1343574598.db2.gz	IIEZCODMZYCWKP-MJGOQNOKSA-N	0	3	342.870	3.024	20	30		EGEDHN
Cc1ccoc1C(=O)N1CC[C@H]2[C@H](CCN2CC#Cc2ccccc2)C1	ZINC001036648200	1343598494	/nfs/dbraw/zinc/59/84/94/1343598494.db2.gz	DJTLTGBKPUXHDY-UXHICEINSA-N	0	3	348.446	3.176	20	30		EGEDHN
C/C(=C\C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccccc2C#N)C1)C1CC1	ZINC001036658369	1343605969	/nfs/dbraw/zinc/60/59/69/1343605969.db2.gz	HLKLMPJPDJAIFL-JVZHIWDNSA-N	0	3	349.478	3.337	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3CN(C(=O)C4CC=CC4)CC[C@@H]32)s1	ZINC001036674582	1343615947	/nfs/dbraw/zinc/61/59/47/1343615947.db2.gz	IBYHLEHQBVQIKP-YJBOKZPZSA-N	0	3	341.480	3.009	20	30		EGEDHN
O=C(C=C1CCC1)N1CC[C@@H]2[C@@H](CCN2CC#Cc2ccccc2)C1	ZINC001036688543	1343631570	/nfs/dbraw/zinc/63/15/70/1343631570.db2.gz	URGOTTHOCRGIJH-LEWJYISDSA-N	0	3	334.463	3.071	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H]2[C@@H](CCN2C/C=C/Cl)C1	ZINC001036726493	1343657870	/nfs/dbraw/zinc/65/78/70/1343657870.db2.gz	NDKCUBKEOBVACS-QFVHEQCKSA-N	0	3	331.287	3.440	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H]3[C@H](CCN3Cc3cncs3)C2)CC1	ZINC001036810461	1343744787	/nfs/dbraw/zinc/74/47/87/1343744787.db2.gz	CJTSVYBPUGKODF-SJLPKXTDSA-N	0	3	345.512	3.312	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCC[C@H]1NC(=O)c1cccs1	ZINC001036933892	1343877517	/nfs/dbraw/zinc/87/75/17/1343877517.db2.gz	GAIHCVQLKATMIU-IAGOWNOFSA-N	0	3	339.464	3.308	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@H]1CCC[C@H]1NC(=O)C1CC=CC1	ZINC001036970646	1343900076	/nfs/dbraw/zinc/90/00/76/1343900076.db2.gz	PQOCGCUHPXHVEN-VQIMIIECSA-N	0	3	341.430	3.038	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCC[C@@H]1NC(=O)C1(F)CCCC1	ZINC001037033267	1343940580	/nfs/dbraw/zinc/94/05/80/1343940580.db2.gz	NGZLDHKEDPVCBP-MSOLQXFVSA-N	0	3	343.446	3.215	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCC[C@H]1NC(=O)C1(F)CCCC1	ZINC001037033270	1343940779	/nfs/dbraw/zinc/94/07/79/1343940779.db2.gz	NGZLDHKEDPVCBP-ZWKOTPCHSA-N	0	3	343.446	3.215	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCC[C@H]1NC(=O)c1ccoc1	ZINC001037147380	1343997380	/nfs/dbraw/zinc/99/73/80/1343997380.db2.gz	DZSUZFFIKBUAGR-PKOBYXMFSA-N	0	3	337.423	3.230	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCC[C@@H]1NC(=O)c1cccnc1	ZINC001037157378	1344007632	/nfs/dbraw/zinc/00/76/32/1344007632.db2.gz	UXEQPPMTDYTUHZ-QUCCMNQESA-N	0	3	348.450	3.032	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NC[C@H]1CCN1CC1CC(C)C1	ZINC001038427274	1344423489	/nfs/dbraw/zinc/42/34/89/1344423489.db2.gz	GOJCNOBGUYWURI-OFLPRAFFSA-N	0	3	328.456	3.102	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1ccc2c(c1)C(C)(C)CO2	ZINC001038496313	1344452066	/nfs/dbraw/zinc/45/20/66/1344452066.db2.gz	MZSDYAJLPCNQKL-INIZCTEOSA-N	0	3	328.456	3.127	20	30		EGEDHN
C=CCOc1cccnc1C(=O)NC[C@H]1CCN1CC1CCCCC1	ZINC001038902681	1344642149	/nfs/dbraw/zinc/64/21/49/1344642149.db2.gz	AFMCHYOTOFOBAH-QGZVFWFLSA-N	0	3	343.471	3.031	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C[C@@H](C)C2CC2)CC[C@H]1c1ccc(F)cc1	ZINC001079162739	1357198453	/nfs/dbraw/zinc/19/84/53/1357198453.db2.gz	YSLJGZPNBVTXIQ-UIAACRFSSA-N	0	3	342.458	3.169	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)c3ccns3)CC2)C1	ZINC001039140150	1344820009	/nfs/dbraw/zinc/82/00/09/1344820009.db2.gz	CECJIVLFSCSAAL-AWEZNQCLSA-N	0	3	339.892	3.070	20	30		EGEDHN
CC(=O)N1CCCC[C@@H]1[C@H]1CCN(CC#Cc2ccc(Cl)cc2)C1	ZINC001039174692	1344866372	/nfs/dbraw/zinc/86/63/72/1344866372.db2.gz	BMYRYTUWNINSOZ-AZUAARDMSA-N	0	3	344.886	3.414	20	30		EGEDHN
CC(C)C(=O)N1CCCC[C@@H]1[C@H]1CCN(Cc2ccc(C#N)s2)C1	ZINC001039188888	1344891696	/nfs/dbraw/zinc/89/16/96/1344891696.db2.gz	FNAJOKTVZQPXNK-MAUKXSAKSA-N	0	3	345.512	3.479	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccoc2Cl)C1	ZINC001039199012	1344908961	/nfs/dbraw/zinc/90/89/61/1344908961.db2.gz	NXXLLNUAZHSRNH-HOCLYGCPSA-N	0	3	334.847	3.273	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cccc(F)c2)C1	ZINC001039207279	1344918246	/nfs/dbraw/zinc/91/82/46/1344918246.db2.gz	ZBOJARNLAZVILU-HKUYNNGSSA-N	0	3	328.431	3.166	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(C)nc(C)c2)C1	ZINC001039211381	1344925504	/nfs/dbraw/zinc/92/55/04/1344925504.db2.gz	TWOGTTMZKUZUBW-QUCCMNQESA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc(F)ccc2CC)C1	ZINC001039220344	1344937712	/nfs/dbraw/zinc/93/77/12/1344937712.db2.gz	YGPVAJOKCBLAIR-FXAWDEMLSA-N	0	3	342.458	3.338	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cccc(Cl)c2F)C1	ZINC001039225508	1344943615	/nfs/dbraw/zinc/94/36/15/1344943615.db2.gz	PSSWHFZENWHRGP-RHSMWYFYSA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)Cc2cccc(C)c2)C1	ZINC001039225700	1344944478	/nfs/dbraw/zinc/94/44/78/1344944478.db2.gz	QMQCPQWMTZBXLI-LEWJYISDSA-N	0	3	338.495	3.264	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2occc2CC)C1	ZINC001039227347	1344946542	/nfs/dbraw/zinc/94/65/42/1344946542.db2.gz	CWWCSWMGGTZMIC-ROUUACIJSA-N	0	3	328.456	3.182	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc3occc3s2)C1	ZINC001039228730	1344948413	/nfs/dbraw/zinc/94/84/13/1344948413.db2.gz	HMQRSVQZHFYHGU-GJZGRUSLSA-N	0	3	342.464	3.444	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccsc2Cl)C1	ZINC001039232219	1344951752	/nfs/dbraw/zinc/95/17/52/1344951752.db2.gz	UKLFMKYBKHGOKS-HIFRSBDPSA-N	0	3	336.888	3.351	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(F)ccc2Cl)C1	ZINC001039236429	1344958423	/nfs/dbraw/zinc/95/84/23/1344958423.db2.gz	BXPREALPDDGSPG-KDOFPFPSSA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)Cc2ccccc2Cl)C1	ZINC001039239504	1344964264	/nfs/dbraw/zinc/96/42/64/1344964264.db2.gz	NPWUHNWFOZJXSC-HKUYNNGSSA-N	0	3	344.886	3.219	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)Cc2cccc(F)c2)C1	ZINC001039240330	1344964676	/nfs/dbraw/zinc/96/46/76/1344964676.db2.gz	UAEDUUCFVSLKKM-UYAOXDASSA-N	0	3	342.458	3.095	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc3c(C)cccn3c2)C1	ZINC001039242874	1344969395	/nfs/dbraw/zinc/96/93/95/1344969395.db2.gz	CWOCJXNFGXOAST-AZUAARDMSA-N	0	3	349.478	3.198	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2coc(C(F)F)c2)C1	ZINC001039245446	1344974819	/nfs/dbraw/zinc/97/48/19/1344974819.db2.gz	OJQFEEQDOYGEPL-UKRRQHHQSA-N	0	3	336.382	3.167	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc[nH]c2CCC)C1	ZINC001039246808	1344976398	/nfs/dbraw/zinc/97/63/98/1344976398.db2.gz	URYUGZZBHHJBKE-YLJYHZDGSA-N	0	3	341.499	3.307	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2oc(CC)cc2C)C1	ZINC001039247180	1344977045	/nfs/dbraw/zinc/97/70/45/1344977045.db2.gz	UTVJKEPJKQBTGJ-MJGOQNOKSA-N	0	3	342.483	3.490	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc3[nH]ccc3s2)C1	ZINC001039249460	1344979411	/nfs/dbraw/zinc/97/94/11/1344979411.db2.gz	IQWRFQQLHRGFFK-ZBFHGGJFSA-N	0	3	341.480	3.179	20	30		EGEDHN
C=C(Cl)C[NH2+]C1C[C@H]2CCC[C@@H](C1)N2C(=O)c1ccccc1[O-]	ZINC001039267124	1344989820	/nfs/dbraw/zinc/98/98/20/1344989820.db2.gz	IURMGVDOSFDCKM-GOOCMWNKSA-N	0	3	334.847	3.260	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc2cccnc2c1	ZINC001039392933	1345042411	/nfs/dbraw/zinc/04/24/11/1345042411.db2.gz	LAYCUYFEIKAKOR-MOPGFXCFSA-N	0	3	335.451	3.029	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1cc(F)c(C)cc1F	ZINC001039409616	1345053176	/nfs/dbraw/zinc/05/31/76/1345053176.db2.gz	BFCMTMGCBHMOPM-SJORKVTESA-N	0	3	348.437	3.457	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H]3CCC[C@@H](C2)N3C[C@@H]2CCCOC2)CC1	ZINC001039890765	1345233481	/nfs/dbraw/zinc/23/34/81/1345233481.db2.gz	BZJJSPCKBQBYOJ-YSIASYRMSA-N	0	3	346.515	3.225	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CCC[C@@H](C1)N2C[C@@H]1CCCOC1	ZINC001039896073	1345238820	/nfs/dbraw/zinc/23/88/20/1345238820.db2.gz	DFLUIVRMUALYRM-GNBUJSLZSA-N	0	3	334.504	3.081	20	30		EGEDHN
CC(C)C(=O)N1CC[C@@]2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001040080733	1345326348	/nfs/dbraw/zinc/32/63/48/1345326348.db2.gz	PRPAYKBHHHBLOC-FQEVSTJZSA-N	0	3	325.456	3.029	20	30		EGEDHN
Cc1ccc(CN2CCC[C@]3(CCN(C(=O)[C@H](C)C#N)C3)C2)cc1F	ZINC001040127419	1345342711	/nfs/dbraw/zinc/34/27/11/1345342711.db2.gz	SHFAWGVVBNYDAJ-UZLBHIALSA-N	0	3	343.446	3.108	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@]3(CCN(C(=O)C=C4CCC4)C3)C2)cc1	ZINC001040153666	1345357492	/nfs/dbraw/zinc/35/74/92/1345357492.db2.gz	QDGOFDONXGBWTJ-JOCHJYFZSA-N	0	3	349.478	3.483	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3coc(C(C)(C)C)n3)C2)C1	ZINC001040201685	1345373204	/nfs/dbraw/zinc/37/32/04/1345373204.db2.gz	NEBPCFWLCFQNLP-IBGZPJMESA-N	0	3	331.460	3.086	20	30		EGEDHN
CC1(C(=O)N2CC[C@]3(C2)CCCN(Cc2cccc(C#N)c2)C3)CC1	ZINC001040220835	1345380526	/nfs/dbraw/zinc/38/05/26/1345380526.db2.gz	MPKGPBGPVYVFFE-OAQYLSRUSA-N	0	3	337.467	3.173	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3cccc4c3CCCC4)C2)C1	ZINC001040221714	1345381446	/nfs/dbraw/zinc/38/14/46/1345381446.db2.gz	VWZRITSCAJCWQW-JOCHJYFZSA-N	0	3	336.479	3.127	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)CC3(c4ccccc4)CC3)C2)C1	ZINC001040230892	1345386432	/nfs/dbraw/zinc/38/64/32/1345386432.db2.gz	HHSFLFNRKPAREY-OAQYLSRUSA-N	0	3	336.479	3.056	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)C[C@H]3CCC(F)(F)C3)C2)C1	ZINC001040233116	1345387961	/nfs/dbraw/zinc/38/79/61/1345387961.db2.gz	WTDNJGXEIJIPCU-SJLPKXTDSA-N	0	3	338.442	3.150	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CC[C@@]2(C1)CCCN(C[C@H](F)CC)C2	ZINC001040241595	1345391759	/nfs/dbraw/zinc/39/17/59/1345391759.db2.gz	PRTRNQLTZPMUJY-XLIONFOSSA-N	0	3	347.478	3.350	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3ccc(-n4cccc4)cc3)C2)C1	ZINC001040281570	1345409972	/nfs/dbraw/zinc/40/99/72/1345409972.db2.gz	CTSTYFZPZYOTBI-QFIPXVFZSA-N	0	3	347.462	3.039	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)CCc3ccc(C)cc3C)C2)C1	ZINC001040320338	1345430188	/nfs/dbraw/zinc/43/01/88/1345430188.db2.gz	QOFAVKHPDPQGPM-JOCHJYFZSA-N	0	3	338.495	3.184	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@]2(C1)CCCN(CCc1ccns1)C2	ZINC001040323381	1345432403	/nfs/dbraw/zinc/43/24/03/1345432403.db2.gz	QVBLYCRFYGVTEF-LJQANCHMSA-N	0	3	347.528	3.212	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@]3(C2)CCCN(Cc2ccccn2)C3)C1	ZINC001040379642	1345465829	/nfs/dbraw/zinc/46/58/29/1345465829.db2.gz	LXJRKXDOFGFTRZ-OAQYLSRUSA-N	0	3	339.483	3.252	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)Cc3ccc(CC)cc3)C2)C1	ZINC001040426668	1345491785	/nfs/dbraw/zinc/49/17/85/1345491785.db2.gz	XMBXKMHUDQRIQD-QFIPXVFZSA-N	0	3	338.495	3.129	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3scnc3C(C)C)C2)C1	ZINC001040444975	1345503835	/nfs/dbraw/zinc/50/38/35/1345503835.db2.gz	ZSUXMGNCJKFIKB-SFHVURJKSA-N	0	3	333.501	3.381	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@@H](C)c3ccccc3F)C2)C1	ZINC001040457546	1345508863	/nfs/dbraw/zinc/50/88/63/1345508863.db2.gz	XGDUVXLEASOKSD-LAUBAEHRSA-N	0	3	342.458	3.267	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3ncsc3C(C)C)C2)C1	ZINC001040492236	1345517572	/nfs/dbraw/zinc/51/75/72/1345517572.db2.gz	MYKWSOUXCRDNOV-GOSISDBHSA-N	0	3	333.501	3.381	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3ccccc3OC(C)C)C2)C1	ZINC001040500428	1345520995	/nfs/dbraw/zinc/52/09/95/1345520995.db2.gz	MNLHGIVCBWIGAN-OAQYLSRUSA-N	0	3	340.467	3.035	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)CCc3cccs3)C2)C1	ZINC001040524410	1345532659	/nfs/dbraw/zinc/53/26/59/1345532659.db2.gz	GZVQGPWFKIZAKP-IBGZPJMESA-N	0	3	330.497	3.019	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@@H](C)c3ccc(F)cc3F)C2)C1	ZINC001040537625	1345536537	/nfs/dbraw/zinc/53/65/37/1345536537.db2.gz	BLKKKVQMIPNKSA-YWZLYKJASA-N	0	3	346.421	3.016	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)C[C@@H](C)c3ccc(F)cc3)C2)C1	ZINC001040538583	1345537069	/nfs/dbraw/zinc/53/70/69/1345537069.db2.gz	KDXVVQWTKKYUNQ-DYESRHJHSA-N	0	3	342.458	3.267	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ccoc3C(C)C)C2)C1	ZINC001040542572	1345538612	/nfs/dbraw/zinc/53/86/12/1345538612.db2.gz	AFUWJIWXPJVHMS-FQEVSTJZSA-N	0	3	328.456	3.354	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@@H](CC)c3ccc(F)cc3)C2)C1	ZINC001040546833	1345540839	/nfs/dbraw/zinc/54/08/39/1345540839.db2.gz	HBEAYSBAJMUYBR-FPOVZHCZSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3c[nH]c4ccc(C)cc34)C2)C1	ZINC001040549078	1345542759	/nfs/dbraw/zinc/54/27/59/1345542759.db2.gz	YIAOTVDLFIYYEX-OAQYLSRUSA-N	0	3	335.451	3.038	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC2(C1)CCN(Cc1cccc(Cl)c1)CC2	ZINC001040644813	1345559316	/nfs/dbraw/zinc/55/93/16/1345559316.db2.gz	RMKAXFVDHPVGQB-OAHLLOKOSA-N	0	3	345.874	3.314	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccc([C@@H]4C[C@H]4C)o3)C2)CC1	ZINC001040701192	1345567176	/nfs/dbraw/zinc/56/71/76/1345567176.db2.gz	WGTBNKHZSKBDIR-IAGOWNOFSA-N	0	3	340.467	3.354	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cccc(Cl)c3C)C2)CC1	ZINC001040708650	1345568443	/nfs/dbraw/zinc/56/84/43/1345568443.db2.gz	WHPISRAGAMOMJS-UHFFFAOYSA-N	0	3	330.859	3.210	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCC2(C1)CCN(C[C@@H](F)CC)CC2	ZINC001040730153	1345571789	/nfs/dbraw/zinc/57/17/89/1345571789.db2.gz	RYDMAJJYHDLZAY-KRWDZBQOSA-N	0	3	347.478	3.350	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cc(C)ccc3F)C2)CC1	ZINC001040869802	1345590686	/nfs/dbraw/zinc/59/06/86/1345590686.db2.gz	QPSIBXTZNIGTAJ-UHFFFAOYSA-N	0	3	328.431	3.086	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@@H]3C[C@H]3c3ccc(C)s3)C2)CC1	ZINC001040877113	1345593491	/nfs/dbraw/zinc/59/34/91/1345593491.db2.gz	SQELESJSUYTNFE-IAGOWNOFSA-N	0	3	342.508	3.108	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@]3(CCN(C(=O)[C@H]4CC=CCC4)C3)C2)cc1	ZINC001041064245	1345640399	/nfs/dbraw/zinc/64/03/99/1345640399.db2.gz	QBDUAWGASLJTQO-RBBKRZOGSA-N	0	3	349.478	3.339	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@]3(CCN(C(=O)[C@H]4CC=CCC4)C3)C2)c1	ZINC001041065141	1345641774	/nfs/dbraw/zinc/64/17/74/1345641774.db2.gz	YVRXNYDBFFMQJN-UNMCSNQZSA-N	0	3	349.478	3.339	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1)C1CC1	ZINC001041175169	1345666840	/nfs/dbraw/zinc/66/68/40/1345666840.db2.gz	RROZLDCVFNEZGP-IIBYNOLFSA-N	0	3	337.467	3.029	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@]3(CCN(C(=O)C4=CCCC4)C3)C2)c1	ZINC001041200111	1345675796	/nfs/dbraw/zinc/67/57/96/1345675796.db2.gz	KJWYLQMVQLZIFA-NRFANRHFSA-N	0	3	335.451	3.093	20	30		EGEDHN
C[C@@H](c1ccc(F)cc1)N1CC[C@]2(CCN(C(=O)C#CC3CC3)C2)C1	ZINC001041266465	1345690759	/nfs/dbraw/zinc/69/07/59/1345690759.db2.gz	SDEVGHWDOQALMW-KKSFZXQISA-N	0	3	340.442	3.225	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cscc3C(F)F)C2)C1	ZINC001041290302	1345695685	/nfs/dbraw/zinc/69/56/85/1345695685.db2.gz	NIDGNAYOSUSWRX-KRWDZBQOSA-N	0	3	338.423	3.247	20	30		EGEDHN
CC1(CC(=O)N2CC[C@@]3(CCN(Cc4cccc(C#N)c4)C3)C2)CC1	ZINC001041481861	1345741356	/nfs/dbraw/zinc/74/13/56/1345741356.db2.gz	KUVTYKOMESOJGG-OAQYLSRUSA-N	0	3	337.467	3.173	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@]3(CCN(C(=O)[C@H]4C[C@H]5C[C@H]5C4)C3)C2)cc1	ZINC001041585605	1345782462	/nfs/dbraw/zinc/78/24/62/1345782462.db2.gz	FWCVNAYACYEJPK-HIUFNZKISA-N	0	3	349.478	3.029	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001041622631	1345798464	/nfs/dbraw/zinc/79/84/64/1345798464.db2.gz	JRPWGQSXECSVHQ-OAQYLSRUSA-N	0	3	339.483	3.419	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)[C@@H](CC)Cc3ccccc3)C2)C1	ZINC001041720035	1345830187	/nfs/dbraw/zinc/83/01/87/1345830187.db2.gz	HKZFOCJGCNQFRF-RBBKRZOGSA-N	0	3	338.495	3.203	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)[C@H](CC)Cc3cccc(C)c3)C2)C1	ZINC001041727615	1345833546	/nfs/dbraw/zinc/83/35/46/1345833546.db2.gz	KXWHGGZYGDTGCO-IRLDBZIGSA-N	0	3	338.495	3.121	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)[C@H](F)CC3CCCCC3)C2)C1	ZINC001041788410	1345850366	/nfs/dbraw/zinc/85/03/66/1345850366.db2.gz	DCYFHATUUUUJTN-QUCCMNQESA-N	0	3	334.479	3.243	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)C3CCC(C(F)F)CC3)C2)C1	ZINC001041809845	1345858208	/nfs/dbraw/zinc/85/82/08/1345858208.db2.gz	SPYHJCBHZKRSBP-LADRWXRNSA-N	0	3	338.442	3.006	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cc(C)nc4ccccc43)C2)C1	ZINC001041815370	1345860754	/nfs/dbraw/zinc/86/07/54/1345860754.db2.gz	AMLDCESVTDYGEJ-QFIPXVFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cc(C)c(F)c(C)c3)C2)C1	ZINC001041834459	1345866969	/nfs/dbraw/zinc/86/69/69/1345866969.db2.gz	DCSOOPJUHNVHSJ-HXUWFJFHSA-N	0	3	328.431	3.004	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccc(F)c4occc43)C2)C1	ZINC001041839313	1345869194	/nfs/dbraw/zinc/86/91/94/1345869194.db2.gz	LLEHVWXZNMBEAF-HXUWFJFHSA-N	0	3	340.398	3.133	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)C34CC(c5ccccc5)(C3)C4)C2)C1	ZINC001041847731	1345872598	/nfs/dbraw/zinc/87/25/98/1345872598.db2.gz	CTIQDYGDBPYGDI-UVKLAMSESA-N	0	3	348.490	3.056	20	30		EGEDHN
C/C(=C\C(=O)N1CC[C@@H]2CCN(Cc3cccc(C#N)c3)[C@@H]2C1)C1CC1	ZINC001041962345	1345908772	/nfs/dbraw/zinc/90/87/72/1345908772.db2.gz	ROCRZYOECKKANA-DJRZKHRSSA-N	0	3	349.478	3.337	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(C)c(OC)c(C)c3)C[C@@H]21	ZINC001042066309	1345934562	/nfs/dbraw/zinc/93/45/62/1345934562.db2.gz	DBPKTUYTJXUIQL-AEFFLSMTSA-N	0	3	328.456	3.034	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3scc(C)c3Cl)C[C@@H]21	ZINC001042077775	1345939086	/nfs/dbraw/zinc/93/90/86/1345939086.db2.gz	PDXIUSPPXYTVTO-KGLIPLIRSA-N	0	3	336.888	3.270	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3cc4ccncc4s3)C[C@@H]21	ZINC001042096433	1345943022	/nfs/dbraw/zinc/94/30/22/1345943022.db2.gz	YCRPTDLONVGCKY-HOCLYGCPSA-N	0	3	341.480	3.409	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C3C4CC5CC(C4)CC3C5)C[C@H]21	ZINC001042095872	1345943085	/nfs/dbraw/zinc/94/30/85/1345943085.db2.gz	RFYVBVRDWBECPR-XOMCCCRZSA-N	0	3	328.500	3.168	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(C)nn3C(CC)CC)C[C@H]21	ZINC001042120823	1345949805	/nfs/dbraw/zinc/94/98/05/1345949805.db2.gz	BEXSKHOVTCFWEJ-QFBILLFUSA-N	0	3	344.503	3.275	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(C)cc(OC)c3C)C[C@@H]21	ZINC001042132589	1345951741	/nfs/dbraw/zinc/95/17/41/1345951741.db2.gz	DVXKTCUTTBQKIB-WMZOPIPTSA-N	0	3	328.456	3.034	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)Cc3cccc(C)c3Cl)C[C@H]21	ZINC001042150019	1345957319	/nfs/dbraw/zinc/95/73/19/1345957319.db2.gz	VUTOQZIYQMCIQR-FUHWJXTLSA-N	0	3	344.886	3.137	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cnc4c(F)cccc4c3)C[C@H]21	ZINC001042153507	1345957782	/nfs/dbraw/zinc/95/77/82/1345957782.db2.gz	SUGOZBVMSGQWKZ-RDTXWAMCSA-N	0	3	339.414	3.096	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)CCc3cccc(Cl)c3)C[C@@H]21	ZINC001042168275	1345963774	/nfs/dbraw/zinc/96/37/74/1345963774.db2.gz	UOAPFGCVKKEXKQ-HKUYNNGSSA-N	0	3	344.886	3.219	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3csc4ccccc34)C[C@H]21	ZINC001042169703	1345965422	/nfs/dbraw/zinc/96/54/22/1345965422.db2.gz	LADRHUUEOZOUPW-MAUKXSAKSA-N	0	3	338.476	3.461	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3cncc(C)c3)[C@@H]2C1	ZINC001042188859	1345976171	/nfs/dbraw/zinc/97/61/71/1345976171.db2.gz	WYQBKWUEXZGBPJ-ZWKOTPCHSA-N	0	3	327.472	3.025	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc4cccc(OC)c4o3)C[C@@H]21	ZINC001042202184	1345982173	/nfs/dbraw/zinc/98/21/73/1345982173.db2.gz	XGKCOUJQMXSQSD-HOCLYGCPSA-N	0	3	340.423	3.164	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3cccc(C#N)c3)[C@H]2C1	ZINC001042209064	1345986935	/nfs/dbraw/zinc/98/69/35/1345986935.db2.gz	WXLOHNIIJQCLLH-OALUTQOASA-N	0	3	339.483	3.417	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C(C)(C)c3cccc(F)c3)C[C@@H]21	ZINC001042229513	1345997353	/nfs/dbraw/zinc/99/73/53/1345997353.db2.gz	FQUABHXGRMNPPE-APWZRJJASA-N	0	3	342.458	3.049	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3scnc3C(C)(C)C)C[C@H]21	ZINC001042262225	1346010359	/nfs/dbraw/zinc/01/03/59/1346010359.db2.gz	HZSMURCLDJZHEE-HUUCEWRRSA-N	0	3	345.512	3.000	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(OC)c(C4CC4)c3)C[C@@H]21	ZINC001042290969	1346019204	/nfs/dbraw/zinc/01/92/04/1346019204.db2.gz	VHFFUYITDSXVLO-APWZRJJASA-N	0	3	340.467	3.295	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)CCc3c[nH]c4ccccc34)C[C@H]21	ZINC001042337048	1346042825	/nfs/dbraw/zinc/04/28/25/1346042825.db2.gz	CSMKPVWOQFVOIS-LAUBAEHRSA-N	0	3	349.478	3.047	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cc(C)nc4ccccc43)C[C@@H]21	ZINC001042339520	1346043962	/nfs/dbraw/zinc/04/39/62/1346043962.db2.gz	XUMXDYRGQLVYPC-UWJYYQICSA-N	0	3	347.462	3.103	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cc(C)n(C(C)C)c3C)C[C@@H]21	ZINC001042345810	1346047826	/nfs/dbraw/zinc/04/78/26/1346047826.db2.gz	NQVRMRFKDUMPHO-QUCCMNQESA-N	0	3	341.499	3.246	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc(F)c4occc43)C[C@@H]21	ZINC001042362714	1346056840	/nfs/dbraw/zinc/05/68/40/1346056840.db2.gz	MCIBLNSYJZINBN-KDOFPFPSSA-N	0	3	340.398	3.132	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C3(C(F)(F)F)CCCC3)C[C@H]21	ZINC001042379281	1346064766	/nfs/dbraw/zinc/06/47/66/1346064766.db2.gz	JFOQBUGIHGRRTE-UONOGXRCSA-N	0	3	330.394	3.218	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc(C(C)(F)F)cc3)C[C@H]21	ZINC001042380498	1346065325	/nfs/dbraw/zinc/06/53/25/1346065325.db2.gz	UCFYLSDFCBVMEH-MAUKXSAKSA-N	0	3	346.421	3.358	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C(C)(C)c3ccccc3OC)C[C@@H]21	ZINC001042385728	1346066794	/nfs/dbraw/zinc/06/67/94/1346066794.db2.gz	VPWPQWICNWDCTP-WMZOPIPTSA-N	0	3	342.483	3.082	20	30		EGEDHN
C[C@H]1C[C@@H](NCc2cc(F)ccc2C#N)CCN1C(=O)c1ccco1	ZINC001044425890	1346325909	/nfs/dbraw/zinc/32/59/09/1346325909.db2.gz	PUVBCLTYHHAAFR-GUYCJALGSA-N	0	3	341.386	3.073	20	30		EGEDHN
C[C@H]1C[C@H](NCc2c(F)cccc2Cl)CCN1C(=O)C#CC1CC1	ZINC001044595065	1346378009	/nfs/dbraw/zinc/37/80/09/1346378009.db2.gz	XCZRTFFUTHEEMA-DZGCQCFKSA-N	0	3	348.849	3.362	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)[C@@H]2CC=CCC2)s1	ZINC001044918961	1346462634	/nfs/dbraw/zinc/46/26/34/1346462634.db2.gz	FBHATFKDLIAFIG-CABCVRRESA-N	0	3	329.469	3.057	20	30		EGEDHN
C[C@@]1(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)s2)C=CCC1	ZINC001045156340	1346509171	/nfs/dbraw/zinc/50/91/71/1346509171.db2.gz	WXCAKLVOZXWEQK-KBXCAEBGSA-N	0	3	329.469	3.057	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@H]2CNCc2cnc(C)s2)CC1	ZINC001045181968	1346517166	/nfs/dbraw/zinc/51/71/66/1346517166.db2.gz	HYSWVOCDBLUINV-INIZCTEOSA-N	0	3	333.501	3.279	20	30		EGEDHN
CC1(NC(=O)C2CC(F)(F)C2)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045402730	1346584716	/nfs/dbraw/zinc/58/47/16/1346584716.db2.gz	YNDAWGJBAYFHCH-UHFFFAOYSA-N	0	3	347.409	3.074	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2cccc(-n3cccc3)c2)CC1	ZINC001045495122	1346608743	/nfs/dbraw/zinc/60/87/43/1346608743.db2.gz	RBHREXQSYOSUST-UHFFFAOYSA-N	0	3	335.451	3.085	20	30		EGEDHN
CC(C)[C@H]1C[C@H]1C(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1	ZINC001045604634	1346642647	/nfs/dbraw/zinc/64/26/47/1346642647.db2.gz	TTWGPSSXUPBJSU-RTBURBONSA-N	0	3	339.483	3.321	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2cc(C)n(CC3CC3)c2C)CC1	ZINC001045618397	1346649241	/nfs/dbraw/zinc/64/92/41/1346649241.db2.gz	PMQXQNZREYEQAZ-UHFFFAOYSA-N	0	3	341.499	3.123	20	30		EGEDHN
CC1(C(=O)N2CC[C@H]3CC[C@@H](C2)N3Cc2ccc(C#N)cc2)CC=CC1	ZINC001045840998	1346716715	/nfs/dbraw/zinc/71/67/15/1346716715.db2.gz	BXRNANSIGASVKE-UXHICEINSA-N	0	3	349.478	3.480	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]3CC[C@@H](C2)N3Cc2ncccc2C)C1	ZINC001045845219	1346719343	/nfs/dbraw/zinc/71/93/43/1346719343.db2.gz	WSEFYBZODWDSLB-MSOLQXFVSA-N	0	3	339.483	3.312	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1cccc(C#N)c1	ZINC001045857876	1346722789	/nfs/dbraw/zinc/72/27/89/1346722789.db2.gz	NRAALUYCEQDHMZ-DBVUQKKJSA-N	0	3	339.483	3.416	20	30		EGEDHN
CCC(=O)N1CCCC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001045902935	1346739723	/nfs/dbraw/zinc/73/97/23/1346739723.db2.gz	IFQGSMVANWLEPX-HXUWFJFHSA-N	0	3	325.456	3.173	20	30		EGEDHN
C=CCC[N@H+]1CC[C@]2(C1)CCCCN(C(=O)c1ccccc1[O-])C2	ZINC001045918956	1346755708	/nfs/dbraw/zinc/75/57/08/1346755708.db2.gz	OJEVKKTZYFWTBE-FQEVSTJZSA-N	0	3	328.456	3.287	20	30		EGEDHN
C=CCC[N@@H+]1CC[C@]2(C1)CCCCN(C(=O)c1ccccc1[O-])C2	ZINC001045918956	1346755711	/nfs/dbraw/zinc/75/57/11/1346755711.db2.gz	OJEVKKTZYFWTBE-FQEVSTJZSA-N	0	3	328.456	3.287	20	30		EGEDHN
O=C(C#CC1CC1)N1CCCC[C@]2(CCN(CCC(F)(F)F)C2)C1	ZINC001045936323	1346773188	/nfs/dbraw/zinc/77/31/88/1346773188.db2.gz	GVVSODMOXRWCTE-QGZVFWFLSA-N	0	3	342.405	3.057	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cccc(C)c1F)C2	ZINC001045940047	1346775727	/nfs/dbraw/zinc/77/57/27/1346775727.db2.gz	OPTKETMEHMHGOY-NRFANRHFSA-N	0	3	342.458	3.476	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H]1CCCC13CC3)C2	ZINC001045946974	1346782648	/nfs/dbraw/zinc/78/26/48/1346782648.db2.gz	GIFAGMXVLUSTCX-AZUAARDMSA-N	0	3	328.500	3.295	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1c(C)[nH]c3ccccc31)C2	ZINC001045950890	1346786170	/nfs/dbraw/zinc/78/61/70/1346786170.db2.gz	OBNRBNTXVLCECW-QFIPXVFZSA-N	0	3	349.478	3.428	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc(C)c(C)n1)C2	ZINC001045953286	1346788665	/nfs/dbraw/zinc/78/86/65/1346788665.db2.gz	XDMMTNVSSACGSM-OAQYLSRUSA-N	0	3	339.483	3.040	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1nccc3ccccc31)C2	ZINC001045960243	1346795497	/nfs/dbraw/zinc/79/54/97/1346795497.db2.gz	HVNKYLNHWXCETH-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc3ncccc3c1)C2	ZINC001045963044	1346798383	/nfs/dbraw/zinc/79/83/83/1346798383.db2.gz	VZZCMKWPWUJNSC-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1c[nH]cc1C1CC1)C2	ZINC001045977786	1346814298	/nfs/dbraw/zinc/81/42/98/1346814298.db2.gz	ITLBVNSUJIDNKU-OAQYLSRUSA-N	0	3	339.483	3.234	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H]1C[C@H]1c1ccccc1)C2	ZINC001045980716	1346818235	/nfs/dbraw/zinc/81/82/35/1346818235.db2.gz	HMDHDLKXDOJWKT-VWPQPMDRSA-N	0	3	336.479	3.128	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cccc(OC)c1)C2	ZINC001045982131	1346821107	/nfs/dbraw/zinc/82/11/07/1346821107.db2.gz	OWYHTTGSYDBAHC-NRFANRHFSA-N	0	3	340.467	3.037	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)CCc1cccs1)C2	ZINC001045983125	1346822381	/nfs/dbraw/zinc/82/23/81/1346822381.db2.gz	KCGRBTHUTJEQJR-IBGZPJMESA-N	0	3	330.497	3.019	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cnc(C(C)C)s1)C2	ZINC001045988154	1346829618	/nfs/dbraw/zinc/82/96/18/1346829618.db2.gz	JOFVJVLZPVYJHZ-LJQANCHMSA-N	0	3	345.512	3.218	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@]2(C)CCN(Cc3cccc(CC)c3)C2)c1	ZINC001046607433	1347037574	/nfs/dbraw/zinc/03/75/74/1347037574.db2.gz	QVWIAIILDVDRIA-JOCHJYFZSA-N	0	3	347.462	3.020	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2ncoc2-c2cccs2)C1	ZINC001046711127	1347070075	/nfs/dbraw/zinc/07/00/75/1347070075.db2.gz	XWGOZABOCIDCFP-KRWDZBQOSA-N	0	3	331.441	3.173	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2ccnc(O[C@H](C)CC)c2)C1	ZINC001046760910	1347089070	/nfs/dbraw/zinc/08/90/70/1347089070.db2.gz	UJWYJPSFDLLTST-BEFAXECRSA-N	0	3	331.460	3.029	20	30		EGEDHN
C#CCCN1CC[C@](C)(NC(=O)c2cc3c(s2)CCCCC3)C1	ZINC001046817313	1347116867	/nfs/dbraw/zinc/11/68/67/1347116867.db2.gz	WMSZEWFUVCBTLY-IBGZPJMESA-N	0	3	330.497	3.235	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2nc(C)sc2C)C1	ZINC001046947391	1347159886	/nfs/dbraw/zinc/15/98/86/1347159886.db2.gz	QNPFTUGCJTXLEK-CYBMUJFWSA-N	0	3	343.443	3.023	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2ccc(CC)o2)C1	ZINC001046954122	1347162948	/nfs/dbraw/zinc/16/29/48/1347162948.db2.gz	QHUKOFVDMSHXKI-ZDUSSCGKSA-N	0	3	326.387	3.105	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2cc(OC)cs2)C1	ZINC001046961431	1347166672	/nfs/dbraw/zinc/16/66/72/1347166672.db2.gz	NHQQWUGVAWNOTJ-GFCCVEGCSA-N	0	3	344.427	3.020	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2C[C@H]3C[C@@H](C2)N(C/C=C\Cl)C3)cc1	ZINC001047122701	1347212995	/nfs/dbraw/zinc/21/29/95/1347212995.db2.gz	BEVLUNBTNJUYMC-QVARQNJESA-N	0	3	328.843	3.003	20	30		EGEDHN
CC1(C(=O)N[C@H]2C[C@H]3C[C@@H](C2)N(Cc2ccc(C#N)s2)C3)CCC1	ZINC001047127038	1347213986	/nfs/dbraw/zinc/21/39/86/1347213986.db2.gz	HDMCXWYFGMJOTL-KKUMJFAQSA-N	0	3	343.496	3.279	20	30		EGEDHN
O=C(N[C@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1ccccc1)C2)C1CC2(CC2)C1	ZINC001047141910	1347218349	/nfs/dbraw/zinc/21/83/49/1347218349.db2.gz	AGGSPRDFBOEFIH-JBACZVJFSA-N	0	3	348.490	3.197	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)Cc3cccs3)C2)CC1	ZINC001047218414	1347249726	/nfs/dbraw/zinc/24/97/26/1347249726.db2.gz	BQWADURBOSVVOQ-SFHVURJKSA-N	0	3	344.524	3.265	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)c3cccs3)C2)CC1	ZINC001047220931	1347252852	/nfs/dbraw/zinc/25/28/52/1347252852.db2.gz	KSBLMUTWEGGYCQ-QGZVFWFLSA-N	0	3	330.497	3.336	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)C=C3CCCCC3)C2)CC1	ZINC001047224574	1347254749	/nfs/dbraw/zinc/25/47/49/1347254749.db2.gz	GFIRODPXLXWLBZ-FQEVSTJZSA-N	0	3	328.500	3.461	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)C(C)=C3CCC3)C2)CC1	ZINC001047240057	1347266691	/nfs/dbraw/zinc/26/66/91/1347266691.db2.gz	YOSXINAOVIGWFQ-FQEVSTJZSA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3c[nH]c4ccccc34)C2)CC1	ZINC001047246605	1347271558	/nfs/dbraw/zinc/27/15/58/1347271558.db2.gz	SLKQHOWSCFVBLY-SFHVURJKSA-N	0	3	349.478	3.365	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)Cc3ccc(C)cc3)C2)CC1	ZINC001047250237	1347274779	/nfs/dbraw/zinc/27/47/79/1347274779.db2.gz	FVPNMJZWKSTSSM-NRFANRHFSA-N	0	3	338.495	3.121	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)C[C@H](C)c3ccco3)C2)CC1	ZINC001047263162	1347284589	/nfs/dbraw/zinc/28/45/89/1347284589.db2.gz	ATYLWGANSNEDNK-HKUYNNGSSA-N	0	3	342.483	3.357	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3ccc(CF)cc3)C2)CC1	ZINC001047266285	1347287494	/nfs/dbraw/zinc/28/74/94/1347287494.db2.gz	UYNLENZPOMMCJP-HXUWFJFHSA-N	0	3	342.458	3.354	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)c2ccsc2)C1	ZINC001047709479	1347343959	/nfs/dbraw/zinc/34/39/59/1347343959.db2.gz	MPXZSFDXIOEGFP-RHSMWYFYSA-N	0	3	339.464	3.260	20	30		EGEDHN
C[C@H](NCc1cc(F)ccc1C#N)[C@@H]1CCN(C(=O)CC(C)(C)C)C1	ZINC001047711940	1347344602	/nfs/dbraw/zinc/34/46/02/1347344602.db2.gz	DISKFWONJSNKET-GOEBONIOSA-N	0	3	345.462	3.460	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@H]([C@H](C)NCc3ccccc3C#N)C2)co1	ZINC001047815196	1347380446	/nfs/dbraw/zinc/38/04/46/1347380446.db2.gz	OBFBBULVSBCXSG-YJBOKZPZSA-N	0	3	337.423	3.100	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H]([C@H](C)NCc2cc(C)no2)C1	ZINC001047855400	1347390166	/nfs/dbraw/zinc/39/01/66/1347390166.db2.gz	LRAVCCRBLREPTM-GXTWGEPZSA-N	0	3	339.867	3.088	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]([C@@H](C)NCc2ccccc2C#N)C1	ZINC001047927598	1347412813	/nfs/dbraw/zinc/41/28/13/1347412813.db2.gz	JMPLQXDGHDJZNJ-APWZRJJASA-N	0	3	339.483	3.487	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]([C@H](C)NCc2cc(C3CC3)no2)C1	ZINC001047933852	1347415304	/nfs/dbraw/zinc/41/53/04/1347415304.db2.gz	ZPVZSYFLEIGLJP-ZFWWWQNUSA-N	0	3	331.460	3.091	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)C(C)(C)C2CC2)C1	ZINC001047942406	1347419092	/nfs/dbraw/zinc/41/90/92/1347419092.db2.gz	XKMYTKQQMGHQPN-CRAIPNDOSA-N	0	3	339.483	3.321	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@@H]([C@H](C)NCc2ccccc2C#N)C1	ZINC001047950467	1347421850	/nfs/dbraw/zinc/42/18/50/1347421850.db2.gz	LVAKXNQABBKTIJ-MAUKXSAKSA-N	0	3	327.472	3.321	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H]([C@@H](C)NCc3cc(C)no3)C2)CC1	ZINC001047960594	1347424925	/nfs/dbraw/zinc/42/49/25/1347424925.db2.gz	UNXRFYWWYUHEAT-NVXWUHKLSA-N	0	3	331.460	3.056	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](C)[C@@H](CNCc2csc(C)n2)C1	ZINC001048337712	1347522404	/nfs/dbraw/zinc/52/24/04/1347522404.db2.gz	FJGZWUVYQQFPTE-ZFWWWQNUSA-N	0	3	335.517	3.238	20	30		EGEDHN
CCC1(C(=O)N2C[C@H](C)[C@H](CNCc3ccccc3C#N)C2)CCC1	ZINC001048342067	1347524160	/nfs/dbraw/zinc/52/41/60/1347524160.db2.gz	GGVFAEYFMDYROR-QFBILLFUSA-N	0	3	339.483	3.323	20	30		EGEDHN
CCC(C)(C)C(=O)N1C[C@@H](C)[C@@H](CNCc2ccccc2C#N)C1	ZINC001048361019	1347531013	/nfs/dbraw/zinc/53/10/13/1347531013.db2.gz	YFANZWPNXZHAFU-QAPCUYQASA-N	0	3	327.472	3.179	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H](C)[C@H](CNCc3nc(C)cs3)C2)CC1	ZINC001048370635	1347532970	/nfs/dbraw/zinc/53/29/70/1347532970.db2.gz	SVUQPCRQEILSQD-WMLDXEAASA-N	0	3	347.528	3.382	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2(C)CC=CC2)C[C@@H]1CNCc1ccccc1C#N	ZINC001048374231	1347534860	/nfs/dbraw/zinc/53/48/60/1347534860.db2.gz	OXTILXZYFVNPTD-APWZRJJASA-N	0	3	337.467	3.099	20	30		EGEDHN
CC(C(=O)N1C[C@H]2CN(CC#Cc3ccccc3)C[C@H]2C1)=C1CCCC1	ZINC001048760091	1347655351	/nfs/dbraw/zinc/65/53/51/1347655351.db2.gz	OWRURZNHJAPXPL-SZPZYZBQSA-N	0	3	348.490	3.319	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CN(Cc3c(C)onc3CC)C[C@H]2C1	ZINC001048974963	1347695390	/nfs/dbraw/zinc/69/53/90/1347695390.db2.gz	LFSGPOUYUBPZJT-IYBDPMFKSA-N	0	3	345.487	3.038	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1cccc(C#N)c1	ZINC001049294575	1347776573	/nfs/dbraw/zinc/77/65/73/1347776573.db2.gz	AQVVUDFKQPJMPE-MOPGFXCFSA-N	0	3	325.456	3.170	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)C[C@H]2C=CCC2)cc1	ZINC001049316228	1347787763	/nfs/dbraw/zinc/78/77/63/1347787763.db2.gz	UQQAIFVMSOBJHE-IOMROCGXSA-N	0	3	349.478	3.480	20	30		EGEDHN
Cc1cc[nH]c1C(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049460913	1347859263	/nfs/dbraw/zinc/85/92/63/1347859263.db2.gz	ZJGJQVIMRHIORJ-RTBURBONSA-N	0	3	348.450	3.074	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C1(c2ccc(F)cc2)CC1	ZINC001049509764	1347884654	/nfs/dbraw/zinc/88/46/54/1347884654.db2.gz	YVBIWTKTAPVNAE-QZTJIDSGSA-N	0	3	328.431	3.109	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1sccc1CN(C)C	ZINC001049510446	1347884827	/nfs/dbraw/zinc/88/48/27/1347884827.db2.gz	GHAYXYJSCZCXEX-SJORKVTESA-N	0	3	347.528	3.065	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc2oc(C)nc2c1	ZINC001049542144	1347899586	/nfs/dbraw/zinc/89/95/86/1347899586.db2.gz	UKKJZGKVWWTPDP-SJORKVTESA-N	0	3	325.412	3.001	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC001049551436	1347904300	/nfs/dbraw/zinc/90/43/00/1347904300.db2.gz	FZZAPEZSLKQWMU-FPCVCCKLSA-N	0	3	342.405	3.382	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(C)c2ccccc2n1	ZINC001049552327	1347905228	/nfs/dbraw/zinc/90/52/28/1347905228.db2.gz	NADSBXJICTZRPM-VQTJNVASSA-N	0	3	335.451	3.408	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccsc1COC	ZINC001049552932	1347905699	/nfs/dbraw/zinc/90/56/99/1347905699.db2.gz	RDFRFRIHCRVLEN-HOTGVXAUSA-N	0	3	334.485	3.150	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)C1(C)CCC(F)(F)CC1	ZINC001049556878	1347907774	/nfs/dbraw/zinc/90/77/74/1347907774.db2.gz	ZWKQNNSKYVQXPO-CABCVRRESA-N	0	3	326.431	3.453	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1F	ZINC001049611789	1347935565	/nfs/dbraw/zinc/93/55/65/1347935565.db2.gz	KOROLUWPYLLWJC-QFHJOOASSA-N	0	3	346.421	3.320	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)CCc1ccc(C)cc1C	ZINC001049620654	1347938545	/nfs/dbraw/zinc/93/85/45/1347938545.db2.gz	LKLLGWJIFMHAEH-RTWAWAEBSA-N	0	3	338.495	3.325	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1nsc2ccc(C)cc21	ZINC001049640535	1347949008	/nfs/dbraw/zinc/94/90/08/1347949008.db2.gz	VZYOYNZYUQNKIG-HZPDHXFCSA-N	0	3	341.480	3.470	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1c(C)[nH]c2ccccc21	ZINC001049681606	1347969969	/nfs/dbraw/zinc/96/99/69/1347969969.db2.gz	PJTGHHSEUZBCOI-LEWJYISDSA-N	0	3	349.478	3.107	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1noc2c1CCCCC2	ZINC001049759762	1348004817	/nfs/dbraw/zinc/00/48/17/1348004817.db2.gz	RVLLJKIIADZLCO-IAGOWNOFSA-N	0	3	343.471	3.199	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(OCC)c(C)c1	ZINC001049761426	1348006399	/nfs/dbraw/zinc/00/63/99/1348006399.db2.gz	JEYIDGRLRDRZJG-ZWKOTPCHSA-N	0	3	328.456	3.259	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049768950	1348011840	/nfs/dbraw/zinc/01/18/40/1348011840.db2.gz	MABIHXRWGWXRMO-DBVUQKKJSA-N	0	3	339.483	3.416	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C1(Cc2ccc(F)cc2)CC1	ZINC001049772945	1348014823	/nfs/dbraw/zinc/01/48/23/1348014823.db2.gz	MFDHDRJRCOKDQD-RTBURBONSA-N	0	3	342.458	3.400	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C[C@H](C)c1ccccc1F	ZINC001049788269	1348022173	/nfs/dbraw/zinc/02/21/73/1348022173.db2.gz	MVLWSOPQUFWQEA-ZYSHUDEJSA-N	0	3	328.431	3.018	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(OC)c(C2CC2)c1	ZINC001049815227	1348034158	/nfs/dbraw/zinc/03/41/58/1348034158.db2.gz	DFRPBSMGBTYPBI-RTBURBONSA-N	0	3	340.467	3.438	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cnoc1-c1ccccc1	ZINC001049822760	1348039736	/nfs/dbraw/zinc/03/97/36/1348039736.db2.gz	NVKJZXORVBWJCJ-MSOLQXFVSA-N	0	3	337.423	3.207	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccnc(O[C@H](C)CC)c1	ZINC001049843207	1348053962	/nfs/dbraw/zinc/05/39/62/1348053962.db2.gz	OEEKGHTWQHUTBV-BPQIPLTHSA-N	0	3	343.471	3.124	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ncccc1OC(C)C	ZINC001049870383	1348076189	/nfs/dbraw/zinc/07/61/89/1348076189.db2.gz	MWXWVLXUOPDUMV-IAGOWNOFSA-N	0	3	343.471	3.124	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)COc1ccccc1C(C)C	ZINC001049881028	1348086314	/nfs/dbraw/zinc/08/63/14/1348086314.db2.gz	LGRXEGSXLFRAAE-OALUTQOASA-N	0	3	342.483	3.440	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1sc(C(C)C)nc1C	ZINC001049891499	1348095844	/nfs/dbraw/zinc/09/58/44/1348095844.db2.gz	UNAXRYUZVMPDSX-HZPDHXFCSA-N	0	3	345.512	3.277	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(C2CCCC2)no1	ZINC001049901640	1348101554	/nfs/dbraw/zinc/10/15/54/1348101554.db2.gz	ZYCGXVUMNFJXKA-QZTJIDSGSA-N	0	3	341.455	3.034	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(Cl)cc2c1OCC2	ZINC001049919898	1348112548	/nfs/dbraw/zinc/11/25/48/1348112548.db2.gz	YNMYIZZLPLRDBB-SJORKVTESA-N	0	3	346.858	3.140	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](C)Cc1cccc(F)c1	ZINC001049925740	1348116138	/nfs/dbraw/zinc/11/61/38/1348116138.db2.gz	FYCJTZIVDHNMRQ-LSTHTHJFSA-N	0	3	342.458	3.093	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C(C)(C)c1ccccc1OC	ZINC001049933745	1348121183	/nfs/dbraw/zinc/12/11/83/1348121183.db2.gz	SAIWJJPQVHRNOQ-QZTJIDSGSA-N	0	3	342.483	3.224	20	30		EGEDHN
CC1CC(C(=O)N2CCC[C@H]3CN(Cc4ccc(C#N)cc4)C[C@H]32)C1	ZINC001050016833	1348155558	/nfs/dbraw/zinc/15/55/58/1348155558.db2.gz	LTIVUSQXNHGYBZ-FOCMDNRUSA-N	0	3	337.467	3.027	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3ccnc(C4CC4)c3)[C@@H]2C1	ZINC001050088051	1348178189	/nfs/dbraw/zinc/17/81/89/1348178189.db2.gz	RMBKFRSXTHTDPB-PKOBYXMFSA-N	0	3	325.456	3.072	20	30		EGEDHN
CC(F)(F)CC(=O)N1CCC[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001050135098	1348192738	/nfs/dbraw/zinc/19/27/38/1348192738.db2.gz	IBAASVWNAXQKQU-DLBZAZTESA-N	0	3	347.409	3.026	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CCCN(C(=O)[C@H]4CC45CCC5)[C@@H]3C2)c1	ZINC001050153666	1348198739	/nfs/dbraw/zinc/19/87/39/1348198739.db2.gz	YSFMHBHTLPGGRD-XUVXKRRUSA-N	0	3	349.478	3.171	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)CCc3ccc(CC)cc3)[C@@H]2C1	ZINC001050198396	1348209277	/nfs/dbraw/zinc/20/92/77/1348209277.db2.gz	CJCLADYKWWTEBY-LEWJYISDSA-N	0	3	338.495	3.128	20	30		EGEDHN
C/C(=C/C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)CC2)C1CC1	ZINC001050448293	1348268729	/nfs/dbraw/zinc/26/87/29/1348268729.db2.gz	XILKNASCJBBLQD-BOPFTXTBSA-N	0	3	349.478	3.339	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)Cc3ccc(C4CCC4)cc3)C2)CC1	ZINC001050608427	1348299742	/nfs/dbraw/zinc/29/97/42/1348299742.db2.gz	WWGYZXPVVYNGJI-UHFFFAOYSA-N	0	3	336.479	3.054	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1c(C)noc1C)CC2	ZINC001050645631	1348313677	/nfs/dbraw/zinc/31/36/77/1348313677.db2.gz	RXMYFDKLYTXDPG-LJQANCHMSA-N	0	3	345.487	3.318	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H](C)OC3CCCCCC3)C2)CC1	ZINC001050655570	1348318687	/nfs/dbraw/zinc/31/86/87/1348318687.db2.gz	OGOSCRTZJQLEGR-GOSISDBHSA-N	0	3	346.515	3.062	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H](CC)c3ccc(F)cc3)C2)CC1	ZINC001050768495	1348353223	/nfs/dbraw/zinc/35/32/23/1348353223.db2.gz	WORRDTASODHIPO-IBGZPJMESA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)[C@@H]3CCCC34CC4)cccc2C1	ZINC001051293191	1348422288	/nfs/dbraw/zinc/42/22/88/1348422288.db2.gz	OQHYJQBVLKZVIP-FQEVSTJZSA-N	0	3	336.479	3.265	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3ccoc3C3CC3)cccc2C1	ZINC001051298273	1348423812	/nfs/dbraw/zinc/42/38/12/1348423812.db2.gz	JOEGSEIUAVFHOD-UHFFFAOYSA-N	0	3	348.446	3.468	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2sc3ccccc3c2C)CC1	ZINC001052541412	1348572923	/nfs/dbraw/zinc/57/29/23/1348572923.db2.gz	VOQJRHTWHKERLR-HNNXBMFYSA-N	0	3	326.465	3.427	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)Cc2ccc(C3CCC3)cc2)CC1	ZINC001052601379	1348591773	/nfs/dbraw/zinc/59/17/73/1348591773.db2.gz	IYYDLBSAQIDENW-NRFANRHFSA-N	0	3	338.495	3.491	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc(F)c(Cl)c2F)CC1	ZINC001052682641	1348629266	/nfs/dbraw/zinc/62/92/66/1348629266.db2.gz	WPLRUQNPHOVADE-GFCCVEGCSA-N	0	3	340.801	3.226	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCN(Cc3cccnc3C)CC2)C1	ZINC001052690882	1348634402	/nfs/dbraw/zinc/63/44/02/1348634402.db2.gz	QEXAHUKAIZIENM-GOSISDBHSA-N	0	3	327.472	3.217	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cc3cccc(F)c3o2)CC1	ZINC001052948042	1348765013	/nfs/dbraw/zinc/76/50/13/1348765013.db2.gz	XGDYAUDKAGPKHG-OAHLLOKOSA-N	0	3	328.387	3.180	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc(OC3CCC3)cc2)CC1	ZINC001052950757	1348765930	/nfs/dbraw/zinc/76/59/30/1348765930.db2.gz	YICMLYQAEORPDX-SFHVURJKSA-N	0	3	340.467	3.226	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)C2CC(c3cccc(F)c3)C2)CC1	ZINC001052970480	1348780447	/nfs/dbraw/zinc/78/04/47/1348780447.db2.gz	NJNNEMNBSYFSGX-AFMYVXGZSA-N	0	3	342.458	3.313	20	30		EGEDHN
CC(=O)N1CCC[C@H]([C@@H]2CCCN(Cc3ccc(C#N)s3)C2)C1	ZINC001052997091	1348793938	/nfs/dbraw/zinc/79/39/38/1348793938.db2.gz	ORFQTLVCOHXAID-CVEARBPZSA-N	0	3	331.485	3.090	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(F)cc2)C1	ZINC001053063431	1348875305	/nfs/dbraw/zinc/87/53/05/1348875305.db2.gz	MUONUBLDVMGPFF-IEBWSBKVSA-N	0	3	328.431	3.166	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2scnc2C)C1	ZINC001053070004	1348883581	/nfs/dbraw/zinc/88/35/81/1348883581.db2.gz	RQUVAZUZUMUUEB-IRXDYDNUSA-N	0	3	345.512	3.182	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccncc2C)C1	ZINC001053081735	1348903191	/nfs/dbraw/zinc/90/31/91/1348903191.db2.gz	XRNQZXZCTFFTBG-ICSRJNTNSA-N	0	3	339.483	3.120	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)CCc2ccsc2)C1	ZINC001053088681	1348914311	/nfs/dbraw/zinc/91/43/11/1348914311.db2.gz	ZECZHWOKSUMCCT-OALUTQOASA-N	0	3	344.524	3.407	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)CCc2ccccc2)C1	ZINC001053104139	1348939721	/nfs/dbraw/zinc/93/97/21/1348939721.db2.gz	COWGGYCQRJZMIU-RTWAWAEBSA-N	0	3	338.495	3.346	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccccc2OC)C1	ZINC001053106932	1348945496	/nfs/dbraw/zinc/94/54/96/1348945496.db2.gz	XELACKBJDPBBSG-MJGOQNOKSA-N	0	3	340.467	3.035	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2ccccc2-c2ccncc2)C1	ZINC001079956861	1357438432	/nfs/dbraw/zinc/43/84/32/1357438432.db2.gz	DPSWSZDNXYHTEN-OXQOHEQNSA-N	0	3	335.451	3.375	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc(C)n(CC)c1C)C2	ZINC001054161158	1349163495	/nfs/dbraw/zinc/16/34/95/1349163495.db2.gz	YNSTYMMRURULOH-NRFANRHFSA-N	0	3	341.499	3.076	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1c(C)[nH]c3ccccc31)C2	ZINC001054161321	1349163792	/nfs/dbraw/zinc/16/37/92/1349163792.db2.gz	BSLPIICJBBHNMM-NRFANRHFSA-N	0	3	335.451	3.038	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)Cc1cccc(C)c1Cl)C2	ZINC001054163623	1349165962	/nfs/dbraw/zinc/16/59/62/1349165962.db2.gz	NFIYTFNOXOOOGU-FQEVSTJZSA-N	0	3	344.886	3.139	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@]2(CCN(Cc3scnc3C)C2)C1	ZINC001054175325	1349177040	/nfs/dbraw/zinc/17/70/40/1349177040.db2.gz	MIDQFJAJCUDIQL-LJQANCHMSA-N	0	3	347.528	3.478	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N1CCC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001054180487	1349183260	/nfs/dbraw/zinc/18/32/60/1349183260.db2.gz	UGHLUIPUDRYTKS-NBHGPNQESA-N	0	3	337.467	3.029	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccoc1C1CC1)C2	ZINC001054184410	1349187161	/nfs/dbraw/zinc/18/71/61/1349187161.db2.gz	CUZLJVVQMVBYQA-HXUWFJFHSA-N	0	3	326.440	3.108	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(F)c(C)c1)C2	ZINC001054186984	1349190257	/nfs/dbraw/zinc/19/02/57/1349190257.db2.gz	JAWQIOIOULWSPN-HXUWFJFHSA-N	0	3	328.431	3.086	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc3cc[nH]c3c1)C2	ZINC001054205747	1349207545	/nfs/dbraw/zinc/20/75/45/1349207545.db2.gz	WTDRFLGBFBXZHS-OAQYLSRUSA-N	0	3	335.451	3.119	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc3sccc3[nH]1)C2	ZINC001054223841	1349219051	/nfs/dbraw/zinc/21/90/51/1349219051.db2.gz	JSTUNRQXDTZCRQ-IBGZPJMESA-N	0	3	341.480	3.181	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc(C)c(F)c(C)c1)C2	ZINC001054242120	1349235731	/nfs/dbraw/zinc/23/57/31/1349235731.db2.gz	FRKWECMXQYOZDU-HXUWFJFHSA-N	0	3	328.431	3.004	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H](C)Cc1ccccc1)C2	ZINC001054243433	1349236668	/nfs/dbraw/zinc/23/66/68/1349236668.db2.gz	HMBMQUZZGIVVOJ-UGKGYDQZSA-N	0	3	338.495	3.203	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@@H]3CCCO[C@@H]3C)cc2C1	ZINC001054262299	1349259576	/nfs/dbraw/zinc/25/95/76/1349259576.db2.gz	URKVIVAIXFOLCS-DNVCBOLYSA-N	0	3	328.456	3.010	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3ccnn3CC)cc2C1	ZINC001054262946	1349260715	/nfs/dbraw/zinc/26/07/15/1349260715.db2.gz	YFUKTCGUPLRSQI-UHFFFAOYSA-N	0	3	338.455	3.115	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cnc(C4CC4)o3)cc2C1	ZINC001054267946	1349265881	/nfs/dbraw/zinc/26/58/81/1349265881.db2.gz	KZXYZXJGNGWEMT-UHFFFAOYSA-N	0	3	337.423	3.374	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cc(C4CC4)on3)cc2C1	ZINC001054276037	1349276148	/nfs/dbraw/zinc/27/61/48/1349276148.db2.gz	KRUNGFLTSJZMOF-UHFFFAOYSA-N	0	3	337.423	3.374	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)NCc1ccc2c(c1)CN(CCCC)C2	ZINC001054283005	1349284496	/nfs/dbraw/zinc/28/44/96/1349284496.db2.gz	GNDHKJURZZQNTC-MOPGFXCFSA-N	0	3	328.456	3.010	20	30		EGEDHN
C#Cc1ccc(C(=O)NCc2ccc3c(c2)CN(CCC(C)C)C3)nc1	ZINC001054290331	1349295656	/nfs/dbraw/zinc/29/56/56/1349295656.db2.gz	NBVJMUPFSICZIV-UHFFFAOYSA-N	0	3	347.462	3.355	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2cc3c([nH]2)c(F)ccc3C)C1	ZINC001080001768	1357454500	/nfs/dbraw/zinc/45/45/00/1357454500.db2.gz	VCLBPTZDNPNWKD-CXAGYDPISA-N	0	3	329.419	3.242	20	30		EGEDHN
Cc1ccsc1C(=O)N1C[C@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001054341415	1349321262	/nfs/dbraw/zinc/32/12/62/1349321262.db2.gz	ZQJMNGMEJWLYLH-SWLSCSKDSA-N	0	3	345.493	3.240	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2CCCC2)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054346508	1349326241	/nfs/dbraw/zinc/32/62/41/1349326241.db2.gz	JNMLFDRHHWWWKJ-DYVFJYSZSA-N	0	3	331.485	3.137	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@@H](NCc2ccc(C#N)s2)C1	ZINC001054970824	1349531437	/nfs/dbraw/zinc/53/14/37/1349531437.db2.gz	JAIJNEJEZWNPEE-CJNGLKHVSA-N	0	3	331.485	3.159	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)C(C)(C)C1CC1	ZINC001135252392	1377002708	/nfs/dbraw/zinc/00/27/08/1377002708.db2.gz	RSLZGKXRTPQBMJ-VXGBXAGGSA-N	0	3	331.298	3.204	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)Cc2c[nH]c3cc(C)ccc23)C1	ZINC001080603951	1357694948	/nfs/dbraw/zinc/69/49/48/1357694948.db2.gz	DOQQDLALEHBKTC-DNVCBOLYSA-N	0	3	325.456	3.031	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2[nH]c3ccc(C)cc3c2C)C1	ZINC001080697787	1357721996	/nfs/dbraw/zinc/72/19/96/1357721996.db2.gz	VDDPAYFSJUJPER-RDTXWAMCSA-N	0	3	325.456	3.411	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1cncc(-c2ccccc2)c1	ZINC001085628600	1358645730	/nfs/dbraw/zinc/64/57/30/1358645730.db2.gz	ARSXZYLANRTKIO-HXUWFJFHSA-N	0	3	335.451	3.471	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)[C@H]2CCC=CCCC2)C1	ZINC001070413259	1354341066	/nfs/dbraw/zinc/34/10/66/1354341066.db2.gz	YFLNIIUFVKLPCV-DLBZAZTESA-N	0	3	342.487	3.138	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCO[C@H]1C1CCN(C(=O)C(CC)CC)CC1	ZINC001071037443	1354441326	/nfs/dbraw/zinc/44/13/26/1354441326.db2.gz	KTCBZKWIHYFGFK-SJORKVTESA-N	0	3	342.911	3.161	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)CC1=CCCCC1)C[C@H](C)O2	ZINC001071146090	1354475687	/nfs/dbraw/zinc/47/56/87/1354475687.db2.gz	GMEHEJNHAAFEGI-PXNSSMCTSA-N	0	3	332.488	3.145	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1csc(C)c1C)C[C@H](C)O2	ZINC001071168417	1354485964	/nfs/dbraw/zinc/48/59/64/1354485964.db2.gz	APGRVFHNWVSZFG-LIRRHRJNSA-N	0	3	348.512	3.246	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1occc1C(C)C)C[C@@H](C)O2	ZINC001071202578	1354502717	/nfs/dbraw/zinc/50/27/17/1354502717.db2.gz	XDQGJNZDNRKBAG-UZLBHIALSA-N	0	3	346.471	3.285	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(F)c(C(F)F)c2)CC[C@@H]1C	ZINC001071515184	1354738218	/nfs/dbraw/zinc/73/82/18/1354738218.db2.gz	RYEDHJAOCBMHBP-JSGCOSHPSA-N	0	3	338.373	3.369	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2sc(Cl)nc2C)CC[C@H]1C	ZINC001071533642	1354750544	/nfs/dbraw/zinc/75/05/44/1354750544.db2.gz	IZOLKCRGUOUELN-PWSUYJOCSA-N	0	3	327.881	3.264	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCCCCN(C(=O)C3CCC3)C2)c(F)c1	ZINC001088245776	1359815734	/nfs/dbraw/zinc/81/57/34/1359815734.db2.gz	CFFSQWKPSFLNOU-SFHVURJKSA-N	0	3	343.446	3.358	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2(c3cccc(Cl)c3)CC2)CC[C@H]1C	ZINC001071544455	1354757587	/nfs/dbraw/zinc/75/75/87/1354757587.db2.gz	YWJKVHWXGFFXPZ-CRAIPNDOSA-N	0	3	344.886	3.364	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cnn(C(C)(C)C)c2C)CC[C@H]1C	ZINC001071544306	1354757979	/nfs/dbraw/zinc/75/79/79/1354757979.db2.gz	WTXPDCKEHAARCS-ZBFHGGJFSA-N	0	3	332.492	3.105	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cncn2-c2ccccc2)CC[C@@H]1C	ZINC001071560561	1354764351	/nfs/dbraw/zinc/76/43/51/1354764351.db2.gz	CHQAIPZMVRBKLO-IRXDYDNUSA-N	0	3	338.455	3.031	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)c2cn(C)c3ccc(F)cc23)CC[C@H]1C	ZINC001071572432	1354771393	/nfs/dbraw/zinc/77/13/93/1354771393.db2.gz	VVCPIDVHOUABJA-HIFRSBDPSA-N	0	3	329.419	3.086	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2cnc(CC3CC3)s2)CC[C@H]1C	ZINC001071692025	1354854122	/nfs/dbraw/zinc/85/41/22/1354854122.db2.gz	DXHQLTFFAAMEDZ-UKRRQHHQSA-N	0	3	333.501	3.254	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2(c3ccc(F)cc3)CCC2)CC[C@H]1C	ZINC001071729267	1354885103	/nfs/dbraw/zinc/88/51/03/1354885103.db2.gz	YEYHYKRCBCYHEQ-VQIMIIECSA-N	0	3	342.458	3.240	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2nc(Cl)cs2)CC[C@H]1C	ZINC001071769415	1354915241	/nfs/dbraw/zinc/91/52/41/1354915241.db2.gz	QNABGZJWZZJRPZ-NEPJUHHUSA-N	0	3	327.881	3.345	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C2(c3cccnc3)CCCC2)CC[C@@H]1C	ZINC001071773166	1354920525	/nfs/dbraw/zinc/92/05/25/1354920525.db2.gz	XGRXHKVMPPNLSN-PKOBYXMFSA-N	0	3	341.499	3.439	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cnc(C(C)C)nc2C)CC[C@H]1C	ZINC001071875827	1355000781	/nfs/dbraw/zinc/00/07/81/1355000781.db2.gz	FGCLTEGJYSCJQX-GDBMZVCRSA-N	0	3	330.476	3.067	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(OC)c(C3CC3)c2)CC[C@@H]1C	ZINC001071946602	1355037306	/nfs/dbraw/zinc/03/73/06/1355037306.db2.gz	LBTDGIYIICDLOO-YJBOKZPZSA-N	0	3	340.467	3.179	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc3c(C)cccn3c2)CC[C@H]1C	ZINC001071988879	1355061161	/nfs/dbraw/zinc/06/11/61/1355061161.db2.gz	MGUMQXSUEKVROL-AEFFLSMTSA-N	0	3	325.456	3.407	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C(C)(C)c2ccc(C)cc2)CC[C@H]1C	ZINC001072003173	1355068296	/nfs/dbraw/zinc/06/82/96/1355068296.db2.gz	SETZHTFTQYYHNY-MJGOQNOKSA-N	0	3	326.484	3.265	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc(C)n(C(C)C)c2C)CC[C@H]1C	ZINC001072063205	1355109384	/nfs/dbraw/zinc/10/93/84/1355109384.db2.gz	SNXLNKNVCDJTRX-CRAIPNDOSA-N	0	3	329.488	3.292	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc(C)n(C(C)(C)C)n2)CC[C@H]1C	ZINC001072076570	1355115686	/nfs/dbraw/zinc/11/56/86/1355115686.db2.gz	RFFPGYYBRXQSLK-ZBFHGGJFSA-N	0	3	332.492	3.105	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2ccc(P(C)(C)=O)cc2)CC[C@@H]1C	ZINC001072087819	1355120497	/nfs/dbraw/zinc/12/04/97/1355120497.db2.gz	BRINKHTWQSVSNV-DOTOQJQBSA-N	0	3	348.427	3.093	20	30		EGEDHN
C[C@H]1CCN(C(=O)CC2CC2)C[C@@H]1CNCc1cc(F)ccc1C#N	ZINC001072160863	1355159482	/nfs/dbraw/zinc/15/94/82/1355159482.db2.gz	WNDDROQHPJDMIL-KSSFIOAISA-N	0	3	343.446	3.072	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@H](C)[C@H](CNCc2ccccc2C#N)C1	ZINC001072170127	1355165231	/nfs/dbraw/zinc/16/52/31/1355165231.db2.gz	CBNGPOBEHMYUDF-QFBILLFUSA-N	0	3	327.472	3.179	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](C)[C@@H](CNCc3nc(C)cs3)C2)C1	ZINC001072359864	1355255755	/nfs/dbraw/zinc/25/57/55/1355255755.db2.gz	IHRGEWGXLVCOPX-ZBFHGGJFSA-N	0	3	347.528	3.382	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](C)[C@@H](CNCc3nccs3)C2)C1	ZINC001072360510	1355256845	/nfs/dbraw/zinc/25/68/45/1355256845.db2.gz	RCHSEZRPVQCSCD-GJZGRUSLSA-N	0	3	333.501	3.074	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC2(C1)CCN([C@H]1CCc3c1cccc3Cl)C2	ZINC001072552093	1355330841	/nfs/dbraw/zinc/33/08/41/1355330841.db2.gz	MNQFUSVVPJRNHT-GUYCJALGSA-N	0	3	343.858	3.021	20	30		EGEDHN
CC(C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2)=C1CCC1	ZINC001072713750	1355400693	/nfs/dbraw/zinc/40/06/93/1355400693.db2.gz	KULKMBIQNNJETL-UHFFFAOYSA-N	0	3	335.451	3.093	20	30		EGEDHN
CC[C@@H](c1ccc(F)cc1)N1CCC2(CN(C(=O)C#CC3CC3)C2)C1	ZINC001072721561	1355406308	/nfs/dbraw/zinc/40/63/08/1355406308.db2.gz	XRCIXNPYZKXDLV-IBGZPJMESA-N	0	3	340.442	3.225	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)[C@@H]4CCC[C@@H]5C[C@@H]54)C3)C2)c1	ZINC001072875412	1355478378	/nfs/dbraw/zinc/47/83/78/1355478378.db2.gz	QNSPRODKXDJCJS-AQNXPRMDSA-N	0	3	349.478	3.029	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1ncccc1C)C2	ZINC001072945328	1355513173	/nfs/dbraw/zinc/51/31/73/1355513173.db2.gz	ZOZHGSVCZREKGR-IBGZPJMESA-N	0	3	327.472	3.027	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@H](CC)Cc3cccc(C)c3)C2)C1	ZINC001073039290	1355564719	/nfs/dbraw/zinc/56/47/19/1355564719.db2.gz	JMQQVIJODYGWKA-LJQANCHMSA-N	0	3	326.484	3.284	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3cc4c(s3)CC[C@@H](C)C4)C2)C1	ZINC001073420111	1355769153	/nfs/dbraw/zinc/76/91/53/1355769153.db2.gz	NNARYGIRBCZDGR-CQSZACIVSA-N	0	3	330.497	3.207	20	30		EGEDHN
C[C@H](CC(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2)C1CC1	ZINC001073463710	1355797145	/nfs/dbraw/zinc/79/71/45/1355797145.db2.gz	OCJKMWMWERFICA-MRXNPFEDSA-N	0	3	337.467	3.029	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H](c3ccc(F)cc3)C(C)C)C2)C1	ZINC001073469940	1355803825	/nfs/dbraw/zinc/80/38/25/1355803825.db2.gz	QHUGTMWXYUVKKE-LJQANCHMSA-N	0	3	342.458	3.123	20	30		EGEDHN
C#CCCN1CCCO[C@@H](CNC(=O)c2ccc([C@H](C)CC)cc2)C1	ZINC001073899378	1355946581	/nfs/dbraw/zinc/94/65/81/1355946581.db2.gz	RIYRHUOULCMQQL-XLIONFOSSA-N	0	3	342.483	3.044	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCCN1C(=O)c1ccc[nH]1	ZINC001073947239	1355985015	/nfs/dbraw/zinc/98/50/15/1355985015.db2.gz	IJPQPYDXHGUREV-GOSISDBHSA-N	0	3	336.439	3.013	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCCN1C(=O)c1ccc[nH]1	ZINC001073947427	1355985105	/nfs/dbraw/zinc/98/51/05/1355985105.db2.gz	QRZNQMYLWOOLTJ-GOSISDBHSA-N	0	3	336.439	3.013	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(C#N)cc1	ZINC001073953058	1355989167	/nfs/dbraw/zinc/98/91/67/1355989167.db2.gz	SNJNFZIKKDIIDR-QFBILLFUSA-N	0	3	327.472	3.417	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCCN1C(=O)C1=CCCC1	ZINC001073992285	1356020520	/nfs/dbraw/zinc/02/05/20/1356020520.db2.gz	OGJDPWPULQECKY-HXUWFJFHSA-N	0	3	337.467	3.481	20	30		EGEDHN
CN(Cc1ccccc1)C[C@H]1CCCCN1C(=O)c1c[nH]c(C#N)c1	ZINC001073996461	1356024827	/nfs/dbraw/zinc/02/48/27/1356024827.db2.gz	BYZQJBAJMIQAED-LJQANCHMSA-N	0	3	336.439	3.013	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCCN1C(=O)[C@@H]1CC1(C)C	ZINC001073996934	1356025612	/nfs/dbraw/zinc/02/56/12/1356025612.db2.gz	LIDQTTLTECYWAX-MOPGFXCFSA-N	0	3	339.483	3.417	20	30		EGEDHN
CC[C@H](F)C(=O)N1CCCC[C@@H]1CN(C)Cc1cccc(C#N)c1	ZINC001074050606	1356055662	/nfs/dbraw/zinc/05/56/62/1356055662.db2.gz	JIOKPHTVMKLLNY-MSOLQXFVSA-N	0	3	331.435	3.119	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@@H](CNCc2cc(F)ccc2C#N)[C@H](C)C1	ZINC001075210000	1356344168	/nfs/dbraw/zinc/34/41/68/1356344168.db2.gz	UIICGPZNXPBBDZ-WBVHZDCISA-N	0	3	343.446	3.238	20	30		EGEDHN
C=CCN1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)[C@@H]2C[C@H]2C)C1	ZINC001075422102	1356364657	/nfs/dbraw/zinc/36/46/57/1356364657.db2.gz	KYVAQEBQBHWIEF-YCEFEEMOSA-N	0	3	330.447	3.189	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccc(C(C)(C)C)cn3)[C@@H]2C1	ZINC001075805145	1356424033	/nfs/dbraw/zinc/42/40/33/1356424033.db2.gz	PHVYVKLBUNFVAH-MAUKXSAKSA-N	0	3	327.472	3.102	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccc(F)c4ccncc34)[C@@H]2C1	ZINC001076159909	1356509719	/nfs/dbraw/zinc/50/97/19/1356509719.db2.gz	BXOKHECZHYNNKC-IFXJQAMLSA-N	0	3	339.414	3.096	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@H](C)Cc3ccccc3F)[C@@H]2C1	ZINC001076232545	1356525855	/nfs/dbraw/zinc/52/58/55/1356525855.db2.gz	JJSAPQSAIOJNTI-HHXXYDBFSA-N	0	3	330.447	3.113	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@@H](C)c3ccc(CC)cc3)[C@@H]2C1	ZINC001076366037	1356560967	/nfs/dbraw/zinc/56/09/67/1356560967.db2.gz	ZUTAYFMCTADCNH-FFZOFVMBSA-N	0	3	326.484	3.461	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@H](C)c3ccc(F)c(F)c3)[C@@H]2C1	ZINC001076590291	1356625546	/nfs/dbraw/zinc/62/55/46/1356625546.db2.gz	FABFNAKWBATJIR-QIIPPGSGSA-N	0	3	334.410	3.177	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(C(C)(C)C)on2)C1	ZINC001098939645	1363530360	/nfs/dbraw/zinc/53/03/60/1363530360.db2.gz	YBHUSAIGTYUVRH-LIRRHRJNSA-N	0	3	331.460	3.133	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H](C)C1CCC1	ZINC001099126239	1363638840	/nfs/dbraw/zinc/63/88/40/1363638840.db2.gz	PWHREPUHVZRRCF-SJLPKXTDSA-N	0	3	336.520	3.232	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)C(C)(C)C(F)(F)F	ZINC001099315873	1363745691	/nfs/dbraw/zinc/74/56/91/1363745691.db2.gz	IYIPKQLDHDBCLT-CYBMUJFWSA-N	0	3	332.410	3.205	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)[C@H](c1ccccc1)N(C)C	ZINC001099349605	1363766526	/nfs/dbraw/zinc/76/65/26/1363766526.db2.gz	QOUPHNDOHVDWJD-OALUTQOASA-N	0	3	343.515	3.082	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2c(C)cncc2C)C12CCC2	ZINC001078680280	1357052556	/nfs/dbraw/zinc/05/25/56/1357052556.db2.gz	NQWAAQQDWAPILX-GJZGRUSLSA-N	0	3	333.863	3.082	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2C[C@@H](NCc3conc3C)C23CCC3)CC1	ZINC001078716654	1357062934	/nfs/dbraw/zinc/06/29/34/1357062934.db2.gz	WGPVOSIBAAXOLO-QZTJIDSGSA-N	0	3	343.471	3.246	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2C[C@@H](NCc3cncs3)C23CCC3)C1	ZINC001078720484	1357064937	/nfs/dbraw/zinc/06/49/37/1357064937.db2.gz	LTQSHLGFVBEBJX-HUUCEWRRSA-N	0	3	331.485	3.016	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@@H](NCc3c(C)noc3C)C23CCC3)C1	ZINC001078720449	1357065415	/nfs/dbraw/zinc/06/54/15/1357065415.db2.gz	LCQDEPCEDKTABR-SJORKVTESA-N	0	3	343.471	3.165	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2ccc3c(c2)COC3)C12CCC2	ZINC001078745701	1357069839	/nfs/dbraw/zinc/06/98/39/1357069839.db2.gz	BHVHKTDCMSTIAK-IAGOWNOFSA-N	0	3	346.858	3.100	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)C2(F)CCCCC2)C12CCC2	ZINC001078771171	1357076202	/nfs/dbraw/zinc/07/62/02/1357076202.db2.gz	QJTGBOHCAWRFTN-KBPBESRZSA-N	0	3	328.859	3.428	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2sc(C)cc2C)C[C@H]1c1ccccc1	ZINC001081122263	1357840700	/nfs/dbraw/zinc/84/07/00/1357840700.db2.gz	KSIKSTIQKPFKET-ZWKOTPCHSA-N	0	3	338.476	3.196	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2ccoc2C(C)C)C[C@H]1c1ccccc1	ZINC001081232913	1357851936	/nfs/dbraw/zinc/85/19/36/1357851936.db2.gz	HCTHKHIKBJUPQC-RBUKOAKNSA-N	0	3	336.435	3.234	20	30		EGEDHN
COc1ccc([C@@H](NC(C)C)C(=O)N2CCCC(C)(C)[C@@H]2C#N)cc1	ZINC001183389806	1387305920	/nfs/dbraw/zinc/30/59/20/1387305920.db2.gz	SGGHPDUHMZYTDB-ZWKOTPCHSA-N	0	3	343.471	3.275	20	30		EGEDHN
C[C@@H](N[C@@H]1CN(C(=O)C#CC2CC2)C[C@H]1C)c1cccc(Cl)c1F	ZINC001082504896	1358052905	/nfs/dbraw/zinc/05/29/05/1358052905.db2.gz	QVIJQNIRXDVELI-PBFPGSCMSA-N	0	3	348.849	3.390	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)c3cc(C)c(Cl)cc3C)[C@H]2C1	ZINC001083161307	1358121855	/nfs/dbraw/zinc/12/18/55/1358121855.db2.gz	WDAFOBUAWLUHLY-ZWKOTPCHSA-N	0	3	348.874	3.058	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)CC(C)(C)C3CCCCC3)[C@H]2C1	ZINC001083247929	1358126944	/nfs/dbraw/zinc/12/69/44/1358126944.db2.gz	KCWIYKHZZGAUHB-RBUKOAKNSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)C2CCC(CCCC)CC2)[C@@H](O)C1	ZINC001084031177	1358135509	/nfs/dbraw/zinc/13/55/09/1358135509.db2.gz	VVNATJAYAQBRJD-GMNCBBECSA-N	0	3	336.520	3.111	20	30		EGEDHN
O=C(C#CC1CC1)N1C[C@H]2CCN(Cc3ccccc3C3CC3)C[C@H]21	ZINC001084333852	1358195432	/nfs/dbraw/zinc/19/54/32/1358195432.db2.gz	CWAOGQVQIATCRJ-TZIWHRDSSA-N	0	3	334.463	3.010	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)CC(C)(C)c3ccc(F)cc3)[C@@H]2C1	ZINC001084409211	1358209133	/nfs/dbraw/zinc/20/91/33/1358209133.db2.gz	PMXPJLLGLAOKOR-VQIMIIECSA-N	0	3	342.458	3.049	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)CCc3ccc(C)c(Cl)c3)[C@@H]2C1	ZINC001084554727	1358237271	/nfs/dbraw/zinc/23/72/71/1358237271.db2.gz	DDQVGOPGNRHWTG-IEBWSBKVSA-N	0	3	344.886	3.137	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CCN(CCc3cccs3)C[C@H]21	ZINC001084634841	1358262894	/nfs/dbraw/zinc/26/28/94/1358262894.db2.gz	GODLKQVUIHMNGE-SZVBFZGTSA-N	0	3	332.513	3.426	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)C(C)(C)c3cccc(Cl)c3)[C@@H]2C1	ZINC001084689573	1358281843	/nfs/dbraw/zinc/28/18/43/1358281843.db2.gz	KKGKRKZGTMTNCQ-CRAIPNDOSA-N	0	3	344.886	3.174	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)c3ccc(C)c(C)c3Cl)[C@@H]2C1	ZINC001084774818	1358307121	/nfs/dbraw/zinc/30/71/21/1358307121.db2.gz	GBRYBBZYEFJFIU-NVXWUHKLSA-N	0	3	330.859	3.126	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)C3CCC(C(C)(C)C)CC3)[C@@H]2C1	ZINC001084810619	1358317080	/nfs/dbraw/zinc/31/70/80/1358317080.db2.gz	XLMCYWBWBDISJB-JWHDQAAXSA-N	0	3	330.516	3.395	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CC[C@H]2CCN(Cc3cccc(C#N)c3)[C@H]2C1	ZINC001085038343	1358373715	/nfs/dbraw/zinc/37/37/15/1358373715.db2.gz	KCFPLHNVGOMZPT-WTGUMLROSA-N	0	3	337.467	3.027	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C3CCC(C(F)F)CC3)C[C@@H]21	ZINC001085084959	1358387287	/nfs/dbraw/zinc/38/72/87/1358387287.db2.gz	ORRUDAZDSGXWIT-VXLLPVPCSA-N	0	3	338.442	3.004	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCCC[C@H]2NC(=O)C2CCC2)c(F)c1	ZINC001085113608	1358395280	/nfs/dbraw/zinc/39/52/80/1358395280.db2.gz	JYMFHZJZCRCQMO-QZTJIDSGSA-N	0	3	329.419	3.014	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N[C@@H]1CCCC[C@H]1NCc1cc(C#N)ccc1F	ZINC001085174093	1358423913	/nfs/dbraw/zinc/42/39/13/1358423913.db2.gz	VSAISGWAIPENAH-CGTJXYLNSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)Cc1cccc(F)c1F	ZINC001085346173	1358474507	/nfs/dbraw/zinc/47/45/07/1358474507.db2.gz	JVCLTLGHNVOAOJ-HUUCEWRRSA-N	0	3	342.817	3.277	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1csc(Cl)n1	ZINC001085385286	1358484528	/nfs/dbraw/zinc/48/45/28/1358484528.db2.gz	REEYQFYCBSYDBC-NXEZZACHSA-N	0	3	334.272	3.180	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1cc(C(F)F)ccc1F	ZINC001085599377	1358624060	/nfs/dbraw/zinc/62/40/60/1358624060.db2.gz	PRCQSDNQVWVWJP-ZDUSSCGKSA-N	0	3	326.362	3.486	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1cc(F)cc2ccncc21	ZINC001085600325	1358625722	/nfs/dbraw/zinc/62/57/22/1358625722.db2.gz	QCNTUAOWQMIRQR-MRXNPFEDSA-N	0	3	327.403	3.096	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1c(Cl)n[nH]c1C1CC1	ZINC001085637546	1358651627	/nfs/dbraw/zinc/65/16/27/1358651627.db2.gz	RZCPYQYQZIIGES-ZDUSSCGKSA-N	0	3	336.867	3.053	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1ccc(-c2cnco2)cc1	ZINC001085675847	1358679835	/nfs/dbraw/zinc/67/98/35/1358679835.db2.gz	BFUIQENIIYPYRK-QGZVFWFLSA-N	0	3	325.412	3.064	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc2cc(F)ccc2[nH]1	ZINC001085753252	1358734504	/nfs/dbraw/zinc/73/45/04/1358734504.db2.gz	BQKFLBQRLNLZIN-INIZCTEOSA-N	0	3	329.419	3.420	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C[C@@H]2CCN2C[C@H]2CCC(F)(F)C2)cc1	ZINC001085758101	1358737903	/nfs/dbraw/zinc/73/79/03/1358737903.db2.gz	ZLPRCKIMPUMEPO-WMZOPIPTSA-N	0	3	346.421	3.250	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1ccc(F)c2ccncc12	ZINC001085779908	1358755102	/nfs/dbraw/zinc/75/51/02/1358755102.db2.gz	GDIKUIZTQDQDIW-AWEZNQCLSA-N	0	3	327.403	3.096	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc2ccccc2n1C	ZINC001085789779	1358764336	/nfs/dbraw/zinc/76/43/36/1358764336.db2.gz	QTEIWGLHKGYGEH-QGZVFWFLSA-N	0	3	325.456	3.291	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)[C@@H]1C[C@H]1c1c(F)cccc1F	ZINC001085805360	1358780857	/nfs/dbraw/zinc/78/08/57/1358780857.db2.gz	DVIINXJKUFCYNJ-RBSFLKMASA-N	0	3	334.410	3.177	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@@H]1CCO[C@H]1c1ccccc1	ZINC001085868495	1358835322	/nfs/dbraw/zinc/83/53/22/1358835322.db2.gz	QWVWKFXQGXIMGN-ZCNNSNEGSA-N	0	3	342.483	3.263	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc(C(F)(F)F)ccn1	ZINC001085907369	1358866053	/nfs/dbraw/zinc/86/60/53/1358866053.db2.gz	UQZGQLRGCKWKQO-AWEZNQCLSA-N	0	3	341.377	3.213	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C[C@@H]2CCN2[C@@H](C)c2ccccc2C)cn1	ZINC001085932915	1358888320	/nfs/dbraw/zinc/88/83/20/1358888320.db2.gz	LTSQIYNRDXGDJS-PXNSSMCTSA-N	0	3	347.462	3.279	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C[C@@H]2CCN2Cc2c(C)cccc2C)cn1	ZINC001085934038	1358889393	/nfs/dbraw/zinc/88/93/93/1358889393.db2.gz	QHMCZRWQOQKRIY-FQEVSTJZSA-N	0	3	347.462	3.026	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc2nc(C)ccc2o1	ZINC001085937910	1358893749	/nfs/dbraw/zinc/89/37/49/1358893749.db2.gz	RWVZAQYMZIAALH-HNNXBMFYSA-N	0	3	327.428	3.249	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1c(Cl)nc2ccccn21	ZINC001085959981	1358917859	/nfs/dbraw/zinc/91/78/59/1358917859.db2.gz	ROMBCERZZVZAOZ-CQSZACIVSA-N	0	3	346.862	3.100	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1ccccc1OCC1CC1	ZINC001085985743	1358938010	/nfs/dbraw/zinc/93/80/10/1358938010.db2.gz	MEWVGVSPBJREIR-KRWDZBQOSA-N	0	3	328.456	3.198	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@@H](CNC(=O)c3ccsc3)C2)c(F)c1	ZINC001086022317	1358969502	/nfs/dbraw/zinc/96/95/02/1358969502.db2.gz	GTBKTTLSPMGWAB-AKAXFMLLSA-N	0	3	343.427	3.057	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cccc([C@H]3CCOC3)c2)C1	ZINC001086131079	1359005099	/nfs/dbraw/zinc/00/50/99/1359005099.db2.gz	GCHZQFPSSKMCHY-JCGIZDLHSA-N	0	3	348.874	3.041	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)NC[C@H]2C[C@@H](NCc3cc(C#N)ccc3F)C2)C1	ZINC001086216234	1359029934	/nfs/dbraw/zinc/02/99/34/1359029934.db2.gz	NAYYXABQHCGBCF-OWIUFQIYSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@@H]2C[C@H]2c2ccccc2OC)C1	ZINC001086221213	1359031477	/nfs/dbraw/zinc/03/14/77/1359031477.db2.gz	KWZPRBYGEPTSST-HDEZJCGLSA-N	0	3	348.874	3.036	20	30		EGEDHN
CC[C@]1(C)C[C@H]1C(=O)NC[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001086240065	1359037243	/nfs/dbraw/zinc/03/72/43/1359037243.db2.gz	POTZGHVHJQJRBF-DZIWXPPMSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc3ccncc3c2)C1	ZINC001086246592	1359041502	/nfs/dbraw/zinc/04/15/02/1359041502.db2.gz	IIGFNPRWMSVBDE-XFHMXUHZSA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc3ncsc3c2)C1	ZINC001086267007	1359048599	/nfs/dbraw/zinc/04/85/99/1359048599.db2.gz	HTVVYDXZMKVCMU-BJHJDKERSA-N	0	3	335.860	3.147	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)[C@H]2CCCC[C@@H]2C)C1	ZINC001086462964	1359106725	/nfs/dbraw/zinc/10/67/25/1359106725.db2.gz	WECFHFYUOAPDIL-MXAVVETBSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2sccc2-n2cccc2)C1	ZINC001086443464	1359098335	/nfs/dbraw/zinc/09/83/35/1359098335.db2.gz	YCUREOAZMQWJCS-HDJSIYSDSA-N	0	3	349.887	3.389	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2C[C@H](NCc3ccncc3Cl)C2)CC1	ZINC001086466680	1359108039	/nfs/dbraw/zinc/10/80/39/1359108039.db2.gz	OTZLHONIBKBMCK-CZIWCDLHSA-N	0	3	347.890	3.466	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)C1	ZINC001086501667	1359121563	/nfs/dbraw/zinc/12/15/63/1359121563.db2.gz	MZRJTGOUZRUBRH-QXRTWZOPSA-N	0	3	348.874	3.036	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc(F)c3ncccc3c2)C1	ZINC001086506900	1359123174	/nfs/dbraw/zinc/12/31/74/1359123174.db2.gz	VZPHMPFAEJFIJW-NNUKFRKNSA-N	0	3	347.821	3.224	20	30		EGEDHN
CC[C@]1(C)C[C@@H]1C(=O)NC[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001086521141	1359129000	/nfs/dbraw/zinc/12/90/00/1359129000.db2.gz	POTZGHVHJQJRBF-WVSUBDOOSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2c(F)cccc2Cl)C1	ZINC001086539450	1359137153	/nfs/dbraw/zinc/13/71/53/1359137153.db2.gz	HSEHCEOGCDWSFW-XYPYZODXSA-N	0	3	331.218	3.330	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2sc(C(C)C)nc2C)C1	ZINC001086550358	1359141833	/nfs/dbraw/zinc/14/18/33/1359141833.db2.gz	FKYTUYOIHVEGCP-JOCQHMNTSA-N	0	3	341.908	3.425	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cccc3cnccc32)C1	ZINC001086553093	1359142871	/nfs/dbraw/zinc/14/28/71/1359142871.db2.gz	WEEORFZKYVCKPE-CTYIDZIISA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(N(C)C(C)C)cc2)C1	ZINC001086564552	1359149037	/nfs/dbraw/zinc/14/90/37/1359149037.db2.gz	RCTVSVQSVZUXIO-JCNLHEQBSA-N	0	3	349.906	3.382	20	30		EGEDHN
C=C(C)CN1C[C@@H](c2ccccc2)[C@H](NC(=O)C[C@H]2CCCCO2)C1	ZINC001086582537	1359155307	/nfs/dbraw/zinc/15/53/07/1359155307.db2.gz	WFIMIHMFDWUWSG-HSALFYBXSA-N	0	3	342.483	3.106	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2c[nH]cc2C2CC2)C1	ZINC001086617370	1359165527	/nfs/dbraw/zinc/16/55/27/1359165527.db2.gz	ABQFCKSWICIIFO-LEWJYISDSA-N	0	3	347.462	3.113	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2c(C)onc2C2CC2)C1	ZINC001086760198	1359195982	/nfs/dbraw/zinc/19/59/82/1359195982.db2.gz	STZBJMVIYGUZBZ-GXTWGEPZSA-N	0	3	337.851	3.101	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cc3ncccc3o2)C1	ZINC001086761234	1359196389	/nfs/dbraw/zinc/19/63/89/1359196389.db2.gz	VNDSMXVINFPQQG-QWHCGFSZSA-N	0	3	333.819	3.068	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccc(OC)cc2C)C1	ZINC001086792214	1359202325	/nfs/dbraw/zinc/20/23/25/1359202325.db2.gz	HBCQVNHEVMSCAT-LSDHHAIUSA-N	0	3	336.863	3.244	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CC[C@@H](NCc3conc3C)C2)CC1	ZINC001086794895	1359203239	/nfs/dbraw/zinc/20/32/39/1359203239.db2.gz	QCKJAKZBQUWKLM-MAUKXSAKSA-N	0	3	331.460	3.104	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cncc3ccccc32)C1	ZINC001086881444	1359219721	/nfs/dbraw/zinc/21/97/21/1359219721.db2.gz	VRDKWCYWDLIIPU-GOEBONIOSA-N	0	3	343.858	3.475	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)/C=C\c3ccco3)C2)CC1	ZINC001086898135	1359227534	/nfs/dbraw/zinc/22/75/34/1359227534.db2.gz	BEKUIVOBWBNCJM-QWPQOLDESA-N	0	3	326.440	3.019	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3[nH]ccc3C3CC3)C2)CC1	ZINC001086925649	1359250859	/nfs/dbraw/zinc/25/08/59/1359250859.db2.gz	CNMOWFYVKJXJBA-MRXNPFEDSA-N	0	3	339.483	3.232	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)CCc3ccsc3)C2)CC1	ZINC001086927008	1359252130	/nfs/dbraw/zinc/25/21/30/1359252130.db2.gz	PUCGQVWDWRNOIQ-INIZCTEOSA-N	0	3	330.497	3.017	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)Cc3ccccc3CC)C2)CC1	ZINC001086928321	1359253337	/nfs/dbraw/zinc/25/33/37/1359253337.db2.gz	BEBUNGYPDOVRML-GOSISDBHSA-N	0	3	338.495	3.128	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H]3C[C@H]3c3ccsc3)C2)CC1	ZINC001086929456	1359254161	/nfs/dbraw/zinc/25/41/61/1359254161.db2.gz	IPWXQUUJNGQYAM-BPQIPLTHSA-N	0	3	342.508	3.188	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)CCc3ccc(F)cc3)C2)CC1	ZINC001086931277	1359255353	/nfs/dbraw/zinc/25/53/53/1359255353.db2.gz	DJCRFJKCZGQWDT-KRWDZBQOSA-N	0	3	342.458	3.095	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc(C)n(CC)c3C)C2)CC1	ZINC001086931666	1359255784	/nfs/dbraw/zinc/25/57/84/1359255784.db2.gz	OFOIITAJHZXKGL-QGZVFWFLSA-N	0	3	341.499	3.075	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)C[C@H]3CC=CCC3)C2)CC1	ZINC001086937529	1359260073	/nfs/dbraw/zinc/26/00/73/1359260073.db2.gz	RKBKPXIFBHFLBB-MOPGFXCFSA-N	0	3	328.500	3.459	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H](C)c3cccs3)C2)CC1	ZINC001086941962	1359263497	/nfs/dbraw/zinc/26/34/97/1359263497.db2.gz	FKHHSSHFMWFXIT-CVEARBPZSA-N	0	3	330.497	3.188	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3ccncc3Cl)C2)CC1	ZINC001086945261	1359266657	/nfs/dbraw/zinc/26/66/57/1359266657.db2.gz	XDIBYVIYTMJBRM-HNNXBMFYSA-N	0	3	345.874	3.075	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H](C)Cc3cccs3)C2)CC1	ZINC001086945645	1359266824	/nfs/dbraw/zinc/26/68/24/1359266824.db2.gz	GFHYOKHXWNQWBU-DLBZAZTESA-N	0	3	344.524	3.263	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@H](C)c3ccc(C)cc3)C2)CC1	ZINC001086952708	1359272690	/nfs/dbraw/zinc/27/26/90/1359272690.db2.gz	OBZZRJVOWDNPGW-RTBURBONSA-N	0	3	338.495	3.435	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cnc(C(C)C)s3)C2)CC1	ZINC001086960805	1359280444	/nfs/dbraw/zinc/28/04/44/1359280444.db2.gz	GYWDDGZCUZMLIF-HNNXBMFYSA-N	0	3	345.512	3.216	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](CNCc2csc(CC)n2)[C@@H](C)C1	ZINC001184079115	1387389674	/nfs/dbraw/zinc/38/96/74/1387389674.db2.gz	TYZQIVHIIJLPBT-GJZGRUSLSA-N	0	3	335.517	3.246	20	30		EGEDHN
C[C@@H]1CCN(C(=O)[C@H]2CC23CC3)[C@H](CNCc2ccc(C#N)s2)C1	ZINC001087218808	1359324084	/nfs/dbraw/zinc/32/40/84/1359324084.db2.gz	VJGMGYRETOWDCM-JKIFEVAISA-N	0	3	343.496	3.137	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc(C(C)C)nc3)C(C)(C)[C@H]21	ZINC001087290493	1359369631	/nfs/dbraw/zinc/36/96/31/1359369631.db2.gz	CVRUVHYTPKXXAZ-NEWSRXKRSA-N	0	3	339.483	3.057	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(C)sc3C)C(C)(C)[C@H]21	ZINC001087293894	1359374265	/nfs/dbraw/zinc/37/42/65/1359374265.db2.gz	LMKKTYHPGJIUGS-OIISXLGYSA-N	0	3	330.497	3.217	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3coc(C(F)F)c3)C(C)(C)[C@H]21	ZINC001087300417	1359383362	/nfs/dbraw/zinc/38/33/62/1359383362.db2.gz	KJVJJAGNIJVFQK-YUELXQCFSA-N	0	3	336.382	3.069	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)Cc3cc(C)cc(C)c3)C(C)(C)[C@@H]21	ZINC001087303654	1359386786	/nfs/dbraw/zinc/38/67/86/1359386786.db2.gz	PVGAKKNMDGDIFN-HMXCVIKNSA-N	0	3	338.495	3.084	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(C)c(F)c3F)C(C)(C)[C@@H]21	ZINC001087304299	1359387695	/nfs/dbraw/zinc/38/76/95/1359387695.db2.gz	AHNGYMHTJUEEQL-ZTFGCOKTSA-N	0	3	346.421	3.125	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc4cccnc4c3)C(C)(C)[C@@H]21	ZINC001087307926	1359394488	/nfs/dbraw/zinc/39/44/88/1359394488.db2.gz	JIGAKOXJTNWZFJ-MISYRCLQSA-N	0	3	347.462	3.087	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(C)c(CC)o3)C(C)(C)[C@@H]21	ZINC001087312341	1359400430	/nfs/dbraw/zinc/40/04/30/1359400430.db2.gz	CTZLLLVOPQDOKX-ZTFGCOKTSA-N	0	3	328.456	3.002	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc(Cl)cc3)C(C)(C)[C@H]21	ZINC001087313851	1359402878	/nfs/dbraw/zinc/40/28/78/1359402878.db2.gz	BAGWJUFPBJHEQD-IKGGRYGDSA-N	0	3	330.859	3.192	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccccc1Cl	ZINC001087314423	1359403665	/nfs/dbraw/zinc/40/36/65/1359403665.db2.gz	KVVJVCQGSKHNDF-HYVNUMGLSA-N	0	3	330.859	3.192	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(CC)c(C)s3)C(C)(C)[C@@H]21	ZINC001087316902	1359408249	/nfs/dbraw/zinc/40/82/49/1359408249.db2.gz	ZBUPXZBDIYEQCO-KBAYOESNSA-N	0	3	344.524	3.471	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc2ccccc2[nH]1	ZINC001087317967	1359410057	/nfs/dbraw/zinc/41/00/57/1359410057.db2.gz	PFXZOQRXYYTMRX-LSTHTHJFSA-N	0	3	349.478	3.410	20	30		EGEDHN
O=C(C1CCC1)N1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1CC#Cc1ccccc1	ZINC001087325891	1359416526	/nfs/dbraw/zinc/41/65/26/1359416526.db2.gz	JRMATFBBIJCTKF-KJJMTIBFSA-N	0	3	348.490	3.007	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CN(CCC)CC[C@@H]2c2ccccc2)nc1	ZINC001087441871	1359466438	/nfs/dbraw/zinc/46/64/38/1359466438.db2.gz	CRGDOPIXWOHTMU-TZIWHRDSSA-N	0	3	347.462	3.061	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(N(C)C)cc2)[C@H]1CC	ZINC001087666438	1359580127	/nfs/dbraw/zinc/58/01/27/1359580127.db2.gz	SQQDQAUBSIXWBK-ZGXWSNOMSA-N	0	3	341.499	3.011	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cc(F)c(F)cc2F)[C@H]1CC	ZINC001087706290	1359601166	/nfs/dbraw/zinc/60/11/66/1359601166.db2.gz	KGPMGBGVGYFGHD-JKSUJKDBSA-N	0	3	326.362	3.263	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2c(F)ccc(F)c2Cl)[C@H]1CC	ZINC001087737389	1359618353	/nfs/dbraw/zinc/61/83/53/1359618353.db2.gz	TZGJXOJTWWDUEL-UONOGXRCSA-N	0	3	340.801	3.224	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2c[nH]c3c2cccc3C)[C@H]1CC	ZINC001087749189	1359626665	/nfs/dbraw/zinc/62/66/65/1359626665.db2.gz	XXRYYXVUHIXOAO-RBUKOAKNSA-N	0	3	337.467	3.011	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)Cc2ccccc2OC(C)C)[C@H]1CC	ZINC001087761423	1359632420	/nfs/dbraw/zinc/63/24/20/1359632420.db2.gz	RUKGDLCVWMPTED-ZWKOTPCHSA-N	0	3	330.472	3.171	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)n(C(C)C)c2C)[C@H]1CC	ZINC001087823520	1359665150	/nfs/dbraw/zinc/66/51/50/1359665150.db2.gz	BECHHPLYBAIMRE-RBUKOAKNSA-N	0	3	329.488	3.292	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2c[nH]cc2-c2ccccc2)[C@H]1CC	ZINC001087829069	1359667174	/nfs/dbraw/zinc/66/71/74/1359667174.db2.gz	HWPCLEYDHCROPR-VQTJNVASSA-N	0	3	335.451	3.288	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc(OCC3CC3)cc2)[C@H]1CC	ZINC001087834237	1359670937	/nfs/dbraw/zinc/67/09/37/1359670937.db2.gz	SOEFVCBNLSSDNX-RBUKOAKNSA-N	0	3	328.456	3.244	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CN(C(=O)C4CCCC4)C[C@@H]3C2)cc1	ZINC001087862539	1359685637	/nfs/dbraw/zinc/68/56/37/1359685637.db2.gz	RGRPXGVHJFYMFW-UXHICEINSA-N	0	3	337.467	3.029	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CN(C(=O)C[C@H]4C=CCC4)C[C@@H]3C2)cc1	ZINC001087880154	1359694253	/nfs/dbraw/zinc/69/42/53/1359694253.db2.gz	VLSAHBGRFHZNCP-WMQCIHAUSA-N	0	3	349.478	3.195	20	30		EGEDHN
CC1(CC(=O)N2C[C@H]3CCN(Cc4ccc(C#N)cc4)C[C@H]3C2)CC1	ZINC001088045566	1359734105	/nfs/dbraw/zinc/73/41/05/1359734105.db2.gz	ZZSYHGZLIJBZQC-MOPGFXCFSA-N	0	3	337.467	3.029	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3ccc(C(C)(C)C)cc3)C[C@@H]2C1	ZINC001088179541	1359783055	/nfs/dbraw/zinc/78/30/55/1359783055.db2.gz	NQLQBOHZZLPUNB-MOPGFXCFSA-N	0	3	338.495	3.401	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3cccc(Cl)c3Cl)C[C@@H]2C1	ZINC001088180837	1359784235	/nfs/dbraw/zinc/78/42/35/1359784235.db2.gz	DRCLCTCGNHHELH-OLZOCXBDSA-N	0	3	337.250	3.021	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](CNCc2nc(C)cs2)[C@H](C)C1	ZINC001184209718	1387415425	/nfs/dbraw/zinc/41/54/25/1387415425.db2.gz	PWOCAWKLNXCFTI-NVXWUHKLSA-N	0	3	347.528	3.219	20	30		EGEDHN
C=CCN1CC[C@@H](OCC2CCN(C(=O)c3ccc(C)s3)CC2)C1	ZINC001088228715	1359808355	/nfs/dbraw/zinc/80/83/55/1359808355.db2.gz	YMKQUNSJVNBHES-QGZVFWFLSA-N	0	3	348.512	3.186	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2cccc3c2OCC3)C1	ZINC001088388537	1359866703	/nfs/dbraw/zinc/86/67/03/1359866703.db2.gz	YGFVAWAAXMEZQV-INIZCTEOSA-N	0	3	348.874	3.348	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)C2(C(F)(F)F)CC2)C1	ZINC001088388433	1359866877	/nfs/dbraw/zinc/86/68/77/1359866877.db2.gz	VJESEJGHOCQXHK-GFCCVEGCSA-N	0	3	338.801	3.442	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)C2(C(F)(F)F)CC2)C1	ZINC001088388434	1359866950	/nfs/dbraw/zinc/86/69/50/1359866950.db2.gz	VJESEJGHOCQXHK-LBPRGKRZSA-N	0	3	338.801	3.442	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)C2(CC)CCOCC2)C1	ZINC001088406561	1359878437	/nfs/dbraw/zinc/87/84/37/1359878437.db2.gz	YZVKIXDQRSHPPL-INIZCTEOSA-N	0	3	342.911	3.307	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2cccc(OC)c2)C1	ZINC001088418470	1359888812	/nfs/dbraw/zinc/88/88/12/1359888812.db2.gz	PSUOTOVIZZMGOS-MRXNPFEDSA-N	0	3	336.863	3.422	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)Cc2ccc(F)cc2)C1	ZINC001088420071	1359889645	/nfs/dbraw/zinc/88/96/45/1359889645.db2.gz	HGVVQZCITNLZKC-KRWDZBQOSA-N	0	3	338.854	3.482	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N2CCCCC[C@H](NCCF)C2)cc1	ZINC001088432334	1359900978	/nfs/dbraw/zinc/90/09/78/1359900978.db2.gz	RRKLAQPCXLRGJH-SFHVURJKSA-N	0	3	348.462	3.124	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCN(C[C@@H](O)c3ccccc3)[C@@H]2C)CC1	ZINC001088838283	1360072331	/nfs/dbraw/zinc/07/23/31/1360072331.db2.gz	ATVMVNPHFMOYRG-LSTHTHJFSA-N	0	3	342.483	3.045	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccc(N(C)C(C)C)cc2)[C@H]1C	ZINC001089073741	1360160658	/nfs/dbraw/zinc/16/06/58/1360160658.db2.gz	XUNBMHXIAMQTHY-APWZRJJASA-N	0	3	329.488	3.300	20	30		EGEDHN
CC1(C)C[C@@H](NC(=O)c2cc[nH]c2)CCN(CC#Cc2ccccc2)C1	ZINC001089391827	1360392123	/nfs/dbraw/zinc/39/21/23/1360392123.db2.gz	PQEMAUHXNBPAFB-FQEVSTJZSA-N	0	3	349.478	3.287	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3c(o2)CCCC3)CC(C)(C)C1	ZINC001089407451	1360406051	/nfs/dbraw/zinc/40/60/51/1360406051.db2.gz	ZNGHYTWUJIIIPQ-KRWDZBQOSA-N	0	3	342.483	3.402	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccc(C(C)C)n2)CC(C)(C)C1	ZINC001089429690	1360421957	/nfs/dbraw/zinc/42/19/57/1360421957.db2.gz	DMIGIUUIJJHGEQ-QGZVFWFLSA-N	0	3	341.499	3.449	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cccc(-n3cccc3)c2)CC(C)(C)C1	ZINC001089432786	1360424525	/nfs/dbraw/zinc/42/45/25/1360424525.db2.gz	DMBBCINUCRKDTQ-IBGZPJMESA-N	0	3	349.478	3.331	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@H]2CCCCC2(F)F)CC(C)(C)C1	ZINC001089448346	1360437026	/nfs/dbraw/zinc/43/70/26/1360437026.db2.gz	CHPCPWIRATYGMH-HUUCEWRRSA-N	0	3	326.431	3.052	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2cccc3cccnc32)CC(C)(C)C1	ZINC001089452554	1360439897	/nfs/dbraw/zinc/43/98/97/1360439897.db2.gz	DBZRQHPTEYMVMB-IBGZPJMESA-N	0	3	349.478	3.017	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc3ccccc3n2C)CC(C)(C)C1	ZINC001089476929	1360459809	/nfs/dbraw/zinc/45/98/09/1360459809.db2.gz	SXPSHKOGNXLCKQ-KRWDZBQOSA-N	0	3	337.467	3.032	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2c(C)cc(C)cc2C)CC(C)(C)C1	ZINC001089482988	1360464257	/nfs/dbraw/zinc/46/42/57/1360464257.db2.gz	DPIQULJRBGUOIC-IBGZPJMESA-N	0	3	340.511	3.394	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ncsc2C2CC2)CC(C)(C)C1	ZINC001089490504	1360469249	/nfs/dbraw/zinc/46/92/49/1360469249.db2.gz	BPAOZXYOBARWQE-OAHLLOKOSA-N	0	3	345.512	3.264	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C23CCC(CC2)C3(C)C)CC(C)(C)C1	ZINC001089511662	1360483145	/nfs/dbraw/zinc/48/31/45/1360483145.db2.gz	UWJJEOQATXEUKE-BQIYRTECSA-N	0	3	330.516	3.443	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@@H](C)c2cc(C)oc2C)CC(C)(C)C1	ZINC001089519935	1360488220	/nfs/dbraw/zinc/48/82/20/1360488220.db2.gz	PODDWKYXRKRFBD-RDJZCZTQSA-N	0	3	330.472	3.240	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(OC)cc2Cl)CC(C)(C)C1	ZINC001089520857	1360488661	/nfs/dbraw/zinc/48/86/61/1360488661.db2.gz	AQEXYURMSXWKDK-CQSZACIVSA-N	0	3	348.874	3.202	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2csc(Cl)n2)CC(C)(C)C1	ZINC001089534097	1360493611	/nfs/dbraw/zinc/49/36/11/1360493611.db2.gz	OMJKQGFVEOXKJF-LBPRGKRZSA-N	0	3	339.892	3.040	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc3cnccc3c2)CC(C)(C)C1	ZINC001089534108	1360493760	/nfs/dbraw/zinc/49/37/60/1360493760.db2.gz	OTWCGUINYWUKNO-IBGZPJMESA-N	0	3	335.451	3.088	20	30		EGEDHN
C=CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1snnc1C1CC1	ZINC001089653195	1360565780	/nfs/dbraw/zinc/56/57/80/1360565780.db2.gz	NRGHHYJVGIWHFV-AWEZNQCLSA-N	0	3	348.516	3.212	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ccn2cncc2c1	ZINC001089664542	1360574769	/nfs/dbraw/zinc/57/47/69/1360574769.db2.gz	MKZNLXVQWYWRPK-KRWDZBQOSA-N	0	3	340.471	3.131	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H]1Cc2ccccc2O1	ZINC001089668547	1360578781	/nfs/dbraw/zinc/57/87/81/1360578781.db2.gz	XUFYMYUSPSYETJ-IEBWSBKVSA-N	0	3	342.483	3.173	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ncc(C)cc1C	ZINC001089672955	1360582691	/nfs/dbraw/zinc/58/26/91/1360582691.db2.gz	VNMAHZRTXUXXTD-KRWDZBQOSA-N	0	3	329.488	3.495	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H]1CCCc2cccnc21	ZINC001089684927	1360590464	/nfs/dbraw/zinc/59/04/64/1360590464.db2.gz	VUTPPSWXTUEFKZ-MSOLQXFVSA-N	0	3	341.499	3.294	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccoc1C1CC1	ZINC001089688173	1360594234	/nfs/dbraw/zinc/59/42/34/1360594234.db2.gz	RCJOAXQNTSCFOF-INIZCTEOSA-N	0	3	328.456	3.401	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(C(F)F)n[nH]1	ZINC001089692713	1360598594	/nfs/dbraw/zinc/59/85/94/1360598594.db2.gz	AXZDTBGCLKSZDZ-GFCCVEGCSA-N	0	3	340.418	3.144	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc2cccnc2c1	ZINC001089711241	1360614779	/nfs/dbraw/zinc/61/47/79/1360614779.db2.gz	PPUIUGHQPKZWCQ-LJQANCHMSA-N	0	3	349.478	3.479	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(C(C)C)nn1C	ZINC001089718679	1360620534	/nfs/dbraw/zinc/62/05/34/1360620534.db2.gz	STOOAWWFCRUVPW-INIZCTEOSA-N	0	3	346.519	3.340	20	30		EGEDHN
N#Cc1ccccc1CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1CCC1	ZINC001089751521	1360649252	/nfs/dbraw/zinc/64/92/52/1360649252.db2.gz	UJKSDJHEDDJYQD-BQJUDKOJSA-N	0	3	349.478	3.027	20	30		EGEDHN
N#Cc1ccccc1CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)CC2CC2)C1	ZINC001089758804	1360652079	/nfs/dbraw/zinc/65/20/79/1360652079.db2.gz	SZZHDCYVSBAWKS-TUFLPTIASA-N	0	3	349.478	3.027	20	30		EGEDHN
N#Cc1ccccc1CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)CC1CC1	ZINC001089758803	1360652176	/nfs/dbraw/zinc/65/21/76/1360652176.db2.gz	SZZHDCYVSBAWKS-BURNTYAHSA-N	0	3	349.478	3.027	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](CNCc2nccn2CC)[C@@H](C)C1	ZINC001184487590	1387470441	/nfs/dbraw/zinc/47/04/41/1387470441.db2.gz	RLKMRCZTKIIRCU-IRXDYDNUSA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CC2=CCCCC2)CC2(CCOCC2)C1	ZINC001089930804	1360749884	/nfs/dbraw/zinc/74/98/84/1360749884.db2.gz	MHQIYFFXVCHZNT-LJQANCHMSA-N	0	3	346.515	3.440	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](CNCc2nc(C)cs2)[C@H](C)C1	ZINC001184499445	1387474892	/nfs/dbraw/zinc/47/48/92/1387474892.db2.gz	ZSYUAFRHFRJXLY-GDBMZVCRSA-N	0	3	335.517	3.382	20	30		EGEDHN
CCN(CC)CC(=O)N[C@@H](C)CCCCNc1cccc(F)c1C#N	ZINC001090093667	1360821644	/nfs/dbraw/zinc/82/16/44/1360821644.db2.gz	OJOMBUFGXWKBJW-HNNXBMFYSA-N	0	3	348.466	3.126	20	30		EGEDHN
CC(C)N(C)CC(=O)N[C@H](C)CCCCNc1cccc(F)c1C#N	ZINC001090095818	1360823662	/nfs/dbraw/zinc/82/36/62/1360823662.db2.gz	YDNLKXIAGUJBHP-OAHLLOKOSA-N	0	3	348.466	3.124	20	30		EGEDHN
CC[C@@H](C(=O)N[C@H](C)CCCCNc1cccc(F)c1C#N)N(C)C	ZINC001090103449	1360826500	/nfs/dbraw/zinc/82/65/00/1360826500.db2.gz	OTMOSRZANJUDKP-KDOFPFPSSA-N	0	3	348.466	3.124	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(F)c3ccncc23)C1	ZINC001091198606	1361004788	/nfs/dbraw/zinc/00/47/88/1361004788.db2.gz	LRWJQZFMJYWNBS-UHFFFAOYSA-N	0	3	347.821	3.224	20	30		EGEDHN
C=C1CCC(C(=O)NCC2CC(NCc3ncccc3C)C2)CC1	ZINC001091212915	1361008993	/nfs/dbraw/zinc/00/89/93/1361008993.db2.gz	FOGRRSMKEVMUBC-UHFFFAOYSA-N	0	3	327.472	3.121	20	30		EGEDHN
C=C1CCC(C(=O)NCC2CC(N[C@H](C)c3cnc(C)cn3)C2)CC1	ZINC001091215966	1361010334	/nfs/dbraw/zinc/01/03/34/1361010334.db2.gz	PQSVPNFGYXKLLH-KLHKWILBSA-N	0	3	342.487	3.077	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(OC)cc2Cl)C1	ZINC001091285647	1361031400	/nfs/dbraw/zinc/03/14/00/1361031400.db2.gz	TZJYBEACESCGBO-UHFFFAOYSA-N	0	3	343.254	3.199	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ncc(Cl)cc2Cl)C1	ZINC001091299547	1361036050	/nfs/dbraw/zinc/03/60/50/1361036050.db2.gz	ZPJPXDXOTVCTAB-UHFFFAOYSA-N	0	3	348.661	3.239	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc3c(s2)CCCC3)C1	ZINC001091355198	1361058236	/nfs/dbraw/zinc/05/82/36/1361058236.db2.gz	RBBBHNSSQYBLEU-UHFFFAOYSA-N	0	3	338.904	3.477	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cccc4c(C)c(C)[nH]c43)C[C@]2(C)C1	ZINC001091792617	1361221449	/nfs/dbraw/zinc/22/14/49/1361221449.db2.gz	HQGGFCLPPLZTAO-VGSWGCGISA-N	0	3	349.478	3.202	20	30		EGEDHN
C[C@@]1(C(=O)N2C[C@H]3CN(Cc4cccc(C#N)c4)C[C@@]3(C)C2)C=CCC1	ZINC001091929249	1361252351	/nfs/dbraw/zinc/25/23/51/1361252351.db2.gz	FLSPOIWQBCLTQD-FCEUIQTBSA-N	0	3	349.478	3.195	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3ccc(C(C)C)c(Cl)c3)C[C@]2(C)C1	ZINC001092315013	1361363081	/nfs/dbraw/zinc/36/30/81/1361363081.db2.gz	MHADUQBDSTVNBH-UZLBHIALSA-N	0	3	344.886	3.491	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)c2ccoc2Cl)CC1	ZINC001093367296	1361576595	/nfs/dbraw/zinc/57/65/95/1361576595.db2.gz	MSBUGEIZSDEVFB-MRXNPFEDSA-N	0	3	346.858	3.273	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C2(C)CC=CC2)CC1	ZINC001093376266	1361586084	/nfs/dbraw/zinc/58/60/84/1361586084.db2.gz	ICNHOBZYAISONW-GOSISDBHSA-N	0	3	326.484	3.069	20	30		EGEDHN
O=C(NC[C@]12CCC[C@H]1N(CC#Cc1ccccc1)CC2)C1CC=CC1	ZINC001094382518	1361780673	/nfs/dbraw/zinc/78/06/73/1361780673.db2.gz	LWKYEVLVYRRZHK-FYYLOGMGSA-N	0	3	348.490	3.365	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3coc4c3cccc4C)CCC[C@@H]12	ZINC001094433759	1361800014	/nfs/dbraw/zinc/80/00/14/1361800014.db2.gz	BBVCAIKSIVZGKN-WIYYLYMNSA-N	0	3	336.435	3.349	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)NC[C@]12CCC[C@H]1N(CC#Cc1ccccc1)CC2	ZINC001094491002	1361828244	/nfs/dbraw/zinc/82/82/44/1361828244.db2.gz	NXRCYHLOIBZPMS-LLMJNHHCSA-N	0	3	336.479	3.055	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3ccc(C(F)F)cc3)CCC[C@@H]12	ZINC001094535782	1361849028	/nfs/dbraw/zinc/84/90/28/1361849028.db2.gz	OGAKMTZUJOKJHW-VQIMIIECSA-N	0	3	332.394	3.232	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1c(F)ccc3ccncc31)C2	ZINC001095446915	1362144019	/nfs/dbraw/zinc/14/40/19/1362144019.db2.gz	OAYKXCMVBRFPMO-JLSDUUJJSA-N	0	3	339.414	3.285	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc3nccc(C)c3c1)C2	ZINC001095463951	1362150378	/nfs/dbraw/zinc/15/03/78/1362150378.db2.gz	XIJKDORQBJDZNA-UXPWSPDFSA-N	0	3	335.451	3.454	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc(F)c3ccccc3c1)C2	ZINC001095505252	1362158614	/nfs/dbraw/zinc/15/86/14/1362158614.db2.gz	DHZPAHRKWIHZID-UXPWSPDFSA-N	0	3	336.410	3.337	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H]1CCc3ccc(OC)cc31)C2	ZINC001095545669	1362165464	/nfs/dbraw/zinc/16/54/64/1362165464.db2.gz	OGRQDVVMBZVRMK-LQJIQPLVSA-N	0	3	340.467	3.023	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C1CCc3ccccc3CC1)C2	ZINC001095660174	1362198278	/nfs/dbraw/zinc/19/82/78/1362198278.db2.gz	BWBAWCDFYLWLIF-HKBOAZHASA-N	0	3	338.495	3.479	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1scnc1C(F)F)C2	ZINC001095744706	1362219213	/nfs/dbraw/zinc/21/92/13/1362219213.db2.gz	XYUDJCVFXRQQMA-WOPDTQHZSA-N	0	3	341.427	3.382	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3C[C@@H]2CCCCO2)CC1	ZINC001095968203	1362314589	/nfs/dbraw/zinc/31/45/89/1362314589.db2.gz	NFHZKDYJQOQIAR-XWSJACJDSA-N	0	3	332.488	3.023	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1ccc(C(C)(C)C)cc1)C2	ZINC001096075387	1362370369	/nfs/dbraw/zinc/37/03/69/1362370369.db2.gz	ZZAHGSOIEGCRAG-AABGKKOBSA-N	0	3	338.495	3.271	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1F)C2	ZINC001096133482	1362399621	/nfs/dbraw/zinc/39/96/21/1362399621.db2.gz	HTZYHXJTSOCFCW-AYTJEOJGSA-N	0	3	328.431	3.227	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CC=C(C)C	ZINC001096138408	1362402744	/nfs/dbraw/zinc/40/27/44/1362402744.db2.gz	QYCSDLDXWDARDC-BCYZHJNNSA-N	0	3	332.488	3.045	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C(C)(C)c1ccc(CC)cc1)C2	ZINC001096302734	1362457601	/nfs/dbraw/zinc/45/76/01/1362457601.db2.gz	NJYDKNXVJBEFNX-AABGKKOBSA-N	0	3	338.495	3.271	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1c(C)noc1C(F)F)C2	ZINC001097309528	1362923549	/nfs/dbraw/zinc/92/35/49/1362923549.db2.gz	XBAALWXRFHENSY-UPJWGTAASA-N	0	3	339.386	3.222	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](CNCc2ccccc2C#N)[C@@H](C)C1	ZINC001185061771	1387604185	/nfs/dbraw/zinc/60/41/85/1387604185.db2.gz	PMKVGAJYCIQIBG-HKUYNNGSSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@@H](NCc2ccc(OC)c(F)c2)C1	ZINC001185063678	1387606300	/nfs/dbraw/zinc/60/63/00/1387606300.db2.gz	GFDRBLKHOYWRJT-GDBMZVCRSA-N	0	3	334.435	3.127	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cnn(C(C)C)c1Cl)C2	ZINC001097586834	1363061069	/nfs/dbraw/zinc/06/10/69/1363061069.db2.gz	FIZAXUZUZKPCRO-YUELXQCFSA-N	0	3	336.867	3.029	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccccc1OCC(C)C)C2	ZINC001098059903	1363211134	/nfs/dbraw/zinc/21/11/34/1363211134.db2.gz	IQMKMGNYEYTRPV-QRQLOZEOSA-N	0	3	340.467	3.080	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccnc(C3CCCC3)n1)C2	ZINC001098131407	1363230305	/nfs/dbraw/zinc/23/03/05/1363230305.db2.gz	AMMMZBRFEYXUBZ-NXHRZFHOSA-N	0	3	340.471	3.045	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccccc1C(F)(F)F)C2	ZINC001098266533	1363279439	/nfs/dbraw/zinc/27/94/39/1363279439.db2.gz	AHBLTIFUFZNEQT-WQVCFCJDSA-N	0	3	336.357	3.064	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc(C)n(C(C)C)c1C)C2	ZINC001098356275	1363306619	/nfs/dbraw/zinc/30/66/19/1363306619.db2.gz	RVWSMVGVXLRAGB-QRQLOZEOSA-N	0	3	327.472	3.044	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@]1(C)CC=CCC1)C[C@@H](C)O2	ZINC001098599740	1363393591	/nfs/dbraw/zinc/39/35/91/1363393591.db2.gz	KLOQKUAACMGKFB-MJGOQNOKSA-N	0	3	332.488	3.001	20	30		EGEDHN
CCCCCCCNCc1cn([C@@H]2CCN(C(=O)C=C(C)C)C2)nn1	ZINC001098607878	1363397067	/nfs/dbraw/zinc/39/70/67/1363397067.db2.gz	IBGCVWOXYZNBGL-GOSISDBHSA-N	0	3	347.507	3.078	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H]1CC3CCC1CC3)C[C@@H](C)O2	ZINC001098663184	1363425186	/nfs/dbraw/zinc/42/51/86/1363425186.db2.gz	YKIMFBJBHIOROT-LWSMDNFKSA-N	0	3	346.515	3.081	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3CCC[C@]3(NC(=O)[C@@H]3CC=CCC3)C2)cc1	ZINC001098725738	1363450841	/nfs/dbraw/zinc/45/08/41/1363450841.db2.gz	MRKUUROQOOCGNE-URVUXULASA-N	0	3	349.478	3.385	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(Cl)c(Cl)n2C)C1	ZINC001098863199	1363496392	/nfs/dbraw/zinc/49/63/92/1363496392.db2.gz	YCVALJBFQFNPEA-ZBEGNZNMSA-N	0	3	342.270	3.102	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CCC[C@]3(NC(=O)[C@@H]3C[C@H]3C3CC3)C2)c1	ZINC001099072797	1363607823	/nfs/dbraw/zinc/60/78/23/1363607823.db2.gz	FENJRKUCGKONFD-KEZQHZCBSA-N	0	3	349.478	3.075	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc3nc(C)sc3c2)C1	ZINC001099105485	1363624296	/nfs/dbraw/zinc/62/42/96/1363624296.db2.gz	JJRHPMWJJNDDCU-KXBFYZLASA-N	0	3	341.480	3.375	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(CC)o1	ZINC001099125555	1363637943	/nfs/dbraw/zinc/63/79/43/1363637943.db2.gz	IGQQINMBXKFIBB-MRXNPFEDSA-N	0	3	348.487	3.265	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)C1	ZINC001099178508	1363675294	/nfs/dbraw/zinc/67/52/94/1363675294.db2.gz	FYMYRTPMKXJAKO-BOLBYERCSA-N	0	3	328.431	3.086	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)C23CC(C(C)(C)C)(C2)C3)C1	ZINC001099180979	1363676370	/nfs/dbraw/zinc/67/63/70/1363676370.db2.gz	IBFOTMNIQNXSKA-AOUGCYQESA-N	0	3	328.500	3.197	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H]1CCC(C)(C)CN1CCOCC1CC1	ZINC001099203752	1363690897	/nfs/dbraw/zinc/69/08/97/1363690897.db2.gz	RHJIUGGYOHJIFX-SFHVURJKSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCCC1(C(=O)NC[C@H]2CCC(C)(C)CN2CCOCC)CC1	ZINC001099214147	1363695066	/nfs/dbraw/zinc/69/50/66/1363695066.db2.gz	HGJDSDHASHYMJR-QGZVFWFLSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2ccc(C(F)F)cc2)C[C@H]1C(F)(F)F	ZINC001099321755	1363750433	/nfs/dbraw/zinc/75/04/33/1363750433.db2.gz	KSIBEIUVBSSINE-CHWSQXEVSA-N	0	3	348.315	3.403	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)COc1ccc(F)cc1	ZINC001099335234	1363757236	/nfs/dbraw/zinc/75/72/36/1363757236.db2.gz	SSXIQAVANFJAGI-KRWDZBQOSA-N	0	3	348.462	3.387	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2ccc(C)c(C)c2)C[C@H]1C(F)(F)F	ZINC001099338763	1363759032	/nfs/dbraw/zinc/75/90/32/1363759032.db2.gz	JZFUGBDXIPWFFR-HUUCEWRRSA-N	0	3	326.362	3.082	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)C2CC(C(C)(C)C)C2)C[C@H]1C(F)(F)F	ZINC001099348333	1363764978	/nfs/dbraw/zinc/76/49/78/1363764978.db2.gz	XTNPMBKWZLUYGO-NWINJMCUSA-N	0	3	332.410	3.224	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)C1(CCOC)CCCC1	ZINC001099358920	1363771734	/nfs/dbraw/zinc/77/17/34/1363771734.db2.gz	LAJCSXVXLBCAMX-SFHVURJKSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=CCCC[N@H+]1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)c2ccccc2[O-])C1	ZINC001099400639	1363787348	/nfs/dbraw/zinc/78/73/48/1363787348.db2.gz	FXAFPTMNMZVHOP-WNHJNPCNSA-N	0	3	340.467	3.141	20	30		EGEDHN
C=CCCC[N@@H+]1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)c2ccccc2[O-])C1	ZINC001099400639	1363787349	/nfs/dbraw/zinc/78/73/49/1363787349.db2.gz	FXAFPTMNMZVHOP-WNHJNPCNSA-N	0	3	340.467	3.141	20	30		EGEDHN
CC1(C(=O)N2C[C@@H]3CCC[C@]3(CNCc3ccccc3C#N)C2)CC1	ZINC001099440134	1363798790	/nfs/dbraw/zinc/79/87/90/1363798790.db2.gz	HYQUZOFENOAVTQ-RXVVDRJESA-N	0	3	337.467	3.077	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)[C@@H](C)CC(C)C)CC2(CCOCC2)C1	ZINC001099594730	1363877082	/nfs/dbraw/zinc/87/70/82/1363877082.db2.gz	JRMBVZAXWWSPDM-ZWKOTPCHSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CCN(CC3=CCCCC3)C[C@@H]2O)CCCC1	ZINC001100145527	1364025848	/nfs/dbraw/zinc/02/58/48/1364025848.db2.gz	MGYKCDRYCVPJEL-MOPGFXCFSA-N	0	3	346.515	3.175	20	30		EGEDHN
C=CCCC(=O)NCC1CC(NCc2cccc(OC)c2Cl)C1	ZINC001100176706	1364036451	/nfs/dbraw/zinc/03/64/51/1364036451.db2.gz	ARAAOBCIFMESBM-UHFFFAOYSA-N	0	3	336.863	3.299	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)CC(C)(C)C2CC2)C1	ZINC001100306047	1364074807	/nfs/dbraw/zinc/07/48/07/1364074807.db2.gz	FFRNMEMJUASEPO-UHFFFAOYSA-N	0	3	343.309	3.206	20	30		EGEDHN
CC(C)(C)C#CC(=O)NCC1CC(NCc2sccc2Cl)C1	ZINC001100317467	1364078912	/nfs/dbraw/zinc/07/89/12/1364078912.db2.gz	WLSPTJADUZPOOW-UHFFFAOYSA-N	0	3	338.904	3.435	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCC1CC(N[C@@H](C)c2cnc(C)cn2)C1	ZINC001100359969	1364091012	/nfs/dbraw/zinc/09/10/12/1364091012.db2.gz	SXBRYXDJOJWPJK-HJOIGYKYSA-N	0	3	342.487	3.099	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C2(c3ccccc3)CCC2)C1	ZINC001100490483	1364133256	/nfs/dbraw/zinc/13/32/56/1364133256.db2.gz	HMISLZDKNVKKLH-UHFFFAOYSA-N	0	3	332.875	3.345	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)Cc2cccc(C)c2Cl)C1	ZINC001100503848	1364138915	/nfs/dbraw/zinc/13/89/15/1364138915.db2.gz	YJFXBGKCHYIETM-UHFFFAOYSA-N	0	3	341.282	3.428	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC1CC(NCc2c(C)noc2CC)C1	ZINC001100568184	1364165899	/nfs/dbraw/zinc/16/58/99/1364165899.db2.gz	UQPOYTFOBSJECZ-UHFFFAOYSA-N	0	3	333.476	3.132	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC1CC(NCc2c(C)noc2CC)C1	ZINC001100644934	1364202118	/nfs/dbraw/zinc/20/21/18/1364202118.db2.gz	NKNCTHSTHINADJ-JFIBYHEFSA-N	0	3	333.476	3.132	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H](CC)c2c(C)noc2C)C1	ZINC001100757803	1364248190	/nfs/dbraw/zinc/24/81/90/1364248190.db2.gz	KPUBOZCIAHNXDR-NRXISQOPSA-N	0	3	339.867	3.022	20	30		EGEDHN
C#CC[C@H](CC(=O)NCC1CC(NCC(=C)Cl)C1)c1ccccc1	ZINC001101075401	1364401209	/nfs/dbraw/zinc/40/12/09/1364401209.db2.gz	FRHXEQJOZXAVFR-CUYAVPTFSA-N	0	3	344.886	3.421	20	30		EGEDHN
C=CCN1CC[C@H](Oc2ccnc(CNC(=O)C[C@H](C)CCC)c2)C1	ZINC001101090670	1364408404	/nfs/dbraw/zinc/40/84/04/1364408404.db2.gz	OQUOZEOFECYBQL-APWZRJJASA-N	0	3	345.487	3.163	20	30		EGEDHN
C=CCN1CC[C@@H](Oc2ccnc(CNC(=O)CCCC(C)C)c2)C1	ZINC001101096980	1364412378	/nfs/dbraw/zinc/41/23/78/1364412378.db2.gz	GRMISJUJENSFCZ-LJQANCHMSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](NCc2ccccc2OC2CC2)C1	ZINC001185303622	1387674885	/nfs/dbraw/zinc/67/48/85/1387674885.db2.gz	GGGJGKJYEATLRA-QGZVFWFLSA-N	0	3	328.456	3.275	20	30		EGEDHN
CCC(CC)C(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001101744320	1364711136	/nfs/dbraw/zinc/71/11/36/1364711136.db2.gz	KQBYILVGDLALMN-UKRRQHHQSA-N	0	3	333.501	3.240	20	30		EGEDHN
C[C@@H](C(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C)C(C)(C)C	ZINC001102089359	1364848772	/nfs/dbraw/zinc/84/87/72/1364848772.db2.gz	KHNAWBOIDIPLTH-QLFBSQMISA-N	0	3	347.528	3.486	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@@H]1CN(Cc2cnc(C)s2)C[C@H]1C	ZINC001102263234	1364975609	/nfs/dbraw/zinc/97/56/09/1364975609.db2.gz	ZJOIGLYKRPFDGV-FVQBIDKESA-N	0	3	335.517	3.238	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](NCc3sc(C)nc3C)C2)CC1	ZINC001185439754	1387717508	/nfs/dbraw/zinc/71/75/08/1387717508.db2.gz	YQNNJSKILAFLMP-OAHLLOKOSA-N	0	3	333.501	3.197	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccc(Cl)cc2)C[C@H]1CNC(=O)C(C)(C)C	ZINC001102523409	1365098508	/nfs/dbraw/zinc/09/85/08/1365098508.db2.gz	LHORLSNFRAFSTQ-NVXWUHKLSA-N	0	3	346.902	3.422	20	30		EGEDHN
C=C[C@@H](C(=O)NC[C@@H]1CN(Cc2ccccn2)C[C@H]1C)c1ccccc1	ZINC001102593221	1365129665	/nfs/dbraw/zinc/12/96/65/1365129665.db2.gz	MJJVIQDXCRONGC-YFVAEKQCSA-N	0	3	349.478	3.236	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1CCNC(=O)C(C)(C)F	ZINC001102635974	1365147030	/nfs/dbraw/zinc/14/70/30/1365147030.db2.gz	JJUZBMJEYAERFJ-UKRRQHHQSA-N	0	3	349.425	3.020	20	30		EGEDHN
CCCCC(=O)NCC[C@@H]1CN(Cc2cc(C#N)ccc2F)C[C@H]1C	ZINC001102670552	1365164185	/nfs/dbraw/zinc/16/41/85/1365164185.db2.gz	GTYXAYDONVDAJV-NVXWUHKLSA-N	0	3	345.462	3.462	20	30		EGEDHN
C[C@@H](C(=O)NCC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C)C1CC1	ZINC001102826763	1365239759	/nfs/dbraw/zinc/23/97/59/1365239759.db2.gz	XITJZFJOYWKYJF-IIAWOOMASA-N	0	3	345.512	3.240	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCC[C@@H]1CN(Cc2cncc(F)c2)C[C@H]1C	ZINC001103345039	1365510529	/nfs/dbraw/zinc/51/05/29/1365510529.db2.gz	YNBQUSBQNGWCSO-LZLYRXPVSA-N	0	3	347.478	3.397	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cc[nH]c2C2CC2)C1	ZINC001103373106	1365522718	/nfs/dbraw/zinc/52/27/18/1365522718.db2.gz	CSIMYWSDBRWTGM-IUODEOHRSA-N	0	3	335.879	3.332	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2ccc3c(c2)CCO3)C1	ZINC001103462050	1365575654	/nfs/dbraw/zinc/57/56/54/1365575654.db2.gz	JHGOBCSCOGCLKE-CXAGYDPISA-N	0	3	348.874	3.062	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)Cc2cccs2)C[C@H]1C	ZINC001103823909	1365799547	/nfs/dbraw/zinc/79/95/47/1365799547.db2.gz	DNOAUTSQDDALMD-TZMCWYRMSA-N	0	3	326.893	3.117	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CN(C(=O)[C@@H](C)CCC)C[C@H]1C	ZINC001104008365	1365872101	/nfs/dbraw/zinc/87/21/01/1365872101.db2.gz	DWNBECJYIPSIHO-GZBFAFLISA-N	0	3	345.325	3.405	20	30		EGEDHN
C/C=C(\C)C(=O)N1C[C@@H](C)[C@H](CCNCc2ccccc2C#N)C1	ZINC001104053769	1365892015	/nfs/dbraw/zinc/89/20/15/1365892015.db2.gz	IZUHTBFEVDMXSN-PTWGCIMZSA-N	0	3	325.456	3.099	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2scnc2CC)C[C@H]1C	ZINC001104270628	1365973793	/nfs/dbraw/zinc/97/37/93/1365973793.db2.gz	HPIABBGXMJMNDF-DGCLKSJQSA-N	0	3	341.908	3.146	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2ccnc(C3CC3)c2)C[C@H]1C	ZINC001104390375	1366000572	/nfs/dbraw/zinc/00/05/72/1366000572.db2.gz	XQUSNOSTDVGSSM-CXAGYDPISA-N	0	3	347.890	3.399	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2c(C)cc(C)nc2C)C[C@H]1C	ZINC001104435831	1366028127	/nfs/dbraw/zinc/02/81/27/1366028127.db2.gz	ITDNZIJYTOEOFQ-CXAGYDPISA-N	0	3	349.906	3.447	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H](C)[C@H](CCNCc2c(C)noc2C)C1	ZINC001104563639	1366078570	/nfs/dbraw/zinc/07/85/70/1366078570.db2.gz	POMZOUFSZIFCEH-IIDMSEBBSA-N	0	3	347.503	3.468	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2c(C)noc2C)C1	ZINC001104606732	1366098669	/nfs/dbraw/zinc/09/86/69/1366098669.db2.gz	CNRFDXNCKRWFDG-RHSMWYFYSA-N	0	3	333.476	3.222	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H](C)[C@H](CCNCc2ocnc2C)C1	ZINC001104631456	1366109969	/nfs/dbraw/zinc/10/99/69/1366109969.db2.gz	NUVILFMNKSIPRP-IDHHARJASA-N	0	3	333.476	3.160	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](C)[C@H](CCNCc3cc(C)no3)C2)CCC1	ZINC001104635148	1366112889	/nfs/dbraw/zinc/11/28/89/1366112889.db2.gz	UBZGMLUNGABXCN-NVXWUHKLSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cnoc2C(C)C)C[C@H]1C	ZINC001104863664	1366203567	/nfs/dbraw/zinc/20/35/67/1366203567.db2.gz	ABZAWDHANMQKBZ-TZMCWYRMSA-N	0	3	339.867	3.238	20	30		EGEDHN
C[C@@H]1CN(C(=O)C(C)(C)C)C[C@H]1CCNCc1ccccc1C#N	ZINC001104939749	1366231932	/nfs/dbraw/zinc/23/19/32/1366231932.db2.gz	FWTVYXPRASUZDO-CRAIPNDOSA-N	0	3	327.472	3.179	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2scnc2Cl)C[C@H]1C	ZINC001105019974	1366278914	/nfs/dbraw/zinc/27/89/14/1366278914.db2.gz	LMFDQRZWHBUBAA-MWLCHTKSSA-N	0	3	348.299	3.237	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2ccccc2N(C)C)C[C@H]1C	ZINC001105098903	1366327323	/nfs/dbraw/zinc/32/73/23/1366327323.db2.gz	BXVPXVNPARPNDF-GDBMZVCRSA-N	0	3	349.906	3.193	20	30		EGEDHN
CCCCCCCNCc1cn(C2CN(C(=O)C(C)(C)CC)C2)nn1	ZINC001105317291	1366419893	/nfs/dbraw/zinc/41/98/93/1366419893.db2.gz	RBDSIGJRKWHFKE-UHFFFAOYSA-N	0	3	349.523	3.158	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@@H](C)CC(=C)C)CC1	ZINC001105394037	1366442883	/nfs/dbraw/zinc/44/28/83/1366442883.db2.gz	NFUWPIINAIFISH-HKUYNNGSSA-N	0	3	328.500	3.315	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001106708833	1366777325	/nfs/dbraw/zinc/77/73/25/1366777325.db2.gz	LQDVACGQNCLJAP-VQIMIIECSA-N	0	3	339.483	3.345	20	30		EGEDHN
C=CCOCCCC(=O)NC[C@]12CCC[C@H]1N(C/C=C/Cl)CC2	ZINC001107350571	1366937964	/nfs/dbraw/zinc/93/79/64/1366937964.db2.gz	KZSGJVQQZBVWPT-JUCJDPDUSA-N	0	3	340.895	3.083	20	30		EGEDHN
CC1(C(=O)NC[C@]23CCC[C@H]2N(CC#Cc2ccccc2)CC3)CC1	ZINC001107414044	1366957018	/nfs/dbraw/zinc/95/70/18/1366957018.db2.gz	ANYHNGYIUUIYCW-DENIHFKCSA-N	0	3	336.479	3.199	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](N(C)Cc2ccc(Cl)c(OC)c2)C1	ZINC001189319157	1366988583	/nfs/dbraw/zinc/98/85/83/1366988583.db2.gz	UWIVAUNHFBHGSY-OAHLLOKOSA-N	0	3	336.863	3.348	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC[C@@H](N(C)C/C=C\c2ccc(Cl)cc2)C1	ZINC001189400600	1367012372	/nfs/dbraw/zinc/01/23/72/1367012372.db2.gz	MGBZHHAMURGEGT-SWTGODCJSA-N	0	3	331.847	3.046	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@]12CCC[C@H]1N(Cc1cnc(C)o1)CC2	ZINC001107533790	1367024694	/nfs/dbraw/zinc/02/46/94/1367024694.db2.gz	GZYRHDDRSNCJJI-MISYRCLQSA-N	0	3	345.487	3.446	20	30		EGEDHN
CCc1ccc(CCN2[C@@H]3CC[C@H]2[C@@H](NC(=O)C#CC(C)C)C3)cc1	ZINC001109249620	1367025144	/nfs/dbraw/zinc/02/51/44/1367025144.db2.gz	GRVXVCHVBHMHOC-HKBOAZHASA-N	0	3	338.495	3.172	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1CC[C@@H](N(C)Cc2ccc(OCC#N)cc2)C1	ZINC001189460338	1367028077	/nfs/dbraw/zinc/02/80/77/1367028077.db2.gz	LKASZWCKFXSCCL-SJLPKXTDSA-N	0	3	343.471	3.058	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@]23CCC[C@H]2N(Cc2ccccn2)CC3)C1	ZINC001107543468	1367035331	/nfs/dbraw/zinc/03/53/31/1367035331.db2.gz	JCYABMPCQVFLND-WIYYLYMNSA-N	0	3	339.483	3.299	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@@H](OCC)C1=CCCC1)C2	ZINC001109289736	1367040183	/nfs/dbraw/zinc/04/01/83/1367040183.db2.gz	NGJWSJLCBCIABE-YDZRNGNQSA-N	0	3	332.488	3.190	20	30		EGEDHN
C=CCCCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1c(F)cncc1F)C2	ZINC001109343046	1367069875	/nfs/dbraw/zinc/06/98/75/1367069875.db2.gz	HQTYUGPKRWFGIA-COXVUDFISA-N	0	3	349.425	3.441	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](C)CCc1ccc(F)cc1)C2	ZINC001109387470	1367098486	/nfs/dbraw/zinc/09/84/86/1367098486.db2.gz	OAGBIWKMMMNSPK-LDTOTXGLSA-N	0	3	342.458	3.139	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)COCCCCCCCC)C2	ZINC001109409650	1367108782	/nfs/dbraw/zinc/10/87/82/1367108782.db2.gz	MYBSWAOGGNJBEG-QYZOEREBSA-N	0	3	334.504	3.108	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](N(C)Cc2ccc(C(F)F)cc2)C1	ZINC001189910022	1367129675	/nfs/dbraw/zinc/12/96/75/1367129675.db2.gz	KXDGOGCCCATDOR-QGZVFWFLSA-N	0	3	334.410	3.460	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@@H](N(C)[C@H](C)c2ccc(F)c(F)c2)C1	ZINC001190004161	1367149884	/nfs/dbraw/zinc/14/98/84/1367149884.db2.gz	NLUJMTJFWWJEOZ-GDBMZVCRSA-N	0	3	334.410	3.218	20	30		EGEDHN
COc1cc(CN(C)[C@H]2CCN(C(=O)C#CC(C)C)C2)ccc1Cl	ZINC001190054015	1367162153	/nfs/dbraw/zinc/16/21/53/1367162153.db2.gz	NURXLKAUDWDJLO-INIZCTEOSA-N	0	3	348.874	3.041	20	30		EGEDHN
COc1ccc(CN(C)[C@@H]2CCN(C(=O)C#CC(C)C)C2)cc1Cl	ZINC001190054611	1367162803	/nfs/dbraw/zinc/16/28/03/1367162803.db2.gz	SIMCVNOTNSMHKO-MRXNPFEDSA-N	0	3	348.874	3.041	20	30		EGEDHN
Cc1cc(F)ccc1CN(C)[C@@H]1CCN(C(=O)C#CC(C)(C)C)C1	ZINC001190076137	1367166478	/nfs/dbraw/zinc/16/64/78/1367166478.db2.gz	KRSSZHQDAYDHHZ-GOSISDBHSA-N	0	3	330.447	3.216	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)NCc1ccc(Cl)cc1Cl	ZINC001190111650	1367175290	/nfs/dbraw/zinc/17/52/90/1367175290.db2.gz	CCQUKEUDHCLXFN-AWEZNQCLSA-N	0	3	342.270	3.443	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2oc(C)cc2C)C1	ZINC001107853160	1367175964	/nfs/dbraw/zinc/17/59/64/1367175964.db2.gz	MTQNCLQKDGKPPE-BEFAXECRSA-N	0	3	334.460	3.072	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2cccc(F)c2C)C1	ZINC001107957913	1367216105	/nfs/dbraw/zinc/21/61/05/1367216105.db2.gz	QGCGPKHHGXMBMH-FOIQADDNSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC[C@]1(C)CN(CC2CCCC2)CCO1	ZINC001107964442	1367220202	/nfs/dbraw/zinc/22/02/02/1367220202.db2.gz	FKXMWMCXHPXPCR-HXUWFJFHSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)C2(CC(C)C)CC2)C1	ZINC001107989423	1367232006	/nfs/dbraw/zinc/23/20/06/1367232006.db2.gz	RTXPZRKOTYNXRU-MJGOQNOKSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@H](N(C)CCOCC2CCC2)C1	ZINC001190353874	1367235836	/nfs/dbraw/zinc/23/58/36/1367235836.db2.gz	CJIZTZNJSSZDTP-INIZCTEOSA-N	0	3	342.911	3.115	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](N(C)CCOc2cccc(F)c2)C1	ZINC001190388009	1367248923	/nfs/dbraw/zinc/24/89/23/1367248923.db2.gz	JXRRSOTTYZWDDA-KRWDZBQOSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](N(C)CCOc2ccc(C)cc2)C1	ZINC001190436529	1367265007	/nfs/dbraw/zinc/26/50/07/1367265007.db2.gz	VZLPSFDOVPNOFL-SFHVURJKSA-N	0	3	330.472	3.263	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3CC/C=C/CCC)c1	ZINC001109697053	1367285810	/nfs/dbraw/zinc/28/58/10/1367285810.db2.gz	SXQHJKUFOWFDHV-FZEFPESISA-N	0	3	337.467	3.144	20	30		EGEDHN
CC(C)CC1(C(=O)N2CC[C@@H](N(C)Cc3cccc(C#N)c3)C2)CC1	ZINC001190595320	1367302562	/nfs/dbraw/zinc/30/25/62/1367302562.db2.gz	PGOXSPFAGYEJSA-LJQANCHMSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)C2CC3(CCC3)C2)C1	ZINC001108141802	1367304438	/nfs/dbraw/zinc/30/44/38/1367304438.db2.gz	DMMFKXDTEUQXQY-VQIMIIECSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2cc[nH]c2C2CC2)C1	ZINC001108164091	1367318774	/nfs/dbraw/zinc/31/87/74/1367318774.db2.gz	UBPXUMKFMXZYRM-MGPUTAFESA-N	0	3	345.487	3.068	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@]2(C)CN(CC3CCCC3)CCO2)CC1	ZINC001108186687	1367330630	/nfs/dbraw/zinc/33/06/30/1367330630.db2.gz	SYOJTKAGRHDUOV-HXUWFJFHSA-N	0	3	334.504	3.130	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCN(C(=O)CCC(C)(F)F)C1	ZINC001190973250	1367392464	/nfs/dbraw/zinc/39/24/64/1367392464.db2.gz	LKJFSFCYPADHAJ-MRXNPFEDSA-N	0	3	335.398	3.026	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCCOc1ccc(C)cc1)C2	ZINC001110066045	1367490802	/nfs/dbraw/zinc/49/08/02/1367490802.db2.gz	UVQDYUVAKBHFFT-HOJAQTOUSA-N	0	3	342.483	3.452	20	30		EGEDHN
C=CC[C@@H](C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCOCC)c1ccccc1	ZINC001110131205	1367515652	/nfs/dbraw/zinc/51/56/52/1367515652.db2.gz	XANNZRJAMGPTAW-ZRNYENFQSA-N	0	3	342.483	3.104	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](C)Cc1ccc(OC)cc1)C2	ZINC001110131061	1367515688	/nfs/dbraw/zinc/51/56/88/1367515688.db2.gz	RGPAKJUQVDUJJY-RKOGWWSCSA-N	0	3	342.483	3.171	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H]1CCCC(C)(C)C1)C2	ZINC001110172708	1367543942	/nfs/dbraw/zinc/54/39/42/1367543942.db2.gz	HVSBUPBPQXTYPO-MHORFTMASA-N	0	3	334.504	3.127	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2[C@H](C)c1ccccc1	ZINC001110182092	1367550621	/nfs/dbraw/zinc/55/06/21/1367550621.db2.gz	VXBKGJXVPOYIRF-YSHGAJCASA-N	0	3	328.456	3.062	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H](N(C)Cc2ccccc2N(C)C)C1	ZINC001191868088	1367620668	/nfs/dbraw/zinc/62/06/68/1367620668.db2.gz	NVPABBOUQDPMGC-MJGOQNOKSA-N	0	3	343.515	3.388	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@@H](N(C)CCOc2ccccc2F)C1	ZINC001191913333	1367637040	/nfs/dbraw/zinc/63/70/40/1367637040.db2.gz	WZJJJSOTMBHHAV-IAGOWNOFSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001191913617	1367638372	/nfs/dbraw/zinc/63/83/72/1367638372.db2.gz	ZQXYBDARJYBSRD-LPHOPBHVSA-N	0	3	325.456	3.193	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](N(C)Cc2cccc3nsnc32)C1	ZINC001192072755	1367680948	/nfs/dbraw/zinc/68/09/48/1367680948.db2.gz	KLEMGPGRFDKOKK-OAHLLOKOSA-N	0	3	344.484	3.080	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](N(C)CCOc2ccccc2F)C1	ZINC001192160234	1367703649	/nfs/dbraw/zinc/70/36/49/1367703649.db2.gz	CBPHTVPMNVNSIL-OXQOHEQNSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)C[C@H](C)c2cccc(F)c2)C1	ZINC001192282481	1367738189	/nfs/dbraw/zinc/73/81/89/1367738189.db2.gz	AFYRNRSHIDXKLR-LPHOPBHVSA-N	0	3	348.462	3.055	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](N(C)CCOc2ccc(F)cc2)C1	ZINC001192577157	1367822631	/nfs/dbraw/zinc/82/26/31/1367822631.db2.gz	CQXKVKIMLKTRCI-QGZVFWFLSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H]1CCC(C)=C(C)C1)C2	ZINC001110585656	1367850009	/nfs/dbraw/zinc/85/00/09/1367850009.db2.gz	HGYKIHRCENEUPL-MKXGPGLRSA-N	0	3	332.488	3.047	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCc1scnc1C	ZINC001110603998	1367865804	/nfs/dbraw/zinc/86/58/04/1367865804.db2.gz	YUSCPPMNDXUASO-OAGGEKHMSA-N	0	3	347.528	3.318	20	30		EGEDHN
C=CC1(CC(=O)N2CC[C@@H](NCc3cncs3)C2)CCCCC1	ZINC001186280822	1387914489	/nfs/dbraw/zinc/91/44/89/1387914489.db2.gz	KRJBTQVRCLRKCR-OAHLLOKOSA-N	0	3	333.501	3.360	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCCOc1ccc(F)cc1)C2	ZINC001110880312	1368054437	/nfs/dbraw/zinc/05/44/37/1368054437.db2.gz	JLVMZEQLKNBQJT-QRQLOZEOSA-N	0	3	346.446	3.282	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCc1scnc1C	ZINC001110933082	1368103101	/nfs/dbraw/zinc/10/31/01/1368103101.db2.gz	FWYFWWHYNRUWMH-DZUCGIPZSA-N	0	3	347.528	3.318	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCc1ccc(OC)cc1	ZINC001110967066	1368128203	/nfs/dbraw/zinc/12/82/03/1368128203.db2.gz	QUCFAWKJACUUJK-RLLQIKCJSA-N	0	3	342.483	3.316	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCCc1ccc(F)cc1)C2	ZINC001111059980	1368151227	/nfs/dbraw/zinc/15/12/27/1368151227.db2.gz	CDSOQVNWLDYSIU-QRVBRYPASA-N	0	3	330.447	3.446	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc([C@@H](C)CC)no1)C2	ZINC001111117415	1368161586	/nfs/dbraw/zinc/16/15/86/1368161586.db2.gz	UXDCRQROICKYJR-ABFRBSLYSA-N	0	3	331.460	3.489	20	30		EGEDHN
C=CC[C@@H](C(=O)N1CC[C@H](N(C)CCOC(C)C)C1)c1ccccc1	ZINC001194173804	1368198189	/nfs/dbraw/zinc/19/81/89/1368198189.db2.gz	FJWYRRJOSHCOAJ-VQTJNVASSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)[C@@H](CC)c2ccc(F)cc2)C1	ZINC001194324258	1368230777	/nfs/dbraw/zinc/23/07/77/1368230777.db2.gz	BABWFOYCVHYGPI-OALUTQOASA-N	0	3	348.462	3.055	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3CC/C=C\CCC)nc1	ZINC001111292280	1368254750	/nfs/dbraw/zinc/25/47/50/1368254750.db2.gz	AYZZSOCOSIGUAW-XBQKGDGXSA-N	0	3	337.467	3.144	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@@H](C)c1ccccc1OC)C2	ZINC001111292567	1368255290	/nfs/dbraw/zinc/25/52/90/1368255290.db2.gz	GUMGZJWLBQAHDT-RWQQGDIJSA-N	0	3	342.483	3.486	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)COc1ccc(Cl)cc1)C2	ZINC001111342330	1368269132	/nfs/dbraw/zinc/26/91/32/1368269132.db2.gz	SBOHMHIDLXUCPS-OIISXLGYSA-N	0	3	334.847	3.016	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCCOc1ccc(C)cc1)C2	ZINC001111357773	1368273128	/nfs/dbraw/zinc/27/31/28/1368273128.db2.gz	UVQDYUVAKBHFFT-RLLQIKCJSA-N	0	3	342.483	3.452	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCn1ccc3ccccc31)C2	ZINC001111376573	1368275723	/nfs/dbraw/zinc/27/57/23/1368275723.db2.gz	SDVCIHUMYVBWTE-GGPKGHCWSA-N	0	3	337.467	3.329	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1cc(C)cc(C)c1	ZINC001111488339	1368318889	/nfs/dbraw/zinc/31/88/89/1368318889.db2.gz	HDIGWFYJCAPOKZ-NBYUQASBSA-N	0	3	342.483	3.116	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccc(C)cc1C	ZINC001111488840	1368319789	/nfs/dbraw/zinc/31/97/89/1368319789.db2.gz	WXPVUCDVMURUNH-NBYUQASBSA-N	0	3	342.483	3.116	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@H](CC)C(C)C)C[C@H](C)O2	ZINC001111552958	1368344711	/nfs/dbraw/zinc/34/47/11/1368344711.db2.gz	QUUNRGHTGMWIDN-ROUUACIJSA-N	0	3	336.520	3.327	20	30		EGEDHN
CC(C)CC(=O)N[C@]12CCC[C@H]1CN(Cc1cccc(C#N)c1)C2	ZINC001111571361	1368348367	/nfs/dbraw/zinc/34/83/67/1368348367.db2.gz	KEGPRWAIYBAYOW-ICSRJNTNSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CCCN(Cc2ccccc2CC)CC1	ZINC001195173579	1368393168	/nfs/dbraw/zinc/39/31/68/1368393168.db2.gz	BZHDVYKYCAEVJU-GOSISDBHSA-N	0	3	344.499	3.265	20	30		EGEDHN
C=CCOCC(=O)N[C@]12CCC[C@H]1CN([C@H](C)c1ccccc1F)C2	ZINC001111662142	1368414974	/nfs/dbraw/zinc/41/49/74/1368414974.db2.gz	IRFMAAVYXQQLAL-GUXCAODWSA-N	0	3	346.446	3.060	20	30		EGEDHN
Cc1cc(Cl)ccc1CN1C[C@@H]2CCC[C@]2(NC(=O)[C@H](C)C#N)C1	ZINC001111667300	1368416684	/nfs/dbraw/zinc/41/66/84/1368416684.db2.gz	ZIFRTCIKODANTF-ALKREAHSSA-N	0	3	345.874	3.279	20	30		EGEDHN
C#CCN1C[C@@H]2CCC[C@]2(NC(=O)CCCc2ccc(Cl)cc2)C1	ZINC001111797123	1368466561	/nfs/dbraw/zinc/46/65/61/1368466561.db2.gz	ZMDZYALPNHRUOK-PXNSSMCTSA-N	0	3	344.886	3.267	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)c2ccc(CCC)cc2)C1	ZINC001195677817	1368470957	/nfs/dbraw/zinc/47/09/57/1368470957.db2.gz	UQXQZVOJUBQHMV-WOJBJXKFSA-N	0	3	346.515	3.384	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2oc(CC3CC3)nc2C)CC1	ZINC001195866042	1368506574	/nfs/dbraw/zinc/50/65/74/1368506574.db2.gz	SSLZZHXAVAPXTR-UHFFFAOYSA-N	0	3	331.460	3.050	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CCCN(CCc2ccccc2)CC1)OCC	ZINC001196025690	1368538157	/nfs/dbraw/zinc/53/81/57/1368538157.db2.gz	SQLQRIGPSPQGDA-HXUWFJFHSA-N	0	3	344.499	3.135	20	30		EGEDHN
C=CCCCN1C[C@@H](O)[C@H](NC(=O)C[C@@H](CC)c2ccc(C)cc2)C1	ZINC001196161243	1368560435	/nfs/dbraw/zinc/56/04/35/1368560435.db2.gz	MXFVWSOQHJSTRB-MISYRCLQSA-N	0	3	344.499	3.006	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccoc2CCC)C1	ZINC001111936353	1368566556	/nfs/dbraw/zinc/56/65/56/1368566556.db2.gz	GOMDVKWDAUYKAD-JXFKEZNVSA-N	0	3	346.471	3.019	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cc3cccn3cn2)CC1	ZINC001196259764	1368578273	/nfs/dbraw/zinc/57/82/73/1368578273.db2.gz	PAKTYOIZTVRWFH-UHFFFAOYSA-N	0	3	340.471	3.229	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)C2[C@@H]3CCCCCC[C@@H]23)C1	ZINC001196408320	1368608889	/nfs/dbraw/zinc/60/88/89/1368608889.db2.gz	ZTYCAYLAHROUNJ-NCXUSEDFSA-N	0	3	348.531	3.111	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)[C@H]2Cc3ccccc3O2)CC1	ZINC001196444963	1368616698	/nfs/dbraw/zinc/61/66/98/1368616698.db2.gz	AZPIYNXSVXZVEM-HXUWFJFHSA-N	0	3	344.499	3.495	20	30		EGEDHN
C=CCC[C@H](C)N1CCCN(C(=O)c2nc3c(s2)CCC3)CC1	ZINC001196499747	1368627719	/nfs/dbraw/zinc/62/77/19/1368627719.db2.gz	DJJWJQZWAMCHIF-AWEZNQCLSA-N	0	3	333.501	3.134	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@@H](C)CC(F)(F)F)C[C@H]1C(F)(F)F	ZINC001112158925	1368689945	/nfs/dbraw/zinc/68/99/45/1368689945.db2.gz	FPYWTDZBNBXVEG-HBNTYKKESA-N	0	3	346.315	3.130	20	30		EGEDHN
C=CC1(CC(=O)N[C@@H]2CN(CCCC3CCC3)C[C@H]2O)CCCCC1	ZINC001196860847	1368701623	/nfs/dbraw/zinc/70/16/23/1368701623.db2.gz	NYTUDUICXHQANB-RTBURBONSA-N	0	3	348.531	3.255	20	30		EGEDHN
C=CC1(CC(=O)N[C@@H]2CN(CC/C=C\CCC)C[C@H]2O)CCCCC1	ZINC001196860507	1368702386	/nfs/dbraw/zinc/70/23/86/1368702386.db2.gz	KZTCTXWERNQSFI-PWBPZBFBSA-N	0	3	348.531	3.421	20	30		EGEDHN
COc1ccc([C@@H]2CN(Cc3ccc(Cl)cc3C#N)CCN2)cc1	ZINC001197052951	1368735403	/nfs/dbraw/zinc/73/54/03/1368735403.db2.gz	YHWCNIVVCIEJIL-IBGZPJMESA-N	0	3	341.842	3.367	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cc(C(F)F)n[nH]2)CC1	ZINC001197125531	1368750266	/nfs/dbraw/zinc/75/02/66/1368750266.db2.gz	COIFKDGCDUTNMC-UHFFFAOYSA-N	0	3	342.434	3.466	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cc(C3CC3)n[nH]2)CC1	ZINC001197227486	1368767190	/nfs/dbraw/zinc/76/71/90/1368767190.db2.gz	PMQZDRLLMIVOJF-UHFFFAOYSA-N	0	3	330.476	3.181	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCCN(C[C@H](O)C2CCCCC2)CC1	ZINC001197291828	1368781436	/nfs/dbraw/zinc/78/14/36/1368781436.db2.gz	MIWBSROEPMRNDH-SFHVURJKSA-N	0	3	336.520	3.064	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)C[C@@H](C)CC(C)C)C1	ZINC001197698632	1368875351	/nfs/dbraw/zinc/87/53/51/1368875351.db2.gz	LWLJJQLGHWBKFE-RCCFBDPRSA-N	0	3	326.525	3.190	20	30		EGEDHN
CCCCCCCCCC(=O)N[C@@H]1CN(CCCCCF)C[C@H]1O	ZINC001198096577	1368959221	/nfs/dbraw/zinc/95/92/21/1368959221.db2.gz	OOSAFFCZORKWHG-QZTJIDSGSA-N	0	3	344.515	3.428	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](C2CCN(C(=O)COCC)CC2)CC1	ZINC001186577295	1387971892	/nfs/dbraw/zinc/97/18/92/1387971892.db2.gz	BNMYDKZFXACTAK-MRXNPFEDSA-N	0	3	342.911	3.116	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N1CCCN([C@H](C)c2ccccc2C)CC1	ZINC001198344194	1369012857	/nfs/dbraw/zinc/01/28/57/1369012857.db2.gz	RASKVZQGEFXPBU-QZTJIDSGSA-N	0	3	330.472	3.181	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N1CCCN(CCCc2ccc(C)cc2)CC1	ZINC001198343729	1369013205	/nfs/dbraw/zinc/01/32/05/1369013205.db2.gz	MVXDXDRTQYWRHP-IBGZPJMESA-N	0	3	344.499	3.053	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cc(N(C)C)ccn2)CC1	ZINC001198357650	1369014685	/nfs/dbraw/zinc/01/46/85/1369014685.db2.gz	FWFKNFWAGGLRPZ-UHFFFAOYSA-N	0	3	344.503	3.042	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)c2c(C)cc(C)cc2C)C1	ZINC001198409176	1369025313	/nfs/dbraw/zinc/02/53/13/1369025313.db2.gz	HXHXSIPBTKHOJL-RTBURBONSA-N	0	3	346.515	3.357	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)c1ccc(C)o1)c1ccccc1OC	ZINC001198508720	1369049540	/nfs/dbraw/zinc/04/95/40/1369049540.db2.gz	PNQABJMRKALAQF-INIZCTEOSA-N	0	3	328.412	3.233	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)c1cccn1C)c1ccccc1OC	ZINC001198529470	1369053134	/nfs/dbraw/zinc/05/31/34/1369053134.db2.gz	FGJWOHUOMLMUAZ-KRWDZBQOSA-N	0	3	341.455	3.061	20	30		EGEDHN
C=CCC[C@H](C)N[C@H](CNC(=O)COCCC)c1ccccc1OC	ZINC001198584653	1369066784	/nfs/dbraw/zinc/06/67/84/1369066784.db2.gz	LRUHKGBVYFJKSU-FUHWJXTLSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)Cc2ccc(OC)cc2C)CC1	ZINC001112883171	1369066744	/nfs/dbraw/zinc/06/67/44/1369066744.db2.gz	YVMWKEREPPFZNS-QGZVFWFLSA-N	0	3	330.472	3.045	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)c1ocnc1C)c1ccccc1OC	ZINC001198648215	1369082490	/nfs/dbraw/zinc/08/24/90/1369082490.db2.gz	UKOHNMHLHPWWTQ-MRXNPFEDSA-N	0	3	343.427	3.019	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)[C@H]1CC1(C)C)c1ccccc1OC	ZINC001198667188	1369086019	/nfs/dbraw/zinc/08/60/19/1369086019.db2.gz	DPRXDMJGCPTSRH-SJORKVTESA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@@H](CC)SC)c1ccccc1OC	ZINC001198669000	1369087165	/nfs/dbraw/zinc/08/71/65/1369087165.db2.gz	WNWQIUCDJBVEKV-DOTOQJQBSA-N	0	3	336.501	3.160	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)C1CC(C)(C)C1)c1ccccc1OC	ZINC001198705297	1369095582	/nfs/dbraw/zinc/09/55/82/1369095582.db2.gz	PYRBXNMVHBQQDZ-KRWDZBQOSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)c1cc[nH]c1)c1ccccc1OC	ZINC001198743471	1369103705	/nfs/dbraw/zinc/10/37/05/1369103705.db2.gz	ZPEUXFZZPUKUQR-KRWDZBQOSA-N	0	3	327.428	3.050	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@H](C)CC(F)F)c1ccccc1OC	ZINC001198797537	1369117873	/nfs/dbraw/zinc/11/78/73/1369117873.db2.gz	VMGWOBQVWLLBGI-UKRRQHHQSA-N	0	3	340.414	3.310	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NC[C@@H](NCCC)c1ccccc1OC	ZINC001198819879	1369122096	/nfs/dbraw/zinc/12/20/96/1369122096.db2.gz	XHPWGSINJJDRER-XLIONFOSSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)c1cocc1C)c1ccccc1OC	ZINC001198842272	1369127189	/nfs/dbraw/zinc/12/71/89/1369127189.db2.gz	GLBJAVRFEQXGIU-QGZVFWFLSA-N	0	3	328.412	3.233	20	30		EGEDHN
CC#CCCCC(=O)NC[C@H](NCCCC)c1ccccc1OC	ZINC001198856206	1369131076	/nfs/dbraw/zinc/13/10/76/1369131076.db2.gz	GXUKBUVUKHTGQV-SFHVURJKSA-N	0	3	330.472	3.436	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@@H](NCCCOC)c1ccccc1OC	ZINC001198857255	1369131444	/nfs/dbraw/zinc/13/14/44/1369131444.db2.gz	NYRDLPXSSXETME-FUHWJXTLSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@H](NCCCOC)c1ccccc1OC	ZINC001198857254	1369131665	/nfs/dbraw/zinc/13/16/65/1369131665.db2.gz	NYRDLPXSSXETME-AEFFLSMTSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)c1cc(C)[nH]c1C)c1ccccc1OC	ZINC001198916659	1369148759	/nfs/dbraw/zinc/14/87/59/1369148759.db2.gz	QHDUUANSMYWYPZ-SFHVURJKSA-N	0	3	341.455	3.277	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@H](C)c2ccccc2C)C1	ZINC001198940575	1369153491	/nfs/dbraw/zinc/15/34/91/1369153491.db2.gz	PZKFACXZLPXRMC-MISYRCLQSA-N	0	3	346.515	3.230	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)C(C1CC1)C1CC1)c1ccccc1OC	ZINC001198959335	1369158118	/nfs/dbraw/zinc/15/81/18/1369158118.db2.gz	ACNCIQWDLRRHFL-GOSISDBHSA-N	0	3	342.483	3.454	20	30		EGEDHN
C=C[C@H](C(=O)N[C@@H]1CN(CCCCCCC)C[C@H]1O)c1ccccc1	ZINC001198956015	1369158190	/nfs/dbraw/zinc/15/81/90/1369158190.db2.gz	OGHVULXIEMKQAP-XUVXKRRUSA-N	0	3	344.499	3.088	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)C[C@@H](C)C1CC1)c1ccccc1OC	ZINC001198992522	1369167083	/nfs/dbraw/zinc/16/70/83/1369167083.db2.gz	BVHRTFAQEBDNGK-QAPCUYQASA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@@H](CCCC)C(C)C)C1	ZINC001199153218	1369185648	/nfs/dbraw/zinc/18/56/48/1369185648.db2.gz	GGDUNEDBRXWOIS-IPMKNSEASA-N	0	3	338.536	3.357	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2CN(CCCCCCC)C[C@H]2O)CCCCC1	ZINC001199278081	1369201005	/nfs/dbraw/zinc/20/10/05/1369201005.db2.gz	NVLMNQRGLVEHBZ-RTBURBONSA-N	0	3	348.531	3.092	20	30		EGEDHN
C=CCCC(=O)N1CCC(NCc2c(Cl)cccc2OC)CC1	ZINC001199726204	1369262660	/nfs/dbraw/zinc/26/26/60/1369262660.db2.gz	SHGARLZSUAJDOC-UHFFFAOYSA-N	0	3	336.863	3.395	20	30		EGEDHN
CC(C)C[C@H](C)C(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001186646300	1387992515	/nfs/dbraw/zinc/99/25/15/1387992515.db2.gz	HVLTXSYRBLQOKR-WMLDXEAASA-N	0	3	331.435	3.070	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)Cc2cn(C)c3ccccc23)CC1	ZINC001113273202	1369307700	/nfs/dbraw/zinc/30/77/00/1369307700.db2.gz	WBNLJYJSUJORKQ-QGZVFWFLSA-N	0	3	339.483	3.220	20	30		EGEDHN
C#CCCCCC(=O)N1CCC(NCc2ccncc2Cl)CC1	ZINC001200147866	1369320502	/nfs/dbraw/zinc/32/05/02/1369320502.db2.gz	HGIMNDNGVDSIEW-UHFFFAOYSA-N	0	3	333.863	3.009	20	30		EGEDHN
CCCCCCCCCNC(=S)NC1CCN(CCOC)CC1	ZINC001200380380	1369357592	/nfs/dbraw/zinc/35/75/92/1369357592.db2.gz	NVADBYMYYBVIHO-UHFFFAOYSA-N	0	3	343.581	3.312	20	30		EGEDHN
CC(C)c1ccc(NC(=S)NCCN2CCCCC2)c(C#N)c1	ZINC001200431064	1369367017	/nfs/dbraw/zinc/36/70/17/1369367017.db2.gz	OWGZNRRKRXHRID-UHFFFAOYSA-N	0	3	330.501	3.454	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC(NCc2cc(C3CC3)no2)CC1	ZINC001200794784	1369430341	/nfs/dbraw/zinc/43/03/41/1369430341.db2.gz	OCAIDMDHMFNVNW-UHFFFAOYSA-N	0	3	331.460	3.235	20	30		EGEDHN
C#CCC1(C(=O)N2CCC(NCc3nc(C)c(C)s3)CC2)CCC1	ZINC001200995734	1369464012	/nfs/dbraw/zinc/46/40/12/1369464012.db2.gz	WBJXQADTYCAJOS-UHFFFAOYSA-N	0	3	345.512	3.034	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)CCOc2ccccc2C)CC1	ZINC001113631798	1369531998	/nfs/dbraw/zinc/53/19/98/1369531998.db2.gz	LWUOTFHSWLUORK-GOSISDBHSA-N	0	3	330.472	3.263	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)Cn2ccc3ccccc32)CC1	ZINC001113644232	1369540860	/nfs/dbraw/zinc/54/08/60/1369540860.db2.gz	NAKSRPBHGFPSNS-QGZVFWFLSA-N	0	3	325.456	3.140	20	30		EGEDHN
CCCCCCCN1CCN(C(=O)c2ccccc2CN(C)C)CC1	ZINC001113680808	1369562400	/nfs/dbraw/zinc/56/24/00/1369562400.db2.gz	VFCBEUFSBUGFPW-UHFFFAOYSA-N	0	3	345.531	3.476	20	30		EGEDHN
CCCCCCCCN1C[C@@H]2[C@H](C1)OCCN2c1ccc(C)nn1	ZINC001201813615	1369627840	/nfs/dbraw/zinc/62/78/40/1369627840.db2.gz	HEHKHRCJXYPAOL-MSOLQXFVSA-N	0	3	332.492	3.035	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)N1CCC(NCc2oc(CC)nc2C)CC1	ZINC001202085389	1369684355	/nfs/dbraw/zinc/68/43/55/1369684355.db2.gz	TYOZMBOBIQJXIG-KBPBESRZSA-N	0	3	333.476	3.084	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)N1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001202101814	1369687831	/nfs/dbraw/zinc/68/78/31/1369687831.db2.gz	SZMZKYPYUWNWJT-HUUCEWRRSA-N	0	3	343.446	3.236	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC(NCC(=C)Br)CC1	ZINC001202108209	1369688658	/nfs/dbraw/zinc/68/86/58/1369688658.db2.gz	IIPXJBAEKKMVAA-LBPRGKRZSA-N	0	3	329.282	3.078	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1[C@H]2CN(Cc3cc(C(C)C)ccc3OC)C[C@H]21	ZINC001114026021	1369690607	/nfs/dbraw/zinc/69/06/07/1369690607.db2.gz	UVNHCILZWOHGCW-WGMWDUQUSA-N	0	3	342.483	3.331	20	30		EGEDHN
CC#CCNC[C@@H]1CN(C(=O)c2ccc([C@@H](C)CC)cc2)CCCO1	ZINC001202174537	1369707727	/nfs/dbraw/zinc/70/77/27/1369707727.db2.gz	VYJZBEWFZZXBBE-FXAWDEMLSA-N	0	3	342.483	3.044	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(NCC(=C)Br)CC2)CCC1	ZINC001202365025	1369751092	/nfs/dbraw/zinc/75/10/92/1369751092.db2.gz	FXUIXVYKYAJDBD-UHFFFAOYSA-N	0	3	341.293	3.222	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@H](NC(=O)CCC(C)C)C12CCC2	ZINC001202447570	1369774779	/nfs/dbraw/zinc/77/47/79/1369774779.db2.gz	JKAWJOYIXBQXAX-KGLIPLIRSA-N	0	3	343.309	3.348	20	30		EGEDHN
CC(C)C(=O)N[C@@H]1C[C@@H](NCC#Cc2cccc(Cl)c2)C12CCC2	ZINC001202459388	1369778387	/nfs/dbraw/zinc/77/83/87/1369778387.db2.gz	OKIPZIUPOYZPIL-QZTJIDSGSA-N	0	3	344.886	3.365	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@@H](NC(=O)CCCCC)C12CCC2	ZINC001202470228	1369781508	/nfs/dbraw/zinc/78/15/08/1369781508.db2.gz	PGCMYHLELAKANJ-ZIAGYGMSSA-N	0	3	343.309	3.492	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@@H](NCc2oc(CC)nc2C)C12CCC2	ZINC001202615953	1369825200	/nfs/dbraw/zinc/82/52/00/1369825200.db2.gz	CCRLXLQYGDXSAL-HZPDHXFCSA-N	0	3	331.460	3.029	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1C[C@@H](NCc2c(C)noc2C)C12CCC2	ZINC001202766683	1369884567	/nfs/dbraw/zinc/88/45/67/1369884567.db2.gz	WRGXBKOMIIMMJD-MSOLQXFVSA-N	0	3	343.471	3.002	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202786273	1369891563	/nfs/dbraw/zinc/89/15/63/1369891563.db2.gz	UKKABTSJJXIJPF-LEWJYISDSA-N	0	3	348.490	3.249	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1[C@H]2CN(Cc3cccc(OC(C)C)c3)C[C@H]21	ZINC001114349334	1369905496	/nfs/dbraw/zinc/90/54/96/1369905496.db2.gz	XBNUIKRQZFYWCW-KXTWHKPSSA-N	0	3	342.483	3.377	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1C[C@@H](NCc2ccncc2Cl)C12CCC2	ZINC001202844873	1369905723	/nfs/dbraw/zinc/90/57/23/1369905723.db2.gz	AEGGUSBXCJINGD-IAGOWNOFSA-N	0	3	345.874	3.056	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1C[C@@H](NCc2nc(C)c(C)s2)C12CCC2	ZINC001202844793	1369905793	/nfs/dbraw/zinc/90/57/93/1369905793.db2.gz	AAXXEUWFZMLMSX-CVEARBPZSA-N	0	3	345.512	3.080	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1C[C@@H](NCc2ccc(F)cc2F)C12CCC2	ZINC001202845188	1369906089	/nfs/dbraw/zinc/90/60/89/1369906089.db2.gz	BSPNUTSBHSYSMV-MSOLQXFVSA-N	0	3	346.421	3.285	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1C[C@H](NCc2cccc(F)c2F)C12CCC2	ZINC001202868113	1369913076	/nfs/dbraw/zinc/91/30/76/1369913076.db2.gz	VSVZLNYJOYGIMR-DLBZAZTESA-N	0	3	346.421	3.141	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1C[C@@H](NCc2ccccn2)C12CCC2	ZINC001202952289	1369934725	/nfs/dbraw/zinc/93/47/25/1369934725.db2.gz	VMQQSHGYDBGOJR-RTBURBONSA-N	0	3	339.483	3.367	20	30		EGEDHN
C=C(Br)CNC1CCN(C(=O)CC[C@H](C)CC)CC1	ZINC001203038412	1369963155	/nfs/dbraw/zinc/96/31/55/1369963155.db2.gz	RWTOYMHPEMVTTF-GFCCVEGCSA-N	0	3	331.298	3.302	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1C[C@@H](NCc2cncs2)C12CCC2	ZINC001203255500	1370043225	/nfs/dbraw/zinc/04/32/25/1370043225.db2.gz	BWGCKEUWGNFWLZ-CABCVRRESA-N	0	3	333.501	3.262	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1[C@H]2CN(CCCCC(F)(F)F)C[C@H]21	ZINC001114722409	1370045895	/nfs/dbraw/zinc/04/58/95/1370045895.db2.gz	HEHXIWOZYSSVGO-KBXIAJHMSA-N	0	3	332.410	3.368	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1C[C@H](NCc2ocnc2C)C12CCC2	ZINC001203258610	1370046267	/nfs/dbraw/zinc/04/62/67/1370046267.db2.gz	SPOWMCNYIHLTMP-JKSUJKDBSA-N	0	3	331.460	3.102	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1C[C@H](NCc2cncs2)C12CCC2	ZINC001203294557	1370066513	/nfs/dbraw/zinc/06/65/13/1370066513.db2.gz	CZOQLHVTDLDLHL-IRXDYDNUSA-N	0	3	345.512	3.244	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2[C@H]3CN(CCc4ccccc4F)C[C@H]32)CC1	ZINC001114795194	1370084802	/nfs/dbraw/zinc/08/48/02/1370084802.db2.gz	XUSVCOPYZXTHAG-DZFIZOCASA-N	0	3	342.458	3.161	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2C[C@H](NCc3ocnc3C)C23CCC3)CCC1	ZINC001203367768	1370101159	/nfs/dbraw/zinc/10/11/59/1370101159.db2.gz	VREMDWHGTNNEAO-DLBZAZTESA-N	0	3	343.471	3.246	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@@H](NCC#Cc3ccccc3)C23CCC3)C1	ZINC001203375084	1370104330	/nfs/dbraw/zinc/10/43/30/1370104330.db2.gz	OCUZESXVMDFBBV-UXHICEINSA-N	0	3	348.490	3.411	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)CCCc2cccnc2)C12CCC2	ZINC001203554327	1370167853	/nfs/dbraw/zinc/16/78/53/1370167853.db2.gz	BZRCIVYYSGSNBA-IRXDYDNUSA-N	0	3	347.890	3.174	20	30		EGEDHN
C#CCC1(C(=O)N2CCC(NCc3ocnc3C)CC2)CCCCC1	ZINC001204008648	1370347251	/nfs/dbraw/zinc/34/72/51/1370347251.db2.gz	YUAFISVMBCRLAS-UHFFFAOYSA-N	0	3	343.471	3.037	20	30		EGEDHN
CC(C)C#CC(=O)NCC1(NCc2ccncc2Cl)CCCCC1	ZINC001115522717	1370521670	/nfs/dbraw/zinc/52/16/70/1370521670.db2.gz	WMUFKAWCMMJTBS-UHFFFAOYSA-N	0	3	347.890	3.303	20	30		EGEDHN
CCc1onc(C)c1CNC1(CNC(=O)C#CC(C)C)CCCCC1	ZINC001115522820	1370521691	/nfs/dbraw/zinc/52/16/91/1370521691.db2.gz	YOAYJZKWDVGRCP-UHFFFAOYSA-N	0	3	345.487	3.114	20	30		EGEDHN
CN1CCN(Cc2ccc(Nc3ccc(F)c(C#N)c3F)cc2)CC1	ZINC001204751609	1370565515	/nfs/dbraw/zinc/56/55/15/1370565515.db2.gz	XFJUTBIIRGFOOZ-UHFFFAOYSA-N	0	3	342.393	3.327	20	30		EGEDHN
CCC[C@H](C)C(=O)N1CCC(CNCc2ccccc2C#N)CC1	ZINC001204828031	1370585637	/nfs/dbraw/zinc/58/56/37/1370585637.db2.gz	SWZXKDRPEQZZAY-INIZCTEOSA-N	0	3	327.472	3.323	20	30		EGEDHN
N[C@H]1CN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C[C@@H]1F	ZINC001204890081	1370597582	/nfs/dbraw/zinc/59/75/82/1370597582.db2.gz	BFFDYOBMJBTRNJ-QWRGUYRKSA-N	0	3	330.247	3.205	20	30		EGEDHN
C#CCCCCC(=O)N1CCC(CNCc2nc(C)c(C)s2)CC1	ZINC001205027692	1370633431	/nfs/dbraw/zinc/63/34/31/1370633431.db2.gz	XNBDARMDYMKUAB-UHFFFAOYSA-N	0	3	347.528	3.282	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCC1(NCc2nccnc2C)CCCCC1	ZINC001115685170	1370668393	/nfs/dbraw/zinc/66/83/93/1370668393.db2.gz	WMTDBZRICNBOJP-MRXNPFEDSA-N	0	3	344.503	3.296	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C(C)(C)C)CC[C@H]1c1ccc(F)cc1	ZINC001205319002	1370721264	/nfs/dbraw/zinc/72/12/64/1370721264.db2.gz	YTRICYWKVFCVHL-ZWKOTPCHSA-N	0	3	330.447	3.169	20	30		EGEDHN
COc1cc(C#N)c(F)cc1NC(=O)c1ccc(CN(C)C)cc1	ZINC001187295275	1388090719	/nfs/dbraw/zinc/09/07/19/1388090719.db2.gz	YDNWTZOTICQAPW-UHFFFAOYSA-N	0	3	327.359	3.020	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@@H](C)C2CCC2)C[C@H]1c1cccc(F)c1	ZINC001205416812	1370748674	/nfs/dbraw/zinc/74/86/74/1370748674.db2.gz	DNZWDPUPVSDONE-RYGJVYDSSA-N	0	3	342.458	3.169	20	30		EGEDHN
C#CCC1(C(=O)N2CCC(CNCc3ccccc3C#N)CC2)CCC1	ZINC001205451344	1370759783	/nfs/dbraw/zinc/75/97/83/1370759783.db2.gz	LFTKJLNQKGVDIU-UHFFFAOYSA-N	0	3	349.478	3.080	20	30		EGEDHN
CCOC[C@H]1COCCC12CCN(Cc1ccc(F)c(C#N)c1)CC2	ZINC001205473056	1370765815	/nfs/dbraw/zinc/76/58/15/1370765815.db2.gz	NYZREMBAXXLYAD-SFHVURJKSA-N	0	3	346.446	3.353	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@@H](C)CC(C)(C)C)[C@@H]3COC[C@@H]32)CC1	ZINC001205511818	1370776461	/nfs/dbraw/zinc/77/64/61/1370776461.db2.gz	INAXZUXIZFEEKS-OKZBNKHCSA-N	0	3	348.531	3.184	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)CCCCCC)[C@@H]3COC[C@@H]32)CC1	ZINC001205516630	1370778027	/nfs/dbraw/zinc/77/80/27/1370778027.db2.gz	NOHGAMGRSDKHPW-ZWKOTPCHSA-N	0	3	334.504	3.082	20	30		EGEDHN
CC(C)(C)N1CCN(c2c(C#N)cnc3c(F)ccc(F)c32)CC1	ZINC001116132108	1370844241	/nfs/dbraw/zinc/84/42/41/1370844241.db2.gz	SDLCQHJCCRDQHG-UHFFFAOYSA-N	0	3	330.382	3.305	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@@H](C)N1CCN(C(C)(C)C)CC1	ZINC001116324196	1370886408	/nfs/dbraw/zinc/88/64/08/1370886408.db2.gz	AVYJVDYSXSOJAC-MRXNPFEDSA-N	0	3	349.544	3.067	20	30		EGEDHN
CC[C@H](NCC(=O)NCc1cccc(C#N)c1)c1ccc(F)cc1	ZINC001116555266	1370935765	/nfs/dbraw/zinc/93/57/65/1370935765.db2.gz	CSQLKAHJEDKAOH-SFHVURJKSA-N	0	3	325.387	3.054	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N[C@@H]1CN(Cc2ccc(CC)cc2)C[C@H]1C	ZINC001206428746	1371052645	/nfs/dbraw/zinc/05/26/45/1371052645.db2.gz	DFKRLBZAOXOZTN-MBOZVWFJSA-N	0	3	344.499	3.167	20	30		EGEDHN
N#Cc1cc(C(=O)NC[C@H](c2ccccc2)N2CCCC2)cs1	ZINC001117777722	1371081867	/nfs/dbraw/zinc/08/18/67/1371081867.db2.gz	BXZUKXVEJKOBTH-QGZVFWFLSA-N	0	3	325.437	3.187	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cccnc1OC)[C@H]2CC	ZINC001206568456	1371094876	/nfs/dbraw/zinc/09/48/76/1371094876.db2.gz	MQYAUUKQUFNNTO-PXNSSMCTSA-N	0	3	343.471	3.012	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN[C@H]2CCOc3ccc(F)cc32)c1	ZINC001118087558	1371130218	/nfs/dbraw/zinc/13/02/18/1371130218.db2.gz	BYEQZGUYTPAKSO-KRWDZBQOSA-N	0	3	339.370	3.139	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CN(Cc2ccc(CC)cc2)C[C@H]1C	ZINC001206886263	1371207280	/nfs/dbraw/zinc/20/72/80/1371207280.db2.gz	ZOLFJJURYRAZJT-YLJYHZDGSA-N	0	3	326.484	3.379	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CN([C@@H]2CCc3ccc(F)cc32)C[C@H]1C	ZINC001206911630	1371220898	/nfs/dbraw/zinc/22/08/98/1371220898.db2.gz	WONGBCUAZGGTBF-NIKGAXFTSA-N	0	3	328.431	3.053	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H]2CN(Cc3cc(F)ccc3C)C[C@H]21	ZINC001187569495	1388126783	/nfs/dbraw/zinc/12/67/83/1388126783.db2.gz	ODSALHQPEGKHGF-FXAWDEMLSA-N	0	3	342.458	3.360	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1CN([C@@H](C)c2ccc3c(c2)CCC3)C[C@H]1C	ZINC001206947167	1371239686	/nfs/dbraw/zinc/23/96/86/1371239686.db2.gz	IOLXLKFKLCROTM-LLGFUMIMSA-N	0	3	338.495	3.332	20	30		EGEDHN
C[C@H](c1ccc2c(c1)CCC2)N1C[C@@H](C)[C@H](NC(=O)C#CC2CC2)C1	ZINC001206951671	1371243158	/nfs/dbraw/zinc/24/31/58/1371243158.db2.gz	DUEARUNXJNDOOT-WHSLLNHNSA-N	0	3	336.479	3.086	20	30		EGEDHN
O=C(CC1CCCC1)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207116180	1371297914	/nfs/dbraw/zinc/29/79/14/1371297914.db2.gz	ILNMJCZVTBFBIO-HXUWFJFHSA-N	0	3	342.458	3.338	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207116013	1371298318	/nfs/dbraw/zinc/29/83/18/1371298318.db2.gz	HDTHGCCYEOPATQ-SFHVURJKSA-N	0	3	332.875	3.318	20	30		EGEDHN
CCCCCCC(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001187580627	1388127500	/nfs/dbraw/zinc/12/75/00/1388127500.db2.gz	CVMISHMXUKGQAT-QGZVFWFLSA-N	0	3	331.435	3.358	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@@H](NCC#Cc2ccccc2Cl)C1	ZINC001207151259	1371311539	/nfs/dbraw/zinc/31/15/39/1371311539.db2.gz	LPLBOENOPMKGTR-QGZVFWFLSA-N	0	3	330.859	3.238	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H]2CN(Cc3ccc(F)cc3C)C[C@H]21	ZINC001187591461	1388128975	/nfs/dbraw/zinc/12/89/75/1388128975.db2.gz	MZOGYPAFQQGSPN-AZUAARDMSA-N	0	3	342.458	3.360	20	30		EGEDHN
O=C(c1ccsc1)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207214118	1371330802	/nfs/dbraw/zinc/33/08/02/1371330802.db2.gz	RVYWYEHEUVCCJS-SFHVURJKSA-N	0	3	342.439	3.133	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN(C[C@@H](OC)c2ccccc2)C[C@H]1C	ZINC001207215233	1371332245	/nfs/dbraw/zinc/33/22/45/1371332245.db2.gz	DNPQQTBPAUONCS-BHIYHBOVSA-N	0	3	330.472	3.167	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)CCOc2cc(C)cc(C)c2)C1	ZINC001207376253	1371379311	/nfs/dbraw/zinc/37/93/11/1371379311.db2.gz	JZFYULOWQOGANP-IEBWSBKVSA-N	0	3	330.472	3.085	20	30		EGEDHN
CC/C=C(/C)C(=O)N1CCC[C@H](NCc2cc(C#N)ccc2OC)C1	ZINC001207566595	1371437434	/nfs/dbraw/zinc/43/74/34/1371437434.db2.gz	ROKCHTWYBTVVDB-HMMSMWIJSA-N	0	3	341.455	3.004	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2coc(CCC)n2)CCCCC1	ZINC001119999294	1371449156	/nfs/dbraw/zinc/44/91/56/1371449156.db2.gz	UVZFUEJWTWQFFQ-UHFFFAOYSA-N	0	3	339.867	3.402	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H](NCc2cc(F)c(OC)c(F)c2)C1	ZINC001207653695	1371465584	/nfs/dbraw/zinc/46/55/84/1371465584.db2.gz	KAOHOVOYHPMLPV-AWEZNQCLSA-N	0	3	338.398	3.020	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)C[C@@H](C)[C@H]2CCCO2)CCCCC1	ZINC001120062462	1371474750	/nfs/dbraw/zinc/47/47/50/1371474750.db2.gz	NWKCEVFUEOCSCG-GDBMZVCRSA-N	0	3	342.911	3.353	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H](OC)C2CCCC2)CCCCC1	ZINC001120075373	1371479629	/nfs/dbraw/zinc/47/96/29/1371479629.db2.gz	YQOAOOMZAMUHPX-MRXNPFEDSA-N	0	3	342.911	3.353	20	30		EGEDHN
O=C(C1=CCCC1)N1CCC[C@@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207790014	1371505604	/nfs/dbraw/zinc/50/56/04/1371505604.db2.gz	QAYSYKNCAMHQNK-LJQANCHMSA-N	0	3	342.870	3.382	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)CCc2ccc(OCC)cc2)C1	ZINC001207834615	1371515036	/nfs/dbraw/zinc/51/50/36/1371515036.db2.gz	VTGTUPCLECHHND-VQIMIIECSA-N	0	3	330.472	3.031	20	30		EGEDHN
CC[C@@H](C)CC(=O)N1CCC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001207913626	1371537190	/nfs/dbraw/zinc/53/71/90/1371537190.db2.gz	CDGPXTBWIZLDEK-PBHICJAKSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H]([C@@H]2CCCN2Cc2nc(C)oc2C)C1	ZINC001120348581	1371543167	/nfs/dbraw/zinc/54/31/67/1371543167.db2.gz	YSSMJRDKYVLMDU-HKUYNNGSSA-N	0	3	345.487	3.461	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CCC[C@H](NCc2ccccc2Cl)C1	ZINC001208011195	1371567706	/nfs/dbraw/zinc/56/77/06/1371567706.db2.gz	XXBQNJOZANDMMQ-INIZCTEOSA-N	0	3	332.875	3.470	20	30		EGEDHN
O=C([C@@H]1C[C@@H]2C=C[C@H]1CC2)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001208090639	1371594304	/nfs/dbraw/zinc/59/43/04/1371594304.db2.gz	USJDBMRUAAECSF-CLAROIROSA-N	0	3	348.490	3.221	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC[C@@H](NCc2cc(C#N)ccc2OC)C1	ZINC001208256072	1371684684	/nfs/dbraw/zinc/68/46/84/1371684684.db2.gz	YBZFGQGUKIIZLK-GOSISDBHSA-N	0	3	341.455	3.004	20	30		EGEDHN
C#CCC1(C(=O)N2CCC[C@H](NCC=C(Cl)Cl)C2)CCC1	ZINC001208318775	1371715864	/nfs/dbraw/zinc/71/58/64/1371715864.db2.gz	HVGRVKJDSKTLTP-ZDUSSCGKSA-N	0	3	329.271	3.080	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CN(CCc2ccccc2F)C[C@H]1C	ZINC001208389152	1371748055	/nfs/dbraw/zinc/74/80/55/1371748055.db2.gz	ZMYWDOSTXFLFOZ-FRQCXROJSA-N	0	3	332.463	3.407	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1CN(CCOc2cccc(C)c2)C[C@H]1C	ZINC001208396557	1371752591	/nfs/dbraw/zinc/75/25/91/1371752591.db2.gz	YBUXOTQQCSDFOM-WSTZPKSXSA-N	0	3	344.499	3.413	20	30		EGEDHN
CC(F)(F)CCC(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001208444840	1371768542	/nfs/dbraw/zinc/76/85/42/1371768542.db2.gz	ZFPBAJYSTPYYML-QGZVFWFLSA-N	0	3	334.410	3.054	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN(C[C@@H](OC)c2ccccc2)C[C@H]1C	ZINC001208455646	1371772843	/nfs/dbraw/zinc/77/28/43/1371772843.db2.gz	YOPHOYOFFTYIEP-BHIYHBOVSA-N	0	3	330.472	3.167	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN(CCOc2ccccc2C)C[C@H]1C	ZINC001208458410	1371774589	/nfs/dbraw/zinc/77/45/89/1371774589.db2.gz	HYOTXVKUQVIFNQ-QZTJIDSGSA-N	0	3	330.472	3.167	20	30		EGEDHN
N#Cc1cccc(CCCN2CCN(c3nc4ccccc4o3)CC2)c1	ZINC001208852649	1371918250	/nfs/dbraw/zinc/91/82/50/1371918250.db2.gz	OXEUBTROOJOTDX-UHFFFAOYSA-N	0	3	346.434	3.454	20	30		EGEDHN
N#Cc1ccc(CCCN2CC[C@@H](N3CCCCC3)[C@@H](F)C2)cc1	ZINC001208863490	1371923513	/nfs/dbraw/zinc/92/35/13/1371923513.db2.gz	FHUXLWFHBLWXMS-VQTJNVASSA-N	0	3	329.463	3.389	20	30		EGEDHN
CC(C)(C)OC(=O)N1C[C@@H]2CCN(CCc3ccc(C#N)cc3)C[C@@H]21	ZINC001208925936	1371947598	/nfs/dbraw/zinc/94/75/98/1371947598.db2.gz	ZGNPRMQGIJSQGR-ROUUACIJSA-N	0	3	341.455	3.042	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)[C@@H](c2ccccc2)C(C)C)C1	ZINC001208944853	1371957422	/nfs/dbraw/zinc/95/74/22/1371957422.db2.gz	OZEBLZXMURWGHM-MISYRCLQSA-N	0	3	344.499	3.065	20	30		EGEDHN
C=CCn1c(Nc2cccc(OC)c2)nnc1[C@H]1CCCN(C)C1	ZINC001121495499	1371991898	/nfs/dbraw/zinc/99/18/98/1371991898.db2.gz	JHIVNJJCDGWZDF-AWEZNQCLSA-N	0	3	327.432	3.026	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC1CC2(CC(NCc3cnc(C)o3)C2)C1	ZINC001121616193	1372025890	/nfs/dbraw/zinc/02/58/90/1372025890.db2.gz	CNMYVMVETSCLPX-IZCUCQHTSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC1CC2(C1)CC(N[C@@H](C)c1cnccn1)C2	ZINC001121616611	1372026999	/nfs/dbraw/zinc/02/69/99/1372026999.db2.gz	MUWBGOMOZFGTAM-CZFKBKNTSA-N	0	3	342.487	3.157	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC1CC2(C1)CC(N[C@@H](C)c1cnccn1)C2	ZINC001121714074	1372057103	/nfs/dbraw/zinc/05/71/03/1372057103.db2.gz	USNUAFNFFHZPDG-TZGQCCDBSA-N	0	3	342.487	3.157	20	30		EGEDHN
N#Cc1ccc(N2CCN(CC3Cc4ccccc4C3)CC2)c(F)c1	ZINC001209322748	1372068335	/nfs/dbraw/zinc/06/83/35/1372068335.db2.gz	XKUMOERNIAVAOY-UHFFFAOYSA-N	0	3	335.426	3.234	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)C[C@@H](C)C2CCCCC2)C1	ZINC001209425038	1372102577	/nfs/dbraw/zinc/10/25/77/1372102577.db2.gz	OVQOISHTOFAOIK-ZHALLVOQSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCCCCCN1CCO[C@@H]2[C@@H](COc3ncccn3)CC[C@@H]21	ZINC001209427318	1372104031	/nfs/dbraw/zinc/10/40/31/1372104031.db2.gz	NWXBRIMKPQUDNK-FGTMMUONSA-N	0	3	331.460	3.081	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)N1CCC[C@@H]1c1cn(C)nc1C	ZINC001121925549	1372124857	/nfs/dbraw/zinc/12/48/57/1372124857.db2.gz	AKWJSENCMLJSNG-ZWKOTPCHSA-N	0	3	334.508	3.470	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N1CCC(OCc2ccccc2F)CC1	ZINC001122120730	1372180473	/nfs/dbraw/zinc/18/04/73/1372180473.db2.gz	PAYRNXJYYBZARE-GOSISDBHSA-N	0	3	334.435	3.017	20	30		EGEDHN
C#CCCN1C[C@@H](C)[C@H](NC(=O)[C@@H](CC)Cc2ccccc2C)C1	ZINC001210298294	1372318798	/nfs/dbraw/zinc/31/87/98/1372318798.db2.gz	OCVWSKVHISCMEG-WSTZPKSXSA-N	0	3	326.484	3.024	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)c2ccc(CC(C)C)cc2)C1	ZINC001210910531	1372451605	/nfs/dbraw/zinc/45/16/05/1372451605.db2.gz	RGUTXKKBZUPVFY-YLJYHZDGSA-N	0	3	344.499	3.138	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C2C(C)(C)C2(C)C)C[C@H]1c1ccccc1	ZINC001211567371	1372581230	/nfs/dbraw/zinc/58/12/30/1372581230.db2.gz	GJVPKISXXDCNRG-ZWKOTPCHSA-N	0	3	338.495	3.276	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2cc[nH]c2CCC)C[C@H]1c1ccccc1	ZINC001211655535	1372597027	/nfs/dbraw/zinc/59/70/27/1372597027.db2.gz	MIPSJMHDJCYBMN-PZJWPPBQSA-N	0	3	349.478	3.188	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)CC[C@H](C)CC)C[C@H]1c1ccccc1	ZINC001211695240	1372603027	/nfs/dbraw/zinc/60/30/27/1372603027.db2.gz	SBMUWFIDLXUAEH-YZGWKJHDSA-N	0	3	326.484	3.420	20	30		EGEDHN
C=CC[C@@H](C(=O)N1CC[C@@H](NCc2cccnc2C)C1)c1ccccc1	ZINC001188001643	1388209939	/nfs/dbraw/zinc/20/99/39/1388209939.db2.gz	FYGQQWRKQVYNNZ-NHCUHLMSSA-N	0	3	349.478	3.440	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C[C@@H](C)C(C)(C)C)C[C@H]1c1ccccc1	ZINC001211713293	1372606886	/nfs/dbraw/zinc/60/68/86/1372606886.db2.gz	HDSWKTWDQLPBMN-NZSAHSFTSA-N	0	3	326.484	3.276	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2ccccc2C)[C@H](OC)C1	ZINC001211780143	1372614637	/nfs/dbraw/zinc/61/46/37/1372614637.db2.gz	VGMUQMCLRCHAGU-RTBURBONSA-N	0	3	330.472	3.170	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](NCc2cccnc2)C1	ZINC001188010383	1388213674	/nfs/dbraw/zinc/21/36/74/1388213674.db2.gz	RWHVZLSBKUUZLS-LEWJYISDSA-N	0	3	349.478	3.207	20	30		EGEDHN
CCCCCCCC[C@@H](C)C(=O)N1CC[C@@H](NCC#CCOC)C1	ZINC001188015311	1388214662	/nfs/dbraw/zinc/21/46/62/1388214662.db2.gz	AVBXVWSKPJQPIU-RTBURBONSA-N	0	3	336.520	3.213	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2cscc2C(F)F)[C@H](OC)C1	ZINC001212290352	1372682672	/nfs/dbraw/zinc/68/26/72/1372682672.db2.gz	WTKGKAIOZLZPRQ-ZIAGYGMSSA-N	0	3	344.427	3.081	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN([C@@H](C)c2ccccc2C)C[C@H]1OC	ZINC001212346969	1372691758	/nfs/dbraw/zinc/69/17/58/1372691758.db2.gz	LYTOIBCZZMYZRV-QXAKKESOSA-N	0	3	330.472	3.228	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@@H](C)C(C)(C)C)[C@H](OC)C1	ZINC001212470069	1372711077	/nfs/dbraw/zinc/71/10/77/1372711077.db2.gz	UGVRWKNVVHKLMS-BRWVUGGUSA-N	0	3	326.525	3.454	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2ccc(CC)o2)[C@H](OC)C1	ZINC001212472498	1372712017	/nfs/dbraw/zinc/71/20/17/1372712017.db2.gz	VZOXNUAOHNNJOB-SJLPKXTDSA-N	0	3	336.476	3.241	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@@H]2C[C@H]2C(C)(C)C)[C@H](OC)C1	ZINC001213156173	1372849785	/nfs/dbraw/zinc/84/97/85/1372849785.db2.gz	MJTOVCLIKLNDGI-BRSBDYLESA-N	0	3	338.536	3.454	20	30		EGEDHN
N#Cc1sccc1C(=O)NCC1(N2CCSCC2)CCCCC1	ZINC001126128918	1372940346	/nfs/dbraw/zinc/94/03/46/1372940346.db2.gz	ILVMUMMSQNGRQG-UHFFFAOYSA-N	0	3	349.525	3.101	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)C[C@H](C)n2cccc2)[C@H](OC)C1	ZINC001213753489	1372956573	/nfs/dbraw/zinc/95/65/73/1372956573.db2.gz	IQBIHOFPYNUQMM-IPMKNSEASA-N	0	3	349.519	3.225	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2ccc(CC(C)C)cc2)[C@H](OC)C1	ZINC001213835554	1372968818	/nfs/dbraw/zinc/96/88/18/1372968818.db2.gz	DLOYZIMCUUSMOR-WOJBJXKFSA-N	0	3	344.499	3.280	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)[C@@H](CC=C)c2ccccc2)[C@H](OC)C1	ZINC001213895601	1372976291	/nfs/dbraw/zinc/97/62/91/1372976291.db2.gz	IYJLQXDLBFVVTN-XUVXKRRUSA-N	0	3	342.483	3.128	20	30		EGEDHN
C=CC[C@@H](C(=O)N[C@@H]1CN(CCCCC)C[C@H]1OC)c1ccccc1	ZINC001213895580	1372976445	/nfs/dbraw/zinc/97/64/45/1372976445.db2.gz	IJLYXXWSNLVASX-VAMGGRTRSA-N	0	3	344.499	3.352	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H]2CN(CCOCc3ccccc3)C[C@H]21	ZINC001188081005	1388237065	/nfs/dbraw/zinc/23/70/65/1388237065.db2.gz	UBDZMOLIAOYFHX-VQTJNVASSA-N	0	3	342.483	3.092	20	30		EGEDHN
CC(C)C#CC(=O)NCCNCc1ccccc1Oc1ccccc1	ZINC001126822648	1373036262	/nfs/dbraw/zinc/03/62/62/1373036262.db2.gz	FSGGQNGJLSYRHH-UHFFFAOYSA-N	0	3	336.435	3.344	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001214304172	1373040809	/nfs/dbraw/zinc/04/08/09/1373040809.db2.gz	KHWCFLWSWFALSU-CRAIPNDOSA-N	0	3	330.859	3.094	20	30		EGEDHN
CC(C)[C@@H](C)CC(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001214307722	1373042008	/nfs/dbraw/zinc/04/20/08/1373042008.db2.gz	LFXQGCWAUVICIJ-QMTMVMCOSA-N	0	3	345.462	3.316	20	30		EGEDHN
C[C@@H]1CN(C(=O)/C=C\C(C)(C)C)C[C@H]1NCC#Cc1ccc(F)cc1	ZINC001214356422	1373048546	/nfs/dbraw/zinc/04/85/46/1373048546.db2.gz	UELBMRUYPADFFW-GXXWZAHFSA-N	0	3	342.458	3.216	20	30		EGEDHN
CCC(=CC(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1)CC	ZINC001214435768	1373061112	/nfs/dbraw/zinc/06/11/12/1373061112.db2.gz	QYHKPPYHKINFMY-CXAGYDPISA-N	0	3	331.485	3.303	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](C)[C@H](N[C@@H](C)c2ccc(F)cc2F)C1	ZINC001214514068	1373072630	/nfs/dbraw/zinc/07/26/30/1373072630.db2.gz	LURHKMMCMBVTBD-QWQRMKEZSA-N	0	3	334.410	3.266	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@@H](C)[C@H](N[C@H](C)c2ccc(F)cc2F)C1	ZINC001214580146	1373084396	/nfs/dbraw/zinc/08/43/96/1373084396.db2.gz	TYRROUQPBNPZFO-HBUWYVDXSA-N	0	3	334.410	3.122	20	30		EGEDHN
COc1ncnc(Nc2cccc(CN3CCCCC3)c2F)c1C#N	ZINC001215676820	1373230700	/nfs/dbraw/zinc/23/07/00/1373230700.db2.gz	HPSGYOXCSKNNLJ-UHFFFAOYSA-N	0	3	341.390	3.225	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2OCCN(C(=O)C(F)=C3CCCC3)[C@H]2C1	ZINC001217631564	1373477999	/nfs/dbraw/zinc/47/79/99/1373477999.db2.gz	NVPVAEFSFIZOFN-HYVNUMGLSA-N	0	3	336.451	3.050	20	30		EGEDHN
C=CCOc1ccc(C(=O)NCCN[C@H](C)c2cccc(F)c2)cc1	ZINC001130371380	1373508619	/nfs/dbraw/zinc/50/86/19/1373508619.db2.gz	QBWKRSHQPCLNGQ-OAHLLOKOSA-N	0	3	342.414	3.471	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCO[C@@H]2CN(CCCC3CCC3)C[C@@H]21	ZINC001217989147	1373527982	/nfs/dbraw/zinc/52/79/82/1373527982.db2.gz	ZYKWQOGYAQDDSH-VQTJNVASSA-N	0	3	346.515	3.247	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCO[C@@H]2CN(CC/C=C\CCC)C[C@@H]21	ZINC001217997436	1373530219	/nfs/dbraw/zinc/53/02/19/1373530219.db2.gz	FIHXLPWGEAXCHH-ICUWKNINSA-N	0	3	334.504	3.247	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)C[C@H](C)CC(C)(C)C)C1	ZINC001130426947	1373534232	/nfs/dbraw/zinc/53/42/32/1373534232.db2.gz	KLUSSJNZQADTEN-JKSUJKDBSA-N	0	3	346.519	3.464	20	30		EGEDHN
N#Cc1cc(-c2ccc(Cl)cc2)cnc1O[C@@H]1CCNC[C@@H]1F	ZINC001218064585	1373550993	/nfs/dbraw/zinc/55/09/93/1373550993.db2.gz	NAAOKGBFUCHAGE-JKSUJKDBSA-N	0	3	331.778	3.352	20	30		EGEDHN
Fc1ccc(N=Cc2ccccc2O[C@@H]2CC[C@@H]3NCCO[C@@H]23)cc1	ZINC001218126823	1373565517	/nfs/dbraw/zinc/56/55/17/1373565517.db2.gz	INOWZJSNZPNJIV-DFQSSKMNSA-N	0	3	340.398	3.475	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cc(F)cc3ccoc32)s1	ZINC001130603513	1373569601	/nfs/dbraw/zinc/56/96/01/1373569601.db2.gz	GKVMURDDZMUFMI-UHFFFAOYSA-N	0	3	343.383	3.025	20	30		EGEDHN
CC(C)Cc1ccc(CC(=O)NCCNCc2ccc(C#N)cc2)cc1	ZINC001130987483	1373621383	/nfs/dbraw/zinc/62/13/83/1373621383.db2.gz	BPBMZDAVGRIKEI-UHFFFAOYSA-N	0	3	349.478	3.205	20	30		EGEDHN
CC#CCCCC(=O)N1CCO[C@@H]2CN(CCCCCCC)C[C@@H]21	ZINC001218504042	1373626620	/nfs/dbraw/zinc/62/66/20/1373626620.db2.gz	REWATQPHVWDGGY-RBUKOAKNSA-N	0	3	334.504	3.062	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCO[C@@H]2CN(CCCC3CCCC3)C[C@@H]21	ZINC001218517085	1373628080	/nfs/dbraw/zinc/62/80/80/1373628080.db2.gz	IULOFSVOADHARJ-YZGWKJHDSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCO[C@@H]2CN(CCCC3CCCC3)C[C@@H]21	ZINC001218522511	1373629699	/nfs/dbraw/zinc/62/96/99/1373629699.db2.gz	AQKWEKYCCNQSGT-YZGWKJHDSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)Nc1ncccc1OC(F)(F)F	ZINC001218651765	1373640386	/nfs/dbraw/zinc/64/03/86/1373640386.db2.gz	PQQRDWZNBATBSF-NSHDSACASA-N	0	3	331.338	3.383	20	30		EGEDHN
C=CC1(CC(=O)N2CCO[C@@H]3CN(CC4CCC4)C[C@@H]32)CCCCC1	ZINC001218775838	1373653826	/nfs/dbraw/zinc/65/38/26/1373653826.db2.gz	ISXMRJXKEOQZQK-RBUKOAKNSA-N	0	3	346.515	3.225	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)[C@H]3CC[C@H](C)CC3)[C@H]2C1	ZINC001218995288	1373676092	/nfs/dbraw/zinc/67/60/92/1373676092.db2.gz	BZCIHZDQGSAXDL-LWYYNNOASA-N	0	3	348.531	3.471	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2ccccc2C(C)C)[C@@H](O)C1	ZINC001219755776	1373730871	/nfs/dbraw/zinc/73/08/71/1373730871.db2.gz	LLVJJGLZEOKUDE-UXHICEINSA-N	0	3	344.499	3.331	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)O[C@@]2(CCN(Cc3ccccc3)C2)C1	ZINC001131666767	1373752251	/nfs/dbraw/zinc/75/22/51/1373752251.db2.gz	RQNOMGXRHFFNKP-WIYYLYMNSA-N	0	3	342.483	3.235	20	30		EGEDHN
Cc1cccc(C)c1CN1C[C@H](NC(=O)CSCC#N)CC[C@@H]1C	ZINC001131825213	1373824291	/nfs/dbraw/zinc/82/42/91/1373824291.db2.gz	IFNCZZRKIVSLLN-DLBZAZTESA-N	0	3	345.512	3.029	20	30		EGEDHN
Cc1ccc(CN2C[C@@H](NC(=O)CSCC#N)CC[C@@H]2C)cc1C	ZINC001131829312	1373827597	/nfs/dbraw/zinc/82/75/97/1373827597.db2.gz	DLOGKYWZSKHZFI-WMZOPIPTSA-N	0	3	345.512	3.029	20	30		EGEDHN
C=CCCOCC(=O)N1CC[C@@H](N[C@@H](C)c2ccccc2Cl)C1	ZINC001188301753	1388286321	/nfs/dbraw/zinc/28/63/21/1388286321.db2.gz	JYUPBHWOXSITIW-LSDHHAIUSA-N	0	3	336.863	3.184	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@@H](C)N(CCOc2ccc(C)cc2)C1	ZINC001131896876	1375033126	/nfs/dbraw/zinc/03/31/26/1375033126.db2.gz	WULUKBLEIKRTMS-QZTJIDSGSA-N	0	3	330.472	3.309	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@H](C)N(Cc2ccc(COC)cc2)C1	ZINC001132001936	1375092871	/nfs/dbraw/zinc/09/28/71/1375092871.db2.gz	FRUHEEDEARTSHX-FXAWDEMLSA-N	0	3	342.483	3.106	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NCC1CCN([C@H](C)c2ccccc2F)CC1	ZINC001225632130	1375135873	/nfs/dbraw/zinc/13/58/73/1375135873.db2.gz	YBFRSLZJZDMQJS-CVEARBPZSA-N	0	3	348.462	3.306	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COCc2ccc(C)cc2)CC[C@@H]1C	ZINC001132082397	1375137281	/nfs/dbraw/zinc/13/72/81/1375137281.db2.gz	GOGXSICELAYZSG-PKOBYXMFSA-N	0	3	330.472	3.057	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)C[C@@H](C)CC	ZINC001225898347	1375172106	/nfs/dbraw/zinc/17/21/06/1375172106.db2.gz	IAPGTPYWFZKETQ-IACUBPJLSA-N	0	3	331.298	3.348	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)C2CCC3(CC3)CC2)CC[C@@H]1C	ZINC001132173005	1375187960	/nfs/dbraw/zinc/18/79/60/1375187960.db2.gz	GAEKWKHKEUEDSA-FUHWJXTLSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CC[C@@H](C)N(Cc2ccccc2N(C)C)C1	ZINC001132217699	1375214697	/nfs/dbraw/zinc/21/46/97/1375214697.db2.gz	FYKASNJWQJJVCW-SJLPKXTDSA-N	0	3	343.515	3.434	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1CC[C@@H](C)N(CCOCC(C)C)C1	ZINC001132240363	1375234789	/nfs/dbraw/zinc/23/47/89/1375234789.db2.gz	FTVXQXKGAFGJQR-RTBURBONSA-N	0	3	336.520	3.212	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1CC[C@@H](C)N(CCOCCCC)C1	ZINC001132241100	1375236074	/nfs/dbraw/zinc/23/60/74/1375236074.db2.gz	QRDMOCIWVVGMMU-MOPGFXCFSA-N	0	3	336.520	3.356	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2CC[C@H](C)N(CCOCC3CC3)C2)CC1	ZINC001132277621	1375261201	/nfs/dbraw/zinc/26/12/01/1375261201.db2.gz	HVQMRPUDCIFWKH-FUHWJXTLSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CC[C@H](C)N(CCOCC(C)C)C2)CCC1	ZINC001132283179	1375266666	/nfs/dbraw/zinc/26/66/66/1375266666.db2.gz	TVZSNIVZFKKGSV-ZWKOTPCHSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2c(C)cccc2C)CC[C@@H]1C	ZINC001132322863	1375302046	/nfs/dbraw/zinc/30/20/46/1375302046.db2.gz	WFZUSAPYYCUXMW-ROUUACIJSA-N	0	3	330.472	3.089	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2cc3sccc3[nH]2)CC[C@@H]1C	ZINC001132403264	1375356438	/nfs/dbraw/zinc/35/64/38/1375356438.db2.gz	UKHRXIKELSTUMI-UONOGXRCSA-N	0	3	347.484	3.015	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2ccc(C)c(C)c2)CC[C@@H]1C	ZINC001132458840	1375401901	/nfs/dbraw/zinc/40/19/01/1375401901.db2.gz	YBBRTKQAKIBYIL-HKUYNNGSSA-N	0	3	330.472	3.089	20	30		EGEDHN
CCCc1ccc(CN2CCC(NC(=O)C#CC(C)C)CC2)cc1	ZINC001227244994	1375412148	/nfs/dbraw/zinc/41/21/48/1375412148.db2.gz	UHOABDDAJJODHV-UHFFFAOYSA-N	0	3	326.484	3.379	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COc2cc(C)cc(C)c2)CC[C@H]1C	ZINC001132486743	1375420181	/nfs/dbraw/zinc/42/01/81/1375420181.db2.gz	PECFOVSWJVLOQN-QZTJIDSGSA-N	0	3	330.472	3.227	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(OCCCC)cc2)CC[C@H]1C	ZINC001132487049	1375420548	/nfs/dbraw/zinc/42/05/48/1375420548.db2.gz	QXIMJHDQLQIGGW-IEBWSBKVSA-N	0	3	342.483	3.472	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)C23CCC(CC2)CC3)CC[C@@H]1C	ZINC001132501115	1375426904	/nfs/dbraw/zinc/42/69/04/1375426904.db2.gz	UWIZWIRLSOSNPB-FFEBTUMSSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)C2CCC(C)(C)CC2)CC[C@H]1C	ZINC001132522930	1375439461	/nfs/dbraw/zinc/43/94/61/1375439461.db2.gz	VEAMUESQJAQADK-AEFFLSMTSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2coc3ccccc32)CC[C@@H]1C	ZINC001132536461	1375445747	/nfs/dbraw/zinc/44/57/47/1375445747.db2.gz	AVLXOHIOCFZOTL-HOTGVXAUSA-N	0	3	342.439	3.218	20	30		EGEDHN
C=C(C)CCC(=O)NC1CCN(CCOCc2ccccc2)CC1	ZINC001227597095	1375449596	/nfs/dbraw/zinc/44/95/96/1375449596.db2.gz	SEZOCKAMBQIOTR-UHFFFAOYSA-N	0	3	330.472	3.140	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2(CCc3ccccc3)CC2)CC[C@@H]1C	ZINC001132551539	1375458210	/nfs/dbraw/zinc/45/82/10/1375458210.db2.gz	JAABMSDOJVLVFM-ICSRJNTNSA-N	0	3	338.495	3.392	20	30		EGEDHN
CC#CCN1CC[C@@H](CN(Cc2scnc2C)C(=O)[C@@H](C)CC)C1	ZINC001132559071	1375466822	/nfs/dbraw/zinc/46/68/22/1375466822.db2.gz	SNVMPAWEGQOCFY-DOTOQJQBSA-N	0	3	347.528	3.171	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCNCc1ccccc1C(F)(F)F	ZINC001132574296	1375471609	/nfs/dbraw/zinc/47/16/09/1375471609.db2.gz	ZALHGHPIEONDHC-CHWSQXEVSA-N	0	3	328.378	3.369	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CCCC[C@H]1NCc1c(C)noc1C	ZINC001227916711	1375491092	/nfs/dbraw/zinc/49/10/92/1375491092.db2.gz	GYYOWOOZKPOPHL-IAGOWNOFSA-N	0	3	333.476	3.411	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1CCCC[C@H]1NCc1cnoc1C	ZINC001227972511	1375495939	/nfs/dbraw/zinc/49/59/39/1375495939.db2.gz	ARXLOCNZIAWMDK-QZTJIDSGSA-N	0	3	331.460	3.084	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](C)[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001132696238	1375518159	/nfs/dbraw/zinc/51/81/59/1375518159.db2.gz	IJCGILVGXOOUCW-CRAIPNDOSA-N	0	3	343.446	3.238	20	30		EGEDHN
CC1(C(=O)N[C@@H]2CCCC[C@H]2NCC#Cc2ccccc2)CC=CC1	ZINC001228347719	1375551748	/nfs/dbraw/zinc/55/17/48/1375551748.db2.gz	SKAJHPWEUHWVRT-WOJBJXKFSA-N	0	3	336.479	3.411	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](C)[C@H](CNCc2csc(C)n2)C1	ZINC001132773708	1375556117	/nfs/dbraw/zinc/55/61/17/1375556117.db2.gz	OYDZAOHXCWGEIO-NVXWUHKLSA-N	0	3	347.528	3.219	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CCCC[C@H]2NCc2cncc(F)c2)CCC1	ZINC001228406585	1375566866	/nfs/dbraw/zinc/56/68/66/1375566866.db2.gz	MMXMAHDJSDZAOL-QZTJIDSGSA-N	0	3	345.462	3.484	20	30		EGEDHN
CC[C@@H](C#CC(=O)OC)Oc1ccc2ccccc2c1CN(C)C	ZINC001228442681	1375573039	/nfs/dbraw/zinc/57/30/39/1375573039.db2.gz	WDZIBBBWHVWDJZ-INIZCTEOSA-N	0	3	325.408	3.235	20	30		EGEDHN
CC(C)N1[C@@H]2CC[C@H]1C[C@@H](Oc1cccc3c1C(=O)C=CC3=O)C2	ZINC001228472109	1375576799	/nfs/dbraw/zinc/57/67/99/1375576799.db2.gz	CYRHMBVJSSSOSH-FICVDOATSA-N	0	3	325.408	3.404	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@H](C)[C@@H](CNCc2c(F)cccc2F)C1	ZINC001132810580	1375576985	/nfs/dbraw/zinc/57/69/85/1375576985.db2.gz	YGLCPJAGFZJQKZ-HOTGVXAUSA-N	0	3	348.437	3.198	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](C)[C@@H](CNCc2nccs2)C1	ZINC001132843202	1375595453	/nfs/dbraw/zinc/59/54/53/1375595453.db2.gz	JGNFDDHYMHUDDT-RDJZCZTQSA-N	0	3	347.528	3.486	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](C)[C@H](CNCc2nc(C)cs2)C1	ZINC001132864864	1375607834	/nfs/dbraw/zinc/60/78/34/1375607834.db2.gz	DGWHIVLRSQVQMV-GDBMZVCRSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC001228747463	1375661255	/nfs/dbraw/zinc/66/12/55/1375661255.db2.gz	BAAFOQKDNVFBBS-HOTGVXAUSA-N	0	3	330.472	3.234	20	30		EGEDHN
C=CCCCC(=O)NC1CCN(C[C@@H](OC)c2ccccc2)CC1	ZINC001228928130	1375718748	/nfs/dbraw/zinc/71/87/48/1375718748.db2.gz	WCNYSVOAUHZPCG-LJQANCHMSA-N	0	3	330.472	3.311	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](C)[C@@H](CNCc2ocnc2C)C1	ZINC001133039051	1375729795	/nfs/dbraw/zinc/72/97/95/1375729795.db2.gz	KDRRFLHGQREEFR-AEFFLSMTSA-N	0	3	345.487	3.141	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](C)[C@H](CNCc2csc(C)n2)C1	ZINC001133059310	1375750059	/nfs/dbraw/zinc/75/00/59/1375750059.db2.gz	OHBSLNYRCKLUCT-DOTOQJQBSA-N	0	3	347.528	3.219	20	30		EGEDHN
COc1cc2c(Cl)c(C#N)cnc2cc1O[C@@H]1CCCN(C)C1	ZINC001229106326	1375765255	/nfs/dbraw/zinc/76/52/55/1375765255.db2.gz	NDNHWCBXHCMFKB-GFCCVEGCSA-N	0	3	331.803	3.241	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](C)[C@@H](CNCc3cc(C)no3)C2)CC1	ZINC001133104827	1375777500	/nfs/dbraw/zinc/77/75/00/1375777500.db2.gz	KUMAZNJORGZEGL-WBVHZDCISA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)CC2(C=C)CCCCC2)CC1	ZINC001229574841	1375856453	/nfs/dbraw/zinc/85/64/53/1375856453.db2.gz	FTOBWPAZDRPRGS-UHFFFAOYSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)[C@@H](F)CC2CCCCC2)CC1	ZINC001230059693	1375939058	/nfs/dbraw/zinc/93/90/58/1375939058.db2.gz	OHBUZCZWZFNJSH-SFHVURJKSA-N	0	3	340.483	3.078	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)COc1ccc(C)cc1	ZINC001230072021	1375941149	/nfs/dbraw/zinc/94/11/49/1375941149.db2.gz	URQKSLCRHCBBTQ-IAGOWNOFSA-N	0	3	336.863	3.143	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1ccc(C)o1	ZINC001133382442	1375963662	/nfs/dbraw/zinc/96/36/62/1375963662.db2.gz	JDHWJBFXRKAZND-UHFFFAOYSA-N	0	3	330.815	3.107	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1ccc(C)o1	ZINC001133382316	1375963693	/nfs/dbraw/zinc/96/36/93/1375963693.db2.gz	BOMFLWLOPGUQAU-UHFFFAOYSA-N	0	3	344.842	3.497	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)CCC1CCC1	ZINC001133390880	1375975517	/nfs/dbraw/zinc/97/55/17/1375975517.db2.gz	NWQMYQNMGGGFQY-UHFFFAOYSA-N	0	3	332.875	3.472	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C1C=CC=CC=C1	ZINC001133398240	1375981962	/nfs/dbraw/zinc/98/19/62/1375981962.db2.gz	LUCKYMZENUSLMR-UHFFFAOYSA-N	0	3	340.854	3.190	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@H]1CCC1(C)C	ZINC001133401602	1375985724	/nfs/dbraw/zinc/98/57/24/1375985724.db2.gz	IQLYGYFKEDUNDF-QGZVFWFLSA-N	0	3	332.875	3.328	20	30		EGEDHN
C#CCCN(CCCNC(=O)C(C)(C)C(=C)Cl)Cc1cccnc1	ZINC001230769289	1376145982	/nfs/dbraw/zinc/14/59/82/1376145982.db2.gz	ISKJGDAPAWUFKH-UHFFFAOYSA-N	0	3	347.890	3.192	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)c1ccc(Cl)o1	ZINC001133682711	1376151158	/nfs/dbraw/zinc/15/11/58/1376151158.db2.gz	CABNBYBOOXGVCS-UWVGGRQHSA-N	0	3	349.656	3.328	20	30		EGEDHN
C#CCCN(CCCNC(=O)C(C)(C)CCC)Cc1cccnc1	ZINC001230829642	1376162006	/nfs/dbraw/zinc/16/20/06/1376162006.db2.gz	KICOCIZPBDJGNA-UHFFFAOYSA-N	0	3	329.488	3.240	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCCN(Cc1cccnc1)C[C@H](C)OC	ZINC001230838769	1376163883	/nfs/dbraw/zinc/16/38/83/1376163883.db2.gz	UPQJSWGOZYJJHU-FXAWDEMLSA-N	0	3	347.503	3.027	20	30		EGEDHN
C=CCOc1cccc(CN2CCC(N(C(C)=O)C(C)C)CC2)c1	ZINC001231624069	1376284849	/nfs/dbraw/zinc/28/48/49/1376284849.db2.gz	GGKBWYRPMATQGU-UHFFFAOYSA-N	0	3	330.472	3.473	20	30		EGEDHN
C=CCOc1cccc(CN2CCC(NC(=O)N3CCCC3)CC2)c1	ZINC001231624552	1376285352	/nfs/dbraw/zinc/28/53/52/1376285352.db2.gz	PLDDLGSBKHEFMH-UHFFFAOYSA-N	0	3	343.471	3.021	20	30		EGEDHN
C=CCOc1cccc(CN2CCCN(c3ccc(C#N)cn3)CC2)c1	ZINC001231624998	1376285923	/nfs/dbraw/zinc/28/59/23/1376285923.db2.gz	JSHKEESDRAYERV-UHFFFAOYSA-N	0	3	348.450	3.230	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)CCC1CC1)NCc1cc(F)ccc1C#N	ZINC001133960861	1376285910	/nfs/dbraw/zinc/28/59/10/1376285910.db2.gz	SJMPFOKNOFIADO-KGLIPLIRSA-N	0	3	331.435	3.260	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H]2CN(C[C@H](OC)c3ccccc3)C[C@H]21	ZINC001189006286	1388434913	/nfs/dbraw/zinc/43/49/13/1388434913.db2.gz	BKKLPYFSWTWDAB-ZCNNSNEGSA-N	0	3	342.483	3.263	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)C1CC=CC1)NCc1cc(F)ccc1C#N	ZINC001133980154	1376296009	/nfs/dbraw/zinc/29/60/09/1376296009.db2.gz	UDEJAHKHEZNMJA-KGLIPLIRSA-N	0	3	329.419	3.036	20	30		EGEDHN
C#CCCCCC(=O)N[C@H](C)C[C@H](C)NCc1ccncc1Cl	ZINC001134115572	1376375422	/nfs/dbraw/zinc/37/54/22/1376375422.db2.gz	UOJXAHVZQXJZBX-LSDHHAIUSA-N	0	3	335.879	3.302	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H](C)C[C@H](C)NCc1ccncc1Cl	ZINC001134115570	1376375654	/nfs/dbraw/zinc/37/56/54/1376375654.db2.gz	UOJXAHVZQXJZBX-GJZGRUSLSA-N	0	3	335.879	3.302	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H](C)C[C@@H](C)NCc1nc(C)sc1C	ZINC001134119171	1376377138	/nfs/dbraw/zinc/37/71/38/1376377138.db2.gz	MSWVOXYNFDMHFE-KGLIPLIRSA-N	0	3	335.517	3.326	20	30		EGEDHN
C#CCCCCC(=O)N[C@H](C)C[C@H](C)NCc1oc(CC)nc1C	ZINC001134119601	1376378688	/nfs/dbraw/zinc/37/86/88/1376378688.db2.gz	UKEZHJILJJTVQN-LSDHHAIUSA-N	0	3	333.476	3.112	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)C#CC1CC1)NCc1nc(C(C)(C)C)cs1	ZINC001134321543	1376475329	/nfs/dbraw/zinc/47/53/29/1376475329.db2.gz	ITZZJJURWKJMLG-ZIAGYGMSSA-N	0	3	347.528	3.227	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1cccc(F)c1Cl)NC(=O)C#CC1CC1	ZINC001134321662	1376475592	/nfs/dbraw/zinc/47/55/92/1376475592.db2.gz	KPCBGDXWRSYXDM-QWHCGFSZSA-N	0	3	336.838	3.265	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)C#CC1CC1)NCc1nc(C(C)(C)C)cs1	ZINC001134321540	1376475643	/nfs/dbraw/zinc/47/56/43/1376475643.db2.gz	ITZZJJURWKJMLG-KBPBESRZSA-N	0	3	347.528	3.227	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)C#CC1CC1)NCc1cc(F)ccc1Cl	ZINC001134329987	1376480004	/nfs/dbraw/zinc/48/00/04/1376480004.db2.gz	UDMFYGNUGWWROZ-CHWSQXEVSA-N	0	3	336.838	3.265	20	30		EGEDHN
Cc1nc(C(C)C)oc1CN[C@@H](C)C[C@@H](C)NC(=O)C#CC(C)C	ZINC001134341139	1376484699	/nfs/dbraw/zinc/48/46/99/1376484699.db2.gz	KIVJAEWWTPKDHW-LSDHHAIUSA-N	0	3	333.476	3.139	20	30		EGEDHN
C[N@H+](Cc1cc(C#N)ccc1[O-])C1CCN(C2CCCCC2)CC1	ZINC001232680348	1376499841	/nfs/dbraw/zinc/49/98/41/1376499841.db2.gz	CNPJHAPLVKRUFY-UHFFFAOYSA-N	0	3	327.472	3.493	20	30		EGEDHN
C[N@@H+](Cc1cc(C#N)ccc1[O-])C1CCN(C2CCCCC2)CC1	ZINC001232680348	1376499843	/nfs/dbraw/zinc/49/98/43/1376499843.db2.gz	CNPJHAPLVKRUFY-UHFFFAOYSA-N	0	3	327.472	3.493	20	30		EGEDHN
Cc1ccc(CN2CCN3C[C@@H](Oc4ccccc4)C[C@H]3C2)c(C#N)c1	ZINC001232966644	1376549819	/nfs/dbraw/zinc/54/98/19/1376549819.db2.gz	UXHUMWSRKJHEDL-UNMCSNQZSA-N	0	3	347.462	3.204	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cc(F)cnc1C)[C@H]2CC	ZINC001232985878	1376551824	/nfs/dbraw/zinc/55/18/24/1376551824.db2.gz	DOPBZAZMEYOWLT-ICSRJNTNSA-N	0	3	345.462	3.451	20	30		EGEDHN
Cc1noc([C@H]2CC[C@@H]3[C@@H](CCN3Cc3ccc(C#N)cc3C)O2)n1	ZINC001233080144	1376566799	/nfs/dbraw/zinc/56/67/99/1376566799.db2.gz	TVXJHEKDSKSDEZ-KZNAEPCWSA-N	0	3	338.411	3.053	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@H]1CCN(Cc1cnc(C)c(C)c1)C2	ZINC001233158232	1376576231	/nfs/dbraw/zinc/57/62/31/1376576231.db2.gz	DODSFOWXVYFHQP-PMACEKPBSA-N	0	3	330.472	3.272	20	30		EGEDHN
COc1ccc(C#N)c(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)c1	ZINC001189094963	1388456489	/nfs/dbraw/zinc/45/64/89/1388456489.db2.gz	ATFWGPYTOVILEO-FQEVSTJZSA-N	0	3	349.434	3.134	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)C12CCC(CC1)C2	ZINC001134737000	1376688512	/nfs/dbraw/zinc/68/85/12/1376688512.db2.gz	MJKAKXVJFFAPLU-NNNQGMHWSA-N	0	3	343.309	3.348	20	30		EGEDHN
Cc1ccccc1CCCN1CC[C@@H]1CN(C)C(=O)C#CC(C)C	ZINC001234170006	1376783418	/nfs/dbraw/zinc/78/34/18/1376783418.db2.gz	HDCJKAVHHUDFSR-HXUWFJFHSA-N	0	3	326.484	3.120	20	30		EGEDHN
CCCCCCCN1CC[C@H]1CN(C)C(=O)[C@@H]1CCCc2cn[nH]c21	ZINC001234322094	1376807566	/nfs/dbraw/zinc/80/75/66/1376807566.db2.gz	FSZDKGPZPMFTSC-ZWKOTPCHSA-N	0	3	346.519	3.333	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H](C)C[C@H](C)NCC(=C)Br)cc1	ZINC001135184402	1376957515	/nfs/dbraw/zinc/95/75/15/1376957515.db2.gz	HFYWECVYDQKZKI-UONOGXRCSA-N	0	3	349.272	3.063	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H](C)C[C@H](C)NCc1ccncc1Cl	ZINC001135234509	1376990668	/nfs/dbraw/zinc/99/06/68/1376990668.db2.gz	AUBIPRUUAUWZBA-GJZGRUSLSA-N	0	3	335.879	3.302	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N[C@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001135242591	1376997800	/nfs/dbraw/zinc/99/78/00/1376997800.db2.gz	BOOBTKNCWCRUEO-IYLRHEGRSA-N	0	3	325.456	3.454	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)C1(CC)CCC1	ZINC001135256771	1377006700	/nfs/dbraw/zinc/00/67/00/1377006700.db2.gz	WPANUGADZSWIJF-QWHCGFSZSA-N	0	3	331.298	3.348	20	30		EGEDHN
CCC1(C(=O)N[C@H]2CCC[C@@H](NCc3ccccc3C#N)C2)CC1	ZINC001266066678	1377180992	/nfs/dbraw/zinc/18/09/92/1377180992.db2.gz	FAZHGOOIDLJYMI-MSOLQXFVSA-N	0	3	325.456	3.265	20	30		EGEDHN
CC(C)[C@H]1CC[C@H](C(=O)NCCNCc2ccc(C#N)s2)CC1	ZINC001135733702	1377196815	/nfs/dbraw/zinc/19/68/15/1377196815.db2.gz	CKTAWQLTTOUTGN-SHTZXODSSA-N	0	3	333.501	3.288	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)C(C1CC1)C1CC1)NCc1ccccc1C#N	ZINC001135904290	1377256168	/nfs/dbraw/zinc/25/61/68/1377256168.db2.gz	AMPFCXHABISNGV-GJZGRUSLSA-N	0	3	339.483	3.367	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](CNC(=O)CCCC3CC3)C2)cc1	ZINC001266525673	1377326168	/nfs/dbraw/zinc/32/61/68/1377326168.db2.gz	LHPWPOHVQILLQC-IBGZPJMESA-N	0	3	325.456	3.077	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CC[C@@H](N(C)C/C=C\c2ccccc2)C1	ZINC001189243338	1388494374	/nfs/dbraw/zinc/49/43/74/1388494374.db2.gz	VATFCKZBMVVPMV-JXYKKQOOSA-N	0	3	342.483	3.214	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)CC(F)(F)F)CCCC[C@@H]1C	ZINC001267868488	1377475935	/nfs/dbraw/zinc/47/59/35/1377475935.db2.gz	MKEAZDZDZKOXFV-GWCFXTLKSA-N	0	3	326.790	3.346	20	30		EGEDHN
CCN(CCN(C)C(=O)OC(C)(C)C)Cc1ccc(OCC#N)cc1	ZINC001137121521	1377482557	/nfs/dbraw/zinc/48/25/57/1377482557.db2.gz	PCQQIODRNYUQAN-UHFFFAOYSA-N	0	3	347.459	3.278	20	30		EGEDHN
C=CCO[C@H]1CO[C@]2(C1)CCCN(Cc1cc3ccccc3[nH]1)C2	ZINC001137317807	1377517438	/nfs/dbraw/zinc/51/74/38/1377517438.db2.gz	SSVTVLWHELTPIB-QUCCMNQESA-N	0	3	326.440	3.494	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)[C@H]2CCCc3cccnc32)CCCC1	ZINC001269571872	1377558959	/nfs/dbraw/zinc/55/89/59/1377558959.db2.gz	BCSAMFFPMZNZDT-INIZCTEOSA-N	0	3	347.890	3.273	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)[C@@H]2CCCc3cccnc32)CCCC1	ZINC001269571873	1377559092	/nfs/dbraw/zinc/55/90/92/1377559092.db2.gz	BCSAMFFPMZNZDT-MRXNPFEDSA-N	0	3	347.890	3.273	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cccc(OC)n1)[C@H]2CC	ZINC001137530106	1377561911	/nfs/dbraw/zinc/56/19/11/1377561911.db2.gz	XSGXRCDBVQTZQU-PXNSSMCTSA-N	0	3	343.471	3.012	20	30		EGEDHN
N#Cc1cccc(N2CCN(Cc3cccc4ncccc34)CC2)c1	ZINC001137630545	1377575434	/nfs/dbraw/zinc/57/54/34/1377575434.db2.gz	COEWHEXOMYKMBU-UHFFFAOYSA-N	0	3	328.419	3.429	20	30		EGEDHN
CN(c1ccc(C#N)cc1)c1ccc(CN2CC[C@@H](F)[C@@H](O)C2)cc1	ZINC001137899635	1377641182	/nfs/dbraw/zinc/64/11/82/1377641182.db2.gz	BDDYOFSXLMJCDI-UXHICEINSA-N	0	3	339.414	3.231	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@@H](C)[C@](O)(C(F)(F)F)C2)c1[O-]	ZINC001138624344	1377756013	/nfs/dbraw/zinc/75/60/13/1377756013.db2.gz	DYHZKMPKCSLKLH-WBMJQRKESA-N	0	3	329.362	3.256	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@@H](C)[C@](O)(C(F)(F)F)C2)c1[O-]	ZINC001138624344	1377756016	/nfs/dbraw/zinc/75/60/16/1377756016.db2.gz	DYHZKMPKCSLKLH-WBMJQRKESA-N	0	3	329.362	3.256	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@H](NC(=O)OC(C)(C)C)C2)c1[O-]	ZINC001138626289	1377756152	/nfs/dbraw/zinc/75/61/52/1377756152.db2.gz	DZOBCIUGPGRXKX-INIZCTEOSA-N	0	3	332.444	3.220	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@H](NC(=O)OC(C)(C)C)C2)c1[O-]	ZINC001138626289	1377756153	/nfs/dbraw/zinc/75/61/53/1377756153.db2.gz	DZOBCIUGPGRXKX-INIZCTEOSA-N	0	3	332.444	3.220	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2C[C@H]3CN(C(=O)OC(C)(C)C)[C@H]3C2)c1[O-]	ZINC001138629527	1377756808	/nfs/dbraw/zinc/75/68/08/1377756808.db2.gz	BVZWGOYYABVCLU-IRXDYDNUSA-N	0	3	344.455	3.172	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2C[C@H]3CN(C(=O)OC(C)(C)C)[C@H]3C2)c1[O-]	ZINC001138629527	1377756809	/nfs/dbraw/zinc/75/68/09/1377756809.db2.gz	BVZWGOYYABVCLU-IRXDYDNUSA-N	0	3	344.455	3.172	20	30		EGEDHN
CC[C@@H]1N(Cc2ccc(C#N)c(F)c2)CCC[C@]12CCC(=O)N2C	ZINC001139527733	1377897201	/nfs/dbraw/zinc/89/72/01/1377897201.db2.gz	IPROXFWESQNGEE-HKUYNNGSSA-N	0	3	329.419	3.063	20	30		EGEDHN
CCCN(Cc1cccc(Cl)c1C#N)C1CCN(C(C)=O)CC1	ZINC001139692123	1377936451	/nfs/dbraw/zinc/93/64/51/1377936451.db2.gz	NXNXMYSZSHHBSH-UHFFFAOYSA-N	0	3	333.863	3.435	20	30		EGEDHN
COC(=O)c1cccc2[nH]cc(CN(C)Cc3ccc(C#N)cc3)c21	ZINC001139718758	1377941066	/nfs/dbraw/zinc/94/10/66/1377941066.db2.gz	BMNHUCJOQQFNKZ-UHFFFAOYSA-N	0	3	333.391	3.458	20	30		EGEDHN
CC(=O)N1CCCCC12CCN(Cc1ccc(C)c(C#N)c1)CC2	ZINC001139723643	1377941508	/nfs/dbraw/zinc/94/15/08/1377941508.db2.gz	CPPITAZJBUBWJA-UHFFFAOYSA-N	0	3	325.456	3.234	20	30		EGEDHN
Cn1ncc2ccc(CN3CCC[C@@H](Oc4cccc(C#N)c4)C3)cc21	ZINC001139907030	1377975074	/nfs/dbraw/zinc/97/50/74/1377975074.db2.gz	BPFUOFGOSWPWQT-HXUWFJFHSA-N	0	3	346.434	3.488	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CCN(Cc3ccc(C)nc3)C2)C1	ZINC001139929247	1377978606	/nfs/dbraw/zinc/97/86/06/1377978606.db2.gz	SVTGZXGWHILTPF-IBGZPJMESA-N	0	3	329.444	3.001	20	30		EGEDHN
Cc1nccnc1O[C@H]1CCCN(Cc2c[nH]c3ccc(C#N)cc23)C1	ZINC001140117816	1378012923	/nfs/dbraw/zinc/01/29/23/1378012923.db2.gz	ZEWLVQNXNSSRJK-KRWDZBQOSA-N	0	3	347.422	3.181	20	30		EGEDHN
CCN1CCN(c2ccc(CN(CC#N)Cc3ccccc3)cc2)CC1	ZINC001140305722	1378043063	/nfs/dbraw/zinc/04/30/63/1378043063.db2.gz	HENIQZMESKKFRG-UHFFFAOYSA-N	0	3	348.494	3.354	20	30		EGEDHN
Cn1cnc2cc(CN3CCC[C@@H](Oc4cccc(C#N)c4)C3)ccc21	ZINC001140508699	1378076185	/nfs/dbraw/zinc/07/61/85/1378076185.db2.gz	OIYUVXBYKNWGKU-LJQANCHMSA-N	0	3	346.434	3.488	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3ccc(OC)cc3F)CC2)C1=O	ZINC001272668576	1378078149	/nfs/dbraw/zinc/07/81/49/1378078149.db2.gz	QMLPXVIMIZLCSF-FQEVSTJZSA-N	0	3	346.446	3.225	20	30		EGEDHN
CC1(C(=O)NCC2(NCc3ccc(F)c(C#N)c3)CCC2)CCC1	ZINC001273133671	1378089006	/nfs/dbraw/zinc/08/90/06/1378089006.db2.gz	LXHVSNISAJWMNK-UHFFFAOYSA-N	0	3	329.419	3.016	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)CCc1scnc1C)C1CC1	ZINC001753525620	1440429469	/nfs/dbraw/zinc/42/94/69/1440429469.db2.gz	DXIBKLQBBBJYKW-INIZCTEOSA-N	0	3	341.908	3.011	20	30		EGEDHN
CCCCN1CC[C@@]2(CCN(Cc3ccc(C#N)c(Cl)c3)C2)C1=O	ZINC001274492227	1378128290	/nfs/dbraw/zinc/12/82/90/1378128290.db2.gz	IMOJZIUZTGYDMR-LJQANCHMSA-N	0	3	345.874	3.436	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@]3(C2)C(=O)Nc2ccccc23)c1Cl	ZINC001140813449	1378149423	/nfs/dbraw/zinc/14/94/23/1378149423.db2.gz	IPIUXHPOBSJPQP-LJQANCHMSA-N	0	3	337.810	3.307	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1cccc2nc[nH]c21	ZINC001275726223	1378154729	/nfs/dbraw/zinc/15/47/29/1378154729.db2.gz	UKKWQXNPGLXUHT-UHFFFAOYSA-N	0	3	334.851	3.003	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CCN(Cc3[nH]cc(C)c3C)C2)C1	ZINC001140855749	1378159445	/nfs/dbraw/zinc/15/94/45/1378159445.db2.gz	BJRURFOIYOMNFR-LJQANCHMSA-N	0	3	331.460	3.242	20	30		EGEDHN
Cn1cc(CN2CC[C@H]3[C@@H]2CCN3c2ccc(F)c(F)c2)cc1C#N	ZINC001276937288	1378194398	/nfs/dbraw/zinc/19/43/98/1378194398.db2.gz	VBENNBLAHSYHCA-OALUTQOASA-N	0	3	342.393	3.028	20	30		EGEDHN
N#Cc1ccccc1OC1CCN(Cc2ccnc3[nH]ccc32)CC1	ZINC001142882560	1378503687	/nfs/dbraw/zinc/50/36/87/1378503687.db2.gz	RIRTVMHYDBFMJD-UHFFFAOYSA-N	0	3	332.407	3.478	20	30		EGEDHN
N#Cc1ccccc1O[C@@H]1CCCN(Cc2ccnc3[nH]ccc32)C1	ZINC001142882340	1378503922	/nfs/dbraw/zinc/50/39/22/1378503922.db2.gz	KTFQCIQMKBIBFO-QGZVFWFLSA-N	0	3	332.407	3.478	20	30		EGEDHN
N#Cc1ccc2c(CN3CCCC[C@@](O)(C(F)(F)F)C3)c[nH]c2c1	ZINC001142911875	1378507952	/nfs/dbraw/zinc/50/79/52/1378507952.db2.gz	MQPARAKUOMOGRI-INIZCTEOSA-N	0	3	337.345	3.319	20	30		EGEDHN
N#Cc1ccc2c(CN3CCN(Cc4ccccc4)CC3)c[nH]c2c1	ZINC001142915449	1378508396	/nfs/dbraw/zinc/50/83/96/1378508396.db2.gz	ANWHTMHNZSTKJZ-UHFFFAOYSA-N	0	3	330.435	3.357	20	30		EGEDHN
N#Cc1ccc2c(CN3CC[C@@H](N4CCCCC4)[C@@H](F)C3)c[nH]c2c1	ZINC001142929776	1378511500	/nfs/dbraw/zinc/51/15/00/1378511500.db2.gz	FSMRZMKTUOXWKF-AZUAARDMSA-N	0	3	340.446	3.438	20	30		EGEDHN
COc1ccc(CN2CCC3SC(=O)C=C3C2)c(C(F)(F)F)c1	ZINC001143476858	1378601946	/nfs/dbraw/zinc/60/19/46/1378601946.db2.gz	WSIIQXBEGRWIKB-AWEZNQCLSA-N	0	3	343.370	3.488	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3cc(Cl)cc(OC)c3)C2)C1=O	ZINC001144480835	1378735901	/nfs/dbraw/zinc/73/59/01/1378735901.db2.gz	JEBLTYCQEXJXEQ-LJQANCHMSA-N	0	3	348.874	3.349	20	30		EGEDHN
C#Cc1ccc(CN2CCC3(CC2)Cc2ccccc2CNC3=O)cc1	ZINC001144571610	1378745671	/nfs/dbraw/zinc/74/56/71/1378745671.db2.gz	CPNMBSADFGEUFR-UHFFFAOYSA-N	0	3	344.458	3.123	20	30		EGEDHN
C#Cc1ccc(CN(C)C[C@H]2CN(Cc3ccccc3)CCO2)cc1	ZINC001144578734	1378747599	/nfs/dbraw/zinc/74/75/99/1378747599.db2.gz	LAIMBNHKAFUHDS-QFIPXVFZSA-N	0	3	334.463	3.001	20	30		EGEDHN
C#Cc1ccc(CN2CCC(c3nc(C(=O)OCC)co3)CC2)cc1	ZINC001144578317	1378747610	/nfs/dbraw/zinc/74/76/10/1378747610.db2.gz	AALPUUPXVWPGIW-UHFFFAOYSA-N	0	3	338.407	3.212	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2cnc(C)o2)CCCCC1	ZINC001146699024	1378899416	/nfs/dbraw/zinc/89/94/16/1378899416.db2.gz	BQPBUQBJOMURPW-CVEARBPZSA-N	0	3	345.487	3.330	20	30		EGEDHN
CN(C(=O)C1CC(C)(C)C1)[C@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001283500931	1378989339	/nfs/dbraw/zinc/98/93/39/1378989339.db2.gz	AIXANKWVOFPZLH-QGZVFWFLSA-N	0	3	345.512	3.383	20	30		EGEDHN
CCCC[C@@H](C)C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001147467185	1379027097	/nfs/dbraw/zinc/02/70/97/1379027097.db2.gz	CZJIBOUSPSDADK-QGZVFWFLSA-N	0	3	339.483	3.419	20	30		EGEDHN
C[C@H](CN(C)C(=O)CC(C)(C)C1CC1)NCc1ccc(C#N)s1	ZINC001283605905	1379048379	/nfs/dbraw/zinc/04/83/79/1379048379.db2.gz	MATXZFWJHVMQHA-CYBMUJFWSA-N	0	3	333.501	3.383	20	30		EGEDHN
C=C(C)CCC(=O)N1CC2(C1)CCN(CCO[C@@H]1CCCC[C@@H]1C)C2	ZINC001147657892	1379056547	/nfs/dbraw/zinc/05/65/47/1379056547.db2.gz	GRUYMIBMYNSETR-RBUKOAKNSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)N1CC2(C1)CCN(Cc1cccc(OC)c1)C2	ZINC001148088639	1379115326	/nfs/dbraw/zinc/11/53/26/1379115326.db2.gz	OQXYJDNULMEDAD-IRXDYDNUSA-N	0	3	342.483	3.188	20	30		EGEDHN
CC[C@@H](C)CCC(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001148484089	1379184009	/nfs/dbraw/zinc/18/40/09/1379184009.db2.gz	ACMOUNLTUVNSPH-QGZVFWFLSA-N	0	3	339.483	3.419	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2c(F)cccc2Cl)cc1F	ZINC001148757389	1379262366	/nfs/dbraw/zinc/26/23/66/1379262366.db2.gz	MXZZUHJOEZPSJE-UHFFFAOYSA-N	0	3	349.768	3.009	20	30		EGEDHN
C=CCC1(C(=O)N2CC3(C2)CCN(CCOCC2CC2)C3)CCCC1	ZINC001148935284	1379299917	/nfs/dbraw/zinc/29/99/17/1379299917.db2.gz	NLRAODRBLAOCDT-UHFFFAOYSA-N	0	3	346.515	3.084	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@H]1CN([C@@H](C)c2ccccc2)CCCO1	ZINC001150084764	1379491893	/nfs/dbraw/zinc/49/18/93/1379491893.db2.gz	GYJMSVQOWARYQM-WMZOPIPTSA-N	0	3	330.472	3.167	20	30		EGEDHN
C=CCCCC(=O)NC[C@H]1CN(Cc2ccc(C)cc2)CCCO1	ZINC001150224400	1379518316	/nfs/dbraw/zinc/51/83/16/1379518316.db2.gz	LBCUQWDJAQZMTC-IBGZPJMESA-N	0	3	330.472	3.058	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@H]2CN(Cc3cccc(C)c3)CCCO2)C1	ZINC001150281910	1379527684	/nfs/dbraw/zinc/52/76/84/1379527684.db2.gz	FLGRBOWHKBDGDJ-LJQANCHMSA-N	0	3	342.483	3.058	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)CC/C=C\c2ccccc2)C1	ZINC001150318703	1379533389	/nfs/dbraw/zinc/53/33/89/1379533389.db2.gz	UDQOWMFJQYMFDW-QLQLNADESA-N	0	3	342.483	3.263	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)[C@@H](CC)CC2CCCC2)C1	ZINC001150402098	1379547091	/nfs/dbraw/zinc/54/70/91/1379547091.db2.gz	ABFICEUQTDOJKJ-RBUKOAKNSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)[C@@H](C)c2ccc(CC)cc2)C1	ZINC001150444053	1379553333	/nfs/dbraw/zinc/55/33/33/1379553333.db2.gz	CMVAUPLTOFVFAO-FXAWDEMLSA-N	0	3	344.499	3.136	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)C[C@@H](CC)c2ccccc2)C1	ZINC001150579131	1379572788	/nfs/dbraw/zinc/57/27/88/1379572788.db2.gz	KMKDSHYHDYOTHN-QUCCMNQESA-N	0	3	344.499	3.354	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2cc(F)ccc2CC)CC1	ZINC001151187365	1379673889	/nfs/dbraw/zinc/67/38/89/1379673889.db2.gz	QBDKVPUBUHTEKM-UHFFFAOYSA-N	0	3	348.462	3.175	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@H](C)c2ccc(C)cc2)CC1	ZINC001151399125	1379710994	/nfs/dbraw/zinc/71/09/94/1379710994.db2.gz	PPQSMYDJJZCJSL-GOSISDBHSA-N	0	3	344.499	3.272	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2ccc(C3CC3)cc2)CC1	ZINC001151410205	1379713459	/nfs/dbraw/zinc/71/34/59/1379713459.db2.gz	UZFXAPWJZDWIET-UHFFFAOYSA-N	0	3	342.483	3.351	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)C[C@@H]1C=CCC1	ZINC001151807340	1379787408	/nfs/dbraw/zinc/78/74/08/1379787408.db2.gz	ZLFFVVCGTNWAEX-HZPDHXFCSA-N	0	3	343.446	3.380	20	30		EGEDHN
CCCCCCCC[C@@H](C)C(=O)NCCN[C@H](CCCC)C(N)=O	ZINC001151847909	1379798422	/nfs/dbraw/zinc/79/84/22/1379798422.db2.gz	BZULRJORWTZTQT-IAGOWNOFSA-N	0	3	341.540	3.123	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)c1occc1C	ZINC001151892797	1379812388	/nfs/dbraw/zinc/81/23/88/1379812388.db2.gz	BSLBLLJLUHLONF-OAHLLOKOSA-N	0	3	325.412	3.100	20	30		EGEDHN
C=CCC1(C(=O)NCCNCc2cccc(C#N)c2)CCCCC1	ZINC001152010999	1379839235	/nfs/dbraw/zinc/83/92/35/1379839235.db2.gz	VXZHBQOSEBXSKU-UHFFFAOYSA-N	0	3	325.456	3.291	20	30		EGEDHN
CC(C)(C)[C@@H](CNCc1ccc(C#N)s1)NC(=O)Cc1ccoc1	ZINC001284577515	1379981302	/nfs/dbraw/zinc/98/13/02/1379981302.db2.gz	RHOFQBBFUBZJSU-MRXNPFEDSA-N	0	3	345.468	3.076	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1oc2c(cccc2F)c1C	ZINC001153828638	1380138835	/nfs/dbraw/zinc/13/88/35/1380138835.db2.gz	PFZHPYWKWRBZTM-CYBMUJFWSA-N	0	3	330.403	3.344	20	30		EGEDHN
Cc1ccc(CCCC(=O)NCCNCc2cccc(C#N)c2)s1	ZINC001153882888	1380149199	/nfs/dbraw/zinc/14/91/99/1380149199.db2.gz	QOXPRKIJSLNUTD-UHFFFAOYSA-N	0	3	341.480	3.157	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)cc1	ZINC001154742381	1380344058	/nfs/dbraw/zinc/34/40/58/1380344058.db2.gz	FFRPFZUQUCMPKB-IAGOWNOFSA-N	0	3	327.472	3.487	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H](C)N(CC)C[C@H](O)c1ccc(CC)cc1	ZINC001154957583	1380381120	/nfs/dbraw/zinc/38/11/20/1380381120.db2.gz	IQEGNCPKHBZEHI-XLIONFOSSA-N	0	3	346.515	3.465	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@H](C)CCc1ccccc1F	ZINC001155193172	1380422547	/nfs/dbraw/zinc/42/25/47/1380422547.db2.gz	GRPHNUFUUNDIHB-IAGOWNOFSA-N	0	3	332.463	3.244	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)[C@@H](C)c1ccco1	ZINC001155199825	1380423852	/nfs/dbraw/zinc/42/38/52/1380423852.db2.gz	KREDKBZIJJWXJB-CVEARBPZSA-N	0	3	339.439	3.282	20	30		EGEDHN
CCCCC[C@@H](C(=O)NC[C@@H](C)N(CC)CC#CCOC)C(C)C	ZINC001156276682	1380552101	/nfs/dbraw/zinc/55/21/01/1380552101.db2.gz	GUEJDLCYBWUFDM-RTBURBONSA-N	0	3	338.536	3.315	20	30		EGEDHN
CCC1(C(=O)N[C@@H]2CCN(Cc3ccc(C#N)cc3)CC2(C)C)CC1	ZINC001328101692	1388673484	/nfs/dbraw/zinc/67/34/84/1388673484.db2.gz	HLKFVEBQSFCZBR-GOSISDBHSA-N	0	3	339.483	3.465	20	30		EGEDHN
CN1CCC[C@H]2CN(c3nc4cc(F)ccc4c(Cl)c3C#N)C[C@@H]21	ZINC001157281755	1380831985	/nfs/dbraw/zinc/83/19/85/1380831985.db2.gz	IACVLOGPWWDZFH-ZBEGNZNMSA-N	0	3	344.821	3.429	20	30		EGEDHN
CC(C)C#CC(=O)NCCCNCc1nc(C2CCCCC2)cs1	ZINC001157639023	1380988323	/nfs/dbraw/zinc/98/83/23/1380988323.db2.gz	VEJVZXIZTQNAKL-UHFFFAOYSA-N	0	3	347.528	3.446	20	30		EGEDHN
N#Cc1ccc2c(c1)CCN(C(=O)[C@@H]1CCC[C@H](c3ccccc3)N1)C2	ZINC001157936433	1381075296	/nfs/dbraw/zinc/07/52/96/1381075296.db2.gz	FYRCXKXFCFJCSR-RTWAWAEBSA-N	0	3	345.446	3.326	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H](C)Oc1ccccc1F	ZINC001157994809	1381096646	/nfs/dbraw/zinc/09/66/46/1381096646.db2.gz	VTIJTIYAPSXORV-JKSUJKDBSA-N	0	3	334.435	3.092	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H]1CCN(C)c2ccccc21	ZINC001158096576	1381126412	/nfs/dbraw/zinc/12/64/12/1381126412.db2.gz	IHKBGZZUGLAILP-MJGOQNOKSA-N	0	3	341.499	3.109	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1CCN(C)c2ccccc21	ZINC001158096575	1381126714	/nfs/dbraw/zinc/12/67/14/1381126714.db2.gz	IHKBGZZUGLAILP-IEBWSBKVSA-N	0	3	341.499	3.109	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)CCc1cccc(OC)c1	ZINC001158212278	1381160890	/nfs/dbraw/zinc/16/08/90/1381160890.db2.gz	HZSXUCUOGGDIQA-GOSISDBHSA-N	0	3	330.472	3.127	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1C[C@]1(C)c1ccccc1	ZINC001158254006	1381174728	/nfs/dbraw/zinc/17/47/28/1381174728.db2.gz	CTBDNKMTERCNJA-SVFBPWRDSA-N	0	3	326.484	3.463	20	30		EGEDHN
CC#CCCCC(=O)N1CCCC[C@@H]1CN(C)C[C@H]1CCCCO1	ZINC001158357435	1381215634	/nfs/dbraw/zinc/21/56/34/1381215634.db2.gz	HODAIKHENWFBKM-RTBURBONSA-N	0	3	334.504	3.062	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCCC[C@@H]1CN(C)CCOC1CCC1	ZINC001158369531	1381220074	/nfs/dbraw/zinc/22/00/74/1381220074.db2.gz	IZANLVQMZPMOGW-QZTJIDSGSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCCCC(=O)N1CCCC[C@@H]1CN(C)C[C@H]1CC(C)(C)CO1	ZINC001158418926	1381239642	/nfs/dbraw/zinc/23/96/42/1381239642.db2.gz	DCVOCHWQCQQEOW-QZTJIDSGSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cnn(CCC(C)C)c1C	ZINC001158723550	1381369034	/nfs/dbraw/zinc/36/90/34/1381369034.db2.gz	CPNXZFGUEPHZIY-GOSISDBHSA-N	0	3	346.519	3.350	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)Cc1ccc2c(c1)CCC2	ZINC001158847226	1381430962	/nfs/dbraw/zinc/43/09/62/1381430962.db2.gz	LNVHZXUYDKTGIR-HXUWFJFHSA-N	0	3	326.484	3.217	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc(OCC)c(OC)c1	ZINC001158847320	1381431012	/nfs/dbraw/zinc/43/10/12/1381431012.db2.gz	OZCRKFBBARIYCB-QGZVFWFLSA-N	0	3	346.471	3.206	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)CC(F)(F)C(F)(F)F	ZINC001158961891	1381486302	/nfs/dbraw/zinc/48/63/02/1381486302.db2.gz	AVKMISRTUUTDEN-LLVKDONJSA-N	0	3	328.325	3.073	20	30		EGEDHN
CCCc1ccc(C(=O)NCCCNCc2ccccc2C#N)s1	ZINC001158965915	1381489594	/nfs/dbraw/zinc/48/95/94/1381489594.db2.gz	MJPGCHKNOPHWHH-UHFFFAOYSA-N	0	3	341.480	3.482	20	30		EGEDHN
C=CCCC(=O)NCCC1=CCN(CCc2csc(C)n2)CC1	ZINC001159544612	1381823938	/nfs/dbraw/zinc/82/39/38/1381823938.db2.gz	VCMLOBGYGLSROY-UHFFFAOYSA-N	0	3	333.501	3.099	20	30		EGEDHN
Cc1ccc(F)cc1CN1CC=C(CCNC(=O)C#CC(C)C)CC1	ZINC001160054922	1381983005	/nfs/dbraw/zinc/98/30/05/1381983005.db2.gz	MQZKPHHNMGXPHO-UHFFFAOYSA-N	0	3	342.458	3.432	20	30		EGEDHN
CC(C)C#CC(=O)NCCC1=CCN(C/C=C\c2ccccc2)CC1	ZINC001160055025	1381983418	/nfs/dbraw/zinc/98/34/18/1381983418.db2.gz	RDHTVLSYDPKACZ-TWGQIWQCSA-N	0	3	336.479	3.498	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H](CC)OC2CCCCC2)CC1	ZINC001160131807	1382009270	/nfs/dbraw/zinc/00/92/70/1382009270.db2.gz	WCSAXOQERXSAIO-IBGZPJMESA-N	0	3	334.504	3.439	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2nsc3ccccc32)CC1	ZINC001160227964	1382040497	/nfs/dbraw/zinc/04/04/97/1382040497.db2.gz	HCTGDJAKVHECQO-UHFFFAOYSA-N	0	3	339.464	3.072	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CCOc2c(C)cccc2C)CC1	ZINC001160286450	1382061793	/nfs/dbraw/zinc/06/17/93/1382061793.db2.gz	QJUYUHOJNOPJSA-UHFFFAOYSA-N	0	3	342.483	3.397	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H]2CCc3cc(C)ccc3O2)CC1	ZINC001160687598	1382171987	/nfs/dbraw/zinc/17/19/87/1382171987.db2.gz	CCSPZPFSQFUPGI-FQEVSTJZSA-N	0	3	340.467	3.013	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc(C)c3cccnc23)CC1	ZINC001160699306	1382173427	/nfs/dbraw/zinc/17/34/27/1382173427.db2.gz	FPSOXYBZQSBZPW-UHFFFAOYSA-N	0	3	335.451	3.481	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc(-c3cccs3)on2)CC1	ZINC001160810204	1382204102	/nfs/dbraw/zinc/20/41/02/1382204102.db2.gz	KSYYSJKDGSPGQA-UHFFFAOYSA-N	0	3	343.452	3.341	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCC1=CCN(CCc2ccns2)CC1	ZINC001160856098	1382217304	/nfs/dbraw/zinc/21/73/04/1382217304.db2.gz	FTESCSUVNASYRW-UHFFFAOYSA-N	0	3	347.528	3.426	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCC1=CCN(CCc2csc(C)n2)CC1	ZINC001160888337	1382225970	/nfs/dbraw/zinc/22/59/70/1382225970.db2.gz	OWOSPOPEVWALOL-UHFFFAOYSA-N	0	3	347.528	3.345	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCC1=CCN(Cc2ncccc2C)CC1	ZINC001160941793	1382244507	/nfs/dbraw/zinc/24/45/07/1382244507.db2.gz	PZHGHAZISSVGBE-WMZOPIPTSA-N	0	3	341.499	3.487	20	30		EGEDHN
Cc1coc(C(=O)NCCC2=CCN(Cc3ccc(C#N)cc3)CC2)c1	ZINC001160973426	1382258671	/nfs/dbraw/zinc/25/86/71/1382258671.db2.gz	VHVPHUUVAXAPMI-UHFFFAOYSA-N	0	3	349.434	3.412	20	30		EGEDHN
CC[C@H]1CCC[C@@]1(C)C(=O)NCCCNCc1ccccc1C#N	ZINC001160978428	1382259799	/nfs/dbraw/zinc/25/97/99/1382259799.db2.gz	IJOASIWFADIJIK-AZUAARDMSA-N	0	3	327.472	3.371	20	30		EGEDHN
CC[C@H]1CCC[C@]1(C)C(=O)NCCCNCc1ccccc1C#N	ZINC001160978430	1382259831	/nfs/dbraw/zinc/25/98/31/1382259831.db2.gz	IJOASIWFADIJIK-ICSRJNTNSA-N	0	3	327.472	3.371	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H]2CC[C@@H](C(F)(F)F)C2)CC1	ZINC001161019247	1382274813	/nfs/dbraw/zinc/27/48/13/1382274813.db2.gz	AKKBVYVIJYQFAU-HUUCEWRRSA-N	0	3	330.394	3.289	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H]2C[C@@]23CCc2ccccc23)CC1	ZINC001161616226	1382460365	/nfs/dbraw/zinc/46/03/65/1382460365.db2.gz	GSPSTBCRQXVBFS-IFMALSPDSA-N	0	3	336.479	3.215	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cccc(-c3cnco3)c2)CC1	ZINC001161621929	1382462706	/nfs/dbraw/zinc/46/27/06/1382462706.db2.gz	GQIGWODHJSHVHJ-UHFFFAOYSA-N	0	3	349.434	3.117	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ncccc2C(F)(F)F)CC1	ZINC001161639955	1382466967	/nfs/dbraw/zinc/46/69/67/1382466967.db2.gz	LRVUWRZRSVYZDG-UHFFFAOYSA-N	0	3	339.361	3.038	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccnc(O[C@@H](C)CC)c2)CC1	ZINC001161668412	1382475232	/nfs/dbraw/zinc/47/52/32/1382475232.db2.gz	AFADAZRKYDJWDD-INIZCTEOSA-N	0	3	343.471	3.197	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cccc(C(F)F)c2)CC1	ZINC001161750038	1382494729	/nfs/dbraw/zinc/49/47/29/1382494729.db2.gz	UPTUMDJBOPGOHC-UHFFFAOYSA-N	0	3	332.394	3.400	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H](C)c2cccc(OC)c2)CC1	ZINC001161952989	1382569927	/nfs/dbraw/zinc/56/99/27/1382569927.db2.gz	OCSQVZFEAVRJLL-MRXNPFEDSA-N	0	3	328.456	3.123	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cnc(CC(C)C)s2)CC1	ZINC001161987372	1382590694	/nfs/dbraw/zinc/59/06/94/1382590694.db2.gz	XPACXOZSNIGWLY-UHFFFAOYSA-N	0	3	345.512	3.117	20	30		EGEDHN
N#Cc1cccc(CNCCN(CCc2ccccc2)C(=O)C2CC2)c1	ZINC001162655505	1382822319	/nfs/dbraw/zinc/82/23/19/1382822319.db2.gz	OIKUKDYEKQJVEL-UHFFFAOYSA-N	0	3	347.462	3.129	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)[C@@H]1CCc2c1cccc2Cl	ZINC001162658417	1382824390	/nfs/dbraw/zinc/82/43/90/1382824390.db2.gz	VICHREXFDYQHBU-CQSZACIVSA-N	0	3	327.255	3.218	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)c1c(C)coc1C	ZINC001162797504	1382875463	/nfs/dbraw/zinc/87/54/63/1382875463.db2.gz	BKUFRTMNBQRRSA-UHFFFAOYSA-N	0	3	338.451	3.194	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C[C@@H]1CCC[C@H]1C	ZINC001162822440	1382887034	/nfs/dbraw/zinc/88/70/34/1382887034.db2.gz	QKKXOVMPGMTWMB-QUCCMNQESA-N	0	3	326.484	3.107	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@](C)(F)CCCC	ZINC001162847750	1382893572	/nfs/dbraw/zinc/89/35/72/1382893572.db2.gz	BBDCJUCIONMQEA-FQEVSTJZSA-N	0	3	332.463	3.199	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)Cc1cccc(CC)c1	ZINC001162851748	1382895180	/nfs/dbraw/zinc/89/51/80/1382895180.db2.gz	VKZPFNNASBGHQP-UHFFFAOYSA-N	0	3	348.490	3.086	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CC[C@@H]2C[C@@H]2C1	ZINC001162852066	1382895406	/nfs/dbraw/zinc/89/54/06/1382895406.db2.gz	YZFDIDYQRCROCZ-NJDAHSKKSA-N	0	3	338.495	3.107	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@H]1Cc2ccccc21	ZINC001162911413	1382913649	/nfs/dbraw/zinc/91/36/49/1382913649.db2.gz	MFDVTIVORYTFND-QFIPXVFZSA-N	0	3	346.474	3.011	20	30		EGEDHN
N=C(Nc1cccc(N2CCC2=O)c1)c1ccc(C(F)(F)F)cc1	ZINC001163683776	1383105340	/nfs/dbraw/zinc/10/53/40/1383105340.db2.gz	HZQBRHWQUMALMP-UHFFFAOYSA-N	0	3	333.313	3.479	20	30		EGEDHN
C#CCCCCC(=O)NCCC1(CNCc2ccncc2Cl)CC1	ZINC001164166223	1383162208	/nfs/dbraw/zinc/16/22/08/1383162208.db2.gz	SDOJEXBMNVTOKV-UHFFFAOYSA-N	0	3	347.890	3.305	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)c2ccoc2C2CC2)c1	ZINC001164604318	1383206211	/nfs/dbraw/zinc/20/62/11/1383206211.db2.gz	IOYUNZVUCXSRLJ-UHFFFAOYSA-N	0	3	341.386	3.077	20	30		EGEDHN
N#Cc1cnc(N2C[C@H]3CCN(Cc4ccccc4)[C@H]3C2)c(Cl)c1	ZINC001165082056	1383224654	/nfs/dbraw/zinc/22/46/54/1383224654.db2.gz	ANTONCCNERKNST-AEFFLSMTSA-N	0	3	338.842	3.317	20	30		EGEDHN
C[C@@H]1CCCC[C@@H]1C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001165411627	1383290310	/nfs/dbraw/zinc/29/03/10/1383290310.db2.gz	VCNAPGNYHMWXDN-PBHICJAKSA-N	0	3	331.435	3.120	20	30		EGEDHN
CC(F)(F)CCC(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001165805616	1383347335	/nfs/dbraw/zinc/34/73/35/1383347335.db2.gz	SQFBPDSAFUTXEM-UHFFFAOYSA-N	0	3	349.425	3.370	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)CCc2nc(C)cs2)CC1	ZINC001166174024	1383398809	/nfs/dbraw/zinc/39/88/09/1383398809.db2.gz	PXYMLUPFPYRUCK-UHFFFAOYSA-N	0	3	341.908	3.013	20	30		EGEDHN
Cc1cocc1C(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001166618349	1383448224	/nfs/dbraw/zinc/44/82/24/1383448224.db2.gz	OYZSHANSONWQBJ-UHFFFAOYSA-N	0	3	337.423	3.150	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)[C@H]2CCC2(C)C)CC1	ZINC001166729975	1383468241	/nfs/dbraw/zinc/46/82/41/1383468241.db2.gz	UASXVGRKMMMMFC-CYBMUJFWSA-N	0	3	343.309	3.207	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCCC1(CNCc2cc(OC)ccn2)CC1	ZINC001166755170	1383472622	/nfs/dbraw/zinc/47/26/22/1383472622.db2.gz	FVHFRDHDNCMXMQ-INIZCTEOSA-N	0	3	345.487	3.069	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C[C@@H](C)C(F)(F)F)CC1	ZINC001166946098	1383503688	/nfs/dbraw/zinc/50/36/88/1383503688.db2.gz	XHUJEWKBSPAYQT-SNVBAGLBSA-N	0	3	326.790	3.204	20	30		EGEDHN
C=CCCCC(=O)NCCC1(CNCC(=C)Br)CC1	ZINC001166910529	1383498490	/nfs/dbraw/zinc/49/84/90/1383498490.db2.gz	XFDFDVWSYWJZPJ-UHFFFAOYSA-N	0	3	329.282	3.127	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2c(F)cc(F)cc2F)CC1	ZINC001166940949	1383502440	/nfs/dbraw/zinc/50/24/40/1383502440.db2.gz	ZUUKZXPRZUQEGS-UHFFFAOYSA-N	0	3	346.780	3.346	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCC1(CNCc2ccc(F)cn2)CC1	ZINC001167339832	1383602629	/nfs/dbraw/zinc/60/26/29/1383602629.db2.gz	OJORHCSNXRHEFG-UHFFFAOYSA-N	0	3	333.451	3.199	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)CO[C@@H]2CCCC[C@@H]2C)CC1	ZINC001167370029	1383612287	/nfs/dbraw/zinc/61/22/87/1383612287.db2.gz	DHTNWCZBMGRDGI-GOEBONIOSA-N	0	3	342.911	3.210	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)COCCCCCC)CC1	ZINC001167881728	1383765194	/nfs/dbraw/zinc/76/51/94/1383765194.db2.gz	RNJKCCHTAILZJF-UHFFFAOYSA-N	0	3	330.900	3.212	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cc3[nH]ccc3s2)CC1	ZINC001167909583	1383768699	/nfs/dbraw/zinc/76/86/99/1383768699.db2.gz	LLXDBGHWQAMKEG-UHFFFAOYSA-N	0	3	337.876	3.472	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@H](C)Oc2ccccc2)CC1	ZINC001167965735	1383780508	/nfs/dbraw/zinc/78/05/08/1383780508.db2.gz	ADFSFZXXAJCBEH-HNNXBMFYSA-N	0	3	336.863	3.083	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)CCOc2ccccc2)CC1	ZINC001168096883	1383816027	/nfs/dbraw/zinc/81/60/27/1383816027.db2.gz	SNDKTKAVGPWMOM-UHFFFAOYSA-N	0	3	336.863	3.084	20	30		EGEDHN
C=CC1(CC(=O)NCCCNCc2conc2CC)CCCCC1	ZINC001168183111	1383837307	/nfs/dbraw/zinc/83/73/07/1383837307.db2.gz	YHBYMBAWLRDJBA-UHFFFAOYSA-N	0	3	333.476	3.360	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1ccc(C(F)F)cc1	ZINC001168493706	1383923174	/nfs/dbraw/zinc/92/31/74/1383923174.db2.gz	PFDMWXSLRVSKNI-UHFFFAOYSA-N	0	3	347.203	3.242	20	30		EGEDHN
C[C@H]1C[C@@H](NCc2ccc(C#N)c(F)c2)CN1C(=O)OC(C)(C)C	ZINC001168821592	1384019067	/nfs/dbraw/zinc/01/90/67/1384019067.db2.gz	FBBJXRGWECBKLM-SWLSCSKDSA-N	0	3	333.407	3.185	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)c1ccco1	ZINC001168830027	1384023536	/nfs/dbraw/zinc/02/35/36/1384023536.db2.gz	BZCMAHTXHCUIPZ-OAHLLOKOSA-N	0	3	325.412	3.230	20	30		EGEDHN
C[C@@H]1C[C@@H](N(C)Cc2ccc(C#N)cc2)CN1C(=O)OC(C)(C)C	ZINC001168865454	1384039154	/nfs/dbraw/zinc/03/91/54/1384039154.db2.gz	MPAZRSVFBKCHGH-RHSMWYFYSA-N	0	3	329.444	3.388	20	30		EGEDHN
C=CCOc1ccccc1[C@H](C)N[C@@H]1CC[C@H](C(=O)OCC)OC1	ZINC001169347737	1384138826	/nfs/dbraw/zinc/13/88/26/1384138826.db2.gz	KPFXTJFKOJSDRW-HDMKZQKVSA-N	0	3	333.428	3.013	20	30		EGEDHN
CSC[C@H](C)C(=O)N[C@@H](C)CCCCNCc1ccccc1C#N	ZINC001169821720	1384188901	/nfs/dbraw/zinc/18/89/01/1384188901.db2.gz	NDOUQYZAVYGQNR-HOTGVXAUSA-N	0	3	347.528	3.322	20	30		EGEDHN
CCN(CC)Cc1cccc(Nc2c(C#N)cnn2C(=O)OC)c1F	ZINC001169969084	1384207153	/nfs/dbraw/zinc/20/71/53/1384207153.db2.gz	WBAOWTDGEAGULZ-UHFFFAOYSA-N	0	3	345.378	3.094	20	30		EGEDHN
C[C@H](CCCCNC/C(Cl)=C\Cl)NC(=O)c1c[nH]c(C#N)c1	ZINC001170283749	1384282640	/nfs/dbraw/zinc/28/26/40/1384282640.db2.gz	YDNJQVXZQCTOTN-ZTFCMROMSA-N	0	3	343.258	3.084	20	30		EGEDHN
CO[C@@H](C)CCC(=O)N[C@@H](C)CCCCNCc1ccccc1C#N	ZINC001170303753	1384286586	/nfs/dbraw/zinc/28/65/86/1384286586.db2.gz	PQJMOGIQNVZERV-IRXDYDNUSA-N	0	3	345.487	3.138	20	30		EGEDHN
C#CCCCC(=O)N[C@H](C)CCCCNCc1nc(C)sc1C	ZINC001170424766	1384315559	/nfs/dbraw/zinc/31/55/59/1384315559.db2.gz	DYYFHQCBJIZDKL-CQSZACIVSA-N	0	3	335.517	3.328	20	30		EGEDHN
C[C@H](CCCCNCc1nc2ccccc2o1)NC(=O)C#CC1CC1	ZINC001170665179	1384359322	/nfs/dbraw/zinc/35/93/22/1384359322.db2.gz	LONKOZUOZZLSTA-OAHLLOKOSA-N	0	3	339.439	3.006	20	30		EGEDHN
CC(C)C[C@H](C)CC(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001170828423	1384393478	/nfs/dbraw/zinc/39/34/78/1384393478.db2.gz	BSRFTLBZSBAUJT-HNNXBMFYSA-N	0	3	333.451	3.366	20	30		EGEDHN
C=C[C@H]1C[C@@]1(Nc1ccc(F)c(CN2CCCC2)c1)C(=O)OCC	ZINC001170927240	1384413136	/nfs/dbraw/zinc/41/31/36/1384413136.db2.gz	JGSZKDIAFQVQFK-KXBFYZLASA-N	0	3	332.419	3.341	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H](C)CCCCNCc1ccn(CC)n1	ZINC001170962115	1384418950	/nfs/dbraw/zinc/41/89/50/1384418950.db2.gz	HJKUAZJBSRCFEB-QGZVFWFLSA-N	0	3	346.519	3.436	20	30		EGEDHN
C=CCC[C@@H](C)[NH2+]CCCC[C@@H](C)NC(=O)c1cccc2n[n-]nc21	ZINC001170963736	1384419279	/nfs/dbraw/zinc/41/92/79/1384419279.db2.gz	SRKCUKJTBPTFBH-HUUCEWRRSA-N	0	3	343.475	3.191	20	30		EGEDHN
CCCc1occc1C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001171115620	1384448924	/nfs/dbraw/zinc/44/89/24/1384448924.db2.gz	MUMHASSEXDQHEH-UHFFFAOYSA-N	0	3	343.402	3.153	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)C2(CCC)CCC2)C1	ZINC001316620478	1384485791	/nfs/dbraw/zinc/48/57/91/1384485791.db2.gz	DYZBGDWVLTWKPO-OKILXGFUSA-N	0	3	343.309	3.350	20	30		EGEDHN
C[C@@H](CC(=O)NCCCNCc1cc(C#N)ccc1F)c1ccco1	ZINC001171385676	1384508764	/nfs/dbraw/zinc/50/87/64/1384508764.db2.gz	RZYPNVJXZHURNJ-AWEZNQCLSA-N	0	3	343.402	3.080	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)N1C[C@H]2[C@H](CN2C(=O)OC(C)(C)C)C1	ZINC001172312596	1384767565	/nfs/dbraw/zinc/76/75/65/1384767565.db2.gz	HLJOXGPVZOYBOY-JLSDUUJJSA-N	0	3	341.455	3.040	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)N(C)C1CN(C(=O)OC(C)(C)C)C1	ZINC001172317144	1384769016	/nfs/dbraw/zinc/76/90/16/1384769016.db2.gz	BSZZVSUXECEXJU-CQSZACIVSA-N	0	3	329.444	3.040	20	30		EGEDHN
N#CCCN(C1CCCC1)[C@@H]1CCN(Cc2ccccc2)C(=O)C1	ZINC001172675624	1384831512	/nfs/dbraw/zinc/83/15/12/1384831512.db2.gz	ICVOEFBKKUBFLE-LJQANCHMSA-N	0	3	325.456	3.336	20	30		EGEDHN
C[N@H+](Cc1ccccc1[O-])[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C#N)C1	ZINC001172991900	1384896021	/nfs/dbraw/zinc/89/60/21/1384896021.db2.gz	NMOXGHBPHKRBKT-CVEARBPZSA-N	0	3	345.443	3.116	20	30		EGEDHN
C[N@@H+](Cc1ccccc1[O-])[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C#N)C1	ZINC001172991900	1384896026	/nfs/dbraw/zinc/89/60/26/1384896026.db2.gz	NMOXGHBPHKRBKT-CVEARBPZSA-N	0	3	345.443	3.116	20	30		EGEDHN
C=Cc1ccc(C(=O)NCC[C@H](C)NCC(=C)Br)cc1	ZINC001317409775	1385121010	/nfs/dbraw/zinc/12/10/10/1385121010.db2.gz	RZBNWZUXLWMRSB-ZDUSSCGKSA-N	0	3	337.261	3.336	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1cnc2ccc(F)cc2c1	ZINC001317411719	1385122899	/nfs/dbraw/zinc/12/28/99/1385122899.db2.gz	VJACMIUTXWOWKU-GFCCVEGCSA-N	0	3	335.810	3.224	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H](C)CCCCNCc1ccn(C(C)C)n1	ZINC001174683629	1385134279	/nfs/dbraw/zinc/13/42/79/1385134279.db2.gz	UNDQTUPTWYYGIZ-INIZCTEOSA-N	0	3	334.508	3.441	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H](C)CCCCNCc1nccn1C(F)F	ZINC001174693924	1385135174	/nfs/dbraw/zinc/13/51/74/1385135174.db2.gz	FSTRFZGPSUIRKC-CYBMUJFWSA-N	0	3	342.434	3.255	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H](C)CCCCNCc1nccn1C(F)F	ZINC001174693925	1385135213	/nfs/dbraw/zinc/13/52/13/1385135213.db2.gz	FSTRFZGPSUIRKC-ZDUSSCGKSA-N	0	3	342.434	3.255	20	30		EGEDHN
CC(C)(CC(=O)NCCCNCc1ccccc1C#N)C(F)(F)F	ZINC001174893088	1385166751	/nfs/dbraw/zinc/16/67/51/1385166751.db2.gz	NDIJXIIKADXUDR-UHFFFAOYSA-N	0	3	341.377	3.133	20	30		EGEDHN
CCN(CCNC(=O)C1CCCCCC1)Cc1cccc(C#N)c1	ZINC001317477697	1385173852	/nfs/dbraw/zinc/17/38/52/1385173852.db2.gz	WNADPNIWGIYTID-UHFFFAOYSA-N	0	3	327.472	3.467	20	30		EGEDHN
CCN(CCNC(=O)[C@H]1CC12CCCC2)Cc1cccc(C#N)c1	ZINC001317488497	1385186906	/nfs/dbraw/zinc/18/69/06/1385186906.db2.gz	HCTNMYGRNSFMFU-GOSISDBHSA-N	0	3	325.456	3.077	20	30		EGEDHN
Cc1cccc(C(=O)NCCCNCc2cc(C#N)ccc2F)c1C	ZINC001175071530	1385189384	/nfs/dbraw/zinc/18/93/84/1385189384.db2.gz	QTCVSAMGEVRRMH-UHFFFAOYSA-N	0	3	339.414	3.224	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](C)CCCCNCc2nccn2CC)CC1	ZINC001175073116	1385189955	/nfs/dbraw/zinc/18/99/55/1385189955.db2.gz	FUDDXPWJELVWMG-KRWDZBQOSA-N	0	3	346.519	3.414	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)C1(CF)CCC1	ZINC001175340862	1385258171	/nfs/dbraw/zinc/25/81/71/1385258171.db2.gz	BAKGWJWVOBNDCO-INIZCTEOSA-N	0	3	345.462	3.463	20	30		EGEDHN
CCC1(C(=O)NC[C@H]2CCN(Cc3cccc(C#N)c3)C2)CCC1	ZINC001317537060	1385268388	/nfs/dbraw/zinc/26/83/88/1385268388.db2.gz	NFXMGXZYJLMQAF-GOSISDBHSA-N	0	3	325.456	3.077	20	30		EGEDHN
CCCN(CCNC(=O)[C@H](C)C(F)(F)F)Cc1cccc(C#N)c1	ZINC001317543111	1385285517	/nfs/dbraw/zinc/28/55/17/1385285517.db2.gz	PBUSAZAMODSWMR-ZDUSSCGKSA-N	0	3	341.377	3.085	20	30		EGEDHN
CCN1CCN(c2ccc(Nc3c(C#N)cccc3OC)cc2)CC1	ZINC001175781910	1385403363	/nfs/dbraw/zinc/40/33/63/1385403363.db2.gz	LSPGTJSTUKETMJ-UHFFFAOYSA-N	0	3	336.439	3.452	20	30		EGEDHN
C[C@H]1CC(C(=O)NCCCNCc2cc(C#N)ccc2F)C[C@H](C)C1	ZINC001177136732	1385828659	/nfs/dbraw/zinc/82/86/59/1385828659.db2.gz	RJLUICJAAOMKQC-HUUCEWRRSA-N	0	3	345.462	3.366	20	30		EGEDHN
Cc1csc(CNCCCN(CC2CCCC2)C(=O)[C@H](C)C#N)n1	ZINC001177256495	1385887133	/nfs/dbraw/zinc/88/71/33/1385887133.db2.gz	FSANBOBSXPMZTL-CQSZACIVSA-N	0	3	348.516	3.110	20	30		EGEDHN
Cc1cnc(CNCCCN(CC2CCCC2)C(=O)[C@@H](C)C#N)s1	ZINC001177261146	1385888269	/nfs/dbraw/zinc/88/82/69/1385888269.db2.gz	FIRGYCNTUAWROT-AWEZNQCLSA-N	0	3	348.516	3.110	20	30		EGEDHN
C#CCCCC(=O)N(CCCNCc1cnc(C)o1)CC1CCCC1	ZINC001177311721	1385909059	/nfs/dbraw/zinc/90/90/59/1385909059.db2.gz	LCXHPXZOGROZGW-UHFFFAOYSA-N	0	3	345.487	3.285	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@@H](OC)C(C)C	ZINC001177406228	1385945562	/nfs/dbraw/zinc/94/55/62/1385945562.db2.gz	SNURMIMQCIJEPJ-KRWDZBQOSA-N	0	3	344.927	3.408	20	30		EGEDHN
C=CCCC(=O)NCCCCCCNCc1csc([N+](=O)[O-])c1	ZINC001178018363	1386109547	/nfs/dbraw/zinc/10/95/47/1386109547.db2.gz	QAOQJOALZHUBSA-UHFFFAOYSA-N	0	3	339.461	3.389	20	30		EGEDHN
CCC(CC)CC(=O)N(C)[C@@H](C)CNCc1ccc(F)c(C#N)c1	ZINC001319550243	1386174698	/nfs/dbraw/zinc/17/46/98/1386174698.db2.gz	BQDKKOGJBAVFKD-AWEZNQCLSA-N	0	3	333.451	3.460	20	30		EGEDHN
Cc1cc(F)ccc1C(=O)N(C)[C@@H](C)CNCc1ccc(C#N)s1	ZINC001319563332	1386181581	/nfs/dbraw/zinc/18/15/81/1386181581.db2.gz	SEKUUDXZKBGFMA-ZDUSSCGKSA-N	0	3	345.443	3.318	20	30		EGEDHN
CC(C)[C@H](C)CC(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)[C@@H]1C	ZINC001178307784	1386185038	/nfs/dbraw/zinc/18/50/38/1386185038.db2.gz	AQBDWRLKOPZXFA-VCBZYWHSSA-N	0	3	345.462	3.459	20	30		EGEDHN
CC(C)C#CC(=O)NCCCCCCNCc1c(F)cccc1F	ZINC001178423229	1386213029	/nfs/dbraw/zinc/21/30/29/1386213029.db2.gz	DSLLRGLFYGEPPP-UHFFFAOYSA-N	0	3	336.426	3.390	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](NC(=O)C2CC2)C2CCCCC2)s1	ZINC001319643652	1386228991	/nfs/dbraw/zinc/22/89/91/1386228991.db2.gz	RXEDKLLISWLAEO-QGZVFWFLSA-N	0	3	331.485	3.184	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2coc(CC3CC3)n2)CCCC1	ZINC001698635299	1406280367	/nfs/dbraw/zinc/28/03/67/1406280367.db2.gz	KQWWSKVSQHKFMI-UHFFFAOYSA-N	0	3	337.851	3.012	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](NCc2cc(F)cc(F)c2)[C@@H]1C	ZINC001178503727	1386237518	/nfs/dbraw/zinc/23/75/18/1386237518.db2.gz	NILAAOLKRRYIMX-KSSFIOAISA-N	0	3	334.410	3.237	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](NCc2ccc(F)c(F)c2)[C@@H]1C	ZINC001178503794	1386238100	/nfs/dbraw/zinc/23/81/00/1386238100.db2.gz	QPGXYFFUIHJBET-KSSFIOAISA-N	0	3	334.410	3.237	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCCCCCNCc1cc(OC)no1	ZINC001178567324	1386251079	/nfs/dbraw/zinc/25/10/79/1386251079.db2.gz	RFFARFIFMSQUGA-UHFFFAOYSA-N	0	3	349.475	3.218	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccc(F)cc2)CCN1C(=O)C1CC(C)(C)C1	ZINC001178605170	1386261093	/nfs/dbraw/zinc/26/10/93/1386261093.db2.gz	HLORAUUAYWYAET-KXBFYZLASA-N	0	3	342.458	3.192	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@@H]1C	ZINC001178795381	1386307452	/nfs/dbraw/zinc/30/74/52/1386307452.db2.gz	OKPGCBLGTKRJPF-LPHOPBHVSA-N	0	3	342.458	3.359	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CC[C@H](NCC#Cc2ccccc2Cl)[C@@H]1C	ZINC001179313748	1386448682	/nfs/dbraw/zinc/44/86/82/1386448682.db2.gz	JNYGLEAICKEYII-XKQJLSEDSA-N	0	3	336.838	3.019	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)c1ccoc1C1CC1	ZINC001179414466	1386479143	/nfs/dbraw/zinc/47/91/43/1386479143.db2.gz	CTEBAJYGVPMHEQ-JXFKEZNVSA-N	0	3	348.446	3.401	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](NCc2cnn(C(C)(C)C)c2)[C@@H]1C	ZINC001179463565	1386487744	/nfs/dbraw/zinc/48/77/44/1386487744.db2.gz	KKMNRTJQICSUPW-RDJZCZTQSA-N	0	3	332.492	3.073	20	30		EGEDHN
C=CCCC1(C(=O)NCCCCCCNCc2cnns2)CC1	ZINC001179482691	1386495435	/nfs/dbraw/zinc/49/54/35/1386495435.db2.gz	ZYVJSWPCQQIJMW-UHFFFAOYSA-N	0	3	336.505	3.051	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCCCCCNCc2ccn(CC)n2)C1	ZINC001179532918	1386507673	/nfs/dbraw/zinc/50/76/73/1386507673.db2.gz	BNMANNSGQMEGEF-UHFFFAOYSA-N	0	3	332.492	3.026	20	30		EGEDHN
N#Cc1ccccc1CNCCCCCCNC(=O)C1(CF)CC1	ZINC001179552252	1386513030	/nfs/dbraw/zinc/51/30/30/1386513030.db2.gz	FVSHEKBYMNBVOZ-UHFFFAOYSA-N	0	3	331.435	3.074	20	30		EGEDHN
C[C@H]1[C@@H](NCc2ccc(C#N)c(F)c2)CCN1C(=O)CCC1(C)CC1	ZINC001179841250	1386603484	/nfs/dbraw/zinc/60/34/84/1386603484.db2.gz	UWSOTBDTSDOKAF-KSSFIOAISA-N	0	3	343.446	3.357	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@@H]2CC2(C)C)C[C@@]1(C)CNCc1ccccc1C#N	ZINC001181142478	1386945205	/nfs/dbraw/zinc/94/52/05/1386945205.db2.gz	GGYKVIBLZSHBTP-FYINFDKHSA-N	0	3	339.483	3.179	20	30		EGEDHN
Cc1cccc(C(=O)N[C@H](C)CNCc2ccc(F)c(C#N)c2)c1C	ZINC001321732835	1386970035	/nfs/dbraw/zinc/97/00/35/1386970035.db2.gz	YXCWJXLVJABCSC-CQSZACIVSA-N	0	3	339.414	3.222	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@@H](C)[C@](C)(CNCc2ocnc2C)C1	ZINC001182313320	1387145298	/nfs/dbraw/zinc/14/52/98/1387145298.db2.gz	BRBJAKCASNOZQK-IDHHARJASA-N	0	3	333.476	3.160	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@@H](NCc2cc(Cl)cc(Cl)c2)C1	ZINC001182423034	1387163929	/nfs/dbraw/zinc/16/39/29/1387163929.db2.gz	NCKWBVCVMUEMJO-MRXNPFEDSA-N	0	3	339.266	3.343	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H](C)[C@](C)(CN[C@H](C)c2cnccn2)C1	ZINC001182750073	1387218718	/nfs/dbraw/zinc/21/87/18/1387218718.db2.gz	JBPLDWGDGKJDJD-JXXFODFXSA-N	0	3	344.503	3.214	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](NCc2sc(C)nc2C)C1	ZINC001182818610	1387229556	/nfs/dbraw/zinc/22/95/56/1387229556.db2.gz	KPBYNZHDRHPMBU-MRXNPFEDSA-N	0	3	333.501	3.219	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC[C@@H]1CNCc1ccnc(Cl)c1	ZINC001698731966	1406381287	/nfs/dbraw/zinc/38/12/87/1406381287.db2.gz	YBWMAPWLNKJDJI-GOEBONIOSA-N	0	3	335.879	3.418	20	30		EGEDHN
C=CCn1c([C@@H](CC)OCC)nnc1N1CCN(C(C)(C)CC)CC1	ZINC001338990528	1389852622	/nfs/dbraw/zinc/85/26/22/1389852622.db2.gz	XBZZGALLUUJCSD-MRXNPFEDSA-N	0	3	349.523	3.262	20	30		EGEDHN
N#Cc1cc(Cl)ncc1NC(=O)C(C[C@@H]1CCCO1)C(F)(F)F	ZINC001339028578	1389866574	/nfs/dbraw/zinc/86/65/74/1389866574.db2.gz	PXCPZZQKZWZORS-UWVGGRQHSA-N	0	3	347.724	3.293	20	30		EGEDHN
Cc1cc(C(=O)NC[C@H](C)CNCc2ccccc2C#N)c(C)s1	ZINC001698753730	1406404970	/nfs/dbraw/zinc/40/49/70/1406404970.db2.gz	KJIQRRSRYZVIAH-CYBMUJFWSA-N	0	3	341.480	3.392	20	30		EGEDHN
N#CCOc1cccc(CNCc2ccc(C(=O)N3CCCC3)cc2)c1	ZINC001331953855	1389923509	/nfs/dbraw/zinc/92/35/09/1389923509.db2.gz	BYWYOIZXKSTEFX-UHFFFAOYSA-N	0	3	349.434	3.115	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1nnc(Cc2ccc(C)cc2)s1	ZINC001339918174	1390189554	/nfs/dbraw/zinc/18/95/54/1390189554.db2.gz	BHEIGXCLPNFCNS-CQSZACIVSA-N	0	3	330.457	3.059	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1cc(F)ccc1OC[C@H]1CCCO1	ZINC001339924088	1390190945	/nfs/dbraw/zinc/19/09/45/1390190945.db2.gz	XLBSVNPRRJSLJK-HUUCEWRRSA-N	0	3	336.407	3.006	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N1C[C@H](CC)CC[C@H]1C	ZINC001340207190	1390250044	/nfs/dbraw/zinc/25/00/44/1390250044.db2.gz	MJGWTPLKKSBSFT-ZACQAIPSSA-N	0	3	331.508	3.288	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1cc(Cl)ccc1O[C@@H](C)COC	ZINC001340383186	1390280157	/nfs/dbraw/zinc/28/01/57/1390280157.db2.gz	OBYDOTPLEOGFPR-GXTWGEPZSA-N	0	3	340.851	3.376	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)NCc1ccc(OC)cc1C(F)(F)F	ZINC001340665488	1390340152	/nfs/dbraw/zinc/34/01/52/1390340152.db2.gz	MXRLHVKWFCUYJY-AWEZNQCLSA-N	0	3	330.350	3.014	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)Nc1ccc2c(c1)OCC(=O)N2C	ZINC001340987610	1390420150	/nfs/dbraw/zinc/42/01/50/1390420150.db2.gz	XCOBBDODSGZTAK-HNNXBMFYSA-N	0	3	347.459	3.058	20	30		EGEDHN
CCn1c(N2CCN(CCC(C)(C)C)CC2)nnc1C(C)(C)CC#N	ZINC001341127517	1390444590	/nfs/dbraw/zinc/44/45/90/1390444590.db2.gz	LVVUMUJXPRAJNR-UHFFFAOYSA-N	0	3	346.523	3.047	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)Nc1cn(C)nc1Br	ZINC001341401589	1390482573	/nfs/dbraw/zinc/48/25/73/1390482573.db2.gz	TYTVJEBDCWICQK-NSHDSACASA-N	0	3	345.285	3.199	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1nnc(-c2c(F)cccc2F)s1	ZINC001341506758	1390495721	/nfs/dbraw/zinc/49/57/21/1390495721.db2.gz	ANBDBISEZFZWQA-NSHDSACASA-N	0	3	338.383	3.105	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1nccn1Cc1ccccc1Cl	ZINC001341568174	1390503749	/nfs/dbraw/zinc/50/37/49/1390503749.db2.gz	YJHADUCCARTJDN-HNNXBMFYSA-N	0	3	332.835	3.207	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)c2ccc(C)nn2)cc1	ZINC001342717582	1390645073	/nfs/dbraw/zinc/64/50/73/1390645073.db2.gz	MNXUHBYESOICBC-MRXNPFEDSA-N	0	3	336.395	3.089	20	30		EGEDHN
C=C(C)Cn1c([C@H](C)CCC#N)nnc1N1C[C@H](C)N(CC)C[C@@H]1C	ZINC001342964441	1390678464	/nfs/dbraw/zinc/67/84/64/1390678464.db2.gz	SFFROBXYRVEREV-IKGGRYGDSA-N	0	3	344.507	3.180	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccc(F)c(Br)c1F	ZINC001344058677	1390752848	/nfs/dbraw/zinc/75/28/48/1390752848.db2.gz	TUNXZFZWDRNOOI-SECBINFHSA-N	0	3	333.176	3.349	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc(Sc2nncs2)cc1	ZINC001343206029	1390699738	/nfs/dbraw/zinc/69/97/38/1390699738.db2.gz	WLBVCWQRDXAMEZ-ZDUSSCGKSA-N	0	3	334.470	3.311	20	30		EGEDHN
Cc1ccc(CC(=O)C(C#N)C(=O)NC2CCCCC2)cc1Cl	ZINC001343582146	1390724231	/nfs/dbraw/zinc/72/42/31/1390724231.db2.gz	IXCIQEGIXYFARZ-HNNXBMFYSA-N	0	3	332.831	3.349	20	30		EGEDHN
C=C(C)Cn1c([C@@H]2C[C@@H]2C)nnc1N1CCN(C2CCCC2)CC1	ZINC001343639493	1390728137	/nfs/dbraw/zinc/72/81/37/1390728137.db2.gz	RQBXWECVKQHWAK-DOTOQJQBSA-N	0	3	329.492	3.042	20	30		EGEDHN
CC(C)Cn1cccc(C(=O)C(C#N)c2nc(C3CC3)cs2)c1=O	ZINC001343757177	1390735305	/nfs/dbraw/zinc/73/53/05/1390735305.db2.gz	XLHRLPNPDGJMGV-CQSZACIVSA-N	0	3	341.436	3.328	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc(F)c(Br)c1F	ZINC001344058679	1390752965	/nfs/dbraw/zinc/75/29/65/1390752965.db2.gz	TUNXZFZWDRNOOI-VIFPVBQESA-N	0	3	333.176	3.349	20	30		EGEDHN
O=C(OCC#Cc1ccccn1)c1cccc(CN2CCCCC2)c1	ZINC001344856011	1390819759	/nfs/dbraw/zinc/81/97/59/1390819759.db2.gz	LBSVDKMPBBYWLN-UHFFFAOYSA-N	0	3	334.419	3.276	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCCOCCc1ccccc1	ZINC001346097156	1390907228	/nfs/dbraw/zinc/90/72/28/1390907228.db2.gz	ZBPHNXJFZGATPV-QGZVFWFLSA-N	0	3	325.412	3.119	20	30		EGEDHN
C=C[C@H](COC)NCc1cccc2c1CCN(C(=O)OC(C)(C)C)C2	ZINC001346843253	1390981726	/nfs/dbraw/zinc/98/17/26/1390981726.db2.gz	WTWBVACTPOPLOZ-QGZVFWFLSA-N	0	3	346.471	3.270	20	30		EGEDHN
CCc1ccc(CC(=O)C(C#N)C(=O)N[C@H](CC)c2ccccc2)nc1	ZINC001348268635	1391196566	/nfs/dbraw/zinc/19/65/66/1391196566.db2.gz	BCICXRJIPWBFOB-RBUKOAKNSA-N	0	3	349.434	3.163	20	30		EGEDHN
N#CC(C(=O)c1cn2c(n1)CCCC2)c1nc2c(cccc2Cl)[nH]1	ZINC001349760419	1391363533	/nfs/dbraw/zinc/36/35/33/1391363533.db2.gz	OAOWKSNZWNYATH-JTQLQIEISA-N	0	3	339.786	3.239	20	30		EGEDHN
N#CC(C(=O)CCc1ccc2c(c1)CCO2)c1nc2ccccc2[nH]1	ZINC001353991597	1392111775	/nfs/dbraw/zinc/11/17/75/1392111775.db2.gz	YCALHSNXOFBHJH-OAHLLOKOSA-N	0	3	331.375	3.307	20	30		EGEDHN
CCC1(C(=O)NC[C@@H](NCc2ccc(C#N)cc2F)C2CC2)CCC1	ZINC001480041035	1392546363	/nfs/dbraw/zinc/54/63/63/1392546363.db2.gz	MONODJKGAUKTKG-GOSISDBHSA-N	0	3	343.446	3.262	20	30		EGEDHN
N#Cc1ccc(CN[C@@H](CNC(=O)C(C2CC2)C2CC2)C2CC2)s1	ZINC001480057332	1392554974	/nfs/dbraw/zinc/55/49/74/1392554974.db2.gz	LOUITWOZRXXHOK-KRWDZBQOSA-N	0	3	343.496	3.040	20	30		EGEDHN
CC(F)(F)CC(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1cccc(C#N)c1	ZINC001480183194	1392614756	/nfs/dbraw/zinc/61/47/56/1392614756.db2.gz	XFXTZTQVPGOFTE-ALOPSCKCSA-N	0	3	347.409	3.215	20	30		EGEDHN
C[C@H](CNC(=O)c1cccc(C(F)F)c1)NCc1ccc(C#N)s1	ZINC001480575130	1392797615	/nfs/dbraw/zinc/79/76/15/1392797615.db2.gz	MOMDYBBFJZSQNS-LLVKDONJSA-N	0	3	349.406	3.465	20	30		EGEDHN
CCCN(CCNC(=O)c1cc(C)co1)Cc1cccc(C#N)c1	ZINC001481144764	1393132929	/nfs/dbraw/zinc/13/29/29/1393132929.db2.gz	NRQOLFRCSQEUON-UHFFFAOYSA-N	0	3	325.412	3.102	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@H](NCc2ccc(C#N)s2)C2CC2)cc1	ZINC001490733208	1394310031	/nfs/dbraw/zinc/31/00/31/1394310031.db2.gz	WDSPTARJHKSYJB-SFHVURJKSA-N	0	3	339.464	3.226	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H](CNC(=O)CCC3CCC3)C2)cc1	ZINC001491098207	1394427422	/nfs/dbraw/zinc/42/74/22/1394427422.db2.gz	LSYGXBVOUDQKGQ-HXUWFJFHSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2cc(C(C)(C)C)on2)CCCC1	ZINC001481901760	1394587782	/nfs/dbraw/zinc/58/77/82/1394587782.db2.gz	UVMOFNUZUOQHSQ-UHFFFAOYSA-N	0	3	339.867	3.357	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)CC2CCOCC2)CCCC[C@@H]1C	ZINC001481958229	1394619881	/nfs/dbraw/zinc/61/98/81/1394619881.db2.gz	UYDGGGRBNDBDKO-KBXCAEBGSA-N	0	3	342.911	3.210	20	30		EGEDHN
C[C@@H](CNCc1ccccc1C#N)CNC(=O)c1cccc2cc[nH]c21	ZINC001482141623	1394767136	/nfs/dbraw/zinc/76/71/36/1394767136.db2.gz	FXPMDARNKLAGNV-HNNXBMFYSA-N	0	3	346.434	3.195	20	30		EGEDHN
Cc1cccc(C(=O)N(C)[C@@H](C)CNCc2ccc(C#N)s2)c1F	ZINC001482288356	1394869164	/nfs/dbraw/zinc/86/91/64/1394869164.db2.gz	KHYIPMDRWWOBGR-ZDUSSCGKSA-N	0	3	345.443	3.318	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)N(C)C(=O)c1ccoc1C1CC1	ZINC001496143888	1396610410	/nfs/dbraw/zinc/61/04/10/1396610410.db2.gz	KBSOLRUBWSJVRE-GFCCVEGCSA-N	0	3	343.452	3.340	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H](C)CN(C)Cc2ccc(C#N)cc2)sc1C	ZINC001498445533	1396997592	/nfs/dbraw/zinc/99/75/92/1396997592.db2.gz	SEJOLSYMBVZUAT-AWEZNQCLSA-N	0	3	341.480	3.487	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1sc(C)nc1C	ZINC001689912099	1404205427	/nfs/dbraw/zinc/20/54/27/1404205427.db2.gz	QCMLJQQAKBELCU-SMDDNHRTSA-N	0	3	341.908	3.485	20	30		EGEDHN
CCCC[C@H](C)C(=O)N1CC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001690224542	1404427507	/nfs/dbraw/zinc/42/75/07/1404427507.db2.gz	GYCQAMQUBLOJMO-YOEHRIQHSA-N	0	3	331.435	3.214	20	30		EGEDHN
Cc1ccc(CC(=O)NCC[C@@H](C)NCc2ccccc2C#N)cc1C	ZINC001690878194	1404792334	/nfs/dbraw/zinc/79/23/34/1404792334.db2.gz	VDAMJVYVKJXUPE-GOSISDBHSA-N	0	3	349.478	3.402	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)[C@@H](C)C2CCCC2)C1	ZINC001691825643	1405541804	/nfs/dbraw/zinc/54/18/04/1405541804.db2.gz	RFINHLNBBQNKBW-YDHLFZDLSA-N	0	3	343.309	3.206	20	30		EGEDHN
CC[C@@H](CNC(=O)CC(C)(C)C1CC1)NCc1ccc(C#N)s1	ZINC001732199154	1428449858	/nfs/dbraw/zinc/44/98/58/1428449858.db2.gz	WZMXRHCLKSDCHY-AWEZNQCLSA-N	0	3	333.501	3.430	20	30		EGEDHN
CC[C@H](CNC(=O)C12CCC(CC1)C2)NCc1ccc(C#N)s1	ZINC001732205158	1428454765	/nfs/dbraw/zinc/45/47/65/1428454765.db2.gz	HTZMZMCXAHSPOH-TXKKKEFDSA-N	0	3	331.485	3.184	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2ccc(OC)c(F)c2)CCCC1	ZINC001732230166	1428477532	/nfs/dbraw/zinc/47/75/32/1428477532.db2.gz	BIEYTJLEAFDZJX-UHFFFAOYSA-N	0	3	340.826	3.219	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)CCc1cccs1)C1CC1	ZINC001732254750	1428495998	/nfs/dbraw/zinc/49/59/98/1428495998.db2.gz	WEUAOYSGLQBGNY-INIZCTEOSA-N	0	3	326.893	3.308	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)NCC1(NCc2ccc(C#N)cc2F)CCCC1	ZINC001732396418	1428563848	/nfs/dbraw/zinc/56/38/48/1428563848.db2.gz	PGTKVCJFMGMSSN-QGZVFWFLSA-N	0	3	349.425	3.210	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)C1(C(F)F)CCCC1	ZINC001699462218	1412818711	/nfs/dbraw/zinc/81/87/11/1412818711.db2.gz	RCTXWUADTPXBSE-AWEZNQCLSA-N	0	3	349.425	3.320	20	30		EGEDHN
C[C@]1(CNCc2ccccc2C#N)CCN(C(=O)C2(F)CCCC2)C1	ZINC001699841783	1413270751	/nfs/dbraw/zinc/27/07/51/1413270751.db2.gz	IUWJQCPRWSJNIB-LJQANCHMSA-N	0	3	343.446	3.169	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)C1=CCCC1)NCc1cc(C#N)ccc1F	ZINC001732559145	1428747536	/nfs/dbraw/zinc/74/75/36/1428747536.db2.gz	UAVRMIPADMTIPK-GOSISDBHSA-N	0	3	329.419	3.038	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1ccn2cc(C)nc2c1	ZINC001700446116	1414022787	/nfs/dbraw/zinc/02/27/87/1414022787.db2.gz	WPBGCCXUUXPOME-UHFFFAOYSA-N	0	3	348.878	3.083	20	30		EGEDHN
C=C(Cl)CNC1CC(N(C)C(=O)CCc2cccc(N(C)C)c2)C1	ZINC001701022610	1414683764	/nfs/dbraw/zinc/68/37/64/1414683764.db2.gz	ASXJLUKOTUBSJD-UHFFFAOYSA-N	0	3	349.906	3.017	20	30		EGEDHN
C=C(Cl)CNC1CC(N(C)C(=O)COc2cc(C)cc(C)c2)C1	ZINC001701028920	1414690598	/nfs/dbraw/zinc/69/05/98/1414690598.db2.gz	FECATABFKINLFM-UHFFFAOYSA-N	0	3	336.863	3.014	20	30		EGEDHN
CC(F)(F)CCC(=O)N[C@@H]1CCC[C@@H]1CNCc1ccccc1C#N	ZINC001732617248	1428879687	/nfs/dbraw/zinc/87/96/87/1428879687.db2.gz	CXRIWVNIKFYNDG-IAGOWNOFSA-N	0	3	349.425	3.368	20	30		EGEDHN
CC(C)c1ccc(C(=O)N[C@H](C)CNCc2ccc(C#N)s2)cn1	ZINC001732958494	1429082239	/nfs/dbraw/zinc/08/22/39/1429082239.db2.gz	PEMHNSKDCKVYMK-CYBMUJFWSA-N	0	3	342.468	3.046	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1scnc1C	ZINC001712995300	1417546828	/nfs/dbraw/zinc/54/68/28/1417546828.db2.gz	XAJKOVHAACYAFH-YPMHNXCESA-N	0	3	327.881	3.177	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1cc(CCC)n[nH]1	ZINC001713001434	1417555053	/nfs/dbraw/zinc/55/50/53/1417555053.db2.gz	ZDSJEZAAVHMQOY-CJNGLKHVSA-N	0	3	338.883	3.088	20	30		EGEDHN
CCCN(CCNC(=O)C1C=CC=CC=C1)Cc1cccc(C#N)c1	ZINC001713546858	1418318795	/nfs/dbraw/zinc/31/87/95/1418318795.db2.gz	BGJDXQNFYQBBFK-UHFFFAOYSA-N	0	3	335.451	3.185	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)COc1c(C)cc(C)cc1C	ZINC001714498651	1419223568	/nfs/dbraw/zinc/22/35/68/1419223568.db2.gz	ARCZGSBZQGEYJQ-MRXNPFEDSA-N	0	3	338.879	3.228	20	30		EGEDHN
CCCC1(C(=O)N(C)[C@@H](C)CNCc2cc(C#N)ccc2OC)CC1	ZINC001714747672	1419492260	/nfs/dbraw/zinc/49/22/60/1419492260.db2.gz	OMGJCIWTEZMPJK-HNNXBMFYSA-N	0	3	343.471	3.084	20	30		EGEDHN
CCc1ccc(C(=O)N(C)[C@@H](C)CNCc2ccc(C#N)s2)cc1	ZINC001714845529	1419557672	/nfs/dbraw/zinc/55/76/72/1419557672.db2.gz	JQZVWGLTQKEOFT-AWEZNQCLSA-N	0	3	341.480	3.432	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccc(OC)cc2C)CCCC1	ZINC001715304761	1420013626	/nfs/dbraw/zinc/01/36/26/1420013626.db2.gz	TZISHQFIEIKBGS-UHFFFAOYSA-N	0	3	336.863	3.388	20	30		EGEDHN
C=C(Br)CNC[C@@H]1[C@@H](C)CCCN1C(=O)CCC1CC1	ZINC001715350522	1420051326	/nfs/dbraw/zinc/05/13/26/1420051326.db2.gz	BJEJNSKVRPYBKR-SWLSCSKDSA-N	0	3	343.309	3.302	20	30		EGEDHN
CC(C)c1cccc(C(=O)N[C@@H](C)CNCc2ccc(C#N)s2)n1	ZINC001715986021	1420443843	/nfs/dbraw/zinc/44/38/43/1420443843.db2.gz	IVBATVFBQYHRAX-ZDUSSCGKSA-N	0	3	342.468	3.046	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)CCC1CCCC1	ZINC001716013462	1420466755	/nfs/dbraw/zinc/46/67/55/1420466755.db2.gz	HMCCUHFUEVLASS-INIZCTEOSA-N	0	3	327.472	3.465	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(OCC#N)cc1)NC(=O)CC1CCCC1	ZINC001716017119	1420471391	/nfs/dbraw/zinc/47/13/91/1420471391.db2.gz	PIYQKXFKSLGGHM-MRXNPFEDSA-N	0	3	343.471	3.106	20	30		EGEDHN
C[C@H](C#N)C(=O)NCC1(NCc2ccc(-c3ccsc3)cc2)CC1	ZINC001716677958	1420833135	/nfs/dbraw/zinc/83/31/35/1420833135.db2.gz	OREKULDFTGWFMG-CQSZACIVSA-N	0	3	339.464	3.313	20	30		EGEDHN
CC[C@H](SC)C(=O)N(C)CC(C)(C)CNCc1ccccc1C#N	ZINC001717452313	1421382160	/nfs/dbraw/zinc/38/21/60/1421382160.db2.gz	ZDUIGDGNGBNFRO-KRWDZBQOSA-N	0	3	347.528	3.274	20	30		EGEDHN
Cc1cscc1C(=O)N[C@@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001723291012	1424336554	/nfs/dbraw/zinc/33/65/54/1424336554.db2.gz	YFTFQIQRBZYXHH-INIZCTEOSA-N	0	3	345.493	3.288	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)CSC(C)C)CC2)C1	ZINC001723597558	1424483981	/nfs/dbraw/zinc/48/39/81/1424483981.db2.gz	PNBILPDWWIHVIN-INIZCTEOSA-N	0	3	344.952	3.441	20	30		EGEDHN
COc1ccc(Cl)c(CNC[C@H]2CCCN2C(=O)C#CC(C)C)c1	ZINC001723899060	1424600790	/nfs/dbraw/zinc/60/07/90/1424600790.db2.gz	PJBVWOVBYPLTFV-MRXNPFEDSA-N	0	3	348.874	3.089	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)c2ncccc2C)CC1	ZINC001725023797	1425440844	/nfs/dbraw/zinc/44/08/44/1425440844.db2.gz	RQOMERCFEYXSOW-UHFFFAOYSA-N	0	3	335.879	3.317	20	30		EGEDHN
Cc1csc(C(=O)NC[C@H](C)N(C)Cc2cccc(C#N)c2)c1	ZINC001725156867	1425649498	/nfs/dbraw/zinc/64/94/98/1425649498.db2.gz	ASMXEHYDZMVWTR-AWEZNQCLSA-N	0	3	327.453	3.179	20	30		EGEDHN
CCC1(C(=O)N(C)[C@H](CNCc2ccc(C#N)cc2F)C2CC2)CC1	ZINC001725463219	1426129349	/nfs/dbraw/zinc/12/93/49/1426129349.db2.gz	DOOGARXDGFUURM-GOSISDBHSA-N	0	3	343.446	3.214	20	30		EGEDHN
CCN(CCNC(=O)[C@H]1CC[C@H](C)CC1)Cc1cccc(C#N)c1	ZINC001731814725	1428007230	/nfs/dbraw/zinc/00/72/30/1428007230.db2.gz	IQNXOMOAFGDNJV-RUCARUNLSA-N	0	3	327.472	3.323	20	30		EGEDHN
CCCCC(=O)N1CCC[C@H]2CN(Cc3cccc(C#N)c3)C[C@H]21	ZINC001733600957	1429803380	/nfs/dbraw/zinc/80/33/80/1429803380.db2.gz	GXKZVPQVUXQDDT-RBUKOAKNSA-N	0	3	325.456	3.171	20	30		EGEDHN
Cc1cc(C(=O)NC[C@@H](C)N(C)Cc2ccc(C#N)cc2)c(C)s1	ZINC001734045507	1437834445	/nfs/dbraw/zinc/83/44/45/1437834445.db2.gz	VTLWEOPCYPJWOY-CYBMUJFWSA-N	0	3	341.480	3.487	20	30		EGEDHN
CC#CCN(CCCNC(=O)C[C@@H](C)c1ccccc1F)C1CC1	ZINC001752283438	1440164801	/nfs/dbraw/zinc/16/48/01/1440164801.db2.gz	LIIADTHOZSTDEM-MRXNPFEDSA-N	0	3	330.447	3.313	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCN1CCN([C@@H](C)c2ccccc2C)CC1	ZINC001752371301	1440172532	/nfs/dbraw/zinc/17/25/32/1440172532.db2.gz	SKDJQRVHEFKMMP-SFHVURJKSA-N	0	3	343.515	3.002	20	30		EGEDHN
C=CCN1CCC(N(CCC)C(=O)c2cc3c([nH]2)CCCC3)CC1	ZINC001752442052	1440181451	/nfs/dbraw/zinc/18/14/51/1440181451.db2.gz	OKZMFFBCPDZVMZ-UHFFFAOYSA-N	0	3	329.488	3.396	20	30		EGEDHN
N#Cc1ccc(CN[C@@H](CNC(=O)c2ccccc2F)C2CC2)s1	ZINC001752444077	1440181825	/nfs/dbraw/zinc/18/18/25/1440181825.db2.gz	DEEKJMMRULTVKP-KRWDZBQOSA-N	0	3	343.427	3.057	20	30		EGEDHN
CCCCCC(=O)NC[C@@H](NCC#Cc1ccc(F)cc1)C1CC1	ZINC001752451482	1440182482	/nfs/dbraw/zinc/18/24/82/1440182482.db2.gz	ORLPDNHJQDVLJT-LJQANCHMSA-N	0	3	330.447	3.242	20	30		EGEDHN
C=CCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(F)c(OC)c1	ZINC001752567487	1440195361	/nfs/dbraw/zinc/19/53/61/1440195361.db2.gz	RVSBNRHGDQGQPR-IYBDPMFKSA-N	0	3	332.419	3.089	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C[C@H](CC)C(C)C)C1	ZINC001752680789	1440199613	/nfs/dbraw/zinc/19/96/13/1440199613.db2.gz	BLKXHHCCCRPNRF-IHRRRGAJSA-N	0	3	331.298	3.204	20	30		EGEDHN
C=CCCC(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1c(C)noc1CC	ZINC001752690523	1440200452	/nfs/dbraw/zinc/20/04/52/1440200452.db2.gz	WOEOYLWKEDNATM-MQVJKMGUSA-N	0	3	331.460	3.123	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)[C@H](C)C(CC)CC)C1	ZINC001752737126	1440204325	/nfs/dbraw/zinc/20/43/25/1440204325.db2.gz	IQYHCLPHSIDIAB-BNOWGMLFSA-N	0	3	331.298	3.204	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)[C@H](C)Cc1ccccc1C	ZINC001752824731	1440223023	/nfs/dbraw/zinc/22/30/23/1440223023.db2.gz	CQLGTPVBYUNCKF-QUCCMNQESA-N	0	3	326.484	3.168	20	30		EGEDHN
C#CCCCC(=O)N[C@H](C)[C@H]1CCCN(Cc2ccccc2F)C1	ZINC001752838752	1440229058	/nfs/dbraw/zinc/22/90/58/1440229058.db2.gz	WMRKKLJYHKVELY-SJORKVTESA-N	0	3	330.447	3.346	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H](C)[C@@H]1CCCN(Cc2cncc(C)c2)C1	ZINC001752839194	1440229415	/nfs/dbraw/zinc/22/94/15/1440229415.db2.gz	CGFFABHFJMIWDY-FUHWJXTLSA-N	0	3	329.488	3.319	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H](C)[C@@H]1CCCN(Cc2cnoc2C)C1	ZINC001752841875	1440230965	/nfs/dbraw/zinc/23/09/65/1440230965.db2.gz	SVXPXXGPZWIBTJ-SJLPKXTDSA-N	0	3	345.487	3.283	20	30		EGEDHN
Cc1cc(C(=O)NC[C@H](C)NCc2ccc(C#N)s2)ccc1Cl	ZINC001752897818	1440242187	/nfs/dbraw/zinc/24/21/87/1440242187.db2.gz	IQADOFNNDRXOQF-LBPRGKRZSA-N	0	3	347.871	3.490	20	30		EGEDHN
CC[C@@H](CC(C)C)C(=O)NC[C@@H](C)NCc1ccc(F)c(C#N)c1	ZINC001752909960	1440245117	/nfs/dbraw/zinc/24/51/17/1440245117.db2.gz	ABZWMPRWHSDIJN-ZBFHGGJFSA-N	0	3	333.451	3.364	20	30		EGEDHN
C=C[C@H](C(=O)NC[C@H](C)NCc1c(C)nsc1C)c1ccccc1	ZINC001752920957	1440248511	/nfs/dbraw/zinc/24/85/11/1440248511.db2.gz	JFXKNWOTNPSEBA-GUYCJALGSA-N	0	3	343.496	3.324	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1CCC[C@@H](NCc2cnc(C)cn2)C1	ZINC001752968591	1440254600	/nfs/dbraw/zinc/25/46/00/1440254600.db2.gz	LWAFPNSNLJEPCS-MSOLQXFVSA-N	0	3	342.487	3.070	20	30		EGEDHN
CC(C)C(=O)NCCC[C@H]1CCCN1CC#Cc1ccc(F)cc1	ZINC001753024287	1440270947	/nfs/dbraw/zinc/27/09/47/1440270947.db2.gz	ZDSAVFHMUMYWCI-IBGZPJMESA-N	0	3	330.447	3.194	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1CCCNC(=O)c1sccc1OC	ZINC001753038046	1440275248	/nfs/dbraw/zinc/27/52/48/1440275248.db2.gz	NRVMXGIJNWJRFX-ZDUSSCGKSA-N	0	3	342.892	3.484	20	30		EGEDHN
CCN(CCNC(=O)C[C@H](C)C(F)(F)F)Cc1ccc(C#N)cc1	ZINC001753086752	1440296889	/nfs/dbraw/zinc/29/68/89/1440296889.db2.gz	GBMHMHDSCBXIEF-ZDUSSCGKSA-N	0	3	341.377	3.085	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC[C@@H]1CCCN1Cc1ccc(C)cc1	ZINC001753099915	1440303978	/nfs/dbraw/zinc/30/39/78/1440303978.db2.gz	YZTUQTWZGOBDKG-HKUYNNGSSA-N	0	3	330.472	3.057	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H](CNC(=O)CC3CCCCC3)C2)c1	ZINC001753120893	1440313542	/nfs/dbraw/zinc/31/35/42/1440313542.db2.gz	ZOIWOJARZYEOJC-HXUWFJFHSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCN(CCC)Cc2ccc(C)nc2C)C1	ZINC001753148491	1440326031	/nfs/dbraw/zinc/32/60/31/1440326031.db2.gz	XVWDWJJCZKLDKR-UHFFFAOYSA-N	0	3	329.488	3.383	20	30		EGEDHN
CC(C)c1ccoc1C(=O)N(C)CCNCc1ccc(F)c(C#N)c1	ZINC001753222342	1440340274	/nfs/dbraw/zinc/34/02/74/1440340274.db2.gz	AZNSKVSGWLTXEK-UHFFFAOYSA-N	0	3	343.402	3.276	20	30		EGEDHN
C#CCC1(C(=O)N(C)CCNCc2c(C)nsc2C)CCCCC1	ZINC001753266823	1440344912	/nfs/dbraw/zinc/34/49/12/1440344912.db2.gz	AJXIOVDGFQIPAY-UHFFFAOYSA-N	0	3	347.528	3.282	20	30		EGEDHN
CCCCC(=O)N1CCC([C@@H](C)NCc2ccccc2C#N)CC1	ZINC001753270134	1440345365	/nfs/dbraw/zinc/34/53/65/1440345365.db2.gz	KBWQOLKVDBANPP-MRXNPFEDSA-N	0	3	327.472	3.465	20	30		EGEDHN
C=CCN[C@H](CNC(=O)[C@H]1CCc2cc(F)ccc21)c1ccccc1	ZINC001753300417	1440353684	/nfs/dbraw/zinc/35/36/84/1440353684.db2.gz	RZUAHVHAFWXERA-VQTJNVASSA-N	0	3	338.426	3.489	20	30		EGEDHN
C=CCN[C@@H](CNC(=O)c1ncccc1C(F)(F)F)c1ccccc1	ZINC001753309075	1440356090	/nfs/dbraw/zinc/35/60/90/1440356090.db2.gz	BQCUNOFWODDBEZ-HNNXBMFYSA-N	0	3	349.356	3.347	20	30		EGEDHN
C#CCCN[C@H](CNC(=O)c1cccc(OC)c1C)c1ccccc1	ZINC001753309002	1440356095	/nfs/dbraw/zinc/35/60/95/1440356095.db2.gz	ALRULYLALOOFAP-LJQANCHMSA-N	0	3	336.435	3.088	20	30		EGEDHN
C=CCOCCN1CC[C@H](N(CCC)C(=O)[C@@H]2CCCC2(C)C)C1	ZINC001753318280	1440361223	/nfs/dbraw/zinc/36/12/23/1440361223.db2.gz	GSJAJMOOQJPHQM-ROUUACIJSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CCC)C(=O)Cc2c(C)noc2Cl)C1	ZINC001753319106	1440361877	/nfs/dbraw/zinc/36/18/77/1440361877.db2.gz	ALBIHTJWQAPCNW-AWEZNQCLSA-N	0	3	339.867	3.068	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CCC)C(=O)c2cc(CC(C)C)c[nH]2)C1	ZINC001753320142	1440362805	/nfs/dbraw/zinc/36/28/05/1440362805.db2.gz	UMZLWHFGINHKOR-GOSISDBHSA-N	0	3	329.488	3.163	20	30		EGEDHN
C#CCCN1CC[C@H](N(CCC)C(=O)[C@@H](C)c2cccc(OC)c2)C1	ZINC001753323132	1440364802	/nfs/dbraw/zinc/36/48/02/1440364802.db2.gz	LVTPYXTUSUIDCG-HKUYNNGSSA-N	0	3	342.483	3.135	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC[C@H]1CCN(CC#Cc2ccccc2)C1	ZINC001753333096	1440370708	/nfs/dbraw/zinc/37/07/08/1440370708.db2.gz	BPFBNNFHPFUMRJ-FQEVSTJZSA-N	0	3	338.495	3.469	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H]2C[C@H]1CN2[C@H](CCOC)c1ccccc1	ZINC001753421440	1440395217	/nfs/dbraw/zinc/39/52/17/1440395217.db2.gz	JYSACJMHELOLJI-SLFFLAALSA-N	0	3	342.483	3.406	20	30		EGEDHN
C=C[C@@H](CC(=O)N(C)[C@@H]1CCN(CCOC(C)C)C1)c1ccccc1	ZINC001753450862	1440405984	/nfs/dbraw/zinc/40/59/84/1440405984.db2.gz	XLEVFOIRAFLQBV-AZUAARDMSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=CCCC(=O)N(CC)[C@H]1CCN(Cc2ccc(C)c(OC)c2)C1	ZINC001753452635	1440406823	/nfs/dbraw/zinc/40/68/23/1440406823.db2.gz	BZLLPQPDWXNVPO-SFHVURJKSA-N	0	3	330.472	3.393	20	30		EGEDHN
CC[C@@H](CNC(=O)c1ccc(C)s1)NCc1ccc(C#N)s1	ZINC001753463581	1440412182	/nfs/dbraw/zinc/41/21/82/1440412182.db2.gz	GAFKSCZSYUWNLW-LBPRGKRZSA-N	0	3	333.482	3.288	20	30		EGEDHN
C=C(Br)CNC[C@@](C)(NC(=O)CC(C)(C)C)C1CC1	ZINC001753513007	1440426509	/nfs/dbraw/zinc/42/65/09/1440426509.db2.gz	HLRZXKCFKAZCPR-OAHLLOKOSA-N	0	3	331.298	3.206	20	30		EGEDHN
Cc1cc(C(=O)N[C@](C)(CNCC#Cc2ccccc2)C2CC2)co1	ZINC001753517031	1440427655	/nfs/dbraw/zinc/42/76/55/1440427655.db2.gz	WADYCWDGNVKEFZ-OAQYLSRUSA-N	0	3	336.435	3.128	20	30		EGEDHN
Cc1nocc1CNC[C@@]1(NC(=O)C#CC(C)(C)C)CCCC[C@@H]1C	ZINC001753531685	1440431289	/nfs/dbraw/zinc/43/12/89/1440431289.db2.gz	LLYRHCOHMDCPCF-YWZLYKJASA-N	0	3	345.487	3.187	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)Cc2cncc(C)c2)CCCC[C@@H]1C	ZINC001753534389	1440432038	/nfs/dbraw/zinc/43/20/38/1440432038.db2.gz	SOQVYIVGLJQUQR-KXBFYZLASA-N	0	3	349.906	3.340	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H](CCNCc2cc(C#N)ccc2F)C1	ZINC001753542569	1440433726	/nfs/dbraw/zinc/43/37/26/1440433726.db2.gz	LOSFDWCZFCMFDJ-MRXNPFEDSA-N	0	3	343.446	3.382	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N1CCC[C@H](CCNCc2ccc(C#N)cc2F)C1	ZINC001753554280	1440435690	/nfs/dbraw/zinc/43/56/90/1440435690.db2.gz	WJKLMXGXAWWVQX-DAYGRLMNSA-N	0	3	343.446	3.072	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CC[C@H](NCc2oc(C(C)C)nc2C)CC1	ZINC001753582140	1440440444	/nfs/dbraw/zinc/44/04/44/1440440444.db2.gz	GMTUWLMGYOLFLA-QAQDUYKDSA-N	0	3	345.487	3.427	20	30		EGEDHN
CC#CCNCc1ccc(CNC(=O)[C@@H](C)c2ccsc2)cc1	ZINC001753590584	1440442674	/nfs/dbraw/zinc/44/26/74/1440442674.db2.gz	KWVOOAJSSLSCBZ-HNNXBMFYSA-N	0	3	326.465	3.281	20	30		EGEDHN
O=C(NCC1([NH2+]CC#Cc2ccccc2)CCCC1)c1ccccc1[O-]	ZINC001753660373	1440458342	/nfs/dbraw/zinc/45/83/42/1440458342.db2.gz	BRMYSHHWSVTXKL-UHFFFAOYSA-N	0	3	348.446	3.076	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccccc1)N(C)C(=O)[C@H]1CCC(C)(C)C1	ZINC001753710692	1440470577	/nfs/dbraw/zinc/47/05/77/1440470577.db2.gz	HBZGKHHFEJCITO-HKUYNNGSSA-N	0	3	326.484	3.301	20	30		EGEDHN
CC(C)C[C@@H](CNCc1ccc(C#N)s1)NC(=O)[C@H]1C[C@H]2C[C@H]2C1	ZINC001753738109	1440478250	/nfs/dbraw/zinc/47/82/50/1440478250.db2.gz	CRICICHOQVTOMF-JJXSEGSLSA-N	0	3	345.512	3.286	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](NCc2c(F)cccc2F)[C@H](C)C1	ZINC001753759969	1440483792	/nfs/dbraw/zinc/48/37/92/1440483792.db2.gz	MZKCIQPFIATLNX-DNVCBOLYSA-N	0	3	348.437	3.485	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](NCc2c(F)cccc2F)[C@H](C)C1	ZINC001753759968	1440483865	/nfs/dbraw/zinc/48/38/65/1440483865.db2.gz	MZKCIQPFIATLNX-BEFAXECRSA-N	0	3	348.437	3.485	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H](C)[C@H]1CNCc1cn(C(C)C)nc1C	ZINC001753805820	1440491739	/nfs/dbraw/zinc/49/17/39/1440491739.db2.gz	RZSAEVFADXFODJ-QFBILLFUSA-N	0	3	346.519	3.455	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CCC[C@@H]1CNCc1nc2ccc(F)cc2o1	ZINC001753882607	1440520655	/nfs/dbraw/zinc/52/06/55/1440520655.db2.gz	MESKWDQGSNZRBV-UKRRQHHQSA-N	0	3	345.418	3.308	20	30		EGEDHN
C=C(Br)CNCC[C@@H](C)NC(=O)[C@]1(C)CC=CCC1	ZINC001753967919	1440526784	/nfs/dbraw/zinc/52/67/84/1440526784.db2.gz	BVOZCHIJOJWDLF-UKRRQHHQSA-N	0	3	329.282	3.126	20	30		EGEDHN
C=C(Cl)CNCC[C@H](C)NC(=O)c1ccc(C)c2cccnc12	ZINC001753985091	1440528430	/nfs/dbraw/zinc/52/84/30/1440528430.db2.gz	NFJOIJRPRARFQV-AWEZNQCLSA-N	0	3	331.847	3.394	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](C)CCNCc2ccncc2Cl)CC1	ZINC001753996465	1440529519	/nfs/dbraw/zinc/52/95/19/1440529519.db2.gz	FTVDQOIHSTVALF-AWEZNQCLSA-N	0	3	335.879	3.466	20	30		EGEDHN
CCN(CCNCc1ccc(C#N)cc1)C(=O)C1CC2(CCC2)C1	ZINC001754062976	1440537196	/nfs/dbraw/zinc/53/71/96/1440537196.db2.gz	WRZSQZGQXLYQRS-UHFFFAOYSA-N	0	3	325.456	3.077	20	30		EGEDHN
Cc1cc(C(=O)NC/C=C/CNCc2cccc(C#N)c2)sc1C	ZINC001754205133	1440550611	/nfs/dbraw/zinc/55/06/11/1440550611.db2.gz	YVYJDJGFHCKWRW-ONEGZZNKSA-N	0	3	339.464	3.312	20	30		EGEDHN
C[C@H](CNCc1ccc(F)c(C#N)c1)NC(=O)[C@H]1CCC=CCCC1	ZINC001754230855	1440554010	/nfs/dbraw/zinc/55/40/10/1440554010.db2.gz	KZMNVVCCOMYHDL-WBVHZDCISA-N	0	3	343.446	3.428	20	30		EGEDHN
Cc1cc(C)cc(C(=O)N[C@@H](C)CNCc2ccc(C#N)c(F)c2)c1	ZINC001754291619	1440565294	/nfs/dbraw/zinc/56/52/94/1440565294.db2.gz	RXADGWMJYNGVSU-HNNXBMFYSA-N	0	3	339.414	3.222	20	30		EGEDHN
O=C(N[C@@H](CNCC#Cc1ccc(F)cc1)C1CC1)C1CCCCC1	ZINC001754435511	1440598034	/nfs/dbraw/zinc/59/80/34/1440598034.db2.gz	LFXDQRBEOKPYJE-FQEVSTJZSA-N	0	3	342.458	3.242	20	30		EGEDHN
O=C(N[C@@H](CNCC#Cc1ccccc1)C1CC1)C1CCCCCC1	ZINC001754436147	1440598072	/nfs/dbraw/zinc/59/80/72/1440598072.db2.gz	QNHKUCHMEIFPSE-NRFANRHFSA-N	0	3	338.495	3.493	20	30		EGEDHN
CC1(CCC(=O)NCC2(NCc3ccc(C#N)c(F)c3)CC2)CC1	ZINC001754531028	1440622545	/nfs/dbraw/zinc/62/25/45/1440622545.db2.gz	MQOYIERLKFJRJE-UHFFFAOYSA-N	0	3	329.419	3.016	20	30		EGEDHN
N#Cc1cccc(CNC2(CNC(=O)C3(c4ccccc4)CC3)CC2)c1	ZINC001754532541	1440623037	/nfs/dbraw/zinc/62/30/37/1440623037.db2.gz	KVWJQXWUATXIIV-UHFFFAOYSA-N	0	3	345.446	3.028	20	30		EGEDHN
C=CCCC(=O)N1CCCC[C@@H]1[C@@H]1CCN(Cc2cccnc2)C1	ZINC001754539688	1440625778	/nfs/dbraw/zinc/62/57/78/1440625778.db2.gz	UKPFAYLTTLQDSU-RTBURBONSA-N	0	3	327.472	3.251	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@]2(CCN(Cc3cccnc3)C2)C1	ZINC001754565481	1440635248	/nfs/dbraw/zinc/63/52/48/1440635248.db2.gz	KKXQYTDHPQUQEC-PXNSSMCTSA-N	0	3	327.472	3.108	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@]2(CCN(Cc3cncc(C)c3)C2)C1	ZINC001754566293	1440635565	/nfs/dbraw/zinc/63/55/65/1440635565.db2.gz	YLFBOLXYPHETGW-OAQYLSRUSA-N	0	3	341.499	3.417	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@H]1CNCc1cc(F)ccc1OC	ZINC001754615471	1440644501	/nfs/dbraw/zinc/64/45/01/1440644501.db2.gz	PDHRBVLBYKJGTR-SFHVURJKSA-N	0	3	346.446	3.109	20	30		EGEDHN
C#CCNC[C@H](NC(=O)c1ccc(C)n1C)c1ccc2ccccc2c1	ZINC001754644071	1440649749	/nfs/dbraw/zinc/64/97/49/1440649749.db2.gz	NJYRSZSWOXVPMS-FQEVSTJZSA-N	0	3	345.446	3.181	20	30		EGEDHN
C=CCCCC(=O)N[C@]1(C)CCN(Cc2ccccc2N(C)C)C1	ZINC001754679446	1440661369	/nfs/dbraw/zinc/66/13/69/1440661369.db2.gz	RQGGZEKPVMKUSF-HXUWFJFHSA-N	0	3	329.488	3.190	20	30		EGEDHN
C#CCN1CCC(C)(CNC(=O)[C@H](C)CCc2ccccc2F)CC1	ZINC001754720127	1440672867	/nfs/dbraw/zinc/67/28/67/1440672867.db2.gz	HYQHRCGGSNZYAD-QGZVFWFLSA-N	0	3	344.474	3.246	20	30		EGEDHN
C=CCN1CCC[C@@](C)(CNC(=O)Cc2coc3ccccc23)C1	ZINC001754731249	1440679309	/nfs/dbraw/zinc/67/93/09/1440679309.db2.gz	DWTXEADPWGRTLZ-FQEVSTJZSA-N	0	3	326.440	3.380	20	30		EGEDHN
C#CCNCCN(Cc1ccccc1)C(=O)c1ccc2ncccc2c1	ZINC001754837597	1440697190	/nfs/dbraw/zinc/69/71/90/1440697190.db2.gz	ODKHINXXWPCRFB-UHFFFAOYSA-N	0	3	343.430	3.100	20	30		EGEDHN
CC#CCNCCN(Cc1ccccc1)C(=O)C1(C(F)F)CCCC1	ZINC001754837677	1440697205	/nfs/dbraw/zinc/69/72/05/1440697205.db2.gz	QUDAFQPKCSNGOQ-UHFFFAOYSA-N	0	3	348.437	3.454	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@]2(CO)CCCN(CC/C=C\CCC)C2)CC1	ZINC001754857724	1440700599	/nfs/dbraw/zinc/70/05/99/1440700599.db2.gz	NCBDQARIVFOTLQ-RMUOZIPVSA-N	0	3	348.531	3.422	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@@H](CCNCc2ncc(C)s2)C1	ZINC001754928408	1440710229	/nfs/dbraw/zinc/71/02/29/1440710229.db2.gz	PHNLQMZHDHKOPQ-HZPDHXFCSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](CCNCc3cnc(C)o3)C2)CC1	ZINC001754931112	1440710546	/nfs/dbraw/zinc/71/05/46/1440710546.db2.gz	UUWBTVTYPPNINH-INIZCTEOSA-N	0	3	331.460	3.058	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCN(C(=O)CC2CCC(OC)CC2)C1	ZINC001754944205	1440712422	/nfs/dbraw/zinc/71/24/22/1440712422.db2.gz	VNOWUXRUTQQZCJ-AQFXKWCLSA-N	0	3	342.911	3.162	20	30		EGEDHN
C#CCCN(C)Cc1ccccc1CNC(=O)C1Cc2ccccc2C1	ZINC001754946358	1440713305	/nfs/dbraw/zinc/71/33/05/1440713305.db2.gz	FTPCFPOZLXGRIN-UHFFFAOYSA-N	0	3	346.474	3.173	20	30		EGEDHN
C#CCN[C@@H](C)c1ccc(CNC(=O)c2c(F)cccc2OC)cc1	ZINC001754948343	1440714210	/nfs/dbraw/zinc/71/42/10/1440714210.db2.gz	YLXVBWGZVGGSRJ-AWEZNQCLSA-N	0	3	340.398	3.048	20	30		EGEDHN
C=CCCCN1CCN([C@H]2CCN(C(=O)C3=CCCCCC3)C2)CC1	ZINC001755018064	1440726385	/nfs/dbraw/zinc/72/63/85/1440726385.db2.gz	TVCUJLAYRJLWFM-FQEVSTJZSA-N	0	3	345.531	3.062	20	30		EGEDHN
C[C@H](CC(=O)N[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1)C1CC1	ZINC001755034806	1440733442	/nfs/dbraw/zinc/73/34/42/1440733442.db2.gz	ZKUNEFUALLNLAS-OXQOHEQNSA-N	0	3	339.483	3.465	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NCc1ccc2c(c1)CN(C(C)C)C2	ZINC001755101567	1440752708	/nfs/dbraw/zinc/75/27/08/1440752708.db2.gz	PYFYVMPBSAZNOP-UHFFFAOYSA-N	0	3	332.447	3.251	20	30		EGEDHN
CC(C)CC(=O)N[C@@H]1CCN(Cc2cccc(C#N)c2)CC1(C)C	ZINC001755136579	1440758462	/nfs/dbraw/zinc/75/84/62/1440758462.db2.gz	BVEUVIXWQDEDSN-GOSISDBHSA-N	0	3	327.472	3.321	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)CCc2ccc(C)cc2C)C(C)(C)C1	ZINC001755143269	1440761948	/nfs/dbraw/zinc/76/19/48/1440761948.db2.gz	YTUWPHGLLIYXHD-FQEVSTJZSA-N	0	3	340.511	3.476	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)CCCC(C)=O)CC1	ZINC001755181938	1440771259	/nfs/dbraw/zinc/77/12/59/1440771259.db2.gz	DAAXPVGBGFBMHP-UHFFFAOYSA-N	0	3	328.884	3.059	20	30		EGEDHN
CC/C(C)=C/C(=O)N1CCC[C@@H]1CN(C)Cc1ccc(C#N)cc1	ZINC001755192404	1440775223	/nfs/dbraw/zinc/77/52/23/1440775223.db2.gz	FCLMVOLFUWLYJJ-APEZIOSESA-N	0	3	325.456	3.337	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H]([C@@H]2CCN(Cc3cncs3)C2)C1	ZINC001755203187	1440781142	/nfs/dbraw/zinc/78/11/42/1440781142.db2.gz	SCUKXAOEFILDTN-JKSUJKDBSA-N	0	3	333.501	3.170	20	30		EGEDHN
CC(C)=C(C)CC(=O)N[C@@H](C)[C@@H](C)NCC#Cc1ccc(F)cc1	ZINC001755250239	1440791640	/nfs/dbraw/zinc/79/16/40/1440791640.db2.gz	VUAJQTYKRWOLBV-SJORKVTESA-N	0	3	330.447	3.406	20	30		EGEDHN
C[C@H](CNC(=O)C#CC1CC1)N(C)[C@@H](C)c1ccc(F)c(Cl)c1	ZINC001755299890	1440808127	/nfs/dbraw/zinc/80/81/27/1440808127.db2.gz	IFFZIUTTYKVURI-OLZOCXBDSA-N	0	3	336.838	3.390	20	30		EGEDHN
C[C@@H](CNC(=O)C#CC1CC1)N(C)Cc1ccccc1C(F)(F)F	ZINC001755300234	1440808269	/nfs/dbraw/zinc/80/82/69/1440808269.db2.gz	MLRVHOYTLKBTPA-ZDUSSCGKSA-N	0	3	338.373	3.055	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H](C)N(C)CCOc2cccc(F)c2)CC1	ZINC001755314905	1440815239	/nfs/dbraw/zinc/81/52/39/1440815239.db2.gz	IXRIULAXQUAREF-INIZCTEOSA-N	0	3	348.462	3.387	20	30		EGEDHN
C=C(Cl)CNCCCOC1CCN(C(=O)C2CC(C)(C)C2)CC1	ZINC001755345349	1440826370	/nfs/dbraw/zinc/82/63/70/1440826370.db2.gz	NORQOOUOGUHCJY-UHFFFAOYSA-N	0	3	342.911	3.162	20	30		EGEDHN
CCCC[C@H](CNCC#Cc1ccccc1)NC(=O)c1ccncc1	ZINC001755356071	1440829577	/nfs/dbraw/zinc/82/95/77/1440829577.db2.gz	DYOXAKJDGJXFII-HXUWFJFHSA-N	0	3	335.451	3.012	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)C(C)(C)c1ccc(F)cc1	ZINC001755367903	1440835949	/nfs/dbraw/zinc/83/59/49/1440835949.db2.gz	KWQHGDWMNUUEFM-IBGZPJMESA-N	0	3	344.474	3.487	20	30		EGEDHN
Cc1cc(CN2C[C@H](NC(=O)C#CC3CC3)C(C)(C)C2)c(C)s1	ZINC001755409242	1440845308	/nfs/dbraw/zinc/84/53/08/1440845308.db2.gz	YCRFKUSRNOEYCG-KRWDZBQOSA-N	0	3	330.497	3.105	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)[C@@H](C)CCc2ccccc2F)C(C)(C)C1	ZINC001755412373	1440846883	/nfs/dbraw/zinc/84/68/83/1440846883.db2.gz	UCMBABYIANBDKW-LPHOPBHVSA-N	0	3	344.474	3.244	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)CCCc2sccc2C)C(C)(C)C1	ZINC001755416212	1440848827	/nfs/dbraw/zinc/84/88/27/1440848827.db2.gz	PMVAWCBSKHCAEA-QGZVFWFLSA-N	0	3	332.513	3.229	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1CN([C@@H](C)c2ccccc2)CC1(C)C	ZINC001755416116	1440848985	/nfs/dbraw/zinc/84/89/85/1440848985.db2.gz	OYJWORAJYHTUFZ-FUHWJXTLSA-N	0	3	330.472	3.167	20	30		EGEDHN
CCCC[C@H](C)C(=O)NC[C@@H]1[C@H]2CN(Cc3cccc(C#N)c3)C[C@H]21	ZINC001755421147	1440850001	/nfs/dbraw/zinc/85/00/01/1440850001.db2.gz	ROXGTKUGMRYZQK-MVJPYGJCSA-N	0	3	339.483	3.179	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@@H]2CN(Cc3ccnc(Cl)c3)C[C@H]2C1	ZINC001755449238	1440852852	/nfs/dbraw/zinc/85/28/52/1440852852.db2.gz	DDNPLXHFPCPCRU-BRWVUGGUSA-N	0	3	347.890	3.418	20	30		EGEDHN
C#CCCCCCC(=O)N1C[C@@]2(C)CN(C[C@@H](F)CC)C[C@@]2(C)C1	ZINC001755461711	1440857556	/nfs/dbraw/zinc/85/75/56/1440857556.db2.gz	DNYPRLUCRYTGGG-YSIASYRMSA-N	0	3	336.495	3.489	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1C[C@H](CNCc2cc(C#N)ccc2F)C1	ZINC001755470796	1440858817	/nfs/dbraw/zinc/85/88/17/1440858817.db2.gz	DZOQBEIGSJADNP-JCNLHEQBSA-N	0	3	329.419	3.038	20	30		EGEDHN
C=C(Cl)CNCCC[C@H](C)NC(=O)c1cc2nc(C)ccc2o1	ZINC001755521386	1440865021	/nfs/dbraw/zinc/86/50/21/1440865021.db2.gz	HEOZVLOYOLLBOQ-LBPRGKRZSA-N	0	3	335.835	3.377	20	30		EGEDHN
CN(CC#Cc1ccccc1)C1CCN(C(=O)[C@@H]2CC[C@H](F)C2)CC1	ZINC001755532581	1440867908	/nfs/dbraw/zinc/86/79/08/1440867908.db2.gz	SIILJLBUWIVURW-MOPGFXCFSA-N	0	3	342.458	3.099	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC(N(C)CC#Cc2ccc(F)cc2)CC1	ZINC001755532684	1440868118	/nfs/dbraw/zinc/86/81/18/1440868118.db2.gz	WQDSFEAKAWXFNT-UHFFFAOYSA-N	0	3	342.458	3.312	20	30		EGEDHN
CC[C@@H](C)CC(=O)N(C)[C@@H](CNCc1cc(C#N)ccc1F)C1CC1	ZINC001755570569	1440876752	/nfs/dbraw/zinc/87/67/52/1440876752.db2.gz	DMQCQRVXRRPZSC-KUHUBIRLSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C(Br)CNC[C@H](C1CC1)N(C)C(=O)C(C)=C1CCC1	ZINC001755570822	1440876927	/nfs/dbraw/zinc/87/69/27/1440876927.db2.gz	JPWFSUHEKLCRQD-OAHLLOKOSA-N	0	3	341.293	3.222	20	30		EGEDHN
CCCC[C@@H](C)C(=O)N(C)C[C@H](C)NCc1ccc(F)c(C#N)c1	ZINC001755585765	1440880382	/nfs/dbraw/zinc/88/03/82/1440880382.db2.gz	USNJBYDMFWFIIK-CABCVRRESA-N	0	3	333.451	3.460	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N(C)C[C@@H](C)NCc1ccc(OC)c(C#N)c1	ZINC001755602069	1440884300	/nfs/dbraw/zinc/88/43/00/1440884300.db2.gz	PRIRTLNHNBKSQN-UBYXTUIOSA-N	0	3	341.455	3.026	20	30		EGEDHN
CC#CCN[C@@H]1C[C@@H](C)N(C(=O)c2cc3c(o2)c(F)ccc3C)C1	ZINC001755685510	1440895861	/nfs/dbraw/zinc/89/58/61/1440895861.db2.gz	YMEIHILYSMVNHB-ZIAGYGMSSA-N	0	3	328.387	3.096	20	30		EGEDHN
CC#CCN[C@@H]1C[C@H](C)N(C(=O)c2ccc(Cl)c3occc32)C1	ZINC001755691597	1440896787	/nfs/dbraw/zinc/89/67/87/1440896787.db2.gz	ZMYQZQRZKYWZAH-QWHCGFSZSA-N	0	3	330.815	3.302	20	30		EGEDHN
C=CCOCCN1CC[C@@]2(NC(=O)C(F)=C3CCCC3)CCC[C@H]12	ZINC001755699416	1440899334	/nfs/dbraw/zinc/89/93/34/1440899334.db2.gz	WFWGXUSPJSQBAI-LPHOPBHVSA-N	0	3	336.451	3.100	20	30		EGEDHN
Cc1cc(F)ccc1CN1CC[C@@]2(NC(=O)C#CC3CC3)CCC[C@@H]12	ZINC001755700163	1440899610	/nfs/dbraw/zinc/89/96/10/1440899610.db2.gz	ZIWIBPNOUMWAEG-CTNGQTDRSA-N	0	3	340.442	3.161	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CCCN(CCOc2ccc(OC)cc2)[C@H]1C	ZINC001755713785	1440904435	/nfs/dbraw/zinc/90/44/35/1440904435.db2.gz	DCTNCXOSFPLNOA-QFBILLFUSA-N	0	3	346.471	3.009	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CC[C@@H](CNCc2nc(C)sc2C)C1	ZINC001755742885	1440911957	/nfs/dbraw/zinc/91/19/57/1440911957.db2.gz	GEBAHWLNYZWZJE-HUUCEWRRSA-N	0	3	335.517	3.347	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](NCc3cccnc3)C(C)(C)C2)CCC1	ZINC001755761130	1440914977	/nfs/dbraw/zinc/91/49/77/1440914977.db2.gz	BYQVKCBXSPOKHA-QGZVFWFLSA-N	0	3	327.472	3.155	20	30		EGEDHN
C=CCN(C)CCN(C(=O)c1csc(-c2ccoc2)n1)C(C)C	ZINC001755814976	1440922842	/nfs/dbraw/zinc/92/28/42/1440922842.db2.gz	WEEPBOHDTDNFDQ-UHFFFAOYSA-N	0	3	333.457	3.372	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H](CNCC#Cc2ccccc2)C(C)(C)C)co1	ZINC001755823925	1440926500	/nfs/dbraw/zinc/92/65/00/1440926500.db2.gz	PLINXKPTUOMDDH-IBGZPJMESA-N	0	3	338.451	3.374	20	30		EGEDHN
CC(C)(C)[C@H](CNCc1ccc(C#N)s1)NC(=O)C1CC2(CC2)C1	ZINC001755831861	1440929061	/nfs/dbraw/zinc/92/90/61/1440929061.db2.gz	ABGHJJUZLXMNSD-INIZCTEOSA-N	0	3	345.512	3.430	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H](C)C2CCN(CC#CC)CC2)CCCCC1	ZINC001755850023	1440934553	/nfs/dbraw/zinc/93/45/53/1440934553.db2.gz	BNLUBGAQXLWIIA-SFHVURJKSA-N	0	3	328.500	3.200	20	30		EGEDHN
CC#CCCCC(=O)N(C)C1CC(NCc2cccc(Cl)n2)C1	ZINC001755859671	1440936345	/nfs/dbraw/zinc/93/63/45/1440936345.db2.gz	BXUHTWYZOSBYBG-UHFFFAOYSA-N	0	3	333.863	3.008	20	30		EGEDHN
CC#CCN1CCC(C2(NC(=O)CCc3cccc(C)c3)CC2)CC1	ZINC001755868932	1440938467	/nfs/dbraw/zinc/93/84/67/1440938467.db2.gz	MPTIWIUBLWCOBF-UHFFFAOYSA-N	0	3	338.495	3.312	20	30		EGEDHN
C=C(C)[C@@H](CO)[NH2+][C@H](C)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1	ZINC000823873138	946495929	/nfs/dbraw/zinc/49/59/29/946495929.db2.gz	JIGIHJMBBPDJIG-AUUYWEPGSA-N	0	3	349.438	3.121	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)[NH2+]Cc1ccc(OC)c(-c2nnn[n-]2)c1	ZINC001573325447	947360343	/nfs/dbraw/zinc/36/03/43/947360343.db2.gz	CGOPYAMDAWLJTK-QGZVFWFLSA-N	0	3	349.438	3.152	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)[NH2+]Cc1ccc(OC)c(-c2nn[n-]n2)c1	ZINC001573325447	947360358	/nfs/dbraw/zinc/36/03/58/947360358.db2.gz	CGOPYAMDAWLJTK-QGZVFWFLSA-N	0	3	349.438	3.152	20	30		EGEDHN
CN1CCC(NC(=O)c2ccccc2Oc2ccccc2C#N)CC1	ZINC000181175184	530050633	/nfs/dbraw/zinc/05/06/33/530050633.db2.gz	QDESEICKHKVBDI-UHFFFAOYSA-N	0	3	335.407	3.175	20	30		EGEDHN
Cn1cc(CNc2ccc(OCCN3CCCCC3)cc2)cc1C#N	ZINC000191358315	239062274	/nfs/dbraw/zinc/06/22/74/239062274.db2.gz	ZAKBFDZABSTTPW-UHFFFAOYSA-N	0	3	338.455	3.374	20	30		EGEDHN
COc1ccsc1[C@@H](C)NC1CCN(c2ccc(C#N)cn2)CC1	ZINC000372117597	242042599	/nfs/dbraw/zinc/04/25/99/242042599.db2.gz	UVHOKYLWLOEJRI-CYBMUJFWSA-N	0	3	342.468	3.343	20	30		EGEDHN
C[C@@H](C(=O)N(CCN(C)C)Cc1cccc(C#N)c1)c1cccs1	ZINC000078121373	217024397	/nfs/dbraw/zinc/02/43/97/217024397.db2.gz	FSMJUUJBPNGMCK-OAHLLOKOSA-N	0	3	341.480	3.314	20	30		EGEDHN
CN(Cc1ccccc1C#N)C1CCN(CCc2ccccn2)CC1	ZINC000078969131	217160042	/nfs/dbraw/zinc/16/00/42/217160042.db2.gz	WTMJPYSHVULXAS-UHFFFAOYSA-N	0	3	334.467	3.092	20	30		EGEDHN
Cn1cc(CN2CCC[C@H](c3nc(-c4ccccc4)n[nH]3)C2)cc1C#N	ZINC000377679457	169059631	/nfs/dbraw/zinc/05/96/31/169059631.db2.gz	LUNPMWNEAQSLRN-KRWDZBQOSA-N	0	3	346.438	3.061	20	30		EGEDHN
C#CCNC(=O)CCN[C@@H](C)c1sc(-c2ccc(C)cc2)nc1C	ZINC000268775709	252225811	/nfs/dbraw/zinc/22/58/11/252225811.db2.gz	AFTGZSAJGREORP-AWEZNQCLSA-N	0	3	341.480	3.217	20	30		EGEDHN
COc1ccc([C@H](CNCc2ccc(C#N)o2)N2CCCCC2)cc1	ZINC000174241299	533180896	/nfs/dbraw/zinc/18/08/96/533180896.db2.gz	PDXAKKNNTACQQE-FQEVSTJZSA-N	0	3	339.439	3.477	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1CCC[C@@H]1c1c(C)n[nH]c1C	ZINC000130711070	533504164	/nfs/dbraw/zinc/50/41/64/533504164.db2.gz	BDDUCFCBJNZNFS-MRXNPFEDSA-N	0	3	340.427	3.123	20	30		EGEDHN
C[C@H](c1ccc(C#N)cc1)N1CCC[C@H](CNC(=O)c2ccco2)C1	ZINC000338375413	141111553	/nfs/dbraw/zinc/11/15/53/141111553.db2.gz	FONINRKNPSUGRO-NVXWUHKLSA-N	0	3	337.423	3.354	20	30		EGEDHN
C[C@@H](NCCNC(=O)c1c(F)cccc1F)c1ccc(C#N)c(F)c1	ZINC000346226104	141185103	/nfs/dbraw/zinc/18/51/03/141185103.db2.gz	XRSRNKFAOAZZRR-LLVKDONJSA-N	0	3	347.340	3.056	20	30		EGEDHN
Cn1cc(CNC[C@@H]2Cc3ccccc3O2)c(-c2ccc(C#N)cc2)n1	ZINC000350627376	141257052	/nfs/dbraw/zinc/25/70/52/141257052.db2.gz	RCVQTJBBKXJLFM-IBGZPJMESA-N	0	3	344.418	3.052	20	30		EGEDHN
N#Cc1csc(CNC[C@H](CO)Cc2c(F)cccc2Cl)c1	ZINC000344678657	144208907	/nfs/dbraw/zinc/20/89/07/144208907.db2.gz	MMNAGSREJOLFAE-GFCCVEGCSA-N	0	3	338.835	3.353	20	30		EGEDHN
CCN(C)CCNC(=O)c1ccc(Oc2ccc(C#N)cc2C)cc1	ZINC000120343504	152268864	/nfs/dbraw/zinc/26/88/64/152268864.db2.gz	VDOUWEYNBKMCBO-UHFFFAOYSA-N	0	3	337.423	3.341	20	30		EGEDHN
N#Cc1cc(NC[C@@H](c2cccc(Cl)c2)N2CCCC2)ccn1	ZINC000341540871	155343696	/nfs/dbraw/zinc/34/36/96/155343696.db2.gz	CAIAYEOVPMPQQU-SFHVURJKSA-N	0	3	326.831	3.278	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H](O)COc1ccccc1Cl	ZINC000192706742	153254886	/nfs/dbraw/zinc/25/48/86/153254886.db2.gz	JHVMVTAFGXNSQO-MRXNPFEDSA-N	0	3	330.815	3.083	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)NC[C@H](C)N(C)C1CC1	ZINC000339852044	155002781	/nfs/dbraw/zinc/00/27/81/155002781.db2.gz	YLBCCXGORFOWOY-NSHDSACASA-N	0	3	327.453	3.294	20	30		EGEDHN
CN(C)CCN(Cc1cccc(F)c1)Cc1ccc(C#N)cc1F	ZINC000349063073	156339505	/nfs/dbraw/zinc/33/95/05/156339505.db2.gz	OUAIUJKKGXGZTJ-UHFFFAOYSA-N	0	3	329.394	3.400	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)s1)Cc1ccc(F)cc1F	ZINC000349065175	156341528	/nfs/dbraw/zinc/34/15/28/156341528.db2.gz	YEIBFGLKDAGYCO-UHFFFAOYSA-N	0	3	335.423	3.462	20	30		EGEDHN
CS[C@@H]1CN(c2cc(C#N)ccc2C(F)(F)F)C[C@H]1N(C)C	ZINC000345351313	286708671	/nfs/dbraw/zinc/70/86/71/286708671.db2.gz	ROLFHAHJGOIHRY-ZIAGYGMSSA-N	0	3	329.391	3.059	20	30		EGEDHN
Cc1cc(CN2CCC[C@H](CNC(=O)c3ccco3)C2)ccc1C#N	ZINC000338343973	163217319	/nfs/dbraw/zinc/21/73/19/163217319.db2.gz	CPCRZZAJFCQEFZ-QGZVFWFLSA-N	0	3	337.423	3.102	20	30		EGEDHN
C[C@H](NC(=O)Cc1c(F)cccc1C#N)[C@H](c1ccccc1)N(C)C	ZINC000354768781	166026965	/nfs/dbraw/zinc/02/69/65/166026965.db2.gz	YJYIVUUJEBGDIM-VBKZILBWSA-N	0	3	339.414	3.047	20	30		EGEDHN
COC(=O)[C@@H]1CN(Cc2cc(C#N)cs2)C[C@@H]1c1ccccc1	ZINC000343636576	164000514	/nfs/dbraw/zinc/00/05/14/164000514.db2.gz	IZXHYSZKGWOLDX-IAGOWNOFSA-N	0	3	326.421	3.008	20	30		EGEDHN
C[C@H](NCc1ccc(CN2CCOCC2)cc1)c1cccc(C#N)c1	ZINC000344087998	164100737	/nfs/dbraw/zinc/10/07/37/164100737.db2.gz	MVMGYMABBCYLFI-KRWDZBQOSA-N	0	3	335.451	3.241	20	30		EGEDHN
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)c1ccc(C#N)cc1	ZINC000181638392	287054795	/nfs/dbraw/zinc/05/47/95/287054795.db2.gz	DXRMVUYGPKPROO-UTKZUKDTSA-N	0	3	347.462	3.443	20	30		EGEDHN
CCN1C[C@H](C)N(Cc2ccc(C#N)cc2Br)C[C@@H]1C	ZINC000350991621	165089843	/nfs/dbraw/zinc/08/98/43/165089843.db2.gz	ONFJQCIERDDERV-STQMWFEESA-N	0	3	336.277	3.235	20	30		EGEDHN
CNc1ccc(C#N)cc1NC(=O)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000351674891	165128015	/nfs/dbraw/zinc/12/80/15/165128015.db2.gz	RLMRCCPPDBNCPN-GOSISDBHSA-N	0	3	348.450	3.451	20	30		EGEDHN
C[C@@H](NCCC(=O)Nc1cccc(C#N)c1)c1ccc2n[nH]cc2c1	ZINC000353328613	165732411	/nfs/dbraw/zinc/73/24/11/165732411.db2.gz	MWINZAHKVULHON-CYBMUJFWSA-N	0	3	333.395	3.114	20	30		EGEDHN
CC(C)C[C@@H](C)N1CCN(c2oc(-c3ccco3)nc2C#N)CC1	ZINC000355747729	166295955	/nfs/dbraw/zinc/29/59/55/166295955.db2.gz	SIDYMENCOUYSMU-CQSZACIVSA-N	0	3	328.416	3.363	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@H](NCc3cccc4[nH]ccc43)C2=O)cc1	ZINC000355772969	166303023	/nfs/dbraw/zinc/30/30/23/166303023.db2.gz	MCAKNTLVAVBYIL-FQEVSTJZSA-N	0	3	344.418	3.325	20	30		EGEDHN
COc1cc2c(cc1OC)[C@@H](NCCOc1ccc(C#N)cc1)CC2	ZINC000358970397	167023288	/nfs/dbraw/zinc/02/32/88/167023288.db2.gz	ULQRKJYBEVTLOX-SFHVURJKSA-N	0	3	338.407	3.231	20	30		EGEDHN
C[C@@H]1[C@@H](NC(=O)c2cccc(F)c2C#N)CCN1Cc1ccccc1	ZINC000359841645	167245787	/nfs/dbraw/zinc/24/57/87/167245787.db2.gz	OURWSSVMMOOICC-KUHUBIRLSA-N	0	3	337.398	3.090	20	30		EGEDHN
C[C@H](C(=O)N[C@H]1CCN(Cc2ccccc2)C1)c1cccc(C#N)c1	ZINC000359890887	167260074	/nfs/dbraw/zinc/26/00/74/167260074.db2.gz	XTJVLDOSJIVTMZ-JXFKEZNVSA-N	0	3	333.435	3.052	20	30		EGEDHN
CC(C)(C)N1C[C@H](N[C@@H]2CCCCc3cc(C#N)ccc32)CC1=O	ZINC000360664320	167382911	/nfs/dbraw/zinc/38/29/11/167382911.db2.gz	PAQBXWRXSYBUTA-SJLPKXTDSA-N	0	3	325.456	3.315	20	30		EGEDHN
N#Cc1ccc(Br)c(CN2CC[C@@H]([C@H]3CCOC3)C2)c1	ZINC000365192976	168032754	/nfs/dbraw/zinc/03/27/54/168032754.db2.gz	YTEVJGPJBRIWOZ-KGLIPLIRSA-N	0	3	335.245	3.179	20	30		EGEDHN
N#Cc1ccccc1OCCN1CCC(n2cc(Cl)cn2)CC1	ZINC000367850797	168277826	/nfs/dbraw/zinc/27/78/26/168277826.db2.gz	ABXGVKUFCZMHJH-UHFFFAOYSA-N	0	3	330.819	3.124	20	30		EGEDHN
CC(C)(C)OC1CCN(C(=O)C(C#N)Cc2ccc(C#N)cc2)CC1	ZINC000280160761	270039761	/nfs/dbraw/zinc/03/97/61/270039761.db2.gz	RZGMBIACOACRKA-KRWDZBQOSA-N	0	3	339.439	3.047	20	30		EGEDHN
CC[C@@H](Cc1ccc(C)cc1)N(C)CC(=O)NCc1cccc(C#N)c1	ZINC000441361251	270052222	/nfs/dbraw/zinc/05/22/22/270052222.db2.gz	UYIMVXZFBDWSCA-NRFANRHFSA-N	0	3	349.478	3.436	20	30		EGEDHN
Cc1nc(N(CCN(C)C)Cc2ccc(F)c(F)c2)ccc1C#N	ZINC000488076262	270056030	/nfs/dbraw/zinc/05/60/30/270056030.db2.gz	DZKCALWOVYRETF-UHFFFAOYSA-N	0	3	330.382	3.108	20	30		EGEDHN
CCN(C[C@@H](O)COc1ccc(C#N)cc1)[C@@H](C)c1ccc(C#N)cc1	ZINC000299031037	266132637	/nfs/dbraw/zinc/13/26/37/266132637.db2.gz	HWBSDGBUQHMIDI-OXJNMPFZSA-N	0	3	349.434	3.253	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H](CCNCc2ccc(C#N)cc2F)C1	ZINC000269428660	266292807	/nfs/dbraw/zinc/29/28/07/266292807.db2.gz	OOSONPVRHWUFON-AWEZNQCLSA-N	0	3	347.434	3.434	20	30		EGEDHN
CCS[C@@H]1CCCC[C@H]1N[C@@H]1CCN(c2sccc2C#N)C1=O	ZINC000299204477	266346499	/nfs/dbraw/zinc/34/64/99/266346499.db2.gz	GAVYUZUEVCHAOG-RBSFLKMASA-N	0	3	349.525	3.379	20	30		EGEDHN
CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@H]1CCN(C)[C@@H](C)C1	ZINC000466032513	266902413	/nfs/dbraw/zinc/90/24/13/266902413.db2.gz	ISPFVFCYGOBWHR-LPHOPBHVSA-N	0	3	342.487	3.209	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)c1cc(C#N)[nH]c1C)c1ccsc1	ZINC000448693873	267061565	/nfs/dbraw/zinc/06/15/65/267061565.db2.gz	HLXWJOMWADWOCN-INIZCTEOSA-N	0	3	330.457	3.069	20	30		EGEDHN
CN(C)CCOc1cccc(-c2noc(Cc3ccc(C#N)cc3)n2)c1	ZINC000273751220	267097996	/nfs/dbraw/zinc/09/79/96/267097996.db2.gz	CERZSPSSZCDEKL-UHFFFAOYSA-N	0	3	348.406	3.139	20	30		EGEDHN
C[C@@H]1Oc2cc(F)ccc2[C@H]1NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000360325031	267102195	/nfs/dbraw/zinc/10/21/95/267102195.db2.gz	MNFGBUXIYQGUTL-HGQUKEQDSA-N	0	3	349.365	3.018	20	30		EGEDHN
CCOC(=O)N1CCC[C@@H]([C@@H](C)NCc2ccc(C#N)cc2F)C1	ZINC000495544242	267122079	/nfs/dbraw/zinc/12/20/79/267122079.db2.gz	VHBBEHLJMKKHDS-CZUORRHYSA-N	0	3	333.407	3.044	20	30		EGEDHN
CCO[C@H]1CCN(Cc2cn(C)nc2-c2ccc(C#N)cc2)C[C@H]1C	ZINC000449500266	267156010	/nfs/dbraw/zinc/15/60/10/267156010.db2.gz	MVRRDXIZZBHXDQ-BEFAXECRSA-N	0	3	338.455	3.206	20	30		EGEDHN
CCO[C@H]1C[C@@H](NCC(=O)Nc2ccc(C#N)c(Cl)c2)C12CCC2	ZINC000451480294	267157635	/nfs/dbraw/zinc/15/76/35/267157635.db2.gz	OLQCQBVLGCOIES-CVEARBPZSA-N	0	3	347.846	3.087	20	30		EGEDHN
C[C@H](NC(=O)C(C#N)Cc1ccc(C#N)cc1)c1c(F)cccc1F	ZINC000348090421	267175998	/nfs/dbraw/zinc/17/59/98/267175998.db2.gz	TYRSZWOXXCYISD-SWLSCSKDSA-N	0	3	339.345	3.396	20	30		EGEDHN
C[C@H](NCCOc1ccccc1C#N)c1ccc([S@@](C)=O)cc1	ZINC000271719297	267183885	/nfs/dbraw/zinc/18/38/85/267183885.db2.gz	CUSHAYZRTHSPTI-LFVRLGFBSA-N	0	3	328.437	3.025	20	30		EGEDHN
CN(C)Cc1ccc(-c2noc(Cc3c(F)cccc3C#N)n2)cc1	ZINC000507995432	267282973	/nfs/dbraw/zinc/28/29/73/267282973.db2.gz	RLODAZYWEXYXGR-UHFFFAOYSA-N	0	3	336.370	3.400	20	30		EGEDHN
CN(C)[C@@]1(CNc2c(C#N)cnc3c(F)cc(F)cc32)CCSC1	ZINC000530882765	267287947	/nfs/dbraw/zinc/28/79/47/267287947.db2.gz	JSQOMLUAZORPPC-QGZVFWFLSA-N	0	3	348.422	3.234	20	30		EGEDHN
Cc1cc(C)cc(CCNC(=O)C(C#N)Cc2ccc(C#N)cc2)c1	ZINC000280557179	267321315	/nfs/dbraw/zinc/32/13/15/267321315.db2.gz	USWQLEGSYXXGRT-HXUWFJFHSA-N	0	3	331.419	3.216	20	30		EGEDHN
COC(=O)[C@H]1CN(Cc2ccc(C#N)cc2F)C[C@H]1c1ccccc1	ZINC000449751644	267391149	/nfs/dbraw/zinc/39/11/49/267391149.db2.gz	ACEGPBDAMXDALI-ROUUACIJSA-N	0	3	338.382	3.086	20	30		EGEDHN
COc1cc(CNCc2ccc(C#N)c(OC)c2)c2ccccc2n1	ZINC000440822669	267592235	/nfs/dbraw/zinc/59/22/35/267592235.db2.gz	PZOAMKDHDGRLGG-UHFFFAOYSA-N	0	3	333.391	3.413	20	30		EGEDHN
Cc1cc([N-]S(=O)(=O)c2ccc(C#N)cc2C)ccc1C[NH+](C)C	ZINC000414463580	268012169	/nfs/dbraw/zinc/01/21/69/268012169.db2.gz	KHCUKWMGLUPRJF-UHFFFAOYSA-N	0	3	343.452	3.038	20	30		EGEDHN
Cc1ccc([C@@H](CNC(=O)[C@H](C)c2cccc(C#N)c2)N(C)C)cc1	ZINC000462000836	268043727	/nfs/dbraw/zinc/04/37/27/268043727.db2.gz	QRNSPYBAQLLGNP-OXQOHEQNSA-N	0	3	335.451	3.389	20	30		EGEDHN
N#Cc1ccc(CNC2CCC(O)(c3cccnc3)CC2)c(F)c1	ZINC000274424890	268072903	/nfs/dbraw/zinc/07/29/03/268072903.db2.gz	LHFUUCGSIWVKIH-UHFFFAOYSA-N	0	3	325.387	3.012	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCN(c3ccc(F)cc3)C2)c(F)c1	ZINC000269393095	268074355	/nfs/dbraw/zinc/07/43/55/268074355.db2.gz	DGRDWLVNZJTFQN-OAHLLOKOSA-N	0	3	327.378	3.453	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NC[C@@H]2CCCc3ccccc32)cc1	ZINC000279700975	268085429	/nfs/dbraw/zinc/08/54/29/268085429.db2.gz	JJTVNGJQRHPUCC-PMACEKPBSA-N	0	3	343.430	3.477	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCc2ccc(Cl)s2)cc1	ZINC000348084935	268090923	/nfs/dbraw/zinc/09/09/23/268090923.db2.gz	YXTMOQMQINGHFX-CYBMUJFWSA-N	0	3	329.812	3.272	20	30		EGEDHN
N#Cc1c2c(cnc1N1CCCN(Cc3ccccc3)CC1)CCC2	ZINC000425211043	268168711	/nfs/dbraw/zinc/16/87/11/268168711.db2.gz	SUNVOBURACDDNU-UHFFFAOYSA-N	0	3	332.451	3.154	20	30		EGEDHN
N#Cc1cc(NCC2CCN(Cc3ccccc3Cl)CC2)ccn1	ZINC000515392271	268171278	/nfs/dbraw/zinc/17/12/78/268171278.db2.gz	PFXWCZSCBAJFFP-UHFFFAOYSA-N	0	3	340.858	3.353	20	30		EGEDHN
N#Cc1ccc(CNC(=O)[C@@H]2CCCCN2C2CCCC2)cc1F	ZINC000456838318	268230679	/nfs/dbraw/zinc/23/06/79/268230679.db2.gz	NFPVKBGFWLMZPM-SFHVURJKSA-N	0	3	329.419	3.111	20	30		EGEDHN
N#Cc1ccc(CNC(=O)c2cccc(CN3CCCCC3)c2)cc1	ZINC000411337963	268231602	/nfs/dbraw/zinc/23/16/02/268231602.db2.gz	MMSQYRIBKREENX-UHFFFAOYSA-N	0	3	333.435	3.474	20	30		EGEDHN
N#Cc1ccc(NC(=O)NC[C@@H]2CCN2C2CCCCC2)cc1F	ZINC000529101244	268245545	/nfs/dbraw/zinc/24/55/45/268245545.db2.gz	NUVQTJKRNOLONM-INIZCTEOSA-N	0	3	330.407	3.226	20	30		EGEDHN
N#Cc1cccc2c1CCN2C(=O)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000421650093	268294267	/nfs/dbraw/zinc/29/42/67/268294267.db2.gz	FUQGKWFBKPBCLN-LJQANCHMSA-N	0	3	345.446	3.360	20	30		EGEDHN
C[C@H]1C[C@H](N2CCCC2)CN1c1ccc(C#N)cc1Br	ZINC000343614767	274620889	/nfs/dbraw/zinc/62/08/89/274620889.db2.gz	SFMKNUOATVBOGZ-JSGCOSHPSA-N	0	3	334.261	3.384	20	30		EGEDHN
CN(C)CCOc1ccc(NC(=O)/C=C/c2cccc(C#N)c2)cc1	ZINC000046722949	275138422	/nfs/dbraw/zinc/13/84/22/275138422.db2.gz	XOGFSARQSZCDMA-IZZDOVSWSA-N	0	3	335.407	3.151	20	30		EGEDHN
Cc1ccc([C@@H](O)CN2CCCN(c3ccccc3C#N)CC2)cc1	ZINC000266378459	275235176	/nfs/dbraw/zinc/23/51/76/275235176.db2.gz	ANAVTCGZDUZBGG-NRFANRHFSA-N	0	3	335.451	3.112	20	30		EGEDHN
C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000352283032	278257020	/nfs/dbraw/zinc/25/70/20/278257020.db2.gz	ZPGMAIHBCXUBKE-OLZOCXBDSA-N	0	3	334.851	3.454	20	30		EGEDHN
C[C@H](c1ccc(C#N)cc1)N1CC[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000172397488	290220966	/nfs/dbraw/zinc/22/09/66/290220966.db2.gz	CKDHDZBROGAMDS-GDBMZVCRSA-N	0	3	329.444	3.466	20	30		EGEDHN
CN1CC[C@H](NC(=O)/C=C\c2cccc(C#N)c2)[C@@H]1c1ccccc1	ZINC000255121881	308040858	/nfs/dbraw/zinc/04/08/58/308040858.db2.gz	INJVRPJKCMZDAK-AKFUDEIGSA-N	0	3	331.419	3.133	20	30		EGEDHN
C[C@H](N[C@@H](C)[C@H]1CN(Cc2ccccc2)CCO1)c1ccc(C#N)cc1	ZINC000538396242	314244178	/nfs/dbraw/zinc/24/41/78/314244178.db2.gz	XLMVQZHIBNPHSB-NPPFBWRTSA-N	0	3	349.478	3.498	20	30		EGEDHN
C[C@H](NCCNc1ccc(-c2ccccc2)nn1)c1cccc(C#N)c1	ZINC000539496420	314317102	/nfs/dbraw/zinc/31/71/02/314317102.db2.gz	MQYJEKFDJKHLHA-INIZCTEOSA-N	0	3	343.434	3.200	20	30		EGEDHN
C=CCOc1c(Br)cc(CN[C@@H](C)COC)cc1OC	ZINC000060816603	454314996	/nfs/dbraw/zinc/31/49/96/454314996.db2.gz	FHMKBYSNZMOSRG-NSHDSACASA-N	0	3	344.249	3.147	20	30		EGEDHN
CC[C@H]1CN(Cc2cccc(OCc3cccc(C#N)c3)c2)C[C@@H]1O	ZINC000539899867	314350432	/nfs/dbraw/zinc/35/04/32/314350432.db2.gz	XYJZXUHOHFKKAK-FPOVZHCZSA-N	0	3	336.435	3.340	20	30		EGEDHN
N#Cc1cccc(-c2nnc(CN[C@@H]3CCCC34CCOCC4)o2)c1	ZINC000548865169	315056659	/nfs/dbraw/zinc/05/66/59/315056659.db2.gz	MYKBAWAKNRMOFS-MRXNPFEDSA-N	0	3	338.411	3.047	20	30		EGEDHN
N#Cc1cc(NC[C@H](c2ccccc2Cl)N2CCCC2)ccn1	ZINC000552909493	315236893	/nfs/dbraw/zinc/23/68/93/315236893.db2.gz	DKTDOCRLPXGTLL-GOSISDBHSA-N	0	3	326.831	3.278	20	30		EGEDHN
N#Cc1ccnc(Nc2cccc(CN3CCSCC3)c2)c1Cl	ZINC000553039629	315242208	/nfs/dbraw/zinc/24/22/08/315242208.db2.gz	UMYOBUKLNILXCS-UHFFFAOYSA-N	0	3	344.871	3.321	20	30		EGEDHN
CC[C@@H](CNCCS(=O)(=O)c1ccc(C#N)cc1)c1ccccc1	ZINC000562312699	315816759	/nfs/dbraw/zinc/81/67/59/315816759.db2.gz	FPQDUMOQVCHUBD-KRWDZBQOSA-N	0	3	342.464	3.115	20	30		EGEDHN
COc1cccc([C@@H](CNc2ncc3c(c2C#N)CCC3)N(C)C)c1	ZINC000563883553	316085512	/nfs/dbraw/zinc/08/55/12/316085512.db2.gz	LORJVDBMZYMPJY-LJQANCHMSA-N	0	3	336.439	3.165	20	30		EGEDHN
CC1(C)C[C@@H](NC[C@@H](O)COc2ccc(C#N)cc2)c2ccccc21	ZINC000564854045	316218832	/nfs/dbraw/zinc/21/88/32/316218832.db2.gz	KJSAYLRUFYNWSK-OXQOHEQNSA-N	0	3	336.435	3.310	20	30		EGEDHN
C=CCOCCCN(C)[C@@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O	ZINC000347962011	456431743	/nfs/dbraw/zinc/43/17/43/456431743.db2.gz	HMSSUGZDQUJAOG-HZPDHXFCSA-N	0	3	330.255	3.476	20	30		EGEDHN
N#Cc1cnn2cc(CN3CCC[C@H](c4ccccc4)CC3)cnc12	ZINC000580834665	325300521	/nfs/dbraw/zinc/30/05/21/325300521.db2.gz	QRAPYTQXYOMHKA-SFHVURJKSA-N	0	3	331.423	3.371	20	30		EGEDHN
N#Cc1ccc([C@H](N[C@H]2CC[C@@H](c3ccc(F)cc3)C2)C(N)=O)cc1	ZINC000580987020	325317107	/nfs/dbraw/zinc/31/71/07/325317107.db2.gz	BQSBMUIDSKDECO-NEWSRXKRSA-N	0	3	337.398	3.150	20	30		EGEDHN
CC(C)(CNCCS(=O)(=O)c1ccc(C#N)cc1)C1CCCC1	ZINC000583494657	325529124	/nfs/dbraw/zinc/52/91/24/325529124.db2.gz	AFJNOAWAWONRHZ-UHFFFAOYSA-N	0	3	334.485	3.138	20	30		EGEDHN
C=CCN(C)CCN(CC)CC(=O)Nc1c(Cl)cccc1Cl	ZINC000429723140	458362468	/nfs/dbraw/zinc/36/24/68/458362468.db2.gz	MQFNQUTZSXXTIH-UHFFFAOYSA-N	0	3	344.286	3.372	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1N[C@H](C)C(=O)Nc1ccc(Cl)c(Cl)c1	ZINC000451607891	458483402	/nfs/dbraw/zinc/48/34/02/458483402.db2.gz	QXORGKLWSIXWKX-FZQKWOKYSA-N	0	3	329.227	3.254	20	30		EGEDHN
CCCN(CC(=O)Nc1ccc(Cl)cc1Cl)C(=O)C(C)C#N	ZINC000510378457	458774438	/nfs/dbraw/zinc/77/44/38/458774438.db2.gz	LJQNGUYNEGPXDN-SNVBAGLBSA-N	0	3	342.226	3.330	20	30		EGEDHN
Cc1cc(N2CCCN(Cc3ccc(C#N)cc3)CC2)nc(C2CC2)n1	ZINC000264693699	455264732	/nfs/dbraw/zinc/26/47/32/455264732.db2.gz	ZWFGQLDCOGGVPQ-UHFFFAOYSA-N	0	3	347.466	3.246	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H]2CCC[C@H]2c2ccccc2)CC1	ZINC000264733397	455272145	/nfs/dbraw/zinc/27/21/45/455272145.db2.gz	HGEKDXZHGDULOC-OALUTQOASA-N	0	3	327.472	3.272	20	30		EGEDHN
CN(CCC#N)C(=O)CCNC1(c2ccc(F)cc2F)CCCC1	ZINC000181256462	455308615	/nfs/dbraw/zinc/30/86/15/455308615.db2.gz	RBIYGSFCYXLFCP-UHFFFAOYSA-N	0	3	335.398	3.086	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(Br)ccc2C)CC1	ZINC000173578490	455309239	/nfs/dbraw/zinc/30/92/39/455309239.db2.gz	JRJHQFVJFHPNDY-UHFFFAOYSA-N	0	3	337.261	3.138	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@H](CO)CC2CC2)cc1OC	ZINC000623472644	460568946	/nfs/dbraw/zinc/56/89/46/460568946.db2.gz	WEBLVUVCAYCXLW-AWEZNQCLSA-N	0	3	325.836	3.164	20	30		EGEDHN
C=CCN(C(=O)CC1(N2CCOCC2)CCCC1)c1ccccc1	ZINC000605368413	460571454	/nfs/dbraw/zinc/57/14/54/460571454.db2.gz	YKBDIPOJDMMWQE-UHFFFAOYSA-N	0	3	328.456	3.241	20	30		EGEDHN
Cc1ccc(NC(=O)N2CCC[C@](C)(C#N)C2)c(OCCN(C)C)c1	ZINC000612309615	460590741	/nfs/dbraw/zinc/59/07/41/460590741.db2.gz	AOCWOLDSVUBATN-LJQANCHMSA-N	0	3	344.459	3.093	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CCC[C@@](C)(C#N)C1)C(C)C	ZINC000612358104	460604824	/nfs/dbraw/zinc/60/48/24/460604824.db2.gz	PYABILOHIADFPI-MJGOQNOKSA-N	0	3	332.492	3.020	20	30		EGEDHN
CC(C)[C@H](CNC(=O)c1ccc(C#N)cc1)N1CCc2ccccc2C1	ZINC000025536199	453777012	/nfs/dbraw/zinc/77/70/12/453777012.db2.gz	LWDKGMSCCHVLMD-NRFANRHFSA-N	0	3	347.462	3.371	20	30		EGEDHN
CN(Cc1cccc(Cl)c1)C[C@H](O)COc1ccc(CC#N)cc1	ZINC000025867048	453788154	/nfs/dbraw/zinc/78/81/54/453788154.db2.gz	ASLHVCSWKLHZBR-SFHVURJKSA-N	0	3	344.842	3.278	20	30		EGEDHN
CCN1CCN(c2ccc(NC(=O)c3ccc(C#N)cc3)c(C)c2)CC1	ZINC000026908784	453808069	/nfs/dbraw/zinc/80/80/69/453808069.db2.gz	HRNBMMHJROXWRU-UHFFFAOYSA-N	0	3	348.450	3.261	20	30		EGEDHN
N#Cc1ccc(S(=O)(=O)CCN(CC2CC2)C2CCCCC2)cc1	ZINC000081513131	453880172	/nfs/dbraw/zinc/88/01/72/453880172.db2.gz	XJUGXZFVQXDXNC-UHFFFAOYSA-N	0	3	346.496	3.377	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(-c3csc(C)n3)cc2)CC1	ZINC000067140044	453905757	/nfs/dbraw/zinc/90/57/57/453905757.db2.gz	UOECTZMGLKWLBD-UHFFFAOYSA-N	0	3	339.464	3.402	20	30		EGEDHN
C=C(C)COc1cccc(NC(=O)NC2CCN(C3CC3)CC2)c1	ZINC000067319616	453921300	/nfs/dbraw/zinc/92/13/00/453921300.db2.gz	PUXVVHNOYLOLDV-UHFFFAOYSA-N	0	3	329.444	3.390	20	30		EGEDHN
N#CC1(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)CCCC1	ZINC000067361616	453924465	/nfs/dbraw/zinc/92/44/65/453924465.db2.gz	FXVFMIDICVNAOH-GOSISDBHSA-N	0	3	325.456	3.099	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@H](C)N1CC[C@H](COCc2ccccc2)C1	ZINC000075866431	453934421	/nfs/dbraw/zinc/93/44/21/453934421.db2.gz	ULOLBDBKPLLMIE-ICSRJNTNSA-N	0	3	344.499	3.338	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2cccc(C#N)c2)C1	ZINC000054719989	453944356	/nfs/dbraw/zinc/94/43/56/453944356.db2.gz	WHRCHIIBEIFKFF-JXFKEZNVSA-N	0	3	348.450	3.193	20	30		EGEDHN
CC(C)n1ncc2cc(C(=O)C(C#N)c3nc4ccccc4[nH]3)cnc21	ZINC000041495234	453969302	/nfs/dbraw/zinc/96/93/02/453969302.db2.gz	CXCWWUUMKPFAOY-CQSZACIVSA-N	0	3	344.378	3.379	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCCN(c3ccc(C#N)cc3F)C2)cc1	ZINC000068991313	454070794	/nfs/dbraw/zinc/07/07/94/454070794.db2.gz	CQTVMGMFUPJICS-SFHVURJKSA-N	0	3	334.398	3.328	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1)C(=O)Nc1ccc(F)c(C#N)c1	ZINC000077500227	454113672	/nfs/dbraw/zinc/11/36/72/454113672.db2.gz	HCQFYYSASBTKQW-UHFFFAOYSA-N	0	3	340.402	3.293	20	30		EGEDHN
CN(C)c1ccccc1CN1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC000078047022	454181114	/nfs/dbraw/zinc/18/11/14/454181114.db2.gz	AMZHSUJDEOBDHZ-UHFFFAOYSA-N	0	3	348.494	3.332	20	30		EGEDHN
Cc1nnc(NC[C@@H](c2cccs2)N2CCCC2)c(C#N)c1C	ZINC000058295791	454181188	/nfs/dbraw/zinc/18/11/88/454181188.db2.gz	USPFWQBTECXEDJ-HNNXBMFYSA-N	0	3	327.457	3.276	20	30		EGEDHN
Cc1cccc(N2CCN(CCCCNc3cnccc3C#N)CC2)c1	ZINC000094135071	454189253	/nfs/dbraw/zinc/18/92/53/454189253.db2.gz	YUWHRKUQZYVZHK-UHFFFAOYSA-N	0	3	349.482	3.276	20	30		EGEDHN
CN(C)CCNC(=O)c1ccc(Sc2ccccc2C#N)cc1	ZINC000130826776	454220046	/nfs/dbraw/zinc/22/00/46/454220046.db2.gz	BLNZVOKXOJCXCH-UHFFFAOYSA-N	0	3	325.437	3.001	20	30		EGEDHN
CCN1CCN(c2ccccc2CN(C)Cc2ccc(C#N)cc2)CC1	ZINC000131192630	454239470	/nfs/dbraw/zinc/23/94/70/454239470.db2.gz	DXEJEIKQJVGNMD-UHFFFAOYSA-N	0	3	348.494	3.332	20	30		EGEDHN
C=CCc1ccc(OC[C@@H](O)CN(C)Cc2cccs2)c(OC)c1	ZINC000046344155	454242311	/nfs/dbraw/zinc/24/23/11/454242311.db2.gz	HJNGQLGNQDQRSV-INIZCTEOSA-N	0	3	347.480	3.357	20	30		EGEDHN
CCn1cc([C@H](C)N[C@@H]2CCCN(c3ccc(C#N)cc3F)C2)cn1	ZINC000160169879	455434084	/nfs/dbraw/zinc/43/40/84/455434084.db2.gz	UZFHKKQXDGEUBR-WMLDXEAASA-N	0	3	341.434	3.233	20	30		EGEDHN
C#CCCOc1ccc(CN2CCC[C@H](Cc3nccn3C)C2)cc1	ZINC000184732472	455438632	/nfs/dbraw/zinc/43/86/32/455438632.db2.gz	VOYVJWKJNBYTBH-LJQANCHMSA-N	0	3	337.467	3.277	20	30		EGEDHN
CO[C@@H](CNCc1cn(CCC#N)nc1-c1ccccc1)C(C)C	ZINC000072924546	454363089	/nfs/dbraw/zinc/36/30/89/454363089.db2.gz	LKTHDQDFMWWPJW-SFHVURJKSA-N	0	3	326.444	3.224	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CNC1(c2cccc(C)c2)CCCC1	ZINC000072962959	454372072	/nfs/dbraw/zinc/37/20/72/454372072.db2.gz	SBHSDHYABKWQCX-KRWDZBQOSA-N	0	3	327.472	3.362	20	30		EGEDHN
COCCOc1ccc([C@H](C)NCc2cccc(C#N)c2)cc1OC	ZINC000047825593	454410350	/nfs/dbraw/zinc/41/03/50/454410350.db2.gz	VVCONDAFARRVIQ-HNNXBMFYSA-N	0	3	340.423	3.443	20	30		EGEDHN
N#Cc1cccc(CNC(=O)NC2CCN(Cc3ccccc3)CC2)c1	ZINC000047970876	454426595	/nfs/dbraw/zinc/42/65/95/454426595.db2.gz	NHILMSSEWLUYFO-UHFFFAOYSA-N	0	3	348.450	3.022	20	30		EGEDHN
C[C@H]1CCCN(C(=O)C2CCN(Cc3ccc(C#N)cc3)CC2)C1	ZINC000048046517	454435494	/nfs/dbraw/zinc/43/54/94/454435494.db2.gz	AYOQHLLUVVYJIK-INIZCTEOSA-N	0	3	325.456	3.029	20	30		EGEDHN
CN1CCC(C(=O)N[C@@H](C#N)c2ccc(Cl)c(Cl)c2)CC1	ZINC000073511009	454444553	/nfs/dbraw/zinc/44/45/53/454444553.db2.gz	INXGOCQUGVUJOL-AWEZNQCLSA-N	0	3	326.227	3.016	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)cc1)C[C@@H](O)COc1ccc(F)cc1	ZINC000063750790	454445208	/nfs/dbraw/zinc/44/52/08/454445208.db2.gz	JCVVFDBUCACVTB-LJQANCHMSA-N	0	3	342.414	3.348	20	30		EGEDHN
CCOC(=O)CC[C@@H]1CCCN(Cc2ccc(C#N)cc2OC)C1	ZINC000121563486	454451916	/nfs/dbraw/zinc/45/19/16/454451916.db2.gz	LVJJHSIZQHDKLU-HNNXBMFYSA-N	0	3	330.428	3.122	20	30		EGEDHN
C=CCN(CC=C)C(=O)NCC(C)(C)N1CCc2ccccc2C1	ZINC000121566588	454453492	/nfs/dbraw/zinc/45/34/92/454453492.db2.gz	QDUCVNDPKHIJHP-UHFFFAOYSA-N	0	3	327.472	3.207	20	30		EGEDHN
N#Cc1cccc(OCCN2CCN(CC3CCCCC3)CC2)c1	ZINC000064130215	454467056	/nfs/dbraw/zinc/46/70/56/454467056.db2.gz	NNULADZTGUVKAC-UHFFFAOYSA-N	0	3	327.472	3.135	20	30		EGEDHN
COc1ccc(CNCc2ccc(O)cc2)cc1OCCCC#N	ZINC000101600161	454475653	/nfs/dbraw/zinc/47/56/53/454475653.db2.gz	PREDLHFOPYLSFQ-UHFFFAOYSA-N	0	3	326.396	3.373	20	30		EGEDHN
COCCSCC(=O)C(C#N)c1nc(-c2ccccc2)cs1	ZINC000073976759	454512320	/nfs/dbraw/zinc/51/23/20/454512320.db2.gz	ACOROKCYVSVESD-ZDUSSCGKSA-N	0	3	332.450	3.366	20	30		EGEDHN
C[C@H](NCc1cccc(C#N)c1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000048744894	454512770	/nfs/dbraw/zinc/51/27/70/454512770.db2.gz	CNGFZAOVTZMPGN-HNNXBMFYSA-N	0	3	349.434	3.066	20	30		EGEDHN
Cc1ccc([C@@H](CNCc2ccc(C#N)cc2)N2CCOCC2)cc1	ZINC000048779406	454514606	/nfs/dbraw/zinc/51/46/06/454514606.db2.gz	PFMCYPTYGXFDRO-OAQYLSRUSA-N	0	3	335.451	3.030	20	30		EGEDHN
C=CCn1c(SCCN2CCCCC2)nnc1-c1cccnc1	ZINC000134209348	454515794	/nfs/dbraw/zinc/51/57/94/454515794.db2.gz	ILMGNBUCCADTER-UHFFFAOYSA-N	0	3	329.473	3.104	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN1CC[C@@H](Nc2ccccc2)C1	ZINC000102845195	454523161	/nfs/dbraw/zinc/52/31/61/454523161.db2.gz	FDGHLCXEKVKAGD-MRXNPFEDSA-N	0	3	340.452	3.135	20	30		EGEDHN
CN(C(=O)c1ccc(C#N)cc1)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000074447782	454583343	/nfs/dbraw/zinc/58/33/43/454583343.db2.gz	DVEOCCOJQZAUQB-FQEVSTJZSA-N	0	3	333.435	3.295	20	30		EGEDHN
N#Cc1cccc(OC2CCN(C[C@H](O)c3ccc(F)cc3)CC2)c1	ZINC000104713499	454598095	/nfs/dbraw/zinc/59/80/95/454598095.db2.gz	UIEDGUHYHJUSJG-FQEVSTJZSA-N	0	3	340.398	3.274	20	30		EGEDHN
CN(C)CCN(Cc1ccc(F)cc1)c1snc(Cl)c1C#N	ZINC000092681846	454610024	/nfs/dbraw/zinc/61/00/24/454610024.db2.gz	CQSMKBPKXNSDJL-UHFFFAOYSA-N	0	3	338.839	3.375	20	30		EGEDHN
CC(C)Oc1ccc(C#N)cc1NC(=O)N1CC[C@@H](N2CCCC2)C1	ZINC000066160851	454662346	/nfs/dbraw/zinc/66/23/46/454662346.db2.gz	ZWQKHTOBUWJFDN-MRXNPFEDSA-N	0	3	342.443	3.047	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(OCC3CC3)cc2)CC1	ZINC000106034281	454674907	/nfs/dbraw/zinc/67/49/07/454674907.db2.gz	OZSJNPKZJHVYSD-UHFFFAOYSA-N	0	3	328.456	3.246	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H]2CCc3cc(F)ccc32)CC1	ZINC000106266180	454688705	/nfs/dbraw/zinc/68/87/05/454688705.db2.gz	MODIFLZHBRQSAO-SFHVURJKSA-N	0	3	331.435	3.153	20	30		EGEDHN
Cc1cccc(N(CCC#N)C(=O)CN2C[C@@H]3CCC[C@@H]3C2)c1C	ZINC000153199802	454769494	/nfs/dbraw/zinc/76/94/94/454769494.db2.gz	SGBLDBORVKANJS-HDICACEKSA-N	0	3	325.456	3.282	20	30		EGEDHN
N#Cc1ccc(S(=O)(=O)CCN[C@H](c2ccccc2)C2CC2)cc1	ZINC000176883917	454795079	/nfs/dbraw/zinc/79/50/79/454795079.db2.gz	CDCSWZRSDICAIY-LJQANCHMSA-N	0	3	340.448	3.073	20	30		EGEDHN
COc1ccc(C#N)cc1NC(=O)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000140949276	454824895	/nfs/dbraw/zinc/82/48/95/454824895.db2.gz	GETGRSCMLJWTHY-SFHVURJKSA-N	0	3	349.434	3.418	20	30		EGEDHN
CCN(CCN1C(=O)c2ccccc2C1=O)[C@H](C)c1ccc(C#N)cc1	ZINC000125777657	454845537	/nfs/dbraw/zinc/84/55/37/454845537.db2.gz	GCLMZATXTBALFH-OAHLLOKOSA-N	0	3	347.418	3.237	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC[C@H]2CCc3ccccc32)CC1	ZINC000111859403	454876879	/nfs/dbraw/zinc/87/68/79/454876879.db2.gz	BLXVNGJCPXJHIT-QGZVFWFLSA-N	0	3	327.472	3.056	20	30		EGEDHN
C=CCOc1cccc(CN(C)[C@@H](CO)c2ccc(OC)cc2)c1	ZINC000126412023	454891686	/nfs/dbraw/zinc/89/16/86/454891686.db2.gz	RLZXORANLVNVBW-FQEVSTJZSA-N	0	3	327.424	3.425	20	30		EGEDHN
C#CCC(C)(C)C(=O)NC[C@H](c1cccc(OC)c1)N(CC)CC	ZINC000185037262	455490269	/nfs/dbraw/zinc/49/02/69/455490269.db2.gz	JAZUETNVFHJGCE-GOSISDBHSA-N	0	3	330.472	3.244	20	30		EGEDHN
COCCN(CCOc1cccc(OC)c1)Cc1ccc(C#N)cc1	ZINC000151478756	454990338	/nfs/dbraw/zinc/99/03/38/454990338.db2.gz	PLIXXFZCEUVRRB-UHFFFAOYSA-N	0	3	340.423	3.094	20	30		EGEDHN
CN(C[C@H]1CCN(Cc2ccc(C#N)cc2)C1)C(=O)OC(C)(C)C	ZINC000170918963	454999517	/nfs/dbraw/zinc/99/95/17/454999517.db2.gz	LZPFBLALOYHFDW-QGZVFWFLSA-N	0	3	329.444	3.247	20	30		EGEDHN
Cc1cc(C)n(Cc2cccc(C(=O)C(C#N)c3ccccn3)c2)n1	ZINC000155462439	455004857	/nfs/dbraw/zinc/00/48/57/455004857.db2.gz	YTUGMVJYRNLRAU-SFHVURJKSA-N	0	3	330.391	3.433	20	30		EGEDHN
C=CCN1CCC(N[C@H](C)c2ncc(Br)s2)CC1	ZINC000179226856	455022776	/nfs/dbraw/zinc/02/27/76/455022776.db2.gz	ODHGBAPSJHJFOF-SNVBAGLBSA-N	0	3	330.295	3.207	20	30		EGEDHN
COCCN(CCCc1ccccc1)C[C@H](O)c1ccc(C#N)cc1	ZINC000155781473	455044904	/nfs/dbraw/zinc/04/49/04/455044904.db2.gz	CWLMJPRGELBURQ-NRFANRHFSA-N	0	3	338.451	3.173	20	30		EGEDHN
COC(=O)c1ccccc1NC(=O)C(C#N)c1nc(C(C)C)cs1	ZINC000128584420	455069579	/nfs/dbraw/zinc/06/95/79/455069579.db2.gz	LXMSAAWCSAJPKR-GFCCVEGCSA-N	0	3	343.408	3.299	20	30		EGEDHN
N#CCc1ccccc1C(=O)NC[C@H](c1ccccc1)N1CCCC1	ZINC000600966526	460660973	/nfs/dbraw/zinc/66/09/73/460660973.db2.gz	PSROGAJJLBBVDO-HXUWFJFHSA-N	0	3	333.435	3.320	20	30		EGEDHN
CN(C)CCN(CC1CCCCC1)C(=O)NCc1cccc(C#N)c1	ZINC000156171140	455089550	/nfs/dbraw/zinc/08/95/50/455089550.db2.gz	CSOBKYHKZDXHPO-UHFFFAOYSA-N	0	3	342.487	3.212	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccccc2N2CCCCC2)CC1	ZINC000171737360	455090337	/nfs/dbraw/zinc/09/03/37/455090337.db2.gz	KLWWYXXNMWNGIL-UHFFFAOYSA-N	0	3	342.487	3.449	20	30		EGEDHN
C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCN2CCC[C@@H]2C1	ZINC000171894988	455100488	/nfs/dbraw/zinc/10/04/88/455100488.db2.gz	CLWQIVRTJYFRRB-LSDHHAIUSA-N	0	3	344.484	3.393	20	30		EGEDHN
CCN1CCN(Cc2ccc(NCc3cc(C#N)cs3)cc2)CC1	ZINC000156355803	455108450	/nfs/dbraw/zinc/10/84/50/455108450.db2.gz	QWXRAQZDGTVLQO-UHFFFAOYSA-N	0	3	340.496	3.369	20	30		EGEDHN
CN(CCN1CCCC1)C(=O)Nc1cccc(C#Cc2ccccn2)c1	ZINC000118822854	455113383	/nfs/dbraw/zinc/11/33/83/455113383.db2.gz	LESJTCUBJCJWRK-UHFFFAOYSA-N	0	3	348.450	3.041	20	30		EGEDHN
Cc1ncsc1CCN1CCCN(c2ccccc2C#N)CC1	ZINC000172527160	455159896	/nfs/dbraw/zinc/15/98/96/455159896.db2.gz	MBXAKMGPLMUAII-UHFFFAOYSA-N	0	3	326.469	3.078	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(CCOC)[C@H](C)c2ccccc2)CC1	ZINC000264375221	455200706	/nfs/dbraw/zinc/20/07/06/455200706.db2.gz	SIFIFJDLWHCBTI-QGZVFWFLSA-N	0	3	345.487	3.056	20	30		EGEDHN
COC(=O)COc1ccc(CN(C)[C@H](C)c2ccc(C#N)cc2)cc1	ZINC000183047029	455216906	/nfs/dbraw/zinc/21/69/06/455216906.db2.gz	JVXPDMZCPQFUIZ-OAHLLOKOSA-N	0	3	338.407	3.303	20	30		EGEDHN
COC[C@@H](NCC(=O)Nc1ccccc1S[C@H](C)CC#N)C1CC1	ZINC000183433395	455292908	/nfs/dbraw/zinc/29/29/08/455292908.db2.gz	OEWYOLOZWIWNFX-CZUORRHYSA-N	0	3	347.484	3.034	20	30		EGEDHN
C[C@](C#N)(NC(=O)CN[C@H](CC1CCC1)c1ccccc1)C1CC1	ZINC000181348536	455321575	/nfs/dbraw/zinc/32/15/75/455321575.db2.gz	BIKBEBHWFQHZES-UYAOXDASSA-N	0	3	325.456	3.316	20	30		EGEDHN
COc1ccc(CN(C)CCc2ccncc2)cc1OCCCC#N	ZINC000183754730	455325327	/nfs/dbraw/zinc/32/53/27/455325327.db2.gz	INJJXXZPRNQLMO-UHFFFAOYSA-N	0	3	339.439	3.447	20	30		EGEDHN
Cc1nc(-c2ccccc2)oc1C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000181432474	455333887	/nfs/dbraw/zinc/33/38/87/455333887.db2.gz	IGGJNBBFAJIZDL-AWEZNQCLSA-N	0	3	346.346	3.006	20	30		EGEDHN
CCNC(=O)c1ccc(CN[C@@H](C)c2ccc(OCC#N)cc2)cc1	ZINC000181506049	455345661	/nfs/dbraw/zinc/34/56/61/455345661.db2.gz	MTVYQADGTXVWHN-HNNXBMFYSA-N	0	3	337.423	3.189	20	30		EGEDHN
CCCN(CC(=O)Nc1sccc1C#N)[C@@H]1[C@H]2CCO[C@H]2C1(C)C	ZINC000265821305	455387968	/nfs/dbraw/zinc/38/79/68/455387968.db2.gz	ATTASWCRNBYTDB-FVQBIDKESA-N	0	3	347.484	3.084	20	30		EGEDHN
Cc1ccccc1CN1CCC(NC(=O)c2ccccc2CC#N)CC1	ZINC000601000602	460670969	/nfs/dbraw/zinc/67/09/69/460670969.db2.gz	VDUQVMPMCOATRO-UHFFFAOYSA-N	0	3	347.462	3.456	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN2CCC[C@H](Cc3nccn3C)C2)cc1	ZINC000184729966	455438006	/nfs/dbraw/zinc/43/80/06/455438006.db2.gz	YHKQNHCUNXMEMP-SJLPKXTDSA-N	0	3	338.455	3.166	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@H](c1ccc(OC)cc1)N1CCCC1	ZINC000184971547	455479614	/nfs/dbraw/zinc/47/96/14/455479614.db2.gz	XCAWQVRYRFHQTL-IBGZPJMESA-N	0	3	328.456	3.142	20	30		EGEDHN
C=CCN(Cc1ccccc1F)C(=O)N[C@H]1CCN(CC2CC2)C1	ZINC000160680573	455487174	/nfs/dbraw/zinc/48/71/74/455487174.db2.gz	DXCCPKBYGGAXIL-KRWDZBQOSA-N	0	3	331.435	3.008	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccccc2CC#N)C1	ZINC000601009781	460674364	/nfs/dbraw/zinc/67/43/64/460674364.db2.gz	IMDKANYNDFOZLH-VQIMIIECSA-N	0	3	333.435	3.318	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1CCC[C@H]1c1cccc(C)c1C	ZINC000246788650	455525884	/nfs/dbraw/zinc/52/58/84/455525884.db2.gz	OYEGHWCUZBOADB-BEFAXECRSA-N	0	3	327.472	3.449	20	30		EGEDHN
C=C(C)COc1cccc(NC(=O)N2CC[C@H](N3CC=CC3)C2)c1	ZINC000176002710	455527201	/nfs/dbraw/zinc/52/72/01/455527201.db2.gz	XHJPYTKVAISFAS-KRWDZBQOSA-N	0	3	327.428	3.120	20	30		EGEDHN
CC[C@H](NCC(=O)N(CCC#N)CCC#N)c1cccc(Cl)c1	ZINC000182603830	455550908	/nfs/dbraw/zinc/55/09/08/455550908.db2.gz	JIZILZMUZCRDMJ-INIZCTEOSA-N	0	3	332.835	3.037	20	30		EGEDHN
C#CC[C@H](N[C@@H](C)c1ccc(NS(C)(=O)=O)cc1)c1ccccc1	ZINC000271445333	455639292	/nfs/dbraw/zinc/63/92/92/455639292.db2.gz	FQTWYGTXCJRBRI-KXBFYZLASA-N	0	3	342.464	3.473	20	30		EGEDHN
C#CC[C@H](N[C@H](C)c1ccc(NS(C)(=O)=O)cc1)c1ccccc1	ZINC000271445321	455639300	/nfs/dbraw/zinc/63/93/00/455639300.db2.gz	FQTWYGTXCJRBRI-BEFAXECRSA-N	0	3	342.464	3.473	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)c1ncnc2ccsc21	ZINC000268282491	455639932	/nfs/dbraw/zinc/63/99/32/455639932.db2.gz	BOHPGMLORFRVMA-UHFFFAOYSA-N	0	3	337.452	3.131	20	30		EGEDHN
CCC[C@H](C)C(=O)NCC/[NH+]=C/c1ccc(N(CC)CC)cc1[O-]	ZINC000292362749	455641376	/nfs/dbraw/zinc/64/13/76/455641376.db2.gz	RDWMMPIBUXXHIT-AUQXIXNCSA-N	0	3	333.476	3.210	20	30		EGEDHN
N#Cc1ccc(OCCN2CCC[C@H]2C[C@@H](O)c2ccco2)cc1	ZINC000268292124	455642654	/nfs/dbraw/zinc/64/26/54/455642654.db2.gz	RYOIKJCBPOGMAA-FUHWJXTLSA-N	0	3	326.396	3.118	20	30		EGEDHN
C=CCN(C(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1)C1CC1	ZINC000271487636	455656594	/nfs/dbraw/zinc/65/65/94/455656594.db2.gz	JJCXOPYQXHKNCR-WMZOPIPTSA-N	0	3	327.472	3.400	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(SC)cc2OC)CC1	ZINC000192651565	455662130	/nfs/dbraw/zinc/66/21/30/455662130.db2.gz	WJONTMLBKOBHSW-UHFFFAOYSA-N	0	3	335.473	3.189	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CC(C)(C)[C@@H]2c2cccnc2)CC1	ZINC000292459331	455669296	/nfs/dbraw/zinc/66/92/96/455669296.db2.gz	ZWGRTSMPIBKVQT-SFHVURJKSA-N	0	3	342.487	3.215	20	30		EGEDHN
C[C@H](N[C@@H]1CCC[C@H](C#N)C1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000192691504	455669864	/nfs/dbraw/zinc/66/98/64/455669864.db2.gz	VHQJTRJBYFWQRU-RLFYNMQTSA-N	0	3	341.455	3.077	20	30		EGEDHN
CCC[C@@H](C)NC(=O)[C@H]1CCCN(Cc2ccc(C#N)cc2C)C1	ZINC000186191844	455713945	/nfs/dbraw/zinc/71/39/45/455713945.db2.gz	KEFSWRUJAIYXAI-APWZRJJASA-N	0	3	327.472	3.384	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N(C)C1CCN(Cc2ccccc2)CC1	ZINC000292670166	455726913	/nfs/dbraw/zinc/72/69/13/455726913.db2.gz	XBVBUALYTAOZIF-UHFFFAOYSA-N	0	3	346.474	3.333	20	30		EGEDHN
C[C@@H]1CN(Cc2cccc(CN[C@H]3CCC[C@@H](C#N)C3)c2)CCO1	ZINC000248855895	455734419	/nfs/dbraw/zinc/73/44/19/455734419.db2.gz	PHJDQHIGWRDRNY-HLIPFELVSA-N	0	3	327.472	3.079	20	30		EGEDHN
C=CCCCC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000271722926	455734882	/nfs/dbraw/zinc/73/48/82/455734882.db2.gz	XEZQTZAQVKCKNH-UHFFFAOYSA-N	0	3	330.472	3.176	20	30		EGEDHN
CC(C)[C@@H](NCCNC(=O)C1N=CC=CC1=O)c1ccc(Cl)cc1	ZINC000271726596	455736388	/nfs/dbraw/zinc/73/63/88/455736388.db2.gz	OMURCLKEBIDHRT-OTZFSBHDSA-N	0	3	347.846	3.153	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H](OC(C)C)c2ccccc2)CC1	ZINC000292794875	455759335	/nfs/dbraw/zinc/75/93/35/455759335.db2.gz	MXADKGDQMAFLFQ-IBGZPJMESA-N	0	3	330.472	3.309	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC[C@@H](OCC)c2ccccc2)CC1	ZINC000193603349	455766727	/nfs/dbraw/zinc/76/67/27/455766727.db2.gz	PJTADFBJHVHMII-LJQANCHMSA-N	0	3	345.487	3.104	20	30		EGEDHN
COc1cc(C)c([C@H](C)NC[C@H](O)c2ccc(C#N)cc2)cc1OC	ZINC000271817022	455772066	/nfs/dbraw/zinc/77/20/66/455772066.db2.gz	VDGYMPQPZHFIHV-KSSFIOAISA-N	0	3	340.423	3.268	20	30		EGEDHN
C=CCN(CCC#N)C(=O)C1(C)CCN(Cc2ccccc2)CC1	ZINC000293949099	455801203	/nfs/dbraw/zinc/80/12/03/455801203.db2.gz	VLZQBDGZPKFNKT-UHFFFAOYSA-N	0	3	325.456	3.217	20	30		EGEDHN
CSc1ccc([C@@H](CNC(=O)C2(C#N)CCCC2)N(C)C)cc1	ZINC000294269033	455809346	/nfs/dbraw/zinc/80/93/46/455809346.db2.gz	GHXPLSPRPMJBAL-MRXNPFEDSA-N	0	3	331.485	3.211	20	30		EGEDHN
C=C[C@H](CC(=O)N1CCN(C2CCOCC2)C[C@H]1C)c1ccccc1	ZINC000278302691	455811203	/nfs/dbraw/zinc/81/12/03/455811203.db2.gz	CHKQMNHUNZIUHV-QZTJIDSGSA-N	0	3	342.483	3.058	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H](C)Cn2ccc3ccccc32)CC1	ZINC000285242152	455811800	/nfs/dbraw/zinc/81/18/00/455811800.db2.gz	BVIVRIYACPPTHW-QGZVFWFLSA-N	0	3	339.483	3.434	20	30		EGEDHN
Cc1sccc1C(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000294366203	455813380	/nfs/dbraw/zinc/81/33/80/455813380.db2.gz	ASGPSFGREOAQES-UHFFFAOYSA-N	0	3	327.453	3.132	20	30		EGEDHN
C=CCOc1cccc(CN2CCC[C@@H](CC(C)(C)C(N)=O)C2)c1	ZINC000294775722	455827397	/nfs/dbraw/zinc/82/73/97/455827397.db2.gz	KPQMHZSOCKWIPR-KRWDZBQOSA-N	0	3	330.472	3.365	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCCOC1CCN(Cc2ccccc2)CC1	ZINC000294824621	455828709	/nfs/dbraw/zinc/82/87/09/455828709.db2.gz	CUXKHHBYCJLRCJ-UHFFFAOYSA-N	0	3	344.499	3.386	20	30		EGEDHN
CC[C@H](N[C@@H]1CCN(Cc2ccccc2)C1=O)c1ccc(C#N)cc1	ZINC000278875541	455851487	/nfs/dbraw/zinc/85/14/87/455851487.db2.gz	XJSZXXWVSSOWPR-VQTJNVASSA-N	0	3	333.435	3.400	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1C(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000278918181	455853277	/nfs/dbraw/zinc/85/32/77/455853277.db2.gz	CRTNOXCTCKYZRH-IJXRJRJASA-N	0	3	342.483	3.137	20	30		EGEDHN
CC[C@H](NC[C@H](O)c1ccc(C#N)cc1)c1ccc(OC)c(OC)c1	ZINC000285476972	455853471	/nfs/dbraw/zinc/85/34/71/455853471.db2.gz	OFLCTQARVFBPKL-ROUUACIJSA-N	0	3	340.423	3.350	20	30		EGEDHN
N#Cc1ccc(CN(C[C@@H](O)COCc2cccs2)C2CC2)cc1	ZINC000194539478	455855374	/nfs/dbraw/zinc/85/53/74/455855374.db2.gz	JOUFEAVEIXYMQF-GOSISDBHSA-N	0	3	342.464	3.162	20	30		EGEDHN
CCN1CCC[C@@H]1CN(Cc1ccc(O)cc1)C(=O)CC(C)(C)C#N	ZINC000279350207	455863952	/nfs/dbraw/zinc/86/39/52/455863952.db2.gz	JHTJUYATHQRFLQ-QGZVFWFLSA-N	0	3	343.471	3.145	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N(CC)Cc1ccc(CN(C)C)cc1)OCC	ZINC000270047547	455865656	/nfs/dbraw/zinc/86/56/56/455865656.db2.gz	LOYSZSCLDKEYIN-IBGZPJMESA-N	0	3	332.488	3.468	20	30		EGEDHN
C=CC[C@H](C)[C@H](C)N[C@@H](C(N)=O)c1cccc(Br)c1	ZINC000279685495	455870604	/nfs/dbraw/zinc/87/06/04/455870604.db2.gz	PEPKTGCGWOCTLK-COPLHBTASA-N	0	3	325.250	3.166	20	30		EGEDHN
C=CCN(CC=C)[C@H](CN[C@@H](c1ncc[nH]1)c1cccnc1)C(C)C	ZINC000279985126	455879571	/nfs/dbraw/zinc/87/95/71/455879571.db2.gz	DVXJASIFYDAOLH-RTBURBONSA-N	0	3	339.487	3.182	20	30		EGEDHN
CC(C)[C@H](CNC(=O)C(C#N)Cc1ccc(C#N)cc1)c1cccnc1	ZINC000280048822	455881195	/nfs/dbraw/zinc/88/11/95/455881195.db2.gz	MBDDBMQIQKUKHH-PMACEKPBSA-N	0	3	346.434	3.192	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NC[C@@H](c1ccccc1)N1CCCC1)OCC	ZINC000270155456	455890099	/nfs/dbraw/zinc/89/00/99/455890099.db2.gz	XGBYDRZOTGRDAM-OALUTQOASA-N	0	3	330.472	3.311	20	30		EGEDHN
CN(CCCC1(C#N)CCOCC1)[C@H](CO)c1ccc(Cl)cc1	ZINC000296361770	455918332	/nfs/dbraw/zinc/91/83/32/455918332.db2.gz	QXQAFJMYJSIVOA-QGZVFWFLSA-N	0	3	336.863	3.406	20	30		EGEDHN
C#CC[C@H](NC(=O)N1CCN(C2CCCC2)CC1)c1ccccc1	ZINC000270384113	455944242	/nfs/dbraw/zinc/94/42/42/455944242.db2.gz	WNOJUHPUAQJCAQ-IBGZPJMESA-N	0	3	325.456	3.021	20	30		EGEDHN
N#Cc1ccc(C(=O)N2CC[C@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000286012833	455960854	/nfs/dbraw/zinc/96/08/54/455960854.db2.gz	ZAQIOTLNXHESPJ-QFIPXVFZSA-N	0	3	345.446	3.296	20	30		EGEDHN
C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC000272496847	455970808	/nfs/dbraw/zinc/97/08/08/455970808.db2.gz	NKWIIYZPTFRSIV-PBHICJAKSA-N	0	3	329.444	3.293	20	30		EGEDHN
CCS[C@H]1CCC[C@H]1NCC(=O)N(CCC#N)c1ccccc1	ZINC000286205531	455999538	/nfs/dbraw/zinc/99/95/38/455999538.db2.gz	QHNZXVIQVZLGJQ-SJORKVTESA-N	0	3	331.485	3.197	20	30		EGEDHN
C=C(C)CN(Cc1ccccc1)C(=O)N[C@@H](C)C1=CCN(C)CC1	ZINC000280767830	456048404	/nfs/dbraw/zinc/04/84/04/456048404.db2.gz	DBZFTRNFPFBWCG-KRWDZBQOSA-N	0	3	327.472	3.425	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H]2C[C@H](c3ccccc3)C2)CC1	ZINC000280860741	456067668	/nfs/dbraw/zinc/06/76/68/456067668.db2.gz	ASNSXAKARJUKTO-UAPYVXQJSA-N	0	3	327.472	3.272	20	30		EGEDHN
C[C@@H]1[C@H](NC(=O)C2(C#N)CCCCC2)CCN1Cc1ccccc1	ZINC000288246296	456090752	/nfs/dbraw/zinc/09/07/52/456090752.db2.gz	OPLZSUMYMLMEIP-SJLPKXTDSA-N	0	3	325.456	3.240	20	30		EGEDHN
CCCCCN(CCO)Cc1ccc(OC)c(OCCCC#N)c1	ZINC000271026063	456102562	/nfs/dbraw/zinc/10/25/62/456102562.db2.gz	DNNYJTGIHFTPEQ-UHFFFAOYSA-N	0	3	334.460	3.362	20	30		EGEDHN
CSC1c2cc(-c3noc(CC(C)(C)C#N)n3)ccc2NC1=O	ZINC000288908452	456109206	/nfs/dbraw/zinc/10/92/06/456109206.db2.gz	KIWWGZFOQQIQKR-CYBMUJFWSA-N	0	3	328.397	3.185	20	30		EGEDHN
CC(C)c1nnc2n1C[C@@H](N[C@@H](C)c1ccc(C#N)cc1F)CC2	ZINC000332696965	456112330	/nfs/dbraw/zinc/11/23/30/456112330.db2.gz	XIRDFIORZPEJRF-JSGCOSHPSA-N	0	3	327.407	3.078	20	30		EGEDHN
CC(C)(C)OC(=O)N1C[C@H]2CCN(Cc3ccc(C#N)cc3)C[C@H]2C1	ZINC000289461451	456126133	/nfs/dbraw/zinc/12/61/33/456126133.db2.gz	GNGFWBVESIRDJJ-MSOLQXFVSA-N	0	3	341.455	3.247	20	30		EGEDHN
CC[C@@H]1CN(Cc2cn(CCC#N)nc2-c2ccccc2)CCCO1	ZINC000281147669	456146260	/nfs/dbraw/zinc/14/62/60/456146260.db2.gz	FFVHENFBEXWKKQ-LJQANCHMSA-N	0	3	338.455	3.465	20	30		EGEDHN
C=CCc1cc(CN2CCC(C3(C)OCCO3)CC2)cc(OC)c1O	ZINC000271160389	456148315	/nfs/dbraw/zinc/14/83/15/456148315.db2.gz	FKGLLXUUDJJCQL-UHFFFAOYSA-N	0	3	347.455	3.104	20	30		EGEDHN
C=C[C@@H](CO)NCc1ccc(OCc2ccccc2)c(OCC)c1	ZINC000289903604	456174553	/nfs/dbraw/zinc/17/45/53/456174553.db2.gz	RCJUZWOKUHMBTL-SFHVURJKSA-N	0	3	327.424	3.301	20	30		EGEDHN
COc1cccc(C[NH2+]C2CCN(c3ccc(C#N)cc3)CC2)c1[O-]	ZINC000263669635	456188803	/nfs/dbraw/zinc/18/88/03/456188803.db2.gz	JIOJICJHYKKAGU-UHFFFAOYSA-N	0	3	337.423	3.031	20	30		EGEDHN
Cc1ccc(N2CCN(CCCC3(C#N)CCOCC3)CC2)cc1	ZINC000281308192	456196562	/nfs/dbraw/zinc/19/65/62/456196562.db2.gz	KHPZRDINLAXGBC-UHFFFAOYSA-N	0	3	327.472	3.218	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc3c(c2)OC(CC)(CC)O3)CC1	ZINC000189078857	456219314	/nfs/dbraw/zinc/21/93/14/456219314.db2.gz	ITLGUJHMPRNHIJ-UHFFFAOYSA-N	0	3	342.439	3.258	20	30		EGEDHN
C=C(C)CN1CCC(Nc2cc(COC)nc(C(C)(C)C)n2)CC1	ZINC000301811389	456220476	/nfs/dbraw/zinc/22/04/76/456220476.db2.gz	XRCYRUGKNJHXFJ-UHFFFAOYSA-N	0	3	332.492	3.373	20	30		EGEDHN
C=CCN1CCC(Nc2nc3ccccc3nc2N2CCCC2)CC1	ZINC000301849683	456232445	/nfs/dbraw/zinc/23/24/45/456232445.db2.gz	AMMCPMSTKOBUNK-UHFFFAOYSA-N	0	3	337.471	3.292	20	30		EGEDHN
N#Cc1cc(Cl)ccc1NC[C@@H]1C[C@@H](O)CN1Cc1ccccc1	ZINC000301876800	456238782	/nfs/dbraw/zinc/23/87/82/456238782.db2.gz	NHPLTOXVPAERCB-ZWKOTPCHSA-N	0	3	341.842	3.259	20	30		EGEDHN
C=C(C)[C@H](Cc1nc(-c2cccc(OCCN(C)C)c2)no1)OCC	ZINC000273871433	456247392	/nfs/dbraw/zinc/24/73/92/456247392.db2.gz	NBIIFXLKAHJQPG-KRWDZBQOSA-N	0	3	345.443	3.201	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/CCc2cn3c(n2)SCC3)c([O-])c1	ZINC000274315895	456254951	/nfs/dbraw/zinc/25/49/51/456254951.db2.gz	HEZSEFHUTWRSQO-XDHOZWIPSA-N	0	3	344.484	3.202	20	30		EGEDHN
C[C@H](CNC(=O)OC(C)(C)C)N[C@@H](C)c1ccc(OCC#N)cc1	ZINC000274706448	456265132	/nfs/dbraw/zinc/26/51/32/456265132.db2.gz	ZHJAYZCFPHVGRY-KGLIPLIRSA-N	0	3	333.432	3.153	20	30		EGEDHN
COc1cc(CNC[C@@](C)(O)c2cccc(Cl)c2)ccc1C#N	ZINC000281692772	456295950	/nfs/dbraw/zinc/29/59/50/456295950.db2.gz	NEGOZPGLSXTWAJ-GOSISDBHSA-N	0	3	330.815	3.218	20	30		EGEDHN
CN(c1nc2ccccn2c1C#N)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000302138057	456296520	/nfs/dbraw/zinc/29/65/20/456296520.db2.gz	DQCSPMINHXQJPH-GOSISDBHSA-N	0	3	345.450	3.307	20	30		EGEDHN
N#Cc1cccc(OCCCN2CCCC[C@@H]2[C@H](O)C(F)(F)F)c1	ZINC000340192830	456304355	/nfs/dbraw/zinc/30/43/55/456304355.db2.gz	PYLMLAJDTOQMGM-CVEARBPZSA-N	0	3	342.361	3.105	20	30		EGEDHN
CN(CCNc1cc(C#N)ccc1[N+](=O)[O-])Cc1ccc(F)cc1	ZINC000302190535	456310915	/nfs/dbraw/zinc/31/09/15/456310915.db2.gz	BDELSVFGUGAQRY-UHFFFAOYSA-N	0	3	328.347	3.149	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cccc(CC#N)c2)C1	ZINC000336907014	456315514	/nfs/dbraw/zinc/31/55/14/456315514.db2.gz	YNXDGMHAYZHPGI-OXQOHEQNSA-N	0	3	333.435	3.318	20	30		EGEDHN
CC[C@@](C)(C#N)C(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000290493786	456343352	/nfs/dbraw/zinc/34/33/52/456343352.db2.gz	MOQMLKHCHFKULE-MJGOQNOKSA-N	0	3	331.460	3.133	20	30		EGEDHN
COc1cc(C(=O)C(C#N)c2ccc(C(F)(F)F)cn2)cc(C)n1	ZINC000337346269	456348699	/nfs/dbraw/zinc/34/86/99/456348699.db2.gz	MAKCRXMUCCSJPT-GFCCVEGCSA-N	0	3	335.285	3.303	20	30		EGEDHN
C[C@@](C#N)(NC(=O)CN[C@@H](Cc1ccccc1)c1ccccc1)C1CC1	ZINC000302589963	456363234	/nfs/dbraw/zinc/36/32/34/456363234.db2.gz	JGWHDLGUJMWNCS-UNMCSNQZSA-N	0	3	347.462	3.368	20	30		EGEDHN
CCOc1cccc(CNCCSCc2ccccc2C#N)n1	ZINC000343036233	456366609	/nfs/dbraw/zinc/36/66/09/456366609.db2.gz	ZOQHDCORXCYHGS-UHFFFAOYSA-N	0	3	327.453	3.375	20	30		EGEDHN
C=CCN1CCC(NCc2c(F)ccc(Br)c2F)CC1	ZINC000281949848	456370664	/nfs/dbraw/zinc/37/06/64/456370664.db2.gz	IQALAYTXWFZECF-UHFFFAOYSA-N	0	3	345.231	3.467	20	30		EGEDHN
Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@H]1N2C(=O)c1ccc(C#N)c(C)n1	ZINC000298377072	456440305	/nfs/dbraw/zinc/44/03/05/456440305.db2.gz	WULFZCCJXOELLZ-FXAWDEMLSA-N	0	3	346.434	3.018	20	30		EGEDHN
CN(Cc1ccc(F)cc1F)C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000348059148	456450381	/nfs/dbraw/zinc/45/03/81/456450381.db2.gz	VZWLQNPLBMTUJA-MRXNPFEDSA-N	0	3	339.345	3.177	20	30		EGEDHN
CN(CCCOc1ccccc1)C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000348112820	456491343	/nfs/dbraw/zinc/49/13/43/456491343.db2.gz	GDJNFKLONOWZDA-LJQANCHMSA-N	0	3	347.418	3.168	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCc2ncc(C(C)(C)C)o2)CC1	ZINC000282375060	456493229	/nfs/dbraw/zinc/49/32/29/456493229.db2.gz	CJTFTCBWOKVJLY-UHFFFAOYSA-N	0	3	333.476	3.061	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Cc1cnccc1Cl)C(C)C	ZINC000298572134	456494268	/nfs/dbraw/zinc/49/42/68/456494268.db2.gz	IYIWDZPLKRVROE-QGZVFWFLSA-N	0	3	335.879	3.092	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H](CNC(=O)c3ccccc3)C2)cc1	ZINC000353133510	456513441	/nfs/dbraw/zinc/51/34/41/456513441.db2.gz	FWAPZNSELAMJRO-LJQANCHMSA-N	0	3	333.435	3.200	20	30		EGEDHN
CN(CCCN(C)c1ccc(C#N)c([N+](=O)[O-])c1)Cc1ccco1	ZINC000291095379	456525955	/nfs/dbraw/zinc/52/59/55/456525955.db2.gz	JWQLSISIYACATH-UHFFFAOYSA-N	0	3	328.372	3.018	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000337755708	456526547	/nfs/dbraw/zinc/52/65/47/456526547.db2.gz	BHGNXEYCUIROAC-FOIQADDNSA-N	0	3	333.435	3.117	20	30		EGEDHN
COc1cc(CN[C@H]2CCN([C@H](C)c3ccccc3)C2)ccc1C#N	ZINC000353194357	456550796	/nfs/dbraw/zinc/55/07/96/456550796.db2.gz	TVUHDSAVBPIKRV-UZLBHIALSA-N	0	3	335.451	3.492	20	30		EGEDHN
C=CCOCCCC(=O)N[C@H]1CCN(Cc2ccccc2)CC1(C)C	ZINC000282640257	456578530	/nfs/dbraw/zinc/57/85/30/456578530.db2.gz	FBBQKAUDXWDHJS-IBGZPJMESA-N	0	3	344.499	3.386	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)N[C@@H]1CCN(C)[C@@H](C)C1	ZINC000340694472	456632321	/nfs/dbraw/zinc/63/23/21/456632321.db2.gz	FEQMINCQOYHEHC-SMDDNHRTSA-N	0	3	327.453	3.294	20	30		EGEDHN
CCN(Cc1ccc(C(=O)NCc2ccc(C#N)cc2)cc1)C1CC1	ZINC000337993471	456643236	/nfs/dbraw/zinc/64/32/36/456643236.db2.gz	IURFJJFBHCVKNQ-UHFFFAOYSA-N	0	3	333.435	3.473	20	30		EGEDHN
Cn1cc(CN(Cc2ccc(F)cc2)C2CCOCC2)cc1C#N	ZINC000277001810	456648345	/nfs/dbraw/zinc/64/83/45/456648345.db2.gz	IKOQXNQRBSGUOS-UHFFFAOYSA-N	0	3	327.403	3.217	20	30		EGEDHN
N#CC(C(=O)c1ccc(C(F)(F)F)cn1)c1nc2ccccc2[nH]1	ZINC000338187064	456692568	/nfs/dbraw/zinc/69/25/68/456692568.db2.gz	DNSIQJPXCQJHCU-SNVBAGLBSA-N	0	3	330.269	3.467	20	30		EGEDHN
N#CCc1ccc(CN2CCC(OC[C@H]3CCCCO3)CC2)cc1	ZINC000343542009	456695830	/nfs/dbraw/zinc/69/58/30/456695830.db2.gz	TVGMJPXQHMVASI-HXUWFJFHSA-N	0	3	328.456	3.303	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N(C)C[C@@H]1CCN(C)[C@@H]1c1cccnc1	ZINC000338225990	456716760	/nfs/dbraw/zinc/71/67/60/456716760.db2.gz	LNEOSNQVAARZBV-AZUAARDMSA-N	0	3	348.450	3.027	20	30		EGEDHN
CC1(C)[C@H](NCC(=O)N[C@@H]2CCOc3ccccc32)[C@@H]2CCCO[C@H]21	ZINC000328654759	456728663	/nfs/dbraw/zinc/72/86/63/456728663.db2.gz	MAXIDUJZEAYLJE-OSGQAZFXSA-N	0	3	344.455	3.260	20	30		EGEDHN
Cc1ccc(NC(=O)[C@H](C)N2CCC[C@@H]2[C@H]2COCC[C@@H]2O)c(C)c1	ZINC000328694247	456738218	/nfs/dbraw/zinc/73/82/18/456738218.db2.gz	CVWDTDMZSONNBZ-ISARSNTHSA-N	0	3	346.471	3.142	20	30		EGEDHN
Cc1ncc(C(=O)NCCN2CCC3(CCCCC3)CC2)c(C)n1	ZINC000328695386	456739379	/nfs/dbraw/zinc/73/93/79/456739379.db2.gz	GJDNTWPCYLGATM-UHFFFAOYSA-N	0	3	330.476	3.444	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)Nc2ccc(C#N)c(F)c2)N(C)C)cc1	ZINC000353557701	456760152	/nfs/dbraw/zinc/76/01/52/456760152.db2.gz	IBEQGKWMDNKAKE-SFHVURJKSA-N	0	3	340.402	3.430	20	30		EGEDHN
C[C@H](C(=O)Nc1ccc2c(c1)OCO2)N1CC[C@@H](C2CCOCC2)C1	ZINC000328855914	456776635	/nfs/dbraw/zinc/77/66/35/456776635.db2.gz	UCLOSFYXFJHCTC-UKRRQHHQSA-N	0	3	346.427	3.140	20	30		EGEDHN
C[C@H]1CN(C)CCN1Cc1cccc(OCc2cccc(C#N)c2)c1	ZINC000353585608	456784476	/nfs/dbraw/zinc/78/44/76/456784476.db2.gz	UNVUHWXBXZDMLE-KRWDZBQOSA-N	0	3	335.451	3.273	20	30		EGEDHN
CC(C)N1CCN(c2cccc(NC(=O)C[C@@](C)(O)C3CC3)c2)CC1	ZINC000328984389	456807702	/nfs/dbraw/zinc/80/77/02/456807702.db2.gz	GAWXRPDVIMLPQZ-HXUWFJFHSA-N	0	3	345.487	3.356	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1ccnc(C2CC2)c1)C(C)C	ZINC000341095919	456816923	/nfs/dbraw/zinc/81/69/23/456816923.db2.gz	OMWNLNAZVCHBLM-LJQANCHMSA-N	0	3	327.472	3.387	20	30		EGEDHN
C[C@@H]1CC[C@@H](C)N1CC(=O)N1CCC[C@H](C(=O)Nc2ccccc2)C1	ZINC000329070461	456827199	/nfs/dbraw/zinc/82/71/99/456827199.db2.gz	YNQMYWJLUVUTKR-ZACQAIPSSA-N	0	3	343.471	3.386	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cccc2[nH]c(C)nc21)C(C)C	ZINC000338539479	456836957	/nfs/dbraw/zinc/83/69/57/456836957.db2.gz	JSLXJFVBFNTJPH-GOSISDBHSA-N	0	3	340.471	3.300	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccc([C@@H]3CCCOC3)cc2)nc(C)n1	ZINC000329250921	456861149	/nfs/dbraw/zinc/86/11/49/456861149.db2.gz	BGWFDYBEDRCCOZ-MSOLQXFVSA-N	0	3	335.407	3.478	20	30		EGEDHN
N#CCOc1ccc(CN[C@@H](c2nnc[nH]2)C2CCCCC2)cc1	ZINC000292130040	456863021	/nfs/dbraw/zinc/86/30/21/456863021.db2.gz	LLCLQHJCTUVLPL-QGZVFWFLSA-N	0	3	325.416	3.118	20	30		EGEDHN
COc1cc(CN(C)CCCN(C)Cc2ccco2)ccc1C#N	ZINC000348818549	456870427	/nfs/dbraw/zinc/87/04/27/456870427.db2.gz	SZRMNYMKDMIZER-UHFFFAOYSA-N	0	3	327.428	3.114	20	30		EGEDHN
Cc1c2cc(F)ccc2oc1CNC(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000329319729	456872176	/nfs/dbraw/zinc/87/21/76/456872176.db2.gz	TXEBMHYRMCCHNC-CYBMUJFWSA-N	0	3	331.391	3.121	20	30		EGEDHN
O=C(CCC1CCCC1)NCC(=O)N1CC[C@@H](N2CCCCC2)C1	ZINC000329338284	456875722	/nfs/dbraw/zinc/87/57/22/456875722.db2.gz	YPCUFSBVTNBZHP-QGZVFWFLSA-N	0	3	335.492	3.000	20	30		EGEDHN
C=CCOc1ccccc1CN(CCNC(C)=O)C1CCSCC1	ZINC000339003749	456895520	/nfs/dbraw/zinc/89/55/20/456895520.db2.gz	YCVMBMMVYNNTFL-UHFFFAOYSA-N	0	3	348.512	3.085	20	30		EGEDHN
CCN(CCC#N)C(=O)CNC(C)(C)c1ccc(OCC(C)C)cc1	ZINC000341688750	456901012	/nfs/dbraw/zinc/90/10/12/456901012.db2.gz	KAPHCMUPGBJLIL-UHFFFAOYSA-N	0	3	345.487	3.308	20	30		EGEDHN
Cc1ccc2nccc(N3CCC([C@@H](O)C(=O)NC4CC4)CC3)c2c1	ZINC000329738497	456933388	/nfs/dbraw/zinc/93/33/88/456933388.db2.gz	UIWVDHZCYCHTRB-LJQANCHMSA-N	0	3	339.439	3.239	20	30		EGEDHN
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H]2C[C@]23CCOC3)cc1	ZINC000329757686	456936407	/nfs/dbraw/zinc/93/64/07/456936407.db2.gz	ZMSMBODPDJSIHI-BJLQDIEVSA-N	0	3	344.455	3.215	20	30		EGEDHN
Cc1cc(C(=O)NC[C@@H]2CCCN(C)[C@@H]2c2cccs2)cnn1	ZINC000329842538	456949154	/nfs/dbraw/zinc/94/91/54/456949154.db2.gz	PBCSAGQQQTULEJ-BBRMVZONSA-N	0	3	330.457	3.234	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN(C)[C@H](C)C(C)C)cc1	ZINC000341811808	456954395	/nfs/dbraw/zinc/95/43/95/456954395.db2.gz	VULGTNPOVKRHEM-MRXNPFEDSA-N	0	3	331.460	3.308	20	30		EGEDHN
C[C@@H]1CC[C@H](C)N1CC(=O)N[C@H]1CC(=O)N(c2ccccc2Cl)C1	ZINC000329895435	456957852	/nfs/dbraw/zinc/95/78/52/456957852.db2.gz	KLYBVPDJDWTTPA-MJBXVCDLSA-N	0	3	349.862	3.275	20	30		EGEDHN
N#Cc1cnc(NCCCN2CCc3ccccc3C2)c(Cl)c1	ZINC000339137523	456959194	/nfs/dbraw/zinc/95/91/94/456959194.db2.gz	UEEVMEIQULTUHW-UHFFFAOYSA-N	0	3	326.831	3.467	20	30		EGEDHN
O=C(NC[C@@H]1CCCCN1C1CC1)[C@@H]1CC[C@@H](C(F)(F)F)NC1=O	ZINC000329930957	456962506	/nfs/dbraw/zinc/96/25/06/456962506.db2.gz	AMIUQPINSIYKER-AVGNSLFASA-N	0	3	347.381	3.257	20	30		EGEDHN
CC(C)(C)C(=O)N1CCC[C@H](C(=O)NC[C@H]2CCCCN2C2CC2)C1	ZINC000329958334	456966343	/nfs/dbraw/zinc/96/63/43/456966343.db2.gz	QANYMVQUCLMAOM-DOTOQJQBSA-N	0	3	349.519	3.245	20	30		EGEDHN
Cc1nc([C@@H]2CCCOC2)sc1C(=O)N[C@@H]1CCN2CCCC[C@@H]12	ZINC000330241516	457010577	/nfs/dbraw/zinc/01/05/77/457010577.db2.gz	IZIQKLONLXPTSW-KFWWJZLASA-N	0	3	349.500	3.277	20	30		EGEDHN
O=C(NC1CCN(C(=O)[C@H]2CCCN2C2CC2)CC1)C1CCCCC1	ZINC000330255189	457013076	/nfs/dbraw/zinc/01/30/76/457013076.db2.gz	JUYDFKDTXGYRPM-GOSISDBHSA-N	0	3	347.503	3.141	20	30		EGEDHN
C=CCCC1(C(=O)Nc2ccc(OC3CCN(C)CC3)nc2)CC1	ZINC000356545779	457048018	/nfs/dbraw/zinc/04/80/18/457048018.db2.gz	HTAKGXXSAHKROM-UHFFFAOYSA-N	0	3	329.444	3.240	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1c1nc(-c2cccc(OCCN(C)C)c2)no1	ZINC000346529716	457048162	/nfs/dbraw/zinc/04/81/62/457048162.db2.gz	JELMIGXZZAGCAE-IRXDYDNUSA-N	0	3	343.427	3.126	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2CCO[C@@H](C(C)(C)C)C2)CC1	ZINC000330518293	457052280	/nfs/dbraw/zinc/05/22/80/457052280.db2.gz	OKGMGYYFAMGEKD-IAGOWNOFSA-N	0	3	337.508	3.124	20	30		EGEDHN
CC(C)c1ccc(C[C@@H]2CCN([C@H](C)C(=O)N(C)CCC#N)C2)cc1	ZINC000359256498	457069332	/nfs/dbraw/zinc/06/93/32/457069332.db2.gz	FUXZJENCABYIGS-MJGOQNOKSA-N	0	3	341.499	3.435	20	30		EGEDHN
CC[C@@H](C)N[C@H](CNC(=O)c1ccc(CC#N)cc1)c1ccco1	ZINC000359536413	457092176	/nfs/dbraw/zinc/09/21/76/457092176.db2.gz	DYDJYZIQXMNUHI-RHSMWYFYSA-N	0	3	325.412	3.205	20	30		EGEDHN
COc1ccc(C(=O)N[C@@H]2CCN(C)[C@@H](C)C2)c(OC(F)F)c1	ZINC000331011977	457119993	/nfs/dbraw/zinc/11/99/93/457119993.db2.gz	JPXILPDQRULNOJ-WDEREUQCSA-N	0	3	328.359	3.084	20	30		EGEDHN
CSc1nc(C(C)C)nc(C)c1C(=O)N[C@@H]1CCN(C)[C@H](C)C1	ZINC000331065037	457126914	/nfs/dbraw/zinc/12/69/14/457126914.db2.gz	QAYSUAUURGZTCG-DGCLKSJQSA-N	0	3	336.505	3.418	20	30		EGEDHN
C[C@H](C(=O)N(CCN(C)C)Cc1ccccc1)c1cccc(C#N)c1	ZINC000359914226	457145225	/nfs/dbraw/zinc/14/52/25/457145225.db2.gz	UCIRBVOHBPZTBO-KRWDZBQOSA-N	0	3	335.451	3.252	20	30		EGEDHN
CC[C@H]1CN(CC(=O)N(CC)CCC#N)CC[C@@H]1c1ccccc1	ZINC000350040973	457152350	/nfs/dbraw/zinc/15/23/50/457152350.db2.gz	LZBWNXBJHQKDQX-HKUYNNGSSA-N	0	3	327.472	3.264	20	30		EGEDHN
Cc1cc(CN2CCC(NC(=O)c3ccsc3)CC2)ccc1C#N	ZINC000362924821	457159450	/nfs/dbraw/zinc/15/94/50/457159450.db2.gz	PZFRIWYYYRTNES-UHFFFAOYSA-N	0	3	339.464	3.323	20	30		EGEDHN
CN(C)[C@@]1(CNC(=O)Nc2ncc(C(C)(C)C)s2)CCSC1	ZINC000331288122	457160004	/nfs/dbraw/zinc/16/00/04/457160004.db2.gz	NJNLYSCHHMFPKE-OAHLLOKOSA-N	0	3	342.534	3.204	20	30		EGEDHN
C=C(C)CN1CCC(NCc2ncc(Br)s2)CC1	ZINC000359947521	457163536	/nfs/dbraw/zinc/16/35/36/457163536.db2.gz	BKJJIWCFPDZOID-UHFFFAOYSA-N	0	3	330.295	3.036	20	30		EGEDHN
CCN1CCC(NC(=O)NC(C)(C)Cc2ccc(OC)cc2)CC1	ZINC000331323347	457166525	/nfs/dbraw/zinc/16/65/25/457166525.db2.gz	LYFAJAAIDLTEDK-UHFFFAOYSA-N	0	3	333.476	3.004	20	30		EGEDHN
CC(C)(CCC#N)CNCC(=O)Nc1cccc(Br)c1	ZINC000350255713	457172799	/nfs/dbraw/zinc/17/27/99/457172799.db2.gz	SSORDZASJNUSAQ-UHFFFAOYSA-N	0	3	338.249	3.307	20	30		EGEDHN
N#Cc1csc(CN[C@H]2CCCN(C(=O)CCC(F)(F)F)C2)c1	ZINC000342223050	457177607	/nfs/dbraw/zinc/17/76/07/457177607.db2.gz	MELWRTNJRKIAQT-LBPRGKRZSA-N	0	3	345.390	3.043	20	30		EGEDHN
CC(C)(CCC#N)CNC(=O)N[C@@H](CN1CCCC1)c1ccccc1	ZINC000350517998	457185135	/nfs/dbraw/zinc/18/51/35/457185135.db2.gz	KLZIIGPFMQLRHP-SFHVURJKSA-N	0	3	342.487	3.453	20	30		EGEDHN
C[C@H]1C[C@H](N(C)C(=O)c2cnccc2C#N)CCN1Cc1ccccc1	ZINC000342269620	457200469	/nfs/dbraw/zinc/20/04/69/457200469.db2.gz	BMDNCMAGEVYYIH-QFBILLFUSA-N	0	3	348.450	3.078	20	30		EGEDHN
C=CCn1c(C(C)C)nnc1N(C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000350742252	457203526	/nfs/dbraw/zinc/20/35/26/457203526.db2.gz	VDPGUKGXMVHYFN-GOSISDBHSA-N	0	3	339.487	3.298	20	30		EGEDHN
N#CC1(CCCN2C[C@@H](O)C[C@H]2c2ccc(F)cc2)CCOCC1	ZINC000331579218	457211855	/nfs/dbraw/zinc/21/18/55/457211855.db2.gz	LJSCSEMLXYZJGQ-ROUUACIJSA-N	0	3	332.419	3.034	20	30		EGEDHN
CC1(C#N)CCN(C[C@H](O)CO[C@@H]2CCCc3ccccc32)CC1	ZINC000331668384	457228915	/nfs/dbraw/zinc/22/89/15/457228915.db2.gz	NZWWCBXKVAELCD-PKOBYXMFSA-N	0	3	328.456	3.067	20	30		EGEDHN
N#CC(C(=O)c1ccccc1NC(=O)c1ccsc1)c1ccncn1	ZINC000354460846	457238151	/nfs/dbraw/zinc/23/81/51/457238151.db2.gz	AJOILDIRKCLHTJ-AWEZNQCLSA-N	0	3	348.387	3.280	20	30		EGEDHN
CCCN(CC(=O)N(CC)CCC#N)[C@@H]1C[C@@H](OCC)C12CCCC2	ZINC000354468198	457243435	/nfs/dbraw/zinc/24/34/35/457243435.db2.gz	WDNJYJCFRQUTMQ-QZTJIDSGSA-N	0	3	349.519	3.198	20	30		EGEDHN
CC(C)[C@]1(CO)CCCN(C(=O)C(C#N)CCc2ccccc2)C1	ZINC000360170772	457287091	/nfs/dbraw/zinc/28/70/91/457287091.db2.gz	KRSUSDOAUTXNMI-AZUAARDMSA-N	0	3	328.456	3.016	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN2CC[C@H](C)[C@H]2CC)cc1	ZINC000360477749	457313800	/nfs/dbraw/zinc/31/38/00/457313800.db2.gz	LOMZJOYWGJFZIK-QFBILLFUSA-N	0	3	343.471	3.452	20	30		EGEDHN
C=CCCN[C@@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1	ZINC000357186015	457364958	/nfs/dbraw/zinc/36/49/58/457364958.db2.gz	NPCFGAAAHMYOIL-SFHVURJKSA-N	0	3	333.428	3.484	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@@H](C)CN2CCC[C@@H](C)C2)cc1OC	ZINC000347420940	457417383	/nfs/dbraw/zinc/41/73/83/457417383.db2.gz	XNJFBFGAONKYIH-CVEARBPZSA-N	0	3	346.471	3.110	20	30		EGEDHN
CCC(C)(C)N[C@@H](C)C(=O)Nc1nc(C)c(SCC#N)s1	ZINC000356010224	457440582	/nfs/dbraw/zinc/44/05/82/457440582.db2.gz	LLZOIZAVGIKFMA-VIFPVBQESA-N	0	3	326.491	3.172	20	30		EGEDHN
CN(C)CCN(C(=O)C[C@H](CC#N)c1ccccc1)C1CCCC1	ZINC000356103490	457448193	/nfs/dbraw/zinc/44/81/93/457448193.db2.gz	YUWSUKUKKJOVQM-SFHVURJKSA-N	0	3	327.472	3.407	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN(C[C@H]1CCCO1)C1CCC(C)CC1	ZINC000347527492	457486239	/nfs/dbraw/zinc/48/62/39/457486239.db2.gz	RTJJAOHBQPXOEN-VLOYRQLPSA-N	0	3	349.519	3.054	20	30		EGEDHN
C[C@@H]1[C@H](c2ccccc2)CCN1CC(=O)NCc1cccc(C#N)c1	ZINC000374210596	457524031	/nfs/dbraw/zinc/52/40/31/457524031.db2.gz	VYNQBMYGYDGPSB-OXQOHEQNSA-N	0	3	333.435	3.052	20	30		EGEDHN
Cc1nsc(N(C)C[C@@H]2CCN(Cc3ccccc3)C2)c1C#N	ZINC000342822962	457541752	/nfs/dbraw/zinc/54/17/52/457541752.db2.gz	GLJQJWIOMBUYGL-INIZCTEOSA-N	0	3	326.469	3.282	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@H](C)N1CC2(CCC2)[C@H]1C1CCOCC1	ZINC000425555618	457596456	/nfs/dbraw/zinc/59/64/56/457596456.db2.gz	QYNYXQZHUUVNEO-FUHWJXTLSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1c2ccccc2CC[C@@H]1CN(C)C)OCC	ZINC000425599774	457608496	/nfs/dbraw/zinc/60/84/96/457608496.db2.gz	AEHJBAPPOMQOSB-MJGOQNOKSA-N	0	3	330.472	3.267	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(-c3ccc(C)cc3)n[nH]2)CC1	ZINC000357589502	457609833	/nfs/dbraw/zinc/60/98/33/457609833.db2.gz	PFUISFIRCOOELA-UHFFFAOYSA-N	0	3	338.455	3.155	20	30		EGEDHN
CC(C)(C)N1C[C@@H](C(=O)N[C@](C)(C#N)C(C)(C)C)[C@H](C(F)(F)F)C1	ZINC000410677636	457657920	/nfs/dbraw/zinc/65/79/20/457657920.db2.gz	SSWDMCHQLCGWPG-XHBSWPGZSA-N	0	3	347.425	3.340	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N1CCC[C@@H](OC)CC1	ZINC000374681973	457686861	/nfs/dbraw/zinc/68/68/61/457686861.db2.gz	XQOCHXQILSTFPB-JKSUJKDBSA-N	0	3	336.501	3.152	20	30		EGEDHN
CCCN(CC)c1ccc(C(=O)C(C#N)c2cc(C)nc(C)n2)cn1	ZINC000357802690	457695577	/nfs/dbraw/zinc/69/55/77/457695577.db2.gz	VWFVOXZSJYVYOS-MRXNPFEDSA-N	0	3	337.427	3.215	20	30		EGEDHN
C=CCN1CCC(NC(=O)C2(c3ccc(C)c(OC)c3)CCC2)CC1	ZINC000357816749	457700481	/nfs/dbraw/zinc/70/04/81/457700481.db2.gz	GTMLAVNXHHGKJG-UHFFFAOYSA-N	0	3	342.483	3.192	20	30		EGEDHN
N#Cc1ccncc1N1CC[C@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000364906713	457717169	/nfs/dbraw/zinc/71/71/69/457717169.db2.gz	USHJIBFXAZYQTJ-OAQYLSRUSA-N	0	3	332.451	3.446	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CCC[C@H]1CSC)C(C)C	ZINC000426027009	457762205	/nfs/dbraw/zinc/76/22/05/457762205.db2.gz	FDVISKVLHYTYHE-DLBZAZTESA-N	0	3	339.549	3.222	20	30		EGEDHN
C=CCC[C@H](N[C@@H]1CCN(C2CCOCC2)C1=O)c1ccccc1	ZINC000366121497	457794042	/nfs/dbraw/zinc/79/40/42/457794042.db2.gz	CXDVFDYSRBYFDZ-RBUKOAKNSA-N	0	3	328.456	3.063	20	30		EGEDHN
COc1ccc(CN2CC[C@H](C)C[C@@H]2[C@H](C)O)cc1OCCCC#N	ZINC000443783630	457810389	/nfs/dbraw/zinc/81/03/89/457810389.db2.gz	DIDYYXXVQSAYTP-XYJFISCASA-N	0	3	346.471	3.359	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCCOc1ccc(Cl)cn1	ZINC000433362845	457821557	/nfs/dbraw/zinc/82/15/57/457821557.db2.gz	KRORLJVFQVUYDZ-HNNXBMFYSA-N	0	3	343.814	3.003	20	30		EGEDHN
C[C@@H]1CN(C[C@@H]2CCCN2CCC2(C#N)CCCCC2)C[C@H](C)O1	ZINC000411193186	457825364	/nfs/dbraw/zinc/82/53/64/457825364.db2.gz	DWGLMIKXVVRMRP-OTWHNJEPSA-N	0	3	333.520	3.424	20	30		EGEDHN
Cc1cccc(N(CCC#N)C(=O)CN2CC[C@H]3CCC[C@@H]32)c1C	ZINC000426476730	457839282	/nfs/dbraw/zinc/83/92/82/457839282.db2.gz	VVIJWZXLAKACRX-MJGOQNOKSA-N	0	3	325.456	3.425	20	30		EGEDHN
CC[C@@H](NCCC1(C#N)CCCCC1)c1cccc(S(N)(=O)=O)c1	ZINC000411457382	457892733	/nfs/dbraw/zinc/89/27/33/457892733.db2.gz	CXONAERQNWUMNU-QGZVFWFLSA-N	0	3	349.500	3.239	20	30		EGEDHN
CC[C@@H](N[C@@H](C)CCC#N)c1ccccc1OCC(=O)N1CCCC1	ZINC000411457651	457893214	/nfs/dbraw/zinc/89/32/14/457893214.db2.gz	WOOUQPMJOOHTLB-FUHWJXTLSA-N	0	3	343.471	3.421	20	30		EGEDHN
CCCN(CCc1cccs1)[C@@H](C)C(=O)N[C@](C)(C#N)C(C)C	ZINC000411557907	457919040	/nfs/dbraw/zinc/91/90/40/457919040.db2.gz	VOEZUYADFXTKMU-MAUKXSAKSA-N	0	3	335.517	3.446	20	30		EGEDHN
C=CCN(C)CCN(CC)Cc1nnc(-c2ccc(Cl)cc2)n1C	ZINC000411637181	457935846	/nfs/dbraw/zinc/93/58/46/457935846.db2.gz	FPEOFMPYDXFHCF-UHFFFAOYSA-N	0	3	347.894	3.075	20	30		EGEDHN
C#Cc1ccc(CN2CCC(n3cc(Br)cn3)CC2)cc1	ZINC000367355835	457948991	/nfs/dbraw/zinc/94/89/91/457948991.db2.gz	GZDGYSRRRWYHKL-UHFFFAOYSA-N	0	3	344.256	3.464	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)[C@H](C)Cc2cccc(F)c2)CC1	ZINC000458326000	458012762	/nfs/dbraw/zinc/01/27/62/458012762.db2.gz	TWJLXEDWNPIVGA-MRXNPFEDSA-N	0	3	347.478	3.439	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC(c3cccc(Cl)c3)C2)CC1	ZINC000458334720	458017119	/nfs/dbraw/zinc/01/71/19/458017119.db2.gz	MWGVDFAOZBOOLM-UHFFFAOYSA-N	0	3	333.863	3.099	20	30		EGEDHN
CC(C)(C#N)CC(=O)N1CC[C@@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000375719243	458035253	/nfs/dbraw/zinc/03/52/53/458035253.db2.gz	MESPOCJAHXTQBI-NRFANRHFSA-N	0	3	339.483	3.441	20	30		EGEDHN
O[C@@H]1CC[C@@H]2CN(CC#Cc3ccc(OC(F)(F)F)cc3)C[C@@H]2C1	ZINC000412035819	458058276	/nfs/dbraw/zinc/05/82/76/458058276.db2.gz	FFNOFZGEYPTMEI-OWCLPIDISA-N	0	3	339.357	3.030	20	30		EGEDHN
CS[C@@H]1CN(c2nc3c(cc2C#N)CCCC3(C)C)C[C@H]1N(C)C	ZINC000428167669	458090149	/nfs/dbraw/zinc/09/01/49/458090149.db2.gz	RPMYNMOAAWYHHG-HZPDHXFCSA-N	0	3	344.528	3.049	20	30		EGEDHN
CC(C)C[C@@H](CN[C@H](C)c1ccc(C#N)cc1F)N1CCOCC1	ZINC000358582949	458091277	/nfs/dbraw/zinc/09/12/77/458091277.db2.gz	FSUBIDGGHRGVCT-WBVHZDCISA-N	0	3	333.451	3.095	20	30		EGEDHN
C=CCc1cc(CN[C@H]2Cc3cccc(O)c3C2)cc(OC)c1O	ZINC000428559663	458170285	/nfs/dbraw/zinc/17/02/85/458170285.db2.gz	AEFAHIJDZPOUKM-INIZCTEOSA-N	0	3	325.408	3.092	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]([C@@H](C)CC)C(F)(F)F)CC1	ZINC000446291773	458172319	/nfs/dbraw/zinc/17/23/19/458172319.db2.gz	BZEQDNMQSPYXIF-JSGCOSHPSA-N	0	3	335.414	3.303	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H]2Cc3cccc(O)c3C2)cc1OC	ZINC000428573932	458173100	/nfs/dbraw/zinc/17/31/00/458173100.db2.gz	QFVQSWDJJFQAQY-MRXNPFEDSA-N	0	3	325.408	3.223	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CCC(C)(OCC)CC1	ZINC000428718233	458198851	/nfs/dbraw/zinc/19/88/51/458198851.db2.gz	MHQSTBVEYVUELJ-GOSISDBHSA-N	0	3	333.472	3.046	20	30		EGEDHN
C=CCC[C@H](C)N[C@@H]1CCN(c2cccc(Br)c2)C1=O	ZINC000447065679	458259688	/nfs/dbraw/zinc/25/96/88/458259688.db2.gz	IEOBHGKDXYMOLG-SWLSCSKDSA-N	0	3	337.261	3.499	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN2CCN([C@@H]3C[C@@H]3C)C[C@H](C)C2)c1C	ZINC000429033521	458262508	/nfs/dbraw/zinc/26/25/08/458262508.db2.gz	ZLKDQRMGHGBHCB-GQIGUUNPSA-N	0	3	343.515	3.136	20	30		EGEDHN
CCN(CCC#N)C(=O)CN1C[C@H](c2ccccc2)[C@@H]2CCCC[C@@H]21	ZINC000362585075	458284946	/nfs/dbraw/zinc/28/49/46/458284946.db2.gz	BLBVSRNCYPHOIC-ZCNNSNEGSA-N	0	3	339.483	3.407	20	30		EGEDHN
N#CCc1ccc(CN2CCC(Oc3ncccc3F)CC2)cc1	ZINC000447355929	458289011	/nfs/dbraw/zinc/28/90/11/458289011.db2.gz	SLPQMJAWSZVVGW-UHFFFAOYSA-N	0	3	325.387	3.330	20	30		EGEDHN
C[C@H]1C[C@H]1N1CCN(c2cc(C(F)(F)F)cnc2C#N)C[C@@H](C)C1	ZINC000413294694	458296851	/nfs/dbraw/zinc/29/68/51/458296851.db2.gz	BOZNDMNJVPXWCC-SLEUVZQESA-N	0	3	338.377	3.139	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N(C)C[C@@H]1CCCN(CC)[C@H]1c1cnn(C)c1	ZINC000372537259	458306031	/nfs/dbraw/zinc/30/60/31/458306031.db2.gz	BLFXAMPNLJMYAU-JENIJYKNSA-N	0	3	346.519	3.254	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NC(=O)N(C)[C@@H]1CCN(C)C[C@@H]1C	ZINC000413834744	458309350	/nfs/dbraw/zinc/30/93/50/458309350.db2.gz	MLCDQABEAFZAJX-QXAKKESOSA-N	0	3	329.488	3.155	20	30		EGEDHN
COc1cc(CN2CCNC[C@H]2c2ccccc2Cl)ccc1C#N	ZINC000414740700	458325434	/nfs/dbraw/zinc/32/54/34/458325434.db2.gz	RJTKUQOKDCJAEP-SFHVURJKSA-N	0	3	341.842	3.367	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Nc1ccc2c(c1)CCN2)C(C)C	ZINC000415844133	458334214	/nfs/dbraw/zinc/33/42/14/458334214.db2.gz	ITRDPPRPTURIND-IBGZPJMESA-N	0	3	342.487	3.475	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N[C@H](CO)CC1CCCCC1	ZINC000416325329	458342054	/nfs/dbraw/zinc/34/20/54/458342054.db2.gz	KADPMECTOPUWBP-MOPGFXCFSA-N	0	3	328.456	3.206	20	30		EGEDHN
COc1cc(NC(=O)C2(C#N)CCCCC2)ccc1OCCN(C)C	ZINC000416345145	458343132	/nfs/dbraw/zinc/34/31/32/458343132.db2.gz	WWRJHGZUWFCXHM-UHFFFAOYSA-N	0	3	345.443	3.048	20	30		EGEDHN
C[C@@H](CNC(=O)c1cccc(SCC#N)c1)N1CCCC[C@@H]1C	ZINC000429954370	458384809	/nfs/dbraw/zinc/38/48/09/458384809.db2.gz	VHTLWQQUSUWJRO-GJZGRUSLSA-N	0	3	331.485	3.295	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)N1C[C@@H](N2CCCC2)C[C@@H]1C	ZINC000376791826	458389937	/nfs/dbraw/zinc/38/99/37/458389937.db2.gz	IKNKOTPTGNTJLL-HOCLYGCPSA-N	0	3	342.443	3.047	20	30		EGEDHN
COc1ccc([C@@H](C)CN2CC[C@H](Oc3ccc(C#N)cn3)C2)cc1	ZINC000430153557	458412071	/nfs/dbraw/zinc/41/20/71/458412071.db2.gz	FAXZFKMJJCAADC-KXBFYZLASA-N	0	3	337.423	3.219	20	30		EGEDHN
COc1cc(C)ccc1CN(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000449322385	458422964	/nfs/dbraw/zinc/42/29/64/458422964.db2.gz	XHXXYLURWPJSKK-UHFFFAOYSA-N	0	3	337.467	3.439	20	30		EGEDHN
CC(=O)NCCc1ccc([C@H](C)NCc2ccc(C#N)s2)cc1	ZINC000421870027	458423138	/nfs/dbraw/zinc/42/31/38/458423138.db2.gz	FHQJLFGTXMXFBU-ZDUSSCGKSA-N	0	3	327.453	3.149	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1	ZINC000449524135	458426762	/nfs/dbraw/zinc/42/67/62/458426762.db2.gz	ZAIHGGMHEHZONE-WBVHZDCISA-N	0	3	344.367	3.297	20	30		EGEDHN
COCCOCc1ccc(CNCc2ccc(C#N)c(F)c2)cc1	ZINC000449738081	458430737	/nfs/dbraw/zinc/43/07/37/458430737.db2.gz	YDVUWUJFUTYISU-UHFFFAOYSA-N	0	3	328.387	3.150	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NCC(C)(C)CCC#N	ZINC000376977376	458433867	/nfs/dbraw/zinc/43/38/67/458433867.db2.gz	YUVDJYKGFNEVQF-FUHWJXTLSA-N	0	3	342.487	3.136	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)CN1[C@H](C)C[C@H](c2ccccc2)[C@H]1C	ZINC000451184171	458469181	/nfs/dbraw/zinc/46/91/81/458469181.db2.gz	LLMVOWWRGMYOGF-ZTRFORPCSA-N	0	3	327.472	3.307	20	30		EGEDHN
N#CC1(c2ccccc2)CC(NCc2ccccc2Cn2cncn2)C1	ZINC000377139729	458473272	/nfs/dbraw/zinc/47/32/72/458473272.db2.gz	KRNGKLRSPKNQBD-UHFFFAOYSA-N	0	3	343.434	3.040	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NC[C@H](c1ccc(CC)cc1)N(C)C	ZINC000437641915	458477979	/nfs/dbraw/zinc/47/79/79/458477979.db2.gz	SIGUHCASQJLRPD-UYAOXDASSA-N	0	3	332.488	3.197	20	30		EGEDHN
Cc1sc(NC(=O)CN[C@@H]2C[C@H](OC(C)C)C2(C)C)c(C#N)c1C	ZINC000451509645	458480013	/nfs/dbraw/zinc/48/00/13/458480013.db2.gz	YKWGGJYTPHLCII-CABCVRRESA-N	0	3	349.500	3.357	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H]2CCN(c3cnn(C)c3)C2)cc1Cl	ZINC000377723456	458512105	/nfs/dbraw/zinc/51/21/05/458512105.db2.gz	NGOVILWKXXKLPT-OAHLLOKOSA-N	0	3	346.862	3.007	20	30		EGEDHN
CN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2ccc(C(C)(C)C#N)cc2)C1	ZINC000373538340	458524271	/nfs/dbraw/zinc/52/42/71/458524271.db2.gz	UYGZIVOFBHXSMQ-VQTJNVASSA-N	0	3	347.462	3.315	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1N[C@H](C)c1ccc(OC)c(Br)c1	ZINC000453348352	458524886	/nfs/dbraw/zinc/52/48/86/458524886.db2.gz	HNEZSTMCIPFVQY-HONMWMINSA-N	0	3	326.234	3.452	20	30		EGEDHN
C=C(C)Cn1c(CC(C)(C)C)nnc1N1CCCN(C(C)C)CC1	ZINC000453463444	458533189	/nfs/dbraw/zinc/53/31/89/458533189.db2.gz	JKWOQGLYVHLAHA-UHFFFAOYSA-N	0	3	333.524	3.363	20	30		EGEDHN
CCC(C)(C)OCCNCc1cn(C)nc1-c1ccc(C#N)cc1	ZINC000453623767	458538828	/nfs/dbraw/zinc/53/88/28/458538828.db2.gz	ZRMLZWKJEXALPG-UHFFFAOYSA-N	0	3	326.444	3.254	20	30		EGEDHN
Cc1cccc2[nH]c([C@@H](C#N)C(=O)c3cccc(CN(C)C)c3)nc21	ZINC000453673646	458542543	/nfs/dbraw/zinc/54/25/43/458542543.db2.gz	PNVKTGGUDJIMDH-INIZCTEOSA-N	0	3	332.407	3.423	20	30		EGEDHN
Cc1cccc2nc([C@@H](C#N)C(=O)c3cccc(CN(C)C)c3)[nH]c21	ZINC000453673646	458542547	/nfs/dbraw/zinc/54/25/47/458542547.db2.gz	PNVKTGGUDJIMDH-INIZCTEOSA-N	0	3	332.407	3.423	20	30		EGEDHN
Cc1nc(-c2ccc([C@@H](C)NC(=O)[C@H](N)CCCC#N)cc2)cs1	ZINC000424088069	458555653	/nfs/dbraw/zinc/55/56/53/458555653.db2.gz	IVQQRWYCTOUKDA-MLGOLLRUSA-N	0	3	342.468	3.317	20	30		EGEDHN
CC(C)(CNC(=O)[C@H](N)CCCC#N)c1cccc(C(F)(F)F)c1	ZINC000424111439	458561347	/nfs/dbraw/zinc/56/13/47/458561347.db2.gz	GPBSZFNWONVNNP-CQSZACIVSA-N	0	3	341.377	3.120	20	30		EGEDHN
C[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)[C@@H](N)CCCC#N	ZINC000424117912	458561878	/nfs/dbraw/zinc/56/18/78/458561878.db2.gz	ZOKDHVUDYNZKGB-HZMBPMFUSA-N	0	3	328.243	3.062	20	30		EGEDHN
C[C@H](Cc1ccc(Cl)cc1Cl)NC(=O)[C@H](N)CCCC#N	ZINC000424117916	458562019	/nfs/dbraw/zinc/56/20/19/458562019.db2.gz	ZOKDHVUDYNZKGB-QMTHXVAHSA-N	0	3	328.243	3.062	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1cc(Cl)ccc1N1CCCCC1	ZINC000424127111	458565491	/nfs/dbraw/zinc/56/54/91/458565491.db2.gz	AMDNHTYQOKPWMZ-AWEZNQCLSA-N	0	3	334.851	3.290	20	30		EGEDHN
Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)[C@H](N)CCCC#N	ZINC000424150262	458571823	/nfs/dbraw/zinc/57/18/23/458571823.db2.gz	YNERAKUZTLWKFR-NVXWUHKLSA-N	0	3	328.460	3.334	20	30		EGEDHN
CC(C)(C)c1ccc(C(C)(C)CNC(=O)[C@@H](N)CCCC#N)cc1	ZINC000424170967	458576164	/nfs/dbraw/zinc/57/61/64/458576164.db2.gz	LRQLTCSFSFFIDQ-KRWDZBQOSA-N	0	3	329.488	3.399	20	30		EGEDHN
C=C(C)CCNC(=O)N1CC[C@]2(CCN(Cc3ccccc3)C2)C1	ZINC000455310020	458592787	/nfs/dbraw/zinc/59/27/87/458592787.db2.gz	COYHGBZBDPDUEQ-FQEVSTJZSA-N	0	3	327.472	3.260	20	30		EGEDHN
CN(CCN(C)C1CC1)C(=O)Nc1ccc(OC(C)(C)C)c(C#N)c1	ZINC000455761935	458612375	/nfs/dbraw/zinc/61/23/75/458612375.db2.gz	AJYNRBSLWHLEPX-UHFFFAOYSA-N	0	3	344.459	3.293	20	30		EGEDHN
C[C@@H]1[C@@H](NC(=O)Nc2ccc(OC(C)(C)C)c(C#N)c2)CCCN1C	ZINC000455768893	458613805	/nfs/dbraw/zinc/61/38/05/458613805.db2.gz	LEKVQKNVRVCPFZ-CJNGLKHVSA-N	0	3	344.459	3.340	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)Nc2ccc(OC(C)(C)C)c(C#N)c2)CCN1C	ZINC000455806688	458616153	/nfs/dbraw/zinc/61/61/53/458616153.db2.gz	YUAXCPXUWGBTBT-CJNGLKHVSA-N	0	3	344.459	3.340	20	30		EGEDHN
C=C[C@H]1CCCCN1C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000494182193	458638282	/nfs/dbraw/zinc/63/82/82/458638282.db2.gz	IBHGVCHWRVCFQT-FQEVSTJZSA-N	0	3	341.499	3.444	20	30		EGEDHN
C=CCCn1cc(C(=O)Nc2cccc(CN3CCCCC3)c2)nn1	ZINC000424584035	458669320	/nfs/dbraw/zinc/66/93/20/458669320.db2.gz	OFDGWUGKRDZWID-UHFFFAOYSA-N	0	3	339.443	3.092	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CCc2ccccc2C1)C(C)C	ZINC000503443060	458708102	/nfs/dbraw/zinc/70/81/02/458708102.db2.gz	VLFXBORFZFUFMN-HXUWFJFHSA-N	0	3	341.499	3.453	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@@H](C)N1CC[C@H](c2ccc(OC)cc2)C1	ZINC000504488607	458738653	/nfs/dbraw/zinc/73/86/53/458738653.db2.gz	MUZXOKQNZPFMSM-AEFFLSMTSA-N	0	3	330.472	3.298	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCc2ccc(C3CCC3)cc2)CC1	ZINC000494797540	458747422	/nfs/dbraw/zinc/74/74/22/458747422.db2.gz	WHTKFOFADMGCBY-UHFFFAOYSA-N	0	3	327.472	3.404	20	30		EGEDHN
C[C@@H](C(=O)NC1(C#N)CCC1)N1CCC[C@H](c2ccccc2)CC1	ZINC000530336218	458750042	/nfs/dbraw/zinc/75/00/42/458750042.db2.gz	TXHWQEZWQFJWKL-WMZOPIPTSA-N	0	3	325.456	3.207	20	30		EGEDHN
CN(C)CCN(CC1CCCCC1)C(=O)Cc1c(F)cccc1C#N	ZINC000507468142	458754626	/nfs/dbraw/zinc/75/46/26/458754626.db2.gz	MVPSLVKEVKWIHA-UHFFFAOYSA-N	0	3	345.462	3.210	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CN2CCC(c3ccccc3)CC2)cc1	ZINC000514368519	458798096	/nfs/dbraw/zinc/79/80/96/458798096.db2.gz	PTJBRRFSTJUNCP-FQEVSTJZSA-N	0	3	336.435	3.178	20	30		EGEDHN
C=CCc1ccc(OC[C@H](O)CN2CC(C)(C)[C@@H]2C2CC2)c(OC)c1	ZINC000515100585	458805529	/nfs/dbraw/zinc/80/55/29/458805529.db2.gz	FNJCFHGACUITAO-XLIONFOSSA-N	0	3	345.483	3.284	20	30		EGEDHN
C=CC[C@H](CO)N[C@@H](C)c1ccc(CNC(=O)OC(C)(C)C)nc1C	ZINC000495377481	458844966	/nfs/dbraw/zinc/84/49/66/458844966.db2.gz	PSIWSJZGVWFEGT-GOEBONIOSA-N	0	3	349.475	3.002	20	30		EGEDHN
C=CCCCCNC(=O)Nc1cccc(N2CCN(CC)CC2)c1	ZINC000473836550	458845092	/nfs/dbraw/zinc/84/50/92/458845092.db2.gz	OQRUYHUICVQCBG-UHFFFAOYSA-N	0	3	330.476	3.306	20	30		EGEDHN
C=CCOCCCN1CCN(Cc2ccccc2OCC)C[C@@H]1C	ZINC000441325792	458919372	/nfs/dbraw/zinc/91/93/72/458919372.db2.gz	CLPVSLGZTJAJJN-SFHVURJKSA-N	0	3	332.488	3.184	20	30		EGEDHN
COC1(CN2CCN([C@H](C#N)c3cccc(Cl)c3)CC2)CCCC1	ZINC000475339901	458937421	/nfs/dbraw/zinc/93/74/21/458937421.db2.gz	WOHYTUXPOXYUOM-GOSISDBHSA-N	0	3	347.890	3.481	20	30		EGEDHN
C=CCCN(C)C(=O)NC[C@H](c1cccc(OC)c1)N(CC)CC	ZINC000466975772	458940468	/nfs/dbraw/zinc/94/04/68/458940468.db2.gz	QGIAXAIUJYVTBP-GOSISDBHSA-N	0	3	333.476	3.296	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N[C@@H]1CCCN(C)[C@H]1C)c1ccc(F)c(F)c1	ZINC000477195714	459034965	/nfs/dbraw/zinc/03/49/65/459034965.db2.gz	VXXZIZFHMQFWBO-VUCTXSBTSA-N	0	3	337.414	3.364	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)N[C@@H]1CCN(CC2CC2)C1	ZINC000590033397	459070037	/nfs/dbraw/zinc/07/00/37/459070037.db2.gz	FCPUXVUPGZEAPZ-OAHLLOKOSA-N	0	3	339.464	3.296	20	30		EGEDHN
C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NCc1cc(C#N)ccc1F	ZINC000496144523	459085941	/nfs/dbraw/zinc/08/59/41/459085941.db2.gz	YMVMMVJHEYAQOD-GUYCJALGSA-N	0	3	347.434	3.432	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCc3cc(C)ccc3C2)CC1	ZINC000478620701	459101050	/nfs/dbraw/zinc/10/10/50/459101050.db2.gz	JZXDFIBAMTVEBY-UHFFFAOYSA-N	0	3	327.472	3.103	20	30		EGEDHN
CC(C)(C)N1C[C@@H](C(=O)N2CCC[C@](C)(C#N)C2)[C@H](C(F)(F)F)C1	ZINC000590326616	459116744	/nfs/dbraw/zinc/11/67/44/459116744.db2.gz	ANEFXWNMMBJYNQ-XJKCOSOUSA-N	0	3	345.409	3.047	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCc2ccccc2COC(C)C)CC1	ZINC000521238931	459134493	/nfs/dbraw/zinc/13/44/93/459134493.db2.gz	TYYHGVXEXYSKHB-UHFFFAOYSA-N	0	3	345.487	3.061	20	30		EGEDHN
N#Cc1ccc(CCN[C@H](C(=O)N2CCCCC2)c2ccccc2)cc1	ZINC000594710123	459136130	/nfs/dbraw/zinc/13/61/30/459136130.db2.gz	IKDLPNWYLMVFCG-NRFANRHFSA-N	0	3	347.462	3.444	20	30		EGEDHN
C=C(C)Cn1c(C2CCCC2)nnc1N1C[C@H](C)N(CC)C[C@@H]1C	ZINC000558626332	459183739	/nfs/dbraw/zinc/18/37/39/459183739.db2.gz	XGYANKYKAAZYEG-HOTGVXAUSA-N	0	3	331.508	3.431	20	30		EGEDHN
C[C@@H](CN1CCN(c2nccnc2C#N)C[C@H]1C)C1CCCCC1	ZINC000559113741	459238176	/nfs/dbraw/zinc/23/81/76/459238176.db2.gz	XSTYRJLZVUPIOH-JKSUJKDBSA-N	0	3	327.476	3.075	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CCN(C(=O)CCCCCC#N)C1	ZINC000590874728	459254119	/nfs/dbraw/zinc/25/41/19/459254119.db2.gz	QFWURUVZLLGMTP-SFHVURJKSA-N	0	3	327.472	3.441	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1NCc1ccc(C#N)c(F)c1	ZINC000496602840	459255142	/nfs/dbraw/zinc/25/51/42/459255142.db2.gz	ISRKGRQQXPOVNG-JKSUJKDBSA-N	0	3	333.407	3.233	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]1NCc1ccc(C#N)c(F)c1	ZINC000496602839	459255675	/nfs/dbraw/zinc/25/56/75/459255675.db2.gz	ISRKGRQQXPOVNG-HZPDHXFCSA-N	0	3	333.407	3.233	20	30		EGEDHN
C=CCN1CCC(NC(=O)CCCc2ccc(SC)cc2)CC1	ZINC000580448344	459260609	/nfs/dbraw/zinc/26/06/09/459260609.db2.gz	HKQNSYMKTQGODP-UHFFFAOYSA-N	0	3	332.513	3.498	20	30		EGEDHN
N#Cc1ccc(CCN2CCCN(Cc3ccc(F)cc3)CC2)cc1	ZINC000595290097	459267631	/nfs/dbraw/zinc/26/76/31/459267631.db2.gz	VDXUTEGKJHIJNN-UHFFFAOYSA-N	0	3	337.442	3.448	20	30		EGEDHN
Cc1cccc(C(=O)N2CCCN(CCc3ccc(C#N)cc3)CC2)c1	ZINC000595289481	459267729	/nfs/dbraw/zinc/26/77/29/459267729.db2.gz	GFWRBXWEPBCQOW-UHFFFAOYSA-N	0	3	347.462	3.257	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)N1CC[C@@H](Cc2ccc(F)cc2)C1	ZINC000523011145	459276652	/nfs/dbraw/zinc/27/66/52/459276652.db2.gz	FFRDLRKMKGIZGX-WMZOPIPTSA-N	0	3	330.447	3.279	20	30		EGEDHN
Cc1ccc(NC(=O)C2CCN(CCc3ccc(C#N)cc3)CC2)nc1	ZINC000595359481	459284003	/nfs/dbraw/zinc/28/40/03/459284003.db2.gz	NWANNTICGVKUAL-UHFFFAOYSA-N	0	3	348.450	3.155	20	30		EGEDHN
N#Cc1ccccc1N1CCN(CCCc2ccc3c(c2)CCO3)CC1	ZINC000482084682	459288576	/nfs/dbraw/zinc/28/85/76/459288576.db2.gz	URVVZWRVIKKQCE-UHFFFAOYSA-N	0	3	347.462	3.248	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)N1CCC[C@@H](CC#N)C1)c1ccccc1	ZINC000595428291	459298114	/nfs/dbraw/zinc/29/81/14/459298114.db2.gz	XBSBNGZIBHUKPI-PKOBYXMFSA-N	0	3	342.487	3.405	20	30		EGEDHN
N#CC(C(=O)c1cncnc1C1CC1)c1ccc(C(F)(F)F)cn1	ZINC000582342925	459349595	/nfs/dbraw/zinc/34/95/95/459349595.db2.gz	WSSGYIOKOTZNDJ-LLVKDONJSA-N	0	3	332.285	3.258	20	30		EGEDHN
C=C(CN(C)C)C(=O)Nc1ccc(CN(C)C(=O)OC(C)(C)C)cc1	ZINC000496879102	459356878	/nfs/dbraw/zinc/35/68/78/459356878.db2.gz	ANRLBQJLZLHUQO-UHFFFAOYSA-N	0	3	347.459	3.110	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2NCc1ccccc1-n1cncn1	ZINC000591357530	459361540	/nfs/dbraw/zinc/36/15/40/459361540.db2.gz	LVDCGKRMSQOHFM-IBGZPJMESA-N	0	3	329.407	3.306	20	30		EGEDHN
C=CCN(C(=O)NC[C@@H](c1cccc(OC)c1)N(CC)CC)C1CC1	ZINC000537856526	459367837	/nfs/dbraw/zinc/36/78/37/459367837.db2.gz	GAJAGSKJNSIHHS-IBGZPJMESA-N	0	3	345.487	3.438	20	30		EGEDHN
CCC[C@@H](NC[C@@H](O)COc1ccc(CC#N)cc1)c1ccccn1	ZINC000591734586	459427378	/nfs/dbraw/zinc/42/73/78/459427378.db2.gz	UNEGDHKNXMALFC-IEBWSBKVSA-N	0	3	339.439	3.018	20	30		EGEDHN
CC(C)C[C@H](NC[C@H](O)CN(C)CCC#N)c1ccc(Cl)cc1	ZINC000591742312	459428324	/nfs/dbraw/zinc/42/83/24/459428324.db2.gz	JHGCCPCMYKHWIC-ROUUACIJSA-N	0	3	337.895	3.223	20	30		EGEDHN
CCN(CC)C(=O)C1(NCc2ccc(CC#N)cc2)CCCCC1	ZINC000541281065	459438673	/nfs/dbraw/zinc/43/86/73/459438673.db2.gz	CHDOYXMAGQKISW-UHFFFAOYSA-N	0	3	327.472	3.414	20	30		EGEDHN
C[C@H](CN[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O)c1ccccc1	ZINC000485270918	459446917	/nfs/dbraw/zinc/44/69/17/459446917.db2.gz	JGADGJLFNMBKHG-OXQOHEQNSA-N	0	3	333.435	3.447	20	30		EGEDHN
COCCN1CCC[C@H](Nc2c(C#N)cnc3c(Cl)cccc32)C1	ZINC000591912643	459481030	/nfs/dbraw/zinc/48/10/30/459481030.db2.gz	QEJWNLDTJBXOQA-AWEZNQCLSA-N	0	3	344.846	3.283	20	30		EGEDHN
COC1CCN(CCNc2c(C#N)cnc3c(Cl)cccc32)CC1	ZINC000591922993	459486272	/nfs/dbraw/zinc/48/62/72/459486272.db2.gz	XOQHSVJWPYZVPA-UHFFFAOYSA-N	0	3	344.846	3.283	20	30		EGEDHN
CCCN(C(=O)N[C@H]1CCCc2cc(C#N)ccc21)[C@@H]1CCN(C)C1	ZINC000592034447	459515264	/nfs/dbraw/zinc/51/52/64/459515264.db2.gz	MIJAAQWKNLQPOW-MJGOQNOKSA-N	0	3	340.471	3.061	20	30		EGEDHN
C[C@H](c1ccccc1)[C@H](O)CN1CCC(C#N)(c2ccccn2)CC1	ZINC000569918240	459531395	/nfs/dbraw/zinc/53/13/95/459531395.db2.gz	YMSWLXGGYCFBHL-IEBWSBKVSA-N	0	3	335.451	3.103	20	30		EGEDHN
Cc1cc(CN[C@H](CN2CCOCC2)c2ccccc2)ccc1C#N	ZINC000488099232	459538298	/nfs/dbraw/zinc/53/82/98/459538298.db2.gz	JNHGKOOJHVSJQF-OAQYLSRUSA-N	0	3	335.451	3.030	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN2CC[C@H](Oc3ccccc3)C2)c1	ZINC000583562427	459560051	/nfs/dbraw/zinc/56/00/51/459560051.db2.gz	SVZSBAHIXHDZFK-IBGZPJMESA-N	0	3	335.407	3.040	20	30		EGEDHN
C=CCN(CCc1ccco1)C(=O)NC[C@@H](C)N1CCCC[C@@H]1C	ZINC000498144742	459570808	/nfs/dbraw/zinc/57/08/08/459570808.db2.gz	ISQRDAAVKYFXRC-DLBZAZTESA-N	0	3	333.476	3.283	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H](CC(F)(F)F)c2ccccc2)CC1	ZINC000490594559	459580424	/nfs/dbraw/zinc/58/04/24/459580424.db2.gz	SMTACWHUDCTKKX-MRXNPFEDSA-N	0	3	338.373	3.142	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H](c2ccc(Cl)cc2)C2CC2)CC1	ZINC000490575668	459580618	/nfs/dbraw/zinc/58/06/18/459580618.db2.gz	SYIUAYAJVQWBMN-GOSISDBHSA-N	0	3	330.859	3.253	20	30		EGEDHN
N#CCc1ccc(OC[C@H](O)CN[C@H]2CCCc3sccc32)cc1	ZINC000583689421	459581279	/nfs/dbraw/zinc/58/12/79/459581279.db2.gz	QBFMGDXVDYEBLR-QAPCUYQASA-N	0	3	342.464	3.221	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cc(F)c(OC(C)C)c(F)c2)CC1	ZINC000490950174	459591555	/nfs/dbraw/zinc/59/15/55/459591555.db2.gz	PCUUFFLQCYFWMY-UHFFFAOYSA-N	0	3	336.382	3.036	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@H](N[C@H]1CCN(C(=O)C3CCCCC3)C1)CC2	ZINC000583781923	459595260	/nfs/dbraw/zinc/59/52/60/459595260.db2.gz	JYEWPMTVCATNMN-AZUAARDMSA-N	0	3	337.467	3.316	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCCc2ccc(C(C)C)cc2)CC1	ZINC000592473915	459609093	/nfs/dbraw/zinc/60/90/93/459609093.db2.gz	DQOUEMATKPQGIE-UHFFFAOYSA-N	0	3	329.488	3.302	20	30		EGEDHN
C[C@@H](N[C@H](C)c1ccc2c(c1)CCCC2)C(=O)NC1(C#N)CCC1	ZINC000527299507	459625270	/nfs/dbraw/zinc/62/52/70/459625270.db2.gz	SGYOBCQKVSUNQA-HUUCEWRRSA-N	0	3	325.456	3.167	20	30		EGEDHN
C[C@@H](N[C@@H](c1ccc(F)cc1)C1CCC1)C(=O)NC1(C#N)CCC1	ZINC000583976892	459627895	/nfs/dbraw/zinc/62/78/95/459627895.db2.gz	SCMYAPUEDHIKEP-CXAGYDPISA-N	0	3	329.419	3.207	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC[C@H](SC)C(C)(C)C)CC1	ZINC000543184263	459632301	/nfs/dbraw/zinc/63/23/01/459632301.db2.gz	KFCXXCAJCFHUCT-HNNXBMFYSA-N	0	3	327.538	3.104	20	30		EGEDHN
N#CC1(NC(=O)CN2CCCC[C@@H]2CCCc2ccccc2)CCC1	ZINC000527377256	459638776	/nfs/dbraw/zinc/63/87/76/459638776.db2.gz	UXVWGWABJJRCOU-LJQANCHMSA-N	0	3	339.483	3.426	20	30		EGEDHN
C#C[C@@H](NC(=N)Nc1cc(OC)ccc1OC)c1ccc(F)cc1	ZINC000491619597	459640305	/nfs/dbraw/zinc/64/03/05/459640305.db2.gz	BBKLTVPGIUFQQB-OAHLLOKOSA-N	0	3	327.359	3.154	20	30		EGEDHN
C#CCNC(=O)C1CCN([C@H](C)c2ccc(C(F)(F)F)cc2)CC1	ZINC000491637711	459644391	/nfs/dbraw/zinc/64/43/91/459644391.db2.gz	USPFDJBGTUGNMU-CYBMUJFWSA-N	0	3	338.373	3.228	20	30		EGEDHN
N#CCC[C@@H](C#N)CNCC1(c2ccc3c(c2)OCCO3)CCCC1	ZINC000562862648	459661584	/nfs/dbraw/zinc/66/15/84/459661584.db2.gz	IZGANFGFAXCMIB-INIZCTEOSA-N	0	3	339.439	3.303	20	30		EGEDHN
N#Cc1ccc([C@H](N[C@H]2CCC[C@@H]2Cc2ccccc2)C(N)=O)cc1	ZINC000493494759	459747032	/nfs/dbraw/zinc/74/70/32/459747032.db2.gz	AJQIALSSDGRKFT-AABGKKOBSA-N	0	3	333.435	3.086	20	30		EGEDHN
COc1ccc(C#N)cc1NC(=O)C(C[C@@H]1CCCO1)C(F)(F)F	ZINC000593047253	459752560	/nfs/dbraw/zinc/75/25/60/459752560.db2.gz	XHGMLJNNVHBYMV-NWDGAFQWSA-N	0	3	342.317	3.253	20	30		EGEDHN
C[C@@H](C#N)CSc1ccccc1NC(=O)CNC1(C2CC2)CC1	ZINC000544415083	459758052	/nfs/dbraw/zinc/75/80/52/459758052.db2.gz	GPRYUVAOXNPVCM-ZDUSSCGKSA-N	0	3	329.469	3.409	20	30		EGEDHN
N#CCCC1CCN(C(=O)[C@@H]2CCCN2Cc2ccccc2)CC1	ZINC000565020083	459780415	/nfs/dbraw/zinc/78/04/15/459780415.db2.gz	UUZJKAWCLAYIAE-IBGZPJMESA-N	0	3	325.456	3.193	20	30		EGEDHN
N#CC1(C[C@H](O)CN2CCC[C@H](c3nc4ccc(F)cc4o3)C2)CC1	ZINC000528421502	459806962	/nfs/dbraw/zinc/80/69/62/459806962.db2.gz	QUQYLAANEBWDKB-ZFWWWQNUSA-N	0	3	343.402	3.201	20	30		EGEDHN
COCc1ccc(NC(=O)NCCN2[C@@H](C)CCC[C@@H]2C)cc1C#N	ZINC000529210089	459825223	/nfs/dbraw/zinc/82/52/23/459825223.db2.gz	CMJBAUFHOQFZPE-GJZGRUSLSA-N	0	3	344.459	3.089	20	30		EGEDHN
CCC(C#N)(CC)C(=O)N1CCN(c2ccnc3ccccc32)CC1	ZINC000529351875	459827721	/nfs/dbraw/zinc/82/77/21/459827721.db2.gz	ZFEGPZMULHAGAW-UHFFFAOYSA-N	0	3	336.439	3.213	20	30		EGEDHN
COCCN(Cc1ccc(C#N)cc1[N+](=O)[O-])C[C@@H]1CC=CCC1	ZINC000566299387	459837667	/nfs/dbraw/zinc/83/76/67/459837667.db2.gz	BMMRTTBWMHMSHW-OAHLLOKOSA-N	0	3	329.400	3.271	20	30		EGEDHN
N#CCc1ccc(OC[C@@H](O)CN2CCC=C(c3ccccc3)C2)cc1	ZINC000585756042	459841323	/nfs/dbraw/zinc/84/13/23/459841323.db2.gz	ZKIGQBGLIHRLQA-NRFANRHFSA-N	0	3	348.446	3.282	20	30		EGEDHN
Cc1cc(CN[C@H](C)[C@@H]2CN(Cc3ccccc3)CCO2)ccc1C#N	ZINC000574714074	459859679	/nfs/dbraw/zinc/85/96/79/459859679.db2.gz	YFCOEQAXPGKJJL-GCJKJVERSA-N	0	3	349.478	3.246	20	30		EGEDHN
Cn1cc([C@@H]2N(C(=O)C(C#N)CCc3ccccc3)CC2(C)C)cn1	ZINC000574762971	459868513	/nfs/dbraw/zinc/86/85/13/459868513.db2.gz	CBPHGKVWJZHFJY-AEFFLSMTSA-N	0	3	336.439	3.102	20	30		EGEDHN
C[C@@H](NC(=O)N1Cc2cccc(C#N)c2C1)[C@H](c1ccccc1)N(C)C	ZINC000593404669	459880520	/nfs/dbraw/zinc/88/05/20/459880520.db2.gz	UAGYEWMVYQXVAH-FOIQADDNSA-N	0	3	348.450	3.275	20	30		EGEDHN
CCC(C#N)C(=O)N[C@@H](CC(=O)OC)c1ccc(C(C)(C)C)cc1	ZINC000593481992	459902577	/nfs/dbraw/zinc/90/25/77/459902577.db2.gz	UXDUVOWTTPRPRF-BBRMVZONSA-N	0	3	330.428	3.254	20	30		EGEDHN
CN(Cc1cccc(Br)c1)C[C@H](O)CC(C)(C)C#N	ZINC000598586799	459953886	/nfs/dbraw/zinc/95/38/86/459953886.db2.gz	ZYUBWVSILSRZKR-CQSZACIVSA-N	0	3	325.250	3.182	20	30		EGEDHN
CC[C@H]1CCCCN1CCNC(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1	ZINC000575149721	459937584	/nfs/dbraw/zinc/93/75/84/459937584.db2.gz	QLRGGVJBMOGKHQ-GBESFXJTSA-N	0	3	325.456	3.042	20	30		EGEDHN
COc1c(Cl)cc(Cl)cc1CNC1CCN(CC#N)CC1	ZINC000609335150	459946624	/nfs/dbraw/zinc/94/66/24/459946624.db2.gz	WPFZURIVYLKGHJ-UHFFFAOYSA-N	0	3	328.243	3.080	20	30		EGEDHN
C/C(=C/c1ccccc1)CN[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000588619509	459956047	/nfs/dbraw/zinc/95/60/47/459956047.db2.gz	KLPHGZVHSWAXDX-YULVEUEDSA-N	0	3	345.446	3.352	20	30		EGEDHN
CCN(CC)[C@H](CNCc1cccc(C#N)n1)c1cccc(OC)c1	ZINC000602502503	459971676	/nfs/dbraw/zinc/97/16/76/459971676.db2.gz	LIEVSRNMXBWLBH-HXUWFJFHSA-N	0	3	338.455	3.135	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CC[C@H](N(C)CCc2ccccc2)C1)OCC	ZINC000618354024	459981882	/nfs/dbraw/zinc/98/18/82/459981882.db2.gz	SATYWJDMMDTQRO-PMACEKPBSA-N	0	3	344.499	3.133	20	30		EGEDHN
Cc1ccc(-c2nc(CNC3CCN(CC#N)CC3)cs2)cc1	ZINC000609599614	459992372	/nfs/dbraw/zinc/99/23/72/459992372.db2.gz	AVLLTJOQDBPCPU-UHFFFAOYSA-N	0	3	326.469	3.196	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CNCc1cccc(OCc2ccccn2)c1	ZINC000598715969	460003254	/nfs/dbraw/zinc/00/32/54/460003254.db2.gz	WRZMBESLPKIBGW-GOSISDBHSA-N	0	3	339.439	3.051	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CNCc1ccnc(Oc2ccc(F)cc2)c1	ZINC000598718708	460005225	/nfs/dbraw/zinc/00/52/25/460005225.db2.gz	CUBNQVUMUQFWJW-INIZCTEOSA-N	0	3	343.402	3.403	20	30		EGEDHN
CC(C)C[C@H](C)Oc1cc(CNC[C@@H](O)CC(C)(C)C#N)ccn1	ZINC000598720616	460006046	/nfs/dbraw/zinc/00/60/46/460006046.db2.gz	PXXGLYQVCWNYDM-RDJZCZTQSA-N	0	3	333.476	3.285	20	30		EGEDHN
N#Cc1cccc(CN[C@@H]2CCN(c3ccc(F)c(Cl)c3)C2)n1	ZINC000602603174	460019110	/nfs/dbraw/zinc/01/91/10/460019110.db2.gz	MKUBWAFVOPDOIY-CQSZACIVSA-N	0	3	330.794	3.114	20	30		EGEDHN
CN(Cc1cccc(C#N)n1)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1	ZINC000602615202	460024187	/nfs/dbraw/zinc/02/41/87/460024187.db2.gz	WLFUHBFPWNIYBV-MOPGFXCFSA-N	0	3	325.387	3.444	20	30		EGEDHN
N#CC(C(=O)c1cnc2n1CCCCC2)c1nc(C2CC2)cs1	ZINC000621721548	460027643	/nfs/dbraw/zinc/02/76/43/460027643.db2.gz	SLBKVVOKLCGBFK-GFCCVEGCSA-N	0	3	326.425	3.433	20	30		EGEDHN
C[C@@H](CCC#N)CNc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1	ZINC000602656493	460046662	/nfs/dbraw/zinc/04/66/62/460046662.db2.gz	YSDCPWIKFMNOII-QFBILLFUSA-N	0	3	342.487	3.205	20	30		EGEDHN
CN(Cc1cccc(OCc2ccccc2C#N)c1)C[C@H](O)C1CC1	ZINC000589198211	460053715	/nfs/dbraw/zinc/05/37/15/460053715.db2.gz	SGTJQNQGURFGRM-NRFANRHFSA-N	0	3	336.435	3.340	20	30		EGEDHN
C[C@H](CCC#N)CN[C@H](CO)c1ccc(Br)c(F)c1	ZINC000602671822	460057801	/nfs/dbraw/zinc/05/78/01/460057801.db2.gz	JYYZPYHSGOQPLE-QMTHXVAHSA-N	0	3	329.213	3.151	20	30		EGEDHN
CC1CCC(N2CCN(c3c(C#N)nnc4ccccc43)CC2)CC1	ZINC000610130855	460067519	/nfs/dbraw/zinc/06/75/19/460067519.db2.gz	MXSWXTNBLYSITJ-UHFFFAOYSA-N	0	3	335.455	3.202	20	30		EGEDHN
C[C@@H]1C[C@H](N(C)C(=O)c2cccc(C#N)n2)CCN1Cc1ccccc1	ZINC000589427937	460085524	/nfs/dbraw/zinc/08/55/24/460085524.db2.gz	QZJDZNDGPSRMDN-VQIMIIECSA-N	0	3	348.450	3.078	20	30		EGEDHN
N#CC[C@H]1CCCN(C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)C1	ZINC000597911389	460105933	/nfs/dbraw/zinc/10/59/33/460105933.db2.gz	LGCAPJXEEDRZNU-AEFFLSMTSA-N	0	3	343.446	3.190	20	30		EGEDHN
CCC(O)(CC)C(C)(C)CNC(=O)C(C#N)CCc1ccccc1	ZINC000597943252	460122431	/nfs/dbraw/zinc/12/24/31/460122431.db2.gz	WGEJUYSELGYMDZ-QGZVFWFLSA-N	0	3	330.472	3.452	20	30		EGEDHN
C[C@H](NC(=O)NCc1cccc(CN(C)C)c1)c1cccc(C#N)c1	ZINC000610347722	460128293	/nfs/dbraw/zinc/12/82/93/460128293.db2.gz	KZOGTIQKEIABPO-HNNXBMFYSA-N	0	3	336.439	3.180	20	30		EGEDHN
CN(C)CCN(Cc1ccccn1)Cc1ccc(C#N)cc1Cl	ZINC000576409436	460135294	/nfs/dbraw/zinc/13/52/94/460135294.db2.gz	SLLNTIOUHTZTMJ-UHFFFAOYSA-N	0	3	328.847	3.170	20	30		EGEDHN
N#CCCCCCC(=O)Nc1cccc(CN2CCC(CO)CC2)c1	ZINC000589840404	460149209	/nfs/dbraw/zinc/14/92/09/460149209.db2.gz	KNECHVIVBRNPOM-UHFFFAOYSA-N	0	3	343.471	3.303	20	30		EGEDHN
C[C@H](NCC[C@@H](O)COCc1ccccc1)c1ccc(C#N)c(F)c1	ZINC000599088614	460157334	/nfs/dbraw/zinc/15/73/34/460157334.db2.gz	IZPSTTSKASZFBZ-HNAYVOBHSA-N	0	3	342.414	3.316	20	30		EGEDHN
CC(C)C[C@@H](CN1CCCC1)NC(=O)[C@H](C)Cc1ccc(C#N)cc1	ZINC000594365508	460195718	/nfs/dbraw/zinc/19/57/18/460195718.db2.gz	PIRPNPSCOXELLU-XLIONFOSSA-N	0	3	341.499	3.364	20	30		EGEDHN
CN(CCc1ccccc1)[C@H]1CCN(C(=O)c2cccc(CC#N)c2)C1	ZINC000598195895	460199926	/nfs/dbraw/zinc/19/99/26/460199926.db2.gz	VWZNVSOYMPULDD-NRFANRHFSA-N	0	3	347.462	3.142	20	30		EGEDHN
C[C@H](c1ccc(F)c(F)c1)N(C)C[C@@H](O)COc1ccccc1C#N	ZINC000599255731	460205811	/nfs/dbraw/zinc/20/58/11/460205811.db2.gz	IWPCHZVTUNUWFS-CZUORRHYSA-N	0	3	346.377	3.269	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CN1CCSC2(CCCCC2)C1	ZINC000599306836	460222922	/nfs/dbraw/zinc/22/29/22/460222922.db2.gz	LTACXVIAOPGSQU-KRWDZBQOSA-N	0	3	346.496	3.050	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CNC1(c2ccc(F)cc2)CCC1	ZINC000599330837	460230062	/nfs/dbraw/zinc/23/00/62/460230062.db2.gz	LRLOWHMQPHZTDL-GOSISDBHSA-N	0	3	340.398	3.106	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CNC1(c2ccc(Cl)cc2)CC1	ZINC000599359928	460238564	/nfs/dbraw/zinc/23/85/64/460238564.db2.gz	JYACOWKKACUIQC-KRWDZBQOSA-N	0	3	342.826	3.230	20	30		EGEDHN
C[C@H](CC(=O)NCCc1ccccc1)N[C@@H](C)c1cccc(C#N)c1	ZINC000610830494	460245169	/nfs/dbraw/zinc/24/51/69/460245169.db2.gz	XCSKOGISLUXLHF-SJORKVTESA-N	0	3	335.451	3.346	20	30		EGEDHN
Cc1cc(Cl)c2c(c1)[C@@H](NC1CCN(CC#N)CC1)CCCO2	ZINC000610863835	460250960	/nfs/dbraw/zinc/25/09/60/460250960.db2.gz	WNWIGCNXADXLSG-KRWDZBQOSA-N	0	3	333.863	3.440	20	30		EGEDHN
N#Cc1ccc(CCN2CCN(c3cccc4[nH]ccc43)CC2)cc1	ZINC000599622486	460290092	/nfs/dbraw/zinc/29/00/92/460290092.db2.gz	JIBHNYJYMWFZKB-UHFFFAOYSA-N	0	3	330.435	3.404	20	30		EGEDHN
CN(CCCN(C)c1nc(C#N)c(Cl)s1)Cc1ccncc1	ZINC000603402450	460297803	/nfs/dbraw/zinc/29/78/03/460297803.db2.gz	SIIUQSINRKNOSV-UHFFFAOYSA-N	0	3	335.864	3.021	20	30		EGEDHN
CN1CCC(N(C(=O)c2ccc(CC#N)cc2)c2ccccc2)CC1	ZINC000611158692	460298487	/nfs/dbraw/zinc/29/84/87/460298487.db2.gz	DKGRUTVGVMIZHU-UHFFFAOYSA-N	0	3	333.435	3.494	20	30		EGEDHN
CCc1ccc(C2CCN([C@@H](C)C(=O)N(C)CCC#N)CC2)cc1	ZINC000599668968	460304326	/nfs/dbraw/zinc/30/43/26/460304326.db2.gz	JORXJDKVUPVIGY-INIZCTEOSA-N	0	3	327.472	3.189	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CCCc3sccc3C2)cc1	ZINC000619370980	460337707	/nfs/dbraw/zinc/33/77/07/460337707.db2.gz	AVOSMROCSDOHGE-KRWDZBQOSA-N	0	3	335.432	3.277	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2NCCC(=O)NC1CCCCC1	ZINC000611391093	460352940	/nfs/dbraw/zinc/35/29/40/460352940.db2.gz	SBRWTQBRSJUGTD-IBGZPJMESA-N	0	3	325.456	3.364	20	30		EGEDHN
N#Cc1cccc(CNC(=O)CN2CCC[C@@H]2C2CCCCC2)c1	ZINC000603896140	460356825	/nfs/dbraw/zinc/35/68/25/460356825.db2.gz	HUSBKDDFUPBXAR-LJQANCHMSA-N	0	3	325.456	3.219	20	30		EGEDHN
CN(Cc1ccccc1)C[C@@H](O)CN[C@@H](CCC#N)c1ccccc1	ZINC000611407026	460356932	/nfs/dbraw/zinc/35/69/32/460356932.db2.gz	VCGFFJBGBMRSQC-SFTDATJTSA-N	0	3	337.467	3.114	20	30		EGEDHN
CC(C)c1cc(CNC2CCN(Cc3ccc(C#N)cc3)CC2)on1	ZINC000611438576	460365259	/nfs/dbraw/zinc/36/52/59/460365259.db2.gz	IERVTQBOBHTIMH-UHFFFAOYSA-N	0	3	338.455	3.424	20	30		EGEDHN
CC1CCN([C@H](CNC(=O)NCC2(C#N)CC2)c2cccs2)CC1	ZINC000619525786	460373903	/nfs/dbraw/zinc/37/39/03/460373903.db2.gz	KNOWZIJBDAREBS-OAHLLOKOSA-N	0	3	346.500	3.124	20	30		EGEDHN
Cc1cccc(CN(CCN(C)C)C(=O)NCC#Cc2ccccc2)c1	ZINC000604164310	460384441	/nfs/dbraw/zinc/38/44/41/460384441.db2.gz	JJDDPRINDOFNFI-UHFFFAOYSA-N	0	3	349.478	3.120	20	30		EGEDHN
CC(C)(NCCCC1(C#N)CCOCC1)C(=O)Nc1ccccc1	ZINC000619621310	460399631	/nfs/dbraw/zinc/39/96/31/460399631.db2.gz	OXOKWENWQUPXIT-UHFFFAOYSA-N	0	3	329.444	3.094	20	30		EGEDHN
C[C@@H](CNC(=O)NCc1ccc(C#N)c(Cl)c1)N1CCC(C)CC1	ZINC000619759559	460434626	/nfs/dbraw/zinc/43/46/26/460434626.db2.gz	QLUYAGQYDXZSLC-AWEZNQCLSA-N	0	3	348.878	3.131	20	30		EGEDHN
N#Cc1ccc(CNC(=O)[C@@H]2CCCN2C2CCCC2)cc1Cl	ZINC000619780320	460442467	/nfs/dbraw/zinc/44/24/67/460442467.db2.gz	JCVQEQLAKBUNAY-KRWDZBQOSA-N	0	3	331.847	3.235	20	30		EGEDHN
CC(C#N)C(=O)N1CC[C@H](Sc2ccc(Br)cc2)C1	ZINC000600216147	460446378	/nfs/dbraw/zinc/44/63/78/460446378.db2.gz	VTVJTUUMYIFILY-GWCFXTLKSA-N	0	3	339.258	3.302	20	30		EGEDHN
N#CC(C(=O)c1ccc(Cn2ccnn2)cc1)c1nc(C2CC2)cs1	ZINC000626467410	460538817	/nfs/dbraw/zinc/53/88/17/460538817.db2.gz	RAKSBTHFRAWJBB-OAHLLOKOSA-N	0	3	349.419	3.150	20	30		EGEDHN
N#Cc1ccc2c(c1)CCCC[C@H]2NC[C@@H](n1cncn1)C(F)(F)F	ZINC000601294681	460779697	/nfs/dbraw/zinc/77/96/97/460779697.db2.gz	PNATZFLGZIKWBF-HZPDHXFCSA-N	0	3	349.360	3.310	20	30		EGEDHN
C[C@H](NCc1ccnc(N2CCSCC2)c1)c1ccc(C#N)cc1	ZINC000601302790	460781289	/nfs/dbraw/zinc/78/12/89/460781289.db2.gz	VUAWSGKAIYZDIT-HNNXBMFYSA-N	0	3	338.480	3.357	20	30		EGEDHN
N#CC(C(=O)c1cccc2c1OCCO2)c1ccc2ccccc2n1	ZINC000620847301	460807315	/nfs/dbraw/zinc/80/73/15/460807315.db2.gz	NSKISJFMTWMILF-HNNXBMFYSA-N	0	3	330.343	3.496	20	30		EGEDHN
C[C@H]1[C@@H](NC(=O)c2ccccc2CC#N)CCN1Cc1ccccc1	ZINC000601580538	460837353	/nfs/dbraw/zinc/83/73/53/460837353.db2.gz	NTDLROQXYGKPHY-JXFKEZNVSA-N	0	3	333.435	3.145	20	30		EGEDHN
C=CCN(C(=O)Nc1cc(CN)cc(C(F)(F)F)c1)[C@H](C)COC	ZINC000659022356	461144378	/nfs/dbraw/zinc/14/43/78/461144378.db2.gz	OSYWQFPSBRXFMV-LLVKDONJSA-N	0	3	345.365	3.219	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)C(=O)c1cc2c(s1)CCNC2	ZINC000662425035	461239570	/nfs/dbraw/zinc/23/95/70/461239570.db2.gz	XDUAEUZIWOCYIO-UHFFFAOYSA-N	0	3	342.464	3.231	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)C(=O)c1cccc2c1CCNC2	ZINC000662521241	461280357	/nfs/dbraw/zinc/28/03/57/461280357.db2.gz	OEIULIMXEGSKDH-UHFFFAOYSA-N	0	3	336.435	3.169	20	30		EGEDHN
CC#CC[C@@H](CO)NCc1cc(OC)c(OC)cc1-c1ccccc1	ZINC000641768594	461361666	/nfs/dbraw/zinc/36/16/66/461361666.db2.gz	CUTXGFWHONZMSB-SFHVURJKSA-N	0	3	339.435	3.235	20	30		EGEDHN
C=CCN(C(=O)NC[C@H](c1ccccc1)N1CCCC1)[C@@H](C)COC	ZINC000663400152	461621737	/nfs/dbraw/zinc/62/17/37/461621737.db2.gz	MUKUKELSPNACEW-PKOBYXMFSA-N	0	3	345.487	3.056	20	30		EGEDHN
CO[C@@H](CNCC#Cc1ccc(C(F)(F)F)cc1)C1CCOCC1	ZINC000638898466	461642701	/nfs/dbraw/zinc/64/27/01/461642701.db2.gz	OWLLXDYGRKMEBS-KRWDZBQOSA-N	0	3	341.373	3.088	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2CCNC3(CCCCC3)C2)cc1OC	ZINC000656364498	461716109	/nfs/dbraw/zinc/71/61/09/461716109.db2.gz	XLLXHQQAPNAOSZ-UHFFFAOYSA-N	0	3	344.455	3.008	20	30		EGEDHN
C=CCc1ccc(OC[C@H](O)CN2C[C@@H]3CCCC[C@@H]32)c(OC)c1	ZINC000656699169	461847382	/nfs/dbraw/zinc/84/73/82/461847382.db2.gz	BBNXYBBKPBYBGL-KSZLIROESA-N	0	3	331.456	3.038	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCc3ccc(C)cc3C2)CC1	ZINC000660596936	461872465	/nfs/dbraw/zinc/87/24/65/461872465.db2.gz	JWDZKGZQTIYRCK-UHFFFAOYSA-N	0	3	327.472	3.103	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](CC)Cc2ccc(F)cc2)CC1	ZINC000660704268	461930094	/nfs/dbraw/zinc/93/00/94/461930094.db2.gz	BLAJGVPLYKRNAQ-QGZVFWFLSA-N	0	3	333.451	3.096	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)[C@H](C)CSc2ccccc2)CC1	ZINC000650852609	461982688	/nfs/dbraw/zinc/98/26/88/461982688.db2.gz	KZHRRHDOXQRPMN-MRXNPFEDSA-N	0	3	347.528	3.459	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](N(C)Cc3ccccc3)C2)CCOCC1	ZINC000644650930	462024460	/nfs/dbraw/zinc/02/44/60/462024460.db2.gz	XPELYQYDCQGLDZ-LJQANCHMSA-N	0	3	342.483	3.092	20	30		EGEDHN
C=CCOc1cccc(CNCC2(S(C)(=O)=O)CCCCC2)c1	ZINC000657654298	462217643	/nfs/dbraw/zinc/21/76/43/462217643.db2.gz	XZTWNMYGZJVWJL-UHFFFAOYSA-N	0	3	337.485	3.089	20	30		EGEDHN
C=CC[C@@H]1CCCN(CC(=O)N2CCc3[nH]c4ccccc4c3C2)C1	ZINC000661381425	462225974	/nfs/dbraw/zinc/22/59/74/462225974.db2.gz	KMKABZYPMQDZAJ-MRXNPFEDSA-N	0	3	337.467	3.341	20	30		EGEDHN
C=CCNC(=O)CN[C@@H](C)Cc1ccc(Cl)c(C(F)(F)F)c1	ZINC000657952333	462328416	/nfs/dbraw/zinc/32/84/16/462328416.db2.gz	FQAJTQLUHBAQFT-JTQLQIEISA-N	0	3	334.769	3.182	20	30		EGEDHN
Cc1ccc(CN2CC[C@H](Nc3nc4c(cc3C#N)COCC4)C2)cc1	ZINC000601249327	468797287	/nfs/dbraw/zinc/79/72/87/468797287.db2.gz	AWBMNPKHXIQBKW-IBGZPJMESA-N	0	3	348.450	3.021	20	30		EGEDHN
Cc1cc(NC(=O)NC2CCN(Cc3ccccc3)CC2)ncc1C#N	ZINC000603121872	469272779	/nfs/dbraw/zinc/27/27/79/469272779.db2.gz	WMAARCKLFPGTGF-UHFFFAOYSA-N	0	3	349.438	3.048	20	30		EGEDHN
N#Cc1c2c(sc1NC(=O)CCN1CCCC3(CC3)C1)CCC2	ZINC000186961338	534766557	/nfs/dbraw/zinc/76/65/57/534766557.db2.gz	IJZTXDPAWJBQGB-UHFFFAOYSA-N	0	3	329.469	3.313	20	30		EGEDHN
C=C(C)COc1cc(CNC[C@@](C)(O)c2ccco2)ccc1OC	ZINC000174532085	526661582	/nfs/dbraw/zinc/66/15/82/526661582.db2.gz	JTJDATWUOBQHPK-LJQANCHMSA-N	0	3	331.412	3.240	20	30		EGEDHN
C=C(C)COc1cc(CNC[C@](C)(O)c2ccco2)ccc1OC	ZINC000174532072	526661948	/nfs/dbraw/zinc/66/19/48/526661948.db2.gz	JTJDATWUOBQHPK-IBGZPJMESA-N	0	3	331.412	3.240	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H](C)c2cc3ccccc3s2)CC1	ZINC000171722822	526928325	/nfs/dbraw/zinc/92/83/25/526928325.db2.gz	RIIICLACSJVNFZ-AWEZNQCLSA-N	0	3	326.465	3.424	20	30		EGEDHN
CC1(C)C[C@H](NCC(=O)Nc2cc(Cl)ccc2C#N)C(C)(C)O1	ZINC000132658642	527740699	/nfs/dbraw/zinc/74/06/99/527740699.db2.gz	URGXKNYFGSSGBI-AWEZNQCLSA-N	0	3	335.835	3.086	20	30		EGEDHN
CCN(CC)[C@@H](CNCc1ccc(OC)c(C#N)c1)c1ccco1	ZINC000174320937	528246952	/nfs/dbraw/zinc/24/69/52/528246952.db2.gz	ZZJFXZUNYHHSBS-KRWDZBQOSA-N	0	3	327.428	3.333	20	30		EGEDHN
CCOC(=O)CCCCN1CCC(Oc2cccc(C#N)c2)CC1	ZINC000132937600	528694271	/nfs/dbraw/zinc/69/42/71/528694271.db2.gz	AQWLXWNHPCWQBQ-UHFFFAOYSA-N	0	3	330.428	3.135	20	30		EGEDHN
COc1cc(C)c(CN(C)CCOc2ccc(C#N)cc2)cc1OC	ZINC000024799306	536568251	/nfs/dbraw/zinc/56/82/51/536568251.db2.gz	VCZIUNKRRAGDBM-UHFFFAOYSA-N	0	3	340.423	3.395	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN[C@@H]1CCCc2c(O)cccc21	ZINC000192367767	536883785	/nfs/dbraw/zinc/88/37/85/536883785.db2.gz	RVENDJRQCALHSN-QGZVFWFLSA-N	0	3	338.407	3.318	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2C[C@@H](C)C[C@H]2c2ccccc2)CC1	ZINC000287580773	547400291	/nfs/dbraw/zinc/40/02/91/547400291.db2.gz	XLPIDKVMSRDCSH-LPHOPBHVSA-N	0	3	327.472	3.430	20	30		EGEDHN
C[C@@H]1CCCN(C(C)(C)CNC(=O)[C@H]2CCC(=O)c3cccn32)C1	ZINC000329834202	547508854	/nfs/dbraw/zinc/50/88/54/547508854.db2.gz	GVLOPELPIJXEOP-GDBMZVCRSA-N	0	3	331.460	3.473	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@H](C)N1CC[C@H](N(C)Cc2ccccc2)C1	ZINC000674252208	548712735	/nfs/dbraw/zinc/71/27/35/548712735.db2.gz	XTKCQXJYSYRUNX-ICSRJNTNSA-N	0	3	343.515	3.006	20	30		EGEDHN
C=CCc1cc(CN2CCC[C@@H](n3ccnc3)C2)cc(OC)c1O	ZINC000678234297	549435513	/nfs/dbraw/zinc/43/55/13/549435513.db2.gz	DALKSCQQQMJFFB-QGZVFWFLSA-N	0	3	327.428	3.163	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN[C@H](CN1CCCCC1)c1ccccc1	ZINC000679939855	549793970	/nfs/dbraw/zinc/79/39/70/549793970.db2.gz	ZXHRSMOAGFBOMC-HXUWFJFHSA-N	0	3	343.515	3.228	20	30		EGEDHN
C=CCOc1ccccc1CN1CC[C@]2(C1)C(=O)Nc1ccccc12	ZINC000681752028	550032658	/nfs/dbraw/zinc/03/26/58/550032658.db2.gz	BOJDZKIWZOPQCD-OAQYLSRUSA-N	0	3	334.419	3.347	20	30		EGEDHN
C[C@H](CNC(=S)Nc1ccc(C#N)c(Cl)c1)N1CCCCC1	ZINC000726471268	574556008	/nfs/dbraw/zinc/55/60/08/574556008.db2.gz	JGZNGHZBSBGQND-GFCCVEGCSA-N	0	3	336.892	3.372	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)C(=O)NC1CCCCC1)c1ccccc1F	ZINC000726858727	574574298	/nfs/dbraw/zinc/57/42/98/574574298.db2.gz	UAFPKAJBNCHIHH-XJKSGUPXSA-N	0	3	330.403	3.477	20	30		EGEDHN
Cc1c(NN=Cc2ccc(OCCN(C)C)cc2)cccc1[N+](=O)[O-]	ZINC000727973694	574707281	/nfs/dbraw/zinc/70/72/81/574707281.db2.gz	XQHMOFSQRLPYMV-UHFFFAOYSA-N	0	3	342.399	3.290	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1scnc1Cl)C(C)C	ZINC000728083084	574716739	/nfs/dbraw/zinc/71/67/39/574716739.db2.gz	BFNQIXNMWMHSHV-GFCCVEGCSA-N	0	3	327.881	3.225	20	30		EGEDHN
CN(CC1CCN(C)CC1)C(=S)Nc1ccc(C#N)c(Cl)c1	ZINC000728792977	574772044	/nfs/dbraw/zinc/77/20/44/574772044.db2.gz	PCFKXXPFXRIBGE-UHFFFAOYSA-N	0	3	336.892	3.182	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)nc1	ZINC000728861458	574779763	/nfs/dbraw/zinc/77/97/63/574779763.db2.gz	KHMVKTBNSAEKOV-NRFANRHFSA-N	0	3	347.462	3.266	20	30		EGEDHN
C#Cc1ccc(C(=O)N(CC)[C@@H]2CCN([C@H](C)c3ccccc3)C2)cn1	ZINC000728861204	574779849	/nfs/dbraw/zinc/77/98/49/574779849.db2.gz	IONNYDCRAMEPFI-DYESRHJHSA-N	0	3	347.462	3.361	20	30		EGEDHN
C=CCN1CCC(NC(=S)Nc2ccc(OC(F)F)cc2)CC1	ZINC000729941694	574897792	/nfs/dbraw/zinc/89/77/92/574897792.db2.gz	AHYGBDSKAWPUEB-UHFFFAOYSA-N	0	3	341.427	3.225	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccccc2SCC#N)CC1	ZINC000729976056	574900406	/nfs/dbraw/zinc/90/04/06/574900406.db2.gz	VKRSYBRMETWGBC-UHFFFAOYSA-N	0	3	329.469	3.073	20	30		EGEDHN
C=CCc1cc(C(=O)NC[C@H]2CCCCN2CC)cc(OC)c1OC	ZINC000731873226	575214171	/nfs/dbraw/zinc/21/41/71/575214171.db2.gz	KUXBNWWIEZQWKO-QGZVFWFLSA-N	0	3	346.471	3.037	20	30		EGEDHN
C#CCOc1ccc(CNC[C@@H](NC(=O)OC(C)(C)C)C(C)C)cc1	ZINC000734512664	575504744	/nfs/dbraw/zinc/50/47/44/575504744.db2.gz	VRJOLFUVAVFKAY-GOSISDBHSA-N	0	3	346.471	3.338	20	30		EGEDHN
C=CC[C@H](NC(=O)NC[C@H](c1ccccc1)N(C)C)c1ccncc1	ZINC000734652858	575531833	/nfs/dbraw/zinc/53/18/33/575531833.db2.gz	UOHZNALVIVSNNS-RBUKOAKNSA-N	0	3	338.455	3.301	20	30		EGEDHN
C=CC[C@H](NC(=O)NC[C@H](C)N1CCC(C)CC1)c1ccncc1	ZINC000734666210	575534432	/nfs/dbraw/zinc/53/44/32/575534432.db2.gz	WCGJCRIAVWAODW-WMZOPIPTSA-N	0	3	330.476	3.118	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2cccc(Cl)c2Cl)CC1	ZINC000740735702	576621423	/nfs/dbraw/zinc/62/14/23/576621423.db2.gz	NDFOTYFLZQZCGT-UHFFFAOYSA-N	0	3	325.239	3.211	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2c(Cl)c3ccccc3n2C)CC1	ZINC000740738993	576622004	/nfs/dbraw/zinc/62/20/04/576622004.db2.gz	ROVVWGRAQHYPMO-UHFFFAOYSA-N	0	3	343.858	3.049	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN[C@@H](C)c2ccc3[nH]c(=O)[nH]c3c2)cc1	ZINC000740897825	576635012	/nfs/dbraw/zinc/63/50/12/576635012.db2.gz	GALFSIZMFNTMGX-STQMWFEESA-N	0	3	336.395	3.410	20	30		EGEDHN
C#CCOc1ccc(C(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1	ZINC000741662516	576709335	/nfs/dbraw/zinc/70/93/35/576709335.db2.gz	PCSGQTAYXTWSAV-OAQYLSRUSA-N	0	3	348.446	3.266	20	30		EGEDHN
C#CCOc1ccc(F)cc1NC(=O)NC[C@H](C)N1CCCC[C@@H]1C	ZINC000743201290	576803273	/nfs/dbraw/zinc/80/32/73/576803273.db2.gz	MPXUYGWMGKMXKK-GJZGRUSLSA-N	0	3	347.434	3.222	20	30		EGEDHN
C#CCCN1CCC(NC(=O)[C@@H](Cc2ccccc2)C(C)C)CC1	ZINC000743490725	576810302	/nfs/dbraw/zinc/81/03/02/576810302.db2.gz	VRVPKMGGHWJIGS-FQEVSTJZSA-N	0	3	326.484	3.105	20	30		EGEDHN
C=CCNC(=O)C(C#N)C(=O)C[C@@H](C)c1ccccc1C(F)(F)F	ZINC000744030856	576819215	/nfs/dbraw/zinc/81/92/15/576819215.db2.gz	NEFMSPMTFWVWJQ-YPMHNXCESA-N	0	3	338.329	3.210	20	30		EGEDHN
N#CC(C(=O)C[C@H](Cc1ccccc1)c1ccccc1)C(=O)NC1CC1	ZINC000744031471	576819248	/nfs/dbraw/zinc/81/92/48/576819248.db2.gz	XXNFJVGWEVOOTC-AZUAARDMSA-N	0	3	346.430	3.390	20	30		EGEDHN
C[C@@H](Oc1ccc(F)c(F)c1)C(=O)C(C#N)c1nc2ccccc2[nH]1	ZINC000744929827	576837149	/nfs/dbraw/zinc/83/71/49/576837149.db2.gz	OUUVNCUEVVUHLP-ZYHUDNBSSA-N	0	3	341.317	3.485	20	30		EGEDHN
C[C@@H]1CCCN(Cc2cc(=O)n3c4ccccc4[nH]c3c2C#N)CC1	ZINC000745170917	576842862	/nfs/dbraw/zinc/84/28/62/576842862.db2.gz	VAGPJTGWUKZCKH-GDBMZVCRSA-N	0	3	334.423	3.346	20	30		EGEDHN
C=CCCC[C@@H](C)[N@@H+]1CCCN(c2ccccc2-c2nnn[n-]2)CC1	ZINC000823894615	608383671	/nfs/dbraw/zinc/38/36/71/608383671.db2.gz	VCHVQDSQGPHCCQ-MRXNPFEDSA-N	0	3	340.475	3.124	20	30		EGEDHN
C=CCCC[C@@H](C)[N@H+]1CCCN(c2ccccc2-c2nnn[n-]2)CC1	ZINC000823894615	608383673	/nfs/dbraw/zinc/38/36/73/608383673.db2.gz	VCHVQDSQGPHCCQ-MRXNPFEDSA-N	0	3	340.475	3.124	20	30		EGEDHN
C=CCCC[C@@H](C)[N@@H+]1CCCN(c2ccccc2-c2nn[n-]n2)CC1	ZINC000823894615	608383674	/nfs/dbraw/zinc/38/36/74/608383674.db2.gz	VCHVQDSQGPHCCQ-MRXNPFEDSA-N	0	3	340.475	3.124	20	30		EGEDHN
C=CCCC[C@@H](C)[N@H+]1CCCN(c2ccccc2-c2nn[n-]n2)CC1	ZINC000823894615	608383677	/nfs/dbraw/zinc/38/36/77/608383677.db2.gz	VCHVQDSQGPHCCQ-MRXNPFEDSA-N	0	3	340.475	3.124	20	30		EGEDHN
C#C[C@](C)(CC)NC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C	ZINC000878010218	1299704008	/nfs/dbraw/zinc/70/40/08/1299704008.db2.gz	LBRNMQLXYMYFDI-HXUWFJFHSA-N	0	3	342.487	3.060	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)CCSc1ccc(F)cc1	ZINC000049231716	1291625317	/nfs/dbraw/zinc/62/53/17/1291625317.db2.gz	PFCFADVWMSXKOK-OAHLLOKOSA-N	0	3	336.432	3.323	20	30		EGEDHN
N#CC(C(=O)CCc1ccccc1Cl)C(=O)NC1CCCCC1	ZINC000050679089	1291654302	/nfs/dbraw/zinc/65/43/02/1291654302.db2.gz	CGKHPAHDHYPUNO-HNNXBMFYSA-N	0	3	332.831	3.430	20	30		EGEDHN
COCCN(CCCOc1ccc(C#N)cc1)Cc1ccc(C#N)cc1	ZINC000063753785	1292022967	/nfs/dbraw/zinc/02/29/67/1292022967.db2.gz	VFEKKZSQPOTWRZ-UHFFFAOYSA-N	0	3	349.434	3.347	20	30		EGEDHN
CN(CCC#N)c1ccc(CNCc2ccc3c(c2)OCCO3)cc1	ZINC000072670225	1292285567	/nfs/dbraw/zinc/28/55/67/1292285567.db2.gz	LRVRTOJGAISYMD-UHFFFAOYSA-N	0	3	337.423	3.097	20	30		EGEDHN
C[C@H](NC[C@H]1CN(C2CCCCC2)C(=O)O1)c1cccc(C#N)c1	ZINC000828155454	1292437113	/nfs/dbraw/zinc/43/71/13/1292437113.db2.gz	NIRXBPJCVPDFCI-KSSFIOAISA-N	0	3	327.428	3.362	20	30		EGEDHN
N#CCOc1ccc(Cl)cc1CN1CCC[C@@H]1[C@H]1CCC[C@@H]1O	ZINC000831154048	1292820434	/nfs/dbraw/zinc/82/04/34/1292820434.db2.gz	VESICWFOSNGTDX-ZACQAIPSSA-N	0	3	334.847	3.368	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)CO[C@@H]2CCC[C@H](C)C2)cc1	ZINC000112758956	1293132871	/nfs/dbraw/zinc/13/28/71/1293132871.db2.gz	QAVOMLDMLVKOCE-BMGDILEWSA-N	0	3	342.439	3.492	20	30		EGEDHN
N#CC(C(=O)CSC1CC1)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000835066532	1293198968	/nfs/dbraw/zinc/19/89/68/1293198968.db2.gz	XWQFABBKAROSBB-SNVBAGLBSA-N	0	3	326.780	3.022	20	30		EGEDHN
C#CCOc1ccccc1CNC[C@@H](O)c1ccc(OC(C)C)cc1	ZINC000116373527	1293205021	/nfs/dbraw/zinc/20/50/21/1293205021.db2.gz	VONVXCVSGQWDNW-HXUWFJFHSA-N	0	3	339.435	3.309	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)[C@@H](C)Cc1ccc(C(F)(F)F)cc1	ZINC000121771294	1293388729	/nfs/dbraw/zinc/38/87/29/1293388729.db2.gz	MJBMAOPWIPHVFL-SMDDNHRTSA-N	0	3	340.345	3.117	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)[C@@H]2CCCCO2)cc1	ZINC000121976007	1293398080	/nfs/dbraw/zinc/39/80/80/1293398080.db2.gz	JDGQECJMHKSRFS-SJORKVTESA-N	0	3	328.412	3.246	20	30		EGEDHN
CC(C)N1CCN(c2cccc(NC(=O)c3ccc(C#N)cc3)c2)CC1	ZINC000122331461	1293409350	/nfs/dbraw/zinc/40/93/50/1293409350.db2.gz	XYXRHIUSNLAIGT-UHFFFAOYSA-N	0	3	348.450	3.341	20	30		EGEDHN
Cc1cc2cc(C([O-])=C(C#N)C(=O)Nc3ccccn3)oc2cc1C	ZINC000123465827	1293444697	/nfs/dbraw/zinc/44/46/97/1293444697.db2.gz	DLSNJKFYBUOKJF-CQSZACIVSA-N	0	3	333.347	3.406	20	30		EGEDHN
Cc1cc2cc(C(=O)C(C#N)C(=O)Nc3ccccn3)oc2cc1C	ZINC000123465827	1293444701	/nfs/dbraw/zinc/44/47/01/1293444701.db2.gz	DLSNJKFYBUOKJF-CQSZACIVSA-N	0	3	333.347	3.406	20	30		EGEDHN
N#CC1(c2ccccc2)CC(NCCNC(=O)CC2CCCCC2)C1	ZINC000127913570	1293577719	/nfs/dbraw/zinc/57/77/19/1293577719.db2.gz	FUMCKBGWKSJSLH-UHFFFAOYSA-N	0	3	339.483	3.287	20	30		EGEDHN
C#CCOc1ccccc1CNCCc1nnc(-c2ccccc2)o1	ZINC000129459680	1293624852	/nfs/dbraw/zinc/62/48/52/1293624852.db2.gz	ALPLZMONXMOZGC-UHFFFAOYSA-N	0	3	333.391	3.081	20	30		EGEDHN
C[C@@H](Oc1ccc(F)c(F)c1)C(=O)C(C#N)C(=O)Nc1ccccc1	ZINC000129858806	1293637019	/nfs/dbraw/zinc/63/70/19/1293637019.db2.gz	WEBOTVMKJMFSID-RISCZKNCSA-N	0	3	344.317	3.080	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)CCCc2cccs2)cc1	ZINC000131665104	1293697240	/nfs/dbraw/zinc/69/72/40/1293697240.db2.gz	OYBMAVGOEIHVEK-MRXNPFEDSA-N	0	3	342.420	3.427	20	30		EGEDHN
COc1ccc(CN(C)CCOc2ccccc2OC)cc1C#N	ZINC000134998145	1293785938	/nfs/dbraw/zinc/78/59/38/1293785938.db2.gz	XOCIMYCGBARSGW-UHFFFAOYSA-N	0	3	326.396	3.086	20	30		EGEDHN
CC[C@H](C)OCC(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000152351153	1293965138	/nfs/dbraw/zinc/96/51/38/1293965138.db2.gz	RKLULJVBFVRTNC-GXSJLCMTSA-N	0	3	343.210	3.456	20	30		EGEDHN
CC[C@H](SC)C(=O)C(C#N)C(=O)Nc1ccc(OC)c(Cl)c1	ZINC000156513126	1294146934	/nfs/dbraw/zinc/14/69/34/1294146934.db2.gz	SBKSATGFKWGXGK-GWCFXTLKSA-N	0	3	340.832	3.138	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)CCC(F)(F)F	ZINC000173972926	1294475627	/nfs/dbraw/zinc/47/56/27/1294475627.db2.gz	DGEXKBZPFVMXDR-SNVBAGLBSA-N	0	3	328.290	3.075	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)C[C@H](C)c1ccc(OC)cc1	ZINC000175096197	1294538471	/nfs/dbraw/zinc/53/84/71/1294538471.db2.gz	BKIXOJUGAGYYRX-WMLDXEAASA-N	0	3	330.428	3.204	20	30		EGEDHN
COc1ccc([C@H](C/N=C/c2ccccc2O)N(C)C)cc1OC	ZINC000194860926	1296017574	/nfs/dbraw/zinc/01/75/74/1296017574.db2.gz	PDJQBQWEYKRTNA-DORSJAEJSA-N	0	3	328.412	3.131	20	30		EGEDHN
C#CCOc1ccccc1CN[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000236722123	1296199233	/nfs/dbraw/zinc/19/92/33/1296199233.db2.gz	MFWKGLBSFSGTNG-QGZVFWFLSA-N	0	3	344.455	3.188	20	30		EGEDHN
N#CC(C(=O)NC1CC1)C(=O)[C@H]1C[C@H]1c1cc(Cl)cc(Cl)c1	ZINC000246484398	1296355138	/nfs/dbraw/zinc/35/51/38/1296355138.db2.gz	CUBQFLDMAWAUPT-IHRRRGAJSA-N	0	3	337.206	3.084	20	30		EGEDHN
C#Cc1cccc(NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)c1	ZINC000248705425	1296425581	/nfs/dbraw/zinc/42/55/81/1296425581.db2.gz	ASNQIWSFOXJUHA-OXJNMPFZSA-N	0	3	333.435	3.310	20	30		EGEDHN
N#CCc1ccnc(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)c1	ZINC000871720639	1296500001	/nfs/dbraw/zinc/50/00/01/1296500001.db2.gz	KVVAZUZOBKMUKO-GOSISDBHSA-N	0	3	349.438	3.106	20	30		EGEDHN
COc1cccc([C@H](C/N=C\c2cccc(OC)c2O)N(C)C)c1	ZINC000255761712	1296566297	/nfs/dbraw/zinc/56/62/97/1296566297.db2.gz	RYJJDMYRBGVPMC-BRLDDBHUSA-N	0	3	328.412	3.131	20	30		EGEDHN
COc1ccc([C@@H](CO)N(C)Cc2ccc(O[C@H](C)C#N)cc2)cc1	ZINC000305720146	1297031540	/nfs/dbraw/zinc/03/15/40/1297031540.db2.gz	AILXZAUHNVGMOF-FOIQADDNSA-N	0	3	340.423	3.151	20	30		EGEDHN
CN1CCCC[C@H]1CNc1cc(Br)c(C#N)cc1F	ZINC000311507982	1297108354	/nfs/dbraw/zinc/10/83/54/1297108354.db2.gz	QUHUOLZPFKIPMH-NSHDSACASA-N	0	3	326.213	3.356	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H]1CNC1CC(C#N)(c2ccccc2)C1	ZINC000724970327	1298352150	/nfs/dbraw/zinc/35/21/50/1298352150.db2.gz	GXHWOBPBNYEAJO-GNZRSQJKSA-N	0	3	341.455	3.209	20	30		EGEDHN
CN(CC(=O)C(C#N)c1nc2ccccc2s1)Cc1nccs1	ZINC000746668695	1298638165	/nfs/dbraw/zinc/63/81/65/1298638165.db2.gz	AJQKBZOXBXOIEX-LLVKDONJSA-N	0	3	342.449	3.061	20	30		EGEDHN
Cc1ccc(SCC(=O)C(C#N)C(=O)Nc2ccccn2)c(C)c1	ZINC000747021627	1298710918	/nfs/dbraw/zinc/71/09/18/1298710918.db2.gz	WLGRQSMOJFSXMG-CQSZACIVSA-N	0	3	339.420	3.138	20	30		EGEDHN
CN(C)CCN(Cc1cccc(Cl)c1)C(=O)C#Cc1ccccc1	ZINC000747371233	1298769347	/nfs/dbraw/zinc/76/93/47/1298769347.db2.gz	XODXNNRHRBSJOJ-UHFFFAOYSA-N	0	3	340.854	3.282	20	30		EGEDHN
CN(Cc1cccc(C#N)n1)C1CCC(NC(=O)OC(C)(C)C)CC1	ZINC000876794812	1298993349	/nfs/dbraw/zinc/99/33/49/1298993349.db2.gz	GIRCFFZLZLBOTF-UHFFFAOYSA-N	0	3	344.459	3.221	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)s1)c1ccc(N2CCOCC2)cc1	ZINC000749110753	1299143665	/nfs/dbraw/zinc/14/36/65/1299143665.db2.gz	QGCYUVFOULOJGX-CQSZACIVSA-N	0	3	327.453	3.307	20	30		EGEDHN
CCN1CCN(c2ccc(Nc3ccc(Cl)c(C#N)n3)cc2)CC1	ZINC000749258276	1299180585	/nfs/dbraw/zinc/18/05/85/1299180585.db2.gz	OZCFTWQZGCMOPX-UHFFFAOYSA-N	0	3	341.846	3.492	20	30		EGEDHN
C#Cc1cccc(NC(=S)N(CCN(C)C)Cc2cccs2)c1	ZINC000752248928	1299714878	/nfs/dbraw/zinc/71/48/78/1299714878.db2.gz	UKJNJNUIMSXAAF-UHFFFAOYSA-N	0	3	343.521	3.490	20	30		EGEDHN
CC[C@@H](C)c1ccc(NC(=O)C(C#N)C(=O)C[C@H]2CCOC2)cc1	ZINC000753912946	1300037860	/nfs/dbraw/zinc/03/78/60/1300037860.db2.gz	IBJZRBKPTUQCTF-CPUCHLNUSA-N	0	3	328.412	3.274	20	30		EGEDHN
CCCN(CCN1CCCC1)CC[C@@](C#N)(C(C)=O)c1ccccc1	ZINC000878607781	1300104440	/nfs/dbraw/zinc/10/44/40/1300104440.db2.gz	YHFJVOWDMMMVAE-OAQYLSRUSA-N	0	3	341.499	3.235	20	30		EGEDHN
C[C@@H](NCC(=O)N[C@@](C)(C#N)C1CC1)c1csc2ccccc21	ZINC000754745878	1300207489	/nfs/dbraw/zinc/20/74/89/1300207489.db2.gz	YDXZTWYSYSPKHK-XIKOKIGWSA-N	0	3	327.453	3.360	20	30		EGEDHN
CCC(C)(C)N1CCN(CC[C@@](C#N)(C(C)=O)c2ccccc2)CC1	ZINC000878846431	1300223246	/nfs/dbraw/zinc/22/32/46/1300223246.db2.gz	VJKGJOOJDYCKEM-OAQYLSRUSA-N	0	3	341.499	3.233	20	30		EGEDHN
COc1ccc(CNC(=O)C(C#N)C(=O)[C@@H](C)CCC(C)(C)C)cc1	ZINC000755610467	1300366669	/nfs/dbraw/zinc/36/66/69/1300366669.db2.gz	OHBKCVCJFHINCV-WMLDXEAASA-N	0	3	344.455	3.483	20	30		EGEDHN
C#Cc1cccc(NC(=S)N(CCN(C)C)Cc2ccco2)c1	ZINC000755730356	1300387510	/nfs/dbraw/zinc/38/75/10/1300387510.db2.gz	DITRURGUDUBHSL-UHFFFAOYSA-N	0	3	327.453	3.022	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)cc1	ZINC000758200907	1300810528	/nfs/dbraw/zinc/81/05/28/1300810528.db2.gz	FXSAARNELMUZOZ-FXAWDEMLSA-N	0	3	348.446	3.091	20	30		EGEDHN
CCN(Cn1cccc(C#N)c1=O)[C@H](Cc1ccc(F)cc1)C(C)C	ZINC000758231469	1300824816	/nfs/dbraw/zinc/82/48/16/1300824816.db2.gz	MZFAMTJVHFWPLL-LJQANCHMSA-N	0	3	341.430	3.406	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cc(F)c(F)c(F)c2F)CC1	ZINC000880682839	1301219972	/nfs/dbraw/zinc/21/99/72/1301219972.db2.gz	SIWGZVRXRFTAMY-UHFFFAOYSA-N	0	3	345.340	3.405	20	30		EGEDHN
CN(C)C1(C(=O)NCc2cccc(-c3ccc(C#N)s3)c2)CCC1	ZINC000763050959	1301813869	/nfs/dbraw/zinc/81/38/69/1301813869.db2.gz	DBVCSDMMFDFYQC-UHFFFAOYSA-N	0	3	339.464	3.387	20	30		EGEDHN
Clc1cccc(N2CCCC2)c1C=NNCCN1CCCCC1	ZINC000763357205	1301884509	/nfs/dbraw/zinc/88/45/09/1301884509.db2.gz	ZHYIDXMRKZQVRS-UHFFFAOYSA-N	0	3	334.895	3.350	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2NCc1ccc(N2CCNC2=O)cc1	ZINC000883286406	1302363523	/nfs/dbraw/zinc/36/35/23/1302363523.db2.gz	RNFUJJHOCRICFK-HXUWFJFHSA-N	0	3	346.434	3.255	20	30		EGEDHN
O=[N+]([O-])c1cc(C=NOCCN2CCCCC2)ccc1N1CCCC1	ZINC000766685282	1302499775	/nfs/dbraw/zinc/49/97/75/1302499775.db2.gz	QQPIENSEZIPVSZ-UHFFFAOYSA-N	0	3	346.431	3.031	20	30		EGEDHN
CC(C)N(CC(=O)C(C#N)c1nc2ccccc2s1)CC(F)F	ZINC000767907511	1302782420	/nfs/dbraw/zinc/78/24/20/1302782420.db2.gz	VQSQLTJVFBIXJU-LLVKDONJSA-N	0	3	337.395	3.448	20	30		EGEDHN
C#CCOc1ccccc1CN[C@@H](C)CC(=O)Nc1cccc(F)c1	ZINC000772989029	1303603165	/nfs/dbraw/zinc/60/31/65/1303603165.db2.gz	WIVOTZXHIJHUQM-HNNXBMFYSA-N	0	3	340.398	3.345	20	30		EGEDHN
C[C@@H](N[C@@H](C)C(=O)Nc1ccccc1C#N)c1ccc(N(C)C)cc1	ZINC000774482860	1303814848	/nfs/dbraw/zinc/81/48/48/1303814848.db2.gz	IHHDNJZTXKHCIS-CABCVRRESA-N	0	3	336.439	3.302	20	30		EGEDHN
C=CCC[C@@H](NCC(=O)NCCC#N)c1ccc(C(F)(F)F)cc1	ZINC000775552096	1303983252	/nfs/dbraw/zinc/98/32/52/1303983252.db2.gz	DSIXRPNPJUNCLD-OAHLLOKOSA-N	0	3	339.361	3.332	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC(C)(C)c2ccc(F)cc2F)CC1	ZINC000888185431	1304062426	/nfs/dbraw/zinc/06/24/26/1304062426.db2.gz	KIKUEXMEAGRPOS-UHFFFAOYSA-N	0	3	337.414	3.150	20	30		EGEDHN
CN(C)c1ccncc1C=[NH+][N-]c1ccc(C#N)c(C(F)(F)F)c1	ZINC000776181706	1304107308	/nfs/dbraw/zinc/10/73/08/1304107308.db2.gz	ZFTXQSGPHHXFAV-UHFFFAOYSA-N	0	3	333.317	3.484	20	30		EGEDHN
C#CCSCC[NH2+][C@@H](C)c1cc(Br)cc(C)c1[O-]	ZINC000779031562	1304520480	/nfs/dbraw/zinc/52/04/80/1304520480.db2.gz	JUJMCUYVJKFJFN-NSHDSACASA-N	0	3	328.275	3.480	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CN1CCC[C@@H](c2n[nH]c(C)n2)C1	ZINC000779164894	1304536303	/nfs/dbraw/zinc/53/63/03/1304536303.db2.gz	VAQYPAPYYDNLPC-CQSZACIVSA-N	0	3	344.846	3.158	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CN1CCC[C@@H](c2nc(C)n[nH]2)C1	ZINC000779164894	1304536309	/nfs/dbraw/zinc/53/63/09/1304536309.db2.gz	VAQYPAPYYDNLPC-CQSZACIVSA-N	0	3	344.846	3.158	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CN1CCC[C@@H](c2nnc(C)[nH]2)C1	ZINC000779164894	1304536314	/nfs/dbraw/zinc/53/63/14/1304536314.db2.gz	VAQYPAPYYDNLPC-CQSZACIVSA-N	0	3	344.846	3.158	20	30		EGEDHN
C#CCCCCCC(=O)Nc1cccc(CN2CCC(O)CC2)c1	ZINC000780961472	1304756267	/nfs/dbraw/zinc/75/62/67/1304756267.db2.gz	XEXBUMAEGPELSD-UHFFFAOYSA-N	0	3	328.456	3.166	20	30		EGEDHN
C=CCCN(OCc1ccccc1)C(=O)N[C@H]1CN(C2CC2)C[C@H]1C	ZINC000782975556	1305033168	/nfs/dbraw/zinc/03/31/68/1305033168.db2.gz	CGSNFDVDYPBKNH-APWZRJJASA-N	0	3	343.471	3.189	20	30		EGEDHN
COc1cccc(CN2CCC(Nc3nccc(C)c3C#N)CC2)c1	ZINC000784152335	1305198097	/nfs/dbraw/zinc/19/80/97/1305198097.db2.gz	WPQHLMOOWZLQMV-UHFFFAOYSA-N	0	3	336.439	3.347	20	30		EGEDHN
CC(=O)N[C@H](CC1CCC1)C(=O)C(C#N)c1nc(C(C)C)cs1	ZINC000786444476	1305575965	/nfs/dbraw/zinc/57/59/65/1305575965.db2.gz	RNIZJXPLHRCKCA-UONOGXRCSA-N	0	3	333.457	3.138	20	30		EGEDHN
Cc1ccc([C@@H](C)C(=O)C(C#N)C(=O)NCc2cccc(Cl)c2)o1	ZINC000786530201	1305590216	/nfs/dbraw/zinc/59/02/16/1305590216.db2.gz	GDJWEYZUWZPVKI-IUODEOHRSA-N	0	3	344.798	3.370	20	30		EGEDHN
C[C@H](C(=O)C(C#N)C(=O)NCc1cccc(Cl)c1)c1ccco1	ZINC000786536445	1305592746	/nfs/dbraw/zinc/59/27/46/1305592746.db2.gz	BTDFFSARSPHFLV-FZMZJTMJSA-N	0	3	330.771	3.062	20	30		EGEDHN
Cc1cccc(CNC(=O)C(C#N)C(=O)Cc2cc3ccccc3o2)c1	ZINC000786550769	1305596964	/nfs/dbraw/zinc/59/69/64/1305596964.db2.gz	YPPABASYFSJOMK-GOSISDBHSA-N	0	3	346.386	3.309	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)[C@@H](C)OCC(C)C)c1ccccc1	ZINC000787048048	1305684530	/nfs/dbraw/zinc/68/45/30/1305684530.db2.gz	YTLXJGGEAYLXEW-OIISXLGYSA-N	0	3	330.428	3.024	20	30		EGEDHN
Cc1cccc(CC(=O)C(C#N)C(=O)NC2CCCCC2)c1Cl	ZINC000788081197	1305861205	/nfs/dbraw/zinc/86/12/05/1305861205.db2.gz	KSRWXAOJGFNWOZ-HNNXBMFYSA-N	0	3	332.831	3.349	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@H]1CCCCC[C@H]1NCc1ccc(C#N)cn1	ZINC000788259240	1305909757	/nfs/dbraw/zinc/90/97/57/1305909757.db2.gz	MBPPUWIIPCGJKR-IAGOWNOFSA-N	0	3	344.459	3.269	20	30		EGEDHN
C=C(C)[C@@H](NC(=O)N(C)[C@H]1CCCN(C)C1)c1ccc(F)c(F)c1	ZINC000894265937	1306309942	/nfs/dbraw/zinc/30/99/42/1306309942.db2.gz	XOFSFDYSZLJKHM-WMLDXEAASA-N	0	3	337.414	3.318	20	30		EGEDHN
CN1CCCC(C)(C)[C@H]1CNC(=O)c1ccccc1SCC#N	ZINC000791146003	1308927904	/nfs/dbraw/zinc/92/79/04/1308927904.db2.gz	CTKRUIUTFBASCT-MRXNPFEDSA-N	0	3	331.485	3.152	20	30		EGEDHN
CCn1cc([C@H](O)CN(CCC(C)(C)C#N)Cc2ccccc2)cn1	ZINC000792377298	1309167770	/nfs/dbraw/zinc/16/77/70/1309167770.db2.gz	UCBDGSBKJHGXEM-LJQANCHMSA-N	0	3	340.471	3.378	20	30		EGEDHN
C(=NN[C@H]1CCCOC1)c1ccc2c(c1)CCN2Cc1ccccc1	ZINC000794933140	1309624175	/nfs/dbraw/zinc/62/41/75/1309624175.db2.gz	OSZBEYWEYMCNIL-FQEVSTJZSA-N	0	3	335.451	3.352	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)COC2CCC(C)CC2)cc1	ZINC000796637147	1310051727	/nfs/dbraw/zinc/05/17/27/1310051727.db2.gz	UGOQBGPWZQFLRM-IUPXNIOVSA-N	0	3	342.439	3.492	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)[C@@H]1CCC(F)(F)C1	ZINC000796638027	1310052622	/nfs/dbraw/zinc/05/26/22/1310052622.db2.gz	YNCDTAGUUDCDNF-NEPJUHHUSA-N	0	3	336.338	3.168	20	30		EGEDHN
C#CCN(CCC(=O)Nc1ccc(N(C)C)cc1)Cc1ccccc1	ZINC000796642033	1310054310	/nfs/dbraw/zinc/05/43/10/1310054310.db2.gz	WCLKIRVFNACBMR-UHFFFAOYSA-N	0	3	335.451	3.217	20	30		EGEDHN
N#CC(C(=O)CCc1cnccn1)c1nc2ccccc2n1C(F)F	ZINC000796649459	1310056953	/nfs/dbraw/zinc/05/69/53/1310056953.db2.gz	HWGNPPJYJLWSRY-LBPRGKRZSA-N	0	3	341.321	3.030	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)Cc1c(C)nn(C(C)C)c1C	ZINC000796741788	1310076992	/nfs/dbraw/zinc/07/69/92/1310076992.db2.gz	SZAQETAAUVPGQG-KRWDZBQOSA-N	0	3	346.475	3.029	20	30		EGEDHN
C[C@H](Cn1ccc2ccccc21)C(=O)C(C#N)C(=O)NC1CCCC1	ZINC000796805463	1310090344	/nfs/dbraw/zinc/09/03/44/1310090344.db2.gz	ZNMTYGWEBLUHSE-RHSMWYFYSA-N	0	3	337.423	3.045	20	30		EGEDHN
N#CC(C(=O)NCc1cccc(Cl)c1)C(=O)[C@@H]1CCC(F)(F)C1	ZINC000796883831	1310105368	/nfs/dbraw/zinc/10/53/68/1310105368.db2.gz	FXJMRIHDJLCXRO-YPMHNXCESA-N	0	3	340.757	3.100	20	30		EGEDHN
C[C@H](NC(=O)C(C)(C)C)C(=O)C(C#N)c1ncc(C(C)(C)C)s1	ZINC000797571483	1310213711	/nfs/dbraw/zinc/21/37/11/1310213711.db2.gz	RZLGPEWVIXJUHT-WDEREUQCSA-N	0	3	335.473	3.168	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](CN(C)Cc3cccnc3)C2)CC1	ZINC000897480437	1310348044	/nfs/dbraw/zinc/34/80/44/1310348044.db2.gz	AAOQEUYTZRJBGO-GOSISDBHSA-N	0	3	327.472	3.108	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N(C)Cc1ccccc1-c1ccccc1	ZINC000836488331	1320494117	/nfs/dbraw/zinc/49/41/17/1320494117.db2.gz	OBIOQSOLDCJGBN-UHFFFAOYSA-N	0	3	349.478	3.450	20	30		EGEDHN
COc1ccc(CNC(=O)C(C#N)C(=O)CCCCC(C)C)cc1	ZINC000838785612	1320816251	/nfs/dbraw/zinc/81/62/51/1320816251.db2.gz	AYJIWOPOTDIQOX-KRWDZBQOSA-N	0	3	330.428	3.237	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1CC[C@H](NCc2ccsc2)C1	ZINC001019054895	1317028518	/nfs/dbraw/zinc/02/85/18/1317028518.db2.gz	HSOMHOLCLQAZAL-INIZCTEOSA-N	0	3	342.464	3.317	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H](NCc2ccc(OC)c(F)c2)C1	ZINC001019331742	1317172881	/nfs/dbraw/zinc/17/28/81/1317172881.db2.gz	CKDCEONJQCMESP-KXBFYZLASA-N	0	3	334.435	3.127	20	30		EGEDHN
CCCN(CCN1CCCCC1)C(=O)Cc1ccccc1CC#N	ZINC000804566934	1317261645	/nfs/dbraw/zinc/26/16/45/1317261645.db2.gz	IFUVQSOVMTUPNE-UHFFFAOYSA-N	0	3	327.472	3.020	20	30		EGEDHN
C=CCNc1ncc(C(=O)Nc2cc(CN(C)C)ccc2C)s1	ZINC000900956362	1317364499	/nfs/dbraw/zinc/36/44/99/1317364499.db2.gz	VSLFGSPMHQVRSQ-UHFFFAOYSA-N	0	3	330.457	3.363	20	30		EGEDHN
C#CCN(Cc1ccccc1)C(=O)NC[C@H](C)N(C)Cc1ccccc1	ZINC000806782861	1317524069	/nfs/dbraw/zinc/52/40/69/1317524069.db2.gz	YRPQXRONAIJWCW-IBGZPJMESA-N	0	3	349.478	3.352	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C(C)=C2CCCC2)C1	ZINC001020064471	1317528470	/nfs/dbraw/zinc/52/84/70/1317528470.db2.gz	UCYYOZYHIKFKGX-HDJSIYSDSA-N	0	3	327.266	3.022	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC(CN(CC)Cc2cncn2C)CC1	ZINC000957737513	1317601738	/nfs/dbraw/zinc/60/17/38/1317601738.db2.gz	LIPQTVQQVLMORM-UHFFFAOYSA-N	0	3	346.519	3.083	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C(C)(C)C2CCCC2)C1	ZINC001020246330	1317607923	/nfs/dbraw/zinc/60/79/23/1317607923.db2.gz	WDQJWBWJOSLEMX-HDJSIYSDSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)Cc2ccc(C)c(Cl)c2)C1	ZINC001020285127	1317625624	/nfs/dbraw/zinc/62/56/24/1317625624.db2.gz	PKELOJFEEAFISD-HDJSIYSDSA-N	0	3	327.255	3.180	20	30		EGEDHN
CC[C@H](N[C@@H]1CCCN(CC(F)(F)F)C1=O)c1cccc(C#N)c1	ZINC000902882160	1317627002	/nfs/dbraw/zinc/62/70/02/1317627002.db2.gz	PGRJPDRZVMKRQP-LSDHHAIUSA-N	0	3	339.361	3.152	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2scnc2C2CCCC2)C1	ZINC001020359273	1317659889	/nfs/dbraw/zinc/65/98/89/1317659889.db2.gz	PZZUQZGEUJHJON-JOCQHMNTSA-N	0	3	339.892	3.404	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@H](NC(=O)[C@]34C[C@H]3CCCC4)C2)c1	ZINC001020566272	1317777852	/nfs/dbraw/zinc/77/78/52/1317777852.db2.gz	KWIJAWPBEPJTHB-WOCWXWTJSA-N	0	3	341.430	3.014	20	30		EGEDHN
CCOc1cc(/C=C2/C(=O)c3ncnn3C2C)cc(Cl)c1OC	ZINC000905081471	1317921667	/nfs/dbraw/zinc/92/16/67/1317921667.db2.gz	QVEARNUNEXKZFM-JTTRITNRSA-N	0	3	333.775	3.180	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2c[nH]nc2C2CCCCC2)C1	ZINC001020907072	1317991844	/nfs/dbraw/zinc/99/18/44/1317991844.db2.gz	RVJOIRFIGHBOKX-HDJSIYSDSA-N	0	3	336.867	3.060	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(F)c(Cl)c1)C(=O)[C@H]1CCCSC1	ZINC000810531206	1318017947	/nfs/dbraw/zinc/01/79/47/1318017947.db2.gz	KDFAQAJPKHGKPM-GXSJLCMTSA-N	0	3	340.807	3.270	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)c2cccc(Cl)c2)C1	ZINC001020965988	1318019435	/nfs/dbraw/zinc/01/94/35/1318019435.db2.gz	DVLAGSVYJCXCGO-JOCQHMNTSA-N	0	3	343.652	3.099	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)c2ccccc2)s1	ZINC000959860937	1318233710	/nfs/dbraw/zinc/23/37/10/1318233710.db2.gz	VOYAHFSHINRXLU-INIZCTEOSA-N	0	3	339.464	3.404	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@@H](CCCN3C(=O)c3ccco3)C2)cc1	ZINC001021492975	1318292929	/nfs/dbraw/zinc/29/29/29/1318292929.db2.gz	OCZOHHBPSPHRDA-OALUTQOASA-N	0	3	349.434	3.278	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@H](CCCN3C(=O)C3CCC3)C2)cc1	ZINC001021494050	1318296021	/nfs/dbraw/zinc/29/60/21/1318296021.db2.gz	YGMZTJQMVDJYKU-UXHICEINSA-N	0	3	337.467	3.171	20	30		EGEDHN
CCCC(=O)N1CCC[C@@H]2CN(Cc3ccc(C#N)cc3)CC[C@H]21	ZINC001021500542	1318311429	/nfs/dbraw/zinc/31/14/29/1318311429.db2.gz	YNYUGPGEQNCPJZ-RTBURBONSA-N	0	3	325.456	3.171	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@H](CCCN3C(=O)c3ccoc3)C2)cc1	ZINC001021520373	1318348917	/nfs/dbraw/zinc/34/89/17/1318348917.db2.gz	WIVQKYQKMRKWAD-UYAOXDASSA-N	0	3	349.434	3.278	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc2ccncc2s1	ZINC000960271176	1318437348	/nfs/dbraw/zinc/43/73/48/1318437348.db2.gz	MQDMWYPMVXVNRW-VQIMIIECSA-N	0	3	349.459	3.468	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccnn1C(C)C	ZINC000960270773	1318437852	/nfs/dbraw/zinc/43/78/52/1318437852.db2.gz	HFTDYYCEJLAWSB-IEBWSBKVSA-N	0	3	338.455	3.026	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1oc(C(C)C)nc1C	ZINC000960313254	1318455463	/nfs/dbraw/zinc/45/54/63/1318455463.db2.gz	KOZPJMUMGYWZSY-IAGOWNOFSA-N	0	3	339.439	3.278	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2ccccc2CC)C1	ZINC001021612593	1318460339	/nfs/dbraw/zinc/46/03/39/1318460339.db2.gz	CQAXHFFGARHQQD-LEWJYISDSA-N	0	3	338.495	3.128	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)Cc1ccc(F)cc1	ZINC000960330560	1318464662	/nfs/dbraw/zinc/46/46/62/1318464662.db2.gz	LIZSKOMUXMJMQQ-TZIWHRDSSA-N	0	3	338.426	3.316	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@@H](C)c1cccc(F)c1	ZINC000960330922	1318464930	/nfs/dbraw/zinc/46/49/30/1318464930.db2.gz	WJABEFBTNLTEJN-VHKYSDTDSA-N	0	3	338.426	3.487	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(C)cc(Cl)c2)C1	ZINC001021631882	1318485859	/nfs/dbraw/zinc/48/58/59/1318485859.db2.gz	BYSSAFJBFFGYBR-QAPCUYQASA-N	0	3	330.859	3.208	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)/C=C/c1ccco1	ZINC000960370389	1318492448	/nfs/dbraw/zinc/49/24/48/1318492448.db2.gz	BOPYZXAENBBBKR-JBVUFVISSA-N	0	3	349.434	3.287	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc3c(ccc(C)c3C)[nH]2)C1	ZINC001021651757	1318512579	/nfs/dbraw/zinc/51/25/79/1318512579.db2.gz	FOGXHENDPNDKPF-DYESRHJHSA-N	0	3	349.478	3.344	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(F)c(Cl)c2)C1	ZINC001021658622	1318521156	/nfs/dbraw/zinc/52/11/56/1318521156.db2.gz	OLULOYLPFAVIDG-RHSMWYFYSA-N	0	3	334.822	3.039	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccoc2C2CC2)C1	ZINC001021659835	1318522113	/nfs/dbraw/zinc/52/21/13/1318522113.db2.gz	VTRWMZUEWMPXOC-WMZOPIPTSA-N	0	3	326.440	3.107	20	30		EGEDHN
Cc1occc1C(=O)N1CCC[C@H]1CN(C)Cc1ccc(C#N)cc1	ZINC000960398936	1318525794	/nfs/dbraw/zinc/52/57/94/1318525794.db2.gz	MTPRJQDTMOMJSW-SFHVURJKSA-N	0	3	337.423	3.196	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(Cl)cs2)C1	ZINC001021677514	1318546362	/nfs/dbraw/zinc/54/63/62/1318546362.db2.gz	QPKFBGFTXBDDGJ-DZGCQCFKSA-N	0	3	336.888	3.351	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2oc(C(C)C)nc2C)C1	ZINC001021686992	1318560518	/nfs/dbraw/zinc/56/05/18/1318560518.db2.gz	DNBZBDBBDSVJCN-IRXDYDNUSA-N	0	3	343.471	3.056	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(C3CC3)s2)C1	ZINC001021712934	1318590071	/nfs/dbraw/zinc/59/00/71/1318590071.db2.gz	BRNXKOMQRAWPHH-HZPDHXFCSA-N	0	3	328.481	3.185	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(C3CC3)s2)C1	ZINC001021712932	1318590534	/nfs/dbraw/zinc/59/05/34/1318590534.db2.gz	BRNXKOMQRAWPHH-HOTGVXAUSA-N	0	3	328.481	3.185	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc3ccccc3n2)C1	ZINC001021720097	1318604367	/nfs/dbraw/zinc/60/43/67/1318604367.db2.gz	VMGCCWINQRCQIG-RXVVDRJESA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(C)nc3ccccc32)C1	ZINC001021724831	1318616443	/nfs/dbraw/zinc/61/64/43/1318616443.db2.gz	ONVJHIBFQMRLOC-LAUBAEHRSA-N	0	3	347.462	3.103	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc3c(c2)CCCC3)C1	ZINC001021726895	1318621668	/nfs/dbraw/zinc/62/16/68/1318621668.db2.gz	HNLXAGMAKFZVCN-RTWAWAEBSA-N	0	3	336.479	3.125	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc3ccccc3o2)C1	ZINC001021726665	1318621730	/nfs/dbraw/zinc/62/17/30/1318621730.db2.gz	FFBZKPBVBAPFKO-QZTJIDSGSA-N	0	3	336.435	3.383	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2c[nH]c3ccc(C)cc32)C1	ZINC001021740968	1318650359	/nfs/dbraw/zinc/65/03/59/1318650359.db2.gz	XTNIJJBWOFPWFQ-JXFKEZNVSA-N	0	3	335.451	3.036	20	30		EGEDHN
CC1CC(C(=O)N2CCC[C@H]2CN(C)Cc2cccc(C#N)c2)C1	ZINC000960533756	1318652515	/nfs/dbraw/zinc/65/25/15/1318652515.db2.gz	IRUBJSKKIGJHEN-PPSBMQLTSA-N	0	3	325.456	3.027	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)C1C=CC=CC=C1	ZINC000960663290	1318781769	/nfs/dbraw/zinc/78/17/69/1318781769.db2.gz	MPCHOYHEOHPEOS-NRFANRHFSA-N	0	3	347.462	3.279	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)C1(C2CC2)CC1	ZINC000960698028	1318799067	/nfs/dbraw/zinc/79/90/67/1318799067.db2.gz	DBJFCJCJDHYGKN-IBGZPJMESA-N	0	3	337.467	3.171	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)Nc1cccc(NC(=O)NC)c1	ZINC000912208543	1318848692	/nfs/dbraw/zinc/84/86/92/1318848692.db2.gz	RHUUMQHBXXWCDN-INIZCTEOSA-N	0	3	334.464	3.454	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@@H]2CCCC[C@H]2C(F)(F)F)C1	ZINC001022228975	1318850864	/nfs/dbraw/zinc/85/08/64/1318850864.db2.gz	SCBOLYGCNSBUBA-YVECIDJPSA-N	0	3	338.801	3.344	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N[C@H](C)c1ccc(OC(C)C)c(OC)c1	ZINC000912391135	1318880740	/nfs/dbraw/zinc/88/07/40/1318880740.db2.gz	PJAPLWLZVJDVHC-GDBMZVCRSA-N	0	3	334.460	3.343	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@H](C)c2c(F)cccc2F)C1	ZINC001022434934	1318939872	/nfs/dbraw/zinc/93/98/72/1318939872.db2.gz	OKRMSEZUODIJPI-UTUOFQBUSA-N	0	3	328.790	3.058	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H]1CN(C)Cc1ccc(CO)cc1	ZINC000960828129	1318954907	/nfs/dbraw/zinc/95/49/07/1318954907.db2.gz	RMSNYEQGZNNKEE-TZIWHRDSSA-N	0	3	344.499	3.204	20	30		EGEDHN
C[C@H]1CC[C@@H](CC(=O)N[C@H]2C[C@@H](NCc3ccc(C#N)cc3F)C2)C1	ZINC001022563365	1318992814	/nfs/dbraw/zinc/99/28/14/1318992814.db2.gz	GPVYUBJLVVSNSR-IHETXDGRSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)c2occc2C(C)C)C1	ZINC001022592092	1319007019	/nfs/dbraw/zinc/00/70/19/1319007019.db2.gz	RWVJRSKJFKHPMU-TXEJJXNPSA-N	0	3	341.249	3.162	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@H]1CN(C)Cc1ccc(C#N)cc1	ZINC000960887127	1319025822	/nfs/dbraw/zinc/02/58/22/1319025822.db2.gz	SADGHVMSJPGKME-CEXWTWQISA-N	0	3	325.456	3.027	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc(F)c(Cl)cc2F)C1	ZINC001022629370	1319028330	/nfs/dbraw/zinc/02/83/30/1319028330.db2.gz	BEWBUQBAMFCFLJ-DTORHVGOSA-N	0	3	335.181	3.221	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N[C@H]1C[C@@H](N[C@@H](C)c2ccccc2F)C1	ZINC001022840869	1319133670	/nfs/dbraw/zinc/13/36/70/1319133670.db2.gz	PWRRLKMLQZWJHM-MBZOWXSBSA-N	0	3	346.446	3.105	20	30		EGEDHN
C[C@H](CC(=O)N1CCC[C@@H]1CN(C)Cc1ccc(C#N)cc1)C1CC1	ZINC000961042093	1319165852	/nfs/dbraw/zinc/16/58/52/1319165852.db2.gz	XQBVJJYDZHIHJY-OXQOHEQNSA-N	0	3	339.483	3.417	20	30		EGEDHN
C[C@H](C(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1)C1CCCC1	ZINC001022958249	1319186785	/nfs/dbraw/zinc/18/67/85/1319186785.db2.gz	HCUXSKFIDPTKBH-DOPJRALCSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc(F)c(F)cc2Cl)C1	ZINC001023049086	1319237146	/nfs/dbraw/zinc/23/71/46/1319237146.db2.gz	CKQHTWOFIWKXEG-DTORHVGOSA-N	0	3	335.181	3.221	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2sc(CCC)nc2C)C1	ZINC001023086572	1319256936	/nfs/dbraw/zinc/25/69/36/1319256936.db2.gz	PVSNJVYKFBYIHN-TXEJJXNPSA-N	0	3	327.881	3.007	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)c2cccc(C3CC3)c2)C1	ZINC001023138213	1319280117	/nfs/dbraw/zinc/28/01/17/1319280117.db2.gz	JYCCWWVUPTVIAQ-IYBDPMFKSA-N	0	3	349.272	3.323	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)C2(C)CCC(C)CC2)C1	ZINC001023145823	1319290315	/nfs/dbraw/zinc/29/03/15/1319290315.db2.gz	AGKHFXDHQHZBKJ-SQVIUHEXSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]([C@H]2CCN(Cc3ocnc3C)C2)C1	ZINC000961223227	1319349842	/nfs/dbraw/zinc/34/98/42/1319349842.db2.gz	AHPLVMKQAJRGAC-SJORKVTESA-N	0	3	345.487	3.256	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)[C@@H]2CCCC[C@@H]2C(F)(F)F)C1	ZINC001023444877	1319542384	/nfs/dbraw/zinc/54/23/84/1319542384.db2.gz	ZBUYDDJUXJDHHT-OAGGEKHMSA-N	0	3	344.421	3.207	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc(F)cc3ccoc32)C1	ZINC001023451035	1319555085	/nfs/dbraw/zinc/55/50/85/1319555085.db2.gz	CZQWHNRBGHFVJJ-CQSZACIVSA-N	0	3	328.387	3.037	20	30		EGEDHN
C=CCN1CCC[C@@H](CNC(=O)c2scnc2C2CCCC2)C1	ZINC001023470113	1319568793	/nfs/dbraw/zinc/56/87/93/1319568793.db2.gz	SULKDBUZPUYMIC-AWEZNQCLSA-N	0	3	333.501	3.429	20	30		EGEDHN
CC1(C)CC[C@@H]1C(=O)NC[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001023536110	1319642013	/nfs/dbraw/zinc/64/20/13/1319642013.db2.gz	QGYYJJXEPQXCID-RTBURBONSA-N	0	3	339.483	3.323	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)COc2ccc(F)cc2)cc1	ZINC000916909401	1319723682	/nfs/dbraw/zinc/72/36/82/1319723682.db2.gz	IUIXLGQFACVTPJ-KRWDZBQOSA-N	0	3	340.354	3.114	20	30		EGEDHN
C#CCN1CCC[C@@H](CNC(=O)[C@@H]2C[C@H]2c2cccc3ccccc32)C1	ZINC001023652923	1319772521	/nfs/dbraw/zinc/77/25/21/1319772521.db2.gz	RJKRIVJFYVPLJW-BULFRSBZSA-N	0	3	346.474	3.405	20	30		EGEDHN
C#CCN1CCC[C@H](CNC(=O)[C@@H]2C[C@H]2c2ccc3ccccc3c2)C1	ZINC001023655561	1319776747	/nfs/dbraw/zinc/77/67/47/1319776747.db2.gz	KKLMEZBALOSLGN-VOQZNFBZSA-N	0	3	346.474	3.405	20	30		EGEDHN
C=CCN1CCC[C@H](CNC(=O)c2ncc(Cl)cc2Cl)C1	ZINC001023671480	1319786338	/nfs/dbraw/zinc/78/63/38/1319786338.db2.gz	HCMYXCBCSQGYCI-LLVKDONJSA-N	0	3	328.243	3.016	20	30		EGEDHN
C#CCN1CCC[C@H](CNC(=O)c2cc3cc(C)ccc3s2)C1	ZINC001023677254	1319790167	/nfs/dbraw/zinc/79/01/67/1319790167.db2.gz	GRKMFDOMGFBJGM-OAHLLOKOSA-N	0	3	326.465	3.285	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2[nH]ccc2-c2ccccc2)C1	ZINC001023696641	1319822548	/nfs/dbraw/zinc/82/25/48/1319822548.db2.gz	RNNUILXMCZEEMX-KRWDZBQOSA-N	0	3	335.451	3.147	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2csc3c2CCCC3)C1	ZINC001023736615	1319878693	/nfs/dbraw/zinc/87/86/93/1319878693.db2.gz	GRYBBOBKHVPZQH-HNNXBMFYSA-N	0	3	330.497	3.092	20	30		EGEDHN
C=C1CCC(C(=O)NC2CC(CNCc3ccn(C(C)C)n3)C2)CC1	ZINC000962265419	1319889808	/nfs/dbraw/zinc/88/98/08/1319889808.db2.gz	PWYAFSIZXOTBKZ-UHFFFAOYSA-N	0	3	344.503	3.195	20	30		EGEDHN
C=CCN1CCC[C@H](CNC(=O)c2coc(C3CCCCC3)n2)C1	ZINC001023770057	1319919933	/nfs/dbraw/zinc/91/99/33/1319919933.db2.gz	OJPUZVMQINDVES-OAHLLOKOSA-N	0	3	331.460	3.350	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H]2[C@H]3CN(Cc4ccc(C#N)cc4)C[C@H]32)c(C)c1	ZINC000962447521	1319966013	/nfs/dbraw/zinc/96/60/13/1319966013.db2.gz	PSOYPNKYCZHCOA-AERCQKQUSA-N	0	3	345.446	3.035	20	30		EGEDHN
CN(C)CCN(Cc1cccc(F)c1)C(=O)c1cc(C#N)ccc1F	ZINC000824387085	1320253818	/nfs/dbraw/zinc/25/38/18/1320253818.db2.gz	RUZVSITTWZWSFQ-UHFFFAOYSA-N	0	3	343.377	3.040	20	30		EGEDHN
CCOc1ccc(C[C@@H](C)C(=O)C(C#N)C(=O)NC2CCCC2)cc1	ZINC000842291333	1321368240	/nfs/dbraw/zinc/36/82/40/1321368240.db2.gz	IMZWDNJFBCYKLW-RDTXWAMCSA-N	0	3	342.439	3.032	20	30		EGEDHN
C[C@@H](NC(=O)OC(C)(C)C)C(=O)C(C#N)c1nc(C2CC2)cs1	ZINC000842939123	1321451112	/nfs/dbraw/zinc/45/11/12/1321451112.db2.gz	ONSGKMYDMVURNR-KOLCDFICSA-N	0	3	335.429	3.110	20	30		EGEDHN
C#CC[C@@H](NC(=O)N1CCN(C(C)(C)CC)CC1)c1ccccc1	ZINC000847343027	1321864315	/nfs/dbraw/zinc/86/43/15/1321864315.db2.gz	QBYKXPGVRZVEQU-GOSISDBHSA-N	0	3	327.472	3.267	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/Cc2c(C3CC3)cnn2C)c([O-])c1	ZINC000849172735	1322093808	/nfs/dbraw/zinc/09/38/08/1322093808.db2.gz	YVFIXCRRWBBWFX-RGVLZGJSSA-N	0	3	326.444	3.468	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cccc(C#Cc3ccccc3)c2)CC1	ZINC000919964048	1322122044	/nfs/dbraw/zinc/12/20/44/1322122044.db2.gz	HOOWIMUPQHCAOF-UHFFFAOYSA-N	0	3	342.442	3.370	20	30		EGEDHN
CC[C@H](C)[C@@](C)(O)CNCc1cc(C#N)ccc1Br	ZINC000921732525	1322386305	/nfs/dbraw/zinc/38/63/05/1322386305.db2.gz	LCHHSYLOXUDJHV-NHYWBVRUSA-N	0	3	325.250	3.207	20	30		EGEDHN
Cc1cc(C(F)(F)F)nn1CCNCc1ccc(C#N)c(F)c1	ZINC000922432048	1322528024	/nfs/dbraw/zinc/52/80/24/1322528024.db2.gz	KQAWTSOOBFROHY-UHFFFAOYSA-N	0	3	326.297	3.011	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](CNCc2ccn(C(C)C)n2)C1	ZINC001024092880	1323124071	/nfs/dbraw/zinc/12/40/71/1323124071.db2.gz	KJSFGMYFUKYDGR-MRXNPFEDSA-N	0	3	332.492	3.004	20	30		EGEDHN
C=CCN1CCC(N[C@@H](c2ccccn2)c2ccccc2OC)CC1	ZINC000924984925	1323235764	/nfs/dbraw/zinc/23/57/64/1323235764.db2.gz	YPZKOEZTXMXBEB-OAQYLSRUSA-N	0	3	337.467	3.420	20	30		EGEDHN
C=C(C)C[N@@H+]1CCC[C@H]1[C@H]1CCCN(C(=O)c2ccccc2[O-])C1	ZINC000963248530	1323259639	/nfs/dbraw/zinc/25/96/39/1323259639.db2.gz	CJWMXCIMTODPRX-WMZOPIPTSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=C(C)C[N@H+]1CCC[C@H]1[C@H]1CCCN(C(=O)c2ccccc2[O-])C1	ZINC000963248530	1323259647	/nfs/dbraw/zinc/25/96/47/1323259647.db2.gz	CJWMXCIMTODPRX-WMZOPIPTSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cnn(CC(C)C)c1CC	ZINC001024434779	1323393703	/nfs/dbraw/zinc/39/37/03/1323393703.db2.gz	HVIOKQWYSQSWTE-KRWDZBQOSA-N	0	3	346.519	3.262	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccc(F)c(C(F)F)c1	ZINC001024441226	1323404936	/nfs/dbraw/zinc/40/49/36/1323404936.db2.gz	BDFAIAKBSNCBDV-CQSZACIVSA-N	0	3	338.373	3.371	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cccc(NC(=O)CC)c1	ZINC001024466656	1323421491	/nfs/dbraw/zinc/42/14/91/1323421491.db2.gz	JPCDICASVTWIHS-SFHVURJKSA-N	0	3	343.471	3.196	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@@H]1CCc2ccc(OC)cc21	ZINC001024484283	1323438072	/nfs/dbraw/zinc/43/80/72/1323438072.db2.gz	PCCKJWDOZQSOCN-IEBWSBKVSA-N	0	3	342.483	3.272	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1coc2cc(F)ccc12	ZINC001024517949	1323467666	/nfs/dbraw/zinc/46/76/66/1323467666.db2.gz	DLGVAJAQIROMMD-OAHLLOKOSA-N	0	3	328.387	3.180	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccc(C)c(OCC)c1	ZINC001024690737	1323605939	/nfs/dbraw/zinc/60/59/39/1323605939.db2.gz	INEOQBSAMGOMJJ-SFHVURJKSA-N	0	3	328.456	3.001	20	30		EGEDHN
C=CCCN1CCCC[C@H]1CNC(=O)c1cnc([C@H]2CCCO2)s1	ZINC001024695524	1323611893	/nfs/dbraw/zinc/61/18/93/1323611893.db2.gz	AIXIMSYJRXITTB-LSDHHAIUSA-N	0	3	349.500	3.155	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccc2nc(C)sc2c1	ZINC001024744777	1323642863	/nfs/dbraw/zinc/64/28/63/1323642863.db2.gz	FPPSVUUUAHJILE-MRXNPFEDSA-N	0	3	341.480	3.212	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cn(CCCC)nc1C	ZINC001024749833	1323652389	/nfs/dbraw/zinc/65/23/89/1323652389.db2.gz	HISJGJOAWHKEJL-QGZVFWFLSA-N	0	3	332.492	3.152	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cnn([C@@H](C)CC)c1C	ZINC001024750031	1323652586	/nfs/dbraw/zinc/65/25/86/1323652586.db2.gz	KIKRBYPREPOTCZ-DOTOQJQBSA-N	0	3	332.492	3.323	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1[nH]ccc1-c1ccccc1	ZINC001024754242	1323654096	/nfs/dbraw/zinc/65/40/96/1323654096.db2.gz	PWTIXYLYBKXGHU-GOSISDBHSA-N	0	3	335.451	3.289	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccc(COC)c(F)c1	ZINC001024775378	1323676547	/nfs/dbraw/zinc/67/65/47/1323676547.db2.gz	BBXAJOHZDWMEBZ-KRWDZBQOSA-N	0	3	334.435	3.133	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1csc2c1CC[C@H](C)C2	ZINC001024787182	1323692484	/nfs/dbraw/zinc/69/24/84/1323692484.db2.gz	ZAUFXSRXYYMYRX-JKSUJKDBSA-N	0	3	344.524	3.481	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@@H]1Cc2cc(C)c(C)cc2O1	ZINC001024809206	1323712629	/nfs/dbraw/zinc/71/26/29/1323712629.db2.gz	QYYAAIFEOXKFKA-QUCCMNQESA-N	0	3	342.483	3.154	20	30		EGEDHN
C=C(Cl)CN1CCCC[C@H]1CNC(=O)c1cccc(CN(C)C)c1	ZINC001024811564	1323713495	/nfs/dbraw/zinc/71/34/95/1323713495.db2.gz	UXVAVTQJSJFATO-SFHVURJKSA-N	0	3	349.906	3.085	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccccc1CC(C)C	ZINC001024816585	1323720265	/nfs/dbraw/zinc/72/02/65/1323720265.db2.gz	MPUBQKLZELMUHT-LJQANCHMSA-N	0	3	326.484	3.493	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)C2CC=CC2)cc1F	ZINC001024909760	1323775553	/nfs/dbraw/zinc/77/55/53/1323775553.db2.gz	ULSXEYQDOUKSAE-GOSISDBHSA-N	0	3	341.430	3.134	20	30		EGEDHN
CC1(CC(=O)N2CCCC[C@@H]2CNCc2ccc(C#N)c(F)c2)CC1	ZINC001025020830	1323829344	/nfs/dbraw/zinc/82/93/44/1323829344.db2.gz	BGCRPUAAVXVGEZ-QGZVFWFLSA-N	0	3	343.446	3.358	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)[C@]23C[C@H]2CCC3)s1	ZINC001025024514	1323831482	/nfs/dbraw/zinc/83/14/82/1323831482.db2.gz	NIHBGZCMYXQODJ-SPYBWZPUSA-N	0	3	343.496	3.281	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCCC[C@H]1CNCc1ncccc1C	ZINC001025070280	1323871956	/nfs/dbraw/zinc/87/19/56/1323871956.db2.gz	WYGYHCWQHIKGDW-PXNSSMCTSA-N	0	3	329.488	3.463	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(C)oc1C	ZINC001025202546	1323989177	/nfs/dbraw/zinc/98/91/77/1323989177.db2.gz	YZQANGGKPUGDII-OALUTQOASA-N	0	3	328.456	3.379	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1[nH]c(C)cc1C	ZINC001025244048	1324040534	/nfs/dbraw/zinc/04/05/34/1324040534.db2.gz	GKZGPTKXFDPAGT-QZTJIDSGSA-N	0	3	327.472	3.114	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1nc(C)sc1C	ZINC001025245050	1324042614	/nfs/dbraw/zinc/04/26/14/1324042614.db2.gz	ZEQYNOLTZMLEGP-IAGOWNOFSA-N	0	3	345.512	3.242	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)CCc1ccc(F)cc1	ZINC001025248361	1324048930	/nfs/dbraw/zinc/04/89/30/1324048930.db2.gz	YWKZDXCIHYGYFA-VQTJNVASSA-N	0	3	342.458	3.237	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)C1(C2CC2)CCC1	ZINC001025254155	1324060018	/nfs/dbraw/zinc/06/00/18/1324060018.db2.gz	DZTHJDKMHFENPP-RBUKOAKNSA-N	0	3	328.500	3.436	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)Cc1cc(C)cc(C)c1	ZINC001025261674	1324072153	/nfs/dbraw/zinc/07/21/53/1324072153.db2.gz	AYTAVEYSGJMZMB-NHCUHLMSSA-N	0	3	338.495	3.325	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc2[nH]ccc2c1	ZINC001025263808	1324074251	/nfs/dbraw/zinc/07/42/51/1324074251.db2.gz	RNBSTHUNLHNOIZ-WOJBJXKFSA-N	0	3	335.451	3.260	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cccc(OCC)c1	ZINC001025274395	1324091860	/nfs/dbraw/zinc/09/18/60/1324091860.db2.gz	XQFJNJHICMTKNL-VQTJNVASSA-N	0	3	340.467	3.178	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cncc(Cl)c1	ZINC001025276274	1324098655	/nfs/dbraw/zinc/09/86/55/1324098655.db2.gz	IMUKBBXAMSOHJP-SJORKVTESA-N	0	3	333.863	3.380	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1nc(CC)oc1C	ZINC001025278481	1324099364	/nfs/dbraw/zinc/09/93/64/1324099364.db2.gz	SWOOFSYLLGLSHF-DLBZAZTESA-N	0	3	343.471	3.028	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cccc(OC)c1F	ZINC001025283325	1324104647	/nfs/dbraw/zinc/10/46/47/1324104647.db2.gz	FPFLIDLENFDUPJ-DLBZAZTESA-N	0	3	346.446	3.479	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccccc1OC	ZINC001025291566	1324115817	/nfs/dbraw/zinc/11/58/17/1324115817.db2.gz	AXJHIYAFAFPOTF-MOPGFXCFSA-N	0	3	340.467	3.178	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)CCc1ccccc1	ZINC001025293474	1324120460	/nfs/dbraw/zinc/12/04/60/1324120460.db2.gz	RZJXZWQLYJSBCB-LEWJYISDSA-N	0	3	338.495	3.488	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1sc(C)nc1C	ZINC001025294402	1324123937	/nfs/dbraw/zinc/12/39/37/1324123937.db2.gz	AOLKCCBBPJNXSU-HZPDHXFCSA-N	0	3	333.501	3.405	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)CCc1ccccc1F	ZINC001025294472	1324124591	/nfs/dbraw/zinc/12/45/91/1324124591.db2.gz	KIYBROSOCOPWHQ-PMACEKPBSA-N	0	3	342.458	3.237	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)Cc1ccc(C)s1	ZINC001025301465	1324135240	/nfs/dbraw/zinc/13/52/40/1324135240.db2.gz	KEUMCQKAJATLAI-QZTJIDSGSA-N	0	3	330.497	3.078	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cccc2c1CCC2	ZINC001025301633	1324135356	/nfs/dbraw/zinc/13/53/56/1324135356.db2.gz	NJKKLEGLAUQLAK-NHCUHLMSSA-N	0	3	336.479	3.268	20	30		EGEDHN
C[C@@H](NC(=O)C1CCCC1)[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001025318520	1324154848	/nfs/dbraw/zinc/15/48/48/1324154848.db2.gz	BDZUOBCUHHEXQZ-UZLBHIALSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2sc(C3CC3)nc2C)C1	ZINC001025418922	1324250264	/nfs/dbraw/zinc/25/02/64/1324250264.db2.gz	GFRTZDHHTLVREP-CJNGLKHVSA-N	0	3	345.512	3.183	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2coc3ccc(CC)cc23)C1	ZINC001025418962	1324251808	/nfs/dbraw/zinc/25/18/08/1324251808.db2.gz	GWISYLHUTADWAE-WBVHZDCISA-N	0	3	338.451	3.459	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cccc(C(F)F)c2F)C1	ZINC001025424938	1324259969	/nfs/dbraw/zinc/25/99/69/1324259969.db2.gz	JXCJGCFOQVKEQO-STQMWFEESA-N	0	3	338.373	3.227	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc3ccccc3nc2C)C1	ZINC001025432211	1324270806	/nfs/dbraw/zinc/27/08/06/1324270806.db2.gz	GXJDJMZXMPCBKW-YJBOKZPZSA-N	0	3	335.451	3.007	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2oc3c(cccc3F)c2C)C1	ZINC001025441585	1324281065	/nfs/dbraw/zinc/28/10/65/1324281065.db2.gz	FUFTZGFWGCYHLB-LSDHHAIUSA-N	0	3	342.414	3.344	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(C3CC3)[nH]c2C2CC2)C1	ZINC001025456914	1324297615	/nfs/dbraw/zinc/29/76/15/1324297615.db2.gz	SWGBIWVNHAKHFW-RHSMWYFYSA-N	0	3	339.483	3.233	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cccc(-n3cccc3)c2)C1	ZINC001025475151	1324320610	/nfs/dbraw/zinc/32/06/10/1324320610.db2.gz	RSKOVZWTPMQHOF-UYAOXDASSA-N	0	3	349.478	3.331	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(-c3ccco3)o2)C1	ZINC001025481139	1324329481	/nfs/dbraw/zinc/32/94/81/1324329481.db2.gz	FHKXARXPDOSQMI-HOTGVXAUSA-N	0	3	340.423	3.393	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(C3CC3)oc2C2CC2)C1	ZINC001025484224	1324331749	/nfs/dbraw/zinc/33/17/49/1324331749.db2.gz	AVHVBEDZHYKIOB-RHSMWYFYSA-N	0	3	340.467	3.498	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(C3CC3)oc2C2CC2)C1	ZINC001025484223	1324331765	/nfs/dbraw/zinc/33/17/65/1324331765.db2.gz	AVHVBEDZHYKIOB-PBHICJAKSA-N	0	3	340.467	3.498	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc3c(o2)c(F)ccc3C)C1	ZINC001025487135	1324338262	/nfs/dbraw/zinc/33/82/62/1324338262.db2.gz	BATVRBMSTASSQN-GJZGRUSLSA-N	0	3	342.414	3.344	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(C)c3cccnc23)C1	ZINC001025489056	1324340465	/nfs/dbraw/zinc/34/04/65/1324340465.db2.gz	NSBULCMYBRAZET-DLBZAZTESA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(C)nc2C2CC2)C1	ZINC001025494609	1324346579	/nfs/dbraw/zinc/34/65/79/1324346579.db2.gz	ZBSQCJUGFHEUQG-FUHWJXTLSA-N	0	3	339.483	3.121	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccn(C(C)C)c2C)C1	ZINC001025519052	1324362630	/nfs/dbraw/zinc/36/26/30/1324362630.db2.gz	JLDLAYLQDMKIEE-FUHWJXTLSA-N	0	3	329.488	3.231	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc3ncccc3c2)C1	ZINC001025524523	1324369822	/nfs/dbraw/zinc/36/98/22/1324369822.db2.gz	UQGUWJJRSKWQIQ-APWZRJJASA-N	0	3	335.451	3.088	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2scnc2C(C)C)C1	ZINC001025555994	1324405294	/nfs/dbraw/zinc/40/52/94/1324405294.db2.gz	RMJQBTXCAQKHOL-HUUCEWRRSA-N	0	3	333.501	3.120	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2[nH]c3ccc(C)cc3c2C)C1	ZINC001025583451	1324424002	/nfs/dbraw/zinc/42/40/02/1324424002.db2.gz	ZNAQQZJLPJXNEM-DLBZAZTESA-N	0	3	337.467	3.248	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc3ccncc3c2)C1	ZINC001025586742	1324428271	/nfs/dbraw/zinc/42/82/71/1324428271.db2.gz	DMHXZUYXRVQMFF-LPHOPBHVSA-N	0	3	335.451	3.088	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CC[C@@H]2CN(C(=O)CCC3CC3)C[C@@H]12	ZINC001026222155	1324670643	/nfs/dbraw/zinc/67/06/43/1324670643.db2.gz	ZGVGCGKRCNRTIZ-VAMGGRTRSA-N	0	3	337.467	3.075	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H]3CC[C@H](NCc4csc(C)n4)[C@H]3C2)C1	ZINC001026353075	1324747524	/nfs/dbraw/zinc/74/75/24/1324747524.db2.gz	XSSJWEOCBUCQNS-XIRDDKMYSA-N	0	3	345.512	3.134	20	30		EGEDHN
Cc1ccoc1C(=O)NC1CCC(NCc2ccccc2C#N)CC1	ZINC001026453702	1324817792	/nfs/dbraw/zinc/81/77/92/1324817792.db2.gz	FWCZXVHZJUOXTF-UHFFFAOYSA-N	0	3	337.423	3.291	20	30		EGEDHN
N#Cc1ccccc1C[NH2+]C1CCC(NC(=O)c2ccccc2[O-])CC1	ZINC001026456687	1324819478	/nfs/dbraw/zinc/81/94/78/1324819478.db2.gz	VLYXUFNNWVBLMS-UHFFFAOYSA-N	0	3	349.434	3.095	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)c2cc(C)co2)CC1	ZINC001026545337	1324882874	/nfs/dbraw/zinc/88/28/74/1324882874.db2.gz	UFNJLHZARCTTKU-UHFFFAOYSA-N	0	3	341.249	3.127	20	30		EGEDHN
Cc1cc(C(=O)NC2CCC(NCc3ccccc3C#N)CC2)ccn1	ZINC001026578437	1324909103	/nfs/dbraw/zinc/90/91/03/1324909103.db2.gz	BIHVBYFLNHKWEV-UHFFFAOYSA-N	0	3	348.450	3.093	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)C2CC(F)(F)C2)C1	ZINC000963281251	1325060615	/nfs/dbraw/zinc/06/06/15/1325060615.db2.gz	HOAQJSWMZWMFRL-DZGCQCFKSA-N	0	3	346.849	3.487	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCN(C(=O)[C@H]2CCCC23CC3)C1	ZINC001026918049	1325080574	/nfs/dbraw/zinc/08/05/74/1325080574.db2.gz	MPRKZLVTLSSEQS-VQIMIIECSA-N	0	3	337.467	3.077	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@H](CNCc2cc(F)ccc2C#N)C1)C(C)(C)C	ZINC001026921255	1325083938	/nfs/dbraw/zinc/08/39/38/1325083938.db2.gz	PEOPTGRKEJQHRZ-HUUCEWRRSA-N	0	3	345.462	3.318	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](CNCc2cc(O)ccc2Cl)C1	ZINC001026992492	1325131149	/nfs/dbraw/zinc/13/11/49/1325131149.db2.gz	ODJLESGPVIAHSG-ZDUSSCGKSA-N	0	3	336.863	3.196	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)c2cccnc2C)C1	ZINC000963350082	1325142091	/nfs/dbraw/zinc/14/20/91/1325142091.db2.gz	YFBHNNNLKKGEJM-FUHWJXTLSA-N	0	3	347.890	3.459	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H](CNCc2nc(C)c(C)s2)C1	ZINC001027039074	1325173040	/nfs/dbraw/zinc/17/30/40/1325173040.db2.gz	VGBGZZBKXFFCRV-QAPCUYQASA-N	0	3	335.517	3.300	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H](CNCc2csc(CC)n2)C1	ZINC001027040367	1325174793	/nfs/dbraw/zinc/17/47/93/1325174793.db2.gz	AMJOGKBEVAAXGF-RDTXWAMCSA-N	0	3	335.517	3.246	20	30		EGEDHN
Cc1ccc2c(c1)[C@H]1CN(C)CC[C@H]1N2C(=O)c1cc(C#N)ccc1F	ZINC000854515511	1325271615	/nfs/dbraw/zinc/27/16/15/1325271615.db2.gz	XIAKDSVBCHCTNL-YLJYHZDGSA-N	0	3	349.409	3.454	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)/C=C/c2ccco2)C1	ZINC001027276322	1325389277	/nfs/dbraw/zinc/38/92/77/1325389277.db2.gz	HHPACHMUUWEZGO-JBVUFVISSA-N	0	3	349.434	3.287	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)C[C@@H]2C=CCC2)C1	ZINC001027290125	1325423252	/nfs/dbraw/zinc/42/32/52/1325423252.db2.gz	PISZZDSLWUEYQX-YLJYHZDGSA-N	0	3	337.467	3.337	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@H](N(C)Cc2ccc(F)c(Cl)c2)C1	ZINC001027335079	1325493639	/nfs/dbraw/zinc/49/36/39/1325493639.db2.gz	BNFXZWXTRHCVJB-OCCSQVGLSA-N	0	3	337.826	3.062	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)CC2CCC2)C1	ZINC001027348258	1325514393	/nfs/dbraw/zinc/51/43/93/1325514393.db2.gz	XJUZKYLDWOEKGV-LJQANCHMSA-N	0	3	325.456	3.171	20	30		EGEDHN
CC1CC(C(=O)N2CCC[C@H](N(C)Cc3ccc(C#N)c(F)c3)C2)C1	ZINC001027361347	1325545273	/nfs/dbraw/zinc/54/52/73/1325545273.db2.gz	GLBCNXQMLDQXBL-UYJHFMRCSA-N	0	3	343.446	3.166	20	30		EGEDHN
CC1CC(C(=O)N2CCC[C@@H](N(C)Cc3cccc(C#N)c3)C2)C1	ZINC001027361415	1325545845	/nfs/dbraw/zinc/54/58/45/1325545845.db2.gz	IIUPGSBRTBJMPM-XUJQIHCRSA-N	0	3	325.456	3.027	20	30		EGEDHN
Cc1cocc1C(=O)NC1CC2(CC(NCc3ccccc3C#N)C2)C1	ZINC000964609840	1325575406	/nfs/dbraw/zinc/57/54/06/1325575406.db2.gz	HCFXJZGQLYGPTP-UHFFFAOYSA-N	0	3	349.434	3.291	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)[C@@H]1C[C@H]1c1ccco1)c1ccccc1	ZINC000860693482	1329344914	/nfs/dbraw/zinc/34/49/14/1329344914.db2.gz	HGKLPHRIWBFAPF-VQHPVUNQSA-N	0	3	336.391	3.359	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)C2C=CC=CC=C2)C1	ZINC001027431062	1327669302	/nfs/dbraw/zinc/66/93/02/1327669302.db2.gz	GTDXIRHKOUXVQB-NRFANRHFSA-N	0	3	347.462	3.279	20	30		EGEDHN
CN(Cc1ccc(F)c(C#N)c1)[C@@H]1CCCN(C(=O)CC2(C)CC2)C1	ZINC001027496886	1327760461	/nfs/dbraw/zinc/76/04/61/1327760461.db2.gz	ZIIAAJRBZWXQHM-QGZVFWFLSA-N	0	3	343.446	3.310	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H](N(C)CCc2ccns2)C1	ZINC001027519462	1327790237	/nfs/dbraw/zinc/79/02/37/1327790237.db2.gz	NTQJNNPEQTZFAA-OAHLLOKOSA-N	0	3	335.517	3.211	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)C(C)(C)c2ccc(Cl)cc2)C1	ZINC001027558407	1327865706	/nfs/dbraw/zinc/86/57/06/1327865706.db2.gz	VSOJCJYEIFPVSU-KRWDZBQOSA-N	0	3	332.875	3.174	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@@H](N(C)Cc2cccc(C#N)c2)C1)C(C)(F)F	ZINC001027580522	1327916664	/nfs/dbraw/zinc/91/66/64/1327916664.db2.gz	XGTVRWZNGUXTAM-WMLDXEAASA-N	0	3	349.425	3.272	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2cc(C(F)F)ccc2F)C1	ZINC000966164532	1328211709	/nfs/dbraw/zinc/21/17/09/1328211709.db2.gz	CAEUXDIMBQQGEA-BLLLJJGKSA-N	0	3	338.373	3.227	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)C1CCc2ccccc2CC1	ZINC001027982396	1328455535	/nfs/dbraw/zinc/45/55/35/1328455535.db2.gz	VHJMWCOOFBGZGU-FQEVSTJZSA-N	0	3	326.484	3.338	20	30		EGEDHN
CC(C)(C)OC(=O)N1[C@H](CNCc2cccc(C#N)c2)COC1(C)C	ZINC000862268931	1329473104	/nfs/dbraw/zinc/47/31/04/1329473104.db2.gz	JIMDAUJHLNPEBD-MRXNPFEDSA-N	0	3	345.443	3.020	20	30		EGEDHN
COc1ccccc1NC(=O)[C@@H]1CCCN(Cc2ccc(C#N)cc2)C1	ZINC000932634961	1329829441	/nfs/dbraw/zinc/82/94/41/1329829441.db2.gz	DYZWCHRVGKUJEC-GOSISDBHSA-N	0	3	349.434	3.418	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N(C[C@@H](O)CC(C)(C)C)C1CCN(C)CC1	ZINC000935816747	1330087816	/nfs/dbraw/zinc/08/78/16/1330087816.db2.gz	GILQBUVYZGZSGX-WMZOPIPTSA-N	0	3	338.536	3.309	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1C[C@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001054699162	1349441822	/nfs/dbraw/zinc/44/18/22/1349441822.db2.gz	FEIQJBGULYZHFV-XJKSGUPXSA-N	0	3	333.501	3.238	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N[C@@H]1CCN(Cc2ccc(C#N)cc2)CC1(C)C	ZINC000940685964	1331157727	/nfs/dbraw/zinc/15/77/27/1331157727.db2.gz	JEKMDWQZUUHCNC-QZTJIDSGSA-N	0	3	339.483	3.321	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(F)cc3ccoc32)[C@@H](C)C1	ZINC000942199784	1331875658	/nfs/dbraw/zinc/87/56/58/1331875658.db2.gz	HMUXMXSKNGOJCX-SUMWQHHRSA-N	0	3	328.387	3.035	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc3c4c(cccc42)CC3)[C@@H](C)C1	ZINC000942393896	1331923592	/nfs/dbraw/zinc/92/35/92/1331923592.db2.gz	QGKYEOKKUVSASW-MGPUTAFESA-N	0	3	332.447	3.012	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(-c3ccco3)o2)[C@@H](C)C1	ZINC000942442949	1331935140	/nfs/dbraw/zinc/93/51/40/1331935140.db2.gz	BNSDFPGSIQHBJC-GJZGRUSLSA-N	0	3	326.396	3.003	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2c(C)occ2C(F)(F)F)[C@H](C)C1	ZINC000942518106	1331950398	/nfs/dbraw/zinc/95/03/98/1331950398.db2.gz	MEYCAFMJIKQNHH-MFKMUULPSA-N	0	3	330.350	3.233	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2sccc2-n2cccc2)[C@@H](C)C1	ZINC000942544755	1331967181	/nfs/dbraw/zinc/96/71/81/1331967181.db2.gz	DZTYQKOJZVJPGW-HOTGVXAUSA-N	0	3	341.480	3.002	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)oc2C(F)(F)F)[C@@H](C)C1	ZINC000943207287	1332120696	/nfs/dbraw/zinc/12/06/96/1332120696.db2.gz	FYUKXRHAEFNUMK-SMDDNHRTSA-N	0	3	342.361	3.070	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2cccc3sccc32)[C@H](C)C1	ZINC000943335155	1332152264	/nfs/dbraw/zinc/15/22/64/1332152264.db2.gz	QGVOIXNNXWBCKY-CRAIPNDOSA-N	0	3	340.492	3.294	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C(C)(C)C)cc2)[C@H](C)C1	ZINC000944306204	1332368611	/nfs/dbraw/zinc/36/86/11/1332368611.db2.gz	RBVVNSYHRICNSX-VQIMIIECSA-N	0	3	326.484	3.448	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3ccc(Cl)cc3)CC2)[C@H](C)C1	ZINC000944655459	1332421529	/nfs/dbraw/zinc/42/15/29/1332421529.db2.gz	QNPFTCYDAHQLNE-CRAIPNDOSA-N	0	3	344.886	3.222	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(OCC(C)C)cc2)[C@H](C)C1	ZINC000944652682	1332421703	/nfs/dbraw/zinc/42/17/03/1332421703.db2.gz	IYUQHWCEBLIGLD-XLIONFOSSA-N	0	3	342.483	3.185	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccccc2-c2ccccc2)[C@@H](C)C1	ZINC000944698356	1332422920	/nfs/dbraw/zinc/42/29/20/1332422920.db2.gz	FRKMMEBKNOMERQ-LAUBAEHRSA-N	0	3	332.447	3.427	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2oc3ccccc3c2CC)[C@@H](C)C1	ZINC000945365875	1332568281	/nfs/dbraw/zinc/56/82/81/1332568281.db2.gz	MGGGPXAZRCISFN-YJBOKZPZSA-N	0	3	338.451	3.459	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(-c3ccccc3)[nH]2)[C@@H](C)C1	ZINC000945806551	1332678328	/nfs/dbraw/zinc/67/83/28/1332678328.db2.gz	DZZJEANXKZTRCT-WMZOPIPTSA-N	0	3	335.451	3.145	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(-c3ccccc3)co2)[C@@H](C)C1	ZINC000946314186	1332786134	/nfs/dbraw/zinc/78/61/34/1332786134.db2.gz	SNSQORLCVKTSJQ-LPHOPBHVSA-N	0	3	336.435	3.410	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(-c3ccccc3)co2)[C@@H](C)C1	ZINC000946314188	1332786370	/nfs/dbraw/zinc/78/63/70/1332786370.db2.gz	SNSQORLCVKTSJQ-QFBILLFUSA-N	0	3	336.435	3.410	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3ccc(Cl)o3)CC[C@@H]2C1	ZINC000946480356	1332840416	/nfs/dbraw/zinc/84/04/16/1332840416.db2.gz	PZWCVJAERIAYFS-BETUJISGSA-N	0	3	343.254	3.470	20	30		EGEDHN
N#Cc1ccccc1CN1C[C@@H]2CCN(C(=O)/C=C\C3CC3)CC[C@@H]2C1	ZINC000946533778	1332848872	/nfs/dbraw/zinc/84/88/72/1332848872.db2.gz	TWNMZUXJXUYLLL-CDJQTCQQSA-N	0	3	349.478	3.195	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H]2CN(Cc3ccns3)C[C@H]2CC1	ZINC000946758391	1332892870	/nfs/dbraw/zinc/89/28/70/1332892870.db2.gz	JNULFFLBKLDRAR-JTDSTZFVSA-N	0	3	347.528	3.416	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)C2CCCC2)CCN1Cc1cccc(C#N)c1	ZINC000946976434	1332952021	/nfs/dbraw/zinc/95/20/21/1332952021.db2.gz	UYMRJVUEIWVPPU-DNVCBOLYSA-N	0	3	325.456	3.218	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)c2ccccc2)CCN1Cc1ccc(C#N)cc1	ZINC000947005194	1332966789	/nfs/dbraw/zinc/96/67/89/1332966789.db2.gz	LUQBMODWDYAUOW-OXJNMPFZSA-N	0	3	333.435	3.341	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@H](C)C2)cn1	ZINC000947053234	1332992130	/nfs/dbraw/zinc/99/21/30/1332992130.db2.gz	WSBIKWQQODCWNX-OXQOHEQNSA-N	0	3	348.450	3.045	20	30		EGEDHN
Cc1cc(CN2CC[C@H](NC(=O)c3cc(C#N)c[nH]3)C[C@H]2C)cs1	ZINC000947171608	1333035499	/nfs/dbraw/zinc/03/54/99/1333035499.db2.gz	YELSMRXQINIAIP-WBMJQRKESA-N	0	3	342.468	3.039	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2c[nH]c(C#N)c2)CCN1C/C=C\c1ccccc1	ZINC000947206009	1333052027	/nfs/dbraw/zinc/05/20/27/1333052027.db2.gz	ZQLCYRAEBMXNSF-BXOXOBTFSA-N	0	3	348.450	3.182	20	30		EGEDHN
Cc1cnccc1C(=O)N[C@H]1CCN(Cc2cccc(C#N)c2)[C@H](C)C1	ZINC000947280624	1333075857	/nfs/dbraw/zinc/07/58/57/1333075857.db2.gz	DKVDPNPOBPHHHR-APWZRJJASA-N	0	3	348.450	3.045	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)C2C=CC=CC=C2)CCN1Cc1ccc(C#N)cc1	ZINC000947362081	1333104003	/nfs/dbraw/zinc/10/40/03/1333104003.db2.gz	USYVIPKKQVNGBC-UWJYYQICSA-N	0	3	347.462	3.326	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)C2C=CC=CC=C2)CCN1Cc1ccc(C#N)cc1	ZINC000947362078	1333104279	/nfs/dbraw/zinc/10/42/79/1333104279.db2.gz	USYVIPKKQVNGBC-DYESRHJHSA-N	0	3	347.462	3.326	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3ccccc3nc2C)C[C@@H]1C	ZINC000947365059	1333104945	/nfs/dbraw/zinc/10/49/45/1333104945.db2.gz	HGYXYIYVFMUCLM-YJBOKZPZSA-N	0	3	335.451	3.149	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2CCc3ccccc3CC2)C[C@H]1C	ZINC000947474735	1333142556	/nfs/dbraw/zinc/14/25/56/1333142556.db2.gz	YLQOIECNFHSJIL-UTKZUKDTSA-N	0	3	338.495	3.174	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2sc(C)nc2CC(C)C)C[C@@H]1C	ZINC000947506607	1333149920	/nfs/dbraw/zinc/14/99/20/1333149920.db2.gz	SFMQTRDNPIKUAQ-DZGCQCFKSA-N	0	3	335.517	3.419	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(-n3cccc3)cc2)C[C@H]1C	ZINC000947512068	1333151272	/nfs/dbraw/zinc/15/12/72/1333151272.db2.gz	TUHOZXUJMGSRMR-MJGOQNOKSA-N	0	3	335.451	3.083	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cn(CC)c3ccccc23)C[C@@H]1C	ZINC000947523716	1333157353	/nfs/dbraw/zinc/15/73/53/1333157353.db2.gz	HSJCRFUMQFNARG-DLBZAZTESA-N	0	3	337.467	3.267	20	30		EGEDHN
Cc1cocc1C(=O)N[C@@H]1CCN(Cc2ccc(C#N)cc2)[C@@H](C)C1	ZINC000947625260	1333199106	/nfs/dbraw/zinc/19/91/06/1333199106.db2.gz	UKUHFBGXVJEDRI-MAUKXSAKSA-N	0	3	337.423	3.243	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2csc(-c3ccco3)n2)C[C@H]1C	ZINC000947661786	1333212790	/nfs/dbraw/zinc/21/27/90/1333212790.db2.gz	AIVHOVCQXRMTER-CHWSQXEVSA-N	0	3	331.441	3.172	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(F)c(Cl)cc2F)C[C@H]1C	ZINC000947676482	1333219569	/nfs/dbraw/zinc/21/95/69/1333219569.db2.gz	XIVLXJKWWCCJAS-NEPJUHHUSA-N	0	3	340.801	3.224	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2c(Cl)cncc2Cl)C[C@H]1C	ZINC000947689900	1333225004	/nfs/dbraw/zinc/22/50/04/1333225004.db2.gz	NMXVFCFTBGAJSP-GHMZBOCLSA-N	0	3	328.243	3.157	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc3nc(C)ccc3c2)C[C@@H]1C	ZINC000947845203	1333277129	/nfs/dbraw/zinc/27/71/29/1333277129.db2.gz	GOLPHQCIGKOKTI-QFBILLFUSA-N	0	3	335.451	3.149	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2[nH]c3ccc(C)cc3c2C)C[C@H]1C	ZINC000947878165	1333288458	/nfs/dbraw/zinc/28/84/58/1333288458.db2.gz	LPASXOMXSNXNPS-NVXWUHKLSA-N	0	3	337.467	3.391	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C(C)(C)c2ccc(CC)cc2)C[C@@H]1C	ZINC000947907274	1333301457	/nfs/dbraw/zinc/30/14/57/1333301457.db2.gz	FYZVWOGIBNYMHY-LPHOPBHVSA-N	0	3	326.484	3.129	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2c[nH]nc2C2CCCCC2)C[C@@H]1C	ZINC000947917533	1333306855	/nfs/dbraw/zinc/30/68/55/1333306855.db2.gz	XTIIEXOAVYMSRZ-RDJZCZTQSA-N	0	3	342.487	3.063	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C(C)(C)c2ccc(F)cc2)C[C@@H]1C	ZINC000947943179	1333313735	/nfs/dbraw/zinc/31/37/35/1333313735.db2.gz	JADFFGXRJIKRHH-MAUKXSAKSA-N	0	3	330.447	3.096	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(COC(C)C)cc2)C[C@@H]1C	ZINC000948017124	1333343205	/nfs/dbraw/zinc/34/32/05/1333343205.db2.gz	TXFREMXSKUMGFY-PXNSSMCTSA-N	0	3	342.483	3.218	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc(OC(C)C)cc2)C[C@H]1C	ZINC000948055979	1333357549	/nfs/dbraw/zinc/35/75/49/1333357549.db2.gz	GVJZCHPCVFWUFS-IEBWSBKVSA-N	0	3	342.483	3.009	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C23CC(c4ccccc4)(C2)C3)C[C@H]1C	ZINC000948078611	1333367877	/nfs/dbraw/zinc/36/78/77/1333367877.db2.gz	MJYOAJHRNMYSCV-LGRHEBEHSA-N	0	3	336.479	3.101	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(Cl)cc3c2OCC3)C[C@@H]1C	ZINC000948079131	1333368645	/nfs/dbraw/zinc/36/86/45/1333368645.db2.gz	UCRXKVJDYHISEL-SWLSCSKDSA-N	0	3	334.847	3.044	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(N(C)C(C)C)cc2)C[C@@H]1C	ZINC000948087366	1333371600	/nfs/dbraw/zinc/37/16/00/1333371600.db2.gz	ZQRDUOZBWYJOFC-HKUYNNGSSA-N	0	3	341.499	3.137	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(-c3ccccc3)[nH]2)C[C@H]1C	ZINC000948094498	1333372901	/nfs/dbraw/zinc/37/29/01/1333372901.db2.gz	LQFUORMMVDRHOT-SJLPKXTDSA-N	0	3	335.451	3.288	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(-c3ccccc3)[nH]2)C[C@H]1C	ZINC000948094496	1333373308	/nfs/dbraw/zinc/37/33/08/1333373308.db2.gz	LQFUORMMVDRHOT-AEFFLSMTSA-N	0	3	335.451	3.288	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2ccc3nccc(C)c3c2)CC1	ZINC000948408622	1333514539	/nfs/dbraw/zinc/51/45/39/1333514539.db2.gz	QOGPUAFWKDAKTE-IBGZPJMESA-N	0	3	349.478	3.493	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)Cc2c(C)cccc2C)CC1	ZINC000948416917	1333517449	/nfs/dbraw/zinc/51/74/49/1333517449.db2.gz	SICDXHKDUZEXAF-LJQANCHMSA-N	0	3	326.484	3.182	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)C2C3CC4CC(C3)CC2C4)CC1	ZINC000948439173	1333525388	/nfs/dbraw/zinc/52/53/88/1333525388.db2.gz	JMTNJLRVJOHVDQ-BIKXEMDZSA-N	0	3	328.500	3.005	20	30		EGEDHN
C=CCn1cccc1C(=O)N(C)[C@H]1CCCN(C/C=C\Cl)CC1	ZINC000948439589	1333526655	/nfs/dbraw/zinc/52/66/55/1333526655.db2.gz	SFUFYJWJDHBADL-DIEDAUMRSA-N	0	3	335.879	3.353	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccsc2)CC1	ZINC000948547197	1333568295	/nfs/dbraw/zinc/56/82/95/1333568295.db2.gz	SPQFAUAFGODQAQ-OKZBNKHCSA-N	0	3	330.497	3.188	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)Cc2cccc(CC)c2)CC1	ZINC000948560636	1333576720	/nfs/dbraw/zinc/57/67/20/1333576720.db2.gz	CYCJDGCVWBHIRW-HXUWFJFHSA-N	0	3	326.484	3.128	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cc(F)ccc2CC)CC1	ZINC000948587135	1333586155	/nfs/dbraw/zinc/58/61/55/1333586155.db2.gz	QZUGNYOWKKLQQO-SFHVURJKSA-N	0	3	330.447	3.338	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2ccc(OC)c(C(C)C)c2)CC1	ZINC000948589577	1333586992	/nfs/dbraw/zinc/58/69/92/1333586992.db2.gz	CMGLMYGDAHXDAX-SFHVURJKSA-N	0	3	342.483	3.378	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cnc(CC3CC3)s2)CC1	ZINC000948642396	1333608395	/nfs/dbraw/zinc/60/83/95/1333608395.db2.gz	HDHLQPRZOKKCEP-MRXNPFEDSA-N	0	3	345.512	3.045	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2ccc(C)c(Cl)c2F)CC1	ZINC000948648670	1333611996	/nfs/dbraw/zinc/61/19/96/1333611996.db2.gz	TXMVTZPRVIPRIY-CQSZACIVSA-N	0	3	336.838	3.347	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@H]2CCCN(Cc3cccnc3)CC2)C1	ZINC000948746695	1333657012	/nfs/dbraw/zinc/65/70/12/1333657012.db2.gz	ICJWAMKEJPKXJV-SFHVURJKSA-N	0	3	327.472	3.251	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@H]1CNC(=O)c1cc(C)n[nH]1	ZINC000948898120	1333724559	/nfs/dbraw/zinc/72/45/59/1333724559.db2.gz	DCXMDYYODGYHQW-LJQANCHMSA-N	0	3	338.455	3.014	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C[C@@H]3C=CCC3)CC2)C1	ZINC000949295318	1333817186	/nfs/dbraw/zinc/81/71/86/1333817186.db2.gz	CPPDJKNILICAHT-GOSISDBHSA-N	0	3	332.488	3.002	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C[C@@H]3C[C@H]3C3CC3)CC2)C1	ZINC000949418465	1333843016	/nfs/dbraw/zinc/84/30/16/1333843016.db2.gz	BNALWFJPKFNZMS-OALUTQOASA-N	0	3	346.515	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C(C)(C)C(=C)C)CC2)C1	ZINC000949433211	1333846131	/nfs/dbraw/zinc/84/61/31/1333846131.db2.gz	IVFXYSBIMMDPJF-UHFFFAOYSA-N	0	3	334.504	3.248	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@H]3CCCC[C@H]3C)CC2)C1	ZINC000949451201	1333850698	/nfs/dbraw/zinc/85/06/98/1333850698.db2.gz	SUAOSJIRNUSZEL-MSOLQXFVSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3ccoc3C3CC3)CC2)C1	ZINC000949454411	1333851703	/nfs/dbraw/zinc/85/17/03/1333851703.db2.gz	KINTXPLKILZWHL-UHFFFAOYSA-N	0	3	344.455	3.040	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C3(C)CC(=C)C3)CC2)C1	ZINC000949468253	1333856360	/nfs/dbraw/zinc/85/63/60/1333856360.db2.gz	AVWMZIXMXTWARQ-UHFFFAOYSA-N	0	3	332.488	3.002	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@H]3CC34CCCC4)CC2)C1	ZINC000949506028	1333862834	/nfs/dbraw/zinc/86/28/34/1333862834.db2.gz	BOBZGMUDGAEEJX-GOSISDBHSA-N	0	3	346.515	3.226	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C3(C)CCC(C)CC3)CC2)C1	ZINC000949534287	1333870529	/nfs/dbraw/zinc/87/05/29/1333870529.db2.gz	VCPGKYSBOCNUGD-UHFFFAOYSA-N	0	3	348.531	3.472	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)C2CCc3ccccc3CC2)C1	ZINC000967054794	1335650361	/nfs/dbraw/zinc/65/03/61/1335650361.db2.gz	CIKHGPHKUHZKTM-DYESRHJHSA-N	0	3	338.495	3.032	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2coc3cc(F)ccc23)C1	ZINC000967093105	1335661575	/nfs/dbraw/zinc/66/15/75/1335661575.db2.gz	YQNPGFOFRFNLHH-CXAGYDPISA-N	0	3	328.387	3.035	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccc(C)c3cccnc23)C1	ZINC000967410067	1335729743	/nfs/dbraw/zinc/72/97/43/1335729743.db2.gz	YFQAJHUAPGEVBY-LPHOPBHVSA-N	0	3	335.451	3.007	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2cc(C3CC3)oc2C2CC2)C1	ZINC000967418543	1335732509	/nfs/dbraw/zinc/73/25/09/1335732509.db2.gz	BCMZQCKRCKTQJJ-RDTXWAMCSA-N	0	3	340.467	3.498	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CN(CC3=CCCCC3)CC[C@H]2C)c1	ZINC000968317509	1335888354	/nfs/dbraw/zinc/88/83/54/1335888354.db2.gz	LAIYQGPZCNECQD-OXQOHEQNSA-N	0	3	337.467	3.004	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2cc(F)cc3cccnc32)C1	ZINC000968369718	1335906741	/nfs/dbraw/zinc/90/67/41/1335906741.db2.gz	PGYRRMNJHGSCPA-RDTXWAMCSA-N	0	3	341.430	3.390	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)C2(c3cccc(F)c3)CC2)C1	ZINC000968375045	1335909204	/nfs/dbraw/zinc/90/92/04/1335909204.db2.gz	QTBMPRBMVXAYFU-MAUKXSAKSA-N	0	3	330.447	3.260	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2ccc(-c3cn[nH]c3)cc2)C1	ZINC000968406255	1335922862	/nfs/dbraw/zinc/92/28/62/1335922862.db2.gz	ZESTUPAUTCHHMX-HNAYVOBHSA-N	0	3	338.455	3.093	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ncc(Cl)cc2Cl)C1	ZINC000968473063	1335934726	/nfs/dbraw/zinc/93/47/26/1335934726.db2.gz	YWKFZUSOTQKRKK-RISCZKNCSA-N	0	3	342.270	3.405	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2cccc(-c3cnco3)c2)C1	ZINC000968492538	1335940851	/nfs/dbraw/zinc/94/08/51/1335940851.db2.gz	JMSNKCLNNXTOJK-YJBOKZPZSA-N	0	3	339.439	3.358	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccc(Cl)c(Cl)c2)C1	ZINC000968579944	1335970302	/nfs/dbraw/zinc/97/03/02/1335970302.db2.gz	QWDHXANTZORDPM-LRDDRELGSA-N	0	3	339.266	3.457	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)Cc2c(F)cccc2Cl)C1	ZINC000968584139	1335973154	/nfs/dbraw/zinc/97/31/54/1335973154.db2.gz	STCKXAHOIRRKMO-GUYCJALGSA-N	0	3	338.854	3.424	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2cccc(Cl)c2Cl)C1	ZINC000968584150	1335973477	/nfs/dbraw/zinc/97/34/77/1335973477.db2.gz	SZGSCTDTYRZIBM-IUODEOHRSA-N	0	3	339.266	3.457	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@@H](NCc2cc(Cl)cc(Cl)c2)C1	ZINC000968627102	1335989559	/nfs/dbraw/zinc/98/95/59/1335989559.db2.gz	MZSAMSPAHSTJIZ-MRXNPFEDSA-N	0	3	337.250	3.097	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2c[nH]c3ccc(F)cc23)C1	ZINC000968700672	1336017133	/nfs/dbraw/zinc/01/71/33/1336017133.db2.gz	AGESJPBLWJCBCR-SCLBCKFNSA-N	0	3	329.419	3.323	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2ccc(CC)c(CC)c2)C1	ZINC000968710448	1336020031	/nfs/dbraw/zinc/02/00/31/1336020031.db2.gz	QRFPHCLHMZDZAI-OXJNMPFZSA-N	0	3	326.484	3.275	20	30		EGEDHN
N#Cc1c[nH]c(C(=O)NC[C@@H]2CCCCCN2Cc2ccsc2)c1	ZINC000968799200	1336054768	/nfs/dbraw/zinc/05/47/68/1336054768.db2.gz	FLQPNMQYMPHZSU-INIZCTEOSA-N	0	3	342.468	3.122	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cn(C(C)(C)C)nc1C	ZINC000968856716	1336069709	/nfs/dbraw/zinc/06/97/09/1336069709.db2.gz	NFURIDKNPFVFRJ-MRXNPFEDSA-N	0	3	332.492	3.107	20	30		EGEDHN
C#CCCN1CCCCC[C@H]1CNC(=O)c1ccoc1C(F)(F)F	ZINC000968875358	1336075254	/nfs/dbraw/zinc/07/52/54/1336075254.db2.gz	YTSNDLOYWVKGKI-ZDUSSCGKSA-N	0	3	342.361	3.296	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cnn(-c2ccccc2)c1	ZINC000968938838	1336097297	/nfs/dbraw/zinc/09/72/97/1336097297.db2.gz	UGGGISDSTDSZPZ-IBGZPJMESA-N	0	3	338.455	3.033	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1nc2c(s1)CCC2	ZINC000968948618	1336100491	/nfs/dbraw/zinc/10/04/91/1336100491.db2.gz	BLWUZNUVZSSWTC-AWEZNQCLSA-N	0	3	333.501	3.182	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)[C@@H]1CCc2cc(C)ccc2O1	ZINC000968951726	1336101039	/nfs/dbraw/zinc/10/10/39/1336101039.db2.gz	DDHLMQPTXBAWEC-QUCCMNQESA-N	0	3	342.483	3.235	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)[C@H]1CCc2cc(F)ccc21	ZINC000968952696	1336101540	/nfs/dbraw/zinc/10/15/40/1336101540.db2.gz	WXFPIVHNOCWOCG-HKUYNNGSSA-N	0	3	330.447	3.402	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccc(C(F)(F)F)nc1	ZINC000968971453	1336105097	/nfs/dbraw/zinc/10/50/97/1336105097.db2.gz	LJTZBUUSXYHLQL-CQSZACIVSA-N	0	3	341.377	3.261	20	30		EGEDHN
C#CCCN1CCCCC[C@@H]1CNC(=O)c1cc2ncccc2s1	ZINC000968974512	1336106565	/nfs/dbraw/zinc/10/65/65/1336106565.db2.gz	VRXFQYLVNUOQEK-OAHLLOKOSA-N	0	3	341.480	3.294	20	30		EGEDHN
C#CCCN1CCCCC[C@H]1CNC(=O)c1cc2occc2s1	ZINC000969022295	1336120085	/nfs/dbraw/zinc/12/00/85/1336120085.db2.gz	BKCVJDIWXALYAZ-AWEZNQCLSA-N	0	3	330.453	3.492	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cnccc1C(F)(F)F	ZINC000969049854	1336128245	/nfs/dbraw/zinc/12/82/45/1336128245.db2.gz	OWULLIWVDJALDM-ZDUSSCGKSA-N	0	3	341.377	3.261	20	30		EGEDHN
C#CCCN1CCCCC[C@H]1CNC(=O)c1sc(C)cc1OC	ZINC000969056569	1336131661	/nfs/dbraw/zinc/13/16/61/1336131661.db2.gz	KCYBCDZMJUFDCK-HNNXBMFYSA-N	0	3	334.485	3.063	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)[C@@H]1CCOc2ccccc21	ZINC000969072244	1336137442	/nfs/dbraw/zinc/13/74/42/1336137442.db2.gz	CGKNMBRVAXTBAB-SJLPKXTDSA-N	0	3	328.456	3.100	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)[C@H]1CCOc2ccccc21	ZINC000969072242	1336137653	/nfs/dbraw/zinc/13/76/53/1336137653.db2.gz	CGKNMBRVAXTBAB-AEFFLSMTSA-N	0	3	328.456	3.100	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1csc(C(F)(F)F)n1	ZINC000969100884	1336143268	/nfs/dbraw/zinc/14/32/68/1336143268.db2.gz	LEAWSOQXALZRLC-LLVKDONJSA-N	0	3	347.406	3.322	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cc2c(C)cccn2c1	ZINC000969114995	1336149485	/nfs/dbraw/zinc/14/94/85/1336149485.db2.gz	MKIWCDZOWGAHBF-SFHVURJKSA-N	0	3	325.456	3.408	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1ccc(C)c2c1CCC2	ZINC000969156327	1336166141	/nfs/dbraw/zinc/16/61/41/1336166141.db2.gz	PPZAORCHUAEXFH-SFHVURJKSA-N	0	3	338.495	3.481	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1cnc(C(C)(C)C)nc1	ZINC000969163310	1336168688	/nfs/dbraw/zinc/16/86/88/1336168688.db2.gz	GKLFKXYQOPZKHZ-QGZVFWFLSA-N	0	3	344.503	3.325	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)c2cc3cc(Cl)ccc3[nH]2)C1	ZINC000970249941	1336291388	/nfs/dbraw/zinc/29/13/88/1336291388.db2.gz	DKXMMUVETOALDG-LBPRGKRZSA-N	0	3	331.847	3.448	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)C2(c3cccc(Cl)c3)CC2)CC1	ZINC001005478058	1336358268	/nfs/dbraw/zinc/35/82/68/1336358268.db2.gz	UYQWUOSHTYVZJZ-UHFFFAOYSA-N	0	3	332.875	3.480	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccnc(-c3ccco3)c2)CC1	ZINC001005557952	1336371166	/nfs/dbraw/zinc/37/11/66/1336371166.db2.gz	ZWALMWSORYINFI-UHFFFAOYSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)C[C@@H]2CCOc3ccccc32)CC1	ZINC001005816000	1336404197	/nfs/dbraw/zinc/40/41/97/1336404197.db2.gz	ZWVAIGYWNIWETB-INIZCTEOSA-N	0	3	328.456	3.052	20	30		EGEDHN
CN(C(=O)[C@H]1CC[C@H](F)C1)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001005893327	1336417691	/nfs/dbraw/zinc/41/76/91/1336417691.db2.gz	WBXCWXWSPSSBOB-ROUUACIJSA-N	0	3	343.446	3.119	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)[C@@H]2C[C@H]2c2c(F)cccc2F)CC1	ZINC001005970953	1336432121	/nfs/dbraw/zinc/43/21/21/1336432121.db2.gz	XBHDGDRVWXHIEZ-HUUCEWRRSA-N	0	3	334.410	3.177	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2ncc(Cl)cc2Cl)CC1	ZINC001006190590	1336464274	/nfs/dbraw/zinc/46/42/74/1336464274.db2.gz	XDXCBUBZIHGSAI-UHFFFAOYSA-N	0	3	328.243	3.111	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cc(Cl)ccc2OC)CC1	ZINC001006364327	1336495663	/nfs/dbraw/zinc/49/56/63/1336495663.db2.gz	MWADVPYBVXKELA-UHFFFAOYSA-N	0	3	336.863	3.461	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2cc(-c3ccccc3)no2)C1	ZINC001007751086	1336694759	/nfs/dbraw/zinc/69/47/59/1336694759.db2.gz	CKPGHGBXSHXUFQ-MRXNPFEDSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2sc(C)nc2CC(C)C)C1	ZINC001007813942	1336705547	/nfs/dbraw/zinc/70/55/47/1336705547.db2.gz	VMMOQYROPPBGON-OAHLLOKOSA-N	0	3	335.517	3.420	20	30		EGEDHN
C#CCCN1CCC[C@@H](NC(=O)Cc2ccc(C(C)(C)C)cc2)C1	ZINC001008667195	1336907794	/nfs/dbraw/zinc/90/77/94/1336907794.db2.gz	RPXQYKNDRNDOTB-LJQANCHMSA-N	0	3	326.484	3.131	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN(Cc3ccc(C)cc3C)C2)cn1	ZINC001009278624	1336995968	/nfs/dbraw/zinc/99/59/68/1336995968.db2.gz	VCZAQIRLECZWTE-OAQYLSRUSA-N	0	3	347.462	3.074	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCN([C@@H](CC)c3ccccc3)C2)cn1	ZINC001009278784	1336995996	/nfs/dbraw/zinc/99/59/96/1336995996.db2.gz	WFWZPXYPCMEQHY-SFTDATJTSA-N	0	3	347.462	3.408	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](NC(=O)c2cc(-c3cccs3)on2)C1	ZINC001015442093	1338143049	/nfs/dbraw/zinc/14/30/49/1338143049.db2.gz	QTZAJPPUOGXHMI-CYBMUJFWSA-N	0	3	331.441	3.173	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCN(CCc3ccc(C)cc3)C2)CC1	ZINC001015659460	1338238078	/nfs/dbraw/zinc/23/80/78/1338238078.db2.gz	BARJJYRGTXEXMI-FQEVSTJZSA-N	0	3	326.484	3.474	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@@H]3NC(=O)C[C@H]3C=CCC3)CC2)c1	ZINC001016501399	1338628466	/nfs/dbraw/zinc/62/84/66/1338628466.db2.gz	ZQZRDFCNXZIFBJ-PXNSSMCTSA-N	0	3	349.478	3.385	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2coc3ccc(CC)cc32)CC1	ZINC001016621378	1338667459	/nfs/dbraw/zinc/66/74/59/1338667459.db2.gz	PZKUPFCXJTYKNJ-LJQANCHMSA-N	0	3	336.435	3.213	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cc3ccccc3nc2C)CC1	ZINC001016651516	1338679038	/nfs/dbraw/zinc/67/90/38/1338679038.db2.gz	IPVPEOGMZPCNNS-HXUWFJFHSA-N	0	3	347.462	3.151	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccc(C)nc2C(C)C)CC1	ZINC001016753647	1338712504	/nfs/dbraw/zinc/71/25/04/1338712504.db2.gz	IXGBQSMWUFOFLJ-GOSISDBHSA-N	0	3	339.483	3.121	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)Cc2c(C)[nH]c3ccccc32)CC1	ZINC001016797015	1338730090	/nfs/dbraw/zinc/73/00/90/1338730090.db2.gz	WPVRFLZAFFXZJG-HXUWFJFHSA-N	0	3	349.478	3.013	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@@H]3NC(=O)[C@H]3CC34CCC4)CC2)c1	ZINC001016857493	1338749163	/nfs/dbraw/zinc/74/91/63/1338749163.db2.gz	ZZTYUCGPGSGGGN-MOPGFXCFSA-N	0	3	349.478	3.219	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2c(F)cccc2Cl)CC1	ZINC001016940008	1338776668	/nfs/dbraw/zinc/77/66/68/1338776668.db2.gz	LPWVAKXSADUPTP-HNNXBMFYSA-N	0	3	334.822	3.087	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccc3[nH]c(C)c(C)c3c2)CC1	ZINC001016969975	1338787314	/nfs/dbraw/zinc/78/73/14/1338787314.db2.gz	YJHPSJNKGKBMNE-HXUWFJFHSA-N	0	3	349.478	3.392	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)[C@H](C)c2cccc(Cl)c2)CC1	ZINC001016987078	1338793943	/nfs/dbraw/zinc/79/39/43/1338793943.db2.gz	SBFMGSRYVFRUDV-QAPCUYQASA-N	0	3	344.886	3.438	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)[C@H](C)c2cccc(Cl)c2)CC1	ZINC001016988438	1338794440	/nfs/dbraw/zinc/79/44/40/1338794440.db2.gz	ZXYBKLWWOUYMOZ-RHSMWYFYSA-N	0	3	330.859	3.047	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)[C@H]2CCCCc3ccccc32)CC1	ZINC001016990938	1338795980	/nfs/dbraw/zinc/79/59/80/1338795980.db2.gz	WCWBBYAXUZJPEA-VQTJNVASSA-N	0	3	336.479	3.101	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(CC)c(CC)c2)CC1	ZINC001017005316	1338801675	/nfs/dbraw/zinc/80/16/75/1338801675.db2.gz	WVZJVENIZSBKJX-FQEVSTJZSA-N	0	3	338.495	3.419	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC[C@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001017055490	1338839232	/nfs/dbraw/zinc/83/92/32/1338839232.db2.gz	JWPXGGCXLYTYMI-HUUCEWRRSA-N	0	3	333.501	3.336	20	30		EGEDHN
Cc1cccc(Cl)c1CN(C)C[C@H]1CCCN(C(=O)[C@H](C)C#N)C1	ZINC001017071548	1338847734	/nfs/dbraw/zinc/84/77/34/1338847734.db2.gz	NUCNVOOXDUZEOT-HZPDHXFCSA-N	0	3	347.890	3.479	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H](CN(C)Cc2cncc(F)c2)C1	ZINC001017201520	1338945637	/nfs/dbraw/zinc/94/56/37/1338945637.db2.gz	JZFBUAUOQMKMDP-UZLBHIALSA-N	0	3	347.478	3.493	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H](CN(C)Cc2cn(C)nc2C)C1	ZINC001017201675	1338946941	/nfs/dbraw/zinc/94/69/41/1338946941.db2.gz	KRXGZBBRMGGPRU-XLIONFOSSA-N	0	3	346.519	3.001	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CCc1csc(C)n1	ZINC001018028267	1339485827	/nfs/dbraw/zinc/48/58/27/1339485827.db2.gz	QZRPODVEVREZGH-CALCHBBNSA-N	0	3	333.501	3.026	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@H](C)c1ccccc1OC	ZINC001018186564	1339525137	/nfs/dbraw/zinc/52/51/37/1339525137.db2.gz	FGWACPONZSRVDF-OKZBNKHCSA-N	0	3	342.483	3.440	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)Cc1ccc(C)cc1	ZINC001018322518	1339576854	/nfs/dbraw/zinc/57/68/54/1339576854.db2.gz	UYUKPLDJROJCLA-RLLQIKCJSA-N	0	3	326.484	3.425	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)Cc1ccc(C)cc1	ZINC001018322519	1339577066	/nfs/dbraw/zinc/57/70/66/1339577066.db2.gz	UYUKPLDJROJCLA-YSIASYRMSA-N	0	3	326.484	3.425	20	30		EGEDHN
N#Cc1cc(CN[C@H]2CCN(C(=O)C3CCCCCC3)C2)ccc1F	ZINC001018611414	1339681456	/nfs/dbraw/zinc/68/14/56/1339681456.db2.gz	VZCVGPRXMKOHIS-SFHVURJKSA-N	0	3	343.446	3.358	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCCN2Cc2ccc(CC)cc2)cn1	ZINC001028270788	1340524534	/nfs/dbraw/zinc/52/45/34/1340524534.db2.gz	SGQRUKCFXDISMP-OAQYLSRUSA-N	0	3	347.462	3.020	20	30		EGEDHN
Cc1cccc(C(=O)NC[C@H]2CCN(Cc3cccc(C#N)c3)C2)c1	ZINC001028376431	1340604226	/nfs/dbraw/zinc/60/42/26/1340604226.db2.gz	ZNJYNYKNRMPQGL-LJQANCHMSA-N	0	3	333.435	3.119	20	30		EGEDHN
CC[C@H](F)C(=O)N1CCC([C@H](C)NCc2ccccc2C#N)CC1	ZINC001029129674	1340937747	/nfs/dbraw/zinc/93/77/47/1340937747.db2.gz	YUJPAOLNBDBKBT-KSSFIOAISA-N	0	3	331.435	3.023	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC([C@H](C)NCc2cc(OC)no2)CC1	ZINC001029139565	1340940477	/nfs/dbraw/zinc/94/04/77/1340940477.db2.gz	GGYVYNFLKNVMIK-IFXJQAMLSA-N	0	3	349.475	3.002	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC([C@H](C)NCc2ccn(CC)n2)CC1	ZINC001029140166	1340940958	/nfs/dbraw/zinc/94/09/58/1340940958.db2.gz	RKDRODVQXLCLJY-OXJNMPFZSA-N	0	3	346.519	3.222	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1C[C@H]2CC[C@@H](C1)N2[C@H]1CCCc2ccc(F)cc21	ZINC001029245061	1340960707	/nfs/dbraw/zinc/96/07/07/1340960707.db2.gz	ORCXJMLZVRJADW-KUZCPNRJSA-N	0	3	341.430	3.038	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CC[C@@H](C2)N3C[C@H](OC)C2CCCC2)C1	ZINC001029465453	1340996832	/nfs/dbraw/zinc/99/68/32/1340996832.db2.gz	XTBWRHFIKBIKJQ-OTWHNJEPSA-N	0	3	346.515	3.223	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCN(C(=O)C[C@@H]2C=CCC2)C1	ZINC001029642211	1341030879	/nfs/dbraw/zinc/03/08/79/1341030879.db2.gz	YGRAQUIZTZVSSV-CVEARBPZSA-N	0	3	343.496	3.256	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001029702485	1341049169	/nfs/dbraw/zinc/04/91/69/1341049169.db2.gz	ITCGIJAXCUXXQI-ZDUSSCGKSA-N	0	3	335.448	3.163	20	30		EGEDHN
Cc1cccc(Cl)c1CN(C)C[C@H]1CCN(C(=O)C#CC2CC2)C1	ZINC001029734435	1341057965	/nfs/dbraw/zinc/05/79/65/1341057965.db2.gz	XLVXGNLGRPRKPH-QGZVFWFLSA-N	0	3	344.886	3.342	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](CN(C)Cc2cnc(C)s2)C1	ZINC001029798004	1341076093	/nfs/dbraw/zinc/07/60/93/1341076093.db2.gz	FBTVFBCSGNFAMU-HNNXBMFYSA-N	0	3	335.517	3.334	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](CN(C)Cc2oc(C)nc2C)C1	ZINC001029799570	1341076621	/nfs/dbraw/zinc/07/66/21/1341076621.db2.gz	AMUQFUSKEHVMON-INIZCTEOSA-N	0	3	333.476	3.174	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](CN(C)Cc2c(C)onc2CC)C1	ZINC001029801278	1341077224	/nfs/dbraw/zinc/07/72/24/1341077224.db2.gz	KFYWYRPIKGAMRV-OAHLLOKOSA-N	0	3	333.476	3.038	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](CN(C)Cc3cnoc3C)C2)CC1	ZINC001029825786	1341087193	/nfs/dbraw/zinc/08/71/93/1341087193.db2.gz	IGTRRTNUIKEZSL-MRXNPFEDSA-N	0	3	331.460	3.010	20	30		EGEDHN
C=C[C@H](C(=O)N1CC[C@H](CN(C)Cc2cccnc2)C1)c1ccccc1	ZINC001029906831	1341111719	/nfs/dbraw/zinc/11/17/19/1341111719.db2.gz	AFGSYIKOVZJZID-CTNGQTDRSA-N	0	3	349.478	3.332	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)CC1CCN(C(=O)C2CCC2)CC1	ZINC001029923458	1341121066	/nfs/dbraw/zinc/12/10/66/1341121066.db2.gz	ICPPODPYVSIPCG-UHFFFAOYSA-N	0	3	331.485	3.090	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC(CN(C)Cc2ccc(C#N)s2)CC1	ZINC001029953875	1341133216	/nfs/dbraw/zinc/13/32/16/1341133216.db2.gz	LWDBAHOXQIIJEE-LNKIKWGQSA-N	0	3	331.485	3.256	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC(CN(C)Cc2cc(C)ncn2)CC1	ZINC001029991467	1341148496	/nfs/dbraw/zinc/14/84/96/1341148496.db2.gz	ZZDGOMLUASKVRB-HXUWFJFHSA-N	0	3	344.503	3.058	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc2oc(C)nc2c1	ZINC001032468174	1341515612	/nfs/dbraw/zinc/51/56/12/1341515612.db2.gz	LWTOGVZBNHJZES-HOTGVXAUSA-N	0	3	325.412	3.001	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cc(C)c2ccccc2n1	ZINC001032480616	1341520671	/nfs/dbraw/zinc/52/06/71/1341520671.db2.gz	HWPYBJVWHJBHOO-IRXDYDNUSA-N	0	3	335.451	3.408	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cnn(C(CC)CC)c1C	ZINC001032723769	1341591956	/nfs/dbraw/zinc/59/19/56/1341591956.db2.gz	TVRISPKUKODJNX-ROUUACIJSA-N	0	3	344.503	3.418	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C12CC3CC(CC(C3)C1)C2	ZINC001032748997	1341601357	/nfs/dbraw/zinc/60/13/57/1341601357.db2.gz	MMXBGMMNTIQSFL-VQIYKNCMSA-N	0	3	328.500	3.454	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cnn(C(C)(C)C)c1CC	ZINC001032785632	1341613433	/nfs/dbraw/zinc/61/34/33/1341613433.db2.gz	MWDQIYBVCPJCFY-HOTGVXAUSA-N	0	3	344.503	3.065	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N2C[C@@H]3C[C@H]2CN3CCC(C)C)cc1	ZINC001032807111	1341620599	/nfs/dbraw/zinc/62/05/99/1341620599.db2.gz	YMGBFJHEDKDELX-OALUTQOASA-N	0	3	342.483	3.125	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](N(C)C(=O)c2ccc(-c3cc[nH]n3)s2)C1	ZINC001033165165	1341742547	/nfs/dbraw/zinc/74/25/47/1341742547.db2.gz	IVBANJSPOGEMGE-CQSZACIVSA-N	0	3	344.484	3.251	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2ccccc2-c2ccncc2)C1	ZINC001033189601	1341748149	/nfs/dbraw/zinc/74/81/49/1341748149.db2.gz	BXNNMSNDRLGCIK-SFHVURJKSA-N	0	3	335.451	3.471	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2ccc(-c3cnco3)cc2)C1	ZINC001033193857	1341749369	/nfs/dbraw/zinc/74/93/69/1341749369.db2.gz	JHUHGCGHNPQAGZ-QGZVFWFLSA-N	0	3	325.412	3.064	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2coc3ccc(OC)cc23)C1	ZINC001033254240	1341760140	/nfs/dbraw/zinc/76/01/40/1341760140.db2.gz	BBVNWMQQLRMUDG-CQSZACIVSA-N	0	3	328.412	3.164	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2cc(C)n(CC3CC3)c2C)C1	ZINC001033596159	1341889712	/nfs/dbraw/zinc/88/97/12/1341889712.db2.gz	WREANIRJBNYMTQ-GOSISDBHSA-N	0	3	329.488	3.237	20	30		EGEDHN
C#CCCN1CC[C@H](N(C)C(=O)CC23CC4CC(CC(C4)C2)C3)C1	ZINC001033611789	1341901835	/nfs/dbraw/zinc/90/18/35/1341901835.db2.gz	FHUJCSJBDOOPSP-TWJKGYNYSA-N	0	3	328.500	3.149	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)C(C)(C)c2ccc(OC)cc2)C1	ZINC001033678788	1341945617	/nfs/dbraw/zinc/94/56/17/1341945617.db2.gz	ORMFSECVIJIHQZ-KRWDZBQOSA-N	0	3	330.472	3.082	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ncn3cc(Cl)ccc23)C1	ZINC001033833131	1342032854	/nfs/dbraw/zinc/03/28/54/1342032854.db2.gz	FRJWXQSIWDLDQP-HNNXBMFYSA-N	0	3	346.862	3.100	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@@H]2COc3cc(C)c(C)cc32)C1	ZINC001033908062	1342078975	/nfs/dbraw/zinc/07/89/75/1342078975.db2.gz	LMUXGEWXHLMMAX-PKOBYXMFSA-N	0	3	342.483	3.278	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2ccc(C)c(Cl)c2F)C1	ZINC001033907331	1342079271	/nfs/dbraw/zinc/07/92/71/1342079271.db2.gz	VCHSPMODRDKNIC-AWEZNQCLSA-N	0	3	336.838	3.347	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@@H]2C[C@H]2c2ccccc2F)C1	ZINC001033979648	1342127321	/nfs/dbraw/zinc/12/73/21/1342127321.db2.gz	KMCGYKUNWGLLSB-BPQIPLTHSA-N	0	3	330.447	3.428	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2ccc3nc(C)ccc3c2)C1	ZINC001033995012	1342135927	/nfs/dbraw/zinc/13/59/27/1342135927.db2.gz	UQKAMGDLBPKIRR-LJQANCHMSA-N	0	3	335.451	3.103	20	30		EGEDHN
C#Cc1ccc(C(=O)N(CC)[C@@H]2CCN(Cc3ccccc3C)C2)nc1	ZINC001034023176	1342161510	/nfs/dbraw/zinc/16/15/10/1342161510.db2.gz	OGBHDZWSGBTZAT-HXUWFJFHSA-N	0	3	347.462	3.108	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2[nH]c3ccccc3c2OC)C1	ZINC001034050449	1342191403	/nfs/dbraw/zinc/19/14/03/1342191403.db2.gz	MNWXJIHMABKGLC-OAHLLOKOSA-N	0	3	341.455	3.289	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@@H]2CCc3cc(OC)ccc32)C1	ZINC001034233428	1342336324	/nfs/dbraw/zinc/33/63/24/1342336324.db2.gz	DICQIIMPSZRSLC-YLJYHZDGSA-N	0	3	342.483	3.272	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cnn(-c3ccccc3)c2)C1	ZINC001034301490	1342384340	/nfs/dbraw/zinc/38/43/40/1342384340.db2.gz	MKSNBPMIQKXVTC-SFHVURJKSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc(-n3ccnc3)cc2)C1	ZINC001034328034	1342402592	/nfs/dbraw/zinc/40/25/92/1342402592.db2.gz	PHQCPRVLHNMTOY-SFHVURJKSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2c(F)ccc(F)c2OC)C1	ZINC001034341937	1342414239	/nfs/dbraw/zinc/41/42/39/1342414239.db2.gz	IQSWMBWKAUHNRE-ZDUSSCGKSA-N	0	3	338.398	3.134	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2c(F)ccc(F)c2Cl)C1	ZINC001034419368	1342481810	/nfs/dbraw/zinc/48/18/10/1342481810.db2.gz	BKHBZBGZIVREJB-GFCCVEGCSA-N	0	3	340.801	3.226	20	30		EGEDHN
C=CCCN1CCCC[C@H](NC(=O)c2cnc([C@H]3CCCO3)s2)C1	ZINC001034430816	1342492870	/nfs/dbraw/zinc/49/28/70/1342492870.db2.gz	AJXSZMRPCBYHSA-LSDHHAIUSA-N	0	3	349.500	3.155	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@@H](C)n2cnc3ccccc32)C1	ZINC001034474642	1342529725	/nfs/dbraw/zinc/52/97/25/1342529725.db2.gz	UERYXSBTFXIPHW-SJORKVTESA-N	0	3	340.471	3.144	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)C2(c3ccccc3F)CCC2)C1	ZINC001034483482	1342540863	/nfs/dbraw/zinc/54/08/63/1342540863.db2.gz	RPCOTUPIYBBUBI-QGZVFWFLSA-N	0	3	342.458	3.241	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)Cc2nsc3ccccc32)C1	ZINC001034538926	1342597908	/nfs/dbraw/zinc/59/79/08/1342597908.db2.gz	WOVGNUFLVVTOAT-OAHLLOKOSA-N	0	3	343.496	3.386	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cccc(OC)c2)C12CCC2	ZINC001078793654	1357088108	/nfs/dbraw/zinc/08/81/08/1357088108.db2.gz	ZNVCXKIBMOLLMW-JKSUJKDBSA-N	0	3	334.847	3.078	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)Cc2ccsc2)s1	ZINC001034849600	1342801777	/nfs/dbraw/zinc/80/17/77/1342801777.db2.gz	MHSJXFSOBOBGIG-CQSZACIVSA-N	0	3	345.493	3.005	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)C[C@@H]2C=CCC2)cc1F	ZINC001034853951	1342805254	/nfs/dbraw/zinc/80/52/54/1342805254.db2.gz	ONKXZLBPLZYCEX-CRAIPNDOSA-N	0	3	341.430	3.134	20	30		EGEDHN
Cc1cc(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)s2)oc1C	ZINC001034909254	1342832994	/nfs/dbraw/zinc/83/29/94/1342832994.db2.gz	ITAVTGUUFINIFY-CQSZACIVSA-N	0	3	343.452	3.224	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)C2(F)CCCCC2)s1	ZINC001035092710	1342921965	/nfs/dbraw/zinc/92/19/65/1342921965.db2.gz	KRWLVNYUTHPEAO-CQSZACIVSA-N	0	3	349.475	3.373	20	30		EGEDHN
C[C@H](CC(=O)N1CCC[C@@H]1CNCc1ccc(C#N)cc1F)C1CC1	ZINC001035136084	1342951283	/nfs/dbraw/zinc/95/12/83/1342951283.db2.gz	RDNXIMOBXCCSIT-RDTXWAMCSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@H]1C[C@H]1C(=O)N1CCC2(CCN(Cc3ccccc3C#N)C2)CC1	ZINC001035154758	1342968760	/nfs/dbraw/zinc/96/87/60/1342968760.db2.gz	YTCQNPMYBXGBTE-QFBILLFUSA-N	0	3	337.467	3.029	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC2(CN(Cc3ccc4cc[nH]c4c3)C2)CC1	ZINC001035700453	1343141900	/nfs/dbraw/zinc/14/19/00/1343141900.db2.gz	FZYFFVOAVVHSDN-UHFFFAOYSA-N	0	3	347.462	3.006	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cn(C)c3ccccc13)CC2	ZINC001035744155	1343164598	/nfs/dbraw/zinc/16/45/98/1343164598.db2.gz	DTHKKHYPXUACOI-UHFFFAOYSA-N	0	3	337.467	3.292	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@H]1CCc3cc(F)ccc31)CC2	ZINC001035751479	1343170562	/nfs/dbraw/zinc/17/05/62/1343170562.db2.gz	YJGIPKGSHQIKMD-IBGZPJMESA-N	0	3	342.458	3.356	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cc1cc(F)c(C)cc1F)CC2	ZINC001035754707	1343172139	/nfs/dbraw/zinc/17/21/39/1343172139.db2.gz	HPJUPKVCGMRYCS-UHFFFAOYSA-N	0	3	348.437	3.316	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1c(F)cc(F)cc1F)CC2	ZINC001035779177	1343189940	/nfs/dbraw/zinc/18/99/40/1343189940.db2.gz	UKTUCOHTKSEVQR-UHFFFAOYSA-N	0	3	338.373	3.218	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)C1[C@H]3CCCCCC[C@H]13)CC2	ZINC001035803431	1343205489	/nfs/dbraw/zinc/20/54/89/1343205489.db2.gz	GDUROPLNAJXWLN-ROUUACIJSA-N	0	3	328.500	3.151	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)CO[C@@H]1CCC[C@H](C)C1)CC2	ZINC001035810182	1343210307	/nfs/dbraw/zinc/21/03/07/1343210307.db2.gz	UYDLNAKNSQCHTR-ZWKOTPCHSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc(OC)cc1Cl)CC2	ZINC001035823342	1343215620	/nfs/dbraw/zinc/21/56/20/1343215620.db2.gz	HVVIQTOALQSCIJ-UHFFFAOYSA-N	0	3	348.874	3.463	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc(C)cc1OC)CC2	ZINC001035839788	1343222574	/nfs/dbraw/zinc/22/25/74/1343222574.db2.gz	AZQHXECQMQABRJ-UHFFFAOYSA-N	0	3	328.456	3.118	20	30		EGEDHN
C[C@H]1CN(C(=O)c2cccs2)CC[C@@H]1NCc1ccccc1C#N	ZINC001035901592	1343259447	/nfs/dbraw/zinc/25/94/47/1343259447.db2.gz	KBAZOXFCINUMPA-YOEHRIQHSA-N	0	3	339.464	3.260	20	30		EGEDHN
C[C@@H]1CN(C(=O)/C=C\c2ccco2)CC[C@H]1NCc1ccccc1C#N	ZINC001035903136	1343260530	/nfs/dbraw/zinc/26/05/30/1343260530.db2.gz	BDMVMTIXYPGBRW-JKUVKPIWSA-N	0	3	349.434	3.191	20	30		EGEDHN
Cc1occc1C(=O)N1CC[C@@H](NCc2ccccc2C#N)[C@@H](C)C1	ZINC001035908442	1343264666	/nfs/dbraw/zinc/26/46/66/1343264666.db2.gz	HCEKIKLUARMSCJ-IFXJQAMLSA-N	0	3	337.423	3.100	20	30		EGEDHN
C[C@H]1CN(C(=O)CCC2CCC2)CC[C@H]1NCc1ccccc1C#N	ZINC001035975154	1343295616	/nfs/dbraw/zinc/29/56/16/1343295616.db2.gz	TZXLUHAFHCVNHA-OXJNMPFZSA-N	0	3	339.483	3.465	20	30		EGEDHN
CCC1(C(=O)N2CC[C@H](NCc3cc(F)ccc3C#N)[C@H](C)C2)CC1	ZINC001036163967	1343338583	/nfs/dbraw/zinc/33/85/83/1343338583.db2.gz	DJROSZWBDFBEBA-KDOFPFPSSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]([C@H](C)NCc2nc(C)oc2C)C1	ZINC001036426040	1343479382	/nfs/dbraw/zinc/47/93/82/1343479382.db2.gz	CXSMYYYNPFSMAU-XJKSGUPXSA-N	0	3	333.476	3.220	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]([C@H](C)NCc3cc(C)no3)C2)C1	ZINC001036445166	1343492245	/nfs/dbraw/zinc/49/22/45/1343492245.db2.gz	MGUBOGBZNLHMQJ-JKSUJKDBSA-N	0	3	331.460	3.056	20	30		EGEDHN
C[C@H](NCc1cc(F)ccc1C#N)[C@@H]1CCCN(C(=O)C(C)(C)C)C1	ZINC001036464625	1343500285	/nfs/dbraw/zinc/50/02/85/1343500285.db2.gz	KQHXYOGWOAIPHO-GOEBONIOSA-N	0	3	345.462	3.460	20	30		EGEDHN
CCCC(=O)N1CCC[C@@H](C)[C@@H]1CNCc1cc(C#N)ccc1OC	ZINC001036483049	1343508600	/nfs/dbraw/zinc/50/86/00/1343508600.db2.gz	AZDZZHIRTRVHBE-QAPCUYQASA-N	0	3	343.471	3.084	20	30		EGEDHN
C[C@H]1CCCN(C(=O)C2=CCCC2)[C@H]1CNCc1ccc(C#N)s1	ZINC001036535581	1343542956	/nfs/dbraw/zinc/54/29/56/1343542956.db2.gz	XJJXSQXZTMKAFA-KSSFIOAISA-N	0	3	343.496	3.447	20	30		EGEDHN
CCC(=O)N1CC[C@H]2[C@@H](CCN2CC#Cc2ccc(Cl)cc2)C1	ZINC001036609026	1343572926	/nfs/dbraw/zinc/57/29/26/1343572926.db2.gz	UGAOQPLHLQHFRG-WMZOPIPTSA-N	0	3	330.859	3.024	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@H]2[C@H](CCN2CC#Cc2ccc(F)cc2)C1	ZINC001036632901	1343590491	/nfs/dbraw/zinc/59/04/91/1343590491.db2.gz	UHSBOEDZJOFKIZ-QUCCMNQESA-N	0	3	340.442	3.066	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3CN(C(=O)CCC4CC4)CC[C@H]32)s1	ZINC001036670500	1343613627	/nfs/dbraw/zinc/61/36/27/1343613627.db2.gz	VHIZOHPFLDXGOW-MAUKXSAKSA-N	0	3	343.496	3.233	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@@H]2CN(C(=O)C3(C4CC4)CC3)CC[C@@H]21	ZINC001036745021	1343670076	/nfs/dbraw/zinc/67/00/76/1343670076.db2.gz	RYKOTNNGSGQYKO-QUCCMNQESA-N	0	3	349.478	3.171	20	30		EGEDHN
CC1(C(=O)N2CC[C@H]3[C@@H](CCN3Cc3ccccc3C#N)C2)CCC1	ZINC001036791972	1343722887	/nfs/dbraw/zinc/72/28/87/1343722887.db2.gz	IGEYAAKXIHIMFQ-OALUTQOASA-N	0	3	337.467	3.171	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2[C@H](CCN2Cc2conc2CC)C1	ZINC001036794265	1343726875	/nfs/dbraw/zinc/72/68/75/1343726875.db2.gz	RSTOOXWUAVOKOJ-QAPCUYQASA-N	0	3	345.487	3.262	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccccc2C#N)C1	ZINC001036804190	1343738895	/nfs/dbraw/zinc/73/88/95/1343738895.db2.gz	FTSHETHYLDFJTC-RTBURBONSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]3[C@@H](CCN3Cc3cnc(C)s3)C2)C1	ZINC001036815337	1343752569	/nfs/dbraw/zinc/75/25/69/1343752569.db2.gz	CJRHUXWTPLZNQV-RDJZCZTQSA-N	0	3	345.512	3.231	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]3[C@@H](CCN3CC#Cc3ccccc3)C2)C1	ZINC001036815250	1343752794	/nfs/dbraw/zinc/75/27/94/1343752794.db2.gz	BGMCQBBQLCNBIO-SFTDATJTSA-N	0	3	348.490	3.317	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@H]1CCC[C@H]1NC(=O)C1CCCC1	ZINC001036921778	1343865636	/nfs/dbraw/zinc/86/56/36/1343865636.db2.gz	HWUXAKGRERFQRX-VQIMIIECSA-N	0	3	343.446	3.262	20	30		EGEDHN
CC[C@@H]1CN(C(=O)C(C)C)CC[C@H]1NCc1cc(F)ccc1C#N	ZINC001037781919	1344093176	/nfs/dbraw/zinc/09/31/76/1344093176.db2.gz	AYJQRXSWCKTICA-RDTXWAMCSA-N	0	3	331.435	3.070	20	30		EGEDHN
CC[C@H]1CN(C(=O)C#CC2CC2)CC[C@H]1NCc1c(F)cccc1F	ZINC001037839870	1344130287	/nfs/dbraw/zinc/13/02/87/1344130287.db2.gz	OMPXRJAYULBIEB-HNAYVOBHSA-N	0	3	346.421	3.095	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1ccnc(O[C@H](C)CC)c1	ZINC001038895405	1344637775	/nfs/dbraw/zinc/63/77/75/1344637775.db2.gz	VJMSIDPQRFMWFH-NVXWUHKLSA-N	0	3	331.460	3.029	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCN2CC2CCC(C)(C)CC2)nc1	ZINC001038934055	1344660319	/nfs/dbraw/zinc/66/03/19/1344660319.db2.gz	ZTJOYUFDUIBYPC-GOSISDBHSA-N	0	3	339.483	3.083	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H]2C[C@H]2CCC)CC[C@H]1c1ccc(F)cc1	ZINC001079158201	1357198570	/nfs/dbraw/zinc/19/85/70/1357198570.db2.gz	XGWXRAWTPSMBCB-GSEOLPGOSA-N	0	3	342.458	3.169	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1cc(Cl)cc2c1OCC2	ZINC001039056792	1344739734	/nfs/dbraw/zinc/73/97/34/1344739734.db2.gz	LHHNBNYNPQJWND-HNNXBMFYSA-N	0	3	334.847	3.045	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1ccc(N(C)CCC)cc1	ZINC001039078493	1344759054	/nfs/dbraw/zinc/75/90/54/1344759054.db2.gz	MDDYNBKRGXUIBE-IBGZPJMESA-N	0	3	329.488	3.303	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)[C@@H]3C[C@H]3C3CC3)CC2)C1	ZINC001039160007	1344844894	/nfs/dbraw/zinc/84/48/94/1344844894.db2.gz	DKEVEUMCDICUQG-OKZBNKHCSA-N	0	3	336.907	3.346	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccsc2C)C1	ZINC001039199682	1344909531	/nfs/dbraw/zinc/90/95/31/1344909531.db2.gz	BYGPILMVBYTGJM-SJLPKXTDSA-N	0	3	330.497	3.396	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2sccc2Cl)C1	ZINC001039212984	1344928510	/nfs/dbraw/zinc/92/85/10/1344928510.db2.gz	ZJIQDJIIPKDVJC-DZGCQCFKSA-N	0	3	336.888	3.351	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cccc(F)c2C)C1	ZINC001039212971	1344928531	/nfs/dbraw/zinc/92/85/31/1344928531.db2.gz	ZDTLYAOTIFNHAI-YLJYHZDGSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(Cl)cc2F)C1	ZINC001039216449	1344933011	/nfs/dbraw/zinc/93/30/11/1344933011.db2.gz	OXJXYPIFLOMVIN-RDTXWAMCSA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccoc2CC)C1	ZINC001039221317	1344938683	/nfs/dbraw/zinc/93/86/83/1344938683.db2.gz	NQLFXRMTDRUFMO-WMZOPIPTSA-N	0	3	328.456	3.182	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccoc2CC)C1	ZINC001039221316	1344938971	/nfs/dbraw/zinc/93/89/71/1344938971.db2.gz	NQLFXRMTDRUFMO-SJLPKXTDSA-N	0	3	328.456	3.182	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ncc(C)cc2C)C1	ZINC001039228640	1344948772	/nfs/dbraw/zinc/94/87/72/1344948772.db2.gz	KIRFEFMDUUILKF-MOPGFXCFSA-N	0	3	339.483	3.038	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ncc(C)cc2C)C1	ZINC001039228642	1344948811	/nfs/dbraw/zinc/94/88/11/1344948811.db2.gz	KIRFEFMDUUILKF-RBUKOAKNSA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)Cc2cc(C)ccc2C)C1	ZINC001039228945	1344948920	/nfs/dbraw/zinc/94/89/20/1344948920.db2.gz	KKBMNJLDDCGZTE-CTNGQTDRSA-N	0	3	338.495	3.182	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2oc(CC)cc2C)C1	ZINC001039242290	1344968655	/nfs/dbraw/zinc/96/86/55/1344968655.db2.gz	AOTADEMKXLYTDZ-AEFFLSMTSA-N	0	3	328.456	3.100	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cccn2C(C)C)C1	ZINC001039242752	1344969782	/nfs/dbraw/zinc/96/97/82/1344969782.db2.gz	QTZSYURPHFPCNN-MSOLQXFVSA-N	0	3	327.472	3.019	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccccc2OC)C1	ZINC001039244319	1344972074	/nfs/dbraw/zinc/97/20/74/1344972074.db2.gz	IDCQCJRDTGOFQV-IEBWSBKVSA-N	0	3	340.467	3.035	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)C2CC3(CCC3)C2)C1	ZINC001039244735	1344972975	/nfs/dbraw/zinc/97/29/75/1344972975.db2.gz	MCIVUBAGTOSYKT-PKOBYXMFSA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccccc2Cl)C1	ZINC001039247000	1344976042	/nfs/dbraw/zinc/97/60/42/1344976042.db2.gz	SOAVLCQVGMOKBY-YJBOKZPZSA-N	0	3	330.859	3.290	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(F)c(Cl)c2)C1	ZINC001039246547	1344976299	/nfs/dbraw/zinc/97/62/99/1344976299.db2.gz	SOWOLNYUUVCUHK-CRAIPNDOSA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2sc(C)nc2C)C1	ZINC001039250520	1344981427	/nfs/dbraw/zinc/98/14/27/1344981427.db2.gz	OQHUGLGDPYVRMU-DLBZAZTESA-N	0	3	345.512	3.100	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)Cc2sc(C)cc2C)C1	ZINC001039250565	1344981968	/nfs/dbraw/zinc/98/19/68/1344981968.db2.gz	PLFUGKBWJAEZGS-QZTJIDSGSA-N	0	3	344.524	3.244	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H]1Cc2ccccc2O1	ZINC001039379779	1345035434	/nfs/dbraw/zinc/03/54/34/1345035434.db2.gz	IFZCVTNFENKJAT-QYZOEREBSA-N	0	3	340.467	3.022	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cnc2n1[C@H](C)CCC2	ZINC001039380001	1345036230	/nfs/dbraw/zinc/03/62/30/1345036230.db2.gz	GKNOGAILWKLMJF-ZACQAIPSSA-N	0	3	342.487	3.035	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1c(C)cccc1C	ZINC001039382370	1345037282	/nfs/dbraw/zinc/03/72/82/1345037282.db2.gz	FSGBXQGZXKYEEY-MOPGFXCFSA-N	0	3	326.484	3.487	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccc(C(F)F)c1	ZINC001039403875	1345049488	/nfs/dbraw/zinc/04/94/88/1345049488.db2.gz	UXRBCKNHJCTYKK-SJORKVTESA-N	0	3	334.410	3.418	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@](C)(OC)c1ccccc1	ZINC001039460578	1345079023	/nfs/dbraw/zinc/07/90/23/1345079023.db2.gz	WYBXGRFTSSBVOB-DYXWJJEUSA-N	0	3	342.483	3.190	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2ccccc2n1	ZINC001039461704	1345080157	/nfs/dbraw/zinc/08/01/57/1345080157.db2.gz	FXPRSNZPHSCSIU-MSOLQXFVSA-N	0	3	335.451	3.490	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C1CCC(C2CC2)CC1	ZINC001039465192	1345083108	/nfs/dbraw/zinc/08/31/08/1345083108.db2.gz	SIGFXYKCYMJZAC-TUNPWDSISA-N	0	3	328.500	3.291	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(C)nc2ccccc21	ZINC001039466521	1345083990	/nfs/dbraw/zinc/08/39/90/1345083990.db2.gz	QBLMNYWLCLQRBN-MSOLQXFVSA-N	0	3	347.462	3.245	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)CCc1cc(F)ccc1F	ZINC001039474525	1345088924	/nfs/dbraw/zinc/08/89/24/1345088924.db2.gz	MIRPUIPDBHWJKU-SJORKVTESA-N	0	3	334.410	3.149	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(OC(C)C)cn1	ZINC001039479962	1345094040	/nfs/dbraw/zinc/09/40/40/1345094040.db2.gz	YDMKZNHQTURIQP-SJORKVTESA-N	0	3	343.471	3.124	20	30		EGEDHN
CC(C)(F)C(=O)N1CC[C@@]2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001040037533	1345302942	/nfs/dbraw/zinc/30/29/42/1345302942.db2.gz	AVMKQDZWRMHOHU-FQEVSTJZSA-N	0	3	343.446	3.121	20	30		EGEDHN
CC1(C(=O)N2CC[C@@]3(C2)CCCN(Cc2ccc(C#N)cc2)C3)CC1	ZINC001040223400	1345382285	/nfs/dbraw/zinc/38/22/85/1345382285.db2.gz	MKQQGXLXGPLAIX-NRFANRHFSA-N	0	3	337.467	3.173	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(C(C)C)nc3)C2)C1	ZINC001040239928	1345390049	/nfs/dbraw/zinc/39/00/49/1345390049.db2.gz	AZUXLYCILGEBQA-OAQYLSRUSA-N	0	3	339.483	3.156	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3ccc(C(C)C)nc3)C2)C1	ZINC001040242159	1345392980	/nfs/dbraw/zinc/39/29/80/1345392980.db2.gz	WSMVSOYROATJPR-FQEVSTJZSA-N	0	3	327.472	3.319	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3c(C)[nH]c4ccccc43)C2)C1	ZINC001040282378	1345410452	/nfs/dbraw/zinc/41/04/52/1345410452.db2.gz	IIXFFTIBYYZKFJ-QFIPXVFZSA-N	0	3	349.478	3.428	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cccc4cccnc43)C2)C1	ZINC001040284070	1345411219	/nfs/dbraw/zinc/41/12/19/1345411219.db2.gz	SFJQQWVIGNVUME-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@]2(C1)CCCN(Cc1scnc1C)C2	ZINC001040328043	1345434883	/nfs/dbraw/zinc/43/48/83/1345434883.db2.gz	JKGKSNGKZDPBOQ-IBGZPJMESA-N	0	3	347.528	3.478	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@]2(C1)CCCN(Cc1cncc(C)c1)C2	ZINC001040328425	1345434981	/nfs/dbraw/zinc/43/49/81/1345434981.db2.gz	LZSPPKHBIOYNNU-OAQYLSRUSA-N	0	3	341.499	3.417	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3c(C)cc(F)cc3C)C2)C1	ZINC001040330261	1345435611	/nfs/dbraw/zinc/43/56/11/1345435611.db2.gz	BABPRVUNLAEPST-NRFANRHFSA-N	0	3	342.458	3.394	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CC[C@]2(C1)CCCN(Cc1cccc(C#N)c1)C2	ZINC001040337543	1345440741	/nfs/dbraw/zinc/44/07/41/1345440741.db2.gz	NEZJLIGIGDUPRK-UYAOXDASSA-N	0	3	343.446	3.121	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@H](C)c3cc(C)oc3C)C2)C1	ZINC001040451599	1345507490	/nfs/dbraw/zinc/50/74/90/1345507490.db2.gz	GBJJVYZSHZMWKE-DYESRHJHSA-N	0	3	342.483	3.338	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3[nH]c4ccc(C)cc4c3C)C2)C1	ZINC001040476918	1345512663	/nfs/dbraw/zinc/51/26/63/1345512663.db2.gz	BAOUOSJAONRIIK-QFIPXVFZSA-N	0	3	349.478	3.346	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ccc4ccccc4n3)C2)C1	ZINC001040504248	1345524037	/nfs/dbraw/zinc/52/40/37/1345524037.db2.gz	XURFVUCGOSHJCO-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3cc(C)nc4ccccc43)C2)C1	ZINC001040515891	1345529112	/nfs/dbraw/zinc/52/91/12/1345529112.db2.gz	PFUFTNQLSOIZOD-JOCHJYFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3cc(C)n(C(C)C)c3C)C2)C1	ZINC001040522090	1345531883	/nfs/dbraw/zinc/53/18/83/1345531883.db2.gz	IKMIRMMKGBPPRO-OAQYLSRUSA-N	0	3	341.499	3.247	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccc4cc(C)cn4c3)C2)CC1	ZINC001040722030	1345570626	/nfs/dbraw/zinc/57/06/26/1345570626.db2.gz	JDEFVYYDRJTBKD-UHFFFAOYSA-N	0	3	349.478	3.199	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)Cc3c(C)cccc3Cl)C2)CC1	ZINC001040761405	1345575731	/nfs/dbraw/zinc/57/57/31/1345575731.db2.gz	VUKQOWOZNKHTSN-UHFFFAOYSA-N	0	3	344.886	3.139	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@H]3CCCCC3(F)F)C2)CC1	ZINC001040790198	1345577828	/nfs/dbraw/zinc/57/78/28/1345577828.db2.gz	QTKPVNIPIPOABJ-MRXNPFEDSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3c(F)ccc(C)c3F)C2)CC1	ZINC001040831983	1345584521	/nfs/dbraw/zinc/58/45/21/1345584521.db2.gz	YYSCWLYQYQTJSC-UHFFFAOYSA-N	0	3	346.421	3.225	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cc4cc(F)ccc4o3)C2)CC1	ZINC001040869933	1345590715	/nfs/dbraw/zinc/59/07/15/1345590715.db2.gz	AKRROLPEBYSITM-UHFFFAOYSA-N	0	3	340.398	3.133	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccc(Cl)cc3)C2)CC1	ZINC001040920484	1345600726	/nfs/dbraw/zinc/60/07/26/1345600726.db2.gz	XLRRKMDYVKIDSM-UHFFFAOYSA-N	0	3	330.859	3.291	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3c(F)cccc3Cl)C2)CC1	ZINC001040923833	1345601731	/nfs/dbraw/zinc/60/17/31/1345601731.db2.gz	QFQNXMFCNWAWCY-UHFFFAOYSA-N	0	3	334.822	3.040	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001041020877	1345623939	/nfs/dbraw/zinc/62/39/39/1345623939.db2.gz	APCIWKABHXYRIG-FQEVSTJZSA-N	0	3	325.456	3.029	20	30		EGEDHN
C=CCN1CC[C@@]2(CCN(C(=O)c3nc(C(C)(C)C)cs3)C2)C1	ZINC001041382068	1345713275	/nfs/dbraw/zinc/71/32/75/1345713275.db2.gz	UJJUMACWXDFKDJ-GOSISDBHSA-N	0	3	333.501	3.165	20	30		EGEDHN
C=CCN1CC[C@]2(CCN(C(=O)c3nc(Cl)sc3Cl)C2)C1	ZINC001041539462	1345756740	/nfs/dbraw/zinc/75/67/40/1345756740.db2.gz	HDAXODPMBRYBQT-AWEZNQCLSA-N	0	3	346.283	3.174	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001041543931	1345758656	/nfs/dbraw/zinc/75/86/56/1345758656.db2.gz	LXVQYIFPBNUFQO-NRFANRHFSA-N	0	3	337.467	3.195	20	30		EGEDHN
C[C@]1(C(=O)N2CC[C@]3(CCN(Cc4cccc(C#N)c4)C3)C2)C=CCC1	ZINC001041557045	1345766871	/nfs/dbraw/zinc/76/68/71/1345766871.db2.gz	CUDFNGLAUNDKHZ-VXKWHMMOSA-N	0	3	349.478	3.339	20	30		EGEDHN
CCC1(C(=O)N2CC[C@@]3(CCN(Cc4ccc(C#N)cc4)C3)C2)CC1	ZINC001041643886	1345808725	/nfs/dbraw/zinc/80/87/25/1345808725.db2.gz	YSLRSDKZBCXPFY-HXUWFJFHSA-N	0	3	337.467	3.173	20	30		EGEDHN
CC(F)(F)CC(=O)N1CC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001041647058	1345809227	/nfs/dbraw/zinc/80/92/27/1345809227.db2.gz	WBYVPJXPVPPHSK-IBGZPJMESA-N	0	3	347.409	3.028	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cccc(F)c3Cl)C2)C1	ZINC001041710225	1345826425	/nfs/dbraw/zinc/82/64/25/1345826425.db2.gz	LJQICWPNJQHTBB-SFHVURJKSA-N	0	3	334.822	3.040	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)C(C)(C)c3cccc(Cl)c3)C2)C1	ZINC001041717025	1345829146	/nfs/dbraw/zinc/82/91/46/1345829146.db2.gz	JIVZZKXTMAXNMN-HXUWFJFHSA-N	0	3	344.886	3.175	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)[C@@]3(C)C[C@@H]3c3ccccc3)C2)C1	ZINC001041733714	1345834990	/nfs/dbraw/zinc/83/49/90/1345834990.db2.gz	CIIHCGHUTWVJHH-BAGYTPMASA-N	0	3	336.479	3.128	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cccc(C)c3Cl)C2)C1	ZINC001041745026	1345838836	/nfs/dbraw/zinc/83/88/36/1345838836.db2.gz	PBEQTVLAEKPELQ-LJQANCHMSA-N	0	3	330.859	3.210	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3sccc3C(F)F)C2)C1	ZINC001041808770	1345857967	/nfs/dbraw/zinc/85/79/67/1345857967.db2.gz	AJDRFFTVKDLBTQ-QGZVFWFLSA-N	0	3	338.423	3.247	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)[C@H](C)c3ccc(F)c(F)c3)C2)C1	ZINC001041838820	1345868193	/nfs/dbraw/zinc/86/81/93/1345868193.db2.gz	CFMSEEFHNQNJMO-QRWLVFNGSA-N	0	3	346.421	3.016	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)C34CC(c5ccccc5)(C3)C4)C2)C1	ZINC001041847730	1345872656	/nfs/dbraw/zinc/87/26/56/1345872656.db2.gz	CTIQDYGDBPYGDI-DDRJZQQSSA-N	0	3	348.490	3.056	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@H]2C1	ZINC001041902567	1345888627	/nfs/dbraw/zinc/88/86/27/1345888627.db2.gz	AXWHPRKFBAVPLZ-OALUTQOASA-N	0	3	325.456	3.027	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3cc4c(o3)CCCC4)C[C@@H]21	ZINC001042090295	1345941459	/nfs/dbraw/zinc/94/14/59/1345941459.db2.gz	JGULZILWAFFNII-WBVHZDCISA-N	0	3	328.456	3.271	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)Cc3ccc(C)cc3Cl)C[C@@H]21	ZINC001042119797	1345949130	/nfs/dbraw/zinc/94/91/30/1345949130.db2.gz	JQIMOUGJRWVXBE-LPHOPBHVSA-N	0	3	344.886	3.137	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)Cc3ccc(CCCC)cc3)C[C@@H]21	ZINC001042138681	1345953900	/nfs/dbraw/zinc/95/39/00/1345953900.db2.gz	RHNXQRIEARDRTH-RTWAWAEBSA-N	0	3	338.495	3.128	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3nc4ccccc4cc3C)C[C@@H]21	ZINC001042155820	1345958527	/nfs/dbraw/zinc/95/85/27/1345958527.db2.gz	NJBYITOABKFVQC-LPHOPBHVSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(C)c4cccnc34)C[C@H]21	ZINC001042155802	1345958593	/nfs/dbraw/zinc/95/85/93/1345958593.db2.gz	NARVCESKLJTYDZ-VQIMIIECSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(C)nc3C(C)C)C[C@H]21	ZINC001042167740	1345963680	/nfs/dbraw/zinc/96/36/80/1345963680.db2.gz	NIBINKYOEZHXHB-SJLPKXTDSA-N	0	3	327.472	3.236	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C3(c4cccc(F)c4)CCC3)C[C@@H]21	ZINC001042177549	1345968328	/nfs/dbraw/zinc/96/83/28/1345968328.db2.gz	WVORELYKXNEYIE-LPHOPBHVSA-N	0	3	342.458	3.356	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C(C3CCC3)C3CCC3)C[C@H]21	ZINC001042201770	1345981840	/nfs/dbraw/zinc/98/18/40/1345981840.db2.gz	QOLKEQSAQLGTBE-VQIMIIECSA-N	0	3	328.500	3.149	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc4cccc(OC)c4o3)C[C@H]21	ZINC001042202182	1345982221	/nfs/dbraw/zinc/98/22/21/1345982221.db2.gz	XGKCOUJQMXSQSD-GDBMZVCRSA-N	0	3	340.423	3.164	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)c3ccc(C)c4ccccc34)C[C@H]21	ZINC001042246184	1346003501	/nfs/dbraw/zinc/00/35/01/1346003501.db2.gz	CGJFRPWBHGCNMO-DYESRHJHSA-N	0	3	332.447	3.318	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc4cc(F)ccc4o3)C[C@@H]21	ZINC001042251753	1346006648	/nfs/dbraw/zinc/00/66/48/1346006648.db2.gz	GPGAADIUYPNTSZ-CJNGLKHVSA-N	0	3	328.387	3.294	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3sc(C)cc3OC)C[C@H]21	ZINC001042260217	1346009039	/nfs/dbraw/zinc/00/90/39/1346009039.db2.gz	UJEDALCJOUCVAV-LSDHHAIUSA-N	0	3	334.485	3.178	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cccn3C3CCCC3)C[C@@H]21	ZINC001042291547	1346019885	/nfs/dbraw/zinc/01/98/85/1346019885.db2.gz	ZBFUHFQHELMWKV-LPHOPBHVSA-N	0	3	327.472	3.326	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3ncoc3C(C)(C)C)C[C@@H]21	ZINC001042307165	1346025876	/nfs/dbraw/zinc/02/58/76/1346025876.db2.gz	MKUGTSXLFLIVGE-GJZGRUSLSA-N	0	3	331.460	3.085	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccsc3C(F)(F)F)C[C@H]21	ZINC001042325998	1346035424	/nfs/dbraw/zinc/03/54/24/1346035424.db2.gz	KWFIZZHRRMCDMS-DGCLKSJQSA-N	0	3	344.402	3.489	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(OC4CCC4)cc3)C[C@H]21	ZINC001042362309	1346055979	/nfs/dbraw/zinc/05/59/79/1346055979.db2.gz	JJYQUEVEZUKALE-OXJNMPFZSA-N	0	3	340.467	3.340	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2cc(F)ccc2C#N)CCN1C(=O)c1ccco1	ZINC001044425886	1346325846	/nfs/dbraw/zinc/32/58/46/1346325846.db2.gz	PUVBCLTYHHAAFR-CXAGYDPISA-N	0	3	341.386	3.073	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@@H](NCc2ccccc2C#N)C[C@H]1C	ZINC001044541402	1346364423	/nfs/dbraw/zinc/36/44/23/1346364423.db2.gz	CLCAGPFFAAUXHQ-RHSMWYFYSA-N	0	3	329.419	3.291	20	30		EGEDHN
C[C@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)C1CC(C)(C)C1	ZINC001044581050	1346374083	/nfs/dbraw/zinc/37/40/83/1346374083.db2.gz	HYRFIOUEHGJGPE-HNAYVOBHSA-N	0	3	339.483	3.464	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)C2CCCCC2)cc1F	ZINC001044904033	1346458923	/nfs/dbraw/zinc/45/89/23/1346458923.db2.gz	HGPSGIPAWRHVIZ-SFHVURJKSA-N	0	3	343.446	3.358	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@H]1CNCc1cccc(Cl)c1Cl	ZINC001044961004	1346470310	/nfs/dbraw/zinc/47/03/10/1346470310.db2.gz	KWCDXNODQYHOGR-YPMHNXCESA-N	0	3	340.254	3.234	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)C2CC3(CCC3)C2)s1	ZINC001045162956	1346512252	/nfs/dbraw/zinc/51/22/52/1346512252.db2.gz	XRCSNPGDJLQNJO-HNNXBMFYSA-N	0	3	343.496	3.281	20	30		EGEDHN
C=C[C@@H](C(=O)N1CCC[C@H]1CNCc1ccccn1)c1ccccc1	ZINC001045320831	1346559300	/nfs/dbraw/zinc/55/93/00/1346559300.db2.gz	ZUIHPWVBKPFHSH-VQTJNVASSA-N	0	3	335.451	3.132	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)[C@@H]2CC[C@H](c3ccccc3)O2)CC1	ZINC001045441447	1346594421	/nfs/dbraw/zinc/59/44/21/1346594421.db2.gz	GBCSXINREXFKON-MSOLQXFVSA-N	0	3	328.456	3.063	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2ccnc(-c3ccco3)c2)CC1	ZINC001045472123	1346602155	/nfs/dbraw/zinc/60/21/55/1346602155.db2.gz	BWFZDCBOJSKKMC-UHFFFAOYSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)[C@@H]2C[C@H]2c2ccc(N(C)C)cc2)CC1	ZINC001045508777	1346613214	/nfs/dbraw/zinc/61/32/14/1346613214.db2.gz	SYFJGEOKZMEFPG-RBUKOAKNSA-N	0	3	341.499	3.013	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)C2CC(c3cccc(F)c3)C2)CC1	ZINC001045650393	1346659794	/nfs/dbraw/zinc/65/97/94/1346659794.db2.gz	XDLZKZUKMXDXOI-UHFFFAOYSA-N	0	3	330.447	3.476	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1csc(C)c1C)C2	ZINC001045940492	1346776281	/nfs/dbraw/zinc/77/62/81/1346776281.db2.gz	ZTENEBRKLVXRJW-LJQANCHMSA-N	0	3	330.497	3.316	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@H]1CCC(C)=C(C)C1)C2	ZINC001045940189	1346776600	/nfs/dbraw/zinc/77/66/00/1346776600.db2.gz	RXODLZQPCJDDTC-FPOVZHCZSA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)Cc1c(C)cccc1C)C2	ZINC001045941599	1346777282	/nfs/dbraw/zinc/77/72/82/1346777282.db2.gz	LKMMRNUOVCHMRP-QFIPXVFZSA-N	0	3	338.495	3.184	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc(C)nc(C)c1)C2	ZINC001045941950	1346778108	/nfs/dbraw/zinc/77/81/08/1346778108.db2.gz	PIVFDVGLLGBALX-OAQYLSRUSA-N	0	3	339.483	3.040	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccnc3ccccc31)C2	ZINC001045951280	1346786233	/nfs/dbraw/zinc/78/62/33/1346786233.db2.gz	WDCFVBTZJSXWRX-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H]1C[C@H]1C(C)(C)C)C2	ZINC001045953400	1346788578	/nfs/dbraw/zinc/78/85/78/1346788578.db2.gz	YNEMPTWOGVZFKL-OPYAIIAOSA-N	0	3	330.516	3.397	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@@]2(CCN(Cc3ocnc3C)C2)C1	ZINC001045957827	1346793010	/nfs/dbraw/zinc/79/30/10/1346793010.db2.gz	GIYHNXZPIIDTLT-FQEVSTJZSA-N	0	3	345.487	3.400	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc(F)c(C)c1)C2	ZINC001045960766	1346796602	/nfs/dbraw/zinc/79/66/02/1346796602.db2.gz	SAELPZJRBCUEFL-NRFANRHFSA-N	0	3	342.458	3.476	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccn(CC)c1C)C2	ZINC001045961463	1346796923	/nfs/dbraw/zinc/79/69/23/1346796923.db2.gz	PGUWHCNYARCNQM-NRFANRHFSA-N	0	3	341.499	3.158	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@H](F)c1ccccc1)C2	ZINC001045972362	1346808517	/nfs/dbraw/zinc/80/85/17/1346808517.db2.gz	ZBXUCGUJXPFMJH-UYAOXDASSA-N	0	3	328.431	3.035	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@H](F)c1ccccc1)C2	ZINC001045972361	1346808577	/nfs/dbraw/zinc/80/85/77/1346808577.db2.gz	ZBXUCGUJXPFMJH-QUCCMNQESA-N	0	3	328.431	3.035	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@H](C)Cc1ccco1)C2	ZINC001045972374	1346808619	/nfs/dbraw/zinc/80/86/19/1346808619.db2.gz	ZHAFYRFWMIUXFK-WIYYLYMNSA-N	0	3	342.483	3.186	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)C1(F)CCCCC1)C2	ZINC001045977352	1346813630	/nfs/dbraw/zinc/81/36/30/1346813630.db2.gz	BJYLNJULPYRXOQ-LJQANCHMSA-N	0	3	334.479	3.387	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H]1C[C@H]1c1ccccc1)C2	ZINC001045980715	1346818130	/nfs/dbraw/zinc/81/81/30/1346818130.db2.gz	HMDHDLKXDOJWKT-TUNNFDKTSA-N	0	3	336.479	3.128	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cccc(Cl)c1)C2	ZINC001045980779	1346818228	/nfs/dbraw/zinc/81/82/28/1346818228.db2.gz	JFVCDLQMJPRGTM-IBGZPJMESA-N	0	3	330.859	3.291	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1c(F)cccc1Cl)C2	ZINC001045980888	1346819004	/nfs/dbraw/zinc/81/90/04/1346819004.db2.gz	LVKBDGGPRQAXSQ-LJQANCHMSA-N	0	3	348.849	3.431	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc(Cl)cn1CC)C2	ZINC001045985282	1346826404	/nfs/dbraw/zinc/82/64/04/1346826404.db2.gz	QJEOTIZSRPDXJI-LJQANCHMSA-N	0	3	347.890	3.113	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H](C)c1ccccc1C)C2	ZINC001045985656	1346826835	/nfs/dbraw/zinc/82/68/35/1346826835.db2.gz	ZCTIDYZEXFISJX-UGKGYDQZSA-N	0	3	338.495	3.436	20	30		EGEDHN
C=CCCN1CC[C@@](C)(NC(=O)c2snc(Cl)c2Cl)C1	ZINC001046354038	1346946941	/nfs/dbraw/zinc/94/69/41/1346946941.db2.gz	BINHVQPRFILREE-CYBMUJFWSA-N	0	3	334.272	3.220	20	30		EGEDHN
C#CCCN1CC[C@@](C)(NC(=O)c2[nH]c3ccccc3c2Cl)C1	ZINC001046444750	1346976719	/nfs/dbraw/zinc/97/67/19/1346976719.db2.gz	VEEJCITZPNTDTH-GOSISDBHSA-N	0	3	329.831	3.039	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2coc3ccc(OC)cc23)C1	ZINC001046474181	1346987385	/nfs/dbraw/zinc/98/73/85/1346987385.db2.gz	RTKFZGZQERTAHQ-IBGZPJMESA-N	0	3	328.412	3.212	20	30		EGEDHN
C#CCCN1CC[C@@](C)(NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2)C1	ZINC001046695736	1347065742	/nfs/dbraw/zinc/06/57/42/1347065742.db2.gz	QKTCJIVHEWTPIY-YQVWRLOYSA-N	0	3	330.859	3.047	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2cc(C)n(CC3CC3)c2C)C1	ZINC001046772355	1347094035	/nfs/dbraw/zinc/09/40/35/1347094035.db2.gz	CSGSDHMNFWNWIA-FQEVSTJZSA-N	0	3	329.488	3.285	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2cc[nH]c2C(C)C)C1	ZINC001046965430	1347169018	/nfs/dbraw/zinc/16/90/18/1347169018.db2.gz	ARZMVDYMQMGCLG-AWEZNQCLSA-N	0	3	339.430	3.401	20	30		EGEDHN
Cc1ccoc1C(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1ccccc1)C2	ZINC001047027840	1347191503	/nfs/dbraw/zinc/19/15/03/1347191503.db2.gz	YOJVPTWZYALBQY-UFYCRDLUSA-N	0	3	348.446	3.222	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@H]3C[C@@H](C2)N(Cc2conc2C)C3)CC1	ZINC001047139460	1347217918	/nfs/dbraw/zinc/21/79/18/1347217918.db2.gz	VMJDEHBIKWSQOI-SNRMKQJTSA-N	0	3	343.471	3.199	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)N(Cc2oc(C)nc2C)C3)C1	ZINC001047144392	1347219659	/nfs/dbraw/zinc/21/96/59/1347219659.db2.gz	ZYBWDFHJBAREAW-BBWFWOEESA-N	0	3	343.471	3.117	20	30		EGEDHN
CC(C)(C)C(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(Cc1ccc(C#N)s1)C2	ZINC001047187603	1347235363	/nfs/dbraw/zinc/23/53/63/1347235363.db2.gz	DYBHMSDXTNQDMS-IHRRRGAJSA-N	0	3	331.485	3.135	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)C(C)=C3CCCC3)C2)CC1	ZINC001047231728	1347260559	/nfs/dbraw/zinc/26/05/59/1347260559.db2.gz	GHXPDSSQNLNLDY-HXUWFJFHSA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3cc(F)ccc3C)C2)CC1	ZINC001047247517	1347272754	/nfs/dbraw/zinc/27/27/54/1347272754.db2.gz	JNBSXHHNUJNPDH-GOSISDBHSA-N	0	3	342.458	3.332	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)[C@@]3(C)C=CCC3)C2)CC1	ZINC001047251123	1347275859	/nfs/dbraw/zinc/27/58/59/1347275859.db2.gz	GDCOFPDPXSSSDS-FPOVZHCZSA-N	0	3	328.500	3.317	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)c3cocc3C)C2)CC1	ZINC001047251168	1347276246	/nfs/dbraw/zinc/27/62/46/1347276246.db2.gz	GNFFYBTWTIEDIH-SFHVURJKSA-N	0	3	328.456	3.176	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@H]3CC[C@@H]4C[C@@H]4CC3)C2)CC1	ZINC001047251652	1347276540	/nfs/dbraw/zinc/27/65/40/1347276540.db2.gz	UPPJIXQSTRGMFQ-PLACYPQZSA-N	0	3	342.527	3.397	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H](C3CCN(CC#CC)CC3)C2)C1	ZINC001047254708	1347278748	/nfs/dbraw/zinc/27/87/48/1347278748.db2.gz	QYAOVRSMPGKLEV-IBGZPJMESA-N	0	3	328.500	3.317	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3cc(C)cc(F)c3)C2)CC1	ZINC001047260447	1347282825	/nfs/dbraw/zinc/28/28/25/1347282825.db2.gz	ZWIMZFVXCCUGEY-GOSISDBHSA-N	0	3	342.458	3.332	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)C[C@H](C)C3CC3)C2)CC1	ZINC001047265738	1347286318	/nfs/dbraw/zinc/28/63/18/1347286318.db2.gz	MCJZSGCQZIZZAR-PXNSSMCTSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)CC(C3CC3)C3CC3)C2)CC1	ZINC001047266007	1347286855	/nfs/dbraw/zinc/28/68/55/1347286855.db2.gz	NUEARFLMTMUVRE-FQEVSTJZSA-N	0	3	342.527	3.397	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)C2(C)CCCC2)C1	ZINC001047925320	1347411538	/nfs/dbraw/zinc/41/15/38/1347411538.db2.gz	LTBBVZZIUHZKEJ-QFBILLFUSA-N	0	3	339.483	3.465	20	30		EGEDHN
Cc1ccccc1C(=O)N1C[C@H](C)[C@H](CNCc2ccccc2C#N)C1	ZINC001048116184	1347472104	/nfs/dbraw/zinc/47/21/04/1347472104.db2.gz	DUCPTQPMTLQUKG-FXAWDEMLSA-N	0	3	347.462	3.365	20	30		EGEDHN
C[C@H]1CN(C(=O)C2C=CC=CC=C2)C[C@@H]1CNCc1ccccc1C#N	ZINC001048268713	1347507005	/nfs/dbraw/zinc/50/70/05/1347507005.db2.gz	ZPBDTFILGBWCNA-UWJYYQICSA-N	0	3	347.462	3.041	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H](C)[C@H](CNCc3cscn3)C2)CC1	ZINC001048374996	1347535213	/nfs/dbraw/zinc/53/52/13/1347535213.db2.gz	SZBVEKHPKWOOFX-GOEBONIOSA-N	0	3	333.501	3.074	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CC[C@H](CNCc3ccon3)CC2)CC1	ZINC001048614972	1347619000	/nfs/dbraw/zinc/61/90/00/1347619000.db2.gz	JBNQLAZLRAVTKE-QAQDUYKDSA-N	0	3	345.487	3.433	20	30		EGEDHN
C=C(C)CN1CCC(N(Cc2ccccn2)C(=O)[C@H]2C[C@@H]2C)CC1	ZINC001048625096	1347623687	/nfs/dbraw/zinc/62/36/87/1347623687.db2.gz	LGXNKUQCJRPKFR-LPHOPBHVSA-N	0	3	327.472	3.107	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@@H](CC)C3CCC(C)CC3)C[C@@H]2C1	ZINC001048856755	1347671995	/nfs/dbraw/zinc/67/19/95/1347671995.db2.gz	VBGYHLQOEKXZPP-VWAQSERHSA-N	0	3	330.516	3.252	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C3(CC)CCC(F)(F)CC3)C[C@@H]2C1	ZINC001048899386	1347680101	/nfs/dbraw/zinc/68/01/01/1347680101.db2.gz	OODAHJORQXDIKL-IYBDPMFKSA-N	0	3	338.442	3.006	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CN(Cc3ccccc3F)C[C@H]2C1	ZINC001048974822	1347695155	/nfs/dbraw/zinc/69/51/55/1347695155.db2.gz	GKPZQNHCEYONDJ-CALCHBBNSA-N	0	3	330.447	3.318	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H]3CN(Cc4cccc(C#N)c4)C[C@H]3C2)CC1	ZINC001049024964	1347709249	/nfs/dbraw/zinc/70/92/49/1347709249.db2.gz	ANBZKYCPAQKODC-OYRHEFFESA-N	0	3	349.478	3.195	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc(-c4ccccc4)cc3)C[C@@H]2C1	ZINC001049197695	1347744758	/nfs/dbraw/zinc/74/47/58/1347744758.db2.gz	OYAAJMYADWTGKC-SZPZYZBQSA-N	0	3	344.458	3.381	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049293571	1347775178	/nfs/dbraw/zinc/77/51/78/1347775178.db2.gz	UNZTXUBMLFRXMX-RTBURBONSA-N	0	3	325.456	3.170	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@H]2CCCN3C(=O)c2ccccc2)c1	ZINC001049295241	1347776736	/nfs/dbraw/zinc/77/67/36/1347776736.db2.gz	DGTXBEPIOYKGHY-RTWAWAEBSA-N	0	3	345.446	3.437	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)/C=C/C2CC2)cc1	ZINC001049399889	1347822775	/nfs/dbraw/zinc/82/27/75/1347822775.db2.gz	ZQZOADPKNZMWAC-RMQQFATJSA-N	0	3	335.451	3.090	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@H]2CCCN3C(=O)C=C2CCC2)cc1	ZINC001049410327	1347832688	/nfs/dbraw/zinc/83/26/88/1347832688.db2.gz	AVBWFOVIIGGDTQ-UXHICEINSA-N	0	3	335.451	3.234	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1sccc1C	ZINC001049475338	1347866514	/nfs/dbraw/zinc/86/65/14/1347866514.db2.gz	SZTQXDVFOFXTMV-ZJPYXAASSA-N	0	3	342.508	3.249	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)C[C@@H]1C[C@H]1c1ccccc1	ZINC001049479401	1347869298	/nfs/dbraw/zinc/86/92/98/1347869298.db2.gz	KAWHRPZWDSGNCZ-TUFLPTIASA-N	0	3	336.479	3.269	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1sccc1CN(C)C	ZINC001049510445	1347885133	/nfs/dbraw/zinc/88/51/33/1347885133.db2.gz	GHAYXYJSCZCXEX-IRXDYDNUSA-N	0	3	347.528	3.065	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(C(F)F)nc1	ZINC001049511837	1347885972	/nfs/dbraw/zinc/88/59/72/1347885972.db2.gz	PXLQMNXFHIANKA-JKSUJKDBSA-N	0	3	335.398	3.274	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1conc1C1CCCC1	ZINC001049517657	1347888262	/nfs/dbraw/zinc/88/82/62/1347888262.db2.gz	LPIZRCWUAFFXBB-ROUUACIJSA-N	0	3	341.455	3.034	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1nc(C(C)(C)C)cs1	ZINC001049531235	1347894194	/nfs/dbraw/zinc/89/41/94/1347894194.db2.gz	IPGAHADGAARSCS-HUUCEWRRSA-N	0	3	345.512	3.143	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(C)n([C@@H](C)C2CC2)n1	ZINC001049565027	1347912055	/nfs/dbraw/zinc/91/20/55/1347912055.db2.gz	RNCCQIXRPAQMKD-KFKAGJAMSA-N	0	3	342.487	3.027	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(F)cc2ccoc21	ZINC001049565854	1347912684	/nfs/dbraw/zinc/91/26/84/1347912684.db2.gz	XMUWLGXILQNSJG-IAGOWNOFSA-N	0	3	328.387	3.437	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(COC)cs1	ZINC001049572227	1347915779	/nfs/dbraw/zinc/91/57/79/1347915779.db2.gz	JVOZPIVJSYURFC-HZPDHXFCSA-N	0	3	334.485	3.150	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(C)cc(OC)c1C	ZINC001049572725	1347916081	/nfs/dbraw/zinc/91/60/81/1347916081.db2.gz	NGQQNMJIPNKJNO-ZWKOTPCHSA-N	0	3	328.456	3.177	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cnc2ccccc2c1C	ZINC001049598470	1347930089	/nfs/dbraw/zinc/93/00/89/1347930089.db2.gz	NUVAIGIHKDIFQX-UXHICEINSA-N	0	3	335.451	3.408	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H]2[C@@H]1CCN2CCc1ccns1	ZINC001049632695	1347944568	/nfs/dbraw/zinc/94/45/68/1347944568.db2.gz	ALKGCFLYGGNNOZ-IRXDYDNUSA-N	0	3	347.528	3.353	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]2[C@H]1CCN2Cc1ccc(C)nc1C	ZINC001049633804	1347945741	/nfs/dbraw/zinc/94/57/41/1347945741.db2.gz	BEUWAYGAGMCWDT-RBUKOAKNSA-N	0	3	341.499	3.476	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1cnccc1C	ZINC001049635677	1347946641	/nfs/dbraw/zinc/94/66/41/1347946641.db2.gz	MAVGVDZKDGWULN-MSOLQXFVSA-N	0	3	327.472	3.168	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc2c(c1)[C@@H](C)CO2	ZINC001049665184	1347963976	/nfs/dbraw/zinc/96/39/76/1347963976.db2.gz	UJMWOFHKKPAKMN-BMGDILEWSA-N	0	3	326.440	3.047	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cncc2sccc21	ZINC001049675486	1347967300	/nfs/dbraw/zinc/96/73/00/1347967300.db2.gz	ZRQNSGPXKBMUDG-CVEARBPZSA-N	0	3	327.453	3.161	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1ccc(F)cc1Cl	ZINC001049688286	1347971966	/nfs/dbraw/zinc/97/19/66/1347971966.db2.gz	AAIRCDWBUFALEY-DLBZAZTESA-N	0	3	336.838	3.273	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@H]3[C@H]2CCN3Cc2ccc(C#N)cc2)CC1	ZINC001049694960	1347976760	/nfs/dbraw/zinc/97/67/60/1347976760.db2.gz	GDRCJQYJGORCJT-RBUKOAKNSA-N	0	3	337.467	3.314	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C(C)(C)c1cccc(F)c1	ZINC001049716559	1347988793	/nfs/dbraw/zinc/98/87/93/1347988793.db2.gz	FLGKRPUQKDVNQR-ZWKOTPCHSA-N	0	3	330.447	3.355	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H]1[C@@H]2CCCCCC[C@@H]21	ZINC001049749273	1347998866	/nfs/dbraw/zinc/99/88/66/1347998866.db2.gz	QXXZHLMYJPIYMY-PXTPFGJHSA-N	0	3	328.500	3.291	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C1(c2cccc(F)c2)CC1	ZINC001049762523	1348007803	/nfs/dbraw/zinc/00/78/03/1348007803.db2.gz	PSQIIOWBORUAGL-ZWKOTPCHSA-N	0	3	328.431	3.109	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(Cl)c(OC)c1	ZINC001049762682	1348008099	/nfs/dbraw/zinc/00/80/99/1348008099.db2.gz	RKSJKKZLLSRHRI-HZPDHXFCSA-N	0	3	334.847	3.214	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1cnc(C)nc1C(C)C	ZINC001049768689	1348011124	/nfs/dbraw/zinc/01/11/24/1348011124.db2.gz	YQDKEIGRYAKGIW-MSOLQXFVSA-N	0	3	342.487	3.163	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(F)c2ncccc2c1	ZINC001049789859	1348023316	/nfs/dbraw/zinc/02/33/16/1348023316.db2.gz	IABGQGJTCKXPSC-ROUUACIJSA-N	0	3	339.414	3.239	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](c1cccnc1)C(C)C	ZINC001049806240	1348029181	/nfs/dbraw/zinc/02/91/81/1348029181.db2.gz	NDPSEWJMJVLNJZ-IPMKNSEASA-N	0	3	327.472	3.073	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cccc(F)c1OCC	ZINC001049817204	1348035012	/nfs/dbraw/zinc/03/50/12/1348035012.db2.gz	XHEZFSRSFBETPZ-ZWKOTPCHSA-N	0	3	346.446	3.479	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cnn(CCCC)c1CC	ZINC001049835235	1348048464	/nfs/dbraw/zinc/04/84/64/1348048464.db2.gz	HBAGEHILKNWUNZ-RBUKOAKNSA-N	0	3	344.503	3.111	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C1(c2ccccc2F)CCC1	ZINC001049845784	1348055406	/nfs/dbraw/zinc/05/54/06/1348055406.db2.gz	YGQZCCLCGJPMMB-RTBURBONSA-N	0	3	342.458	3.499	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc2nc(C)ccc2o1	ZINC001049854668	1348061420	/nfs/dbraw/zinc/06/14/20/1348061420.db2.gz	OZIKHVNPOMGAGO-SJORKVTESA-N	0	3	339.439	3.391	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc2c(s1)CCOC2	ZINC001049856513	1348064129	/nfs/dbraw/zinc/06/41/29/1348064129.db2.gz	ZLDXXUNOADXOFM-CVEARBPZSA-N	0	3	346.496	3.076	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1c(F)cccc1Cl	ZINC001049864987	1348071577	/nfs/dbraw/zinc/07/15/77/1348071577.db2.gz	SQJIRPVJUZYRMP-DLBZAZTESA-N	0	3	336.838	3.273	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)CC12CC3CC(CC(C3)C1)C2	ZINC001049866016	1348072561	/nfs/dbraw/zinc/07/25/61/1348072561.db2.gz	XGFSWTGAWQMLBM-GKHXVQBSSA-N	0	3	340.511	3.291	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](C)Oc1ccc(C)cc1	ZINC001049880185	1348085195	/nfs/dbraw/zinc/08/51/95/1348085195.db2.gz	BHSFEMCLZAFOSX-YTQUADARSA-N	0	3	328.456	3.014	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](C)c1ccc(F)c(F)c1	ZINC001049905146	1348103837	/nfs/dbraw/zinc/10/38/37/1348103837.db2.gz	VLLSACNPZGSUOD-JEBQAFNWSA-N	0	3	334.410	3.320	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(F)c2occc21	ZINC001049905820	1348104215	/nfs/dbraw/zinc/10/42/15/1348104215.db2.gz	BFLNMTIBXYPCKN-ZWKOTPCHSA-N	0	3	340.398	3.274	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](F)Cc1ccccc1	ZINC001049912586	1348107897	/nfs/dbraw/zinc/10/78/97/1348107897.db2.gz	MTNWADQSPLBSTE-IPMKNSEASA-N	0	3	330.447	3.209	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(N(C)CC)cc1	ZINC001049928928	1348119270	/nfs/dbraw/zinc/11/92/70/1348119270.db2.gz	WLPVKLQRPAYWFG-RBUKOAKNSA-N	0	3	327.472	3.008	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3nccc4ccsc43)[C@@H]2C1	ZINC001050069918	1348172310	/nfs/dbraw/zinc/17/23/10/1348172310.db2.gz	UOKIDFHICHZSJW-LSDHHAIUSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cccc(-n4cccc4)c3)[C@@H]2C1	ZINC001050087444	1348178201	/nfs/dbraw/zinc/17/82/01/1348178201.db2.gz	JUBRVGNPMAVQDV-AZUAARDMSA-N	0	3	335.451	3.200	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)[C@H](C)OC3CCCCCC3)[C@@H]2C1	ZINC001050137400	1348193247	/nfs/dbraw/zinc/19/32/47/1348193247.db2.gz	WAPGUOFTIRWWJG-JENIJYKNSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cc(F)cc4cccnc43)[C@@H]2C1	ZINC001050155530	1348199228	/nfs/dbraw/zinc/19/92/28/1348199228.db2.gz	BOAKBERNSBDGJN-MAUKXSAKSA-N	0	3	339.414	3.096	20	30		EGEDHN
CC[C@H](C)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001050438143	1348266557	/nfs/dbraw/zinc/26/65/57/1348266557.db2.gz	OHLYWAITRLSAPR-INIZCTEOSA-N	0	3	325.456	3.029	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cccc4ccc(C)nc43)C2)CC1	ZINC001050559783	1348289268	/nfs/dbraw/zinc/28/92/68/1348289268.db2.gz	LTWVWIMXSLAYQE-UHFFFAOYSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cccc(-n4cccc4)c3)C2)CC1	ZINC001050582960	1348293076	/nfs/dbraw/zinc/29/30/76/1348293076.db2.gz	QXPXRULAISWKPY-UHFFFAOYSA-N	0	3	347.462	3.039	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)CCc3ccc(Cl)cc3)C2)CC1	ZINC001050607603	1348299663	/nfs/dbraw/zinc/29/96/63/1348299663.db2.gz	MHMJZTHRCZMSHF-UHFFFAOYSA-N	0	3	344.886	3.220	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1ccccn1)CC2	ZINC001050645515	1348313899	/nfs/dbraw/zinc/31/38/99/1348313899.db2.gz	OVORPLUKFQXCFE-IBGZPJMESA-N	0	3	327.472	3.108	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@@H](C)c3cccc(Cl)c3)C2)CC1	ZINC001050758914	1348350050	/nfs/dbraw/zinc/35/00/50/1348350050.db2.gz	BEMKQANAYYFEFD-HNNXBMFYSA-N	0	3	330.859	3.001	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)C(CC)(CC)c3ccccc3)C2)CC1	ZINC001050760962	1348350800	/nfs/dbraw/zinc/35/08/00/1348350800.db2.gz	BURGHDJPNHHWDI-UHFFFAOYSA-N	0	3	338.495	3.302	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3coc(CC)n3)cccc2C1	ZINC001051285086	1348418606	/nfs/dbraw/zinc/41/86/06/1348418606.db2.gz	XMNYIJOLAZEHNQ-UHFFFAOYSA-N	0	3	339.439	3.101	20	30		EGEDHN
C=CCCN1CCN([C@H]2CCN(C(=O)C3(CC)CCCCC3)C2)CC1	ZINC001052120136	1348503895	/nfs/dbraw/zinc/50/38/95/1348503895.db2.gz	ZFEXMCQTIAOPJN-IBGZPJMESA-N	0	3	347.547	3.142	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H](NC(=O)Cc3ccccc3)CC2)cc1	ZINC001052501030	1348560823	/nfs/dbraw/zinc/56/08/23/1348560823.db2.gz	VOMADGSPMIDJMJ-OAQYLSRUSA-N	0	3	347.462	3.272	20	30		EGEDHN
C[C@@]1(C(=O)N[C@H]2CCCN(Cc3ccc(C#N)cc3)CC2)C=CCC1	ZINC001052629633	1348602458	/nfs/dbraw/zinc/60/24/58/1348602458.db2.gz	ORWMOICCSGOTQW-PZJWPPBQSA-N	0	3	337.467	3.385	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2CC)CC1	ZINC001052663808	1348618397	/nfs/dbraw/zinc/61/83/97/1348618397.db2.gz	ZJPLCQYOYQUSNP-HLAWJBBLSA-N	0	3	338.495	3.347	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCN(Cc3cnccc3C)CC2)C1	ZINC001052691136	1348634497	/nfs/dbraw/zinc/63/44/97/1348634497.db2.gz	SDJVBWZVLQJPNZ-GOSISDBHSA-N	0	3	327.472	3.217	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@@H](C)c2ccc(CC)cc2)CC1	ZINC001052793484	1348681218	/nfs/dbraw/zinc/68/12/18/1348681218.db2.gz	DXKMXGFXAFOGGV-FXAWDEMLSA-N	0	3	326.484	3.347	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cnn(C(CC)CC)c2C)CC1	ZINC001052851267	1348701814	/nfs/dbraw/zinc/70/18/14/1348701814.db2.gz	YPPUOAVWSPGWAB-KRWDZBQOSA-N	0	3	344.503	3.160	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cnc(-c3ccco3)s2)CC1	ZINC001052880213	1348717092	/nfs/dbraw/zinc/71/70/92/1348717092.db2.gz	LVMIBIRTBVAOIB-CQSZACIVSA-N	0	3	343.452	3.011	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2cc(CC)c(CCC)s2)CC1	ZINC001052926008	1348751428	/nfs/dbraw/zinc/75/14/28/1348751428.db2.gz	XOLNNIFUPYDQNY-MRXNPFEDSA-N	0	3	332.513	3.481	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@H]([C@@H]2CCCN(C/C=C/Cl)C2)C1	ZINC001053023306	1348821420	/nfs/dbraw/zinc/82/14/20/1348821420.db2.gz	HYBHZAZADRPGHG-JRCVZIISSA-N	0	3	334.891	3.103	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccsc2)C1	ZINC001053063651	1348875513	/nfs/dbraw/zinc/87/55/13/1348875513.db2.gz	POBZTMFTEHGMMN-WMZOPIPTSA-N	0	3	330.497	3.478	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cnccc2C)C1	ZINC001053074554	1348892083	/nfs/dbraw/zinc/89/20/83/1348892083.db2.gz	CHGSMXDKTPMQPZ-ICSRJNTNSA-N	0	3	339.483	3.120	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2oc(C)cc2C)C1	ZINC001053075975	1348894335	/nfs/dbraw/zinc/89/43/35/1348894335.db2.gz	KNDGWEGWVZHBBC-MSOLQXFVSA-N	0	3	328.456	3.236	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(CC)o2)C1	ZINC001053087704	1348911360	/nfs/dbraw/zinc/91/13/60/1348911360.db2.gz	NKIAYFIAGHXNHK-AEFFLSMTSA-N	0	3	328.456	3.182	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ncc(C)cc2C)C1	ZINC001053089557	1348915412	/nfs/dbraw/zinc/91/54/12/1348915412.db2.gz	CFUGKIAOTHKXCA-OALUTQOASA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(Cl)[nH]2)C1	ZINC001053093832	1348922834	/nfs/dbraw/zinc/92/28/34/1348922834.db2.gz	AFRRYKKWZSSJBW-ZBFHGGJFSA-N	0	3	333.863	3.008	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cc(C)ccc2F)C1	ZINC001053097560	1348928283	/nfs/dbraw/zinc/92/82/83/1348928283.db2.gz	GQARYQICTPHEQW-PXNSSMCTSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cncc(Cl)c2)C1	ZINC001053100828	1348934653	/nfs/dbraw/zinc/93/46/53/1348934653.db2.gz	JKDWVWUGPZOSNM-MAUKXSAKSA-N	0	3	345.874	3.075	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)Cc2ccsc2C)C1	ZINC001053100790	1348934804	/nfs/dbraw/zinc/93/48/04/1348934804.db2.gz	IVSVSXGQLALWRM-RTBURBONSA-N	0	3	344.524	3.325	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)Cc2cccc(F)c2)C1	ZINC001053104398	1348939153	/nfs/dbraw/zinc/93/91/53/1348939153.db2.gz	GCMCIJVRTPNDIQ-ICSRJNTNSA-N	0	3	342.458	3.095	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(CF)cc2)C1	ZINC001053107144	1348946042	/nfs/dbraw/zinc/94/60/42/1348946042.db2.gz	ADKHEAVBJNSQSG-UXHICEINSA-N	0	3	342.458	3.496	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H]1CCC=CCCC1)C2	ZINC001054152634	1349156396	/nfs/dbraw/zinc/15/63/96/1349156396.db2.gz	FVOUIPUYDCSROK-CTNGQTDRSA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)Cc1cccc(C(F)F)c1)C2	ZINC001054163338	1349165903	/nfs/dbraw/zinc/16/59/03/1349165903.db2.gz	GITBGPSSNHQETP-HXUWFJFHSA-N	0	3	346.421	3.114	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@]2(CCN(CCC(F)(F)F)C2)C1	ZINC001054174949	1349176438	/nfs/dbraw/zinc/17/64/38/1349176438.db2.gz	DQSZMLZCLJNXQE-INIZCTEOSA-N	0	3	332.410	3.466	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)N1CCC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001054176988	1349180030	/nfs/dbraw/zinc/18/00/30/1349180030.db2.gz	UGHLUIPUDRYTKS-OZOXKJRCSA-N	0	3	337.467	3.029	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H](C)OC1CCCCCC1)C2	ZINC001054194312	1349196813	/nfs/dbraw/zinc/19/68/13/1349196813.db2.gz	NKSSFQUDBWXFKN-WIYYLYMNSA-N	0	3	346.515	3.062	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@]3(C2)CCCN(C(=O)[C@@H]2CC24CC4)C3)cc1	ZINC001054204098	1349205233	/nfs/dbraw/zinc/20/52/33/1349205233.db2.gz	NJSYRRLPYBMEIU-FPOVZHCZSA-N	0	3	349.478	3.173	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(C(F)F)cc1)C2	ZINC001054213318	1349213013	/nfs/dbraw/zinc/21/30/13/1349213013.db2.gz	XEOSNDYDGNVZGR-IBGZPJMESA-N	0	3	332.394	3.186	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)C[C@H]1CCc3ccccc31)C2	ZINC001054216366	1349215967	/nfs/dbraw/zinc/21/59/67/1349215967.db2.gz	UQGMKMLPFIGVBD-KNQAVFIVSA-N	0	3	336.479	3.054	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)C1CCC(C3CC3)CC1)C2	ZINC001054234999	1349227777	/nfs/dbraw/zinc/22/77/77/1349227777.db2.gz	NMSPRBQLNIIJSB-GZNCHQMQSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc(C)c(CC)s1)C2	ZINC001054236730	1349229591	/nfs/dbraw/zinc/22/95/91/1349229591.db2.gz	MRNUWXIYPWYQKF-IBGZPJMESA-N	0	3	330.497	3.180	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H](C)c1cccc(Cl)c1)C2	ZINC001054242613	1349235690	/nfs/dbraw/zinc/23/56/90/1349235690.db2.gz	PCUGNQLVLRRFEA-OXJNMPFZSA-N	0	3	344.886	3.391	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cnc(C(C)(C)C)s1)C2	ZINC001054245866	1349240454	/nfs/dbraw/zinc/24/04/54/1349240454.db2.gz	GERWISOIDUPOCU-LJQANCHMSA-N	0	3	345.512	3.002	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(C(C)C)s1)C2	ZINC001054247423	1349243072	/nfs/dbraw/zinc/24/30/72/1349243072.db2.gz	WITPIIGAFAGOEB-IBGZPJMESA-N	0	3	330.497	3.433	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)[C@H](C)Cc1ccccc1C)C2	ZINC001054247430	1349243141	/nfs/dbraw/zinc/24/31/41/1349243141.db2.gz	WKGBQWUCBNCXHM-KNQAVFIVSA-N	0	3	338.495	3.121	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cc4cccn4cn3)cc2C1	ZINC001054269608	1349267673	/nfs/dbraw/zinc/26/76/73/1349267673.db2.gz	GYVXFFBHYSGQBE-UHFFFAOYSA-N	0	3	346.434	3.156	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3ocnc3C(F)F)cc2C1	ZINC001054282293	1349283448	/nfs/dbraw/zinc/28/34/48/1349283448.db2.gz	ZSGNZPVDZGDMPA-UHFFFAOYSA-N	0	3	347.365	3.434	20	30		EGEDHN
C=CCN1Cc2ccc(CNC(=O)[C@H]3CCCCN3C(C)C)cc2C1	ZINC001054284790	1349286756	/nfs/dbraw/zinc/28/67/56/1349286756.db2.gz	HYYLKUAEVZKQIR-HXUWFJFHSA-N	0	3	341.499	3.067	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)NCc1ccc2c(c1)CN(CCC)C2	ZINC001054285191	1349287575	/nfs/dbraw/zinc/28/75/75/1349287575.db2.gz	WTGQCELBQRBMFO-PMACEKPBSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3[nH]cnc3CC)cc2C1	ZINC001054290764	1349296157	/nfs/dbraw/zinc/29/61/57/1349296157.db2.gz	KYWGQCNEOVQUKV-UHFFFAOYSA-N	0	3	338.455	3.184	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cncnc3C3CC3)cc2C1	ZINC001054291108	1349296589	/nfs/dbraw/zinc/29/65/89/1349296589.db2.gz	VQBKQGBYTIKMFR-UHFFFAOYSA-N	0	3	348.450	3.176	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@H]3COc4ccccc43)cc2C1	ZINC001054293033	1349299319	/nfs/dbraw/zinc/29/93/19/1349299319.db2.gz	KOQPQXBBMLMJCC-FQEVSTJZSA-N	0	3	348.446	3.371	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccc(F)cc2)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054329311	1349311445	/nfs/dbraw/zinc/31/14/45/1349311445.db2.gz	QIWFSQLUUBYEQQ-PXAZEXFGSA-N	0	3	343.427	3.009	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CCCCC2)C[C@H]1NCc1ccc(C#N)c(F)c1	ZINC001054344265	1349322694	/nfs/dbraw/zinc/32/26/94/1349322694.db2.gz	CKVHPUBITNIQNM-AUUYWEPGSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2cc(C)nn2C(CC)CC)C1	ZINC001080007150	1357457439	/nfs/dbraw/zinc/45/74/39/1357457439.db2.gz	PEYOZOSQTNBWFJ-RHSMWYFYSA-N	0	3	332.492	3.179	20	30		EGEDHN
C[C@H]1CN(C(=O)C2C(C)(C)C2(C)C)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054543503	1349393089	/nfs/dbraw/zinc/39/30/89/1349393089.db2.gz	VQLMIXREAOWBIE-WFASDCNBSA-N	0	3	345.512	3.238	20	30		EGEDHN
C[C@H]1CN(C(=O)CC(C)(C)C2CC2)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054642185	1349426378	/nfs/dbraw/zinc/42/63/78/1349426378.db2.gz	JQVNNHSKCYAJQN-GUYCJALGSA-N	0	3	345.512	3.383	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@H](NCc2cc(C)ns2)[C@@H](C)C1	ZINC001054678630	1349434813	/nfs/dbraw/zinc/43/48/13/1349434813.db2.gz	IHCCAWGBIJKLJJ-HZMBPMFUSA-N	0	3	341.908	3.167	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H](NCc2cc(C)ccc2OC)[C@@H](C)C1	ZINC001054966302	1349529806	/nfs/dbraw/zinc/52/98/06/1349529806.db2.gz	LYXXCZKVVCHKNV-RDJZCZTQSA-N	0	3	330.472	3.152	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001054970327	1349530377	/nfs/dbraw/zinc/53/03/77/1349530377.db2.gz	BEYAJULWWDGGKN-RDTXWAMCSA-N	0	3	343.446	3.236	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001054970826	1349531360	/nfs/dbraw/zinc/53/13/60/1349531360.db2.gz	JAIJNEJEZWNPEE-XJKSGUPXSA-N	0	3	331.485	3.159	20	30		EGEDHN
C[C@@H]1CN(C(=O)C(C)(C)C2CC2)C[C@H]1NCc1ccc(C#N)c(F)c1	ZINC001054990884	1349541343	/nfs/dbraw/zinc/54/13/43/1349541343.db2.gz	BZIUAUWVFRASJL-FZKQIMNGSA-N	0	3	343.446	3.070	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2)C1	ZINC001080595884	1357692034	/nfs/dbraw/zinc/69/20/34/1357692034.db2.gz	RVKSHQSTTUFLGZ-BVPBIZIASA-N	0	3	332.875	3.456	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCCC1(CNCC(=C)Br)CC1	ZINC001166747242	1383470270	/nfs/dbraw/zinc/47/02/70/1383470270.db2.gz	LLXVMFIIRBCUNH-CYBMUJFWSA-N	0	3	343.309	3.373	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)C1(C)CCCC1	ZINC001085289007	1358453512	/nfs/dbraw/zinc/45/35/12/1358453512.db2.gz	MGJGOSSEKOPKML-ZIAGYGMSSA-N	0	3	343.309	3.492	20	30		EGEDHN
CN1CCC[C@H](NC(=O)C[C@H](C#N)c2c(Cl)cccc2Cl)C1	ZINC001183119815	1387265337	/nfs/dbraw/zinc/26/53/37/1387265337.db2.gz	CRQHVGFRXWELOF-NEPJUHHUSA-N	0	3	340.254	3.201	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)CC1CCCCC1)C[C@@H](C)O2	ZINC001071131882	1354470375	/nfs/dbraw/zinc/47/03/75/1354470375.db2.gz	NXTMAERFMNQBAI-YLJYHZDGSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1c(C)oc(C)c1C)C[C@@H](C)O2	ZINC001071190431	1354495301	/nfs/dbraw/zinc/49/53/01/1354495301.db2.gz	ZGOVANKMICLVDB-JLTOFOAXSA-N	0	3	346.471	3.086	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C(C)(C)C1CCC1)C[C@H](C)O2	ZINC001071195082	1354496278	/nfs/dbraw/zinc/49/62/78/1354496278.db2.gz	RTFVOPNBABMHGN-OXJNMPFZSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)O[C@]2(CCN(CC=C(C)C)C2)C1	ZINC001071199899	1354500299	/nfs/dbraw/zinc/50/02/99/1354500299.db2.gz	QWLANHHFUGRFDB-XLIONFOSSA-N	0	3	334.504	3.247	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1c(C)cccc1C)C[C@@H](C)O2	ZINC001071211364	1354508139	/nfs/dbraw/zinc/50/81/39/1354508139.db2.gz	GRLSPYJGEUSWKJ-NQIIRXRSSA-N	0	3	342.483	3.185	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1cc(C)cc(F)c1)C[C@@H](C)O2	ZINC001071213231	1354509052	/nfs/dbraw/zinc/50/90/52/1354509052.db2.gz	BDLHOIQGJJKHCP-OXQOHEQNSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1ccoc1CCC)C[C@@H](C)O2	ZINC001071228445	1354514075	/nfs/dbraw/zinc/51/40/75/1354514075.db2.gz	UUZNPBGEZNAJGQ-UZLBHIALSA-N	0	3	346.471	3.114	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C1CCC=CCC1)C[C@H](C)O2	ZINC001071244550	1354524898	/nfs/dbraw/zinc/52/48/98/1354524898.db2.gz	WSRXUZXEKATECL-FXAWDEMLSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1ccoc1C(C)C)C[C@H](C)O2	ZINC001071245574	1354525779	/nfs/dbraw/zinc/52/57/79/1354525779.db2.gz	GEKLDPHMOUXTDI-JXFKEZNVSA-N	0	3	346.471	3.285	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@H]3CCC(C)=C(C)C3)C2)CC1	ZINC001086924457	1359249766	/nfs/dbraw/zinc/24/97/66/1359249766.db2.gz	SXBYOCPCDIAUKQ-MOPGFXCFSA-N	0	3	328.500	3.459	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cscc2C(F)F)CC[C@@H]1C	ZINC001071512601	1354737008	/nfs/dbraw/zinc/73/70/08/1354737008.db2.gz	ZSWKKBZCLGPXAD-RYUDHWBXSA-N	0	3	326.412	3.292	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccnn2C2CCCC2)CC[C@@H]1C	ZINC001071542546	1354756026	/nfs/dbraw/zinc/75/60/26/1354756026.db2.gz	HGFLYOVDGJUQST-JKSUJKDBSA-N	0	3	330.476	3.157	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc(C3CCCCC3)n[nH]2)CC[C@@H]1C	ZINC001071576441	1354774079	/nfs/dbraw/zinc/77/40/79/1354774079.db2.gz	GOCZRRNZCUOPDK-RDJZCZTQSA-N	0	3	342.487	3.063	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc(C)cc(OC)c2C)CC[C@H]1C	ZINC001071647446	1354824926	/nfs/dbraw/zinc/82/49/26/1354824926.db2.gz	HCEVWFBKXBANPX-WBVHZDCISA-N	0	3	330.472	3.471	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2cc(C)ccc2OC)CC[C@@H]1C	ZINC001071664176	1354836397	/nfs/dbraw/zinc/83/63/97/1354836397.db2.gz	ZMVLUXOOCCMHMI-FUHWJXTLSA-N	0	3	330.472	3.091	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc3c(cn2)CCCC3)CC[C@@H]1C	ZINC001071665220	1354837163	/nfs/dbraw/zinc/83/71/63/1354837163.db2.gz	BWIQUQBIYDBTBL-MAUKXSAKSA-N	0	3	327.472	3.119	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cnc3ccccc3c2C)CC[C@H]1C	ZINC001071695728	1354857377	/nfs/dbraw/zinc/85/73/77/1354857377.db2.gz	SISIJXGPQHPRNL-NVXWUHKLSA-N	0	3	335.451	3.149	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(C)nc2C(C)C)CC[C@H]1C	ZINC001071715464	1354873269	/nfs/dbraw/zinc/87/32/69/1354873269.db2.gz	IBXLEUHRPXDDAO-IAGOWNOFSA-N	0	3	327.472	3.119	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cn2cc(C)c3ccccc32)CC[C@@H]1C	ZINC001071883357	1355004959	/nfs/dbraw/zinc/00/49/59/1355004959.db2.gz	JYWOHCQKAMHGQZ-ROUUACIJSA-N	0	3	339.483	3.495	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)Cc2c[nH]c3cc(C)ccc23)CC[C@H]1C	ZINC001071886628	1355006449	/nfs/dbraw/zinc/00/64/49/1355006449.db2.gz	HLAJRHJBHDWSIW-NVXWUHKLSA-N	0	3	325.456	3.174	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(C(F)F)cc2F)CC[C@@H]1C	ZINC001071920364	1355025799	/nfs/dbraw/zinc/02/57/99/1355025799.db2.gz	PXTSRFRRHVXROL-JSGCOSHPSA-N	0	3	338.373	3.369	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cccc(-n3ccnc3)c2)CC[C@@H]1C	ZINC001071954426	1355040588	/nfs/dbraw/zinc/04/05/88/1355040588.db2.gz	OOHSGBXCVYYFSO-WMZOPIPTSA-N	0	3	338.455	3.031	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CC[C@H](C)N(Cc3ccccc3C)C2)nc1	ZINC001072000691	1355066333	/nfs/dbraw/zinc/06/63/33/1355066333.db2.gz	ZBGYVESEIBYYTO-FXAWDEMLSA-N	0	3	347.462	3.154	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CC[C@H](C)N(Cc3ccc(C)cc3)C2)nc1	ZINC001071998271	1355066461	/nfs/dbraw/zinc/06/64/61/1355066461.db2.gz	IEUFMYJQRDNXAB-FXAWDEMLSA-N	0	3	347.462	3.154	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CC[C@@H](C)N(Cc3cccc(C)c3)C2)cn1	ZINC001072002153	1355067354	/nfs/dbraw/zinc/06/73/54/1355067354.db2.gz	JEELGYCJBQYDEO-UTKZUKDTSA-N	0	3	347.462	3.154	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C23CC4CC(CC(C4)C2)C3)CC[C@@H]1C	ZINC001072012078	1355075320	/nfs/dbraw/zinc/07/53/20/1355075320.db2.gz	HZMLPXPMEODOCS-VJRVKHOTSA-N	0	3	328.500	3.195	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(OC)c(OCC)c2)CC[C@@H]1C	ZINC001072049645	1355103284	/nfs/dbraw/zinc/10/32/84/1355103284.db2.gz	QKERLQCKDDADAY-RDJZCZTQSA-N	0	3	346.471	3.253	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(OCC3CC3)nc2)CC[C@H]1C	ZINC001072098701	1355128359	/nfs/dbraw/zinc/12/83/59/1355128359.db2.gz	FAEVQUZLHUCNOM-QAPCUYQASA-N	0	3	343.471	3.029	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(C)cc1F	ZINC001089704339	1360607264	/nfs/dbraw/zinc/60/72/64/1360607264.db2.gz	VSTADLFGNHZFGT-INIZCTEOSA-N	0	3	330.447	3.378	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)Cc2c(C)oc3ccccc32)CC[C@H]1C	ZINC001072128821	1355144317	/nfs/dbraw/zinc/14/43/17/1355144317.db2.gz	FZFYUCMTBOMTQZ-GDBMZVCRSA-N	0	3	326.440	3.439	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](C)[C@H](CNCc2ocnc2C)C1	ZINC001072334729	1355244131	/nfs/dbraw/zinc/24/41/31/1355244131.db2.gz	GSPCVRVDAPOVMJ-GDBMZVCRSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](C)[C@H](CNCc2nccn2CC)C1	ZINC001072335489	1355244614	/nfs/dbraw/zinc/24/46/14/1355244614.db2.gz	NRTIFOIPIKBRQN-DLBZAZTESA-N	0	3	346.519	3.080	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](C)[C@H](CNCc2ccn(C(C)C)n2)C1	ZINC001072337093	1355245855	/nfs/dbraw/zinc/24/58/55/1355245855.db2.gz	WJLALXODTCNXRB-DLBZAZTESA-N	0	3	346.519	3.250	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CN(C(=O)C4CCCCC4)C3)C2)cc1	ZINC001072413544	1355278253	/nfs/dbraw/zinc/27/82/53/1355278253.db2.gz	PIYCYBZZRUTZGC-UHFFFAOYSA-N	0	3	337.467	3.173	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)C4=CCCCCC4)C3)C2)c1	ZINC001072658184	1355378538	/nfs/dbraw/zinc/37/85/38/1355378538.db2.gz	NQBUVDLYUBJWQE-UHFFFAOYSA-N	0	3	349.478	3.483	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3cncc(-c4ccccc4)c3)C2)C1	ZINC001072800328	1355444353	/nfs/dbraw/zinc/44/43/53/1355444353.db2.gz	MQFMSURPTVMSSN-UHFFFAOYSA-N	0	3	333.435	3.083	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC3(C2)CCN(Cc2ccc(C)nc2C)C3)C1	ZINC001072963906	1355525827	/nfs/dbraw/zinc/52/58/27/1355525827.db2.gz	AIJPRVLZFBMWGU-UHFFFAOYSA-N	0	3	339.483	3.089	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H](CC)c3ccc(Cl)cc3)C2)C1	ZINC001073451229	1355787793	/nfs/dbraw/zinc/78/77/93/1355787793.db2.gz	YJHACNZMNYLKPO-SFHVURJKSA-N	0	3	344.886	3.391	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2ccccc2C(C)(C)C)C1	ZINC001073651967	1355853724	/nfs/dbraw/zinc/85/37/24/1355853724.db2.gz	LOOJQIAIMCIUGQ-KRWDZBQOSA-N	0	3	344.499	3.381	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2ccc3c(c2)CCC=C3)C1	ZINC001073859346	1355921714	/nfs/dbraw/zinc/92/17/14/1355921714.db2.gz	HZZIDFWJVDMCKT-FQEVSTJZSA-N	0	3	340.467	3.043	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2cc3c(s2)CCCC3)C1	ZINC001073878895	1355935341	/nfs/dbraw/zinc/93/53/41/1355935341.db2.gz	VYBVFLNLALFEFD-MRXNPFEDSA-N	0	3	348.512	3.024	20	30		EGEDHN
C[C@H]1[C@@H](NCc2ccc(C#N)c(F)c2)CCN1C(=O)[C@@H]1CC=CCC1	ZINC001074524814	1356204120	/nfs/dbraw/zinc/20/41/20/1356204120.db2.gz	TZVVNMXADRGRAP-GMBSWORKSA-N	0	3	341.430	3.133	20	30		EGEDHN
C[C@H]1CN(C(=O)c2ccccc2)CC[C@H]1CNCc1ccccc1C#N	ZINC001075205881	1356339381	/nfs/dbraw/zinc/33/93/81/1356339381.db2.gz	NUFWKQVYAVACKV-PXNSSMCTSA-N	0	3	347.462	3.446	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@H](C)Cc3cccc(F)c3)[C@@H]2C1	ZINC001076623335	1356636375	/nfs/dbraw/zinc/63/63/75/1356636375.db2.gz	QNMNMQHCAVASID-HHXXYDBFSA-N	0	3	330.447	3.113	20	30		EGEDHN
CCCCCCCCC(=O)N[C@@H](C)CCNC(=O)CN(C)C(C)C	ZINC001076924473	1356691966	/nfs/dbraw/zinc/69/19/66/1356691966.db2.gz	OUYTULQJAIHAGA-KRWDZBQOSA-N	0	3	341.540	3.088	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2coc(C3CCCC3)n2)C1	ZINC001099099147	1363621181	/nfs/dbraw/zinc/62/11/81/1363621181.db2.gz	BENJCFUTWKBYSM-KXBFYZLASA-N	0	3	329.444	3.103	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)C(F)=C2CCCC2)C[C@H]1C(F)(F)F	ZINC001099238118	1363708770	/nfs/dbraw/zinc/70/87/70/1363708770.db2.gz	ABPBOKAFNRHEAY-CHWSQXEVSA-N	0	3	334.357	3.339	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(C)[nH]c1C	ZINC001099246883	1363712463	/nfs/dbraw/zinc/71/24/63/1363712463.db2.gz	ZWEROWYSHJQJIT-KRWDZBQOSA-N	0	3	347.503	3.055	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@H](C)c2cccc(F)c2)C[C@H]1C(F)(F)F	ZINC001099343946	1363761982	/nfs/dbraw/zinc/76/19/82/1363761982.db2.gz	AYZREBQTHQJRSZ-KCPJHIHWSA-N	0	3	344.352	3.094	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2c(C)noc2C2CC2)C12CCC2	ZINC001078683883	1357053718	/nfs/dbraw/zinc/05/37/18/1357053718.db2.gz	XXNSEYJQRVTZNX-KBPBESRZSA-N	0	3	349.862	3.244	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2c[nH]cc2C2CC2)C12CCC2	ZINC001078766327	1357072954	/nfs/dbraw/zinc/07/29/54/1357072954.db2.gz	CORHFLPPEVVNEF-CVEARBPZSA-N	0	3	333.863	3.275	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)C[C@H]2CCc3ccccc3C2)C1	ZINC001080844530	1357750662	/nfs/dbraw/zinc/75/06/62/1357750662.db2.gz	GWEMQHWQXHSTBC-FUHIMQAGSA-N	0	3	326.484	3.194	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2ccsc2C(F)(F)F)C1	ZINC001080852753	1357752931	/nfs/dbraw/zinc/75/29/31/1357752931.db2.gz	TUYPWXNJGPWUKG-ZYHUDNBSSA-N	0	3	332.391	3.393	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2ccccc2Cl)C[C@H]1c1ccccc1	ZINC001081216682	1357850376	/nfs/dbraw/zinc/85/03/76/1357850376.db2.gz	ONCPKIZFVHHIEB-PKOBYXMFSA-N	0	3	338.838	3.171	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CN([C@@H](CC)c3ccccc3)C[C@H]2OC)C1	ZINC001082106480	1357947617	/nfs/dbraw/zinc/94/76/17/1357947617.db2.gz	SLYLGWGFGUMMCH-CEXWTWQISA-N	0	3	342.483	3.309	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)[C@H]3CCC=CCCC3)[C@H]2C1	ZINC001083119426	1358120094	/nfs/dbraw/zinc/12/00/94/1358120094.db2.gz	RUNYDINTCUPRTA-GBESFXJTSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)c3cccc(C4CC4)c3)[C@H]2C1	ZINC001083286650	1358129607	/nfs/dbraw/zinc/12/96/07/1358129607.db2.gz	VXZPQDQWKKAECJ-VQTJNVASSA-N	0	3	340.467	3.055	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3sc(C4CC4)nc3C)[C@@H]2C1	ZINC001084340035	1358196725	/nfs/dbraw/zinc/19/67/25/1358196725.db2.gz	RBBPINYQVJYHIJ-HUUCEWRRSA-N	0	3	331.485	3.051	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3oc(CC4CC4)nc3C)[C@@H]2C1	ZINC001084347090	1358197239	/nfs/dbraw/zinc/19/72/39/1358197239.db2.gz	HAMKCRXAAHYKAO-IAGOWNOFSA-N	0	3	343.471	3.048	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3cncc(-c4ccccc4)c3)[C@@H]2C1	ZINC001084389142	1358205467	/nfs/dbraw/zinc/20/54/67/1358205467.db2.gz	UULAFNQFRGRHTA-WIYYLYMNSA-N	0	3	347.462	3.471	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)[C@@H](Cc3ccccc3)C(C)C)[C@@H]2C1	ZINC001084657793	1358271898	/nfs/dbraw/zinc/27/18/98/1358271898.db2.gz	OSHLYDUXXPMRFM-QHAWAJNXSA-N	0	3	338.495	3.057	20	30		EGEDHN
N#Cc1c(NC(=O)C(C#N)Cc2ccc(O)cc2)sc2c1CCC2	ZINC001183605659	1387323065	/nfs/dbraw/zinc/32/30/65/1387323065.db2.gz	QJWJYNINYSIQFV-GFCCVEGCSA-N	0	3	337.404	3.135	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)C[C@@H](C)c3ccccc3OC)[C@@H]2C1	ZINC001084781427	1358308184	/nfs/dbraw/zinc/30/81/84/1358308184.db2.gz	AMKGXHMPVZJOIU-ZHALLVOQSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@H](C)c3c(F)cccc3F)C[C@@H]21	ZINC001084989838	1358359921	/nfs/dbraw/zinc/35/99/21/1358359921.db2.gz	DGPBPLLKPHHPBL-CPUCHLNUSA-N	0	3	334.410	3.177	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3c3ccc(C)s3)C[C@@H]21	ZINC001085052664	1358378790	/nfs/dbraw/zinc/37/87/90/1358378790.db2.gz	CRRZCSLTQFTDHK-VQHPVUNQSA-N	0	3	330.497	3.269	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@H](C)c3ccc(CC)cc3)C[C@@H]21	ZINC001085057575	1358380907	/nfs/dbraw/zinc/38/09/07/1358380907.db2.gz	LLAWEEPVKFYKMK-DBVUQKKJSA-N	0	3	326.484	3.461	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCCC[C@H]2NC(=O)C2CC=CC2)c(F)c1	ZINC001085156042	1358414394	/nfs/dbraw/zinc/41/43/94/1358414394.db2.gz	VONANBLFIPHISY-RTBURBONSA-N	0	3	341.430	3.181	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1n[nH]c(CC)c1Cl	ZINC001085228565	1358438475	/nfs/dbraw/zinc/43/84/75/1358438475.db2.gz	RWIGPCRTNDZNOI-VXGBXAGGSA-N	0	3	345.274	3.009	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)C[C@H]1CCC(C)(C)CO1	ZINC001085278167	1358450274	/nfs/dbraw/zinc/45/02/74/1358450274.db2.gz	TUWAXJQJPSXSAG-BZUAXINKSA-N	0	3	342.911	3.351	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1coc(CC2CC2)n1	ZINC001085378702	1358482518	/nfs/dbraw/zinc/48/25/18/1358482518.db2.gz	LSPWFGPDVPTMMM-ZIAGYGMSSA-N	0	3	337.851	3.010	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cccc2scnc21	ZINC001085594741	1358621265	/nfs/dbraw/zinc/62/12/65/1358621265.db2.gz	OUTMVKQIPRKDPL-CQSZACIVSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccnn1C(CC)CC	ZINC001085639537	1358652690	/nfs/dbraw/zinc/65/26/90/1358652690.db2.gz	QRDKPRRHTSLZHR-KRWDZBQOSA-N	0	3	332.492	3.357	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@@H]1Cc2cc(Cl)ccc2O1	ZINC001085707103	1358699693	/nfs/dbraw/zinc/69/96/93/1358699693.db2.gz	CSXZMDCGCDVFSU-WMZOPIPTSA-N	0	3	348.874	3.142	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cccc2c1O[C@H](C)C2	ZINC001085729736	1358717749	/nfs/dbraw/zinc/71/77/49/1358717749.db2.gz	FRXOALXSRJVUDE-WBVHZDCISA-N	0	3	328.456	3.123	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc(C2CC2)nc1C	ZINC001085824241	1358794062	/nfs/dbraw/zinc/79/40/62/1358794062.db2.gz	DLPVMHRZQUVLFB-QGZVFWFLSA-N	0	3	327.472	3.380	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N(C)C[C@@H]1CCN1CCCC1CCCC1	ZINC001085827598	1358795634	/nfs/dbraw/zinc/79/56/34/1358795634.db2.gz	XHGCIMNOUKGAPW-OTWHNJEPSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC001085865966	1358831876	/nfs/dbraw/zinc/83/18/76/1358831876.db2.gz	SNURDZQKPUWKIY-YSIASYRMSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1ccc(-c2ccccc2)nc1	ZINC001085891103	1358850695	/nfs/dbraw/zinc/85/06/95/1358850695.db2.gz	QFGIPNNQBWHTRV-LJQANCHMSA-N	0	3	335.451	3.471	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1coc(C2CCCC2)n1	ZINC001085899379	1358856409	/nfs/dbraw/zinc/85/64/09/1358856409.db2.gz	CICOZWMOJREEHO-INIZCTEOSA-N	0	3	331.460	3.445	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1cccc(-c2cnco2)c1	ZINC001085903652	1358862110	/nfs/dbraw/zinc/86/21/10/1358862110.db2.gz	KCQDBZMXQDCAGJ-QGZVFWFLSA-N	0	3	325.412	3.064	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cn(CCCC)nc1C	ZINC001085917502	1358877772	/nfs/dbraw/zinc/87/77/72/1358877772.db2.gz	BHRUMNNDHHEBCH-QGZVFWFLSA-N	0	3	332.492	3.104	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@@H]1CCCc2sc(C)nc21	ZINC001085923502	1358882177	/nfs/dbraw/zinc/88/21/77/1358882177.db2.gz	ZNUQVSRMLAOSCA-JKSUJKDBSA-N	0	3	347.528	3.370	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C[C@H]2CCN2CCC2CCCCC2)cn1	ZINC001085932747	1358888707	/nfs/dbraw/zinc/88/87/07/1358888707.db2.gz	HWRDUAUOCUCRCZ-HXUWFJFHSA-N	0	3	339.483	3.180	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)c2ccsc2C)C1	ZINC001086078711	1358989756	/nfs/dbraw/zinc/98/97/56/1358989756.db2.gz	GZIBRKRPSRNUFM-TXEJJXNPSA-N	0	3	343.290	3.063	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc(-c3ccccc3)no2)C1	ZINC001086136027	1359005871	/nfs/dbraw/zinc/00/58/71/1359005871.db2.gz	JOVYQWRFWCSNIU-OTVXOJSOSA-N	0	3	345.830	3.192	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(-c3ccco3)o2)C1	ZINC001086425429	1359093616	/nfs/dbraw/zinc/09/36/16/1359093616.db2.gz	XGYYPVLRXVSMBC-JOCQHMNTSA-N	0	3	334.803	3.390	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cnoc2-c2ccccc2)C1	ZINC001086522958	1359131243	/nfs/dbraw/zinc/13/12/43/1359131243.db2.gz	SFWSYDJUXYOGLE-CTYIDZIISA-N	0	3	345.830	3.192	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cnc(C(C)(C)C)s2)C1	ZINC001086558366	1359145171	/nfs/dbraw/zinc/14/51/71/1359145171.db2.gz	HJHVPMYVAKRCSJ-HAQNSBGRSA-N	0	3	341.908	3.291	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)[C@H]2CCC(F)(F)C2)C1	ZINC001086591730	1359158287	/nfs/dbraw/zinc/15/82/87/1359158287.db2.gz	CFNIUOKYJOGQEW-OKZBNKHCSA-N	0	3	346.421	3.029	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CC[C@H](CNC(=O)C2C=CC=CC=C2)C1	ZINC001086708354	1359189765	/nfs/dbraw/zinc/18/97/65/1359189765.db2.gz	XIMHURYCRJPWMQ-LAUBAEHRSA-N	0	3	347.462	3.231	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2c(C)noc2C(C)C)C1	ZINC001086722439	1359191280	/nfs/dbraw/zinc/19/12/80/1359191280.db2.gz	DNKZNLANYGWBES-UONOGXRCSA-N	0	3	339.867	3.347	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)[C@@H]2CCCc3cccnc32)C1	ZINC001086784729	1359201404	/nfs/dbraw/zinc/20/14/04/1359201404.db2.gz	OMPIZVKANOTWOJ-USXIJHARSA-N	0	3	347.890	3.129	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccc(F)c(F)c2F)C1	ZINC001086789856	1359201805	/nfs/dbraw/zinc/20/18/05/1359201805.db2.gz	JBTHSWDGGZVNAG-WDEREUQCSA-N	0	3	346.780	3.345	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2oc(CCC)nc2C)C1	ZINC001086853498	1359214271	/nfs/dbraw/zinc/21/42/71/1359214271.db2.gz	DHHKPPCDDBESAJ-UONOGXRCSA-N	0	3	339.867	3.176	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3sc(C)cc3C)C2)CC1	ZINC001086925303	1359250524	/nfs/dbraw/zinc/25/05/24/1359250524.db2.gz	RZAFBSINEOSZPX-HNNXBMFYSA-N	0	3	330.497	3.315	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)CCc3ccc(F)cc3)C2)CC1	ZINC001086931278	1359255125	/nfs/dbraw/zinc/25/51/25/1359255125.db2.gz	DJCRFJKCZGQWDT-QGZVFWFLSA-N	0	3	342.458	3.095	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3cc(C)c(C)cn3)C2)CC1	ZINC001086934185	1359257928	/nfs/dbraw/zinc/25/79/28/1359257928.db2.gz	JHVSKHJKYOAKJG-SFHVURJKSA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc[nH]c3C(C)C)C2)CC1	ZINC001086937915	1359260614	/nfs/dbraw/zinc/26/06/14/1359260614.db2.gz	CIWAQZRYHCXAIR-MRXNPFEDSA-N	0	3	327.472	3.088	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)C3CC4(CCC4)C3)C2)CC1	ZINC001086938446	1359261127	/nfs/dbraw/zinc/26/11/27/1359261127.db2.gz	QGVJXWCVRBAETA-KRWDZBQOSA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc(F)c(Cl)c3)C2)CC1	ZINC001086940511	1359262447	/nfs/dbraw/zinc/26/24/47/1359262447.db2.gz	STNNFQPNTBUQMW-AWEZNQCLSA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H](CC)OC3CCCC3)C2)CC1	ZINC001086945582	1359266548	/nfs/dbraw/zinc/26/65/48/1359266548.db2.gz	FFPCFIRVZCLEFV-PKOBYXMFSA-N	0	3	346.515	3.060	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc4cccnc4c3)C2)CC1	ZINC001086949311	1359270155	/nfs/dbraw/zinc/27/01/55/1359270155.db2.gz	WTVXMUFJLABGMK-QGZVFWFLSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)C[C@H](C)c3ccco3)C2)CC1	ZINC001086953566	1359273568	/nfs/dbraw/zinc/27/35/68/1359273568.db2.gz	MAHVKIPVXQTMIV-IRXDYDNUSA-N	0	3	328.456	3.109	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)C[C@@H](C)c3ccco3)C2)CC1	ZINC001086953567	1359273899	/nfs/dbraw/zinc/27/38/99/1359273899.db2.gz	MAHVKIPVXQTMIV-SJORKVTESA-N	0	3	328.456	3.109	20	30		EGEDHN
CC[C@H](C)C(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccc(C#N)s1	ZINC001087123649	1359297083	/nfs/dbraw/zinc/29/70/83/1359297083.db2.gz	ULEOLJHDTIEXAD-ILXRZTDVSA-N	0	3	333.501	3.383	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC001087200983	1359319215	/nfs/dbraw/zinc/31/92/15/1359319215.db2.gz	WZXXOZLNRNIGFN-BODMPHMZSA-N	0	3	343.446	3.070	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccccc3F)C(C)(C)[C@H]21	ZINC001087267117	1359339228	/nfs/dbraw/zinc/33/92/28/1359339228.db2.gz	VWUMHZJGHMJUPW-NJAFHUGGSA-N	0	3	328.431	3.068	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3cccc(F)c3)C(C)(C)[C@H]21	ZINC001087270194	1359342980	/nfs/dbraw/zinc/34/29/80/1359342980.db2.gz	WIRHQPJBVVVXKR-SQNIBIBYSA-N	0	3	328.431	3.068	20	30		EGEDHN
C=C(C)C[N@@H+]1CCC[C@@H]2[C@@H](NC(=O)c3ccccc3[O-])C(C)(C)[C@@H]21	ZINC001087271540	1359345394	/nfs/dbraw/zinc/34/53/94/1359345394.db2.gz	SSCFMEKYLNLVPL-KBAYOESNSA-N	0	3	328.456	3.187	20	30		EGEDHN
C=C(C)C[N@H+]1CCC[C@@H]2[C@@H](NC(=O)c3ccccc3[O-])C(C)(C)[C@@H]21	ZINC001087271540	1359345399	/nfs/dbraw/zinc/34/53/99/1359345399.db2.gz	SSCFMEKYLNLVPL-KBAYOESNSA-N	0	3	328.456	3.187	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccsc3C)C(C)(C)[C@H]21	ZINC001087286510	1359365219	/nfs/dbraw/zinc/36/52/19/1359365219.db2.gz	RVHCYMUGGRLRKY-ZACQAIPSSA-N	0	3	330.497	3.299	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc4occc4c3)C(C)(C)[C@H]21	ZINC001087288108	1359367075	/nfs/dbraw/zinc/36/70/75/1359367075.db2.gz	RLBCFFURAAABEP-NEWSRXKRSA-N	0	3	336.435	3.285	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3c[nH]c4ccccc34)C(C)(C)[C@@H]21	ZINC001087294822	1359375416	/nfs/dbraw/zinc/37/54/16/1359375416.db2.gz	YXICLRSNONQKLI-NSISKUIASA-N	0	3	349.478	3.410	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(C(C)C)on3)C(C)(C)[C@@H]21	ZINC001087297451	1359379520	/nfs/dbraw/zinc/37/95/20/1359379520.db2.gz	OYECDQAXQCBIKK-ZTFGCOKTSA-N	0	3	343.471	3.040	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cccc(Cl)c3F)C(C)(C)[C@H]21	ZINC001087304236	1359387498	/nfs/dbraw/zinc/38/74/98/1359387498.db2.gz	ZIFIVJGRQQCWKW-COXVUDFISA-N	0	3	348.849	3.331	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc4c(C)cccn4c3)C(C)(C)[C@H]21	ZINC001087312414	1359400833	/nfs/dbraw/zinc/40/08/33/1359400833.db2.gz	DZJBSAFAIJZGPY-HOJAQTOUSA-N	0	3	349.478	3.100	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1oc(CC)cc1C	ZINC001087313428	1359402354	/nfs/dbraw/zinc/40/23/54/1359402354.db2.gz	UYRWALIYJHFMRH-NZSAHSFTSA-N	0	3	342.483	3.393	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc2cnccc2c1	ZINC001087313660	1359403159	/nfs/dbraw/zinc/40/31/59/1359403159.db2.gz	YQFIHDJGJVEFOH-HSALFYBXSA-N	0	3	347.462	3.087	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc(C)c(CC)s3)C(C)(C)[C@H]21	ZINC001087317807	1359409437	/nfs/dbraw/zinc/40/94/37/1359409437.db2.gz	NEKDKSDALUNABR-JLSDUUJJSA-N	0	3	344.524	3.471	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)C2CC(C)(C)C2)C1	ZINC001087426893	1359461856	/nfs/dbraw/zinc/46/18/56/1359461856.db2.gz	BXRXYZKUYMHYQT-WOJBJXKFSA-N	0	3	338.495	3.420	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)C(C)(C)C2CC2)C1	ZINC001087435572	1359464886	/nfs/dbraw/zinc/46/48/86/1359464886.db2.gz	VTABSXTWJOARMM-WOJBJXKFSA-N	0	3	338.495	3.420	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cn(CC)c3ccccc23)[C@H]1CC	ZINC001087649242	1359571632	/nfs/dbraw/zinc/57/16/32/1359571632.db2.gz	BUYFATSFCXMJIM-ZWKOTPCHSA-N	0	3	325.456	3.430	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3ccc(C#N)cc3)[C@@H]2CC)C1	ZINC001087717664	1359608816	/nfs/dbraw/zinc/60/88/16/1359608816.db2.gz	LOAYGHOFZIYDTN-RBUKOAKNSA-N	0	3	337.467	3.384	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(C[C@@H](O)c3ccccc3)[C@@H]2CC)C1	ZINC001087717893	1359609722	/nfs/dbraw/zinc/60/97/22/1359609722.db2.gz	RHJPYOJERVTTNI-IPMKNSEASA-N	0	3	342.483	3.045	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cc(-n3cccc3)ccn2)[C@H]1CC	ZINC001087788149	1359645038	/nfs/dbraw/zinc/64/50/38/1359645038.db2.gz	GYNWEWJTFGIMJO-PKOBYXMFSA-N	0	3	338.455	3.031	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)[C@]2(c3ccccc3)CCCO2)[C@H]1CC	ZINC001087809011	1359658261	/nfs/dbraw/zinc/65/82/61/1359658261.db2.gz	VKJIXGDBVRRDDW-QKNQBKEWSA-N	0	3	342.483	3.238	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccc3ncsc3c2)[C@H]1CC	ZINC001087818126	1359663191	/nfs/dbraw/zinc/66/31/91/1359663191.db2.gz	BYJXYZZBVYUHIX-GOEBONIOSA-N	0	3	329.469	3.455	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)C(C)(C)c2ccccc2OC)[C@H]1CC	ZINC001087849589	1359679957	/nfs/dbraw/zinc/67/99/57/1359679957.db2.gz	IXIZBZWXTIWKMZ-DLBZAZTESA-N	0	3	330.472	3.128	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)[C@]2(C)CCc3ccccc3C2)[C@H]1CC	ZINC001087853979	1359681658	/nfs/dbraw/zinc/68/16/58/1359681658.db2.gz	OPIMORCDTJHPHO-QKNQBKEWSA-N	0	3	326.484	3.337	20	30		EGEDHN
Cc1cccc(Cl)c1CN1CC[C@@H]2CN(C(=O)[C@H](C)C#N)C[C@@H]2C1	ZINC001087912103	1359704571	/nfs/dbraw/zinc/70/45/71/1359704571.db2.gz	XJWYHLFDVRLQMC-OAGGEKHMSA-N	0	3	345.874	3.088	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CCN(Cc3c(C)onc3CC)C[C@H]2C1	ZINC001088066542	1359740390	/nfs/dbraw/zinc/74/03/90/1359740390.db2.gz	ONHDSKOOBJPIBP-CVEARBPZSA-N	0	3	345.487	3.038	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3ccc(C)c(Cl)c3)C[C@@H]2C1	ZINC001088088510	1359751895	/nfs/dbraw/zinc/75/18/95/1359751895.db2.gz	YEKRJAGSELYVNK-SJORKVTESA-N	0	3	330.859	3.066	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)[C@H](C)c3ccc(Cl)cc3)C[C@@H]2C1	ZINC001088090532	1359752160	/nfs/dbraw/zinc/75/21/60/1359752160.db2.gz	UAPIBWYVTIFVQY-NXHRZFHOSA-N	0	3	344.886	3.247	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)[C@H](CC)CC3CCCC3)C[C@@H]2C1	ZINC001088128240	1359767435	/nfs/dbraw/zinc/76/74/35/1359767435.db2.gz	GGBZCAVAAISZRP-AQNXPRMDSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3ccccc3C3CCC3)C[C@@H]2C1	ZINC001088185453	1359785364	/nfs/dbraw/zinc/78/53/64/1359785364.db2.gz	AJVHGYFKMFAWSV-MOPGFXCFSA-N	0	3	336.479	3.371	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3cc4cc(F)ccc4s3)C[C@@H]2C1	ZINC001088196325	1359791595	/nfs/dbraw/zinc/79/15/95/1359791595.db2.gz	ASWNQJNKXISTBL-HIFRSBDPSA-N	0	3	342.439	3.068	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3ccc(CC)c(CC)c3)C[C@@H]2C1	ZINC001088224598	1359802292	/nfs/dbraw/zinc/80/22/92/1359802292.db2.gz	GIOVSAZMXUPALP-RTWAWAEBSA-N	0	3	338.495	3.229	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2conc2C2CC2)C1	ZINC001088380799	1359863836	/nfs/dbraw/zinc/86/38/36/1359863836.db2.gz	PMXJQSNFSJMICV-AWEZNQCLSA-N	0	3	337.851	3.279	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2coc(C3CC3)n2)C1	ZINC001088394562	1359871156	/nfs/dbraw/zinc/87/11/56/1359871156.db2.gz	JJIWJYHIARLNGM-CQSZACIVSA-N	0	3	337.851	3.279	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2ccc(O[C@H](C)CC)cc2)[C@H]1C	ZINC001088963139	1360118262	/nfs/dbraw/zinc/11/82/62/1360118262.db2.gz	RIYZLKHLSWGUQH-MDZRGWNJSA-N	0	3	328.456	3.080	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCCC[C@H]1CN(C)Cc1cccc(Cl)c1	ZINC001089139638	1360197285	/nfs/dbraw/zinc/19/72/85/1360197285.db2.gz	IFYSXPQXWBGLNA-PBHICJAKSA-N	0	3	333.863	3.313	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C[C@@H]2C[C@H]2c2ccccc2)CC(C)(C)C1	ZINC001089387230	1360388672	/nfs/dbraw/zinc/38/86/72/1360388672.db2.gz	XVYZBIXUVULKEG-UFYCRDLUSA-N	0	3	338.495	3.420	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(C(C)(C)C)cn2)CC(C)(C)C1	ZINC001089389344	1360390215	/nfs/dbraw/zinc/39/02/15/1360390215.db2.gz	PHLWOSXRPLLJLA-KRWDZBQOSA-N	0	3	341.499	3.233	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc(C)c(OC)c(C)c2)CC(C)(C)C1	ZINC001089392451	1360393067	/nfs/dbraw/zinc/39/30/67/1360393067.db2.gz	UJBDLWLRJUVQKE-SFHVURJKSA-N	0	3	342.483	3.166	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc3c(o2)CCCC3)CC(C)(C)C1	ZINC001089406924	1360405676	/nfs/dbraw/zinc/40/56/76/1360405676.db2.gz	UDJKGRKPVNVTJL-MRXNPFEDSA-N	0	3	328.456	3.012	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2ccc(C)c(Cl)c2)CC(C)(C)C1	ZINC001089416678	1360411022	/nfs/dbraw/zinc/41/10/22/1360411022.db2.gz	OGDNGMXMAQWMQI-KRWDZBQOSA-N	0	3	346.902	3.431	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2nc(C)sc2C)CC(C)(C)C1	ZINC001089416432	1360411292	/nfs/dbraw/zinc/41/12/92/1360411292.db2.gz	LYJWIHFFVPZBSS-OAHLLOKOSA-N	0	3	333.501	3.004	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2cccc(CC)c2)CC(C)(C)C1	ZINC001089424761	1360417852	/nfs/dbraw/zinc/41/78/52/1360417852.db2.gz	YOTBUNMZXSMOGO-LJQANCHMSA-N	0	3	326.484	3.032	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2c(C)[nH]c3ccccc32)CC(C)(C)C1	ZINC001089435426	1360426484	/nfs/dbraw/zinc/42/64/84/1360426484.db2.gz	JCWGFKRSYFJMKO-INIZCTEOSA-N	0	3	337.467	3.330	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc(Cl)ccc2F)CC(C)(C)C1	ZINC001089435797	1360426657	/nfs/dbraw/zinc/42/66/57/1360426657.db2.gz	PREYIVIDVMINPY-CQSZACIVSA-N	0	3	336.838	3.333	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@H]2CCc3cc(F)ccc32)CC(C)(C)C1	ZINC001089440487	1360430902	/nfs/dbraw/zinc/43/09/02/1360430902.db2.gz	OJVGHDACZZQGDT-MJGOQNOKSA-N	0	3	342.458	3.096	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cnc3ccccc3c2C)CC(C)(C)C1	ZINC001089442805	1360432843	/nfs/dbraw/zinc/43/28/43/1360432843.db2.gz	ULDGFPQCQWSIHO-KRWDZBQOSA-N	0	3	349.478	3.397	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2cc3ccccc3o2)CC(C)(C)C1	ZINC001089448203	1360436610	/nfs/dbraw/zinc/43/66/10/1360436610.db2.gz	BHVHWAMPEWMNPW-KRWDZBQOSA-N	0	3	338.451	3.215	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(C)c(F)c2F)CC(C)(C)C1	ZINC001089495488	1360472006	/nfs/dbraw/zinc/47/20/06/1360472006.db2.gz	WZLXWEQNQSPLLO-AWEZNQCLSA-N	0	3	334.410	3.127	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2ccc(Cl)s2)CC(C)(C)C1	ZINC001089510273	1360481377	/nfs/dbraw/zinc/48/13/77/1360481377.db2.gz	PXWUVSQTWDOPCH-CYBMUJFWSA-N	0	3	338.904	3.184	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2scnc2C(C)(C)C)CC(C)(C)C1	ZINC001089515353	1360485553	/nfs/dbraw/zinc/48/55/53/1360485553.db2.gz	VTUWEIDQXDSPMY-CQSZACIVSA-N	0	3	347.528	3.294	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C[C@H]2CCc3ccccc32)CC(C)(C)C1	ZINC001089523768	1360489232	/nfs/dbraw/zinc/48/92/32/1360489232.db2.gz	HBNGJWIRNBHUQL-RTBURBONSA-N	0	3	338.495	3.347	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2coc3ccccc23)CC(C)(C)C1	ZINC001089528416	1360492033	/nfs/dbraw/zinc/49/20/33/1360492033.db2.gz	KASUDSZWVUMEOQ-KRWDZBQOSA-N	0	3	338.451	3.215	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2coc(C3CCC3)n2)CC(C)(C)C1	ZINC001089537455	1360496104	/nfs/dbraw/zinc/49/61/04/1360496104.db2.gz	MTNUYMUHFCAJJV-INIZCTEOSA-N	0	3	343.471	3.186	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cccc3cnccc32)CC(C)(C)C1	ZINC001089564349	1360510942	/nfs/dbraw/zinc/51/09/42/1360510942.db2.gz	YFTYQYCZBOCYCH-QGZVFWFLSA-N	0	3	335.451	3.088	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C2(c3cccc(C)c3)CC2)CC(C)(C)C1	ZINC001089566714	1360512839	/nfs/dbraw/zinc/51/28/39/1360512839.db2.gz	QXGGCUHFRAEMGX-LJQANCHMSA-N	0	3	338.495	3.267	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cnc(CC(C)C)[nH]1	ZINC001089641834	1360554541	/nfs/dbraw/zinc/55/45/41/1360554541.db2.gz	UWXSAUKUZRVHNJ-INIZCTEOSA-N	0	3	346.519	3.405	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cccc(F)c1C	ZINC001089641356	1360554810	/nfs/dbraw/zinc/55/48/10/1360554810.db2.gz	LPGLZRLNOQDEQD-INIZCTEOSA-N	0	3	330.447	3.378	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(OCC)nc1	ZINC001089648141	1360560686	/nfs/dbraw/zinc/56/06/86/1360560686.db2.gz	GQWNCWNHYQWVET-KRWDZBQOSA-N	0	3	345.487	3.277	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(C2CC2)nn1C	ZINC001089650359	1360563629	/nfs/dbraw/zinc/56/36/29/1360563629.db2.gz	YUFTZYTVNGFVGJ-MRXNPFEDSA-N	0	3	344.503	3.094	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H]1COc2ccccc2C1	ZINC001089667128	1360577496	/nfs/dbraw/zinc/57/74/96/1360577496.db2.gz	BMJCYPWOHZFMAH-ZWKOTPCHSA-N	0	3	342.483	3.031	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(C(C)C)n[nH]1	ZINC001089699819	1360603244	/nfs/dbraw/zinc/60/32/44/1360603244.db2.gz	QRFNDJATUBNUIF-OAHLLOKOSA-N	0	3	332.492	3.330	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ncoc1C(C)(C)C	ZINC001089719722	1360621463	/nfs/dbraw/zinc/62/14/63/1360621463.db2.gz	KFSJMYAVUWWQGM-HNNXBMFYSA-N	0	3	345.487	3.216	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc2cnccc2c1	ZINC001089720175	1360622357	/nfs/dbraw/zinc/62/23/57/1360622357.db2.gz	RGGNSAUICJYEDE-HXUWFJFHSA-N	0	3	349.478	3.479	20	30		EGEDHN
N#Cc1ccccc1CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)CC1CC1	ZINC001089758802	1360652324	/nfs/dbraw/zinc/65/23/24/1360652324.db2.gz	SZZHDCYVSBAWKS-BQJUDKOJSA-N	0	3	349.478	3.027	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1ccc(C)o1	ZINC001089767635	1360656729	/nfs/dbraw/zinc/65/67/29/1360656729.db2.gz	XXSKNZSPKPSLLX-JJXSEGSLSA-N	0	3	334.847	3.123	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1cc(C)c(C)o1	ZINC001089797164	1360668154	/nfs/dbraw/zinc/66/81/54/1360668154.db2.gz	JXUFMBUBFGVLLH-NXOAAHMSSA-N	0	3	348.874	3.431	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1CC(C)(C)C1	ZINC001089807987	1360672359	/nfs/dbraw/zinc/67/23/59/1360672359.db2.gz	DSLBLBBESVAJBS-ORQFMDKSSA-N	0	3	336.907	3.344	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1CC(C)(C)C1	ZINC001089807988	1360672609	/nfs/dbraw/zinc/67/26/09/1360672609.db2.gz	DSLBLBBESVAJBS-SVGFKBNWSA-N	0	3	336.907	3.344	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1(C)CCCC1	ZINC001089848692	1360695796	/nfs/dbraw/zinc/69/57/96/1360695796.db2.gz	YLZOHAUGZXBAPX-YVSFHVDLSA-N	0	3	336.907	3.488	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)C2(C)CC(=C)C2)C1	ZINC001089865590	1360708357	/nfs/dbraw/zinc/70/83/57/1360708357.db2.gz	QWURTJKHLVTWDP-QAETUUGQSA-N	0	3	334.891	3.264	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)[C@@H]2CCCC3(CC3)C2)CC2(CCOCC2)C1	ZINC001089939491	1360754870	/nfs/dbraw/zinc/75/48/70/1360754870.db2.gz	SRNHDYADXVBIAM-QZTJIDSGSA-N	0	3	346.515	3.130	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)[C@@H]2CCCC(C)(C)C2)CC2(CCOCC2)C1	ZINC001089969395	1360772873	/nfs/dbraw/zinc/77/28/73/1360772873.db2.gz	KPIGZKWTWRTOIW-MSOLQXFVSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](CNCc2nc(C)cs2)[C@@H](C)C1	ZINC001184499448	1387474653	/nfs/dbraw/zinc/47/46/53/1387474653.db2.gz	ZSYUAFRHFRJXLY-HOCLYGCPSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)c2sccc2C)C1	ZINC001090894782	1360947386	/nfs/dbraw/zinc/94/73/86/1360947386.db2.gz	NLCWIJGWALSTHF-UHFFFAOYSA-N	0	3	343.290	3.063	20	30		EGEDHN
N#Cc1ccc(F)c(CNC2CC(CNC(=O)[C@H]3CC=CCC3)C2)c1	ZINC001090922655	1360954232	/nfs/dbraw/zinc/95/42/32/1360954232.db2.gz	QGYBFQNUUKHJJV-PQUAAJSLSA-N	0	3	341.430	3.038	20	30		EGEDHN
C#Cc1ccc(C(=O)NCC2CC(NCc3ccccc3F)C2)cc1	ZINC001091176956	1361001371	/nfs/dbraw/zinc/00/13/71/1361001371.db2.gz	WCCZFWJRHJYJNW-UHFFFAOYSA-N	0	3	336.410	3.105	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cnoc2-c2ccccc2)C1	ZINC001091306577	1361037569	/nfs/dbraw/zinc/03/75/69/1361037569.db2.gz	SFWSYDJUXYOGLE-UHFFFAOYSA-N	0	3	345.830	3.192	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cnc(C(C)C)s2)C1	ZINC001091397229	1361079790	/nfs/dbraw/zinc/07/97/90/1361079790.db2.gz	SUKBYFMLAUHYOF-UHFFFAOYSA-N	0	3	327.881	3.117	20	30		EGEDHN
C[C@@]12CN(Cc3cccc(C#N)c3)C[C@@H]1CN(C(=O)C1CCCC1)C2	ZINC001091421704	1361090072	/nfs/dbraw/zinc/09/00/72/1361090072.db2.gz	FFEXMNWHKDDAKU-CTNGQTDRSA-N	0	3	337.467	3.029	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3ccccc3C(C)(C)CC)C[C@]2(C)C1	ZINC001091768921	1361215257	/nfs/dbraw/zinc/21/52/57/1361215257.db2.gz	ZUJZGZOLTKVPPS-VGSWGCGISA-N	0	3	338.495	3.401	20	30		EGEDHN
CCC(C)(C)C(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@@]2(C)C1	ZINC001091964126	1361261562	/nfs/dbraw/zinc/26/15/62/1361261562.db2.gz	RZKYQMNMHDUYFI-NQIIRXRSSA-N	0	3	339.483	3.275	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc(C)c(Cl)c3)C[C@]2(C)C1	ZINC001091973836	1361264538	/nfs/dbraw/zinc/26/45/38/1361264538.db2.gz	HCUWPNCLVZLWOU-APWZRJJASA-N	0	3	330.859	3.066	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc4ccccc4c3)C[C@]2(C)C1	ZINC001092225625	1361330963	/nfs/dbraw/zinc/33/09/63/1361330963.db2.gz	GEBKCRXFWFNEOS-IRLDBZIGSA-N	0	3	332.447	3.257	20	30		EGEDHN
Cc1ccccc1C(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C	ZINC001092439314	1361384300	/nfs/dbraw/zinc/38/43/00/1361384300.db2.gz	HXBFYKPFRRVVDX-TZIWHRDSSA-N	0	3	346.474	3.344	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1CNC(=O)[C@@H]1CC=CCC1	ZINC001092459831	1361388353	/nfs/dbraw/zinc/38/83/53/1361388353.db2.gz	UREJBWRSYUUJIZ-HMXCVIKNSA-N	0	3	336.479	3.079	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NC[C@@H]1CN(C/C=C/Cl)C[C@H]1C	ZINC001092740752	1361450746	/nfs/dbraw/zinc/45/07/46/1361450746.db2.gz	RCLIWFHYALQZFH-HKFHSAMXSA-N	0	3	348.874	3.302	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CN(Cc3cnc(C)s3)C[C@H]2C)CC1	ZINC001092940588	1361491252	/nfs/dbraw/zinc/49/12/52/1361491252.db2.gz	UERPYTDFNNKBIW-RHSMWYFYSA-N	0	3	347.528	3.382	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)/C=C/c2ccco2)CC1	ZINC001093353010	1361566674	/nfs/dbraw/zinc/56/66/74/1361566674.db2.gz	OWVXUNISNXYDPF-ROUKRRSUSA-N	0	3	338.451	3.019	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C[C@@H]2C=CCC2)CC1	ZINC001093353553	1361567623	/nfs/dbraw/zinc/56/76/23/1361567623.db2.gz	AVIRJMPFDNIFFR-XLIONFOSSA-N	0	3	326.484	3.069	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C[C@H]2C=CCCC2)CC1	ZINC001093372604	1361581876	/nfs/dbraw/zinc/58/18/76/1361581876.db2.gz	FXBLMZLMYZIXRD-GHTZIAJQSA-N	0	3	340.511	3.459	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)c2occc2CC)CC1	ZINC001093379008	1361589725	/nfs/dbraw/zinc/58/97/25/1361589725.db2.gz	XYPFLDUWPBTMKO-IBGZPJMESA-N	0	3	340.467	3.182	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)[C@@H]2C[C@H]2CC(C)C)CC1	ZINC001093379739	1361590526	/nfs/dbraw/zinc/59/05/26/1361590526.db2.gz	HMRXIKYZPWFMBO-VAMGGRTRSA-N	0	3	342.527	3.395	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C[C@H](C)C2CC2)CC1	ZINC001093383022	1361594529	/nfs/dbraw/zinc/59/45/29/1361594529.db2.gz	HMQDEWYXCWNLOX-JXFKEZNVSA-N	0	3	328.500	3.149	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cnc4ccccc4c3C)CCC[C@@H]12	ZINC001094471984	1361817899	/nfs/dbraw/zinc/81/78/99/1361817899.db2.gz	WRVRULYKRAQUQB-IFMALSPDSA-N	0	3	347.462	3.151	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3ccccc3OC(C)C)CCC[C@@H]12	ZINC001094563511	1361861988	/nfs/dbraw/zinc/86/19/88/1361861988.db2.gz	BJXSIJOLRDQKPM-TZIWHRDSSA-N	0	3	340.467	3.081	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1C[C@H]2C[C@@H](C1)N(C(=O)C1CCCC1)C2	ZINC001094834844	1361920550	/nfs/dbraw/zinc/92/05/50/1361920550.db2.gz	XBYPIWRZJRRYOH-YSSFQJQWSA-N	0	3	337.467	3.218	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H]1COc3cc(C)c(C)cc31)C2	ZINC001095817167	1362244124	/nfs/dbraw/zinc/24/41/24/1362244124.db2.gz	VMCMYKCJEWCIPU-BVBHFADKSA-N	0	3	340.467	3.077	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3C[C@H]2CC(C)(C)CO2)CC1	ZINC001095968172	1362314743	/nfs/dbraw/zinc/31/47/43/1362314743.db2.gz	LHUOCNAAPBBPTQ-YRXWBPOGSA-N	0	3	346.515	3.269	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1oc(CC(C)C)nc1C)C2	ZINC001096130574	1362399276	/nfs/dbraw/zinc/39/92/76/1362399276.db2.gz	CXEWPXBPGBPDKH-IKGGRYGDSA-N	0	3	345.487	3.483	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1sc(CC)nc1C)C2	ZINC001096156403	1362408482	/nfs/dbraw/zinc/40/84/82/1362408482.db2.gz	SAGTZZVQLQPBNA-ILXRZTDVSA-N	0	3	333.501	3.315	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](CNCc2oc(C)nc2C)[C@@H](C)C1	ZINC001184967119	1387575567	/nfs/dbraw/zinc/57/55/67/1387575567.db2.gz	HTTSHKPXKIXTOY-YJBOKZPZSA-N	0	3	345.487	3.059	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1ccc3c(c1)CCCC3)C2	ZINC001096521108	1362549128	/nfs/dbraw/zinc/54/91/28/1362549128.db2.gz	YUHJQKLIGCANEG-HKBOAZHASA-N	0	3	338.495	3.406	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1sc(CCC)nc1C)C2	ZINC001096537573	1362563379	/nfs/dbraw/zinc/56/33/79/1362563379.db2.gz	SGANKQTUGBNDPF-ILXRZTDVSA-N	0	3	333.501	3.315	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1coc3c1cccc3OC)C2	ZINC001097081192	1362835954	/nfs/dbraw/zinc/83/59/54/1362835954.db2.gz	QHNYFTRDLWHRTB-XYPHTWIQSA-N	0	3	340.423	3.353	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1c(Cl)cncc1Cl)C2	ZINC001097780939	1363119881	/nfs/dbraw/zinc/11/98/81/1363119881.db2.gz	WKGMQPHSHCIDRZ-HONMWMINSA-N	0	3	340.254	3.300	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(C(C)C)nc1CC)C2	ZINC001097866448	1363144023	/nfs/dbraw/zinc/14/40/23/1363144023.db2.gz	QVMHAVUNJVIYGB-YSGRDPCXSA-N	0	3	339.483	3.126	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(Cl)cc1Cl)C2	ZINC001098266985	1363279652	/nfs/dbraw/zinc/27/96/52/1363279652.db2.gz	YACFUTDXELTGLE-WQVCFCJDSA-N	0	3	337.250	3.352	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H]1Cc3c1cccc3Cl)C2	ZINC001098482112	1363339097	/nfs/dbraw/zinc/33/90/97/1363339097.db2.gz	QSHHVMBHUKLWLN-XGWTYTTDSA-N	0	3	330.859	3.277	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)C[C@@H](NC(=O)C1CCC1)c1ccccc1O2	ZINC001098541669	1363363755	/nfs/dbraw/zinc/36/37/55/1363363755.db2.gz	QDFPGHAMYRLQSV-WIYYLYMNSA-N	0	3	340.467	3.447	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@]1(C)CC=CCC1)C[C@@H](C)O2	ZINC001098599739	1363393803	/nfs/dbraw/zinc/39/38/03/1363393803.db2.gz	KLOQKUAACMGKFB-IEBWSBKVSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H]1CC3CCC1CC3)C[C@H](C)O2	ZINC001098663185	1363425136	/nfs/dbraw/zinc/42/51/36/1363425136.db2.gz	YKIMFBJBHIOROT-MKCYZYCBSA-N	0	3	346.515	3.081	20	30		EGEDHN
C[C@@H](C(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(C#N)cc1)C2)C1CC1	ZINC001098774791	1363463539	/nfs/dbraw/zinc/46/35/39/1363463539.db2.gz	JYJWTGIZFQYCKV-JJXUHFIVSA-N	0	3	337.467	3.075	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2cccc(C(C)C)n2)C1	ZINC001098925620	1363523760	/nfs/dbraw/zinc/52/37/60/1363523760.db2.gz	FFQNBJVBWWAJCL-JXFKEZNVSA-N	0	3	327.472	3.365	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc3cc(C)ccc3n2)C1	ZINC001098934992	1363528202	/nfs/dbraw/zinc/52/82/02/1363528202.db2.gz	ADNJUUGREMNTPK-UWJYYQICSA-N	0	3	335.451	3.314	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(C)c(OCC)c2)C1	ZINC001099062608	1363602093	/nfs/dbraw/zinc/60/20/93/1363602093.db2.gz	WDSSJHRNUZJTHB-PXNSSMCTSA-N	0	3	328.456	3.164	20	30		EGEDHN
C#CCN1C[C@@H]2CCC[C@]2(NC(=O)Cc2cccc3sccc32)C1	ZINC001099063800	1363602731	/nfs/dbraw/zinc/60/27/31/1363602731.db2.gz	HRRHFPLMSCJTCK-JXFKEZNVSA-N	0	3	338.476	3.048	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2scnc2C2CC2)C1	ZINC001099067718	1363605050	/nfs/dbraw/zinc/60/50/50/1363605050.db2.gz	BPXMNELQTIDLGA-KSSFIOAISA-N	0	3	331.485	3.181	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)Cc2c[nH]c3cc(C)ccc23)C1	ZINC001099076214	1363610464	/nfs/dbraw/zinc/61/04/64/1363610464.db2.gz	WDIINOMURGGWQL-AVRDEDQJSA-N	0	3	349.478	3.013	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ncoc2-c2cccs2)C1	ZINC001099082580	1363613496	/nfs/dbraw/zinc/61/34/96/1363613496.db2.gz	YTXISLZMXONUIR-UGSOOPFHSA-N	0	3	343.452	3.173	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)COCC1CCCC1	ZINC001099110748	1363628998	/nfs/dbraw/zinc/62/89/98/1363628998.db2.gz	IFFFNKNOKWUZQR-SFHVURJKSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)C(C)(C)COCC(F)F	ZINC001099153228	1363659578	/nfs/dbraw/zinc/65/95/78/1363659578.db2.gz	HIOYZVJNVMECDB-CQSZACIVSA-N	0	3	346.462	3.087	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)C1(CC)CCC1	ZINC001099182580	1363678101	/nfs/dbraw/zinc/67/81/01/1363678101.db2.gz	MYLNOMJSXVFKCW-KRWDZBQOSA-N	0	3	336.520	3.376	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)C1(C(F)F)CCCC1	ZINC001099199387	1363688493	/nfs/dbraw/zinc/68/84/93/1363688493.db2.gz	MKFAWMTYFHIMTE-OAHLLOKOSA-N	0	3	340.458	3.442	20	30		EGEDHN
C=CCCCC(=O)NC[C@H]1CCC(C)(C)CN1CCOCC1CC1	ZINC001099203751	1363690549	/nfs/dbraw/zinc/69/05/49/1363690549.db2.gz	RHJIUGGYOHJIFX-GOSISDBHSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)Cc1csc(C)n1	ZINC001099329951	1363754067	/nfs/dbraw/zinc/75/40/67/1363754067.db2.gz	YZVDMRWVBASAFY-MRXNPFEDSA-N	0	3	335.517	3.177	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)CC(C2CC2)C2CC2)C[C@H]1C(F)(F)F	ZINC001099346397	1363763367	/nfs/dbraw/zinc/76/33/67/1363763367.db2.gz	BMIYPPOLUFQQBD-HZPDHXFCSA-N	0	3	344.421	3.368	20	30		EGEDHN
C=C[C@H](C(=O)NC[C@@H]1CCC(C)(C)CN1CCOC)c1ccccc1	ZINC001099348733	1363764441	/nfs/dbraw/zinc/76/44/41/1363764441.db2.gz	LKVYLAFGNFFQPX-OALUTQOASA-N	0	3	344.499	3.209	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)Cc1csc(CC)n1	ZINC001099355055	1363768853	/nfs/dbraw/zinc/76/88/53/1363768853.db2.gz	XDMVOCPONPECEN-HNNXBMFYSA-N	0	3	335.517	3.041	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1CN(CC=C(C)C)CC2(CCOCC2)C1	ZINC001099587278	1363869304	/nfs/dbraw/zinc/86/93/04/1363869304.db2.gz	UNWWTOOFSHKMOA-QGZVFWFLSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCC(C)(C)C)CC2(CCOCC2)C1	ZINC001099595140	1363878088	/nfs/dbraw/zinc/87/80/88/1363878088.db2.gz	UGLVXJGMBPZCAU-QGZVFWFLSA-N	0	3	336.520	3.376	20	30		EGEDHN
CCC[C@@H](C)CC(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100175851	1364036183	/nfs/dbraw/zinc/03/61/83/1364036183.db2.gz	SECHIVLDWGTPAL-PPDQVPDSSA-N	0	3	344.474	3.488	20	30		EGEDHN
C[C@H](C#N)C(=O)NCC1CC(NCc2ccc(Cl)cc2Cl)C1	ZINC001100196733	1364042235	/nfs/dbraw/zinc/04/22/35/1364042235.db2.gz	RNGSAUJEVXJGBF-CDWSIMAYSA-N	0	3	340.254	3.137	20	30		EGEDHN
O=C(CCC1CC1)NCC1CC(NCC#Cc2ccccc2Cl)C1	ZINC001100203318	1364043875	/nfs/dbraw/zinc/04/38/75/1364043875.db2.gz	JYVNQPCKDRVBHF-UHFFFAOYSA-N	0	3	344.886	3.366	20	30		EGEDHN
O=C(C=C1CCC1)NCC1CC(NCC#Cc2ccc(Cl)cc2)C1	ZINC001100240325	1364054583	/nfs/dbraw/zinc/05/45/83/1364054583.db2.gz	NIRIWZSEFSVPCG-UHFFFAOYSA-N	0	3	342.870	3.286	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)C(F)=C2CCCC2)C1	ZINC001100243049	1364055243	/nfs/dbraw/zinc/05/52/43/1364055243.db2.gz	VVZWKTANSLEXGA-UHFFFAOYSA-N	0	3	345.256	3.177	20	30		EGEDHN
CCC(=CC(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1)CC	ZINC001100241429	1364055282	/nfs/dbraw/zinc/05/52/82/1364055282.db2.gz	SDPKISRFKCWCCK-UHFFFAOYSA-N	0	3	342.458	3.408	20	30		EGEDHN
CC/C(C)=C\C(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1	ZINC001100307637	1364075751	/nfs/dbraw/zinc/07/57/51/1364075751.db2.gz	LXSSKVMOBOBLJF-MLPAPPSSSA-N	0	3	329.419	3.038	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@H](c2ccccc2)C2CC2)C1	ZINC001100505653	1364139519	/nfs/dbraw/zinc/13/95/19/1364139519.db2.gz	LYBNJHSYVIOICT-IUPXNIOVSA-N	0	3	332.875	3.417	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC1CC(NCc2cccc(Cl)n2)C1	ZINC001100644725	1364202062	/nfs/dbraw/zinc/20/20/62/1364202062.db2.gz	DOYLHANNOBCPMJ-RWKZGTHUSA-N	0	3	335.879	3.322	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)CCOc2ccccc2C)C1	ZINC001100979668	1364356310	/nfs/dbraw/zinc/35/63/10/1364356310.db2.gz	SNLMCFMIDLJRMN-UHFFFAOYSA-N	0	3	336.863	3.001	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@H](C)Cc2cccc(F)c2)C1	ZINC001101061703	1364397158	/nfs/dbraw/zinc/39/71/58/1364397158.db2.gz	LCJHUDINSGHMKO-OLJMKKDRSA-N	0	3	338.854	3.241	20	30		EGEDHN
C=CCCC(=O)N1C[C@H]2CN(Cc3cc(F)ccc3C)C[C@@]2(C)C1	ZINC001101163153	1364441011	/nfs/dbraw/zinc/44/10/11/1364441011.db2.gz	ZFKPLCPDGZWNSX-XLIONFOSSA-N	0	3	330.447	3.381	20	30		EGEDHN
C#CCCCC(=O)N1C[C@H]2CN([C@H](C)c3ccccc3F)C[C@@]2(C)C1	ZINC001101213201	1364465207	/nfs/dbraw/zinc/46/52/07/1364465207.db2.gz	YDJPHIOLFYTJLD-LZJOCLMNSA-N	0	3	342.458	3.471	20	30		EGEDHN
C=CCCCC(=O)N1C[C@H]2CN(Cc3ccccc3F)C[C@@]2(C)C1	ZINC001101347099	1364520998	/nfs/dbraw/zinc/52/09/98/1364520998.db2.gz	WJFCAWKIXRTISA-XLIONFOSSA-N	0	3	330.447	3.462	20	30		EGEDHN
C=CCCC(=O)N1CCC(C(C)(C)CNCc2cc(OC)no2)CC1	ZINC001101519646	1364595568	/nfs/dbraw/zinc/59/55/68/1364595568.db2.gz	NSEYEJRLMJOOGV-UHFFFAOYSA-N	0	3	349.475	3.004	20	30		EGEDHN
C=CCCCC(=O)N1CCC(C(C)(C)CNCc2nccn2C)CC1	ZINC001101569056	1364624203	/nfs/dbraw/zinc/62/42/03/1364624203.db2.gz	PVDSCRPYSLIQIV-UHFFFAOYSA-N	0	3	346.519	3.131	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CC2(CN(C[C@H](C)CC)C2)n2ccnc21	ZINC001101635215	1364663624	/nfs/dbraw/zinc/66/36/24/1364663624.db2.gz	CVHDSLAKZRFNLZ-HZPDHXFCSA-N	0	3	344.503	3.103	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1CC2(CN(CCC(C)C)C2)n2ccnc21	ZINC001101638041	1364664506	/nfs/dbraw/zinc/66/45/06/1364664506.db2.gz	UDMKGUUZEKQMHP-DLBZAZTESA-N	0	3	344.503	3.103	20	30		EGEDHN
CCCCCC(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001101723383	1364703796	/nfs/dbraw/zinc/70/37/96/1364703796.db2.gz	ZTCBDFRDOLOSHU-HUUCEWRRSA-N	0	3	333.501	3.384	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1C	ZINC001102010630	1364810481	/nfs/dbraw/zinc/81/04/81/1364810481.db2.gz	HSFABWOYQJQKHA-IEBWSBKVSA-N	0	3	342.458	3.218	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H]1CN(Cc2ccc(OC)c(F)c2)C[C@H]1C	ZINC001102010708	1364810605	/nfs/dbraw/zinc/81/06/05/1364810605.db2.gz	LGVLGAFVGGXXFR-NVXWUHKLSA-N	0	3	348.462	3.375	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@@H]1CN(Cc2c(C)noc2C)C[C@H]1C	ZINC001102410261	1365042859	/nfs/dbraw/zinc/04/28/59/1365042859.db2.gz	TYGCKJKRMCUGOL-CZUORRHYSA-N	0	3	333.476	3.078	20	30		EGEDHN
CC(C)=CC(=O)NCC[C@@H]1CN(Cc2cc(C#N)ccc2F)C[C@H]1C	ZINC001102648063	1365154462	/nfs/dbraw/zinc/15/44/62/1365154462.db2.gz	OIOFONLGXFSPNT-NVXWUHKLSA-N	0	3	343.446	3.238	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2ccc(Cl)o2)C1	ZINC001102663895	1365161234	/nfs/dbraw/zinc/16/12/34/1365161234.db2.gz	PERXZCAIHKSOKD-ZYHUDNBSSA-N	0	3	331.243	3.373	20	30		EGEDHN
C=CC(C)(C)C(=O)NCC[C@@H]1CN([C@H](C)c2ncc(C)o2)C[C@H]1C	ZINC001103311846	1365487323	/nfs/dbraw/zinc/48/73/23/1365487323.db2.gz	NXVXJQOKWUBZOS-FVQBIDKESA-N	0	3	333.476	3.330	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC[C@@H]2CN(Cc3ccns3)C[C@H]2C)C1	ZINC001103418618	1365549546	/nfs/dbraw/zinc/54/95/46/1365549546.db2.gz	QWKSBHPTGQTQNU-HUUCEWRRSA-N	0	3	333.501	3.074	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2ccccc2OC)C1	ZINC001103667603	1365715688	/nfs/dbraw/zinc/71/56/88/1365715688.db2.gz	FBIGIHNWWVISOP-UKRRQHHQSA-N	0	3	336.863	3.136	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2ccc(F)cn2)C1	ZINC001104607146	1366099076	/nfs/dbraw/zinc/09/90/76/1366099076.db2.gz	LZVQNHUUHJBDFB-HZPDHXFCSA-N	0	3	333.451	3.151	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CN(C(=O)C(C)(C)C)C[C@H]1C	ZINC001104939377	1366232184	/nfs/dbraw/zinc/23/21/84/1366232184.db2.gz	NTQDJCBQLWZLIA-DGCLKSJQSA-N	0	3	331.298	3.015	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1C[C@@H](C)[C@H](CCNCC(=C)Cl)C1	ZINC001104954591	1366240877	/nfs/dbraw/zinc/24/08/77/1366240877.db2.gz	JKDJMYCZBPPHKL-DNVCBOLYSA-N	0	3	344.886	3.037	20	30		EGEDHN
CCCCCCCNCc1cn(C2CN(C(=O)/C=C(/C)CC)C2)nn1	ZINC001105232991	1366382011	/nfs/dbraw/zinc/38/20/11/1366382011.db2.gz	CICPBYSXZXWDRC-WJDWOHSUSA-N	0	3	347.507	3.078	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@H](C)CC(C)C)CC1	ZINC001105396017	1366444409	/nfs/dbraw/zinc/44/44/09/1366444409.db2.gz	GZOJRHRZSGNYQD-MJGOQNOKSA-N	0	3	330.516	3.395	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@@H](CNCc2nc(C)sc2C)[C@H](C)C1	ZINC001106025634	1366606930	/nfs/dbraw/zinc/60/69/30/1366606930.db2.gz	AGQWGKRIZDYULE-RHSMWYFYSA-N	0	3	347.528	3.138	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](CNCc2cc(F)ccc2C#N)[C@H](C)C1	ZINC001106190098	1366619306	/nfs/dbraw/zinc/61/93/06/1366619306.db2.gz	STZIWUSTIIZFSF-CRAIPNDOSA-N	0	3	343.446	3.238	20	30		EGEDHN
Cc1cc(N2CCN(C)[C@H](C)[C@@H]2C)n2c3ccccc3nc2c1C#N	ZINC001185967802	1387837789	/nfs/dbraw/zinc/83/77/89/1387837789.db2.gz	CCZWVXYIERNRRV-CABCVRRESA-N	0	3	333.439	3.196	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](NCc2ccccc2N(C)C)C1	ZINC001185968943	1387838671	/nfs/dbraw/zinc/83/86/71/1387838671.db2.gz	QHRJFCZBHNFPGF-QGZVFWFLSA-N	0	3	329.488	3.045	20	30		EGEDHN
CC[C@@H](C)C(=O)NC[C@]12CCC[C@H]1N(CC#Cc1ccccc1)CC2	ZINC001107286466	1366916472	/nfs/dbraw/zinc/91/64/72/1366916472.db2.gz	IZQOGBRTXMSIDM-SYYKKAFVSA-N	0	3	338.495	3.445	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC[C@]12CCC[C@H]1N(Cc1ccccc1Cl)CC2	ZINC001107336335	1366932056	/nfs/dbraw/zinc/93/20/56/1366932056.db2.gz	LQPUGOHRYNYJQW-POZUXBRTSA-N	0	3	345.874	3.360	20	30		EGEDHN
CC(C)[C@H](C)CC(=O)N1CC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001189326201	1366992043	/nfs/dbraw/zinc/99/20/43/1366992043.db2.gz	DDBAZZZKEUAWPU-APWZRJJASA-N	0	3	327.472	3.273	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)C[C@H](C)CCCCC)[C@@H]2C1	ZINC001189341617	1366996778	/nfs/dbraw/zinc/99/67/78/1366996778.db2.gz	GUONRXWLJYCOLC-CEXWTWQISA-N	0	3	336.520	3.328	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC[C@H](N(C)C/C=C\c2ccc(Cl)cc2)C1	ZINC001189400601	1367012245	/nfs/dbraw/zinc/01/22/45/1367012245.db2.gz	MGBZHHAMURGEGT-UIRUKZSUSA-N	0	3	331.847	3.046	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@]12CCC[C@H]1N(Cc1cnoc1C)CC2	ZINC001107514682	1367013130	/nfs/dbraw/zinc/01/31/30/1367013130.db2.gz	QUEOVQFUDOUVEB-XFQXTVEOSA-N	0	3	345.487	3.446	20	30		EGEDHN
CCC[C@H](C(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C1)C(C)C	ZINC001186019962	1387847148	/nfs/dbraw/zinc/84/71/48/1387847148.db2.gz	UTYNDMNARNYLIK-PBHICJAKSA-N	0	3	333.501	3.383	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1CC[C@@H](N(C)Cc2ccc(OC)c(C#N)c2)C1	ZINC001189462553	1367029946	/nfs/dbraw/zinc/02/99/46/1367029946.db2.gz	XJHUPBOZOOGCCK-CRAIPNDOSA-N	0	3	343.471	3.036	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@]23CCC[C@H]2N(Cc2conc2C)CC3)C1	ZINC001107543652	1367035667	/nfs/dbraw/zinc/03/56/67/1367035667.db2.gz	RHKZKOUSZDISFL-YLJYHZDGSA-N	0	3	343.471	3.200	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2C[C@@H]1CC(C)(C)CO1	ZINC001109328902	1367055415	/nfs/dbraw/zinc/05/54/15/1367055415.db2.gz	GBDMDBMDDQELOP-XWSJACJDSA-N	0	3	346.515	3.291	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](N(C)CCOC2CCCCCC2)C1	ZINC001189751779	1367102658	/nfs/dbraw/zinc/10/26/58/1367102658.db2.gz	JPWAFWDPUGACHI-LJQANCHMSA-N	0	3	348.531	3.452	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@@H](N(C)Cc2cccc(OC(C)C)c2)C1	ZINC001190046819	1367160671	/nfs/dbraw/zinc/16/06/71/1367160671.db2.gz	LYQILYMBQAHBPO-LJQANCHMSA-N	0	3	342.483	3.166	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)C2=CCCCCC2)C1	ZINC001107894526	1367193748	/nfs/dbraw/zinc/19/37/48/1367193748.db2.gz	ZCRDDVWCXTZSKM-PXNSSMCTSA-N	0	3	334.504	3.439	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC[C@@]1(C)CN(CC2CCCC2)CCO1	ZINC001107964440	1367220124	/nfs/dbraw/zinc/22/01/24/1367220124.db2.gz	FKXMWMCXHPXPCR-FQEVSTJZSA-N	0	3	334.504	3.152	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCOCCCC	ZINC001109606758	1367229041	/nfs/dbraw/zinc/22/90/41/1367229041.db2.gz	HZHQRHCMAHDQFI-QYZOEREBSA-N	0	3	334.504	3.108	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](N(C)CCOc2ccccc2)C1	ZINC001190354284	1367237087	/nfs/dbraw/zinc/23/70/87/1367237087.db2.gz	HRXHBYCJIGAQSA-LJQANCHMSA-N	0	3	342.483	3.367	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)[C@@H](CCCC)C(C)C)[C@@H]2C1	ZINC001190394102	1367250718	/nfs/dbraw/zinc/25/07/18/1367250718.db2.gz	GTVHBCDRJMFPON-GBESFXJTSA-N	0	3	336.520	3.184	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@]1(C)CN(CC(CC)CC)CCO1	ZINC001108121936	1367292756	/nfs/dbraw/zinc/29/27/56/1367292756.db2.gz	JKSIPTUPZSIUHS-HXUWFJFHSA-N	0	3	336.520	3.213	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCCCc1ccc(F)cc1)C2	ZINC001109757561	1367304108	/nfs/dbraw/zinc/30/41/08/1367304108.db2.gz	LAAZNZVGORZLHV-AABGKKOBSA-N	0	3	342.458	3.283	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](C)Cc1ccccc1Cl)C2	ZINC001109778746	1367317233	/nfs/dbraw/zinc/31/72/33/1367317233.db2.gz	UHCWURRAHLNVFH-JZGRTCEGSA-N	0	3	344.886	3.263	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)C2CCC=CCC2)C1	ZINC001108402519	1367434814	/nfs/dbraw/zinc/43/48/14/1367434814.db2.gz	GXXPTYZGUOGXPV-FXAWDEMLSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)c1ccc(OCC(F)(F)F)cc1	ZINC001191417567	1367498945	/nfs/dbraw/zinc/49/89/45/1367498945.db2.gz	KQVUZEPVQRNSLB-AWEZNQCLSA-N	0	3	342.361	3.008	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](CC)c1ccc(F)cc1)C2	ZINC001110172682	1367544012	/nfs/dbraw/zinc/54/40/12/1367544012.db2.gz	HENDTFMSHZZNPY-YRXWBPOGSA-N	0	3	328.431	3.064	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](C)CCOc1ccccc1)C2	ZINC001110206184	1367563408	/nfs/dbraw/zinc/56/34/08/1367563408.db2.gz	CMCXTLAHFHAXKI-HNJRGHQBSA-N	0	3	342.483	3.389	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](N(C)CCc2scnc2C)C1	ZINC001191763451	1367580244	/nfs/dbraw/zinc/58/02/44/1367580244.db2.gz	LPFPOHRFCCBUCJ-QGZVFWFLSA-N	0	3	347.528	3.110	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)CCCC(C)(C)C)C1	ZINC001191807628	1367595985	/nfs/dbraw/zinc/59/59/85/1367595985.db2.gz	SOVSWHPAICBJQY-IAGOWNOFSA-N	0	3	326.525	3.335	20	30		EGEDHN
CC#CCN1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)CC(C)C)C1	ZINC001186166143	1387888029	/nfs/dbraw/zinc/88/80/29/1387888029.db2.gz	QOAVRGXNUBQBDS-UYAOXDASSA-N	0	3	344.474	3.417	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](N(C)Cc2ccc(COC)cc2)C1	ZINC001191867459	1367619033	/nfs/dbraw/zinc/61/90/33/1367619033.db2.gz	BOCRKCSQKSINKN-PXNSSMCTSA-N	0	3	344.499	3.468	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H](N(C)Cc2ccc(COC)cc2)C1	ZINC001191867460	1367619300	/nfs/dbraw/zinc/61/93/00/1367619300.db2.gz	BOCRKCSQKSINKN-XLIONFOSSA-N	0	3	344.499	3.468	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@H](N(C)Cc2ccc3c(c2)COC3)C1	ZINC001191911332	1367634678	/nfs/dbraw/zinc/63/46/78/1367634678.db2.gz	FBBZAUKZRRCRLN-JXFKEZNVSA-N	0	3	342.483	3.352	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001191912033	1367636634	/nfs/dbraw/zinc/63/66/34/1367636634.db2.gz	MFINNAQITWCBTB-QFBILLFUSA-N	0	3	325.456	3.193	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](N(C)CCOc3ccccc3C)C2)C1	ZINC001192257047	1367732336	/nfs/dbraw/zinc/73/23/36/1367732336.db2.gz	LSUBIVWNDDRZSB-GOSISDBHSA-N	0	3	342.483	3.263	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)CC/C=C/c2ccccc2)C1	ZINC001192326869	1367754311	/nfs/dbraw/zinc/75/43/11/1367754311.db2.gz	UBCWDIGZEFCPTA-WUTDNEBXSA-N	0	3	342.483	3.215	20	30		EGEDHN
O=C(C#CC1CC1)N[C@@H]1C[C@H]2CC[C@@H]1N2CCc1ccc(Cl)cc1	ZINC001110540192	1367820238	/nfs/dbraw/zinc/82/02/38/1367820238.db2.gz	HSMBCEHBBXHSCQ-QRVBRYPASA-N	0	3	342.870	3.017	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H]1CCC(C)=C(C)C1)C2	ZINC001110585653	1367850084	/nfs/dbraw/zinc/85/00/84/1367850084.db2.gz	HGYKIHRCENEUPL-MANSERQUSA-N	0	3	332.488	3.047	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccc(CO)cc1	ZINC001110933753	1368103595	/nfs/dbraw/zinc/10/35/95/1368103595.db2.gz	PYMWFUKYAPKSJQ-OBZTUIKSSA-N	0	3	342.483	3.003	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCc1scnc1C	ZINC001111073334	1368153880	/nfs/dbraw/zinc/15/38/80/1368153880.db2.gz	FICNYVAGTLMHQE-OAGGEKHMSA-N	0	3	347.528	3.318	20	30		EGEDHN
CCCCCCCOC(=O)Nc1cnccc1N1CCN(C)CC1	ZINC001193994062	1368162892	/nfs/dbraw/zinc/16/28/92/1368162892.db2.gz	UYSMZLQOZIEVKV-UHFFFAOYSA-N	0	3	334.464	3.352	20	30		EGEDHN
C=C[C@@H](CC(=O)N1CC[C@@H](N(C)CCOC(C)C)C1)c1ccccc1	ZINC001194199372	1368206405	/nfs/dbraw/zinc/20/64/05/1368206405.db2.gz	BTZHEOKAVBEWBP-AZUAARDMSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N1CC[C@@H](N(C)Cc2cc3ccccc3o2)C1	ZINC001194397201	1368252113	/nfs/dbraw/zinc/25/21/13/1368252113.db2.gz	QONNYDUYXCJGBX-DOTOQJQBSA-N	0	3	342.439	3.057	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)C[C@H]2CCCCC2(C)C)C1	ZINC001194532493	1368280775	/nfs/dbraw/zinc/28/07/75/1368280775.db2.gz	TVEGBDSYOOZNOG-QZTJIDSGSA-N	0	3	336.520	3.328	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](C)CCCc1ccccc1)C2	ZINC001111477812	1368315258	/nfs/dbraw/zinc/31/52/58/1368315258.db2.gz	AIALQLOBUFJOHK-WLRLJWMZSA-N	0	3	338.495	3.390	20	30		EGEDHN
C#CCCN1CC[C@]2(C1)C[C@H](NC(=O)CC(C)C)c1ccccc1O2	ZINC001111530669	1368330942	/nfs/dbraw/zinc/33/09/42/1368330942.db2.gz	XTNVYOATEWFVQD-GHTZIAJQSA-N	0	3	340.467	3.140	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1(CC=C)CCC1)C[C@H](C)O2	ZINC001111548493	1368340796	/nfs/dbraw/zinc/34/07/96/1368340796.db2.gz	FZLXBDGRESRWNH-KRWDZBQOSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H](CC)CC(C)C)C[C@H](C)O2	ZINC001111552427	1368343487	/nfs/dbraw/zinc/34/34/87/1368343487.db2.gz	DXXBBOFWMZIICY-ZWKOTPCHSA-N	0	3	336.520	3.327	20	30		EGEDHN
Cc1ccc(C)c([C@@H](C)N2CCCN(C(=O)CSCC#N)CC2)c1	ZINC001194918916	1368347012	/nfs/dbraw/zinc/34/70/12/1368347012.db2.gz	FMMVLXJNQTZEKW-QGZVFWFLSA-N	0	3	345.512	3.156	20	30		EGEDHN
C#CCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1cc(F)ccc1C)C2	ZINC001111730065	1368431814	/nfs/dbraw/zinc/43/18/14/1368431814.db2.gz	UAOZAOKJNFONQA-RXVVDRJESA-N	0	3	342.458	3.408	20	30		EGEDHN
C#CCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(F)cc1C)C2	ZINC001111729494	1368432360	/nfs/dbraw/zinc/43/23/60/1368432360.db2.gz	RFTABGRWNZSIPP-RXVVDRJESA-N	0	3	342.458	3.408	20	30		EGEDHN
CC#CCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1cccnc1C)C2	ZINC001111846232	1368499925	/nfs/dbraw/zinc/49/99/25/1368499925.db2.gz	WVJXZFLMGYYBOV-FPOVZHCZSA-N	0	3	339.483	3.054	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CCCN(Cc2cccc(C)c2)CC1)OCC	ZINC001196018051	1368537536	/nfs/dbraw/zinc/53/75/36/1368537536.db2.gz	IAYIXBWUNLYVHI-FQEVSTJZSA-N	0	3	344.499	3.401	20	30		EGEDHN
C#CCC1(C(=O)N2CCCN(CCc3cccs3)CC2)CCC1	ZINC001196107490	1368550762	/nfs/dbraw/zinc/55/07/62/1368550762.db2.gz	OTACUAPFDNJHBV-UHFFFAOYSA-N	0	3	330.497	3.019	20	30		EGEDHN
C#CCN1C[C@@H]2CCC[C@]2(NC(=O)CCCCc2ccc(C)cc2)C1	ZINC001112017424	1368621333	/nfs/dbraw/zinc/62/13/33/1368621333.db2.gz	FLUSBUVNIJDPFA-UNMCSNQZSA-N	0	3	338.495	3.312	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)[C@H]2CCC(C)=C(C)C2)C[C@H]1C(F)(F)F	ZINC001112107181	1368661317	/nfs/dbraw/zinc/66/13/17/1368661317.db2.gz	RLEMMFISPIXPCS-ARFHVFGLSA-N	0	3	342.405	3.125	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)C(C)(C)CC(F)F)C[C@H]1C(F)(F)F	ZINC001112113407	1368664324	/nfs/dbraw/zinc/66/43/24/1368664324.db2.gz	SFVMMQXZKVCNJL-GHMZBOCLSA-N	0	3	342.352	3.223	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cnn(C(F)F)c2)CC1	ZINC001197560187	1368839752	/nfs/dbraw/zinc/83/97/52/1368839752.db2.gz	LTJPWWWYKKDPAD-UHFFFAOYSA-N	0	3	342.434	3.397	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)C(C)(C)CC(C)C)C1	ZINC001197604609	1368853154	/nfs/dbraw/zinc/85/31/54/1368853154.db2.gz	PBGYLHFROFRMGQ-IAGOWNOFSA-N	0	3	326.525	3.190	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cnn(C(C)C)c2)CC1	ZINC001197795213	1368898672	/nfs/dbraw/zinc/89/86/72/1368898672.db2.gz	TXNFPBXMEQYOEC-UHFFFAOYSA-N	0	3	332.492	3.358	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@H](C)c2ccc(C)cc2)C1	ZINC001197858588	1368915001	/nfs/dbraw/zinc/91/50/01/1368915001.db2.gz	CEEAYESVZORSOB-MISYRCLQSA-N	0	3	344.499	3.006	20	30		EGEDHN
CCCCCCCCC(=O)N1CCCN(CCC[C@H](C)O)CC1	ZINC001197928645	1368926337	/nfs/dbraw/zinc/92/63/37/1368926337.db2.gz	KHAIYDQBFVEOHR-SFHVURJKSA-N	0	3	326.525	3.432	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N1CCCN([C@H](C)c2ccccc2C)CC1	ZINC001198344193	1369013581	/nfs/dbraw/zinc/01/35/81/1369013581.db2.gz	RASKVZQGEFXPBU-MSOLQXFVSA-N	0	3	330.472	3.181	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)c1ccncc1)c1ccccc1OC	ZINC001198491585	1369044035	/nfs/dbraw/zinc/04/40/35/1369044035.db2.gz	IZHULCCENFNQRC-GOSISDBHSA-N	0	3	339.439	3.117	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)C[C@H](OCC)C2=CCCC2)CC1	ZINC001112856465	1369050080	/nfs/dbraw/zinc/05/00/80/1369050080.db2.gz	MBLIKCGLJJKRKX-HKUYNNGSSA-N	0	3	334.504	3.391	20	30		EGEDHN
COc1ccccc1[C@H](CNC(=O)[C@H](C)C#N)NCCC(C)(C)C	ZINC001198617995	1369074591	/nfs/dbraw/zinc/07/45/91/1369074591.db2.gz	VEXQNSBYOFAYBC-ZBFHGGJFSA-N	0	3	331.460	3.038	20	30		EGEDHN
C#CCCCC(=O)NC[C@H](NCCCCC)c1ccccc1OC	ZINC001198695826	1369092698	/nfs/dbraw/zinc/09/26/98/1369092698.db2.gz	VGQBAHHPWTZGPR-SFHVURJKSA-N	0	3	330.472	3.436	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)[C@H]2CCc3cc(OC)ccc32)CC1	ZINC001112929851	1369094507	/nfs/dbraw/zinc/09/45/07/1369094507.db2.gz	PXNHYOQDRPWZRY-JXFKEZNVSA-N	0	3	342.483	3.224	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)c1[nH]ccc1C)c1ccccc1OC	ZINC001198704809	1369094923	/nfs/dbraw/zinc/09/49/23/1369094923.db2.gz	LTOUIRKVUJWLNY-KRWDZBQOSA-N	0	3	341.455	3.359	20	30		EGEDHN
COc1ccccc1[C@H](CNC(=O)C#CC(C)(C)C)NCCC1CC1	ZINC001198723905	1369099606	/nfs/dbraw/zinc/09/96/06/1369099606.db2.gz	MFQVWFVBHDYWJW-SFHVURJKSA-N	0	3	342.483	3.292	20	30		EGEDHN
C#CCC1(C(=O)NC[C@@H](NCC(C)C)c2ccccc2OC)CCC1	ZINC001198752191	1369105090	/nfs/dbraw/zinc/10/50/90/1369105090.db2.gz	NHTOIJQTMDBOPR-GOSISDBHSA-N	0	3	342.483	3.292	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NC[C@@H](NC(C)C)c1ccccc1OC)OCC	ZINC001198751906	1369105188	/nfs/dbraw/zinc/10/51/88/1369105188.db2.gz	KMKCWUOCGNEZIV-MJGOQNOKSA-N	0	3	348.487	3.222	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NC[C@H](NC(C)C)c1ccccc1OC	ZINC001198820186	1369121913	/nfs/dbraw/zinc/12/19/13/1369121913.db2.gz	YWRCXKREVWGONT-PXNSSMCTSA-N	0	3	348.487	3.079	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)Cc2ccc3c(c2)CCCO3)CC1	ZINC001112991545	1369126540	/nfs/dbraw/zinc/12/65/40/1369126540.db2.gz	PNHHQCGKBUHTNL-KRWDZBQOSA-N	0	3	342.483	3.053	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@H](NC(C)C)c1ccccc1OC	ZINC001198842333	1369127384	/nfs/dbraw/zinc/12/73/84/1369127384.db2.gz	IFGGHQWZRDBDTF-SFHVURJKSA-N	0	3	330.472	3.434	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)c1conc1C)c1ccccc1OC	ZINC001198875877	1369137421	/nfs/dbraw/zinc/13/74/21/1369137421.db2.gz	LCOXEAHNAIZRMW-QGZVFWFLSA-N	0	3	343.427	3.019	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@H](NCCCOC)c1ccccc1OC	ZINC001198885113	1369139504	/nfs/dbraw/zinc/13/95/04/1369139504.db2.gz	AWUUJKALKDCEER-PXNSSMCTSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@@H](NCC1CC1)c1ccccc1OC	ZINC001198885748	1369140258	/nfs/dbraw/zinc/14/02/58/1369140258.db2.gz	RIERIJUXBLEHJO-YLJYHZDGSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)C1(C(C)C)CC1)c1ccccc1OC	ZINC001198903099	1369144814	/nfs/dbraw/zinc/14/48/14/1369144814.db2.gz	UTKVWJBQVNGRDX-QGZVFWFLSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@H]1CC12CCC2)c1ccccc1OC	ZINC001198925851	1369150700	/nfs/dbraw/zinc/15/07/00/1369150700.db2.gz	YQIYSYNTTQSZNZ-SJORKVTESA-N	0	3	328.456	3.208	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@@H]1C[C@H]1C1CC1)c1ccccc1OC	ZINC001198932639	1369152057	/nfs/dbraw/zinc/15/20/57/1369152057.db2.gz	QXNYPAFSUGYKNB-RCCFBDPRSA-N	0	3	328.456	3.064	20	30		EGEDHN
C=C[C@@H](C(=O)N[C@@H]1CN(CCCCCCC)C[C@H]1O)c1ccccc1	ZINC001198956013	1369158410	/nfs/dbraw/zinc/15/84/10/1369158410.db2.gz	OGHVULXIEMKQAP-VAMGGRTRSA-N	0	3	344.499	3.088	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)[C@H](C)CCOC)c1ccccc1OC	ZINC001198994384	1369168821	/nfs/dbraw/zinc/16/88/21/1369168821.db2.gz	YCPPSQJXBBBADW-AEFFLSMTSA-N	0	3	348.487	3.081	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@@H]2CCCCC2(C)C)C1	ZINC001199226778	1369194714	/nfs/dbraw/zinc/19/47/14/1369194714.db2.gz	KNCLUFRFAITUOY-RCCFBDPRSA-N	0	3	338.536	3.335	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)c2c[nH]c(=O)c3ccccc23)CC1	ZINC001113404005	1369401786	/nfs/dbraw/zinc/40/17/86/1369401786.db2.gz	XAHMARXITMHAFO-HNNXBMFYSA-N	0	3	339.439	3.053	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCC(NC/C(Cl)=C/Cl)CC1	ZINC001201060201	1369474224	/nfs/dbraw/zinc/47/42/24/1369474224.db2.gz	NGNRCXHVDFYDEW-QBFSEMIESA-N	0	3	342.270	3.187	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCCO[C@H](CNCc2cccc(F)c2)C1	ZINC001201209608	1369496308	/nfs/dbraw/zinc/49/63/08/1369496308.db2.gz	BOZGYVLASWOERW-QFBILLFUSA-N	0	3	348.462	3.135	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)CCOCc2ccccc2)CC1	ZINC001113648322	1369542550	/nfs/dbraw/zinc/54/25/50/1369542550.db2.gz	DOJOLFYVOQXIBQ-SFHVURJKSA-N	0	3	330.472	3.092	20	30		EGEDHN
CC#CCNC[C@@H]1CN(C(=O)[C@@H](CCC)CC2CCCC2)CCCO1	ZINC001201546706	1369572391	/nfs/dbraw/zinc/57/23/91/1369572391.db2.gz	MHUFCCMQKGHUAN-VQTJNVASSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)Cc2cc3ccccc3n2C)CC1	ZINC001113699886	1369573065	/nfs/dbraw/zinc/57/30/65/1369573065.db2.gz	ZHEOGJSUWNVTQR-KRWDZBQOSA-N	0	3	339.483	3.220	20	30		EGEDHN
C=C[C@H](COC)NCc1ccc(-n2ccc(C(F)(F)F)n2)cc1	ZINC001325620304	1388013865	/nfs/dbraw/zinc/01/38/65/1388013865.db2.gz	VBWXBSYZYHZXRH-CYBMUJFWSA-N	0	3	325.334	3.182	20	30		EGEDHN
CCCCCCCCN1CCN(CCNC(=O)OC(C)(C)C)CC1	ZINC001201804770	1369627525	/nfs/dbraw/zinc/62/75/25/1369627525.db2.gz	SDZFVQQFXZTPAQ-UHFFFAOYSA-N	0	3	341.540	3.489	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)N1CCC(NCc2ccn(C(C)C)n2)CC1	ZINC001202085568	1369685113	/nfs/dbraw/zinc/68/51/13/1369685113.db2.gz	VYUHIHGQWKVJBK-HZPDHXFCSA-N	0	3	332.492	3.003	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC(NCc2ccn(C(C)C)n2)CC1	ZINC001202122399	1369691490	/nfs/dbraw/zinc/69/14/90/1369691490.db2.gz	AENBCPZXAPFHJH-INIZCTEOSA-N	0	3	332.492	3.147	20	30		EGEDHN
C=CCCCC(=O)N1CCC(NCc2nc3ccccc3o2)CC1	ZINC001202245368	1369721949	/nfs/dbraw/zinc/72/19/49/1369721949.db2.gz	JIWCNYGDKYECME-UHFFFAOYSA-N	0	3	327.428	3.265	20	30		EGEDHN
O=C(N[C@H]1C[C@H](NCC#Cc2ccccc2Cl)C12CCC2)C1CC1	ZINC001202282272	1369729083	/nfs/dbraw/zinc/72/90/83/1369729083.db2.gz	ZVPLXOCGAYEHCV-ROUUACIJSA-N	0	3	342.870	3.119	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@@H](NCC#Cc2ccc(F)cc2)C12CCC2	ZINC001202591590	1369815681	/nfs/dbraw/zinc/81/56/81/1369815681.db2.gz	PFZZFNYKPFCQOK-MOPGFXCFSA-N	0	3	340.442	3.160	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@@H](NCc2cnc(Cl)s2)C12CCC2	ZINC001202593156	1369817028	/nfs/dbraw/zinc/81/70/28/1369817028.db2.gz	XXHPRURDIACBRU-CHWSQXEVSA-N	0	3	339.892	3.280	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@H](NCc2oc(CCC)nc2C)C12CCC2	ZINC001202597862	1369818604	/nfs/dbraw/zinc/81/86/04/1369818604.db2.gz	BRPLNAFUVCTEQL-IRXDYDNUSA-N	0	3	345.487	3.419	20	30		EGEDHN
CC[C@@H](c1ccc(Cl)cc1)N1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)C#CC(C)C	ZINC001114247108	1369826497	/nfs/dbraw/zinc/82/64/97/1369826497.db2.gz	DZHFKDNPSIOJCG-HLNWXESRSA-N	0	3	344.886	3.497	20	30		EGEDHN
O=C(N[C@@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2)C1CC=CC1	ZINC001202644337	1369835855	/nfs/dbraw/zinc/83/58/55/1369835855.db2.gz	UTWZDFLERLONRX-VQTJNVASSA-N	0	3	334.463	3.021	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H]1C[C@@H](NCc2ccc(F)cc2F)C12CCC2	ZINC001202867761	1369911868	/nfs/dbraw/zinc/91/18/68/1369911868.db2.gz	UJKPXJKJCQEAJJ-MSOLQXFVSA-N	0	3	346.421	3.141	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1C[C@@H](NCc2ccccc2F)C12CCC2	ZINC001202867369	1369911905	/nfs/dbraw/zinc/91/19/05/1369911905.db2.gz	QIPADEKRJKAAKD-QZTJIDSGSA-N	0	3	328.431	3.002	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1C[C@@H](NCc2ccccn2)C12CCC2	ZINC001202952286	1369934588	/nfs/dbraw/zinc/93/45/88/1369934588.db2.gz	VMQQSHGYDBGOJR-MOPGFXCFSA-N	0	3	339.483	3.367	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1C[C@@H](NCc2conc2CC)C12CCC2	ZINC001202986150	1369945971	/nfs/dbraw/zinc/94/59/71/1369945971.db2.gz	GYPZWGXKOUCNBX-SJORKVTESA-N	0	3	331.460	3.110	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1C[C@H](NCc2c(C)noc2CC)C12CCC2	ZINC001202986114	1369946257	/nfs/dbraw/zinc/94/62/57/1369946257.db2.gz	GSJPBVQNGCNEJY-ZWKOTPCHSA-N	0	3	345.487	3.419	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)CCc2cncc(C)c2)C12CCC2	ZINC001203161511	1370005912	/nfs/dbraw/zinc/00/59/12/1370005912.db2.gz	RITACRFZDWXXGQ-SJORKVTESA-N	0	3	347.890	3.092	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1[C@H]2CN(Cc3cccc(OC(C)C)c3)C[C@H]21	ZINC001114670860	1370017445	/nfs/dbraw/zinc/01/74/45/1370017445.db2.gz	AGXGSKDWIVZKNY-BWTSREIZSA-N	0	3	342.483	3.232	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1[C@H]2CN([C@@H](C)c3ccc(F)cc3)C[C@H]21	ZINC001114710489	1370039950	/nfs/dbraw/zinc/03/99/50/1370039950.db2.gz	DROVIGHCTFMWOV-FEUVXWNVSA-N	0	3	328.431	3.127	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(OC)c(C)c3)C[C@H]21	ZINC001114725047	1370046978	/nfs/dbraw/zinc/04/69/78/1370046978.db2.gz	XOAPCMXIGSEZMD-WOGUSJMUSA-N	0	3	342.483	3.152	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1[C@H]2CN(Cc3cccc(OC)c3C)C[C@H]21	ZINC001114792064	1370083473	/nfs/dbraw/zinc/08/34/73/1370083473.db2.gz	NWAJMGZSPSOXCM-QRKMNUTDSA-N	0	3	342.483	3.152	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2C[C@@H](NCc3ccns3)C23CCC3)CCC1	ZINC001203366910	1370100639	/nfs/dbraw/zinc/10/06/39/1370100639.db2.gz	PMRUXJLJDJVJJA-HZPDHXFCSA-N	0	3	345.512	3.407	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1C[C@@H](NCc2oc(C)nc2C)C12CCC2	ZINC001203451599	1370131347	/nfs/dbraw/zinc/13/13/47/1370131347.db2.gz	KCTGMZLLGGGYCI-IAGOWNOFSA-N	0	3	345.487	3.411	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)CCCc2cccnc2)C12CCC2	ZINC001203554329	1370167920	/nfs/dbraw/zinc/16/79/20/1370167920.db2.gz	BZRCIVYYSGSNBA-SJORKVTESA-N	0	3	347.890	3.174	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001203757094	1370251137	/nfs/dbraw/zinc/25/11/37/1370251137.db2.gz	IBUQDIFTIOHVGH-HXUWFJFHSA-N	0	3	339.439	3.169	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CC2)C(=O)Nc2c3cccc2F)c1	ZINC001203760066	1370252830	/nfs/dbraw/zinc/25/28/30/1370252830.db2.gz	BDQUGHUWHVRKRD-UHFFFAOYSA-N	0	3	335.382	3.183	20	30		EGEDHN
C=CCO[C@H]1CO[C@]2(C1)CCCN(Cc1ccc(OC)c(C)c1)C2	ZINC001203896156	1370304524	/nfs/dbraw/zinc/30/45/24/1370304524.db2.gz	HWQFDPWUMRAVFM-QUCCMNQESA-N	0	3	331.456	3.330	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2[C@H]3CN(Cc4ccsc4)C[C@H]32)CCCCC1	ZINC001115327047	1370388610	/nfs/dbraw/zinc/38/86/10/1370388610.db2.gz	YVQXQDWOHVMPKO-PIIMJCKOSA-N	0	3	342.508	3.268	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)C2CCC2)CCCCC1	ZINC001115376725	1370416344	/nfs/dbraw/zinc/41/63/44/1370416344.db2.gz	YJSJQKOYCSAJQZ-UHFFFAOYSA-N	0	3	329.282	3.104	20	30		EGEDHN
C=CCOc1ccc(CN2CC[C@@H](Oc3ccnc(OC)c3)C2)cc1	ZINC001204302510	1370437611	/nfs/dbraw/zinc/43/76/11/1370437611.db2.gz	LCPFIVVBAFPUBS-LJQANCHMSA-N	0	3	340.423	3.308	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@H]2[C@@H](CCN2Cc2nccs2)C1	ZINC001204370739	1370456620	/nfs/dbraw/zinc/45/66/20/1370456620.db2.gz	JXJHFMVDYADNSS-ROUUACIJSA-N	0	3	338.480	3.111	20	30		EGEDHN
CC(=O)n1cc(CN2CCC3SC(=O)C=C3C2)c2ccccc21	ZINC001204409936	1370468958	/nfs/dbraw/zinc/46/89/58/1370468958.db2.gz	XGMZGFPQHUARDO-QGZVFWFLSA-N	0	3	326.421	3.076	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)C2CC(C)C2)CCCCC1	ZINC001115475805	1370482253	/nfs/dbraw/zinc/48/22/53/1370482253.db2.gz	QDUDYKCKTWSERP-UHFFFAOYSA-N	0	3	343.309	3.350	20	30		EGEDHN
CC1(C(=O)NCC2(NCc3cc(C#N)ccc3F)CCCCC2)CC1	ZINC001115548643	1370545429	/nfs/dbraw/zinc/54/54/29/1370545429.db2.gz	PYHNFDGJKZQCHD-UHFFFAOYSA-N	0	3	343.446	3.406	20	30		EGEDHN
C=CCCC(=O)N1CCC(CNCc2nc3ccc(F)cc3o2)CC1	ZINC001204753972	1370567008	/nfs/dbraw/zinc/56/70/08/1370567008.db2.gz	VEACWHBWZGBRIP-UHFFFAOYSA-N	0	3	345.418	3.261	20	30		EGEDHN
CS[C@@H](C)CC(=O)N1CCC(CNCc2ccccc2C#N)CC1	ZINC001205027634	1370633457	/nfs/dbraw/zinc/63/34/57/1370633457.db2.gz	VXSHBWHCMZNLHO-HNNXBMFYSA-N	0	3	345.512	3.028	20	30		EGEDHN
C#Cc1ccc(C(=O)NCC2(NCC(=C)Cl)CCCCC2)cc1	ZINC001115658763	1370643957	/nfs/dbraw/zinc/64/39/57/1370643957.db2.gz	HPBBHEKREZBXMW-UHFFFAOYSA-N	0	3	330.859	3.443	20	30		EGEDHN
C=CC(C)(C)C(=O)NCC1(NCc2cccnc2OC)CCCCC1	ZINC001115667081	1370647822	/nfs/dbraw/zinc/64/78/22/1370647822.db2.gz	RAEQEXFHXNQCPZ-UHFFFAOYSA-N	0	3	345.487	3.211	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC1(NCc2nccnc2C)CCCCC1	ZINC001115712734	1370692387	/nfs/dbraw/zinc/69/23/87/1370692387.db2.gz	ZWLIRTLZHGTAIN-LJQANCHMSA-N	0	3	344.503	3.296	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C=C(C)C)CC[C@H]1c1ccc(F)cc1	ZINC001205244438	1370693748	/nfs/dbraw/zinc/69/37/48/1370693748.db2.gz	CHVHTGLLFVQUPI-RBUKOAKNSA-N	0	3	328.431	3.089	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C(C)(C)CC(C)C)C[C@H]1c1cccc(F)c1	ZINC001205448497	1370759388	/nfs/dbraw/zinc/75/93/88/1370759388.db2.gz	GDKSXJAYARNCSL-RBUKOAKNSA-N	0	3	344.474	3.415	20	30		EGEDHN
CC(C)(C)/C=C\C(=O)N1CC[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001187357449	1388098892	/nfs/dbraw/zinc/09/88/92/1388098892.db2.gz	UQWOMLSDLKBGOP-ZXGCVLBKSA-N	0	3	337.467	3.193	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CCCN(Cc3scnc3C)C2)CC1	ZINC001206863640	1371194469	/nfs/dbraw/zinc/19/44/69/1371194469.db2.gz	ORYXNXDYWYCBFF-UHFFFAOYSA-N	0	3	349.500	3.452	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CN(CCCCC(F)(F)F)C[C@H]1C	ZINC001206885191	1371206476	/nfs/dbraw/zinc/20/64/76/1371206476.db2.gz	YZLKGSRBPVBRGB-HUUCEWRRSA-N	0	3	332.410	3.349	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CN(Cc2cccc(OC(C)C)c2)C[C@H]1C	ZINC001206912257	1371221400	/nfs/dbraw/zinc/22/14/00/1371221400.db2.gz	CHLDSEMRKOODBS-YLJYHZDGSA-N	0	3	342.483	3.214	20	30		EGEDHN
CCCc1ccc(CN2C[C@@H](C)[C@H](NC(=O)C#CC(C)C)C2)cc1	ZINC001206946174	1371239714	/nfs/dbraw/zinc/23/97/14/1371239714.db2.gz	NIXWYQPBJRNTPJ-YLJYHZDGSA-N	0	3	326.484	3.235	20	30		EGEDHN
COc1cccc([C@@H](C)N2C[C@@H](C)[C@H](NC(=O)C#CC(C)(C)C)C2)c1	ZINC001206949473	1371241057	/nfs/dbraw/zinc/24/10/57/1371241057.db2.gz	FFMLRLSLUVANMK-GPMSIDNRSA-N	0	3	342.483	3.242	20	30		EGEDHN
O=C(C1CCCC1)N1CCC[C@@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207023000	1371270297	/nfs/dbraw/zinc/27/02/97/1371270297.db2.gz	ZWSXSLGSMGKWOP-LJQANCHMSA-N	0	3	344.886	3.462	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CN(CCOCc2ccccc2)C[C@H]1C	ZINC001207172193	1371319701	/nfs/dbraw/zinc/31/97/01/1371319701.db2.gz	QOQZVARWMFKDDI-IEBWSBKVSA-N	0	3	344.499	3.242	20	30		EGEDHN
CC(C)CCC(=O)N1CCC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001207222140	1371333626	/nfs/dbraw/zinc/33/36/26/1371333626.db2.gz	NLAPTCLURBLNQN-QGZVFWFLSA-N	0	3	331.435	3.214	20	30		EGEDHN
CS(=O)(=O)C[C@@H](NCCCCC1(C#N)CCC1)c1ccccc1	ZINC001119695263	1371389076	/nfs/dbraw/zinc/38/90/76/1371389076.db2.gz	GUFWXMBXXZKDPH-QGZVFWFLSA-N	0	3	334.485	3.226	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H](C)c2cccnc2)CCCCC1	ZINC001120020337	1371457476	/nfs/dbraw/zinc/45/74/76/1371457476.db2.gz	AVCSNDLZHANHSB-HNNXBMFYSA-N	0	3	335.879	3.346	20	30		EGEDHN
C=CCOCC(=O)N1CCC[C@@H](N[C@@H](C)c2ccccc2Cl)C1	ZINC001207679702	1371473242	/nfs/dbraw/zinc/47/32/42/1371473242.db2.gz	CKSMGGVLNBVFFB-LSDHHAIUSA-N	0	3	336.863	3.184	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H](NCC#Cc2ccccc2Cl)C1)C1CC1	ZINC001207743780	1371491460	/nfs/dbraw/zinc/49/14/60/1371491460.db2.gz	FUKWYUHXGKJSFI-YJBOKZPZSA-N	0	3	344.886	3.318	20	30		EGEDHN
C#CCCCCC(=O)N1CCC[C@H](NCc2cccc(C(C)C)n2)C1	ZINC001207859575	1371521499	/nfs/dbraw/zinc/52/14/99/1371521499.db2.gz	BGVAWYNQBDNSJU-IBGZPJMESA-N	0	3	341.499	3.479	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H]([C@H]2CCCN2Cc2cncc(F)c2)C1	ZINC001120348224	1371542769	/nfs/dbraw/zinc/54/27/69/1371542769.db2.gz	RORXDOZAJAGNNR-PKOBYXMFSA-N	0	3	345.462	3.390	20	30		EGEDHN
CC/C(C)=C\C(=O)N1CCC[C@@H](NCc2cc(C#N)ccc2OC)C1	ZINC001208002651	1371565131	/nfs/dbraw/zinc/56/51/31/1371565131.db2.gz	XCWIDKNWEDPQGT-QWSHFYNQSA-N	0	3	341.455	3.004	20	30		EGEDHN
C#CCOCCC(=O)N1CCC[C@@H](N[C@H](C)c2ccccc2Cl)C1	ZINC001208029493	1371573937	/nfs/dbraw/zinc/57/39/37/1371573937.db2.gz	XKRFOMCVGSXABV-HZPDHXFCSA-N	0	3	348.874	3.022	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC[C@H](NCc2cccc(NC(C)=O)c2)C1	ZINC001208252925	1371683857	/nfs/dbraw/zinc/68/38/57/1371683857.db2.gz	PZUOJTIKLDGIEB-IBGZPJMESA-N	0	3	343.471	3.082	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN([C@@H](C)c2cccc(OC)c2)C[C@H]1C	ZINC001208318008	1371715385	/nfs/dbraw/zinc/71/53/85/1371715385.db2.gz	FLHKQUJXUBEJTD-RVKKMQEKSA-N	0	3	330.472	3.405	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN([C@H](C)c2cccc(OC)c2)C[C@H]1C	ZINC001208318007	1371715798	/nfs/dbraw/zinc/71/57/98/1371715798.db2.gz	FLHKQUJXUBEJTD-IIDMSEBBSA-N	0	3	330.472	3.405	20	30		EGEDHN
C#CCC1(C(=O)N2CCC[C@@H](NCc3c(C)nsc3C)C2)CCC1	ZINC001208319254	1371716797	/nfs/dbraw/zinc/71/67/97/1371716797.db2.gz	PNKURRYNSUIHOP-MRXNPFEDSA-N	0	3	345.512	3.034	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCC[C@@H](NCC=C(Cl)Cl)C1	ZINC001208337544	1371724264	/nfs/dbraw/zinc/72/42/64/1371724264.db2.gz	MBVAGTFZOXXJOX-CYBMUJFWSA-N	0	3	342.270	3.187	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1CN(Cc2ccccc2N(C)C)C[C@H]1C	ZINC001208393690	1371751741	/nfs/dbraw/zinc/75/17/41/1371751741.db2.gz	WXDBQCZGTRAZBV-ZIFCJYIRSA-N	0	3	343.515	3.291	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CCOc3ccccc3)C[C@H]2C)CCC1	ZINC001208507667	1371791669	/nfs/dbraw/zinc/79/16/69/1371791669.db2.gz	XFOYNAMUNJIOOS-IEBWSBKVSA-N	0	3	342.483	3.248	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1CN(Cc2cccc(N(C)C)c2)C[C@H]1C	ZINC001208508888	1371792683	/nfs/dbraw/zinc/79/26/83/1371792683.db2.gz	KFDKUBRHZMPRIJ-BSIFCXSSSA-N	0	3	343.515	3.291	20	30		EGEDHN
CC(C)(C)C#CC(=O)NC1CC2(CC(NC/C(Cl)=C\Cl)C2)C1	ZINC001121091551	1371852543	/nfs/dbraw/zinc/85/25/43/1371852543.db2.gz	KMYNIEBVQPHHER-ZRDIBKRKSA-N	0	3	343.298	3.372	20	30		EGEDHN
CCOC(=O)[C@H]1CCCc2sc(NC3=CCN(C)CC3)c(C#N)c21	ZINC001208720152	1371872650	/nfs/dbraw/zinc/87/26/50/1371872650.db2.gz	YMPKWXISKUXBEF-ZDUSSCGKSA-N	0	3	345.468	3.234	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)C[C@@H](OCC)C(C)C)C2	ZINC001121232707	1371902247	/nfs/dbraw/zinc/90/22/47/1371902247.db2.gz	IDYGBPACVWUBMT-LMBQMVEXSA-N	0	3	342.911	3.207	20	30		EGEDHN
N#Cc1cccc(CCCN2CCCN(C(=O)c3ccccc3)CC2)c1	ZINC001208851130	1371918396	/nfs/dbraw/zinc/91/83/96/1371918396.db2.gz	RIIBBHILRBVRPP-UHFFFAOYSA-N	0	3	347.462	3.339	20	30		EGEDHN
N#Cc1cccc(CCCN2CCN(c3cc(Cl)ccn3)CC2)c1	ZINC001208853713	1371919336	/nfs/dbraw/zinc/91/93/36/1371919336.db2.gz	TUYFKQMUPWAKLY-UHFFFAOYSA-N	0	3	340.858	3.361	20	30		EGEDHN
N#Cc1ccc(CCN2CCC(Oc3cc(Cl)ncn3)CC2)cc1	ZINC001208926611	1371947307	/nfs/dbraw/zinc/94/73/07/1371947307.db2.gz	WEHRPTILZKHLDM-UHFFFAOYSA-N	0	3	342.830	3.088	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CN(CCOCc2ccccc2)C[C@H]1C	ZINC001208954299	1371962656	/nfs/dbraw/zinc/96/26/56/1371962656.db2.gz	IKHJEAVRAXIDBD-IEBWSBKVSA-N	0	3	344.499	3.242	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N1CCC[C@@H](NCc2ccc(C#N)s2)C1	ZINC001209102258	1371998657	/nfs/dbraw/zinc/99/86/57/1371998657.db2.gz	VOZVUSITVMWGET-HWIKDYBBSA-N	0	3	329.469	3.223	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@@H](NCc2ccnc(Cl)c2)C1	ZINC001209110884	1372000968	/nfs/dbraw/zinc/00/09/68/1372000968.db2.gz	HRBYSBARKJUDBZ-MRXNPFEDSA-N	0	3	333.863	3.009	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)[C@@H](C)CC2CCCCC2)C1	ZINC001209115967	1372002723	/nfs/dbraw/zinc/00/27/23/1372002723.db2.gz	KSQBNYVQWKYRIB-YQVWRLOYSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@H](NCc2ccc(C#N)s2)C1	ZINC001209146317	1372014423	/nfs/dbraw/zinc/01/44/23/1372014423.db2.gz	NKWUNQNOSPTKAM-CABCVRRESA-N	0	3	331.485	3.303	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@H](NCc2cn(C(C)C)nc2C)C1	ZINC001209155889	1372016916	/nfs/dbraw/zinc/01/69/16/1372016916.db2.gz	GMXLSZTXMJDUHY-IBGZPJMESA-N	0	3	344.503	3.047	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001209192544	1372033028	/nfs/dbraw/zinc/03/30/28/1372033028.db2.gz	ARUSNSGYHVFEGP-QAPCUYQASA-N	0	3	343.446	3.380	20	30		EGEDHN
CCn1ccc(C(=O)N2CCC[C@H](NCC#Cc3ccccc3)C2)c1C	ZINC001209205098	1372037910	/nfs/dbraw/zinc/03/79/10/1372037910.db2.gz	NFINZSYVLNYVCQ-FQEVSTJZSA-N	0	3	349.478	3.062	20	30		EGEDHN
C#CCCCN(Cc1ccncc1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC001209268005	1372055266	/nfs/dbraw/zinc/05/52/66/1372055266.db2.gz	PGVNPOXLRCQTBV-GOSISDBHSA-N	0	3	343.471	3.306	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC1CC2(CC(NCc3nccn3CC)C2)C1	ZINC001121714188	1372056596	/nfs/dbraw/zinc/05/65/96/1372056596.db2.gz	YOGTUKMRUCFTAV-PUFPBPQXSA-N	0	3	344.503	3.022	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@H](NCc2cn(C(C)C)nc2C)C1	ZINC001209373857	1372080915	/nfs/dbraw/zinc/08/09/15/1372080915.db2.gz	GLARZQSMZBDGKN-SFHVURJKSA-N	0	3	332.492	3.209	20	30		EGEDHN
C=CCCCCCCCN1CCCn2cnc(COCCO)c2C1	ZINC001209441678	1372107146	/nfs/dbraw/zinc/10/71/46/1372107146.db2.gz	KUHPIHPPXBGZKI-UHFFFAOYSA-N	0	3	335.492	3.124	20	30		EGEDHN
O=C([C@@H]1CC12CC2)N1CCC[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001209807280	1372203401	/nfs/dbraw/zinc/20/34/01/1372203401.db2.gz	DEIRUHJPXKNXBM-ROUUACIJSA-N	0	3	342.870	3.072	20	30		EGEDHN
O=C([C@H]1CC12CC2)N1CCC[C@@H](NCC#Cc2ccccc2Cl)C1	ZINC001209808950	1372204355	/nfs/dbraw/zinc/20/43/55/1372204355.db2.gz	QOOZJYAFJBRTCP-IAGOWNOFSA-N	0	3	342.870	3.072	20	30		EGEDHN
N#CC(C(=O)c1cnn(CC2CC2)c1)c1nccn1Cc1ccccc1	ZINC001122512911	1372263671	/nfs/dbraw/zinc/26/36/71/1372263671.db2.gz	BRJJMWGZCGKZRQ-SFHVURJKSA-N	0	3	345.406	3.028	20	30		EGEDHN
N#CC(C(=O)c1ccc(F)c2cccnc12)c1nnc2n1CCCCC2	ZINC001122514877	1372264754	/nfs/dbraw/zinc/26/47/54/1372264754.db2.gz	WUDAUAHYZJHCIB-AWEZNQCLSA-N	0	3	349.369	3.182	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CCCN(C)C2)nnc1N(CC)CC1CCC1	ZINC001122631025	1372287238	/nfs/dbraw/zinc/28/72/38/1372287238.db2.gz	LFPCIZUWYBNPLW-KRWDZBQOSA-N	0	3	331.508	3.290	20	30		EGEDHN
C=C(C)CN(C)c1nnc([C@H]2CCCN(C)C2)n1Cc1cccs1	ZINC001123041315	1372368005	/nfs/dbraw/zinc/36/80/05/1372368005.db2.gz	NBDVPECBCJGHAB-HNNXBMFYSA-N	0	3	345.516	3.209	20	30		EGEDHN
CC[C@@H](C)n1ncc(C(=O)C(C#N)c2nccn2CC)c1C1CC1	ZINC001123233821	1372403642	/nfs/dbraw/zinc/40/36/42/1372403642.db2.gz	ODCUDXWICMXTJD-TZMCWYRMSA-N	0	3	325.416	3.438	20	30		EGEDHN
N#CC(C(=O)c1cc(C2CC2)[nH]n1)c1nc2c(cccc2Cl)[nH]1	ZINC001123247116	1372406878	/nfs/dbraw/zinc/40/68/78/1372406878.db2.gz	HKAREKDVNQPXKL-VIFPVBQESA-N	0	3	325.759	3.307	20	30		EGEDHN
Cn1c(Cl)cnc1C(C#N)C(=O)CCCOc1ccccc1F	ZINC001123338307	1372431932	/nfs/dbraw/zinc/43/19/32/1372431932.db2.gz	ZVARCUXGRDDXAR-NSHDSACASA-N	0	3	335.766	3.248	20	30		EGEDHN
CCC(C)(CC)C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001211159005	1372491655	/nfs/dbraw/zinc/49/16/55/1372491655.db2.gz	CCWPTIUHNXMMIQ-LJQANCHMSA-N	0	3	326.484	3.445	20	30		EGEDHN
C=C(CN1CCCCC1)c1nc(-c2cc(OC)ccc2OC)no1	ZINC001211436545	1372558749	/nfs/dbraw/zinc/55/87/49/1372558749.db2.gz	PKCNFAGJLUDYNA-UHFFFAOYSA-N	0	3	329.400	3.253	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@@H](OC(C)C)c2ccccc2)C1	ZINC001211513172	1372571508	/nfs/dbraw/zinc/57/15/08/1372571508.db2.gz	KULBNYXPUBELIO-QRQLOZEOSA-N	0	3	330.472	3.165	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@@]2(C)CC=CCC2)C[C@H]1c1ccccc1	ZINC001211605163	1372589051	/nfs/dbraw/zinc/58/90/51/1372589051.db2.gz	GOESORBMCGSCRA-VWPQPMDRSA-N	0	3	336.479	3.340	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)CCCCC(C)C)C[C@H]1c1ccccc1	ZINC001211690829	1372602992	/nfs/dbraw/zinc/60/29/92/1372602992.db2.gz	MAPSMWHRMAMERM-VQTJNVASSA-N	0	3	326.484	3.420	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@H](CC)CCC)C[C@H]1c1ccccc1	ZINC001211698448	1372604153	/nfs/dbraw/zinc/60/41/53/1372604153.db2.gz	OLUSDQTXRDCWLJ-YZGWKJHDSA-N	0	3	326.484	3.420	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2cc(C)cc(C)n2)[C@H](OC)C1	ZINC001212499098	1372716230	/nfs/dbraw/zinc/71/62/30/1372716230.db2.gz	LKUTVLKJAJIVAI-RTBURBONSA-N	0	3	347.503	3.098	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1CN(CCCc2ccccc2)C[C@H]1OC	ZINC001213380023	1372896986	/nfs/dbraw/zinc/89/69/86/1372896986.db2.gz	IZQGUXSKKLUGBI-SBHAEUEKSA-N	0	3	344.499	3.037	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2CN(CCC3=CCCCC3)C[C@H]2OC)CC1	ZINC001213395084	1372900040	/nfs/dbraw/zinc/90/00/40/1372900040.db2.gz	MIOSAVRZHOBFDK-RTBURBONSA-N	0	3	346.515	3.439	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2ccsc2C(F)F)[C@H](OC)C1	ZINC001213790849	1372962521	/nfs/dbraw/zinc/96/25/21/1372962521.db2.gz	XXSSHKLSBLTQML-CHWSQXEVSA-N	0	3	344.427	3.081	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2ccc(CF)cc2)[C@H](OC)C1	ZINC001213946925	1372984669	/nfs/dbraw/zinc/98/46/69/1372984669.db2.gz	YOFADVASWGPITM-RTBURBONSA-N	0	3	348.462	3.332	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2=CCCC2)C[C@H]1NCC#Cc1ccc(Cl)cc1	ZINC001214428812	1373059621	/nfs/dbraw/zinc/05/96/21/1373059621.db2.gz	MNIAZXVJRXIKKU-DNVCBOLYSA-N	0	3	342.870	3.238	20	30		EGEDHN
CC/C(C)=C\C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001214575868	1373082970	/nfs/dbraw/zinc/08/29/70/1373082970.db2.gz	MDLSQDILJILWQG-MWPJJREVSA-N	0	3	344.886	3.484	20	30		EGEDHN
CC#CCCCC(=O)N1C[C@@H](C)[C@H](NCc2cc(F)cc(F)c2)C1	ZINC001215363606	1373203206	/nfs/dbraw/zinc/20/32/06/1373203206.db2.gz	WUVWLELIDYFRAL-RDTXWAMCSA-N	0	3	334.410	3.095	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](C)[C@H](NCc2cc(C)ccc2OC)C1	ZINC001215428113	1373206535	/nfs/dbraw/zinc/20/65/35/1373206535.db2.gz	WPUBLKLONDBWKQ-SJLPKXTDSA-N	0	3	330.472	3.296	20	30		EGEDHN
C[C@H](CC(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(F)cc2)C1)C1CC1	ZINC001216855691	1373351735	/nfs/dbraw/zinc/35/17/35/1373351735.db2.gz	QYKLOPRLNGZFTR-JXXFODFXSA-N	0	3	342.458	3.050	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)[C@@H](C)CC(C)(C)C)C1	ZINC001130431392	1373536482	/nfs/dbraw/zinc/53/64/82/1373536482.db2.gz	XBYHIQSKAFAQLT-GJZGRUSLSA-N	0	3	332.492	3.074	20	30		EGEDHN
O=C(/C=C/c1ccccc1)c1ccc(O[C@H]2CC[C@@H]3NCCO[C@H]32)cc1	ZINC001218149332	1373569910	/nfs/dbraw/zinc/56/99/10/1373569910.db2.gz	IRVPCPKTKWWDIM-BPWJZVITSA-N	0	3	349.430	3.481	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)CCC(C)(F)F)[C@H]2C1	ZINC001218188900	1373575053	/nfs/dbraw/zinc/57/50/53/1373575053.db2.gz	WVTMBIGABWJSPP-JKSUJKDBSA-N	0	3	346.462	3.304	20	30		EGEDHN
C=C(C)[C@@H]1CC[C@@H](C)C[C@H]1Oc1ccnc2c3c(nn21)CCNC3	ZINC001218358317	1373602589	/nfs/dbraw/zinc/60/25/89/1373602589.db2.gz	WAVJMMHROMIGMI-JKIFEVAISA-N	0	3	326.444	3.135	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)CC(C)=C(C)C)[C@H]2C1	ZINC001218461489	1373618536	/nfs/dbraw/zinc/61/85/36/1373618536.db2.gz	FMWVCBNFUXEAOP-RBUKOAKNSA-N	0	3	334.504	3.391	20	30		EGEDHN
Cc1noc(NC(=O)C[C@@H](N)c2ccc(Cl)cc2Cl)c1C#N	ZINC001218502257	1373626664	/nfs/dbraw/zinc/62/66/64/1373626664.db2.gz	AQUJFDOERAHBSI-GFCCVEGCSA-N	0	3	339.182	3.190	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCO[C@@H]2CN(CC/C=C/CCC)C[C@@H]21	ZINC001218516524	1373628229	/nfs/dbraw/zinc/62/82/29/1373628229.db2.gz	DCLGWVJBBWVHDQ-UMPVYUTHSA-N	0	3	334.504	3.247	20	30		EGEDHN
CC(C)(C)Oc1ccc(C[C@H](N)C(=O)Nc2ccsc2C#N)cc1	ZINC001218625307	1373638465	/nfs/dbraw/zinc/63/84/65/1373638465.db2.gz	XBISPMDBSMFREM-AWEZNQCLSA-N	0	3	343.452	3.306	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@@H]2C[C@H]2CC(C)(C)C)[C@@H](O)C1	ZINC001219662981	1373722817	/nfs/dbraw/zinc/72/28/17/1373722817.db2.gz	QDURLEBBIWUZDW-MLHJIOFPSA-N	0	3	338.536	3.190	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@@H]2CCC(C)=C(C)C2)[C@@H](O)C1	ZINC001219684945	1373724912	/nfs/dbraw/zinc/72/49/12/1373724912.db2.gz	WYQDKZSGTDIGFP-QRVBRYPASA-N	0	3	334.504	3.031	20	30		EGEDHN
C=CCCC(=O)N1C[C@H](C)O[C@@]2(CCN(Cc3cccc(C)c3)C2)C1	ZINC001131645160	1373741135	/nfs/dbraw/zinc/74/11/35/1373741135.db2.gz	BYNJRWXWRHVMAV-GHTZIAJQSA-N	0	3	342.483	3.153	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C1(CCCC)CC1)C[C@H](C)O2	ZINC001131688665	1373764542	/nfs/dbraw/zinc/76/45/42/1373764542.db2.gz	QBEMCXCJIXTCNV-FXAWDEMLSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CCCC(C)(C)C)C[C@@H]2O)CCCC1	ZINC001221195987	1373767673	/nfs/dbraw/zinc/76/76/73/1373767673.db2.gz	BVAPPADOYHSNKW-SJORKVTESA-N	0	3	336.520	3.111	20	30		EGEDHN
C#CCCN1CC[C@]2(C1)CN(C(=O)CCCC1CCCC1)C[C@@H](C)O2	ZINC001131701356	1373770783	/nfs/dbraw/zinc/77/07/83/1373770783.db2.gz	SRKRCFGLINWQDD-NQIIRXRSSA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)CN(C(=O)CCCC1CCCC1)C[C@@H](C)O2	ZINC001131701358	1373771059	/nfs/dbraw/zinc/77/10/59/1373771059.db2.gz	SRKRCFGLINWQDD-WIYYLYMNSA-N	0	3	346.515	3.062	20	30		EGEDHN
CC(C)=CC(=O)N[C@@H]1CC[C@H](C)N(Cc2ccc(OCC#N)cc2)C1	ZINC001131771643	1373795639	/nfs/dbraw/zinc/79/56/39/1373795639.db2.gz	JWAVALAWFFATID-FUHWJXTLSA-N	0	3	341.455	3.024	20	30		EGEDHN
CCCCCCCCCCC(=O)N1C[C@H]2CCN(C[C@H](C)O)C[C@H]21	ZINC001221973789	1373810724	/nfs/dbraw/zinc/81/07/24/1373810724.db2.gz	MWRHVYHSMOUOOW-IPMKNSEASA-N	0	3	338.536	3.431	20	30		EGEDHN
C#CCCCC(=O)NCC1CCN(Cc2ccc(C)c(F)c2)CC1	ZINC001223012083	1375029238	/nfs/dbraw/zinc/02/92/38/1375029238.db2.gz	BKYRTWBGIGZKCO-UHFFFAOYSA-N	0	3	330.447	3.266	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC[C@@H](C)N(Cc2cccc(COC)c2)C1	ZINC001131899536	1375036382	/nfs/dbraw/zinc/03/63/82/1375036382.db2.gz	NMLJBHVLZPFDJU-APWZRJJASA-N	0	3	330.472	3.268	20	30		EGEDHN
C=CCOCCCC(=O)N[C@@H]1CC[C@H](C)N(Cc2ccc(C)cc2)C1	ZINC001131940183	1375058276	/nfs/dbraw/zinc/05/82/76/1375058276.db2.gz	ZTEPEHZVYBGNRC-AZUAARDMSA-N	0	3	344.499	3.447	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1CC[C@H](C)N(CCc2scnc2C)C1	ZINC001131971140	1375075700	/nfs/dbraw/zinc/07/57/00/1375075700.db2.gz	CKCSWTAVKAQNFT-RDJZCZTQSA-N	0	3	347.528	3.157	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)CCc2ccccc2Cl)CC1	ZINC001225363350	1375106346	/nfs/dbraw/zinc/10/63/46/1375106346.db2.gz	BJFJQQXNMAOMHI-UHFFFAOYSA-N	0	3	332.875	3.124	20	30		EGEDHN
C[C@H]1CC[C@@H](NC(=O)C#CC2CC2)CN1Cc1ccc(C2CC2)cc1	ZINC001132033578	1375108870	/nfs/dbraw/zinc/10/88/70/1375108870.db2.gz	IJSXIJXFAPISJF-HRAATJIYSA-N	0	3	336.479	3.447	20	30		EGEDHN
C#CCN1CCC(CNC(=O)CCCc2cc(C)sc2C)CC1	ZINC001225603851	1375131375	/nfs/dbraw/zinc/13/13/75/1375131375.db2.gz	NCUOALKUTYEYLC-UHFFFAOYSA-N	0	3	332.513	3.149	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCc2ccccc2OCC)CC[C@H]1C	ZINC001132156405	1375174491	/nfs/dbraw/zinc/17/44/91/1375174491.db2.gz	DWZFFAZOCMSJFG-SJLPKXTDSA-N	0	3	330.472	3.173	20	30		EGEDHN
CC1(C)CC(C(=O)N[C@@H]2CCCC[C@H]2NCC#Cc2ccccc2)C1	ZINC001225995059	1375186371	/nfs/dbraw/zinc/18/63/71/1375186371.db2.gz	MRJTXDZWGLSRGC-WOJBJXKFSA-N	0	3	338.495	3.491	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2ccccc2CC)CC[C@@H]1C	ZINC001132260052	1375251689	/nfs/dbraw/zinc/25/16/89/1375251689.db2.gz	AGRAXZXNCSNGEH-WMZOPIPTSA-N	0	3	330.472	3.034	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H]2CC[C@H](C)N(CCOC3CCC3)C2)CC1	ZINC001132277114	1375261661	/nfs/dbraw/zinc/26/16/61/1375261661.db2.gz	BANVJMAETDPDFH-IRXDYDNUSA-N	0	3	334.504	3.271	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CCCC[C@H]1NCc1cc(OC)ns1	ZINC001226532637	1375276660	/nfs/dbraw/zinc/27/66/60/1375276660.db2.gz	GZXODVGABXXCGF-HUUCEWRRSA-N	0	3	337.489	3.025	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CC[C@H](C)N(CCOCC2CCC2)C1	ZINC001132330176	1375308718	/nfs/dbraw/zinc/30/87/18/1375308718.db2.gz	CCQXUDOOVZAYDT-FUHWJXTLSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CC[C@@H](C)N(CCOCC2CCC2)C1	ZINC001132330177	1375308918	/nfs/dbraw/zinc/30/89/18/1375308918.db2.gz	CCQXUDOOVZAYDT-SJLPKXTDSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCOCCCC(=O)NC1CCN([C@@H](C)c2cccc(F)c2)CC1	ZINC001226778484	1375332378	/nfs/dbraw/zinc/33/23/78/1375332378.db2.gz	NTAYJSUKDVRCAW-INIZCTEOSA-N	0	3	348.462	3.450	20	30		EGEDHN
CCCCCCCN1C[C@H](NC(=O)c2c[nH]c(C)cc2=O)CC[C@@H]1C	ZINC001132403502	1375355648	/nfs/dbraw/zinc/35/56/48/1375355648.db2.gz	XWNMXAIYUCUFLZ-DLBZAZTESA-N	0	3	347.503	3.236	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCOc2ccccc2CC)CC[C@H]1C	ZINC001132414808	1375362328	/nfs/dbraw/zinc/36/23/28/1375362328.db2.gz	XIJFJUQWGXXYLK-SJLPKXTDSA-N	0	3	330.472	3.173	20	30		EGEDHN
C#CCCCCC(=O)NC1CCN(Cc2ccc(OC)c(C)c2)CC1	ZINC001226961488	1375372262	/nfs/dbraw/zinc/37/22/62/1375372262.db2.gz	DZOLSRWKEHXWSL-UHFFFAOYSA-N	0	3	342.483	3.278	20	30		EGEDHN
C[C@@H]1CCCC[C@H]1OCCN1CCC(NC(=O)C#CC(C)(C)C)CC1	ZINC001227243826	1375411208	/nfs/dbraw/zinc/41/12/08/1375411208.db2.gz	CUGYALDQKAFJJR-IEBWSBKVSA-N	0	3	348.531	3.212	20	30		EGEDHN
CC#CCCCC(=O)NCCNCc1cc(Cl)cc(Cl)c1	ZINC001132592969	1375479899	/nfs/dbraw/zinc/47/98/99/1375479899.db2.gz	KLJJZGGNRMXHLF-UHFFFAOYSA-N	0	3	327.255	3.393	20	30		EGEDHN
CCCCC(=O)N1CC[C@@H](C)[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001132670622	1375507363	/nfs/dbraw/zinc/50/73/63/1375507363.db2.gz	VKILFRUPNHVGFC-QAPCUYQASA-N	0	3	345.462	3.462	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CCCC[C@H]1N[C@H](C)c1cnc(C)cn1	ZINC001228090358	1375517452	/nfs/dbraw/zinc/51/74/52/1375517452.db2.gz	YHPBFFORFVSMCB-KZNAEPCWSA-N	0	3	342.487	3.057	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](C)[C@@H](CNCc2nc(C)sc2C)C1	ZINC001132697558	1375519237	/nfs/dbraw/zinc/51/92/37/1375519237.db2.gz	RXWDXJRBSRFTSH-BBRMVZONSA-N	0	3	335.517	3.300	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](C)[C@@H](CNCc2csc(CC)n2)C1	ZINC001132701546	1375523231	/nfs/dbraw/zinc/52/32/31/1375523231.db2.gz	TZELHRJRVVTIQP-CABCVRRESA-N	0	3	335.517	3.246	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](C)[C@@H](CNCc2nc(C)c(C)s2)C1	ZINC001132785766	1375564042	/nfs/dbraw/zinc/56/40/42/1375564042.db2.gz	LDWYBSQURYOKKK-PBHICJAKSA-N	0	3	347.528	3.138	20	30		EGEDHN
CC/C(C)=C/C(=O)N1CC[C@H](C)[C@H](CNCc2ccccc2C#N)C1	ZINC001132804175	1375570915	/nfs/dbraw/zinc/57/09/15/1375570915.db2.gz	GKLGLFKODGZNET-RSFQOKOSSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](C)[C@H](CNCc2cc(C)no2)C1	ZINC001132847463	1375600508	/nfs/dbraw/zinc/60/05/08/1375600508.db2.gz	YJZAQDPONDMJSX-GDBMZVCRSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NC1CCN(CCOc2ccc(C)cc2)CC1	ZINC001228750125	1375663557	/nfs/dbraw/zinc/66/35/57/1375663557.db2.gz	WLAKCURNLHXESN-ZWKOTPCHSA-N	0	3	344.499	3.413	20	30		EGEDHN
Cc1nc(OC2CCN(C3CC3)CC2)c(C#N)cc1Br	ZINC001228797782	1375680616	/nfs/dbraw/zinc/68/06/16/1375680616.db2.gz	BIUUCWNTFQOQLE-UHFFFAOYSA-N	0	3	336.233	3.030	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)C[C@H](C)C2CCCCC2)CC1	ZINC001229592962	1375862561	/nfs/dbraw/zinc/86/25/61/1375862561.db2.gz	QXFGYBGEKUQZMX-KRWDZBQOSA-N	0	3	336.520	3.376	20	30		EGEDHN
Cc1cccc(Cl)c1C(=O)NCCNCc1ccc(C#N)s1	ZINC001133314681	1375918219	/nfs/dbraw/zinc/91/82/19/1375918219.db2.gz	NQUFJIUMHRHNSG-UHFFFAOYSA-N	0	3	333.844	3.101	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)COc1ccccc1C	ZINC001230045403	1375934806	/nfs/dbraw/zinc/93/48/06/1375934806.db2.gz	LMXBBBFLDGADGW-HZPDHXFCSA-N	0	3	336.863	3.143	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C1CCCCC1	ZINC001133377450	1375958522	/nfs/dbraw/zinc/95/85/22/1375958522.db2.gz	SJSOIYRJWNGKKV-UHFFFAOYSA-N	0	3	332.875	3.472	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1ccc(F)cc1	ZINC001133382604	1375962643	/nfs/dbraw/zinc/96/26/43/1375962643.db2.gz	QKXUPKANHGNDDS-UHFFFAOYSA-N	0	3	344.817	3.344	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)C1(C)CCC1	ZINC001133401777	1375987319	/nfs/dbraw/zinc/98/73/19/1375987319.db2.gz	MITUNWBXCLXPFM-UHFFFAOYSA-N	0	3	332.875	3.472	20	30		EGEDHN
C=CCC1(C(=O)NC2CCN(CCc3ccns3)CC2)CCCC1	ZINC001230475645	1376035223	/nfs/dbraw/zinc/03/52/23/1376035223.db2.gz	PJVORUGIIPODOH-UHFFFAOYSA-N	0	3	347.528	3.403	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)c1cccs1	ZINC001133580665	1376103881	/nfs/dbraw/zinc/10/38/81/1376103881.db2.gz	CNNFECZMQPKQEQ-GHMZBOCLSA-N	0	3	331.279	3.143	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H](C)C[C@@H](C)NCc2cc(F)ccc2C#N)o1	ZINC001133652387	1376137902	/nfs/dbraw/zinc/13/79/02/1376137902.db2.gz	ASCPETFPGKXUFG-OLZOCXBDSA-N	0	3	343.402	3.286	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)C1(C(F)F)CC1)Cc1cccnc1	ZINC001230763089	1376142399	/nfs/dbraw/zinc/14/23/99/1376142399.db2.gz	QUQPOHDBPRTNEJ-UHFFFAOYSA-N	0	3	337.414	3.011	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)c1cc(Cl)c[nH]1	ZINC001133672406	1376147604	/nfs/dbraw/zinc/14/76/04/1376147604.db2.gz	ZKNBKTZYFQNHFZ-VHSXEESVSA-N	0	3	348.672	3.063	20	30		EGEDHN
C=C/C(C)=C\CC(=O)NCCCN(CC(=C)C)Cc1cccnc1	ZINC001230818291	1376157762	/nfs/dbraw/zinc/15/77/62/1376157762.db2.gz	HWEUDVMBMMWYGP-NVMNQCDNSA-N	0	3	327.472	3.488	20	30		EGEDHN
C#CCCN(CCCNC(=O)c1ccccc1CC)Cc1cccnc1	ZINC001230824646	1376160302	/nfs/dbraw/zinc/16/03/02/1376160302.db2.gz	KDIDLXFWIAWFRY-UHFFFAOYSA-N	0	3	349.478	3.289	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCCN(Cc1cccnc1)[C@H](C)COC	ZINC001230859596	1376166253	/nfs/dbraw/zinc/16/62/53/1376166253.db2.gz	GHTATWYXKUCSEH-QGZVFWFLSA-N	0	3	347.503	3.027	20	30		EGEDHN
CC(C)SCC(=O)N[C@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001133726238	1376178714	/nfs/dbraw/zinc/17/87/14/1376178714.db2.gz	FZZZQNUTDGMROI-LSDHHAIUSA-N	0	3	333.501	3.073	20	30		EGEDHN
C=CCOCC(=O)N(C)C[C@H]1CCN1Cc1cccc2ccccc21	ZINC001231233610	1376216888	/nfs/dbraw/zinc/21/68/88/1376216888.db2.gz	LMDQOYKEJRWLCI-LJQANCHMSA-N	0	3	338.451	3.075	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1cc(F)ccc1C#N)NC(=O)CC(F)(F)F	ZINC001133849330	1376232561	/nfs/dbraw/zinc/23/25/61/1376232561.db2.gz	VWYRRPOUSOVQPK-WDEREUQCSA-N	0	3	345.340	3.023	20	30		EGEDHN
C#CCCCC(=O)N[C@@H](C)C[C@@H](C)NCc1ccn(C2CCCC2)n1	ZINC001134200911	1376415268	/nfs/dbraw/zinc/41/52/68/1376415268.db2.gz	JSGZAXBHRFNQNE-SJORKVTESA-N	0	3	344.503	3.175	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)C1CC(C)(C)C1	ZINC001134255463	1376438676	/nfs/dbraw/zinc/43/86/76/1376438676.db2.gz	BDMCFXUJXFRYRH-VXGBXAGGSA-N	0	3	331.298	3.204	20	30		EGEDHN
CCc1[nH]ccc1C(=O)N[C@@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001134264461	1376445276	/nfs/dbraw/zinc/44/52/76/1376445276.db2.gz	ALUDMJUVRXRFNK-CABCVRRESA-N	0	3	338.455	3.135	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)C#CC1CC1)NCc1c(F)cccc1Cl	ZINC001134321939	1376475491	/nfs/dbraw/zinc/47/54/91/1376475491.db2.gz	NCZCSLDYAABSPR-STQMWFEESA-N	0	3	336.838	3.265	20	30		EGEDHN
COc1cc(Cl)cc(F)c1CN1CCC2SC(=O)C=C2C1	ZINC001233000119	1376554655	/nfs/dbraw/zinc/55/46/55/1376554655.db2.gz	MPZBGOYQNKHERH-CQSZACIVSA-N	0	3	327.808	3.262	20	30		EGEDHN
N#Cc1cccc(O[C@H]2CCCN(Cc3cc(Cl)ncc3O)C2)c1	ZINC001233037593	1376558999	/nfs/dbraw/zinc/55/89/99/1376558999.db2.gz	CXURBWQUQKSLLC-INIZCTEOSA-N	0	3	343.814	3.356	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@@H]1CCN(Cc1cnc(C)c(C)c1)C2	ZINC001233158235	1376577008	/nfs/dbraw/zinc/57/70/08/1376577008.db2.gz	DODSFOWXVYFHQP-WOJBJXKFSA-N	0	3	330.472	3.272	20	30		EGEDHN
CC[C@@H](Cc1ccccc1)C(=O)NCCNCc1cccc(C#N)c1	ZINC001134586082	1376609728	/nfs/dbraw/zinc/60/97/28/1376609728.db2.gz	QKYRZEBVINQFCA-FQEVSTJZSA-N	0	3	335.451	3.033	20	30		EGEDHN
CCCCCCCN1CC[C@H]1CN(C)C(=O)Cc1ccncc1C	ZINC001234356332	1376816847	/nfs/dbraw/zinc/81/68/47/1376816847.db2.gz	HNVPMYKSZKUIFM-IBGZPJMESA-N	0	3	331.504	3.436	20	30		EGEDHN
C=CCC[C@@H](C)N1CC[C@H]1CN(C)C(=O)c1cc(C(F)(F)F)no1	ZINC001235632309	1376879744	/nfs/dbraw/zinc/87/97/44/1376879744.db2.gz	FXVVXPXGIFJYIM-NEPJUHHUSA-N	0	3	345.365	3.194	20	30		EGEDHN
CCCCCCCN1CC[C@@H]1CN(C)C(=O)c1cc2cccn2cn1	ZINC001235725743	1376886962	/nfs/dbraw/zinc/88/69/62/1376886962.db2.gz	UHNBAMOTHASWRU-GOSISDBHSA-N	0	3	342.487	3.451	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)C1(C)CCCC1	ZINC001135114489	1376908233	/nfs/dbraw/zinc/90/82/33/1376908233.db2.gz	ARWFZJHBELOSSA-CHWSQXEVSA-N	0	3	331.298	3.348	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H](C)C[C@H](C)NCc1nc(C)cs1	ZINC001135188745	1376962140	/nfs/dbraw/zinc/96/21/40/1376962140.db2.gz	OYDFFOHHPSFUEZ-GJZGRUSLSA-N	0	3	335.517	3.408	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H](C)C[C@@H](C)NCc1nc2ccccc2o1	ZINC001135229456	1376988788	/nfs/dbraw/zinc/98/87/88/1376988788.db2.gz	ANIBKBQIEMEFFK-KGLIPLIRSA-N	0	3	329.444	3.413	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)CCCC1CC1	ZINC001135246418	1376999522	/nfs/dbraw/zinc/99/95/22/1376999522.db2.gz	HMHRQDHUDGFBON-OLZOCXBDSA-N	0	3	331.298	3.348	20	30		EGEDHN
CCc1ccc([C@H](C)C(=O)NCCNCc2cccc(C#N)c2)cc1	ZINC001135364172	1377054575	/nfs/dbraw/zinc/05/45/75/1377054575.db2.gz	ULUGSARIIQZTRH-INIZCTEOSA-N	0	3	335.451	3.130	20	30		EGEDHN
C[C@@H](CC(=O)NCCNCc1ccc(C#N)s1)c1ccccc1F	ZINC001135391516	1377070548	/nfs/dbraw/zinc/07/05/48/1377070548.db2.gz	WVVJVZIEJINDPY-ZDUSSCGKSA-N	0	3	345.443	3.158	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)c1occc1CC	ZINC001135394529	1377071630	/nfs/dbraw/zinc/07/16/30/1377071630.db2.gz	IFWUOCBWCYPJAN-RYUDHWBXSA-N	0	3	343.265	3.237	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)C1(C)CC=CC1)NCc1cc(F)ccc1C#N	ZINC001135411169	1377080089	/nfs/dbraw/zinc/08/00/89/1377080089.db2.gz	LROCGJXJPMFWRS-HUUCEWRRSA-N	0	3	343.446	3.427	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](C)C[C@H](C)NCc2ccn(CC)n2)CC1	ZINC001135414601	1377081450	/nfs/dbraw/zinc/08/14/50/1377081450.db2.gz	BFXDIVMXJJIQTL-JKSUJKDBSA-N	0	3	332.492	3.022	20	30		EGEDHN
CCCC(C)(C)C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001266617039	1377346494	/nfs/dbraw/zinc/34/64/94/1377346494.db2.gz	STUJVMMXWWHGEI-WKILWMFISA-N	0	3	331.435	3.260	20	30		EGEDHN
CC[C@@H](CNC(=O)c1cc(C#N)ccc1C)N1CCc2ccccc2C1	ZINC001136200891	1377363662	/nfs/dbraw/zinc/36/36/62/1377363662.db2.gz	OBKFNPRKEJFHEP-FQEVSTJZSA-N	0	3	347.462	3.433	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@H](C(=O)N(CC)CC)C2)c1[O-]	ZINC001138625066	1377755777	/nfs/dbraw/zinc/75/57/77/1377755777.db2.gz	YROBCWJQWWOMAH-SFHVURJKSA-N	0	3	330.472	3.201	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@H](C(=O)N(CC)CC)C2)c1[O-]	ZINC001138625066	1377755780	/nfs/dbraw/zinc/75/57/80/1377755780.db2.gz	YROBCWJQWWOMAH-SFHVURJKSA-N	0	3	330.472	3.201	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2C[C@H]3CN(Cc4cccnc4)C[C@H]3C2)c1[O-]	ZINC001138626595	1377756065	/nfs/dbraw/zinc/75/60/65/1377756065.db2.gz	LJASTBLBPSKGNR-OYRHEFFESA-N	0	3	349.478	3.080	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2C[C@H]3CN(Cc4cccnc4)C[C@H]3C2)c1[O-]	ZINC001138626595	1377756066	/nfs/dbraw/zinc/75/60/66/1377756066.db2.gz	LJASTBLBPSKGNR-OYRHEFFESA-N	0	3	349.478	3.080	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2C[C@H]3CN(c4ccccc4)C(=O)[C@H]3C2)c1[O-]	ZINC001138627913	1377756596	/nfs/dbraw/zinc/75/65/96/1377756596.db2.gz	PVPQADRKIXXAFR-ICSRJNTNSA-N	0	3	348.446	3.216	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2C[C@H]3CN(c4ccccc4)C(=O)[C@H]3C2)c1[O-]	ZINC001138627913	1377756597	/nfs/dbraw/zinc/75/65/97/1377756597.db2.gz	PVPQADRKIXXAFR-ICSRJNTNSA-N	0	3	348.446	3.216	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CCC(c3nnc(CC)o3)CC2)c1[O-]	ZINC001138627879	1377756825	/nfs/dbraw/zinc/75/68/25/1377756825.db2.gz	IGPXEVUDPXZHGA-UHFFFAOYSA-N	0	3	327.428	3.446	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CCC3(CCOC[C@@H]3COC)CC2)c1[O-]	ZINC001138627713	1377756861	/nfs/dbraw/zinc/75/68/61/1377756861.db2.gz	NDMKOVUASZZDBJ-IBGZPJMESA-N	0	3	345.483	3.386	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@@H](Oc3cc(C)ncn3)C2)c1[O-]	ZINC001138630904	1377757967	/nfs/dbraw/zinc/75/79/67/1377757967.db2.gz	FYIDZUQLQICEHA-GOSISDBHSA-N	0	3	339.439	3.263	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@@H](Oc3cc(C)ncn3)C2)c1[O-]	ZINC001138630904	1377757971	/nfs/dbraw/zinc/75/79/71/1377757971.db2.gz	FYIDZUQLQICEHA-GOSISDBHSA-N	0	3	339.439	3.263	20	30		EGEDHN
Cc1cnccc1O[C@@H]1CCN(Cc2c[nH]c3c2cccc3C#N)C1	ZINC001139707726	1377938034	/nfs/dbraw/zinc/93/80/34/1377938034.db2.gz	QTNFCOPCGAICKI-QGZVFWFLSA-N	0	3	332.407	3.396	20	30		EGEDHN
CCCCOC(=O)[C@H]1CCN(Cc2c[nH]c3c2cccc3C#N)C1	ZINC001139706886	1377938050	/nfs/dbraw/zinc/93/80/50/1377938050.db2.gz	BPZDLPKYXAZMRK-HNNXBMFYSA-N	0	3	325.412	3.205	20	30		EGEDHN
Cc1ccc(CN2CC[C@@]3(C[C@@H](OCC4CC4)CO3)C2)cc1C#N	ZINC001139724322	1377941361	/nfs/dbraw/zinc/94/13/61/1377941361.db2.gz	ODPYWUUGIGVBTD-WOJBJXKFSA-N	0	3	326.440	3.027	20	30		EGEDHN
N#Cc1ccccc1OC1CC[NH+](Cc2cc(F)ccc2[O-])CC1	ZINC001140058487	1377998341	/nfs/dbraw/zinc/99/83/41/1377998341.db2.gz	CPNJPNZCHSZXQO-UHFFFAOYSA-N	0	3	326.371	3.446	20	30		EGEDHN
N#Cc1ccc2[nH]cc(CN3CCC(Oc4cccnc4)CC3)c2c1	ZINC001140114508	1378010568	/nfs/dbraw/zinc/01/05/68/1378010568.db2.gz	RWWVVIOPWCIKOG-UHFFFAOYSA-N	0	3	332.407	3.478	20	30		EGEDHN
CC(=O)N(C(C)C)C1CCN(Cc2c[nH]c3ccc(C#N)cc23)CC1	ZINC001140116446	1378011875	/nfs/dbraw/zinc/01/18/75/1378011875.db2.gz	ZJVLQEXSWNPJFB-UHFFFAOYSA-N	0	3	338.455	3.261	20	30		EGEDHN
CCCc1nc(CNC[C@H]2CC[C@H](NC(=O)[C@@H](C)C#N)CC2)cs1	ZINC001272720331	1378080911	/nfs/dbraw/zinc/08/09/11/1378080911.db2.gz	GFGREMZPQOZPHC-KKUMJFAQSA-N	0	3	348.516	3.020	20	30		EGEDHN
C=CCNC(=O)[C@@H]1CC12CCN(Cc1ccc(OC(C)C)cc1)CC2	ZINC001273007855	1378084912	/nfs/dbraw/zinc/08/49/12/1378084912.db2.gz	GHLBRJWUMHIJBP-IBGZPJMESA-N	0	3	342.483	3.378	20	30		EGEDHN
C=C(C)CN1C[C@@]2(CC1=O)CCCCN2CCc1ccccc1F	ZINC001273040947	1378085330	/nfs/dbraw/zinc/08/53/30/1378085330.db2.gz	JUPOUVOXNZRYQI-FQEVSTJZSA-N	0	3	330.447	3.401	20	30		EGEDHN
N#CCCCN1C[C@@]2(CC1=O)CCCCN2CCc1ccccc1F	ZINC001273041090	1378085475	/nfs/dbraw/zinc/08/54/75/1378085475.db2.gz	NKSFQPKDUDOZLT-FQEVSTJZSA-N	0	3	343.446	3.129	20	30		EGEDHN
C#CCN1CCC2(CCN(Cc3cccc4sccc43)CC2)C1=O	ZINC001274465690	1378126003	/nfs/dbraw/zinc/12/60/03/1378126003.db2.gz	ZBZXYEZEWWCJKS-UHFFFAOYSA-N	0	3	338.476	3.349	20	30		EGEDHN
C#CCN1CC[C@]2(CCCN(Cc3cc(C)ccc3Cl)CC2)C1=O	ZINC001274492249	1378128361	/nfs/dbraw/zinc/12/83/61/1378128361.db2.gz	JFNHBFBPGXMWAZ-HXUWFJFHSA-N	0	3	344.886	3.486	20	30		EGEDHN
CC(C)N1CCC2(CCN(Cc3cccc(C#N)c3Cl)CC2)C1=O	ZINC001140815021	1378149400	/nfs/dbraw/zinc/14/94/00/1378149400.db2.gz	YPEQYZJVTDGHTD-UHFFFAOYSA-N	0	3	345.874	3.435	20	30		EGEDHN
COc1ccc(CN2CCC(Oc3ccccc3C#N)CC2)cc1N	ZINC001140898211	1378173941	/nfs/dbraw/zinc/17/39/41/1378173941.db2.gz	CDSFQYAEMUJQRP-UHFFFAOYSA-N	0	3	337.423	3.192	20	30		EGEDHN
C=CCN1C(=O)CCC[C@@]12CCCN(Cc1cnc(CCCC)[nH]1)C2	ZINC001141069061	1378228286	/nfs/dbraw/zinc/22/82/86/1378228286.db2.gz	UKUFODLEYFGFOL-FQEVSTJZSA-N	0	3	344.503	3.285	20	30		EGEDHN
C[C@]1(CNCc2ccccc2C#N)CCN(C(=O)c2ccsc2)C1	ZINC001278457144	1378273990	/nfs/dbraw/zinc/27/39/90/1378273990.db2.gz	XALCXXWNQOKGSK-LJQANCHMSA-N	0	3	339.464	3.262	20	30		EGEDHN
C=CCOC(=O)N[C@H]1CCCN(Cc2c(C)cc(OC)cc2C)C1	ZINC001142949655	1378515384	/nfs/dbraw/zinc/51/53/84/1378515384.db2.gz	MHDBYZUOZZGZGP-INIZCTEOSA-N	0	3	332.444	3.189	20	30		EGEDHN
CCOc1ccc(F)c(F)c1CN1CCC2SC(=O)C=C2C1	ZINC001143489184	1378603890	/nfs/dbraw/zinc/60/38/90/1378603890.db2.gz	YQTYCDORVPQGFS-AWEZNQCLSA-N	0	3	325.380	3.138	20	30		EGEDHN
COC(=O)[C@@H](c1ccccc1)[C@H]1CCCCN1Cc1ccc(C#N)cn1	ZINC001144163575	1378689313	/nfs/dbraw/zinc/68/93/13/1378689313.db2.gz	LDQULJYBMGDXRA-UXHICEINSA-N	0	3	349.434	3.265	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2cccc3ccsc32)c1	ZINC001146650027	1378888111	/nfs/dbraw/zinc/88/81/11/1378888111.db2.gz	XPTQQZBDQBNIFD-UHFFFAOYSA-N	0	3	335.432	3.293	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2ccn(CC)n2)CCCC1	ZINC001146823445	1378929306	/nfs/dbraw/zinc/92/93/06/1378929306.db2.gz	ZZEOKMKXXUCSLL-SJORKVTESA-N	0	3	346.519	3.412	20	30		EGEDHN
CC(C)(Cc1ccccc1)C(=O)NCCNCc1ccc(C#N)s1	ZINC001146883644	1378939541	/nfs/dbraw/zinc/93/95/41/1378939541.db2.gz	JURUDMMKSFOCOZ-UHFFFAOYSA-N	0	3	341.480	3.094	20	30		EGEDHN
CC[C@@H](CC(=O)NCCNCc1ccc(F)c(C#N)c1)C(C)(C)C	ZINC001147466764	1379026493	/nfs/dbraw/zinc/02/64/93/1379026493.db2.gz	VSNCXMOUIBBCRR-INIZCTEOSA-N	0	3	333.451	3.366	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC2(C1)CCN(Cc1ccc(C)nc1C)C2	ZINC001148130734	1379122600	/nfs/dbraw/zinc/12/26/00/1379122600.db2.gz	PGCUWUBGPIKBPR-GOSISDBHSA-N	0	3	341.499	3.335	20	30		EGEDHN
C=CCC1(C(=O)N2CC3(C2)CCN(Cc2cccc(C#N)c2)C3)CCC1	ZINC001148226362	1379136117	/nfs/dbraw/zinc/13/61/17/1379136117.db2.gz	DINNUTHGTSYMRS-UHFFFAOYSA-N	0	3	349.478	3.339	20	30		EGEDHN
Cc1ccc([C@@H](C)C(=O)NCCNCc2ccc(C#N)c(F)c2)cc1	ZINC001148279077	1379144293	/nfs/dbraw/zinc/14/42/93/1379144293.db2.gz	HHWARULHPAMPHX-OAHLLOKOSA-N	0	3	339.414	3.015	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc(Cl)cc2Cl)cc1	ZINC001148803630	1379271416	/nfs/dbraw/zinc/27/14/16/1379271416.db2.gz	PQRPHHIJJPWUFR-UHFFFAOYSA-N	0	3	348.233	3.385	20	30		EGEDHN
CCCCCCCCCC(=O)NCCNCc1ccnc(OC)c1	ZINC001148820546	1379275653	/nfs/dbraw/zinc/27/56/53/1379275653.db2.gz	IASIOAOKTNXSCU-UHFFFAOYSA-N	0	3	335.492	3.437	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N1CC2(C1)CCN([C@H](C)c1ccccc1F)C2	ZINC001148899875	1379293881	/nfs/dbraw/zinc/29/38/81/1379293881.db2.gz	IMISQXQAWVYZKE-CVEARBPZSA-N	0	3	346.446	3.012	20	30		EGEDHN
CN1CCC[C@@](C)(NC(=O)c2ccc(C(C)(C)CCC#N)cc2)C1	ZINC001148912428	1379297794	/nfs/dbraw/zinc/29/77/94/1379297794.db2.gz	OAGDDYYOTHYYCW-HXUWFJFHSA-N	0	3	327.472	3.482	20	30		EGEDHN
C=CCCC(=O)NC[C@@H]1CN(Cc2ccc(CCC)cc2)CCCO1	ZINC001149363233	1379369117	/nfs/dbraw/zinc/36/91/17/1379369117.db2.gz	VNAJVIFGUMTLFS-HXUWFJFHSA-N	0	3	344.499	3.312	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)c2cccc3ccccc32)ccc1F	ZINC001149712409	1379435118	/nfs/dbraw/zinc/43/51/18/1379435118.db2.gz	YQISTJAVTKGESV-UHFFFAOYSA-N	0	3	347.393	3.370	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@H]1CN(Cc2cccc(C)c2)CCCO1	ZINC001149789635	1379446832	/nfs/dbraw/zinc/44/68/32/1379446832.db2.gz	PYWLMZADRHKOGD-IBGZPJMESA-N	0	3	330.472	3.058	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)C/C=C/c2ccc(F)cc2)C1	ZINC001149882163	1379459822	/nfs/dbraw/zinc/45/98/22/1379459822.db2.gz	YGERIKSZWAHBES-JUGMSXHOSA-N	0	3	346.446	3.012	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)Cc2cccc(C(C)C)c2)C1	ZINC001149945328	1379470818	/nfs/dbraw/zinc/47/08/18/1379470818.db2.gz	COJADRIXKUQSMZ-FQEVSTJZSA-N	0	3	344.499	3.136	20	30		EGEDHN
C=C[C@H](C(=O)NC[C@@H]1CN(CC=C(C)C)CCCO1)c1ccccc1	ZINC001150751523	1379606120	/nfs/dbraw/zinc/60/61/20/1379606120.db2.gz	GQINSQXXPNEVTK-UXHICEINSA-N	0	3	342.483	3.130	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)C[C@@H]2CCCCC2(C)C)C1	ZINC001150829962	1379620457	/nfs/dbraw/zinc/62/04/57/1379620457.db2.gz	BGZBNHFLLOMQJV-ROUUACIJSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCCC(=O)NC1(CCOC)CCN(Cc2ccsc2)CC1	ZINC001151014428	1379648839	/nfs/dbraw/zinc/64/88/39/1379648839.db2.gz	MGUKYZQXOUUGFE-UHFFFAOYSA-N	0	3	336.501	3.202	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@H]2[C@H](C=C(C)C)C2(C)C)CC1	ZINC001151209029	1379677270	/nfs/dbraw/zinc/67/72/70/1379677270.db2.gz	DAZSDXDKSCHLCE-ZWKOTPCHSA-N	0	3	348.531	3.398	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@@H]2CC[C@@H]3C[C@@H]3CC2)CC1	ZINC001151225909	1379681364	/nfs/dbraw/zinc/68/13/64/1379681364.db2.gz	XWOKPNVBAFMNSH-LDLYASANSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2cc3occc3s2)CC1	ZINC001151302114	1379696866	/nfs/dbraw/zinc/69/68/66/1379696866.db2.gz	DPDYPULPBLZGLU-UHFFFAOYSA-N	0	3	348.468	3.281	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2ccc(C)c(C)c2)CC1	ZINC001151405723	1379712345	/nfs/dbraw/zinc/71/23/45/1379712345.db2.gz	FGJBCATVXKOPMV-UHFFFAOYSA-N	0	3	344.499	3.480	20	30		EGEDHN
C=CCC1(C(=O)NCCNCc2ccc(C#N)s2)CCCCC1	ZINC001152010096	1379837423	/nfs/dbraw/zinc/83/74/23/1379837423.db2.gz	BKEDDWOCDUSUET-UHFFFAOYSA-N	0	3	331.485	3.352	20	30		EGEDHN
C=CCOCC(=O)NC[C@@H](C)N(CC)Cc1cccc(OC(C)C)c1	ZINC001152370358	1379921104	/nfs/dbraw/zinc/92/11/04/1379921104.db2.gz	BPLRDMPFDHRJFR-QGZVFWFLSA-N	0	3	348.487	3.003	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)CC1CCC1	ZINC001152585111	1379954092	/nfs/dbraw/zinc/95/40/92/1379954092.db2.gz	NJKLTYWTJGYJLC-CQSZACIVSA-N	0	3	331.435	3.214	20	30		EGEDHN
CC(C)c1ccc(C(=O)NCCNCc2ccc(C#N)s2)s1	ZINC001152777529	1379980656	/nfs/dbraw/zinc/98/06/56/1379980656.db2.gz	OGRJGMLDMVGLFN-UHFFFAOYSA-N	0	3	333.482	3.324	20	30		EGEDHN
C#CCC1(C(=O)NCCNCc2ccc(OC)c(F)c2)CCCCC1	ZINC001153004409	1380006233	/nfs/dbraw/zinc/00/62/33/1380006233.db2.gz	JYJXQKNVYWXHOR-UHFFFAOYSA-N	0	3	346.446	3.014	20	30		EGEDHN
CC/C(C)=C\C(=O)NC[C@@H](C)N(CC)Cc1ccc(OC)c(C#N)c1	ZINC001153187139	1380032232	/nfs/dbraw/zinc/03/22/32/1380032232.db2.gz	KDFJJMPAVFWYPO-DDITZMBXSA-N	0	3	343.471	3.250	20	30		EGEDHN
C#CCC1(C(=O)NC[C@@H](C)N(CC)Cc2ccc(F)c(F)c2)CCC1	ZINC001153776126	1380126930	/nfs/dbraw/zinc/12/69/30/1380126930.db2.gz	CMRDMXJDCJZGQU-OAHLLOKOSA-N	0	3	348.437	3.485	20	30		EGEDHN
C=CCC[C@@H](C(=O)NCCNCc1cnc(C)s1)c1ccccc1	ZINC001153817522	1380135413	/nfs/dbraw/zinc/13/54/13/1380135413.db2.gz	QBBJMQCHLCWFIU-GOSISDBHSA-N	0	3	343.496	3.407	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1ccccc1-c1ccncc1	ZINC001154005036	1380175452	/nfs/dbraw/zinc/17/54/52/1380175452.db2.gz	VPZJHSKSTAAXFH-QGZVFWFLSA-N	0	3	335.451	3.212	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1cc(C2CC2)oc1C1CC1	ZINC001154410698	1380272999	/nfs/dbraw/zinc/27/29/99/1380272999.db2.gz	SFSJIYBJCFMCQA-CQSZACIVSA-N	0	3	328.456	3.498	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@@H](C)N(CC)CCc1csc(C)n1	ZINC001154743340	1380344393	/nfs/dbraw/zinc/34/43/93/1380344393.db2.gz	ZFAKYAREBASCIU-LSDHHAIUSA-N	0	3	337.533	3.423	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@@H](C)N(CC)CCc1csc(C)n1	ZINC001154750954	1380345902	/nfs/dbraw/zinc/34/59/02/1380345902.db2.gz	HCAGWLVRNGPZAF-GDBMZVCRSA-N	0	3	337.533	3.423	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@@H](C)N(CC)Cc1cccc(C#N)c1	ZINC001154751487	1380346053	/nfs/dbraw/zinc/34/60/53/1380346053.db2.gz	YGUHJIXNYMRQBL-SJORKVTESA-N	0	3	327.472	3.487	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1cc(C)oc1C(F)(F)F	ZINC001155509317	1380462499	/nfs/dbraw/zinc/46/24/99/1380462499.db2.gz	FEUPPYVCPMWEHH-LLVKDONJSA-N	0	3	330.350	3.070	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)C2CCCCCC2)c(F)c1	ZINC001155572885	1380469930	/nfs/dbraw/zinc/46/99/30/1380469930.db2.gz	KZOAISZYLANGLU-UHFFFAOYSA-N	0	3	331.435	3.264	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)[C@@H]1C[C@H]1C1CCC1	ZINC001155736180	1380488214	/nfs/dbraw/zinc/48/82/14/1380488214.db2.gz	YRXLZGBOZXMFQF-UIAACRFSSA-N	0	3	339.483	3.321	20	30		EGEDHN
CCN(CC#CCOC)[C@H](C)CNC(=O)C[C@@H](C)C1CCCCC1	ZINC001155782108	1380491859	/nfs/dbraw/zinc/49/18/59/1380491859.db2.gz	BBDSOTARNUIWBR-QZTJIDSGSA-N	0	3	336.520	3.069	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@]1(C)CCCc2ccccc21	ZINC001155838682	1380497688	/nfs/dbraw/zinc/49/76/88/1380497688.db2.gz	AOKKLLNSQSESBQ-DYESRHJHSA-N	0	3	326.484	3.131	20	30		EGEDHN
CCN(CC#CCOC)[C@H](C)CNC(=O)C1(CC(C)C)CCCC1	ZINC001155872446	1380500996	/nfs/dbraw/zinc/50/09/96/1380500996.db2.gz	YFRSPGLPULMNAN-GOSISDBHSA-N	0	3	336.520	3.069	20	30		EGEDHN
C#CCN(CC)[C@H](C)CNC(=O)[C@@H]1C[C@H]1c1cccc2ccccc21	ZINC001155895586	1380503464	/nfs/dbraw/zinc/50/34/64/1380503464.db2.gz	OXCIFCMUIRRQDQ-TYCQWZJGSA-N	0	3	334.463	3.403	20	30		EGEDHN
C=CCOCCCC(=O)NCCCNCc1cc(F)ccc1Cl	ZINC001156159923	1380533224	/nfs/dbraw/zinc/53/32/24/1380533224.db2.gz	KCWGALHKCRQVNE-UHFFFAOYSA-N	0	3	342.842	3.058	20	30		EGEDHN
C#CCCCC(=O)NCCCNCc1cc(Cl)sc1Cl	ZINC001157171884	1380794594	/nfs/dbraw/zinc/79/45/94/1380794594.db2.gz	YKVSVKNDSPMJSO-UHFFFAOYSA-N	0	3	333.284	3.454	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1coc(C2CCCCC2)n1	ZINC001157209545	1380811123	/nfs/dbraw/zinc/81/11/23/1380811123.db2.gz	BEPHUGYYRUQWFP-OAHLLOKOSA-N	0	3	331.460	3.186	20	30		EGEDHN
C=CCN(c1nccnc1C(C#N)C(=O)OC(C)(C)C)C(C)(C)C	ZINC001157585897	1380972165	/nfs/dbraw/zinc/97/21/65/1380972165.db2.gz	VBTHBGAAADPSPT-ZDUSSCGKSA-N	0	3	330.432	3.216	20	30		EGEDHN
C=CCCC(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(OC)cc1	ZINC001157705623	1381009422	/nfs/dbraw/zinc/00/94/22/1381009422.db2.gz	GLRHAHZEKGCOLD-GOSISDBHSA-N	0	3	330.472	3.474	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H](C)Oc1cccc(F)c1	ZINC001157994042	1381095253	/nfs/dbraw/zinc/09/52/53/1381095253.db2.gz	GDEFLSCVYJLTPU-NVXWUHKLSA-N	0	3	334.435	3.092	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H](C)Oc1ccccc1F	ZINC001157994808	1381096171	/nfs/dbraw/zinc/09/61/71/1381096171.db2.gz	VTIJTIYAPSXORV-HZPDHXFCSA-N	0	3	334.435	3.092	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)C[C@H](C)c1c(C)n[nH]c1C	ZINC001158171965	1381147864	/nfs/dbraw/zinc/14/78/64/1381147864.db2.gz	RDMHMFXFSGYWSM-WMLDXEAASA-N	0	3	332.492	3.019	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H]1CCOc2c(F)cccc21	ZINC001158206761	1381158715	/nfs/dbraw/zinc/15/87/15/1381158715.db2.gz	GBDXJVQLCJJAJL-WBVHZDCISA-N	0	3	346.446	3.191	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1nc(Cl)sc1C	ZINC001158212151	1381159892	/nfs/dbraw/zinc/15/98/92/1381159892.db2.gz	BCOBSTQVCNAWAQ-GFCCVEGCSA-N	0	3	327.881	3.217	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1CCc2cc(F)ccc21	ZINC001158233964	1381170103	/nfs/dbraw/zinc/17/01/03/1381170103.db2.gz	VGUQBODRTDAMGC-IEBWSBKVSA-N	0	3	330.447	3.354	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc2c(c1)[C@@H](C)CO2	ZINC001158363926	1381219422	/nfs/dbraw/zinc/21/94/22/1381219422.db2.gz	NFLVQFGZZQZLOW-DOTOQJQBSA-N	0	3	328.456	3.295	20	30		EGEDHN
C=CCCCC(=O)N1CCCC[C@@H]1CN(C)CCc1ccns1	ZINC001158419748	1381240294	/nfs/dbraw/zinc/24/02/94/1381240294.db2.gz	ZIXWBTDVWVBRHB-MRXNPFEDSA-N	0	3	335.517	3.355	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cnc([C@@H]2CCCO2)s1	ZINC001158565638	1381303254	/nfs/dbraw/zinc/30/32/54/1381303254.db2.gz	VUBTUDZJKJPKTG-CABCVRRESA-N	0	3	349.500	3.107	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)C[C@@H]1OCc2ccccc21	ZINC001158801026	1381405263	/nfs/dbraw/zinc/40/52/63/1381405263.db2.gz	NKECYAFEDAZGCU-MJGOQNOKSA-N	0	3	328.456	3.147	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)COc1cc(C)cc(C)c1	ZINC001158853509	1381434744	/nfs/dbraw/zinc/43/47/44/1381434744.db2.gz	YIMADRXFCCSPBF-GOSISDBHSA-N	0	3	330.472	3.181	20	30		EGEDHN
Cc1nc(N(C)C)cc(N2CCC(C#N)(c3ccccc3F)CC2)n1	ZINC001158887835	1381449839	/nfs/dbraw/zinc/44/98/39/1381449839.db2.gz	HVLTYAUAYPYBGM-UHFFFAOYSA-N	0	3	339.418	3.052	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1ncoc1-c1ccccc1	ZINC001328352737	1388728306	/nfs/dbraw/zinc/72/83/06/1388728306.db2.gz	UCXHPIUPCAUURN-ZDUSSCGKSA-N	0	3	333.819	3.192	20	30		EGEDHN
N#Cc1ccc(CN2CC=C(CCNC(=O)C3CCCC3)CC2)cc1	ZINC001159106836	1381589410	/nfs/dbraw/zinc/58/94/10/1381589410.db2.gz	SITKDLMIJRJCSF-UHFFFAOYSA-N	0	3	337.467	3.387	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCC1=CCN([C@@H]2CCc3c2cccc3F)CC1	ZINC001159594218	1381840835	/nfs/dbraw/zinc/84/08/35/1381840835.db2.gz	OLTBZCRWOXCCOH-AUUYWEPGSA-N	0	3	341.430	3.111	20	30		EGEDHN
C=CCn1cccc1C(=O)NCCCNCc1c(F)cccc1Cl	ZINC001159974386	1381955176	/nfs/dbraw/zinc/95/51/76/1381955176.db2.gz	AGVKYBWEDYXGJC-UHFFFAOYSA-N	0	3	349.837	3.376	20	30		EGEDHN
C=CCn1cccc1C(=O)NCCCNCc1cccc(F)c1Cl	ZINC001159975389	1381956366	/nfs/dbraw/zinc/95/63/66/1381956366.db2.gz	ZTNAWKDRLXDVTN-UHFFFAOYSA-N	0	3	349.837	3.376	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccoc2C(F)(F)F)CC1	ZINC001160257875	1382052557	/nfs/dbraw/zinc/05/25/57/1382052557.db2.gz	IEMUORZOWUMKNL-UHFFFAOYSA-N	0	3	340.345	3.074	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)Cc2ccc(C)cc2Cl)CC1	ZINC001160514962	1382128369	/nfs/dbraw/zinc/12/83/69/1382128369.db2.gz	HNFHEPBNDZPQCI-UHFFFAOYSA-N	0	3	344.886	3.353	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc(C)cc(OC)c2C)CC1	ZINC001160600563	1382150373	/nfs/dbraw/zinc/15/03/73/1382150373.db2.gz	NPNUBXGRJIVDFD-UHFFFAOYSA-N	0	3	328.456	3.250	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CCc2ccccc2OCC)CC1	ZINC001160607380	1382152064	/nfs/dbraw/zinc/15/20/64/1382152064.db2.gz	OWSIGFSGLJJDML-UHFFFAOYSA-N	0	3	342.483	3.342	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cccc3cccnc32)CC1	ZINC001160612807	1382153281	/nfs/dbraw/zinc/15/32/81/1382153281.db2.gz	BBTJCIUBSVLKSO-UHFFFAOYSA-N	0	3	333.435	3.010	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cnc(CC3CC3)s2)CC1	ZINC001160772197	1382191416	/nfs/dbraw/zinc/19/14/16/1382191416.db2.gz	AYNUPMLBWRVXLQ-UHFFFAOYSA-N	0	3	331.485	3.034	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc3ncccc3s2)CC1	ZINC001160852012	1382216550	/nfs/dbraw/zinc/21/65/50/1382216550.db2.gz	MEYTXFIGWJFODU-UHFFFAOYSA-N	0	3	339.464	3.072	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCC1=CCN(Cc2ccc(C#N)cc2)CC1	ZINC001160888264	1382224950	/nfs/dbraw/zinc/22/49/50/1382224950.db2.gz	FVKQRHJAAFUFNL-UHFFFAOYSA-N	0	3	337.467	3.409	20	30		EGEDHN
C=CCN1CCC[C@H]1CNc1ccc(C(=O)N2CCC(C)CC2)cn1	ZINC001160957736	1382251241	/nfs/dbraw/zinc/25/12/41/1382251241.db2.gz	QYTVYYPLNZCNRU-SFHVURJKSA-N	0	3	342.487	3.016	20	30		EGEDHN
CC(C)(C)OC(=O)C(C#N)c1nccnc1N[C@H]1CCC(C)(C)C1	ZINC001161035223	1382279292	/nfs/dbraw/zinc/27/92/92/1382279292.db2.gz	GYCXYWPERVLCEK-QWHCGFSZSA-N	0	3	330.432	3.416	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCC1=CCN(CCOCC2CC2)CC1	ZINC001161121240	1382308040	/nfs/dbraw/zinc/30/80/40/1382308040.db2.gz	DILMPVXPHFYAOV-HXUWFJFHSA-N	0	3	334.504	3.154	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc[nH]c2C2CCC2)CC1	ZINC001161205300	1382340169	/nfs/dbraw/zinc/34/01/69/1382340169.db2.gz	CMULPVUQIQWOKA-UHFFFAOYSA-N	0	3	325.456	3.058	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)COc2ccsc2Cl)CC1	ZINC001161451662	1382414848	/nfs/dbraw/zinc/41/48/48/1382414848.db2.gz	GHTNBTDCXCRPJH-UHFFFAOYSA-N	0	3	340.876	3.105	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H]2C[C@@]23CCc2ccccc23)CC1	ZINC001161616230	1382460031	/nfs/dbraw/zinc/46/00/31/1382460031.db2.gz	GSPSTBCRQXVBFS-RBBKRZOGSA-N	0	3	336.479	3.215	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2sccc2C(F)F)CC1	ZINC001161796549	1382508563	/nfs/dbraw/zinc/50/85/63/1382508563.db2.gz	NATCPBCGJOFZLB-UHFFFAOYSA-N	0	3	338.423	3.461	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@H](C)Cc2cccc(F)c2)CC1	ZINC001161982947	1382586285	/nfs/dbraw/zinc/58/62/85/1382586285.db2.gz	OMOSGBJOSFWBOV-QGZVFWFLSA-N	0	3	342.458	3.166	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C2CC(c3ccccc3)C2)CC1	ZINC001161987174	1382589729	/nfs/dbraw/zinc/58/97/29/1382589729.db2.gz	RESZXUGHZKFOHQ-UHFFFAOYSA-N	0	3	336.479	3.342	20	30		EGEDHN
CC(C)=C[C@@H]1[C@H](C(=O)NCCCNCc2ccccc2C#N)C1(C)C	ZINC001162157135	1382643311	/nfs/dbraw/zinc/64/33/11/1382643311.db2.gz	ROWVVIPKZNTMDI-RTBURBONSA-N	0	3	339.483	3.393	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCC1(COC)CCN(C[C@@H](F)CC)CC1	ZINC001162424989	1382755457	/nfs/dbraw/zinc/75/54/57/1382755457.db2.gz	XNAHETBMSUQKCZ-IRXDYDNUSA-N	0	3	342.499	3.182	20	30		EGEDHN
C=C(C)C[NH2+]CCN(CCc1ccccc1)C(=O)c1ccccc1[O-]	ZINC001162709851	1382843548	/nfs/dbraw/zinc/84/35/48/1382843548.db2.gz	HREAVKIMOKYXCR-UHFFFAOYSA-N	0	3	338.451	3.243	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C(C)(C)C(C)C	ZINC001162821972	1382885943	/nfs/dbraw/zinc/88/59/43/1382885943.db2.gz	BHHUGKMNOSBWCF-UHFFFAOYSA-N	0	3	328.500	3.353	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1cccc(C(C)C)n1	ZINC001162856398	1382896241	/nfs/dbraw/zinc/89/62/41/1382896241.db2.gz	FLBDEXCKPULCGA-UHFFFAOYSA-N	0	3	349.478	3.113	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C[C@H]1CCCC1(F)F	ZINC001162906268	1382911575	/nfs/dbraw/zinc/91/15/75/1382911575.db2.gz	HOKNGOQRIQEMNF-GOSISDBHSA-N	0	3	348.437	3.106	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H](CC)CCC	ZINC001162971129	1382932789	/nfs/dbraw/zinc/93/27/89/1382932789.db2.gz	YIECXXATGRVZEV-FQEVSTJZSA-N	0	3	328.500	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CCCC[C@H]1CC	ZINC001162970980	1382933022	/nfs/dbraw/zinc/93/30/22/1382933022.db2.gz	RQEOVFKTELWLMU-NHCUHLMSSA-N	0	3	340.511	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1ccc(C)c(C)c1	ZINC001162992847	1382941029	/nfs/dbraw/zinc/94/10/29/1382941029.db2.gz	YZAGPEZKTKWHRX-UHFFFAOYSA-N	0	3	334.463	3.211	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@]1(C)CC=C(C)CC1	ZINC001163001945	1382944349	/nfs/dbraw/zinc/94/43/49/1382944349.db2.gz	RTIFGSNJAHRXSB-JOCHJYFZSA-N	0	3	338.495	3.417	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1ccoc1C(C)C	ZINC001163006687	1382945824	/nfs/dbraw/zinc/94/58/24/1382945824.db2.gz	IWWNFERVYPINNX-UHFFFAOYSA-N	0	3	338.451	3.311	20	30		EGEDHN
O=C(NCCC1(CNCC#Cc2ccccc2Cl)CC1)C1CCC1	ZINC001163103808	1382965801	/nfs/dbraw/zinc/96/58/01/1382965801.db2.gz	JZNGODVCVBRXJQ-UHFFFAOYSA-N	0	3	344.886	3.368	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)CC2CCCC2)CC1	ZINC001163222325	1382997012	/nfs/dbraw/zinc/99/70/12/1382997012.db2.gz	ISVGXSANVWXRKB-UHFFFAOYSA-N	0	3	343.309	3.351	20	30		EGEDHN
CCCCC(=O)NCCC1(CNCc2ccc(C#N)cc2F)CC1	ZINC001163464398	1383057032	/nfs/dbraw/zinc/05/70/32/1383057032.db2.gz	GZAAXCGYAKOECP-UHFFFAOYSA-N	0	3	331.435	3.264	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)C(C)(C)c1cccs1	ZINC001163883715	1383132798	/nfs/dbraw/zinc/13/27/98/1383132798.db2.gz	PXPQGGMWVWFLBH-UHFFFAOYSA-N	0	3	345.306	3.030	20	30		EGEDHN
Cc1nc(CNCC2(CCNC(=O)C#CC(C)(C)C)CC2)sc1C	ZINC001164471357	1383189985	/nfs/dbraw/zinc/18/99/85/1383189985.db2.gz	CPTVVJFUKPVGTN-UHFFFAOYSA-N	0	3	347.528	3.186	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)C(C)=C2CCC2)CC1	ZINC001164476638	1383190624	/nfs/dbraw/zinc/19/06/24/1383190624.db2.gz	PIVGELJXGIIMOF-UHFFFAOYSA-N	0	3	341.293	3.272	20	30		EGEDHN
C[C@@H](NCC1(CCNC(=O)C#CC2CC2)CC1)c1ccc(F)cc1F	ZINC001164482937	1383191377	/nfs/dbraw/zinc/19/13/77/1383191377.db2.gz	RYIUZFNMQYJFRG-CQSZACIVSA-N	0	3	346.421	3.315	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2c(C)noc2CCC)CC1	ZINC001164513848	1383195096	/nfs/dbraw/zinc/19/50/96/1383195096.db2.gz	JGLGURGWQJEHSG-UHFFFAOYSA-N	0	3	339.867	3.178	20	30		EGEDHN
CCN(CC)Cc1cc(OC)ccc1NC(=NC#N)c1ccncc1	ZINC001164517005	1383195553	/nfs/dbraw/zinc/19/55/53/1383195553.db2.gz	GGTCKMHCRJGKSQ-UHFFFAOYSA-N	0	3	337.427	3.081	20	30		EGEDHN
CCN(CC)Cc1cc(NC(=NC#N)c2ccncc2)ccc1OC	ZINC001164517131	1383195560	/nfs/dbraw/zinc/19/55/60/1383195560.db2.gz	JLTDVGOXWJBBCH-UHFFFAOYSA-N	0	3	337.427	3.081	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCC1(CNCc2cccnc2OC)CC1	ZINC001165215461	1383251261	/nfs/dbraw/zinc/25/12/61/1383251261.db2.gz	YUCOGJQWPRWIIZ-UHFFFAOYSA-N	0	3	345.487	3.069	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2sc(Cl)nc2C)CC1	ZINC001165234714	1383254632	/nfs/dbraw/zinc/25/46/32/1383254632.db2.gz	FFMTZKSEVDZIOG-UHFFFAOYSA-N	0	3	348.299	3.347	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C2(COC)CCCCC2)CC1	ZINC001165348611	1383278957	/nfs/dbraw/zinc/27/89/57/1383278957.db2.gz	FYLYLSRDPSCVES-UHFFFAOYSA-N	0	3	342.911	3.212	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1ccc(CCC)cc1	ZINC001165491112	1383302272	/nfs/dbraw/zinc/30/22/72/1383302272.db2.gz	WHFXINHORWHNFR-UHFFFAOYSA-N	0	3	339.277	3.257	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCCNCc1nsc2ccccc12	ZINC001165929123	1383366799	/nfs/dbraw/zinc/36/67/99/1383366799.db2.gz	IHRBYCCESXAUAR-GOSISDBHSA-N	0	3	331.485	3.495	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)C2(C)CCCC2)CC1	ZINC001166444708	1383423145	/nfs/dbraw/zinc/42/31/45/1383423145.db2.gz	ZTVTWDGZRTXMST-UHFFFAOYSA-N	0	3	343.309	3.351	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCC1(CNCC(=C)Br)CC1	ZINC001166693684	1383461580	/nfs/dbraw/zinc/46/15/80/1383461580.db2.gz	JEQQUARGYXBQGH-OCCSQVGLSA-N	0	3	343.309	3.229	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCC1(CNCc2c(C)noc2CC)CC1	ZINC001166703711	1383463873	/nfs/dbraw/zinc/46/38/73/1383463873.db2.gz	JSYGSPSMZMWDST-CABCVRRESA-N	0	3	347.503	3.380	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCC1(CNCc2cccc(OC)n2)CC1	ZINC001167026169	1383522667	/nfs/dbraw/zinc/52/26/67/1383522667.db2.gz	SYKVPELILQYGNS-LJQANCHMSA-N	0	3	345.487	3.069	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cccc(OC)c2C)CC1	ZINC001167334408	1383600998	/nfs/dbraw/zinc/60/09/98/1383600998.db2.gz	QIVKGMWCAAPSIX-UHFFFAOYSA-N	0	3	336.863	3.246	20	30		EGEDHN
C[C@@H](Cc1cccs1)C(=O)NCCCNCc1ccccc1C#N	ZINC001167467477	1383641178	/nfs/dbraw/zinc/64/11/78/1383641178.db2.gz	HHMACNKBVQHGQB-HNNXBMFYSA-N	0	3	341.480	3.094	20	30		EGEDHN
C=C(Cl)Cn1c(CC(C)C)nnc1N1CCN(CC(C)C)CC1	ZINC001301043697	1383691773	/nfs/dbraw/zinc/69/17/73/1383691773.db2.gz	BQTTVOUZGFXKPX-UHFFFAOYSA-N	0	3	339.915	3.007	20	30		EGEDHN
CC(C)(C)C(=O)Nc1ccc(CN)nc1N[C@H]1CC[C@H](C#N)CC1	ZINC001167842741	1383756484	/nfs/dbraw/zinc/75/64/84/1383756484.db2.gz	QEGBIBGPMSJBJV-JOCQHMNTSA-N	0	3	329.448	3.019	20	30		EGEDHN
N#Cc1ccccc1N1CCN([C@H]2CCc3cc(F)ccc3C2)CC1	ZINC001168420843	1383901749	/nfs/dbraw/zinc/90/17/49/1383901749.db2.gz	MVODLPAIXKOHEK-FQEVSTJZSA-N	0	3	335.426	3.377	20	30		EGEDHN
C[C@@H](CC#N)N[C@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C(F)(F)F)C1	ZINC001168531102	1383930991	/nfs/dbraw/zinc/93/09/91/1383930991.db2.gz	UQNRMVWPRPAMNU-SDDRHHMPSA-N	0	3	335.370	3.209	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)CC2CCC(OC)CC2)CC1	ZINC001168557049	1383935816	/nfs/dbraw/zinc/93/58/16/1383935816.db2.gz	NCDMPOLCEMXORM-UHFFFAOYSA-N	0	3	342.911	3.210	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)c1ccncc1	ZINC001168797346	1384009533	/nfs/dbraw/zinc/00/95/33/1384009533.db2.gz	XZWOMADMSUKTEZ-MRXNPFEDSA-N	0	3	336.439	3.032	20	30		EGEDHN
CN(C)/C=N/c1ccc(NCCC(=O)Nc2ccccc2)cc1C#N	ZINC001168981774	1384078673	/nfs/dbraw/zinc/07/86/73/1384078673.db2.gz	PZTWVHVQQXFWDE-HYARGMPZSA-N	0	3	335.411	3.220	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@H]1CC[C@H](C(C)C)CC1	ZINC001169185620	1384120197	/nfs/dbraw/zinc/12/01/97/1384120197.db2.gz	XYFNGBLVYMWSHE-SHTZXODSSA-N	0	3	345.325	3.453	20	30		EGEDHN
COc1ccc(NC(=O)N2CCN(CCC(C)(C)C)CC2)cc1C#N	ZINC001311120268	1384258758	/nfs/dbraw/zinc/25/87/58/1384258758.db2.gz	OKPPAQAUMTXKNO-UHFFFAOYSA-N	0	3	344.459	3.153	20	30		EGEDHN
CO[C@@H]1[C@H](C)[C@@H](NCc2ccc(C#N)cc2Br)C1(C)C	ZINC001170398980	1384307403	/nfs/dbraw/zinc/30/74/03/1384307403.db2.gz	GOSQBTLEEPSAJG-VCTAVGKDSA-N	0	3	337.261	3.470	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)C1(C(F)F)CC1	ZINC001170751806	1384378729	/nfs/dbraw/zinc/37/87/29/1384378729.db2.gz	VQPXGPZJXZINBR-CQSZACIVSA-N	0	3	349.425	3.368	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H](C)CCCCNCc1nnc(C(C)C)[nH]1	ZINC001171007098	1384428184	/nfs/dbraw/zinc/42/81/84/1384428184.db2.gz	FIAWDKYBQLAXJF-OAHLLOKOSA-N	0	3	349.523	3.295	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1CC[C@@H](F)[C@@](O)(C(F)(F)F)CC1	ZINC001171210747	1384469865	/nfs/dbraw/zinc/46/98/65/1384469865.db2.gz	WEEQGHVPRRDTAS-DAXOMENPSA-N	0	3	344.352	3.217	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)[C@@H](F)CC1CCCCC1	ZINC001171279079	1384484349	/nfs/dbraw/zinc/48/43/49/1384484349.db2.gz	OVPGHFAQNNZKOS-IBGZPJMESA-N	0	3	345.462	3.463	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1ccccc1Cl	ZINC001171813835	1384647774	/nfs/dbraw/zinc/64/77/74/1384647774.db2.gz	VUKMXQRPEPJWRS-UHFFFAOYSA-N	0	3	327.815	3.121	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1ccc(Cl)cc1	ZINC001171818913	1384649875	/nfs/dbraw/zinc/64/98/75/1384649875.db2.gz	WRZJXBCMTGLRTR-UHFFFAOYSA-N	0	3	327.815	3.121	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1cc(CCC)on1	ZINC001316879237	1384664657	/nfs/dbraw/zinc/66/46/57/1384664657.db2.gz	JVUAFFLHWMTBGB-CJNGLKHVSA-N	0	3	339.867	3.352	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)C1(CCF)CC1	ZINC001171902180	1384675174	/nfs/dbraw/zinc/67/51/74/1384675174.db2.gz	KWXNZQQVCJEWSX-MRXNPFEDSA-N	0	3	345.462	3.463	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)N1CCC[C@@H](C(F)(F)F)[C@H]1CO	ZINC001172315167	1384768263	/nfs/dbraw/zinc/76/82/63/1384768263.db2.gz	NZINPFKXAXJNLU-DAXOMENPSA-N	0	3	326.362	3.124	20	30		EGEDHN
CC(C)C(C)(C)C(=O)NC[C@@H](NCc1cc(C#N)ccc1F)C1CC1	ZINC001317016817	1384780809	/nfs/dbraw/zinc/78/08/09/1384780809.db2.gz	GNUKADDSALRUEO-GOSISDBHSA-N	0	3	345.462	3.364	20	30		EGEDHN
CC(C)(C(=O)NC[C@@H](NCc1ccc(C#N)cc1F)C1CC1)C1CC1	ZINC001317027269	1384794522	/nfs/dbraw/zinc/79/45/22/1384794522.db2.gz	PKQSODIWYMBICU-GOSISDBHSA-N	0	3	343.446	3.118	20	30		EGEDHN
C[C@H](CCCC#N)N1CCC(n2c3ccccc3n(C)c2=O)CC1	ZINC001172507232	1384807508	/nfs/dbraw/zinc/80/75/08/1384807508.db2.gz	QWWCMTMXVLGHSA-OAHLLOKOSA-N	0	3	326.444	3.059	20	30		EGEDHN
COC(=O)[C@H]1CCC[C@@H](N2CCC(C#N)(c3ccccc3)CC2)C1	ZINC001172612266	1384819308	/nfs/dbraw/zinc/81/93/08/1384819308.db2.gz	TWESWPGXRODQDV-FUHWJXTLSA-N	0	3	326.440	3.276	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@H](NC(=O)CCC3CCC3)C2)c1	ZINC001317076282	1384842844	/nfs/dbraw/zinc/84/28/44/1384842844.db2.gz	RCZXLMCMDGPYBS-QAQDUYKDSA-N	0	3	329.419	3.014	20	30		EGEDHN
CC(C)(C)OC(=O)[C@H]1CCCCN1CNC1CCC(CC#N)CC1	ZINC001173334596	1384960506	/nfs/dbraw/zinc/96/05/06/1384960506.db2.gz	UZPQOYWZFJHCIT-OFLPRAFFSA-N	0	3	335.492	3.202	20	30		EGEDHN
C=CCN1c2ccc(Nc3ccncc3C)cc2C2(CCOCC2)C1=O	ZINC001174537274	1385117571	/nfs/dbraw/zinc/11/75/71/1385117571.db2.gz	ALSCOUYRZFXPHT-UHFFFAOYSA-N	0	3	349.434	3.136	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)N[C@@H](C)CCCCNCc1ccccc1C#N	ZINC001174781326	1385148095	/nfs/dbraw/zinc/14/80/95/1385148095.db2.gz	AWDKPSOPAQAYFR-MAUKXSAKSA-N	0	3	333.451	3.317	20	30		EGEDHN
C=CCCCC(=O)N[C@H](C)CCCCNCc1nnc(C)n1CCC	ZINC001174985890	1385178970	/nfs/dbraw/zinc/17/89/70/1385178970.db2.gz	CAAGFWHMLZFMMT-MRXNPFEDSA-N	0	3	349.523	3.117	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](C)CCCCN[C@H](C)c2nnc(C)[nH]2)CC1	ZINC001175073827	1385189960	/nfs/dbraw/zinc/18/99/60/1385189960.db2.gz	ITYPANTVUOHFCL-LSDHHAIUSA-N	0	3	347.507	3.185	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)CCC1CCCCC1	ZINC001175195559	1385216573	/nfs/dbraw/zinc/21/65/73/1385216573.db2.gz	YIDOTYQBXPIMOK-UHFFFAOYSA-N	0	3	331.298	3.351	20	30		EGEDHN
CCN1CCN(c2ccc(Nc3cnc(C#N)c(Cl)c3)cc2)CC1	ZINC001175782915	1385404481	/nfs/dbraw/zinc/40/44/81/1385404481.db2.gz	YEBAKGXGCJMFMT-UHFFFAOYSA-N	0	3	341.846	3.492	20	30		EGEDHN
N#Cc1cccc([C@@H](O)CN2CCC[C@H]2COc2ccc(F)cc2)c1	ZINC001176531955	1385617466	/nfs/dbraw/zinc/61/74/66/1385617466.db2.gz	GDKAHZHZGZWLGE-ICSRJNTNSA-N	0	3	340.398	3.274	20	30		EGEDHN
C=C[C@@H](C(=O)NCCCNCc1ccn(C(C)C)n1)c1ccccc1	ZINC001176785552	1385696565	/nfs/dbraw/zinc/69/65/65/1385696565.db2.gz	HZWYXPXNCJWCCL-LJQANCHMSA-N	0	3	340.471	3.030	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)CCCCNCc2nnc(C)[nH]2)CCCC1	ZINC001176853696	1385724547	/nfs/dbraw/zinc/72/45/47/1385724547.db2.gz	FHAAUBPROCZQJI-HNNXBMFYSA-N	0	3	347.507	3.014	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1ccc(C(C)C)s1	ZINC001177147755	1385834285	/nfs/dbraw/zinc/83/42/85/1385834285.db2.gz	RNTIGAAUWZFGLI-UHFFFAOYSA-N	0	3	345.306	3.490	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)c1ncoc1C	ZINC001177239092	1385881557	/nfs/dbraw/zinc/88/15/57/1385881557.db2.gz	ZSVJNYQUNQRMOZ-UHFFFAOYSA-N	0	3	339.867	3.348	20	30		EGEDHN
C=CCCC(=O)N(CCCNCc1nccnc1C)CC1CCCC1	ZINC001177245896	1385882775	/nfs/dbraw/zinc/88/27/75/1385882775.db2.gz	NYTSOHZQSJCFTR-UHFFFAOYSA-N	0	3	344.503	3.250	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1coc2ccccc12	ZINC001177428179	1385953082	/nfs/dbraw/zinc/95/30/82/1385953082.db2.gz	YXUBERFNZQVOSL-UHFFFAOYSA-N	0	3	333.391	3.214	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)C1(C)CCCCC1	ZINC001319237869	1386019463	/nfs/dbraw/zinc/01/94/63/1386019463.db2.gz	JWXDPNVIUXBCRE-MRXNPFEDSA-N	0	3	327.472	3.371	20	30		EGEDHN
CCc1ccsc1C(=O)NC[C@@H](C)CNCc1ccccc1C#N	ZINC001319284180	1386041992	/nfs/dbraw/zinc/04/19/92/1386041992.db2.gz	FMNSNNQPJVZARB-AWEZNQCLSA-N	0	3	341.480	3.338	20	30		EGEDHN
N#CC(Cc1cccs1)C(=O)Nc1cn2c(cccc2Cl)n1	ZINC001177909831	1386080944	/nfs/dbraw/zinc/08/09/44/1386080944.db2.gz	ZOVQGRZZYQMNGQ-SNVBAGLBSA-N	0	3	330.800	3.370	20	30		EGEDHN
CCC(=O)N1CC[C@H](NCC#Cc2ccc(C(F)(F)F)cc2)[C@@H]1C	ZINC001177977905	1386100961	/nfs/dbraw/zinc/10/09/61/1386100961.db2.gz	NSQHEEVRDWAEJB-BBRMVZONSA-N	0	3	338.373	3.046	20	30		EGEDHN
Cc1cccc(C(=O)N2CC[C@H](NCC#Cc3ccccc3)[C@@H]2C)c1	ZINC001178054296	1386118025	/nfs/dbraw/zinc/11/80/25/1386118025.db2.gz	HDHMNVSVWSKMEE-RXVVDRJESA-N	0	3	332.447	3.239	20	30		EGEDHN
N#Cc1ccc(F)cc1CNCCCCCCNC(=O)/C=C\C1CC1	ZINC001178110289	1386131771	/nfs/dbraw/zinc/13/17/71/1386131771.db2.gz	VAOJBKYXFNSIGU-YFHOEESVSA-N	0	3	343.446	3.430	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)N(C)C(=O)C12CCC(CC1)C2	ZINC001319477513	1386139090	/nfs/dbraw/zinc/13/90/90/1386139090.db2.gz	OZFMYEZLFMESHV-VNSJNIRKSA-N	0	3	331.485	3.137	20	30		EGEDHN
CC/C=C(\C)C(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)[C@@H]1C	ZINC001178245678	1386170439	/nfs/dbraw/zinc/17/04/39/1386170439.db2.gz	OCBHAFWTNSUMDT-KZQVWELSSA-N	0	3	329.419	3.133	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2Cl)CCN1C(=O)/C=C/C1CC1	ZINC001178418166	1386211761	/nfs/dbraw/zinc/21/17/61/1386211761.db2.gz	MISNLUCWXYJZQY-NVPHKHGQSA-N	0	3	342.870	3.237	20	30		EGEDHN
CC(C)n1ccc(CNCCCCCCNC(=O)C#CC(C)(C)C)n1	ZINC001178441927	1386218320	/nfs/dbraw/zinc/21/83/20/1386218320.db2.gz	BXEKEOXTCBVPFR-UHFFFAOYSA-N	0	3	346.519	3.280	20	30		EGEDHN
N#Cc1ccc(F)cc1CNCCCCCCNC(=O)c1cc[nH]c1	ZINC001178552399	1386246828	/nfs/dbraw/zinc/24/68/28/1386246828.db2.gz	ZOYNRSDBKJFFCV-UHFFFAOYSA-N	0	3	342.418	3.105	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCCCCCNCc1cc(C)n(C)n1	ZINC001178564213	1386248836	/nfs/dbraw/zinc/24/88/36/1386248836.db2.gz	AOJVFOLPQZGRHU-UHFFFAOYSA-N	0	3	346.519	3.263	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@H](N[C@H](C)c2ccc(F)cc2F)[C@@H]1C	ZINC001178637697	1386266008	/nfs/dbraw/zinc/26/60/08/1386266008.db2.gz	QIYURFAVAHNKGG-GLJUWKHASA-N	0	3	334.410	3.264	20	30		EGEDHN
N#CCCn1cc(CNCc2ccc(CO)cc2)c(-c2ccccc2)n1	ZINC001179021439	1386378584	/nfs/dbraw/zinc/37/85/84/1386378584.db2.gz	YCMGWXUEJQBJJC-UHFFFAOYSA-N	0	3	346.434	3.246	20	30		EGEDHN
CC(C)[C@H](F)C(=O)NCCCCCCNCc1ccccc1C#N	ZINC001179302084	1386442605	/nfs/dbraw/zinc/44/26/05/1386442605.db2.gz	KEKNQRZXFYZBDF-SFHVURJKSA-N	0	3	333.451	3.319	20	30		EGEDHN
C=CCCCC(=O)NCCCCCCN[C@@H](C)c1nnc(CC)[nH]1	ZINC001179425870	1386481199	/nfs/dbraw/zinc/48/11/99/1386481199.db2.gz	JDSINPNHOXNFEB-HNNXBMFYSA-N	0	3	335.496	3.051	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)NCCCCCCNC/C(Cl)=C/Cl	ZINC001179633717	1386537146	/nfs/dbraw/zinc/53/71/46/1386537146.db2.gz	JDTLLFDTKVFPEH-ZDZFUCEFSA-N	0	3	349.302	3.163	20	30		EGEDHN
CC(C)C[C@@H](C)C(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)[C@@H]1C	ZINC001179793268	1386588091	/nfs/dbraw/zinc/58/80/91/1386588091.db2.gz	CWGMDGVLQQWVEY-VCBZYWHSSA-N	0	3	345.462	3.459	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)Cc2ccc(C)nc2)CCCC[C@H]1C	ZINC001698660624	1406311558	/nfs/dbraw/zinc/31/15/58/1406311558.db2.gz	KVOJXWUQJHJVOI-AUUYWEPGSA-N	0	3	349.906	3.340	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)Cc2ccc(C)nc2)CCCC[C@@H]1C	ZINC001698660645	1406311712	/nfs/dbraw/zinc/31/17/12/1406311712.db2.gz	KVOJXWUQJHJVOI-IFXJQAMLSA-N	0	3	349.906	3.340	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CCCC2)C[C@@]1(C)CNCc1ccccc1C#N	ZINC001180386888	1386781007	/nfs/dbraw/zinc/78/10/07/1386781007.db2.gz	COQNTLTTWWFWAI-IIBYNOLFSA-N	0	3	339.483	3.323	20	30		EGEDHN
Cc1cccc(C)c1C(=O)N[C@@H](C)CNCc1ccc(C#N)s1	ZINC001321991412	1387025301	/nfs/dbraw/zinc/02/53/01/1387025301.db2.gz	KEHGKBZOGQFHHE-AWEZNQCLSA-N	0	3	327.453	3.145	20	30		EGEDHN
Cc1oc(C)c(C(=O)N[C@H](C)CN(C)Cc2cccc(C#N)c2)c1C	ZINC001322197539	1387099338	/nfs/dbraw/zinc/09/93/38/1387099338.db2.gz	VRSJBHFEQIGAEU-CYBMUJFWSA-N	0	3	339.439	3.327	20	30		EGEDHN
CCCC[C@@H](C)C(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001182277495	1387136459	/nfs/dbraw/zinc/13/64/59/1387136459.db2.gz	GYCQAMQUBLOJMO-RHSMWYFYSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2ocnc2C)C1	ZINC001182305038	1387142843	/nfs/dbraw/zinc/14/28/43/1387142843.db2.gz	DERACJBCJCWHNW-QMTMVMCOSA-N	0	3	333.476	3.160	20	30		EGEDHN
CC[C@H](N[C@@H]1CCN(C(=O)C#CC(C)C)C1)c1ccc(F)cc1F	ZINC001182431742	1387164844	/nfs/dbraw/zinc/16/48/44/1387164844.db2.gz	GAXHGTUFROSRDP-QAPCUYQASA-N	0	3	334.410	3.266	20	30		EGEDHN
N#Cc1ccc(-c2ccccc2NC(=O)[C@@H]2CCCN2CC2CC2)nc1	ZINC001182558469	1387187066	/nfs/dbraw/zinc/18/70/66/1387187066.db2.gz	XHGLQVHXAMEKPU-FQEVSTJZSA-N	0	3	346.434	3.433	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)C(CC)CC)CC1	ZINC001698706064	1406347846	/nfs/dbraw/zinc/34/78/46/1406347846.db2.gz	VJAOUVUTTNAEJI-HDJSIYSDSA-N	0	3	331.298	3.348	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](NCc2cn(C(C)C)nc2C)C1	ZINC001182841086	1387233202	/nfs/dbraw/zinc/23/32/02/1387233202.db2.gz	GZLMVNXSFKJFTG-LJQANCHMSA-N	0	3	344.503	3.231	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)C1(CC)CCOCC1	ZINC001329345142	1389069957	/nfs/dbraw/zinc/06/99/57/1389069957.db2.gz	IGGBPDOUZJUCEH-UHFFFAOYSA-N	0	3	330.900	3.020	20	30		EGEDHN
C[C@H]1[C@H](NCc2ccc(C#N)s2)CCN1C(=O)CCC(F)(F)F	ZINC001331869557	1389893657	/nfs/dbraw/zinc/89/36/57/1389893657.db2.gz	LLBWLKPSXVLWGG-GXFFZTMASA-N	0	3	345.390	3.041	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N[C@@H](COC)c1cccc(C(F)(F)F)c1	ZINC001339954747	1390198517	/nfs/dbraw/zinc/19/85/17/1390198517.db2.gz	HPYZDDVSDIPATN-GJZGRUSLSA-N	0	3	344.377	3.193	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccc2[nH]c([C@H]3CCCO3)nc2c1	ZINC001340185248	1390245187	/nfs/dbraw/zinc/24/51/87/1390245187.db2.gz	SFDIITRAKYANJG-CZUORRHYSA-N	0	3	328.416	3.037	20	30		EGEDHN
C=C(C)CN(C)c1nnc([C@H]2CCCN(C)C2)n1Cc1ccccc1	ZINC001340498258	1390299246	/nfs/dbraw/zinc/29/92/46/1390299246.db2.gz	LWHPEEJOZAMECE-SFHVURJKSA-N	0	3	339.487	3.148	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N[C@@H](C)c1ccc(-n2nc(C)cc2C)cc1	ZINC001340880399	1390393312	/nfs/dbraw/zinc/39/33/12/1390393312.db2.gz	NGBFMKPVSSWYOJ-QFBILLFUSA-N	0	3	340.471	3.350	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)c1coc2ccccc21	ZINC001698778781	1406445590	/nfs/dbraw/zinc/44/55/90/1406445590.db2.gz	KWRBXRPQVXKXNE-OAHLLOKOSA-N	0	3	347.418	3.460	20	30		EGEDHN
C[C@H](C(=O)C(C#N)C(=O)NC1CCCCC1)c1ccc(F)cc1F	ZINC001341899793	1390546821	/nfs/dbraw/zinc/54/68/21/1390546821.db2.gz	UDCUIVFGWLOJHH-NHYWBVRUSA-N	0	3	334.366	3.226	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccnn1Cc1ccc(Cl)s1	ZINC001342138471	1390576901	/nfs/dbraw/zinc/57/69/01/1390576901.db2.gz	PMKBEEYJTFVXBA-LBPRGKRZSA-N	0	3	338.864	3.268	20	30		EGEDHN
C[C@@H](C(=O)C(C#N)C(=O)NC1CCCCC1)c1ccc(F)c(F)c1	ZINC001342580682	1390628633	/nfs/dbraw/zinc/62/86/33/1390628633.db2.gz	UAEITAWLPJYDAB-RISCZKNCSA-N	0	3	334.366	3.226	20	30		EGEDHN
CC(C)N1CCC[C@@H]1C(=O)C(C#N)c1nc2cc(F)ccc2s1	ZINC001343273385	1390704129	/nfs/dbraw/zinc/70/41/29/1390704129.db2.gz	HIRFRORVMYSUTB-TZMCWYRMSA-N	0	3	331.416	3.484	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)NCc1ccc2c(c1)nc(CC)n2C1CC1	ZINC001353870172	1392103834	/nfs/dbraw/zinc/10/38/34/1392103834.db2.gz	RUYGTWCGJAHXTF-INIZCTEOSA-N	0	3	340.471	3.233	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N1CCC[C@H](c2nc3c(s2)CCC3)C1	ZINC001354842111	1392172208	/nfs/dbraw/zinc/17/22/08/1392172208.db2.gz	RXQCEEALRVDCAX-UONOGXRCSA-N	0	3	333.501	3.021	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)CC(CC)CC)C1	ZINC001479330353	1392216383	/nfs/dbraw/zinc/21/63/83/1392216383.db2.gz	QQHCKBPQCUYNHC-OKILXGFUSA-N	0	3	331.298	3.206	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@H](CC)CC(F)(F)F)C1	ZINC001479408384	1392237279	/nfs/dbraw/zinc/23/72/79/1392237279.db2.gz	KSUNMLQYOXMOEE-IJLUTSLNSA-N	0	3	326.790	3.202	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@H](CC)OC2CCCCC2)C1	ZINC001480138749	1392598562	/nfs/dbraw/zinc/59/85/62/1392598562.db2.gz	LMQLWWFAJNWPFT-DZKIICNBSA-N	0	3	328.884	3.104	20	30		EGEDHN
CCN(CCNC(=O)c1ccc(C)s1)Cc1ccc(C#N)cc1	ZINC001480959550	1393048547	/nfs/dbraw/zinc/04/85/47/1393048547.db2.gz	PWLFATDANAYGEH-UHFFFAOYSA-N	0	3	327.453	3.180	20	30		EGEDHN
CCCN(CCNC(=O)c1coc(C)c1)Cc1ccc(C#N)cc1	ZINC001481133804	1393129044	/nfs/dbraw/zinc/12/90/44/1393129044.db2.gz	JUHBIGRQONOACN-UHFFFAOYSA-N	0	3	325.412	3.102	20	30		EGEDHN
CC[C@@H](CNC(=O)c1conc1C(C)C)NCc1ccc(C#N)s1	ZINC001481817926	1394544720	/nfs/dbraw/zinc/54/47/20/1394544720.db2.gz	CLRUNLSSDQMEKG-LBPRGKRZSA-N	0	3	346.456	3.029	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)CC2CCOCC2)CCCC[C@H]1C	ZINC001481958233	1394619872	/nfs/dbraw/zinc/61/98/72/1394619872.db2.gz	UYDGGGRBNDBDKO-RDTXWAMCSA-N	0	3	342.911	3.210	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)[C@H](C)c1cccs1	ZINC001482141496	1394766998	/nfs/dbraw/zinc/76/69/98/1394766998.db2.gz	DFCPZFRKCHHIQY-HUUCEWRRSA-N	0	3	341.480	3.265	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1ccc2scnc2c1)C(C)C	ZINC001482564997	1395091034	/nfs/dbraw/zinc/09/10/34/1395091034.db2.gz	ZDTJALYUCNSGSF-CQSZACIVSA-N	0	3	337.876	3.393	20	30		EGEDHN
C[C@]1(CNC(=O)CC2CC2)CCCN(Cc2cccc(C#N)c2)C1	ZINC001484148058	1395284824	/nfs/dbraw/zinc/28/48/24/1395284824.db2.gz	GOAFBOMSIVNVRB-HXUWFJFHSA-N	0	3	325.456	3.077	20	30		EGEDHN
CC(C)[C@H](C)C(=O)NCC1(NCc2ccc(F)c(C#N)c2)CCC1	ZINC001484654134	1395463964	/nfs/dbraw/zinc/46/39/64/1395463964.db2.gz	ZFUUFOCRUUDZSI-AWEZNQCLSA-N	0	3	331.435	3.118	20	30		EGEDHN
C[C@@H](C#N)C(=O)N(C)CCN(C)Cc1ccc(-c2ccsc2)cc1	ZINC001698983045	1406762605	/nfs/dbraw/zinc/76/26/05/1406762605.db2.gz	FLTQRVXZEFQAMV-HNNXBMFYSA-N	0	3	341.480	3.465	20	30		EGEDHN
CN(C(=O)C1CC2(CC2)C1)[C@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001485828528	1396158749	/nfs/dbraw/zinc/15/87/49/1396158749.db2.gz	WZKNFAMRNLVURE-QGZVFWFLSA-N	0	3	343.496	3.137	20	30		EGEDHN
CCC1(C(=O)N[C@H]2CC[C@H](CNCc3ccccc3C#N)C2)CC1	ZINC001486211743	1396183287	/nfs/dbraw/zinc/18/32/87/1396183287.db2.gz	DNGCQVUESOWXOQ-YJBOKZPZSA-N	0	3	325.456	3.123	20	30		EGEDHN
CC(C)(C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2)C1CC1	ZINC001688118566	1396735979	/nfs/dbraw/zinc/73/59/79/1396735979.db2.gz	INQPSZKQTIYZAL-UHFFFAOYSA-N	0	3	337.467	3.029	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1sc(C)nc1C	ZINC001689912098	1404205527	/nfs/dbraw/zinc/20/55/27/1404205527.db2.gz	QCMLJQQAKBELCU-RISCZKNCSA-N	0	3	341.908	3.485	20	30		EGEDHN
CCCC[C@@H](C)C(=O)N1CC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001690224541	1404427251	/nfs/dbraw/zinc/42/72/51/1404427251.db2.gz	GYCQAMQUBLOJMO-PBHICJAKSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1ccccc1-n1cccc1	ZINC001690861192	1404782533	/nfs/dbraw/zinc/78/25/33/1404782533.db2.gz	UWBUTLHKYFDSEI-HNNXBMFYSA-N	0	3	331.847	3.328	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)Cc2ccccc2Cl)C1	ZINC001691478492	1405294234	/nfs/dbraw/zinc/29/42/34/1405294234.db2.gz	GIWLBKDACYMGOO-XBXGTLAGSA-N	0	3	327.255	3.119	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)C[C@@H]2CCc3ccccc3C2)C1	ZINC001691825793	1405542729	/nfs/dbraw/zinc/54/27/29/1405542729.db2.gz	XZMHVOIIWQAFQD-GPMSIDNRSA-N	0	3	346.902	3.419	20	30		EGEDHN
CC[C@@H](CNC(=O)c1cccc(C)c1F)NCc1ccc(C#N)s1	ZINC001732200151	1428450744	/nfs/dbraw/zinc/45/07/44/1428450744.db2.gz	LPFDELPVMDANRJ-ZDUSSCGKSA-N	0	3	345.443	3.366	20	30		EGEDHN
CC(C)c1cccc(CNC[C@H]2CCCN2C(=O)C#CC(C)(C)C)n1	ZINC001732327160	1428535412	/nfs/dbraw/zinc/53/54/12/1428535412.db2.gz	PPIHHXZYXSFAOO-GOSISDBHSA-N	0	3	341.499	3.335	20	30		EGEDHN
CCCC[C@@H](C)C(=O)NCC1(NCc2ccc(F)c(C#N)c2)CC1	ZINC001699651291	1413033642	/nfs/dbraw/zinc/03/36/42/1413033642.db2.gz	AFCXVHHTVHJYCH-CQSZACIVSA-N	0	3	331.435	3.262	20	30		EGEDHN
CCC(C)(C)C(=O)N[C@@H]1CCN(Cc2cccc(C#N)c2)[C@H](C)C1	ZINC001700317230	1413777648	/nfs/dbraw/zinc/77/76/48/1413777648.db2.gz	FJBKQUHAWFJWKU-CRAIPNDOSA-N	0	3	327.472	3.464	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)[C@@H](C)CSC)CC1	ZINC001700339846	1413816930	/nfs/dbraw/zinc/81/69/30/1413816930.db2.gz	ARCNXPSAOYKJFH-ZDUSSCGKSA-N	0	3	332.941	3.299	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)[C@H](C)CSC)CC1	ZINC001700339845	1413817333	/nfs/dbraw/zinc/81/73/33/1413817333.db2.gz	ARCNXPSAOYKJFH-CYBMUJFWSA-N	0	3	332.941	3.299	20	30		EGEDHN
C=C(Br)CNCC(C)(C)CN(C)C(=O)CCC1CC1	ZINC001700439156	1414009742	/nfs/dbraw/zinc/00/97/42/1414009742.db2.gz	PBDSGUCWRQORQL-UHFFFAOYSA-N	0	3	331.298	3.159	20	30		EGEDHN
C[C@@H](CNC(=O)C1CC2(CCC2)C1)N(C)Cc1cccc(C#N)c1	ZINC001700469580	1414084056	/nfs/dbraw/zinc/08/40/56/1414084056.db2.gz	GSHQMKFJKGHDTM-HNNXBMFYSA-N	0	3	325.456	3.075	20	30		EGEDHN
Cc1cc(C(=O)NC[C@@H](C)N(C)Cc2ccc(C#N)cc2)sc1C	ZINC001700485471	1414131190	/nfs/dbraw/zinc/13/11/90/1414131190.db2.gz	LHOWZYMDHANVGY-CQSZACIVSA-N	0	3	341.480	3.487	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H](C)CNCc2ccc(F)c(C#N)c2)cc1C	ZINC001732981182	1429108033	/nfs/dbraw/zinc/10/80/33/1429108033.db2.gz	XYPZQIGQKJCQRD-OAHLLOKOSA-N	0	3	339.414	3.222	20	30		EGEDHN
C[C@@H](C#N)C(=O)N(C)C1CCN(Cc2ccc(C(F)F)cc2)CC1	ZINC001713051990	1417603624	/nfs/dbraw/zinc/60/36/24/1417603624.db2.gz	WZTLULQDFFWTGV-ZDUSSCGKSA-N	0	3	335.398	3.207	20	30		EGEDHN
CC(C)CC(=O)N[C@H](C)[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001713270848	1417882264	/nfs/dbraw/zinc/88/22/64/1417882264.db2.gz	FMAXMLRCKFDZSF-VQIMIIECSA-N	0	3	327.472	3.321	20	30		EGEDHN
CCCN(CCNC(=O)c1cc(C)oc1C)Cc1cccc(C#N)c1	ZINC001713546125	1418315173	/nfs/dbraw/zinc/31/51/73/1418315173.db2.gz	ZEDPNPXRNHISNZ-UHFFFAOYSA-N	0	3	339.439	3.410	20	30		EGEDHN
CC(C)(C)C(=O)NCC[C@H]1CCN(Cc2ccc(F)c(C#N)c2)C1	ZINC001713738528	1418535749	/nfs/dbraw/zinc/53/57/49/1418535749.db2.gz	VKXNLDKKZPLLBU-AWEZNQCLSA-N	0	3	331.435	3.072	20	30		EGEDHN
CC(C)(C)CC(=O)N[C@@H]1CC12CCN(Cc1cccc(C#N)c1)CC2	ZINC001713843765	1418640615	/nfs/dbraw/zinc/64/06/15/1418640615.db2.gz	MODLJBONVTXRSE-GOSISDBHSA-N	0	3	339.483	3.465	20	30		EGEDHN
CCCN(C(=O)[C@@H](C)C#N)C1CCN(Cc2csc(C)c2)CC1	ZINC001713852945	1418650019	/nfs/dbraw/zinc/65/00/19/1418650019.db2.gz	CRXGAWMAPNPCEN-AWEZNQCLSA-N	0	3	333.501	3.419	20	30		EGEDHN
CC[C@@H](CNC(=O)c1cc(C#N)c[nH]1)N[C@H](C)c1ccccc1Cl	ZINC001714065342	1418861714	/nfs/dbraw/zinc/86/17/14/1418861714.db2.gz	MEWIFJJAJXOGID-OCCSQVGLSA-N	0	3	344.846	3.399	20	30		EGEDHN
C[C@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)C1CCCCC1	ZINC001714531777	1419258690	/nfs/dbraw/zinc/25/86/90/1419258690.db2.gz	UDLITVRSGRYDEN-CQSZACIVSA-N	0	3	331.435	3.214	20	30		EGEDHN
CCN(CCNC(=O)[C@@H](C)C1CCCC1)Cc1ccc(C#N)cc1	ZINC001714595884	1419348269	/nfs/dbraw/zinc/34/82/69/1419348269.db2.gz	CDZVNGJZTKIZPV-INIZCTEOSA-N	0	3	327.472	3.323	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](CNC(=O)CCC3CCCC3)C2)cc1	ZINC001714627616	1419397739	/nfs/dbraw/zinc/39/77/39/1419397739.db2.gz	VDPXODFTBBUKDZ-HXUWFJFHSA-N	0	3	339.483	3.467	20	30		EGEDHN
CC(C)SCC(=O)N1CC[C@H](NCc2ccccc2C#N)[C@@H](C)C1	ZINC001714998226	1419730200	/nfs/dbraw/zinc/73/02/00/1419730200.db2.gz	GBFHCEMVGFQQHY-YJBOKZPZSA-N	0	3	345.512	3.026	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2ccc(C(F)F)nc2)CCCC1	ZINC001715092867	1419833417	/nfs/dbraw/zinc/83/34/17/1419833417.db2.gz	SLCGVZBAFAPTNV-UHFFFAOYSA-N	0	3	343.805	3.404	20	30		EGEDHN
C[C@@](CNCc1ccc(C#N)cc1F)(NC(=O)CC1CCC1)C1CC1	ZINC001715116077	1419860697	/nfs/dbraw/zinc/86/06/97/1419860697.db2.gz	UBZASVOKRFYVNY-FQEVSTJZSA-N	0	3	343.446	3.262	20	30		EGEDHN
C[C@@H](CN(C)Cc1cccc(C#N)c1)NC(=O)c1ccnc(C2CC2)c1	ZINC001716032497	1420491795	/nfs/dbraw/zinc/49/17/95/1420491795.db2.gz	QOIJDLLUJHQZFV-HNNXBMFYSA-N	0	3	348.450	3.081	20	30		EGEDHN
C[C@H]1C[C@H](NCc2ccc(C#N)s2)CN1C(=O)CCC(C)(F)F	ZINC001717817975	1421636930	/nfs/dbraw/zinc/63/69/30/1421636930.db2.gz	NNEXENHZVQWLAW-RYUDHWBXSA-N	0	3	341.427	3.134	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)c1ccc(F)cc1F	ZINC001722915215	1424248768	/nfs/dbraw/zinc/24/87/68/1424248768.db2.gz	VMUPWDROYRCUDU-ZDUSSCGKSA-N	0	3	343.377	3.087	20	30		EGEDHN
C[C@@H](CN(C)C(=O)C(C)(C)C(F)(F)F)NCc1ccc(C#N)s1	ZINC001725519043	1426209948	/nfs/dbraw/zinc/20/99/48/1426209948.db2.gz	WNYSLEHBTYACFJ-JTQLQIEISA-N	0	3	347.406	3.145	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2ccc(C#N)s2)CN1C(=O)CCC(F)(F)F	ZINC001725580087	1426236192	/nfs/dbraw/zinc/23/61/92/1426236192.db2.gz	FJSPHKAWQCTMMB-MNOVXSKESA-N	0	3	345.390	3.041	20	30		EGEDHN
Cc1cccc(C(=O)NC[C@H](C)NCc2ccc(F)c(C#N)c2)c1F	ZINC001731594096	1427635729	/nfs/dbraw/zinc/63/57/29/1427635729.db2.gz	LJMNUXPVJHUUJY-ZDUSSCGKSA-N	0	3	343.377	3.053	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)[C@H](F)Cc1ccccc1	ZINC001734025644	1437813665	/nfs/dbraw/zinc/81/36/65/1437813665.db2.gz	SZNYPJHTVUMTMJ-MRXNPFEDSA-N	0	3	340.870	3.394	20	30		EGEDHN
CC[C@H](C)C(=O)NCCCN(Cc1ccc(F)c(C#N)c1)C1CC1	ZINC001752244647	1440160010	/nfs/dbraw/zinc/16/00/10/1440160010.db2.gz	ZRCVISVYHDNJCI-AWEZNQCLSA-N	0	3	331.435	3.214	20	30		EGEDHN
C#CCN(CCCNC(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1)C1CC1	ZINC001752282968	1440164825	/nfs/dbraw/zinc/16/48/25/1440164825.db2.gz	BKFOIZWLNNZQRF-ZWKOTPCHSA-N	0	3	330.859	3.047	20	30		EGEDHN
C=CCOCC(=O)N(C)C1CCN([C@@H](C)c2ccc(F)cc2)CC1	ZINC001752294932	1440166886	/nfs/dbraw/zinc/16/68/86/1440166886.db2.gz	KJYFWGCLIBPKBA-HNNXBMFYSA-N	0	3	334.435	3.012	20	30		EGEDHN
CCCCCCCN1CCC[C@@H](NC(=O)c2cc(Cl)no2)C1	ZINC001752331178	1440171120	/nfs/dbraw/zinc/17/11/20/1440171120.db2.gz	NMSLHULAJXULDK-CYBMUJFWSA-N	0	3	327.856	3.493	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)CC(C2CCC2)C2CCC2)CC1	ZINC001752434591	1440179923	/nfs/dbraw/zinc/17/99/23/1440179923.db2.gz	HJUVCQDBWXHPGP-LJQANCHMSA-N	0	3	328.500	3.197	20	30		EGEDHN
CCCCCC(=O)NC[C@H](NCC#Cc1ccc(F)cc1)C1CC1	ZINC001752451481	1440182566	/nfs/dbraw/zinc/18/25/66/1440182566.db2.gz	ORLPDNHJQDVLJT-IBGZPJMESA-N	0	3	330.447	3.242	20	30		EGEDHN
N#Cc1ccc(CN[C@@H](CNC(=O)C2=CCCCCC2)C2CC2)s1	ZINC001752457239	1440183229	/nfs/dbraw/zinc/18/32/29/1440183229.db2.gz	GBAUFUYRISRUPC-SFHVURJKSA-N	0	3	343.496	3.495	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@@H]2CN(Cc3c(C)noc3C)CC[C@@H]21	ZINC001752705760	1440202331	/nfs/dbraw/zinc/20/23/31/1440202331.db2.gz	BKUDMQZOWGICME-MJGOQNOKSA-N	0	3	345.487	3.461	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc(OCCCC)cc2)C1	ZINC001752790473	1440213759	/nfs/dbraw/zinc/21/37/59/1440213759.db2.gz	ZBBFVJCWKWJQKJ-SFHVURJKSA-N	0	3	342.483	3.331	20	30		EGEDHN
C=CCOCCN1CCCC[C@H]1CNC(=O)c1ccc(C=C)cc1	ZINC001752822558	1440221481	/nfs/dbraw/zinc/22/14/81/1440221481.db2.gz	KAAQHVNNXAKSML-IBGZPJMESA-N	0	3	328.456	3.117	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)[C@H](C)Cc1ccccc1C	ZINC001752824732	1440222934	/nfs/dbraw/zinc/22/29/34/1440222934.db2.gz	CQLGTPVBYUNCKF-UYAOXDASSA-N	0	3	326.484	3.168	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)CCOc1ccccc1C	ZINC001752825145	1440223269	/nfs/dbraw/zinc/22/32/69/1440223269.db2.gz	MHAFBFAQVVTZME-GOSISDBHSA-N	0	3	330.472	3.311	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)Cc2cc(F)c(C)cc2F)C1	ZINC001752836447	1440228076	/nfs/dbraw/zinc/22/80/76/1440228076.db2.gz	NHDGNFRXIRLRSZ-CVEARBPZSA-N	0	3	348.437	3.056	20	30		EGEDHN
C=C(Cl)CNCCc1ccc(CNC(=O)c2coc(C)c2)cc1	ZINC001752982829	1440257443	/nfs/dbraw/zinc/25/74/43/1440257443.db2.gz	RLLZDVQKPSFRSJ-UHFFFAOYSA-N	0	3	332.831	3.403	20	30		EGEDHN
CC#CCN(C)[C@H]1CCCN(C(=O)CCOc2ccc(C)c(C)c2)C1	ZINC001752991932	1440259749	/nfs/dbraw/zinc/25/97/49/1440259749.db2.gz	AYKQMMUEXZUSME-IBGZPJMESA-N	0	3	342.483	3.018	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)CCC(C)(F)F)C1	ZINC001752993650	1440260787	/nfs/dbraw/zinc/26/07/87/1440260787.db2.gz	KVUUYADTHXTBQI-KRWDZBQOSA-N	0	3	349.425	3.416	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1csc(-c2ccco2)n1	ZINC001753012533	1440267420	/nfs/dbraw/zinc/26/74/20/1440267420.db2.gz	BCWFBJRQBNBDSR-LLVKDONJSA-N	0	3	339.848	3.254	20	30		EGEDHN
C[C@H](C(=O)NCCC[C@H]1CCCN1Cc1ccccc1C#N)C1CC1	ZINC001753025645	1440271394	/nfs/dbraw/zinc/27/13/94/1440271394.db2.gz	YKQRJSRJKUCNHU-JXFKEZNVSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1CCCNC(=O)c1coc(CCC)n1	ZINC001753037604	1440275022	/nfs/dbraw/zinc/27/50/22/1440275022.db2.gz	ISXDBBYEVKNPCN-CQSZACIVSA-N	0	3	339.867	3.354	20	30		EGEDHN
CCN(CCNC(=O)C#CC(C)(C)C)[C@@H]1CCc2c1cc(F)cc2F	ZINC001753081461	1440293948	/nfs/dbraw/zinc/29/39/48/1440293948.db2.gz	GNQAORVPGQVXLC-GOSISDBHSA-N	0	3	348.437	3.440	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NCCN(CC)Cc1ccc(F)cc1C	ZINC001753091065	1440299037	/nfs/dbraw/zinc/29/90/37/1440299037.db2.gz	HRUIYKNZCAIMAD-OALUTQOASA-N	0	3	348.462	3.053	20	30		EGEDHN
CCC[C@H](C)CC(=O)NC[C@@H]1CCN(Cc2ccc(C#N)cc2)C1	ZINC001753122778	1440314193	/nfs/dbraw/zinc/31/41/93/1440314193.db2.gz	MTGPYHGIEZVKMY-LPHOPBHVSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C1CCC(C(=O)NCCN(CCC)C[C@@H](O)c2ccccc2)CC1	ZINC001753147525	1440325185	/nfs/dbraw/zinc/32/51/85/1440325185.db2.gz	HPCOGLPWGANRGU-HXUWFJFHSA-N	0	3	344.499	3.295	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)CCNCc2cc3ccccc3o2)cc1	ZINC001753219247	1440339895	/nfs/dbraw/zinc/33/98/95/1440339895.db2.gz	JLGUILJYPMYORV-UHFFFAOYSA-N	0	3	332.403	3.276	20	30		EGEDHN
C=C(C)CN[C@H](CNC(=O)[C@@]1(F)CCOC1)c1ccc(C(C)C)cc1	ZINC001753294543	1440351815	/nfs/dbraw/zinc/35/18/15/1440351815.db2.gz	PBNZSJLMXMFZQL-UYAOXDASSA-N	0	3	348.462	3.262	20	30		EGEDHN
C=CCN[C@H](CNC(=O)c1ncccc1C(F)(F)F)c1ccccc1	ZINC001753309076	1440356049	/nfs/dbraw/zinc/35/60/49/1440356049.db2.gz	BQCUNOFWODDBEZ-OAHLLOKOSA-N	0	3	349.356	3.347	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CCC)C(=O)CN(C)Cc2ccccc2)C1	ZINC001753322839	1440364595	/nfs/dbraw/zinc/36/45/95/1440364595.db2.gz	KFWKGICJZDHNLJ-FQEVSTJZSA-N	0	3	343.515	3.007	20	30		EGEDHN
CCCC(=O)N1CC[C@@H](CN(C)CC#Cc2ccc(Cl)cc2)C1	ZINC001753347131	1440376473	/nfs/dbraw/zinc/37/64/73/1440376473.db2.gz	UOVQFXXDAWKDPV-KRWDZBQOSA-N	0	3	332.875	3.272	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](N(Cc2ccccc2)C(=O)COCCC)C1	ZINC001753362492	1440383532	/nfs/dbraw/zinc/38/35/32/1440383532.db2.gz	ZHHBTJCYBRWGKM-HXUWFJFHSA-N	0	3	344.499	3.482	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC(CN(C)Cc2cnoc2C)CC1	ZINC001753365321	1440384814	/nfs/dbraw/zinc/38/48/14/1440384814.db2.gz	CBGNCAVLTYBZLO-MRXNPFEDSA-N	0	3	333.476	3.256	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC(CN(C)Cc2ccc(F)cn2)CC1	ZINC001753365612	1440385004	/nfs/dbraw/zinc/38/50/04/1440385004.db2.gz	GXGYAOAUHFRYAI-MRXNPFEDSA-N	0	3	347.478	3.493	20	30		EGEDHN
C=C[C@H](C(=O)N1C[C@@H]2C[C@H]1CN2CCCCCOC)c1ccccc1	ZINC001753428169	1440397542	/nfs/dbraw/zinc/39/75/42/1440397542.db2.gz	ZBTRLQONDUAINR-UFYCRDLUSA-N	0	3	342.483	3.058	20	30		EGEDHN
C#CCCCC(=O)N(C)[C@@H]1CCN(CCOC2CCCCCC2)C1	ZINC001753434370	1440399601	/nfs/dbraw/zinc/39/96/01/1440399601.db2.gz	CLFBJSCQKVNSJW-GOSISDBHSA-N	0	3	334.504	3.062	20	30		EGEDHN
C=CCOCCN1CC[C@H](N(C)C(=O)c2coc3c2cccc3C)C1	ZINC001753440582	1440401419	/nfs/dbraw/zinc/40/14/19/1440401419.db2.gz	ZXUMUHSECJWVGR-INIZCTEOSA-N	0	3	342.439	3.090	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)Cc2ccc3c(c2)CCCO3)C1	ZINC001753457174	1440408681	/nfs/dbraw/zinc/40/86/81/1440408681.db2.gz	LGEVAVFSLPCNQW-IBGZPJMESA-N	0	3	342.483	3.053	20	30		EGEDHN
C=CCOCCN1CC[C@@H](N(CC)C(=O)C2CC(C(C)(C)C)C2)C1	ZINC001753465186	1440412384	/nfs/dbraw/zinc/41/23/84/1440412384.db2.gz	XCMJRDJNGGBAOK-DAWZGUTISA-N	0	3	336.520	3.184	20	30		EGEDHN
CC[C@H](CNC(=O)c1cc(C)cs1)NCc1ccc(C#N)s1	ZINC001753471492	1440414066	/nfs/dbraw/zinc/41/40/66/1440414066.db2.gz	NWLFVWOPJAPXDT-GFCCVEGCSA-N	0	3	333.482	3.288	20	30		EGEDHN
CC[C@@H](CNC(=O)C1(C)CCCC1)NCc1ccc(C#N)c(F)c1	ZINC001753481171	1440416670	/nfs/dbraw/zinc/41/66/70/1440416670.db2.gz	KSBFWPLALRFPKE-INIZCTEOSA-N	0	3	331.435	3.262	20	30		EGEDHN
CC[C@@H](CNC(=O)C[C@H]1CC=CCC1)NCc1ccc(C#N)c(F)c1	ZINC001753482114	1440416975	/nfs/dbraw/zinc/41/69/75/1440416975.db2.gz	BIYGYMVSDNFIFZ-YJBOKZPZSA-N	0	3	343.446	3.428	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@H](CC)NCc2cc(C)ccc2OC)C1	ZINC001753490214	1440419383	/nfs/dbraw/zinc/41/93/83/1440419383.db2.gz	QYAUEBWKJVBNCK-KRWDZBQOSA-N	0	3	330.472	3.344	20	30		EGEDHN
C=C(Br)CNCC1(NC(=O)C2(F)CCCC2)CCCC1	ZINC001753505492	1440424342	/nfs/dbraw/zinc/42/43/42/1440424342.db2.gz	IWHHQMQCOUYOQW-UHFFFAOYSA-N	0	3	347.272	3.196	20	30		EGEDHN
CC(C)=CC(=O)N[C@@](C)(CNCC#Cc1ccc(F)cc1)C1CC1	ZINC001753513292	1440426682	/nfs/dbraw/zinc/42/66/82/1440426682.db2.gz	MNHSDFHMGYTUFV-FQEVSTJZSA-N	0	3	328.431	3.018	20	30		EGEDHN
C=C(Br)CNC[C@@](C)(NC(=O)/C=C(/C)C1CC1)C1CC1	ZINC001753514459	1440427023	/nfs/dbraw/zinc/42/70/23/1440427023.db2.gz	ITNVFGDJEVDXME-JXMNSVBMSA-N	0	3	341.293	3.126	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2ccc(C)n2C)CCCC[C@@H]1C	ZINC001753529303	1440430573	/nfs/dbraw/zinc/43/05/73/1440430573.db2.gz	CXWVUGKSLXSSPY-UGSOOPFHSA-N	0	3	337.895	3.354	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H](CCNCc2oc(CC)nc2C)C1	ZINC001753546137	1440434283	/nfs/dbraw/zinc/43/42/83/1440434283.db2.gz	FHNOPUIVNPWCMV-QGZVFWFLSA-N	0	3	345.487	3.067	20	30		EGEDHN
CC#CCNCc1ccc(CNC(=O)[C@@H](C)c2cccc(F)c2)cc1	ZINC001753592547	1440443340	/nfs/dbraw/zinc/44/33/40/1440443340.db2.gz	SABDCWACCJRWEP-INIZCTEOSA-N	0	3	338.426	3.359	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCC1CCN([C@H](C)c2cnccn2)CC1	ZINC001753597316	1440445094	/nfs/dbraw/zinc/44/50/94/1440445094.db2.gz	TVGVJQRFBGAMLG-UZLBHIALSA-N	0	3	344.503	3.358	20	30		EGEDHN
CCCCc1nc(CNC[C@H](C)CNC(=O)C#CC(C)(C)C)cs1	ZINC001753613124	1440449244	/nfs/dbraw/zinc/44/92/44/1440449244.db2.gz	QKJXOEMZVNEZBT-HNNXBMFYSA-N	0	3	349.544	3.377	20	30		EGEDHN
C[C@H](C#N)C(=O)NCC1(NCc2cccc(F)c2Cl)CCCC1	ZINC001753661376	1440458848	/nfs/dbraw/zinc/45/88/48/1440458848.db2.gz	ITOZTKBZQIHCNR-GFCCVEGCSA-N	0	3	337.826	3.157	20	30		EGEDHN
Cc1ccoc1C(=O)N(C)[C@H](C)CNCC#Cc1ccc(Cl)cc1	ZINC001753680065	1440464401	/nfs/dbraw/zinc/46/44/01/1440464401.db2.gz	XEYOQMOFAFUMMI-OAHLLOKOSA-N	0	3	344.842	3.343	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N(C)[C@@H](C)CNCc1ccc(C#N)c(F)c1	ZINC001753694123	1440467164	/nfs/dbraw/zinc/46/71/64/1440467164.db2.gz	WQBZZQQBJUQQBD-AWEZNQCLSA-N	0	3	333.451	3.316	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](CN[C@@H](C)c2n[nH]c(C)n2)CC(C)C)CC1	ZINC001753742358	1440479528	/nfs/dbraw/zinc/47/95/28/1440479528.db2.gz	QQRLJTMHDAUQKJ-WMLDXEAASA-N	0	3	347.507	3.041	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H](CN[C@H](C)c1n[nH]c(C)n1)C1CCCCC1	ZINC001753747448	1440481531	/nfs/dbraw/zinc/48/15/31/1440481531.db2.gz	QWZFNXJBYVFBJQ-CZUORRHYSA-N	0	3	347.507	3.041	20	30		EGEDHN
C=C(Br)CNCC[C@H]1CCCCN1C(=O)C(C)(C)F	ZINC001753765142	1440484596	/nfs/dbraw/zinc/48/45/96/1440484596.db2.gz	CLMIGYPPEVIHSA-GFCCVEGCSA-N	0	3	335.261	3.004	20	30		EGEDHN
N#Cc1ccccc1CNCC[C@@H]1CCCCN1C(=O)c1cc[nH]c1	ZINC001753777514	1440486775	/nfs/dbraw/zinc/48/67/75/1440486775.db2.gz	RUEWQKRPYVEVKR-IBGZPJMESA-N	0	3	336.439	3.061	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H](NCc2cc(C)ns2)C(C)C)CCC1	ZINC001753839242	1440502096	/nfs/dbraw/zinc/50/20/96/1440502096.db2.gz	YEEOJTILNHVUHX-MRXNPFEDSA-N	0	3	335.517	3.428	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H]2[C@@H](CCN2Cc2cc(C)ns2)C1	ZINC001753872846	1440517826	/nfs/dbraw/zinc/51/78/26/1440517826.db2.gz	PAQLXDATZKEYPK-DOTOQJQBSA-N	0	3	347.528	3.477	20	30		EGEDHN
C[C@H](CCNCc1nsc2ccccc21)NC(=O)C#CC(C)(C)C	ZINC001753965382	1440526507	/nfs/dbraw/zinc/52/65/07/1440526507.db2.gz	ZPTQZSMFABWXPH-CQSZACIVSA-N	0	3	343.496	3.330	20	30		EGEDHN
C[C@H](CCNCc1ccccc1C#N)NC(=O)c1ccoc1C1CC1	ZINC001753994812	1440529472	/nfs/dbraw/zinc/52/94/72/1440529472.db2.gz	XYDWPTPUSVDJBD-CQSZACIVSA-N	0	3	337.423	3.327	20	30		EGEDHN
CCN(CCNCc1ccc(C#N)cc1)C(=O)C=C1CCCCC1	ZINC001754036445	1440534231	/nfs/dbraw/zinc/53/42/31/1440534231.db2.gz	QWOQGEMOHXSMOZ-UHFFFAOYSA-N	0	3	325.456	3.387	20	30		EGEDHN
CCN(CCNCC#CCOC)C(=O)c1ccc(C(C)(C)CC)cc1	ZINC001754052122	1440535861	/nfs/dbraw/zinc/53/58/61/1440535861.db2.gz	OKGAEIAICSRHQH-UHFFFAOYSA-N	0	3	344.499	3.076	20	30		EGEDHN
CCN(CCNCc1ccc(F)c(C#N)c1)C(=O)[C@@H]1CC[C@@H]2C[C@@H]2C1	ZINC001754052625	1440535949	/nfs/dbraw/zinc/53/59/49/1440535949.db2.gz	BUKXPKFBVAXNFW-BRWVUGGUSA-N	0	3	343.446	3.072	20	30		EGEDHN
CCN(CCNCc1cccc(C#N)c1)C(=O)[C@H](C)CC(F)(F)F	ZINC001754058538	1440536565	/nfs/dbraw/zinc/53/65/65/1440536565.db2.gz	GZIGUSDFFZSZMB-CYBMUJFWSA-N	0	3	341.377	3.085	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H](C)CNCC#Cc2cccc(Cl)c2)s1	ZINC001754216643	1440552033	/nfs/dbraw/zinc/55/20/33/1440552033.db2.gz	RZCXFPZKLUSLSB-CYBMUJFWSA-N	0	3	346.883	3.470	20	30		EGEDHN
C[C@@H](CNCC#Cc1cccc(Cl)c1)NC(=O)Cc1ccccc1	ZINC001754273210	1440561744	/nfs/dbraw/zinc/56/17/44/1440561744.db2.gz	IHRXXIHVLHSDFC-INIZCTEOSA-N	0	3	340.854	3.029	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H](C)CNCC#Cc2ccccc2)c(F)c1F	ZINC001754285161	1440563990	/nfs/dbraw/zinc/56/39/90/1440563990.db2.gz	KWEVMKXOEMHSOX-HNNXBMFYSA-N	0	3	342.389	3.033	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccc(Cl)cc1)NC(=O)[C@H]1CC12CCCC2	ZINC001754289779	1440564874	/nfs/dbraw/zinc/56/48/74/1440564874.db2.gz	UWJRCLFKCUCZQG-MAUKXSAKSA-N	0	3	344.886	3.366	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccc(F)cc1)NC(=O)c1ccccc1Cl	ZINC001754291447	1440565270	/nfs/dbraw/zinc/56/52/70/1440565270.db2.gz	LGOZRLAXGQYRMJ-AWEZNQCLSA-N	0	3	344.817	3.239	20	30		EGEDHN
CN(CCCNCc1cc(Cl)ccc1Cl)C(=O)C#CC1CC1	ZINC001754369973	1440592494	/nfs/dbraw/zinc/59/24/94/1440592494.db2.gz	KKCUHKMYJRSHSK-UHFFFAOYSA-N	0	3	339.266	3.345	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](NC(=O)c2ccc(Cl)o2)C2CC2)s1	ZINC001754433275	1440597412	/nfs/dbraw/zinc/59/74/12/1440597412.db2.gz	CAEWNZKRCVFERA-CYBMUJFWSA-N	0	3	349.843	3.164	20	30		EGEDHN
C[C@H](C(=O)N[C@H](CNCC#Cc1cccc(Cl)c1)C1CC1)C1CC1	ZINC001754437216	1440598368	/nfs/dbraw/zinc/59/83/68/1440598368.db2.gz	IKHQEACJYFPJCX-IFXJQAMLSA-N	0	3	344.886	3.222	20	30		EGEDHN
C=CCC[C@@H](C)N1CC[C@@H]1CNC(=O)c1cnn(C2CCCC2)c1C	ZINC001754500816	1440614175	/nfs/dbraw/zinc/61/41/75/1440614175.db2.gz	SDUBKVJIYMAEPM-CRAIPNDOSA-N	0	3	344.503	3.465	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H]2CCN2C[C@H](OC)C2CCC2)CCCC1	ZINC001754505575	1440616230	/nfs/dbraw/zinc/61/62/30/1440616230.db2.gz	VTCHGVCKASHGEA-ROUUACIJSA-N	0	3	334.504	3.129	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)[C@]34C[C@H]3CCCC4)CC2)cc1F	ZINC001754524763	1440620764	/nfs/dbraw/zinc/62/07/64/1440620764.db2.gz	QALURYGTPGXSEJ-OXQOHEQNSA-N	0	3	341.430	3.016	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)[C@@H]3C[C@H]3c3ccccc3)CC2)cc1	ZINC001754532006	1440622776	/nfs/dbraw/zinc/62/27/76/1440622776.db2.gz	WYAOJDVVOJMAAN-VQTJNVASSA-N	0	3	345.446	3.100	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC(N(CCOC)C[C@@H](F)CC)CC2)C1	ZINC001754558831	1440632913	/nfs/dbraw/zinc/63/29/13/1440632913.db2.gz	DAYIQGXPQOXJJG-INIZCTEOSA-N	0	3	340.483	3.030	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@@]2(CCN(CCC(F)(F)F)C2)C1	ZINC001754565799	1440635521	/nfs/dbraw/zinc/63/55/21/1440635521.db2.gz	NFNLQVHNFRLBDU-GOEBONIOSA-N	0	3	332.410	3.466	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC[C@H]1CNCc1ccnc(Cl)c1	ZINC001754615685	1440644488	/nfs/dbraw/zinc/64/44/88/1440644488.db2.gz	YBWMAPWLNKJDJI-ZBFHGGJFSA-N	0	3	335.879	3.418	20	30		EGEDHN
CC#CCNC[C@@H](NC(=O)c1nccs1)c1ccc2ccccc2c1	ZINC001754644591	1440649883	/nfs/dbraw/zinc/64/98/83/1440649883.db2.gz	UXUZILGWOZSHQM-GOSISDBHSA-N	0	3	349.459	3.380	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H]2CC[C@@H](C1)N2CCc1csc(C)n1	ZINC001754658791	1440654173	/nfs/dbraw/zinc/65/41/73/1440654173.db2.gz	PQQWTLBINODKQQ-MSOLQXFVSA-N	0	3	347.528	3.416	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@](C)(CNCc2oc(CC)nc2C)C1	ZINC001754694768	1440666854	/nfs/dbraw/zinc/66/68/54/1440666854.db2.gz	HDDATOZROIDLCO-HXUWFJFHSA-N	0	3	347.503	3.476	20	30		EGEDHN
C#CCN1CCC(C)(CNC(=O)c2cc3ccccc3n2CC)CC1	ZINC001754722171	1440673818	/nfs/dbraw/zinc/67/38/18/1440673818.db2.gz	NSOGRQRLBLMQQL-UHFFFAOYSA-N	0	3	337.467	3.126	20	30		EGEDHN
O=C(CCC(F)F)N[C@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1ccccc1)C2	ZINC001754785970	1440687848	/nfs/dbraw/zinc/68/78/48/1440687848.db2.gz	TXJWVLASJYMHIO-BZSNNMDCSA-N	0	3	346.421	3.053	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H]([C@H](C)NCc2csc(CC)n2)C1	ZINC001754801037	1440690382	/nfs/dbraw/zinc/69/03/82/1440690382.db2.gz	YFSDHEASJOSQBU-LSDHHAIUSA-N	0	3	335.517	3.388	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1cncc(C)c1	ZINC001754864835	1440702489	/nfs/dbraw/zinc/70/24/89/1440702489.db2.gz	DUFZCNUGMAPRAS-OALUTQOASA-N	0	3	327.472	3.312	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](OCC)c1ccccc1	ZINC001754871242	1440705092	/nfs/dbraw/zinc/70/50/92/1440705092.db2.gz	GNXPKSAFNNPHNZ-IPMKNSEASA-N	0	3	328.456	3.016	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@H](CCNCc2ccc(F)cc2Cl)C1	ZINC001754914280	1440708496	/nfs/dbraw/zinc/70/84/96/1440708496.db2.gz	CQNVUDHRYPIZBQ-HNNXBMFYSA-N	0	3	348.849	3.221	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCN(C(=O)c2ccnn2[C@@H](C)CC)C1	ZINC001754917721	1440708928	/nfs/dbraw/zinc/70/89/28/1440708928.db2.gz	WDLPSWQNTBMXGG-GJZGRUSLSA-N	0	3	338.883	3.048	20	30		EGEDHN
C=CCN(C)Cc1ccccc1CNC(=O)c1ccc(OC)c(F)c1	ZINC001754945577	1440712655	/nfs/dbraw/zinc/71/26/55/1440712655.db2.gz	BDQILWZHCFYJAO-UHFFFAOYSA-N	0	3	342.414	3.382	20	30		EGEDHN
C=CCN(C)Cc1ccccc1CNC(=O)c1cnoc1C(C)C	ZINC001754953794	1440715835	/nfs/dbraw/zinc/71/58/35/1440715835.db2.gz	MVVJJXIXOBGJSB-UHFFFAOYSA-N	0	3	327.428	3.346	20	30		EGEDHN
N#Cc1cc(C(=O)NCC2(NCc3ccc(Cl)s3)CCC2)c[nH]1	ZINC001754981041	1440721302	/nfs/dbraw/zinc/72/13/02/1440721302.db2.gz	BJFGPXMEAIHEPD-UHFFFAOYSA-N	0	3	348.859	3.044	20	30		EGEDHN
C=C(C)CCC(=O)NCC1(NCc2cc(C)ccc2OC)CCC1	ZINC001754982871	1440721905	/nfs/dbraw/zinc/72/19/05/1440721905.db2.gz	JNLBEYAGAKEMFV-UHFFFAOYSA-N	0	3	330.472	3.488	20	30		EGEDHN
CN(CCCN(C)C(=O)[C@H]1[C@@H]2CCC[C@@H]21)Cc1ccc(F)c(C#N)c1	ZINC001755036446	1440734668	/nfs/dbraw/zinc/73/46/68/1440734668.db2.gz	GMDXBYYILZQPHV-DZFIZOCASA-N	0	3	343.446	3.024	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC[C@@](CO)(NCc2ccc(C)cc2)C1	ZINC001755087347	1440751063	/nfs/dbraw/zinc/75/10/63/1440751063.db2.gz	BZNXIQJWDDZQCW-GHTZIAJQSA-N	0	3	344.499	3.040	20	30		EGEDHN
C[C@H](C#N)C(=O)NCc1ccc2c(c1)CN(CCc1cccs1)C2	ZINC001755100690	1440752078	/nfs/dbraw/zinc/75/20/78/1440752078.db2.gz	CULYLSIYWYRXPW-CQSZACIVSA-N	0	3	339.464	3.082	20	30		EGEDHN
C=CCCCN1Cc2ccc(CNC(=O)c3ncccc3F)cc2C1	ZINC001755101373	1440752657	/nfs/dbraw/zinc/75/26/57/1440752657.db2.gz	BETQWCJNLIRGHU-UHFFFAOYSA-N	0	3	339.414	3.433	20	30		EGEDHN
C=CCCCN1Cc2ccc(CNC(=O)[C@H]3C[C@H](C)CO3)cc2C1	ZINC001755102038	1440753270	/nfs/dbraw/zinc/75/32/70/1440753270.db2.gz	GCWSOKXBIYDTPK-HNAYVOBHSA-N	0	3	328.456	3.010	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)[C@H](c2cccnc2)C(C)C)C(C)(C)C1	ZINC001755141653	1440760922	/nfs/dbraw/zinc/76/09/22/1440760922.db2.gz	IUTNTNCWBOCNKW-ROUUACIJSA-N	0	3	329.488	3.224	20	30		EGEDHN
C=C(Cl)CNCC1(O)CCN(C(=O)[C@H](CCC)CC(C)C)CC1	ZINC001755156034	1440763184	/nfs/dbraw/zinc/76/31/84/1440763184.db2.gz	MGHJQDLTZWAJNJ-MRXNPFEDSA-N	0	3	344.927	3.144	20	30		EGEDHN
C=CCCC(=O)N1CCC(CN(CC)Cc2conc2CC)CC1	ZINC001755181963	1440771113	/nfs/dbraw/zinc/77/11/13/1440771113.db2.gz	FEVQPAFSWARPRI-UHFFFAOYSA-N	0	3	333.476	3.264	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)CC[C@H]2CCOC2)CC1	ZINC001755181862	1440771277	/nfs/dbraw/zinc/77/12/77/1440771277.db2.gz	DSWMEHPVZKIPDQ-KRWDZBQOSA-N	0	3	342.911	3.116	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC(CN(CC)Cc2cncn2C)CC1	ZINC001755183852	1440771995	/nfs/dbraw/zinc/77/19/95/1440771995.db2.gz	IXOUNTUKJMTMKW-KRWDZBQOSA-N	0	3	346.519	3.083	20	30		EGEDHN
C=CCCCC(=O)N1CCC(CN(CC)Cc2cnc(C)nc2)CC1	ZINC001755183911	1440772165	/nfs/dbraw/zinc/77/21/65/1440772165.db2.gz	LFJMDDBVGGVQMG-UHFFFAOYSA-N	0	3	344.503	3.202	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCN1C(=O)CCCOc1cccc(F)c1	ZINC001755201279	1440779940	/nfs/dbraw/zinc/77/99/40/1440779940.db2.gz	QCWPDUKPNOCDKB-QGZVFWFLSA-N	0	3	334.435	3.094	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC1CC(CNCc2cc(C#N)ccc2F)C1	ZINC001755216211	1440784073	/nfs/dbraw/zinc/78/40/73/1440784073.db2.gz	QOTVUPPFBLNELB-MXWWQKGMSA-N	0	3	343.446	3.284	20	30		EGEDHN
CCC(CC)CC(=O)NC1CC(CNCc2ccccc2C#N)C1	ZINC001755219078	1440784376	/nfs/dbraw/zinc/78/43/76/1440784376.db2.gz	CCKGITKWCLVWDQ-UHFFFAOYSA-N	0	3	327.472	3.369	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H](C)[C@H](C)NCC(=O)Nc1ccc(C)cc1	ZINC001755257295	1440793527	/nfs/dbraw/zinc/79/35/27/1440793527.db2.gz	MOOCSCXXPBZVAG-JKSUJKDBSA-N	0	3	345.487	3.019	20	30		EGEDHN
C=C(Br)CNCC(C)(C)CN(C)C(=O)[C@@H]1CC1(C)C	ZINC001755280861	1440800564	/nfs/dbraw/zinc/80/05/64/1440800564.db2.gz	YAFFLQGZDMMVSK-LBPRGKRZSA-N	0	3	331.298	3.015	20	30		EGEDHN
C[C@H](CNC(=O)c1ccc(C#N)[nH]1)N(C)Cc1cccc(C(F)F)c1	ZINC001755296211	1440806448	/nfs/dbraw/zinc/80/64/48/1440806448.db2.gz	KEGUDPIXNNYTOQ-GFCCVEGCSA-N	0	3	346.381	3.074	20	30		EGEDHN
C[C@H](CNC(=O)[C@@H]1C[C@H]1c1ccccc1)N(C)Cc1cccc(C#N)c1	ZINC001755323000	1440819955	/nfs/dbraw/zinc/81/99/55/1440819955.db2.gz	PASOHIRFIWEVFF-TYCQWZJGSA-N	0	3	347.462	3.298	20	30		EGEDHN
O=C(C#CC1CC1)NC1(CNCc2ccncc2Cl)CCCCC1	ZINC001755350817	1440827797	/nfs/dbraw/zinc/82/77/97/1440827797.db2.gz	HZOZXEGMOGPUCR-UHFFFAOYSA-N	0	3	345.874	3.057	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H](C)C1CN(CCCOc2ccccc2)C1	ZINC001755382279	1440839688	/nfs/dbraw/zinc/83/96/88/1440839688.db2.gz	DAKNTXFKGRCXLS-QGZVFWFLSA-N	0	3	344.499	3.494	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)[C@H](C)CCc2cccc(F)c2)C1	ZINC001755392309	1440842342	/nfs/dbraw/zinc/84/23/42/1440842342.db2.gz	STWHSQKGQPACKI-CVEARBPZSA-N	0	3	332.463	3.407	20	30		EGEDHN
CC/C=C(\C)C(=O)N1CC2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001755454741	1440854935	/nfs/dbraw/zinc/85/49/35/1440854935.db2.gz	NREUEROOQOOQQO-YAXRCOADSA-N	0	3	337.467	3.339	20	30		EGEDHN
C=C(Br)CNC[C@H]1C[C@H](NC(=O)C(F)=C2CCCC2)C1	ZINC001755469624	1440858759	/nfs/dbraw/zinc/85/87/59/1440858759.db2.gz	XIRLNLMRTYMGDK-AULYBMBSSA-N	0	3	345.256	3.177	20	30		EGEDHN
C=C(Cl)CNCCC[C@H](C)NC(=O)[C@H]1CCN(C)c2ccccc21	ZINC001755501293	1440862601	/nfs/dbraw/zinc/86/26/01/1440862601.db2.gz	JUIQXFSGZZLUGL-RDJZCZTQSA-N	0	3	349.906	3.237	20	30		EGEDHN
C=C(Cl)CNCCC[C@@H](C)NC(=O)C[C@@H]1OCc2ccccc21	ZINC001755523319	1440865289	/nfs/dbraw/zinc/86/52/89/1440865289.db2.gz	UKBKTLYHEVWCBT-PBHICJAKSA-N	0	3	336.863	3.275	20	30		EGEDHN
CC[C@H](F)C(=O)NCC[C@@H](NCc1cc(F)ccc1C#N)C(C)C	ZINC001755551897	1440872315	/nfs/dbraw/zinc/87/23/15/1440872315.db2.gz	PCYXLIWIBORXHR-DLBZAZTESA-N	0	3	337.414	3.066	20	30		EGEDHN
C=CC(C)(C)CC(=O)N(C)C[C@H](C)NCc1cnn(C(C)(C)C)c1	ZINC001755588961	1440881019	/nfs/dbraw/zinc/88/10/19/1440881019.db2.gz	KBCXDTQFPIIRSB-HNNXBMFYSA-N	0	3	334.508	3.177	20	30		EGEDHN
Cc1ccccc1CCC(=O)N(C)C[C@H](C)NCC#Cc1ccccc1	ZINC001755607759	1440886203	/nfs/dbraw/zinc/88/62/03/1440886203.db2.gz	STFGEKLDINESON-FQEVSTJZSA-N	0	3	348.490	3.416	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](NCc2cc(Cl)ccc2OC)[C@@H]1C	ZINC001755651552	1440891458	/nfs/dbraw/zinc/89/14/58/1440891458.db2.gz	GWIOEXDDEYGZDE-XJKSGUPXSA-N	0	3	336.863	3.394	20	30		EGEDHN
Cc1cc(F)ccc1CN1CC[C@]2(NC(=O)C#CC3CC3)CCC[C@@H]12	ZINC001755700166	1440899627	/nfs/dbraw/zinc/89/96/27/1440899627.db2.gz	ZIWIBPNOUMWAEG-TZIWHRDSSA-N	0	3	340.442	3.161	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)CCc2cc(F)ccc2F)[C@H]1C	ZINC001755722236	1440907954	/nfs/dbraw/zinc/90/79/54/1440907954.db2.gz	GVITVCYTMNZZGK-KDOFPFPSSA-N	0	3	336.426	3.443	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@H](NCc2ccnc(Cl)c2)C(C)(C)C1	ZINC001755756007	1440913926	/nfs/dbraw/zinc/91/39/26/1440913926.db2.gz	YWNGAYRPDWNIGS-INIZCTEOSA-N	0	3	347.890	3.255	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1C[C@@H](NCC#Cc2ccccc2)C(C)(C)C1	ZINC001755763972	1440915572	/nfs/dbraw/zinc/91/55/72/1440915572.db2.gz	LRFRXFWJSXAPAW-IEBWSBKVSA-N	0	3	326.484	3.157	20	30		EGEDHN
CC1(C)CN(C(=O)CC#Cc2ccccc2)C[C@H]1NC/C=C\Cl	ZINC001755767608	1440916561	/nfs/dbraw/zinc/91/65/61/1440916561.db2.gz	ZRAPDXWYLVZJPX-UUKWBXHYSA-N	0	3	330.859	3.007	20	30		EGEDHN
C=C(C)CN(C)CCN(C(=O)c1ccc2oc(C)nc2c1)C(C)C	ZINC001755812037	1440920869	/nfs/dbraw/zinc/92/08/69/1440920869.db2.gz	JQPOXSUFHRZDGP-UHFFFAOYSA-N	0	3	329.444	3.495	20	30		EGEDHN
C=CCCC(=O)N[C@@H](CNCc1cc(F)ccc1OC)C(C)(C)C	ZINC001755820542	1440925552	/nfs/dbraw/zinc/92/55/52/1440925552.db2.gz	KQXWWSQRNABDFV-KRWDZBQOSA-N	0	3	336.451	3.421	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](CNCc2cnoc2C)C(C)(C)C)CC1	ZINC001755830678	1440928563	/nfs/dbraw/zinc/92/85/63/1440928563.db2.gz	NIOCCWHFHCOGRW-QGZVFWFLSA-N	0	3	333.476	3.350	20	30		EGEDHN
C[C@@H](NC(=O)CCCF)C1CCN(Cc2cccc(C#N)c2)CC1	ZINC001755843966	1440932460	/nfs/dbraw/zinc/93/24/60/1440932460.db2.gz	CHJFJMLYJRZSQB-OAHLLOKOSA-N	0	3	331.435	3.025	20	30		EGEDHN
C=CCCC(=O)NC1(C2CCN(Cc3oc(C)nc3C)CC2)CC1	ZINC001755867781	1440938119	/nfs/dbraw/zinc/93/81/19/1440938119.db2.gz	UAQLYOSNFMKKKG-UHFFFAOYSA-N	0	3	331.460	3.118	20	30		EGEDHN
C#CCCCC(=O)NCC1=CCN(Cc2cc(C)sc2C)CC1	ZINC001755883728	1440939984	/nfs/dbraw/zinc/93/99/84/1440939984.db2.gz	VNEGIZHLYNBEEI-UHFFFAOYSA-N	0	3	330.497	3.417	20	30		EGEDHN
C=CCOCCN1CC=C(CNC(=O)[C@H]2CCC=CCCC2)CC1	ZINC001755888776	1440940811	/nfs/dbraw/zinc/94/08/11/1440940811.db2.gz	LQLXPIVJTXGBIP-IBGZPJMESA-N	0	3	332.488	3.074	20	30		EGEDHN
Cc1ccc(OCC(=O)C(C#N)C(=O)Nc2ccccc2Cl)cc1	ZINC000103504473	219309323	/nfs/dbraw/zinc/30/93/23/219309323.db2.gz	AKAGUHIVPNORFG-AWEZNQCLSA-N	0	3	342.782	3.375	20	30		EGEDHN
N#Cc1ccc(CNCc2c[nH]nc2-c2ccc3c(c2)OCCO3)cc1	ZINC000040153256	213274281	/nfs/dbraw/zinc/27/42/81/213274281.db2.gz	FUOKDAJXIQUHAK-UHFFFAOYSA-N	0	3	346.390	3.009	20	30		EGEDHN
C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCCN(Cc2cc(C#N)n(C)c2)C1	ZINC000191366130	239067831	/nfs/dbraw/zinc/06/78/31/239067831.db2.gz	PIYYGYKDMYFPGN-GOEBONIOSA-N	0	3	346.475	3.022	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCN2CCC(c3ccncc3)CC2)cc1	ZINC000191608690	239209638	/nfs/dbraw/zinc/20/96/38/239209638.db2.gz	VLAJWGMSLLYUBL-UHFFFAOYSA-N	0	3	334.423	3.161	20	30		EGEDHN
Cn1cc(CN[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)cc1C#N	ZINC000191616860	239213357	/nfs/dbraw/zinc/21/33/57/239213357.db2.gz	MRGMXJWPPULBQH-CQSZACIVSA-N	0	3	348.372	3.284	20	30		EGEDHN
C[C@H]1CCSCCN1Cc1cn(C)nc1-c1ccc(C#N)cc1	ZINC000191818693	239317787	/nfs/dbraw/zinc/31/77/87/239317787.db2.gz	UGIVUNYULGDGKB-AWEZNQCLSA-N	0	3	326.469	3.286	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc3c(c2)OC(C)(C)O3)CC1	ZINC000264437923	246500055	/nfs/dbraw/zinc/50/00/55/246500055.db2.gz	YUDKEJXECYBPST-UHFFFAOYSA-N	0	3	345.443	3.356	20	30		EGEDHN
CCOCCCN1CC[C@@H](Nc2snc(Cl)c2C#N)[C@@H](C)C1	ZINC000265177035	247272663	/nfs/dbraw/zinc/27/26/63/247272663.db2.gz	CYOLZSMRWSQJEE-WCQYABFASA-N	0	3	342.896	3.217	20	30		EGEDHN
C#CCCOc1ccc(CN[C@H](C)[C@@H](O)c2ccc(F)cc2)cc1	ZINC000265243698	247332016	/nfs/dbraw/zinc/33/20/16/247332016.db2.gz	MGKFESJMVRJTMS-FOIQADDNSA-N	0	3	327.399	3.440	20	30		EGEDHN
Cc1ccc(C#N)cc1NC(=O)NCC1CCN(c2ccncc2)CC1	ZINC000093239580	218207036	/nfs/dbraw/zinc/20/70/36/218207036.db2.gz	VAOUFGGTTRIMNB-UHFFFAOYSA-N	0	3	349.438	3.300	20	30		EGEDHN
COCCN(Cc1ccc(C#N)cc1)Cc1cccc2nsnc21	ZINC000268873965	252322355	/nfs/dbraw/zinc/32/23/55/252322355.db2.gz	GULNHLDRYJCJSC-UHFFFAOYSA-N	0	3	338.436	3.212	20	30		EGEDHN
C#CCOc1ccccc1CN1CCC[C@H](c2nnc3ccccn32)C1	ZINC000097032576	258011639	/nfs/dbraw/zinc/01/16/39/258011639.db2.gz	KFWVFXYNOKYADW-SFHVURJKSA-N	0	3	346.434	3.121	20	30		EGEDHN
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCc1cc(C#N)cs1	ZINC000342817886	141151007	/nfs/dbraw/zinc/15/10/07/141151007.db2.gz	HYCXDZKLBJZUIY-CXAGYDPISA-N	0	3	328.437	3.130	20	30		EGEDHN
COc1cc(C#N)ccc1CN(CCCO)[C@@H]1CCc2ccccc21	ZINC000121149777	152329371	/nfs/dbraw/zinc/32/93/71/152329371.db2.gz	CVTFZLXIRNLRQP-HXUWFJFHSA-N	0	3	336.435	3.439	20	30		EGEDHN
C[C@@H](COc1ccccc1C(F)(F)F)NCc1cc(C#N)n(C)c1	ZINC000190861254	153163377	/nfs/dbraw/zinc/16/33/77/153163377.db2.gz	UQBYPMZAPKFHSR-LBPRGKRZSA-N	0	3	337.345	3.473	20	30		EGEDHN
COCCN(C)CC[C@@H](NCc1ccc(C#N)s1)c1ccccc1	ZINC000344231397	164131790	/nfs/dbraw/zinc/13/17/90/164131790.db2.gz	LBAYDBQNBQQKSH-LJQANCHMSA-N	0	3	343.496	3.419	20	30		EGEDHN
C[C@H](N[C@@H]1CC(=O)N([C@@H]2C[C@H]2c2ccccc2)C1)c1ccc(C#N)cc1	ZINC000344316535	164154301	/nfs/dbraw/zinc/15/43/01/164154301.db2.gz	DTXZLRIBECEQBI-PSMQTCRGSA-N	0	3	345.446	3.366	20	30		EGEDHN
CN(Cc1cc(C#N)n(C)c1)C[C@@H]1C[C@@H](F)CN1Cc1cccs1	ZINC000354933146	166067369	/nfs/dbraw/zinc/06/73/69/166067369.db2.gz	FZIMFSMJJOKYKV-WBVHZDCISA-N	0	3	346.475	3.003	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)NCCN1CCCC[C@@H]1CC	ZINC000355372675	166177948	/nfs/dbraw/zinc/17/79/48/166177948.db2.gz	SMIILTATXFUXMC-INIZCTEOSA-N	0	3	344.459	3.343	20	30		EGEDHN
CC[C@H](C)N[C@@H](CNC(=O)c1cccc(F)c1C#N)c1ccco1	ZINC000359528879	167180476	/nfs/dbraw/zinc/18/04/76/167180476.db2.gz	BHVHNJJIPAZSFY-LRDDRELGSA-N	0	3	329.375	3.150	20	30		EGEDHN
C[C@@H](NC[C@H](O)Cn1cccn1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000359856016	167250086	/nfs/dbraw/zinc/25/00/86/167250086.db2.gz	CAINBJMQNALCJB-IERDGZPVSA-N	0	3	346.434	3.133	20	30		EGEDHN
COc1cc(CNCc2ccc(-n3ccnc3)c(F)c2)ccc1C#N	ZINC000367103216	168179455	/nfs/dbraw/zinc/17/94/55/168179455.db2.gz	ZHSWWRAVEOMXNB-UHFFFAOYSA-N	0	3	336.370	3.181	20	30		EGEDHN
N#Cc1ccnc(N2CC[C@]3(C2)CCCN(Cc2ccccc2)C3)c1	ZINC000367340464	168210455	/nfs/dbraw/zinc/21/04/55/168210455.db2.gz	XFVUGWZVXSRKGM-OAQYLSRUSA-N	0	3	332.451	3.446	20	30		EGEDHN
CCCOc1ccc(CNC(=O)C(C#N)Cc2ccc(C#N)cc2)cc1	ZINC000279324207	270040016	/nfs/dbraw/zinc/04/00/16/270040016.db2.gz	OJPKRZNPVRXUFH-LJQANCHMSA-N	0	3	347.418	3.346	20	30		EGEDHN
CC[C@@H](Cc1ccccc1)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000279436957	270040028	/nfs/dbraw/zinc/04/00/28/270040028.db2.gz	YGPMGGMDFSYSTH-PMACEKPBSA-N	0	3	331.419	3.378	20	30		EGEDHN
C#CCNC(=O)CCN[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000491164754	270057616	/nfs/dbraw/zinc/05/76/16/270057616.db2.gz	FKKSJUVXLVDNDU-MRXNPFEDSA-N	0	3	331.419	3.015	20	30		EGEDHN
C#C[C@@H](NC(=O)C(C#N)Cc1ccc(C#N)cc1)c1ccc(Cl)cc1	ZINC000491712726	270058021	/nfs/dbraw/zinc/05/80/21/270058021.db2.gz	AFFKCBXCOXLCCY-PKOBYXMFSA-N	0	3	347.805	3.385	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)c1cc(C#N)oc1C)c1ccccc1	ZINC000280529934	266119650	/nfs/dbraw/zinc/11/96/50/266119650.db2.gz	GUFRAUIRGYRKHL-GOSISDBHSA-N	0	3	325.412	3.273	20	30		EGEDHN
CC(C)Oc1cccc([C@H](O)CNCc2ccc(C#N)cc2F)c1	ZINC000269428554	266293123	/nfs/dbraw/zinc/29/31/23/266293123.db2.gz	OKUGEKGWLHKHCD-LJQANCHMSA-N	0	3	328.387	3.308	20	30		EGEDHN
CN(C)CCN(Cc1cc(C#N)n(C)c1)Cc1cccc(Cl)c1	ZINC000289402146	266495919	/nfs/dbraw/zinc/49/59/19/266495919.db2.gz	GRAVNLKUQLUMKW-UHFFFAOYSA-N	0	3	330.863	3.114	20	30		EGEDHN
C[C@@H](N[C@H](CO)Cc1c[nH]c2ccccc12)c1ccc(C#N)c(F)c1	ZINC000271929905	266978368	/nfs/dbraw/zinc/97/83/68/266978368.db2.gz	HNUDIACRUXANPN-DYVFJYSZSA-N	0	3	337.398	3.433	20	30		EGEDHN
CC1(C)[C@H](c2ccccc2)CCN1CC(=O)NCc1cccc(C#N)c1	ZINC000421009646	266981668	/nfs/dbraw/zinc/98/16/68/266981668.db2.gz	CBTONUNVUIXWFX-FQEVSTJZSA-N	0	3	347.462	3.443	20	30		EGEDHN
CCOC(=O)N1CCC[C@H]([C@@H](C)NCc2ccc(C#N)cc2F)C1	ZINC000495544241	267123469	/nfs/dbraw/zinc/12/34/69/267123469.db2.gz	VHBBEHLJMKKHDS-CJNGLKHVSA-N	0	3	333.407	3.044	20	30		EGEDHN
CN(C(=O)c1ccc(C#N)s1)C1CCN(Cc2ccccc2)CC1	ZINC000487047368	267277269	/nfs/dbraw/zinc/27/72/69/267277269.db2.gz	RAZSAWGKCXYKHI-UHFFFAOYSA-N	0	3	339.464	3.356	20	30		EGEDHN
CN(C)CCc1ccccc1NC(=O)NCc1cc(C#N)ccc1F	ZINC000446588805	267281314	/nfs/dbraw/zinc/28/13/14/267281314.db2.gz	COZLXKUKUYBRSU-UHFFFAOYSA-N	0	3	340.402	3.123	20	30		EGEDHN
CN(C)C[C@H]1CCCCN1C(=O)CCCCOc1cccc(C#N)c1	ZINC000517680895	267282169	/nfs/dbraw/zinc/28/21/69/267282169.db2.gz	LBUDMZVBXPLBCP-GOSISDBHSA-N	0	3	343.471	3.050	20	30		EGEDHN
CN(C)C[C@H](NC(=O)/C=C\c1cccc(C#N)c1)c1ccc(F)cc1	ZINC000493001812	267283054	/nfs/dbraw/zinc/28/30/54/267283054.db2.gz	CRUDOVGHQKAIIN-LFIXQJEJSA-N	0	3	337.398	3.130	20	30		EGEDHN
Cc1cc(F)cc2c1ncc(C#N)c2N1CCN(CC(C)C)CC1	ZINC000301658825	267328793	/nfs/dbraw/zinc/32/87/93/267328793.db2.gz	WKZQKDUTESKHQW-UHFFFAOYSA-N	0	3	326.419	3.332	20	30		EGEDHN
Cc1cc(NC(=O)N[C@@H](C)CN2CCCCC2)c(C#N)cc1N(C)C	ZINC000331230657	267333636	/nfs/dbraw/zinc/33/36/36/267333636.db2.gz	HIFUQJIDZJGYHA-HNNXBMFYSA-N	0	3	343.475	3.133	20	30		EGEDHN
CN1CCC[C@@]2(CCN(C(=O)C(C)(C)Cc3ccc(C#N)cc3)C2)C1	ZINC000456040638	267335451	/nfs/dbraw/zinc/33/54/51/267335451.db2.gz	XIEXAKXECPCHMA-OAQYLSRUSA-N	0	3	339.483	3.071	20	30		EGEDHN
COC(=O)[C@H]1CN(Cc2ccc(C#N)c(C)c2)C[C@@H]1c1ccccc1	ZINC000449752063	267388531	/nfs/dbraw/zinc/38/85/31/267388531.db2.gz	AXHNZFYHCTUYOH-UXHICEINSA-N	0	3	334.419	3.255	20	30		EGEDHN
COC(=O)[C@](C)(CNCc1ccc(C#N)c(C)c1)c1ccc(F)cc1	ZINC000447061310	267392748	/nfs/dbraw/zinc/39/27/48/267392748.db2.gz	RREJGACMSHHDQK-HXUWFJFHSA-N	0	3	340.398	3.226	20	30		EGEDHN
N#Cc1ccc(CC(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1	ZINC000194840044	268056652	/nfs/dbraw/zinc/05/66/52/268056652.db2.gz	SXTIYAVGLCEISL-KRWDZBQOSA-N	0	3	339.464	3.116	20	30		EGEDHN
N#Cc1ccc(CNCCCOCCOCc2ccccc2)s1	ZINC000272604515	268072008	/nfs/dbraw/zinc/07/20/08/268072008.db2.gz	SUCHTAZMNXPTBJ-UHFFFAOYSA-N	0	3	330.453	3.333	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CCc3ccc(Cl)cc3C2)cc1	ZINC000348417738	268084353	/nfs/dbraw/zinc/08/43/53/268084353.db2.gz	HLWUZGQASLIVSV-KRWDZBQOSA-N	0	3	349.821	3.479	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCc2nc3ccccc3s2)cc1	ZINC000347985339	268090473	/nfs/dbraw/zinc/09/04/73/268090473.db2.gz	IUHQLUHFCQUQSD-OAHLLOKOSA-N	0	3	346.415	3.167	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@@H]2CCCc3ccccc32)cc1	ZINC000279468785	268092151	/nfs/dbraw/zinc/09/21/51/268092151.db2.gz	MRUXSJYGZRMNTB-UYAOXDASSA-N	0	3	329.403	3.434	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@@H]2CCOc3c(F)cccc32)cc1	ZINC000348144941	268092361	/nfs/dbraw/zinc/09/23/61/268092361.db2.gz	QSWLUQKFMXYNTJ-CRAIPNDOSA-N	0	3	349.365	3.020	20	30		EGEDHN
N#Cc1ccc(N2CCN(Cc3cccc4ccccc43)CC2)cn1	ZINC000301598126	268118381	/nfs/dbraw/zinc/11/83/81/268118381.db2.gz	SZXRJALTDIHTRG-UHFFFAOYSA-N	0	3	328.419	3.429	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN2CCC[C@H]2c2cccc(F)c2)cc1	ZINC000298723011	268179097	/nfs/dbraw/zinc/17/90/97/268179097.db2.gz	PFBKBXWFIWPVCF-QUCCMNQESA-N	0	3	340.398	3.274	20	30		EGEDHN
N#Cc1ccc([N+](=O)[O-])c(N2CCN(CC3CCCCC3)CC2)c1	ZINC000301336224	268217092	/nfs/dbraw/zinc/21/70/92/268217092.db2.gz	DAZXBUDHCDEKPO-UHFFFAOYSA-N	0	3	328.416	3.169	20	30		EGEDHN
N#Cc1ccc2c(c1)N(C(=O)C1CCN(Cc3ccccc3)CC1)CC2	ZINC000270185042	268221626	/nfs/dbraw/zinc/22/16/26/268221626.db2.gz	HAMOISKMSZIQSG-UHFFFAOYSA-N	0	3	345.446	3.360	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3C[C@H](O)CC[C@H]3C2)c(OC(F)F)c1	ZINC000451692700	268222310	/nfs/dbraw/zinc/22/23/10/268222310.db2.gz	GELSLJXBWHGGLX-IJEWVQPXSA-N	0	3	336.382	3.143	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@H](c3nnc4n3CCCCC4)C2)c1	ZINC000298107534	268247749	/nfs/dbraw/zinc/24/77/49/268247749.db2.gz	KIWSYQKOYXHNAZ-SFHVURJKSA-N	0	3	335.455	3.256	20	30		EGEDHN
CC(C)CSCCCNC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000348353936	269613812	/nfs/dbraw/zinc/61/38/12/269613812.db2.gz	XRBNUADYGDFTMJ-QGZVFWFLSA-N	0	3	329.469	3.136	20	30		EGEDHN
CCCN(CCN1CCCCCC1)C(=O)NCc1ccc(C#N)cc1	ZINC000460165407	269652940	/nfs/dbraw/zinc/65/29/40/269652940.db2.gz	CPBICDQWDFZOBB-UHFFFAOYSA-N	0	3	342.487	3.356	20	30		EGEDHN
Cc1ccc(C#N)cc1NC(=O)NC[C@H](Cc1ccccc1)N(C)C	ZINC000058453554	274736323	/nfs/dbraw/zinc/73/63/23/274736323.db2.gz	WMSKAUZRQPXNPO-SFHVURJKSA-N	0	3	336.439	3.161	20	30		EGEDHN
CC1CCN([C@H](CNC(=O)c2cnccc2C#N)c2ccccc2)CC1	ZINC000358556584	275941916	/nfs/dbraw/zinc/94/19/16/275941916.db2.gz	MOALDUVCAYQMRF-HXUWFJFHSA-N	0	3	348.450	3.156	20	30		EGEDHN
CCC[C@@H](C)C(=O)NCCN[C@H]1CCCCc2cc(C#N)ccc21	ZINC000340420914	276021886	/nfs/dbraw/zinc/02/18/86/276021886.db2.gz	SAGJCIMICMGWIT-BEFAXECRSA-N	0	3	327.472	3.468	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cccc(NC(=O)OC)c2)CC1	ZINC000071880049	276862334	/nfs/dbraw/zinc/86/23/34/276862334.db2.gz	OMRLXXVBFALUDK-UHFFFAOYSA-N	0	3	346.431	3.027	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](O)COCc2ccccc2Cl)cc1F	ZINC000404144621	308908682	/nfs/dbraw/zinc/90/86/82/308908682.db2.gz	IWNJYDJXZDOAAB-INIZCTEOSA-N	0	3	348.805	3.018	20	30		EGEDHN
N#Cc1ccc(Br)c(CN2CCN(C3CCCC3)CC2)c1	ZINC000492607629	311271018	/nfs/dbraw/zinc/27/10/18/311271018.db2.gz	NTGBWDNPQGBGSZ-UHFFFAOYSA-N	0	3	348.288	3.381	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN2CCC=C(c3ccccc3)C2)cc1	ZINC000551405756	315153125	/nfs/dbraw/zinc/15/31/25/315153125.db2.gz	BCNVFODXBCDFKF-HXUWFJFHSA-N	0	3	334.419	3.087	20	30		EGEDHN
CN1CCN(CCCOc2cccc(C#N)c2)C[C@H]1Cc1ccccc1	ZINC000551406514	315153410	/nfs/dbraw/zinc/15/34/10/315153410.db2.gz	MGSRHSRWIXAFJF-OAQYLSRUSA-N	0	3	349.478	3.186	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)c1ncc(C#N)cc1C)c1ccsc1	ZINC000555298155	315377957	/nfs/dbraw/zinc/37/79/57/315377957.db2.gz	GJRBHQKANZQHHH-INIZCTEOSA-N	0	3	342.468	3.136	20	30		EGEDHN
N#Cc1csc(CNCc2cccc(CN3CCCC3=O)c2)c1	ZINC000177684815	323343577	/nfs/dbraw/zinc/34/35/77/323343577.db2.gz	LJAKERFNJSMNLJ-UHFFFAOYSA-N	0	3	325.437	3.032	20	30		EGEDHN
N#Cc1ccc(NC(=O)CN[C@@H](C[C@H]2CCOC2)c2ccccc2)cc1	ZINC000181215572	323474280	/nfs/dbraw/zinc/47/42/80/323474280.db2.gz	AUXCSWHIYYHLKI-XLIONFOSSA-N	0	3	349.434	3.254	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1C[C@@H](C)S[C@@H](C)C1)C(C)C	ZINC000525295178	459444572	/nfs/dbraw/zinc/44/45/72/459444572.db2.gz	XXCPYYLFLKNMKO-IXDOHACOSA-N	0	3	339.549	3.220	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC[C@@]2(C)CCCc3ccccc32)CC1	ZINC000180983126	455273100	/nfs/dbraw/zinc/27/31/00/455273100.db2.gz	YKEQWGSBLOQUHI-OAQYLSRUSA-N	0	3	341.499	3.230	20	30		EGEDHN
Cc1ccc([C@H](C)N[C@H]2CCN(Cc3ccc(C#N)cc3)C2=O)s1	ZINC000190604021	455350736	/nfs/dbraw/zinc/35/07/36/455350736.db2.gz	KBHHPFUKBYJFQC-YOEHRIQHSA-N	0	3	339.464	3.380	20	30		EGEDHN
Cc1cccc(OCCN(C)CCC(=O)Nc2ccccc2C#N)c1	ZINC000014079604	453502696	/nfs/dbraw/zinc/50/26/96/453502696.db2.gz	DQKZYTPSFQWMNV-UHFFFAOYSA-N	0	3	337.423	3.206	20	30		EGEDHN
CN(C)[C@@H](CNc1ccc([N+](=O)[O-])cc1C#N)c1cccc(F)c1	ZINC000024107803	453725638	/nfs/dbraw/zinc/72/56/38/453725638.db2.gz	RTVNGXLINIOTGU-KRWDZBQOSA-N	0	3	328.347	3.320	20	30		EGEDHN
CN(CCOc1ccc(F)cc1)CCC(=O)Nc1sccc1C#N	ZINC000024339589	453731418	/nfs/dbraw/zinc/73/14/18/453731418.db2.gz	UXYIWBZGCFSMCX-UHFFFAOYSA-N	0	3	347.415	3.098	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(c3cnc4ccccc4n3)CC2)cc1	ZINC000026138253	453792990	/nfs/dbraw/zinc/79/29/90/453792990.db2.gz	GLJRCXSKUFPYKS-UHFFFAOYSA-N	0	3	343.434	3.214	20	30		EGEDHN
CN(CCOc1ccc(F)cc1)CCC(=O)Nc1ccc(C#N)cc1	ZINC000026336800	453796982	/nfs/dbraw/zinc/79/69/82/453796982.db2.gz	GRVQUOSIUFDZEP-UHFFFAOYSA-N	0	3	341.386	3.037	20	30		EGEDHN
CN(CCOc1ccccc1F)CCC(=O)Nc1ccc(C#N)cc1	ZINC000026337157	453797318	/nfs/dbraw/zinc/79/73/18/453797318.db2.gz	OEAQINXQSPOCKO-UHFFFAOYSA-N	0	3	341.386	3.037	20	30		EGEDHN
N#Cc1ccc(CCC(=O)NCCCN2CCc3ccccc3C2)cc1	ZINC000029840979	453832096	/nfs/dbraw/zinc/83/20/96/453832096.db2.gz	MIILFPVUBAOKPF-UHFFFAOYSA-N	0	3	347.462	3.055	20	30		EGEDHN
C[C@@H](NC(=O)NCc1cccc(CN(C)C)c1)c1ccc(C#N)cc1	ZINC000031125324	453839205	/nfs/dbraw/zinc/83/92/05/453839205.db2.gz	QQGROLIMAFDGGO-OAHLLOKOSA-N	0	3	336.439	3.180	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)CN(Cc1ccccc1)[C@@H](C)C1CC1	ZINC000052795414	453844829	/nfs/dbraw/zinc/84/48/29/453844829.db2.gz	DLMHUGRNBRPALI-JXFKEZNVSA-N	0	3	327.472	3.342	20	30		EGEDHN
N#Cc1c(NC(=O)CCN2CCC23CCC3)sc2c1CCCC2	ZINC000081545439	453884764	/nfs/dbraw/zinc/88/47/64/453884764.db2.gz	PQVGRGGLSCKJOC-UHFFFAOYSA-N	0	3	329.469	3.456	20	30		EGEDHN
N#Cc1csc(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)c1	ZINC000084183324	453975863	/nfs/dbraw/zinc/97/58/63/453975863.db2.gz	HPCGYEBSEUVQMP-MRXNPFEDSA-N	0	3	339.464	3.262	20	30		EGEDHN
Cn1cc(CNc2cccc(N3CCN(CC4CC4)CC3)c2)cc1C#N	ZINC000190865795	455394142	/nfs/dbraw/zinc/39/41/42/455394142.db2.gz	AKQZVTOMSPQCNG-UHFFFAOYSA-N	0	3	349.482	3.041	20	30		EGEDHN
CN(c1cccc(F)c1C#N)C1CCN(CCc2ccccn2)CC1	ZINC000069617537	454125093	/nfs/dbraw/zinc/12/50/93/454125093.db2.gz	GNPWQPCEHPWLLK-UHFFFAOYSA-N	0	3	338.430	3.236	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Nc1c(C)nn(CC)c1C)C(C)C	ZINC000089480271	454155096	/nfs/dbraw/zinc/15/50/96/454155096.db2.gz	FOSLJIXXIWSMPZ-QGZVFWFLSA-N	0	3	347.507	3.340	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H]2C[C@H]2c2cc(F)ccc2F)CC1	ZINC000119279215	454183697	/nfs/dbraw/zinc/18/36/97/454183697.db2.gz	STSIWIYWIZLBFG-RDJZCZTQSA-N	0	3	334.410	3.225	20	30		EGEDHN
N#CC(C(=O)[C@H]1CCCN(C(=O)C2CC2)C1)c1ccc2ccccc2n1	ZINC000089873129	454222746	/nfs/dbraw/zinc/22/27/46/454222746.db2.gz	RGTXGXKAEROICO-IRXDYDNUSA-N	0	3	347.418	3.060	20	30		EGEDHN
N#Cc1cccc(COc2cccc(CNCCn3cccn3)c2)c1	ZINC000071819648	454224142	/nfs/dbraw/zinc/22/41/42/454224142.db2.gz	BLWZZJXTNOAQGG-UHFFFAOYSA-N	0	3	332.407	3.124	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H]2CCCC[C@H]2SCC)CC1	ZINC000078331646	454232859	/nfs/dbraw/zinc/23/28/59/454232859.db2.gz	ADOFBHZNTHCHMT-HZPDHXFCSA-N	0	3	325.522	3.000	20	30		EGEDHN
C=CCOc1ccc(C(F)(F)F)cc1C(=O)NC1CCN(C)CC1	ZINC000071916276	454257066	/nfs/dbraw/zinc/25/70/66/454257066.db2.gz	WWBVRZOVPRXDIB-UHFFFAOYSA-N	0	3	342.361	3.094	20	30		EGEDHN
C[C@@H](NCCOc1ccc(C#N)cc1)c1ccc([S@@](C)=O)cc1	ZINC000090107618	454280680	/nfs/dbraw/zinc/28/06/80/454280680.db2.gz	NKHOGFCOSPWDQP-FATZIPQQSA-N	0	3	328.437	3.025	20	30		EGEDHN
CCOC1CCN(CCC(=O)Nc2ccc(C#N)c(Cl)c2)CC1	ZINC000060485231	454294163	/nfs/dbraw/zinc/29/41/63/454294163.db2.gz	UQTHMNSBCZSFBF-UHFFFAOYSA-N	0	3	335.835	3.041	20	30		EGEDHN
Cc1ccc(C(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)s1	ZINC000047010830	454318105	/nfs/dbraw/zinc/31/81/05/454318105.db2.gz	ILGVMFUEMCFSEY-UHFFFAOYSA-N	0	3	327.453	3.132	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NCC1CCN(Cc2cccs2)CC1	ZINC000061566845	454346526	/nfs/dbraw/zinc/34/65/26/454346526.db2.gz	KGXUUUWEXKXUGT-HNNXBMFYSA-N	0	3	336.501	3.058	20	30		EGEDHN
C[C@H]1CCCN(CC#Cc2ccc(OC(F)(F)F)cc2)[C@@H]1CO	ZINC000132778996	454365788	/nfs/dbraw/zinc/36/57/88/454365788.db2.gz	ZBVKBVPXZDRCBS-XJKSGUPXSA-N	0	3	327.346	3.030	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N[C@@H](C)c1c(C)noc1C)C(C)C	ZINC000073202764	454407041	/nfs/dbraw/zinc/40/70/41/454407041.db2.gz	WYMUASLLKSQYOV-WMLDXEAASA-N	0	3	348.491	3.350	20	30		EGEDHN
CCC[C@@H](C)N(C)CC(=O)Nc1c(C#N)c(C)c(C)n1CCCOC	ZINC000048070614	454440746	/nfs/dbraw/zinc/44/07/46/454440746.db2.gz	ZZSGFVLAUKZQNI-CQSZACIVSA-N	0	3	348.491	3.072	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(CC#Cc3ccc(F)cc3)CC2)cc1	ZINC000121494910	454443120	/nfs/dbraw/zinc/44/31/20/454443120.db2.gz	VYEYLLDWYSUXAE-UHFFFAOYSA-N	0	3	347.437	3.257	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@@H](C)N1CCC(c2ccc(O)cc2)CC1	ZINC000073713589	454470161	/nfs/dbraw/zinc/47/01/61/454470161.db2.gz	WDZNETGAVJYQIC-MRXNPFEDSA-N	0	3	330.472	3.385	20	30		EGEDHN
C=CCOc1ccc(CN2CCC[C@@H](c3nc(C)no3)C2)cc1OC	ZINC000091832854	454477842	/nfs/dbraw/zinc/47/78/42/454477842.db2.gz	IIJOULKTFVOXNX-MRXNPFEDSA-N	0	3	343.427	3.331	20	30		EGEDHN
C=CCc1cc(CN2CCC[C@H](c3nc(C)no3)C2)cc(OC)c1O	ZINC000091832557	454478117	/nfs/dbraw/zinc/47/81/17/454478117.db2.gz	HCRIKOZLSWEQBC-INIZCTEOSA-N	0	3	343.427	3.200	20	30		EGEDHN
Cc1noc([C@H]2CCCN(Cc3ccc(N(C)CCC#N)cc3)C2)n1	ZINC000091833014	454478475	/nfs/dbraw/zinc/47/84/75/454478475.db2.gz	CPBSNEWAHUQCCC-KRWDZBQOSA-N	0	3	339.443	3.108	20	30		EGEDHN
COc1ccc(CNCCc2nc(C)cs2)cc1OCCCC#N	ZINC000064613949	454494061	/nfs/dbraw/zinc/49/40/61/454494061.db2.gz	JHTXDYRLZGIBOY-UHFFFAOYSA-N	0	3	345.468	3.475	20	30		EGEDHN
COC(=O)[C@@H](C)[C@H](NCCOc1ccc(C#N)cc1)c1ccccc1	ZINC000079922269	454499881	/nfs/dbraw/zinc/49/98/81/454499881.db2.gz	HNMQYQPBWFUYJV-KXBFYZLASA-N	0	3	338.407	3.077	20	30		EGEDHN
Cc1nc(CON=C(N)c2ccccc2CN2CCCCC2)cs1	ZINC000102653977	454513711	/nfs/dbraw/zinc/51/37/11/454513711.db2.gz	INFXGGAVEGRLDO-UHFFFAOYSA-N	0	3	344.484	3.275	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@]2(C)CCc3ccccc3C2)CC1	ZINC000080079889	454529408	/nfs/dbraw/zinc/52/94/08/454529408.db2.gz	FWLVXCSDCHXBLQ-NRFANRHFSA-N	0	3	326.484	3.338	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccnc(Oc3ccccc3)c2)CC1	ZINC000074254594	454551111	/nfs/dbraw/zinc/55/11/11/454551111.db2.gz	OFUFNUKYOVPFKJ-UHFFFAOYSA-N	0	3	335.407	3.158	20	30		EGEDHN
CCSCc1ccc(C(=O)C(C#N)C(=O)Nc2ccccn2)cc1	ZINC000104055591	454572217	/nfs/dbraw/zinc/57/22/17/454572217.db2.gz	VXWMYSIXRGURHM-OAHLLOKOSA-N	0	3	339.420	3.296	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)c2sccc2C#N)N(C)C)cc1	ZINC000052034144	454650479	/nfs/dbraw/zinc/65/04/79/454650479.db2.gz	HMRHBXVNEXTSRS-MRXNPFEDSA-N	0	3	327.453	3.215	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)COc2ccc(C(C)C)cc2)CC1	ZINC000106038987	454675860	/nfs/dbraw/zinc/67/58/60/454675860.db2.gz	WTVNQZYNPUNMHA-UHFFFAOYSA-N	0	3	330.472	3.346	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H](C)Oc2cccc(Cl)c2)CC1	ZINC000106040276	454676093	/nfs/dbraw/zinc/67/60/93/454676093.db2.gz	HHSQDGJHJKPVAF-AWEZNQCLSA-N	0	3	336.863	3.264	20	30		EGEDHN
CC(C)n1cc([C@H](C)NC2CCN(c3ccc(C#N)cn3)CC2)cn1	ZINC000161771692	454722394	/nfs/dbraw/zinc/72/23/94/454722394.db2.gz	KLGJEBQFCOJMHT-HNNXBMFYSA-N	0	3	338.459	3.050	20	30		EGEDHN
CCOC[C@@H]1CCN(Cc2cn(CCC#N)nc2-c2ccccc2)C1	ZINC000093838708	454738027	/nfs/dbraw/zinc/73/80/27/454738027.db2.gz	WZJNYVMYAIFFOF-QGZVFWFLSA-N	0	3	338.455	3.322	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC[C@H](C)Cc2cccs2)CC1	ZINC000176501201	454752724	/nfs/dbraw/zinc/75/27/24/454752724.db2.gz	HTLBEKKCSVBGAN-OAHLLOKOSA-N	0	3	335.517	3.266	20	30		EGEDHN
COCCOc1ccc(Cl)cc1C(=O)C(C#N)c1ccccn1	ZINC000176526920	454756352	/nfs/dbraw/zinc/75/63/52/454756352.db2.gz	ROEPUEXFFXXXRV-CQSZACIVSA-N	0	3	330.771	3.250	20	30		EGEDHN
N#CCCCN1CCC[C@@H](c2nnc3ccc(C(F)(F)F)cn32)C1	ZINC000153252065	454775433	/nfs/dbraw/zinc/77/54/33/454775433.db2.gz	IBRWXPORIUOMMT-GFCCVEGCSA-N	0	3	337.349	3.231	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN1CCC[C@@H]1c1ccc(O)cc1	ZINC000138870750	454798517	/nfs/dbraw/zinc/79/85/17/454798517.db2.gz	WDGXVFZNSVHEDL-MRXNPFEDSA-N	0	3	341.436	3.491	20	30		EGEDHN
C[C@@H](CC#N)Sc1ccccc1NC(=O)CN[C@@H](C)[C@@H]1CCOC1	ZINC000162754916	454799141	/nfs/dbraw/zinc/79/91/41/454799141.db2.gz	PNXSBMVFNGMXFD-SOUVJXGZSA-N	0	3	347.484	3.034	20	30		EGEDHN
N#Cc1ccc(OC2CCC(NCc3cccnc3Cl)CC2)nc1	ZINC000125416716	454820555	/nfs/dbraw/zinc/82/05/55/454820555.db2.gz	JPRGJIGHCGPGCS-UHFFFAOYSA-N	0	3	342.830	3.481	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN(Cc1cccnc1)C(C)C	ZINC000125738285	454842762	/nfs/dbraw/zinc/84/27/62/454842762.db2.gz	HROCGMIWCSWMJE-UHFFFAOYSA-N	0	3	325.412	3.251	20	30		EGEDHN
C=CC1CCN([C@@H](C)C(=O)N(C)Cc2ccc(OC)c(F)c2)CC1	ZINC000111258088	454859142	/nfs/dbraw/zinc/85/91/42/454859142.db2.gz	UFJJQEJLRUKSII-AWEZNQCLSA-N	0	3	334.435	3.079	20	30		EGEDHN
CCS[C@@H]1CCCCN([C@@H](C)C(=O)NC2(C#N)CCCCC2)C1	ZINC000112088080	454880113	/nfs/dbraw/zinc/88/01/13/454880113.db2.gz	VUYSQTIKEDCRKV-JKSUJKDBSA-N	0	3	337.533	3.325	20	30		EGEDHN
C=CCN(Cc1nn2c(nc(C)cc2=O)s1)CC1CCCCC1	ZINC000112202362	454882279	/nfs/dbraw/zinc/88/22/79/454882279.db2.gz	QYWMIEXIJOBVEJ-UHFFFAOYSA-N	0	3	332.473	3.028	20	30		EGEDHN
N#Cc1ccccc1COc1cccc(CN2CCC[C@H](CO)C2)c1	ZINC000154576940	454908806	/nfs/dbraw/zinc/90/88/06/454908806.db2.gz	PYLPESCKXLQMGX-SFHVURJKSA-N	0	3	336.435	3.342	20	30		EGEDHN
C=CCc1cc(CNC[C@H](c2ccco2)N(C)C)cc(OC)c1O	ZINC000113313129	454921804	/nfs/dbraw/zinc/92/18/04/454921804.db2.gz	LESWGDZISDRTNB-MRXNPFEDSA-N	0	3	330.428	3.115	20	30		EGEDHN
C=CCc1cc(CNC[C@@H](O)c2ccc(C)cc2)cc(OC)c1O	ZINC000113326175	454923244	/nfs/dbraw/zinc/92/32/44/454923244.db2.gz	CGMFIMOUKLXGHX-GOSISDBHSA-N	0	3	327.424	3.261	20	30		EGEDHN
N#Cc1ccc(CCC(=O)NC[C@@H]2CCCN2Cc2ccccc2)cc1	ZINC000114642779	454965868	/nfs/dbraw/zinc/96/58/68/454965868.db2.gz	RXOOUMALWOMFRJ-NRFANRHFSA-N	0	3	347.462	3.272	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H]1C[C@@H](C)N(C2CC2)C1	ZINC000127507437	454971446	/nfs/dbraw/zinc/97/14/46/454971446.db2.gz	UTBFBGSKIYPOPR-QAPCUYQASA-N	0	3	340.471	3.105	20	30		EGEDHN
C=CCN(CCc1ccccc1)C(=O)N[C@H]1C[C@H](C)N(C2CC2)C1	ZINC000127618943	454982340	/nfs/dbraw/zinc/98/23/40/454982340.db2.gz	BUUFVPZWGZBHHT-WMZOPIPTSA-N	0	3	327.472	3.052	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H](c2ccccc2Cl)C(C)C)CC1	ZINC000115097743	454996747	/nfs/dbraw/zinc/99/67/47/454996747.db2.gz	KNJKCRRQXAGGIB-SFHVURJKSA-N	0	3	332.875	3.499	20	30		EGEDHN
C[C@@H](N[C@H]1CCCN(Cc2ccccc2)C1=O)c1cccc(C#N)c1	ZINC000179244723	455024155	/nfs/dbraw/zinc/02/41/55/455024155.db2.gz	RQXNOBLQOGXRLB-UZLBHIALSA-N	0	3	333.435	3.400	20	30		EGEDHN
C[C@H](N[C@@H]1CCCN(Cc2ccccc2)C1=O)c1cccc(C#N)c1	ZINC000179244701	455024166	/nfs/dbraw/zinc/02/41/66/455024166.db2.gz	RQXNOBLQOGXRLB-OXJNMPFZSA-N	0	3	333.435	3.400	20	30		EGEDHN
N#Cc1cc(F)ccc1CN1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1	ZINC000179506681	455054338	/nfs/dbraw/zinc/05/43/38/455054338.db2.gz	XFFZPQCDRBJSQH-CQSZACIVSA-N	0	3	325.391	3.072	20	30		EGEDHN
COc1ccc(C#N)cc1CN(Cc1ccccc1)[C@@H](CO)C1CC1	ZINC000156039522	455075961	/nfs/dbraw/zinc/07/59/61/455075961.db2.gz	QKGCOVYJNKHRNF-FQEVSTJZSA-N	0	3	336.435	3.340	20	30		EGEDHN
C=CC[C@H](C)NC(=O)N1CCCN(CCCc2ccccc2)CC1	ZINC000116973886	455076324	/nfs/dbraw/zinc/07/63/24/455076324.db2.gz	OJNNQVGLQMIGSS-SFHVURJKSA-N	0	3	329.488	3.301	20	30		EGEDHN
C=CC[C@H](C)NC(=O)Nc1ccc(CCN2CCSCC2)cc1	ZINC000117004363	455077341	/nfs/dbraw/zinc/07/73/41/455077341.db2.gz	RVPAJGJZSNUJKU-HNNXBMFYSA-N	0	3	333.501	3.364	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC[C@H](c2ccccc2)C(C)C)CC1	ZINC000171716379	455088853	/nfs/dbraw/zinc/08/88/53/455088853.db2.gz	RLZXQEQRDRENBM-IBGZPJMESA-N	0	3	329.488	3.376	20	30		EGEDHN
C=CCOc1ccc(CNCc2ccc(OCC#N)cc2)cc1OC	ZINC000171769814	455092760	/nfs/dbraw/zinc/09/27/60/455092760.db2.gz	XTFVNWPITBCTLS-UHFFFAOYSA-N	0	3	338.407	3.452	20	30		EGEDHN
CC(C)N1CCCN(C(=O)Nc2ccc(C(C)(C)C#N)cc2)CC1	ZINC000263936336	455168055	/nfs/dbraw/zinc/16/80/55/455168055.db2.gz	FBFVIJLEADEBOY-UHFFFAOYSA-N	0	3	328.460	3.436	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2c[nH]cc2-c2ccc(C)s2)CC1	ZINC000189276905	455168377	/nfs/dbraw/zinc/16/83/77/455168377.db2.gz	XTIFQCAKQUZASP-UHFFFAOYSA-N	0	3	329.469	3.432	20	30		EGEDHN
CC1(C)[C@H](NCc2cccc(OCc3cccc(C#N)c3)c2)C[C@@H]1O	ZINC000189327671	455176748	/nfs/dbraw/zinc/17/67/48/455176748.db2.gz	KOUVYXLAFGHOBZ-UXHICEINSA-N	0	3	336.435	3.386	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2nc3ccccc3s2)CC1	ZINC000264405755	455206376	/nfs/dbraw/zinc/20/63/76/455206376.db2.gz	RNWQJMNEHJGLSZ-UHFFFAOYSA-N	0	3	344.484	3.136	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc3c(c2)O[C@@](C)(CC)O3)CC1	ZINC000190499002	455333997	/nfs/dbraw/zinc/33/39/97/455333997.db2.gz	PUNMVQHQFUHBKP-IBGZPJMESA-N	0	3	345.443	3.356	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN[C@H](C)c1cccc(O)c1	ZINC000181512380	455346969	/nfs/dbraw/zinc/34/69/69/455346969.db2.gz	ZYPPJIXMNPTSGR-DNVCBOLYSA-N	0	3	327.424	3.211	20	30		EGEDHN
C[C@H](N[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O)[C@@H](C)c1ccccc1	ZINC000190622154	455355576	/nfs/dbraw/zinc/35/55/76/455355576.db2.gz	BHFQNSFPQNDDLZ-LLGFUMIMSA-N	0	3	347.462	3.441	20	30		EGEDHN
CC(C)(C#N)CN[C@@H]1CCCC[C@H](N2C(=O)c3ccccc3C2=O)C1	ZINC000612585237	460670085	/nfs/dbraw/zinc/67/00/85/460670085.db2.gz	TWJPUJXVZIOVBC-CABCVRRESA-N	0	3	339.439	3.123	20	30		EGEDHN
CC(C)C[C@H](NCC(=O)NCC#N)c1cccc(C(F)(F)F)c1	ZINC000181882110	455393563	/nfs/dbraw/zinc/39/35/63/455393563.db2.gz	LODYRVCGDDPJFR-AWEZNQCLSA-N	0	3	327.350	3.022	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1CCS[C@H]2CCCC[C@H]21	ZINC000246070465	455421494	/nfs/dbraw/zinc/42/14/94/455421494.db2.gz	CKAKUFMGANSKRU-QAPCUYQASA-N	0	3	332.469	3.306	20	30		EGEDHN
CN(Cc1ccc(OCC#N)cc1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000266716581	455441415	/nfs/dbraw/zinc/44/14/15/455441415.db2.gz	IQRAAQJBIFOHIM-MRXNPFEDSA-N	0	3	345.443	3.030	20	30		EGEDHN
COc1ccc([C@H](CCO)NCCCOc2cccc(C#N)c2)cc1	ZINC000182399613	455505489	/nfs/dbraw/zinc/50/54/89/455505489.db2.gz	OGOWXFZCBQVAGB-FQEVSTJZSA-N	0	3	340.423	3.049	20	30		EGEDHN
C[C@H]1CN(CCC2CCN(CC#Cc3ccccc3)CC2)C[C@H](C)O1	ZINC000192061169	455551179	/nfs/dbraw/zinc/55/11/79/455551179.db2.gz	LVWBLERJXYIZHD-PMACEKPBSA-N	0	3	340.511	3.249	20	30		EGEDHN
C=CCCCC(=O)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000267859943	455557763	/nfs/dbraw/zinc/55/77/63/455557763.db2.gz	GPDCLFAKTXMWLX-UHFFFAOYSA-N	0	3	334.435	3.141	20	30		EGEDHN
Cc1cc(C)cc(CN[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)c1	ZINC000192243191	455580362	/nfs/dbraw/zinc/58/03/62/455580362.db2.gz	RHNULVLPDXWXJT-HXUWFJFHSA-N	0	3	333.435	3.066	20	30		EGEDHN
C=CCCOCC(=O)N(CC)[C@H]1CCN([C@H](C)c2ccccc2)C1	ZINC000620531723	460679701	/nfs/dbraw/zinc/67/97/01/460679701.db2.gz	NNFLORWIYPJXOK-MJGOQNOKSA-N	0	3	330.472	3.263	20	30		EGEDHN
C[C@H](c1cccc(S(N)(=O)=O)c1)N(C)CCCCC(C)(C)C#N	ZINC000277571081	455602041	/nfs/dbraw/zinc/60/20/41/455602041.db2.gz	BJQVOJFDFCPRDY-CQSZACIVSA-N	0	3	337.489	3.047	20	30		EGEDHN
C[C@H]1CN(C(=O)c2ccc(C(C)(C)C#N)cc2)CCN(C2CCC2)C1	ZINC000292264834	455613661	/nfs/dbraw/zinc/61/36/61/455613661.db2.gz	FRWSPUFHVQRUKK-MRXNPFEDSA-N	0	3	339.483	3.434	20	30		EGEDHN
CC(C)(NC[C@H](O)c1ccc(C#N)cc1)c1ccccc1[N+](=O)[O-]	ZINC000292272451	455614280	/nfs/dbraw/zinc/61/42/80/455614280.db2.gz	ZRQXLGYCAOSOJI-KRWDZBQOSA-N	0	3	325.368	3.025	20	30		EGEDHN
CN(C(=O)CN[C@H](c1ccccc1)C1CC1)C1(C#N)CCCCC1	ZINC000192504772	455633106	/nfs/dbraw/zinc/63/31/06/455633106.db2.gz	VBQPIJAQDHVLBK-LJQANCHMSA-N	0	3	325.456	3.412	20	30		EGEDHN
C=CCSCCN[C@H](C)c1ccc(OCCOC)c(OC)c1	ZINC000271507626	455663951	/nfs/dbraw/zinc/66/39/51/455663951.db2.gz	RVJKGOKGWJMONP-CQSZACIVSA-N	0	3	325.474	3.290	20	30		EGEDHN
C[C@@H](NCCOc1cccc(C#N)c1)[C@@H]1OCCc2sccc21	ZINC000292479234	455674311	/nfs/dbraw/zinc/67/43/11/455674311.db2.gz	RZSJEYRQYVEKSU-ACJLOTCBSA-N	0	3	328.437	3.291	20	30		EGEDHN
C=CCN(C(=O)NC[C@@H]1CCCN(Cc2cccs2)C1)C1CC1	ZINC000271598161	455696545	/nfs/dbraw/zinc/69/65/45/455696545.db2.gz	UXFCCSPQMJKVJM-HNNXBMFYSA-N	0	3	333.501	3.320	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(Cc3cc(O)cc(F)c3)CC2)cc1	ZINC000186170300	455709005	/nfs/dbraw/zinc/70/90/05/455709005.db2.gz	CXEHWUCYCCRUJB-UHFFFAOYSA-N	0	3	339.414	3.111	20	30		EGEDHN
Cc1ccc(NC(=O)[C@@H]2CCCN(Cc3ccc(C#N)cc3C)C2)nc1	ZINC000186296164	455737493	/nfs/dbraw/zinc/73/74/93/455737493.db2.gz	GITVLLNPNDGPDI-LJQANCHMSA-N	0	3	348.450	3.421	20	30		EGEDHN
CC(C)(NC[C@@H](O)COc1ccc(C#N)cc1)c1ccc(F)c(F)c1	ZINC000271739503	455740524	/nfs/dbraw/zinc/74/05/24/455740524.db2.gz	VIUWPMOWGPOKPY-OAHLLOKOSA-N	0	3	346.377	3.101	20	30		EGEDHN
Cc1cc(C(=O)C(C#N)c2nnc3n2CCCCC3)c2ccccc2n1	ZINC000193262399	455750651	/nfs/dbraw/zinc/75/06/51/455750651.db2.gz	CLSPJFLGPOXECB-MRXNPFEDSA-N	0	3	345.406	3.351	20	30		EGEDHN
CC(C)C[C@H]1OCCC[C@@H]1NCC(=O)N(CCC#N)c1ccccc1	ZINC000186358510	455751934	/nfs/dbraw/zinc/75/19/34/455751934.db2.gz	FFVMAYMJVLKLNM-RBUKOAKNSA-N	0	3	343.471	3.117	20	30		EGEDHN
COC(=O)N1CCC([C@H](C)NCC#Cc2cccc(Cl)c2)CC1	ZINC000186389720	455758901	/nfs/dbraw/zinc/75/89/01/455758901.db2.gz	YHKIAUNZBJBJRW-AWEZNQCLSA-N	0	3	334.847	3.148	20	30		EGEDHN
C[C@H]1CN(C(=O)Nc2ccc(F)cc2C#N)CCN(C2CCC2)C1	ZINC000292879674	455765142	/nfs/dbraw/zinc/76/51/42/455765142.db2.gz	XUODYXMCPNSATH-CYBMUJFWSA-N	0	3	330.407	3.035	20	30		EGEDHN
OC[C@H]1CCCN(CC#Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000293027697	455770746	/nfs/dbraw/zinc/77/07/46/455770746.db2.gz	FZEGCVIMGGFZJR-HNNXBMFYSA-N	0	3	327.346	3.031	20	30		EGEDHN
C=C(C)[C@H](NC1CCN(C(=O)N(C)C)CC1)c1ccc(F)c(F)c1	ZINC000186451694	455771409	/nfs/dbraw/zinc/77/14/09/455771409.db2.gz	PLKPELZPYHOPBK-KRWDZBQOSA-N	0	3	337.414	3.318	20	30		EGEDHN
COc1cc(NCCN[C@H](C)c2ccc(C#N)c(F)c2)cc(OC)c1	ZINC000271945031	455801093	/nfs/dbraw/zinc/80/10/93/455801093.db2.gz	NAKNSLOGXXGLJG-CYBMUJFWSA-N	0	3	343.402	3.477	20	30		EGEDHN
C#CCNC(=O)CCN[C@@H](C)c1cccc(OCc2ccccc2)c1	ZINC000294239537	455808409	/nfs/dbraw/zinc/80/84/09/455808409.db2.gz	TZHWSLUZNIJUPS-KRWDZBQOSA-N	0	3	336.435	3.056	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C	ZINC000294428724	455814361	/nfs/dbraw/zinc/81/43/61/455814361.db2.gz	NQDXWCSXVJSPDJ-PBHICJAKSA-N	0	3	336.501	3.109	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1CC2(CCN(C)CC2)Oc2ccccc21	ZINC000294513933	455818228	/nfs/dbraw/zinc/81/82/28/455818228.db2.gz	ONAVZKKJBZOSEF-INIZCTEOSA-N	0	3	328.456	3.303	20	30		EGEDHN
CC(C)(C#N)CCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000272026520	455824710	/nfs/dbraw/zinc/82/47/10/455824710.db2.gz	OBTMGZCZFFFHFN-UHFFFAOYSA-N	0	3	332.423	3.351	20	30		EGEDHN
CC[C@@H](NCCNC(=O)c1c(F)cccc1F)c1ccc(C#N)cc1	ZINC000278780959	455848237	/nfs/dbraw/zinc/84/82/37/455848237.db2.gz	PXBRWTAZRVHFHD-QGZVFWFLSA-N	0	3	343.377	3.307	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)N[C@H](C[C@@H]1CCOC1)c1ccccc1	ZINC000279131120	455859355	/nfs/dbraw/zinc/85/93/55/455859355.db2.gz	WBRLYPIUSLIKHX-CMKODMSKSA-N	0	3	342.483	3.333	20	30		EGEDHN
CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1ccc(F)c(C#N)c1	ZINC000279180701	455860450	/nfs/dbraw/zinc/86/04/50/455860450.db2.gz	IEKRJPJMKRSFMM-UHFFFAOYSA-N	0	3	343.377	3.040	20	30		EGEDHN
CSC[C@@H]1CCCN1Cc1cn(CCC#N)nc1-c1ccncc1	ZINC000279439140	455865284	/nfs/dbraw/zinc/86/52/84/455865284.db2.gz	RHISVVQOUIRZIO-KRWDZBQOSA-N	0	3	341.484	3.186	20	30		EGEDHN
Cc1cc(C)cc(N(CCC#N)C(=O)[C@H](C)N(C)CCCCCO)c1	ZINC000279741635	455872392	/nfs/dbraw/zinc/87/23/92/455872392.db2.gz	OTZCUDGYLYGKLA-SFHVURJKSA-N	0	3	345.487	3.033	20	30		EGEDHN
CN(C)CCN(Cc1ccco1)C(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000280094094	455889330	/nfs/dbraw/zinc/88/93/30/455889330.db2.gz	ZHDOZPYKNZGWIH-UHFFFAOYSA-N	0	3	339.439	3.285	20	30		EGEDHN
CN1CC[C@@H]2CCN(C(=O)Nc3ccc(C(C)(C)C#N)cc3)[C@H]2C1	ZINC000272270781	455896685	/nfs/dbraw/zinc/89/66/85/455896685.db2.gz	LLBKICZOYIYLOG-PBHICJAKSA-N	0	3	326.444	3.046	20	30		EGEDHN
CN1CC[C@@H]2CCN(C(=O)Nc3ccc(C(C)(C)C#N)cc3)[C@@H]2C1	ZINC000272270782	455896765	/nfs/dbraw/zinc/89/67/65/455896765.db2.gz	LLBKICZOYIYLOG-RHSMWYFYSA-N	0	3	326.444	3.046	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C)OCC	ZINC000270204403	455901319	/nfs/dbraw/zinc/90/13/19/455901319.db2.gz	QWGFXWCOMSWSNR-IHPCNDPISA-N	0	3	344.499	3.385	20	30		EGEDHN
N#CCc1ccc(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)cc1	ZINC000270364548	455939005	/nfs/dbraw/zinc/93/90/05/455939005.db2.gz	ZZELIEIOEYLESZ-FQEVSTJZSA-N	0	3	333.435	3.147	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)c1cc(C#N)ccc1Cl	ZINC000285910759	455939934	/nfs/dbraw/zinc/93/99/34/455939934.db2.gz	VXKPPWPWDHUMDW-AWEZNQCLSA-N	0	3	341.842	3.462	20	30		EGEDHN
CN1CCC(N(Cc2ccccc2)C(=O)c2ccc(CC#N)cc2)CC1	ZINC000270375278	455941306	/nfs/dbraw/zinc/94/13/06/455941306.db2.gz	NZBPZRGPMYWABT-UHFFFAOYSA-N	0	3	347.462	3.489	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1CNCc1c(C)nn(-c2ccccn2)c1Cl	ZINC000285932086	455944447	/nfs/dbraw/zinc/94/44/47/455944447.db2.gz	LUHARMLSYPNHRZ-PBHICJAKSA-N	0	3	346.862	3.300	20	30		EGEDHN
CCOC[C@@H](N[C@H](C)C(=O)N(CCC#N)c1ccc(F)cc1)C(C)C	ZINC000286072923	455972544	/nfs/dbraw/zinc/97/25/44/455972544.db2.gz	JQXDBMIEEQLMBJ-CRAIPNDOSA-N	0	3	349.450	3.112	20	30		EGEDHN
C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(Cc2ccc(C#N)cc2)C1	ZINC000272526500	455982785	/nfs/dbraw/zinc/98/27/85/455982785.db2.gz	QJVFSVYGSJERJE-RHSMWYFYSA-N	0	3	329.444	3.293	20	30		EGEDHN
Cc1ccc(O[C@@H](C)CNC(=O)C(C#N)Cc2ccc(C#N)cc2)cc1	ZINC000280540007	455994987	/nfs/dbraw/zinc/99/49/87/455994987.db2.gz	SXGCMKKXGRJDTL-QFBILLFUSA-N	0	3	347.418	3.133	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000280568936	456002119	/nfs/dbraw/zinc/00/21/19/456002119.db2.gz	LIAUBKHGYPLZHZ-UHFFFAOYSA-N	0	3	337.423	3.163	20	30		EGEDHN
C=C(Cl)CNC(=O)N1CC[C@@]2(CCN(Cc3ccccc3)C2)C1	ZINC000287368226	456067410	/nfs/dbraw/zinc/06/74/10/456067410.db2.gz	IQHDIQLIRVZDPC-GOSISDBHSA-N	0	3	333.863	3.047	20	30		EGEDHN
C=C(Cl)COc1ccc([C@H](C)NCC2(S(C)(=O)=O)CC2)cc1	ZINC000280908732	456078520	/nfs/dbraw/zinc/07/85/20/456078520.db2.gz	GHXHNXYADIGFQP-ZDUSSCGKSA-N	0	3	343.876	3.046	20	30		EGEDHN
CC[C@@](C)(C#N)C(=O)N1CC[C@]2(CCN(Cc3ccccc3)C2)C1	ZINC000287982239	456083517	/nfs/dbraw/zinc/08/35/17/456083517.db2.gz	AOCXUPSGWABCJC-PMACEKPBSA-N	0	3	325.456	3.051	20	30		EGEDHN
Cc1cc(C)c2ncc(C#N)c(N3CCN(c4ccncc4)CC3)c2c1	ZINC000301338559	456093931	/nfs/dbraw/zinc/09/39/31/456093931.db2.gz	HMJYVENOBRQVSO-UHFFFAOYSA-N	0	3	343.434	3.445	20	30		EGEDHN
N#CC1(C(=O)N2CC[C@]3(CCN(Cc4ccccc4)C3)C2)CCCC1	ZINC000288618860	456100418	/nfs/dbraw/zinc/10/04/18/456100418.db2.gz	ZYZVIXOWEDAEME-FQEVSTJZSA-N	0	3	337.467	3.195	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(Cc2c(F)cccc2F)C2CC2)CC1	ZINC000188691810	456115712	/nfs/dbraw/zinc/11/57/12/456115712.db2.gz	WNNXWFKBSIHVDZ-UHFFFAOYSA-N	0	3	349.425	3.289	20	30		EGEDHN
CN(C)CCN(Cc1ccco1)Cc1ccc(N(C)CCC#N)cc1	ZINC000289480458	456127679	/nfs/dbraw/zinc/12/76/79/456127679.db2.gz	QLJNQXLHUUEWOU-UHFFFAOYSA-N	0	3	340.471	3.193	20	30		EGEDHN
CN(CCC#N)c1ccc(CN2CCC(C3(C)OCCO3)CC2)cc1	ZINC000271149157	456143054	/nfs/dbraw/zinc/14/30/54/456143054.db2.gz	AAYBRZKQSHXBOJ-UHFFFAOYSA-N	0	3	343.471	3.011	20	30		EGEDHN
N#Cc1ccc(NCc2ccccc2CN2CC[C@H](O)C2)cc1Cl	ZINC000273071024	456167426	/nfs/dbraw/zinc/16/74/26/456167426.db2.gz	FONRBPSDKNLIAT-SFHVURJKSA-N	0	3	341.842	3.390	20	30		EGEDHN
C=CCc1cc(CNC[C@@H](O)CCc2ccccc2)cc(OC)c1O	ZINC000273074221	456169102	/nfs/dbraw/zinc/16/91/02/456169102.db2.gz	HSZOWMIRLGWPRG-IBGZPJMESA-N	0	3	341.451	3.213	20	30		EGEDHN
C=C(C)CN(Cc1ccccc1)C(=O)Nc1ccnn1CCN(C)C	ZINC000297296181	456176364	/nfs/dbraw/zinc/17/63/64/456176364.db2.gz	HJKPHLKTDWPVMF-UHFFFAOYSA-N	0	3	341.459	3.055	20	30		EGEDHN
C[C@@](C#N)(NC(=O)CN[C@H]1CC(C)(C)CCc2ccccc21)C1CC1	ZINC000333272924	456190077	/nfs/dbraw/zinc/19/00/77/456190077.db2.gz	HPKBLIFBJRTXRR-RXVVDRJESA-N	0	3	339.483	3.488	20	30		EGEDHN
C#CC[C@@H](NC(=O)N(C)[C@@H](C)C1CCN(C)CC1)c1ccccc1	ZINC000273406840	456229232	/nfs/dbraw/zinc/22/92/32/456229232.db2.gz	HSTKNOHVVBPXTL-QFBILLFUSA-N	0	3	327.472	3.123	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CCC([C@H]2CCCO2)CC1	ZINC000189151627	456242037	/nfs/dbraw/zinc/24/20/37/456242037.db2.gz	KLWJYEMMQINQQK-WOJBJXKFSA-N	0	3	345.483	3.046	20	30		EGEDHN
CC[C@H](CC#N)N[C@@H]1CCCC[C@H](N2C(=O)c3ccccc3C2=O)C1	ZINC000273869979	456246599	/nfs/dbraw/zinc/24/65/99/456246599.db2.gz	OGDWMOSOAMWFFJ-OAGGEKHMSA-N	0	3	339.439	3.266	20	30		EGEDHN
COc1cc(CNC[C@H](c2ccc(C)o2)N2CCCC2)ccc1C#N	ZINC000281681662	456293137	/nfs/dbraw/zinc/29/31/37/456293137.db2.gz	MIKKEEKESQNOJN-GOSISDBHSA-N	0	3	339.439	3.395	20	30		EGEDHN
CN(C)[C@H](CNc1cc(C#N)ccc1[N+](=O)[O-])c1cccc(F)c1	ZINC000302199664	456314901	/nfs/dbraw/zinc/31/49/01/456314901.db2.gz	GSRLGPFOEOGXQC-QGZVFWFLSA-N	0	3	328.347	3.320	20	30		EGEDHN
CN(C)[C@@H](CNc1nccnc1C#N)c1cccc(C(F)(F)F)c1	ZINC000302211726	456319274	/nfs/dbraw/zinc/31/92/74/456319274.db2.gz	DNZJEGRMSCONFB-AWEZNQCLSA-N	0	3	335.333	3.082	20	30		EGEDHN
CC1CCC(N2CCN(CCCC3(C#N)CCOCC3)CC2)CC1	ZINC000337191007	456336878	/nfs/dbraw/zinc/33/68/78/456336878.db2.gz	SBYWRIOBAXKBQW-UHFFFAOYSA-N	0	3	333.520	3.283	20	30		EGEDHN
C=CCc1cc(CN[C@H]2CCC[C@@H]2OC(F)F)cc(OC)c1O	ZINC000337318839	456347107	/nfs/dbraw/zinc/34/71/07/456347107.db2.gz	YOYIRWKEMZZDRF-KBPBESRZSA-N	0	3	327.371	3.379	20	30		EGEDHN
C#C[C@H](NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1)C(C)C	ZINC000298134159	456371535	/nfs/dbraw/zinc/37/15/35/456371535.db2.gz	YZBFWCCFHBUGEA-IHPCNDPISA-N	0	3	341.499	3.339	20	30		EGEDHN
C=CCOc1ccc(CN[C@H]2CCC(=O)N[C@H]2C(C)(C)C)cc1OC	ZINC000353137606	456514614	/nfs/dbraw/zinc/51/46/14/456514614.db2.gz	MDEYPWHHPADXIN-HNAYVOBHSA-N	0	3	346.471	3.043	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)N(CCN(C)C)C(C)C	ZINC000343335052	456537903	/nfs/dbraw/zinc/53/79/03/456537903.db2.gz	DGXALIZVDOXJDX-UHFFFAOYSA-N	0	3	329.469	3.494	20	30		EGEDHN
CCc1nc(C#N)cc(N(C)[C@@H]2CCCN(Cc3ccccc3)C2)n1	ZINC000308178114	456571569	/nfs/dbraw/zinc/57/15/69/456571569.db2.gz	KVPRVCZSITZOBJ-GOSISDBHSA-N	0	3	335.455	3.011	20	30		EGEDHN
CCc1nc(C#N)cc(NC[C@H]2CCCN(Cc3ccccc3)C2)n1	ZINC000308170230	456572583	/nfs/dbraw/zinc/57/25/83/456572583.db2.gz	PQMJDGZDFWFEGN-QGZVFWFLSA-N	0	3	335.455	3.235	20	30		EGEDHN
CCN1CCO[C@@H](CNCc2cc(C#N)cs2)[C@@H]1c1ccccc1	ZINC000343389992	456583257	/nfs/dbraw/zinc/58/32/57/456583257.db2.gz	CMXMSUMLKHEJAP-OALUTQOASA-N	0	3	341.480	3.171	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000276858209	456600523	/nfs/dbraw/zinc/60/05/23/456600523.db2.gz	CEPWOWUAVTZPGB-FQEVSTJZSA-N	0	3	348.462	3.387	20	30		EGEDHN
CO[C@@H]1CCCC[C@H]1N[C@H](C)C(=O)N(CCC#N)c1ccc(C)cc1	ZINC000276909773	456618249	/nfs/dbraw/zinc/61/82/49/456618249.db2.gz	FQDIENCELCGTMR-BHIYHBOVSA-N	0	3	343.471	3.177	20	30		EGEDHN
C#CCN(C(=O)N[C@H]1CCN(Cc2ccccc2)CC1(C)C)C1CC1	ZINC000282822335	456635683	/nfs/dbraw/zinc/63/56/83/456635683.db2.gz	IYBODTNSAYMXOG-IBGZPJMESA-N	0	3	339.483	3.094	20	30		EGEDHN
CC[C@H](NCCS(=O)(=O)c1ccc(C#N)cc1)C1CCCCC1	ZINC000322109430	456644131	/nfs/dbraw/zinc/64/41/31/456644131.db2.gz	UOQWTZCGRINCIS-SFHVURJKSA-N	0	3	334.485	3.280	20	30		EGEDHN
CS[C@H]1CN(c2c(C#N)cnc3c(C)cc(F)cc32)C[C@H]1N(C)C	ZINC000340753504	456667852	/nfs/dbraw/zinc/66/78/52/456667852.db2.gz	LKEMNYMULRGRFC-CVEARBPZSA-N	0	3	344.459	3.036	20	30		EGEDHN
N#Cc1ccc(S(=O)(=O)CCN[C@@H]2CCCCC23CCCC3)cc1	ZINC000326971946	456702056	/nfs/dbraw/zinc/70/20/56/456702056.db2.gz	HEMXVTWQQIDWTI-GOSISDBHSA-N	0	3	346.496	3.425	20	30		EGEDHN
CN(Cc1cccc2[nH]ccc21)C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000348504969	456719324	/nfs/dbraw/zinc/71/93/24/456719324.db2.gz	ACARAUFIVLAIIH-SFHVURJKSA-N	0	3	342.402	3.380	20	30		EGEDHN
Cc1ccc(F)c(CN(C)C(=O)C(C#N)Cc2ccc(C#N)cc2)c1	ZINC000348509910	456722858	/nfs/dbraw/zinc/72/28/58/456722858.db2.gz	NTEMHIPDMXJYAP-QGZVFWFLSA-N	0	3	335.382	3.347	20	30		EGEDHN
Cc1nc(NC(=O)[C@H](C)N[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)sc1C	ZINC000328676110	456735098	/nfs/dbraw/zinc/73/50/98/456735098.db2.gz	LEOFYWXIHXKRGW-DEQVHRJGSA-N	0	3	335.473	3.284	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2cn3c(n2)CCCC3)C1	ZINC000328730258	456747507	/nfs/dbraw/zinc/74/75/07/456747507.db2.gz	WJHNLZJEZXOGBN-WBVHZDCISA-N	0	3	338.455	3.360	20	30		EGEDHN
CC(C)[C@H](NC(=O)C1CCN(C2CC2)CC1)c1nnc2ccccn21	ZINC000328768114	456757194	/nfs/dbraw/zinc/75/71/94/456757194.db2.gz	QDXAXDSWBDMHDE-KRWDZBQOSA-N	0	3	341.459	3.257	20	30		EGEDHN
NC(=O)[C@@H]1CCCN(Cc2ccccc2NC(=O)[C@H]2CCCO2)C1	ZINC000328796341	456762674	/nfs/dbraw/zinc/76/26/74/456762674.db2.gz	URWPVCAFBMZEOB-GDBMZVCRSA-N	0	3	331.416	3.201	20	30		EGEDHN
CCc1nn(C)c(CC)c1CNC(=O)[C@H]1CCCN1C1CCCC1	ZINC000328799795	456764645	/nfs/dbraw/zinc/76/46/45/456764645.db2.gz	XWSFQNQDJKGMHF-GOSISDBHSA-N	0	3	332.492	3.408	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN[C@@H]1CC[C@H](c2ccccc2)C[C@@H]1OC	ZINC000353575569	456775780	/nfs/dbraw/zinc/77/57/80/456775780.db2.gz	OZTHLKOEZSNUDA-ZCNNSNEGSA-N	0	3	342.483	3.128	20	30		EGEDHN
CC(C)(C)c1nnc(SCC(=O)NC2CCN(C3CC3)CC2)o1	ZINC000328865153	456779853	/nfs/dbraw/zinc/77/98/53/456779853.db2.gz	NFBMLSUUEYBTSC-UHFFFAOYSA-N	0	3	338.477	3.043	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2ccc3c(c2)NC(=O)C3(C)C)CN1C1CC1	ZINC000328930412	456793234	/nfs/dbraw/zinc/79/32/34/456793234.db2.gz	ZCBSLGVJZXHENR-DGCLKSJQSA-N	0	3	327.428	3.496	20	30		EGEDHN
O=C(CN[C@@H]1CCC(=O)N[C@H]1C1CC1)Nc1nc2c(s1)CCCC2	ZINC000328930635	456793985	/nfs/dbraw/zinc/79/39/85/456793985.db2.gz	ZDDRZRKGDASOKJ-WBMJQRKESA-N	0	3	348.472	3.097	20	30		EGEDHN
Cc1cccc(C)c1NC(=O)CN1CCC[C@@H]1[C@@H]1COCC[C@]1(C)O	ZINC000328968288	456802726	/nfs/dbraw/zinc/80/27/26/456802726.db2.gz	NTAWRRWGSXOMMK-QKLQHJQFSA-N	0	3	346.471	3.143	20	30		EGEDHN
N#CCc1ccc(CN2CC[C@](CO)(Cc3ccc(F)cc3)C2)cc1	ZINC000344170166	456803079	/nfs/dbraw/zinc/80/30/79/456803079.db2.gz	QMWOZRLMYBJPLR-NRFANRHFSA-N	0	3	338.426	3.319	20	30		EGEDHN
CC(C)[C@H]1N(C[C@H](O)COc2ccc(CC#N)cc2)CC12CCC2	ZINC000292003247	456826717	/nfs/dbraw/zinc/82/67/17/456826717.db2.gz	XTJYICVRCNQNEV-PKOBYXMFSA-N	0	3	328.456	3.003	20	30		EGEDHN
CCCN1CCN(c2ccccc2CN2CCC(F)(C#N)CC2)CC1	ZINC000348719229	456827813	/nfs/dbraw/zinc/82/78/13/456827813.db2.gz	ZNEFSFDVXRETQH-UHFFFAOYSA-N	0	3	344.478	3.046	20	30		EGEDHN
C=C(C)Cn1c(C)nnc1N1CCN(Cc2ccccc2)[C@@H](CC)C1	ZINC000338813624	456861300	/nfs/dbraw/zinc/86/13/00/456861300.db2.gz	VWBJPXSNMUVIDV-IBGZPJMESA-N	0	3	339.487	3.263	20	30		EGEDHN
C[C@H](C(=O)NC1(C#N)CCCCC1)N1CC[C@H](N2CCCCC2)C1	ZINC000329265826	456864244	/nfs/dbraw/zinc/86/42/44/456864244.db2.gz	FWCGILFDBFVNIQ-SJORKVTESA-N	0	3	332.492	3.118	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2ccc(OC3CCCC3)nc2)CN1C1CC1	ZINC000329288040	456867078	/nfs/dbraw/zinc/86/70/78/456867078.db2.gz	HMOJMDMQTJGZLZ-HIFRSBDPSA-N	0	3	329.444	3.333	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)NC[C@@H](C)N2CCC[C@H](C)C2)cc1	ZINC000344909203	456870852	/nfs/dbraw/zinc/87/08/52/456870852.db2.gz	ZTZYOHYKTBVXLU-DLBZAZTESA-N	0	3	345.487	3.171	20	30		EGEDHN
CC(C)c1noc2ncc(C(=O)N[C@H](C)C3=CCN(C)CC3)cc21	ZINC000329316543	456871453	/nfs/dbraw/zinc/87/14/53/456871453.db2.gz	HNRHGYJIQMWDKT-GFCCVEGCSA-N	0	3	328.416	3.301	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)Cc2cccc(C)c2C)CC1	ZINC000292168553	456875665	/nfs/dbraw/zinc/87/56/65/456875665.db2.gz	DNKTYSFTHFOFCY-UHFFFAOYSA-N	0	3	329.488	3.485	20	30		EGEDHN
CC1(C)CN(C2(CNC(=O)C[C@H]3CCCO3)CCCCC2)CCO1	ZINC000329378713	456880879	/nfs/dbraw/zinc/88/08/79/456880879.db2.gz	MREMKRPNSGRVMK-MRXNPFEDSA-N	0	3	338.492	3.326	20	30		EGEDHN
C[C@H](C(=O)NC(=O)Nc1ccc2c(c1)OCCO2)N(C)CC1CCC1	ZINC000329392776	456884205	/nfs/dbraw/zinc/88/42/05/456884205.db2.gz	VWVNPPKZJMBYGU-GFCCVEGCSA-N	0	3	347.415	3.080	20	30		EGEDHN
C=C(C)CN1CCC(NCc2nc3ccc(OC)cc3s2)CC1	ZINC000353760867	456895051	/nfs/dbraw/zinc/89/50/51/456895051.db2.gz	RNLPDAOLSHSNGX-UHFFFAOYSA-N	0	3	331.485	3.435	20	30		EGEDHN
CCCN1CCC[C@H]1C(=O)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000349117970	456897789	/nfs/dbraw/zinc/89/77/89/456897789.db2.gz	LNXXPCOAZHVEOX-INIZCTEOSA-N	0	3	338.373	3.048	20	30		EGEDHN
Cc1nnc([C@@H]2CCCN([C@H](C)C(=O)N[C@@H]3CCC[C@H](C)[C@H]3C)C2)[nH]1	ZINC000329491993	456899803	/nfs/dbraw/zinc/89/98/03/456899803.db2.gz	VVXXVHHXOXDSSA-JYXJIEJFSA-N	0	3	347.507	3.462	20	30		EGEDHN
C[C@H](C(=O)NC12CC3CC(CC(C3)C1)C2)N1C[C@@H]2CC[C@H](O)[C@@H]2C1	ZINC000329655600	456922742	/nfs/dbraw/zinc/92/27/42/456922742.db2.gz	MHBZUHIOJMIPHO-WWMADYAFSA-N	0	3	332.488	3.003	20	30		EGEDHN
COc1ccc(CCCN(C)[C@@H](C)C(=O)N[C@@](C)(C#N)C(C)C)cc1	ZINC000345093061	456923576	/nfs/dbraw/zinc/92/35/76/456923576.db2.gz	RTVLHVUWDLAKOA-JXFKEZNVSA-N	0	3	345.487	3.003	20	30		EGEDHN
COC(=O)[C@@H]1CC12CCN(Cc1cccc(OCCCC#N)c1)CC2	ZINC000353901727	456958641	/nfs/dbraw/zinc/95/86/41/456958641.db2.gz	RTIMIIHMCANEQU-SFHVURJKSA-N	0	3	342.439	3.144	20	30		EGEDHN
CC(C)[C@@H]1CCC[C@H](NC(=O)C(C)S(=O)(=O)C2CCOCC2)C1	ZINC000330036999	456977528	/nfs/dbraw/zinc/97/75/28/456977528.db2.gz	CXPSLENZMKNXAV-KFWWJZLASA-N	0	3	345.505	3.140	20	30		EGEDHN
CCCN(Cc1nnc(-c2ccccc2Cl)o1)C(=O)C(C)C#N	ZINC000345551971	456982318	/nfs/dbraw/zinc/98/23/18/456982318.db2.gz	UQPFPLCDDAQYBA-LLVKDONJSA-N	0	3	332.791	3.288	20	30		EGEDHN
CC(C)(C)[C@@H](CN1CCc2ccccc2C1)NC(=O)NCCCC#N	ZINC000345729669	456990515	/nfs/dbraw/zinc/99/05/15/456990515.db2.gz	OQHQKQHDUMHRFJ-GOSISDBHSA-N	0	3	342.487	3.062	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1C(=O)NC[C@H]1CCCN(Cc2cccs2)C1	ZINC000345749163	456990855	/nfs/dbraw/zinc/99/08/55/456990855.db2.gz	AADCHIGHVDEHGN-NXHRZFHOSA-N	0	3	348.512	3.058	20	30		EGEDHN
C[C@@H]1CCN(C)CCN1C(=O)c1ccccc1-c1ccccc1C#N	ZINC000354009246	457005625	/nfs/dbraw/zinc/00/56/25/457005625.db2.gz	VBQWOFZDVLOVJH-MRXNPFEDSA-N	0	3	333.435	3.391	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)NC[C@@H]2CCCCO2)CCN1Cc1ccccc1	ZINC000330264593	457016388	/nfs/dbraw/zinc/01/63/88/457016388.db2.gz	YCXXZJXJODMRPI-QRQLOZEOSA-N	0	3	345.487	3.112	20	30		EGEDHN
C#CCOc1ccccc1CNCc1ccccc1-c1cnn(C)c1	ZINC000362674325	457038203	/nfs/dbraw/zinc/03/82/03/457038203.db2.gz	CWPLAPLZFKJXNS-UHFFFAOYSA-N	0	3	331.419	3.389	20	30		EGEDHN
N#C[C@@H]1CC[C@H](NCc2cnn(-c3ccc(Br)cc3)c2)C1	ZINC000349801537	457057001	/nfs/dbraw/zinc/05/70/01/457057001.db2.gz	LXZQWXJVGKIURT-DOMZBBRYSA-N	0	3	345.244	3.417	20	30		EGEDHN
CCC1(CC)[C@H](N[C@@H](C)C(=O)Nc2cccc(C#N)c2)C[C@@H]1OC	ZINC000359421344	457082791	/nfs/dbraw/zinc/08/27/91/457082791.db2.gz	KKBTTYSUWJXFHY-XKQJLSEDSA-N	0	3	329.444	3.069	20	30		EGEDHN
CCN1CCC(NC(=O)c2c(C)nc(C(C)C)nc2SC)CC1	ZINC000331046544	457124390	/nfs/dbraw/zinc/12/43/90/457124390.db2.gz	UXGASUIYHBYXFB-UHFFFAOYSA-N	0	3	336.505	3.419	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)OCC	ZINC000339452038	457124827	/nfs/dbraw/zinc/12/48/27/457124827.db2.gz	UEHRFQCFCQGSDI-OALUTQOASA-N	0	3	330.472	3.091	20	30		EGEDHN
CC(C)Cc1ccc([C@@H](CNC(=O)C2(C#N)CCC2)N(C)C)cc1	ZINC000359892557	457140020	/nfs/dbraw/zinc/14/00/20/457140020.db2.gz	ICXURMGBVFNIJZ-GOSISDBHSA-N	0	3	327.472	3.298	20	30		EGEDHN
C=CCOc1ccc(CNCCN2CCOC(C)(C)C2)cc1Cl	ZINC000356899779	457207650	/nfs/dbraw/zinc/20/76/50/457207650.db2.gz	XRTQCYFPMMXKEA-UHFFFAOYSA-N	0	3	338.879	3.105	20	30		EGEDHN
COc1cc([C@H](C)NC(=O)C(C)C#N)ccc1OCc1ccncc1	ZINC000347077757	457218788	/nfs/dbraw/zinc/21/87/88/457218788.db2.gz	UZHAOOPMXTXTHU-KGLIPLIRSA-N	0	3	339.395	3.006	20	30		EGEDHN
CC(C#N)C(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000347117406	457237678	/nfs/dbraw/zinc/23/76/78/457237678.db2.gz	UFYCHAHJZLRXIS-LLVKDONJSA-N	0	3	340.254	3.234	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2sc(C(F)(F)F)nc2C)CC1	ZINC000360175926	457289072	/nfs/dbraw/zinc/28/90/72/457289072.db2.gz	PIZQVPVXTXDLKW-UHFFFAOYSA-N	0	3	347.406	3.241	20	30		EGEDHN
C[C@H](c1ccc(N2CCCS2(=O)=O)cc1)N(C)CCC(C)(C)C#N	ZINC000347242990	457307058	/nfs/dbraw/zinc/30/70/58/457307058.db2.gz	YFBJRUBNAMANPD-OAHLLOKOSA-N	0	3	349.500	3.159	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C2CC(c3cccc(F)c3)C2)CC1	ZINC000363390405	457309334	/nfs/dbraw/zinc/30/93/34/457309334.db2.gz	JZQCKEVLCDGUFB-UHFFFAOYSA-N	0	3	330.447	3.476	20	30		EGEDHN
C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H]1CCCN(C)[C@@H]1C	ZINC000355079953	457339517	/nfs/dbraw/zinc/33/95/17/457339517.db2.gz	JXWWEWPUDDGQFC-AEFFLSMTSA-N	0	3	347.507	3.034	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN1CCC[C@@](C)(c2ccccc2)CC1	ZINC000352204547	457347312	/nfs/dbraw/zinc/34/73/12/457347312.db2.gz	XYUPODIFJOYYOH-GHTZIAJQSA-N	0	3	341.499	3.438	20	30		EGEDHN
COc1ccccc1NC(=O)C1CCN([C@H]2CC[C@H](C#N)C2)CC1	ZINC000332330330	457351037	/nfs/dbraw/zinc/35/10/37/457351037.db2.gz	SIJCNXFTNIWPEM-HOCLYGCPSA-N	0	3	327.428	3.038	20	30		EGEDHN
C=CCSCCNC(=O)N[C@H](C)[C@@H](c1ccccc1C)N(C)C	ZINC000352254168	457352465	/nfs/dbraw/zinc/35/24/65/457352465.db2.gz	YWWGDKFYYYSQBV-WBVHZDCISA-N	0	3	335.517	3.205	20	30		EGEDHN
CC(=O)Nc1c[nH]nc1[C@H]1CCCN([C@H](C)c2cccc(C#N)c2)C1	ZINC000332366007	457356475	/nfs/dbraw/zinc/35/64/75/457356475.db2.gz	VWLRIEQMPZWUTR-DYVFJYSZSA-N	0	3	337.427	3.180	20	30		EGEDHN
COC[C@@H]1CCCCN([C@@H](C)C(=O)N(CCC#N)c2ccccc2)C1	ZINC000342575361	457373696	/nfs/dbraw/zinc/37/36/96/457373696.db2.gz	XVOBBJIQNZICOR-ZWKOTPCHSA-N	0	3	343.471	3.070	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@@H](C)N(C)CC[C@H]1CCCO1	ZINC000342596300	457390043	/nfs/dbraw/zinc/39/00/43/457390043.db2.gz	QMPDIUDNHAEIFK-HZPDHXFCSA-N	0	3	336.501	3.152	20	30		EGEDHN
Cc1oc(Br)cc1C(=O)C(C#N)c1cc(C)nc(C)n1	ZINC000425279031	457481003	/nfs/dbraw/zinc/48/10/03/457481003.db2.gz	ZTYDMVRXFRHLIV-NSHDSACASA-N	0	3	334.173	3.247	20	30		EGEDHN
C=CCOc1cccc(CN2CCC[C@@H]2C[C@H](O)c2cnn(C)c2)c1	ZINC000374254941	457547375	/nfs/dbraw/zinc/54/73/75/457547375.db2.gz	HCQHHYSADJINSQ-QUCCMNQESA-N	0	3	341.455	3.073	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@@H](C)N[C@@H](C)c1ccc(OC)c(OC)c1C	ZINC000347638436	457567325	/nfs/dbraw/zinc/56/73/25/457567325.db2.gz	JNQQARGRIGZTLD-JKSUJKDBSA-N	0	3	346.471	3.252	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN[C@H](C)c1cncc(F)c1	ZINC000361132627	457601742	/nfs/dbraw/zinc/60/17/42/457601742.db2.gz	QXIWXDJXQPFFTI-KDOFPFPSSA-N	0	3	330.403	3.040	20	30		EGEDHN
C=CCOc1cccc(CN[C@@H]2CC(=O)N(c3ccccc3F)C2)c1	ZINC000361251431	457666881	/nfs/dbraw/zinc/66/68/81/457666881.db2.gz	NNTVTZIRLHPMIQ-MRXNPFEDSA-N	0	3	340.398	3.286	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC[C@](F)(c3ccccc3F)C2)CC1	ZINC000374685408	457687456	/nfs/dbraw/zinc/68/74/56/457687456.db2.gz	IJMARAASMBTLDZ-LJQANCHMSA-N	0	3	349.425	3.056	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(N(C)CC(C)C)cc2)CC1	ZINC000357819328	457701325	/nfs/dbraw/zinc/70/13/25/457701325.db2.gz	LUIHWHOHRNDUJJ-UHFFFAOYSA-N	0	3	329.488	3.159	20	30		EGEDHN
COc1ccc(CN2CCC[C@@H](OC)CC2)cc1OCCCC#N	ZINC000370708737	457703511	/nfs/dbraw/zinc/70/35/11/457703511.db2.gz	QNAWAKUOXIHVIT-QGZVFWFLSA-N	0	3	332.444	3.379	20	30		EGEDHN
COc1ccc(CNC(=O)C(C#N)CCc2ccccc2)cc1F	ZINC000433220366	457782254	/nfs/dbraw/zinc/78/22/54/457782254.db2.gz	KQACPBVEEVBPEF-INIZCTEOSA-N	0	3	326.371	3.223	20	30		EGEDHN
COc1ccc(CN2CC[C@H](C)C[C@H]2[C@@H](C)O)cc1OCCCC#N	ZINC000443783628	457810439	/nfs/dbraw/zinc/81/04/39/457810439.db2.gz	DIDYYXXVQSAYTP-JZXOWHBKSA-N	0	3	346.471	3.359	20	30		EGEDHN
C[C@@H]1CN(C[C@@H]2CCCN2CCC2(C#N)CCCCC2)C[C@@H](C)O1	ZINC000411193188	457824854	/nfs/dbraw/zinc/82/48/54/457824854.db2.gz	DWGLMIKXVVRMRP-QRVBRYPASA-N	0	3	333.520	3.424	20	30		EGEDHN
C[C@@H]1CN(C[C@H]2CCCN2CCC2(C#N)CCCCC2)C[C@H](C)O1	ZINC000411193182	457825127	/nfs/dbraw/zinc/82/51/27/457825127.db2.gz	DWGLMIKXVVRMRP-CEXWTWQISA-N	0	3	333.520	3.424	20	30		EGEDHN
Cc1noc(C)c1[C@H](C)CNC(=O)C(C#N)CCc1ccccc1	ZINC000433378974	457825389	/nfs/dbraw/zinc/82/53/89/457825389.db2.gz	WRHGBXIKCVTTFB-DYVFJYSZSA-N	0	3	325.412	3.284	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N[C@@H](CCO)C1CCCCC1	ZINC000433382356	457825872	/nfs/dbraw/zinc/82/58/72/457825872.db2.gz	CVOURNQTVZJOGL-MOPGFXCFSA-N	0	3	328.456	3.206	20	30		EGEDHN
N#CC1(CCN2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)CCCCC1	ZINC000411371962	457867516	/nfs/dbraw/zinc/86/75/16/457867516.db2.gz	BJRJFCQYGHPKKH-OAHLLOKOSA-N	0	3	343.431	3.340	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1noc2c1C[C@@H](C)CC2)C(C)C	ZINC000433791370	457887403	/nfs/dbraw/zinc/88/74/03/457887403.db2.gz	CMSHGIJBEHTRDL-RDJZCZTQSA-N	0	3	345.487	3.228	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NC[C@]1(CO)C[C@H]1c1ccccc1	ZINC000426743056	457892085	/nfs/dbraw/zinc/89/20/85/457892085.db2.gz	MQFKUILXOKBABP-ONTIZHBOSA-N	0	3	348.446	3.041	20	30		EGEDHN
N#CC(=C([O-])c1ccnn1-c1ccccc1)c1cnc2ccccc2n1	ZINC000361842387	457901289	/nfs/dbraw/zinc/90/12/89/457901289.db2.gz	KZLWRCHSIFUZEU-OAHLLOKOSA-N	0	3	339.358	3.306	20	30		EGEDHN
N#CC(C(=O)c1ccnn1-c1ccccc1)c1cnc2ccccc2n1	ZINC000361842387	457901297	/nfs/dbraw/zinc/90/12/97/457901297.db2.gz	KZLWRCHSIFUZEU-OAHLLOKOSA-N	0	3	339.358	3.306	20	30		EGEDHN
C[C@H]1C[C@H](c2cccnc2)N(CCC(=O)Nc2cccc(C#N)c2)C1	ZINC000411523133	457911185	/nfs/dbraw/zinc/91/11/85/457911185.db2.gz	GPHLBTQBPNMIBI-HNAYVOBHSA-N	0	3	334.423	3.365	20	30		EGEDHN
C=CCOc1ccc(CN[C@H]2CCCO[C@@H]2c2cnn(CC)c2)cc1	ZINC000433929080	457915304	/nfs/dbraw/zinc/91/53/04/457915304.db2.gz	CBOWDFZGBFPFTA-VQTJNVASSA-N	0	3	341.455	3.478	20	30		EGEDHN
C=CCN(C)CCN(CC)[C@@H](C)C(=O)Nc1cccc(SC)c1	ZINC000411640644	457936220	/nfs/dbraw/zinc/93/62/20/457936220.db2.gz	KYNYOOFDRDBVDQ-HNNXBMFYSA-N	0	3	335.517	3.175	20	30		EGEDHN
CC(C)(C)OC(=O)CN[C@]1(C)CCN(CCC2(C#N)CCCCC2)C1	ZINC000411668178	457945054	/nfs/dbraw/zinc/94/50/54/457945054.db2.gz	CSQUVJAWFWSQNH-LJQANCHMSA-N	0	3	349.519	3.246	20	30		EGEDHN
CN(CCn1cc(Br)cn1)CCC1(C#N)CCCCC1	ZINC000411749353	457971572	/nfs/dbraw/zinc/97/15/72/457971572.db2.gz	LJOLNGOAUZPQPV-UHFFFAOYSA-N	0	3	339.281	3.442	20	30		EGEDHN
C[C@@H](NC(=O)NCCN1CCCC(C)(C)C1)c1ccc(C#N)cc1	ZINC000444980120	458002418	/nfs/dbraw/zinc/00/24/18/458002418.db2.gz	AOXJWEYKQVGKSM-OAHLLOKOSA-N	0	3	328.460	3.040	20	30		EGEDHN
C=C(C)COc1cc(CN2CC[C@H](c3nccn3C)C2)ccc1OC	ZINC000368137165	458013726	/nfs/dbraw/zinc/01/37/26/458013726.db2.gz	XXTCKWMZGHFQSK-KRWDZBQOSA-N	0	3	341.455	3.373	20	30		EGEDHN
C[C@@H]1CN(Cc2cccc(OCc3ccccc3C#N)c2)CC[C@@H]1O	ZINC000428461746	458150362	/nfs/dbraw/zinc/15/03/62/458150362.db2.gz	JCYYKOAEDRVMJF-IERDGZPVSA-N	0	3	336.435	3.340	20	30		EGEDHN
Cc1ccccc1[C@H]([C@@H](C)NC(=O)NCC(C)(C)CC#N)N(C)C	ZINC000458766064	458164222	/nfs/dbraw/zinc/16/42/22/458164222.db2.gz	KAMSIQIAIXNANG-WBVHZDCISA-N	0	3	330.476	3.225	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1CNCc1cc(O)ccc1Br	ZINC000435742307	458194178	/nfs/dbraw/zinc/19/41/78/458194178.db2.gz	NCFIKUUSAIWQSW-NHYWBVRUSA-N	0	3	326.234	3.226	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)N[C@@H](CN(C)Cc1ccccc1)C(C)C	ZINC000436100586	458252736	/nfs/dbraw/zinc/25/27/36/458252736.db2.gz	NIAPSSLKFWVSLM-IBGZPJMESA-N	0	3	339.439	3.346	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1S[C@H](C)CCC#N	ZINC000412991795	458290195	/nfs/dbraw/zinc/29/01/95/458290195.db2.gz	SLZGZNQSFJNFNA-OAHLLOKOSA-N	0	3	333.505	3.277	20	30		EGEDHN
C=CCOc1ccc(CN2CCC[C@@](C)(C(=O)OC)C2)cc1OC	ZINC000414555646	458324553	/nfs/dbraw/zinc/32/45/53/458324553.db2.gz	ISDOFHTWJSMMHB-LJQANCHMSA-N	0	3	333.428	3.035	20	30		EGEDHN
C=CCOc1cccc(NC(=O)NC[C@@H]2NCCc3ccccc32)c1	ZINC000415011707	458326404	/nfs/dbraw/zinc/32/64/04/458326404.db2.gz	HYIKDRWILZTVRC-IBGZPJMESA-N	0	3	337.423	3.260	20	30		EGEDHN
CC1(C)CN(Cc2cccc(OCc3ccccc3C#N)c2)C[C@@H]1O	ZINC000448365039	458400612	/nfs/dbraw/zinc/40/06/12/458400612.db2.gz	HHNKBXGWJAHXEY-FQEVSTJZSA-N	0	3	336.435	3.340	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)CN1CC[C@H](c2ccccc2)C1(C)C	ZINC000421010938	458406073	/nfs/dbraw/zinc/40/60/73/458406073.db2.gz	CZUISYHBARMOPJ-YLJYHZDGSA-N	0	3	327.472	3.309	20	30		EGEDHN
N#CCCN(C(=O)CN1CC[C@H](C2CCCC2)C1)c1ccccc1	ZINC000420966486	458406469	/nfs/dbraw/zinc/40/64/69/458406469.db2.gz	VHROLEURDOVLJI-SFHVURJKSA-N	0	3	325.456	3.445	20	30		EGEDHN
COc1cccc(N2CC[C@H](NCc3ccc(C#N)c(F)c3)C2)c1	ZINC000421322072	458410699	/nfs/dbraw/zinc/41/06/99/458410699.db2.gz	FOGWRIYMERWOFY-INIZCTEOSA-N	0	3	325.387	3.074	20	30		EGEDHN
CN(C[C@@H]1CCCN1C)C(=O)c1cn(CCCC#N)c2ccccc12	ZINC000422046503	458425014	/nfs/dbraw/zinc/42/50/14/458425014.db2.gz	ZXEJZWCJLCANKO-INIZCTEOSA-N	0	3	338.455	3.111	20	30		EGEDHN
CC#CCCCC(=O)NCC1CCN(Cc2ccccc2F)CC1	ZINC000376947408	458427211	/nfs/dbraw/zinc/42/72/11/458427211.db2.gz	HJXZVSQHMRKITQ-UHFFFAOYSA-N	0	3	330.447	3.348	20	30		EGEDHN
COC(=O)[C@@H]1CN(Cc2ccc(C#N)c(C)c2)C[C@@H]1c1ccccc1	ZINC000449752069	458431147	/nfs/dbraw/zinc/43/11/47/458431147.db2.gz	AXHNZFYHCTUYOH-WOJBJXKFSA-N	0	3	334.419	3.255	20	30		EGEDHN
C=CCC1(C(=O)Nc2ccc(OC[C@@H](O)CN(C)C)cc2)CCCC1	ZINC000450132444	458440753	/nfs/dbraw/zinc/44/07/53/458440753.db2.gz	IEPRRVXFWNTQDB-KRWDZBQOSA-N	0	3	346.471	3.063	20	30		EGEDHN
C[C@H]1CCC[C@H](C)N1CCNC(=O)c1cccc(SCC#N)c1	ZINC000430692853	458481219	/nfs/dbraw/zinc/48/12/19/458481219.db2.gz	WRFJERKPDWEXBP-GJZGRUSLSA-N	0	3	331.485	3.295	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCC(=O)N[C@@H](C)c1ccc(Cl)c(Cl)c1	ZINC000451599172	458482556	/nfs/dbraw/zinc/48/25/56/458482556.db2.gz	NMCWYHSHAPYCAY-VQISRLSMSA-N	0	3	343.254	3.104	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1N[C@@H]1CCN(c2ccc(Cl)cc2Cl)C1=O	ZINC000451606140	458483478	/nfs/dbraw/zinc/48/34/78/458483478.db2.gz	HBZDMQKFYSPJBJ-NFAWXSAZSA-N	0	3	341.238	3.032	20	30		EGEDHN
CC[C@H](C)N[C@@H](CNC(=O)[C@]1(C#N)CC12CCCC2)c1ccco1	ZINC000451670464	458484347	/nfs/dbraw/zinc/48/43/47/458484347.db2.gz	CTPMOKHWPAUOFU-YZVOILCLSA-N	0	3	329.444	3.299	20	30		EGEDHN
CCCCN(CC(=O)N[C@@](C)(C#N)C(C)C)[C@@H]1CCCC[C@H]1OC	ZINC000451652725	458484438	/nfs/dbraw/zinc/48/44/38/458484438.db2.gz	QNLZKAKCFMGXCF-LMMKCTJWSA-N	0	3	337.508	3.101	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN1CCN([C@@H](C)CC)CC1	ZINC000451821834	458488690	/nfs/dbraw/zinc/48/86/90/458488690.db2.gz	ICSBYIZBWCRMMI-INIZCTEOSA-N	0	3	347.528	3.319	20	30		EGEDHN
C=CCC[C@@H](CO)N[C@H]1CCc2c1c(Br)ccc2F	ZINC000453338989	458524616	/nfs/dbraw/zinc/52/46/16/458524616.db2.gz	CTFLNNOGTDECBI-HZMBPMFUSA-N	0	3	328.225	3.492	20	30		EGEDHN
C=CCn1c(CC(C)(C)C)nnc1N1CCN([C@@H]2C[C@H]2C)C[C@H](C)C1	ZINC000453428104	458528871	/nfs/dbraw/zinc/52/88/71/458528871.db2.gz	ZMXOYCZSGYAHKB-GVDBMIGSSA-N	0	3	345.535	3.219	20	30		EGEDHN
CC(C)[C@H](CN[C@@H](C(N)=O)c1ccc(C#N)cc1)Cc1ccccc1	ZINC000468851459	458539589	/nfs/dbraw/zinc/53/95/89/458539589.db2.gz	DMGKBMFBDRLBHJ-VQTJNVASSA-N	0	3	335.451	3.189	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N(Cc1cccs1)Cc1cccs1	ZINC000424067173	458548820	/nfs/dbraw/zinc/54/88/20/458548820.db2.gz	OQLDWIUVYHTYQJ-HNNXBMFYSA-N	0	3	333.482	3.360	20	30		EGEDHN
COc1ccc(N(Cc2cccs2)C(=O)[C@H](N)CCCC#N)cc1	ZINC000424071300	458550465	/nfs/dbraw/zinc/55/04/65/458550465.db2.gz	ZMPARMOBSJVCDA-QGZVFWFLSA-N	0	3	343.452	3.311	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N(CCc1ccccc1)Cc1ccccc1	ZINC000424082130	458554348	/nfs/dbraw/zinc/55/43/48/458554348.db2.gz	VUTNWNKNDNSPAK-HXUWFJFHSA-N	0	3	335.451	3.279	20	30		EGEDHN
CCc1ccc(-c2csc(NC(=O)[C@@H](N)CCCC#N)n2)cc1	ZINC000424083420	458554512	/nfs/dbraw/zinc/55/45/12/458554512.db2.gz	XKBSPIFVPBLAQP-AWEZNQCLSA-N	0	3	328.441	3.332	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N(CCc1ccccc1F)C1CCCC1	ZINC000424092149	458556795	/nfs/dbraw/zinc/55/67/95/458556795.db2.gz	GCJDIHSHLDIWGM-GOSISDBHSA-N	0	3	331.435	3.161	20	30		EGEDHN
Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)[C@@H](N)CCCC#N	ZINC000424106654	458559787	/nfs/dbraw/zinc/55/97/87/458559787.db2.gz	SQGYGSCEHPURCX-WFASDCNBSA-N	0	3	342.468	3.317	20	30		EGEDHN
CCCN(C(=O)[C@H](N)CCCC#N)[C@@H]1C[C@@H](OCC)C12CCCCC2	ZINC000424134209	458566789	/nfs/dbraw/zinc/56/67/89/458566789.db2.gz	YBWRLDYFOVYFEP-KZNAEPCWSA-N	0	3	349.519	3.374	20	30		EGEDHN
CC(C)C[C@@H](CN1CCCC1)NC(=O)NCc1cc(C#N)ccc1F	ZINC000454564416	458567163	/nfs/dbraw/zinc/56/71/63/458567163.db2.gz	IEEPSZBUUMADQV-KRWDZBQOSA-N	0	3	346.450	3.007	20	30		EGEDHN
C[C@@H](NCCNC(=O)CCCc1ccccc1)c1ccc(C#N)cc1	ZINC000424146497	458570305	/nfs/dbraw/zinc/57/03/05/458570305.db2.gz	WLMBFRBPXHCHEK-QGZVFWFLSA-N	0	3	335.451	3.348	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1	ZINC000424170049	458575956	/nfs/dbraw/zinc/57/59/56/458575956.db2.gz	KMBPRVVZUBIMNE-HUUCEWRRSA-N	0	3	339.361	3.294	20	30		EGEDHN
CC(C)[C@H](NC(=O)[C@H](N)CCCC#N)c1ccc(Cl)cc1F	ZINC000424169759	458576343	/nfs/dbraw/zinc/57/63/43/458576343.db2.gz	KFAHMRGXGRJJKT-CABCVRRESA-N	0	3	325.815	3.314	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N(Cc1cccc(-c2cccnc2)c1)C1CC1	ZINC000424178893	458579249	/nfs/dbraw/zinc/57/92/49/458579249.db2.gz	XUPXYDWEAOLEHX-HXUWFJFHSA-N	0	3	348.450	3.261	20	30		EGEDHN
C=CCCCCCN(C)C(=O)CCN1CCN(c2ccccc2)CC1	ZINC000469681123	458584390	/nfs/dbraw/zinc/58/43/90/458584390.db2.gz	CZMIVGUVDMMWQT-UHFFFAOYSA-N	0	3	343.515	3.404	20	30		EGEDHN
C[C@@H]1CC=C(C(=O)N(CCN(C)C)Cc2cccc(C#N)c2)CC1	ZINC000455125006	458585781	/nfs/dbraw/zinc/58/57/81/458585781.db2.gz	DMVMPYUMUWIPAX-MRXNPFEDSA-N	0	3	325.456	3.195	20	30		EGEDHN
C[C@@H](CNC(=O)[C@@H](C)c1cccc(C#N)c1)N(C)Cc1ccccc1	ZINC000462055985	458590463	/nfs/dbraw/zinc/59/04/63/458590463.db2.gz	JNFHBRHIQSVNQL-IRXDYDNUSA-N	0	3	335.451	3.298	20	30		EGEDHN
C=CCn1cc(CN[C@H]2CCCC[C@@H]2c2ccc(OC)c(F)c2)nn1	ZINC000424297269	458607413	/nfs/dbraw/zinc/60/74/13/458607413.db2.gz	QBFWLIKLHBTNAV-AEFFLSMTSA-N	0	3	344.434	3.428	20	30		EGEDHN
C[C@H]1C[C@H](N2CCCC2)CN1C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000455728884	458609748	/nfs/dbraw/zinc/60/97/48/458609748.db2.gz	IEKHXYSNUFAWBA-ZFWWWQNUSA-N	0	3	346.862	3.497	20	30		EGEDHN
C[C@@H]1C[C@@H](CNC(=O)OC(C)(C)C)CN1Cc1cccc(C#N)c1	ZINC000493988826	458611242	/nfs/dbraw/zinc/61/12/42/458611242.db2.gz	LOYVTGZAZQBDDI-PBHICJAKSA-N	0	3	329.444	3.293	20	30		EGEDHN
CO[C@@](C)(CNC(=O)C(C#N)CCc1ccccc1)c1ccccc1	ZINC000456139139	458633074	/nfs/dbraw/zinc/63/30/74/458633074.db2.gz	ZFRONGTZZKPSAB-RXVVDRJESA-N	0	3	336.435	3.437	20	30		EGEDHN
CO[C@](C)(CNC(=O)C(C#N)CCc1ccccc1)c1ccccc1	ZINC000456139137	458633224	/nfs/dbraw/zinc/63/32/24/458633224.db2.gz	ZFRONGTZZKPSAB-GHTZIAJQSA-N	0	3	336.435	3.437	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N1CCN(Cc2ccccc2)C[C@H](C)C1	ZINC000456353127	458643520	/nfs/dbraw/zinc/64/35/20/458643520.db2.gz	ZEUGNHFWNBFZPM-KRWDZBQOSA-N	0	3	347.462	3.461	20	30		EGEDHN
Cc1cc(N(CCC#N)C(=O)CN[C@]2(C)CCO[C@@H]2C)ccc1Cl	ZINC000494257522	458648818	/nfs/dbraw/zinc/64/88/18/458648818.db2.gz	RPVIICOIZUIDLT-RDTXWAMCSA-N	0	3	349.862	3.052	20	30		EGEDHN
C=CCN(CCc1ccccc1)C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000470869789	458657680	/nfs/dbraw/zinc/65/76/80/458657680.db2.gz	KSKANMWCHXDRMY-OAQYLSRUSA-N	0	3	343.430	3.498	20	30		EGEDHN
C=CC1CCN(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)CC1	ZINC000463006006	458670159	/nfs/dbraw/zinc/67/01/59/458670159.db2.gz	FKFSSRUDNOYWSZ-QFBILLFUSA-N	0	3	327.472	3.115	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000424761163	458725967	/nfs/dbraw/zinc/72/59/67/458725967.db2.gz	WEQJPBSPGKCLMS-UHFFFAOYSA-N	0	3	344.499	3.422	20	30		EGEDHN
C=CCn1c(CC(C)C)nnc1N1CCN(C2CCCCC2)CC1	ZINC000508930491	458767770	/nfs/dbraw/zinc/76/77/70/458767770.db2.gz	LVCWWIOANJZXBG-UHFFFAOYSA-N	0	3	331.508	3.117	20	30		EGEDHN
C=CCSCCNC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1	ZINC000509166521	458770739	/nfs/dbraw/zinc/77/07/39/458770739.db2.gz	MEJMGQPMLHGJKC-QGZVFWFLSA-N	0	3	347.528	3.212	20	30		EGEDHN
C=CCC[C@@H](CC)[NH2+]CC[N-]S(=O)(=O)c1ccc(F)cc1Cl	ZINC000511027183	458777702	/nfs/dbraw/zinc/77/77/02/458777702.db2.gz	IKBJWVIHMPNNGB-CYBMUJFWSA-N	0	3	348.871	3.092	20	30		EGEDHN
CCN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)NCC(C)(C)C#N	ZINC000512793440	458788233	/nfs/dbraw/zinc/78/82/33/458788233.db2.gz	UPKZUUWLVMZTSW-GOSISDBHSA-N	0	3	342.487	3.090	20	30		EGEDHN
C[C@H]1[C@H](Cc2ccccc2)CCN1CC(=O)Nc1ccc(C#N)cc1	ZINC000472350415	458788765	/nfs/dbraw/zinc/78/87/65/458788765.db2.gz	UAODGLPSEBJCBQ-LPHOPBHVSA-N	0	3	333.435	3.450	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNCc1cn2cc(C)ccc2n1)C(C)C	ZINC000515168134	458806507	/nfs/dbraw/zinc/80/65/07/458806507.db2.gz	DUBSUCNRSZFPOO-IBGZPJMESA-N	0	3	326.488	3.431	20	30		EGEDHN
CN1CCC[C@H](CNC(=O)N[C@@H]2CC[C@H](C#N)C2)[C@@H]1c1cccs1	ZINC000515469287	458809566	/nfs/dbraw/zinc/80/95/66/458809566.db2.gz	YWBKEZZEOIQAPT-KLZNWCGWSA-N	0	3	346.500	3.122	20	30		EGEDHN
CC(C)(C)OC(=O)CN[C@]1(C)CCN(CCCCC(C)(C)C#N)C1	ZINC000440514740	458821482	/nfs/dbraw/zinc/82/14/82/458821482.db2.gz	XWQNNKJDTWAHJW-LJQANCHMSA-N	0	3	337.508	3.102	20	30		EGEDHN
C=C(C)CN1CCC(Nc2cc(C)c([N+](=O)[O-])cc2C(=O)OC)CC1	ZINC000553409310	458895115	/nfs/dbraw/zinc/89/51/15/458895115.db2.gz	UXEHXSXVIBOQTQ-UHFFFAOYSA-N	0	3	347.415	3.142	20	30		EGEDHN
N#CCC[C@@H](NC[C@H](O)COc1ccc(CC#N)cc1)c1ccccc1	ZINC000553385951	458895288	/nfs/dbraw/zinc/89/52/88/458895288.db2.gz	IULOHXCMHJXJDU-PZJWPPBQSA-N	0	3	349.434	3.127	20	30		EGEDHN
C[C@@H](C(=O)N(C)CCC#N)N1CCC[C@H](CCCc2ccccc2)C1	ZINC000441215019	458901889	/nfs/dbraw/zinc/90/18/89/458901889.db2.gz	ZGXZGMBOYCSJMC-ICSRJNTNSA-N	0	3	341.499	3.482	20	30		EGEDHN
CC(C)O[C@@H]1CCN(CCC(=O)Nc2ccc(C#N)c(Cl)c2)C1	ZINC000519148685	458920567	/nfs/dbraw/zinc/92/05/67/458920567.db2.gz	NGEQSFHJPOHIMT-OAHLLOKOSA-N	0	3	335.835	3.040	20	30		EGEDHN
CCN(CCC#N)C(=O)CN(C)[C@@H]1CCC[C@H]1c1ccc(C)cc1	ZINC000441339772	458922679	/nfs/dbraw/zinc/92/26/79/458922679.db2.gz	IEJLQFIFQJTLIO-RBUKOAKNSA-N	0	3	327.472	3.325	20	30		EGEDHN
CC1CC(C#N)(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)C1	ZINC000531569176	458937954	/nfs/dbraw/zinc/93/79/54/458937954.db2.gz	UOVSDVFVADWABF-ULRHQZHYSA-N	0	3	339.483	3.438	20	30		EGEDHN
C=CCOCCCN1CCN(c2cccc(Br)c2)CC1	ZINC000556505402	458966631	/nfs/dbraw/zinc/96/66/31/458966631.db2.gz	GXMBYOGWJHDRNX-UHFFFAOYSA-N	0	3	339.277	3.164	20	30		EGEDHN
C[C@H]1C[C@@H](Nc2c(C#N)cnc3c(F)ccc(Cl)c32)CN1C1CC1	ZINC000566652541	458976199	/nfs/dbraw/zinc/97/61/99/458976199.db2.gz	QWFNBUCCYUYICK-CMPLNLGQSA-N	0	3	344.821	3.358	20	30		EGEDHN
CC(C)Sc1ccc([C@@H](C)NC[C@H](O)CN(C)CCC#N)cc1	ZINC000577097636	458979736	/nfs/dbraw/zinc/97/97/36/458979736.db2.gz	GHXNLRVJKUTZIS-WBVHZDCISA-N	0	3	335.517	3.044	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cc(Cl)cc(F)c2F)CC1	ZINC000442188841	458996693	/nfs/dbraw/zinc/99/66/93/458996693.db2.gz	ATYWRYFYNIMUJQ-UHFFFAOYSA-N	0	3	329.778	3.390	20	30		EGEDHN
CN(CCCOc1cccc(C#N)c1)CCOc1ccccc1F	ZINC000477155287	459033877	/nfs/dbraw/zinc/03/38/77/459033877.db2.gz	CSAZVQSMRKBWSZ-UHFFFAOYSA-N	0	3	328.387	3.477	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N[C@@H]1CCCN(C)[C@@H]1C)c1ccc(F)c(F)c1	ZINC000477195711	459034911	/nfs/dbraw/zinc/03/49/11/459034911.db2.gz	VXXZIZFHMQFWBO-JLZZUVOBSA-N	0	3	337.414	3.364	20	30		EGEDHN
COc1cc(CN(Cc2ccccc2)[C@@H](CO)C2CC2)ccc1C#N	ZINC000442849420	459046003	/nfs/dbraw/zinc/04/60/03/459046003.db2.gz	GYRLRKIUEJHJPY-FQEVSTJZSA-N	0	3	336.435	3.340	20	30		EGEDHN
N#C[C@@H]1CC[C@@H](N[C@@H](Cc2ccccc2)C(=O)NCc2ccccc2)C1	ZINC000442865237	459047010	/nfs/dbraw/zinc/04/70/10/459047010.db2.gz	SVIFTWMZLXUSGQ-NJYVYQBISA-N	0	3	347.462	3.196	20	30		EGEDHN
N#CCC1CCN(C(=O)N[C@@H](CN)c2ccc3ccccc3c2)CC1	ZINC000557223411	459058894	/nfs/dbraw/zinc/05/88/94/459058894.db2.gz	MIQQQZNSTKEMJL-IBGZPJMESA-N	0	3	336.439	3.175	20	30		EGEDHN
CC1CC(C#N)(C(=O)N2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)C1	ZINC000557612905	459091157	/nfs/dbraw/zinc/09/11/57/459091157.db2.gz	HNKLLRCDPSABAB-TWMPVWRBSA-N	0	3	337.467	3.051	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H](CCNCc2ccc(C#N)c(F)c2)C1	ZINC000496161611	459092308	/nfs/dbraw/zinc/09/23/08/459092308.db2.gz	ODGYSUVWPIHCIQ-AWEZNQCLSA-N	0	3	347.434	3.434	20	30		EGEDHN
C[C@H](C(=O)N[C@@H]1CCCc2cc(C#N)ccc21)N1CCCCCC1	ZINC000520766500	459092867	/nfs/dbraw/zinc/09/28/67/459092867.db2.gz	DAUVESNLTJXVNK-DNVCBOLYSA-N	0	3	325.456	3.316	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CC2(CCOCC2)[C@H]1C1CC1	ZINC000520871299	459101652	/nfs/dbraw/zinc/10/16/52/459101652.db2.gz	FNAMHZVHCCPRCI-RTBURBONSA-N	0	3	338.451	3.177	20	30		EGEDHN
COc1ccc([C@@H](CCC#N)NCCC(=O)Nc2ccccn2)cc1	ZINC000567461541	459108836	/nfs/dbraw/zinc/10/88/36/459108836.db2.gz	HDZCKVPNDMERGQ-QGZVFWFLSA-N	0	3	338.411	3.053	20	30		EGEDHN
C[C@H](O)CN(Cc1cccc(OCc2ccccc2C#N)c1)C1CC1	ZINC000594613851	459114464	/nfs/dbraw/zinc/11/44/64/459114464.db2.gz	FDXUNGZBEOAGDT-INIZCTEOSA-N	0	3	336.435	3.482	20	30		EGEDHN
C=CCN(CCc1ccccc1)C[C@@H](O)COc1ccccc1F	ZINC000521066093	459117445	/nfs/dbraw/zinc/11/74/45/459117445.db2.gz	RCWOXFZCHQLVBI-GOSISDBHSA-N	0	3	329.415	3.296	20	30		EGEDHN
CC(C#N)C(=O)N[C@H](Cc1cccc(Br)c1)CC1CC1	ZINC000479266832	459130415	/nfs/dbraw/zinc/13/04/15/459130415.db2.gz	OQXUKKVHTMBNAF-ABAIWWIYSA-N	0	3	335.245	3.436	20	30		EGEDHN
COC[C@@H](C)Oc1ccc(CNCc2ccc(C#N)c(F)c2)cc1	ZINC000594952257	459190315	/nfs/dbraw/zinc/19/03/15/459190315.db2.gz	FMRYRLUSVNQYCN-CQSZACIVSA-N	0	3	328.387	3.401	20	30		EGEDHN
C[C@@H](N[C@@H](c1ccc(F)c(Cl)c1)C1CC1)C(=O)NC1(C#N)CCC1	ZINC000590751376	459203733	/nfs/dbraw/zinc/20/37/33/459203733.db2.gz	VCRDCXXJWUIFMV-BDJLRTHQSA-N	0	3	349.837	3.471	20	30		EGEDHN
CCCN(Cc1cnc2c(C#N)cnn2c1)[C@@H]1C[C@@H](OCC)C1(C)C	ZINC000578508030	459212356	/nfs/dbraw/zinc/21/23/56/459212356.db2.gz	KVUUZLKKTOQWNX-IAGOWNOFSA-N	0	3	341.459	3.017	20	30		EGEDHN
CC(C)Cc1ccc([C@@H](CNC(=O)NCC2(C#N)CC2)N(C)C)cc1	ZINC000568125749	459230677	/nfs/dbraw/zinc/23/06/77/459230677.db2.gz	PBUOFTSEIPNOQW-GOSISDBHSA-N	0	3	342.487	3.091	20	30		EGEDHN
C=C(C)CN(C)CCc1nc2sc3c(c2c(N)n1)CC[C@@H](C)C3	ZINC000481212495	459239684	/nfs/dbraw/zinc/23/96/84/459239684.db2.gz	PKTNXYUYBRLHSQ-GFCCVEGCSA-N	0	3	330.501	3.449	20	30		EGEDHN
Cc1cccnc1C(C)(C)CNC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000568339701	459270407	/nfs/dbraw/zinc/27/04/07/459270407.db2.gz	CTBIKCGWTSEKKK-SFHVURJKSA-N	0	3	346.434	3.038	20	30		EGEDHN
C=CC[C@@H](C)NCc1nc2c(s1)CN(C(=O)OC(C)(C)C)CC2	ZINC000496650444	459273133	/nfs/dbraw/zinc/27/31/33/459273133.db2.gz	ZDDJRCYYRXRMST-GFCCVEGCSA-N	0	3	337.489	3.491	20	30		EGEDHN
CN(Cc1ccco1)Cc1ccccc1CNC[C@@H](C#N)CCC#N	ZINC000559703650	459273348	/nfs/dbraw/zinc/27/33/48/459273348.db2.gz	SRMXMQKZPJYVQZ-QGZVFWFLSA-N	0	3	336.439	3.445	20	30		EGEDHN
COc1ccc([C@H](Cc2ccc(F)cc2)NC(=O)C(C)C#N)cc1	ZINC000522980259	459275496	/nfs/dbraw/zinc/27/54/96/459275496.db2.gz	UGSBCWMXWRSAQV-UGSOOPFHSA-N	0	3	326.371	3.394	20	30		EGEDHN
C[C@H](NC(=O)[C@H]1CCCN(Cc2cccnc2)C1)c1ccc(C#N)cc1	ZINC000523668625	459321322	/nfs/dbraw/zinc/32/13/22/459321322.db2.gz	YAJKDGZRPWDASE-JXFKEZNVSA-N	0	3	348.450	3.043	20	30		EGEDHN
CCCCO[C@@H]1C[C@@H](N[C@@H](C)C(=O)Nc2ccccc2C#N)C1(C)C	ZINC000568681308	459326908	/nfs/dbraw/zinc/32/69/08/459326908.db2.gz	CMANIBJZGAFOCS-BMGDILEWSA-N	0	3	343.471	3.459	20	30		EGEDHN
N#Cc1ccccc1N1CCCN(Cc2ccc3[nH]cnc3c2)CC1	ZINC000560460364	459351009	/nfs/dbraw/zinc/35/10/09/459351009.db2.gz	NOADSHYPXZUADO-UHFFFAOYSA-N	0	3	331.423	3.147	20	30		EGEDHN
N#Cc1ccccc1N1CCCN(Cc2ccc3nc[nH]c3c2)CC1	ZINC000560460364	459351012	/nfs/dbraw/zinc/35/10/12/459351012.db2.gz	NOADSHYPXZUADO-UHFFFAOYSA-N	0	3	331.423	3.147	20	30		EGEDHN
CN(C)[C@H](CC(=O)N[C@H]1CCc2cc(C#N)ccc21)c1ccccc1	ZINC000591320375	459354428	/nfs/dbraw/zinc/35/44/28/459354428.db2.gz	HGBMUOODHPBTBZ-VQTJNVASSA-N	0	3	333.435	3.355	20	30		EGEDHN
CCCOc1ccc(C(C)(C)NCC(=O)N[C@](C)(C#N)C2CC2)cc1	ZINC000483287248	459356586	/nfs/dbraw/zinc/35/65/86/459356586.db2.gz	ROJUZXJDBGKQRP-HXUWFJFHSA-N	0	3	343.471	3.109	20	30		EGEDHN
COC(C)(C)CN(C)Cc1cn(CCC#N)nc1-c1ccccc1	ZINC000535852201	459357724	/nfs/dbraw/zinc/35/77/24/459357724.db2.gz	LGBAXAMWXMYWFL-UHFFFAOYSA-N	0	3	326.444	3.321	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CC[C@@H](O)[C@H](C2CCCC2)C1	ZINC000560507706	459361049	/nfs/dbraw/zinc/36/10/49/459361049.db2.gz	MFEDZBAXUIHVDE-HSALFYBXSA-N	0	3	340.467	3.159	20	30		EGEDHN
N#Cc1ccc(CN(C(=O)NCc2ccc3c(c2)CNC3)C2CC2)cc1	ZINC000591360344	459361863	/nfs/dbraw/zinc/36/18/63/459361863.db2.gz	MASNRKKWJXNEGS-UHFFFAOYSA-N	0	3	346.434	3.036	20	30		EGEDHN
C=CCN(CCC(=O)Nc1ccc(C#N)c(Cl)c1)[C@@H](C)COC	ZINC000595638983	459378803	/nfs/dbraw/zinc/37/88/03/459378803.db2.gz	QLFMGHCROOGDIW-ZDUSSCGKSA-N	0	3	335.835	3.063	20	30		EGEDHN
C[C@@H](CNC(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1)N1CCCC[C@@H]1C	ZINC000560686606	459386414	/nfs/dbraw/zinc/38/64/14/459386414.db2.gz	WYMKRNJVIHOFIL-STEAMIEHSA-N	0	3	325.456	3.041	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@H](CN[C@H]1CCc2ccc(C#N)cc21)C1CC1	ZINC000496983880	459395468	/nfs/dbraw/zinc/39/54/68/459395468.db2.gz	ZURIUZXCSNXUDU-ZWKOTPCHSA-N	0	3	341.455	3.438	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@H](CN[C@H]1CCc2ccc(C#N)cc21)C1CC1	ZINC000496983878	459395670	/nfs/dbraw/zinc/39/56/70/459395670.db2.gz	ZURIUZXCSNXUDU-ROUUACIJSA-N	0	3	341.455	3.438	20	30		EGEDHN
C/C=C/c1ccc(OC[C@H](O)CN2CCC(CC#N)CC2)c(OC)c1	ZINC000541022929	459419564	/nfs/dbraw/zinc/41/95/64/459419564.db2.gz	OMUKJQSCSPUXJH-OAJJDEHYSA-N	0	3	344.455	3.094	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](O)COCc2ccc(Cl)cc2)c(F)c1	ZINC000591733712	459427162	/nfs/dbraw/zinc/42/71/62/459427162.db2.gz	GIGDFRNJUULVAA-KRWDZBQOSA-N	0	3	348.805	3.018	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@@H](Nc2nc3ccccn3c2C#N)C1	ZINC000541114438	459428051	/nfs/dbraw/zinc/42/80/51/459428051.db2.gz	WIVUTZCHYVQDLA-DOTOQJQBSA-N	0	3	331.423	3.453	20	30		EGEDHN
N#CC(C(=O)c1cnc2ccsc2c1)c1nnc2n1CCCCC2	ZINC000525284059	459440849	/nfs/dbraw/zinc/44/08/49/459440849.db2.gz	PGAGOVSREWQUHK-LBPRGKRZSA-N	0	3	337.408	3.104	20	30		EGEDHN
CC[C@H](NCCCC1(C#N)CCOCC1)c1nnc2n1CCCCC2	ZINC000595800320	459446213	/nfs/dbraw/zinc/44/62/13/459446213.db2.gz	RTTIKXGYVMXTQS-INIZCTEOSA-N	0	3	345.491	3.146	20	30		EGEDHN
C[C@H](CN[C@H]1CCCN(c2ccc(C#N)cc2)C1=O)c1ccccc1	ZINC000485270920	459446946	/nfs/dbraw/zinc/44/69/46/459446946.db2.gz	JGADGJLFNMBKHG-UZLBHIALSA-N	0	3	333.435	3.447	20	30		EGEDHN
C=CCn1c(-c2ccccc2)nnc1N1C[C@H](C)N(CC)C[C@@H]1C	ZINC000569511420	459464256	/nfs/dbraw/zinc/46/42/56/459464256.db2.gz	ZDTQXFMQKVUWSW-HOTGVXAUSA-N	0	3	325.460	3.050	20	30		EGEDHN
C=C(CN(C)C)C(=O)Nc1cc(C)cc(CNC(=O)OC(C)(C)C)c1	ZINC000497158423	459466514	/nfs/dbraw/zinc/46/65/14/459466514.db2.gz	DDZKZYBYXHMFDB-UHFFFAOYSA-N	0	3	347.459	3.076	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H]2CN(Cc3cc(C#N)cs3)C[C@H]2C1	ZINC000497162896	459467109	/nfs/dbraw/zinc/46/71/09/459467109.db2.gz	CKQGJFYSZBVIKG-GJZGRUSLSA-N	0	3	347.484	3.309	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H]2CN(Cc3cc(C#N)cs3)C[C@@H]2C1	ZINC000497162898	459467287	/nfs/dbraw/zinc/46/72/87/459467287.db2.gz	CKQGJFYSZBVIKG-LSDHHAIUSA-N	0	3	347.484	3.309	20	30		EGEDHN
C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NCc1cccc(C#N)c1F	ZINC000497172713	459472676	/nfs/dbraw/zinc/47/26/76/459472676.db2.gz	NLGIVBIBPSXEST-BBRMVZONSA-N	0	3	347.434	3.432	20	30		EGEDHN
CCC(CC)(CN[C@@H](C)C(=O)N(C)CCC#N)c1ccc(F)cc1	ZINC000596052799	459502796	/nfs/dbraw/zinc/50/27/96/459502796.db2.gz	YZGKQFLINAFLBE-HNNXBMFYSA-N	0	3	333.451	3.234	20	30		EGEDHN
C=CCn1c(CC)nnc1N1C[C@H](C)N(Cc2ccccc2)C[C@H]1C	ZINC000562030030	459505269	/nfs/dbraw/zinc/50/52/69/459505269.db2.gz	WDFOLNBFJHMIJZ-DLBZAZTESA-N	0	3	339.487	3.126	20	30		EGEDHN
CCN(Cc1ccc(C#N)cn1)CC1CCN(c2ccccn2)CC1	ZINC000569768396	459505631	/nfs/dbraw/zinc/50/56/31/459505631.db2.gz	FBUVLYBQHFPBLX-UHFFFAOYSA-N	0	3	335.455	3.087	20	30		EGEDHN
N#Cc1nc(NC2CCN(CCc3ccccc3)CC2)sc1Cl	ZINC000596075510	459509782	/nfs/dbraw/zinc/50/97/82/459509782.db2.gz	FJAKEGXATHFRGQ-UHFFFAOYSA-N	0	3	346.887	3.209	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)NC[C@@H](c1ccc(CC)cc1)N(CC)CC	ZINC000562187526	459517411	/nfs/dbraw/zinc/51/74/11/459517411.db2.gz	ZAOOOCSMIKQDLM-ICSRJNTNSA-N	0	3	332.488	3.075	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCOc2cccc(Cl)c2)CC1	ZINC000592075524	459521130	/nfs/dbraw/zinc/52/11/30/459521130.db2.gz	CRQMMBXTZHFHAQ-UHFFFAOYSA-N	0	3	336.863	3.266	20	30		EGEDHN
C=CCN(Cc1ccccc1)Cc1ccc(OCC(=O)OC)cc1	ZINC000542130679	459528399	/nfs/dbraw/zinc/52/83/99/459528399.db2.gz	JJRRWXLOOAKUQS-UHFFFAOYSA-N	0	3	325.408	3.427	20	30		EGEDHN
C[C@@H](NC(C)(C)CNC(=O)N1CCC(F)(C#N)CC1)c1ccccc1	ZINC000497439945	459535876	/nfs/dbraw/zinc/53/58/76/459535876.db2.gz	BGVDJCOYOAWFBX-OAHLLOKOSA-N	0	3	346.450	3.153	20	30		EGEDHN
C[C@H](c1ccc(C#N)cc1)N1CC[C@@H](C(=O)NCc2ccccc2)C1	ZINC000592153983	459538561	/nfs/dbraw/zinc/53/85/61/459538561.db2.gz	FJJPGBJAXGLDND-OXQOHEQNSA-N	0	3	333.435	3.258	20	30		EGEDHN
COc1cc([C@@H](C)NCc2ccc(C#N)c(C)c2)ccc1OCCO	ZINC000488115028	459539488	/nfs/dbraw/zinc/53/94/88/459539488.db2.gz	LUDWGEOMMNUPFN-OAHLLOKOSA-N	0	3	340.423	3.097	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@@H](c1ccc(CC)cc1)N(C)C	ZINC000488601047	459547853	/nfs/dbraw/zinc/54/78/53/459547853.db2.gz	XQTVGXPBLZSPQM-IBGZPJMESA-N	0	3	325.456	3.269	20	30		EGEDHN
C=CCN(CCc1ccco1)C(=O)NC[C@H](C)N1CCC(C)CC1	ZINC000497691015	459551507	/nfs/dbraw/zinc/55/15/07/459551507.db2.gz	LXRYOQAAHJHZGU-KRWDZBQOSA-N	0	3	333.476	3.140	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN1CCC[C@@H](Cc2ccc(OC)cc2)C1	ZINC000570387038	459555774	/nfs/dbraw/zinc/55/57/74/459555774.db2.gz	FMYVREAYANKAQA-IBGZPJMESA-N	0	3	342.483	3.150	20	30		EGEDHN
N#C[C@@H]1CC[C@H](NCCNc2ncc(C(F)(F)F)cc2Cl)C1	ZINC000571743662	459572345	/nfs/dbraw/zinc/57/23/45/459572345.db2.gz	BOBUOVBECLIFAG-KOLCDFICSA-N	0	3	332.757	3.448	20	30		EGEDHN
Cc1ccc(Cl)c(OC[C@@H](O)CN2CCC(CCC#N)CC2)c1	ZINC000572117917	459576703	/nfs/dbraw/zinc/57/67/03/459576703.db2.gz	GDPBKSJDPLUBBY-INIZCTEOSA-N	0	3	336.863	3.404	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCCC[C@H]2OC(F)F)c([N+](=O)[O-])c1	ZINC000572845952	459585456	/nfs/dbraw/zinc/58/54/56/459585456.db2.gz	IZLSRMXGHPUVJY-TZMCWYRMSA-N	0	3	325.315	3.106	20	30		EGEDHN
N#Cc1cc(C(=O)N2CCC[C@@H]2CN2CCCCC2)ccc1Cl	ZINC000542730159	459585820	/nfs/dbraw/zinc/58/58/20/459585820.db2.gz	SBHZNGVTWVQGMB-MRXNPFEDSA-N	0	3	331.847	3.302	20	30		EGEDHN
CC[C@@H](c1ccccc1)[C@@H]1CCCN1CC(=O)NC1(C#N)CCC1	ZINC000527127686	459596426	/nfs/dbraw/zinc/59/64/26/459596426.db2.gz	OZUHWPXKSRLFEZ-ROUUACIJSA-N	0	3	325.456	3.207	20	30		EGEDHN
C#C[C@H](NC[C@H](C)c1ccc(S(C)(=O)=O)cc1)c1ccc(F)cc1	ZINC000491371558	459621217	/nfs/dbraw/zinc/62/12/17/459621217.db2.gz	FNEJUHTVXBVFTB-LIRRHRJNSA-N	0	3	345.439	3.297	20	30		EGEDHN
CC[C@@H]1CN([C@H](C)C(=O)NC2(C#N)CCC2)CC[C@H]1c1ccccc1	ZINC000527298027	459625161	/nfs/dbraw/zinc/62/51/61/459625161.db2.gz	LDSHHSMQXDRBFE-ZHALLVOQSA-N	0	3	339.483	3.453	20	30		EGEDHN
C[C@@H]1C[C@@H]1[C@H](NCC(=O)NC1(C#N)CCC1)c1ccc(Cl)cc1	ZINC000527385144	459639916	/nfs/dbraw/zinc/63/99/16/459639916.db2.gz	AJVVDQWFSMLVMB-ISTRZQFTSA-N	0	3	331.847	3.189	20	30		EGEDHN
C#CCN1CCC(C(=O)NC[C@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000491622597	459640764	/nfs/dbraw/zinc/64/07/64/459640764.db2.gz	GODNAQLSSNZGBG-NHCUHLMSSA-N	0	3	338.495	3.422	20	30		EGEDHN
C#C[C@@H](NC(=O)Nc1ccccc1CCN(C)C)c1ccc(F)cc1	ZINC000491780675	459672312	/nfs/dbraw/zinc/67/23/12/459672312.db2.gz	MCKKZSZGGBTRMV-GOSISDBHSA-N	0	3	339.414	3.426	20	30		EGEDHN
C[C@H](CCNCCS(=O)(=O)c1ccc(C#N)cc1)CC(C)(C)C	ZINC000563012494	459696207	/nfs/dbraw/zinc/69/62/07/459696207.db2.gz	ZILBVAZGULLKQP-OAHLLOKOSA-N	0	3	336.501	3.384	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N2CCC(CC#N)CC2)C1	ZINC000543776826	459698443	/nfs/dbraw/zinc/69/84/43/459698443.db2.gz	XEUCVNUROQCZFD-APWZRJJASA-N	0	3	340.471	3.157	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1CNCc1ncc(Br)cc1F	ZINC000527704175	459707795	/nfs/dbraw/zinc/70/77/95/459707795.db2.gz	VIICJGFCOGCXRM-IINYFYTJSA-N	0	3	329.213	3.054	20	30		EGEDHN
N#C[C@@H]1CC[C@@H](N[C@H]2CC(=O)N(c3cccc(C(F)(F)F)c3)C2)C1	ZINC000584389684	459723801	/nfs/dbraw/zinc/72/38/01/459723801.db2.gz	RHJWJGMWCFMUJS-BNOWGMLFSA-N	0	3	337.345	3.093	20	30		EGEDHN
CC[C@@H](C)CCNC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000596726422	459742434	/nfs/dbraw/zinc/74/24/34/459742434.db2.gz	CJBFROZLHQCINX-MRXNPFEDSA-N	0	3	330.476	3.068	20	30		EGEDHN
N#CCCC1CCN(CCC(=O)c2ccc3c(c2)OCCO3)CC1	ZINC000584527319	459761673	/nfs/dbraw/zinc/76/16/73/459761673.db2.gz	FNSYZCGDNWRBQH-UHFFFAOYSA-N	0	3	328.412	3.046	20	30		EGEDHN
COCC1(NCc2ccc(OC)c(OCCCC#N)c2)CCCC1	ZINC000563440395	459764960	/nfs/dbraw/zinc/76/49/60/459764960.db2.gz	RIMWHLYNZQEEMF-UHFFFAOYSA-N	0	3	332.444	3.427	20	30		EGEDHN
CC1(C)CN(C(=O)C(C#N)Cc2ccc(C#N)cc2)[C@@H]1c1ccncc1	ZINC000564212749	459771837	/nfs/dbraw/zinc/77/18/37/459771837.db2.gz	FMSBHDJYMUIGFA-RBUKOAKNSA-N	0	3	344.418	3.245	20	30		EGEDHN
N#CCc1cccc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)c1	ZINC000593169791	459794789	/nfs/dbraw/zinc/79/47/89/459794789.db2.gz	NPGACRZSKVLWKB-UONOGXRCSA-N	0	3	326.318	3.439	20	30		EGEDHN
N#CCc1cccc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)c1	ZINC000593169790	459794915	/nfs/dbraw/zinc/79/49/15/459794915.db2.gz	NPGACRZSKVLWKB-KGLIPLIRSA-N	0	3	326.318	3.439	20	30		EGEDHN
N#Cc1cccc2c1CCN2C(=O)C(C[C@H]1CCCO1)C(F)(F)F	ZINC000593175704	459797175	/nfs/dbraw/zinc/79/71/75/459797175.db2.gz	ZLQVBNLWMDITBT-OCCSQVGLSA-N	0	3	338.329	3.195	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H]2CC[C@@H]2c2ccc(F)cc2)CC1	ZINC000528446611	459807324	/nfs/dbraw/zinc/80/73/24/459807324.db2.gz	BMGRTKJQLWWQPD-RTBURBONSA-N	0	3	330.447	3.476	20	30		EGEDHN
CCC(C#N)(CC)C(=O)N1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1	ZINC000529502794	459830260	/nfs/dbraw/zinc/83/02/60/459830260.db2.gz	AKOCXVPVVBTVEL-ZWKOTPCHSA-N	0	3	325.456	3.049	20	30		EGEDHN
N#CC1(N(C(=O)C2CCN(Cc3ccccc3)CC2)C2CC2)CCC1	ZINC000585748618	459840416	/nfs/dbraw/zinc/84/04/16/459840416.db2.gz	ADJXSHQNYILHLK-UHFFFAOYSA-N	0	3	337.467	3.336	20	30		EGEDHN
N#Cc1ccc(C2=CCN(C(=O)[C@@H]3CCN3C3CCCC3)CC2)cc1	ZINC000602134203	459851819	/nfs/dbraw/zinc/85/18/19/459851819.db2.gz	UDGWVSFCDHDZQA-FQEVSTJZSA-N	0	3	335.451	3.191	20	30		EGEDHN
Cc1cc(N(C)CCC2CCN(c3ccncc3)CC2)c(C#N)cn1	ZINC000575175806	459941156	/nfs/dbraw/zinc/94/11/56/459941156.db2.gz	SBYNWBFRBZMUBH-UHFFFAOYSA-N	0	3	335.455	3.400	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](NC/C=C\c3ccc(F)cc3)C2=O)cc1	ZINC000588589313	459955413	/nfs/dbraw/zinc/95/54/13/459955413.db2.gz	SENJQGZAVHKDFF-SZSMBMMGSA-N	0	3	349.409	3.101	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN(Cc1cccc(F)c1)C[C@H]1CCCO1	ZINC000598589590	459955788	/nfs/dbraw/zinc/95/57/88/459955788.db2.gz	GYRHGFPWFSCHMD-ZWKOTPCHSA-N	0	3	334.435	3.107	20	30		EGEDHN
CCCN(C[C@H](O)CC(C)(C)C#N)[C@H](C)C(=O)Nc1ccccc1	ZINC000598594912	459957320	/nfs/dbraw/zinc/95/73/20/459957320.db2.gz	NVWGLVXFXKBCQY-NVXWUHKLSA-N	0	3	331.460	3.026	20	30		EGEDHN
COC[C@H](NC[C@H](O)CC(C)(C)C#N)c1cccc(C(F)(F)F)c1	ZINC000598599198	459958969	/nfs/dbraw/zinc/95/89/69/459958969.db2.gz	AVOUPSCFQPUSIR-CABCVRRESA-N	0	3	344.377	3.283	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN[C@@H](CN1CCCCC1)c1ccccc1	ZINC000598604014	459960306	/nfs/dbraw/zinc/96/03/06/459960306.db2.gz	NNRGZTRPVSNLMI-MOPGFXCFSA-N	0	3	329.488	3.104	20	30		EGEDHN
C[C@H](NC[C@H](O)CC(C)(C)C#N)c1nc2ccccc2n1C(F)F	ZINC000598605594	459961145	/nfs/dbraw/zinc/96/11/45/459961145.db2.gz	BXKKKFDEOXEZOD-NWDGAFQWSA-N	0	3	336.386	3.383	20	30		EGEDHN
CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)CCCCCC#N	ZINC000588652718	459961410	/nfs/dbraw/zinc/96/14/10/459961410.db2.gz	UZLHXCIEHHGKHF-UHFFFAOYSA-N	0	3	337.414	3.329	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CNC1(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000598617803	459965522	/nfs/dbraw/zinc/96/55/22/459965522.db2.gz	LNADWSOSNXDBGV-ZDUSSCGKSA-N	0	3	342.361	3.465	20	30		EGEDHN
CCN1CCN(c2ccc(NCc3cccc(C#N)n3)c(C)c2)CC1	ZINC000602493759	459968241	/nfs/dbraw/zinc/96/82/41/459968241.db2.gz	KRCDUHINKGQCRG-UHFFFAOYSA-N	0	3	335.455	3.016	20	30		EGEDHN
COC(=O)c1cc(CN[C@H](C)c2ccc(C#N)cc2)n2c1CCCC2	ZINC000598629017	459968940	/nfs/dbraw/zinc/96/89/40/459968940.db2.gz	AASHGCCKKZDUTG-CQSZACIVSA-N	0	3	337.423	3.333	20	30		EGEDHN
C[C@@H](CNCc1cccc(C#N)n1)Oc1ccccc1Br	ZINC000602566375	459999697	/nfs/dbraw/zinc/99/96/97/459999697.db2.gz	HPFYWAJRFZIIMQ-LBPRGKRZSA-N	0	3	346.228	3.273	20	30		EGEDHN
C[C@@H](C#N)CN(C)C(=O)N[C@H](CN1CCCCC1)c1ccccc1	ZINC000609640193	460001800	/nfs/dbraw/zinc/00/18/00/460001800.db2.gz	ZRTBWCRHASDCKR-FUHWJXTLSA-N	0	3	328.460	3.015	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)NCC12CCCN1CCC2	ZINC000597588197	460001821	/nfs/dbraw/zinc/00/18/21/460001821.db2.gz	GUJYBVZBFRWHDB-UHFFFAOYSA-N	0	3	339.464	3.440	20	30		EGEDHN
COCCOc1cc(C)ccc1CN[C@@H](C)CC1(C#N)CCOCC1	ZINC000602573812	460004750	/nfs/dbraw/zinc/00/47/50/460004750.db2.gz	NEBXAWXNVCBHSY-KRWDZBQOSA-N	0	3	346.471	3.209	20	30		EGEDHN
COc1cccc(CNC[C@H](O)CC(C)(C)C#N)c1OC1CCCC1	ZINC000598721249	460006198	/nfs/dbraw/zinc/00/61/98/460006198.db2.gz	UEIIVLOTPLPTNQ-MRXNPFEDSA-N	0	3	346.471	3.407	20	30		EGEDHN
C[C@@H](CCC#N)CN[C@@H](CCO)c1ccccc1Br	ZINC000602596094	460015944	/nfs/dbraw/zinc/01/59/44/460015944.db2.gz	GMZDIPKNGZBNIW-WFASDCNBSA-N	0	3	325.250	3.402	20	30		EGEDHN
C[C@H](c1ccc(C#N)cc1)N1CCC(C(=O)NCC(F)(F)F)CC1	ZINC000609822868	460024717	/nfs/dbraw/zinc/02/47/17/460024717.db2.gz	NHUUUUPMXIZDIW-GFCCVEGCSA-N	0	3	339.361	3.010	20	30		EGEDHN
C[C@@H]1CN(c2nccnc2C#N)CCN1CCC1CCCCCC1	ZINC000575955530	460038523	/nfs/dbraw/zinc/03/85/23/460038523.db2.gz	MYYKURUIYRKRRR-MRXNPFEDSA-N	0	3	327.476	3.219	20	30		EGEDHN
CC[C@@H]1CN(C(=O)C(C)C)CC[C@H]1NCc1cc(C#N)ccc1F	ZINC000614204233	460047069	/nfs/dbraw/zinc/04/70/69/460047069.db2.gz	ZBFLMCQYWGBLPC-CRAIPNDOSA-N	0	3	331.435	3.070	20	30		EGEDHN
CC[C@H]1CN(C(=O)C(C)C)CC[C@H]1NCc1cc(C#N)ccc1F	ZINC000614204235	460047204	/nfs/dbraw/zinc/04/72/04/460047204.db2.gz	ZBFLMCQYWGBLPC-MAUKXSAKSA-N	0	3	331.435	3.070	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)cn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000594015092	460057359	/nfs/dbraw/zinc/05/73/59/460057359.db2.gz	FAFAZRLYCFIGOW-NRFANRHFSA-N	0	3	334.467	3.438	20	30		EGEDHN
N#C[C@@H]1CCC[C@H](N[C@H](Cc2ccccc2)[C@H](O)C(F)(F)F)C1	ZINC000618573812	460068937	/nfs/dbraw/zinc/06/89/37/460068937.db2.gz	QKYFKGTXMXHHEJ-QXSJWSMHSA-N	0	3	326.362	3.193	20	30		EGEDHN
Cc1cccc(C)c1OC[C@@H](O)CN[C@H]1CCc2ccc(C#N)cc21	ZINC000589338043	460075718	/nfs/dbraw/zinc/07/57/18/460075718.db2.gz	PYNXVRIEMCEFIH-ICSRJNTNSA-N	0	3	336.435	3.192	20	30		EGEDHN
CSC1c2cc(-c3noc(-c4cccc(C#N)n4)n3)ccc2NC1=O	ZINC000589367191	460079435	/nfs/dbraw/zinc/07/94/35/460079435.db2.gz	UEIAXZZGDBUFIN-AWEZNQCLSA-N	0	3	349.375	3.026	20	30		EGEDHN
C[C@@H]1C[C@@H](N(C)C(=O)c2cccc(C#N)n2)CCN1Cc1ccccc1	ZINC000589427934	460085723	/nfs/dbraw/zinc/08/57/23/460085723.db2.gz	QZJDZNDGPSRMDN-APWZRJJASA-N	0	3	348.450	3.078	20	30		EGEDHN
C=CCc1ccc(OC[C@H](O)CNCc2cc(C)cs2)c(OC)c1	ZINC000576339897	460121067	/nfs/dbraw/zinc/12/10/67/460121067.db2.gz	KMIMIOMSWISMFO-MRXNPFEDSA-N	0	3	347.480	3.323	20	30		EGEDHN
CN(C[C@H](O)COc1ccc(C(F)(F)F)cc1)CC1(CC#N)CC1	ZINC000602782885	460121458	/nfs/dbraw/zinc/12/14/58/460121458.db2.gz	JVNDFXUNWHYJQX-AWEZNQCLSA-N	0	3	342.361	3.071	20	30		EGEDHN
CCC(O)(CC)C(C)(C)CNC(=O)C(C#N)CCc1ccccc1	ZINC000597943250	460122028	/nfs/dbraw/zinc/12/20/28/460122028.db2.gz	WGEJUYSELGYMDZ-KRWDZBQOSA-N	0	3	330.472	3.452	20	30		EGEDHN
N#CCc1ccc(OC[C@@H](O)CN2CCC(C3CCCC3)CC2)cc1	ZINC000610370872	460138310	/nfs/dbraw/zinc/13/83/10/460138310.db2.gz	SGILWEHXDPPQEG-FQEVSTJZSA-N	0	3	342.483	3.395	20	30		EGEDHN
N#Cc1ccc2c(c1)CC[C@@H]2NCc1ccc(C(=O)NC2CC2)cc1	ZINC000618741586	460151729	/nfs/dbraw/zinc/15/17/29/460151729.db2.gz	HEVMMDCWLZJVFG-FQEVSTJZSA-N	0	3	331.419	3.228	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)[C@H](C)Cc2ccc(C#N)cc2)N(C)C)cc1	ZINC000594254558	460174299	/nfs/dbraw/zinc/17/42/99/460174299.db2.gz	ISQUWNMJAYVNIZ-UTKZUKDTSA-N	0	3	349.478	3.464	20	30		EGEDHN
CC(C)(CNC(=O)N[C@@H]1CCc2cc(C#N)ccc21)N1CCCCC1	ZINC000618797374	460179152	/nfs/dbraw/zinc/17/91/52/460179152.db2.gz	TZRCAPXGNXIFDC-GOSISDBHSA-N	0	3	340.471	3.109	20	30		EGEDHN
C[C@@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccc(-n2cncn2)cc1	ZINC000618806203	460183672	/nfs/dbraw/zinc/18/36/72/460183672.db2.gz	PZMQAXSLLZRFOV-JLTOFOAXSA-N	0	3	329.407	3.477	20	30		EGEDHN
CC[C@@H]1CCCCN1CCNC(=O)N[C@H]1CCc2cc(C#N)ccc21	ZINC000618816225	460186240	/nfs/dbraw/zinc/18/62/40/460186240.db2.gz	KDVPRIHWNSFCSC-MJGOQNOKSA-N	0	3	340.471	3.109	20	30		EGEDHN
C[C@H](c1ccc(F)cc1)N(C)C[C@@H](O)COc1ccccc1C#N	ZINC000599249744	460206946	/nfs/dbraw/zinc/20/69/46/460206946.db2.gz	GQFASPYSZCFEIV-RDTXWAMCSA-N	0	3	328.387	3.130	20	30		EGEDHN
C[C@](C#N)(NC(=O)CNC1(c2ccccc2)CCCCC1)C1CC1	ZINC000610677047	460212815	/nfs/dbraw/zinc/21/28/15/460212815.db2.gz	PWUFVKDOLNMBRP-LJQANCHMSA-N	0	3	325.456	3.244	20	30		EGEDHN
CN(Cc1c(Cl)cccc1Cl)C(=O)[C@@H](N)CCCCC#N	ZINC000594426888	460215556	/nfs/dbraw/zinc/21/55/56/460215556.db2.gz	HPCOHCJDHRUNRM-AWEZNQCLSA-N	0	3	328.243	3.363	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)c1ccnc(C(C)(C)C)n1	ZINC000610734599	460227717	/nfs/dbraw/zinc/22/77/17/460227717.db2.gz	YEBFLBQQDIDTGP-UHFFFAOYSA-N	0	3	337.471	3.214	20	30		EGEDHN
CC[C@@H](CN1CCCC1)NC(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000610986445	460271870	/nfs/dbraw/zinc/27/18/70/460271870.db2.gz	RIPPXTOPLKDZOB-ROUUACIJSA-N	0	3	328.460	3.205	20	30		EGEDHN
Cc1ccc(S(=O)(=O)CCCN[C@@H](C)c2cccc(C#N)c2)cc1	ZINC000611387088	460349843	/nfs/dbraw/zinc/34/98/43/460349843.db2.gz	ZFHMTCHFVHMOMQ-INIZCTEOSA-N	0	3	342.464	3.381	20	30		EGEDHN
N#Cc1cccc(OCCN2C[C@@H]3CN(c4ccccc4)C[C@@H]3C2)c1	ZINC000603865312	460351797	/nfs/dbraw/zinc/35/17/97/460351797.db2.gz	WQBRXELOIBQVJH-KDURUIRLSA-N	0	3	333.435	3.005	20	30		EGEDHN
CCNC(=O)c1ccc(CN[C@@H]2CCCc3cc(C#N)ccc32)cc1	ZINC000611390732	460352493	/nfs/dbraw/zinc/35/24/93/460352493.db2.gz	RBNXUSCAYFWEFS-HXUWFJFHSA-N	0	3	333.435	3.475	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2N[C@H]1CC(=O)N(c2ccccc2)C1	ZINC000611391721	460353358	/nfs/dbraw/zinc/35/33/58/460353358.db2.gz	GFVGFAWSNPPLGU-FXAWDEMLSA-N	0	3	331.419	3.331	20	30		EGEDHN
Cc1ccc([C@H](C)CN[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)cc1	ZINC000600149996	460408126	/nfs/dbraw/zinc/40/81/26/460408126.db2.gz	GKCVXGNMOKIXCX-DYESRHJHSA-N	0	3	347.462	3.361	20	30		EGEDHN
CC(C)(C#N)CNC(=O)N[C@H](CN1CCCCC1)c1ccccc1	ZINC000611623896	460417187	/nfs/dbraw/zinc/41/71/87/460417187.db2.gz	FKHDOTFJOOWXDC-QGZVFWFLSA-N	0	3	328.460	3.063	20	30		EGEDHN
C=CCCOCc1nc(-c2ccc3c(c2)C(SC)C(=O)N3)no1	ZINC000612922610	460772593	/nfs/dbraw/zinc/77/25/93/460772593.db2.gz	ATBPXEMBIBYOLY-AWEZNQCLSA-N	0	3	331.397	3.186	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CCN(C(=O)c2ccccc2CC#N)C1	ZINC000601617464	460848091	/nfs/dbraw/zinc/84/80/91/460848091.db2.gz	REYWIWNQYCORDA-SFHVURJKSA-N	0	3	347.462	3.347	20	30		EGEDHN
CN(CCc1ccccc1)[C@@H]1CCN(C(=O)c2ccccc2CC#N)C1	ZINC000601670096	460864555	/nfs/dbraw/zinc/86/45/55/460864555.db2.gz	JLDOQBUEMAQNSX-HXUWFJFHSA-N	0	3	347.462	3.142	20	30		EGEDHN
N#CC(C(=O)c1ccc2cccnc2c1)c1nnc2n1CCCCC2	ZINC000633900276	461321056	/nfs/dbraw/zinc/32/10/56/461321056.db2.gz	ORXDBPLRDOFLIQ-HNNXBMFYSA-N	0	3	331.379	3.043	20	30		EGEDHN
CC#CC[C@H](CO)NCc1ccc(OCc2cccs2)c(OC)c1	ZINC000641768561	461361283	/nfs/dbraw/zinc/36/12/83/461361283.db2.gz	CBJOOHUIDBTPSK-MRXNPFEDSA-N	0	3	345.464	3.200	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H](C)OCc2cccc(C)c2)CC1	ZINC000630941699	461426359	/nfs/dbraw/zinc/42/63/59/461426359.db2.gz	DONQYJLMWUSWLM-KRWDZBQOSA-N	0	3	330.472	3.057	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cc(C(C)(C)C)n[nH]1)C(C)C	ZINC000642631747	461541786	/nfs/dbraw/zinc/54/17/86/461541786.db2.gz	RKRBRJPSOHSLRK-MRXNPFEDSA-N	0	3	332.492	3.136	20	30		EGEDHN
C=CCOc1cccc(NC(=O)N[C@@H]2CCCN3CCCC[C@H]23)c1	ZINC000653953293	461957952	/nfs/dbraw/zinc/95/79/52/461957952.db2.gz	XITBUIXIYWNBRM-QZTJIDSGSA-N	0	3	329.444	3.390	20	30		EGEDHN
C=CCN1CCC(Nc2ccc(-c3ccc(Cl)s3)nn2)CC1	ZINC000651308642	462175445	/nfs/dbraw/zinc/17/54/45/462175445.db2.gz	XBDFEUJTACVIBQ-UHFFFAOYSA-N	0	3	334.876	3.343	20	30		EGEDHN
C=CC[C@@H]1CCCN(CC(=O)NCc2ccc(COCC)cc2)C1	ZINC000661379725	462225667	/nfs/dbraw/zinc/22/56/67/462225667.db2.gz	HKAMSLQRZASHBQ-GOSISDBHSA-N	0	3	330.472	3.127	20	30		EGEDHN
Cc1cc(NC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)ncc1C#N	ZINC000603113545	469268807	/nfs/dbraw/zinc/26/88/07/469268807.db2.gz	PNYHEEFHPJMCLT-RDTXWAMCSA-N	0	3	337.427	3.075	20	30		EGEDHN
C[C@@H](CN1CCCCC1)NC(=O)N(Cc1ccc(C#N)cc1)C1CC1	ZINC000171305449	533821369	/nfs/dbraw/zinc/82/13/69/533821369.db2.gz	XQVSHZMUDVEADY-INIZCTEOSA-N	0	3	340.471	3.107	20	30		EGEDHN
C[C@@H]1C[C@H](N(C)C(=O)c2ccc(C#N)[nH]2)CCN1Cc1ccccc1	ZINC000153531961	533894639	/nfs/dbraw/zinc/89/46/39/533894639.db2.gz	IALCATHTUBGMSH-CRAIPNDOSA-N	0	3	336.439	3.011	20	30		EGEDHN
Cc1oc(NC(=O)CN[C@@H](C)[C@@H](C)c2ccccc2)c(C#N)c1C	ZINC000181528086	534547287	/nfs/dbraw/zinc/54/72/87/534547287.db2.gz	MQCABMIPWQWEFP-OCCSQVGLSA-N	0	3	325.412	3.488	20	30		EGEDHN
Cc1oc([N-]C(=O)C[NH2+][C@@H](C)[C@@H](C)c2ccccc2)c(C#N)c1C	ZINC000181528086	534547292	/nfs/dbraw/zinc/54/72/92/534547292.db2.gz	MQCABMIPWQWEFP-OCCSQVGLSA-N	0	3	325.412	3.488	20	30		EGEDHN
C=CCN1CCC(NC(=O)/C=C/c2ccc(Br)cc2)CC1	ZINC000171727077	526416246	/nfs/dbraw/zinc/41/62/46/526416246.db2.gz	ZKFUCMFTUMFLAI-VMPITWQZSA-N	0	3	349.272	3.229	20	30		EGEDHN
C=CCN1CCC(NC(=O)Cc2ccccc2C(F)(F)F)CC1	ZINC000171716214	526424284	/nfs/dbraw/zinc/42/42/84/526424284.db2.gz	NUBZGQPTQJSDPZ-UHFFFAOYSA-N	0	3	326.362	3.015	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC(C)(C)CCc2ccccc2)CC1	ZINC000171733052	526431190	/nfs/dbraw/zinc/43/11/90/526431190.db2.gz	IGDLLQQVWLWPBM-UHFFFAOYSA-N	0	3	329.488	3.347	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H]2CCSc3ccccc32)CC1	ZINC000171713455	526438611	/nfs/dbraw/zinc/43/86/11/526438611.db2.gz	ZEBURZDQCXYVJR-MRXNPFEDSA-N	0	3	331.485	3.173	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cc(F)ccc2OC(F)F)CC1	ZINC000178015428	526440579	/nfs/dbraw/zinc/44/05/79/526440579.db2.gz	KGZYMCGNIQUHSO-UHFFFAOYSA-N	0	3	343.349	3.199	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccccc2C(F)(F)F)CC1	ZINC000171680059	526441841	/nfs/dbraw/zinc/44/18/41/526441841.db2.gz	ZNEFAYBDWARHTF-UHFFFAOYSA-N	0	3	327.350	3.477	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@@H](C)Oc2cc(C)ccc2Cl)CC1	ZINC000171717876	526443248	/nfs/dbraw/zinc/44/32/48/526443248.db2.gz	PXCINEXXYBAYRS-CQSZACIVSA-N	0	3	336.863	3.182	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@H](C)Oc2cccc(C(C)C)c2)CC1	ZINC000171717881	526444494	/nfs/dbraw/zinc/44/44/94/526444494.db2.gz	ZBAVYNNPQVNMND-INIZCTEOSA-N	0	3	330.472	3.344	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(C)ccc2Br)CC1	ZINC000178233038	526446519	/nfs/dbraw/zinc/44/65/19/526446519.db2.gz	XDMOKPZZUKBUGS-UHFFFAOYSA-N	0	3	337.261	3.138	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](C)Cc2ccccc2C)CC1	ZINC000171556346	526594507	/nfs/dbraw/zinc/59/45/07/526594507.db2.gz	OSKPEHXTTPKPJL-QGZVFWFLSA-N	0	3	329.488	3.266	20	30		EGEDHN
C=CCN(CC=C)C(=O)c1ccc(NC(=O)C2(N)CCCCC2)cc1	ZINC000154755879	527639813	/nfs/dbraw/zinc/63/98/13/527639813.db2.gz	NEMVINXSGVWSNX-UHFFFAOYSA-N	0	3	341.455	3.101	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H]2C[C@@H](OCC)C23CCCCC3)CC1	ZINC000078959131	546591594	/nfs/dbraw/zinc/59/15/94/546591594.db2.gz	HWINUEQVEXJQBV-ZWKOTPCHSA-N	0	3	349.519	3.064	20	30		EGEDHN
CN1CCC[C@@]2(CCN(C(=O)Nc3ccc(CC#N)cc3Cl)C2)C1	ZINC000455730246	547938123	/nfs/dbraw/zinc/93/81/23/547938123.db2.gz	KPIRIMYRECXMCT-GOSISDBHSA-N	0	3	346.862	3.356	20	30		EGEDHN
CN(C)CCN(C)C(=O)Nc1cccc(C#Cc2cccs2)c1	ZINC000674278835	548717780	/nfs/dbraw/zinc/71/77/80/548717780.db2.gz	MKCGIEDZFKJNDZ-UHFFFAOYSA-N	0	3	327.453	3.173	20	30		EGEDHN
C=CCN(CCc1ccccc1)C(=O)N[C@H](CC)CN1CCCC1	ZINC000675193430	548869293	/nfs/dbraw/zinc/86/92/93/548869293.db2.gz	CCHVPKSIRNNQDE-LJQANCHMSA-N	0	3	329.488	3.301	20	30		EGEDHN
C=CCOc1ccc(CN2CCC[C@H](n3ccnc3)C2)cc1OC	ZINC000678234873	549435568	/nfs/dbraw/zinc/43/55/68/549435568.db2.gz	MOIKPRQADLBFLL-KRWDZBQOSA-N	0	3	327.428	3.294	20	30		EGEDHN
COCC#CCN[C@H](c1cc(F)cc(Br)c1)C1CC1	ZINC000681479446	550001603	/nfs/dbraw/zinc/00/16/03/550001603.db2.gz	RZMGRLHFETXMOG-HNNXBMFYSA-N	0	3	326.209	3.279	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H](c2ccccc2)N2CCC(C)CC2)cn1	ZINC000728862301	574779934	/nfs/dbraw/zinc/77/99/34/574779934.db2.gz	ZUAYLPMHXOOKPB-NRFANRHFSA-N	0	3	347.462	3.266	20	30		EGEDHN
CCC(=O)N[C@H](C)C(=O)C(C#N)c1nc(-c2ccc(C)cc2)cs1	ZINC000729069963	574810495	/nfs/dbraw/zinc/81/04/95/574810495.db2.gz	JKRDZPOFOIAWFU-OCCSQVGLSA-N	0	3	341.436	3.210	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](C)COc2ccc(C)cc2)CC1	ZINC000730023310	574906502	/nfs/dbraw/zinc/90/65/02/574906502.db2.gz	KSFYPXDPPZZJSL-QGZVFWFLSA-N	0	3	345.487	3.102	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]\C2CCC(C(=O)OC)CC2)c([O-])c1	ZINC000730148156	574925192	/nfs/dbraw/zinc/92/51/92/574925192.db2.gz	YHBZQOFUYTZSFG-MOSHPQCFSA-N	0	3	332.444	3.389	20	30		EGEDHN
COc1cccc([O-])c1/C=N\CC1([NH+]2CCC(OC)CC2)CCCC1	ZINC000730733342	575013696	/nfs/dbraw/zinc/01/36/96/575013696.db2.gz	XVHGXCYIBKCDAB-STZFKDTASA-N	0	3	346.471	3.243	20	30		EGEDHN
N#Cc1ccc(NC(=S)N2CC[C@H](N3CCCCC3)C2)cc1Cl	ZINC000730735319	575014338	/nfs/dbraw/zinc/01/43/38/575014338.db2.gz	PXYXEOCJZQGSIY-HNNXBMFYSA-N	0	3	348.903	3.469	20	30		EGEDHN
N#CCSc1ccccc1C(=O)N1CC[C@H](N2CCCCC2)C1	ZINC000730795125	575021148	/nfs/dbraw/zinc/02/11/48/575021148.db2.gz	FXJIURBTYHTOCW-HNNXBMFYSA-N	0	3	329.469	3.003	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccn2)CCC1N=Nc1nc2ccccc2[nH]1	ZINC000734361732	575473683	/nfs/dbraw/zinc/47/36/83/575473683.db2.gz	HZXXYAPQTISZJL-CQSZACIVSA-N	0	3	334.427	3.268	20	30		EGEDHN
CC1CCC(N2CCN(C(=O)/C=C\c3ccccc3C#N)CC2)CC1	ZINC000734401003	575480041	/nfs/dbraw/zinc/48/00/41/575480041.db2.gz	QZQGRMMTIGKVKP-FLIBITNWSA-N	0	3	337.467	3.294	20	30		EGEDHN
CCOCCCN1CCC(=NNC(=S)Nc2ccccc2)[C@H](C)C1	ZINC000735224431	575619159	/nfs/dbraw/zinc/61/91/59/575619159.db2.gz	RGWWFPAKCMZMGC-OAHLLOKOSA-N	0	3	348.516	3.097	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2ccc(N(CC)CCC)cc2)CC1	ZINC000740737668	576622126	/nfs/dbraw/zinc/62/21/26/576622126.db2.gz	IBPLSRMPHIIRIV-UHFFFAOYSA-N	0	3	341.499	3.140	20	30		EGEDHN
C#CCOc1ccc(CNC[C@@H](O)c2c(F)cccc2Cl)cc1	ZINC000741255369	576669095	/nfs/dbraw/zinc/66/90/95/576669095.db2.gz	TVUMDPCMQSDIEF-QGZVFWFLSA-N	0	3	333.790	3.314	20	30		EGEDHN
CCOc1ccc(NC(=S)NN=C2CCN(CC)C[C@H]2C)cc1	ZINC000741457622	576687687	/nfs/dbraw/zinc/68/76/87/576687687.db2.gz	OEMYGAAOGYWNKO-CYBMUJFWSA-N	0	3	334.489	3.089	20	30		EGEDHN
COc1ccc(CNCCc2ccn(-c3ccccc3)n2)cc1C#N	ZINC000742369150	576774554	/nfs/dbraw/zinc/77/45/54/576774554.db2.gz	XJMQSDZXARZQPZ-UHFFFAOYSA-N	0	3	332.407	3.085	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1)C(=O)[C@H]1C[C@]12CCc1ccccc12	ZINC000744028506	576819131	/nfs/dbraw/zinc/81/91/31/576819131.db2.gz	JCWVIUCPMTYIJP-CDXJDZJCSA-N	0	3	330.387	3.238	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)[C@H](C)c1ccc(C)o1	ZINC000744031120	576819207	/nfs/dbraw/zinc/81/92/07/576819207.db2.gz	QUMVYFGWPFPSDU-KGLIPLIRSA-N	0	3	340.379	3.438	20	30		EGEDHN
Cc1cc(C(=O)CON=C(N)C2CCCC2)c(C)n1-c1nccs1	ZINC000054211293	1291745583	/nfs/dbraw/zinc/74/55/83/1291745583.db2.gz	LPQWQPWDJUTLKR-UHFFFAOYSA-N	0	3	346.456	3.212	20	30		EGEDHN
CCOc1ccc(CCC(=O)C(C#N)C(=O)NC2CCCCC2)cc1	ZINC000066507613	1292119913	/nfs/dbraw/zinc/11/99/13/1292119913.db2.gz	XSVPHDRWGQOCFS-GOSISDBHSA-N	0	3	342.439	3.176	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C[C@H]2CCCCN2Cc2ccccc2)nc1	ZINC000830975713	1292793902	/nfs/dbraw/zinc/79/39/02/1292793902.db2.gz	ZIKGAYRQGVIWEN-HXUWFJFHSA-N	0	3	347.462	3.190	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)CCCc2ccccc2)c1	ZINC000105261597	1293030273	/nfs/dbraw/zinc/03/02/73/1293030273.db2.gz	IXSRMJRQUVHFCM-SFHVURJKSA-N	0	3	336.391	3.365	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@H](C)CSc1ccccc1	ZINC000111944225	1293113373	/nfs/dbraw/zinc/11/33/73/1293113373.db2.gz	JIYIXBKWUQVGMY-GDBMZVCRSA-N	0	3	332.469	3.430	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)CO[C@H]2CCC[C@H](C)C2)cc1	ZINC000112758960	1293133364	/nfs/dbraw/zinc/13/33/64/1293133364.db2.gz	QAVOMLDMLVKOCE-JCGIZDLHSA-N	0	3	342.439	3.492	20	30		EGEDHN
C=C(Cl)COc1ccc([C@@H](C)N[C@@H]2COC[C@H]2OCC)cc1	ZINC000834902450	1293170073	/nfs/dbraw/zinc/17/00/73/1293170073.db2.gz	AWTYDBDWLJKRFU-KBRIMQKVSA-N	0	3	325.836	3.272	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)C[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000121770189	1293389189	/nfs/dbraw/zinc/38/91/89/1293389189.db2.gz	MMFCVFSWYCGTRM-FZMZJTMJSA-N	0	3	340.345	3.432	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)[C@H](C)Cc1ccc(C(F)(F)F)cc1	ZINC000121771629	1293389343	/nfs/dbraw/zinc/38/93/43/1293389343.db2.gz	MJBMAOPWIPHVFL-BXUZGUMPSA-N	0	3	340.345	3.117	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc3c(c2)N(CCCC)CC3)CC1	ZINC000122723174	1293422894	/nfs/dbraw/zinc/42/28/94/1293422894.db2.gz	SBZCFQLGGCPAJO-UHFFFAOYSA-N	0	3	339.483	3.133	20	30		EGEDHN
C=C(Br)CNC1CCN(c2ccc(N(C)C)cc2)CC1	ZINC000125104225	1293495538	/nfs/dbraw/zinc/49/55/38/1293495538.db2.gz	HEYIRVLBJVAEMJ-UHFFFAOYSA-N	0	3	338.293	3.220	20	30		EGEDHN
CCCSCC(=O)C(C#N)C(=O)Nc1ccc(OC)c(Cl)c1	ZINC000125591663	1293511965	/nfs/dbraw/zinc/51/19/65/1293511965.db2.gz	LCQHRUCTDMDWKX-LLVKDONJSA-N	0	3	340.832	3.139	20	30		EGEDHN
N#CC1(c2ccccc2)CC(NC[C@H]2COC3(CCCCC3)O2)C1	ZINC000128350156	1293590416	/nfs/dbraw/zinc/59/04/16/1293590416.db2.gz	NJHZKXNKJVKWCP-XBMUEBEBSA-N	0	3	326.440	3.276	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)Cc1cccs1	ZINC000128898012	1293607161	/nfs/dbraw/zinc/60/71/61/1293607161.db2.gz	XXTMGSAUPIBATL-CYBMUJFWSA-N	0	3	328.393	3.037	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)c2cccs2)cc1Cl	ZINC000130280088	1293650473	/nfs/dbraw/zinc/65/04/73/1293650473.db2.gz	UVVCNZZDBYFNKD-SNVBAGLBSA-N	0	3	334.784	3.371	20	30		EGEDHN
C=CCc1cc(CN2CCC[C@@H]2CC(=O)OCC)cc(OC)c1O	ZINC000130495563	1293658008	/nfs/dbraw/zinc/65/80/08/1293658008.db2.gz	WLSLJFKZIKCGHI-MRXNPFEDSA-N	0	3	333.428	3.047	20	30		EGEDHN
COc1ccc(C[C@@H](C)C(=O)C(C#N)C(=O)NC2CCCCC2)cc1	ZINC000136584002	1293818354	/nfs/dbraw/zinc/81/83/54/1293818354.db2.gz	CHIKXNHKJRFWNA-RDTXWAMCSA-N	0	3	342.439	3.032	20	30		EGEDHN
N#CCOc1cccc(CNCc2c[nH]nc2-c2ccccc2F)c1	ZINC000152131562	1293954744	/nfs/dbraw/zinc/95/47/44/1293954744.db2.gz	WXKPPVWDBMDTMI-UHFFFAOYSA-N	0	3	336.370	3.408	20	30		EGEDHN
C=CCN(CCc1ccccc1)C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000153786016	1294028474	/nfs/dbraw/zinc/02/84/74/1294028474.db2.gz	LLOKWHICUYEFCA-LJQANCHMSA-N	0	3	326.396	3.359	20	30		EGEDHN
C[C@H](Cc1ccccc1Cl)C(=O)C(C#N)C(=O)NC1CCCC1	ZINC000155179356	1294087536	/nfs/dbraw/zinc/08/75/36/1294087536.db2.gz	RNGDTGXYLBATGF-DOMZBBRYSA-N	0	3	332.831	3.286	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)[C@H](C)c2c(C)noc2C)cc1	ZINC000159769694	1294246675	/nfs/dbraw/zinc/24/66/75/1294246675.db2.gz	GBUMHHIAWKNUQH-BZNIZROVSA-N	0	3	339.395	3.305	20	30		EGEDHN
CC(C)(C)c1nc(CC(=O)C(C#N)C(=O)Nc2ccccc2)cs1	ZINC000170672720	1294376491	/nfs/dbraw/zinc/37/64/91/1294376491.db2.gz	VZWOXNCPFQGHIW-AWEZNQCLSA-N	0	3	341.436	3.331	20	30		EGEDHN
C[C@@H](CCc1ccc(F)cc1)C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000870162497	1295713014	/nfs/dbraw/zinc/71/30/14/1295713014.db2.gz	IVOBSVRNTFTXNV-BBRMVZONSA-N	0	3	339.370	3.137	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)C1C[C@H]2CCC[C@@H](C1)C2=O	ZINC000193263979	1295847604	/nfs/dbraw/zinc/84/76/04/1295847604.db2.gz	ADOYCWFOAICGCK-IXXDHKBRSA-N	0	3	335.407	3.145	20	30		EGEDHN
C#C[C@H](CC)NCc1cc(Br)c(OCC)c(OC)c1	ZINC000229885639	1296159367	/nfs/dbraw/zinc/15/93/67/1296159367.db2.gz	QTMPGJXDHIWNTJ-GFCCVEGCSA-N	0	3	326.234	3.358	20	30		EGEDHN
CN1CCC(N(Cc2ccco2)C(=O)/C=C\c2ccccc2C#N)CC1	ZINC000255101498	1296497868	/nfs/dbraw/zinc/49/78/68/1296497868.db2.gz	IIBMCEPNARRBJY-HJWRWDBZSA-N	0	3	349.434	3.287	20	30		EGEDHN
CN(C)CCN(Cc1cccs1)C(=O)/C=C\c1ccccc1C#N	ZINC000255672981	1296559924	/nfs/dbraw/zinc/55/99/24/1296559924.db2.gz	NSIWLJCKRBYTRJ-KTKRTIGZSA-N	0	3	339.464	3.223	20	30		EGEDHN
CCN1CCN(c2cccc(Nc3c(C#N)cccc3C#N)c2)CC1	ZINC000302880735	1296807355	/nfs/dbraw/zinc/80/73/55/1296807355.db2.gz	IMYHHZXYYVMYDD-UHFFFAOYSA-N	0	3	331.423	3.315	20	30		EGEDHN
C=CC[C@H](CO)C[NH2+]Cc1ccc(OCc2ccccc2)cc1[O-]	ZINC000753572720	1299976335	/nfs/dbraw/zinc/97/63/35/1299976335.db2.gz	WWGUXUOZHFNSCB-KRWDZBQOSA-N	0	3	327.424	3.245	20	30		EGEDHN
CCOC1CC2(C1)CCN(CC[C@@](C#N)(C(C)=O)c1ccccc1)C2	ZINC000878611918	1300107068	/nfs/dbraw/zinc/10/70/68/1300107068.db2.gz	XHWCBYXZJIZVIU-XVAXZDLZSA-N	0	3	340.467	3.318	20	30		EGEDHN
CC1(F)CCN(CC(=O)C(C#N)c2nc3ccccc3s2)CC1	ZINC000879381524	1300509301	/nfs/dbraw/zinc/50/93/01/1300509301.db2.gz	FCXXMJNFTXBEGL-LBPRGKRZSA-N	0	3	331.416	3.297	20	30		EGEDHN
C[C@H](c1ccc(C#N)cc1)N1CC[C@H](N2CC(=O)Nc3ccccc32)C1	ZINC000759892057	1301184781	/nfs/dbraw/zinc/18/47/81/1301184781.db2.gz	FKHHDJVHCMIGFD-QAPCUYQASA-N	0	3	346.434	3.152	20	30		EGEDHN
C#CC[C@H](CO)NCc1cn(C(C)(C)C)nc1-c1ccccc1Cl	ZINC000883123620	1302261330	/nfs/dbraw/zinc/26/13/30/1302261330.db2.gz	FBCHMBDJWGZTER-OAHLLOKOSA-N	0	3	345.874	3.432	20	30		EGEDHN
C=CC[C@H](N[C@H](C)c1ccc(NS(C)(=O)=O)cc1)c1ccncc1	ZINC000766019530	1302370827	/nfs/dbraw/zinc/37/08/27/1302370827.db2.gz	MGVPPCWXQMBKCX-KDOFPFPSSA-N	0	3	345.468	3.421	20	30		EGEDHN
C=CCc1cc(CN2CCC(C(=O)OC(C)C)CC2)c(O)c(OC)c1	ZINC000884476349	1302874206	/nfs/dbraw/zinc/87/42/06/1302874206.db2.gz	NICYEAUUCBOGON-UHFFFAOYSA-N	0	3	347.455	3.293	20	30		EGEDHN
C#C[C@@H](C)N(C)C[C@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000769962071	1303198785	/nfs/dbraw/zinc/19/87/85/1303198785.db2.gz	PVJDROYXGXPYQA-SJORKVTESA-N	0	3	325.408	3.172	20	30		EGEDHN
C#C[C@H](C)N(C)C[C@H](O)CO[C@H](c1ccccc1)c1ccccc1C	ZINC000769976333	1303201142	/nfs/dbraw/zinc/20/11/42/1303201142.db2.gz	ZJHLITDHNDZIQV-RCZSKKKRSA-N	0	3	337.463	3.415	20	30		EGEDHN
C=CCCCCNC(=O)Nc1ccc(N2CCN(CC)CC2)cc1	ZINC000771097121	1303359836	/nfs/dbraw/zinc/35/98/36/1303359836.db2.gz	ORBMKRBDHDHOFI-UHFFFAOYSA-N	0	3	330.476	3.306	20	30		EGEDHN
C[C@@H](N[C@@H](C)C(=O)Nc1cccc(C#N)c1)c1ccc(N(C)C)cc1	ZINC000774478535	1303814768	/nfs/dbraw/zinc/81/47/68/1303814768.db2.gz	GXLZZLKIHOEEDP-CABCVRRESA-N	0	3	336.439	3.302	20	30		EGEDHN
N#CCCNC(=O)CN[C@H](Cc1ccc(Cl)cc1)c1ccccc1	ZINC000775206173	1303925502	/nfs/dbraw/zinc/92/55/02/1303925502.db2.gz	IBWPZMIKOWEBQG-GOSISDBHSA-N	0	3	341.842	3.243	20	30		EGEDHN
C#CCNC(=O)CN[C@H](CC(C)C)c1cccc(C(F)(F)F)c1	ZINC000775323440	1303939167	/nfs/dbraw/zinc/93/91/67/1303939167.db2.gz	FKZPNKXPGYYCGC-OAHLLOKOSA-N	0	3	326.362	3.132	20	30		EGEDHN
C#CC[C@H](NC[C@@H](O)COc1ccc(Cl)cc1)c1ccccc1	ZINC000775400886	1303956997	/nfs/dbraw/zinc/95/69/97/1303956997.db2.gz	SVRJAJBTBWDVKY-MJGOQNOKSA-N	0	3	329.827	3.434	20	30		EGEDHN
C#CC[C@H](NC[C@H](O)COc1ccc(Cl)cc1)c1ccccc1	ZINC000775400884	1303957169	/nfs/dbraw/zinc/95/71/69/1303957169.db2.gz	SVRJAJBTBWDVKY-HKUYNNGSSA-N	0	3	329.827	3.434	20	30		EGEDHN
C=C(C)[C@@H](NC[C@H]1CC(C(=O)OC)=C(C)O1)c1ccc(F)c(F)c1	ZINC000775725836	1304021289	/nfs/dbraw/zinc/02/12/89/1304021289.db2.gz	XIVZBBKEERRINH-CXAGYDPISA-N	0	3	337.366	3.408	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776277430	1304126551	/nfs/dbraw/zinc/12/65/51/1304126551.db2.gz	PHBMAHRNWINREP-LJQANCHMSA-N	0	3	342.395	3.325	20	30		EGEDHN
N#C[C@H](OC(=O)C1CCN(c2ccc(F)cc2)C1=O)C1CCCCC1	ZINC000776378039	1304144161	/nfs/dbraw/zinc/14/41/61/1304144161.db2.gz	HYCSMEYRDPWMPK-IRXDYDNUSA-N	0	3	344.386	3.194	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)Cc2ccccc2CC#N)N(C)C)cc1	ZINC000777372325	1304287302	/nfs/dbraw/zinc/28/73/02/1304287302.db2.gz	HIUNSIRKKGAZRF-FQEVSTJZSA-N	0	3	335.451	3.023	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CNC[C@@H](CO)Cc1ccccc1	ZINC000778160897	1304407184	/nfs/dbraw/zinc/40/71/84/1304407184.db2.gz	YWCWFNVVFPHLPH-KRWDZBQOSA-N	0	3	343.854	3.293	20	30		EGEDHN
CN(C(=O)Nc1ccc(C#N)cn1)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000889226694	1304419068	/nfs/dbraw/zinc/41/90/68/1304419068.db2.gz	MQTZKHVMJQNRBB-GOSISDBHSA-N	0	3	349.438	3.082	20	30		EGEDHN
C#CCCCCCC(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC000780388768	1304685307	/nfs/dbraw/zinc/68/53/07/1304685307.db2.gz	UZYDNUZUZAYWPQ-UHFFFAOYSA-N	0	3	342.483	3.360	20	30		EGEDHN
C#CCCCCCC(=O)N(C)C1CCN(CCc2ccccn2)CC1	ZINC000780696765	1304726254	/nfs/dbraw/zinc/72/62/54/1304726254.db2.gz	FTFCQCUKMMDXQY-UHFFFAOYSA-N	0	3	341.499	3.131	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCC2(OC)CCCCCC2)CC1	ZINC000892851528	1305577232	/nfs/dbraw/zinc/57/72/32/1305577232.db2.gz	LGLQKILIBDMEFI-UHFFFAOYSA-N	0	3	337.508	3.066	20	30		EGEDHN
CC(F)(F)CCC(=O)C(C#N)C(=O)NCc1cccc(Cl)c1	ZINC000786531659	1305591519	/nfs/dbraw/zinc/59/15/19/1305591519.db2.gz	SLQXFGGWZOHBHB-LBPRGKRZSA-N	0	3	328.746	3.100	20	30		EGEDHN
Cc1cccc(CNC(=O)C(C#N)C(=O)CCCC(F)(F)F)c1	ZINC000786538207	1305592564	/nfs/dbraw/zinc/59/25/64/1305592564.db2.gz	DRFSWNGTXMDGTD-ZDUSSCGKSA-N	0	3	326.318	3.053	20	30		EGEDHN
N#CC(C(=O)CCCC(F)(F)F)C(=O)NCc1ccc(F)c(F)c1	ZINC000786569442	1305600419	/nfs/dbraw/zinc/60/04/19/1305600419.db2.gz	NEPYMDGRWOGFAX-SNVBAGLBSA-N	0	3	348.271	3.022	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)[C@H]1CCCCS1)c1ccccc1	ZINC000787046174	1305682567	/nfs/dbraw/zinc/68/25/67/1305682567.db2.gz	PPYZWBLBDYEAEY-HRCADAONSA-N	0	3	330.453	3.248	20	30		EGEDHN
CC(C)(C)c1cnc(CCC(=O)C(C#N)C(=O)NC2CCCCC2)o1	ZINC000788179559	1305888617	/nfs/dbraw/zinc/88/86/17/1305888617.db2.gz	IBYMVKPXOXCOPE-AWEZNQCLSA-N	0	3	345.443	3.062	20	30		EGEDHN
C#C[C@@H](CCC)NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1	ZINC000791060052	1308918596	/nfs/dbraw/zinc/91/85/96/1308918596.db2.gz	YHQCAFQISUZFMA-MJGOQNOKSA-N	0	3	327.472	3.094	20	30		EGEDHN
CC(C)[C@@H](CNCc1ccc(C#N)s1)ONC(=O)OC(C)(C)C	ZINC000895027764	1309162322	/nfs/dbraw/zinc/16/23/22/1309162322.db2.gz	ZAUOTLPRTOXCHD-CQSZACIVSA-N	0	3	339.461	3.190	20	30		EGEDHN
CN1CCN(CCCOc2ccc(C#N)cc2)C[C@@H]1Cc1ccccc1	ZINC000792944131	1309268222	/nfs/dbraw/zinc/26/82/22/1309268222.db2.gz	VZGCZCKCXGKOCB-NRFANRHFSA-N	0	3	349.478	3.186	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(Cl)cc1)C(=O)[C@H]1CCC(F)(F)C1	ZINC000796633744	1310051775	/nfs/dbraw/zinc/05/17/75/1310051775.db2.gz	RNIAPHLDIAUECH-JOYOIKCWSA-N	0	3	326.730	3.423	20	30		EGEDHN
C#CCN(CCCCN1C(=O)c2ccccc2C1=O)Cc1ccccc1	ZINC000796638983	1310054120	/nfs/dbraw/zinc/05/41/20/1310054120.db2.gz	KEHGZSHXRQPECM-UHFFFAOYSA-N	0	3	346.430	3.198	20	30		EGEDHN
N#CC(C(=O)Nc1ccccn1)C(=O)C1CC(c2ccc(F)cc2)C1	ZINC000796776904	1310085354	/nfs/dbraw/zinc/08/53/54/1310085354.db2.gz	YRAPTTYQIOZSRD-XUJLQICISA-N	0	3	337.354	3.062	20	30		EGEDHN
C[C@@H](Cn1ccc2ccccc21)C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000796819138	1310093711	/nfs/dbraw/zinc/09/37/11/1310093711.db2.gz	QBNKUTMQVJABCE-GOEBONIOSA-N	0	3	346.390	3.020	20	30		EGEDHN
C#CCOc1ccc([C@@H](C)NCc2ccc(C[S@](C)=O)cc2)cc1	ZINC000797133207	1310145192	/nfs/dbraw/zinc/14/51/92/1310145192.db2.gz	PWANMCKVTIEWLF-GYCJOSAFSA-N	0	3	341.476	3.428	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](O)c2cccc(Br)c2)s1	ZINC000800288686	1310721942	/nfs/dbraw/zinc/72/19/42/1310721942.db2.gz	XNPKIXPLINZDMF-AWEZNQCLSA-N	0	3	337.242	3.205	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)[C@@H]2CCCC(F)(F)C2)c1	ZINC000800385091	1310747525	/nfs/dbraw/zinc/74/75/25/1310747525.db2.gz	RLIYIHXURMIGDV-RISCZKNCSA-N	0	3	336.338	3.168	20	30		EGEDHN
CC[C@H](C)N[C@@H](CNC(=O)c1cc(C#N)ccc1C)c1ccco1	ZINC000899078624	1310928539	/nfs/dbraw/zinc/92/85/39/1310928539.db2.gz	IQDPKIZTVFIFBF-YOEHRIQHSA-N	0	3	325.412	3.319	20	30		EGEDHN
CCCCN(CC(=O)NC1(C#N)CCCCC1)Cc1ccccc1O	ZINC000801594848	1310971614	/nfs/dbraw/zinc/97/16/14/1310971614.db2.gz	ANSOVOUMHRWUHG-UHFFFAOYSA-N	0	3	343.471	3.337	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)[C@@H]3CC[C@@H]4C[C@@H]4CC3)C2)s1	ZINC001019179565	1317088680	/nfs/dbraw/zinc/08/86/80/1317088680.db2.gz	YFLMLEZANSVXKF-JONQDZQNSA-N	0	3	343.496	3.137	20	30		EGEDHN
CC(C)(C)C(C)(C)C(=O)N1CC[C@H](NCc2ccc(C#N)s2)C1	ZINC001019235955	1317116237	/nfs/dbraw/zinc/11/62/37/1317116237.db2.gz	VDPGEZQZKIVUCM-ZDUSSCGKSA-N	0	3	333.501	3.383	20	30		EGEDHN
C=C[C@@H](C(=O)N1CC[C@H](NCc2cccnc2C)C1)c1ccccc1	ZINC001019804600	1317432025	/nfs/dbraw/zinc/43/20/25/1317432025.db2.gz	BXKAVTXCTQFPSN-VQTJNVASSA-N	0	3	335.451	3.050	20	30		EGEDHN
C#Cc1cncc(C(=O)N(CC)[C@H]2CCN([C@H](C)c3ccccc3)C2)c1	ZINC000807071656	1317548778	/nfs/dbraw/zinc/54/87/78/1317548778.db2.gz	QRXXQBXAGBPAIQ-UTKZUKDTSA-N	0	3	347.462	3.361	20	30		EGEDHN
C=C(Cl)CNC(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000807589807	1317573806	/nfs/dbraw/zinc/57/38/06/1317573806.db2.gz	YFBKRQYAWKYWIC-MRXNPFEDSA-N	0	3	339.867	3.128	20	30		EGEDHN
C#C[C@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)C(C)(C)C	ZINC000808213915	1317645796	/nfs/dbraw/zinc/64/57/96/1317645796.db2.gz	SSXYEUJISXECPS-MSOLQXFVSA-N	0	3	327.472	3.171	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc(C)n(C(CC)CC)n2)C1	ZINC001020332096	1317648796	/nfs/dbraw/zinc/64/87/96/1317648796.db2.gz	CZNUULBBODNDIR-HDJSIYSDSA-N	0	3	338.883	3.156	20	30		EGEDHN
C#C[C@@H](NC(=O)N1CCCN(Cc2ccccc2C)CC1)C(C)(C)C	ZINC000808318543	1317661313	/nfs/dbraw/zinc/66/13/13/1317661313.db2.gz	NNASUHSTMLQGBK-LJQANCHMSA-N	0	3	341.499	3.260	20	30		EGEDHN
CC(C)(C)[C@@H]1C[C@H]1C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001020385410	1317673805	/nfs/dbraw/zinc/67/38/05/1317673805.db2.gz	KQORFYYJHNLQLA-QBPKDAKJSA-N	0	3	343.446	3.116	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2oc3ccccc3c2OC)C1	ZINC001020461019	1317707207	/nfs/dbraw/zinc/70/72/07/1317707207.db2.gz	ZQSKRHHSSDMBQT-HAQNSBGRSA-N	0	3	334.803	3.044	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2CC)C1	ZINC001020520221	1317739759	/nfs/dbraw/zinc/73/97/59/1317739759.db2.gz	BMUWPYYCRLRIIX-UOVPBQLFSA-N	0	3	332.875	3.342	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1)C(=O)c1ccnc(C(F)(F)F)c1	ZINC000808979221	1317756067	/nfs/dbraw/zinc/75/60/67/1317756067.db2.gz	GFPFKBPGVSZKGL-GFCCVEGCSA-N	0	3	333.269	3.062	20	30		EGEDHN
C#Cc1ccc(CN2CC[C@H](NC(=O)OC(C)(C)C)[C@H](C)C2)cc1	ZINC000809575404	1317835797	/nfs/dbraw/zinc/83/57/97/1317835797.db2.gz	BRRCMLAGQHSVFU-QAPCUYQASA-N	0	3	328.456	3.403	20	30		EGEDHN
Cc1nccn1-c1ccc(CN[C@@H]2CCc3ccc(C#N)cc32)cn1	ZINC000810210966	1317977248	/nfs/dbraw/zinc/97/72/48/1317977248.db2.gz	IJLUGEKNKNJPTK-LJQANCHMSA-N	0	3	329.407	3.225	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc3nc(C)sc3c2)C1	ZINC001020877391	1317978496	/nfs/dbraw/zinc/97/84/96/1317978496.db2.gz	SQBSYHFLPFKTRN-JOCQHMNTSA-N	0	3	335.860	3.208	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@H](NC(=O)[C@@H]3CC34CCCC4)C2)c1	ZINC001020883980	1317984004	/nfs/dbraw/zinc/98/40/04/1317984004.db2.gz	XAXMMMVFASFQCD-ULQDDVLXSA-N	0	3	341.430	3.014	20	30		EGEDHN
Cc1ccc(C#N)cc1C(=O)N1c2ccccc2CC[C@H]1CN(C)C	ZINC000905727688	1317986372	/nfs/dbraw/zinc/98/63/72/1317986372.db2.gz	QAAIGNDPYJJDEY-SFHVURJKSA-N	0	3	333.435	3.390	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccsc2C#N)C1	ZINC000906382697	1318090304	/nfs/dbraw/zinc/09/03/04/1318090304.db2.gz	RJVIBGVTTQNCRU-UKRRQHHQSA-N	0	3	325.437	3.185	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)c2ccsc2)s1	ZINC000959862959	1318236545	/nfs/dbraw/zinc/23/65/45/1318236545.db2.gz	HWRDZHOXLYGJRK-AWEZNQCLSA-N	0	3	345.493	3.466	20	30		EGEDHN
C[C@H](NC[C@@H]1CCCCN1C(=O)C#CC1CC1)c1ccccc1F	ZINC000960009331	1318311020	/nfs/dbraw/zinc/31/10/20/1318311020.db2.gz	YTAJVOYYDQADMH-RDJZCZTQSA-N	0	3	328.431	3.271	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@@H](CCCN3C(=O)c3ccco3)C2)c1	ZINC001021507416	1318324955	/nfs/dbraw/zinc/32/49/55/1318324955.db2.gz	YTYKKWQDXIEBFG-OALUTQOASA-N	0	3	349.434	3.278	20	30		EGEDHN
COc1cccc([C@H](C/N=C\c2c(O)cccc2OC)N(C)C)c1	ZINC000812396609	1318381476	/nfs/dbraw/zinc/38/14/76/1318381476.db2.gz	WYWKUWAXNBSPHW-BRLDDBHUSA-N	0	3	328.412	3.131	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cccc(OCCC)c2)C1	ZINC001021590756	1318436833	/nfs/dbraw/zinc/43/68/33/1318436833.db2.gz	DVQYKUDXSLCASY-ICSRJNTNSA-N	0	3	340.467	3.035	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc3occc3c2)C1	ZINC001021594767	1318439266	/nfs/dbraw/zinc/43/92/66/1318439266.db2.gz	PRVOBTCAFQLLHN-RTBURBONSA-N	0	3	336.435	3.383	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccccc1COC	ZINC000960279996	1318442138	/nfs/dbraw/zinc/44/21/38/1318442138.db2.gz	DXFHQJKQCBKITA-WOJBJXKFSA-N	0	3	336.435	3.004	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ncc(Cl)s1	ZINC000960280459	1318442438	/nfs/dbraw/zinc/44/24/38/1318442438.db2.gz	CSYMUYFOPCPUAC-UKRRQHHQSA-N	0	3	347.871	3.358	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc2[nH]nc(C)c2c1	ZINC000960283253	1318443612	/nfs/dbraw/zinc/44/36/12/1318443612.db2.gz	OHAMDUQOYFYDRZ-WOJBJXKFSA-N	0	3	346.434	3.043	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@@H]1CCc2ccccc2C1	ZINC000960314168	1318456838	/nfs/dbraw/zinc/45/68/38/1318456838.db2.gz	WKRXSYZTHVCDDK-CEMLEFRQSA-N	0	3	346.474	3.349	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc(C(C)C)n[nH]1	ZINC000960316435	1318458305	/nfs/dbraw/zinc/45/83/05/1318458305.db2.gz	ZHRSVWBKWOBWRZ-IEBWSBKVSA-N	0	3	338.455	3.095	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cccc3cccnc32)C1	ZINC001021621376	1318470470	/nfs/dbraw/zinc/47/04/70/1318470470.db2.gz	ARZKBORSHYLQEK-AZUAARDMSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc3cc(C)ccc3n2)C1	ZINC001021627026	1318479130	/nfs/dbraw/zinc/47/91/30/1318479130.db2.gz	KJMRWRDKZJXLBB-GHTZIAJQSA-N	0	3	347.462	3.103	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(-c3ccco3)o2)C1	ZINC001021629566	1318483256	/nfs/dbraw/zinc/48/32/56/1318483256.db2.gz	HLXAFQCZYIGJEM-CVEARBPZSA-N	0	3	338.407	3.099	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)/C=C/c1ccco1	ZINC000960377605	1318499719	/nfs/dbraw/zinc/49/97/19/1318499719.db2.gz	LACMFOQGJALTLK-VYENPZKTSA-N	0	3	349.434	3.287	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(F)c(Cl)c2)C1	ZINC001021658469	1318519488	/nfs/dbraw/zinc/51/94/88/1318519488.db2.gz	NPJBKKYEVGOIEJ-MAUKXSAKSA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)Cc2cc(C)ccc2C)C1	ZINC001021661815	1318526149	/nfs/dbraw/zinc/52/61/49/1318526149.db2.gz	RSACPPKUYPEIAC-CTNGQTDRSA-N	0	3	338.495	3.182	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)C[C@@H]1C=CCC1	ZINC000960401793	1318529202	/nfs/dbraw/zinc/52/92/02/1318529202.db2.gz	ZGECNQMAJFQIKN-XLIONFOSSA-N	0	3	337.467	3.337	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cccc(Cl)c2F)C1	ZINC001021667023	1318529512	/nfs/dbraw/zinc/52/95/12/1318529512.db2.gz	YMGQJUFDAQJQPM-BBRMVZONSA-N	0	3	334.822	3.039	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cccc(F)c2Cl)C1	ZINC001021677341	1318546449	/nfs/dbraw/zinc/54/64/49/1318546449.db2.gz	QAKKNEIVOTUPCT-RHSMWYFYSA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc3c(c2)C=CCC3)C1	ZINC001021685273	1318559278	/nfs/dbraw/zinc/55/92/78/1318559278.db2.gz	PQUHLWCYUJMCEE-RTWAWAEBSA-N	0	3	334.463	3.206	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cccn2C2CCCC2)C1	ZINC001021691421	1318565689	/nfs/dbraw/zinc/56/56/89/1318565689.db2.gz	AOCAPBXUUWPRBU-IEBWSBKVSA-N	0	3	339.483	3.163	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc3nc(C)ccc3c2)C1	ZINC001021697047	1318570740	/nfs/dbraw/zinc/57/07/40/1318570740.db2.gz	NMMDDQOBSYDKHB-CTNGQTDRSA-N	0	3	347.462	3.103	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(F)cc2C)C1	ZINC001021718762	1318601958	/nfs/dbraw/zinc/60/19/58/1318601958.db2.gz	JNXSIAOWFMNGGE-APWZRJJASA-N	0	3	328.431	3.084	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2cc(C)ccc2F)C1	ZINC001021720913	1318605314	/nfs/dbraw/zinc/60/53/14/1318605314.db2.gz	ZUVMEBKYERWKMI-FXAWDEMLSA-N	0	3	342.458	3.013	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(C)c(CC)s2)C1	ZINC001021728587	1318626350	/nfs/dbraw/zinc/62/63/50/1318626350.db2.gz	APMNCUITGLSBQA-HOTGVXAUSA-N	0	3	330.497	3.179	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc3cc(C)ccc3o2)C1	ZINC001021742355	1318654202	/nfs/dbraw/zinc/65/42/02/1318654202.db2.gz	KGCMPKLJECJCDS-FUHWJXTLSA-N	0	3	336.435	3.301	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@@H](NC(=O)CC3=CCCCC3)C2)c1	ZINC001021902234	1318725519	/nfs/dbraw/zinc/72/55/19/1318725519.db2.gz	NZKSYRXGFAVGTE-HDICACEKSA-N	0	3	341.430	3.325	20	30		EGEDHN
CN(Cc1cccc(C(F)F)c1)C[C@@H]1CCCN1C(=O)C#CC1CC1	ZINC000960612393	1318738524	/nfs/dbraw/zinc/73/85/24/1318738524.db2.gz	GESHZCORVCNMEA-SFHVURJKSA-N	0	3	346.421	3.460	20	30		EGEDHN
Cc1sccc1C(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001022048288	1318779695	/nfs/dbraw/zinc/77/96/95/1318779695.db2.gz	MOCUCFFYRHYKMA-GASCZTMLSA-N	0	3	343.427	3.118	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)c2sccc2Cl)C1	ZINC001022122971	1318803317	/nfs/dbraw/zinc/80/33/17/1318803317.db2.gz	AMMPHRBXWQIIOW-DTORHVGOSA-N	0	3	349.681	3.161	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)NCc1ccc(-c2csc(C)n2)s1	ZINC000912132724	1318828741	/nfs/dbraw/zinc/82/87/41/1318828741.db2.gz	KTMIHUMAVLOHOD-ZDUSSCGKSA-N	0	3	335.498	3.480	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)Nc1cccc(NC(=O)NC)c1	ZINC000912208545	1318848654	/nfs/dbraw/zinc/84/86/54/1318848654.db2.gz	RHUUMQHBXXWCDN-MRXNPFEDSA-N	0	3	334.464	3.454	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000912323603	1318869004	/nfs/dbraw/zinc/86/90/04/1318869004.db2.gz	YNRNCJFNEDNIOI-MRXNPFEDSA-N	0	3	333.476	3.371	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)[C@]2(C)CCC[C@H]2CC)C1	ZINC001022285825	1318877031	/nfs/dbraw/zinc/87/70/31/1318877031.db2.gz	MGHKBNKEZKVXTB-HGTKMLMNSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]1CN(C)C[C@H]1CC(C)(C)CO1	ZINC000960789420	1318894026	/nfs/dbraw/zinc/89/40/26/1318894026.db2.gz	WNTZGASKGOAXSK-IAGOWNOFSA-N	0	3	336.520	3.327	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)[C@@H]1CCC1(C)C	ZINC000960814397	1318937007	/nfs/dbraw/zinc/93/70/07/1318937007.db2.gz	JAPNZRCDQCEVJR-MOPGFXCFSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)Cc2ccc(C3CCC3)cc2)C1	ZINC001022506560	1318971130	/nfs/dbraw/zinc/97/11/30/1318971130.db2.gz	VFEWOEJLJDJDKG-HDICACEKSA-N	0	3	332.875	3.486	20	30		EGEDHN
CCC(C)(C)C(=O)N1CCC[C@H]1CN(C)Cc1ccc(C#N)cc1	ZINC000960840375	1318974980	/nfs/dbraw/zinc/97/49/80/1318974980.db2.gz	NGCPOAFDPWYPNV-SFHVURJKSA-N	0	3	327.472	3.417	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N1CCC[C@@H]1CN(C)Cc1ccc(C#N)cc1	ZINC000960847556	1318985692	/nfs/dbraw/zinc/98/56/92/1318985692.db2.gz	PRCYRKKDBWGTMJ-VAMGGRTRSA-N	0	3	339.483	3.417	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H]1CN(C)Cc1cccc(C#N)c1)C(C)(F)F	ZINC000960869616	1319014752	/nfs/dbraw/zinc/01/47/52/1319014752.db2.gz	OWFZGJMNCWSDMW-PBHICJAKSA-N	0	3	349.425	3.272	20	30		EGEDHN
C[C@H]1CCC[C@@H](C(=O)N[C@H]2C[C@@H](NCc3cc(C#N)ccc3F)C2)C1	ZINC001022623948	1319025239	/nfs/dbraw/zinc/02/52/39/1319025239.db2.gz	ZWHVWUDSXXDKIT-UNQWWWNPSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc(C)oc2C(F)(F)F)C1	ZINC001022782650	1319108543	/nfs/dbraw/zinc/10/85/43/1319108543.db2.gz	DXKXLLJDQLBXBK-AOOOYVTPSA-N	0	3	336.741	3.210	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)[C@H]2C[C@@]2(CC)C(C)C)C1	ZINC001022913773	1319163682	/nfs/dbraw/zinc/16/36/82/1319163682.db2.gz	RUXOXTHUCJWINC-CTASWTNQSA-N	0	3	343.309	3.204	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)[C@H]2C[C@]2(CC)C(C)C)C1	ZINC001022913775	1319164268	/nfs/dbraw/zinc/16/42/68/1319164268.db2.gz	RUXOXTHUCJWINC-HLPPOEQASA-N	0	3	343.309	3.204	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cnc(CC(C)(C)C)s2)C1	ZINC001022941126	1319182049	/nfs/dbraw/zinc/18/20/49/1319182049.db2.gz	JUSIPCHUEIDHDG-TXEJJXNPSA-N	0	3	341.908	3.335	20	30		EGEDHN
CCN1CCN(c2ccc(NC(=O)c3cccc(CC#N)c3)cc2)CC1	ZINC000915827856	1319543825	/nfs/dbraw/zinc/54/38/25/1319543825.db2.gz	LWBXCFDDEOVXEP-UHFFFAOYSA-N	0	3	348.450	3.147	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CCCN(Cc3ccccn3)C2)CC1	ZINC001023572425	1319688260	/nfs/dbraw/zinc/68/82/60/1319688260.db2.gz	CIKSDGBWBLNANO-KRWDZBQOSA-N	0	3	327.472	3.156	20	30		EGEDHN
C[C@@H](Oc1ccccc1)C(=O)C(C#N)C(=O)Nc1ccccc1Cl	ZINC000916905892	1319723146	/nfs/dbraw/zinc/72/31/46/1319723146.db2.gz	NZAUQACNUMKARZ-OCCSQVGLSA-N	0	3	342.782	3.455	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2[nH]c3ccc(C)cc3c2C)C1	ZINC001023680157	1319794975	/nfs/dbraw/zinc/79/49/75/1319794975.db2.gz	SWEABYPFIQGBPW-KRWDZBQOSA-N	0	3	337.467	3.250	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc(F)c(F)cc2Cl)C1	ZINC001023733846	1319874853	/nfs/dbraw/zinc/87/48/53/1319874853.db2.gz	TVJYMEFYNWAXHE-LBPRGKRZSA-N	0	3	340.801	3.083	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2sc(C(C)(C)C)nc2C)C1	ZINC001023774494	1319924756	/nfs/dbraw/zinc/92/47/56/1319924756.db2.gz	LEHGMBUNUCVJBF-OAHLLOKOSA-N	0	3	347.528	3.214	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000823618135	1320192678	/nfs/dbraw/zinc/19/26/78/1320192678.db2.gz	NWSRZSGQAWPLON-FZKQIMNGSA-N	0	3	325.368	3.193	20	30		EGEDHN
COc1cc(C#N)ccc1C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1	ZINC000930508108	1328881164	/nfs/dbraw/zinc/88/11/64/1328881164.db2.gz	NIYMFVSUPUBKGS-MAUKXSAKSA-N	0	3	349.434	3.132	20	30		EGEDHN
C=CCOc1ccc(/C=C/C(=O)OCCN2CCCCC2)cc1OC	ZINC000858971091	1328902066	/nfs/dbraw/zinc/90/20/66/1328902066.db2.gz	YGZAEMAXIAFMKO-CSKARUKUSA-N	0	3	345.439	3.302	20	30		EGEDHN
CCCCCCCOc1ccc(CN2CC[C@H](O)[C@H](CO)C2)cc1	ZINC000840976968	1321192078	/nfs/dbraw/zinc/19/20/78/1321192078.db2.gz	ZWJHQIICEMWRAL-ICSRJNTNSA-N	0	3	335.488	3.211	20	30		EGEDHN
N#CC(C(=O)c1ccc(N)c([N+](=O)[O-])c1)c1nc(C2CC2)cs1	ZINC000842938955	1321451096	/nfs/dbraw/zinc/45/10/96/1321451096.db2.gz	MXGUKDWZHTYGKP-JTQLQIEISA-N	0	3	328.353	3.001	20	30		EGEDHN
C[C@@H](NC(=O)c1cccs1)C(=O)C(C#N)c1nc(C2CC2)cs1	ZINC000842938174	1321451122	/nfs/dbraw/zinc/45/11/22/1321451122.db2.gz	IYIGMYQMJGYHBX-MWLCHTKSSA-N	0	3	345.449	3.077	20	30		EGEDHN
CN1CCN(CCCOc2ccc(C#N)cc2)[C@@H](Cc2ccccc2)C1	ZINC000844424359	1321604792	/nfs/dbraw/zinc/60/47/92/1321604792.db2.gz	FFLJTBTZBFFUNL-NRFANRHFSA-N	0	3	349.478	3.186	20	30		EGEDHN
CCC(C)(C)N1CCN(C(=O)Nc2ccc(F)cc2OCC#N)CC1	ZINC000847167501	1321847237	/nfs/dbraw/zinc/84/72/37/1321847237.db2.gz	VKDNJMXLMKOTLV-UHFFFAOYSA-N	0	3	348.422	3.066	20	30		EGEDHN
CS[C@H](C)C(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847745351	1321899679	/nfs/dbraw/zinc/89/96/79/1321899679.db2.gz	HKIPXLMEHIITSP-OAHLLOKOSA-N	0	3	332.469	3.087	20	30		EGEDHN
C#CCCOc1ccc(CNCc2ccccc2CC(=O)OC)cc1	ZINC000848579190	1321979375	/nfs/dbraw/zinc/97/93/75/1321979375.db2.gz	VVOQQVXTVZRNPE-UHFFFAOYSA-N	0	3	337.419	3.094	20	30		EGEDHN
N#C[C@H]1CCCN(C(=O)N[C@H](CN2CCCCC2)c2ccccc2)C1	ZINC000918861645	1322005512	/nfs/dbraw/zinc/00/55/12/1322005512.db2.gz	PJDQENDAVIUIPK-IEBWSBKVSA-N	0	3	340.471	3.159	20	30		EGEDHN
CC[C@H](C[C@@H](C)CO)NCc1cc(C#N)ccc1Br	ZINC000921807398	1322401254	/nfs/dbraw/zinc/40/12/54/1322401254.db2.gz	QAXJCNWENNVVOY-BXUZGUMPSA-N	0	3	325.250	3.207	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1cnn(CCC(C)C)c1C(C)C	ZINC000931082793	1329045223	/nfs/dbraw/zinc/04/52/23/1329045223.db2.gz	CURBFANBQKIZLO-UHFFFAOYSA-N	0	3	347.507	3.129	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H](CNCc2cc(F)ccc2C#N)C1)C1CC1	ZINC001023914912	1323021912	/nfs/dbraw/zinc/02/19/12/1323021912.db2.gz	DVKXOONCEIIQGB-LSDHHAIUSA-N	0	3	343.446	3.072	20	30		EGEDHN
C[C@H](NC[C@@H]1CCCN(C(=O)C#CC2CC2)C1)c1c(F)cccc1F	ZINC001023980982	1323063096	/nfs/dbraw/zinc/06/30/96/1323063096.db2.gz	GAAGQMXUJIDTHN-HOCLYGCPSA-N	0	3	346.421	3.267	20	30		EGEDHN
CN(Cc1cc(Cl)ccc1OCC#N)[C@H](CO)Cc1ccccc1	ZINC000852289306	1323174624	/nfs/dbraw/zinc/17/46/24/1323174624.db2.gz	NVSHZHAPYWXYMK-SFHVURJKSA-N	0	3	344.842	3.278	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCN(C(=O)C2(CF)CCC2)C1	ZINC001024163869	1323181286	/nfs/dbraw/zinc/18/12/86/1323181286.db2.gz	OZZMZTBVJMGQSC-INIZCTEOSA-N	0	3	343.446	3.026	20	30		EGEDHN
C=C(Br)CNC1CCC(N(C)C(=O)CC2CC2)CC1	ZINC000962993087	1323181601	/nfs/dbraw/zinc/18/16/01/1323181601.db2.gz	APPXGDBDXMIDCS-UHFFFAOYSA-N	0	3	329.282	3.054	20	30		EGEDHN
C=CCN(C[C@H](O)c1ccc(F)c(Br)c1)[C@H](C)COC	ZINC000852356294	1323182019	/nfs/dbraw/zinc/18/20/19/1323182019.db2.gz	AGKJNSUEPMCDEH-ABAIWWIYSA-N	0	3	346.240	3.145	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCC[C@H](CNCc2ccccc2C#N)C1	ZINC001024186257	1323197370	/nfs/dbraw/zinc/19/73/70/1323197370.db2.gz	OCYXAJMFWPGGOT-DLBZAZTESA-N	0	3	327.472	3.179	20	30		EGEDHN
C[C@@H](CC(C)(C)C#N)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000924882492	1323198789	/nfs/dbraw/zinc/19/87/89/1323198789.db2.gz	QDQGCBSREDAEHD-FUHWJXTLSA-N	0	3	327.472	3.138	20	30		EGEDHN
Cc1cc(C)cc([C@@H](NC2CCN(CC#N)CC2)c2cccnc2)c1	ZINC000925001833	1323242117	/nfs/dbraw/zinc/24/21/17/1323242117.db2.gz	HJJYYGFZMSLGDJ-NRFANRHFSA-N	0	3	334.467	3.365	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@@H]([C@H]2CCCN2Cc2ccccc2C#N)C1	ZINC000963260698	1323273582	/nfs/dbraw/zinc/27/35/82/1323273582.db2.gz	VTOZUXCZGGSBEM-WOJBJXKFSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cccc2scnc21	ZINC001024438446	1323400624	/nfs/dbraw/zinc/40/06/24/1323400624.db2.gz	OVZBEPOGSBFKBA-AWEZNQCLSA-N	0	3	329.469	3.457	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1nsc2ccccc21	ZINC001024452910	1323410044	/nfs/dbraw/zinc/41/00/44/1323410044.db2.gz	CGRNNTDMVSRUEH-CQSZACIVSA-N	0	3	329.469	3.457	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1c(Cl)n[nH]c1C1CC1	ZINC001024477101	1323429712	/nfs/dbraw/zinc/42/97/12/1323429712.db2.gz	ILDFNZRTEGKJAQ-CYBMUJFWSA-N	0	3	336.867	3.101	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cn(C)c2ccc(F)cc12	ZINC001024479204	1323433508	/nfs/dbraw/zinc/43/35/08/1323433508.db2.gz	BUKXITIVVYAAAI-MRXNPFEDSA-N	0	3	343.446	3.478	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccc2c(c1)[C@@H](C)CO2	ZINC001024617901	1323547480	/nfs/dbraw/zinc/54/74/80/1323547480.db2.gz	NCCRJSMWOWVOBX-DOTOQJQBSA-N	0	3	328.456	3.343	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cc2ccccc2n1C	ZINC001024621016	1323548498	/nfs/dbraw/zinc/54/84/98/1323548498.db2.gz	HXVFWILFMQCBOC-KRWDZBQOSA-N	0	3	325.456	3.339	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CCCCN2CCOC2CCC2)CC1	ZINC001024634708	1323560632	/nfs/dbraw/zinc/56/06/32/1323560632.db2.gz	WEHXNLMMTHSWFB-SFHVURJKSA-N	0	3	334.504	3.273	20	30		EGEDHN
N#CC1(CCCCN2CCN(CCc3ccncc3)CC2)CCC1	ZINC000931339545	1329097849	/nfs/dbraw/zinc/09/78/49/1329097849.db2.gz	SVMVCFFULLGDKG-UHFFFAOYSA-N	0	3	326.488	3.106	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@H]2CCCCN2CC2=CCCCC2)c1	ZINC001024644686	1323568614	/nfs/dbraw/zinc/56/86/14/1323568614.db2.gz	VEYGVYOKKHNHPF-HXUWFJFHSA-N	0	3	337.467	3.148	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@@H]2CCCCN2CC2=CCCCC2)c1	ZINC001024644682	1323569112	/nfs/dbraw/zinc/56/91/12/1323569112.db2.gz	VEYGVYOKKHNHPF-FQEVSTJZSA-N	0	3	337.467	3.148	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cn(C)nc1C1CCCC1	ZINC001024644945	1323570447	/nfs/dbraw/zinc/57/04/47/1323570447.db2.gz	CCJGNHANUKPMJN-KRWDZBQOSA-N	0	3	344.503	3.238	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1cc(C)oc1C(F)(F)F	ZINC001024686009	1323602541	/nfs/dbraw/zinc/60/25/41/1323602541.db2.gz	TWQLSUUHPBZALI-ZDUSSCGKSA-N	0	3	342.361	3.214	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccc(-c2ccccc2)nc1	ZINC001024727474	1323629636	/nfs/dbraw/zinc/62/96/36/1323629636.db2.gz	LJAUBNIMUVSBHB-FQEVSTJZSA-N	0	3	347.462	3.356	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cccc(F)c1OCC	ZINC001024732991	1323633402	/nfs/dbraw/zinc/63/34/02/1323633402.db2.gz	YWZMFPAINCSRBB-HNNXBMFYSA-N	0	3	334.435	3.385	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cc2c(cccc2OC)[nH]1	ZINC001024796432	1323701897	/nfs/dbraw/zinc/70/18/97/1323701897.db2.gz	AOWRUMUNXYZGOM-HNNXBMFYSA-N	0	3	341.455	3.337	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cc(OC)c(OC)cc1C	ZINC001024808928	1323711397	/nfs/dbraw/zinc/71/13/97/1323711397.db2.gz	MIIRSQHRSCHMOH-MRXNPFEDSA-N	0	3	346.471	3.173	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1c[nH]c2ccc(F)cc12	ZINC001024824155	1323726658	/nfs/dbraw/zinc/72/66/58/1323726658.db2.gz	CPXLAPZTOCNFOY-OAHLLOKOSA-N	0	3	329.419	3.467	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccc(N(CC)CC)nc1	ZINC001024822158	1323727035	/nfs/dbraw/zinc/72/70/35/1323727035.db2.gz	YSEZZEZCMZQNBS-GOSISDBHSA-N	0	3	344.503	3.088	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1cscc1C(F)(F)F	ZINC001024833950	1323734952	/nfs/dbraw/zinc/73/49/52/1323734952.db2.gz	MTPSCYRHKGYNJB-LBPRGKRZSA-N	0	3	344.402	3.375	20	30		EGEDHN
Cc1ccoc1C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)s1	ZINC001024868941	1323758410	/nfs/dbraw/zinc/75/84/10/1323758410.db2.gz	FQJFJUDCOJHRFT-CQSZACIVSA-N	0	3	343.452	3.306	20	30		EGEDHN
C/C(=C/C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)s1)C1CC1	ZINC001024882392	1323763582	/nfs/dbraw/zinc/76/35/82/1323763582.db2.gz	GAJCLDBYINFSPU-SCOADAFUSA-N	0	3	343.496	3.447	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCCC[C@@H]1CNCc1ccc(OC)nc1	ZINC001025069231	1323869275	/nfs/dbraw/zinc/86/92/75/1323869275.db2.gz	DVYXWMMMKHPWLJ-YLJYHZDGSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCCC[C@@H]1CNCc1n[nH]c(C(C)C)n1	ZINC001025069401	1323871272	/nfs/dbraw/zinc/87/12/72/1323871272.db2.gz	JTCPJJLMKIZBNX-DNVCBOLYSA-N	0	3	347.507	3.001	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001025091889	1323888437	/nfs/dbraw/zinc/88/84/37/1323888437.db2.gz	ROCZEXNBSVBEAP-KBAYOESNSA-N	0	3	343.446	3.214	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)s1	ZINC001025101641	1323895737	/nfs/dbraw/zinc/89/57/37/1323895737.db2.gz	HMZOGYIUBKDAGB-LSDHHAIUSA-N	0	3	333.501	3.383	20	30		EGEDHN
CCC(=O)N1CCCC[C@H]1[C@H]1CCCN1Cc1ccc(C#N)s1	ZINC001025186463	1323959673	/nfs/dbraw/zinc/95/96/73/1323959673.db2.gz	XDHXPZBFWQDHFD-SJORKVTESA-N	0	3	331.485	3.375	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1scnc1C	ZINC001025197016	1323981993	/nfs/dbraw/zinc/98/19/93/1323981993.db2.gz	FEZUKQKGSHGZJX-JKSUJKDBSA-N	0	3	333.501	3.487	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cccc(C)c1F	ZINC001025234266	1324022036	/nfs/dbraw/zinc/02/20/36/1324022036.db2.gz	GNNSMVPBGXOUOA-ZWKOTPCHSA-N	0	3	328.431	3.226	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)CCc1ccsc1	ZINC001025239357	1324030653	/nfs/dbraw/zinc/03/06/53/1324030653.db2.gz	DLXKJDZMZPRKKF-QZTJIDSGSA-N	0	3	330.497	3.159	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccnc(CCC)c1	ZINC001025240086	1324032769	/nfs/dbraw/zinc/03/27/69/1324032769.db2.gz	LAMZPIKCRSMZMU-WOJBJXKFSA-N	0	3	339.483	3.126	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ncccc1CC	ZINC001025244698	1324042050	/nfs/dbraw/zinc/04/20/50/1324042050.db2.gz	JSFPTPWCUALVFV-QZTJIDSGSA-N	0	3	327.472	3.289	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1nc(C)sc1C	ZINC001025245049	1324043303	/nfs/dbraw/zinc/04/33/03/1324043303.db2.gz	ZEQYNOLTZMLEGP-DLBZAZTESA-N	0	3	345.512	3.242	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)CCc1ccc(F)cc1	ZINC001025248359	1324049384	/nfs/dbraw/zinc/04/93/84/1324049384.db2.gz	YWKZDXCIHYGYFA-PMACEKPBSA-N	0	3	342.458	3.237	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)C1(C2CCC2)CCC1	ZINC001025256508	1324065026	/nfs/dbraw/zinc/06/50/26/1324065026.db2.gz	YCFUAVPJINRJQA-RBUKOAKNSA-N	0	3	328.500	3.436	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc[nH]c1CCC	ZINC001025263552	1324074276	/nfs/dbraw/zinc/07/42/76/1324074276.db2.gz	NQYPVKNVYBUNAI-MOPGFXCFSA-N	0	3	327.472	3.060	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc(C(C)C)cn1	ZINC001025269453	1324082406	/nfs/dbraw/zinc/08/24/06/1324082406.db2.gz	QIRSNOJUJMICFJ-WOJBJXKFSA-N	0	3	339.483	3.297	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc(C(C)C)cn1	ZINC001025269450	1324082581	/nfs/dbraw/zinc/08/25/81/1324082581.db2.gz	QIRSNOJUJMICFJ-PMACEKPBSA-N	0	3	339.483	3.297	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)C1(C(C)(F)F)CC1	ZINC001025273545	1324088627	/nfs/dbraw/zinc/08/86/27/1324088627.db2.gz	QBICDDQHBAZIKN-HZPDHXFCSA-N	0	3	338.442	3.291	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1noc2c1CCCC2	ZINC001025274065	1324090173	/nfs/dbraw/zinc/09/01/73/1324090173.db2.gz	UAXOHYDSUQKHMG-SJORKVTESA-N	0	3	343.471	3.199	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ncoc1C1CC1	ZINC001025284419	1324106681	/nfs/dbraw/zinc/10/66/81/1324106681.db2.gz	HAKABVLUVPSRAF-IRXDYDNUSA-N	0	3	341.455	3.034	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ncoc1C(C)C	ZINC001025286888	1324108678	/nfs/dbraw/zinc/10/86/78/1324108678.db2.gz	LYAXBCPREBJVQB-IRXDYDNUSA-N	0	3	343.471	3.280	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cccc2ccncc21	ZINC001025287502	1324109006	/nfs/dbraw/zinc/10/90/06/1324109006.db2.gz	OLKYZPVEDHRJOM-RTWAWAEBSA-N	0	3	347.462	3.327	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cccc(OC)c1	ZINC001025292956	1324119129	/nfs/dbraw/zinc/11/91/29/1324119129.db2.gz	NOLMJADFDNQMJI-VQTJNVASSA-N	0	3	340.467	3.178	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)CCc1ccccc1F	ZINC001025294474	1324124552	/nfs/dbraw/zinc/12/45/52/1324124552.db2.gz	KIYBROSOCOPWHQ-UXHICEINSA-N	0	3	342.458	3.237	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(C)n(C)c1C	ZINC001025297116	1324129470	/nfs/dbraw/zinc/12/94/70/1324129470.db2.gz	OJJLJKXFJNDEPL-PMACEKPBSA-N	0	3	341.499	3.124	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cncc2ccccc21	ZINC001025301875	1324134821	/nfs/dbraw/zinc/13/48/21/1324134821.db2.gz	QHZLZCQNZWZOQP-RTWAWAEBSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(F)c3ccccc3c2)C1	ZINC001025437506	1324277158	/nfs/dbraw/zinc/27/71/58/1324277158.db2.gz	WSZMZVWUPVXKGK-WBVHZDCISA-N	0	3	338.426	3.442	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2oc3c(cccc3F)c2C)C1	ZINC001025441584	1324281271	/nfs/dbraw/zinc/28/12/71/1324281271.db2.gz	FUFTZGFWGCYHLB-HUUCEWRRSA-N	0	3	342.414	3.344	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc3cc(F)ccc3[nH]2)C1	ZINC001025503257	1324351321	/nfs/dbraw/zinc/35/13/21/1324351321.db2.gz	PSAZZPNSCPHZJI-HUUCEWRRSA-N	0	3	341.430	3.161	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2c(F)ccc(C)c2F)C1	ZINC001025524003	1324370144	/nfs/dbraw/zinc/37/01/44/1324370144.db2.gz	RLMNRLRETIVLFW-GJZGRUSLSA-N	0	3	334.410	3.127	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(C)oc2C(F)(F)F)C1	ZINC001025546675	1324395336	/nfs/dbraw/zinc/39/53/36/1324395336.db2.gz	SMWORNTUVPJUPO-QWHCGFSZSA-N	0	3	342.361	3.070	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc3cccnc3c2)C1	ZINC001025563504	1324410558	/nfs/dbraw/zinc/41/05/58/1324410558.db2.gz	CTIBEHWDCDAUHL-VQIMIIECSA-N	0	3	335.451	3.088	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccccc2OCC(C)C)C1	ZINC001025565614	1324411874	/nfs/dbraw/zinc/41/18/74/1324411874.db2.gz	SOTQSALVFVIHEK-QZTJIDSGSA-N	0	3	342.483	3.185	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc3ccn(C)c3c2)C1	ZINC001025586814	1324430056	/nfs/dbraw/zinc/43/00/56/1324430056.db2.gz	FXEGPPNPVIOAGY-LPHOPBHVSA-N	0	3	337.467	3.032	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cnc(CC(C)C)s2)C1	ZINC001025632356	1324483947	/nfs/dbraw/zinc/48/39/47/1324483947.db2.gz	JYXSEMCBQSKCMR-HZPDHXFCSA-N	0	3	347.528	3.195	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H]2CC[C@@H](NCc3nccs3)[C@@H]2C1	ZINC001026327155	1324728794	/nfs/dbraw/zinc/72/87/94/1324728794.db2.gz	XYGHBMBDFGLUSV-RRFJBIMHSA-N	0	3	333.501	3.072	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H]3CC[C@@H](NCc4cscn4)[C@@H]3C2)CC1	ZINC001026346150	1324743480	/nfs/dbraw/zinc/74/34/80/1324743480.db2.gz	FAJDSVMWKWUZRQ-CGTJXYLNSA-N	0	3	345.512	3.216	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)C[C@@H]2C=CCC2)CC1	ZINC001026449824	1324813221	/nfs/dbraw/zinc/81/32/21/1324813221.db2.gz	CJVAFUKZWAFYPZ-WLYUNCDWSA-N	0	3	341.293	3.268	20	30		EGEDHN
N#Cc1ccccc1CNC1CCC(NC(=O)C[C@H]2C=CCC2)CC1	ZINC001026450153	1324814433	/nfs/dbraw/zinc/81/44/33/1324814433.db2.gz	MEGVISFHFBRKAE-DZIBYMRMSA-N	0	3	337.467	3.432	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC1CCC(NC(=O)[C@@H]2CC23CC3)CC1	ZINC001026566778	1324900129	/nfs/dbraw/zinc/90/01/29/1324900129.db2.gz	OILMYMDLGKGMCJ-ABHNRTSZSA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)c2c(C)ccn2C)C1	ZINC000963291898	1325078047	/nfs/dbraw/zinc/07/80/47/1325078047.db2.gz	AEPKATLNSSWLLZ-SJORKVTESA-N	0	3	349.906	3.403	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)c2cccnc2C)C1	ZINC000963350080	1325142441	/nfs/dbraw/zinc/14/24/41/1325142441.db2.gz	YFBHNNNLKKGEJM-AEFFLSMTSA-N	0	3	347.890	3.459	20	30		EGEDHN
CC1(C)CCC[C@H]1C(=O)N1CC[C@H](CNCc2ccccc2C#N)C1	ZINC001027003801	1325143575	/nfs/dbraw/zinc/14/35/75/1325143575.db2.gz	ZKJDLXISEYSNGM-APWZRJJASA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@H](CNCc2nc(C)sc2C)C1	ZINC001027037880	1325172506	/nfs/dbraw/zinc/17/25/06/1325172506.db2.gz	DDDZVIHXKKATBV-YJBOKZPZSA-N	0	3	335.517	3.300	20	30		EGEDHN
CCC(C#N)C(=O)N1[C@H](C(=O)OCc2ccccc2)C[C@@H]2CCC[C@@H]21	ZINC000925559353	1325209751	/nfs/dbraw/zinc/20/97/51/1325209751.db2.gz	XTELILVPBWYDIT-XSLAGTTESA-N	0	3	340.423	3.049	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)C2CCCC2)C1	ZINC001027268713	1325370003	/nfs/dbraw/zinc/37/00/03/1325370003.db2.gz	VXBOYGQMEOOXNB-IBGZPJMESA-N	0	3	325.456	3.171	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@H](N(C)Cc2ccc(F)c(C#N)c2)C1	ZINC001027276906	1325391997	/nfs/dbraw/zinc/39/19/97/1325391997.db2.gz	RTXMLMPWXMBVEK-KRWDZBQOSA-N	0	3	331.435	3.166	20	30		EGEDHN
N#CCCc1ccc(NC(=O)NC[C@@H]2NCCc3ccccc32)cc1	ZINC000926192303	1325464650	/nfs/dbraw/zinc/46/46/50/1325464650.db2.gz	DVRMHMGQUNVWPF-IBGZPJMESA-N	0	3	334.423	3.151	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)CCC2CC2)C1	ZINC001027338643	1325498889	/nfs/dbraw/zinc/49/88/89/1325498889.db2.gz	MORFCEBPJXPCDU-IBGZPJMESA-N	0	3	325.456	3.171	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)c(F)c2)C1)C1CC1	ZINC001027352543	1325521275	/nfs/dbraw/zinc/52/12/75/1325521275.db2.gz	XCGKOVFUNPJDSE-KDOFPFPSSA-N	0	3	343.446	3.166	20	30		EGEDHN
CC[C@@H](SC)C(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001027371383	1325564686	/nfs/dbraw/zinc/56/46/86/1325564686.db2.gz	ADNZZRYLHYGYRX-ZWKOTPCHSA-N	0	3	345.512	3.123	20	30		EGEDHN
CCC[C@H](OCC)C(=O)C(C#N)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000860474047	1329321796	/nfs/dbraw/zinc/32/17/96/1329321796.db2.gz	VRLONIPAMPSKQM-RISCZKNCSA-N	0	3	340.782	3.332	20	30		EGEDHN
COC1CC(C(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2Cl)C1	ZINC000860473288	1329321820	/nfs/dbraw/zinc/32/18/20/1329321820.db2.gz	KLTXIUFKKJKDQV-BOBPJJCASA-N	0	3	341.194	3.066	20	30		EGEDHN
CC(=O)N[C@@H](C(=O)C(C#N)c1nc2cc(Cl)ccc2s1)C(C)C	ZINC000860479290	1329322480	/nfs/dbraw/zinc/32/24/80/1329322480.db2.gz	MLNBECZNAYPVTM-BXUZGUMPSA-N	0	3	349.843	3.287	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)C2C=CC=CC=C2)C1	ZINC001027431323	1327669159	/nfs/dbraw/zinc/66/91/59/1327669159.db2.gz	NVQLUELHDHIRQO-OAQYLSRUSA-N	0	3	347.462	3.279	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)c2oc3c(cccc3F)c2C)C1	ZINC001027444251	1327685370	/nfs/dbraw/zinc/68/53/70/1327685370.db2.gz	QKDVZVUWYJDWIE-AWEZNQCLSA-N	0	3	328.387	3.050	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)[C@H]2CCC2(F)F)C1	ZINC001027458455	1327700918	/nfs/dbraw/zinc/70/09/18/1327700918.db2.gz	JNBWVBPPMRUMIH-IAGOWNOFSA-N	0	3	347.409	3.026	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)cc2)C1)C1CCC1	ZINC001027461018	1327707885	/nfs/dbraw/zinc/70/78/85/1327707885.db2.gz	SVFMKMZRHUAEBE-OXJNMPFZSA-N	0	3	339.483	3.417	20	30		EGEDHN
C[C@H](NC[C@H]1CCCN1CC(F)(F)F)c1ccc(C#N)cc1F	ZINC000926919441	1327775871	/nfs/dbraw/zinc/77/58/71/1327775871.db2.gz	DBJXTNCHRCJKLV-WCQYABFASA-N	0	3	329.341	3.375	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)c(F)c2)C1	ZINC001027535242	1327825732	/nfs/dbraw/zinc/82/57/32/1327825732.db2.gz	WOFVMLUEHPGKEL-SJLPKXTDSA-N	0	3	349.425	3.114	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)[C@@H](CC)Cc2cccc(C)c2)C1	ZINC001027604942	1327961380	/nfs/dbraw/zinc/96/13/80/1327961380.db2.gz	TXUOULYRUACLHZ-PMACEKPBSA-N	0	3	326.484	3.120	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1ccc(OC)c(C)c1)C2	ZINC000965452980	1327995254	/nfs/dbraw/zinc/99/52/54/1327995254.db2.gz	OUZXWGUKYBSBPN-UHFFFAOYSA-N	0	3	348.874	3.387	20	30		EGEDHN
C=C(Cl)CN(C)[C@H]1CCCN(C(=O)c2cccc3[nH]c(C)nc32)C1	ZINC001027642241	1328015261	/nfs/dbraw/zinc/01/52/61/1328015261.db2.gz	UPWXTALATVWYNE-AWEZNQCLSA-N	0	3	346.862	3.160	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)CC(C)(C)c2ccc(C)cc2)C1	ZINC001027673786	1328071227	/nfs/dbraw/zinc/07/12/27/1328071227.db2.gz	MKIXCUPKKDINEL-LJQANCHMSA-N	0	3	326.484	3.219	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)c2cc3c(s2)CC[C@@H](C)C3)C1	ZINC001027679009	1328079031	/nfs/dbraw/zinc/07/90/31/1328079031.db2.gz	SESQDHNMYYWGKX-GDBMZVCRSA-N	0	3	330.497	3.043	20	30		EGEDHN
C[C@H](CC(=O)N1CCC[C@H](N(C)Cc2cccc(C#N)c2)C1)C1CC1	ZINC001027695607	1328102439	/nfs/dbraw/zinc/10/24/39/1328102439.db2.gz	HRAMXDQMIHHFME-UZLBHIALSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2nsc3ccccc32)C1	ZINC000966296977	1328257718	/nfs/dbraw/zinc/25/77/18/1328257718.db2.gz	KUEXELWAVXKTNA-HIFRSBDPSA-N	0	3	329.469	3.313	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(C(=O)CCC3CCCC3)C2)s1	ZINC000966563031	1328341534	/nfs/dbraw/zinc/34/15/34/1328341534.db2.gz	OGDYDOAWUIEQCJ-OAHLLOKOSA-N	0	3	331.485	3.281	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)C2C3CC4CC(C3)CC2C4)C1	ZINC000966722875	1328393596	/nfs/dbraw/zinc/39/35/96/1328393596.db2.gz	MIVHXUMQPROGAK-RJBHSWFSSA-N	0	3	330.516	3.461	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1ccc(-c2cnco2)cc1	ZINC001027972472	1328445142	/nfs/dbraw/zinc/44/51/42/1328445142.db2.gz	BJFYELOYNUKOLG-QGZVFWFLSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)Cc2cncc3ccccc32)C1	ZINC000966876753	1328449231	/nfs/dbraw/zinc/44/92/31/1328449231.db2.gz	ZXEPPRSMHXWZSI-JXFKEZNVSA-N	0	3	337.467	3.180	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)Cc3ccc(C(F)F)cc3)C2)CC1	ZINC001050591065	1348295375	/nfs/dbraw/zinc/29/53/75/1348295375.db2.gz	UCIVULBOYQDUGU-UHFFFAOYSA-N	0	3	346.421	3.114	20	30		EGEDHN
C=C(Br)CNC1CCN(c2ccccc2OC)CC1	ZINC000865450253	1329699184	/nfs/dbraw/zinc/69/91/84/1329699184.db2.gz	NHGVCEKVYBRMQU-UHFFFAOYSA-N	0	3	325.250	3.162	20	30		EGEDHN
CN(C)CCN(CCc1ccccc1)C(=O)Nc1sccc1C#N	ZINC000931845283	1329765864	/nfs/dbraw/zinc/76/58/64/1329765864.db2.gz	DRPOFBHIFNHPAY-UHFFFAOYSA-N	0	3	342.468	3.258	20	30		EGEDHN
CN(C)CCN(Cc1cccc(F)c1)C(=O)Nc1sccc1C#N	ZINC000931844778	1329765875	/nfs/dbraw/zinc/76/58/75/1329765875.db2.gz	JKPCMMCOXKRTKR-UHFFFAOYSA-N	0	3	346.431	3.355	20	30		EGEDHN
Cc1ccc(C#N)cc1C(=O)N(CCN(C)C)Cc1cccs1	ZINC000934357837	1329972107	/nfs/dbraw/zinc/97/21/07/1329972107.db2.gz	JNZGDZQSNVGSSF-UHFFFAOYSA-N	0	3	327.453	3.132	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc3c(C)c(C)[nH]c32)[C@H](C)C1	ZINC000942180422	1331863402	/nfs/dbraw/zinc/86/34/02/1331863402.db2.gz	GIEAMIOAXORYNA-KUHUBIRLSA-N	0	3	337.467	3.248	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc3cc(C)ccc3n2)[C@H](C)C1	ZINC000942430006	1331932516	/nfs/dbraw/zinc/93/25/16/1331932516.db2.gz	FOLLNRYMOWWVCD-SJLPKXTDSA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc(C(F)F)cc2)[C@H](C)C1	ZINC000942468013	1331941195	/nfs/dbraw/zinc/94/11/95/1331941195.db2.gz	VURRETQQVJNYNE-RHSMWYFYSA-N	0	3	334.410	3.017	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(-c3cccs3)on2)[C@@H](C)C1	ZINC000942538196	1331963187	/nfs/dbraw/zinc/96/31/87/1331963187.db2.gz	MBLPHNGMEUPJDJ-QWHCGFSZSA-N	0	3	331.441	3.029	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2nsc3ccc(C)cc32)[C@H](C)C1	ZINC000942563439	1331977787	/nfs/dbraw/zinc/97/77/87/1331977787.db2.gz	XRQNPKPMSFDHEA-UKRRQHHQSA-N	0	3	329.469	3.231	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C(C)(C)c2ccc(Cl)cc2)[C@@H](C)C1	ZINC000942595381	1331994698	/nfs/dbraw/zinc/99/46/98/1331994698.db2.gz	YNGALNGEEVTWFP-YOEHRIQHSA-N	0	3	332.875	3.077	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3cnccc3C)C[C@H]2C)C1	ZINC000942602079	1331999299	/nfs/dbraw/zinc/99/92/99/1331999299.db2.gz	CTDBJEJFDQEODD-AEFFLSMTSA-N	0	3	327.472	3.073	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccccc2OC2CCC2)[C@H](C)C1	ZINC000942703332	1332023684	/nfs/dbraw/zinc/02/36/84/1332023684.db2.gz	XTWLUKPRFDQDQQ-QAPCUYQASA-N	0	3	328.456	3.244	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc3nc(C)sc3c2)[C@@H](C)C1	ZINC000943990024	1332305501	/nfs/dbraw/zinc/30/55/01/1332305501.db2.gz	ZUIWYFPGSUHJCC-BBRMVZONSA-N	0	3	341.480	3.068	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnc(-c3ccco3)s2)[C@H](C)C1	ZINC000944243243	1332353043	/nfs/dbraw/zinc/35/30/43/1332353043.db2.gz	ZUELCZWQPBHLHT-OLZOCXBDSA-N	0	3	331.441	3.029	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(Cl)cc2Cl)[C@@H](C)C1	ZINC000944303157	1332367269	/nfs/dbraw/zinc/36/72/69/1332367269.db2.gz	BIECOASAANWIHU-LRDDRELGSA-N	0	3	339.266	3.457	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3c(s2)CCCCC3)[C@@H](C)C1	ZINC000944618205	1332417357	/nfs/dbraw/zinc/41/73/57/1332417357.db2.gz	BYCPLYLYOHZVLJ-RDJZCZTQSA-N	0	3	344.524	3.481	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(F)c(F)cc2Cl)[C@@H](C)C1	ZINC000944619670	1332419524	/nfs/dbraw/zinc/41/95/24/1332419524.db2.gz	OIUFFYHMYXMAMH-ZBEGNZNMSA-N	0	3	340.801	3.082	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(F)c3occc32)[C@H](C)C1	ZINC000945030132	1332481564	/nfs/dbraw/zinc/48/15/64/1332481564.db2.gz	WMWVFCXTXKEGPJ-DYVFJYSZSA-N	0	3	328.387	3.035	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@]3(C)C[C@H]4C[C@H]4C3)CC[C@@H]2C1	ZINC000946697541	1332879790	/nfs/dbraw/zinc/87/97/90/1332879790.db2.gz	WFBQAJKPPDWSPP-YJZQBRCTSA-N	0	3	336.907	3.346	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@]34C[C@H]3CCCC4)CC[C@@H]2C1	ZINC000946770010	1332896419	/nfs/dbraw/zinc/89/64/19/1332896419.db2.gz	GSPFDXNBXWXRTG-SFNKJDCFSA-N	0	3	336.907	3.490	20	30		EGEDHN
Cc1cccnc1C(=O)N[C@H]1CCN(Cc2ccc(C#N)cc2)[C@@H](C)C1	ZINC000947156497	1333027903	/nfs/dbraw/zinc/02/79/03/1333027903.db2.gz	DSVQFTGZMSTYQU-LPHOPBHVSA-N	0	3	348.450	3.045	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)C2CC(F)(F)C2)CCN1Cc1cccc(C#N)c1	ZINC000947169946	1333034023	/nfs/dbraw/zinc/03/40/23/1333034023.db2.gz	AQXLRSFDPORBDD-DYVFJYSZSA-N	0	3	347.409	3.073	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2coc3c2cccc3OC)C[C@@H]1C	ZINC000947314536	1333085757	/nfs/dbraw/zinc/08/57/57/1333085757.db2.gz	GUTZTHLVEGEZSB-GJZGRUSLSA-N	0	3	340.423	3.047	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2coc3c2cccc3OC)C[C@H]1C	ZINC000947314538	1333086174	/nfs/dbraw/zinc/08/61/74/1333086174.db2.gz	GUTZTHLVEGEZSB-HUUCEWRRSA-N	0	3	340.423	3.047	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ocnc2-c2ccccc2)C[C@H]1C	ZINC000947377401	1333108235	/nfs/dbraw/zinc/10/82/35/1333108235.db2.gz	GVSXBUUOXHVKLT-ZBFHGGJFSA-N	0	3	325.412	3.110	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnc(-c3ccccc3)o2)C[C@@H]1C	ZINC000947417196	1333120366	/nfs/dbraw/zinc/12/03/66/1333120366.db2.gz	NDUWVWKXNWKOKB-GOEBONIOSA-N	0	3	325.412	3.110	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(OC)c(C(C)C)c2)C[C@H]1C	ZINC000947505821	1333149862	/nfs/dbraw/zinc/14/98/62/1333149862.db2.gz	FPVJLEJTVPVGAT-SJLPKXTDSA-N	0	3	342.483	3.425	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc3c4c(cccc42)CC3)C[C@H]1C	ZINC000947520672	1333155582	/nfs/dbraw/zinc/15/55/82/1333155582.db2.gz	QTCUCKVBFDMNAE-QAPCUYQASA-N	0	3	332.447	3.154	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cnc3ccccc3c2C)C[C@H]1C	ZINC000947556935	1333171337	/nfs/dbraw/zinc/17/13/37/1333171337.db2.gz	UTXCGFANMOMCBI-NVXWUHKLSA-N	0	3	335.451	3.149	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)[C@H]2C[C@H]3C[C@H]3C2)CCN1Cc1ccc(C#N)cc1	ZINC000947639286	1333203888	/nfs/dbraw/zinc/20/38/88/1333203888.db2.gz	OYKUAWQJTZMYGU-NSYSGPAISA-N	0	3	337.467	3.073	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3cccc(OC)c3o2)C[C@H]1C	ZINC000947668578	1333216633	/nfs/dbraw/zinc/21/66/33/1333216633.db2.gz	YDCCGOSISJIPKO-ZBFHGGJFSA-N	0	3	340.423	3.047	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccccc2OC2CCC2)C[C@H]1C	ZINC000947710382	1333236025	/nfs/dbraw/zinc/23/60/25/1333236025.db2.gz	MPBBRRGBEIWMEX-HZPDHXFCSA-N	0	3	328.456	3.387	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccn2C2CCCC2)C[C@H]1C	ZINC000947857704	1333282957	/nfs/dbraw/zinc/28/29/57/1333282957.db2.gz	QGZMSPMGEPPFEC-IAGOWNOFSA-N	0	3	327.472	3.209	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2sc(CC3CC3)nc2C)C[C@@H]1C	ZINC000947862050	1333284457	/nfs/dbraw/zinc/28/44/57/1333284457.db2.gz	RLZQOMRGXDEGTE-SWLSCSKDSA-N	0	3	333.501	3.173	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccc3nc(C)sc3c2)C[C@H]1C	ZINC000947894453	1333295232	/nfs/dbraw/zinc/29/52/32/1333295232.db2.gz	AGSVTEMEDMHMQA-IUODEOHRSA-N	0	3	329.469	3.373	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc3nc(C)sc3c2)C[C@@H]1C	ZINC000947894702	1333295253	/nfs/dbraw/zinc/29/52/53/1333295253.db2.gz	BYQIATIJYGZKJF-XJKSGUPXSA-N	0	3	341.480	3.211	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(Cl)c(Cl)c2)C[C@@H]1C	ZINC000947967446	1333324569	/nfs/dbraw/zinc/32/45/69/1333324569.db2.gz	PAJUCLSFBSOZRV-AAEUAGOBSA-N	0	3	325.239	3.209	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(F)c(F)cc2Cl)C[C@H]1C	ZINC000947998821	1333337304	/nfs/dbraw/zinc/33/73/04/1333337304.db2.gz	PKNLSVQAIDDCMK-NEPJUHHUSA-N	0	3	340.801	3.224	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(OC(C)C)cc2)C[C@H]1C	ZINC000948055980	1333357560	/nfs/dbraw/zinc/35/75/60/1333357560.db2.gz	GVJZCHPCVFWUFS-MJGOQNOKSA-N	0	3	342.483	3.009	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3ccccc3n2CC)C[C@H]1C	ZINC000948060293	1333359049	/nfs/dbraw/zinc/35/90/49/1333359049.db2.gz	AZYJBICZLNCQLC-AEFFLSMTSA-N	0	3	337.467	3.267	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)[C@H]2CCc3cc(F)ccc32)CC1	ZINC000948621635	1333600721	/nfs/dbraw/zinc/60/07/21/1333600721.db2.gz	SMSZXNJUBGYFRL-ICSRJNTNSA-N	0	3	342.458	3.192	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)C2(c3cccc(C)c3)CCC2)CC1	ZINC000948665434	1333620012	/nfs/dbraw/zinc/62/00/12/1333620012.db2.gz	JXIYGURXJGHRJX-HXUWFJFHSA-N	0	3	338.495	3.363	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2ccc3c(c2)[C@H](C)CO3)CC1	ZINC000948701274	1333638477	/nfs/dbraw/zinc/63/84/77/1333638477.db2.gz	UEEYKDYYUPVCCA-SJLPKXTDSA-N	0	3	340.467	3.132	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@@H]2CCCN(Cc3ccccn3)CC2)C1	ZINC000948747168	1333657853	/nfs/dbraw/zinc/65/78/53/1333657853.db2.gz	QHOPIAGWWDMPMJ-GOSISDBHSA-N	0	3	327.472	3.251	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2ccc(C(C)C)nc2C)CC1	ZINC000948779184	1333675820	/nfs/dbraw/zinc/67/58/20/1333675820.db2.gz	KLSVKRNPDHCYSC-SFHVURJKSA-N	0	3	341.499	3.463	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)C[C@@H]2CCc3ccccc32)CC1	ZINC000948868540	1333715124	/nfs/dbraw/zinc/71/51/24/1333715124.db2.gz	ONAUJUAAFPGSKV-PMACEKPBSA-N	0	3	338.495	3.443	20	30		EGEDHN
CCCCN1CCc2ccccc2[C@@H]1CNC(=O)c1c[nH]c(C#N)c1	ZINC000948906131	1333727738	/nfs/dbraw/zinc/72/77/38/1333727738.db2.gz	JLCHOUPRJAXVQG-IBGZPJMESA-N	0	3	336.439	3.016	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@@H]1CNC(=O)c1ccc(C#N)[nH]1	ZINC000948910425	1333730793	/nfs/dbraw/zinc/73/07/93/1333730793.db2.gz	RCJKSXQUIYAAQN-FQEVSTJZSA-N	0	3	348.450	3.182	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NC[C@H]1c2ccccc2CCN1C(C)C	ZINC000948919889	1333734862	/nfs/dbraw/zinc/73/48/62/1333734862.db2.gz	STXFOCPAVQFRRH-AABGKKOBSA-N	0	3	342.483	3.092	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@@H]1CNC(=O)c1nc(C)c[nH]1	ZINC000948969782	1333750695	/nfs/dbraw/zinc/75/06/95/1333750695.db2.gz	LYXHXUBHURPOGC-SFHVURJKSA-N	0	3	338.455	3.014	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C[C@@H]3CC[C@H]4C[C@H]43)CC2)C1	ZINC000949401748	1333838343	/nfs/dbraw/zinc/83/83/43/1333838343.db2.gz	KXAOBEBHGBPGDY-GBESFXJTSA-N	0	3	346.515	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C[C@H]3CC=CCC3)CC2)C1	ZINC000949436803	1333846912	/nfs/dbraw/zinc/84/69/12/1333846912.db2.gz	BGWSHPYAXONSPZ-IBGZPJMESA-N	0	3	346.515	3.392	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C(C)(C)C3CC3)CC2)C1	ZINC000949441067	1333847736	/nfs/dbraw/zinc/84/77/36/1333847736.db2.gz	NBAOYOVOAIWQJN-UHFFFAOYSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@H]3CCC[C@H](C)C3)CC2)C1	ZINC000949455233	1333851863	/nfs/dbraw/zinc/85/18/63/1333851863.db2.gz	XQEGHNDCOYBUMX-OALUTQOASA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@@H](C)C3CCCC3)CC2)C1	ZINC000949509487	1333863142	/nfs/dbraw/zinc/86/31/42/1333863142.db2.gz	SDSHHMNHFVTONL-KRWDZBQOSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C[C@H](C(=O)N1CCC2(CC1)CN(CCC)CCO2)c1ccccc1	ZINC000949529541	1333868569	/nfs/dbraw/zinc/86/85/69/1333868569.db2.gz	ZCAHRQPNNLFULU-IBGZPJMESA-N	0	3	342.483	3.060	20	30		EGEDHN
C=C(C)CCN1CC(N(CC)C(=O)c2cc(-c3ccccc3)[nH]n2)C1	ZINC000950814545	1334134003	/nfs/dbraw/zinc/13/40/03/1334134003.db2.gz	GJHJZRJQJXFVDE-UHFFFAOYSA-N	0	3	338.455	3.189	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2cc(F)cc3ccoc32)C1	ZINC000967061248	1335652608	/nfs/dbraw/zinc/65/26/08/1335652608.db2.gz	MMPVWSKTLGEIMW-SUMWQHHRSA-N	0	3	328.387	3.035	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2cc(C3CC3)oc2C2CC2)C1	ZINC000967418541	1335732361	/nfs/dbraw/zinc/73/23/61/1335732361.db2.gz	BCMZQCKRCKTQJJ-KSSFIOAISA-N	0	3	340.467	3.498	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2cc3cc(C)ccc3[nH]2)C1	ZINC000967661385	1335803104	/nfs/dbraw/zinc/80/31/04/1335803104.db2.gz	YNPJMZAEVQQGNV-HNAYVOBHSA-N	0	3	325.456	3.493	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2c(F)cc(F)cc2F)C1	ZINC000968076290	1335853493	/nfs/dbraw/zinc/85/34/93/1335853493.db2.gz	CVAZDVXMOSIEDE-ABAIWWIYSA-N	0	3	326.362	3.120	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)Cc2ccc(F)cc2Cl)C1	ZINC000968212534	1335872875	/nfs/dbraw/zinc/87/28/75/1335872875.db2.gz	NEPDFQXYPHOAAI-SUMWQHHRSA-N	0	3	338.854	3.424	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](C)[C@@H](NC(=O)c2ocnc2C(F)F)C1	ZINC000968331095	1335892106	/nfs/dbraw/zinc/89/21/06/1335892106.db2.gz	KCLLFDIUAVDNHF-NEPJUHHUSA-N	0	3	327.375	3.019	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)C(C)(C)c2cccc(Cl)c2)C1	ZINC000968364058	1335903605	/nfs/dbraw/zinc/90/36/05/1335903605.db2.gz	DLBPZHOAZSGPDH-MAUKXSAKSA-N	0	3	346.902	3.468	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@H]2CN(CC=C(C)C)CC[C@H]2C)cc1	ZINC000968391426	1335916791	/nfs/dbraw/zinc/91/67/91/1335916791.db2.gz	SBYKLBOYCBKEHF-XLIONFOSSA-N	0	3	340.467	3.105	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(-c3c[nH]cn3)cc2)C1	ZINC000968500831	1335943343	/nfs/dbraw/zinc/94/33/43/1335943343.db2.gz	KGVZMZIFDUHKST-BEFAXECRSA-N	0	3	338.455	3.093	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccc3nc(C)sc3c2)C1	ZINC000968503905	1335944532	/nfs/dbraw/zinc/94/45/32/1335944532.db2.gz	CEEYUFHAEVXCQJ-GUYCJALGSA-N	0	3	341.480	3.068	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CN(Cc3cccc(C)c3)CC[C@@H]2C)nc1	ZINC000968548535	1335959547	/nfs/dbraw/zinc/95/95/47/1335959547.db2.gz	GLGAEBGVLKFFFC-LAUBAEHRSA-N	0	3	347.462	3.012	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)Cc2c[nH]c3ccccc23)C1	ZINC000968569513	1335964067	/nfs/dbraw/zinc/96/40/67/1335964067.db2.gz	JTHUNYCKSWPYPB-KXBFYZLASA-N	0	3	325.456	3.113	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)Cc2cc3ccccc3n2C)C1	ZINC000968685242	1336011235	/nfs/dbraw/zinc/01/12/35/1336011235.db2.gz	PGNJNEPADXOCHE-QFBILLFUSA-N	0	3	339.483	3.124	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccccc2CC(C)C)C1	ZINC000968692559	1336013823	/nfs/dbraw/zinc/01/38/23/1336013823.db2.gz	OBJLQQRLMJDHDQ-XLIONFOSSA-N	0	3	326.484	3.349	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccc(CC)c(CC)c2)C1	ZINC000968710449	1336019825	/nfs/dbraw/zinc/01/98/25/1336019825.db2.gz	QRFPHCLHMZDZAI-OXQOHEQNSA-N	0	3	326.484	3.275	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)NC[C@H]1CCCCCN1Cc1ccc(C#N)cc1	ZINC000968819629	1336060267	/nfs/dbraw/zinc/06/02/67/1336060267.db2.gz	ULSUSJUJWIZFQY-MOPGFXCFSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccnn1-c1ccccc1	ZINC000968917136	1336088039	/nfs/dbraw/zinc/08/80/39/1336088039.db2.gz	OWZPFBAHHRNZSY-SFHVURJKSA-N	0	3	338.455	3.033	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)[C@@H]1C[C@H]1c1ccsc1	ZINC000968917160	1336088100	/nfs/dbraw/zinc/08/81/00/1336088100.db2.gz	PKMKMBDBGXOLQC-OKZBNKHCSA-N	0	3	330.497	3.236	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000968954275	1336101852	/nfs/dbraw/zinc/10/18/52/1336101852.db2.gz	AHUIBBXWCJAPTA-RDJZCZTQSA-N	0	3	328.456	3.170	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)[C@H]1COc2cc(C)c(C)cc21	ZINC000968965642	1336104162	/nfs/dbraw/zinc/10/41/62/1336104162.db2.gz	UPPLHQXHIDLFDH-HKUYNNGSSA-N	0	3	342.483	3.326	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cc(-c2ccco2)on1	ZINC000968973237	1336105685	/nfs/dbraw/zinc/10/56/85/1336105685.db2.gz	DXKCQVZADCLKLV-AWEZNQCLSA-N	0	3	329.400	3.095	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1cccc(OC)c1F	ZINC000969087447	1336139236	/nfs/dbraw/zinc/13/92/36/1336139236.db2.gz	ASJBRMSCNHTPLJ-OAHLLOKOSA-N	0	3	334.435	3.385	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)[C@H]1CCCc2sc(C)nc21	ZINC000969114274	1336148901	/nfs/dbraw/zinc/14/89/01/1336148901.db2.gz	DXQJFDLPWHUIOA-HOTGVXAUSA-N	0	3	347.528	3.418	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cnn(CC(C)C)c1C	ZINC000969133669	1336155663	/nfs/dbraw/zinc/15/56/63/1336155663.db2.gz	RZSFRWFUWCSPEC-KRWDZBQOSA-N	0	3	332.492	3.008	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)C12CC(C(F)(F)F)(C1)C2	ZINC000969156148	1336165408	/nfs/dbraw/zinc/16/54/08/1336165408.db2.gz	LCLRQBGJXAEVPD-IUDNXUCKSA-N	0	3	330.394	3.266	20	30		EGEDHN
Cc1cccc([C@@H](C)N2CC([C@H](C)NC(=O)c3cc(C#N)c[nH]3)C2)c1	ZINC000969465775	1336214774	/nfs/dbraw/zinc/21/47/74/1336214774.db2.gz	GYOPQSNHHXGIHC-LSDHHAIUSA-N	0	3	336.439	3.006	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](NCc2ccccc2N(C)C)C1	ZINC000969570854	1336225062	/nfs/dbraw/zinc/22/50/62/1336225062.db2.gz	XHXLNWBKGMWSIW-QGZVFWFLSA-N	0	3	329.488	3.045	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H](C)C1CN(Cc2ccc(C)cc2)C1	ZINC000969842146	1336253469	/nfs/dbraw/zinc/25/34/69/1336253469.db2.gz	NXSXKTWLLJLEEL-KRWDZBQOSA-N	0	3	337.467	3.233	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)[C@@H]2CCCO[C@H]2c2ccccc2)C1	ZINC000969860631	1336254568	/nfs/dbraw/zinc/25/45/68/1336254568.db2.gz	CIHDGENOKQELKX-DBVUQKKJSA-N	0	3	342.483	3.167	20	30		EGEDHN
CC1(C)CC[C@@H](C(=O)N2CC[C@@H](NCc3ccc(C#N)c(F)c3)C2)C1	ZINC000969867255	1336254927	/nfs/dbraw/zinc/25/49/27/1336254927.db2.gz	LUSLSTVUADBPAC-NVXWUHKLSA-N	0	3	343.446	3.214	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(C(=O)C3(F)CCCCC3)C2)cc1F	ZINC000970403298	1336303984	/nfs/dbraw/zinc/30/39/84/1336303984.db2.gz	GQATUHBRZWCSNB-MRXNPFEDSA-N	0	3	347.409	3.060	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2nsc3ccccc32)CC1	ZINC001005428791	1336346431	/nfs/dbraw/zinc/34/64/31/1336346431.db2.gz	HLEOHKUZEYXVJX-UHFFFAOYSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cnn(C(C)(C)C)c2C)CC1	ZINC001005461653	1336354843	/nfs/dbraw/zinc/35/48/43/1336354843.db2.gz	RYYJJZGKTPNNFW-UHFFFAOYSA-N	0	3	332.492	3.059	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N(C)C1CCN(CC(=C)C)CC1	ZINC001005600546	1336378343	/nfs/dbraw/zinc/37/83/43/1336378343.db2.gz	VNBQBFUZPQYMOX-UHFFFAOYSA-N	0	3	328.456	3.364	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cc(-c3ccccc3)no2)CC1	ZINC001005647819	1336387289	/nfs/dbraw/zinc/38/72/89/1336387289.db2.gz	IYCGRFTWHXFLFJ-UHFFFAOYSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccc(C)nc2C2CC2)CC1	ZINC001005773306	1336400592	/nfs/dbraw/zinc/40/05/92/1336400592.db2.gz	OWNHYWSIOSGCCR-UHFFFAOYSA-N	0	3	327.472	3.380	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N(C)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001005969623	1336431967	/nfs/dbraw/zinc/43/19/67/1336431967.db2.gz	JWPSGUWWCSTNRD-UYAOXDASSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)[C@]2(C)CCCc3ccccc32)CC1	ZINC001006144011	1336458563	/nfs/dbraw/zinc/45/85/63/1336458563.db2.gz	CDCJHYYMTBZNTG-OAQYLSRUSA-N	0	3	326.484	3.389	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2ccc(OC)c(C3CC3)c2)CC1	ZINC001006209413	1336466823	/nfs/dbraw/zinc/46/68/23/1336466823.db2.gz	DIRDSYIJURXIOG-UHFFFAOYSA-N	0	3	328.456	3.295	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cc(C)n(CC3CC3)c2C)CC1	ZINC001006294067	1336484958	/nfs/dbraw/zinc/48/49/58/1336484958.db2.gz	JKZBKRKNGQSZTL-UHFFFAOYSA-N	0	3	329.488	3.237	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccc(Br)o2)CC1	ZINC001006326763	1336489833	/nfs/dbraw/zinc/48/98/33/1336489833.db2.gz	FJHMXVQPEBTNQQ-UHFFFAOYSA-N	0	3	341.249	3.155	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CCCN(CC2=CCCCC2)C1	ZINC001007501687	1336659487	/nfs/dbraw/zinc/65/94/87/1336659487.db2.gz	CFEJVMHWUHZGAW-GOSISDBHSA-N	0	3	327.472	3.369	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN(Cc3cc(C)ccc3C)C2)nc1	ZINC001009250053	1336991560	/nfs/dbraw/zinc/99/15/60/1336991560.db2.gz	DOSMSIXWQUHQAK-HXUWFJFHSA-N	0	3	347.462	3.074	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCN([C@H](CC)c3ccccc3)C2)cn1	ZINC001009278771	1336995653	/nfs/dbraw/zinc/99/56/53/1336995653.db2.gz	WFWZPXYPCMEQHY-LEWJYISDSA-N	0	3	347.462	3.408	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](NC(=O)c2cnc(-c3ccccc3)o2)C1	ZINC001014839596	1337920067	/nfs/dbraw/zinc/92/00/67/1337920067.db2.gz	QVPGYPMLVPJNRZ-MRXNPFEDSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=C(C)CCN1CC[C@H](NC(=O)c2cc3cccc(OC)c3o2)C1	ZINC001015630220	1338217006	/nfs/dbraw/zinc/21/70/06/1338217006.db2.gz	VIYONAUEFPJDPN-HNNXBMFYSA-N	0	3	328.412	3.212	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@@H]1CCN(Cc2ccc(CC)cc2)C1	ZINC001016112698	1338466340	/nfs/dbraw/zinc/46/63/40/1338466340.db2.gz	ZEAVKYNFILYTET-JOCHJYFZSA-N	0	3	346.474	3.164	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2cc(Cl)sc2Cl)CC1	ZINC001016656142	1338681061	/nfs/dbraw/zinc/68/10/61/1338681061.db2.gz	ZXBBPNFCTMXGIT-NSHDSACASA-N	0	3	343.279	3.272	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CC12CCN(C/C=C/Cl)CC2	ZINC001016658715	1338681747	/nfs/dbraw/zinc/68/17/47/1338681747.db2.gz	JRFBMNPIIZXNGM-KZJSRBBCSA-N	0	3	333.863	3.011	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2nc(C(C)(C)C)cs2)CC1	ZINC001016666054	1338685529	/nfs/dbraw/zinc/68/55/29/1338685529.db2.gz	CQDAVDSUBSULAR-CQSZACIVSA-N	0	3	345.512	3.048	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2c(C)c(F)ccc2Cl)CC1	ZINC001016696454	1338693897	/nfs/dbraw/zinc/69/38/97/1338693897.db2.gz	YGPCGGJVXFOLTI-INIZCTEOSA-N	0	3	348.849	3.395	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2c(C)c(F)ccc2Cl)CC1	ZINC001016694728	1338694337	/nfs/dbraw/zinc/69/43/37/1338694337.db2.gz	GZHOSQPKNYAOLF-HNNXBMFYSA-N	0	3	334.822	3.005	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cc3ccc(C)cc3[nH]2)CC1	ZINC001016753444	1338712364	/nfs/dbraw/zinc/71/23/64/1338712364.db2.gz	JTUFFFTZCYCIGO-LJQANCHMSA-N	0	3	335.451	3.084	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CC23CCN(Cc2cccnc2)CC3)CC1	ZINC001016802873	1338731863	/nfs/dbraw/zinc/73/18/63/1338731863.db2.gz	JQMZJWTVNHQNGG-LJQANCHMSA-N	0	3	339.483	3.299	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccc(Cl)c(F)c2)CC1	ZINC001016843228	1338743595	/nfs/dbraw/zinc/74/35/95/1338743595.db2.gz	NGKZMPSVGMFXIG-MRXNPFEDSA-N	0	3	334.822	3.087	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(Cl)c3occc32)CC1	ZINC001016927028	1338772981	/nfs/dbraw/zinc/77/29/81/1338772981.db2.gz	PDNBQKYIYOQQGF-INIZCTEOSA-N	0	3	342.826	3.304	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2ccc3[nH]c(C)c(C)c3c2)CC1	ZINC001016969952	1338787318	/nfs/dbraw/zinc/78/73/18/1338787318.db2.gz	XLUWEMUPHXALIU-IBGZPJMESA-N	0	3	335.451	3.002	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)[C@@H]2CCCCc3ccccc32)CC1	ZINC001016990937	1338795875	/nfs/dbraw/zinc/79/58/75/1338795875.db2.gz	WCWBBYAXUZJPEA-UXHICEINSA-N	0	3	336.479	3.101	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@@H](CN(C)Cc2ccc(Cl)s2)C1	ZINC001017070505	1338846984	/nfs/dbraw/zinc/84/69/84/1338846984.db2.gz	GIDGNJSHLBSWGT-OLZOCXBDSA-N	0	3	339.892	3.232	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCCN(C(=O)/C=C\C2CC2)C1	ZINC001017089744	1338857810	/nfs/dbraw/zinc/85/78/10/1338857810.db2.gz	YRTWZGODNOIHIC-CXOKCQFOSA-N	0	3	343.496	3.256	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC[C@H](CN(C)Cc3cccnc3)C2)cc1	ZINC001017174709	1338918989	/nfs/dbraw/zinc/91/89/89/1338918989.db2.gz	BIZBULXEQQRFOG-HXUWFJFHSA-N	0	3	347.462	3.047	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H](CN(C)[C@@H](C)c2cnccn2)C1	ZINC001017179458	1338922663	/nfs/dbraw/zinc/92/26/63/1338922663.db2.gz	JNIBQWHNOOVIBA-DLBZAZTESA-N	0	3	344.503	3.310	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H](CN(C)Cc2cncc(F)c2)C1	ZINC001017180031	1338923935	/nfs/dbraw/zinc/92/39/35/1338923935.db2.gz	QWSFWQYJUDPFIY-INIZCTEOSA-N	0	3	347.478	3.493	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCCN(C(=O)C2(CF)CC2)C1	ZINC001017204040	1338949906	/nfs/dbraw/zinc/94/99/06/1338949906.db2.gz	GPODBAARCXRBOI-AWEZNQCLSA-N	0	3	349.475	3.040	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc(OC)c(F)c1	ZINC001017714295	1339398971	/nfs/dbraw/zinc/39/89/71/1339398971.db2.gz	WYFYZTDURDNPBW-CALCHBBNSA-N	0	3	346.446	3.018	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc(F)c(F)c1	ZINC001017861615	1339433127	/nfs/dbraw/zinc/43/31/27/1339433127.db2.gz	XNXUKOGUWRVKOW-IYBDPMFKSA-N	0	3	334.410	3.149	20	30		EGEDHN
CC1(C)C(C(=O)N2CC[C@H](NCc3ccc(C#N)c(F)c3)C2)C1(C)C	ZINC001018676753	1339698819	/nfs/dbraw/zinc/69/88/19/1339698819.db2.gz	DWSGHWBTRJSLDW-HNNXBMFYSA-N	0	3	343.446	3.070	20	30		EGEDHN
CC(C)(CC(=O)N1CC[C@H](NCc2ccc(C#N)s2)C1)C1CC1	ZINC001018811937	1339732691	/nfs/dbraw/zinc/73/26/91/1339732691.db2.gz	GPRORYRBEQQFIL-AWEZNQCLSA-N	0	3	331.485	3.137	20	30		EGEDHN
C#CCCN1CCC[C@H]1CNC(=O)c1ccc(O[C@@H](C)CC)cc1	ZINC001028247075	1340508329	/nfs/dbraw/zinc/50/83/29/1340508329.db2.gz	GEAQZHNJMMNSKH-WMZOPIPTSA-N	0	3	328.456	3.081	20	30		EGEDHN
C#CCCN1CCC[C@@H]1CNC(=O)c1coc2ccc(Cl)cc12	ZINC001028289987	1340542667	/nfs/dbraw/zinc/54/26/67/1340542667.db2.gz	GQANCNPXLPHBCD-CQSZACIVSA-N	0	3	330.815	3.304	20	30		EGEDHN
Cc1ccsc1C(=O)NC[C@@H]1CCN(Cc2ccc(C#N)cc2)C1	ZINC001028369918	1340598524	/nfs/dbraw/zinc/59/85/24/1340598524.db2.gz	VNZVJGASARXSAT-KRWDZBQOSA-N	0	3	339.464	3.180	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CCN(Cc3sc(C)nc3C)C2)CC1	ZINC001028780521	1340812636	/nfs/dbraw/zinc/81/26/36/1340812636.db2.gz	KKDVJIYRMUIGMU-INIZCTEOSA-N	0	3	347.528	3.444	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)c2coc3ccc(Cl)cc23)C1	ZINC001028956244	1340893404	/nfs/dbraw/zinc/89/34/04/1340893404.db2.gz	AVQGMQIZZQNHNE-ZDUSSCGKSA-N	0	3	330.815	3.161	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC([C@H](C)NCc2nccn2CC)CC1	ZINC001029136744	1340939711	/nfs/dbraw/zinc/93/97/11/1340939711.db2.gz	KYMXWSPWHYWSTN-OXJNMPFZSA-N	0	3	346.519	3.222	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC([C@H](C)NCc2ccn(CC)n2)CC1	ZINC001029140165	1340940969	/nfs/dbraw/zinc/94/09/69/1340940969.db2.gz	RKDRODVQXLCLJY-JXFKEZNVSA-N	0	3	346.519	3.222	20	30		EGEDHN
C[C@H](C#N)C(=O)N1C[C@H]2CC[C@@H](C1)N2[C@H]1CCCc2ccc(F)cc21	ZINC001029245063	1340960484	/nfs/dbraw/zinc/96/04/84/1340960484.db2.gz	ORCXJMLZVRJADW-WKCGWZECSA-N	0	3	341.430	3.038	20	30		EGEDHN
Cc1ccc(CN(C)C[C@@H]2CCN(C(=O)[C@@H](C)C#N)C2)c(Cl)c1	ZINC001029677044	1341040557	/nfs/dbraw/zinc/04/05/57/1341040557.db2.gz	IGKYHVUSNZLFOF-GJZGRUSLSA-N	0	3	333.863	3.088	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H](CN(C)Cc2ncccc2C)C1	ZINC001029748470	1341062300	/nfs/dbraw/zinc/06/23/00/1341062300.db2.gz	DXMKAEIGNDDVPR-INIZCTEOSA-N	0	3	349.906	3.449	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H](CN(C)Cc2ncccc2C)C1	ZINC001029826478	1341087468	/nfs/dbraw/zinc/08/74/68/1341087468.db2.gz	QYFBOSVXYNDTFY-YLJYHZDGSA-N	0	3	329.488	3.273	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H](CN(C)Cc2c(C)noc2CC)C1	ZINC001029828631	1341088719	/nfs/dbraw/zinc/08/87/19/1341088719.db2.gz	GXWOOGJIMAPESZ-UZLBHIALSA-N	0	3	347.503	3.428	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](N(Cc2ccccc2)C(=O)[C@@H]2CCOC2)C1	ZINC001029918032	1341118086	/nfs/dbraw/zinc/11/80/86/1341118086.db2.gz	VHSLETJHUUKSDI-WOJBJXKFSA-N	0	3	342.483	3.092	20	30		EGEDHN
C#CCCN1CCC[C@@H](N(Cc2ccccc2)C(=O)c2cccnc2)C1	ZINC001029918780	1341118521	/nfs/dbraw/zinc/11/85/21/1341118521.db2.gz	IUMDBMZYIZDBSX-OAQYLSRUSA-N	0	3	347.462	3.212	20	30		EGEDHN
C#CCCN1CCC[C@@H](N(Cc2ccccc2)C(=O)[C@@H]2CC2(F)F)C1	ZINC001029919997	1341119268	/nfs/dbraw/zinc/11/92/68/1341119268.db2.gz	LWUAJKSRNWEHQX-MSOLQXFVSA-N	0	3	346.421	3.158	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC(CN(C)Cc2ccc(C#N)s2)CC1	ZINC001029937473	1341128596	/nfs/dbraw/zinc/12/85/96/1341128596.db2.gz	OBGVXWRMWLMNTN-CQSZACIVSA-N	0	3	333.501	3.336	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)CC1CCN(C(=O)C2CC=CC2)CC1	ZINC001029949299	1341131456	/nfs/dbraw/zinc/13/14/56/1341131456.db2.gz	NEWXCSDSNMCKSH-UHFFFAOYSA-N	0	3	343.496	3.256	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC(CN(C)Cc2cncs2)CC1	ZINC001029983232	1341143749	/nfs/dbraw/zinc/14/37/49/1341143749.db2.gz	YQTAAOQUZWDTAU-UHFFFAOYSA-N	0	3	335.517	3.416	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC(CN(C)Cc2cn(C)nc2C)CC1	ZINC001029989986	1341147700	/nfs/dbraw/zinc/14/77/00/1341147700.db2.gz	FHPDWUSFYBMZIB-FQEVSTJZSA-N	0	3	346.519	3.001	20	30		EGEDHN
C[C@@H]1C[C@@H]1CC(=O)N1CCC(CN(C)Cc2ccc(C#N)s2)CC1	ZINC001029991235	1341148499	/nfs/dbraw/zinc/14/84/99/1341148499.db2.gz	VTESKZVERHRDJM-GDBMZVCRSA-N	0	3	345.512	3.336	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC001032476331	1341518496	/nfs/dbraw/zinc/51/84/96/1341518496.db2.gz	IHBIHUNKLHHCCM-CAOSSQGBSA-N	0	3	342.405	3.382	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1nc2ccccc2cc1C	ZINC001032528454	1341532171	/nfs/dbraw/zinc/53/21/71/1341532171.db2.gz	SMXMMMLOHLVEHN-ROUUACIJSA-N	0	3	335.451	3.408	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cnn([C@H](C)CC)c1C	ZINC001032723611	1341591996	/nfs/dbraw/zinc/59/19/96/1341591996.db2.gz	NGBFQTBQMHSTNS-PVAVHDDUSA-N	0	3	330.476	3.027	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@]1(c2ccccc2)C[C@H](F)C1	ZINC001032757557	1341604541	/nfs/dbraw/zinc/60/45/41/1341604541.db2.gz	URMGOIOEBOILAI-IWFBPKFRSA-N	0	3	342.458	3.308	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)CCc1c[nH]c2ccccc12	ZINC001032765826	1341607203	/nfs/dbraw/zinc/60/72/03/1341607203.db2.gz	HJWGIDBOBOQOHA-ROUUACIJSA-N	0	3	337.467	3.352	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C[C@H](C)c1ccc(OC)cc1	ZINC001032794854	1341616173	/nfs/dbraw/zinc/61/61/73/1341616173.db2.gz	UVPGODHQAHKHQW-WDSOQIARSA-N	0	3	342.483	3.440	20	30		EGEDHN
CN(C(=O)c1cc(C#N)c[nH]1)[C@@H]1CCN(Cc2ccccc2C2CC2)C1	ZINC001032988069	1341686305	/nfs/dbraw/zinc/68/63/05/1341686305.db2.gz	XCZUKXFBFCEBSH-GOSISDBHSA-N	0	3	348.450	3.110	20	30		EGEDHN
CN(C(=O)c1cc(C#N)c[nH]1)[C@H]1CCN(Cc2ccccc2C2CC2)C1	ZINC001032988070	1341686625	/nfs/dbraw/zinc/68/66/25/1341686625.db2.gz	XCZUKXFBFCEBSH-SFHVURJKSA-N	0	3	348.450	3.110	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N(C)[C@@H]1CCN(Cc2ccc(C)cc2)C1	ZINC001033093668	1341720942	/nfs/dbraw/zinc/72/09/42/1341720942.db2.gz	VRBQSQHQFXVOGS-AQNXPRMDSA-N	0	3	342.483	3.009	20	30		EGEDHN
C#CCCN1CC[C@@H](N(C)C(=O)c2csc3cc(C)ccc32)C1	ZINC001033111070	1341729375	/nfs/dbraw/zinc/72/93/75/1341729375.db2.gz	PSTYXTQIRJEQKZ-OAHLLOKOSA-N	0	3	326.465	3.379	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)[C@@H]2CC=CC[C@H]2C(F)(F)F)C1	ZINC001033192942	1341749272	/nfs/dbraw/zinc/74/92/72/1341749272.db2.gz	ZERDVUMXKSEXOI-RRFJBIMHSA-N	0	3	330.394	3.240	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N(C)[C@H]1CCN(Cc2ccc(C)cc2)C1	ZINC001033497152	1341847652	/nfs/dbraw/zinc/84/76/52/1341847652.db2.gz	KLBOEVKNADGVDY-UFYCRDLUSA-N	0	3	342.483	3.009	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@H]2CCN(Cc3cc(C)cc(C)c3)C2)cn1	ZINC001033596573	1341889938	/nfs/dbraw/zinc/88/99/38/1341889938.db2.gz	LYMDPGHEKDQJHL-NRFANRHFSA-N	0	3	347.462	3.026	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2ccc(COC(C)C)cc2)C1	ZINC001033659362	1341933512	/nfs/dbraw/zinc/93/35/12/1341933512.db2.gz	ZDNWMKJNZAAPIT-LJQANCHMSA-N	0	3	330.472	3.334	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)[C@]2(C)CCc3ccccc3C2)C1	ZINC001033713803	1341972868	/nfs/dbraw/zinc/97/28/68/1341972868.db2.gz	IOFRADLYAQUPJT-TZIWHRDSSA-N	0	3	326.484	3.290	20	30		EGEDHN
C=CCCN1CC[C@@H](N(CC)C(=O)c2sc(C3CC3)nc2C)C1	ZINC001033828660	1342029308	/nfs/dbraw/zinc/02/93/08/1342029308.db2.gz	QZHLMHRHYGPIBY-OAHLLOKOSA-N	0	3	333.501	3.441	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccc3c(c2)[C@@H](C)CO3)C1	ZINC001033931202	1342094685	/nfs/dbraw/zinc/09/46/85/1342094685.db2.gz	DEDKKRZKTWHOKX-DOTOQJQBSA-N	0	3	328.456	3.295	20	30		EGEDHN
C=C1CCC(C(=O)N(CC)[C@H]2CCN(CCOC3CCC3)C2)CC1	ZINC001033943667	1342105123	/nfs/dbraw/zinc/10/51/23/1342105123.db2.gz	AGYFSDVNCGAXCY-SFHVURJKSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cc(-c3cccs3)n[nH]2)C1	ZINC001033963011	1342115691	/nfs/dbraw/zinc/11/56/91/1342115691.db2.gz	IYUUZKRXVPRREX-CQSZACIVSA-N	0	3	344.484	3.251	20	30		EGEDHN
C=CCCN1CC[C@H](N(CC)C(=O)c2oc(CC(C)C)nc2C)C1	ZINC001033978627	1342126732	/nfs/dbraw/zinc/12/67/32/1342126732.db2.gz	AWXSJMGQBVZNOY-INIZCTEOSA-N	0	3	333.476	3.294	20	30		EGEDHN
CC(C)(C)C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C12CCC2	ZINC001078788811	1357084585	/nfs/dbraw/zinc/08/45/85/1357084585.db2.gz	MIUCLNOCZXAXHQ-IRXDYDNUSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccnc(OC3CCC3)c2)C1	ZINC001033997923	1342137836	/nfs/dbraw/zinc/13/78/36/1342137836.db2.gz	IYNVLRKHSDVCCJ-KRWDZBQOSA-N	0	3	343.471	3.125	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccc3ncsc3c2)C1	ZINC001034036273	1342175035	/nfs/dbraw/zinc/17/50/35/1342175035.db2.gz	UXGWCNZEJRHLDW-OAHLLOKOSA-N	0	3	329.469	3.409	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2ccc(OCC3CC3)cc2)C1	ZINC001034044032	1342184893	/nfs/dbraw/zinc/18/48/93/1342184893.db2.gz	IWXZPSKXXHQQEV-IBGZPJMESA-N	0	3	340.467	3.035	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)[C@@H]2CCCCc3ccccc32)C1	ZINC001034047532	1342186905	/nfs/dbraw/zinc/18/69/05/1342186905.db2.gz	FJLADAIGMMGENJ-PZJWPPBQSA-N	0	3	338.495	3.443	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2ccc(N(C)C(C)C)cc2)C1	ZINC001034055380	1342196256	/nfs/dbraw/zinc/19/62/56/1342196256.db2.gz	TXTNLASZLJFVRO-HXUWFJFHSA-N	0	3	341.499	3.091	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)Cc2coc3cc(F)ccc23)C1	ZINC001034200880	1342310718	/nfs/dbraw/zinc/31/07/18/1342310718.db2.gz	SSODBNQRMBLLTM-MRXNPFEDSA-N	0	3	330.403	3.271	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@H]2CCc3cc(OC)ccc32)C1	ZINC001034233423	1342336644	/nfs/dbraw/zinc/33/66/44/1342336644.db2.gz	DICQIIMPSZRSLC-PXNSSMCTSA-N	0	3	342.483	3.272	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)[C@@H]2CCCO[C@H]2c2ccccc2)C1	ZINC001034246573	1342344990	/nfs/dbraw/zinc/34/49/90/1342344990.db2.gz	GLJJYNLALQHODF-AQNXPRMDSA-N	0	3	342.483	3.311	20	30		EGEDHN
C=C(C)CCN1CCCC[C@@H](NC(=O)c2ncc(Cl)s2)C1	ZINC001034307817	1342391132	/nfs/dbraw/zinc/39/11/32/1342391132.db2.gz	OGMXTTYVMWBRRR-GFCCVEGCSA-N	0	3	327.881	3.347	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2cc3c(o2)c(F)ccc3C)C1	ZINC001034323960	1342400070	/nfs/dbraw/zinc/40/00/70/1342400070.db2.gz	RVPDMWOQFYQVOG-OAHLLOKOSA-N	0	3	342.414	3.488	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc(C(F)(F)F)nc2)C1	ZINC001034334774	1342409497	/nfs/dbraw/zinc/40/94/97/1342409497.db2.gz	MCCVJQHPSDTRRI-CQSZACIVSA-N	0	3	341.377	3.261	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)C2(c3cccc(F)c3)CC2)C1	ZINC001034429924	1342491610	/nfs/dbraw/zinc/49/16/10/1342491610.db2.gz	XSZKNCJVYBPMMI-SFHVURJKSA-N	0	3	330.447	3.404	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc(-n3cccc3)nc2)C1	ZINC001034443815	1342504327	/nfs/dbraw/zinc/50/43/27/1342504327.db2.gz	JUEZTHGCLILYIO-SFHVURJKSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2c[nH]nc2-c2ccsc2)C1	ZINC001034466911	1342521234	/nfs/dbraw/zinc/52/12/34/1342521234.db2.gz	HUNVRCNOZIVQDK-OAHLLOKOSA-N	0	3	344.484	3.299	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc(OCC)c(OC)c2)C1	ZINC001034518768	1342577313	/nfs/dbraw/zinc/57/73/13/1342577313.db2.gz	BXRAJQYWISMKCG-QGZVFWFLSA-N	0	3	346.471	3.254	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@]2(C)CCc3ccccc32)C1	ZINC001034543880	1342605067	/nfs/dbraw/zinc/60/50/67/1342605067.db2.gz	BPZISZGSECFIIY-WIYYLYMNSA-N	0	3	326.484	3.437	20	30		EGEDHN
N#Cc1ccccc1C[NH2+][C@H]1CC[C@H](NC(=O)c2ccccc2[O-])CC1	ZINC001034597252	1342640371	/nfs/dbraw/zinc/64/03/71/1342640371.db2.gz	VLYXUFNNWVBLMS-IYARVYRRSA-N	0	3	349.434	3.095	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)[C@@H]2C[C@H]2C(C)C)CC1	ZINC001034772762	1342752497	/nfs/dbraw/zinc/75/24/97/1342752497.db2.gz	YCXWKHSJAHBLEA-ZQDZILKHSA-N	0	3	343.309	3.204	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)[C@H]2CC=CCC2)cc1F	ZINC001034859034	1342808889	/nfs/dbraw/zinc/80/88/89/1342808889.db2.gz	OUPCEVABXQHAFG-FUHWJXTLSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)Cc2cccc(OC)c2)C12CCC2	ZINC001078797684	1357090102	/nfs/dbraw/zinc/09/01/02/1357090102.db2.gz	LCVHKOOTGSCOBN-IAGOWNOFSA-N	0	3	348.874	3.007	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001034904813	1342830492	/nfs/dbraw/zinc/83/04/92/1342830492.db2.gz	HEYOIGDLKDTDMA-OAHLLOKOSA-N	0	3	333.382	3.041	20	30		EGEDHN
Cc1ccc(CNC[C@H]2CCCN2C(=O)C#CC2CC2)c(Cl)c1	ZINC001034935189	1342843103	/nfs/dbraw/zinc/84/31/03/1342843103.db2.gz	HHPATRSGKUHXLA-QGZVFWFLSA-N	0	3	330.859	3.142	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2scnc2Cl)C12CCC2	ZINC001078812693	1357093981	/nfs/dbraw/zinc/09/39/81/1357093981.db2.gz	OKXXRUJNCCRVHI-NXEZZACHSA-N	0	3	346.283	3.180	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H]1CNCc1cc(CO)ccc1F	ZINC001035036623	1342890501	/nfs/dbraw/zinc/89/05/01/1342890501.db2.gz	CXBLWRYBVQHYRZ-YLJYHZDGSA-N	0	3	348.462	3.001	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]2CNCc2ccc(F)c(F)c2)C1	ZINC001035040953	1342893095	/nfs/dbraw/zinc/89/30/95/1342893095.db2.gz	GBFNZATWROTELZ-OAHLLOKOSA-N	0	3	334.410	3.402	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]2CNCc2cc(F)cc(F)c2)C1	ZINC001035044275	1342896493	/nfs/dbraw/zinc/89/64/93/1342896493.db2.gz	DKNZGILXDKSLBG-QGZVFWFLSA-N	0	3	334.410	3.402	20	30		EGEDHN
CC(C)CC(=O)N1CCC2(CCN(Cc3ccc(C#N)s3)C2)CC1	ZINC001035150497	1342963087	/nfs/dbraw/zinc/96/30/87/1342963087.db2.gz	ZBRPHRSQGJJLTE-UHFFFAOYSA-N	0	3	345.512	3.480	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc3c(o1)CCCC3)CC2	ZINC001035722226	1343152592	/nfs/dbraw/zinc/15/25/92/1343152592.db2.gz	IVPQJGAHLAYGOP-UHFFFAOYSA-N	0	3	328.456	3.273	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cc1cc(C)c(Cl)cn1)CC2	ZINC001035732735	1343158257	/nfs/dbraw/zinc/15/82/57/1343158257.db2.gz	GELLCXRKZVJLCA-UHFFFAOYSA-N	0	3	347.890	3.086	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cc(Cl)ccc1F)CC2	ZINC001035745212	1343165690	/nfs/dbraw/zinc/16/56/90/1343165690.db2.gz	FBHQPPLFWFGMPS-UHFFFAOYSA-N	0	3	334.822	3.040	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)Cc1cccc(C)c1Cl)CC2	ZINC001035746488	1343166239	/nfs/dbraw/zinc/16/62/39/1343166239.db2.gz	VIDKMOJRBMPMPM-UHFFFAOYSA-N	0	3	344.886	3.139	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC2(CN(C[C@H]3CC[C@H](C)O3)C2)CC1	ZINC001035767724	1343179860	/nfs/dbraw/zinc/17/98/60/1343179860.db2.gz	VOJAVFJOCYELDH-DLBZAZTESA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H]1CCCC(F)(F)C1)CC2	ZINC001035794700	1343202607	/nfs/dbraw/zinc/20/26/07/1343202607.db2.gz	KRNDYGFMMDIZGI-OAHLLOKOSA-N	0	3	326.431	3.312	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@@H](c1ccccc1)C(C)C)CC2	ZINC001035803808	1343206480	/nfs/dbraw/zinc/20/64/80/1343206480.db2.gz	KNABGWDWJMFWRW-HXUWFJFHSA-N	0	3	338.495	3.374	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H]1CCc3ccccc3C1)CC2	ZINC001035805291	1343207218	/nfs/dbraw/zinc/20/72/18/1343207218.db2.gz	CTNMFOCDDDRXLU-HXUWFJFHSA-N	0	3	338.495	3.292	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)CO[C@H]1CCCC[C@H]1C)CC2	ZINC001035807916	1343208217	/nfs/dbraw/zinc/20/82/17/1343208217.db2.gz	XCOWNSDNHYPVSD-MSOLQXFVSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc3c(c1)C[C@@H](C)O3)CC2	ZINC001035820637	1343215247	/nfs/dbraw/zinc/21/52/47/1343215247.db2.gz	YHYFBSBIHADDFD-MRXNPFEDSA-N	0	3	340.467	3.124	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cccc3ccncc31)CC2	ZINC001035826540	1343216343	/nfs/dbraw/zinc/21/63/43/1343216343.db2.gz	OTRXZPQXUDHQLB-UHFFFAOYSA-N	0	3	335.451	3.349	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)CC[C@@H]1CC(C)(C)CO1)CC2	ZINC001035841847	1343224177	/nfs/dbraw/zinc/22/41/77/1343224177.db2.gz	MNQQXELAYNKQEU-QGZVFWFLSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H](OC)c1ccc(F)cc1)CC2	ZINC001035860398	1343236534	/nfs/dbraw/zinc/23/65/34/1343236534.db2.gz	MHASWINOHLVUNJ-SFHVURJKSA-N	0	3	346.446	3.014	20	30		EGEDHN
C[C@H]1CN(C(=O)c2ccsc2)CC[C@@H]1NCc1ccccc1C#N	ZINC001035901991	1343259852	/nfs/dbraw/zinc/25/98/52/1343259852.db2.gz	SFQGYVDEWKQGQH-KSSFIOAISA-N	0	3	339.464	3.260	20	30		EGEDHN
C/C(=C/C(=O)N1CC[C@H](NCc2ccccc2C#N)[C@@H](C)C1)C1CC1	ZINC001035938605	1343280595	/nfs/dbraw/zinc/28/05/95/1343280595.db2.gz	DSLLHYLFDAZEHA-SKBXDANDSA-N	0	3	337.467	3.241	20	30		EGEDHN
C[C@H]1CN(C(=O)C2(C)CCCC2)CC[C@@H]1NCc1ccccc1C#N	ZINC001036136752	1343322648	/nfs/dbraw/zinc/32/26/48/1343322648.db2.gz	SIOJJUPPKRHUJI-LPHOPBHVSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](NCc2nc(C)oc2C)[C@@H](C)C1	ZINC001036139437	1343324502	/nfs/dbraw/zinc/32/45/02/1343324502.db2.gz	ZHXFEKFPAXDJJO-XJKSGUPXSA-N	0	3	333.476	3.220	20	30		EGEDHN
C[C@@H](NCc1c(F)cccc1F)[C@H]1CCCN(C(=O)C#CC2CC2)C1	ZINC001036405038	1343467439	/nfs/dbraw/zinc/46/74/39/1343467439.db2.gz	OOPSREWYCFRNMH-ZBFHGGJFSA-N	0	3	346.421	3.095	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]([C@H](C)NCc3nc(C)oc3C)C2)C1	ZINC001036443539	1343491344	/nfs/dbraw/zinc/49/13/44/1343491344.db2.gz	HYPBOTKIENEXFR-YOEHRIQHSA-N	0	3	345.487	3.364	20	30		EGEDHN
C[C@@H](NCc1cc(F)ccc1C#N)[C@H]1CCCN(C(=O)C(C)(C)C)C1	ZINC001036464629	1343500276	/nfs/dbraw/zinc/50/02/76/1343500276.db2.gz	KQHXYOGWOAIPHO-ZBFHGGJFSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@H]2[C@H](CCN2Cc2ccc(C#N)c(F)c2)C1	ZINC001036628181	1343585322	/nfs/dbraw/zinc/58/53/22/1343585322.db2.gz	WYPPHQZXXHFTNP-MJGOQNOKSA-N	0	3	343.446	3.166	20	30		EGEDHN
C/C(=C/C(=O)N1CC[C@@H]2[C@H](CCN2CC#Cc2ccccc2)C1)C1CC1	ZINC001036659477	1343605898	/nfs/dbraw/zinc/60/58/98/1343605898.db2.gz	ZSDWERSNUWKANO-QGSCIIRKSA-N	0	3	348.490	3.317	20	30		EGEDHN
C/C=C(/C)C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001036682363	1343623924	/nfs/dbraw/zinc/62/39/24/1343623924.db2.gz	CCGCMCOASFWAID-MUHVUHTASA-N	0	3	329.469	3.009	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001036687245	1343630873	/nfs/dbraw/zinc/63/08/73/1343630873.db2.gz	ZOPBZDUNYKWLPE-CZUORRHYSA-N	0	3	347.459	3.306	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2cnc(C)s2)C1	ZINC001036789304	1343720005	/nfs/dbraw/zinc/72/00/05/1343720005.db2.gz	PEPCIQGOYWAENU-GOEBONIOSA-N	0	3	333.501	3.087	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001036791680	1343722118	/nfs/dbraw/zinc/72/21/18/1343722118.db2.gz	CKEFXFAAGFKBKX-RHSMWYFYSA-N	0	3	343.496	3.255	20	30		EGEDHN
CC1(C(=O)N2CC[C@H]3[C@@H](CCN3Cc3ccc(C#N)s3)C2)CCC1	ZINC001036792662	1343723412	/nfs/dbraw/zinc/72/34/12/1343723412.db2.gz	SHQIKMRQKFUYQX-YOEHRIQHSA-N	0	3	343.496	3.233	20	30		EGEDHN
CCC1(C(=O)N2CC[C@@H]3[C@@H](CCN3Cc3ccc(C#N)s3)C2)CC1	ZINC001036814089	1343751639	/nfs/dbraw/zinc/75/16/39/1343751639.db2.gz	IXYHUVIXTDECBN-WMLDXEAASA-N	0	3	343.496	3.233	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]3[C@H](CCN3Cc3conc3CC)C2)C1	ZINC001036816083	1343753426	/nfs/dbraw/zinc/75/34/26/1343753426.db2.gz	PSEIKKFJGVVMEJ-CRAIPNDOSA-N	0	3	343.471	3.016	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H]2CCC[C@H]2CNCc2ccccc2C#N)o1	ZINC001036938538	1343881809	/nfs/dbraw/zinc/88/18/09/1343881809.db2.gz	WTJGMBLUCVHIKU-ZWKOTPCHSA-N	0	3	337.423	3.148	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCC[C@@H]1NC(=O)C1(F)CCCC1	ZINC001037033269	1343940708	/nfs/dbraw/zinc/94/07/08/1343940708.db2.gz	NGZLDHKEDPVCBP-ROUUACIJSA-N	0	3	343.446	3.215	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)C(C)(C)C(=C)Cl)[C@H](OC)C1	ZINC001212337637	1372690774	/nfs/dbraw/zinc/69/07/74/1372690774.db2.gz	YHYKSLACDGWFEP-HZPDHXFCSA-N	0	3	342.911	3.327	20	30		EGEDHN
CC(C)C(=O)N[C@H]1CCCC[C@H]1CNCc1cc(F)ccc1C#N	ZINC001037188772	1344028536	/nfs/dbraw/zinc/02/85/36/1344028536.db2.gz	RLDGCTCQOTZQHD-YJBOKZPZSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NC[C@@H]1CCN1CCC1=CCCCC1	ZINC001038265771	1344349554	/nfs/dbraw/zinc/34/95/54/1344349554.db2.gz	HJKNOYCTKQLRRJ-OTWHNJEPSA-N	0	3	332.488	3.049	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CCN2C[C@H]2CCC(F)(F)C2)CC1	ZINC001038668333	1344531734	/nfs/dbraw/zinc/53/17/34/1344531734.db2.gz	UEXJTOXDIWGEOQ-GOEBONIOSA-N	0	3	326.431	3.359	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)[C@H](C)SC)CC2)C1	ZINC001039109910	1344781576	/nfs/dbraw/zinc/78/15/76/1344781576.db2.gz	OWZBGWQCFQZYMY-ZFWWWQNUSA-N	0	3	330.925	3.051	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)[C@@H](C)n3cccc3)CC2)C1	ZINC001039125103	1344801689	/nfs/dbraw/zinc/80/16/89/1344801689.db2.gz	PELFCKLCAPYSRR-AEFFLSMTSA-N	0	3	349.906	3.362	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)Cc3ccco3)CC2)C1	ZINC001039162150	1344848164	/nfs/dbraw/zinc/84/81/64/1344848164.db2.gz	PCKANOYINHEOPO-INIZCTEOSA-N	0	3	336.863	3.135	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccoc2Cl)C1	ZINC001039199010	1344908936	/nfs/dbraw/zinc/90/89/36/1344908936.db2.gz	NXXLLNUAZHSRNH-GDBMZVCRSA-N	0	3	334.847	3.273	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2csc(C)c2C)C1	ZINC001039204310	1344915617	/nfs/dbraw/zinc/91/56/17/1344915617.db2.gz	ZIYXYZKKNAUXIG-FUHWJXTLSA-N	0	3	330.497	3.315	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc[nH]c2C(C)C)C1	ZINC001039224930	1344943167	/nfs/dbraw/zinc/94/31/67/1344943167.db2.gz	KYCRPDBXBBXMTJ-PKOBYXMFSA-N	0	3	341.499	3.478	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc3ccc(C)cc3[nH]2)C1	ZINC001039226009	1344944559	/nfs/dbraw/zinc/94/45/59/1344944559.db2.gz	RHBWSTHVVOCFLD-RXVVDRJESA-N	0	3	349.478	3.426	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)Cc2ccc(C)c(C)c2)C1	ZINC001039237050	1344959172	/nfs/dbraw/zinc/95/91/72/1344959172.db2.gz	ATRVSQOSRFMICF-NHCUHLMSSA-N	0	3	338.495	3.182	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccoc1C(F)(F)F	ZINC001039381736	1345036368	/nfs/dbraw/zinc/03/63/68/1345036368.db2.gz	YNHOVYJLNNIMEV-OLZOCXBDSA-N	0	3	340.345	3.001	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1[nH]nc(C2CC2)c1Cl	ZINC001039399295	1345046456	/nfs/dbraw/zinc/04/64/56/1345046456.db2.gz	RVMGGOUTEQWVOZ-KGLIPLIRSA-N	0	3	348.878	3.196	20	30		EGEDHN
C=CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1nc(Cl)cs1	ZINC001039424668	1345061991	/nfs/dbraw/zinc/06/19/91/1345061991.db2.gz	BXSYWZPVTRNIAY-NEPJUHHUSA-N	0	3	325.865	3.052	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1c(F)cccc1F	ZINC001039424598	1345062167	/nfs/dbraw/zinc/06/21/67/1345062167.db2.gz	YVRJEQHGVJKXPL-CABCVRRESA-N	0	3	334.410	3.149	20	30		EGEDHN
C=CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1sccc1COC	ZINC001039458584	1345078029	/nfs/dbraw/zinc/07/80/29/1345078029.db2.gz	DGAZKUPMDXCBJX-CVEARBPZSA-N	0	3	334.485	3.150	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)COc1ccc(C)c(C)c1	ZINC001039468521	1345086326	/nfs/dbraw/zinc/08/63/26/1345086326.db2.gz	RNQGZUYRRFQCJS-MOPGFXCFSA-N	0	3	342.483	3.324	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)COc1cc(C)cc(C)c1	ZINC001039469007	1345086437	/nfs/dbraw/zinc/08/64/37/1345086437.db2.gz	RCIDBZHACLDPQC-MOPGFXCFSA-N	0	3	342.483	3.324	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C1(c2cccc(C)c2)CC1	ZINC001039474856	1345089498	/nfs/dbraw/zinc/08/94/98/1345089498.db2.gz	ITSCQVQZWVDMLX-UXHICEINSA-N	0	3	336.479	3.115	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc2cccc(C)c2o1	ZINC001039475603	1345090239	/nfs/dbraw/zinc/09/02/39/1345090239.db2.gz	ZMPNLFOEXUSNKT-MSOLQXFVSA-N	0	3	336.435	3.443	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@]3(CCN(C(=O)c4ccco4)C3)C2)c1	ZINC001040044345	1345308681	/nfs/dbraw/zinc/30/86/81/1345308681.db2.gz	QJFCPLAGOCTDFY-OAQYLSRUSA-N	0	3	349.434	3.280	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3c(C)noc3C(C)C)C2)C1	ZINC001040253698	1345396486	/nfs/dbraw/zinc/39/64/86/1345396486.db2.gz	PXGUOWSMSRSTRA-FQEVSTJZSA-N	0	3	343.471	3.058	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cscc3Cl)C2)C1	ZINC001040253115	1345396958	/nfs/dbraw/zinc/39/69/58/1345396958.db2.gz	HCZKHIILSOWZGB-QGZVFWFLSA-N	0	3	336.888	3.353	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)Cc3ccc(C)cc3Cl)C2)C1	ZINC001040265820	1345403179	/nfs/dbraw/zinc/40/31/79/1345403179.db2.gz	FGONTIWKNVEBJO-HXUWFJFHSA-N	0	3	344.886	3.139	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3cn(CC)c4ccccc34)C2)C1	ZINC001040283649	1345411633	/nfs/dbraw/zinc/41/16/33/1345411633.db2.gz	NZTKYXPYIXLPBV-QFIPXVFZSA-N	0	3	349.478	3.223	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3scnc3C(F)F)C2)C1	ZINC001040291171	1345415577	/nfs/dbraw/zinc/41/55/77/1345415577.db2.gz	LVPAMCDOQWONSL-INIZCTEOSA-N	0	3	341.427	3.195	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3c(F)cc(F)cc3F)C2)C1	ZINC001040358858	1345453298	/nfs/dbraw/zinc/45/32/98/1345453298.db2.gz	AJFUIZSOYKBZNY-GOSISDBHSA-N	0	3	338.373	3.218	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@]3(CCN(C(=O)[C@H]4CC45CC5)C3)C2)cc1	ZINC001040421066	1345488279	/nfs/dbraw/zinc/48/82/79/1345488279.db2.gz	DJYAYOIHCNIABL-TZIWHRDSSA-N	0	3	349.478	3.173	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@@H](C)c3cccc(C)c3)C2)C1	ZINC001040422401	1345489073	/nfs/dbraw/zinc/48/90/73/1345489073.db2.gz	MLHAQCAAJLJGAJ-SIKLNZKXSA-N	0	3	338.495	3.436	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3[nH]c4ccc(C)cc4c3C)C2)C1	ZINC001040476917	1345512956	/nfs/dbraw/zinc/51/29/56/1345512956.db2.gz	BAOUOSJAONRIIK-JOCHJYFZSA-N	0	3	349.478	3.346	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)Cc3ccc4ccccc4c3)C2)C1	ZINC001040522549	1345531513	/nfs/dbraw/zinc/53/15/13/1345531513.db2.gz	MYVOYQFTROBAQQ-HSZRJFAPSA-N	0	3	346.474	3.330	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)C34CC(c5ccccc5)(C3)C4)C2)C1	ZINC001040544853	1345539026	/nfs/dbraw/zinc/53/90/26/1345539026.db2.gz	LCKOIHMFEXOKCP-UVKLAMSESA-N	0	3	348.490	3.056	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@H]3CCCC4(CC4)C3)C2)CC1	ZINC001040704509	1345568129	/nfs/dbraw/zinc/56/81/29/1345568129.db2.gz	YJPOUVAYHSLCDQ-SFHVURJKSA-N	0	3	328.500	3.295	20	30		EGEDHN
CC1(C(=O)N2CCC3(C2)CCN(Cc2cccc(C#N)c2)CC3)CC1	ZINC001040710734	1345568879	/nfs/dbraw/zinc/56/88/79/1345568879.db2.gz	OTTSZDXZAKWDOJ-UHFFFAOYSA-N	0	3	337.467	3.173	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCC2(C1)CCN(C/C=C/Cl)CC2	ZINC001040730123	1345571803	/nfs/dbraw/zinc/57/18/03/1345571803.db2.gz	QQSSCHUTDNKYRC-RUDMXATFSA-N	0	3	347.890	3.355	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccc4c(c3)CCC=C4)C2)CC1	ZINC001040913805	1345599328	/nfs/dbraw/zinc/59/93/28/1345599328.db2.gz	HACXZPLUTDUNGZ-UHFFFAOYSA-N	0	3	334.463	3.207	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccc(CC(C)C)cc3)C2)CC1	ZINC001040936080	1345604846	/nfs/dbraw/zinc/60/48/46/1345604846.db2.gz	UHLIOFUUXBMVDP-UHFFFAOYSA-N	0	3	338.495	3.446	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cc4cccc(F)c4o3)C2)CC1	ZINC001040944005	1345606464	/nfs/dbraw/zinc/60/64/64/1345606464.db2.gz	DHFLZRVLWDAHPS-UHFFFAOYSA-N	0	3	340.398	3.133	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@]3(CCN(C(=O)c4ccccc4)C3)C2)cc1	ZINC001041025204	1345626549	/nfs/dbraw/zinc/62/65/49/1345626549.db2.gz	ABGQLJOIXDCJSY-QFIPXVFZSA-N	0	3	345.446	3.296	20	30		EGEDHN
C/C(=C\C(=O)N1CC[C@]2(CCN(Cc3ccc(C#N)cc3)C2)C1)C1CC1	ZINC001041098319	1345652319	/nfs/dbraw/zinc/65/23/19/1345652319.db2.gz	RXTXIHCXLCDBJC-PFSBYRDKSA-N	0	3	349.478	3.339	20	30		EGEDHN
CC1CC(C(=O)N2CC[C@@]3(CCN(Cc4cccc(C#N)c4)C3)C2)C1	ZINC001041198239	1345674810	/nfs/dbraw/zinc/67/48/10/1345674810.db2.gz	MZONQGJGEABHJZ-VFIGECHUSA-N	0	3	337.467	3.029	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cc4ccccc4nc3C)C2)C1	ZINC001041335682	1345705707	/nfs/dbraw/zinc/70/57/07/1345705707.db2.gz	AGYJXGCVNHPWLQ-QFIPXVFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)[C@H](c3ccccc3)C3CC3)C2)C1	ZINC001041463628	1345734964	/nfs/dbraw/zinc/73/49/64/1345734964.db2.gz	IEKXVLWIWDMQJO-IFMALSPDSA-N	0	3	336.479	3.128	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@]2(CCN(Cc3cccnc3C)C2)C1	ZINC001041536508	1345755263	/nfs/dbraw/zinc/75/52/63/1345755263.db2.gz	OHQBYVFYGOXQBY-NRFANRHFSA-N	0	3	341.499	3.417	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@]2(CCN(Cc3sc(C)nc3C)C2)C1	ZINC001041543911	1345758860	/nfs/dbraw/zinc/75/88/60/1345758860.db2.gz	LVLCYXSRVSXVCN-IBGZPJMESA-N	0	3	347.528	3.397	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)[C@@H]3C[C@H]3c3ccc(Cl)s3)C2)C1	ZINC001041598977	1345788400	/nfs/dbraw/zinc/78/84/00/1345788400.db2.gz	PAYVSHIRHGTOBI-HBUWYVDXSA-N	0	3	348.899	3.063	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)C(C3CCC3)C3CCC3)C2)C1	ZINC001041605834	1345789782	/nfs/dbraw/zinc/78/97/82/1345789782.db2.gz	NFVSOSMLHBYWRW-NRFANRHFSA-N	0	3	328.500	3.151	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@]3(CCN(CCC(F)(F)F)C3)C2)C1	ZINC001041657719	1345813331	/nfs/dbraw/zinc/81/33/31/1345813331.db2.gz	TZGJUGUMNJETQZ-INIZCTEOSA-N	0	3	330.394	3.220	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)[C@@H]3C[C@H]3c3cccc(Cl)c3)C2)C1	ZINC001041730086	1345834917	/nfs/dbraw/zinc/83/49/17/1345834917.db2.gz	IZQQPIIUTTWKCY-NSHGMRRFSA-N	0	3	342.870	3.001	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)[C@@H]3C[C@H]3c3ccc(Cl)cc3)C2)C1	ZINC001041736542	1345836157	/nfs/dbraw/zinc/83/61/57/1345836157.db2.gz	TUSXEKWPLWJPNB-NSHGMRRFSA-N	0	3	342.870	3.001	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)[C@@H](C)c3ccc(C)s3)C2)C1	ZINC001041788110	1345850467	/nfs/dbraw/zinc/85/04/67/1345850467.db2.gz	WGRCWHMXBFCPRF-LPHOPBHVSA-N	0	3	330.497	3.108	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)C[C@H]3CCCc4ccccc43)C2)C1	ZINC001041798518	1345854452	/nfs/dbraw/zinc/85/44/52/1345854452.db2.gz	YHHSMFCLECSMPX-KNQAVFIVSA-N	0	3	336.479	3.054	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3coc4ccc(F)cc43)C2)C1	ZINC001041809958	1345858630	/nfs/dbraw/zinc/85/86/30/1345858630.db2.gz	WLKKSAGBKRIQDX-HXUWFJFHSA-N	0	3	340.398	3.133	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccc(C(C)(F)F)cc3)C2)C1	ZINC001041867973	1345877527	/nfs/dbraw/zinc/87/75/27/1345877527.db2.gz	YXAWOXKFFKUSLR-FQEVSTJZSA-N	0	3	346.421	3.360	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@@H]2CCN(Cc3cccc(C#N)c3)[C@@H]2C1	ZINC001041948946	1345905988	/nfs/dbraw/zinc/90/59/88/1345905988.db2.gz	AHOFFFHBNHYHIU-VQTJNVASSA-N	0	3	339.483	3.417	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CCN(C(=O)C4=CCCC4)C[C@@H]32)c1	ZINC001042010917	1345924275	/nfs/dbraw/zinc/92/42/75/1345924275.db2.gz	RWDJMXHTRZCONZ-QUCCMNQESA-N	0	3	335.451	3.091	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccoc3C(F)(F)F)C[C@@H]21	ZINC001042075774	1345938285	/nfs/dbraw/zinc/93/82/85/1345938285.db2.gz	NRTSEHQZPXLHCS-AAEUAGOBSA-N	0	3	328.334	3.021	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cccc4c3CCCC4)C[C@@H]21	ZINC001042077615	1345939029	/nfs/dbraw/zinc/93/90/29/1345939029.db2.gz	MLIDANYDPPDACD-RXVVDRJESA-N	0	3	336.479	3.125	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3cc4c(o3)CCCC4)C[C@H]21	ZINC001042090288	1345941134	/nfs/dbraw/zinc/94/11/34/1345941134.db2.gz	JGULZILWAFFNII-DOTOQJQBSA-N	0	3	328.456	3.271	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(-c4ccncc4)o3)C[C@H]21	ZINC001042094403	1345942146	/nfs/dbraw/zinc/94/21/46/1345942146.db2.gz	RNGUUSRJSGISTG-NVXWUHKLSA-N	0	3	337.423	3.064	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C3C4CC5CC(C4)CC3C5)C[C@@H]21	ZINC001042095870	1345943065	/nfs/dbraw/zinc/94/30/65/1345943065.db2.gz	RFYVBVRDWBECPR-JSDMQDOWSA-N	0	3	328.500	3.168	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cccc4ccc(C)nc43)C[C@H]21	ZINC001042111666	1345947106	/nfs/dbraw/zinc/94/71/06/1345947106.db2.gz	MJLXYSYVTZUWSR-YLJYHZDGSA-N	0	3	347.462	3.103	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C3(C)CCC(F)(F)CC3)C[C@@H]21	ZINC001042116295	1345948388	/nfs/dbraw/zinc/94/83/88/1345948388.db2.gz	BHDPWCXHYRNICR-CVEARBPZSA-N	0	3	338.442	3.148	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(-c4cnco4)cc3)C[C@@H]21	ZINC001042116010	1345948546	/nfs/dbraw/zinc/94/85/46/1345948546.db2.gz	FJRBZWVGWBBTAG-YJBOKZPZSA-N	0	3	337.423	3.064	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C3CCc4ccccc4CC3)C[C@H]21	ZINC001042125308	1345950848	/nfs/dbraw/zinc/95/08/48/1345950848.db2.gz	RKWCKJJPMAKKTH-TZIWHRDSSA-N	0	3	338.495	3.290	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C3(c4ccc(F)cc4)CCC3)C[C@H]21	ZINC001042177105	1345968068	/nfs/dbraw/zinc/96/80/68/1345968068.db2.gz	UJTVORZJMHOHSX-VQIMIIECSA-N	0	3	342.458	3.356	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2CCN(Cc3scnc3C)[C@H]2C1	ZINC001042183330	1345971086	/nfs/dbraw/zinc/97/10/86/1345971086.db2.gz	JGLFMJZMFDZFAH-CVEARBPZSA-N	0	3	347.528	3.477	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3CCN(C(=O)[C@H]4C[C@H]5C[C@H]5C4)C[C@H]32)cc1	ZINC001042197052	1345979595	/nfs/dbraw/zinc/97/95/95/1345979595.db2.gz	WSYMWPLMGLNIJP-WRTQPQOASA-N	0	3	349.478	3.027	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(F)c(Cl)cc3F)C[C@H]21	ZINC001042207776	1345986137	/nfs/dbraw/zinc/98/61/37/1345986137.db2.gz	UCOHLNZKOIFMRM-MEDUHNTESA-N	0	3	340.801	3.341	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@@H]2C1	ZINC001042208901	1345987062	/nfs/dbraw/zinc/98/70/62/1345987062.db2.gz	UPWJPTJRAIKANH-RBUKOAKNSA-N	0	3	339.483	3.417	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3CCN(C(=O)C4CC5(CC5)C4)C[C@H]32)cc1	ZINC001042232055	1345997744	/nfs/dbraw/zinc/99/77/44/1345997744.db2.gz	IQYIMNZVCUVOSW-AZUAARDMSA-N	0	3	349.478	3.171	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3cnc(C)nc3C(C)C)C[C@@H]21	ZINC001042254299	1346007027	/nfs/dbraw/zinc/00/70/27/1346007027.db2.gz	KGCBZWMKTKUNAB-WMZOPIPTSA-N	0	3	342.487	3.021	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3sc(CC)nc3C)C[C@@H]21	ZINC001042264635	1346011259	/nfs/dbraw/zinc/01/12/59/1346011259.db2.gz	CJDWUVPZDYNIIG-CABCVRRESA-N	0	3	333.501	3.126	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cnoc3-c3ccccc3)C[C@@H]21	ZINC001042297899	1346022868	/nfs/dbraw/zinc/02/28/68/1346022868.db2.gz	XEGAXYPFNXAXFM-QAPCUYQASA-N	0	3	337.423	3.064	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)[C@@]3(c4ccccc4)C[C@H](F)C3)C[C@H]21	ZINC001042326960	1346035939	/nfs/dbraw/zinc/03/59/39/1346035939.db2.gz	STPWQNNVTFZCRV-ROPHOZQPSA-N	0	3	342.458	3.165	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)COc3c(C)cc(C)cc3C)C[C@H]21	ZINC001042331906	1346039292	/nfs/dbraw/zinc/03/92/92/1346039292.db2.gz	GBVWQOFYVVYUKC-RBUKOAKNSA-N	0	3	342.483	3.099	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(OC(C)C)cc3)C[C@@H]21	ZINC001042331235	1346039327	/nfs/dbraw/zinc/03/93/27/1346039327.db2.gz	ADPBUHHRNOVYRO-APWZRJJASA-N	0	3	328.456	3.196	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(Cl)ccc3OC)C[C@H]21	ZINC001042336801	1346042525	/nfs/dbraw/zinc/04/25/25/1346042525.db2.gz	AFSNZWOQCFAEEB-XJKSGUPXSA-N	0	3	334.847	3.071	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc4c(c3)CCCC4)C[C@H]21	ZINC001042343790	1346046588	/nfs/dbraw/zinc/04/65/88/1346046588.db2.gz	OKKSWEREVWPDHY-WIYYLYMNSA-N	0	3	336.479	3.125	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc4[nH]c(C)c(C)c4c3)C[C@@H]21	ZINC001042348203	1346049326	/nfs/dbraw/zinc/04/93/26/1346049326.db2.gz	HFEGPZSQGVABSR-UWJYYQICSA-N	0	3	349.478	3.344	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(OC)c(Cl)c3)C[C@@H]21	ZINC001042349748	1346050201	/nfs/dbraw/zinc/05/02/01/1346050201.db2.gz	TUMRWPFYKGDVTA-CJNGLKHVSA-N	0	3	334.847	3.071	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc(F)c4occc43)C[C@H]21	ZINC001042362716	1346056316	/nfs/dbraw/zinc/05/63/16/1346056316.db2.gz	MCIBLNSYJZINBN-RDTXWAMCSA-N	0	3	340.398	3.132	20	30		EGEDHN
C[C@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)CC(C)(C)C	ZINC001044469613	1346341825	/nfs/dbraw/zinc/34/18/25/1346341825.db2.gz	YDKRQYOBCLRJDO-YJBOKZPZSA-N	0	3	327.472	3.464	20	30		EGEDHN
C/C(=C/C(=O)N1CC[C@H](NCc2ccccc2C#N)C[C@H]1C)C1CC1	ZINC001044491567	1346347204	/nfs/dbraw/zinc/34/72/04/1346347204.db2.gz	SSSFOKOQQPQJBS-OUAFYBQWSA-N	0	3	337.467	3.384	20	30		EGEDHN
C[C@H]1C[C@H](NCc2cc(F)ccc2C#N)CCN1C(=O)CCC1CC1	ZINC001044511159	1346353103	/nfs/dbraw/zinc/35/31/03/1346353103.db2.gz	UZKSBBDOFKTRFJ-IFXJQAMLSA-N	0	3	343.446	3.357	20	30		EGEDHN
C[C@H]1C[C@@H](NCc2cc(F)ccc2C#N)CCN1C(=O)CC1(C)CC1	ZINC001044689429	1346403857	/nfs/dbraw/zinc/40/38/57/1346403857.db2.gz	OVJIZFOYVIGQDH-KSSFIOAISA-N	0	3	343.446	3.357	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3nccnc3C)C[C@@H]2C)CC1	ZINC001044730254	1346414492	/nfs/dbraw/zinc/41/44/92/1346414492.db2.gz	OJPGIBSNVBRNDY-YJBOKZPZSA-N	0	3	342.487	3.001	20	30		EGEDHN
CCC(C)(C)C(=O)N1CCC[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC001045178149	1346516302	/nfs/dbraw/zinc/51/63/02/1346516302.db2.gz	AQXLKMHAZKRROU-INIZCTEOSA-N	0	3	331.435	3.214	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H]1CNCc1ccc(C#N)s1)c1ccco1	ZINC001045198246	1346528489	/nfs/dbraw/zinc/52/84/89/1346528489.db2.gz	KJVFGUUXUXVUTQ-KBPBESRZSA-N	0	3	343.452	3.097	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CCC[C@H]1CNCc1ccc(C#N)cc1F	ZINC001045224508	1346534580	/nfs/dbraw/zinc/53/45/80/1346534580.db2.gz	LNVFGHQZQPUARR-PBHICJAKSA-N	0	3	331.435	3.070	20	30		EGEDHN
C[C@H](CC(=O)N1CCC[C@H]1CNCc1ccc(C#N)cc1F)C1CC1	ZINC001045326285	1346561807	/nfs/dbraw/zinc/56/18/07/1346561807.db2.gz	RDNXIMOBXCCSIT-KDOFPFPSSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@@H](CC(=O)N1CCC[C@H]1CNCc1ccc(C#N)c(F)c1)C1CC1	ZINC001045326653	1346562562	/nfs/dbraw/zinc/56/25/62/1346562562.db2.gz	XGHFVHGXOHGHPK-KSSFIOAISA-N	0	3	343.446	3.214	20	30		EGEDHN
CC1(NC(=O)[C@H]2C[C@H]3C[C@H]3C2)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045530840	1346619310	/nfs/dbraw/zinc/61/93/10/1346619310.db2.gz	NWYHFAMAUHEAPK-BWTSREIZSA-N	0	3	337.467	3.075	20	30		EGEDHN
CC(C)[C@@H]1C[C@H]1C(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1	ZINC001045604633	1346642622	/nfs/dbraw/zinc/64/26/22/1346642622.db2.gz	TTWGPSSXUPBJSU-RBUKOAKNSA-N	0	3	339.483	3.321	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC[C@H]2CC[C@@H](C1)N2CCc1ccccc1Cl	ZINC001045734341	1346682930	/nfs/dbraw/zinc/68/29/30/1346682930.db2.gz	CDTKZQKAOCQHQO-UAGQMJEPSA-N	0	3	345.874	3.107	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)Cc1cccs1)C2	ZINC001045907638	1346744333	/nfs/dbraw/zinc/74/43/33/1346744333.db2.gz	BDKIFPAOOZMXTG-IBGZPJMESA-N	0	3	330.497	3.019	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCCC[C@]2(CCN(Cc3ccc(F)cc3)C2)C1	ZINC001045925923	1346762012	/nfs/dbraw/zinc/76/20/12/1346762012.db2.gz	XNGKFDWXIWPJNO-OXQOHEQNSA-N	0	3	343.446	3.190	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@H]1CCC(C)=C(C)C1)C2	ZINC001045940190	1346776359	/nfs/dbraw/zinc/77/63/59/1346776359.db2.gz	RXODLZQPCJDDTC-PZJWPPBQSA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cccc(C(C)C)n1)C2	ZINC001045950610	1346785608	/nfs/dbraw/zinc/78/56/08/1346785608.db2.gz	HFTTXAHQXPVUIS-OAQYLSRUSA-N	0	3	339.483	3.156	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)C1(C(F)F)CCC1)C2	ZINC001045960044	1346794733	/nfs/dbraw/zinc/79/47/33/1346794733.db2.gz	DUBDESYXNJBHJB-SFHVURJKSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccn(C(C)C)c1C)C2	ZINC001045961743	1346796981	/nfs/dbraw/zinc/79/69/81/1346796981.db2.gz	SJDLKTOFLVOKKJ-NRFANRHFSA-N	0	3	341.499	3.329	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@H](C)c1cccs1)C2	ZINC001045966468	1346800921	/nfs/dbraw/zinc/80/09/21/1346800921.db2.gz	XHRGMECZUMINEQ-APWZRJJASA-N	0	3	330.497	3.189	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@H](F)c1ccccc1)C2	ZINC001045970215	1346805717	/nfs/dbraw/zinc/80/57/17/1346805717.db2.gz	CSNOOIANLKTDGS-CTNGQTDRSA-N	0	3	342.458	3.425	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc3sccc3[nH]1)C2	ZINC001045979078	1346815862	/nfs/dbraw/zinc/81/58/62/1346815862.db2.gz	OXLNEMOYYQLADT-IBGZPJMESA-N	0	3	341.480	3.181	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)Cc1cccc(F)c1)C2	ZINC001045981281	1346819829	/nfs/dbraw/zinc/81/98/29/1346819829.db2.gz	BBIAZMYXBSJTMN-NRFANRHFSA-N	0	3	342.458	3.096	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2ccn(C3CCCCC3)n2)C1	ZINC001046314177	1346931065	/nfs/dbraw/zinc/93/10/65/1346931065.db2.gz	FOBZWFJSWGKGNG-LJQANCHMSA-N	0	3	330.476	3.159	20	30		EGEDHN
C#CCCN1CC[C@@](C)(NC(=O)c2cc(C3CC3)oc2C2CC2)C1	ZINC001046495862	1346995043	/nfs/dbraw/zinc/99/50/43/1346995043.db2.gz	KBZWJOMSEQHYJL-HXUWFJFHSA-N	0	3	326.440	3.252	20	30		EGEDHN
C#CCCN1CC[C@](C)(NC(=O)c2cc(C3CC3)oc2C2CC2)C1	ZINC001046495861	1346995099	/nfs/dbraw/zinc/99/50/99/1346995099.db2.gz	KBZWJOMSEQHYJL-FQEVSTJZSA-N	0	3	326.440	3.252	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@]2(C)CCN(CCOc3ccccc3)C2)CC1	ZINC001046595815	1347032103	/nfs/dbraw/zinc/03/21/03/1347032103.db2.gz	AOPXGTQDCKFSRY-NRFANRHFSA-N	0	3	342.483	3.392	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@]2(C)CCN(Cc3cccc(CC)c3)C2)c1	ZINC001046607434	1347037822	/nfs/dbraw/zinc/03/78/22/1347037822.db2.gz	QVWIAIILDVDRIA-QFIPXVFZSA-N	0	3	347.462	3.020	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@]2(C)CCN(Cc3ccccc3)C2)cc1	ZINC001046680119	1347060614	/nfs/dbraw/zinc/06/06/14/1347060614.db2.gz	XQIGWYIBWRIRKM-JOCHJYFZSA-N	0	3	348.446	3.093	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2cnc3ccc(F)cc3c2)C1	ZINC001046758860	1347087383	/nfs/dbraw/zinc/08/73/83/1347087383.db2.gz	VDGXHZAIIUANKY-LJQANCHMSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2cccc(F)c2)C1	ZINC001046913229	1347151269	/nfs/dbraw/zinc/15/12/69/1347151269.db2.gz	UMKXIISNFFUVDA-CQSZACIVSA-N	0	3	326.362	3.089	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)/C=C/c3ccc[nH]3)C2)CC1	ZINC001047241444	1347267584	/nfs/dbraw/zinc/26/75/84/1347267584.db2.gz	PXWOSIDVHDAAKI-CSHXORCISA-N	0	3	339.483	3.002	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)[C@H]3CCC3(F)F)C2)CC1	ZINC001047242066	1347268426	/nfs/dbraw/zinc/26/84/26/1347268426.db2.gz	AYPCHPMTXCKQCZ-DLBZAZTESA-N	0	3	338.442	3.006	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)CC3CC(F)(F)C3)C2)CC1	ZINC001047245576	1347271085	/nfs/dbraw/zinc/27/10/85/1347271085.db2.gz	ZAHDGWXIHNJWIT-KRWDZBQOSA-N	0	3	338.442	3.006	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)C3CCC(F)CC3)C2)CC1	ZINC001047255101	1347279331	/nfs/dbraw/zinc/27/93/31/1347279331.db2.gz	UTICXTHMFFCNJJ-GPJFCIFZSA-N	0	3	348.506	3.489	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)[C@@H]3C[C@H]3C3CCC3)C2)CC1	ZINC001047256900	1347280182	/nfs/dbraw/zinc/28/01/82/1347280182.db2.gz	FFSJJWCUSXCWHL-QHAWAJNXSA-N	0	3	342.527	3.397	20	30		EGEDHN
C=C1CCC(C(=O)N(C)[C@H]2CN(CCCC3CCCC3)C[C@@H]2O)CC1	ZINC001047512077	1347308260	/nfs/dbraw/zinc/30/82/60/1347308260.db2.gz	GSEDLXJQTBPHOY-PMACEKPBSA-N	0	3	348.531	3.207	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@@H]([C@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001047733093	1347354718	/nfs/dbraw/zinc/35/47/18/1347354718.db2.gz	RCPYCIQAPLBZRF-WMLDXEAASA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)CC2CCC2)C1	ZINC001047772770	1347366536	/nfs/dbraw/zinc/36/65/36/1347366536.db2.gz	JDCXGFPJHMSKOM-BEFAXECRSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@H]([C@H](C)NCc2cnc(C)o2)C1	ZINC001047856060	1347390740	/nfs/dbraw/zinc/39/07/40/1347390740.db2.gz	QNYWNXZNGKCFLK-FZMZJTMJSA-N	0	3	339.867	3.088	20	30		EGEDHN
Cc1coc(C(=O)N2CC[C@H]([C@H](C)NCc3ccccc3C#N)C2)c1	ZINC001047938586	1347417840	/nfs/dbraw/zinc/41/78/40/1347417840.db2.gz	YAQRFLYPVWVJBG-YJBOKZPZSA-N	0	3	337.423	3.100	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)C2(C)CCC2)C1	ZINC001047939968	1347418192	/nfs/dbraw/zinc/41/81/92/1347418192.db2.gz	KGGWQPHQBOTXKT-QAPCUYQASA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@H]1CN(C(=O)CC(C)(C)C)C[C@H]1CNCc1cc(F)ccc1C#N	ZINC001048149938	1347481763	/nfs/dbraw/zinc/48/17/63/1347481763.db2.gz	YILWTSCYLWBBHV-WMLDXEAASA-N	0	3	345.462	3.318	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](C)[C@@H](CNCc3ccn(C(C)C)n3)C2)C1	ZINC001048373697	1347534210	/nfs/dbraw/zinc/53/42/10/1347534210.db2.gz	IWVMUCGBYPLKRZ-SJORKVTESA-N	0	3	344.503	3.004	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](C)[C@@H](CNCc3csc(CC)n3)C2)C1	ZINC001048373978	1347534756	/nfs/dbraw/zinc/53/47/56/1347534756.db2.gz	LXYWIKXAFNTIJK-CABCVRRESA-N	0	3	347.528	3.246	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H](C)[C@@H](CNCc3cscn3)C2)CC1	ZINC001048374999	1347535026	/nfs/dbraw/zinc/53/50/26/1347535026.db2.gz	SZBVEKHPKWOOFX-HOCLYGCPSA-N	0	3	333.501	3.074	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)C2CCCC2)CC1	ZINC001048625511	1347623866	/nfs/dbraw/zinc/62/38/66/1347623866.db2.gz	DZBTXROSYAAYKM-UHFFFAOYSA-N	0	3	327.472	3.251	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)[C@H]2C[C@H]3C[C@H]3C2)CC1	ZINC001048626687	1347624392	/nfs/dbraw/zinc/62/43/92/1347624392.db2.gz	UFSKXFKNBBXOFX-PIIMJCKOSA-N	0	3	339.483	3.107	20	30		EGEDHN
C=C(C)CN1CCC(N(Cc2ccccn2)C(=O)[C@H]2CC2(C)C)CC1	ZINC001048627160	1347624524	/nfs/dbraw/zinc/62/45/24/1347624524.db2.gz	GFFVKXOPGWRGOW-LJQANCHMSA-N	0	3	341.499	3.497	20	30		EGEDHN
C[C@H](c1ccc(Cl)cc1)N1C[C@@H]2CN(C(=O)C#CC3CC3)C[C@@H]2C1	ZINC001048812180	1347663226	/nfs/dbraw/zinc/66/32/26/1347663226.db2.gz	DNRXTFCUXLHXOZ-OLMNPRSZSA-N	0	3	342.870	3.205	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc(C4CC4)oc3C3CC3)C[C@@H]2C1	ZINC001048947855	1347690563	/nfs/dbraw/zinc/69/05/63/1347690563.db2.gz	NRLKCBHJLVDEFE-CALCHBBNSA-N	0	3	338.451	3.062	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H]3CN(Cc4cnc(C)s4)C[C@H]3C2)CC1	ZINC001049026697	1347709684	/nfs/dbraw/zinc/70/96/84/1347709684.db2.gz	XDXWPETVWPPQQC-CALCHBBNSA-N	0	3	345.512	3.088	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@H]2[C@H]1CCN2Cc1ccc(C(F)F)cc1	ZINC001049373201	1347809781	/nfs/dbraw/zinc/80/97/81/1347809781.db2.gz	QUVIZUPRKSRVDZ-XOKHGSTOSA-N	0	3	347.409	3.349	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049415506	1347838181	/nfs/dbraw/zinc/83/81/81/1347838181.db2.gz	LKAIZHOVZJRDIQ-QRVBRYPASA-N	0	3	337.467	3.170	20	30		EGEDHN
Cc1cc[nH]c1C(=O)N1CCC[C@H]2[C@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049460910	1347859431	/nfs/dbraw/zinc/85/94/31/1347859431.db2.gz	ZJGJQVIMRHIORJ-RBUKOAKNSA-N	0	3	348.450	3.074	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1coc2cc(F)ccc12	ZINC001049475156	1347866808	/nfs/dbraw/zinc/86/68/08/1347866808.db2.gz	NWQKGQZJAWMDMF-QZTJIDSGSA-N	0	3	342.414	3.366	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(C)c(OC)c(C)c1	ZINC001049493410	1347875313	/nfs/dbraw/zinc/87/53/13/1347875313.db2.gz	YYEWJJIWENKIBM-RBUKOAKNSA-N	0	3	340.467	3.014	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccnn1C(CC)CC	ZINC001049519396	1347889337	/nfs/dbraw/zinc/88/93/37/1347889337.db2.gz	YPLXZIZGYQIYGF-IAGOWNOFSA-N	0	3	330.476	3.109	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1nccc2ccsc21	ZINC001049535821	1347896771	/nfs/dbraw/zinc/89/67/71/1347896771.db2.gz	KDEOTMRNGORJGF-HUUCEWRRSA-N	0	3	327.453	3.161	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cccc2c(C)c(C)[nH]c21	ZINC001049551784	1347904014	/nfs/dbraw/zinc/90/40/14/1347904014.db2.gz	IUQQDKBKITYIGX-VQTJNVASSA-N	0	3	349.478	3.487	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(C)c2ccccc2n1	ZINC001049552326	1347904729	/nfs/dbraw/zinc/90/47/29/1347904729.db2.gz	NADSBXJICTZRPM-UXHICEINSA-N	0	3	335.451	3.408	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(C)c2ccccc2n1	ZINC001049552329	1347904941	/nfs/dbraw/zinc/90/49/41/1347904941.db2.gz	NADSBXJICTZRPM-WOJBJXKFSA-N	0	3	335.451	3.408	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(-c2cnco2)cc1	ZINC001049554370	1347906303	/nfs/dbraw/zinc/90/63/03/1347906303.db2.gz	CHQBHECJXYRXGS-QZTJIDSGSA-N	0	3	337.423	3.207	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cccc(-n2cccc2)c1	ZINC001049577318	1347918523	/nfs/dbraw/zinc/91/85/23/1347918523.db2.gz	PBNUYMQSBUWOGD-VQTJNVASSA-N	0	3	335.451	3.342	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1cccc(C(F)F)c1	ZINC001049590618	1347925812	/nfs/dbraw/zinc/92/58/12/1347925812.db2.gz	BARGCDVATZDEGZ-ROUUACIJSA-N	0	3	346.421	3.255	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)CCc1ccc(C)c(Cl)c1	ZINC001049627884	1347941861	/nfs/dbraw/zinc/94/18/61/1347941861.db2.gz	VFOLBGBQUQRXHK-OALUTQOASA-N	0	3	344.886	3.280	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1cccc(OC)c1	ZINC001049646603	1347953235	/nfs/dbraw/zinc/95/32/35/1347953235.db2.gz	QGOZMQSBRGOTBF-MOPGFXCFSA-N	0	3	342.483	3.473	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(Cl)cc1OC	ZINC001049671493	1347965973	/nfs/dbraw/zinc/96/59/73/1347965973.db2.gz	LNMTZLZFNNGIQV-JKSUJKDBSA-N	0	3	334.847	3.214	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(F)c(F)c1F	ZINC001049676793	1347967994	/nfs/dbraw/zinc/96/79/94/1347967994.db2.gz	QPONQJKBPBJEMN-CABCVRRESA-N	0	3	338.373	3.359	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](C)Cc1ccccc1F	ZINC001049713504	1347987684	/nfs/dbraw/zinc/98/76/84/1347987684.db2.gz	DPDBRZQPRQMQOT-ZYSHUDEJSA-N	0	3	330.447	3.256	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049734560	1347994067	/nfs/dbraw/zinc/99/40/67/1347994067.db2.gz	FHZSSVGKNKOMNL-WTGUMLROSA-N	0	3	337.467	3.170	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1oc(C(C)C)nc1C	ZINC001049774552	1348015311	/nfs/dbraw/zinc/01/53/11/1348015311.db2.gz	XIPJNXMWIFRLSM-CVEARBPZSA-N	0	3	331.460	3.361	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC001049778630	1348016926	/nfs/dbraw/zinc/01/69/26/1348016926.db2.gz	XJRMHOKMEALBCA-MTQWCTHYSA-N	0	3	340.467	3.050	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1csc(-c2ccoc2)n1	ZINC001049792705	1348024162	/nfs/dbraw/zinc/02/41/62/1348024162.db2.gz	JNDABXIVFMOTHZ-HZPDHXFCSA-N	0	3	343.452	3.268	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ncoc1-c1cccs1	ZINC001049793502	1348024371	/nfs/dbraw/zinc/02/43/71/1348024371.db2.gz	OMCDHNBHNBLKGP-UONOGXRCSA-N	0	3	343.452	3.268	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cnoc1-c1ccccc1	ZINC001049822763	1348039683	/nfs/dbraw/zinc/03/96/83/1348039683.db2.gz	NVKJZXORVBWJCJ-QZTJIDSGSA-N	0	3	337.423	3.207	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc2nc(C)sc2c1	ZINC001049823302	1348039696	/nfs/dbraw/zinc/03/96/96/1348039696.db2.gz	AFPMOPPGQCVEEX-DLBZAZTESA-N	0	3	341.480	3.470	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cnoc1-c1ccccc1	ZINC001049822770	1348040098	/nfs/dbraw/zinc/04/00/98/1348040098.db2.gz	NVKJZXORVBWJCJ-ZWKOTPCHSA-N	0	3	337.423	3.207	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ncoc1C(C)(C)C	ZINC001049835252	1348048697	/nfs/dbraw/zinc/04/86/97/1348048697.db2.gz	PJPPFUORGSAUKE-LSDHHAIUSA-N	0	3	331.460	3.227	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@]1(c2ccccc2)C[C@H](F)C1	ZINC001049874935	1348079581	/nfs/dbraw/zinc/07/95/81/1348079581.db2.gz	IGOZCJLYBZILQP-HUUJSLGLSA-N	0	3	342.458	3.308	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)CCn1ccc2ccccc21	ZINC001049880668	1348086520	/nfs/dbraw/zinc/08/65/20/1348086520.db2.gz	DCZIAYPZRTVASH-RTWAWAEBSA-N	0	3	349.478	3.120	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(C)c(CC)s1	ZINC001049881906	1348087580	/nfs/dbraw/zinc/08/75/80/1348087580.db2.gz	SVVSXYHYWPJFDX-JKSUJKDBSA-N	0	3	330.497	3.321	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1ccc2ccccc2c1	ZINC001049884179	1348089416	/nfs/dbraw/zinc/08/94/16/1348089416.db2.gz	AGBLMSHKJJKJOK-RTWAWAEBSA-N	0	3	332.447	3.081	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(C2CCCC2)no1	ZINC001049901639	1348101825	/nfs/dbraw/zinc/10/18/25/1348101825.db2.gz	ZYCGXVUMNFJXKA-MSOLQXFVSA-N	0	3	341.455	3.034	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(F)c2occc21	ZINC001049907889	1348105687	/nfs/dbraw/zinc/10/56/87/1348105687.db2.gz	LBWMHUIHRNIZAU-DLBZAZTESA-N	0	3	328.387	3.437	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)CC[C@@H]1CCc2ccccc21	ZINC001049910858	1348106973	/nfs/dbraw/zinc/10/69/73/1348106973.db2.gz	WJTBKTPZHWWCJN-SESVDKBCSA-N	0	3	336.479	3.195	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](C)Cc1ccccc1C	ZINC001049916577	1348110586	/nfs/dbraw/zinc/11/05/86/1348110586.db2.gz	IFERVRGBVKRVEF-SESVDKBCSA-N	0	3	338.495	3.262	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1[nH]c2ccccc2c1OC	ZINC001049919916	1348112560	/nfs/dbraw/zinc/11/25/60/1348112560.db2.gz	YPSZPXVVUGNPPZ-DLBZAZTESA-N	0	3	339.439	3.041	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1csc(CC(C)C)n1	ZINC001049927491	1348118199	/nfs/dbraw/zinc/11/81/99/1348118199.db2.gz	LCQROPINIXCZTQ-HZPDHXFCSA-N	0	3	333.501	3.207	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cccc(OCCC)c3)[C@@H]2C1	ZINC001050060455	1348169541	/nfs/dbraw/zinc/16/95/41/1348169541.db2.gz	XRSHJJKCWLNFBQ-PKOBYXMFSA-N	0	3	328.456	3.198	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)Cc3cccc(C4CC4)c3)[C@@H]2C1	ZINC001050101973	1348184327	/nfs/dbraw/zinc/18/43/27/1348184327.db2.gz	DZJPNVCZPWEYOU-LEWJYISDSA-N	0	3	336.479	3.053	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3CCCN(C(=O)C4CC5(CC5)C4)[C@@H]3C2)cc1	ZINC001050138081	1348193891	/nfs/dbraw/zinc/19/38/91/1348193891.db2.gz	OWFUGNUDPKJAMP-AZUAARDMSA-N	0	3	349.478	3.171	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3ccc(OCC)c(C)c3)[C@@H]2C1	ZINC001050154441	1348199151	/nfs/dbraw/zinc/19/91/51/1348199151.db2.gz	QFHDPUIHXQXOPD-ZWKOTPCHSA-N	0	3	328.456	3.116	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)[C@@H]3C[C@H]3c3cccc(C)c3)[C@@H]2C1	ZINC001050163431	1348200980	/nfs/dbraw/zinc/20/09/80/1348200980.db2.gz	LFHNYWDUYDUFCP-UWHLTILDSA-N	0	3	336.479	3.045	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)CC3(c4ccccc4)CC3)C2)CC1	ZINC001050540728	1348286617	/nfs/dbraw/zinc/28/66/17/1348286617.db2.gz	SHJVSQVXHAYSFT-UHFFFAOYSA-N	0	3	336.479	3.056	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3oc4c(cccc4F)c3C)C2)CC1	ZINC001050544242	1348287067	/nfs/dbraw/zinc/28/70/67/1348287067.db2.gz	PFXOZYVKPIZNRF-UHFFFAOYSA-N	0	3	340.398	3.052	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC2(C1)CCN(Cc1ccccn1)CC2	ZINC001050614394	1348303020	/nfs/dbraw/zinc/30/30/20/1348303020.db2.gz	YUBJUBVTAYCTRE-UHFFFAOYSA-N	0	3	327.472	3.108	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@H](CC)Cc3cccc(C)c3)C2)CC1	ZINC001050691490	1348328632	/nfs/dbraw/zinc/32/86/32/1348328632.db2.gz	XOMVPWKKMPYVKH-HXUWFJFHSA-N	0	3	338.495	3.121	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@@H]3C[C@H]3c3cccc(Cl)c3)C2)CC1	ZINC001050694245	1348329518	/nfs/dbraw/zinc/32/95/18/1348329518.db2.gz	QFTNPGCSLYKZIE-ZWKOTPCHSA-N	0	3	342.870	3.001	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@]3(C)C[C@@H]3c3ccccc3)C2)CC1	ZINC001050695195	1348329797	/nfs/dbraw/zinc/32/97/97/1348329797.db2.gz	ZXULNJGOYGRHJW-CTNGQTDRSA-N	0	3	336.479	3.128	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3c(CC)oc4ccccc43)C2)CC1	ZINC001050764814	1348352205	/nfs/dbraw/zinc/35/22/05/1348352205.db2.gz	HXAKDGGSTREPSN-UHFFFAOYSA-N	0	3	336.435	3.166	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)[C@H]3OCC[C@H]3CC)cccc2C1	ZINC001051290381	1348420530	/nfs/dbraw/zinc/42/05/30/1348420530.db2.gz	LSBYLQYHVQAQDG-UZLBHIALSA-N	0	3	342.483	3.052	20	30		EGEDHN
C=C(C)CCN1CCN([C@@H]2CCN(C(=O)CC3CCCCC3)C2)CC1	ZINC001051978229	1348493831	/nfs/dbraw/zinc/49/38/31/1348493831.db2.gz	OHHGBUOSFZNZCY-HXUWFJFHSA-N	0	3	347.547	3.142	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H](NC(=O)[C@]34C[C@H]3CCC4)CC2)cc1	ZINC001052577129	1348584457	/nfs/dbraw/zinc/58/44/57/1348584457.db2.gz	YMCFEDLCYBGHNI-SVFBPWRDSA-N	0	3	337.467	3.219	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cc(F)c(Cl)cc2F)CC1	ZINC001052669677	1348622438	/nfs/dbraw/zinc/62/24/38/1348622438.db2.gz	ZKTTXBJYNZRFFB-LBPRGKRZSA-N	0	3	340.801	3.226	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(C)s2)CC1	ZINC001052779538	1348675926	/nfs/dbraw/zinc/67/59/26/1348675926.db2.gz	HTNDFBINMGDGJF-GVDBMIGSSA-N	0	3	330.497	3.154	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2coc3ccc(F)cc23)CC1	ZINC001052896490	1348732710	/nfs/dbraw/zinc/73/27/10/1348732710.db2.gz	CGAYVNUFNRYNTF-OAHLLOKOSA-N	0	3	328.387	3.180	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cscc2C(F)(F)F)CC1	ZINC001052982191	1348786781	/nfs/dbraw/zinc/78/67/81/1348786781.db2.gz	UYQVSKOSXRRGKT-GFCCVEGCSA-N	0	3	344.402	3.375	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)Cc2c(C)oc3ccccc32)CC1	ZINC001052983073	1348787724	/nfs/dbraw/zinc/78/77/24/1348787724.db2.gz	BEOQNMWTGVNYHU-QGZVFWFLSA-N	0	3	338.451	3.278	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)/C=C\c2ccco2)C1	ZINC001053061067	1348870669	/nfs/dbraw/zinc/87/06/69/1348870669.db2.gz	MJMJXBLZSHUFNR-GHCKNRNOSA-N	0	3	340.467	3.409	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(Cl)o2)C1	ZINC001053067933	1348880718	/nfs/dbraw/zinc/88/07/18/1348880718.db2.gz	TWDIHXUDEQXRFO-HUUCEWRRSA-N	0	3	334.847	3.273	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(C)o2)C1	ZINC001053068771	1348882494	/nfs/dbraw/zinc/88/24/94/1348882494.db2.gz	WABDJFXMUIQFCJ-ROUUACIJSA-N	0	3	328.456	3.318	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)/C=C\c2ccc[nH]2)C1	ZINC001053080105	1348901358	/nfs/dbraw/zinc/90/13/58/1348901358.db2.gz	AKLVUHXTWKQIML-IACUCBDGSA-N	0	3	339.483	3.144	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cc(C)cc(C)n2)C1	ZINC001053087681	1348911936	/nfs/dbraw/zinc/91/19/36/1348911936.db2.gz	MYRIANTYFNOSRM-ICSRJNTNSA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccc(C)c(F)c2)C1	ZINC001053089516	1348915360	/nfs/dbraw/zinc/91/53/60/1348915360.db2.gz	BKCNFJVLOPPXGL-AZUAARDMSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(Cl)[nH]2)C1	ZINC001053093829	1348922432	/nfs/dbraw/zinc/92/24/32/1348922432.db2.gz	AFRRYKKWZSSJBW-GDBMZVCRSA-N	0	3	333.863	3.008	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cccc(F)c2F)C1	ZINC001053093891	1348922662	/nfs/dbraw/zinc/92/26/62/1348922662.db2.gz	ATJWWHZXMWKDCR-CRAIPNDOSA-N	0	3	346.421	3.305	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cc3ccccn3c2)C1	ZINC001053100006	1348932528	/nfs/dbraw/zinc/93/25/28/1348932528.db2.gz	CJWUZGGRAHCQCV-GHTZIAJQSA-N	0	3	349.478	3.279	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2c(C)nsc2C)C1	ZINC001053104736	1348940311	/nfs/dbraw/zinc/94/03/11/1348940311.db2.gz	IUUZCRKPLHUQIM-IAGOWNOFSA-N	0	3	345.512	3.100	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)CCc2cccs2)C1	ZINC001053107587	1348946652	/nfs/dbraw/zinc/94/66/52/1348946652.db2.gz	JWBJYSDUMQQYKN-PKOBYXMFSA-N	0	3	344.524	3.407	20	30		EGEDHN
C=C(C)CCN1Cc2ccccc2C[C@@H]1CNC(=O)[C@@H]1CC1(F)F	ZINC001054039752	1349135887	/nfs/dbraw/zinc/13/58/87/1349135887.db2.gz	IJDGLWDPGPTBOS-SJORKVTESA-N	0	3	334.410	3.151	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1coc3cc(F)ccc13)C2	ZINC001054158914	1349161424	/nfs/dbraw/zinc/16/14/24/1349161424.db2.gz	RBYWKOCZFZMVHI-HXUWFJFHSA-N	0	3	340.398	3.133	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)CCc1ccc(F)cc1)C2	ZINC001054160759	1349162519	/nfs/dbraw/zinc/16/25/19/1349162519.db2.gz	NFQFIQNDIJIYCU-OAQYLSRUSA-N	0	3	342.458	3.096	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1c[nH]c3ccccc13)C2	ZINC001054161093	1349163671	/nfs/dbraw/zinc/16/36/71/1349163671.db2.gz	XDWPTFMDAVGJBI-OAQYLSRUSA-N	0	3	335.451	3.119	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1c(F)cc(C)cc1F)C2	ZINC001054162550	1349165248	/nfs/dbraw/zinc/16/52/48/1349165248.db2.gz	KXJKVKJDVHARCM-FQEVSTJZSA-N	0	3	346.421	3.225	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1c(F)cc(C)cc1F)C2	ZINC001054162551	1349165399	/nfs/dbraw/zinc/16/53/99/1349165399.db2.gz	KXJKVKJDVHARCM-HXUWFJFHSA-N	0	3	346.421	3.225	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)CCc1cccc(C)c1)C2	ZINC001054172057	1349172940	/nfs/dbraw/zinc/17/29/40/1349172940.db2.gz	FSNIVGKBDGMXRN-JOCHJYFZSA-N	0	3	338.495	3.265	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@]2(CCN(Cc3cncc(C)c3)C2)C1	ZINC001054177811	1349179569	/nfs/dbraw/zinc/17/95/69/1349179569.db2.gz	RRKWYZUEJHSHQX-NRFANRHFSA-N	0	3	341.499	3.417	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)N1CCC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001054176987	1349179939	/nfs/dbraw/zinc/17/99/39/1349179939.db2.gz	UGHLUIPUDRYTKS-BSIFCXSSSA-N	0	3	337.467	3.029	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(F)c(C)c1)C2	ZINC001054186983	1349189828	/nfs/dbraw/zinc/18/98/28/1349189828.db2.gz	JAWQIOIOULWSPN-FQEVSTJZSA-N	0	3	328.431	3.086	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc3occc3s1)C2	ZINC001054196469	1349198824	/nfs/dbraw/zinc/19/88/24/1349198824.db2.gz	HVEOKCMQBLUUHX-LJQANCHMSA-N	0	3	342.464	3.446	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc3ccncc3c1)C2	ZINC001054223008	1349218393	/nfs/dbraw/zinc/21/83/93/1349218393.db2.gz	MPPZWPHMITWIKV-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)CCc1ccc(CC)cc1)C2	ZINC001054238551	1349232566	/nfs/dbraw/zinc/23/25/66/1349232566.db2.gz	XLUVKKIGLVEVSA-QFIPXVFZSA-N	0	3	338.495	3.129	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)CCc1ccccc1F)C2	ZINC001054238608	1349232596	/nfs/dbraw/zinc/23/25/96/1349232596.db2.gz	ZFWIGSNCRJDRIR-NRFANRHFSA-N	0	3	342.458	3.096	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H](C)c1ccc(F)cc1F)C2	ZINC001054241973	1349235006	/nfs/dbraw/zinc/23/50/06/1349235006.db2.gz	CDTHRVRMKOELOH-YWZLYKJASA-N	0	3	346.421	3.016	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@H](C)c1cccc(Cl)c1)C2	ZINC001054242614	1349235594	/nfs/dbraw/zinc/23/55/94/1349235594.db2.gz	PCUGNQLVLRRFEA-OXQOHEQNSA-N	0	3	344.886	3.391	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)NCc1ccc2c(c1)CN(CCC1CC1)C2	ZINC001054282037	1349283551	/nfs/dbraw/zinc/28/35/51/1349283551.db2.gz	NJXMGMALKFZXJD-UXHICEINSA-N	0	3	340.467	3.010	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3cnoc3CC)cc2C1	ZINC001054283480	1349284604	/nfs/dbraw/zinc/28/46/04/1349284604.db2.gz	DBAXQESVQWRVOE-UHFFFAOYSA-N	0	3	339.439	3.449	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3nocc3C)cc2C1	ZINC001054288767	1349292328	/nfs/dbraw/zinc/29/23/28/1349292328.db2.gz	IQMXNCRCOMEQJS-UHFFFAOYSA-N	0	3	325.412	3.195	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2CCCC2)C[C@H]1NCc1ccc(C#N)s1	ZINC001054346507	1349325925	/nfs/dbraw/zinc/32/59/25/1349325925.db2.gz	JNMLFDRHHWWWKJ-CXAGYDPISA-N	0	3	331.485	3.137	20	30		EGEDHN
C[C@H]1CN(C(=O)c2cccc(F)c2)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054349521	1349329643	/nfs/dbraw/zinc/32/96/43/1349329643.db2.gz	DJUMVBWJFKSGEA-SJCJKPOMSA-N	0	3	343.427	3.009	20	30		EGEDHN
CC(C(=O)N1C[C@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1)=C1CCC1	ZINC001054637493	1349424915	/nfs/dbraw/zinc/42/49/15/1349424915.db2.gz	MXISEBLDEDUMGL-ORAYPTAESA-N	0	3	341.430	3.134	20	30		EGEDHN
C[C@@H]1CN(C(=O)C(C)(C)C2CCC2)C[C@H]1NCc1ccc(C#N)s1	ZINC001054936538	1349519274	/nfs/dbraw/zinc/51/92/74/1349519274.db2.gz	MAGFCMJUOLYLBS-CXAGYDPISA-N	0	3	345.512	3.383	20	30		EGEDHN
C=C(CN1CCCC1)C(=O)N(C)[C@@H](CCC)C(=O)c1ccccc1	ZINC001183044555	1387255757	/nfs/dbraw/zinc/25/57/57/1387255757.db2.gz	KHAUPVBJWBBGQJ-SFHVURJKSA-N	0	3	328.456	3.148	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)[C@@H]2CCCC(C)(C)C2)C1	ZINC001070435351	1354348830	/nfs/dbraw/zinc/34/88/30/1354348830.db2.gz	DOHJGHCBQUPDHG-CVEARBPZSA-N	0	3	344.503	3.218	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)CC(C)(C)C1CC1)C[C@@H](C)O2	ZINC001071164051	1354483512	/nfs/dbraw/zinc/48/35/12/1354483512.db2.gz	GVYXQPQXTFAWEL-OXQOHEQNSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1ccc(CC)s1)C[C@H](C)O2	ZINC001071185165	1354491256	/nfs/dbraw/zinc/49/12/56/1354491256.db2.gz	BMKPDOGPUSXHET-HNAYVOBHSA-N	0	3	348.512	3.192	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C(C)(C)C1CCC1)C[C@@H](C)O2	ZINC001071195083	1354496310	/nfs/dbraw/zinc/49/63/10/1354496310.db2.gz	RTFVOPNBABMHGN-OXQOHEQNSA-N	0	3	334.504	3.081	20	30		EGEDHN
C#CCCN1CC[C@]2(C1)CN(C(=O)CC1CCCCCC1)C[C@@H](C)O2	ZINC001071215391	1354510212	/nfs/dbraw/zinc/51/02/12/1354510212.db2.gz	AZQJVPHOWUMSNF-NQIIRXRSSA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)CN(C(=O)CC1CCCCCC1)C[C@H](C)O2	ZINC001071215390	1354510230	/nfs/dbraw/zinc/51/02/30/1354510230.db2.gz	AZQJVPHOWUMSNF-GHTZIAJQSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1ccc(CC)cc1)C[C@H](C)O2	ZINC001071238885	1354521565	/nfs/dbraw/zinc/52/15/65/1354521565.db2.gz	SLZOWSLOGCLVGY-LAUBAEHRSA-N	0	3	342.483	3.131	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1cc(C)c(C)s1)C[C@H](C)O2	ZINC001071238435	1354521617	/nfs/dbraw/zinc/52/16/17/1354521617.db2.gz	MMSRVOOAZWCILF-KXBFYZLASA-N	0	3	348.512	3.246	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(F)cc2Cl)C1	ZINC001086265933	1359047424	/nfs/dbraw/zinc/04/74/24/1359047424.db2.gz	DVBOPWAGFNUYNS-KLPPZKSPSA-N	0	3	331.218	3.330	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C1(C)C(C)(C)C1(C)C)C[C@@H](C)O2	ZINC001071248793	1354527112	/nfs/dbraw/zinc/52/71/12/1354527112.db2.gz	SYBBDIZFTFYPML-IERDGZPVSA-N	0	3	348.531	3.327	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(F)c(C(F)F)c2)CC[C@@H]1C	ZINC001071515183	1354738122	/nfs/dbraw/zinc/73/81/22/1354738122.db2.gz	RYEDHJAOCBMHBP-GXTWGEPZSA-N	0	3	338.373	3.369	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc(C)c(OC)c(C)c2)CC[C@@H]1C	ZINC001071523004	1354744275	/nfs/dbraw/zinc/74/42/75/1354744275.db2.gz	VZHXVMBNABZXLR-FUHWJXTLSA-N	0	3	330.472	3.471	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2nsc3ccccc32)CC[C@@H]1C	ZINC001071525099	1354744876	/nfs/dbraw/zinc/74/48/76/1354744876.db2.gz	KBSICEALTDECKX-KBPBESRZSA-N	0	3	329.469	3.455	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cnn(C(C)(C)C)c2C)CC[C@@H]1C	ZINC001071544304	1354757592	/nfs/dbraw/zinc/75/75/92/1354757592.db2.gz	WTXPDCKEHAARCS-GOEBONIOSA-N	0	3	332.492	3.105	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2cc3ccncc3s2)CC[C@@H]1C	ZINC001071568546	1354769100	/nfs/dbraw/zinc/76/91/00/1354769100.db2.gz	OSQXCOYMZWCOCI-ZFWWWQNUSA-N	0	3	329.469	3.455	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cnn3c2ccc(C)c3C)CC[C@@H]1C	ZINC001071580279	1354777120	/nfs/dbraw/zinc/77/71/20/1354777120.db2.gz	RADKXAMPMDJQQC-DOTOQJQBSA-N	0	3	340.471	3.110	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc(F)cc3ccoc32)CC[C@H]1C	ZINC001071628682	1354812421	/nfs/dbraw/zinc/81/24/21/1354812421.db2.gz	SBKHWNVBNKNHNS-CZUORRHYSA-N	0	3	328.387	3.178	20	30		EGEDHN
C=C(C)CCN1C[C@H](NC(=O)c2nc3cnccc3s2)CC[C@H]1C	ZINC001071672258	1354841653	/nfs/dbraw/zinc/84/16/53/1354841653.db2.gz	ADZPOHNHSSFJJP-ZIAGYGMSSA-N	0	3	344.484	3.240	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)Cc2cc3ccccc3s2)CC[C@@H]1C	ZINC001071681153	1354848918	/nfs/dbraw/zinc/84/89/18/1354848918.db2.gz	ZAQRRQAHRMQHRI-RDJZCZTQSA-N	0	3	340.492	3.436	20	30		EGEDHN
C=C(C)CCN1C[C@H](NC(=O)c2nc3c(s2)CCC3)CC[C@@H]1C	ZINC001071683161	1354850387	/nfs/dbraw/zinc/85/03/87/1354850387.db2.gz	YDWVWAHXOCWKPX-UONOGXRCSA-N	0	3	333.501	3.181	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc(F)c(Cl)cc2F)CC[C@@H]1C	ZINC001071779845	1354928404	/nfs/dbraw/zinc/92/84/04/1354928404.db2.gz	PPFBXFVGHRLFTJ-RYUDHWBXSA-N	0	3	340.801	3.224	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cn(C)nc2C2CCCC2)CC[C@H]1C	ZINC001071817802	1354958743	/nfs/dbraw/zinc/95/87/43/1354958743.db2.gz	IHULGZYNJVXBHZ-WBVHZDCISA-N	0	3	344.503	3.237	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cn(CC)nc2C(C)C)CC[C@H]1C	ZINC001071854641	1354982486	/nfs/dbraw/zinc/98/24/86/1354982486.db2.gz	DASQZUBUXHAZKD-HZPDHXFCSA-N	0	3	332.492	3.185	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cnc(-c3ccccc3)[nH]2)CC[C@H]1C	ZINC001071857133	1354986020	/nfs/dbraw/zinc/98/60/20/1354986020.db2.gz	DQKKXRAIPYFWHG-NVXWUHKLSA-N	0	3	338.455	3.236	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)Cc2csc(C(C)(C)C)n2)CC[C@@H]1C	ZINC001071899665	1355013937	/nfs/dbraw/zinc/01/39/37/1355013937.db2.gz	BXMZBXLPPVYGGF-KBPBESRZSA-N	0	3	335.517	3.138	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cccc(N3CCCC3)c2)CC[C@H]1C	ZINC001071930513	1355030612	/nfs/dbraw/zinc/03/06/12/1355030612.db2.gz	GBSIFKZPAKTJFK-MJGOQNOKSA-N	0	3	341.499	3.446	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cnn(CC3CCCC3)c2)CC[C@H]1C	ZINC001071931691	1355032453	/nfs/dbraw/zinc/03/24/53/1355032453.db2.gz	YXYPCENWMOIFBD-APWZRJJASA-N	0	3	344.503	3.232	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2c(C)nn(C(C)C)c2C)CC[C@@H]1C	ZINC001071982718	1355058292	/nfs/dbraw/zinc/05/82/92/1355058292.db2.gz	PSEDUMOEAYDSMP-YJBOKZPZSA-N	0	3	346.519	3.169	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2)CC[C@@H]1C	ZINC001072015239	1355077579	/nfs/dbraw/zinc/07/75/79/1355077579.db2.gz	ADPWIWAJZUOTJT-BBRMVZONSA-N	0	3	338.373	3.311	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(OC(C)C)cc2)CC[C@@H]1C	ZINC001072049593	1355103403	/nfs/dbraw/zinc/10/34/03/1355103403.db2.gz	PUDMLFBXVWVYSR-WMZOPIPTSA-N	0	3	328.456	3.080	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc3c(cccc3OC)[nH]2)CC[C@@H]1C	ZINC001072070964	1355112444	/nfs/dbraw/zinc/11/24/44/1355112444.db2.gz	UGOQLBDYTZTTGN-GJZGRUSLSA-N	0	3	341.455	3.335	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc(-c3ccc(C)o3)n[nH]2)CC[C@H]1C	ZINC001072072300	1355113273	/nfs/dbraw/zinc/11/32/73/1355113273.db2.gz	IODAHXXDQBVEGX-HIFRSBDPSA-N	0	3	342.443	3.137	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2nsc3ccccc32)CC[C@H]1C	ZINC001072092261	1355124420	/nfs/dbraw/zinc/12/44/20/1355124420.db2.gz	OSZDOZBGELHMIC-HUUCEWRRSA-N	0	3	343.496	3.384	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C(C)(C)c2ccccc2C)CC[C@H]1C	ZINC001072113384	1355139007	/nfs/dbraw/zinc/13/90/07/1355139007.db2.gz	ULMQXFWWPGZERZ-QZTJIDSGSA-N	0	3	326.484	3.265	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(N(C)C(C)C)cc2)CC[C@H]1C	ZINC001072116228	1355140242	/nfs/dbraw/zinc/14/02/42/1355140242.db2.gz	JYJKYJSUAGDMHP-IEBWSBKVSA-N	0	3	341.499	3.137	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)Cc2c(C)oc3ccccc32)CC[C@@H]1C	ZINC001072128822	1355144321	/nfs/dbraw/zinc/14/43/21/1355144321.db2.gz	FZFYUCMTBOMTQZ-GOEBONIOSA-N	0	3	326.440	3.439	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](C)[C@H](CNCc2cnc(C)o2)C1	ZINC001072334509	1355243748	/nfs/dbraw/zinc/24/37/48/1355243748.db2.gz	CIPBDPRVJNDLMH-GDBMZVCRSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](C)[C@H](CNCc2cnc(C)o2)C1	ZINC001072334510	1355244098	/nfs/dbraw/zinc/24/40/98/1355244098.db2.gz	CIPBDPRVJNDLMH-GOEBONIOSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](C)[C@@H](CNCc2nccn2CC)C1	ZINC001072335494	1355244350	/nfs/dbraw/zinc/24/43/50/1355244350.db2.gz	NRTIFOIPIKBRQN-IRXDYDNUSA-N	0	3	346.519	3.080	20	30		EGEDHN
C[C@H]1CCN(C(=O)CC(C)(F)F)C[C@@H]1CNCc1ccccc1C#N	ZINC001072359816	1355255928	/nfs/dbraw/zinc/25/59/28/1355255928.db2.gz	HXEAPPXSHOIWSI-YOEHRIQHSA-N	0	3	349.425	3.178	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC2(C1)CCN([C@@H]1CCc3c1cccc3Cl)C2	ZINC001072552062	1355331132	/nfs/dbraw/zinc/33/11/32/1355331132.db2.gz	MNQFUSVVPJRNHT-CXAGYDPISA-N	0	3	343.858	3.021	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cccc4c3CCCCC4)C2)C1	ZINC001072836498	1355457859	/nfs/dbraw/zinc/45/78/59/1355457859.db2.gz	BEOPYHPQWQKHMO-UHFFFAOYSA-N	0	3	336.479	3.127	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CN(C(=O)[C@H]4CCCC45CC5)C3)C2)cc1	ZINC001072851522	1355465026	/nfs/dbraw/zinc/46/50/26/1355465026.db2.gz	ZCIVXZHMWYYAQM-LJQANCHMSA-N	0	3	349.478	3.173	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CN(C(=O)[C@@H]4CCC[C@@H]5C[C@@H]54)C3)C2)cc1	ZINC001072875049	1355477543	/nfs/dbraw/zinc/47/75/43/1355477543.db2.gz	KCWMUGRCXGLXJS-AQNXPRMDSA-N	0	3	349.478	3.029	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3ccc(CC(C)C)s3)[C@@H]2C1	ZINC001075892111	1356441615	/nfs/dbraw/zinc/44/16/15/1356441615.db2.gz	GTTAHVXUOLWKJB-DOTOQJQBSA-N	0	3	330.497	3.116	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)[C@@H]3CCc4c3cccc4Cl)[C@@H]2C1	ZINC001076053310	1356475737	/nfs/dbraw/zinc/47/57/37/1356475737.db2.gz	ZSTMWYMPMDNUCY-FDQGKXFDSA-N	0	3	330.859	3.089	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)CCc3ccc(C)c(Cl)c3)[C@@H]2C1	ZINC001076099414	1356488933	/nfs/dbraw/zinc/48/89/33/1356488933.db2.gz	ZWZHISUVYQDUNM-FUHWJXTLSA-N	0	3	332.875	3.300	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cccc4c3OCC4(C)C)[C@@H]2C1	ZINC001076645894	1356640850	/nfs/dbraw/zinc/64/08/50/1356640850.db2.gz	RXYVFEIFHHULKZ-MAUKXSAKSA-N	0	3	340.467	3.079	20	30		EGEDHN
C#CCN1C[C@@H]2CCC[C@]2(NC(=O)Cc2ccc(CCCC)cc2)C1	ZINC001098927684	1363524332	/nfs/dbraw/zinc/52/43/32/1363524332.db2.gz	UCTHBFLZUPYVCW-UNMCSNQZSA-N	0	3	338.495	3.176	20	30		EGEDHN
C=C(C)CCN1C[C@@H](O)[C@H](NC(=O)c2ccc(C3CCCC3)cc2)C1	ZINC001077399281	1356771983	/nfs/dbraw/zinc/77/19/83/1356771983.db2.gz	AMFSRNRYAJBQOJ-WOJBJXKFSA-N	0	3	342.483	3.085	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@H](C)c2cccs2)C[C@H]1C(F)(F)F	ZINC001099306120	1363741153	/nfs/dbraw/zinc/74/11/53/1363741153.db2.gz	OGDOGEWPFXMTMR-IJLUTSLNSA-N	0	3	332.391	3.017	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCCO[C@H](CNCc2cccc(F)c2)C1	ZINC001078460395	1356977520	/nfs/dbraw/zinc/97/75/20/1356977520.db2.gz	RUHVVVIPHFXOOO-UYAOXDASSA-N	0	3	348.462	3.135	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)Cc2c[nH]c3cccc(C)c23)C1	ZINC001080798211	1357739802	/nfs/dbraw/zinc/73/98/02/1357739802.db2.gz	XYYOLNQNTHXUKV-CRAIPNDOSA-N	0	3	325.456	3.031	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)CC2C3CC4CC(C3)CC2C4)C1	ZINC001080976967	1357772399	/nfs/dbraw/zinc/77/23/99/1357772399.db2.gz	PZGZVDLHOAPHKW-OBMPVAGPSA-N	0	3	330.516	3.461	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)Cc2c(C)oc3ccccc32)C1	ZINC001081065477	1357806689	/nfs/dbraw/zinc/80/66/89/1357806689.db2.gz	DBJCRVQNHKBXGL-RDTXWAMCSA-N	0	3	326.440	3.296	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2ccc(C(C)C)nc2)C[C@H]1c1ccccc1	ZINC001081125841	1357842441	/nfs/dbraw/zinc/84/24/41/1357842441.db2.gz	SIJMVCICHMQSPI-PZJWPPBQSA-N	0	3	347.462	3.036	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2ccc(CCCC)cc2)[C@H](OC)C1	ZINC001081918329	1357894465	/nfs/dbraw/zinc/89/44/65/1357894465.db2.gz	UUVIESUFSXBFGX-WOJBJXKFSA-N	0	3	344.499	3.424	20	30		EGEDHN
CC[C@@H](C)N[C@H](CNC(=O)c1ccc(C#N)cc1F)c1ccco1	ZINC001183433588	1387308099	/nfs/dbraw/zinc/30/80/99/1387308099.db2.gz	URHXQICRRXMNKB-MLGOLLRUSA-N	0	3	329.375	3.150	20	30		EGEDHN
CC[C@@H](C)N[C@@H](CNC(=O)c1ccc(C#N)cc1F)c1ccco1	ZINC001183433591	1387308175	/nfs/dbraw/zinc/30/81/75/1387308175.db2.gz	URHXQICRRXMNKB-WBMJQRKESA-N	0	3	329.375	3.150	20	30		EGEDHN
C[C@H](N[C@@H]1CN(C(=O)C#CC2CC2)C[C@H]1C)c1ccccc1Cl	ZINC001082502781	1358052084	/nfs/dbraw/zinc/05/20/84/1358052084.db2.gz	KELWQPCXXMINMU-QWQRMKEZSA-N	0	3	330.859	3.251	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H](C)[C@H](NCc2cc(F)ccc2OC)C1	ZINC001082722713	1358080935	/nfs/dbraw/zinc/08/09/35/1358080935.db2.gz	DNRLFZCUIMOJDW-ZTQAJYAQSA-N	0	3	348.462	3.373	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)CC3(C)CCCCC3)[C@H]2C1	ZINC001083138579	1358119464	/nfs/dbraw/zinc/11/94/64/1358119464.db2.gz	GKLAGYJPQNQKCV-ZWKOTPCHSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)C3[C@H]4CCCCCC[C@H]34)[C@H]2C1	ZINC001083203207	1358122844	/nfs/dbraw/zinc/12/28/44/1358122844.db2.gz	GZSPCQOYJCNMJR-CADBVGFASA-N	0	3	346.515	3.081	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)[C@@H](CC)CC3CCCCC3)[C@H]2C1	ZINC001083213241	1358123968	/nfs/dbraw/zinc/12/39/68/1358123968.db2.gz	SMJBXCHHGPHIRB-SLFFLAALSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)c3cc(C)c(OC)c(C)c3)[C@@H]2C1	ZINC001084363644	1358199639	/nfs/dbraw/zinc/19/96/39/1358199639.db2.gz	NIZPQMJZDOMVGF-SJLPKXTDSA-N	0	3	328.456	3.034	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)C3CC(C)(C)CC(C)(C)C3)[C@@H]2C1	ZINC001084547944	1358235072	/nfs/dbraw/zinc/23/50/72/1358235072.db2.gz	UNRZTPDMZMWXDT-SJLPKXTDSA-N	0	3	330.516	3.395	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)c3ccccc3O[C@H](C)CC)[C@@H]2C1	ZINC001084690929	1358282190	/nfs/dbraw/zinc/28/21/90/1358282190.db2.gz	XAWYNKSDGYSZHE-ZHALLVOQSA-N	0	3	340.467	3.034	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)CCc3cc(C)cc(C)c3)[C@@H]2C1	ZINC001084758817	1358302162	/nfs/dbraw/zinc/30/21/62/1358302162.db2.gz	COAJUYGEMGOKJE-WOJBJXKFSA-N	0	3	326.484	3.345	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)c3ccc(F)c4occc43)[C@@H]2C1	ZINC001084840966	1358325686	/nfs/dbraw/zinc/32/56/86/1358325686.db2.gz	AEAIBJKCDYVEMR-CXAGYDPISA-N	0	3	328.387	3.294	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)C3(C(F)(F)F)CCCCC3)[C@@H]2C1	ZINC001084867778	1358335727	/nfs/dbraw/zinc/33/57/27/1358335727.db2.gz	CFHSVUDJEMPEGR-HUUCEWRRSA-N	0	3	342.405	3.055	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)[C@@H](C)Cc3cccc(Cl)c3)[C@@H]2C1	ZINC001084871083	1358336414	/nfs/dbraw/zinc/33/64/14/1358336414.db2.gz	SHPMMSSXHGUXPS-KVSKMBFKSA-N	0	3	344.886	3.075	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@H](CC)OC3CCCCC3)C[C@@H]21	ZINC001084939952	1358352444	/nfs/dbraw/zinc/35/24/44/1358352444.db2.gz	UGFYFQMJHVWJEK-NZSAHSFTSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@H](C)c3ccc(CC)cc3)C[C@@H]21	ZINC001085057574	1358380841	/nfs/dbraw/zinc/38/08/41/1358380841.db2.gz	LLAWEEPVKFYKMK-AHRSYUTCSA-N	0	3	326.484	3.461	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@H](C)c3ccc(F)cc3F)C[C@@H]21	ZINC001085097626	1358389941	/nfs/dbraw/zinc/38/99/41/1358389941.db2.gz	QAQQRZZCAQHURO-LBTNJELSSA-N	0	3	334.410	3.177	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)C(C)(C)c1cccnc1	ZINC001085252769	1358445142	/nfs/dbraw/zinc/44/51/42/1358445142.db2.gz	GITYLDCFVOGWEA-HZPDHXFCSA-N	0	3	335.879	3.129	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)Cc1ccncc1Cl	ZINC001085333558	1358470328	/nfs/dbraw/zinc/47/03/28/1358470328.db2.gz	WPKIZPPJBDPEAR-HUUCEWRRSA-N	0	3	342.270	3.047	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cc(F)cc(F)c1	ZINC001085415479	1358494329	/nfs/dbraw/zinc/49/43/29/1358494329.db2.gz	YGHFFWJKRNYYCP-HUUCEWRRSA-N	0	3	328.790	3.348	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1c(C)nsc1C	ZINC001085434711	1358499093	/nfs/dbraw/zinc/49/90/93/1358499093.db2.gz	ZDAICHBVAOXINE-CHWSQXEVSA-N	0	3	327.881	3.143	20	30		EGEDHN
CN(C[C@@H]1CCN1CCCC1CCCC1)C(=O)c1cc(C#N)c[nH]1	ZINC001085534310	1358571326	/nfs/dbraw/zinc/57/13/26/1358571326.db2.gz	HQHJMNBIWITXHB-KRWDZBQOSA-N	0	3	328.460	3.003	20	30		EGEDHN
CC[C@@H](c1ccccc1)N1CC[C@H]1CN(C)C(=O)c1ccc(C#N)[nH]1	ZINC001085542544	1358582179	/nfs/dbraw/zinc/58/21/79/1358582179.db2.gz	ADSMXFAXYGIGOJ-HKUYNNGSSA-N	0	3	336.439	3.184	20	30		EGEDHN
CN(C[C@@H]1CCN1[C@@H]1CCCc2ccccc21)C(=O)c1ccc(C#N)[nH]1	ZINC001085553752	1358589603	/nfs/dbraw/zinc/58/96/03/1358589603.db2.gz	XISRQYSUAZYYFZ-FXAWDEMLSA-N	0	3	348.450	3.110	20	30		EGEDHN
Cc1ccccc1[C@H](C)N1CC[C@H]1CN(C)C(=O)c1ccc(C#N)[nH]1	ZINC001085553696	1358590164	/nfs/dbraw/zinc/59/01/64/1358590164.db2.gz	UNSCXYDTRRFSDJ-RDJZCZTQSA-N	0	3	336.439	3.102	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1conc1C1CCCC1	ZINC001085637660	1358651926	/nfs/dbraw/zinc/65/19/26/1358651926.db2.gz	WDUGASHYPYVCNB-MRXNPFEDSA-N	0	3	331.460	3.445	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc(-c2ccccc2)on1	ZINC001085710081	1358702988	/nfs/dbraw/zinc/70/29/88/1358702988.db2.gz	YLRZJIYMXTZRFP-KRWDZBQOSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ncsc1C(F)(F)F	ZINC001085718298	1358708544	/nfs/dbraw/zinc/70/85/44/1358708544.db2.gz	NKVSLDYMODYENJ-NSHDSACASA-N	0	3	347.406	3.274	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1cc(-c2ccccc2)ccn1	ZINC001085892290	1358851648	/nfs/dbraw/zinc/85/16/48/1358851648.db2.gz	VMPNUKAQVKMIIR-IBGZPJMESA-N	0	3	335.451	3.471	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cccc(F)c1OCC	ZINC001085896093	1358856942	/nfs/dbraw/zinc/85/69/42/1358856942.db2.gz	SKYOXTQOZWHQQT-OAHLLOKOSA-N	0	3	334.435	3.337	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@@H](CNC(=O)[C@@H]3CC=CCC3)C2)c1	ZINC001086027353	1358971656	/nfs/dbraw/zinc/97/16/56/1358971656.db2.gz	QGYBFQNUUKHJJV-NUJGCVRESA-N	0	3	341.430	3.038	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc(C)n([C@H](C)CC)n2)C1	ZINC001086132267	1359005302	/nfs/dbraw/zinc/00/53/02/1359005302.db2.gz	JZROEBALWZFHKP-YUELXQCFSA-N	0	3	338.883	3.013	20	30		EGEDHN
CC1(C)CC[C@@H]1C(=O)NC[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001086172129	1359014354	/nfs/dbraw/zinc/01/43/54/1359014354.db2.gz	METXIHRBGOQYLP-HYVNUMGLSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)[C@H]2CCC[C@H](C)C2)C1	ZINC001086182893	1359019203	/nfs/dbraw/zinc/01/92/03/1359019203.db2.gz	MSTFKFBRQCYLDE-CYUUQNCZSA-N	0	3	343.309	3.206	20	30		EGEDHN
Cc1cc(C)c(C(=O)NCC2(NCc3cccc(C#N)c3)CC2)s1	ZINC001323455470	1387372413	/nfs/dbraw/zinc/37/24/13/1387372413.db2.gz	DRUDZJWKCCXZOD-UHFFFAOYSA-N	0	3	339.464	3.289	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(OCC)c(C)c2)C1	ZINC001086214942	1359029215	/nfs/dbraw/zinc/02/92/15/1359029215.db2.gz	VKMDWHZYVOOTGN-FZNQNYSPSA-N	0	3	336.863	3.244	20	30		EGEDHN
C[C@@H]1CC[C@H](C(=O)NC[C@H]2C[C@@H](NCc3cc(C#N)ccc3F)C2)C1	ZINC001086216232	1359030079	/nfs/dbraw/zinc/03/00/79/1359030079.db2.gz	NAYYXABQHCGBCF-KBEGMRNHSA-N	0	3	343.446	3.118	20	30		EGEDHN
CC[C@@]1(C)C[C@H]1C(=O)NC[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001086240066	1359037223	/nfs/dbraw/zinc/03/72/23/1359037223.db2.gz	POTZGHVHJQJRBF-FORWCCJISA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc3ccccc3n2)C1	ZINC001086259974	1359045747	/nfs/dbraw/zinc/04/57/47/1359045747.db2.gz	BDABVOCKPIRDKM-OTVXOJSOSA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)C2CCC(C(F)F)CC2)C1	ZINC001086264048	1359046526	/nfs/dbraw/zinc/04/65/26/1359046526.db2.gz	RTAAWZIGEYNZAN-AJNFDDFZSA-N	0	3	334.838	3.295	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cccc([C@@H]3CCOC3)c2)C1	ZINC001086410700	1359090141	/nfs/dbraw/zinc/09/01/41/1359090141.db2.gz	GCHZQFPSSKMCHY-ZTFGCOKTSA-N	0	3	348.874	3.041	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(C)c(F)c2F)C1	ZINC001086486793	1359115445	/nfs/dbraw/zinc/11/54/45/1359115445.db2.gz	QIALWHVZERKILQ-HAQNSBGRSA-N	0	3	328.790	3.124	20	30		EGEDHN
C[C@@H]1CC[C@H](C(=O)NC[C@H]2C[C@H](NCc3ccc(C#N)cc3F)C2)C1	ZINC001086496109	1359119975	/nfs/dbraw/zinc/11/99/75/1359119975.db2.gz	NKJYMTZVCXFYRD-NYCLONFESA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(OC3CCC3)cc2)C1	ZINC001086556201	1359144118	/nfs/dbraw/zinc/14/41/18/1359144118.db2.gz	NGSGGRRHBMOJLK-KOMQPUFPSA-N	0	3	348.874	3.468	20	30		EGEDHN
C=CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2onc(C)c2C)C1	ZINC001086594054	1359158841	/nfs/dbraw/zinc/15/88/41/1359158841.db2.gz	CIYFBSNCPXNEEB-ZWKOTPCHSA-N	0	3	339.439	3.065	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2nc(C(C)C)oc2C)C1	ZINC001086695657	1359187565	/nfs/dbraw/zinc/18/75/65/1359187565.db2.gz	ZZPOHMYBVPXIQH-UONOGXRCSA-N	0	3	339.867	3.347	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cccnc2C(F)F)C1	ZINC001086753260	1359195607	/nfs/dbraw/zinc/19/56/07/1359195607.db2.gz	FQPGWWHXLJOCMW-NWDGAFQWSA-N	0	3	343.805	3.260	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccc3ncccc3c2)C1	ZINC001086793141	1359202707	/nfs/dbraw/zinc/20/27/07/1359202707.db2.gz	DJWCSBRZIBHIDZ-WMLDXEAASA-N	0	3	343.858	3.475	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cccc3ccncc32)C1	ZINC001086842683	1359212056	/nfs/dbraw/zinc/21/20/56/1359212056.db2.gz	PJKFWZKNVGMCQO-GOEBONIOSA-N	0	3	343.858	3.475	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cccc3oc(C)nc32)C1	ZINC001086885387	1359220747	/nfs/dbraw/zinc/22/07/47/1359220747.db2.gz	ZNSDLCYFXCZHLK-UONOGXRCSA-N	0	3	347.846	3.377	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc(Cl)c[nH]3)C2)CC1	ZINC001086901054	1359231293	/nfs/dbraw/zinc/23/12/93/1359231293.db2.gz	XUFNMHRNHUMOGO-CQSZACIVSA-N	0	3	333.863	3.008	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3sccc3F)C2)CC1	ZINC001086920514	1359247834	/nfs/dbraw/zinc/24/78/34/1359247834.db2.gz	RLGKMMYUNPXUTA-AWEZNQCLSA-N	0	3	334.460	3.227	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3cc[nH]c3CCC)C2)CC1	ZINC001086938418	1359261051	/nfs/dbraw/zinc/26/10/51/1359261051.db2.gz	PSUAEHUHAJTDON-KRWDZBQOSA-N	0	3	341.499	3.307	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cccc(Cl)c3F)C2)CC1	ZINC001086940745	1359262756	/nfs/dbraw/zinc/26/27/56/1359262756.db2.gz	YVPDEWGVWXKZCE-AWEZNQCLSA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@H]3CCCC(F)(F)C3)C2)CC1	ZINC001086941083	1359263068	/nfs/dbraw/zinc/26/30/68/1359263068.db2.gz	IPYZLPHMCROVES-CVEARBPZSA-N	0	3	338.442	3.148	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)[C@H](C)c3ccc(C)o3)C2)CC1	ZINC001086946884	1359268240	/nfs/dbraw/zinc/26/82/40/1359268240.db2.gz	KTJOHNFGLFFWCF-SJLPKXTDSA-N	0	3	342.483	3.418	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H](C)c3ccccc3F)C2)CC1	ZINC001086948717	1359269806	/nfs/dbraw/zinc/26/98/06/1359269806.db2.gz	GKUTVEJOSGFQKU-IRXDYDNUSA-N	0	3	342.458	3.265	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@H](C)c3ccc(C)s3)C2)CC1	ZINC001086953106	1359273268	/nfs/dbraw/zinc/27/32/68/1359273268.db2.gz	ZBTIYAMTRYCBPW-NVXWUHKLSA-N	0	3	344.524	3.496	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3ccccc3OC)C2)CC1	ZINC001086953958	1359274149	/nfs/dbraw/zinc/27/41/49/1359274149.db2.gz	YFTXXKDCAXWACC-KRWDZBQOSA-N	0	3	340.467	3.035	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H](C=C)c3ccccc3)C2)CC1	ZINC001086955964	1359276477	/nfs/dbraw/zinc/27/64/77/1359276477.db2.gz	AQWGHLHRRIHNTL-ICSRJNTNSA-N	0	3	336.479	3.292	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cc(Cl)cn3CC)C2)CC1	ZINC001086957575	1359278820	/nfs/dbraw/zinc/27/88/20/1359278820.db2.gz	QXJIXVHLDHEZIR-HNNXBMFYSA-N	0	3	347.890	3.111	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](CNCc2ccn(C(C)C)n2)[C@H](C)C1	ZINC001184079131	1387389425	/nfs/dbraw/zinc/38/94/25/1387389425.db2.gz	UHHXGLBDULEMRC-IAGOWNOFSA-N	0	3	332.492	3.004	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](CNCc2oc(CC)nc2C)[C@H](C)C1	ZINC001184079502	1387389915	/nfs/dbraw/zinc/38/99/15/1387389915.db2.gz	WQDAQCRCQWKRHJ-ZBFHGGJFSA-N	0	3	333.476	3.086	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)C(F)=C1CCCC1	ZINC001087281714	1359360571	/nfs/dbraw/zinc/36/05/71/1359360571.db2.gz	LFPJFKIEJWBXMS-BPQIPLTHSA-N	0	3	332.463	3.413	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(C)sc3C)C(C)(C)[C@@H]21	ZINC001087293892	1359373970	/nfs/dbraw/zinc/37/39/70/1359373970.db2.gz	LMKKTYHPGJIUGS-DJIMGWMZSA-N	0	3	330.497	3.217	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1occc1CC	ZINC001087303900	1359386473	/nfs/dbraw/zinc/38/64/73/1359386473.db2.gz	UTDNNUXOJCTPFQ-BPQIPLTHSA-N	0	3	328.456	3.084	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccsc3Cl)C(C)(C)[C@H]21	ZINC001087306788	1359393673	/nfs/dbraw/zinc/39/36/73/1359393673.db2.gz	OLWCUMKLYNUPOL-BNOWGMLFSA-N	0	3	336.888	3.254	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc2cccnc2c1	ZINC001087307928	1359394403	/nfs/dbraw/zinc/39/44/03/1359394403.db2.gz	JIGAKOXJTNWZFJ-YZGWKJHDSA-N	0	3	347.462	3.087	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3csc(C(C)C)n3)C(C)(C)[C@@H]21	ZINC001087307638	1359394976	/nfs/dbraw/zinc/39/49/76/1359394976.db2.gz	DEISHGRBLBCYNT-FVQBIDKESA-N	0	3	345.512	3.119	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(CC)c(CC)o3)C(C)(C)[C@H]21	ZINC001087314481	1359403319	/nfs/dbraw/zinc/40/33/19/1359403319.db2.gz	LPUZHJYYKWRCDS-LZQZEXGQSA-N	0	3	342.483	3.256	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccn3C(C)C)C(C)(C)[C@H]21	ZINC001087319661	1359412441	/nfs/dbraw/zinc/41/24/41/1359412441.db2.gz	ROGXCSPYUBLWRI-QRQLOZEOSA-N	0	3	341.499	3.311	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cccc(C2CC2)c1	ZINC001087319564	1359412570	/nfs/dbraw/zinc/41/25/70/1359412570.db2.gz	PSWIOQPISRJWOP-HSALFYBXSA-N	0	3	336.479	3.416	20	30		EGEDHN
CC(C)=CC(=O)N1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1CC#Cc1ccccc1	ZINC001087331849	1359421718	/nfs/dbraw/zinc/42/17/18/1359421718.db2.gz	CFROXNKEFXMGIA-KJJMTIBFSA-N	0	3	348.490	3.173	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)[C@@H](C)n2cccc2)C1	ZINC001087425716	1359461250	/nfs/dbraw/zinc/46/12/50/1359461250.db2.gz	OFJAMEZJYXAHLQ-HMXCVIKNSA-N	0	3	349.478	3.047	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CN(CC)CC[C@@H]2c2ccccc2)cc1	ZINC001087434317	1359463709	/nfs/dbraw/zinc/46/37/09/1359463709.db2.gz	GPKXRCGIQQYCAY-NHCUHLMSSA-N	0	3	332.447	3.276	20	30		EGEDHN
C=CCCN1CC[C@H](c2ccc(F)cc2)[C@H](NC(=O)[C@H]2C[C@@H]2C)C1	ZINC001087466744	1359479537	/nfs/dbraw/zinc/47/95/37/1359479537.db2.gz	ITMKJSFGCFCZFY-KLIQENQMSA-N	0	3	330.447	3.332	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2c(C)cccc2Cl)[C@H]1CC	ZINC001087641057	1359566842	/nfs/dbraw/zinc/56/68/42/1359566842.db2.gz	NMPLZDYSJSXKNK-ZWKOTPCHSA-N	0	3	332.875	3.183	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2cc3c(o2)c(F)ccc3C)[C@H]1CC	ZINC001087669766	1359580416	/nfs/dbraw/zinc/58/04/16/1359580416.db2.gz	PCTRYTBDGZWOHB-DLBZAZTESA-N	0	3	342.414	3.486	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)Cc2c[nH]c3ccc(F)cc23)[C@H]1CC	ZINC001087739781	1359620774	/nfs/dbraw/zinc/62/07/74/1359620774.db2.gz	AVMPORWFWZTZPZ-ZWKOTPCHSA-N	0	3	329.419	3.005	20	30		EGEDHN
CC(C)(C)CC(=O)N1C[C@H]2CCN(Cc3ccc(C#N)cc3)C[C@H]2C1	ZINC001087883845	1359695548	/nfs/dbraw/zinc/69/55/48/1359695548.db2.gz	LZYKYRPUBUUGMF-MOPGFXCFSA-N	0	3	339.483	3.275	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3cc4ccccc4s3)C[C@@H]2C1	ZINC001088030428	1359728697	/nfs/dbraw/zinc/72/86/97/1359728697.db2.gz	OYVBOZZFLBUKBO-SJORKVTESA-N	0	3	338.476	3.319	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3sc4ccccc4c3C)C[C@@H]2C1	ZINC001088032926	1359729866	/nfs/dbraw/zinc/72/98/66/1359729866.db2.gz	MNHYDDPWYSIMGC-CVEARBPZSA-N	0	3	338.476	3.237	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CCN(Cc3cncc(C)c3)C[C@H]2C1	ZINC001088064446	1359740086	/nfs/dbraw/zinc/74/00/86/1359740086.db2.gz	FVOILYGGSLRVQO-MOPGFXCFSA-N	0	3	341.499	3.273	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)C[C@H]3CCCC(C)(C)C3)C[C@@H]2C1	ZINC001088170323	1359779803	/nfs/dbraw/zinc/77/98/03/1359779803.db2.gz	NLYCDTCEYYLGPM-QRVBRYPASA-N	0	3	330.516	3.397	20	30		EGEDHN
C=CCN1CC[C@@H](OCC2CCN(C(=O)C(C)(CC)CC)CC2)C1	ZINC001088241129	1359812594	/nfs/dbraw/zinc/81/25/94/1359812594.db2.gz	QBYPAAPTLUEOQV-GOSISDBHSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2c(C)noc2CC)C1	ZINC001088423502	1359892536	/nfs/dbraw/zinc/89/25/36/1359892536.db2.gz	UPZIXBIBGNBHAA-CQSZACIVSA-N	0	3	339.867	3.272	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2cnc(CC)s2)C1	ZINC001088433050	1359901479	/nfs/dbraw/zinc/90/14/79/1359901479.db2.gz	KWKNVHTXRBBRME-ZDUSSCGKSA-N	0	3	341.908	3.432	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(CCOc3ccccc3)[C@@H]2C)C1	ZINC001088844107	1360078125	/nfs/dbraw/zinc/07/81/25/1360078125.db2.gz	CGXDUPHMVYQHNZ-AEFFLSMTSA-N	0	3	328.456	3.001	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2ccccc2O[C@H](C)CC)[C@H]1C	ZINC001088889860	1360093949	/nfs/dbraw/zinc/09/39/49/1360093949.db2.gz	OZXSBBFUYMPASS-NUJGCVRESA-N	0	3	328.456	3.080	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2cc3cccc(Cl)c3o2)[C@H]1C	ZINC001089088932	1360163430	/nfs/dbraw/zinc/16/34/30/1360163430.db2.gz	HARXWVFAVHBSSL-DOMZBBRYSA-N	0	3	330.815	3.302	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCCC[C@H]1CN(C)Cc1ccc(C#N)cc1	ZINC001089124148	1360187024	/nfs/dbraw/zinc/18/70/24/1360187024.db2.gz	SNJNFZIKKDIIDR-APWZRJJASA-N	0	3	327.472	3.417	20	30		EGEDHN
Cc1cc(F)ccc1CN(C)C[C@@H]1CCCCN1C(=O)[C@@H](C)C#N	ZINC001089139780	1360197279	/nfs/dbraw/zinc/19/72/79/1360197279.db2.gz	MZIQSAIEZRLALQ-YJBOKZPZSA-N	0	3	331.435	3.107	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCCN1C(=O)/C=C/C1CC1	ZINC001089146115	1360201943	/nfs/dbraw/zinc/20/19/43/1360201943.db2.gz	SVSXHXXEDRYLIR-SGWGQVFISA-N	0	3	337.467	3.337	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)N1CCCC[C@H]1CN(C)Cc1ccc(C#N)cc1	ZINC001089209928	1360255220	/nfs/dbraw/zinc/25/52/20/1360255220.db2.gz	QFFKJHNSRFUVPQ-AYOQOUSVSA-N	0	3	325.456	3.027	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@@H]2C[C@H]2c2sccc2C)CC(C)(C)C1	ZINC001089384052	1360385148	/nfs/dbraw/zinc/38/51/48/1360385148.db2.gz	NGESADGJAAUQLU-BRWVUGGUSA-N	0	3	344.524	3.400	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(Cl)c(F)c2)CC(C)(C)C1	ZINC001089500759	1360475133	/nfs/dbraw/zinc/47/51/33/1360475133.db2.gz	VUEYRCKVCKWAQY-CQSZACIVSA-N	0	3	336.838	3.333	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C2CCC(F)(F)CC2)CC(C)(C)C1	ZINC001089501724	1360475550	/nfs/dbraw/zinc/47/55/50/1360475550.db2.gz	GPBOBPLILCKSIT-OAHLLOKOSA-N	0	3	326.431	3.052	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccc(OC)c2F)CC(C)(C)C1	ZINC001089526717	1360490506	/nfs/dbraw/zinc/49/05/06/1360490506.db2.gz	FPTKEKKMRRVVSM-OAHLLOKOSA-N	0	3	346.446	3.078	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc3scnc3c2)CC(C)(C)C1	ZINC001089534360	1360494468	/nfs/dbraw/zinc/49/44/68/1360494468.db2.gz	QGWSNTPLGRSSRX-OAHLLOKOSA-N	0	3	341.480	3.150	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cccc(C(F)F)c2)CC(C)(C)C1	ZINC001089538305	1360496554	/nfs/dbraw/zinc/49/65/54/1360496554.db2.gz	AQHFVUYGAUXBAX-INIZCTEOSA-N	0	3	334.410	3.478	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@H](C)c2ccccc2C)CC(C)(C)C1	ZINC001089561706	1360509418	/nfs/dbraw/zinc/50/94/18/1360509418.db2.gz	SAAOPMNWGIJCMW-QZTJIDSGSA-N	0	3	326.484	3.339	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cnc(C(C)(C)C)s2)CC(C)(C)C1	ZINC001089567351	1360513544	/nfs/dbraw/zinc/51/35/44/1360513544.db2.gz	ZOUUHTOGZFGDNX-CQSZACIVSA-N	0	3	347.528	3.294	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccnn1[C@@H](C)CC	ZINC001089647092	1360560341	/nfs/dbraw/zinc/56/03/41/1360560341.db2.gz	SCSRYANLTDKBOM-DLBZAZTESA-N	0	3	344.503	3.098	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ncc(OC)cc1F	ZINC001089650034	1360563829	/nfs/dbraw/zinc/56/38/29/1360563829.db2.gz	SATHDFITTDFKDP-CQSZACIVSA-N	0	3	349.450	3.026	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc2c(o1)CCCC2	ZINC001089651383	1360564553	/nfs/dbraw/zinc/56/45/53/1360564553.db2.gz	BLTYSXZPXVLVEU-KRWDZBQOSA-N	0	3	342.483	3.402	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(C2CC2)on1	ZINC001089676846	1360585124	/nfs/dbraw/zinc/58/51/24/1360585124.db2.gz	QJJGQQCASNNEQE-HNNXBMFYSA-N	0	3	331.460	3.349	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cnc2n1CCCC2	ZINC001089686166	1360591910	/nfs/dbraw/zinc/59/19/10/1360591910.db2.gz	NRJDAVNWQLWLNR-MRXNPFEDSA-N	0	3	344.503	3.016	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H]1Cc2ccc(F)cc21	ZINC001089687370	1360593469	/nfs/dbraw/zinc/59/34/69/1360593469.db2.gz	IYDFYJRMVDOXRJ-AEFFLSMTSA-N	0	3	330.447	3.258	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ccnc(OCC)c1	ZINC001089692745	1360598230	/nfs/dbraw/zinc/59/82/30/1360598230.db2.gz	BYUKCHNBHHASEK-KRWDZBQOSA-N	0	3	345.487	3.277	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1coc(C2CC2)n1	ZINC001089705814	1360608243	/nfs/dbraw/zinc/60/82/43/1360608243.db2.gz	ATEGHTAATXJICA-OAHLLOKOSA-N	0	3	331.460	3.349	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc2cnccc2c1	ZINC001089720174	1360622322	/nfs/dbraw/zinc/62/23/22/1360622322.db2.gz	RGGNSAUICJYEDE-FQEVSTJZSA-N	0	3	349.478	3.479	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1oc(CCC)nc1C	ZINC001089722459	1360626136	/nfs/dbraw/zinc/62/61/36/1360626136.db2.gz	ZSOIDCSEJWEKDF-MRXNPFEDSA-N	0	3	345.487	3.179	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(C(F)F)o1	ZINC001089725240	1360628267	/nfs/dbraw/zinc/62/82/67/1360628267.db2.gz	CPDDDUNPGLOTCW-CYBMUJFWSA-N	0	3	338.398	3.461	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)c2cc(C)oc2C)C1	ZINC001089769315	1360657310	/nfs/dbraw/zinc/65/73/10/1360657310.db2.gz	KNQINJIPUUBFLR-DKIMLUQUSA-N	0	3	348.874	3.431	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1CC2(CC2)C1	ZINC001089865758	1360708958	/nfs/dbraw/zinc/70/89/58/1360708958.db2.gz	TXMJLDJIRZFQBR-ORQFMDKSSA-N	0	3	334.891	3.098	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1cccn1CC	ZINC001089905049	1360735492	/nfs/dbraw/zinc/73/54/92/1360735492.db2.gz	NGUCBDYKWUYTAN-YVSFHVDLSA-N	0	3	347.890	3.043	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccccc2C)CC2(CCOCC2)C1	ZINC001089922816	1360746488	/nfs/dbraw/zinc/74/64/88/1360746488.db2.gz	SLGJQWJQKUGOOB-SFHVURJKSA-N	0	3	342.483	3.172	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc(C)oc2C)CC2(CCOCC2)C1	ZINC001089924773	1360747674	/nfs/dbraw/zinc/74/76/74/1360747674.db2.gz	UMUGRAUDUGSKHB-KRWDZBQOSA-N	0	3	346.471	3.073	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)C=C2CCCCC2)CC2(CCOCC2)C1	ZINC001089926002	1360748260	/nfs/dbraw/zinc/74/82/60/1360748260.db2.gz	BGSXXHOECQXWAT-SFHVURJKSA-N	0	3	332.488	3.050	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](CNCc2nc(C)cs2)[C@H](C)C1	ZINC001184499450	1387474800	/nfs/dbraw/zinc/47/48/00/1387474800.db2.gz	ZSYUAFRHFRJXLY-ZBFHGGJFSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)c2cc(C)cs2)C1	ZINC001091019575	1360979877	/nfs/dbraw/zinc/97/98/77/1360979877.db2.gz	AXUJTCKYKWAKDV-UHFFFAOYSA-N	0	3	343.290	3.063	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H]2CC[C@H](c3ccccc3)O2)C1	ZINC001091030069	1360982955	/nfs/dbraw/zinc/98/29/55/1360982955.db2.gz	BUBSYDJQTUZUKV-SYNTWQANSA-N	0	3	348.874	3.144	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccccc2OC2CCC2)C1	ZINC001091223248	1361013538	/nfs/dbraw/zinc/01/35/38/1361013538.db2.gz	BDSOUDKVJGVETL-UHFFFAOYSA-N	0	3	348.874	3.468	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(Cl)c(F)c2)C1	ZINC001091252481	1361022514	/nfs/dbraw/zinc/02/25/14/1361022514.db2.gz	TUXAZPRKIGKKSZ-UHFFFAOYSA-N	0	3	331.218	3.330	20	30		EGEDHN
C[C@@]12CN(Cc3ccc(C#N)cc3)C[C@@H]1CN(C(=O)[C@H]1CC=CCC1)C2	ZINC001091475144	1361111908	/nfs/dbraw/zinc/11/19/08/1361111908.db2.gz	ZCQUZNYBPRBTNC-VWPQPMDRSA-N	0	3	349.478	3.195	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc4c(cc(C)cc4C)[nH]3)C[C@]2(C)C1	ZINC001091891891	1361241405	/nfs/dbraw/zinc/24/14/05/1361241405.db2.gz	HNJSFLBDUHRYKC-VGSWGCGISA-N	0	3	349.478	3.202	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CN(Cc3cnc(C)s3)C[C@@]2(C)C1	ZINC001091910304	1361243941	/nfs/dbraw/zinc/24/39/41/1361243941.db2.gz	RCKPCKGAECPBLQ-BEFAXECRSA-N	0	3	347.528	3.334	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CN(Cc3ccc(C#N)cc3)C[C@@]2(C)C1	ZINC001091916147	1361247477	/nfs/dbraw/zinc/24/74/77/1361247477.db2.gz	CGFFCXZZXZZXCT-NQIIRXRSSA-N	0	3	337.467	3.051	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CN(Cc3cnccc3C)C[C@@]2(C)C1	ZINC001091978576	1361264711	/nfs/dbraw/zinc/26/47/11/1361264711.db2.gz	WHNJFQAIZRRAGE-NRSPTQNISA-N	0	3	341.499	3.273	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CN(Cc3cncc(C)c3)C[C@@]2(C)C1	ZINC001091978623	1361265847	/nfs/dbraw/zinc/26/58/47/1361265847.db2.gz	YIWPZXMUMPYMIW-NRSPTQNISA-N	0	3	341.499	3.273	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc4c(c3)C=CCC4)C[C@]2(C)C1	ZINC001092092302	1361299858	/nfs/dbraw/zinc/29/98/58/1361299858.db2.gz	RYEQDSUPVQDEDU-IRLDBZIGSA-N	0	3	334.463	3.063	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cccc(C)c3Cl)C[C@]2(C)C1	ZINC001092106794	1361301046	/nfs/dbraw/zinc/30/10/46/1361301046.db2.gz	ASSMXYVPQQNZQK-BEFAXECRSA-N	0	3	330.859	3.066	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NC[C@@H]1CN(C[C@H](F)CC)C[C@H]1C	ZINC001092740537	1361450602	/nfs/dbraw/zinc/45/06/02/1361450602.db2.gz	PTZMSRHSFVTTQY-BRWVUGGUSA-N	0	3	348.462	3.297	20	30		EGEDHN
C#CCN1C[C@@H](CNC(=O)c2sc3ccccc3c2C)[C@H](C)C1	ZINC001092801582	1361458922	/nfs/dbraw/zinc/45/89/22/1361458922.db2.gz	AUBDCJGTWYUFGP-UKRRQHHQSA-N	0	3	326.465	3.141	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)[C@@]2(C)CC=CCC2)CC1	ZINC001093369689	1361578585	/nfs/dbraw/zinc/57/85/85/1361578585.db2.gz	JIURKHGGUIJOAT-CTNGQTDRSA-N	0	3	340.511	3.459	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)c2ccsc2C)CC1	ZINC001093370465	1361580082	/nfs/dbraw/zinc/58/00/82/1361580082.db2.gz	UJILKDMRVUNKHS-GOSISDBHSA-N	0	3	342.508	3.396	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C2CC3(CCC3)C2)CC1	ZINC001093376532	1361586905	/nfs/dbraw/zinc/58/69/05/1361586905.db2.gz	LIBPHBFXOMKHOJ-IBGZPJMESA-N	0	3	340.511	3.293	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)[C@@H]2Cc3ccccc32)CC1	ZINC001093377089	1361587500	/nfs/dbraw/zinc/58/75/00/1361587500.db2.gz	PXBCGUARFHJUKY-NHCUHLMSSA-N	0	3	348.490	3.053	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)c2ccc(Cl)[nH]2)CC1	ZINC001093378282	1361588808	/nfs/dbraw/zinc/58/88/08/1361588808.db2.gz	MQBFSNXRNBJSNS-KRWDZBQOSA-N	0	3	345.874	3.008	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3c(C)oc4ccccc43)CCC[C@@H]12	ZINC001094423165	1361795992	/nfs/dbraw/zinc/79/59/92/1361795992.db2.gz	NHLHWDDIMKCKID-WIYYLYMNSA-N	0	3	336.435	3.349	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cccc(OCCC)c3)CCC[C@@H]12	ZINC001094427966	1361798232	/nfs/dbraw/zinc/79/82/32/1361798232.db2.gz	BWWJCZDWSWSLGJ-TZIWHRDSSA-N	0	3	340.467	3.083	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cnc([C@H](C)OC)s1)C2	ZINC001095419080	1362134066	/nfs/dbraw/zinc/13/40/66/1362134066.db2.gz	NQFZDNWMIISKFC-XGUBFFRZSA-N	0	3	349.500	3.152	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1c(C)noc1C(C)C)C2	ZINC001095568837	1362171590	/nfs/dbraw/zinc/17/15/90/1362171590.db2.gz	WPBRGCDAVMKISS-PMPSAXMXSA-N	0	3	331.460	3.408	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@@H]1C[C@H]1Cc1ccccc1)C2	ZINC001095800962	1362234262	/nfs/dbraw/zinc/23/42/62/1362234262.db2.gz	GFPVAVMEAJHUAD-TXVWBRJLSA-N	0	3	336.479	3.000	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C(C)(C)c1cccc(Cl)c1)C2	ZINC001096081611	1362375324	/nfs/dbraw/zinc/37/53/24/1362375324.db2.gz	OGGRNCBGLLYUIS-SQNIBIBYSA-N	0	3	344.886	3.362	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1c[nH]c3c1cccc3C)C2	ZINC001096098941	1362382205	/nfs/dbraw/zinc/38/22/05/1362382205.db2.gz	LGFJVQVVDFIENY-NEWSRXKRSA-N	0	3	337.467	3.316	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cnc(C3CC3)s1)C2	ZINC001096396699	1362487594	/nfs/dbraw/zinc/48/75/94/1362487594.db2.gz	BGQYAZAGAKERLW-ILXRZTDVSA-N	0	3	331.485	3.322	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(OC)c(Cl)c1)C2	ZINC001096509160	1362541175	/nfs/dbraw/zinc/54/11/75/1362541175.db2.gz	GIMUBCQZMBAPMQ-KBMXLJTQSA-N	0	3	334.847	3.260	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1nc(C(C)(C)C)cs1)C2	ZINC001097264103	1362906206	/nfs/dbraw/zinc/90/62/06/1362906206.db2.gz	JWLZCYMJLLMTDB-MCIONIFRSA-N	0	3	333.501	3.352	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](CNCc2ncc(C)s2)[C@@H](C)C1	ZINC001185060137	1387603447	/nfs/dbraw/zinc/60/34/47/1387603447.db2.gz	DRVJCVYWZHJWRI-GOEBONIOSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc(C)cc(OC)c1C)C2	ZINC001097441312	1362991345	/nfs/dbraw/zinc/99/13/45/1362991345.db2.gz	HLKNBNHMQNGJLE-NXHRZFHOSA-N	0	3	328.456	3.223	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc(-c3cccs3)on1)C2	ZINC001097600454	1363066852	/nfs/dbraw/zinc/06/68/52/1363066852.db2.gz	PNKPPRYNEVAZSJ-NFAWXSAZSA-N	0	3	343.452	3.314	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1ccc(F)cc1Cl)C2	ZINC001097780204	1363119205	/nfs/dbraw/zinc/11/92/05/1363119205.db2.gz	GVFXQMQSCFDKEO-OIISXLGYSA-N	0	3	336.838	3.319	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C1(c3ccccc3)CCCC1)C2	ZINC001098336247	1363302983	/nfs/dbraw/zinc/30/29/83/1363302983.db2.gz	XLEYBIMXDIDXFY-AQNXPRMDSA-N	0	3	336.479	3.243	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C(C)(C)C(=C)Cl)C[C@@H](C)O2	ZINC001098599893	1363393701	/nfs/dbraw/zinc/39/37/01/1363393701.db2.gz	NUUDSONYCPPDAH-CQSZACIVSA-N	0	3	340.895	3.033	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H]1CCCC1(C)C)C[C@H](C)O2	ZINC001098627112	1363405969	/nfs/dbraw/zinc/40/59/69/1363405969.db2.gz	JHRYERFWZSTFDZ-IRXDYDNUSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1(CC)CCCC1)C[C@@H](C)O2	ZINC001098653929	1363419554	/nfs/dbraw/zinc/41/95/54/1363419554.db2.gz	RPGMMDRIOLTBHA-QGZVFWFLSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](n2cc(CNCCCCCC)nn2)C1	ZINC001098680949	1363433424	/nfs/dbraw/zinc/43/34/24/1363433424.db2.gz	LXYZGSTYKCRKFA-GOSISDBHSA-N	0	3	347.507	3.078	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CCC[C@]3(NC(=O)C3CCCC3)C2)c1	ZINC001098683998	1363433967	/nfs/dbraw/zinc/43/39/67/1363433967.db2.gz	FGDGSRFYKVMRGN-FPOVZHCZSA-N	0	3	337.467	3.219	20	30		EGEDHN
C#CCCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(CCC)s2)C1	ZINC001098857525	1363494443	/nfs/dbraw/zinc/49/44/43/1363494443.db2.gz	JVYQKZKWPLKESK-KXBFYZLASA-N	0	3	330.497	3.308	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)CCc1ccco1	ZINC001098895707	1363508843	/nfs/dbraw/zinc/50/88/43/1363508843.db2.gz	WWVRIGVGTKDKMW-QGZVFWFLSA-N	0	3	348.487	3.022	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2coc3cc(F)ccc23)C1	ZINC001098914099	1363518348	/nfs/dbraw/zinc/51/83/48/1363518348.db2.gz	LNZKSCPHMAHIFG-DJJJIMSYSA-N	0	3	328.387	3.342	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC[C@@H]1CCC(C)(C)CN1CCCCC(F)(F)F	ZINC001098982352	1363555567	/nfs/dbraw/zinc/55/55/67/1363555567.db2.gz	KFSQNRPNJYVRCV-KBPBESRZSA-N	0	3	347.425	3.485	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(F)c(Cl)c2F)C1	ZINC001099012993	1363573627	/nfs/dbraw/zinc/57/36/27/1363573627.db2.gz	HKZFRSHNLPHJDA-GTNSWQLSSA-N	0	3	340.801	3.389	20	30		EGEDHN
CC(C)(C)C#CC(=O)NC[C@@H]1CCC(C)(C)CN1CCOC1CCC1	ZINC001099070313	1363606548	/nfs/dbraw/zinc/60/65/48/1363606548.db2.gz	VQGMZUGJSNQWTJ-KRWDZBQOSA-N	0	3	348.531	3.212	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)C(C)(C)[C@@H]1CCCCO1	ZINC001099079662	1363612241	/nfs/dbraw/zinc/61/22/41/1363612241.db2.gz	HAPYTVMYKYCDQE-IRXDYDNUSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H](C)Cn1ccc(C)n1	ZINC001099098072	1363620293	/nfs/dbraw/zinc/62/02/93/1363620293.db2.gz	IWCLPUKOBKANPI-FUHWJXTLSA-N	0	3	346.519	3.011	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@H]1CCC(C)(C)CN1CCOCC1CC1	ZINC001099097802	1363620395	/nfs/dbraw/zinc/62/03/95/1363620395.db2.gz	DDIYJGOUXSUVDE-GOSISDBHSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H]1CCCC12CC2	ZINC001099121711	1363636126	/nfs/dbraw/zinc/63/61/26/1363636126.db2.gz	NMPRVQSARGDVFN-QZTJIDSGSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(COC(C)C)cc2)C1	ZINC001099155156	1363659882	/nfs/dbraw/zinc/65/98/82/1363659882.db2.gz	CKDRRFLKGLWAFI-FPOVZHCZSA-N	0	3	342.483	3.382	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cocc1C	ZINC001099166327	1363666387	/nfs/dbraw/zinc/66/63/87/1363666387.db2.gz	UOMGHFVLAVHNOM-MRXNPFEDSA-N	0	3	334.460	3.011	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)C1(CC)CCC1	ZINC001099182581	1363678596	/nfs/dbraw/zinc/67/85/96/1363678596.db2.gz	MYLNOMJSXVFKCW-QGZVFWFLSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)C[C@@H](C=C)CC	ZINC001099194845	1363686658	/nfs/dbraw/zinc/68/66/58/1363686658.db2.gz	SWNCJJQGXLTKEI-ZWKOTPCHSA-N	0	3	336.520	3.398	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(C)[nH]c1C	ZINC001099246884	1363711883	/nfs/dbraw/zinc/71/18/83/1363711883.db2.gz	ZWEROWYSHJQJIT-QGZVFWFLSA-N	0	3	347.503	3.055	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@@H]2CCC(C)=C(C)C2)C[C@H]1C(F)(F)F	ZINC001099256167	1363717007	/nfs/dbraw/zinc/71/70/07/1363717007.db2.gz	ZARPWKCTJBOPST-RBSFLKMASA-N	0	3	330.394	3.288	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@@]2(C)CC=CCC2)C[C@H]1C(F)(F)F	ZINC001099256266	1363717164	/nfs/dbraw/zinc/71/71/64/1363717164.db2.gz	JIZPLFNMCNOAAM-FMKPAKJESA-N	0	3	330.394	3.288	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)CCCc1cccnc1	ZINC001099286482	1363733257	/nfs/dbraw/zinc/73/32/57/1363733257.db2.gz	YLBHEZPTOIXLAX-SFHVURJKSA-N	0	3	329.488	3.197	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)C(C)(C)c2cccs2)C[C@H]1C(F)(F)F	ZINC001099288109	1363733530	/nfs/dbraw/zinc/73/35/30/1363733530.db2.gz	AKFAQROIZRXMHH-VXGBXAGGSA-N	0	3	346.418	3.191	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)CCC1(C)CC1	ZINC001099292213	1363735194	/nfs/dbraw/zinc/73/51/94/1363735194.db2.gz	RHPNNEDTKQYMEL-KRWDZBQOSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H]1CC12CCCC2	ZINC001099299723	1363738113	/nfs/dbraw/zinc/73/81/13/1363738113.db2.gz	VGNWIEQEXYEIJG-ROUUACIJSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H](C)c1cccnc1	ZINC001099310510	1363743928	/nfs/dbraw/zinc/74/39/28/1363743928.db2.gz	OICGDSZGPPOZED-SJLPKXTDSA-N	0	3	329.488	3.368	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H](C)Oc1ccccn1	ZINC001099316605	1363746287	/nfs/dbraw/zinc/74/62/87/1363746287.db2.gz	WTSMZJWMQKMCAI-SJORKVTESA-N	0	3	345.487	3.032	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@H](C)c2cc(C)oc2C)C[C@H]1C(F)(F)F	ZINC001099321995	1363750428	/nfs/dbraw/zinc/75/04/28/1363750428.db2.gz	GICOZYXBHNYHOW-KCPJHIHWSA-N	0	3	344.377	3.165	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@H]2CC23CCCC3)C[C@H]1C(F)(F)F	ZINC001099330289	1363753915	/nfs/dbraw/zinc/75/39/15/1363753915.db2.gz	KKUHRSQZWTYLCR-MGPQQGTHSA-N	0	3	330.394	3.122	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2cccc(C)c2C)C[C@H]1C(F)(F)F	ZINC001099336092	1363757639	/nfs/dbraw/zinc/75/76/39/1363757639.db2.gz	IAELZORNXSHUMP-HZPDHXFCSA-N	0	3	340.389	3.472	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)Cc2ccc(C)s2)C[C@H]1C(F)(F)F	ZINC001099345947	1363763483	/nfs/dbraw/zinc/76/34/83/1363763483.db2.gz	ZUNCXRAUNXOGPX-ZIAGYGMSSA-N	0	3	346.418	3.154	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H](C)n1c(C)ccc1C	ZINC001099353586	1363768265	/nfs/dbraw/zinc/76/82/65/1363768265.db2.gz	COHZQAFKWMAERQ-QZTJIDSGSA-N	0	3	331.504	3.459	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CC(C)(C)CC)CC2(CCOCC2)C1	ZINC001099582991	1363864329	/nfs/dbraw/zinc/86/43/29/1363864329.db2.gz	GUCGLICCAUYCGS-KRWDZBQOSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)C[C@H](CC)C(C)C)CC2(CCOCC2)C1	ZINC001099596418	1363879251	/nfs/dbraw/zinc/87/92/51/1363879251.db2.gz	BKVRUJJECXHHIR-ZWKOTPCHSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1CCN(Cc2ccccc2C(C)C)C[C@H]1O	ZINC001099973787	1363994457	/nfs/dbraw/zinc/99/44/57/1363994457.db2.gz	JGHZJTFJNIGJRM-VQTJNVASSA-N	0	3	344.499	3.218	20	30		EGEDHN
C=CCCC(=O)NCC1CC(NCc2cc(Cl)cc3c2OCC3)C1	ZINC001100176818	1364036556	/nfs/dbraw/zinc/03/65/56/1364036556.db2.gz	HAKJFDOUNNZQKC-UHFFFAOYSA-N	0	3	348.874	3.226	20	30		EGEDHN
CC(C)C#CC(=O)NCC1CC(NCc2cc(F)ccc2Cl)C1	ZINC001100309338	1364076785	/nfs/dbraw/zinc/07/67/85/1364076785.db2.gz	PYJOXYOUZNHNKX-UHFFFAOYSA-N	0	3	336.838	3.123	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)CCCc2csc(C)n2)C1	ZINC001100336069	1364083037	/nfs/dbraw/zinc/08/30/37/1364083037.db2.gz	GXKIVIUDYANRTD-UHFFFAOYSA-N	0	3	341.908	3.011	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCC1CC(NCc2c(C)nsc2C)C1	ZINC001100364840	1364092879	/nfs/dbraw/zinc/09/28/79/1364092879.db2.gz	WSGMQQPNUVSJPR-UHFFFAOYSA-N	0	3	335.517	3.347	20	30		EGEDHN
C=C(C)CCC(=O)NCC1CC(NCc2oc(C(C)C)nc2C)C1	ZINC001100371181	1364094924	/nfs/dbraw/zinc/09/49/24/1364094924.db2.gz	TXMPOUNFLAJYBT-UHFFFAOYSA-N	0	3	333.476	3.447	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)C2(CC(C)C)CC2)C1	ZINC001100395530	1364100518	/nfs/dbraw/zinc/10/05/18/1364100518.db2.gz	GRZPUHMDBRXCOE-UHFFFAOYSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)CCCc2ccsc2)C1	ZINC001100424826	1364109413	/nfs/dbraw/zinc/10/94/13/1364109413.db2.gz	ZGZALDUAGRPVMR-UHFFFAOYSA-N	0	3	326.893	3.308	20	30		EGEDHN
O=C(C[C@H]1CC=CCC1)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100572736	1364168655	/nfs/dbraw/zinc/16/86/55/1364168655.db2.gz	OPEMFMKEVGJBOZ-MWXLCCTBSA-N	0	3	336.479	3.269	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC1CC(NCc2c(C)onc2CC)C1	ZINC001100711375	1364231137	/nfs/dbraw/zinc/23/11/37/1364231137.db2.gz	MJZKSSORSGRGNF-UHFFFAOYSA-N	0	3	333.476	3.132	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)[C@H](CCC)C(C)C)C1	ZINC001100720072	1364234541	/nfs/dbraw/zinc/23/45/41/1364234541.db2.gz	FRHUYKOVWAAEON-YMAMQOFZSA-N	0	3	345.325	3.452	20	30		EGEDHN
C=C(C)CN1CC[C@@H](Oc2ccnc(CNC(=O)CC(C)(C)C)c2)C1	ZINC001101090090	1364408666	/nfs/dbraw/zinc/40/86/66/1364408666.db2.gz	FYBZLBUXGCZMNE-GOSISDBHSA-N	0	3	345.487	3.163	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)COCCCCCCCC)C[C@]2(C)C1	ZINC001101269450	1364493084	/nfs/dbraw/zinc/49/30/84/1364493084.db2.gz	KXFFIZINVIEGLC-CTNGQTDRSA-N	0	3	348.531	3.167	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@H]2CN(Cc3cncc(C)c3)C[C@@]2(C)C1	ZINC001101337708	1364516725	/nfs/dbraw/zinc/51/67/25/1364516725.db2.gz	IYBITOXYIMBGDV-DSKINZAPSA-N	0	3	341.499	3.273	20	30		EGEDHN
C#CCC1(C(=O)N2C[C@H]3CN(C[C@@H](F)CC)C[C@@]3(C)C2)CCCCC1	ZINC001101482633	1364578032	/nfs/dbraw/zinc/57/80/32/1364578032.db2.gz	HEJDBARYQYYFAH-HBFSDRIKSA-N	0	3	348.506	3.489	20	30		EGEDHN
C#CCCCC(=O)N1CCC(C(C)(C)CNCc2nccs2)CC1	ZINC001101535520	1364604602	/nfs/dbraw/zinc/60/46/02/1364604602.db2.gz	LWIJDCUQGGRJJT-UHFFFAOYSA-N	0	3	347.528	3.301	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC(C(C)(C)CNCc2cscn2)CC1	ZINC001101540698	1364607104	/nfs/dbraw/zinc/60/71/04/1364607104.db2.gz	PWPSHQMOBUQPKU-UHFFFAOYSA-N	0	3	347.528	3.157	20	30		EGEDHN
C=CCC[C@H](C)N1CC2(C1)C[C@@H](NC(=O)CC(C)(C)C)c1nccn12	ZINC001101610050	1364654535	/nfs/dbraw/zinc/65/45/35/1364654535.db2.gz	DVDWUZRBRJEBKJ-JKSUJKDBSA-N	0	3	344.503	3.246	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC2(CN(C[C@@H](C)CC(C)C)C2)n2ccnc21	ZINC001101615201	1364656413	/nfs/dbraw/zinc/65/64/13/1364656413.db2.gz	CDHVEUIQNOHTBI-DLBZAZTESA-N	0	3	344.503	3.103	20	30		EGEDHN
C=CCC[C@H](C)N1CC2(C1)C[C@@H](NC(=O)CCC(=C)C)c1nccn12	ZINC001101630326	1364662573	/nfs/dbraw/zinc/66/25/73/1364662573.db2.gz	DUENHBQPFRIZCI-DLBZAZTESA-N	0	3	342.487	3.166	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1CC2(CN(CCC(C)(C)C)C2)n2ccnc21	ZINC001101637478	1364664572	/nfs/dbraw/zinc/66/45/72/1364664572.db2.gz	MUXCEROHFXOGGX-HNNXBMFYSA-N	0	3	344.503	3.103	20	30		EGEDHN
CC[C@H](C)C(=O)NC[C@@H]1CN(CC#Cc2ccc(Cl)cc2)C[C@H]1C	ZINC001101730076	1364706119	/nfs/dbraw/zinc/70/61/19/1364706119.db2.gz	NXUMURLULCRENB-LZLYRXPVSA-N	0	3	346.902	3.422	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC[C@@H]1CN(Cc2c(C)noc2C)C[C@H]1C	ZINC001101997053	1364804830	/nfs/dbraw/zinc/80/48/30/1364804830.db2.gz	VOJJGJMFHOSQJU-RDTXWAMCSA-N	0	3	345.487	3.244	20	30		EGEDHN
CCC1(C(=O)NC[C@@H]2CN(Cc3ccc(C#N)s3)C[C@H]2C)CCC1	ZINC001102256513	1364969618	/nfs/dbraw/zinc/96/96/18/1364969618.db2.gz	WGVXSPSRXWTZPZ-HUUCEWRRSA-N	0	3	345.512	3.384	20	30		EGEDHN
CC1CC(C(=O)NCC[C@@H]2CN(Cc3ccccc3C#N)C[C@H]2C)C1	ZINC001102845889	1365248636	/nfs/dbraw/zinc/24/86/36/1365248636.db2.gz	RUROUMAUIYJQLG-URTYCYGZSA-N	0	3	339.483	3.179	20	30		EGEDHN
CC/C(C)=C/C(=O)NCC[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1C	ZINC001102951888	1365313189	/nfs/dbraw/zinc/31/31/89/1365313189.db2.gz	QZMQMUFYMJOUNU-KMXARQBDSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)C(C)(C)CC(F)F)C1	ZINC001103074827	1365366215	/nfs/dbraw/zinc/36/62/15/1365366215.db2.gz	YVZMEKNKVSLHGV-DGCLKSJQSA-N	0	3	336.854	3.495	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cc3c[nH]ccc-3n2)C1	ZINC001103144044	1365407106	/nfs/dbraw/zinc/40/71/06/1365407106.db2.gz	FYVMFDOFJSCMHK-TZMCWYRMSA-N	0	3	346.862	3.003	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC[C@@H]1CN(Cc2cnc(C)o2)C[C@H]1C	ZINC001103402025	1365537896	/nfs/dbraw/zinc/53/78/96/1365537896.db2.gz	XSESTJKSZXDCLF-IDHHARJASA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2ocnc2C(F)F)C1	ZINC001103442646	1365562778	/nfs/dbraw/zinc/56/27/78/1365562778.db2.gz	BOLXVVHIPQQIAR-MWLCHTKSSA-N	0	3	347.793	3.053	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1CCNC(=O)C(C)(C)C	ZINC001103667631	1365715808	/nfs/dbraw/zinc/71/58/08/1365715808.db2.gz	GLBRFHFRMVUGTN-GDBMZVCRSA-N	0	3	345.462	3.318	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cc(F)cc(F)c2)C1	ZINC001103699448	1365737302	/nfs/dbraw/zinc/73/73/02/1365737302.db2.gz	HLXGTKDMCWZKJN-DGCLKSJQSA-N	0	3	342.817	3.405	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CN(C(=O)CC(C)(C)C)C[C@H]1C	ZINC001103887729	1365824313	/nfs/dbraw/zinc/82/43/13/1365824313.db2.gz	KRSHWNILUFGDBC-TZMCWYRMSA-N	0	3	345.325	3.405	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@H](CCNCc2c(C)onc2CC)C1	ZINC001103979502	1365857668	/nfs/dbraw/zinc/85/76/68/1365857668.db2.gz	UDVZPOJWWAMPOQ-GDBMZVCRSA-N	0	3	333.476	3.086	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](C)[C@H](CCNCc2c(C)noc2C)C1	ZINC001104238709	1365965619	/nfs/dbraw/zinc/96/56/19/1365965619.db2.gz	NKXLYQBRHHUJFE-RHSMWYFYSA-N	0	3	347.503	3.468	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)[C@H](CCNCc2ccn(C(C)C)n2)C1	ZINC001104249952	1365967944	/nfs/dbraw/zinc/96/79/44/1365967944.db2.gz	LIYLBUAQIDOQSS-QZTJIDSGSA-N	0	3	346.519	3.395	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](C)[C@H](CCNCc2cc(C)no2)C1	ZINC001104563844	1366078867	/nfs/dbraw/zinc/07/88/67/1366078867.db2.gz	WZWUNVDRYIUSRN-ZMSDIMECSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](C)[C@H](CCNCc2conc2C)C1	ZINC001104563692	1366078984	/nfs/dbraw/zinc/07/89/84/1366078984.db2.gz	RBMODQMUFMHYAK-ZMSDIMECSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)C[C@@H](C)c2cccnc2)C[C@H]1C	ZINC001104752340	1366157060	/nfs/dbraw/zinc/15/70/60/1366157060.db2.gz	CGSZRQIGYDVSCA-IIDMSEBBSA-N	0	3	349.906	3.402	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2c[nH]cc2C2CC2)C[C@H]1C	ZINC001104853473	1366199756	/nfs/dbraw/zinc/19/97/56/1366199756.db2.gz	FJXAYFYTPVXNEZ-IUODEOHRSA-N	0	3	335.879	3.332	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1C[C@@](CNCCF)(c2ccccc2)C1	ZINC001105425214	1366460746	/nfs/dbraw/zinc/46/07/46/1366460746.db2.gz	BSRQOWFLIIRVFK-MSEWRSJXSA-N	0	3	332.463	3.364	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(c2ccccc2)C[C@H](NC(=O)CCCF)C1	ZINC001105434028	1366466124	/nfs/dbraw/zinc/46/61/24/1366466124.db2.gz	WMDCCGKSFQCHQP-MAEOIBBWSA-N	0	3	338.854	3.295	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@H]1C[C@@](CNCCF)(c2ccccc2)C1	ZINC001105436894	1366467710	/nfs/dbraw/zinc/46/77/10/1366467710.db2.gz	MTHCHGFZYHCRTD-RLLQIKCJSA-N	0	3	332.463	3.364	20	30		EGEDHN
CC/C=C(\C)C(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001105898039	1366597787	/nfs/dbraw/zinc/59/77/87/1366597787.db2.gz	SWEGHMUXUBYXIG-NENMWUPCSA-N	0	3	325.456	3.099	20	30		EGEDHN
CC#CCCCC(=O)N1C[C@@H](CNCc2c(F)cccc2F)[C@H](C)C1	ZINC001106557942	1366734626	/nfs/dbraw/zinc/73/46/26/1366734626.db2.gz	MAUDKHJZEDOMHM-HZPDHXFCSA-N	0	3	348.437	3.343	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC[C@]12CCC[C@H]1N(Cc1ccc(Cl)cc1)CC2	ZINC001107335895	1366931786	/nfs/dbraw/zinc/93/17/86/1366931786.db2.gz	DWUKSUVYZSIFTN-POZUXBRTSA-N	0	3	345.874	3.360	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCCc1cccc(F)c1	ZINC001109245902	1367024305	/nfs/dbraw/zinc/02/43/05/1367024305.db2.gz	FSMJMJLAOBJZJS-AABGKKOBSA-N	0	3	342.458	3.139	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](N(C)C[C@@H](OC)c2ccccc2)C1	ZINC001189743716	1367100721	/nfs/dbraw/zinc/10/07/21/1367100721.db2.gz	IADVKZQJXCRQFP-WOJBJXKFSA-N	0	3	342.483	3.100	20	30		EGEDHN
C#CCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3CCc2cccs2)CCC1	ZINC001109395623	1367103066	/nfs/dbraw/zinc/10/30/66/1367103066.db2.gz	SNIKUCWYAMBBCA-NJAFHUGGSA-N	0	3	342.508	3.206	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)C[C@H](CC)C(C)(C)C)[C@@H]2C1	ZINC001189762631	1367104415	/nfs/dbraw/zinc/10/44/15/1367104415.db2.gz	CVGQBMKYNGUPMW-OKZBNKHCSA-N	0	3	336.520	3.184	20	30		EGEDHN
C#CCCCCC(=O)NC[C@]1(C)CN(C[C@H](C)CC(C)C)CCO1	ZINC001107883160	1367190878	/nfs/dbraw/zinc/19/08/78/1367190878.db2.gz	MIVFLPPJRFJYLN-UYAOXDASSA-N	0	3	336.520	3.069	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)CC(C)(C)C2CC2)C1	ZINC001107922015	1367203248	/nfs/dbraw/zinc/20/32/48/1367203248.db2.gz	KLTRHWIKLHXWMD-JXFKEZNVSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC[C@]1(C)CN(CCC(C)(C)C)CCO1	ZINC001107967995	1367222025	/nfs/dbraw/zinc/22/20/25/1367222025.db2.gz	ZXCUOUDBFDRXDY-HXUWFJFHSA-N	0	3	336.520	3.398	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](N(C)Cc2cccc(OC)c2)C1	ZINC001190355283	1367237727	/nfs/dbraw/zinc/23/77/27/1367237727.db2.gz	XWCCMGDRHVROJQ-IBGZPJMESA-N	0	3	342.483	3.496	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCc1scnc1C	ZINC001109632849	1367251819	/nfs/dbraw/zinc/25/18/19/1367251819.db2.gz	FWYFWWHYNRUWMH-ORQFMDKSSA-N	0	3	347.528	3.318	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](N(C)Cc2ccc3c(c2)COC3)C1	ZINC001190397728	1367253311	/nfs/dbraw/zinc/25/33/11/1367253311.db2.gz	OARJOMCJEJTPOC-IBGZPJMESA-N	0	3	342.483	3.352	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2c(C)oc(C)c2C)C1	ZINC001108061051	1367262265	/nfs/dbraw/zinc/26/22/65/1367262265.db2.gz	FOUXHZUEEJDBOY-VLIAUNLRSA-N	0	3	348.487	3.380	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](N(C)C[C@H](OC)c2ccccc2)C1	ZINC001190428685	1367263036	/nfs/dbraw/zinc/26/30/36/1367263036.db2.gz	NNJHEBJFJVJJHM-OALUTQOASA-N	0	3	330.472	3.263	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](N(C)CCc2c(F)cccc2F)C1	ZINC001190429163	1367263343	/nfs/dbraw/zinc/26/33/43/1367263343.db2.gz	VTHQHFQGXNWCFK-OAHLLOKOSA-N	0	3	336.426	3.396	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](N(C)CCOc2ccc(C)cc2)C1	ZINC001190436528	1367265284	/nfs/dbraw/zinc/26/52/84/1367265284.db2.gz	VZLPSFDOVPNOFL-GOSISDBHSA-N	0	3	330.472	3.263	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCCc1ccc(OC)cc1)C2	ZINC001109671422	1367274887	/nfs/dbraw/zinc/27/48/87/1367274887.db2.gz	IGMVAPKZYPQVBH-HOJAQTOUSA-N	0	3	342.483	3.316	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2cc(F)ccc2C)C1	ZINC001108106967	1367285949	/nfs/dbraw/zinc/28/59/49/1367285949.db2.gz	MRMGLDQUXOCLQL-OXQOHEQNSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)C[C@@H]3CCCCC3(C)C)[C@@H]2C1	ZINC001190535474	1367288153	/nfs/dbraw/zinc/28/81/53/1367288153.db2.gz	PGCILCLKEJLQRB-GBESFXJTSA-N	0	3	348.531	3.328	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@@H](N(C)Cc3ccc(F)cc3)C2)CCC1	ZINC001190595352	1367303013	/nfs/dbraw/zinc/30/30/13/1367303013.db2.gz	PSLBATONFGPGAJ-GOSISDBHSA-N	0	3	328.431	3.052	20	30		EGEDHN
CC#CCCCC(=O)NC[C@]1(C)CN(C[C@H](C)CC(C)C)CCO1	ZINC001108144166	1367305683	/nfs/dbraw/zinc/30/56/83/1367305683.db2.gz	LLHABBZGWKXMEX-UYAOXDASSA-N	0	3	336.520	3.069	20	30		EGEDHN
CC[C@@H](CC(F)F)C(=O)N1CC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001190614398	1367309420	/nfs/dbraw/zinc/30/94/20/1367309420.db2.gz	YHCZUIVNNQNJIH-IRXDYDNUSA-N	0	3	349.425	3.272	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)C2CCC(=C)CC2)C1	ZINC001108186378	1367329999	/nfs/dbraw/zinc/32/99/99/1367329999.db2.gz	OMXIOYACLIURCK-FXAWDEMLSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc([C@H](C)CC)no1)C2	ZINC001109816421	1367338690	/nfs/dbraw/zinc/33/86/90/1367338690.db2.gz	UXDCRQROICKYJR-JHNDHUHGSA-N	0	3	331.460	3.489	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2ccc(C)cc2F)C1	ZINC001108241026	1367356259	/nfs/dbraw/zinc/35/62/59/1367356259.db2.gz	UHOXKUFAINGZOQ-JXFKEZNVSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2ccc(C)cc2)C1	ZINC001108362834	1367412216	/nfs/dbraw/zinc/41/22/16/1367412216.db2.gz	SPESALLVMPMIMU-YLJYHZDGSA-N	0	3	330.472	3.170	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2ccc(C)cc2)C1	ZINC001108362832	1367412541	/nfs/dbraw/zinc/41/25/41/1367412541.db2.gz	SPESALLVMPMIMU-PXNSSMCTSA-N	0	3	330.472	3.170	20	30		EGEDHN
C[C@H](CC(C)(C)C)C(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001186111970	1387873295	/nfs/dbraw/zinc/87/32/95/1387873295.db2.gz	YRPOMOKMVDFPLA-RHSMWYFYSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](C)c1ccc(C)cc1)C2	ZINC001109992372	1367449259	/nfs/dbraw/zinc/44/92/59/1367449259.db2.gz	ZYQHCAYRASODCM-RNQOJCNYSA-N	0	3	342.483	3.023	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2c(C)cccc2F)C1	ZINC001108440799	1367458699	/nfs/dbraw/zinc/45/86/99/1367458699.db2.gz	FHPIPJUFDWYJDY-OXQOHEQNSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)COc1ccc(Cl)cc1)C2	ZINC001110054577	1367486152	/nfs/dbraw/zinc/48/61/52/1367486152.db2.gz	SBOHMHIDLXUCPS-PVAVHDDUSA-N	0	3	334.847	3.016	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)CCC2CCCCCC2)C1	ZINC001191383075	1367488920	/nfs/dbraw/zinc/48/89/20/1367488920.db2.gz	PVLCUALMYNEEDN-IBGZPJMESA-N	0	3	336.520	3.472	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccccc1CC	ZINC001110183245	1367551672	/nfs/dbraw/zinc/55/16/72/1367551672.db2.gz	OHQMBULTFDMWMJ-LDTOTXGLSA-N	0	3	342.483	3.062	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](N(C)Cc2cc(F)ccc2C)C1	ZINC001191840714	1367608960	/nfs/dbraw/zinc/60/89/60/1367608960.db2.gz	ZYSHLWBVIOMYIE-LJQANCHMSA-N	0	3	330.447	3.360	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001191868158	1367619926	/nfs/dbraw/zinc/61/99/26/1367619926.db2.gz	OZEINKCYLQEWTQ-APWZRJJASA-N	0	3	325.456	3.193	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001191867995	1367620520	/nfs/dbraw/zinc/62/05/20/1367620520.db2.gz	MKVKVHMTSUOFHU-VQIMIIECSA-N	0	3	325.456	3.193	20	30		EGEDHN
CC[C@H](c1ccccc1)N1[C@@H]2CC[C@H]1[C@H](NC(=O)CSCC#N)C2	ZINC001110301390	1367622486	/nfs/dbraw/zinc/62/24/86/1367622486.db2.gz	DBPQFIRNMBMQRM-TVFCKZIOSA-N	0	3	343.496	3.116	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@@H](N(C)CCc2scnc2C)C1	ZINC001191889447	1367626011	/nfs/dbraw/zinc/62/60/11/1367626011.db2.gz	GLULCFRUFCJPHC-JKSUJKDBSA-N	0	3	335.517	3.129	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@@H](N(C)CCOc2ccccc2)C1	ZINC001191890698	1367626952	/nfs/dbraw/zinc/62/69/52/1367626952.db2.gz	UEMSCKYMYWLTTI-QZTJIDSGSA-N	0	3	330.472	3.200	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@H](N(C)Cc2ccc(OC)cc2)C1	ZINC001191913284	1367636591	/nfs/dbraw/zinc/63/65/91/1367636591.db2.gz	VRCGZSQLFDLLPN-AEFFLSMTSA-N	0	3	330.472	3.330	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H](N(C)CCOc2ccccc2F)C1	ZINC001191913335	1367636982	/nfs/dbraw/zinc/63/69/82/1367636982.db2.gz	WZJJJSOTMBHHAV-SJORKVTESA-N	0	3	348.462	3.340	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](N(C)Cc3cccc(OC)c3)C2)CCC1	ZINC001192218517	1367722399	/nfs/dbraw/zinc/72/23/99/1367722399.db2.gz	RCQDQGHTWXFWCY-GOSISDBHSA-N	0	3	342.483	3.474	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](N(C)CCOCC3CCC3)C2)CCC1	ZINC001192227845	1367725145	/nfs/dbraw/zinc/72/51/45/1367725145.db2.gz	VMKZNOAGUCNYFW-SFHVURJKSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](N(C)C[C@H](OC)c3ccccc3)C2)C1	ZINC001192257401	1367732162	/nfs/dbraw/zinc/73/21/62/1367732162.db2.gz	ODAABEMFVRWKNH-MOPGFXCFSA-N	0	3	342.483	3.263	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2C[C@H]1CCCCO1	ZINC001110595468	1367855810	/nfs/dbraw/zinc/85/58/10/1367855810.db2.gz	RNGDNIZUHDYZOR-MKXGPGLRSA-N	0	3	332.488	3.045	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](C)CCc1ccc(F)cc1)C2	ZINC001110645823	1367889023	/nfs/dbraw/zinc/88/90/23/1367889023.db2.gz	OAGBIWKMMMNSPK-OBZTUIKSSA-N	0	3	342.458	3.139	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1CN([C@H](CC)c2ccccc2)C[C@H]1O	ZINC001193241649	1367975374	/nfs/dbraw/zinc/97/53/74/1367975374.db2.gz	WQCBHSWAACKQQG-VAMGGRTRSA-N	0	3	342.483	3.067	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CC1CC(F)(F)C1	ZINC001110933138	1368103218	/nfs/dbraw/zinc/10/32/18/1368103218.db2.gz	HBOOQAVFRUYWIM-MIGQKNRLSA-N	0	3	326.431	3.356	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCCc1ccc(OC)cc1)C2	ZINC001110977938	1368131628	/nfs/dbraw/zinc/13/16/28/1368131628.db2.gz	IGMVAPKZYPQVBH-RLLQIKCJSA-N	0	3	342.483	3.316	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2oc3ccccc3c2C)C1	ZINC001193865402	1368133510	/nfs/dbraw/zinc/13/35/10/1368133510.db2.gz	NFOOWIPZTCYYCV-MRXNPFEDSA-N	0	3	342.439	3.090	20	30		EGEDHN
C=CCCCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1conc1CC)C2	ZINC001110990703	1368136738	/nfs/dbraw/zinc/13/67/38/1368136738.db2.gz	JPZRDVHNBMZLDX-OLMNPRSZSA-N	0	3	331.460	3.319	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)[C@H](CCC)c2ccccc2)C1	ZINC001193877896	1368137978	/nfs/dbraw/zinc/13/79/78/1368137978.db2.gz	JSNVXRDIRFGQQP-VQTJNVASSA-N	0	3	344.499	3.306	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C1(Cc3ccc(F)cc3)CC1)C2	ZINC001111114038	1368162215	/nfs/dbraw/zinc/16/22/15/1368162215.db2.gz	DSWGWQXKKRRHLU-QRVBRYPASA-N	0	3	342.458	3.446	20	30		EGEDHN
C=C[C@H](C(=O)N1CC[C@@H](N(C)CCOCC(C)C)C1)c1ccccc1	ZINC001194183474	1368202095	/nfs/dbraw/zinc/20/20/95/1368202095.db2.gz	PXLXQNGLNKRDDP-UXHICEINSA-N	0	3	344.499	3.162	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@H](N(C)CCOC3CCC3)C2)CCCCC1	ZINC001194367518	1368244968	/nfs/dbraw/zinc/24/49/68/1368244968.db2.gz	HXEFMDFGVAWRQV-SFHVURJKSA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@@H](N(C)CCOCC(C)C)C2)CCCCC1	ZINC001194381756	1368249488	/nfs/dbraw/zinc/24/94/88/1368249488.db2.gz	MWBFORNDVJPIOR-LJQANCHMSA-N	0	3	348.531	3.166	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C1CCC(C)(C)CC1)C2	ZINC001111477069	1368315946	/nfs/dbraw/zinc/31/59/46/1368315946.db2.gz	QLIBMRPFADUXNU-KURKYZTESA-N	0	3	334.504	3.127	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)C[C@H](NC(=O)CCC=C)c1ccccc1O2	ZINC001111529643	1368328781	/nfs/dbraw/zinc/32/87/81/1368328781.db2.gz	NNSOHYPQDHZLAC-RXVVDRJESA-N	0	3	338.451	3.060	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@](C)(F)CCCC)C[C@@H](C)O2	ZINC001111546120	1368339091	/nfs/dbraw/zinc/33/90/91/1368339091.db2.gz	XWWKZHDHLBGSII-AEFFLSMTSA-N	0	3	340.483	3.173	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@H](C)C(C)(C)C)C[C@H](C)O2	ZINC001111553074	1368344745	/nfs/dbraw/zinc/34/47/45/1368344745.db2.gz	UDEQSGCHMKWLGX-IRXDYDNUSA-N	0	3	336.520	3.327	20	30		EGEDHN
CC(C)(C)CC(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(C#N)cc1)C2	ZINC001111594204	1368359258	/nfs/dbraw/zinc/35/92/58/1368359258.db2.gz	YHZFLWTZNDDKHS-RXVVDRJESA-N	0	3	339.483	3.465	20	30		EGEDHN
C=CCOCC(=O)N[C@]12CCC[C@H]1CN([C@H](C)c1ccc(F)cc1)C2	ZINC001111662062	1368414868	/nfs/dbraw/zinc/41/48/68/1368414868.db2.gz	DLNJIADWIXKZMW-SYNHAJSKSA-N	0	3	346.446	3.060	20	30		EGEDHN
C=CCOCCCC(=O)N1CCCN([C@@H]2CCc3ccccc32)CC1	ZINC001195434843	1368436289	/nfs/dbraw/zinc/43/62/89/1368436289.db2.gz	SLDJAMCBFKVGKU-HXUWFJFHSA-N	0	3	342.483	3.191	20	30		EGEDHN
C#CCCCCC(=O)N1CCCN(CCCc2cccc(F)c2)CC1	ZINC001195540527	1368451945	/nfs/dbraw/zinc/45/19/45/1368451945.db2.gz	CRJNSFHMMMOELL-UHFFFAOYSA-N	0	3	344.474	3.486	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CCCN(C[C@@H]2CCC(F)(F)C2)CC1	ZINC001195785115	1368489230	/nfs/dbraw/zinc/48/92/30/1368489230.db2.gz	CQINZCGGMIOQOL-OAHLLOKOSA-N	0	3	326.431	3.006	20	30		EGEDHN
Cc1ccc(CCN2CCCN(C(=O)C#CC(C)(C)C)CC2)cc1	ZINC001195785598	1368489618	/nfs/dbraw/zinc/48/96/18/1368489618.db2.gz	QTWIARRFZNMVCR-UHFFFAOYSA-N	0	3	326.484	3.121	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CCCN(C[C@H]2CCC(F)(F)C2)CC1	ZINC001195785114	1368489715	/nfs/dbraw/zinc/48/97/15/1368489715.db2.gz	CQINZCGGMIOQOL-HNNXBMFYSA-N	0	3	326.431	3.006	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@]12CCC[C@H]1CN(Cc1cnccc1C)C2	ZINC001111850631	1368505173	/nfs/dbraw/zinc/50/51/73/1368505173.db2.gz	QVVXBBVDCAQVTJ-CUWPLCDZSA-N	0	3	341.499	3.463	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCCN(CCCOC(C)C)CC1	ZINC001195958090	1368522858	/nfs/dbraw/zinc/52/28/58/1368522858.db2.gz	OFILFRVTTIHFPG-UHFFFAOYSA-N	0	3	330.900	3.115	20	30		EGEDHN
C#CCCN1CCCN(C(=O)CCCc2ccccc2Cl)CC1	ZINC001196085383	1368545596	/nfs/dbraw/zinc/54/55/96/1368545596.db2.gz	JIRXGPAUHKBBFW-UHFFFAOYSA-N	0	3	332.875	3.220	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2ccc(N(C)C)nc2)CC1	ZINC001196401707	1368607301	/nfs/dbraw/zinc/60/73/01/1368607301.db2.gz	VJJHEGNMPJGKLS-UHFFFAOYSA-N	0	3	346.519	3.266	20	30		EGEDHN
C#CCN1C[C@@H]2CCC[C@]2(NC(=O)C[C@@H](C)CCc2ccccc2)C1	ZINC001112017657	1368621686	/nfs/dbraw/zinc/62/16/86/1368621686.db2.gz	OFQUZYLRONIUMC-VCOUNFBDSA-N	0	3	338.495	3.249	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C(F)(F)F)[C@H](NCC2=CCCCC2)C1	ZINC001112063397	1368641646	/nfs/dbraw/zinc/64/16/46/1368641646.db2.gz	CLVBEZSRIOIUBN-HUUCEWRRSA-N	0	3	330.394	3.432	20	30		EGEDHN
CC(C)CCC(=O)N1CC[C@H]([C@H](C)NCc2ccccc2C#N)C1	ZINC001325381658	1387956686	/nfs/dbraw/zinc/95/66/86/1387956686.db2.gz	VTMKRUKWFMMFQA-LPHOPBHVSA-N	0	3	327.472	3.321	20	30		EGEDHN
C=CC1(CC(=O)N[C@@H]2CN(CC/C=C/CCC)C[C@H]2O)CCCCC1	ZINC001196860506	1368702408	/nfs/dbraw/zinc/70/24/08/1368702408.db2.gz	KZTCTXWERNQSFI-LXORQPIJSA-N	0	3	348.531	3.421	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)[C@@H](C)CCC(C)(C)C)C[C@H]1C(F)(F)F	ZINC001112194238	1368707734	/nfs/dbraw/zinc/70/77/34/1368707734.db2.gz	USXIXFNYTSBDST-RRFJBIMHSA-N	0	3	346.437	3.451	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@H](F)CCCCCC)C[C@H]1C(F)(F)F	ZINC001112193977	1368707955	/nfs/dbraw/zinc/70/79/55/1368707955.db2.gz	FQEPZYVEGCBHBF-MGPQQGTHSA-N	0	3	338.389	3.460	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)[C@H](CCC)CC(C)C)C[C@H]1C(F)(F)F	ZINC001112213869	1368722206	/nfs/dbraw/zinc/72/22/06/1368722206.db2.gz	FTRPHWKDCSXTAE-BZUAXINKSA-N	0	3	346.437	3.451	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cccnc2OC)CC1	ZINC001197014115	1368730678	/nfs/dbraw/zinc/73/06/78/1368730678.db2.gz	BCIFVKILRIPYQK-UHFFFAOYSA-N	0	3	333.476	3.209	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2ccn(C(C)C)n2)CC1	ZINC001197300418	1368783331	/nfs/dbraw/zinc/78/33/31/1368783331.db2.gz	JLKGBVWSERKFQZ-UHFFFAOYSA-N	0	3	332.492	3.358	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H]2CCC[C@]2(CNCc2cc(C)no2)C1	ZINC001112375520	1368801531	/nfs/dbraw/zinc/80/15/31/1368801531.db2.gz	XBCMEZYHWAAJPM-LPHOPBHVSA-N	0	3	331.460	3.058	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2ccncc2C(F)(F)F)CC1	ZINC001197669936	1368869643	/nfs/dbraw/zinc/86/96/43/1368869643.db2.gz	VEQMZJRLPKUDJY-UHFFFAOYSA-N	0	3	341.377	3.215	20	30		EGEDHN
N#Cc1cccc(NC(=S)N2CCN(C3CCCCC3)CC2)c1	ZINC001197675026	1368870895	/nfs/dbraw/zinc/87/08/95/1368870895.db2.gz	KBHAKQGPUBOCJR-UHFFFAOYSA-N	0	3	328.485	3.205	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@H](F)CCCCCC)C1	ZINC001197776379	1368893877	/nfs/dbraw/zinc/89/38/77/1368893877.db2.gz	UUURTQGFJZVANC-KZNAEPCWSA-N	0	3	342.499	3.203	20	30		EGEDHN
C=CC[C@@H](C(=O)N1CCCN(CCC[C@@H](C)O)CC1)c1ccccc1	ZINC001198196294	1368977966	/nfs/dbraw/zinc/97/79/66/1368977966.db2.gz	AJFMQRFJDXAYBX-UYAOXDASSA-N	0	3	344.499	3.042	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)C2CCC(C3CC3)CC2)C1	ZINC001198247944	1368988993	/nfs/dbraw/zinc/98/89/93/1368988993.db2.gz	GPUDIZXOJIZDKR-NTFDOXNWSA-N	0	3	348.531	3.111	20	30		EGEDHN
C=CCCOCC(=O)N1CCCN([C@H](C)c2cccc(C)c2)CC1	ZINC001198337333	1369010757	/nfs/dbraw/zinc/01/07/57/1369010757.db2.gz	NFKVHNAETLUQOU-GOSISDBHSA-N	0	3	330.472	3.183	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N1CCCN(CCCc2ccc(C)cc2)CC1	ZINC001198343730	1369012920	/nfs/dbraw/zinc/01/29/20/1369012920.db2.gz	MVXDXDRTQYWRHP-LJQANCHMSA-N	0	3	344.499	3.053	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N1CCCN([C@H](C)c2cc(C)ccc2C)CC1	ZINC001198344204	1369012937	/nfs/dbraw/zinc/01/29/37/1369012937.db2.gz	RDFJUVBVETZANR-RTBURBONSA-N	0	3	344.499	3.490	20	30		EGEDHN
C=CCCN1CCCN(C(=O)[C@@H](OC(C)C)c2ccccc2)CC1	ZINC001198433694	1369031943	/nfs/dbraw/zinc/03/19/43/1369031943.db2.gz	QWEBBUNEJFMKFA-IBGZPJMESA-N	0	3	330.472	3.263	20	30		EGEDHN
C=CCC[C@@H](C)N[C@@H](CNC(=O)C(C)(F)F)c1ccccc1OC	ZINC001198482538	1369042003	/nfs/dbraw/zinc/04/20/03/1369042003.db2.gz	PXVSPASPSOMCOW-HIFRSBDPSA-N	0	3	340.414	3.452	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)c1cccnc1)c1ccccc1OC	ZINC001198493234	1369044859	/nfs/dbraw/zinc/04/48/59/1369044859.db2.gz	ZEUBPQHCGDPZQQ-SFHVURJKSA-N	0	3	339.439	3.117	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)c1ccco1)c1ccccc1OC	ZINC001198498688	1369045810	/nfs/dbraw/zinc/04/58/10/1369045810.db2.gz	AGRQEQSLPZWCOE-MRXNPFEDSA-N	0	3	328.412	3.315	20	30		EGEDHN
C=CCC[C@H](C)N[C@@H](CNC(=O)c1ccc[nH]1)c1ccccc1OC	ZINC001198523398	1369052804	/nfs/dbraw/zinc/05/28/04/1369052804.db2.gz	XMJMPKWUXVHYMC-YJBOKZPZSA-N	0	3	341.455	3.439	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)c1cccc(C)n1)c1ccccc1OC	ZINC001198542879	1369057555	/nfs/dbraw/zinc/05/75/55/1369057555.db2.gz	NZGWWWQMBUFTRF-GOSISDBHSA-N	0	3	339.439	3.035	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)c1scnc1C)c1ccccc1OC	ZINC001198567232	1369061757	/nfs/dbraw/zinc/06/17/57/1369061757.db2.gz	NTFLORJPYLLHOI-OAHLLOKOSA-N	0	3	345.468	3.097	20	30		EGEDHN
C=CCCCCCN[C@@H](CNC(=O)[C@@H](C)OC)c1ccccc1OC	ZINC001198577749	1369064588	/nfs/dbraw/zinc/06/45/88/1369064588.db2.gz	LQPZYUDZYTYMDV-AEFFLSMTSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)/C=C(/C)C1CC1)c1ccccc1OC	ZINC001198578007	1369065177	/nfs/dbraw/zinc/06/51/77/1369065177.db2.gz	MOCQXQAVBXGKLS-XXTMNZORSA-N	0	3	328.456	3.375	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)CCCCOC)c1ccccc1OC	ZINC001198595293	1369069048	/nfs/dbraw/zinc/06/90/48/1369069048.db2.gz	JQCJDFIAZGUHRO-SFHVURJKSA-N	0	3	348.487	3.225	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC[C@@H](NCC(C)C)c1ccccc1OC	ZINC001198596597	1369069280	/nfs/dbraw/zinc/06/92/80/1369069280.db2.gz	SRWQJEVYIJYIQM-FUHWJXTLSA-N	0	3	348.487	3.079	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)CCc1ccoc1)c1ccccc1OC	ZINC001198655387	1369083146	/nfs/dbraw/zinc/08/31/46/1369083146.db2.gz	DDBPFLAUYWOSSU-SFHVURJKSA-N	0	3	342.439	3.244	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CCN(CC2CCCCCC2)CC1)OCC	ZINC001112906461	1369084608	/nfs/dbraw/zinc/08/46/08/1369084608.db2.gz	DJCKPWVVRKMKEJ-IBGZPJMESA-N	0	3	336.520	3.472	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)C1CC(C)(C)C1)c1ccccc1OC	ZINC001198705299	1369095494	/nfs/dbraw/zinc/09/54/94/1369095494.db2.gz	PYRBXNMVHBQQDZ-QGZVFWFLSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H](NCCCCOC)c1ccccc1OC	ZINC001198751941	1369105201	/nfs/dbraw/zinc/10/52/01/1369105201.db2.gz	KZTZLRDOXVMIJB-GOSISDBHSA-N	0	3	348.487	3.225	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NC[C@H](NC(C)C)c1ccccc1OC)OCC	ZINC001198751907	1369105710	/nfs/dbraw/zinc/10/57/10/1369105710.db2.gz	KMKCWUOCGNEZIV-PKOBYXMFSA-N	0	3	348.487	3.222	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)c1[nH]c(C)cc1C)c1ccccc1OC	ZINC001198776020	1369111187	/nfs/dbraw/zinc/11/11/87/1369111187.db2.gz	LSQPTDWCFROROX-QGZVFWFLSA-N	0	3	341.455	3.277	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)[C@H](OC)C(C)C)c1ccccc1OC	ZINC001198876363	1369137190	/nfs/dbraw/zinc/13/71/90/1369137190.db2.gz	RXJBYGDOLWXLJR-PKOBYXMFSA-N	0	3	348.487	3.079	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)C[C@H](C)C1CC1)c1ccccc1OC	ZINC001198992523	1369167001	/nfs/dbraw/zinc/16/70/01/1369167001.db2.gz	BVHRTFAQEBDNGK-YJBOKZPZSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)[C@@H](C)CCOC)c1ccccc1OC	ZINC001198994388	1369168374	/nfs/dbraw/zinc/16/83/74/1369168374.db2.gz	YCPPSQJXBBBADW-WMZOPIPTSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)Cc2ccc3cnccc3c2)CC1	ZINC001113095651	1369199051	/nfs/dbraw/zinc/19/90/51/1369199051.db2.gz	XRPJXGFGUMRIQM-QGZVFWFLSA-N	0	3	337.467	3.276	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N1CCN(CC2CCCCCC2)CC1	ZINC001113164483	1369237531	/nfs/dbraw/zinc/23/75/31/1369237531.db2.gz	PTBYOKRWXGKRDV-HXUWFJFHSA-N	0	3	336.520	3.330	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N1CCN(CC2CCC(C)CC2)CC1	ZINC001113164751	1369237649	/nfs/dbraw/zinc/23/76/49/1369237649.db2.gz	YOBABGIROBDISY-QLOJAFMTSA-N	0	3	336.520	3.186	20	30		EGEDHN
CC[C@@H](C)CC(=O)N1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001200273919	1369340169	/nfs/dbraw/zinc/34/01/69/1369340169.db2.gz	WYDYLURAWOIMJE-CQSZACIVSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=C(C)CCC(=O)N1CCCO[C@H](CN[C@H](C)c2ccccc2F)C1	ZINC001200621463	1369401474	/nfs/dbraw/zinc/40/14/74/1369401474.db2.gz	JAISOEZWSCSBLY-IAGOWNOFSA-N	0	3	348.462	3.450	20	30		EGEDHN
CC[C@@H](CC(F)F)C(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001201002618	1369465122	/nfs/dbraw/zinc/46/51/22/1369465122.db2.gz	RWCKFODOIKZENQ-AWEZNQCLSA-N	0	3	349.425	3.320	20	30		EGEDHN
C#CCNC[C@H]1CN(C(=O)[C@@H](CCC)CC2CCCCC2)CCCO1	ZINC001201548748	1369573281	/nfs/dbraw/zinc/57/32/81/1369573281.db2.gz	ZDLKKJJVPQKNMB-PMACEKPBSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=CCC1(C(=O)N2CCCO[C@@H](CNC[C@@H](F)CC)C2)CCCC1	ZINC001202243627	1369722067	/nfs/dbraw/zinc/72/20/67/1369722067.db2.gz	OSTKBVVQWGSKEB-IRXDYDNUSA-N	0	3	340.483	3.078	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1[C@H]2CN(Cc3cc4ccccc4o3)C[C@H]21	ZINC001114159280	1369768559	/nfs/dbraw/zinc/76/85/59/1369768559.db2.gz	CAWAOQFKXPHZOL-WGMWDUQUSA-N	0	3	336.435	3.173	20	30		EGEDHN
CC(C)C(=O)N[C@H]1C[C@H](NCC#Cc2ccc(Cl)cc2)C12CCC2	ZINC001202460552	1369778401	/nfs/dbraw/zinc/77/84/01/1369778401.db2.gz	VYVWWXYSGXDYJB-ROUUACIJSA-N	0	3	344.886	3.365	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@@H](NCc2c(C)onc2CC)C12CCC2	ZINC001202589080	1369814999	/nfs/dbraw/zinc/81/49/99/1369814999.db2.gz	BBZJTPKIPPHICL-SJORKVTESA-N	0	3	331.460	3.029	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@H](NCc2cccc(Cl)n2)C12CCC2	ZINC001202592685	1369816257	/nfs/dbraw/zinc/81/62/57/1369816257.db2.gz	VTTKZTQGNXKIDN-LSDHHAIUSA-N	0	3	333.863	3.218	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@H](NCc2oc(CC)nc2C)C12CCC2	ZINC001202615954	1369824992	/nfs/dbraw/zinc/82/49/92/1369824992.db2.gz	CCRLXLQYGDXSAL-JKSUJKDBSA-N	0	3	331.460	3.029	20	30		EGEDHN
CCCC[C@@H](CNc1cccc(F)c1C#N)NC(=O)CN(C)C(C)C	ZINC001114266116	1369838795	/nfs/dbraw/zinc/83/87/95/1369838795.db2.gz	YZMRPGBZXLPWMO-HNNXBMFYSA-N	0	3	348.466	3.124	20	30		EGEDHN
C/C=C(\C)C(=O)N[C@@H]1C[C@@H](NCC#Cc2ccc(F)cc2)C12CCC2	ZINC001202722841	1369866916	/nfs/dbraw/zinc/86/69/16/1369866916.db2.gz	BZNAYAZJFXQYGS-MNZAMAJESA-N	0	3	340.442	3.160	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1[C@H]2CN(CCCCC(F)(F)F)C[C@H]21	ZINC001114340926	1369901146	/nfs/dbraw/zinc/90/11/46/1369901146.db2.gz	OXVGDSQHLARKND-NHAGDIPZSA-N	0	3	332.410	3.368	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1[C@H]2CN(CCOc3ccccc3C)C[C@H]21	ZINC001114340533	1369901213	/nfs/dbraw/zinc/90/12/13/1369901213.db2.gz	HZSVKTKANPZMGD-YRWFTTLQSA-N	0	3	342.483	3.023	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@@H](NC(=O)/C=C(\C)CC)C12CCC2	ZINC001202846323	1369906787	/nfs/dbraw/zinc/90/67/87/1369906787.db2.gz	JTOJZEQFLLXNRY-DVFZLIDBSA-N	0	3	341.293	3.268	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1C[C@H](NCc2conc2CC)C12CCC2	ZINC001202986149	1369946055	/nfs/dbraw/zinc/94/60/55/1369946055.db2.gz	GYPZWGXKOUCNBX-IRXDYDNUSA-N	0	3	331.460	3.110	20	30		EGEDHN
O=C(N[C@@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2)C1(C2CC2)CC1	ZINC001203050912	1369966930	/nfs/dbraw/zinc/96/69/30/1369966930.db2.gz	HFBSBJYFLHCWGA-WOJBJXKFSA-N	0	3	348.490	3.245	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1C[C@H](NCc2oc(C)nc2C)C12CCC2	ZINC001203257582	1370044724	/nfs/dbraw/zinc/04/47/24/1370044724.db2.gz	NGCYPBDXDXJDNO-IRXDYDNUSA-N	0	3	345.487	3.411	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(F)cc3C)C[C@H]21	ZINC001114725164	1370046945	/nfs/dbraw/zinc/04/69/45/1370046945.db2.gz	ZXUVUHSNOGJHRW-WQANXHIZSA-N	0	3	330.447	3.283	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1C[C@H](NCc2ncccc2C)C12CCC2	ZINC001203273515	1370054296	/nfs/dbraw/zinc/05/42/96/1370054296.db2.gz	IWJNUXKIHCYAEP-IRXDYDNUSA-N	0	3	327.472	3.119	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1C[C@@H](NCc2c(C)noc2C)C12CCC2	ZINC001203274307	1370054757	/nfs/dbraw/zinc/05/47/57/1370054757.db2.gz	MYPUSRSMHPHMLL-QZTJIDSGSA-N	0	3	343.471	3.002	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1C[C@H](NCc2c(C)noc2CC)C12CCC2	ZINC001203281515	1370060238	/nfs/dbraw/zinc/06/02/38/1370060238.db2.gz	PWEKYJAPMYOATE-IRXDYDNUSA-N	0	3	345.487	3.275	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1C[C@@H](NCc2ocnc2C)C12CCC2	ZINC001203297035	1370070313	/nfs/dbraw/zinc/07/03/13/1370070313.db2.gz	WNWNONDXOQTBQJ-MSOLQXFVSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=CCCC1(C(=O)NC2[C@H]3CN(C/C=C/c4ccccc4)C[C@@H]23)CC1	ZINC001114777113	1370074479	/nfs/dbraw/zinc/07/44/79/1370074479.db2.gz	XNVCIKAROQIUAW-XZRXLXLESA-N	0	3	336.479	3.493	20	30		EGEDHN
CC1(C(=O)N[C@H]2C[C@@H](NCC#Cc3ccccc3)C23CCC3)CC=CC1	ZINC001203341518	1370089714	/nfs/dbraw/zinc/08/97/14/1370089714.db2.gz	RMRUZPOONWACAW-UXHICEINSA-N	0	3	348.490	3.411	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3ccccc3OCC)C2)C1=O	ZINC001203536779	1370160489	/nfs/dbraw/zinc/16/04/89/1370160489.db2.gz	HZCXHMIIJGNNDL-HXUWFJFHSA-N	0	3	328.456	3.086	20	30		EGEDHN
C=CCO[C@H]1CO[C@@]2(C1)CCCN(Cc1ccccc1OCC)C2	ZINC001203542259	1370162212	/nfs/dbraw/zinc/16/22/12/1370162212.db2.gz	JUWDQASZRBAIJL-UYAOXDASSA-N	0	3	331.456	3.411	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN2Cc3ccccc3C3(CCC3)C2)cc1	ZINC001325873752	1388059137	/nfs/dbraw/zinc/05/91/37/1388059137.db2.gz	IIKBEJURVQQNJQ-LJQANCHMSA-N	0	3	348.446	3.235	20	30		EGEDHN
N#Cc1cccc(N2C[C@]3(CCN(Cc4cccc(F)c4)C3)CC2=O)c1	ZINC001203786711	1370264142	/nfs/dbraw/zinc/26/41/42/1370264142.db2.gz	OBKRBFBJCJAZDN-OAQYLSRUSA-N	0	3	349.409	3.326	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001203899848	1370305640	/nfs/dbraw/zinc/30/56/40/1370305640.db2.gz	DTFVIEXCRYBYSW-UHFFFAOYSA-N	0	3	327.428	3.001	20	30		EGEDHN
C=CCOc1ccc(CN2CCC(N(C(C)=O)C(C)C)CC2)cc1	ZINC001204303048	1370438116	/nfs/dbraw/zinc/43/81/16/1370438116.db2.gz	XPPKCFWHLXGLTD-UHFFFAOYSA-N	0	3	330.472	3.473	20	30		EGEDHN
CCCCCCCCOc1ccc(CN2C[C@@H](O)[C@H](CO)C2)cc1	ZINC001204311952	1370440077	/nfs/dbraw/zinc/44/00/77/1370440077.db2.gz	NAFXEBDNUGRXTE-AZUAARDMSA-N	0	3	335.488	3.211	20	30		EGEDHN
CC[C@H](C)C(=O)NCC1(NCC#Cc2ccccc2)CCCCC1	ZINC001115414506	1370443085	/nfs/dbraw/zinc/44/30/85/1370443085.db2.gz	YOLSHGZDNUQMMQ-SFHVURJKSA-N	0	3	326.484	3.493	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CC[C@H]2CN(Cc3cccc(C)c3)C[C@H]21	ZINC001187216780	1388074750	/nfs/dbraw/zinc/07/47/50/1388074750.db2.gz	GQANPTINPXZABD-YSIASYRMSA-N	0	3	342.483	3.009	20	30		EGEDHN
O=C(NCC1(NCC#Cc2ccccc2)CCCCC1)[C@@H]1CC1(F)F	ZINC001115522376	1370521748	/nfs/dbraw/zinc/52/17/48/1370521748.db2.gz	OVHSVRCPHSSEFD-KRWDZBQOSA-N	0	3	346.421	3.102	20	30		EGEDHN
CC(C)(C)C#CC(=O)NCC1(NCc2cncc(F)c2)CCCCC1	ZINC001115528408	1370526829	/nfs/dbraw/zinc/52/68/29/1370526829.db2.gz	MLYCBHQGBGKTBD-UHFFFAOYSA-N	0	3	345.462	3.179	20	30		EGEDHN
Cc1ccc(F)c(CNC2(CNC(=O)C#CC3CC3)CCCCC2)c1	ZINC001115528613	1370527595	/nfs/dbraw/zinc/52/75/95/1370527595.db2.gz	UDNVJSINFMSZQA-UHFFFAOYSA-N	0	3	342.458	3.456	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H]2CCCO[C@H]2CC)CCCCC1	ZINC001115567508	1370567878	/nfs/dbraw/zinc/56/78/78/1370567878.db2.gz	KBLZVVVGIFMIRM-CVEARBPZSA-N	0	3	342.911	3.353	20	30		EGEDHN
CN1CCN(Cc2ccc(Nc3c(F)ccc(F)c3C#N)cc2)CC1	ZINC001204765646	1370571256	/nfs/dbraw/zinc/57/12/56/1370571256.db2.gz	KBINKMLBZDMYMX-UHFFFAOYSA-N	0	3	342.393	3.327	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCC1(NCc2conc2C)CCCCC1	ZINC001115684620	1370667137	/nfs/dbraw/zinc/66/71/37/1370667137.db2.gz	BFEOORKOYUCZDA-MRXNPFEDSA-N	0	3	333.476	3.494	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCC1(NCc2cc(C)ncn2)CCCCC1	ZINC001115684970	1370667929	/nfs/dbraw/zinc/66/79/29/1370667929.db2.gz	OZRJODSNPRAJIQ-QGZVFWFLSA-N	0	3	344.503	3.296	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC2(NCc3ccns3)CCCCC2)C1	ZINC001115723220	1370701917	/nfs/dbraw/zinc/70/19/17/1370701917.db2.gz	DXOBMVFRGFQEBU-UHFFFAOYSA-N	0	3	333.501	3.408	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccn(C)c2CC)CCCCC1	ZINC001115729834	1370712112	/nfs/dbraw/zinc/71/21/12/1370712112.db2.gz	UROSTIOJNSYXJX-UHFFFAOYSA-N	0	3	337.895	3.362	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2cccs2)C[C@H]1c1cccc(F)c1	ZINC001205349385	1370729363	/nfs/dbraw/zinc/72/93/63/1370729363.db2.gz	DDWRNSWCESVVAB-DLBZAZTESA-N	0	3	342.439	3.108	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](c2cccc(F)c2)[C@H](NC[C@@H](F)CC)C1	ZINC001205406063	1370746019	/nfs/dbraw/zinc/74/60/19/1370746019.db2.gz	CUODZBCSFZSGTR-YTQUADARSA-N	0	3	348.437	3.261	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](c2cccc(F)c2)[C@H](NCC#CC)C1	ZINC001205429271	1370752464	/nfs/dbraw/zinc/75/24/64/1370752464.db2.gz	SVPXDPBAZVXLEF-FFZOFVMBSA-N	0	3	342.458	3.335	20	30		EGEDHN
COC(=O)N1CCC2(CCN(Cc3ccc(F)c(C#N)c3)CC2)CC1	ZINC001205455877	1370760775	/nfs/dbraw/zinc/76/07/75/1370760775.db2.gz	XXRXDDMIGATSNA-UHFFFAOYSA-N	0	3	345.418	3.142	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2nc(C)oc2C)CCCCC1	ZINC001115787169	1370769767	/nfs/dbraw/zinc/76/97/67/1370769767.db2.gz	NEOYECKHHXKVOL-UHFFFAOYSA-N	0	3	325.840	3.066	20	30		EGEDHN
C[NH+](C)[C@@H]1CCCC[C@@H]1/N=C/c1cc(Br)ccc1[O-]	ZINC001116024305	1370821289	/nfs/dbraw/zinc/82/12/89/1370821289.db2.gz	PWKCGVCBTBQLEP-KQLQBFTNSA-N	0	3	325.250	3.446	20	30		EGEDHN
CC#CCCCC(=O)N1CCC(CNC/C(Cl)=C/Cl)CC1	ZINC001205970210	1370925346	/nfs/dbraw/zinc/92/53/46/1370925346.db2.gz	MXPVACDBPMZXOK-PTNGSMBKSA-N	0	3	331.287	3.327	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC(CNCc2oc(C)nc2C)CC1	ZINC001205988300	1370930935	/nfs/dbraw/zinc/93/09/35/1370930935.db2.gz	DSNJTKSJIPGKPV-INIZCTEOSA-N	0	3	333.476	3.222	20	30		EGEDHN
Cc1ccc(CN2CCCN(c3c(C#N)cccc3C#N)CC2)cc1	ZINC001116797264	1370976940	/nfs/dbraw/zinc/97/69/40/1370976940.db2.gz	CZYGOXUXDKDTLD-UHFFFAOYSA-N	0	3	330.435	3.451	20	30		EGEDHN
C=CCO[C@H]1CO[C@@]2(C1)CCCN(Cc1ccc(C)cc1OC)C2	ZINC001206762657	1371156850	/nfs/dbraw/zinc/15/68/50/1371156850.db2.gz	OJECNWDTIBUFQJ-UYAOXDASSA-N	0	3	331.456	3.330	20	30		EGEDHN
O=C(c1cccs1)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207136303	1371305755	/nfs/dbraw/zinc/30/57/55/1371305755.db2.gz	QQJYMPQFPOYVFA-KRWDZBQOSA-N	0	3	342.439	3.133	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207167076	1371316823	/nfs/dbraw/zinc/31/68/23/1371316823.db2.gz	HKEVFYRZFSKAAD-SFHVURJKSA-N	0	3	330.859	3.238	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H]2CN(CCc3ccccc3F)C[C@H]21	ZINC001187591917	1388129024	/nfs/dbraw/zinc/12/90/24/1388129024.db2.gz	YSTYGAWWZWMEAK-AZUAARDMSA-N	0	3	342.458	3.095	20	30		EGEDHN
CC/C=C(\C)C(=O)N1CCC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001207565109	1371436818	/nfs/dbraw/zinc/43/68/18/1371436818.db2.gz	GIDYCUPUGYZWDL-DRESWSQNSA-N	0	3	329.419	3.134	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1CCC[C@H](NCc2cc(C#N)ccc2OC)C1	ZINC001207718530	1371485593	/nfs/dbraw/zinc/48/55/93/1371485593.db2.gz	RNGDAGQEDZOWNX-QAPCUYQASA-N	0	3	343.471	3.084	20	30		EGEDHN
O=C(/C=C/C1CC1)N1CCC[C@@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207741742	1371490566	/nfs/dbraw/zinc/49/05/66/1371490566.db2.gz	PHRYWWUVGXNHLZ-VSRDTVRMSA-N	0	3	342.870	3.238	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H](NCC#Cc2ccc(Cl)cc2)C1)C1CC1	ZINC001207753956	1371495301	/nfs/dbraw/zinc/49/53/01/1371495301.db2.gz	GVMLUAKRHKECJK-BEFAXECRSA-N	0	3	344.886	3.318	20	30		EGEDHN
O=C(CCC1CCC1)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207758763	1371495756	/nfs/dbraw/zinc/49/57/56/1371495756.db2.gz	GTJDOPQLOUSOMK-HXUWFJFHSA-N	0	3	342.458	3.338	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207764000	1371497704	/nfs/dbraw/zinc/49/77/04/1371497704.db2.gz	JNLBXKUDIRWYMW-VSEHZYKHSA-N	0	3	330.859	3.238	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N1CCC[C@@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207819276	1371512100	/nfs/dbraw/zinc/51/21/00/1371512100.db2.gz	HPPBTDJPFAYEAS-MSOLQXFVSA-N	0	3	344.886	3.318	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)C#CC(C)(C)C)C1	ZINC001120372802	1371552550	/nfs/dbraw/zinc/55/25/50/1371552550.db2.gz	JFKIHEHGEBWYDI-IAGOWNOFSA-N	0	3	336.907	3.491	20	30		EGEDHN
CCCC[C@@H](C)C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001207979907	1371559258	/nfs/dbraw/zinc/55/92/58/1371559258.db2.gz	PRZUUEWIVMJTHK-UYAOXDASSA-N	0	3	326.484	3.445	20	30		EGEDHN
CC/C(C)=C\C(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001208002981	1371564761	/nfs/dbraw/zinc/56/47/61/1371564761.db2.gz	ZYQUEMRBBUNTHT-VDUFWMCCSA-N	0	3	328.431	3.114	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N2CCC[C@H](NC[C@@H](F)CC)C2)cc1	ZINC001208029251	1371574051	/nfs/dbraw/zinc/57/40/51/1371574051.db2.gz	RQZGWSYMZRIUSP-ROUUACIJSA-N	0	3	346.446	3.031	20	30		EGEDHN
C=C(C)[C@@H]1CC=C(CN2CCC[C@H](OCC(=O)N(C)CC)C2)CC1	ZINC001208178545	1371621172	/nfs/dbraw/zinc/62/11/72/1371621172.db2.gz	JNGBQIXHDDWKLY-MOPGFXCFSA-N	0	3	334.504	3.248	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1CN(Cc2ccc(OC)cc2)C[C@H]1C	ZINC001208315152	1371712682	/nfs/dbraw/zinc/71/26/82/1371712682.db2.gz	MPFVZXQCVZVXEW-YLJYHZDGSA-N	0	3	342.483	3.215	20	30		EGEDHN
C/C(=C\C(=O)NC1CC2(CC(NCc3ccccc3C#N)C2)C1)C1CC1	ZINC001120725039	1371729181	/nfs/dbraw/zinc/72/91/81/1371729181.db2.gz	MUJXJCLWLUKKGM-OVCLIPMQSA-N	0	3	349.478	3.432	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CN(Cc2cccc(CC)c2)C[C@H]1C	ZINC001208371080	1371740379	/nfs/dbraw/zinc/74/03/79/1371740379.db2.gz	DTVGDWIZHGTXAJ-YLJYHZDGSA-N	0	3	326.484	3.379	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CN([C@H]2CCc3ccc(F)cc32)C[C@H]1C	ZINC001208374438	1371742058	/nfs/dbraw/zinc/74/20/58/1371742058.db2.gz	JIEKRHBEJBASSS-YSGRDPCXSA-N	0	3	342.458	3.443	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)CCc1ccsc1)C2	ZINC001121238139	1371903972	/nfs/dbraw/zinc/90/39/72/1371903972.db2.gz	IYKSMUBZKKEQEF-UHFFFAOYSA-N	0	3	338.904	3.450	20	30		EGEDHN
CC1(C(=O)N2CCC[C@H](NCC#Cc3ccc(F)cc3)C2)CCCC1	ZINC001208818273	1371905013	/nfs/dbraw/zinc/90/50/13/1371905013.db2.gz	WRSREXSFXCGALJ-IBGZPJMESA-N	0	3	342.458	3.338	20	30		EGEDHN
COc1ccccc1CCCN1CCN(c2cccc(C#N)c2)CC1	ZINC001208841932	1371914221	/nfs/dbraw/zinc/91/42/21/1371914221.db2.gz	QMWUVISPCCIBNO-UHFFFAOYSA-N	0	3	335.451	3.322	20	30		EGEDHN
N#Cc1cccc(CCCN2CCN3CCc4ccccc4[C@H]3C2)c1	ZINC001208851428	1371918031	/nfs/dbraw/zinc/91/80/31/1371918031.db2.gz	YQZZARCHBIVTSG-JOCHJYFZSA-N	0	3	331.463	3.406	20	30		EGEDHN
C[C@H]1CC[C@H](NC(=O)OC(C)(C)C)CN1CCc1ccc(C#N)cc1	ZINC001208927664	1371948151	/nfs/dbraw/zinc/94/81/51/1371948151.db2.gz	NYGYRWFHKCDUKO-YJBOKZPZSA-N	0	3	343.471	3.478	20	30		EGEDHN
CO[C@@H](CN1CCN(CCc2ccc(C#N)cc2)CC1)c1ccccc1	ZINC001208929551	1371949535	/nfs/dbraw/zinc/94/95/35/1371949535.db2.gz	QSQHFMWHEPCJJP-QFIPXVFZSA-N	0	3	349.478	3.106	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCCN(C(=O)CCCC3CC3)C2)cc1F	ZINC001209145190	1372013249	/nfs/dbraw/zinc/01/32/49/1372013249.db2.gz	CDKNIMHQCHXFAT-SFHVURJKSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC[C@H](NCc2ccnc(Cl)c2)C1	ZINC001209145740	1372014282	/nfs/dbraw/zinc/01/42/82/1372014282.db2.gz	HBBFCJIUMACNIZ-HOCLYGCPSA-N	0	3	335.879	3.418	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@H](NCc2cc(CO)ccc2F)C1	ZINC001209182229	1372026561	/nfs/dbraw/zinc/02/65/61/1372026561.db2.gz	BHSXORABUNPYTK-MAUKXSAKSA-N	0	3	348.462	3.001	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC1CC2(C1)CC(N[C@@H](C)c1cnccn1)C2	ZINC001121616661	1372026765	/nfs/dbraw/zinc/02/67/65/1372026765.db2.gz	NUWUVFOLVGZHDJ-IKJBTNJWSA-N	0	3	342.487	3.157	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC1CC2(CC(NCc3ocnc3C)C2)C1	ZINC001121714131	1372057161	/nfs/dbraw/zinc/05/71/61/1372057161.db2.gz	WDBNXMFLOWLRTK-LZUQWOSISA-N	0	3	331.460	3.102	20	30		EGEDHN
CCc1ccoc1C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001209465164	1372112896	/nfs/dbraw/zinc/11/28/96/1372112896.db2.gz	NZAMKEYGLMCAPY-IBGZPJMESA-N	0	3	336.435	3.088	20	30		EGEDHN
CC(F)(F)C1(C(=O)N2CCC[C@@H](NCC#Cc3ccccc3)C2)CC1	ZINC001209668123	1372166152	/nfs/dbraw/zinc/16/61/52/1372166152.db2.gz	BLMWRHQCHJZOQH-QGZVFWFLSA-N	0	3	346.421	3.054	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001209707966	1372175522	/nfs/dbraw/zinc/17/55/22/1372175522.db2.gz	KZBOTTFMUFDZFA-BPQIPLTHSA-N	0	3	344.886	3.318	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)CC[C@H]1CC[C@H](C)O1)C2	ZINC001122219479	1372204123	/nfs/dbraw/zinc/20/41/23/1372204123.db2.gz	GVEJCCQLXSZMFJ-AILYUCJNSA-N	0	3	340.895	3.104	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)[C@H](C)OCCC(C)C)C2	ZINC001122275302	1372219774	/nfs/dbraw/zinc/21/97/74/1372219774.db2.gz	YTKUHZJXXKIEOD-JFPDKAJLSA-N	0	3	342.911	3.207	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)[C@H]1CCOC(C)(C)C1)c1ccccc1	ZINC001122898323	1372338400	/nfs/dbraw/zinc/33/84/00/1372338400.db2.gz	UTIKOSLXLHYXPZ-BBWFWOEESA-N	0	3	342.439	3.168	20	30		EGEDHN
CCCCCCCCCC(=O)N1CCC[C@@H](NCc2n[nH]c(C)n2)C1	ZINC001210823959	1372433584	/nfs/dbraw/zinc/43/35/84/1372433584.db2.gz	HAINKFVUSMKKAF-QGZVFWFLSA-N	0	3	349.523	3.334	20	30		EGEDHN
O=C(C1CCC=CCC1)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001211112813	1372486909	/nfs/dbraw/zinc/48/69/09/1372486909.db2.gz	MKVKVEKVZWVGNY-NRFANRHFSA-N	0	3	336.479	3.365	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N2CCC[C@@H](NC[C@H](F)CC)C2)cc1	ZINC001211321198	1372530557	/nfs/dbraw/zinc/53/05/57/1372530557.db2.gz	MLUZQLNPCVDEFY-QZTJIDSGSA-N	0	3	348.462	3.123	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N[C@@H]1CN(Cc2ccc(C(C)C)cc2)C[C@H]1C	ZINC001211426109	1372556426	/nfs/dbraw/zinc/55/64/26/1372556426.db2.gz	ZDSHFUDMKRGPRL-FUHIMQAGSA-N	0	3	344.499	3.338	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C[C@H](C)CCC)C[C@H]1c1ccccc1	ZINC001211555737	1372580062	/nfs/dbraw/zinc/58/00/62/1372580062.db2.gz	ZIJVTQKIYQSANI-YZGWKJHDSA-N	0	3	326.484	3.420	20	30		EGEDHN
C=CC[C@H](C(=O)N1CC[C@@H](NCc2cncc(C)c2)C1)c1ccccc1	ZINC001188001728	1388209641	/nfs/dbraw/zinc/20/96/41/1388209641.db2.gz	KGAZVPSGAXYMHH-RTWAWAEBSA-N	0	3	349.478	3.440	20	30		EGEDHN
C=C(CCc1nc(-c2ccc3c(n2)CCNC3)no1)c1ccccc1	ZINC001211694553	1372603198	/nfs/dbraw/zinc/60/31/98/1372603198.db2.gz	RBWZWPMBRNYRPG-UHFFFAOYSA-N	0	3	332.407	3.423	20	30		EGEDHN
C=CC[C@H](C(=O)N1CC[C@@H](NCc2cnccc2C)C1)c1ccccc1	ZINC001188001707	1388210033	/nfs/dbraw/zinc/21/00/33/1388210033.db2.gz	JSFDJOWYJAUOKQ-RTWAWAEBSA-N	0	3	349.478	3.440	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2cc(C)oc2C)[C@H](OC)C1	ZINC001211838414	1372619873	/nfs/dbraw/zinc/61/98/73/1372619873.db2.gz	SCLJWEGNZGXQES-QZTJIDSGSA-N	0	3	336.476	3.296	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@H]2CCC(F)(F)C2)[C@H](OC)C1	ZINC001212377360	1372696497	/nfs/dbraw/zinc/69/64/97/1372696497.db2.gz	HSPMUHKCDOLITN-ARFHVFGLSA-N	0	3	346.462	3.208	20	30		EGEDHN
C=CCOCCCC(=O)NCCNCc1ccc(Cl)c(Cl)c1	ZINC001125256394	1372764298	/nfs/dbraw/zinc/76/42/98/1372764298.db2.gz	VPNNROYCBITAHV-UHFFFAOYSA-N	0	3	345.270	3.182	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@@H]2CC[C@@H]3C[C@@H]3CC2)[C@H](OC)C1	ZINC001213201723	1372859309	/nfs/dbraw/zinc/85/93/09/1372859309.db2.gz	WCHNTYWFWXEXKQ-OUUBHVDSSA-N	0	3	348.531	3.375	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CN(CCC2=CCCCC2)C[C@H]1OC	ZINC001213320269	1372883435	/nfs/dbraw/zinc/88/34/35/1372883435.db2.gz	QOVLSEAVMWOHKQ-BHIYHBOVSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2ccc(C)cc2)[C@H](OC)C1	ZINC001213771269	1372959490	/nfs/dbraw/zinc/95/94/90/1372959490.db2.gz	XMPMXLWRQOAZMK-RTBURBONSA-N	0	3	330.472	3.170	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2cc(C)ccc2C)[C@H](OC)C1	ZINC001213776797	1372959911	/nfs/dbraw/zinc/95/99/11/1372959911.db2.gz	PANKUOMZIZKZAP-WOJBJXKFSA-N	0	3	344.499	3.479	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H]2CN(CC[C@H]3CC3(Cl)Cl)C[C@H]21	ZINC001188080871	1388237189	/nfs/dbraw/zinc/23/71/89/1388237189.db2.gz	NWIWELIZYNFSGN-SOUVJXGZSA-N	0	3	345.314	3.459	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H]2CN(C[C@@H](OC)c3ccccc3)C[C@H]21	ZINC001188080862	1388237844	/nfs/dbraw/zinc/23/78/44/1388237844.db2.gz	NUTROGVJBZEWCZ-XUVXKRRUSA-N	0	3	342.483	3.263	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@H](NCc2cc(Cl)cc3c2OCC3)C1	ZINC001214304158	1373040549	/nfs/dbraw/zinc/04/05/49/1373040549.db2.gz	JWLJHZKJFYHDMJ-CXAGYDPISA-N	0	3	348.874	3.178	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@H](N[C@H]2CCc3c2c(F)ccc3F)C1	ZINC001214304526	1373040852	/nfs/dbraw/zinc/04/08/52/1373040852.db2.gz	XQRIRVRJDAZDNK-OAUYIBNBSA-N	0	3	334.410	3.355	20	30		EGEDHN
CC(C)[C@@H](C)CC(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2)C1	ZINC001214308116	1373042359	/nfs/dbraw/zinc/04/23/59/1373042359.db2.gz	UEMWQZLCMMGFLF-NLWGTHIKSA-N	0	3	326.484	3.157	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCC2CC2)C[C@H]1NCC#Cc1ccccc1Cl	ZINC001214368612	1373050872	/nfs/dbraw/zinc/05/08/72/1373050872.db2.gz	FYQMORCUFHILNK-DNVCBOLYSA-N	0	3	344.886	3.318	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001214741657	1373113588	/nfs/dbraw/zinc/11/35/88/1373113588.db2.gz	VZSCJRYLJSSVAP-VQIMIIECSA-N	0	3	344.886	3.484	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001214741436	1373113607	/nfs/dbraw/zinc/11/36/07/1373113607.db2.gz	LHCQQEFXYXMJLV-VQIMIIECSA-N	0	3	344.886	3.484	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1C[C@@H](C)[C@H](NCC=C(Cl)Cl)C1)OCC	ZINC001214754680	1373115570	/nfs/dbraw/zinc/11/55/70/1373115570.db2.gz	CBYVOIWWRITWGJ-MGPQQGTHSA-N	0	3	349.302	3.113	20	30		EGEDHN
C=C(C)CNCc1ccncc1O[C@H]1CCN(C(=O)C[C@@H](C)CC)C1	ZINC001127878278	1373194686	/nfs/dbraw/zinc/19/46/86/1373194686.db2.gz	FUBRGSIUZQAXES-WMZOPIPTSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NCCNCc1ccc(F)c(Cl)c1)OCC	ZINC001128529173	1373284018	/nfs/dbraw/zinc/28/40/18/1373284018.db2.gz	ZUOWRDADNTVZEM-MRXNPFEDSA-N	0	3	342.842	3.056	20	30		EGEDHN
C=CC[C@@H](C(=O)N1C[C@@H](C)[C@H](NCc2ccccn2)C1)c1ccccc1	ZINC001216806191	1373345391	/nfs/dbraw/zinc/34/53/91/1373345391.db2.gz	FHSNRVCXCZYOCX-DUXKGJEZSA-N	0	3	349.478	3.378	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2OCCN(C(=O)c3cccc(F)c3C)[C@H]2C1	ZINC001217953297	1373518835	/nfs/dbraw/zinc/51/88/35/1373518835.db2.gz	CXUYJWCQVOMCKU-MDASCCDHSA-N	0	3	346.446	3.014	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)CCC2CCCCC2)C1	ZINC001130442643	1373542139	/nfs/dbraw/zinc/54/21/39/1373542139.db2.gz	NOURFJMWKJRDSX-KRWDZBQOSA-N	0	3	344.503	3.362	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)C2(CC=C)CCCC2)C1	ZINC001130455844	1373546053	/nfs/dbraw/zinc/54/60/53/1373546053.db2.gz	HFUCIPNCZZTXJB-INIZCTEOSA-N	0	3	342.487	3.138	20	30		EGEDHN
N#Cc1cc(-c2ccc(Cl)cc2)cnc1O[C@H]1CCNC[C@@H]1F	ZINC001218064583	1373551151	/nfs/dbraw/zinc/55/11/51/1373551151.db2.gz	NAAOKGBFUCHAGE-HOTGVXAUSA-N	0	3	331.778	3.352	20	30		EGEDHN
Fc1ccc(C#Cc2ccc(O[C@H]3CC[C@@H]4NCCO[C@@H]43)cc2)cc1	ZINC001218116072	1373563426	/nfs/dbraw/zinc/56/34/26/1373563426.db2.gz	KEWYKEBXJLYIJU-ACRUOGEOSA-N	0	3	337.394	3.124	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)[C@@H](C)C3CCC3)[C@H]2C1	ZINC001218154892	1373571054	/nfs/dbraw/zinc/57/10/54/1373571054.db2.gz	TYFKPUYVERNILA-YTQUADARSA-N	0	3	336.520	3.305	20	30		EGEDHN
CC(C)=CCCC1=CC(=O)c2c(O)ccc(O[C@H]3CN[C@@H]3C)c2C1=O	ZINC001218391254	1373605241	/nfs/dbraw/zinc/60/52/41/1373605241.db2.gz	LLMORGNOFKWZEL-PXAZEXFGSA-N	0	3	341.407	3.183	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCO[C@@H]2CN(CCCC(C)(C)C)C[C@@H]21	ZINC001218517200	1373628067	/nfs/dbraw/zinc/62/80/67/1373628067.db2.gz	KAGPJOMFYJQJHK-FGTMMUONSA-N	0	3	336.520	3.327	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCO[C@@H]2CN(CCC3CCCC3)C[C@@H]21	ZINC001218524364	1373629667	/nfs/dbraw/zinc/62/96/67/1373629667.db2.gz	WROOROQIUXJJKP-YTQUADARSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2OCCN(C(=O)c3ccc(C)cc3F)[C@H]2C1	ZINC001218677742	1373642741	/nfs/dbraw/zinc/64/27/41/1373642741.db2.gz	ZKLDWUQIVCJZLL-ZYSHUDEJSA-N	0	3	346.446	3.014	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)[C@@H]2CCC[C@H]2c2ccccc2)cc1	ZINC001131157246	1373654224	/nfs/dbraw/zinc/65/42/24/1373654224.db2.gz	SVJRLPHZVOIMBN-LEWJYISDSA-N	0	3	347.462	3.348	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)CC(CC)CC)[C@H]2C1	ZINC001218859551	1373662223	/nfs/dbraw/zinc/66/22/23/1373662223.db2.gz	UIPCIKNTHYSBFN-RBUKOAKNSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)C3CCC(C4CC4)CC3)[C@H]2C1	ZINC001219013723	1373679459	/nfs/dbraw/zinc/67/94/59/1373679459.db2.gz	WEPMQWGIIJCNRS-GHBBCFCZSA-N	0	3	346.515	3.081	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2OCCN(C(=O)c3ccc(C)cc3C)[C@H]2C1	ZINC001219014815	1373679758	/nfs/dbraw/zinc/67/97/58/1373679758.db2.gz	UJOJBVQQLIIFQK-YZGWKJHDSA-N	0	3	342.483	3.183	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)C[C@@H](C)c3ccccc3)[C@H]2C1	ZINC001219017646	1373680588	/nfs/dbraw/zinc/68/05/88/1373680588.db2.gz	AGKVNSOVKKLDQG-YZGWKJHDSA-N	0	3	342.483	3.058	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H](NC(=O)c2cc3ccccc3s2)[C@@H](O)C1	ZINC001219953145	1373741452	/nfs/dbraw/zinc/74/14/52/1373741452.db2.gz	DNVREHXZMNEAIK-BMFZPTHFSA-N	0	3	344.480	3.031	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)CCc2ccc(Cl)cc2)CC1	ZINC001223959313	1375049391	/nfs/dbraw/zinc/04/93/91/1375049391.db2.gz	YRYFMALYOWRBJZ-UHFFFAOYSA-N	0	3	332.875	3.124	20	30		EGEDHN
C=CCOCCCC(=O)N[C@@H]1CC[C@@H](C)N(Cc2ccccc2)C1	ZINC001131939252	1375057588	/nfs/dbraw/zinc/05/75/88/1375057588.db2.gz	PAUFFIGMYWCDDJ-IEBWSBKVSA-N	0	3	330.472	3.139	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@H](C)N(CCOc2ccccc2C)C1	ZINC001131996287	1375089083	/nfs/dbraw/zinc/08/90/83/1375089083.db2.gz	SGGANJQIUHCPIJ-RBUKOAKNSA-N	0	3	342.483	3.146	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CC[C@@H](C)N(Cc2ccc(COC)cc2)C1	ZINC001132001938	1375093012	/nfs/dbraw/zinc/09/30/12/1375093012.db2.gz	FRUHEEDEARTSHX-XLIONFOSSA-N	0	3	342.483	3.106	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2csc3ccccc23)s1	ZINC001132012688	1375097039	/nfs/dbraw/zinc/09/70/39/1375097039.db2.gz	DXPLPWOAPYTZFN-UHFFFAOYSA-N	0	3	341.461	3.354	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1CC[C@@H](C)N(CCCc2ccsc2)C1	ZINC001132022147	1375103416	/nfs/dbraw/zinc/10/34/16/1375103416.db2.gz	VOQDELFBVYZGSF-SJLPKXTDSA-N	0	3	332.513	3.309	20	30		EGEDHN
Cc1ncsc1CCN1C[C@H](NC(=O)C#CC(C)(C)C)CC[C@@H]1C	ZINC001132037508	1375110998	/nfs/dbraw/zinc/11/09/98/1375110998.db2.gz	DBNXOVVWPUJXKA-GOEBONIOSA-N	0	3	347.528	3.013	20	30		EGEDHN
C[C@@H](C(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccc(F)cc1)C1CC1	ZINC001225532946	1375119956	/nfs/dbraw/zinc/11/99/56/1375119956.db2.gz	CPLIUKPFCGTUAV-CDHQVMDDSA-N	0	3	342.458	3.240	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1CC[C@H](C)N(CCOCC(C)C)C1	ZINC001132057233	1375123651	/nfs/dbraw/zinc/12/36/51/1375123651.db2.gz	LTAABIRGVYFETQ-HKUYNNGSSA-N	0	3	336.520	3.397	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCCC[C@H]2NC(=O)/C=C\C2CC2)c(F)c1	ZINC001225570218	1375126170	/nfs/dbraw/zinc/12/61/70/1375126170.db2.gz	PTQJFHDSHUIKPV-WXUGTPJSSA-N	0	3	341.430	3.181	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1CC[C@H](C)N(CCn2nc(C)cc2C)C1	ZINC001132060845	1375126373	/nfs/dbraw/zinc/12/63/73/1375126373.db2.gz	MBXDFGXDRSNLAB-WMZOPIPTSA-N	0	3	346.519	3.071	20	30		EGEDHN
C#CCN1CCC(CNC(=O)[C@H](c2ccc(F)cc2)C(C)C)CC1	ZINC001225596732	1375129936	/nfs/dbraw/zinc/12/99/36/1375129936.db2.gz	ITFIONFWNBQROV-IBGZPJMESA-N	0	3	330.447	3.027	20	30		EGEDHN
C#CCN1CCC(CNC(=O)C[C@@H](C)CCc2ccccc2)CC1	ZINC001225626093	1375134782	/nfs/dbraw/zinc/13/47/82/1375134782.db2.gz	RLQMAGLFCCBPTA-SFHVURJKSA-N	0	3	326.484	3.107	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCc2cccc(OC)c2F)CC[C@@H]1C	ZINC001132082117	1375137350	/nfs/dbraw/zinc/13/73/50/1375137350.db2.gz	FQXMXBQWKQOQGO-RDJZCZTQSA-N	0	3	348.462	3.312	20	30		EGEDHN
CN1CCC(N(C(=O)c2cccc(CC#N)c2)C2CCCC2)CC1	ZINC001188676466	1388359685	/nfs/dbraw/zinc/35/96/85/1388359685.db2.gz	CEHRNFYFMGQYFI-UHFFFAOYSA-N	0	3	325.456	3.232	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)COCCCCCCCC)CC[C@H]1C	ZINC001132107039	1375151215	/nfs/dbraw/zinc/15/12/15/1375151215.db2.gz	XAWBIYRZSZQGNS-RTBURBONSA-N	0	3	336.520	3.356	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@@]2(C)CCc3ccccc3C2)CC1	ZINC001225754977	1375152738	/nfs/dbraw/zinc/15/27/38/1375152738.db2.gz	LIKNBOXRYVMJBQ-QFIPXVFZSA-N	0	3	338.495	3.033	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2(Cc3ccccc3)CCC2)CC[C@@H]1C	ZINC001132111607	1375154591	/nfs/dbraw/zinc/15/45/91/1375154591.db2.gz	UHBWLFJJMYUUOE-AZUAARDMSA-N	0	3	338.495	3.392	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2cc(C)sc2C)CC[C@H]1C	ZINC001132157927	1375176005	/nfs/dbraw/zinc/17/60/05/1375176005.db2.gz	UXXJFTSMVBXEBD-CZUORRHYSA-N	0	3	336.501	3.150	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)C2(CC(C)C)CCC2)CC[C@H]1C	ZINC001132169644	1375184387	/nfs/dbraw/zinc/18/43/87/1375184387.db2.gz	RTVQVRZXBURJHX-QZTJIDSGSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CC[C@@H](C)N(Cc2ccc(CO)cc2)C1	ZINC001132217904	1375216141	/nfs/dbraw/zinc/21/61/41/1375216141.db2.gz	IRJGSAKYOSQELJ-VQIMIIECSA-N	0	3	344.499	3.250	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1CC[C@@H](C)N(CCc2ccc(OC)cc2)C1	ZINC001132228075	1375223357	/nfs/dbraw/zinc/22/33/57/1375223357.db2.gz	LTYFTFZUIQWPNJ-AEFFLSMTSA-N	0	3	344.499	3.419	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1CC[C@H](C)N(CCOc2ccccc2)C1	ZINC001132249542	1375245776	/nfs/dbraw/zinc/24/57/76/1375245776.db2.gz	QCMSRTQRHBTBLZ-ROUUACIJSA-N	0	3	330.472	3.391	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1CCCC[C@H]1NCc1ccns1	ZINC001226434449	1375257540	/nfs/dbraw/zinc/25/75/40/1375257540.db2.gz	JQNDTGGAYTVLKX-IAGOWNOFSA-N	0	3	333.501	3.429	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC1CCN(Cc2ccc(CC)cc2)CC1	ZINC001226446565	1375260189	/nfs/dbraw/zinc/26/01/89/1375260189.db2.gz	CZFXFENPWMCBTR-QGZVFWFLSA-N	0	3	344.499	3.311	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC1CCN(Cc2ccc(F)cc2C)CC1	ZINC001226448578	1375261098	/nfs/dbraw/zinc/26/10/98/1375261098.db2.gz	YQHQHMOWFVYTNG-INIZCTEOSA-N	0	3	348.462	3.196	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2CC[C@@H](C)N(CCOC3CCC3)C2)CC1	ZINC001132277113	1375261348	/nfs/dbraw/zinc/26/13/48/1375261348.db2.gz	BANVJMAETDPDFH-IAGOWNOFSA-N	0	3	334.504	3.271	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CCCC[C@H]1NCc1cc(CO)ccc1F	ZINC001226523311	1375275120	/nfs/dbraw/zinc/27/51/20/1375275120.db2.gz	UORTYNZPKSEQGH-RTBURBONSA-N	0	3	348.462	3.191	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)C23CCC(CC2)C3(C)C)CC[C@@H]1C	ZINC001132340194	1375320210	/nfs/dbraw/zinc/32/02/10/1375320210.db2.gz	OLCSHRPGJWPNFW-LWLAFGSWSA-N	0	3	348.531	3.375	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2(Cc3ccccc3F)CC2)CC[C@H]1C	ZINC001132346196	1375324542	/nfs/dbraw/zinc/32/45/42/1375324542.db2.gz	VXAXVICVFBQLTM-SJLPKXTDSA-N	0	3	342.458	3.141	20	30		EGEDHN
C#CCCCC(=O)NC1CCN(CCOc2cc(C)ccc2C)CC1	ZINC001227107607	1375391275	/nfs/dbraw/zinc/39/12/75/1375391275.db2.gz	GCQVLSWGSGZTOI-UHFFFAOYSA-N	0	3	342.483	3.066	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COc2cc(C)cc(C)c2)CC[C@@H]1C	ZINC001132486746	1375420112	/nfs/dbraw/zinc/42/01/12/1375420112.db2.gz	PECFOVSWJVLOQN-ZWKOTPCHSA-N	0	3	330.472	3.227	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COc2ccccc2Cl)CC[C@H]1C	ZINC001132487316	1375421188	/nfs/dbraw/zinc/42/11/88/1375421188.db2.gz	TUXHEZFUMMNKCY-CABCVRRESA-N	0	3	336.863	3.264	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1CC[C@@H](C)N(Cc2ccc(CF)cc2)C1	ZINC001132529117	1375443442	/nfs/dbraw/zinc/44/34/42/1375443442.db2.gz	IUNRCFKODPHRQO-APWZRJJASA-N	0	3	348.462	3.218	20	30		EGEDHN
C=C(C)CCC(=O)NC1CCN(C[C@@H](O)c2ccc(CC)cc2)CC1	ZINC001227596400	1375449947	/nfs/dbraw/zinc/44/99/47/1375449947.db2.gz	CLJYFFFUZFGZSO-HXUWFJFHSA-N	0	3	344.499	3.219	20	30		EGEDHN
C#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)CCCC)CC1	ZINC001132552589	1375458918	/nfs/dbraw/zinc/45/89/18/1375458918.db2.gz	XGAKIAOMMCLARA-IBGZPJMESA-N	0	3	327.472	3.088	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CCCC[C@H]1NCc1conc1CC	ZINC001227917494	1375490819	/nfs/dbraw/zinc/49/08/19/1375490819.db2.gz	WZMQYQFKRMUYIY-IAGOWNOFSA-N	0	3	333.476	3.356	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CCCC[C@H]1N[C@H](C)c1cnc(C)cn1	ZINC001227925556	1375492063	/nfs/dbraw/zinc/49/20/63/1375492063.db2.gz	MASJTCIVBXNFCL-BRWVUGGUSA-N	0	3	344.503	3.465	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](C)[C@@H](CNCc2ccn(C(C)C)n2)C1	ZINC001132700253	1375521127	/nfs/dbraw/zinc/52/11/27/1375521127.db2.gz	FGPZRSJKLHLORG-SJORKVTESA-N	0	3	332.492	3.004	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](C)[C@H](CNCc2cc(C3CC3)no2)C1	ZINC001132700478	1375521508	/nfs/dbraw/zinc/52/15/08/1375521508.db2.gz	ILWJSWLYAUUHNL-GDBMZVCRSA-N	0	3	331.460	3.092	20	30		EGEDHN
CC/C(C)=C/C(=O)N1CC[C@H](C)[C@@H](CNCc2ccccc2C#N)C1	ZINC001132804177	1375570930	/nfs/dbraw/zinc/57/09/30/1375570930.db2.gz	GKLGLFKODGZNET-VWUMBVJFSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](C)[C@H](CNCc2cnc(C)o2)C1	ZINC001132845895	1375597785	/nfs/dbraw/zinc/59/77/85/1375597785.db2.gz	CJETVLXVDWNZMJ-GDBMZVCRSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CCN(Cc2ccccc2N(C)C)CC1	ZINC001228622461	1375620690	/nfs/dbraw/zinc/62/06/90/1375620690.db2.gz	UXTGDDREZOYXBS-UHFFFAOYSA-N	0	3	329.488	3.045	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NC1CCN(CCOc2cccc(C)c2)CC1	ZINC001228748878	1375662438	/nfs/dbraw/zinc/66/24/38/1375662438.db2.gz	NXEHBIFZNKALFA-MSOLQXFVSA-N	0	3	344.499	3.413	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NC1CCN(Cc2ccc(OC)cc2)CC1	ZINC001228750234	1375663439	/nfs/dbraw/zinc/66/34/39/1375663439.db2.gz	YAEPAFCAXKOBHD-JKSUJKDBSA-N	0	3	330.472	3.234	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@@H]1Oc1c(C#N)cccc1[N+](=O)[O-]	ZINC001228774288	1375672775	/nfs/dbraw/zinc/67/27/75/1375672775.db2.gz	QMLHPNRBUJAQST-KSSFIOAISA-N	0	3	337.379	3.366	20	30		EGEDHN
C=CCCCC(=O)NC1CCN(Cc2cccc(N(C)C)c2)CC1	ZINC001228927963	1375717589	/nfs/dbraw/zinc/71/75/89/1375717589.db2.gz	PUXIOVSVRNMUDV-UHFFFAOYSA-N	0	3	329.488	3.190	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](C)[C@H](CNCc3ocnc3C)C2)CCC1	ZINC001133105312	1375778684	/nfs/dbraw/zinc/77/86/84/1375778684.db2.gz	SBXMTWBSTJBDBB-DOTOQJQBSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@H]2CN(CCc3scnc3C)C[C@H]21	ZINC001188886219	1388400235	/nfs/dbraw/zinc/40/02/35/1388400235.db2.gz	UXNUBYXFARTLRZ-BHYGNILZSA-N	0	3	347.528	3.129	20	30		EGEDHN
Cc1cc(Cl)ccc1C(=O)NCCNCc1ccc(C#N)cc1	ZINC001133252531	1375870799	/nfs/dbraw/zinc/87/07/99/1375870799.db2.gz	XFTFWAICQAQOJW-UHFFFAOYSA-N	0	3	327.815	3.040	20	30		EGEDHN
C=CCCC1(C(=O)NCCNCc2ccccc2OC2CC2)CC1	ZINC001133374179	1375953206	/nfs/dbraw/zinc/95/32/06/1375953206.db2.gz	OYDGEIALGZNZRX-UHFFFAOYSA-N	0	3	328.456	3.180	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)C1CCCC1	ZINC001133376814	1375956606	/nfs/dbraw/zinc/95/66/06/1375956606.db2.gz	CIGBGRZBRNDJRC-UHFFFAOYSA-N	0	3	332.875	3.472	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1cccs1	ZINC001133376831	1375956697	/nfs/dbraw/zinc/95/66/97/1375956697.db2.gz	DCDDMLOAGYLTHF-UHFFFAOYSA-N	0	3	332.856	3.267	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@H](CC)SC	ZINC001133396180	1375979861	/nfs/dbraw/zinc/97/98/61/1375979861.db2.gz	UXPQGQIWSUUAPH-INIZCTEOSA-N	0	3	338.904	3.033	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1[nH]ccc1C	ZINC001133396003	1375979883	/nfs/dbraw/zinc/97/98/83/1375979883.db2.gz	MHGRHPZKCZRJHE-UHFFFAOYSA-N	0	3	343.858	3.232	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H](C)CC(F)F	ZINC001133399499	1375984400	/nfs/dbraw/zinc/98/44/00/1375984400.db2.gz	QGBVLVGQRQBRSS-ZDUSSCGKSA-N	0	3	342.817	3.183	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C[C@H](C=C)CC	ZINC001133405901	1375991744	/nfs/dbraw/zinc/99/17/44/1375991744.db2.gz	VXGUGPLNGLDPHQ-MRXNPFEDSA-N	0	3	332.875	3.494	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H]1CC12CC2	ZINC001133405968	1375991758	/nfs/dbraw/zinc/99/17/58/1375991758.db2.gz	ZLJZBGJYUKHUEL-KRWDZBQOSA-N	0	3	330.859	3.082	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@H]1CC[C@H](C)C1	ZINC001133408123	1375992379	/nfs/dbraw/zinc/99/23/79/1375992379.db2.gz	XNHGSPMCYNMIQW-RDJZCZTQSA-N	0	3	332.875	3.328	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NC1CCN(Cc2ccc(C3CC3)cc2)CC1	ZINC001230414747	1376023946	/nfs/dbraw/zinc/02/39/46/1376023946.db2.gz	GDOZAWIKGAPEAL-MRXNPFEDSA-N	0	3	342.483	3.236	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1C1CCN(C(=O)[C@@H](CC)OCC)CC1	ZINC001230522172	1376053792	/nfs/dbraw/zinc/05/37/92/1376053792.db2.gz	INIBCXASILMJID-DLBZAZTESA-N	0	3	342.911	3.257	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)c1ccccc1	ZINC001133524623	1376057785	/nfs/dbraw/zinc/05/77/85/1376057785.db2.gz	HUBJJVXIQUNTHY-OLZOCXBDSA-N	0	3	325.250	3.082	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N1CCC([C@@H]2CCCN2CC(=C)Cl)CC1	ZINC001230630893	1376108698	/nfs/dbraw/zinc/10/86/98/1376108698.db2.gz	WMFBWNKEMZGWCB-WBVHZDCISA-N	0	3	340.895	3.033	20	30		EGEDHN
C#CCCN(CCCNC(=O)CC[C@H](C)CC)Cc1cccnc1	ZINC001230876366	1376172319	/nfs/dbraw/zinc/17/23/19/1376172319.db2.gz	KZEVQHCAZPIQJV-GOSISDBHSA-N	0	3	329.488	3.240	20	30		EGEDHN
Cc1ccc(C(=O)NCCCN(C)Cc2ccc(C#N)c(F)c2)s1	ZINC001231301559	1376224065	/nfs/dbraw/zinc/22/40/65/1376224065.db2.gz	XLGQSBGZWXUDOO-UHFFFAOYSA-N	0	3	345.443	3.319	20	30		EGEDHN
C#Cc1cccc(CN2CCC3(CC2)C(=O)NC[C@H]3c2ccccc2)c1	ZINC001231658051	1376297643	/nfs/dbraw/zinc/29/76/43/1376297643.db2.gz	XSDXBSGJBQNGQO-NRFANRHFSA-N	0	3	344.458	3.164	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)CCC(F)(F)F	ZINC001134003337	1376306093	/nfs/dbraw/zinc/30/60/93/1376306093.db2.gz	IQRGHEUCCGJUSZ-VHSXEESVSA-N	0	3	345.203	3.110	20	30		EGEDHN
C#CCCCCC(=O)N[C@H](C)C[C@@H](C)NCc1nc(C)c(C)s1	ZINC001134113206	1376373599	/nfs/dbraw/zinc/37/35/99/1376373599.db2.gz	ALFDUYSVEULHGK-ZIAGYGMSSA-N	0	3	335.517	3.326	20	30		EGEDHN
C#CCCCC(=O)N[C@H](C)C[C@@H](C)NCc1nc2ccccc2o1	ZINC001134201714	1376415004	/nfs/dbraw/zinc/41/50/04/1376415004.db2.gz	SPFNQFQRSUQKRA-HUUCEWRRSA-N	0	3	327.428	3.004	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)C(C)=C1CCC1	ZINC001134308914	1376467741	/nfs/dbraw/zinc/46/77/41/1376467741.db2.gz	WBCFEVNQXSJLNM-VXGBXAGGSA-N	0	3	329.282	3.268	20	30		EGEDHN
CCC(CC)n1ccc(CN[C@@H](C)C[C@@H](C)NC(=O)C#CC2CC2)n1	ZINC001134317485	1376472566	/nfs/dbraw/zinc/47/25/66/1376472566.db2.gz	JQXJLIPTDUXJNK-JKSUJKDBSA-N	0	3	344.503	3.031	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H](C)C[C@H](C)NCc1cc2n(n1)CCCC2	ZINC001134456657	1376548104	/nfs/dbraw/zinc/54/81/04/1376548104.db2.gz	BJAFMLLWJNELIL-HOTGVXAUSA-N	0	3	346.519	3.195	20	30		EGEDHN
Cc1cccc([C@H](C)C(=O)NCCNCc2ccc(C#N)c(F)c2)c1	ZINC001134468990	1376553611	/nfs/dbraw/zinc/55/36/11/1376553611.db2.gz	SWYWUKHSGCCDOI-HNNXBMFYSA-N	0	3	339.414	3.015	20	30		EGEDHN
C#CCCCCC(=O)N(C)C[C@H]1CCN1CCCc1ccccc1	ZINC001233801845	1376720665	/nfs/dbraw/zinc/72/06/65/1376720665.db2.gz	RZHWEHLESWAHER-HXUWFJFHSA-N	0	3	326.484	3.346	20	30		EGEDHN
CCCCC[C@H](C)CC(=O)NCCNCc1ccc(OC)c(C#N)c1	ZINC001134824023	1376743488	/nfs/dbraw/zinc/74/34/88/1376743488.db2.gz	KSNVDNVDCJXLGV-INIZCTEOSA-N	0	3	345.487	3.379	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](C)C[C@@H](C)NCc1ncc(Cl)n1C	ZINC001135181084	1376953773	/nfs/dbraw/zinc/95/37/73/1376953773.db2.gz	MCUFEGOKHGFTKY-OLZOCXBDSA-N	0	3	340.899	3.049	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H](C)C[C@@H](C)NC/C(Cl)=C\Cl)cc1	ZINC001135184903	1376958299	/nfs/dbraw/zinc/95/82/99/1376958299.db2.gz	QRIYGONXCFIKDW-VYBIZCNCSA-N	0	3	339.266	3.473	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1cc(F)ccc1C#N)NC(=O)C1(C)CCC1	ZINC001135206650	1376975934	/nfs/dbraw/zinc/97/59/34/1376975934.db2.gz	CDRKUIOFOVBQJE-UONOGXRCSA-N	0	3	331.435	3.260	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H](C)C[C@@H](C)NCc1nc(C)c(C)s1	ZINC001135224289	1376984612	/nfs/dbraw/zinc/98/46/12/1376984612.db2.gz	APXFUIIZBTUKOS-KGLIPLIRSA-N	0	3	335.517	3.326	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H](C)C[C@H](C)NCc1nc(C)c(C)s1	ZINC001135224288	1376984700	/nfs/dbraw/zinc/98/47/00/1376984700.db2.gz	APXFUIIZBTUKOS-KBPBESRZSA-N	0	3	335.517	3.326	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3ccc(C#N)cc3Cl)C2)C1=O	ZINC001238081629	1376993004	/nfs/dbraw/zinc/99/30/04/1376993004.db2.gz	CJBWFOLLVQENFS-IBGZPJMESA-N	0	3	343.858	3.212	20	30		EGEDHN
Cc1coc(C(=O)N[C@H](C)C[C@@H](C)NCc2ccccc2C#N)c1	ZINC001135237781	1376994074	/nfs/dbraw/zinc/99/40/74/1376994074.db2.gz	FKLDEXSUPFMCKH-HUUCEWRRSA-N	0	3	325.412	3.146	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)C1CC2(CC2)C1)NCc1ccccc1C#N	ZINC001135452397	1377102863	/nfs/dbraw/zinc/10/28/63/1377102863.db2.gz	SXILFEQVFMDNDK-HUUCEWRRSA-N	0	3	325.456	3.121	20	30		EGEDHN
CCCCCCCCCCC[C@H](C)N1CCN(CC(N)=O)CC1	ZINC001258052314	1377115657	/nfs/dbraw/zinc/11/56/57/1377115657.db2.gz	OMAHHIMVKJUIHR-SFHVURJKSA-N	0	3	325.541	3.399	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H](C)C[C@@H](C)NCc1nccn1C(F)F	ZINC001135562372	1377146132	/nfs/dbraw/zinc/14/61/32/1377146132.db2.gz	YIDUKPONMZNCRT-CHWSQXEVSA-N	0	3	342.434	3.253	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1ccccc1C#N)NC(=O)C(C1CC1)C1CC1	ZINC001135904292	1377256348	/nfs/dbraw/zinc/25/63/48/1377256348.db2.gz	AMPFCXHABISNGV-LSDHHAIUSA-N	0	3	339.483	3.367	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CC[C@H](N(C)Cc2ccc(F)cc2C)C1	ZINC001189242798	1388493711	/nfs/dbraw/zinc/49/37/11/1388493711.db2.gz	MCFLZMFYYGAWCG-APWZRJJASA-N	0	3	348.462	3.148	20	30		EGEDHN
CC(C)[C@@H](C(=O)Nc1ccc(Oc2ccc(C#N)cn2)cc1)N(C)C	ZINC001136450383	1377394678	/nfs/dbraw/zinc/39/46/78/1377394678.db2.gz	SEBSOOCJWRRKFZ-SFHVURJKSA-N	0	3	338.411	3.270	20	30		EGEDHN
N#CCOc1ccc(CN2CCC(O)(Cc3ccccc3)CC2)cc1	ZINC001137114493	1377481113	/nfs/dbraw/zinc/48/11/13/1377481113.db2.gz	NWOAIPPCQUULHP-UHFFFAOYSA-N	0	3	336.435	3.159	20	30		EGEDHN
Cc1cccnc1O[C@@H]1CCCN(Cc2ccc(OCC#N)cc2)C1	ZINC001137122460	1377482314	/nfs/dbraw/zinc/48/23/14/1377482314.db2.gz	BNPFGBSQPISHFU-LJQANCHMSA-N	0	3	337.423	3.336	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@]3(C2)C(=O)Nc2ccccc23)c1[O-]	ZINC001138627385	1377756765	/nfs/dbraw/zinc/75/67/65/1377756765.db2.gz	FHCULZKFQKGQJP-OAQYLSRUSA-N	0	3	334.419	3.217	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@]3(C2)C(=O)Nc2ccccc23)c1[O-]	ZINC001138627385	1377756767	/nfs/dbraw/zinc/75/67/67/1377756767.db2.gz	FHCULZKFQKGQJP-OAQYLSRUSA-N	0	3	334.419	3.217	20	30		EGEDHN
O=C1C=C2CN(Cc3cccn3-c3ccccc3F)CCC2S1	ZINC001138631974	1377757384	/nfs/dbraw/zinc/75/73/84/1377757384.db2.gz	JFWNZPMGONKRBU-QGZVFWFLSA-N	0	3	328.412	3.391	20	30		EGEDHN
C=CCOc1ccccc1CN1CC[C@H]2[C@@H]1CCC(=O)N2CC1CC1	ZINC001139027942	1377819169	/nfs/dbraw/zinc/81/91/69/1377819169.db2.gz	GOQRISNSANQQMK-OALUTQOASA-N	0	3	340.467	3.227	20	30		EGEDHN
N#Cc1ccnc(-c2ccc(CN3CCN(CC4CC4)CC3)cc2)c1	ZINC001139406978	1377879964	/nfs/dbraw/zinc/87/99/64/1377879964.db2.gz	LQQAWLQYOJKSKY-UHFFFAOYSA-N	0	3	332.451	3.148	20	30		EGEDHN
N#Cc1ccc(F)c(CN2CCC3(CC2)C(=O)Nc2ccccc23)c1	ZINC001139646611	1377925148	/nfs/dbraw/zinc/92/51/48/1377925148.db2.gz	YNTOGKVYMJAVQO-UHFFFAOYSA-N	0	3	335.382	3.183	20	30		EGEDHN
CC(C)(C)OC(=O)[C@@H]1CCN(Cc2c[nH]c3c2cccc3C#N)C1	ZINC001139703854	1377937746	/nfs/dbraw/zinc/93/77/46/1377937746.db2.gz	VSEVLJUJEYCKAL-CQSZACIVSA-N	0	3	325.412	3.203	20	30		EGEDHN
Cc1cncnc1OC1CCN(Cc2c[nH]c3c2cccc3C#N)CC1	ZINC001139706862	1377938160	/nfs/dbraw/zinc/93/81/60/1377938160.db2.gz	ALTHKOWPZZXAQC-UHFFFAOYSA-N	0	3	347.422	3.181	20	30		EGEDHN
Cc1ccc(CN2CCc3ccc(=O)n(CC4CC4)c3CC2)cc1C#N	ZINC001139725351	1377942100	/nfs/dbraw/zinc/94/21/00/1377942100.db2.gz	MBJMXMGZKLEQEE-UHFFFAOYSA-N	0	3	347.462	3.039	20	30		EGEDHN
C=CCn1cc(CN(C[C@H](O)c2ccccc2OC)C(C)C)cn1	ZINC001139772971	1377948862	/nfs/dbraw/zinc/94/88/62/1377948862.db2.gz	VSOBJYVWDVTCNC-SFHVURJKSA-N	0	3	329.444	3.022	20	30		EGEDHN
C=CCn1cc(CN2CCN([C@@H]3CCCc4ccccc43)CC2)cn1	ZINC001139771355	1377949422	/nfs/dbraw/zinc/94/94/22/1377949422.db2.gz	XTWCGTDYJAYBFR-OAQYLSRUSA-N	0	3	336.483	3.264	20	30		EGEDHN
COC(=O)N1CCC2(CCN(Cc3cc(F)cc(C#N)c3)CC2)CC1	ZINC001139873616	1377969092	/nfs/dbraw/zinc/96/90/92/1377969092.db2.gz	YFYJLPCJPHEYPY-UHFFFAOYSA-N	0	3	345.418	3.142	20	30		EGEDHN
CCOC(=O)[C@H]1CN(Cc2cc(F)cc(C#N)c2)C[C@H]2CCCC[C@@H]12	ZINC001139877290	1377970076	/nfs/dbraw/zinc/97/00/76/1377970076.db2.gz	DYFLNBLQACWESI-QRQLOZEOSA-N	0	3	344.430	3.499	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@H]1CC[N@@H+](Cc1cc(F)ccc1[O-])C2	ZINC001140053950	1377996998	/nfs/dbraw/zinc/99/69/98/1377996998.db2.gz	GANFVMRSNLOPGV-RBUKOAKNSA-N	0	3	335.419	3.105	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@H]1CC[N@H+](Cc1cc(F)ccc1[O-])C2	ZINC001140053950	1377997001	/nfs/dbraw/zinc/99/70/01/1377997001.db2.gz	GANFVMRSNLOPGV-RBUKOAKNSA-N	0	3	335.419	3.105	20	30		EGEDHN
Cc1ccc(O[C@@H]2CCN(Cc3c[nH]c4ccc(C#N)cc34)C2)nc1	ZINC001140117243	1378012150	/nfs/dbraw/zinc/01/21/50/1378012150.db2.gz	ONICAFMQQTUXHO-QGZVFWFLSA-N	0	3	332.407	3.396	20	30		EGEDHN
C=CCO[C@@H]1CO[C@]2(C1)CCCN(Cc1c[nH]c3cccc(O)c13)C2	ZINC001140233831	1378035270	/nfs/dbraw/zinc/03/52/70/1378035270.db2.gz	VQMDERJRRHLSDO-JXFKEZNVSA-N	0	3	342.439	3.200	20	30		EGEDHN
CN(Cc1ccc(C#N)nc1)CC1CCN(C(=O)OC(C)(C)C)CC1	ZINC001140541408	1378081454	/nfs/dbraw/zinc/08/14/54/1378081454.db2.gz	HSXKTJDEHKITFF-UHFFFAOYSA-N	0	3	344.459	3.032	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(CCCN2Cc2ccc3cccnc3c2)C1=O	ZINC001273008251	1378084838	/nfs/dbraw/zinc/08/48/38/1378084838.db2.gz	HZRGHOIILAXCNX-NRFANRHFSA-N	0	3	335.451	3.378	20	30		EGEDHN
Cc1cc(C)cc(CN2CCC3(CCN(CCCC#N)C3=O)CC2)c1	ZINC001273006991	1378085081	/nfs/dbraw/zinc/08/50/81/1378085081.db2.gz	WQIAONBOPUYBRE-UHFFFAOYSA-N	0	3	339.483	3.422	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@@H]3[C@H]2CCC(=O)N3CC(=C)C)c1[O-]	ZINC001273360710	1378099265	/nfs/dbraw/zinc/09/92/65/1378099265.db2.gz	UEDDXVJTCDVRPD-RTBURBONSA-N	0	3	340.467	3.262	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@@H]3[C@H]2CCC(=O)N3CC(=C)C)c1[O-]	ZINC001273360710	1378099269	/nfs/dbraw/zinc/09/92/69/1378099269.db2.gz	UEDDXVJTCDVRPD-RTBURBONSA-N	0	3	340.467	3.262	20	30		EGEDHN
CC(C)CN1CC[C@]2(CCN(Cc3ccc(C#N)c(Cl)c3)C2)C1=O	ZINC001274492599	1378128328	/nfs/dbraw/zinc/12/83/28/1378128328.db2.gz	PVFALDZFXLPNPR-IBGZPJMESA-N	0	3	345.874	3.292	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@]3(CCC[C@@H]3C(=O)N(C)C)C2)c1[O-]	ZINC001277463810	1378223992	/nfs/dbraw/zinc/22/39/92/1378223992.db2.gz	OSEUIBMJQBECIW-WIYYLYMNSA-N	0	3	342.483	3.201	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@]3(CCC[C@@H]3C(=O)N(C)C)C2)c1[O-]	ZINC001277463810	1378223998	/nfs/dbraw/zinc/22/39/98/1378223998.db2.gz	OSEUIBMJQBECIW-WIYYLYMNSA-N	0	3	342.483	3.201	20	30		EGEDHN
Cn1cc(CN2CC3(CN(CCCCc4ccccc4)C3)C2)cc1C#N	ZINC001279633950	1378317244	/nfs/dbraw/zinc/31/72/44/1378317244.db2.gz	BRBREQWRUQNOGK-UHFFFAOYSA-N	0	3	348.494	3.037	20	30		EGEDHN
C=CCN(CC=C)CCN1CCN(Cc2csc(Cl)c2)CC1	ZINC001142780166	1378486930	/nfs/dbraw/zinc/48/69/30/1378486930.db2.gz	JASPCJQZXUFSKL-UHFFFAOYSA-N	0	3	339.936	3.193	20	30		EGEDHN
COc1ccc(O[C@H]2CCN(Cc3c[nH]c4cc(C#N)ccc34)C2)nc1	ZINC001142930550	1378511392	/nfs/dbraw/zinc/51/13/92/1378511392.db2.gz	KOKBTPOXHPZLLF-KRWDZBQOSA-N	0	3	348.406	3.096	20	30		EGEDHN
COc1cc(CN2CCC3SC(=O)C=C3C2)ccc1C(F)(F)F	ZINC001143343190	1378583597	/nfs/dbraw/zinc/58/35/97/1378583597.db2.gz	IIIALAWIDZMPPW-CQSZACIVSA-N	0	3	343.370	3.488	20	30		EGEDHN
Cc1cc(CN2CCCN(c3ccc(C#N)cn3)CC2)cc(C)c1F	ZINC001143381722	1378589429	/nfs/dbraw/zinc/58/94/29/1378589429.db2.gz	MCKWBLYYIGGAFJ-UHFFFAOYSA-N	0	3	338.430	3.422	20	30		EGEDHN
O=C1C=C2CN(Cc3cc(OC(F)(F)F)ccc3F)CCC2S1	ZINC001143542809	1378613505	/nfs/dbraw/zinc/61/35/05/1378613505.db2.gz	YJADMRQSPUWZOK-ZDUSSCGKSA-N	0	3	347.333	3.498	20	30		EGEDHN
COc1ccc(CN2CCC3SC(=O)C=C3C2)cc1C(F)(F)F	ZINC001143639055	1378628570	/nfs/dbraw/zinc/62/85/70/1378628570.db2.gz	MROPZDHSINGEOF-AWEZNQCLSA-N	0	3	343.370	3.488	20	30		EGEDHN
C=C(C(=O)NCCN1CCC(Cc2ccccc2)CC1)C(F)(F)F	ZINC001144208822	1378699253	/nfs/dbraw/zinc/69/92/53/1378699253.db2.gz	RLUROVZBNQLOCD-UHFFFAOYSA-N	0	3	340.389	3.176	20	30		EGEDHN
C#Cc1ccc(CN2C[C@H](C)C[C@H](NC(=O)OC(C)(C)C)C2)cc1	ZINC001144578811	1378747459	/nfs/dbraw/zinc/74/74/59/1378747459.db2.gz	QLKVOIQYMWWZPA-QAPCUYQASA-N	0	3	328.456	3.403	20	30		EGEDHN
C=CCCC(=O)N1CC2(C1)CCN(Cc1ccccc1OC1CC1)C2	ZINC001147181992	1378983359	/nfs/dbraw/zinc/98/33/59/1378983359.db2.gz	PHMRPQMZKNYBKD-UHFFFAOYSA-N	0	3	340.467	3.228	20	30		EGEDHN
C=C(Br)CNC[C@@H](C1CC1)N(C)C(=O)C(C)(C)C1CC1	ZINC001283530085	1379002756	/nfs/dbraw/zinc/00/27/56/1379002756.db2.gz	KGYGIPBWLXELNO-AWEZNQCLSA-N	0	3	343.309	3.158	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)C[C@@H](C)Cc3cccc(F)c3)C2)C1	ZINC001147566715	1379044029	/nfs/dbraw/zinc/04/40/29/1379044029.db2.gz	QPKCLYHOHDYQAH-INIZCTEOSA-N	0	3	330.447	3.115	20	30		EGEDHN
C=C(C)CCC(=O)N1CC2(C1)CCN(CCOc1cccc(C)c1)C2	ZINC001147658477	1379056759	/nfs/dbraw/zinc/05/67/59/1379056759.db2.gz	SVGIYQVWLNIQST-UHFFFAOYSA-N	0	3	342.483	3.264	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001148088181	1379114445	/nfs/dbraw/zinc/11/44/45/1379114445.db2.gz	JGXGEUYWFKGBNQ-HAVNEIBRSA-N	0	3	335.451	3.115	20	30		EGEDHN
CCCCCCCCCC(=O)NCCN[C@@H](C)C(=O)N(CC)CC	ZINC001148827047	1379277769	/nfs/dbraw/zinc/27/77/69/1379277769.db2.gz	UDYJLXSZBDOAIM-KRWDZBQOSA-N	0	3	341.540	3.090	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)C/C=C/c2cccc(F)c2)C1	ZINC001149868340	1379457967	/nfs/dbraw/zinc/45/79/67/1379457967.db2.gz	GPOARPRWPWFWJI-QTWIXLPOSA-N	0	3	346.446	3.012	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@H]1CN([C@H](C)c2cccc(C)c2)CCCO1	ZINC001150086155	1379492714	/nfs/dbraw/zinc/49/27/14/1379492714.db2.gz	XVHXNZXPVFDJGC-MJGOQNOKSA-N	0	3	344.499	3.475	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)CC(C2CCC2)C2CCC2)C1	ZINC001150317215	1379532688	/nfs/dbraw/zinc/53/26/88/1379532688.db2.gz	IAKGQVJMSORQSN-LJQANCHMSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)[C@H](c2ccccc2)C(C)C)C1	ZINC001150380035	1379541887	/nfs/dbraw/zinc/54/18/87/1379541887.db2.gz	OLXGYYYJSJDWKT-PMACEKPBSA-N	0	3	344.499	3.209	20	30		EGEDHN
Cc1ccc(C(C)(C)CC(=O)NCCNCc2ccc(C#N)cc2)cc1	ZINC001150377504	1379541899	/nfs/dbraw/zinc/54/18/99/1379541899.db2.gz	WVGBSVLYOBTZSF-UHFFFAOYSA-N	0	3	349.478	3.440	20	30		EGEDHN
C#CCCN1CCCO[C@@H](CNC(=O)C[C@H](C)CCCCCC)C1	ZINC001150579539	1379572771	/nfs/dbraw/zinc/57/27/71/1379572771.db2.gz	NJQMYIIFKBWTPG-MOPGFXCFSA-N	0	3	336.520	3.213	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@@H](C)c2cccs2)CC1	ZINC001151302687	1379696725	/nfs/dbraw/zinc/69/67/25/1379696725.db2.gz	OPQOWFLVZHSCPI-HNNXBMFYSA-N	0	3	336.501	3.025	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2ccc(C)cc2F)CC1	ZINC001151334724	1379700306	/nfs/dbraw/zinc/70/03/06/1379700306.db2.gz	LZIKWOPTPBPNQD-UHFFFAOYSA-N	0	3	348.462	3.311	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@H]2C[C@@H]2C2CCCC2)CC1	ZINC001151374512	1379707141	/nfs/dbraw/zinc/70/71/41/1379707141.db2.gz	JFIRKCBIDQHMCL-MOPGFXCFSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@H](C)c2ccccc2)CC1	ZINC001151402540	1379711538	/nfs/dbraw/zinc/71/15/38/1379711538.db2.gz	KRAIGCQICGHCLE-GOSISDBHSA-N	0	3	344.499	3.354	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@@H](C)Cc2ccccc2)CC1	ZINC001151409851	1379713518	/nfs/dbraw/zinc/71/35/18/1379713518.db2.gz	JNDPSLACZRQVML-SFHVURJKSA-N	0	3	344.499	3.039	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)C[C@@H]2CCCC[C@@H]2C)CC1	ZINC001151412377	1379713992	/nfs/dbraw/zinc/71/39/92/1379713992.db2.gz	AQWARRISYZQXFO-ROUUACIJSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)C2CCC(C)(C)CC2)CC1	ZINC001151412363	1379714256	/nfs/dbraw/zinc/71/42/56/1379714256.db2.gz	ACLCHBHLSYRNFN-UHFFFAOYSA-N	0	3	336.520	3.376	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)C[C@@H]1C=CCC1	ZINC001151801592	1379785180	/nfs/dbraw/zinc/78/51/80/1379785180.db2.gz	WFMJWGCTNOZBPE-HZPDHXFCSA-N	0	3	343.446	3.380	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)C[C@H]1C=CCC1	ZINC001151806861	1379785943	/nfs/dbraw/zinc/78/59/43/1379785943.db2.gz	OZWZORBVIGVENY-SJORKVTESA-N	0	3	325.456	3.241	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)C(=O)NCCNCc1cccc(F)c1	ZINC001151906977	1379814037	/nfs/dbraw/zinc/81/40/37/1379814037.db2.gz	RNWGSYITPBWRII-LJQANCHMSA-N	0	3	340.442	3.467	20	30		EGEDHN
Cc1ccccc1[C@@H](C)C(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001152018697	1379840975	/nfs/dbraw/zinc/84/09/75/1379840975.db2.gz	YWGHTUIMNIYAEZ-OAHLLOKOSA-N	0	3	339.414	3.015	20	30		EGEDHN
CCC1(C(=O)NCCNCc2ccc(F)c(C#N)c2)CCCCC1	ZINC001152053941	1379853246	/nfs/dbraw/zinc/85/32/46/1379853246.db2.gz	KMMWHTHRYBGIKC-UHFFFAOYSA-N	0	3	331.435	3.264	20	30		EGEDHN
CC[C@@H](SC)C(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)cc1	ZINC001152841361	1379986010	/nfs/dbraw/zinc/98/60/10/1379986010.db2.gz	BJIRWDOAQZDRQE-RHSMWYFYSA-N	0	3	333.501	3.026	20	30		EGEDHN
CC1(C)CCCC[C@@H]1C(=O)NCCNCc1ccc(C#N)c(F)c1	ZINC001152911558	1379993175	/nfs/dbraw/zinc/99/31/75/1379993175.db2.gz	XAOOAXOFZPPOMN-MRXNPFEDSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=CCCOCC(=O)NCCN[C@H](C)c1ccc(Cl)c(Cl)c1	ZINC001153086233	1380018064	/nfs/dbraw/zinc/01/80/64/1380018064.db2.gz	SORBGRICDYVZEI-GFCCVEGCSA-N	0	3	345.270	3.353	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)C#CC(C)(C)C	ZINC001153281345	1380049082	/nfs/dbraw/zinc/04/90/82/1380049082.db2.gz	LNSACSROXFOWPI-OAHLLOKOSA-N	0	3	343.446	3.073	20	30		EGEDHN
C=CCCCCC[N@@H+](CC)[C@H](C)CNC(=O)c1cccc2n[n-]nc21	ZINC001153549895	1380091602	/nfs/dbraw/zinc/09/16/02/1380091602.db2.gz	YWFWACCZKVYRFQ-OAHLLOKOSA-N	0	3	343.475	3.145	20	30		EGEDHN
C=CCCCCC[N@H+](CC)[C@H](C)CNC(=O)c1cccc2n[n-]nc21	ZINC001153549895	1380091607	/nfs/dbraw/zinc/09/16/07/1380091607.db2.gz	YWFWACCZKVYRFQ-OAHLLOKOSA-N	0	3	343.475	3.145	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NC[C@@H](C)N(CC)Cc1ccsc1)OCC	ZINC001153653708	1380110732	/nfs/dbraw/zinc/11/07/32/1380110732.db2.gz	BDJPGFREWGVQLR-NVXWUHKLSA-N	0	3	338.517	3.446	20	30		EGEDHN
C#CCC1(C(=O)NC[C@@H](C)N(CC)Cc2cccc(C#N)c2)CCC1	ZINC001153773499	1380126307	/nfs/dbraw/zinc/12/63/07/1380126307.db2.gz	SORQZDQOEHUOHA-QGZVFWFLSA-N	0	3	337.467	3.078	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@@H]1CCCO[C@H]1c1ccccc1	ZINC001153864334	1380146524	/nfs/dbraw/zinc/14/65/24/1380146524.db2.gz	PRKBYGKXZNSGMF-RLLQIKCJSA-N	0	3	342.483	3.004	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)C1(C2CC2)CC1	ZINC001153956664	1380161810	/nfs/dbraw/zinc/16/18/10/1380161810.db2.gz	HJOONQXVRJIDAA-CQSZACIVSA-N	0	3	343.446	3.214	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)[C@@H](F)C(C)C	ZINC001154705249	1380336080	/nfs/dbraw/zinc/33/60/80/1380336080.db2.gz	HYFMLFSOQRCJJK-DYVFJYSZSA-N	0	3	337.414	3.018	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)c1cc(C)co1	ZINC001154724724	1380340777	/nfs/dbraw/zinc/34/07/77/1380340777.db2.gz	ITDRSGXTDLMGNJ-CQSZACIVSA-N	0	3	343.402	3.239	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@@H](C)N(CC)Cc1ccnc(N(C)C)c1	ZINC001154742582	1380343901	/nfs/dbraw/zinc/34/39/01/1380343901.db2.gz	IQTYHUYVFSKABJ-IAGOWNOFSA-N	0	3	346.519	3.077	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@@H](C)N(CC)Cc1ccnc(N(C)C)c1	ZINC001154751406	1380345697	/nfs/dbraw/zinc/34/56/97/1380345697.db2.gz	VRZPFKRVDZCNAR-SJORKVTESA-N	0	3	346.519	3.077	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)cc1	ZINC001154751267	1380345997	/nfs/dbraw/zinc/34/59/97/1380345997.db2.gz	SRVRJKQONKEXRK-SJORKVTESA-N	0	3	327.472	3.487	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)[C@H]1Cc2ccccc21	ZINC001154921986	1380376778	/nfs/dbraw/zinc/37/67/78/1380376778.db2.gz	UYZUQSZDGONKQS-IERDGZPVSA-N	0	3	347.462	3.225	20	30		EGEDHN
CCN(Cc1ccc(OC)c(C#N)c1)[C@H](C)CNC(=O)C1(CC)CC1	ZINC001155055986	1380400277	/nfs/dbraw/zinc/40/02/77/1380400277.db2.gz	DEMGROHVINDJLA-OAHLLOKOSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@@H](C)N(CC)Cc1ccc2nonc2c1	ZINC001155072820	1380403401	/nfs/dbraw/zinc/40/34/01/1380403401.db2.gz	LSMKMUJYFNTQFT-KUHUBIRLSA-N	0	3	344.459	3.152	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)c1ccc(Cl)c2cnccc12	ZINC001155207011	1380425239	/nfs/dbraw/zinc/42/52/39/1380425239.db2.gz	XIKPFCGWFQTSCN-ZDUSSCGKSA-N	0	3	329.831	3.268	20	30		EGEDHN
C#CCN(CC)[C@H](C)CNC(=O)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC001155343476	1380439190	/nfs/dbraw/zinc/43/91/90/1380439190.db2.gz	MEZWMEMKPPBZHO-MISYRCLQSA-N	0	3	326.484	3.420	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NCCCN[C@H](C)c1cc(F)ccc1F	ZINC001155438349	1380453472	/nfs/dbraw/zinc/45/34/72/1380453472.db2.gz	AMBORKYTYWYQMU-KGLIPLIRSA-N	0	3	340.414	3.103	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)c1cc(C)[nH]c1C	ZINC001155484135	1380458492	/nfs/dbraw/zinc/45/84/92/1380458492.db2.gz	ASNYCSBCYMJKHX-OAHLLOKOSA-N	0	3	338.455	3.144	20	30		EGEDHN
CC[C@H](CC1CCCC1)C(=O)NC[C@@H](C)N(CC)CC#CCOC	ZINC001155606838	1380472993	/nfs/dbraw/zinc/47/29/93/1380472993.db2.gz	AVTXAYBPLGKFCX-IEBWSBKVSA-N	0	3	336.520	3.069	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1	ZINC001155771448	1380491027	/nfs/dbraw/zinc/49/10/27/1380491027.db2.gz	YJHZREXNKXUQJI-FHLIZLRMSA-N	0	3	332.875	3.293	20	30		EGEDHN
C=CCOCCCC(=O)NCCCNCc1cccc(Cl)c1F	ZINC001156160029	1380533317	/nfs/dbraw/zinc/53/33/17/1380533317.db2.gz	LTMDDDITRAYSRK-UHFFFAOYSA-N	0	3	342.842	3.058	20	30		EGEDHN
CCC[C@H](C(=O)NC[C@@H](C)N(CC)CC#CCOC)c1ccccc1	ZINC001156746503	1380626026	/nfs/dbraw/zinc/62/60/26/1380626026.db2.gz	QUMAHOCHTLQFKO-QUCCMNQESA-N	0	3	344.499	3.047	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)Cc1cccc(F)c1	ZINC001755287150	1440802267	/nfs/dbraw/zinc/80/22/67/1440802267.db2.gz	PHJNXCRGMWBUOW-UHFFFAOYSA-N	0	3	326.843	3.195	20	30		EGEDHN
C#CCCCC(=O)NCCCNCc1cc(Cl)ccc1Cl	ZINC001157170470	1380793813	/nfs/dbraw/zinc/79/38/13/1380793813.db2.gz	IFLVDMDRMSCEDP-UHFFFAOYSA-N	0	3	327.255	3.393	20	30		EGEDHN
Cc1c(Cl)c(Cl)nc(N2C[C@H]3CCCN(C)[C@@H]3C2)c1C#N	ZINC001157259099	1380826806	/nfs/dbraw/zinc/82/68/06/1380826806.db2.gz	CQFMOOPPZNKLPV-ZYHUDNBSSA-N	0	3	325.243	3.099	20	30		EGEDHN
CCCN(CCN1CCCCC1)C(=O)[C@H](C)Cc1ccc(C#N)cc1	ZINC001157557741	1380964855	/nfs/dbraw/zinc/96/48/55/1380964855.db2.gz	QNGJAFMRDFQTKK-GOSISDBHSA-N	0	3	341.499	3.461	20	30		EGEDHN
C=C(Cl)CNCC1(O)CCN(C(=O)[C@@H](CCCC)C(C)C)CC1	ZINC001328218173	1388690794	/nfs/dbraw/zinc/69/07/94/1388690794.db2.gz	YSJMPDFOVBLTCL-INIZCTEOSA-N	0	3	344.927	3.144	20	30		EGEDHN
C=CCCC(=O)N1CCCC[C@@H]1CN(C)Cc1cccc(C#N)c1	ZINC001157657001	1380991366	/nfs/dbraw/zinc/99/13/66/1380991366.db2.gz	WDUHZQKOBORUAW-LJQANCHMSA-N	0	3	325.456	3.337	20	30		EGEDHN
C=CCOCC(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(CF)cc1	ZINC001157701668	1381008646	/nfs/dbraw/zinc/00/86/46/1381008646.db2.gz	HVOJVLWMVHUNRK-LJQANCHMSA-N	0	3	348.462	3.172	20	30		EGEDHN
CC(C)(C)C#CC(=O)NCCCNCc1nc(C(C)(C)C)cs1	ZINC001157727439	1381015963	/nfs/dbraw/zinc/01/59/63/1381015963.db2.gz	OFGKJTLNKIAIIJ-UHFFFAOYSA-N	0	3	335.517	3.086	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1ccc([C@@H]2C[C@H]2C)o1	ZINC001157912798	1381068678	/nfs/dbraw/zinc/06/86/78/1381068678.db2.gz	YLGSJNRNWQLFPK-ZYHUDNBSSA-N	0	3	341.249	3.021	20	30		EGEDHN
CN(CCc1ccns1)C[C@H]1CCCCN1C(=O)C#CC(C)(C)C	ZINC001157965250	1381084828	/nfs/dbraw/zinc/08/48/28/1381084828.db2.gz	VXFDBSJGXKACEU-MRXNPFEDSA-N	0	3	347.528	3.048	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1sc(Cl)nc1C	ZINC001158005137	1381099268	/nfs/dbraw/zinc/09/92/68/1381099268.db2.gz	FHAYMDQSXREIPV-GFCCVEGCSA-N	0	3	327.881	3.217	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H]1CCc2cc(C)ccc2O1	ZINC001158220694	1381163290	/nfs/dbraw/zinc/16/32/90/1381163290.db2.gz	AWSUOLWOQUALTB-UYAOXDASSA-N	0	3	342.483	3.188	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)CCOc1ccc(F)cc1	ZINC001158434833	1381245767	/nfs/dbraw/zinc/24/57/67/1381245767.db2.gz	NMVKHZMYLRJROF-QGZVFWFLSA-N	0	3	334.435	3.094	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cccc(N2CC=CC2)c1	ZINC001158529183	1381284303	/nfs/dbraw/zinc/28/43/03/1381284303.db2.gz	JFOZVTHIBHUXCY-HXUWFJFHSA-N	0	3	339.483	3.175	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1sccc1Cl	ZINC001158561167	1381299941	/nfs/dbraw/zinc/29/99/41/1381299941.db2.gz	VMNOXGSJAIDOFQ-UHFFFAOYSA-N	0	3	337.670	3.020	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC001158565172	1381302387	/nfs/dbraw/zinc/30/23/87/1381302387.db2.gz	LCXZUOHSBQXYED-YZGWKJHDSA-N	0	3	342.483	3.298	20	30		EGEDHN
Cc1c(Cl)cccc1C(=O)NCCCNCc1ccccc1C#N	ZINC001158578905	1381307920	/nfs/dbraw/zinc/30/79/20/1381307920.db2.gz	WWRPAENPRFVBCW-UHFFFAOYSA-N	0	3	341.842	3.430	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@H]1CCC(C)=C(C)C1	ZINC001158720852	1381365506	/nfs/dbraw/zinc/36/55/06/1381365506.db2.gz	MMAUFYKLEGGIIO-AWEZNQCLSA-N	0	3	329.282	3.127	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)COC[C@H](C)c1ccccc1	ZINC001158806282	1381407332	/nfs/dbraw/zinc/40/73/32/1381407332.db2.gz	FOYLACPBKDZQOP-AZUAARDMSA-N	0	3	344.499	3.306	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)CCCOc1cccc(F)c1	ZINC001158885829	1381448487	/nfs/dbraw/zinc/44/84/87/1381448487.db2.gz	CWJOLARRLBNDRB-GOSISDBHSA-N	0	3	348.462	3.484	20	30		EGEDHN
N#Cc1ccc(CN2CC=C(CCNC(=O)c3ccco3)CC2)cc1	ZINC001159079966	1381563837	/nfs/dbraw/zinc/56/38/37/1381563837.db2.gz	LQZVFCDLMARVGC-UHFFFAOYSA-N	0	3	335.407	3.103	20	30		EGEDHN
N#Cc1cnn(-c2ccccc2Br)c1NC1=CNCCC1	ZINC001159311042	1381759097	/nfs/dbraw/zinc/75/90/97/1381759097.db2.gz	FAJAKLUQWVYALO-UHFFFAOYSA-N	0	3	344.216	3.143	20	30		EGEDHN
C=CCC[C@@H](C)[N@H+]1CC=C(CCNC(=O)c2ccccc2[O-])CC1	ZINC001159314831	1381759763	/nfs/dbraw/zinc/75/97/63/1381759763.db2.gz	QSYNUDVTSSQTFO-MRXNPFEDSA-N	0	3	328.456	3.499	20	30		EGEDHN
C=CCC[C@@H](C)[N@@H+]1CC=C(CCNC(=O)c2ccccc2[O-])CC1	ZINC001159314831	1381759768	/nfs/dbraw/zinc/75/97/68/1381759768.db2.gz	QSYNUDVTSSQTFO-MRXNPFEDSA-N	0	3	328.456	3.499	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCC1=CCN([C@@H](C)c2cccc(F)c2)CC1	ZINC001159595434	1381842131	/nfs/dbraw/zinc/84/21/31/1381842131.db2.gz	YTAVVGWQJYBVDV-CABCVRRESA-N	0	3	329.419	3.185	20	30		EGEDHN
C=CCOCC(=O)NCCC1=CCN([C@H](C)c2ccc(F)cc2)CC1	ZINC001159619004	1381850757	/nfs/dbraw/zinc/85/07/57/1381850757.db2.gz	ROSDKSRIYQDFJH-MRXNPFEDSA-N	0	3	346.446	3.228	20	30		EGEDHN
CC1CC(C(=O)NCCC2=CCN(Cc3ccc(C#N)cc3)CC2)C1	ZINC001159804121	1381906064	/nfs/dbraw/zinc/90/60/64/1381906064.db2.gz	QISAFCPBTGZXSC-UHFFFAOYSA-N	0	3	337.467	3.243	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CO[C@H]2CCCC[C@H]2CC)CC1	ZINC001160106831	1381998241	/nfs/dbraw/zinc/99/82/41/1381998241.db2.gz	DFNBLXBRKITSDX-MOPGFXCFSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc(-c3cc[nH]n3)s2)CC1	ZINC001160416187	1382098344	/nfs/dbraw/zinc/09/83/44/1382098344.db2.gz	KRUZWZOKIPZFPI-UHFFFAOYSA-N	0	3	342.468	3.076	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H](C)OCc2ccccc2C)CC1	ZINC001160792638	1382197173	/nfs/dbraw/zinc/19/71/73/1382197173.db2.gz	HOEYCXYXLTXGSI-SFHVURJKSA-N	0	3	342.483	3.225	20	30		EGEDHN
CC1(C(=O)NCCC2=CCN(Cc3ccc(C#N)cc3)CC2)CCC1	ZINC001160875859	1382221490	/nfs/dbraw/zinc/22/14/90/1382221490.db2.gz	NUOMDJUIBBPPJM-UHFFFAOYSA-N	0	3	337.467	3.387	20	30		EGEDHN
C=CCN1CCC[C@H]1CNc1ncccc1C(=O)N1CCC(C)CC1	ZINC001160957431	1382250783	/nfs/dbraw/zinc/25/07/83/1382250783.db2.gz	LJNVCZFOYWSZTD-KRWDZBQOSA-N	0	3	342.487	3.016	20	30		EGEDHN
C[C@@H]1C[C@@H]1CC(=O)NCCC1=CCN(Cc2ccc(C#N)cc2)CC1	ZINC001161114540	1382303099	/nfs/dbraw/zinc/30/30/99/1382303099.db2.gz	ZXHVIIULJHZYSA-OXQOHEQNSA-N	0	3	337.467	3.243	20	30		EGEDHN
Cc1nc(NCC2CCN(Cc3ccccc3F)CC2)cnc1C#N	ZINC001161193868	1382336085	/nfs/dbraw/zinc/33/60/85/1382336085.db2.gz	HDUIBIVFQHHYPO-UHFFFAOYSA-N	0	3	339.418	3.120	20	30		EGEDHN
COc1cccc(CN2CC[C@H](Nc3ccc4c(C#N)c[nH]c4n3)C2)c1	ZINC001161193409	1382336641	/nfs/dbraw/zinc/33/66/41/1382336641.db2.gz	YSZYVVFSCSTIQE-INIZCTEOSA-N	0	3	347.422	3.130	20	30		EGEDHN
Cc1cc(C#N)c(NCC2CCN(Cc3ccccn3)CC2)nc1C	ZINC001161242760	1382352593	/nfs/dbraw/zinc/35/25/93/1382352593.db2.gz	GBRBAFHXFPXNJN-UHFFFAOYSA-N	0	3	335.455	3.289	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc(C3CC3)nc2C)CC1	ZINC001161244221	1382353559	/nfs/dbraw/zinc/35/35/59/1382353559.db2.gz	YDKPQQOGELOQIY-UHFFFAOYSA-N	0	3	325.456	3.205	20	30		EGEDHN
CCC(CC)[C@H](C)C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001161428153	1382407514	/nfs/dbraw/zinc/40/75/14/1382407514.db2.gz	RGYXABCVBNJLMB-AWEZNQCLSA-N	0	3	333.451	3.366	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H](C)c2cc(C)oc2C)CC1	ZINC001161477491	1382418553	/nfs/dbraw/zinc/41/85/53/1382418553.db2.gz	DXUZSZYVCLNVTE-INIZCTEOSA-N	0	3	328.456	3.162	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2coc(C3CCCC3)n2)CC1	ZINC001161598367	1382450964	/nfs/dbraw/zinc/45/09/64/1382450964.db2.gz	MTNVBBVJRTZSMB-UHFFFAOYSA-N	0	3	341.455	3.108	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cccc3ccncc32)CC1	ZINC001161622053	1382462239	/nfs/dbraw/zinc/46/22/39/1382462239.db2.gz	JFANDHAIFDODBN-UHFFFAOYSA-N	0	3	333.435	3.010	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2sccc2C2CC2)CC1	ZINC001161817663	1382517598	/nfs/dbraw/zinc/51/75/98/1382517598.db2.gz	BGHNZALFHHXFBU-UHFFFAOYSA-N	0	3	328.481	3.401	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc3ncsc3c2)CC1	ZINC001161818137	1382518841	/nfs/dbraw/zinc/51/88/41/1382518841.db2.gz	OLUSAKNOOUKBRZ-UHFFFAOYSA-N	0	3	327.453	3.234	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)Cc2ccccc2Cl)CC1	ZINC001161824720	1382521713	/nfs/dbraw/zinc/52/17/13/1382521713.db2.gz	OXCOKIKELDZTQV-UHFFFAOYSA-N	0	3	330.859	3.044	20	30		EGEDHN
N#Cc1cc(Cl)nnc1NC[C@@H]1CCCN1Cc1ccccc1	ZINC001161885495	1382540327	/nfs/dbraw/zinc/54/03/27/1382540327.db2.gz	SWRJCKKQWJEGMT-HNNXBMFYSA-N	0	3	327.819	3.078	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cncc3ccccc32)CC1	ZINC001161932038	1382559297	/nfs/dbraw/zinc/55/92/97/1382559297.db2.gz	PSLRBQWIQOWTOE-UHFFFAOYSA-N	0	3	333.435	3.010	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2[nH]c3ccccc3c2OC)CC1	ZINC001161963546	1382574265	/nfs/dbraw/zinc/57/42/65/1382574265.db2.gz	KGFCQZNQMMBKAU-UHFFFAOYSA-N	0	3	339.439	3.115	20	30		EGEDHN
Cc1cc(F)c(C(=O)NCCCNCc2ccccc2C#N)c(F)c1	ZINC001162210348	1382658001	/nfs/dbraw/zinc/65/80/01/1382658001.db2.gz	STQVSHYEPIYBPS-UHFFFAOYSA-N	0	3	343.377	3.055	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCC1(COC)CCN(C[C@H](F)CC)CC1	ZINC001162424988	1382755692	/nfs/dbraw/zinc/75/56/92/1382755692.db2.gz	XNAHETBMSUQKCZ-IAGOWNOFSA-N	0	3	342.499	3.182	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCC1(COC)CCN(C[C@@H](F)CC)CC1	ZINC001162428550	1382756646	/nfs/dbraw/zinc/75/66/46/1382756646.db2.gz	JCIRBNXFLGBYNF-IRXDYDNUSA-N	0	3	342.499	3.182	20	30		EGEDHN
CC(C)C(=O)N(CCNCc1ccc(C#N)cc1)CCc1ccccc1	ZINC001162707298	1382841979	/nfs/dbraw/zinc/84/19/79/1382841979.db2.gz	PYXMKNNBURSDAF-UHFFFAOYSA-N	0	3	349.478	3.375	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C[C@@H](C)CCC	ZINC001162732797	1382850343	/nfs/dbraw/zinc/85/03/43/1382850343.db2.gz	JRKLEZWVSJIOID-IBGZPJMESA-N	0	3	328.500	3.497	20	30		EGEDHN
C=CCCC(=O)N(CCNCc1cccnc1)CCc1ccccc1	ZINC001162732850	1382850395	/nfs/dbraw/zinc/85/03/95/1382850395.db2.gz	LUQSNMWCXLUDFW-UHFFFAOYSA-N	0	3	337.467	3.209	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CCCC2(CC2)C1	ZINC001162810641	1382880754	/nfs/dbraw/zinc/88/07/54/1382880754.db2.gz	OMFLCVXWCKEIQZ-FQEVSTJZSA-N	0	3	338.495	3.251	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C[C@@H]1C=CCCC1	ZINC001162841082	1382891735	/nfs/dbraw/zinc/89/17/35/1382891735.db2.gz	LBIXKBAEBLWYME-OAQYLSRUSA-N	0	3	338.495	3.417	20	30		EGEDHN
C[C@]1(c2ccccc2)C[C@H]1C(=O)NCCCNCc1ccccc1C#N	ZINC001162884357	1382904305	/nfs/dbraw/zinc/90/43/05/1382904305.db2.gz	RCNBWEOKCWJQGP-RBBKRZOGSA-N	0	3	347.462	3.132	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H](C)c1cccc(C)c1	ZINC001162952235	1382925903	/nfs/dbraw/zinc/92/59/03/1382925903.db2.gz	INIVQJVSOLKGPK-FQEVSTJZSA-N	0	3	348.490	3.393	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)CC[C@H](C)CC	ZINC001162964077	1382928943	/nfs/dbraw/zinc/92/89/43/1382928943.db2.gz	SFFOQKREYGJVMX-LJQANCHMSA-N	0	3	328.500	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C[C@@H](C)c1ccccc1	ZINC001162992632	1382940709	/nfs/dbraw/zinc/94/07/09/1382940709.db2.gz	UPGDMPNEWQZOCH-HXUWFJFHSA-N	0	3	348.490	3.474	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CC2CCC1CC2	ZINC001163007592	1382946470	/nfs/dbraw/zinc/94/64/70/1382946470.db2.gz	VHBQHPRHJIMGNZ-XVAXZDLZSA-N	0	3	338.495	3.107	20	30		EGEDHN
N#Cc1ccccc1CNCC1(CCNC(=O)/C=C/c2ccco2)CC1	ZINC001163202469	1382991927	/nfs/dbraw/zinc/99/19/27/1382991927.db2.gz	SYHHPEJWRXSHCC-BQYQJAHWSA-N	0	3	349.434	3.241	20	30		EGEDHN
C=CCc1ccnc(N[C@H]2CNCc3ccsc32)c1C(OC)OC	ZINC001163221650	1382996175	/nfs/dbraw/zinc/99/61/75/1382996175.db2.gz	XFXJFACNTRPCLX-AWEZNQCLSA-N	0	3	345.468	3.419	20	30		EGEDHN
C=CCCC(=O)NCCC1(CNCc2cc(C#N)ccc2F)CC1	ZINC001163768133	1383120282	/nfs/dbraw/zinc/12/02/82/1383120282.db2.gz	YLMWNTJEJJMABH-UHFFFAOYSA-N	0	3	329.419	3.040	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCCNCc1nsc2ccccc21	ZINC001163861060	1383130609	/nfs/dbraw/zinc/13/06/09/1383130609.db2.gz	TVSAWLNZJBLHIC-UHFFFAOYSA-N	0	3	331.485	3.495	20	30		EGEDHN
CS[C@H](C)CC(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001164156220	1383161504	/nfs/dbraw/zinc/16/15/04/1383161504.db2.gz	MJUKDGIZMRGCPF-OAHLLOKOSA-N	0	3	345.512	3.076	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCCNCc1cccc(OC)c1Cl	ZINC001164221946	1383167697	/nfs/dbraw/zinc/16/76/97/1383167697.db2.gz	GXMMTVYTUOEEMT-KBPBESRZSA-N	0	3	338.879	3.403	20	30		EGEDHN
CC/C(C)=C/C(=O)NCCC1(CNCc2cc(C#N)ccc2F)CC1	ZINC001164446709	1383187571	/nfs/dbraw/zinc/18/75/71/1383187571.db2.gz	DBIMCYIABBXLBQ-XNTDXEJSSA-N	0	3	343.446	3.430	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)/C=C(/C)CC)CC1	ZINC001164448056	1383187795	/nfs/dbraw/zinc/18/77/95/1383187795.db2.gz	OVIYAFVGUKDLPV-XFXZXTDPSA-N	0	3	329.282	3.127	20	30		EGEDHN
CC(C)N1CCN(c2c(C#N)cnc3cnc(Cl)cc32)C[C@H]1C	ZINC001165199051	1383245565	/nfs/dbraw/zinc/24/55/65/1383245565.db2.gz	RXIDOSRYESTPNL-GFCCVEGCSA-N	0	3	329.835	3.074	20	30		EGEDHN
C[C@H](C(=O)NCCC1(CNCc2ccccc2C#N)CC1)C1CCC1	ZINC001165696902	1383326793	/nfs/dbraw/zinc/32/67/93/1383326793.db2.gz	MRYWQGQNNDJFSH-INIZCTEOSA-N	0	3	339.483	3.371	20	30		EGEDHN
Cc1cc(C(=O)NCCCNCc2ccccc2C#N)ccc1Cl	ZINC001165712671	1383330904	/nfs/dbraw/zinc/33/09/04/1383330904.db2.gz	CQTYEIXVDUJPHS-UHFFFAOYSA-N	0	3	341.842	3.430	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cc(COC)cs2)CC1	ZINC001165986091	1383374024	/nfs/dbraw/zinc/37/40/24/1383374024.db2.gz	LKMZJELMCUERIM-UHFFFAOYSA-N	0	3	342.892	3.137	20	30		EGEDHN
N#Cc1ccccc1CNCC1(CCNC(=O)[C@]23C[C@H]2CCC3)CC1	ZINC001166287289	1383409172	/nfs/dbraw/zinc/40/91/72/1383409172.db2.gz	QFSIWDAJHIIQTI-WIYYLYMNSA-N	0	3	337.467	3.125	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2nccc3occc32)CC1	ZINC001166316035	1383411121	/nfs/dbraw/zinc/41/11/21/1383411121.db2.gz	YZLSOLCBORWBTM-UHFFFAOYSA-N	0	3	333.819	3.070	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@H]2CCCCC2(F)F)CC1	ZINC001166391353	1383418266	/nfs/dbraw/zinc/41/82/66/1383418266.db2.gz	SGSFIBSQEQLRHH-CYBMUJFWSA-N	0	3	334.838	3.441	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCC1(CNCc2c(C)noc2CC)CC1	ZINC001166579614	1383440764	/nfs/dbraw/zinc/44/07/64/1383440764.db2.gz	LUWACNZWFHABHD-UHFFFAOYSA-N	0	3	333.476	3.134	20	30		EGEDHN
CC#CCCCC(=O)NCCC1(CNCC=C(Cl)Cl)CC1	ZINC001166710464	1383464696	/nfs/dbraw/zinc/46/46/96/1383464696.db2.gz	YHUSBRWDUGQLOT-UHFFFAOYSA-N	0	3	331.287	3.375	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCCC1(CNCc2ccc(F)cn2)CC1	ZINC001166746995	1383470625	/nfs/dbraw/zinc/47/06/25/1383470625.db2.gz	JRKPTLHBPZTBID-HNNXBMFYSA-N	0	3	333.451	3.199	20	30		EGEDHN
Cc1nc(C2CC2)ccc1C(=O)NCCCNCc1ccccc1C#N	ZINC001166918682	1383500255	/nfs/dbraw/zinc/50/02/55/1383500255.db2.gz	XXNRLFLDMUTGIU-UHFFFAOYSA-N	0	3	348.450	3.049	20	30		EGEDHN
C=C1CCC(C(=O)NCCC2(CNCc3cc(C)no3)CC2)CC1	ZINC001167012773	1383518041	/nfs/dbraw/zinc/51/80/41/1383518041.db2.gz	QIHHHINUFSZCOD-UHFFFAOYSA-N	0	3	331.460	3.106	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCC1(CN[C@@H](C)c2cnc(C)cn2)CC1	ZINC001167018446	1383520167	/nfs/dbraw/zinc/52/01/67/1383520167.db2.gz	JNUCSSZKTUOBJK-QFBILLFUSA-N	0	3	344.503	3.324	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@@H](C)c2ccsc2)CC1	ZINC001167193995	1383563581	/nfs/dbraw/zinc/56/35/81/1383563581.db2.gz	IYUXICSXSUACPQ-ZDUSSCGKSA-N	0	3	326.893	3.480	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@@H](C)c2cccs2)CC1	ZINC001167200954	1383565625	/nfs/dbraw/zinc/56/56/25/1383565625.db2.gz	OGLWNVDDIFJXLX-ZDUSSCGKSA-N	0	3	326.893	3.480	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1cc(F)cc(Cl)c1	ZINC001167286663	1383585082	/nfs/dbraw/zinc/58/50/82/1383585082.db2.gz	YHENFKYQQQTXKL-UHFFFAOYSA-N	0	3	345.805	3.260	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)CCc2csc(C)n2)CC1	ZINC001167376693	1383614948	/nfs/dbraw/zinc/61/49/48/1383614948.db2.gz	DYXBQKKHJNMTCE-UHFFFAOYSA-N	0	3	341.908	3.013	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@@H](C)c2c(C)noc2C)CC1	ZINC001167459211	1383638113	/nfs/dbraw/zinc/63/81/13/1383638113.db2.gz	WSWWBLRZNQVECA-LBPRGKRZSA-N	0	3	339.867	3.024	20	30		EGEDHN
Cc1cc2c(cc1C#N)[nH]nc2NC(=O)[C@@H](C(C)C)N1CCCCC1	ZINC001300270143	1383656541	/nfs/dbraw/zinc/65/65/41/1383656541.db2.gz	HGLFAEPTGNLYPJ-QGZVFWFLSA-N	0	3	339.443	3.192	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)[C@@H](C)[C@@H](C)CC)CC1	ZINC001167557058	1383667412	/nfs/dbraw/zinc/66/74/12/1383667412.db2.gz	PGJLTWDPIGBHPL-JSGCOSHPSA-N	0	3	345.325	3.453	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2nc(C3CC3)oc2C)CC1	ZINC001167574277	1383674303	/nfs/dbraw/zinc/67/43/03/1383674303.db2.gz	SGMJBTICXKVVRS-UHFFFAOYSA-N	0	3	337.851	3.103	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc3ccncc3c2)CC1	ZINC001167651887	1383698478	/nfs/dbraw/zinc/69/84/78/1383698478.db2.gz	CBSJYUAENKDSCI-UHFFFAOYSA-N	0	3	343.858	3.477	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc(COC)cc2)CC1	ZINC001168057973	1383805898	/nfs/dbraw/zinc/80/58/98/1383805898.db2.gz	LUPVYHPFJPNBRB-UHFFFAOYSA-N	0	3	336.863	3.075	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@@H](C)c1cc(C)oc1C	ZINC001168458618	1383911587	/nfs/dbraw/zinc/91/15/87/1383911587.db2.gz	UNDYUAMACSCKJJ-LBPRGKRZSA-N	0	3	343.265	3.004	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@@H]2Oc3ccccc3[C@@H]2C)CC1	ZINC001168530100	1383930092	/nfs/dbraw/zinc/93/00/92/1383930092.db2.gz	IHJOMCAZBRSGKZ-WMLDXEAASA-N	0	3	348.874	3.180	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@@H]2Oc3ccccc3[C@H]2C)CC1	ZINC001168530098	1383930185	/nfs/dbraw/zinc/93/01/85/1383930185.db2.gz	IHJOMCAZBRSGKZ-RHSMWYFYSA-N	0	3	348.874	3.180	20	30		EGEDHN
C[C@H](NCCC(=O)Nc1ccc(C#N)c(Cl)c1)c1cncc(F)c1	ZINC001307831537	1384040316	/nfs/dbraw/zinc/04/03/16/1384040316.db2.gz	BDWVPWSFXKJOIF-NSHDSACASA-N	0	3	346.793	3.425	20	30		EGEDHN
CN(C)/C=N/c1ccc(N[C@@H]2CCc3ccccc3[C@H]2O)cc1C#N	ZINC001169627448	1384166649	/nfs/dbraw/zinc/16/66/49/1384166649.db2.gz	IHKDZXIVEPHMLG-COIUQNELSA-N	0	3	334.423	3.240	20	30		EGEDHN
C=CCCC(=O)N[C@@H](C)CCCCNCc1c(C)nn(C)c1Cl	ZINC001169712331	1384176755	/nfs/dbraw/zinc/17/67/55/1384176755.db2.gz	BWOGQOVPZHQGRI-ZDUSSCGKSA-N	0	3	340.899	3.113	20	30		EGEDHN
CCC(CC)n1ccc(CNCCCC[C@H](C)NC(=O)[C@@H](C)C#N)n1	ZINC001169849448	1384191108	/nfs/dbraw/zinc/19/11/08/1384191108.db2.gz	WQCDPVAWSULHAJ-HOTGVXAUSA-N	0	3	347.507	3.168	20	30		EGEDHN
CN(C)/C=N/c1ccc(NCc2cccnc2N2CCCC2)cc1C#N	ZINC001169859976	1384192410	/nfs/dbraw/zinc/19/24/10/1384192410.db2.gz	VYZSDRADOOUSSN-BUVRLJJBSA-N	0	3	348.454	3.387	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)C1CC(C)C1	ZINC001170109721	1384236991	/nfs/dbraw/zinc/23/69/91/1384236991.db2.gz	CNXVKMLGAAXRLO-WUJZJPHMSA-N	0	3	327.472	3.369	20	30		EGEDHN
Cc1cc[nH]c1C(=O)N[C@@H](C)CCCCNCc1ccccc1C#N	ZINC001170514472	1384333174	/nfs/dbraw/zinc/33/31/74/1384333174.db2.gz	DXFZUKVHQSNOTJ-INIZCTEOSA-N	0	3	338.455	3.273	20	30		EGEDHN
CC(C)C[C@H](C)CC(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001170828415	1384393357	/nfs/dbraw/zinc/39/33/57/1384393357.db2.gz	BKPQAVLZYRWWMH-HNNXBMFYSA-N	0	3	333.451	3.366	20	30		EGEDHN
CC(C)C[C@H]([NH2+][C@@H]1CCc2cc(Cl)c(Cl)cc2C1)C(=O)N[O-]	ZINC001171149632	1384455123	/nfs/dbraw/zinc/45/51/23/1384455123.db2.gz	KCBDPJFLDVMJOS-DOMZBBRYSA-N	0	3	345.270	3.360	20	30		EGEDHN
C[C@@H](Cc1cccc(C#N)c1)N1CC[C@@H](C)[C@](O)(C(F)(F)F)C1	ZINC001171204694	1384467907	/nfs/dbraw/zinc/46/79/07/1384467907.db2.gz	ZTEGMUDTOCAGHO-WWGRRREGSA-N	0	3	326.362	3.124	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H](C)CCCCNCc1nccs1	ZINC001171260874	1384481004	/nfs/dbraw/zinc/48/10/04/1384481004.db2.gz	NUMKTMKGVQKNDW-HNNXBMFYSA-N	0	3	346.500	3.209	20	30		EGEDHN
CC[C@@H](CC(=O)NCCCNCc1ccc(C#N)cc1F)C(C)C	ZINC001171560720	1384562853	/nfs/dbraw/zinc/56/28/53/1384562853.db2.gz	HOMXPSMQMILXMO-INIZCTEOSA-N	0	3	333.451	3.366	20	30		EGEDHN
C[C@H](CCCC#N)N1CCO[C@H]2[C@H]1CC[C@H]2COCc1cccnc1	ZINC001172498257	1384806042	/nfs/dbraw/zinc/80/60/42/1384806042.db2.gz	KFUMRPQRWXDYNG-GSEOLPGOSA-N	0	3	343.471	3.160	20	30		EGEDHN
N#Cc1ccc(C2(N[C@@H]3CCN(Cc4ccccc4)C(=O)C3)CC2)cc1	ZINC001172678918	1384832098	/nfs/dbraw/zinc/83/20/98/1384832098.db2.gz	HRXQOZIJFMDKOU-HXUWFJFHSA-N	0	3	345.446	3.328	20	30		EGEDHN
C[C@H](CCN(C)C(=O)OC(C)(C)C)NC(=N)c1ccc(Cl)cn1	ZINC001172953915	1384888641	/nfs/dbraw/zinc/88/86/41/1384888641.db2.gz	LMAAPGQBADIVKI-LLVKDONJSA-N	0	3	340.855	3.086	20	30		EGEDHN
C=CCOC1CCC(N2CC3(CCN3Cc3ccccc3)C2)CC1	ZINC001173327790	1384960393	/nfs/dbraw/zinc/96/03/93/1384960393.db2.gz	RXIBTJBCVXISQF-UHFFFAOYSA-N	0	3	326.484	3.461	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@]1(F)CCN(C2CCC(CC#N)CC2)C1	ZINC001173339133	1384961732	/nfs/dbraw/zinc/96/17/32/1384961732.db2.gz	DNOQTZOPFGIHPV-JTTJXQCZSA-N	0	3	339.455	3.398	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)c1sc(C)cc1C	ZINC001317395572	1385112961	/nfs/dbraw/zinc/11/29/61/1385112961.db2.gz	RGQQPFGKSKLUNO-LLVKDONJSA-N	0	3	345.306	3.372	20	30		EGEDHN
C=C(Br)CN[C@@H](C)CCNC(=O)C(C)(C)CC(C)C	ZINC001317410686	1385121832	/nfs/dbraw/zinc/12/18/32/1385121832.db2.gz	LVHKZGMCXOHSAF-ZDUSSCGKSA-N	0	3	333.314	3.452	20	30		EGEDHN
CCOC(=O)[C@H]1CCCc2sc(Nc3ccnc(C)c3)c(C#N)c21	ZINC001174651877	1385130643	/nfs/dbraw/zinc/13/06/43/1385130643.db2.gz	PKXIVGNYJFVZIJ-ZDUSSCGKSA-N	0	3	341.436	3.472	20	30		EGEDHN
C[C@@H](CCCCNCc1cc(F)ccc1C#N)NC(=O)[C@@H]1C[C@H]1C	ZINC001174713099	1385138641	/nfs/dbraw/zinc/13/86/41/1385138641.db2.gz	MLUDYVOBFJXSQH-QWQRMKEZSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@H](C)CCCCNCc1cn(C(C)C)nn1	ZINC001174849182	1385159632	/nfs/dbraw/zinc/15/96/32/1385159632.db2.gz	KOJAKSRFUPJRNG-DLBZAZTESA-N	0	3	349.523	3.226	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)C1(CF)CC1	ZINC001175191746	1385216008	/nfs/dbraw/zinc/21/60/08/1385216008.db2.gz	XYWNKPUVFPXHBA-OAHLLOKOSA-N	0	3	331.435	3.073	20	30		EGEDHN
CCCN(CCNC(=O)[C@@H](C)C#N)Cc1ccc(Cl)c(Cl)c1	ZINC001317538389	1385271505	/nfs/dbraw/zinc/27/15/05/1385271505.db2.gz	KKVPFUWQQODCSV-LBPRGKRZSA-N	0	3	342.270	3.481	20	30		EGEDHN
CCN1CCN(c2ccc(Nc3cc(OC)ccc3C#N)cc2)CC1	ZINC001175782928	1385404567	/nfs/dbraw/zinc/40/45/67/1385404567.db2.gz	ZDKMVTONVNCIDZ-UHFFFAOYSA-N	0	3	336.439	3.452	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)C(=O)NCCCNCc1cc(C)no1	ZINC001176743662	1385679799	/nfs/dbraw/zinc/67/97/99/1385679799.db2.gz	CATHPTGBJVMYGS-SFHVURJKSA-N	0	3	341.455	3.014	20	30		EGEDHN
C=C[C@@H](C(=O)NCCCNCc1cc(C2CC2)no1)c1ccccc1	ZINC001176781445	1385694728	/nfs/dbraw/zinc/69/47/28/1385694728.db2.gz	DFQSRMYPWKGJQH-GOSISDBHSA-N	0	3	339.439	3.118	20	30		EGEDHN
CC1(C)CCC[C@@H](C(=O)NCCCNCc2ccccc2C#N)C1	ZINC001177155528	1385836183	/nfs/dbraw/zinc/83/61/83/1385836183.db2.gz	KEBBNUNCLUTZPZ-MRXNPFEDSA-N	0	3	327.472	3.371	20	30		EGEDHN
C=CCc1ccc(OC[C@@H](O)CN2CC(C)(C)C2(C)C)c(OC)c1	ZINC001318972052	1385903228	/nfs/dbraw/zinc/90/32/28/1385903228.db2.gz	YXPSFLYVRAADDX-INIZCTEOSA-N	0	3	333.472	3.284	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@@H]1CC1(F)F	ZINC001177308655	1385907022	/nfs/dbraw/zinc/90/70/22/1385907022.db2.gz	MFFRYJDIAQXBRW-AWEZNQCLSA-N	0	3	334.838	3.393	20	30		EGEDHN
Cc1cc(CNCCCN(CC2CCCC2)C(=O)C#CC(C)C)on1	ZINC001177311858	1385909127	/nfs/dbraw/zinc/90/91/27/1385909127.db2.gz	NQUIWMVPOLILFM-UHFFFAOYSA-N	0	3	345.487	3.141	20	30		EGEDHN
O=C(CC1CC(F)(F)C1)N1CCC[C@@H]1CNCC#Cc1ccccc1	ZINC001319085379	1385956592	/nfs/dbraw/zinc/95/65/92/1385956592.db2.gz	RNXBKZNGPIUBHG-GOSISDBHSA-N	0	3	346.421	3.054	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)c1sc(C(C)(C)C)nc1C	ZINC001177491585	1385977341	/nfs/dbraw/zinc/97/73/41/1385977341.db2.gz	ZEDLDIDHBMRABN-UHFFFAOYSA-N	0	3	329.897	3.211	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2Cl)CCN1C(=O)C1CCC1	ZINC001178026073	1386111083	/nfs/dbraw/zinc/11/10/83/1386111083.db2.gz	JDIHKMKLKPBGKV-KSSFIOAISA-N	0	3	330.859	3.071	20	30		EGEDHN
COc1ccc(C#N)cc1CNC[C@H](C)N(C)C(=O)C(C)(C)C(C)C	ZINC001319463960	1386133050	/nfs/dbraw/zinc/13/30/50/1386133050.db2.gz	LKXYABTZNXWIAM-HNNXBMFYSA-N	0	3	345.487	3.186	20	30		EGEDHN
CCCCC(=O)N1CC[C@H](NCC#Cc2cccc(Cl)c2)[C@@H]1C	ZINC001178139700	1386139313	/nfs/dbraw/zinc/13/93/13/1386139313.db2.gz	MYLLTTDKMBJXQG-YJBOKZPZSA-N	0	3	332.875	3.461	20	30		EGEDHN
CCCCC(=O)N1CC[C@H](NCC#Cc2ccc(Cl)cc2)[C@@H]1C	ZINC001178140139	1386140278	/nfs/dbraw/zinc/14/02/78/1386140278.db2.gz	XCYWQPFQEDQVHJ-YJBOKZPZSA-N	0	3	332.875	3.461	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)CCCC(F)(F)F)CCCC1	ZINC001698633615	1406277526	/nfs/dbraw/zinc/27/75/26/1406277526.db2.gz	IVWWYNAKLBLFID-UHFFFAOYSA-N	0	3	326.790	3.490	20	30		EGEDHN
CCC(=CC(=O)N1CC[C@H](NCc2ccc(C#N)s2)[C@@H]1C)CC	ZINC001178477121	1386228572	/nfs/dbraw/zinc/22/85/72/1386228572.db2.gz	BQAHRCIDFSIUAU-GUYCJALGSA-N	0	3	331.485	3.445	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2Cl)CCN1C(=O)[C@H]1CC1(C)C	ZINC001178480990	1386230517	/nfs/dbraw/zinc/23/05/17/1386230517.db2.gz	HMUWVFCGMVZOPN-LESCRADOSA-N	0	3	344.886	3.317	20	30		EGEDHN
CC[C@@H](C)CC(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@@H]1C	ZINC001178567204	1386250975	/nfs/dbraw/zinc/25/09/75/1386250975.db2.gz	NBQQYKUBKVOEQC-GJYPPUQNSA-N	0	3	330.447	3.192	20	30		EGEDHN
CC1(C)CCC[C@]1(O)CNCc1cc(C#N)ccc1Br	ZINC001178795261	1386307442	/nfs/dbraw/zinc/30/74/42/1386307442.db2.gz	JFZFBAXWGXTKIW-INIZCTEOSA-N	0	3	337.261	3.352	20	30		EGEDHN
CC(C)CCC(=O)NC[C@@H](NCc1cc(C#N)ccc1F)C(C)C	ZINC001319896973	1386372850	/nfs/dbraw/zinc/37/28/50/1386372850.db2.gz	RGPTXFFITXVHAO-GOSISDBHSA-N	0	3	333.451	3.364	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCCCCCNCc1cn(C(C)C)nn1	ZINC001179306754	1386445823	/nfs/dbraw/zinc/44/58/23/1386445823.db2.gz	LLTOSCPCHWCNJU-SJORKVTESA-N	0	3	349.523	3.083	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCCCCCCNCc1cn(C(C)C)nn1	ZINC001179335804	1386454715	/nfs/dbraw/zinc/45/47/15/1386454715.db2.gz	QZTRRQLXBIUFSE-KRWDZBQOSA-N	0	3	349.523	3.228	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)c1occc1Cl	ZINC001179486675	1386495941	/nfs/dbraw/zinc/49/59/41/1386495941.db2.gz	PBUSRHMGFGTYIQ-YOEHRIQHSA-N	0	3	342.826	3.177	20	30		EGEDHN
CC(C)CCCC(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C	ZINC001179590002	1386525242	/nfs/dbraw/zinc/52/52/42/1386525242.db2.gz	IYVSQXQIDXRSHC-ICSRJNTNSA-N	0	3	326.484	3.443	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1ccc(C)cc1OC)C1CC1	ZINC001698654356	1406304354	/nfs/dbraw/zinc/30/43/54/1406304354.db2.gz	SWJKXPDALYNWMR-SFHVURJKSA-N	0	3	336.863	3.244	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCC2CC2)C[C@@]1(C)CNCc1ccccc1C#N	ZINC001180960710	1386907855	/nfs/dbraw/zinc/90/78/55/1386907855.db2.gz	SGXOSRGIMZQLHV-IIBYNOLFSA-N	0	3	339.483	3.323	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2nc(C)sc2C)C1	ZINC001181315300	1386975629	/nfs/dbraw/zinc/97/56/29/1386975629.db2.gz	PIWZMQWQQBFDAT-AUUYWEPGSA-N	0	3	347.528	3.138	20	30		EGEDHN
CCC[C@@H](C)CC(=O)N1CC[C@@H](NCc2ccc(OC)c(C#N)c2)C1	ZINC001181502170	1387006357	/nfs/dbraw/zinc/00/63/57/1387006357.db2.gz	OCYOZLIQNDEXTK-CRAIPNDOSA-N	0	3	343.471	3.084	20	30		EGEDHN
CCc1sc(C(=O)N[C@@H](C)CNCc2ccc(C#N)s2)cc1C	ZINC001322070370	1387044901	/nfs/dbraw/zinc/04/49/01/1387044901.db2.gz	SLMKYQGXVXMQRY-LBPRGKRZSA-N	0	3	347.509	3.460	20	30		EGEDHN
C[C@@H](CN(C)Cc1cccc(C#N)c1)NC(=O)c1ccccc1Cl	ZINC001322287218	1387142761	/nfs/dbraw/zinc/14/27/61/1387142761.db2.gz	YGFJNYLUTUYEBQ-AWEZNQCLSA-N	0	3	341.842	3.462	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H](C)[C@](C)(CNCc3ocnc3C)C2)CC1	ZINC001182500113	1387178342	/nfs/dbraw/zinc/17/83/42/1387178342.db2.gz	SHSZOVHQCOFRPS-FOIQADDNSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCOc1ccccc1[C@H](C)NC(=O)[C@@H]1CCCN1CC1CC1	ZINC001182560182	1387187687	/nfs/dbraw/zinc/18/76/87/1387187687.db2.gz	DOPGLMSKWZGHGG-YJBOKZPZSA-N	0	3	328.456	3.303	20	30		EGEDHN
N#Cc1ccc(C(=O)NC[C@H](c2ccccc2)N2CCCC2)c(F)c1	ZINC001336871185	1389191947	/nfs/dbraw/zinc/19/19/47/1389191947.db2.gz	HWSQVPLHLYPSHD-LJQANCHMSA-N	0	3	337.398	3.264	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(c3cc(Cl)ccn3)CC2)cc1	ZINC001336957081	1389220808	/nfs/dbraw/zinc/22/08/08/1389220808.db2.gz	DKIHRUMWUYZXCL-UHFFFAOYSA-N	0	3	326.831	3.319	20	30		EGEDHN
C[C@H](NC[C@H](O)COc1ccc(C#N)cc1)c1ccc(Cl)c(F)c1	ZINC001337222182	1389279563	/nfs/dbraw/zinc/27/95/63/1389279563.db2.gz	WSJIUMAPSYFYGI-WFASDCNBSA-N	0	3	348.805	3.441	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N1CC[C@@H](C)C[C@@H](C)C1	ZINC001338851094	1389790589	/nfs/dbraw/zinc/79/05/89/1389790589.db2.gz	IERYOFAMVBKANL-ZACQAIPSSA-N	0	3	331.508	3.146	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CN1Cc2ccccc2C2(CCC2)C1	ZINC001331589170	1389815318	/nfs/dbraw/zinc/81/53/18/1389815318.db2.gz	DXJVNYUOVZMUAC-LJQANCHMSA-N	0	3	348.446	3.235	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N[C@H](CC)c1nc(C(F)(F)F)cs1	ZINC001339993451	1390204891	/nfs/dbraw/zinc/20/48/91/1390204891.db2.gz	ROQAVWGSTXLRKN-NXEZZACHSA-N	0	3	335.395	3.413	20	30		EGEDHN
CC(C)C(=O)NCc1ccc(CNCc2ccc(C#N)cc2)cc1F	ZINC001333463229	1390310809	/nfs/dbraw/zinc/31/08/09/1390310809.db2.gz	XNSPTAMUZDPKOA-UHFFFAOYSA-N	0	3	339.414	3.259	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)NCc1cc(Cl)ccc1OC(F)F	ZINC001341501847	1390494977	/nfs/dbraw/zinc/49/49/77/1390494977.db2.gz	IAQRGZKYILEAFX-GFCCVEGCSA-N	0	3	332.778	3.241	20	30		EGEDHN
C[C@H](Sc1ccc(F)cc1)C(=O)C(C#N)C(=O)NC1CCCC1	ZINC001342011901	1390561650	/nfs/dbraw/zinc/56/16/50/1390561650.db2.gz	XWPKJLYYLHIJGQ-XHDPSFHLSA-N	0	3	334.416	3.074	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CCCN(C)C2)nnc1N(C)Cc1cccs1	ZINC001342354583	1390604450	/nfs/dbraw/zinc/60/44/50/1390604450.db2.gz	HLFBTEMXXMSUBD-HNNXBMFYSA-N	0	3	345.516	3.361	20	30		EGEDHN
N#CC(C(=O)c1cc(C2CC2)[nH]n1)c1nccn1Cc1ccccc1	ZINC001342604340	1390631015	/nfs/dbraw/zinc/63/10/15/1390631015.db2.gz	OSAOFZNKMCTKPG-OAHLLOKOSA-N	0	3	331.379	3.022	20	30		EGEDHN
C=C(C)Cn1c([C@@H](C)SC)nnc1N1CCN([C@H](C)CC)CC1	ZINC001343669624	1390729938	/nfs/dbraw/zinc/72/99/38/1390729938.db2.gz	OXQZLQOJRDRCAR-HUUCEWRRSA-N	0	3	337.537	3.199	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCc1ncc(-c2ccccc2)o1	ZINC001344322815	1390782002	/nfs/dbraw/zinc/78/20/02/1390782002.db2.gz	YVVRVIHOEDEVBS-OAHLLOKOSA-N	0	3	334.379	3.367	20	30		EGEDHN
Cc1ncncc1C(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1Cl	ZINC001344544874	1390798788	/nfs/dbraw/zinc/79/87/88/1390798788.db2.gz	WWZLHZJAAOCACJ-JTQLQIEISA-N	0	3	349.177	3.053	20	30		EGEDHN
CC(=O)N[C@@](C)(C(=O)C(C#N)c1ncc(C(C)(C)C)s1)C(C)C	ZINC001344603684	1390802474	/nfs/dbraw/zinc/80/24/74/1390802474.db2.gz	KDFRSTVQZZFYNJ-YVEFUNNKSA-N	0	3	335.473	3.168	20	30		EGEDHN
CC(=O)N[C@](C)(C(=O)C(C#N)c1ncc(C(C)(C)C)s1)C(C)C	ZINC001344603682	1390802593	/nfs/dbraw/zinc/80/25/93/1390802593.db2.gz	KDFRSTVQZZFYNJ-SJCJKPOMSA-N	0	3	335.473	3.168	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCCOCCc1ccccc1	ZINC001346097155	1390907329	/nfs/dbraw/zinc/90/73/29/1390907329.db2.gz	ZBPHNXJFZGATPV-KRWDZBQOSA-N	0	3	325.412	3.119	20	30		EGEDHN
C=CCN(Cc1ccccc1)c1nnc([C@H]2CCCN(C)C2)n1CC	ZINC001352967279	1391897073	/nfs/dbraw/zinc/89/70/73/1391897073.db2.gz	SNVMJGAVQLLBCR-SFHVURJKSA-N	0	3	339.487	3.300	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCCC[C@@H]1CNCc1ncccc1C	ZINC001480345954	1392698196	/nfs/dbraw/zinc/69/81/96/1392698196.db2.gz	OLDGJJNDYOEXLW-QGZVFWFLSA-N	0	3	329.488	3.463	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)C1(Cc2ccc(F)cc2)CC1	ZINC001480797220	1392939420	/nfs/dbraw/zinc/93/94/20/1392939420.db2.gz	NLTRHYQVAWDADN-CQSZACIVSA-N	0	3	338.854	3.385	20	30		EGEDHN
CCN(CCNC(=O)[C@@H](F)c1ccccc1)Cc1ccc(C#N)cc1	ZINC001481003045	1393081950	/nfs/dbraw/zinc/08/19/50/1393081950.db2.gz	XJPFWRYUFXPEHX-IBGZPJMESA-N	0	3	339.414	3.207	20	30		EGEDHN
CC[C@@H](CNC(=O)c1ccc(F)c(C)c1)NCc1ccc(C#N)s1	ZINC001481849420	1394558582	/nfs/dbraw/zinc/55/85/82/1394558582.db2.gz	JSHVDKHGKJQAKL-AWEZNQCLSA-N	0	3	345.443	3.366	20	30		EGEDHN
N#Cc1ccc(CNCC2(NC(=O)[C@@H]3CC34CC4)CCCC2)c(F)c1	ZINC001481906776	1394590285	/nfs/dbraw/zinc/59/02/85/1394590285.db2.gz	SAXDIQCFGQJCCN-INIZCTEOSA-N	0	3	341.430	3.016	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1sc(C2CC2)nc1C)C(C)C	ZINC001698960573	1406713240	/nfs/dbraw/zinc/71/32/40/1406713240.db2.gz	HNCOTRGZHAFLDX-CYBMUJFWSA-N	0	3	341.908	3.425	20	30		EGEDHN
Cc1cc(C)c(C(=O)NC[C@H](C)CNCc2ccccc2C#N)s1	ZINC001482105112	1394748768	/nfs/dbraw/zinc/74/87/68/1394748768.db2.gz	DTRXXOFVOGXHQL-CYBMUJFWSA-N	0	3	341.480	3.392	20	30		EGEDHN
C[C@H](C(=O)NC[C@@H](C)CNCc1ccccc1C#N)c1cccs1	ZINC001482141494	1394767114	/nfs/dbraw/zinc/76/71/14/1394767114.db2.gz	DFCPZFRKCHHIQY-GJZGRUSLSA-N	0	3	341.480	3.265	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)CCCC(F)(F)F	ZINC001482142535	1394767513	/nfs/dbraw/zinc/76/75/13/1394767513.db2.gz	MJYPYGSQDSRSCD-CYBMUJFWSA-N	0	3	341.377	3.133	20	30		EGEDHN
CCC(CC)C(=O)NC[C@H](NCc1cc(C#N)ccc1F)C(C)C	ZINC001698964520	1406720942	/nfs/dbraw/zinc/72/09/42/1406720942.db2.gz	XUZKOAOGQYCPLT-SFHVURJKSA-N	0	3	333.451	3.364	20	30		EGEDHN
Cc1coc(C)c1C(=O)N(C)[C@@H](C)CNCc1ccc(F)c(C#N)c1	ZINC001482279138	1394862855	/nfs/dbraw/zinc/86/28/55/1394862855.db2.gz	JHOSNXYCSXJPBK-ZDUSSCGKSA-N	0	3	343.402	3.158	20	30		EGEDHN
Cc1ccc(C(=O)N(C)[C@@H](C)CNCc2ccc(C#N)s2)c(C)c1	ZINC001482363547	1394926309	/nfs/dbraw/zinc/92/63/09/1394926309.db2.gz	YYIRRGYUJNHGLB-HNNXBMFYSA-N	0	3	341.480	3.487	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1ccc2ncccc2c1)C(C)C	ZINC001698971378	1406735767	/nfs/dbraw/zinc/73/57/67/1406735767.db2.gz	IGBYHRSJINHYDE-QGZVFWFLSA-N	0	3	331.847	3.331	20	30		EGEDHN
CC(C)(C)[C@@H]1C[C@H]1C(=O)N1CCC[C@@H]1CNCC#Cc1ccccc1	ZINC001483937426	1395152374	/nfs/dbraw/zinc/15/23/74/1395152374.db2.gz	KREQTQRXDWYZOQ-VAMGGRTRSA-N	0	3	338.495	3.301	20	30		EGEDHN
CC(C)[C@H](CNC(=O)C(C)(C)C1CC1)NCc1ccc(C#N)cc1F	ZINC001698975464	1406743854	/nfs/dbraw/zinc/74/38/54/1406743854.db2.gz	KLLRHRCZTYNDFI-SFHVURJKSA-N	0	3	345.462	3.364	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cc(C(F)(F)F)ccn1)C(C)C	ZINC001698977577	1406749587	/nfs/dbraw/zinc/74/95/87/1406749587.db2.gz	KNBCXOLQZFPVBO-CYBMUJFWSA-N	0	3	349.784	3.197	20	30		EGEDHN
CCC(=O)NCc1ccc([C@H](C)NCc2ccc(C#N)s2)cc1	ZINC001484557642	1395439481	/nfs/dbraw/zinc/43/94/81/1395439481.db2.gz	VNIPLASCNWAMCV-ZDUSSCGKSA-N	0	3	327.453	3.497	20	30		EGEDHN
Cc1cc(C)cc(C(=O)NC[C@@H](C)N(C)Cc2cccc(C#N)c2)c1	ZINC001485377616	1395857940	/nfs/dbraw/zinc/85/79/40/1395857940.db2.gz	LAAGSYBFWKANLJ-QGZVFWFLSA-N	0	3	335.451	3.425	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)[C@@H](CC(C)C)OC)CC1	ZINC001505399533	1396287246	/nfs/dbraw/zinc/28/72/46/1396287246.db2.gz	QIEZKLZSULBCSX-QGZVFWFLSA-N	0	3	344.927	3.361	20	30		EGEDHN
CCN(CCNC(=O)CCc1ccsc1)Cc1ccc(C#N)cc1	ZINC001492966470	1396330045	/nfs/dbraw/zinc/33/00/45/1396330045.db2.gz	VEKUSWYDTJBIIX-UHFFFAOYSA-N	0	3	341.480	3.191	20	30		EGEDHN
CCN(CCNC(=O)[C@H]1CCCCC1(F)F)Cc1ccc(C#N)cc1	ZINC001492992700	1396330831	/nfs/dbraw/zinc/33/08/31/1396330831.db2.gz	JQEXVGYJCWQWOZ-QGZVFWFLSA-N	0	3	349.425	3.322	20	30		EGEDHN
C=C(Br)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1ccco1	ZINC001689897360	1404192318	/nfs/dbraw/zinc/19/23/18/1404192318.db2.gz	XCQIXZKUMGJEAS-OLZOCXBDSA-N	0	3	341.249	3.161	20	30		EGEDHN
Cc1scc(C(=O)NC[C@@H](C)NCc2ccc(F)c(C#N)c2)c1C	ZINC001690579226	1404638590	/nfs/dbraw/zinc/63/85/90/1404638590.db2.gz	KSWRLMHRXODJOS-LLVKDONJSA-N	0	3	345.443	3.284	20	30		EGEDHN
CCCc1occc1C(=O)NC[C@@H](C)NCc1ccc(C#N)s1	ZINC001690638966	1404671045	/nfs/dbraw/zinc/67/10/45/1404671045.db2.gz	SKPHNHCLSVNZKM-GFCCVEGCSA-N	0	3	331.441	3.073	20	30		EGEDHN
CCN(CCNC(=O)Cc1ccccc1C)Cc1cccc(C#N)c1	ZINC001691052009	1404968779	/nfs/dbraw/zinc/96/87/79/1404968779.db2.gz	AJIGGOUOICXZPW-UHFFFAOYSA-N	0	3	335.451	3.048	20	30		EGEDHN
C[C@@H](C(=O)NC[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1)C1CCC1	ZINC001691795116	1405506562	/nfs/dbraw/zinc/50/65/62/1405506562.db2.gz	YOPXBLPDDXGAAV-DDUZABMNSA-N	0	3	343.446	3.118	20	30		EGEDHN
N#Cc1ccc(F)c(CNCC2(NC(=O)[C@H]3CC34CC4)CCCC2)c1	ZINC001732236620	1428482797	/nfs/dbraw/zinc/48/27/97/1428482797.db2.gz	WJIWXOVNFBOZJM-MRXNPFEDSA-N	0	3	341.430	3.016	20	30		EGEDHN
CC/C=C(\C)C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)c(F)c1	ZINC001699745687	1413155913	/nfs/dbraw/zinc/15/59/13/1413155913.db2.gz	HEJYBHRAXMSAPS-DRESWSQNSA-N	0	3	329.419	3.134	20	30		EGEDHN
C[C@@H](C(=O)N1CCCC[C@@H]1CNCC#Cc1ccccc1)C1CCC1	ZINC001700124947	1413540884	/nfs/dbraw/zinc/54/08/84/1413540884.db2.gz	FIOBBKOEHMJHLJ-WIYYLYMNSA-N	0	3	338.495	3.445	20	30		EGEDHN
Cc1cc(C)c(C(=O)NCC2(NCc3ccc(C#N)s3)CCC2)o1	ZINC001700129762	1413545203	/nfs/dbraw/zinc/54/52/03/1413545203.db2.gz	DHRRDJAWSGZTLJ-UHFFFAOYSA-N	0	3	343.452	3.272	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1ccc(N(C)C)cc1	ZINC001700447399	1414025664	/nfs/dbraw/zinc/02/56/64/1414025664.db2.gz	ARQBZGFASVOUPJ-UHFFFAOYSA-N	0	3	337.895	3.193	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)Cc2ccc(C)cc2Cl)C1	ZINC001707085151	1417192532	/nfs/dbraw/zinc/19/25/32/1417192532.db2.gz	QEGCWOWHZKRVHP-CTYIDZIISA-N	0	3	341.282	3.428	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)Cc1ccc(F)cc1	ZINC001707439637	1417343613	/nfs/dbraw/zinc/34/36/13/1417343613.db2.gz	TYSXMDOUURFLEJ-YOEHRIQHSA-N	0	3	338.854	3.480	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)Cc1ccc(F)cc1	ZINC001707439631	1417343689	/nfs/dbraw/zinc/34/36/89/1417343689.db2.gz	TYSXMDOUURFLEJ-PBHICJAKSA-N	0	3	338.854	3.480	20	30		EGEDHN
C#CCCN1CCC[C@H](NC(=O)CCCc2cc(C)sc2C)C1	ZINC001713065008	1417622717	/nfs/dbraw/zinc/62/27/17/1417622717.db2.gz	DITXCKCHOVHIFT-SFHVURJKSA-N	0	3	332.513	3.292	20	30		EGEDHN
CC(C)CC(=O)N[C@H](C)[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001713270845	1417882857	/nfs/dbraw/zinc/88/28/57/1417882857.db2.gz	FMAXMLRCKFDZSF-APWZRJJASA-N	0	3	327.472	3.321	20	30		EGEDHN
C=CCCCN1CCC[C@@H](NC(=O)c2c(F)cc(OC)cc2F)C1	ZINC001713792095	1418610241	/nfs/dbraw/zinc/61/02/41/1418610241.db2.gz	IYQMZSHLYDHBOD-CYBMUJFWSA-N	0	3	338.398	3.134	20	30		EGEDHN
C=C(Br)CNCC1(NC(=O)[C@@H](CC)SC)CCCC1	ZINC001714132237	1418935377	/nfs/dbraw/zinc/93/53/77/1418935377.db2.gz	RLBIDYUYIVMEBB-GFCCVEGCSA-N	0	3	349.338	3.055	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)Cc1cc(C)cc(C)c1)C1CC1	ZINC001714172102	1418980139	/nfs/dbraw/zinc/98/01/39/1418980139.db2.gz	QEZZKFGRBSZRGV-IBGZPJMESA-N	0	3	334.891	3.473	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2[nH]c(C)nc2C)CCCC[C@H]1C	ZINC001714185753	1418992888	/nfs/dbraw/zinc/99/28/88/1418992888.db2.gz	CQYZFTRJVWAFFS-DIFFPNOSSA-N	0	3	338.883	3.047	20	30		EGEDHN
CC[C@@H](N[C@@H](C)CNC(=O)c1cc(C#N)c[nH]1)c1ccc(F)cc1F	ZINC001714222600	1419017061	/nfs/dbraw/zinc/01/70/61/1419017061.db2.gz	LJGLGKWNXKXTSD-MEDUHNTESA-N	0	3	346.381	3.024	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@@H](C)CNCc2ccccc2C#N)c(C)c1	ZINC001714453351	1419185999	/nfs/dbraw/zinc/18/59/99/1419185999.db2.gz	VTFGVLGHZIUVHU-INIZCTEOSA-N	0	3	335.451	3.331	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1cc2ccc(OC)cc2[nH]1	ZINC001714482870	1419205742	/nfs/dbraw/zinc/20/57/42/1419205742.db2.gz	YLCROJUYLOTBPL-LBPRGKRZSA-N	0	3	335.835	3.027	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccc3c(c2)CCOC3)CCCC1	ZINC001714497971	1419222531	/nfs/dbraw/zinc/22/25/31/1419222531.db2.gz	YVXFSNQJEVJVSM-UHFFFAOYSA-N	0	3	348.874	3.144	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)N(C)C(=O)[C@@H](C)c1ccccc1	ZINC001714823588	1419533532	/nfs/dbraw/zinc/53/35/32/1419533532.db2.gz	VMNXNOIODAWKQM-CABCVRRESA-N	0	3	341.480	3.360	20	30		EGEDHN
CC1(CC(=O)NCC[C@H]2CCN(Cc3ccc(F)c(C#N)c3)C2)CC1	ZINC001714873747	1419607129	/nfs/dbraw/zinc/60/71/29/1419607129.db2.gz	LCVMLUNYAFOHEL-HNNXBMFYSA-N	0	3	343.446	3.216	20	30		EGEDHN
Cc1ccc(F)cc1CNCc1ccc(CNC(=O)[C@H](C)C#N)cc1	ZINC001715195942	1419927830	/nfs/dbraw/zinc/92/78/30/1419927830.db2.gz	WXZCXECJDPEHNB-OAHLLOKOSA-N	0	3	339.414	3.200	20	30		EGEDHN
C[C@@H](CNCc1ccccc1C#N)CNC(=O)[C@H]1CCCC1(C)C	ZINC001715243694	1419971384	/nfs/dbraw/zinc/97/13/84/1419971384.db2.gz	CDNJNCFBGVCNDH-MAUKXSAKSA-N	0	3	327.472	3.226	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)N(C)C(=O)[C@@H]1CC[C@@H](C)CC1	ZINC001715374794	1420070709	/nfs/dbraw/zinc/07/07/09/1420070709.db2.gz	ZGJHYJILWBIGKE-RBSFLKMASA-N	0	3	333.501	3.383	20	30		EGEDHN
CC(C)C[C@@H](CNCc1ccc(F)c(C#N)c1)NC(=O)C1=CCCC1	ZINC001715380352	1420076769	/nfs/dbraw/zinc/07/67/69/1420076769.db2.gz	FHEUFWRSCNVLCS-SFHVURJKSA-N	0	3	343.446	3.428	20	30		EGEDHN
C=C(Br)CN[C@@H](CNC(=O)CC1CCCC1)C(C)C	ZINC001715486813	1420168315	/nfs/dbraw/zinc/16/83/15/1420168315.db2.gz	LQGBKIHAYGXHAZ-AWEZNQCLSA-N	0	3	331.298	3.206	20	30		EGEDHN
CC(C)[C@H](CNC(=O)c1cccs1)NCc1cc(C#N)ccc1F	ZINC001715487434	1420168656	/nfs/dbraw/zinc/16/86/56/1420168656.db2.gz	NZCUVAHDHMBOAH-INIZCTEOSA-N	0	3	345.443	3.303	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H](C)CN(C)Cc2cccc(C#N)c2)c(C)o1	ZINC001716011158	1420464446	/nfs/dbraw/zinc/46/44/46/1420464446.db2.gz	AGTVHKGCVYLIJC-ZDUSSCGKSA-N	0	3	325.412	3.018	20	30		EGEDHN
C[C@H](CN(C)Cc1ccccc1C1CC1)NC(=O)c1cc(C#N)c[nH]1	ZINC001716017667	1420471943	/nfs/dbraw/zinc/47/19/43/1420471943.db2.gz	TYIMZNQNCVGXCD-CQSZACIVSA-N	0	3	336.439	3.014	20	30		EGEDHN
Cc1ccc(C)c(C(=O)NCC2(NCc3cccc(C#N)c3)CC2)c1	ZINC001733262767	1429419098	/nfs/dbraw/zinc/41/90/98/1429419098.db2.gz	ZXKGIAFNFHDBNN-UHFFFAOYSA-N	0	3	333.435	3.227	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](CNCc2ccc(C#N)s2)C2CC2)c(C)o1	ZINC001716605246	1420773197	/nfs/dbraw/zinc/77/31/97/1420773197.db2.gz	SSLHZFGRNAMGDH-QGZVFWFLSA-N	0	3	343.452	3.128	20	30		EGEDHN
CC(C)C[C@@H](C)CC(=O)NCC1(NCc2ccc(C#N)cc2)CC1	ZINC001716699164	1420851771	/nfs/dbraw/zinc/85/17/71/1420851771.db2.gz	HNNJHHOOTNGBJP-MRXNPFEDSA-N	0	3	327.472	3.369	20	30		EGEDHN
C[C@H](C#N)C(=O)NC1(C)CCN(C/C=C\c2ccc(Cl)cc2)CC1	ZINC001716794576	1420927523	/nfs/dbraw/zinc/92/75/23/1420927523.db2.gz	ODZVLBKBTKOREF-ABCZVMIZSA-N	0	3	345.874	3.484	20	30		EGEDHN
C[C@H](C#N)C(=O)NC1(C)CCN(C/C=C/c2ccc(Cl)cc2)CC1	ZINC001716794579	1420927591	/nfs/dbraw/zinc/92/75/91/1420927591.db2.gz	ODZVLBKBTKOREF-NHZBNJEXSA-N	0	3	345.874	3.484	20	30		EGEDHN
CCCc1ccc(CN(C)[C@@H](C)CNC(=O)c2cc(C#N)c[nH]2)cc1	ZINC001717468271	1421400267	/nfs/dbraw/zinc/40/02/67/1421400267.db2.gz	HFEOZXKSSAFHOC-HNNXBMFYSA-N	0	3	338.455	3.089	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccc2[nH]ccc2c1)N(C)Cc1cccc(C#N)c1	ZINC001717486027	1421422716	/nfs/dbraw/zinc/42/27/16/1421422716.db2.gz	YDFPSLRZUCZXIN-HNNXBMFYSA-N	0	3	346.434	3.290	20	30		EGEDHN
N#Cc1cccc(CNC2(CNC(=O)CCC3CCCC3)CC2)c1	ZINC001723490619	1424439283	/nfs/dbraw/zinc/43/92/83/1424439283.db2.gz	HPVDILQJDWHORL-UHFFFAOYSA-N	0	3	325.456	3.267	20	30		EGEDHN
CC1(C(=O)NCC2(NCc3ccc(F)c(C#N)c3)CC2)CCCC1	ZINC001723543769	1424457408	/nfs/dbraw/zinc/45/74/08/1424457408.db2.gz	HAFDEBXMQCMHTA-UHFFFAOYSA-N	0	3	329.419	3.016	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)CCOC(C)C)CC2)C1	ZINC001723597271	1424484097	/nfs/dbraw/zinc/48/40/97/1424484097.db2.gz	LHIPOCLYEABPSY-KRWDZBQOSA-N	0	3	342.911	3.115	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N(C)CC(C)(C)CNCc1ccccc1C#N	ZINC001725150161	1425634787	/nfs/dbraw/zinc/63/47/87/1425634787.db2.gz	QWUXVYDIHHENLD-MRXNPFEDSA-N	0	3	329.488	3.425	20	30		EGEDHN
C=C(Br)CNC[C@@H](NC(=O)CC1(C)CC1)C(C)(C)C	ZINC001725747475	1426425299	/nfs/dbraw/zinc/42/52/99/1426425299.db2.gz	YATOVAIUUJILRK-GFCCVEGCSA-N	0	3	331.298	3.206	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1cc2c[nH]ccc-2n1	ZINC001731292458	1427234862	/nfs/dbraw/zinc/23/48/62/1427234862.db2.gz	FETYVMSYZXVVOH-SUMWQHHRSA-N	0	3	346.862	3.288	20	30		EGEDHN
CCC[C@@H](CC)C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2OC)C1	ZINC001731454419	1427430862	/nfs/dbraw/zinc/43/08/62/1427430862.db2.gz	ACEJLMALZGNCHI-KBAYOESNSA-N	0	3	343.471	3.130	20	30		EGEDHN
CC(C)c1ncsc1C(=O)NC[C@H](C)NCc1ccc(C#N)s1	ZINC001731625531	1427676326	/nfs/dbraw/zinc/67/63/26/1427676326.db2.gz	WDCMQGOEXHQMPB-NSHDSACASA-N	0	3	348.497	3.108	20	30		EGEDHN
Cc1cccc(C(=O)NC[C@@H](C)NCc2ccc(C#N)s2)c1Cl	ZINC001731626642	1427677340	/nfs/dbraw/zinc/67/73/40/1427677340.db2.gz	CXROAXSTMBWLLT-GFCCVEGCSA-N	0	3	347.871	3.490	20	30		EGEDHN
C[C@H](CCNC(=O)c1ccoc1Cl)NCc1ccccc1C#N	ZINC001731725955	1427799622	/nfs/dbraw/zinc/79/96/22/1427799622.db2.gz	VKMOOAULPZXXOQ-GFCCVEGCSA-N	0	3	331.803	3.103	20	30		EGEDHN
C[C@@H](CCNC(=O)C#CC(C)(C)C)N[C@@H](C)c1nc2ccccc2o1	ZINC001733905465	1437723445	/nfs/dbraw/zinc/72/34/45/1437723445.db2.gz	IIKWPAZPQRZVJW-GJZGRUSLSA-N	0	3	341.455	3.423	20	30		EGEDHN
CC(C(=O)NCC[C@H](C)NCc1cc(C#N)ccc1F)=C1CCC1	ZINC001733905573	1437723488	/nfs/dbraw/zinc/72/34/88/1437723488.db2.gz	SUBCEQLTONUFKY-ZDUSSCGKSA-N	0	3	329.419	3.182	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N2CCCC[C@H]2[C@H](C)NCCF)cc1	ZINC001752146454	1440145941	/nfs/dbraw/zinc/14/59/41/1440145941.db2.gz	LULGLKQDFLHMRK-LPHOPBHVSA-N	0	3	346.446	3.031	20	30		EGEDHN
CC/C(C)=C\C(=O)NCCCN(CC)CC#Cc1ccc(F)cc1	ZINC001752181211	1440151311	/nfs/dbraw/zinc/15/13/11/1440151311.db2.gz	PBCSVFKZLGIQRK-MSUUIHNZSA-N	0	3	330.447	3.362	20	30		EGEDHN
C=CCOCCN1CCC(N(C)C(=O)C(C)(C)C2CCCC2)CC1	ZINC001752301976	1440167947	/nfs/dbraw/zinc/16/79/47/1440167947.db2.gz	WCHVINPAHGGNEE-UHFFFAOYSA-N	0	3	336.520	3.328	20	30		EGEDHN
C#CCCCCC(=O)N1CCC[C@H](CN(C)CCC(F)(F)F)C1	ZINC001752506609	1440189536	/nfs/dbraw/zinc/18/95/36/1440189536.db2.gz	UWYPUAGIEPHGPD-OAHLLOKOSA-N	0	3	332.410	3.303	20	30		EGEDHN
O=C(N[C@H]1C[C@H](NCC#Cc2ccccc2)C1)C1(c2ccccc2)CC1	ZINC001752678776	1440199354	/nfs/dbraw/zinc/19/93/54/1440199354.db2.gz	FEVISVGQOFPEDZ-MEMLXQNLSA-N	0	3	344.458	3.007	20	30		EGEDHN
C[C@H]1C[C@H](C(=O)N[C@H]2C[C@H](NCC#Cc3ccccc3)C2)C[C@@H](C)C1	ZINC001752687184	1440199940	/nfs/dbraw/zinc/19/99/40/1440199940.db2.gz	ITNJVUVGDLGOQY-LJXNCHROSA-N	0	3	338.495	3.347	20	30		EGEDHN
C=CCCC(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1c(C)nsc1C	ZINC001752690525	1440200458	/nfs/dbraw/zinc/20/04/58/1440200458.db2.gz	WOOWUBBLFKZHJG-MQVJKMGUSA-N	0	3	333.501	3.338	20	30		EGEDHN
CC[C@@H](N[C@H]1C[C@@H](NC(=O)C#CC2CC2)C1)c1ccc(F)cc1F	ZINC001752726141	1440203940	/nfs/dbraw/zinc/20/39/40/1440203940.db2.gz	MGLDLTKKDKZWOR-RVKKMQEKSA-N	0	3	332.394	3.066	20	30		EGEDHN
C[C@H](C#N)C(=O)NC[C@H]1CCCN(Cc2cccc(C(F)F)c2)C1	ZINC001752780185	1440208762	/nfs/dbraw/zinc/20/87/62/1440208762.db2.gz	UCIPAQAKLKVAAT-UKRRQHHQSA-N	0	3	335.398	3.112	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@H](CNC(=O)C3(CF)CCC3)C2)c1	ZINC001752787793	1440212045	/nfs/dbraw/zinc/21/20/45/1440212045.db2.gz	UOWZNKLMBRKYKB-GOSISDBHSA-N	0	3	343.446	3.026	20	30		EGEDHN
CC(C)c1ccc(CN2CCCC[C@H]2CNC(=O)[C@H](C)C#N)cc1	ZINC001752816974	1440218475	/nfs/dbraw/zinc/21/84/75/1440218475.db2.gz	SSEKQTLAUWVBRP-APWZRJJASA-N	0	3	327.472	3.440	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)[C@@H](C)Cc1ccccc1C	ZINC001752824730	1440223075	/nfs/dbraw/zinc/22/30/75/1440223075.db2.gz	CQLGTPVBYUNCKF-ICSRJNTNSA-N	0	3	326.484	3.168	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)C2(C(F)F)CCCC2)C1	ZINC001752840933	1440230362	/nfs/dbraw/zinc/23/03/62/1440230362.db2.gz	NGIWOJNHFOEXOJ-CABCVRRESA-N	0	3	326.431	3.052	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CCC(NCc2ccccc2C#N)CC1	ZINC001752851820	1440233787	/nfs/dbraw/zinc/23/37/87/1440233787.db2.gz	FFQYUOCOEIOPJV-UHFFFAOYSA-N	0	3	325.456	3.287	20	30		EGEDHN
C[C@@H](CNC(=O)[C@H]1CC[C@@H]2C[C@@H]2CC1)NCc1ccc(C#N)s1	ZINC001752889360	1440240536	/nfs/dbraw/zinc/24/05/36/1440240536.db2.gz	PMCAVQLAXCUCLZ-XQLPTFJDSA-N	0	3	331.485	3.040	20	30		EGEDHN
C=CCC1(C(=O)NC[C@H](C)NCc2cn(C(C)C)nc2C)CCC1	ZINC001752899418	1440242549	/nfs/dbraw/zinc/24/25/49/1440242549.db2.gz	PPQIRJIGCAVOBP-HNNXBMFYSA-N	0	3	332.492	3.113	20	30		EGEDHN
C[C@H](CNC(=O)CCCC(F)(F)F)NCc1ccc(C#N)c(F)c1	ZINC001752906046	1440244115	/nfs/dbraw/zinc/24/41/15/1440244115.db2.gz	YLQWCKWWKBPQAZ-LLVKDONJSA-N	0	3	345.340	3.024	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CCC[C@H](NCc2csc(CCC)n2)C1	ZINC001752969454	1440254738	/nfs/dbraw/zinc/25/47/38/1440254738.db2.gz	ROUAKIPDWGYFKO-JKSUJKDBSA-N	0	3	347.528	3.416	20	30		EGEDHN
CC/C=C(/C)C(=O)N1CCC[C@@H](N(C)Cc2ccc(F)c(C#N)c2)C1	ZINC001752988123	1440258657	/nfs/dbraw/zinc/25/86/57/1440258657.db2.gz	HNOAEVJOLYCYDH-HUJBZGQLSA-N	0	3	343.446	3.476	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@@H](N(C)C[C@@H](O)c2ccccc2)C1	ZINC001752992313	1440259989	/nfs/dbraw/zinc/25/99/89/1440259989.db2.gz	JQESNFFTJAQNII-RTBURBONSA-N	0	3	344.499	3.245	20	30		EGEDHN
C[C@H](CCNC(=O)C#CC(C)(C)C)N[C@@H](C)c1nc2ccccc2o1	ZINC001753005290	1440265704	/nfs/dbraw/zinc/26/57/04/1440265704.db2.gz	IIKWPAZPQRZVJW-CABCVRRESA-N	0	3	341.455	3.423	20	30		EGEDHN
CCCC(=O)NCCC[C@@H]1CCCN1Cc1ccc(F)c(C#N)c1	ZINC001753022621	1440270377	/nfs/dbraw/zinc/27/03/77/1440270377.db2.gz	MGWBKFQPPZSKFI-QGZVFWFLSA-N	0	3	331.435	3.358	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H]1CCCN1CCOc1ccccc1C	ZINC001753108166	1440307244	/nfs/dbraw/zinc/30/72/44/1440307244.db2.gz	JJJBCPQJWAXDPK-KRWDZBQOSA-N	0	3	330.472	3.167	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](CNC(=O)CC3CCCC3)C2)cc1	ZINC001753118851	1440312787	/nfs/dbraw/zinc/31/27/87/1440312787.db2.gz	KUFBXJQAYQDKQE-LJQANCHMSA-N	0	3	325.456	3.077	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@H]1CCN(Cc2cccc(C(C)C)n2)C1	ZINC001753128787	1440315723	/nfs/dbraw/zinc/31/57/23/1440315723.db2.gz	KDNGVMAQVVGDFQ-QGZVFWFLSA-N	0	3	329.488	3.499	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NC[C@@H]1CCN(Cc2cccc(F)c2)C1)OCC	ZINC001753128941	1440315890	/nfs/dbraw/zinc/31/58/90/1440315890.db2.gz	KWPKFTFIUXXLPE-PKOBYXMFSA-N	0	3	348.462	3.135	20	30		EGEDHN
CCCN(CCNC(=O)[C@@H]1CC12CCCC2)Cc1ccc(C#N)cc1	ZINC001753149376	1440326831	/nfs/dbraw/zinc/32/68/31/1440326831.db2.gz	YPPUXCIGJFVMSE-IBGZPJMESA-N	0	3	339.483	3.467	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC([C@H](C)NCc2cnc(C)o2)CC1	ZINC001753278866	1440346763	/nfs/dbraw/zinc/34/67/63/1440346763.db2.gz	VUPSKXPRKSJPLT-HOCLYGCPSA-N	0	3	333.476	3.302	20	30		EGEDHN
CC(C)N(CCCNC(=O)C(C)(C)F)Cc1cc(C#N)ccc1F	ZINC001753281648	1440347597	/nfs/dbraw/zinc/34/75/97/1440347597.db2.gz	KIZRNEWOROJGHQ-UHFFFAOYSA-N	0	3	337.414	3.162	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)NCCCN(CC#Cc1ccccc1)C(C)C	ZINC001753290817	1440350396	/nfs/dbraw/zinc/35/03/96/1440350396.db2.gz	LABMYRSWMMBKSE-LJQANCHMSA-N	0	3	332.463	3.249	20	30		EGEDHN
C=CCN[C@H](CNC(=O)[C@@H](C)Oc1ccccc1F)c1ccccc1	ZINC001753298911	1440353316	/nfs/dbraw/zinc/35/33/16/1440353316.db2.gz	OZOWRAIDCVYHGD-CRAIPNDOSA-N	0	3	342.414	3.226	20	30		EGEDHN
C=C(C)CN[C@@H](CNC(=O)C[C@@H]1CC(C)(C)CO1)c1ccccc1	ZINC001753300487	1440353983	/nfs/dbraw/zinc/35/39/83/1440353983.db2.gz	UJXRXURJHQGKFF-MSOLQXFVSA-N	0	3	330.472	3.215	20	30		EGEDHN
C=CCCC(=O)N1C[C@H]2CC[C@@H](C1)N2CCc1ccccc1CC	ZINC001753303816	1440355070	/nfs/dbraw/zinc/35/50/70/1440355070.db2.gz	KBOAMJDEWVMRFX-BGYRXZFFSA-N	0	3	326.484	3.433	20	30		EGEDHN
CC[C@H](C)CC(=O)NCC[C@H]1CCN(CC#Cc2ccc(F)cc2)C1	ZINC001753326368	1440366761	/nfs/dbraw/zinc/36/67/61/1440366761.db2.gz	JSUHJWDZHWLMKD-HKUYNNGSSA-N	0	3	344.474	3.442	20	30		EGEDHN
C=CCCN1CCN(CCN(C)C(=O)C[C@@H]2CCCCC2(C)C)CC1	ZINC001753346714	1440376292	/nfs/dbraw/zinc/37/62/92/1440376292.db2.gz	KPHDDYCEFNWVRH-IBGZPJMESA-N	0	3	349.563	3.245	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@@H](CN(C)Cc2cccc(C(C)C)n2)C1	ZINC001753348574	1440377026	/nfs/dbraw/zinc/37/70/26/1440377026.db2.gz	XESTYJIVVUUJAH-SFHVURJKSA-N	0	3	341.499	3.145	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@@H](CN(C)[C@@H](C)c2ccc(F)cc2F)C1	ZINC001753349540	1440377156	/nfs/dbraw/zinc/37/71/56/1440377156.db2.gz	RBWLJQSTHGSEJT-HOTGVXAUSA-N	0	3	348.437	3.466	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@H](CN(C)Cc2c(C)noc2C)C1	ZINC001753355297	1440379648	/nfs/dbraw/zinc/37/96/48/1440379648.db2.gz	PEDSNMDWXRDOJY-IAGOWNOFSA-N	0	3	333.476	3.174	20	30		EGEDHN
C[C@@H](C#N)C(=O)N(C)[C@H]1CCN(Cc2ccc(C(C)(C)C)cc2)C1	ZINC001753434459	1440399476	/nfs/dbraw/zinc/39/94/76/1440399476.db2.gz	WBIDNWFBZLEZEZ-YJBOKZPZSA-N	0	3	327.472	3.176	20	30		EGEDHN
C=CCOCCN1CC[C@@H](N(CC)C(=O)c2cc(F)ccc2CC)C1	ZINC001753461524	1440410904	/nfs/dbraw/zinc/41/09/04/1440410904.db2.gz	MIRGALIYXOCIPZ-GOSISDBHSA-N	0	3	348.462	3.127	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)[C@@H](C)Cc2ccc(C)cc2)C1	ZINC001753463956	1440412085	/nfs/dbraw/zinc/41/20/85/1440412085.db2.gz	LETQSEHQSJFLQR-AZUAARDMSA-N	0	3	326.484	3.120	20	30		EGEDHN
CC[C@@H](CNC(=O)C=C1CCC1)NCC#Cc1cccc(Cl)c1	ZINC001753469665	1440413819	/nfs/dbraw/zinc/41/38/19/1440413819.db2.gz	DUXLXNHCVOEMEV-SFHVURJKSA-N	0	3	330.859	3.286	20	30		EGEDHN
CC[C@H](CNC(=O)CCc1cccc(C)c1)NCC#Cc1ccccc1	ZINC001753481311	1440416666	/nfs/dbraw/zinc/41/66/66/1440416666.db2.gz	NVWPBZKBNVCTBZ-JOCHJYFZSA-N	0	3	348.490	3.464	20	30		EGEDHN
C=C[C@H](C(=O)NC[C@H](CC)NCc1cncc(F)c1)c1ccccc1	ZINC001753496443	1440421619	/nfs/dbraw/zinc/42/16/19/1440421619.db2.gz	DPBNCLFXESPUPZ-OALUTQOASA-N	0	3	341.430	3.175	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2nccc3cccnc32)CCCC1	ZINC001753504149	1440424094	/nfs/dbraw/zinc/42/40/94/1440424094.db2.gz	GVVVVYAJYNBSMS-UHFFFAOYSA-N	0	3	344.846	3.015	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)COc2ccccc2C)CCCC1	ZINC001753510659	1440425782	/nfs/dbraw/zinc/42/57/82/1440425782.db2.gz	ZAMWFZONTZNXTG-UHFFFAOYSA-N	0	3	336.863	3.145	20	30		EGEDHN
Cc1nocc1CNC[C@]1(NC(=O)C#CC(C)(C)C)CCCC[C@H]1C	ZINC001753531682	1440431162	/nfs/dbraw/zinc/43/11/62/1440431162.db2.gz	LLYRHCOHMDCPCF-FOIQADDNSA-N	0	3	345.487	3.187	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2ncoc2CC)CCCC[C@@H]1C	ZINC001753531767	1440431282	/nfs/dbraw/zinc/43/12/82/1440431282.db2.gz	MOLYYHUDMJUBHG-SJCJKPOMSA-N	0	3	339.867	3.258	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H](CCNCc2cc(C#N)ccc2F)C1	ZINC001753542568	1440433698	/nfs/dbraw/zinc/43/36/98/1440433698.db2.gz	LOSFDWCZFCMFDJ-INIZCTEOSA-N	0	3	343.446	3.382	20	30		EGEDHN
C#CCCCC(=O)N1CCC(CCNCc2ccccc2C#N)CC1	ZINC001753568517	1440438065	/nfs/dbraw/zinc/43/80/65/1440438065.db2.gz	DPDWHRIGINNYGP-UHFFFAOYSA-N	0	3	337.467	3.080	20	30		EGEDHN
C#CCCCC(=O)NCc1ccc(CNCc2scnc2C)cc1	ZINC001753591213	1440442928	/nfs/dbraw/zinc/44/29/28/1440442928.db2.gz	PVIOSPJZYOQCAJ-UHFFFAOYSA-N	0	3	341.480	3.161	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCC1CCN(Cc2scnc2C)CC1	ZINC001753597944	1440445459	/nfs/dbraw/zinc/44/54/59/1440445459.db2.gz	YQWQLFBDSPXDKX-UHFFFAOYSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@@H](C)CNCc1cc(O)ccc1Cl	ZINC001753634751	1440452988	/nfs/dbraw/zinc/45/29/88/1440452988.db2.gz	SWOLDVHWRDMZSV-ZDUSSCGKSA-N	0	3	338.879	3.490	20	30		EGEDHN
C=CC(C)(C)C(=O)NCC1(NCc2cccc(OCC)n2)CCCC1	ZINC001753667518	1440460820	/nfs/dbraw/zinc/46/08/20/1440460820.db2.gz	YXFJOXFDDLPTBM-UHFFFAOYSA-N	0	3	345.487	3.211	20	30		EGEDHN
Cc1ccc([C@@H](C)C(=O)N(C)[C@H](C)CNCc2ccc(C#N)s2)o1	ZINC001753716540	1440472089	/nfs/dbraw/zinc/47/20/89/1440472089.db2.gz	WCHSKCBOPGQHDP-TZMCWYRMSA-N	0	3	345.468	3.261	20	30		EGEDHN
C#CCC1(C(=O)N(C)[C@H](C)CNCc2cnc(C)s2)CCCCC1	ZINC001753727714	1440474918	/nfs/dbraw/zinc/47/49/18/1440474918.db2.gz	HPFSRLMQBSHQCK-OAHLLOKOSA-N	0	3	347.528	3.362	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H](CNCc1cnn(C(C)(C)C)c1)CC(C)C	ZINC001753738309	1440478269	/nfs/dbraw/zinc/47/82/69/1440478269.db2.gz	GLEUFVOXNAOMQN-QGZVFWFLSA-N	0	3	348.535	3.471	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](NCc2ccn(C(C)C)n2)[C@@H](C)C1	ZINC001753755389	1440483085	/nfs/dbraw/zinc/48/30/85/1440483085.db2.gz	QJDLODJHJQMSLD-FUHWJXTLSA-N	0	3	346.519	3.393	20	30		EGEDHN
C=C(Br)CNCC[C@H]1CCCCN1C(=O)CC1CCC1	ZINC001753775361	1440486364	/nfs/dbraw/zinc/48/63/64/1440486364.db2.gz	KVLSONUMKFXDPZ-OAHLLOKOSA-N	0	3	343.309	3.446	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H]([C@@H](C)NCc2nc(C)sc2C)C1	ZINC001753793255	1440489221	/nfs/dbraw/zinc/48/92/21/1440489221.db2.gz	WDKDNYQZIKOHRE-CJNGLKHVSA-N	0	3	335.517	3.443	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H](C)[C@@H]1CNCc1c(C)nsc1C	ZINC001753806004	1440491798	/nfs/dbraw/zinc/49/17/98/1440491798.db2.gz	UUQIHBBOECZCRZ-GUYCJALGSA-N	0	3	335.517	3.443	20	30		EGEDHN
Cc1ccoc1C(=O)NC[C@H](NCc1ccc(C#N)cc1F)C(C)C	ZINC001753824192	1440497665	/nfs/dbraw/zinc/49/76/65/1440497665.db2.gz	HPJHUTDTIQISEP-KRWDZBQOSA-N	0	3	343.402	3.143	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1ccnc(-c2ccco2)c1)C(C)C	ZINC001753832343	1440500017	/nfs/dbraw/zinc/50/00/17/1440500017.db2.gz	LYJSNHHYFJDXJO-MRXNPFEDSA-N	0	3	347.846	3.438	20	30		EGEDHN
Cc1cccnc1CN[C@@H](CNC(=O)CC#Cc1ccccc1)C(C)C	ZINC001753845325	1440504117	/nfs/dbraw/zinc/50/41/17/1440504117.db2.gz	JJDUQJIZBLEEPV-FQEVSTJZSA-N	0	3	349.478	3.062	20	30		EGEDHN
CN(CCN(C)C(=O)CC1CCCC1)Cc1ccc(F)c(C#N)c1	ZINC001753848191	1440505648	/nfs/dbraw/zinc/50/56/48/1440505648.db2.gz	VVJPYVAMZKQMLQ-UHFFFAOYSA-N	0	3	331.435	3.168	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)CCNCc2cc(C)no2)CCCCC1	ZINC001754024907	1440532944	/nfs/dbraw/zinc/53/29/44/1440532944.db2.gz	ZWHXVBJEXKNXIM-HNNXBMFYSA-N	0	3	333.476	3.494	20	30		EGEDHN
CCN(CCN[C@@H]1CCc2c1cc(F)cc2F)C(=O)C#CC(C)(C)C	ZINC001754045712	1440535102	/nfs/dbraw/zinc/53/51/02/1440535102.db2.gz	YATZRYPMDUJALY-GOSISDBHSA-N	0	3	348.437	3.440	20	30		EGEDHN
CCN(CCNCc1ccc(C#N)s1)C(=O)C1CCC=CCC1	ZINC001754082240	1440539588	/nfs/dbraw/zinc/53/95/88/1440539588.db2.gz	OSGZENVAKXGONM-UHFFFAOYSA-N	0	3	331.485	3.304	20	30		EGEDHN
O=C(C#CC1CC1)NC/C=C/CN[C@@H]1CCc2c1cccc2Cl	ZINC001754119528	1440542778	/nfs/dbraw/zinc/54/27/78/1440542778.db2.gz	MICXKBPVKPFPPU-ZMXQLYDGSA-N	0	3	328.843	3.003	20	30		EGEDHN
CC(C)c1ccoc1C(=O)NC/C=C\CNCc1ccc(C#N)cc1	ZINC001754162560	1440546189	/nfs/dbraw/zinc/54/61/89/1440546189.db2.gz	XXXJJMLRAXSWFT-ARJAWSKDSA-N	0	3	337.423	3.350	20	30		EGEDHN
Cc1cccc(F)c1C(=O)NC/C=C\CNCc1cccc(C#N)c1	ZINC001754211880	1440551328	/nfs/dbraw/zinc/55/13/28/1440551328.db2.gz	LQAKVOLYPSQISZ-IHWYPQMZSA-N	0	3	337.398	3.082	20	30		EGEDHN
C[C@H](CNCC#Cc1ccccc1)NC(=O)C[C@@H](C)c1ccccc1	ZINC001754251354	1440558197	/nfs/dbraw/zinc/55/81/97/1440558197.db2.gz	WTKUXQMIJGLNPI-RTBURBONSA-N	0	3	334.463	3.326	20	30		EGEDHN
CC1=C(C)C[C@H](C(=O)N[C@@H](C)CNCc2ccc(C#N)s2)CC1	ZINC001754268646	1440561066	/nfs/dbraw/zinc/56/10/66/1440561066.db2.gz	WYPOMSYOAAWQGY-LSDHHAIUSA-N	0	3	331.485	3.351	20	30		EGEDHN
C[C@@H](CN(C)Cc1cccc(C#N)c1)NC(=O)C1(F)CCCCC1	ZINC001754330895	1440583749	/nfs/dbraw/zinc/58/37/49/1440583749.db2.gz	OTVFPAGVEQIFHQ-HNNXBMFYSA-N	0	3	331.435	3.167	20	30		EGEDHN
CN(CCCNCc1cc(C#N)ccc1F)C(=O)[C@H]1CCC1(C)C	ZINC001754390990	1440594205	/nfs/dbraw/zinc/59/42/05/1440594205.db2.gz	LAKHMZXCWVUBNJ-MRXNPFEDSA-N	0	3	331.435	3.072	20	30		EGEDHN
CN(CCCNCc1ccc(C#N)cc1F)C(=O)C(C)(C)C1CC1	ZINC001754391068	1440594213	/nfs/dbraw/zinc/59/42/13/1440594213.db2.gz	NLUKDHYIVTXUHV-UHFFFAOYSA-N	0	3	331.435	3.072	20	30		EGEDHN
CCC[C@@H](C)C(=O)N[C@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001754436298	1440598133	/nfs/dbraw/zinc/59/81/33/1440598133.db2.gz	SVIUIHCIBZRLIW-FZKQIMNGSA-N	0	3	331.435	3.118	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@H](CNCc1ccccc1Cl)C1CC1	ZINC001754438738	1440598762	/nfs/dbraw/zinc/59/87/62/1440598762.db2.gz	FIEIRNZZAUDWIY-QGZVFWFLSA-N	0	3	332.875	3.374	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](CNCc2ccnc(Cl)c2)C2CC2)CC1	ZINC001754450153	1440600990	/nfs/dbraw/zinc/60/09/90/1440600990.db2.gz	HNMIYULCFOSKSX-KRWDZBQOSA-N	0	3	347.890	3.466	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)N[C@H](CNCc2ccc(C#N)s2)C2CC2)CC1	ZINC001754456867	1440602481	/nfs/dbraw/zinc/60/24/81/1440602481.db2.gz	DHFBDROOKFRZMG-DDUZABMNSA-N	0	3	345.512	3.430	20	30		EGEDHN
CC[C@H](NC1(CNC(=O)c2cc(C#N)c[nH]2)CC1)c1ccc(F)cc1	ZINC001754512111	1440617696	/nfs/dbraw/zinc/61/76/96/1440617696.db2.gz	UGQUJTCHFZREQN-INIZCTEOSA-N	0	3	340.402	3.029	20	30		EGEDHN
Cc1ccc([C@@H](C)C(=O)NCC2(NCc3ccc(C#N)cc3)CC2)o1	ZINC001754528393	1440621676	/nfs/dbraw/zinc/62/16/76/1440621676.db2.gz	GFZWIWVSCGWHLS-OAHLLOKOSA-N	0	3	337.423	3.002	20	30		EGEDHN
C=CCC1(C(=O)NCC2(NCc3ccc(C)cc3)CC2)CCOCC1	ZINC001754532855	1440623148	/nfs/dbraw/zinc/62/31/48/1440623148.db2.gz	OZDXOTWPKZKRLL-UHFFFAOYSA-N	0	3	342.483	3.106	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)C#CC(C)(C)C)CC2)C1	ZINC001754534761	1440623686	/nfs/dbraw/zinc/62/36/86/1440623686.db2.gz	AXFPEJIEVZOEMH-QGZVFWFLSA-N	0	3	336.907	3.349	20	30		EGEDHN
C=CCCC(=O)N1CCC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001754559882	1440633346	/nfs/dbraw/zinc/63/33/46/1440633346.db2.gz	WLKDQMMRAVMGRJ-UHFFFAOYSA-N	0	3	337.467	3.339	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@]2(CCN(Cc3ccccn3)C2)C1	ZINC001754565073	1440635148	/nfs/dbraw/zinc/63/51/48/1440635148.db2.gz	GDSGTDILPJFTBI-OAQYLSRUSA-N	0	3	339.483	3.090	20	30		EGEDHN
CCC(CC)C(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001754623814	1440645741	/nfs/dbraw/zinc/64/57/41/1440645741.db2.gz	CPKFGCCPJIWWSA-UHFFFAOYSA-N	0	3	327.472	3.465	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)[C@H](C)Cc2ccc(OC)cc2)CC1	ZINC001754630040	1440647501	/nfs/dbraw/zinc/64/75/01/1440647501.db2.gz	RUZPOKKILPAASU-MRXNPFEDSA-N	0	3	330.472	3.031	20	30		EGEDHN
C#CCN(C(=O)/C=C(/C)CC)C1CCN(CCOCC2CCC2)CC1	ZINC001754636760	1440648636	/nfs/dbraw/zinc/64/86/36/1440648636.db2.gz	YPRVHLYMDSTOCN-VLGSPTGOSA-N	0	3	346.515	3.086	20	30		EGEDHN
C#CCN(C(=O)[C@@H](F)CC)C1CCN(Cc2ccc(CF)cc2)CC1	ZINC001754639551	1440648888	/nfs/dbraw/zinc/64/88/88/1440648888.db2.gz	MZNTZTGDOPURRH-IBGZPJMESA-N	0	3	348.437	3.330	20	30		EGEDHN
C#CCN(C(=O)[C@@H](F)CC)C1CCN(Cc2ccc(C)cc2)CC1	ZINC001754639711	1440648967	/nfs/dbraw/zinc/64/89/67/1440648967.db2.gz	TZIYHGJOPMXSRS-IBGZPJMESA-N	0	3	330.447	3.169	20	30		EGEDHN
CCCCC(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1cccc(C#N)c1	ZINC001754657451	1440653989	/nfs/dbraw/zinc/65/39/89/1440653989.db2.gz	STYHOTFHXIOVBC-MOPGFXCFSA-N	0	3	325.456	3.314	20	30		EGEDHN
C=CCCC(=O)N1CCCC[C@]2(CCN(Cc3oc(C)nc3C)C2)C1	ZINC001754660153	1440654636	/nfs/dbraw/zinc/65/46/36/1440654636.db2.gz	BJRNRJZBCDVULB-HXUWFJFHSA-N	0	3	345.487	3.462	20	30		EGEDHN
CC[C@H](F)C(=O)NC[C@]1(C)CCCN(Cc2cccc(C#N)c2)C1	ZINC001754730927	1440679163	/nfs/dbraw/zinc/67/91/63/1440679163.db2.gz	ZMUKZZRCLQVRAC-HKUYNNGSSA-N	0	3	331.435	3.025	20	30		EGEDHN
C=CCN1CCC[C@](C)(CNC(=O)c2csc(CC(C)C)n2)C1	ZINC001754734303	1440681548	/nfs/dbraw/zinc/68/15/48/1440681548.db2.gz	KQMLHGSLOXTQEW-GOSISDBHSA-N	0	3	335.517	3.360	20	30		EGEDHN
CC(C)=CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(Cc1ccc(F)c(C#N)c1)C2	ZINC001754778731	1440686012	/nfs/dbraw/zinc/68/60/12/1440686012.db2.gz	CTQALBVJENISHD-SZMVWBNQSA-N	0	3	341.430	3.133	20	30		EGEDHN
C=C(C)CN[C@@H](CNC(=O)Cc1cc(C)on1)c1ccccc1CC	ZINC001754785682	1440687571	/nfs/dbraw/zinc/68/75/71/1440687571.db2.gz	PIWVJXDKYILECO-IBGZPJMESA-N	0	3	341.455	3.111	20	30		EGEDHN
C=CCN[C@@H](CNC(=O)c1cnoc1CC)c1ccccc1CC	ZINC001754788760	1440688329	/nfs/dbraw/zinc/68/83/29/1440688329.db2.gz	GCNJQTNOWISPHU-KRWDZBQOSA-N	0	3	327.428	3.046	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1cncc(C)c1	ZINC001754864833	1440702529	/nfs/dbraw/zinc/70/25/29/1440702529.db2.gz	DUFZCNUGMAPRAS-MOPGFXCFSA-N	0	3	327.472	3.312	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC[C@H]2CN(CCCCC(F)(F)F)C[C@H]21	ZINC001754873032	1440705770	/nfs/dbraw/zinc/70/57/70/1440705770.db2.gz	SZPUSEUGQOBDHL-JKSUJKDBSA-N	0	3	344.421	3.301	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CC[C@@H](CCNCc2ccc(F)cc2F)C1	ZINC001754914457	1440708498	/nfs/dbraw/zinc/70/84/98/1440708498.db2.gz	GFBPTYKVXDDCEM-OAHLLOKOSA-N	0	3	348.437	3.343	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](CCNCc3conc3C)C2)CC1	ZINC001754930845	1440710477	/nfs/dbraw/zinc/71/04/77/1440710477.db2.gz	QUGJKSZOFQADRW-MRXNPFEDSA-N	0	3	331.460	3.058	20	30		EGEDHN
C=CCN(C)Cc1ccccc1CNC(=O)c1ccn2c(C)cnc2c1	ZINC001754945911	1440712925	/nfs/dbraw/zinc/71/29/25/1440712925.db2.gz	NGOBQDINGPZKOY-UHFFFAOYSA-N	0	3	348.450	3.191	20	30		EGEDHN
C#CCN[C@@H](C)c1ccc(CNC(=O)c2ccc3cnccc3c2)cc1	ZINC001754949134	1440714609	/nfs/dbraw/zinc/71/46/09/1440714609.db2.gz	WQCZWHUYQZJAAE-INIZCTEOSA-N	0	3	343.430	3.449	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)s1)c1ccc(CNC(=O)C(F)F)cc1	ZINC001754955224	1440716212	/nfs/dbraw/zinc/71/62/12/1440716212.db2.gz	XYNXHHMCEVAHTC-NSHDSACASA-N	0	3	349.406	3.352	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)C3(COC)CCC3)cccc2C1	ZINC001754975767	1440720037	/nfs/dbraw/zinc/72/00/37/1440720037.db2.gz	MXPYWFIHQOFMDX-UHFFFAOYSA-N	0	3	342.483	3.054	20	30		EGEDHN
CC#CCNC1(CNC(=O)c2c(Cl)oc3ccccc32)CCC1	ZINC001754985113	1440722383	/nfs/dbraw/zinc/72/23/83/1440722383.db2.gz	IIBMCIZHNSNDFZ-UHFFFAOYSA-N	0	3	330.815	3.352	20	30		EGEDHN
CC#CCNC1(CNC(=O)c2cc3c(s2)CC[C@H](C)C3)CCC1	ZINC001754992952	1440725024	/nfs/dbraw/zinc/72/50/24/1440725024.db2.gz	XVMLTLXRACBWQX-AWEZNQCLSA-N	0	3	330.497	3.138	20	30		EGEDHN
CC#CCNC[C@@H]1CN(C(=O)[C@@H](CCC)CC2CCCCC2)CCO1	ZINC001755009656	1440725849	/nfs/dbraw/zinc/72/58/49/1440725849.db2.gz	PCYGTNJCKKFCTA-VQTJNVASSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=CC1(CC(=O)N[C@@H]2CCCN(CC#CCOC)CC2)CCCCC1	ZINC001755028635	1440730433	/nfs/dbraw/zinc/73/04/33/1440730433.db2.gz	GSGRORBFEVDBAY-LJQANCHMSA-N	0	3	346.515	3.134	20	30		EGEDHN
COCCCCCN1Cc2ccc(CNC(=O)C#CC(C)C)cc2C1	ZINC001755101065	1440752453	/nfs/dbraw/zinc/75/24/53/1440752453.db2.gz	PZGBYRRXYDKUKM-UHFFFAOYSA-N	0	3	342.483	3.095	20	30		EGEDHN
C=CCCC(=O)N1C[C@H](NCC#Cc2ccccc2Cl)[C@@H](C)C1	ZINC001755104795	1440753696	/nfs/dbraw/zinc/75/36/96/1440753696.db2.gz	KHWCFLWSWFALSU-YJBOKZPZSA-N	0	3	330.859	3.094	20	30		EGEDHN
CCC(C)(C)CC(=O)N1C[C@H](NCc2ccc(C#N)s2)[C@@H](C)C1	ZINC001755120512	1440755652	/nfs/dbraw/zinc/75/56/52/1440755652.db2.gz	HVXKBNSUMPEXMH-BBRMVZONSA-N	0	3	333.501	3.383	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)C2(CCOCC)CCCC2)C(C)(C)C1	ZINC001755141428	1440760558	/nfs/dbraw/zinc/76/05/58/1440760558.db2.gz	GMLMOUNPGARWDF-QGZVFWFLSA-N	0	3	336.520	3.376	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)CCc2ccc(C)cc2C)C(C)(C)C1	ZINC001755143270	1440761945	/nfs/dbraw/zinc/76/19/45/1440761945.db2.gz	YTUWPHGLLIYXHD-HXUWFJFHSA-N	0	3	340.511	3.476	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)[C@H](C)Cc2ccc(F)cc2)C(C)(C)C1	ZINC001755143717	1440762194	/nfs/dbraw/zinc/76/21/94/1440762194.db2.gz	NSVZGLSOMZZTIL-QAPCUYQASA-N	0	3	332.463	3.407	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CCN(Cc2ncccc2C)[C@@H](C)C1	ZINC001755166898	1440767598	/nfs/dbraw/zinc/76/75/98/1440767598.db2.gz	HOCABAYSPLDTCS-DLBZAZTESA-N	0	3	329.488	3.461	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C3(CCC)CC3)CC2)C1	ZINC001755174107	1440770043	/nfs/dbraw/zinc/77/00/43/1440770043.db2.gz	JUKVUUFPXLNKSH-UHFFFAOYSA-N	0	3	334.504	3.226	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)[C@@H]2CC[C@H](CC)O2)CC1	ZINC001755183319	1440771842	/nfs/dbraw/zinc/77/18/42/1440771842.db2.gz	HRQMIAYCXIAFQL-IRXDYDNUSA-N	0	3	342.911	3.257	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC[C@H]1CN(C)CCOc1ccccc1	ZINC001755194933	1440776580	/nfs/dbraw/zinc/77/65/80/1440776580.db2.gz	FQJGZVJLKRFENL-SFHVURJKSA-N	0	3	330.472	3.345	20	30		EGEDHN
C[C@H](NCC#Cc1ccc(Cl)cc1)[C@H](C)NC(=O)c1ccco1	ZINC001755223278	1440785125	/nfs/dbraw/zinc/78/51/25/1440785125.db2.gz	KVJFCZYZEXAZMX-KBPBESRZSA-N	0	3	330.815	3.081	20	30		EGEDHN
Cc1cc(F)cc(C(=O)N[C@@H](C)[C@@H](C)NCc2ccc(C#N)s2)c1	ZINC001755256449	1440793337	/nfs/dbraw/zinc/79/33/37/1440793337.db2.gz	KCCQTQLDXFTRNZ-OLZOCXBDSA-N	0	3	345.443	3.364	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1cc(C(C)(C)C)on1	ZINC001755283277	1440801162	/nfs/dbraw/zinc/80/11/62/1440801162.db2.gz	KFTOTCBXRPMDJQ-UHFFFAOYSA-N	0	3	341.883	3.412	20	30		EGEDHN
C[C@@H](CNC(=O)C#CC1CC1)N(C)Cc1cc2ccccc2s1	ZINC001755298306	1440807506	/nfs/dbraw/zinc/80/75/06/1440807506.db2.gz	IMQYUGXHCQWGLU-AWEZNQCLSA-N	0	3	326.465	3.251	20	30		EGEDHN
C[C@@H](CNC(=O)c1c(F)cccc1F)N(C)Cc1cccc(C#N)c1	ZINC001755322182	1440819227	/nfs/dbraw/zinc/81/92/27/1440819227.db2.gz	CHGVMZGOTYSOJW-ZDUSSCGKSA-N	0	3	343.377	3.087	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)CC[C@@H](NCc2cc(C)n(C)n2)C(C)C)C1	ZINC001755351714	1440828046	/nfs/dbraw/zinc/82/80/46/1440828046.db2.gz	ZAWHJUZWEPVUEE-GOSISDBHSA-N	0	3	346.519	3.048	20	30		EGEDHN
CCCC[C@H](CNCc1ccc(C#N)c(F)c1)NC(=O)C=C(C)C	ZINC001755356001	1440829562	/nfs/dbraw/zinc/82/95/62/1440829562.db2.gz	CIRDCBOXFXVIJV-QGZVFWFLSA-N	0	3	331.435	3.428	20	30		EGEDHN
CCCC[C@H](CNCC#Cc1ccc(F)cc1)NC(=O)c1ccoc1	ZINC001755356841	1440829781	/nfs/dbraw/zinc/82/97/81/1440829781.db2.gz	ZATOYODNGLCVFX-LJQANCHMSA-N	0	3	342.414	3.349	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)COc1c(C)cccc1C	ZINC001755367523	1440835444	/nfs/dbraw/zinc/83/54/44/1440835444.db2.gz	HRVQTTDGFWXRNE-GOSISDBHSA-N	0	3	330.472	3.229	20	30		EGEDHN
C#CCN1CCCCC[C@@H]1CNC(=O)[C@@H](CC)c1ccc(OC)cc1	ZINC001755367321	1440835455	/nfs/dbraw/zinc/83/54/55/1440835455.db2.gz	FSESBPBRIWLHFZ-QUCCMNQESA-N	0	3	342.483	3.183	20	30		EGEDHN
C#CCCN1CC([C@H](C)NC(=O)C[C@@H](c2ccccc2)C(C)C)C1	ZINC001755388193	1440841158	/nfs/dbraw/zinc/84/11/58/1440841158.db2.gz	AOOXTJHFJNQOMC-FXAWDEMLSA-N	0	3	326.484	3.276	20	30		EGEDHN
C#CCCN1CC([C@H](C)NC(=O)CCCCc2ccc(C)cc2)C1	ZINC001755392902	1440842439	/nfs/dbraw/zinc/84/24/39/1440842439.db2.gz	ZBPPQRAFXJKOQL-SFHVURJKSA-N	0	3	326.484	3.168	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2(Cc3ccccc3)CCC2)C(C)(C)C1	ZINC001755413278	1440847424	/nfs/dbraw/zinc/84/74/24/1440847424.db2.gz	WQQXGLCQDDKENY-IBGZPJMESA-N	0	3	338.495	3.249	20	30		EGEDHN
C#CCN1C[C@]2(C)CN(C(=O)CC/C=C/c3ccccc3)C[C@]2(C)C1	ZINC001755461194	1440857603	/nfs/dbraw/zinc/85/76/03/1440857603.db2.gz	WQFHXSVWZBYYEI-MOLCRCNFSA-N	0	3	336.479	3.284	20	30		EGEDHN
CCc1occc1C(=O)N[C@@H](C)CCCNCc1ccccc1C#N	ZINC001755495413	1440861996	/nfs/dbraw/zinc/86/19/96/1440861996.db2.gz	INACUOPDXMFISU-HNNXBMFYSA-N	0	3	339.439	3.402	20	30		EGEDHN
C=C(Cl)CNCCC[C@H](C)NC(=O)c1nc(C(C)C)oc1C	ZINC001755498490	1440862362	/nfs/dbraw/zinc/86/23/62/1440862362.db2.gz	JVDSPGDVMFDAIK-LBPRGKRZSA-N	0	3	327.856	3.347	20	30		EGEDHN
C=CCCCC(=O)N1CCC(N(C)Cc2ccccc2[N+](=O)[O-])CC1	ZINC001755533135	1440868269	/nfs/dbraw/zinc/86/82/69/1440868269.db2.gz	KFFCWVPASYVFSG-UHFFFAOYSA-N	0	3	345.443	3.374	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N(C)[C@H](CNCC#Cc1ccccc1Cl)C1CC1	ZINC001755565457	1440875625	/nfs/dbraw/zinc/87/56/25/1440875625.db2.gz	ZOFJRMPPSSVDEM-UCLAIMLFSA-N	0	3	344.886	3.174	20	30		EGEDHN
CN(C(=O)C1(C)CC=CC1)[C@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001755566571	1440875936	/nfs/dbraw/zinc/87/59/36/1440875936.db2.gz	WSRUZHFXPAHVES-QGZVFWFLSA-N	0	3	343.496	3.303	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@H](CO)N[C@H](C)c1cc(C)ccc1C	ZINC001755635464	1440890774	/nfs/dbraw/zinc/89/07/74/1440890774.db2.gz	YDVWTZBIQPYFGR-IAGOWNOFSA-N	0	3	332.488	3.033	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@]3(NC(=O)CCC(F)F)CCC[C@@H]23)cc1	ZINC001755700907	1440900036	/nfs/dbraw/zinc/90/00/36/1440900036.db2.gz	HNMRIDVMYOLOGR-APWZRJJASA-N	0	3	347.409	3.217	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H]2CCC[C@H](NCc3nccs3)[C@H]2C1	ZINC001755708221	1440903067	/nfs/dbraw/zinc/90/30/67/1440903067.db2.gz	WHRHONRQNBTRPJ-JYJNAYRXSA-N	0	3	333.501	3.216	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H]2CCC[C@H](NCc3nocc3C)[C@@H]2C1	ZINC001755708693	1440903133	/nfs/dbraw/zinc/90/31/33/1440903133.db2.gz	NJUPXPZPTHOOPE-BBWFWOEESA-N	0	3	331.460	3.056	20	30		EGEDHN
CC#CCCCC(=O)N1C[C@@H](NCc2ccc(C#N)s2)C(C)(C)C1	ZINC001755775856	1440917223	/nfs/dbraw/zinc/91/72/23/1440917223.db2.gz	SGJAWNNKPUEJII-QGZVFWFLSA-N	0	3	343.496	3.140	20	30		EGEDHN
CC(C)(C)[C@@H](CNCC#Cc1ccccc1)NC(=O)C1CC(F)(F)C1	ZINC001755820559	1440925554	/nfs/dbraw/zinc/92/55/54/1440925554.db2.gz	QSMAVZGWJBKQDA-QGZVFWFLSA-N	0	3	348.437	3.204	20	30		EGEDHN
C#CCCCC(=O)N[C@H](CNCc1ccc(Cl)nc1)C(C)(C)C	ZINC001755823464	1440926395	/nfs/dbraw/zinc/92/63/95/1440926395.db2.gz	HCKPSEXPDQJOSX-OAHLLOKOSA-N	0	3	335.879	3.159	20	30		EGEDHN
CC(C)(C)[C@@H](CNCC#Cc1ccccc1)NC(=O)CC(C)(F)F	ZINC001755831646	1440928807	/nfs/dbraw/zinc/92/88/07/1440928807.db2.gz	WICDTUGHJFYFSJ-MRXNPFEDSA-N	0	3	336.426	3.204	20	30		EGEDHN
C[C@@H](NC(=O)C(C)(C)F)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001755841637	1440931800	/nfs/dbraw/zinc/93/18/00/1440931800.db2.gz	RJRWYXHPHRJANL-CQSZACIVSA-N	0	3	331.435	3.023	20	30		EGEDHN
C=CCC(C)(C)C(=O)N(C)C1CC(NCc2cc(C#N)ccc2F)C1	ZINC001755862815	1440937039	/nfs/dbraw/zinc/93/70/39/1440937039.db2.gz	YLVMQOMMQPTQKL-UHFFFAOYSA-N	0	3	343.446	3.379	20	30		EGEDHN
CC#CCN1CCC(C2(NC(=O)CCc3ccc(C)s3)CC2)CC1	ZINC001755870086	1440938914	/nfs/dbraw/zinc/93/89/14/1440938914.db2.gz	XNCCVWBCNFBGAJ-UHFFFAOYSA-N	0	3	344.524	3.373	20	30		EGEDHN
C=CC[C@H]1[N@@H+](CCc2ccc(-c3nnn[n-]3)cc2)CCCC1(C)C	ZINC001573330027	947431046	/nfs/dbraw/zinc/43/10/46/947431046.db2.gz	SEPZQVWVBHQHRS-QGZVFWFLSA-N	0	3	325.460	3.476	20	30		EGEDHN
C=CC[C@H]1[N@H+](CCc2ccc(-c3nnn[n-]3)cc2)CCCC1(C)C	ZINC001573330027	947431052	/nfs/dbraw/zinc/43/10/52/947431052.db2.gz	SEPZQVWVBHQHRS-QGZVFWFLSA-N	0	3	325.460	3.476	20	30		EGEDHN
C=CC[C@H]1[N@@H+](CCc2ccc(-c3nn[n-]n3)cc2)CCCC1(C)C	ZINC001573330027	947431058	/nfs/dbraw/zinc/43/10/58/947431058.db2.gz	SEPZQVWVBHQHRS-QGZVFWFLSA-N	0	3	325.460	3.476	20	30		EGEDHN
C=CC[C@H]1[N@H+](CCc2ccc(-c3nn[n-]n3)cc2)CCCC1(C)C	ZINC001573330027	947431063	/nfs/dbraw/zinc/43/10/63/947431063.db2.gz	SEPZQVWVBHQHRS-QGZVFWFLSA-N	0	3	325.460	3.476	20	30		EGEDHN
C#Cc1ccc(CN[C@H](Cc2ccccc2)[C@H](O)C(F)(F)F)cc1	ZINC000809619194	1126110811	/nfs/dbraw/zinc/11/08/11/1126110811.db2.gz	VMUAHYOGIQBQES-MSOLQXFVSA-N	0	3	333.353	3.292	20	30		EGEDHN
Cn1ncc2c1CCC[C@H]2NCCSCc1ccccc1C#N	ZINC000177823636	232003633	/nfs/dbraw/zinc/00/36/33/232003633.db2.gz	YGUULUBRZLECFO-QGZVFWFLSA-N	0	3	326.469	3.192	20	30		EGEDHN
Cc1nccn1CCCN(C)Cc1ccc(C#N)cc1Br	ZINC000181186157	234111409	/nfs/dbraw/zinc/11/14/09/234111409.db2.gz	QXJWYZVXVATBRS-UHFFFAOYSA-N	0	3	347.260	3.348	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1F)C(=O)Nc1cccc(C#N)c1	ZINC000040150528	213273097	/nfs/dbraw/zinc/27/30/97/213273097.db2.gz	KLVNWBYHLORVPK-UHFFFAOYSA-N	0	3	340.402	3.293	20	30		EGEDHN
C=CCc1cc(OCC)cc(CN2CCC(C(=O)OCC)CC2)c1O	ZINC000040149253	213273140	/nfs/dbraw/zinc/27/31/40/213273140.db2.gz	SGIZHYWIBHJSKK-UHFFFAOYSA-N	0	3	347.455	3.295	20	30		EGEDHN
Cc1ccccc1[C@H](CN1CCOCC1)NCc1cccc(C#N)c1	ZINC000183343771	235019209	/nfs/dbraw/zinc/01/92/09/235019209.db2.gz	DZNXZIGCVDQKHD-NRFANRHFSA-N	0	3	335.451	3.030	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)C[C@@H]1C=CCCC1	ZINC000187988752	236373424	/nfs/dbraw/zinc/37/34/24/236373424.db2.gz	LGZZUOHXSIZAAO-QGZVFWFLSA-N	0	3	325.456	3.195	20	30		EGEDHN
C[C@@H](NC[C@H](c1cccs1)N1CCOCC1)c1ccc(C#N)cc1	ZINC000072287938	216120645	/nfs/dbraw/zinc/12/06/45/216120645.db2.gz	QMGLUPVGKNJVMS-CRAIPNDOSA-N	0	3	341.480	3.344	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)Nc1ccccc1NC1CCN(C)CC1	ZINC000264040313	246005156	/nfs/dbraw/zinc/00/51/56/246005156.db2.gz	BXOCZEQKFKYHHE-OAHLLOKOSA-N	0	3	331.460	3.112	20	30		EGEDHN
N#Cc1c(F)cccc1NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000264300476	246317942	/nfs/dbraw/zinc/31/79/42/246317942.db2.gz	RLAKAUKDGBEALZ-UHFFFAOYSA-N	0	3	339.414	3.266	20	30		EGEDHN
CN(Cc1cn(C)nc1-c1ccc(C#N)cc1)Cc1ccc(O)cc1	ZINC000377689932	169061981	/nfs/dbraw/zinc/06/19/81/169061981.db2.gz	FJNSVMQLGCSLLZ-UHFFFAOYSA-N	0	3	332.407	3.296	20	30		EGEDHN
N#Cc1ccc(OCCN2CCC[C@@H](C(=O)Nc3ccccc3)C2)cc1	ZINC000012284480	211333028	/nfs/dbraw/zinc/33/30/28/211333028.db2.gz	KHFFLUACWBXLNA-GOSISDBHSA-N	0	3	349.434	3.288	20	30		EGEDHN
CCn1nc(C)c(CN2CCCN(c3ccccc3C#N)CC2)c1C	ZINC000091792383	218066706	/nfs/dbraw/zinc/06/67/06/218066706.db2.gz	PBPVYGQOISLODE-UHFFFAOYSA-N	0	3	337.471	3.104	20	30		EGEDHN
CN(CCOc1cccc(C#N)c1)CCc1nc(-c2ccccc2)no1	ZINC000512150070	269688839	/nfs/dbraw/zinc/68/88/39/269688839.db2.gz	UFYKHUWQOWGVPG-UHFFFAOYSA-N	0	3	348.406	3.162	20	30		EGEDHN
CCN(Cc1ccc(OC)c(OC)c1)C[C@H](O)c1ccc(C#N)cc1	ZINC000268572215	252033076	/nfs/dbraw/zinc/03/30/76/252033076.db2.gz	AXEUUHCHNJMTSI-SFHVURJKSA-N	0	3	340.423	3.131	20	30		EGEDHN
C[C@@H](N[C@H]1CN(Cc2ccccc2)CC[C@@H]1CO)c1ccc(C#N)cc1	ZINC000181784562	533547931	/nfs/dbraw/zinc/54/79/31/533547931.db2.gz	GLFDUJFRQLJVEU-YHYVQYDKSA-N	0	3	349.478	3.092	20	30		EGEDHN
COc1ccc(CN2CC[C@H]3[C@@H](CCCN3C3CC3)C2)cc1C#N	ZINC000246793892	141034806	/nfs/dbraw/zinc/03/48/06/141034806.db2.gz	MLRRCRHILBKALL-LPHOPBHVSA-N	0	3	325.456	3.016	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)NC1CCN([C@@H](C)c2ccccc2)CC1	ZINC000366692893	141529067	/nfs/dbraw/zinc/52/90/67/141529067.db2.gz	YZCMOJAIXPNAEQ-AWEZNQCLSA-N	0	3	337.423	3.415	20	30		EGEDHN
CN(CCN(C)C1CC1)c1c(C#N)cnc2ccc(OC(F)F)cc21	ZINC000184788280	144099355	/nfs/dbraw/zinc/09/93/55/144099355.db2.gz	FFXDQWPOQHAYCS-UHFFFAOYSA-N	0	3	346.381	3.238	20	30		EGEDHN
CCO[C@@H]1C[C@H](NCC(=O)Nc2sccc2C#N)C1(CC)CC	ZINC000187051078	144151378	/nfs/dbraw/zinc/15/13/78/144151378.db2.gz	MVMGXGBYNDCCNS-UONOGXRCSA-N	0	3	335.473	3.132	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H]1CCN(C(=O)c2cccc(F)c2C#N)C1	ZINC000363770176	144364303	/nfs/dbraw/zinc/36/43/03/144364303.db2.gz	SWOZRKTVLPSHQE-MRXNPFEDSA-N	0	3	337.398	3.044	20	30		EGEDHN
CCCCNC(=O)[C@@H]1CC[C@H](C)N(Cc2ccc(C#N)cc2OC)C1	ZINC000120710614	152295199	/nfs/dbraw/zinc/29/51/99/152295199.db2.gz	HSQIUZQYLHGHEE-MAUKXSAKSA-N	0	3	343.471	3.084	20	30		EGEDHN
COc1cccc(CN(CCN(C)C)c2ncc(C#N)cc2Cl)c1	ZINC000189630449	153085014	/nfs/dbraw/zinc/08/50/14/153085014.db2.gz	CMVCJSXZVQZRBD-UHFFFAOYSA-N	0	3	344.846	3.183	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H](O)COc1ccccc1Cl	ZINC000192707023	153254413	/nfs/dbraw/zinc/25/44/13/153254413.db2.gz	UPGLSFIDDOVUGB-INIZCTEOSA-N	0	3	330.815	3.083	20	30		EGEDHN
CN(c1ccccc1)C1CCN(C[C@H](O)c2ccc(C#N)cc2)CC1	ZINC000305075076	154080761	/nfs/dbraw/zinc/08/07/61/154080761.db2.gz	NIWICDDEGWTOHH-NRFANRHFSA-N	0	3	335.451	3.192	20	30		EGEDHN
CN(C)CCOc1cccc(NC(=O)CCc2ccc(C#N)cc2)c1	ZINC000337270824	163188715	/nfs/dbraw/zinc/18/87/15/163188715.db2.gz	ZZUOAAJJJFZGHH-UHFFFAOYSA-N	0	3	337.423	3.070	20	30		EGEDHN
C[C@H](NCCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccc(C#N)cc1	ZINC000338347002	163218200	/nfs/dbraw/zinc/21/82/00/163218200.db2.gz	DIWZCYWMKRFLOP-ZDUSSCGKSA-N	0	3	338.367	3.146	20	30		EGEDHN
CN(CCOCc1ccc(C#N)cc1)Cc1ccc(-n2ccnc2)cc1	ZINC000344119519	164107419	/nfs/dbraw/zinc/10/74/19/164107419.db2.gz	PEESVCXVZSMLHS-UHFFFAOYSA-N	0	3	346.434	3.393	20	30		EGEDHN
COCCN(C)CC[C@H](NCc1cc(C#N)cs1)c1ccccc1	ZINC000344274869	164144073	/nfs/dbraw/zinc/14/40/73/164144073.db2.gz	VCMWAQCQGWALEF-IBGZPJMESA-N	0	3	343.496	3.419	20	30		EGEDHN
CN(C)C[C@H](NC(=O)c1cc(C#N)ccc1Cl)c1ccc(F)cc1	ZINC000360206924	167270591	/nfs/dbraw/zinc/27/05/91/167270591.db2.gz	CYRNKRULYJCEEM-KRWDZBQOSA-N	0	3	345.805	3.383	20	30		EGEDHN
COc1cccc(O[C@H](C)CNCc2ccc(C#N)c(OC)c2)c1	ZINC000440823106	269794507	/nfs/dbraw/zinc/79/45/07/269794507.db2.gz	QVTNKJCSVFTXNG-CQSZACIVSA-N	0	3	326.396	3.133	20	30		EGEDHN
C[C@@H](N[C@@H](C)c1ccc2n[nH]cc2c1)C(=O)Nc1cccc(C#N)c1	ZINC000507267255	269845395	/nfs/dbraw/zinc/84/53/95/269845395.db2.gz	WWYKWFWEKJJNNP-QWHCGFSZSA-N	0	3	333.395	3.112	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)c2ccccc2-c2ccccc2C#N)CCN1C	ZINC000331370831	269893257	/nfs/dbraw/zinc/89/32/57/269893257.db2.gz	GHLJJJINJLXTOY-RDJZCZTQSA-N	0	3	333.435	3.438	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)N(C)C1CCN(C)CC1	ZINC000429839188	269906868	/nfs/dbraw/zinc/90/68/68/269906868.db2.gz	RAOLGTKMLUXZJS-UHFFFAOYSA-N	0	3	327.453	3.248	20	30		EGEDHN
Cc1cccc(C[NH2+]C2CCC(Oc3ccc(C#N)cn3)CC2)c1[O-]	ZINC000182663651	270038730	/nfs/dbraw/zinc/03/87/30/270038730.db2.gz	JLECHWWDCLAUPR-UHFFFAOYSA-N	0	3	337.423	3.447	20	30		EGEDHN
N#Cc1ccc(CN2CCC[N@@H+](Cc3cc(F)ccc3[O-])CC2)cc1	ZINC000179895620	270038799	/nfs/dbraw/zinc/03/87/99/270038799.db2.gz	UUGZMTNTGIMLGT-UHFFFAOYSA-N	0	3	339.414	3.111	20	30		EGEDHN
N#Cc1ccc(CN2CCC[N@H+](Cc3cc(F)ccc3[O-])CC2)cc1	ZINC000179895620	270038801	/nfs/dbraw/zinc/03/88/01/270038801.db2.gz	UUGZMTNTGIMLGT-UHFFFAOYSA-N	0	3	339.414	3.111	20	30		EGEDHN
N#Cc1ccc(OCCN(CCc2ccccc2)[C@@H]2CCOC2)cc1	ZINC000437529925	270051478	/nfs/dbraw/zinc/05/14/78/270051478.db2.gz	VQRAEEZQADMWNG-HXUWFJFHSA-N	0	3	336.435	3.271	20	30		EGEDHN
N#Cc1ccnc(N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)n1	ZINC000450328762	270053239	/nfs/dbraw/zinc/05/32/39/270053239.db2.gz	DEYGHNDQGJMYIZ-HNNXBMFYSA-N	0	3	347.344	3.053	20	30		EGEDHN
N#Cc1ccc(Br)c(CN2CCC[C@@H]2[C@H]2CCC[C@@H]2O)c1	ZINC000451419405	270053509	/nfs/dbraw/zinc/05/35/09/270053509.db2.gz	LGLLKRMLMQEFHY-OIISXLGYSA-N	0	3	349.272	3.446	20	30		EGEDHN
Cc1ccc([C@H]2C[C@@H](C)N(CC(=O)NCc3cccc(C#N)c3)C2)cc1	ZINC000490101030	270056426	/nfs/dbraw/zinc/05/64/26/270056426.db2.gz	QSJVIUKNKNHCSA-UTKZUKDTSA-N	0	3	347.462	3.361	20	30		EGEDHN
CCC1(CC)[C@H](N[C@@H](C)C(=O)Nc2oc(C)c(C)c2C#N)C[C@@H]1OC	ZINC000191383983	266012824	/nfs/dbraw/zinc/01/28/24/266012824.db2.gz	OLLNPMLZXLWQKI-MAZHCROVSA-N	0	3	347.459	3.278	20	30		EGEDHN
CCN(Cc1ccc(OC)cc1)C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000279736620	266135857	/nfs/dbraw/zinc/13/58/57/266135857.db2.gz	OKMJPIOSBKUZSQ-LJQANCHMSA-N	0	3	347.418	3.298	20	30		EGEDHN
CCO[C@@H](CNC(=O)C(C#N)Cc1ccc(C#N)cc1)c1ccccc1	ZINC000279912257	266289735	/nfs/dbraw/zinc/28/97/35/266289735.db2.gz	FJPNEHGMAXOHRB-PMACEKPBSA-N	0	3	347.418	3.135	20	30		EGEDHN
CCCCNC(=O)C1(NCCOc2ccccc2C#N)CCCCC1	ZINC000440897503	267009212	/nfs/dbraw/zinc/00/92/12/267009212.db2.gz	RPWALCHZQNVYDA-UHFFFAOYSA-N	0	3	343.471	3.146	20	30		EGEDHN
CCCN(CCc1cccs1)CC(=O)NCc1cccc(C#N)c1	ZINC000464596706	267012326	/nfs/dbraw/zinc/01/23/26/267012326.db2.gz	YXOAZONWWBUWIK-UHFFFAOYSA-N	0	3	341.480	3.191	20	30		EGEDHN
C[C@@H]1CN(CCC2CCN(c3cccc(F)c3C#N)CC2)C[C@@H](C)O1	ZINC000301528664	267047528	/nfs/dbraw/zinc/04/75/28/267047528.db2.gz	GWRXQQRAUPKQIP-HZPDHXFCSA-N	0	3	345.462	3.413	20	30		EGEDHN
CCN(CC)[C@@H](CNc1ccc(C#N)c(C)n1)c1cccc(OC)c1	ZINC000487938654	267061752	/nfs/dbraw/zinc/06/17/52/267061752.db2.gz	JPKLQFZEHLMCOL-IBGZPJMESA-N	0	3	338.455	3.187	20	30		EGEDHN
C[C@@H]1COc2ccccc2CN1C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000280019288	267071853	/nfs/dbraw/zinc/07/18/53/267071853.db2.gz	MLGBREXPICFWKS-DNVCBOLYSA-N	0	3	345.402	3.050	20	30		EGEDHN
CCOC(=O)N1CCC[C@H]([C@H](C)NCc2cccc(C#N)c2F)C1	ZINC000495486511	267123985	/nfs/dbraw/zinc/12/39/85/267123985.db2.gz	HTNLGQGZILSLLM-BBRMVZONSA-N	0	3	333.407	3.044	20	30		EGEDHN
CCOC(=O)[C@](C)(CNCc1ccc(C#N)cc1F)c1ccccc1	ZINC000470138479	267134433	/nfs/dbraw/zinc/13/44/33/267134433.db2.gz	PQMNYBKIMRKNBV-HXUWFJFHSA-N	0	3	340.398	3.308	20	30		EGEDHN
C[C@H](NCCOc1ccc(C#N)cc1)[C@H]1OCCc2sccc21	ZINC000292415260	267183170	/nfs/dbraw/zinc/18/31/70/267183170.db2.gz	MJGDHOKOYDLXDP-SCLBCKFNSA-N	0	3	328.437	3.291	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@@H]1Nc1cc(C#N)ccc1[N+](=O)[O-]	ZINC000302211478	267233734	/nfs/dbraw/zinc/23/37/34/267233734.db2.gz	MNEAFKTXKBUQPV-KSSFIOAISA-N	0	3	336.395	3.399	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CCN(C(=O)c2cccc(C#N)c2)C1	ZINC000324218892	267235238	/nfs/dbraw/zinc/23/52/38/267235238.db2.gz	YNQHYXGGKFCUJX-KRWDZBQOSA-N	0	3	333.435	3.152	20	30		EGEDHN
CN(C)C[C@H]1CCc2ccccc2N1C(=O)c1cc(C#N)cs1	ZINC000436721224	267282662	/nfs/dbraw/zinc/28/26/62/267282662.db2.gz	HFVUCINBEWWYEN-OAHLLOKOSA-N	0	3	325.437	3.143	20	30		EGEDHN
CN(C)[C@@H](CC(=O)NCc1cc(C#N)ccc1F)c1ccccc1	ZINC000416158605	267286793	/nfs/dbraw/zinc/28/67/93/267286793.db2.gz	TWQDDCGKMZMYDM-SFHVURJKSA-N	0	3	325.387	3.007	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N1CCC(CCN2CCOCC2)CC1	ZINC000442675005	267731024	/nfs/dbraw/zinc/73/10/24/267731024.db2.gz	ATAQVMMBCKJKGR-KRWDZBQOSA-N	0	3	327.472	3.054	20	30		EGEDHN
C[C@H](NC(C)(C)CNC(=O)c1ccc(C#N)s1)c1ccccc1	ZINC000487339125	267852273	/nfs/dbraw/zinc/85/22/73/267852273.db2.gz	XXXMPHIWCXNFSZ-ZDUSSCGKSA-N	0	3	327.453	3.479	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCN(c3ccccc3F)C2)c(F)c1	ZINC000291080342	268074434	/nfs/dbraw/zinc/07/44/34/268074434.db2.gz	UUUZDXBBBLBQRI-OAHLLOKOSA-N	0	3	327.378	3.453	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCN(c3ccc(F)cc3)C2)c(F)c1	ZINC000269393093	268074488	/nfs/dbraw/zinc/07/44/88/268074488.db2.gz	DGRDWLVNZJTFQN-HNNXBMFYSA-N	0	3	327.378	3.453	20	30		EGEDHN
N#Cc1ccc(NC(=O)C2CCN(C3CC3)CC2)cc1C(F)(F)F	ZINC000278361532	268137170	/nfs/dbraw/zinc/13/71/70/268137170.db2.gz	ODWONAJOEGGEHK-UHFFFAOYSA-N	0	3	337.345	3.390	20	30		EGEDHN
N#Cc1cccc(OCCN[C@H](c2cccs2)C2(CO)CCC2)c1	ZINC000452057860	268285169	/nfs/dbraw/zinc/28/51/69/268285169.db2.gz	HITHAUXKFQOHBZ-GOSISDBHSA-N	0	3	342.464	3.492	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CN1CCC[C@@H]1c1ccsc1	ZINC000528350215	268299834	/nfs/dbraw/zinc/29/98/34/268299834.db2.gz	LSKKFLOWSKMREV-IAGOWNOFSA-N	0	3	328.437	3.197	20	30		EGEDHN
N#Cc1csc(C(=O)N(CCN2CCCCCC2)C2CCC2)c1	ZINC000359823071	279546700	/nfs/dbraw/zinc/54/67/00/279546700.db2.gz	SJDBHXYMNAQCQC-UHFFFAOYSA-N	0	3	331.485	3.490	20	30		EGEDHN
C[C@H]1CN(c2nccnc2C#N)CCN1C[C@H]1CCCC(C)(C)C1	ZINC000538808964	314277476	/nfs/dbraw/zinc/27/74/76/314277476.db2.gz	DIBGWTPKVBXMOE-HOTGVXAUSA-N	0	3	327.476	3.075	20	30		EGEDHN
C[C@@H]1CCN(CCNC(=O)c2ccccc2Oc2ccccc2C#N)C1	ZINC000539771001	314335529	/nfs/dbraw/zinc/33/55/29/314335529.db2.gz	ZBDFCZAPMXYYFV-MRXNPFEDSA-N	0	3	349.434	3.422	20	30		EGEDHN
C[C@@]1(NCC(=O)Nc2sccc2C#N)CCCc2ccccc21	ZINC000539807617	314340314	/nfs/dbraw/zinc/34/03/14/314340314.db2.gz	MOWBPJQYXZWSMN-GOSISDBHSA-N	0	3	325.437	3.400	20	30		EGEDHN
N#Cc1ccc2nc(N[C@H]3CCN(Cc4ccccc4)C3)ccc2c1	ZINC000540079312	314361807	/nfs/dbraw/zinc/36/18/07/314361807.db2.gz	ZTXBMWVPKUHLJM-IBGZPJMESA-N	0	3	328.419	3.215	20	30		EGEDHN
COCCN(Cc1ccc(C#N)cc1)C[C@H]1CCC2(CCCC2)O1	ZINC000549119945	315076676	/nfs/dbraw/zinc/07/66/76/315076676.db2.gz	VSZKWPKUIMPQHZ-LJQANCHMSA-N	0	3	328.456	3.498	20	30		EGEDHN
Cc1cc(C#N)cnc1C(=O)N(CCN1CCCCCC1)C1CCC1	ZINC000552441639	315221057	/nfs/dbraw/zinc/22/10/57/315221057.db2.gz	OQIUOIDTVHLNAZ-UHFFFAOYSA-N	0	3	340.471	3.132	20	30		EGEDHN
Cc1ccccc1[C@@H]([C@H](C)Nc1nccc(C#N)c1Cl)N(C)C	ZINC000561408592	315760765	/nfs/dbraw/zinc/76/07/65/315760765.db2.gz	PLTNWDXQJYDGFO-SUMWQHHRSA-N	0	3	328.847	3.440	20	30		EGEDHN
Cc1cc(N2CCN(c3cnccc3C#N)CC2)c2ccccc2n1	ZINC000562332352	315819664	/nfs/dbraw/zinc/81/96/64/315819664.db2.gz	FQCJLAXPWJBLOB-UHFFFAOYSA-N	0	3	329.407	3.137	20	30		EGEDHN
COc1ccc(CN(C)CCOCc2ccc(C#N)cc2)cc1OC	ZINC000564380009	316144266	/nfs/dbraw/zinc/14/42/66/316144266.db2.gz	PFUUJEJOCKMZCY-UHFFFAOYSA-N	0	3	340.423	3.224	20	30		EGEDHN
Cc1csc(NC(=O)NCc2cccc(CN(C)C)c2)c1C#N	ZINC000565709908	316359889	/nfs/dbraw/zinc/35/98/89/316359889.db2.gz	KGVPZRLRDQPORW-UHFFFAOYSA-N	0	3	328.441	3.312	20	30		EGEDHN
Cc1ccc(C)c(OC[C@@H](O)CNCc2ccc(C#N)c(F)c2)c1C	ZINC000567698098	316657748	/nfs/dbraw/zinc/65/77/48/316657748.db2.gz	ZWOXRWFOIPAUFS-SFHVURJKSA-N	0	3	342.414	3.152	20	30		EGEDHN
Cc1cc(NC[C@H]2CCCN(C)[C@@H]2c2cccs2)c(C#N)cn1	ZINC000571635480	317226737	/nfs/dbraw/zinc/22/67/37/317226737.db2.gz	HMJCPCFNIHCSFP-KDOFPFPSSA-N	0	3	326.469	3.240	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(c3cccc(Br)c3)C2)o1	ZINC000278669211	455843781	/nfs/dbraw/zinc/84/37/81/455843781.db2.gz	HDBSQHHMHHLDOE-CYBMUJFWSA-N	0	3	346.228	3.282	20	30		EGEDHN
C[C@@H]1CN(Cc2cccc(CNCc3cc(C#N)cs3)c2)CCO1	ZINC000177690292	323344336	/nfs/dbraw/zinc/34/43/36/323344336.db2.gz	MLNNDRAZRBJWMH-OAHLLOKOSA-N	0	3	341.480	3.130	20	30		EGEDHN
CC[C@@H](NC[C@@H](O)COc1ccc(C#N)cc1)c1ccc(F)cc1F	ZINC000179633950	323396881	/nfs/dbraw/zinc/39/68/81/323396881.db2.gz	TUJBRHARPPJGIV-DNVCBOLYSA-N	0	3	346.377	3.317	20	30		EGEDHN
C[C@@H](N[C@@H]1CCN(CC(F)(F)F)C1)c1ccc(C#N)cc1Cl	ZINC000581921532	325398611	/nfs/dbraw/zinc/39/86/11/325398611.db2.gz	DXPNDMSJSIRCJQ-ZYHUDNBSSA-N	0	3	331.769	3.499	20	30		EGEDHN
COc1ccc(OCCN(C)Cc2ccc(OCC#N)cc2)cc1	ZINC000264523988	455229216	/nfs/dbraw/zinc/22/92/16/455229216.db2.gz	BICUEWNOPRAIRJ-UHFFFAOYSA-N	0	3	326.396	3.108	20	30		EGEDHN
CCOc1cccc([C@H](C)NC[C@@H](O)COc2ccc(C#N)cc2)c1	ZINC000180710393	455232312	/nfs/dbraw/zinc/23/23/12/455232312.db2.gz	NJFRQSWLPJJJSI-MAUKXSAKSA-N	0	3	340.423	3.047	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H]2C[C@@]23CCCc2ccccc23)CC1	ZINC000173161212	455241583	/nfs/dbraw/zinc/24/15/83/455241583.db2.gz	ZCRKYPFTNLKWCU-RBBKRZOGSA-N	0	3	338.495	3.437	20	30		EGEDHN
C[C@@H](CN1CCCCC1)NC(=O)CCCCOc1cccc(C#N)c1	ZINC000264754687	455276272	/nfs/dbraw/zinc/27/62/72/455276272.db2.gz	MSINTZHJXPWNNU-KRWDZBQOSA-N	0	3	343.471	3.098	20	30		EGEDHN
C[C@H](NC1CC(C#N)(c2ccccc2)C1)c1ccc(NC(N)=O)cc1	ZINC000158471094	455305499	/nfs/dbraw/zinc/30/54/99/455305499.db2.gz	NYNFFQKMJLECAS-KLOIUYPJSA-N	0	3	334.423	3.452	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CNCc1ccc(C2CCC2)cc1	ZINC000600734754	460583249	/nfs/dbraw/zinc/58/32/49/460583249.db2.gz	PZRPEJQTRISHKS-FQEVSTJZSA-N	0	3	336.435	3.355	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@H](CO)CC(F)F)cc1OC	ZINC000623507653	460587396	/nfs/dbraw/zinc/58/73/96/460587396.db2.gz	UOXYPPBZWLRJPV-NSHDSACASA-N	0	3	335.778	3.019	20	30		EGEDHN
CN(CCOc1ccccc1F)CCC(=O)Nc1ccccc1C#N	ZINC000014079367	453502727	/nfs/dbraw/zinc/50/27/27/453502727.db2.gz	VOGYXCFSZBPAMK-UHFFFAOYSA-N	0	3	341.386	3.037	20	30		EGEDHN
C[C@@H]1CCCC[C@@H]1CN1CCN(c2oc(C3CC3)nc2C#N)CC1	ZINC000612397678	460617817	/nfs/dbraw/zinc/61/78/17/460617817.db2.gz	XPWAKDCFMJCFKN-GDBMZVCRSA-N	0	3	328.460	3.372	20	30		EGEDHN
C[C@H]1CCCC[C@H]1CN1CCN(c2oc(C3CC3)nc2C#N)CC1	ZINC000612397680	460618155	/nfs/dbraw/zinc/61/81/55/460618155.db2.gz	XPWAKDCFMJCFKN-HOCLYGCPSA-N	0	3	328.460	3.372	20	30		EGEDHN
COc1ccc(CN2CCCN(Cc3cccc(C#N)c3)CC2)cc1	ZINC000026344875	453797177	/nfs/dbraw/zinc/79/71/77/453797177.db2.gz	CECMHVGMBSYEMY-UHFFFAOYSA-N	0	3	335.451	3.275	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)c1cccc(C#N)c1)c1ccsc1	ZINC000031988776	453860743	/nfs/dbraw/zinc/86/07/43/453860743.db2.gz	WKJHEBJMSQVIOD-QGZVFWFLSA-N	0	3	327.453	3.433	20	30		EGEDHN
C=CCC[C@H](O)CN1CCN(c2cccc(C(F)(F)F)c2)CC1	ZINC000033924293	453918440	/nfs/dbraw/zinc/91/84/40/453918440.db2.gz	XHBJPQZMTKFJQC-INIZCTEOSA-N	0	3	328.378	3.155	20	30		EGEDHN
CC(C)CCO[C@@H]1CCN(CCC(=O)Nc2ccc(C#N)cc2)C1	ZINC000083247557	453946247	/nfs/dbraw/zinc/94/62/47/453946247.db2.gz	YSWCKNVBUFBLNG-GOSISDBHSA-N	0	3	329.444	3.024	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](c2ncccc2C)C(C)C)CC1	ZINC000076016568	453949190	/nfs/dbraw/zinc/94/91/90/453949190.db2.gz	NRQVWQMVKSRSFG-QGZVFWFLSA-N	0	3	330.476	3.037	20	30		EGEDHN
CN(C)[C@@H](CNC(=O)Nc1ccc(CC#N)cc1)Cc1ccccc1	ZINC000076085169	453960903	/nfs/dbraw/zinc/96/09/03/453960903.db2.gz	OMOBVKVSCMKPEI-LJQANCHMSA-N	0	3	336.439	3.047	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)c1cc(C#N)cs1	ZINC000084182697	453975892	/nfs/dbraw/zinc/97/58/92/453975892.db2.gz	HUQLERQWVVAIMX-YOEHRIQHSA-N	0	3	339.464	3.260	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cccc(C#N)c1	ZINC000076388012	453995474	/nfs/dbraw/zinc/99/54/74/453995474.db2.gz	ZJSUOXDMTZVUGI-KRWDZBQOSA-N	0	3	333.435	3.295	20	30		EGEDHN
CC[C@H](C)N(C)CC(=O)Nc1c(C#N)c(C)c(C)n1Cc1ccco1	ZINC000068450459	454028021	/nfs/dbraw/zinc/02/80/21/454028021.db2.gz	JHBHNSNYSZRVAK-ZDUSSCGKSA-N	0	3	342.443	3.287	20	30		EGEDHN
C[C@H](C#N)CSc1ccccc1NC(=O)N(C)CCN1CCCC1	ZINC000077203848	454074349	/nfs/dbraw/zinc/07/43/49/454074349.db2.gz	WMVWVWAEEMCLIQ-OAHLLOKOSA-N	0	3	346.500	3.498	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H]2CCCC[C@H]2Cc2ccccc2)CC1	ZINC000077309577	454088728	/nfs/dbraw/zinc/08/87/28/454088728.db2.gz	INWMRASZADSSHH-LEWJYISDSA-N	0	3	338.495	3.249	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NC[C@H](Cc1ccccc1)N(C)C	ZINC000045053477	454135327	/nfs/dbraw/zinc/13/53/27/454135327.db2.gz	AZOCDGAFQBKUDN-SFHVURJKSA-N	0	3	338.451	3.154	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H]2C[C@@H]2c2cc(F)ccc2F)CC1	ZINC000119278921	454184006	/nfs/dbraw/zinc/18/40/06/454184006.db2.gz	STSIWIYWIZLBFG-NVXWUHKLSA-N	0	3	334.410	3.225	20	30		EGEDHN
CC(C)[C@H](NCC(=O)N[C@](C)(C#N)C1CC1)c1ccc(Cl)cc1	ZINC000078396187	454247639	/nfs/dbraw/zinc/24/76/39/454247639.db2.gz	UYPAMOLDYZXPKW-ZWKOTPCHSA-N	0	3	333.863	3.435	20	30		EGEDHN
CC(C)c1csc(C(C#N)C(=O)c2ccc(-n3ccnn3)cc2)n1	ZINC000089980062	454252163	/nfs/dbraw/zinc/25/21/63/454252163.db2.gz	KBOWTBHVCNBONP-AWEZNQCLSA-N	0	3	337.408	3.337	20	30		EGEDHN
N#Cc1ccc(CNCc2ccc(NC(=O)c3cccnc3)cc2)cc1	ZINC000131491250	454258000	/nfs/dbraw/zinc/25/80/00/454258000.db2.gz	MESNBPJOCMKJGY-UHFFFAOYSA-N	0	3	342.402	3.495	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)c1ccc(Cl)cc1	ZINC000047010680	454318598	/nfs/dbraw/zinc/31/85/98/454318598.db2.gz	FSQZICKJZBQYQO-UHFFFAOYSA-N	0	3	341.842	3.416	20	30		EGEDHN
N#CC(C(=O)c1cccc(NC(N)=O)c1)c1ccc(C(F)(F)F)cn1	ZINC000047371494	454364388	/nfs/dbraw/zinc/36/43/88/454364388.db2.gz	BJAONPFOWFBYIO-GFCCVEGCSA-N	0	3	348.284	3.081	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N[C@H](C)c1ccccn1)C(C)C	ZINC000079206334	454381298	/nfs/dbraw/zinc/38/12/98/454381298.db2.gz	RGCTVSFZFNPVKL-AEFFLSMTSA-N	0	3	330.476	3.140	20	30		EGEDHN
C[C@@H](C#N)CN(C)C(=O)NC[C@H](c1cccs1)N1CCC(C)CC1	ZINC000079220262	454383595	/nfs/dbraw/zinc/38/35/95/454383595.db2.gz	KNABULMRUBDGBQ-JKSUJKDBSA-N	0	3	348.516	3.322	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1SCc1ccccn1	ZINC000073090613	454393311	/nfs/dbraw/zinc/39/33/11/454393311.db2.gz	PMLJNAAWFNGWPK-UHFFFAOYSA-N	0	3	343.500	3.180	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CCC(OCC(C)C)CC1	ZINC000079391425	454407579	/nfs/dbraw/zinc/40/75/79/454407579.db2.gz	YKBGQYDFHBWVPF-LJQANCHMSA-N	0	3	347.499	3.292	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1CCC[C@@H]1c1cc(C)ccc1C	ZINC000133646323	454449720	/nfs/dbraw/zinc/44/97/20/454449720.db2.gz	ZLSILJBGTPZCPG-VQIMIIECSA-N	0	3	327.472	3.449	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN(C)CC2CCCC2)cc1	ZINC000064020751	454464318	/nfs/dbraw/zinc/46/43/18/454464318.db2.gz	QGZYWVVBEOCQJY-UHFFFAOYSA-N	0	3	343.471	3.454	20	30		EGEDHN
COC(=O)[C@H](C)[C@H](NCCOc1ccc(C#N)cc1)c1ccccc1	ZINC000079922272	454499583	/nfs/dbraw/zinc/49/95/83/454499583.db2.gz	HNMQYQPBWFUYJV-BEFAXECRSA-N	0	3	338.407	3.077	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)C[C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000102401455	454502450	/nfs/dbraw/zinc/50/24/50/454502450.db2.gz	MZUCKFFHRHGRJA-RISCZKNCSA-N	0	3	340.345	3.432	20	30		EGEDHN
COc1cccc(CN2CCC(Oc3cccc(C#N)c3)CC2)c1O	ZINC000092034359	454505375	/nfs/dbraw/zinc/50/53/75/454505375.db2.gz	XADLZHPVUKZOGB-UHFFFAOYSA-N	0	3	338.407	3.316	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)Cc2cc3ccccc3o2)CC1	ZINC000175477543	455452924	/nfs/dbraw/zinc/45/29/24/455452924.db2.gz	QGNSCFMJGYZKRG-UHFFFAOYSA-N	0	3	327.428	3.225	20	30		EGEDHN
N#CC(C(=O)CCc1ccccc1Cl)C(=O)Nc1ccccn1	ZINC000103717593	454564962	/nfs/dbraw/zinc/56/49/62/454564962.db2.gz	QSZJFRQXRAZGQE-CYBMUJFWSA-N	0	3	327.771	3.015	20	30		EGEDHN
N#CC(C(=O)CCSc1ccccc1F)C(=O)Nc1ccccn1	ZINC000104055630	454572262	/nfs/dbraw/zinc/57/22/62/454572262.db2.gz	HBMICVQOSFXYJU-GFCCVEGCSA-N	0	3	343.383	3.050	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000074446834	454583847	/nfs/dbraw/zinc/58/38/47/454583847.db2.gz	CWAPBVBRRGINCO-PKOBYXMFSA-N	0	3	330.472	3.091	20	30		EGEDHN
C[C@@](C#N)(NC(=O)CN[C@H](c1ccc(F)cc1)C1CCC1)C1CC1	ZINC000104706144	454596523	/nfs/dbraw/zinc/59/65/23/454596523.db2.gz	TXSUTDOGZPUOGA-OALUTQOASA-N	0	3	329.419	3.065	20	30		EGEDHN
C=CCOc1ccc(CN(CCN2C(=O)CCC2=O)C(C)(C)C)cc1	ZINC000134853231	454598110	/nfs/dbraw/zinc/59/81/10/454598110.db2.gz	NYAZOTYBIVVBJT-UHFFFAOYSA-N	0	3	344.455	3.001	20	30		EGEDHN
CC(C)(C)OC(=O)CCN1CCC(Oc2cccc(C#N)c2)CC1	ZINC000104712723	454598397	/nfs/dbraw/zinc/59/83/97/454598397.db2.gz	GBVQOCMHSGRKTD-UHFFFAOYSA-N	0	3	330.428	3.133	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN(C)C[C@@H]1CCCO[C@@H]1c1ccccc1	ZINC000051133403	454610540	/nfs/dbraw/zinc/61/05/40/454610540.db2.gz	BOUHFABZLTWBPN-PZJWPPBQSA-N	0	3	342.483	3.287	20	30		EGEDHN
Cc1cc2ncn(C[C@@H](O)CN(C)Cc3cccc(C#N)c3)c2cc1C	ZINC000051322655	454618512	/nfs/dbraw/zinc/61/85/12/454618512.db2.gz	YHKNPWVTAIGJDU-IBGZPJMESA-N	0	3	348.450	3.018	20	30		EGEDHN
Cc1ccc(C(=O)N(CCN(C)C)Cc2cccc(C#N)c2)cc1C	ZINC000065930848	454640779	/nfs/dbraw/zinc/64/07/79/454640779.db2.gz	DHMFQTMAVIOQTM-UHFFFAOYSA-N	0	3	335.451	3.379	20	30		EGEDHN
Cc1cc(C(=O)N(CCN(C)C)Cc2cccc(C#N)c2)c(C)s1	ZINC000065931067	454641471	/nfs/dbraw/zinc/64/14/71/454641471.db2.gz	DHFIJCLUDTULIV-UHFFFAOYSA-N	0	3	341.480	3.441	20	30		EGEDHN
COc1cccc([C@H](C)N2CCN(CCCSCC#N)CC2)c1	ZINC000074990320	454671439	/nfs/dbraw/zinc/67/14/39/454671439.db2.gz	WHCYXRCYRHTJNO-INIZCTEOSA-N	0	3	333.501	3.021	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cccnc2SC(F)F)CC1	ZINC000106037545	454674258	/nfs/dbraw/zinc/67/42/58/454674258.db2.gz	GYAKFFIJNAPKQG-UHFFFAOYSA-N	0	3	341.427	3.167	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C2(c3cccc(F)c3)CCC2)CC1	ZINC000106037099	454674504	/nfs/dbraw/zinc/67/45/04/454674504.db2.gz	GKCSLFGFGMCUPJ-UHFFFAOYSA-N	0	3	330.447	3.404	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1	ZINC000106038703	454675746	/nfs/dbraw/zinc/67/57/46/454675746.db2.gz	QWLRZYLYLUWFBN-UHFFFAOYSA-N	0	3	337.807	3.019	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CCCN(Cc2ccccc2C)CC1	ZINC000066314759	454683333	/nfs/dbraw/zinc/68/33/33/454683333.db2.gz	DKDRHWBYRFCTOY-SFHVURJKSA-N	0	3	330.472	3.011	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCC2(c3ccc(F)cc3)CC2)CC1	ZINC000106261021	454688722	/nfs/dbraw/zinc/68/87/22/454688722.db2.gz	GNRZIPRCEDKXMZ-UHFFFAOYSA-N	0	3	345.462	3.197	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCCCOc2ccc(C)cc2)CC1	ZINC000106268911	454688999	/nfs/dbraw/zinc/68/89/99/454688999.db2.gz	PYBJKFMIQPMAMG-UHFFFAOYSA-N	0	3	345.487	3.104	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@@H](C)NCC(C)(C)c1ccc(OC)cc1	ZINC000123956311	454690216	/nfs/dbraw/zinc/69/02/16/454690216.db2.gz	HAWBKPDBXPKYCV-MRXNPFEDSA-N	0	3	332.488	3.376	20	30		EGEDHN
CN(Cc1ccccc1)[C@H]1CCN(C(=O)CCc2ccc(C#N)cc2)C1	ZINC000081126186	454690724	/nfs/dbraw/zinc/69/07/24/454690724.db2.gz	BBAAIAKLCUGJRV-NRFANRHFSA-N	0	3	347.462	3.224	20	30		EGEDHN
CC[C@H](NCC(=O)NC1(C#N)CCCCC1)c1ccc(OC)cc1	ZINC000124182376	454703928	/nfs/dbraw/zinc/70/39/28/454703928.db2.gz	QRBROUWDECMMSA-KRWDZBQOSA-N	0	3	329.444	3.079	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](CC)CCc2ccccc2)CC1	ZINC000623635085	460652022	/nfs/dbraw/zinc/65/20/22/460652022.db2.gz	UHLHWYGDSAVTSD-GOSISDBHSA-N	0	3	329.488	3.347	20	30		EGEDHN
CCOC(=O)CC[C@H]1CCCN(Cc2ccc(OC)c(C#N)c2)C1	ZINC000162096238	454751365	/nfs/dbraw/zinc/75/13/65/454751365.db2.gz	JKDBLBFFXPGBMP-OAHLLOKOSA-N	0	3	330.428	3.122	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC[C@H](C)Oc2ccc(C)cc2)CC1	ZINC000176500759	454752408	/nfs/dbraw/zinc/75/24/08/454752408.db2.gz	ZUERWQIYSGULFA-KRWDZBQOSA-N	0	3	345.487	3.102	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000136942666	454761981	/nfs/dbraw/zinc/76/19/81/454761981.db2.gz	YHHXCVFTEHNJIX-IBGZPJMESA-N	0	3	339.395	3.412	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cccc(NC3CCCC3)c2)CC1	ZINC000109898502	454839971	/nfs/dbraw/zinc/83/99/71/454839971.db2.gz	WYORZIIYHVPVGA-UHFFFAOYSA-N	0	3	325.456	3.325	20	30		EGEDHN
C=CC1CCN([C@H](C)C(=O)N(C)Cc2ccc(OC)c(F)c2)CC1	ZINC000111258090	454858770	/nfs/dbraw/zinc/85/87/70/454858770.db2.gz	UFJJQEJLRUKSII-CQSZACIVSA-N	0	3	334.435	3.079	20	30		EGEDHN
CC[C@@H](NCC(=O)N(CCC#N)c1cccc(C)c1C)[C@H]1CCCO1	ZINC000182329768	455490265	/nfs/dbraw/zinc/49/02/65/455490265.db2.gz	CVGQIRIDEKZCOX-IEBWSBKVSA-N	0	3	343.471	3.097	20	30		EGEDHN
CN(C(=O)c1ccccc1-c1ccccc1C#N)[C@H]1CCCN(C)C1	ZINC000151196509	454950910	/nfs/dbraw/zinc/95/09/10/454950910.db2.gz	MJUOTMWSPFKPCX-KRWDZBQOSA-N	0	3	333.435	3.391	20	30		EGEDHN
CN(C(=O)c1ccccc1-c1ccccc1C#N)[C@@H]1CCCN(C)C1	ZINC000151196574	454951200	/nfs/dbraw/zinc/95/12/00/454951200.db2.gz	MJUOTMWSPFKPCX-QGZVFWFLSA-N	0	3	333.435	3.391	20	30		EGEDHN
CCc1cc(N2CCN(c3ccc(C#N)cn3)CC2)c2ccccc2n1	ZINC000178513841	454958531	/nfs/dbraw/zinc/95/85/31/454958531.db2.gz	LQTYFSGFAAAKKT-UHFFFAOYSA-N	0	3	343.434	3.390	20	30		EGEDHN
C=CC[C@H](C)[C@H](C)NCc1ccccc1S(=O)(=O)NC(C)(C)C	ZINC000155099187	454963093	/nfs/dbraw/zinc/96/30/93/454963093.db2.gz	IGBHTJNIJXQKHT-GJZGRUSLSA-N	0	3	338.517	3.454	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Cc2c[nH]c3ccc(F)cc23)CC1	ZINC000115372837	455012099	/nfs/dbraw/zinc/01/20/99/455012099.db2.gz	RLACFJULABZHIX-UHFFFAOYSA-N	0	3	329.419	3.006	20	30		EGEDHN
Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@@H]1N2C(=O)c1sccc1C#N	ZINC000128034943	455020330	/nfs/dbraw/zinc/02/03/30/455020330.db2.gz	BOPJRMOXSHRQJW-RDJZCZTQSA-N	0	3	337.448	3.376	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H]2CCCc3ccc(C)cc32)CC1	ZINC000179340746	455034615	/nfs/dbraw/zinc/03/46/15/455034615.db2.gz	PILCEPFDSCFQEU-LJQANCHMSA-N	0	3	327.472	3.322	20	30		EGEDHN
N#CC1(C(=O)Nc2ccc(CCN3CCSCC3)cc2)CCCC1	ZINC000128361401	455049244	/nfs/dbraw/zinc/04/92/44/455049244.db2.gz	YLZCYTHHYIHWSS-UHFFFAOYSA-N	0	3	343.496	3.300	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(C)ccc2N2CCCC2)CC1	ZINC000116754146	455068438	/nfs/dbraw/zinc/06/84/38/455068438.db2.gz	WERPJIXEEJXLLJ-UHFFFAOYSA-N	0	3	341.499	3.366	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2sc(-c3ccccc3)nc2C)CC1	ZINC000171723109	455089668	/nfs/dbraw/zinc/08/96/68/455089668.db2.gz	PEQGFUKFZYGTNO-UHFFFAOYSA-N	0	3	341.480	3.499	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H](c3nc(C4CC4)n[nH]3)C2)c(F)c1	ZINC000152240427	455091168	/nfs/dbraw/zinc/09/11/68/455091168.db2.gz	KGSWNJSCHRLKPQ-OAHLLOKOSA-N	0	3	325.391	3.072	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H](c3n[nH]c(C4CC4)n3)C2)c(F)c1	ZINC000152240427	455091173	/nfs/dbraw/zinc/09/11/73/455091173.db2.gz	KGSWNJSCHRLKPQ-OAHLLOKOSA-N	0	3	325.391	3.072	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)[C@@H]2CCCc3nc(C)sc32)CC1	ZINC000171907778	455101367	/nfs/dbraw/zinc/10/13/67/455101367.db2.gz	PLYOLFOWTYKZGP-MRXNPFEDSA-N	0	3	348.516	3.121	20	30		EGEDHN
CCCCNC(=O)[C@@H]1CC[C@H](C)N(Cc2cc(C#N)ccc2OC)C1	ZINC000156359639	455109352	/nfs/dbraw/zinc/10/93/52/455109352.db2.gz	ZODFPCYJFKEHLP-DOTOQJQBSA-N	0	3	343.471	3.084	20	30		EGEDHN
COc1ccc([C@@H](CO)N(C)CCCOc2cccc(C#N)c2)cc1	ZINC000156385596	455112549	/nfs/dbraw/zinc/11/25/49/455112549.db2.gz	YDNXQUIAKYUUNG-HXUWFJFHSA-N	0	3	340.423	3.001	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2C[C@@H](c3ccccc3)C[C@H]2C)CC1	ZINC000172150882	455128950	/nfs/dbraw/zinc/12/89/50/455128950.db2.gz	YGLBZVWQVVFEMV-AEFFLSMTSA-N	0	3	327.472	3.224	20	30		EGEDHN
COc1ccc(CNC[C@@H](O)c2ccsc2)cc1OCCCC#N	ZINC000152560294	455136157	/nfs/dbraw/zinc/13/61/57/455136157.db2.gz	XDCYOIFNDJPLMG-MRXNPFEDSA-N	0	3	346.452	3.262	20	30		EGEDHN
COc1ccc(CNC[C@](C)(O)c2ccccc2Cl)cc1C#N	ZINC000156708484	455146190	/nfs/dbraw/zinc/14/61/90/455146190.db2.gz	XMGWWEWAZDSVSK-SFHVURJKSA-N	0	3	330.815	3.218	20	30		EGEDHN
C=CCN1CCC(NC(=O)Cc2c[nH]c3ccc(Cl)cc23)CC1	ZINC000172542759	455161097	/nfs/dbraw/zinc/16/10/97/455161097.db2.gz	YDCGIGLMYAOLPO-UHFFFAOYSA-N	0	3	331.847	3.130	20	30		EGEDHN
C[C@H](CC(=O)N(C)c1ccccc1)NCc1ccc(OCC#N)cc1	ZINC000180551070	455195226	/nfs/dbraw/zinc/19/52/26/455195226.db2.gz	WIOXGEDOPPNSCK-MRXNPFEDSA-N	0	3	337.423	3.120	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(CCC)Cc2ccc(F)cc2)CC1	ZINC000264398018	455205279	/nfs/dbraw/zinc/20/52/79/455205279.db2.gz	YOEQPTXNHNSJSY-UHFFFAOYSA-N	0	3	333.451	3.398	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCc2ccccc2C(F)(F)F)CC1	ZINC000264455963	455217156	/nfs/dbraw/zinc/21/71/56/455217156.db2.gz	ZVGMDLNDMHNFFD-UHFFFAOYSA-N	0	3	341.377	3.155	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(COC(C)C)cc2)CC1	ZINC000264464191	455218435	/nfs/dbraw/zinc/21/84/35/455218435.db2.gz	HFBWBNHAWPLBKN-UHFFFAOYSA-N	0	3	330.472	3.382	20	30		EGEDHN
C=CCC1(C(=O)NCc2ccccc2CN2CCC[C@H]2CO)CCC1	ZINC000190111960	455279714	/nfs/dbraw/zinc/27/97/14/455279714.db2.gz	CKEMPWSMECHRAB-IBGZPJMESA-N	0	3	342.483	3.006	20	30		EGEDHN
CC(C)(C)[C@@H](NCC(=O)N(CCC#N)CCC#N)c1cccc(F)c1	ZINC000181073337	455282913	/nfs/dbraw/zinc/28/29/13/455282913.db2.gz	RIHBTIOEEFNBQO-SFHVURJKSA-N	0	3	344.434	3.158	20	30		EGEDHN
C[C@H]1CCN(C(=O)Cc2ccc(C#N)cc2)CCN1Cc1ccccc1	ZINC000173507446	455296753	/nfs/dbraw/zinc/29/67/53/455296753.db2.gz	ISYGCTANTODSID-SFHVURJKSA-N	0	3	347.462	3.224	20	30		EGEDHN
CN(CCC#N)C(=O)CCNC1(c2cccc(Cl)c2)CCCC1	ZINC000181464183	455339084	/nfs/dbraw/zinc/33/90/84/455339084.db2.gz	PXUNLXQUHMLEGC-UHFFFAOYSA-N	0	3	333.863	3.461	20	30		EGEDHN
C[C@H](NCCNC(=O)c1ccccc1Cl)c1cccc(C#N)c1	ZINC000181747380	455378158	/nfs/dbraw/zinc/37/81/58/455378158.db2.gz	DANJPNVHTSDAPR-ZDUSSCGKSA-N	0	3	327.815	3.292	20	30		EGEDHN
N#Cc1ccc(NC(=O)[C@H]2CCCN(Cc3ccccc3)C2)cc1C#N	ZINC000265782417	455379859	/nfs/dbraw/zinc/37/98/59/455379859.db2.gz	MKPSJEOOAJYLFR-SFHVURJKSA-N	0	3	344.418	3.281	20	30		EGEDHN
C[C@H]1CN(Cc2cccc(C#N)c2)CC[C@@H]1NC(=O)OC(C)(C)C	ZINC000265849987	455392937	/nfs/dbraw/zinc/39/29/37/455392937.db2.gz	PQVBXHGQDCQOJJ-YOEHRIQHSA-N	0	3	329.444	3.293	20	30		EGEDHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)N[C@@H](CCC#N)c2ccccc2)C1	ZINC000246005666	455413109	/nfs/dbraw/zinc/41/31/09/455413109.db2.gz	SIZJSKBQYUGZPM-GBESFXJTSA-N	0	3	340.471	3.157	20	30		EGEDHN
COc1ccc(C(=O)C(C#N)c2cnc3ccccc3n2)c(OC)c1	ZINC000190953815	455413914	/nfs/dbraw/zinc/41/39/14/455413914.db2.gz	ZPYRRPQOBDYZLC-CQSZACIVSA-N	0	3	333.347	3.137	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1CCS[C@@H]2CCCC[C@H]21	ZINC000246070462	455421057	/nfs/dbraw/zinc/42/10/57/455421057.db2.gz	CKAKUFMGANSKRU-CRAIPNDOSA-N	0	3	332.469	3.306	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCc2c(C)oc3ccccc32)CC1	ZINC000184652913	455421208	/nfs/dbraw/zinc/42/12/08/455421208.db2.gz	RPMIMQDYDBHFTJ-UHFFFAOYSA-N	0	3	327.428	3.191	20	30		EGEDHN
C=C(C)[C@@H](NC(=O)NC[C@@H]1CCCN(C)C1)c1ccc(F)c(F)c1	ZINC000184697491	455430240	/nfs/dbraw/zinc/43/02/40/455430240.db2.gz	MUQZOVXHELXVHN-SUMWQHHRSA-N	0	3	337.414	3.223	20	30		EGEDHN
C=CC1CCN(C(=O)Nc2cccc(N3CCN(CC)CC3)c2)CC1	ZINC000184920573	455472622	/nfs/dbraw/zinc/47/26/22/455472622.db2.gz	FUFUOADFNUNGSV-UHFFFAOYSA-N	0	3	342.487	3.258	20	30		EGEDHN
C[C@H](CNC(=O)c1cccc(SCC#N)c1)N1CCC[C@H](C)C1	ZINC000246412866	455486065	/nfs/dbraw/zinc/48/60/65/455486065.db2.gz	BHXYEPLMFINCFW-LSDHHAIUSA-N	0	3	331.485	3.152	20	30		EGEDHN
C=CCN(CCCN1CCN(C(C)C)CC1)Cc1ccccc1F	ZINC000191458654	455486544	/nfs/dbraw/zinc/48/65/44/455486544.db2.gz	HECUMXYBMDFOCI-UHFFFAOYSA-N	0	3	333.495	3.230	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)Cc2ccc(C#N)cc2)CCN1Cc1ccccc1	ZINC000176105244	455540035	/nfs/dbraw/zinc/54/00/35/455540035.db2.gz	HSWWEPMERFFFIR-LAUBAEHRSA-N	0	3	347.462	3.270	20	30		EGEDHN
COc1cc(C#N)ccc1CN[C@H]1CCO[C@H]1c1ccc(F)c(F)c1	ZINC000192131768	455561629	/nfs/dbraw/zinc/56/16/29/455561629.db2.gz	PWCWQWGTFPJVTJ-HKUYNNGSSA-N	0	3	344.361	3.465	20	30		EGEDHN
Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@@H]1N2C(=O)c1ccc(F)c(C#N)c1	ZINC000283812195	455597881	/nfs/dbraw/zinc/59/78/81/455597881.db2.gz	IPPUZPRQAVNTBD-PXNSSMCTSA-N	0	3	349.409	3.454	20	30		EGEDHN
CCc1cc[n+](C(C(=O)c2nccs2)C(=S)[N-]C2CCC2)cc1	ZINC000292252673	455609438	/nfs/dbraw/zinc/60/94/38/455609438.db2.gz	DRBXECWZQXTZNA-UHFFFAOYSA-O	0	3	346.501	3.074	20	30		EGEDHN
C[C@H]1CN(Cc2ccc(CN[C@@H]3CCC[C@H](C#N)C3)cc2)C[C@H](C)O1	ZINC000185770323	455619894	/nfs/dbraw/zinc/61/98/94/455619894.db2.gz	JSNWOHOTYCJEJL-IDPBPBMLSA-N	0	3	341.499	3.468	20	30		EGEDHN
C=C(C)[C@@H](NC(=O)N1CC[C@H](N2CCCC2)C1)c1ccc(F)c(F)c1	ZINC000185827954	455630334	/nfs/dbraw/zinc/63/03/34/455630334.db2.gz	SJUWDUGLGPBJQO-MAUKXSAKSA-N	0	3	349.425	3.462	20	30		EGEDHN
CC[C@@H](Cc1ccc(C)cc1)N(C)CC(=O)N[C@](C)(C#N)C1CC1	ZINC000247642919	455632419	/nfs/dbraw/zinc/63/24/19/455632419.db2.gz	TXIKTXIWBGMUHI-AZUAARDMSA-N	0	3	327.472	3.056	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)[C@H]1CCCc2cccnc21)C(C)C	ZINC000192554792	455640808	/nfs/dbraw/zinc/64/08/08/455640808.db2.gz	FQPKLQZVFVRYFD-RBUKOAKNSA-N	0	3	341.499	3.316	20	30		EGEDHN
Cc1cc(N(CCN(C)C)Cc2ccc(C#N)cc2)nc(C2CC2)n1	ZINC000268317455	455650007	/nfs/dbraw/zinc/65/00/07/455650007.db2.gz	LYSZMUMTEBSSLQ-UHFFFAOYSA-N	0	3	335.455	3.102	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc3c(c2)CC(C)(C)O3)CC1	ZINC000268329126	455653179	/nfs/dbraw/zinc/65/31/79/455653179.db2.gz	MAGWCRULFBZXFH-UHFFFAOYSA-N	0	3	329.444	3.172	20	30		EGEDHN
C[C@H](c1cccc(C(F)(F)F)c1)N(C)CCC(=O)N(C)CCC#N	ZINC000271585273	455692933	/nfs/dbraw/zinc/69/29/33/455692933.db2.gz	RMVNGEYZEQFDRX-CYBMUJFWSA-N	0	3	341.377	3.460	20	30		EGEDHN
CN(CCC#N)C(=O)CCNC1(c2ccc(Cl)c(Cl)c2)CC1	ZINC000271611642	455700373	/nfs/dbraw/zinc/70/03/73/455700373.db2.gz	VVSIJLAGLHASND-UHFFFAOYSA-N	0	3	340.254	3.334	20	30		EGEDHN
C=CCN1CCC(N[C@H]2CCCc3oc(C(=O)OCC)c(C)c32)CC1	ZINC000192839356	455703772	/nfs/dbraw/zinc/70/37/72/455703772.db2.gz	LOMIURZCHAVLKR-INIZCTEOSA-N	0	3	346.471	3.382	20	30		EGEDHN
CN(C)c1ccc(CN(C[C@H](O)c2ccc(C#N)cc2)C2CC2)cc1	ZINC000268593114	455710448	/nfs/dbraw/zinc/71/04/48/455710448.db2.gz	GKNLVZVUXAAGDG-NRFANRHFSA-N	0	3	335.451	3.322	20	30		EGEDHN
CCC[C@H](N[C@@H]1CCC[C@@H](C#N)C1)C(=O)N1CCc2sccc2C1	ZINC000248745056	455728607	/nfs/dbraw/zinc/72/86/07/455728607.db2.gz	FKWLEUNNHXKCFP-OIISXLGYSA-N	0	3	345.512	3.473	20	30		EGEDHN
Cc1cccc(C[NH+]2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1[O-]	ZINC000271710397	455729660	/nfs/dbraw/zinc/72/96/60/455729660.db2.gz	GOYGCXCGSXIRBE-UHFFFAOYSA-N	0	3	349.434	3.423	20	30		EGEDHN
CC[C@H](N[C@H]1CCC[C@@H](C#N)C1)c1ccccc1OCC(=O)N(C)C	ZINC000248828391	455732469	/nfs/dbraw/zinc/73/24/69/455732469.db2.gz	MFJJIZMBPXFHSU-RYRKJORJSA-N	0	3	343.471	3.277	20	30		EGEDHN
N#C[C@@H]1CCC[C@H](N[C@@H]2CCN(c3ccc(F)c(Cl)c3)C2=O)C1	ZINC000248927113	455738805	/nfs/dbraw/zinc/73/88/05/455738805.db2.gz	XIFJLEHDFIBMFW-BFQNTYOBSA-N	0	3	335.810	3.256	20	30		EGEDHN
CC[C@@](C)(NCCC(C#N)(c1ccccc1)c1ccccc1)C(N)=O	ZINC000193073646	455740956	/nfs/dbraw/zinc/74/09/56/455740956.db2.gz	YDNNVJZUXKSBNU-HXUWFJFHSA-N	0	3	335.451	3.130	20	30		EGEDHN
N#C[C@H]1CCC[C@@H](Nc2ccccc2CN2CCC(CO)CC2)C1	ZINC000193112391	455742704	/nfs/dbraw/zinc/74/27/04/455742704.db2.gz	ZRFISWNQJWWMNH-PKOBYXMFSA-N	0	3	327.472	3.385	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(OC)c(C3CC3)c2)CC1	ZINC000278080233	455752657	/nfs/dbraw/zinc/75/26/57/455752657.db2.gz	WUYHRZOBTLZYHT-UHFFFAOYSA-N	0	3	328.456	3.343	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2c(Cl)cncc2Cl)CC1	ZINC000293159880	455776119	/nfs/dbraw/zinc/77/61/19/455776119.db2.gz	SZCDWPQNETXRIX-UHFFFAOYSA-N	0	3	328.243	3.159	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000293374485	455784330	/nfs/dbraw/zinc/78/43/30/455784330.db2.gz	HVWPJUXAXFAMCW-LJQANCHMSA-N	0	3	344.499	3.151	20	30		EGEDHN
C=CCC(C)(C)CNC(=O)C(=O)Nc1cccc(CN(CC)CC)c1	ZINC000293381729	455784810	/nfs/dbraw/zinc/78/48/10/455784810.db2.gz	MRSSNWQPPAOZTM-UHFFFAOYSA-N	0	3	345.487	3.185	20	30		EGEDHN
C[C@@H](NCCC(=O)N1CCc2sccc2C1)c1ccc(C#N)cc1	ZINC000271870255	455793094	/nfs/dbraw/zinc/79/30/94/455793094.db2.gz	MLJFFFGLENAYIO-CQSZACIVSA-N	0	3	339.464	3.245	20	30		EGEDHN
COc1ccc(OC)c([C@H](O)CN[C@@H](C)c2ccc(C#N)c(F)c2)c1	ZINC000271939596	455799250	/nfs/dbraw/zinc/79/92/50/455799250.db2.gz	OKWQQAPOJDRVNC-KPZWWZAWSA-N	0	3	344.386	3.099	20	30		EGEDHN
O=C(c1nccs1)C(C(=S)[N-]C1CCCCC1)[n+]1ccccc1	ZINC000278270496	455802091	/nfs/dbraw/zinc/80/20/91/455802091.db2.gz	ORUIJHGPSRQLIU-UHFFFAOYSA-O	0	3	346.501	3.292	20	30		EGEDHN
CC[C@H](N[C@@H]1CCCN(CC(F)(F)F)C1=O)c1ccc(C#N)cc1	ZINC000278358552	455828676	/nfs/dbraw/zinc/82/86/76/455828676.db2.gz	BFDYRWXAQVWQTP-LSDHHAIUSA-N	0	3	339.361	3.152	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)C[C@@H]1C=CCCC1	ZINC000186731309	455830033	/nfs/dbraw/zinc/83/00/33/455830033.db2.gz	WBGXAIFTLZZILH-QGZVFWFLSA-N	0	3	325.456	3.195	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000294955093	455833286	/nfs/dbraw/zinc/83/32/86/455833286.db2.gz	IXSAKQHBMFYBFA-UHFFFAOYSA-N	0	3	348.462	3.387	20	30		EGEDHN
CC1(C)[C@H](NCc2cc(C#N)ccc2Br)[C@H]2CCO[C@H]21	ZINC000295092033	455838853	/nfs/dbraw/zinc/83/88/53/455838853.db2.gz	ADCJFNTWNLKBTQ-BPLDGKMQSA-N	0	3	335.245	3.224	20	30		EGEDHN
CN(C[C@H](O)COc1ccccc1C(F)(F)F)[C@@H]1CC[C@@H](C#N)C1	ZINC000278571798	455840111	/nfs/dbraw/zinc/84/01/11/455840111.db2.gz	JHRCDEMDAGPFLW-MCIONIFRSA-N	0	3	342.361	3.069	20	30		EGEDHN
CN(C)Cc1cccc(NC(=O)NC2(c3cccc(C#N)c3)CC2)c1	ZINC000269634468	455851894	/nfs/dbraw/zinc/85/18/94/455851894.db2.gz	QATDJAQHZFHCKO-UHFFFAOYSA-N	0	3	334.423	3.431	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@H](C)Cn2ccc3ccccc32)CC1	ZINC000285479540	455854794	/nfs/dbraw/zinc/85/47/94/455854794.db2.gz	VUKKNKZLCNGXTQ-MRXNPFEDSA-N	0	3	325.456	3.044	20	30		EGEDHN
N#Cc1cc(C(=O)NC2CCN(Cc3ccccc3)CC2)ccc1F	ZINC000279266304	455861400	/nfs/dbraw/zinc/86/14/00/455861400.db2.gz	UOAOOZTZBACYGB-UHFFFAOYSA-N	0	3	337.398	3.092	20	30		EGEDHN
C[C@@H](NC1(c2cccc(C#N)c2)CC1)c1ccc(-n2cncn2)cc1	ZINC000272165993	455864733	/nfs/dbraw/zinc/86/47/33/455864733.db2.gz	CGLISMWPDZCWQO-OAHLLOKOSA-N	0	3	329.407	3.479	20	30		EGEDHN
N#CCCn1cc(CNC[C@@H](O)c2ccccc2)c(-c2ccccc2)n1	ZINC000194665960	455870759	/nfs/dbraw/zinc/87/07/59/455870759.db2.gz	ITDZZIZTJNBNNP-HXUWFJFHSA-N	0	3	346.434	3.287	20	30		EGEDHN
CN(CC1(c2ccccc2)CC1)C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000280130280	455899194	/nfs/dbraw/zinc/89/91/94/455899194.db2.gz	VCTVLXHDITZVKP-LJQANCHMSA-N	0	3	343.430	3.431	20	30		EGEDHN
C=CCc1cc(CNC[C@](C)(O)c2ccc(F)cc2)cc(OC)c1O	ZINC000270274777	455918836	/nfs/dbraw/zinc/91/88/36/455918836.db2.gz	LHKUISVDQOOKND-FQEVSTJZSA-N	0	3	345.414	3.266	20	30		EGEDHN
C=CCc1cc(CNC[C@@](C)(O)c2ccc(F)cc2)cc(OC)c1O	ZINC000270274779	455918862	/nfs/dbraw/zinc/91/88/62/455918862.db2.gz	LHKUISVDQOOKND-HXUWFJFHSA-N	0	3	345.414	3.266	20	30		EGEDHN
C=CCC[C@H](NCc1ccnc(N2CCN(C)CC2)c1)c1ccco1	ZINC000285818432	455922599	/nfs/dbraw/zinc/92/25/99/455922599.db2.gz	WFUBMDIETWYXEA-SFHVURJKSA-N	0	3	340.471	3.224	20	30		EGEDHN
CNc1ccc(C#N)cc1NC(=O)c1ccc(CN2CCCC2)cc1	ZINC000285876113	455933841	/nfs/dbraw/zinc/93/38/41/455933841.db2.gz	IHZZNCGUNALIGK-UHFFFAOYSA-N	0	3	334.423	3.448	20	30		EGEDHN
Cc1occc1C(=O)NC1CCN([C@H](C)c2cccc(C#N)c2)CC1	ZINC000187674272	455937417	/nfs/dbraw/zinc/93/74/17/455937417.db2.gz	WZFURIFHLRCHFE-CQSZACIVSA-N	0	3	337.423	3.415	20	30		EGEDHN
C=CCC[C@@H](NCCCNC(=O)c1cccc(O)c1)c1ccco1	ZINC000285987239	455954673	/nfs/dbraw/zinc/95/46/73/455954673.db2.gz	HYLYJLPNXJERGU-QGZVFWFLSA-N	0	3	328.412	3.402	20	30		EGEDHN
CN(CCOc1ccc(C#N)cc1)CCc1nc(-c2ccccc2)no1	ZINC000286114538	455980092	/nfs/dbraw/zinc/98/00/92/455980092.db2.gz	UMOSWZKZDJLFHI-UHFFFAOYSA-N	0	3	348.406	3.162	20	30		EGEDHN
COc1ccc(CN(C)CCc2nc(-c3ccccc3)no2)cc1C#N	ZINC000286162491	455990481	/nfs/dbraw/zinc/99/04/81/455990481.db2.gz	WJKXSMUHOOTOMC-UHFFFAOYSA-N	0	3	348.406	3.291	20	30		EGEDHN
CCS[C@@H]1CCC[C@@H]1NCC(=O)N(CCC#N)c1ccccc1	ZINC000286205504	455999105	/nfs/dbraw/zinc/99/91/05/455999105.db2.gz	QHNZXVIQVZLGJQ-DLBZAZTESA-N	0	3	331.485	3.197	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000280561744	455999429	/nfs/dbraw/zinc/99/94/29/455999429.db2.gz	FVAISIGKNCMGRQ-RHSMWYFYSA-N	0	3	337.423	3.243	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)C1=CCN(C)CC1	ZINC000272653845	456026777	/nfs/dbraw/zinc/02/67/77/456026777.db2.gz	AYRNIYRKUNZCOG-INIZCTEOSA-N	0	3	340.471	3.130	20	30		EGEDHN
C=CCNC(=O)[C@H](C)N[C@H](c1cccc(OC(F)(F)F)c1)C1CC1	ZINC000286746789	456053350	/nfs/dbraw/zinc/05/33/50/456053350.db2.gz	YNLCNEMJDNHSER-NHYWBVRUSA-N	0	3	342.361	3.317	20	30		EGEDHN
C#CCOc1ccccc1NC(=O)N1CCN(C2CCC2)C[C@@H](C)C1	ZINC000296912589	456065211	/nfs/dbraw/zinc/06/52/11/456065211.db2.gz	PALHBICVVMDVLI-MRXNPFEDSA-N	0	3	341.455	3.037	20	30		EGEDHN
C=CCS(=O)(=O)CCN[C@H](C)c1ccc(OC)c2ccccc21	ZINC000272818266	456078326	/nfs/dbraw/zinc/07/83/26/456078326.db2.gz	FJFIYBDWSILELC-CQSZACIVSA-N	0	3	333.453	3.100	20	30		EGEDHN
N=C(NCc1ccc(OCC2CC2)nc1)Nc1cc(F)ccc1F	ZINC000288713362	456103406	/nfs/dbraw/zinc/10/34/06/456103406.db2.gz	LDGSTPKTGNZWHO-UHFFFAOYSA-N	0	3	332.354	3.075	20	30		EGEDHN
CC(C)c1nnc2n1C[C@H](N[C@@H](C)c1ccc(C#N)cc1F)CC2	ZINC000332696964	456112916	/nfs/dbraw/zinc/11/29/16/456112916.db2.gz	XIRDFIORZPEJRF-GXTWGEPZSA-N	0	3	327.407	3.078	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)c2cccc(F)c2C#N)N(C)C)cc1	ZINC000188694405	456114578	/nfs/dbraw/zinc/11/45/78/456114578.db2.gz	JPSRDKXTKWIYRZ-SFHVURJKSA-N	0	3	325.387	3.039	20	30		EGEDHN
N#CCOc1cccc(NC2CCN(CCC(F)(F)F)CC2)c1	ZINC000272927451	456115283	/nfs/dbraw/zinc/11/52/83/456115283.db2.gz	SCTMNIRJHYKRJZ-UHFFFAOYSA-N	0	3	327.350	3.418	20	30		EGEDHN
Cc1cc2c(ncnc2N2CCN(CC(C)(C)CCC#N)CC2)s1	ZINC000188757914	456130013	/nfs/dbraw/zinc/13/00/13/456130013.db2.gz	GPECRBCRSFKMAI-UHFFFAOYSA-N	0	3	343.500	3.452	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cccc([N+](=O)[O-])c2Cl)CC1	ZINC000289811129	456143734	/nfs/dbraw/zinc/14/37/34/456143734.db2.gz	VQIRKDCZSQNDTG-UHFFFAOYSA-N	0	3	338.795	3.020	20	30		EGEDHN
C=CCOc1ccc(CN[C@H](CO)Cc2ccc(F)cc2)cc1OC	ZINC000271169806	456152315	/nfs/dbraw/zinc/15/23/15/456152315.db2.gz	BVVMSGOJWYWORP-SFHVURJKSA-N	0	3	345.414	3.092	20	30		EGEDHN
C#C[C@H](NC(=O)N(CC)C[C@@H]1CCN(Cc2ccccc2)C1)C(C)C	ZINC000281179260	456154788	/nfs/dbraw/zinc/15/47/88/456154788.db2.gz	YMYJWGVSOHWUFV-UXHICEINSA-N	0	3	341.499	3.198	20	30		EGEDHN
CN(C)CCN(Cc1cccs1)C(=O)Nc1ccc(C#N)c(F)c1	ZINC000289877594	456165440	/nfs/dbraw/zinc/16/54/40/456165440.db2.gz	RVNXPKNBYFJIEC-UHFFFAOYSA-N	0	3	346.431	3.355	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc([C@@H]3CCOC3)cc2)CC1	ZINC000297336239	456190229	/nfs/dbraw/zinc/19/02/29/456190229.db2.gz	JGJHZHKHSFKVPC-QGZVFWFLSA-N	0	3	343.471	3.353	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc([C@H]3CCOC3)cc2)CC1	ZINC000297336234	456190245	/nfs/dbraw/zinc/19/02/45/456190245.db2.gz	JGJHZHKHSFKVPC-KRWDZBQOSA-N	0	3	343.471	3.353	20	30		EGEDHN
Cc1ccc2nc(CN(CCN(C)C)Cc3ccc(C#N)cc3)cn2c1	ZINC000289955753	456194401	/nfs/dbraw/zinc/19/44/01/456194401.db2.gz	YBRZILMHDRERLO-UHFFFAOYSA-N	0	3	347.466	3.078	20	30		EGEDHN
Cc1cccc(C[C@H](CO)NCc2cccc(OCCCC#N)c2)c1	ZINC000189022103	456203336	/nfs/dbraw/zinc/20/33/36/456203336.db2.gz	ZUMOTLTYTGJYEP-HXUWFJFHSA-N	0	3	338.451	3.371	20	30		EGEDHN
C=CC[C@H](CC)NC(=O)N(Cc1ccncc1)C[C@H]1CCCN1CC	ZINC000281342068	456206707	/nfs/dbraw/zinc/20/67/07/456206707.db2.gz	MADCDABPILEEIY-RBUKOAKNSA-N	0	3	344.503	3.432	20	30		EGEDHN
C=CCN(Cc1ccc(O[C@@H](C)C(=O)N(C)C)c(OCC)c1)C1CC1	ZINC000273490315	456234278	/nfs/dbraw/zinc/23/42/78/456234278.db2.gz	NFUCDVGKPFXHHP-HNNXBMFYSA-N	0	3	346.471	3.091	20	30		EGEDHN
COc1ccc([C@H](OC)[C@@H](C)NCc2ccc(C#N)c(OC)c2)cc1	ZINC000281467637	456241975	/nfs/dbraw/zinc/24/19/75/456241975.db2.gz	BHJICEZOLVWNJW-JLTOFOAXSA-N	0	3	340.423	3.441	20	30		EGEDHN
C=CCCCCNC(=O)N(C)C1CCN(CCc2ccccn2)CC1	ZINC000274590604	456262675	/nfs/dbraw/zinc/26/26/75/456262675.db2.gz	IFBYIQWDXXVDTR-UHFFFAOYSA-N	0	3	344.503	3.086	20	30		EGEDHN
CN1CCN(CCNc2ccc(C#N)cc2C(F)(F)F)CC1(C)C	ZINC000281580301	456269744	/nfs/dbraw/zinc/26/97/44/456269744.db2.gz	FTPHJSRLEDADBC-UHFFFAOYSA-N	0	3	340.393	3.015	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](C)c2ccccc2SC)CC1	ZINC000281628702	456278999	/nfs/dbraw/zinc/27/89/99/456278999.db2.gz	HZKKEENOJNVRLN-AWEZNQCLSA-N	0	3	333.501	3.419	20	30		EGEDHN
Cn1cc(CN2CCC[C@H](CCNC(=O)OC(C)(C)C)C2)cc1C#N	ZINC000281674049	456289312	/nfs/dbraw/zinc/28/93/12/456289312.db2.gz	DRJYSFGKDOSVQA-OAHLLOKOSA-N	0	3	346.475	3.024	20	30		EGEDHN
Cc1ccc([C@H](CNc2nc3ccccn3c2C#N)N2CCCC2)o1	ZINC000302109629	456290015	/nfs/dbraw/zinc/29/00/15/456290015.db2.gz	TURYKAYFLGSURC-INIZCTEOSA-N	0	3	335.411	3.356	20	30		EGEDHN
C=CCOCCCC(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000290381597	456312076	/nfs/dbraw/zinc/31/20/76/456312076.db2.gz	HMHOPMFIOMVTMB-IBGZPJMESA-N	0	3	348.487	3.176	20	30		EGEDHN
CCN1C[C@@H](C)N(Cc2ccc(C#N)cc2Br)[C@H](C)C1	ZINC000347710262	456318834	/nfs/dbraw/zinc/31/88/34/456318834.db2.gz	SJROFODAHRVTCJ-CHWSQXEVSA-N	0	3	336.277	3.235	20	30		EGEDHN
C[C@H](C#N)CSc1ccccc1NC(=O)CN[C@H]1CSC[C@@H]1C	ZINC000352817788	456333500	/nfs/dbraw/zinc/33/35/00/456333500.db2.gz	RSIMHWHDXNBWQD-IPYPFGDCSA-N	0	3	349.525	3.218	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N(CC)Cc1ccc(CN(C)C)cc1	ZINC000275859123	456334133	/nfs/dbraw/zinc/33/41/33/456334133.db2.gz	XGXJUAZWPSBQFH-HXUWFJFHSA-N	0	3	332.488	3.326	20	30		EGEDHN
C=CCN1CC[C@H](NC(C)(C)c2cccc(C(F)(F)F)c2)C1=O	ZINC000282021934	456391449	/nfs/dbraw/zinc/39/14/49/456391449.db2.gz	PGTFJWXDURRTQP-AWEZNQCLSA-N	0	3	326.362	3.317	20	30		EGEDHN
COC[C@H](NCCCC1(C#N)CCOCC1)c1ccc(F)c(F)c1	ZINC000282027858	456393883	/nfs/dbraw/zinc/39/38/83/456393883.db2.gz	PUEJCDQPDPMTIR-KRWDZBQOSA-N	0	3	338.398	3.342	20	30		EGEDHN
N#Cc1cc(F)ccc1NC[C@@H]1CN(Cc2ccccc2)CCCO1	ZINC000302798446	456404192	/nfs/dbraw/zinc/40/41/92/456404192.db2.gz	RLQRWKLYIHQBPZ-LJQANCHMSA-N	0	3	339.414	3.400	20	30		EGEDHN
C=CCOCCCN(C)[C@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O	ZINC000347962010	456432266	/nfs/dbraw/zinc/43/22/66/456432266.db2.gz	HMSSUGZDQUJAOG-HOTGVXAUSA-N	0	3	330.255	3.476	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1	ZINC000353036464	456453461	/nfs/dbraw/zinc/45/34/61/456453461.db2.gz	ZDBAFIGPHZOTJW-RXVVDRJESA-N	0	3	344.499	3.338	20	30		EGEDHN
C[C@@H](NC(=O)C(C#N)Cc1ccc(C#N)cc1)c1c(F)cccc1F	ZINC000348090419	456470330	/nfs/dbraw/zinc/47/03/30/456470330.db2.gz	TYRSZWOXXCYISD-DOMZBBRYSA-N	0	3	339.345	3.396	20	30		EGEDHN
C[C@@H](c1ccc(C#N)cc1)N(C)CCN1CCN(c2ccccc2)CC1	ZINC000303724025	456480784	/nfs/dbraw/zinc/48/07/84/456480784.db2.gz	BRFXSTDTXASSMC-IBGZPJMESA-N	0	3	348.494	3.373	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000337755711	456526489	/nfs/dbraw/zinc/52/64/89/456526489.db2.gz	BHGNXEYCUIROAC-MGPUTAFESA-N	0	3	333.435	3.117	20	30		EGEDHN
C=C(C)COc1cc(CN2CCC([C@@H](C)CO)CC2)ccc1OC	ZINC000651956236	462391608	/nfs/dbraw/zinc/39/16/08/462391608.db2.gz	QQEQJKFMEYWCDD-INIZCTEOSA-N	0	3	333.472	3.491	20	30		EGEDHN
C=CCOc1ccc(CN[C@H]2CCO[C@H]2c2nccn2CC)cc1	ZINC000343385559	456578994	/nfs/dbraw/zinc/57/89/94/456578994.db2.gz	DHSNNBLPUYIJPJ-ZWKOTPCHSA-N	0	3	327.428	3.088	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H]2CCO[C@@H]2c2nccn2C)cc1Cl	ZINC000343386617	456580767	/nfs/dbraw/zinc/58/07/67/456580767.db2.gz	GUZJGQOWIDONFF-WBVHZDCISA-N	0	3	347.846	3.258	20	30		EGEDHN
C=CCn1c(C(C)C)nnc1N1CCN(C2CCC(C)CC2)CC1	ZINC000337916125	456598026	/nfs/dbraw/zinc/59/80/26/456598026.db2.gz	UNWCYDOCGMDFNK-UHFFFAOYSA-N	0	3	331.508	3.288	20	30		EGEDHN
C[C@@H]1[C@@H](NC(=O)c2ccccc2-c2ccccc2C#N)CCCN1C	ZINC000343431095	456615110	/nfs/dbraw/zinc/61/51/10/456615110.db2.gz	JPHAJIMSEDGLCP-QRWLVFNGSA-N	0	3	333.435	3.438	20	30		EGEDHN
C[C@H](C#N)CN(C)C(=O)N[C@H]1CCN(Cc2ccccc2)CC1(C)C	ZINC000282758201	456616985	/nfs/dbraw/zinc/61/69/85/456616985.db2.gz	BVYJZAWINXMTRH-AEFFLSMTSA-N	0	3	342.487	3.088	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N(CCN(C)C)Cc1cccs1	ZINC000337963649	456625435	/nfs/dbraw/zinc/62/54/35/456625435.db2.gz	GNYHNEJYSAYYFQ-UHFFFAOYSA-N	0	3	327.453	3.132	20	30		EGEDHN
C=CCN1CCC(NC(=O)C[C@H](c2cccs2)n2cccc2)CC1	ZINC000353315104	456631601	/nfs/dbraw/zinc/63/16/01/456631601.db2.gz	OAYCLTSOMCDKPV-QGZVFWFLSA-N	0	3	343.496	3.296	20	30		EGEDHN
CS[C@@H]1CN(c2c(C#N)cnc3c(C)cc(C)cc32)C[C@@H]1N(C)C	ZINC000340732502	456656095	/nfs/dbraw/zinc/65/60/95/456656095.db2.gz	AMLIUZXCYXOAEN-DLBZAZTESA-N	0	3	340.496	3.205	20	30		EGEDHN
CS[C@@H]1CN(c2ccc(C#N)cc2C(F)(F)F)C[C@H]1N(C)C	ZINC000340735519	456656904	/nfs/dbraw/zinc/65/69/04/456656904.db2.gz	ATYWPQIFUCSCEF-ZIAGYGMSSA-N	0	3	329.391	3.059	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CCN(C(=O)C2(C#N)CCCCC2)C1	ZINC000324095655	456660602	/nfs/dbraw/zinc/66/06/02/456660602.db2.gz	CIZVUPWTLKXYLY-GOSISDBHSA-N	0	3	339.483	3.441	20	30		EGEDHN
C=CCN(Cc1ccsc1)[C@H](C)c1cccc(-n2cnnn2)c1	ZINC000353505022	456722366	/nfs/dbraw/zinc/72/23/66/456722366.db2.gz	UGQIZFYSWYCGDW-CQSZACIVSA-N	0	3	325.441	3.473	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Cc1nc(CC)cs1)C(C)C	ZINC000283184022	456730175	/nfs/dbraw/zinc/73/01/75/456730175.db2.gz	LNPYZVWXRQZGNO-MRXNPFEDSA-N	0	3	335.517	3.063	20	30		EGEDHN
Cc1cn2c(n1)[C@H](CNC(=O)[C@@H]1CCCN1C1CCCC1)CCC2	ZINC000328662991	456732821	/nfs/dbraw/zinc/73/28/21/456732821.db2.gz	XSCHFVKRRLNNHS-RDJZCZTQSA-N	0	3	330.476	3.432	20	30		EGEDHN
Cc1cc(C)cc(NC(=O)[C@H](C)N2CCC[C@@H]2[C@@H]2COCC[C@H]2O)c1	ZINC000328693856	456737725	/nfs/dbraw/zinc/73/77/25/456737725.db2.gz	CSMTWECORMUIFB-GDAAHCPNSA-N	0	3	346.471	3.142	20	30		EGEDHN
C[C@H](C(=O)NC1(C#N)CCCCC1)N1CC[C@H](C2CCOCC2)C1	ZINC000328812089	456767772	/nfs/dbraw/zinc/76/77/72/456767772.db2.gz	FOMQTXBTYLLFTH-WBVHZDCISA-N	0	3	333.476	3.306	20	30		EGEDHN
O=C(CN1CC[C@H](C2CCOCC2)C1)N[C@@H]1CCOc2ccccc21	ZINC000328835019	456772203	/nfs/dbraw/zinc/77/22/03/456772203.db2.gz	MEHYVUAMYLTQTJ-FUHWJXTLSA-N	0	3	344.455	3.215	20	30		EGEDHN
CCOC(=O)c1csc(C(C#N)C(=O)c2cccn2C(C)C)n1	ZINC000343913230	456782011	/nfs/dbraw/zinc/78/20/11/456782011.db2.gz	FRVOFEFNFVNCKU-LLVKDONJSA-N	0	3	331.397	3.192	20	30		EGEDHN
Cc1noc(C[C@H](NCCOc2ccc(C#N)cc2)c2ccccc2)n1	ZINC000277347509	456789304	/nfs/dbraw/zinc/78/93/04/456789304.db2.gz	WKROZMUYKJQMBD-IBGZPJMESA-N	0	3	348.406	3.202	20	30		EGEDHN
Cc1noc(C)c1C(C)(C)NC(=O)C(C#N)CCc1ccccc1	ZINC000344038083	456790392	/nfs/dbraw/zinc/79/03/92/456790392.db2.gz	ZNWYNDLREDPWDD-MRXNPFEDSA-N	0	3	325.412	3.415	20	30		EGEDHN
CN(C)[C@@H](CNC(=O)C[C@H](CC#N)c1ccccc1)c1ccccc1	ZINC000353604392	456796837	/nfs/dbraw/zinc/79/68/37/456796837.db2.gz	OQXXKFCSAKIUHA-PMACEKPBSA-N	0	3	335.451	3.493	20	30		EGEDHN
C=CC[C@H](CO)CNCc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1	ZINC000341285173	456833075	/nfs/dbraw/zinc/83/30/75/456833075.db2.gz	XDFYUYFLMQYQCW-ZDUSSCGKSA-N	0	3	346.383	3.138	20	30		EGEDHN
C[C@H](c1ccccc1)[C@@H](NCc1ccccc1C(C)(C)C#N)C(N)=O	ZINC000292075807	456848382	/nfs/dbraw/zinc/84/83/82/456848382.db2.gz	DBPVJYBSOUUVHJ-DNVCBOLYSA-N	0	3	335.451	3.235	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cc(-c2ccco2)on1)C(C)C	ZINC000344786951	456859698	/nfs/dbraw/zinc/85/96/98/456859698.db2.gz	JJNWEUAKBBPINF-MRXNPFEDSA-N	0	3	343.427	3.363	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN(C)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1	ZINC000348822306	456871302	/nfs/dbraw/zinc/87/13/02/456871302.db2.gz	NRTLGQPFQCCFDP-RTBURBONSA-N	0	3	348.462	3.402	20	30		EGEDHN
CN(C[C@H](O)COc1ccc(C(F)(F)F)cc1)[C@@H]1CC[C@H](C#N)C1	ZINC000338994512	456891151	/nfs/dbraw/zinc/89/11/51/456891151.db2.gz	WWMICRFVQVHSBK-CFVMTHIKSA-N	0	3	342.361	3.069	20	30		EGEDHN
C[C@H]1CCN(C)CCN1C(=O)Nc1cccc(C#Cc2ccccn2)c1	ZINC000345053373	456910196	/nfs/dbraw/zinc/91/01/96/456910196.db2.gz	FSYCROBOAITRMU-KRWDZBQOSA-N	0	3	348.450	3.039	20	30		EGEDHN
CCN1C[C@@H](C)N(Cc2ccc(OC)c(OCCCC#N)c2)C[C@H]1C	ZINC000353816443	456920796	/nfs/dbraw/zinc/92/07/96/456920796.db2.gz	MOJUQPFLTOOMAT-IAGOWNOFSA-N	0	3	345.487	3.292	20	30		EGEDHN
C=CC[C@H](C)[C@H](C)[NH2+]Cc1cccc(-c2n[n-]c(C(=O)OCC)n2)c1	ZINC000349254658	456925359	/nfs/dbraw/zinc/92/53/59/456925359.db2.gz	ZYJFWQLKFXKMNV-KBPBESRZSA-N	0	3	342.443	3.339	20	30		EGEDHN
[O-]C(NC[C@H]1CCCC[C@H]1C(F)(F)F)=[NH+][C@@H]1CCc2nc[nH]c2C1	ZINC000329736936	456933305	/nfs/dbraw/zinc/93/33/05/456933305.db2.gz	STZVVUFKHVCMBA-IJLUTSLNSA-N	0	3	344.381	3.139	20	30		EGEDHN
[O-]C(NC[C@H]1CCCC[C@H]1C(F)(F)F)=[NH+][C@@H]1CCc2[nH]cnc2C1	ZINC000329736936	456933308	/nfs/dbraw/zinc/93/33/08/456933308.db2.gz	STZVVUFKHVCMBA-IJLUTSLNSA-N	0	3	344.381	3.139	20	30		EGEDHN
[O-]C(NC[C@H]1CCCC[C@H]1C(F)(F)F)=[NH+][C@H]1CCc2nc[nH]c2C1	ZINC000329736934	456933841	/nfs/dbraw/zinc/93/38/41/456933841.db2.gz	STZVVUFKHVCMBA-GRYCIOLGSA-N	0	3	344.381	3.139	20	30		EGEDHN
[O-]C(NC[C@H]1CCCC[C@H]1C(F)(F)F)=[NH+][C@H]1CCc2[nH]cnc2C1	ZINC000329736934	456933845	/nfs/dbraw/zinc/93/38/45/456933845.db2.gz	STZVVUFKHVCMBA-GRYCIOLGSA-N	0	3	344.381	3.139	20	30		EGEDHN
C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)CSc1nccn1C(C)(C)C	ZINC000329809110	456944411	/nfs/dbraw/zinc/94/44/11/456944411.db2.gz	AWRFLCOQNHQQDJ-OCCSQVGLSA-N	0	3	336.505	3.169	20	30		EGEDHN
Cc1ncoc1C(=O)N[C@H]1CC2(CCN(C)CC2)Oc2ccccc21	ZINC000329985494	456970654	/nfs/dbraw/zinc/97/06/54/456970654.db2.gz	DIBORRYDIDXQPZ-HNNXBMFYSA-N	0	3	341.411	3.276	20	30		EGEDHN
O=C(NC[C@@H]1COc2ccccc2O1)[C@H]1CCCN1C1CCCC1	ZINC000330000995	456972177	/nfs/dbraw/zinc/97/21/77/456972177.db2.gz	XKJDPHWRNGOYCQ-HZPDHXFCSA-N	0	3	330.428	3.190	20	30		EGEDHN
N#C[C@@H]1CC[C@H](N2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)C1	ZINC000339183412	456981078	/nfs/dbraw/zinc/98/10/78/456981078.db2.gz	GBIGNUWGHCICPI-AQNXPRMDSA-N	0	3	339.483	3.282	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1)OCC	ZINC000339203951	456991097	/nfs/dbraw/zinc/99/10/97/456991097.db2.gz	NODXLAXMZCZNRR-WDSOQIARSA-N	0	3	330.472	3.309	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)NC[C@@H]2CCCCN2C2CC2)cc1	ZINC000346008260	457010637	/nfs/dbraw/zinc/01/06/37/457010637.db2.gz	WUTFOJNQBUMUGO-SFHVURJKSA-N	0	3	343.471	3.068	20	30		EGEDHN
N#CCCCOc1cccc(CN2CCC(O[C@@H]3CCOC3)CC2)c1	ZINC000354025630	457017387	/nfs/dbraw/zinc/01/73/87/457017387.db2.gz	HDORJNKEUSKJBZ-HXUWFJFHSA-N	0	3	344.455	3.139	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2CCN([C@@H]3C[C@@H]3C)C[C@H](C)C2)cc1	ZINC000346161863	457021758	/nfs/dbraw/zinc/02/17/58/457021758.db2.gz	NFLKAUGZIYMFQV-TXPKVOOTSA-N	0	3	328.456	3.054	20	30		EGEDHN
C=CCC[C@@H](O)CN[C@@H](c1cncc(Br)c1)C1CC1	ZINC000342093305	457104450	/nfs/dbraw/zinc/10/44/50/457104450.db2.gz	QUPMCXHWBXGAND-HUUCEWRRSA-N	0	3	325.250	3.212	20	30		EGEDHN
Cn1cc(NC(=O)NCC(C)(C)N2CCCCC2)c(C(F)(F)F)n1	ZINC000331331473	457168314	/nfs/dbraw/zinc/16/83/14/457168314.db2.gz	UIMJFWDOCZYIIP-UHFFFAOYSA-N	0	3	347.385	3.029	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2nc3ccccc3cc2Cl)CC1	ZINC000354279227	457169780	/nfs/dbraw/zinc/16/97/80/457169780.db2.gz	NEZUZUSUQYJVHE-UHFFFAOYSA-N	0	3	329.831	3.268	20	30		EGEDHN
C[C@H](N[C@H]1CC(C)(C)CCc2ccccc21)C(=O)N(C)CCC#N	ZINC000331485287	457193143	/nfs/dbraw/zinc/19/31/43/457193143.db2.gz	WSJDZMQPWKSPHA-YJBOKZPZSA-N	0	3	327.472	3.440	20	30		EGEDHN
CCCN(CCN1CCCC1)C(=O)[C@H](C#N)CCc1ccccc1	ZINC000342254990	457193528	/nfs/dbraw/zinc/19/35/28/457193528.db2.gz	UMPOQNOCKFPKIF-IBGZPJMESA-N	0	3	327.472	3.093	20	30		EGEDHN
CC(C)(C#N)CCCN1CCC(NC(=O)c2ccc(F)cc2)CC1	ZINC000350667425	457196527	/nfs/dbraw/zinc/19/65/27/457196527.db2.gz	BPURJBHHNQMTPZ-UHFFFAOYSA-N	0	3	331.435	3.350	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)NC[C@@H]1CCCSC1)C(C)C	ZINC000350745432	457203828	/nfs/dbraw/zinc/20/38/28/457203828.db2.gz	BNXRJKUICNTKQX-IRXDYDNUSA-N	0	3	339.549	3.127	20	30		EGEDHN
CCO[C@H]1C[C@@H](N(C)CCOc2ccc(C#N)cc2OC)C1(C)C	ZINC000354424878	457212757	/nfs/dbraw/zinc/21/27/57/457212757.db2.gz	HADBTBYXNHOPOS-MSOLQXFVSA-N	0	3	332.444	3.081	20	30		EGEDHN
N#CC(C(=O)c1cccc(NC(=O)C2CCCCC2)c1)c1ccncn1	ZINC000354472086	457244468	/nfs/dbraw/zinc/24/44/68/457244468.db2.gz	UOVIRVYLKDXILD-QGZVFWFLSA-N	0	3	348.406	3.485	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccc(CC#N)cc2)C1	ZINC000340102122	457333141	/nfs/dbraw/zinc/33/31/41/457333141.db2.gz	LVUGHIWJNOPTAS-OXJNMPFZSA-N	0	3	333.435	3.318	20	30		EGEDHN
C[C@H](C(=O)N(C)CCC#N)N1CCC[C@@](C)(c2ccccc2)CC1	ZINC000352211315	457348289	/nfs/dbraw/zinc/34/82/89/457348289.db2.gz	JTQHBBUDKYRCJH-YLJYHZDGSA-N	0	3	327.472	3.191	20	30		EGEDHN
CCC(C#N)(CC)C(=O)NCC1(N(C)Cc2ccccc2)CCC1	ZINC000386625409	457431726	/nfs/dbraw/zinc/43/17/26/457431726.db2.gz	FBKIYLZGYMTYNL-UHFFFAOYSA-N	0	3	327.472	3.487	20	30		EGEDHN
CCN(CCCC1CCN(CC2(C#N)CC2)CC1)CC1(C#N)CC1	ZINC000347477903	457453594	/nfs/dbraw/zinc/45/35/94/457453594.db2.gz	KUVZILKDPSANRD-UHFFFAOYSA-N	0	3	328.504	3.408	20	30		EGEDHN
C[C@H]1[C@@H](c2ccccc2)CCN1CC(=O)NCc1cccc(C#N)c1	ZINC000374210591	457523399	/nfs/dbraw/zinc/52/33/99/457523399.db2.gz	VYNQBMYGYDGPSB-JXFKEZNVSA-N	0	3	333.435	3.052	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@H](CO)C1CCCC1	ZINC000352680439	457525814	/nfs/dbraw/zinc/52/58/14/457525814.db2.gz	TZBNBPPONPPTRH-MRXNPFEDSA-N	0	3	334.485	3.044	20	30		EGEDHN
C=CCN(CCOc1ccc(C#N)cc1OC)CCc1ccco1	ZINC000352702270	457543083	/nfs/dbraw/zinc/54/30/83/457543083.db2.gz	VDXDNTJIIVYLNW-UHFFFAOYSA-N	0	3	326.396	3.269	20	30		EGEDHN
C=CCCOCCCCC(=O)N1C[C@@H](N(C)C)Cc2ccccc21	ZINC000342833329	457546431	/nfs/dbraw/zinc/54/64/31/457546431.db2.gz	YUAISGAJEAHNES-SFHVURJKSA-N	0	3	330.472	3.269	20	30		EGEDHN
C[C@H](CNC(=O)N(C)[C@@H](C)c1cccc(C#N)c1)N1CCC[C@@H](C)C1	ZINC000425450309	457560205	/nfs/dbraw/zinc/56/02/05/457560205.db2.gz	XZLOQUAVSZAKGC-ZACQAIPSSA-N	0	3	342.487	3.381	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCc1ccc(Br)cc1[N+](=O)[O-]	ZINC000425493859	457575749	/nfs/dbraw/zinc/57/57/49/457575749.db2.gz	PMZNICLAZOXGIQ-OCCSQVGLSA-N	0	3	341.205	3.181	20	30		EGEDHN
COCC(C)(C)N1CCN(Cc2ccccc2C(C)(C)C#N)CC1	ZINC000425504418	457579833	/nfs/dbraw/zinc/57/98/33/457579833.db2.gz	LMCYLXRDDGQFER-UHFFFAOYSA-N	0	3	329.488	3.030	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)C[C@H](O)COCc1ccccc1F	ZINC000425540121	457589995	/nfs/dbraw/zinc/58/99/95/457589995.db2.gz	UVJQDZULIQMKKC-BEFAXECRSA-N	0	3	342.414	3.268	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@@H](C)N1CC[C@@H](n2ncc3ccccc32)C1	ZINC000357791505	457691503	/nfs/dbraw/zinc/69/15/03/457691503.db2.gz	AGNUWBZGMGHENI-SJLPKXTDSA-N	0	3	340.471	3.096	20	30		EGEDHN
CC(C#N)C(=O)NCc1cn(Cc2ccccc2)nc1-c1ccccc1	ZINC000357834780	457705072	/nfs/dbraw/zinc/70/50/72/457705072.db2.gz	SDICCPLTVSMLAI-INIZCTEOSA-N	0	3	344.418	3.374	20	30		EGEDHN
C[C@H](O)[C@@H]1C[C@H](C)CCN1CC#Cc1ccc(OC(F)(F)F)cc1	ZINC000443346025	457753104	/nfs/dbraw/zinc/75/31/04/457753104.db2.gz	LYKYXVSNXBHLBW-KEYYUXOJSA-N	0	3	341.373	3.418	20	30		EGEDHN
C[C@H](CN1CCC[C@H](C)C1)NC(=O)Nc1ccc(C#N)cc1Cl	ZINC000426134025	457777154	/nfs/dbraw/zinc/77/71/54/457777154.db2.gz	QDQNMYDIJFDQHH-QWHCGFSZSA-N	0	3	334.851	3.454	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NC[C@H]1CCN(c2ccccc2)C1	ZINC000433231841	457785628	/nfs/dbraw/zinc/78/56/28/457785628.db2.gz	YUNPNQLEYAUJKR-WOJBJXKFSA-N	0	3	347.462	3.402	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCCOc1ccc(F)c(F)c1	ZINC000433342599	457815444	/nfs/dbraw/zinc/81/54/44/457815444.db2.gz	LRQYZFPYDCKIBL-OAHLLOKOSA-N	0	3	344.361	3.232	20	30		EGEDHN
Cc1nc(C)c(CCNC(=O)C(C#N)CCc2ccccc2)s1	ZINC000433356892	457820225	/nfs/dbraw/zinc/82/02/25/457820225.db2.gz	TXIBBKBFZFLNPH-MRXNPFEDSA-N	0	3	327.453	3.191	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CCC(C(F)F)CC1	ZINC000361689103	457821929	/nfs/dbraw/zinc/82/19/29/457821929.db2.gz	GFSKRLBNJKEZIH-MRXNPFEDSA-N	0	3	325.399	3.132	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N[C@@H](CCCO)c1ccccc1	ZINC000433370119	457822853	/nfs/dbraw/zinc/82/28/53/457822853.db2.gz	CQNQSTZVMSJOIW-PMACEKPBSA-N	0	3	336.435	3.389	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCC1(CCO)CCCCC1	ZINC000433379172	457825078	/nfs/dbraw/zinc/82/50/78/457825078.db2.gz	XQUZFWGAHZUWJM-SFHVURJKSA-N	0	3	328.456	3.208	20	30		EGEDHN
Cc1cc(CNCc2ccccc2CN2CCCC2=O)ccc1C#N	ZINC000443960568	457829994	/nfs/dbraw/zinc/82/99/94/457829994.db2.gz	OJGCGZJPXUOAML-UHFFFAOYSA-N	0	3	333.435	3.279	20	30		EGEDHN
C=CC[C@@H](C(=O)NCC1(SC)CCN(C)CC1)c1ccccc1	ZINC000358170276	457831816	/nfs/dbraw/zinc/83/18/16/457831816.db2.gz	QPWGYTVIHMMYQK-QGZVFWFLSA-N	0	3	332.513	3.290	20	30		EGEDHN
FC(F)(F)Oc1ccc(C#CCN2CC[C@H]([C@@H]3CCOC3)C2)cc1	ZINC000361750584	457832526	/nfs/dbraw/zinc/83/25/26/457832526.db2.gz	IYCOLNZQPRAREL-JKSUJKDBSA-N	0	3	339.357	3.295	20	30		EGEDHN
FC(F)(F)Oc1ccc(C#CCN2CC[C@@H]([C@@H]3CCOC3)C2)cc1	ZINC000361750583	457833296	/nfs/dbraw/zinc/83/32/96/457833296.db2.gz	IYCOLNZQPRAREL-HZPDHXFCSA-N	0	3	339.357	3.295	20	30		EGEDHN
CNS(=O)(=O)c1ccc([C@@H](C)NCCC2(C#N)CCCCC2)cc1	ZINC000411455958	457893848	/nfs/dbraw/zinc/89/38/48/457893848.db2.gz	MAMWVZDIAOSHQQ-OAHLLOKOSA-N	0	3	349.500	3.109	20	30		EGEDHN
C=CC[C@H]1N(Cc2cnc(-c3cnn(C)c3)nc2)CCCC1(C)C	ZINC000366862406	457904054	/nfs/dbraw/zinc/90/40/54/457904054.db2.gz	HQGKWUWVFIFYKV-QGZVFWFLSA-N	0	3	325.460	3.444	20	30		EGEDHN
N#CC1(CCCN2CC[C@H](Oc3ccc(F)cc3)C2)CCOCC1	ZINC000366906700	457909187	/nfs/dbraw/zinc/90/91/87/457909187.db2.gz	YUGHYNRDMXIXMM-SFHVURJKSA-N	0	3	332.419	3.379	20	30		EGEDHN
C[C@@H]1C[C@H](c2cccnc2)N(CCC(=O)Nc2cccc(C#N)c2)C1	ZINC000411523132	457911403	/nfs/dbraw/zinc/91/14/03/457911403.db2.gz	GPHLBTQBPNMIBI-DNVCBOLYSA-N	0	3	334.423	3.365	20	30		EGEDHN
CC(C)(C#N)CCCCN1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000444656398	457929723	/nfs/dbraw/zinc/92/97/23/457929723.db2.gz	FGHJRBBTSLHGJN-CQSZACIVSA-N	0	3	331.420	3.196	20	30		EGEDHN
C=CCN(C)CCN(CC)[C@H](C)C(=O)Nc1c(C)cc(C)cc1C	ZINC000411635741	457934744	/nfs/dbraw/zinc/93/47/44/457934744.db2.gz	CCFDWXFHFXZKLE-GOSISDBHSA-N	0	3	331.504	3.379	20	30		EGEDHN
C=CCN(C)CCN(CC)[C@@H](C)C(=O)N1CCC[C@@H]1c1cccs1	ZINC000411637591	457936794	/nfs/dbraw/zinc/93/67/94/457936794.db2.gz	FZAMLKMGFKZWSU-DLBZAZTESA-N	0	3	349.544	3.240	20	30		EGEDHN
Cc1cc(NC(=O)C2(C#N)CCCCC2)ccc1OCCN(C)C	ZINC000458194586	457964431	/nfs/dbraw/zinc/96/44/31/457964431.db2.gz	KMKCWLPHFZLWNB-UHFFFAOYSA-N	0	3	329.444	3.348	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN2CCC[C@](O)(C(F)(F)F)CC2)cc1	ZINC000368051457	458008374	/nfs/dbraw/zinc/00/83/74/458008374.db2.gz	MVFWKWHQFBUOJJ-XJKSGUPXSA-N	0	3	342.361	3.257	20	30		EGEDHN
C[C@H](N[C@@H]1C[C@H](OC(C)(C)C)C1(C)C)C(=O)NC1(C#N)CCCCC1	ZINC000412066954	458076229	/nfs/dbraw/zinc/07/62/29/458076229.db2.gz	GRJCARPOLXMMEY-XHSDSOJGSA-N	0	3	349.519	3.289	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)NCC(C)(C)CC#N	ZINC000458520931	458079706	/nfs/dbraw/zinc/07/97/06/458079706.db2.gz	WYEXZYADAZVMER-FUHWJXTLSA-N	0	3	342.487	3.136	20	30		EGEDHN
CN(Cc1ccccc1C(C)(C)C#N)C(C)(C)CN1CCOCC1	ZINC000412098577	458091548	/nfs/dbraw/zinc/09/15/48/458091548.db2.gz	YAQKQQPMXFJULM-UHFFFAOYSA-N	0	3	329.488	3.030	20	30		EGEDHN
Cn1cc([C@@H](NCCCC2(C#N)CCOCC2)c2ccccc2)cn1	ZINC000369177549	458113527	/nfs/dbraw/zinc/11/35/27/458113527.db2.gz	GPXSRKYIUWOHRC-IBGZPJMESA-N	0	3	338.455	3.200	20	30		EGEDHN
C=CCSc1ccccc1C(=O)N1C[C@@H](SC)[C@@H](N(C)C)C1	ZINC000362402511	458155583	/nfs/dbraw/zinc/15/55/83/458155583.db2.gz	MPKZWWAWUYSUSM-GOEBONIOSA-N	0	3	336.526	3.082	20	30		EGEDHN
CN(C)CCN(Cc1ccsc1)C(=O)NCC(C)(C)CCC#N	ZINC000458768135	458164808	/nfs/dbraw/zinc/16/48/08/458164808.db2.gz	OFVARQBAHIUOLS-UHFFFAOYSA-N	0	3	336.505	3.151	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1CN[C@H](C(=O)N1CCCCC1)c1ccccc1	ZINC000435674734	458182080	/nfs/dbraw/zinc/18/20/80/458182080.db2.gz	RRUNQDBPWJUOGH-UFYCRDLUSA-N	0	3	342.483	3.311	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@@H]1CNCc1ccc(OC)c(OC)c1Cl	ZINC000435733163	458193204	/nfs/dbraw/zinc/19/32/04/458193204.db2.gz	BAARDIJFNNKJTQ-CZUORRHYSA-N	0	3	325.836	3.428	20	30		EGEDHN
CC(C#N)C(=O)N1CCC[C@@H]1c1ccc(Br)c(F)c1	ZINC000435971461	458231358	/nfs/dbraw/zinc/23/13/58/458231358.db2.gz	YPYIRQNGUBFZLI-TVQRCGJNSA-N	0	3	325.181	3.411	20	30		EGEDHN
CC(C#N)C(=O)N1CCC[C@H]1c1ccc(Br)c(F)c1	ZINC000435971462	458231677	/nfs/dbraw/zinc/23/16/77/458231677.db2.gz	YPYIRQNGUBFZLI-ZANVPECISA-N	0	3	325.181	3.411	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H]1CCN(C(=O)c2ccc(CC#N)cc2)C1	ZINC000372275987	458259580	/nfs/dbraw/zinc/25/95/80/458259580.db2.gz	VVYCXDYJRHVWQF-HXUWFJFHSA-N	0	3	333.435	3.099	20	30		EGEDHN
Cc1ccccc1CN1CCCN(C(=O)c2ccc(CC#N)cc2)CC1	ZINC000372291347	458266203	/nfs/dbraw/zinc/26/62/03/458266203.db2.gz	JKMVMLLELGGFIT-UHFFFAOYSA-N	0	3	347.462	3.409	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1CNc1ccnc2cc(OC)c(OC)cc21	ZINC000413261727	458296537	/nfs/dbraw/zinc/29/65/37/458296537.db2.gz	FDZOLUWTFIPANZ-YJYMSZOUSA-N	0	3	328.412	3.067	20	30		EGEDHN
Cc1ccc([C@H]2CCC[C@@H]2N(C)CC(=O)NC2(C#N)CCC2)cc1	ZINC000372613595	458308431	/nfs/dbraw/zinc/30/84/31/458308431.db2.gz	ZQXKZDOOBWBMAD-MSOLQXFVSA-N	0	3	325.456	3.125	20	30		EGEDHN
N#Cc1ccccc1N1CCCN(CCOCC2CCCC2)CC1	ZINC000459302688	458321318	/nfs/dbraw/zinc/32/13/18/458321318.db2.gz	NNAMLRADRLCYFL-UHFFFAOYSA-N	0	3	327.472	3.277	20	30		EGEDHN
N#Cc1csc(CN[C@H](c2ccccc2)C2(CO)CCOCC2)c1	ZINC000414543440	458322998	/nfs/dbraw/zinc/32/29/98/458322998.db2.gz	TXYKYGDDTCKZSR-GOSISDBHSA-N	0	3	342.464	3.240	20	30		EGEDHN
C=CCOc1ccc(CNC[C@H](CO)c2ccc(F)cc2)cc1OC	ZINC000414555784	458324243	/nfs/dbraw/zinc/32/42/43/458324243.db2.gz	MNHMWJHJZQLRAJ-QGZVFWFLSA-N	0	3	345.414	3.265	20	30		EGEDHN
C=CCc1cc(CNC[C@@H]2NCCc3ccccc32)cc(OC)c1O	ZINC000414954010	458326542	/nfs/dbraw/zinc/32/65/42/458326542.db2.gz	KNRDYEJUPZIOFD-IBGZPJMESA-N	0	3	338.451	3.106	20	30		EGEDHN
C[C@H](C#N)CSc1ccccc1NC(=O)N1C[C@H](C)NC[C@H]1C	ZINC000415152859	458328040	/nfs/dbraw/zinc/32/80/40/458328040.db2.gz	CGRZJNCCSOXZKK-HZSPNIEDSA-N	0	3	332.473	3.152	20	30		EGEDHN
C[C@H](CC#N)Sc1ccccc1NC(=O)N1C[C@@H](C)NC[C@H]1C	ZINC000415161577	458329644	/nfs/dbraw/zinc/32/96/44/458329644.db2.gz	MSFXGFYIQAHQJW-MGPQQGTHSA-N	0	3	332.473	3.295	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Nc1ccc(OC)c(N)c1)C(C)C	ZINC000415819338	458334388	/nfs/dbraw/zinc/33/43/88/458334388.db2.gz	ZAKWLZXUHDXBBG-QGZVFWFLSA-N	0	3	346.475	3.098	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN(C)[C@H]2CC[C@@H](C)C2)cc1	ZINC000429584971	458349699	/nfs/dbraw/zinc/34/96/99/458349699.db2.gz	PEADYEBDJQEECM-AEFFLSMTSA-N	0	3	343.471	3.452	20	30		EGEDHN
C=CCN(C)CCN(CC)[C@H](C)C(=O)Nc1nc2ccccc2s1	ZINC000429716371	458362128	/nfs/dbraw/zinc/36/21/28/458362128.db2.gz	ACLHPOPOVJXQJX-CQSZACIVSA-N	0	3	346.500	3.063	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)=C([O-])c1cccc(C[NH+](C)C)c1	ZINC000436699030	458362288	/nfs/dbraw/zinc/36/22/88/458362288.db2.gz	SEVPGWVEMRYQCV-MRXNPFEDSA-N	0	3	332.407	3.125	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@@H](CC(F)(F)F)C2)CC1	ZINC000420912670	458404118	/nfs/dbraw/zinc/40/41/18/458404118.db2.gz	IQRWWCBKWXEYCO-ZDUSSCGKSA-N	0	3	333.398	3.011	20	30		EGEDHN
C[C@@H]1C[C@H](N2CCN([C@@H](C#N)c3cccc(Cl)c3)CC2)CCO1	ZINC000420969273	458406510	/nfs/dbraw/zinc/40/65/10/458406510.db2.gz	XXJCFLBVDSSVHU-OLMNPRSZSA-N	0	3	333.863	3.090	20	30		EGEDHN
C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)NCc1ccc(C#N)s1	ZINC000421353236	458412123	/nfs/dbraw/zinc/41/21/23/458412123.db2.gz	SGWIAOSAQQCHCS-LLVKDONJSA-N	0	3	344.396	3.035	20	30		EGEDHN
COc1ccc(CN[C@@H]2CCO[C@H]2C2CC2)cc1OCCCC#N	ZINC000373179389	458420374	/nfs/dbraw/zinc/42/03/74/458420374.db2.gz	ZCQNULAVSXRNIB-APWZRJJASA-N	0	3	330.428	3.035	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCc1ccc(-n2ccc(C(F)(F)F)n2)cc1	ZINC000449516382	458425942	/nfs/dbraw/zinc/42/59/42/458425942.db2.gz	AIOGVIBCKPBXJN-CABCVRRESA-N	0	3	337.345	3.324	20	30		EGEDHN
C=CCC[C@H](CO)NCc1ccc(-c2ccccc2C(=O)OC)o1	ZINC000449701935	458429524	/nfs/dbraw/zinc/42/95/24/458429524.db2.gz	XWQQZAAMUMQWNW-CQSZACIVSA-N	0	3	329.396	3.150	20	30		EGEDHN
C=C(CC)CNCc1ccc(OCCN2CCOCC2)c(Cl)c1	ZINC000449730019	458430198	/nfs/dbraw/zinc/43/01/98/458430198.db2.gz	CHUZCHSHLHEVIV-UHFFFAOYSA-N	0	3	338.879	3.107	20	30		EGEDHN
COC[C@@H]1CCCCN1Cc1ccc(OC)c(OCCCC#N)c1	ZINC000449761043	458431472	/nfs/dbraw/zinc/43/14/72/458431472.db2.gz	UEWKHFWLRACGOU-KRWDZBQOSA-N	0	3	332.444	3.379	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000450155270	458440647	/nfs/dbraw/zinc/44/06/47/458440647.db2.gz	CNUMSIYSOOMBHA-MOPGFXCFSA-N	0	3	344.455	3.081	20	30		EGEDHN
C[C@H]1[C@H](NC(=O)NCC(C)(C)CCC#N)CCN1Cc1ccccc1	ZINC000377040336	458447887	/nfs/dbraw/zinc/44/78/87/458447887.db2.gz	BUZFLQKXKHESDV-FUHWJXTLSA-N	0	3	342.487	3.279	20	30		EGEDHN
N#Cc1cc(NC2CCN([C@H]3CCOC3)CC2)ccc1C(F)(F)F	ZINC000373325302	458461473	/nfs/dbraw/zinc/46/14/73/458461473.db2.gz	OWLIYSQUYYSGPZ-HNNXBMFYSA-N	0	3	339.361	3.242	20	30		EGEDHN
C=C(C)CN(CCN(C)Cc1ccccc1)Cc1ccc(CO)o1	ZINC000450982250	458462234	/nfs/dbraw/zinc/46/22/34/458462234.db2.gz	KLRNNBGLNJNQHQ-UHFFFAOYSA-N	0	3	328.456	3.282	20	30		EGEDHN
C[C@@H]1CN(Cc2cc(C#N)ccc2Br)CCN(C2CC2)C1	ZINC000451094678	458465438	/nfs/dbraw/zinc/46/54/38/458465438.db2.gz	QGJBORNBSVABJN-CYBMUJFWSA-N	0	3	348.288	3.237	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN[C@@H]1CCc2c1cccc2O	ZINC000451177808	458469409	/nfs/dbraw/zinc/46/94/09/458469409.db2.gz	XMPXRIKAFXSDNH-QFBILLFUSA-N	0	3	339.435	3.138	20	30		EGEDHN
COc1ccc(CN[C@@H]2C[C@@H](OC)C23CCC3)cc1OCCCC#N	ZINC000459799207	458482220	/nfs/dbraw/zinc/48/22/20/458482220.db2.gz	YOXXJVKEFUDIBC-RTBURBONSA-N	0	3	344.455	3.425	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1N[C@H]1CCN(c2ccc(Cl)cc2Cl)C1=O	ZINC000451606139	458483153	/nfs/dbraw/zinc/48/31/53/458483153.db2.gz	HBZDMQKFYSPJBJ-IPYPFGDCSA-N	0	3	341.238	3.032	20	30		EGEDHN
C[C@@](CO)(NCCCSCC#N)c1cc(Cl)cc(Cl)c1	ZINC000451912065	458490423	/nfs/dbraw/zinc/49/04/23/458490423.db2.gz	ONYPPNQLKGEVNX-AWEZNQCLSA-N	0	3	333.284	3.437	20	30		EGEDHN
CC(C)(CN1CCCC1)NCc1cc(C#N)ccc1Br	ZINC000452095501	458493718	/nfs/dbraw/zinc/49/37/18/458493718.db2.gz	LETGCLHDYTVEDS-UHFFFAOYSA-N	0	3	336.277	3.285	20	30		EGEDHN
CC(C)(C#N)CCCCN(CCN1CCOCC1)Cc1ccco1	ZINC000452049069	458494389	/nfs/dbraw/zinc/49/43/89/458494389.db2.gz	NZAOMYNKSLZKFL-UHFFFAOYSA-N	0	3	333.476	3.134	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)[C@@]2(C#N)C[C@H]2C)N(CC)CC)cc1	ZINC000452134066	458495099	/nfs/dbraw/zinc/49/50/99/458495099.db2.gz	SLJUFDNKCBGRDK-MOXGXCLJSA-N	0	3	327.472	3.298	20	30		EGEDHN
CCOC(=O)[C@@H](C)[C@@H](C)NCC#Cc1ccc(C(F)(F)F)cc1	ZINC000460352127	458512393	/nfs/dbraw/zinc/51/23/93/458512393.db2.gz	VPGIKJZZAINUBC-QWHCGFSZSA-N	0	3	327.346	3.234	20	30		EGEDHN
C=C(C)Cn1c(N2CCN([C@@H]3C[C@@H]3C)C[C@H](C)C2)nnc1C(C)(C)C	ZINC000453457855	458531951	/nfs/dbraw/zinc/53/19/51/458531951.db2.gz	YEOJHENYYRBMPF-YESZJQIVSA-N	0	3	345.535	3.318	20	30		EGEDHN
C=C(C)Cn1c(N2CCN([C@@H]3C[C@@H]3C)C[C@@H](C)C2)nnc1C(C)(C)C	ZINC000453457854	458532090	/nfs/dbraw/zinc/53/20/90/458532090.db2.gz	YEOJHENYYRBMPF-IXDOHACOSA-N	0	3	345.535	3.318	20	30		EGEDHN
CC[C@@H](Cc1ccccc1)N(CC)CC(=O)N(CC)C[C@H](C)C#N	ZINC000468917026	458543390	/nfs/dbraw/zinc/54/33/90/458543390.db2.gz	JFCRRPSBHXFGIS-MJGOQNOKSA-N	0	3	329.488	3.338	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cc(C(C)(C)C)on1)C(C)C	ZINC000460986770	458543728	/nfs/dbraw/zinc/54/37/28/458543728.db2.gz	HXBIJUFWDMUHTF-MRXNPFEDSA-N	0	3	333.476	3.401	20	30		EGEDHN
Cc1ccc(-c2nc(NC(=O)[C@H](N)CCCC#N)sc2C)s1	ZINC000424111379	458560737	/nfs/dbraw/zinc/56/07/37/458560737.db2.gz	GIAKYGYBHQHFSO-LLVKDONJSA-N	0	3	334.470	3.448	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCC[C@H]2CCc3ccccc32)CC1	ZINC000454464973	458563679	/nfs/dbraw/zinc/56/36/79/458563679.db2.gz	OHKRBCUIYFOOMO-GOSISDBHSA-N	0	3	341.499	3.446	20	30		EGEDHN
Cc1ccc(CNC(=O)[C@H](N)CCCC#N)c(O[C@H](C)CC(C)C)c1	ZINC000424124213	458564181	/nfs/dbraw/zinc/56/41/81/458564181.db2.gz	LRAQBSXLKJSJGF-SJLPKXTDSA-N	0	3	345.487	3.446	20	30		EGEDHN
CN(C)CCN(Cc1cccs1)C(=O)Nc1cccc(CC#N)c1	ZINC000455909340	458620585	/nfs/dbraw/zinc/62/05/85/458620585.db2.gz	BBYJKYFXBJBRLL-UHFFFAOYSA-N	0	3	342.468	3.410	20	30		EGEDHN
COc1ncc(CNC(=O)C(C#N)CCc2ccccc2)cc1Cl	ZINC000456098221	458631299	/nfs/dbraw/zinc/63/12/99/458631299.db2.gz	NQHQLLNFVZLCAT-OAHLLOKOSA-N	0	3	343.814	3.132	20	30		EGEDHN
C[C@H](C#N)CSc1ccccc1NC(=O)CN[C@@]1(C)CCO[C@H]1C	ZINC000494246501	458647463	/nfs/dbraw/zinc/64/74/63/458647463.db2.gz	BLYVUOVYWYNRBQ-GLJUWKHASA-N	0	3	347.484	3.034	20	30		EGEDHN
C=CCN1CCC(Nc2c(C#N)cnc3c(F)c(F)c(F)cc32)CC1	ZINC000439160840	458663667	/nfs/dbraw/zinc/66/36/67/458663667.db2.gz	VVURANQFIQRDGU-UHFFFAOYSA-N	0	3	346.356	3.008	20	30		EGEDHN
CC1(C)[C@@H](O)C[C@@H]1NCc1cccc(OCc2ccccc2C#N)c1	ZINC000494429282	458675130	/nfs/dbraw/zinc/67/51/30/458675130.db2.gz	WSKYDZDNULOXAP-PMACEKPBSA-N	0	3	336.435	3.386	20	30		EGEDHN
C[C@H]1C[C@H](CNC(=O)OC(C)(C)C)CN1Cc1cc(C#N)cs1	ZINC000494470099	458683659	/nfs/dbraw/zinc/68/36/59/458683659.db2.gz	MNWHMOQXVSVMOJ-GXTWGEPZSA-N	0	3	335.473	3.355	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NC2CCc3ccccc3CC2)cc1	ZINC000456462298	458686290	/nfs/dbraw/zinc/68/62/90/458686290.db2.gz	RHQDOIHINVAEDT-FQEVSTJZSA-N	0	3	343.430	3.304	20	30		EGEDHN
Cc1cc(C)cc(CN[C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)c1	ZINC000503928334	458730974	/nfs/dbraw/zinc/73/09/74/458730974.db2.gz	NWBCCKJYYLQFBY-HXUWFJFHSA-N	0	3	333.435	3.460	20	30		EGEDHN
C=CCNC(=O)CNC1(c2ccc(C(F)(F)F)cc2)CCCC1	ZINC000505478467	458743785	/nfs/dbraw/zinc/74/37/85/458743785.db2.gz	DLVDMCUGORKLBC-UHFFFAOYSA-N	0	3	326.362	3.367	20	30		EGEDHN
Cc1ccccc1[C@@H]1C[C@H](C)N([C@H](C)C(=O)NC2(C#N)CCC2)C1	ZINC000530334475	458749497	/nfs/dbraw/zinc/74/94/97/458749497.db2.gz	CLBPGLNOXXNPNL-GVDBMIGSSA-N	0	3	325.456	3.124	20	30		EGEDHN
Cc1cc([C@H](N[C@H](C)C(=O)NC2(C#N)CCC2)C2CC2)ccc1F	ZINC000530337016	458750561	/nfs/dbraw/zinc/75/05/61/458750561.db2.gz	ZYJJSCRWZVFAPC-CXAGYDPISA-N	0	3	329.419	3.126	20	30		EGEDHN
Cc1cccc2c1CC[C@@H]2NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000547768163	458788795	/nfs/dbraw/zinc/78/87/95/458788795.db2.gz	REGQKPFNJFSFET-PXNSSMCTSA-N	0	3	329.403	3.353	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN(C)CCN(C)C(=O)OC(C)(C)C)cc1	ZINC000495188885	458808013	/nfs/dbraw/zinc/80/80/13/458808013.db2.gz	KHPXKXXTJFDIRG-OAHLLOKOSA-N	0	3	347.459	3.276	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCc1ccc(OCCN2CCCC2)cc1	ZINC000473542193	458834415	/nfs/dbraw/zinc/83/44/15/458834415.db2.gz	AMISKBVQKLTOLX-HXUWFJFHSA-N	0	3	330.472	3.380	20	30		EGEDHN
Cc1cc(C)cc([C@@H](C)NC[C@@H](O)COc2ccc(CC#N)cc2)c1	ZINC000553300622	458894538	/nfs/dbraw/zinc/89/45/38/458894538.db2.gz	UQIKVNOVLFIDBO-YLJYHZDGSA-N	0	3	338.451	3.460	20	30		EGEDHN
C=CC[C@@H](CC)NC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1	ZINC000466378760	458896592	/nfs/dbraw/zinc/89/65/92/458896592.db2.gz	RQKCUWWDEDWJDN-OAHLLOKOSA-N	0	3	339.430	3.393	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CCC[C@@H]1c1ccccn1	ZINC000531440553	458918873	/nfs/dbraw/zinc/91/88/73/458918873.db2.gz	NBKYRVKDOTVUNN-AZUAARDMSA-N	0	3	338.451	3.387	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)OC(C)(C)C)NCc1ccc(C#N)cc1F	ZINC000495691157	458922058	/nfs/dbraw/zinc/92/20/58/458922058.db2.gz	PZWNPINXLUGLJC-OLZOCXBDSA-N	0	3	335.423	3.479	20	30		EGEDHN
COc1ccc([C@@H](CNc2ccnc(C#N)c2)N2CCCCC2)cc1	ZINC000577010659	458964109	/nfs/dbraw/zinc/96/41/09/458964109.db2.gz	NMZSKFGUYPQJPP-HXUWFJFHSA-N	0	3	336.439	3.023	20	30		EGEDHN
C[C@@H]1C[C@@H](Nc2c(C#N)cnc3c(F)cc(F)cc32)CN1C1CC1	ZINC000566770346	458996682	/nfs/dbraw/zinc/99/66/82/458996682.db2.gz	RWBITBBDVSQQQZ-ZWNOBZJWSA-N	0	3	328.366	3.422	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N[C@]1(C)CCN(Cc2ccccc2)C1)OCC	ZINC000519757549	458999436	/nfs/dbraw/zinc/99/94/36/458999436.db2.gz	IMCBKOKNWDLWBY-AZUAARDMSA-N	0	3	330.472	3.139	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN[C@H]1CCCc2occc21	ZINC000566792299	459001294	/nfs/dbraw/zinc/00/12/94/459001294.db2.gz	QAWBSSLQXGXTNF-WMZOPIPTSA-N	0	3	327.424	3.415	20	30		EGEDHN
CC(C)CN(CC(=O)NCc1cccc(C#N)c1)Cc1ccccc1	ZINC000520171933	459036073	/nfs/dbraw/zinc/03/60/73/459036073.db2.gz	MFHHLEMDXGKQAR-UHFFFAOYSA-N	0	3	335.451	3.333	20	30		EGEDHN
CN1CCC2(CCCN2C(=O)Nc2ccc(CC#N)cc2Cl)CC1	ZINC000567079073	459044887	/nfs/dbraw/zinc/04/48/87/459044887.db2.gz	DNYULLGSQMKYRN-UHFFFAOYSA-N	0	3	346.862	3.498	20	30		EGEDHN
COc1cc(CN(CCO)[C@@H]2CCCc3ccccc32)ccc1C#N	ZINC000442884267	459053640	/nfs/dbraw/zinc/05/36/40/459053640.db2.gz	XMYCAOMGARUETP-HXUWFJFHSA-N	0	3	336.435	3.439	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)C[C@H]1CN(c2ccccc2)CCO1	ZINC000577765647	459091295	/nfs/dbraw/zinc/09/12/95/459091295.db2.gz	HSRXPTSQSPIHQX-UTKZUKDTSA-N	0	3	335.451	3.456	20	30		EGEDHN
N#Cc1cc(Br)cnc1N[C@H]1CCCN2CCCC[C@@H]12	ZINC000594601866	459106502	/nfs/dbraw/zinc/10/65/02/459106502.db2.gz	PFHICTBWPRPUPE-KBPBESRZSA-N	0	3	335.249	3.145	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC1CCN(C[C@@H]2CCCO2)CC1	ZINC000594605211	459107454	/nfs/dbraw/zinc/10/74/54/459107454.db2.gz	HRBSCIAQCXCZAQ-KRWDZBQOSA-N	0	3	329.444	3.012	20	30		EGEDHN
COc1ccc(N2C[C@@H](N[C@H](C)c3cccc(C#N)c3)CC2=O)cc1	ZINC000594723192	459139562	/nfs/dbraw/zinc/13/95/62/459139562.db2.gz	YSQAJPPXVCRWGH-PBHICJAKSA-N	0	3	335.407	3.023	20	30		EGEDHN
C[C@H](OC[C@@H](O)CNCc1cccc(C#N)c1)c1ccc(Cl)cc1	ZINC000567678506	459144141	/nfs/dbraw/zinc/14/41/41/459144141.db2.gz	UXGXCBUSKHBKOH-LIRRHRJNSA-N	0	3	344.842	3.440	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCCOc2ccc(C)cc2C)CC1	ZINC000521584064	459163658	/nfs/dbraw/zinc/16/36/58/459163658.db2.gz	FZDLJCXIIBCTLV-UHFFFAOYSA-N	0	3	345.487	3.022	20	30		EGEDHN
C=CCCSCCN[C@H](C)c1cccc(NS(C)(=O)=O)c1	ZINC000595061040	459232375	/nfs/dbraw/zinc/23/23/75/459232375.db2.gz	XIQOYVSYCAPFRY-CYBMUJFWSA-N	0	3	328.503	3.018	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1N[C@@H](C)C(=O)N[C@H](C)c1cccc2ccccc21	ZINC000579917353	459253490	/nfs/dbraw/zinc/25/34/90/459253490.db2.gz	UEFXVUOTUFEETR-ITKAJJHTSA-N	0	3	338.451	3.339	20	30		EGEDHN
C[C@@H]1C[C@@H](NC2CCN(Cc3ccc(C#N)cc3)CC2)c2nccn21	ZINC000568355102	459272985	/nfs/dbraw/zinc/27/29/85/459272985.db2.gz	ORWWRXSSCJRHEQ-DNVCBOLYSA-N	0	3	335.455	3.015	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cccc3c(OC)ccnc23)CC1	ZINC000534318790	459312174	/nfs/dbraw/zinc/31/21/74/459312174.db2.gz	RZUBZVNKQHXWGA-UHFFFAOYSA-N	0	3	340.427	3.015	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1nc(-c2c(F)cccc2F)cs1	ZINC000568745535	459338574	/nfs/dbraw/zinc/33/85/74/459338574.db2.gz	ZURVEOQPWYXUSO-NSHDSACASA-N	0	3	336.367	3.048	20	30		EGEDHN
CC(C)(C)OC(=O)CC1(NCc2ccc(F)c(C#N)c2)CCOCC1	ZINC000595541226	459339446	/nfs/dbraw/zinc/33/94/46/459339446.db2.gz	UMZFOIGKXWVYFU-UHFFFAOYSA-N	0	3	348.418	3.068	20	30		EGEDHN
CC(C)(C)OC(=O)CC1(NCc2ccc(C#N)cc2F)CCOCC1	ZINC000595546579	459342440	/nfs/dbraw/zinc/34/24/40/459342440.db2.gz	KZNFZDCUMBCKNS-UHFFFAOYSA-N	0	3	348.418	3.068	20	30		EGEDHN
COC1(CN2CCN([C@H](C#N)c3ccccc3)CC2)CCCCC1	ZINC000483175487	459348014	/nfs/dbraw/zinc/34/80/14/459348014.db2.gz	UIVZXXZFEXNEGX-LJQANCHMSA-N	0	3	327.472	3.218	20	30		EGEDHN
Cc1cc(C(C)(C)C)ccc1OC[C@H](O)CNCC1(CC#N)CC1	ZINC000568859798	459356955	/nfs/dbraw/zinc/35/69/55/459356955.db2.gz	WJUJUIWQEOXLGK-QGZVFWFLSA-N	0	3	330.472	3.316	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN[C@@H]2CCSc3ccccc32)cc1	ZINC000568971722	459374530	/nfs/dbraw/zinc/37/45/30/459374530.db2.gz	IUABNRKJYGLVFN-CRAIPNDOSA-N	0	3	340.448	3.125	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCCC[C@H]1[C@H]1CCCC1=Nn1cnnc1	ZINC000496985180	459395602	/nfs/dbraw/zinc/39/56/02/459395602.db2.gz	LCANVMBOCBWNJP-ZFWWWQNUSA-N	0	3	333.436	3.072	20	30		EGEDHN
C=CCN(CCCn1c(=O)[nH]c2ccccc21)CCc1ccco1	ZINC000540915020	459403063	/nfs/dbraw/zinc/40/30/63/459403063.db2.gz	NMBILUGCRHPMQQ-UHFFFAOYSA-N	0	3	325.412	3.456	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cnc(C2CC2)s1)C(C)C	ZINC000591643502	459418368	/nfs/dbraw/zinc/41/83/68/459418368.db2.gz	UWXQOPZRKIOBJR-OAHLLOKOSA-N	0	3	333.501	3.449	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](O)CO[C@H]2CCCc3ccccc32)cc1	ZINC000591725160	459425424	/nfs/dbraw/zinc/42/54/24/459425424.db2.gz	DTFQVZXMINMMCF-FPOVZHCZSA-N	0	3	336.435	3.103	20	30		EGEDHN
N#Cc1cnn2c1NC[C@@H](CN[C@H](CC(F)(F)F)c1ccccc1)C2	ZINC000561220751	459432128	/nfs/dbraw/zinc/43/21/28/459432128.db2.gz	BKYVIUIEKMAQBD-IUODEOHRSA-N	0	3	349.360	3.080	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1N[C@H](C)C(=O)N[C@H](C)c1ccc2c(c1)CCCC2	ZINC000569436901	459450297	/nfs/dbraw/zinc/45/02/97/459450297.db2.gz	ZQJISBKGHUVMAW-IONDEXAJSA-N	0	3	342.483	3.064	20	30		EGEDHN
CC(C)[C@H]1N(C(=O)C(C#N)CCc2ccccc2)CC12CCOCC2	ZINC000569555108	459470978	/nfs/dbraw/zinc/47/09/78/459470978.db2.gz	YHGLEWDQQKJVRL-RBUKOAKNSA-N	0	3	340.467	3.423	20	30		EGEDHN
C=CCn1c(-c2sccc2C)nnc1N1C[C@@H](C)N(CC)C[C@@H]1C	ZINC000583052541	459472986	/nfs/dbraw/zinc/47/29/86/459472986.db2.gz	DNUKNDBGFMJRJN-CABCVRRESA-N	0	3	345.516	3.420	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1ccc(OC(F)(F)F)cc1Cl	ZINC000595991005	459492727	/nfs/dbraw/zinc/49/27/27/459492727.db2.gz	FPWSYAJRVUTKNO-JTQLQIEISA-N	0	3	335.713	3.198	20	30		EGEDHN
CN1CC[C@H](NC(=O)N2CCC(CCC#N)CC2)[C@@H]1c1ccccc1	ZINC000591959958	459498120	/nfs/dbraw/zinc/49/81/20/459498120.db2.gz	KYNLPFSCLLYJCU-OALUTQOASA-N	0	3	340.471	3.157	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N(C)Cc1occc1C)C(C)C	ZINC000487855403	459534492	/nfs/dbraw/zinc/53/44/92/459534492.db2.gz	UZBMYRJSDOHFMI-KRWDZBQOSA-N	0	3	333.476	3.428	20	30		EGEDHN
N#Cc1ccc2c(c1)CCCC[C@H]2NCCC(=O)Nc1ccccn1	ZINC000562315681	459536531	/nfs/dbraw/zinc/53/65/31/459536531.db2.gz	HWHNRBUVMAUVNA-GOSISDBHSA-N	0	3	334.423	3.339	20	30		EGEDHN
COCCN(CC(=O)N(CCC#N)c1ccccc1)[C@@H]1CCC[C@H]1C	ZINC000487962084	459537095	/nfs/dbraw/zinc/53/70/95/459537095.db2.gz	OJYYKFMBHVQHSM-IEBWSBKVSA-N	0	3	343.471	3.070	20	30		EGEDHN
Cc1cc(CN[C@@H](CN2CCOCC2)c2ccccc2)ccc1C#N	ZINC000488098776	459537739	/nfs/dbraw/zinc/53/77/39/459537739.db2.gz	JNHGKOOJHVSJQF-NRFANRHFSA-N	0	3	335.451	3.030	20	30		EGEDHN
C[C@@H](c1ccc(C#N)cc1)N1CC[C@H](C(=O)NCc2ccccc2)C1	ZINC000592153977	459538066	/nfs/dbraw/zinc/53/80/66/459538066.db2.gz	FJJPGBJAXGLDND-JXFKEZNVSA-N	0	3	333.435	3.258	20	30		EGEDHN
COc1ccc([C@H](CCC#N)N[C@@H]2CCN(CC(F)(F)F)C2)cc1	ZINC000569955698	459538098	/nfs/dbraw/zinc/53/80/98/459538098.db2.gz	GGBKHLAOLVTIMM-ZBFHGGJFSA-N	0	3	341.377	3.266	20	30		EGEDHN
COc1cc([C@H](C)NCc2ccc(C#N)c(C)c2)ccc1OCCO	ZINC000488115027	459539374	/nfs/dbraw/zinc/53/93/74/459539374.db2.gz	LUDWGEOMMNUPFN-HNNXBMFYSA-N	0	3	340.423	3.097	20	30		EGEDHN
COCCN(CCOc1ccc(F)cc1)Cc1ccc(CC#N)cc1	ZINC000542279958	459543807	/nfs/dbraw/zinc/54/38/07/459543807.db2.gz	GTMLETWUEFMRRX-UHFFFAOYSA-N	0	3	342.414	3.419	20	30		EGEDHN
CC(C)[C@@H]1C[C@@H](N[C@H]2CCCN(c3ccc(C#N)cc3)C2=O)CS1	ZINC000488551056	459545910	/nfs/dbraw/zinc/54/59/10/459545910.db2.gz	ZTUORGNZLPCHCN-NJAFHUGGSA-N	0	3	343.496	3.173	20	30		EGEDHN
C=C(C)CNC(=O)N1CC[C@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000488567216	459547395	/nfs/dbraw/zinc/54/73/95/459547395.db2.gz	PLOFHEDPDIZQEX-HXUWFJFHSA-N	0	3	327.472	3.260	20	30		EGEDHN
N#CCC[C@H](NC(=O)Nc1cccc2c1CCNC2)c1ccccc1	ZINC000572464857	459580092	/nfs/dbraw/zinc/58/00/92/459580092.db2.gz	IGOPFTMGKIYHLN-SFHVURJKSA-N	0	3	334.423	3.499	20	30		EGEDHN
C[C@H](NC(C)(C)CNC(=O)N1CCC[C@H](CC#N)C1)c1ccccc1	ZINC000596305417	459589496	/nfs/dbraw/zinc/58/94/96/459589496.db2.gz	UQVDRQHSCWJTOK-DLBZAZTESA-N	0	3	342.487	3.451	20	30		EGEDHN
C[C@H](NCC(=O)NC1(C#N)CCC1)C1(c2ccccc2)CCCC1	ZINC000527128322	459596236	/nfs/dbraw/zinc/59/62/36/459596236.db2.gz	VOXBOAOHIPHCHI-INIZCTEOSA-N	0	3	325.456	3.039	20	30		EGEDHN
C=CCN1CC[C@H](N[C@@H]2CCCC[C@@H]2Oc2ccccc2C)C1=O	ZINC000499647628	459644059	/nfs/dbraw/zinc/64/40/59/459644059.db2.gz	QPDWKCYCINGDHE-AOIWGVFYSA-N	0	3	328.456	3.062	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H]2C[C@H](c3ccccc3Cl)C2)CC1	ZINC000491676065	459652593	/nfs/dbraw/zinc/65/25/93/459652593.db2.gz	NOGILLSUAUKWFP-WKILWMFISA-N	0	3	330.859	3.047	20	30		EGEDHN
C#CCNC(=O)C1CCN(c2ccnc3ccc(CCC)cc32)CC1	ZINC000491702160	459656414	/nfs/dbraw/zinc/65/64/14/459656414.db2.gz	QQPXJUBGCOSGQC-UHFFFAOYSA-N	0	3	335.451	3.153	20	30		EGEDHN
CN(Cc1ccccc1)C1(CNC(=O)c2cc(C#N)cs2)CCC1	ZINC000573321104	459659249	/nfs/dbraw/zinc/65/92/49/459659249.db2.gz	NQTHUVLNFJTRJU-UHFFFAOYSA-N	0	3	339.464	3.404	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN[C@@H](C)c1cnn(C(C)C)c1	ZINC000543502920	459663859	/nfs/dbraw/zinc/66/38/59/459663859.db2.gz	APUNXGFRPKMEHS-QFBILLFUSA-N	0	3	343.471	3.283	20	30		EGEDHN
C=CCCSCCNC(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000596596980	459691322	/nfs/dbraw/zinc/69/13/22/459691322.db2.gz	HRIZZVWVXIRODI-RDJZCZTQSA-N	0	3	335.517	3.286	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CCC(CC#N)CC2)C1	ZINC000543776828	459698996	/nfs/dbraw/zinc/69/89/96/459698996.db2.gz	XEUCVNUROQCZFD-QFBILLFUSA-N	0	3	340.471	3.157	20	30		EGEDHN
Cc1ccc(C)c(OC[C@@H](O)CN2CCC(CCC#N)CC2)c1C	ZINC000563068188	459709851	/nfs/dbraw/zinc/70/98/51/459709851.db2.gz	LOUOTYMGWWZESI-IBGZPJMESA-N	0	3	330.472	3.367	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cc(C)n(C(C)(C)C)n1)C(C)C	ZINC000493095944	459733734	/nfs/dbraw/zinc/73/37/34/459733734.db2.gz	HSXVNZLYYHWKAG-SFHVURJKSA-N	0	3	346.519	3.375	20	30		EGEDHN
Cc1ncccc1CNCc1cn(CCC#N)nc1-c1ccccc1	ZINC000527792111	459737981	/nfs/dbraw/zinc/73/79/81/459737981.db2.gz	REWJCJRLVDSCEK-UHFFFAOYSA-N	0	3	331.423	3.457	20	30		EGEDHN
N#Cc1ccc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)cc1C#N	ZINC000593068520	459763263	/nfs/dbraw/zinc/76/32/63/459763263.db2.gz	PNANKQHACSJOFB-KBPBESRZSA-N	0	3	337.301	3.116	20	30		EGEDHN
N#C[C@@H]1CCC[C@H](N[C@@H]2CCN(c3ccc(Cl)cc3F)C2=O)C1	ZINC000527992671	459790381	/nfs/dbraw/zinc/79/03/81/459790381.db2.gz	ZGVIBWXMBMNCGZ-OSAQELSMSA-N	0	3	335.810	3.256	20	30		EGEDHN
N#Cc1ccc2c(c1)CCCC[C@H]2N[C@@H]1Cc2ccccc2NC1=O	ZINC000528002120	459792381	/nfs/dbraw/zinc/79/23/81/459792381.db2.gz	WJWDOTQRZOFDGJ-WOJBJXKFSA-N	0	3	331.419	3.479	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)C(=O)[C@@H]1CNCc2ccccc21	ZINC000574273800	459799431	/nfs/dbraw/zinc/79/94/31/459799431.db2.gz	SWKVOFIXCFNUNV-HXUWFJFHSA-N	0	3	336.435	3.097	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(OC(F)F)ccc2F)CC1	ZINC000528447139	459807541	/nfs/dbraw/zinc/80/75/41/459807541.db2.gz	DNMCUKHPEVIXFR-UHFFFAOYSA-N	0	3	342.361	3.197	20	30		EGEDHN
C=CCN1CCC(NC(=O)Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000528447411	459807589	/nfs/dbraw/zinc/80/75/89/459807589.db2.gz	HOEPKZPQDNFQRN-UHFFFAOYSA-N	0	3	327.255	3.303	20	30		EGEDHN
CCC(C#N)(CC)C(=O)NCc1ccc(OC2CCN(C)CC2)cc1	ZINC000529313033	459827323	/nfs/dbraw/zinc/82/73/23/459827323.db2.gz	NLTZXXLDGOZSSU-UHFFFAOYSA-N	0	3	343.471	3.106	20	30		EGEDHN
COCc1ccc(NC(=O)[C@@H]2CCCCN2C2CCCC2)cc1C#N	ZINC000529818080	459850770	/nfs/dbraw/zinc/85/07/70/459850770.db2.gz	USBVMWOOQQRAGV-IBGZPJMESA-N	0	3	341.455	3.440	20	30		EGEDHN
CN(CCN1CCCCC1)C(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000593381966	459872557	/nfs/dbraw/zinc/87/25/57/459872557.db2.gz	FLLCOLCQQQMKBG-SFHVURJKSA-N	0	3	328.460	3.159	20	30		EGEDHN
Cc1csc(NC(=O)[C@H]2CCN(Cc3ccccc3)C2)c1C#N	ZINC000602337276	459897952	/nfs/dbraw/zinc/89/79/52/459897952.db2.gz	VNTRWGOUMIMVFX-HNNXBMFYSA-N	0	3	325.437	3.389	20	30		EGEDHN
N#CCCN(C(=O)CN1CCC[C@@H]1C1CC1)c1cccc(Cl)c1	ZINC000609137216	459908969	/nfs/dbraw/zinc/90/89/69/459908969.db2.gz	UZVWEMSDEAURJB-QGZVFWFLSA-N	0	3	331.847	3.461	20	30		EGEDHN
C[C@H](CNC(=O)c1cc2ccccc2n1CC#N)N1CCC(C)CC1	ZINC000609167893	459918298	/nfs/dbraw/zinc/91/82/98/459918298.db2.gz	IMTJEGMHLBACRI-MRXNPFEDSA-N	0	3	338.455	3.015	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000598512010	459927996	/nfs/dbraw/zinc/92/79/96/459927996.db2.gz	VZKAONRASCWXGL-LEWJYISDSA-N	0	3	347.462	3.150	20	30		EGEDHN
C[C@@H]1c2ccccc2CCN1C[C@H](O)COc1ccc(CC#N)cc1	ZINC000609316938	459942759	/nfs/dbraw/zinc/94/27/59/459942759.db2.gz	DWDITGJYBHXVCZ-APWZRJJASA-N	0	3	336.435	3.112	20	30		EGEDHN
CN(CCc1ccc(Br)cc1)Cc1cccc(C#N)n1	ZINC000602457607	459946990	/nfs/dbraw/zinc/94/69/90/459946990.db2.gz	HKPQLFXTXWWYFV-UHFFFAOYSA-N	0	3	330.229	3.390	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CNC1(c2ccc(Br)cc2)CC1	ZINC000598602452	459960958	/nfs/dbraw/zinc/96/09/58/459960958.db2.gz	OHKIADCPMTXNJS-CQSZACIVSA-N	0	3	337.261	3.329	20	30		EGEDHN
C[C@@H](NC1CCN(Cc2cccc(C#N)c2)CC1)c1cc2n(n1)CCC2	ZINC000593724263	459964378	/nfs/dbraw/zinc/96/43/78/459964378.db2.gz	BTLVVSLRANZYMW-MRXNPFEDSA-N	0	3	349.482	3.016	20	30		EGEDHN
C[C@@H]1CN(C[C@H](O)CC(C)(C)C#N)[C@H](C)[C@H](C)N1Cc1ccccc1	ZINC000598622320	459967490	/nfs/dbraw/zinc/96/74/90/459967490.db2.gz	HUFDBKABOLKLKH-FTEYMNFISA-N	0	3	343.515	3.270	20	30		EGEDHN
N#Cc1cccc(CNCC2(c3ccc4c(c3)OCCO4)CCCC2)n1	ZINC000602501117	459971702	/nfs/dbraw/zinc/97/17/02/459971702.db2.gz	DNUWVTMDGBCKPP-UHFFFAOYSA-N	0	3	349.434	3.326	20	30		EGEDHN
Cc1cccc(CNC[C@H](O)CC(C)(C)C#N)c1Br	ZINC000598725660	460007850	/nfs/dbraw/zinc/00/78/50/460007850.db2.gz	YQVZLTIORQOXME-CYBMUJFWSA-N	0	3	325.250	3.148	20	30		EGEDHN
C[C@@H](C#N)CN(C)C(=O)N[C@@H](CN1CCCCC1)c1ccccc1	ZINC000609640195	460000808	/nfs/dbraw/zinc/00/08/08/460000808.db2.gz	ZRTBWCRHASDCKR-WMZOPIPTSA-N	0	3	328.460	3.015	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CNCc1ccc(OC2CCCCC2)nc1	ZINC000598721461	460006660	/nfs/dbraw/zinc/00/66/60/460006660.db2.gz	VTIGBAPVZNSINO-INIZCTEOSA-N	0	3	331.460	3.183	20	30		EGEDHN
N#Cc1cccc(CN[C@H](Cc2ccccc2)[C@@H](O)C(F)(F)F)c1	ZINC000609707815	460009148	/nfs/dbraw/zinc/00/91/48/460009148.db2.gz	YYZNPLXLPGQNEX-IAGOWNOFSA-N	0	3	334.341	3.182	20	30		EGEDHN
C[C@@H](CCC#N)CN[C@H](CCO)c1ccccc1Br	ZINC000602596093	460016708	/nfs/dbraw/zinc/01/67/08/460016708.db2.gz	GMZDIPKNGZBNIW-SWLSCSKDSA-N	0	3	325.250	3.402	20	30		EGEDHN
N#Cc1cccc(OCCN2CC[C@@]3(C2)CCc2ccccc2O3)c1	ZINC000589278729	460066929	/nfs/dbraw/zinc/06/69/29/460066929.db2.gz	REXNDPLAXWJQPG-OAQYLSRUSA-N	0	3	334.419	3.407	20	30		EGEDHN
Cc1cc(C)c(C#N)c(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)n1	ZINC000598858119	460071396	/nfs/dbraw/zinc/07/13/96/460071396.db2.gz	WXIGKUQBDKQMTM-AAEUAGOBSA-N	0	3	341.333	3.256	20	30		EGEDHN
C[C@H](CCC#N)CN1CCN(c2cc(C(F)(F)F)ccn2)CC1	ZINC000602713418	460080035	/nfs/dbraw/zinc/08/00/35/460080035.db2.gz	ADRFXEYDAPKUBG-CYBMUJFWSA-N	0	3	326.366	3.162	20	30		EGEDHN
Cc1ncc([C@@H](C)NC2(c3ccc(C#N)cc3)CCOCC2)c(C)n1	ZINC000602726170	460087364	/nfs/dbraw/zinc/08/73/64/460087364.db2.gz	VPRPDIOPZNAUET-OAHLLOKOSA-N	0	3	336.439	3.322	20	30		EGEDHN
N#CC[C@H]1CCCN(C(=O)c2ccc(CN3CCCCC3)cc2)C1	ZINC000597904478	460103275	/nfs/dbraw/zinc/10/32/75/460103275.db2.gz	SGSIKYWUGVBEJP-QGZVFWFLSA-N	0	3	325.456	3.438	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H]1CCN(c2ccc(C#N)cc2[N+](=O)[O-])C1	ZINC000610281804	460107122	/nfs/dbraw/zinc/10/71/22/460107122.db2.gz	OUIWXIABPBOBCW-QGZVFWFLSA-N	0	3	336.395	3.177	20	30		EGEDHN
CCC[C@@H](CNCc1cn(C)nc1-c1ccc(C#N)cc1)OCC	ZINC000598989680	460119165	/nfs/dbraw/zinc/11/91/65/460119165.db2.gz	QPSYNVPCVLRBFS-SFHVURJKSA-N	0	3	326.444	3.254	20	30		EGEDHN
COc1ncc(Br)cc1CNCC(C)(C)CCC#N	ZINC000599002501	460124470	/nfs/dbraw/zinc/12/44/70/460124470.db2.gz	DCBRKDQQDKKPOG-UHFFFAOYSA-N	0	3	326.238	3.272	20	30		EGEDHN
C[C@@H](NC(=O)[C@H]1CCCN(Cc2cccnc2)C1)c1cccc(C#N)c1	ZINC000610363360	460135105	/nfs/dbraw/zinc/13/51/05/460135105.db2.gz	FSEVASMCAZIIMC-UZLBHIALSA-N	0	3	348.450	3.043	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)c1nc2cccc(F)c2o1	ZINC000599056577	460144030	/nfs/dbraw/zinc/14/40/30/460144030.db2.gz	JILMSMNKYMDKMQ-UHFFFAOYSA-N	0	3	338.386	3.407	20	30		EGEDHN
COc1ccc(C)cc1CN1CCN(CCCC(C)(C)C#N)CC1	ZINC000610447502	460153628	/nfs/dbraw/zinc/15/36/28/460153628.db2.gz	UQVBEDLNCNJNRE-UHFFFAOYSA-N	0	3	329.488	3.451	20	30		EGEDHN
CC(C)(CNC(=O)N[C@H]1CCc2cc(C#N)ccc21)N1CCCCC1	ZINC000618797375	460179524	/nfs/dbraw/zinc/17/95/24/460179524.db2.gz	TZRCAPXGNXIFDC-SFHVURJKSA-N	0	3	340.471	3.109	20	30		EGEDHN
CN(C[C@H](O)COc1cc(Cl)cc(Cl)c1)[C@@H]1CC[C@@H](C#N)C1	ZINC000602924593	460188210	/nfs/dbraw/zinc/18/82/10/460188210.db2.gz	GHICDIALGHSVFR-DFBGVHRSSA-N	0	3	343.254	3.357	20	30		EGEDHN
C=CCN(CCc1ccccc1)C[C@H](O)COc1ccccc1C#N	ZINC000599283548	460218706	/nfs/dbraw/zinc/21/87/06/460218706.db2.gz	YLXRMGRFXFQHPH-FQEVSTJZSA-N	0	3	336.435	3.029	20	30		EGEDHN
Cc1cccc([C@@H](NC(=O)[C@@H](N)CCCCC#N)C(F)(F)F)c1	ZINC000594435804	460220423	/nfs/dbraw/zinc/22/04/23/460220423.db2.gz	DYBZWZCTCKZFGV-UONOGXRCSA-N	0	3	327.350	3.126	20	30		EGEDHN
N#CCCCC[C@@H](N)C(=O)NCC1(c2ccc(F)cc2Cl)CC1	ZINC000594446734	460223717	/nfs/dbraw/zinc/22/37/17/460223717.db2.gz	RZXULHROVLHHQI-OAHLLOKOSA-N	0	3	337.826	3.038	20	30		EGEDHN
C[C@@H](NC(C)(C)CNC(=O)Nc1ccnc(C#N)c1)c1ccccc1	ZINC000603127437	460248954	/nfs/dbraw/zinc/24/89/54/460248954.db2.gz	DUPHEVOTXNZPFP-CQSZACIVSA-N	0	3	337.427	3.204	20	30		EGEDHN
CCCC(=O)NC1CCN(Cc2ccccc2C(C)(C)C#N)CC1	ZINC000610859155	460249633	/nfs/dbraw/zinc/24/96/33/460249633.db2.gz	CLNPMSDITMMVGO-UHFFFAOYSA-N	0	3	327.472	3.368	20	30		EGEDHN
N#Cc1ccc(CCN[C@H](Cc2ccccc2)[C@@H](O)C(F)(F)F)cc1	ZINC000603146902	460253821	/nfs/dbraw/zinc/25/38/21/460253821.db2.gz	VQDBCNQIIFSIAN-QZTJIDSGSA-N	0	3	348.368	3.225	20	30		EGEDHN
COCc1cc(C#N)ccc1NCCCCN1C[C@@H](C)O[C@@H](C)C1	ZINC000603308761	460281609	/nfs/dbraw/zinc/28/16/09/460281609.db2.gz	ITYQCHMPYUIQIF-IYBDPMFKSA-N	0	3	331.460	3.006	20	30		EGEDHN
Cc1ccc(CN2CC[C@H](CN(C)c3ccc(C#N)cn3)C2)s1	ZINC000603400581	460297856	/nfs/dbraw/zinc/29/78/56/460297856.db2.gz	LPBAYRLDLJWUIO-MRXNPFEDSA-N	0	3	326.469	3.282	20	30		EGEDHN
C[C@@H](NC(=O)NC[C@H]1N(C)CCCC1(C)C)c1cccc(C#N)c1	ZINC000619204617	460300544	/nfs/dbraw/zinc/30/05/44/460300544.db2.gz	AIDOBCFALXHGQL-RHSMWYFYSA-N	0	3	328.460	3.039	20	30		EGEDHN
CC[C@H]1CCCCN1CCNC(=O)Nc1cc(OC)c(C#N)cc1F	ZINC000599818301	460340578	/nfs/dbraw/zinc/34/05/78/460340578.db2.gz	WMPKWXPBRWRJJI-AWEZNQCLSA-N	0	3	348.422	3.092	20	30		EGEDHN
Cc1ccccc1CN1CCCN(CCOc2cccc(C#N)c2)CC1	ZINC000603844068	460346878	/nfs/dbraw/zinc/34/68/78/460346878.db2.gz	OMVSTLGRCHUXGA-UHFFFAOYSA-N	0	3	349.478	3.453	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2NCc1ccccc1Cn1cncn1	ZINC000611390725	460352808	/nfs/dbraw/zinc/35/28/08/460352808.db2.gz	QOYSLDFMCGTXJT-NRFANRHFSA-N	0	3	343.434	3.365	20	30		EGEDHN
Cc1cccc(C)c1OC[C@H](O)CN[C@@H](C)c1ccc(C#N)c(F)c1	ZINC000611465530	460370433	/nfs/dbraw/zinc/37/04/33/460370433.db2.gz	LIEMZMWROJTPTL-MAUKXSAKSA-N	0	3	342.414	3.405	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2ccc(C#N)c(Cl)c2)CC1	ZINC000619757334	460433274	/nfs/dbraw/zinc/43/32/74/460433274.db2.gz	VVUIQJOLAHKNBK-UHFFFAOYSA-N	0	3	346.862	3.051	20	30		EGEDHN
C[C@H](CNC(=O)NCc1ccc(C#N)c(Cl)c1)N1CCC(C)CC1	ZINC000619759560	460434343	/nfs/dbraw/zinc/43/43/43/460434343.db2.gz	QLUYAGQYDXZSLC-CQSZACIVSA-N	0	3	348.878	3.131	20	30		EGEDHN
C=CCOc1c(Cl)cc(CNC[C@@](C)(O)C(C)C)cc1OC	ZINC000623415863	460536497	/nfs/dbraw/zinc/53/64/97/460536497.db2.gz	AEWVECOQQUTUNK-QGZVFWFLSA-N	0	3	327.852	3.410	20	30		EGEDHN
C[C@@H](Oc1ccccc1C#N)c1nc(C2C[C@H]3CC[C@@H](C2)N3C)no1	ZINC000612954123	460781920	/nfs/dbraw/zinc/78/19/20/460781920.db2.gz	BWFTZHKGYARRFH-OHRKKDJYSA-N	0	3	338.411	3.421	20	30		EGEDHN
C=CCN(C(=O)c1cccc(CN2CCCCC2)c1)[C@H](C)COC	ZINC000617584529	460919131	/nfs/dbraw/zinc/91/91/31/460919131.db2.gz	FGFSMVLXIOPHET-QGZVFWFLSA-N	0	3	330.472	3.336	20	30		EGEDHN
Cc1cccc(CN2CC[C@H](NC(=O)c3cccc(CC#N)c3)C2)c1	ZINC000601849296	460924476	/nfs/dbraw/zinc/92/44/76/460924476.db2.gz	HEGAYCWLRIQEBN-FQEVSTJZSA-N	0	3	333.435	3.065	20	30		EGEDHN
CN(Cc1ccccc1)[C@H]1CCN(c2cc(C#N)ccc2[N+](=O)[O-])C1	ZINC000613425857	460942924	/nfs/dbraw/zinc/94/29/24/460942924.db2.gz	JINFEAJWLFBGEO-KRWDZBQOSA-N	0	3	336.395	3.177	20	30		EGEDHN
Cc1ccc2oc(CNC[C@@H](O)COc3ccccc3C#N)cc2c1	ZINC000601961390	460962572	/nfs/dbraw/zinc/96/25/72/460962572.db2.gz	XBCAMIZUQWYUJN-QGZVFWFLSA-N	0	3	336.391	3.142	20	30		EGEDHN
Cc1ccc(CNC[C@H](O)CC(C)(C)C#N)cc1Br	ZINC000601969267	460965164	/nfs/dbraw/zinc/96/51/64/460965164.db2.gz	BGJGMXRPPZUCBW-CYBMUJFWSA-N	0	3	325.250	3.148	20	30		EGEDHN
C=CC[C@@H]1CCCN(C(=O)Nc2cccc(OCCN(C)C)c2)C1	ZINC000665601889	461155734	/nfs/dbraw/zinc/15/57/34/461155734.db2.gz	HEJTXTZVHGHWBR-MRXNPFEDSA-N	0	3	331.460	3.447	20	30		EGEDHN
C=CCC[C@H](CO)NCc1cc(OC)c(Br)cc1F	ZINC000631154267	461595164	/nfs/dbraw/zinc/59/51/64/461595164.db2.gz	UBTGSQSPAAODNK-LLVKDONJSA-N	0	3	332.213	3.014	20	30		EGEDHN
C=CCN(C(=O)NC[C@@H](c1ccccc1)N1CCCC1)[C@H](C)COC	ZINC000663400151	461621860	/nfs/dbraw/zinc/62/18/60/461621860.db2.gz	MUKUKELSPNACEW-MJGOQNOKSA-N	0	3	345.487	3.056	20	30		EGEDHN
C=CCN(C(=O)NCC(C)(C)N[C@H](C)c1ccccc1)[C@@H](C)COC	ZINC000664106699	461943710	/nfs/dbraw/zinc/94/37/10/461943710.db2.gz	BTDAZTSZBHNRMI-DLBZAZTESA-N	0	3	347.503	3.348	20	30		EGEDHN
OCC1(N(CC#Cc2ccc(OC(F)(F)F)cc2)C2CC2)CCC1	ZINC000660773455	461964550	/nfs/dbraw/zinc/96/45/50/461964550.db2.gz	YSVXAEYGSBBCRE-UHFFFAOYSA-N	0	3	339.357	3.316	20	30		EGEDHN
CC(=O)c1ccccc1NC(=O)CCCN1CCC[C@H](CC#N)C1	ZINC000661151471	462125833	/nfs/dbraw/zinc/12/58/33/462125833.db2.gz	CGULMFUWPJDQQT-MRXNPFEDSA-N	0	3	327.428	3.234	20	30		EGEDHN
C=CCN(C[C@H](O)Cc1ccc(C(F)(F)F)cc1)[C@@H](C)COC	ZINC000661242390	462166188	/nfs/dbraw/zinc/16/61/88/462166188.db2.gz	NVYUDYSXSYKZIO-XJKSGUPXSA-N	0	3	331.378	3.132	20	30		EGEDHN
C=CC[C@@H]1CCCN(CC(=O)N(C)Cc2ccc(OC)c(F)c2)C1	ZINC000661376377	462222955	/nfs/dbraw/zinc/22/29/55/462222955.db2.gz	BGOUOLOFHFZFDY-OAHLLOKOSA-N	0	3	334.435	3.081	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cccc3oc(C)nc32)CC1	ZINC000640249352	462334535	/nfs/dbraw/zinc/33/45/35/462334535.db2.gz	UGQHRYYTYIIAKY-UHFFFAOYSA-N	0	3	328.416	3.298	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1ccc(C(F)F)nc1)C(C)C	ZINC000654781580	462381501	/nfs/dbraw/zinc/38/15/01/462381501.db2.gz	IZNHTDLQGDHNCV-MRXNPFEDSA-N	0	3	337.414	3.448	20	30		EGEDHN
C=CCC1(NC(=O)C(=O)Nc2ccc(CN(C)C)c(C)c2)CCCC1	ZINC000658729449	462513819	/nfs/dbraw/zinc/51/38/19/462513819.db2.gz	NSSBBXNJRBTRNX-UHFFFAOYSA-N	0	3	343.471	3.000	20	30		EGEDHN
COC(=O)c1cccc(NC2CCN(Cc3ccc(C#N)cc3)CC2)c1	ZINC000183513083	534277510	/nfs/dbraw/zinc/27/75/10/534277510.db2.gz	RWUXEEYDTNVKIV-UHFFFAOYSA-N	0	3	349.434	3.421	20	30		EGEDHN
C=CCN1CCC(NC(=O)/C=C/c2nc3ccccc3s2)CC1	ZINC000171726344	526415403	/nfs/dbraw/zinc/41/54/03/526415403.db2.gz	FUSGQCJAUIGEQX-BQYQJAHWSA-N	0	3	327.453	3.076	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)[C@H](C)c2ccc(F)c(F)c2)CC1	ZINC000171740191	526423912	/nfs/dbraw/zinc/42/39/12/526423912.db2.gz	DOZQSVLTXQKQBJ-CYBMUJFWSA-N	0	3	337.414	3.318	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC[C@@H](Nc2ccccc2)C(C)C)CC1	ZINC000171707661	526433323	/nfs/dbraw/zinc/43/33/23/526433323.db2.gz	LTMYXGMNXDFSDF-LJQANCHMSA-N	0	3	344.503	3.073	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(-c3ccccc3)nc2C)CC1	ZINC000171722280	526445952	/nfs/dbraw/zinc/44/59/52/526445952.db2.gz	VQRRZJBJGILXKC-UHFFFAOYSA-N	0	3	335.451	3.437	20	30		EGEDHN
C#CCCCCNC(=O)N(CC)C[C@H]1CCN(Cc2ccccc2)C1	ZINC000155049369	526696166	/nfs/dbraw/zinc/69/61/66/526696166.db2.gz	OSWJEARGSIFKKT-FQEVSTJZSA-N	0	3	341.499	3.344	20	30		EGEDHN
CCS[C@@H]1CCCCN([C@H]2CCN(c3ccc(C#N)cc3)C2=O)C1	ZINC000246587143	535705339	/nfs/dbraw/zinc/70/53/39/535705339.db2.gz	ILWORGYAAVLVCB-MSOLQXFVSA-N	0	3	343.496	3.271	20	30		EGEDHN
Cc1cc(C(=O)C(C#N)c2nnc3n2CCCCC3)cc(C)c1F	ZINC000153527740	546880445	/nfs/dbraw/zinc/88/04/45/546880445.db2.gz	SCLNFOOPDYZLCT-AWEZNQCLSA-N	0	3	326.375	3.251	20	30		EGEDHN
C=CCC[C@@H](NC(=O)N[C@H]1CCN(CC2CC2)C1)c1ccccc1	ZINC000158690220	546930526	/nfs/dbraw/zinc/93/05/26/546930526.db2.gz	IFOJLSJXYWKGOL-RBUKOAKNSA-N	0	3	327.472	3.477	20	30		EGEDHN
O=C(CN1CCC[C@H](C2CC2)C1)NC(=O)Nc1ccc2c(c1)OCO2	ZINC000329630141	547502285	/nfs/dbraw/zinc/50/22/85/547502285.db2.gz	HTNQKAAZOLDWKC-ZDUSSCGKSA-N	0	3	345.399	3.039	20	30		EGEDHN
C[C@H](C(=O)NC[C@@H]1COc2ccccc2O1)N1CCC[C@H](C2CC2)C1	ZINC000329644660	547503709	/nfs/dbraw/zinc/50/37/09/547503709.db2.gz	JEOTYWCWYNZPCZ-HYVNUMGLSA-N	0	3	344.455	3.293	20	30		EGEDHN
Fc1ccc(CCN2CCC(N=Nc3nccnc3Cl)CC2)cc1	ZINC000733079564	575306114	/nfs/dbraw/zinc/30/61/14/575306114.db2.gz	NCKIGLBTLOWVGP-UHFFFAOYSA-N	0	3	347.825	3.376	20	30		EGEDHN
CC(C)n1ccc(C(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)n1	ZINC000733678560	575381181	/nfs/dbraw/zinc/38/11/81/575381181.db2.gz	DJCXYJFASNYPRA-ZDUSSCGKSA-N	0	3	330.775	3.079	20	30		EGEDHN
C=CC[C@@H](NC(=O)NC[C@H](C)N1CCC(C)CC1)c1ccncc1	ZINC000734666208	575534476	/nfs/dbraw/zinc/53/44/76/575534476.db2.gz	WCGJCRIAVWAODW-FUHWJXTLSA-N	0	3	330.476	3.118	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2ccc(N(CC)C(C)C)cc2)CC1	ZINC000740735655	576621351	/nfs/dbraw/zinc/62/13/51/576621351.db2.gz	KQDKRJAVTSLDAH-UHFFFAOYSA-N	0	3	341.499	3.139	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2cc3cc(F)ccc3s2)CC1	ZINC000740737970	576621988	/nfs/dbraw/zinc/62/19/88/576621988.db2.gz	OUKHGRRAZMSUNY-UHFFFAOYSA-N	0	3	330.428	3.258	20	30		EGEDHN
CC1(C)[C@@H]2CN(CC(=O)C(C#N)c3nc4ccccc4s3)C[C@@H]21	ZINC000741807256	576724073	/nfs/dbraw/zinc/72/40/73/576724073.db2.gz	YBHCPUVJUOVSDX-UPJWGTAASA-N	0	3	325.437	3.060	20	30		EGEDHN
CN(Cc1ccccc1)[C@H]1CCN(C(=O)/C=C\c2ccccc2C#N)C1	ZINC000742794406	576795556	/nfs/dbraw/zinc/79/55/56/576795556.db2.gz	WWVAKVGLTXAPHD-GMGKOPGTSA-N	0	3	345.446	3.304	20	30		EGEDHN
C#CCOc1ccc(C(=O)N2CC[C@@H](N(C)Cc3ccccc3)C2)cc1	ZINC000742793139	576795591	/nfs/dbraw/zinc/79/55/91/576795591.db2.gz	KSPPMVPCOROIMY-HXUWFJFHSA-N	0	3	348.446	3.045	20	30		EGEDHN
C#CCCN1CCC(NC(=O)[C@H](Cc2ccccc2)C(C)C)CC1	ZINC000743490726	576810281	/nfs/dbraw/zinc/81/02/81/576810281.db2.gz	VRVPKMGGHWJIGS-HXUWFJFHSA-N	0	3	326.484	3.105	20	30		EGEDHN
CC(=NNc1ccc([N+](=O)[O-])cc1)c1cccc(OCCN(C)C)c1	ZINC000743526821	576811089	/nfs/dbraw/zinc/81/10/89/576811089.db2.gz	WBHWXUXXCVQRQZ-UHFFFAOYSA-N	0	3	342.399	3.371	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@H]1C[C@@]12CCc1ccccc12	ZINC000744022795	576818990	/nfs/dbraw/zinc/81/89/90/576818990.db2.gz	SPDMJICNMTUKJT-HGHGUNKESA-N	0	3	338.451	3.296	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1ccc(Br)cc1Cl	ZINC000691634057	1298135703	/nfs/dbraw/zinc/13/57/03/1298135703.db2.gz	ZLWZZUIEYGXPOV-SNVBAGLBSA-N	0	3	330.613	3.062	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000769297520	1303087612	/nfs/dbraw/zinc/08/76/12/1303087612.db2.gz	BAOJLPARDXDRRQ-QGZVFWFLSA-N	0	3	329.444	3.390	20	30		EGEDHN
COc1ccc(C(C)N=Nc2ncncc2F)cc1CN1CCCC1	ZINC000793226842	1309322447	/nfs/dbraw/zinc/32/24/47/1309322447.db2.gz	YGTPGHMHCGSLEQ-UHFFFAOYSA-N	0	3	343.406	3.056	20	30		EGEDHN
Cc1ccccc1OCCN1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC000022850291	1291226679	/nfs/dbraw/zinc/22/66/79/1291226679.db2.gz	CMHISHNFGJKZDW-UHFFFAOYSA-N	0	3	349.478	3.453	20	30		EGEDHN
N#CC(C(=O)CCCc1nnc(-c2ccccc2)o1)c1ccccn1	ZINC000049458667	1291628197	/nfs/dbraw/zinc/62/81/97/1291628197.db2.gz	FAYMJURGNYNUBB-OAHLLOKOSA-N	0	3	332.363	3.331	20	30		EGEDHN
N#CC(C(=O)CCc1ccc(Cl)cc1)C(=O)NC1CCCCC1	ZINC000050682318	1291655001	/nfs/dbraw/zinc/65/50/01/1291655001.db2.gz	BRMUOWKQBLYKCY-INIZCTEOSA-N	0	3	332.831	3.430	20	30		EGEDHN
CN(C)CCN(C(=O)/C=C/c1ccccc1C#N)C1CCCCC1	ZINC000065745931	1292090237	/nfs/dbraw/zinc/09/02/37/1292090237.db2.gz	RPSXZKKZCLFAIF-OUKQBFOZSA-N	0	3	325.456	3.294	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)CCc1nc2ccccc2s1	ZINC000069911300	1292253472	/nfs/dbraw/zinc/25/34/72/1292253472.db2.gz	CZPXMLCZFHHFKK-CYBMUJFWSA-N	0	3	343.452	3.244	20	30		EGEDHN
CN(c1ccc(CNC(=O)[C@H](N)CCCC#N)cc1)C1CCCCC1	ZINC000827821354	1292381654	/nfs/dbraw/zinc/38/16/54/1292381654.db2.gz	WDYHRMHFAQKVMH-LJQANCHMSA-N	0	3	342.487	3.093	20	30		EGEDHN
N#Cc1ccc(CN[C@@H](Cc2ccccc2Cl)[C@H]2CCCO2)nc1	ZINC000834773933	1293145585	/nfs/dbraw/zinc/14/55/85/1293145585.db2.gz	LSCGLALTUKGHCH-RBUKOAKNSA-N	0	3	341.842	3.487	20	30		EGEDHN
C[C@@H](NCc1ccc(O[C@@H](C)C#N)cc1)c1ccc(NC(N)=O)cc1	ZINC000113351173	1293148003	/nfs/dbraw/zinc/14/80/03/1293148003.db2.gz	RCQGOOMKIJZYPZ-UONOGXRCSA-N	0	3	338.411	3.319	20	30		EGEDHN
CCc1cccc(CC)c1NC(=O)C(C#N)C(=O)CSC(F)F	ZINC000835062950	1293196400	/nfs/dbraw/zinc/19/64/00/1293196400.db2.gz	GXPOJRDKPUFRKW-LBPRGKRZSA-N	0	3	340.395	3.415	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)CCCC(=O)C(C)(C)C)cc1	ZINC000835064995	1293197497	/nfs/dbraw/zinc/19/74/97/1293197497.db2.gz	LKHIQTKFIDHPSA-OAHLLOKOSA-N	0	3	344.411	3.128	20	30		EGEDHN
C#CCOc1ccccc1CNC[C@@H](O)c1cccc(OC(C)C)c1	ZINC000116925631	1293212171	/nfs/dbraw/zinc/21/21/71/1293212171.db2.gz	XCUGXPSTOJZMNU-HXUWFJFHSA-N	0	3	339.435	3.309	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/C[C@H](C(C)C)N2CCOCC2)c([O-])c1	ZINC000119812956	1293289592	/nfs/dbraw/zinc/28/95/92/1293289592.db2.gz	CLAJOFZVGMBMJE-KNGGAZFVSA-N	0	3	347.503	3.014	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)Cc2c(F)cccc2F)c1	ZINC000119996087	1293298018	/nfs/dbraw/zinc/29/80/18/1293298018.db2.gz	VZGJZJFKLZFDCC-CQSZACIVSA-N	0	3	328.318	3.163	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)[C@H]2CCCCO2)cc1	ZINC000121976211	1293398279	/nfs/dbraw/zinc/39/82/79/1293398279.db2.gz	JDGQECJMHKSRFS-DLBZAZTESA-N	0	3	328.412	3.246	20	30		EGEDHN
CCCCSCCC(=O)C(C#N)C(=O)Nc1ccccc1OC	ZINC000124070406	1293466362	/nfs/dbraw/zinc/46/63/62/1293466362.db2.gz	QFPVIDRJCHYQDP-ZDUSSCGKSA-N	0	3	334.441	3.266	20	30		EGEDHN
N#CC(C(=O)Nc1ccccn1)=C([O-])c1cc(Cl)cc(Cl)c1	ZINC000126427773	1293535004	/nfs/dbraw/zinc/53/50/04/1293535004.db2.gz	GFXZSYRKVMPPSS-GFCCVEGCSA-N	0	3	334.162	3.350	20	30		EGEDHN
N#CC(C(=O)Nc1ccccn1)C(=O)c1cc(Cl)cc(Cl)c1	ZINC000126427773	1293535007	/nfs/dbraw/zinc/53/50/07/1293535007.db2.gz	GFXZSYRKVMPPSS-GFCCVEGCSA-N	0	3	334.162	3.350	20	30		EGEDHN
[O-]c1ccc(Cl)cc1/C=N/C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1	ZINC000128469838	1293594003	/nfs/dbraw/zinc/59/40/03/1293594003.db2.gz	NGRDOGPAGWDGPI-URFUOSOHSA-N	0	3	336.863	3.232	20	30		EGEDHN
N#CC(C(=O)CC(c1ccccc1)c1ccccc1)C(=O)NC1CC1	ZINC000129098790	1293613341	/nfs/dbraw/zinc/61/33/41/1293613341.db2.gz	BVNCZKUHESZQSM-IBGZPJMESA-N	0	3	332.403	3.196	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)Cc1ccc(N2CCOCC2)c(F)c1	ZINC000131180553	1293681719	/nfs/dbraw/zinc/68/17/19/1293681719.db2.gz	HJWTWNFVAPTRLW-UHFFFAOYSA-N	0	3	339.414	3.166	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)C[C@@H](C)c1ccc(F)cc1F	ZINC000152188520	1293957847	/nfs/dbraw/zinc/95/78/47/1293957847.db2.gz	DPUKPFZPNHEADL-IUODEOHRSA-N	0	3	336.382	3.474	20	30		EGEDHN
C[C@H](Cc1ccccc1Cl)C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000155196928	1294088870	/nfs/dbraw/zinc/08/88/70/1294088870.db2.gz	DZOSORIYZSYKSE-TZMCWYRMSA-N	0	3	341.798	3.261	20	30		EGEDHN
CC[C@@H](SC)C(=O)C(C#N)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000156512483	1294147352	/nfs/dbraw/zinc/14/73/52/1294147352.db2.gz	RJXLGYXZWXUOKA-BXKDBHETSA-N	0	3	328.796	3.268	20	30		EGEDHN
C[C@H](OC1CCCCCC1)C(=O)C(C#N)c1nnc2n1CCCCC2	ZINC000162681116	1294320228	/nfs/dbraw/zinc/32/02/28/1294320228.db2.gz	NGMHFPNMPDULOI-HOCLYGCPSA-N	0	3	344.459	3.309	20	30		EGEDHN
C[C@H](CCc1cccc(F)c1)C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000174012054	1294476975	/nfs/dbraw/zinc/47/69/75/1294476975.db2.gz	UFEIKKFEDXMBSQ-CZUORRHYSA-N	0	3	339.370	3.137	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)COc1ccc(C(C)C)cc1	ZINC000193372874	1295858012	/nfs/dbraw/zinc/85/80/12/1295858012.db2.gz	TVXTZVVBOMEHEQ-KRWDZBQOSA-N	0	3	330.428	3.204	20	30		EGEDHN
Cc1noc(C)c1[C@@H](C)C(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1	ZINC000195491930	1296072610	/nfs/dbraw/zinc/07/26/10/1296072610.db2.gz	IRNNAGRMJSFJEC-YMTOWFKASA-N	0	3	345.786	3.396	20	30		EGEDHN
C#CCOc1ccc(Br)cc1CN[C@@H]1CCSC1	ZINC000225515741	1296137345	/nfs/dbraw/zinc/13/73/45/1296137345.db2.gz	IGSRUKNQMPFCAA-CYBMUJFWSA-N	0	3	326.259	3.056	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)[C@H]1C[C@H]1c1cc(Cl)cc(Cl)c1	ZINC000246520266	1296358257	/nfs/dbraw/zinc/35/82/57/1296358257.db2.gz	HUZSZXPRLFZXML-MELADBBJSA-N	0	3	339.222	3.330	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)[C@@H]1C[C@H]1c1cc(Cl)cc(Cl)c1	ZINC000246520256	1296359060	/nfs/dbraw/zinc/35/90/60/1296359060.db2.gz	HUZSZXPRLFZXML-BFHYXJOUSA-N	0	3	339.222	3.330	20	30		EGEDHN
Cc1ccsc1[C@@H]1C[C@@H]1C(=O)C(C#N)C(=O)NC1CCCCC1	ZINC000246574378	1296361507	/nfs/dbraw/zinc/36/15/07/1296361507.db2.gz	LPAHDRRIQSSJMW-ZNMIVQPWSA-N	0	3	330.453	3.318	20	30		EGEDHN
N#CC(C(=O)NC1CCCC1)C(=O)[C@@H]1C[C@@]12CCCc1ccccc12	ZINC000246661466	1296365434	/nfs/dbraw/zinc/36/54/34/1296365434.db2.gz	XRUQTPWASHTFLC-DJPFJPOOSA-N	0	3	336.435	3.048	20	30		EGEDHN
CC[C@@H](Cc1cccc(C)c1)C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000873499089	1297544804	/nfs/dbraw/zinc/54/48/04/1297544804.db2.gz	KVVUSGTVQBMHEW-DLBZAZTESA-N	0	3	335.407	3.306	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)OC(C)(C)C)C1(C)C	ZINC000404746200	1297759371	/nfs/dbraw/zinc/75/93/71/1297759371.db2.gz	SQBDTCDHXFSBCO-QWRGUYRKSA-N	0	3	333.270	3.176	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC000584908658	1298024236	/nfs/dbraw/zinc/02/42/36/1298024236.db2.gz	IJHYZCDRUSLKIL-MRXNPFEDSA-N	0	3	330.472	3.378	20	30		EGEDHN
C#CCN(C[C@@H](O)COc1ccccc1F)[C@H]1CCc2ccccc21	ZINC000747528708	1298795362	/nfs/dbraw/zinc/79/53/62/1298795362.db2.gz	NUBMJGONAXHPJE-XLIONFOSSA-N	0	3	339.410	3.188	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](O)c2ccc(OC(F)(F)F)cc2)s1	ZINC000749110903	1299145772	/nfs/dbraw/zinc/14/57/72/1299145772.db2.gz	SURZKVPAGJQKRG-AWEZNQCLSA-N	0	3	342.342	3.342	20	30		EGEDHN
N#CCCCCN1CCN(Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000749396608	1299208250	/nfs/dbraw/zinc/20/82/50/1299208250.db2.gz	QQQIJJVZQUQNIO-UHFFFAOYSA-N	0	3	341.377	3.397	20	30		EGEDHN
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C)[C@H]1NCc1cccc(C#N)n1	ZINC000877522816	1299365883	/nfs/dbraw/zinc/36/58/83/1299365883.db2.gz	GTQBAAQYODQZNH-CPUCHLNUSA-N	0	3	344.459	3.077	20	30		EGEDHN
CC(=O)[C@@](C#N)(CCN1CCC([C@H]2CCCO2)CC1)c1ccccc1	ZINC000878483074	1300029318	/nfs/dbraw/zinc/02/93/18/1300029318.db2.gz	GCBLYSMWULXOEK-RTWAWAEBSA-N	0	3	340.467	3.318	20	30		EGEDHN
COc1ccc(-n2c(C)cc(C(=O)C(C#N)c3ccncn3)c2C)cc1	ZINC000760337971	1301256118	/nfs/dbraw/zinc/25/61/18/1301256118.db2.gz	CMHVRKZMISCUGI-GOSISDBHSA-N	0	3	346.390	3.383	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)[C@@H]2C[C@]23CCOC3)cc1	ZINC000764762191	1302129156	/nfs/dbraw/zinc/12/91/56/1302129156.db2.gz	RKOXFHCSYRDBDR-UWVAXJGDSA-N	0	3	340.423	3.103	20	30		EGEDHN
C[C@@H]1CN(C[C@@H](O)c2ccc(C#N)cc2)[C@H](C)CN1Cc1ccccc1	ZINC000766965044	1302554181	/nfs/dbraw/zinc/55/41/81/1302554181.db2.gz	WQPVAXQPQWBSBM-JBYIUTFZSA-N	0	3	349.478	3.186	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)[C@@H](F)c1ccccc1	ZINC000769280677	1303083635	/nfs/dbraw/zinc/08/36/35/1303083635.db2.gz	BXJRXZQFDJMBHG-PBHICJAKSA-N	0	3	340.354	3.443	20	30		EGEDHN
C#CCOc1ccccc1CN[C@H](C)CC(=O)Nc1cccc(F)c1	ZINC000772989031	1303602796	/nfs/dbraw/zinc/60/27/96/1303602796.db2.gz	WIVOTZXHIJHUQM-OAHLLOKOSA-N	0	3	340.398	3.345	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)c1	ZINC000774251343	1303790517	/nfs/dbraw/zinc/79/05/17/1303790517.db2.gz	IHWVYBMDJQQLJJ-HZPDHXFCSA-N	0	3	343.362	3.076	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)c1	ZINC000774251341	1303790756	/nfs/dbraw/zinc/79/07/56/1303790756.db2.gz	IHWVYBMDJQQLJJ-CVEARBPZSA-N	0	3	343.362	3.076	20	30		EGEDHN
CC(CN1CCCCCC1)N=Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000777418554	1304293310	/nfs/dbraw/zinc/29/33/10/1304293310.db2.gz	MZDIAWQORMGARC-UHFFFAOYSA-N	0	3	335.364	3.167	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CN[C@H]1CCC[C@H](C(=O)N(C)C)C1	ZINC000778168265	1304408731	/nfs/dbraw/zinc/40/87/31/1304408731.db2.gz	AMMGJZUTQOFRAO-GJZGRUSLSA-N	0	3	348.874	3.089	20	30		EGEDHN
CCN(C(=O)Nc1ccc(C#N)cn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000889233145	1304421182	/nfs/dbraw/zinc/42/11/82/1304421182.db2.gz	RRWCWLGMSBTXIG-GOSISDBHSA-N	0	3	349.438	3.082	20	30		EGEDHN
COc1ccc(CN[C@H]2CCCN(c3ccc(C#N)cc3)C2=O)c(C)c1	ZINC000778551605	1304465009	/nfs/dbraw/zinc/46/50/09/1304465009.db2.gz	YYPWOHVDRRNPMP-FQEVSTJZSA-N	0	3	349.434	3.161	20	30		EGEDHN
C[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1NCc1cc(C#N)ccc1F	ZINC000779121123	1304531363	/nfs/dbraw/zinc/53/13/63/1304531363.db2.gz	SQICETTUMDOFKF-SUMWQHHRSA-N	0	3	347.434	3.432	20	30		EGEDHN
C=CC(C)(C)CC(=O)C(C#N)C(=O)Nc1ccc(C(=O)OCC)cc1	ZINC000892498422	1305408036	/nfs/dbraw/zinc/40/80/36/1305408036.db2.gz	IJVUTXNAAVOXCN-HNNXBMFYSA-N	0	3	342.395	3.113	20	30		EGEDHN
C=C(C)CN1CCC(NC(=S)N[C@@H](C)Cc2ccccc2)CC1	ZINC000786078524	1305506614	/nfs/dbraw/zinc/50/66/14/1305506614.db2.gz	LMVHIPJDOQFVNJ-INIZCTEOSA-N	0	3	331.529	3.122	20	30		EGEDHN
C#C[C@H](CCC)NC(=O)N1CCCN(Cc2ccccc2C)CC1	ZINC000791068166	1308920325	/nfs/dbraw/zinc/92/03/25/1308920325.db2.gz	QQPDFRMTAOCSRW-LJQANCHMSA-N	0	3	327.472	3.014	20	30		EGEDHN
C[C@H]1CCSCCN1CC(=O)C(C#N)c1nc2ccccc2s1	ZINC000794570492	1309548764	/nfs/dbraw/zinc/54/87/64/1309548764.db2.gz	KBCVPNZPESVOEA-QWHCGFSZSA-N	0	3	345.493	3.300	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1Cl)C(=O)[C@@H]1CCC(F)(F)C1	ZINC000796632370	1310050809	/nfs/dbraw/zinc/05/08/09/1310050809.db2.gz	KRWPCIDVYWKSPV-NXEZZACHSA-N	0	3	326.730	3.423	20	30		EGEDHN
C[C@@H]1C(=O)CC[C@H]1CC(=O)C(C#N)C(=O)Nc1cccc2ccccc21	ZINC000796633603	1310051377	/nfs/dbraw/zinc/05/13/77/1310051377.db2.gz	GAGUGQDAHAPBGC-QRTARXTBSA-N	0	3	348.402	3.492	20	30		EGEDHN
C[C@@H](Cn1ccc2ccccc21)C(=O)C(C#N)C(=O)NC1CCCC1	ZINC000796805465	1310090760	/nfs/dbraw/zinc/09/07/60/1310090760.db2.gz	ZNMTYGWEBLUHSE-YOEHRIQHSA-N	0	3	337.423	3.045	20	30		EGEDHN
C[C@@H](CNC(=O)OC(C)(C)C)C(=O)C(C#N)c1nc2ccccc2o1	ZINC000796819771	1310093532	/nfs/dbraw/zinc/09/35/32/1310093532.db2.gz	SJRIKRYBSAENLD-NWDGAFQWSA-N	0	3	343.383	3.165	20	30		EGEDHN
C#CCOc1ccc([C@H](C)NCc2ccc(C[S@@](C)=O)cc2)cc1	ZINC000797133209	1310145668	/nfs/dbraw/zinc/14/56/68/1310145668.db2.gz	PWANMCKVTIEWLF-UPCLLVRISA-N	0	3	341.476	3.428	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc(OC3CCC3)cc2)C1	ZINC001023760420	1319906366	/nfs/dbraw/zinc/90/63/66/1319906366.db2.gz	VUFYRAQFLZWDRK-QGZVFWFLSA-N	0	3	340.467	3.083	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)C#CC1CC1	ZINC000837372528	1320606354	/nfs/dbraw/zinc/60/63/54/1320606354.db2.gz	NXHSHDUAHQWHOO-UHFFFAOYSA-N	0	3	338.373	3.009	20	30		EGEDHN
Cc1cccc(CNC(=O)C(C#N)C(=O)Cc2ccc(Cl)s2)c1	ZINC000802213102	1316988361	/nfs/dbraw/zinc/98/83/61/1316988361.db2.gz	OPQNGGIUVTVKIK-AWEZNQCLSA-N	0	3	346.839	3.278	20	30		EGEDHN
CC(C)c1[nH]ccc1C(=O)N1CC[C@H](NCc2ccc(C#N)s2)C1	ZINC001019269488	1317139286	/nfs/dbraw/zinc/13/92/86/1317139286.db2.gz	SJKXGUZXDXTFTA-ZDUSSCGKSA-N	0	3	342.468	3.076	20	30		EGEDHN
C/C(=C(/F)C(=O)N(CCN(C)C)Cc1cccc(C#N)c1)C1CC1	ZINC000900419827	1317287001	/nfs/dbraw/zinc/28/70/01/1317287001.db2.gz	ZJCNWBYAZJKYAM-JXAWBTAJSA-N	0	3	329.419	3.102	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)C1)C1CCCC1	ZINC001019632611	1317312981	/nfs/dbraw/zinc/31/29/81/1317312981.db2.gz	SHYAQHYREGIVCF-KDOFPFPSSA-N	0	3	343.446	3.214	20	30		EGEDHN
Cc1cc(C)cc(C(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)c1	ZINC001019704450	1317353822	/nfs/dbraw/zinc/35/38/22/1317353822.db2.gz	UPGMZVPNLCVRSG-INIZCTEOSA-N	0	3	339.464	3.241	20	30		EGEDHN
CCC(C)(CC)C(=O)N1CC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001019794249	1317425283	/nfs/dbraw/zinc/42/52/83/1317425283.db2.gz	WTFILNUTFLGBGL-INIZCTEOSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=C[C@H](C(=O)N1CC[C@H](NCc2scnc2C)C1)c1ccccc1	ZINC001019804994	1317432739	/nfs/dbraw/zinc/43/27/39/1317432739.db2.gz	OYOACVMKCVRWLT-IRXDYDNUSA-N	0	3	341.480	3.112	20	30		EGEDHN
C#Cc1cccc(NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)c1	ZINC000806182749	1317469783	/nfs/dbraw/zinc/46/97/83/1317469783.db2.gz	BEKYWXMLBSBEOF-GOSISDBHSA-N	0	3	325.387	3.231	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@H](NC(=O)CC3=CCCCC3)C2)c1	ZINC001020027152	1317507461	/nfs/dbraw/zinc/50/74/61/1317507461.db2.gz	NZKSYRXGFAVGTE-IYARVYRRSA-N	0	3	341.430	3.325	20	30		EGEDHN
CC1(C)C(C(=O)N[C@H]2C[C@H](NCc3ccc(C#N)cc3F)C2)C1(C)C	ZINC001020053872	1317521225	/nfs/dbraw/zinc/52/12/25/1317521225.db2.gz	ZGOURBQAWKERMY-SHTZXODSSA-N	0	3	343.446	3.116	20	30		EGEDHN
C#CCCCCNC(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000806960532	1317540106	/nfs/dbraw/zinc/54/01/06/1317540106.db2.gz	ZPCHZQJJKVOOOZ-LJQANCHMSA-N	0	3	345.487	3.179	20	30		EGEDHN
Cc1sccc1C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001020130849	1317554467	/nfs/dbraw/zinc/55/44/67/1317554467.db2.gz	MOCUCFFYRHYKMA-SHTZXODSSA-N	0	3	343.427	3.118	20	30		EGEDHN
CC[C@@H](C)N[C@H](CNC(=O)Cc1ccccc1CC#N)c1ccco1	ZINC000807679226	1317576594	/nfs/dbraw/zinc/57/65/94/1317576594.db2.gz	GIJQJSYCWOEDGJ-CRAIPNDOSA-N	0	3	339.439	3.134	20	30		EGEDHN
CC[C@H](NCc1cccc(NC(=O)COC)c1)c1cccc(C#N)c1	ZINC000902733486	1317610667	/nfs/dbraw/zinc/61/06/67/1317610667.db2.gz	OHFXKUHKBWVXAX-IBGZPJMESA-N	0	3	337.423	3.384	20	30		EGEDHN
CC[C@@H](NCc1ccc(OCCOC)nc1)c1cccc(C#N)c1	ZINC000902751352	1317612877	/nfs/dbraw/zinc/61/28/77/1317612877.db2.gz	UAGQRRPLEPGJRW-GOSISDBHSA-N	0	3	325.412	3.219	20	30		EGEDHN
CC[C@@H](NCc1ccc(OCCO)c(OC)c1)c1cccc(C#N)c1	ZINC000902758970	1317613673	/nfs/dbraw/zinc/61/36/73/1317613673.db2.gz	MFTPMWSAJZKUOA-GOSISDBHSA-N	0	3	340.423	3.179	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@H](NC(=O)[C@H]3CCCC34CC4)C2)c1	ZINC001020290155	1317629383	/nfs/dbraw/zinc/62/93/83/1317629383.db2.gz	JRDRAXQVFUIQBB-BRWVUGGUSA-N	0	3	341.430	3.014	20	30		EGEDHN
C#C[C@H](NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1)C(C)(C)C	ZINC000808315856	1317659940	/nfs/dbraw/zinc/65/99/40/1317659940.db2.gz	NKWJVWBKTVOWPH-HKUYNNGSSA-N	0	3	341.499	3.340	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc3cc(C)ccc3n2)C1	ZINC001020378129	1317669660	/nfs/dbraw/zinc/66/96/60/1317669660.db2.gz	LGSQHKIPIYEHMK-SHTZXODSSA-N	0	3	329.831	3.146	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H]2COc3ccccc3[C@@H]2O)cc1Cl	ZINC000808454243	1317680362	/nfs/dbraw/zinc/68/03/62/1317680362.db2.gz	NOKRIGIQANWNBL-APWZRJJASA-N	0	3	345.826	3.489	20	30		EGEDHN
C[C@H]1CC[C@@H](CC(=O)N[C@H]2C[C@H](NCc3ccc(C#N)cc3F)C2)C1	ZINC001020482544	1317716617	/nfs/dbraw/zinc/71/66/17/1317716617.db2.gz	GPVYUBJLVVSNSR-DACLVMHWSA-N	0	3	343.446	3.260	20	30		EGEDHN
N#Cc1ccc(CN2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)CC2CCCCC2)cc1	ZINC000958173644	1317731874	/nfs/dbraw/zinc/73/18/74/1317731874.db2.gz	BKQWTDNXOYBFNO-KXTWHKPSSA-N	0	3	337.467	3.075	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc(F)c(Cl)cc2F)C1	ZINC001020530626	1317750195	/nfs/dbraw/zinc/75/01/95/1317750195.db2.gz	BEWBUQBAMFCFLJ-KYZUINATSA-N	0	3	335.181	3.221	20	30		EGEDHN
CC1(C(=O)N[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)CCCCC1	ZINC001020542782	1317756900	/nfs/dbraw/zinc/75/69/00/1317756900.db2.gz	SLZCZJAUMPIHDT-QAQDUYKDSA-N	0	3	343.446	3.405	20	30		EGEDHN
CC[C@H]1CCC[C@@H]1C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001020554093	1317765782	/nfs/dbraw/zinc/76/57/82/1317765782.db2.gz	KTTKABXABKQFDC-DKIMLUQUSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N[C@H]1C[C@H](N[C@H](C)c2ccccc2Cl)C1	ZINC001020605782	1317795705	/nfs/dbraw/zinc/79/57/05/1317795705.db2.gz	ZFDLQMFQUQOBTE-VEGMONKWSA-N	0	3	348.874	3.229	20	30		EGEDHN
C#Cc1ccc(CN2CC[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)C2)cc1	ZINC000809575403	1317834884	/nfs/dbraw/zinc/83/48/84/1317834884.db2.gz	BRRCMLAGQHSVFU-MAUKXSAKSA-N	0	3	328.456	3.403	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(C)c(C)c2)C1	ZINC001020710189	1317881204	/nfs/dbraw/zinc/88/12/04/1317881204.db2.gz	WCSIOGWTPAKNTR-XLAORIBOSA-N	0	3	332.875	3.396	20	30		EGEDHN
CCOc1c(Cl)cc(/C=C2\C(=O)c3ncnn3C2C)cc1OC	ZINC000905079320	1317920586	/nfs/dbraw/zinc/92/05/86/1317920586.db2.gz	ATDBDKDGUUZLMM-QQCYMQAYSA-N	0	3	333.775	3.180	20	30		EGEDHN
Cc1nn(Cc2ccc(C)cc2)c(C)c1/C=C1/C(=O)c2ncnn2C1C	ZINC000905079706	1317920618	/nfs/dbraw/zinc/92/06/18/1317920618.db2.gz	FOBQCDPKDVCERM-QANDDYDISA-N	0	3	347.422	3.289	20	30		EGEDHN
CCCCOc1ccc(/C=C2/C(=O)c3ncnn3C2C)cc1OC	ZINC000905080917	1317920637	/nfs/dbraw/zinc/92/06/37/1317920637.db2.gz	OFOBKHVPMDSBJC-ZMTLZGASSA-N	0	3	327.384	3.307	20	30		EGEDHN
CC[C@@H](C)c1ccc(NC(=O)C(C#N)C(=O)c2cccc(C#N)n2)cc1	ZINC000810532364	1318019163	/nfs/dbraw/zinc/01/91/63/1318019163.db2.gz	CZPDDJLTHFBGAN-DYVFJYSZSA-N	0	3	346.390	3.428	20	30		EGEDHN
COc1cccnc1CC(=O)C(C#N)c1nc2cc(F)ccc2s1	ZINC000810575930	1318025522	/nfs/dbraw/zinc/02/55/22/1318025522.db2.gz	LRZTZNNTJGAVSS-NSHDSACASA-N	0	3	341.367	3.258	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc3[nH]c(C)c(C)c3c2)C1	ZINC001021034442	1318056137	/nfs/dbraw/zinc/05/61/37/1318056137.db2.gz	JYSXFWMHPGODER-SHTZXODSSA-N	0	3	331.847	3.388	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1cccc(C#N)c1	ZINC001021231424	1318151254	/nfs/dbraw/zinc/15/12/54/1318151254.db2.gz	KYQIJUROSAWYIN-XVLXNVKGSA-N	0	3	337.467	3.216	20	30		EGEDHN
C=CCc1cc(OC)cc(CN2CC[C@H](n3cc(Cl)cn3)C2)c1O	ZINC000811802069	1318269098	/nfs/dbraw/zinc/26/90/98/1318269098.db2.gz	RPMPGWNTNLRHCN-INIZCTEOSA-N	0	3	347.846	3.426	20	30		EGEDHN
CC1CC(C(=O)N2CCCC[C@H]2CNCc2ccc(C#N)cc2F)C1	ZINC000959947126	1318281004	/nfs/dbraw/zinc/28/10/04/1318281004.db2.gz	JSCITYHGIZFMLV-UYJHFMRCSA-N	0	3	343.446	3.214	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)cc1F	ZINC000959954797	1318287559	/nfs/dbraw/zinc/28/75/59/1318287559.db2.gz	OCYPAMJCNMECPI-ZTWVHDNBSA-N	0	3	329.419	3.134	20	30		EGEDHN
O=C(C#CC1CC1)N1CCCC[C@H]1CNCc1sccc1Cl	ZINC000960003893	1318307634	/nfs/dbraw/zinc/30/76/34/1318307634.db2.gz	REXQLWSDVYNCPW-AWEZNQCLSA-N	0	3	336.888	3.286	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@@H]2CN(Cc3ccc(C#N)cc3)CC[C@@H]21	ZINC001021507615	1318325346	/nfs/dbraw/zinc/32/53/46/1318325346.db2.gz	ZTELHIHCZUKIEU-UXHICEINSA-N	0	3	339.483	3.417	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@@H](CCCN3C(=O)c3ccoc3)C2)c1	ZINC001021519174	1318346327	/nfs/dbraw/zinc/34/63/27/1318346327.db2.gz	KTIIDLZUXXIKDA-AZUAARDMSA-N	0	3	349.434	3.278	20	30		EGEDHN
C#C[C@H](C)N(C)C(=O)NC[C@@H](c1ccc(Cl)cc1)N(C)CCC	ZINC000812345591	1318372028	/nfs/dbraw/zinc/37/20/28/1318372028.db2.gz	FOSKBKCSKVXQHE-YOEHRIQHSA-N	0	3	335.879	3.386	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cnoc1-c1ccco1	ZINC000960277258	1318439510	/nfs/dbraw/zinc/43/95/10/1318439510.db2.gz	BQHDRCPDGUYJPH-SJLPKXTDSA-N	0	3	349.390	3.106	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc(C)nc1C1CC1	ZINC000960295593	1318449755	/nfs/dbraw/zinc/44/97/55/1318449755.db2.gz	JFEHGFPYQWAXKL-TZIWHRDSSA-N	0	3	347.462	3.439	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc(F)c(F)c1F	ZINC000960300149	1318450392	/nfs/dbraw/zinc/45/03/92/1318450392.db2.gz	SHJDNBHCJGBRDF-CRAIPNDOSA-N	0	3	346.352	3.275	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)CC1CC(OCC)C1	ZINC000960300205	1318451021	/nfs/dbraw/zinc/45/10/21/1318451021.db2.gz	MQIFKPYPSIJLPY-KZQZBHJTSA-N	0	3	342.483	3.140	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2coc3c2cccc3C)C1	ZINC001021607846	1318455341	/nfs/dbraw/zinc/45/53/41/1318455341.db2.gz	XUBUBPVMHJAZBQ-VQIMIIECSA-N	0	3	336.435	3.301	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cccc2[nH]c(C)nc21	ZINC000960323348	1318461197	/nfs/dbraw/zinc/46/11/97/1318461197.db2.gz	FYESNHNUWFCULC-RTBURBONSA-N	0	3	346.434	3.043	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc2c(c1)CCC2	ZINC000960333894	1318467699	/nfs/dbraw/zinc/46/76/99/1318467699.db2.gz	CPHUSYJULFQBOR-NHCUHLMSSA-N	0	3	332.447	3.347	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2coc3cc(F)ccc32)C1	ZINC001021619374	1318468088	/nfs/dbraw/zinc/46/80/88/1318468088.db2.gz	KSVKASSQIUEIFU-KDOFPFPSSA-N	0	3	340.398	3.132	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)Cc1ccccc1F	ZINC000960335789	1318468735	/nfs/dbraw/zinc/46/87/35/1318468735.db2.gz	ZLFHGYZITDWJFP-TZIWHRDSSA-N	0	3	338.426	3.316	20	30		EGEDHN
C#CCN(C(=O)Nc1ccc(CCN2CCSCC2)cc1)C(C)C	ZINC000930032355	1328769994	/nfs/dbraw/zinc/76/99/94/1328769994.db2.gz	QGHAGGMJXTXBHC-UHFFFAOYSA-N	0	3	345.512	3.153	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(F)c(C)c2)C1	ZINC001021655382	1318516112	/nfs/dbraw/zinc/51/61/12/1318516112.db2.gz	OHNRUCBLFRQIMV-HKUYNNGSSA-N	0	3	328.431	3.084	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2coc(C(F)F)c2)C1	ZINC001021660079	1318523893	/nfs/dbraw/zinc/52/38/93/1318523893.db2.gz	YDFSSWXCZVJEJJ-ZFWWWQNUSA-N	0	3	336.382	3.167	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(F)ccc2Cl)C1	ZINC001021676813	1318544514	/nfs/dbraw/zinc/54/45/14/1318544514.db2.gz	NGJKOCCLSQGSIE-KDOFPFPSSA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(Cl)c(F)c2)C1	ZINC001021677846	1318546905	/nfs/dbraw/zinc/54/69/05/1318546905.db2.gz	SSZLLHJKKXRNBA-RHSMWYFYSA-N	0	3	334.822	3.039	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(C)ccc2F)C1	ZINC001021679523	1318549431	/nfs/dbraw/zinc/54/94/31/1318549431.db2.gz	OVBZOEJVLDIFQN-APWZRJJASA-N	0	3	328.431	3.084	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc3sccc3[nH]2)C1	ZINC001021706307	1318577502	/nfs/dbraw/zinc/57/75/02/1318577502.db2.gz	KJSWWBFIUZQRQF-RHSMWYFYSA-N	0	3	341.480	3.179	20	30		EGEDHN
CCN1CCCN(C(=O)c2c(Cl)cc(C#N)cc2Cl)[C@@H](C)C1	ZINC000910279845	1318593609	/nfs/dbraw/zinc/59/36/09/1318593609.db2.gz	CZCVKTRIXNROBP-NSHDSACASA-N	0	3	340.254	3.421	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(CC(C)C)c[nH]2)C1	ZINC001021718471	1318599788	/nfs/dbraw/zinc/59/97/88/1318599788.db2.gz	YAKWSTHBVOQLMT-QUCCMNQESA-N	0	3	341.499	3.163	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2oc3ccccc3c2C)C1	ZINC001021729033	1318627807	/nfs/dbraw/zinc/62/78/07/1318627807.db2.gz	XIESEVUJHVWCKR-SJLPKXTDSA-N	0	3	336.435	3.301	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H]1CN(C)Cc1cccc(C#N)c1)C1CC1	ZINC000960522351	1318633280	/nfs/dbraw/zinc/63/32/80/1318633280.db2.gz	VPYKXNMHCODKQY-HNAYVOBHSA-N	0	3	325.456	3.027	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(C3CCCC3)no2)C1	ZINC001021742432	1318654909	/nfs/dbraw/zinc/65/49/09/1318654909.db2.gz	LDORJROINKAUFV-FUHWJXTLSA-N	0	3	343.471	3.445	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cnc(C(C)C)s2)C1	ZINC001021746330	1318664402	/nfs/dbraw/zinc/66/44/02/1318664402.db2.gz	KRQAGCDQZQRWBA-CVEARBPZSA-N	0	3	345.512	3.216	20	30		EGEDHN
C[C@@H](N[C@H]1C[C@@H](NC(=O)c2cc(C#N)c[nH]2)C1)c1ccccc1Cl	ZINC001021945874	1318741533	/nfs/dbraw/zinc/74/15/33/1318741533.db2.gz	FABKKXCMGLDOOY-BNOWGMLFSA-N	0	3	342.830	3.151	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc3nccc(C)c3c2)C1	ZINC001022137646	1318815386	/nfs/dbraw/zinc/81/53/86/1318815386.db2.gz	NCMXZZFAAXVVIK-GASCZTMLSA-N	0	3	329.831	3.146	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N1CCC[C@H]1c1ccc(OC)c(OC)c1	ZINC000912197114	1318846523	/nfs/dbraw/zinc/84/65/23/1318846523.db2.gz	PFULFSPXFLEHQA-HOTGVXAUSA-N	0	3	332.444	3.051	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)Cc2ccc(C)c(Cl)c2)C1	ZINC001022270296	1318867284	/nfs/dbraw/zinc/86/72/84/1318867284.db2.gz	PKELOJFEEAFISD-OKILXGFUSA-N	0	3	327.255	3.180	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@@H](NC(=O)[C@@H]3CCCC34CC4)C2)c(F)c1	ZINC001022280547	1318873281	/nfs/dbraw/zinc/87/32/81/1318873281.db2.gz	KBIOROGPJAUUOF-BBWFWOEESA-N	0	3	341.430	3.014	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc(Br)c(OC)c1	ZINC000912437623	1318886175	/nfs/dbraw/zinc/88/61/75/1318886175.db2.gz	HYQWCNBJQOMTLE-LBPRGKRZSA-N	0	3	327.222	3.080	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]1CN(C)Cc1cccc(C#N)c1	ZINC000960785816	1318888071	/nfs/dbraw/zinc/88/80/71/1318888071.db2.gz	ARAFHUQYBVSRGF-SFHVURJKSA-N	0	3	325.456	3.193	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc(C)n(C(CC)CC)n2)C1	ZINC001022338985	1318898928	/nfs/dbraw/zinc/89/89/28/1318898928.db2.gz	CZNUULBBODNDIR-OKILXGFUSA-N	0	3	338.883	3.156	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@@H](NCc3c(C)noc3CC)C2)CC1	ZINC001022655647	1319045199	/nfs/dbraw/zinc/04/51/99/1319045199.db2.gz	IOHRWYJGXGIUDX-IYBDPMFKSA-N	0	3	331.460	3.029	20	30		EGEDHN
CC[C@@H]1CCC[C@H]1C(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001022661363	1319049700	/nfs/dbraw/zinc/04/97/00/1319049700.db2.gz	LWIBKEWZPXYWBJ-NRSFXHEJSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@]2(C)CCCc3ccccc32)C1	ZINC001022854567	1319136936	/nfs/dbraw/zinc/13/69/36/1319136936.db2.gz	DAGGAMVEWXUUGC-JTDSTZFVSA-N	0	3	332.875	3.270	20	30		EGEDHN
CCC(=O)N1CCC[C@H]([C@H]2CCN(CC#Cc3ccc(F)cc3)C2)C1	ZINC000961082124	1319193887	/nfs/dbraw/zinc/19/38/87/1319193887.db2.gz	VYCAYLOJCUKEHT-OALUTQOASA-N	0	3	342.458	3.148	20	30		EGEDHN
C[C@@H]1CC[C@H](C(=O)OC(C)(C)C)CN1C[C@H](O)c1ccc(C#N)cc1	ZINC000817280075	1319313504	/nfs/dbraw/zinc/31/35/04/1319313504.db2.gz	YMDYKJAWSBEDCY-JLSDUUJJSA-N	0	3	344.455	3.034	20	30		EGEDHN
C=CC[C@H](CO)CN[C@@H](c1nc(Br)cs1)C1CC1	ZINC000817581334	1319405183	/nfs/dbraw/zinc/40/51/83/1319405183.db2.gz	QRJKYUYAAZMRKL-JOYOIKCWSA-N	0	3	331.279	3.131	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1cccc(CCC(F)(F)F)c1	ZINC000930315191	1328831610	/nfs/dbraw/zinc/83/16/10/1328831610.db2.gz	PPGDLJVHCKQCAT-UHFFFAOYSA-N	0	3	341.377	3.258	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@@H]2CCCN(C[C@H](F)CC)C2)cc1	ZINC001023448812	1319549462	/nfs/dbraw/zinc/54/94/62/1319549462.db2.gz	YQXIRIQEQCPEKM-FUHWJXTLSA-N	0	3	348.462	3.441	20	30		EGEDHN
C#CCN(C)CCCNC(=O)CCCc1ccc(Cl)c(Cl)c1	ZINC000818602740	1319567012	/nfs/dbraw/zinc/56/70/12/1319567012.db2.gz	BDXRWJFIEFLTBH-UHFFFAOYSA-N	0	3	341.282	3.387	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1cnc(-c2ccccc2Cl)s1	ZINC000818588997	1319563829	/nfs/dbraw/zinc/56/38/29/1319563829.db2.gz	MCFIZPMKBZMJFG-UHFFFAOYSA-N	0	3	347.871	3.148	20	30		EGEDHN
C#CCN(C)CCCNC(=O)[C@H](C)Cc1ccc(Cl)cc1Cl	ZINC000818599508	1319566920	/nfs/dbraw/zinc/56/69/20/1319566920.db2.gz	UYXZILDFJJMHSA-CYBMUJFWSA-N	0	3	341.282	3.243	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1sc2cc(F)ccc2c1Cl	ZINC000818609398	1319569163	/nfs/dbraw/zinc/56/91/63/1319569163.db2.gz	SSORIAJOWYVEFJ-UHFFFAOYSA-N	0	3	338.835	3.379	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](C2CCN(C(=O)[C@H]3CC34CC4)CC2)C1	ZINC000961416156	1319571813	/nfs/dbraw/zinc/57/18/13/1319571813.db2.gz	RNAGAGOEGXZXDV-IAGOWNOFSA-N	0	3	336.907	3.490	20	30		EGEDHN
C#Cc1ccc(C(=O)NC2[C@H]3CN(C/C=C/c4ccccc4)C[C@@H]23)cc1	ZINC000961444522	1319596984	/nfs/dbraw/zinc/59/69/84/1319596984.db2.gz	SIKPCHZXUZLNBS-PWTONALDSA-N	0	3	342.442	3.041	20	30		EGEDHN
CSc1ccc([C@H](CNC(=O)C#Cc2ccccc2)N(C)C)cc1	ZINC000819336179	1319702871	/nfs/dbraw/zinc/70/28/71/1319702871.db2.gz	SPFWJRLJKCLFDL-IBGZPJMESA-N	0	3	338.476	3.179	20	30		EGEDHN
N#CC(C(=O)CSCc1ccc(F)cc1)C(=O)NC1CCCCC1	ZINC000916893156	1319720391	/nfs/dbraw/zinc/72/03/91/1319720391.db2.gz	UBTQVBVMIXVABE-MRXNPFEDSA-N	0	3	348.443	3.217	20	30		EGEDHN
C[C@@H](Oc1ccc2c(c1)CCC2)C(=O)C(C#N)C(=O)Nc1ccccc1	ZINC000916900865	1319722975	/nfs/dbraw/zinc/72/29/75/1319722975.db2.gz	YAQIAEUVZQDEEZ-KUHUBIRLSA-N	0	3	348.402	3.290	20	30		EGEDHN
C[C@H](Oc1ccc2c(c1)CCC2)C(=O)C(C#N)C(=O)Nc1ccccc1	ZINC000916900867	1319723450	/nfs/dbraw/zinc/72/34/50/1319723450.db2.gz	YAQIAEUVZQDEEZ-LIRRHRJNSA-N	0	3	348.402	3.290	20	30		EGEDHN
CCOCCCC(=O)C(C#N)C(=O)Nc1c(CC)cccc1CC	ZINC000916905798	1319723852	/nfs/dbraw/zinc/72/38/52/1319723852.db2.gz	FIQULWRNFGCAPE-MRXNPFEDSA-N	0	3	330.428	3.275	20	30		EGEDHN
C[C@@]1(C(=O)NC2CC(CNCc3ccccc3C#N)C2)CC=CCC1	ZINC000961874492	1319756626	/nfs/dbraw/zinc/75/66/26/1319756626.db2.gz	CWQVONMKEFLSAX-VFIGECHUSA-N	0	3	337.467	3.289	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCC2(c3cccc(F)c3)CCC2)CC1	ZINC000917141346	1319762685	/nfs/dbraw/zinc/76/26/85/1319762685.db2.gz	BUAOCQKERYLYGA-UHFFFAOYSA-N	0	3	345.462	3.197	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccccc2OCC(C)C)C1	ZINC001023652707	1319771864	/nfs/dbraw/zinc/77/18/64/1319771864.db2.gz	NCQYKOIHEAVNFJ-GOSISDBHSA-N	0	3	342.483	3.187	20	30		EGEDHN
C#C[C@@H](NC(=O)N(CCC)[C@@H]1CCN(C)C1)c1ccc(Cl)cc1	ZINC000820552384	1319908886	/nfs/dbraw/zinc/90/88/86/1319908886.db2.gz	IXQSWBPODLRSIO-IAGOWNOFSA-N	0	3	333.863	3.140	20	30		EGEDHN
C#C[C@@H](NC(=O)N(CCN(C)C)Cc1ccc(C)o1)c1ccccc1	ZINC000820605304	1319920059	/nfs/dbraw/zinc/92/00/59/1319920059.db2.gz	MGEDAWRBVGCRAR-LJQANCHMSA-N	0	3	339.439	3.036	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCN(C(=O)C[C@H]2C=CCC2)C1	ZINC001023831494	1319975325	/nfs/dbraw/zinc/97/53/25/1319975325.db2.gz	MWXPJIIHANPXFH-ZWKOTPCHSA-N	0	3	337.467	3.243	20	30		EGEDHN
COc1ccc(OC)c([C@H](O)CN(C)[C@@H](C)c2cccc(C#N)c2)c1	ZINC000823617940	1320192820	/nfs/dbraw/zinc/19/28/20/1320192820.db2.gz	NTPVUHHXJVHIFP-IFXJQAMLSA-N	0	3	340.423	3.302	20	30		EGEDHN
COC(=O)C1(C#N)CCN([C@H]2CC[C@](C)(c3ccccc3)C2)CC1	ZINC000824871436	1320293420	/nfs/dbraw/zinc/29/34/20/1320293420.db2.gz	GTNIPEONUWWEOC-HKUYNNGSSA-N	0	3	326.440	3.276	20	30		EGEDHN
Cc1ccc([C@H](C)N[C@@H]2CCN(c3ccc(C#N)cc3)C2=O)s1	ZINC000839551624	1320936654	/nfs/dbraw/zinc/93/66/54/1320936654.db2.gz	DJGAWQVBISUBAZ-XJKSGUPXSA-N	0	3	325.437	3.384	20	30		EGEDHN
CN(CCOC(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1)Cc1ccccc1	ZINC000840607322	1321114339	/nfs/dbraw/zinc/11/43/39/1321114339.db2.gz	WIJFALIYRQTAMD-VQTJNVASSA-N	0	3	334.419	3.337	20	30		EGEDHN
COc1ccc(CN(Cc2cnc3c(C#N)cnn3c2)C(C)(C)C)cc1	ZINC000843409222	1321513356	/nfs/dbraw/zinc/51/33/56/1321513356.db2.gz	GQXYKPNLFXNARW-UHFFFAOYSA-N	0	3	349.438	3.410	20	30		EGEDHN
N#CC[C@]1(O)CCN(Cc2ccc3c(c2)CCN3Cc2ccccc2)C1	ZINC000843425146	1321516375	/nfs/dbraw/zinc/51/63/75/1321516375.db2.gz	FTHAVRPIQLMHGG-QFIPXVFZSA-N	0	3	347.462	3.100	20	30		EGEDHN
CCn1cc(CN(CCCOc2ccc(C#N)cc2)C(C)C)cn1	ZINC000844417757	1321603687	/nfs/dbraw/zinc/60/36/87/1321603687.db2.gz	OGAIWMOIAYVCEJ-UHFFFAOYSA-N	0	3	326.444	3.454	20	30		EGEDHN
C#CCC1(C(=O)N(C)CCCN(C)Cc2ccncc2)CCCCC1	ZINC000846170806	1321773965	/nfs/dbraw/zinc/77/39/65/1321773965.db2.gz	AVWFQLXMTDFWQG-UHFFFAOYSA-N	0	3	341.499	3.336	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cccc(C#Cc3cccs3)c2)CC1	ZINC000918759122	1321993318	/nfs/dbraw/zinc/99/33/18/1321993318.db2.gz	PGWCOHOXJXHLRH-UHFFFAOYSA-N	0	3	348.471	3.432	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CNC[C@@H]1CC(=O)N(C(C)(C)C)C1	ZINC000850396738	1322237631	/nfs/dbraw/zinc/23/76/31/1322237631.db2.gz	ONIBNOKZUGCRTN-AWEZNQCLSA-N	0	3	348.874	3.089	20	30		EGEDHN
CC[C@H](C)[C@](C)(O)CNCc1cc(C#N)ccc1Br	ZINC000921732527	1322386377	/nfs/dbraw/zinc/38/63/77/1322386377.db2.gz	LCHHSYLOXUDJHV-XHDPSFHLSA-N	0	3	325.250	3.207	20	30		EGEDHN
CC(C(=O)N1CCC[C@H](CNCc2ccccc2C#N)C1)=C1CCC1	ZINC001023983510	1323064075	/nfs/dbraw/zinc/06/40/75/1323064075.db2.gz	SSJKCYCGJKOCLV-QGZVFWFLSA-N	0	3	337.467	3.387	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC[C@@H](CNCc2cnc(C)o2)C1	ZINC001024002529	1323074177	/nfs/dbraw/zinc/07/41/77/1323074177.db2.gz	DXJMYCJWDAFJMM-AWEZNQCLSA-N	0	3	339.867	3.090	20	30		EGEDHN
C=C(C)CN(CCn1cnc(Br)n1)Cc1ccccc1	ZINC000851997431	1323128241	/nfs/dbraw/zinc/12/82/41/1323128241.db2.gz	KHTDOERWRALBEX-UHFFFAOYSA-N	0	3	335.249	3.119	20	30		EGEDHN
C#C[C@](C)(CC)NCC(=O)N[C@@H](c1cccs1)c1ccc(F)cc1	ZINC000852097115	1323145932	/nfs/dbraw/zinc/14/59/32/1323145932.db2.gz	LSFBJFIOSJFVSJ-RTBURBONSA-N	0	3	344.455	3.484	20	30		EGEDHN
C#C[C@@](C)(CC)NCc1cc(=O)oc2cc(NC(=O)OCC)ccc12	ZINC000852101164	1323147811	/nfs/dbraw/zinc/14/78/11/1323147811.db2.gz	NIQZYIBTPSXCOW-IBGZPJMESA-N	0	3	342.395	3.253	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H](CNCc2ncc(C)s2)C1	ZINC001024137920	1323162508	/nfs/dbraw/zinc/16/25/08/1323162508.db2.gz	VXORISZRNIFSCR-QAPCUYQASA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H](CNCc3cc(C4CC4)no3)C2)C1	ZINC001024146138	1323171778	/nfs/dbraw/zinc/17/17/78/1323171778.db2.gz	NXJQTUJWCJMNQM-OAHLLOKOSA-N	0	3	343.471	3.237	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cn(C)c2ccc(F)cc12	ZINC001024479203	1323432570	/nfs/dbraw/zinc/43/25/70/1323432570.db2.gz	BUKXITIVVYAAAI-INIZCTEOSA-N	0	3	343.446	3.478	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccccc1-c1ccncc1	ZINC001024508224	1323456418	/nfs/dbraw/zinc/45/64/18/1323456418.db2.gz	HLTBLLPRFNRKSZ-LJQANCHMSA-N	0	3	347.462	3.356	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@H]1Cc2cc(Cl)ccc2O1	ZINC001024537544	1323478778	/nfs/dbraw/zinc/47/87/78/1323478778.db2.gz	HEBLOLGGFDYIGN-SJLPKXTDSA-N	0	3	348.874	3.190	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccc2[nH]nc(C)c2c1	ZINC001024548714	1323489858	/nfs/dbraw/zinc/48/98/58/1323489858.db2.gz	DXZXGSMRNBUNHN-INIZCTEOSA-N	0	3	326.444	3.032	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cc(C)nc2onc(C)c21	ZINC001024577648	1323513929	/nfs/dbraw/zinc/51/39/29/1323513929.db2.gz	FLPINFKAWMWIDZ-HNNXBMFYSA-N	0	3	342.443	3.000	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cncc(OC(C)C)c1	ZINC001024596022	1323527355	/nfs/dbraw/zinc/52/73/55/1323527355.db2.gz	NNPAPFZXSHZJEE-QGZVFWFLSA-N	0	3	331.460	3.029	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cn(C)nc1C1CCCC1	ZINC001024644946	1323570126	/nfs/dbraw/zinc/57/01/26/1323570126.db2.gz	CCJGNHANUKPMJN-QGZVFWFLSA-N	0	3	344.503	3.238	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1c(F)ccc(F)c1Cl	ZINC001024672892	1323585821	/nfs/dbraw/zinc/58/58/21/1323585821.db2.gz	GATKGMOPIXUTGP-LBPRGKRZSA-N	0	3	340.801	3.226	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1c[nH]c(=O)c2ccccc12	ZINC001024689334	1323603859	/nfs/dbraw/zinc/60/38/59/1323603859.db2.gz	DATUFSJNWCWTLV-HNNXBMFYSA-N	0	3	339.439	3.101	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@H]1CCc2cccc(OC)c21	ZINC001024696323	1323613054	/nfs/dbraw/zinc/61/30/54/1323613054.db2.gz	GHEQGYVLHKEFER-MSOLQXFVSA-N	0	3	342.483	3.272	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1ccc(C)s1	ZINC001024700571	1323614260	/nfs/dbraw/zinc/61/42/60/1323614260.db2.gz	CCGCHKVELPOGDC-BRWVUGGUSA-N	0	3	330.497	3.154	20	30		EGEDHN
C=CCCN1CCCC[C@@H]1CNC(=O)c1occc1Br	ZINC001024712621	1323619732	/nfs/dbraw/zinc/61/97/32/1323619732.db2.gz	CIOQMCZQSNGHKR-GFCCVEGCSA-N	0	3	341.249	3.203	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1c(C)nn(CCC)c1C	ZINC001024746605	1323646310	/nfs/dbraw/zinc/64/63/10/1323646310.db2.gz	GUCFOUFQYHRFKA-QGZVFWFLSA-N	0	3	332.492	3.070	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cc2c(C)cccn2c1	ZINC001024755973	1323656155	/nfs/dbraw/zinc/65/61/55/1323656155.db2.gz	LOQYTAKISCIWKM-SFHVURJKSA-N	0	3	325.456	3.408	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccc(OC)c(OCC)c1	ZINC001024790520	1323695640	/nfs/dbraw/zinc/69/56/40/1323695640.db2.gz	KKWXOSQNSMZBAE-QGZVFWFLSA-N	0	3	346.471	3.254	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccc(OC2CCC2)cc1	ZINC001024811812	1323713290	/nfs/dbraw/zinc/71/32/90/1323713290.db2.gz	ZXAMLYPROMFTCY-GOSISDBHSA-N	0	3	340.467	3.226	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccc(N(C)C(C)C)cc1	ZINC001024824591	1323728234	/nfs/dbraw/zinc/72/82/34/1323728234.db2.gz	RBQHRAIZAGLOKF-HXUWFJFHSA-N	0	3	341.499	3.139	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)/C=C/C2CC2)cc1F	ZINC001024910504	1323776889	/nfs/dbraw/zinc/77/68/89/1323776889.db2.gz	RGRQUJINFFDUDQ-PDFOZTTASA-N	0	3	341.430	3.134	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001024932931	1323790050	/nfs/dbraw/zinc/79/00/50/1323790050.db2.gz	IKFASMJMCQJFKT-SJORKVTESA-N	0	3	343.446	3.214	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cccc(F)c1	ZINC001025195986	1323976864	/nfs/dbraw/zinc/97/68/64/1323976864.db2.gz	PHTAODFGSDIYML-RTBURBONSA-N	0	3	328.431	3.308	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccoc1Cl	ZINC001025224000	1324011553	/nfs/dbraw/zinc/01/15/53/1324011553.db2.gz	KEVVVVPACLVSIF-JKSUJKDBSA-N	0	3	334.847	3.415	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cccc(F)c1C	ZINC001025235035	1324023067	/nfs/dbraw/zinc/02/30/67/1324023067.db2.gz	MRQWOKUVGHCDNO-MOPGFXCFSA-N	0	3	328.431	3.226	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCCC[C@H]1[C@H]1CCCN1CC#CC	ZINC001025240254	1324033960	/nfs/dbraw/zinc/03/39/60/1324033960.db2.gz	MRAZUEWADYRUFA-MOPGFXCFSA-N	0	3	339.483	3.157	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(C)n(CC)c1C	ZINC001025247741	1324047845	/nfs/dbraw/zinc/04/78/45/1324047845.db2.gz	PNEOCXGYYXBBGW-VQTJNVASSA-N	0	3	341.499	3.217	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(Cl)cn1C	ZINC001025250227	1324050899	/nfs/dbraw/zinc/05/08/99/1324050899.db2.gz	IICFZPBOEURYEV-SJORKVTESA-N	0	3	347.890	3.161	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1nc(C)c(C)nc1C	ZINC001025251089	1324054385	/nfs/dbraw/zinc/05/43/85/1324054385.db2.gz	PWORHNJEQLUSTE-QZTJIDSGSA-N	0	3	342.487	3.047	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1c(C)cc(C)nc1C	ZINC001025253862	1324060156	/nfs/dbraw/zinc/06/01/56/1324060156.db2.gz	XMQAPDUDJQUULN-OALUTQOASA-N	0	3	339.483	3.099	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1occ2c1CCC2	ZINC001025255943	1324062563	/nfs/dbraw/zinc/06/25/63/1324062563.db2.gz	UBUYRYQULFTJRN-MOPGFXCFSA-N	0	3	340.467	3.251	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCCC[C@H]2[C@H]2CCCN2CC#CC)cc1	ZINC001025257920	1324066517	/nfs/dbraw/zinc/06/65/17/1324066517.db2.gz	GXAMKOIPXDYHMC-RTWAWAEBSA-N	0	3	334.463	3.150	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccn(CC)c1C	ZINC001025263598	1324075249	/nfs/dbraw/zinc/07/52/49/1324075249.db2.gz	OMUPIZQLAAWCOZ-VQTJNVASSA-N	0	3	341.499	3.299	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc(C(C)C)cn1	ZINC001025269451	1324082206	/nfs/dbraw/zinc/08/22/06/1324082206.db2.gz	QIRSNOJUJMICFJ-UXHICEINSA-N	0	3	339.483	3.297	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc2cccnc2c1	ZINC001025278770	1324100612	/nfs/dbraw/zinc/10/06/12/1324100612.db2.gz	VGJNDMCIEPNMCF-SFTDATJTSA-N	0	3	347.462	3.327	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)C1(CC)CCOCC1	ZINC001025281350	1324103116	/nfs/dbraw/zinc/10/31/16/1324103116.db2.gz	TXJDKPPOYOHBSX-RBUKOAKNSA-N	0	3	346.515	3.062	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)C(C1CC1)C1CC1	ZINC001025287528	1324110158	/nfs/dbraw/zinc/11/01/58/1324110158.db2.gz	ONOKEVUPPUQJEG-RBUKOAKNSA-N	0	3	328.500	3.291	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccccc1Cl	ZINC001025291945	1324115744	/nfs/dbraw/zinc/11/57/44/1324115744.db2.gz	DCQFZDZCFLOHAG-ROUUACIJSA-N	0	3	330.859	3.432	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(Cl)cn1CC	ZINC001025297523	1324129177	/nfs/dbraw/zinc/12/91/77/1324129177.db2.gz	YFVAGOQJFXGRTF-IAGOWNOFSA-N	0	3	347.890	3.254	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc2ccccc2[nH]1	ZINC001025297421	1324129361	/nfs/dbraw/zinc/12/93/61/1324129361.db2.gz	PUWIDQROESDNSZ-VQTJNVASSA-N	0	3	335.451	3.260	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)CCc1ccc(C)o1	ZINC001025301401	1324134473	/nfs/dbraw/zinc/13/44/73/1324134473.db2.gz	JCUVLJCEPPSBHV-UXHICEINSA-N	0	3	342.483	3.389	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(CC(C)C)s2)C1	ZINC001025441684	1324281808	/nfs/dbraw/zinc/28/18/08/1324281808.db2.gz	GVXRWRUDZXBYQD-HOTGVXAUSA-N	0	3	332.513	3.410	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2[nH]c3ccccc3c2Cl)C1	ZINC001025469489	1324315526	/nfs/dbraw/zinc/31/55/26/1324315526.db2.gz	PVHLSRGHCFFZQQ-UONOGXRCSA-N	0	3	343.858	3.285	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(Cl)cc2F)C1	ZINC001025478339	1324323854	/nfs/dbraw/zinc/32/38/54/1324323854.db2.gz	LWCJFOVEAHOABZ-ZIAGYGMSSA-N	0	3	336.838	3.333	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(C)c(Cl)cc2C)C1	ZINC001025500590	1324349018	/nfs/dbraw/zinc/34/90/18/1324349018.db2.gz	UVDXDLCMBUWIFJ-CVEARBPZSA-N	0	3	332.875	3.420	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc3c(ccc(C)c3C)[nH]2)C1	ZINC001025506116	1324354852	/nfs/dbraw/zinc/35/48/52/1324354852.db2.gz	OQPGOAFCXWQYMX-IRXDYDNUSA-N	0	3	337.467	3.248	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccccc2OC2CCC2)C1	ZINC001025532221	1324377416	/nfs/dbraw/zinc/37/74/16/1324377416.db2.gz	WLUDACPDTKBNEH-SJORKVTESA-N	0	3	340.467	3.081	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(C)c(OCC)c2)C1	ZINC001025548424	1324396201	/nfs/dbraw/zinc/39/62/01/1324396201.db2.gz	ISJRBEGIVLPRIE-HKUYNNGSSA-N	0	3	342.483	3.247	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(C)c(OCC)c2)C1	ZINC001025548426	1324396819	/nfs/dbraw/zinc/39/68/19/1324396819.db2.gz	ISJRBEGIVLPRIE-MJGOQNOKSA-N	0	3	342.483	3.247	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cccc3c2ccn3C)C1	ZINC001025560114	1324407440	/nfs/dbraw/zinc/40/74/40/1324407440.db2.gz	ANXGQDYIRNUWDF-IAGOWNOFSA-N	0	3	337.467	3.032	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cccc(F)c2OCC)C1	ZINC001025577585	1324417340	/nfs/dbraw/zinc/41/73/40/1324417340.db2.gz	CYEFQKQMMCASSA-HOTGVXAUSA-N	0	3	346.446	3.078	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2[nH]c3ccc(C)cc3c2C)C1	ZINC001025583452	1324424719	/nfs/dbraw/zinc/42/47/19/1324424719.db2.gz	ZNAQQZJLPJXNEM-IAGOWNOFSA-N	0	3	337.467	3.248	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cccc3ccncc32)C1	ZINC001025583116	1324425095	/nfs/dbraw/zinc/42/50/95/1324425095.db2.gz	XVSJAWLPALCPLJ-FUHWJXTLSA-N	0	3	335.451	3.088	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cnn(C(CC)CC)c2C)C1	ZINC001025590626	1324436246	/nfs/dbraw/zinc/43/62/46/1324436246.db2.gz	PDPACGSMALCAEL-WBVHZDCISA-N	0	3	344.503	3.016	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2occ3c2CCCC3)C1	ZINC001025602569	1324450121	/nfs/dbraw/zinc/45/01/21/1324450121.db2.gz	IMRQUISPBRAPKG-JKSUJKDBSA-N	0	3	328.456	3.012	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(-c3cccs3)o2)C1	ZINC001025607152	1324456618	/nfs/dbraw/zinc/45/66/18/1324456618.db2.gz	SGNNXJYEOIEVSY-LSDHHAIUSA-N	0	3	342.464	3.472	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(Cl)c(Cl)c2)C1	ZINC001025607912	1324458945	/nfs/dbraw/zinc/45/89/45/1324458945.db2.gz	JFDAWZUQDOWGCG-JSGCOSHPSA-N	0	3	339.266	3.457	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(C)nc3ccccc32)C1	ZINC001025613672	1324465380	/nfs/dbraw/zinc/46/53/80/1324465380.db2.gz	YZISIBVXGXTAPS-DLBZAZTESA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2csc3c2CCCC3)C1	ZINC001025613732	1324465559	/nfs/dbraw/zinc/46/55/59/1324465559.db2.gz	ZUFWIDAQCKELKP-CVEARBPZSA-N	0	3	344.524	3.481	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cnc(C(C)C)s2)C1	ZINC001025637351	1324488937	/nfs/dbraw/zinc/48/89/37/1324488937.db2.gz	SGIGZHJDJQPCBH-CABCVRRESA-N	0	3	333.501	3.120	20	30		EGEDHN
Cc1cc(C(=O)N2C[C@@H]3CC[C@@H](NCc4ccccc4C#N)[C@H]3C2)co1	ZINC001026249814	1324685560	/nfs/dbraw/zinc/68/55/60/1324685560.db2.gz	HFODHAHBHNMGET-YSIASYRMSA-N	0	3	349.434	3.100	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H]2CC[C@@H](NCc3cscn3)[C@@H]2C1	ZINC001026331890	1324731970	/nfs/dbraw/zinc/73/19/70/1324731970.db2.gz	ZKVPLZNXAJHPOA-NUEKZKHPSA-N	0	3	333.501	3.072	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC1CCC(NC(=O)c2ccco2)CC1	ZINC001026443756	1324805137	/nfs/dbraw/zinc/80/51/37/1324805137.db2.gz	NYKJDQIVJUMKHJ-UHFFFAOYSA-N	0	3	341.386	3.121	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)c2ccsc2)CC1	ZINC001026448280	1324812353	/nfs/dbraw/zinc/81/23/53/1324812353.db2.gz	SBDCGOIOAKMAKB-UHFFFAOYSA-N	0	3	343.290	3.287	20	30		EGEDHN
Cc1cccc(C(=O)NC2CCC(NCc3ccccc3C#N)CC2)n1	ZINC001026455333	1324818453	/nfs/dbraw/zinc/81/84/53/1324818453.db2.gz	XKJRWAPZMRSPCJ-UHFFFAOYSA-N	0	3	348.450	3.093	20	30		EGEDHN
N#Cc1ccccc1CNC1CCC(NC(=O)[C@]23C[C@H]2CCC3)CC1	ZINC001026530753	1324870521	/nfs/dbraw/zinc/87/05/21/1324870521.db2.gz	FOIAHKNNPRTICU-YXUAKONQSA-N	0	3	337.467	3.265	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)[C@]2(C)C=CCC2)CC1	ZINC001026542618	1324880093	/nfs/dbraw/zinc/88/00/93/1324880093.db2.gz	SXJZKBGPPFRKGE-ZBCRRDGASA-N	0	3	341.293	3.268	20	30		EGEDHN
C=C1CCC(C(=O)NC2CCC(NCc3nccnc3C)CC2)CC1	ZINC001026554121	1324890215	/nfs/dbraw/zinc/89/02/15/1324890215.db2.gz	JMXUSJBTXCPGEG-UHFFFAOYSA-N	0	3	342.487	3.048	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC[C@@H](CNCc2cc(Cl)sc2Cl)C1	ZINC001026732524	1324995809	/nfs/dbraw/zinc/99/58/09/1324995809.db2.gz	KDMRRWFMHVTOGD-UWVGGRQHSA-N	0	3	346.283	3.153	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)c2[nH]ccc2C)C1	ZINC000963293266	1325080159	/nfs/dbraw/zinc/08/01/59/1325080159.db2.gz	LJBXRPQSMPOYOX-JKSUJKDBSA-N	0	3	335.879	3.392	20	30		EGEDHN
Cc1ccc(NN=Cc2c(Cl)nc(N)nc2N2CCCC2)cc1F	ZINC000853438940	1325091716	/nfs/dbraw/zinc/09/17/16/1325091716.db2.gz	UVTGSEZIZCQASO-UHFFFAOYSA-N	0	3	348.813	3.206	20	30		EGEDHN
CC(C)(C)[C@@H]1C[C@H]1C(=O)N1CC[C@H](CNCc2ccccc2C#N)C1	ZINC001026953197	1325102411	/nfs/dbraw/zinc/10/24/11/1325102411.db2.gz	ZSUDMIZVXKSADD-ATZDWAIDSA-N	0	3	339.483	3.179	20	30		EGEDHN
CC(C)(C(=O)N1CC[C@H](CNCc2cc(F)ccc2C#N)C1)C1CC1	ZINC001027010758	1325151533	/nfs/dbraw/zinc/15/15/33/1325151533.db2.gz	BLCKNHZLMUJGPX-CQSZACIVSA-N	0	3	343.446	3.072	20	30		EGEDHN
CCc1ccccc1C(=O)N1CC[C@H](CNCc2ccccc2C#N)C1	ZINC001027026624	1325162199	/nfs/dbraw/zinc/16/21/99/1325162199.db2.gz	ZMWFPQXKWTVWAQ-QGZVFWFLSA-N	0	3	347.462	3.373	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001027038785	1325173120	/nfs/dbraw/zinc/17/31/20/1325173120.db2.gz	QUMZNCBLYVBDCS-QRWLVFNGSA-N	0	3	343.446	3.238	20	30		EGEDHN
C[C@H](CC(C)(C)C#N)N[C@@H]1CCN(CCCc2ccccc2)C1=O	ZINC000925499044	1325179483	/nfs/dbraw/zinc/17/94/83/1325179483.db2.gz	LYAHVXGCLKADQB-SJLPKXTDSA-N	0	3	327.472	3.138	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](CNCc3cc(O)ccc3Cl)C2)C1	ZINC001027050667	1325188805	/nfs/dbraw/zinc/18/88/05/1325188805.db2.gz	HWQPCQIECWSEQE-CQSZACIVSA-N	0	3	348.874	3.340	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@H](CNCc2ccccc2C#N)C1)C1CCCC1	ZINC001027163691	1325265196	/nfs/dbraw/zinc/26/51/96/1325265196.db2.gz	IDPXDTFLOQTHHD-IAGOWNOFSA-N	0	3	339.483	3.323	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)C2CCCC2)C1	ZINC001027268714	1325370048	/nfs/dbraw/zinc/37/00/48/1325370048.db2.gz	VXBOYGQMEOOXNB-LJQANCHMSA-N	0	3	325.456	3.171	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)cc2)C1)C1CC1	ZINC001027352535	1325522565	/nfs/dbraw/zinc/52/25/65/1325522565.db2.gz	XACPVAKFVBJAOH-DNVCBOLYSA-N	0	3	325.456	3.027	20	30		EGEDHN
CN(Cc1ccc(C#N)c(F)c1)[C@H]1CCCN(C(=O)C=C2CCC2)C1	ZINC001027363592	1325552072	/nfs/dbraw/zinc/55/20/72/1325552072.db2.gz	KCMHGSJSRIKMIS-SFHVURJKSA-N	0	3	341.430	3.230	20	30		EGEDHN
CCO[C@H](C(=O)C(C#N)C(=O)Nc1c(CC)cccc1CC)C1CC1	ZINC000860470123	1329321586	/nfs/dbraw/zinc/32/15/86/1329321586.db2.gz	NKEGYQNGUAOTBN-APWZRJJASA-N	0	3	342.439	3.274	20	30		EGEDHN
CCO[C@H](C(=O)C(C#N)C(=O)Nc1c(CC)cccc1CC)C1CC1	ZINC000860470124	1329321590	/nfs/dbraw/zinc/32/15/90/1329321590.db2.gz	NKEGYQNGUAOTBN-LPHOPBHVSA-N	0	3	342.439	3.274	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)c2cc3cccc(C)c3s2)C1	ZINC001027472157	1327729095	/nfs/dbraw/zinc/72/90/95/1327729095.db2.gz	ZQKFYTHQEYHCNI-INIZCTEOSA-N	0	3	326.465	3.379	20	30		EGEDHN
C=C1CCC(C(=O)NC2CC3(CC(NCc4ocnc4C)C3)C2)CC1	ZINC000964881268	1327746826	/nfs/dbraw/zinc/74/68/26/1327746826.db2.gz	OUFHLIYTYMIBCA-UHFFFAOYSA-N	0	3	343.471	3.246	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC[C@H](N(C)Cc3ccsc3)C2)cc1	ZINC001027516358	1327788761	/nfs/dbraw/zinc/78/87/61/1327788761.db2.gz	DCCWVGMFLOVMEB-IBGZPJMESA-N	0	3	338.476	3.466	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@H](N(C)Cc3ccc(C#N)c(F)c3)C2)CC1	ZINC001027561744	1327880896	/nfs/dbraw/zinc/88/08/96/1327880896.db2.gz	AJQSPOIPPPMBOS-KRWDZBQOSA-N	0	3	343.446	3.310	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)c2cc(CC)c(CCC)s2)C1	ZINC001027675519	1328072990	/nfs/dbraw/zinc/07/29/90/1328072990.db2.gz	FDJNDAVUOADABB-INIZCTEOSA-N	0	3	332.513	3.433	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1c(F)cccc1F)C2	ZINC000965882382	1328073285	/nfs/dbraw/zinc/07/32/85/1328073285.db2.gz	KUEYPJSQGFEIRS-UHFFFAOYSA-N	0	3	340.801	3.348	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](C)[C@@H](NC(=O)c2sc3nccn3c2C)C1	ZINC000966817155	1328425963	/nfs/dbraw/zinc/42/59/63/1328425963.db2.gz	WKCQZPAPQAYXKZ-HIFRSBDPSA-N	0	3	346.500	3.111	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1coc2ccc(OC)cc12	ZINC001028016211	1328478464	/nfs/dbraw/zinc/47/84/64/1328478464.db2.gz	FDDRGLHLGHQKDW-CQSZACIVSA-N	0	3	328.412	3.212	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1cnc2c(F)cccc2c1	ZINC001028028798	1328492787	/nfs/dbraw/zinc/49/27/87/1328492787.db2.gz	JKBFJWGMMONLBY-MRXNPFEDSA-N	0	3	327.403	3.144	20	30		EGEDHN
COc1ccc(NC2CCN(CCC(F)(F)F)CC2)cc1C#N	ZINC000865859752	1329746215	/nfs/dbraw/zinc/74/62/15/1329746215.db2.gz	PWQZJABUVASBKP-UHFFFAOYSA-N	0	3	327.350	3.396	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1)C(=O)Nc1sccc1C#N	ZINC000931844766	1329765895	/nfs/dbraw/zinc/76/58/95/1329765895.db2.gz	BYFPEHFJRXLZKD-UHFFFAOYSA-N	0	3	328.441	3.215	20	30		EGEDHN
C=CCN1CCC(NC(=O)C[C@H](C)Cc2cccc(OC)c2)CC1	ZINC000932141445	1329788370	/nfs/dbraw/zinc/78/83/70/1329788370.db2.gz	ZTQHAHALLIZRPX-MRXNPFEDSA-N	0	3	330.472	3.031	20	30		EGEDHN
CC(C)N1CCC[C@H]1C(=O)NCC#Cc1ccc(C(F)(F)F)cc1	ZINC000934063245	1329943332	/nfs/dbraw/zinc/94/33/32/1329943332.db2.gz	DDCXPTTYSDDOCN-INIZCTEOSA-N	0	3	338.373	3.046	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H](C)[C@H](NCc3ccc(Cl)nc3)C2)CC1	ZINC000939051352	1330365276	/nfs/dbraw/zinc/36/52/76/1330365276.db2.gz	YZEARMPHEGOUGP-RHSMWYFYSA-N	0	3	347.890	3.418	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N[C@H]1CCN(Cc2cccc(C#N)c2)CC1(C)C	ZINC000940665768	1331149297	/nfs/dbraw/zinc/14/92/97/1331149297.db2.gz	YYVXYUMULGIISD-MSOLQXFVSA-N	0	3	339.483	3.321	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2coc3ccc(C)cc23)[C@@H](C)C1	ZINC000942093252	1331826796	/nfs/dbraw/zinc/82/67/96/1331826796.db2.gz	ZCWPQWHTWHQVFF-LPHOPBHVSA-N	0	3	338.451	3.134	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)[C@H]2CC[C@H](C3CCC3)CC2)[C@@H](C)C1	ZINC000942145277	1331846996	/nfs/dbraw/zinc/84/69/96/1331846996.db2.gz	YFCQNHIKLAFMGL-FRYIKTPZSA-N	0	3	330.516	3.443	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(C(C)(C)CC)cc2)[C@@H](C)C1	ZINC000942163424	1331854636	/nfs/dbraw/zinc/85/46/36/1331854636.db2.gz	KLTRJFAOKOHFND-LPHOPBHVSA-N	0	3	326.484	3.448	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2cccc(C(C)C)c2)[C@H](C)C1	ZINC000942270870	1331892651	/nfs/dbraw/zinc/89/26/51/1331892651.db2.gz	GRBNLZUDYXTZGJ-YLJYHZDGSA-N	0	3	326.484	3.202	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@H](C)C(CC)CC)C1	ZINC001194316236	1368229897	/nfs/dbraw/zinc/22/98/97/1368229897.db2.gz	SAIFUOHFQUONJA-KBAYOESNSA-N	0	3	326.525	3.190	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cccc(C(F)F)c2)[C@@H](C)C1	ZINC000942467137	1331941568	/nfs/dbraw/zinc/94/15/68/1331941568.db2.gz	NYFSHHXCRUHGFM-YOEHRIQHSA-N	0	3	334.410	3.017	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3cscc3s2)[C@H](C)C1	ZINC000942521592	1331953090	/nfs/dbraw/zinc/95/30/90/1331953090.db2.gz	WXVHWEKKQOSHQY-TZMCWYRMSA-N	0	3	332.494	3.426	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3cscc3s2)[C@H](C)C1	ZINC000942521591	1331953107	/nfs/dbraw/zinc/95/31/07/1331953107.db2.gz	WXVHWEKKQOSHQY-OCCSQVGLSA-N	0	3	332.494	3.426	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cnc3ccccc3c2C)[C@@H](C)C1	ZINC000942523373	1331953983	/nfs/dbraw/zinc/95/39/83/1331953983.db2.gz	PIWGMIXFBNXLHC-KXBFYZLASA-N	0	3	335.451	3.007	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2oc3ccccc3c2OC)[C@@H](C)C1	ZINC000942546860	1331968654	/nfs/dbraw/zinc/96/86/54/1331968654.db2.gz	BKWUGLYHKXDGIW-DZGCQCFKSA-N	0	3	328.412	3.068	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2nsc3ccc(C)cc32)[C@@H](C)C1	ZINC000942563441	1331977485	/nfs/dbraw/zinc/97/74/85/1331977485.db2.gz	XRQNPKPMSFDHEA-ZFWWWQNUSA-N	0	3	329.469	3.231	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2csc(-c3ccco3)n2)[C@H](C)C1	ZINC000942584338	1331990286	/nfs/dbraw/zinc/99/02/86/1331990286.db2.gz	WDORGRRSSOFXOE-OLZOCXBDSA-N	0	3	331.441	3.029	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCN(CCc3ccns3)C[C@H]2C)CC1	ZINC000942599986	1331997553	/nfs/dbraw/zinc/99/75/53/1331997553.db2.gz	IOXKVFYEBILTLP-CRAIPNDOSA-N	0	3	347.528	3.259	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C(C)(C)C)oc2C)[C@H](C)C1	ZINC000943029853	1332084584	/nfs/dbraw/zinc/08/45/84/1332084584.db2.gz	UKSABSCGRJNLBK-PBHICJAKSA-N	0	3	330.472	3.349	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C(C)(C)c2cccc(Cl)c2)[C@@H](C)C1	ZINC000943209588	1332121943	/nfs/dbraw/zinc/12/19/43/1332121943.db2.gz	RDHJZGFXZJCNMT-MAUKXSAKSA-N	0	3	346.902	3.468	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2csc(-c3ccoc3)n2)[C@@H](C)C1	ZINC000943688541	1332238781	/nfs/dbraw/zinc/23/87/81/1332238781.db2.gz	DZNQKVCQIFLWKH-JSGCOSHPSA-N	0	3	331.441	3.029	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(-c3ccccc3)nc2)[C@H](C)C1	ZINC000943757028	1332255413	/nfs/dbraw/zinc/25/54/13/1332255413.db2.gz	ZDAGKEGSQBUKFV-YLJYHZDGSA-N	0	3	347.462	3.212	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(Cl)ccc2Cl)[C@H](C)C1	ZINC000944305250	1332368175	/nfs/dbraw/zinc/36/81/75/1332368175.db2.gz	LRPUTMDOKRJHRT-WBMJQRKESA-N	0	3	339.266	3.457	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(Cl)cc(Cl)c2)[C@H](C)C1	ZINC000944318374	1332372893	/nfs/dbraw/zinc/37/28/93/1332372893.db2.gz	PGXLZJCUKUTHNO-MLGOLLRUSA-N	0	3	339.266	3.457	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2sccc2C(F)F)[C@@H](C)C1	ZINC000944530950	1332414244	/nfs/dbraw/zinc/41/42/44/1332414244.db2.gz	HPZCQQYHBZBWGP-AAEUAGOBSA-N	0	3	326.412	3.149	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3cccc(F)c3o2)[C@H](C)C1	ZINC000945061992	1332491156	/nfs/dbraw/zinc/49/11/56/1332491156.db2.gz	KPSLONGXBKQTKC-CJNGLKHVSA-N	0	3	328.387	3.035	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2sc(C(C)(C)C)nc2C)[C@@H](C)C1	ZINC000945809949	1332678888	/nfs/dbraw/zinc/67/88/88/1332678888.db2.gz	WIQSLWHXRRCYCS-ZFWWWQNUSA-N	0	3	347.528	3.213	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@H]3CCC[C@H](F)C3)CC[C@@H]2C1	ZINC000946590907	1332858907	/nfs/dbraw/zinc/85/89/07/1332858907.db2.gz	KXYIDIAUOLGRCL-NXOAAHMSSA-N	0	3	342.886	3.438	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@@H]3CC[C@@H]4C[C@@H]4C3)CC[C@@H]2C1	ZINC000946652093	1332870980	/nfs/dbraw/zinc/87/09/80/1332870980.db2.gz	LSWWOVRKPCVVOK-HSFUPAIVSA-N	0	3	336.907	3.346	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@@H]3CC[C@H](F)C3)CC[C@@H]2C1	ZINC000946740117	1332888624	/nfs/dbraw/zinc/88/86/24/1332888624.db2.gz	PYKQYWINCMKJJF-WCVJEAGWSA-N	0	3	328.859	3.048	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@@]34C[C@@H]3CCCC4)CC[C@@H]2C1	ZINC000946770012	1332896727	/nfs/dbraw/zinc/89/67/27/1332896727.db2.gz	GSPFDXNBXWXRTG-ZMMAXQRCSA-N	0	3	336.907	3.490	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3cc(C4CC4)no3)CC[C@@H]2C1	ZINC000946800890	1332902331	/nfs/dbraw/zinc/90/23/31/1332902331.db2.gz	PZFWASUTLGVCTH-GASCZTMLSA-N	0	3	349.862	3.089	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H]2CCN(Cc3cccc(C#N)c3)[C@@H](C)C2)o1	ZINC000947027730	1332981074	/nfs/dbraw/zinc/98/10/74/1332981074.db2.gz	UMCVKRBDSCZKRL-KBXCAEBGSA-N	0	3	337.423	3.243	20	30		EGEDHN
Cc1occc1C(=O)N[C@@H]1CCN(Cc2cccc(C#N)c2)[C@H](C)C1	ZINC000947032424	1332982909	/nfs/dbraw/zinc/98/29/09/1332982909.db2.gz	OHOAAWUGXBHECL-RDTXWAMCSA-N	0	3	337.423	3.243	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2ccccc2O)CCN1Cc1cccc(C#N)c1	ZINC000947046081	1332987787	/nfs/dbraw/zinc/98/77/87/1332987787.db2.gz	VZDWRVFOBNIWRP-QAPCUYQASA-N	0	3	349.434	3.047	20	30		EGEDHN
Cc1ccoc1C(=O)N[C@H]1CCN(Cc2ccc(C#N)cc2)[C@@H](C)C1	ZINC000947058350	1332995875	/nfs/dbraw/zinc/99/58/75/1332995875.db2.gz	YHHUQOAWMLYYIG-YJBOKZPZSA-N	0	3	337.423	3.243	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2cc(C#N)c[nH]2)CCN1C/C=C\c1ccccc1	ZINC000947173870	1333036874	/nfs/dbraw/zinc/03/68/74/1333036874.db2.gz	AUPXDFXFDZAFNF-BXOXOBTFSA-N	0	3	348.450	3.182	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2coc3cc(F)ccc23)C[C@H]1C	ZINC000947293023	1333079277	/nfs/dbraw/zinc/07/92/77/1333079277.db2.gz	ZEVQKHNUAZENQS-PBHICJAKSA-N	0	3	342.414	3.107	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccn(C3CCCCC3)n2)C[C@@H]1C	ZINC000947314139	1333085476	/nfs/dbraw/zinc/08/54/76/1333085476.db2.gz	FNHSTRMPZYLBAZ-HOTGVXAUSA-N	0	3	330.476	3.157	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cscc2C(F)F)C[C@H]1C	ZINC000947318191	1333086682	/nfs/dbraw/zinc/08/66/82/1333086682.db2.gz	FKFOONKSTSDJEJ-NEPJUHHUSA-N	0	3	326.412	3.292	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2CCc3ccccc3CC2)C[C@H]1C	ZINC000947474733	1333142019	/nfs/dbraw/zinc/14/20/19/1333142019.db2.gz	YLQOIECNFHSJIL-DYESRHJHSA-N	0	3	338.495	3.174	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2[nH]c3ccccc3c2Cl)C[C@H]1C	ZINC000947479297	1333143808	/nfs/dbraw/zinc/14/38/08/1333143808.db2.gz	LXYNZAJRLOZJCG-OLZOCXBDSA-N	0	3	329.831	3.037	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2csc(C(F)(F)F)c2)C[C@H]1C	ZINC000947497542	1333147330	/nfs/dbraw/zinc/14/73/30/1333147330.db2.gz	JHBXCDNZHGLQLU-DGCLKSJQSA-N	0	3	344.402	3.373	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cccc(C)c2Cl)C[C@@H]1C	ZINC000947540914	1333164922	/nfs/dbraw/zinc/16/49/22/1333164922.db2.gz	ZZTINACRSTXQLQ-RDJZCZTQSA-N	0	3	332.875	3.183	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cccc(C)c2Cl)C[C@H]1C	ZINC000947540915	1333165148	/nfs/dbraw/zinc/16/51/48/1333165148.db2.gz	ZZTINACRSTXQLQ-WBVHZDCISA-N	0	3	332.875	3.183	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3cccc(OC)c3o2)C[C@H]1C	ZINC000947668575	1333216686	/nfs/dbraw/zinc/21/66/86/1333216686.db2.gz	YDCCGOSISJIPKO-GDBMZVCRSA-N	0	3	340.423	3.047	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccccc2OCC(C)C)C[C@H]1C	ZINC000947821227	1333271016	/nfs/dbraw/zinc/27/10/16/1333271016.db2.gz	RPJPXXUGJOMLCJ-QZTJIDSGSA-N	0	3	342.483	3.327	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C(F)F)cc2F)C[C@@H]1C	ZINC000947850358	1333279436	/nfs/dbraw/zinc/27/94/36/1333279436.db2.gz	ZKLIQBMNAQUIMO-JSGCOSHPSA-N	0	3	338.373	3.369	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)CC2C3CC4CC(C3)CC2C4)C[C@@H]1C	ZINC000948056099	1333357942	/nfs/dbraw/zinc/35/79/42/1333357942.db2.gz	HBZFWIUDSAEWQG-XDSQKNPHSA-N	0	3	342.527	3.441	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccccc2CC(C)C)C[C@H]1C	ZINC000948082460	1333369136	/nfs/dbraw/zinc/36/91/36/1333369136.db2.gz	DBMFVGYXEQKKDD-MJGOQNOKSA-N	0	3	326.484	3.491	20	30		EGEDHN
CN(C(=O)[C@@H]1CC1(C)C)[C@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948306795	1333474252	/nfs/dbraw/zinc/47/42/52/1333474252.db2.gz	PKOZTYIOTWVTAI-OALUTQOASA-N	0	3	339.483	3.417	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)[C@@H]2C[C@H]2c2sccc2C)CC1	ZINC000948368273	1333497093	/nfs/dbraw/zinc/49/70/93/1333497093.db2.gz	HBCZJHPFCUTDFV-GVDBMIGSSA-N	0	3	330.497	3.106	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cccc3scnc32)CC1	ZINC000948374083	1333499915	/nfs/dbraw/zinc/49/99/15/1333499915.db2.gz	TUCMZBLFQKZSCS-OAHLLOKOSA-N	0	3	341.480	3.246	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC000948381173	1333503314	/nfs/dbraw/zinc/50/33/14/1333503314.db2.gz	GSIHXMBZPIRPGZ-AWEZNQCLSA-N	0	3	338.373	3.323	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2oc3ccc(F)cc3c2C)CC1	ZINC000948436006	1333523690	/nfs/dbraw/zinc/52/36/90/1333523690.db2.gz	RRPCITMABOVJKL-INIZCTEOSA-N	0	3	342.414	3.440	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2cnc3ccccc3c2C)CC1	ZINC000948626135	1333601940	/nfs/dbraw/zinc/60/19/40/1333601940.db2.gz	ZIDSDMSRHPJZPT-KRWDZBQOSA-N	0	3	335.451	3.103	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)Cc2ccc(C3CCC3)cc2)CC1	ZINC000948655395	1333614234	/nfs/dbraw/zinc/61/42/34/1333614234.db2.gz	AHOMSNILSUDEPH-OAQYLSRUSA-N	0	3	338.495	3.443	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2ccc(C)nc2C2CC2)CC1	ZINC000948656418	1333615750	/nfs/dbraw/zinc/61/57/50/1333615750.db2.gz	YKPWCINHIJXMHG-SFHVURJKSA-N	0	3	339.483	3.217	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cc3ccsc3[nH]2)CC1	ZINC000948662169	1333618393	/nfs/dbraw/zinc/61/83/93/1333618393.db2.gz	RYDUOMYJQXTTEO-OAHLLOKOSA-N	0	3	329.469	3.179	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)C(C)(C)c2cccc(F)c2)CC1	ZINC000948772147	1333672549	/nfs/dbraw/zinc/67/25/49/1333672549.db2.gz	UJCIVXIUIYGOIX-IBGZPJMESA-N	0	3	344.474	3.440	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)[C@@H](C)c2cc(C)oc2C)CC1	ZINC000948860514	1333711623	/nfs/dbraw/zinc/71/16/23/1333711623.db2.gz	DZEVMVYIVKYKBH-FUHWJXTLSA-N	0	3	330.472	3.336	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@H]1CNC(=O)c1nc(C)c[nH]1	ZINC000948969781	1333750675	/nfs/dbraw/zinc/75/06/75/1333750675.db2.gz	LYXHXUBHURPOGC-GOSISDBHSA-N	0	3	338.455	3.014	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1cc(C(C)C)oc1C)CCO2	ZINC000949220153	1333797001	/nfs/dbraw/zinc/79/70/01/1333797001.db2.gz	BDJGTUWOAVDOSN-UHFFFAOYSA-N	0	3	346.471	3.204	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@@]3(C)CC=CCC3)CC2)C1	ZINC000949376151	1333833755	/nfs/dbraw/zinc/83/37/55/1333833755.db2.gz	URLMUPLDYUVHPP-IBGZPJMESA-N	0	3	332.488	3.002	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@@H]3CCC[C@@H](C)C3)CC2)C1	ZINC000949455186	1333851759	/nfs/dbraw/zinc/85/17/59/1333851759.db2.gz	VXUSSWZSYHKEIQ-QZTJIDSGSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@@H]3CCC(C)(C)C3)CC2)C1	ZINC000949466933	1333855982	/nfs/dbraw/zinc/85/59/82/1333855982.db2.gz	WUTUUHBBXXJWQI-GOSISDBHSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C3CCC=CCC3)CC2)C1	ZINC000949528953	1333868188	/nfs/dbraw/zinc/86/81/88/1333868188.db2.gz	GOQZXQFXICIRJJ-UHFFFAOYSA-N	0	3	332.488	3.002	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](C)[C@H](NC(=O)c2nc3cnccc3s2)C1	ZINC000967315710	1335699042	/nfs/dbraw/zinc/69/90/42/1335699042.db2.gz	RDTAYGOUSWDUEQ-UKRRQHHQSA-N	0	3	344.484	3.098	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2ccc(F)c3ccncc23)C1	ZINC000967947805	1335832963	/nfs/dbraw/zinc/83/29/63/1335832963.db2.gz	YFDRYXIFBDSYOF-LIRRHRJNSA-N	0	3	341.430	3.390	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccccc2OC2CCC2)C1	ZINC000968316055	1335888249	/nfs/dbraw/zinc/88/82/49/1335888249.db2.gz	DAVICYMOOXDJCE-LPHOPBHVSA-N	0	3	340.467	3.081	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CN(Cc3cccc(C)c3)CC[C@H]2C)c1	ZINC000968316711	1335888402	/nfs/dbraw/zinc/88/84/02/1335888402.db2.gz	GIKLQPWPGBUDLQ-UTKZUKDTSA-N	0	3	347.462	3.012	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2cc(C(C)(C)C)oc2C)C1	ZINC000968357547	1335902317	/nfs/dbraw/zinc/90/23/17/1335902317.db2.gz	OULSMOWXJOBJAW-RHSMWYFYSA-N	0	3	330.472	3.349	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)C2(c3cccc(F)c3)CC2)C1	ZINC000968375046	1335909344	/nfs/dbraw/zinc/90/93/44/1335909344.db2.gz	QTBMPRBMVXAYFU-QAPCUYQASA-N	0	3	330.447	3.260	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2ccc3scnc3c2)C1	ZINC000968498257	1335942130	/nfs/dbraw/zinc/94/21/30/1335942130.db2.gz	YUUMTYGDGKRBEU-CZUORRHYSA-N	0	3	329.469	3.313	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2csc(C(F)(F)F)n2)C1	ZINC000968500728	1335943481	/nfs/dbraw/zinc/94/34/81/1335943481.db2.gz	IVBJSKWVECPDBI-MNOVXSKESA-N	0	3	347.406	3.178	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccc3nc(C)sc3c2)C1	ZINC000968503904	1335944691	/nfs/dbraw/zinc/94/46/91/1335944691.db2.gz	CEEYUFHAEVXCQJ-DYVFJYSZSA-N	0	3	341.480	3.068	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2cc3nc(C)ccc3o2)C1	ZINC000968565154	1335961680	/nfs/dbraw/zinc/96/16/80/1335961680.db2.gz	FHFGYSYUSDLDNQ-CZUORRHYSA-N	0	3	327.428	3.153	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)C23CC4CC(CC(C4)C2)C3)C1	ZINC000968575383	1335968249	/nfs/dbraw/zinc/96/82/49/1335968249.db2.gz	VWRFPPRVCGVJBS-GZKSLDRRSA-N	0	3	328.500	3.053	20	30		EGEDHN
CC(C)(CC(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1)C1CC1	ZINC000968589617	1335975521	/nfs/dbraw/zinc/97/55/21/1335975521.db2.gz	AXNGMIPIQQNSQS-QGZVFWFLSA-N	0	3	343.446	3.214	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@@H]1CN(Cc2ccccc2)CC[C@@H]1C	ZINC000968592093	1335976438	/nfs/dbraw/zinc/97/64/38/1335976438.db2.gz	KKFBPNFCWJSLCF-PGRDOPGGSA-N	0	3	346.474	3.237	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)Cc2cccc(OCC)c2)C1	ZINC000968684979	1336010079	/nfs/dbraw/zinc/01/00/79/1336010079.db2.gz	LIUHRXDVARMSSL-VQIMIIECSA-N	0	3	330.472	3.031	20	30		EGEDHN
N#Cc1c[nH]c(C(=O)NC[C@H]2CCCCCN2Cc2ccsc2)c1	ZINC000968799201	1336054917	/nfs/dbraw/zinc/05/49/17/1336054917.db2.gz	FLQPNMQYMPHZSU-MRXNPFEDSA-N	0	3	342.468	3.122	20	30		EGEDHN
N#Cc1cccc(CN2CCCCC[C@H]2CNC(=O)c2cc[nH]c2)c1	ZINC000968869103	1336073099	/nfs/dbraw/zinc/07/30/99/1336073099.db2.gz	IJDKGGDLZFUCSX-IBGZPJMESA-N	0	3	336.439	3.061	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccc2nc(C)oc2c1	ZINC000968896444	1336083412	/nfs/dbraw/zinc/08/34/12/1336083412.db2.gz	QOINCHGZLXZMOZ-INIZCTEOSA-N	0	3	327.428	3.297	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)[C@H]1CCCc2ccccc21	ZINC000968917203	1336088324	/nfs/dbraw/zinc/08/83/24/1336088324.db2.gz	QEYGXMQNKFEYQD-CTNGQTDRSA-N	0	3	338.495	3.491	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cc(C)n([C@H](C)CC)n1	ZINC000968922886	1336090774	/nfs/dbraw/zinc/09/07/74/1336090774.db2.gz	HHFJHMUYOAZCSD-NVXWUHKLSA-N	0	3	332.492	3.323	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1coc(C(F)(F)F)n1	ZINC000968936491	1336095707	/nfs/dbraw/zinc/09/57/07/1336095707.db2.gz	JHFKPHJPUZLHEH-GFCCVEGCSA-N	0	3	345.365	3.244	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccncc1OC(C)C	ZINC000968965515	1336103858	/nfs/dbraw/zinc/10/38/58/1336103858.db2.gz	RBCZMWRWAXYKQZ-MRXNPFEDSA-N	0	3	331.460	3.029	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1c(C)cc(F)cc1C	ZINC000968979655	1336107652	/nfs/dbraw/zinc/10/76/52/1336107652.db2.gz	JPVMGLRJJWMVQZ-GOSISDBHSA-N	0	3	330.447	3.440	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1n[nH]c2c1C[C@@H](C)CC2	ZINC000969093739	1336140299	/nfs/dbraw/zinc/14/02/99/1336140299.db2.gz	XGEQRDDXSSATJZ-JKSUJKDBSA-N	0	3	344.503	3.085	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1cnc(C)nc1C1CC1	ZINC000969137389	1336157704	/nfs/dbraw/zinc/15/77/04/1336157704.db2.gz	ZBIWQJSQPRYILU-QGZVFWFLSA-N	0	3	342.487	3.213	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cc2c(cccc2OC)[nH]1	ZINC000969142182	1336159993	/nfs/dbraw/zinc/15/99/93/1336159993.db2.gz	XSUFCWDGFHXVQH-OAHLLOKOSA-N	0	3	341.455	3.337	20	30		EGEDHN
C#CCCN1CCCCC[C@@H]1CNC(=O)c1sc(CCC)nc1C	ZINC000969144941	1336161126	/nfs/dbraw/zinc/16/11/26/1336161126.db2.gz	XFEOWLXZKGHABR-MRXNPFEDSA-N	0	3	347.528	3.402	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)[C@H]1Cc2c1cccc2Cl	ZINC000969165536	1336169328	/nfs/dbraw/zinc/16/93/28/1336169328.db2.gz	ZWHAMIOPOVEZGV-QAPCUYQASA-N	0	3	344.886	3.364	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccc(OC(C)C)cn1	ZINC000969169748	1336170740	/nfs/dbraw/zinc/17/07/40/1336170740.db2.gz	DZNSDTUNJDTAEP-MRXNPFEDSA-N	0	3	331.460	3.029	20	30		EGEDHN
C#CCCN1CCCCC[C@H]1CNC(=O)c1cnc(C(C)C)s1	ZINC000969173853	1336171213	/nfs/dbraw/zinc/17/12/13/1336171213.db2.gz	QYZCSKCVOVQWSA-HNNXBMFYSA-N	0	3	333.501	3.264	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@@H](NCc3ccc(C#N)c(F)c3)C2)cc1	ZINC000970558577	1336321556	/nfs/dbraw/zinc/32/15/56/1336321556.db2.gz	VHQAIBHHGAFNJQ-GOSISDBHSA-N	0	3	337.398	3.010	20	30		EGEDHN
CN(C(=O)Cc1ccccc1)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001005596806	1336377757	/nfs/dbraw/zinc/37/77/57/1336377757.db2.gz	LEMDNINPKOEVQJ-UHFFFAOYSA-N	0	3	347.462	3.224	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccc3ccn(C)c3c2)CC1	ZINC001006250342	1336476710	/nfs/dbraw/zinc/47/67/10/1336476710.db2.gz	BCCXDHBDFSTHPG-UHFFFAOYSA-N	0	3	325.456	3.291	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cnn(CCC(C)C)c2C)CC1	ZINC001006266110	1336478586	/nfs/dbraw/zinc/47/85/86/1336478586.db2.gz	MLHPACAPUQGLCG-UHFFFAOYSA-N	0	3	346.519	3.350	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccnc(O[C@H](C)CC)c2)CC1	ZINC001006274220	1336479426	/nfs/dbraw/zinc/47/94/26/1336479426.db2.gz	HXXRHGJBEIIYDF-MRXNPFEDSA-N	0	3	345.487	3.371	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CCCN(CCc2ccccc2)C1	ZINC001007501596	1336659517	/nfs/dbraw/zinc/65/95/17/1336659517.db2.gz	ZOZSDTOAJBOJJP-IBGZPJMESA-N	0	3	337.467	3.111	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CCCN([C@H](CC)c3ccccc3)C2)c1	ZINC001008465694	1336863820	/nfs/dbraw/zinc/86/38/20/1336863820.db2.gz	ACJSKWKKVDQHLX-LEWJYISDSA-N	0	3	347.462	3.408	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CCCN(Cc3ccccc3CC)C2)c1	ZINC001008468848	1336864680	/nfs/dbraw/zinc/86/46/80/1336864680.db2.gz	NNJIFMKZVTVMHT-NRFANRHFSA-N	0	3	347.462	3.020	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)Cc2c[nH]c3ccc(F)cc23)C1	ZINC001008660871	1336905817	/nfs/dbraw/zinc/90/58/17/1336905817.db2.gz	SIEOYNXXTDLCTG-INIZCTEOSA-N	0	3	329.419	3.006	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N[C@@H]1CCCN(Cc2ccc(C)cc2)C1	ZINC001008858556	1336933403	/nfs/dbraw/zinc/93/34/03/1336933403.db2.gz	YZUTYCWDCGMLCA-AABGKKOBSA-N	0	3	342.483	3.057	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2ccnc(O[C@H](C)CC)c2)C1	ZINC001009135346	1336974490	/nfs/dbraw/zinc/97/44/90/1336974490.db2.gz	YQRLEALTQKQUPM-WBVHZDCISA-N	0	3	331.460	3.029	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCN(Cc3ccccc3CC)C2)nc1	ZINC001009255110	1336991475	/nfs/dbraw/zinc/99/14/75/1336991475.db2.gz	ULLDQYYMTCHAOR-FQEVSTJZSA-N	0	3	347.462	3.020	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN(Cc3cc(C)ccc3C)C2)cn1	ZINC001009268843	1336994057	/nfs/dbraw/zinc/99/40/57/1336994057.db2.gz	LIFQCUXWLKYVLM-OAQYLSRUSA-N	0	3	347.462	3.074	20	30		EGEDHN
C=C(C)CCN1CCC[C@H](NC(=O)c2c(F)ccc(OC)c2F)C1	ZINC001009297538	1337000690	/nfs/dbraw/zinc/00/06/90/1337000690.db2.gz	OQZSXWIGPIVSIR-ZDUSSCGKSA-N	0	3	338.398	3.134	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@@H]1CCCN(Cc2cccc(C)c2)C1	ZINC001009356633	1337009927	/nfs/dbraw/zinc/00/99/27/1337009927.db2.gz	ZDEGYTLSTJRCCZ-JOCHJYFZSA-N	0	3	346.474	3.300	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N[C@H]1CCN(Cc2cc(C)sc2C)C1	ZINC001014472941	1337790483	/nfs/dbraw/zinc/79/04/83/1337790483.db2.gz	XREIBAPFWMDJGJ-KSZLIROESA-N	0	3	348.512	3.037	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](NC(=O)c2sc(C)nc2CC(C)C)C1	ZINC001015123527	1338025732	/nfs/dbraw/zinc/02/57/32/1338025732.db2.gz	BYPREVRDARPPGT-OAHLLOKOSA-N	0	3	335.517	3.420	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N[C@H]1CCN(Cc2ccccc2C(C)C)C1	ZINC001015725905	1338274526	/nfs/dbraw/zinc/27/45/26/1338274526.db2.gz	FGDQEGIHFRCKCN-SXLOBPIMSA-N	0	3	342.483	3.092	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc3ccccc3c2)C1	ZINC001015873555	1338343601	/nfs/dbraw/zinc/34/36/01/1338343601.db2.gz	YUCRBAYIOVSIPD-PCCBWWKXSA-N	0	3	332.447	3.157	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@H]1CCN(Cc2ccc(CC)cc2)C1	ZINC001016112699	1338466429	/nfs/dbraw/zinc/46/64/29/1338466429.db2.gz	ZEAVKYNFILYTET-QFIPXVFZSA-N	0	3	346.474	3.164	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(C)c(Cl)c2F)CC1	ZINC001016744711	1338709785	/nfs/dbraw/zinc/70/97/85/1338709785.db2.gz	JEQPWXRMXWPGSH-AWEZNQCLSA-N	0	3	334.822	3.005	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2cc(C)c(C)cc2Cl)CC1	ZINC001016761214	1338715470	/nfs/dbraw/zinc/71/54/70/1338715470.db2.gz	HUNLUNVDMKXZJH-KRWDZBQOSA-N	0	3	330.859	3.174	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2cc3cc(Cl)ccc3[nH]2)CC1	ZINC001016762220	1338715854	/nfs/dbraw/zinc/71/58/54/1338715854.db2.gz	GZEFCVNGINOCST-QGZVFWFLSA-N	0	3	341.842	3.039	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)C(C)(C)c2ccc(Cl)cc2)CC1	ZINC001016801366	1338731823	/nfs/dbraw/zinc/73/18/23/1338731823.db2.gz	WREGRAIXQYHZHK-KRWDZBQOSA-N	0	3	344.886	3.222	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)[C@@H]2C[C@H]2c2ccccc2C)CC1	ZINC001016874062	1338755077	/nfs/dbraw/zinc/75/50/77/1338755077.db2.gz	SVFNGXWBTWHSQA-ZCNNSNEGSA-N	0	3	336.479	3.093	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccc(OC(C)C)cc2)CC1	ZINC001016957739	1338784427	/nfs/dbraw/zinc/78/44/27/1338784427.db2.gz	CQJDJVHCNWDKFJ-LJQANCHMSA-N	0	3	340.467	3.081	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2csc3c2CCCC3)CC1	ZINC001016961814	1338785427	/nfs/dbraw/zinc/78/54/27/1338785427.db2.gz	UVVKCIFJFSOVDR-SFHVURJKSA-N	0	3	342.508	3.235	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cc(CC)c(C)s2)CC1	ZINC001016965707	1338786573	/nfs/dbraw/zinc/78/65/73/1338786573.db2.gz	RGIXBKQWXVAHSA-KRWDZBQOSA-N	0	3	330.497	3.227	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2oc3c(cccc3C)c2C)CC1	ZINC001016986747	1338793391	/nfs/dbraw/zinc/79/33/91/1338793391.db2.gz	SZTYYTRBWFUHJX-QGZVFWFLSA-N	0	3	336.435	3.267	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)C(C)(C)c2ccccc2C)CC1	ZINC001016994218	1338797387	/nfs/dbraw/zinc/79/73/87/1338797387.db2.gz	LAYPUIOZZHHHNT-LJQANCHMSA-N	0	3	338.495	3.267	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)C2(c3ccccc3C)CC2)CC1	ZINC001017000566	1338799897	/nfs/dbraw/zinc/79/98/97/1338799897.db2.gz	VWNBRJZIPWBUQG-LJQANCHMSA-N	0	3	336.479	3.021	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2ccc(C3=CCCC3)cc2)CC1	ZINC001017003241	1338801063	/nfs/dbraw/zinc/80/10/63/1338801063.db2.gz	JZGMAGSTQHKBGJ-HXUWFJFHSA-N	0	3	334.463	3.471	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCCN(C(=O)c2ccco2)C1	ZINC001017025558	1338816126	/nfs/dbraw/zinc/81/61/26/1338816126.db2.gz	IEYWQRQWJLCDNV-AWEZNQCLSA-N	0	3	343.452	3.197	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC[C@H](CN(C)Cc2ccc(Cl)s2)C1	ZINC001017070506	1338847479	/nfs/dbraw/zinc/84/74/79/1338847479.db2.gz	GIDGNJSHLBSWGT-QWHCGFSZSA-N	0	3	339.892	3.232	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC[C@@H](CN(C)Cc2ccc(Cl)s2)C1	ZINC001017070508	1338847664	/nfs/dbraw/zinc/84/76/64/1338847664.db2.gz	GIDGNJSHLBSWGT-STQMWFEESA-N	0	3	339.892	3.232	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@@H](CN(C)Cc2ccc(C#N)s2)C1)C1CC1	ZINC001017087633	1338855175	/nfs/dbraw/zinc/85/51/75/1338855175.db2.gz	NOCNUZWRSKCPQM-CABCVRRESA-N	0	3	345.512	3.336	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H](CN(C)[C@H](C)c2cnccn2)C1	ZINC001017179461	1338922614	/nfs/dbraw/zinc/92/26/14/1338922614.db2.gz	JNIBQWHNOOVIBA-SJORKVTESA-N	0	3	344.503	3.310	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H](CN(C)Cc2ccccn2)C1	ZINC001017201351	1338946269	/nfs/dbraw/zinc/94/62/69/1338946269.db2.gz	IHHOWCATYICVTC-XLIONFOSSA-N	0	3	329.488	3.354	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H](CN(C)Cc2cnc(C)nc2)C1	ZINC001017201882	1338946743	/nfs/dbraw/zinc/94/67/43/1338946743.db2.gz	MYQKBBHHEMEBSY-FXAWDEMLSA-N	0	3	344.503	3.058	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H](CN(C)Cc2cnc(C)nc2)C1	ZINC001017201883	1338947167	/nfs/dbraw/zinc/94/71/67/1338947167.db2.gz	MYQKBBHHEMEBSY-PXNSSMCTSA-N	0	3	344.503	3.058	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H](CN(C)Cc2cnoc2C)C1	ZINC001017202472	1338948547	/nfs/dbraw/zinc/94/85/47/1338948547.db2.gz	XSEXQTOSMYCNBD-VQIMIIECSA-N	0	3	333.476	3.256	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)CCc1ncc(C(C)(C)C)o1	ZINC001017625821	1339378632	/nfs/dbraw/zinc/37/86/32/1339378632.db2.gz	UYRIDKJKRMSUGV-IYBDPMFKSA-N	0	3	345.487	3.156	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccc2ncccc12	ZINC001017731012	1339406037	/nfs/dbraw/zinc/40/60/37/1339406037.db2.gz	YYBDHNRUVWUAAS-HDICACEKSA-N	0	3	335.451	3.029	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CCc1cccc(OC)c1	ZINC001017729668	1339406133	/nfs/dbraw/zinc/40/61/33/1339406133.db2.gz	GTJKLGWNAUSQBB-KDURUIRLSA-N	0	3	342.483	3.269	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](c1ccncc1)C(C)C	ZINC001017849173	1339429981	/nfs/dbraw/zinc/42/99/81/1339429981.db2.gz	GLUPZCCDYWTDQG-HSALFYBXSA-N	0	3	341.499	3.463	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)CCc1c[nH]c2ccccc12	ZINC001018236247	1339543528	/nfs/dbraw/zinc/54/35/28/1339543528.db2.gz	DLGYWXSPDVOZPR-HDICACEKSA-N	0	3	337.467	3.352	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cccc2oc(C)nc21	ZINC001018318555	1339574859	/nfs/dbraw/zinc/57/48/59/1339574859.db2.gz	DDMGZNOIMDVZOA-IYBDPMFKSA-N	0	3	339.439	3.391	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1Oc2ccccc2[C@@H]1C	ZINC001018343635	1339585701	/nfs/dbraw/zinc/58/57/01/1339585701.db2.gz	XXBSZVGDBUCUQM-MIALQEHNSA-N	0	3	340.467	3.193	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)CC3CCCCC3)C2)s1	ZINC001018468835	1339631500	/nfs/dbraw/zinc/63/15/00/1339631500.db2.gz	RVHXXAHRZRXVAL-HNNXBMFYSA-N	0	3	331.485	3.281	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)C(F)=C3CCCC3)C2)s1	ZINC001018710750	1339708637	/nfs/dbraw/zinc/70/86/37/1339708637.db2.gz	YFHQKFOZIHCHCC-ZDUSSCGKSA-N	0	3	333.432	3.108	20	30		EGEDHN
C[C@]1(C(=O)N2CC[C@H](NCc3ccc(F)c(C#N)c3)C2)CC=CCC1	ZINC001018905222	1339748444	/nfs/dbraw/zinc/74/84/44/1339748444.db2.gz	XHZJIRXVEWGYSO-PXNSSMCTSA-N	0	3	341.430	3.134	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCCN2Cc2ccccc2CC)nc1	ZINC001028269443	1340523482	/nfs/dbraw/zinc/52/34/82/1340523482.db2.gz	MRRHBUFAECBDAR-FQEVSTJZSA-N	0	3	347.462	3.020	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1ccccc1OCC1CC1	ZINC001028332631	1340571339	/nfs/dbraw/zinc/57/13/39/1340571339.db2.gz	ZQJWPRNUAZOFOL-KRWDZBQOSA-N	0	3	328.456	3.246	20	30		EGEDHN
Cc1cc(C(=O)NC[C@H]2CCN(Cc3ccc(C#N)cc3)C2)c(C)o1	ZINC001028403001	1340624722	/nfs/dbraw/zinc/62/47/22/1340624722.db2.gz	IYOBXVHKWSBCFC-GOSISDBHSA-N	0	3	337.423	3.020	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H](CNC(=O)C3=CCCCCC3)C2)c1	ZINC001028501316	1340673774	/nfs/dbraw/zinc/67/37/74/1340673774.db2.gz	FLPWZSRGZKVWHM-LJQANCHMSA-N	0	3	337.467	3.387	20	30		EGEDHN
CC(C)(C)[C@@H]1C[C@H]1C(=O)NC[C@@H]1CCN(Cc2ccc(C#N)cc2)C1	ZINC001028684764	1340757564	/nfs/dbraw/zinc/75/75/64/1340757564.db2.gz	UTBJLIVOPSHVNF-IPMKNSEASA-N	0	3	339.483	3.179	20	30		EGEDHN
CC1(C)CC[C@H](C(=O)NC[C@@H]2CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001028782029	1340813218	/nfs/dbraw/zinc/81/32/18/1340813218.db2.gz	ADKROZDXSYITGU-OALUTQOASA-N	0	3	339.483	3.323	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)c2cc(Cl)cc(Cl)c2)C1	ZINC001028950367	1340892037	/nfs/dbraw/zinc/89/20/37/1340892037.db2.gz	GISJJJUUQROICY-GFCCVEGCSA-N	0	3	325.239	3.068	20	30		EGEDHN
Cc1cc(C)cc(C(=O)NC[C@@H]2CCN(Cc3ccc(C#N)cc3)C2)c1	ZINC001028954342	1340893032	/nfs/dbraw/zinc/89/30/32/1340893032.db2.gz	XSTVYMXIJLFWES-FQEVSTJZSA-N	0	3	347.462	3.427	20	30		EGEDHN
CCc1ccc(C(=O)NC[C@@H]2CCN(Cc3cccc(C#N)c3)C2)cc1	ZINC001028965721	1340895092	/nfs/dbraw/zinc/89/50/92/1340895092.db2.gz	MRVZIYSSQITCEA-FQEVSTJZSA-N	0	3	347.462	3.373	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CC[C@@H](C1)N2CC1CC(OCC)C1	ZINC001029453716	1340993828	/nfs/dbraw/zinc/99/38/28/1340993828.db2.gz	JETWGTCTCTWBHT-UFCQKJOMSA-N	0	3	334.504	3.079	20	30		EGEDHN
Cc1occc1C(=O)N1CC[C@@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001029639092	1341029932	/nfs/dbraw/zinc/02/99/32/1341029932.db2.gz	CHZZAFMJUUWHFR-AWEZNQCLSA-N	0	3	343.452	3.115	20	30		EGEDHN
C/C(=C/C(=O)N1CC[C@H](CN(C)Cc2ccc(C#N)s2)C1)C1CC1	ZINC001029663042	1341037254	/nfs/dbraw/zinc/03/72/54/1341037254.db2.gz	DPYDSAGQQAXQMP-KQGZCTBQSA-N	0	3	343.496	3.256	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCN(C(=O)CC2(C)CC2)C1	ZINC001029786760	1341073204	/nfs/dbraw/zinc/07/32/04/1341073204.db2.gz	ZFOFGVUXTFABNZ-CQSZACIVSA-N	0	3	331.485	3.090	20	30		EGEDHN
C[C@H](c1cc(F)ccc1F)N(C)CC1CCN(C(=O)[C@@H](C)C#N)CC1	ZINC001029945456	1341130411	/nfs/dbraw/zinc/13/04/11/1341130411.db2.gz	ISMFVRQZZPFQKF-UONOGXRCSA-N	0	3	349.425	3.356	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC(CN(C)Cc2cc(C#N)ccc2F)CC1	ZINC001029954261	1341133693	/nfs/dbraw/zinc/13/36/93/1341133693.db2.gz	XHFIJXMDEMFRDF-SYZQJQIISA-N	0	3	343.446	3.334	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC(CN(C)Cc2c(C)noc2CC)CC1	ZINC001029985356	1341144495	/nfs/dbraw/zinc/14/44/95/1341144495.db2.gz	WBOAAPNLRYGJEK-UHFFFAOYSA-N	0	3	347.503	3.428	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC(CN(C)Cc2cc(C)ncn2)CC1	ZINC001029991466	1341148507	/nfs/dbraw/zinc/14/85/07/1341148507.db2.gz	ZZDGOMLUASKVRB-FQEVSTJZSA-N	0	3	344.503	3.058	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@@H]2CCN(CCOc3ccccc3C)C2)C1	ZINC001033394589	1341811485	/nfs/dbraw/zinc/81/14/85/1341811485.db2.gz	WYPJVDKVEWEORC-GOSISDBHSA-N	0	3	342.483	3.263	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2ncoc2-c2cccs2)C1	ZINC001033508208	1341850986	/nfs/dbraw/zinc/85/09/86/1341850986.db2.gz	QVGRADYIZLPCMB-ZDUSSCGKSA-N	0	3	331.441	3.126	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2cc3ccccc3n2CC)C1	ZINC001033686290	1341950897	/nfs/dbraw/zinc/95/08/97/1341950897.db2.gz	UTXQJXYHVBDZRG-KRWDZBQOSA-N	0	3	325.456	3.384	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](N(CC)C(=O)c2sc3nccn3c2C)C1	ZINC001033861325	1342049401	/nfs/dbraw/zinc/04/94/01/1342049401.db2.gz	GUEVXNYFKGYIEA-OAHLLOKOSA-N	0	3	346.500	3.207	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2cccc(-n3cccc3)c2)C1	ZINC001033886889	1342059774	/nfs/dbraw/zinc/05/97/74/1342059774.db2.gz	CRSYKRMCLVTLET-FQEVSTJZSA-N	0	3	335.451	3.037	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@H]2COc3cc(C)c(C)cc32)C1	ZINC001033908059	1342079440	/nfs/dbraw/zinc/07/94/40/1342079440.db2.gz	LMUXGEWXHLMMAX-HKUYNNGSSA-N	0	3	342.483	3.278	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccc(C(F)(F)F)nc2)C1	ZINC001033919830	1342087988	/nfs/dbraw/zinc/08/79/88/1342087988.db2.gz	VPNKECNRYPJZJU-AWEZNQCLSA-N	0	3	341.377	3.213	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccc3c(c2)[C@H](C)CO3)C1	ZINC001033931205	1342094816	/nfs/dbraw/zinc/09/48/16/1342094816.db2.gz	DEDKKRZKTWHOKX-WBVHZDCISA-N	0	3	328.456	3.295	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N(CC)[C@H]1CCN(Cc2ccc(C)cc2)C1	ZINC001033960476	1342113640	/nfs/dbraw/zinc/11/36/40/1342113640.db2.gz	VFHGTUDDBDCKAQ-ZCNNSNEGSA-N	0	3	342.483	3.009	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2)C1	ZINC001033979651	1342127447	/nfs/dbraw/zinc/12/74/47/1342127447.db2.gz	KOSCVUGXQFASJI-CEXWTWQISA-N	0	3	344.886	3.390	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccc(N(CC)CC)nc2)C1	ZINC001034050968	1342192719	/nfs/dbraw/zinc/19/27/19/1342192719.db2.gz	KEDUHWZAFRVOFG-SFHVURJKSA-N	0	3	344.503	3.040	20	30		EGEDHN
N#Cc1ccc(CN2CCCC[C@@H](NC(=O)CC3CCC3)C2)cc1	ZINC001034139491	1342266221	/nfs/dbraw/zinc/26/62/21/1342266221.db2.gz	YKTONLXQFMOISF-LJQANCHMSA-N	0	3	325.456	3.219	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2c(Cl)n[nH]c2C2CC2)C1	ZINC001034240814	1342341733	/nfs/dbraw/zinc/34/17/33/1342341733.db2.gz	MFNQLLNTOHOTES-ZDUSSCGKSA-N	0	3	336.867	3.101	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)c2ccc3c(c2)C(C)(C)CO3)C1	ZINC001034303727	1342386329	/nfs/dbraw/zinc/38/63/29/1342386329.db2.gz	JPZCFLJKUCDGFB-INIZCTEOSA-N	0	3	328.456	3.127	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cc(-c3ccccc3)n[nH]2)C1	ZINC001034303979	1342386737	/nfs/dbraw/zinc/38/67/37/1342386737.db2.gz	OALOOHNBQZXIBM-KRWDZBQOSA-N	0	3	338.455	3.237	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)C(C)(C)c2c(C)noc2C)C1	ZINC001034355078	1342426659	/nfs/dbraw/zinc/42/66/59/1342426659.db2.gz	BOJPPLNQUJTAJM-MRXNPFEDSA-N	0	3	333.476	3.116	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cc3cc(OC)ccc3[nH]2)C1	ZINC001034377961	1342447064	/nfs/dbraw/zinc/44/70/64/1342447064.db2.gz	HITMPFJVOOZTFL-MRXNPFEDSA-N	0	3	341.455	3.337	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCCN(CCc3scnc3C)C2)C1	ZINC001034388024	1342457238	/nfs/dbraw/zinc/45/72/38/1342457238.db2.gz	BAAUDRIPGUNGGS-MRXNPFEDSA-N	0	3	347.528	3.321	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2F)C1	ZINC001034432785	1342495462	/nfs/dbraw/zinc/49/54/62/1342495462.db2.gz	KLWJLUHYBZXGEY-RYQLBKOJSA-N	0	3	330.447	3.476	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccccc2NC(=O)CC)C1	ZINC001034450800	1342510908	/nfs/dbraw/zinc/51/09/08/1342510908.db2.gz	MBNHQHVOGGJXPE-INIZCTEOSA-N	0	3	343.471	3.196	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)C2(c3ccccc3F)CCC2)C1	ZINC001034483475	1342540935	/nfs/dbraw/zinc/54/09/35/1342540935.db2.gz	RPCOTUPIYBBUBI-KRWDZBQOSA-N	0	3	342.458	3.241	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc(Br)o2)C1	ZINC001034506685	1342564948	/nfs/dbraw/zinc/56/49/48/1342564948.db2.gz	LSBNRNQYBOTNQT-GFCCVEGCSA-N	0	3	341.249	3.203	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2csc3c2CC[C@@H](C)C3)C1	ZINC001034513181	1342572107	/nfs/dbraw/zinc/57/21/07/1342572107.db2.gz	VFZBFKZAUULENH-HZPDHXFCSA-N	0	3	344.524	3.481	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc(OC)c(OCC)c2)C1	ZINC001034522197	1342580323	/nfs/dbraw/zinc/58/03/23/1342580323.db2.gz	SKGYFAZLLPDSID-QGZVFWFLSA-N	0	3	346.471	3.254	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)C2CC(c3ccc(F)cc3)C2)C1	ZINC001034554528	1342616656	/nfs/dbraw/zinc/61/66/56/1342616656.db2.gz	RVJOGANIDTYCKN-TVPLGVNVSA-N	0	3	330.447	3.476	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)C2CC(c3cccc(F)c3)C2)C1	ZINC001034554718	1342616952	/nfs/dbraw/zinc/61/69/52/1342616952.db2.gz	TWWWSAWXWLFAMX-FAFZWHIHSA-N	0	3	330.447	3.476	20	30		EGEDHN
CC(C)[C@@H]1C[C@H]1C(=O)N[C@H]1CC[C@H](NCc2ccccc2C#N)CC1	ZINC001034771769	1342751077	/nfs/dbraw/zinc/75/10/77/1342751077.db2.gz	STAXEBQWWUDGCX-LWYYNNOASA-N	0	3	339.483	3.367	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc(F)cc(F)c2)C12CCC2	ZINC001078800134	1357091326	/nfs/dbraw/zinc/09/13/26/1357091326.db2.gz	JBVBGNOHELGJGT-GJZGRUSLSA-N	0	3	340.801	3.348	20	30		EGEDHN
C[C@H](NC[C@H]1CCCN1C(=O)C#CC1CC1)c1ccc(F)cc1F	ZINC001034930073	1342841114	/nfs/dbraw/zinc/84/11/14/1342841114.db2.gz	HDKIORFHKXLTGX-XJKSGUPXSA-N	0	3	332.394	3.020	20	30		EGEDHN
CC1(C)CC[C@@H]1C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)c(F)c1	ZINC001035022806	1342882143	/nfs/dbraw/zinc/88/21/43/1342882143.db2.gz	SLCFFPXAMYWNPQ-IAGOWNOFSA-N	0	3	343.446	3.214	20	30		EGEDHN
O=C(/C=C\C1CC1)N1CCC2(CCN(CC#Cc3ccccc3)C2)CC1	ZINC001035170494	1342986107	/nfs/dbraw/zinc/98/61/07/1342986107.db2.gz	QKZMAZCGHRTRCJ-KHPPLWFESA-N	0	3	348.490	3.319	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC2(CCN(Cc3ccc(C#N)s3)C2)CC1	ZINC001035171957	1342987587	/nfs/dbraw/zinc/98/75/87/1342987587.db2.gz	HMKGOCDXHRFBCB-CRKCGEKBSA-N	0	3	343.496	3.400	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC2(CCN(Cc3ccccc3C#N)C2)CC1	ZINC001035173340	1342989983	/nfs/dbraw/zinc/98/99/83/1342989983.db2.gz	YCROICNIBRJFJV-YPEHOIGNSA-N	0	3	337.467	3.339	20	30		EGEDHN
CC[C@H](c1ccc(F)cc1)N1CC2(C1)CCN(C(=O)[C@@H](C)C#N)CC2	ZINC001035667910	1343129455	/nfs/dbraw/zinc/12/94/55/1343129455.db2.gz	AWMHXFJPYBPYHI-MAUKXSAKSA-N	0	3	343.446	3.361	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccnn1C1CCCC1)CC2	ZINC001035715642	1343149739	/nfs/dbraw/zinc/14/97/39/1343149739.db2.gz	NEUQVDUIKBPDKC-UHFFFAOYSA-N	0	3	342.487	3.112	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H]1C[C@H]1c1ccsc1)CC2	ZINC001035731850	1343158860	/nfs/dbraw/zinc/15/88/60/1343158860.db2.gz	OFPCKVVZHUWGDO-DLBZAZTESA-N	0	3	330.497	3.352	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cc1cc(C)ccc1OC)CC2	ZINC001035743930	1343164499	/nfs/dbraw/zinc/16/44/99/1343164499.db2.gz	AKMZGKWHJAAGCB-UHFFFAOYSA-N	0	3	342.483	3.047	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cc(C)ccc1C1CC1)CC2	ZINC001035756007	1343172014	/nfs/dbraw/zinc/17/20/14/1343172014.db2.gz	VLCIMJSDTZMIAA-UHFFFAOYSA-N	0	3	336.479	3.434	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc3c(c1)[C@@H](C)CO3)CC2	ZINC001035772062	1343183447	/nfs/dbraw/zinc/18/34/47/1343183447.db2.gz	MWPAIGDLPCRNBS-INIZCTEOSA-N	0	3	340.467	3.297	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)COc1ccccc1CC)CC2	ZINC001035847306	1343228118	/nfs/dbraw/zinc/22/81/18/1343228118.db2.gz	MZGACVTXNBPNLI-UHFFFAOYSA-N	0	3	342.483	3.128	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H](C)Oc1ccc(C)cc1)CC2	ZINC001035849087	1343228780	/nfs/dbraw/zinc/22/87/80/1343228780.db2.gz	RUTBYKSTVYKCFR-GOSISDBHSA-N	0	3	342.483	3.263	20	30		EGEDHN
C[C@@H]1CN(C(=O)/C=C\c2ccco2)CC[C@@H]1NCc1ccccc1C#N	ZINC001035903153	1343260763	/nfs/dbraw/zinc/26/07/63/1343260763.db2.gz	BDMVMTIXYPGBRW-YEPKGFQBSA-N	0	3	349.434	3.191	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2(C)CC2)CC[C@H]1NCc1cc(F)ccc1C#N	ZINC001036125513	1343318739	/nfs/dbraw/zinc/31/87/39/1343318739.db2.gz	WOGJHFKXFJTWCI-RDTXWAMCSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](NCc2ccccc2C#N)[C@H](C)C1	ZINC001036136703	1343322443	/nfs/dbraw/zinc/32/24/43/1343322443.db2.gz	KEMBWILCIOAMDP-VQIMIIECSA-N	0	3	339.483	3.487	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](NCc2csc(C)n2)[C@@H](C)C1	ZINC001036140147	1343324766	/nfs/dbraw/zinc/32/47/66/1343324766.db2.gz	BLQFVXJVEYGQET-XJKSGUPXSA-N	0	3	335.517	3.380	20	30		EGEDHN
Cc1coc(C(=O)N2CC[C@@H](NCc3ccccc3C#N)[C@H](C)C2)c1	ZINC001036148231	1343330105	/nfs/dbraw/zinc/33/01/05/1343330105.db2.gz	ZQHPVYZTTSCMBP-CRAIPNDOSA-N	0	3	337.423	3.100	20	30		EGEDHN
CCC1(C(=O)N2CC[C@@H](NCc3ccccc3C#N)[C@@H](C)C2)CCC1	ZINC001036160376	1343336482	/nfs/dbraw/zinc/33/64/82/1343336482.db2.gz	VGRAFWAXRBJKOY-QFBILLFUSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](NCc3ccccc3C#N)[C@@H](C)C2)C1	ZINC001036171041	1343344407	/nfs/dbraw/zinc/34/44/07/1343344407.db2.gz	VVRYXBYQOPDUSQ-QFBILLFUSA-N	0	3	337.467	3.241	20	30		EGEDHN
C[C@H]1CN(C(=O)C2(CF)CCC2)CC[C@@H]1NCc1ccccc1C#N	ZINC001036190271	1343354846	/nfs/dbraw/zinc/35/48/46/1343354846.db2.gz	YTBPLKPLFYGRRP-YJBOKZPZSA-N	0	3	343.446	3.025	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@H]([C@@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001036339583	1343425333	/nfs/dbraw/zinc/42/53/33/1343425333.db2.gz	GHAINXSZQJNCJW-WBVHZDCISA-N	0	3	343.446	3.380	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCCN(C(=O)C(C)(C)F)C1	ZINC001036359289	1343441282	/nfs/dbraw/zinc/44/12/82/1343441282.db2.gz	XHGJVUIBFXNDMM-PBHICJAKSA-N	0	3	331.435	3.023	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]([C@H](C)NCc3cnc(C)o3)C2)C1	ZINC001036440551	1343489066	/nfs/dbraw/zinc/48/90/66/1343489066.db2.gz	ABVVQMKKURJLGS-HOCLYGCPSA-N	0	3	331.460	3.056	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]([C@@H](C)NCc3nc(C)oc3C)C2)C1	ZINC001036443531	1343491452	/nfs/dbraw/zinc/49/14/52/1343491452.db2.gz	HYPBOTKIENEXFR-PBHICJAKSA-N	0	3	345.487	3.364	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC[C@H](C)[C@H]1CNCc1ccc(C#N)s1	ZINC001036533044	1343540441	/nfs/dbraw/zinc/54/04/41/1343540441.db2.gz	LXUMEYUTTBZZMG-QRDFODAWSA-N	0	3	331.485	3.303	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC[C@H](C)[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001036532933	1343540525	/nfs/dbraw/zinc/54/05/25/1343540525.db2.gz	KNRZSYLGTARLRV-OELZBGSDSA-N	0	3	343.446	3.380	20	30		EGEDHN
CCC(=O)N1CC[C@@H]2[C@H](CCN2CC#Cc2cccc(Cl)c2)C1	ZINC001036607805	1343572203	/nfs/dbraw/zinc/57/22/03/1343572203.db2.gz	BGOIRKHPWCAGDO-SJLPKXTDSA-N	0	3	330.859	3.024	20	30		EGEDHN
O=C(C1CC1)N1CC[C@@H]2[C@@H](CCN2CC#Cc2ccc(Cl)cc2)C1	ZINC001036613502	1343574855	/nfs/dbraw/zinc/57/48/55/1343574855.db2.gz	IIEZCODMZYCWKP-PKOBYXMFSA-N	0	3	342.870	3.024	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@@H]2[C@@H](CCN2CC#Cc2ccc(F)cc2)C1	ZINC001036626663	1343583772	/nfs/dbraw/zinc/58/37/72/1343583772.db2.gz	APBQUXFCNDHSEZ-AZUAARDMSA-N	0	3	342.458	3.146	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@@H]2[C@H](CCN2CC#Cc2ccc(F)cc2)C1	ZINC001036632902	1343591048	/nfs/dbraw/zinc/59/10/48/1343591048.db2.gz	UHSBOEDZJOFKIZ-UYAOXDASSA-N	0	3	340.442	3.066	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@H]2CN(C(=O)CCC3CC3)CC[C@H]21	ZINC001036670753	1343613667	/nfs/dbraw/zinc/61/36/67/1343613667.db2.gz	ZKZGJTQAKDHHFD-VQTJNVASSA-N	0	3	337.467	3.171	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@H]2CN(C(=O)CCC3CC3)CC[C@@H]21	ZINC001036670751	1343613836	/nfs/dbraw/zinc/61/38/36/1343613836.db2.gz	ZKZGJTQAKDHHFD-PMACEKPBSA-N	0	3	337.467	3.171	20	30		EGEDHN
O=C(C1=CCCC1)N1CC[C@@H]2[C@@H](CCN2CC#Cc2ccccc2)C1	ZINC001036687159	1343629502	/nfs/dbraw/zinc/62/95/02/1343629502.db2.gz	YDPAUNZTIJWGHE-LEWJYISDSA-N	0	3	334.463	3.071	20	30		EGEDHN
O=C(C1=CCCC1)N1CC[C@H]2[C@H](CCN2CC#Cc2ccccc2)C1	ZINC001036687161	1343629607	/nfs/dbraw/zinc/62/96/07/1343629607.db2.gz	YDPAUNZTIJWGHE-RTWAWAEBSA-N	0	3	334.463	3.071	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@@H]2[C@@H](CCN2CC#Cc2ccccc2)C1	ZINC001036686693	1343629774	/nfs/dbraw/zinc/62/97/74/1343629774.db2.gz	RDVDPWSRWDTLNC-RBUKOAKNSA-N	0	3	340.442	3.224	20	30		EGEDHN
O=C(C=C1CCC1)N1CC[C@H]2[C@@H](CCN2CC#Cc2ccccc2)C1	ZINC001036688546	1343631846	/nfs/dbraw/zinc/63/18/46/1343631846.db2.gz	URGOTTHOCRGIJH-SFTDATJTSA-N	0	3	334.463	3.071	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CN(C(=O)C=C4CCC4)CC[C@H]32)s1	ZINC001036689135	1343632287	/nfs/dbraw/zinc/63/22/87/1343632287.db2.gz	CZDVHTLXZDHBOH-CRAIPNDOSA-N	0	3	341.480	3.153	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2[C@@H](CCN2Cc2cnc(C)s2)C1	ZINC001036789305	1343719526	/nfs/dbraw/zinc/71/95/26/1343719526.db2.gz	PEPCIQGOYWAENU-HOCLYGCPSA-N	0	3	333.501	3.087	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2[C@@H](CCN2CC#Cc2ccccc2)C1	ZINC001036792007	1343722669	/nfs/dbraw/zinc/72/26/69/1343722669.db2.gz	IVEDLTUHRODLNT-PMACEKPBSA-N	0	3	336.479	3.173	20	30		EGEDHN
CC1(C(=O)N2CC[C@@H]3[C@@H](CCN3CC#Cc3ccccc3)C2)CCC1	ZINC001036793141	1343725371	/nfs/dbraw/zinc/72/53/71/1343725371.db2.gz	ZYEHPDAJOPKPBN-VQTJNVASSA-N	0	3	336.479	3.151	20	30		EGEDHN
CC1(C(=O)N2CC[C@H]3[C@H](CCN3CC#Cc3ccccc3)C2)CCC1	ZINC001036793140	1343726023	/nfs/dbraw/zinc/72/60/23/1343726023.db2.gz	ZYEHPDAJOPKPBN-UXHICEINSA-N	0	3	336.479	3.151	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2oc(C)nc2C)C1	ZINC001036793871	1343726050	/nfs/dbraw/zinc/72/60/50/1343726050.db2.gz	MIMKNKZTKYPMNV-DLBZAZTESA-N	0	3	345.487	3.317	20	30		EGEDHN
CCC1(C(=O)N2CC[C@@H]3[C@H](CCN3Cc3ccccc3C#N)C2)CC1	ZINC001036813642	1343749693	/nfs/dbraw/zinc/74/96/93/1343749693.db2.gz	AJLVCORHFWRIEB-RTBURBONSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]3[C@@H](CCN3Cc3conc3CC)C2)C1	ZINC001036816086	1343753104	/nfs/dbraw/zinc/75/31/04/1343753104.db2.gz	PSEIKKFJGVVMEJ-YJBOKZPZSA-N	0	3	343.471	3.016	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]3[C@@H](CCN3Cc3cc(C)ns3)C2)C1	ZINC001036816349	1343754314	/nfs/dbraw/zinc/75/43/14/1343754314.db2.gz	TUSLUQCZSFUWFT-RDJZCZTQSA-N	0	3	345.512	3.231	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@@H]2[C@H](CCN2CC#Cc2ccc(F)cc2)C1	ZINC001036876180	1343815077	/nfs/dbraw/zinc/81/50/77/1343815077.db2.gz	LTHUXBZVTGRLQR-IEBWSBKVSA-N	0	3	342.458	3.146	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCC[C@@H]1NC(=O)c1ccccc1	ZINC001036931223	1343874479	/nfs/dbraw/zinc/87/44/79/1343874479.db2.gz	QYPSEEXLNBEYAK-PMACEKPBSA-N	0	3	333.435	3.247	20	30		EGEDHN
Cc1occc1C(=O)N[C@H]1CCC[C@H]1CNCc1ccccc1C#N	ZINC001036940239	1343883765	/nfs/dbraw/zinc/88/37/65/1343883765.db2.gz	WPSDATGMZQMVDN-HKUYNNGSSA-N	0	3	337.423	3.148	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCC[C@H]1NC(=O)CC1CCC1	ZINC001036970614	1343900024	/nfs/dbraw/zinc/90/00/24/1343900024.db2.gz	PBZUOJUNGNLARY-RTBURBONSA-N	0	3	325.456	3.123	20	30		EGEDHN
CC(C)(C(=O)N[C@@H]1CCC[C@H]1CNCc1ccccc1C#N)C1CC1	ZINC001037059974	1343954896	/nfs/dbraw/zinc/95/48/96/1343954896.db2.gz	HFUANKQCJFDCQE-PKOBYXMFSA-N	0	3	339.483	3.369	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCC[C@@H]2CNCc2cnc(C)o2)CC1	ZINC001037070189	1343963211	/nfs/dbraw/zinc/96/32/11/1343963211.db2.gz	NMDIFMSPUBRNBE-SJLPKXTDSA-N	0	3	331.460	3.104	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCC[C@@H]1NC(=O)C1CC2(CC2)C1	ZINC001037075527	1343968400	/nfs/dbraw/zinc/96/84/00/1343968400.db2.gz	QVNPUNBXPPAUOM-HKUYNNGSSA-N	0	3	337.467	3.123	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCC[C@H]2CNCc2cc(C)no2)C1	ZINC001037236517	1344060149	/nfs/dbraw/zinc/06/01/49/1344060149.db2.gz	RPUNVXSYLBWEMY-DOTOQJQBSA-N	0	3	331.460	3.104	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](NCc2cc(C)n(C)n2)[C@@H](CC)C1	ZINC001037902773	1344168227	/nfs/dbraw/zinc/16/82/27/1344168227.db2.gz	GXTQSQUPZVSTQE-FUHWJXTLSA-N	0	3	346.519	3.048	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](NCc3cc(C)no3)[C@H](CC)C2)C1	ZINC001037915776	1344176378	/nfs/dbraw/zinc/17/63/78/1344176378.db2.gz	RVHGXNNEJZAORH-NVXWUHKLSA-N	0	3	331.460	3.056	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3cc(C)no3)[C@@H](CC)C2)CC1	ZINC001037924877	1344184424	/nfs/dbraw/zinc/18/44/24/1344184424.db2.gz	MDEOAOBKIIKUES-LPHOPBHVSA-N	0	3	345.487	3.446	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)[C@@H]1CC[C@H](c2ccccc2)O1	ZINC001038258726	1344346901	/nfs/dbraw/zinc/34/69/01/1344346901.db2.gz	SNVNXZYKNWWTOU-QRVBRYPASA-N	0	3	328.456	3.063	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NC[C@H]1CCN1CCC(C)(C)C	ZINC001038428462	1344424527	/nfs/dbraw/zinc/42/45/27/1344424527.db2.gz	RDOZKODDXSPWIP-MRXNPFEDSA-N	0	3	330.472	3.492	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1ccc2c(c1)C(C)(C)CO2	ZINC001038496315	1344452665	/nfs/dbraw/zinc/45/26/65/1344452665.db2.gz	MZSDYAJLPCNQKL-MRXNPFEDSA-N	0	3	328.456	3.127	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1ccccc1OC1CCC1	ZINC001038676466	1344538050	/nfs/dbraw/zinc/53/80/50/1344538050.db2.gz	KNAVXEOIQPKGHJ-MRXNPFEDSA-N	0	3	328.456	3.388	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2ccccc2)CC[C@H]1c1ccc(F)cc1	ZINC001079148874	1357196570	/nfs/dbraw/zinc/19/65/70/1357196570.db2.gz	QCPCQMPKRXSYDI-VQTJNVASSA-N	0	3	336.410	3.047	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1ccc(COC(C)C)cc1	ZINC001039012288	1344715092	/nfs/dbraw/zinc/71/50/92/1344715092.db2.gz	LMINDQSMUCPWJX-LJQANCHMSA-N	0	3	330.472	3.382	20	30		EGEDHN
CCC(=O)N1CCC([C@@H]2CCN(Cc3cc(C#N)ccc3F)C2)CC1	ZINC001039105290	1344776350	/nfs/dbraw/zinc/77/63/50/1344776350.db2.gz	XPRPNYQGKZTOIA-QGZVFWFLSA-N	0	3	343.446	3.168	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)C3(C(F)F)CC3)CC2)C1	ZINC001039129679	1344808555	/nfs/dbraw/zinc/80/85/55/1344808555.db2.gz	CNWLWVLGXDPWEH-AWEZNQCLSA-N	0	3	346.849	3.345	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)c3cc(F)c[nH]3)CC2)C1	ZINC001039145026	1344826337	/nfs/dbraw/zinc/82/63/37/1344826337.db2.gz	SCKIMTYMSAZECQ-CQSZACIVSA-N	0	3	339.842	3.080	20	30		EGEDHN
CCC(=O)N1CCCC[C@@H]1[C@H]1CCN(Cc2ccc(C#N)c(F)c2)C1	ZINC001039179444	1344875580	/nfs/dbraw/zinc/87/55/80/1344875580.db2.gz	FVMWEQHMILDBEN-PKOBYXMFSA-N	0	3	343.446	3.310	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cscc2C)C1	ZINC001039204462	1344916111	/nfs/dbraw/zinc/91/61/11/1344916111.db2.gz	XZBWYZVXCVPAJT-AEFFLSMTSA-N	0	3	330.497	3.396	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cscc2C)C1	ZINC001039204464	1344916829	/nfs/dbraw/zinc/91/68/29/1344916829.db2.gz	XZBWYZVXCVPAJT-SJLPKXTDSA-N	0	3	330.497	3.396	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccc3cc(C)cn3c2)C1	ZINC001039209146	1344921702	/nfs/dbraw/zinc/92/17/02/1344921702.db2.gz	GZQRURSSDMLKBD-WIYYLYMNSA-N	0	3	349.478	3.198	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2c[nH]c3ccccc23)C1	ZINC001039217445	1344933806	/nfs/dbraw/zinc/93/38/06/1344933806.db2.gz	HBSQBFYGUQNWOP-OXJNMPFZSA-N	0	3	335.451	3.118	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccoc2CC)C1	ZINC001039221314	1344939084	/nfs/dbraw/zinc/93/90/84/1344939084.db2.gz	NQLFXRMTDRUFMO-AEFFLSMTSA-N	0	3	328.456	3.182	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc(C)c(C)cn2)C1	ZINC001039227021	1344945941	/nfs/dbraw/zinc/94/59/41/1344945941.db2.gz	ANZCYWSMCXBBNU-UYAOXDASSA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2csc(Cl)c2)C1	ZINC001039229486	1344949144	/nfs/dbraw/zinc/94/91/44/1344949144.db2.gz	DTISLQWEUTZKQB-ZFWWWQNUSA-N	0	3	336.888	3.351	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cncc(Cl)c2)C1	ZINC001039229983	1344949729	/nfs/dbraw/zinc/94/97/29/1344949729.db2.gz	HFFFJHCJOAMRQG-QAPCUYQASA-N	0	3	345.874	3.075	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(Cl)cs2)C1	ZINC001039233276	1344953162	/nfs/dbraw/zinc/95/31/62/1344953162.db2.gz	AGJYRSMSCBOIFG-HIFRSBDPSA-N	0	3	336.888	3.351	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc3ccccn3c2)C1	ZINC001039235819	1344957233	/nfs/dbraw/zinc/95/72/33/1344957233.db2.gz	RGJOUCGDPDEZCZ-GHTZIAJQSA-N	0	3	349.478	3.279	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)Cc2ccccc2Cl)C1	ZINC001039239507	1344964152	/nfs/dbraw/zinc/96/41/52/1344964152.db2.gz	NPWUHNWFOZJXSC-PKOBYXMFSA-N	0	3	344.886	3.219	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(OC)cc2)C1	ZINC001039242383	1344968738	/nfs/dbraw/zinc/96/87/38/1344968738.db2.gz	BIRSTQQQLGONJN-UYAOXDASSA-N	0	3	340.467	3.035	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cccn2C(C)C)C1	ZINC001039242754	1344969761	/nfs/dbraw/zinc/96/97/61/1344969761.db2.gz	QTZSYURPHFPCNN-QZTJIDSGSA-N	0	3	327.472	3.019	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2sccc2CC)C1	ZINC001039244746	1344973160	/nfs/dbraw/zinc/97/31/60/1344973160.db2.gz	YTJCVEQRBREGQM-IAGOWNOFSA-N	0	3	330.497	3.260	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccc(F)c(Cl)c2)C1	ZINC001039246548	1344976367	/nfs/dbraw/zinc/97/63/67/1344976367.db2.gz	SOWOLNYUUVCUHK-MAUKXSAKSA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(F)cc2C)C1	ZINC001039256238	1344985949	/nfs/dbraw/zinc/98/59/49/1344985949.db2.gz	ISRIBBPWLNTUFU-PXNSSMCTSA-N	0	3	342.458	3.474	20	30		EGEDHN
Cc1ccc(CN2CC[C@H]3CC[C@@H](C2)N3C(=O)[C@@H](C)C#N)c(C)c1	ZINC001039349378	1345023479	/nfs/dbraw/zinc/02/34/79/1345023479.db2.gz	VGDYJQUWDKVMBO-UHOSZYNNSA-N	0	3	325.456	3.028	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(C#N)c[nH]1	ZINC001039363104	1345029670	/nfs/dbraw/zinc/02/96/70/1345029670.db2.gz	WKLFJKIUGIJVBS-IPELMVKDSA-N	0	3	348.450	3.326	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1coc2cc(F)ccc12	ZINC001039373955	1345032586	/nfs/dbraw/zinc/03/25/86/1345032586.db2.gz	VZHTWFGAZOQCEN-SJORKVTESA-N	0	3	342.414	3.366	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cnc2n1[C@@H](C)CCC2	ZINC001039379999	1345036164	/nfs/dbraw/zinc/03/61/64/1345036164.db2.gz	GKNOGAILWKLMJF-BBWFWOEESA-N	0	3	342.487	3.035	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccn(C2CCCC2)n1	ZINC001039381894	1345036339	/nfs/dbraw/zinc/03/63/39/1345036339.db2.gz	LPUZRVPEAWUBNN-MSOLQXFVSA-N	0	3	342.487	3.253	20	30		EGEDHN
C=CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1c(C)noc1C(C)C	ZINC001039389317	1345040202	/nfs/dbraw/zinc/04/02/02/1345040202.db2.gz	NGBLHBPGBCHIOM-CVEARBPZSA-N	0	3	331.460	3.361	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2cc(C)ccc2n1	ZINC001039403404	1345048833	/nfs/dbraw/zinc/04/88/33/1345048833.db2.gz	USESOMOODMAILN-MOPGFXCFSA-N	0	3	347.462	3.245	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(F)ccc1Cl	ZINC001039442281	1345068945	/nfs/dbraw/zinc/06/89/45/1345068945.db2.gz	XAFXBUKPSWUSFN-CABCVRRESA-N	0	3	334.822	3.181	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cn(CC)nc1C(C)C	ZINC001039445214	1345070825	/nfs/dbraw/zinc/07/08/25/1345070825.db2.gz	IXIHXFSIDPEACG-SJORKVTESA-N	0	3	344.503	3.281	20	30		EGEDHN
C=CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc([C@@H](C)CC)no1	ZINC001039449237	1345073843	/nfs/dbraw/zinc/07/38/43/1345073843.db2.gz	OTPJFWIQBBYBSL-XHSDSOJGSA-N	0	3	331.460	3.443	20	30		EGEDHN
C=CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc2nc(C)ccc2o1	ZINC001039460962	1345079476	/nfs/dbraw/zinc/07/94/76/1345079476.db2.gz	PGWQZWDCXZDMOM-CVEARBPZSA-N	0	3	339.439	3.391	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)Oc1ccc(C)cc1	ZINC001039467273	1345084810	/nfs/dbraw/zinc/08/48/10/1345084810.db2.gz	BOEMMCAMKMQSPJ-OTWHNJEPSA-N	0	3	342.483	3.404	20	30		EGEDHN
CC(F)(F)C(=O)N1CC[C@]2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001040037490	1345303119	/nfs/dbraw/zinc/30/31/19/1345303119.db2.gz	ZPLRYKQOQBWTKE-LJQANCHMSA-N	0	3	347.409	3.028	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@]3(CCN(C(=O)c4ccco4)C3)C2)c1	ZINC001040044344	1345308545	/nfs/dbraw/zinc/30/85/45/1345308545.db2.gz	QJFCPLAGOCTDFY-NRFANRHFSA-N	0	3	349.434	3.280	20	30		EGEDHN
CC(C)C(=O)N1CC[C@@]2(C1)CCCN(Cc1cccc(C#N)c1)C2	ZINC001040079778	1345325435	/nfs/dbraw/zinc/32/54/35/1345325435.db2.gz	IBCQRYLEJSARRY-FQEVSTJZSA-N	0	3	325.456	3.029	20	30		EGEDHN
Cc1cc(F)ccc1CN1CCC[C@@]2(CCN(C(=O)[C@H](C)C#N)C2)C1	ZINC001040128187	1345343852	/nfs/dbraw/zinc/34/38/52/1345343852.db2.gz	XLPAUYPCGPMMBP-OXQOHEQNSA-N	0	3	343.446	3.108	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@@H]3C[C@H]3CC(C)(C)C)C2)C1	ZINC001040211552	1345377373	/nfs/dbraw/zinc/37/73/73/1345377373.db2.gz	XDUSWBUEJMNUKZ-WAOWUJCRSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cc(C)c(F)cc3F)C2)C1	ZINC001040253468	1345396999	/nfs/dbraw/zinc/39/69/99/1345396999.db2.gz	JANPWGBOWRNBDV-HXUWFJFHSA-N	0	3	346.421	3.225	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3cc(C)ccc3C3CC3)C2)C1	ZINC001040307799	1345424432	/nfs/dbraw/zinc/42/44/32/1345424432.db2.gz	BWLUBDDHUVKZPL-JOCHJYFZSA-N	0	3	336.479	3.434	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CC[C@]3(C2)CCCN(C[C@H](F)CC)C3)cc1	ZINC001040323375	1345432782	/nfs/dbraw/zinc/43/27/82/1345432782.db2.gz	QMMPRGJBDOPNEQ-TZIWHRDSSA-N	0	3	342.458	3.344	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ccn(C(C)C)c3C)C2)C1	ZINC001040349403	1345447273	/nfs/dbraw/zinc/44/72/73/1345447273.db2.gz	FPZBTTQXOTWTRX-OAQYLSRUSA-N	0	3	341.499	3.329	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3c(F)ccc(F)c3F)C2)C1	ZINC001040361211	1345454690	/nfs/dbraw/zinc/45/46/90/1345454690.db2.gz	QRNMMLSRXUUMRD-SFHVURJKSA-N	0	3	338.373	3.218	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@]2(C1)CCCN(Cc1cccnc1)C2	ZINC001040370909	1345460011	/nfs/dbraw/zinc/46/00/11/1345460011.db2.gz	FKWRHVJPPHZJRS-NHCUHLMSSA-N	0	3	341.499	3.498	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)Cc3cccc(Cl)c3)C2)C1	ZINC001040372815	1345460556	/nfs/dbraw/zinc/46/05/56/1345460556.db2.gz	ROGGICBHQFZBIZ-HXUWFJFHSA-N	0	3	344.886	3.220	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3sccc3COC)C2)C1	ZINC001040494308	1345519555	/nfs/dbraw/zinc/51/95/55/1345519555.db2.gz	WGOUXXFNYCGCLO-SFHVURJKSA-N	0	3	334.485	3.009	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)Cc3ccc(C)c(C)c3)C2)C1	ZINC001040520651	1345531223	/nfs/dbraw/zinc/53/12/23/1345531223.db2.gz	UVVXNOPHNGBPMJ-JOCHJYFZSA-N	0	3	338.495	3.184	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)CCc3ccccc3F)C2)C1	ZINC001040524937	1345533104	/nfs/dbraw/zinc/53/31/04/1345533104.db2.gz	OLQUBXCBDFZREU-NRFANRHFSA-N	0	3	342.458	3.096	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3c(Cl)cccc3OC)C2)C1	ZINC001040544644	1345539272	/nfs/dbraw/zinc/53/92/72/1345539272.db2.gz	YUGQKGRJAPUMDZ-IBGZPJMESA-N	0	3	348.874	3.463	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@@H]3CCCc4ccccc43)C2)CC1	ZINC001040747275	1345574040	/nfs/dbraw/zinc/57/40/40/1345574040.db2.gz	NLAAOUFRBLUSCC-HXUWFJFHSA-N	0	3	336.479	3.054	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC2(C1)CCN(Cc1conc1CC)CC2	ZINC001040802050	1345579422	/nfs/dbraw/zinc/57/94/22/1345579422.db2.gz	FJYFVJDLKHBPKK-UHFFFAOYSA-N	0	3	345.487	3.264	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)C(C3CCC3)C3CCC3)C2)CC1	ZINC001040820743	1345582424	/nfs/dbraw/zinc/58/24/24/1345582424.db2.gz	VRAKLQMRQMLBQW-UHFFFAOYSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@H](C)OC3CCCCCC3)C2)CC1	ZINC001040841638	1345587247	/nfs/dbraw/zinc/58/72/47/1345587247.db2.gz	KZOICZKBTGXQQS-SFHVURJKSA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccc(Cl)c(F)c3)C2)CC1	ZINC001040861230	1345589040	/nfs/dbraw/zinc/58/90/40/1345589040.db2.gz	IWWLVHQSYHIZLX-UHFFFAOYSA-N	0	3	334.822	3.040	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@H](F)CC3CCCCC3)C2)CC1	ZINC001040914187	1345599377	/nfs/dbraw/zinc/59/93/77/1345599377.db2.gz	KYOQRKNPHNARIK-GOSISDBHSA-N	0	3	334.479	3.243	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)Cc3cccc4ccccc43)C2)CC1	ZINC001040920291	1345601018	/nfs/dbraw/zinc/60/10/18/1345601018.db2.gz	LYSDOBXDRSOEJP-UHFFFAOYSA-N	0	3	346.474	3.330	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cc(C)c(C)s3)C2)CC1	ZINC001040930123	1345603336	/nfs/dbraw/zinc/60/33/36/1345603336.db2.gz	LMIVKTIVUUYZQG-UHFFFAOYSA-N	0	3	330.497	3.316	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001041077242	1345646433	/nfs/dbraw/zinc/64/64/33/1345646433.db2.gz	GAXWLYLUOWTLAL-NRFANRHFSA-N	0	3	339.483	3.419	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccc4nccc(C)c4c3)C2)C1	ZINC001041321148	1345702394	/nfs/dbraw/zinc/70/23/94/1345702394.db2.gz	HVJDMFFADIKAFF-JOCHJYFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cc4ccccc4nc3C)C2)C1	ZINC001041335681	1345705157	/nfs/dbraw/zinc/70/51/57/1345705157.db2.gz	AGYJXGCVNHPWLQ-JOCHJYFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)CCc3ccc4[nH]ccc4c3)C2)C1	ZINC001041478160	1345740503	/nfs/dbraw/zinc/74/05/03/1345740503.db2.gz	FODARISIPFKNKW-JOCHJYFZSA-N	0	3	349.478	3.048	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3cc(C)c(C)cc3Cl)C2)C1	ZINC001041540304	1345756373	/nfs/dbraw/zinc/75/63/73/1345756373.db2.gz	MEGRQTADLMUBEO-LJQANCHMSA-N	0	3	330.859	3.128	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@]3(CCN(Cc4ncccc4C)C3)C2)C1	ZINC001041653162	1345811752	/nfs/dbraw/zinc/81/17/52/1345811752.db2.gz	PREWOBTYKWIJHV-OAQYLSRUSA-N	0	3	339.483	3.171	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccc(C4CC4)s3)C2)C1	ZINC001041787724	1345850458	/nfs/dbraw/zinc/85/04/58/1345850458.db2.gz	SRRQDAPBUWVYJA-IBGZPJMESA-N	0	3	328.481	3.187	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccc4ccccc4c3)C2)C1	ZINC001041803309	1345856512	/nfs/dbraw/zinc/85/65/12/1345856512.db2.gz	COJMDJOCLQUWNN-JOCHJYFZSA-N	0	3	332.447	3.401	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3oc4c(cccc4C)c3C)C2)C1	ZINC001041845506	1345871618	/nfs/dbraw/zinc/87/16/18/1345871618.db2.gz	FZGDTACAMIWPLX-NRFANRHFSA-N	0	3	336.435	3.221	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3cc4cccc(Cl)c4o3)C2)C1	ZINC001041868155	1345877493	/nfs/dbraw/zinc/87/74/93/1345877493.db2.gz	FYXKADJSMLCUPF-IBGZPJMESA-N	0	3	342.826	3.257	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3CCN(C(=O)C4=CCCC4)C[C@H]32)cc1	ZINC001042009224	1345923677	/nfs/dbraw/zinc/92/36/77/1345923677.db2.gz	CJTLTKYQHLEUFI-AZUAARDMSA-N	0	3	335.451	3.091	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cccc(C(F)F)c3F)C[C@@H]21	ZINC001042065328	1345934130	/nfs/dbraw/zinc/93/41/30/1345934130.db2.gz	RGLNXQWAWVYVRL-WFASDCNBSA-N	0	3	338.373	3.486	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cccc(Cl)c3C)C[C@@H]21	ZINC001042067185	1345935076	/nfs/dbraw/zinc/93/50/76/1345935076.db2.gz	OHOCIPOAFKEDLC-YJBOKZPZSA-N	0	3	330.859	3.208	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3ccoc3C(F)(F)F)C[C@@H]21	ZINC001042076069	1345938984	/nfs/dbraw/zinc/93/89/84/1345938984.db2.gz	QRAFYVHHYIJIFP-OCCSQVGLSA-N	0	3	342.361	3.411	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3conc3C3CCCC3)C[C@H]21	ZINC001042091823	1345941706	/nfs/dbraw/zinc/94/17/06/1345941706.db2.gz	YMXCNYPWIYNFGH-CRAIPNDOSA-N	0	3	343.471	3.445	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3nc(C(C)(C)C)cs3)C[C@H]21	ZINC001042103003	1345944787	/nfs/dbraw/zinc/94/47/87/1345944787.db2.gz	QTFUXSFQTJGEFG-HUUCEWRRSA-N	0	3	345.512	3.000	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)Cc3ccc(C)cc3Cl)C[C@H]21	ZINC001042119799	1345949091	/nfs/dbraw/zinc/94/90/91/1345949091.db2.gz	JQIMOUGJRWVXBE-VQIMIIECSA-N	0	3	344.886	3.137	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(F)cc4ccoc43)C[C@@H]21	ZINC001042121452	1345949716	/nfs/dbraw/zinc/94/97/16/1345949716.db2.gz	HGTCASVTRNLRAF-DYVFJYSZSA-N	0	3	328.387	3.294	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3coc4ccc(OC)cc43)C[C@@H]21	ZINC001042147929	1345956992	/nfs/dbraw/zinc/95/69/92/1345956992.db2.gz	HTIVQBBUBPXZEM-KSSFIOAISA-N	0	3	340.423	3.164	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3ccc(C#N)cc3)[C@@H]2C1	ZINC001042188633	1345976206	/nfs/dbraw/zinc/97/62/06/1345976206.db2.gz	VNAXGLJMIPASMJ-RTBURBONSA-N	0	3	337.467	3.193	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3sc(C)cc3OC)C[C@@H]21	ZINC001042260215	1346009250	/nfs/dbraw/zinc/00/92/50/1346009250.db2.gz	UJEDALCJOUCVAV-GJZGRUSLSA-N	0	3	334.485	3.178	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C3(Cc4ccccc4F)CC3)C[C@H]21	ZINC001042266546	1346012426	/nfs/dbraw/zinc/01/24/26/1346012426.db2.gz	NHODBXPROZMDMP-VQIMIIECSA-N	0	3	342.458	3.257	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(C(F)F)cc3F)C[C@H]21	ZINC001042285249	1346017316	/nfs/dbraw/zinc/01/73/16/1346017316.db2.gz	MOPHWGKKCFTDMP-MLGOLLRUSA-N	0	3	338.373	3.486	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cccc(N4CCCC4)c3)C[C@H]21	ZINC001042286768	1346018023	/nfs/dbraw/zinc/01/80/23/1346018023.db2.gz	CLQJLEXPGZQWRQ-YLJYHZDGSA-N	0	3	339.483	3.009	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C(C)(C)c3cccc(OC)c3)C[C@@H]21	ZINC001042297785	1346022166	/nfs/dbraw/zinc/02/21/66/1346022166.db2.gz	VLEKWFWVUVKBLD-APWZRJJASA-N	0	3	342.483	3.082	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)C(C)(C)c3ccc(C)cc3)C[C@H]21	ZINC001042315766	1346030247	/nfs/dbraw/zinc/03/02/47/1346030247.db2.gz	CDHVSEUNMFBZAC-AZUAARDMSA-N	0	3	338.495	3.219	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)Cc3c(F)cccc3Cl)C[C@@H]21	ZINC001042331197	1346038500	/nfs/dbraw/zinc/03/85/00/1346038500.db2.gz	NYQPIRQYXRZFDW-GUYCJALGSA-N	0	3	336.838	3.130	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc4[nH]c(C)c(C)c4c3)C[C@@H]21	ZINC001042348200	1346049145	/nfs/dbraw/zinc/04/91/45/1346049145.db2.gz	HFEGPZSQGVABSR-UTKZUKDTSA-N	0	3	349.478	3.344	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3cc(C4CCCC4)no3)C[C@H]21	ZINC001042363470	1346057123	/nfs/dbraw/zinc/05/71/23/1346057123.db2.gz	UIGZFXHHSAMMSI-FUHWJXTLSA-N	0	3	343.471	3.445	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)CC3C4CC5CC(C4)CC3C5)C[C@H]21	ZINC001042366838	1346058781	/nfs/dbraw/zinc/05/87/81/1346058781.db2.gz	YJKSWHMKAVUOGZ-OFCVNSCPSA-N	0	3	340.511	3.005	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc(-c4ccccc4)[nH]3)C[C@@H]21	ZINC001042373481	1346061994	/nfs/dbraw/zinc/06/19/94/1346061994.db2.gz	GPHFLTOHTHFTPL-NQIIRXRSSA-N	0	3	347.462	3.241	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cscc3C(F)(F)F)C[C@@H]21	ZINC001042383840	1346065942	/nfs/dbraw/zinc/06/59/42/1346065942.db2.gz	YOAWPYKAWGKRJI-RISCZKNCSA-N	0	3	344.402	3.489	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)C(C)(C)c3ccccc3C)C[C@H]21	ZINC001042382288	1346066148	/nfs/dbraw/zinc/06/61/48/1346066148.db2.gz	GJCKTPDYQWAABN-AZUAARDMSA-N	0	3	338.495	3.219	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)c1ccccc1	ZINC001044424954	1346326140	/nfs/dbraw/zinc/32/61/40/1346326140.db2.gz	HPYRCORPQVAIBP-OXQOHEQNSA-N	0	3	333.435	3.341	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@@H](NCc2ccccc2C#N)C[C@@H]1C	ZINC001044471509	1346342947	/nfs/dbraw/zinc/34/29/47/1346342947.db2.gz	OMSMJPUMPDTZJT-HNAYVOBHSA-N	0	3	327.472	3.464	20	30		EGEDHN
Cc1cocc1C(=O)N1CC[C@H](NCc2ccccc2C#N)C[C@@H]1C	ZINC001044706552	1346407189	/nfs/dbraw/zinc/40/71/89/1346407189.db2.gz	CEMCLPSHMVIWKW-YJBOKZPZSA-N	0	3	337.423	3.243	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3cnc(C)cn3)C[C@@H]2C)CC1	ZINC001044728608	1346413517	/nfs/dbraw/zinc/41/35/17/1346413517.db2.gz	APCSXTQEKHMWLB-WMZOPIPTSA-N	0	3	342.487	3.001	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3cnc(C)cn3)C[C@H]2C)CC1	ZINC001044728605	1346413693	/nfs/dbraw/zinc/41/36/93/1346413693.db2.gz	APCSXTQEKHMWLB-AEFFLSMTSA-N	0	3	342.487	3.001	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3cc(C)no3)C[C@@H]2C)CC1	ZINC001044730904	1346414881	/nfs/dbraw/zinc/41/48/81/1346414881.db2.gz	SBMHAJZZTHCSHB-RDJZCZTQSA-N	0	3	331.460	3.199	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)[C@@H]2CC=CCC2)c(F)c1	ZINC001044919213	1346462630	/nfs/dbraw/zinc/46/26/30/1346462630.db2.gz	KEVGMXUEMOARSN-AEFFLSMTSA-N	0	3	341.430	3.134	20	30		EGEDHN
C/C(=C/C(=O)N1CCC[C@H]1CNCc1ccc(C#N)cc1F)C1CC1	ZINC001044943227	1346467055	/nfs/dbraw/zinc/46/70/55/1346467055.db2.gz	LTWVGKODDDTNDK-WAFIBAPDSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H]1CNCc1c(C)onc1CC	ZINC001045148896	1346506509	/nfs/dbraw/zinc/50/65/09/1346506509.db2.gz	JJLFYZIOHHUUFQ-HNNXBMFYSA-N	0	3	333.476	3.228	20	30		EGEDHN
C=C[C@@H](C(=O)N1CCC[C@H]1CNCc1cccnc1)c1ccccc1	ZINC001045320136	1346558813	/nfs/dbraw/zinc/55/88/13/1346558813.db2.gz	NHDNZBBQMLZFLW-VQTJNVASSA-N	0	3	335.451	3.132	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2[nH]c3ccccc3c2Cl)CC1	ZINC001045488456	1346606998	/nfs/dbraw/zinc/60/69/98/1346606998.db2.gz	SOYRLVIWPAGSAL-UHFFFAOYSA-N	0	3	343.858	3.429	20	30		EGEDHN
CC1(NC(=O)[C@@H]2CC23CCC3)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045571608	1346631976	/nfs/dbraw/zinc/63/19/76/1346631976.db2.gz	FSSBOJABEZDCMX-SFHVURJKSA-N	0	3	337.467	3.219	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2ccnc(O[C@@H](C)CC)c2)CC1	ZINC001045614623	1346647771	/nfs/dbraw/zinc/64/77/71/1346647771.db2.gz	PEQWEFXILJDMPI-HNNXBMFYSA-N	0	3	331.460	3.029	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1cccc(C#N)c1)C1CC1	ZINC001045747744	1346687205	/nfs/dbraw/zinc/68/72/05/1346687205.db2.gz	RDCSHYYNOGFVRD-YSGRDPCXSA-N	0	3	337.467	3.170	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccccc1F)C2	ZINC001045908107	1346745209	/nfs/dbraw/zinc/74/52/09/1346745209.db2.gz	BCSWBMBSDNQENS-FQEVSTJZSA-N	0	3	328.431	3.167	20	30		EGEDHN
CC(C)C(=O)N1CCCC[C@]2(CCN(Cc3ccc(C#N)s3)C2)C1	ZINC001045918504	1346755334	/nfs/dbraw/zinc/75/53/34/1346755334.db2.gz	KSEVRNDPNQYEKF-LJQANCHMSA-N	0	3	345.512	3.480	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cccc(F)c1C)C2	ZINC001045940051	1346775980	/nfs/dbraw/zinc/77/59/80/1346775980.db2.gz	OUDTVCXUTHGPIC-FQEVSTJZSA-N	0	3	328.431	3.086	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc3occc3[nH]1)C2	ZINC001045945091	1346780766	/nfs/dbraw/zinc/78/07/66/1346780766.db2.gz	SKBKUPRTCFOQTR-HXUWFJFHSA-N	0	3	339.439	3.102	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1scnc1CC)C2	ZINC001045945129	1346780808	/nfs/dbraw/zinc/78/08/08/1346780808.db2.gz	UKTGMEKYALYHCY-LJQANCHMSA-N	0	3	345.512	3.047	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccn(CC)c1C)C2	ZINC001045961464	1346797171	/nfs/dbraw/zinc/79/71/71/1346797171.db2.gz	PGUWHCNYARCNQM-OAQYLSRUSA-N	0	3	341.499	3.158	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)C[C@H]1CCCC1(F)F)C2	ZINC001045961912	1346797189	/nfs/dbraw/zinc/79/71/89/1346797189.db2.gz	VDCIQWDEWAZRMZ-AEFFLSMTSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc3occc3s1)C2	ZINC001045966162	1346801236	/nfs/dbraw/zinc/80/12/36/1346801236.db2.gz	PVNNEKZOMQXMQW-IBGZPJMESA-N	0	3	342.464	3.446	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc(Cl)cn1)C2	ZINC001045980663	1346818381	/nfs/dbraw/zinc/81/83/81/1346818381.db2.gz	GEENOIOITCSPBG-IBGZPJMESA-N	0	3	345.874	3.077	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1c(F)cccc1Cl)C2	ZINC001045980887	1346818553	/nfs/dbraw/zinc/81/85/53/1346818553.db2.gz	LVKBDGGPRQAXSQ-IBGZPJMESA-N	0	3	348.849	3.431	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@H](C)n1c(C)ccc1C)C2	ZINC001045986638	1346828438	/nfs/dbraw/zinc/82/84/38/1346828438.db2.gz	WSEXHZKXQWMOKP-FPOVZHCZSA-N	0	3	341.499	3.004	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2ocnc2-c2ccccc2)C1	ZINC001046365979	1346951426	/nfs/dbraw/zinc/95/14/26/1346951426.db2.gz	PMGLRCCFCBAQEF-IBGZPJMESA-N	0	3	325.412	3.112	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@]2(C)CCN(Cc3ccc(C)cc3C)C2)c1	ZINC001046605287	1347036209	/nfs/dbraw/zinc/03/62/09/1347036209.db2.gz	QWTDMURPZWWVBG-JOCHJYFZSA-N	0	3	347.462	3.074	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@]2(C)CCN(Cc3ccc(C)c(C)c3)C2)cn1	ZINC001046779990	1347097215	/nfs/dbraw/zinc/09/72/15/1347097215.db2.gz	YZICIJUIWHOCPJ-QFIPXVFZSA-N	0	3	347.462	3.074	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)[C@@H]2C[C@H]2c2cccc(F)c2F)C1	ZINC001046850977	1347129576	/nfs/dbraw/zinc/12/95/76/1347129576.db2.gz	YTQGJGWEYAENHZ-QMTMVMCOSA-N	0	3	334.410	3.225	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2cccc(F)c2)C1	ZINC001046913228	1347151204	/nfs/dbraw/zinc/15/12/04/1347151204.db2.gz	UMKXIISNFFUVDA-AWEZNQCLSA-N	0	3	326.362	3.089	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@H](CNC(=O)C2CCC3(CC3)CC2)C1	ZINC001046957035	1347165433	/nfs/dbraw/zinc/16/54/33/1347165433.db2.gz	JXVLEMWSMNRGMH-MRXNPFEDSA-N	0	3	338.442	3.054	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@H](CNC(=O)C2CC(C(C)(C)C)C2)C1	ZINC001046996843	1347179318	/nfs/dbraw/zinc/17/93/18/1347179318.db2.gz	YGNGQIJIPXGHFE-UYSNPLJNSA-N	0	3	340.458	3.155	20	30		EGEDHN
O=C(N[C@@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1ccc(Cl)cc1)C2)C1CC1	ZINC001047007636	1347183984	/nfs/dbraw/zinc/18/39/84/1347183984.db2.gz	NJWXSQDZYUFYAI-IPELMVKDSA-N	0	3	342.870	3.071	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(C/C=C\Cl)C2	ZINC001047084249	1347204168	/nfs/dbraw/zinc/20/41/68/1347204168.db2.gz	JBCHSYDKIOMWKA-CQMQOEFUSA-N	0	3	333.863	3.009	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)Cc3ccsc3)C2)CC1	ZINC001047220542	1347252469	/nfs/dbraw/zinc/25/24/69/1347252469.db2.gz	AVDDWJWCXFJCDL-IBGZPJMESA-N	0	3	344.524	3.265	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3cc(C)c(C)o3)C2)CC1	ZINC001047235182	1347262967	/nfs/dbraw/zinc/26/29/67/1347262967.db2.gz	WBYNSJCSBBNPNQ-SFHVURJKSA-N	0	3	328.456	3.094	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)c3cc[nH]c3CC)C2)CC1	ZINC001047235702	1347263899	/nfs/dbraw/zinc/26/38/99/1347263899.db2.gz	ARJACGVASZKTFJ-GOSISDBHSA-N	0	3	341.499	3.165	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)c3ccoc3CC)C2)CC1	ZINC001047238082	1347265336	/nfs/dbraw/zinc/26/53/36/1347265336.db2.gz	YMFONQDGQSOJKR-GOSISDBHSA-N	0	3	342.483	3.430	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3cccc(F)c3C)C2)CC1	ZINC001047240830	1347266791	/nfs/dbraw/zinc/26/67/91/1347266791.db2.gz	IEUXUCNBMKZDPK-SFHVURJKSA-N	0	3	342.458	3.332	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)Cc3cccc(C)c3)C2)CC1	ZINC001047253133	1347277273	/nfs/dbraw/zinc/27/72/73/1347277273.db2.gz	SRNSYRFCNBOVGH-OAQYLSRUSA-N	0	3	338.495	3.121	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3ccc4[nH]ccc4c3)C2)CC1	ZINC001047252791	1347277301	/nfs/dbraw/zinc/27/73/01/1347277301.db2.gz	JPPKHFBZGYKCQG-HXUWFJFHSA-N	0	3	349.478	3.365	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3ccc(CC)cc3)C2)CC1	ZINC001047263796	1347285074	/nfs/dbraw/zinc/28/50/74/1347285074.db2.gz	CSWHTDXOQHIYOZ-OAQYLSRUSA-N	0	3	338.495	3.446	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3oc(CC)cc3C)C2)CC1	ZINC001047265321	1347286379	/nfs/dbraw/zinc/28/63/79/1347286379.db2.gz	YOFBPSALYPWSMJ-SFHVURJKSA-N	0	3	342.483	3.348	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)c2cccs2)C1	ZINC001047692245	1347333950	/nfs/dbraw/zinc/33/39/50/1347333950.db2.gz	KKCRISFPOAYMMI-WMLDXEAASA-N	0	3	339.464	3.260	20	30		EGEDHN
C[C@H](NCc1cc(F)ccc1C#N)[C@H]1CCN(C(=O)C=C2CCC2)C1	ZINC001047799997	1347376438	/nfs/dbraw/zinc/37/64/38/1347376438.db2.gz	OLRYTZJOSZPVTD-YOEHRIQHSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@H]([C@H](C)NCc2nccs2)C1	ZINC001047852058	1347388943	/nfs/dbraw/zinc/38/89/43/1347388943.db2.gz	DHGFGHBYBSQUKC-AAEUAGOBSA-N	0	3	341.908	3.248	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H]([C@@H](C)NCc2cnc(C)o2)C1	ZINC001047856059	1347390548	/nfs/dbraw/zinc/39/05/48/1347390548.db2.gz	QNYWNXZNGKCFLK-BXUZGUMPSA-N	0	3	339.867	3.088	20	30		EGEDHN
CC(C)=C(F)C(=O)N1C[C@H](C)[C@H](CNCc2ccccc2C#N)C1	ZINC001048203848	1347493182	/nfs/dbraw/zinc/49/31/82/1347493182.db2.gz	KXIDRRSKXHEITE-WMLDXEAASA-N	0	3	329.419	3.006	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@@H](CNCc2cscn2)[C@H](C)C1	ZINC001048272250	1347507835	/nfs/dbraw/zinc/50/78/35/1347507835.db2.gz	WZRDIUVZXQDCKH-DGCLKSJQSA-N	0	3	341.908	3.106	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2(F)CCCC2)C[C@H]1CNCc1ccccc1C#N	ZINC001048295914	1347511820	/nfs/dbraw/zinc/51/18/20/1347511820.db2.gz	RPKUYAUVHXAFKW-CRAIPNDOSA-N	0	3	343.446	3.025	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](C)[C@@H](CNCc2ccccc2C#N)C1	ZINC001048338012	1347522274	/nfs/dbraw/zinc/52/22/74/1347522274.db2.gz	HLTILFDKFXFSFG-LPHOPBHVSA-N	0	3	339.483	3.345	20	30		EGEDHN
CCC(C)(C)C(=O)N1C[C@@H](CNCc2cc(F)ccc2C#N)[C@H](C)C1	ZINC001048357927	1347529679	/nfs/dbraw/zinc/52/96/79/1347529679.db2.gz	HXWMWGRSHRCSRZ-RHSMWYFYSA-N	0	3	345.462	3.318	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)[C@H]2CC[C@@H](F)C2)CC1	ZINC001048626676	1347624297	/nfs/dbraw/zinc/62/42/97/1347624297.db2.gz	SVEFYOUUPYMCNH-DLBZAZTESA-N	0	3	345.462	3.199	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)[C@H]2C[C@]2(C)CC)CC1	ZINC001048629179	1347625109	/nfs/dbraw/zinc/62/51/09/1347625109.db2.gz	SALSBXPVRJXAPM-CTNGQTDRSA-N	0	3	341.499	3.497	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc4ccc(F)cc4s3)C[C@@H]2C1	ZINC001048924679	1347685351	/nfs/dbraw/zinc/68/53/51/1347685351.db2.gz	GIAGRVGAIBPMMQ-GASCZTMLSA-N	0	3	342.439	3.068	20	30		EGEDHN
C#Cc1ccc(C(=O)N2C[C@H]3CN(Cc4ccccc4F)C[C@H]3C2)cc1	ZINC001048973198	1347695281	/nfs/dbraw/zinc/69/52/81/1347695281.db2.gz	HAIUQWRSGFMGTE-BGYRXZFFSA-N	0	3	348.421	3.011	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc(F)c4ccccc34)C[C@@H]2C1	ZINC001049075853	1347719436	/nfs/dbraw/zinc/71/94/36/1347719436.db2.gz	DPNLRRPLKPZOBV-IYBDPMFKSA-N	0	3	336.410	3.006	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc(C(C)C)c(Cl)c3)C[C@@H]2C1	ZINC001049244006	1347756842	/nfs/dbraw/zinc/75/68/42/1347756842.db2.gz	LTFDSCXBSPCIEE-CALCHBBNSA-N	0	3	344.886	3.491	20	30		EGEDHN
CC1CC(C(=O)N2CCC[C@@H]3[C@H]2CCN3Cc2cccc(C#N)c2)C1	ZINC001049408020	1347830865	/nfs/dbraw/zinc/83/08/65/1347830865.db2.gz	TZIFWURYVBUROP-CVMOCDCISA-N	0	3	337.467	3.170	20	30		EGEDHN
CC1CC(C(=O)N2CCC[C@H]3[C@@H]2CCN3Cc2cccc(C#N)c2)C1	ZINC001049408027	1347831349	/nfs/dbraw/zinc/83/13/49/1347831349.db2.gz	TZIFWURYVBUROP-YIGDWTTGSA-N	0	3	337.467	3.170	20	30		EGEDHN
C=C(C)CCN1C[C@@H](C)[C@H](NC(=O)c2snc(Cl)c2Cl)C1	ZINC001079768916	1357376346	/nfs/dbraw/zinc/37/63/46/1357376346.db2.gz	SCSCMQNNVDDXMO-NXEZZACHSA-N	0	3	348.299	3.466	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1oc(CC2CC2)nc1C	ZINC001049470941	1347864492	/nfs/dbraw/zinc/86/44/92/1347864492.db2.gz	URYUBEZYAVQWJS-DLBZAZTESA-N	0	3	343.471	3.191	20	30		EGEDHN
C=CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cnc([C@H](C)OC)s1	ZINC001049472256	1347865297	/nfs/dbraw/zinc/86/52/97/1347865297.db2.gz	ADGQTFFWFLIIMS-RRFJBIMHSA-N	0	3	349.500	3.106	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1sccc1C	ZINC001049475327	1347867196	/nfs/dbraw/zinc/86/71/96/1347867196.db2.gz	SZTQXDVFOFXTMV-BDXSIMOUSA-N	0	3	342.508	3.249	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccn(C2CCCCC2)n1	ZINC001049476139	1347867782	/nfs/dbraw/zinc/86/77/82/1347867782.db2.gz	WNWIEICNPJZPBW-RTBURBONSA-N	0	3	342.487	3.253	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(C)c(OC)c(C)c1	ZINC001049491677	1347874596	/nfs/dbraw/zinc/87/45/96/1347874596.db2.gz	PHOPVBULIBAMGR-MSOLQXFVSA-N	0	3	328.456	3.177	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ncoc1-c1ccccc1	ZINC001049507704	1347883862	/nfs/dbraw/zinc/88/38/62/1347883862.db2.gz	LGEVVTWIEIDEAI-SJORKVTESA-N	0	3	337.423	3.207	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1c(Cl)n[nH]c1C1CC1	ZINC001049514467	1347887344	/nfs/dbraw/zinc/88/73/44/1347887344.db2.gz	FSAFONIJUKBCAG-UONOGXRCSA-N	0	3	348.878	3.196	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cn(C)c2ccc(F)cc12	ZINC001049522152	1347890820	/nfs/dbraw/zinc/89/08/20/1347890820.db2.gz	DNIUJWUMYZAICJ-OALUTQOASA-N	0	3	341.430	3.182	20	30		EGEDHN
C=C(C)CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1snnc1C1CC1	ZINC001049532307	1347894209	/nfs/dbraw/zinc/89/42/09/1347894209.db2.gz	OKYYYFNOZZTSLG-CABCVRRESA-N	0	3	346.500	3.061	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc2oc(C)nc2c1	ZINC001049542139	1347899607	/nfs/dbraw/zinc/89/96/07/1347899607.db2.gz	UKKJZGKVWWTPDP-IAGOWNOFSA-N	0	3	325.412	3.001	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1c(C)noc1C(F)F	ZINC001049544811	1347900372	/nfs/dbraw/zinc/90/03/72/1347900372.db2.gz	PFEXUYMRFLLQON-QWHCGFSZSA-N	0	3	339.386	3.176	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H]1CCCc2ccccc21	ZINC001049550965	1347903886	/nfs/dbraw/zinc/90/38/86/1347903886.db2.gz	CXVXBJNASGMNFV-NJDAHSKKSA-N	0	3	336.479	3.195	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(-n2cccc2)cc1	ZINC001049579892	1347919899	/nfs/dbraw/zinc/91/98/99/1347919899.db2.gz	PJMVVXRMMIAEIS-UXHICEINSA-N	0	3	335.451	3.342	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)CCc1cccc(Cl)c1	ZINC001049625068	1347940935	/nfs/dbraw/zinc/94/09/35/1347940935.db2.gz	GMIXNCRXWGAJIM-RTBURBONSA-N	0	3	344.886	3.361	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc2cc(F)ccc2[nH]1	ZINC001049627901	1347942179	/nfs/dbraw/zinc/94/21/79/1347942179.db2.gz	CIALPTJZKVCWTI-ROUUACIJSA-N	0	3	327.403	3.172	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]2[C@H]1CCN2Cc1cccnc1C	ZINC001049637211	1347946996	/nfs/dbraw/zinc/94/69/96/1347946996.db2.gz	WOKIOGFTXPKOSI-ZWKOTPCHSA-N	0	3	327.472	3.168	20	30		EGEDHN
C[C@]1(C(=O)N2CCC[C@@H]3[C@H]2CCN3Cc2ccc(C#N)cc2)C=CCC1	ZINC001049644406	1347951902	/nfs/dbraw/zinc/95/19/02/1347951902.db2.gz	JDFVJDDLUVNUDJ-SJBKTWHCSA-N	0	3	349.478	3.480	20	30		EGEDHN
CC(F)(F)CC(=O)N1CCC[C@H]2[C@H]1CCN2Cc1cccc(C#N)c1	ZINC001049698114	1347978035	/nfs/dbraw/zinc/97/80/35/1347978035.db2.gz	NBJSGJXCVGOKPV-DLBZAZTESA-N	0	3	347.409	3.169	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]3[C@H]2CCN3CCc2ccns2)C1	ZINC001049704413	1347982309	/nfs/dbraw/zinc/98/23/09/1347982309.db2.gz	XZLAFMOWZFJSLZ-IAGOWNOFSA-N	0	3	345.512	3.107	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(C(C)C)cn1	ZINC001049723758	1347990475	/nfs/dbraw/zinc/99/04/75/1347990475.db2.gz	OPHMMXPRFOFDPD-MOPGFXCFSA-N	0	3	327.472	3.460	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1ccc(Cl)c(F)c1	ZINC001049746104	1347997903	/nfs/dbraw/zinc/99/79/03/1347997903.db2.gz	CNDZKGLVEIWFQY-ZWKOTPCHSA-N	0	3	348.849	3.110	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(C)oc1C(F)(F)F	ZINC001049754954	1348003178	/nfs/dbraw/zinc/00/31/78/1348003178.db2.gz	PDQGKICXFMSYJC-KBPBESRZSA-N	0	3	342.361	3.472	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](CC)Oc1ccccc1C	ZINC001049757940	1348004631	/nfs/dbraw/zinc/00/46/31/1348004631.db2.gz	DRVPSSVRHMWONJ-OTWHNJEPSA-N	0	3	342.483	3.404	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C[C@@H]1CCc2ccccc21	ZINC001049800967	1348027168	/nfs/dbraw/zinc/02/71/68/1348027168.db2.gz	FVNAJCNRSXNWSW-SESVDKBCSA-N	0	3	336.479	3.195	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1c[nH]nc1-c1ccsc1	ZINC001049817796	1348035342	/nfs/dbraw/zinc/03/53/42/1348035342.db2.gz	NUNRXVOOEKONRF-JKSUJKDBSA-N	0	3	342.468	3.003	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cnn(CCC(C)C)c1C	ZINC001049837314	1348049757	/nfs/dbraw/zinc/04/97/57/1348049757.db2.gz	ARWABYPTWRFGJY-RTBURBONSA-N	0	3	344.503	3.103	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cnn(C(C)C)c1C1CC1	ZINC001049837754	1348050492	/nfs/dbraw/zinc/05/04/92/1348050492.db2.gz	RFYMNQKPLNINSC-QZTJIDSGSA-N	0	3	342.487	3.206	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)C1(c2ccccc2F)CCC1	ZINC001049845780	1348055038	/nfs/dbraw/zinc/05/50/38/1348055038.db2.gz	YGQZCCLCGJPMMB-MOPGFXCFSA-N	0	3	342.458	3.499	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1coc(-c2ccccc2)n1	ZINC001049847826	1348056442	/nfs/dbraw/zinc/05/64/42/1348056442.db2.gz	FSTLWYYOMMMQEX-RBUKOAKNSA-N	0	3	349.434	3.044	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)C(C)(C)c1ccc(F)cc1	ZINC001049854408	1348060766	/nfs/dbraw/zinc/06/07/66/1348060766.db2.gz	LAAOHGBQNKZZJR-MSOLQXFVSA-N	0	3	330.447	3.355	20	30		EGEDHN
Cc1c[nH]cc1C(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049889517	1348094543	/nfs/dbraw/zinc/09/45/43/1348094543.db2.gz	GPESKWREOWPKKF-UXHICEINSA-N	0	3	348.450	3.074	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](C)c1ccc(F)c(F)c1	ZINC001049905142	1348103926	/nfs/dbraw/zinc/10/39/26/1348103926.db2.gz	VLLSACNPZGSUOD-DOPJRALCSA-N	0	3	334.410	3.320	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](CC)c1ccc(OC)cc1	ZINC001049907253	1348104733	/nfs/dbraw/zinc/10/47/33/1348104733.db2.gz	CBTRNFKRBZYVAT-XUVXKRRUSA-N	0	3	342.483	3.440	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](C)Cc1ccccc1C	ZINC001049916574	1348110536	/nfs/dbraw/zinc/11/05/36/1348110536.db2.gz	IFERVRGBVKRVEF-HMXCVIKNSA-N	0	3	338.495	3.262	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](C)Cc1ccccc1C	ZINC001049916565	1348110564	/nfs/dbraw/zinc/11/05/64/1348110564.db2.gz	IFERVRGBVKRVEF-CEWLAPEOSA-N	0	3	338.495	3.262	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cnc(C(C)(C)C)s1	ZINC001049922762	1348114751	/nfs/dbraw/zinc/11/47/51/1348114751.db2.gz	RNMABJIKYHCTSD-LSDHHAIUSA-N	0	3	345.512	3.143	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3ccc(C(C)(C)C)cn3)[C@@H]2C1	ZINC001050048143	1348165148	/nfs/dbraw/zinc/16/51/48/1348165148.db2.gz	GWOMPYTXKLHPJG-MAUKXSAKSA-N	0	3	327.472	3.102	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)Cc3coc4ccc(C)cc34)[C@@H]2C1	ZINC001050055775	1348167318	/nfs/dbraw/zinc/16/73/18/1348167318.db2.gz	JBSXXTKAAUXRGY-QFBILLFUSA-N	0	3	338.451	3.393	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3cc(COC)cs3)[C@@H]2C1	ZINC001050086944	1348177683	/nfs/dbraw/zinc/17/76/83/1348177683.db2.gz	BYJIDQQWWBWSDT-JKSUJKDBSA-N	0	3	334.485	3.007	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)[C@@H]3CCc4c3cccc4Cl)[C@@H]2C1	ZINC001050095864	1348181975	/nfs/dbraw/zinc/18/19/75/1348181975.db2.gz	BJKXXSUPNHLDNZ-POZUXBRTSA-N	0	3	344.886	3.479	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3cc4ncccc4s3)[C@@H]2C1	ZINC001050110057	1348185945	/nfs/dbraw/zinc/18/59/45/1348185945.db2.gz	XHMUGBZYZKPINM-GOEBONIOSA-N	0	3	341.480	3.409	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)[C@H](CC)Cc3ccccc3)[C@@H]2C1	ZINC001050154476	1348199029	/nfs/dbraw/zinc/19/90/29/1348199029.db2.gz	QZAAZTYOQXXXNC-HSALFYBXSA-N	0	3	326.484	3.364	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)[C@@H]3C[C@H]3c3ccccc3C)[C@@H]2C1	ZINC001050163011	1348201087	/nfs/dbraw/zinc/20/10/87/1348201087.db2.gz	CTCQSGZIYRJHFT-MJUUVYJYSA-N	0	3	336.479	3.045	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3ccc4scnc4c3)[C@@H]2C1	ZINC001050175698	1348202816	/nfs/dbraw/zinc/20/28/16/1348202816.db2.gz	YHUAWZIJDINCCA-GOEBONIOSA-N	0	3	327.453	3.019	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)[C@H](C)Cc3ccc(C)cc3)[C@@H]2C1	ZINC001050209953	1348212045	/nfs/dbraw/zinc/21/20/45/1348212045.db2.gz	JQLSSJTZQNZVFT-HLAWJBBLSA-N	0	3	338.495	3.120	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)Cc3c(C)cccc3Cl)C2)CC1	ZINC001050582245	1348293277	/nfs/dbraw/zinc/29/32/77/1348293277.db2.gz	ZCBLIUBHTJTCBA-UHFFFAOYSA-N	0	3	344.886	3.139	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cc(Cl)ccc3C)C2)CC1	ZINC001050701994	1348331529	/nfs/dbraw/zinc/33/15/29/1348331529.db2.gz	WWBLTBNXFOXBGC-UHFFFAOYSA-N	0	3	330.859	3.210	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)CCc3c[nH]c4ccccc34)C2)CC1	ZINC001050745442	1348346609	/nfs/dbraw/zinc/34/66/09/1348346609.db2.gz	RVLZURPRTZKLBL-UHFFFAOYSA-N	0	3	349.478	3.048	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3ccc(C4=CCCC4)cc3)C2)CC1	ZINC001050776685	1348355594	/nfs/dbraw/zinc/35/55/94/1348355594.db2.gz	OMZBHTFGLSGYIR-UHFFFAOYSA-N	0	3	334.463	3.425	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3scnc3C)cccc2C1	ZINC001051278781	1348415291	/nfs/dbraw/zinc/41/52/91/1348415291.db2.gz	FBFBMRXZHYAKIB-UHFFFAOYSA-N	0	3	341.480	3.316	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)[C@@H]3CCC[C@@H]3OC)cccc2C1	ZINC001051292490	1348421486	/nfs/dbraw/zinc/42/14/86/1348421486.db2.gz	ZEMRKGKLKUJHHW-UXHICEINSA-N	0	3	342.483	3.052	20	30		EGEDHN
Cc1cc(C(=O)N[C@H]2CCCN(Cc3cccc(C#N)c3)CC2)co1	ZINC001052338488	1348527918	/nfs/dbraw/zinc/52/79/18/1348527918.db2.gz	ULJSTCDYOFGNGL-IBGZPJMESA-N	0	3	337.423	3.244	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2nc(C(C)(C)C)cs2)CC1	ZINC001052465526	1348547472	/nfs/dbraw/zinc/54/74/72/1348547472.db2.gz	MQWWQWFVGXCPJO-CQSZACIVSA-N	0	3	333.501	3.048	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@H](NC(=O)[C@@H]3CCC3(F)F)CC2)c1	ZINC001052481583	1348551520	/nfs/dbraw/zinc/55/15/20/1348551520.db2.gz	PUOSIJNQWBWASJ-IRXDYDNUSA-N	0	3	347.409	3.074	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)Cc2ccc(C)cc2Cl)CC1	ZINC001052503993	1348561137	/nfs/dbraw/zinc/56/11/37/1348561137.db2.gz	XLNPWHPHJMXASS-KRWDZBQOSA-N	0	3	332.875	3.185	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc(OC)c(C(C)C)c2)CC1	ZINC001052532035	1348567835	/nfs/dbraw/zinc/56/78/35/1348567835.db2.gz	WGCAWTLLNXACNR-GOSISDBHSA-N	0	3	342.483	3.426	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc(-n3cccc3)cc2)CC1	ZINC001052535716	1348569538	/nfs/dbraw/zinc/56/95/38/1348569538.db2.gz	WJNRBBZAUVGWBE-LJQANCHMSA-N	0	3	335.451	3.085	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@H](C)c2ccc(Cl)cc2)CC1	ZINC001052676479	1348625446	/nfs/dbraw/zinc/62/54/46/1348625446.db2.gz	HESCQXVWULABFW-CRAIPNDOSA-N	0	3	332.875	3.438	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCCN(Cc3c(C)noc3C)CC2)C1	ZINC001052691092	1348634191	/nfs/dbraw/zinc/63/41/91/1348634191.db2.gz	RTGJNCUDZLDLPA-INIZCTEOSA-N	0	3	331.460	3.118	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC001052726332	1348648878	/nfs/dbraw/zinc/64/88/78/1348648878.db2.gz	JXKBPSNCNABHNF-GUDVDZBRSA-N	0	3	325.456	3.075	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)Cc2cccc3sccc32)CC1	ZINC001052765625	1348670412	/nfs/dbraw/zinc/67/04/12/1348670412.db2.gz	JZPPENDKKUTCTI-INIZCTEOSA-N	0	3	326.465	3.048	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2sccc2C(F)F)CC1	ZINC001052901294	1348735116	/nfs/dbraw/zinc/73/51/16/1348735116.db2.gz	OSSKMMAQFVFZNK-LBPRGKRZSA-N	0	3	326.412	3.293	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2csc3c2CCCC3)CC1	ZINC001052920525	1348748691	/nfs/dbraw/zinc/74/86/91/1348748691.db2.gz	ZGQPHNDABOTRMW-HNNXBMFYSA-N	0	3	330.497	3.235	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cc(C)n(C(C)C)c2C)CC1	ZINC001052923586	1348749355	/nfs/dbraw/zinc/74/93/55/1348749355.db2.gz	GYZPAVVHWYFURT-GOSISDBHSA-N	0	3	329.488	3.293	20	30		EGEDHN
CC(=O)N1CCC[C@H]([C@@H]2CCCN(Cc3ccc(C#N)cc3F)C2)C1	ZINC001052997532	1348794173	/nfs/dbraw/zinc/79/41/73/1348794173.db2.gz	RMCSOEFGLGCGNU-MSOLQXFVSA-N	0	3	343.446	3.168	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCC[C@H]([C@@H]2CCCN(CCF)C2)C1	ZINC001053029164	1348827820	/nfs/dbraw/zinc/82/78/20/1348827820.db2.gz	QFTWTGSZYZJQAG-MSOLQXFVSA-N	0	3	347.478	3.208	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cccc(F)c2)C1	ZINC001053062840	1348873775	/nfs/dbraw/zinc/87/37/75/1348873775.db2.gz	CXVXYIBHZHWANC-HKUYNNGSSA-N	0	3	328.431	3.166	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccsc2C)C1	ZINC001053083474	1348904571	/nfs/dbraw/zinc/90/45/71/1348904571.db2.gz	LBJNDXGEVQABPL-SJLPKXTDSA-N	0	3	330.497	3.396	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cccc(C)c2F)C1	ZINC001053086795	1348909129	/nfs/dbraw/zinc/90/91/29/1348909129.db2.gz	OVBMCQZRWZHKTH-HKUYNNGSSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ncc(C)cc2C)C1	ZINC001053089558	1348914977	/nfs/dbraw/zinc/91/49/77/1348914977.db2.gz	CFUGKIAOTHKXCA-RBUKOAKNSA-N	0	3	339.483	3.038	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)Cc2occc2C)C1	ZINC001053093822	1348922717	/nfs/dbraw/zinc/92/27/17/1348922717.db2.gz	AECYGXWQXWTJMF-OALUTQOASA-N	0	3	342.483	3.247	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2occc2CC)C1	ZINC001053099791	1348932048	/nfs/dbraw/zinc/93/20/48/1348932048.db2.gz	YZUQZNFQTPLFCK-QZTJIDSGSA-N	0	3	328.456	3.182	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2nc(C)oc2C)C1	ZINC001053101322	1348934088	/nfs/dbraw/zinc/93/40/88/1348934088.db2.gz	NCKMVZMJHYTSLU-ROUUACIJSA-N	0	3	343.471	3.021	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2c[nH]cc2C)C1	ZINC001053107412	1348946765	/nfs/dbraw/zinc/94/67/65/1348946765.db2.gz	HMFSWUJJXUJFPW-IEBWSBKVSA-N	0	3	327.472	3.053	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)[C@H]2[C@H]3[C@@H]2[C@@H]2CC[C@H]3C2)C1	ZINC001053107903	1348947479	/nfs/dbraw/zinc/94/74/79/1348947479.db2.gz	NBPPUTAWWQEALD-HXOHHMPKSA-N	0	3	340.511	3.005	20	30		EGEDHN
CCCC(=O)N1CCC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001054071681	1349144663	/nfs/dbraw/zinc/14/46/63/1349144663.db2.gz	HFFYBBCDTVHLLW-HXUWFJFHSA-N	0	3	325.456	3.173	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H](C)c1c(F)cccc1F)C2	ZINC001054164346	1349167146	/nfs/dbraw/zinc/16/71/46/1349167146.db2.gz	HLJKGGJNSVHMQN-MGPUTAFESA-N	0	3	346.421	3.016	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@]3(C2)CCCN(C(=O)[C@@H]2CC24CC4)C3)cc1	ZINC001054204099	1349205487	/nfs/dbraw/zinc/20/54/87/1349205487.db2.gz	NJSYRRLPYBMEIU-PZJWPPBQSA-N	0	3	349.478	3.173	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)C[C@H](C)c1ccco1)C2	ZINC001054229029	1349222250	/nfs/dbraw/zinc/22/22/50/1349222250.db2.gz	IIGBFQXMDDUKFJ-PXNSSMCTSA-N	0	3	328.456	3.111	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc(CC(C)C)c[nH]1)C2	ZINC001054228515	1349222971	/nfs/dbraw/zinc/22/29/71/1349222971.db2.gz	RRPYWDDEXVIHDQ-OAQYLSRUSA-N	0	3	341.499	3.165	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H](C)n1c(C)ccc1C)C2	ZINC001054244241	1349237731	/nfs/dbraw/zinc/23/77/31/1349237731.db2.gz	BCMIZHFMWCHVRP-CTNGQTDRSA-N	0	3	341.499	3.004	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)[C@]1(C)CCC(C)=C(C)C1)C2	ZINC001054246859	1349241810	/nfs/dbraw/zinc/24/18/10/1349241810.db2.gz	KWEXHCRCXFCZHM-RTWAWAEBSA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)C13CC(C(C)(C)C)(C1)C3)C2	ZINC001054247247	1349241855	/nfs/dbraw/zinc/24/18/55/1349241855.db2.gz	RZGCEJUWYATXPI-MWXLCCTBSA-N	0	3	328.500	3.151	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@@H]3CCC[C@H]3OC)cc2C1	ZINC001054271607	1349271250	/nfs/dbraw/zinc/27/12/50/1349271250.db2.gz	SISGOPZZJKCJQO-WOJBJXKFSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3c[nH]nc3CC)cc2C1	ZINC001054271994	1349271929	/nfs/dbraw/zinc/27/19/29/1349271929.db2.gz	AFRAJDNTGXDBJT-UHFFFAOYSA-N	0	3	338.455	3.184	20	30		EGEDHN
C=C(C)CN1Cc2ccc(CNC(=O)[C@@H]3CCCCN3CC)cc2C1	ZINC001054292872	1349299348	/nfs/dbraw/zinc/29/93/48/1349299348.db2.gz	XSGXZAWTNCBLKN-FQEVSTJZSA-N	0	3	341.499	3.069	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2cccc(F)c2)C[C@H]1NCc1ccc(C#N)s1	ZINC001054349522	1349329231	/nfs/dbraw/zinc/32/92/31/1349329231.db2.gz	DJUMVBWJFKSGEA-SJKOYZFVSA-N	0	3	343.427	3.009	20	30		EGEDHN
C[C@H]1CN(C(=O)C=C2CCCCC2)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054447486	1349362214	/nfs/dbraw/zinc/36/22/14/1349362214.db2.gz	GNJFVPNCCCBISP-KSSFIOAISA-N	0	3	343.496	3.447	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2=CCCCC2)C[C@H]1NCc1ccc(C#N)s1	ZINC001054477014	1349370039	/nfs/dbraw/zinc/37/00/39/1349370039.db2.gz	AUTDWKUJYYOEFW-RDTXWAMCSA-N	0	3	343.496	3.447	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)C2CCc3ccccc3CC2)C1	ZINC001080009931	1357458533	/nfs/dbraw/zinc/45/85/33/1357458533.db2.gz	ZYGZBSXKYHXIJI-OXQOHEQNSA-N	0	3	326.484	3.194	20	30		EGEDHN
CCc1occc1C(=O)N1C[C@H](NCc2ccc(C#N)s2)[C@@H](C)C1	ZINC001054615063	1349415270	/nfs/dbraw/zinc/41/52/70/1349415270.db2.gz	NZZMBBCOAGDHOZ-LRDDRELGSA-N	0	3	343.452	3.025	20	30		EGEDHN
C[C@H]1CN(C(=O)c2sccc2F)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054624314	1349419646	/nfs/dbraw/zinc/41/96/46/1349419646.db2.gz	SMGLAUWUFYBXCJ-HZMBPMFUSA-N	0	3	349.456	3.071	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@H](NCc2cnc(C)s2)[C@@H](C)C1	ZINC001054677194	1349434116	/nfs/dbraw/zinc/43/41/16/1349434116.db2.gz	DWHKPHJSDOPEGT-HZMBPMFUSA-N	0	3	341.908	3.167	20	30		EGEDHN
C#Cc1ccc(C(=O)N2C[C@@H](C)[C@@H](NCc3ccccc3F)C2)cc1	ZINC001054960852	1349528477	/nfs/dbraw/zinc/52/84/77/1349528477.db2.gz	FPTQFEIYPZZCMV-QRWLVFNGSA-N	0	3	336.410	3.057	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@@H](NCc2cccc(OCC)n2)C1	ZINC001054971586	1349532280	/nfs/dbraw/zinc/53/22/80/1349532280.db2.gz	RDCCKBSGYQIGKJ-WBVHZDCISA-N	0	3	345.487	3.019	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](C)[C@H](NCc2cnn(C(C)(C)C)c2)C1	ZINC001054971841	1349532515	/nfs/dbraw/zinc/53/25/15/1349532515.db2.gz	VCUZRUAIXOFKDH-DOTOQJQBSA-N	0	3	346.519	3.177	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H](NCc2cccc(C(C)C)n2)[C@@H](C)C1	ZINC001054976008	1349534158	/nfs/dbraw/zinc/53/41/58/1349534158.db2.gz	HRNILGSEEMJEOA-YJBOKZPZSA-N	0	3	329.488	3.354	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2coc3ccc(OC)cc23)C1	ZINC001080103499	1357486466	/nfs/dbraw/zinc/48/64/66/1357486466.db2.gz	GOALVHGTEYNVRY-CXAGYDPISA-N	0	3	328.412	3.068	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cnn(C(C)(C)C)c1C	ZINC001085628766	1358645588	/nfs/dbraw/zinc/64/55/88/1358645588.db2.gz	FKCSHVYAIRNTRN-MRXNPFEDSA-N	0	3	332.492	3.059	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc(-c2ccco2)on1	ZINC001085750663	1358731512	/nfs/dbraw/zinc/73/15/12/1358731512.db2.gz	LYAOYLSJNMDSNX-CQSZACIVSA-N	0	3	329.400	3.047	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1occc1C(C)C)C[C@H](C)O2	ZINC001071202575	1354502747	/nfs/dbraw/zinc/50/27/47/1354502747.db2.gz	XDQGJNZDNRKBAG-JXFKEZNVSA-N	0	3	346.471	3.285	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H](C)O[C@@]3(CCN(CC=C(C)C)C3)C2)CC1	ZINC001071202314	1354502773	/nfs/dbraw/zinc/50/27/73/1354502773.db2.gz	SXNRSGUOMGTJOD-WIYYLYMNSA-N	0	3	346.515	3.391	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)[C@H]1CC[C@H](C)CC1)C[C@H](C)O2	ZINC001071232110	1354515912	/nfs/dbraw/zinc/51/59/12/1354515912.db2.gz	ZEBWWTFEWKJTJS-JPLJXNOCSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1ccc(F)cc1C)C[C@H](C)O2	ZINC001071231138	1354515929	/nfs/dbraw/zinc/51/59/29/1354515929.db2.gz	NOOHLPOBYAVJFK-OXJNMPFZSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1ccccc1Cl)C[C@@H](C)O2	ZINC001071234096	1354518172	/nfs/dbraw/zinc/51/81/72/1354518172.db2.gz	TXPHHEYUVUNMTM-BEFAXECRSA-N	0	3	348.874	3.222	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)Cc2coc3cc(F)ccc23)CC[C@H]1C	ZINC001071498001	1354728607	/nfs/dbraw/zinc/72/86/07/1354728607.db2.gz	PMLAZQIYOOZFPU-CZUORRHYSA-N	0	3	330.403	3.270	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(C)c(NC(C)=O)c2)CC[C@@H]1C	ZINC001071527342	1354747336	/nfs/dbraw/zinc/74/73/36/1354747336.db2.gz	BPAZEABJUNMJHM-YJBOKZPZSA-N	0	3	343.471	3.112	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2oc3c(cccc3F)c2C)CC[C@H]1C	ZINC001071568344	1354767767	/nfs/dbraw/zinc/76/77/67/1354767767.db2.gz	MLIPIZZQFCYKHI-HIFRSBDPSA-N	0	3	342.414	3.486	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc3nc(C)oc3c2)CC[C@H]1C	ZINC001071588292	1354780538	/nfs/dbraw/zinc/78/05/38/1354780538.db2.gz	HVOVNGBDZVNXRY-CJNGLKHVSA-N	0	3	327.428	3.295	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2ccc(-c3cc[nH]n3)s2)CC[C@@H]1C	ZINC001071594403	1354783796	/nfs/dbraw/zinc/78/37/96/1354783796.db2.gz	QGFJRQZBVPMYAC-KBPBESRZSA-N	0	3	344.484	3.297	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N[C@H]1CC[C@@H](C)N(CCCF)C1	ZINC001071619531	1354801832	/nfs/dbraw/zinc/80/18/32/1354801832.db2.gz	PXZGVQBKAZVNKK-CVEARBPZSA-N	0	3	334.435	3.194	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2coc3cc(F)ccc23)CC[C@H]1C	ZINC001071631648	1354814026	/nfs/dbraw/zinc/81/40/26/1354814026.db2.gz	PQSIFXVLQHLMFJ-HIFRSBDPSA-N	0	3	328.387	3.178	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2nc3ccccc3cc2C)CC[C@H]1C	ZINC001071696221	1354857136	/nfs/dbraw/zinc/85/71/36/1354857136.db2.gz	XHCRSSJAFRSQAG-SJLPKXTDSA-N	0	3	335.451	3.149	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc(Cl)c(Cl)[nH]2)CC[C@@H]1C	ZINC001071714893	1354872668	/nfs/dbraw/zinc/87/26/68/1354872668.db2.gz	BIFBWIJBCHGYKJ-QWRGUYRKSA-N	0	3	330.259	3.480	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc3ccc(OC)cc3[nH]2)CC[C@H]1C	ZINC001071728474	1354883895	/nfs/dbraw/zinc/88/38/95/1354883895.db2.gz	NGPKOCBQBRCFEL-ZBFHGGJFSA-N	0	3	341.455	3.335	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc3cc(OC)ccc3[nH]2)CC[C@H]1C	ZINC001071779030	1354926477	/nfs/dbraw/zinc/92/64/77/1354926477.db2.gz	DHZATCLBTZYKTQ-ZBFHGGJFSA-N	0	3	341.455	3.335	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)Cc2c[nH]c3ccc(F)cc23)CC[C@@H]1C	ZINC001071843763	1354973753	/nfs/dbraw/zinc/97/37/53/1354973753.db2.gz	AMNHCMGIJSJZJW-BBRMVZONSA-N	0	3	329.419	3.005	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2cc(C)ccc2C)CC(C)(C)C1	ZINC001089476487	1360459211	/nfs/dbraw/zinc/45/92/11/1360459211.db2.gz	NZWNYXDKSSEKOZ-LJQANCHMSA-N	0	3	326.484	3.086	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ncoc2-c2cccs2)CC[C@H]1C	ZINC001071908242	1355018663	/nfs/dbraw/zinc/01/86/63/1355018663.db2.gz	PWHXZJQKKVXBJT-ZIAGYGMSSA-N	0	3	343.452	3.009	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cccc(C(F)(F)F)n2)CC[C@@H]1C	ZINC001071931557	1355031998	/nfs/dbraw/zinc/03/19/98/1355031998.db2.gz	XGGKVFNDEMSZQV-QWHCGFSZSA-N	0	3	341.377	3.259	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cccc3[nH]c(C)nc32)CC[C@H]1C	ZINC001071954809	1355040929	/nfs/dbraw/zinc/04/09/29/1355040929.db2.gz	WPOQCEJAVIOUTD-UKRRQHHQSA-N	0	3	326.444	3.030	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cccc3[nH]c(C)nc32)CC[C@@H]1C	ZINC001071954810	1355041273	/nfs/dbraw/zinc/04/12/73/1355041273.db2.gz	WPOQCEJAVIOUTD-ZFWWWQNUSA-N	0	3	326.444	3.030	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(-c3c[nH]cn3)cc2)CC[C@@H]1C	ZINC001071957054	1355042497	/nfs/dbraw/zinc/04/24/97/1355042497.db2.gz	BHSNCLCARVQQQC-YJBOKZPZSA-N	0	3	338.455	3.236	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CC[C@@H](C)N(Cc3ccccc3C)C2)nc1	ZINC001072000693	1355066676	/nfs/dbraw/zinc/06/66/76/1355066676.db2.gz	ZBGYVESEIBYYTO-XLIONFOSSA-N	0	3	347.462	3.154	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cccc(C(F)(F)F)c2)CC[C@H]1C	ZINC001072020153	1355083600	/nfs/dbraw/zinc/08/36/00/1355083600.db2.gz	UJBOOADNHISDIZ-CZUORRHYSA-N	0	3	338.373	3.311	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc(F)c(F)cc2Cl)CC[C@H]1C	ZINC001072046084	1355101419	/nfs/dbraw/zinc/10/14/19/1355101419.db2.gz	VFHPLVIGOFEHCR-NEPJUHHUSA-N	0	3	340.801	3.224	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc(C)n(C(C)(C)C)n2)CC[C@H]1C	ZINC001072076567	1355115288	/nfs/dbraw/zinc/11/52/88/1355115288.db2.gz	RFFPGYYBRXQSLK-GDBMZVCRSA-N	0	3	332.492	3.105	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@H](C)[C@@H](CNCc2ccccc2C#N)C1	ZINC001072170126	1355165408	/nfs/dbraw/zinc/16/54/08/1355165408.db2.gz	CBNGPOBEHMYUDF-LPHOPBHVSA-N	0	3	327.472	3.179	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](C)[C@@H](CNCc2ccn(C(C)C)n2)C1	ZINC001072337096	1355245756	/nfs/dbraw/zinc/24/57/56/1355245756.db2.gz	WJLALXODTCNXRB-SJORKVTESA-N	0	3	346.519	3.250	20	30		EGEDHN
C[C@@H]1CCN(C(=O)C2(C)CCC2)C[C@@H]1CNCc1ccccc1C#N	ZINC001072338582	1355246137	/nfs/dbraw/zinc/24/61/37/1355246137.db2.gz	DMOGIULRVRZLTO-APWZRJJASA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](C)[C@@H](CNCc3cscn3)C2)CC1	ZINC001072352711	1355253771	/nfs/dbraw/zinc/25/37/71/1355253771.db2.gz	JYVZUCVQBNPHTG-RDJZCZTQSA-N	0	3	347.528	3.464	20	30		EGEDHN
Cc1cc(C(=O)N2CC3(C2)CCN(Cc2ccc(C#N)cc2)C3)c(C)o1	ZINC001072457531	1355294684	/nfs/dbraw/zinc/29/46/84/1355294684.db2.gz	FWHIENYCBFIGMO-UHFFFAOYSA-N	0	3	349.434	3.116	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@@H]3CCCC[C@H]3C(F)(F)F)C2)C1	ZINC001072827362	1355453441	/nfs/dbraw/zinc/45/34/41/1355453441.db2.gz	FHGOKDVZYURXRF-ZIAGYGMSSA-N	0	3	330.394	3.075	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C(C)(C)c3ccc(Cl)cc3)C2)C1	ZINC001072937801	1355508100	/nfs/dbraw/zinc/50/81/00/1355508100.db2.gz	IQGCGFFLUNFRMP-UHFFFAOYSA-N	0	3	344.886	3.175	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC2(C1)CCN(CCc1csc(C)n1)C2	ZINC001072944608	1355512523	/nfs/dbraw/zinc/51/25/23/1355512523.db2.gz	HPVYJQJHMAPJPQ-SFHVURJKSA-N	0	3	347.528	3.131	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H](C)c3cc4ccccc4o3)C2)C1	ZINC001073114995	1355604457	/nfs/dbraw/zinc/60/44/57/1355604457.db2.gz	NPHUERYXHVCYIO-MRXNPFEDSA-N	0	3	336.435	3.094	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2csc3ccccc23)C1	ZINC001073716617	1355874786	/nfs/dbraw/zinc/87/47/86/1355874786.db2.gz	HNZPUFXRLFJOQN-OAHLLOKOSA-N	0	3	344.480	3.298	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2c(C)csc2Cl)C1	ZINC001073867241	1355927020	/nfs/dbraw/zinc/92/70/20/1355927020.db2.gz	QULKXDICCLSINM-ZDUSSCGKSA-N	0	3	342.892	3.107	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2sccc2C(F)F)C1	ZINC001073873586	1355930790	/nfs/dbraw/zinc/93/07/90/1355930790.db2.gz	FLKFNUSDRNUTRQ-GFCCVEGCSA-N	0	3	344.427	3.083	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCCN1C(=O)c1ccncc1	ZINC001073928794	1355964426	/nfs/dbraw/zinc/96/44/26/1355964426.db2.gz	UFMWZHRZQIPJJS-HXUWFJFHSA-N	0	3	348.450	3.080	20	30		EGEDHN
CC(C)=CC(=O)N1CCCC[C@@H]1CN(C)Cc1cccc(C#N)c1	ZINC001073931615	1355966428	/nfs/dbraw/zinc/96/64/28/1355966428.db2.gz	IUWIJUJZKSYWJA-LJQANCHMSA-N	0	3	325.456	3.337	20	30		EGEDHN
C[C@H]1[C@@H](NCc2ccc(C#N)s2)CCN1C(=O)/C=C/c1ccco1	ZINC001074502257	1356200826	/nfs/dbraw/zinc/20/08/26/1356200826.db2.gz	RZMJBPMASWGJQM-UHONWTQSSA-N	0	3	341.436	3.005	20	30		EGEDHN
C[C@H]1[C@@H](NCc2ccc(C#N)s2)CCN1C(=O)C[C@@H]1C=CCC1	ZINC001074519303	1356203026	/nfs/dbraw/zinc/20/30/26/1356203026.db2.gz	COCNHWGLJSXJOG-VBQJREDUSA-N	0	3	329.469	3.055	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccc(F)c(C(F)F)c3)[C@@H]2C1	ZINC001075801073	1356423455	/nfs/dbraw/zinc/42/34/55/1356423455.db2.gz	UEQOFCJOYQEXER-XJKSGUPXSA-N	0	3	338.373	3.486	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CC1=CCCCC1	ZINC001098019754	1363199069	/nfs/dbraw/zinc/19/90/69/1363199069.db2.gz	LBFHCJDMRFXWES-RMMWZPCPSA-N	0	3	344.499	3.190	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)Cc3ccc(CCCC)cc3)[C@@H]2C1	ZINC001075998546	1356463760	/nfs/dbraw/zinc/46/37/60/1356463760.db2.gz	YBCJGFVDWHXGLW-VQTJNVASSA-N	0	3	326.484	3.290	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccc4cc(C)ccc4n3)[C@@H]2C1	ZINC001076020825	1356467630	/nfs/dbraw/zinc/46/76/30/1356467630.db2.gz	ZCITVUOGAINRIM-FXAWDEMLSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cc(C)n(CC4CC4)c3C)[C@@H]2C1	ZINC001076471061	1356585883	/nfs/dbraw/zinc/58/58/83/1356585883.db2.gz	WIZHAQHKZSUCRJ-AZUAARDMSA-N	0	3	341.499	3.237	20	30		EGEDHN
CCCCCCCCC(=O)N[C@@H](C)CCNC(=O)[C@@H](CC)N(C)C	ZINC001077151373	1356736729	/nfs/dbraw/zinc/73/67/29/1356736729.db2.gz	PEVMMJDQVOGDDI-DLBZAZTESA-N	0	3	341.540	3.088	20	30		EGEDHN
C#CCCN1C[C@@H](C)[C@H](NC(=O)c2cc(Cl)cc(Cl)c2)C1	ZINC001080839149	1357750156	/nfs/dbraw/zinc/75/01/56/1357750156.db2.gz	ZMDNNOLKSLXIDX-IAQYHMDHSA-N	0	3	325.239	3.067	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@H](NC(=O)C=C2CCC2)C12CCC2	ZINC001078593895	1357027146	/nfs/dbraw/zinc/02/71/46/1357027146.db2.gz	KMZKGUVRMDYAOT-KGLIPLIRSA-N	0	3	339.277	3.022	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2cc(CC)ccn2)C12CCC2	ZINC001078628291	1357040648	/nfs/dbraw/zinc/04/06/48/1357040648.db2.gz	BXTJXKMZEJCZTM-CVEARBPZSA-N	0	3	333.863	3.027	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2c[nH]cc2C2CC2)C12CCC2	ZINC001078766328	1357072999	/nfs/dbraw/zinc/07/29/99/1357072999.db2.gz	CORHFLPPEVVNEF-HOTGVXAUSA-N	0	3	333.863	3.275	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2c[nH]cc2C2CC2)C12CCC2	ZINC001078766329	1357073149	/nfs/dbraw/zinc/07/31/49/1357073149.db2.gz	CORHFLPPEVVNEF-HZPDHXFCSA-N	0	3	333.863	3.275	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C[C@H](C)c2ccccc2)C[C@H]1c1ccccc1	ZINC001081222128	1357851483	/nfs/dbraw/zinc/85/14/83/1357851483.db2.gz	NLBUCRLMXSGWKH-YUXAGFNASA-N	0	3	346.474	3.398	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2csc3cc(C)ccc32)[C@H](OC)C1	ZINC001081737115	1357862887	/nfs/dbraw/zinc/86/28/87/1357862887.db2.gz	NALROTXCDPLWIC-IAGOWNOFSA-N	0	3	344.480	3.215	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CN(CCCC3CCC3)C[C@H]2OC)CC1	ZINC001082102195	1357946839	/nfs/dbraw/zinc/94/68/39/1357946839.db2.gz	VZKQBBFOPBHVRD-RTBURBONSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2c(C)csc2Cl)[C@H](OC)C1	ZINC001082344808	1358021057	/nfs/dbraw/zinc/02/10/57/1358021057.db2.gz	GLLBKSOBPRMMLQ-CHWSQXEVSA-N	0	3	342.892	3.105	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2ccc3c(c2)CCC=C3)[C@H](OC)C1	ZINC001082329626	1358017602	/nfs/dbraw/zinc/01/76/02/1358017602.db2.gz	BENZKGAFSBPHFD-WOJBJXKFSA-N	0	3	340.467	3.041	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1C[C@@H](C)[C@H](NCc2cccc(Cl)c2Cl)C1	ZINC001082450699	1358039866	/nfs/dbraw/zinc/03/98/66/1358039866.db2.gz	DWTHZECYJITNQJ-MISXGVKJSA-N	0	3	340.254	3.090	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)c3cc(C4CC4)[nH]c3C3CC3)[C@@H]2C1	ZINC001084450769	1358216505	/nfs/dbraw/zinc/21/65/05/1358216505.db2.gz	YIXRXFXKBBBQPY-VQIMIIECSA-N	0	3	339.483	3.492	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2C[C@H]3CCN(CC[C@@H](C)F)C[C@H]32)cc1	ZINC001084459882	1358220179	/nfs/dbraw/zinc/22/01/79/1358220179.db2.gz	AKABZPCSPHJLJJ-SZVBFZGTSA-N	0	3	346.446	3.146	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)CCc3ccc(C(C)C)cc3)[C@@H]2C1	ZINC001084513615	1358229819	/nfs/dbraw/zinc/22/98/19/1358229819.db2.gz	JDYIXWROTBXRNE-NHCUHLMSSA-N	0	3	338.495	3.299	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3cc(-c4cccs4)on3)[C@@H]2C1	ZINC001084556846	1358237976	/nfs/dbraw/zinc/23/79/76/1358237976.db2.gz	GPPLDWDZUDQVMX-UKRRQHHQSA-N	0	3	343.452	3.126	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)c3ccc(N(CC)CC)cc3)[C@@H]2C1	ZINC001084794676	1358313367	/nfs/dbraw/zinc/31/33/67/1358313367.db2.gz	PBWKBSLJRAQWTJ-UYAOXDASSA-N	0	3	341.499	3.255	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@H](C)c3ccc(F)c(F)c3)[C@@H]2C1	ZINC001084842630	1358326056	/nfs/dbraw/zinc/32/60/56/1358326056.db2.gz	XEZVWOFSTRGDJA-DDUZABMNSA-N	0	3	334.410	3.177	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CCN(C(=O)[C@H]4[C@@H]5CCC[C@@H]54)C[C@@H]32)c1	ZINC001084914309	1358346150	/nfs/dbraw/zinc/34/61/50/1358346150.db2.gz	NHCNHMVMMUXQPW-MJCUULBUSA-N	0	3	349.478	3.027	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)[C@@H]3CCCCc4ccccc43)C[C@@H]21	ZINC001085102504	1358391269	/nfs/dbraw/zinc/39/12/69/1358391269.db2.gz	HQGYGPXVJDFPEW-NRSPTQNISA-N	0	3	336.479	3.053	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@H](CC)c3ccc(F)cc3)C[C@@H]21	ZINC001085102891	1358392788	/nfs/dbraw/zinc/39/27/88/1358392788.db2.gz	DEARKTFPIKSKOX-QRQLOZEOSA-N	0	3	330.447	3.428	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1conc1C(C)C	ZINC001085222965	1358437131	/nfs/dbraw/zinc/43/71/31/1358437131.db2.gz	SAULZMQOOXMIGA-ZIAGYGMSSA-N	0	3	325.840	3.181	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccc2c(c1)CCO2	ZINC001085341682	1358472339	/nfs/dbraw/zinc/47/23/39/1358472339.db2.gz	HYKCKGJZWXOAKI-HZPDHXFCSA-N	0	3	334.847	3.005	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H]1[C@@H]2c3ccccc3C[C@H]12	ZINC001085355508	1358477105	/nfs/dbraw/zinc/47/71/05/1358477105.db2.gz	ILNZYETUPOYIFX-UURKPOQGSA-N	0	3	344.886	3.342	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1[C@@H]2Cc3ccccc3[C@@H]21	ZINC001085355507	1358477244	/nfs/dbraw/zinc/47/72/44/1358477244.db2.gz	ILNZYETUPOYIFX-IEWDOMPSSA-N	0	3	344.886	3.342	20	30		EGEDHN
COc1ccc(C#N)cc1CN[C@@H]1CCCC[C@H]1NC(=O)C(C)(C)C	ZINC001085401743	1358489825	/nfs/dbraw/zinc/48/98/25/1358489825.db2.gz	CWGNFWCBFBANTK-IAGOWNOFSA-N	0	3	343.471	3.130	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccc2c(c1)N(C)CC2	ZINC001085410379	1358492648	/nfs/dbraw/zinc/49/26/48/1358492648.db2.gz	RDVMIEWCPOGWGW-IAGOWNOFSA-N	0	3	347.890	3.062	20	30		EGEDHN
CN(C[C@H]1CCN1CCCC1CCCC1)C(=O)c1ccc(C#N)[nH]1	ZINC001085553401	1358589829	/nfs/dbraw/zinc/58/98/29/1358589829.db2.gz	IBPAAENUUSFSEF-QGZVFWFLSA-N	0	3	328.460	3.003	20	30		EGEDHN
CN(C[C@H]1CCN1[C@@H]1CCCc2ccccc21)C(=O)c1ccc(C#N)[nH]1	ZINC001085553755	1358589979	/nfs/dbraw/zinc/58/99/79/1358589979.db2.gz	XISRQYSUAZYYFZ-YLJYHZDGSA-N	0	3	348.450	3.110	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1coc2c1cccc2OC	ZINC001085596970	1358623322	/nfs/dbraw/zinc/62/33/22/1358623322.db2.gz	NEHGVNGISNRVJN-AWEZNQCLSA-N	0	3	328.412	3.164	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@H]1CCCN1c1ccccc1	ZINC001085634552	1358650821	/nfs/dbraw/zinc/65/08/21/1358650821.db2.gz	SSEOCECKFUBWAG-WOJBJXKFSA-N	0	3	341.499	3.154	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc(C)n([C@@H](C)CC)n1	ZINC001085685215	1358687073	/nfs/dbraw/zinc/68/70/73/1358687073.db2.gz	LYIQRLNUOLJOJP-RDJZCZTQSA-N	0	3	332.492	3.275	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1coc2ccc(OC)cc12	ZINC001085715475	1358706592	/nfs/dbraw/zinc/70/65/92/1358706592.db2.gz	LQFRGZSZZGYGSQ-AWEZNQCLSA-N	0	3	328.412	3.164	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@@H]1C[C@]1(C)c1ccccc1	ZINC001085733913	1358719759	/nfs/dbraw/zinc/71/97/59/1358719759.db2.gz	SLTFXXHPGQRGAM-IRFCIJBXSA-N	0	3	326.484	3.463	20	30		EGEDHN
CCC(CC)[C@H](C)C(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001183817060	1387353679	/nfs/dbraw/zinc/35/36/79/1387353679.db2.gz	LISREJOICGONLB-KBXCAEBGSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C1CCC(C(=O)N(C)C[C@@H]2CCN2CC[C@@H]2CCCCO2)CC1	ZINC001085800797	1358775890	/nfs/dbraw/zinc/77/58/90/1358775890.db2.gz	BWEQVXOBAAYPJU-OALUTQOASA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccn(C(CC)CC)n1	ZINC001085854697	1358821977	/nfs/dbraw/zinc/82/19/77/1358821977.db2.gz	FMXSNQZBYLIIQU-QGZVFWFLSA-N	0	3	332.492	3.357	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cnc2ccc(F)cc2c1	ZINC001085908875	1358868655	/nfs/dbraw/zinc/86/86/55/1358868655.db2.gz	UWBRTSCLZQIOCP-GOSISDBHSA-N	0	3	341.430	3.486	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cnn(CCC(C)C)c1C	ZINC001085915708	1358875379	/nfs/dbraw/zinc/87/53/79/1358875379.db2.gz	IVHDBDQNMSNNCJ-SFHVURJKSA-N	0	3	346.519	3.350	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc2c(C)cccn2c1	ZINC001085925008	1358881835	/nfs/dbraw/zinc/88/18/35/1358881835.db2.gz	MCERNZXUBFSKIN-SFHVURJKSA-N	0	3	325.456	3.360	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1ccccc1C(F)(F)F	ZINC001085939962	1358897433	/nfs/dbraw/zinc/89/74/33/1358897433.db2.gz	VMOWJZAHOGWLCO-CYBMUJFWSA-N	0	3	326.362	3.428	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc(N(CC)CC)nc1	ZINC001085996080	1358951297	/nfs/dbraw/zinc/95/12/97/1358951297.db2.gz	CXKWJSBATWPHCD-GOSISDBHSA-N	0	3	344.503	3.040	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)C1CC(c2ccc(F)cc2)C1	ZINC001086001276	1358955599	/nfs/dbraw/zinc/95/55/99/1358955599.db2.gz	BLDCFXCGYPIWNW-FAFZWHIHSA-N	0	3	330.447	3.428	20	30		EGEDHN
CCCCC(=O)N1CC[C@H](CNCc2cc(F)ccc2C#N)[C@H](C)C1	ZINC001183899479	1387368825	/nfs/dbraw/zinc/36/88/25/1387368825.db2.gz	POBWSJHWVSTOQC-NVXWUHKLSA-N	0	3	345.462	3.462	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc(F)c(Cl)cc2F)C1	ZINC001086183786	1359019721	/nfs/dbraw/zinc/01/97/21/1359019721.db2.gz	UGNBZIVJRRHDBO-AOOOYVTPSA-N	0	3	349.208	3.469	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2csc(C(C)C)n2)C1	ZINC001086225972	1359032784	/nfs/dbraw/zinc/03/27/84/1359032784.db2.gz	SQNSZRGLWBGHST-TXEJJXNPSA-N	0	3	327.881	3.117	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc3c(c2)CCCC3)C1	ZINC001086266957	1359048642	/nfs/dbraw/zinc/04/86/42/1359048642.db2.gz	DVNAYJFRDFLKTG-UJKQEGAGSA-N	0	3	332.875	3.416	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)c2cccc(C)c2)C1	ZINC001086299141	1359060383	/nfs/dbraw/zinc/06/03/83/1359060383.db2.gz	CHHXPYAWLVXCLL-CTYIDZIISA-N	0	3	337.261	3.002	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cccc3c2CCCC3)C1	ZINC001086375390	1359081702	/nfs/dbraw/zinc/08/17/02/1359081702.db2.gz	MLPRHSGNALLQBR-KOMQPUFPSA-N	0	3	332.875	3.416	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cn(C)c3ccc(F)cc23)C1	ZINC001086387927	1359084733	/nfs/dbraw/zinc/08/47/33/1359084733.db2.gz	BBFMVVYBBWCVMG-MQMHXKEQSA-N	0	3	349.837	3.168	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)[C@H]2CCC[C@@H](C)C2)C1	ZINC001086462410	1359105810	/nfs/dbraw/zinc/10/58/10/1359105810.db2.gz	MSTFKFBRQCYLDE-REBRKWNGSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@H]2C[C@@]23CCc2ccccc23)C1	ZINC001086522499	1359130533	/nfs/dbraw/zinc/13/05/33/1359130533.db2.gz	XLZJUZYHOYWJPA-QSFMABPGSA-N	0	3	344.886	3.127	20	30		EGEDHN
C=CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2scnc2C)C1	ZINC001086576734	1359153756	/nfs/dbraw/zinc/15/37/56/1359153756.db2.gz	AITQFQVBEPFQQL-DLBZAZTESA-N	0	3	341.480	3.225	20	30		EGEDHN
C=CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2csnc2C)C1	ZINC001086583607	1359155537	/nfs/dbraw/zinc/15/55/37/1359155537.db2.gz	WHBFHQCMDUIIEK-FUHWJXTLSA-N	0	3	341.480	3.225	20	30		EGEDHN
C=C(C)CN1C[C@@H](c2ccccc2)[C@H](NC(=O)Cc2ccccc2)C1	ZINC001086595617	1359159304	/nfs/dbraw/zinc/15/93/04/1359159304.db2.gz	LAHDPRREPSHFKV-LEWJYISDSA-N	0	3	334.463	3.389	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)C(C2CC2)C2CC2)C1	ZINC001086619374	1359166095	/nfs/dbraw/zinc/16/60/95/1359166095.db2.gz	MVOLFCXHJFBAKZ-VQTJNVASSA-N	0	3	336.479	3.030	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2sc(CC)nc2C)C1	ZINC001086827087	1359209915	/nfs/dbraw/zinc/20/99/15/1359209915.db2.gz	ADBRQZGPKUDPNK-QWHCGFSZSA-N	0	3	341.908	3.255	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CC[C@H](CNC(=O)c2cccs2)C1	ZINC001086636012	1359173364	/nfs/dbraw/zinc/17/33/64/1359173364.db2.gz	PUCWFGOLRNVFCW-WMLDXEAASA-N	0	3	339.464	3.308	20	30		EGEDHN
C=C(Br)CN[C@@H]1CC[C@H](CNC(=O)[C@@H]2CC=CCC2)C1	ZINC001086642147	1359174724	/nfs/dbraw/zinc/17/47/24/1359174724.db2.gz	TVCVLMNBILXBHF-RRFJBIMHSA-N	0	3	341.293	3.126	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC2(C[C@@H]1C)CCN(Cc1ccc(F)cc1)CC2	ZINC001086910244	1359237545	/nfs/dbraw/zinc/23/75/45/1359237545.db2.gz	PAQXGPVTWVVULU-HOTGVXAUSA-N	0	3	343.446	3.188	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@H]3CCC=CCCC3)C2)CC1	ZINC001086928609	1359253060	/nfs/dbraw/zinc/25/30/60/1359253060.db2.gz	JBSMLZGINHNCFY-MOPGFXCFSA-N	0	3	328.500	3.459	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)[C@H]3CCCC34CC4)C2)CC1	ZINC001086929773	1359254170	/nfs/dbraw/zinc/25/41/70/1359254170.db2.gz	QETYKHOTMJVTEY-QZTJIDSGSA-N	0	3	328.500	3.293	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3cc[nH]c3C(C)C)C2)CC1	ZINC001086938024	1359260494	/nfs/dbraw/zinc/26/04/94/1359260494.db2.gz	GFNIIUFTEQYOMZ-KRWDZBQOSA-N	0	3	341.499	3.478	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc(F)c(C)c3)C2)CC1	ZINC001086939151	1359261528	/nfs/dbraw/zinc/26/15/28/1359261528.db2.gz	JMZGMUQCVFPDJZ-KRWDZBQOSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cnc4ccccc4c3)C2)CC1	ZINC001086945568	1359266346	/nfs/dbraw/zinc/26/63/46/1359266346.db2.gz	DXOBZHHUBZKTLE-QGZVFWFLSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@H](F)c3ccccc3)C2)CC1	ZINC001086945754	1359267010	/nfs/dbraw/zinc/26/70/10/1359267010.db2.gz	IEFNWIIWEHBGLU-FUHWJXTLSA-N	0	3	328.431	3.033	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)CC[C@@H]3CCCCO3)C2)CC1	ZINC001086945749	1359267136	/nfs/dbraw/zinc/26/71/36/1359267136.db2.gz	ICYLBXNTBCIDBG-MOPGFXCFSA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc4cccnc4c3)C2)CC1	ZINC001086949310	1359270159	/nfs/dbraw/zinc/27/01/59/1359270159.db2.gz	WTVXMUFJLABGMK-KRWDZBQOSA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H]3CC34CCCC4)C2)CC1	ZINC001086951572	1359271787	/nfs/dbraw/zinc/27/17/87/1359271787.db2.gz	JOMGEICHTBJQSW-MSOLQXFVSA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc(OCC)cc3)C2)CC1	ZINC001086955356	1359275972	/nfs/dbraw/zinc/27/59/72/1359275972.db2.gz	LKLJAIOWEUJQEN-QGZVFWFLSA-N	0	3	340.467	3.035	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc(C)nc3C)C2)CC1	ZINC001086958058	1359278709	/nfs/dbraw/zinc/27/87/09/1359278709.db2.gz	CQHLOZCROCTYIO-QGZVFWFLSA-N	0	3	339.483	3.038	20	30		EGEDHN
CCC(=O)N[C@@H]1[C@H]2CCCN(Cc3cccc(C#N)c3)[C@@H]2C1(C)C	ZINC001087262416	1359331804	/nfs/dbraw/zinc/33/18/04/1359331804.db2.gz	BVYQVSGNLSLQCQ-QRQLOZEOSA-N	0	3	325.456	3.073	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3oc(C)cc3C)C(C)(C)[C@H]21	ZINC001087278314	1359353858	/nfs/dbraw/zinc/35/38/58/1359353858.db2.gz	FGDFUPDXASXNHU-NJAFHUGGSA-N	0	3	328.456	3.139	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc(F)c(F)c1	ZINC001087290131	1359369551	/nfs/dbraw/zinc/36/95/51/1359369551.db2.gz	XSNMBHBNTXLMEP-FHLIZLRMSA-N	0	3	346.421	3.207	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccn4ccccc34)C(C)(C)[C@H]21	ZINC001087295566	1359377234	/nfs/dbraw/zinc/37/72/34/1359377234.db2.gz	KYURKNVBXAIXFW-RLLQIKCJSA-N	0	3	349.478	3.181	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1occ2c1CCC2	ZINC001087297002	1359378735	/nfs/dbraw/zinc/37/87/35/1359378735.db2.gz	JMYUPMMJJCLVAM-NZSAHSFTSA-N	0	3	340.467	3.010	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccn(C(C)C)c3C)C(C)(C)[C@H]21	ZINC001087300232	1359382641	/nfs/dbraw/zinc/38/26/41/1359382641.db2.gz	HZGCQKKWPWKEBL-QRVBRYPASA-N	0	3	341.499	3.229	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc(F)c(C)c1	ZINC001087300944	1359384052	/nfs/dbraw/zinc/38/40/52/1359384052.db2.gz	STZXTTNKKPOAFO-NZSAHSFTSA-N	0	3	342.458	3.376	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)Cc1cccc(Cl)c1	ZINC001087303066	1359385983	/nfs/dbraw/zinc/38/59/83/1359385983.db2.gz	FTNDAMARMKOESJ-NZSAHSFTSA-N	0	3	344.886	3.121	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc(CC)cc3)C(C)(C)[C@H]21	ZINC001087315713	1359406196	/nfs/dbraw/zinc/40/61/96/1359406196.db2.gz	HFDLEFVBOPATRK-AABGKKOBSA-N	0	3	338.495	3.491	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)C1CCC(C)(C)CC1	ZINC001087318698	1359410849	/nfs/dbraw/zinc/41/08/49/1359410849.db2.gz	BKOAGZSNUFFGND-FGTMMUONSA-N	0	3	330.516	3.441	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc(CF)cc3)C(C)(C)[C@H]21	ZINC001087319433	1359411677	/nfs/dbraw/zinc/41/16/77/1359411677.db2.gz	NOMSITHMRHMCJR-SQNIBIBYSA-N	0	3	328.431	3.008	20	30		EGEDHN
C=C(C)CCN1CC[C@H](c2ccccc2)[C@H](NC(=O)c2ccon2)C1	ZINC001087422262	1359459546	/nfs/dbraw/zinc/45/95/46/1359459546.db2.gz	TZKBELIPQVPSDX-IEBWSBKVSA-N	0	3	339.439	3.229	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CN(CCC)CC[C@@H]2c2ccccc2)c1	ZINC001087437439	1359465808	/nfs/dbraw/zinc/46/58/08/1359465808.db2.gz	RJBYEULJYQAFIZ-NHCUHLMSSA-N	0	3	347.462	3.061	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)[C@H]2CC=CCC2)CCN1Cc1ccc(C#N)cc1	ZINC001087500639	1359499125	/nfs/dbraw/zinc/49/91/25/1359499125.db2.gz	TXHRVQIXYJKGQG-SLFFLAALSA-N	0	3	337.467	3.384	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)CC2CCC2)CCN1Cc1ccc(C#N)cc1	ZINC001087530908	1359513764	/nfs/dbraw/zinc/51/37/64/1359513764.db2.gz	ZPXRCWLOKWAVRU-RBUKOAKNSA-N	0	3	325.456	3.218	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cc(C)n([C@@H](C)CC)n2)[C@H]1CC	ZINC001087635095	1359565415	/nfs/dbraw/zinc/56/54/15/1359565415.db2.gz	JZRFARMMEOPDSL-QILLFSRXSA-N	0	3	332.492	3.321	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cccc(C(C)C)c2)[C@H]1CC	ZINC001087640885	1359566397	/nfs/dbraw/zinc/56/63/97/1359566397.db2.gz	CXTKUXMQLSUBAO-VQTJNVASSA-N	0	3	326.484	3.345	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2c(F)ccc(F)c2OC)[C@H]1CC	ZINC001087683294	1359588004	/nfs/dbraw/zinc/58/80/04/1359588004.db2.gz	VJOTXCLZGXQLQC-LSDHHAIUSA-N	0	3	338.398	3.132	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ncccc2OCCC)[C@H]1CC	ZINC001087711150	1359603516	/nfs/dbraw/zinc/60/35/16/1359603516.db2.gz	NNWCHQQPDGGMRP-JKSUJKDBSA-N	0	3	331.460	3.029	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cc(F)c(F)c(F)c2)[C@H]1CC	ZINC001087736023	1359617429	/nfs/dbraw/zinc/61/74/29/1359617429.db2.gz	ULXJLVXZUGXQGG-LSDHHAIUSA-N	0	3	326.362	3.263	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(F)c3ncccc3c2)[C@H]1CC	ZINC001087764457	1359633802	/nfs/dbraw/zinc/63/38/02/1359633802.db2.gz	RFRSFZDOSBWIBL-DLBZAZTESA-N	0	3	327.403	3.143	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2c(F)ccc(OC)c2F)[C@H]1CC	ZINC001087804779	1359654580	/nfs/dbraw/zinc/65/45/80/1359654580.db2.gz	VKEZCEBBGUEFNF-UONOGXRCSA-N	0	3	338.398	3.132	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)C2(c3cc(C)cc(C)c3)CC2)[C@H]1CC	ZINC001087831662	1359669718	/nfs/dbraw/zinc/66/97/18/1359669718.db2.gz	XXPPQLXXGWPYGA-RBUKOAKNSA-N	0	3	326.484	3.490	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cc(Cl)cc3c2OCC3)[C@H]1CC	ZINC001087843229	1359676254	/nfs/dbraw/zinc/67/62/54/1359676254.db2.gz	LAQPMXCLJVKBFR-DLBZAZTESA-N	0	3	348.874	3.434	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CCN(Cc3cnccc3C)C[C@H]2C1	ZINC001088064701	1359740319	/nfs/dbraw/zinc/74/03/19/1359740319.db2.gz	QPMFOWXTVCRZOR-MJGOQNOKSA-N	0	3	341.499	3.273	20	30		EGEDHN
CCC(C)(C)C(=O)N1C[C@H]2CCN(Cc3cccc(C#N)c3)C[C@H]2C1	ZINC001088084835	1359749931	/nfs/dbraw/zinc/74/99/31/1359749931.db2.gz	HKWVLGKSVRPFEE-MOPGFXCFSA-N	0	3	339.483	3.275	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)C[C@H](C)c3ccc(CC)cc3)C[C@@H]2C1	ZINC001088103126	1359757030	/nfs/dbraw/zinc/75/70/30/1359757030.db2.gz	KIXVXBIHTOVNKW-WMQCIHAUSA-N	0	3	338.495	3.156	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3ccc(C4CC4)s3)C[C@@H]2C1	ZINC001088169743	1359779888	/nfs/dbraw/zinc/77/98/88/1359779888.db2.gz	KYKJOFDCRYOVMH-CVEARBPZSA-N	0	3	328.481	3.043	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3sccc3C3CC3)C[C@@H]2C1	ZINC001088190657	1359788585	/nfs/dbraw/zinc/78/85/85/1359788585.db2.gz	LHXRZMQLFAXOJH-CVEARBPZSA-N	0	3	328.481	3.043	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)[C@H](C)c3cccc(Cl)c3)C[C@@H]2C1	ZINC001088206604	1359794262	/nfs/dbraw/zinc/79/42/62/1359794262.db2.gz	WZXNCHCAWQOGCR-NXHRZFHOSA-N	0	3	344.886	3.247	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)C(C)(C)c3ccccc3C)C[C@@H]2C1	ZINC001088221740	1359802973	/nfs/dbraw/zinc/80/29/73/1359802973.db2.gz	UKVQFBFMACACFC-MOPGFXCFSA-N	0	3	338.495	3.076	20	30		EGEDHN
C=CCN1CC[C@H](OCC2CCN(C(=O)[C@@]34C[C@@H]3CCCC4)CC2)C1	ZINC001088238632	1359809740	/nfs/dbraw/zinc/80/97/40/1359809740.db2.gz	ZJEVLEVDDJRVBH-ZJOUEHCJSA-N	0	3	346.515	3.082	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCCCC[C@@H](NCc3ccns3)C2)C1	ZINC001088379020	1359862229	/nfs/dbraw/zinc/86/22/29/1359862229.db2.gz	XZOMGUMLWCNSGL-OAHLLOKOSA-N	0	3	333.501	3.360	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2cnc(C3CC3)nc2)C1	ZINC001088394516	1359870721	/nfs/dbraw/zinc/87/07/21/1359870721.db2.gz	IMOBVPRIYHIRHZ-MRXNPFEDSA-N	0	3	348.878	3.081	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2cc(CCC)on2)C1	ZINC001088407862	1359878832	/nfs/dbraw/zinc/87/88/32/1359878832.db2.gz	HEGDEJPAUPHLHQ-CQSZACIVSA-N	0	3	339.867	3.354	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2cn3ccccc3n2)C1	ZINC001088420856	1359890499	/nfs/dbraw/zinc/89/04/99/1359890499.db2.gz	AJJGHMIOMSHMNP-OAHLLOKOSA-N	0	3	346.862	3.061	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccnc(-c3ccco3)c2)[C@H]1C	ZINC001088649032	1360001141	/nfs/dbraw/zinc/00/11/41/1360001141.db2.gz	GLSXCMLPPASOFM-ZBFHGGJFSA-N	0	3	325.412	3.110	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2cc(Cl)cc(Cl)c2)[C@H]1C	ZINC001089001619	1360132857	/nfs/dbraw/zinc/13/28/57/1360132857.db2.gz	RRZIHLQQUMTFQI-ABAIWWIYSA-N	0	3	325.239	3.209	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCCN1C(=O)c1ccncc1	ZINC001089105261	1360169514	/nfs/dbraw/zinc/16/95/14/1360169514.db2.gz	HRENQIHELFBINQ-FQEVSTJZSA-N	0	3	348.450	3.080	20	30		EGEDHN
Cc1nc(CNC[C@H]2CCN(C(=O)C#CC(C)(C)C)C[C@H]2C)cs1	ZINC001184371394	1387442795	/nfs/dbraw/zinc/44/27/95/1387442795.db2.gz	LZYCISUUQUUQAU-GDBMZVCRSA-N	0	3	347.528	3.075	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc3nccc(C)c3c2)CC(C)(C)C1	ZINC001089395909	1360395459	/nfs/dbraw/zinc/39/54/59/1360395459.db2.gz	BUDCTTGYJWBRFZ-SFHVURJKSA-N	0	3	349.478	3.397	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2c(C)noc2C(C)C)CC(C)(C)C1	ZINC001089408568	1360407307	/nfs/dbraw/zinc/40/73/07/1360407307.db2.gz	BWVQHSJKQGXJMB-INIZCTEOSA-N	0	3	345.487	3.350	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccccc2OCC=C)CC(C)(C)C1	ZINC001089424409	1360418191	/nfs/dbraw/zinc/41/81/91/1360418191.db2.gz	UITSWLAEPBCMQJ-QGZVFWFLSA-N	0	3	340.467	3.105	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2nc3ccccc3cc2C)CC(C)(C)C1	ZINC001089441337	1360431579	/nfs/dbraw/zinc/43/15/79/1360431579.db2.gz	XUVQILDPCWYIKR-GOSISDBHSA-N	0	3	349.478	3.397	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2cccc(C3CC3)c2)CC(C)(C)C1	ZINC001089448310	1360437139	/nfs/dbraw/zinc/43/71/39/1360437139.db2.gz	OSXAVTKUJNRCLF-FQEVSTJZSA-N	0	3	338.495	3.347	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc3c(c2)[C@@H](C)CO3)CC(C)(C)C1	ZINC001089468750	1360452555	/nfs/dbraw/zinc/45/25/55/1360452555.db2.gz	CQTUVNVSQCZUGW-RDJZCZTQSA-N	0	3	340.467	3.036	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(Cl)cc2OC)CC(C)(C)C1	ZINC001089472705	1360455931	/nfs/dbraw/zinc/45/59/31/1360455931.db2.gz	NPACPTSIZVPJDQ-HNNXBMFYSA-N	0	3	348.874	3.202	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(Cl)c(OC)c2)CC(C)(C)C1	ZINC001089510213	1360481614	/nfs/dbraw/zinc/48/16/14/1360481614.db2.gz	OTQLAIJKWCWUSC-OAHLLOKOSA-N	0	3	348.874	3.202	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc(CC(C)C)c[nH]2)CC(C)(C)C1	ZINC001089540725	1360498304	/nfs/dbraw/zinc/49/83/04/1360498304.db2.gz	WXKANFWJMFIOPI-KRWDZBQOSA-N	0	3	329.488	3.067	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2coc3ccc(F)cc23)CC(C)(C)C1	ZINC001089549384	1360502705	/nfs/dbraw/zinc/50/27/05/1360502705.db2.gz	XNGDUCCFFGHJGR-OAHLLOKOSA-N	0	3	342.414	3.426	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc3c(s2)CCC3)CC(C)(C)C1	ZINC001089553802	1360504856	/nfs/dbraw/zinc/50/48/56/1360504856.db2.gz	AIUSJTHGTFKYQG-OAHLLOKOSA-N	0	3	330.497	3.090	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2ccc(C)c(C)c2)CC(C)(C)C1	ZINC001089554878	1360506017	/nfs/dbraw/zinc/50/60/17/1360506017.db2.gz	FKXOMKMTCJUEGZ-LJQANCHMSA-N	0	3	326.484	3.086	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ccnn1C(F)F	ZINC001089647315	1360560477	/nfs/dbraw/zinc/56/04/77/1360560477.db2.gz	VFWSBVPVRFXKGY-ZDUSSCGKSA-N	0	3	340.418	3.075	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cc2c[nH]ccc-2n1	ZINC001089657240	1360569163	/nfs/dbraw/zinc/56/91/63/1360569163.db2.gz	BNKQOVUOHZCPSO-INIZCTEOSA-N	0	3	340.471	3.359	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cnc2ccccn12	ZINC001089660005	1360571231	/nfs/dbraw/zinc/57/12/31/1360571231.db2.gz	CTRMOXNIZHSFIL-INIZCTEOSA-N	0	3	340.471	3.131	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc2cccnn21	ZINC001089707405	1360610740	/nfs/dbraw/zinc/61/07/40/1360610740.db2.gz	IUGQXYAFBJQAJQ-QGZVFWFLSA-N	0	3	340.471	3.131	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cccc2[nH]c(C)nc21	ZINC001089721855	1360624752	/nfs/dbraw/zinc/62/47/52/1360624752.db2.gz	LMSRJAPBZGCHEE-OAHLLOKOSA-N	0	3	340.471	3.278	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)c2ccc(C)o2)C1	ZINC001089767649	1360656837	/nfs/dbraw/zinc/65/68/37/1360656837.db2.gz	XXSKNZSPKPSLLX-VGWMRTNUSA-N	0	3	334.847	3.123	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)C2(C)CCCC2)C1	ZINC001089848691	1360695966	/nfs/dbraw/zinc/69/59/66/1360695966.db2.gz	YLZOHAUGZXBAPX-QAETUUGQSA-N	0	3	336.907	3.488	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](CNCc2nccs2)[C@@H](C)C1	ZINC001184488707	1387470388	/nfs/dbraw/zinc/47/03/88/1387470388.db2.gz	XURGKKMBUQITHB-LSDHHAIUSA-N	0	3	335.517	3.320	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C2CCCCC2)CC2(CCOCC2)C1	ZINC001089921510	1360745455	/nfs/dbraw/zinc/74/54/55/1360745455.db2.gz	BRCOTMOBSNKWAF-GOSISDBHSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=C(C)CN1CC[C@@H](NC(=O)c2ccc(C3CCCC3)cc2)[C@H](O)C1	ZINC001090435722	1360896347	/nfs/dbraw/zinc/89/63/47/1360896347.db2.gz	JWYFPFUFHLMOKZ-WOJBJXKFSA-N	0	3	342.483	3.085	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ncsc2C(C)C)C1	ZINC001091319251	1361042639	/nfs/dbraw/zinc/04/26/39/1361042639.db2.gz	LBVWRXGTOCKGNP-UHFFFAOYSA-N	0	3	327.881	3.117	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(C)c3cccnc23)C1	ZINC001091151110	1360999159	/nfs/dbraw/zinc/99/91/59/1360999159.db2.gz	MKOMNJABNCNGAQ-UHFFFAOYSA-N	0	3	343.858	3.394	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(C)nc2C2CC2)C1	ZINC001091165293	1361000049	/nfs/dbraw/zinc/00/00/49/1361000049.db2.gz	ATGVOIVBGFAHKX-UHFFFAOYSA-N	0	3	333.863	3.118	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H]2C[C@H]2c2cccc(C)c2)C1	ZINC001091277484	1361029371	/nfs/dbraw/zinc/02/93/71/1361029371.db2.gz	RZJUZODIKNVANI-DQVOVIAYSA-N	0	3	332.875	3.335	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc(F)c3ncccc3c2)C1	ZINC001091283965	1361030810	/nfs/dbraw/zinc/03/08/10/1361030810.db2.gz	VZPHMPFAEJFIJW-UHFFFAOYSA-N	0	3	347.821	3.224	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3cc4ccc(F)cc4s3)C[C@]2(C)C1	ZINC001091828925	1361231531	/nfs/dbraw/zinc/23/15/31/1361231531.db2.gz	FNDNXQIHFMMRSM-KUHUBIRLSA-N	0	3	342.439	3.068	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CN(Cc3c(C)onc3CC)C[C@@]2(C)C1	ZINC001091916317	1361247616	/nfs/dbraw/zinc/24/76/16/1361247616.db2.gz	FSOBBUWRMFRZER-QRWLVFNGSA-N	0	3	345.487	3.038	20	30		EGEDHN
C[C@]1(C(=O)N2C[C@H]3CN(Cc4cccc(C#N)c4)C[C@@]3(C)C2)C=CCC1	ZINC001091929250	1361252672	/nfs/dbraw/zinc/25/26/72/1361252672.db2.gz	FLSPOIWQBCLTQD-HJNYFJLDSA-N	0	3	349.478	3.195	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CN(Cc3scnc3C)C[C@@]2(C)C1	ZINC001091978451	1361265354	/nfs/dbraw/zinc/26/53/54/1361265354.db2.gz	RRDQUPOJZIQLIK-LZQZEXGQSA-N	0	3	347.528	3.334	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C[C@@H](C)C3CCCCC3)C[C@]2(C)C1	ZINC001092093105	1361299870	/nfs/dbraw/zinc/29/98/70/1361299870.db2.gz	MWYFUXDGJUFJEK-QFUCXCTJSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)[C@H](CC)c3ccc(Cl)cc3)C[C@]2(C)C1	ZINC001092294240	1361355919	/nfs/dbraw/zinc/35/59/19/1361355919.db2.gz	NCRAPIXGBAUIFK-POAQFYNOSA-N	0	3	344.886	3.247	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)NC[C@@H]1CN(CC#Cc2ccc(Cl)cc2)C[C@H]1C	ZINC001092890612	1361479165	/nfs/dbraw/zinc/47/91/65/1361479165.db2.gz	ZRFYUJYJOLKKND-MGTHKWJCSA-N	0	3	344.886	3.032	20	30		EGEDHN
CC(=O)N1CCC([C@H]2N(CC#Cc3ccccc3)CC23CCC3)CC1	ZINC001093349888	1361564106	/nfs/dbraw/zinc/56/41/06/1361564106.db2.gz	YKVNIADEDKGGMO-OAQYLSRUSA-N	0	3	336.479	3.151	20	30		EGEDHN
C[C@@H]1CN(C(=O)C[C@@H]2C=CCC2)C[C@H]1CNCc1ccccc1C#N	ZINC001093627336	1361662748	/nfs/dbraw/zinc/66/27/48/1361662748.db2.gz	CHDLBPAAKBUYNC-MBOZVWFJSA-N	0	3	337.467	3.099	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@@]2(C)C=CCC2)C[C@H]1CNCc1ccccc1C#N	ZINC001093974833	1361723254	/nfs/dbraw/zinc/72/32/54/1361723254.db2.gz	CYMOXYPGOJLTMR-BSIFCXSSSA-N	0	3	337.467	3.099	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@]12CCC[C@H]1N(C/C=C/Cl)CC2	ZINC001094434278	1361799819	/nfs/dbraw/zinc/79/98/19/1361799819.db2.gz	ZYLBNHKGLOFESJ-PPJOAQQTSA-N	0	3	347.890	3.401	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@]12CCC[C@H]1N(C/C=C\Cl)CC2	ZINC001094434277	1361800231	/nfs/dbraw/zinc/80/02/31/1361800231.db2.gz	ZYLBNHKGLOFESJ-LDHAIWNLSA-N	0	3	347.890	3.401	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3ccc(-c4ccco4)o3)CCC[C@@H]12	ZINC001094466148	1361814619	/nfs/dbraw/zinc/81/46/19/1361814619.db2.gz	DTLLNRYIWVFGLB-UYAOXDASSA-N	0	3	338.407	3.147	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3ccc4c(c3)CCC=C4)CCC[C@@H]12	ZINC001094561780	1361860587	/nfs/dbraw/zinc/86/05/87/1361860587.db2.gz	FTFVZLBVUGWOQL-IFMALSPDSA-N	0	3	334.463	3.254	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccccc1	ZINC001095537889	1362164066	/nfs/dbraw/zinc/16/40/66/1362164066.db2.gz	NWUPRWNECKYKHB-QYZOEREBSA-N	0	3	335.451	3.209	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cnc(-c3ccccc3)o1)C2	ZINC001095578871	1362175106	/nfs/dbraw/zinc/17/51/06/1362175106.db2.gz	COZJMBHPYBOACV-IKGGRYGDSA-N	0	3	337.423	3.253	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1cccc3cccnc31)C2	ZINC001095838873	1362251243	/nfs/dbraw/zinc/25/12/43/1362251243.db2.gz	GIALRPDPHLYTAN-QYZOEREBSA-N	0	3	335.451	3.075	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](CNCc2cnc(C)o2)[C@H](C)C1	ZINC001184943916	1387567340	/nfs/dbraw/zinc/56/73/40/1387567340.db2.gz	BKOLMJAMZKWQKF-AEFFLSMTSA-N	0	3	345.487	3.141	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](CNCc2ocnc2C)[C@@H](C)C1	ZINC001184945442	1387568010	/nfs/dbraw/zinc/56/80/10/1387568010.db2.gz	NQLFCHAHLQRNML-FUHWJXTLSA-N	0	3	345.487	3.141	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1ccc(Cl)c(F)c1)C2	ZINC001096065021	1362361000	/nfs/dbraw/zinc/36/10/00/1362361000.db2.gz	IMVCJYSQWOAYCU-COXVUDFISA-N	0	3	336.838	3.319	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](CNCc2ncc(C)s2)[C@H](C)C1	ZINC001184970168	1387576682	/nfs/dbraw/zinc/57/66/82/1387576682.db2.gz	UEQSEWIVPXBFAS-NVXWUHKLSA-N	0	3	347.528	3.219	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cccc(OCC(C)C)c1)C2	ZINC001096512352	1362544486	/nfs/dbraw/zinc/54/44/86/1362544486.db2.gz	HQYRISHFGMNAFW-HOJAQTOUSA-N	0	3	340.467	3.080	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc3[nH]c(C)c(C)c3c1)C2	ZINC001096524985	1362553747	/nfs/dbraw/zinc/55/37/47/1362553747.db2.gz	XASZFOKFOURWPO-UXPWSPDFSA-N	0	3	335.451	3.143	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C1CC(c3ccc(F)cc3)C1)C2	ZINC001096667124	1362624822	/nfs/dbraw/zinc/62/48/22/1362624822.db2.gz	GBSRAPLJYOQJIX-BLXWGWSPSA-N	0	3	340.442	3.064	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](NCc2ccc(F)c(Cl)c2)C1	ZINC001185020262	1387590099	/nfs/dbraw/zinc/59/00/99/1387590099.db2.gz	TUSVQESJBPTETR-OAHLLOKOSA-N	0	3	336.838	3.363	20	30		EGEDHN
Cc1cc(C)cc(CN2[C@@H]3CC[C@H]2[C@H](NC(=O)c2cc(C#N)c[nH]2)C3)c1	ZINC001096924393	1362778038	/nfs/dbraw/zinc/77/80/38/1362778038.db2.gz	FJXBIIIACZRHNL-GGPKGHCWSA-N	0	3	348.450	3.039	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@@H](NCc2ccccc2N(C)C)C1	ZINC001185049205	1387596772	/nfs/dbraw/zinc/59/67/72/1387596772.db2.gz	JZRGYPDIMSUFLJ-SJLPKXTDSA-N	0	3	329.488	3.045	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc(F)c3ccccc3c1)C2	ZINC001097184892	1362877857	/nfs/dbraw/zinc/87/78/57/1362877857.db2.gz	DHZPAHRKWIHZID-AHRSYUTCSA-N	0	3	336.410	3.337	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1ccc3cnccc3c1)C2	ZINC001097521961	1363037375	/nfs/dbraw/zinc/03/73/75/1363037375.db2.gz	GRZUKOCKDUNCFX-AQNXPRMDSA-N	0	3	335.451	3.075	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@@H]1C[C@H]1Cc1ccccc1)C2	ZINC001097573570	1363059081	/nfs/dbraw/zinc/05/90/81/1363059081.db2.gz	GFPVAVMEAJHUAD-XNTOXWQXSA-N	0	3	336.479	3.000	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc3cc(F)ccc3o1)C2	ZINC001097961526	1363181188	/nfs/dbraw/zinc/18/11/88/1363181188.db2.gz	IORUBWQOZNENKQ-OAGGEKHMSA-N	0	3	328.387	3.483	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@H](CNCc3nccs3)[C@@H](C)C2)CC1	ZINC001185094463	1387617358	/nfs/dbraw/zinc/61/73/58/1387617358.db2.gz	IRRQUDXXOAZPAQ-JKSUJKDBSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1sc(CC)nc1C)C2	ZINC001098026320	1363200456	/nfs/dbraw/zinc/20/04/56/1363200456.db2.gz	SAGTZZVQLQPBNA-KFWWJZLASA-N	0	3	333.501	3.315	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1c(C)oc(C)c1C)C[C@H](C)O2	ZINC001098614520	1363399665	/nfs/dbraw/zinc/39/96/65/1363399665.db2.gz	RNYSVDBCPNUVDH-AWEZNQCLSA-N	0	3	346.471	3.086	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccccc1CC)C[C@@H](C)O2	ZINC001098631217	1363406968	/nfs/dbraw/zinc/40/69/68/1363406968.db2.gz	RVBKROSHWBYYBD-QGZVFWFLSA-N	0	3	342.483	3.131	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@@H](C)c1ccco1)C[C@@H](C)O2	ZINC001098657199	1363422140	/nfs/dbraw/zinc/42/21/40/1363422140.db2.gz	YZJWIRYOUCUGAF-IAGOWNOFSA-N	0	3	346.471	3.041	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@@H](C)c1ccco1)C[C@H](C)O2	ZINC001098657201	1363422144	/nfs/dbraw/zinc/42/21/44/1363422144.db2.gz	YZJWIRYOUCUGAF-SJORKVTESA-N	0	3	346.471	3.041	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H]1CCCC(C)(C)C1)C[C@@H](C)O2	ZINC001098664748	1363426051	/nfs/dbraw/zinc/42/60/51/1363426051.db2.gz	WAAQOXPTRBTMTK-QZTJIDSGSA-N	0	3	348.531	3.471	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CCC[C@]3(NC(=O)C[C@H]3C=CCC3)C2)c1	ZINC001098721077	1363449276	/nfs/dbraw/zinc/44/92/76/1363449276.db2.gz	ZVGJUDVOLVIKLM-XJABCFGWSA-N	0	3	349.478	3.385	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(C)nn2C(CC)CC)C1	ZINC001098914340	1363518244	/nfs/dbraw/zinc/51/82/44/1363518244.db2.gz	SFHVJTWJWRFEFJ-JXFKEZNVSA-N	0	3	344.503	3.323	20	30		EGEDHN
C#CCCCC(=O)NC[C@@H]1CCC(C)(C)CN1CCc1ccns1	ZINC001099042830	1363589469	/nfs/dbraw/zinc/58/94/69/1363589469.db2.gz	CKTTVAIMKSZRGJ-INIZCTEOSA-N	0	3	347.528	3.096	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)Cc2ccc(Cl)c(F)c2)C1	ZINC001099050272	1363595499	/nfs/dbraw/zinc/59/54/99/1363595499.db2.gz	ONNQXNDCLLTMHK-KXBFYZLASA-N	0	3	348.849	3.016	20	30		EGEDHN
CCCCOCCN1CC(C)(C)CC[C@H]1CNC(=O)C#CC(C)C	ZINC001099065119	1363604351	/nfs/dbraw/zinc/60/43/51/1363604351.db2.gz	MVDPALMDHSGGSE-SFHVURJKSA-N	0	3	336.520	3.069	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2oc(CC(C)C)nc2C)C1	ZINC001099066566	1363605145	/nfs/dbraw/zinc/60/51/45/1363605145.db2.gz	IJAFBEPXRVFBLD-JXFKEZNVSA-N	0	3	345.487	3.342	20	30		EGEDHN
CC(C)CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)C#CC1CC1	ZINC001099069438	1363605591	/nfs/dbraw/zinc/60/55/91/1363605591.db2.gz	HRUCTZYVPHNHTK-LJQANCHMSA-N	0	3	348.531	3.069	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)C[C@@H]2CCc3ccccc32)C1	ZINC001099088278	1363617002	/nfs/dbraw/zinc/61/70/02/1363617002.db2.gz	FDKOZZOOTYQCJL-IPJJNNNSSA-N	0	3	336.479	3.101	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cccc(N3CCCC3)c2)C1	ZINC001099092378	1363618133	/nfs/dbraw/zinc/61/81/33/1363618133.db2.gz	AOYMHIPQLAZMIO-RXVVDRJESA-N	0	3	339.483	3.057	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H]2CC[C@H](C(C)C)CC2)C1	ZINC001099095275	1363619648	/nfs/dbraw/zinc/61/96/48/1363619648.db2.gz	RKSKBCUMFRJKKH-IWFBPKFRSA-N	0	3	330.516	3.443	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)C1(COC)CCCCC1	ZINC001099102293	1363622936	/nfs/dbraw/zinc/62/29/36/1363622936.db2.gz	LHDDHVKUJRORTQ-KRWDZBQOSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)CCCc1ncc(C)o1	ZINC001099101978	1363622956	/nfs/dbraw/zinc/62/29/56/1363622956.db2.gz	IFMRJLFGMMORRW-MRXNPFEDSA-N	0	3	333.476	3.099	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)CCCC1CCOCC1	ZINC001099103458	1363624029	/nfs/dbraw/zinc/62/40/29/1363624029.db2.gz	ZVFIKDCHIVUXOY-GOSISDBHSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H](C)C1CCC1	ZINC001099126240	1363638515	/nfs/dbraw/zinc/63/85/15/1363638515.db2.gz	PWHREPUHVZRRCF-WMZOPIPTSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2cc3nc(C)ccc3o2)C1	ZINC001099131459	1363643877	/nfs/dbraw/zinc/64/38/77/1363643877.db2.gz	ZGIZFQYHARKYAW-YWZLYKJASA-N	0	3	339.439	3.297	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(C3CC3)cn2)C1	ZINC001099143323	1363651821	/nfs/dbraw/zinc/65/18/21/1363651821.db2.gz	SGQKBHUFDUSTDK-PXNSSMCTSA-N	0	3	325.456	3.119	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@@H]1CCC(C)(C)CN1CCOCC	ZINC001099171195	1363669211	/nfs/dbraw/zinc/66/92/11/1363669211.db2.gz	OHHKJVYZFQZYJM-SFHVURJKSA-N	0	3	336.520	3.213	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@H]1CCC(C)(C)CN1CCn1cccn1	ZINC001099215657	1363696558	/nfs/dbraw/zinc/69/65/58/1363696558.db2.gz	YGZLGYTZGGMZSF-XLIONFOSSA-N	0	3	346.519	3.092	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H](C)C(C)(F)F	ZINC001099234862	1363705280	/nfs/dbraw/zinc/70/52/80/1363705280.db2.gz	NRRDOCVQVYURSH-CABCVRRESA-N	0	3	346.462	3.087	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)CCCn1nc(C)cc1C	ZINC001099251141	1363713456	/nfs/dbraw/zinc/71/34/56/1363713456.db2.gz	GDXURLMXLDINIK-SFHVURJKSA-N	0	3	346.519	3.073	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)C2CCC3(CC3)CC2)C[C@H]1C(F)(F)F	ZINC001099279672	1363728980	/nfs/dbraw/zinc/72/89/80/1363728980.db2.gz	RAOCQWYYMAOZNQ-ZIAGYGMSSA-N	0	3	330.394	3.122	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)C(C1CC1)C1CC1	ZINC001099303302	1363739343	/nfs/dbraw/zinc/73/93/43/1363739343.db2.gz	GBRFCZAGTOHSJW-GOSISDBHSA-N	0	3	348.531	3.232	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)CCCc1ccccn1	ZINC001099320265	1363747862	/nfs/dbraw/zinc/74/78/62/1363747862.db2.gz	HSZYYLWOUPUBRK-GOSISDBHSA-N	0	3	329.488	3.197	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)COc1cc(C)ccc1C	ZINC001099340346	1363760749	/nfs/dbraw/zinc/76/07/49/1363760749.db2.gz	RZBOEDZIWVNVDT-GOSISDBHSA-N	0	3	344.499	3.475	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H](C)n1c(C)ccc1C	ZINC001099354276	1363768116	/nfs/dbraw/zinc/76/81/16/1363768116.db2.gz	QCRPVQQPBMTXAA-MOPGFXCFSA-N	0	3	343.515	3.296	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@H](C)OCCC(C)C	ZINC001099360669	1363773486	/nfs/dbraw/zinc/77/34/86/1363773486.db2.gz	ZSWJDMKAHOUCIB-ROUUACIJSA-N	0	3	336.520	3.068	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)[C@](C)(CC)CCC)CC2(CCOCC2)C1	ZINC001099594654	1363877212	/nfs/dbraw/zinc/87/72/12/1363877212.db2.gz	IIEWVTBAJYGPSS-UYAOXDASSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)[C@@H](CC)CC(C)C)CC2(CCOCC2)C1	ZINC001099597041	1363880236	/nfs/dbraw/zinc/88/02/36/1363880236.db2.gz	RDXONZVAEJYZBA-ROUUACIJSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CCN(Cc2ccc(CCC)cc2)C[C@@H]1O	ZINC001099977349	1363995460	/nfs/dbraw/zinc/99/54/60/1363995460.db2.gz	XMBQTOHQJKRZPA-UXHICEINSA-N	0	3	344.499	3.047	20	30		EGEDHN
CC(C)[C@@H](C)CC(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100172723	1364035886	/nfs/dbraw/zinc/03/58/86/1364035886.db2.gz	CPFBOTSOZIYOPP-VQSBYGRUSA-N	0	3	344.474	3.344	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](CNCc2cc(C)no2)[C@@H](C)C1	ZINC001185223909	1387656288	/nfs/dbraw/zinc/65/62/88/1387656288.db2.gz	BLZQHFPAZOGJPE-HOCLYGCPSA-N	0	3	333.476	3.160	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)NCC1CC(NCC#Cc2ccc(Cl)cc2)C1	ZINC001100245719	1364056556	/nfs/dbraw/zinc/05/65/56/1364056556.db2.gz	BOTUPJMXGOKUFD-VMWRSERWSA-N	0	3	344.886	3.222	20	30		EGEDHN
C#CCCCC(=O)NCC1CC(NCc2ccc(Cl)cc2F)C1	ZINC001100283823	1364067449	/nfs/dbraw/zinc/06/74/49/1364067449.db2.gz	XAZCTQFXVOFZBQ-UHFFFAOYSA-N	0	3	336.838	3.267	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)CC(C)(C)CC)C1	ZINC001100361997	1364091692	/nfs/dbraw/zinc/09/16/92/1364091692.db2.gz	LJZKAHYTILTGNM-UHFFFAOYSA-N	0	3	331.298	3.206	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)C(C)(C)C(C)C)C1	ZINC001100365916	1364093420	/nfs/dbraw/zinc/09/34/20/1364093420.db2.gz	UADQMNWPFQYTRH-UHFFFAOYSA-N	0	3	331.298	3.062	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)CC2(c3ccccc3)CC2)C1	ZINC001100394508	1364100700	/nfs/dbraw/zinc/10/07/00/1364100700.db2.gz	GXVOYAIVVVNMHB-UHFFFAOYSA-N	0	3	332.875	3.345	20	30		EGEDHN
C[C@H](C(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1)C(C)(C)C	ZINC001100448235	1364118883	/nfs/dbraw/zinc/11/88/83/1364118883.db2.gz	MFGFNIPDNBUGBN-BZOOQXSSSA-N	0	3	345.462	3.364	20	30		EGEDHN
Cc1ccc(CC(=O)NCC2CC(NCC#Cc3ccccc3)C2)cc1	ZINC001100484711	1364130628	/nfs/dbraw/zinc/13/06/28/1364130628.db2.gz	VDACCAKLMVFSPP-UHFFFAOYSA-N	0	3	346.474	3.074	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)Cc2c(C)[nH]c3ccccc32)C1	ZINC001100622236	1364193290	/nfs/dbraw/zinc/19/32/90/1364193290.db2.gz	GSQYLCARDVPNSJ-UHFFFAOYSA-N	0	3	345.874	3.256	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC1CC(NCc2c(C)onc2CC)C1	ZINC001100644716	1364202140	/nfs/dbraw/zinc/20/21/40/1364202140.db2.gz	DIUAALRILZVDMS-JFIBYHEFSA-N	0	3	333.476	3.132	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)[C@@H](CC)CC(C)C)C1	ZINC001100839491	1364284781	/nfs/dbraw/zinc/28/47/81/1364284781.db2.gz	NZNKCVWNLQCMRY-SLTAFYQDSA-N	0	3	345.325	3.452	20	30		EGEDHN
C[C@@H](CC(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1)C1CC1	ZINC001101042585	1364387162	/nfs/dbraw/zinc/38/71/62/1364387162.db2.gz	HVLWOISQTSZECD-FVWXCPNNSA-N	0	3	342.458	3.098	20	30		EGEDHN
C[C@@H](CC(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1)C1CC1	ZINC001101042500	1364387344	/nfs/dbraw/zinc/38/73/44/1364387344.db2.gz	DOWLTAUZJIYXPD-UQHVZDHRSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=CCC1(C(=O)NCC2CC(NCc3c(C)noc3C)C2)CCCC1	ZINC001101080404	1364403990	/nfs/dbraw/zinc/40/39/90/1364403990.db2.gz	NWOPHNUELXXNBW-UHFFFAOYSA-N	0	3	345.487	3.412	20	30		EGEDHN
C=C(C)CN1CC[C@@H](Oc2ccnc(CNC(=O)C[C@@H](C)CC)c2)C1	ZINC001101093828	1364410144	/nfs/dbraw/zinc/41/01/44/1364410144.db2.gz	KWMNPTYQMSUCNV-QFBILLFUSA-N	0	3	345.487	3.163	20	30		EGEDHN
CCCC[C@@H](CC)CC(=O)N1C[C@H]2CN(CC#CCOC)C[C@@]2(C)C1	ZINC001101306248	1364504770	/nfs/dbraw/zinc/50/47/70/1364504770.db2.gz	ICIHACTYIVXJHM-SBHAEUEKSA-N	0	3	348.531	3.023	20	30		EGEDHN
C=CCCCC(=O)N1C[C@H]2CN(Cc3ccc(C)nc3C)C[C@@]2(C)C1	ZINC001101347058	1364520772	/nfs/dbraw/zinc/52/07/72/1364520772.db2.gz	UJUZDMCNUAELJI-CTNGQTDRSA-N	0	3	341.499	3.335	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)CCCCCc3cccs3)C[C@]2(C)C1	ZINC001101396828	1364544170	/nfs/dbraw/zinc/54/41/70/1364544170.db2.gz	MYEVWXMUPOZZKE-XLIONFOSSA-N	0	3	344.524	3.265	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)[C@@H](C)CCCc3ccccc3)C[C@]2(C)C1	ZINC001101479449	1364576743	/nfs/dbraw/zinc/57/67/43/1364576743.db2.gz	PFBAGNCENRZHEN-DWLFOUALSA-N	0	3	338.495	3.059	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)[C@H](C)CCCc3ccccc3)C[C@]2(C)C1	ZINC001101479450	1364576988	/nfs/dbraw/zinc/57/69/88/1364576988.db2.gz	PFBAGNCENRZHEN-UZKOGDIHSA-N	0	3	338.495	3.059	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1CC2(CN(CC3CCCC3)C2)n2ccnc21	ZINC001101630420	1364662589	/nfs/dbraw/zinc/66/25/89/1364662589.db2.gz	GTZHPAHGLMWTKE-KRWDZBQOSA-N	0	3	342.487	3.002	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC[C@@H]1CN(Cc2conc2CC)C[C@H]1C	ZINC001101996999	1364804403	/nfs/dbraw/zinc/80/44/03/1364804403.db2.gz	SPCLHIXYBPKBMF-NVXWUHKLSA-N	0	3	345.487	3.190	20	30		EGEDHN
C[C@H](C(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C)C1CCC1	ZINC001102079790	1364842189	/nfs/dbraw/zinc/84/21/89/1364842189.db2.gz	FJIBOZXENIEBMP-IJEWVQPXSA-N	0	3	345.512	3.240	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@@H]1CN(Cc2c(C)onc2CC)C[C@H]1C	ZINC001102261174	1364973965	/nfs/dbraw/zinc/97/39/65/1364973965.db2.gz	QCIJCJSNNDMACI-BFYDXBDKSA-N	0	3	347.503	3.332	20	30		EGEDHN
CC(C)[C@H](C)C(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C	ZINC001102423443	1365048465	/nfs/dbraw/zinc/04/84/65/1365048465.db2.gz	XGSFGHIXSYJZOL-WSTZPKSXSA-N	0	3	326.484	3.014	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1CCNC(=O)C1CCC1	ZINC001102632457	1365144053	/nfs/dbraw/zinc/14/40/53/1365144053.db2.gz	XSBNPCRJLYYWBV-VQIMIIECSA-N	0	3	342.458	3.052	20	30		EGEDHN
CC[C@H](C)C(=O)NCC[C@@H]1CN(Cc2cc(C#N)ccc2F)C[C@H]1C	ZINC001102680131	1365167390	/nfs/dbraw/zinc/16/73/90/1365167390.db2.gz	XIQQMKWAHDRNHI-ZMSDIMECSA-N	0	3	345.462	3.318	20	30		EGEDHN
C=CCCC(=O)NCC[C@@H]1CN(Cc2nc(C)sc2C)C[C@H]1C	ZINC001102762306	1365207829	/nfs/dbraw/zinc/20/78/29/1365207829.db2.gz	VWFVSEDBKRUUGJ-CZUORRHYSA-N	0	3	335.517	3.300	20	30		EGEDHN
C/C=C(/C)C(=O)NCC[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1C	ZINC001102841974	1365247085	/nfs/dbraw/zinc/24/70/85/1365247085.db2.gz	OXDSFLNCMULYHQ-YPHGIUPASA-N	0	3	343.446	3.238	20	30		EGEDHN
C#CCCCCC(=O)NCC[C@@H]1CN([C@H](C)c2ncc(C)o2)C[C@H]1C	ZINC001102883487	1365272422	/nfs/dbraw/zinc/27/24/22/1365272422.db2.gz	UARPQSKXJNJITF-KBAYOESNSA-N	0	3	345.487	3.312	20	30		EGEDHN
C=CCC1(C(=O)NCC[C@@H]2CN(Cc3cnc(C)o3)C[C@H]2C)CCC1	ZINC001103404433	1365539940	/nfs/dbraw/zinc/53/99/40/1365539940.db2.gz	BKDNAQWSCIEENT-NVXWUHKLSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC[C@@H]1CN(Cc2ccns2)C[C@H]1C	ZINC001103475285	1365584679	/nfs/dbraw/zinc/58/46/79/1365584679.db2.gz	ZWAXVUOPKRTSAV-HUUCEWRRSA-N	0	3	335.517	3.320	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)C[C@H](C)c2cccnc2)C1	ZINC001103493960	1365595952	/nfs/dbraw/zinc/59/59/52/1365595952.db2.gz	JNPXEGKVVCFSRH-HDMKZQKVSA-N	0	3	349.906	3.402	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)CCC2CCOCC2)C1	ZINC001103494162	1365595964	/nfs/dbraw/zinc/59/59/64/1365595964.db2.gz	NNBLDQHIJVQGRH-RHSMWYFYSA-N	0	3	342.911	3.020	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2c(C)nsc2C)C1	ZINC001103762103	1365770157	/nfs/dbraw/zinc/77/01/57/1365770157.db2.gz	XWSXCCUYFJNISY-QMTHXVAHSA-N	0	3	341.908	3.200	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2ccc(C)s2)C[C@H]1C	ZINC001103828315	1365801230	/nfs/dbraw/zinc/80/12/30/1365801230.db2.gz	VORXTBACIVWLNF-BXUZGUMPSA-N	0	3	326.893	3.497	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)CCC(F)(F)F)C[C@H]1C	ZINC001104032298	1365882591	/nfs/dbraw/zinc/88/25/91/1365882591.db2.gz	OWYLYRFJXSJPGV-ZYHUDNBSSA-N	0	3	326.790	3.156	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CN(C(=O)CC2CCC2)C[C@H]1C	ZINC001104036723	1365884359	/nfs/dbraw/zinc/88/43/59/1365884359.db2.gz	FQCPCJUHOCBYII-IUODEOHRSA-N	0	3	343.309	3.159	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cc(CC)ccn2)C[C@H]1C	ZINC001104228936	1365960544	/nfs/dbraw/zinc/96/05/44/1365960544.db2.gz	WAORXRYCEJDYFI-CZUORRHYSA-N	0	3	335.879	3.084	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2(C)CC2)C[C@H]1CCNCc1ccccc1C#N	ZINC001104429795	1366025058	/nfs/dbraw/zinc/02/50/58/1366025058.db2.gz	BHRQTXLOADUXHK-VQIMIIECSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)[C@H](CCNCc2ccccc2C#N)C1	ZINC001104491918	1366046963	/nfs/dbraw/zinc/04/69/63/1366046963.db2.gz	ILYZCYNMODQWJO-VQIMIIECSA-N	0	3	339.483	3.345	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCCF)C[C@H]1CCNCc1ccc(C#N)cc1F	ZINC001104509506	1366054271	/nfs/dbraw/zinc/05/42/71/1366054271.db2.gz	LKMGNRJUPYUJSB-RHSMWYFYSA-N	0	3	349.425	3.021	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2conc2CC)C1	ZINC001104607320	1366099170	/nfs/dbraw/zinc/09/91/70/1366099170.db2.gz	PAPNODORBJIWLN-HZPDHXFCSA-N	0	3	333.476	3.168	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H](C)[C@H](CCNCc2c(C)noc2C)C1	ZINC001104731343	1366148791	/nfs/dbraw/zinc/14/87/91/1366148791.db2.gz	CZXKTIGXOMXOLI-RHSMWYFYSA-N	0	3	347.503	3.468	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C2(CCC=C)CC2)CC1	ZINC001105396697	1366445317	/nfs/dbraw/zinc/44/53/17/1366445317.db2.gz	SRMWIXZOMMUTCG-LJQANCHMSA-N	0	3	340.511	3.459	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(c2ccccc2)C[C@H](NC(=O)c2ccc[nH]2)C1	ZINC001105404731	1366450597	/nfs/dbraw/zinc/45/05/97/1366450597.db2.gz	PJDJMHQYDHPCEN-UWUNEBHHSA-N	0	3	343.858	3.187	20	30		EGEDHN
CCCCCCCNCc1cn([C@H]2CCCN(C(=O)CCC)C2)nn1	ZINC001185842841	1387813137	/nfs/dbraw/zinc/81/31/37/1387813137.db2.gz	MSYSSPIRLHKZSF-SFHVURJKSA-N	0	3	349.523	3.302	20	30		EGEDHN
C=CCCC(=O)N1CCCC[C@@H]1C1(CNCc2nccn2C)CCC1	ZINC001105522718	1366507548	/nfs/dbraw/zinc/50/75/48/1366507548.db2.gz	NRJKCHVOPZXIHG-QGZVFWFLSA-N	0	3	344.503	3.027	20	30		EGEDHN
C[C@@H]1CN(C(=O)/C=C/C(C)(C)C)C[C@H]1CNCc1ccccc1C#N	ZINC001105956214	1366602106	/nfs/dbraw/zinc/60/21/06/1366602106.db2.gz	QBYBLJUEIGXZGU-LBDIVEORSA-N	0	3	339.483	3.345	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](CNCc2csc(CC)n2)[C@H](C)C1	ZINC001106180908	1366617452	/nfs/dbraw/zinc/61/74/52/1366617452.db2.gz	CMOMEHZTBCGWDO-HUUCEWRRSA-N	0	3	349.544	3.492	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](CNCc2ccn(C(C)C)n2)[C@H](C)C1	ZINC001106190387	1366619343	/nfs/dbraw/zinc/61/93/43/1366619343.db2.gz	HHAGUOLXFPBPMU-IAGOWNOFSA-N	0	3	332.492	3.004	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H](CNCc2cc(C3CC3)no2)[C@H](C)C1	ZINC001106563996	1366737220	/nfs/dbraw/zinc/73/72/20/1366737220.db2.gz	PKXYFXWBODXHPA-BFYDXBDKSA-N	0	3	345.487	3.338	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@]12CCC[C@H]1N(Cc1cnoc1C)CC2	ZINC001107420986	1366959708	/nfs/dbraw/zinc/95/97/08/1366959708.db2.gz	RXYBMYNPIDXNHN-YLJYHZDGSA-N	0	3	345.487	3.446	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](N(C)CCOc2cccc(Cl)c2)C1	ZINC001189318655	1366988467	/nfs/dbraw/zinc/98/84/67/1366988467.db2.gz	NNKNFAYEDLLVEP-MRXNPFEDSA-N	0	3	336.863	3.218	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](N(C)CCOc2ccc(Cl)cc2)C1	ZINC001189319418	1366988757	/nfs/dbraw/zinc/98/87/57/1366988757.db2.gz	ZDVMGAJDBQEUMS-INIZCTEOSA-N	0	3	336.863	3.218	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@]12CCC[C@H]1N(Cc1ocnc1C)CC2	ZINC001107503060	1367001336	/nfs/dbraw/zinc/00/13/36/1367001336.db2.gz	QORUCBNOFNDYBV-VQIMIIECSA-N	0	3	331.460	3.056	20	30		EGEDHN
C=CCCCC(=O)NC[C@]12CCC[C@H]1N(Cc1cccnc1)CC2	ZINC001107524077	1367017827	/nfs/dbraw/zinc/01/78/27/1367017827.db2.gz	GQPJZXKAJBLNMQ-UYAOXDASSA-N	0	3	327.472	3.299	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccccc1C1CC1	ZINC001109250281	1367026203	/nfs/dbraw/zinc/02/62/03/1367026203.db2.gz	OIYBBKVYPOIMIK-GIVPXCGWSA-N	0	3	336.479	3.445	20	30		EGEDHN
C=CCCOCCCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CC=C(C)C	ZINC001109281562	1367038140	/nfs/dbraw/zinc/03/81/40/1367038140.db2.gz	LBKZADFMYUWOBU-QYZOEREBSA-N	0	3	334.504	3.437	20	30		EGEDHN
COCC#CCN1CC[C@@]2(CNC(=O)C[C@H](C)CC(C)C)CCC[C@@H]12	ZINC001107605912	1367068173	/nfs/dbraw/zinc/06/81/73/1367068173.db2.gz	CFYPTIVRNVRABP-SFHLNBCPSA-N	0	3	348.531	3.069	20	30		EGEDHN
CCC(=CC(=O)N1CC[C@@H](N(C)Cc2cccc(C#N)c2)C1)CC	ZINC001189631879	1367074310	/nfs/dbraw/zinc/07/43/10/1367074310.db2.gz	KXCCSHNJICYWHO-LJQANCHMSA-N	0	3	325.456	3.337	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccc(COC)cc1	ZINC001109351155	1367081624	/nfs/dbraw/zinc/08/16/24/1367081624.db2.gz	PLVHPXFXDMXMEW-AABGKKOBSA-N	0	3	342.483	3.411	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](N(C)CCOc2ccccc2C)C1	ZINC001189743927	1367100524	/nfs/dbraw/zinc/10/05/24/1367100524.db2.gz	KMWJAYBIVXVMJO-IBGZPJMESA-N	0	3	342.483	3.100	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCc1cc3ccccc3o1)C2	ZINC001109502762	1367161998	/nfs/dbraw/zinc/16/19/98/1367161998.db2.gz	UFDNGKBZZBMIJP-NEWSRXKRSA-N	0	3	336.435	3.110	20	30		EGEDHN
CN(Cc1ccc(Cl)cc1)[C@H]1CCN(C(=O)C#CC(C)(C)C)C1	ZINC001190076231	1367167606	/nfs/dbraw/zinc/16/76/06/1367167606.db2.gz	MUIMNCQEBVQZSB-KRWDZBQOSA-N	0	3	332.875	3.422	20	30		EGEDHN
CN(CCc1c(F)cccc1F)[C@@H]1CCN(C(=O)C#CC(C)(C)C)C1	ZINC001190083748	1367169074	/nfs/dbraw/zinc/16/90/74/1367169074.db2.gz	FSAKBMQDWKONDU-OAHLLOKOSA-N	0	3	348.437	3.090	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2cscc2C)C1	ZINC001107850968	1367175139	/nfs/dbraw/zinc/17/51/39/1367175139.db2.gz	USOMBUQPQALPLU-YJBOKZPZSA-N	0	3	336.501	3.232	20	30		EGEDHN
CCCCCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc(OCC)no1)C2	ZINC001109529980	1367180192	/nfs/dbraw/zinc/18/01/92/1367180192.db2.gz	BGGJBTRORBRYJV-PMPSAXMXSA-N	0	3	349.475	3.379	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCOCCC(C)C	ZINC001109634203	1367253173	/nfs/dbraw/zinc/25/31/73/1367253173.db2.gz	GGAYIIZVVVNFDB-RDGPPVDQSA-N	0	3	336.520	3.373	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CC1CC(F)(F)C1	ZINC001109634220	1367253234	/nfs/dbraw/zinc/25/32/34/1367253234.db2.gz	HBOOQAVFRUYWIM-UKMLZYKCSA-N	0	3	326.431	3.356	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](N(C)CCOc2ccccc2C)C1	ZINC001190434809	1367263818	/nfs/dbraw/zinc/26/38/18/1367263818.db2.gz	BBYPLQGHWNFIPK-GOSISDBHSA-N	0	3	330.472	3.263	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)C(C)(C)C2CCC2)C1	ZINC001108101235	1367281968	/nfs/dbraw/zinc/28/19/68/1367281968.db2.gz	IWOMYMBVRWNTRM-OXJNMPFZSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCC[C@@H](C)N1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1snnc1C(C)C)C2	ZINC001109872657	1367372371	/nfs/dbraw/zinc/37/23/71/1367372371.db2.gz	YMUKJBBRMUXBBD-KBXIAJHMSA-N	0	3	348.516	3.351	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2csc(C)c2)C1	ZINC001108280706	1367378074	/nfs/dbraw/zinc/37/80/74/1367378074.db2.gz	XPXMIARJGVGPCO-KSSFIOAISA-N	0	3	336.501	3.232	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)[C@H]2CC[C@H](C)CC2)C1	ZINC001108353914	1367407037	/nfs/dbraw/zinc/40/70/37/1367407037.db2.gz	RWBNQJMLFMSIPL-SOAMZJECSA-N	0	3	336.520	3.375	20	30		EGEDHN
C#CCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3CC[C@H](C)F)CCCCC1	ZINC001110178069	1367548116	/nfs/dbraw/zinc/54/81/16/1367548116.db2.gz	RBSJZUXKZCVCBF-MHORFTMASA-N	0	3	334.479	3.430	20	30		EGEDHN
C=CCC[C@H](C)N1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cnc(CC)s1)C2	ZINC001110179982	1367548819	/nfs/dbraw/zinc/54/88/19/1367548819.db2.gz	MXHLZDDEFUGMQA-XGUBFFRZSA-N	0	3	333.501	3.395	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1cc(C)sc1C	ZINC001110183382	1367551996	/nfs/dbraw/zinc/55/19/96/1367551996.db2.gz	SUKHVCHMHPDWCS-SQNIBIBYSA-N	0	3	348.512	3.179	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3C[C@H]2CCCCO2)CCCC1	ZINC001110214524	1367568689	/nfs/dbraw/zinc/56/86/89/1367568689.db2.gz	LDFBDFNTVIVMAP-YRXWBPOGSA-N	0	3	346.515	3.414	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](N(C)CCOc2cccc(CC)c2)C1	ZINC001191726786	1367571956	/nfs/dbraw/zinc/57/19/56/1367571956.db2.gz	BVHFJRGAHVXGHC-SFHVURJKSA-N	0	3	344.499	3.373	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](N(C)CCc2csc(C)n2)C1	ZINC001191755335	1367578138	/nfs/dbraw/zinc/57/81/38/1367578138.db2.gz	WLSWJFVIMZJTNF-SFHVURJKSA-N	0	3	347.528	3.110	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](N(C)C[C@@H](OC)c2ccccc2)C1	ZINC001191859915	1367616766	/nfs/dbraw/zinc/61/67/66/1367616766.db2.gz	SVJUNGXXMLDFGR-VQTJNVASSA-N	0	3	342.483	3.100	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@H](N(C)Cc2cccc(COC)c2)C1	ZINC001191911805	1367635332	/nfs/dbraw/zinc/63/53/32/1367635332.db2.gz	JTOGZWOKBNXCOO-XLIONFOSSA-N	0	3	344.499	3.468	20	30		EGEDHN
CN(C)c1ccncc1NC(=O)c1ccc(C#N)cc1C(F)(F)F	ZINC001192077228	1367681805	/nfs/dbraw/zinc/68/18/05/1367681805.db2.gz	ILDMQAYHCFSFLK-UHFFFAOYSA-N	0	3	334.301	3.290	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H](N(C)CCOc2ccc(F)cc2)C1	ZINC001192163393	1367705750	/nfs/dbraw/zinc/70/57/50/1367705750.db2.gz	WKPRXVJLNKLSQW-PXNSSMCTSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](N(C)CCOCCC(C)C)C2)CC1	ZINC001192218323	1367720637	/nfs/dbraw/zinc/72/06/37/1367720637.db2.gz	NYXLYKRPOTUYGN-GOSISDBHSA-N	0	3	336.520	3.328	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccccc1C1CC1	ZINC001110538121	1367818139	/nfs/dbraw/zinc/81/81/39/1367818139.db2.gz	OIYBBKVYPOIMIK-NRSPTQNISA-N	0	3	336.479	3.445	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccc(COC)cc1	ZINC001110608472	1367870739	/nfs/dbraw/zinc/87/07/39/1367870739.db2.gz	PLVHPXFXDMXMEW-AQNXPRMDSA-N	0	3	342.483	3.411	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCN(C(=O)CCC(C)(C)C)C1	ZINC001192947096	1367909083	/nfs/dbraw/zinc/90/90/83/1367909083.db2.gz	HRJXIUUFGRBKGL-GOSISDBHSA-N	0	3	327.472	3.417	20	30		EGEDHN
CC[C@H](C)CCC(=O)N1CC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001193017700	1367923958	/nfs/dbraw/zinc/92/39/58/1367923958.db2.gz	PAEZRSXMISRKLJ-QFBILLFUSA-N	0	3	327.472	3.417	20	30		EGEDHN
CCC[C@@H](CC)C(=O)N1CC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001193122165	1367950046	/nfs/dbraw/zinc/95/00/46/1367950046.db2.gz	IGUJIIQVVOJZDB-RTBURBONSA-N	0	3	327.472	3.417	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@@H]2CCC(C)=C(C)C2)C1	ZINC001193201482	1367964417	/nfs/dbraw/zinc/96/44/17/1367964417.db2.gz	JVKHBOAKGIPOKM-GUDVDZBRSA-N	0	3	336.520	3.255	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)C[C@H]2CCCC(C)(C)C2)C1	ZINC001193461123	1368035286	/nfs/dbraw/zinc/03/52/86/1368035286.db2.gz	FIXGUQZIHYTGLL-QZTJIDSGSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)[C@@H](F)CCCCCC)C1	ZINC001193479402	1368042908	/nfs/dbraw/zinc/04/29/08/1368042908.db2.gz	VAGUDRBTLWBUIH-IRXDYDNUSA-N	0	3	328.472	3.030	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3CCCCCF)cc1	ZINC001110884198	1368057985	/nfs/dbraw/zinc/05/79/85/1368057985.db2.gz	VENNYVLEDHOGLF-QRVBRYPASA-N	0	3	328.431	3.143	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@@H](N(C)CCOCCCC)C2)CCCCC1	ZINC001194367405	1368245322	/nfs/dbraw/zinc/24/53/22/1368245322.db2.gz	HCKHLFXGOSFGLX-LJQANCHMSA-N	0	3	348.531	3.310	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCCc1cc(C)ccc1C)C2	ZINC001111439244	1368307309	/nfs/dbraw/zinc/30/73/09/1368307309.db2.gz	VRKZLJPRKWZNCL-NJYVYQBISA-N	0	3	338.495	3.371	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3CCCOCC)CCCC1	ZINC001111522322	1368324658	/nfs/dbraw/zinc/32/46/58/1368324658.db2.gz	ANDHZLIKSBOCBP-KURKYZTESA-N	0	3	334.504	3.271	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H](C)C(CC)CC)C[C@H](C)O2	ZINC001111545488	1368338384	/nfs/dbraw/zinc/33/83/84/1368338384.db2.gz	HTHXMSGGGJYOKX-DLBZAZTESA-N	0	3	336.520	3.327	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C(CCC)CCC)C[C@@H](C)O2	ZINC001111546944	1368339542	/nfs/dbraw/zinc/33/95/42/1368339542.db2.gz	FJISBTHLYLNDNR-QGZVFWFLSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)c2ccc(CCC)cc2)C1	ZINC001195677881	1368471027	/nfs/dbraw/zinc/47/10/27/1368471027.db2.gz	WIDJZTRIRFQIOX-WOJBJXKFSA-N	0	3	344.499	3.160	20	30		EGEDHN
CCc1ccccc1CN1CCCN(C(=O)C#CC(C)(C)C)CC1	ZINC001195785795	1368490538	/nfs/dbraw/zinc/49/05/38/1368490538.db2.gz	VTFXAVMSORHUKK-UHFFFAOYSA-N	0	3	326.484	3.333	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cc(C3CC3)nn2C)CC1	ZINC001196003449	1368533128	/nfs/dbraw/zinc/53/31/28/1368533128.db2.gz	JFHIAKHPUXHJMJ-UHFFFAOYSA-N	0	3	346.519	3.416	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2c(C)[nH]nc2Cl)CC1	ZINC001196093659	1368548075	/nfs/dbraw/zinc/54/80/75/1368548075.db2.gz	XMCGSIJMOXARAQ-UHFFFAOYSA-N	0	3	338.883	3.266	20	30		EGEDHN
C#CCN1C[C@@H]2CCC[C@]2(NC(=O)CCCc2cc(C)ccc2C)C1	ZINC001111997719	1368601226	/nfs/dbraw/zinc/60/12/26/1368601226.db2.gz	KCXYAVCSCPXRCW-UNMCSNQZSA-N	0	3	338.495	3.230	20	30		EGEDHN
C=C(C)CCN1C[C@@H](O)[C@H](NC(=O)[C@@H](CCC)CC2CCCC2)C1	ZINC001196616224	1368650050	/nfs/dbraw/zinc/65/00/50/1368650050.db2.gz	IGIQKDWGDGJIAT-IPMKNSEASA-N	0	3	336.520	3.111	20	30		EGEDHN
C=CCCN1CCCN(C(=O)[C@H](C)OCc2ccc(C)cc2)CC1	ZINC001196690163	1368663962	/nfs/dbraw/zinc/66/39/62/1368663962.db2.gz	PCKTWEUKJSLWAB-SFHVURJKSA-N	0	3	330.472	3.011	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)C2(C)CCCCCC2)C[C@H]1C(F)(F)F	ZINC001112116114	1368666837	/nfs/dbraw/zinc/66/68/37/1368666837.db2.gz	KVHAPFDZLWBJBB-HUUCEWRRSA-N	0	3	344.421	3.349	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)[C@@H](C)C(CC)CC)C[C@H]1C(F)(F)F	ZINC001112124650	1368670765	/nfs/dbraw/zinc/67/07/65/1368670765.db2.gz	QUROFURHEPAHFI-NWANDNLSSA-N	0	3	332.410	3.061	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)[C@@](C)(CC)CCC)C[C@H]1C(F)(F)F	ZINC001112184909	1368704935	/nfs/dbraw/zinc/70/49/35/1368704935.db2.gz	KJUHDWUKZBKIFW-FMKPAKJESA-N	0	3	332.410	3.205	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)[C@@H](CCC)CC(C)C)C[C@H]1C(F)(F)F	ZINC001112213868	1368722272	/nfs/dbraw/zinc/72/22/72/1368722272.db2.gz	FTRPHWKDCSXTAE-ARFHVFGLSA-N	0	3	346.437	3.451	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cc(C(F)F)n[nH]2)CC1	ZINC001197125541	1368749645	/nfs/dbraw/zinc/74/96/45/1368749645.db2.gz	CPPBMKNCDAFPIT-UHFFFAOYSA-N	0	3	340.418	3.242	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H]2CCC[C@]2(CNC/C(Cl)=C/Cl)C1	ZINC001112330506	1368769637	/nfs/dbraw/zinc/76/96/37/1368769637.db2.gz	OFAMCOSPPJLFFY-LBRHBIIVSA-N	0	3	343.298	3.327	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2cnc(C(C)C)nc2C)CC1	ZINC001197346349	1368792694	/nfs/dbraw/zinc/79/26/94/1368792694.db2.gz	OTVNPVMHUFQUOD-UHFFFAOYSA-N	0	3	330.476	3.023	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H]2CCC[C@]2(CNCc2cnc(C)o2)C1	ZINC001112375257	1368801474	/nfs/dbraw/zinc/80/14/74/1368801474.db2.gz	KQHZEWAIVCBDDO-JXFKEZNVSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2ncccc2C(F)(F)F)CC1	ZINC001197676421	1368871322	/nfs/dbraw/zinc/87/13/22/1368871322.db2.gz	HMIJNBCOGAYFBL-UHFFFAOYSA-N	0	3	341.377	3.215	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@@H](C)c2ccc(C)cc2)C1	ZINC001197858585	1368914869	/nfs/dbraw/zinc/91/48/69/1368914869.db2.gz	CEEAYESVZORSOB-DFQSSKMNSA-N	0	3	344.499	3.006	20	30		EGEDHN
CCCCCCCC[C@@H](C)C(=O)N1CCCN(C[C@H](C)O)CC1	ZINC001198197567	1368978429	/nfs/dbraw/zinc/97/84/29/1368978429.db2.gz	PZLPRRJYENZNDZ-MSOLQXFVSA-N	0	3	326.525	3.288	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](C2CCN(C(=O)COCC)CC2)CC1	ZINC001186577293	1387971877	/nfs/dbraw/zinc/97/18/77/1387971877.db2.gz	BNMYDKZFXACTAK-INIZCTEOSA-N	0	3	342.911	3.116	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N1CCCN(Cc2c(C)cc(C)cc2C)CC1	ZINC001198336533	1369011455	/nfs/dbraw/zinc/01/14/55/1369011455.db2.gz	DHSWUIJYZPDLGK-LJQANCHMSA-N	0	3	344.499	3.237	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2csc(CC(C)C)n2)CC1	ZINC001198364014	1369015513	/nfs/dbraw/zinc/01/55/13/1369015513.db2.gz	JZZHEMSEGNKSHB-UHFFFAOYSA-N	0	3	335.517	3.456	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)c1cccnc1)c1ccccc1OC	ZINC001198491003	1369044531	/nfs/dbraw/zinc/04/45/31/1369044531.db2.gz	FTXHSIMWHQEVPR-GOSISDBHSA-N	0	3	339.439	3.117	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)CCC(F)(F)F)c1ccccc1OC	ZINC001198637577	1369078950	/nfs/dbraw/zinc/07/89/50/1369078950.db2.gz	QIBKWDZJMFXCGY-AWEZNQCLSA-N	0	3	344.377	3.361	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@H](CC)SC)c1ccccc1OC	ZINC001198669003	1369087472	/nfs/dbraw/zinc/08/74/72/1369087472.db2.gz	WNWQIUCDJBVEKV-WBVHZDCISA-N	0	3	336.501	3.160	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)CO[C@@H](C)CC)c1ccccc1OC	ZINC001198668735	1369087547	/nfs/dbraw/zinc/08/75/47/1369087547.db2.gz	VBSYKKNGWOQJAB-FUHWJXTLSA-N	0	3	348.487	3.223	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H](NCC[C@@H](C)F)c1ccccc1OC	ZINC001198677916	1369088823	/nfs/dbraw/zinc/08/88/23/1369088823.db2.gz	VERHSZVPKMFHBA-SJLPKXTDSA-N	0	3	348.462	3.384	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@@H](NCCCOC)c1ccccc1OC	ZINC001198743339	1369103604	/nfs/dbraw/zinc/10/36/04/1369103604.db2.gz	XAHCLZWXOJMWJE-QGZVFWFLSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)c1cc(F)c[nH]1)c1ccccc1OC	ZINC001198796385	1369116738	/nfs/dbraw/zinc/11/67/38/1369116738.db2.gz	LIBONOWAHFQIJV-KRWDZBQOSA-N	0	3	345.418	3.189	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@@H](NCCCF)c1ccccc1OC	ZINC001198857540	1369131372	/nfs/dbraw/zinc/13/13/72/1369131372.db2.gz	QSWORGVVZKLVRE-NVXWUHKLSA-N	0	3	336.451	3.404	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@@H](NCCCF)c1ccccc1OC	ZINC001198885155	1369139161	/nfs/dbraw/zinc/13/91/61/1369139161.db2.gz	BLWFUQRLABHCDB-APWZRJJASA-N	0	3	336.451	3.404	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@H](C)C(C)(F)F)c1ccccc1OC	ZINC001198902198	1369143751	/nfs/dbraw/zinc/14/37/51/1369143751.db2.gz	HSASJVXEPHGCSV-ZFWWWQNUSA-N	0	3	340.414	3.310	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)C1(CF)CCC1)c1ccccc1OC	ZINC001198908711	1369145728	/nfs/dbraw/zinc/14/57/28/1369145728.db2.gz	MCPFVBGINOWVAD-INIZCTEOSA-N	0	3	334.435	3.158	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CCCCCC)C[C@H]2O)CCCCC1	ZINC001198949818	1369156101	/nfs/dbraw/zinc/15/61/01/1369156101.db2.gz	GBZOUWXHAYLNER-QZTJIDSGSA-N	0	3	336.520	3.255	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)COCCC=C)c1ccccc1OC	ZINC001199002011	1369170159	/nfs/dbraw/zinc/17/01/59/1369170159.db2.gz	NYTQXAOEPYYRML-GOSISDBHSA-N	0	3	346.471	3.001	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)[C@@H]2CCc3cc(F)ccc32)CC1	ZINC001113111389	1369209719	/nfs/dbraw/zinc/20/97/19/1369209719.db2.gz	VRKPIQAQJSIYGW-HNAYVOBHSA-N	0	3	330.447	3.354	20	30		EGEDHN
C#CCCCCC(=O)N1CCC(NCc2nc(C)c(C)s2)CC1	ZINC001200147685	1369320429	/nfs/dbraw/zinc/32/04/29/1369320429.db2.gz	DEEFRPOVSHZVSK-UHFFFAOYSA-N	0	3	333.501	3.034	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)Cc2c[nH]c3ccc(F)cc23)CC1	ZINC001113380116	1369380022	/nfs/dbraw/zinc/38/00/22/1369380022.db2.gz	ATECWUOTYSZREM-OAHLLOKOSA-N	0	3	343.446	3.348	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCCO[C@@H](CNCc2ccsc2)C1	ZINC001200604984	1369399024	/nfs/dbraw/zinc/39/90/24/1369399024.db2.gz	BEWBVBHXZZELGI-INIZCTEOSA-N	0	3	336.501	3.058	20	30		EGEDHN
C#CCCCCCC(=O)N1CCCO[C@@H](CNCc2ccsc2)C1	ZINC001201162905	1369487708	/nfs/dbraw/zinc/48/77/08/1369487708.db2.gz	RIFUZXIVPVDHDS-SFHVURJKSA-N	0	3	348.512	3.039	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)C[C@H]2CCC3(CCC3)CO2)CC1	ZINC001113569701	1369497193	/nfs/dbraw/zinc/49/71/93/1369497193.db2.gz	SOWRFKGSMCPQLZ-ZWKOTPCHSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)CCc2ccccc2OC)CC1	ZINC001113611186	1369520317	/nfs/dbraw/zinc/52/03/17/1369520317.db2.gz	AEZQEEHTIDUYMK-QGZVFWFLSA-N	0	3	330.472	3.127	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)Cc2ccc(OCC=C)cc2)CC1	ZINC001113695229	1369570018	/nfs/dbraw/zinc/57/00/18/1369570018.db2.gz	UGGAYCLQXZKAPJ-SFHVURJKSA-N	0	3	342.483	3.293	20	30		EGEDHN
CC#CCNC[C@H]1CN(C(=O)[C@@](C)(CC)CCCCC)CCCO1	ZINC001202174123	1369707197	/nfs/dbraw/zinc/70/71/97/1369707197.db2.gz	QNIBWBFYDDWFHD-ICSRJNTNSA-N	0	3	336.520	3.213	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC(NCc3cc(C4CC4)no3)CC2)CC1	ZINC001202364961	1369750827	/nfs/dbraw/zinc/75/08/27/1369750827.db2.gz	BMCSKEKSRSMASX-UHFFFAOYSA-N	0	3	343.471	3.379	20	30		EGEDHN
CC(C)=CC(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C12CCC2	ZINC001202384017	1369756609	/nfs/dbraw/zinc/75/66/09/1369756609.db2.gz	PPQOTWNNVTZZFV-ROUUACIJSA-N	0	3	341.430	3.181	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)CC(C)(C)C)C12CCC2	ZINC001202503622	1369793096	/nfs/dbraw/zinc/79/30/96/1369793096.db2.gz	YTMZVNAQYMGNEU-STQMWFEESA-N	0	3	343.309	3.348	20	30		EGEDHN
CC/C=C(/C)C(=O)N[C@@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202582109	1369812800	/nfs/dbraw/zinc/81/28/00/1369812800.db2.gz	LMOFMMNCTCAJSM-IDFFNOJMSA-N	0	3	336.479	3.411	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@@H](NC(=O)CCC2CC2)C12CCC2	ZINC001202655011	1369839079	/nfs/dbraw/zinc/83/90/79/1369839079.db2.gz	NOSCTUAZWXMTAC-ZIAGYGMSSA-N	0	3	341.293	3.102	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1C[C@@H](NCc2c(C)noc2C)C12CCC2	ZINC001202978793	1369944383	/nfs/dbraw/zinc/94/43/83/1369944383.db2.gz	IYMGODPOFKBNAJ-IAGOWNOFSA-N	0	3	331.460	3.165	20	30		EGEDHN
CC[C@@H](C)CCC(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001203037265	1369962913	/nfs/dbraw/zinc/96/29/13/1369962913.db2.gz	KOJSRCDMWJHCTA-MRXNPFEDSA-N	0	3	327.472	3.465	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1C[C@@H](NCc2cnoc2C)C12CCC2	ZINC001203259545	1370045969	/nfs/dbraw/zinc/04/59/69/1370045969.db2.gz	XJCOWOUQEFEYGY-HZPDHXFCSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1[C@H]2CN(CCOc3ccccc3C)C[C@H]21	ZINC001114724235	1370047193	/nfs/dbraw/zinc/04/71/93/1370047193.db2.gz	JKMQPDLQXHPEJA-XSYGEPLQSA-N	0	3	342.483	3.023	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1[C@H]2CN(CCOc3ccc(C)cc3)C[C@H]21	ZINC001114724968	1370047390	/nfs/dbraw/zinc/04/73/90/1370047390.db2.gz	WKJAIUZACGRTQC-IJXRJRJASA-N	0	3	342.483	3.023	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1C[C@@H](NCc2oc(CC)nc2C)C12CCC2	ZINC001203338622	1370089255	/nfs/dbraw/zinc/08/92/55/1370089255.db2.gz	CKXXZPJFTZEYLF-IAGOWNOFSA-N	0	3	345.487	3.419	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2C[C@H](NCc3conc3C)C23CCC3)CCC1	ZINC001203366944	1370100734	/nfs/dbraw/zinc/10/07/34/1370100734.db2.gz	PYYRHAYCYZFPNT-DLBZAZTESA-N	0	3	343.471	3.246	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H](NCc3cnc(C)o3)C23CCC3)CCC1	ZINC001203368116	1370101726	/nfs/dbraw/zinc/10/17/26/1370101726.db2.gz	YQKQLQWAPXURTH-IRXDYDNUSA-N	0	3	343.471	3.246	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CCN(Cc3ccccc3OC)C2)C1	ZINC001203425597	1370119969	/nfs/dbraw/zinc/11/99/69/1370119969.db2.gz	NTPOFTOOOBOJBN-FQEVSTJZSA-N	0	3	344.455	3.306	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1[C@H]2CN(CCc3ccccc3F)C[C@H]21	ZINC001114894956	1370134781	/nfs/dbraw/zinc/13/47/81/1370134781.db2.gz	OPVMAPCLYHMWSY-VQFNDLOPSA-N	0	3	330.447	3.017	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)CCCn2cccc2)C12CCC2	ZINC001203770214	1370258188	/nfs/dbraw/zinc/25/81/88/1370258188.db2.gz	FGBJBOSOABMRRT-JKSUJKDBSA-N	0	3	335.879	3.038	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@]3(C[C@H](OCC4CC4)CO3)C2)cc1	ZINC001203902946	1370307731	/nfs/dbraw/zinc/30/77/31/1370307731.db2.gz	ORQLZHLEBDOLEN-VQTJNVASSA-N	0	3	326.440	3.108	20	30		EGEDHN
CCCCCCCCC(=O)N[C@@H]1[C@H]2CN(CCOCC3CC3)C[C@H]21	ZINC001115166059	1370324030	/nfs/dbraw/zinc/32/40/30/1370324030.db2.gz	UDCAOQFQGAMGEL-RUYXUALKSA-N	0	3	336.520	3.210	20	30		EGEDHN
C=CCOC(=O)N1CCCC2(CCN(Cc3ccccn3)CC2)C1	ZINC001204056291	1370362532	/nfs/dbraw/zinc/36/25/32/1370362532.db2.gz	ZIIQFZRSMRFFAY-UHFFFAOYSA-N	0	3	329.444	3.082	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)COC2CCCC2)CCCCC1	ZINC001115422908	1370445771	/nfs/dbraw/zinc/44/57/71/1370445771.db2.gz	UEFPKIFAKOCONM-UHFFFAOYSA-N	0	3	328.884	3.107	20	30		EGEDHN
CC(=O)n1cc(CN2CCC3SC(=O)C=C3C2)c2ccccc21	ZINC001204409935	1370469292	/nfs/dbraw/zinc/46/92/92/1370469292.db2.gz	XGMZGFPQHUARDO-KRWDZBQOSA-N	0	3	326.421	3.076	20	30		EGEDHN
C#CCCCCC(=O)NCC1(NCc2oc(C)nc2C)CCCCC1	ZINC001115490784	1370494373	/nfs/dbraw/zinc/49/43/73/1370494373.db2.gz	RCICGLJGJGMUTE-UHFFFAOYSA-N	0	3	345.487	3.394	20	30		EGEDHN
CCCCC(=O)N1CCC(CNCc2cc(F)ccc2C#N)CC1	ZINC001204516426	1370500239	/nfs/dbraw/zinc/50/02/39/1370500239.db2.gz	AKZZKRJKOFDITG-UHFFFAOYSA-N	0	3	331.435	3.216	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@H]1CCN(Cc1ccc(F)c(OC)c1)C2	ZINC001204558328	1370514855	/nfs/dbraw/zinc/51/48/55/1370514855.db2.gz	XMMPDTKLPICQIZ-VQTJNVASSA-N	0	3	349.446	3.408	20	30		EGEDHN
CN1CCN(Cc2cccc(Nc3cc(F)c(F)c(C#N)c3)c2)CC1	ZINC001204575053	1370520708	/nfs/dbraw/zinc/52/07/08/1370520708.db2.gz	VHXGEYRKONDBIF-UHFFFAOYSA-N	0	3	342.393	3.327	20	30		EGEDHN
Cc1nsc(C)c1CNC1(CNC(=O)C#CC(C)C)CCCCC1	ZINC001115522354	1370521474	/nfs/dbraw/zinc/52/14/74/1370521474.db2.gz	NMTJPAOHQKPUFB-UHFFFAOYSA-N	0	3	347.528	3.328	20	30		EGEDHN
CN1CCN(Cc2cccc(Nc3c(C#N)ccc(F)c3F)c2)CC1	ZINC001204578255	1370522434	/nfs/dbraw/zinc/52/24/34/1370522434.db2.gz	BHVLKJIZQHTAHR-UHFFFAOYSA-N	0	3	342.393	3.327	20	30		EGEDHN
CC(C)(C)/C=C/C(=O)N1CCC(CNCc2ccccc2C#N)CC1	ZINC001204818640	1370582586	/nfs/dbraw/zinc/58/25/86/1370582586.db2.gz	KLWYNEXFWKIRBA-DHZHZOJOSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=CCOCCCC(=O)N1CCC(CNC/C(Cl)=C\Cl)CC1	ZINC001204908569	1370603104	/nfs/dbraw/zinc/60/31/04/1370603104.db2.gz	UUBIHYXTOHPYHZ-RVDMUPIBSA-N	0	3	349.302	3.116	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccc(COC)o2)CCCCC1	ZINC001115621745	1370617349	/nfs/dbraw/zinc/61/73/49/1370617349.db2.gz	YZYDKPXSMFQSJJ-UHFFFAOYSA-N	0	3	340.851	3.201	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)[C@H](F)CC)CCCCC1	ZINC001115669468	1370650389	/nfs/dbraw/zinc/65/03/89/1370650389.db2.gz	VUUKAHQWLSEYQU-GFCCVEGCSA-N	0	3	335.261	3.052	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H]2CCc3cccnc32)CCCCC1	ZINC001115696319	1370677469	/nfs/dbraw/zinc/67/74/69/1370677469.db2.gz	QCEQOSGCIYEBHW-INIZCTEOSA-N	0	3	347.890	3.273	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC[C@@H](c2ccc(F)cc2)[C@H](NC/C=C\Cl)C1	ZINC001205262962	1370699466	/nfs/dbraw/zinc/69/94/66/1370699466.db2.gz	HJFJNXSUGWDCEQ-YMUKGANLSA-N	0	3	349.837	3.012	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@@H](C)C2CC2)CC[C@H]1c1ccc(F)cc1	ZINC001205269725	1370701324	/nfs/dbraw/zinc/70/13/24/1370701324.db2.gz	BLDBCACVICNMRW-RYGJVYDSSA-N	0	3	342.458	3.169	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2conc2C2CC2)CCCCC1	ZINC001115725502	1370706534	/nfs/dbraw/zinc/70/65/34/1370706534.db2.gz	ZFKNUFDJCWNWOK-UHFFFAOYSA-N	0	3	337.851	3.327	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C2(C)CCCC2)C[C@H]1c1cccc(F)c1	ZINC001205422958	1370750425	/nfs/dbraw/zinc/75/04/25/1370750425.db2.gz	ZUXOZDJRWOTGSO-RBUKOAKNSA-N	0	3	342.458	3.313	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@@]2(C)C=CCC2)C[C@H]1c1cccc(F)c1	ZINC001205427319	1370751819	/nfs/dbraw/zinc/75/18/19/1370751819.db2.gz	XDEBWJMBUONEPS-ZVDOUQERSA-N	0	3	340.442	3.089	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@@H]1OCC(=O)c1ccc(C#N)cc1	ZINC001206505681	1371076414	/nfs/dbraw/zinc/07/64/14/1371076414.db2.gz	QOEMKJCJJMXGOU-KKSFZXQISA-N	0	3	334.419	3.278	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CN(CCOc2cccc(C)c2)C[C@H]1C	ZINC001206887122	1371207898	/nfs/dbraw/zinc/20/78/98/1371207898.db2.gz	XICIIVICAXQYLX-UYAOXDASSA-N	0	3	342.483	3.004	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CN(Cc2cc(C)sc2C)C[C@H]1C	ZINC001206886898	1371207947	/nfs/dbraw/zinc/20/79/47/1371207947.db2.gz	MFIPOOMUFQVCPU-RDTXWAMCSA-N	0	3	332.513	3.495	20	30		EGEDHN
CCCCCCCN1C[C@@H](C)[C@H](NC(=O)c2cc(OC)ns2)C1	ZINC001206987583	1371260065	/nfs/dbraw/zinc/26/00/65/1371260065.db2.gz	HFQFPENOLJKHJN-ZIAGYGMSSA-N	0	3	339.505	3.172	20	30		EGEDHN
O=C(CC1CC1)N1CCC[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001207041948	1371275237	/nfs/dbraw/zinc/27/52/37/1371275237.db2.gz	QLDSQLWLLCQJGZ-KRWDZBQOSA-N	0	3	330.859	3.072	20	30		EGEDHN
O=C(c1ccco1)N1CCC[C@@H](NCC#Cc2ccccc2Cl)C1	ZINC001207082210	1371288806	/nfs/dbraw/zinc/28/88/06/1371288806.db2.gz	PQLWICWAOFHNFE-MRXNPFEDSA-N	0	3	342.826	3.179	20	30		EGEDHN
O=C(c1ccccc1)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207092414	1371292192	/nfs/dbraw/zinc/29/21/92/1371292192.db2.gz	ZCEGLAWIQSHHPL-FQEVSTJZSA-N	0	3	336.410	3.072	20	30		EGEDHN
CC(C)(C)c1ccc(NC(=O)C2CC3(C2)CNC[C@@H]3C#N)cc1F	ZINC001119376881	1371324771	/nfs/dbraw/zinc/32/47/71/1371324771.db2.gz	FHQFFCPZHSKEOO-MLZJXEJWSA-N	0	3	329.419	3.201	20	30		EGEDHN
CS(=O)(=O)C[C@H](NCCCCC1(C#N)CCC1)c1ccccc1	ZINC001119695257	1371388627	/nfs/dbraw/zinc/38/86/27/1371388627.db2.gz	GUFWXMBXXZKDPH-KRWDZBQOSA-N	0	3	334.485	3.226	20	30		EGEDHN
CC/C=C(\C)C(=O)N1CCC[C@H](NCc2cc(C#N)ccc2OC)C1	ZINC001207566598	1371437318	/nfs/dbraw/zinc/43/73/18/1371437318.db2.gz	ROKCHTWYBTVVDB-WCLIJEPQSA-N	0	3	341.455	3.004	20	30		EGEDHN
CC(C)(C)/C=C\C(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207710833	1371481464	/nfs/dbraw/zinc/48/14/64/1371481464.db2.gz	SHEMPHAOVJMBEJ-SYGIOELKSA-N	0	3	342.458	3.360	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H](NCC#Cc2ccccc2Cl)C1)C1CC1	ZINC001207743778	1371491631	/nfs/dbraw/zinc/49/16/31/1371491631.db2.gz	FUKWYUHXGKJSFI-MAUKXSAKSA-N	0	3	344.886	3.318	20	30		EGEDHN
CC1(C)C(C(=O)N2CCC[C@@H](NCC#Cc3ccccc3)C2)C1(C)C	ZINC001207749416	1371493532	/nfs/dbraw/zinc/49/35/32/1371493532.db2.gz	DSJNAVKZLGMAIN-GOSISDBHSA-N	0	3	338.495	3.301	20	30		EGEDHN
CC1(CN2CCC(C#N)(c3ccc(Br)cc3)CC2)COC1	ZINC001207797414	1371507092	/nfs/dbraw/zinc/50/70/92/1371507092.db2.gz	WJFSAQSNYOIYNU-UHFFFAOYSA-N	0	3	349.272	3.343	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)CCCOCC)C1	ZINC001120329690	1371537091	/nfs/dbraw/zinc/53/70/91/1371537091.db2.gz	UKLNVCZOQMKIMM-IAGOWNOFSA-N	0	3	342.911	3.259	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H]([C@H]2CCCN2Cc2ccc(F)cn2)C1	ZINC001120348039	1371542428	/nfs/dbraw/zinc/54/24/28/1371542428.db2.gz	ONYFATJVURWVPE-QFBILLFUSA-N	0	3	345.462	3.390	20	30		EGEDHN
C=C(C)[C@@H]1CC=C(CN2CC[C@@H](Oc3ncc(OC)cn3)C2)CC1	ZINC001208179172	1371622693	/nfs/dbraw/zinc/62/26/93/1371622693.db2.gz	PUUFQYLBYDRTCC-IAGOWNOFSA-N	0	3	329.444	3.241	20	30		EGEDHN
C=C(Br)CNC1CC2(C1)CC(NC(=O)CCCCC)C2	ZINC001120636666	1371671791	/nfs/dbraw/zinc/67/17/91/1371671791.db2.gz	ZOSHHRPJNRPGJI-UHFFFAOYSA-N	0	3	343.309	3.492	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H]2CN(Cc3ccc(C(F)F)cc3)C[C@H]21	ZINC001187736228	1388152901	/nfs/dbraw/zinc/15/29/01/1388152901.db2.gz	AHFXSBLVLVCMML-ZWKOTPCHSA-N	0	3	346.421	3.460	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CN(CCOCc2ccccc2)C[C@H]1C	ZINC001208298075	1371705496	/nfs/dbraw/zinc/70/54/96/1371705496.db2.gz	CVHFMIKKDXUHIV-IEBWSBKVSA-N	0	3	344.499	3.242	20	30		EGEDHN
C#CCC1(C(=O)N2CCC[C@@H](NCC=C(Cl)Cl)C2)CCC1	ZINC001208318774	1371715776	/nfs/dbraw/zinc/71/57/76/1371715776.db2.gz	HVGRVKJDSKTLTP-CYBMUJFWSA-N	0	3	329.271	3.080	20	30		EGEDHN
C/C(=C/C(=O)NC1CC2(CC(NCc3ccccc3C#N)C2)C1)C1CC1	ZINC001120725034	1371729140	/nfs/dbraw/zinc/72/91/40/1371729140.db2.gz	MUJXJCLWLUKKGM-NVNXTCNLSA-N	0	3	349.478	3.432	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N1CCC[C@@H](NCc2ccccc2F)C1	ZINC001208797823	1371899504	/nfs/dbraw/zinc/89/95/04/1371899504.db2.gz	VGECMELFQUFLEC-XLIONFOSSA-N	0	3	348.462	3.135	20	30		EGEDHN
COc1ccccc1N1CCN(CCCc2ccc(C#N)cc2)CC1	ZINC001208860309	1371922218	/nfs/dbraw/zinc/92/22/18/1371922218.db2.gz	KFVWPYUZQPPBNU-UHFFFAOYSA-N	0	3	335.451	3.322	20	30		EGEDHN
CC1(C)CCC[C@H]1C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001209061854	1371987735	/nfs/dbraw/zinc/98/77/35/1371987735.db2.gz	USXZIFFNGSGNQE-PMACEKPBSA-N	0	3	338.495	3.445	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@H](NCc2c(C)nsc2C)C1	ZINC001209146964	1372015209	/nfs/dbraw/zinc/01/52/09/1372015209.db2.gz	SKPMDXWZUWINBM-INIZCTEOSA-N	0	3	333.501	3.034	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NC1CC2(CC(NCc3nccs3)C2)C1	ZINC001121611488	1372023883	/nfs/dbraw/zinc/02/38/83/1372023883.db2.gz	RQHBHJDGNZNWRV-KHYYSDFOSA-N	0	3	333.501	3.118	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001209182520	1372027606	/nfs/dbraw/zinc/02/76/06/1372027606.db2.gz	FCIPLDMJANXAHC-FXAWDEMLSA-N	0	3	342.458	3.360	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC[C@H](NCc2ccc(Cl)nc2)C1	ZINC001209184200	1372029903	/nfs/dbraw/zinc/02/99/03/1372029903.db2.gz	RRPXNRMSQZSQMT-HOCLYGCPSA-N	0	3	335.879	3.418	20	30		EGEDHN
C=CCCC1(C(=O)NC2CC3(CC(NCc4conc4C)C3)C2)CC1	ZINC001121709758	1372054515	/nfs/dbraw/zinc/05/45/15/1372054515.db2.gz	ZKAVBNUHWIKAAU-UHFFFAOYSA-N	0	3	343.471	3.246	20	30		EGEDHN
C[C@@H](c1ccccc1)N(CCN1CCOCC1)Cc1cccc(C#N)c1	ZINC001209293110	1372060146	/nfs/dbraw/zinc/06/01/46/1372060146.db2.gz	DRKUSICJSNVASC-IBGZPJMESA-N	0	3	349.478	3.454	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001209335181	1372071543	/nfs/dbraw/zinc/07/15/43/1372071543.db2.gz	IOLUUPPULIDUAZ-IBGZPJMESA-N	0	3	328.431	3.114	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC1CC2(CC(NCc3cnc(C)o3)C2)C1	ZINC001121842211	1372099050	/nfs/dbraw/zinc/09/90/50/1372099050.db2.gz	ZIVRHIZDHMCAPC-UHFFFAOYSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=CCCCCCN1CC[C@H]2[C@H](C1)OCCN2C(=O)OC(C)(C)C	ZINC001209423375	1372103185	/nfs/dbraw/zinc/10/31/85/1372103185.db2.gz	NESZQFFSWLTNME-IRXDYDNUSA-N	0	3	338.492	3.443	20	30		EGEDHN
C=CCCCCCN1CCN(Cc2ccc(C(=O)OC)cc2)CC1	ZINC001209426950	1372103720	/nfs/dbraw/zinc/10/37/20/1372103720.db2.gz	CFZUEXZFTFPUHS-UHFFFAOYSA-N	0	3	330.472	3.337	20	30		EGEDHN
C=CCCCCCCN1CC2(C1)CCN(C(=O)c1cccnc1)C2	ZINC001209437737	1372106145	/nfs/dbraw/zinc/10/61/45/1372106145.db2.gz	SGEWOUKYNZSHIU-UHFFFAOYSA-N	0	3	327.472	3.366	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)NCc1ccnc(Oc2ccc(F)cc2)c1	ZINC001121915198	1372121872	/nfs/dbraw/zinc/12/18/72/1372121872.db2.gz	BPGRCWAXKZUYBG-QGZVFWFLSA-N	0	3	343.402	3.313	20	30		EGEDHN
CCCC1(C(=O)N2CCC[C@H](NCc3ccc(F)c(C#N)c3)C2)CC1	ZINC001209535567	1372130342	/nfs/dbraw/zinc/13/03/42/1372130342.db2.gz	JGZAXFZFUQCNGC-KRWDZBQOSA-N	0	3	343.446	3.358	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@@H](NCC#Cc2ccccc2Cl)C1	ZINC001209707967	1372175470	/nfs/dbraw/zinc/17/54/70/1372175470.db2.gz	KZBOTTFMUFDZFA-KBAYOESNSA-N	0	3	344.886	3.318	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)CC[C@@H]1CC[C@H](C)O1)C2	ZINC001122219481	1372204526	/nfs/dbraw/zinc/20/45/26/1372204526.db2.gz	GVEJCCQLXSZMFJ-XZZVAGQJSA-N	0	3	340.895	3.104	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@H](NCc2ccnc(Cl)c2)C1	ZINC001209866315	1372217469	/nfs/dbraw/zinc/21/74/69/1372217469.db2.gz	RIBPIQJZQBVXHE-HNNXBMFYSA-N	0	3	335.879	3.418	20	30		EGEDHN
C=C(C)Cn1c([C@@H](C)CCC#N)nnc1N1CCN([C@@H](C)CC)CC1	ZINC001122530220	1372267767	/nfs/dbraw/zinc/26/77/67/1372267767.db2.gz	CNAXBJCLMAZFKB-IRXDYDNUSA-N	0	3	344.507	3.182	20	30		EGEDHN
N#Cc1cc(C(=O)OCC2CCN(Cc3ccco3)CC2)cs1	ZINC001122648705	1372291010	/nfs/dbraw/zinc/29/10/10/1372291010.db2.gz	BDKBHAHVRKSDLN-UHFFFAOYSA-N	0	3	330.409	3.282	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCN(C(=O)[C@H](c2ccccc2)N(C)CC)C1	ZINC001210633571	1372396484	/nfs/dbraw/zinc/39/64/84/1372396484.db2.gz	FWRJIOWTQMPIIH-MSOLQXFVSA-N	0	3	349.906	3.013	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)N2CCC[C@H](NCC#Cc3ccccc3)C2)CC1	ZINC001210757046	1372420774	/nfs/dbraw/zinc/42/07/74/1372420774.db2.gz	NOISJGSXUIZBMB-JBACZVJFSA-N	0	3	338.495	3.445	20	30		EGEDHN
C[C@@H](CC(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1)C1CC1	ZINC001211276318	1372519352	/nfs/dbraw/zinc/51/93/52/1372519352.db2.gz	FKCZMPGJIUFPFM-OXJNMPFZSA-N	0	3	342.458	3.194	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)CCc2cccc(OCC)c2)C1	ZINC001211401245	1372551704	/nfs/dbraw/zinc/55/17/04/1372551704.db2.gz	NYSHOKLTHNLLOA-VQIMIIECSA-N	0	3	330.472	3.031	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)CC2CCC(C)(C)CC2)C1	ZINC001211497634	1372569217	/nfs/dbraw/zinc/56/92/17/1372569217.db2.gz	LSVVEKXQSBZCHY-SJLPKXTDSA-N	0	3	336.520	3.232	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@H](C)CCCC)C[C@H]1c1ccccc1	ZINC001211590189	1372586894	/nfs/dbraw/zinc/58/68/94/1372586894.db2.gz	CZTCPXYLWGBMDX-YZGWKJHDSA-N	0	3	326.484	3.420	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@@H]2CCC(C)(C)C2)C[C@H]1c1ccccc1	ZINC001211671101	1372600557	/nfs/dbraw/zinc/60/05/57/1372600557.db2.gz	YGSGCBBDZKHBDQ-HSALFYBXSA-N	0	3	338.495	3.420	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C[C@H](CC)C(C)C)C[C@H]1c1ccccc1	ZINC001211711465	1372606658	/nfs/dbraw/zinc/60/66/58/1372606658.db2.gz	HPXMTVIIRDZLRX-YSIASYRMSA-N	0	3	326.484	3.276	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C2CCC=CCC2)C[C@H]1c1ccccc1	ZINC001211724035	1372608135	/nfs/dbraw/zinc/60/81/35/1372608135.db2.gz	ILVXAVFBUJHLAS-LEWJYISDSA-N	0	3	336.479	3.340	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CN([C@H]2CCc3ccccc32)C[C@H]1OC	ZINC001212338445	1372690239	/nfs/dbraw/zinc/69/02/39/1372690239.db2.gz	KYUOPFDRMNHWBT-CEXWTWQISA-N	0	3	342.483	3.092	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@@H]2C[C@H]2C(C)(C)C)[C@H](OC)C1	ZINC001213156031	1372849940	/nfs/dbraw/zinc/84/99/40/1372849940.db2.gz	GAWNVUICICLMKX-BRSBDYLESA-N	0	3	336.520	3.230	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN([C@H](C)c2cc(C)ccc2C)C[C@H]1OC	ZINC001213273354	1372872354	/nfs/dbraw/zinc/87/23/54/1372872354.db2.gz	LOTWNIISOGUTJG-BHIYHBOVSA-N	0	3	344.499	3.392	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN(CC/C=C\c2ccccc2)C[C@H]1OC	ZINC001213356880	1372890459	/nfs/dbraw/zinc/89/04/59/1372890459.db2.gz	CUNYAMDPAAIPBI-JORPEJITSA-N	0	3	342.483	3.262	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN(CCCc2ccccc2C)C[C@H]1OC	ZINC001213357409	1372891705	/nfs/dbraw/zinc/89/17/05/1372891705.db2.gz	UTINYROJCBGIHG-WOJBJXKFSA-N	0	3	344.499	3.099	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)C2(CC(C)C)CCCC2)[C@H](OC)C1	ZINC001213588458	1372930296	/nfs/dbraw/zinc/93/02/96/1372930296.db2.gz	IJIRMRSSULWPNV-QZTJIDSGSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)C(CC(C)C)CC(C)C)[C@H](OC)C1	ZINC001213944203	1372984373	/nfs/dbraw/zinc/98/43/73/1372984373.db2.gz	SOPOUDDNMNYQFC-RTBURBONSA-N	0	3	338.536	3.476	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CCCCCF)C[C@H]2OC)CCCC1	ZINC001214004357	1372993220	/nfs/dbraw/zinc/99/32/20/1372993220.db2.gz	WBWMKTZZYAPOSQ-IAGOWNOFSA-N	0	3	340.483	3.078	20	30		EGEDHN
CC(C)C#CC(=O)NCCN[C@@H]1CCc2c1cc(Cl)cc2Cl	ZINC001126810776	1373031616	/nfs/dbraw/zinc/03/16/16/1373031616.db2.gz	KPHYWTYQYIZHHJ-MRXNPFEDSA-N	0	3	339.266	3.346	20	30		EGEDHN
C[C@@H](C(=O)N1C[C@@H](C)[C@H](NCC#Cc2cccc(Cl)c2)C1)C1CC1	ZINC001214400714	1373055537	/nfs/dbraw/zinc/05/55/37/1373055537.db2.gz	KFNHUFSAUVWDGJ-SPYBWZPUSA-N	0	3	344.886	3.174	20	30		EGEDHN
CC[C@@H](C)CC(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001214516736	1373072698	/nfs/dbraw/zinc/07/26/98/1373072698.db2.gz	YTYBLQJDBUFLAB-GPMSIDNRSA-N	0	3	330.447	3.050	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](C)[C@H](NCc2ccc(C)cc2Cl)C1	ZINC001214524607	1373073498	/nfs/dbraw/zinc/07/34/98/1373073498.db2.gz	ICLAQIUMAKZONI-CRAIPNDOSA-N	0	3	332.875	3.388	20	30		EGEDHN
CCCC[C@@H](C)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001214550896	1373079219	/nfs/dbraw/zinc/07/92/19/1373079219.db2.gz	VTFKZJARMMRMSL-MBOZVWFJSA-N	0	3	344.474	3.440	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H](C)[C@H](NCc2cnc(C)s2)C1	ZINC001214703682	1373105279	/nfs/dbraw/zinc/10/52/79/1373105279.db2.gz	VFGZNPJDEKSEEO-CXAGYDPISA-N	0	3	333.501	3.156	20	30		EGEDHN
COc1ccc(Nc2ccc(N3CCN(C)CC3)cc2C)cc1C#N	ZINC001215001013	1373153947	/nfs/dbraw/zinc/15/39/47/1373153947.db2.gz	KTEJRLXMDQBUOL-UHFFFAOYSA-N	0	3	336.439	3.371	20	30		EGEDHN
C[C@@H](C#N)c1cccc(-c2nc(-c3ccc4c(n3)CCNC4)no2)c1	ZINC001215353296	1373201658	/nfs/dbraw/zinc/20/16/58/1373201658.db2.gz	MWLCIIOYLNRKSG-LBPRGKRZSA-N	0	3	331.379	3.071	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](C)[C@H](NCC=C(Cl)Cl)C2)CCC1	ZINC001215480297	1373207764	/nfs/dbraw/zinc/20/77/64/1373207764.db2.gz	PGKBUXWZXHKNGM-CHWSQXEVSA-N	0	3	331.287	3.488	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NCCN[C@H]1CCc2c1cc(F)cc2F	ZINC001128190308	1373231882	/nfs/dbraw/zinc/23/18/82/1373231882.db2.gz	PBSDRLGFEOUAFX-HNNXBMFYSA-N	0	3	342.817	3.437	20	30		EGEDHN
CC(C)C[C@@H](C)C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001216099631	1373263247	/nfs/dbraw/zinc/26/32/47/1373263247.db2.gz	WCWQETCFCNJFLT-CKEIUWERSA-N	0	3	333.501	3.238	20	30		EGEDHN
CCC[C@@H](CC)C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001216105035	1373263861	/nfs/dbraw/zinc/26/38/61/1373263861.db2.gz	SWSOWTHBMOOEFE-CKEIUWERSA-N	0	3	333.501	3.383	20	30		EGEDHN
C[C@@H](C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2)C1)C1CCCC1	ZINC001216319607	1373299690	/nfs/dbraw/zinc/29/96/90/1373299690.db2.gz	DEFYDPKIAZOCGN-DBXWQHBBSA-N	0	3	338.495	3.301	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCc2ccccc2)C[C@H]1NCC#Cc1ccccc1	ZINC001216530744	1373314783	/nfs/dbraw/zinc/31/47/83/1373314783.db2.gz	JQCIUOSKQJDVTH-DENIHFKCSA-N	0	3	346.474	3.107	20	30		EGEDHN
Cc1ccccc1CC(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2)C1	ZINC001216721140	1373336452	/nfs/dbraw/zinc/33/64/52/1373336452.db2.gz	HVOZPDSNBKPGAE-DENIHFKCSA-N	0	3	346.474	3.026	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)C[C@@H](C)CC(C)(C)C)C1	ZINC001130426946	1373533835	/nfs/dbraw/zinc/53/38/35/1373533835.db2.gz	KLUSSJNZQADTEN-HZPDHXFCSA-N	0	3	346.519	3.464	20	30		EGEDHN
COc1ccc(/C=C\C(=O)c2ccccc2O[C@H]2CNC[C@@H]2F)cc1	ZINC001218016167	1373538227	/nfs/dbraw/zinc/53/82/27/1373538227.db2.gz	BKZLICAJXIYIST-IZWSSQNWSA-N	0	3	341.382	3.280	20	30		EGEDHN
N#Cc1ccc(-c2ccc(Cl)cc2)nc1O[C@@H]1CCNC[C@H]1F	ZINC001218066556	1373551717	/nfs/dbraw/zinc/55/17/17/1373551717.db2.gz	MAURDZDLOPVEDN-GDBMZVCRSA-N	0	3	331.778	3.352	20	30		EGEDHN
O=C(/C=C/c1ccc(O[C@H]2CC[C@@H]3NCCO[C@H]32)cc1)c1ccccc1	ZINC001218149813	1373569854	/nfs/dbraw/zinc/56/98/54/1373569854.db2.gz	SKXTVYITAQPFAM-KVKOHGDOSA-N	0	3	349.430	3.481	20	30		EGEDHN
Fc1ccc(/N=C/c2ccc(O[C@H]3CC[C@@H]4NCCO[C@H]43)cc2)cc1	ZINC001218149265	1373570163	/nfs/dbraw/zinc/57/01/63/1373570163.db2.gz	GJKJPFWCKVNKGT-RWBRMYDLSA-N	0	3	340.398	3.475	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)[C@@H]3CCC=CCCC3)[C@H]2C1	ZINC001218161626	1373571580	/nfs/dbraw/zinc/57/15/80/1373571580.db2.gz	HRALIKDMKPQDSK-CEXWTWQISA-N	0	3	332.488	3.001	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)C[C@@H](CC)CCCC)C[C@H]1c1cn(C)cn1	ZINC001130632651	1373572392	/nfs/dbraw/zinc/57/23/92/1373572392.db2.gz	LCIDXSBZVUKTSY-JENIJYKNSA-N	0	3	346.519	3.097	20	30		EGEDHN
C=C(C)[C@@H]1CC[C@@H](C)C[C@@H]1Oc1ccnc2c3c(nn21)CCNC3	ZINC001218358318	1373603115	/nfs/dbraw/zinc/60/31/15/1373603115.db2.gz	WAVJMMHROMIGMI-KEYYUXOJSA-N	0	3	326.444	3.135	20	30		EGEDHN
CC(C)(C)n1cc(C#N)cc1NC(=O)[C@@](C)(N)Cc1ccc(F)cc1	ZINC001218558316	1373633000	/nfs/dbraw/zinc/63/30/00/1373633000.db2.gz	CZVBYDNONVXXRZ-IBGZPJMESA-N	0	3	342.418	3.152	20	30		EGEDHN
C=C1CCC(C(=O)N2CCO[C@@H]3CN(CCCC(C)C)C[C@@H]32)CC1	ZINC001218591013	1373634536	/nfs/dbraw/zinc/63/45/36/1373634536.db2.gz	RJBWQRKYYKLDJR-RBUKOAKNSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C1CCC(C(=O)N2CCO[C@@H]3CN(CC/C=C\CCC)C[C@@H]32)CC1	ZINC001218590696	1373634900	/nfs/dbraw/zinc/63/49/00/1373634900.db2.gz	KZLQNGNYHWTWIU-DXPXIUTNSA-N	0	3	346.515	3.391	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)C3CC4(CC4)C3)[C@H]2C1	ZINC001218618571	1373637516	/nfs/dbraw/zinc/63/75/16/1373637516.db2.gz	VAOJNXAWKXGKET-ZWKOTPCHSA-N	0	3	334.504	3.059	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)C3[C@H]4CCCCCC[C@H]34)[C@H]2C1	ZINC001218688337	1373644082	/nfs/dbraw/zinc/64/40/82/1373644082.db2.gz	CZBIUQXHNYIFRT-CADBVGFASA-N	0	3	346.515	3.081	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)[C@@H]3C[C@H]3C3CCC3)[C@H]2C1	ZINC001218757898	1373651846	/nfs/dbraw/zinc/65/18/46/1373651846.db2.gz	KMPWNBAUPOEZJW-ZGXWSNOMSA-N	0	3	346.515	3.081	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)C[C@@H](CC)C(C)(C)C)[C@H]2C1	ZINC001218945860	1373669422	/nfs/dbraw/zinc/66/94/22/1373669422.db2.gz	GGQYLTDCLNBXFM-FGTMMUONSA-N	0	3	336.520	3.327	20	30		EGEDHN
CCc1cc(NC(=O)[C@@H](NC)[C@@H](C)OC(C)(C)C)cc(CC)c1C#N	ZINC001219112586	1373688309	/nfs/dbraw/zinc/68/83/09/1373688309.db2.gz	NEGFDIFTWKCFFH-ACJLOTCBSA-N	0	3	345.487	3.413	20	30		EGEDHN
Cc1cc(NC(=O)N[C@@]2(C)CCN(Cc3ccccc3)C2)ncc1C#N	ZINC001219692632	1373726413	/nfs/dbraw/zinc/72/64/13/1373726413.db2.gz	RBDVMSZEJUTTHZ-FQEVSTJZSA-N	0	3	349.438	3.048	20	30		EGEDHN
C#CCCN1CC[C@]2(C1)CN(C(=O)CCCCCC(C)C)C[C@@H](C)O2	ZINC001131688012	1373763429	/nfs/dbraw/zinc/76/34/29/1373763429.db2.gz	GNPUFDFWHGOLJG-CTNGQTDRSA-N	0	3	348.531	3.308	20	30		EGEDHN
C#CCCN1CC[C@]2(C1)CN(C(=O)CCCCCCCC)C[C@H](C)O2	ZINC001131697286	1373768189	/nfs/dbraw/zinc/76/81/89/1373768189.db2.gz	ISOSJEIGSXZZLI-FPOVZHCZSA-N	0	3	348.531	3.452	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)[C@H]2CCCC[C@H]2C2CC2)cc1F	ZINC001131741957	1373780668	/nfs/dbraw/zinc/78/06/68/1373780668.db2.gz	NYOZREQSPRZLBA-ROUUACIJSA-N	0	3	343.446	3.120	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H]2CCN(CCOc3ccc(F)cc3)[C@H]2C1	ZINC001222398496	1373837464	/nfs/dbraw/zinc/83/74/64/1373837464.db2.gz	ZQKQREAVSHYVPS-APWZRJJASA-N	0	3	346.446	3.094	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H]2CCN(Cc3sc(C)nc3C)[C@H]2C1	ZINC001222402480	1373838261	/nfs/dbraw/zinc/83/82/61/1373838261.db2.gz	WLNVBCWEUNHZFN-CVEARBPZSA-N	0	3	333.501	3.149	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)C3(F)CCCCC3)CCC2)s1	ZINC001326911285	1388347459	/nfs/dbraw/zinc/34/74/59/1388347459.db2.gz	NUMODKGRIWQMES-UHFFFAOYSA-N	0	3	349.475	3.421	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@H](C)N(CCCOc2ccccc2)C1	ZINC001131894842	1375032707	/nfs/dbraw/zinc/03/27/07/1375032707.db2.gz	CBKDNALEONOVRZ-ZWKOTPCHSA-N	0	3	330.472	3.391	20	30		EGEDHN
C=CCOCC(=O)N[C@H]1CC[C@@H](C)N(Cc2cc(C)sc2C)C1	ZINC001131896564	1375033175	/nfs/dbraw/zinc/03/31/75/1375033175.db2.gz	UAHHUQDTCAMLQF-DYVFJYSZSA-N	0	3	336.501	3.037	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCC1CCN(Cc2cncc(C)c2)CC1	ZINC001224165090	1375058552	/nfs/dbraw/zinc/05/85/52/1375058552.db2.gz	GEKMKHPAERTXOU-IRXDYDNUSA-N	0	3	329.488	3.176	20	30		EGEDHN
Cc1ccc(C)c(CN2C[C@H](NC(=O)C#CC(C)C)CC[C@@H]2C)c1	ZINC001132017256	1375100802	/nfs/dbraw/zinc/10/08/02/1375100802.db2.gz	NJADDAFEQDMIKZ-AZUAARDMSA-N	0	3	326.484	3.432	20	30		EGEDHN
C[C@H]1CC[C@H](NC(=O)C#CC(C)(C)C)CN1CCc1ccccc1	ZINC001132033742	1375108449	/nfs/dbraw/zinc/10/84/49/1375108449.db2.gz	KQLHRNMJRJXGFR-HKUYNNGSSA-N	0	3	326.484	3.248	20	30		EGEDHN
O=C(CCC1CC1)N[C@@H]1CCCC[C@H]1NCC#Cc1ccc(F)cc1	ZINC001225457760	1375112613	/nfs/dbraw/zinc/11/26/13/1375112613.db2.gz	YVXRBCQLUJFRNU-WOJBJXKFSA-N	0	3	342.458	3.384	20	30		EGEDHN
C[C@H]1CC[C@@H](NC(=O)C#CC2CC2)CN1CCc1ccc(Cl)cc1	ZINC001132046053	1375114833	/nfs/dbraw/zinc/11/48/33/1375114833.db2.gz	MAWMTTCGTVLFTP-HNAYVOBHSA-N	0	3	344.886	3.265	20	30		EGEDHN
CCc1ccccc1CCN1C[C@H](NC(=O)C#CC2CC2)CC[C@H]1C	ZINC001132047103	1375116052	/nfs/dbraw/zinc/11/60/52/1375116052.db2.gz	UIYBGGSOZIBJOF-DYESRHJHSA-N	0	3	338.495	3.174	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1CC[C@H](C)N(CCOCC(C)C)C1	ZINC001132057236	1375122867	/nfs/dbraw/zinc/12/28/67/1375122867.db2.gz	LTAABIRGVYFETQ-PKOBYXMFSA-N	0	3	336.520	3.397	20	30		EGEDHN
C=CCOCCCC(=O)N[C@@H]1CCCC[C@H]1NCc1ccccc1F	ZINC001225553092	1375123968	/nfs/dbraw/zinc/12/39/68/1375123968.db2.gz	SHZBLPZQPAKMFR-RTBURBONSA-N	0	3	348.462	3.326	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@]2(C)CCc3ccccc3C2)CC1	ZINC001225754973	1375152985	/nfs/dbraw/zinc/15/29/85/1375152985.db2.gz	LIKNBOXRYVMJBQ-JOCHJYFZSA-N	0	3	338.495	3.033	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCc2ccccc2OCC)CC[C@@H]1C	ZINC001132156406	1375174261	/nfs/dbraw/zinc/17/42/61/1375174261.db2.gz	DWZFFAZOCMSJFG-WMZOPIPTSA-N	0	3	330.472	3.173	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CCCC[C@H]1NCc1cc(F)ccc1OC	ZINC001225929578	1375176095	/nfs/dbraw/zinc/17/60/95/1375176095.db2.gz	WCXYPINAUCZLAI-QZTJIDSGSA-N	0	3	346.446	3.155	20	30		EGEDHN
C=CCCCCCN1C[C@H](NC(=O)c2cc(OCC)no2)CC[C@@H]1C	ZINC001132174402	1375188234	/nfs/dbraw/zinc/18/82/34/1375188234.db2.gz	UWBRVTNSUCJPQG-JKSUJKDBSA-N	0	3	349.475	3.402	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@@H]1CCCC[C@H]1NCc1cccc(Cl)n1	ZINC001226134039	1375208717	/nfs/dbraw/zinc/20/87/17/1375208717.db2.gz	PAZCXUYPQMRMJU-HZPDHXFCSA-N	0	3	347.890	3.302	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1CC[C@H](C)N(CCOCC2CCC2)C1	ZINC001132221564	1375218806	/nfs/dbraw/zinc/21/88/06/1375218806.db2.gz	KFXJECBIGRVDKO-WMZOPIPTSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1CC[C@H](C)N(CCc2ccc(OC)cc2)C1	ZINC001132228078	1375223422	/nfs/dbraw/zinc/22/34/22/1375223422.db2.gz	LTYFTFZUIQWPNJ-WMZOPIPTSA-N	0	3	344.499	3.419	20	30		EGEDHN
CC#CCCCC(=O)N[C@H]1CC[C@@H](C)N(CCc2scnc2C)C1	ZINC001132235911	1375232243	/nfs/dbraw/zinc/23/22/43/1375232243.db2.gz	VJSOYDLGPZODKJ-WBVHZDCISA-N	0	3	347.528	3.157	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2ccn(C(C)C)c2C)CC[C@@H]1C	ZINC001132237489	1375232422	/nfs/dbraw/zinc/23/24/22/1375232422.db2.gz	KDSOARQSNZDPHK-FUHWJXTLSA-N	0	3	347.503	3.163	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1CC[C@@H](C)N(CCOCCCC)C1	ZINC001132241103	1375236609	/nfs/dbraw/zinc/23/66/09/1375236609.db2.gz	QRDMOCIWVVGMMU-RTBURBONSA-N	0	3	336.520	3.356	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2ccc(CCC)cc2)CC[C@@H]1C	ZINC001132246327	1375241821	/nfs/dbraw/zinc/24/18/21/1375241821.db2.gz	SALCOMQOFWEYTC-FXAWDEMLSA-N	0	3	344.499	3.424	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CC[C@H](C)N(CCOCC3CCC3)C2)C1	ZINC001132273783	1375259647	/nfs/dbraw/zinc/25/96/47/1375259647.db2.gz	JXKJYOXSKVCMIF-FUHWJXTLSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2CC[C@@H](C)N(CCOCC3CC3)C2)CCC1	ZINC001132281813	1375263791	/nfs/dbraw/zinc/26/37/91/1375263791.db2.gz	FUCPBBBRYAWLRE-AEFFLSMTSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCOCC(=O)NC1CCN([C@H](CC)c2ccc(F)cc2)CC1	ZINC001226571318	1375284772	/nfs/dbraw/zinc/28/47/72/1375284772.db2.gz	RTSOWRNSGPAYMH-GOSISDBHSA-N	0	3	334.435	3.060	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COCc2ccccc2C)CC[C@H]1C	ZINC001132340157	1375319477	/nfs/dbraw/zinc/31/94/77/1375319477.db2.gz	NPQBBGJAMLKDLP-IEBWSBKVSA-N	0	3	330.472	3.057	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCc2ccc(F)cc2F)CC[C@H]1C	ZINC001132392340	1375347374	/nfs/dbraw/zinc/34/73/74/1375347374.db2.gz	IMCXBYKAFILZEP-PBHICJAKSA-N	0	3	336.426	3.443	20	30		EGEDHN
C#CCN1CC[C@H](CN(Cc2scnc2C)C(=O)CCC(C)C)C1	ZINC001132558387	1375465896	/nfs/dbraw/zinc/46/58/96/1375465896.db2.gz	MERWHKIHHJEPCT-KRWDZBQOSA-N	0	3	347.528	3.171	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](C)[C@H](CNCc2ncc(C)s2)C1	ZINC001132761258	1375551845	/nfs/dbraw/zinc/55/18/45/1375551845.db2.gz	HPYZQPRGNJIRKJ-DOTOQJQBSA-N	0	3	347.528	3.219	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CCCC[C@H]2NCc2cnoc2C)CCC1	ZINC001228406603	1375567425	/nfs/dbraw/zinc/56/74/25/1375567425.db2.gz	NDDCLOLGWRJWKB-IAGOWNOFSA-N	0	3	331.460	3.246	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CCN(C[C@H](O)c2ccc(CC)cc2)CC1	ZINC001228631468	1375622172	/nfs/dbraw/zinc/62/21/72/1375622172.db2.gz	MMHQLOJVRMSNKN-IBGZPJMESA-N	0	3	344.499	3.075	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CCN(C[C@H](OC)c2ccccc2)CC1	ZINC001228631129	1375622594	/nfs/dbraw/zinc/62/25/94/1375622594.db2.gz	DIQYFQAOSJBCDU-SFHVURJKSA-N	0	3	330.472	3.167	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CCN(CCOc2cccc(C)c2)CC1	ZINC001228631503	1375622644	/nfs/dbraw/zinc/62/26/44/1375622644.db2.gz	NUQDFKROSOMTJJ-UHFFFAOYSA-N	0	3	330.472	3.167	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N1CC[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001188844884	1388389789	/nfs/dbraw/zinc/38/97/89/1388389789.db2.gz	CXIFEBPRSIBJHR-ORAICCCFSA-N	0	3	335.451	3.113	20	30		EGEDHN
CC#CCCCC(=O)NC1CCN(Cc2cccc(COC)c2)CC1	ZINC001228719100	1375651724	/nfs/dbraw/zinc/65/17/24/1375651724.db2.gz	WJWGLWFGAPIEBM-UHFFFAOYSA-N	0	3	342.483	3.107	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NC1CCN(CCOc2ccc(C)cc2)CC1	ZINC001228750124	1375663163	/nfs/dbraw/zinc/66/31/63/1375663163.db2.gz	WLAKCURNLHXESN-ROUUACIJSA-N	0	3	344.499	3.413	20	30		EGEDHN
CC#CCCCC(=O)NC1CCN(CCc2ccccc2F)CC1	ZINC001228770044	1375670644	/nfs/dbraw/zinc/67/06/44/1375670644.db2.gz	BOXHANIUUJJVAZ-UHFFFAOYSA-N	0	3	330.447	3.142	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](C)[C@@H](CNCc2cc(C)no2)C1	ZINC001133039663	1375729676	/nfs/dbraw/zinc/72/96/76/1375729676.db2.gz	UDBKVWDBJOMYBO-AEFFLSMTSA-N	0	3	345.487	3.141	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](C)[C@H](CNCc2csc(C)n2)C1	ZINC001133072143	1375758951	/nfs/dbraw/zinc/75/89/51/1375758951.db2.gz	GIMAXOJWVRHKSX-GDBMZVCRSA-N	0	3	335.517	3.382	20	30		EGEDHN
CCN1CC[C@@H](Oc2cc3ncc(C#N)c(Cl)c3cc2OC)C1	ZINC001229107059	1375765320	/nfs/dbraw/zinc/76/53/20/1375765320.db2.gz	VGWDIFLOIDZHID-GFCCVEGCSA-N	0	3	331.803	3.241	20	30		EGEDHN
CCCCCCCCC(=O)N[C@@H]1CCCC[C@H]1NCc1cnnn1C	ZINC001229882965	1375911332	/nfs/dbraw/zinc/91/13/32/1375911332.db2.gz	IRXFSMUMUWBBEF-QZTJIDSGSA-N	0	3	349.523	3.083	20	30		EGEDHN
Cc1cccc(Cl)c1C(=O)NCCNCc1cccc(C#N)c1	ZINC001133314322	1375916595	/nfs/dbraw/zinc/91/65/95/1375916595.db2.gz	FYBDOMUIKMVGCD-UHFFFAOYSA-N	0	3	327.815	3.040	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H](C)Oc1ccccc1	ZINC001230047644	1375935719	/nfs/dbraw/zinc/93/57/19/1375935719.db2.gz	OPAMSETVIZSTRF-USXIJHARSA-N	0	3	336.863	3.223	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)[C@@H](F)CCCCCC)CC1	ZINC001230052696	1375937021	/nfs/dbraw/zinc/93/70/21/1375937021.db2.gz	HUFLZKGRYYZHLR-KRWDZBQOSA-N	0	3	328.472	3.078	20	30		EGEDHN
C=C1CCC(C(=O)NCCNCc2ccccc2OC2CC2)CC1	ZINC001133365398	1375947211	/nfs/dbraw/zinc/94/72/11/1375947211.db2.gz	PDXYFFAHHJEBHS-UHFFFAOYSA-N	0	3	328.456	3.180	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2ccc(CC(C)C)cc2)CC1	ZINC001230230888	1375973717	/nfs/dbraw/zinc/97/37/17/1375973717.db2.gz	NPXIADPECVGCCI-UHFFFAOYSA-N	0	3	344.499	3.282	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)C[C@@H]1C[C@H]1C	ZINC001133403642	1375988127	/nfs/dbraw/zinc/98/81/27/1375988127.db2.gz	BXJQEGFXGKAZQF-WBVHZDCISA-N	0	3	332.875	3.328	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C1(C)CC=CC1	ZINC001133404016	1375990046	/nfs/dbraw/zinc/99/00/46/1375990046.db2.gz	UVNXRQJTMLJZDH-UHFFFAOYSA-N	0	3	330.859	3.248	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@H]1CC12CCC2	ZINC001133405878	1375990718	/nfs/dbraw/zinc/99/07/18/1375990718.db2.gz	VDUHHBBBRUOCCI-GOSISDBHSA-N	0	3	344.886	3.472	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C1(CF)CCC1	ZINC001133405882	1375991661	/nfs/dbraw/zinc/99/16/61/1375991661.db2.gz	VJYIJZAXSNQUFA-UHFFFAOYSA-N	0	3	336.838	3.031	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)c1cccc(F)c1)NCc1ccccc1C#N	ZINC001133576312	1376101772	/nfs/dbraw/zinc/10/17/72/1376101772.db2.gz	GEGULSCCIOWZIB-GJZGRUSLSA-N	0	3	339.414	3.384	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)c1oc(C)cc1C)Cc1cccnc1	ZINC001230726147	1376134627	/nfs/dbraw/zinc/13/46/27/1376134627.db2.gz	CCKYPKABAYWSBG-UHFFFAOYSA-N	0	3	341.455	3.490	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCCN(CCCF)Cc1cccnc1	ZINC001230769500	1376145354	/nfs/dbraw/zinc/14/53/54/1376145354.db2.gz	UXTCPSCPBUPTAY-UHFFFAOYSA-N	0	3	335.467	3.352	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCCN(CC(=C)C)Cc2cccnc2)cc1	ZINC001230812162	1376155444	/nfs/dbraw/zinc/15/54/44/1376155444.db2.gz	XKVWHDRZVSMCKV-UHFFFAOYSA-N	0	3	347.462	3.261	20	30		EGEDHN
C#CCCN(CCCNC(=O)CC(C)=C(C)C)Cc1cccnc1	ZINC001230813875	1376156611	/nfs/dbraw/zinc/15/66/11/1376156611.db2.gz	LNLOXCUSTPFQAT-UHFFFAOYSA-N	0	3	327.472	3.160	20	30		EGEDHN
C=C/C(C)=C/CC(=O)NCCCN(CC(=C)C)Cc1cccnc1	ZINC001230818290	1376158220	/nfs/dbraw/zinc/15/82/20/1376158220.db2.gz	HWEUDVMBMMWYGP-GIJQJNRQSA-N	0	3	327.472	3.488	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)[C@@H]1C[C@H]1C1CCC1)Cc1cccnc1	ZINC001230868324	1376170503	/nfs/dbraw/zinc/17/05/03/1376170503.db2.gz	WCVQRYOVCXVZDD-VQTJNVASSA-N	0	3	341.499	3.402	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)[C@H]1C[C@@]1(C)CC)Cc1cccnc1	ZINC001230881955	1376176655	/nfs/dbraw/zinc/17/66/55/1376176655.db2.gz	KVFGIRJULXQAIT-UYAOXDASSA-N	0	3	329.488	3.402	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N(C)C[C@@H]1CCN1CCC1=CCCCC1	ZINC001231093742	1376202914	/nfs/dbraw/zinc/20/29/14/1376202914.db2.gz	BWFXTWMXDAXGOC-MJGOQNOKSA-N	0	3	334.504	3.391	20	30		EGEDHN
C[C@@H](C#N)C(=O)N(C)C[C@H]1CCN1CCc1ccc2ccccc2c1	ZINC001231292694	1376223468	/nfs/dbraw/zinc/22/34/68/1376223468.db2.gz	FDWQUNFHDBGNDR-OXJNMPFZSA-N	0	3	335.451	3.075	20	30		EGEDHN
C(#Cc1ccccc1CN1CCC2(CC1)OCCO2)c1ccccc1	ZINC001231576966	1376269408	/nfs/dbraw/zinc/26/94/08/1376269408.db2.gz	MAFPHOJMKFCEFU-UHFFFAOYSA-N	0	3	333.431	3.425	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H]2CN(Cc3ccc(OC)c(C)c3)C[C@H]21	ZINC001189006907	1388434412	/nfs/dbraw/zinc/43/44/12/1388434412.db2.gz	MMTICZYPIFGNFQ-RBUKOAKNSA-N	0	3	342.483	3.393	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)C1C(C)(C)C1(C)C	ZINC001134076361	1376352868	/nfs/dbraw/zinc/35/28/68/1376352868.db2.gz	KOBAQVXAMRTERX-RYUDHWBXSA-N	0	3	345.325	3.450	20	30		EGEDHN
Cc1[nH]ccc1C(=O)N[C@H](C)C[C@@H](C)NCc1cc(F)ccc1C#N	ZINC001134104963	1376370206	/nfs/dbraw/zinc/37/02/06/1376370206.db2.gz	NROMIDWPVQLJRX-CHWSQXEVSA-N	0	3	342.418	3.021	20	30		EGEDHN
C#CCCCC(=O)N[C@@H](C)C[C@H](C)NCc1oc(C(C)C)nc1C	ZINC001134201849	1376415543	/nfs/dbraw/zinc/41/55/43/1376415543.db2.gz	SWZAJCMDSOJIJE-GJZGRUSLSA-N	0	3	333.476	3.283	20	30		EGEDHN
C#CCCCC(=O)N[C@H](C)C[C@H](C)NCc1ccn(C(CC)CC)n1	ZINC001134206241	1376417469	/nfs/dbraw/zinc/41/74/69/1376417469.db2.gz	QULPDPPTMIPZPP-DLBZAZTESA-N	0	3	346.519	3.421	20	30		EGEDHN
C#CCCCC(=O)N[C@H](C)C[C@@H](C)NCc1nsc2ccccc12	ZINC001134206495	1376418595	/nfs/dbraw/zinc/41/85/95/1376418595.db2.gz	VRCBLAPIUFENOR-HUUCEWRRSA-N	0	3	343.496	3.473	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CCN(Cc3cc(F)ccc3N)C2)C1	ZINC001232508202	1376469885	/nfs/dbraw/zinc/46/98/85/1376469885.db2.gz	YYAPCPYPTRWKOA-IBGZPJMESA-N	0	3	347.434	3.018	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)c1ccsc1C	ZINC001134319427	1376474638	/nfs/dbraw/zinc/47/46/38/1376474638.db2.gz	ZUBNFGHXZRVZJT-MNOVXSKESA-N	0	3	345.306	3.452	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1cc(F)ccc1C#N)NC(=O)C#CC(C)(C)C	ZINC001134330090	1376479907	/nfs/dbraw/zinc/47/99/07/1376479907.db2.gz	VLJNYDHAHOOLTB-LSDHHAIUSA-N	0	3	343.446	3.120	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H](C)C[C@H](C)NCc1oc(C)nc1C	ZINC001134419239	1376524664	/nfs/dbraw/zinc/52/46/64/1376524664.db2.gz	UYYMUURDZBYEBZ-UONOGXRCSA-N	0	3	333.476	3.433	20	30		EGEDHN
C=CCOCCCC(=O)N(C)C[C@H]1CCN1Cc1ccccc1CC	ZINC001233488008	1376653574	/nfs/dbraw/zinc/65/35/74/1376653574.db2.gz	AIMVTAXEBKSCRP-HXUWFJFHSA-N	0	3	344.499	3.265	20	30		EGEDHN
C[C@H]1CC[C@@](C)(C(=O)NCCNCc2ccc(F)c(C#N)c2)C1(C)C	ZINC001134783564	1376718746	/nfs/dbraw/zinc/71/87/46/1376718746.db2.gz	ZAMKNRDHRDZNQO-XOBRGWDASA-N	0	3	345.462	3.366	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)Cc2cccc3sccc32)c1	ZINC001134821169	1376742081	/nfs/dbraw/zinc/74/20/81/1376742081.db2.gz	MBVAWVQYEPRDPN-UHFFFAOYSA-N	0	3	349.459	3.221	20	30		EGEDHN
CC(C)C#CC(=O)N(C)C[C@@H]1CCN1CCCCOc1ccccc1	ZINC001234169362	1376782928	/nfs/dbraw/zinc/78/29/28/1376782928.db2.gz	DSKRHRRBPJTBGU-IBGZPJMESA-N	0	3	342.483	3.038	20	30		EGEDHN
C=CCCCN1CC[C@@H]1CN(C)C(=O)c1c(C)nn(C(C)(C)C)c1C	ZINC001235037355	1376837215	/nfs/dbraw/zinc/83/72/15/1376837215.db2.gz	RAMCOTISPLSQHF-QGZVFWFLSA-N	0	3	346.519	3.367	20	30		EGEDHN
C=CC1(CC(=O)NCCNCc2ccnc(Cl)c2)CCCCC1	ZINC001135187103	1376960046	/nfs/dbraw/zinc/96/00/46/1376960046.db2.gz	PZBLALHNWOWAAQ-UHFFFAOYSA-N	0	3	335.879	3.467	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)C1CC2(CCC2)C1	ZINC001135225201	1376986708	/nfs/dbraw/zinc/98/67/08/1376986708.db2.gz	OHHBEZRPSXUQMB-OLZOCXBDSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N[C@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001135242592	1376997714	/nfs/dbraw/zinc/99/77/14/1376997714.db2.gz	BOOBTKNCWCRUEO-QYHCQRMFSA-N	0	3	325.456	3.454	20	30		EGEDHN
CC1(C)C[C@@]1(C(=O)NCCNCc1ccc(C#N)cc1)c1ccccc1	ZINC001135649983	1377175327	/nfs/dbraw/zinc/17/53/27/1377175327.db2.gz	ALWBIJPGBFGEDR-QFIPXVFZSA-N	0	3	347.462	3.132	20	30		EGEDHN
CC(C)[C@H]1CC[C@H](C(=O)NCCNCc2ccc(C#N)cc2)CC1	ZINC001135734068	1377196748	/nfs/dbraw/zinc/19/67/48/1377196748.db2.gz	LEYDJNOACRLDQX-WGSAOQKQSA-N	0	3	327.472	3.226	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1ccc2cc(C)ccc2n1	ZINC001266158536	1377210814	/nfs/dbraw/zinc/21/08/14/1377210814.db2.gz	QANGBZQRJWRVOS-CQSZACIVSA-N	0	3	331.847	3.394	20	30		EGEDHN
C=CCCCCCN1CCC[C@H](NC(=O)c2n[nH]c3c2CCCC3)C1	ZINC001266225247	1377236429	/nfs/dbraw/zinc/23/64/29/1377236429.db2.gz	LFLTULYELHAVNP-INIZCTEOSA-N	0	3	344.503	3.229	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@@H]1CCN(Cc1cnn(C(C)C)c1)C2	ZINC001137076569	1377474036	/nfs/dbraw/zinc/47/40/36/1377474036.db2.gz	KTSVYDWGIMFJCJ-MOPGFXCFSA-N	0	3	333.476	3.038	20	30		EGEDHN
N#Cc1ccc(CN2CCC3SC(=O)C=C3C2)c(Br)c1	ZINC001137634345	1377578669	/nfs/dbraw/zinc/57/86/69/1377578669.db2.gz	OGQAHQFRQQZKCQ-CQSZACIVSA-N	0	3	349.253	3.095	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@@H](C(=O)N(CC)CC)C2)c1[O-]	ZINC001138625064	1377755811	/nfs/dbraw/zinc/75/58/11/1377755811.db2.gz	YROBCWJQWWOMAH-GOSISDBHSA-N	0	3	330.472	3.201	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@@H](C(=O)N(CC)CC)C2)c1[O-]	ZINC001138625064	1377755814	/nfs/dbraw/zinc/75/58/14/1377755814.db2.gz	YROBCWJQWWOMAH-GOSISDBHSA-N	0	3	330.472	3.201	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@@H](Oc3ccnc(OC)c3)C2)c1[O-]	ZINC001138631538	1377757987	/nfs/dbraw/zinc/75/79/87/1377757987.db2.gz	VBHZQXQAFLTKBH-GOSISDBHSA-N	0	3	340.423	3.178	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@@H](Oc3ccnc(OC)c3)C2)c1[O-]	ZINC001138631538	1377757990	/nfs/dbraw/zinc/75/79/90/1377757990.db2.gz	VBHZQXQAFLTKBH-GOSISDBHSA-N	0	3	340.423	3.178	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2C[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C2)c1[O-]	ZINC001138630458	1377758127	/nfs/dbraw/zinc/75/81/27/1377758127.db2.gz	WZZDLOWWCITJKW-PBHICJAKSA-N	0	3	346.471	3.466	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2C[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C2)c1[O-]	ZINC001138630458	1377758132	/nfs/dbraw/zinc/75/81/32/1377758132.db2.gz	WZZDLOWWCITJKW-PBHICJAKSA-N	0	3	346.471	3.466	20	30		EGEDHN
N#Cc1cccc2c(CN3CCC[C@@](O)(C(F)(F)F)CC3)c[nH]c21	ZINC001139701253	1377937409	/nfs/dbraw/zinc/93/74/09/1377937409.db2.gz	DFUFWUZYXJDOLM-INIZCTEOSA-N	0	3	337.345	3.319	20	30		EGEDHN
C#C[C@H]1CCCN(Cc2ccc3n2CCN(C(=O)OC(C)(C)C)C3)C1	ZINC001139929757	1377978056	/nfs/dbraw/zinc/97/80/56/1377978056.db2.gz	QOSOSYCDEJVBPX-INIZCTEOSA-N	0	3	343.471	3.084	20	30		EGEDHN
N#Cc1ccc2[nH]cc(CN3CCC(Oc4ccccn4)CC3)c2c1	ZINC001140113723	1378010641	/nfs/dbraw/zinc/01/06/41/1378010641.db2.gz	CFOQAZITNGNBJM-UHFFFAOYSA-N	0	3	332.407	3.478	20	30		EGEDHN
CC(C)C(=O)N(C)C1CCN(Cc2c[nH]c3ccc(C#N)cc23)CC1	ZINC001140117491	1378012108	/nfs/dbraw/zinc/01/21/08/1378012108.db2.gz	SIIPXDKRYCFDQP-UHFFFAOYSA-N	0	3	338.455	3.118	20	30		EGEDHN
C=CCN1C(=O)CCC12CCN(Cc1ccc(C)c(OC)c1)CC2	ZINC001140157374	1378022516	/nfs/dbraw/zinc/02/25/16/1378022516.db2.gz	ASRFLGXUQCNVLE-UHFFFAOYSA-N	0	3	328.456	3.147	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@]23CCN(CC(=C)C)C3=O)c1[O-]	ZINC001273360516	1378098779	/nfs/dbraw/zinc/09/87/79/1378098779.db2.gz	POVDLOUMOGGKLA-OAQYLSRUSA-N	0	3	340.467	3.264	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@]23CCN(CC(=C)C)C3=O)c1[O-]	ZINC001273360516	1378098781	/nfs/dbraw/zinc/09/87/81/1378098781.db2.gz	POVDLOUMOGGKLA-OAQYLSRUSA-N	0	3	340.467	3.264	20	30		EGEDHN
C=C(C)CN1C[C@@]2(CC1=O)CCCCN2Cc1cc(O)ccc1C	ZINC001274110773	1378116452	/nfs/dbraw/zinc/11/64/52/1378116452.db2.gz	URPZWDDKALYRBS-FQEVSTJZSA-N	0	3	328.456	3.234	20	30		EGEDHN
CCN1CC[C@]2(CCCN(Cc3cccc(C#N)c3Cl)C2)C1=O	ZINC001140813280	1378148874	/nfs/dbraw/zinc/14/88/74/1378148874.db2.gz	BVQBWDUYRWSUEJ-SFHVURJKSA-N	0	3	331.847	3.046	20	30		EGEDHN
N#Cc1ccccc1N1CCC[C@]2(C1)CN(C1CCCC1)CCO2	ZINC001276953605	1378196612	/nfs/dbraw/zinc/19/66/12/1378196612.db2.gz	MYNQVWZCCZHAJZ-HXUWFJFHSA-N	0	3	325.456	3.172	20	30		EGEDHN
C=CCO[C@H]1CO[C@@]2(C1)CCCN(Cc1cnc(CCCC)[nH]1)C2	ZINC001141069919	1378228593	/nfs/dbraw/zinc/22/85/93/1378228593.db2.gz	IPGYDKWEXMPJRH-IEBWSBKVSA-N	0	3	333.476	3.078	20	30		EGEDHN
O=C1C=C2CN(Cc3cc4c5c(c3)CCCN5CCC4)CCC2S1	ZINC001141075498	1378232786	/nfs/dbraw/zinc/23/27/86/1378232786.db2.gz	RSHDSTXLHKUKIW-SFHVURJKSA-N	0	3	340.492	3.160	20	30		EGEDHN
O=C1C=C2CN(Cc3cc4c5c(c3)CCCN5CCC4)CC[C@@H]2S1	ZINC001141075498	1378232789	/nfs/dbraw/zinc/23/27/89/1378232789.db2.gz	RSHDSTXLHKUKIW-SFHVURJKSA-N	0	3	340.492	3.160	20	30		EGEDHN
CC(C)CCC(=O)N(C)[C@@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001277615187	1378236835	/nfs/dbraw/zinc/23/68/35/1378236835.db2.gz	JWQDBEANLDTHGW-KRWDZBQOSA-N	0	3	333.501	3.383	20	30		EGEDHN
N#Cc1c(N)sc(CN2CC[C@@H](O)[C@@H]2Cc2ccccc2)c1Cl	ZINC001141110963	1378242400	/nfs/dbraw/zinc/24/24/00/1378242400.db2.gz	AFHNQDRZYDEXRG-UONOGXRCSA-N	0	3	347.871	3.033	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@@H]1CCN(Cc1cc3cccnc3[nH]1)C2	ZINC001143214362	1378561643	/nfs/dbraw/zinc/56/16/43/1378561643.db2.gz	OCJMAPFNICPJOX-UYAOXDASSA-N	0	3	341.455	3.137	20	30		EGEDHN
C#Cc1ccc(CN2CCc3ccc(CC(=O)OCC)cc3C2)cc1	ZINC001144568492	1378745860	/nfs/dbraw/zinc/74/58/60/1378745860.db2.gz	XAIUUGLERAJTEN-UHFFFAOYSA-N	0	3	333.431	3.332	20	30		EGEDHN
CCn1cccc1C(=O)N[C@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001146350760	1378824672	/nfs/dbraw/zinc/82/46/72/1378824672.db2.gz	SSYBSXTZFVPSIZ-JKSUJKDBSA-N	0	3	338.455	3.066	20	30		EGEDHN
C=CCCC(=O)N1CC2(C1)CCN(CC[C@@H]1CC1(Cl)Cl)C2	ZINC001147186866	1378984266	/nfs/dbraw/zinc/98/42/66/1378984266.db2.gz	DBXNGQMSBUQNGP-CYBMUJFWSA-N	0	3	331.287	3.071	20	30		EGEDHN
CC(C)C#CC(=O)N1CC2(C1)CCN([C@H](C)c1cccc(F)c1)C2	ZINC001147483513	1379031634	/nfs/dbraw/zinc/03/16/34/1379031634.db2.gz	QSSIKHJMFREDFW-MRXNPFEDSA-N	0	3	328.431	3.080	20	30		EGEDHN
C[C@@H](c1cccc(F)c1)N1CCC2(CN(C(=O)C#CC(C)(C)C)C2)C1	ZINC001147522642	1379036838	/nfs/dbraw/zinc/03/68/38/1379036838.db2.gz	DDEXXHCTSQFTPM-INIZCTEOSA-N	0	3	342.458	3.471	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001148089434	1379115197	/nfs/dbraw/zinc/11/51/97/1379115197.db2.gz	WCLCKFDURULIAV-DLBZAZTESA-N	0	3	337.467	3.051	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CN(C(=O)CCCC4CC4)C3)C2)cc1	ZINC001148117581	1379121103	/nfs/dbraw/zinc/12/11/03/1379121103.db2.gz	XCMFMYZXTDEPEC-UHFFFAOYSA-N	0	3	337.467	3.173	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC2(C1)CCN(Cc1ncccc1C)C2	ZINC001148130661	1379122557	/nfs/dbraw/zinc/12/25/57/1379122557.db2.gz	NYNCKLJJUHXGPH-QGZVFWFLSA-N	0	3	327.472	3.027	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC2(C1)CCN(CCc1csc(C)n1)C2	ZINC001148130365	1379122627	/nfs/dbraw/zinc/12/26/27/1379122627.db2.gz	MPPNDPWBGKCLTG-INIZCTEOSA-N	0	3	347.528	3.131	20	30		EGEDHN
CC(C)n1cccc1C(=O)N(C)C[C@H](C)NCc1ccc(C#N)s1	ZINC001283715700	1379138914	/nfs/dbraw/zinc/13/89/14/1379138914.db2.gz	VKGJAOHLRPFXEP-AWEZNQCLSA-N	0	3	344.484	3.252	20	30		EGEDHN
CC(C)CCCC(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001148327582	1379153099	/nfs/dbraw/zinc/15/30/99/1379153099.db2.gz	OQKPFSPOWNEIHX-UHFFFAOYSA-N	0	3	339.483	3.419	20	30		EGEDHN
CCCCCCCCCC(=O)NCCN[C@H](C)C(=O)N[C@@H](C)CC	ZINC001148825863	1379277790	/nfs/dbraw/zinc/27/77/90/1379277790.db2.gz	NEGPNDWAZRJAFI-DLBZAZTESA-N	0	3	341.540	3.136	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)c1ccc(-c2ccc(O)cc2)cc1	ZINC001148883758	1379290617	/nfs/dbraw/zinc/29/06/17/1379290617.db2.gz	FFRPGHYAEMMJAX-IBGZPJMESA-N	0	3	336.435	3.439	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N1CC2(C1)CCN([C@H](C)c1cccc(F)c1)C2	ZINC001148899933	1379293862	/nfs/dbraw/zinc/29/38/62/1379293862.db2.gz	LRBOEYOOIKVTHU-CVEARBPZSA-N	0	3	346.446	3.012	20	30		EGEDHN
CCC[C@H](C(=O)NCCNCc1ccc(C#N)s1)c1ccccc1	ZINC001150043954	1379488720	/nfs/dbraw/zinc/48/87/20/1379488720.db2.gz	JFCSUGCFBKZMNY-SFHVURJKSA-N	0	3	341.480	3.409	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)CCc2ccc(C)cc2C)C1	ZINC001150048060	1379489765	/nfs/dbraw/zinc/48/97/65/1379489765.db2.gz	UJEDQJVAIBMFBP-FQEVSTJZSA-N	0	3	344.499	3.019	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@H]1CN(Cc2ccccc2C)CCCO1	ZINC001150141281	1379501262	/nfs/dbraw/zinc/50/12/62/1379501262.db2.gz	ZEBHSXYEUWHEAA-QUCCMNQESA-N	0	3	344.499	3.304	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@@H]1CN(Cc2ccccc2C)CCCO1	ZINC001150141282	1379501461	/nfs/dbraw/zinc/50/14/61/1379501461.db2.gz	ZEBHSXYEUWHEAA-UYAOXDASSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)CC[C@H](C)c2ccccc2)C1	ZINC001150395960	1379547197	/nfs/dbraw/zinc/54/71/97/1379547197.db2.gz	XWCBWKWGFHQZCL-AZUAARDMSA-N	0	3	344.499	3.354	20	30		EGEDHN
C=CC[C@@H](C(=O)NC[C@H]1CN(CC(=C)C)CCCO1)c1ccccc1	ZINC001150745415	1379604033	/nfs/dbraw/zinc/60/40/33/1379604033.db2.gz	PFJGLVJEVXYNOX-VQTJNVASSA-N	0	3	342.483	3.130	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)[C@@H](CC)c2ccc(F)cc2)C1	ZINC001150786982	1379614115	/nfs/dbraw/zinc/61/41/15/1379614115.db2.gz	HPJCIXLODYVVCY-MOPGFXCFSA-N	0	3	348.462	3.103	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)[C@@H](CC)c2ccc(F)cc2)C1	ZINC001150786983	1379614172	/nfs/dbraw/zinc/61/41/72/1379614172.db2.gz	HPJCIXLODYVVCY-OALUTQOASA-N	0	3	348.462	3.103	20	30		EGEDHN
Cc1nc(C(C)C)sc1C(=O)NCCNCc1ccc(C#N)s1	ZINC001151024684	1379650017	/nfs/dbraw/zinc/65/00/17/1379650017.db2.gz	BVUIABANOWIBMR-UHFFFAOYSA-N	0	3	348.497	3.028	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2cccc(C)c2F)CC1	ZINC001151131939	1379664668	/nfs/dbraw/zinc/66/46/68/1379664668.db2.gz	KBCVBYUFEPHYKQ-UHFFFAOYSA-N	0	3	348.462	3.311	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)CCc2cccc(C)c2)CC1	ZINC001151232484	1379683702	/nfs/dbraw/zinc/68/37/02/1379683702.db2.gz	IYCJTCFZXFXFLP-UHFFFAOYSA-N	0	3	344.499	3.101	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2cc(C)ccc2F)CC1	ZINC001151334409	1379700695	/nfs/dbraw/zinc/70/06/95/1379700695.db2.gz	GQWKPTFRNGNQJP-UHFFFAOYSA-N	0	3	348.462	3.311	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2cc(C)cc(F)c2)CC1	ZINC001151339611	1379701251	/nfs/dbraw/zinc/70/12/51/1379701251.db2.gz	ILUPENAOFZKWFT-UHFFFAOYSA-N	0	3	348.462	3.311	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2csc(Cl)c2)CC1	ZINC001151352205	1379703746	/nfs/dbraw/zinc/70/37/46/1379703746.db2.gz	UHRBUEHEPWIQIV-UHFFFAOYSA-N	0	3	342.892	3.188	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2ccc(C)cc2)CC1	ZINC001151405686	1379712447	/nfs/dbraw/zinc/71/24/47/1379712447.db2.gz	CMFZABJVRYYFCA-UHFFFAOYSA-N	0	3	330.472	3.172	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)c1ccccc1	ZINC001151648856	1379756050	/nfs/dbraw/zinc/75/60/50/1379756050.db2.gz	XJFNVCXATHUXCK-OAHLLOKOSA-N	0	3	339.414	3.338	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)c1ccsc1	ZINC001151784597	1379780449	/nfs/dbraw/zinc/78/04/49/1379780449.db2.gz	YLKPSDVWMXICSO-CQSZACIVSA-N	0	3	327.453	3.260	20	30		EGEDHN
CC(C)(C)CC(C)(C)C(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001151938241	1379818955	/nfs/dbraw/zinc/81/89/55/1379818955.db2.gz	GYNNQAWPHFNTQJ-UHFFFAOYSA-N	0	3	333.451	3.366	20	30		EGEDHN
C=C[C@H](CC(=O)NCCNCc1cccc(F)c1)c1ccccc1	ZINC001151943122	1379821351	/nfs/dbraw/zinc/82/13/51/1379821351.db2.gz	RASOCGWNNWYHMK-QGZVFWFLSA-N	0	3	326.415	3.391	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)CSC(C)C	ZINC001151962085	1379826830	/nfs/dbraw/zinc/82/68/30/1379826830.db2.gz	WUZYJDOVOIFYQI-OAHLLOKOSA-N	0	3	333.501	3.026	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)CCc1ccoc1	ZINC001152659937	1379964913	/nfs/dbraw/zinc/96/49/13/1379964913.db2.gz	VTIUZEXTAUCUEB-MRXNPFEDSA-N	0	3	339.439	3.111	20	30		EGEDHN
Cc1ccc(C[C@H](C)C(=O)NCCNCc2ccc(C#N)s2)cc1	ZINC001152691290	1379971486	/nfs/dbraw/zinc/97/14/86/1379971486.db2.gz	JMGUYFXKOIUUDJ-HNNXBMFYSA-N	0	3	341.480	3.013	20	30		EGEDHN
C=C(Br)CNC[C@@H](NC(=O)c1ccsc1)C(C)(C)C	ZINC001284566168	1379975590	/nfs/dbraw/zinc/97/55/90/1379975590.db2.gz	TXFFFLLDMZHZDV-GFCCVEGCSA-N	0	3	345.306	3.391	20	30		EGEDHN
CC[C@H](C)CC(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)c(F)c1	ZINC001153001127	1380005233	/nfs/dbraw/zinc/00/52/33/1380005233.db2.gz	PDLVYIPIRQIBJH-LSDHHAIUSA-N	0	3	333.451	3.460	20	30		EGEDHN
CC(C)(C)[C@H](CNCc1ccc(C#N)s1)NC(=O)c1cc(F)c[nH]1	ZINC001284607885	1380007347	/nfs/dbraw/zinc/00/73/47/1380007347.db2.gz	GFXVZZHKIDKAQU-HNNXBMFYSA-N	0	3	348.447	3.021	20	30		EGEDHN
C=CCCOCC(=O)NCCN[C@@H](C)c1ccc(Cl)c(Cl)c1	ZINC001153086234	1380018596	/nfs/dbraw/zinc/01/85/96/1380018596.db2.gz	SORBGRICDYVZEI-LBPRGKRZSA-N	0	3	345.270	3.353	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@@H]1[C@@H](c2ccccc2)C1(C)C	ZINC001153401021	1380071252	/nfs/dbraw/zinc/07/12/52/1380071252.db2.gz	WOWICVLGHDCWGI-QRQLOZEOSA-N	0	3	326.484	3.276	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC[C@@H](C)N(CC)C[C@@H](O)c1ccccc1	ZINC001153567447	1380095092	/nfs/dbraw/zinc/09/50/92/1380095092.db2.gz	ZGBIUSLXKOXOKI-YLJYHZDGSA-N	0	3	344.499	3.315	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H](C)N(CC)C[C@@H](O)c1ccc(CC)cc1	ZINC001153626012	1380106560	/nfs/dbraw/zinc/10/65/60/1380106560.db2.gz	UVIZPXGLJMXKSJ-YLJYHZDGSA-N	0	3	346.515	3.465	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)CCC(C)(F)F	ZINC001154053273	1380192558	/nfs/dbraw/zinc/19/25/58/1380192558.db2.gz	OTLBLDAJPXRBEY-CQSZACIVSA-N	0	3	337.414	3.320	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1csc(C(F)(F)F)c1	ZINC001154158856	1380218274	/nfs/dbraw/zinc/21/82/74/1380218274.db2.gz	JILMUCLFLKQTQK-LLVKDONJSA-N	0	3	332.391	3.230	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)CCc1cc2ccccc2o1	ZINC001154233190	1380236154	/nfs/dbraw/zinc/23/61/54/1380236154.db2.gz	NURSNGZEUBVQHO-MRXNPFEDSA-N	0	3	326.440	3.215	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)[C@]1(C)C=CCC1	ZINC001154682056	1380330445	/nfs/dbraw/zinc/33/04/45/1380330445.db2.gz	DXEPTBJCCSTOPR-OXQOHEQNSA-N	0	3	325.456	3.241	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@@H]1C[C@H]1c1ccccc1CC	ZINC001154894057	1380373834	/nfs/dbraw/zinc/37/38/34/1380373834.db2.gz	GOMGOLUXIQMJRH-LSTHTHJFSA-N	0	3	326.484	3.202	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)[C@H]1Cc2ccccc21	ZINC001154920963	1380376278	/nfs/dbraw/zinc/37/62/78/1380376278.db2.gz	JHVBBPLAMPXJQN-IERDGZPVSA-N	0	3	347.462	3.225	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1ccc(F)c(Cl)c1F	ZINC001155005011	1380389146	/nfs/dbraw/zinc/38/91/46/1380389146.db2.gz	DEDZXZTVIFWJTH-LLVKDONJSA-N	0	3	328.790	3.082	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)Cc1occc1C	ZINC001155155431	1380417017	/nfs/dbraw/zinc/41/70/17/1380417017.db2.gz	JIBLLZCPMPLGNB-MRXNPFEDSA-N	0	3	339.439	3.029	20	30		EGEDHN
CSc1nc(Cl)c(C#N)c(-n2c3ccccc3nc2[C@H](C)N)n1	ZINC001155247162	1380428773	/nfs/dbraw/zinc/42/87/73/1380428773.db2.gz	BTFXQZLSUSTTOL-QMMMGPOBSA-N	0	3	344.831	3.082	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NCCCNCc1cccc(F)c1Cl	ZINC001155445832	1380454728	/nfs/dbraw/zinc/45/47/28/1380454728.db2.gz	FMFJGEUFXOBXDT-CYBMUJFWSA-N	0	3	342.842	3.056	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)[C@H]1CC12CCC2	ZINC001155503388	1380461635	/nfs/dbraw/zinc/46/16/35/1380461635.db2.gz	NXPMIIIWLHVPAO-CRAIPNDOSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1ccccc1OCC(C)C	ZINC001155883675	1380502561	/nfs/dbraw/zinc/50/25/61/1380502561.db2.gz	AHOFXSMZIITOFR-QGZVFWFLSA-N	0	3	330.472	3.185	20	30		EGEDHN
C=C(Cl)CN(CC)[C@H](C)CNC(=O)c1cccc2nc(C)[nH]c21	ZINC001156201138	1380541607	/nfs/dbraw/zinc/54/16/07/1380541607.db2.gz	WSPJPMJRLNRZLH-GFCCVEGCSA-N	0	3	334.851	3.064	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C(C)(C)c1ccccc1Cl	ZINC001156475426	1380581075	/nfs/dbraw/zinc/58/10/75/1380581075.db2.gz	FQVWRBXTYQDLJA-OAHLLOKOSA-N	0	3	334.891	3.468	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H](C)N(CC)C/C=C\c2ccccc2)nc1	ZINC001156475975	1380581243	/nfs/dbraw/zinc/58/12/43/1380581243.db2.gz	ZMEXMBQNYMTOMG-ZVBPTUHVSA-N	0	3	347.462	3.217	20	30		EGEDHN
COc1nc(NC[C@H](c2ccccc2)N2CCCC2)c(F)cc1C#N	ZINC001156531178	1380589350	/nfs/dbraw/zinc/58/93/50/1380589350.db2.gz	STEMOXVAQHJEOB-QGZVFWFLSA-N	0	3	340.402	3.350	20	30		EGEDHN
C#CCCCCC(=O)NCCCNCc1ccn(C(CC)CC)n1	ZINC001156811784	1380644008	/nfs/dbraw/zinc/64/40/08/1380644008.db2.gz	KVMGUHLXPFJJLO-UHFFFAOYSA-N	0	3	332.492	3.034	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NC[C@@H](C)N(CC)Cc1cc(F)ccc1C	ZINC001157217649	1380813635	/nfs/dbraw/zinc/81/36/35/1380813635.db2.gz	UPZHUIBFAJKCSB-HZPDHXFCSA-N	0	3	336.451	3.052	20	30		EGEDHN
O=C(C#CC1CC1)NCCCNCc1nc(C2CCCCC2)cs1	ZINC001157682555	1381000371	/nfs/dbraw/zinc/00/03/71/1381000371.db2.gz	JWBVMQPULFLJHR-UHFFFAOYSA-N	0	3	345.512	3.200	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCCC[C@@H]1CN(C)CCOCC(F)F	ZINC001158005072	1381099900	/nfs/dbraw/zinc/09/99/00/1381099900.db2.gz	BNFLPNLKAKYMFH-OAHLLOKOSA-N	0	3	346.462	3.183	20	30		EGEDHN
C=C(C)CCC(=O)N1CCCC[C@@H]1CN(C)CCO[C@H]1CC1(F)F	ZINC001158011966	1381103363	/nfs/dbraw/zinc/10/33/63/1381103363.db2.gz	XYVIRXUJOFLJCR-CVEARBPZSA-N	0	3	344.446	3.080	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1coc(Br)c1	ZINC001158035466	1381108878	/nfs/dbraw/zinc/10/88/78/1381108878.db2.gz	CFMLJQSAZKFBCO-CYBMUJFWSA-N	0	3	341.249	3.155	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H]1CCc2ccc(OC)cc21	ZINC001158077539	1381122535	/nfs/dbraw/zinc/12/25/35/1381122535.db2.gz	SFOKZDYGVGBCPP-MJGOQNOKSA-N	0	3	342.483	3.224	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc2ccncc2s1	ZINC001158089805	1381125252	/nfs/dbraw/zinc/12/52/52/1381125252.db2.gz	CLTJOESDAZBHEY-OAHLLOKOSA-N	0	3	329.469	3.409	20	30		EGEDHN
CC#CCCCC(=O)N1CCCC[C@@H]1CN(C)CCOCC1CCC1	ZINC001158358198	1381216444	/nfs/dbraw/zinc/21/64/44/1381216444.db2.gz	XLQSACNESBSGDL-HXUWFJFHSA-N	0	3	348.531	3.310	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001158747011	1381381581	/nfs/dbraw/zinc/38/15/81/1381381581.db2.gz	RBGILAMFOOWIHB-UHFFFAOYSA-N	0	3	329.419	3.062	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc(OC)c(OCC)c1	ZINC001158836805	1381423311	/nfs/dbraw/zinc/42/33/11/1381423311.db2.gz	DKWYZRITJKURDU-QGZVFWFLSA-N	0	3	346.471	3.206	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NCCCNCc1cc(F)ccc1F	ZINC001158857031	1381436810	/nfs/dbraw/zinc/43/68/10/1381436810.db2.gz	KXBMFDPLNYXHDP-UHFFFAOYSA-N	0	3	330.806	3.339	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NCCCNCc1oc(C(C)C)nc1C	ZINC001158857828	1381436824	/nfs/dbraw/zinc/43/68/24/1381436824.db2.gz	VRXDOQQWSIUDLQ-UHFFFAOYSA-N	0	3	341.883	3.481	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1ccc(CF)cc1	ZINC001158928243	1381469431	/nfs/dbraw/zinc/46/94/31/1381469431.db2.gz	PMXKSDWMWXFJGJ-LJQANCHMSA-N	0	3	348.462	3.285	20	30		EGEDHN
C=C(C)CCC(=O)NCCCNCC(=O)Nc1ccc(C(C)C)cc1	ZINC001159021324	1381513728	/nfs/dbraw/zinc/51/37/28/1381513728.db2.gz	RBBFRSFNBQMNBS-UHFFFAOYSA-N	0	3	345.487	3.201	20	30		EGEDHN
C=C(C)CCC(=O)NCCCNCc1ccccc1Br	ZINC001159040739	1381534632	/nfs/dbraw/zinc/53/46/32/1381534632.db2.gz	WECSTFWQMVRNKA-UHFFFAOYSA-N	0	3	339.277	3.401	20	30		EGEDHN
Cc1occc1C(=O)NCCC1=CCN(Cc2ccc(C#N)cc2)CC1	ZINC001159206313	1381731137	/nfs/dbraw/zinc/73/11/37/1381731137.db2.gz	XYSHAWAQTKGMIK-UHFFFAOYSA-N	0	3	349.434	3.412	20	30		EGEDHN
N#Cc1ccc(CN2CC=C(CCNC(=O)c3ccoc3)CC2)cc1	ZINC001159300527	1381756477	/nfs/dbraw/zinc/75/64/77/1381756477.db2.gz	MLCBPBQJCXCVOV-UHFFFAOYSA-N	0	3	335.407	3.103	20	30		EGEDHN
C=CCCC(=O)NCCC1=CCN(Cc2sc(C)nc2C)CC1	ZINC001159538700	1381821534	/nfs/dbraw/zinc/82/15/34/1381821534.db2.gz	HXWOWDFEXQSFTI-UHFFFAOYSA-N	0	3	333.501	3.365	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCC1=CCN(CCCCC(F)(F)F)CC1	ZINC001159587290	1381836820	/nfs/dbraw/zinc/83/68/20/1381836820.db2.gz	MUCTTWFRIJZQNE-ZDUSSCGKSA-N	0	3	331.382	3.017	20	30		EGEDHN
C#CCC1(C(=O)NCCCNCc2ccn(C(CC)CC)n2)CCC1	ZINC001159638075	1381856316	/nfs/dbraw/zinc/85/63/16/1381856316.db2.gz	IJGGTYWDCUOOAO-UHFFFAOYSA-N	0	3	344.503	3.034	20	30		EGEDHN
C#CCCCCC(=O)NCCC1=CCN(CCOCC2CCC2)CC1	ZINC001159858725	1381921805	/nfs/dbraw/zinc/92/18/05/1381921805.db2.gz	AYQLSMBLCXXZLO-UHFFFAOYSA-N	0	3	346.515	3.135	20	30		EGEDHN
C=CCn1cccc1C(=O)NCCCNCc1cc(Cl)ccc1F	ZINC001159974405	1381955034	/nfs/dbraw/zinc/95/50/34/1381955034.db2.gz	BCOFOJYIOWAMCP-UHFFFAOYSA-N	0	3	349.837	3.376	20	30		EGEDHN
N#Cc1cnc2cc[nH]c(NC(=N)c3ccc4cc(O)ccc4c3)c1-2	ZINC001160025857	1381972409	/nfs/dbraw/zinc/97/24/09/1381972409.db2.gz	GAYNOYQECZMHSR-UHFFFAOYSA-N	0	3	327.347	3.330	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CCCc2csc(C)n2)CC1	ZINC001160136743	1382011273	/nfs/dbraw/zinc/01/12/73/1382011273.db2.gz	ORFCOFCXQIBGKB-UHFFFAOYSA-N	0	3	333.501	3.099	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc3cc(C)cn3c2)CC1	ZINC001160314366	1382070495	/nfs/dbraw/zinc/07/04/95/1382070495.db2.gz	KXSJSHYHWIEXSP-UHFFFAOYSA-N	0	3	335.451	3.023	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ncsc2C(F)(F)F)CC1	ZINC001160666295	1382165828	/nfs/dbraw/zinc/16/58/28/1382165828.db2.gz	XSXVZSVSYAUWFB-UHFFFAOYSA-N	0	3	345.390	3.100	20	30		EGEDHN
N#CCCN(Cc1ccc(Cl)cc1)C(=O)[C@@H](N)CC1CCCC1	ZINC001160739246	1382182825	/nfs/dbraw/zinc/18/28/25/1382182825.db2.gz	VBKUQFZOCVLZBD-KRWDZBQOSA-N	0	3	333.863	3.490	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H]2CC[C@H](C(F)(F)F)C2)CC1	ZINC001161021044	1382276363	/nfs/dbraw/zinc/27/63/63/1382276363.db2.gz	JZAANNYCHMOVAI-CVEARBPZSA-N	0	3	342.405	3.127	20	30		EGEDHN
CCC(CC)[C@H](C)C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001161426533	1382405914	/nfs/dbraw/zinc/40/59/14/1382405914.db2.gz	IMGPDGFSUSJXIG-AWEZNQCLSA-N	0	3	333.451	3.366	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CCc2cccc(OCC)c2)CC1	ZINC001161968032	1382575887	/nfs/dbraw/zinc/57/58/87/1382575887.db2.gz	CUMMFIJMVNYOHK-UHFFFAOYSA-N	0	3	342.483	3.342	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H](C)Cc2cccc(F)c2)CC1	ZINC001161983309	1382587664	/nfs/dbraw/zinc/58/76/64/1382587664.db2.gz	ZVUQIIRAKYDTAU-MRXNPFEDSA-N	0	3	330.447	3.329	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)CCc2cccc(F)c2F)CC1	ZINC001162007053	1382597345	/nfs/dbraw/zinc/59/73/45/1382597345.db2.gz	KVYMEZOGQTXJIS-UHFFFAOYSA-N	0	3	346.421	3.059	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)C1(c2ccccc2)CCC1	ZINC001162086352	1382625252	/nfs/dbraw/zinc/62/52/52/1382625252.db2.gz	LFBQLDMBYOORIZ-UHFFFAOYSA-N	0	3	347.462	3.276	20	30		EGEDHN
C=CCCC(=O)NCC1(COC)CCN(Cc2ccccc2F)CC1	ZINC001162151190	1382640753	/nfs/dbraw/zinc/64/07/53/1382640753.db2.gz	NUXZURBLOZXYGX-UHFFFAOYSA-N	0	3	348.462	3.137	20	30		EGEDHN
Cc1ccc2c(c1)[C@@H](Nc1ccc(/N=C/N(C)C)c(C#N)c1)C(=O)N2	ZINC001162577526	1382796518	/nfs/dbraw/zinc/79/65/18/1382796518.db2.gz	ZQQKIJPGSYHPED-PGNNWUFWSA-N	0	3	333.395	3.193	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@@H]2CCCC(C)(C)C2)(COC)CC1	ZINC001162623351	1382814002	/nfs/dbraw/zinc/81/40/02/1382814002.db2.gz	RNIVUGPQQYICCD-GOSISDBHSA-N	0	3	348.531	3.071	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C[C@H]1CCC[C@H]1C	ZINC001162822441	1382887017	/nfs/dbraw/zinc/88/70/17/1382887017.db2.gz	QKKXOVMPGMTWMB-UYAOXDASSA-N	0	3	326.484	3.107	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)c1[nH]ccc1C1CC1	ZINC001162832414	1382889625	/nfs/dbraw/zinc/88/96/25/1382889625.db2.gz	RXCRWSOVNDQEFU-UHFFFAOYSA-N	0	3	349.478	3.190	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CC[C@@H]2C[C@@H]2CC1	ZINC001162870972	1382899894	/nfs/dbraw/zinc/89/98/94/1382899894.db2.gz	BNYBSBSYKJELNC-WKCHPHFGSA-N	0	3	338.495	3.107	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CCCC(F)(F)C1	ZINC001162929192	1382919046	/nfs/dbraw/zinc/91/90/46/1382919046.db2.gz	RWPHDDXMAMXRLQ-GOSISDBHSA-N	0	3	348.437	3.106	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H](C)Cc1ccccc1	ZINC001163001559	1382943470	/nfs/dbraw/zinc/94/34/70/1382943470.db2.gz	JRQOPQCOAWNNBB-FQEVSTJZSA-N	0	3	348.490	3.159	20	30		EGEDHN
C[C@H]1C[C@H]1C(=O)NCCC1(CNCC#Cc2ccccc2Cl)CC1	ZINC001163238528	1383002666	/nfs/dbraw/zinc/00/26/66/1383002666.db2.gz	YYSMZMQIPUQGJI-DOTOQJQBSA-N	0	3	344.886	3.224	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)C[C@@H]2C=CCC2)CC1	ZINC001163369103	1383034189	/nfs/dbraw/zinc/03/41/89/1383034189.db2.gz	FNZDVKIVDYPYMI-CQSZACIVSA-N	0	3	341.293	3.127	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCC1(CN[C@@H](C)c2cc(F)ccc2F)CC1	ZINC001163842389	1383128255	/nfs/dbraw/zinc/12/82/55/1383128255.db2.gz	YRZZJIXZNZEZDS-OLZOCXBDSA-N	0	3	335.398	3.062	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCC1(CNCc2cc(F)ccc2Cl)CC1	ZINC001163854222	1383129811	/nfs/dbraw/zinc/12/98/11/1383129811.db2.gz	KUDODUTVESFWOZ-LBPRGKRZSA-N	0	3	337.826	3.015	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCC1(CNCc2cccc(F)c2Cl)CC1	ZINC001163860043	1383130338	/nfs/dbraw/zinc/13/03/38/1383130338.db2.gz	WSYHHNIAZQZWIG-GFCCVEGCSA-N	0	3	337.826	3.015	20	30		EGEDHN
CC1CC(C(=O)NCCC2(CNCc3cc(C#N)ccc3F)CC2)C1	ZINC001164026515	1383148043	/nfs/dbraw/zinc/14/80/43/1383148043.db2.gz	HYOMZDDXXMKXGX-UHFFFAOYSA-N	0	3	343.446	3.120	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)NCCC1(CNCc2cc(C#N)ccc2F)CC1	ZINC001164124562	1383158721	/nfs/dbraw/zinc/15/87/21/1383158721.db2.gz	BITFWKQHXCVQIF-INIZCTEOSA-N	0	3	343.446	3.120	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCCNCc1ccn(C2CCCC2)n1	ZINC001164221928	1383167591	/nfs/dbraw/zinc/16/75/91/1383167591.db2.gz	GTFRUCPYORPUIW-HZPDHXFCSA-N	0	3	332.492	3.052	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCCNCc1ccn(C(CC)CC)n1	ZINC001164223918	1383168033	/nfs/dbraw/zinc/16/80/33/1383168033.db2.gz	XVHCKQOIGGVORS-JKSUJKDBSA-N	0	3	334.508	3.298	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCCNCc1nc(C(C)(C)C)cs1	ZINC001164233638	1383169387	/nfs/dbraw/zinc/16/93/87/1383169387.db2.gz	INOGXOGGDCYZOW-UONOGXRCSA-N	0	3	337.533	3.495	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)C(C)(C)C(C)C)CC1	ZINC001164682542	1383216587	/nfs/dbraw/zinc/21/65/87/1383216587.db2.gz	DRHUIAMPKNZBKP-UHFFFAOYSA-N	0	3	345.325	3.453	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C[C@H]2CCC(F)(F)C2)CC1	ZINC001165374545	1383282133	/nfs/dbraw/zinc/28/21/33/1383282133.db2.gz	VLXVNGXMFTZFPF-CYBMUJFWSA-N	0	3	334.838	3.441	20	30		EGEDHN
C[C@@H]1CCCC[C@H]1C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001165411634	1383290256	/nfs/dbraw/zinc/29/02/56/1383290256.db2.gz	VCNAPGNYHMWXDN-RHSMWYFYSA-N	0	3	331.435	3.120	20	30		EGEDHN
COc1c(C#N)c(F)ccc1NCC1CN(Cc2ccccc2)C1	ZINC001165468078	1383299593	/nfs/dbraw/zinc/29/95/93/1383299593.db2.gz	BEYDWWGGZIXAIR-UHFFFAOYSA-N	0	3	325.387	3.250	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)C2(F)CCCC2)CC1	ZINC001165899538	1383361289	/nfs/dbraw/zinc/36/12/89/1383361289.db2.gz	HQDLNIOJFFICSW-UHFFFAOYSA-N	0	3	347.272	3.053	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCCNCc1ccn(C(CC)CC)n1	ZINC001165929300	1383366952	/nfs/dbraw/zinc/36/69/52/1383366952.db2.gz	KNJQWQPKIVQPOI-IBGZPJMESA-N	0	3	334.508	3.442	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cccc3cccnc32)CC1	ZINC001166005133	1383376634	/nfs/dbraw/zinc/37/66/34/1383376634.db2.gz	CIYUPRADPKGJFK-UHFFFAOYSA-N	0	3	343.858	3.477	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc(OC)cc2F)CC1	ZINC001166010505	1383376766	/nfs/dbraw/zinc/37/67/66/1383376766.db2.gz	GXIRKWFMGQBGLN-UHFFFAOYSA-N	0	3	340.826	3.077	20	30		EGEDHN
C[C@@H]1CCCN(c2nccnc2C(C#N)C(=O)OC(C)(C)C)[C@@H]1C	ZINC001166612976	1383447072	/nfs/dbraw/zinc/44/70/72/1383447072.db2.gz	BZEHUTWVIPACDC-MGPQQGTHSA-N	0	3	330.432	3.050	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCCC1(CN[C@@H](C)c2cnc(C)cn2)CC1	ZINC001166765692	1383474454	/nfs/dbraw/zinc/47/44/54/1383474454.db2.gz	VTZWLFMVRONVCV-DLBZAZTESA-N	0	3	344.503	3.324	20	30		EGEDHN
CCC1(C(=O)NCCC2(CNCc3ccc(C#N)cc3F)CC2)CC1	ZINC001167057117	1383529362	/nfs/dbraw/zinc/52/93/62/1383529362.db2.gz	NUMIFFZDFWSQIT-UHFFFAOYSA-N	0	3	343.446	3.264	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2sc(C)cc2OC)CC1	ZINC001167385585	1383618967	/nfs/dbraw/zinc/61/89/67/1383618967.db2.gz	JVABBXXHALYCGT-UHFFFAOYSA-N	0	3	342.892	3.307	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@@H]2CCOc3ccccc32)CC1	ZINC001167466389	1383640646	/nfs/dbraw/zinc/64/06/46/1383640646.db2.gz	KSIOLKKSKAZBHX-MRXNPFEDSA-N	0	3	348.874	3.181	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)[C@@H](C)Cc1ccccc1Cl	ZINC001167475721	1383644812	/nfs/dbraw/zinc/64/48/12/1383644812.db2.gz	KPIBXVWMYIXJCH-LBPRGKRZSA-N	0	3	329.271	3.367	20	30		EGEDHN
C=C(Cl)Cn1c([C@@H](C)CC)nnc1N1CCN(C(C)(C)C)CC1	ZINC001301018205	1383690704	/nfs/dbraw/zinc/69/07/04/1383690704.db2.gz	WVOJGQMVPWLTMF-ZDUSSCGKSA-N	0	3	339.915	3.465	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc(C)cc2OC)CC1	ZINC001167798145	1383742518	/nfs/dbraw/zinc/74/25/18/1383742518.db2.gz	PGRJHCLDSQFDKZ-UHFFFAOYSA-N	0	3	336.863	3.246	20	30		EGEDHN
CC(C)(C)C(=O)NCCC1(CNCc2cc(C#N)ccc2F)CC1	ZINC001167836451	1383755405	/nfs/dbraw/zinc/75/54/05/1383755405.db2.gz	WCQZPEATPOKXMT-UHFFFAOYSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@H](C)n2c(C)ccc2C)CC1	ZINC001168335722	1383875705	/nfs/dbraw/zinc/87/57/05/1383875705.db2.gz	RUHBAOQIHIBBCQ-INIZCTEOSA-N	0	3	337.895	3.295	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@@H](C)CCCCNCc1c(F)cccc1Cl	ZINC001169833108	1384190235	/nfs/dbraw/zinc/19/02/35/1384190235.db2.gz	TUACUYXPUZDOOZ-OLZOCXBDSA-N	0	3	339.842	3.403	20	30		EGEDHN
CCCc1nc(CNCCCC[C@H](C)NC(=O)[C@@H](C)C#N)cs1	ZINC001169849060	1384191118	/nfs/dbraw/zinc/19/11/18/1384191118.db2.gz	UBMFNRXGZMBTIO-KBPBESRZSA-N	0	3	336.505	3.020	20	30		EGEDHN
CC[C@@H](SC)C(=O)N[C@@H](C)CCCCNCc1ccccc1C#N	ZINC001170213285	1384266246	/nfs/dbraw/zinc/26/62/46/1384266246.db2.gz	XZBINRCBJHBICG-MAUKXSAKSA-N	0	3	347.528	3.464	20	30		EGEDHN
COc1cccnc1O[C@H]1CCN([C@@H](C)Cc2cccc(C#N)c2)C1	ZINC001171230410	1384474886	/nfs/dbraw/zinc/47/48/86/1384474886.db2.gz	DINHKHZSNIWQHX-YJBOKZPZSA-N	0	3	337.423	3.046	20	30		EGEDHN
Cc1nccnc1O[C@@H]1CCCN([C@H](C)Cc2cccc(C#N)c2)C1	ZINC001171231618	1384475383	/nfs/dbraw/zinc/47/53/83/1384475383.db2.gz	KLKKYOUSMAEQGM-DNVCBOLYSA-N	0	3	336.439	3.131	20	30		EGEDHN
Cc1c(C)c(NC(=N)c2ccc(C(N)=O)cc2)ccc1Br	ZINC001171256909	1384480344	/nfs/dbraw/zinc/48/03/44/1384480344.db2.gz	NOLMWMRMQKRLSI-UHFFFAOYSA-N	0	3	346.228	3.202	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)C[C@@H](C)c2c(C)noc2C)C1	ZINC001316633927	1384496331	/nfs/dbraw/zinc/49/63/31/1384496331.db2.gz	VWCOCPMHNFPFMN-VCTAVGKDSA-N	0	3	339.867	3.022	20	30		EGEDHN
CC[C@H](CC(F)(F)F)C(=O)NCCCNCc1ccccc1C#N	ZINC001171354937	1384500053	/nfs/dbraw/zinc/50/00/53/1384500053.db2.gz	SIFMDEWNXWCOAW-CYBMUJFWSA-N	0	3	341.377	3.133	20	30		EGEDHN
C=CCOC(=O)N[C@H]1CCCN([C@@H]2CCc3c(F)cccc3C2)C1	ZINC001171445569	1384525538	/nfs/dbraw/zinc/52/55/38/1384525538.db2.gz	LCMLAOVVPHMPQQ-JKSUJKDBSA-N	0	3	332.419	3.060	20	30		EGEDHN
CCCCCCCC[C@@H](CC)N1CCN(CC(=O)N(C)C)CC1	ZINC001172505836	1384806307	/nfs/dbraw/zinc/80/63/07/1384806307.db2.gz	VXIXZPSBTSARJE-GOSISDBHSA-N	0	3	325.541	3.221	20	30		EGEDHN
CCC(C)(C)CC(=O)N1CC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001317057053	1384831421	/nfs/dbraw/zinc/83/14/21/1384831421.db2.gz	LWDDPIFPQNOLKH-INIZCTEOSA-N	0	3	331.435	3.214	20	30		EGEDHN
N=C(N[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccc(Cl)cn1	ZINC001172900849	1384874385	/nfs/dbraw/zinc/87/43/85/1384874385.db2.gz	GPWVSIYGSYHKHB-CQSZACIVSA-N	0	3	344.802	3.296	20	30		EGEDHN
C[C@@H](N[C@H]1CCN(C(=O)OC(C)(C)C)[C@H](C#N)C1)c1cccnc1	ZINC001172969563	1384892884	/nfs/dbraw/zinc/89/28/84/1384892884.db2.gz	YPSHBGXAVKXQKC-KBMXLJTQSA-N	0	3	330.432	3.024	20	30		EGEDHN
C=CCOC1CCC(N2CCN(c3cc(Cl)ccn3)CC2)CC1	ZINC001173327375	1384959497	/nfs/dbraw/zinc/95/94/97/1384959497.db2.gz	MWDAFCPAMUYEIC-UHFFFAOYSA-N	0	3	335.879	3.371	20	30		EGEDHN
C[C@H](CCCCNCc1cc(F)ccc1C#N)NC(=O)[C@H]1C[C@@H]1C	ZINC001174783546	1385148341	/nfs/dbraw/zinc/14/83/41/1385148341.db2.gz	MLUDYVOBFJXSQH-IYOUNJFTSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=CCCCC(=O)N[C@@H](C)CCCCNCc1cc2n(n1)CCCC2	ZINC001174979331	1385177927	/nfs/dbraw/zinc/17/79/27/1385177927.db2.gz	XNWGNCKERNPKAL-KRWDZBQOSA-N	0	3	346.519	3.340	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](C)CCCCNCc2ocnc2C)CC1	ZINC001175074142	1385190407	/nfs/dbraw/zinc/19/04/07/1385190407.db2.gz	NZMVWZGGXCQKGO-OAHLLOKOSA-N	0	3	333.476	3.494	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1ccc(Cl)s1	ZINC001175282613	1385240045	/nfs/dbraw/zinc/24/00/45/1385240045.db2.gz	XTHVGOPBVKOMEC-UHFFFAOYSA-N	0	3	333.844	3.183	20	30		EGEDHN
CCCN(CCNC(=O)Cc1ccc(C)cc1)Cc1cccc(C#N)c1	ZINC001317543247	1385285473	/nfs/dbraw/zinc/28/54/73/1385285473.db2.gz	KICDAHCSLJUXCL-UHFFFAOYSA-N	0	3	349.478	3.438	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)[C@@H]1CC12CC2	ZINC001175453779	1385297066	/nfs/dbraw/zinc/29/70/66/1385297066.db2.gz	VXAJIMANYPBPFG-QAPCUYQASA-N	0	3	325.456	3.123	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1CCCN(CCc2cccs2)C1	ZINC001317979337	1385597023	/nfs/dbraw/zinc/59/70/23/1385597023.db2.gz	HDUOAVGROPYCLG-KRWDZBQOSA-N	0	3	332.513	3.455	20	30		EGEDHN
C=CC[C@@H](C(=O)NCCCNCc1conc1CC)c1ccccc1	ZINC001176697620	1385663148	/nfs/dbraw/zinc/66/31/48/1385663148.db2.gz	KZMOAJDOMZYYJG-GOSISDBHSA-N	0	3	341.455	3.193	20	30		EGEDHN
C#CCC1(C(=O)NCCCNCc2nc(C)cs2)CCCCC1	ZINC001177217970	1385870991	/nfs/dbraw/zinc/87/09/91/1385870991.db2.gz	XPFYJJONONYNDS-UHFFFAOYSA-N	0	3	333.501	3.021	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1ccoc1C(C)C	ZINC001177227852	1385875103	/nfs/dbraw/zinc/87/51/03/1385875103.db2.gz	AJPUPTXCDHZCMS-UHFFFAOYSA-N	0	3	329.238	3.021	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@H]1C[C@@H]1OCC	ZINC001177235908	1385879598	/nfs/dbraw/zinc/87/95/98/1385879598.db2.gz	PUNAFYJDZPKDDL-IRXDYDNUSA-N	0	3	342.911	3.162	20	30		EGEDHN
C=CCC1(C(=O)NCCCNCc2cccc(OCC)n2)CCCC1	ZINC001177552289	1385995148	/nfs/dbraw/zinc/99/51/48/1385995148.db2.gz	CUROMJQUAOZCCN-UHFFFAOYSA-N	0	3	345.487	3.213	20	30		EGEDHN
C=CCC[C@H](C(=O)NCCCNCc1ocnc1C)c1ccccc1	ZINC001177552491	1385995348	/nfs/dbraw/zinc/99/53/48/1385995348.db2.gz	IDASUIQYNXFCFX-SFHVURJKSA-N	0	3	341.455	3.329	20	30		EGEDHN
CCCCCC(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)[C@@H]1C	ZINC001178116950	1386134689	/nfs/dbraw/zinc/13/46/89/1386134689.db2.gz	UIWRWTCNEGVRRX-KSSFIOAISA-N	0	3	331.435	3.357	20	30		EGEDHN
CC(C)C#CC(=O)NCCCCCCNCc1csc(C2CC2)n1	ZINC001178423230	1386212936	/nfs/dbraw/zinc/21/29/36/1386212936.db2.gz	DTHCCSCXHKDTDO-UHFFFAOYSA-N	0	3	347.528	3.446	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@H](NCC#Cc2cccc(Cl)c2)[C@@H]1C)C1CC1	ZINC001178428188	1386214449	/nfs/dbraw/zinc/21/44/49/1386214449.db2.gz	ZHCXPJZBYOKIKS-VCBZYWHSSA-N	0	3	344.886	3.317	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2cccc(Cl)c2)CCN1C(=O)/C=C\C1CC1	ZINC001178432365	1386215169	/nfs/dbraw/zinc/21/51/69/1386215169.db2.gz	ZBWTVSHQKPXJFM-MTWVLMLHSA-N	0	3	342.870	3.237	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2cccc(Cl)c2)CCN1C(=O)[C@@H]1CC1(C)C	ZINC001178481169	1386230057	/nfs/dbraw/zinc/23/00/57/1386230057.db2.gz	JMVRKYTWOCQMIU-WBAXXEDZSA-N	0	3	344.886	3.317	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCCCCCN[C@@H](C)c1nnc(C)[nH]1	ZINC001178566939	1386250969	/nfs/dbraw/zinc/25/09/69/1386250969.db2.gz	JQUJEIWVWFBVNL-HNNXBMFYSA-N	0	3	347.507	3.209	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)c1[nH]ccc1C1CC1	ZINC001178859491	1386331218	/nfs/dbraw/zinc/33/12/18/1386331218.db2.gz	WGKMWSLPPSRJHB-JXFKEZNVSA-N	0	3	347.462	3.136	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cc(-c2ccccc2)no1)C(C)C	ZINC001319921415	1386392817	/nfs/dbraw/zinc/39/28/17/1386392817.db2.gz	GNEPASCCGWFGMZ-INIZCTEOSA-N	0	3	347.846	3.438	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](NCc2ccnc(Cl)c2)[C@@H]1C	ZINC001179314499	1386448736	/nfs/dbraw/zinc/44/87/36/1386448736.db2.gz	WJJHHWSZZYVNQL-RDJZCZTQSA-N	0	3	347.890	3.398	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCCCCCCNCc1cc2n(n1)CCC2	ZINC001179339255	1386455558	/nfs/dbraw/zinc/45/55/58/1386455558.db2.gz	AHUIFQDBPWWTLK-QGZVFWFLSA-N	0	3	346.519	3.198	20	30		EGEDHN
C=CCCCC(=O)NCCCCCCNCc1cn(C(C)(C)C)nn1	ZINC001179426031	1386481076	/nfs/dbraw/zinc/48/10/76/1386481076.db2.gz	NGMDJBVBXOAVNH-UHFFFAOYSA-N	0	3	349.523	3.156	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCCCCCN[C@H](C)c1nnc(C)[nH]1	ZINC001179481500	1386494556	/nfs/dbraw/zinc/49/45/56/1386494556.db2.gz	GOXJOJXKWNAXBY-KDOFPFPSSA-N	0	3	335.496	3.043	20	30		EGEDHN
CC#CC(=O)N(Cc1ccccc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC001179752661	1386572002	/nfs/dbraw/zinc/57/20/02/1386572002.db2.gz	ZOBKNGXWTAYJEI-NRFANRHFSA-N	0	3	332.447	3.313	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)CCCC(C)=O)CCCC[C@@H]1C	ZINC001698657347	1406307904	/nfs/dbraw/zinc/30/79/04/1406307904.db2.gz	QYIXGJFNWXTHKS-GUYCJALGSA-N	0	3	328.884	3.153	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)Cc2cncs2)CCCC[C@H]1C	ZINC001698662505	1406313481	/nfs/dbraw/zinc/31/34/81/1406313481.db2.gz	RWYMKFOSOGTLHG-MLGOLLRUSA-N	0	3	341.908	3.093	20	30		EGEDHN
CC[C@@H](F)C(=O)N1C[C@@H](C)[C@](C)(CNCc2cc(F)ccc2C#N)C1	ZINC001182208575	1387121004	/nfs/dbraw/zinc/12/10/04/1387121004.db2.gz	WPTJEJXKQWWYAW-OMWUSAIZSA-N	0	3	349.425	3.020	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)c1cc2ccccn2c1	ZINC001322259605	1387126319	/nfs/dbraw/zinc/12/63/19/1387126319.db2.gz	ZGRMZJMXFZYBJW-INIZCTEOSA-N	0	3	346.434	3.061	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)N1C[C@@H](C)[C@](C)(CNCc2ccccc2C#N)C1	ZINC001182275952	1387135709	/nfs/dbraw/zinc/13/57/09/1387135709.db2.gz	FKVBEWOWNOSAJD-XFQXTVEOSA-N	0	3	345.462	3.127	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)c1ccccc1Cl	ZINC001322284634	1387139701	/nfs/dbraw/zinc/13/97/01/1387139701.db2.gz	DMIPTVOZFAKZGB-AWEZNQCLSA-N	0	3	341.842	3.462	20	30		EGEDHN
C[C@@H](CN(C)Cc1cccc(C#N)c1)NC(=O)c1cc2ccccc2[nH]1	ZINC001322291408	1387143418	/nfs/dbraw/zinc/14/34/18/1387143418.db2.gz	ANFHTAVUMKPUQR-HNNXBMFYSA-N	0	3	346.434	3.290	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2nccs2)C1	ZINC001182306172	1387143437	/nfs/dbraw/zinc/14/34/37/1387143437.db2.gz	WARUNORZAKKDOZ-HDMKZQKVSA-N	0	3	335.517	3.320	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CC[C@@H](NCc2ccc(F)c(Cl)c2)C1	ZINC001182422949	1387163916	/nfs/dbraw/zinc/16/39/16/1387163916.db2.gz	JOHLRKSAUCDRCA-CQSZACIVSA-N	0	3	336.838	3.219	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](C)[C@](C)(CNCc3cc(C)no3)C2)CCC1	ZINC001182524460	1387182150	/nfs/dbraw/zinc/18/21/50/1387182150.db2.gz	KAMJGTWXULFHDQ-DNVCBOLYSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCCOCCCCC(=O)N1CC[C@@H](NCc2ccsc2)C1	ZINC001182530680	1387182722	/nfs/dbraw/zinc/18/27/22/1387182722.db2.gz	QHYGPQNEYRTQCW-QGZVFWFLSA-N	0	3	336.501	3.202	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2ccccc2C#N)C1	ZINC001182796123	1387225976	/nfs/dbraw/zinc/22/59/76/1387225976.db2.gz	IJXKRJKHAXUQBY-LLGFUMIMSA-N	0	3	341.499	3.425	20	30		EGEDHN
C[C@H](CNC(=O)c1ccc(Cl)o1)N(C)Cc1cccc(C#N)c1	ZINC001329386744	1389089947	/nfs/dbraw/zinc/08/99/47/1389089947.db2.gz	SSLJMKIOMCLOJI-GFCCVEGCSA-N	0	3	331.803	3.055	20	30		EGEDHN
C=Cc1ccc(C(=O)NC[C@H](C)N(C)Cc2ccc(C#N)cc2)cc1	ZINC001329562785	1389158896	/nfs/dbraw/zinc/15/88/96/1389158896.db2.gz	YUTMWWBNKXMNLR-INIZCTEOSA-N	0	3	333.435	3.452	20	30		EGEDHN
C[C@H](C#N)C(=O)NCc1ccc(CNCc2ccc(F)c(F)c2)cc1	ZINC001698718706	1406362930	/nfs/dbraw/zinc/36/29/30/1406362930.db2.gz	VODNNJBNWUYZQV-CYBMUJFWSA-N	0	3	343.377	3.030	20	30		EGEDHN
C[C@@H](NC[C@@H](O)COc1ccc(C#N)cc1)c1ccc(Cl)c(F)c1	ZINC001337222179	1389279929	/nfs/dbraw/zinc/27/99/29/1389279929.db2.gz	WSJIUMAPSYFYGI-IUODEOHRSA-N	0	3	348.805	3.441	20	30		EGEDHN
C[C@@H](CN(C)C(=O)C1CCCCC1)NCc1ccc(F)c(C#N)c1	ZINC001331368554	1389720343	/nfs/dbraw/zinc/72/03/43/1389720343.db2.gz	AQDLGBGJUWYKCC-AWEZNQCLSA-N	0	3	331.435	3.214	20	30		EGEDHN
CC(C)(C)[C@H](CNCc1cc(C#N)ccc1F)NC(=O)C(C)(C)F	ZINC001332755184	1390181433	/nfs/dbraw/zinc/18/14/33/1390181433.db2.gz	YPAZWIREIRAOQE-HNNXBMFYSA-N	0	3	337.414	3.066	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc(C)c(OCC2CCOCC2)c1	ZINC001340717516	1390352129	/nfs/dbraw/zinc/35/21/29/1390352129.db2.gz	PZBVMLCITRZEEP-SFHVURJKSA-N	0	3	346.471	3.423	20	30		EGEDHN
C=CCC1(O)CCN(Cc2sc(N3CCCCC3)nc2C)CC1	ZINC001334402722	1390533046	/nfs/dbraw/zinc/53/30/46/1390533046.db2.gz	QQCSOWDGVRHELK-UHFFFAOYSA-N	0	3	335.517	3.345	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)Nc1ccc2c(c1)CC(=O)N2C	ZINC001341928221	1390550772	/nfs/dbraw/zinc/55/07/72/1390550772.db2.gz	HVQBSXZDBGKYLW-INIZCTEOSA-N	0	3	331.460	3.222	20	30		EGEDHN
C=C(C)Cn1c(CCCCC#N)nnc1N1C[C@@H](C)N(CC)C[C@H]1C	ZINC001341940757	1390552410	/nfs/dbraw/zinc/55/24/10/1390552410.db2.gz	SFENYDQBQWXUQP-IAGOWNOFSA-N	0	3	344.507	3.009	20	30		EGEDHN
C=C(C)Cn1c(C2CC=CC2)nnc1N1CCN(C(C)(C)C)CC1	ZINC001342043936	1390565311	/nfs/dbraw/zinc/56/53/11/1390565311.db2.gz	QZHOPNQMSOITQF-UHFFFAOYSA-N	0	3	329.492	3.208	20	30		EGEDHN
N#Cc1ccc(C2CCN(C(=O)[C@@H](N)C3CCCCC3)CC2)cc1	ZINC001342869759	1390665639	/nfs/dbraw/zinc/66/56/39/1390665639.db2.gz	QSTDZSQQWWDQCH-IBGZPJMESA-N	0	3	325.456	3.172	20	30		EGEDHN
CCn1c([C@@H](C)CCC#N)nnc1N1CCN(C2CCCCC2)CC1	ZINC001342938954	1390675258	/nfs/dbraw/zinc/67/52/58/1390675258.db2.gz	DDFMWOJGRNUOBL-INIZCTEOSA-N	0	3	344.507	3.160	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N1CCC(c2nc3c(s2)CCCC3)CC1	ZINC001343722794	1390733203	/nfs/dbraw/zinc/73/32/03/1390733203.db2.gz	UHQIEGLCMPHCIW-OAHLLOKOSA-N	0	3	347.528	3.412	20	30		EGEDHN
C=CCC[C@H]1CCCN1c1nnc([C@H]2CCCN(C)C2)n1CC1CC1	ZINC001345100007	1390837151	/nfs/dbraw/zinc/83/71/51/1390837151.db2.gz	RVPYTEBBIIFRCH-ROUUACIJSA-N	0	3	343.519	3.432	20	30		EGEDHN
C[C@@H](NC[C@H](O)COc1ccccc1C#N)c1ccc(Cl)c(F)c1	ZINC001348423520	1391217272	/nfs/dbraw/zinc/21/72/72/1391217272.db2.gz	TXWGTLGAJAQUAB-DOMZBBRYSA-N	0	3	348.805	3.441	20	30		EGEDHN
Cc1ccsc1C(=O)N(C)[C@H](C)CNCc1ccc(F)c(C#N)c1	ZINC001698810465	1406496405	/nfs/dbraw/zinc/49/64/05/1406496405.db2.gz	FLBDUWJZWXFTRC-CYBMUJFWSA-N	0	3	345.443	3.318	20	30		EGEDHN
N#CC(C(=O)c1cn2c(n1)CCCC2)c1nc2c(cccc2Cl)[nH]1	ZINC001349760420	1391363511	/nfs/dbraw/zinc/36/35/11/1391363511.db2.gz	OAOWKSNZWNYATH-SNVBAGLBSA-N	0	3	339.786	3.239	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)N[C@@H](C)c1ccc2c(c1)CC(=O)N2	ZINC001353193217	1391956290	/nfs/dbraw/zinc/95/62/90/1391956290.db2.gz	TWNWGWYASSYDPF-WMLDXEAASA-N	0	3	345.487	3.436	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)NCc1cc(C(F)(F)F)cc(Cl)n1	ZINC001354569551	1392153256	/nfs/dbraw/zinc/15/32/56/1392153256.db2.gz	DMJBVTQRQIJYAZ-NSHDSACASA-N	0	3	335.757	3.054	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@@]2(C)CCc3ccccc3C2)C1	ZINC001479347189	1392221200	/nfs/dbraw/zinc/22/12/00/1392221200.db2.gz	LHMFRPOJFZTSLH-CVAIRZPRSA-N	0	3	346.902	3.419	20	30		EGEDHN
CC(C)(CC(=O)NC[C@H](NCc1ccc(C#N)s1)C1CC1)C1CC1	ZINC001480017662	1392537282	/nfs/dbraw/zinc/53/72/82/1392537282.db2.gz	MLMJIHRHOVQJLM-KRWDZBQOSA-N	0	3	345.512	3.430	20	30		EGEDHN
C=C(Br)CN[C@@H](C)CCNC(=O)c1ccoc1C1CC1	ZINC001480788898	1392933693	/nfs/dbraw/zinc/93/36/93/1392933693.db2.gz	XDVWNTCQQBQREF-NSHDSACASA-N	0	3	341.249	3.164	20	30		EGEDHN
Cc1ccc(F)c(C(=O)NCC[C@@H](C)NCc2ccccc2C#N)c1	ZINC001480794719	1392938295	/nfs/dbraw/zinc/93/82/95/1392938295.db2.gz	GEIXCFQYUOIJJN-OAHLLOKOSA-N	0	3	339.414	3.304	20	30		EGEDHN
CCN(CCNC(=O)c1cccc(F)c1C)Cc1ccc(C#N)cc1	ZINC001480978111	1393062833	/nfs/dbraw/zinc/06/28/33/1393062833.db2.gz	PPHHZUSBMDCOKQ-UHFFFAOYSA-N	0	3	339.414	3.258	20	30		EGEDHN
C[C@@H](C#N)C(=O)N(C)C1CCN(CCCc2ccccc2Cl)CC1	ZINC001490402813	1394215819	/nfs/dbraw/zinc/21/58/19/1394215819.db2.gz	WIZMYLIROINZBI-HNNXBMFYSA-N	0	3	347.890	3.355	20	30		EGEDHN
CC(C)n1cccc1C(=O)NC[C@H](C)CNCc1ccccc1C#N	ZINC001482170739	1394784854	/nfs/dbraw/zinc/78/48/54/1394784854.db2.gz	OAYMKJMIUHLKSL-MRXNPFEDSA-N	0	3	338.455	3.096	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)Cc1ccc(Cl)s1)C(C)C	ZINC001698972648	1406737649	/nfs/dbraw/zinc/73/76/49/1406737649.db2.gz	GLWYNVNEASLLGV-LBPRGKRZSA-N	0	3	335.300	3.427	20	30		EGEDHN
Cc1cc(C)c(C(=O)NC[C@H](C)N(C)Cc2ccc(C#N)cc2)s1	ZINC001485307125	1395784098	/nfs/dbraw/zinc/78/40/98/1395784098.db2.gz	QYRZKJXUXSJGRJ-AWEZNQCLSA-N	0	3	341.480	3.487	20	30		EGEDHN
Cc1ccc(F)cc1C(=O)NC[C@H](C)N(C)Cc1cccc(C#N)c1	ZINC001485334211	1395807032	/nfs/dbraw/zinc/80/70/32/1395807032.db2.gz	NGZLQXGPTIHDTC-HNNXBMFYSA-N	0	3	339.414	3.256	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)[C@H](CC)OCC)CC1	ZINC001505394869	1396282942	/nfs/dbraw/zinc/28/29/42/1396282942.db2.gz	RBGDQFDXFPSXHN-INIZCTEOSA-N	0	3	330.900	3.115	20	30		EGEDHN
CCN(CCNC(=O)c1cccc(C)c1C)Cc1ccc(C#N)cc1	ZINC001493054719	1396334746	/nfs/dbraw/zinc/33/47/46/1396334746.db2.gz	VLPJDNQFRMITNN-UHFFFAOYSA-N	0	3	335.451	3.427	20	30		EGEDHN
Cc1cccc(CC(=O)NC[C@H]2CCN(Cc3ccc(C#N)cc3)C2)c1	ZINC001493233215	1396338511	/nfs/dbraw/zinc/33/85/11/1396338511.db2.gz	JZQMZUKSAJIZDN-OAQYLSRUSA-N	0	3	347.462	3.048	20	30		EGEDHN
CCCC1(C(=O)NC[C@@H](NCc2cc(C#N)ccc2F)C2CC2)CC1	ZINC001690166749	1404365622	/nfs/dbraw/zinc/36/56/22/1404365622.db2.gz	KVMADMDBOOGKBX-GOSISDBHSA-N	0	3	343.446	3.262	20	30		EGEDHN
CCCC[C@](C)(F)C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001690281922	1404444839	/nfs/dbraw/zinc/44/48/39/1404444839.db2.gz	NDTPQMJSSAHKKK-BXWFABGCSA-N	0	3	349.425	3.353	20	30		EGEDHN
C[C@H](CNC(=O)C(C)(C)C1CCCC1)NCc1ccc(C#N)s1	ZINC001690586623	1404641162	/nfs/dbraw/zinc/64/11/62/1404641162.db2.gz	GVFHDAKFGTZKCR-CYBMUJFWSA-N	0	3	333.501	3.430	20	30		EGEDHN
Cc1cccc(C)c1C(=O)NC[C@@H](C)NCc1ccc(C#N)s1	ZINC001690624704	1404659278	/nfs/dbraw/zinc/65/92/78/1404659278.db2.gz	AVXNZNZYDRAMQK-CQSZACIVSA-N	0	3	327.453	3.145	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1cnoc1-c1ccccc1	ZINC001690871960	1404787700	/nfs/dbraw/zinc/78/77/00/1404787700.db2.gz	JTKGLQPFNLYPHB-CYBMUJFWSA-N	0	3	333.819	3.192	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@@H](CC)Cc2ccccc2)C1	ZINC001691742831	1405464176	/nfs/dbraw/zinc/46/41/76/1405464176.db2.gz	MCBVGQNQFIKFAL-OKZBNKHCSA-N	0	3	334.891	3.492	20	30		EGEDHN
C[C@H](C#N)C(=O)NC[C@H]1C[C@H](NCc2cc(Cl)ccc2Cl)C1	ZINC001691770892	1405482246	/nfs/dbraw/zinc/48/22/46/1405482246.db2.gz	MYYSXPAPGBVDLY-JTNHKYCSSA-N	0	3	340.254	3.137	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)C2(c3ccccc3F)CC2)C1	ZINC001691822050	1405538330	/nfs/dbraw/zinc/53/83/30/1405538330.db2.gz	YUUOHBSCSFCQMG-HDJSIYSDSA-N	0	3	336.838	3.094	20	30		EGEDHN
Cc1cc(C(=O)NCC[C@@H]2CCN(Cc3ccccc3C#N)C2)co1	ZINC001691884012	1405607922	/nfs/dbraw/zinc/60/79/22/1405607922.db2.gz	YTIKZDUDBHRIJZ-MRXNPFEDSA-N	0	3	337.423	3.102	20	30		EGEDHN
CC[C@H](CNC(=O)CC(C)(C)C1CC1)NCc1ccc(C#N)s1	ZINC001732199155	1428450103	/nfs/dbraw/zinc/45/01/03/1428450103.db2.gz	WZMXRHCLKSDCHY-CQSZACIVSA-N	0	3	333.501	3.430	20	30		EGEDHN
C=C(Br)CNCC1(NC(=O)c2coc(C)c2)CCCC1	ZINC001732229166	1428476590	/nfs/dbraw/zinc/47/65/90/1428476590.db2.gz	QCERSPPOVVYTAC-UHFFFAOYSA-N	0	3	341.249	3.129	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)C(C)(C)C1CCC1	ZINC001732356667	1428546479	/nfs/dbraw/zinc/54/64/79/1428546479.db2.gz	UZNSZNIIBPAZTJ-OAHLLOKOSA-N	0	3	327.472	3.226	20	30		EGEDHN
CC(C)n1cccc1C(=O)N(C)[C@H](C)CNCc1ccc(C#N)s1	ZINC001732454669	1428588938	/nfs/dbraw/zinc/58/89/38/1428588938.db2.gz	PNUMATVXSUCCOH-CQSZACIVSA-N	0	3	344.484	3.252	20	30		EGEDHN
CC(C)[C@H](CNC(=O)CC1(C)CC1)NCc1ccc(C#N)cc1F	ZINC001732562826	1428753448	/nfs/dbraw/zinc/75/34/48/1428753448.db2.gz	ZQVNPQKAPULTEI-KRWDZBQOSA-N	0	3	331.435	3.118	20	30		EGEDHN
C[C@@H](CNC(=O)C1CCC2(CC2)CC1)N(C)Cc1ccc(C#N)cc1	ZINC001700465746	1414073370	/nfs/dbraw/zinc/07/33/70/1414073370.db2.gz	FVXGTBGHFZESIK-INIZCTEOSA-N	0	3	339.483	3.465	20	30		EGEDHN
CCCCC(=O)N1CC2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001700612581	1414277344	/nfs/dbraw/zinc/27/73/44/1414277344.db2.gz	AQJDHQQOSXOMKV-UHFFFAOYSA-N	0	3	325.456	3.173	20	30		EGEDHN
CC[C@@H](C)CC(=O)NC[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001707083117	1417191022	/nfs/dbraw/zinc/19/10/22/1417191022.db2.gz	KTVMTCOSPTVEJV-FRFSOERESA-N	0	3	331.435	3.118	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)C1CCC2(CC2)CC1	ZINC001733042449	1429172344	/nfs/dbraw/zinc/17/23/44/1429172344.db2.gz	JBYJKPVWRRUCGZ-INIZCTEOSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC(C)C#CC(=O)N1CCCC[C@@H]1CNCc1cc(F)cc(F)c1	ZINC001713263046	1417870957	/nfs/dbraw/zinc/87/09/57/1417870957.db2.gz	ZUEVVWTXEDGXLU-GOSISDBHSA-N	0	3	334.410	3.095	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1CCC[C@H](NC(=O)CC(F)(F)F)C1	ZINC001713369636	1417981797	/nfs/dbraw/zinc/98/17/97/1417981797.db2.gz	UJVYPXVZJNLVFT-GJZGRUSLSA-N	0	3	339.361	3.028	20	30		EGEDHN
CCN(CCNC(=O)c1ccc(C)c(C)c1)Cc1cccc(C#N)c1	ZINC001713497235	1418208907	/nfs/dbraw/zinc/20/89/07/1418208907.db2.gz	YRODEFYYFLRZHD-UHFFFAOYSA-N	0	3	335.451	3.427	20	30		EGEDHN
C=CCN[C@@H](CNC(=O)C[C@H]1CCOC1)c1ccc(C(C)C)cc1	ZINC001713697848	1418453132	/nfs/dbraw/zinc/45/31/32/1418453132.db2.gz	JFFCMYKBKPRCHE-APWZRJJASA-N	0	3	330.472	3.170	20	30		EGEDHN
CC(C)Oc1cccc(CN2CCC(N(C)C(=O)[C@@H](C)C#N)CC2)c1	ZINC001713777775	1418593777	/nfs/dbraw/zinc/59/37/77/1418593777.db2.gz	ZTTAWHUSRAFGGE-INIZCTEOSA-N	0	3	343.471	3.056	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2CCCN(CCC[C@@H](C)O)C2)CCCCC1	ZINC001713804830	1418617672	/nfs/dbraw/zinc/61/76/72/1418617672.db2.gz	AWEYBETWMKVOMK-MSOLQXFVSA-N	0	3	336.520	3.255	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1CCN(Cc2cccc3c2CCOC3)C1	ZINC001713951091	1418735077	/nfs/dbraw/zinc/73/50/77/1418735077.db2.gz	RFWLFVOXDQPBJN-SFHVURJKSA-N	0	3	342.483	3.052	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)[C@@H](F)Cc2ccccc2)CCCC1	ZINC001714152722	1418959507	/nfs/dbraw/zinc/95/95/07/1418959507.db2.gz	ZEYCNTZXAUESTE-INIZCTEOSA-N	0	3	338.854	3.338	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)[C@H](F)Cc2ccccc2)CCCC1	ZINC001714152723	1418959836	/nfs/dbraw/zinc/95/98/36/1418959836.db2.gz	ZEYCNTZXAUESTE-MRXNPFEDSA-N	0	3	338.854	3.338	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1ccnc(C2CC2)c1)C1CC1	ZINC001714167328	1418976328	/nfs/dbraw/zinc/97/63/28/1418976328.db2.gz	QEGRVMKMCCKTDJ-GOSISDBHSA-N	0	3	333.863	3.200	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2cc(C)no2)CCCC[C@@H]1C	ZINC001714177193	1418984649	/nfs/dbraw/zinc/98/46/49/1418984649.db2.gz	DHOOYQBXWDGJGH-MEDUHNTESA-N	0	3	325.840	3.004	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)CCC3CC3)CCCC2)c(F)c1	ZINC001714491197	1419214696	/nfs/dbraw/zinc/21/46/96/1419214696.db2.gz	YITAJDOOQJQFLN-UHFFFAOYSA-N	0	3	343.446	3.406	20	30		EGEDHN
CCN(CCNC(=O)C1CC2(CCC2)C1)Cc1cccc(C#N)c1	ZINC001714591050	1419338071	/nfs/dbraw/zinc/33/80/71/1419338071.db2.gz	LMDOEWWBADQQQH-UHFFFAOYSA-N	0	3	325.456	3.077	20	30		EGEDHN
CCCC1(C(=O)N(C)[C@H](C)CNCc2cc(C#N)ccc2OC)CC1	ZINC001714747675	1419492218	/nfs/dbraw/zinc/49/22/18/1419492218.db2.gz	OMGJCIWTEZMPJK-OAHLLOKOSA-N	0	3	343.471	3.084	20	30		EGEDHN
CCC(C)(C)C(=O)NCC[C@@H]1CCN(Cc2ccccc2C#N)C1	ZINC001714873619	1419606657	/nfs/dbraw/zinc/60/66/57/1419606657.db2.gz	BRKBMPMWAOUSNX-MRXNPFEDSA-N	0	3	327.472	3.323	20	30		EGEDHN
CC(C)C[C@H](CNCc1ccc(C#N)s1)NC(=O)c1cncs1	ZINC001714905809	1419648647	/nfs/dbraw/zinc/64/86/47/1419648647.db2.gz	LPHJQKLKBQXYBT-GFCCVEGCSA-N	0	3	348.497	3.011	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2oc(C)nc2C)CCCC[C@@H]1C	ZINC001715126632	1419872998	/nfs/dbraw/zinc/87/29/98/1419872998.db2.gz	CHLNFRPLWDMDTG-APPDUMDISA-N	0	3	339.867	3.312	20	30		EGEDHN
Cc1ccc(F)cc1CNCc1ccc(CNC(=O)[C@@H](C)C#N)cc1	ZINC001715195941	1419927924	/nfs/dbraw/zinc/92/79/24/1419927924.db2.gz	WXZCXECJDPEHNB-HNNXBMFYSA-N	0	3	339.414	3.200	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCC1(NCc2cc(Cl)ccc2F)CCCC1	ZINC001715294950	1420002491	/nfs/dbraw/zinc/00/24/91/1420002491.db2.gz	IJOCCCOFHRJWJK-LBPRGKRZSA-N	0	3	337.826	3.157	20	30		EGEDHN
CCc1sc(C(=O)N[C@H](C)CNCc2ccc(C#N)s2)cc1C	ZINC001716422865	1420650449	/nfs/dbraw/zinc/65/04/49/1420650449.db2.gz	SLMKYQGXVXMQRY-GFCCVEGCSA-N	0	3	347.509	3.460	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H](C)CN(C)Cc2cccc(C#N)c2)ccc1F	ZINC001716492854	1420714635	/nfs/dbraw/zinc/71/46/35/1420714635.db2.gz	XNGPFCDPASDNNC-HNNXBMFYSA-N	0	3	339.414	3.256	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)c1cc2ccccc2[nH]1	ZINC001716504195	1420734907	/nfs/dbraw/zinc/73/49/07/1420734907.db2.gz	HHKUURLNOOLCJR-OAHLLOKOSA-N	0	3	346.434	3.290	20	30		EGEDHN
C[C@@]1(CNCc2ccccc2C#N)CCN(C(=O)CCC2CC2)C1	ZINC001716860395	1420990780	/nfs/dbraw/zinc/99/07/80/1420990780.db2.gz	KJQDJHKLPLBBEG-FQEVSTJZSA-N	0	3	325.456	3.077	20	30		EGEDHN
CCC1(C(=O)NC[C@]2(C)CCCN(Cc3ccc(C#N)cc3)C2)CC1	ZINC001716899625	1421028988	/nfs/dbraw/zinc/02/89/88/1421028988.db2.gz	OKNKDWUQPPCLSM-FQEVSTJZSA-N	0	3	339.483	3.467	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)c3cccc(F)c3)CCC2)s1	ZINC001717146959	1421139191	/nfs/dbraw/zinc/13/91/91/1421139191.db2.gz	ZLHGTMNPMYXOAJ-UHFFFAOYSA-N	0	3	343.427	3.201	20	30		EGEDHN
CCCCC(=O)N1CC[C@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001733294042	1429475502	/nfs/dbraw/zinc/47/55/02/1429475502.db2.gz	MXLRCWOMJNZULI-FQEVSTJZSA-N	0	3	325.456	3.173	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)CCc1c(C)noc1C	ZINC001717460128	1421389651	/nfs/dbraw/zinc/38/96/51/1421389651.db2.gz	AZWIVYGLCJUSRA-UHFFFAOYSA-N	0	3	341.883	3.051	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCC1(C)CCN(Cc2ccc(Cl)cc2)CC1	ZINC001733445947	1429655276	/nfs/dbraw/zinc/65/52/76/1429655276.db2.gz	IBFJBRNQJQVRJR-AWEZNQCLSA-N	0	3	333.863	3.218	20	30		EGEDHN
C[C@H](CNC(=O)c1cccc(Cl)c1)N(C)Cc1ccc(C#N)cc1	ZINC001725191769	1425737219	/nfs/dbraw/zinc/73/72/19/1425737219.db2.gz	YSOKGTDVXJRLBG-CQSZACIVSA-N	0	3	341.842	3.462	20	30		EGEDHN
CCC[C@H](CC)C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2OC)C1	ZINC001731454420	1427430722	/nfs/dbraw/zinc/43/07/22/1427430722.db2.gz	ACEJLMALZGNCHI-SZMVWBNQSA-N	0	3	343.471	3.130	20	30		EGEDHN
Cc1ccc(C)c(C(=O)NC[C@@H](C)NCc2ccc(C#N)s2)c1	ZINC001731633630	1427687557	/nfs/dbraw/zinc/68/75/57/1427687557.db2.gz	KXWGTAYIQAPUKF-CQSZACIVSA-N	0	3	327.453	3.145	20	30		EGEDHN
Cc1ccc(C)c(C(=O)NC[C@@H](C)N(C)Cc2ccc(C#N)cc2)c1	ZINC001734059022	1437851094	/nfs/dbraw/zinc/85/10/94/1437851094.db2.gz	MASYHPOZMYZRDN-QGZVFWFLSA-N	0	3	335.451	3.425	20	30		EGEDHN
CN(CCCNC(=O)CCC(C)(F)F)Cc1ccc(F)c(C#N)c1	ZINC001752005709	1440132281	/nfs/dbraw/zinc/13/22/81/1440132281.db2.gz	YLEQFPRZGCXJDH-UHFFFAOYSA-N	0	3	341.377	3.071	20	30		EGEDHN
C[C@H](C(=O)NCCCN(C)Cc1ccc(C#N)c(F)c1)C(C)(C)C	ZINC001752014078	1440132501	/nfs/dbraw/zinc/13/25/01/1440132501.db2.gz	HDGONDYOSPJHJW-CQSZACIVSA-N	0	3	333.451	3.318	20	30		EGEDHN
C=C(Br)CN[C@H](C)[C@H]1CCCCN1C(=O)CC1(C)CC1	ZINC001752142844	1440145046	/nfs/dbraw/zinc/14/50/46/1440145046.db2.gz	KGRXVDIBEHWDKE-ZIAGYGMSSA-N	0	3	343.309	3.444	20	30		EGEDHN
C[C@H](NCC#Cc1ccccc1)[C@@H]1CCCCN1C(=O)CCCF	ZINC001752144527	1440145363	/nfs/dbraw/zinc/14/53/63/1440145363.db2.gz	QRHNVLFTWQIBRX-HKUYNNGSSA-N	0	3	330.447	3.147	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCCC[C@@H]1[C@@H](C)NCc1cn(C)nc1C	ZINC001752146575	1440146090	/nfs/dbraw/zinc/14/60/90/1440146090.db2.gz	NDMLZSLUPAUFEC-SJLPKXTDSA-N	0	3	346.519	3.190	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N(CCC)C1CCN(CC(=C)C)CC1	ZINC001752441636	1440181405	/nfs/dbraw/zinc/18/14/05/1440181405.db2.gz	IQJUFQACXLSNKE-UHFFFAOYSA-N	0	3	338.495	3.490	20	30		EGEDHN
C=CCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)COc1ccc(C)c(C)c1	ZINC001752544523	1440195006	/nfs/dbraw/zinc/19/50/06/1440195006.db2.gz	AUXZGLSHXAXHET-KDURUIRLSA-N	0	3	342.483	3.324	20	30		EGEDHN
CCCC[C@](C)(F)C(=O)N[C@H]1C[C@H](NCC#Cc2ccccc2)C1	ZINC001752639256	1440197497	/nfs/dbraw/zinc/19/74/97/1440197497.db2.gz	JIJXIBGBTRZAKB-BJLQDIEVSA-N	0	3	330.447	3.193	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1C[C@H](NCc2cccc(OC)c2Cl)C1	ZINC001752650003	1440197859	/nfs/dbraw/zinc/19/78/59/1440197859.db2.gz	AKGCAUORNKICEN-HDJSIYSDSA-N	0	3	336.863	3.298	20	30		EGEDHN
CCc1ccsc1C(=O)N[C@H]1C[C@H](NCC#Cc2ccccc2)C1	ZINC001752686811	1440199979	/nfs/dbraw/zinc/19/99/79/1440199979.db2.gz	BKJOJGVQXIDXEN-IYARVYRRSA-N	0	3	338.476	3.213	20	30		EGEDHN
CC(C)(C)C1CC(C(=O)N[C@H]2C[C@@H](NCC#Cc3ccccc3)C2)C1	ZINC001752775639	1440206749	/nfs/dbraw/zinc/20/67/49/1440206749.db2.gz	QOPQWLGKHLQDOA-KHSMEXAKSA-N	0	3	338.495	3.347	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@H]1CCCN(Cc2ncccc2C)C1	ZINC001752785734	1440211205	/nfs/dbraw/zinc/21/12/05/1440211205.db2.gz	DFKAAHDTZGSYEG-QZTJIDSGSA-N	0	3	329.488	3.321	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)C1(c2cccc(Cl)c2)CC1	ZINC001752821002	1440220386	/nfs/dbraw/zinc/22/03/86/1440220386.db2.gz	JMDLOHIQUTXKPH-GOSISDBHSA-N	0	3	344.886	3.366	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)Cc1noc2ccc(F)cc12	ZINC001752824503	1440222624	/nfs/dbraw/zinc/22/26/24/1440222624.db2.gz	YQRSGXMWJUCGCA-HNNXBMFYSA-N	0	3	345.418	3.056	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@H](C)c1cccc(OC)c1	ZINC001752825123	1440223308	/nfs/dbraw/zinc/22/33/08/1440223308.db2.gz	LWMNALBVCGUFEB-AEFFLSMTSA-N	0	3	330.472	3.346	20	30		EGEDHN
N#Cc1ccccc1CNC1CCC(NC(=O)C2(CF)CCC2)CC1	ZINC001752852781	1440233933	/nfs/dbraw/zinc/23/39/33/1440233933.db2.gz	QAFYRKKVIOWRBA-UHFFFAOYSA-N	0	3	343.446	3.215	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](CNCc2ccccc2C#N)C1	ZINC001752942006	1440251046	/nfs/dbraw/zinc/25/10/46/1440251046.db2.gz	VDTGKPLTTTWXPG-QGZVFWFLSA-N	0	3	337.467	3.265	20	30		EGEDHN
C[C@H](CCNC(=O)C#CC(C)(C)C)N[C@H](C)c1nc2ccccc2o1	ZINC001753005292	1440265611	/nfs/dbraw/zinc/26/56/11/1440265611.db2.gz	IIKWPAZPQRZVJW-HUUCEWRRSA-N	0	3	341.455	3.423	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1cccc(-c2cnco2)c1	ZINC001753017735	1440268857	/nfs/dbraw/zinc/26/88/57/1440268857.db2.gz	XQIKJFXLMMZQSL-CYBMUJFWSA-N	0	3	333.819	3.192	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1CCCNC(=O)c1cc(OC)cs1	ZINC001753032858	1440273500	/nfs/dbraw/zinc/27/35/00/1440273500.db2.gz	YXYSWHYHAOLOBK-ZDUSSCGKSA-N	0	3	342.892	3.484	20	30		EGEDHN
C[C@H](c1ccc(CN(C)CCNC(=O)[C@@H](C)C#N)cc1)C(F)(F)F	ZINC001753043659	1440277240	/nfs/dbraw/zinc/27/72/40/1440277240.db2.gz	HVJZKZHLFNOFEL-QWHCGFSZSA-N	0	3	341.377	3.060	20	30		EGEDHN
C=C[C@@](C)(O)CC(=O)NCCN(CC)[C@H](C)c1ccc(Cl)cc1	ZINC001753080690	1440293459	/nfs/dbraw/zinc/29/34/59/1440293459.db2.gz	FJDREJONNXSMPG-RDTXWAMCSA-N	0	3	338.879	3.166	20	30		EGEDHN
CCN(CCNC(=O)[C@H]1CCCC[C@H]1C)Cc1ccc(C#N)cc1	ZINC001753087442	1440296981	/nfs/dbraw/zinc/29/69/81/1440296981.db2.gz	FXOLPSKYDXLYDN-APWZRJJASA-N	0	3	327.472	3.323	20	30		EGEDHN
CCc1ccsc1C(=O)NCCN(CC)Cc1ccc(C#N)cc1	ZINC001753094983	1440301879	/nfs/dbraw/zinc/30/18/79/1440301879.db2.gz	LGORPBJUQWBUHQ-UHFFFAOYSA-N	0	3	341.480	3.434	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NC[C@@H]1CCN(Cc2ccccc2F)C1)OCC	ZINC001753129555	1440316140	/nfs/dbraw/zinc/31/61/40/1440316140.db2.gz	OLHCHLSNYBNPHQ-QFBILLFUSA-N	0	3	348.462	3.135	20	30		EGEDHN
C[C@@H](NCCN(C)C(=O)c1c[nH]c(C#N)c1)c1ccc(F)c(Cl)c1	ZINC001753181639	1440336925	/nfs/dbraw/zinc/33/69/25/1440336925.db2.gz	QEGRZYOVFDZOSC-LLVKDONJSA-N	0	3	348.809	3.102	20	30		EGEDHN
CN(CCNCc1ccc(C#N)c(F)c1)C(=O)[C@@H]1CCC=CCCC1	ZINC001753202430	1440338419	/nfs/dbraw/zinc/33/84/19/1440338419.db2.gz	DILXPLNVFCDBFD-QGZVFWFLSA-N	0	3	343.446	3.382	20	30		EGEDHN
C#CCCCC(=O)N1C[C@H]2CC[C@@H](C1)N2[C@H]1CCc2ccc(F)cc21	ZINC001753305864	1440355396	/nfs/dbraw/zinc/35/53/96/1440355396.db2.gz	VBOCMSZZSRWHTG-NSHGMRRFSA-N	0	3	340.442	3.292	20	30		EGEDHN
C=CCOCCN1CC[C@@H](N(CCC)C(=O)c2ccsc2C)C1	ZINC001753316661	1440359996	/nfs/dbraw/zinc/35/99/96/1440359996.db2.gz	XNDFOBYATMASAP-MRXNPFEDSA-N	0	3	336.501	3.186	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NCC1CN(Cc2cc(C)ccc2C)C1	ZINC001753407649	1440392400	/nfs/dbraw/zinc/39/24/00/1440392400.db2.gz	RPBRUDOALZOMIT-OAQYLSRUSA-N	0	3	344.499	3.080	20	30		EGEDHN
C=CCOCC(=O)N(CC)[C@H]1CCN(Cc2ccc(C(C)C)cc2)C1	ZINC001753452666	1440406681	/nfs/dbraw/zinc/40/66/81/1440406681.db2.gz	CLLNJPBFPMYQTA-FQEVSTJZSA-N	0	3	344.499	3.435	20	30		EGEDHN
CCN(C(=O)[C@@H](C)C#N)[C@@H]1CCN(CCCc2ccccc2Cl)C1	ZINC001753453816	1440407217	/nfs/dbraw/zinc/40/72/17/1440407217.db2.gz	XWNHLBKRULESBS-DOTOQJQBSA-N	0	3	347.890	3.355	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)Cc2csc(C(C)(C)C)n2)C1	ZINC001753459754	1440409867	/nfs/dbraw/zinc/40/98/67/1440409867.db2.gz	SVAFXKMBLTVPFO-INIZCTEOSA-N	0	3	349.544	3.482	20	30		EGEDHN
C=CCN1CC[C@H](N(CC)C(=O)Cc2c[nH]c3cc(C)ccc23)C1	ZINC001753459934	1440409917	/nfs/dbraw/zinc/40/99/17/1440409917.db2.gz	VRTKGSYQINZCFQ-KRWDZBQOSA-N	0	3	325.456	3.128	20	30		EGEDHN
CC[C@H](CNC(=O)c1occc1C)NCC#Cc1ccc(Cl)cc1	ZINC001753465553	1440412644	/nfs/dbraw/zinc/41/26/44/1440412644.db2.gz	CBSUNAARRGLOCK-QGZVFWFLSA-N	0	3	344.842	3.391	20	30		EGEDHN
CC[C@@H](CNC(=O)[C@@H](C)C1CCCC1)NCC#Cc1ccc(F)cc1	ZINC001753492426	1440419936	/nfs/dbraw/zinc/41/99/36/1440419936.db2.gz	NKOUVQUFBMPKTJ-JXFKEZNVSA-N	0	3	344.474	3.488	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@](C)(CNCc1ccncc1Cl)C1CC1	ZINC001753518391	1440428098	/nfs/dbraw/zinc/42/80/98/1440428098.db2.gz	HGLMCSKJLKJZIV-SFHVURJKSA-N	0	3	335.879	3.466	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CC[C@H](NCc2cc(F)ccc2C#N)CC1	ZINC001753583071	1440440497	/nfs/dbraw/zinc/44/04/97/1440440497.db2.gz	WIYQAQSTEMMKHE-WGSAOQKQSA-N	0	3	341.430	3.018	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCC1(NCc2cccc(F)c2Cl)CCCC1	ZINC001753661377	1440458813	/nfs/dbraw/zinc/45/88/13/1440458813.db2.gz	ITOZTKBZQIHCNR-LBPRGKRZSA-N	0	3	337.826	3.157	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H](CC)OC2CCCC2)CCCC1	ZINC001753669007	1440461254	/nfs/dbraw/zinc/46/12/54/1440461254.db2.gz	AYUJMZBQOKUEDT-MRXNPFEDSA-N	0	3	342.911	3.495	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)C[C@H](C)C2CC2)CCCC1	ZINC001753671143	1440462261	/nfs/dbraw/zinc/46/22/61/1440462261.db2.gz	SDRFLBSHXBJSMQ-LBPRGKRZSA-N	0	3	343.309	3.350	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccc(Cl)cc1)N(C)C(=O)CC(F)(F)F	ZINC001753680659	1440464589	/nfs/dbraw/zinc/46/45/89/1440464589.db2.gz	JTDXTUABKZNZHC-LBPRGKRZSA-N	0	3	346.780	3.080	20	30		EGEDHN
C[C@@H](CNCC#Cc1cccc(Cl)c1)N(C)C(=O)[C@@H]1CC1(C)C	ZINC001753685653	1440465498	/nfs/dbraw/zinc/46/54/98/1440465498.db2.gz	NYNAFPNBJDCQBE-YOEHRIQHSA-N	0	3	332.875	3.174	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)N(C)C(=O)C(C)(C)C(F)(F)F	ZINC001753723140	1440473595	/nfs/dbraw/zinc/47/35/95/1440473595.db2.gz	GBNTZLOMJXKECS-SNVBAGLBSA-N	0	3	347.406	3.145	20	30		EGEDHN
Cc1ccc(C(=O)N(C)[C@H](C)CNCC#Cc2ccc(F)cc2)cc1	ZINC001753723224	1440473763	/nfs/dbraw/zinc/47/37/63/1440473763.db2.gz	HQDDYJYCVUJNHQ-QGZVFWFLSA-N	0	3	338.426	3.236	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](NC(=O)C2CC2)C2CCCCC2)c(F)c1	ZINC001753743038	1440479930	/nfs/dbraw/zinc/47/99/30/1440479930.db2.gz	DTCQJVSVXRWCIV-IBGZPJMESA-N	0	3	343.446	3.262	20	30		EGEDHN
O=C(CC#Cc1ccccc1)N[C@@H](CNCCF)C1CCCCC1	ZINC001753748964	1440481969	/nfs/dbraw/zinc/48/19/69/1440481969.db2.gz	BDAREGQTLHJATF-IBGZPJMESA-N	0	3	330.447	3.052	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@H]([C@@H](C)NCc2ccn(CC)n2)C1	ZINC001753799729	1440490538	/nfs/dbraw/zinc/49/05/38/1440490538.db2.gz	QGKHZPDYOUGTSU-SJORKVTESA-N	0	3	346.519	3.222	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H](C)[C@@H]1CNCc1c(C)nsc1C	ZINC001753818970	1440495041	/nfs/dbraw/zinc/49/50/41/1440495041.db2.gz	OEEODBGNDFHMFC-KDOFPFPSSA-N	0	3	347.528	3.280	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cccc2cccnc21)C(C)C	ZINC001753833894	1440500241	/nfs/dbraw/zinc/50/02/41/1440500241.db2.gz	GJWFMWPEXZHADS-INIZCTEOSA-N	0	3	331.847	3.331	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)CCC(C)(F)F)NCC#Cc1ccccc1	ZINC001753835407	1440500840	/nfs/dbraw/zinc/50/08/40/1440500840.db2.gz	RQANPFCPUKAPDR-QGZVFWFLSA-N	0	3	336.426	3.204	20	30		EGEDHN
C=C(Br)CN[C@H](CNC(=O)CC1CC(C)(C)C1)C(C)C	ZINC001753837368	1440501587	/nfs/dbraw/zinc/50/15/87/1440501587.db2.gz	LTWABTNDALHOJH-CQSZACIVSA-N	0	3	345.325	3.452	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1c(F)cc(F)cc1F)C(C)C	ZINC001753838860	1440501928	/nfs/dbraw/zinc/50/19/28/1440501928.db2.gz	VOGZZUDORFKNSX-ZDUSSCGKSA-N	0	3	334.769	3.200	20	30		EGEDHN
C[C@H](C#N)C(=O)N(C)CCN(C)CCc1cc(Cl)ccc1Cl	ZINC001753850068	1440506098	/nfs/dbraw/zinc/50/60/98/1440506098.db2.gz	QUSFOVOYZLCDEG-GFCCVEGCSA-N	0	3	342.270	3.086	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1CCC[C@H]1CNCc1nc(C)cs1	ZINC001753883886	1440520908	/nfs/dbraw/zinc/52/09/08/1440520908.db2.gz	BIARMVPOURRKRN-HOTGVXAUSA-N	0	3	333.501	3.020	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1CCC[C@H]1CNCc1nc(C)sc1C	ZINC001753887433	1440521412	/nfs/dbraw/zinc/52/14/12/1440521412.db2.gz	JHEMUCWDYNCCGA-HOTGVXAUSA-N	0	3	335.517	3.491	20	30		EGEDHN
CC(C)c1ccoc1C(=O)NC/C=C/CNCc1ccc(C#N)cc1	ZINC001754162561	1440546207	/nfs/dbraw/zinc/54/62/07/1440546207.db2.gz	XXXJJMLRAXSWFT-ONEGZZNKSA-N	0	3	337.423	3.350	20	30		EGEDHN
CC(C)c1ccc(C(=O)NC/C=C\CNCc2cccc(C#N)c2)nc1	ZINC001754173596	1440547340	/nfs/dbraw/zinc/54/73/40/1440547340.db2.gz	OLOWIEJBORZOSK-ARJAWSKDSA-N	0	3	348.450	3.152	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)c(F)c1)NC(=O)[C@H]1CCCC2(CC2)C1	ZINC001754267332	1440560884	/nfs/dbraw/zinc/56/08/84/1440560884.db2.gz	FYPVJJLXYIDNSS-HOCLYGCPSA-N	0	3	343.446	3.262	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H](C)CNCc2cc(C)ns2)CCCCC1	ZINC001754298117	1440566898	/nfs/dbraw/zinc/56/68/98/1440566898.db2.gz	ZMSPPSRPUDSICC-HNNXBMFYSA-N	0	3	333.501	3.020	20	30		EGEDHN
C=C(Cl)CNCCCN(C)C(=O)[C@]1(C)CCc2ccccc2C1	ZINC001754419860	1440597165	/nfs/dbraw/zinc/59/71/65/1440597165.db2.gz	XMYMXVINIWUHEI-LJQANCHMSA-N	0	3	334.891	3.372	20	30		EGEDHN
CCC[C@H](C)C(=O)N[C@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001754436299	1440598154	/nfs/dbraw/zinc/59/81/54/1440598154.db2.gz	SVIUIHCIBZRLIW-SCLBCKFNSA-N	0	3	331.435	3.118	20	30		EGEDHN
C[C@@H](C(=O)N[C@H](CNCC#Cc1cccc(Cl)c1)C1CC1)C1CC1	ZINC001754437215	1440598361	/nfs/dbraw/zinc/59/83/61/1440598361.db2.gz	IKHQEACJYFPJCX-AUUYWEPGSA-N	0	3	344.886	3.222	20	30		EGEDHN
CCCCCCCN1CC[C@@H]1CNC(=O)c1cnn2ccc(C)cc12	ZINC001754485716	1440608577	/nfs/dbraw/zinc/60/85/77/1440608577.db2.gz	ALXLGRMFBGZPOE-QGZVFWFLSA-N	0	3	342.487	3.417	20	30		EGEDHN
CCCCCCCN1CC[C@@H]1CNC(=O)[C@H]1Cc2cc(F)ccc2O1	ZINC001754495022	1440611671	/nfs/dbraw/zinc/61/16/71/1440611671.db2.gz	CVWIJCKMIHUTOT-IEBWSBKVSA-N	0	3	348.462	3.290	20	30		EGEDHN
CCCCCCCN1CC[C@H]1CNC(=O)c1ccc2c(c1)COC2	ZINC001754497573	1440612697	/nfs/dbraw/zinc/61/26/97/1440612697.db2.gz	NSORQQGAOZKXPE-IBGZPJMESA-N	0	3	330.472	3.491	20	30		EGEDHN
C=CCC[C@H](C)N1CC[C@@H]1CNC(=O)c1occc1Br	ZINC001754498194	1440613032	/nfs/dbraw/zinc/61/30/32/1440613032.db2.gz	UVYBJSHECMCYJS-NWDGAFQWSA-N	0	3	341.249	3.201	20	30		EGEDHN
CCCCCCCN1CC[C@@H]1CNC(=O)c1cccc2[nH]cnc21	ZINC001754498626	1440613266	/nfs/dbraw/zinc/61/32/66/1440613266.db2.gz	YDFNVOAYZGGLHH-OAHLLOKOSA-N	0	3	328.460	3.337	20	30		EGEDHN
CCc1ccc(C(=O)NCC2(NCc3ccc(C#N)cc3)CC2)s1	ZINC001754519178	1440619284	/nfs/dbraw/zinc/61/92/84/1440619284.db2.gz	BMJIWQRRWCYWAX-UHFFFAOYSA-N	0	3	339.464	3.234	20	30		EGEDHN
C=CCOCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)CC(C)(C)C1CC1	ZINC001754542428	1440626396	/nfs/dbraw/zinc/62/63/96/1440626396.db2.gz	PYDLDZFMLQBTRT-MSOLQXFVSA-N	0	3	334.504	3.081	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)CCCc3ccccc3Cl)C2)C1	ZINC001754564549	1440634996	/nfs/dbraw/zinc/63/49/96/1440634996.db2.gz	GMAUELGFIJIDQL-HXUWFJFHSA-N	0	3	344.886	3.220	20	30		EGEDHN
O=C(C1CC=CC1)N1CCC[C@H]1CNCC#Cc1cccc(Cl)c1	ZINC001754606749	1440643390	/nfs/dbraw/zinc/64/33/90/1440643390.db2.gz	BYEDAPHFGACOHR-IBGZPJMESA-N	0	3	342.870	3.238	20	30		EGEDHN
C#CCN(C(=O)[C@@H]1CC[C@H](C)C1)C1CCN(CCOCC(C)C)CC1	ZINC001754640965	1440649173	/nfs/dbraw/zinc/64/91/73/1440649173.db2.gz	KURHNNMDVKFACE-RBUKOAKNSA-N	0	3	348.531	3.021	20	30		EGEDHN
C#CCNC[C@@H](NC(=O)C1(CCF)CC1)c1ccc2ccccc2c1	ZINC001754643543	1440649371	/nfs/dbraw/zinc/64/93/71/1440649371.db2.gz	BADKPBNSMPLTBF-LJQANCHMSA-N	0	3	338.426	3.360	20	30		EGEDHN
C#CCNC[C@@H](NC(=O)CCC(F)F)c1ccc2ccccc2c1	ZINC001754644043	1440649689	/nfs/dbraw/zinc/64/96/89/1440649689.db2.gz	MRUYUIHDMVNXTK-QGZVFWFLSA-N	0	3	330.378	3.265	20	30		EGEDHN
C=CCCCC(=O)N[C@@]1(C)CCN(Cc2ccccc2N(C)C)C1	ZINC001754679445	1440661596	/nfs/dbraw/zinc/66/15/96/1440661596.db2.gz	RQGGZEKPVMKUSF-FQEVSTJZSA-N	0	3	329.488	3.190	20	30		EGEDHN
C#CCN1CCC(C)(CNC(=O)C(C)(C)c2ccccc2Cl)CC1	ZINC001754721607	1440673478	/nfs/dbraw/zinc/67/34/78/1440673478.db2.gz	VFKZENCEHUOLDT-UHFFFAOYSA-N	0	3	346.902	3.469	20	30		EGEDHN
C=CCN1CCC[C@](C)(CNC(=O)c2ccnc(OC3CCC3)c2)C1	ZINC001754732362	1440680333	/nfs/dbraw/zinc/68/03/33/1440680333.db2.gz	SKUALIVPBJZQBY-HXUWFJFHSA-N	0	3	343.471	3.031	20	30		EGEDHN
C=CCN1CCC[C@](C)(CNC(=O)[C@@H]2CCOc3c(F)cccc32)C1	ZINC001754735954	1440682352	/nfs/dbraw/zinc/68/23/52/1440682352.db2.gz	NYICERRYFDWPRE-OXQOHEQNSA-N	0	3	346.446	3.096	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@]1(O)CCN([C@H](C)c2ccc(F)cc2)C1	ZINC001754756383	1440685344	/nfs/dbraw/zinc/68/53/44/1440685344.db2.gz	MHOZYCJRXAMJDN-QRWLVFNGSA-N	0	3	348.462	3.042	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(Cc1cc(C)no1)C2	ZINC001754784581	1440687224	/nfs/dbraw/zinc/68/72/24/1440687224.db2.gz	FCZSHKVMNUYYLE-SZMVWBNQSA-N	0	3	343.471	3.221	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H](C)[C@@H](CNCc2csc(C)n2)C1	ZINC001754815536	1440692319	/nfs/dbraw/zinc/69/23/19/1440692319.db2.gz	TTWLVLQABNUJOA-PBHICJAKSA-N	0	3	347.528	3.404	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@H]3CN(Cc4cnc(C)s4)C[C@H]3C2)CCC1	ZINC001754844974	1440698868	/nfs/dbraw/zinc/69/88/68/1440698868.db2.gz	DBLJTPLHCKNCHS-IYBDPMFKSA-N	0	3	345.512	3.088	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H]2[C@H]1CCN2CCOc1cccc(F)c1	ZINC001754864534	1440702079	/nfs/dbraw/zinc/70/20/79/1440702079.db2.gz	XHDDYNWZAUHMRQ-RBUKOAKNSA-N	0	3	346.446	3.236	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](CCNCc2oc(C)nc2C)C1	ZINC001754917874	1440708959	/nfs/dbraw/zinc/70/89/59/1440708959.db2.gz	ZDRQYDZCJKWVJQ-INIZCTEOSA-N	0	3	333.476	3.222	20	30		EGEDHN
C=C(C)CN(C)Cc1ccccc1CNC(=O)[C@@H]1CCO[C@H]1CC	ZINC001754946626	1440713401	/nfs/dbraw/zinc/71/34/01/1440713401.db2.gz	PLBPKFIPWRHACP-MOPGFXCFSA-N	0	3	330.472	3.126	20	30		EGEDHN
CC#CCN[C@H](C)c1ccc(CNC(=O)c2cc(C3CC3)no2)cc1	ZINC001754948229	1440714166	/nfs/dbraw/zinc/71/41/66/1440714166.db2.gz	GUHVFEMMZQVCIC-CQSZACIVSA-N	0	3	337.423	3.156	20	30		EGEDHN
C#CCN[C@H](C)c1ccc(CNC(=O)[C@@H](OCC)C2CCCC2)cc1	ZINC001754949085	1440714371	/nfs/dbraw/zinc/71/43/71/1440714371.db2.gz	VXXNHRWQMJHHJV-UZLBHIALSA-N	0	3	342.483	3.182	20	30		EGEDHN
CC#CCN[C@@H](C)c1ccc(CNC(=O)c2cccc3n[nH]cc32)cc1	ZINC001754948910	1440714392	/nfs/dbraw/zinc/71/43/92/1440714392.db2.gz	RVHYAQWXJWYWRI-HNNXBMFYSA-N	0	3	346.434	3.167	20	30		EGEDHN
C#CCN[C@H](C)c1ccc(CNC(=O)C2(c3ccccc3)CC2)cc1	ZINC001754951176	1440715022	/nfs/dbraw/zinc/71/50/22/1440715022.db2.gz	LDIVTYBHNICVJK-QGZVFWFLSA-N	0	3	332.447	3.318	20	30		EGEDHN
C=C(C)CN(C)Cc1ccccc1CNC(=O)[C@@]1(C)CCCOC1	ZINC001754955134	1440716260	/nfs/dbraw/zinc/71/62/60/1440716260.db2.gz	VDWPVKGRAAQLIR-FQEVSTJZSA-N	0	3	330.472	3.127	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)CC[C@H](C)OC)cccc2C1	ZINC001754974734	1440719627	/nfs/dbraw/zinc/71/96/27/1440719627.db2.gz	SGKFCAOIJZCOAW-INIZCTEOSA-N	0	3	330.472	3.052	20	30		EGEDHN
CC#CCNC1(CNC(=O)c2cc(Cl)sc2Cl)CCC1	ZINC001754982586	1440721665	/nfs/dbraw/zinc/72/16/65/1440721665.db2.gz	WOOSTJVYDKKSCQ-UHFFFAOYSA-N	0	3	331.268	3.320	20	30		EGEDHN
CC[C@H](C)CCCCC(=O)N[C@H]1CCCN(CC#CCOC)CC1	ZINC001755024665	1440728263	/nfs/dbraw/zinc/72/82/63/1440728263.db2.gz	GBHTXDLFYNJBEC-OALUTQOASA-N	0	3	336.520	3.213	20	30		EGEDHN
Cc1ccncc1CN(C)CCCN(C)C(=O)CC#Cc1ccccc1	ZINC001755047475	1440741951	/nfs/dbraw/zinc/74/19/51/1440741951.db2.gz	KXURTXTTWOFJTB-UHFFFAOYSA-N	0	3	349.478	3.112	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H]([C@@H]2CCCN(C/C=C\Cl)C2)C1	ZINC001755048296	1440742568	/nfs/dbraw/zinc/74/25/68/1440742568.db2.gz	VQPIULDBWXJHSM-GCNOGIOXSA-N	0	3	336.907	3.493	20	30		EGEDHN
C=CCCCC(=O)N1CCC(CC)([NH2+]Cc2nnc(C(C)C)[n-]2)CC1	ZINC001755071458	1440746744	/nfs/dbraw/zinc/74/67/44/1440746744.db2.gz	UNEMFFBVXQLRCC-UHFFFAOYSA-N	0	3	347.507	3.145	20	30		EGEDHN
Cc1cccc(Cl)c1CN[C@H]1CN(C(=O)C#CC(C)C)C[C@@H]1C	ZINC001755108368	1440754018	/nfs/dbraw/zinc/75/40/18/1440754018.db2.gz	DPGQEGUJHFXWAO-YJBOKZPZSA-N	0	3	332.875	3.244	20	30		EGEDHN
C=CCCCN1CCc2ccccc2[C@@H]1CNC(=O)C1=COCCC1	ZINC001755172788	1440769977	/nfs/dbraw/zinc/76/99/77/1440769977.db2.gz	XVMAAXZMYIIQEY-FQEVSTJZSA-N	0	3	340.467	3.363	20	30		EGEDHN
C=CCCCN1CCOC2(CCN(C(=O)[C@@H]3CCCC[C@H]3C)CC2)C1	ZINC001755174319	1440770263	/nfs/dbraw/zinc/77/02/63/1440770263.db2.gz	NUJINPJBKNGXRO-RTBURBONSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCCN1CCOC2(CCN(C(=O)[C@H](C)CCCC)CC2)C1	ZINC001755174828	1440770564	/nfs/dbraw/zinc/77/05/64/1440770564.db2.gz	YPQHROIELQTDDX-GOSISDBHSA-N	0	3	336.520	3.472	20	30		EGEDHN
C=CCC1(C(=O)NC2CC(CNCc3ccccc3C#N)C2)CCC1	ZINC001755216659	1440784147	/nfs/dbraw/zinc/78/41/47/1440784147.db2.gz	IVFBKPXLWUYRLZ-UHFFFAOYSA-N	0	3	337.467	3.289	20	30		EGEDHN
C[C@@H](NCC#Cc1ccccc1)[C@H](C)NC(=O)CC1CCCCC1	ZINC001755226336	1440786086	/nfs/dbraw/zinc/78/60/86/1440786086.db2.gz	NBQGFYBJMWCOMQ-MSOLQXFVSA-N	0	3	326.484	3.491	20	30		EGEDHN
C[C@@H](NC(=O)c1sccc1F)[C@H](C)NCC#Cc1ccc(F)cc1	ZINC001755234906	1440788001	/nfs/dbraw/zinc/78/80/01/1440788001.db2.gz	VWKNMPJDGJURKY-QWHCGFSZSA-N	0	3	348.418	3.174	20	30		EGEDHN
C[C@@H](NCC#Cc1ccc(F)cc1)[C@@H](C)NC(=O)c1sccc1F	ZINC001755234904	1440788029	/nfs/dbraw/zinc/78/80/29/1440788029.db2.gz	VWKNMPJDGJURKY-CHWSQXEVSA-N	0	3	348.418	3.174	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H](C)[C@H](C)NCc1cccc(C(C)C)n1	ZINC001755247510	1440791082	/nfs/dbraw/zinc/79/10/82/1440791082.db2.gz	BHVLGNPRAAUAFQ-IRXDYDNUSA-N	0	3	329.488	3.381	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)[C@@H](C)NCc2cccc(OC)n2)CCCC1	ZINC001755267096	1440796636	/nfs/dbraw/zinc/79/66/36/1440796636.db2.gz	BLAUOSAMISWIAY-HZPDHXFCSA-N	0	3	345.487	3.210	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@H](C)N(C)Cc1cccc2nsnc21	ZINC001755313899	1440814813	/nfs/dbraw/zinc/81/48/13/1440814813.db2.gz	AOABABLKTYXPQY-SCLBCKFNSA-N	0	3	346.500	3.230	20	30		EGEDHN
C[C@@H](CNC(=O)c1cc(F)cc(F)c1)N(C)Cc1cccc(C#N)c1	ZINC001755325256	1440821303	/nfs/dbraw/zinc/82/13/03/1440821303.db2.gz	VVMWUHRMCAXMQN-ZDUSSCGKSA-N	0	3	343.377	3.087	20	30		EGEDHN
C=CCCCC(=O)NC1(CNCc2ccc(F)cn2)CCCCC1	ZINC001755353475	1440828627	/nfs/dbraw/zinc/82/86/27/1440828627.db2.gz	MIGZUNNJMYJCOG-UHFFFAOYSA-N	0	3	333.451	3.486	20	30		EGEDHN
CCCC[C@@H](CNCC#Cc1ccc(F)cc1)NC(=O)c1ccoc1	ZINC001755356840	1440829802	/nfs/dbraw/zinc/82/98/02/1440829802.db2.gz	ZATOYODNGLCVFX-IBGZPJMESA-N	0	3	342.414	3.349	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@]2(CCN(C(=O)c3cc(C)c(C)o3)C2)C1	ZINC001755400123	1440842835	/nfs/dbraw/zinc/84/28/35/1440842835.db2.gz	CGQJFYLQXJPZHD-JXFKEZNVSA-N	0	3	346.471	3.168	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CN(CCOc2ccccc2)CC1(C)C	ZINC001755405593	1440844065	/nfs/dbraw/zinc/84/40/65/1440844065.db2.gz	MWDQPQZDPRGXRH-LJQANCHMSA-N	0	3	342.483	3.086	20	30		EGEDHN
C=CCOCC(=O)N[C@@H]1CN([C@@H](CC)c2ccc(F)cc2)CC1(C)C	ZINC001755406126	1440844420	/nfs/dbraw/zinc/84/44/20/1440844420.db2.gz	KFKSZNIAVCLHGR-ZWKOTPCHSA-N	0	3	348.462	3.306	20	30		EGEDHN
C/C(=C/C(=O)N[C@H]1C[C@H](CNCc2cc(C#N)ccc2F)C1)C1CC1	ZINC001755466037	1440858244	/nfs/dbraw/zinc/85/82/44/1440858244.db2.gz	FISHBTIWOBPRBQ-PRLZIYHSSA-N	0	3	341.430	3.038	20	30		EGEDHN
CC(C)CCC(=O)N1CCC(N(C)CC#Cc2ccccc2)CC1	ZINC001755525847	1440865634	/nfs/dbraw/zinc/86/56/34/1440865634.db2.gz	SFCSYSOXUNZFAW-UHFFFAOYSA-N	0	3	326.484	3.397	20	30		EGEDHN
CN(C(=O)C#CC(C)(C)C)[C@H](CNCc1cc(F)cc(F)c1)C1CC1	ZINC001755572229	1440877228	/nfs/dbraw/zinc/87/72/28/1440877228.db2.gz	ROGZKSNBRDSFIC-GOSISDBHSA-N	0	3	348.437	3.341	20	30		EGEDHN
C[C@H](CN(C)C(=O)c1sccc1F)NCc1ccc(C#N)s1	ZINC001755585182	1440880306	/nfs/dbraw/zinc/88/03/06/1440880306.db2.gz	LMPWLHJLCHFSRQ-SNVBAGLBSA-N	0	3	337.445	3.071	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N(C)C[C@H](C)NCc1ccc(OC)c(C#N)c1	ZINC001755602070	1440884330	/nfs/dbraw/zinc/88/43/30/1440884330.db2.gz	PRIRTLNHNBKSQN-UJPCXNRSSA-N	0	3	341.455	3.026	20	30		EGEDHN
C=CCC1(C(=O)N(C)C[C@H](C)NCc2ccnc(OC)c2)CCCC1	ZINC001755620809	1440890457	/nfs/dbraw/zinc/89/04/57/1440890457.db2.gz	ZAGZMLXKWCULOJ-INIZCTEOSA-N	0	3	345.487	3.163	20	30		EGEDHN
C[C@@H]1[C@H](NCc2ccc(C#N)s2)CCN1C(=O)/C=C/C(C)(C)C	ZINC001755651638	1440891463	/nfs/dbraw/zinc/89/14/63/1440891463.db2.gz	HZVKWKOAMMITKI-TYPPYWKXSA-N	0	3	331.485	3.301	20	30		EGEDHN
C[C@@H]1[C@@H](NCc2ccc(C#N)c(F)c2)CCN1C(=O)CCC1(C)CC1	ZINC001755665235	1440893351	/nfs/dbraw/zinc/89/33/51/1440893351.db2.gz	UWSOTBDTSDOKAF-KDOFPFPSSA-N	0	3	343.446	3.357	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@H](NCc2ccc(OC)c(C#N)c2)C[C@@H]1C	ZINC001755675124	1440894446	/nfs/dbraw/zinc/89/44/46/1440894446.db2.gz	INOZHAKLSXVANG-MAUKXSAKSA-N	0	3	341.455	3.002	20	30		EGEDHN
Cc1cc(C)cc(CN2CCC[C@H](NC(=O)CSCC#N)[C@H]2C)c1	ZINC001755715123	1440904516	/nfs/dbraw/zinc/90/45/16/1440904516.db2.gz	UQQRZTJMFGLNLV-AEFFLSMTSA-N	0	3	345.512	3.029	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1CCCN(CCn2nc(C)cc2C)[C@@H]1C	ZINC001755716239	1440905415	/nfs/dbraw/zinc/90/54/15/1440905415.db2.gz	KTXZGTYIGJUWEE-MSOLQXFVSA-N	0	3	346.519	3.071	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1C[C@H](NCC#Cc2ccccc2)C(C)(C)C1	ZINC001755763973	1440915535	/nfs/dbraw/zinc/91/55/35/1440915535.db2.gz	LRFRXFWJSXAPAW-MJGOQNOKSA-N	0	3	326.484	3.157	20	30		EGEDHN
CC(C)(C)[C@H](CNCC#Cc1ccccc1)NC(=O)C1CC(F)(F)C1	ZINC001755820557	1440925446	/nfs/dbraw/zinc/92/54/46/1440925446.db2.gz	QSMAVZGWJBKQDA-KRWDZBQOSA-N	0	3	348.437	3.204	20	30		EGEDHN
Cc1ccncc1C(=O)N[C@@H](CNCC#Cc1ccccc1)C(C)(C)C	ZINC001755820907	1440925705	/nfs/dbraw/zinc/92/57/05/1440925705.db2.gz	VBJYRELPWOWBQC-FQEVSTJZSA-N	0	3	349.478	3.176	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H](CNCc1ccnc(Cl)c1)C(C)(C)C	ZINC001755822781	1440926259	/nfs/dbraw/zinc/92/62/59/1440926259.db2.gz	XEDSBUINGZKIBY-HNNXBMFYSA-N	0	3	335.879	3.015	20	30		EGEDHN
CC#CCN1CCC([C@@H](C)NC(=O)C2(c3ccccc3F)CC2)CC1	ZINC001755845996	1440933330	/nfs/dbraw/zinc/93/33/30/1440933330.db2.gz	IAYOZKXACUNMCN-MRXNPFEDSA-N	0	3	342.458	3.097	20	30		EGEDHN
C=C(Br)CNC1CC(N(C)C(=O)C2(CC)CCC2)C1	ZINC001755860306	1440936655	/nfs/dbraw/zinc/93/66/55/1440936655.db2.gz	ZQXQYBJNEGQDRE-UHFFFAOYSA-N	0	3	329.282	3.054	20	30		EGEDHN
C=CCCC(=O)NCC1=CCN(CCOc2cc(C)cc(C)c2)CC1	ZINC001755882494	1440939904	/nfs/dbraw/zinc/93/99/04/1440939904.db2.gz	JHXXKHDPSQSDBA-UHFFFAOYSA-N	0	3	342.483	3.397	20	30		EGEDHN
C[Si](C)(C)C#Cc1ccnc(N2CCN(C3CCCC3)CC2)c1	ZINC001165033392	721862149	/nfs/dbraw/zinc/86/21/49/721862149.db2.gz	MKGBRQUIJWGCIB-UHFFFAOYSA-N	0	3	327.548	3.375	20	30		EGEDHN
C=CCCCCC[N@@H+]1CCCN(c2ccccc2-c2nnn[n-]2)CC1	ZINC001573334665	947461994	/nfs/dbraw/zinc/46/19/94/947461994.db2.gz	HNSOYFKMWKFFHI-UHFFFAOYSA-N	0	3	340.475	3.125	20	30		EGEDHN
C=CCCCCC[N@H+]1CCCN(c2ccccc2-c2nnn[n-]2)CC1	ZINC001573334665	947462002	/nfs/dbraw/zinc/46/20/02/947462002.db2.gz	HNSOYFKMWKFFHI-UHFFFAOYSA-N	0	3	340.475	3.125	20	30		EGEDHN
C=CCCCCC[N@@H+]1CCCN(c2ccccc2-c2nn[n-]n2)CC1	ZINC001573334665	947462006	/nfs/dbraw/zinc/46/20/06/947462006.db2.gz	HNSOYFKMWKFFHI-UHFFFAOYSA-N	0	3	340.475	3.125	20	30		EGEDHN
C=CCCCCC[N@H+]1CCCN(c2ccccc2-c2nn[n-]n2)CC1	ZINC001573334665	947462012	/nfs/dbraw/zinc/46/20/12/947462012.db2.gz	HNSOYFKMWKFFHI-UHFFFAOYSA-N	0	3	340.475	3.125	20	30		EGEDHN
COc1ccccc1[C@H](CNCc1cccc(C#N)c1)N1CCCC1	ZINC000053095299	214163947	/nfs/dbraw/zinc/16/39/47/214163947.db2.gz	WIRLRAXVZFJQAU-FQEVSTJZSA-N	0	3	335.451	3.494	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2cccc(C#N)c2)CCN1Cc1ccccc1	ZINC000079554885	217240540	/nfs/dbraw/zinc/24/05/40/217240540.db2.gz	OPFOTULBIJBOER-OXQOHEQNSA-N	0	3	333.435	3.341	20	30		EGEDHN
C=CCOCCCC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000079552051	217240631	/nfs/dbraw/zinc/24/06/31/217240631.db2.gz	MORZGJVFZXGDAQ-PKOBYXMFSA-N	0	3	330.472	3.139	20	30		EGEDHN
Cc1ccc(NC(=O)[C@H]2CCCN(Cc3cccc(C#N)c3)C2)nc1	ZINC000080927311	217341114	/nfs/dbraw/zinc/34/11/14/217341114.db2.gz	HRCFHPJLZIDMNX-SFHVURJKSA-N	0	3	334.423	3.112	20	30		EGEDHN
C=CCN(CC=C)C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000267417878	251040959	/nfs/dbraw/zinc/04/09/59/251040959.db2.gz	PLHKYCNKFGWIIV-MJGOQNOKSA-N	0	3	327.472	3.281	20	30		EGEDHN
Cc1sc(NC(=O)CN(C[C@H](C)O)C2CCCCC2)c(C#N)c1C	ZINC000267420624	251041917	/nfs/dbraw/zinc/04/19/17/251041917.db2.gz	WFLNYXJSXZMAMN-LBPRGKRZSA-N	0	3	349.500	3.191	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(Br)cc2CC)CC1	ZINC000268717321	252166932	/nfs/dbraw/zinc/16/69/32/252166932.db2.gz	JDRCRKTUFJWASM-UHFFFAOYSA-N	0	3	349.272	3.295	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CCCN1C[C@H](O)c1ccc(C#N)cc1	ZINC000268676143	252128243	/nfs/dbraw/zinc/12/82/43/252128243.db2.gz	LJDQAGVWDYWBOB-AVRDEDQJSA-N	0	3	349.478	3.188	20	30		EGEDHN
COc1ccccc1[C@@H](CNCc1ccc(C#N)o1)N1CCCC1	ZINC000174239968	532974301	/nfs/dbraw/zinc/97/43/01/532974301.db2.gz	UEZPOODZGOVDQS-GOSISDBHSA-N	0	3	325.412	3.087	20	30		EGEDHN
COc1ccc([C@H](CNCc2ccc(C#N)o2)N2CCCC2)cc1	ZINC000174243154	533182535	/nfs/dbraw/zinc/18/25/35/533182535.db2.gz	JDUKFEDOZVSMKP-IBGZPJMESA-N	0	3	325.412	3.087	20	30		EGEDHN
COc1ccc(CNC[C@@H](c2ccco2)N2CCCCC2)cc1C#N	ZINC000174240400	533666755	/nfs/dbraw/zinc/66/67/55/533666755.db2.gz	XUEOELKTBLSRGR-SFHVURJKSA-N	0	3	339.439	3.477	20	30		EGEDHN
COc1ccc([C@@H](C)NCCC(=O)Nc2sccc2C#N)cc1	ZINC000341185470	141134433	/nfs/dbraw/zinc/13/44/33/141134433.db2.gz	AUDPOJPMVBVNOW-GFCCVEGCSA-N	0	3	329.425	3.308	20	30		EGEDHN
C[C@@H](NCc1ccc(Cn2cncn2)cc1)c1ccc(C#N)c(F)c1	ZINC000346207978	141180380	/nfs/dbraw/zinc/18/03/80/141180380.db2.gz	WNBSMYNZCCNFEV-CQSZACIVSA-N	0	3	335.386	3.188	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCN[C@H]2CCCc3c(O)cccc32)cc1	ZINC000192360443	144173609	/nfs/dbraw/zinc/17/36/09/144173609.db2.gz	YRHLKHZYFVBUBW-SFHVURJKSA-N	0	3	335.407	3.260	20	30		EGEDHN
C[C@H]1CC=CC[C@H]1C(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000341146474	155189913	/nfs/dbraw/zinc/18/99/13/155189913.db2.gz	LAGSXYQTRNRIIH-QFBILLFUSA-N	0	3	325.456	3.051	20	30		EGEDHN
N#Cc1cc(NC[C@H](c2cccc(Cl)c2)N2CCCC2)ccn1	ZINC000341540849	155343560	/nfs/dbraw/zinc/34/35/60/155343560.db2.gz	CAIAYEOVPMPQQU-GOSISDBHSA-N	0	3	326.831	3.278	20	30		EGEDHN
C[C@@H]1CN(CC2CCN(Cc3ccc(C#N)c(F)c3)CC2)C[C@H](C)O1	ZINC000191984253	153235170	/nfs/dbraw/zinc/23/51/70/153235170.db2.gz	CXENKFXVFATMKM-IYBDPMFKSA-N	0	3	345.462	3.019	20	30		EGEDHN
CC[C@H]1c2ccsc2CCN1C[C@@H](O)COc1ccc(C#N)cc1	ZINC000302807461	154030133	/nfs/dbraw/zinc/03/01/33/154030133.db2.gz	GBLKYIBDVCLAKL-QAPCUYQASA-N	0	3	342.464	3.369	20	30		EGEDHN
CCOCCOCc1cccc(CNCc2cc(C#N)cs2)c1	ZINC000343284595	155724073	/nfs/dbraw/zinc/72/40/73/155724073.db2.gz	UEPOIVSEXMMDKS-UHFFFAOYSA-N	0	3	330.453	3.463	20	30		EGEDHN
COc1ccc(CN(CCN(C)C)Cc2ccc(C#N)cc2)cc1C	ZINC000348933138	156291034	/nfs/dbraw/zinc/29/10/34/156291034.db2.gz	HWMWGDYDGLSDSV-UHFFFAOYSA-N	0	3	337.467	3.439	20	30		EGEDHN
Cn1cc(CN2CCC(C(F)F)CC2)c(-c2ccc(C#N)cc2)n1	ZINC000352610965	156378989	/nfs/dbraw/zinc/37/89/89/156378989.db2.gz	ADFIXDBQABQMQO-UHFFFAOYSA-N	0	3	330.382	3.436	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)Cc1cc(=O)n2c(C)cccc2n1	ZINC000126077785	162294055	/nfs/dbraw/zinc/29/40/55/162294055.db2.gz	QLXIAVZNYSDBRA-UHFFFAOYSA-N	0	3	346.434	3.287	20	30		EGEDHN
CN(CCOc1ccccc1C#N)CCc1cccc([N+](=O)[O-])c1	ZINC000338389415	163221221	/nfs/dbraw/zinc/22/12/21/163221221.db2.gz	SBNTVJLVNJAPAR-UHFFFAOYSA-N	0	3	325.368	3.020	20	30		EGEDHN
COc1cc(C#N)ccc1OCCNC1(c2ccc(F)cc2)CC1	ZINC000354400775	166013381	/nfs/dbraw/zinc/01/33/81/166013381.db2.gz	WNURMUVCTQEWFF-UHFFFAOYSA-N	0	3	326.371	3.364	20	30		EGEDHN
CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)c1cccc(C#N)c1	ZINC000346114544	164339825	/nfs/dbraw/zinc/33/98/25/164339825.db2.gz	BUHUOECMTWUULN-FQEVSTJZSA-N	0	3	335.451	3.445	20	30		EGEDHN
CCN(Cc1nnc(-c2cccc(C#N)c2)o1)[C@H]1CCOC(C)(C)C1	ZINC000351919378	165150297	/nfs/dbraw/zinc/15/02/97/165150297.db2.gz	PGBBQQWDCYQHJK-INIZCTEOSA-N	0	3	340.427	3.388	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)[C@@H]1CCCC1(C)C	ZINC000355292798	166155666	/nfs/dbraw/zinc/15/56/66/166155666.db2.gz	OEJAFTDTKDAIBJ-SFHVURJKSA-N	0	3	327.472	3.275	20	30		EGEDHN
N#Cc1ccc2c(c1)CCCC[C@@H]2NCc1ccccc1OCCO	ZINC000360658174	167381544	/nfs/dbraw/zinc/38/15/44/167381544.db2.gz	RPYUVCWAGAQXPF-FQEVSTJZSA-N	0	3	336.435	3.487	20	30		EGEDHN
C[C@@H]1CN(CC2CCN(Cc3cc(C#N)ccc3F)CC2)C[C@H](C)O1	ZINC000171306892	227006497	/nfs/dbraw/zinc/00/64/97/227006497.db2.gz	JPBSFKDGHYITFZ-IYBDPMFKSA-N	0	3	345.462	3.019	20	30		EGEDHN
CCCc1cc(NCCCc2[nH]nc(N)c2C#N)c2ccccc2n1	ZINC000123094114	222213538	/nfs/dbraw/zinc/21/35/38/222213538.db2.gz	NMTOKZITSIQUHG-UHFFFAOYSA-N	0	3	334.427	3.409	20	30		EGEDHN
Cc1cccc(O[C@H](C)CNC(=O)C(C#N)Cc2ccc(C#N)cc2)c1	ZINC000280441132	270039725	/nfs/dbraw/zinc/03/97/25/270039725.db2.gz	NAYWMJBLJBZSAJ-VQIMIIECSA-N	0	3	347.418	3.133	20	30		EGEDHN
N#Cc1cnc(NCC2CCN(Cc3cccs3)CC2)c(F)c1	ZINC000413089782	270047187	/nfs/dbraw/zinc/04/71/87/270047187.db2.gz	CIUDNOROJBKFEW-UHFFFAOYSA-N	0	3	330.432	3.478	20	30		EGEDHN
N#Cc1cccc(N2CCCN(Cc3ccccc3)CC2)c1[N+](=O)[O-]	ZINC000450234577	270052700	/nfs/dbraw/zinc/05/27/00/270052700.db2.gz	RNAHZLBMFLGNSI-UHFFFAOYSA-N	0	3	336.395	3.179	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CCC(CC(F)(F)F)CC2)cc1	ZINC000501422235	270058902	/nfs/dbraw/zinc/05/89/02/270058902.db2.gz	ULOCNSASQPKNOD-INIZCTEOSA-N	0	3	349.356	3.432	20	30		EGEDHN
CCc1cnc(CNC2CCC(Oc3ncccc3C#N)CC2)s1	ZINC000526082656	270059506	/nfs/dbraw/zinc/05/95/06/270059506.db2.gz	QFCVVYFOIMLYHM-UHFFFAOYSA-N	0	3	342.468	3.452	20	30		EGEDHN
CCC1(CC)[C@H](N[C@@H](C)C(=O)Nc2oc(C)c(C)c2C#N)C[C@H]1OC	ZINC000191384017	266013025	/nfs/dbraw/zinc/01/30/25/266013025.db2.gz	OLLNPMLZXLWQKI-APHBMKBZSA-N	0	3	347.459	3.278	20	30		EGEDHN
CCN(CC)Cc1cccc(NC(=O)CNc2cccc(C#N)c2)c1	ZINC000152467309	266117937	/nfs/dbraw/zinc/11/79/37/266117937.db2.gz	PBNRIRDJQNDXTQ-UHFFFAOYSA-N	0	3	336.439	3.451	20	30		EGEDHN
CCN(C[C@@H](O)COc1ccc(C#N)cc1)[C@H](C)c1ccc(C#N)cc1	ZINC000299031043	266132749	/nfs/dbraw/zinc/13/27/49/266132749.db2.gz	HWBSDGBUQHMIDI-OXQOHEQNSA-N	0	3	349.434	3.253	20	30		EGEDHN
CCc1ncc(CN(CCN(C)C)Cc2ccc(C#N)cc2)s1	ZINC000289787081	266451536	/nfs/dbraw/zinc/45/15/36/266451536.db2.gz	LPRJQCFPFXBAMU-UHFFFAOYSA-N	0	3	328.485	3.141	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)C(C#N)Cc2ccc(C#N)cc2)c2ccccc2O1	ZINC000295375346	267080383	/nfs/dbraw/zinc/08/03/83/267080383.db2.gz	DVJPRHMKQOSDPM-DKSSEZFCSA-N	0	3	345.402	3.269	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2cccc(F)c2C#N)CN1Cc1ccccc1	ZINC000186316994	267082127	/nfs/dbraw/zinc/08/21/27/267082127.db2.gz	HJVKAVDJWLEMCJ-GDBMZVCRSA-N	0	3	337.398	3.090	20	30		EGEDHN
C[C@H](CCN1CCN(c2nccnc2C#N)C[C@@H]1C)c1ccccc1	ZINC000194065670	267149930	/nfs/dbraw/zinc/14/99/30/267149930.db2.gz	GTWKXQQJMRWWSO-SJORKVTESA-N	0	3	335.455	3.053	20	30		EGEDHN
C[C@H](NCCOc1cccc(C#N)c1)[C@@H]1OCCc2sccc21	ZINC000292479250	267183238	/nfs/dbraw/zinc/18/32/38/267183238.db2.gz	RZSJEYRQYVEKSU-UGSOOPFHSA-N	0	3	328.437	3.291	20	30		EGEDHN
CC[C@@H](Cc1ccccc1)N(C)CC(=O)NCc1cccc(C#N)c1	ZINC000525126824	267187656	/nfs/dbraw/zinc/18/76/56/267187656.db2.gz	QYSOKOYTYOHOTB-FQEVSTJZSA-N	0	3	335.451	3.128	20	30		EGEDHN
CCc1ccc(C(C)(C)CNCc2cnc3c(C#N)cnn3c2)cc1	ZINC000518979299	267247704	/nfs/dbraw/zinc/24/77/04/267247704.db2.gz	HIIQDJVVDGPWJP-UHFFFAOYSA-N	0	3	333.439	3.231	20	30		EGEDHN
C[C@](CO)(NCC(=O)Nc1cc(Cl)ccc1C#N)C1CCCCC1	ZINC000266847617	267255735	/nfs/dbraw/zinc/25/57/35/267255735.db2.gz	BDENXVRVJDCBHR-GOSISDBHSA-N	0	3	349.862	3.071	20	30		EGEDHN
CN(C)C[C@@H]1CCc2ccccc2N1C(=O)c1ccc(C#N)s1	ZINC000425600635	267282982	/nfs/dbraw/zinc/28/29/82/267282982.db2.gz	DELYECVLOOVQDE-AWEZNQCLSA-N	0	3	325.437	3.143	20	30		EGEDHN
CN(CCC(=O)Nc1sccc1C#N)[C@H](CCO)c1ccccc1	ZINC000441400650	267303970	/nfs/dbraw/zinc/30/39/70/267303970.db2.gz	AHRGSBBRJYUTQL-MRXNPFEDSA-N	0	3	343.452	3.004	20	30		EGEDHN
Cc1cc(CN2CC[C@@H](Oc3ccc(C#N)cn3)C2)c2ccccc2n1	ZINC000292231408	267324364	/nfs/dbraw/zinc/32/43/64/267324364.db2.gz	POVZWTWVPZDVBM-GOSISDBHSA-N	0	3	344.418	3.463	20	30		EGEDHN
Cc1ccc(C#N)c(N2CC[C@]3(CCN(Cc4ccccc4)C3)C2)n1	ZINC000286335842	267375931	/nfs/dbraw/zinc/37/59/31/267375931.db2.gz	LSTSNDLLCCATFL-NRFANRHFSA-N	0	3	332.451	3.364	20	30		EGEDHN
N#Cc1cc(NC(=O)C23CCCN2CCC3)ccc1OC(F)(F)F	ZINC000291633477	268005814	/nfs/dbraw/zinc/00/58/14/268005814.db2.gz	SOOFABQIRSMFGJ-UHFFFAOYSA-N	0	3	339.317	3.024	20	30		EGEDHN
Cc1cc(NC(=O)c2cc(C#N)cs2)ccc1OCCN(C)C	ZINC000458203403	268010334	/nfs/dbraw/zinc/01/03/34/268010334.db2.gz	WJDGHPWXNXYTSJ-UHFFFAOYSA-N	0	3	329.425	3.121	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)[C@@H]2C[C@H]2c2cccc(C#N)c2)N(C)C)cc1	ZINC000411688650	268046060	/nfs/dbraw/zinc/04/60/60/268046060.db2.gz	CTTLTWYIECNOJN-HBMCJLEFSA-N	0	3	347.462	3.389	20	30		EGEDHN
Cc1cccc([C@@H]2CCCN2C[C@@H](O)COc2ccccc2C#N)c1	ZINC000528350091	268056590	/nfs/dbraw/zinc/05/65/90/268056590.db2.gz	CFFAHCAJUWQPRV-UXHICEINSA-N	0	3	336.435	3.444	20	30		EGEDHN
N#Cc1ccc(CNC(=O)CN[C@H]2CCC[C@@H]2c2ccccc2)cc1	ZINC000275674557	268068668	/nfs/dbraw/zinc/06/86/68/268068668.db2.gz	XUICREGDSVWLNM-UXHICEINSA-N	0	3	333.435	3.100	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2Cc3cccc(Cl)c3C2)cc1	ZINC000377080496	268083822	/nfs/dbraw/zinc/08/38/22/268083822.db2.gz	GGRYMAIKEXUAFE-INIZCTEOSA-N	0	3	335.794	3.436	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CCS[C@H]3CCCC[C@H]32)cc1	ZINC000279915379	268090006	/nfs/dbraw/zinc/09/00/06/268090006.db2.gz	FDKLZOAQMIHDCB-KURKYZTESA-N	0	3	339.464	3.127	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCc2ccc(F)c(Cl)c2)cc1	ZINC000348191597	268090414	/nfs/dbraw/zinc/09/04/14/268090414.db2.gz	FDJCMKIUEVHDFA-OAHLLOKOSA-N	0	3	341.773	3.349	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NC[C@@H]2CCCC(F)(F)C2)cc1	ZINC000282678261	268090574	/nfs/dbraw/zinc/09/05/74/268090574.db2.gz	OJIHNYZBYQBLSB-HZPDHXFCSA-N	0	3	331.366	3.182	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@H]2C[C@H](c3ccccc3)C2)cc1	ZINC000280718252	268092210	/nfs/dbraw/zinc/09/22/10/268092210.db2.gz	PRXDDRKAWNQGDS-VAMGGRTRSA-N	0	3	329.403	3.303	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@H]2CCOc3ccc(F)cc32)cc1	ZINC000280597116	268092231	/nfs/dbraw/zinc/09/22/31/268092231.db2.gz	WYLVKYLUFROSNH-QAPCUYQASA-N	0	3	349.365	3.020	20	30		EGEDHN
N#Cc1ccc(NC(=O)N2CCCN(C3CCCC3)CC2)cc1F	ZINC000289710323	268143862	/nfs/dbraw/zinc/14/38/62/268143862.db2.gz	JBHJKCYXFOYZLY-UHFFFAOYSA-N	0	3	330.407	3.180	20	30		EGEDHN
N#Cc1c(F)cccc1C(=O)N1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1	ZINC000425005712	268162393	/nfs/dbraw/zinc/16/23/93/268162393.db2.gz	LNLMIBBCDVLUGI-OXJNMPFZSA-N	0	3	349.409	3.044	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](NC[C@@H]3C[C@H]3c3ccccc3)C2=O)cc1	ZINC000521205897	268224087	/nfs/dbraw/zinc/22/40/87/268224087.db2.gz	GWMXSJPNVASDPI-ACRUOGEOSA-N	0	3	345.446	3.052	20	30		EGEDHN
N#Cc1ccc(CNC[C@]2(O)CCC[C@H](C(F)(F)F)C2)c(F)c1	ZINC000436398783	268233388	/nfs/dbraw/zinc/23/33/88/268233388.db2.gz	BALJGQHSNDXNBM-ZFWWWQNUSA-N	0	3	330.325	3.271	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1CCCc2ccc(F)cc21	ZINC000530233828	268303761	/nfs/dbraw/zinc/30/37/61/268303761.db2.gz	IIMFYPJABZGRRS-IEBWSBKVSA-N	0	3	340.398	3.104	20	30		EGEDHN
COc1ccc([C@H](CN(C)C)N[C@H]2CCc3ccc(C#N)cc32)cc1	ZINC000353592663	274117420	/nfs/dbraw/zinc/11/74/20/274117420.db2.gz	AXJUWVPMBNQBGU-SFTDATJTSA-N	0	3	335.451	3.447	20	30		EGEDHN
N#Cc1sc(NCC2CCN(c3ccncc3)CC2)nc1Cl	ZINC000286592358	276020467	/nfs/dbraw/zinc/02/04/67/276020467.db2.gz	UFPJTQPGANAXBV-UHFFFAOYSA-N	0	3	333.848	3.392	20	30		EGEDHN
COc1ccc(CN(CCN(C)C)Cc2ccc(C#N)cc2)cc1C#N	ZINC000289777762	276392611	/nfs/dbraw/zinc/39/26/11/276392611.db2.gz	KZJLAUXLVGXWJI-UHFFFAOYSA-N	0	3	348.450	3.002	20	30		EGEDHN
CC(C)CN(C(=O)CSc1ccc(C#N)cc1)C1CCN(C)CC1	ZINC000264035527	278814682	/nfs/dbraw/zinc/81/46/82/278814682.db2.gz	OBSNNNNEMAWKDE-UHFFFAOYSA-N	0	3	345.512	3.229	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)N1CC[C@@]2(CCN(C)C2)C1	ZINC000346314475	280261098	/nfs/dbraw/zinc/26/10/98/280261098.db2.gz	HNDULCGUXOLEGW-LJQANCHMSA-N	0	3	339.464	3.249	20	30		EGEDHN
C[C@H](c1ccc(C#N)cc1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000072665283	307381367	/nfs/dbraw/zinc/38/13/67/307381367.db2.gz	AFPIDMQHPLOAMF-CJNGLKHVSA-N	0	3	337.383	3.109	20	30		EGEDHN
Cc1ccccc1[C@@H](NCC(=O)NCc1cccc(C#N)c1)C(C)C	ZINC000537059430	314159791	/nfs/dbraw/zinc/15/97/91/314159791.db2.gz	IFEJPLRYKHJUDP-NRFANRHFSA-N	0	3	335.451	3.470	20	30		EGEDHN
C[C@H](NCCOc1ccc([N+](=O)[O-])cc1)c1ccc(C#N)c(F)c1	ZINC000537408340	314179284	/nfs/dbraw/zinc/17/92/84/314179284.db2.gz	VMVKVKALICRLOR-LBPRGKRZSA-N	0	3	329.331	3.335	20	30		EGEDHN
CN(C)[C@H](CNC(=O)c1ccc(Cl)c(C#N)c1)c1ccccc1	ZINC000537583059	314190916	/nfs/dbraw/zinc/19/09/16/314190916.db2.gz	CENAQVSETSGIAV-QGZVFWFLSA-N	0	3	327.815	3.244	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)Nc2cccc(C#N)n2)CCN1Cc1ccccc1	ZINC000564943240	316236524	/nfs/dbraw/zinc/23/65/24/316236524.db2.gz	YCEYMUKUHBHPGS-NVXWUHKLSA-N	0	3	349.438	3.128	20	30		EGEDHN
C[C@@H]1OCC[C@]1(O)CN(Cc1ccccc1)Cc1ccc(C#N)cc1	ZINC000565708620	316359895	/nfs/dbraw/zinc/35/98/95/316359895.db2.gz	LDTUUCFTVXBTNE-UWJYYQICSA-N	0	3	336.435	3.100	20	30		EGEDHN
C=CC[C@H](C)NCc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-]	ZINC000272254400	455893734	/nfs/dbraw/zinc/89/37/34/455893734.db2.gz	CKEPANOPXHFSMF-JTQLQIEISA-N	0	3	330.331	3.302	20	30		EGEDHN
CCc1ccccc1C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000157664594	455218946	/nfs/dbraw/zinc/21/89/46/455218946.db2.gz	OIBCIIBWEOUJCB-UHFFFAOYSA-N	0	3	335.451	3.325	20	30		EGEDHN
C[C@H](NCC(=O)Nc1ccc(C#N)cc1)c1cccc(N2CCCC2)c1	ZINC000181876585	323509648	/nfs/dbraw/zinc/50/96/48/323509648.db2.gz	MZXAQHSDTVSHGV-INIZCTEOSA-N	0	3	348.450	3.448	20	30		EGEDHN
N#Cc1cc(Br)ccc1CN[C@@H](CO)C1CCCCC1	ZINC000386059684	324265487	/nfs/dbraw/zinc/26/54/87/324265487.db2.gz	AZECAMVGUUTMDV-INIZCTEOSA-N	0	3	337.261	3.352	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@H]1Nc1nc2c(cc1C#N)CCC2	ZINC000389796981	324280308	/nfs/dbraw/zinc/28/03/08/324280308.db2.gz	UTWGQGPKXXLYJE-FOIQADDNSA-N	0	3	332.451	3.374	20	30		EGEDHN
C[C@H]1C[C@H]1N1CCN(C(=O)c2ccc(Cl)c(C#N)c2)C[C@@H](C)C1	ZINC000579020231	325051773	/nfs/dbraw/zinc/05/17/73/325051773.db2.gz	FMHJXXQFQFBECO-GDZNZVCISA-N	0	3	331.847	3.014	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCN2CCC(C(F)(F)F)CC2)cc1	ZINC000173010664	455219096	/nfs/dbraw/zinc/21/90/96/455219096.db2.gz	UYHZMFTVEGRVJC-UHFFFAOYSA-N	0	3	325.334	3.161	20	30		EGEDHN
N#CCc1ccc(NC(=O)NCC2CCN(c3ccncc3)CC2)cc1	ZINC000180676976	455225855	/nfs/dbraw/zinc/22/58/55/455225855.db2.gz	YQYDOWZCHGZKEA-UHFFFAOYSA-N	0	3	349.438	3.186	20	30		EGEDHN
C[C@H](C#N)CSc1ccccc1NC(=O)NC[C@H]1CCCN1C	ZINC000264506336	455226676	/nfs/dbraw/zinc/22/66/76/455226676.db2.gz	DPLVWQHBIILQLZ-ZIAGYGMSSA-N	0	3	332.473	3.154	20	30		EGEDHN
C=CCN1CCC(NC(=O)C(F)(F)c2cccc(Cl)c2)CC1	ZINC000264517448	455228740	/nfs/dbraw/zinc/22/87/40/455228740.db2.gz	VNTDZFPQLUQXJG-UHFFFAOYSA-N	0	3	328.790	3.198	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)N1CC[C@H](c2ccccc2OC)C1	ZINC000158101585	455269321	/nfs/dbraw/zinc/26/93/21/455269321.db2.gz	PSEAQAJJCVPMFM-IRXDYDNUSA-N	0	3	328.456	3.074	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCc1ccccc1CN1CCN(CC)CC1	ZINC000190511012	455335941	/nfs/dbraw/zinc/33/59/41/455335941.db2.gz	APZSJXUGJYVOSU-NRFANRHFSA-N	0	3	343.515	3.043	20	30		EGEDHN
Cc1oc2ccccc2c1CNC[C@@H](O)COc1ccccc1C#N	ZINC000600735694	460584401	/nfs/dbraw/zinc/58/44/01/460584401.db2.gz	PGCQFHPXJPJSRQ-MRXNPFEDSA-N	0	3	336.391	3.142	20	30		EGEDHN
N#Cc1cccc(CN2CCCN(Cc3cccc(C#N)c3)CC2)c1	ZINC000023699233	453716506	/nfs/dbraw/zinc/71/65/06/453716506.db2.gz	VANGBKKFVQEGJC-UHFFFAOYSA-N	0	3	330.435	3.138	20	30		EGEDHN
CSc1ccc([C@H](C)NC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000030534649	453836385	/nfs/dbraw/zinc/83/63/85/453836385.db2.gz	BLCCNPSERVJKTG-YOEHRIQHSA-N	0	3	342.464	3.371	20	30		EGEDHN
C[C@H](NC(=O)NCc1ccc(CN(C)C)cc1)c1ccc(C#N)cc1	ZINC000031105945	453838849	/nfs/dbraw/zinc/83/88/49/453838849.db2.gz	WGNXNHYFICDCGO-HNNXBMFYSA-N	0	3	336.439	3.180	20	30		EGEDHN
Cc1cccc([C@H](CNCc2cccc(C#N)c2)N2CCOCC2)c1	ZINC000030915609	453841470	/nfs/dbraw/zinc/84/14/70/453841470.db2.gz	FGIOYTKADGINMG-NRFANRHFSA-N	0	3	335.451	3.030	20	30		EGEDHN
Cc1ncc(CO)c(/C=N/Cc2ccccc2C[N@@H+](C)C(C)C)c1[O-]	ZINC000031643407	453850477	/nfs/dbraw/zinc/85/04/77/453850477.db2.gz	QEBJZMWLIJMZDM-SRZZPIQSSA-N	0	3	341.455	3.047	20	30		EGEDHN
Cc1ncc(CO)c(/C=N/Cc2ccccc2C[N@H+](C)C(C)C)c1[O-]	ZINC000031643407	453850479	/nfs/dbraw/zinc/85/04/79/453850479.db2.gz	QEBJZMWLIJMZDM-SRZZPIQSSA-N	0	3	341.455	3.047	20	30		EGEDHN
C=C(C)COc1cccc(NC(=O)N2CC[C@@H](N3CCCC3)C2)c1	ZINC000067320803	453921651	/nfs/dbraw/zinc/92/16/51/453921651.db2.gz	JAAUUJAEACZPLJ-QGZVFWFLSA-N	0	3	329.444	3.344	20	30		EGEDHN
N#Cc1cccc(OCCN2CC[C@@H](COCc3ccccc3)C2)c1	ZINC000075866521	453934546	/nfs/dbraw/zinc/93/45/46/453934546.db2.gz	PTHQKTYZGSZEDO-HXUWFJFHSA-N	0	3	336.435	3.476	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN[C@H](C)c1cccc(N2CCCC2)c1	ZINC000181878955	455392825	/nfs/dbraw/zinc/39/28/25/455392825.db2.gz	XNDNBNBIRWUFPI-QGZVFWFLSA-N	0	3	327.472	3.138	20	30		EGEDHN
CCOC(=O)c1csc(C(C#N)C(=O)c2ccc(C)cc2C)n1	ZINC000067895296	453978027	/nfs/dbraw/zinc/97/80/27/453978027.db2.gz	LJRJGZMBKKORTG-ZDUSSCGKSA-N	0	3	328.393	3.427	20	30		EGEDHN
CC(=O)N1CCCN(Cc2ccc(-c3ccccc3C#N)cc2)CC1	ZINC000055374834	453979017	/nfs/dbraw/zinc/97/90/17/453979017.db2.gz	HVVSUOPIIMWBHE-UHFFFAOYSA-N	0	3	333.435	3.279	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2CCC[C@H]2CN2CCCCC2)cc1	ZINC000068133202	453999917	/nfs/dbraw/zinc/99/99/17/453999917.db2.gz	LVYGWNLGGJXPRX-SFHVURJKSA-N	0	3	328.456	3.342	20	30		EGEDHN
N#CCc1cccc(C(=O)NC[C@@H](c2cccs2)N2CCCC2)c1	ZINC000042378909	454008578	/nfs/dbraw/zinc/00/85/78/454008578.db2.gz	MAUZLFHFFYIAEN-KRWDZBQOSA-N	0	3	339.464	3.381	20	30		EGEDHN
COc1cc(OC)cc(OCCCNCc2cc(C#N)cs2)c1	ZINC000084959653	454017540	/nfs/dbraw/zinc/01/75/40/454017540.db2.gz	QWHZYSANHXFPAR-UHFFFAOYSA-N	0	3	332.425	3.196	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)cc1)C[C@@H](O)COc1ccc(C#N)cc1	ZINC000069071201	454077242	/nfs/dbraw/zinc/07/72/42/454077242.db2.gz	QSROJPASIBCJDK-HXUWFJFHSA-N	0	3	349.434	3.080	20	30		EGEDHN
C=CCN(Cc1ccccc1F)C(=O)NC1CCN(C2CC2)CC1	ZINC000056828991	454083124	/nfs/dbraw/zinc/08/31/24/454083124.db2.gz	RPWJMWGHODMGFF-UHFFFAOYSA-N	0	3	331.435	3.150	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Cc1csc(CC)n1)C(C)C	ZINC000056969085	454093261	/nfs/dbraw/zinc/09/32/61/454093261.db2.gz	MHOULOLOBUJIRD-INIZCTEOSA-N	0	3	335.517	3.063	20	30		EGEDHN
N#Cc1ccc(NC2CCN([C@H]3CCOC3)CC2)c(C(F)(F)F)c1	ZINC000089603114	454166767	/nfs/dbraw/zinc/16/67/67/454166767.db2.gz	WRRVOPAPUHDYKB-AWEZNQCLSA-N	0	3	339.361	3.242	20	30		EGEDHN
CN(Cc1cn(CCC#N)nc1-c1ccccc1)[C@@H]1CCSC1	ZINC000130500583	454201929	/nfs/dbraw/zinc/20/19/29/454201929.db2.gz	RGKHUPODDJNLIR-QGZVFWFLSA-N	0	3	326.469	3.401	20	30		EGEDHN
Cc1cc(C)c(C#N)c(SC[C@H](O)CN(C)Cc2ccccc2)n1	ZINC000060368079	454282216	/nfs/dbraw/zinc/28/22/16/454282216.db2.gz	OXDLCHDSNUSDHW-QGZVFWFLSA-N	0	3	341.480	3.155	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)c1ccc(Cl)s1	ZINC000060575805	454303523	/nfs/dbraw/zinc/30/35/23/454303523.db2.gz	DESWOLKPKAPEIC-UHFFFAOYSA-N	0	3	347.871	3.477	20	30		EGEDHN
Cc1ccc(C(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)c(C)c1	ZINC000047010834	454318434	/nfs/dbraw/zinc/31/84/34/454318434.db2.gz	GTXBKTNNPKUYCA-UHFFFAOYSA-N	0	3	335.451	3.379	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2CCc3c2cccc3OC)CC1	ZINC000120593853	454323042	/nfs/dbraw/zinc/32/30/42/454323042.db2.gz	RCGNYJIJFOAAPP-GOSISDBHSA-N	0	3	343.471	3.022	20	30		EGEDHN
N#CCc1cccc(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)c1	ZINC000078820391	454324784	/nfs/dbraw/zinc/32/47/84/454324784.db2.gz	VNWCJUCXEAPEJO-FQEVSTJZSA-N	0	3	333.435	3.320	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](CCC#N)c2ccccc2)CC1	ZINC000132797971	454366421	/nfs/dbraw/zinc/36/64/21/454366421.db2.gz	PYQZCSYTNUXQAJ-IBGZPJMESA-N	0	3	340.471	3.371	20	30		EGEDHN
C=CCN(CC=C)C(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000079168494	454377212	/nfs/dbraw/zinc/37/72/12/454377212.db2.gz	MTNATUMMVSMNTF-UHFFFAOYSA-N	0	3	327.472	3.343	20	30		EGEDHN
C=CCN(Cc1ccc(Cl)s1)C(=O)C[C@@H]1CSCCN1	ZINC000091135648	454388222	/nfs/dbraw/zinc/38/82/22/454388222.db2.gz	ZSEQTYGVFAKGTN-LLVKDONJSA-N	0	3	330.906	3.011	20	30		EGEDHN
N#CCSc1cccc(C(=O)N2CCC[C@@H]2CN2CCCC2)c1	ZINC000079536935	454433225	/nfs/dbraw/zinc/43/32/25/454433225.db2.gz	QXWCVNZDLDGNEW-MRXNPFEDSA-N	0	3	329.469	3.003	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2oc(-c3ccccc3)nc2C)CC1	ZINC000073436766	454436405	/nfs/dbraw/zinc/43/64/05/454436405.db2.gz	AAHCFDXFRGJDOQ-UHFFFAOYSA-N	0	3	325.412	3.030	20	30		EGEDHN
N#CC1(NC(=O)CN[C@@H]2CCC[C@@H]2c2ccccc2)CCCCC1	ZINC000133586620	454442325	/nfs/dbraw/zinc/44/23/25/454442325.db2.gz	RBGTUJFWJOVZRI-QZTJIDSGSA-N	0	3	325.456	3.255	20	30		EGEDHN
CCOC1CCN(Cc2cn(CCC#N)nc2-c2ccccc2)CC1	ZINC000091676639	454456237	/nfs/dbraw/zinc/45/62/37/454456237.db2.gz	WPNAWELVUMVVSR-UHFFFAOYSA-N	0	3	338.455	3.465	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)NCCCCC#N)CCN1Cc1ccccc1	ZINC000080115879	454536096	/nfs/dbraw/zinc/53/60/96/454536096.db2.gz	XQPSVMIZNWRMRY-AEFFLSMTSA-N	0	3	328.460	3.033	20	30		EGEDHN
Cc1c(C(=O)C(C#N)c2cc(C)nc(C)n2)cnn1-c1ccccc1	ZINC000049405439	454546978	/nfs/dbraw/zinc/54/69/78/454546978.db2.gz	FQOJNABCDITHCC-INIZCTEOSA-N	0	3	331.379	3.078	20	30		EGEDHN
CC[C@H](CNC(=O)c1cccc(CC#N)c1)N1CCc2ccccc2C1	ZINC000049676306	454555927	/nfs/dbraw/zinc/55/59/27/454555927.db2.gz	ZGFHGFOKNVYKHA-OAQYLSRUSA-N	0	3	347.462	3.319	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)C(=O)Nc1ccccn1)c1ccc(F)cc1	ZINC000103717467	454565072	/nfs/dbraw/zinc/56/50/72/454565072.db2.gz	PNMKKOHWQDTUTQ-WFASDCNBSA-N	0	3	325.343	3.062	20	30		EGEDHN
Cc1cccc(C2(NCC(=O)N[C@](C)(C#N)C(C)C)CCCC2)c1	ZINC000104076757	454574464	/nfs/dbraw/zinc/57/44/64/454574464.db2.gz	ZEDFGNFPDFXPRS-LJQANCHMSA-N	0	3	327.472	3.408	20	30		EGEDHN
N#Cc1csc(CNCCOc2ncccc2C(F)(F)F)c1	ZINC000122865491	454575977	/nfs/dbraw/zinc/57/59/77/454575977.db2.gz	DXTZZIKHDJAOKM-UHFFFAOYSA-N	0	3	327.331	3.202	20	30		EGEDHN
N#CC(C(=O)CCc1c[nH]c2ccccc12)C(=O)NC1CCCCC1	ZINC000050678892	454594198	/nfs/dbraw/zinc/59/41/98/454594198.db2.gz	HZXFXMSXYCDQIE-QGZVFWFLSA-N	0	3	337.423	3.258	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN(C)C[C@H]1CCCO[C@@H]1c1ccccc1	ZINC000051133404	454610306	/nfs/dbraw/zinc/61/03/06/454610306.db2.gz	BOUHFABZLTWBPN-TZIWHRDSSA-N	0	3	342.483	3.287	20	30		EGEDHN
CCCCNC(=O)[C@H]1CC[C@@H](C)N(Cc2ccc(OC)c(C#N)c2)C1	ZINC000135005364	454623301	/nfs/dbraw/zinc/62/33/01/454623301.db2.gz	CIBOQHCVIJVEGX-WBVHZDCISA-N	0	3	343.471	3.084	20	30		EGEDHN
C=C(C)Cn1c(SCCN2CCCCC2)nnc1-c1ccncc1	ZINC000123327432	454626005	/nfs/dbraw/zinc/62/60/05/454626005.db2.gz	NLZNKUZQBASVMG-UHFFFAOYSA-N	0	3	343.500	3.494	20	30		EGEDHN
CN(CCC1CCN(c2ccncc2)CC1)C[C@@H](C#N)CCC#N	ZINC000092820955	454639474	/nfs/dbraw/zinc/63/94/74/454639474.db2.gz	YFUFQJFEQZAXIC-GOSISDBHSA-N	0	3	325.460	3.063	20	30		EGEDHN
Cc1cccc(C2=CCN(C[C@H](O)COc3ccc(C#N)cc3)CC2)c1	ZINC000092822230	454641734	/nfs/dbraw/zinc/64/17/34/454641734.db2.gz	QQNZIGBFIZSBAN-NRFANRHFSA-N	0	3	348.446	3.396	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CCC[C@H]1[C@H](O)C(F)(F)F	ZINC000135205956	454645719	/nfs/dbraw/zinc/64/57/19/454645719.db2.gz	ICRXFMAEAMFNLM-GJZGRUSLSA-N	0	3	326.362	3.375	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CCC[C@H](N2CCCC2=O)C1	ZINC000135217175	454647015	/nfs/dbraw/zinc/64/70/15/454647015.db2.gz	OAWJNDJYUNPWEW-KRWDZBQOSA-N	0	3	325.456	3.075	20	30		EGEDHN
COC(=O)CCN(Cc1ccccc1C(C)(C)C#N)C[C@@H]1CCCO1	ZINC000135232207	454649821	/nfs/dbraw/zinc/64/98/21/454649821.db2.gz	JUGWXNDJHVQSLM-KRWDZBQOSA-N	0	3	344.455	3.032	20	30		EGEDHN
CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1cccc(C#N)c1	ZINC000123744511	454670937	/nfs/dbraw/zinc/67/09/37/454670937.db2.gz	GMWAMGCWRORWPT-HXUWFJFHSA-N	0	3	348.450	3.080	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc3oc(C)nc3c2)CC1	ZINC000106341215	454691932	/nfs/dbraw/zinc/69/19/32/454691932.db2.gz	QCTHCKOEUCBBKQ-UHFFFAOYSA-N	0	3	328.416	3.298	20	30		EGEDHN
N#Cc1ccc(N2CCC(NCc3cc(F)c(F)cc3F)CC2)nc1	ZINC000136028490	454715371	/nfs/dbraw/zinc/71/53/71/454715371.db2.gz	CJGUTWBOHNXZTL-UHFFFAOYSA-N	0	3	346.356	3.129	20	30		EGEDHN
Cc1cc(C)cc(N(CCC#N)C(=O)CN2C[C@@H]3CCC[C@H]3C2)c1	ZINC000152812094	454729308	/nfs/dbraw/zinc/72/93/08/454729308.db2.gz	TUWDMTVILMIZIS-ROUUACIJSA-N	0	3	325.456	3.282	20	30		EGEDHN
CCN(C[C@@H]1CCN(Cc2cccc(C#N)c2)C1)CC(F)(F)F	ZINC000176401584	454740436	/nfs/dbraw/zinc/74/04/36/454740436.db2.gz	JVLGVRIGDVVEQJ-INIZCTEOSA-N	0	3	325.378	3.264	20	30		EGEDHN
C=CCN(CC=C)C(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000175641297	455475258	/nfs/dbraw/zinc/47/52/58/455475258.db2.gz	FHKQYQMABUWFGM-HKUYNNGSSA-N	0	3	327.472	3.423	20	30		EGEDHN
C=CC1CCN(C(=O)N[C@H](CN2CCCC2)c2ccccc2)CC1	ZINC000111819184	454876834	/nfs/dbraw/zinc/87/68/34/454876834.db2.gz	YIHMJRKHBMWAOK-LJQANCHMSA-N	0	3	327.472	3.431	20	30		EGEDHN
C[C@@H](NCC1(Sc2ccccc2)CCCC1)C(=O)N(C)CCC#N	ZINC000112546442	454890417	/nfs/dbraw/zinc/89/04/17/454890417.db2.gz	ZXPAODNEQXVNLT-MRXNPFEDSA-N	0	3	345.512	3.442	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H]2C[C@@H]2c2ccc(F)cc2F)CC1	ZINC000112905829	454905495	/nfs/dbraw/zinc/90/54/95/454905495.db2.gz	HFUDPFBOIFDQKB-SJORKVTESA-N	0	3	334.410	3.225	20	30		EGEDHN
C#CCN(C(=O)NC1CCN(Cc2ccccc2)CC1)C1CCCC1	ZINC000150933295	454914106	/nfs/dbraw/zinc/91/41/06/454914106.db2.gz	QWXMVBBFZDVIOO-UHFFFAOYSA-N	0	3	339.483	3.238	20	30		EGEDHN
C#CCC(C)(C)C(=O)NC[C@@H](c1cccc(OC)c1)N(CC)CC	ZINC000185037243	455489911	/nfs/dbraw/zinc/48/99/11/455489911.db2.gz	JAZUETNVFHJGCE-SFHVURJKSA-N	0	3	330.472	3.244	20	30		EGEDHN
N#Cc1ccccc1CSCCNCc1ccccc1[N+](=O)[O-]	ZINC000170670653	454952566	/nfs/dbraw/zinc/95/25/66/454952566.db2.gz	NNKKMLNYQHETRK-UHFFFAOYSA-N	0	3	327.409	3.489	20	30		EGEDHN
COc1cccc(C[NH2+]CCSCc2ccccc2C#N)c1[O-]	ZINC000171128778	455034535	/nfs/dbraw/zinc/03/45/35/455034535.db2.gz	CUNVTFYXIKSXSW-UHFFFAOYSA-N	0	3	328.437	3.295	20	30		EGEDHN
C[C@@H]1CCC[C@](C#N)(NC(=O)[C@@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000116808674	455071018	/nfs/dbraw/zinc/07/10/18/455071018.db2.gz	UHMRTEAPKFDUNJ-QFUCXCTJSA-N	0	3	339.483	3.487	20	30		EGEDHN
CN(CCC#N)c1ccc(CNCc2ccc(OCC#N)cc2)cc1	ZINC000171769816	455092719	/nfs/dbraw/zinc/09/27/19/455092719.db2.gz	RBIGWBWEYHPLTA-UHFFFAOYSA-N	0	3	334.423	3.229	20	30		EGEDHN
Cn1cc(CN2CCN(C3CCCC3)CC2)c(-c2ccc(C#N)cc2)n1	ZINC000179914501	455098167	/nfs/dbraw/zinc/09/81/67/455098167.db2.gz	GLOHZVOMUSZAIU-UHFFFAOYSA-N	0	3	349.482	3.019	20	30		EGEDHN
C[C@H]1CN(C[C@@H]2CCCN2CC#Cc2cccc(Cl)c2)C[C@H](C)O1	ZINC000156364165	455110099	/nfs/dbraw/zinc/11/00/99/455110099.db2.gz	DLHNFMCPASEGCC-ZWOKBUDYSA-N	0	3	346.902	3.265	20	30		EGEDHN
FC(F)(F)Oc1ccc(C#CCN2CCC(n3ccnc3)CC2)cc1	ZINC000156440714	455118392	/nfs/dbraw/zinc/11/83/92/455118392.db2.gz	NMWZJVVKXDAIBB-UHFFFAOYSA-N	0	3	349.356	3.470	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)Nc1ccc(OCCN2CCCC2)c(C)c1	ZINC000119142856	455128367	/nfs/dbraw/zinc/12/83/67/455128367.db2.gz	SCBIZYYTRIFXMH-KRWDZBQOSA-N	0	3	346.471	3.389	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cccc(-c3nc(C)cs3)c2)CC1	ZINC000172542773	455161312	/nfs/dbraw/zinc/16/13/12/455161312.db2.gz	RMXNHXRFPQKATF-UHFFFAOYSA-N	0	3	341.480	3.499	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](CC)c2cc(F)ccc2F)CC1	ZINC000172703067	455175771	/nfs/dbraw/zinc/17/57/71/455175771.db2.gz	YCKCIYYVNFWRGB-QGZVFWFLSA-N	0	3	337.414	3.366	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](CC)c2cc(F)ccc2F)CC1	ZINC000172703064	455176191	/nfs/dbraw/zinc/17/61/91/455176191.db2.gz	YCKCIYYVNFWRGB-KRWDZBQOSA-N	0	3	337.414	3.366	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCCc2cccc(Cl)c2)CC1	ZINC000264366341	455199165	/nfs/dbraw/zinc/19/91/65/455199165.db2.gz	HXPJNQWHNFFARM-UHFFFAOYSA-N	0	3	335.879	3.222	20	30		EGEDHN
N#Cc1cc(NC[C@@H](c2ccco2)N2CCCC2)ccc1[N+](=O)[O-]	ZINC000157536044	455204796	/nfs/dbraw/zinc/20/47/96/455204796.db2.gz	BOBRPDCEEAUQHB-INIZCTEOSA-N	0	3	326.356	3.308	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC[C@H]2CCCc3ccccc32)CC1	ZINC000264444881	455214095	/nfs/dbraw/zinc/21/40/95/455214095.db2.gz	XNIMSAQREUZQPH-QGZVFWFLSA-N	0	3	327.472	3.056	20	30		EGEDHN
C=C(C)CS(=O)(=O)NCc1ccccc1CN1CCCC[C@@H]1C	ZINC000189532695	455215622	/nfs/dbraw/zinc/21/56/22/455215622.db2.gz	WMRQJQINYAKULZ-INIZCTEOSA-N	0	3	336.501	3.057	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CC[C@H](c3ccccc3F)C2)CC1	ZINC000264460765	455217750	/nfs/dbraw/zinc/21/77/50/455217750.db2.gz	RITLLOWHSCBYSC-INIZCTEOSA-N	0	3	345.462	3.365	20	30		EGEDHN
COc1ccc(O)c(/C=N/C2CCN([C@H](C)c3ccncc3)CC2)c1	ZINC000158273263	455286906	/nfs/dbraw/zinc/28/69/06/455286906.db2.gz	BBAYTARXVAFBGX-QQHUYRGFSA-N	0	3	339.439	3.440	20	30		EGEDHN
C[C@@H](c1ccc(C#N)cc1)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000245430524	455296943	/nfs/dbraw/zinc/29/69/43/455296943.db2.gz	AFPIDMQHPLOAMF-XJKSGUPXSA-N	0	3	337.383	3.109	20	30		EGEDHN
CC#CCCCC(=O)NCC1(N[C@H](C)c2ccccc2)CCOCC1	ZINC000183994204	455346755	/nfs/dbraw/zinc/34/67/55/455346755.db2.gz	OLNVCEDXJGHHMI-GOSISDBHSA-N	0	3	342.483	3.196	20	30		EGEDHN
C[C@@H]1C[C@@H](N(C)C(=O)Nc2ccc(C(C)(C)C#N)cc2)CCN1C	ZINC000174904554	455417885	/nfs/dbraw/zinc/41/78/85/455417885.db2.gz	WQXDLCOQJXKFFU-PBHICJAKSA-N	0	3	328.460	3.434	20	30		EGEDHN
C[C@H]1C[C@H](N(C)C(=O)Nc2ccc(C(C)(C)C#N)cc2)CCN1C	ZINC000174904534	455418146	/nfs/dbraw/zinc/41/81/46/455418146.db2.gz	WQXDLCOQJXKFFU-WMLDXEAASA-N	0	3	328.460	3.434	20	30		EGEDHN
COc1cc(OC)cc(OCCN[C@H](C)c2cccc(C#N)c2)c1	ZINC000182020526	455418381	/nfs/dbraw/zinc/41/83/81/455418381.db2.gz	YZAFQLAGIGSKCY-CQSZACIVSA-N	0	3	326.396	3.305	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1CC2(CCN(C)CC2)Oc2ccccc21	ZINC000175227952	455428215	/nfs/dbraw/zinc/42/82/15/455428215.db2.gz	JXLAJHOBGDEZGI-KRWDZBQOSA-N	0	3	328.456	3.447	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)Nc2ccc(Br)cc2)n1	ZINC000160129167	455430353	/nfs/dbraw/zinc/43/03/53/455430353.db2.gz	LRMIGQFCHTVTAL-LLVKDONJSA-N	0	3	336.214	3.460	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)CC1	ZINC000191356375	455480267	/nfs/dbraw/zinc/48/02/67/455480267.db2.gz	QRCPKKLCTIAHSB-UHFFFAOYSA-N	0	3	346.431	3.374	20	30		EGEDHN
C=CCN(Cc1ccccc1F)C(=O)N[C@@H]1CCN(CC2CC2)C1	ZINC000160680445	455486786	/nfs/dbraw/zinc/48/67/86/455486786.db2.gz	DXCCPKBYGGAXIL-QGZVFWFLSA-N	0	3	331.435	3.008	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCc1ccc(CN2CCN(CC)CC2)cc1	ZINC000185167811	455515326	/nfs/dbraw/zinc/51/53/26/455515326.db2.gz	WDJWKEMODHOGSF-SFHVURJKSA-N	0	3	343.515	3.043	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)c1cccc(C#N)c1	ZINC000267348432	455543787	/nfs/dbraw/zinc/54/37/87/455543787.db2.gz	CMXQBIZZYFMVEI-OXQOHEQNSA-N	0	3	333.435	3.199	20	30		EGEDHN
C[C@H](NC[C@@H](O)COc1ccc(C#N)cc1)c1cc2ccccc2o1	ZINC000182634529	455556974	/nfs/dbraw/zinc/55/69/74/455556974.db2.gz	COVCBZFZTJDQQH-WMLDXEAASA-N	0	3	336.391	3.395	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@H](C)N1CC[C@@H](COCc2ccccc2)C1	ZINC000247646402	455633157	/nfs/dbraw/zinc/63/31/57/455633157.db2.gz	ULOLBDBKPLLMIE-AZUAARDMSA-N	0	3	344.499	3.338	20	30		EGEDHN
C=CCN(CCC(=O)Nc1sc2c(c1C#N)CCCC2)C1CC1	ZINC000271449600	455640431	/nfs/dbraw/zinc/64/04/31/455640431.db2.gz	NVAJZZHJFFTUCJ-UHFFFAOYSA-N	0	3	329.469	3.478	20	30		EGEDHN
C=CCn1c(=O)c2ccccc2nc1SCCN1CCCCC1	ZINC000247984830	455666348	/nfs/dbraw/zinc/66/63/48/455666348.db2.gz	ILQVSXAGIFPJDW-UHFFFAOYSA-N	0	3	329.469	3.161	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)CN1CCC[C@@]1(C)Cc1ccccc1	ZINC000186041556	455683116	/nfs/dbraw/zinc/68/31/16/455683116.db2.gz	OFSWKEXLMWKOJD-VQTJNVASSA-N	0	3	327.472	3.138	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(c3cccc(Cl)n3)CC2)cc1	ZINC000192769042	455688910	/nfs/dbraw/zinc/68/89/10/455688910.db2.gz	HTPRNPQXISDMGM-UHFFFAOYSA-N	0	3	326.831	3.319	20	30		EGEDHN
C[C@H](NC[C@@H](O)COc1cccc2[nH]ccc21)c1ccc(C#N)cc1	ZINC000268462249	455689760	/nfs/dbraw/zinc/68/97/60/455689760.db2.gz	UWWLGWDVDRVKJP-WMLDXEAASA-N	0	3	335.407	3.130	20	30		EGEDHN
COc1cccc([C@@H](C)NCCOc2ccc(C#N)cc2OC)c1	ZINC000271614841	455701169	/nfs/dbraw/zinc/70/11/69/455701169.db2.gz	CEUQJAPBDOUXBW-CQSZACIVSA-N	0	3	326.396	3.305	20	30		EGEDHN
CC[C@@H](CSC)N(C)[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000248733533	455728380	/nfs/dbraw/zinc/72/83/80/455728380.db2.gz	KCCRNNCLYGQJGS-RDJZCZTQSA-N	0	3	331.485	3.127	20	30		EGEDHN
CCN1CCO[C@@H](CN[C@H]2CCC[C@H](C#N)C2)[C@@H]1c1ccccc1	ZINC000284751325	455736403	/nfs/dbraw/zinc/73/64/03/455736403.db2.gz	YVKPIZMJKYKVQM-LEAZDLGRSA-N	0	3	327.472	3.120	20	30		EGEDHN
N#C[C@@H]1CCC[C@@H](N[C@H]2CCN(c3ccc(F)c(Cl)c3)C2=O)C1	ZINC000248927116	455739192	/nfs/dbraw/zinc/73/91/92/455739192.db2.gz	XIFJLEHDFIBMFW-HSMVNMDESA-N	0	3	335.810	3.256	20	30		EGEDHN
Cc1ccc(CN[C@@H]2CCC[C@@H](C#N)C2)c(-n2cc(Cl)cn2)n1	ZINC000193338088	455752671	/nfs/dbraw/zinc/75/26/71/455752671.db2.gz	WEOCLROVMOBQGW-CZUORRHYSA-N	0	3	329.835	3.401	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@@H](C)N1CC[C@@H](c2ccc(OC)cc2)C1	ZINC000249861670	455779891	/nfs/dbraw/zinc/77/98/91/455779891.db2.gz	GFMSGKGWUCTHBI-SJLPKXTDSA-N	0	3	328.456	3.074	20	30		EGEDHN
CC[C@@](C)(C#N)C(=O)N[C@H]1CC2(CCN(C)CC2)Oc2ccccc21	ZINC000285109908	455791215	/nfs/dbraw/zinc/79/12/15/455791215.db2.gz	JTAZCQWYWYNXGA-LPHOPBHVSA-N	0	3	341.455	3.031	20	30		EGEDHN
COc1ccc(CN2CC[C@@H](O)C23CCCC3)cc1OCCCC#N	ZINC000293783009	455796834	/nfs/dbraw/zinc/79/68/34/455796834.db2.gz	BYJFWZLQLPRYKV-LJQANCHMSA-N	0	3	344.455	3.257	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)CSCC#N)N(CC)CC)cc1	ZINC000294676707	455824060	/nfs/dbraw/zinc/82/40/60/455824060.db2.gz	SOZFQTYBPCWVHK-QGZVFWFLSA-N	0	3	333.501	3.005	20	30		EGEDHN
CC[C@H](NC[C@H](O)COc1ccc(F)c(F)c1)c1ccc(C#N)cc1	ZINC000278672727	455844447	/nfs/dbraw/zinc/84/44/47/455844447.db2.gz	JGKZNHSALKIBLI-KXBFYZLASA-N	0	3	346.377	3.317	20	30		EGEDHN
C[C@@H]1CN(C2CCOCC2)CCN1Cc1ccccc1C(C)(C)C#N	ZINC000278705147	455845906	/nfs/dbraw/zinc/84/59/06/455845906.db2.gz	QPSBCFNMXAFZBK-QGZVFWFLSA-N	0	3	341.499	3.173	20	30		EGEDHN
CC[C@@H](NCc1ccccc1CS(C)(=O)=O)c1ccc(C#N)cc1	ZINC000278744915	455846838	/nfs/dbraw/zinc/84/68/38/455846838.db2.gz	NLSCYVWUPHAROI-LJQANCHMSA-N	0	3	342.464	3.344	20	30		EGEDHN
CC[C@H](NCc1ccnc(OCCN(C)C)c1)c1ccc(C#N)cc1	ZINC000278886587	455851625	/nfs/dbraw/zinc/85/16/25/455851625.db2.gz	YHPJCVACYNEIHK-IBGZPJMESA-N	0	3	338.455	3.135	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)C2CCN(C3CC3)CC2)cc1	ZINC000194562432	455858914	/nfs/dbraw/zinc/85/89/14/455858914.db2.gz	OGRFOHXXMIGBHG-UHFFFAOYSA-N	0	3	341.455	3.206	20	30		EGEDHN
C#CCCCCNC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F	ZINC000285500951	455859454	/nfs/dbraw/zinc/85/94/54/455859454.db2.gz	AIKROJKLFDXXME-QGZVFWFLSA-N	0	3	334.410	3.064	20	30		EGEDHN
Cc1nccn1CCCN1CCC(Oc2ccc(C#N)cc2F)CC1	ZINC000285586525	455875969	/nfs/dbraw/zinc/87/59/69/455875969.db2.gz	VPPRTZCZRLULKE-UHFFFAOYSA-N	0	3	342.418	3.136	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NC1CCN(Cc2ccccc2)CC1)OCC	ZINC000270152530	455889925	/nfs/dbraw/zinc/88/99/25/455889925.db2.gz	WHNBRGPLFXAGHM-IBGZPJMESA-N	0	3	330.472	3.139	20	30		EGEDHN
C[C@@H](N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O)c1cccc(C#N)c1	ZINC000272255744	455893647	/nfs/dbraw/zinc/89/36/47/455893647.db2.gz	WCPQQVIREOJLHH-FOIQADDNSA-N	0	3	344.418	3.276	20	30		EGEDHN
C[C@@H](CN[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O)c1ccccc1	ZINC000194891932	455897498	/nfs/dbraw/zinc/89/74/98/455897498.db2.gz	NLWLKNMEXQZXKE-JXFKEZNVSA-N	0	3	333.435	3.052	20	30		EGEDHN
C#CCN(Cc1ccccc1)CC1CCN(C(=O)C(C)(C)C)CC1	ZINC000285782057	455914540	/nfs/dbraw/zinc/91/45/40/455914540.db2.gz	SQNGPDKOYADHQX-UHFFFAOYSA-N	0	3	326.484	3.407	20	30		EGEDHN
C[C@H](c1ccc(OCC#N)cc1)N1CCC[C@H](CC(C)(C)C(N)=O)C1	ZINC000296393566	455926372	/nfs/dbraw/zinc/92/63/72/455926372.db2.gz	KEXPFFOWHGAHJT-HZPDHXFCSA-N	0	3	343.471	3.264	20	30		EGEDHN
CN(C)CCN(Cc1cccs1)C(=O)c1ccc(CC#N)cc1	ZINC000270336744	455931818	/nfs/dbraw/zinc/93/18/18/455931818.db2.gz	DAJRHXKPFFDOCJ-UHFFFAOYSA-N	0	3	327.453	3.018	20	30		EGEDHN
C#CC[C@H](NC(=O)N1CC[C@H](N2CCCCC2)C1)c1ccccc1	ZINC000270403825	455948023	/nfs/dbraw/zinc/94/80/23/455948023.db2.gz	KAWORPDATHNZGS-OALUTQOASA-N	0	3	325.456	3.021	20	30		EGEDHN
C=C(C)[C@@H](NC[C@@H](O)COCc1ccco1)c1ccc(F)c(F)c1	ZINC000187786093	455952851	/nfs/dbraw/zinc/95/28/51/455952851.db2.gz	QWBHUIQLBSZREC-RDTXWAMCSA-N	0	3	337.366	3.342	20	30		EGEDHN
CC(C)N1CCN(C2CCN(c3c(Cl)cccc3C#N)CC2)CC1	ZINC000270458832	455959323	/nfs/dbraw/zinc/95/93/23/455959323.db2.gz	KOXYZIDIJIKMHH-UHFFFAOYSA-N	0	3	346.906	3.206	20	30		EGEDHN
C=CCOc1cccc(NC(=O)N2CC[C@@]3(C2)CCCN(C)C3)c1	ZINC000296617686	455990428	/nfs/dbraw/zinc/99/04/28/455990428.db2.gz	WHJWWLYFYRNWHY-IBGZPJMESA-N	0	3	329.444	3.201	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(OC(C)C)cc2Cl)CC1	ZINC000188327593	456044033	/nfs/dbraw/zinc/04/40/33/456044033.db2.gz	XPMINDMGOCZXMN-UHFFFAOYSA-N	0	3	334.847	3.411	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H](C)[C@H](O)c2ccccc2)cc1OC	ZINC000288528579	456098379	/nfs/dbraw/zinc/09/83/79/456098379.db2.gz	KATJLRKYIPFRAX-YWZLYKJASA-N	0	3	327.424	3.472	20	30		EGEDHN
CC#CCCCc1nc(-c2ccc(OCCN(C)C)c(OC)c2)no1	ZINC000288853813	456107173	/nfs/dbraw/zinc/10/71/73/456107173.db2.gz	AIZYHJDNRKPHLI-UHFFFAOYSA-N	0	3	343.427	3.032	20	30		EGEDHN
CSC1c2cc(-c3noc(CC(C)(C)C#N)n3)ccc2NC1=O	ZINC000288908454	456108867	/nfs/dbraw/zinc/10/88/67/456108867.db2.gz	KIWWGZFOQQIQKR-ZDUSSCGKSA-N	0	3	328.397	3.185	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)Cc1ccc2c(c1)ncn2C	ZINC000289740888	456139631	/nfs/dbraw/zinc/13/96/31/456139631.db2.gz	INZIJBAOYZXMBH-UHFFFAOYSA-N	0	3	347.466	3.009	20	30		EGEDHN
COC[C@]1(CN[C@@H](C)c2cccc(C#N)c2)OCCc2ccccc21	ZINC000289765962	456140711	/nfs/dbraw/zinc/14/07/11/456140711.db2.gz	LWXSRKYTSLVHMN-KKSFZXQISA-N	0	3	336.435	3.323	20	30		EGEDHN
CN(C)CCOc1ccc(CNc2snc(Cl)c2C#N)cc1	ZINC000263786010	456222865	/nfs/dbraw/zinc/22/28/65/456222865.db2.gz	ZVTSBOOFUCDZMP-UHFFFAOYSA-N	0	3	336.848	3.221	20	30		EGEDHN
Cc1ccc([C@@H](C)[NH2+][C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)c([O-])c1	ZINC000273475493	456233262	/nfs/dbraw/zinc/23/32/62/456233262.db2.gz	SSWURHJMYXCYTA-DNVCBOLYSA-N	0	3	349.434	3.419	20	30		EGEDHN
C=CCN(Cc1ccc(O[C@H](C)C(=O)N(C)C)c(OCC)c1)C1CC1	ZINC000273490320	456235346	/nfs/dbraw/zinc/23/53/46/456235346.db2.gz	NFUCDVGKPFXHHP-OAHLLOKOSA-N	0	3	346.471	3.091	20	30		EGEDHN
COc1cc(CNC[C@](C)(O)c2ccccc2Cl)ccc1C#N	ZINC000281460537	456241172	/nfs/dbraw/zinc/24/11/72/456241172.db2.gz	AWFYGGGNGUSCHB-SFHVURJKSA-N	0	3	330.815	3.218	20	30		EGEDHN
C=CCCCCNC(=O)N(Cc1ccncc1)C[C@H]1CCCN1CC	ZINC000274690923	456263733	/nfs/dbraw/zinc/26/37/33/456263733.db2.gz	UUGODDRCTNTTQV-LJQANCHMSA-N	0	3	344.503	3.434	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N1CC[C@H]2CCN(C)C[C@@H]21)c1ccc(F)c(F)c1	ZINC000274846645	456265785	/nfs/dbraw/zinc/26/57/85/456265785.db2.gz	AAWCAXFLBHASHF-BVGQSLNGSA-N	0	3	349.425	3.318	20	30		EGEDHN
C=C(Cl)COc1ccc([C@@H](C)N[C@@H](C)C(=O)N2CCCC2)cc1	ZINC000281560431	456265979	/nfs/dbraw/zinc/26/59/79/456265979.db2.gz	JTQKKWZCPSMTLT-CABCVRRESA-N	0	3	336.863	3.479	20	30		EGEDHN
Cc1nc2c(c(N(CCN(C)C)Cc3ccc(C#N)cc3)n1)CCCC2	ZINC000302067339	456279079	/nfs/dbraw/zinc/27/90/79/456279079.db2.gz	DESRCHRFOJKZQE-UHFFFAOYSA-N	0	3	349.482	3.104	20	30		EGEDHN
COc1cc(CNC[C@@H](c2ccco2)N2CCCCC2)ccc1C#N	ZINC000281648856	456281845	/nfs/dbraw/zinc/28/18/45/456281845.db2.gz	JQTPGOAWDVTHLM-SFHVURJKSA-N	0	3	339.439	3.477	20	30		EGEDHN
COc1cc(CN(Cc2ccccc2)CC2(CO)CC2)ccc1C#N	ZINC000342865709	456281857	/nfs/dbraw/zinc/28/18/57/456281857.db2.gz	WYWFZIUSXATESX-UHFFFAOYSA-N	0	3	336.435	3.342	20	30		EGEDHN
CN(c1nc2ccccn2c1C#N)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000302138059	456296823	/nfs/dbraw/zinc/29/68/23/456296823.db2.gz	DQCSPMINHXQJPH-SFHVURJKSA-N	0	3	345.450	3.307	20	30		EGEDHN
COc1ccc(CN(C)[C@@H](CO)CC(C)C)cc1OCCCC#N	ZINC000290350667	456302889	/nfs/dbraw/zinc/30/28/89/456302889.db2.gz	GAZQQJSOHGJWOO-QGZVFWFLSA-N	0	3	334.460	3.217	20	30		EGEDHN
C=CCOCCCN[C@@H]1CCOc2c(Br)cccc21	ZINC000337375716	456349669	/nfs/dbraw/zinc/34/96/69/456349669.db2.gz	RKHUPSAUHKSNHC-CQSZACIVSA-N	0	3	326.234	3.455	20	30		EGEDHN
C#C[C@H](NC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1)C(C)C	ZINC000298134161	456371560	/nfs/dbraw/zinc/37/15/60/456371560.db2.gz	YZBFWCCFHBUGEA-SXLOBPIMSA-N	0	3	341.499	3.339	20	30		EGEDHN
Cn1c(CCNCc2ccc(C#N)cc2F)nc2c1cccc2F	ZINC000347810490	456380370	/nfs/dbraw/zinc/38/03/70/456380370.db2.gz	AKEMPFZKTQAXHM-UHFFFAOYSA-N	0	3	326.350	3.055	20	30		EGEDHN
CSc1ccccc1[C@@H](C)NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000282136901	456423476	/nfs/dbraw/zinc/42/34/76/456423476.db2.gz	RRIOGZMDDWTKQT-GDBMZVCRSA-N	0	3	342.464	3.371	20	30		EGEDHN
C=CCOCCCN1C[C@@H](O)C[C@@H]1c1ccc(C(F)(F)F)cc1	ZINC000348047310	456444796	/nfs/dbraw/zinc/44/47/96/456444796.db2.gz	JWFOVHZVKWXAAN-JKSUJKDBSA-N	0	3	329.362	3.406	20	30		EGEDHN
N#Cc1ncn(CCNCc2ccc(-c3ccccc3Cl)s2)n1	ZINC000353036002	456452799	/nfs/dbraw/zinc/45/27/99/456452799.db2.gz	DXUXUFYSCWDQLN-UHFFFAOYSA-N	0	3	343.843	3.321	20	30		EGEDHN
C=CCOc1cccc(CN[C@@H]2CCCN(C(=O)N3CCCC3)C2)c1	ZINC000353039079	456455566	/nfs/dbraw/zinc/45/55/66/456455566.db2.gz	ONFBRGIGTVYLLD-GOSISDBHSA-N	0	3	343.471	3.021	20	30		EGEDHN
C=C(CNCc1c(C)n(C)n(-c2ccccc2)c1=O)c1ccccc1	ZINC000340436856	456460885	/nfs/dbraw/zinc/46/08/85/456460885.db2.gz	GWSDYSLUUMARDP-UHFFFAOYSA-N	0	3	333.435	3.287	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(-c3csc(C)n3)cc2)CC1	ZINC000282420197	456507090	/nfs/dbraw/zinc/50/70/90/456507090.db2.gz	LTCLICVDYZSGIV-UHFFFAOYSA-N	0	3	341.480	3.499	20	30		EGEDHN
COc1cc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)ccc1C#N	ZINC000282507774	456536158	/nfs/dbraw/zinc/53/61/58/456536158.db2.gz	YQROFBPXBSSENY-GOSISDBHSA-N	0	3	349.434	3.052	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N[C@H](CN1CCCC1)c1ccccc1	ZINC000337905315	456595343	/nfs/dbraw/zinc/59/53/43/456595343.db2.gz	UKCVBCKTHRKFHM-HXUWFJFHSA-N	0	3	333.435	3.434	20	30		EGEDHN
CCN1CCO[C@H](CNCc2ccc(C#N)cc2)[C@H]1c1ccccc1	ZINC000343406350	456599497	/nfs/dbraw/zinc/59/94/97/456599497.db2.gz	VAWQCRFHBACYBW-NHCUHLMSSA-N	0	3	335.451	3.110	20	30		EGEDHN
CN(CC(C)(C)C#N)C(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000353289862	456615959	/nfs/dbraw/zinc/61/59/59/456615959.db2.gz	PKAVMVDYRWOCCC-MRXNPFEDSA-N	0	3	331.435	3.046	20	30		EGEDHN
C[C@H](CN1CCOCC1)N(Cc1ccccc1)Cc1ccc(C#N)cc1	ZINC000353328542	456642186	/nfs/dbraw/zinc/64/21/86/456642186.db2.gz	MCRBWQHJBCXSOX-LJQANCHMSA-N	0	3	349.478	3.281	20	30		EGEDHN
Cc1ccc2c(c1)[C@H]1CN(C)CC[C@H]1N2C(=O)c1cccc(C#N)c1	ZINC000299257620	456643587	/nfs/dbraw/zinc/64/35/87/456643587.db2.gz	IHDKNOVCDDJDNJ-UYAOXDASSA-N	0	3	331.419	3.315	20	30		EGEDHN
C[C@@H](NC(=O)C(C#N)Cc1ccc(C#N)cc1)c1cccc(F)c1F	ZINC000348418202	456678086	/nfs/dbraw/zinc/67/80/86/456678086.db2.gz	WUYUJIHAZHGUJT-DOMZBBRYSA-N	0	3	339.345	3.396	20	30		EGEDHN
Cc1ccc(C(=O)NCCN[C@H]2CCc3ccc(C#N)cc32)cc1F	ZINC000353408835	456682108	/nfs/dbraw/zinc/68/21/08/456682108.db2.gz	DLJGHUGJDBPXQH-IBGZPJMESA-N	0	3	337.398	3.013	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCc1ccc(OC2CCN(C)CC2)cc1	ZINC000353453209	456699042	/nfs/dbraw/zinc/69/90/42/456699042.db2.gz	FCTKYZCBTIWTCF-UHFFFAOYSA-N	0	3	330.472	3.378	20	30		EGEDHN
CN(C)[C@H](CNC(=O)c1cc(C#N)ccc1Cl)c1ccccc1	ZINC000348506200	456719567	/nfs/dbraw/zinc/71/95/67/456719567.db2.gz	IRFADXLJPSIPHX-QGZVFWFLSA-N	0	3	327.815	3.244	20	30		EGEDHN
Cc1ccc(CNC(=O)[C@H](C)N[C@@H]2CCC(=O)NC23CCC3)cc1	ZINC000328726390	456747280	/nfs/dbraw/zinc/74/72/80/456747280.db2.gz	ZONCDUBEURQSEB-GOEBONIOSA-N	0	3	329.444	3.471	20	30		EGEDHN
COc1ccc(CN[C@@H](C)[C@H]2OCCc3sccc32)cc1C#N	ZINC000291762306	456747974	/nfs/dbraw/zinc/74/79/74/456747974.db2.gz	RQDXRNGPQQQFAA-KPZWWZAWSA-N	0	3	328.437	3.420	20	30		EGEDHN
C=CCOCCCN1C[C@@H](O)C[C@@H]1c1ccccc1C(F)(F)F	ZINC000343690393	456768091	/nfs/dbraw/zinc/76/80/91/456768091.db2.gz	QSOVEWHKPIHNQH-XJKSGUPXSA-N	0	3	329.362	3.406	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000283381543	456768592	/nfs/dbraw/zinc/76/85/92/456768592.db2.gz	CWTIUEIAEVNWSU-IBGZPJMESA-N	0	3	333.435	3.152	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)[C@@H]2CCn3cncc3C2)C1	ZINC000328907505	456787828	/nfs/dbraw/zinc/78/78/28/456787828.db2.gz	CEYFENKWSZZVAC-NXHRZFHOSA-N	0	3	338.455	3.238	20	30		EGEDHN
CN(C)[C@@H](CNC(=O)C[C@@H](CC#N)c1ccccc1)c1ccccc1	ZINC000353604393	456796719	/nfs/dbraw/zinc/79/67/19/456796719.db2.gz	OQXXKFCSAKIUHA-UXHICEINSA-N	0	3	335.451	3.493	20	30		EGEDHN
C=CC[C@@H](CO)CNCc1c(C)nn(Cc2ccc(Cl)cc2)c1C	ZINC000341283183	456831774	/nfs/dbraw/zinc/83/17/74/456831774.db2.gz	WSMABXBETLEMGG-QGZVFWFLSA-N	0	3	347.890	3.476	20	30		EGEDHN
C[C@H]1CN(C(=O)C[C@@H](CC#N)c2ccccc2)CCN(C2CCC2)C1	ZINC000344721997	456852797	/nfs/dbraw/zinc/85/27/97/456852797.db2.gz	IQDVMJNCNLAWQU-IEBWSBKVSA-N	0	3	339.483	3.407	20	30		EGEDHN
CC(C#N)C(=O)N1CCc2c(Br)ccc(Cl)c2C1	ZINC000344807278	456862516	/nfs/dbraw/zinc/86/25/16/456862516.db2.gz	GZECFZIQNWRPOY-QMMMGPOBSA-N	0	3	327.609	3.147	20	30		EGEDHN
C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)c1ccc(OC2CCCC2)nc1	ZINC000329276266	456865129	/nfs/dbraw/zinc/86/51/29/456865129.db2.gz	BYOMIBXKPMFNBR-DYVFJYSZSA-N	0	3	329.444	3.190	20	30		EGEDHN
CN(C)CCOc1cccc(NC(=O)NCC(C)(C)CCC#N)c1	ZINC000348809161	456865342	/nfs/dbraw/zinc/86/53/42/456865342.db2.gz	KKWKLXPVVASHJQ-UHFFFAOYSA-N	0	3	332.448	3.078	20	30		EGEDHN
C=CC[C@H](CC)NC(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000341485864	456868839	/nfs/dbraw/zinc/86/88/39/456868839.db2.gz	WGRKQENWPFQIGF-BZSNNMDCSA-N	0	3	330.476	3.071	20	30		EGEDHN
Cc1cnc([C@H](NC(=O)N[C@@H](C)C2=CCN(C)CC2)C2CC2)s1	ZINC000329309185	456871023	/nfs/dbraw/zinc/87/10/23/456871023.db2.gz	AHBPYXKSAGPIEZ-SWLSCSKDSA-N	0	3	334.489	3.057	20	30		EGEDHN
O=C(NCc1ccccc1OC1CCCC1)N[C@@H]1CCN(C2CC2)C1	ZINC000329320383	456871808	/nfs/dbraw/zinc/87/18/08/456871808.db2.gz	UCBNZHMCKRNXIW-MRXNPFEDSA-N	0	3	343.471	3.248	20	30		EGEDHN
CN1CCC[C@@H]1CNC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1	ZINC000348842901	456880713	/nfs/dbraw/zinc/88/07/13/456880713.db2.gz	MKDGVSHZMHRVMA-GOSISDBHSA-N	0	3	349.434	3.369	20	30		EGEDHN
CC(C)c1cc(C(=O)N[C@@H]2CN(C)C[C@@H]2c2ccccc2)cc(=O)[nH]1	ZINC000329392420	456884312	/nfs/dbraw/zinc/88/43/12/456884312.db2.gz	SCENGHLONACACM-SJLPKXTDSA-N	0	3	339.439	3.313	20	30		EGEDHN
C[C@@H]1C[C@@H](C(=O)NCC2CCN(c3ccncc3)CC2)CC(=O)N1	ZINC000329440599	456890819	/nfs/dbraw/zinc/89/08/19/456890819.db2.gz	MWOAZCZTKLNBQK-UKRRQHHQSA-N	0	3	330.432	3.010	20	30		EGEDHN
Cc1nnc([C@@H]2CCCN([C@H](C)C(=O)N[C@@H]3CCCC[C@@H]3C)C2)[nH]1	ZINC000329452548	456892770	/nfs/dbraw/zinc/89/27/70/456892770.db2.gz	NIZOXERUUBQOFF-SJXGUFTOSA-N	0	3	333.480	3.216	20	30		EGEDHN
Cc1nnc([C@@H]2CCCN([C@@H](C)C(=O)NCc3ccc(C)cc3)C2)[nH]1	ZINC000329491187	456899696	/nfs/dbraw/zinc/89/96/96/456899696.db2.gz	VIDTYDKJTKNAKR-WMLDXEAASA-N	0	3	341.459	3.146	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCNC1(c2ccc(F)cc2)CC1	ZINC000341693703	456902625	/nfs/dbraw/zinc/90/26/25/456902625.db2.gz	GSORFRFOOHEPDD-UHFFFAOYSA-N	0	3	329.400	3.366	20	30		EGEDHN
O=C(NCC1(N2CCCCC2)CCOCC1)c1ccnc(C2CC2)c1	ZINC000329660289	456923385	/nfs/dbraw/zinc/92/33/85/456923385.db2.gz	OKKSLRPFDGGPPY-UHFFFAOYSA-N	0	3	343.471	3.299	20	30		EGEDHN
C=CC[C@@H](C)[C@H](C)[NH2+]Cc1cccc(-c2n[n-]c(C(=O)OCC)n2)c1	ZINC000349254659	456925578	/nfs/dbraw/zinc/92/55/78/456925578.db2.gz	ZYJFWQLKFXKMNV-KGLIPLIRSA-N	0	3	342.443	3.339	20	30		EGEDHN
CCCN(CCN1CCCCC1)C(=O)Nc1ccc(F)c(C#N)c1	ZINC000349283522	456930843	/nfs/dbraw/zinc/93/08/43/456930843.db2.gz	IBJJTKVVWJCPET-UHFFFAOYSA-N	0	3	332.423	3.427	20	30		EGEDHN
CC(=O)N[C@@H]1CCCN(C(=O)CN2CC[C@H](C)C3(CCCCC3)C2)C1	ZINC000329749708	456935697	/nfs/dbraw/zinc/93/56/97/456935697.db2.gz	UMRNSFJDMZEKRZ-FUHWJXTLSA-N	0	3	349.519	3.246	20	30		EGEDHN
CC(C)C1CCC(NC(=O)C(C)S(=O)(=O)C2CCOCC2)CC1	ZINC000330088788	456982761	/nfs/dbraw/zinc/98/27/61/456982761.db2.gz	VBMNFZOIUASWFA-NFOMZHRRSA-N	0	3	345.505	3.140	20	30		EGEDHN
C=CC[C@H](CO)CN[C@H]1CCCOc2c(Br)cccc21	ZINC000341891590	456989138	/nfs/dbraw/zinc/98/91/38/456989138.db2.gz	VGJUGVGJAPNXMG-WFASDCNBSA-N	0	3	340.261	3.437	20	30		EGEDHN
CCn1nccc1[C@@H]1OCC[C@H]1CNC(=O)[C@H](C)N1CCCCCC1	ZINC000330180838	456997288	/nfs/dbraw/zinc/99/72/88/456997288.db2.gz	NOOZUSBXCNWIHB-XYJFISCASA-N	0	3	348.491	3.202	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(F)ccc2-c2ccoc2)CC1	ZINC000349735471	457033085	/nfs/dbraw/zinc/03/30/85/457033085.db2.gz	PJOMRFDXQWNIOT-UHFFFAOYSA-N	0	3	328.387	3.466	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1CCC[C@@H]1Cc1ccccc1C	ZINC000358962271	457043670	/nfs/dbraw/zinc/04/36/70/457043670.db2.gz	BPQWTLUGQSZLDZ-VQIMIIECSA-N	0	3	327.472	3.010	20	30		EGEDHN
COc1cc(CN[C@H]2CC[C@H](C#N)C2)ccc1OCC(F)(F)F	ZINC000349803189	457058851	/nfs/dbraw/zinc/05/88/51/457058851.db2.gz	QBYIKVLCOZUWCJ-AAEUAGOBSA-N	0	3	328.334	3.418	20	30		EGEDHN
COc1cc(CN[C@@H]2CC[C@@H](C#N)C2)ccc1OCC(F)(F)F	ZINC000349803190	457058689	/nfs/dbraw/zinc/05/86/89/457058689.db2.gz	QBYIKVLCOZUWCJ-DGCLKSJQSA-N	0	3	328.334	3.418	20	30		EGEDHN
CC(C)c1ccc(C[C@H]2CCN([C@@H](C)C(=O)N(C)CCC#N)C2)cc1	ZINC000359256499	457069166	/nfs/dbraw/zinc/06/91/66/457069166.db2.gz	FUXZJENCABYIGS-PKOBYXMFSA-N	0	3	341.499	3.435	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1)OCC	ZINC000339378650	457077700	/nfs/dbraw/zinc/07/77/00/457077700.db2.gz	OBKRYBWQIKHXPT-QUCCMNQESA-N	0	3	344.499	3.481	20	30		EGEDHN
N#CCSCCCN[C@H](CCO)c1ccccc1Br	ZINC000359538133	457092441	/nfs/dbraw/zinc/09/24/41/457092441.db2.gz	MHULUXMCGSTFOV-CQSZACIVSA-N	0	3	343.290	3.109	20	30		EGEDHN
CCN(CCC#N)C(=O)CN(CCc1ccc(F)cc1)C1CCCC1	ZINC000346735696	457138141	/nfs/dbraw/zinc/13/81/41/457138141.db2.gz	SYGUAXMLVUTKQB-UHFFFAOYSA-N	0	3	345.462	3.375	20	30		EGEDHN
CC[C@H](C)n1ncc(NC(=O)N(C)[C@H](C)C2CCN(C)CC2)c1C	ZINC000331166153	457141149	/nfs/dbraw/zinc/14/11/49/457141149.db2.gz	YFAISHPFRSFJOG-UONOGXRCSA-N	0	3	335.496	3.370	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN(C)CCOc1ccccc1C	ZINC000354243359	457150941	/nfs/dbraw/zinc/15/09/41/457150941.db2.gz	ZPZUCLKAWPCTRO-UHFFFAOYSA-N	0	3	340.423	3.265	20	30		EGEDHN
CC(C)CN1CCN(c2c(C#N)cnc3c(F)cc(F)cc32)CC1	ZINC000346926475	457189798	/nfs/dbraw/zinc/18/97/98/457189798.db2.gz	ZSOTWFPKCLAASA-UHFFFAOYSA-N	0	3	330.382	3.163	20	30		EGEDHN
CC(C#N)C(=O)N[C@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000347080130	457220156	/nfs/dbraw/zinc/22/01/56/457220156.db2.gz	WEYAATGFDCEELO-QWHCGFSZSA-N	0	3	339.370	3.415	20	30		EGEDHN
CC1(C)CN(CC(=O)N(CCC#N)c2ccccc2)[C@H]2CCC[C@@H]21	ZINC000339715264	457229586	/nfs/dbraw/zinc/22/95/86/457229586.db2.gz	FXPJDVXGKIWYRN-ROUUACIJSA-N	0	3	325.456	3.444	20	30		EGEDHN
N#CC(C(=O)c1cccc(NC(=O)C2CCCCC2)c1)c1ccncn1	ZINC000354472081	457244519	/nfs/dbraw/zinc/24/45/19/457244519.db2.gz	UOVIRVYLKDXILD-KRWDZBQOSA-N	0	3	348.406	3.485	20	30		EGEDHN
COc1ccccc1NC(=O)C1CCN([C@@H]2CC[C@H](C#N)C2)CC1	ZINC000332330327	457350822	/nfs/dbraw/zinc/35/08/22/457350822.db2.gz	SIJCNXFTNIWPEM-GOEBONIOSA-N	0	3	327.428	3.038	20	30		EGEDHN
N#CCc1ccc(CN2CCC(O)(Cc3cccc(F)c3)CC2)cc1	ZINC000352259839	457353098	/nfs/dbraw/zinc/35/30/98/457353098.db2.gz	PFDGLFGCGSTTFS-UHFFFAOYSA-N	0	3	338.426	3.461	20	30		EGEDHN
CC(=O)Nc1c[nH]nc1[C@@H]1CCCN([C@H](C)c2cccc(C#N)c2)C1	ZINC000332366004	457356737	/nfs/dbraw/zinc/35/67/37/457356737.db2.gz	VWLRIEQMPZWUTR-CXAGYDPISA-N	0	3	337.427	3.180	20	30		EGEDHN
C=CCNC(=O)Nc1ccc(NC(=O)[C@@H](C)NC(C)(C)CC)cc1	ZINC000355475923	457379766	/nfs/dbraw/zinc/37/97/66/457379766.db2.gz	SHWMQBAMWJBMSM-CYBMUJFWSA-N	0	3	332.448	3.099	20	30		EGEDHN
COc1ccc(CN2CC[C@](CO)(C(C)C)C2)cc1OCCCC#N	ZINC000378132172	457380217	/nfs/dbraw/zinc/38/02/17/457380217.db2.gz	PQHZIZXBWPBKIP-FQEVSTJZSA-N	0	3	346.471	3.218	20	30		EGEDHN
CC1(C)CN(C2(CNc3cccnc3C#N)CCCCC2)CCO1	ZINC000357234091	457390131	/nfs/dbraw/zinc/39/01/31/457390131.db2.gz	GJDKPEJZYQNWSZ-UHFFFAOYSA-N	0	3	328.460	3.179	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1	ZINC000352474332	457394725	/nfs/dbraw/zinc/39/47/25/457394725.db2.gz	GCJISQVURHHKPT-ILZDJORESA-N	0	3	330.472	3.167	20	30		EGEDHN
CC(=O)Nc1ccc(CN[C@H]2CCCCc3cc(C#N)ccc32)cn1	ZINC000360881700	457403788	/nfs/dbraw/zinc/40/37/88/457403788.db2.gz	AHTRRJQDXFOUBN-IBGZPJMESA-N	0	3	334.423	3.469	20	30		EGEDHN
COc1ccc(C#N)cc1CN1CC[C@@H](C(=O)N(C)c2ccccc2)C1	ZINC000374045668	457455073	/nfs/dbraw/zinc/45/50/73/457455073.db2.gz	NYQWYCCQUYPJFW-QGZVFWFLSA-N	0	3	349.434	3.052	20	30		EGEDHN
N#CCc1ccc(CN2CCC[C@@H](c3nnc4ccccn43)C2)cc1	ZINC000342736791	457487993	/nfs/dbraw/zinc/48/79/93/457487993.db2.gz	QTCDLOIHTVAEMS-GOSISDBHSA-N	0	3	331.423	3.175	20	30		EGEDHN
C[C@H]1[C@H](c2ccccc2)CCN1CC(=O)NCc1cccc(C#N)c1	ZINC000374210594	457523319	/nfs/dbraw/zinc/52/33/19/457523319.db2.gz	VYNQBMYGYDGPSB-OXJNMPFZSA-N	0	3	333.435	3.052	20	30		EGEDHN
COc1cccc([C@H](CNCc2ccc(C#N)c(F)c2)N(C)C)c1	ZINC000403978859	457536884	/nfs/dbraw/zinc/53/68/84/457536884.db2.gz	AKHZLQDNLZTLNX-IBGZPJMESA-N	0	3	327.403	3.098	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@@H](C)N1CCC(CCCn2ccnc2)CC1	ZINC000361058460	457553158	/nfs/dbraw/zinc/55/31/58/457553158.db2.gz	QDLDRSFQIZETMR-GOSISDBHSA-N	0	3	346.519	3.188	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)CCC(=O)N1CCOc2ccccc21	ZINC000425529206	457587154	/nfs/dbraw/zinc/58/71/54/457587154.db2.gz	AYCZPOXOLFITEC-MRXNPFEDSA-N	0	3	349.434	3.367	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)NCc1cccc(F)c1)C(C)C	ZINC000410169228	457633161	/nfs/dbraw/zinc/63/31/61/457633161.db2.gz	CFQNUAMIHGMXPI-SFHVURJKSA-N	0	3	333.451	3.324	20	30		EGEDHN
COc1ccc(CN2CCC[C@H](OC)CC2)cc1OCCCC#N	ZINC000370708726	457704048	/nfs/dbraw/zinc/70/40/48/457704048.db2.gz	QNAWAKUOXIHVIT-KRWDZBQOSA-N	0	3	332.444	3.379	20	30		EGEDHN
COc1ccc(C[NH2+]C2CCN(c3ccc(C#N)cc3)CC2)c([O-])c1	ZINC000364926556	457717428	/nfs/dbraw/zinc/71/74/28/457717428.db2.gz	NBKAJNLWRLEQRM-UHFFFAOYSA-N	0	3	337.423	3.031	20	30		EGEDHN
C#CCCN1CCC(N(C)C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000365009609	457723634	/nfs/dbraw/zinc/72/36/34/457723634.db2.gz	PUZWRWKIACBUIW-UHFFFAOYSA-N	0	3	338.373	3.265	20	30		EGEDHN
CC(C)O[C@@H]1C[C@@H](N[C@@H](C)C(=O)Nc2cccc(C#N)c2)C1(C)C	ZINC000361547267	457787892	/nfs/dbraw/zinc/78/78/92/457787892.db2.gz	DDQGJHJWELGMQP-IAOVAPTHSA-N	0	3	329.444	3.067	20	30		EGEDHN
C=CCC[C@@H](N[C@H]1CCN(C2CCOCC2)C1=O)c1ccccc1	ZINC000366121494	457795110	/nfs/dbraw/zinc/79/51/10/457795110.db2.gz	CXDVFDYSRBYFDZ-MOPGFXCFSA-N	0	3	328.456	3.063	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CCC[C@@H](NCc2ccccc2)C1)OCC	ZINC000371120971	457796502	/nfs/dbraw/zinc/79/65/02/457796502.db2.gz	YUWFYQMKDFCGKW-RTBURBONSA-N	0	3	330.472	3.139	20	30		EGEDHN
COC[C@@H](NC(=O)C(C#N)CCc1ccccc1)c1ccc(C)o1	ZINC000433389102	457826287	/nfs/dbraw/zinc/82/62/87/457826287.db2.gz	WFVPYGHIXVVBFP-DLBZAZTESA-N	0	3	326.396	3.164	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN(C)CC[C@H]2CCCCN2C)c1C	ZINC000444167270	457863252	/nfs/dbraw/zinc/86/32/52/457863252.db2.gz	DNLUHRMRPDUZBY-GOSISDBHSA-N	0	3	331.504	3.280	20	30		EGEDHN
C=CCNC(=O)NC(=O)[C@@H](C)N[C@@H](CC(C)(C)C)c1ccc(F)cc1	ZINC000361841400	457901106	/nfs/dbraw/zinc/90/11/06/457901106.db2.gz	CTTUKUFKRXCRQT-CJNGLKHVSA-N	0	3	349.450	3.293	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1)OCC	ZINC000366823104	457903373	/nfs/dbraw/zinc/90/33/73/457903373.db2.gz	DJPPQUIBJJCTSE-VQTJNVASSA-N	0	3	344.499	3.386	20	30		EGEDHN
C[C@@H]1C[C@@H](c2cccnc2)N(CCC(=O)Nc2cccc(C#N)c2)C1	ZINC000411523131	457910470	/nfs/dbraw/zinc/91/04/70/457910470.db2.gz	GPHLBTQBPNMIBI-BEFAXECRSA-N	0	3	334.423	3.365	20	30		EGEDHN
CC1(C)CCCN(C(=O)[C@H]2CCCN(Cc3ccccc3)C2)[C@H]1C#N	ZINC000434032356	457934412	/nfs/dbraw/zinc/93/44/12/457934412.db2.gz	REKGMKQLZWJYLV-OALUTQOASA-N	0	3	339.483	3.439	20	30		EGEDHN
CC(C)OC[C@H](CO)N(C)Cc1ccc(-c2ccccc2C#N)cc1	ZINC000411634500	457934782	/nfs/dbraw/zinc/93/47/82/457934782.db2.gz	LHAJLSXXSUNXDT-FQEVSTJZSA-N	0	3	338.451	3.443	20	30		EGEDHN
C=CCN(C)CCN(CC)[C@@H](C)C(=O)N1CCC[C@H]1c1cccs1	ZINC000411637594	457936984	/nfs/dbraw/zinc/93/69/84/457936984.db2.gz	FZAMLKMGFKZWSU-IRXDYDNUSA-N	0	3	349.544	3.240	20	30		EGEDHN
Cc1cc(NC(=O)c2ccc(F)c(C#N)c2)ccc1OCCN(C)C	ZINC000458210880	457971001	/nfs/dbraw/zinc/97/10/01/457971001.db2.gz	LWZWCLDYNLTRDF-UHFFFAOYSA-N	0	3	341.386	3.199	20	30		EGEDHN
CC(C)N(Cc1ccc(CC#N)cc1)C[C@@H](O)COc1ccccc1	ZINC000444797460	457980464	/nfs/dbraw/zinc/98/04/64/457980464.db2.gz	DKPFDKBKVFBYMW-HXUWFJFHSA-N	0	3	338.451	3.403	20	30		EGEDHN
C#Cc1ccc(CNc2cccc3c2CCN(CC(C)(C)O)C3)cc1	ZINC000368013265	458004608	/nfs/dbraw/zinc/00/46/08/458004608.db2.gz	AAACOGQFVMTHPW-UHFFFAOYSA-N	0	3	334.463	3.409	20	30		EGEDHN
C=CCc1cc(CN2CCC([C@H]3CCOC3)CC2)cc(OC)c1O	ZINC000371810812	458083973	/nfs/dbraw/zinc/08/39/73/458083973.db2.gz	SOWCUVVYHCXIIN-SFHVURJKSA-N	0	3	331.456	3.378	20	30		EGEDHN
C[C@H]1CN(CC2CCN(Cc3cccc(F)c3C#N)CC2)C[C@H](C)O1	ZINC000428240388	458104040	/nfs/dbraw/zinc/10/40/40/458104040.db2.gz	IPLAYXPAEBNQLE-HOTGVXAUSA-N	0	3	345.462	3.019	20	30		EGEDHN
C=C(C)[C@H](NC(=O)NC(C)(C)CN(C)C)c1ccc(F)c(F)c1	ZINC000458668089	458129615	/nfs/dbraw/zinc/12/96/15/458129615.db2.gz	KBRIWYNBLIFDBC-HNNXBMFYSA-N	0	3	325.403	3.221	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CC[C@H](n2cc(Cl)cn2)C1	ZINC000428508203	458160538	/nfs/dbraw/zinc/16/05/38/458160538.db2.gz	UDSSYCBYSKKEOF-RDJZCZTQSA-N	0	3	342.830	3.082	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NC(=O)NC1CCN(CC=C)CC1	ZINC000413240369	458296551	/nfs/dbraw/zinc/29/65/51/458296551.db2.gz	NIVFOTPPTQEIKQ-LJQANCHMSA-N	0	3	327.472	3.123	20	30		EGEDHN
CS(=O)(=O)CC1(CN[C@@H]2CCCCc3cc(C#N)ccc32)CCC1	ZINC000414338022	458317386	/nfs/dbraw/zinc/31/73/86/458317386.db2.gz	XXRCBIASMGNZEI-GOSISDBHSA-N	0	3	346.496	3.130	20	30		EGEDHN
CN(C)CCN(Cc1ccsc1)C(=O)Nc1ccc(CC#N)cc1	ZINC000459331539	458332179	/nfs/dbraw/zinc/33/21/79/458332179.db2.gz	VQGGRFKCELJEAT-UHFFFAOYSA-N	0	3	342.468	3.410	20	30		EGEDHN
C[C@H](CN1CCCCC1)NC(=O)N[C@@H]1CCCc2cc(C#N)ccc21	ZINC000416684969	458352892	/nfs/dbraw/zinc/35/28/92/458352892.db2.gz	MCIGDBUDRFZGSR-DNVCBOLYSA-N	0	3	340.471	3.109	20	30		EGEDHN
CO[C@@H](CNCc1cn(C)nc1-c1ccc(C#N)cc1)CC(C)C	ZINC000418104406	458371393	/nfs/dbraw/zinc/37/13/93/458371393.db2.gz	UUYAQRXTDLMBBX-GOSISDBHSA-N	0	3	326.444	3.109	20	30		EGEDHN
Cc1ccc(CC(C)(C)NCC(=O)NCc2cccc(C#N)c2)cc1	ZINC000419330926	458379972	/nfs/dbraw/zinc/37/99/72/458379972.db2.gz	IQIUXDZKLRCPOV-UHFFFAOYSA-N	0	3	335.451	3.094	20	30		EGEDHN
C[C@@H](NCC(=O)NCc1ccc(C#N)cc1)c1ccc(C2CC2)cc1	ZINC000419365212	458380511	/nfs/dbraw/zinc/38/05/11/458380511.db2.gz	XNLKTHKXSCJQOB-OAHLLOKOSA-N	0	3	333.435	3.403	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000429902638	458381737	/nfs/dbraw/zinc/38/17/37/458381737.db2.gz	NDIQLMZUCSDOBM-UHFFFAOYSA-N	0	3	343.515	3.307	20	30		EGEDHN
CSc1ccc([C@@H](CNC(=O)NCC2(C#N)CCC2)N(C)C)cc1	ZINC000419501753	458384435	/nfs/dbraw/zinc/38/44/35/458384435.db2.gz	BSMUHUBZOJZQFM-MRXNPFEDSA-N	0	3	346.500	3.004	20	30		EGEDHN
CN(C)C1(CN(C)C(=O)N[C@H]2CCCc3cc(C#N)ccc32)CCC1	ZINC000419613450	458387109	/nfs/dbraw/zinc/38/71/09/458387109.db2.gz	NPSKGWDUKIUQCC-SFHVURJKSA-N	0	3	340.471	3.061	20	30		EGEDHN
COc1cc(CNCC2(CC#N)CC2)ccc1OCc1ccncc1	ZINC000430068775	458394967	/nfs/dbraw/zinc/39/49/67/458394967.db2.gz	TWEIOPOCYQTAPV-UHFFFAOYSA-N	0	3	337.423	3.453	20	30		EGEDHN
N#C[C@@H]1CCC[C@H](N[C@@H](CO)c2ccc(Br)c(F)c2)C1	ZINC000430114429	458403602	/nfs/dbraw/zinc/40/36/02/458403602.db2.gz	CMRRPFAKCJIRDU-GMXABZIVSA-N	0	3	341.224	3.294	20	30		EGEDHN
C[C@@H](CN1CC[C@H](Oc2ccc(C#N)cn2)C1)c1ccc(F)cc1	ZINC000430183905	458416128	/nfs/dbraw/zinc/41/61/28/458416128.db2.gz	BRYBJLKBCLHQSW-KSSFIOAISA-N	0	3	325.387	3.349	20	30		EGEDHN
CON1CCC(N(C)CC#Cc2ccc(C(F)(F)F)cc2)CC1	ZINC000459580984	458417652	/nfs/dbraw/zinc/41/76/52/458417652.db2.gz	MNUCPVHECVJUBO-UHFFFAOYSA-N	0	3	326.362	3.015	20	30		EGEDHN
C[C@@H](NC(=O)NCc1ccc(C#N)s1)[C@@H](c1ccccc1)N(C)C	ZINC000422213425	458426582	/nfs/dbraw/zinc/42/65/82/458426582.db2.gz	YHUJVJNAFMNDBV-DYVFJYSZSA-N	0	3	342.468	3.110	20	30		EGEDHN
C=CCOc1ccc(CN[C@H]2CCC[C@H]2C(=O)OCC)cc1OC	ZINC000449580558	458427361	/nfs/dbraw/zinc/42/73/61/458427361.db2.gz	ROKBFDJFGFDAFZ-CVEARBPZSA-N	0	3	333.428	3.081	20	30		EGEDHN
C=CCC[C@H](CO)NCc1cnn(-c2ccc(C(F)(F)F)cc2)c1	ZINC000449701378	458429458	/nfs/dbraw/zinc/42/94/58/458429458.db2.gz	WCHVJVLRZDLUDD-OAHLLOKOSA-N	0	3	339.361	3.308	20	30		EGEDHN
COc1ccc(NC(=O)C[C@@H](C)NCc2ccc(C#N)c(F)c2)cc1	ZINC000449735075	458430068	/nfs/dbraw/zinc/43/00/68/458430068.db2.gz	FZCFMQFQHCGQBK-CYBMUJFWSA-N	0	3	341.386	3.213	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)CN(C)[C@H]1CCC[C@H]1c1ccccc1	ZINC000459669765	458442628	/nfs/dbraw/zinc/44/26/28/458442628.db2.gz	DXDPWCZQEKBMLY-BJLQDIEVSA-N	0	3	327.472	3.309	20	30		EGEDHN
C[C@@H](CNc1cccc(C#N)c1[N+](=O)[O-])N1CCc2ccccc2C1	ZINC000450247335	458443185	/nfs/dbraw/zinc/44/31/85/458443185.db2.gz	NBLNKJJXEBQSFU-AWEZNQCLSA-N	0	3	336.395	3.325	20	30		EGEDHN
C[C@@H](c1ccccc1)[C@H](O)CN(C)CCOCc1ccc(C#N)cc1	ZINC000451037420	458464011	/nfs/dbraw/zinc/46/40/11/458464011.db2.gz	OZTSLVGWLTVROH-LAUBAEHRSA-N	0	3	338.451	3.171	20	30		EGEDHN
CN(CCC#N)C(=O)CCN[C@@H](c1ccc(F)c(Cl)c1)C1CC1	ZINC000451349200	458473941	/nfs/dbraw/zinc/47/39/41/458473941.db2.gz	ANTOKLZNYXCVRI-QGZVFWFLSA-N	0	3	337.826	3.282	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC[S@@](=O)c1cc(Cl)ccc1Cl	ZINC000451672667	458484368	/nfs/dbraw/zinc/48/43/68/458484368.db2.gz	IVVUUOWYNJIJKW-HKZYLEAXSA-N	0	3	348.295	3.424	20	30		EGEDHN
CCN(CC)S(=O)(=O)c1ccc([C@H](C)NCC2(CC#N)CC2)cc1	ZINC000430744951	458486925	/nfs/dbraw/zinc/48/69/25/458486925.db2.gz	WTTVIJOVEYPYOQ-HNNXBMFYSA-N	0	3	349.500	3.062	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN(C)[C@@H]1CCN(C(C)C)C1	ZINC000452112141	458495301	/nfs/dbraw/zinc/49/53/01/458495301.db2.gz	FGXFLJGQODORBR-MRXNPFEDSA-N	0	3	347.528	3.318	20	30		EGEDHN
C=C(C)Cn1c(N2CCN([C@@H]3C[C@H]3C)C[C@@H](C)C2)nnc1C(C)(C)C	ZINC000453457852	458532352	/nfs/dbraw/zinc/53/23/52/458532352.db2.gz	YEOJHENYYRBMPF-BRWVUGGUSA-N	0	3	345.535	3.318	20	30		EGEDHN
CCOC(=O)c1cc2cc(NC(=O)[C@@H](N)CCCC#N)ccc2s1	ZINC000424078797	458553294	/nfs/dbraw/zinc/55/32/94/458553294.db2.gz	FDUCKZFKOMLGLM-ZDUSSCGKSA-N	0	3	345.424	3.038	20	30		EGEDHN
C=CC(C)(C)CNC(=O)NC[C@@H]1CCCN(Cc2cccs2)C1	ZINC000454409781	458560767	/nfs/dbraw/zinc/56/07/67/458560767.db2.gz	DTZVWYHYAGTYOO-HNNXBMFYSA-N	0	3	335.517	3.472	20	30		EGEDHN
CC(C)(Cc1ccc(Cl)cc1Cl)NC(=O)[C@@H](N)CCCC#N	ZINC000424119539	458563091	/nfs/dbraw/zinc/56/30/91/458563091.db2.gz	DYIAZNBRVVGKRD-AWEZNQCLSA-N	0	3	342.270	3.452	20	30		EGEDHN
COc1ccc(CCN(CC(C)(C)C)C(=O)[C@@H](N)CCCC#N)cc1	ZINC000424121090	458563397	/nfs/dbraw/zinc/56/33/97/458563397.db2.gz	HYLVDHJRNKUTNI-SFHVURJKSA-N	0	3	345.487	3.134	20	30		EGEDHN
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)[C@H](N)CCCC#N	ZINC000424126458	458565730	/nfs/dbraw/zinc/56/57/30/458565730.db2.gz	PAGCASOBMJWLBX-IAGOWNOFSA-N	0	3	331.460	3.310	20	30		EGEDHN
C[C@@H]1c2cc(Cl)cc(Cl)c2CCN1C(=O)[C@@H](N)CCCC#N	ZINC000424130464	458566200	/nfs/dbraw/zinc/56/62/00/458566200.db2.gz	FJNQSBAGILWCPP-BMIGLBTASA-N	0	3	340.254	3.460	20	30		EGEDHN
CC(C)(CNC(=O)[C@@H](N)CCCC#N)c1c(Cl)cccc1Cl	ZINC000424142454	458568868	/nfs/dbraw/zinc/56/88/68/458568868.db2.gz	PUKMTUUYHFDEKA-ZDUSSCGKSA-N	0	3	342.270	3.408	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1ccc(Cl)cc1OCC(F)(F)F	ZINC000424144951	458570817	/nfs/dbraw/zinc/57/08/17/458570817.db2.gz	TZSJIDBQMJMLMD-SNVBAGLBSA-N	0	3	349.740	3.241	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Nc1ccc(C(C)=O)cn1)C(C)C	ZINC000455115753	458585930	/nfs/dbraw/zinc/58/59/30/458585930.db2.gz	HYHRKJPOYHRYLJ-KRWDZBQOSA-N	0	3	344.459	3.104	20	30		EGEDHN
C=CCC[C@H](C(=O)NCCCN1CCCO[C@@H](C)C1)c1ccccc1	ZINC000470095427	458612083	/nfs/dbraw/zinc/61/20/83/458612083.db2.gz	ZHKBTTDPZMFYNO-ICSRJNTNSA-N	0	3	344.499	3.354	20	30		EGEDHN
CC(C)(C#N)c1ccc(C(=O)N2CCC[C@@H](N3CCCC3)C2)cc1	ZINC000373850023	458625121	/nfs/dbraw/zinc/62/51/21/458625121.db2.gz	JREYJUFEDVTXQI-GOSISDBHSA-N	0	3	325.456	3.188	20	30		EGEDHN
CC(C)(C)Oc1ccc(NC(=O)C23CCCN2CCC3)cc1C#N	ZINC000456113563	458631535	/nfs/dbraw/zinc/63/15/35/458631535.db2.gz	NQKNKFRWJXZMOV-UHFFFAOYSA-N	0	3	327.428	3.302	20	30		EGEDHN
C[C@H](CC#N)Sc1ccccc1NC(=O)CN[C@]1(C)CCO[C@@H]1C	ZINC000494214666	458642361	/nfs/dbraw/zinc/64/23/61/458642361.db2.gz	CBTWJENNVLYLGE-HBUWYVDXSA-N	0	3	347.484	3.176	20	30		EGEDHN
CC(C)[C@@H](NCC(=O)NCc1ccc(C#N)cc1)c1ccc(F)cc1	ZINC000502503975	458653723	/nfs/dbraw/zinc/65/37/23/458653723.db2.gz	XQYOKPYJDNFDRT-HXUWFJFHSA-N	0	3	339.414	3.300	20	30		EGEDHN
CN(CCCc1ccccc1)C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000470841719	458655904	/nfs/dbraw/zinc/65/59/04/458655904.db2.gz	PITYFRNGADZONZ-FQEVSTJZSA-N	0	3	331.419	3.332	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](CCN(C)CCOC)c1ccccc1	ZINC000424648001	458694795	/nfs/dbraw/zinc/69/47/95/458694795.db2.gz	QZRVVAMCCIQLOR-SFHVURJKSA-N	0	3	332.488	3.415	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)N[C@@H](C)CN1CCC[C@@H](C)C1	ZINC000463518803	458707692	/nfs/dbraw/zinc/70/76/92/458707692.db2.gz	RPIQHNZUKDKPPE-CVEARBPZSA-N	0	3	346.471	3.110	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)NCc1ccc(C)cc1)C(C)C	ZINC000503439358	458708369	/nfs/dbraw/zinc/70/83/69/458708369.db2.gz	RYUUIUHDQOXJAG-IBGZPJMESA-N	0	3	329.488	3.493	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1)C(C)C	ZINC000503435824	458708523	/nfs/dbraw/zinc/70/85/23/458708523.db2.gz	IAIKAVRDVSHIGC-KRWDZBQOSA-N	0	3	346.431	3.415	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CCC[C@H](OCC2CC2)C1	ZINC000494660526	458723544	/nfs/dbraw/zinc/72/35/44/458723544.db2.gz	GBLVLQRKYPTSCN-PMACEKPBSA-N	0	3	345.483	3.046	20	30		EGEDHN
C=C[C@@H]1CCCCN1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000494704263	458733446	/nfs/dbraw/zinc/73/34/46/458733446.db2.gz	SVAULXVWRWYFNA-RTBURBONSA-N	0	3	327.472	3.401	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCc2cnc3ccccc3c2)cc1	ZINC000471870018	458745009	/nfs/dbraw/zinc/74/50/09/458745009.db2.gz	JCPVQVYZTLUGAT-LJQANCHMSA-N	0	3	340.386	3.105	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)cc1)Cc1ccc2c(c1)NC(=O)CO2	ZINC000507250427	458753828	/nfs/dbraw/zinc/75/38/28/458753828.db2.gz	ACSSFKIIKNMEPP-UHFFFAOYSA-N	0	3	335.407	3.300	20	30		EGEDHN
C=CCn1c(N2CCN(CCC(C)(C)C)CC2)nnc1C(C)(C)C	ZINC000508494356	458759679	/nfs/dbraw/zinc/75/96/79/458759679.db2.gz	OUSLWURBIHPZPH-UHFFFAOYSA-N	0	3	333.524	3.320	20	30		EGEDHN
C=C(C)CCN1CCN([C@@H](C(=O)OC)c2cccc(Cl)c2)CC1	ZINC000509360506	458771717	/nfs/dbraw/zinc/77/17/17/458771717.db2.gz	WCIJZBCVWOGPGS-QGZVFWFLSA-N	0	3	336.863	3.138	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1C(=O)N[C@@H](C)[C@H](c1ccccc1C)N(C)C	ZINC000510516018	458775379	/nfs/dbraw/zinc/77/53/79/458775379.db2.gz	ZCIBSDDKBRADEP-JCHJZTRSSA-N	0	3	330.472	3.084	20	30		EGEDHN
C=CCOc1cccc(NC(=O)NC[C@@H](C)N2CCC[C@H](C)C2)c1	ZINC000510718480	458775944	/nfs/dbraw/zinc/77/59/44/458775944.db2.gz	OHHDEAXJRIBVFH-JKSUJKDBSA-N	0	3	331.460	3.493	20	30		EGEDHN
CN(Cc1ccc(CC#N)cc1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000495028490	458785331	/nfs/dbraw/zinc/78/53/31/458785331.db2.gz	GEHIZFFAYOWZHR-QGZVFWFLSA-N	0	3	329.444	3.194	20	30		EGEDHN
CN(Cc1ccc(CC#N)cc1)[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000495028489	458785605	/nfs/dbraw/zinc/78/56/05/458785605.db2.gz	GEHIZFFAYOWZHR-KRWDZBQOSA-N	0	3	329.444	3.194	20	30		EGEDHN
C[C@@H]1[C@@H](Cc2ccccc2)CCN1CC(=O)NCc1ccc(C#N)cc1	ZINC000472349975	458788974	/nfs/dbraw/zinc/78/89/74/458788974.db2.gz	PHLCBJDNRIXULU-DYESRHJHSA-N	0	3	347.462	3.128	20	30		EGEDHN
C=CCN(CC=C)C(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000512896755	458788963	/nfs/dbraw/zinc/78/89/63/458788963.db2.gz	OLEYKNVKOPTMFP-IBGZPJMESA-N	0	3	345.487	3.460	20	30		EGEDHN
C=CCN(C(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C)C1CC1	ZINC000512911413	458790110	/nfs/dbraw/zinc/79/01/10/458790110.db2.gz	GGOOXVCGNKWWSN-IBGZPJMESA-N	0	3	345.487	3.437	20	30		EGEDHN
C[C@@H]1[C@@H](Cc2ccccc2)CCN1CC(=O)NCc1cccc(C#N)c1	ZINC000472353107	458790669	/nfs/dbraw/zinc/79/06/69/458790669.db2.gz	VWWCSFISEXWIKD-DYESRHJHSA-N	0	3	347.462	3.128	20	30		EGEDHN
C[C@H]1C[C@H](c2ccccc2)N(CC(=O)NCc2ccc(C#N)cc2)C1	ZINC000513227084	458792663	/nfs/dbraw/zinc/79/26/63/458792663.db2.gz	AKXQUXHKAINKCW-OXJNMPFZSA-N	0	3	333.435	3.258	20	30		EGEDHN
C=C(C)Cn1c(CCCC)nnc1N1CC[C@H](N2CCCCC2)C1	ZINC000515066486	458805714	/nfs/dbraw/zinc/80/57/14/458805714.db2.gz	QWFRKGLODIYENA-KRWDZBQOSA-N	0	3	331.508	3.261	20	30		EGEDHN
C[C@@H](S[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N(C)CCC#N	ZINC000516062458	458814769	/nfs/dbraw/zinc/81/47/69/458814769.db2.gz	AKYCRDHFNZVHSA-AEFFLSMTSA-N	0	3	345.512	3.145	20	30		EGEDHN
Cc1ncncc1[C@@H](C)N[C@H]1CCCN(c2ccc(C#N)cc2F)C1	ZINC000516490808	458818116	/nfs/dbraw/zinc/81/81/16/458818116.db2.gz	OBSQNJVNJDJHLG-ZBFHGGJFSA-N	0	3	339.418	3.115	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)Cc2ccc(OC)c(C)c2)CC1	ZINC000517318753	458828859	/nfs/dbraw/zinc/82/88/59/458828859.db2.gz	LATSDXCDPDSBHT-UHFFFAOYSA-N	0	3	345.487	3.186	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H]2CCc3ccc(F)cc32)CC1	ZINC000517349498	458828976	/nfs/dbraw/zinc/82/89/76/458828976.db2.gz	OFVZOVOTFSDQJL-SFHVURJKSA-N	0	3	331.435	3.153	20	30		EGEDHN
N#CCC[C@H](NC[C@@H](O)COc1ccc(CC#N)cc1)c1ccccc1	ZINC000553385949	458895087	/nfs/dbraw/zinc/89/50/87/458895087.db2.gz	IULOHXCMHJXJDU-CTNGQTDRSA-N	0	3	349.434	3.127	20	30		EGEDHN
C=CCn1c(CC2CCCC2)nnc1N1C[C@@H](C)N(CC)C[C@H]1C	ZINC000554924331	458902382	/nfs/dbraw/zinc/90/23/82/458902382.db2.gz	KAWISFFHZIASGQ-HZPDHXFCSA-N	0	3	331.508	3.116	20	30		EGEDHN
C=C(C)Cn1c(C2CCCC2)nnc1N1CCN(C)[C@@H](C(C)C)C1	ZINC000555269696	458905030	/nfs/dbraw/zinc/90/50/30/458905030.db2.gz	SEIKTFKCPIJSOW-QGZVFWFLSA-N	0	3	331.508	3.288	20	30		EGEDHN
CO[C@]1(C)C[C@H](N(C)C(=O)C(C#N)CCc2ccccc2)C1(C)C	ZINC000555556505	458906828	/nfs/dbraw/zinc/90/68/28/458906828.db2.gz	VHPXFWBUQGUVME-FUHIMQAGSA-N	0	3	328.456	3.421	20	30		EGEDHN
CN1CCN(Cc2ccc(NC3CCC(C)(C#N)CC3)cc2)CC1	ZINC000519076089	458913217	/nfs/dbraw/zinc/91/32/17/458913217.db2.gz	NRLVCIUQPKNZLA-UHFFFAOYSA-N	0	3	326.488	3.318	20	30		EGEDHN
C[C@@H]1CCC[C@@H]1CNC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000466718799	458915139	/nfs/dbraw/zinc/91/51/39/458915139.db2.gz	JLUPMYQJCZEVCU-VQIMIIECSA-N	0	3	342.487	3.068	20	30		EGEDHN
CCN(CCNCc1ccc(O[C@@H](C)C#N)cc1)C(=O)OC(C)(C)C	ZINC000495806143	458961163	/nfs/dbraw/zinc/96/11/63/458961163.db2.gz	AAUGMMYJTNSZBO-HNNXBMFYSA-N	0	3	347.459	3.324	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)COCc2cccc(Cl)c2)CC1	ZINC000457543672	458996091	/nfs/dbraw/zinc/99/60/91/458996091.db2.gz	OERJVTQNYSYXQD-UHFFFAOYSA-N	0	3	336.863	3.013	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CC(C)(C)[C@H]1[C@@H]1CCCO1	ZINC000577307209	459013869	/nfs/dbraw/zinc/01/38/69/459013869.db2.gz	KDHQFZYFVCQOGP-YZGWKJHDSA-N	0	3	345.483	3.044	20	30		EGEDHN
C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NCC#Cc1ccc(F)cc1	ZINC000495949949	459015903	/nfs/dbraw/zinc/01/59/03/459015903.db2.gz	ZLVUXIDGLKUKQB-YJBOKZPZSA-N	0	3	346.446	3.412	20	30		EGEDHN
C[C@H]1OCC[C@]1(O)CN(Cc1ccccc1)Cc1cccc(C#N)c1	ZINC000566882180	459016151	/nfs/dbraw/zinc/01/61/51/459016151.db2.gz	JFONJFZCBNDCRK-UTKZUKDTSA-N	0	3	336.435	3.100	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CCSC3(CCC3)CC2)cc1	ZINC000577361182	459022190	/nfs/dbraw/zinc/02/21/90/459022190.db2.gz	SYIDUQGIUIMVKA-KRWDZBQOSA-N	0	3	339.464	3.129	20	30		EGEDHN
C=CCC[C@H](CC)[NH2+]CC[N-]S(=O)(=O)c1ccc(Cl)cc1F	ZINC000442868251	459047670	/nfs/dbraw/zinc/04/76/70/459047670.db2.gz	NJZMINTWIIKCGW-ZDUSSCGKSA-N	0	3	348.871	3.092	20	30		EGEDHN
C=CCN(Cc1cccs1)C[C@@](C)(O)CNC(=O)OC(C)(C)C	ZINC000496061878	459051297	/nfs/dbraw/zinc/05/12/97/459051297.db2.gz	OGWZXUWFERFDMO-KRWDZBQOSA-N	0	3	340.489	3.012	20	30		EGEDHN
N#CCCCOc1cccc(NC2CCN([C@@H]3CCOC3)CC2)c1	ZINC000594512308	459071356	/nfs/dbraw/zinc/07/13/56/459071356.db2.gz	JXQBBRUMIUKPHB-GOSISDBHSA-N	0	3	329.444	3.034	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)s1)[C@H]1CCCN1C(=O)OC(C)(C)C	ZINC000496137149	459082213	/nfs/dbraw/zinc/08/22/13/459082213.db2.gz	MAANJSUUFZKAFF-SWLSCSKDSA-N	0	3	335.473	3.497	20	30		EGEDHN
C[C@@H](C(=O)N[C@@H]1CCCc2cc(C#N)ccc21)N1CCCCCC1	ZINC000520766501	459092229	/nfs/dbraw/zinc/09/22/29/459092229.db2.gz	DAUVESNLTJXVNK-HNAYVOBHSA-N	0	3	325.456	3.316	20	30		EGEDHN
CN1CCC[C@@H](CNC(=O)c2cn(CCCC#N)c3ccccc23)C1	ZINC000577927203	459117890	/nfs/dbraw/zinc/11/78/90/459117890.db2.gz	JMSUWPDWQYANTL-INIZCTEOSA-N	0	3	338.455	3.017	20	30		EGEDHN
CC1(C)Cc2ccsc2CN1C[C@@H](O)COc1ccc(C#N)cc1	ZINC000577938601	459119764	/nfs/dbraw/zinc/11/97/64/459119764.db2.gz	ADAGRZIXTQUBIG-MRXNPFEDSA-N	0	3	342.464	3.196	20	30		EGEDHN
C=CC[C@H](C)[C@@H](C)Nc1ccc2nc(CCN3CCOCC3)[nH]c2c1	ZINC000558274281	459144265	/nfs/dbraw/zinc/14/42/65/459144265.db2.gz	QDGYSHMGJGNNCF-JKSUJKDBSA-N	0	3	342.487	3.450	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccc3[nH]c(C(F)F)nc3c2)nc(C)n1	ZINC000522103227	459215164	/nfs/dbraw/zinc/21/51/64/459215164.db2.gz	OMKBOHBGMMHMSF-NSHDSACASA-N	0	3	341.321	3.397	20	30		EGEDHN
C[C@@H]1OCC[C@]1(O)CN(Cc1cc(C#N)cs1)Cc1ccccc1	ZINC000578579522	459223404	/nfs/dbraw/zinc/22/34/04/459223404.db2.gz	ABOBFJFSBKOXTB-KXBFYZLASA-N	0	3	342.464	3.162	20	30		EGEDHN
CC[C@H](N[C@@H]1CC(=O)N(c2ccc(OC)cc2)C1)c1ccc(C#N)cc1	ZINC000595077340	459238801	/nfs/dbraw/zinc/23/88/01/459238801.db2.gz	HBKCQAZYCZVPAE-XLIONFOSSA-N	0	3	349.434	3.413	20	30		EGEDHN
C[C@H](N[C@@H](COC(N)=O)Cc1ccccc1)c1ccc(C#N)c(F)c1	ZINC000496597115	459253006	/nfs/dbraw/zinc/25/30/06/459253006.db2.gz	UAKKYYXROCIYGF-SUMWQHHRSA-N	0	3	341.386	3.469	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CCC(CCC#N)CC1	ZINC000580711869	459263703	/nfs/dbraw/zinc/26/37/03/459263703.db2.gz	OWOCRFXNOQFXHA-LJQANCHMSA-N	0	3	328.456	3.171	20	30		EGEDHN
N#Cc1ccc(CCN2CCC(CC(=O)NC3CCCC3)CC2)cc1	ZINC000595293572	459269297	/nfs/dbraw/zinc/26/92/97/459269297.db2.gz	CRXYMUKGKNAPBL-UHFFFAOYSA-N	0	3	339.483	3.262	20	30		EGEDHN
C=CCOc1ccc(CNCc2ccc3cnn(C)c3c2)cc1OC	ZINC000581224987	459270074	/nfs/dbraw/zinc/27/00/74/459270074.db2.gz	WOOXHOQZPADBPB-UHFFFAOYSA-N	0	3	337.423	3.437	20	30		EGEDHN
Cc1cc([C@@H](C)NC[C@H](O)COc2ccc(CC#N)cc2)ccc1F	ZINC000581291726	459270716	/nfs/dbraw/zinc/27/07/16/459270716.db2.gz	IUXIJQADGGWYFE-QAPCUYQASA-N	0	3	342.414	3.291	20	30		EGEDHN
C=CCc1ccc(OC[C@H](O)CN2CC(C3CCCC3)C2)c(OC)c1	ZINC000481720392	459271264	/nfs/dbraw/zinc/27/12/64/459271264.db2.gz	SQVGPIPAZWMZDZ-LJQANCHMSA-N	0	3	345.483	3.285	20	30		EGEDHN
N#CCCC1CCN(Cc2cccc(CN3CCOCC3)c2)CC1	ZINC000581605708	459275226	/nfs/dbraw/zinc/27/52/26/459275226.db2.gz	UIFJMZXCJLQNDK-UHFFFAOYSA-N	0	3	327.472	3.035	20	30		EGEDHN
CC(C)N1CCN([C@H]2CCN([C@H](C#N)c3ccc(Cl)cc3)C2)CC1	ZINC000595341724	459279729	/nfs/dbraw/zinc/27/97/29/459279729.db2.gz	YMFZHZMOTMAYRH-RBUKOAKNSA-N	0	3	346.906	3.005	20	30		EGEDHN
N#Cc1ccc(CCN2CCC(C(=O)NC3CCCCC3)CC2)cc1	ZINC000595360648	459284720	/nfs/dbraw/zinc/28/47/20/459284720.db2.gz	JVLVWULBOBKHMR-UHFFFAOYSA-N	0	3	339.483	3.262	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)[C@H](C)N[C@@H](C)C(C)(C)c1ccccc1	ZINC000538153499	459368736	/nfs/dbraw/zinc/36/87/36/459368736.db2.gz	SKQGPGTZIMYITC-FTRWYGJKSA-N	0	3	329.488	3.385	20	30		EGEDHN
C=CCN(C(=O)NC[C@H](C1CC1)N(C)Cc1ccccc1)C1CC1	ZINC000483684696	459382110	/nfs/dbraw/zinc/38/21/10/459382110.db2.gz	MVKHIHMYHLHCKO-LJQANCHMSA-N	0	3	327.472	3.257	20	30		EGEDHN
CN(CCNC(=O)c1ccc(Cl)c(C#N)c1)Cc1ccccc1	ZINC000540884743	459396528	/nfs/dbraw/zinc/39/65/28/459396528.db2.gz	SRBTXMCWXDUMND-UHFFFAOYSA-N	0	3	327.815	3.073	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)[C@H](C)N1CCC(Cc2ccccc2)CC1	ZINC000484286570	459411390	/nfs/dbraw/zinc/41/13/90/459411390.db2.gz	BFPOVFAIJLUPEX-MSOLQXFVSA-N	0	3	341.499	3.338	20	30		EGEDHN
CN(CCC#N)C[C@H](O)CN[C@@H]1CCc2ccc(-c3ccccc3)cc21	ZINC000591761370	459430547	/nfs/dbraw/zinc/43/05/47/459430547.db2.gz	FMHFTQDDGSMYBC-IFMALSPDSA-N	0	3	349.478	3.137	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](O)COCc2ccccc2F)cc1Cl	ZINC000591765792	459431649	/nfs/dbraw/zinc/43/16/49/459431649.db2.gz	IKIFJJJVYUMAHR-INIZCTEOSA-N	0	3	348.805	3.018	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@@H](C)NCC(C)(C)c1ccc(OC)cc1	ZINC000561881359	459489344	/nfs/dbraw/zinc/48/93/44/459489344.db2.gz	AOJWVXDULIXLGF-MRXNPFEDSA-N	0	3	330.472	3.152	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(OC3CCCC3)cc2)CC1	ZINC000592068745	459520154	/nfs/dbraw/zinc/52/01/54/459520154.db2.gz	WTGOGUHYGCBBHA-UHFFFAOYSA-N	0	3	328.456	3.388	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCOc2ccccc2Cl)CC1	ZINC000592075523	459520683	/nfs/dbraw/zinc/52/06/83/459520683.db2.gz	CLIXWPOJTQSXKK-UHFFFAOYSA-N	0	3	336.863	3.266	20	30		EGEDHN
CCc1nc(C#N)cc(N(C)[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)n1	ZINC000596132984	459531040	/nfs/dbraw/zinc/53/10/40/459531040.db2.gz	AALFPAUUGLWRKP-VQIMIIECSA-N	0	3	349.482	3.400	20	30		EGEDHN
CCc1nc(C#N)cc(N(CC)C[C@@H]2CCN(Cc3ccccc3)C2)n1	ZINC000596145079	459536320	/nfs/dbraw/zinc/53/63/20/459536320.db2.gz	QHYRAWGBANRDSZ-GOSISDBHSA-N	0	3	349.482	3.259	20	30		EGEDHN
N#CC[C@]1(O)CCN(CC/C=C/c2ccc(Br)cc2)C1	ZINC000592151180	459537680	/nfs/dbraw/zinc/53/76/80/459537680.db2.gz	NSVCYXGVDBBDGA-VQRJYJFOSA-N	0	3	335.245	3.203	20	30		EGEDHN
CC[C@@H](CN[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O)c1ccccc1	ZINC000488556677	459545391	/nfs/dbraw/zinc/54/53/91/459545391.db2.gz	JVBAUUNUPMXIHJ-PZJWPPBQSA-N	0	3	347.462	3.443	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)CN(C)[C@H]1CC[C@@H](C(F)(F)F)CC1	ZINC000570431084	459556789	/nfs/dbraw/zinc/55/67/89/459556789.db2.gz	TYUVZHKSYYXIKN-VNHYZAJKSA-N	0	3	333.398	3.094	20	30		EGEDHN
C=CCn1cccc1C(=O)N(CCCc1ccccc1)CCN(C)C	ZINC000488946192	459556956	/nfs/dbraw/zinc/55/69/56/459556956.db2.gz	QHEHMGSVMPWPFE-UHFFFAOYSA-N	0	3	339.483	3.311	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1CN[C@@H](C)c1ccc(Br)cn1	ZINC000562439545	459562559	/nfs/dbraw/zinc/56/25/59/459562559.db2.gz	UDDQKMUZCCGMMG-HUBLWGQQSA-N	0	3	325.250	3.476	20	30		EGEDHN
N#CC1(c2ccccc2)CCC(NCc2nnc3ccccn32)CC1	ZINC000542819781	459599333	/nfs/dbraw/zinc/59/93/33/459599333.db2.gz	AWTXIYKVMXDTJB-UHFFFAOYSA-N	0	3	331.423	3.223	20	30		EGEDHN
C[C@]1(Cc2ccccc2F)CCCN1Cc1cnc2c(C#N)cnn2c1	ZINC000592525478	459625720	/nfs/dbraw/zinc/62/57/20/459625720.db2.gz	MLJXBKJDPJEHCM-HXUWFJFHSA-N	0	3	349.413	3.337	20	30		EGEDHN
C#CCN1CCC(C(=O)NCC2(Cc3cccc(Cl)c3)CC2)CC1	ZINC000491535584	459635266	/nfs/dbraw/zinc/63/52/66/459635266.db2.gz	CYTMEIUNVPYPAH-UHFFFAOYSA-N	0	3	344.886	3.124	20	30		EGEDHN
CN(CCc1ccccc1)[C@H]1CCN(C(=O)Nc2cccc(C#N)c2)C1	ZINC000596471533	459648401	/nfs/dbraw/zinc/64/84/01/459648401.db2.gz	WVKAFQAXKTWXCI-FQEVSTJZSA-N	0	3	348.450	3.339	20	30		EGEDHN
CC(C)N(C(=O)CC(C)(C)C#N)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000592693941	459669008	/nfs/dbraw/zinc/66/90/08/459669008.db2.gz	CSFJQGXNZAECQZ-GOSISDBHSA-N	0	3	327.472	3.438	20	30		EGEDHN
CN(C)C/C=C/C(=O)Nc1cccc(COc2ccc(CC#N)cc2)c1	ZINC000491885749	459683315	/nfs/dbraw/zinc/68/33/15/459683315.db2.gz	POHXGVLMAIDZAV-QPJJXVBHSA-N	0	3	349.434	3.388	20	30		EGEDHN
Cc1cc(C(C)(C)C)ccc1OC[C@H](O)CN[C@@H]1CC[C@H](C#N)C1	ZINC000573596736	459703621	/nfs/dbraw/zinc/70/36/21/459703621.db2.gz	NVCPQIYOSCMFSW-CGTJXYLNSA-N	0	3	330.472	3.314	20	30		EGEDHN
CCN1C[C@@H](C)N(Cc2cc(C#N)ccc2Br)C[C@@H]1C	ZINC000492585129	459711690	/nfs/dbraw/zinc/71/16/90/459711690.db2.gz	WPXPNLZNLATEGM-QWHCGFSZSA-N	0	3	336.277	3.235	20	30		EGEDHN
C=CCOc1ccc(Br)cc1NC(=O)/C=C/CN(C)C	ZINC000493319728	459740644	/nfs/dbraw/zinc/74/06/44/459740644.db2.gz	KGNBHMNOMVEGSP-AATRIKPKSA-N	0	3	339.233	3.070	20	30		EGEDHN
CN(C(=O)C(C[C@@H]1CCCO1)C(F)(F)F)c1ccc(C#N)cc1	ZINC000593073070	459764997	/nfs/dbraw/zinc/76/49/97/459764997.db2.gz	OTYSSIJCCDAILL-KBPBESRZSA-N	0	3	326.318	3.269	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCCOc1cncc(Cl)c1	ZINC000563631465	459767518	/nfs/dbraw/zinc/76/75/18/459767518.db2.gz	QZSRFAKJKYHFFL-OAHLLOKOSA-N	0	3	343.814	3.003	20	30		EGEDHN
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCc1ccc(C#N)s1	ZINC000584581640	459772439	/nfs/dbraw/zinc/77/24/39/459772439.db2.gz	NUGZYNRXGRFZMU-SUMWQHHRSA-N	0	3	328.437	3.130	20	30		EGEDHN
CCC(C#N)(CC)C(=O)N1CCCN(CCCc2ccccc2)CC1	ZINC000528354388	459803820	/nfs/dbraw/zinc/80/38/20/459803820.db2.gz	XKBMTYGTPUNYQH-UHFFFAOYSA-N	0	3	341.499	3.483	20	30		EGEDHN
CC[C@@H]1c2ccsc2CCN1C[C@H](O)COc1ccccc1C#N	ZINC000528353517	459803845	/nfs/dbraw/zinc/80/38/45/459803845.db2.gz	UDRJTZRWYCPXSF-DOTOQJQBSA-N	0	3	342.464	3.369	20	30		EGEDHN
C[C@@H]1CCN(C[C@H](O)COc2ccccc2C#N)[C@H](c2ccco2)C1	ZINC000528394351	459805684	/nfs/dbraw/zinc/80/56/84/459805684.db2.gz	JZTFIHDTGFYQOX-NJAFHUGGSA-N	0	3	340.423	3.364	20	30		EGEDHN
CCC1(CNCCS(=O)(=O)c2ccc(C#N)cc2)CCCCC1	ZINC000574631525	459843837	/nfs/dbraw/zinc/84/38/37/459843837.db2.gz	FUUODVABLAFFHY-UHFFFAOYSA-N	0	3	334.485	3.282	20	30		EGEDHN
CC(C)C[C@H](C#N)NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000608822121	459886828	/nfs/dbraw/zinc/88/68/28/459886828.db2.gz	GOTIEZHRNDIJHH-FUHWJXTLSA-N	0	3	331.435	3.092	20	30		EGEDHN
CN(C)Cc1ccc(NC(=O)[C@@H]2CCCN2c2ccc(C#N)cc2)cc1	ZINC000609100865	459904913	/nfs/dbraw/zinc/90/49/13/459904913.db2.gz	FPWHNCLECCZQLZ-FQEVSTJZSA-N	0	3	348.450	3.227	20	30		EGEDHN
C[C@@H](C#N)CN(C)C(=O)c1ccccc1OCCN1CCCC[C@@H]1C	ZINC000609201098	459923420	/nfs/dbraw/zinc/92/34/20/459923420.db2.gz	MQKVDGADGBFIIM-IRXDYDNUSA-N	0	3	343.471	3.171	20	30		EGEDHN
C[C@H](CCC#N)CN1CCN(c2c(C#N)cnc3ccccc32)CC1	ZINC000602453212	459945450	/nfs/dbraw/zinc/94/54/50/459945450.db2.gz	GRNQVKATOLFLDC-MRXNPFEDSA-N	0	3	333.439	3.168	20	30		EGEDHN
CCOc1ccc([C@H](C)NC[C@@H](O)CC(C)(C)C#N)cc1OCC	ZINC000598599283	459959099	/nfs/dbraw/zinc/95/90/99/459959099.db2.gz	IYPQLASIJGSTQT-HOCLYGCPSA-N	0	3	334.460	3.435	20	30		EGEDHN
N#Cc1nc(NC[C@@H]2CCCN(Cc3ccccc3)C2)ccc1Cl	ZINC000609449135	459964592	/nfs/dbraw/zinc/96/45/92/459964592.db2.gz	IBQHLEWFKSIRQW-INIZCTEOSA-N	0	3	340.858	3.353	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN1CCC2(CCc3ccccc3O2)CC1	ZINC000598628747	459969102	/nfs/dbraw/zinc/96/91/02/459969102.db2.gz	QOHYXBQFGCGJRH-QGZVFWFLSA-N	0	3	328.456	3.147	20	30		EGEDHN
C[C@@H](CC1(C#N)CCOCC1)NCc1ccc(-n2ccnc2)c(F)c1	ZINC000602520136	459979308	/nfs/dbraw/zinc/97/93/08/459979308.db2.gz	FJDXIPZBHLMWFP-HNNXBMFYSA-N	0	3	342.418	3.200	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CC[C@@H](N(C)CCc2ccccc2)C1)OCC	ZINC000618354027	459980534	/nfs/dbraw/zinc/98/05/34/459980534.db2.gz	SATYWJDMMDTQRO-WOJBJXKFSA-N	0	3	344.499	3.133	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CC1(C#N)CCCCC1	ZINC000597515645	459981918	/nfs/dbraw/zinc/98/19/18/459981918.db2.gz	CTAQOGJWYZCQCN-HKUYNNGSSA-N	0	3	339.483	3.487	20	30		EGEDHN
COc1ccccc1SC[C@H](C)CNCc1cccc(C#N)n1	ZINC000602540422	459991079	/nfs/dbraw/zinc/99/10/79/459991079.db2.gz	PFGDGSBNZNLJRJ-CQSZACIVSA-N	0	3	327.453	3.480	20	30		EGEDHN
CCOc1cc(CN[C@@H](C)CC2(C#N)CCOCC2)ccc1OC	ZINC000602548424	459991563	/nfs/dbraw/zinc/99/15/63/459991563.db2.gz	ZCALPXMUHHXTLX-HNNXBMFYSA-N	0	3	332.444	3.282	20	30		EGEDHN
C[C@H](CC1(C#N)CCOCC1)NCCc1nc(C(F)(F)F)cs1	ZINC000602556906	459995159	/nfs/dbraw/zinc/99/51/59/459995159.db2.gz	GURZHPDFJVVEQC-LLVKDONJSA-N	0	3	347.406	3.393	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCc1ccncc1C(F)(F)F	ZINC000597576735	459999227	/nfs/dbraw/zinc/99/92/27/459999227.db2.gz	DKPVRWKOLKRYLB-CQSZACIVSA-N	0	3	347.340	3.489	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CNCc1cc(Cl)ccc1OC(F)F	ZINC000598719723	460004705	/nfs/dbraw/zinc/00/47/05/460004705.db2.gz	KNMUPNAPEZYBRH-LBPRGKRZSA-N	0	3	332.778	3.332	20	30		EGEDHN
N#CCN1CCC(NCc2ccc(-c3c(F)cccc3F)o2)CC1	ZINC000609677672	460007866	/nfs/dbraw/zinc/00/78/66/460007866.db2.gz	WCLARBCDZAIAGM-UHFFFAOYSA-N	0	3	331.366	3.302	20	30		EGEDHN
Cn1nccc1[C@H]1CCCCN1C(=O)C(C#N)CCc1ccccc1	ZINC000597612329	460008410	/nfs/dbraw/zinc/00/84/10/460008410.db2.gz	WACJOSJOVYXYAJ-IEBWSBKVSA-N	0	3	336.439	3.246	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)C(=O)NC[C@@H](c1ccccc1)N(C)C	ZINC000593943165	460022139	/nfs/dbraw/zinc/02/21/39/460022139.db2.gz	KFGVTSOVNDJKDO-JXFKEZNVSA-N	0	3	335.451	3.156	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)C(=O)NCCCN(C)Cc1ccccc1	ZINC000593955680	460026978	/nfs/dbraw/zinc/02/69/78/460026978.db2.gz	UXYCWAFKPLGWPI-SFHVURJKSA-N	0	3	349.478	3.375	20	30		EGEDHN
CC(C#N)C(=O)NCCOc1ccc2cc(Br)ccc2c1	ZINC000609921029	460039651	/nfs/dbraw/zinc/03/96/51/460039651.db2.gz	FDIUJCYLKUPDHE-NSHDSACASA-N	0	3	347.212	3.257	20	30		EGEDHN
C[C@@H]1[C@H](C)N(Cc2ccccc2)[C@@H](C)CN1Cc1ccc(C#N)cn1	ZINC000594015138	460056911	/nfs/dbraw/zinc/05/69/11/460056911.db2.gz	GQJHGZVEQPZNEC-KSZLIROESA-N	0	3	334.467	3.437	20	30		EGEDHN
C=C(C)CN1CCC(Nc2c(C#N)cnc3c(F)ccc(F)c32)CC1	ZINC000610277495	460104606	/nfs/dbraw/zinc/10/46/06/460104606.db2.gz	QCPOFPOGTRZWJQ-UHFFFAOYSA-N	0	3	342.393	3.259	20	30		EGEDHN
COc1ccc(CN(Cc2ccc(OC)cc2)C(=O)C(C)C#N)cc1	ZINC000610426032	460148032	/nfs/dbraw/zinc/14/80/32/460148032.db2.gz	QWJIHFCOCMXRPH-HNNXBMFYSA-N	0	3	338.407	3.392	20	30		EGEDHN
C[C@H](c1ccc(C#N)cc1)N(C)CCCN1C(=O)c2ccccc2C1=O	ZINC000576608933	460178359	/nfs/dbraw/zinc/17/83/59/460178359.db2.gz	JKNXEYBKHSCCPK-OAHLLOKOSA-N	0	3	347.418	3.237	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N1CCC(CCc2ccc(F)cc2F)CC1	ZINC000594448831	460223860	/nfs/dbraw/zinc/22/38/60/460223860.db2.gz	PRADOSOXYQMIRD-SFHVURJKSA-N	0	3	349.425	3.157	20	30		EGEDHN
C[C@@H]1CN(C(=O)Nc2cc(F)cc(C#N)c2)CCN(C2CCC2)C1	ZINC000603071445	460235575	/nfs/dbraw/zinc/23/55/75/460235575.db2.gz	XMLNBXJUUNVPDA-ZDUSSCGKSA-N	0	3	330.407	3.035	20	30		EGEDHN
C[C@H](NC[C@H](O)COc1ccccc1C#N)c1cc2ccccc2o1	ZINC000599358406	460238916	/nfs/dbraw/zinc/23/89/16/460238916.db2.gz	HYKBALRELCWPKJ-YOEHRIQHSA-N	0	3	336.391	3.395	20	30		EGEDHN
C[C@@H](NC1CCN(CC#N)CC1)c1cc(Br)ccc1F	ZINC000610813495	460241190	/nfs/dbraw/zinc/24/11/90/460241190.db2.gz	ITKILYDCUUQXFZ-LLVKDONJSA-N	0	3	340.240	3.227	20	30		EGEDHN
C[C@H](N[C@@H](C)c1cccc(C#N)c1)c1ccc(NS(C)(=O)=O)cc1	ZINC000610829950	460245460	/nfs/dbraw/zinc/24/54/60/460245460.db2.gz	TVVFHEQJXLKLDQ-KBPBESRZSA-N	0	3	343.452	3.342	20	30		EGEDHN
COc1ccc(C#N)cc1CN1C[C@H]2CN(c3ccccc3)C[C@@H]2C1	ZINC000610952842	460265318	/nfs/dbraw/zinc/26/53/18/460265318.db2.gz	KZZMORBJARDYAU-OALUTQOASA-N	0	3	333.435	3.135	20	30		EGEDHN
C[C@@H](NC1CCN(CC#N)CC1)c1ccc(Br)cc1F	ZINC000615085835	460272787	/nfs/dbraw/zinc/27/27/87/460272787.db2.gz	KLCMWKGOHQMFRC-LLVKDONJSA-N	0	3	340.240	3.227	20	30		EGEDHN
C[C@H]1CN(CCOc2cccc(C#N)c2)CC[C@@H]1C(=O)OC(C)(C)C	ZINC000599586149	460281239	/nfs/dbraw/zinc/28/12/39/460281239.db2.gz	HBCCCKHAORSXOG-YJBOKZPZSA-N	0	3	344.455	3.237	20	30		EGEDHN
CN(Cc1ccccc1)C[C@@H](O)COc1ccc(C#N)c(Cl)c1	ZINC000615167024	460287635	/nfs/dbraw/zinc/28/76/35/460287635.db2.gz	QSBVFBYTNLSNRM-MRXNPFEDSA-N	0	3	330.815	3.083	20	30		EGEDHN
COc1cc(NC(=O)NC[C@@H](C)N2CCCC[C@@H]2C)c(F)cc1C#N	ZINC000599818715	460340850	/nfs/dbraw/zinc/34/08/50/460340850.db2.gz	ZDWMLMWOOWRHKH-QWHCGFSZSA-N	0	3	348.422	3.090	20	30		EGEDHN
C[C@@H](NC[C@@H](O)COc1ccccc1Cl)c1cccc(C#N)c1	ZINC000611386302	460349915	/nfs/dbraw/zinc/34/99/15/460349915.db2.gz	KTXKPQHCDCXJTE-CZUORRHYSA-N	0	3	330.815	3.302	20	30		EGEDHN
COCC(=O)Nc1cccc(CN[C@@H]2CCCc3cc(C#N)ccc32)c1	ZINC000611390545	460352624	/nfs/dbraw/zinc/35/26/24/460352624.db2.gz	GQAXBVOJIFBVER-HXUWFJFHSA-N	0	3	349.434	3.310	20	30		EGEDHN
C[C@@H](N[C@@H]1CCCc2cc(C#N)ccc21)C(=O)NCc1ccccc1	ZINC000611392463	460353788	/nfs/dbraw/zinc/35/37/88/460353788.db2.gz	RKQYUFLFHMWCKH-FOIQADDNSA-N	0	3	333.435	3.230	20	30		EGEDHN
C[C@H](C(=O)N(C)CCC#N)N1CCC[C@H](c2cc3ccccc3[nH]2)C1	ZINC000603890047	460356143	/nfs/dbraw/zinc/35/61/43/460356143.db2.gz	MKHLCCQMPPOKEG-WBVHZDCISA-N	0	3	338.455	3.108	20	30		EGEDHN
N#Cc1ccccc1N1CCCN(Cc2cccc3n[nH]cc32)CC1	ZINC000600112254	460386275	/nfs/dbraw/zinc/38/62/75/460386275.db2.gz	VSAYBOOGFAYQOO-UHFFFAOYSA-N	0	3	331.423	3.147	20	30		EGEDHN
C[C@@H](Cc1cccs1)N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000611559851	460399011	/nfs/dbraw/zinc/39/90/11/460399011.db2.gz	BEVNTGQKMLGXLO-KSSFIOAISA-N	0	3	339.464	3.336	20	30		EGEDHN
C[C@H](Cc1cccs1)N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000611559852	460399037	/nfs/dbraw/zinc/39/90/37/460399037.db2.gz	BEVNTGQKMLGXLO-RDTXWAMCSA-N	0	3	339.464	3.336	20	30		EGEDHN
CC(C)N(Cc1cccs1)C[C@H](O)COc1ccc(CC#N)cc1	ZINC000604416417	460423176	/nfs/dbraw/zinc/42/31/76/460423176.db2.gz	JXJRODYJOKQEPP-KRWDZBQOSA-N	0	3	344.480	3.464	20	30		EGEDHN
CC(C)CN(CCc1ccccc1)CC(=O)N[C@](C)(C#N)C(C)C	ZINC000604459650	460429433	/nfs/dbraw/zinc/42/94/33/460429433.db2.gz	BDRWSOGXEKFWNT-HXUWFJFHSA-N	0	3	329.488	3.242	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)[C@H](C(C)C)N1CCCCC1	ZINC000600460986	460499504	/nfs/dbraw/zinc/49/95/04/460499504.db2.gz	MMNREKGUYHIYNF-IBGZPJMESA-N	0	3	330.472	3.378	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@H](C)Cn2ccnc2)cc1OC	ZINC000623356201	460507677	/nfs/dbraw/zinc/50/76/77/460507677.db2.gz	CKRSQQDAHWLEED-CYBMUJFWSA-N	0	3	335.835	3.288	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1ccccc1CC#N)C(C)C	ZINC000601165457	460737401	/nfs/dbraw/zinc/73/74/01/460737401.db2.gz	PCNJTGDRGIHFLL-LJQANCHMSA-N	0	3	325.456	3.181	20	30		EGEDHN
CN(C(=O)c1ccccc1CC#N)C1CCN(Cc2ccccc2)CC1	ZINC000601170057	460739954	/nfs/dbraw/zinc/73/99/54/460739954.db2.gz	KYTWZBCEDTWJBG-UHFFFAOYSA-N	0	3	347.462	3.489	20	30		EGEDHN
N#CC(C(=O)c1ccnc(-n2cccn2)c1)c1ccc2ccccc2n1	ZINC000607009533	460776011	/nfs/dbraw/zinc/77/60/11/460776011.db2.gz	SBNRJXNZUBOZDL-INIZCTEOSA-N	0	3	339.358	3.306	20	30		EGEDHN
N#Cc1ccc(Br)c(CN[C@H](CO)C2CCCCC2)c1	ZINC000617219508	460777359	/nfs/dbraw/zinc/77/73/59/460777359.db2.gz	HFTZLSRXVGMGHC-MRXNPFEDSA-N	0	3	337.261	3.352	20	30		EGEDHN
C=CCCNC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1	ZINC000617615272	460927900	/nfs/dbraw/zinc/92/79/00/460927900.db2.gz	FOVJXWKBRPNUFH-INIZCTEOSA-N	0	3	326.362	3.133	20	30		EGEDHN
Cc1ccc(CN2CC[C@@H](NC(=O)CCc3ccc(C#N)cc3)C2)cc1	ZINC000601879424	460933628	/nfs/dbraw/zinc/93/36/28/460933628.db2.gz	HHRCVQZCBOLNTI-OAQYLSRUSA-N	0	3	347.462	3.190	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN(CCCO)C2CC2)cc1OC	ZINC000628173917	461034051	/nfs/dbraw/zinc/03/40/51/461034051.db2.gz	PYCGTRDGHUAHKC-UHFFFAOYSA-N	0	3	325.836	3.260	20	30		EGEDHN
C=CCN(CCc1ccccc1)C(=O)c1cc2c(s1)CCNC2	ZINC000662419675	461237852	/nfs/dbraw/zinc/23/78/52/461237852.db2.gz	LVYCNMGOZGGIGK-UHFFFAOYSA-N	0	3	326.465	3.265	20	30		EGEDHN
CC#CC[C@@H](CO)NCc1c(C)nn(-c2ccc(Cl)cc2)c1C	ZINC000641769683	461361600	/nfs/dbraw/zinc/36/16/00/461361600.db2.gz	XXZHUFUAYUWUPH-INIZCTEOSA-N	0	3	331.847	3.006	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1CNCc1cc(OC)c(OC)cc1Cl	ZINC000631127759	461573777	/nfs/dbraw/zinc/57/37/77/461573777.db2.gz	VHUPBYZAGQCSRC-SJCJKPOMSA-N	0	3	325.836	3.428	20	30		EGEDHN
C=C(C)[C@@H](NCCc1nnn(C(C)(C)C)n1)c1ccc(F)c(F)c1	ZINC000660311391	461702531	/nfs/dbraw/zinc/70/25/31/461702531.db2.gz	GZXNYPPKAZVYNG-MRXNPFEDSA-N	0	3	335.402	3.156	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@@H](C)N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1	ZINC000639906097	462164199	/nfs/dbraw/zinc/16/41/99/462164199.db2.gz	QGZJWFAGESDVPQ-OLMNPRSZSA-N	0	3	348.874	3.349	20	30		EGEDHN
Cc1cc(F)ccc1C(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000178275948	533862913	/nfs/dbraw/zinc/86/29/13/533862913.db2.gz	HMGNTQAJFPRIMK-UHFFFAOYSA-N	0	3	339.414	3.210	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]2CN(Cc3ccc(C#N)o3)C[C@@H]21	ZINC000363844130	534894654	/nfs/dbraw/zinc/89/46/54/534894654.db2.gz	IAESLMUXPUOEGE-XOKHGSTOSA-N	0	3	345.443	3.276	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)[C@@H](C)c2ccc(OC)cc2)CC1	ZINC000171739533	526423679	/nfs/dbraw/zinc/42/36/79/526423679.db2.gz	GGOQJPNMHPJLSS-HNNXBMFYSA-N	0	3	331.460	3.048	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@H]2c2cccc(C)c2)CC1	ZINC000171741025	526426844	/nfs/dbraw/zinc/42/68/44/526426844.db2.gz	BHHANGSGVRFHGZ-IBGZPJMESA-N	0	3	327.472	3.492	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCc2cccc(OCC(C)C)c2)CC1	ZINC000171724340	526434872	/nfs/dbraw/zinc/43/48/72/526434872.db2.gz	GOOFLHRNJSNFNF-UHFFFAOYSA-N	0	3	345.487	3.171	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccccc2OCC(C)C)CC1	ZINC000171741713	526441187	/nfs/dbraw/zinc/44/11/87/526441187.db2.gz	ZQWCFRHAFJUEDN-UHFFFAOYSA-N	0	3	331.460	3.493	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccccc2Br)CC1	ZINC000171738741	526441930	/nfs/dbraw/zinc/44/19/30/526441930.db2.gz	RZRJOWCGUBMHMB-UHFFFAOYSA-N	0	3	338.249	3.221	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2c(F)c(F)cc(F)c2F)CC1	ZINC000177829587	526598896	/nfs/dbraw/zinc/59/88/96/526598896.db2.gz	RFEBJUJYEYVXGW-UHFFFAOYSA-N	0	3	330.325	3.013	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cn(CC)c3ccccc23)CC1	ZINC000171729699	526602205	/nfs/dbraw/zinc/60/22/05/526602205.db2.gz	FHFIEPIPOVRJEV-UHFFFAOYSA-N	0	3	325.456	3.432	20	30		EGEDHN
CC(C)(C)[C@@H](CCO)NCc1cc(C#N)ccc1Br	ZINC000191822560	526615017	/nfs/dbraw/zinc/61/50/17/526615017.db2.gz	NZDQNCHMEVIIMS-CQSZACIVSA-N	0	3	325.250	3.207	20	30		EGEDHN
C=CCOc1ccc(CNC[C@@](C)(O)c2cccs2)cc1OC	ZINC000152992547	526885473	/nfs/dbraw/zinc/88/54/73/526885473.db2.gz	UDDJAMZMEJADBF-GOSISDBHSA-N	0	3	333.453	3.319	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H](CCC)CCc2ccccc2)CC1	ZINC000130227360	526928527	/nfs/dbraw/zinc/92/85/27/526928527.db2.gz	ZSYNXKIYVSHOFM-FQEVSTJZSA-N	0	3	326.484	3.249	20	30		EGEDHN
C=CCCCC(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000175466575	527107457	/nfs/dbraw/zinc/10/74/57/527107457.db2.gz	IYXZQYCWTBZCCY-UHFFFAOYSA-N	0	3	330.472	3.380	20	30		EGEDHN
COc1ccccc1NC(=O)[C@@H](C)N[C@H]1CCC(=O)NC12CCC2	ZINC000328693314	547482629	/nfs/dbraw/zinc/48/26/29/547482629.db2.gz	JOFXZZZBIMIBMQ-DOMZBBRYSA-N	0	3	331.416	3.303	20	30		EGEDHN
Cn1c2ccc(C(=O)NCC3=CCN(C)CC3)cc2nc1C(F)F	ZINC000328828534	547485843	/nfs/dbraw/zinc/48/58/43/547485843.db2.gz	QSRICSDNUXXOQB-UHFFFAOYSA-N	0	3	334.370	3.077	20	30		EGEDHN
CC(C)(C)n1ccnc1SCC(=O)NC1CCN(C2CC2)CC1	ZINC000329385742	547495927	/nfs/dbraw/zinc/49/59/27/547495927.db2.gz	QBXCFUROIFEBNS-UHFFFAOYSA-N	0	3	336.505	3.314	20	30		EGEDHN
O=C(Cc1cc(F)cc2c1OCOC2)NC[C@H]1CCCCN1C1CC1	ZINC000329969576	547511477	/nfs/dbraw/zinc/51/14/77/547511477.db2.gz	WQSVUHCOJJZHPN-QGZVFWFLSA-N	0	3	348.418	3.208	20	30		EGEDHN
C=CCOc1ccc(CN[C@H](C)c2cccc(-n3cnnn3)c2)cc1	ZINC000671764779	548356139	/nfs/dbraw/zinc/35/61/39/548356139.db2.gz	MVEAZYVDXXJPQK-OAHLLOKOSA-N	0	3	335.411	3.078	20	30		EGEDHN
CCC(=O)N1CCC(NCC#Cc2ccc(C(F)(F)F)cc2)CC1	ZINC000674911469	548826665	/nfs/dbraw/zinc/82/66/65/548826665.db2.gz	FRZGRWNVQYTNSK-UHFFFAOYSA-N	0	3	338.373	3.048	20	30		EGEDHN
C=CCC[C@H](O)CN1CCN(Cc2ccc(C(F)(F)F)cc2)CC1	ZINC000675486696	548928380	/nfs/dbraw/zinc/92/83/80/548928380.db2.gz	LPMIJQVDXBZKGX-KRWDZBQOSA-N	0	3	342.405	3.150	20	30		EGEDHN
N#Cc1ccc(NC(=S)NC2CCN(C3CC3)CC2)cc1Cl	ZINC000726454303	574554805	/nfs/dbraw/zinc/55/48/05/574554805.db2.gz	YUOMNPOQPSENIU-UHFFFAOYSA-N	0	3	334.876	3.125	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)C(=O)NC1CCCCC1)c1ccccc1F	ZINC000726858724	574574312	/nfs/dbraw/zinc/57/43/12/574574312.db2.gz	UAFPKAJBNCHIHH-BBRMVZONSA-N	0	3	330.403	3.477	20	30		EGEDHN
CN(C)CCOc1ccc(CCNc2c(F)cc(C#N)cc2F)cc1	ZINC000729183191	574821424	/nfs/dbraw/zinc/82/14/24/574821424.db2.gz	HNGIHPKBJYWDLM-UHFFFAOYSA-N	0	3	345.393	3.431	20	30		EGEDHN
CON=Cc1ccc(C(=O)N(CCN(C)C)CC2CCCCC2)cc1	ZINC000729333620	574843405	/nfs/dbraw/zinc/84/34/05/574843405.db2.gz	COWOEDDKVLSTEI-UHFFFAOYSA-N	0	3	345.487	3.251	20	30		EGEDHN
Cc1noc(C)c1CC(=O)C(C#N)c1nc2cc(F)ccc2s1	ZINC000730417156	574984679	/nfs/dbraw/zinc/98/46/79/574984679.db2.gz	LLTKBGCTSQKGJR-LBPRGKRZSA-N	0	3	329.356	3.459	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CNC(C)(C)C(=O)Nc2ccccc2)cc1	ZINC000731041813	575046536	/nfs/dbraw/zinc/04/65/36/575046536.db2.gz	YCRVVRJCIBBVJD-HNNXBMFYSA-N	0	3	337.423	3.484	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CNC(C)(C)C(=O)Nc2ccccc2)cc1	ZINC000731041814	575046561	/nfs/dbraw/zinc/04/65/61/575046561.db2.gz	YCRVVRJCIBBVJD-OAHLLOKOSA-N	0	3	337.423	3.484	20	30		EGEDHN
CC(C)n1ccc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)n1	ZINC000733679386	575381162	/nfs/dbraw/zinc/38/11/62/575381162.db2.gz	YUBYRTUVXYBJNZ-LLVKDONJSA-N	0	3	330.775	3.079	20	30		EGEDHN
CCOCCC[N@@H+]1CC[C@H](/N=C/c2ccc(OCC)cc2[O-])[C@@H](C)C1	ZINC000734366170	575474588	/nfs/dbraw/zinc/47/45/88/575474588.db2.gz	HAYACCHDYICEGX-ARMOGDTMSA-N	0	3	348.487	3.347	20	30		EGEDHN
CCOCCC[N@H+]1CC[C@H](/N=C/c2ccc(OCC)cc2[O-])[C@@H](C)C1	ZINC000734366170	575474589	/nfs/dbraw/zinc/47/45/89/575474589.db2.gz	HAYACCHDYICEGX-ARMOGDTMSA-N	0	3	348.487	3.347	20	30		EGEDHN
CCCCCCCCCC(=O)N1CCN([C@@H]2CCCN(C)C2)CC1	ZINC000734454067	575490802	/nfs/dbraw/zinc/49/08/02/575490802.db2.gz	SHEYANGBAKGDLJ-LJQANCHMSA-N	0	3	337.552	3.366	20	30		EGEDHN
C#Cc1ccc(C(=O)NC2CCN([C@H](C)c3ccccc3)CC2)cn1	ZINC000734783315	575551455	/nfs/dbraw/zinc/55/14/55/575551455.db2.gz	OHDDKSHFZCRNRY-MRXNPFEDSA-N	0	3	333.435	3.018	20	30		EGEDHN
C[C@H](Cc1ccccc1F)C(=O)C(C#N)C(=O)NC1CCCCC1	ZINC000739153290	576379897	/nfs/dbraw/zinc/37/98/97/576379897.db2.gz	AITFYWBUNXZNFR-CJNGLKHVSA-N	0	3	330.403	3.162	20	30		EGEDHN
C#CCCN1CCC(NC(=O)CCCOc2ccccc2Cl)CC1	ZINC000740736497	576621827	/nfs/dbraw/zinc/62/18/27/576621827.db2.gz	WUCRPMNRNSHTLW-UHFFFAOYSA-N	0	3	348.874	3.103	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2ccc(N(C)CCCC)cc2)CC1	ZINC000740738171	576621945	/nfs/dbraw/zinc/62/19/45/576621945.db2.gz	XFWXUWGGZGVAGQ-UHFFFAOYSA-N	0	3	341.499	3.140	20	30		EGEDHN
C#CCOc1ccc(F)cc1NC(=O)N[C@@H](C)CN1CCC[C@H](C)C1	ZINC000743201954	576803325	/nfs/dbraw/zinc/80/33/25/576803325.db2.gz	SPRPNHVAGRDZMN-GJZGRUSLSA-N	0	3	347.434	3.080	20	30		EGEDHN
C#CCCN1CCC(NC(=O)CCc2c[nH]c3c2cccc3C)CC1	ZINC000743489497	576810271	/nfs/dbraw/zinc/81/02/71/576810271.db2.gz	HDWAGXLJNQVLJP-UHFFFAOYSA-N	0	3	337.467	3.013	20	30		EGEDHN
CCC[N@H+](Cc1ccc(-c2nnn[n-]2)cc1)CC(C)(C)CCC#N	ZINC000825318017	608547807	/nfs/dbraw/zinc/54/78/07/608547807.db2.gz	GURKSAMAQOXRHU-UHFFFAOYSA-N	0	3	326.448	3.409	20	30		EGEDHN
CCC[N@@H+](Cc1ccc(-c2nnn[n-]2)cc1)CC(C)(C)CCC#N	ZINC000825318017	608547809	/nfs/dbraw/zinc/54/78/09/608547809.db2.gz	GURKSAMAQOXRHU-UHFFFAOYSA-N	0	3	326.448	3.409	20	30		EGEDHN
CCC[N@H+](Cc1ccc(-c2nn[n-]n2)cc1)CC(C)(C)CCC#N	ZINC000825318017	608547811	/nfs/dbraw/zinc/54/78/11/608547811.db2.gz	GURKSAMAQOXRHU-UHFFFAOYSA-N	0	3	326.448	3.409	20	30		EGEDHN
CCC[N@@H+](Cc1ccc(-c2nn[n-]n2)cc1)CC(C)(C)CCC#N	ZINC000825318017	608547812	/nfs/dbraw/zinc/54/78/12/608547812.db2.gz	GURKSAMAQOXRHU-UHFFFAOYSA-N	0	3	326.448	3.409	20	30		EGEDHN
N#CC(C(=O)CCC(=O)CCC(=O)c1cccs1)c1ccccn1	ZINC000041481211	1291417778	/nfs/dbraw/zinc/41/77/78/1291417778.db2.gz	MDPVAEFLKATTGB-CQSZACIVSA-N	0	3	340.404	3.332	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2cc(C#N)ccc2F)CN1Cc1ccccc1	ZINC000830009983	1292653628	/nfs/dbraw/zinc/65/36/28/1292653628.db2.gz	KDSUFBDDWYCQRC-RHSMWYFYSA-N	0	3	337.398	3.090	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)CO[C@@H]2CCC[C@H](C)C2)c1	ZINC000112758918	1293132742	/nfs/dbraw/zinc/13/27/42/1293132742.db2.gz	INSSIBAEPIYPRB-USXIJHARSA-N	0	3	328.412	3.238	20	30		EGEDHN
CC[C@H](NCc1ccc(C#N)cn1)[C@@H]1CCCN1C(=O)OC(C)(C)C	ZINC000834773604	1293145333	/nfs/dbraw/zinc/14/53/33/1293145333.db2.gz	HVEAHZUVQBRDKM-IRXDYDNUSA-N	0	3	344.459	3.221	20	30		EGEDHN
COc1ccc(C(C)N=Nc2ccncn2)cc1CN1CCCCC1	ZINC000835000916	1293184998	/nfs/dbraw/zinc/18/49/98/1293184998.db2.gz	BVPUTAKABKWHMP-UHFFFAOYSA-N	0	3	339.443	3.307	20	30		EGEDHN
C=C(C)COc1cc(CNCC[S@@](=O)C(C)(C)C)ccc1OC	ZINC000116921884	1293211412	/nfs/dbraw/zinc/21/14/12/1293211412.db2.gz	PYRHOZVNIQMRJJ-QHCPKHFHSA-N	0	3	339.501	3.287	20	30		EGEDHN
CC[C@H](CC(F)(F)F)C(=O)C(C#N)C(=O)NCc1cccc(C)c1	ZINC000835340523	1293268370	/nfs/dbraw/zinc/26/83/70/1293268370.db2.gz	NGHCSGIHYKTJLL-ZIAGYGMSSA-N	0	3	340.345	3.299	20	30		EGEDHN
Cc1cccc(CSCC(=O)C(C#N)C(=O)NC2CCCCC2)c1	ZINC000127368420	1293561829	/nfs/dbraw/zinc/56/18/29/1293561829.db2.gz	CSVHQRHCZWAOTL-QGZVFWFLSA-N	0	3	344.480	3.386	20	30		EGEDHN
CCc1ncsc1C(=O)C(C#N)C(=O)Nc1ccc(CC)cc1	ZINC000160165914	1294261271	/nfs/dbraw/zinc/26/12/71/1294261271.db2.gz	YRJAZJPDWXTXIG-ZDUSSCGKSA-N	0	3	327.409	3.229	20	30		EGEDHN
COc1ccc(CN[C@@H](C)c2ccc(OC)c(OC)c2)cc1C#N	ZINC000172688778	1294442085	/nfs/dbraw/zinc/44/20/85/1294442085.db2.gz	AQBHHCJLJMGGOO-ZDUSSCGKSA-N	0	3	326.396	3.435	20	30		EGEDHN
C[C@@H](CCc1ccccc1F)C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000174013077	1294476826	/nfs/dbraw/zinc/47/68/26/1294476826.db2.gz	WNBVNZCAEMKHCR-DZGCQCFKSA-N	0	3	339.370	3.137	20	30		EGEDHN
COc1csc(C(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)c1	ZINC000177596475	1294679656	/nfs/dbraw/zinc/67/96/56/1294679656.db2.gz	YTRQWPPFQZJEEG-GFCCVEGCSA-N	0	3	334.784	3.371	20	30		EGEDHN
C#CCOc1ccc(CN2CC[C@H](CNC(=O)OC(C)(C)C)C2)cc1	ZINC000179740141	1294820615	/nfs/dbraw/zinc/82/06/15/1294820615.db2.gz	VQMVPOKMKOLNDI-QGZVFWFLSA-N	0	3	344.455	3.045	20	30		EGEDHN
C=CCCN(OCc1ccccc1)C(=O)NC1CCN(CC=C)CC1	ZINC000187153579	1295371486	/nfs/dbraw/zinc/37/14/86/1295371486.db2.gz	IFLHVTJQTAHIQJ-UHFFFAOYSA-N	0	3	343.471	3.356	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)CCOc1c(C)cccc1C	ZINC000193380499	1295860527	/nfs/dbraw/zinc/86/05/27/1295860527.db2.gz	MQAMOWBSEDMECA-INIZCTEOSA-N	0	3	330.428	3.088	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)COCc2ccccc2)cc1	ZINC000193448928	1295870685	/nfs/dbraw/zinc/87/06/85/1295870685.db2.gz	XIKRIRUBHZLUHH-SFHVURJKSA-N	0	3	336.391	3.113	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)Cc1ccsc1	ZINC000193457472	1295873230	/nfs/dbraw/zinc/87/32/30/1295873230.db2.gz	AJGWNKAFFPXOJV-ZDUSSCGKSA-N	0	3	328.393	3.037	20	30		EGEDHN
CCOC(C)(C)C(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000870456461	1295881817	/nfs/dbraw/zinc/88/18/17/1295881817.db2.gz	IPQVQZHJKWXGRA-UHFFFAOYSA-N	0	3	344.455	3.151	20	30		EGEDHN
Cc1noc(C)c1[C@@H](C)C(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1	ZINC000195491935	1296072096	/nfs/dbraw/zinc/07/20/96/1296072096.db2.gz	IRNNAGRMJSFJEC-OTYXRUKQSA-N	0	3	345.786	3.396	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@@H]1C[C@H]1c1cccc(F)c1F	ZINC000246652651	1296365515	/nfs/dbraw/zinc/36/55/15/1296365515.db2.gz	WTXJMJUAWJQLKO-RRFJBIMHSA-N	0	3	348.393	3.474	20	30		EGEDHN
COc1ccc([C@@H](CO)N(C)Cc2ccc(O[C@@H](C)C#N)cc2)cc1	ZINC000305720147	1297034088	/nfs/dbraw/zinc/03/40/88/1297034088.db2.gz	AILXZAUHNVGMOF-MGPUTAFESA-N	0	3	340.423	3.151	20	30		EGEDHN
CC[C@@H](C)N1CCN(Cc2ccc(Br)cc2C#N)CC1	ZINC000312261008	1297114011	/nfs/dbraw/zinc/11/40/11/1297114011.db2.gz	HCFIALAWIXGQLG-CYBMUJFWSA-N	0	3	336.277	3.237	20	30		EGEDHN
C=C(Cl)C[C@@H](N)C(=O)NCC1(c2c(F)cccc2F)CCCC1	ZINC000876637882	1298888733	/nfs/dbraw/zinc/88/87/33/1298888733.db2.gz	URDURXFWYGWXNJ-CQSZACIVSA-N	0	3	342.817	3.363	20	30		EGEDHN
C#CCCCCCCN[C@H](c1nc(-c2nc[nH]n2)no1)C(C)(C)C	ZINC000877113666	1299163169	/nfs/dbraw/zinc/16/31/69/1299163169.db2.gz	NLXABEYRBDLNOZ-CYBMUJFWSA-N	0	3	330.436	3.115	20	30		EGEDHN
COc1ccc(CN2CCC(C(C)(C)O)CC2)cc1OCCCC#N	ZINC000877754410	1299529696	/nfs/dbraw/zinc/52/96/96/1299529696.db2.gz	DWOWLAFUALWYRL-UHFFFAOYSA-N	0	3	346.471	3.361	20	30		EGEDHN
CC[C@@H]1CN(C(C)=O)[C@@H](CC)CN1CCCOc1ccc(C#N)cc1	ZINC000752090841	1299691852	/nfs/dbraw/zinc/69/18/52/1299691852.db2.gz	DKYJHDPOCKQXHJ-MOPGFXCFSA-N	0	3	343.471	3.048	20	30		EGEDHN
CSC1CCN(CC(=O)C(C#N)c2nc3ccccc3s2)CC1	ZINC000879098363	1300367088	/nfs/dbraw/zinc/36/70/88/1300367088.db2.gz	CAWNBJYMTPHGAM-ZDUSSCGKSA-N	0	3	345.493	3.300	20	30		EGEDHN
C#CC[C@@H](NC(=O)NCCN(C)Cc1ccccc1)c1ccccc1	ZINC000757017141	1300612098	/nfs/dbraw/zinc/61/20/98/1300612098.db2.gz	WIFABANXWYSSLN-HXUWFJFHSA-N	0	3	335.451	3.182	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)c2cc(F)cc(Cl)c2)c1	ZINC000757304144	1300663473	/nfs/dbraw/zinc/66/34/73/1300663473.db2.gz	IYRSFQPFPMKYBG-HNNXBMFYSA-N	0	3	346.745	3.449	20	30		EGEDHN
C#CC[C@@H](NC(=O)NC[C@H](Cc1ccccc1)N(C)C)c1ccccc1	ZINC000757605418	1300692924	/nfs/dbraw/zinc/69/29/24/1300692924.db2.gz	KXFNETXCGFXVAL-LEWJYISDSA-N	0	3	349.478	3.223	20	30		EGEDHN
CC(C)(O)[C@@H]1CCCN(CC#Cc2ccc(OC(F)(F)F)cc2)C1	ZINC000879963351	1300810154	/nfs/dbraw/zinc/81/01/54/1300810154.db2.gz	ILQGOWVDHFBCKM-OAHLLOKOSA-N	0	3	341.373	3.420	20	30		EGEDHN
CC[C@]1(C)CCN(Cc2cc(=O)n3c4ccccc4[nH]c3c2C#N)C1	ZINC000758738127	1300948281	/nfs/dbraw/zinc/94/82/81/1300948281.db2.gz	ANTRGHRLOHTKBV-MGPUTAFESA-N	0	3	334.423	3.346	20	30		EGEDHN
C#CCCCCNC(=O)N[C@@H](CN1CCCCC1)c1ccccc1	ZINC000758784359	1300954961	/nfs/dbraw/zinc/95/49/61/1300954961.db2.gz	CWYGXTKRDNKNOF-IBGZPJMESA-N	0	3	327.472	3.316	20	30		EGEDHN
C#CCOc1ccc(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000762369364	1301665418	/nfs/dbraw/zinc/66/54/18/1301665418.db2.gz	GQFFDYUNYQESDQ-HXUWFJFHSA-N	0	3	348.446	3.045	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)C(F)=C1CCCC1	ZINC000763027762	1301807376	/nfs/dbraw/zinc/80/73/76/1301807376.db2.gz	AJEOXVVOASTQPU-UHFFFAOYSA-N	0	3	329.419	3.246	20	30		EGEDHN
CC(C)CCN(Cn1cc2c(c(C#N)c1=O)CCC2)C1CCCC1	ZINC000766611225	1302487294	/nfs/dbraw/zinc/48/72/94/1302487294.db2.gz	APVQHJJAHLIOIW-UHFFFAOYSA-N	0	3	327.472	3.457	20	30		EGEDHN
C#CCOc1ccccc1CN1CCC[C@@H](C(=O)N[C@@H](C)CCC)C1	ZINC000769212505	1303073161	/nfs/dbraw/zinc/07/31/61/1303073161.db2.gz	KBVBJCSZKIPOHP-PKOBYXMFSA-N	0	3	342.483	3.215	20	30		EGEDHN
C=CCCCCNC(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000769760642	1303171290	/nfs/dbraw/zinc/17/12/90/1303171290.db2.gz	OWIGCEWTOOFCEX-UHFFFAOYSA-N	0	3	331.529	3.471	20	30		EGEDHN
C#CCOc1ccccc1CNc1ccc(N2CCN(C)CC2)cc1C	ZINC000770402195	1303263152	/nfs/dbraw/zinc/26/31/52/1303263152.db2.gz	JZKIQCGWJOJGCS-UHFFFAOYSA-N	0	3	349.478	3.371	20	30		EGEDHN
C#CCN1CCC[C@@H](N[C@@H](c2cccnc2)c2ccc(F)c(C)c2)C1	ZINC000886663207	1303544455	/nfs/dbraw/zinc/54/44/55/1303544455.db2.gz	VVQACOVMXDXBFA-TZIWHRDSSA-N	0	3	337.442	3.306	20	30		EGEDHN
CN(CC(=O)C(C#N)c1nc2cc(F)ccc2s1)[C@@H]1CCSC1	ZINC000774073137	1303771875	/nfs/dbraw/zinc/77/18/75/1303771875.db2.gz	SCFOZKRNQSXMIW-NEPJUHHUSA-N	0	3	349.456	3.049	20	30		EGEDHN
Cc1cccc(C)c1OC[C@@H](O)CNC1(c2cccc(C#N)c2)CC1	ZINC000775432028	1303963065	/nfs/dbraw/zinc/96/30/65/1303963065.db2.gz	WSKVJGUYDZQVHQ-IBGZPJMESA-N	0	3	336.435	3.194	20	30		EGEDHN
CN1CCN(c2ccc(CN(CCC#N)CC(C)(C)C)cc2)CC1	ZINC000775677555	1304013314	/nfs/dbraw/zinc/01/33/14/1304013314.db2.gz	NYWHXZHBFAGDAX-UHFFFAOYSA-N	0	3	328.504	3.200	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CNC[C@H]1CSCCS1	ZINC000778176473	1304411487	/nfs/dbraw/zinc/41/14/87/1304411487.db2.gz	KHPFHZJBNOLNKQ-LBPRGKRZSA-N	0	3	327.902	3.290	20	30		EGEDHN
CSc1cc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)ccn1	ZINC000779196998	1304541439	/nfs/dbraw/zinc/54/14/39/1304541439.db2.gz	KLMUCMBPAHFINI-LLVKDONJSA-N	0	3	345.811	3.418	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N1CC[C@@H](N2CC(=O)Nc3ccccc32)C1	ZINC000782194133	1304928349	/nfs/dbraw/zinc/92/83/49/1304928349.db2.gz	LLWXAPXULUCVGZ-CRAIPNDOSA-N	0	3	346.434	3.152	20	30		EGEDHN
C=CCC1(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)CCC1	ZINC000891247174	1304999654	/nfs/dbraw/zinc/99/96/54/1304999654.db2.gz	GOVBCVBFGQSTHJ-GOSISDBHSA-N	0	3	329.488	3.218	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)CCCc2ccsc2)cc1	ZINC000783355860	1305083089	/nfs/dbraw/zinc/08/30/89/1305083089.db2.gz	OJDMIFPPYRPBCZ-MRXNPFEDSA-N	0	3	342.420	3.427	20	30		EGEDHN
Cc1cccc(CNC(=O)C(C#N)C(=O)CCCc2cccs2)c1	ZINC000786551481	1305596501	/nfs/dbraw/zinc/59/65/01/1305596501.db2.gz	YNHNCNSXUFTWIO-KRWDZBQOSA-N	0	3	340.448	3.405	20	30		EGEDHN
C[C@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccc(N2CCNC2=O)cc1	ZINC000787028778	1305678854	/nfs/dbraw/zinc/67/88/54/1305678854.db2.gz	WHZCINIOIMIQCL-XOBRGWDASA-N	0	3	346.434	3.426	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)[C@@H]1CCCCS1)c1ccccc1	ZINC000787046198	1305682977	/nfs/dbraw/zinc/68/29/77/1305682977.db2.gz	PPYZWBLBDYEAEY-JYJNAYRXSA-N	0	3	330.453	3.248	20	30		EGEDHN
Cc1cccc(CC(=O)C(C#N)C(=O)NC2CCCCC2)c1Cl	ZINC000788081199	1305861033	/nfs/dbraw/zinc/86/10/33/1305861033.db2.gz	KSRWXAOJGFNWOZ-OAHLLOKOSA-N	0	3	332.831	3.349	20	30		EGEDHN
C=C(C)CNCc1ccc(N2CCN(C(=O)OC(C)(C)C)CC2)o1	ZINC000893894527	1306118158	/nfs/dbraw/zinc/11/81/58/1306118158.db2.gz	IKHNTCJEKKGSTB-UHFFFAOYSA-N	0	3	335.448	3.002	20	30		EGEDHN
C#C[C@H](CCC)NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C	ZINC000791068734	1308920575	/nfs/dbraw/zinc/92/05/75/1308920575.db2.gz	BPVTVVPGQRGITH-IEBWSBKVSA-N	0	3	327.472	3.094	20	30		EGEDHN
COC1(CC(=O)C(C#N)C(=O)Nc2ccc(F)c(Cl)c2)CCC1	ZINC000791770253	1309059338	/nfs/dbraw/zinc/05/93/38/1309059338.db2.gz	AXEJYAZGMUOWLW-LLVKDONJSA-N	0	3	338.766	3.086	20	30		EGEDHN
O=C1[C@H]([NH2+][C@@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)CCCN1[O-]	ZINC000895162442	1309217778	/nfs/dbraw/zinc/21/77/78/1309217778.db2.gz	ZOADIKPNDFJNDT-NWANDNLSSA-N	0	3	342.361	3.311	20	30		EGEDHN
N#Cc1c(=O)n(CN(CC2CC2)CC2CCC2)cc2c1CCCC2	ZINC000793514859	1309390162	/nfs/dbraw/zinc/39/01/62/1309390162.db2.gz	HMAJHEOGGOXKET-UHFFFAOYSA-N	0	3	325.456	3.068	20	30		EGEDHN
C=CCC1(O)CCN(Cc2cn(C)nc2-c2ccc(F)cc2)CC1	ZINC000895835012	1309545314	/nfs/dbraw/zinc/54/53/14/1309545314.db2.gz	WFBYNWPSXVHAIV-UHFFFAOYSA-N	0	3	329.419	3.129	20	30		EGEDHN
COc1ccc(C2=NO[C@@H](CN[C@@H](C)CC(C)(C)C#N)C2)cc1F	ZINC000895977422	1309623487	/nfs/dbraw/zinc/62/34/87/1309623487.db2.gz	NVYCRSCNOFARNY-GXTWGEPZSA-N	0	3	333.407	3.245	20	30		EGEDHN
N#CC[C@H](CC(=O)C(C#N)C(=O)NC1CCCCC1)c1ccccc1	ZINC000796632347	1310051218	/nfs/dbraw/zinc/05/12/18/1310051218.db2.gz	KIBWQXGSGBMDPH-SJLPKXTDSA-N	0	3	337.423	3.232	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)CCCC1CCOCC1	ZINC000798814087	1310445794	/nfs/dbraw/zinc/44/57/94/1310445794.db2.gz	PVPUAIIPCXQIAI-OAHLLOKOSA-N	0	3	325.412	3.346	20	30		EGEDHN
C#CCN1CCC[C@@H](CNC(=O)c2ccc(Cl)cc2Cl)C1	ZINC001023717739	1319852524	/nfs/dbraw/zinc/85/25/24/1319852524.db2.gz	JTGWRVJDMUTHLI-LBPRGKRZSA-N	0	3	325.239	3.068	20	30		EGEDHN
C#CCN1CCC[C@H](CNC(=O)c2cc(Cl)cc(Cl)c2)C1	ZINC001023721025	1319857565	/nfs/dbraw/zinc/85/75/65/1319857565.db2.gz	ZOPWQHCKOXITOC-GFCCVEGCSA-N	0	3	325.239	3.068	20	30		EGEDHN
C=CCNc1nc(C(=O)OCCN(C)Cc2ccccc2)cs1	ZINC000837372802	1320606402	/nfs/dbraw/zinc/60/64/02/1320606402.db2.gz	JZDDFIOTJUFNNV-UHFFFAOYSA-N	0	3	331.441	3.030	20	30		EGEDHN
C[C@@H](C#N)OCCN1CCN(C2c3ccccc3-c3ccccc32)CC1	ZINC000801933531	1316968567	/nfs/dbraw/zinc/96/85/67/1316968567.db2.gz	CJNJIRYRPPUQKS-KRWDZBQOSA-N	0	3	347.462	3.303	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)[C@@H](F)c3ccccc3)C2)s1	ZINC001019440665	1317247111	/nfs/dbraw/zinc/24/71/11/1317247111.db2.gz	OCDLRMKSAOYROV-YOEHRIQHSA-N	0	3	343.427	3.021	20	30		EGEDHN
Cc1ccc(C)c(C(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)c1	ZINC001019701762	1317351064	/nfs/dbraw/zinc/35/10/64/1317351064.db2.gz	KIVBIIBVIBHGNM-HNNXBMFYSA-N	0	3	339.464	3.241	20	30		EGEDHN
C=C[C@H](C(=O)N1CC[C@H](NCc2ncccc2C)C1)c1ccccc1	ZINC001019805141	1317433298	/nfs/dbraw/zinc/43/32/98/1317433298.db2.gz	UQAJIDULIDTOPH-OALUTQOASA-N	0	3	335.451	3.050	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@H](NC(=O)CC3CCCC3)C2)c(F)c1	ZINC001019954412	1317474574	/nfs/dbraw/zinc/47/45/74/1317474574.db2.gz	RNHBRYXQOJHNOW-QAQDUYKDSA-N	0	3	329.419	3.014	20	30		EGEDHN
C=C(C)CNC(=S)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000806599616	1317510687	/nfs/dbraw/zinc/51/06/87/1317510687.db2.gz	VCGFMECSLHRDAQ-QGZVFWFLSA-N	0	3	335.517	3.117	20	30		EGEDHN
C#Cc1cccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)c1	ZINC000807621257	1317574758	/nfs/dbraw/zinc/57/47/58/1317574758.db2.gz	XMENUWCKZYZEMC-UZLBHIALSA-N	0	3	333.435	3.452	20	30		EGEDHN
C#C[C@@H](NC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F)C(C)(C)C	ZINC000807879128	1317597712	/nfs/dbraw/zinc/59/77/12/1317597712.db2.gz	OJYVZSPEURQQFA-DLBZAZTESA-N	0	3	348.437	3.308	20	30		EGEDHN
CN(C)CCN1c2ccccc2C(=NNc2cccc(Cl)c2)C1=O	ZINC000807943651	1317602824	/nfs/dbraw/zinc/60/28/24/1317602824.db2.gz	YLRVYGQOXFAAHT-UHFFFAOYSA-N	0	3	342.830	3.064	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1C[C@H](NCc2ccc(F)cc2F)C1	ZINC001020240119	1317605438	/nfs/dbraw/zinc/60/54/38/1317605438.db2.gz	WRVAECZPBGJDGM-WKILWMFISA-N	0	3	345.393	3.003	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC(CN(CC)Cc2ccnn2C)CC1	ZINC000957749272	1317614701	/nfs/dbraw/zinc/61/47/01/1317614701.db2.gz	BJBBLRXMUNUZQN-FQEVSTJZSA-N	0	3	346.519	3.083	20	30		EGEDHN
CC[C@@H](N[C@H](C)C(=O)NCCc1ccccc1)c1cccc(C#N)c1	ZINC000903016646	1317640711	/nfs/dbraw/zinc/64/07/11/1317640711.db2.gz	LIIDSMDIXAZWRD-OXQOHEQNSA-N	0	3	335.451	3.346	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)c2ccc(CC)s2)C1	ZINC001020362721	1317661992	/nfs/dbraw/zinc/66/19/92/1317661992.db2.gz	JJMUXYYCVHWXQS-XYPYZODXSA-N	0	3	343.290	3.070	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2C[C@H](N[C@H](C)c3ccccc3F)C2)cc1	ZINC001020456180	1317705110	/nfs/dbraw/zinc/70/51/10/1317705110.db2.gz	DOTYIUMELXZBPD-ZTFGCOKTSA-N	0	3	336.410	3.419	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@H](NCc3cc(Cl)ccc3OC)C2)C1	ZINC001020563618	1317775220	/nfs/dbraw/zinc/77/52/20/1317775220.db2.gz	OTYHCKQZKBOXLV-WKILWMFISA-N	0	3	348.874	3.442	20	30		EGEDHN
CCCOc1ccc(/C=C2\C(=O)c3ncnn3C2C)cc1OCC	ZINC000905080929	1317921012	/nfs/dbraw/zinc/92/10/12/1317921012.db2.gz	OKNUWRBUGFMBFP-CJAAZZPWSA-N	0	3	327.384	3.307	20	30		EGEDHN
CC1/C(=C\c2ccc(OCC(F)(F)F)c(F)c2)C(=O)c2ncnn21	ZINC000905087838	1317921920	/nfs/dbraw/zinc/92/19/20/1317921920.db2.gz	ZSZGGFSRTMMCET-OPWUTIMJSA-N	0	3	341.264	3.199	20	30		EGEDHN
CC1/C(=C\c2ccc(C(=O)OC(C)(C)C)cc2)C(=O)c2ncnn21	ZINC000905087250	1317922101	/nfs/dbraw/zinc/92/21/01/1317922101.db2.gz	WSZVNHQFXFXXBE-ZECSTPGPSA-N	0	3	325.368	3.074	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@@H](NCc1ccc(N3CCCC3=O)cc1)CC2	ZINC000810207340	1317976239	/nfs/dbraw/zinc/97/62/39/1317976239.db2.gz	JTNUZRADDIBDRU-FQEVSTJZSA-N	0	3	331.419	3.462	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)C2(c3ccc(Cl)cc3)CC2)C1	ZINC001021016543	1318046832	/nfs/dbraw/zinc/04/68/32/1318046832.db2.gz	BHFQNWPZKXOUTM-SHTZXODSSA-N	0	3	339.266	3.361	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)CC2C3CC4CC(C3)CC2C4)C1	ZINC001021081651	1318071392	/nfs/dbraw/zinc/07/13/92/1318071392.db2.gz	FMIXYAIGVXXQMR-IYBCDGABSA-N	0	3	336.907	3.438	20	30		EGEDHN
C=CCc1cc(CN2CC[C@H](n3cc(Cl)cn3)C2)c(O)c(OC)c1	ZINC000811801285	1318268330	/nfs/dbraw/zinc/26/83/30/1318268330.db2.gz	IAVKDFQKIAZOER-INIZCTEOSA-N	0	3	347.846	3.426	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCCC[C@H]1CNCc1ccc(F)cc1Cl	ZINC000959924289	1318268678	/nfs/dbraw/zinc/26/86/78/1318268678.db2.gz	IKLISWBNUJJXLA-WFASDCNBSA-N	0	3	337.826	3.109	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@H](CCCN3C(=O)C3CCC3)C2)c1	ZINC001021493729	1318295679	/nfs/dbraw/zinc/29/56/79/1318295679.db2.gz	VPQDQFZGLLNOEV-WOJBJXKFSA-N	0	3	337.467	3.171	20	30		EGEDHN
CC(C)(F)C(=O)N1CCC[C@H]2CN(Cc3cccc(C#N)c3)CC[C@H]21	ZINC001021494395	1318296624	/nfs/dbraw/zinc/29/66/24/1318296624.db2.gz	AXHMFTFZQBMHAQ-ZWKOTPCHSA-N	0	3	343.446	3.119	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1scnc1CC	ZINC000960271577	1318437934	/nfs/dbraw/zinc/43/79/34/1318437934.db2.gz	PTRMYLVBESJLNS-IAGOWNOFSA-N	0	3	341.480	3.267	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc(C)c(F)cc1F	ZINC000960276803	1318439438	/nfs/dbraw/zinc/43/94/38/1318439438.db2.gz	TULWTUBMEIDXRC-RTBURBONSA-N	0	3	342.389	3.445	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccncc1CC	ZINC000960276076	1318439484	/nfs/dbraw/zinc/43/94/84/1318439484.db2.gz	RRHKBNAZTWCXSU-WOJBJXKFSA-N	0	3	335.451	3.206	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)C(C)(C)c1cc(C)ccn1	ZINC000960279786	1318442213	/nfs/dbraw/zinc/44/22/13/1318442213.db2.gz	ZUMCIPNQMDYCSS-UYAOXDASSA-N	0	3	349.478	3.225	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc2ccsc2[nH]1	ZINC000960294670	1318448319	/nfs/dbraw/zinc/44/83/19/1318448319.db2.gz	ANECMIWDWJGJHN-NVXWUHKLSA-N	0	3	337.448	3.401	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)Cc2c(C)cccc2C)C1	ZINC001021604428	1318449569	/nfs/dbraw/zinc/44/95/69/1318449569.db2.gz	VXOLBPJMEWKJRO-FPOVZHCZSA-N	0	3	338.495	3.182	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc(C(C)C)cn1	ZINC000960303271	1318452046	/nfs/dbraw/zinc/45/20/46/1318452046.db2.gz	GDEWGBHQWMYECB-WOJBJXKFSA-N	0	3	335.451	3.376	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cscc2Cl)C1	ZINC001021612121	1318459969	/nfs/dbraw/zinc/45/99/69/1318459969.db2.gz	XAEKQMTXVAVMNI-CJNGLKHVSA-N	0	3	336.888	3.351	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)Cc1ccc(Cl)cc1	ZINC000960328886	1318463576	/nfs/dbraw/zinc/46/35/76/1318463576.db2.gz	DCYGTPNSMPKDJM-UYAOXDASSA-N	0	3	340.854	3.440	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)Cc2cccc(C(C)C)c2)C1	ZINC001021623707	1318473347	/nfs/dbraw/zinc/47/33/47/1318473347.db2.gz	KXSAMDSORUBSND-RTWAWAEBSA-N	0	3	338.495	3.299	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(Cl)ccc2F)C1	ZINC001021627957	1318480263	/nfs/dbraw/zinc/48/02/63/1318480263.db2.gz	RAEFTNKZIHBARH-SUMWQHHRSA-N	0	3	334.822	3.039	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2ccc(C(F)F)cc2)C1	ZINC001021628284	1318480765	/nfs/dbraw/zinc/48/07/65/1318480765.db2.gz	AGCZXEMFUYIQPB-ZWKOTPCHSA-N	0	3	346.421	3.113	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)Cc2ccc(C(F)F)cc2)C1	ZINC001021628280	1318480997	/nfs/dbraw/zinc/48/09/97/1318480997.db2.gz	AGCZXEMFUYIQPB-QZTJIDSGSA-N	0	3	346.421	3.113	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)Cc2cccc(C)c2Cl)C1	ZINC001021633283	1318487603	/nfs/dbraw/zinc/48/76/03/1318487603.db2.gz	PVNGMTFDNUBAEL-ROUUACIJSA-N	0	3	344.886	3.137	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)CCc2cccc(C)c2)C1	ZINC001021641671	1318500966	/nfs/dbraw/zinc/50/09/66/1318500966.db2.gz	KBTNBODHJNCUKD-RTWAWAEBSA-N	0	3	338.495	3.264	20	30		EGEDHN
N#Cc1ccccc1OCC(=O)C(C#N)c1cc(C(F)(F)F)ccn1	ZINC000813217010	1318516246	/nfs/dbraw/zinc/51/62/46/1318516246.db2.gz	APBLFNTVWBDCGV-CYBMUJFWSA-N	0	3	345.280	3.227	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)Cc2cccc(Cl)c2)C1	ZINC001021664836	1318528052	/nfs/dbraw/zinc/52/80/52/1318528052.db2.gz	IVLDDBOLFIDSMK-IEBWSBKVSA-N	0	3	344.886	3.219	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cccc3cc[nH]c32)C1	ZINC001021672350	1318536265	/nfs/dbraw/zinc/53/62/65/1318536265.db2.gz	BBBUKPKQTDCMBL-HKUYNNGSSA-N	0	3	335.451	3.118	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc3ccncc3c2)C1	ZINC001021711495	1318588733	/nfs/dbraw/zinc/58/87/33/1318588733.db2.gz	XCPHJIJOERFNLF-CTNGQTDRSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cccc(C(F)F)c2)C1	ZINC001021716681	1318597745	/nfs/dbraw/zinc/59/77/45/1318597745.db2.gz	FOYNNIUWYZRAAF-SJORKVTESA-N	0	3	332.394	3.184	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cccc3ccccc32)C1	ZINC001021726911	1318620904	/nfs/dbraw/zinc/62/09/04/1318620904.db2.gz	HPBJXABFCXIONW-WIYYLYMNSA-N	0	3	332.447	3.400	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc3ccccc3o2)C1	ZINC001021726661	1318621964	/nfs/dbraw/zinc/62/19/64/1318621964.db2.gz	FFBZKPBVBAPFKO-MSOLQXFVSA-N	0	3	336.435	3.383	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc3c(s2)CCCC3)C1	ZINC001021729496	1318630551	/nfs/dbraw/zinc/63/05/51/1318630551.db2.gz	ZYPBTPDRUYTRHZ-DLBZAZTESA-N	0	3	342.508	3.187	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)CCc2ccccc2F)C1	ZINC001021732727	1318636888	/nfs/dbraw/zinc/63/68/88/1318636888.db2.gz	HCQWMDXGIQUQEQ-QUCCMNQESA-N	0	3	342.458	3.095	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc3cccc(C)c3o2)C1	ZINC001021740880	1318650924	/nfs/dbraw/zinc/65/09/24/1318650924.db2.gz	WZVFFPYPEFXGSN-QZTJIDSGSA-N	0	3	336.435	3.301	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)[C@@H]1CC1(C)C	ZINC000960564963	1318695691	/nfs/dbraw/zinc/69/56/91/1318695691.db2.gz	RRFUUELTNRXPDE-MSOLQXFVSA-N	0	3	325.456	3.027	20	30		EGEDHN
CC(C(=O)N1CCC[C@@H]1CN(C)Cc1cccc(C#N)c1)=C1CCC1	ZINC000960613990	1318741144	/nfs/dbraw/zinc/74/11/44/1318741144.db2.gz	PDSRPCIECNHMGN-HXUWFJFHSA-N	0	3	337.467	3.481	20	30		EGEDHN
CN(Cc1cc2ccccc2o1)C[C@@H]1CCCN1C(=O)C#CC1CC1	ZINC000960626680	1318751781	/nfs/dbraw/zinc/75/17/81/1318751781.db2.gz	KNCQXSBWWPDDLO-SFHVURJKSA-N	0	3	336.435	3.269	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1nnc(SCc2ccccc2)s1	ZINC000911971877	1318788630	/nfs/dbraw/zinc/78/86/30/1318788630.db2.gz	QUIVGCHDKSQJOV-CYBMUJFWSA-N	0	3	348.497	3.453	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)NCc1cccc(NC(C)=O)c1	ZINC000912250693	1318855000	/nfs/dbraw/zinc/85/50/00/1318855000.db2.gz	URPVDJZSLFBKOT-GOSISDBHSA-N	0	3	333.476	3.339	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)C1(C)CCC1	ZINC000960794217	1318903147	/nfs/dbraw/zinc/90/31/47/1318903147.db2.gz	YGLDWQXEAXLRGN-SFHVURJKSA-N	0	3	325.456	3.171	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)C(C)(C)C1CC1	ZINC000960809149	1318922883	/nfs/dbraw/zinc/92/28/83/1318922883.db2.gz	MGDDQJRUBARPEH-IBGZPJMESA-N	0	3	339.483	3.417	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N1CCC[C@H]1CN(C)Cc1cccc(C#N)c1	ZINC000960852129	1318994139	/nfs/dbraw/zinc/99/41/39/1318994139.db2.gz	MADIUVLLKGMQCF-HSALFYBXSA-N	0	3	339.483	3.417	20	30		EGEDHN
CO[C@@H]1CCC[C@H](C(=O)C(C#N)C(=O)Nc2ccccc2Cl)C1	ZINC000815907445	1319071470	/nfs/dbraw/zinc/07/14/70/1319071470.db2.gz	ATKOKONCOPEKHQ-XQQFMLRXSA-N	0	3	334.803	3.193	20	30		EGEDHN
CCC(=O)N1CCC[C@H]([C@@H]2CCN(Cc3ccc(C#N)c(F)c3)C2)C1	ZINC000961074576	1319185896	/nfs/dbraw/zinc/18/58/96/1319185896.db2.gz	IYMSYWPETFPYMI-ZWKOTPCHSA-N	0	3	343.446	3.168	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@H]([C@H]2CCN(Cc3ccccc3C#N)C2)C1	ZINC000961132639	1319246881	/nfs/dbraw/zinc/24/68/81/1319246881.db2.gz	FEUJHMQVDRWYGQ-PMACEKPBSA-N	0	3	339.483	3.275	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@H]2C[C@H]2c2cc(F)ccc2F)C1	ZINC001023105908	1319263204	/nfs/dbraw/zinc/26/32/04/1319263204.db2.gz	NRGNPJKVOCTPSC-XFMPKHEZSA-N	0	3	340.801	3.058	20	30		EGEDHN
CCC(C#N)(CC)C(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC000858653280	1328818516	/nfs/dbraw/zinc/81/85/16/1328818516.db2.gz	RYTXSIIWKVZUFG-UHFFFAOYSA-N	0	3	343.471	3.106	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)[C@@H]2CCCCC2(C)C)C1	ZINC001023144569	1319286790	/nfs/dbraw/zinc/28/67/90/1319286790.db2.gz	AFERQHVVSUBHJP-MJBXVCDLSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]([C@H]2CCN(Cc3cncs3)C2)C1	ZINC000961229156	1319357378	/nfs/dbraw/zinc/35/73/78/1319357378.db2.gz	LQJZRGXJJVXPQT-CVEARBPZSA-N	0	3	347.528	3.416	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)[C@@H]2[C@@H](c3ccccc3)C2(C)C)C1	ZINC001023369687	1319482403	/nfs/dbraw/zinc/48/24/03/1319482403.db2.gz	GQDFVPALMSHNEW-SXLOBPIMSA-N	0	3	338.495	3.278	20	30		EGEDHN
[NH3+]CC[C@@H]([N-]C(=O)[C@H](F)c1ccc(C(F)(F)F)cc1)C(F)(F)F	ZINC000817995032	1319487215	/nfs/dbraw/zinc/48/72/15/1319487215.db2.gz	SPSCIYAHFTWHPX-NXEZZACHSA-N	0	3	346.246	3.112	20	30		EGEDHN
N#C[C@H]1CC[C@@H](NCc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)C1	ZINC000818230169	1319524303	/nfs/dbraw/zinc/52/43/03/1319524303.db2.gz	NRRUQMUUPFEVEQ-GOEBONIOSA-N	0	3	328.416	3.367	20	30		EGEDHN
C#CCN(C)CCCNC(=O)C[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000818595607	1319565405	/nfs/dbraw/zinc/56/54/05/1319565405.db2.gz	DHKVCXUKVRVMTJ-AWEZNQCLSA-N	0	3	340.389	3.270	20	30		EGEDHN
C#CCN(C)CCCNC(=O)/C=C(/C)c1ccc(C(F)(F)F)cc1	ZINC000818608949	1319567844	/nfs/dbraw/zinc/56/78/44/1319567844.db2.gz	AGDAEWOAHIDYDL-YPKPFQOOSA-N	0	3	338.373	3.180	20	30		EGEDHN
N#Cc1ccccc1CNCC1CC(NC(=O)CC2CCCC2)C1	ZINC000961504743	1319623542	/nfs/dbraw/zinc/62/35/42/1319623542.db2.gz	FREZQLOTVIBQOC-UHFFFAOYSA-N	0	3	325.456	3.123	20	30		EGEDHN
N#Cc1ccccc1CNCC1CC(NC(=O)CC2=CCCCC2)C1	ZINC000961635215	1319677324	/nfs/dbraw/zinc/67/73/24/1319677324.db2.gz	QQNJXUODLBVEFV-UHFFFAOYSA-N	0	3	337.467	3.433	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@H](CNC(=O)C3CC4(CC4)C3)C2)c1	ZINC001023579506	1319699007	/nfs/dbraw/zinc/69/90/07/1319699007.db2.gz	HVYKXAXVNWCFCO-GOSISDBHSA-N	0	3	337.467	3.077	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1)C(=O)c1ccc(C(F)(F)F)cn1	ZINC000916898852	1319721565	/nfs/dbraw/zinc/72/15/65/1319721565.db2.gz	IWIACQMWUZAFJD-GFCCVEGCSA-N	0	3	333.269	3.062	20	30		EGEDHN
Cc1cc2ccccc2n1CC(=O)C(C#N)C(=O)NC1CCCCC1	ZINC000916895468	1319721767	/nfs/dbraw/zinc/72/17/67/1319721767.db2.gz	LJHNOHGNKRCQHL-QGZVFWFLSA-N	0	3	337.423	3.108	20	30		EGEDHN
CC(C)c1cc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)n[nH]1	ZINC000916909444	1319723572	/nfs/dbraw/zinc/72/35/72/1319723572.db2.gz	BNNLSWCKINEJDM-SNVBAGLBSA-N	0	3	330.775	3.148	20	30		EGEDHN
N#CC(C(=O)Cc1ccccc1F)C(=O)Nc1ccccc1Cl	ZINC000916905925	1319723646	/nfs/dbraw/zinc/72/36/46/1319723646.db2.gz	OLEUFZMZHWBSIE-GFCCVEGCSA-N	0	3	330.746	3.369	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)c1cc2ccccc2o1	ZINC000916929079	1319726258	/nfs/dbraw/zinc/72/62/58/1319726258.db2.gz	AZSRCLFOJJWUPB-ZDUSSCGKSA-N	0	3	334.331	3.403	20	30		EGEDHN
N#Cc1ccccc1CNCC1CC(NC(=O)c2sccc2F)C1	ZINC000961793770	1319734193	/nfs/dbraw/zinc/73/41/93/1319734193.db2.gz	BEXSPVARZVEWIT-UHFFFAOYSA-N	0	3	343.427	3.057	20	30		EGEDHN
CC(C)(C)CCN1CCN(C(=O)/C=C/c2ccccc2C#N)CC1	ZINC000917880782	1319885052	/nfs/dbraw/zinc/88/50/52/1319885052.db2.gz	NXCFLMTYCWBQDO-CMDGGOBGSA-N	0	3	325.456	3.152	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2sc(C(C)C)nc2C)C1	ZINC001023745678	1319892059	/nfs/dbraw/zinc/89/20/59/1319892059.db2.gz	BLLKMKKNMRXGJG-OAHLLOKOSA-N	0	3	333.501	3.040	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2c[nH]cc2-c2ccccc2)C1	ZINC001023750307	1319894443	/nfs/dbraw/zinc/89/44/43/1319894443.db2.gz	KAGLOQMVTSUTNC-KRWDZBQOSA-N	0	3	335.451	3.147	20	30		EGEDHN
C=CCN1CCC[C@H](CNC(=O)c2ccc(C(F)(F)F)s2)C1	ZINC001023772797	1319923154	/nfs/dbraw/zinc/92/31/54/1319923154.db2.gz	BWUSCCIPRSGDLF-LLVKDONJSA-N	0	3	332.391	3.395	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCN(C(=O)c2cccs2)C1	ZINC001023821044	1319966518	/nfs/dbraw/zinc/96/65/18/1319966518.db2.gz	SDUDVMQFVKGELA-OAHLLOKOSA-N	0	3	339.464	3.262	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001023853975	1319990218	/nfs/dbraw/zinc/99/02/18/1319990218.db2.gz	AMTBAPQXTKPJNB-HUUCEWRRSA-N	0	3	331.435	3.072	20	30		EGEDHN
CN(C)C[C@@H]1CCc2ccccc2N1C(=O)/C=C\c1ccccc1C#N	ZINC000821630883	1320023731	/nfs/dbraw/zinc/02/37/31/1320023731.db2.gz	OQEIZYHYXCCXOH-WXFJXSOESA-N	0	3	345.446	3.481	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cc(C#N)ccc2F)C1	ZINC000823268944	1320166648	/nfs/dbraw/zinc/16/66/48/1320166648.db2.gz	SXNYMBHKNVHKTC-WMLDXEAASA-N	0	3	337.398	3.263	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C1(CNC(=O)OC(C)(C)C)CCC1	ZINC000824932170	1320298256	/nfs/dbraw/zinc/29/82/56/1320298256.db2.gz	JSLVZSDKUVBTLT-UHFFFAOYSA-N	0	3	329.444	3.437	20	30		EGEDHN
C#CCOc1ccc(CN2CCC(OCCOC(C)C)CC2)cc1	ZINC000825208192	1320318984	/nfs/dbraw/zinc/31/89/84/1320318984.db2.gz	SRHWFTCZIIAVET-UHFFFAOYSA-N	0	3	331.456	3.105	20	30		EGEDHN
C#Cc1cccc(CNC(=O)NC[C@H](N[C@@H](C)CC)c2ccco2)c1	ZINC000838587913	1320793239	/nfs/dbraw/zinc/79/32/39/1320793239.db2.gz	RXAVAFBDMMGLBS-YJBOKZPZSA-N	0	3	339.439	3.190	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1ccc2oc(C(C)C)nc2c1	ZINC000838624227	1320795894	/nfs/dbraw/zinc/79/58/94/1320795894.db2.gz	NGHBGNBTUGAKIR-UHFFFAOYSA-N	0	3	328.416	3.028	20	30		EGEDHN
C[C@@H]1CN(C(=S)Nc2ccc(C#N)c(Cl)c2)CCN(C2CC2)C1	ZINC000840762813	1321143633	/nfs/dbraw/zinc/14/36/33/1321143633.db2.gz	DFNGOLKDOYLSIY-LBPRGKRZSA-N	0	3	348.903	3.325	20	30		EGEDHN
COCCN(CCCCC1(C#N)CCC1)Cc1c(C)nn(C)c1C	ZINC000930682845	1328936433	/nfs/dbraw/zinc/93/64/33/1328936433.db2.gz	BULJITAQYFGILU-UHFFFAOYSA-N	0	3	332.492	3.350	20	30		EGEDHN
CCCCCCC[C@H](C)CNC(=O)C(=O)Nc1ccc2c(c1)CNC2	ZINC000841019102	1321201299	/nfs/dbraw/zinc/20/12/99/1321201299.db2.gz	CSUMPJLVHTXTMV-HNNXBMFYSA-N	0	3	345.487	3.341	20	30		EGEDHN
CC1(C)OCC[C@H]1NN=C1CCN(C2CC2)[C@H](c2ccccc2)C1	ZINC000841641852	1321290866	/nfs/dbraw/zinc/29/08/66/1321290866.db2.gz	XGFICTMHDMGVMN-RBUKOAKNSA-N	0	3	327.472	3.499	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)[C@@H](CC(C)C)OC)c1ccccc1	ZINC000842341806	1321374579	/nfs/dbraw/zinc/37/45/79/1321374579.db2.gz	ABLLVQAFCMNAQG-IXDOHACOSA-N	0	3	330.428	3.024	20	30		EGEDHN
Cc1ccc([C@H](C)NCC#CCN2C(=O)c3ccccc3C2=O)s1	ZINC000859249143	1328954987	/nfs/dbraw/zinc/95/49/87/1328954987.db2.gz	SYTGMBXHBXLOSQ-AWEZNQCLSA-N	0	3	338.432	3.007	20	30		EGEDHN
N#CC(C(=O)[C@H]1CCc2ncncc2C1)c1ccc2ccccc2n1	ZINC000842677419	1321417318	/nfs/dbraw/zinc/41/73/18/1321417318.db2.gz	OYONUVXYFYAZEA-HOCLYGCPSA-N	0	3	328.375	3.006	20	30		EGEDHN
C[C@@H](NC(=O)C1CCCCC1)C(=O)C(C#N)c1nc(C2CC2)cs1	ZINC000842941039	1321451775	/nfs/dbraw/zinc/45/17/75/1321451775.db2.gz	GXUIAIXLTDUQNN-RISCZKNCSA-N	0	3	345.468	3.282	20	30		EGEDHN
CC(C)(C)N1CC[C@@H]1COC(=O)c1cc2ccccc2n1CC#N	ZINC000845742585	1321740028	/nfs/dbraw/zinc/74/00/28/1321740028.db2.gz	YVHHEZBLQYPSQO-OAHLLOKOSA-N	0	3	325.412	3.194	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN2CCN(C)C[C@@H]2Cc2ccccc2)cc1	ZINC000846066806	1321766212	/nfs/dbraw/zinc/76/62/12/1321766212.db2.gz	GWBQVNWZORBMKU-NQIIRXRSSA-N	0	3	349.478	3.336	20	30		EGEDHN
C#CCOc1ccc([C@@H](C)N[C@H]2CCc3ccccc3NC2=O)cc1	ZINC000848557310	1321976383	/nfs/dbraw/zinc/97/63/83/1321976383.db2.gz	DTUOCNRQWRKXEY-QRWLVFNGSA-N	0	3	334.419	3.303	20	30		EGEDHN
COc1cccc([C@@H](OC)C(=O)C(C#N)c2nc3ccccc3n2C)c1	ZINC000850738360	1322281422	/nfs/dbraw/zinc/28/14/22/1322281422.db2.gz	KFGDKZAYDLQICU-DNVCBOLYSA-N	0	3	349.390	3.146	20	30		EGEDHN
COc1cccc([C@@H](OC)C(=O)C(C#N)c2nc3ccccc3n2C)c1	ZINC000850738362	1322281483	/nfs/dbraw/zinc/28/14/83/1322281483.db2.gz	KFGDKZAYDLQICU-HNAYVOBHSA-N	0	3	349.390	3.146	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@@H]1C[C@H]1c1ccc(OC)cc1	ZINC000850753212	1322285049	/nfs/dbraw/zinc/28/50/49/1322285049.db2.gz	ZXKWWMLZAGPOAZ-KSZLIROESA-N	0	3	342.439	3.204	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)[C@@H]1C[C@H]1OC(C)(C)C)c1ccccc1	ZINC000850977901	1322318810	/nfs/dbraw/zinc/31/88/10/1322318810.db2.gz	GPNOOQVYHRGJDW-LTIDMASMSA-N	0	3	342.439	3.166	20	30		EGEDHN
CC(=O)N[C@@H](c1ccccc1F)[C@H](C)NCc1ccc(C#N)cc1	ZINC000924701868	1323119902	/nfs/dbraw/zinc/11/99/02/1323119902.db2.gz	SOMCMWRWULLJTF-ORAYPTAESA-N	0	3	325.387	3.053	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H](CNCc2csc(C)n2)C1	ZINC001024138050	1323162867	/nfs/dbraw/zinc/16/28/67/1323162867.db2.gz	YTNGGBUJXRCGRU-QAPCUYQASA-N	0	3	335.517	3.382	20	30		EGEDHN
C=CCN(CCOc1ccc2c(C)cc(=O)oc2c1)[C@@H](C)COC	ZINC000852358631	1323182649	/nfs/dbraw/zinc/18/26/49/1323182649.db2.gz	WMZPDYWNPGLAAM-HNNXBMFYSA-N	0	3	331.412	3.003	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCN(C(=O)[C@H]2CC23CCC3)C1	ZINC001024182818	1323195350	/nfs/dbraw/zinc/19/53/50/1323195350.db2.gz	YDVIEZRYXHKYNE-VQIMIIECSA-N	0	3	337.467	3.077	20	30		EGEDHN
N#Cc1ccc(OCCCN2CCOC(C3CC3)(C3CC3)C2)cc1	ZINC000852652143	1323222141	/nfs/dbraw/zinc/22/21/41/1323222141.db2.gz	ZYIXJYAYTLGMBU-UHFFFAOYSA-N	0	3	326.440	3.218	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)c2cscn2)C1	ZINC000963262058	1323278466	/nfs/dbraw/zinc/27/84/66/1323278466.db2.gz	DGIQLOJFAVEBQG-HIFRSBDPSA-N	0	3	339.892	3.212	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@H]1CCCN1c1ccccc1	ZINC001024471717	1323426577	/nfs/dbraw/zinc/42/65/77/1323426577.db2.gz	KMJHJBNMIJLCHP-WOJBJXKFSA-N	0	3	341.499	3.202	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@H]1CCCCN1Cc1ccccc1	ZINC001024479936	1323433284	/nfs/dbraw/zinc/43/32/84/1323433284.db2.gz	UIWPZLJLHJTWEK-LJQANCHMSA-N	0	3	337.467	3.459	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@H]1CCN(C)c2ccccc21	ZINC001024484005	1323438164	/nfs/dbraw/zinc/43/81/64/1323438164.db2.gz	IFQWHEYFBTZSKJ-MJGOQNOKSA-N	0	3	341.499	3.157	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@H]1CCc2cc(C)ccc2O1	ZINC001024553536	1323494431	/nfs/dbraw/zinc/49/44/31/1323494431.db2.gz	CFVUQBJPISPLAP-UYAOXDASSA-N	0	3	342.483	3.235	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccc(C(F)F)c(F)c1	ZINC001024648151	1323572888	/nfs/dbraw/zinc/57/28/88/1323572888.db2.gz	YQSKYJNSGZMDON-CQSZACIVSA-N	0	3	338.373	3.371	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1cccc(F)c1F	ZINC001024809742	1323711615	/nfs/dbraw/zinc/71/16/15/1323711615.db2.gz	WOLDUWVCZXLYIE-HYVNUMGLSA-N	0	3	346.421	3.062	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@@H]1CNCc1c(C)noc1CC	ZINC001025041198	1323843529	/nfs/dbraw/zinc/84/35/29/1323843529.db2.gz	VTLYJGGWOATCPM-OAHLLOKOSA-N	0	3	333.476	3.228	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)c(F)c1	ZINC001025049139	1323854167	/nfs/dbraw/zinc/85/41/67/1323854167.db2.gz	SGZCQVZCVBSXKE-SJLPKXTDSA-N	0	3	349.425	3.162	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCCC[C@@H]1CNCc1cccc(OC)n1	ZINC001025069908	1323870871	/nfs/dbraw/zinc/87/08/71/1323870871.db2.gz	RQTXTVLQZPBEQC-XLIONFOSSA-N	0	3	345.487	3.163	20	30		EGEDHN
O=C(C#CC1CC1)N1CCCC[C@H]1[C@@H]1CCCN1CCC(F)(F)F	ZINC001025229612	1324015785	/nfs/dbraw/zinc/01/57/85/1324015785.db2.gz	NCDGULZKLYTBAF-HOTGVXAUSA-N	0	3	342.405	3.198	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc2occc2[nH]1	ZINC001025238625	1324029770	/nfs/dbraw/zinc/02/97/70/1324029770.db2.gz	UFMBTVLVTQNPIA-QZTJIDSGSA-N	0	3	339.439	3.243	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc2cc(C)cn2c1	ZINC001025238618	1324029921	/nfs/dbraw/zinc/02/99/21/1324029921.db2.gz	UAHZYWPFRQJNPR-RTWAWAEBSA-N	0	3	349.478	3.340	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(C)cc(C)n1	ZINC001025245705	1324045059	/nfs/dbraw/zinc/04/50/59/1324045059.db2.gz	PEGUVVOCJVVOEX-WOJBJXKFSA-N	0	3	339.483	3.181	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccn2ccccc12	ZINC001025249364	1324050595	/nfs/dbraw/zinc/05/05/95/1324050595.db2.gz	BHKZLXLVYXHUQN-SFTDATJTSA-N	0	3	349.478	3.422	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(C)c(C)cn1	ZINC001025252475	1324057722	/nfs/dbraw/zinc/05/77/22/1324057722.db2.gz	OUYQDNNKWDXIRN-UXHICEINSA-N	0	3	339.483	3.181	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccn(C(C)C)c1C	ZINC001025263657	1324074710	/nfs/dbraw/zinc/07/47/10/1324074710.db2.gz	PEDXUCYRBKCQDH-UXHICEINSA-N	0	3	341.499	3.470	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc[nH]c1CCC	ZINC001025264322	1324076221	/nfs/dbraw/zinc/07/62/21/1324076221.db2.gz	ZLCPFHJRTFUSLZ-PMACEKPBSA-N	0	3	341.499	3.450	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc2ncccc2c1	ZINC001025264529	1324076700	/nfs/dbraw/zinc/07/67/00/1324076700.db2.gz	AVVURENUNUNVRD-LEWJYISDSA-N	0	3	347.462	3.327	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ocnc1C1CC1	ZINC001025268901	1324081332	/nfs/dbraw/zinc/08/13/32/1324081332.db2.gz	HWWKDVTYQFAZRD-JKSUJKDBSA-N	0	3	329.444	3.197	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccn(C)c1CC	ZINC001025269097	1324082688	/nfs/dbraw/zinc/08/26/88/1324082688.db2.gz	KVNKBWPGNRBUKA-WOJBJXKFSA-N	0	3	341.499	3.070	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1conc1C1CC1	ZINC001025269955	1324085131	/nfs/dbraw/zinc/08/51/31/1324085131.db2.gz	YWUDVEKEAHKVES-DLBZAZTESA-N	0	3	329.444	3.197	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1csc(Cl)c1	ZINC001025273175	1324088732	/nfs/dbraw/zinc/08/87/32/1324088732.db2.gz	BGAHXIHZEWYLRL-LSDHHAIUSA-N	0	3	336.888	3.494	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1coc(C2CC2)n1	ZINC001025273927	1324090031	/nfs/dbraw/zinc/09/00/31/1324090031.db2.gz	IKDPQFAQVRWWKD-QZTJIDSGSA-N	0	3	341.455	3.034	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)CCC1CCOCC1	ZINC001025274859	1324093744	/nfs/dbraw/zinc/09/37/44/1324093744.db2.gz	PHLWHRUQPVMGRB-UXHICEINSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1coc(C2CC2)n1	ZINC001025278180	1324100154	/nfs/dbraw/zinc/10/01/54/1324100154.db2.gz	RNSWKZORSAMQAY-IAGOWNOFSA-N	0	3	329.444	3.197	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ncoc1C1CC1	ZINC001025284418	1324106306	/nfs/dbraw/zinc/10/63/06/1324106306.db2.gz	HAKABVLUVPSRAF-IAGOWNOFSA-N	0	3	341.455	3.034	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1c[nH]cc1C1CC1	ZINC001025284832	1324106401	/nfs/dbraw/zinc/10/64/01/1324106401.db2.gz	OHIYZPFYXJRMLL-PMACEKPBSA-N	0	3	339.483	3.375	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc2c(C)cccn2c1	ZINC001025289216	1324112841	/nfs/dbraw/zinc/11/28/41/1324112841.db2.gz	OKADLTKGTIDRMZ-VQTJNVASSA-N	0	3	349.478	3.340	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)Cc1cc(C)ccc1F	ZINC001025291482	1324115629	/nfs/dbraw/zinc/11/56/29/1324115629.db2.gz	AFXFLOUBFCFWKR-PMACEKPBSA-N	0	3	342.458	3.155	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)CCc1cccs1	ZINC001025293559	1324120406	/nfs/dbraw/zinc/12/04/06/1324120406.db2.gz	DOMASLRPNOLPOC-QZTJIDSGSA-N	0	3	330.497	3.159	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc(C)nc1C	ZINC001025302785	1324136537	/nfs/dbraw/zinc/13/65/37/1324136537.db2.gz	XTVJVKGJQXMHPL-WOJBJXKFSA-N	0	3	339.483	3.181	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(F)c3ccccc3c2)C1	ZINC001025437505	1324276158	/nfs/dbraw/zinc/27/61/58/1324276158.db2.gz	WSZMZVWUPVXKGK-RDJZCZTQSA-N	0	3	338.426	3.442	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(C)c(F)cc2F)C1	ZINC001025455908	1324296856	/nfs/dbraw/zinc/29/68/56/1324296856.db2.gz	MZXNZWGSXFEIOE-GJZGRUSLSA-N	0	3	334.410	3.127	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2scnc2C2CCCC2)C1	ZINC001025474098	1324318924	/nfs/dbraw/zinc/31/89/24/1324318924.db2.gz	IPXOKRKGLBNCIG-HOCLYGCPSA-N	0	3	345.512	3.264	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc3cc(C)ccc3n2)C1	ZINC001025478006	1324323993	/nfs/dbraw/zinc/32/39/93/1324323993.db2.gz	KZGXXLCIJCYVRK-MJGOQNOKSA-N	0	3	349.478	3.397	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc3cscc3s2)C1	ZINC001025484273	1324331355	/nfs/dbraw/zinc/33/13/55/1324331355.db2.gz	BNCUWMVWTJZRSZ-QWHCGFSZSA-N	0	3	332.494	3.426	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(C(C)C)nc2C)C1	ZINC001025530473	1324375774	/nfs/dbraw/zinc/37/57/74/1324375774.db2.gz	IRYIHZPKOLRSNC-FUHWJXTLSA-N	0	3	341.499	3.367	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(C(CC)CC)no2)C1	ZINC001025555574	1324404332	/nfs/dbraw/zinc/40/43/32/1324404332.db2.gz	OVOAJFTURDQOMP-WBVHZDCISA-N	0	3	345.487	3.432	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc3sccc3c2)C1	ZINC001025582181	1324423348	/nfs/dbraw/zinc/42/33/48/1324423348.db2.gz	PHQQOPAKXBJEFJ-WMLDXEAASA-N	0	3	326.465	3.365	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2[nH]c3ccc(C)cc3c2C)C1	ZINC001025583454	1324424466	/nfs/dbraw/zinc/42/44/66/1324424466.db2.gz	ZNAQQZJLPJXNEM-SJORKVTESA-N	0	3	337.467	3.248	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2[nH]ccc2-c2ccccc2)C1	ZINC001025591484	1324437633	/nfs/dbraw/zinc/43/76/33/1324437633.db2.gz	CIWZLYVHQPBOGH-AEFFLSMTSA-N	0	3	335.451	3.145	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(C)c(C)c2Cl)C1	ZINC001025592625	1324439868	/nfs/dbraw/zinc/43/98/68/1324439868.db2.gz	QLMLDFJIWBPSMJ-HOTGVXAUSA-N	0	3	332.875	3.420	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2sccc2C(F)F)C1	ZINC001025605995	1324454439	/nfs/dbraw/zinc/45/44/39/1324454439.db2.gz	KMKWXSYSENVCHU-NEPJUHHUSA-N	0	3	326.412	3.149	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(-c3cccs3)o2)C1	ZINC001025607150	1324457006	/nfs/dbraw/zinc/45/70/06/1324457006.db2.gz	SGNNXJYEOIEVSY-HUUCEWRRSA-N	0	3	342.464	3.472	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2c[nH]cc2-c2ccccc2)C1	ZINC001025623193	1324472413	/nfs/dbraw/zinc/47/24/13/1324472413.db2.gz	ZCRLJTAXEFZGMJ-FUHWJXTLSA-N	0	3	335.451	3.145	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(F)c3occc32)C1	ZINC001025623576	1324472917	/nfs/dbraw/zinc/47/29/17/1324472917.db2.gz	FRHMJWKBIOFZTM-CABCVRRESA-N	0	3	342.414	3.426	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(C3CCCC3)no2)C1	ZINC001025624207	1324475349	/nfs/dbraw/zinc/47/53/49/1324475349.db2.gz	BTHDKIOUYZTCIS-DOTOQJQBSA-N	0	3	343.471	3.186	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(C)c(F)c(C)c2)C1	ZINC001025629104	1324480403	/nfs/dbraw/zinc/48/04/03/1324480403.db2.gz	ZZKBOGPCTVKSII-DLBZAZTESA-N	0	3	330.447	3.296	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CC[C@@H]2CN(C(=O)C3(C4CC4)CC3)C[C@H]12	ZINC001026291709	1324706949	/nfs/dbraw/zinc/70/69/49/1324706949.db2.gz	UUJCCPGFQNTRPE-YZGWKJHDSA-N	0	3	349.478	3.075	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H]2CC[C@H](NCc3nccs3)[C@@H]2C1	ZINC001026327157	1324728599	/nfs/dbraw/zinc/72/85/99/1324728599.db2.gz	XYGHBMBDFGLUSV-ZNMIVQPWSA-N	0	3	333.501	3.072	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H]3CC[C@H](NCc4cscn4)[C@H]3C2)CC1	ZINC001026346153	1324743246	/nfs/dbraw/zinc/74/32/46/1324743246.db2.gz	FAJDSVMWKWUZRQ-SZMVWBNQSA-N	0	3	345.512	3.216	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)C2CCCCC2)CC1	ZINC001026444441	1324806929	/nfs/dbraw/zinc/80/69/29/1324806929.db2.gz	WEYFIYGHUXONMJ-UHFFFAOYSA-N	0	3	343.309	3.492	20	30		EGEDHN
N#Cc1ccccc1CNC1CCC(NC(=O)[C@H]2CCC2(F)F)CC1	ZINC001026512488	1324858368	/nfs/dbraw/zinc/85/83/68/1324858368.db2.gz	HGFSMBHKIWACRX-OFLPRAFFSA-N	0	3	347.409	3.121	20	30		EGEDHN
C=C1CC(C)(C(=O)NC2CCC(NCc3cc(C4CC4)no3)CC2)C1	ZINC001026555910	1324893085	/nfs/dbraw/zinc/89/30/85/1324893085.db2.gz	RGLLXICSMBHDLT-UHFFFAOYSA-N	0	3	343.471	3.425	20	30		EGEDHN
Cc1cccc(C(=O)N2CC[C@H](CNCc3ccccc3C#N)C2)c1	ZINC001026661547	1324960134	/nfs/dbraw/zinc/96/01/34/1324960134.db2.gz	LGAYEZHEEMQTNI-QGZVFWFLSA-N	0	3	333.435	3.119	20	30		EGEDHN
Cc1coc(C)c1C(=O)N1CC[C@H](CNCc2ccccc2C#N)C1	ZINC001026820189	1325033594	/nfs/dbraw/zinc/03/35/94/1325033594.db2.gz	HKKBIBOHBBAUMD-MRXNPFEDSA-N	0	3	337.423	3.020	20	30		EGEDHN
CC1(C)CC(C(=O)N2CC[C@@H](CNCc3cc(F)ccc3C#N)C2)C1	ZINC001026822107	1325035310	/nfs/dbraw/zinc/03/53/10/1325035310.db2.gz	VCIUPYPPOAWLFK-AWEZNQCLSA-N	0	3	343.446	3.072	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCN(C(=O)c2sccc2F)C1	ZINC001026826840	1325035707	/nfs/dbraw/zinc/03/57/07/1325035707.db2.gz	PJFBKKZYCBBVQF-CYBMUJFWSA-N	0	3	343.427	3.011	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)C[C@@H]2C=CCCC2)C1	ZINC001026914114	1325076749	/nfs/dbraw/zinc/07/67/49/1325076749.db2.gz	RVIQRFCNZWPULN-MSOLQXFVSA-N	0	3	337.467	3.243	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@H](CNCc2ccccc2C#N)C1)C(C)(C)C	ZINC001026919931	1325083093	/nfs/dbraw/zinc/08/30/93/1325083093.db2.gz	QQCXUHWQTOTVEP-HZPDHXFCSA-N	0	3	327.472	3.179	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@H](CNCc2cc(F)ccc2C#N)C1)C(C)(C)C	ZINC001026921256	1325084405	/nfs/dbraw/zinc/08/44/05/1325084405.db2.gz	PEOPTGRKEJQHRZ-LSDHHAIUSA-N	0	3	345.462	3.318	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](CNCc2csc(CCC)n2)C1	ZINC001026992571	1325130471	/nfs/dbraw/zinc/13/04/71/1325130471.db2.gz	PIKNLFWVHIQMPU-AWEZNQCLSA-N	0	3	335.517	3.246	20	30		EGEDHN
C(=NOCCC1SCCS1)c1ccc(N2CCOCC2)cc1	ZINC000853642601	1325139742	/nfs/dbraw/zinc/13/97/42/1325139742.db2.gz	JOUZOKRPIDOTJN-UHFFFAOYSA-N	0	3	338.498	3.070	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)[C@H]2C[C@H]3C[C@H]3C2)C1	ZINC000963349023	1325141390	/nfs/dbraw/zinc/14/13/90/1325141390.db2.gz	NIMMWZQUJSEJRX-AVEIZBFRSA-N	0	3	336.907	3.488	20	30		EGEDHN
CCC1(C(=O)N2CC[C@H](CNCc3cc(F)ccc3C#N)C2)CCC1	ZINC001027004117	1325143956	/nfs/dbraw/zinc/14/39/56/1325143956.db2.gz	KBDBLYWSUQEUOC-OAHLLOKOSA-N	0	3	343.446	3.216	20	30		EGEDHN
CN(C(=O)C1(C)CC1)C1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC000963357106	1325153212	/nfs/dbraw/zinc/15/32/12/1325153212.db2.gz	OXGRDJOKGUCXKM-UHFFFAOYSA-N	0	3	343.446	3.357	20	30		EGEDHN
CC1(C)CC(CC(=O)N2CC[C@H](CNCc3ccccc3C#N)C2)C1	ZINC001027017608	1325158172	/nfs/dbraw/zinc/15/81/72/1325158172.db2.gz	XGHGUAMSTPZTOK-MRXNPFEDSA-N	0	3	339.483	3.323	20	30		EGEDHN
C[C@@H](CC(C)(C)C#N)N[C@H](CO)c1ccc(Br)cc1	ZINC000925674591	1325258659	/nfs/dbraw/zinc/25/86/59/1325258659.db2.gz	SFCMLBICKOHQJV-SMDDNHRTSA-N	0	3	325.250	3.400	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC001027187267	1325287805	/nfs/dbraw/zinc/28/78/05/1325287805.db2.gz	YAPUQXHGQPEDCH-LJQANCHMSA-N	0	3	347.462	3.129	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1cc(Cl)c[nH]1)C2	ZINC000963560888	1325319662	/nfs/dbraw/zinc/31/96/62/1325319662.db2.gz	NNOKOYXUNKHWJO-UHFFFAOYSA-N	0	3	328.243	3.051	20	30		EGEDHN
N#Cc1ccc(F)c(C(=O)N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)c1	ZINC000854983994	1325330724	/nfs/dbraw/zinc/33/07/24/1325330724.db2.gz	ZVUSMVSNMHETGF-FXAWDEMLSA-N	0	3	349.409	3.044	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)C2CCC(NCc3conc3CC)CC2)C1	ZINC000963891314	1325423733	/nfs/dbraw/zinc/42/37/33/1325423733.db2.gz	RGUDHYAUJKFKCJ-UHFFFAOYSA-N	0	3	345.487	3.453	20	30		EGEDHN
CN(Cc1ccc(F)c(C#N)c1)[C@@H]1CCCN(C(=O)c2ccoc2)C1	ZINC001027297446	1325437423	/nfs/dbraw/zinc/43/74/23/1325437423.db2.gz	FYYPLLKCDLLILK-QGZVFWFLSA-N	0	3	341.386	3.027	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)c(F)c2)C1	ZINC001027305111	1325449928	/nfs/dbraw/zinc/44/99/28/1325449928.db2.gz	HTMYYZCXEYACET-YOEHRIQHSA-N	0	3	331.435	3.166	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1ccn3ccccc13)C2	ZINC000964292708	1325492749	/nfs/dbraw/zinc/49/27/49/1325492749.db2.gz	HOLICOQNSWFYTM-UHFFFAOYSA-N	0	3	343.858	3.322	20	30		EGEDHN
CN(Cc1ccc(C#N)c(F)c1)[C@@H]1CCCN(C(=O)[C@@H]2CC2(C)C)C1	ZINC001027374755	1325571577	/nfs/dbraw/zinc/57/15/77/1325571577.db2.gz	IUEOSVBLYSNYRU-SJORKVTESA-N	0	3	343.446	3.166	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)C[C@@H](C)c2ccco2)c1	ZINC000860468178	1329321099	/nfs/dbraw/zinc/32/10/99/1329321099.db2.gz	IPQWCZNDKYBLHD-DOMZBBRYSA-N	0	3	326.352	3.129	20	30		EGEDHN
N#CC(C(=O)CCc1ccc(Cl)c(F)c1)C(=O)NC1CCCC1	ZINC000860478343	1329322439	/nfs/dbraw/zinc/32/24/39/1329322439.db2.gz	WCAQHROFAMMLFQ-ZDUSSCGKSA-N	0	3	336.794	3.179	20	30		EGEDHN
C[C@H](CC(=O)C(C#N)C(=O)NCc1ccc(F)c(F)c1)c1ccco1	ZINC000860692562	1329344845	/nfs/dbraw/zinc/34/48/45/1329344845.db2.gz	NKCCYGRZZDHTJW-DGCLKSJQSA-N	0	3	346.333	3.077	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)C(=O)NCc1ccc(F)cc1F)c1ccco1	ZINC000860692857	1329344880	/nfs/dbraw/zinc/34/48/80/1329344880.db2.gz	XFQMXVPONXTJOX-SMDDNHRTSA-N	0	3	346.333	3.077	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)c2cc3ccc(F)cc3s2)C1	ZINC001027481534	1327735065	/nfs/dbraw/zinc/73/50/65/1327735065.db2.gz	LWQGWWRWRWBBNC-OAHLLOKOSA-N	0	3	330.428	3.210	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)c2ccc3c4c(cccc42)CC3)C1	ZINC001027485636	1327743316	/nfs/dbraw/zinc/74/33/16/1327743316.db2.gz	FTXCPUYCLTVCPF-GOSISDBHSA-N	0	3	332.447	3.108	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)[C@H]2C[C@H]3C[C@H]3C2)C1	ZINC001027537793	1327832235	/nfs/dbraw/zinc/83/22/35/1327832235.db2.gz	QIHLHPPRXPLKNA-NMLBUPMWSA-N	0	3	337.467	3.027	20	30		EGEDHN
COc1cc(Cl)ccc1[C@@H](C)NCCNc1ccc(C#N)cn1	ZINC000927167304	1327905052	/nfs/dbraw/zinc/90/50/52/1327905052.db2.gz	IOYLJKZNRGOECJ-GFCCVEGCSA-N	0	3	330.819	3.378	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccoc2C(F)(F)F)C1	ZINC000966389909	1328288137	/nfs/dbraw/zinc/28/81/37/1328288137.db2.gz	SYLXTDMTMNRUPI-AAEUAGOBSA-N	0	3	330.350	3.315	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1ncoc1-c1ccccc1	ZINC001027918508	1328396926	/nfs/dbraw/zinc/39/69/26/1328396926.db2.gz	OCVPDMRKKFBFEA-INIZCTEOSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@@H]2CCCN2CC=C(C)C)cc1	ZINC001027973964	1328449777	/nfs/dbraw/zinc/44/97/77/1328449777.db2.gz	CMTIFYLPODUQEW-SFHVURJKSA-N	0	3	328.456	3.412	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1cn(CC)c2ccccc12	ZINC001028012043	1328474645	/nfs/dbraw/zinc/47/46/45/1328474645.db2.gz	FSKYVXDWZDTIKW-MRXNPFEDSA-N	0	3	325.456	3.432	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN(C)C[C@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000862541261	1329494625	/nfs/dbraw/zinc/49/46/25/1329494625.db2.gz	RKPOBMDKKGOLNJ-LSDHHAIUSA-N	0	3	347.459	3.322	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)Cc3cccc(C(F)F)c3)C2)CC1	ZINC001050590560	1348295353	/nfs/dbraw/zinc/29/53/53/1348295353.db2.gz	CXLMGNPABFGEEO-UHFFFAOYSA-N	0	3	346.421	3.114	20	30		EGEDHN
C=CC1(CC(=O)N2CCN(CC3CCOCC3)CC2)CCCCC1	ZINC000933178227	1329869568	/nfs/dbraw/zinc/86/95/68/1329869568.db2.gz	JAQAEIHVWPHFOU-UHFFFAOYSA-N	0	3	334.504	3.084	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2ccc(Cl)c(Cl)c2)CC1	ZINC001052888967	1348725261	/nfs/dbraw/zinc/72/52/61/1348725261.db2.gz	MCVSYIOGQRFTDH-CYBMUJFWSA-N	0	3	325.239	3.211	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](C)[C@H](NCc3cc(F)ccc3OC)C2)C1	ZINC000939102496	1330376502	/nfs/dbraw/zinc/37/65/02/1330376502.db2.gz	ISGYSZRMAIRFBN-RHSMWYFYSA-N	0	3	346.446	3.127	20	30		EGEDHN
CC(C)(C)C(=O)N[C@@H]1CCN(Cc2cccc(C#N)c2)CC1(C)C	ZINC000941177834	1331372226	/nfs/dbraw/zinc/37/22/26/1331372226.db2.gz	PCZGOPLJAPDTMB-QGZVFWFLSA-N	0	3	327.472	3.321	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccccc2C(C)(C)CC)[C@@H](C)C1	ZINC000942163874	1331855303	/nfs/dbraw/zinc/85/53/03/1331855303.db2.gz	PAJNWSZXKFMPNY-QFBILLFUSA-N	0	3	326.484	3.448	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)nn2C(CC)CC)[C@@H](C)C1	ZINC000942201827	1331876567	/nfs/dbraw/zinc/87/65/67/1331876567.db2.gz	AJWNDXPRLVOPSR-MAUKXSAKSA-N	0	3	344.503	3.016	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(C)n(C(CC)CC)n2)[C@H](C)C1	ZINC000942207296	1331879987	/nfs/dbraw/zinc/87/99/87/1331879987.db2.gz	KYTFBAUFNBXTCK-PBHICJAKSA-N	0	3	332.492	3.179	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2sc(C)nc2CC(C)C)[C@@H](C)C1	ZINC000942313690	1331900754	/nfs/dbraw/zinc/90/07/54/1331900754.db2.gz	LGOGLBGQXIAPQB-DZGCQCFKSA-N	0	3	335.517	3.276	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cn(CC)c3ccccc23)[C@@H](C)C1	ZINC000942390750	1331921101	/nfs/dbraw/zinc/92/11/01/1331921101.db2.gz	BSFVURSDNHZUOK-QFBILLFUSA-N	0	3	337.467	3.125	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2cccc(C(F)F)c2)[C@H](C)C1	ZINC000942467135	1331941299	/nfs/dbraw/zinc/94/12/99/1331941299.db2.gz	NYFSHHXCRUHGFM-RHSMWYFYSA-N	0	3	334.410	3.017	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(Cc3ccsc3)C[C@H]2C)cc1	ZINC000942553063	1331970665	/nfs/dbraw/zinc/97/06/65/1331970665.db2.gz	MBMZUDBDCFKHKN-DNVCBOLYSA-N	0	3	338.476	3.370	20	30		EGEDHN
Cc1cocc1C(=O)N[C@H]1CCN(Cc2cccc(C#N)c2)C[C@H]1C	ZINC000942558449	1331973539	/nfs/dbraw/zinc/97/35/39/1331973539.db2.gz	WPBOCMSTMZILAI-KUHUBIRLSA-N	0	3	337.423	3.100	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)c(C)cc2Cl)[C@H](C)C1	ZINC000942561936	1331975648	/nfs/dbraw/zinc/97/56/48/1331975648.db2.gz	DZJNLRNWRKEXTL-CRAIPNDOSA-N	0	3	332.875	3.420	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)cc2)CC[C@@H]1NC(=O)C1(C)CC=CC1	ZINC000942603169	1332001213	/nfs/dbraw/zinc/00/12/13/1332001213.db2.gz	TUOVJUXGNJCVIX-APWZRJJASA-N	0	3	337.467	3.241	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C(C)(C)c2cccc(Cl)c2)[C@H](C)C1	ZINC000943209589	1332121633	/nfs/dbraw/zinc/12/16/33/1332121633.db2.gz	RDHJZGFXZJCNMT-QAPCUYQASA-N	0	3	346.902	3.468	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(C)oc2C(F)(F)F)[C@H](C)C1	ZINC000943209076	1332122029	/nfs/dbraw/zinc/12/20/29/1332122029.db2.gz	ODSKNWOVOSRGOR-ZWNOBZJWSA-N	0	3	330.350	3.233	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3cc(F)ccc3o2)[C@@H](C)C1	ZINC000943286776	1332138275	/nfs/dbraw/zinc/13/82/75/1332138275.db2.gz	GBSGBYSEUCUTMN-BBRMVZONSA-N	0	3	328.387	3.035	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)c(F)cc2Cl)[C@@H](C)C1	ZINC000944345303	1332379878	/nfs/dbraw/zinc/37/98/78/1332379878.db2.gz	FLLGDWLLDQMYCV-GUYCJALGSA-N	0	3	336.838	3.251	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(OC3CCC3)cc2)[C@@H](C)C1	ZINC000945029276	1332481395	/nfs/dbraw/zinc/48/13/95/1332481395.db2.gz	RGZTWAHKWOVVHM-JXFKEZNVSA-N	0	3	340.467	3.081	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(F)c3occc32)[C@@H](C)C1	ZINC000945030134	1332481429	/nfs/dbraw/zinc/48/14/29/1332481429.db2.gz	WMWVFCXTXKEGPJ-SUMWQHHRSA-N	0	3	328.387	3.035	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CC[C@H]2CN(Cc3ccccc3C#N)C[C@H]2CC1	ZINC000946489877	1332842619	/nfs/dbraw/zinc/84/26/19/1332842619.db2.gz	IPJNJXTUBIDXAH-AHRSYUTCSA-N	0	3	339.483	3.275	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc(OCCC)c2)C[C@@H]1C	ZINC000947365843	1333105174	/nfs/dbraw/zinc/10/51/74/1333105174.db2.gz	UYBDDVJXLMYZBG-WMZOPIPTSA-N	0	3	328.456	3.081	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CCN(CCC(F)(F)F)[C@@H](C)C1	ZINC000947391115	1333112938	/nfs/dbraw/zinc/11/29/38/1333112938.db2.gz	GVLXYXJKGMZTHU-KBPBESRZSA-N	0	3	343.393	3.209	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2oc3c(cccc3F)c2C)C[C@H]1C	ZINC000947392660	1333113313	/nfs/dbraw/zinc/11/33/13/1333113313.db2.gz	XHBSYZASDNSUPR-HIFRSBDPSA-N	0	3	342.414	3.486	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccc3ccc(C)nc32)C[C@H]1C	ZINC000947432940	1333126444	/nfs/dbraw/zinc/12/64/44/1333126444.db2.gz	CUCMWMTWHPARLS-SJLPKXTDSA-N	0	3	335.451	3.149	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(CC(C)C)cc2)C[C@H]1C	ZINC000947519819	1333154745	/nfs/dbraw/zinc/15/47/45/1333154745.db2.gz	JCAUQDBNOJSIPV-NQIIRXRSSA-N	0	3	340.511	3.420	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cc3ccccc3s2)C[C@H]1C	ZINC000947540751	1333164734	/nfs/dbraw/zinc/16/47/34/1333164734.db2.gz	YBMJXTBSUCGAEH-WBVHZDCISA-N	0	3	340.492	3.436	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2cccc3sccc32)C[C@H]1C	ZINC000947780210	1333259899	/nfs/dbraw/zinc/25/98/99/1333259899.db2.gz	XVOYKLHWTZLZMA-GDBMZVCRSA-N	0	3	326.465	3.046	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(F)c3ncccc3c2)C[C@@H]1C	ZINC000947809406	1333267377	/nfs/dbraw/zinc/26/73/77/1333267377.db2.gz	BZCSFDYILBNGCD-XJKSGUPXSA-N	0	3	327.403	3.143	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cccc(-c3cnco3)c2)C[C@@H]1C	ZINC000947882804	1333290561	/nfs/dbraw/zinc/29/05/61/1333290561.db2.gz	XHNFEXZOKXVIFT-YOEHRIQHSA-N	0	3	325.412	3.110	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc3nc(C)sc3c2)C[C@H]1C	ZINC000947894700	1333295332	/nfs/dbraw/zinc/29/53/32/1333295332.db2.gz	BYQIATIJYGZKJF-CZUORRHYSA-N	0	3	341.480	3.211	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)n(CC3CC3)c2C)C[C@@H]1C	ZINC000947938736	1333313012	/nfs/dbraw/zinc/31/30/12/1333313012.db2.gz	ATYZTSSINKMWPR-KXBFYZLASA-N	0	3	341.499	3.121	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccccc2C(F)(F)F)C[C@H]1C	ZINC000947962450	1333321932	/nfs/dbraw/zinc/32/19/32/1333321932.db2.gz	MZIUCBXLRDBBLO-KGLIPLIRSA-N	0	3	338.373	3.311	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cccc(OCC(C)C)c2)C[C@@H]1C	ZINC000948016416	1333343431	/nfs/dbraw/zinc/34/34/31/1333343431.db2.gz	OITUVUWIQRWYTE-FUHWJXTLSA-N	0	3	330.472	3.490	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc3ccccc3c2)C[C@H]1C	ZINC000948017769	1333343868	/nfs/dbraw/zinc/34/38/68/1333343868.db2.gz	XCPCLJGUMSVCQJ-UTKZUKDTSA-N	0	3	334.463	3.375	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc3[nH]c(C)c(C)c3c2)C[C@H]1C	ZINC000948025302	1333344957	/nfs/dbraw/zinc/34/49/57/1333344957.db2.gz	GCRRCBOISTZLNW-KDOFPFPSSA-N	0	3	337.467	3.391	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccccc2OCC2CC2)C[C@@H]1C	ZINC000948061479	1333359850	/nfs/dbraw/zinc/35/98/50/1333359850.db2.gz	VBVGBKGRQJBASN-DOTOQJQBSA-N	0	3	328.456	3.244	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C(F)(F)F)s2)C[C@@H]1C	ZINC000948083343	1333370378	/nfs/dbraw/zinc/37/03/78/1333370378.db2.gz	ROUNKKRSECNNHL-NWDGAFQWSA-N	0	3	344.402	3.373	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2sc(C(C)(C)C)nc2C)C[C@@H]1C	ZINC000948091179	1333371988	/nfs/dbraw/zinc/37/19/88/1333371988.db2.gz	VDLIZTACCIEXJM-DZGCQCFKSA-N	0	3	347.528	3.355	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2c(C)oc3ccccc32)C[C@@H]1C	ZINC000948104006	1333375096	/nfs/dbraw/zinc/37/50/96/1333375096.db2.gz	JCQGEUUMIKSYAA-RDJZCZTQSA-N	0	3	338.451	3.276	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)Cc2ccc(C)c(Cl)c2)CC1	ZINC000948474045	1333539952	/nfs/dbraw/zinc/53/99/52/1333539952.db2.gz	PNXHDLGESFLMFC-QGZVFWFLSA-N	0	3	332.875	3.137	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2cccc3c(C)c(C)[nH]c32)CC1	ZINC000948546861	1333567577	/nfs/dbraw/zinc/56/75/77/1333567577.db2.gz	JTZGLLBLZBMADZ-QGZVFWFLSA-N	0	3	337.467	3.344	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2cc(F)cc3ccoc32)CC1	ZINC000948570618	1333580845	/nfs/dbraw/zinc/58/08/45/1333580845.db2.gz	NHLZTXQRVBXVIL-MRXNPFEDSA-N	0	3	328.387	3.132	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)[C@@H](C)c2c(F)cccc2F)CC1	ZINC000948620809	1333600072	/nfs/dbraw/zinc/60/00/72/1333600072.db2.gz	IQFHQXIZFMOKKL-GJZGRUSLSA-N	0	3	334.410	3.014	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2ccc(C)c3cccnc23)CC1	ZINC000948625479	1333601803	/nfs/dbraw/zinc/60/18/03/1333601803.db2.gz	PVXPHUDLHQWRAA-KRWDZBQOSA-N	0	3	335.451	3.103	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2c(F)cc(F)cc2F)CC1	ZINC000948722378	1333646566	/nfs/dbraw/zinc/64/65/66/1333646566.db2.gz	NPNVJSLQJKJMAI-AWEZNQCLSA-N	0	3	338.373	3.054	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)C(C)(C)c2cccc(F)c2)CC1	ZINC000948772634	1333672267	/nfs/dbraw/zinc/67/22/67/1333672267.db2.gz	ZSKGNTVHVQNHJX-GOSISDBHSA-N	0	3	330.447	3.049	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2ccc(C(C)C)nc2C)CC1	ZINC000948779542	1333676516	/nfs/dbraw/zinc/67/65/16/1333676516.db2.gz	OSHKFMNCOOUNQY-KRWDZBQOSA-N	0	3	327.472	3.073	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2csc(C(C)C)n2)CC1	ZINC000948852223	1333710438	/nfs/dbraw/zinc/71/04/38/1333710438.db2.gz	KXAHYQBMSZPFEQ-OAHLLOKOSA-N	0	3	333.501	3.216	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)C(C)(C)c2ccccc2F)CC1	ZINC000948860210	1333712013	/nfs/dbraw/zinc/71/20/13/1333712013.db2.gz	ATMJGIPBKNOLQG-QGZVFWFLSA-N	0	3	344.474	3.440	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@H]1CNC(=O)c1n[nH]cc1C	ZINC000948915534	1333732533	/nfs/dbraw/zinc/73/25/33/1333732533.db2.gz	AYKMIJQJOQRVFG-GOSISDBHSA-N	0	3	338.455	3.014	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@@H]1CNC(=O)c1nocc1C	ZINC000948978406	1333755196	/nfs/dbraw/zinc/75/51/96/1333755196.db2.gz	LTCGOBDDNBSFMX-SFHVURJKSA-N	0	3	339.439	3.278	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H]1CCC[C@@H]1CCC)CCO2	ZINC000949129554	1333781714	/nfs/dbraw/zinc/78/17/14/1333781714.db2.gz	NQKADBQIEWXHHN-ZWKOTPCHSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H]1CCC[C@H]1CCC)CCO2	ZINC000949129552	1333781719	/nfs/dbraw/zinc/78/17/19/1333781719.db2.gz	NQKADBQIEWXHHN-QZTJIDSGSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)CC1CCC(C)(C)CC1)CCO2	ZINC000949257463	1333805640	/nfs/dbraw/zinc/80/56/40/1333805640.db2.gz	CJTRAWHJXJSQKQ-UHFFFAOYSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C[C@H]3CCC[C@@H]3C)CC2)C1	ZINC000949365843	1333831156	/nfs/dbraw/zinc/83/11/56/1333831156.db2.gz	ITDKQZCDQCNVGJ-RBUKOAKNSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC2(CC1)CN(CCC(C)C)CCO2	ZINC000949463426	1333854266	/nfs/dbraw/zinc/85/42/66/1333854266.db2.gz	MBQIBLAXDABXEU-LJQANCHMSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@H]3CC[C@H](C)CC3)CC2)C1	ZINC000949515583	1333864595	/nfs/dbraw/zinc/86/45/95/1333864595.db2.gz	YWVOXFOXHWGMFW-IYARVYRRSA-N	0	3	334.504	3.082	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2c(C)c(F)ccc2Cl)C1	ZINC000967032751	1335646505	/nfs/dbraw/zinc/64/65/05/1335646505.db2.gz	OKMGBSZNXBAHJI-BLLLJJGKSA-N	0	3	336.838	3.251	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)Cc2ccc(CC(C)C)cc2)C1	ZINC000967274680	1335683917	/nfs/dbraw/zinc/68/39/17/1335683917.db2.gz	RQYIJDJBQRCOIV-GHTZIAJQSA-N	0	3	340.511	3.278	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)Cc2cc3ccccc3o2)C1	ZINC000967620200	1335794304	/nfs/dbraw/zinc/79/43/04/1335794304.db2.gz	DLQKYHPUJUOPOB-YJBOKZPZSA-N	0	3	326.440	3.378	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2nsc3ccc(C)cc32)C1	ZINC000967780507	1335816049	/nfs/dbraw/zinc/81/60/49/1335816049.db2.gz	PRSGPEAMVYBFPR-HOCLYGCPSA-N	0	3	341.480	3.068	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2c(Cl)cncc2Cl)C1	ZINC000968211448	1335873044	/nfs/dbraw/zinc/87/30/44/1335873044.db2.gz	KZJQRSXGNFERAL-RISCZKNCSA-N	0	3	342.270	3.405	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CN(CCc3cccs3)CC[C@@H]2C)C1	ZINC000968277156	1335882837	/nfs/dbraw/zinc/88/28/37/1335882837.db2.gz	YAQQSBRAZSGPHZ-DOTOQJQBSA-N	0	3	332.513	3.474	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)Cc2ccc(F)c(Cl)c2)C1	ZINC000968354386	1335899638	/nfs/dbraw/zinc/89/96/38/1335899638.db2.gz	RYNVLXBYNNIRHI-CXAGYDPISA-N	0	3	338.854	3.424	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2c(C)noc2C(F)(F)F)C1	ZINC000968369327	1335906957	/nfs/dbraw/zinc/90/69/57/1335906957.db2.gz	ITLFHWQHXOIWPI-CMPLNLGQSA-N	0	3	345.365	3.018	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2ccc(C)c(OCC)c2)C1	ZINC000968382789	1335912659	/nfs/dbraw/zinc/91/26/59/1335912659.db2.gz	VUVCCCWDWLIJDL-MAUKXSAKSA-N	0	3	330.472	3.410	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C)[C@@H](NC(=O)c2cccc3nc(C)[nH]c32)C1	ZINC000968508548	1335947201	/nfs/dbraw/zinc/94/72/01/1335947201.db2.gz	AZKBIOQTXNQNAC-BZNIZROVSA-N	0	3	346.862	3.064	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CN(Cc3cccc(C)c3)CC[C@H]2C)nc1	ZINC000968548534	1335959540	/nfs/dbraw/zinc/95/95/40/1335959540.db2.gz	GLGAEBGVLKFFFC-DYESRHJHSA-N	0	3	347.462	3.012	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cc(F)c(F)c(F)c2F)C1	ZINC000968568765	1335962366	/nfs/dbraw/zinc/96/23/66/1335962366.db2.gz	CJJKZEIYBNNIBU-MFKMUULPSA-N	0	3	344.352	3.259	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccc(Cl)cc2Cl)C1	ZINC000968578653	1335968716	/nfs/dbraw/zinc/96/87/16/1335968716.db2.gz	GZFUHOZXVVDVGX-MLGOLLRUSA-N	0	3	339.266	3.457	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2)C1	ZINC000968580537	1335971329	/nfs/dbraw/zinc/97/13/29/1335971329.db2.gz	WGWBPCZLWQEXAD-CJNGLKHVSA-N	0	3	338.373	3.169	20	30		EGEDHN
Cc1sccc1C(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC000968595303	1335977211	/nfs/dbraw/zinc/97/72/11/1335977211.db2.gz	QRPGNMPDCULJLP-OAHLLOKOSA-N	0	3	343.427	3.072	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2cc(OC)c(C)c(OC)c2)C1	ZINC000968624690	1335988400	/nfs/dbraw/zinc/98/84/00/1335988400.db2.gz	YFCIXOLZWMDYAH-RHSMWYFYSA-N	0	3	346.471	3.029	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)Cc2cccc(OC(C)C)c2)C1	ZINC000968687981	1336011427	/nfs/dbraw/zinc/01/14/27/1336011427.db2.gz	ITNJPNVBNVEFGV-PXNSSMCTSA-N	0	3	344.499	3.419	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(CN(CC)CC)o2)C1	ZINC000968688016	1336011560	/nfs/dbraw/zinc/01/15/60/1336011560.db2.gz	JGWYIBYCOWUYGQ-AEFFLSMTSA-N	0	3	347.503	3.138	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2ccccc2CC(C)C)C1	ZINC000968692555	1336014396	/nfs/dbraw/zinc/01/43/96/1336014396.db2.gz	OBJLQQRLMJDHDQ-FXAWDEMLSA-N	0	3	326.484	3.349	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)C(C)(C)c2ccccc2C)C1	ZINC000968698707	1336016377	/nfs/dbraw/zinc/01/63/77/1336016377.db2.gz	QTNSDIANVWYGFS-PKOBYXMFSA-N	0	3	326.484	3.123	20	30		EGEDHN
CC1=C(C)C[C@@H](C(=O)N2CC[C@@H](NCc3ccc(C#N)s3)C2)CC1	ZINC000968777126	1336047374	/nfs/dbraw/zinc/04/73/74/1336047374.db2.gz	VYQCDGWZBXUAFV-JKSUJKDBSA-N	0	3	343.496	3.447	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1cc(C)c(OC)c(C)c1	ZINC000968869085	1336073110	/nfs/dbraw/zinc/07/31/10/1336073110.db2.gz	HVATYFGPMMJPTH-IBGZPJMESA-N	0	3	342.483	3.310	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1cc(C)n(C(F)F)n1	ZINC000968876581	1336076188	/nfs/dbraw/zinc/07/61/88/1336076188.db2.gz	FSGYZXXEILOSKG-CQSZACIVSA-N	0	3	340.418	3.137	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cc(Cl)c(Cl)n1C	ZINC000968877296	1336076735	/nfs/dbraw/zinc/07/67/35/1336076735.db2.gz	SGTVMNXGFOJEPH-LBPRGKRZSA-N	0	3	344.286	3.492	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@@H]2CCCCCN2CC=C)cc1	ZINC000968923299	1336090944	/nfs/dbraw/zinc/09/09/44/1336090944.db2.gz	PMXXJRHXYVVARY-SFHVURJKSA-N	0	3	328.456	3.412	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)[C@H]1CCc2cc(F)ccc21	ZINC000968952698	1336101759	/nfs/dbraw/zinc/10/17/59/1336101759.db2.gz	WXFPIVHNOCWOCG-MJGOQNOKSA-N	0	3	330.447	3.402	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1noc2c1CC(C)(C)CC2	ZINC000968957767	1336102872	/nfs/dbraw/zinc/10/28/72/1336102872.db2.gz	RKAARMIDOMWAPC-HNNXBMFYSA-N	0	3	345.487	3.350	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)[C@@H]1COc2cc(C)c(C)cc21	ZINC000968965645	1336103941	/nfs/dbraw/zinc/10/39/41/1336103941.db2.gz	UPPLHQXHIDLFDH-PKOBYXMFSA-N	0	3	342.483	3.326	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccc(C(F)(F)F)cn1	ZINC000968971722	1336106017	/nfs/dbraw/zinc/10/60/17/1336106017.db2.gz	RQBANPRIHNBWCR-AWEZNQCLSA-N	0	3	341.377	3.261	20	30		EGEDHN
C#CCN1CCCCC[C@@H]1CNC(=O)c1ccccc1-n1cccc1	ZINC000969008277	1336116532	/nfs/dbraw/zinc/11/65/32/1336116532.db2.gz	PBUBVOOZAWIUBM-GOSISDBHSA-N	0	3	335.451	3.085	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1ccccc1-n1cccc1	ZINC000969008216	1336116628	/nfs/dbraw/zinc/11/66/28/1336116628.db2.gz	OTQQUQDBIYGXSG-IBGZPJMESA-N	0	3	349.478	3.475	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cc(F)c(F)c(F)c1	ZINC000969040065	1336123701	/nfs/dbraw/zinc/12/37/01/1336123701.db2.gz	YCYADFUMTNETGC-CYBMUJFWSA-N	0	3	326.362	3.264	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccc(-c2cn[nH]c2)cc1	ZINC000969072710	1336137941	/nfs/dbraw/zinc/13/79/41/1336137941.db2.gz	QEJRNLDUHLRPND-IBGZPJMESA-N	0	3	338.455	3.237	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cccc(-n2ccnc2)c1	ZINC000969101046	1336143405	/nfs/dbraw/zinc/14/34/05/1336143405.db2.gz	OTGWKMZJJGXHRX-IBGZPJMESA-N	0	3	338.455	3.033	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccc2scnc2c1	ZINC000969101131	1336143430	/nfs/dbraw/zinc/14/34/30/1336143430.db2.gz	RJCHGDXBNHZFQR-OAHLLOKOSA-N	0	3	329.469	3.457	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1ccc2ccncc2c1	ZINC000969105453	1336145337	/nfs/dbraw/zinc/14/53/37/1336145337.db2.gz	HUJQTPRNLXBCNJ-FQEVSTJZSA-N	0	3	335.451	3.233	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1cc(C)n(C(C)(C)C)n1	ZINC000969144777	1336160918	/nfs/dbraw/zinc/16/09/18/1336160918.db2.gz	SXHCXLPTOPBFAN-QGZVFWFLSA-N	0	3	346.519	3.497	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cc(NC(C)=O)ccc1C	ZINC000969165474	1336169319	/nfs/dbraw/zinc/16/93/19/1336169319.db2.gz	YXKXIUCTLURIKO-GOSISDBHSA-N	0	3	343.471	3.114	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@H](NCc2cc(C)ccc2OC)C1	ZINC000969831496	1336252173	/nfs/dbraw/zinc/25/21/73/1336252173.db2.gz	HAJDKFHRUIEVSX-XLIONFOSSA-N	0	3	330.472	3.296	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@H](NCc2cn(C(C)C)nc2C)C1	ZINC000969831148	1336252245	/nfs/dbraw/zinc/25/22/45/1336252245.db2.gz	BHOGVCFPHNOPOK-MJGOQNOKSA-N	0	3	332.492	3.065	20	30		EGEDHN
C#CCCN1CC([C@@H](C)NC(=O)c2ccccc2C(C)(C)CC)C1	ZINC000969922196	1336260802	/nfs/dbraw/zinc/26/08/02/1336260802.db2.gz	IKPDRQOWSFYYBI-MRXNPFEDSA-N	0	3	326.484	3.448	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C1)c1cccs1	ZINC000969923469	1336261310	/nfs/dbraw/zinc/26/13/10/1336261310.db2.gz	KOMUVGUJFGOTJR-CHWSQXEVSA-N	0	3	345.493	3.175	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H](C)C2CN(Cc3ccc(C)cc3)C2)cc1	ZINC000970251042	1336291310	/nfs/dbraw/zinc/29/13/10/1336291310.db2.gz	BVTLFRVLMRKGFF-KRWDZBQOSA-N	0	3	332.447	3.227	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)C[C@@H]2C[C@H]2c2ccc(OC)cc2)CC1	ZINC001005523804	1336366882	/nfs/dbraw/zinc/36/68/82/1336366882.db2.gz	FBDVVEDDIZAQJR-PXNSSMCTSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cnc(-c3ccccc3)o2)CC1	ZINC001005539389	1336369732	/nfs/dbraw/zinc/36/97/32/1336369732.db2.gz	NVBDFSIMYQRPSV-UHFFFAOYSA-N	0	3	325.412	3.064	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2c(Cl)cncc2Cl)CC1	ZINC001005934532	1336425447	/nfs/dbraw/zinc/42/54/47/1336425447.db2.gz	LLFAVJAQNFUKRD-UHFFFAOYSA-N	0	3	328.243	3.111	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)C2CCN(Cc3ccc(C#N)cc3)CC2)C1	ZINC001005942784	1336427425	/nfs/dbraw/zinc/42/74/25/1336427425.db2.gz	LXAXVJUHSWKONK-UHFFFAOYSA-N	0	3	337.467	3.337	20	30		EGEDHN
CC[C@@]1(C)C[C@H]1C(=O)N(C)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001006224484	1336470709	/nfs/dbraw/zinc/47/07/09/1336470709.db2.gz	JUEDHTMKRXDBCB-FPOVZHCZSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2csc(-c3ccco3)n2)C1	ZINC001008336909	1336825572	/nfs/dbraw/zinc/82/55/72/1336825572.db2.gz	XJGMPPKPBCJNSL-ZDUSSCGKSA-N	0	3	331.441	3.173	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCCN(C[C@@H]3CC(C)(C)CO3)C2)CC1	ZINC001008418665	1336847343	/nfs/dbraw/zinc/84/73/43/1336847343.db2.gz	PIOYQSBITVODLN-ROUUACIJSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H](NC(=O)c2occc2Br)C1	ZINC001008888679	1336938248	/nfs/dbraw/zinc/93/82/48/1336938248.db2.gz	RPFAZEXIWAJJNN-GFCCVEGCSA-N	0	3	341.249	3.203	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN([C@H]3CCc4ccccc43)C2)cc1	ZINC001015482391	1338155581	/nfs/dbraw/zinc/15/55/81/1338155581.db2.gz	NUIHIYWLSWRBOA-CTNGQTDRSA-N	0	3	330.431	3.160	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCN(Cc3ccccc3N(C)C)C2)CC1	ZINC001015659624	1338238007	/nfs/dbraw/zinc/23/80/07/1338238007.db2.gz	FUVCFOMFPVUNHV-LJQANCHMSA-N	0	3	341.499	3.190	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CCN([C@@H](C)c3cc(C)ccc3C)C2)c1	ZINC001015680305	1338255433	/nfs/dbraw/zinc/25/54/33/1338255433.db2.gz	ZUHIUGSRJKSXMC-PXNSSMCTSA-N	0	3	347.462	3.245	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@H]2CCN(Cc3cccc(C)c3)C2)cc1	ZINC001015804673	1338317785	/nfs/dbraw/zinc/31/77/85/1338317785.db2.gz	XERQRXGCWPBPKM-FQEVSTJZSA-N	0	3	348.446	3.011	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@H]3NC(=O)c3ccccc3)CC2)c1	ZINC001016478539	1338617509	/nfs/dbraw/zinc/61/75/09/1338617509.db2.gz	FKYZPPUSTAQGPH-HXUWFJFHSA-N	0	3	345.446	3.343	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2oc3c(cccc3F)c2C)CC1	ZINC001016664925	1338684834	/nfs/dbraw/zinc/68/48/34/1338684834.db2.gz	ZXBGYTSZHVCHIY-MRXNPFEDSA-N	0	3	340.398	3.098	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)[C@@H]2CC[C@@H](c3ccccc3)C2)CC1	ZINC001016685466	1338689684	/nfs/dbraw/zinc/68/96/84/1338689684.db2.gz	PZGCASLHPUXLLA-VAMGGRTRSA-N	0	3	336.479	3.174	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)Cc2c(C)cccc2Cl)CC1	ZINC001016707784	1338697724	/nfs/dbraw/zinc/69/77/24/1338697724.db2.gz	AQPIKVRCRGYKFD-SFHVURJKSA-N	0	3	344.886	3.185	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2cc3cc(Cl)ccc3o2)CC1	ZINC001016714832	1338700410	/nfs/dbraw/zinc/70/04/10/1338700410.db2.gz	LBYSMGFTUYBEGR-QGZVFWFLSA-N	0	3	342.826	3.304	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)C2CC(C)(C)CC(C)(C)C2)CC1	ZINC001016744239	1338709396	/nfs/dbraw/zinc/70/93/96/1338709396.db2.gz	GBYXDODGCGGRDF-KRWDZBQOSA-N	0	3	330.516	3.443	20	30		EGEDHN
C[C@]1(C(=O)N[C@H]2CC23CCN(Cc2cccc(C#N)c2)CC3)C=CCC1	ZINC001016776636	1338722703	/nfs/dbraw/zinc/72/27/03/1338722703.db2.gz	ZQCRFCSGOSJCPG-FPOVZHCZSA-N	0	3	349.478	3.385	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)[C@@H](C)c2ccc(Cl)cc2)CC1	ZINC001016809629	1338733465	/nfs/dbraw/zinc/73/34/65/1338733465.db2.gz	ZQTJKENNYBHLFQ-YOEHRIQHSA-N	0	3	330.859	3.047	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2c(C)cccc2Cl)CC1	ZINC001016810521	1338734167	/nfs/dbraw/zinc/73/41/67/1338734167.db2.gz	LJRCKUFWTWSPOI-MRXNPFEDSA-N	0	3	330.859	3.256	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2ccc(C)c3ccccc23)CC1	ZINC001016856096	1338748970	/nfs/dbraw/zinc/74/89/70/1338748970.db2.gz	UWPZBSZDLOOFAJ-HXUWFJFHSA-N	0	3	332.447	3.366	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccc3nc(C)ccc3c2)CC1	ZINC001016891441	1338760812	/nfs/dbraw/zinc/76/08/12/1338760812.db2.gz	FXVJAGGORGZIBS-FQEVSTJZSA-N	0	3	347.462	3.151	20	30		EGEDHN
Cc1cccc(Cl)c1CN(C)C[C@@H]1CCCN(C(=O)[C@@H](C)C#N)C1	ZINC001017071547	1338848123	/nfs/dbraw/zinc/84/81/23/1338848123.db2.gz	NUCNVOOXDUZEOT-HOTGVXAUSA-N	0	3	347.890	3.479	20	30		EGEDHN
CN(Cc1cc(F)cc(F)c1)C[C@H]1CCCN(C(=O)C#CC2CC2)C1	ZINC001017122800	1338880472	/nfs/dbraw/zinc/88/04/72/1338880472.db2.gz	AUDSAOKIOZHRMV-MRXNPFEDSA-N	0	3	346.421	3.049	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1CCC[C@H]1C(F)F	ZINC001017616795	1339377760	/nfs/dbraw/zinc/37/77/60/1339377760.db2.gz	IDRYFEQOSCULEI-QXSJWSMHSA-N	0	3	326.431	3.309	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccnc2ccccc21	ZINC001017713768	1339398877	/nfs/dbraw/zinc/39/88/77/1339398877.db2.gz	QSSHNJMKAPESQU-CALCHBBNSA-N	0	3	335.451	3.490	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2[nH]nc(C)c2c1	ZINC001017726078	1339404034	/nfs/dbraw/zinc/40/40/34/1339404034.db2.gz	PCXJHSHVMDCFGO-CALCHBBNSA-N	0	3	338.455	3.126	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccc(F)c1F	ZINC001017998110	1339478975	/nfs/dbraw/zinc/47/89/75/1339478975.db2.gz	KRYFMSVFEBSUKB-IYBDPMFKSA-N	0	3	334.410	3.149	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1c[nH]c2c1cccc2C	ZINC001018030051	1339486470	/nfs/dbraw/zinc/48/64/70/1339486470.db2.gz	UHIYCTYBRQGVBY-HDICACEKSA-N	0	3	337.467	3.270	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)Cc1c(C)noc1C	ZINC001018037233	1339488008	/nfs/dbraw/zinc/48/80/08/1339488008.db2.gz	LXRQQBYAATWQDW-OLMNPRSZSA-N	0	3	345.487	3.111	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H]1OCCc2ccsc21	ZINC001018191495	1339526376	/nfs/dbraw/zinc/52/63/76/1339526376.db2.gz	AVEAIIOQASOERK-BBWFWOEESA-N	0	3	346.496	3.003	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@H]1CCc2ccccc2C1	ZINC001018212395	1339534949	/nfs/dbraw/zinc/53/49/49/1339534949.db2.gz	ZUGZIXAAMWOPDV-DZFGPLHGSA-N	0	3	338.495	3.433	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)c1cccc(OC)c1	ZINC001018312851	1339572405	/nfs/dbraw/zinc/57/24/05/1339572405.db2.gz	ISYDVJCOPBEJKD-NXHRZFHOSA-N	0	3	328.456	3.050	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](OC)C1CCCCC1	ZINC001018355616	1339588442	/nfs/dbraw/zinc/58/84/42/1339588442.db2.gz	QMKDBSXUDFPPLI-OTWHNJEPSA-N	0	3	334.504	3.223	20	30		EGEDHN
C[C@@H](N[C@H]1CCN(C(=O)c2ccc(C#N)[nH]2)C1)c1ccccc1Cl	ZINC001018724480	1339712896	/nfs/dbraw/zinc/71/28/96/1339712896.db2.gz	WQTWXSQAGANCRW-OCCSQVGLSA-N	0	3	342.830	3.105	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCCN2Cc2cccc(C)c2)cc1	ZINC001028066524	1340406126	/nfs/dbraw/zinc/40/61/26/1340406126.db2.gz	CKJLPKHACMMROM-NRFANRHFSA-N	0	3	332.447	3.371	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)[C@@H]1C[C@H]1c1c(F)cccc1F	ZINC001028123243	1340442227	/nfs/dbraw/zinc/44/22/27/1340442227.db2.gz	PHZROVUCNBUBDD-RRFJBIMHSA-N	0	3	334.410	3.225	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)c2sc3ccccc3c2C)C1	ZINC001028672524	1340751385	/nfs/dbraw/zinc/75/13/85/1340751385.db2.gz	JYFSCINDSUESDL-HNNXBMFYSA-N	0	3	326.465	3.285	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CCN(Cc3cnc(C)s3)C2)CC1	ZINC001028779024	1340810249	/nfs/dbraw/zinc/81/02/49/1340810249.db2.gz	SGHVSAOMYBMKMS-OAHLLOKOSA-N	0	3	333.501	3.136	20	30		EGEDHN
C=Cc1ccc(C(=O)NC[C@H]2CCN(Cc3cccc(C#N)c3)C2)cc1	ZINC001028822325	1340837698	/nfs/dbraw/zinc/83/76/98/1340837698.db2.gz	RQRQPIFGJZLSEJ-HXUWFJFHSA-N	0	3	345.446	3.453	20	30		EGEDHN
Cc1cc(C(=O)NC[C@H]2CCN(Cc3ccc(C#N)cc3)C2)cs1	ZINC001028867127	1340869176	/nfs/dbraw/zinc/86/91/76/1340869176.db2.gz	YRMWPBOESKIZOS-QGZVFWFLSA-N	0	3	339.464	3.180	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)C1CCN(C(=O)CCC2CC2)CC1	ZINC001029070415	1340922991	/nfs/dbraw/zinc/92/29/91/1340922991.db2.gz	NFKCKGBJIFHFCC-MRXNPFEDSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC([C@H](C)NCc2ccccc2C#N)CC1	ZINC001029126376	1340936110	/nfs/dbraw/zinc/93/61/10/1340936110.db2.gz	RGFXGKUNZCHNPW-INIZCTEOSA-N	0	3	339.483	3.487	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CCC([C@H](C)NCc2cc(F)ccc2C#N)CC1	ZINC001029129624	1340937783	/nfs/dbraw/zinc/93/77/83/1340937783.db2.gz	XVKPHBXGDUYOSV-SCLBCKFNSA-N	0	3	349.425	3.162	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC([C@H](C)NCc3cc(C)no3)CC2)CC1	ZINC001029136188	1340939633	/nfs/dbraw/zinc/93/96/33/1340939633.db2.gz	BAEDXGFFVZKMLI-INIZCTEOSA-N	0	3	345.487	3.446	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC([C@@H](C)NCc2cnc(C)cn2)CC1	ZINC001029139227	1340940509	/nfs/dbraw/zinc/94/05/09/1340940509.db2.gz	ATLGPVSPKZEKRW-UZLBHIALSA-N	0	3	344.503	3.104	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CC[C@@H](C1)N2CCC[C@@H]1CCOC1	ZINC001029456765	1340994346	/nfs/dbraw/zinc/99/43/46/1340994346.db2.gz	PQMHNRRDOHAIJX-FTEYMNFISA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H]3CC[C@@H](C2)N3CC[C@H]2CCCCO2)CC1	ZINC001029457567	1340994714	/nfs/dbraw/zinc/99/47/14/1340994714.db2.gz	OJDMVXSSRSCRSW-HSALFYBXSA-N	0	3	346.515	3.367	20	30		EGEDHN
C=C[C@H](C(=O)N1C[C@H]2CC[C@@H](C1)N2CC[C@H](C)F)c1ccccc1	ZINC001029594668	1341018383	/nfs/dbraw/zinc/01/83/83/1341018383.db2.gz	UCPRTJNWXCSSRV-KANFNMMFSA-N	0	3	330.447	3.380	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCN(C(=O)C2CCCC2)C1	ZINC001029621205	1341024105	/nfs/dbraw/zinc/02/41/05/1341024105.db2.gz	XQYIGMFAPKHQTN-AWEZNQCLSA-N	0	3	331.485	3.090	20	30		EGEDHN
Cc1cccc(Cl)c1CN(C)C[C@H]1CCN(C(=O)[C@H](C)C#N)C1	ZINC001029676487	1341040502	/nfs/dbraw/zinc/04/05/02/1341040502.db2.gz	BXANQOIQKZLMID-HUUCEWRRSA-N	0	3	333.863	3.088	20	30		EGEDHN
C[C@H](c1ccc(F)cc1F)N(C)C[C@@H]1CCN(C(=O)C#CC2CC2)C1	ZINC001029733137	1341057348	/nfs/dbraw/zinc/05/73/48/1341057348.db2.gz	GDHAGVSCWPJZAU-ZBFHGGJFSA-N	0	3	346.421	3.220	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H](CN(C)Cc2ocnc2C)C1	ZINC001029749006	1341062971	/nfs/dbraw/zinc/06/29/71/1341062971.db2.gz	QVQDJELFVVDESB-AWEZNQCLSA-N	0	3	339.867	3.042	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](CN(C)Cc2ccc(Cl)nc2)C1	ZINC001029800923	1341076856	/nfs/dbraw/zinc/07/68/56/1341076856.db2.gz	BXKXCZWOVXWWQP-OAHLLOKOSA-N	0	3	335.879	3.228	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](CN(C)Cc2ccc(Cl)nc2)C1	ZINC001029800922	1341076951	/nfs/dbraw/zinc/07/69/51/1341076951.db2.gz	BXKXCZWOVXWWQP-HNNXBMFYSA-N	0	3	335.879	3.228	20	30		EGEDHN
C#CCCN1CCC[C@@H](N(Cc2ccccc2)C(=O)c2ccccn2)C1	ZINC001029919083	1341119047	/nfs/dbraw/zinc/11/90/47/1341119047.db2.gz	OIIWLTPUMAWFGR-HXUWFJFHSA-N	0	3	347.462	3.212	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)CC1CCN(C(=O)C(C)(C)F)CC1	ZINC001029925406	1341122022	/nfs/dbraw/zinc/12/20/22/1341122022.db2.gz	SZYZVWACXGACSY-UHFFFAOYSA-N	0	3	337.464	3.038	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)CC1CCN(C(=O)C2=CCCC2)CC1	ZINC001029955974	1341134475	/nfs/dbraw/zinc/13/44/75/1341134475.db2.gz	AOBCHBKPYJPSCW-UHFFFAOYSA-N	0	3	343.496	3.400	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC(CN(C)Cc2cncc(F)c2)CC1	ZINC001029991422	1341148679	/nfs/dbraw/zinc/14/86/79/1341148679.db2.gz	YZDMSFGCSNRMME-HXUWFJFHSA-N	0	3	347.478	3.493	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC(CN(C)Cc2nccnc2C)CC1	ZINC001029992204	1341149050	/nfs/dbraw/zinc/14/90/50/1341149050.db2.gz	NZZATZWPGHCCHZ-FQEVSTJZSA-N	0	3	344.503	3.058	20	30		EGEDHN
C=CCn1cccc1C(=O)NCC1CN([C@H]2CCc3ccccc32)C1	ZINC001031733068	1341394846	/nfs/dbraw/zinc/39/48/46/1341394846.db2.gz	KVZSWIXNTMEYIN-IBGZPJMESA-N	0	3	335.451	3.023	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccnn1C(CC)CC	ZINC001032444398	1341511921	/nfs/dbraw/zinc/51/19/21/1341511921.db2.gz	XBAKEUUQMRMFGH-IRXDYDNUSA-N	0	3	330.476	3.109	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1C[C@@H]2C[C@H]1CN2CC1CC(C)C1	ZINC001032484455	1341521197	/nfs/dbraw/zinc/52/11/97/1341521197.db2.gz	SZXOIOMAEAJOFC-FOIPXRHGSA-N	0	3	340.467	3.196	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C[C@@H]1CCOc2ccccc21	ZINC001032559142	1341540358	/nfs/dbraw/zinc/54/03/58/1341540358.db2.gz	VARMSSUGTDMHCT-BZSNNMDCSA-N	0	3	340.467	3.194	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H]3C[C@H]2CN3C[C@@H](OC)C2CCCC2)CC1	ZINC001032605662	1341555989	/nfs/dbraw/zinc/55/59/89/1341555989.db2.gz	FMRGRULBLGSEMW-SLFFLAALSA-N	0	3	346.515	3.223	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H](CC)Cc1cccc(C)c1	ZINC001032667107	1341576400	/nfs/dbraw/zinc/57/64/00/1341576400.db2.gz	SQFZNOXHQFDWEP-AABGKKOBSA-N	0	3	326.484	3.425	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc2nc(C)sc2c1	ZINC001032714627	1341588952	/nfs/dbraw/zinc/58/89/52/1341588952.db2.gz	PNRNOGHZDZXTMW-HOTGVXAUSA-N	0	3	341.480	3.470	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H](C)Oc1ccc(C)cc1	ZINC001032769742	1341608829	/nfs/dbraw/zinc/60/88/29/1341608829.db2.gz	WUBVAMKRHYSCCL-BZSNNMDCSA-N	0	3	328.456	3.014	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cc2c(cccc2OC)[nH]1	ZINC001032779868	1341612333	/nfs/dbraw/zinc/61/23/33/1341612333.db2.gz	MIJQSKINOGIRRW-GJZGRUSLSA-N	0	3	339.439	3.041	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H](C)Cc1ccccc1C	ZINC001032807989	1341621030	/nfs/dbraw/zinc/62/10/30/1341621030.db2.gz	GQNWDWFLJZOSER-HOJAQTOUSA-N	0	3	326.484	3.425	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)C[C@@H]2C[C@H]2c2ccc(OC)cc2)C1	ZINC001033166376	1341743083	/nfs/dbraw/zinc/74/30/83/1341743083.db2.gz	SXSQHGMUPFCMFR-NSHGMRRFSA-N	0	3	342.483	3.298	20	30		EGEDHN
C#CCCN1CC[C@H](N(C)C(=O)c2cc(C3CC3)oc2C2CC2)C1	ZINC001033282705	1341766903	/nfs/dbraw/zinc/76/69/03/1341766903.db2.gz	JZAMLWQAVUFUDP-INIZCTEOSA-N	0	3	326.440	3.204	20	30		EGEDHN
C=C1CCC(C(=O)N(C)[C@@H]2CCN(C[C@@H]3CC(C)(C)CO3)C2)CC1	ZINC001033388282	1341807447	/nfs/dbraw/zinc/80/74/47/1341807447.db2.gz	AVRMKZBFZFKNSG-MSOLQXFVSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@@H]2CCN(CCc3ccc(OC)cc3)C2)C1	ZINC001033393871	1341810759	/nfs/dbraw/zinc/81/07/59/1341810759.db2.gz	MCLVPHIZTCWWCD-GOSISDBHSA-N	0	3	342.483	3.127	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@@H]2CCN(C[C@@H](OC)c3ccccc3)C2)C1	ZINC001033400073	1341813726	/nfs/dbraw/zinc/81/37/26/1341813726.db2.gz	SMPHEWOCQMMOSK-RTBURBONSA-N	0	3	342.483	3.263	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2ccccc2OCC(C)C)C1	ZINC001033511947	1341852967	/nfs/dbraw/zinc/85/29/67/1341852967.db2.gz	OKNGGEZBYSPCJG-QGZVFWFLSA-N	0	3	330.472	3.444	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@@H]2CCN(Cc3ccc(C)c(C)c3)C2)cn1	ZINC001033598262	1341890609	/nfs/dbraw/zinc/89/06/09/1341890609.db2.gz	IIXWNEZKSCMLKD-OAQYLSRUSA-N	0	3	347.462	3.026	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2ccc(OC3CCC3)cc2)C1	ZINC001033674564	1341940302	/nfs/dbraw/zinc/94/03/02/1341940302.db2.gz	AKMRYFQSOJZCQV-KRWDZBQOSA-N	0	3	328.456	3.340	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cn(C(C)(C)C)nc2C)C1	ZINC001033828570	1342029153	/nfs/dbraw/zinc/02/91/53/1342029153.db2.gz	QCRPCXFUAZUIMP-MRXNPFEDSA-N	0	3	332.492	3.059	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)[C@@H]2C[C@H]2c2sccc2C)C1	ZINC001033838028	1342035784	/nfs/dbraw/zinc/03/57/84/1342035784.db2.gz	VWSHGYSIDGNYTM-BRWVUGGUSA-N	0	3	330.497	3.106	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@@H]2CCc3ccc(OC)cc32)C1	ZINC001033860650	1342048947	/nfs/dbraw/zinc/04/89/47/1342048947.db2.gz	GLRKMVHOBUWZGM-PKOBYXMFSA-N	0	3	342.483	3.224	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@@H]2C[C@]2(C)c2ccccc2)C1	ZINC001033900044	1342071307	/nfs/dbraw/zinc/07/13/07/1342071307.db2.gz	MDXLRNYCWDVFQQ-SVFBPWRDSA-N	0	3	326.484	3.463	20	30		EGEDHN
C#CCOc1ccc(C(=O)N(CC)[C@H]2CCN(CC=C(C)C)C2)cc1	ZINC001033976666	1342125665	/nfs/dbraw/zinc/12/56/65/1342125665.db2.gz	IFZOWAKATMGTEC-IBGZPJMESA-N	0	3	340.467	3.201	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cc(OC)c(C)c(OC)c2)C1	ZINC001034036079	1342174586	/nfs/dbraw/zinc/17/45/86/1342174586.db2.gz	OHLUBDPXEIXXQR-KRWDZBQOSA-N	0	3	346.471	3.125	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2ccc(CC(C)C)cc2)C1	ZINC001034040418	1342180710	/nfs/dbraw/zinc/18/07/10/1342180710.db2.gz	VJLANBHYCNJGNK-FQEVSTJZSA-N	0	3	326.484	3.445	20	30		EGEDHN
C=CCCN1CC[C@@H](N(CC)C(=O)c2cnc(CC(C)C)s2)C1	ZINC001034050766	1342191427	/nfs/dbraw/zinc/19/14/27/1342191427.db2.gz	FQESNANAUVACAD-OAHLLOKOSA-N	0	3	335.517	3.454	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@@H]2Cc3c2cccc3Cl)C1	ZINC001034051631	1342193989	/nfs/dbraw/zinc/19/39/89/1342193989.db2.gz	XQORKNQHWACBBQ-WMLDXEAASA-N	0	3	332.875	3.479	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)C1	ZINC001034053670	1342194667	/nfs/dbraw/zinc/19/46/67/1342194667.db2.gz	VBLHQNPSJQDPEI-CEXWTWQISA-N	0	3	330.447	3.428	20	30		EGEDHN
C=CCCN1CCCC[C@H](NC(=O)c2cnc(CC3CC3)s2)C1	ZINC001034320316	1342397488	/nfs/dbraw/zinc/39/74/88/1342397488.db2.gz	WPXCOXGZDOKITC-HNNXBMFYSA-N	0	3	333.501	3.256	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2ccc(C)nc2C(C)C)C1	ZINC001034335588	1342410565	/nfs/dbraw/zinc/41/05/65/1342410565.db2.gz	WCPWPNQFPFFRDU-KRWDZBQOSA-N	0	3	327.472	3.121	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)C2(c3cccc(F)c3)CCC2)C1	ZINC001034336093	1342410809	/nfs/dbraw/zinc/41/08/09/1342410809.db2.gz	IVRARKNWNSFGSK-SFHVURJKSA-N	0	3	330.447	3.404	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc(C3CC3)nc2C)C1	ZINC001034407939	1342470385	/nfs/dbraw/zinc/47/03/85/1342470385.db2.gz	WUHPBJBGUZVGKE-KRWDZBQOSA-N	0	3	327.472	3.428	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@@H]2CCc3ccccc3C2)C1	ZINC001034413793	1342475560	/nfs/dbraw/zinc/47/55/60/1342475560.db2.gz	QCNFVTILUPAYGH-WOJBJXKFSA-N	0	3	326.484	3.338	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2cc(C(CC)CC)no2)C1	ZINC001034428203	1342490618	/nfs/dbraw/zinc/49/06/18/1342490618.db2.gz	KLSGLDHIDBKTOU-INIZCTEOSA-N	0	3	331.460	3.186	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)Cc2c[nH]c3cc(C)ccc23)C1	ZINC001034439958	1342501120	/nfs/dbraw/zinc/50/11/20/1342501120.db2.gz	RXLTUOQBYBSWEC-KRWDZBQOSA-N	0	3	325.456	3.176	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccccc2NC(=O)CC)C1	ZINC001034450801	1342510596	/nfs/dbraw/zinc/51/05/96/1342510596.db2.gz	MBNHQHVOGGJXPE-MRXNPFEDSA-N	0	3	343.471	3.196	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccnc(C3CCCC3)n2)C1	ZINC001034465415	1342520918	/nfs/dbraw/zinc/52/09/18/1342520918.db2.gz	PJKUBLKOOVHGEJ-QGZVFWFLSA-N	0	3	342.487	3.295	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2ccc3nc(C)sc3c2)C1	ZINC001034472172	1342526710	/nfs/dbraw/zinc/52/67/10/1342526710.db2.gz	RKGOETBKHIWMGO-MRXNPFEDSA-N	0	3	341.480	3.212	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)Cc2c[nH]c3cccc(C)c23)C1	ZINC001034492345	1342548003	/nfs/dbraw/zinc/54/80/03/1342548003.db2.gz	CHGOMFMFADGOCC-QGZVFWFLSA-N	0	3	325.456	3.176	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)c2ccc(COC(C)C)cc2)C1	ZINC001034519340	1342577681	/nfs/dbraw/zinc/57/76/81/1342577681.db2.gz	HYONYDLMQGZTKJ-LJQANCHMSA-N	0	3	330.472	3.382	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2cc3c(s2)CC[C@H](C)C3)C1	ZINC001034522693	1342580851	/nfs/dbraw/zinc/58/08/51/1342580851.db2.gz	VTZDCFWRGACQKZ-RDJZCZTQSA-N	0	3	344.524	3.481	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)c2ccc(OC3CCC3)cc2)C1	ZINC001034531136	1342586686	/nfs/dbraw/zinc/58/66/86/1342586686.db2.gz	FGHLESCUOMAMIE-KRWDZBQOSA-N	0	3	328.456	3.388	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc(N(C)CC)cc2)C1	ZINC001034546556	1342609171	/nfs/dbraw/zinc/60/91/71/1342609171.db2.gz	HRWIOEVZXPRSFI-GOSISDBHSA-N	0	3	329.488	3.303	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2cscc2C(F)(F)F)C1	ZINC001034559656	1342618505	/nfs/dbraw/zinc/61/85/05/1342618505.db2.gz	SGPUEJWORSMYFC-LBPRGKRZSA-N	0	3	344.402	3.375	20	30		EGEDHN
N#Cc1ccc(F)cc1CN[C@H]1CC[C@H](NC(=O)C2CCC2)CC1	ZINC001034577507	1342623403	/nfs/dbraw/zinc/62/34/03/1342623403.db2.gz	KURUXAZLHVIFKF-IYARVYRRSA-N	0	3	329.419	3.014	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)[C@H](C)C2CCC2)CC1	ZINC001034670403	1342681095	/nfs/dbraw/zinc/68/10/95/1342681095.db2.gz	SRQQCODFPPWMQA-BPLDGKMQSA-N	0	3	343.309	3.348	20	30		EGEDHN
Cc1cc(C(=O)N[C@H]2CC[C@H](NCc3ccccc3C#N)CC2)ccn1	ZINC001034757797	1342741078	/nfs/dbraw/zinc/74/10/78/1342741078.db2.gz	BIHVBYFLNHKWEV-MXVIHJGJSA-N	0	3	348.450	3.093	20	30		EGEDHN
N#Cc1cccc(CNCc2ccc(CNC(=O)[C@H]3CC34CC4)cc2)c1	ZINC001034827375	1342788338	/nfs/dbraw/zinc/78/83/38/1342788338.db2.gz	WYWSGEORMNITRO-HXUWFJFHSA-N	0	3	345.446	3.264	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc(N(C)C)cc2)C12CCC2	ZINC001078795545	1357088968	/nfs/dbraw/zinc/08/89/68/1357088968.db2.gz	RSRAJLJILCVPGL-IRXDYDNUSA-N	0	3	347.890	3.136	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)/C=C/c2ccco2)s1	ZINC001034845083	1342797347	/nfs/dbraw/zinc/79/73/47/1342797347.db2.gz	FITKAHNSQBOGCX-LHRNQBEKSA-N	0	3	341.436	3.007	20	30		EGEDHN
Cc1ccccc1C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)s1	ZINC001034846106	1342798559	/nfs/dbraw/zinc/79/85/59/1342798559.db2.gz	HGFDOLZKALBERZ-OAHLLOKOSA-N	0	3	339.464	3.323	20	30		EGEDHN
COc1ccc(C#N)cc1CNC[C@H]1CCCN1C(=O)CC(C)(C)C	ZINC001034860933	1342809990	/nfs/dbraw/zinc/80/99/90/1342809990.db2.gz	GGRAYVZUOPXNEG-QGZVFWFLSA-N	0	3	343.471	3.084	20	30		EGEDHN
CC1(C)CC[C@H]1C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001035023233	1342882308	/nfs/dbraw/zinc/88/23/08/1342882308.db2.gz	YNGKOWOJFGXEIG-SJORKVTESA-N	0	3	343.446	3.214	20	30		EGEDHN
CC(C)(C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)cc1F)C1CC1	ZINC001035023365	1342882362	/nfs/dbraw/zinc/88/23/62/1342882362.db2.gz	BGJPNRUWQSQAPJ-QGZVFWFLSA-N	0	3	343.446	3.214	20	30		EGEDHN
CC(C)(F)C(=O)N1CCC2(CCN(CC#Cc3ccccc3)C2)CC1	ZINC001035149259	1342960634	/nfs/dbraw/zinc/96/06/34/1342960634.db2.gz	CMGVNZBAIIKSOF-UHFFFAOYSA-N	0	3	342.458	3.101	20	30		EGEDHN
CCCC(=O)N1CCC2(CCN(Cc3ccc(C#N)c(F)c3)C2)CC1	ZINC001035149049	1342961515	/nfs/dbraw/zinc/96/15/15/1342961515.db2.gz	XDYWWHWLSBGRMQ-UHFFFAOYSA-N	0	3	343.446	3.312	20	30		EGEDHN
C[C@H]1C[C@H]1C(=O)N1CCC2(CCN(Cc3ccc(C#N)s3)C2)CC1	ZINC001035156160	1342972789	/nfs/dbraw/zinc/97/27/89/1342972789.db2.gz	JIUABBTWRLDEQJ-WMLDXEAASA-N	0	3	343.496	3.090	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC2(CCN(Cc3ccccc3Cl)C2)CC1	ZINC001035167995	1342984812	/nfs/dbraw/zinc/98/48/12/1342984812.db2.gz	QEJHSOPDBFPAFU-HNNXBMFYSA-N	0	3	345.874	3.314	20	30		EGEDHN
Cc1cc(CN2CC3(C2)CCN(C(=O)C#CC2CC2)CC3)c(C)s1	ZINC001035701092	1343142356	/nfs/dbraw/zinc/14/23/56/1343142356.db2.gz	NYUWYFQAEQJXKK-UHFFFAOYSA-N	0	3	342.508	3.203	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C1([C@H]3CCCCO3)CCC1)CC2	ZINC001035747722	1343167483	/nfs/dbraw/zinc/16/74/83/1343167483.db2.gz	BHDFILDLOYJZOI-GOSISDBHSA-N	0	3	346.515	3.226	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)Cc1c(C)cc(C)cc1C)CC2	ZINC001035785727	1343196587	/nfs/dbraw/zinc/19/65/87/1343196587.db2.gz	LCEIDEXERKORFQ-UHFFFAOYSA-N	0	3	338.495	3.102	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@H](c1ccccc1)C(C)C)CC2	ZINC001035803806	1343206463	/nfs/dbraw/zinc/20/64/63/1343206463.db2.gz	KNABGWDWJMFWRW-FQEVSTJZSA-N	0	3	338.495	3.374	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccn(C(CC)CC)n1)CC2	ZINC001035810502	1343210159	/nfs/dbraw/zinc/21/01/59/1343210159.db2.gz	NDGSACMDMHMZPH-UHFFFAOYSA-N	0	3	344.503	3.358	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1CCC2(CN(CC=C(C)C)C2)CC1	ZINC001035842759	1343224811	/nfs/dbraw/zinc/22/48/11/1343224811.db2.gz	DTSMDTBERKZGRJ-UHFFFAOYSA-N	0	3	336.479	3.101	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)CCc1ccccc1F)CC2	ZINC001035849700	1343229820	/nfs/dbraw/zinc/22/98/20/1343229820.db2.gz	KRQOPYACIPIOAP-UHFFFAOYSA-N	0	3	330.447	3.259	20	30		EGEDHN
C[C@H]1CN(C(=O)c2ccccc2)CC[C@@H]1NCc1ccccc1C#N	ZINC001035885937	1343248362	/nfs/dbraw/zinc/24/83/62/1343248362.db2.gz	CXNNCTVLBJWKOV-JXFKEZNVSA-N	0	3	333.435	3.199	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCC2CC2)CC[C@@H]1NCc1cc(F)ccc1C#N	ZINC001035969216	1343292746	/nfs/dbraw/zinc/29/27/46/1343292746.db2.gz	UAOMXXZJYZUZIU-KUHUBIRLSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@H]1CN(C(=O)C2(C)CCC2)CC[C@@H]1NCc1cc(F)ccc1C#N	ZINC001036139852	1343324423	/nfs/dbraw/zinc/32/44/23/1343324423.db2.gz	AWYMIEISUGIKNV-KSSFIOAISA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@H]1CN(C(=O)C(C)(C)C(F)F)CC[C@@H]1NCc1ccccc1C#N	ZINC001036167684	1343340649	/nfs/dbraw/zinc/34/06/49/1343340649.db2.gz	BQTUJUCDDCZBTC-BBRMVZONSA-N	0	3	349.425	3.176	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3cnc(C)o3)[C@@H](C)C2)CC1	ZINC001036174600	1343346974	/nfs/dbraw/zinc/34/69/74/1343346974.db2.gz	PUNGFIBEEJXEQW-KBXCAEBGSA-N	0	3	331.460	3.056	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@H](NCc2ccccc2C#N)[C@H](C)C1	ZINC001036175678	1343347241	/nfs/dbraw/zinc/34/72/41/1343347241.db2.gz	SOPLVKQIYGGVJG-QAPCUYQASA-N	0	3	327.472	3.321	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@H]([C@@H](C)NCc2ccccc2C#N)C1	ZINC001036343935	1343430665	/nfs/dbraw/zinc/43/06/65/1343430665.db2.gz	JKRVZCFGFLPTPH-APWZRJJASA-N	0	3	327.472	3.321	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@H]([C@@H](C)NCc3cnns3)C2)CC1	ZINC001036431675	1343483145	/nfs/dbraw/zinc/48/31/45/1343483145.db2.gz	UQRNISMIKOKZJG-ZBFHGGJFSA-N	0	3	348.516	3.001	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H]([C@@H](C)NCc2nccn2CC)C1	ZINC001036444323	1343491832	/nfs/dbraw/zinc/49/18/32/1343491832.db2.gz	YPEZCFWAWXFETO-SJORKVTESA-N	0	3	346.519	3.222	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCCN(C(=O)C2(CF)CC2)C1	ZINC001036450350	1343494550	/nfs/dbraw/zinc/49/45/50/1343494550.db2.gz	KSDDSUHRDLBISZ-CRAIPNDOSA-N	0	3	343.446	3.025	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)C(C)(C)F)[C@H]1CNCc1ccc(C#N)s1	ZINC001036501678	1343520058	/nfs/dbraw/zinc/52/00/58/1343520058.db2.gz	POTOLUJQGONRFC-DOMZBBRYSA-N	0	3	337.464	3.085	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@H](C)[C@H]1CNCc1cc(C#N)ccc1F	ZINC001036510749	1343526859	/nfs/dbraw/zinc/52/68/59/1343526859.db2.gz	QRASJHBFSLAGRN-KBXCAEBGSA-N	0	3	331.435	3.070	20	30		EGEDHN
O=C(C1CCCC1)N1CC[C@@H]2[C@@H](CCN2CC#Cc2ccccc2)C1	ZINC001036621543	1343580472	/nfs/dbraw/zinc/58/04/72/1343580472.db2.gz	VIQFXHSMMJHBNX-LEWJYISDSA-N	0	3	336.479	3.151	20	30		EGEDHN
O=C(C1CCCC1)N1CC[C@H]2[C@@H](CCN2CC#Cc2ccccc2)C1	ZINC001036621546	1343580475	/nfs/dbraw/zinc/58/04/75/1343580475.db2.gz	VIQFXHSMMJHBNX-SFTDATJTSA-N	0	3	336.479	3.151	20	30		EGEDHN
C/C=C(/C)C(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccc(C#N)cc2F)C1	ZINC001036682867	1343624545	/nfs/dbraw/zinc/62/45/45/1343624545.db2.gz	KQTWFYKUEVDYCO-AZDZRYJGSA-N	0	3	341.430	3.086	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccccc2C#N)C1	ZINC001036789873	1343719225	/nfs/dbraw/zinc/71/92/25/1343719225.db2.gz	YXFLNTREQUBNNK-RBUKOAKNSA-N	0	3	337.467	3.193	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H]3[C@@H](CCN3Cc3cc(C)no3)C2)CC1	ZINC001036810707	1343746416	/nfs/dbraw/zinc/74/64/16/1343746416.db2.gz	GZRZEFULFZWZET-HKUYNNGSSA-N	0	3	343.471	3.152	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@@H]1CCC[C@@H]1NC(=O)CC1CCC1	ZINC001036971000	1343900289	/nfs/dbraw/zinc/90/02/89/1343900289.db2.gz	VDXAOAHNIQOVOS-LPHOPBHVSA-N	0	3	343.446	3.262	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCC[C@@H]1NC(=O)c1ccco1	ZINC001037145522	1343995348	/nfs/dbraw/zinc/99/53/48/1343995348.db2.gz	CQZBWUZUMQRYGL-MSOLQXFVSA-N	0	3	337.423	3.230	20	30		EGEDHN
C/C=C(/C)C(=O)N1CC[C@H](NCc2cc(F)ccc2C#N)[C@@H](CC)C1	ZINC001037822106	1344118661	/nfs/dbraw/zinc/11/86/61/1344118661.db2.gz	MSZPZRZZIFBXNS-OELZBGSDSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3cc(C)no3)[C@@H](CC)C2)CC1	ZINC001037924879	1344184255	/nfs/dbraw/zinc/18/42/55/1344184255.db2.gz	MDEOAOBKIIKUES-QFBILLFUSA-N	0	3	345.487	3.446	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1ncoc1-c1cccs1	ZINC001038818489	1344595887	/nfs/dbraw/zinc/59/58/87/1344595887.db2.gz	RWMVUJIRZVLYDV-CYBMUJFWSA-N	0	3	331.441	3.173	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1cccc(-c2cnco2)c1	ZINC001038878106	1344625937	/nfs/dbraw/zinc/62/59/37/1344625937.db2.gz	KSQFPTKARXTWFU-KRWDZBQOSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1ccccc1C(F)(F)F	ZINC001038945572	1344669057	/nfs/dbraw/zinc/66/90/57/1344669057.db2.gz	QDTQXFSILSXGJV-CYBMUJFWSA-N	0	3	326.362	3.476	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C2CC(C)(C)C2)CC[C@H]1c1ccc(F)cc1	ZINC001079152555	1357197962	/nfs/dbraw/zinc/19/79/62/1357197962.db2.gz	QZXWIKMTBADRIS-RBUKOAKNSA-N	0	3	342.458	3.169	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1cc(F)c(F)cc1Cl	ZINC001038984811	1344698320	/nfs/dbraw/zinc/69/83/20/1344698320.db2.gz	DPWQGYLDGOOACI-LLVKDONJSA-N	0	3	328.790	3.389	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1ccc(OC2CCC2)cc1	ZINC001039045233	1344731734	/nfs/dbraw/zinc/73/17/34/1344731734.db2.gz	FIHLGVCSZMHQLO-QGZVFWFLSA-N	0	3	328.456	3.388	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)c3cccnc3)CC2)C1	ZINC001039109119	1344780636	/nfs/dbraw/zinc/78/06/36/1344780636.db2.gz	NVNVGUJHSPUXKF-QGZVFWFLSA-N	0	3	333.863	3.008	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)c3[nH]ccc3C)CC2)C1	ZINC001039119911	1344793519	/nfs/dbraw/zinc/79/35/19/1344793519.db2.gz	GDWDNKHVAKNQMG-INIZCTEOSA-N	0	3	335.879	3.250	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)c3ccncc3C)CC2)C1	ZINC001039120386	1344794750	/nfs/dbraw/zinc/79/47/50/1344794750.db2.gz	JPTSULCYIWLSOV-KRWDZBQOSA-N	0	3	347.890	3.317	20	30		EGEDHN
CC(C)C(=O)N1CCCC[C@H]1[C@@H]1CCN(CC#Cc2ccccc2)C1	ZINC001039185240	1344884352	/nfs/dbraw/zinc/88/43/52/1344884352.db2.gz	DPSSKXQCSUQNCM-RTWAWAEBSA-N	0	3	338.495	3.397	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cccc(C)c2F)C1	ZINC001039210209	1344923490	/nfs/dbraw/zinc/92/34/90/1344923490.db2.gz	OPTCMDFSOHGJRZ-MJGOQNOKSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cccc(C)c2F)C1	ZINC001039213058	1344928517	/nfs/dbraw/zinc/92/85/17/1344928517.db2.gz	ZRGALQAPKNSDMS-WMZOPIPTSA-N	0	3	328.431	3.084	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc(Cl)ccc2F)C1	ZINC001039213871	1344929271	/nfs/dbraw/zinc/92/92/71/1344929271.db2.gz	BQLOVNHBBHTATD-RDTXWAMCSA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2scnc2CC)C1	ZINC001039216382	1344932975	/nfs/dbraw/zinc/93/29/75/1344932975.db2.gz	ZWWPVZBIYKRCLN-NVXWUHKLSA-N	0	3	345.512	3.045	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cccc(C(C)C)n2)C1	ZINC001039218184	1344935923	/nfs/dbraw/zinc/93/59/23/1344935923.db2.gz	KYBJUGYJMQHOFQ-XLIONFOSSA-N	0	3	339.483	3.155	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2c(C)coc2C)C1	ZINC001039221125	1344938627	/nfs/dbraw/zinc/93/86/27/1344938627.db2.gz	KPERNYPXYXLATJ-ZWKOTPCHSA-N	0	3	328.456	3.236	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccc3ncccc3c2)C1	ZINC001039224498	1344942214	/nfs/dbraw/zinc/94/22/14/1344942214.db2.gz	GSEGQPVKWRZBJF-TZIWHRDSSA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2occc2CC)C1	ZINC001039227342	1344946063	/nfs/dbraw/zinc/94/60/63/1344946063.db2.gz	CWWCSWMGGTZMIC-MSOLQXFVSA-N	0	3	328.456	3.182	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)Cc2cccc(Cl)c2)C1	ZINC001039229823	1344949114	/nfs/dbraw/zinc/94/91/14/1344949114.db2.gz	MUVCXQQQPDQVJK-PKOBYXMFSA-N	0	3	344.886	3.219	20	30		EGEDHN
C=C1CCC(C(=O)N2CCCC[C@@H]2[C@H]2CCN(CC#CC)C2)CC1	ZINC001039233051	1344952439	/nfs/dbraw/zinc/95/24/39/1344952439.db2.gz	ZMDLYGDRKDLYQP-VQTJNVASSA-N	0	3	328.500	3.459	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)Cc2cccc(F)c2)C1	ZINC001039240327	1344964697	/nfs/dbraw/zinc/96/46/97/1344964697.db2.gz	UAEDUUCFVSLKKM-QUCCMNQESA-N	0	3	342.458	3.095	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc(F)cc(Cl)c2)C1	ZINC001039240550	1344965315	/nfs/dbraw/zinc/96/53/15/1344965315.db2.gz	XZARZRBZHPMSTR-KBXCAEBGSA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)Cc2ccc(Cl)cc2)C1	ZINC001039250043	1344980326	/nfs/dbraw/zinc/98/03/26/1344980326.db2.gz	MLLMTZRPCKKYLX-HKUYNNGSSA-N	0	3	344.886	3.219	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2c(C)nsc2C)C1	ZINC001039251907	1344983373	/nfs/dbraw/zinc/98/33/73/1344983373.db2.gz	WQAONAHWRCLSKB-IRXDYDNUSA-N	0	3	345.512	3.100	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@H]2CC[C@@H](C1)N2C(=O)c1c[nH]c(C#N)c1	ZINC001039366017	1345030342	/nfs/dbraw/zinc/03/03/42/1345030342.db2.gz	KXDXWTOCNBJZEQ-BEVDRBHNSA-N	0	3	348.450	3.326	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CCCc2ccccc21	ZINC001039394766	1345043945	/nfs/dbraw/zinc/04/39/45/1345043945.db2.gz	IISVJJISIMCUFF-SVFBPWRDSA-N	0	3	336.479	3.195	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc(C(F)F)cc1	ZINC001039403682	1345049591	/nfs/dbraw/zinc/04/95/91/1345049591.db2.gz	JBOOQNQQBWOZRI-SJORKVTESA-N	0	3	334.410	3.418	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2c(c1)[C@@H](C)CO2	ZINC001039421341	1345060029	/nfs/dbraw/zinc/06/00/29/1345060029.db2.gz	AVOGXVAOTZWCBO-JQHSSLGASA-N	0	3	340.467	3.438	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1CCc2ccccc2C1	ZINC001039443026	1345069026	/nfs/dbraw/zinc/06/90/26/1345069026.db2.gz	FWFFFQWBXHKAPN-HBMCJLEFSA-N	0	3	338.495	3.433	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC(N(Cc2nocc2C)CC2CC2)CC1	ZINC001039487206	1345106500	/nfs/dbraw/zinc/10/65/00/1345106500.db2.gz	CMPNELBWRBWXPS-UHFFFAOYSA-N	0	3	345.487	3.398	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CCC[C@@H](C1)N2CCC1CCOCC1	ZINC001039820407	1345199259	/nfs/dbraw/zinc/19/92/59/1345199259.db2.gz	GTLWQFIYHPQEFN-HDICACEKSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N1C[C@H]2CCC[C@@H](C1)N2CCC1CC1	ZINC001039941508	1345254164	/nfs/dbraw/zinc/25/41/64/1345254164.db2.gz	WHQWSQZYDIEOOA-YRPNKDGESA-N	0	3	346.515	3.223	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@@H]3C[C@H]3CC(C)(C)C)C2)C1	ZINC001040211550	1345377383	/nfs/dbraw/zinc/37/73/83/1345377383.db2.gz	XDUSWBUEJMNUKZ-UEXGIBASSA-N	0	3	330.516	3.397	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@]3(CCN(C(=O)c4cc[nH]c4)C3)C2)c1	ZINC001040222680	1345382180	/nfs/dbraw/zinc/38/21/80/1345382180.db2.gz	GWDJKXBCTJMZFM-NRFANRHFSA-N	0	3	348.450	3.015	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)C3(c4ccccc4)CCC3)C2)C1	ZINC001040284155	1345411663	/nfs/dbraw/zinc/41/16/63/1345411663.db2.gz	SHPXNCZWZQWRIH-NRFANRHFSA-N	0	3	336.479	3.056	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cc4c(cn3)CCCC4)C2)C1	ZINC001040289295	1345413370	/nfs/dbraw/zinc/41/33/70/1345413370.db2.gz	NRICPAYESAIKKT-NRFANRHFSA-N	0	3	339.483	3.075	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@@H](c3ccccc3)C3CC3)C2)C1	ZINC001040289090	1345413766	/nfs/dbraw/zinc/41/37/66/1345413766.db2.gz	CCNZHOBQEIJLEB-RBBKRZOGSA-N	0	3	336.479	3.128	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)Cc3cccc(C)c3Cl)C2)C1	ZINC001040290802	1345414365	/nfs/dbraw/zinc/41/43/65/1345414365.db2.gz	HBUDGYZGZVFSEZ-HXUWFJFHSA-N	0	3	344.886	3.139	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@@H](C)c3c(F)cccc3F)C2)C1	ZINC001040292072	1345416128	/nfs/dbraw/zinc/41/61/28/1345416128.db2.gz	KQZMFCCBNNYYLB-YWZLYKJASA-N	0	3	346.421	3.016	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CC[C@]2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001040327802	1345434242	/nfs/dbraw/zinc/43/42/42/1345434242.db2.gz	IFDSTDDTQVEXMO-UYAOXDASSA-N	0	3	343.446	3.121	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3c(C)cc(F)cc3C)C2)C1	ZINC001040330267	1345436075	/nfs/dbraw/zinc/43/60/75/1345436075.db2.gz	BABPRVUNLAEPST-OAQYLSRUSA-N	0	3	342.458	3.394	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cc(F)c(F)cc3F)C2)C1	ZINC001040353127	1345449312	/nfs/dbraw/zinc/44/93/12/1345449312.db2.gz	GFCWIJAIACGARN-GOSISDBHSA-N	0	3	338.373	3.218	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)C3(C(F)F)CCCC3)C2)C1	ZINC001040353605	1345449693	/nfs/dbraw/zinc/44/96/93/1345449693.db2.gz	JUTMHVNOVCMYSD-GOSISDBHSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cc(Cl)cs3)C2)C1	ZINC001040431770	1345494935	/nfs/dbraw/zinc/49/49/35/1345494935.db2.gz	KSWQTVBNIWKYDL-KRWDZBQOSA-N	0	3	336.888	3.353	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ccc4cnccc4c3)C2)C1	ZINC001040485184	1345515826	/nfs/dbraw/zinc/51/58/26/1345515826.db2.gz	XOOIGKJMLAXXAH-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cc(C)c(CC)o3)C2)C1	ZINC001040492840	1345518830	/nfs/dbraw/zinc/51/88/30/1345518830.db2.gz	VTKQWJWOMCUZDD-HXUWFJFHSA-N	0	3	328.456	3.102	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)C(C)(C)c3ccccc3C)C2)C1	ZINC001040553050	1345544165	/nfs/dbraw/zinc/54/41/65/1345544165.db2.gz	RLPSCBOLXLWYGN-JOCHJYFZSA-N	0	3	338.495	3.220	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@@H]3C[C@H]3c3sccc3C)C2)CC1	ZINC001040704068	1345567513	/nfs/dbraw/zinc/56/75/13/1345567513.db2.gz	SZKDFADKMZLZLB-IAGOWNOFSA-N	0	3	342.508	3.108	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cc4ccsc4[nH]3)C2)CC1	ZINC001040796554	1345578820	/nfs/dbraw/zinc/57/88/20/1345578820.db2.gz	YVRIHDPABKVSBI-UHFFFAOYSA-N	0	3	341.480	3.181	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccc4ccncc4c3)C2)CC1	ZINC001040906998	1345597694	/nfs/dbraw/zinc/59/76/94/1345597694.db2.gz	MTEAGXYEQUBPEX-UHFFFAOYSA-N	0	3	347.462	3.186	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccoc3C(C)C)C2)CC1	ZINC001040950790	1345607764	/nfs/dbraw/zinc/60/77/64/1345607764.db2.gz	CBKIFBWTMORDGU-UHFFFAOYSA-N	0	3	328.456	3.354	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccc(C(C)(F)F)cc3)C2)CC1	ZINC001040961939	1345611178	/nfs/dbraw/zinc/61/11/78/1345611178.db2.gz	UHBCTTTZXKVZTC-UHFFFAOYSA-N	0	3	346.421	3.360	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@]3(CCN(C(=O)[C@H]4[C@@H]5CCC[C@@H]54)C3)C2)c1	ZINC001041177314	1345667542	/nfs/dbraw/zinc/66/75/42/1345667542.db2.gz	FZRWSUIBPOTMTH-FCIYXJNOSA-N	0	3	349.478	3.029	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@]3(CCN(C(=O)C=C4CCC4)C3)C2)cc1	ZINC001041201666	1345677305	/nfs/dbraw/zinc/67/73/05/1345677305.db2.gz	UHNJYZVKOZWOBK-NRFANRHFSA-N	0	3	335.451	3.093	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N1CC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001041220564	1345681125	/nfs/dbraw/zinc/68/11/25/1345681125.db2.gz	XKLBCGYLRWNUHG-RXVVDRJESA-N	0	3	337.467	3.029	20	30		EGEDHN
C=CCN1CC[C@]2(CCN(C(=O)c3snc(Cl)c3Cl)C2)C1	ZINC001041323810	1345703016	/nfs/dbraw/zinc/70/30/16/1345703016.db2.gz	POFGKJNQQCAANU-AWEZNQCLSA-N	0	3	346.283	3.174	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3cc(Cl)sc3Cl)C2)C1	ZINC001041356620	1345709097	/nfs/dbraw/zinc/70/90/97/1345709097.db2.gz	ZXGMPODBIBFCDR-OAHLLOKOSA-N	0	3	343.279	3.226	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccc(Cl)cc3C)C2)C1	ZINC001041625410	1345800523	/nfs/dbraw/zinc/80/05/23/1345800523.db2.gz	HZUNDFNNZFTZHX-IBGZPJMESA-N	0	3	330.859	3.210	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cc(C(C)(C)C)oc3C)C2)C1	ZINC001041713148	1345828333	/nfs/dbraw/zinc/82/83/33/1345828333.db2.gz	CZYDQQLCDNDHAR-OAQYLSRUSA-N	0	3	342.483	3.447	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3coc4ccc(F)cc43)C2)C1	ZINC001041809957	1345858294	/nfs/dbraw/zinc/85/82/94/1345858294.db2.gz	WLKKSAGBKRIQDX-FQEVSTJZSA-N	0	3	340.398	3.133	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3cc4c(s3)CCCCC4)C2)C1	ZINC001041816152	1345861297	/nfs/dbraw/zinc/86/12/97/1345861297.db2.gz	LHXHBMWJPWGNND-FQEVSTJZSA-N	0	3	342.508	3.188	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cc(C)n(C(C)C)c3C)C2)C1	ZINC001041821638	1345863606	/nfs/dbraw/zinc/86/36/06/1345863606.db2.gz	KPIRPIOGMDZXLF-NRFANRHFSA-N	0	3	341.499	3.247	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)CC3C4CC5CC(C4)CC3C5)C2)C1	ZINC001041838792	1345868145	/nfs/dbraw/zinc/86/81/45/1345868145.db2.gz	BYSRTWZRRNTDDN-DSVYFTGISA-N	0	3	340.511	3.006	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)[C@H](C)c3cccc(Cl)c3)C2)C1	ZINC001041841644	1345869612	/nfs/dbraw/zinc/86/96/12/1345869612.db2.gz	QUPMXXTZHBVPAI-DNVCBOLYSA-N	0	3	330.859	3.001	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3CCN(C(=O)C=C4CCC4)C[C@H]32)cc1	ZINC001042006826	1345922427	/nfs/dbraw/zinc/92/24/27/1345922427.db2.gz	QRGQZOANWVEXKY-VQTJNVASSA-N	0	3	335.451	3.091	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3ccc(CCC)s3)C[C@@H]21	ZINC001042080482	1345939552	/nfs/dbraw/zinc/93/95/52/1345939552.db2.gz	LXJYUVDENXFQHI-RDJZCZTQSA-N	0	3	330.497	3.260	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(C4CC4)[nH]c3C3CC3)C[C@@H]21	ZINC001042114329	1345947650	/nfs/dbraw/zinc/94/76/50/1345947650.db2.gz	JWNZQMGSEHRWNB-BEFAXECRSA-N	0	3	339.483	3.492	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C3CCc4ccccc4CC3)C[C@@H]21	ZINC001042125305	1345950742	/nfs/dbraw/zinc/95/07/42/1345950742.db2.gz	RKWCKJJPMAKKTH-CTNGQTDRSA-N	0	3	338.495	3.290	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cccc(-n4cccc4)c3)C[C@H]21	ZINC001042139243	1345953958	/nfs/dbraw/zinc/95/39/58/1345953958.db2.gz	VXLUAOOTGHLFDN-WIYYLYMNSA-N	0	3	347.462	3.037	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)COc3ccc(C(C)C)cc3)C[C@@H]21	ZINC001042139573	1345954014	/nfs/dbraw/zinc/95/40/14/1345954014.db2.gz	XUIYAEHOGLRVTO-ICSRJNTNSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cccc(-n4cccc4)c3)C[C@@H]21	ZINC001042139594	1345954257	/nfs/dbraw/zinc/95/42/57/1345954257.db2.gz	YACBFQDFBJCSKW-XLIONFOSSA-N	0	3	335.451	3.200	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)CCc3ccc4[nH]ccc4c3)C[C@H]21	ZINC001042152025	1345957401	/nfs/dbraw/zinc/95/74/01/1345957401.db2.gz	DBBFWGDEZZZHAO-GHTZIAJQSA-N	0	3	349.478	3.047	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3nsc4ccc(C)cc43)C[C@H]21	ZINC001042183288	1345971180	/nfs/dbraw/zinc/97/11/80/1345971180.db2.gz	IUBJCZMSSGRNIA-GDBMZVCRSA-N	0	3	341.480	3.327	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3cc4ncccc4s3)C[C@@H]21	ZINC001042185114	1345972495	/nfs/dbraw/zinc/97/24/95/1345972495.db2.gz	QCPODNSKAOTIIU-ZBFHGGJFSA-N	0	3	341.480	3.409	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3ncccc3C)[C@@H]2C1	ZINC001042188576	1345974933	/nfs/dbraw/zinc/97/49/33/1345974933.db2.gz	UPSOHXOBZNFFFQ-SJLPKXTDSA-N	0	3	327.472	3.025	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C3(c4cccnc4)CCCC3)C[C@@H]21	ZINC001042205241	1345983609	/nfs/dbraw/zinc/98/36/09/1345983609.db2.gz	WNMVBADDTSHUFJ-MJGOQNOKSA-N	0	3	339.483	3.002	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3csc(-c4ccco4)n3)C[C@@H]21	ZINC001042206654	1345984752	/nfs/dbraw/zinc/98/47/52/1345984752.db2.gz	HVSQRHXVFUKYDQ-HIFRSBDPSA-N	0	3	343.452	3.126	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc(C)c(Cl)c3)C[C@@H]21	ZINC001042216012	1345989223	/nfs/dbraw/zinc/98/92/23/1345989223.db2.gz	KOORQGNOGHSGEY-YJBOKZPZSA-N	0	3	330.859	3.208	20	30		EGEDHN
CC1(C(=O)N2CC[C@@H]3CCN(Cc4cccc(C#N)c4)[C@@H]3C2)CC=CC1	ZINC001042222733	1345993641	/nfs/dbraw/zinc/99/36/41/1345993641.db2.gz	XUBGQVJWXLHMOA-VQTJNVASSA-N	0	3	349.478	3.337	20	30		EGEDHN
C#CCN1CC[C@H]2CCN(C(=O)CC(C3CCC3)C3CCC3)C[C@H]21	ZINC001042237057	1345999141	/nfs/dbraw/zinc/99/91/41/1345999141.db2.gz	FQFSNBQGDJVTOF-AZUAARDMSA-N	0	3	328.500	3.149	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3cnc(C(C)C)nc3C)C[C@@H]21	ZINC001042259170	1346009063	/nfs/dbraw/zinc/00/90/63/1346009063.db2.gz	FUZRBPHMTJCXGO-WMZOPIPTSA-N	0	3	342.487	3.021	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(F)c4ncccc4c3)C[C@H]21	ZINC001042271527	1346014762	/nfs/dbraw/zinc/01/47/62/1346014762.db2.gz	ZLUXQVJUPNIUBU-RDTXWAMCSA-N	0	3	339.414	3.096	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cccn3C3CCCC3)C[C@H]21	ZINC001042291548	1346019862	/nfs/dbraw/zinc/01/98/62/1346019862.db2.gz	ZBFUHFQHELMWKV-QFBILLFUSA-N	0	3	327.472	3.326	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc4nc(C)sc4c3)C[C@@H]21	ZINC001042297126	1346021677	/nfs/dbraw/zinc/02/16/77/1346021677.db2.gz	AISDQHMIINZHBT-PBHICJAKSA-N	0	3	341.480	3.327	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cnn(C(C)C)c3C3CC3)C[C@@H]21	ZINC001042308069	1346026615	/nfs/dbraw/zinc/02/66/15/1346026615.db2.gz	SJMCQRFTJXTQMG-YJBOKZPZSA-N	0	3	342.487	3.064	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3ccc(C#N)cc3)[C@@H]2C1	ZINC001042324993	1346033630	/nfs/dbraw/zinc/03/36/30/1346033630.db2.gz	YHYUCWWDGASKPV-QZTJIDSGSA-N	0	3	325.456	3.027	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)Cc3c(F)cccc3Cl)C[C@H]21	ZINC001042331198	1346038802	/nfs/dbraw/zinc/03/88/02/1346038802.db2.gz	NYQPIRQYXRZFDW-SUMWQHHRSA-N	0	3	336.838	3.130	20	30		EGEDHN
C#CCN1CC[C@H]2CCN(C(=O)CC34CC5CC(CC(C5)C3)C4)C[C@H]21	ZINC001042332734	1346040088	/nfs/dbraw/zinc/04/00/88/1346040088.db2.gz	XBVMECBHSRXOHH-GKHXVQBSSA-N	0	3	340.511	3.149	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(OCC(C)C)cc3)C[C@@H]21	ZINC001042340163	1346044900	/nfs/dbraw/zinc/04/49/00/1346044900.db2.gz	FNQRGKRMIVJHHL-PXNSSMCTSA-N	0	3	342.483	3.444	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(C)n(C(C)C)c3C)C[C@H]21	ZINC001042346586	1346048246	/nfs/dbraw/zinc/04/82/46/1346048246.db2.gz	UZWTZPUPWRKIEY-IEBWSBKVSA-N	0	3	329.488	3.408	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(COC(C)C)cc3)C[C@H]21	ZINC001042347932	1346048959	/nfs/dbraw/zinc/04/89/59/1346048959.db2.gz	FLCWWTXRCCQXDE-AZUAARDMSA-N	0	3	342.483	3.334	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(COC(C)C)cc3)C[C@@H]21	ZINC001042347933	1346049009	/nfs/dbraw/zinc/04/90/09/1346049009.db2.gz	FLCWWTXRCCQXDE-ICSRJNTNSA-N	0	3	342.483	3.334	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cccc(OCC(C)C)c3)C[C@@H]21	ZINC001042349060	1346050282	/nfs/dbraw/zinc/05/02/82/1346050282.db2.gz	NRNIISQSWAYNQB-XLIONFOSSA-N	0	3	342.483	3.444	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3csc(CC(C)C)n3)C[C@@H]21	ZINC001042373379	1346062273	/nfs/dbraw/zinc/06/22/73/1346062273.db2.gz	FWQMEQKZULPTBC-WBVHZDCISA-N	0	3	347.528	3.454	20	30		EGEDHN
C[C@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)C1CC(F)(F)C1	ZINC001044545467	1346366292	/nfs/dbraw/zinc/36/62/92/1346366292.db2.gz	QGSGYHOAJWNQOO-SUMWQHHRSA-N	0	3	347.409	3.073	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3snnc3C)C[C@H]2C)CC1	ZINC001044729170	1346413925	/nfs/dbraw/zinc/41/39/25/1346413925.db2.gz	FOQPKZVPLWGELN-CJNGLKHVSA-N	0	3	348.516	3.062	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC[C@H]1CNCc1cnc(C)s1	ZINC001045052363	1346487213	/nfs/dbraw/zinc/48/72/13/1346487213.db2.gz	UJLBRUKJXBOLGN-ZDUSSCGKSA-N	0	3	341.908	3.311	20	30		EGEDHN
CC1(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)cc2F)CCCC1	ZINC001045140296	1346503246	/nfs/dbraw/zinc/50/32/46/1346503246.db2.gz	PGLIYGMUEOQIEW-KRWDZBQOSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H]1CNCc1cccc(Cl)n1	ZINC001045146707	1346504034	/nfs/dbraw/zinc/50/40/34/1346504034.db2.gz	DXDWWHHMNDGSRE-HNNXBMFYSA-N	0	3	335.879	3.418	20	30		EGEDHN
CC1(NC(=O)[C@@H]2CC=CCC2)CCN(Cc2cccc(C#N)c2)CC1	ZINC001045362319	1346573884	/nfs/dbraw/zinc/57/38/84/1346573884.db2.gz	NPXBUTUVMYWLFV-LJQANCHMSA-N	0	3	337.467	3.385	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2cc(C3CCCCC3)n[nH]2)CC1	ZINC001045464349	1346600350	/nfs/dbraw/zinc/60/03/50/1346600350.db2.gz	ODVKASGANBOSES-UHFFFAOYSA-N	0	3	330.476	3.228	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)[C@H]2CCC[C@@H](C(F)(F)F)C2)CC1	ZINC001045482529	1346605140	/nfs/dbraw/zinc/60/51/40/1346605140.db2.gz	NHAMIQBHZCGUOI-LSDHHAIUSA-N	0	3	344.421	3.349	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)C2CCc3ccccc3CC2)CC1	ZINC001045489444	1346607105	/nfs/dbraw/zinc/60/71/05/1346607105.db2.gz	MJMZKKOLKSKFJG-UHFFFAOYSA-N	0	3	338.495	3.176	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)[C@H]2CCc3c2cccc3Cl)CC1	ZINC001045505654	1346612359	/nfs/dbraw/zinc/61/23/59/1346612359.db2.gz	POZVTHZGAXFTBS-KRWDZBQOSA-N	0	3	344.886	3.364	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2cccc(N3CCCC3)c2)CC1	ZINC001045595812	1346640033	/nfs/dbraw/zinc/64/00/33/1346640033.db2.gz	LZTGHLIGZLWKQP-UHFFFAOYSA-N	0	3	327.472	3.057	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)[C@@H]2C[C@H]2c2cc(F)ccc2F)CC1	ZINC001045643379	1346656869	/nfs/dbraw/zinc/65/68/69/1346656869.db2.gz	ATVNHEUCRCHPIE-GOEBONIOSA-N	0	3	334.410	3.225	20	30		EGEDHN
C/C(=C/C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1cccc(C#N)c1)C1CC1	ZINC001045719597	1346679615	/nfs/dbraw/zinc/67/96/15/1346679615.db2.gz	IZKYJTMIVSLSKQ-BJXLYJTFSA-N	0	3	349.478	3.480	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]3CC[C@@H](C2)N3CCC(F)(F)F)C1	ZINC001045843824	1346718216	/nfs/dbraw/zinc/71/82/16/1346718216.db2.gz	VRUBUGULHSGICC-KGLIPLIRSA-N	0	3	330.394	3.360	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1ccc(C#N)cc1	ZINC001045851321	1346721226	/nfs/dbraw/zinc/72/12/26/1346721226.db2.gz	WFDWJXFRBPVNGZ-YSTOQKLRSA-N	0	3	337.467	3.170	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc(C)c(C)o1)C2	ZINC001045931151	1346768998	/nfs/dbraw/zinc/76/89/98/1346768998.db2.gz	GYAGGNDCAXULHV-HXUWFJFHSA-N	0	3	328.456	3.238	20	30		EGEDHN
O=C(C#CC1CC1)N1CCCC[C@@]2(CCN(CCC(F)(F)F)C2)C1	ZINC001045936321	1346773153	/nfs/dbraw/zinc/77/31/53/1346773153.db2.gz	GVVSODMOXRWCTE-KRWDZBQOSA-N	0	3	342.405	3.057	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1nc(C(C)C)oc1C)C2	ZINC001045942332	1346777933	/nfs/dbraw/zinc/77/79/33/1346777933.db2.gz	QOWRFAFUUXHEQJ-HXUWFJFHSA-N	0	3	343.471	3.058	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1nc(C)sc1C)C2	ZINC001045946259	1346782182	/nfs/dbraw/zinc/78/21/82/1346782182.db2.gz	MUFYBGIFJNUIJY-IBGZPJMESA-N	0	3	345.512	3.101	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@H]1CCC=CCCC1)C2	ZINC001045947997	1346783463	/nfs/dbraw/zinc/78/34/63/1346783463.db2.gz	RPWHRSDDVASHGP-PZJWPPBQSA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@H]1CCC=CCCC1)C2	ZINC001045947996	1346783511	/nfs/dbraw/zinc/78/35/11/1346783511.db2.gz	RPWHRSDDVASHGP-FPOVZHCZSA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)C1CCC3(CC3)CC1)C2	ZINC001045953186	1346787855	/nfs/dbraw/zinc/78/78/55/1346787855.db2.gz	UMPPJPKVEQTCAH-OAQYLSRUSA-N	0	3	328.500	3.295	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)C1(C3CC3)CCC1)C2	ZINC001045954618	1346789011	/nfs/dbraw/zinc/78/90/11/1346789011.db2.gz	FCIIWXVSGJMHSL-HXUWFJFHSA-N	0	3	328.500	3.295	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)C[C@H]1CC=CCC1)C2	ZINC001045956947	1346792241	/nfs/dbraw/zinc/79/22/41/1346792241.db2.gz	PUJALFNLXHDSIK-PZJWPPBQSA-N	0	3	328.500	3.461	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cccc(F)c1F)C2	ZINC001045961074	1346796290	/nfs/dbraw/zinc/79/62/90/1346796290.db2.gz	FOFQMWKYARPDSS-FQEVSTJZSA-N	0	3	346.421	3.306	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1coc(C(F)F)c1)C2	ZINC001045960843	1346796628	/nfs/dbraw/zinc/79/66/28/1346796628.db2.gz	UJTRTZSMFBMMGB-SFHVURJKSA-N	0	3	336.382	3.169	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@H](C)c1ccco1)C2	ZINC001045965420	1346800491	/nfs/dbraw/zinc/80/04/91/1346800491.db2.gz	HAXFOJYFOZHIMN-XLIONFOSSA-N	0	3	328.456	3.111	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H]1C[C@H]1C1CCC1)C2	ZINC001045973279	1346809048	/nfs/dbraw/zinc/80/90/48/1346809048.db2.gz	JXYYRILPBPRADG-ZVDOUQERSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc(C(C)C)no1)C2	ZINC001045974098	1346810358	/nfs/dbraw/zinc/81/03/58/1346810358.db2.gz	YCJRZNMOVNYUQQ-FQEVSTJZSA-N	0	3	343.471	3.140	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ncoc1C(C)C)C2	ZINC001045979518	1346816381	/nfs/dbraw/zinc/81/63/81/1346816381.db2.gz	UUGMYYTVCIPGJF-HXUWFJFHSA-N	0	3	343.471	3.140	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)Cc1c[nH]c3ccccc13)C2	ZINC001045982628	1346821676	/nfs/dbraw/zinc/82/16/76/1346821676.db2.gz	YYBYKYMJCKQICR-QFIPXVFZSA-N	0	3	349.478	3.048	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccccc1OCC)C2	ZINC001045983159	1346823069	/nfs/dbraw/zinc/82/30/69/1346823069.db2.gz	JIHNWBNXAHPLAZ-OAQYLSRUSA-N	0	3	340.467	3.037	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H](C)c1cccc(F)c1)C2	ZINC001045984718	1346825108	/nfs/dbraw/zinc/82/51/08/1346825108.db2.gz	HKGCBMMZFFZQFQ-UWJYYQICSA-N	0	3	342.458	3.267	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@H]1[C@H]3[C@@H]1[C@@H]1CC[C@H]3C1)C2	ZINC001045987566	1346829404	/nfs/dbraw/zinc/82/94/04/1346829404.db2.gz	VLHLAYCLKLGFSR-LICMUICMSA-N	0	3	340.511	3.006	20	30		EGEDHN
C=C(C)CCN1CC[C@@](C)(NC(=O)c2cnc([C@H](C)OC)s2)C1	ZINC001046319249	1346933852	/nfs/dbraw/zinc/93/38/52/1346933852.db2.gz	QUFMPVFXLLUTRZ-SUMWQHHRSA-N	0	3	337.489	3.011	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N[C@@]1(C)CCN(Cc2cccc(C)c2)C1	ZINC001046320715	1346934543	/nfs/dbraw/zinc/93/45/43/1346934543.db2.gz	YNTCZHJRSFHKLP-DYXWJJEUSA-N	0	3	342.483	3.057	20	30		EGEDHN
C=C(C)CCN1CC[C@@](C)(NC(=O)c2sc(Cl)nc2C)C1	ZINC001046343858	1346942233	/nfs/dbraw/zinc/94/22/33/1346942233.db2.gz	FTTSBNBMMGHMLA-OAHLLOKOSA-N	0	3	327.881	3.265	20	30		EGEDHN
C#CCCN1CC[C@@](C)(NC(=O)c2cc3cc(Cl)ccc3o2)C1	ZINC001046457694	1346980604	/nfs/dbraw/zinc/98/06/04/1346980604.db2.gz	IVMYMPLGRGMQMV-GOSISDBHSA-N	0	3	330.815	3.304	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@]2(C)CCN(Cc3ccc(C)c(C)c3)C2)c1	ZINC001046605415	1347036485	/nfs/dbraw/zinc/03/64/85/1347036485.db2.gz	SUDPJLZPPZBTID-QFIPXVFZSA-N	0	3	347.462	3.074	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2cnn(C3CCCCC3)c2)C1	ZINC001046754388	1347085890	/nfs/dbraw/zinc/08/58/90/1347085890.db2.gz	PADJMUHOWPSJJE-IBGZPJMESA-N	0	3	330.476	3.159	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)[C@H]2CCCc3sc(C)nc32)C1	ZINC001046765576	1347090965	/nfs/dbraw/zinc/09/09/65/1347090965.db2.gz	ZEJLAXIUJCUCKS-KSSFIOAISA-N	0	3	333.501	3.028	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@]2(C)CCN([C@@H](C)c3ccccc3)C2)nc1	ZINC001046782980	1347098799	/nfs/dbraw/zinc/09/87/99/1347098799.db2.gz	HVNKDBCOHGIBGA-HRAATJIYSA-N	0	3	333.435	3.018	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@]2(C)CCN(Cc3ccccc3CC)C2)cn1	ZINC001046784149	1347099324	/nfs/dbraw/zinc/09/93/24/1347099324.db2.gz	YBPDGVRAUHQPSM-QFIPXVFZSA-N	0	3	347.462	3.020	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2cc(C)ccc2F)C1	ZINC001046975169	1347172593	/nfs/dbraw/zinc/17/25/93/1347172593.db2.gz	LBYHTNWHCOEFHE-AWEZNQCLSA-N	0	3	340.389	3.397	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2sc(C)nc2C)C1	ZINC001046995786	1347178804	/nfs/dbraw/zinc/17/88/04/1347178804.db2.gz	LKMJOHZOCKNNMJ-ZDUSSCGKSA-N	0	3	343.443	3.023	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)N(Cc2cnc(C)s2)C3)C1	ZINC001047143145	1347218747	/nfs/dbraw/zinc/21/87/47/1347218747.db2.gz	KZFTYYJRWLDARQ-XHSDSOJGSA-N	0	3	345.512	3.277	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)c3cc(C)oc3C)C2)CC1	ZINC001047222754	1347253557	/nfs/dbraw/zinc/25/35/57/1347253557.db2.gz	FCXLFDNVTUPHCL-LJQANCHMSA-N	0	3	342.483	3.484	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)c3scnc3C)C2)CC1	ZINC001047227517	1347258424	/nfs/dbraw/zinc/25/84/24/1347258424.db2.gz	GTZHIDVDJDDHHN-QGZVFWFLSA-N	0	3	345.512	3.039	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3[nH]ccc3C3CC3)C2)CC1	ZINC001047242550	1347268796	/nfs/dbraw/zinc/26/87/96/1347268796.db2.gz	VAZJHPLGWRAUAM-GOSISDBHSA-N	0	3	339.483	3.090	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@H]3CCC(F)(F)C3)C2)CC1	ZINC001047243965	1347269408	/nfs/dbraw/zinc/26/94/08/1347269408.db2.gz	OHHJFNNMYGAFGV-DLBZAZTESA-N	0	3	338.442	3.006	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3cc[nH]c3C(C)C)C2)CC1	ZINC001047250040	1347274562	/nfs/dbraw/zinc/27/45/62/1347274562.db2.gz	ZRZLWLUEXAQTCN-SFHVURJKSA-N	0	3	341.499	3.336	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H](C3CCN(CC#CC)CC3)C2)C1	ZINC001047254709	1347278674	/nfs/dbraw/zinc/27/86/74/1347278674.db2.gz	QYAOVRSMPGKLEV-LJQANCHMSA-N	0	3	328.500	3.317	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3occc3Cl)C2)CC1	ZINC001047254765	1347278731	/nfs/dbraw/zinc/27/87/31/1347278731.db2.gz	RUJFTELTFPSGII-OAHLLOKOSA-N	0	3	334.847	3.130	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)C3CCC(F)CC3)C2)CC1	ZINC001047255103	1347279032	/nfs/dbraw/zinc/27/90/32/1347279032.db2.gz	UTICXTHMFFCNJJ-IOJLRTSASA-N	0	3	348.506	3.489	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)c2cccs2)C1	ZINC001047692244	1347333929	/nfs/dbraw/zinc/33/39/29/1347333929.db2.gz	KKCRISFPOAYMMI-RHSMWYFYSA-N	0	3	339.464	3.260	20	30		EGEDHN
Cc1coc(C(=O)N2CC[C@@H]([C@H](C)NCc3ccccc3C#N)C2)c1	ZINC001047938582	1347417275	/nfs/dbraw/zinc/41/72/75/1347417275.db2.gz	YAQRFLYPVWVJBG-MAUKXSAKSA-N	0	3	337.423	3.100	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)C2(C)CCC2)C1	ZINC001047939967	1347418114	/nfs/dbraw/zinc/41/81/14/1347418114.db2.gz	KGGWQPHQBOTXKT-MAUKXSAKSA-N	0	3	325.456	3.075	20	30		EGEDHN
Cc1ccccc1C(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001048116187	1347471930	/nfs/dbraw/zinc/47/19/30/1347471930.db2.gz	DUCPTQPMTLQUKG-YLJYHZDGSA-N	0	3	347.462	3.365	20	30		EGEDHN
C[C@H]1CN(C(=O)CC2CCCC2)C[C@@H]1CNCc1ccccc1C#N	ZINC001048122005	1347474232	/nfs/dbraw/zinc/47/42/32/1347474232.db2.gz	KCGGFIZMVMHWFN-JXFKEZNVSA-N	0	3	339.483	3.323	20	30		EGEDHN
CC(C)=C(F)C(=O)N1C[C@H](C)[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001048210190	1347495706	/nfs/dbraw/zinc/49/57/06/1347495706.db2.gz	LAIROUSGISCBNF-BBRMVZONSA-N	0	3	347.409	3.145	20	30		EGEDHN
C[C@H]1CN(C(=O)CC2(C)CC2)C[C@@H]1CNCc1cc(F)ccc1C#N	ZINC001048318955	1347517562	/nfs/dbraw/zinc/51/75/62/1347517562.db2.gz	XKMCZQFTRRWXLI-YOEHRIQHSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@H]2C[C@H]3CC[C@@H](C2)N3CCF)cc1	ZINC001048540155	1347584341	/nfs/dbraw/zinc/58/43/41/1347584341.db2.gz	OPEPUVOUTKXWEJ-VBUUOAMHSA-N	0	3	346.446	3.194	20	30		EGEDHN
C=C(C)CN1CCC(N(Cc2ccccn2)C(=O)[C@@H]2C[C@@H]2C)CC1	ZINC001048625097	1347623497	/nfs/dbraw/zinc/62/34/97/1347623497.db2.gz	LGXNKUQCJRPKFR-QFBILLFUSA-N	0	3	327.472	3.107	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)[C@H]2C[C@H]2C(C)C)CC1	ZINC001048628729	1347624906	/nfs/dbraw/zinc/62/49/06/1347624906.db2.gz	GQCZSORMBYLARE-PMACEKPBSA-N	0	3	341.499	3.353	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CN(Cc3c(C)nsc3C)C[C@H]2C1	ZINC001048975957	1347695583	/nfs/dbraw/zinc/69/55/83/1347695583.db2.gz	BSSBDDXDBWJPFH-IYBDPMFKSA-N	0	3	347.528	3.252	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CN(C(=O)[C@H]4CC45CCCC5)C[C@@H]3C2)c1	ZINC001049155339	1347736076	/nfs/dbraw/zinc/73/60/76/1347736076.db2.gz	BDCXXDWXZUEBPP-HSALFYBXSA-N	0	3	349.478	3.029	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)CC34CC5CC(CC(C5)C3)C4)C[C@@H]2C1	ZINC001049187149	1347742426	/nfs/dbraw/zinc/74/24/26/1347742426.db2.gz	ULDUKEWUPQCTNI-HBSVTFQGSA-N	0	3	340.511	3.006	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@@H]2CCCN3C(=O)C2CCCC2)cc1	ZINC001049280372	1347767770	/nfs/dbraw/zinc/76/77/70/1347767770.db2.gz	ODGVPRHQPDQRNX-PMACEKPBSA-N	0	3	337.467	3.314	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1ccc(C#N)cc1)C1CC1	ZINC001049403693	1347825639	/nfs/dbraw/zinc/82/56/39/1347825639.db2.gz	KAOJODVRYLPAAS-CWFSZBLJSA-N	0	3	337.467	3.170	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)[C@@H]1CC[C@H](c2ccccc2)O1	ZINC001049480795	1347869778	/nfs/dbraw/zinc/86/97/78/1347869778.db2.gz	QJYBYBHSYSQAHG-HAGHYFMRSA-N	0	3	340.467	3.158	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1c(C)nn(C(C)(C)C)c1C	ZINC001049507504	1347883831	/nfs/dbraw/zinc/88/38/31/1347883831.db2.gz	JNOZKUMCAHGKOR-SJORKVTESA-N	0	3	344.503	3.120	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(C(F)F)nc1	ZINC001049511829	1347885951	/nfs/dbraw/zinc/88/59/51/1347885951.db2.gz	PXLQMNXFHIANKA-HOTGVXAUSA-N	0	3	335.398	3.274	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(C2CCCCC2)n[nH]1	ZINC001049522828	1347890645	/nfs/dbraw/zinc/89/06/45/1347890645.db2.gz	JFSVBBMCQUOEIV-MOPGFXCFSA-N	0	3	342.487	3.322	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(C)cc(OC)c1C	ZINC001049572723	1347915713	/nfs/dbraw/zinc/91/57/13/1347915713.db2.gz	NGQQNMJIPNKJNO-ROUUACIJSA-N	0	3	328.456	3.177	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1c(C)[nH]c2ccccc21	ZINC001049582823	1347921819	/nfs/dbraw/zinc/92/18/19/1347921819.db2.gz	QHMQMPRCWOLSLD-OALUTQOASA-N	0	3	335.451	3.179	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1nc(Cl)sc1C	ZINC001049588839	1347924395	/nfs/dbraw/zinc/92/43/95/1347924395.db2.gz	OGIGSUQDGQSYCC-STQMWFEESA-N	0	3	339.892	3.360	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1cccc(C(F)F)c1	ZINC001049590614	1347925829	/nfs/dbraw/zinc/92/58/29/1347925829.db2.gz	BARGCDVATZDEGZ-QZTJIDSGSA-N	0	3	346.421	3.255	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1ccc(C(F)F)cc1	ZINC001049591162	1347926054	/nfs/dbraw/zinc/92/60/54/1347926054.db2.gz	DSCKWKSMPKPGHM-QZTJIDSGSA-N	0	3	346.421	3.255	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1ccc(C2CCC2)cc1	ZINC001049622426	1347939526	/nfs/dbraw/zinc/93/95/26/1347939526.db2.gz	UTIZKAUCXTUFOH-SFTDATJTSA-N	0	3	336.479	3.195	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]2[C@H]1CCN2Cc1ncccc1C	ZINC001049635907	1347946213	/nfs/dbraw/zinc/94/62/13/1347946213.db2.gz	NQVZBUINXACWSV-ZWKOTPCHSA-N	0	3	327.472	3.168	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]2[C@H]1CCN2Cc1ccc(OC)cc1	ZINC001049636511	1347947120	/nfs/dbraw/zinc/94/71/20/1347947120.db2.gz	SFMZYJKUBKZVML-RBUKOAKNSA-N	0	3	342.483	3.473	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1cccc(OC)c1	ZINC001049646609	1347953205	/nfs/dbraw/zinc/95/32/05/1347953205.db2.gz	QGOZMQSBRGOTBF-OALUTQOASA-N	0	3	342.483	3.473	20	30		EGEDHN
C[C@]1(C(=O)N2CCC[C@H]3[C@H]2CCN3Cc2cccc(C#N)c2)C=CCC1	ZINC001049659454	1347959219	/nfs/dbraw/zinc/95/92/19/1347959219.db2.gz	SMMDBAIITQTYAF-VWPQPMDRSA-N	0	3	349.478	3.480	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)[C@H]2C[C@H]3C[C@H]3C2)c1	ZINC001049661586	1347961287	/nfs/dbraw/zinc/96/12/87/1347961287.db2.gz	WMBKTVRSWCYIJA-XDWAVFMPSA-N	0	3	349.478	3.170	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cncc2sccc21	ZINC001049675495	1347967394	/nfs/dbraw/zinc/96/73/94/1347967394.db2.gz	ZRQNSGPXKBMUDG-JKSUJKDBSA-N	0	3	327.453	3.161	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc2cc(OC)ccc2[nH]1	ZINC001049682982	1347971108	/nfs/dbraw/zinc/97/11/08/1347971108.db2.gz	YVWPSJDXWQMIDO-RBUKOAKNSA-N	0	3	339.439	3.041	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]3[C@H]2CCN3Cc2cccnc2C)C1	ZINC001049707643	1347984235	/nfs/dbraw/zinc/98/42/35/1347984235.db2.gz	DSHIAWVPBHFSDH-RBUKOAKNSA-N	0	3	339.483	3.312	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](C)OC1CCCCCC1	ZINC001049710103	1347985252	/nfs/dbraw/zinc/98/52/52/1347985252.db2.gz	UISFGCPVFFEAKW-YTQUADARSA-N	0	3	334.504	3.366	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(C(C)C)nc1C	ZINC001049729879	1347992127	/nfs/dbraw/zinc/99/21/27/1347992127.db2.gz	YBNFXCQETJHLHY-MOPGFXCFSA-N	0	3	327.472	3.378	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1sc(CC)nc1C	ZINC001049777964	1348016464	/nfs/dbraw/zinc/01/64/64/1348016464.db2.gz	LLJHGSINXQHPAO-GJZGRUSLSA-N	0	3	333.501	3.269	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC001049778631	1348017381	/nfs/dbraw/zinc/01/73/81/1348017381.db2.gz	XJRMHOKMEALBCA-NMLBUPMWSA-N	0	3	340.467	3.050	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](CC)c1c(C)noc1C	ZINC001049787306	1348021888	/nfs/dbraw/zinc/02/18/88/1348021888.db2.gz	GYXCPJIRIBDOHU-YESZJQIVSA-N	0	3	331.460	3.036	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](C)c1ccc(CC)cc1	ZINC001049789523	1348023410	/nfs/dbraw/zinc/02/34/10/1348023410.db2.gz	ASKDQCXBWFLMMH-IOMROCGXSA-N	0	3	338.495	3.441	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cccc(OC(C)C)n1	ZINC001049827796	1348043451	/nfs/dbraw/zinc/04/34/51/1348043451.db2.gz	LYLGMNXFWHYSJA-ZWKOTPCHSA-N	0	3	343.471	3.124	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cnn([C@@H](C)CC)c1C	ZINC001049834530	1348048099	/nfs/dbraw/zinc/04/80/99/1348048099.db2.gz	KXCFAKGGFMPGSW-JCGIZDLHSA-N	0	3	330.476	3.027	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)CCc1ccc(CC)cc1	ZINC001049888311	1348092434	/nfs/dbraw/zinc/09/24/34/1348092434.db2.gz	GFWUKDSNCPMHDZ-SFTDATJTSA-N	0	3	338.495	3.270	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(C)c(F)c(C)c1	ZINC001049901733	1348101784	/nfs/dbraw/zinc/10/17/84/1348101784.db2.gz	AUIFOJJNRDZHTK-ROUUACIJSA-N	0	3	328.431	3.145	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(OC2CCC2)cc1	ZINC001049909698	1348106783	/nfs/dbraw/zinc/10/67/83/1348106783.db2.gz	RWJAOZBVSIWKMI-UXHICEINSA-N	0	3	340.467	3.483	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](C)Cc1ccccc1C	ZINC001049914459	1348109753	/nfs/dbraw/zinc/10/97/53/1348109753.db2.gz	DHOQQUXQWPUWSQ-YZGWKJHDSA-N	0	3	326.484	3.425	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(N(C)CC)cc1	ZINC001049928927	1348119139	/nfs/dbraw/zinc/11/91/39/1348119139.db2.gz	WLPVKLQRPAYWFG-OALUTQOASA-N	0	3	327.472	3.008	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3ccc4nccc(C)c4c3)[C@@H]2C1	ZINC001050055066	1348167245	/nfs/dbraw/zinc/16/72/45/1348167245.db2.gz	ANJWYWAHGJLMDI-FXAWDEMLSA-N	0	3	335.451	3.266	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)C3C4CC5CC(C4)CC3C5)[C@@H]2C1	ZINC001050063929	1348170487	/nfs/dbraw/zinc/17/04/87/1348170487.db2.gz	YLWDJGOWPFDMSO-VXHMAKRFSA-N	0	3	340.511	3.005	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3cc(C)c(F)cc3F)[C@@H]2C1	ZINC001050071152	1348172425	/nfs/dbraw/zinc/17/24/25/1348172425.db2.gz	ITAKGDFHDBZWOA-KBXCAEBGSA-N	0	3	334.410	3.386	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cc(F)cc4ccoc43)[C@@H]2C1	ZINC001050080360	1348175656	/nfs/dbraw/zinc/17/56/56/1348175656.db2.gz	DUPGTMADFBOQKI-WMLDXEAASA-N	0	3	328.387	3.294	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3cc4c(cn3)CCCC4)[C@@H]2C1	ZINC001050090234	1348179415	/nfs/dbraw/zinc/17/94/15/1348179415.db2.gz	QZZOPBAUGQZISY-AZUAARDMSA-N	0	3	339.483	3.073	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)[C@@H](C)c3c(F)cccc3F)[C@@H]2C1	ZINC001050095142	1348181717	/nfs/dbraw/zinc/18/17/17/1348181717.db2.gz	ADQNLTVENXRXPM-GRDNDAEWSA-N	0	3	334.410	3.177	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cnc4ccccc4c3C)[C@@H]2C1	ZINC001050098788	1348182797	/nfs/dbraw/zinc/18/27/97/1348182797.db2.gz	XDNGZYLDSSDXRD-OXJNMPFZSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3nc4ccccc4cc3C)[C@@H]2C1	ZINC001050100525	1348183539	/nfs/dbraw/zinc/18/35/39/1348183539.db2.gz	YSFZSLZLXVQAJJ-PKOBYXMFSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)CCc3ccc(C)cc3C)[C@@H]2C1	ZINC001050107258	1348185132	/nfs/dbraw/zinc/18/51/32/1348185132.db2.gz	XGXLBNRODCZFQH-VQTJNVASSA-N	0	3	326.484	3.345	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)C[C@@H](C)c3cccc(F)c3)[C@@H]2C1	ZINC001050137185	1348193705	/nfs/dbraw/zinc/19/37/05/1348193705.db2.gz	QMMWIHQDQXVCNK-IMFGXOCKSA-N	0	3	342.458	3.265	20	30		EGEDHN
C#CCCN1C[C@@H]2CCCN(C(=O)c3sccc3C(F)F)[C@@H]2C1	ZINC001050191345	1348207139	/nfs/dbraw/zinc/20/71/39/1348207139.db2.gz	RSRDIZWGUFMQTR-GXTWGEPZSA-N	0	3	338.423	3.245	20	30		EGEDHN
Cc1cccc(Cl)c1CN1CCC2(CN(C(=O)[C@H](C)C#N)C2)CC1	ZINC001050463352	1348272386	/nfs/dbraw/zinc/27/23/86/1348272386.db2.gz	PETZADJUOBFRGI-OAHLLOKOSA-N	0	3	345.874	3.233	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cccc(Cl)c3C)C2)CC1	ZINC001050527649	1348283544	/nfs/dbraw/zinc/28/35/44/1348283544.db2.gz	QGKMIZRUXJLGOV-UHFFFAOYSA-N	0	3	330.859	3.210	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3scc(C)c3Cl)C2)CC1	ZINC001050531237	1348284242	/nfs/dbraw/zinc/28/42/42/1348284242.db2.gz	IBCNYAJARMKUBJ-UHFFFAOYSA-N	0	3	336.888	3.271	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc4nccc(C)c4c3)C2)CC1	ZINC001050532587	1348285114	/nfs/dbraw/zinc/28/51/14/1348285114.db2.gz	YGBWVTNBXOKUSZ-UHFFFAOYSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3nc(C(C)(C)C)cs3)C2)CC1	ZINC001050550930	1348288141	/nfs/dbraw/zinc/28/81/41/1348288141.db2.gz	RDZVPBREKRVVNI-UHFFFAOYSA-N	0	3	345.512	3.002	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H](C)c3c(F)cccc3F)C2)CC1	ZINC001050591219	1348295839	/nfs/dbraw/zinc/29/58/39/1348295839.db2.gz	BKOCVCJOQFTDLI-OAHLLOKOSA-N	0	3	346.421	3.016	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3csc4ccccc34)C2)CC1	ZINC001050608788	1348300285	/nfs/dbraw/zinc/30/02/85/1348300285.db2.gz	NGLNCLFDORXCPP-UHFFFAOYSA-N	0	3	338.476	3.463	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)CC(C3CCC3)C3CCC3)C2)CC1	ZINC001050667725	1348321678	/nfs/dbraw/zinc/32/16/78/1348321678.db2.gz	DNEAEBGXPACDSF-UHFFFAOYSA-N	0	3	328.500	3.151	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)[C@@H]4C[C@H]4C4CC4)C3)CC2)c1	ZINC001050695646	1348329770	/nfs/dbraw/zinc/32/97/70/1348329770.db2.gz	KSIRAGACWFLMLG-VQTJNVASSA-N	0	3	349.478	3.029	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)C[C@H]3C[C@@H](C)CC(C)(C)C3)C2)CC1	ZINC001050700189	1348330883	/nfs/dbraw/zinc/33/08/83/1348330883.db2.gz	BKJWKVVXSQUCQO-QZTJIDSGSA-N	0	3	330.516	3.397	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3ccncc3C)cccc2C1	ZINC001051287594	1348419272	/nfs/dbraw/zinc/41/92/72/1348419272.db2.gz	AZHWLNJFRJMWPK-UHFFFAOYSA-N	0	3	335.451	3.254	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3cc4c([nH]3)CCC4)cccc2C1	ZINC001051305915	1348427059	/nfs/dbraw/zinc/42/70/59/1348427059.db2.gz	YKCYTHRKEZJBOK-UHFFFAOYSA-N	0	3	349.478	3.368	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2oc3c(cccc3F)c2C)CC1	ZINC001052446529	1348542962	/nfs/dbraw/zinc/54/29/62/1348542962.db2.gz	MABKAPSHUGRFNS-CQSZACIVSA-N	0	3	328.387	3.098	20	30		EGEDHN
C[C@H](C(=O)N[C@@H]1CCCN(Cc2ccc(C#N)cc2)CC1)C1CCC1	ZINC001052485782	1348553168	/nfs/dbraw/zinc/55/31/68/1348553168.db2.gz	DLTDGTGPAZNVPD-OXJNMPFZSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccccc2-c2ccncc2)CC1	ZINC001052492100	1348556059	/nfs/dbraw/zinc/55/60/59/1348556059.db2.gz	PFFNYJIMMQUZMQ-IBGZPJMESA-N	0	3	347.462	3.356	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cc(C3CC3)[nH]c2C2CC2)CC1	ZINC001052491644	1348556100	/nfs/dbraw/zinc/55/61/00/1348556100.db2.gz	IKCYNWOQZMPTNC-KRWDZBQOSA-N	0	3	339.483	3.377	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)C2(C)CCC(F)(F)CC2)CC1	ZINC001052494943	1348557666	/nfs/dbraw/zinc/55/76/66/1348557666.db2.gz	GJKICTYAGDLKCD-OAHLLOKOSA-N	0	3	326.431	3.196	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cc(F)cc3ccoc32)CC1	ZINC001052510778	1348563112	/nfs/dbraw/zinc/56/31/12/1348563112.db2.gz	YABBODMXMIKWAE-MRXNPFEDSA-N	0	3	328.387	3.180	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)Cc2cc3ccccc3s2)CC1	ZINC001052552943	1348577224	/nfs/dbraw/zinc/57/72/24/1348577224.db2.gz	CDFGWTIQBXDNOP-KRWDZBQOSA-N	0	3	340.492	3.438	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2nsc3ccc(C)cc32)CC1	ZINC001052623402	1348598848	/nfs/dbraw/zinc/59/88/48/1348598848.db2.gz	RGENDLQIJKZPKR-OAHLLOKOSA-N	0	3	341.480	3.212	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)Cc2c(C)[nH]c3ccccc32)CC1	ZINC001052672746	1348623761	/nfs/dbraw/zinc/62/37/61/1348623761.db2.gz	YJCLXMPCMWUOCE-KRWDZBQOSA-N	0	3	337.467	3.013	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc(C)c(OCC)c2)CC1	ZINC001052765398	1348670294	/nfs/dbraw/zinc/67/02/94/1348670294.db2.gz	YOGBSOXCCCUVRY-GOSISDBHSA-N	0	3	328.456	3.001	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc(C)c(C)c2)CC1	ZINC001052777454	1348675133	/nfs/dbraw/zinc/67/51/33/1348675133.db2.gz	CODCCOXJPXWYKH-QHAWAJNXSA-N	0	3	338.495	3.401	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2csc(-c3ccoc3)n2)CC1	ZINC001052799260	1348684680	/nfs/dbraw/zinc/68/46/80/1348684680.db2.gz	HXMIJDCBHPNMAQ-HNNXBMFYSA-N	0	3	343.452	3.011	20	30		EGEDHN
CC(=O)N1CCC[C@H]([C@H]2CCCN(Cc3ccccc3C#N)C2)C1	ZINC001052998145	1348795304	/nfs/dbraw/zinc/79/53/04/1348795304.db2.gz	VJZWLKXOPAIWTC-PMACEKPBSA-N	0	3	325.456	3.029	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccc(C)nc2)C1	ZINC001053070385	1348884708	/nfs/dbraw/zinc/88/47/08/1348884708.db2.gz	YEQDVWFABTZWQG-VQTJNVASSA-N	0	3	339.483	3.120	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cc[nH]c2C)C1	ZINC001053076789	1348895555	/nfs/dbraw/zinc/89/55/55/1348895555.db2.gz	UBSBQVXOWBRLBU-IEBWSBKVSA-N	0	3	327.472	3.053	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(Cl)[nH]2)C1	ZINC001053094480	1348923492	/nfs/dbraw/zinc/92/34/92/1348923492.db2.gz	FRKCGSVEDFKWFL-WBVHZDCISA-N	0	3	347.890	3.398	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(Cl)cn2)C1	ZINC001053103544	1348937425	/nfs/dbraw/zinc/93/74/25/1348937425.db2.gz	HXUMDNYSPPBVMQ-CRAIPNDOSA-N	0	3	345.874	3.075	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2sccc2OC)C1	ZINC001053103703	1348938242	/nfs/dbraw/zinc/93/82/42/1348938242.db2.gz	KWGWPXOCEFNYBR-JKSUJKDBSA-N	0	3	346.496	3.097	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccc(F)cc2F)C1	ZINC001053106956	1348945272	/nfs/dbraw/zinc/94/52/72/1348945272.db2.gz	XYNDCIPJMFSTKK-HNAYVOBHSA-N	0	3	346.421	3.305	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccccc2OC)C1	ZINC001053106930	1348945581	/nfs/dbraw/zinc/94/55/81/1348945581.db2.gz	XELACKBJDPBBSG-HKUYNNGSSA-N	0	3	340.467	3.035	20	30		EGEDHN
C=C(C)CCN1Cc2ccccc2C[C@@H]1CNC(=O)c1c[nH]c(C#N)c1	ZINC001054037582	1349133488	/nfs/dbraw/zinc/13/34/88/1349133488.db2.gz	JZNVPZKDTWJVMQ-HXUWFJFHSA-N	0	3	348.450	3.009	20	30		EGEDHN
CC(F)(F)C(=O)N1CCC[C@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001054071452	1349144809	/nfs/dbraw/zinc/14/48/09/1349144809.db2.gz	CDBPJLDIAWNZJW-LJQANCHMSA-N	0	3	347.409	3.028	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)Cc1ccc(C(F)F)cc1)C2	ZINC001054164108	1349167215	/nfs/dbraw/zinc/16/72/15/1349167215.db2.gz	ZOCFTKZBZLLJBZ-HXUWFJFHSA-N	0	3	346.421	3.114	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1cnc3ccccc3c1C)C2	ZINC001054165977	1349168996	/nfs/dbraw/zinc/16/89/96/1349168996.db2.gz	RPQIGSKEFMXILU-QFIPXVFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1nc3ccccc3cc1C)C2	ZINC001054166782	1349169478	/nfs/dbraw/zinc/16/94/78/1349169478.db2.gz	JJOAYBYYSYSIPY-JOCHJYFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H](c1ccccc1)C(C)C)C2	ZINC001054202853	1349204641	/nfs/dbraw/zinc/20/46/41/1349204641.db2.gz	BFAPMNCJQWASAA-IRLDBZIGSA-N	0	3	338.495	3.374	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@]3(C2)CCCN(C(=O)[C@H]2CC24CC4)C3)cc1	ZINC001054204100	1349204943	/nfs/dbraw/zinc/20/49/43/1349204943.db2.gz	NJSYRRLPYBMEIU-TZIWHRDSSA-N	0	3	349.478	3.173	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc3c(c1)C=CCC3)C2	ZINC001054212462	1349212232	/nfs/dbraw/zinc/21/22/32/1349212232.db2.gz	HJZPDXZEEUCCHN-JOCHJYFZSA-N	0	3	334.463	3.207	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)C(C)(C)Cc1ccccc1)C2	ZINC001054224461	1349219986	/nfs/dbraw/zinc/21/99/86/1349219986.db2.gz	CZWRFXVBPJWFOM-JOCHJYFZSA-N	0	3	338.495	3.203	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)CCc1cc(C)cc(C)c1)C2	ZINC001054224952	1349220273	/nfs/dbraw/zinc/22/02/73/1349220273.db2.gz	NLGQJJAHDRAWJK-QFIPXVFZSA-N	0	3	338.495	3.184	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H](F)CC1CCCCC1)C2	ZINC001054227289	1349221882	/nfs/dbraw/zinc/22/18/82/1349221882.db2.gz	GJYVOXXIOSOVIG-ICSRJNTNSA-N	0	3	334.479	3.243	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)C(C)(C)c1ccc(C)cc1)C2	ZINC001054229291	1349222790	/nfs/dbraw/zinc/22/27/90/1349222790.db2.gz	QEVHMQSJXDODDG-QFIPXVFZSA-N	0	3	338.495	3.220	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)CCc1cc(C)sc1C)C2	ZINC001054245825	1349239212	/nfs/dbraw/zinc/23/92/12/1349239212.db2.gz	FFOFTHUASDUFKX-FQEVSTJZSA-N	0	3	344.524	3.245	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H](CC)c1ccc(F)cc1)C2	ZINC001054245855	1349239248	/nfs/dbraw/zinc/23/92/48/1349239248.db2.gz	FUOFWWVAOHKMRM-PZJWPPBQSA-N	0	3	342.458	3.267	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3ccsn3)cc2C1	ZINC001054270672	1349270124	/nfs/dbraw/zinc/27/01/24/1349270124.db2.gz	WYEWVDAXSMWHNW-UHFFFAOYSA-N	0	3	327.453	3.355	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3ccc4[nH]ccc4n3)cc2C1	ZINC001054273960	1349273534	/nfs/dbraw/zinc/27/35/34/1349273534.db2.gz	KFYLEZYJPMYIBS-UHFFFAOYSA-N	0	3	346.434	3.385	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3c[nH]c4cccnc34)cc2C1	ZINC001054289612	1349294053	/nfs/dbraw/zinc/29/40/53/1349294053.db2.gz	LMJXYPTUFIPZBY-UHFFFAOYSA-N	0	3	346.434	3.385	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@H]3[C@H]4[C@@H]3[C@@H]3CC[C@H]4C3)cc2C1	ZINC001054293212	1349300057	/nfs/dbraw/zinc/30/00/57/1349300057.db2.gz	WBMVEWDTRFOLDG-DWDHFNPESA-N	0	3	336.479	3.487	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@@H]3CCCC[C@H]3OC)cc2C1	ZINC001054293280	1349300374	/nfs/dbraw/zinc/30/03/74/1349300374.db2.gz	ZCBSREZVNVURRB-WOJBJXKFSA-N	0	3	342.483	3.400	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CCCCC2)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054345192	1349324081	/nfs/dbraw/zinc/32/40/81/1349324081.db2.gz	MBIAWDXTFULVII-DYVFJYSZSA-N	0	3	331.485	3.137	20	30		EGEDHN
Cc1cc(C(=O)N2C[C@@H](C)[C@@H](NCc3ccc(C#N)s3)C2)oc1C	ZINC001054570805	1349403093	/nfs/dbraw/zinc/40/30/93/1349403093.db2.gz	WVMLNNSQIZFWPU-WBMJQRKESA-N	0	3	343.452	3.080	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)[C@@H](NCc2cc(C)ccc2OC)C1	ZINC001054966303	1349530171	/nfs/dbraw/zinc/53/01/71/1349530171.db2.gz	LYXXCZKVVCHKNV-WBVHZDCISA-N	0	3	330.472	3.152	20	30		EGEDHN
CCC1(C(=O)N2C[C@H](C)[C@H](NCc3ccc(C#N)s3)C2)CCC1	ZINC001054987399	1349540070	/nfs/dbraw/zinc/54/00/70/1349540070.db2.gz	WPGBLYOSPVCYIG-XJKSGUPXSA-N	0	3	331.485	3.137	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)C2(c3cccc(F)c3)CCC2)C1	ZINC001080234566	1357532954	/nfs/dbraw/zinc/53/29/54/1357532954.db2.gz	ILUVQBHMYBYIJG-CRAIPNDOSA-N	0	3	330.447	3.260	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)[C@H]2CCC=CCCC2)C1	ZINC001070413261	1354341216	/nfs/dbraw/zinc/34/12/16/1354341216.db2.gz	YFLNIIUFVKLPCV-IRXDYDNUSA-N	0	3	342.487	3.138	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1ccc(CC)s1)C[C@H](C)O2	ZINC001071185166	1354491912	/nfs/dbraw/zinc/49/19/12/1354491912.db2.gz	BMKPDOGPUSXHET-KXBFYZLASA-N	0	3	348.512	3.192	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)CN(C(=O)CCC1CCCCC1)C[C@@H](C)O2	ZINC001071233531	1354516952	/nfs/dbraw/zinc/51/69/52/1354516952.db2.gz	KGEDCQXJZABGJS-WIYYLYMNSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)Cc2coc3cc(F)ccc23)CC[C@@H]1C	ZINC001071497999	1354728660	/nfs/dbraw/zinc/72/86/60/1354728660.db2.gz	PMLAZQIYOOZFPU-BBRMVZONSA-N	0	3	330.403	3.270	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2sc(C3CC3)nc2C)CC[C@@H]1C	ZINC001071508502	1354733430	/nfs/dbraw/zinc/73/34/30/1354733430.db2.gz	PBKNJJVDGDMQBC-WFASDCNBSA-N	0	3	333.501	3.488	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cscc2C(F)F)CC[C@H]1C	ZINC001071512602	1354736697	/nfs/dbraw/zinc/73/66/97/1354736697.db2.gz	ZSWKKBZCLGPXAD-VXGBXAGGSA-N	0	3	326.412	3.292	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccnn2C2CCCC2)CC[C@H]1C	ZINC001071542544	1354755771	/nfs/dbraw/zinc/75/57/71/1354755771.db2.gz	HGFLYOVDGJUQST-HZPDHXFCSA-N	0	3	330.476	3.157	20	30		EGEDHN
C=C(C)CCN1C[C@H](NC(=O)c2cn3cc(C)nc3s2)CC[C@H]1C	ZINC001071568497	1354769136	/nfs/dbraw/zinc/76/91/36/1354769136.db2.gz	OEEJRYUUVSYLLA-HUUCEWRRSA-N	0	3	346.500	3.253	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2cncc3ccccc32)CC[C@@H]1C	ZINC001071584633	1354779259	/nfs/dbraw/zinc/77/92/59/1354779259.db2.gz	RLMQYNXZZHITOM-QFBILLFUSA-N	0	3	337.467	3.323	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2(C)CCC(F)(F)CC2)CC[C@H]1C	ZINC001071612919	1354796831	/nfs/dbraw/zinc/79/68/31/1354796831.db2.gz	PCHARFOCWGSRCI-CABCVRRESA-N	0	3	326.431	3.194	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc(C)cc(OC)c2C)CC[C@@H]1C	ZINC001071647443	1354825438	/nfs/dbraw/zinc/82/54/38/1354825438.db2.gz	HCEVWFBKXBANPX-DOTOQJQBSA-N	0	3	330.472	3.471	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(-n3cccc3)cc2)CC[C@@H]1C	ZINC001071653881	1354829047	/nfs/dbraw/zinc/82/90/47/1354829047.db2.gz	AOZWNIWZHLPAOO-HKUYNNGSSA-N	0	3	335.451	3.083	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2ncsc2C(F)(F)F)CC[C@H]1C	ZINC001071682632	1354850054	/nfs/dbraw/zinc/85/00/54/1354850054.db2.gz	ONNJQAZNZRCATK-MNOVXSKESA-N	0	3	347.406	3.321	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2cnc(CC3CC3)s2)CC[C@H]1C	ZINC001071692024	1354853162	/nfs/dbraw/zinc/85/31/62/1354853162.db2.gz	DXHQLTFFAAMEDZ-HIFRSBDPSA-N	0	3	333.501	3.254	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CC[C@H](C)N(CCOC3CCC3)C2)CC1	ZINC001071794422	1354939411	/nfs/dbraw/zinc/93/94/11/1354939411.db2.gz	CDEBZVORUMBDPT-WMZOPIPTSA-N	0	3	334.504	3.271	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C(C)(C)c2cccc(F)c2)CC[C@@H]1C	ZINC001071825540	1354963783	/nfs/dbraw/zinc/96/37/83/1354963783.db2.gz	YKGAPHJTFHAALI-MAUKXSAKSA-N	0	3	330.447	3.096	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc(-c3cccs3)n[nH]2)CC[C@H]1C	ZINC001071831168	1354967868	/nfs/dbraw/zinc/96/78/68/1354967868.db2.gz	AOQOIRVJWDWKPU-KGLIPLIRSA-N	0	3	344.484	3.297	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)Cc2cccc(Cl)c2F)CC[C@H]1C	ZINC001071843768	1354973276	/nfs/dbraw/zinc/97/32/76/1354973276.db2.gz	APKWXOHAOHXLQE-HIFRSBDPSA-N	0	3	336.838	3.014	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)Cc2c[nH]c3ccc(F)cc23)CC[C@H]1C	ZINC001071843765	1354973878	/nfs/dbraw/zinc/97/38/78/1354973878.db2.gz	AMNHCMGIJSJZJW-CZUORRHYSA-N	0	3	329.419	3.005	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@@H]2CC[C@@H](C)N(CC=C(C)C)C2)cc1	ZINC001071868044	1354994438	/nfs/dbraw/zinc/99/44/38/1354994438.db2.gz	GSUSXOCAINORCH-IEBWSBKVSA-N	0	3	340.467	3.248	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(-n3cccc3)nc2)CC[C@@H]1C	ZINC001071899536	1355013759	/nfs/dbraw/zinc/01/37/59/1355013759.db2.gz	AUOXEABARLYWRU-FUHWJXTLSA-N	0	3	338.455	3.031	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cnn(C(CC)CC)c2C)CC[C@H]1C	ZINC001071976678	1355055040	/nfs/dbraw/zinc/05/50/40/1355055040.db2.gz	GUGCQVXEZDXANV-WBVHZDCISA-N	0	3	344.503	3.159	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(COC)c(F)c2)CC[C@@H]1C	ZINC001072023629	1355086178	/nfs/dbraw/zinc/08/61/78/1355086178.db2.gz	UNPOPZBUQUNAKI-WMLDXEAASA-N	0	3	334.435	3.131	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc(C)n(C(C)C)c2C)CC[C@@H]1C	ZINC001072063220	1355109252	/nfs/dbraw/zinc/10/92/52/1355109252.db2.gz	SNXLNKNVCDJTRX-MAUKXSAKSA-N	0	3	329.488	3.292	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H]1COc2ccccc21	ZINC001089735759	1360640877	/nfs/dbraw/zinc/64/08/77/1360640877.db2.gz	HSLDRYSTPFVAOX-FUHWJXTLSA-N	0	3	342.483	3.346	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@@H](C)[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001072176895	1355171328	/nfs/dbraw/zinc/17/13/28/1355171328.db2.gz	RTOIDDUFUWGQCJ-QAPCUYQASA-N	0	3	345.462	3.318	20	30		EGEDHN
C[C@@H]1CCN(C(=O)c2ccoc2)C[C@H]1CNCc1ccccc1C#N	ZINC001072194138	1355182121	/nfs/dbraw/zinc/18/21/21/1355182121.db2.gz	FXQSEHAXLGUHDW-DNVCBOLYSA-N	0	3	337.423	3.039	20	30		EGEDHN
C/C=C(/C)C(=O)N1CC[C@H](C)[C@@H](CNCc2ccccc2C#N)C1	ZINC001072240545	1355200630	/nfs/dbraw/zinc/20/06/30/1355200630.db2.gz	JIUANBHWQDINFF-LITPMCFQSA-N	0	3	325.456	3.099	20	30		EGEDHN
C[C@@H]1CCN(C(=O)C2(C)CC2)C[C@@H]1CNCc1cc(F)ccc1C#N	ZINC001072288437	1355221912	/nfs/dbraw/zinc/22/19/12/1355221912.db2.gz	LKIKPAHGQAJJEY-PBHICJAKSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](C)[C@H](CNCc2ccn(C(C)C)n2)C1	ZINC001072337094	1355245828	/nfs/dbraw/zinc/24/58/28/1355245828.db2.gz	WJLALXODTCNXRB-IAGOWNOFSA-N	0	3	346.519	3.250	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CN(C(=O)[C@@]45C[C@@H]4CCCC5)C3)C2)cc1	ZINC001072967270	1355528427	/nfs/dbraw/zinc/52/84/27/1355528427.db2.gz	YLAOMUPMINRMCA-UGKGYDQZSA-N	0	3	349.478	3.173	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)C4CCC=CCC4)C3)C2)c1	ZINC001073436804	1355777832	/nfs/dbraw/zinc/77/78/32/1355777832.db2.gz	BTZTZOLLZMCLCY-UHFFFAOYSA-N	0	3	349.478	3.339	20	30		EGEDHN
CCC(C)(CC)C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001073441653	1355780420	/nfs/dbraw/zinc/78/04/20/1355780420.db2.gz	RBENCLKRMOSTBU-UHFFFAOYSA-N	0	3	339.483	3.419	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H](C)Cc3cccc(Cl)c3)C2)C1	ZINC001073489325	1355818685	/nfs/dbraw/zinc/81/86/85/1355818685.db2.gz	SRRXCKDUSZZCTG-INIZCTEOSA-N	0	3	344.886	3.076	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2cc(C)cc(Cl)c2)C1	ZINC001073697879	1355868761	/nfs/dbraw/zinc/86/87/61/1355868761.db2.gz	SAZBCPWEGVQYDU-QGZVFWFLSA-N	0	3	336.863	3.045	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2ccc(C)cc2Cl)C1	ZINC001073777556	1355894241	/nfs/dbraw/zinc/89/42/41/1355894241.db2.gz	UYNAIYRAUMTNSH-OAHLLOKOSA-N	0	3	336.863	3.045	20	30		EGEDHN
CC(C)[C@H](F)C(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(C#N)cc1	ZINC001074053463	1356057050	/nfs/dbraw/zinc/05/70/50/1356057050.db2.gz	TZJNKZAQRNMYBZ-MOPGFXCFSA-N	0	3	345.462	3.365	20	30		EGEDHN
C[C@H]1[C@@H](NCc2ccc(C#N)s2)CCN1C(=O)[C@H]1CC=CCC1	ZINC001074522884	1356203620	/nfs/dbraw/zinc/20/36/20/1356203620.db2.gz	AHCVJYAQZHOCLC-ZQIUZPCESA-N	0	3	329.469	3.055	20	30		EGEDHN
C[C@H]1[C@@H](NCc2ccc(C#N)s2)CCN1C(=O)[C@@H]1CCCC12CC2	ZINC001074709721	1356227688	/nfs/dbraw/zinc/22/76/88/1356227688.db2.gz	NVJLFGFZOGAHRG-JQFCIGGWSA-N	0	3	343.496	3.279	20	30		EGEDHN
C=CCN1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)C2CCC2)C1	ZINC001075419006	1356363290	/nfs/dbraw/zinc/36/32/90/1356363290.db2.gz	NAOZSHGXZOHQKF-IEBWSBKVSA-N	0	3	330.447	3.334	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccc(Cl)c(OC)c3)[C@@H]2C1	ZINC001076325932	1356549102	/nfs/dbraw/zinc/54/91/02/1356549102.db2.gz	DRVYDNFBZBAEOY-GOEBONIOSA-N	0	3	334.847	3.071	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(C3CC3)nc2C)C1	ZINC001099036206	1363586000	/nfs/dbraw/zinc/58/60/00/1363586000.db2.gz	KLMMLHIHGGEQMO-JXFKEZNVSA-N	0	3	325.456	3.038	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)C[C@@H](C)c1ccncc1	ZINC001099125917	1363639146	/nfs/dbraw/zinc/63/91/46/1363639146.db2.gz	MPPAQLIAQNKESQ-SJLPKXTDSA-N	0	3	329.488	3.368	20	30		EGEDHN
CC1(C(=O)N[C@@H]2C[C@@H](NCc3ccc(C#N)cc3F)C23CCC3)CC1	ZINC001078628132	1357040507	/nfs/dbraw/zinc/04/05/07/1357040507.db2.gz	AYHVUNPPQCKMRR-IAGOWNOFSA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cncc(Cl)c2)C12CCC2	ZINC001078746170	1357070279	/nfs/dbraw/zinc/07/02/79/1357070279.db2.gz	ILBUEINAHNFPPH-UONOGXRCSA-N	0	3	340.254	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ncoc2C(C)C)C12CCC2	ZINC001078774567	1357078429	/nfs/dbraw/zinc/07/84/29/1357078429.db2.gz	ZFJPMJLOQXKMBF-QWHCGFSZSA-N	0	3	337.851	3.181	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ncccc2Cl)C12CCC2	ZINC001078785288	1357081014	/nfs/dbraw/zinc/08/10/14/1357081014.db2.gz	AXPYFJVZNSOTLX-STQMWFEESA-N	0	3	340.254	3.118	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2cccc(C)c2C)C[C@H]1c1ccccc1	ZINC001081219855	1357850529	/nfs/dbraw/zinc/85/05/29/1357850529.db2.gz	PCSZWCCOEQMDIK-LEWJYISDSA-N	0	3	332.447	3.134	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2csc3ccccc23)[C@H](OC)C1	ZINC001081998799	1357916480	/nfs/dbraw/zinc/91/64/80/1357916480.db2.gz	JTQAQFQWDHRLNT-IAGOWNOFSA-N	0	3	344.480	3.297	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2c(Cl)oc3ccccc32)[C@H](OC)C1	ZINC001082049798	1357931089	/nfs/dbraw/zinc/93/10/89/1357931089.db2.gz	BERDVXIIRMFUSN-UKRRQHHQSA-N	0	3	348.830	3.091	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CN(CCC3=CCCCC3)C[C@H]2OC)C1	ZINC001082111515	1357949962	/nfs/dbraw/zinc/94/99/62/1357949962.db2.gz	DOVYWVQQIGPAAR-QZTJIDSGSA-N	0	3	332.488	3.049	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2ccc(C)c3ccccc23)[C@H](OC)C1	ZINC001082179315	1357970158	/nfs/dbraw/zinc/97/01/58/1357970158.db2.gz	PJUGPUAOFXURGY-WOJBJXKFSA-N	0	3	338.451	3.153	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2oc3ccccc3c2C)[C@H](OC)C1	ZINC001082357278	1358021747	/nfs/dbraw/zinc/02/17/47/1358021747.db2.gz	QHCNPFNMJSODBQ-SJLPKXTDSA-N	0	3	342.439	3.136	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2cc3c(cccc3C)o2)[C@H](OC)C1	ZINC001082390032	1358025890	/nfs/dbraw/zinc/02/58/90/1358025890.db2.gz	VUKVJLTUEZZWSZ-VQIMIIECSA-N	0	3	342.439	3.136	20	30		EGEDHN
C[C@H](C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1)C(C)(C)C	ZINC001082595120	1358065187	/nfs/dbraw/zinc/06/51/87/1358065187.db2.gz	XFILQSXYXLLKFT-XJKCOSOUSA-N	0	3	333.501	3.238	20	30		EGEDHN
C[C@H](C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1)C1CCCC1	ZINC001082852667	1358099088	/nfs/dbraw/zinc/09/90/88/1358099088.db2.gz	PCFATTMMMUKBNT-QWQRMKEZSA-N	0	3	345.512	3.383	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)C[C@@H](C)c3ccccc3)[C@H]2C1	ZINC001083266107	1358127945	/nfs/dbraw/zinc/12/79/45/1358127945.db2.gz	HSPUMWNBUITWMR-YZGWKJHDSA-N	0	3	342.483	3.058	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)Cc3ccc(C)c(Cl)c3)[C@@H]2C1	ZINC001084445742	1358215716	/nfs/dbraw/zinc/21/57/16/1358215716.db2.gz	FEYMUCXVDIPAAF-SJLPKXTDSA-N	0	3	332.875	3.300	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)Cc3ccc(C(F)F)cc3)[C@@H]2C1	ZINC001084514401	1358230051	/nfs/dbraw/zinc/23/00/51/1358230051.db2.gz	QVBIQYGYPJFXCB-IAGOWNOFSA-N	0	3	334.410	3.276	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)CCc3ccc(Cl)cc3)[C@@H]2C1	ZINC001084554418	1358237436	/nfs/dbraw/zinc/23/74/36/1358237436.db2.gz	SQOIVKBFTBEDNU-SJLPKXTDSA-N	0	3	332.875	3.381	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CCN(C(=O)[C@@H]4CC45CCC5)C[C@@H]32)cc1	ZINC001085044576	1358375136	/nfs/dbraw/zinc/37/51/36/1358375136.db2.gz	BQYVEXSEUKFVPN-AABGKKOBSA-N	0	3	349.478	3.171	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cc(F)ccc1OC	ZINC001085290777	1358454306	/nfs/dbraw/zinc/45/43/06/1358454306.db2.gz	ADHCAAJSZRQFFE-HUUCEWRRSA-N	0	3	340.826	3.217	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cc(F)c(F)cc1F	ZINC001085314279	1358463127	/nfs/dbraw/zinc/46/31/27/1358463127.db2.gz	NQDUCOYSVDBDQV-HUUCEWRRSA-N	0	3	346.780	3.487	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1c(F)ccc(F)c1F	ZINC001085315362	1358463407	/nfs/dbraw/zinc/46/34/07/1358463407.db2.gz	RQTDKNRBLUBDTP-CHWSQXEVSA-N	0	3	346.780	3.487	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cccc(OC)c1F	ZINC001085371344	1358480778	/nfs/dbraw/zinc/48/07/78/1358480778.db2.gz	LANPIERLFUAGIC-ZIAGYGMSSA-N	0	3	340.826	3.217	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)Cc1ccc2c(c1)CCC2	ZINC001085420352	1358494734	/nfs/dbraw/zinc/49/47/34/1358494734.db2.gz	ZSMWOLXBMTXMAV-RTBURBONSA-N	0	3	346.902	3.487	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cccc(NC(=O)CC)c1	ZINC001085629836	1358647088	/nfs/dbraw/zinc/64/70/88/1358647088.db2.gz	DLRFNGYTBUEADA-SFHVURJKSA-N	0	3	343.471	3.148	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)[C@@H]1CCCC[C@@H]1C(F)(F)F	ZINC001085671253	1358675700	/nfs/dbraw/zinc/67/57/00/1358675700.db2.gz	RXUQPMBJQSUSBK-ZNMIVQPWSA-N	0	3	332.410	3.464	20	30		EGEDHN
C=CCOc1ccc(C(=O)N(C)C[C@H]2CCN2CCC2CC2)cc1	ZINC001085678825	1358682609	/nfs/dbraw/zinc/68/26/09/1358682609.db2.gz	SAEXDEBHEWUEOW-GOSISDBHSA-N	0	3	328.456	3.198	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc(C(C)C)nn1CC	ZINC001085694893	1358691084	/nfs/dbraw/zinc/69/10/84/1358691084.db2.gz	UGNATKABXGMEBL-INIZCTEOSA-N	0	3	332.492	3.139	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc2ccccc2n1C	ZINC001085789778	1358764316	/nfs/dbraw/zinc/76/43/16/1358764316.db2.gz	QTEIWGLHKGYGEH-KRWDZBQOSA-N	0	3	325.456	3.291	20	30		EGEDHN
C#Cc1cncc(C(=O)N(C)C[C@@H]2CCN2CCC2CCCCC2)c1	ZINC001085809828	1358787017	/nfs/dbraw/zinc/78/70/17/1358787017.db2.gz	ONTPOYKMRWMUNU-FQEVSTJZSA-N	0	3	339.483	3.180	20	30		EGEDHN
C#Cc1cncc(C(=O)N(C)C[C@H]2CCN2[C@@H](CC)c2ccccc2)c1	ZINC001085809592	1358787358	/nfs/dbraw/zinc/78/73/58/1358787358.db2.gz	IVCCOUDNYUYHDI-RTWAWAEBSA-N	0	3	347.462	3.361	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1ccc(C(C)C)nc1CC	ZINC001085819228	1358793314	/nfs/dbraw/zinc/79/33/14/1358793314.db2.gz	SZRDIJJTCRKJCK-INIZCTEOSA-N	0	3	329.488	3.490	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@H]1CCc2ccccc2C1	ZINC001085844014	1358812150	/nfs/dbraw/zinc/81/21/50/1358812150.db2.gz	BPHDDYNDZUEUBC-PMACEKPBSA-N	0	3	326.484	3.290	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc(C(F)(F)F)ccn1	ZINC001085907370	1358866244	/nfs/dbraw/zinc/86/62/44/1358866244.db2.gz	UQZGQLRGCKWKQO-CQSZACIVSA-N	0	3	341.377	3.213	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccnc(O[C@H](C)CC)c1	ZINC001085915453	1358875805	/nfs/dbraw/zinc/87/58/05/1358875805.db2.gz	BGELRTWSBIOQKP-SJLPKXTDSA-N	0	3	345.487	3.371	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)C1CC(c2cccc(F)c2)C1	ZINC001086001481	1358957000	/nfs/dbraw/zinc/95/70/00/1358957000.db2.gz	ICTTUHKRVWMNCR-TVPLGVNVSA-N	0	3	330.447	3.428	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)C1CC(c2cccc(F)c2)C1	ZINC001086001480	1358957135	/nfs/dbraw/zinc/95/71/35/1358957135.db2.gz	ICTTUHKRVWMNCR-FAFZWHIHSA-N	0	3	330.447	3.428	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2sccc2-n2cccc2)C1	ZINC001086162618	1359011950	/nfs/dbraw/zinc/01/19/50/1359011950.db2.gz	YCUREOAZMQWJCS-OKILXGFUSA-N	0	3	349.887	3.389	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc(Cl)ccc2C)C1	ZINC001086227514	1359033570	/nfs/dbraw/zinc/03/35/70/1359033570.db2.gz	ISHARCUCNBPBDK-XBXGTLAGSA-N	0	3	327.255	3.499	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cccc(-c3cnco3)c2)C1	ZINC001086243430	1359040072	/nfs/dbraw/zinc/04/00/72/1359040072.db2.gz	IWIMEQNQTPMECJ-AKAXFMLLSA-N	0	3	345.830	3.192	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccnc3ccccc32)C1	ZINC001086421375	1359092597	/nfs/dbraw/zinc/09/25/97/1359092597.db2.gz	MTBZNHANGPYZJV-HDJSIYSDSA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@@H]2CCc3cc(F)ccc32)C1	ZINC001086429818	1359095423	/nfs/dbraw/zinc/09/54/23/1359095423.db2.gz	MFMSMDRJKYTSAL-SRCQZFHVSA-N	0	3	336.838	3.092	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(C)c(OCC)c2)C1	ZINC001086495384	1359119575	/nfs/dbraw/zinc/11/95/75/1359119575.db2.gz	RPKVGSLYPKKVLH-KOMQPUFPSA-N	0	3	336.863	3.244	20	30		EGEDHN
CC[C@]1(C)C[C@H]1C(=O)NC[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001086521138	1359129013	/nfs/dbraw/zinc/12/90/13/1359129013.db2.gz	POTZGHVHJQJRBF-JWWIWJDOSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)[C@H]2CC[C@H](C)CC2)C1	ZINC001086537055	1359135478	/nfs/dbraw/zinc/13/54/78/1359135478.db2.gz	LXQIIGUXJHRJSX-ZRQDPWPFSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)C1	ZINC001086562378	1359148231	/nfs/dbraw/zinc/14/82/31/1359148231.db2.gz	OAGVBKUCXPUZOK-OSMBCOQSSA-N	0	3	336.838	3.166	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccc3oc(C)nc3c2)C1	ZINC001086729007	1359192116	/nfs/dbraw/zinc/19/21/16/1359192116.db2.gz	DMZLIFWAFGILLJ-DZGCQCFKSA-N	0	3	347.846	3.377	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ncsc2C2CC2)C1	ZINC001086802203	1359205207	/nfs/dbraw/zinc/20/52/07/1359205207.db2.gz	WKGJCNWCQCQCLO-WCQYABFASA-N	0	3	339.892	3.261	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccc(C(C)C)cn2)C1	ZINC001086802663	1359205226	/nfs/dbraw/zinc/20/52/26/1359205226.db2.gz	UCFXMFGYAUTCAI-GOEBONIOSA-N	0	3	335.879	3.446	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc(C)s3)C2)CC1	ZINC001086898160	1359227672	/nfs/dbraw/zinc/22/76/72/1359227672.db2.gz	BQRXQWYTDNFFFG-OAHLLOKOSA-N	0	3	330.497	3.396	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc4occc4c3)C2)CC1	ZINC001086924711	1359250469	/nfs/dbraw/zinc/25/04/69/1359250469.db2.gz	ZTVRVCQEABGHKS-INIZCTEOSA-N	0	3	336.435	3.383	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc(Cl)cn3C)C2)CC1	ZINC001086931816	1359255794	/nfs/dbraw/zinc/25/57/94/1359255794.db2.gz	RTFRYZYIFXFNAD-OAHLLOKOSA-N	0	3	347.890	3.018	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3ccoc3C3CC3)C2)CC1	ZINC001086939307	1359261782	/nfs/dbraw/zinc/26/17/82/1359261782.db2.gz	MYXFNSJBMFUTOX-INIZCTEOSA-N	0	3	340.467	3.497	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@H](C)c3ccsc3)C2)CC1	ZINC001086941392	1359263116	/nfs/dbraw/zinc/26/31/16/1359263116.db2.gz	SIDWJHPNICJIBK-JKSUJKDBSA-N	0	3	330.497	3.188	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H](F)c3ccccc3)C2)CC1	ZINC001086945756	1359266998	/nfs/dbraw/zinc/26/69/98/1359266998.db2.gz	IEFNWIIWEHBGLU-WMZOPIPTSA-N	0	3	328.431	3.033	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cc4c(C)cccn4c3)C2)CC1	ZINC001086952428	1359272609	/nfs/dbraw/zinc/27/26/09/1359272609.db2.gz	INRFVWSETPXFPB-SFHVURJKSA-N	0	3	349.478	3.198	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc(C)c(CC)o3)C2)CC1	ZINC001086952960	1359273057	/nfs/dbraw/zinc/27/30/57/1359273057.db2.gz	VPIWZANCYFMAKM-MRXNPFEDSA-N	0	3	328.456	3.100	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)Cc3sc(C)cc3C)C2)CC1	ZINC001086954198	1359274735	/nfs/dbraw/zinc/27/47/35/1359274735.db2.gz	FIXVETBXCSVGJF-MRXNPFEDSA-N	0	3	344.524	3.244	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc(F)s3)C2)CC1	ZINC001086958568	1359279842	/nfs/dbraw/zinc/27/98/42/1359279842.db2.gz	UYXDPSBQAHFDQH-CQSZACIVSA-N	0	3	334.460	3.227	20	30		EGEDHN
CC(C)C(=O)N[C@@H]1[C@@H]2CCCN(Cc3cccc(C#N)c3)[C@H]2C1(C)C	ZINC001087273877	1359347768	/nfs/dbraw/zinc/34/77/68/1359347768.db2.gz	HKRWRLNUJULPLS-IPMKNSEASA-N	0	3	339.483	3.319	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3c(C)coc3C)C(C)(C)[C@H]21	ZINC001087286265	1359365300	/nfs/dbraw/zinc/36/53/00/1359365300.db2.gz	OPDKCBKBTPQYFN-NJAFHUGGSA-N	0	3	328.456	3.139	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cccc(F)c1C	ZINC001087288233	1359366909	/nfs/dbraw/zinc/36/69/09/1359366909.db2.gz	TXHLVLYHBVDRRM-NZSAHSFTSA-N	0	3	342.458	3.376	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)Cc3cccc(CC)c3)C(C)(C)[C@@H]21	ZINC001087293190	1359374649	/nfs/dbraw/zinc/37/46/49/1359374649.db2.gz	ZTNKHKWWHHPLPL-HMXCVIKNSA-N	0	3	338.495	3.030	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1c[nH]c2ccccc12	ZINC001087294821	1359375603	/nfs/dbraw/zinc/37/56/03/1359375603.db2.gz	YXICLRSNONQKLI-LSTHTHJFSA-N	0	3	349.478	3.410	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1c(C)oc(C)c1C	ZINC001087295410	1359376027	/nfs/dbraw/zinc/37/60/27/1359376027.db2.gz	JALMGVKNUSLRGD-NZSAHSFTSA-N	0	3	342.483	3.447	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc4cc(C)ccc4[nH]3)C(C)(C)[C@H]21	ZINC001087299664	1359381461	/nfs/dbraw/zinc/38/14/61/1359381461.db2.gz	ZVZOVPXLVFNGBI-AHRSYUTCSA-N	0	3	349.478	3.328	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)Cc3cccc(Cl)c3)C(C)(C)[C@H]21	ZINC001087303067	1359386125	/nfs/dbraw/zinc/38/61/25/1359386125.db2.gz	FTNDAMARMKOESJ-QRQLOZEOSA-N	0	3	344.886	3.121	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc[nH]c3C3CCC3)C(C)(C)[C@H]21	ZINC001087305567	1359391220	/nfs/dbraw/zinc/39/12/20/1359391220.db2.gz	VLBDJMLWZIEJIJ-QRQLOZEOSA-N	0	3	339.483	3.134	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)C3CCC(F)(F)CC3)C(C)(C)[C@H]21	ZINC001087305599	1359391282	/nfs/dbraw/zinc/39/12/82/1359391282.db2.gz	VVJWIWSPSLLUIN-PMPSAXMXSA-N	0	3	338.442	3.050	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc2ccncc2c1	ZINC001087312148	1359400178	/nfs/dbraw/zinc/40/01/78/1359400178.db2.gz	ZTUAEUOTCMVQRT-HSALFYBXSA-N	0	3	347.462	3.087	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)C3(F)CCCCC3)C(C)(C)[C@H]21	ZINC001087313361	1359402147	/nfs/dbraw/zinc/40/21/47/1359402147.db2.gz	SWQNKNARXVZYNK-ZACQAIPSSA-N	0	3	334.479	3.287	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc(Cl)s1	ZINC001087316605	1359407493	/nfs/dbraw/zinc/40/74/93/1359407493.db2.gz	UWKJKNYBQQWLBJ-BYCMXARLSA-N	0	3	336.888	3.254	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3occ4c3CCCC4)C(C)(C)[C@H]21	ZINC001087316662	1359407613	/nfs/dbraw/zinc/40/76/13/1359407613.db2.gz	VXJYYWJFOSQESN-NEWSRXKRSA-N	0	3	340.467	3.010	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc4c(c3)CCC4)C(C)(C)[C@@H]21	ZINC001087317120	1359408108	/nfs/dbraw/zinc/40/81/08/1359408108.db2.gz	CVMZBCSIXWHWNY-VAMGGRTRSA-N	0	3	336.479	3.027	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cncc2ccccc21	ZINC001087317705	1359409184	/nfs/dbraw/zinc/40/91/84/1359409184.db2.gz	LQJCHGBWLKTWOP-YZGWKJHDSA-N	0	3	347.462	3.087	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)C2(C)CC=CC2)C1	ZINC001087436908	1359466042	/nfs/dbraw/zinc/46/60/42/1359466042.db2.gz	RCFKEVTZVVZVRW-WOJBJXKFSA-N	0	3	336.479	3.340	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CN(CCC)CC[C@@H]2c2ccccc2)cn1	ZINC001087442151	1359466209	/nfs/dbraw/zinc/46/62/09/1359466209.db2.gz	VPRCYEQMCAZOPE-NHCUHLMSSA-N	0	3	347.462	3.061	20	30		EGEDHN
C=CCCN1CC[C@@H](c2ccc(OC)c(F)c2)[C@@H](NC(=O)CC)C1	ZINC001087476846	1359483123	/nfs/dbraw/zinc/48/31/23/1359483123.db2.gz	JCLQEGXNVGTBRB-RDJZCZTQSA-N	0	3	334.435	3.095	20	30		EGEDHN
C=CCCN1CC[C@H](NC(=O)c2sc(Cl)nc2C)[C@H]1CC	ZINC001087587401	1359544846	/nfs/dbraw/zinc/54/48/46/1359544846.db2.gz	MQTWYEUUGQQCNC-NWDGAFQWSA-N	0	3	327.881	3.264	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cc(C)n([C@H](C)C3CC3)n2)[C@H]1CC	ZINC001087635074	1359566125	/nfs/dbraw/zinc/56/61/25/1359566125.db2.gz	JCMNDYLZNXWIFW-HHXXYDBFSA-N	0	3	344.503	3.321	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccc(C(F)(F)F)cn2)[C@H]1CC	ZINC001087678821	1359586694	/nfs/dbraw/zinc/58/66/94/1359586694.db2.gz	GKMJWQCTNXQHNB-DZGCQCFKSA-N	0	3	341.377	3.259	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)[C@]2(C)C=CCC2)CCN1Cc1ccc(C#N)cc1	ZINC001087690649	1359591158	/nfs/dbraw/zinc/59/11/58/1359591158.db2.gz	LNTXIZFOCMRCIT-QKNQBKEWSA-N	0	3	337.467	3.384	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(CCOc3ccccc3)[C@@H]2CC)C1	ZINC001087718415	1359609927	/nfs/dbraw/zinc/60/99/27/1359609927.db2.gz	NFCLTXDXXXMSHM-RBUKOAKNSA-N	0	3	342.483	3.391	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2oc(CC(C)C)nc2C)[C@H]1CC	ZINC001087754272	1359629383	/nfs/dbraw/zinc/62/93/83/1359629383.db2.gz	XHEIAIDLYCYIJB-JKSUJKDBSA-N	0	3	333.476	3.340	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3ccc(C)cc3)[C@@H]2CC)cn1	ZINC001087802530	1359652826	/nfs/dbraw/zinc/65/28/26/1359652826.db2.gz	VUCNYVOTERWRDW-LEWJYISDSA-N	0	3	347.462	3.154	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(F)c3occc32)[C@H]1CC	ZINC001087834640	1359670540	/nfs/dbraw/zinc/67/05/40/1359670540.db2.gz	MMCCSRVSMLACKJ-DLBZAZTESA-N	0	3	328.387	3.178	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)[C@H](C)c2cccc(Cl)c2)[C@H]1CC	ZINC001087835582	1359671611	/nfs/dbraw/zinc/67/16/11/1359671611.db2.gz	HAYRGRZJWRGXNY-FHLIZLRMSA-N	0	3	332.875	3.436	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2c(C)oc3ccccc32)[C@H]1CC	ZINC001087852798	1359681380	/nfs/dbraw/zinc/68/13/80/1359681380.db2.gz	JDSULEPCTJCJMM-RBUKOAKNSA-N	0	3	338.451	3.276	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CN(C(=O)C4CCCC4)C[C@@H]3C2)c1	ZINC001087862448	1359685975	/nfs/dbraw/zinc/68/59/75/1359685975.db2.gz	MISOIIGKQHNQSH-UXHICEINSA-N	0	3	337.467	3.029	20	30		EGEDHN
Cc1occc1C(=O)N1C[C@H]2CCN(Cc3ccc(C#N)cc3)C[C@H]2C1	ZINC001087878561	1359693667	/nfs/dbraw/zinc/69/36/67/1359693667.db2.gz	CWZOLOZHNLGQSE-MOPGFXCFSA-N	0	3	349.434	3.054	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CN(C(=O)[C@@H]4CC=CCC4)C[C@@H]3C2)cc1	ZINC001087881581	1359694201	/nfs/dbraw/zinc/69/42/01/1359694201.db2.gz	JPKHAOQEILLYFQ-NJYVYQBISA-N	0	3	349.478	3.195	20	30		EGEDHN
Cc1ccoc1C(=O)N1C[C@H]2CCN(Cc3cccc(C#N)c3)C[C@H]2C1	ZINC001087885891	1359696545	/nfs/dbraw/zinc/69/65/45/1359696545.db2.gz	JOUSKMCVZIKXCT-MOPGFXCFSA-N	0	3	349.434	3.054	20	30		EGEDHN
C[C@H](c1ccccc1F)N1CC[C@@H]2CN(C(=O)C#CC3CC3)C[C@@H]2C1	ZINC001087958689	1359719896	/nfs/dbraw/zinc/71/98/96/1359719896.db2.gz	ABFHTCPHCAJERC-NXHRZFHOSA-N	0	3	340.442	3.080	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CCN(Cc3c(C)noc3C)C[C@H]2C1	ZINC001088064792	1359739730	/nfs/dbraw/zinc/73/97/30/1359739730.db2.gz	VPNKQWCDTJLWBB-SJORKVTESA-N	0	3	345.487	3.174	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CCN(Cc3ccc(F)cc3)C[C@H]2C1	ZINC001088066716	1359741495	/nfs/dbraw/zinc/74/14/95/1359741495.db2.gz	WHYYVHQNPVMMLD-SJORKVTESA-N	0	3	330.447	3.318	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)C[C@H](C)c3ccc(F)cc3)C[C@@H]2C1	ZINC001088210119	1359796220	/nfs/dbraw/zinc/79/62/20/1359796220.db2.gz	YBEGTPIIIUKOJU-UHOSZYNNSA-N	0	3	342.458	3.123	20	30		EGEDHN
C=CCN1CC[C@@H](OCC2CCN(C(=O)C3(CC)CCCC3)CC2)C1	ZINC001088240128	1359812165	/nfs/dbraw/zinc/81/21/65/1359812165.db2.gz	PNWLSKNWTCTBMT-LJQANCHMSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCCCC[C@@H](NCc3cnc(C)nc3)C2)C1	ZINC001088378185	1359861721	/nfs/dbraw/zinc/86/17/21/1359861721.db2.gz	BJUCHOXXCXNUCV-GOSISDBHSA-N	0	3	342.487	3.002	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2ccc3c(c2)CCO3)C1	ZINC001088388604	1359867450	/nfs/dbraw/zinc/86/74/50/1359867450.db2.gz	ZPBZJRAGPFZGSY-QGZVFWFLSA-N	0	3	348.874	3.348	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2cnn(C(C)C)c2)C1	ZINC001088412426	1359883358	/nfs/dbraw/zinc/88/33/58/1359883358.db2.gz	IDCUKFFHTWKKSR-MRXNPFEDSA-N	0	3	338.883	3.191	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)[C@@H]2COc3ccccc32)C1	ZINC001088433781	1359901924	/nfs/dbraw/zinc/90/19/24/1359901924.db2.gz	FTEVTWILDPFVQP-DOTOQJQBSA-N	0	3	348.874	3.276	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](CNCc2csc(CC)n2)[C@H](C)C1	ZINC001184313158	1387427416	/nfs/dbraw/zinc/42/74/16/1387427416.db2.gz	XGQMQNVBRRKZJA-CVEARBPZSA-N	0	3	347.528	3.083	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccc3c(c2)C(C)(C)CO3)[C@H]1C	ZINC001088737887	1360026220	/nfs/dbraw/zinc/02/62/20/1360026220.db2.gz	IWTZGVOAOHSEDH-PBHICJAKSA-N	0	3	328.456	3.125	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2F)[C@H]1C	ZINC001088765059	1360035817	/nfs/dbraw/zinc/03/58/17/1360035817.db2.gz	KWDNZURSXCRLFZ-UOUZQGKXSA-N	0	3	334.410	3.223	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(CCc3ccc(OC)cc3)[C@@H]2C)C1	ZINC001088844437	1360078105	/nfs/dbraw/zinc/07/81/05/1360078105.db2.gz	QTUGUXKFTTVZTD-APWZRJJASA-N	0	3	342.483	3.173	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3ccc(C)c(C)c3)[C@@H]2C)cn1	ZINC001088991435	1360127274	/nfs/dbraw/zinc/12/72/74/1360127274.db2.gz	ZPTXKSYJHYLCFF-UTKZUKDTSA-N	0	3	347.462	3.073	20	30		EGEDHN
Cc1cc(F)ccc1CN(C)C[C@@H]1CCCCN1C(=O)[C@H](C)C#N	ZINC001089139779	1360196752	/nfs/dbraw/zinc/19/67/52/1360196752.db2.gz	MZIQSAIEZRLALQ-QAPCUYQASA-N	0	3	331.435	3.107	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N[C@@H]1CCN(CC#Cc2ccccc2)CC(C)(C)C1	ZINC001089467337	1360451450	/nfs/dbraw/zinc/45/14/50/1360451450.db2.gz	RKRGJYHBZPHPSC-SXLOBPIMSA-N	0	3	338.495	3.301	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2occ3c2CCCC3)CC(C)(C)C1	ZINC001089548405	1360502032	/nfs/dbraw/zinc/50/20/32/1360502032.db2.gz	LABVLMDIXGPYGP-QGZVFWFLSA-N	0	3	342.483	3.402	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(F)c3occc32)CC(C)(C)C1	ZINC001089560870	1360509258	/nfs/dbraw/zinc/50/92/58/1360509258.db2.gz	IWSIQIDAROROPF-CQSZACIVSA-N	0	3	342.414	3.426	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@@H](C)c2cccc(OC)c2)CC(C)(C)C1	ZINC001089567131	1360513499	/nfs/dbraw/zinc/51/34/99/1360513499.db2.gz	WKWWQKHTSZTWRZ-FUHWJXTLSA-N	0	3	342.483	3.039	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1c(C2CC2)cnn1C	ZINC001089651600	1360564046	/nfs/dbraw/zinc/56/40/46/1360564046.db2.gz	HLBBJQQHEFVQIO-INIZCTEOSA-N	0	3	344.503	3.094	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ncc(C)cc1OC	ZINC001089651737	1360564279	/nfs/dbraw/zinc/56/42/79/1360564279.db2.gz	LSGMJDXMJFZYPU-MRXNPFEDSA-N	0	3	345.487	3.195	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)[C@]12CCC[C@H]1OCC2	ZINC001089669503	1360579519	/nfs/dbraw/zinc/57/95/19/1360579519.db2.gz	NWGGONIHGFCPQT-HLIPFELVSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)NC[C@H]1CCC(C)(C)CN1CC=C(C)C	ZINC001089700143	1360603716	/nfs/dbraw/zinc/60/37/16/1360603716.db2.gz	ZTDGSUMTKXNRGS-KURKYZTESA-N	0	3	334.504	3.151	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cn(C(C)C)nc1C	ZINC001089726104	1360629625	/nfs/dbraw/zinc/62/96/25/1360629625.db2.gz	NAXXYNJGKMSURO-KRWDZBQOSA-N	0	3	344.503	3.016	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)/C=C/c1ccco1	ZINC001089758509	1360651836	/nfs/dbraw/zinc/65/18/36/1360651836.db2.gz	RQBDNMKTULAWOR-RPVIMQNBSA-N	0	3	346.858	3.214	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)CCc2ccco2)C1	ZINC001089769283	1360657428	/nfs/dbraw/zinc/65/74/28/1360657428.db2.gz	KAMOFQHBNQWZJO-DKIMLUQUSA-N	0	3	348.874	3.134	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)CCc2ccoc2)C1	ZINC001089790135	1360664555	/nfs/dbraw/zinc/66/45/55/1360664555.db2.gz	QMQYWMYRKAMUAD-XSLAGTTESA-N	0	3	348.874	3.134	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)C2CC(C)(C)C2)C1	ZINC001089807985	1360672550	/nfs/dbraw/zinc/67/25/50/1360672550.db2.gz	DSLBLBBESVAJBS-HJWJTTGWSA-N	0	3	336.907	3.344	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](CNCc2ccn(CC)n2)[C@@H](C)C1	ZINC001184473847	1387468344	/nfs/dbraw/zinc/46/83/44/1387468344.db2.gz	RXCRATOYNJSELP-IRXDYDNUSA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)Cc2occc2C)C1	ZINC001089858461	1360703163	/nfs/dbraw/zinc/70/31/63/1360703163.db2.gz	AZVWJVBGTSRAMH-QAETUUGQSA-N	0	3	348.874	3.052	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CN(CC=C(C)C)CC3(CCOCC3)C2)C1	ZINC001089956219	1360765080	/nfs/dbraw/zinc/76/50/80/1360765080.db2.gz	JGMCTCLDYDAIRV-SFHVURJKSA-N	0	3	346.515	3.296	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)c2ccsc2C)C1	ZINC001091022460	1360981822	/nfs/dbraw/zinc/98/18/22/1360981822.db2.gz	GZIBRKRPSRNUFM-UHFFFAOYSA-N	0	3	343.290	3.063	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc(F)ccc2Cl)C1	ZINC001091251358	1361021696	/nfs/dbraw/zinc/02/16/96/1361021696.db2.gz	DLLIFTYKAUVUIA-UHFFFAOYSA-N	0	3	331.218	3.330	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cccc([C@@H]3CCOC3)c2)C1	ZINC001091106072	1360993274	/nfs/dbraw/zinc/99/32/74/1360993274.db2.gz	GCHZQFPSSKMCHY-ZCDVPAHGSA-N	0	3	348.874	3.041	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc([C@H](C)CC)no2)C1	ZINC001091270082	1361027375	/nfs/dbraw/zinc/02/73/75/1361027375.db2.gz	LEDGYMFPRJPSHP-QFWMXSHPSA-N	0	3	325.840	3.039	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H]2C[C@H]2c2ccc(C)s2)C1	ZINC001091275409	1361029164	/nfs/dbraw/zinc/02/91/64/1361029164.db2.gz	GXDZWDVOAWAXFU-NEXFUWMNSA-N	0	3	338.904	3.397	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccccc2OCC2CC2)C1	ZINC001091377120	1361068206	/nfs/dbraw/zinc/06/82/06/1361068206.db2.gz	ADJYMGRHCBZOAV-UHFFFAOYSA-N	0	3	348.874	3.326	20	30		EGEDHN
C[C@@]12CN(Cc3ccc(C#N)cc3)C[C@@H]1CN(C(=O)C1CCCC1)C2	ZINC001091424166	1361091486	/nfs/dbraw/zinc/09/14/86/1361091486.db2.gz	XGBQJCBMBWGCRV-CTNGQTDRSA-N	0	3	337.467	3.029	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3ccc(C4CCCC4)cc3)C[C@]2(C)C1	ZINC001091859203	1361236678	/nfs/dbraw/zinc/23/66/78/1361236678.db2.gz	WFDMHILEIUODNB-IRLDBZIGSA-N	0	3	336.479	3.371	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CN(Cc3cccc(F)c3)C[C@@]2(C)C1	ZINC001091916337	1361247638	/nfs/dbraw/zinc/24/76/38/1361247638.db2.gz	GRCHHJWWQFCGPM-UZLBHIALSA-N	0	3	330.447	3.318	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@@H](CC)Cc3ccccc3)C[C@]2(C)C1	ZINC001092063050	1361285842	/nfs/dbraw/zinc/28/58/42/1361285842.db2.gz	JIBFLXASMFJYQF-VWPQPMDRSA-N	0	3	338.495	3.059	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc4sccc4c3)C[C@]2(C)C1	ZINC001092157973	1361314656	/nfs/dbraw/zinc/31/46/56/1361314656.db2.gz	XHQGWRRCRRFKGW-XLIONFOSSA-N	0	3	338.476	3.319	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3coc4ccc(Cl)cc34)C[C@]2(C)C1	ZINC001092238709	1361336681	/nfs/dbraw/zinc/33/66/81/1361336681.db2.gz	UZWDPOYWUYBPOH-YJYMSZOUSA-N	0	3	342.826	3.113	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc(C)n(C(C)C)c3C)C[C@]2(C)C1	ZINC001092262132	1361348097	/nfs/dbraw/zinc/34/80/97/1361348097.db2.gz	ITNHEJJKLKANMD-NQIIRXRSSA-N	0	3	341.499	3.103	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)c2ccccc2F)CC1	ZINC001093351436	1361565480	/nfs/dbraw/zinc/56/54/80/1361565480.db2.gz	AMDPMQXHAKYZQR-IBGZPJMESA-N	0	3	340.442	3.166	20	30		EGEDHN
C=C(C)CN1CC2(CCC2)[C@H]1C1CCN(C(=O)C(=O)C(C)(C)C)CC1	ZINC001093361226	1361572509	/nfs/dbraw/zinc/57/25/09/1361572509.db2.gz	IBUYYMOZUSZQBF-QGZVFWFLSA-N	0	3	346.515	3.271	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)c2sccc2F)CC1	ZINC001093370301	1361579234	/nfs/dbraw/zinc/57/92/34/1361579234.db2.gz	RJFWWKCMRXMVOI-QGZVFWFLSA-N	0	3	346.471	3.227	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)[C@@H]2C[C@H]2C2CCC2)CC1	ZINC001093381708	1361593408	/nfs/dbraw/zinc/59/34/08/1361593408.db2.gz	SIBGDOBZTSHQBN-XUVXKRRUSA-N	0	3	340.511	3.149	20	30		EGEDHN
N#Cc1ccc(NC(=O)N2CC[C@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC001184742203	1387524523	/nfs/dbraw/zinc/52/45/23/1387524523.db2.gz	FRIVCXYDLWTNOU-ICSRJNTNSA-N	0	3	346.434	3.296	20	30		EGEDHN
O=C(NC[C@]12CCC[C@H]1N(CC#Cc1ccccc1)CC2)C1CCC1	ZINC001094345807	1361770478	/nfs/dbraw/zinc/77/04/78/1361770478.db2.gz	AVIYTWBABZGRDT-IFMALSPDSA-N	0	3	336.479	3.199	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@]3(CNC(=O)c4ccco4)CCC[C@@H]23)c1	ZINC001094347713	1361771273	/nfs/dbraw/zinc/77/12/73/1361771273.db2.gz	VCFZODSNLNCVDJ-TZIWHRDSSA-N	0	3	349.434	3.326	20	30		EGEDHN
Cc1ccccc1CN1CC[C@H](NC(=O)Nc2ccc(C#N)cc2)C1	ZINC001184774633	1387535522	/nfs/dbraw/zinc/53/55/22/1387535522.db2.gz	QPHSVBKTXGCXIV-IBGZPJMESA-N	0	3	334.423	3.263	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cccc4c3CCCC4)CCC[C@@H]12	ZINC001094424445	1361795624	/nfs/dbraw/zinc/79/56/24/1361795624.db2.gz	VILCKAYMCMKUKH-IFMALSPDSA-N	0	3	336.479	3.173	20	30		EGEDHN
CC#CCN1CC[C@@]2(CNC(=O)c3cc4ccccc4o3)CCC[C@@H]12	ZINC001094574157	1361866057	/nfs/dbraw/zinc/86/60/57/1361866057.db2.gz	UQHOUKMOTPUYNM-TZIWHRDSSA-N	0	3	336.435	3.431	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc(F)c(F)c(F)c1F)C2	ZINC001096404968	1362492206	/nfs/dbraw/zinc/49/22/06/1362492206.db2.gz	QMNKDTWKBOURBS-ICCXJUOJSA-N	0	3	342.336	3.154	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](CNCc2nc(C)cs2)[C@@H](C)C1	ZINC001184977862	1387577940	/nfs/dbraw/zinc/57/79/40/1387577940.db2.gz	FSBXRBOTEUMZEQ-DOTOQJQBSA-N	0	3	347.528	3.219	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1coc3cc(C)c(C)cc13)C2	ZINC001097584361	1363060629	/nfs/dbraw/zinc/06/06/29/1363060629.db2.gz	OQOFNPNSOYCVSZ-LZQZEXGQSA-N	0	3	336.435	3.408	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc3cccc(OC)c3o1)C2	ZINC001097748023	1363113174	/nfs/dbraw/zinc/11/31/74/1363113174.db2.gz	JSJNZFJTEOMYIX-OAGGEKHMSA-N	0	3	340.423	3.353	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1)C2	ZINC001098015342	1363197682	/nfs/dbraw/zinc/19/76/82/1363197682.db2.gz	OOGDHDPZXKNYEW-ZRSRNVLSSA-N	0	3	342.870	3.188	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1c(Cl)cccc1Cl)C2	ZINC001098273640	1363281315	/nfs/dbraw/zinc/28/13/15/1363281315.db2.gz	ZYNKAEFMEAWLRY-DFBGVHRSSA-N	0	3	337.250	3.352	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc(Cl)cc(Cl)c1)C2	ZINC001098273634	1363281409	/nfs/dbraw/zinc/28/14/09/1363281409.db2.gz	ZOIIBYJPGUZRTK-OAGGEKHMSA-N	0	3	337.250	3.352	20	30		EGEDHN
N#Cc1cc(C(=O)NCC2(N3CCSCC3)CCCCC2)cs1	ZINC001324415315	1387619288	/nfs/dbraw/zinc/61/92/88/1387619288.db2.gz	MFXSQBBXXKSETB-UHFFFAOYSA-N	0	3	349.525	3.101	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)C[C@H](NC(=O)C(C)(C)F)c1ccccc1O2	ZINC001098541241	1363363009	/nfs/dbraw/zinc/36/30/09/1363363009.db2.gz	JJSVNDHANPXAFM-JXFKEZNVSA-N	0	3	346.446	3.395	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C(F)=C1CCCC1)C[C@H](C)O2	ZINC001098586190	1363389750	/nfs/dbraw/zinc/38/97/50/1363389750.db2.gz	DTEOVQSBLVKOQE-HNNXBMFYSA-N	0	3	336.451	3.052	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)CC1CC(C)(C)C1)C[C@@H](C)O2	ZINC001098630189	1363407138	/nfs/dbraw/zinc/40/71/38/1363407138.db2.gz	BZNRILZNUYZYDE-MRXNPFEDSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccoc1CCC)C[C@@H](C)O2	ZINC001098655887	1363421128	/nfs/dbraw/zinc/42/11/28/1363421128.db2.gz	NKIOKSFFSUCXRU-MRXNPFEDSA-N	0	3	346.471	3.114	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1cccc(C)c1C)C[C@@H](C)O2	ZINC001098658674	1363422816	/nfs/dbraw/zinc/42/28/16/1363422816.db2.gz	FREOCUSTBIGTGS-QGZVFWFLSA-N	0	3	342.483	3.185	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H]1CCCCC1(C)C)C[C@H](C)O2	ZINC001098664037	1363425616	/nfs/dbraw/zinc/42/56/16/1363425616.db2.gz	MNGRPWAIMANOQB-ROUUACIJSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(C)n([C@@H](C)CC)n2)C1	ZINC001098914284	1363518557	/nfs/dbraw/zinc/51/85/57/1363518557.db2.gz	PSKBAVAILJCJMG-KNBMTAEXSA-N	0	3	344.503	3.323	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2nc3ccccc3cc2C)C1	ZINC001098950072	1363537271	/nfs/dbraw/zinc/53/72/71/1363537271.db2.gz	RAOKYTJXHWNNFN-UWJYYQICSA-N	0	3	335.451	3.314	20	30		EGEDHN
C=CCCC(=O)NC[C@@H]1CCC(C)(C)CN1CCn1nc(C)cc1C	ZINC001098966633	1363544825	/nfs/dbraw/zinc/54/48/25/1363544825.db2.gz	RPTMUOJEBZRTSL-SFHVURJKSA-N	0	3	346.519	3.073	20	30		EGEDHN
C[C@H](C#N)C(=O)NC[C@H]1CCC(C)(C)CN1CCCCC(F)(F)F	ZINC001098982380	1363555044	/nfs/dbraw/zinc/55/50/44/1363555044.db2.gz	KFSQNRPNJYVRCV-ZIAGYGMSSA-N	0	3	347.425	3.485	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CCC[C@]3(NC(=O)[C@H]3CC34CCC4)C2)c1	ZINC001099055772	1363598033	/nfs/dbraw/zinc/59/80/33/1363598033.db2.gz	RGFZLXPRHGSPSG-JQVVWYNYSA-N	0	3	349.478	3.219	20	30		EGEDHN
CC(C)(C)C#CC(=O)NC[C@H]1CCC(C)(C)CN1CCOCC1CC1	ZINC001099070479	1363607004	/nfs/dbraw/zinc/60/70/04/1363607004.db2.gz	YJLIURJBSRCPGQ-GOSISDBHSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)C(C)(C)[C@@H]1CCCCO1	ZINC001099079665	1363611645	/nfs/dbraw/zinc/61/16/45/1363611645.db2.gz	HAPYTVMYKYCDQE-SJORKVTESA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)CCC(C)(F)F	ZINC001099125357	1363637979	/nfs/dbraw/zinc/63/79/79/1363637979.db2.gz	FJUKFQQRJRYEJA-HNNXBMFYSA-N	0	3	346.462	3.231	20	30		EGEDHN
C#CCN1C[C@@H]2CCC[C@]2(NC(=O)CC23CC4CC(CC(C4)C2)C3)C1	ZINC001099133426	1363644261	/nfs/dbraw/zinc/64/42/61/1363644261.db2.gz	MVGUCBRWKHJMRK-UVFKIOKUSA-N	0	3	340.511	3.197	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2cc3[nH]ccc3s2)C1	ZINC001099138197	1363648050	/nfs/dbraw/zinc/64/80/50/1363648050.db2.gz	XBQMXCDYAULLRY-UGSOOPFHSA-N	0	3	329.469	3.390	20	30		EGEDHN
C#CCCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc3cccc(C)c3o2)C1	ZINC001099177825	1363674760	/nfs/dbraw/zinc/67/47/60/1363674760.db2.gz	RDWSQWRDHHKFGZ-UWJYYQICSA-N	0	3	336.435	3.349	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@@]1(C)C=CCC1	ZINC001099183274	1363678987	/nfs/dbraw/zinc/67/89/87/1363678987.db2.gz	TVBVLKJINHPRRJ-PXNSSMCTSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H](C)CC(=C)C	ZINC001099187981	1363679825	/nfs/dbraw/zinc/67/98/25/1363679825.db2.gz	AJNCTEJWHYCWOA-ROUUACIJSA-N	0	3	336.520	3.398	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2cccc(C)c2)C[C@H]1C(F)(F)F	ZINC001099205266	1363692280	/nfs/dbraw/zinc/69/22/80/1363692280.db2.gz	VLXRGJACBPZBCJ-HUUCEWRRSA-N	0	3	326.362	3.164	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H](C)Oc1cccnc1	ZINC001099221318	1363699239	/nfs/dbraw/zinc/69/92/39/1363699239.db2.gz	ZKWPWZPYGDUYLZ-SJORKVTESA-N	0	3	345.487	3.032	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H](C)Oc1cccnc1	ZINC001099221312	1363699555	/nfs/dbraw/zinc/69/95/55/1363699555.db2.gz	ZKWPWZPYGDUYLZ-DLBZAZTESA-N	0	3	345.487	3.032	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2ccc(CCC)s2)C[C@H]1C(F)(F)F	ZINC001099259784	1363720233	/nfs/dbraw/zinc/72/02/33/1363720233.db2.gz	YWWPTUXHNMZFAQ-CHWSQXEVSA-N	0	3	346.418	3.479	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H](C)c1c(C)n[nH]c1C	ZINC001099269931	1363724309	/nfs/dbraw/zinc/72/43/09/1363724309.db2.gz	HETIQWBMTIKGAG-WMLDXEAASA-N	0	3	346.519	3.313	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@@H](C)c2cc(C)oc2C)C[C@H]1C(F)(F)F	ZINC001099321996	1363750454	/nfs/dbraw/zinc/75/04/54/1363750454.db2.gz	GICOZYXBHNYHOW-NILFDRSVSA-N	0	3	344.377	3.165	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2ncsc2C(C)C)C[C@H]1C(F)(F)F	ZINC001099330823	1363754705	/nfs/dbraw/zinc/75/47/05/1363754705.db2.gz	FWWQAGJLAXMWFD-GHMZBOCLSA-N	0	3	347.406	3.045	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)COc1cccc(F)c1	ZINC001099340750	1363760283	/nfs/dbraw/zinc/76/02/83/1363760283.db2.gz	YHUSVESVVIVCTH-QGZVFWFLSA-N	0	3	348.462	3.387	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)C2(C)CCC(C)CC2)C[C@H]1C(F)(F)F	ZINC001099347261	1363763375	/nfs/dbraw/zinc/76/33/75/1363763375.db2.gz	ACKMNODHYCUXJN-MYMJJRTCSA-N	0	3	332.410	3.368	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@@H](C)Cc2ccccc2)C[C@H]1C(F)(F)F	ZINC001099346208	1363763600	/nfs/dbraw/zinc/76/36/00/1363763600.db2.gz	KLYLMOSUVLOQAK-NUEKZKHPSA-N	0	3	340.389	3.030	20	30		EGEDHN
N#Cc1ccccc1CNC[C@]12CCC[C@H]1CN(C(=O)CC1CC1)C2	ZINC001099358313	1363770946	/nfs/dbraw/zinc/77/09/46/1363770946.db2.gz	VPHXCMHGLWFCPC-FPOVZHCZSA-N	0	3	337.467	3.077	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H](OC)C1CCCCC1	ZINC001099380850	1363782179	/nfs/dbraw/zinc/78/21/79/1363782179.db2.gz	WNAIJKHOAIKSLE-RTBURBONSA-N	0	3	348.531	3.212	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@H](OC)C1CCCCC1	ZINC001099380849	1363782300	/nfs/dbraw/zinc/78/23/00/1363782300.db2.gz	WNAIJKHOAIKSLE-RBUKOAKNSA-N	0	3	348.531	3.212	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)CCC(C)(F)F	ZINC001099496178	1363821106	/nfs/dbraw/zinc/82/11/06/1363821106.db2.gz	INNIFWQQILUIGP-XQLPTFJDSA-N	0	3	346.849	3.343	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)C[C@H](C)C(C)C)C1	ZINC001100172020	1364035089	/nfs/dbraw/zinc/03/50/89/1364035089.db2.gz	UGPXYEDEDJVGGC-XGNXJENSSA-N	0	3	331.298	3.062	20	30		EGEDHN
CCC[C@H](C)CC(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100175852	1364036312	/nfs/dbraw/zinc/03/63/12/1364036312.db2.gz	SECHIVLDWGTPAL-VQSBYGRUSA-N	0	3	344.474	3.488	20	30		EGEDHN
C=CCOCC(=O)NCC1CC(N[C@@H](C)c2ccccc2Cl)C1	ZINC001100187584	1364039464	/nfs/dbraw/zinc/03/94/64/1364039464.db2.gz	CKSKMZPKCQZBDZ-NFOMZHRRSA-N	0	3	336.863	3.088	20	30		EGEDHN
C#CCCCCC(=O)NCC1CC(NCc2cc(F)ccc2OC)C1	ZINC001100260669	1364061148	/nfs/dbraw/zinc/06/11/48/1364061148.db2.gz	IPAWAJIBCWLUSF-UHFFFAOYSA-N	0	3	346.446	3.012	20	30		EGEDHN
C#CCCCC(=O)NCC1CC(N[C@@H]2CCc3c2c(F)ccc3F)C1	ZINC001100283143	1364066973	/nfs/dbraw/zinc/06/69/73/1364066973.db2.gz	CGKXCBRPALIBSX-WTNGLUPJSA-N	0	3	346.421	3.240	20	30		EGEDHN
C#CCCCC(=O)NCC1CC(NCc2ccc(F)cc2Cl)C1	ZINC001100283252	1364067100	/nfs/dbraw/zinc/06/71/00/1364067100.db2.gz	HRCKAIWBZAFPIX-UHFFFAOYSA-N	0	3	336.838	3.267	20	30		EGEDHN
CC(C)C#CC(=O)NCC1CC(NCc2ccc(F)cc2Cl)C1	ZINC001100309152	1364076172	/nfs/dbraw/zinc/07/61/72/1364076172.db2.gz	JTIUDZLIAFKQEQ-UHFFFAOYSA-N	0	3	336.838	3.123	20	30		EGEDHN
C[C@@]1(C(=O)NCC2CC(NCC#Cc3ccccc3)C2)CC=CCC1	ZINC001100359735	1364090525	/nfs/dbraw/zinc/09/05/25/1364090525.db2.gz	KGCKKUPTLLSIBH-QETWGEEDSA-N	0	3	336.479	3.269	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C/C=C\c2ccccc2F)C1	ZINC001100441488	1364116522	/nfs/dbraw/zinc/11/65/22/1364116522.db2.gz	SEKUXJLDGOMANT-XQRVVYSFSA-N	0	3	336.838	3.466	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C[C@H]2CCOc3ccccc32)C1	ZINC001100564618	1364164237	/nfs/dbraw/zinc/16/42/37/1364164237.db2.gz	OPORZXMBDDDPMG-HWOWSKLDSA-N	0	3	348.874	3.180	20	30		EGEDHN
CC(C)=C(C)CC(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1	ZINC001100576325	1364170290	/nfs/dbraw/zinc/17/02/90/1364170290.db2.gz	XEVGTBUQOHUYJN-UHFFFAOYSA-N	0	3	343.446	3.428	20	30		EGEDHN
C=CCCCC(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1	ZINC001100623270	1364193988	/nfs/dbraw/zinc/19/39/88/1364193988.db2.gz	GSAVSYQYXJLTLS-UHFFFAOYSA-N	0	3	329.419	3.038	20	30		EGEDHN
C=CCCC1(C(=O)NCC2CC(NCc3cccc(Cl)n3)C2)CC1	ZINC001100642775	1364201274	/nfs/dbraw/zinc/20/12/74/1364201274.db2.gz	NUEVIJLLXGGHJS-UHFFFAOYSA-N	0	3	347.890	3.466	20	30		EGEDHN
C=CCC1(C(=O)NCC2CC(NCc3c(C)noc3C)C2)CCC1	ZINC001100648654	1364204590	/nfs/dbraw/zinc/20/45/90/1364204590.db2.gz	PYXDWBOTYPBCTD-UHFFFAOYSA-N	0	3	331.460	3.022	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)[C@H](C)C2CCCC2)C1	ZINC001100853645	1364292629	/nfs/dbraw/zinc/29/26/29/1364292629.db2.gz	RFINHLNBBQNKBW-DNOWBOINSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)Cc2ccc(Cl)cc2)C1	ZINC001100933177	1364337003	/nfs/dbraw/zinc/33/70/03/1364337003.db2.gz	VVHPVWLGKKZIHZ-UHFFFAOYSA-N	0	3	327.255	3.119	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)Cc2nsc3ccccc32)C1	ZINC001101015170	1364374409	/nfs/dbraw/zinc/37/44/09/1364374409.db2.gz	KUUGGQFBEAELOR-UHFFFAOYSA-N	0	3	349.887	3.076	20	30		EGEDHN
C=CCOc1ccc(CC(=O)NCC2CC(NCC(=C)Cl)C2)cc1	ZINC001101047950	1364391127	/nfs/dbraw/zinc/39/11/27/1364391127.db2.gz	SJYDOBMOFYYWTD-UHFFFAOYSA-N	0	3	348.874	3.031	20	30		EGEDHN
C=CCN1CC[C@H](Oc2ccnc(CNC(=O)[C@H](CC)CCC)c2)C1	ZINC001101097513	1364413711	/nfs/dbraw/zinc/41/37/11/1364413711.db2.gz	UQGMCGZKLSBGFW-APWZRJJASA-N	0	3	345.487	3.163	20	30		EGEDHN
CC(C)CCC(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@@]2(C)C1	ZINC001101121789	1364419684	/nfs/dbraw/zinc/41/96/84/1364419684.db2.gz	YNAGKLSXCROLIO-CTNGQTDRSA-N	0	3	339.483	3.275	20	30		EGEDHN
CC/C=C(\C)C(=O)N1C[C@H]2CN(Cc3ccc(C#N)cc3)C[C@@]2(C)C1	ZINC001101152385	1364434018	/nfs/dbraw/zinc/43/40/18/1364434018.db2.gz	BPKMUBNKGJJXRD-WADBLCAHSA-N	0	3	337.467	3.195	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@H]2CN(Cc3ncccc3C)C[C@@]2(C)C1	ZINC001101253192	1364487141	/nfs/dbraw/zinc/48/71/41/1364487141.db2.gz	IHXMYDOZQKNJDF-XLIONFOSSA-N	0	3	327.472	3.027	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1CC2(CN(C[C@@H](C)CC)C2)n2ccnc21	ZINC001101635214	1364663628	/nfs/dbraw/zinc/66/36/28/1364663628.db2.gz	CVHDSLAKZRFNLZ-HOTGVXAUSA-N	0	3	344.503	3.103	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CC2(CN(CCC(C)C)C2)n2ccnc21	ZINC001101639722	1364666535	/nfs/dbraw/zinc/66/65/35/1364666535.db2.gz	MCAMAKZVHITFAS-IAGOWNOFSA-N	0	3	344.503	3.103	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2cccc(Cl)c2)C[C@H]1CNC(=O)CC1CC1	ZINC001101672524	1364683635	/nfs/dbraw/zinc/68/36/35/1364683635.db2.gz	QGXCWBKHEWJVPP-CRAIPNDOSA-N	0	3	344.886	3.176	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@@H]1CN([C@H](C)c2ccc(F)c(F)c2)C[C@H]1C	ZINC001101943230	1364784368	/nfs/dbraw/zinc/78/43/68/1364784368.db2.gz	NCJSHDJWVCDXNT-BFYDXBDKSA-N	0	3	348.437	3.369	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@@H]1CN(Cc2c(C)noc2CC)C[C@H]1C	ZINC001102263016	1364975315	/nfs/dbraw/zinc/97/53/15/1364975315.db2.gz	RTMXYPYVTOABOA-DJIMGWMZSA-N	0	3	347.503	3.332	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H]2CN(Cc3ccccn3)C[C@H]2C)CCC1	ZINC001102330203	1365005011	/nfs/dbraw/zinc/00/50/11/1365005011.db2.gz	IRIOBWUACNYTJI-IAGOWNOFSA-N	0	3	327.472	3.012	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H]2CN(Cc3cc(C)no3)C[C@H]2C)CCCC1	ZINC001102620399	1365138841	/nfs/dbraw/zinc/13/88/41/1365138841.db2.gz	DFTQXRREKNQYCJ-NVXWUHKLSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](NCc3ccc(F)c(F)c3)C2)CCC1	ZINC001185462817	1387721819	/nfs/dbraw/zinc/72/18/19/1387721819.db2.gz	AHDZZJVUEPQNSD-OAHLLOKOSA-N	0	3	334.410	3.402	20	30		EGEDHN
CCCCC(=O)NCC[C@@H]1CN(Cc2ccc(C#N)cc2F)C[C@H]1C	ZINC001102670705	1365164026	/nfs/dbraw/zinc/16/40/26/1365164026.db2.gz	NTUFEQZTEYREPA-NVXWUHKLSA-N	0	3	345.462	3.462	20	30		EGEDHN
CCCCC(=O)NCC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001102670643	1365164137	/nfs/dbraw/zinc/16/41/37/1365164137.db2.gz	KXOZQCZIODQHPE-HUUCEWRRSA-N	0	3	333.501	3.384	20	30		EGEDHN
C=CCCC(=O)NCC[C@@H]1CN(Cc2cc(F)ccc2OC)C[C@H]1C	ZINC001102764218	1365208040	/nfs/dbraw/zinc/20/80/40/1365208040.db2.gz	LJBXZNGCHORKHZ-HZPDHXFCSA-N	0	3	348.462	3.375	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)C2C(C)(C)C2(C)C)C1	ZINC001102830222	1365242012	/nfs/dbraw/zinc/24/20/12/1365242012.db2.gz	NNVRXQQBFVTTJN-TZMCWYRMSA-N	0	3	326.912	3.495	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1CCNC(=O)C1(C)CC1	ZINC001103013531	1365337338	/nfs/dbraw/zinc/33/73/38/1365337338.db2.gz	HSTYXEBEUIBCCX-SJLPKXTDSA-N	0	3	342.458	3.052	20	30		EGEDHN
C=C(C)CCC(=O)NCC[C@@H]1CN(Cc2cccnc2OC)C[C@H]1C	ZINC001103040470	1365351716	/nfs/dbraw/zinc/35/17/16/1365351716.db2.gz	YFJALKPKULYMAQ-IAGOWNOFSA-N	0	3	345.487	3.021	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2nc(C)sc2C)C1	ZINC001103135725	1365400699	/nfs/dbraw/zinc/40/06/99/1365400699.db2.gz	VWLWMWQCYFRTFE-QMTHXVAHSA-N	0	3	341.908	3.200	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1CCNC(=O)CCCF	ZINC001103324018	1365495000	/nfs/dbraw/zinc/49/50/00/1365495000.db2.gz	HVFLRYGFRGDSMR-SJLPKXTDSA-N	0	3	348.437	3.001	20	30		EGEDHN
CC(C)[C@H](F)C(=O)NCC[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1C	ZINC001103335697	1365503933	/nfs/dbraw/zinc/50/39/33/1365503933.db2.gz	NCAAHDHDAZBBJK-SUMDDJOVSA-N	0	3	345.462	3.127	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)CCCc2cccnc2)C1	ZINC001103583317	1365652239	/nfs/dbraw/zinc/65/22/39/1365652239.db2.gz	PRYNNJFDXHOHBP-CRAIPNDOSA-N	0	3	349.906	3.231	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2ccc(Cl)cn2)C1	ZINC001103660839	1365709371	/nfs/dbraw/zinc/70/93/71/1365709371.db2.gz	XTLMEAJKRHBNGV-DGCLKSJQSA-N	0	3	342.270	3.175	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CN(C(=O)C2CCCC2)C[C@H]1C	ZINC001103810388	1365791660	/nfs/dbraw/zinc/79/16/60/1365791660.db2.gz	MNIGRJPSDMKQKW-IUODEOHRSA-N	0	3	343.309	3.159	20	30		EGEDHN
CCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2ccc(C#N)cc2F)C1	ZINC001103892921	1365826476	/nfs/dbraw/zinc/82/64/76/1365826476.db2.gz	ZZLGUTNHGWLFNE-CRAIPNDOSA-N	0	3	345.462	3.462	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CN(C(=O)C2=CCCC2)C[C@H]1C	ZINC001104067528	1365897855	/nfs/dbraw/zinc/89/78/55/1365897855.db2.gz	WCTDHXCLZQZVCM-IUODEOHRSA-N	0	3	341.293	3.080	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2ccncc2Cl)C1	ZINC001104124428	1365918132	/nfs/dbraw/zinc/91/81/32/1365918132.db2.gz	JOBDQIWPOBMDJC-NVXWUHKLSA-N	0	3	347.890	3.113	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)[C@H](CCNCc2conc2CC)C1	ZINC001104245351	1365966908	/nfs/dbraw/zinc/96/69/08/1365966908.db2.gz	DDRRKKKJLLKBFX-HZPDHXFCSA-N	0	3	333.476	3.168	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)[C@H](C)C(F)(F)F)C[C@H]1C	ZINC001104511058	1366055454	/nfs/dbraw/zinc/05/54/54/1366055454.db2.gz	CLYZBGOJZKLLCF-ADEWGFFLSA-N	0	3	326.790	3.012	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H](C)[C@H](CCNCc2oc(C)nc2C)C1	ZINC001104631630	1366110703	/nfs/dbraw/zinc/11/07/03/1366110703.db2.gz	VNSYWAYRXCTITH-WIBUTAKZSA-N	0	3	347.503	3.468	20	30		EGEDHN
CC(C)CC(=O)NCC1(C)CCN(Cc2cccc(C#N)c2)CC1	ZINC001324841339	1387788700	/nfs/dbraw/zinc/78/87/00/1387788700.db2.gz	XJHBAELFLMTHAM-UHFFFAOYSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cc3ccccn3c2)C[C@H]1C	ZINC001104751489	1366156678	/nfs/dbraw/zinc/15/66/78/1366156678.db2.gz	SVFWIRYGXSISQY-GDBMZVCRSA-N	0	3	345.874	3.380	20	30		EGEDHN
CC(C)CCC(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001105807601	1366592304	/nfs/dbraw/zinc/59/23/04/1366592304.db2.gz	ZHPAQGUHZRIIEN-VQIMIIECSA-N	0	3	327.472	3.179	20	30		EGEDHN
CC/C(C)=C/C(=O)N1C[C@@H](CNCc2cc(F)ccc2C#N)[C@H](C)C1	ZINC001106093700	1366610692	/nfs/dbraw/zinc/61/06/92/1366610692.db2.gz	JHOAIWJXQGZPBQ-SMODISSLSA-N	0	3	343.446	3.238	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001106550040	1366730862	/nfs/dbraw/zinc/73/08/62/1366730862.db2.gz	JNMXWKZTYBGRRB-AJRXHNNOSA-N	0	3	337.467	3.265	20	30		EGEDHN
CC#CCCCC(=O)N1C[C@@H](CNC/C(Cl)=C/Cl)[C@H](C)C1	ZINC001106559480	1366735378	/nfs/dbraw/zinc/73/53/78/1366735378.db2.gz	WMGJNDFOZRISLB-XPWVWULPSA-N	0	3	331.287	3.183	20	30		EGEDHN
C#CCCCCC(=O)NC[C@]12CCC[C@H]1N(Cc1cncs1)CC2	ZINC001107373051	1366945587	/nfs/dbraw/zinc/94/55/87/1366945587.db2.gz	YMFCLJPIKBLWSE-IEBWSBKVSA-N	0	3	345.512	3.198	20	30		EGEDHN
C#CCCCC(=O)NC[C@]12CCC[C@H]1N(Cc1cnc(C)s1)CC2	ZINC001107383827	1366948064	/nfs/dbraw/zinc/94/80/64/1366948064.db2.gz	IEJMSOCOJNXXFN-IEBWSBKVSA-N	0	3	345.512	3.116	20	30		EGEDHN
O=C(C#CC1CC1)NC[C@]12CCC[C@H]1N(Cc1ccc(F)cc1)CC2	ZINC001107398378	1366952322	/nfs/dbraw/zinc/95/23/22/1366952322.db2.gz	RESXYFZHDDZPPV-TZIWHRDSSA-N	0	3	340.442	3.100	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@]12CCC[C@H]1N(Cc1ocnc1C)CC2	ZINC001107514540	1367012841	/nfs/dbraw/zinc/01/28/41/1367012841.db2.gz	LDPTXTLIHRJONP-QKYXUNIQSA-N	0	3	345.487	3.446	20	30		EGEDHN
CCC[C@@H](C(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1)C(C)C	ZINC001186019143	1387847092	/nfs/dbraw/zinc/84/70/92/1387847092.db2.gz	LXCUZCIFZNSJMZ-QZTJIDSGSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@]23CCC[C@H]2N(Cc2cc(C)no2)CC3)C1	ZINC001107543269	1367034113	/nfs/dbraw/zinc/03/41/13/1367034113.db2.gz	CTSRHKWVVPOSGG-YLJYHZDGSA-N	0	3	343.471	3.200	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@]23CCC[C@H]2N(Cc2ocnc2C)CC3)C1	ZINC001107543787	1367035003	/nfs/dbraw/zinc/03/50/03/1367035003.db2.gz	ZSRDUJOVXQFAHM-YLJYHZDGSA-N	0	3	343.471	3.200	20	30		EGEDHN
CC[C@H](C)CC(=O)N1CC[C@@H](N(C)Cc2ccc(OCC#N)cc2)C1	ZINC001189855631	1367119173	/nfs/dbraw/zinc/11/91/73/1367119173.db2.gz	BBPMLCWUOLPXJR-FUHWJXTLSA-N	0	3	343.471	3.058	20	30		EGEDHN
CC[C@@H](C)CC(=O)N1CC[C@H](N(C)Cc2ccc(OCC#N)cc2)C1	ZINC001189855629	1367119793	/nfs/dbraw/zinc/11/97/93/1367119793.db2.gz	BBPMLCWUOLPXJR-AEFFLSMTSA-N	0	3	343.471	3.058	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](N(C)Cc2cccc(OC(C)C)c2)C1	ZINC001189910110	1367128911	/nfs/dbraw/zinc/12/89/11/1367128911.db2.gz	LSFYNKKNHAHYOX-IBGZPJMESA-N	0	3	342.483	3.310	20	30		EGEDHN
CCCC[C@H](C)C(=O)N1CC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001189972177	1367142797	/nfs/dbraw/zinc/14/27/97/1367142797.db2.gz	FYBWAZSVQOJLNO-LPHOPBHVSA-N	0	3	327.472	3.417	20	30		EGEDHN
CCCCCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1coc(OCC)n1)C2	ZINC001109487538	1367154586	/nfs/dbraw/zinc/15/45/86/1367154586.db2.gz	XUOJZAWSPNZHFE-VYDXJSESSA-N	0	3	349.475	3.379	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@H](N(C)[C@H]2CCc3c2cc(F)cc3F)C1	ZINC001190045683	1367159201	/nfs/dbraw/zinc/15/92/01/1367159201.db2.gz	AQWJYUZQBIMQNV-KXBFYZLASA-N	0	3	346.421	3.144	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2cccc(C)c2F)C1	ZINC001107961123	1367218637	/nfs/dbraw/zinc/21/86/37/1367218637.db2.gz	SOCIYVRDUWCQLJ-OXJNMPFZSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@]1(C)CN(C[C@@H](C)CC(C)C)CCO1	ZINC001107970887	1367224971	/nfs/dbraw/zinc/22/49/71/1367224971.db2.gz	KWIOQVBVSXYYLL-FXAWDEMLSA-N	0	3	338.536	3.478	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H](N(C)CCOCCC(C)C)C1	ZINC001190355214	1367238011	/nfs/dbraw/zinc/23/80/11/1367238011.db2.gz	WDZJPCDTZYGOHO-MRXNPFEDSA-N	0	3	344.927	3.361	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CC1CC(F)(F)C1	ZINC001109633142	1367252385	/nfs/dbraw/zinc/25/23/85/1367252385.db2.gz	PYAIREAYRRMXEL-UKMLZYKCSA-N	0	3	326.431	3.356	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](N(C)CCOCc2ccccc2)C1	ZINC001190397839	1367253218	/nfs/dbraw/zinc/25/32/18/1367253218.db2.gz	PHOSWFTVDAQJGZ-IBGZPJMESA-N	0	3	344.499	3.338	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001190398620	1367254302	/nfs/dbraw/zinc/25/43/02/1367254302.db2.gz	ZGBDCYUWVCXXKM-SFHVURJKSA-N	0	3	325.456	3.193	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](N(C)Cc2cccc3c2CCOC3)C1	ZINC001190436582	1367264860	/nfs/dbraw/zinc/26/48/60/1367264860.db2.gz	XEZBIDKLHVYZMW-IBGZPJMESA-N	0	3	342.483	3.148	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@]1(C)CN(CC2CCCCC2)CCO1	ZINC001108149404	1367310846	/nfs/dbraw/zinc/31/08/46/1367310846.db2.gz	VLIQVYVWINYXDX-FXAWDEMLSA-N	0	3	336.520	3.376	20	30		EGEDHN
CCCCCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc(COC)on1)C2	ZINC001109809307	1367334880	/nfs/dbraw/zinc/33/48/80/1367334880.db2.gz	NWUGPOIYQXQGRY-HFTRVMKXSA-N	0	3	349.475	3.127	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2ccc(F)cc2C)C1	ZINC001108353459	1367406570	/nfs/dbraw/zinc/40/65/70/1367406570.db2.gz	IQZVRVGWYNNCTD-OXJNMPFZSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2cccc(C)c2C)C1	ZINC001108374381	1367422235	/nfs/dbraw/zinc/42/22/35/1367422235.db2.gz	KQYGPXIIGYWOOR-UWJYYQICSA-N	0	3	344.499	3.479	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCn1ccc3ccccc31)C2	ZINC001110082540	1367496817	/nfs/dbraw/zinc/49/68/17/1367496817.db2.gz	SDVCIHUMYVBWTE-HBFSDRIKSA-N	0	3	337.467	3.329	20	30		EGEDHN
C=CC[C@@H](C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCCF)c1ccccc1	ZINC001110130819	1367514291	/nfs/dbraw/zinc/51/42/91/1367514291.db2.gz	GDBIOWOIUAOPCO-YRXWBPOGSA-N	0	3	330.447	3.427	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N1CC[C@H](N(C)Cc2ccc(F)cc2)C1	ZINC001191577856	1367534062	/nfs/dbraw/zinc/53/40/62/1367534062.db2.gz	XFLKKSPBPVMFPA-AZUAARDMSA-N	0	3	348.462	3.087	20	30		EGEDHN
C=CCCCCC[N@@H+]1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccccc1[O-])C2	ZINC001110289452	1367614094	/nfs/dbraw/zinc/61/40/94/1367614094.db2.gz	KPTASXMUTPDGKW-NXHRZFHOSA-N	0	3	328.456	3.474	20	30		EGEDHN
C=CCCCCC[N@H+]1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccccc1[O-])C2	ZINC001110289452	1367614104	/nfs/dbraw/zinc/61/41/04/1367614104.db2.gz	KPTASXMUTPDGKW-NXHRZFHOSA-N	0	3	328.456	3.474	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@@H](N(C)Cc2cccc(OC)c2)C1	ZINC001191911249	1367635771	/nfs/dbraw/zinc/63/57/71/1367635771.db2.gz	DCDQDGPWWZADJK-FUHWJXTLSA-N	0	3	330.472	3.330	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccc(COC)cc1	ZINC001110368537	1367671813	/nfs/dbraw/zinc/67/18/13/1367671813.db2.gz	DZQAGWJGTPCWNJ-QRVBRYPASA-N	0	3	328.456	3.021	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](N(C)CCc2c(F)cccc2F)C1	ZINC001192094025	1367686668	/nfs/dbraw/zinc/68/66/68/1367686668.db2.gz	PAWAUEHYPWERHS-OAHLLOKOSA-N	0	3	336.426	3.396	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@H](N(C)Cc3cccc(C#N)c3)C2)CC1	ZINC001192180593	1367707895	/nfs/dbraw/zinc/70/78/95/1367707895.db2.gz	JLZJYXKUXRVXDX-IBGZPJMESA-N	0	3	337.467	3.337	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](N(C)CCOCCC(C)C)C2)CCC1	ZINC001192189650	1367712380	/nfs/dbraw/zinc/71/23/80/1367712380.db2.gz	HFUQZAWKUSDBQW-GOSISDBHSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](N(C)CCc3csc(C)n3)C2)CCC1	ZINC001192218521	1367721748	/nfs/dbraw/zinc/72/17/48/1367721748.db2.gz	RCRUMYWMOOHNIC-KRWDZBQOSA-N	0	3	347.528	3.273	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)C[C@@H](C)CCC=C(C)C)C1	ZINC001192472026	1367792007	/nfs/dbraw/zinc/79/20/07/1367792007.db2.gz	JIIHHBZNETVOGJ-RBUKOAKNSA-N	0	3	336.520	3.494	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)C[C@H](C)C2CCCCC2)C1	ZINC001192800821	1367876956	/nfs/dbraw/zinc/87/69/56/1367876956.db2.gz	IYDXFDUTMYANLV-HKUYNNGSSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2ccc3sccc3c2)C1	ZINC001193196574	1367964151	/nfs/dbraw/zinc/96/41/51/1367964151.db2.gz	ZCBVLJZSEDANKN-QGZVFWFLSA-N	0	3	344.480	3.250	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)C[C@H]2CCCC(C)(C)C2)C1	ZINC001193461122	1368034777	/nfs/dbraw/zinc/03/47/77/1368034777.db2.gz	FIXGUQZIHYTGLL-MSOLQXFVSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CC1=CCCCC1	ZINC001110863360	1368042715	/nfs/dbraw/zinc/04/27/15/1368042715.db2.gz	GFDDYYIFRUSMPB-BNDYYXHWSA-N	0	3	346.515	3.437	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2oc3ccccc3c2C)C1	ZINC001193865401	1368133613	/nfs/dbraw/zinc/13/36/13/1368133613.db2.gz	NFOOWIPZTCYYCV-INIZCTEOSA-N	0	3	342.439	3.090	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3C[C@@H]2CC(C)(C)CO2)CCC1	ZINC001110987668	1368134967	/nfs/dbraw/zinc/13/49/67/1368134967.db2.gz	ZKNROXARZIZNNY-XDNAFOTISA-N	0	3	346.515	3.269	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](CC)Cc1cccc(C)c1)C2	ZINC001111109120	1368161044	/nfs/dbraw/zinc/16/10/44/1368161044.db2.gz	HJGLFLZCMZHZRV-NCYKPQTJSA-N	0	3	338.495	3.309	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N2CC[C@H](N(C)CC=C(C)C)C2)cc1	ZINC001194337177	1368236271	/nfs/dbraw/zinc/23/62/71/1368236271.db2.gz	PYGTZJKNARREHZ-IBGZPJMESA-N	0	3	342.483	3.293	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)Oc1ccc(Br)cc1	ZINC001194617840	1368298153	/nfs/dbraw/zinc/29/81/53/1368298153.db2.gz	PEXTVOKGHWQGBG-ZDUSSCGKSA-N	0	3	339.233	3.188	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](C)Cc1ccc(OC)cc1)C2	ZINC001111435521	1368306288	/nfs/dbraw/zinc/30/62/88/1368306288.db2.gz	RGPAKJUQVDUJJY-QOJCHSLYSA-N	0	3	342.483	3.171	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](CC)c1ccc(F)cc1)C2	ZINC001111479115	1368316717	/nfs/dbraw/zinc/31/67/17/1368316717.db2.gz	HENDTFMSHZZNPY-MKXGPGLRSA-N	0	3	328.431	3.064	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](C)CCOc1ccccc1)C2	ZINC001111514912	1368323043	/nfs/dbraw/zinc/32/30/43/1368323043.db2.gz	CMCXTLAHFHAXKI-CUDHKJQZSA-N	0	3	342.483	3.389	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3C[C@@H]2CCCCO2)CCCC1	ZINC001111522834	1368325227	/nfs/dbraw/zinc/32/52/27/1368325227.db2.gz	LDFBDFNTVIVMAP-HCXYKTFWSA-N	0	3	346.515	3.414	20	30		EGEDHN
C=CCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1cnccc1C)C2	ZINC001111855897	1368508597	/nfs/dbraw/zinc/50/85/97/1368508597.db2.gz	RDORRCCVWQNNRD-ICSRJNTNSA-N	0	3	327.472	3.217	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CCC3CCCCCC3)C[C@H]2O)CCC1	ZINC001195939842	1368520553	/nfs/dbraw/zinc/52/05/53/1368520553.db2.gz	JBXOVNMLFXTQEW-RTBURBONSA-N	0	3	348.531	3.255	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCCN(CCCCCOC)CC1	ZINC001195957823	1368522662	/nfs/dbraw/zinc/52/26/62/1368522662.db2.gz	JPDHKADKSSYYOH-UHFFFAOYSA-N	0	3	330.900	3.116	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2cc(C)n([C@H](C)CC)n2)CC1	ZINC001196381847	1368601912	/nfs/dbraw/zinc/60/19/12/1368601912.db2.gz	GHHNZXAZNRPKSG-MRXNPFEDSA-N	0	3	332.492	3.277	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)[C@@H]2CCC=CCCC2)C[C@H]1C(F)(F)F	ZINC001112121403	1368669117	/nfs/dbraw/zinc/66/91/17/1368669117.db2.gz	KYBABKJFFHRNKU-BZUAXINKSA-N	0	3	342.405	3.125	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](C(F)(F)F)[C@H](NCC=C(C)C)C2)C1	ZINC001112162720	1368691786	/nfs/dbraw/zinc/69/17/86/1368691786.db2.gz	ZJCPQDXSEPVHCB-ZIAGYGMSSA-N	0	3	330.394	3.288	20	30		EGEDHN
CC(C)CCC(=O)N1CC[C@@H]([C@@H](C)NCc2ccccc2C#N)C1	ZINC001325381660	1387956563	/nfs/dbraw/zinc/95/65/63/1387956563.db2.gz	VTMKRUKWFMMFQA-VQIMIIECSA-N	0	3	327.472	3.321	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)[C@H](CCCC)C(C)C)C[C@H]1C(F)(F)F	ZINC001112213270	1368721672	/nfs/dbraw/zinc/72/16/72/1368721672.db2.gz	IDCHUBBYKDGBPK-BZUAXINKSA-N	0	3	346.437	3.451	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)C2(C)CCC(C)CC2)C[C@H]1C(F)(F)F	ZINC001112213732	1368721686	/nfs/dbraw/zinc/72/16/86/1368721686.db2.gz	XPLUUHBHFPKGTP-GYMHETDLSA-N	0	3	344.421	3.205	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)C2(CC=C)CCCC2)C[C@H]1C(F)(F)F	ZINC001112220305	1368728995	/nfs/dbraw/zinc/72/89/95/1368728995.db2.gz	UQTMOOQETBVWND-ZIAGYGMSSA-N	0	3	330.394	3.288	20	30		EGEDHN
C=CCCC1(C(=O)N2CCCN(C[C@@H](OC)C3CCC3)CC2)CC1	ZINC001197062481	1368737207	/nfs/dbraw/zinc/73/72/07/1368737207.db2.gz	RMJJHFOYAYEZRE-GOSISDBHSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCCC1(C(=O)N2CCCN(CC3CC(F)(F)C3)CC2)CC1	ZINC001197062810	1368738271	/nfs/dbraw/zinc/73/82/71/1368738271.db2.gz	YGVFIRBGYZUITA-UHFFFAOYSA-N	0	3	326.431	3.312	20	30		EGEDHN
C=CCC1(C(=O)N2CCCN(C[C@@H](O)C3CCCCC3)CC2)CCC1	ZINC001197076231	1368741487	/nfs/dbraw/zinc/74/14/87/1368741487.db2.gz	DJFUBCROFDVSLR-LJQANCHMSA-N	0	3	348.531	3.208	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2c(C)noc2C(F)(F)F)CC1	ZINC001197269926	1368776038	/nfs/dbraw/zinc/77/60/38/1368776038.db2.gz	WTBVHYONZREAPW-UHFFFAOYSA-N	0	3	345.365	3.116	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)C[C@H](CC)C(C)C)C1	ZINC001197942233	1368929086	/nfs/dbraw/zinc/92/90/86/1368929086.db2.gz	XKJNBKMFCAXWIS-RCCFBDPRSA-N	0	3	326.525	3.190	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N1CCCN(CC/C=C/c2ccccc2)CC1	ZINC001198342772	1369011901	/nfs/dbraw/zinc/01/19/01/1369011901.db2.gz	AICAVNDWOHAIAX-LKQLOZHYSA-N	0	3	342.483	3.215	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N1CCCN([C@@H]2CCCc3ccccc32)CC1	ZINC001198345069	1369012740	/nfs/dbraw/zinc/01/27/40/1369012740.db2.gz	ZOFASQJWOYXYIK-YLJYHZDGSA-N	0	3	342.483	3.189	20	30		EGEDHN
C=CCC[C@@H](C(=O)N1CCCN(C[C@H](C)OC)CC1)c1ccccc1	ZINC001198423082	1369029569	/nfs/dbraw/zinc/02/95/69/1369029569.db2.gz	KAYDDXFHSUYUSN-AZUAARDMSA-N	0	3	344.499	3.306	20	30		EGEDHN
C=CCCCCCN[C@H](CNC(=O)CCOC)c1ccccc1OC	ZINC001198463616	1369038242	/nfs/dbraw/zinc/03/82/42/1369038242.db2.gz	PILWJADHDBLJOC-GOSISDBHSA-N	0	3	348.487	3.225	20	30		EGEDHN
CCC/C=C/CCN[C@H](CNC(=O)[C@@H](C)C#N)c1ccccc1OC	ZINC001198616546	1369073854	/nfs/dbraw/zinc/07/38/54/1369073854.db2.gz	IPLZEBXBDSMJAN-ZZGCUDHESA-N	0	3	343.471	3.348	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)c1cnccc1C)c1ccccc1OC	ZINC001198638004	1369078877	/nfs/dbraw/zinc/07/88/77/1369078877.db2.gz	UBEMNUKSDSWLSQ-SFHVURJKSA-N	0	3	339.439	3.035	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)C#CC(C)C)c1ccccc1OC	ZINC001198712723	1369096635	/nfs/dbraw/zinc/09/66/35/1369096635.db2.gz	FKTQHPMRMNRBQT-SFHVURJKSA-N	0	3	328.456	3.068	20	30		EGEDHN
CC/C=C\CCN[C@@H](CNC(=O)C#CC1CC1)c1ccccc1OC	ZINC001198723407	1369099164	/nfs/dbraw/zinc/09/91/64/1369099164.db2.gz	GOZYFWUVIDMRSA-HMECNJMJSA-N	0	3	340.467	3.212	20	30		EGEDHN
COc1ccccc1[C@@H](CNC(=O)C#CC(C)(C)C)NCC[C@@H](C)F	ZINC001198723741	1369100141	/nfs/dbraw/zinc/10/01/41/1369100141.db2.gz	JUEHIIJHFJCTIE-NVXWUHKLSA-N	0	3	348.462	3.240	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NC[C@H](NCCC)c1ccccc1OC)OCC	ZINC001198752174	1369105046	/nfs/dbraw/zinc/10/50/46/1369105046.db2.gz	MYBMMKFRZDGHOB-PKOBYXMFSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)CCC(F)F)c1ccccc1OC	ZINC001198796960	1369116653	/nfs/dbraw/zinc/11/66/53/1369116653.db2.gz	OUDIAKZPWPCXDT-CQSZACIVSA-N	0	3	326.387	3.064	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)CCC(F)F)c1ccccc1OC	ZINC001198797172	1369117150	/nfs/dbraw/zinc/11/71/50/1369117150.db2.gz	QPBMTIKIKRPSGS-OAHLLOKOSA-N	0	3	340.414	3.454	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NC[C@H](NCCC)c1ccccc1OC	ZINC001198819877	1369121711	/nfs/dbraw/zinc/12/17/11/1369121711.db2.gz	XHPWGSINJJDRER-FXAWDEMLSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@H](NCC[C@@H](C)F)c1ccccc1OC	ZINC001198835054	1369125580	/nfs/dbraw/zinc/12/55/80/1369125580.db2.gz	QVBWEFYYBWYSPH-ZBFHGGJFSA-N	0	3	336.451	3.402	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@H](NCC1CC1)c1ccccc1OC	ZINC001198855544	1369130821	/nfs/dbraw/zinc/13/08/21/1369130821.db2.gz	DAQZFTCEBIMLDO-GOSISDBHSA-N	0	3	328.456	3.046	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)CC(C)(F)F)c1ccccc1OC	ZINC001198886017	1369139829	/nfs/dbraw/zinc/13/98/29/1369139829.db2.gz	WXXZHSHEKYILTF-AWEZNQCLSA-N	0	3	326.387	3.064	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@]2(C)CC=C(C)CC2)C1	ZINC001198889702	1369140879	/nfs/dbraw/zinc/14/08/79/1369140879.db2.gz	XMSCOFVIZGMWSO-QWFCFKBJSA-N	0	3	334.504	3.031	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)Cc1occc1C)c1ccccc1OC	ZINC001198895882	1369143484	/nfs/dbraw/zinc/14/34/84/1369143484.db2.gz	XIHBHTXFRQPAFH-QGZVFWFLSA-N	0	3	342.439	3.162	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)CCCC2CCCC2)C1	ZINC001199201586	1369189593	/nfs/dbraw/zinc/18/95/93/1369189593.db2.gz	NOMYVNQFKPAVFY-RTBURBONSA-N	0	3	336.520	3.255	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)C2(C)CCC(C)CC2)C1	ZINC001199226412	1369194507	/nfs/dbraw/zinc/19/45/07/1369194507.db2.gz	DUZHAJRWCKGNCF-SFANZJOMSA-N	0	3	336.520	3.111	20	30		EGEDHN
CCC[C@@H](C)CC(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001199693238	1369255715	/nfs/dbraw/zinc/25/57/15/1369255715.db2.gz	ZMAFRVMGWWTOEH-MRXNPFEDSA-N	0	3	327.472	3.465	20	30		EGEDHN
CCCCCCCN1CCN(C(=O)c2occc2CN(C)C)CC1	ZINC001113263039	1369299756	/nfs/dbraw/zinc/29/97/56/1369299756.db2.gz	DUEUFZMQWXHUIT-UHFFFAOYSA-N	0	3	335.492	3.069	20	30		EGEDHN
C=CCNC(=S)N1CCC2(CC[C@@H]2N(C)Cc2ccco2)CC1	ZINC001200286166	1369342271	/nfs/dbraw/zinc/34/22/71/1369342271.db2.gz	JLIATJANMFASCY-INIZCTEOSA-N	0	3	333.501	3.017	20	30		EGEDHN
Cc1c(Cl)c(C#N)ccc1NC(=S)NCCN1CCCCC1	ZINC001200432012	1369366607	/nfs/dbraw/zinc/36/66/07/1369366607.db2.gz	ANQHAKPQFUFPFF-UHFFFAOYSA-N	0	3	336.892	3.292	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)c2cccc3c2ccn3C)CC1	ZINC001113434472	1369424873	/nfs/dbraw/zinc/42/48/73/1369424873.db2.gz	JXGVXHUGXAEONX-INIZCTEOSA-N	0	3	325.456	3.291	20	30		EGEDHN
CC#CCNC[C@@H]1CN(C(=O)[C@H](CCC)CC2CCCC2)CCCO1	ZINC001201546707	1369571996	/nfs/dbraw/zinc/57/19/96/1369571996.db2.gz	MHUFCCMQKGHUAN-WOJBJXKFSA-N	0	3	348.531	3.213	20	30		EGEDHN
CCCCCCCN1CCO[C@H]2[C@H]1CC[C@H]2COc1ncccn1	ZINC001201776633	1369622316	/nfs/dbraw/zinc/62/23/16/1369622316.db2.gz	HPOLNODGGLWDCT-RCCFBDPRSA-N	0	3	333.476	3.305	20	30		EGEDHN
CCCCCCCCCCS(=O)(=O)NCC1CCN(C)CC1	ZINC001201836364	1369631377	/nfs/dbraw/zinc/63/13/77/1369631377.db2.gz	YZPWVAKJWWSZAT-UHFFFAOYSA-N	0	3	332.554	3.388	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N1CCC(NC/C(Cl)=C\Cl)CC1	ZINC001201845793	1369633285	/nfs/dbraw/zinc/63/32/85/1369633285.db2.gz	OEYBPTRCFIVNTC-BYIUCRAPSA-N	0	3	349.302	3.115	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)N1CCC(NCc2oc(CC)nc2C)CC1	ZINC001202085398	1369684244	/nfs/dbraw/zinc/68/42/44/1369684244.db2.gz	TYOZMBOBIQJXIG-UONOGXRCSA-N	0	3	333.476	3.084	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001202085779	1369685167	/nfs/dbraw/zinc/68/51/67/1369685167.db2.gz	ZMSRHEMMIIWVDL-JKSUJKDBSA-N	0	3	325.456	3.097	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@H](NCc2oc(CC)nc2C)C12CCC2	ZINC001202615951	1369825245	/nfs/dbraw/zinc/82/52/45/1369825245.db2.gz	CCRLXLQYGDXSAL-HOTGVXAUSA-N	0	3	331.460	3.029	20	30		EGEDHN
CC(C)=C(F)C(=O)N[C@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202736462	1369873499	/nfs/dbraw/zinc/87/34/99/1369873499.db2.gz	QGUAOFMGZWCZSR-MSOLQXFVSA-N	0	3	340.442	3.319	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1C[C@@H](NCc2cnoc2C)C12CCC2	ZINC001202952645	1369935102	/nfs/dbraw/zinc/93/51/02/1369935102.db2.gz	YFKUGMUYDDTECC-QZTJIDSGSA-N	0	3	343.471	3.268	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1C[C@@H](NCc2conc2CC)C12CCC2	ZINC001202959353	1369936807	/nfs/dbraw/zinc/93/68/07/1369936807.db2.gz	CLLANLUNPWUMKT-SJORKVTESA-N	0	3	345.487	3.356	20	30		EGEDHN
CN1Cc2c(NC(=O)[C@@H]3C[C@@H]3C#N)cccc2[C@@H](c2ccccc2)C1	ZINC001186976369	1388033610	/nfs/dbraw/zinc/03/36/10/1388033610.db2.gz	CAIQGPQATIDMNX-KBAYOESNSA-N	0	3	331.419	3.362	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1C[C@H](NCC(=C)Br)C12CCC2	ZINC001202977662	1369943556	/nfs/dbraw/zinc/94/35/56/1369943556.db2.gz	FJJDNAZIQNVVFU-KBPBESRZSA-N	0	3	341.293	3.268	20	30		EGEDHN
CC[C@@H](C)[C@H](C)C(=O)N1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001203093857	1369981224	/nfs/dbraw/zinc/98/12/24/1369981224.db2.gz	ZLVZAQGIARBPEW-CABCVRRESA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(OC)c(C)c3)C[C@H]21	ZINC001114725045	1370047345	/nfs/dbraw/zinc/04/73/45/1370047345.db2.gz	XOAPCMXIGSEZMD-LBKNJMOBSA-N	0	3	342.483	3.152	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001203275443	1370055748	/nfs/dbraw/zinc/05/57/48/1370055748.db2.gz	UWSJAHGVRBRRPM-RBUKOAKNSA-N	0	3	336.479	3.267	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2[C@H]3CN(Cc4ccc(F)cc4C)C[C@H]32)CCC1	ZINC001114785881	1370079075	/nfs/dbraw/zinc/07/90/75/1370079075.db2.gz	WOROQZXCKXVZJW-BWTSREIZSA-N	0	3	342.458	3.427	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(F)cc3C)C[C@H]21	ZINC001114792781	1370083703	/nfs/dbraw/zinc/08/37/03/1370083703.db2.gz	XAVPXOYGJUUDNZ-DOADOZAASA-N	0	3	330.447	3.283	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H]2C[C@H](NCc3cncs3)C23CCC3)CC1	ZINC001203375611	1370104688	/nfs/dbraw/zinc/10/46/88/1370104688.db2.gz	RKACOEMMLJBPIU-HOTGVXAUSA-N	0	3	345.512	3.407	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)CCCC(F)(F)F)C12CCC2	ZINC001203428629	1370122503	/nfs/dbraw/zinc/12/25/03/1370122503.db2.gz	ZEWAUVADTFETIZ-VXGBXAGGSA-N	0	3	338.801	3.489	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1C[C@H](NCc2c(C)noc2C)C12CCC2	ZINC001203451113	1370131175	/nfs/dbraw/zinc/13/11/75/1370131175.db2.gz	IGGRFJSUZFZBQA-IRXDYDNUSA-N	0	3	345.487	3.411	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1[C@H]2CN(Cc3cc(F)ccc3C)C[C@H]21	ZINC001114899485	1370137421	/nfs/dbraw/zinc/13/74/21/1370137421.db2.gz	SSUACSKRHRVHLO-PIIMJCKOSA-N	0	3	330.447	3.283	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CC2)C(=O)NC[C@@H]3c2ccccc2)c1	ZINC001203762378	1370254670	/nfs/dbraw/zinc/25/46/70/1370254670.db2.gz	PTSDZBZGZIZJLL-HXUWFJFHSA-N	0	3	345.446	3.054	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1ccc(O)c(O)c1)[C@H]2CC	ZINC001203878203	1370297615	/nfs/dbraw/zinc/29/76/15/1370297615.db2.gz	QYCRLDLTUPKHSB-ICSRJNTNSA-N	0	3	344.455	3.019	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)C[C@@H]1CN(Cc2ccccc2)CCO1	ZINC001203905786	1370309570	/nfs/dbraw/zinc/30/95/70/1370309570.db2.gz	BZVVYWNEHBPRFT-JOCHJYFZSA-N	0	3	349.478	3.281	20	30		EGEDHN
CCOc1ccc(CN2CCCN(c3ccc(C#N)cn3)CC2)cc1	ZINC001203968319	1370334843	/nfs/dbraw/zinc/33/48/43/1370334843.db2.gz	DREGPBKHVRBWMR-UHFFFAOYSA-N	0	3	336.439	3.064	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(NCc3conc3C)CC2)CCCC1	ZINC001204139890	1370387978	/nfs/dbraw/zinc/38/79/78/1370387978.db2.gz	CRBRNFVRDNKBDM-UHFFFAOYSA-N	0	3	331.460	3.200	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCC[N@@H+](Cc1ccc(O)cc1[O-])[C@H]2CC	ZINC001204273624	1370428298	/nfs/dbraw/zinc/42/82/98/1370428298.db2.gz	SHUXJKBTBDLTHJ-ICSRJNTNSA-N	0	3	344.455	3.019	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCC[N@H+](Cc1ccc(O)cc1[O-])[C@H]2CC	ZINC001204273624	1370428299	/nfs/dbraw/zinc/42/82/99/1370428299.db2.gz	SHUXJKBTBDLTHJ-ICSRJNTNSA-N	0	3	344.455	3.019	20	30		EGEDHN
C=CCOc1ccc(CN2CCC3(CCC(=O)N3CC)CC2)cc1	ZINC001204301165	1370436164	/nfs/dbraw/zinc/43/61/64/1370436164.db2.gz	QFBKDJDUJVVGMR-UHFFFAOYSA-N	0	3	328.456	3.228	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3cn(C)c4ccccc34)C2)C1=O	ZINC001204316617	1370442127	/nfs/dbraw/zinc/44/21/27/1370442127.db2.gz	NWBITXMZEJJBHY-NRFANRHFSA-N	0	3	337.467	3.179	20	30		EGEDHN
C#CCCCC(=O)NCC1(NCc2c(C)nsc2C)CCCCC1	ZINC001115507177	1370507259	/nfs/dbraw/zinc/50/72/59/1370507259.db2.gz	FRMLWSATGCHWKG-UHFFFAOYSA-N	0	3	347.528	3.472	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H](C)[C@@H](C)COC)CCCCC1	ZINC001115567532	1370568213	/nfs/dbraw/zinc/56/82/13/1370568213.db2.gz	KRSHONUVQYEKNF-ZFWWWQNUSA-N	0	3	330.900	3.066	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cc(C)c(C)cn2)CCCCC1	ZINC001115641629	1370633275	/nfs/dbraw/zinc/63/32/75/1370633275.db2.gz	BDGKRIYNQIPFLY-UHFFFAOYSA-N	0	3	335.879	3.473	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCC1(NCc2cnc(C)cn2)CCCCC1	ZINC001115684963	1370667730	/nfs/dbraw/zinc/66/77/30/1370667730.db2.gz	OURNXGKLSYDEPX-QGZVFWFLSA-N	0	3	344.503	3.296	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)CCCC)CC[C@H]1c1ccc(F)cc1	ZINC001205251382	1370695959	/nfs/dbraw/zinc/69/59/59/1370695959.db2.gz	GKTHJJKHVMPAHY-RBUKOAKNSA-N	0	3	330.447	3.313	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC[C@@H](c2ccc(F)cc2)[C@H](NC/C=C/Cl)C1	ZINC001205262953	1370699655	/nfs/dbraw/zinc/69/96/55/1370699655.db2.gz	HJFJNXSUGWDCEQ-OBBULAJVSA-N	0	3	349.837	3.012	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC2(NCc3cnc(C)cn3)CCCCC2)C1	ZINC001115723512	1370702402	/nfs/dbraw/zinc/70/24/02/1370702402.db2.gz	WBZJPFGBPWUBBC-UHFFFAOYSA-N	0	3	342.487	3.050	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cc(C3CC3)n[nH]2)CCCCC1	ZINC001115744146	1370724964	/nfs/dbraw/zinc/72/49/64/1370724964.db2.gz	QTGSIWIDFWRNBN-UHFFFAOYSA-N	0	3	336.867	3.062	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CC[C@H]2CCCCO2)CCCCC1	ZINC001115754059	1370735292	/nfs/dbraw/zinc/73/52/92/1370735292.db2.gz	NVSWGPZSSJQZEP-MRXNPFEDSA-N	0	3	342.911	3.497	20	30		EGEDHN
C#CC[C@H](NCc1ccc(OCC(=O)OCC)cc1)c1ccccc1	ZINC001116489801	1370923837	/nfs/dbraw/zinc/92/38/37/1370923837.db2.gz	NFNACBATPVEMNT-FQEVSTJZSA-N	0	3	337.419	3.483	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC(CNCc2csc(C)n2)CC1	ZINC001205988602	1370930753	/nfs/dbraw/zinc/93/07/53/1370930753.db2.gz	IJMZFCYIMGLRHP-CQSZACIVSA-N	0	3	335.517	3.382	20	30		EGEDHN
C[C@@H](CC(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1)C(C)(C)C	ZINC001187413079	1388104020	/nfs/dbraw/zinc/10/40/20/1388104020.db2.gz	JUDIXTCYEUHSSJ-WMLDXEAASA-N	0	3	345.462	3.460	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N[C@@H]1CN(Cc2cccc(CC)c2)C[C@H]1C	ZINC001206485117	1371069208	/nfs/dbraw/zinc/06/92/08/1371069208.db2.gz	DHIWKUQPQCXLOY-MBOZVWFJSA-N	0	3	344.499	3.167	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CCN(Cc3scnc3C)C2)C1	ZINC001206863913	1371194609	/nfs/dbraw/zinc/19/46/09/1371194609.db2.gz	YBYZZICKIZDVSZ-QGZVFWFLSA-N	0	3	335.473	3.062	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CN(CC[C@@H]2CC2(Cl)Cl)C[C@H]1C	ZINC001206885155	1371205858	/nfs/dbraw/zinc/20/58/58/1371205858.db2.gz	XIGALKCKQZMPIJ-RBSFLKMASA-N	0	3	345.314	3.200	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CN([C@@H]2CCc3c2cccc3F)C[C@H]1C	ZINC001206911100	1371221043	/nfs/dbraw/zinc/22/10/43/1371221043.db2.gz	BQNUMGDOVRNLSN-NIKGAXFTSA-N	0	3	328.431	3.053	20	30		EGEDHN
CCc1ccc(CN2C[C@@H](C)[C@H](NC(=O)C#CC(C)(C)C)C2)cc1	ZINC001206949574	1371241068	/nfs/dbraw/zinc/24/10/68/1371241068.db2.gz	IYFAGKDXBKQLEG-VQIMIIECSA-N	0	3	326.484	3.235	20	30		EGEDHN
O=C(c1ccccc1)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207092415	1371291337	/nfs/dbraw/zinc/29/13/37/1371291337.db2.gz	ZCEGLAWIQSHHPL-HXUWFJFHSA-N	0	3	336.410	3.072	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CCN(Cc3cccnc3C)C2)C1	ZINC001207147317	1371310163	/nfs/dbraw/zinc/31/01/63/1371310163.db2.gz	BQTNALMMPMQSEF-IBGZPJMESA-N	0	3	329.444	3.001	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CN(CCc2ccccc2F)C[C@H]1C	ZINC001207165470	1371317061	/nfs/dbraw/zinc/31/70/61/1371317061.db2.gz	PDZNVWLUIVDQHZ-CRAIPNDOSA-N	0	3	332.463	3.407	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H](CN2CCc3ccc(C#N)cc3C2)C1	ZINC001207206735	1371328469	/nfs/dbraw/zinc/32/84/69/1371328469.db2.gz	QKPHROCLSYEVMH-MRXNPFEDSA-N	0	3	341.455	3.173	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H](CN2CCc3ccc(C#N)cc3C2)C1	ZINC001207206734	1371329197	/nfs/dbraw/zinc/32/91/97/1371329197.db2.gz	QKPHROCLSYEVMH-INIZCTEOSA-N	0	3	341.455	3.173	20	30		EGEDHN
O=C(c1ccsc1)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207214117	1371330786	/nfs/dbraw/zinc/33/07/86/1371330786.db2.gz	RVYWYEHEUVCCJS-GOSISDBHSA-N	0	3	342.439	3.133	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N[C@@H]1CN(Cc2ccc(C)cc2)C[C@H]1C)OCC	ZINC001207255636	1371342458	/nfs/dbraw/zinc/34/24/58/1371342458.db2.gz	MAWBMKJMRLMGTL-MISYRCLQSA-N	0	3	344.499	3.303	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccc3nccn3c2)CCCCC1	ZINC001119994031	1371446626	/nfs/dbraw/zinc/44/66/26/1371446626.db2.gz	ZSEVGQOLMSYQBU-UHFFFAOYSA-N	0	3	346.862	3.109	20	30		EGEDHN
O=C(CCC1CC1)N1CCC[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207705043	1371479298	/nfs/dbraw/zinc/47/92/98/1371479298.db2.gz	JCYMTHFKKYFHRF-IBGZPJMESA-N	0	3	344.886	3.462	20	30		EGEDHN
O=C(/C=C\C1CC1)N1CCC[C@@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207741741	1371491059	/nfs/dbraw/zinc/49/10/59/1371491059.db2.gz	PHRYWWUVGXNHLZ-UZRURVBFSA-N	0	3	342.870	3.238	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC(CCN2CCc3ccc(C#N)cc3C2)C1	ZINC001207759598	1371496610	/nfs/dbraw/zinc/49/66/10/1371496610.db2.gz	FFHBLSJGNVRKQW-UHFFFAOYSA-N	0	3	341.455	3.173	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CC[C@@H]2CC[C@H](C)O2)CCCCC1	ZINC001120176318	1371500191	/nfs/dbraw/zinc/50/01/91/1371500191.db2.gz	KHYHUDQTHSRFOC-HOTGVXAUSA-N	0	3	342.911	3.495	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NCC1(NCc2ccccc2F)CCCCC1	ZINC001120233994	1371510306	/nfs/dbraw/zinc/51/03/06/1371510306.db2.gz	STHLZJGHLLPEEY-INIZCTEOSA-N	0	3	348.462	3.326	20	30		EGEDHN
CC[C@H](C)CC(=O)N1CCC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001207915848	1371538250	/nfs/dbraw/zinc/53/82/50/1371538250.db2.gz	ZRZGSIJWSYBKGS-WMLDXEAASA-N	0	3	331.435	3.214	20	30		EGEDHN
CC[C@@H](C)CC(=O)N1CCC[C@H](NCc2cc(C#N)ccc2OC)C1	ZINC001207915532	1371538387	/nfs/dbraw/zinc/53/83/87/1371538387.db2.gz	XUZUKAMWPKYXBN-QAPCUYQASA-N	0	3	343.471	3.084	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H]([C@H]2CCCN2Cc2ccc(F)cn2)C1	ZINC001120348040	1371543392	/nfs/dbraw/zinc/54/33/92/1371543392.db2.gz	ONYFATJVURWVPE-VQIMIIECSA-N	0	3	345.462	3.390	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207944019	1371545281	/nfs/dbraw/zinc/54/52/81/1371545281.db2.gz	HTBMEHMWUHMZMO-LJQANCHMSA-N	0	3	342.870	3.076	20	30		EGEDHN
CCCCC(=O)NC1CC2(CC(NCc3cc(F)ccc3C#N)C2)C1	ZINC001120639387	1371673775	/nfs/dbraw/zinc/67/37/75/1371673775.db2.gz	CFZKXHRXWWVWHY-UHFFFAOYSA-N	0	3	343.446	3.405	20	30		EGEDHN
O=C(c1cc2occc2[nH]1)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001208255743	1371684474	/nfs/dbraw/zinc/68/44/74/1371684474.db2.gz	QAQBVTQIWVOAGA-QGZVFWFLSA-N	0	3	347.418	3.007	20	30		EGEDHN
C=CCCC(=O)NC1CC2(CC(NCc3ccncc3Cl)C2)C1	ZINC001120787480	1371758771	/nfs/dbraw/zinc/75/87/71/1371758771.db2.gz	OESGEWZJKKZKFZ-UHFFFAOYSA-N	0	3	333.863	3.218	20	30		EGEDHN
O=C(CC1CC(F)(F)C1)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001208439784	1371767026	/nfs/dbraw/zinc/76/70/26/1371767026.db2.gz	UPVPEZIULCXORH-SFHVURJKSA-N	0	3	346.421	3.054	20	30		EGEDHN
C=C(C)CN1CCC(Nc2nc(Br)ccc2C#N)CC1	ZINC001120896797	1371799067	/nfs/dbraw/zinc/79/90/67/1371799067.db2.gz	SXNMYZQPVMXDKN-UHFFFAOYSA-N	0	3	335.249	3.168	20	30		EGEDHN
C#CCCCC(=O)NC1CC2(CC(NCc3c(F)cccc3F)C2)C1	ZINC001121007385	1371832975	/nfs/dbraw/zinc/83/29/75/1371832975.db2.gz	KJSJRVAIYLKUPI-UHFFFAOYSA-N	0	3	346.421	3.285	20	30		EGEDHN
CC1(CC(=O)N2CCC[C@H](NCC#Cc3ccccc3Cl)C2)CC1	ZINC001208595575	1371833701	/nfs/dbraw/zinc/83/37/01/1371833701.db2.gz	SZECVIZANCJIMN-KRWDZBQOSA-N	0	3	344.886	3.462	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@H]1CCCN(CCCc2ccc(C#N)cc2)C1	ZINC001208860357	1371922353	/nfs/dbraw/zinc/92/23/53/1371922353.db2.gz	KREWVBMULWLGEB-SFHVURJKSA-N	0	3	343.471	3.480	20	30		EGEDHN
C[C@H]1CCN(C(=O)OC(C)(C)C)CCN1CCc1ccc(C#N)cc1	ZINC001208920836	1371944989	/nfs/dbraw/zinc/94/49/89/1371944989.db2.gz	QYVFSNCXCPJFNA-INIZCTEOSA-N	0	3	343.471	3.432	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H]2[C@@H]1CCN2CCc1ccc(C#N)cc1	ZINC001208925811	1371947480	/nfs/dbraw/zinc/94/74/80/1371947480.db2.gz	UBKAWNDGEBAYLC-ROUUACIJSA-N	0	3	341.455	3.184	20	30		EGEDHN
N#Cc1ccc(CCN2CCN(C3(c4ccccc4)CC3)CC2)cc1	ZINC001208928371	1371948931	/nfs/dbraw/zinc/94/89/31/1371948931.db2.gz	BFVVNSALBIMFPE-UHFFFAOYSA-N	0	3	331.463	3.408	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CN(Cc2ccc(COC)cc2)C[C@H]1C	ZINC001208964156	1371964956	/nfs/dbraw/zinc/96/49/56/1371964956.db2.gz	UMCZADFKCKFZBZ-VQIMIIECSA-N	0	3	344.499	3.372	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC[C@@H](NCc2ccc(C#N)s2)C1	ZINC001209004900	1371971910	/nfs/dbraw/zinc/97/19/10/1371971910.db2.gz	QRJYHYOLLYLLQE-MRXNPFEDSA-N	0	3	343.496	3.284	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CCC[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001209020949	1371976572	/nfs/dbraw/zinc/97/65/72/1371976572.db2.gz	XSQCAZZXHZFMNH-DLBZAZTESA-N	0	3	336.838	3.020	20	30		EGEDHN
C=CCN(CCN1CC[C@H](c2ccc(OC)cc2)C1)C(=O)OCC	ZINC001209021387	1371976750	/nfs/dbraw/zinc/97/67/50/1371976750.db2.gz	ZSADXGSMNSVEFR-KRWDZBQOSA-N	0	3	332.444	3.129	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N1CCC[C@@H](NCc2ccc(C#N)s2)C1	ZINC001209102259	1371998814	/nfs/dbraw/zinc/99/88/14/1371998814.db2.gz	VOZVUSITVMWGET-SXSSENBOSA-N	0	3	329.469	3.223	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@H](NCc2ccc(F)c(F)c2)C1	ZINC001209111924	1372001082	/nfs/dbraw/zinc/00/10/82/1372001082.db2.gz	RAZTXZQNMCSUIT-INIZCTEOSA-N	0	3	334.410	3.239	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC[C@@H](NCc2cnn(C(C)(C)C)c2)C1	ZINC001209185753	1372030647	/nfs/dbraw/zinc/03/06/47/1372030647.db2.gz	XJBBEQHIIVVKAF-FUHWJXTLSA-N	0	3	346.519	3.321	20	30		EGEDHN
O=C(c1ccoc1C1CC1)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001209269060	1372055932	/nfs/dbraw/zinc/05/59/32/1372055932.db2.gz	DXZADYMJOOOBJJ-IBGZPJMESA-N	0	3	348.446	3.403	20	30		EGEDHN
C=CCCCCCN1CCO[C@@H]2[C@H](COc3ncccn3)CC[C@@H]21	ZINC001209427320	1372103702	/nfs/dbraw/zinc/10/37/02/1372103702.db2.gz	NWXBRIMKPQUDNK-OKZBNKHCSA-N	0	3	331.460	3.081	20	30		EGEDHN
C=CCCCCCN1CCO[C@@H]2[C@@H](COc3ncccn3)CC[C@H]21	ZINC001209427319	1372104080	/nfs/dbraw/zinc/10/40/80/1372104080.db2.gz	NWXBRIMKPQUDNK-KZNAEPCWSA-N	0	3	331.460	3.081	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N[C@H](C)c1nc(-c2ccc(F)c(C)c2)no1	ZINC001121896326	1372117597	/nfs/dbraw/zinc/11/75/97/1372117597.db2.gz	LFJHVDPQYJVXNL-IUODEOHRSA-N	0	3	346.406	3.045	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC[C@H](NCc3scnc3C)C2)CC1	ZINC001209493209	1372120383	/nfs/dbraw/zinc/12/03/83/1372120383.db2.gz	KOWNQJRCGYSAAD-HNNXBMFYSA-N	0	3	333.501	3.279	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3c[nH]c4ccc(C)cc34)C2)C1=O	ZINC001209495212	1372120927	/nfs/dbraw/zinc/12/09/27/1372120927.db2.gz	NGFIVKSLAGTZAY-NRFANRHFSA-N	0	3	337.467	3.477	20	30		EGEDHN
Cc1ccc(CN2C[C@@H]3CCN(C(=O)C#CC(C)(C)C)[C@@H]3C2)cc1C	ZINC001187849928	1388177143	/nfs/dbraw/zinc/17/71/43/1388177143.db2.gz	YXSDSCGKIIHDIW-VQTJNVASSA-N	0	3	338.495	3.386	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@@H](NCc2c(C)nsc2C)C1	ZINC001209867413	1372217534	/nfs/dbraw/zinc/21/75/34/1372217534.db2.gz	YPNGWDUCXGUMFD-OAHLLOKOSA-N	0	3	335.517	3.443	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001209911298	1372229892	/nfs/dbraw/zinc/22/98/92/1372229892.db2.gz	VJAYISNYUKVQOA-APWZRJJASA-N	0	3	330.447	3.050	20	30		EGEDHN
C=C(C)Cn1c(-c2ccco2)nnc1N1CCN([C@@H](C)CC)CC1	ZINC001122509796	1372262846	/nfs/dbraw/zinc/26/28/46/1372262846.db2.gz	IBKBWYWTEMAHQN-HNNXBMFYSA-N	0	3	329.448	3.035	20	30		EGEDHN
N#CC(C(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1cccc(F)n1	ZINC001122714044	1372304638	/nfs/dbraw/zinc/30/46/38/1372304638.db2.gz	HXGSUGPUUPSXJY-AWEZNQCLSA-N	0	3	342.330	3.197	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1)C1CCCC1	ZINC001210584985	1372384816	/nfs/dbraw/zinc/38/48/16/1372384816.db2.gz	NUBAMFRGTWMEIX-NQIIRXRSSA-N	0	3	338.495	3.445	20	30		EGEDHN
Cn1c(Cl)cnc1C(C#N)C(=O)CCCOCCc1ccccc1	ZINC001123234663	1372403610	/nfs/dbraw/zinc/40/36/10/1372403610.db2.gz	ZSPISIRRHDRXKN-HNNXBMFYSA-N	0	3	345.830	3.289	20	30		EGEDHN
CCCCCCCCC(=O)N1CCC[C@@H](NCc2cncn2C)C1	ZINC001210805052	1372429957	/nfs/dbraw/zinc/42/99/57/1372429957.db2.gz	PRXKVGUELBQDCG-QGZVFWFLSA-N	0	3	334.508	3.251	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)CCCC2CCCCC2)C1	ZINC001210807297	1372430394	/nfs/dbraw/zinc/43/03/94/1372430394.db2.gz	KKTMDRNAGPZHPX-IEBWSBKVSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](c2ccccc2)[C@H](NCc2cccnc2)C1	ZINC001211551323	1372578477	/nfs/dbraw/zinc/57/84/77/1372578477.db2.gz	JCNQGXRZWAXQEW-VQTJNVASSA-N	0	3	335.451	3.132	20	30		EGEDHN
C[C@@H](NCCNC(=O)CSCC#N)c1ccc(Cl)c(Cl)c1	ZINC001123792142	1372590613	/nfs/dbraw/zinc/59/06/13/1372590613.db2.gz	KDHDWCRTRSFGHQ-SNVBAGLBSA-N	0	3	346.283	3.017	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@@H]2CCCC23CC3)C[C@H]1c1ccccc1	ZINC001211623761	1372592472	/nfs/dbraw/zinc/59/24/72/1372592472.db2.gz	RYACONYRWMMKDD-SLFFLAALSA-N	0	3	336.479	3.174	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C(C)(C)C2CCC2)C[C@H]1c1ccccc1	ZINC001211642818	1372594330	/nfs/dbraw/zinc/59/43/30/1372594330.db2.gz	RTJIBLDIWAULNK-VQTJNVASSA-N	0	3	338.495	3.420	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C2(CC=C)CCCC2)C[C@H]1c1ccccc1	ZINC001211754669	1372611603	/nfs/dbraw/zinc/61/16/03/1372611603.db2.gz	HVBJCCWFVUPUPB-VQTJNVASSA-N	0	3	336.479	3.340	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1CN(CC/C=C/CCC)C[C@H]1OC	ZINC001212321107	1372685701	/nfs/dbraw/zinc/68/57/01/1372685701.db2.gz	ROVRJTWTNCAVTJ-BGGMYYEUSA-N	0	3	334.504	3.317	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H]1CN(CCCCCC)C[C@H]1OC	ZINC001212337344	1372690287	/nfs/dbraw/zinc/69/02/87/1372690287.db2.gz	JBIPTUOAWBAMIG-HUUCEWRRSA-N	0	3	330.900	3.161	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN(CCCc2cccc(C)c2)C[C@H]1OC	ZINC001212346876	1372691525	/nfs/dbraw/zinc/69/15/25/1372691525.db2.gz	GNTPVEUSGPDRLW-WOJBJXKFSA-N	0	3	344.499	3.099	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2ncccc2CC)[C@H](OC)C1	ZINC001212495690	1372715502	/nfs/dbraw/zinc/71/55/02/1372715502.db2.gz	NQTXKRAJPPCPOK-QZTJIDSGSA-N	0	3	347.503	3.043	20	30		EGEDHN
CN1CCN(Cc2cccc(Nc3ccccc3OCC#N)c2)CC1	ZINC001212601892	1372735662	/nfs/dbraw/zinc/73/56/62/1372735662.db2.gz	VRGRPWNYIHZLET-UHFFFAOYSA-N	0	3	336.439	3.080	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2c(C)cncc2C)[C@H](OC)C1	ZINC001213160252	1372850943	/nfs/dbraw/zinc/85/09/43/1372850943.db2.gz	HDZDJNIATNSNQO-QZTJIDSGSA-N	0	3	347.503	3.098	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN(CC/C=C\c2ccccc2)C[C@H]1OC	ZINC001213271180	1372871697	/nfs/dbraw/zinc/87/16/97/1372871697.db2.gz	LVJKWJZCAWSFDQ-LZZACLKFSA-N	0	3	342.483	3.118	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@H]2Cc3ccccc32)[C@H](OC)C1	ZINC001213344232	1372887916	/nfs/dbraw/zinc/88/79/16/1372887916.db2.gz	IHFIRSVBQJTJTP-XUVXKRRUSA-N	0	3	344.499	3.112	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN(Cc2ccccc2C2CC2)C[C@H]1OC	ZINC001213356843	1372890818	/nfs/dbraw/zinc/89/08/18/1372890818.db2.gz	BZXXJWTXWCJREP-WOJBJXKFSA-N	0	3	342.483	3.236	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2ccc(C3CC3)s2)[C@H](OC)C1	ZINC001213716773	1372950461	/nfs/dbraw/zinc/95/04/61/1372950461.db2.gz	GAFAKVCKJAKQEQ-HUUCEWRRSA-N	0	3	334.485	3.021	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)[C@@H](F)CC2CCCCC2)[C@H](OC)C1	ZINC001213728578	1372952141	/nfs/dbraw/zinc/95/21/41/1372952141.db2.gz	NBJSYIVORLNHSJ-RCCFBDPRSA-N	0	3	340.483	3.077	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H](NC(=O)c2sccc2CC)[C@H](OC)C1	ZINC001213905563	1372978741	/nfs/dbraw/zinc/97/87/41/1372978741.db2.gz	DPGMDMVETVRYMG-FVQBIDKESA-N	0	3	336.501	3.094	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2ccccc2CC(C)C)[C@H](OC)C1	ZINC001213951493	1372986325	/nfs/dbraw/zinc/98/63/25/1372986325.db2.gz	UTNGKWWDRUQRQU-WOJBJXKFSA-N	0	3	344.499	3.280	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CC/C=C/CC)C[C@H]2OC)CCCC1	ZINC001214003986	1372993091	/nfs/dbraw/zinc/99/30/91/1372993091.db2.gz	FICVKTAQORYRJY-IKSUFZCESA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CCCC(C)C)C[C@H]2OC)CCCC1	ZINC001214003898	1372993418	/nfs/dbraw/zinc/99/34/18/1372993418.db2.gz	CDVOXMJXDZPDNI-QZTJIDSGSA-N	0	3	336.520	3.375	20	30		EGEDHN
CC(C)=CC(=O)N1C[C@@H](C)[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001214083203	1373006018	/nfs/dbraw/zinc/00/60/18/1373006018.db2.gz	QELBOQACHXCXOJ-CRAIPNDOSA-N	0	3	330.859	3.094	20	30		EGEDHN
CC(C)CCC(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001214121225	1373011617	/nfs/dbraw/zinc/01/16/17/1373011617.db2.gz	DTLRKXVEOWVPHV-RDTXWAMCSA-N	0	3	331.435	3.070	20	30		EGEDHN
Cc1csc(C(=O)N2C[C@@H](C)[C@H](NCC#Cc3ccccc3)C2)c1	ZINC001214559236	1373080324	/nfs/dbraw/zinc/08/03/24/1373080324.db2.gz	DYDDPOWLGKVESS-SJLPKXTDSA-N	0	3	338.476	3.158	20	30		EGEDHN
C[C@@H](N[C@@H]1CN(C(=O)C#CC(C)(C)C)C[C@H]1C)c1ccccc1F	ZINC001214586300	1373085462	/nfs/dbraw/zinc/08/54/62/1373085462.db2.gz	WYXYOGUDVJYOAJ-IIDMSEBBSA-N	0	3	330.447	3.373	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)[C@H](NCc2cc(F)ccc2OC)C1	ZINC001214746015	1373114238	/nfs/dbraw/zinc/11/42/38/1373114238.db2.gz	SXRVMNUYBVPBMG-RHSMWYFYSA-N	0	3	334.435	3.127	20	30		EGEDHN
CC1=C(C)C[C@@H](C(=O)NCCNCc2ccc(F)c(C#N)c2)CC1	ZINC001128031219	1373210935	/nfs/dbraw/zinc/21/09/35/1373210935.db2.gz	RSWMCVYKRLJIBJ-INIZCTEOSA-N	0	3	329.419	3.040	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)c3cccc(F)c3)[C@H]2C1	ZINC001217206676	1373405920	/nfs/dbraw/zinc/40/59/20/1373405920.db2.gz	MZTZJMFNPOZUGY-RBUKOAKNSA-N	0	3	346.446	3.097	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NCCNCc1cccc(Cl)c1	ZINC001130374129	1373509111	/nfs/dbraw/zinc/50/91/11/1373509111.db2.gz	IOCIAYZZWDXCNP-UHFFFAOYSA-N	0	3	344.842	3.424	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)CCC[C@@H](C)CCC)[C@H]2C1	ZINC001218004070	1373532373	/nfs/dbraw/zinc/53/23/73/1373532373.db2.gz	OBIVFMFCXWLKBG-GBESFXJTSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCO[C@@H]2CN(CCCC(C)(C)C)C[C@@H]21	ZINC001218023049	1373540423	/nfs/dbraw/zinc/54/04/23/1373540423.db2.gz	KQPYZQVXSPUTFP-DLBZAZTESA-N	0	3	336.520	3.327	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)[C@@]2(C)CC=C(C)CC2)C1	ZINC001130450593	1373544750	/nfs/dbraw/zinc/54/47/50/1373544750.db2.gz	PQYBTNMWJVMVPL-JXFKEZNVSA-N	0	3	342.487	3.138	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)C2(CC)CCCCC2)C1	ZINC001130452855	1373546296	/nfs/dbraw/zinc/54/62/96/1373546296.db2.gz	OHEUVTFAAHBWBG-INIZCTEOSA-N	0	3	344.503	3.362	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2OCCN(C(=O)c3ccc(F)c(C)c3)[C@H]2C1	ZINC001218558135	1373632852	/nfs/dbraw/zinc/63/28/52/1373632852.db2.gz	UXKBVNATMMQPIQ-ZYSHUDEJSA-N	0	3	346.446	3.014	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)[C@@H](C)C(C)(F)F)[C@H]2C1	ZINC001218639815	1373639190	/nfs/dbraw/zinc/63/91/90/1373639190.db2.gz	VKCQNTPXMFCYMJ-OWCLPIDISA-N	0	3	346.462	3.160	20	30		EGEDHN
CC(C)=C[C@@H]1[C@@H](C(=O)NCCNCc2ccc(C#N)s2)C1(C)C	ZINC001131088933	1373640717	/nfs/dbraw/zinc/64/07/17/1373640717.db2.gz	UGUXYMWWQBCHAV-CVEARBPZSA-N	0	3	331.485	3.064	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)Nc1cnc(C#N)c(C(F)(F)F)c1	ZINC001218658514	1373641323	/nfs/dbraw/zinc/64/13/23/1373641323.db2.gz	FQDNIJRWVLOEIV-ZDUSSCGKSA-N	0	3	340.349	3.374	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)CCC3(C)CC3)[C@H]2C1	ZINC001218899625	1373665559	/nfs/dbraw/zinc/66/55/59/1373665559.db2.gz	LYIJJHGPFNROOV-ZWKOTPCHSA-N	0	3	334.504	3.225	20	30		EGEDHN
N#Cc1cc(NC(=O)C[C@@H]([NH3+])c2ccc(C(F)(F)F)cc2)ccc1[O-]	ZINC001218953897	1373670456	/nfs/dbraw/zinc/67/04/56/1373670456.db2.gz	CDBWRXNOROJGKB-CQSZACIVSA-N	0	3	349.312	3.311	20	30		EGEDHN
Cc1cc(Cl)cc(C(=O)NCCNCc2ccc(C#N)cc2)c1	ZINC001131362727	1373683528	/nfs/dbraw/zinc/68/35/28/1373683528.db2.gz	LHZSEIZSYJULSB-UHFFFAOYSA-N	0	3	327.815	3.040	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cc3cscc3s2)s1	ZINC001131475700	1373706556	/nfs/dbraw/zinc/70/65/56/1373706556.db2.gz	WIOBPRJRQHCEFT-UHFFFAOYSA-N	0	3	347.490	3.416	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CN(CCC2CCCCCC2)C[C@@H]1O	ZINC001220201151	1373757764	/nfs/dbraw/zinc/75/77/64/1373757764.db2.gz	HRXRTMLSRGNALW-QRQLOZEOSA-N	0	3	336.520	3.111	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CCC3=CCCCC3)C[C@@H]2O)CCCC1	ZINC001221198287	1373767690	/nfs/dbraw/zinc/76/76/90/1373767690.db2.gz	AVLRANILPDBXSI-MOPGFXCFSA-N	0	3	346.515	3.175	20	30		EGEDHN
C=CCCCN1CC[C@@H]2CN(C(=O)c3scnc3C(F)F)[C@@H]2C1	ZINC001221684194	1373789478	/nfs/dbraw/zinc/78/94/78/1373789478.db2.gz	JTKDZEWTWNLZCN-VXGBXAGGSA-N	0	3	341.427	3.193	20	30		EGEDHN
C=CC[C@@H](C(=O)N1C[C@H]2CCN(CCCF)C[C@H]21)c1ccccc1	ZINC001222037043	1373812993	/nfs/dbraw/zinc/81/29/93/1373812993.db2.gz	OJEOSVIOAPBVNJ-GUDVDZBRSA-N	0	3	330.447	3.239	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC1CCN(Cc2cccnc2C)CC1	ZINC001224013483	1375052510	/nfs/dbraw/zinc/05/25/10/1375052510.db2.gz	AMTMNVWZNLGEDH-UHFFFAOYSA-N	0	3	329.488	3.321	20	30		EGEDHN
O=C(N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1)[C@@H]1CC=CCC1	ZINC001224740781	1375073221	/nfs/dbraw/zinc/07/32/21/1375073221.db2.gz	QROQLTDUIRTRKP-NJDAHSKKSA-N	0	3	336.479	3.411	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@H](C)N(CCCCC(F)(F)F)C1	ZINC001132002343	1375092648	/nfs/dbraw/zinc/09/26/48/1375092648.db2.gz	ISZXFJZDAUCKNP-LSDHHAIUSA-N	0	3	332.410	3.492	20	30		EGEDHN
Cc1ccc(CN2C[C@@H](NC(=O)C#CC(C)C)CC[C@H]2C)cc1C	ZINC001132021959	1375102446	/nfs/dbraw/zinc/10/24/46/1375102446.db2.gz	SIZFNTCCCUVBJQ-QUCCMNQESA-N	0	3	326.484	3.432	20	30		EGEDHN
C[C@@H]1CC[C@H](NC(=O)C#CC2CC2)CN1Cc1ccc2cc[nH]c2c1	ZINC001132034406	1375109696	/nfs/dbraw/zinc/10/96/96/1375109696.db2.gz	QVGNDFAAEXFMDE-BEFAXECRSA-N	0	3	335.451	3.050	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1CC[C@@H](C)N(CCc2cnn(CC)c2)C1	ZINC001132060402	1375125393	/nfs/dbraw/zinc/12/53/93/1375125393.db2.gz	FIGUQRNHOKDANP-AEFFLSMTSA-N	0	3	346.519	3.017	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CC[C@H](C)N(CCn2nc(C)cc2C)C1	ZINC001132060843	1375126388	/nfs/dbraw/zinc/12/63/88/1375126388.db2.gz	MBXDFGXDRSNLAB-FUHWJXTLSA-N	0	3	346.519	3.071	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)Cc2c(C)cccc2C)CC[C@@H]1C	ZINC001132065516	1375129587	/nfs/dbraw/zinc/12/95/87/1375129587.db2.gz	VMWSAIGXFQSKSE-RBUKOAKNSA-N	0	3	344.499	3.018	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NCC1CCN(Cc2cc(F)ccc2C)CC1	ZINC001225631547	1375135950	/nfs/dbraw/zinc/13/59/50/1375135950.db2.gz	PFWLQTYPHWDWFB-INIZCTEOSA-N	0	3	348.462	3.053	20	30		EGEDHN
CC[C@@H](C)CC(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1	ZINC001225899623	1375171999	/nfs/dbraw/zinc/17/19/99/1375171999.db2.gz	XJILZHULTWSSAY-MISYRCLQSA-N	0	3	326.484	3.491	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2ccccc2CCC)CC[C@@H]1C	ZINC001132165467	1375182272	/nfs/dbraw/zinc/18/22/72/1375182272.db2.gz	VMDSGGQGBYDIIY-PKOBYXMFSA-N	0	3	344.499	3.424	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)CCc2ccc(C)cc2)CC[C@@H]1C	ZINC001132168615	1375182927	/nfs/dbraw/zinc/18/29/27/1375182927.db2.gz	FENKXMCBLVDKBW-AZUAARDMSA-N	0	3	344.499	3.099	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)CC(C)(C)CC(F)F)CC[C@@H]1C	ZINC001132190693	1375197638	/nfs/dbraw/zinc/19/76/38/1375197638.db2.gz	MPDQGICMRXIOKF-GJZGRUSLSA-N	0	3	346.462	3.230	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)/C=C(/C)CC	ZINC001226059610	1375197687	/nfs/dbraw/zinc/19/76/87/1375197687.db2.gz	YQBZRTGWBYXDFC-IVYWBBSESA-N	0	3	329.282	3.268	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2ccn(C(C)C)c2C)CC[C@@H]1C	ZINC001132237491	1375232912	/nfs/dbraw/zinc/23/29/12/1375232912.db2.gz	KDSOARQSNZDPHK-WMZOPIPTSA-N	0	3	347.503	3.163	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CC[C@H](C)N(Cc2ccc(CO)cc2)C1	ZINC001132256286	1375250387	/nfs/dbraw/zinc/25/03/87/1375250387.db2.gz	MBHPSYPPFMEVMC-QFBILLFUSA-N	0	3	330.472	3.004	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2cc[nH]c2C2CCC2)CC[C@@H]1C	ZINC001132306224	1375285548	/nfs/dbraw/zinc/28/55/48/1375285548.db2.gz	TYRBITDPMVTEGG-DOTOQJQBSA-N	0	3	345.487	3.068	20	30		EGEDHN
COCCN1CCC(Oc2ccc(C(F)(F)F)cc2C#N)CC1	ZINC001227000973	1375379809	/nfs/dbraw/zinc/37/98/09/1375379809.db2.gz	LWPRJHBQPXKCMS-UHFFFAOYSA-N	0	3	328.334	3.067	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2ccc(C)c(C)c2)CC[C@H]1C	ZINC001132458841	1375402069	/nfs/dbraw/zinc/40/20/69/1375402069.db2.gz	YBBRTKQAKIBYIL-IEBWSBKVSA-N	0	3	330.472	3.089	20	30		EGEDHN
C[C@H](c1ccccn1)N1CCC[C@H](Oc2nc3cc(C#N)ccc3[nH]2)C1	ZINC001227218935	1375407879	/nfs/dbraw/zinc/40/78/79/1375407879.db2.gz	JBFNXXLBSHHBJF-ZBFHGGJFSA-N	0	3	347.422	3.434	20	30		EGEDHN
C[C@@H](c1ccccn1)N1CCC[C@H](Oc2nc3cc(C#N)ccc3[nH]2)C1	ZINC001227218934	1375408218	/nfs/dbraw/zinc/40/82/18/1375408218.db2.gz	JBFNXXLBSHHBJF-HOCLYGCPSA-N	0	3	347.422	3.434	20	30		EGEDHN
COc1cccc([C@H](C)N2CCC(NC(=O)C#CC(C)(C)C)CC2)c1	ZINC001227290326	1375416799	/nfs/dbraw/zinc/41/67/99/1375416799.db2.gz	UOFHODYCLODSHQ-INIZCTEOSA-N	0	3	342.483	3.386	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCOc2ccc(OC)cc2)CC[C@H]1C	ZINC001132499008	1375426392	/nfs/dbraw/zinc/42/63/92/1375426392.db2.gz	AJKRCNWVCLSREN-IAGOWNOFSA-N	0	3	346.471	3.009	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1CC[C@H](C)N(Cc2ccc(C)c(C)c2)C1	ZINC001132533037	1375444547	/nfs/dbraw/zinc/44/45/47/1375444547.db2.gz	JCTLDTOBCBWGQI-AZUAARDMSA-N	0	3	344.499	3.365	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)C2(C)C(C)(C)C2(C)C)CC[C@@H]1C	ZINC001132546552	1375453124	/nfs/dbraw/zinc/45/31/24/1375453124.db2.gz	NVOXKIITVTWGDR-JKSUJKDBSA-N	0	3	336.520	3.230	20	30		EGEDHN
CC#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)C=C(C)C)CC1	ZINC001132551893	1375457688	/nfs/dbraw/zinc/45/76/88/1375457688.db2.gz	NSSGHCBAPIPRKO-FQEVSTJZSA-N	0	3	339.483	3.254	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCNCc1cc(C(C)C)ccc1OC	ZINC001132573499	1375471883	/nfs/dbraw/zinc/47/18/83/1375471883.db2.gz	OMFWMBLDWUWUCB-CVEARBPZSA-N	0	3	332.488	3.483	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N[C@@H]1CCCC[C@H]1NCC(=C)Br	ZINC001228036914	1375507709	/nfs/dbraw/zinc/50/77/09/1375507709.db2.gz	YKSFZPSZXXQPJC-PRYPJVTBSA-N	0	3	341.293	3.434	20	30		EGEDHN
N#Cc1ccc(OC[C@H]2CN(Cc3ccccc3)CCCO2)cc1C#N	ZINC001228260283	1375536597	/nfs/dbraw/zinc/53/65/97/1375536597.db2.gz	RBJNORHCUFILBG-OAQYLSRUSA-N	0	3	347.418	3.100	20	30		EGEDHN
Cc1csc(CNC[C@@H]2CN(C(=O)C#CC(C)(C)C)CC[C@@H]2C)n1	ZINC001132818592	1375581810	/nfs/dbraw/zinc/58/18/10/1375581810.db2.gz	LECSPKKXYXMFDL-GOEBONIOSA-N	0	3	347.528	3.075	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC001228747451	1375660173	/nfs/dbraw/zinc/66/01/73/1375660173.db2.gz	AYMAXCXVQXFFAT-JKSUJKDBSA-N	0	3	348.462	3.243	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NC1CCN(CCOCc2ccccc2)CC1	ZINC001228748211	1375661023	/nfs/dbraw/zinc/66/10/23/1375661023.db2.gz	KDSRYULOCMWGIS-ROUUACIJSA-N	0	3	344.499	3.242	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC1CCN(Cc2sc(C)nc2C)CC1	ZINC001228786462	1375675031	/nfs/dbraw/zinc/67/50/31/1375675031.db2.gz	JVJFCDAQWMQFER-ZDUSSCGKSA-N	0	3	335.517	3.443	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](C)[C@H](CNCc2cc(C)no2)C1	ZINC001133039665	1375729868	/nfs/dbraw/zinc/72/98/68/1375729868.db2.gz	UDBKVWDBJOMYBO-SJLPKXTDSA-N	0	3	345.487	3.141	20	30		EGEDHN
COC(=O)c1ccc(C#C[Si](C)(C)C)c(OC2CCN(C)CC2)c1	ZINC001229283330	1375799609	/nfs/dbraw/zinc/79/96/09/1375799609.db2.gz	MPAWGBSVRGEHHK-UHFFFAOYSA-N	0	3	345.515	3.175	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1occc1C	ZINC001133389612	1375972755	/nfs/dbraw/zinc/97/27/55/1375972755.db2.gz	XTDYMTVQFBHBGW-UHFFFAOYSA-N	0	3	344.842	3.497	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1cscn1	ZINC001133388889	1375972915	/nfs/dbraw/zinc/97/29/15/1375972915.db2.gz	PRKTVVQYBVBEEL-UHFFFAOYSA-N	0	3	347.871	3.052	20	30		EGEDHN
C[C@@H](C#N)C(=O)N(CCNC/C=C/Cl)Cc1cccc(Cl)c1	ZINC001133392641	1375977488	/nfs/dbraw/zinc/97/74/88/1375977488.db2.gz	HCLIITHSQGEMGY-YIALFULDSA-N	0	3	340.254	3.170	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@H](C)C1CCC1	ZINC001133399103	1375982232	/nfs/dbraw/zinc/98/22/32/1375982232.db2.gz	CJNJGFGNLBREJK-OAHLLOKOSA-N	0	3	332.875	3.328	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1nccs1	ZINC001133407880	1375992518	/nfs/dbraw/zinc/99/25/18/1375992518.db2.gz	QSSGVHYKJAKGNN-UHFFFAOYSA-N	0	3	347.871	3.052	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)[C@H](CC=C)c2ccccc2)CC1	ZINC001230324551	1375997327	/nfs/dbraw/zinc/99/73/27/1375997327.db2.gz	UHODJOLBSKLVKV-HXUWFJFHSA-N	0	3	342.483	3.130	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CCCC[C@H]2NCc2cncn2C)CCCC1	ZINC001230385861	1376011789	/nfs/dbraw/zinc/01/17/89/1376011789.db2.gz	CSCAGAQONCBDAP-QZTJIDSGSA-N	0	3	344.503	3.074	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)c1sccc1C	ZINC001133560493	1376088942	/nfs/dbraw/zinc/08/89/42/1376088942.db2.gz	VMNQDTOVFQADQM-RYUDHWBXSA-N	0	3	345.306	3.452	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)c1cccs1)NCc1cc(F)ccc1C#N	ZINC001133580835	1376103890	/nfs/dbraw/zinc/10/38/90/1376103890.db2.gz	DCTLIFRRNMUJKH-STQMWFEESA-N	0	3	345.443	3.446	20	30		EGEDHN
C=CCCOCC(=O)N1CCC([C@H]2CCCN2CC(=C)Cl)CC1	ZINC001230630286	1376107790	/nfs/dbraw/zinc/10/77/90/1376107790.db2.gz	RKZRKWUTRJFHPH-QGZVFWFLSA-N	0	3	340.895	3.035	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)c1ccsc1	ZINC001133633589	1376129390	/nfs/dbraw/zinc/12/93/90/1376129390.db2.gz	UVZYRDOVMQNTEF-GHMZBOCLSA-N	0	3	331.279	3.143	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)c1ccsc1)NCc1cc(F)ccc1C#N	ZINC001133633922	1376130136	/nfs/dbraw/zinc/13/01/36/1376130136.db2.gz	ZTEOADYTOWRQBB-OLZOCXBDSA-N	0	3	345.443	3.446	20	30		EGEDHN
C#CCCN(CCCNC(=O)C[C@@H]1CCC[C@@H]1C)Cc1cccnc1	ZINC001230767288	1376143564	/nfs/dbraw/zinc/14/35/64/1376143564.db2.gz	PTUNKJZEUANHHI-ICSRJNTNSA-N	0	3	341.499	3.240	20	30		EGEDHN
C#CCCN(CCCNC(=O)C[C@H]1CCC[C@H]1C)Cc1cccnc1	ZINC001230767290	1376143796	/nfs/dbraw/zinc/14/37/96/1376143796.db2.gz	PTUNKJZEUANHHI-UYAOXDASSA-N	0	3	341.499	3.240	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)c1cc(Cl)c[nH]1	ZINC001133672405	1376147619	/nfs/dbraw/zinc/14/76/19/1376147619.db2.gz	ZKNBKTZYFQNHFZ-UWVGGRQHSA-N	0	3	348.672	3.063	20	30		EGEDHN
C#CCCN(CCCNC(=O)[C@@H]1CCCC[C@H]1C)Cc1cccnc1	ZINC001230829330	1376162340	/nfs/dbraw/zinc/16/23/40/1376162340.db2.gz	FLRICUNBBMXVJW-UYAOXDASSA-N	0	3	341.499	3.240	20	30		EGEDHN
CCCSCC(=O)N[C@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001133821881	1376218369	/nfs/dbraw/zinc/21/83/69/1376218369.db2.gz	WAOUGVIEWZHION-HUUCEWRRSA-N	0	3	333.501	3.074	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)/C=C(\C)C1CC1	ZINC001133868250	1376242859	/nfs/dbraw/zinc/24/28/59/1376242859.db2.gz	WYOLAHLBQJTQKZ-ILGUYDGLSA-N	0	3	329.282	3.124	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H]2CN(Cc3ccccc3N(C)C)C[C@H]21	ZINC001188999129	1388431143	/nfs/dbraw/zinc/43/11/43/1388431143.db2.gz	DPIJDNVLCAHAIK-AZUAARDMSA-N	0	3	341.499	3.142	20	30		EGEDHN
CC#CCN(CCCNC(=O)c1ccsc1C(F)F)C1CC1	ZINC001752284502	1440165235	/nfs/dbraw/zinc/16/52/35/1440165235.db2.gz	HWAGJRBRTBOLPD-UHFFFAOYSA-N	0	3	326.412	3.293	20	30		EGEDHN
C#C[C@H]1CCCN(Cc2ccc(OC(=O)C(C)C)c(OCC)c2)C1	ZINC001231560008	1376265337	/nfs/dbraw/zinc/26/53/37/1376265337.db2.gz	PHTPCBXQKMMJBT-INIZCTEOSA-N	0	3	329.440	3.492	20	30		EGEDHN
O=C1CCC2(CCN(Cc3ccccc3C#Cc3ccccc3)CC2)N1	ZINC001231578654	1376269010	/nfs/dbraw/zinc/26/90/10/1376269010.db2.gz	PSLCUSVQAGJYGT-UHFFFAOYSA-N	0	3	344.458	3.331	20	30		EGEDHN
C=CCOc1cccc(CN2CC[C@]3(C[C@H](OCC4CC4)CO3)C2)c1	ZINC001231623494	1376285776	/nfs/dbraw/zinc/28/57/76/1376285776.db2.gz	GXEJNJABYBENEC-SFTDATJTSA-N	0	3	343.467	3.411	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1cc(F)ccc1C#N)NC(=O)C1CC=CC1	ZINC001133980155	1376295645	/nfs/dbraw/zinc/29/56/45/1376295645.db2.gz	UDEJAHKHEZNMJA-UONOGXRCSA-N	0	3	329.419	3.036	20	30		EGEDHN
C#Cc1cccc(CN2CCc3ccc(CC(=O)OCC)cc3C2)c1	ZINC001231655735	1376295778	/nfs/dbraw/zinc/29/57/78/1376295778.db2.gz	BRIQTEGEOONXRY-UHFFFAOYSA-N	0	3	333.431	3.332	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)CCC(F)(F)F	ZINC001134003338	1376306934	/nfs/dbraw/zinc/30/69/34/1376306934.db2.gz	IQRGHEUCCGJUSZ-ZJUUUORDSA-N	0	3	345.203	3.110	20	30		EGEDHN
C#CCCCC(=O)N[C@@H](C)C[C@@H](C)NCc1ccn(C(CC)CC)n1	ZINC001134206244	1376417744	/nfs/dbraw/zinc/41/77/44/1376417744.db2.gz	QULPDPPTMIPZPP-SJORKVTESA-N	0	3	346.519	3.421	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)c2ccc(Cl)c(F)c2)ccc1F	ZINC001134263747	1376444086	/nfs/dbraw/zinc/44/40/86/1376444086.db2.gz	NGKZUTPDPZLIAI-UHFFFAOYSA-N	0	3	349.768	3.009	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)c1sccc1F	ZINC001134273627	1376449059	/nfs/dbraw/zinc/44/90/59/1376449059.db2.gz	HVGYSPCPKWKTLL-UWVGGRQHSA-N	0	3	349.269	3.282	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)C(C)=C1CCC1	ZINC001134308912	1376467375	/nfs/dbraw/zinc/46/73/75/1376467375.db2.gz	WBCFEVNQXSJLNM-NWDGAFQWSA-N	0	3	329.282	3.268	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)C#CC(C)(C)C)NCc1cc(F)ccc1C#N	ZINC001134330089	1376480293	/nfs/dbraw/zinc/48/02/93/1376480293.db2.gz	VLJNYDHAHOOLTB-HUUCEWRRSA-N	0	3	343.446	3.120	20	30		EGEDHN
N#Cc1ccc([O-])c(C[N@@H+]2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)c1	ZINC001232678927	1376500638	/nfs/dbraw/zinc/50/06/38/1376500638.db2.gz	VDTGZWKGTDDTJD-JOCHJYFZSA-N	0	3	347.462	3.362	20	30		EGEDHN
N#Cc1ccc([O-])c(C[N@H+]2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)c1	ZINC001232678927	1376500643	/nfs/dbraw/zinc/50/06/43/1376500643.db2.gz	VDTGZWKGTDDTJD-JOCHJYFZSA-N	0	3	347.462	3.362	20	30		EGEDHN
N#Cc1ccc([O-])c(CN2CC[C@@]3(CC[N@H+](Cc4ccccc4)C3)C2)c1	ZINC001232678927	1376500645	/nfs/dbraw/zinc/50/06/45/1376500645.db2.gz	VDTGZWKGTDDTJD-JOCHJYFZSA-N	0	3	347.462	3.362	20	30		EGEDHN
N#Cc1ccc([O-])c(CN2CC[C@@]3(CC[N@@H+](Cc4ccccc4)C3)C2)c1	ZINC001232678927	1376500652	/nfs/dbraw/zinc/50/06/52/1376500652.db2.gz	VDTGZWKGTDDTJD-JOCHJYFZSA-N	0	3	347.462	3.362	20	30		EGEDHN
CCOC[C@@H]1COCCC12CCN(Cc1ccc(C#N)s1)CC2	ZINC001232843668	1376522636	/nfs/dbraw/zinc/52/26/36/1376522636.db2.gz	UKUYHGNWYHABHL-OAHLLOKOSA-N	0	3	334.485	3.275	20	30		EGEDHN
CCOC[C@H]1COCCC12CCN(Cc1ccc(C#N)s1)CC2	ZINC001232843667	1376523233	/nfs/dbraw/zinc/52/32/33/1376523233.db2.gz	UKUYHGNWYHABHL-HNNXBMFYSA-N	0	3	334.485	3.275	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H](C)C[C@@H](C)NCc1ccn(C(C)C)n1	ZINC001134457110	1376547974	/nfs/dbraw/zinc/54/79/74/1376547974.db2.gz	JTLLQVYHKPLCDW-HZPDHXFCSA-N	0	3	334.508	3.439	20	30		EGEDHN
C=CCO[C@@H]1CO[C@]2(C1)CCCN(Cc1ccc(C#N)cc1C)C2	ZINC001233081196	1376566876	/nfs/dbraw/zinc/56/68/76/1376566876.db2.gz	SIAFSAXBTOHHGN-PMACEKPBSA-N	0	3	326.440	3.193	20	30		EGEDHN
Cc1cc(C#N)ccc1CN(C)C[C@@H]1CN(Cc2ccccc2)CCO1	ZINC001233083354	1376568508	/nfs/dbraw/zinc/56/85/08/1376568508.db2.gz	HDFJTJAIHOKVMW-JOCHJYFZSA-N	0	3	349.478	3.200	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2ccccc2C#N)CCC1	ZINC001134593468	1376615142	/nfs/dbraw/zinc/61/51/42/1376615142.db2.gz	NHEJKKBINJSJDF-SJORKVTESA-N	0	3	337.467	3.125	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)C[C@H](C)NC/C(Cl)=C\Cl)CCC1	ZINC001134593198	1376615546	/nfs/dbraw/zinc/61/55/46/1376615546.db2.gz	JFNUHYIBXSAORH-NNQLKGDCSA-N	0	3	331.287	3.372	20	30		EGEDHN
C=CCOCCCC(=O)N(C)C[C@H]1CCN1CCCC1CCCC1	ZINC001233489899	1376655048	/nfs/dbraw/zinc/65/50/48/1376655048.db2.gz	NCBIODZKIQRSDH-LJQANCHMSA-N	0	3	336.520	3.472	20	30		EGEDHN
COc1ccc(C#N)c(C(=O)NC[C@H](c2ccccc2)N2CCCC2)c1	ZINC001189094964	1388456687	/nfs/dbraw/zinc/45/66/87/1388456687.db2.gz	ATFWGPYTOVILEO-HXUWFJFHSA-N	0	3	349.434	3.134	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)Cc1ccccc1)NCc1ccccc1C#N	ZINC001134747288	1376696770	/nfs/dbraw/zinc/69/67/70/1376696770.db2.gz	CLLHQGBENZKUHK-IRXDYDNUSA-N	0	3	335.451	3.174	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)Cc1ccccc1)NCc1ccccc1C#N	ZINC001134747286	1376697203	/nfs/dbraw/zinc/69/72/03/1376697203.db2.gz	CLLHQGBENZKUHK-IAGOWNOFSA-N	0	3	335.451	3.174	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)CCC(C)(F)F	ZINC001134761634	1376706252	/nfs/dbraw/zinc/70/62/52/1376706252.db2.gz	QWNWMPQTWGJGMG-MNOVXSKESA-N	0	3	341.240	3.203	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N(C)C[C@@H]2CCN2CCC(=C)C)cc1	ZINC001234254964	1376793285	/nfs/dbraw/zinc/79/32/85/1376793285.db2.gz	GTMQFKBLOUCKEA-IBGZPJMESA-N	0	3	340.467	3.201	20	30		EGEDHN
CC1(C)C2CCC1(C(=O)NCCNCc1ccc(C#N)c(F)c1)CC2	ZINC001134987684	1376829259	/nfs/dbraw/zinc/82/92/59/1376829259.db2.gz	YIGRGRLESWEFHF-UHFFFAOYSA-N	0	3	343.446	3.120	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H](C)C[C@@H](C)NCc1nc2ccccc2n1C	ZINC001135231238	1376991021	/nfs/dbraw/zinc/99/10/21/1376991021.db2.gz	YDWTYBPHSBAIRN-HUUCEWRRSA-N	0	3	342.487	3.158	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H](C)C[C@H](C)NCc1nc2ccccc2o1	ZINC001135236059	1376992690	/nfs/dbraw/zinc/99/26/90/1376992690.db2.gz	PRMSYQQIZYCRMW-HOTGVXAUSA-N	0	3	341.455	3.394	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1Cl)C1CCN(C(C)=O)CC1	ZINC001238086676	1376994453	/nfs/dbraw/zinc/99/44/53/1376994453.db2.gz	LXZWGNFSWLKNLS-UHFFFAOYSA-N	0	3	333.863	3.435	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)[C@H]1C[C@H]2C[C@H]2C1)NCc1cc(F)ccc1C#N	ZINC001135247133	1377000563	/nfs/dbraw/zinc/00/05/63/1377000563.db2.gz	QHLGLPXNZCJWQS-XSIBGMEISA-N	0	3	343.446	3.116	20	30		EGEDHN
C=CCO[C@@H]1CO[C@]2(C1)CCCN(Cc1ccc(C#N)c(CC)c1)C2	ZINC001238775816	1377001351	/nfs/dbraw/zinc/00/13/51/1377001351.db2.gz	PCKORSQGQHPTDE-SFTDATJTSA-N	0	3	340.467	3.447	20	30		EGEDHN
Cc1nc(C(=O)N[C@H](C)C[C@@H](C)NCc2ccccc2C#N)cs1	ZINC001135275392	1377017305	/nfs/dbraw/zinc/01/73/05/1377017305.db2.gz	XIPFSHSANZBTAC-CHWSQXEVSA-N	0	3	342.468	3.010	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)c1ccc(Cl)[nH]1	ZINC001135420036	1377085438	/nfs/dbraw/zinc/08/54/38/1377085438.db2.gz	SKHZVMLJPRCMOJ-UWVGGRQHSA-N	0	3	348.672	3.063	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)c1ccc(Cl)[nH]1)NCc1ccccc1C#N	ZINC001135435834	1377096742	/nfs/dbraw/zinc/09/67/42/1377096742.db2.gz	WTGUCDVVNAHYHJ-STQMWFEESA-N	0	3	344.846	3.226	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H](C)C[C@H](C)NCc1ncc(Cl)n1C	ZINC001135560972	1377144831	/nfs/dbraw/zinc/14/48/31/1377144831.db2.gz	NTRWNQFZVYUDIB-STQMWFEESA-N	0	3	340.899	3.049	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)C1(F)CCCCC1	ZINC001135854305	1377235759	/nfs/dbraw/zinc/23/57/59/1377235759.db2.gz	CDOXFECFWSFZSY-CHWSQXEVSA-N	0	3	349.288	3.440	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CC[C@@H](N(C)Cc2ccc(CF)cc2)C1	ZINC001189242128	1388493459	/nfs/dbraw/zinc/49/34/59/1388493459.db2.gz	FLDAABUCGNYKJB-QFBILLFUSA-N	0	3	348.462	3.170	20	30		EGEDHN
COc1ccccc1O[C@@H]1CCN(Cc2ccc(OCC#N)cc2)C1	ZINC001137119312	1377481395	/nfs/dbraw/zinc/48/13/95/1377481395.db2.gz	GCULAKZLQJIGMJ-GOSISDBHSA-N	0	3	338.407	3.251	20	30		EGEDHN
CC(C)(C)OC(=O)C[C@H]1CCCN1Cc1ccc(OCC#N)cc1	ZINC001137121534	1377482282	/nfs/dbraw/zinc/48/22/82/1377482282.db2.gz	PWUWUWQTSZWRJA-MRXNPFEDSA-N	0	3	330.428	3.285	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1c(C)noc1C(C)C)C(C)C	ZINC001268212261	1377495887	/nfs/dbraw/zinc/49/58/87/1377495887.db2.gz	KCYDJSFPYRSGFZ-CYBMUJFWSA-N	0	3	327.856	3.203	20	30		EGEDHN
N#Cc1ccc(N2CCN(Cc3cccc4ncccc34)CC2)cc1	ZINC001137628105	1377575426	/nfs/dbraw/zinc/57/54/26/1377575426.db2.gz	NZCORQPYUPZKKB-UHFFFAOYSA-N	0	3	328.419	3.429	20	30		EGEDHN
C#CCOc1ccc(CN2CCC(n3nccc3C)CC2)cc1OC	ZINC001138347340	1377707315	/nfs/dbraw/zinc/70/73/15/1377707315.db2.gz	VTUMTDNOTOBOSR-UHFFFAOYSA-N	0	3	339.439	3.049	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@@]3(C[C@H](OCC4CC4)CO3)C2)c1[O-]	ZINC001138628661	1377756818	/nfs/dbraw/zinc/75/68/18/1377756818.db2.gz	BFLWMUVBJYWUGI-PZJWPPBQSA-N	0	3	343.467	3.281	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@@]3(C[C@H](OCC4CC4)CO3)C2)c1[O-]	ZINC001138628661	1377756819	/nfs/dbraw/zinc/75/68/19/1377756819.db2.gz	BFLWMUVBJYWUGI-PZJWPPBQSA-N	0	3	343.467	3.281	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@H](N3Cc4ccccc4C3=O)C2)c1[O-]	ZINC001138630670	1377757868	/nfs/dbraw/zinc/75/78/68/1377757868.db2.gz	AITQCJGFZRHRFP-IBGZPJMESA-N	0	3	348.446	3.351	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@H](N3Cc4ccccc4C3=O)C2)c1[O-]	ZINC001138630670	1377757872	/nfs/dbraw/zinc/75/78/72/1377757872.db2.gz	AITQCJGFZRHRFP-IBGZPJMESA-N	0	3	348.446	3.351	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@H]1CCN(Cc1cnn(CCC)c1C)C2	ZINC001138636561	1377758938	/nfs/dbraw/zinc/75/89/38/1377758938.db2.gz	UULCPKJHTXMGOJ-VQTJNVASSA-N	0	3	347.503	3.175	20	30		EGEDHN
C=CCO[C@@H]1CO[C@@]2(C1)CCCN(Cc1ccc3c(c1)CCCO3)C2	ZINC001138715654	1377772428	/nfs/dbraw/zinc/77/24/28/1377772428.db2.gz	QODLUKHCYBOZCE-PZJWPPBQSA-N	0	3	343.467	3.338	20	30		EGEDHN
Cc1cccnc1O[C@H]1CCN(Cc2c[nH]c3c2cccc3C#N)C1	ZINC001139707656	1377938017	/nfs/dbraw/zinc/93/80/17/1377938017.db2.gz	NZMKQECSVOSISO-KRWDZBQOSA-N	0	3	332.407	3.396	20	30		EGEDHN
COc1ccc(O[C@H]2CCN(Cc3c[nH]c4c3cccc4C#N)C2)nc1	ZINC001139707500	1377938061	/nfs/dbraw/zinc/93/80/61/1377938061.db2.gz	HYHWHGMRYQZALF-KRWDZBQOSA-N	0	3	348.406	3.096	20	30		EGEDHN
Cc1cccc(O[C@H]2CCN(Cc3c[nH]c4c3cccc4C#N)C2)n1	ZINC001139707863	1377939049	/nfs/dbraw/zinc/93/90/49/1377939049.db2.gz	WHYVCIMHVGTNIW-KRWDZBQOSA-N	0	3	332.407	3.396	20	30		EGEDHN
C=CCOC(=O)N1CCCC2(CCN(Cc3ccc(C)cn3)CC2)C1	ZINC001139837444	1377959537	/nfs/dbraw/zinc/95/95/37/1377959537.db2.gz	CXWWLNMCUAJEAL-UHFFFAOYSA-N	0	3	343.471	3.391	20	30		EGEDHN
C=CCN1C(=O)CCC[C@@]12CCC[N@@H+](Cc1cc(F)ccc1[O-])C2	ZINC001140062882	1377998966	/nfs/dbraw/zinc/99/89/66/1377998966.db2.gz	HMKXTBGVIHMWLQ-IBGZPJMESA-N	0	3	332.419	3.064	20	30		EGEDHN
C=CCN1C(=O)CCC[C@@]12CCC[N@H+](Cc1cc(F)ccc1[O-])C2	ZINC001140062882	1377998967	/nfs/dbraw/zinc/99/89/67/1377998967.db2.gz	HMKXTBGVIHMWLQ-IBGZPJMESA-N	0	3	332.419	3.064	20	30		EGEDHN
CCOC(=O)C[C@H]1CCCN(Cc2c[nH]c3ccc(C#N)cc23)C1	ZINC001140110926	1378009758	/nfs/dbraw/zinc/00/97/58/1378009758.db2.gz	VCFWGXIMHDPGTD-OAHLLOKOSA-N	0	3	325.412	3.205	20	30		EGEDHN
Cc1cccc(O[C@@H]2CCN(Cc3c[nH]c4ccc(C#N)cc34)C2)n1	ZINC001140117130	1378011979	/nfs/dbraw/zinc/01/19/79/1378011979.db2.gz	LXNNMNSVNSULJK-QGZVFWFLSA-N	0	3	332.407	3.396	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1ccc(O)cc1F)[C@@H]2CC	ZINC001140125880	1378013527	/nfs/dbraw/zinc/01/35/27/1378013527.db2.gz	KPXKEBAVMRQBAR-QUCCMNQESA-N	0	3	346.446	3.453	20	30		EGEDHN
C=CCN1C(=O)CCC12CCN(Cc1[nH]nc3ccc(C)cc31)CC2	ZINC001140326797	1378045974	/nfs/dbraw/zinc/04/59/74/1378045974.db2.gz	BPCAWDWJQHBYCB-UHFFFAOYSA-N	0	3	338.455	3.014	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(C[C@H](c4ccccc4)CO3)CC2)cn1	ZINC001140543473	1378081967	/nfs/dbraw/zinc/08/19/67/1378081967.db2.gz	OYCOOBGTOZISBK-IBGZPJMESA-N	0	3	333.435	3.492	20	30		EGEDHN
CN(Cc1ccc(C#N)nc1)C[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC001140546151	1378082684	/nfs/dbraw/zinc/08/26/84/1378082684.db2.gz	WAYBQEGAJJDAFG-MRXNPFEDSA-N	0	3	344.459	3.032	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3cc(O)cc(Cl)c3)C2)C1=O	ZINC001140788733	1378136153	/nfs/dbraw/zinc/13/61/53/1378136153.db2.gz	SRLPXCFCUGHPKB-GOSISDBHSA-N	0	3	334.847	3.046	20	30		EGEDHN
CCN1CCC2(CCN(Cc3cccc(C#N)c3Cl)CC2)C1=O	ZINC001140812651	1378148154	/nfs/dbraw/zinc/14/81/54/1378148154.db2.gz	FBOGKRIOYWHWSQ-UHFFFAOYSA-N	0	3	331.847	3.046	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3cccc(C#N)c3Cl)C2)C1=O	ZINC001140811001	1378148540	/nfs/dbraw/zinc/14/85/40/1378148540.db2.gz	DPMWCWSIOXHOPY-LJQANCHMSA-N	0	3	343.858	3.212	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3ccc(OC)cc3Cl)C2)C1=O	ZINC001140819785	1378150702	/nfs/dbraw/zinc/15/07/02/1378150702.db2.gz	JUDWXEGTPGEDEC-LJQANCHMSA-N	0	3	348.874	3.349	20	30		EGEDHN
Cc1sccc1C(=O)NC[C@@H](C)N(C)Cc1cccc(C#N)c1	ZINC001275827021	1378158252	/nfs/dbraw/zinc/15/82/52/1378158252.db2.gz	FEHPOKJSHHRAET-CYBMUJFWSA-N	0	3	327.453	3.179	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@@H]1CCN(Cc1sccc1OC)C2	ZINC001141323362	1378301513	/nfs/dbraw/zinc/30/15/13/1378301513.db2.gz	WWVSYESOAZJUPH-QZTJIDSGSA-N	0	3	337.485	3.330	20	30		EGEDHN
CCN1CCN(Cc2ccc(Br)cc2C#N)C(C)(C)C1	ZINC001141818563	1378381671	/nfs/dbraw/zinc/38/16/71/1378381671.db2.gz	JWOKPQLJVVOPIR-UHFFFAOYSA-N	0	3	336.277	3.237	20	30		EGEDHN
CC(C)(C)N1CCN(Cc2cc(Br)ccc2C#N)CC1	ZINC001141903191	1378392386	/nfs/dbraw/zinc/39/23/86/1378392386.db2.gz	VGKZAXISVKQHIN-UHFFFAOYSA-N	0	3	336.277	3.237	20	30		EGEDHN
CSc1nc(CN2CC[C@@H](N3CCCCC3)[C@@H](F)C2)ccc1C#N	ZINC001141948349	1378397097	/nfs/dbraw/zinc/39/70/97/1378397097.db2.gz	VBEUESCNWPUVSN-DLBZAZTESA-N	0	3	348.491	3.073	20	30		EGEDHN
COC(=O)[C@H]1CCN(Cc2ccc(C#Cc3ccccc3)s2)C1	ZINC001141972667	1378400319	/nfs/dbraw/zinc/40/03/19/1378400319.db2.gz	PKHFDYNLGNUYST-INIZCTEOSA-N	0	3	325.433	3.143	20	30		EGEDHN
Cc1ccc([C@@H](CNC(=O)[C@H](CC#N)c2ccccc2)N(C)C)cc1	ZINC001142539563	1378455213	/nfs/dbraw/zinc/45/52/13/1378455213.db2.gz	SWBABWNMKCELTQ-WOJBJXKFSA-N	0	3	335.451	3.411	20	30		EGEDHN
COC(=O)Cc1ccc(CN2CCC(C#N)(c3ccccc3)CC2)cc1	ZINC001142898995	1378507153	/nfs/dbraw/zinc/50/71/53/1378507153.db2.gz	TZYVYHNEXRQKJO-UHFFFAOYSA-N	0	3	348.446	3.459	20	30		EGEDHN
Cc1cncnc1O[C@@H]1CCCN(Cc2c[nH]c3cc(C#N)ccc23)C1	ZINC001142931158	1378512176	/nfs/dbraw/zinc/51/21/76/1378512176.db2.gz	OWBHASMVZNDCCZ-QGZVFWFLSA-N	0	3	347.422	3.181	20	30		EGEDHN
C#Cc1ccc(CN2CC[C@@H]3[C@H]2CCC(=O)N3c2ccccc2)cc1	ZINC001144571956	1378746729	/nfs/dbraw/zinc/74/67/29/1378746729.db2.gz	MBDSEABLNLQCHX-NHCUHLMSSA-N	0	3	330.431	3.438	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2cnc(C)o2)CCCCC1	ZINC001146699026	1378899861	/nfs/dbraw/zinc/89/98/61/1378899861.db2.gz	BQPBUQBJOMURPW-HZPDHXFCSA-N	0	3	345.487	3.330	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)c1ccc(F)s1)NCc1ccccc1C#N	ZINC001146735626	1378910861	/nfs/dbraw/zinc/91/08/61/1378910861.db2.gz	PGSCCVIEBAVVQJ-CHWSQXEVSA-N	0	3	345.443	3.446	20	30		EGEDHN
C=CCCC(=O)N1CC2(C1)CCN(Cc1cccc(OCCC)c1)C2	ZINC001147182282	1378983275	/nfs/dbraw/zinc/98/32/75/1378983275.db2.gz	RZVXILLJNUFOTI-UHFFFAOYSA-N	0	3	342.483	3.476	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC2(C1)CCN(Cc1ccc(C)nc1C)C2	ZINC001148130736	1379122746	/nfs/dbraw/zinc/12/27/46/1379122746.db2.gz	PGCUWUBGPIKBPR-SFHVURJKSA-N	0	3	341.499	3.335	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC2(C1)CCN(Cc1cnccc1C)C2	ZINC001148147721	1379125856	/nfs/dbraw/zinc/12/58/56/1379125856.db2.gz	YQJCXCQQIAFUGV-KRWDZBQOSA-N	0	3	327.472	3.027	20	30		EGEDHN
C=CCCCC(=O)N1CC2(C1)CCN(Cc1cccc(COC)c1)C2	ZINC001148194085	1379131266	/nfs/dbraw/zinc/13/12/66/1379131266.db2.gz	RWDJMQBIYBDVJI-UHFFFAOYSA-N	0	3	342.483	3.224	20	30		EGEDHN
C=CCCCC(=O)N1CC2(C1)CCN(Cc1ccc(OC)c(C)c1)C2	ZINC001148199553	1379133055	/nfs/dbraw/zinc/13/30/55/1379133055.db2.gz	JOQOQYBDWSMBDW-UHFFFAOYSA-N	0	3	342.483	3.394	20	30		EGEDHN
CCCCCCCCCC(=O)NCCN[C@@H](C)C(=O)NCCCC	ZINC001148825744	1379277160	/nfs/dbraw/zinc/27/71/60/1379277160.db2.gz	KWNZYFPEBNREAU-KRWDZBQOSA-N	0	3	341.540	3.138	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2c(Cl)cccc2Cl)cc1	ZINC001148909973	1379295941	/nfs/dbraw/zinc/29/59/41/1379295941.db2.gz	DOZMLRAMDQHYSO-UHFFFAOYSA-N	0	3	348.233	3.385	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H]1CN(Cc2ccccc2CC)CCCO1	ZINC001150224419	1379518619	/nfs/dbraw/zinc/51/86/19/1379518619.db2.gz	LLJLQKGIMBHFNA-HXUWFJFHSA-N	0	3	344.499	3.312	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@H]2CN([C@H](C)c3ccccc3)CCCO2)C1	ZINC001150293338	1379530035	/nfs/dbraw/zinc/53/00/35/1379530035.db2.gz	YBTFVSWKHUWVOU-MJGOQNOKSA-N	0	3	342.483	3.311	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)[C@H](C)CC2CCCCC2)C1	ZINC001150417562	1379551816	/nfs/dbraw/zinc/55/18/16/1379551816.db2.gz	NUCVWNPKSJGCPX-IEBWSBKVSA-N	0	3	336.520	3.376	20	30		EGEDHN
Cc1cc(C(=O)NCCNCc2ccc(C#N)cc2)c(C)n1C(C)C	ZINC001150509374	1379559956	/nfs/dbraw/zinc/55/99/56/1379559956.db2.gz	LKVGJKOAJKCUHY-UHFFFAOYSA-N	0	3	338.455	3.077	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)[C@@H](CCC)c2ccccc2)C1	ZINC001150686225	1379595608	/nfs/dbraw/zinc/59/56/08/1379595608.db2.gz	XVRLBSYWKSXRTM-PMACEKPBSA-N	0	3	344.499	3.354	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)[C@@]2(C)CCC(C)=C(C)C2)C1	ZINC001150818376	1379618600	/nfs/dbraw/zinc/61/86/00/1379618600.db2.gz	QBUBQVAXWCEYRF-QUCCMNQESA-N	0	3	334.504	3.296	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2ccsc2C)CC1	ZINC001151115085	1379662747	/nfs/dbraw/zinc/66/27/47/1379662747.db2.gz	QCQUCZHCVBWINE-UHFFFAOYSA-N	0	3	336.501	3.234	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@H](CC)CC(F)F)CC1	ZINC001151161866	1379669968	/nfs/dbraw/zinc/66/99/68/1379669968.db2.gz	FCFLBGIYKNXEER-OAHLLOKOSA-N	0	3	346.462	3.231	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2cc(C)cc(C)c2)CC1	ZINC001151402375	1379711507	/nfs/dbraw/zinc/71/15/07/1379711507.db2.gz	GGPCKHJCTKICQP-UHFFFAOYSA-N	0	3	344.499	3.480	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)C2CCC=CCC2)CC1	ZINC001151409133	1379713125	/nfs/dbraw/zinc/71/31/25/1379713125.db2.gz	ZKNMLLQQXVFJJN-UHFFFAOYSA-N	0	3	334.504	3.296	20	30		EGEDHN
C[C@@H](C(=O)NCCNCc1ccc(C#N)cc1)c1cccc(Cl)c1	ZINC001151642683	1379753946	/nfs/dbraw/zinc/75/39/46/1379753946.db2.gz	ZYHJRLXQDXASIY-CQSZACIVSA-N	0	3	341.842	3.221	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)[C@@H]1CC=CCC1	ZINC001151830952	1379790221	/nfs/dbraw/zinc/79/02/21/1379790221.db2.gz	QXBFKYGHMCMBMW-NVXWUHKLSA-N	0	3	343.446	3.380	20	30		EGEDHN
CCCCC[C@@H](CC)C(=O)NCCNCc1ccc(OC)c(C#N)c1	ZINC001151891156	1379811659	/nfs/dbraw/zinc/81/16/59/1379811659.db2.gz	UHRSMKKSOQZHPQ-QGZVFWFLSA-N	0	3	345.487	3.379	20	30		EGEDHN
CCN(Cc1cc2ccccc2o1)[C@H](C)CNC(=O)CSCC#N	ZINC001151965274	1379827269	/nfs/dbraw/zinc/82/72/69/1379827269.db2.gz	HNOCSQPOCSZPAV-CQSZACIVSA-N	0	3	345.468	3.016	20	30		EGEDHN
CCN(C/C=C\c1ccccc1)[C@H](C)CNC(=O)c1ccc(C#N)[nH]1	ZINC001152775330	1379980547	/nfs/dbraw/zinc/98/05/47/1379980547.db2.gz	RGBNXCZSVXQHBD-BSDKJSHOSA-N	0	3	336.439	3.040	20	30		EGEDHN
CC(C)Cc1ccccc1C(=O)NCCNCc1ccc(C#N)cc1	ZINC001152943066	1379997071	/nfs/dbraw/zinc/99/70/71/1379997071.db2.gz	SJUBBPRPTUYMPU-UHFFFAOYSA-N	0	3	335.451	3.276	20	30		EGEDHN
C#CCC1(C(=O)NCCNCc2cc(C)ccc2OC)CCCCC1	ZINC001153014987	1380008093	/nfs/dbraw/zinc/00/80/93/1380008093.db2.gz	JUIWYVJXPIKPDH-UHFFFAOYSA-N	0	3	342.483	3.183	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H](C)N(CC)C[C@@H](O)c1ccc(F)cc1	ZINC001153626103	1380106480	/nfs/dbraw/zinc/10/64/80/1380106480.db2.gz	ZJLJBGLFUMGMNI-CRAIPNDOSA-N	0	3	336.451	3.042	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1cncc(-c2ccccc2)c1	ZINC001153727894	1380119605	/nfs/dbraw/zinc/11/96/05/1380119605.db2.gz	HGAXCAFDIXSFMV-QGZVFWFLSA-N	0	3	335.451	3.212	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1cc(C)n(C(CC)CC)n1	ZINC001154116930	1380211949	/nfs/dbraw/zinc/21/19/49/1380211949.db2.gz	ZUTWZAVUDONXLU-MRXNPFEDSA-N	0	3	332.492	3.016	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)Cc1ccc(C)cc1	ZINC001154212837	1380230317	/nfs/dbraw/zinc/23/03/17/1380230317.db2.gz	WLUVAHIMZJOSFH-GOSISDBHSA-N	0	3	349.478	3.436	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)[C@]12C[C@H]1CCC2	ZINC001154396293	1380269161	/nfs/dbraw/zinc/26/91/61/1380269161.db2.gz	DVEKSVYTZIFHAH-XFQXTVEOSA-N	0	3	325.456	3.075	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)[C@]1(C)C[C@H]2C[C@H]2C1	ZINC001154435547	1380276797	/nfs/dbraw/zinc/27/67/97/1380276797.db2.gz	FAFIRPFNQQEDEU-KBMWQNTOSA-N	0	3	339.483	3.321	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H](C)N(CC)Cc2ccc(F)cc2)cc1	ZINC001154561408	1380306337	/nfs/dbraw/zinc/30/63/37/1380306337.db2.gz	BIKSMOMCZSCXIC-MRXNPFEDSA-N	0	3	338.426	3.447	20	30		EGEDHN
C#CCCCNc1ccc2c(=O)n(Cc3ccc(OC)cc3)cc-2[nH]1	ZINC001155017871	1380392669	/nfs/dbraw/zinc/39/26/69/1380392669.db2.gz	HCGQAEPQXHBBAA-UHFFFAOYSA-N	0	3	335.407	3.072	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)Cc1occc1C	ZINC001155155402	1380416902	/nfs/dbraw/zinc/41/69/02/1380416902.db2.gz	IFPNKFPEFJICPW-MRXNPFEDSA-N	0	3	339.439	3.029	20	30		EGEDHN
C[C@@H](N)c1nc2ccccc2n1-c1nc(-c2ccncc2)ccc1C#N	ZINC001155259318	1380429883	/nfs/dbraw/zinc/42/98/83/1380429883.db2.gz	XISIMPPTAHKIDZ-CYBMUJFWSA-N	0	3	340.390	3.374	20	30		EGEDHN
C=CCOC(=O)[C@@H](Nc1ccc(CN2CCCC2)cn1)[C@@H](C)CC	ZINC001157186766	1380801174	/nfs/dbraw/zinc/80/11/74/1380801174.db2.gz	YMLJBZIZKNQOQI-YJBOKZPZSA-N	0	3	331.460	3.233	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1cc(C)oc1C	ZINC001157503998	1380949977	/nfs/dbraw/zinc/94/99/77/1380949977.db2.gz	UBSXRKGFXLQZBT-QGZVFWFLSA-N	0	3	334.460	3.026	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc(OC)c(OC)c1C	ZINC001158113507	1381131703	/nfs/dbraw/zinc/13/17/03/1381131703.db2.gz	QEMLSIRQSKRUMH-MRXNPFEDSA-N	0	3	346.471	3.125	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)Cc1cccc2cccnc21	ZINC001158296942	1381190479	/nfs/dbraw/zinc/19/04/79/1381190479.db2.gz	XJUXCZUVNBEUTG-LJQANCHMSA-N	0	3	337.467	3.276	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCCC[C@@H]2CN(C)CCOC(C)C)cc1	ZINC001158311239	1381195236	/nfs/dbraw/zinc/19/52/36/1381195236.db2.gz	YJGWMQVPNRWOSF-HXUWFJFHSA-N	0	3	342.483	3.019	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H]1CCOc2ccccc21	ZINC001158616996	1381323831	/nfs/dbraw/zinc/32/38/31/1381323831.db2.gz	WSNDYGIFXKFYOF-AEFFLSMTSA-N	0	3	328.456	3.052	20	30		EGEDHN
CC1=C(C)C[C@@H](C(=O)NCCCNCc2ccccc2C#N)CC1	ZINC001158722296	1381367122	/nfs/dbraw/zinc/36/71/22/1381367122.db2.gz	XCGXSFFMCSHYJF-KRWDZBQOSA-N	0	3	325.456	3.291	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)Cn1c(C)cc2ccccc21	ZINC001328361642	1388729526	/nfs/dbraw/zinc/72/95/26/1388729526.db2.gz	OUAIGPBMJROYCG-AWEZNQCLSA-N	0	3	333.863	3.187	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCC1=CCN([C@H]2CCc3ccc(F)cc32)CC1	ZINC001159593588	1381839174	/nfs/dbraw/zinc/83/91/74/1381839174.db2.gz	HACXWHGDJJJORD-LIRRHRJNSA-N	0	3	341.430	3.111	20	30		EGEDHN
CC(C)CC1(C(=O)NCCCNCc2cc(C#N)ccc2F)CC1	ZINC001159592964	1381839661	/nfs/dbraw/zinc/83/96/61/1381839661.db2.gz	WZDJEJQEOSWEQD-UHFFFAOYSA-N	0	3	331.435	3.120	20	30		EGEDHN
C#CCC1(C(=O)NCCCN[C@@H](C)c2cc(F)ccc2F)CCC1	ZINC001159666449	1381863808	/nfs/dbraw/zinc/86/38/08/1381863808.db2.gz	VFULVYSPWRJSRC-AWEZNQCLSA-N	0	3	334.410	3.315	20	30		EGEDHN
N#Cc1ccc(CN2CC=C(CCNC(=O)C3CC=CC3)CC2)cc1	ZINC001159708193	1381876408	/nfs/dbraw/zinc/87/64/08/1381876408.db2.gz	VKSITVADQJTHJV-UHFFFAOYSA-N	0	3	335.451	3.163	20	30		EGEDHN
NCc1cnccc1Nc1c(F)c(F)c(C(F)(F)F)c(F)c1F	ZINC001159969910	1381953141	/nfs/dbraw/zinc/95/31/41/1381953141.db2.gz	DQXHUBSKDPUQFF-UHFFFAOYSA-N	0	3	339.214	3.281	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2sc(Cl)nc2C)CC1	ZINC001160247593	1382049083	/nfs/dbraw/zinc/04/90/83/1382049083.db2.gz	VMXVMUWMFFJPAV-UHFFFAOYSA-N	0	3	325.865	3.043	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccccc2-c2cn[nH]c2)CC1	ZINC001160315305	1382069952	/nfs/dbraw/zinc/06/99/52/1382069952.db2.gz	WQLODKLJPOWOLI-UHFFFAOYSA-N	0	3	336.439	3.015	20	30		EGEDHN
N#CCc1ccc(OCc2ccc(Nc3ccc(CN)nc3)nc2)cc1	ZINC001160401769	1382094781	/nfs/dbraw/zinc/09/47/81/1382094781.db2.gz	ANJMWBAVBQKPOT-UHFFFAOYSA-N	0	3	345.406	3.324	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccnc(-c3ccco3)c2)CC1	ZINC001160449452	1382105700	/nfs/dbraw/zinc/10/57/00/1382105700.db2.gz	DVPAZWKFKCCCFP-UHFFFAOYSA-N	0	3	349.434	3.117	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)Cc2ccc(C)c(Cl)c2)CC1	ZINC001160467758	1382114849	/nfs/dbraw/zinc/11/48/49/1382114849.db2.gz	VRFSKBHSMKSPPV-UHFFFAOYSA-N	0	3	344.886	3.353	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)Cc2cccc3cnccc32)CC1	ZINC001160479093	1382118485	/nfs/dbraw/zinc/11/84/85/1382118485.db2.gz	NPAWAUMDJASUCE-UHFFFAOYSA-N	0	3	335.451	3.102	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc(-c3ccccc3)on2)CC1	ZINC001160628968	1382156380	/nfs/dbraw/zinc/15/63/80/1382156380.db2.gz	WGTWEQXEICDKQA-UHFFFAOYSA-N	0	3	349.434	3.117	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CCc2ccc(OC)c(F)c2)CC1	ZINC001160671430	1382166298	/nfs/dbraw/zinc/16/62/98/1382166298.db2.gz	ISUKBFOTKIPJKL-UHFFFAOYSA-N	0	3	346.446	3.091	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cnn(C(C)C)c2Cl)CC1	ZINC001160793163	1382197303	/nfs/dbraw/zinc/19/73/03/1382197303.db2.gz	SHTWVGIXXHAFFH-UHFFFAOYSA-N	0	3	336.867	3.055	20	30		EGEDHN
CC(C)(C)OC(=O)C(C#N)c1nccnc1N[C@@H]1CCC(C)(C)C1	ZINC001161035222	1382277705	/nfs/dbraw/zinc/27/77/05/1382277705.db2.gz	GYCXYWPERVLCEK-OLZOCXBDSA-N	0	3	330.432	3.416	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2c(Cl)cncc2Cl)CC1	ZINC001161101607	1382296602	/nfs/dbraw/zinc/29/66/02/1382296602.db2.gz	GGLKUQQGBBTHOR-UHFFFAOYSA-N	0	3	340.254	3.326	20	30		EGEDHN
C=CCC1(C(=O)NCCC2=CCN(CCOCC3CC3)CC2)CCC1	ZINC001161125981	1382309298	/nfs/dbraw/zinc/30/92/98/1382309298.db2.gz	KDGVUGPRTACGDB-UHFFFAOYSA-N	0	3	346.515	3.298	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H](C)OC2CCCCCC2)CC1	ZINC001161177576	1382326298	/nfs/dbraw/zinc/32/62/98/1382326298.db2.gz	BBPIHIKZYXOAER-KRWDZBQOSA-N	0	3	334.504	3.439	20	30		EGEDHN
CC(C)[C@H](C)C(=O)NCCC1=CCN(Cc2ccc(C#N)cc2)CC1	ZINC001161368737	1382385813	/nfs/dbraw/zinc/38/58/13/1382385813.db2.gz	IYJBFWMLZQZWJG-KRWDZBQOSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ncoc2-c2cccs2)CC1	ZINC001161491685	1382421861	/nfs/dbraw/zinc/42/18/61/1382421861.db2.gz	LLVDORHZGKXCLL-UHFFFAOYSA-N	0	3	343.452	3.341	20	30		EGEDHN
N#Cc1ccc(CN2CC=C(CCNC(=O)Cc3ccco3)CC2)cc1	ZINC001161519220	1382429567	/nfs/dbraw/zinc/42/95/67/1382429567.db2.gz	NKTCQSJCENSSGX-UHFFFAOYSA-N	0	3	349.434	3.032	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cccn2C2CCCC2)CC1	ZINC001161585844	1382447997	/nfs/dbraw/zinc/44/79/97/1382447997.db2.gz	YEMVMDZBUIPQKP-UHFFFAOYSA-N	0	3	339.483	3.379	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)[C@@H]1CCC[C@@H](C(F)(F)F)C1	ZINC001161596721	1382449918	/nfs/dbraw/zinc/44/99/18/1382449918.db2.gz	VBLSKOORRPMNNJ-VXGBXAGGSA-N	0	3	326.790	3.204	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CCCOc2cccc(C)c2)CC1	ZINC001161818177	1382518849	/nfs/dbraw/zinc/51/88/49/1382518849.db2.gz	QIEZEZOCXJNZDG-UHFFFAOYSA-N	0	3	342.483	3.478	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NCCC1=CCN(Cc2csc(C)c2)CC1	ZINC001161978074	1382584456	/nfs/dbraw/zinc/58/44/56/1382584456.db2.gz	MBDJCGCVPOKCDK-INIZCTEOSA-N	0	3	348.512	3.286	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NCCC1=CCN(Cc2csc(C)c2)CC1	ZINC001161978076	1382584643	/nfs/dbraw/zinc/58/46/43/1382584643.db2.gz	MBDJCGCVPOKCDK-MRXNPFEDSA-N	0	3	348.512	3.286	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2c[nH]c3ccc(F)cc23)CC1	ZINC001162012183	1382600729	/nfs/dbraw/zinc/60/07/29/1382600729.db2.gz	POMQTLFCKJTXJA-UHFFFAOYSA-N	0	3	327.403	3.245	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1ccc(Cl)cc1F	ZINC001162065939	1382617962	/nfs/dbraw/zinc/61/79/62/1382617962.db2.gz	UWVPGSKUYUOPQT-UHFFFAOYSA-N	0	3	345.805	3.260	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)C2(C)CCCCCC2)(COC)CC1	ZINC001162306515	1382726919	/nfs/dbraw/zinc/72/69/19/1382726919.db2.gz	NYLPPGGGXFWSST-UHFFFAOYSA-N	0	3	348.531	3.215	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1cc(C)cc(Cl)c1	ZINC001162578118	1382797161	/nfs/dbraw/zinc/79/71/61/1382797161.db2.gz	DZBUXPUOPNBQIS-UHFFFAOYSA-N	0	3	345.668	3.267	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C1CCCCC1	ZINC001162678498	1382830955	/nfs/dbraw/zinc/83/09/55/1382830955.db2.gz	RZVFVCDNSARLMQ-UHFFFAOYSA-N	0	3	326.484	3.251	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)C2CCC3(CC3)CC2)c(F)c1	ZINC001162685097	1382833433	/nfs/dbraw/zinc/83/34/33/1382833433.db2.gz	SPRDGQWAOSIKDW-UHFFFAOYSA-N	0	3	343.446	3.264	20	30		EGEDHN
COc1nc(-n2c3ccccc3nc2[C@H](C)N)c(C#N)c(C)c1Cl	ZINC001162759965	1382862357	/nfs/dbraw/zinc/86/23/57/1382862357.db2.gz	VBNIPQDHYZGPIB-JTQLQIEISA-N	0	3	341.802	3.282	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1cccc(F)c1C	ZINC001162822368	1382886473	/nfs/dbraw/zinc/88/64/73/1382886473.db2.gz	MYHSPQVRAWLZSS-UHFFFAOYSA-N	0	3	338.426	3.042	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C1(C(F)F)CCCC1	ZINC001162897907	1382909254	/nfs/dbraw/zinc/90/92/54/1382909254.db2.gz	OTFMVSCAIHYERB-UHFFFAOYSA-N	0	3	348.437	3.106	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)CCCc1ccccc1	ZINC001162911407	1382913681	/nfs/dbraw/zinc/91/36/81/1382913681.db2.gz	LWDIOWXOIFCAIF-UHFFFAOYSA-N	0	3	348.490	3.303	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1ccc2[nH]ccc2c1	ZINC001162911242	1382914046	/nfs/dbraw/zinc/91/40/46/1382914046.db2.gz	JBDPBDZJIJNMDS-UHFFFAOYSA-N	0	3	345.446	3.076	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1cc(C)ccc1F	ZINC001162946959	1382924331	/nfs/dbraw/zinc/92/43/31/1382924331.db2.gz	UZHVYJBRFMJINI-UHFFFAOYSA-N	0	3	338.426	3.042	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H](C)CC1CCCC1	ZINC001162952240	1382925910	/nfs/dbraw/zinc/92/59/10/1382925910.db2.gz	IQEDOYGCNDUMQU-LJQANCHMSA-N	0	3	340.511	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1cccc(Cl)c1	ZINC001162992448	1382940620	/nfs/dbraw/zinc/94/06/20/1382940620.db2.gz	PEUQMDRGKZLPED-UHFFFAOYSA-N	0	3	340.854	3.248	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C[C@H](C)C1CC1	ZINC001163006299	1382945804	/nfs/dbraw/zinc/94/58/04/1382945804.db2.gz	CDOLWZMMVYREHC-SFHVURJKSA-N	0	3	326.484	3.107	20	30		EGEDHN
C[Si](C)(C)C#Cc1ccc(N[C@H]2CCCC[C@@]23CNCCO3)cn1	ZINC001163653284	1383095927	/nfs/dbraw/zinc/09/59/27/1383095927.db2.gz	GTYXOJKEIAYTRW-RBUKOAKNSA-N	0	3	343.547	3.024	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCCNCc2cc(Cl)ccc2F)cc1	ZINC001163734092	1383116208	/nfs/dbraw/zinc/11/62/08/1383116208.db2.gz	IGLRYJFELWBJNU-UHFFFAOYSA-N	0	3	344.817	3.370	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCCNCc1ccn(C(CC)CC)n1	ZINC001163860843	1383130701	/nfs/dbraw/zinc/13/07/01/1383130701.db2.gz	RJYALLPQXVCYHQ-UHFFFAOYSA-N	0	3	334.508	3.442	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)/C=C(\C)CC)CC1	ZINC001164448055	1383187885	/nfs/dbraw/zinc/18/78/85/1383187885.db2.gz	OVIYAFVGUKDLPV-FMIVXFBMSA-N	0	3	329.282	3.127	20	30		EGEDHN
CC(C)C#CC(=O)NCCC1(CNCc2cc(F)ccc2F)CC1	ZINC001164460767	1383188936	/nfs/dbraw/zinc/18/89/36/1383188936.db2.gz	GQNFXCAAKUODFD-UHFFFAOYSA-N	0	3	334.410	3.000	20	30		EGEDHN
CCN1CCC(N(C)C(F)(F)c2ccnc(Cl)c2C#N)CC1	ZINC001165069022	1383221907	/nfs/dbraw/zinc/22/19/07/1383221907.db2.gz	SMOGYQWTONSDSI-UHFFFAOYSA-N	0	3	328.794	3.072	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C2(C(F)(F)F)CCC2)CC1	ZINC001165764153	1383341795	/nfs/dbraw/zinc/34/17/95/1383341795.db2.gz	NFJBUWVCAYQDQX-UHFFFAOYSA-N	0	3	338.801	3.348	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc3[nH]nc(C)c3c2)CC1	ZINC001166117356	1383392059	/nfs/dbraw/zinc/39/20/59/1383392059.db2.gz	TZZOUCMORLKZDX-UHFFFAOYSA-N	0	3	346.862	3.114	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCCNCc2cc(OC)ccc2Cl)C1	ZINC001166239175	1383405681	/nfs/dbraw/zinc/40/56/81/1383405681.db2.gz	ORIDUTKQOXKARX-UHFFFAOYSA-N	0	3	336.863	3.301	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@@H]2CCCCC2(F)F)CC1	ZINC001166391354	1383418261	/nfs/dbraw/zinc/41/82/61/1383418261.db2.gz	SGSFIBSQEQLRHH-ZDUSSCGKSA-N	0	3	334.838	3.441	20	30		EGEDHN
CC(C)[C@H](F)C(=O)NCCC1(CNCc2cc(C#N)ccc2F)CC1	ZINC001166722956	1383466979	/nfs/dbraw/zinc/46/69/79/1383466979.db2.gz	MJOQAUMBMMOKNK-KRWDZBQOSA-N	0	3	349.425	3.068	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCCC1(CN[C@H](C)c2cnc(C)cn2)CC1	ZINC001166755602	1383472517	/nfs/dbraw/zinc/47/25/17/1383472517.db2.gz	MFZOHSCIKPQBSH-NVXWUHKLSA-N	0	3	344.503	3.324	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C[C@H](C)C(F)(F)F)CC1	ZINC001166946097	1383503695	/nfs/dbraw/zinc/50/36/95/1383503695.db2.gz	XHUJEWKBSPAYQT-JTQLQIEISA-N	0	3	326.790	3.204	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCC1(CN[C@@H](C)c2cnccn2)CC1	ZINC001167018094	1383520002	/nfs/dbraw/zinc/52/00/02/1383520002.db2.gz	ARSFECAPEJGZDU-YJBOKZPZSA-N	0	3	330.476	3.016	20	30		EGEDHN
C=CCCC1(C(=O)NCCC2(CNCc3conc3C)CC2)CC1	ZINC001167025178	1383521191	/nfs/dbraw/zinc/52/11/91/1383521191.db2.gz	CEKJCWLDHUPURN-UHFFFAOYSA-N	0	3	331.460	3.106	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)Cc2ccc(CC)cc2)CC1	ZINC001167351890	1383607292	/nfs/dbraw/zinc/60/72/92/1383607292.db2.gz	QZDPQPHWWBHYRD-UHFFFAOYSA-N	0	3	334.891	3.420	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1ccsc1Cl	ZINC001167650939	1383698245	/nfs/dbraw/zinc/69/82/45/1383698245.db2.gz	XGOAKJPSZBEKBJ-UHFFFAOYSA-N	0	3	337.670	3.020	20	30		EGEDHN
N#Cc1ccc(-c2ccccc2)nc1-n1nc(CN)c2ccccc21	ZINC001167695335	1383713441	/nfs/dbraw/zinc/71/34/41/1383713441.db2.gz	GNUVDJYVKUPQJW-UHFFFAOYSA-N	0	3	325.375	3.418	20	30		EGEDHN
CCCCN(CCC#N)C1CCN(C(=O)c2cccc(OC)c2)CC1	ZINC001167873941	1383763325	/nfs/dbraw/zinc/76/33/25/1383763325.db2.gz	JZRRBWFOIVWRHT-UHFFFAOYSA-N	0	3	343.471	3.316	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2c(C)nsc2C)CC1	ZINC001168366275	1383884166	/nfs/dbraw/zinc/88/41/66/1383884166.db2.gz	HGHNRNNJOSULFN-UHFFFAOYSA-N	0	3	327.881	3.002	20	30		EGEDHN
N#Cc1c(C#N)c(NCCN2CCCCC2)nc2c1CCCCCC2	ZINC001306930277	1383922610	/nfs/dbraw/zinc/92/26/10/1383922610.db2.gz	JGJYERGXHBNMTO-UHFFFAOYSA-N	0	3	337.471	3.382	20	30		EGEDHN
C[C@@H]1C[C@H](N(C)Cc2cccc(C#N)c2)CN1C(=O)OC(C)(C)C	ZINC001168886472	1384046576	/nfs/dbraw/zinc/04/65/76/1384046576.db2.gz	YODCNYLPSXKABY-PBHICJAKSA-N	0	3	329.444	3.388	20	30		EGEDHN
C[C@@H](N)c1ccn(-c2cc(Br)cc(Cl)c2C#N)n1	ZINC001169233851	1384125646	/nfs/dbraw/zinc/12/56/46/1384125646.db2.gz	SWWZSRQSRPIADZ-SSDOTTSWSA-N	0	3	325.597	3.180	20	30		EGEDHN
CSC[C@@H](C)C(=O)N[C@H](C)CCCCNCc1ccccc1C#N	ZINC001169821721	1384189051	/nfs/dbraw/zinc/18/90/51/1384189051.db2.gz	NDOUQYZAVYGQNR-HZPDHXFCSA-N	0	3	347.528	3.322	20	30		EGEDHN
C#CCCCCC(=O)N[C@H](C)CCCCNCc1ncc(C)s1	ZINC001170281739	1384281129	/nfs/dbraw/zinc/28/11/29/1384281129.db2.gz	BGKXRRYZRVDCIA-OAHLLOKOSA-N	0	3	335.517	3.410	20	30		EGEDHN
N#CC1(c2ccccc2)CCC(NCc2cc3n(n2)CCCO3)CC1	ZINC001170376952	1384303594	/nfs/dbraw/zinc/30/35/94/1384303594.db2.gz	TVMWXEXKOZESOU-UHFFFAOYSA-N	0	3	336.439	3.159	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H](C)CCCCNCc1csc(C2CC2)n1	ZINC001170637108	1384354953	/nfs/dbraw/zinc/35/49/53/1384354953.db2.gz	BVRIDOLMVLQLES-HNNXBMFYSA-N	0	3	347.528	3.445	20	30		EGEDHN
C[C@@H](CCCCNCc1cc(F)ccc1C#N)NC(=O)c1cc[nH]c1	ZINC001170932501	1384413529	/nfs/dbraw/zinc/41/35/29/1384413529.db2.gz	IALNLCCEOUUABL-AWEZNQCLSA-N	0	3	342.418	3.104	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H](C)CCCCNCc1nnc(C)n1CCC	ZINC001171035730	1384433853	/nfs/dbraw/zinc/43/38/53/1384433853.db2.gz	PIUUAUIIHMVEOV-INIZCTEOSA-N	0	3	349.523	3.117	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H](C)CCCCNCc1cc2n(n1)CCCC2	ZINC001171043085	1384435225	/nfs/dbraw/zinc/43/52/25/1384435225.db2.gz	IETBIGZEXLIOAF-KRWDZBQOSA-N	0	3	346.519	3.340	20	30		EGEDHN
C[C@@H](Cc1cccc(C#N)c1)NCc1ccncc1Br	ZINC001171191968	1384464994	/nfs/dbraw/zinc/46/49/94/1384464994.db2.gz	JCXDXNRLIXBTIK-LBPRGKRZSA-N	0	3	330.229	3.437	20	30		EGEDHN
COc1ccc(N2CCN([C@H](C)Cc3cccc(C#N)c3)CC2)cc1	ZINC001171203302	1384467900	/nfs/dbraw/zinc/46/79/00/1384467900.db2.gz	LCUXASKHFHYRFV-QGZVFWFLSA-N	0	3	335.451	3.320	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1CC[C@@H](N(C)C(=O)OC(C)(C)C)C1	ZINC001171224713	1384473235	/nfs/dbraw/zinc/47/32/35/1384473235.db2.gz	UUOAOPBLKPJRIB-CRAIPNDOSA-N	0	3	343.471	3.430	20	30		EGEDHN
Cc1cncnc1O[C@H]1CCCN([C@@H](C)Cc2cccc(C#N)c2)C1	ZINC001171232492	1384475643	/nfs/dbraw/zinc/47/56/43/1384475643.db2.gz	SUZRSCJZAOAMSF-LPHOPBHVSA-N	0	3	336.439	3.131	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1C[C@@H](NC(=O)OC(C)(C)C)C[C@H]1C	ZINC001171233536	1384475822	/nfs/dbraw/zinc/47/58/22/1384475822.db2.gz	ANQUGLSNBLAHRN-RKVPGOIHSA-N	0	3	343.471	3.477	20	30		EGEDHN
CCCN(CCC#N)C1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccccc1	ZINC001171271239	1384482622	/nfs/dbraw/zinc/48/26/22/1384482622.db2.gz	GKFUQOBVRZFOOB-DFNIBXOVSA-N	0	3	325.456	3.448	20	30		EGEDHN
CN(C)Cc1cccc(NC2(C#N)CCN(Cc3ccccc3)CC2)n1	ZINC001171275452	1384483282	/nfs/dbraw/zinc/48/32/82/1384483282.db2.gz	WCSKRTLNEDKJFX-UHFFFAOYSA-N	0	3	349.482	3.113	20	30		EGEDHN
C=CCOc1ccccc1[C@H](C)Nc1ccc2c(n1)OCCNC2	ZINC001171370686	1384504045	/nfs/dbraw/zinc/50/40/45/1384504045.db2.gz	YPNKYFLSZPINOD-AWEZNQCLSA-N	0	3	325.412	3.302	20	30		EGEDHN
CCCCCCCCC(=O)NCCCNCc1cc(OC)ns1	ZINC001171822821	1384651438	/nfs/dbraw/zinc/65/14/38/1384651438.db2.gz	OSYJZJPBRPHKIH-UHFFFAOYSA-N	0	3	341.521	3.498	20	30		EGEDHN
CCCCCCCN1CCC[C@@H](NC(=O)c2ccn(C(F)F)n2)C1	ZINC001316943552	1384715182	/nfs/dbraw/zinc/71/51/82/1384715182.db2.gz	GUABJYIDJQWXPY-CQSZACIVSA-N	0	3	342.434	3.443	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)N(C)C1CN(C(=O)OC(C)(C)C)C1	ZINC001172317143	1384768841	/nfs/dbraw/zinc/76/88/41/1384768841.db2.gz	BSZZVSUXECEXJU-AWEZNQCLSA-N	0	3	329.444	3.040	20	30		EGEDHN
CC(C)C(C)(C)C(=O)NC[C@H](NCc1cc(C#N)ccc1F)C1CC1	ZINC001317016818	1384781004	/nfs/dbraw/zinc/78/10/04/1384781004.db2.gz	GNUKADDSALRUEO-SFHVURJKSA-N	0	3	345.462	3.364	20	30		EGEDHN
CCOC(=O)c1ccc(N2CCN([C@H](C)CCCC#N)CC2)cc1	ZINC001172497423	1384805114	/nfs/dbraw/zinc/80/51/14/1384805114.db2.gz	BTEQQDRTBJHLHP-MRXNPFEDSA-N	0	3	329.444	3.068	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H](N[C@@H]2CCCC[C@H]2F)C[C@H]1C#N	ZINC001172967570	1384892071	/nfs/dbraw/zinc/89/20/71/1384892071.db2.gz	YLQSXPSPNCBEGO-BYNSBNAKSA-N	0	3	325.428	3.148	20	30		EGEDHN
CCCCN(CCC#N)C1CCN(C(=O)c2ccc(F)cc2)CC1	ZINC001173000841	1384896679	/nfs/dbraw/zinc/89/66/79/1384896679.db2.gz	CRAOUUQDJUCROA-UHFFFAOYSA-N	0	3	331.435	3.446	20	30		EGEDHN
C=CCOC[C@H]1CCC[C@@]12CN([C@H]1CCc3ncsc3C1)CCO2	ZINC001173137144	1384921006	/nfs/dbraw/zinc/92/10/06/1384921006.db2.gz	JDCSHBCLGILLJK-JTDSTZFVSA-N	0	3	348.512	3.074	20	30		EGEDHN
C=C(Br)CN[C@@H](C)CCNC(=O)[C@H](C)C1CCCC1	ZINC001317412230	1385123184	/nfs/dbraw/zinc/12/31/84/1385123184.db2.gz	YFUUUWUIRAWBDU-QWHCGFSZSA-N	0	3	331.298	3.206	20	30		EGEDHN
CCOC(=O)[C@@H]1CCCc2sc(Nc3ccnc(C)c3)c(C#N)c21	ZINC001174651876	1385130766	/nfs/dbraw/zinc/13/07/66/1385130766.db2.gz	PKXIVGNYJFVZIJ-CYBMUJFWSA-N	0	3	341.436	3.472	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)c1ccsc1C(F)(F)F	ZINC001174706803	1385137672	/nfs/dbraw/zinc/13/76/72/1385137672.db2.gz	WXEHCLBGGOAIRT-UHFFFAOYSA-N	0	3	326.771	3.229	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@H](C)CCCCNCc1cc(OC)no1	ZINC001174832870	1385156328	/nfs/dbraw/zinc/15/63/28/1385156328.db2.gz	GXHBQFWUJOWLAN-CABCVRRESA-N	0	3	337.464	3.050	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H](C)CCCCNCc2cc(C)no2)CC1	ZINC001175074442	1385190187	/nfs/dbraw/zinc/19/01/87/1385190187.db2.gz	RXWOQRMTBQJOQE-OAHLLOKOSA-N	0	3	333.476	3.494	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](C)CCCCNCc2ocnc2C)CC1	ZINC001175074140	1385190306	/nfs/dbraw/zinc/19/03/06/1385190306.db2.gz	NZMVWZGGXCQKGO-HNNXBMFYSA-N	0	3	333.476	3.494	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](C)CCCCNCc2cc(C)no2)CC1	ZINC001175074410	1385190398	/nfs/dbraw/zinc/19/03/98/1385190398.db2.gz	QZRPQSIQOCQQQJ-OAHLLOKOSA-N	0	3	333.476	3.494	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H](C)CCCCNCc1cc2n(n1)CCC2	ZINC001175081917	1385191582	/nfs/dbraw/zinc/19/15/82/1385191582.db2.gz	KIUXUPUVDZGXSV-JXFKEZNVSA-N	0	3	346.519	3.196	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H](C)CCCCNCc1cn(C(C)C)nn1	ZINC001175082259	1385191684	/nfs/dbraw/zinc/19/16/84/1385191684.db2.gz	NHENOCHEVJFMTC-LPHOPBHVSA-N	0	3	349.523	3.226	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1cc2ccccc2o1	ZINC001175299251	1385243735	/nfs/dbraw/zinc/24/37/35/1385243735.db2.gz	WIDZQIYIPDTRFP-UHFFFAOYSA-N	0	3	333.391	3.214	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H](C)CCCCN[C@H](C)c1nnc(CC)[nH]1	ZINC001175469041	1385301862	/nfs/dbraw/zinc/30/18/62/1385301862.db2.gz	MGYMCUOHZFKYBR-LSDHHAIUSA-N	0	3	349.523	3.295	20	30		EGEDHN
CC1(C(=O)NCC[C@H]2CCN(Cc3ccccc3C#N)C2)CCCC1	ZINC001317795048	1385487495	/nfs/dbraw/zinc/48/74/95/1385487495.db2.gz	HELYMJBRLLWVTH-KRWDZBQOSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)C(=O)NCCCNCc1ocnc1C	ZINC001176746247	1385680452	/nfs/dbraw/zinc/68/04/52/1385680452.db2.gz	XUEVCYNPAZGODI-GOSISDBHSA-N	0	3	341.455	3.014	20	30		EGEDHN
O=C(CC#Cc1ccccc1)NCCCNCc1cc(F)ccc1F	ZINC001176762486	1385687766	/nfs/dbraw/zinc/68/77/66/1385687766.db2.gz	CZOYQPCWOARABZ-UHFFFAOYSA-N	0	3	342.389	3.003	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)CCCCNCc2nccn2C)CCCC1	ZINC001176847603	1385722440	/nfs/dbraw/zinc/72/24/40/1385722440.db2.gz	CLOYMTSMRBKCRT-QGZVFWFLSA-N	0	3	346.519	3.321	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)CC(C2CC2)C2CC2)c(F)c1	ZINC001177042176	1385782019	/nfs/dbraw/zinc/78/20/19/1385782019.db2.gz	KVZZXWWFQBCDGZ-UHFFFAOYSA-N	0	3	343.446	3.120	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)[C@@H]2CC3CCC2CC3)c(F)c1	ZINC001177073955	1385796292	/nfs/dbraw/zinc/79/62/92/1385796292.db2.gz	ISCFCILISYEJDD-JFUPDXTOSA-N	0	3	343.446	3.120	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)COc2cccc(C)c2)CCCC1	ZINC001318666313	1385827272	/nfs/dbraw/zinc/82/72/72/1385827272.db2.gz	MJGNYYVICZQABV-UHFFFAOYSA-N	0	3	336.863	3.145	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2ccsn2)CCCC[C@H]1C	ZINC001318743319	1385850674	/nfs/dbraw/zinc/85/06/74/1385850674.db2.gz	HNOIOQLUZWXYHV-ABAIWWIYSA-N	0	3	327.881	3.164	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)c1ccc(C(F)(F)F)s1	ZINC001177301149	1385903935	/nfs/dbraw/zinc/90/39/35/1385903935.db2.gz	SRRRHXARRVRFPR-UHFFFAOYSA-N	0	3	326.771	3.229	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)c1coc(C2CCCCC2)n1	ZINC001177234388	1385878460	/nfs/dbraw/zinc/87/84/60/1385878460.db2.gz	MCQSKTMTGIIUAD-UHFFFAOYSA-N	0	3	325.840	3.184	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@H]1CCCOC1	ZINC001177250334	1385884065	/nfs/dbraw/zinc/88/40/65/1385884065.db2.gz	OGKVDWXXRSYDMT-KRWDZBQOSA-N	0	3	342.911	3.164	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NCCCNCc1c(Cl)cccc1Cl	ZINC001177276694	1385893559	/nfs/dbraw/zinc/89/35/59/1385893559.db2.gz	GQZRKXUPJNNDGP-GFCCVEGCSA-N	0	3	345.270	3.180	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@H]1CC[C@@H](C)O1	ZINC001177428037	1385952750	/nfs/dbraw/zinc/95/27/50/1385952750.db2.gz	WWNVPZQFVYCTSI-NVXWUHKLSA-N	0	3	342.911	3.305	20	30		EGEDHN
CC1(C)C(C)(C)C1(C)C(=O)NCCCNCc1ccccc1C#N	ZINC001177540597	1385990181	/nfs/dbraw/zinc/99/01/81/1385990181.db2.gz	STEFDKMEMSSYJX-UHFFFAOYSA-N	0	3	327.472	3.226	20	30		EGEDHN
C=C(CNCc1ccccc1O[C@@H](C)C(=O)OC)c1ccccc1	ZINC001177687630	1386022781	/nfs/dbraw/zinc/02/27/81/1386022781.db2.gz	DVOBSJLCMKKSAW-INIZCTEOSA-N	0	3	325.408	3.430	20	30		EGEDHN
COc1ccc(Cl)c(CNC2(CNC(=O)[C@H](C)C#N)CCCC2)c1	ZINC001319341433	1386069002	/nfs/dbraw/zinc/06/90/02/1386069002.db2.gz	ROGMVHXBARGHLA-CYBMUJFWSA-N	0	3	349.862	3.027	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2Cl)CCN1C(=O)CC1CC1	ZINC001178024135	1386111171	/nfs/dbraw/zinc/11/11/71/1386111171.db2.gz	XRDHNSBDRCPDQI-KSSFIOAISA-N	0	3	330.859	3.071	20	30		EGEDHN
CC(C)CCC(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@@H]1C	ZINC001178101831	1386128665	/nfs/dbraw/zinc/12/86/65/1386128665.db2.gz	INEPFZBDTLKDGJ-LPHOPBHVSA-N	0	3	330.447	3.192	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2Cl)CCN1C(=O)c1ccoc1	ZINC001178105918	1386130163	/nfs/dbraw/zinc/13/01/63/1386130163.db2.gz	CNRGAOJSQPIJEI-KSSFIOAISA-N	0	3	342.826	3.177	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N(C)[C@H](C)CNCc1ccc(F)c(C#N)c1	ZINC001319462796	1386132664	/nfs/dbraw/zinc/13/26/64/1386132664.db2.gz	HYXDCXYDDKXIGB-CQSZACIVSA-N	0	3	333.451	3.316	20	30		EGEDHN
CS[C@H](C)CC(=O)NCCCCCCNCc1ccccc1C#N	ZINC001178240917	1386169598	/nfs/dbraw/zinc/16/95/98/1386169598.db2.gz	WBPFXITVSXEBLZ-MRXNPFEDSA-N	0	3	347.528	3.466	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccc(Cl)cc2)CCN1C(=O)[C@H]1CC1(C)C	ZINC001178481931	1386231308	/nfs/dbraw/zinc/23/13/08/1386231308.db2.gz	SMGHIQUNMVNIQG-QGTPRVQTSA-N	0	3	344.886	3.317	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCCCCCNCc1nccn1CC	ZINC001178580230	1386255127	/nfs/dbraw/zinc/25/51/27/1386255127.db2.gz	RKGABJZLCHPQOC-UHFFFAOYSA-N	0	3	334.508	3.272	20	30		EGEDHN
CC#CCCCC(=O)NCCCCCCNCc1ncc(C)s1	ZINC001179315874	1386449194	/nfs/dbraw/zinc/44/91/94/1386449194.db2.gz	LBPGXGJZMUBQOQ-UHFFFAOYSA-N	0	3	335.517	3.411	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCCCCCCN[C@@H](C)c1nnc(C)[nH]1	ZINC001179340337	1386457179	/nfs/dbraw/zinc/45/71/79/1386457179.db2.gz	ZIYYDTSPNHISDV-HOCLYGCPSA-N	0	3	335.496	3.043	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCCCCCNCc1cn(C(C)C)nn1	ZINC001179482209	1386494858	/nfs/dbraw/zinc/49/48/58/1386494858.db2.gz	RMCVJOJPJFRJGX-LJQANCHMSA-N	0	3	349.523	3.228	20	30		EGEDHN
C=CCC1(C(=O)NCCCCCCNCc2cc(C)no2)CCC1	ZINC001179487544	1386495795	/nfs/dbraw/zinc/49/57/95/1386495795.db2.gz	VTYIUHIBYMOEKJ-UHFFFAOYSA-N	0	3	333.476	3.496	20	30		EGEDHN
C=CCC1(C(=O)NCCCCCCNCc2cc(C)n(C)n2)CCC1	ZINC001179487532	1386495870	/nfs/dbraw/zinc/49/58/70/1386495870.db2.gz	SEUMMXDDBRNPMX-UHFFFAOYSA-N	0	3	346.519	3.241	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CC[C@H](NCC#Cc2ccc(Cl)cc2)[C@@H]1C	ZINC001179561921	1386515407	/nfs/dbraw/zinc/51/54/07/1386515407.db2.gz	XPRCNHNMVXSMMZ-WLWJZTKJSA-N	0	3	344.886	3.317	20	30		EGEDHN
CC(=O)N1CC[C@H](NCc2cccc(OCC#N)c2)c2ccccc2C1	ZINC001320161840	1386541583	/nfs/dbraw/zinc/54/15/83/1386541583.db2.gz	RCOSITHYDUZGBL-NRFANRHFSA-N	0	3	349.434	3.172	20	30		EGEDHN
C#CCN(CC1CC1)C(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F	ZINC001321905462	1387007455	/nfs/dbraw/zinc/00/74/55/1387007455.db2.gz	SEOJKNAXBGKVJX-SFHVURJKSA-N	0	3	346.421	3.016	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2cc(C)no2)C1	ZINC001181573607	1387019083	/nfs/dbraw/zinc/01/90/83/1387019083.db2.gz	VCEGMYDLWFHWBF-FOIQADDNSA-N	0	3	345.487	3.326	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)[C@](C)(CNCc2oc(CC)nc2C)C1	ZINC001181629994	1387027301	/nfs/dbraw/zinc/02/73/01/1387027301.db2.gz	RAEWLBPKTZNFLI-FOIQADDNSA-N	0	3	347.503	3.476	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)c1cc2ccccn2c1	ZINC001322259606	1387126482	/nfs/dbraw/zinc/12/64/82/1387126482.db2.gz	ZGRMZJMXFZYBJW-MRXNPFEDSA-N	0	3	346.434	3.061	20	30		EGEDHN
CCCCN(CC)[C@H](C(=O)N1C[C@@H](F)C[C@H]1C#N)c1ccccc1	ZINC001182233604	1387128432	/nfs/dbraw/zinc/12/84/32/1387128432.db2.gz	IRPFSPFCDIZYEZ-BZSNNMDCSA-N	0	3	331.435	3.312	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)C12CCC(CC1)CC2	ZINC001322299706	1387149271	/nfs/dbraw/zinc/14/92/71/1387149271.db2.gz	WOPIMZRBGFOVJY-ZGGTZUKQSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CC[C@@H](NCc2ccc(Cl)c(F)c2)C1	ZINC001182423111	1387164384	/nfs/dbraw/zinc/16/43/84/1387164384.db2.gz	QSGDVYOFEIJSPO-CQSZACIVSA-N	0	3	336.838	3.219	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](NCc2cc(C)ccc2OC)C1	ZINC001182894268	1387241055	/nfs/dbraw/zinc/24/10/55/1387241055.db2.gz	SLPMBDMZPLMIMS-QGZVFWFLSA-N	0	3	330.472	3.296	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)CC2(C)CC2)CC1	ZINC001698709444	1406351223	/nfs/dbraw/zinc/35/12/23/1406351223.db2.gz	ICWZCKRYBARXNV-JOCQHMNTSA-N	0	3	329.282	3.102	20	30		EGEDHN
C[C@@H](CNC(=O)C1(C)CCCCC1)N(C)Cc1ccc(C#N)cc1	ZINC001329532882	1389145624	/nfs/dbraw/zinc/14/56/24/1389145624.db2.gz	RXGKIKBQSGDYQY-INIZCTEOSA-N	0	3	327.472	3.465	20	30		EGEDHN
C=CCn1c([C@H](C)OC(C)(C)C)nnc1N1C[C@@H](C)N(CC)C[C@@H]1C	ZINC001338994552	1389853963	/nfs/dbraw/zinc/85/39/63/1389853963.db2.gz	FRILHZQEBHSBRX-PMPSAXMXSA-N	0	3	349.523	3.259	20	30		EGEDHN
Cc1ccc(C2=NO[C@@H](CN[C@H](C)CC3(C#N)CCOCC3)C2)cc1	ZINC001332725462	1390170851	/nfs/dbraw/zinc/17/08/51/1390170851.db2.gz	SOPMPENTHQHIRW-SJLPKXTDSA-N	0	3	341.455	3.177	20	30		EGEDHN
CC[C@]1(CCc2ccccc2)CCCN1C(=O)[C@H](N)CCCC#N	ZINC001333729614	1390386612	/nfs/dbraw/zinc/38/66/12/1390386612.db2.gz	AUISBBFDRLWTTI-UYAOXDASSA-N	0	3	327.472	3.412	20	30		EGEDHN
C[C@H](NC(=O)[C@H](N)CCCC#N)c1cc(Cl)cc(Cl)c1F	ZINC001341162336	1390450452	/nfs/dbraw/zinc/45/04/52/1390450452.db2.gz	PHWBRTBSIMYUQB-QPUJVOFHSA-N	0	3	332.206	3.331	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N(C)Cc1cc(Br)ccc1F	ZINC001341519856	1390497064	/nfs/dbraw/zinc/49/70/64/1390497064.db2.gz	BSMGAAYSVNBZME-CQSZACIVSA-N	0	3	343.240	3.230	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)C(C#N)C(=O)Nc1ccc(C(=O)OCC)cc1	ZINC001341954937	1390554164	/nfs/dbraw/zinc/55/41/64/1390554164.db2.gz	IHNKWZWGNPUKQX-XJKSGUPXSA-N	0	3	342.395	3.113	20	30		EGEDHN
N#CC(C(=O)CCc1cnn(-c2ccccc2)c1)c1cccc(F)n1	ZINC001343312021	1390706710	/nfs/dbraw/zinc/70/67/10/1390706710.db2.gz	JVZMQUFKQCVJIR-INIZCTEOSA-N	0	3	334.354	3.215	20	30		EGEDHN
Cn1c(Cl)cnc1C(C#N)C(=O)C1CC(OCc2ccccc2)C1	ZINC001349702628	1391356085	/nfs/dbraw/zinc/35/60/85/1391356085.db2.gz	RGPHOBYWRKPZJB-NRXISQOPSA-N	0	3	343.814	3.245	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N(C)CCCc1cc(-c2ccccc2)n[nH]1	ZINC001353193220	1391956408	/nfs/dbraw/zinc/95/64/08/1391956408.db2.gz	TXIOWFXKWTWTSN-SFHVURJKSA-N	0	3	340.471	3.151	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1cccc(OC)c1	ZINC001479834219	1392420210	/nfs/dbraw/zinc/42/02/10/1392420210.db2.gz	OAKGEWXONJCMFK-PBHICJAKSA-N	0	3	336.863	3.421	20	30		EGEDHN
C=CCCOCC(=O)N1CC[C@H](N[C@H](C)c2ccccc2Cl)C1	ZINC001480122597	1392595370	/nfs/dbraw/zinc/59/53/70/1392595370.db2.gz	JYUPBHWOXSITIW-CABCVRRESA-N	0	3	336.863	3.184	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](NCc2cc(F)cc(F)c2)C1	ZINC001480618523	1392822787	/nfs/dbraw/zinc/82/27/87/1392822787.db2.gz	CPQHIDSEYGCITD-SFHVURJKSA-N	0	3	334.410	3.239	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cc(OC)cs2)CCCC1	ZINC001482226767	1394820859	/nfs/dbraw/zinc/82/08/59/1394820859.db2.gz	UMSDQQHLFOYNEE-UHFFFAOYSA-N	0	3	328.865	3.141	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1coc(C2CCC2)n1)C(C)C	ZINC001698978031	1406750205	/nfs/dbraw/zinc/75/02/05/1406750205.db2.gz	PDMOYNQHYMQWAF-CYBMUJFWSA-N	0	3	325.840	3.039	20	30		EGEDHN
C=C(Br)CNCC(C)(C)CN(C)C(=O)CC1(C)CC1	ZINC001485255843	1395742593	/nfs/dbraw/zinc/74/25/93/1395742593.db2.gz	BSTXXLIBDZLVLG-UHFFFAOYSA-N	0	3	331.298	3.159	20	30		EGEDHN
Cc1csc(C(=O)N(C)C[C@@H](C)NCc2ccc(C#N)s2)c1	ZINC001485870027	1396160523	/nfs/dbraw/zinc/16/05/23/1396160523.db2.gz	CTSPGENLZULOCU-GFCCVEGCSA-N	0	3	333.482	3.240	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)CCc1cncc(C)c1	ZINC001689905685	1404199446	/nfs/dbraw/zinc/19/94/46/1404199446.db2.gz	OYPDMOKZTYNRQR-FUHWJXTLSA-N	0	3	349.906	3.434	20	30		EGEDHN
C[C@@H](C(=O)N(C)C1CCN(Cc2ccc(C#N)cc2)CC1)C(C)(F)F	ZINC001690027165	1404265433	/nfs/dbraw/zinc/26/54/33/1404265433.db2.gz	BKZLMYQXDSYPHN-AWEZNQCLSA-N	0	3	349.425	3.272	20	30		EGEDHN
C[C@H](C(=O)N(C)C1CCN(Cc2ccc(C#N)cc2)CC1)C(C)(F)F	ZINC001690027166	1404265629	/nfs/dbraw/zinc/26/56/29/1404265629.db2.gz	BKZLMYQXDSYPHN-CQSZACIVSA-N	0	3	349.425	3.272	20	30		EGEDHN
CC(C)(C)CC(=O)NC[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001690374485	1404505737	/nfs/dbraw/zinc/50/57/37/1404505737.db2.gz	RDBJKRAAARCMKO-SFHVURJKSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1ccnc(-c2ccco2)c1	ZINC001690848958	1404775353	/nfs/dbraw/zinc/77/53/53/1404775353.db2.gz	PKAQOOCSTQIFFC-CYBMUJFWSA-N	0	3	333.819	3.192	20	30		EGEDHN
C[C@H](CCNC(=O)C(C)(C)C1CC1)NCc1cc(C#N)ccc1F	ZINC001690859505	1404780790	/nfs/dbraw/zinc/78/07/90/1404780790.db2.gz	GCGQEPLAOFBNIR-CYBMUJFWSA-N	0	3	331.435	3.118	20	30		EGEDHN
C[C@H](CCNC(=O)[C@H](C)c1ccccc1)NCc1ccccc1C#N	ZINC001690874116	1404788916	/nfs/dbraw/zinc/78/89/16/1404788916.db2.gz	CGTNMUOIZVDOPK-IAGOWNOFSA-N	0	3	335.451	3.346	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)Cc2coc3ccccc23)C1	ZINC001691175266	1405111216	/nfs/dbraw/zinc/11/12/16/1405111216.db2.gz	VTVZNNOXGFFTTG-CTYIDZIISA-N	0	3	332.831	3.212	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)[C@H](C)C2CCCC2)C1	ZINC001691825642	1405541547	/nfs/dbraw/zinc/54/15/47/1405541547.db2.gz	RFINHLNBBQNKBW-UMVBOHGHSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)C[C@@H](CC)C(C)C)C1	ZINC001691825528	1405541703	/nfs/dbraw/zinc/54/17/03/1405541703.db2.gz	NGXZLYKVGFPZRS-RBSFLKMASA-N	0	3	345.325	3.452	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)C(C)(C)c2ccc(F)cc2)C1	ZINC001691825237	1405541917	/nfs/dbraw/zinc/54/19/17/1405541917.db2.gz	BXDMNRZDTYIODO-SAZUREKKSA-N	0	3	338.854	3.340	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2nc(C)n3ccccc23)CCCC1	ZINC001732230687	1428477811	/nfs/dbraw/zinc/47/78/11/1428477811.db2.gz	KZTCRGRPZOGNEZ-UHFFFAOYSA-N	0	3	346.862	3.027	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@@H]1CC[C@@H](N[C@@H](C)c2nc3ccccc3o2)CC1	ZINC001732305896	1428521845	/nfs/dbraw/zinc/52/18/45/1428521845.db2.gz	JEQWEUVRBOBFOF-LXTVHRRPSA-N	0	3	340.427	3.065	20	30		EGEDHN
Cc1cc(C)c(C(=O)N[C@H](C)CNCc2ccc(F)c(C#N)c2)s1	ZINC001699364240	1412670874	/nfs/dbraw/zinc/67/08/74/1412670874.db2.gz	RUQURIYMWCKZOU-GFCCVEGCSA-N	0	3	345.443	3.284	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)NC(=O)c1cccc(C(F)F)c1	ZINC001699428868	1412745078	/nfs/dbraw/zinc/74/50/78/1412745078.db2.gz	UFQXBRCCOJOXQF-NSHDSACASA-N	0	3	349.406	3.465	20	30		EGEDHN
C=C(Br)CN[C@@H](C)CCNC(=O)[C@@H](C)c1ccccc1	ZINC001700327555	1413797834	/nfs/dbraw/zinc/79/78/34/1413797834.db2.gz	MLYVQPYHTIYOTC-KBPBESRZSA-N	0	3	339.277	3.183	20	30		EGEDHN
Cc1ccoc1C(=O)N1CCCC[C@H]1CNCC#Cc1ccccc1	ZINC001700343621	1413829771	/nfs/dbraw/zinc/82/97/71/1413829771.db2.gz	NJNRMYVGQHORCX-IBGZPJMESA-N	0	3	336.435	3.224	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)CCC(C)(F)F	ZINC001700356031	1413857093	/nfs/dbraw/zinc/85/70/93/1413857093.db2.gz	FQAHVQOGEDYMBW-QGZVFWFLSA-N	0	3	349.425	3.416	20	30		EGEDHN
C[C@@H](CNC(=O)c1cc(C#N)c[nH]1)N(C)[C@@H](C)c1cccc(Cl)c1	ZINC001700454450	1414041916	/nfs/dbraw/zinc/04/19/16/1414041916.db2.gz	HBHCTZAEYRDZRX-STQMWFEESA-N	0	3	344.846	3.351	20	30		EGEDHN
Cc1coc(C(=O)N[C@@H](CNCc2ccc(C#N)s2)C(C)(C)C)c1	ZINC001700996373	1414644623	/nfs/dbraw/zinc/64/46/23/1414644623.db2.gz	XRCFQNWPHVEFMX-INIZCTEOSA-N	0	3	345.468	3.456	20	30		EGEDHN
Cc1cccc(Cl)c1C(=O)N[C@@H](C)CNCc1ccc(C#N)s1	ZINC001733011651	1429131510	/nfs/dbraw/zinc/13/15/10/1429131510.db2.gz	IXJMTZNNNLWTQS-LBPRGKRZSA-N	0	3	347.871	3.490	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H](CNC(=O)CCC3CC3)C2)cc1	ZINC001713213110	1417785951	/nfs/dbraw/zinc/78/59/51/1417785951.db2.gz	FEZOKUBHIHJYRU-IBGZPJMESA-N	0	3	325.456	3.077	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)[C@@H](CC)SC)CC1	ZINC001714297593	1419076574	/nfs/dbraw/zinc/07/65/74/1419076574.db2.gz	KYFWURNXHKTNOZ-JHJVBQTASA-N	0	3	349.338	3.054	20	30		EGEDHN
Cc1cc(C(=O)N(C)[C@H](C)CNCc2ccc(C#N)s2)oc1C	ZINC001714595907	1419347936	/nfs/dbraw/zinc/34/79/36/1419347936.db2.gz	YOSAZANILZNTSZ-GFCCVEGCSA-N	0	3	331.441	3.080	20	30		EGEDHN
CCCC(C)(C)C(=O)N(C)[C@H](C)CNCc1ccc(F)c(C#N)c1	ZINC001714741615	1419489880	/nfs/dbraw/zinc/48/98/80/1419489880.db2.gz	BGJPIORFDCNFSY-CQSZACIVSA-N	0	3	333.451	3.460	20	30		EGEDHN
CC(C)CC(=O)N[C@@](C)(CNCc1cc(C#N)ccc1F)C1CC1	ZINC001715101727	1419842107	/nfs/dbraw/zinc/84/21/07/1419842107.db2.gz	AUKGZJGIWFKASN-IBGZPJMESA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2snnc2C(C)C)CCCC1	ZINC001715307143	1420015791	/nfs/dbraw/zinc/01/57/91/1420015791.db2.gz	KETCSKYYNLBOSY-UHFFFAOYSA-N	0	3	342.896	3.046	20	30		EGEDHN
CC(C)c1ccc(C(=O)NCC2(NCc3cccc(C#N)c3)CC2)cn1	ZINC001733249045	1429396213	/nfs/dbraw/zinc/39/62/13/1429396213.db2.gz	IHOFMYSVRCIQOP-UHFFFAOYSA-N	0	3	348.450	3.129	20	30		EGEDHN
CC(C)SCC(=O)N[C@@H]1CCC[C@H]1CNCc1ccccc1C#N	ZINC001715546441	1420243339	/nfs/dbraw/zinc/24/33/39/1420243339.db2.gz	IEOZZBPMOOQKPZ-ZWKOTPCHSA-N	0	3	345.512	3.074	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1nsc2ccccc21)C(C)C	ZINC001715554399	1420249229	/nfs/dbraw/zinc/24/92/29/1420249229.db2.gz	CDHBBFMWQRGGQU-ZDUSSCGKSA-N	0	3	337.876	3.393	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H](C)CNCc2ccc(C#N)s2)c(C)c1	ZINC001716003704	1420457671	/nfs/dbraw/zinc/45/76/71/1420457671.db2.gz	NMRSQUMPKDDTIZ-AWEZNQCLSA-N	0	3	327.453	3.145	20	30		EGEDHN
Cc1csc(C(=O)NCC2(NCc3ccc(C#N)s3)CCC2)c1	ZINC001717150678	1421141591	/nfs/dbraw/zinc/14/15/91/1421141591.db2.gz	KAMJEAZZIHBSJJ-UHFFFAOYSA-N	0	3	345.493	3.432	20	30		EGEDHN
CN(CCCN(C)C(=O)C1(C)CCC1)Cc1ccc(F)c(C#N)c1	ZINC001717210277	1421183055	/nfs/dbraw/zinc/18/30/55/1421183055.db2.gz	DMOSEUPVVQCIMX-UHFFFAOYSA-N	0	3	331.435	3.168	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)c2ncoc2CC)CC1	ZINC001717354770	1421289641	/nfs/dbraw/zinc/28/96/41/1421289641.db2.gz	MOYPDPTTYZMOIG-UHFFFAOYSA-N	0	3	339.867	3.164	20	30		EGEDHN
C[C@@H](C#N)C(=O)N(C)CC(C)(C)CN[C@@H](C)c1c(F)cccc1F	ZINC001717450985	1421380884	/nfs/dbraw/zinc/38/08/84/1421380884.db2.gz	FTXOGRZIKDNZPH-STQMWFEESA-N	0	3	337.414	3.260	20	30		EGEDHN
C[C@H](CNC(=O)[C@@H]1CC[C@@H](C)CC1)N(C)Cc1cccc(C#N)c1	ZINC001717496020	1421436936	/nfs/dbraw/zinc/43/69/36/1421436936.db2.gz	ZVOIHRAUSOLBRJ-GPMSIDNRSA-N	0	3	327.472	3.321	20	30		EGEDHN
C[C@@H](CN(C)Cc1cccc(C#N)c1)NC(=O)c1ccc(F)cc1F	ZINC001722915394	1424250526	/nfs/dbraw/zinc/25/05/26/1424250526.db2.gz	XFMLZRNNNJFXSP-ZDUSSCGKSA-N	0	3	343.377	3.087	20	30		EGEDHN
CC(C)(C(=O)NCC1(NCc2cccc(C#N)c2)CC1)c1ccccc1	ZINC001723589843	1424479320	/nfs/dbraw/zinc/47/93/20/1424479320.db2.gz	PKAILUKJQOEHHL-UHFFFAOYSA-N	0	3	347.462	3.274	20	30		EGEDHN
CCCC1(C(=O)N2CC[C@@H]([C@@H](C)NCc3ccccc3C#N)C2)CC1	ZINC001733539861	1429745801	/nfs/dbraw/zinc/74/58/01/1429745801.db2.gz	RZHUMGZSPWEOCG-VQIMIIECSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@]1(CNCc2ccccc2C#N)CCN(C(=O)c2cccs2)C1	ZINC001724194138	1424725174	/nfs/dbraw/zinc/72/51/74/1424725174.db2.gz	FLJGLPIRFQTJGT-LJQANCHMSA-N	0	3	339.464	3.262	20	30		EGEDHN
CN(CCCN(C)C(=O)c1ccccc1)Cc1ccc(F)c(C#N)c1	ZINC001724839036	1425187156	/nfs/dbraw/zinc/18/71/56/1425187156.db2.gz	ITLCGWMULMMATQ-UHFFFAOYSA-N	0	3	339.414	3.291	20	30		EGEDHN
Cc1sccc1CC(=O)NC[C@@H](C)N(C)Cc1cccc(C#N)c1	ZINC001725190038	1425733355	/nfs/dbraw/zinc/73/33/55/1425733355.db2.gz	MEXQRHXCRNRVDO-CQSZACIVSA-N	0	3	341.480	3.107	20	30		EGEDHN
C[C@H](C#N)C(=O)N(C)C1CCN([C@@H]2CCc3c2cccc3Cl)CC1	ZINC001731346921	1427284520	/nfs/dbraw/zinc/28/45/20/1427284520.db2.gz	SWKILUZXTLCYAG-FZKQIMNGSA-N	0	3	345.874	3.410	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1cc2c(s1)CCCC2	ZINC001731738727	1427823953	/nfs/dbraw/zinc/82/39/53/1427823953.db2.gz	JQRYSWNOEZRAHA-GFCCVEGCSA-N	0	3	326.893	3.477	20	30		EGEDHN
CCc1ccccc1C(=O)NCCN(CC)Cc1cccc(C#N)c1	ZINC001731809436	1427988242	/nfs/dbraw/zinc/98/82/42/1427988242.db2.gz	HROMDOMJDJCXDW-UHFFFAOYSA-N	0	3	335.451	3.373	20	30		EGEDHN
CCN(CCNC(=O)[C@H](C)c1ccsc1)Cc1cccc(C#N)c1	ZINC001731812093	1427995672	/nfs/dbraw/zinc/99/56/72/1427995672.db2.gz	VUAPINQZYKPFHI-OAHLLOKOSA-N	0	3	341.480	3.362	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)CCC3CCC3)CCC2)s1	ZINC001733714744	1429932976	/nfs/dbraw/zinc/93/29/76/1429932976.db2.gz	SSWYJALUGVFEFK-UHFFFAOYSA-N	0	3	331.485	3.329	20	30		EGEDHN
CCC1(C(=O)N(C)CCCN(C)Cc2ccc(OC)c(C#N)c2)CC1	ZINC001733776690	1430023922	/nfs/dbraw/zinc/02/39/22/1430023922.db2.gz	SLDDEIHZEIUHAZ-UHFFFAOYSA-N	0	3	343.471	3.037	20	30		EGEDHN
C=C(Br)CNCC(C)(C)CN(C)C(=O)[C@@H]1C[C@H]1C1CC1	ZINC001734023923	1437812311	/nfs/dbraw/zinc/81/23/11/1437812311.db2.gz	JDNLWVDTNMDPTH-UONOGXRCSA-N	0	3	343.309	3.015	20	30		EGEDHN
C[C@@H](CNC(=O)C1CCCCCC1)N(C)Cc1cccc(C#N)c1	ZINC001734032844	1437820603	/nfs/dbraw/zinc/82/06/03/1437820603.db2.gz	UOYGPGZJPFFVIL-INIZCTEOSA-N	0	3	327.472	3.465	20	30		EGEDHN
C[C@@H](CNC(=O)C(C)(C)c1ccccc1)N(C)Cc1cccc(C#N)c1	ZINC001734061785	1437855675	/nfs/dbraw/zinc/85/56/75/1437855675.db2.gz	AXZGHOQOTBDAKR-KRWDZBQOSA-N	0	3	349.478	3.473	20	30		EGEDHN
CC(C)(C)CC(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1	ZINC001750974714	1440120363	/nfs/dbraw/zinc/12/03/63/1440120363.db2.gz	ZDPIZJXLIMMAGB-UHFFFAOYSA-N	0	3	331.435	3.118	20	30		EGEDHN
COc1ccc(C(C)C)cc1CN(C)CCCNC(=O)C#CC(C)C	ZINC001751972796	1440129554	/nfs/dbraw/zinc/12/95/54/1440129554.db2.gz	ZCSGVCVPSDEOKV-UHFFFAOYSA-N	0	3	344.499	3.416	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCCC[C@H]1[C@H](C)NCc1cn(C)nc1C	ZINC001752146576	1440146086	/nfs/dbraw/zinc/14/60/86/1440146086.db2.gz	NDMLZSLUPAUFEC-WMZOPIPTSA-N	0	3	346.519	3.190	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCCN(CC)CC#Cc1ccccc1	ZINC001752210786	1440155235	/nfs/dbraw/zinc/15/52/35/1440155235.db2.gz	ZGSUTSJHNDYLCP-OAQYLSRUSA-N	0	3	326.484	3.469	20	30		EGEDHN
C=CC(C)(C)C(=O)N(C)C1CCN(CCOCc2ccccc2)CC1	ZINC001752304207	1440168371	/nfs/dbraw/zinc/16/83/71/1440168371.db2.gz	LEYLEAOODLEAQM-UHFFFAOYSA-N	0	3	344.499	3.338	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@@H]1CC12CCN(Cc1cccc(F)c1)CC2	ZINC001752419376	1440175375	/nfs/dbraw/zinc/17/53/75/1440175375.db2.gz	GPRIAFFHJBWJMO-GOSISDBHSA-N	0	3	342.458	3.346	20	30		EGEDHN
Cc1coc(C)c1C(=O)NC[C@@H](NCc1ccc(C#N)s1)C1CC1	ZINC001752460668	1440183701	/nfs/dbraw/zinc/18/37/01/1440183701.db2.gz	VQHRRKZOFGQOIQ-MRXNPFEDSA-N	0	3	343.452	3.128	20	30		EGEDHN
CC1(C(=O)NC[C@H](NCC#Cc2ccccc2)C2CC2)CCCCC1	ZINC001752482176	1440185798	/nfs/dbraw/zinc/18/57/98/1440185798.db2.gz	LMAWKMNWBVDNMY-FQEVSTJZSA-N	0	3	338.495	3.493	20	30		EGEDHN
C=CCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H]1OCc2ccccc21	ZINC001752544917	1440194912	/nfs/dbraw/zinc/19/49/12/1440194912.db2.gz	IGLDJTWFLFCKBO-NSHGMRRFSA-N	0	3	340.467	3.289	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](OC)C1CCCC1	ZINC001752544559	1440194924	/nfs/dbraw/zinc/19/49/24/1440194924.db2.gz	BXLYOEHLSBUFRA-KANFNMMFSA-N	0	3	334.504	3.222	20	30		EGEDHN
CCCC[C@@](C)(F)C(=O)N[C@H]1C[C@H](NCC#Cc2ccccc2)C1	ZINC001752639257	1440197502	/nfs/dbraw/zinc/19/75/02/1440197502.db2.gz	JIJXIBGBTRZAKB-QWFCFKBJSA-N	0	3	330.447	3.193	20	30		EGEDHN
CC(C)C[C@H](C)CC(=O)N[C@H]1C[C@H](NCC#Cc2ccccc2)C1	ZINC001752682531	1440199723	/nfs/dbraw/zinc/19/97/23/1440199723.db2.gz	RHPKXNLMGLYLHG-IHPCNDPISA-N	0	3	326.484	3.347	20	30		EGEDHN
O=C(N[C@H]1C[C@@H](NCC#Cc2ccc(Cl)cc2)C1)[C@]12C[C@H]1CCC2	ZINC001752746658	1440204835	/nfs/dbraw/zinc/20/48/35/1440204835.db2.gz	VATGILIREWJVBS-PHXBYCTMSA-N	0	3	342.870	3.119	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1C[C@@H](NCc2cc(OC)ccc2Cl)C1	ZINC001752751892	1440204929	/nfs/dbraw/zinc/20/49/29/1440204929.db2.gz	RRXAPHGZDFOYTL-IYBDPMFKSA-N	0	3	348.874	3.279	20	30		EGEDHN
CC[C@@H](SC)C(=O)NC[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001752780212	1440208553	/nfs/dbraw/zinc/20/85/53/1440208553.db2.gz	UPHVIZICMMOODL-QZTJIDSGSA-N	0	3	345.512	3.028	20	30		EGEDHN
C#CCCCCC(=O)NC[C@H]1CCCN(Cc2c(C)noc2CC)C1	ZINC001752781264	1440208963	/nfs/dbraw/zinc/20/89/63/1440208963.db2.gz	OHACTTUMLAUFLB-QGZVFWFLSA-N	0	3	345.487	3.067	20	30		EGEDHN
C=CCOCCN1CCCC[C@@H]1CNC(=O)C1[C@@H]2CCCCCC[C@@H]12	ZINC001752822250	1440221173	/nfs/dbraw/zinc/22/11/73/1440221173.db2.gz	CTHNNLRNAQHEIE-GUDVDZBRSA-N	0	3	348.531	3.376	20	30		EGEDHN
C[C@H](NC(=O)CC1CCC1)[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001752838357	1440228887	/nfs/dbraw/zinc/22/88/87/1440228887.db2.gz	QRXHQBJKOYODPK-JXFKEZNVSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H](C)[C@@H]1CCCN(Cc2ccc(F)cc2)C1	ZINC001752841448	1440230582	/nfs/dbraw/zinc/23/05/82/1440230582.db2.gz	QSXRDCHXXSVQSZ-FUHWJXTLSA-N	0	3	348.462	3.135	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)CCc2ccc(C)s2)C1	ZINC001752841968	1440231240	/nfs/dbraw/zinc/23/12/40/1440231240.db2.gz	VWLOKCCSUAXLSS-IAGOWNOFSA-N	0	3	332.513	3.229	20	30		EGEDHN
C=C(C)CCC(=O)NC1CCC(NCC(=C)Br)CC1	ZINC001752850257	1440233447	/nfs/dbraw/zinc/23/34/47/1440233447.db2.gz	PTPUQYOBABRLTC-UHFFFAOYSA-N	0	3	329.282	3.268	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H](C)NCc2ccccc2OC2CC2)cc1	ZINC001752893101	1440241212	/nfs/dbraw/zinc/24/12/12/1440241212.db2.gz	ASHFDFORTRJQFW-INIZCTEOSA-N	0	3	348.446	3.117	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](CNCc2csc(C3CC3)n2)C1	ZINC001752935905	1440250424	/nfs/dbraw/zinc/25/04/24/1440250424.db2.gz	VPRIZINZEIRSIU-HNNXBMFYSA-N	0	3	345.512	3.152	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@@H](CNCc2ccn(C(C)C)n2)C1	ZINC001752949861	1440251993	/nfs/dbraw/zinc/25/19/93/1440251993.db2.gz	OZQQTNXALKFBAM-IRXDYDNUSA-N	0	3	332.492	3.004	20	30		EGEDHN
CN(Cc1cccc(F)c1)[C@@H]1CCCN(C(=O)C#CC(C)(C)C)C1	ZINC001752991434	1440259655	/nfs/dbraw/zinc/25/96/55/1440259655.db2.gz	RPFMGYBIHMFDGV-GOSISDBHSA-N	0	3	330.447	3.298	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)CCC(C)(F)F)C1	ZINC001752993723	1440260944	/nfs/dbraw/zinc/26/09/44/1440260944.db2.gz	MIYZFMZCBBIKJI-QGZVFWFLSA-N	0	3	349.425	3.416	20	30		EGEDHN
C#CCCCC(=O)NCC[C@@H](C)NCc1nc2cc(C)ccc2s1	ZINC001753005207	1440265659	/nfs/dbraw/zinc/26/56/59/1440265659.db2.gz	YGVDTEVUQSIMQW-OAHLLOKOSA-N	0	3	343.496	3.393	20	30		EGEDHN
CC(C)C(C)(C)C(=O)NCC[C@@H](C)NCc1cc(C#N)ccc1F	ZINC001753007021	1440266071	/nfs/dbraw/zinc/26/60/71/1440266071.db2.gz	XVOMGTHMBNIOCY-CQSZACIVSA-N	0	3	333.451	3.364	20	30		EGEDHN
C[C@H](CCNC(=O)c1ccc(F)s1)NCc1ccccc1C#N	ZINC001753018431	1440269150	/nfs/dbraw/zinc/26/91/50/1440269150.db2.gz	KDLIAFYCBGJICK-GFCCVEGCSA-N	0	3	331.416	3.057	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)NCCN(CC)Cc1cc2ccccc2s1	ZINC001753080904	1440293777	/nfs/dbraw/zinc/29/37/77/1440293777.db2.gz	MOJYYFNFSVLEQH-IBGZPJMESA-N	0	3	346.496	3.167	20	30		EGEDHN
C=CCN(CC)CCNC(=O)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC001753081899	1440294184	/nfs/dbraw/zinc/29/41/84/1440294184.db2.gz	ASYJHGRBPXBQFK-WUCCLRPBSA-N	0	3	332.410	3.225	20	30		EGEDHN
C=C1CCC(C(=O)NCCN(CC)Cc2ccc3c(c2)COC3)CC1	ZINC001753086798	1440296749	/nfs/dbraw/zinc/29/67/49/1440296749.db2.gz	HMBJPXYFHUNKMT-UHFFFAOYSA-N	0	3	342.483	3.401	20	30		EGEDHN
Cc1ccc(C(=O)N(C)CCNCc2ccc(C#N)s2)c(Cl)c1	ZINC001753234140	1440341327	/nfs/dbraw/zinc/34/13/27/1440341327.db2.gz	OCACTYOARHVVRP-UHFFFAOYSA-N	0	3	347.871	3.443	20	30		EGEDHN
C#CCCN[C@@H](CNC(=O)C1=COCCC1)c1ccc(C(C)C)cc1	ZINC001753294842	1440351913	/nfs/dbraw/zinc/35/19/13/1440351913.db2.gz	WLRUTAFVSPXTPV-FQEVSTJZSA-N	0	3	340.467	3.275	20	30		EGEDHN
C#CCCN[C@H](CNC(=O)CCc1cccc(C)c1)c1ccccc1	ZINC001753299502	1440353623	/nfs/dbraw/zinc/35/36/23/1440353623.db2.gz	CSVSVLTTWBMBRV-OAQYLSRUSA-N	0	3	334.463	3.398	20	30		EGEDHN
C#CCCN[C@@H](CNC(=O)C[C@@H]1CCC(C)(C)CO1)c1ccccc1	ZINC001753300572	1440353844	/nfs/dbraw/zinc/35/38/44/1440353844.db2.gz	WJXJBEJTQZTDDB-OALUTQOASA-N	0	3	342.483	3.052	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@H]2CC[C@@H](C1)N2C[C@@H](OC)C1CCCC1	ZINC001753306628	1440355487	/nfs/dbraw/zinc/35/54/87/1440355487.db2.gz	DIQXLBBXYNVEFK-CEXWTWQISA-N	0	3	334.504	3.223	20	30		EGEDHN
C=CCCN1CC[C@@H](N(CCC)C(=O)c2cc(C(F)(F)F)no2)C1	ZINC001753317846	1440360922	/nfs/dbraw/zinc/36/09/22/1440360922.db2.gz	XDICFKBINHHWFJ-GFCCVEGCSA-N	0	3	345.365	3.196	20	30		EGEDHN
C#CCCN1CC[C@H](N(CCC)C(=O)c2cc(CC(C)C)c[nH]2)C1	ZINC001753320143	1440362640	/nfs/dbraw/zinc/36/26/40/1440362640.db2.gz	UMZLWHFGINHKOR-SFHVURJKSA-N	0	3	329.488	3.163	20	30		EGEDHN
C#CCCN1CC[C@H](N(CCC)C(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)C1	ZINC001753324219	1440365648	/nfs/dbraw/zinc/36/56/48/1440365648.db2.gz	ZTNPJQKCKAAPID-SLFFLAALSA-N	0	3	342.458	3.265	20	30		EGEDHN
CC(C(=O)NCC[C@@H]1CCN(CC#Cc2ccccc2)C1)=C1CCC1	ZINC001753328749	1440367939	/nfs/dbraw/zinc/36/79/39/1440367939.db2.gz	ZKXUXLAQJRKAKN-HXUWFJFHSA-N	0	3	336.479	3.367	20	30		EGEDHN
C=CC(C)(C)C(=O)NCC1CN(CCCOc2ccc(C)c(C)c2)C1	ZINC001753407281	1440392221	/nfs/dbraw/zinc/39/22/21/1440392221.db2.gz	CLEKCSSPSYXNSV-UHFFFAOYSA-N	0	3	344.499	3.333	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H]2C[C@H]1CN2[C@@H](CCOC)c1ccccc1	ZINC001753421441	1440395292	/nfs/dbraw/zinc/39/52/92/1440395292.db2.gz	JYSACJMHELOLJI-UFYCRDLUSA-N	0	3	342.483	3.406	20	30		EGEDHN
CC#CCCCC(=O)N1C[C@@H]2C[C@H]1CN2CC1CCC(F)(F)CC1	ZINC001753422609	1440395753	/nfs/dbraw/zinc/39/57/53/1440395753.db2.gz	DACXPEVMZXKXHJ-IRXDYDNUSA-N	0	3	338.442	3.291	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N(C)[C@H]1CCN(CCc2ccc(OC)cc2)C1	ZINC001753443469	1440402529	/nfs/dbraw/zinc/40/25/29/1440402529.db2.gz	WMVYNNWDNIPOPH-SFHVURJKSA-N	0	3	344.499	3.373	20	30		EGEDHN
CC[C@@H](CNC(=O)c1cccnc1C1CC1)NCC#Cc1ccccc1	ZINC001753477528	1440415678	/nfs/dbraw/zinc/41/56/78/1440415678.db2.gz	NYZINSKVGKQEAM-IBGZPJMESA-N	0	3	347.462	3.109	20	30		EGEDHN
C[C@@H](C(=O)NC1(CNCC#Cc2ccccc2)CCCC1)n1cccc1	ZINC001753502486	1440423692	/nfs/dbraw/zinc/42/36/92/1440423692.db2.gz	QFGCBTVQGWANJF-IBGZPJMESA-N	0	3	349.478	3.119	20	30		EGEDHN
C[C@H]1CCCC[C@]1(CNCC#Cc1ccccc1)NC(=O)c1cc[nH]c1	ZINC001753532604	1440431487	/nfs/dbraw/zinc/43/14/87/1440431487.db2.gz	TWRIGKPAOMISHN-PGRDOPGGSA-N	0	3	349.478	3.335	20	30		EGEDHN
Cc1cccnc1CNC[C@]1(NC(=O)C#CC(C)C)CCCC[C@H]1C	ZINC001753532993	1440431711	/nfs/dbraw/zinc/43/17/11/1440431711.db2.gz	VXFXSHXZUDWRIS-WIYYLYMNSA-N	0	3	341.499	3.204	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)Cc2cccnc2C)CCCC[C@@H]1C	ZINC001753535879	1440432485	/nfs/dbraw/zinc/43/24/85/1440432485.db2.gz	NAPYVDIZMUKYRN-IFXJQAMLSA-N	0	3	349.906	3.340	20	30		EGEDHN
C#CCNCc1ccc(CNC(=O)[C@@H](CC)Cc2ccccc2)cc1	ZINC001753590553	1440442781	/nfs/dbraw/zinc/44/27/81/1440442781.db2.gz	KAFPHRHEYBEUFM-NRFANRHFSA-N	0	3	334.463	3.295	20	30		EGEDHN
Cc1cc(CN2CCC(CCNC(=O)C#CC(C)(C)C)CC2)sn1	ZINC001753594404	1440444053	/nfs/dbraw/zinc/44/40/53/1440444053.db2.gz	BMEHBDXKXHDDQI-UHFFFAOYSA-N	0	3	347.528	3.219	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)[C@@H](C)c1ccsc1	ZINC001753630862	1440452279	/nfs/dbraw/zinc/45/22/79/1440452279.db2.gz	PUVGPSREBLIYBH-CABCVRRESA-N	0	3	341.480	3.265	20	30		EGEDHN
C[C@H](CNCC#Cc1ccc(F)cc1)N(C)C(=O)C1CC(C)(C)C1	ZINC001753690141	1440466413	/nfs/dbraw/zinc/46/64/13/1440466413.db2.gz	QDXUQIOTDFCZEE-OAHLLOKOSA-N	0	3	330.447	3.050	20	30		EGEDHN
C=CC[C@H](C(=O)N(C)[C@@H](C)CNCc1ccccn1)c1ccccc1	ZINC001753729183	1440475151	/nfs/dbraw/zinc/47/51/51/1440475151.db2.gz	HWNKNPSSHXMFEA-PXNSSMCTSA-N	0	3	337.467	3.378	20	30		EGEDHN
COCC#CCNC[C@H](CC(C)C)NC(=O)C1(C)CCCCCC1	ZINC001753736140	1440477809	/nfs/dbraw/zinc/47/78/09/1440477809.db2.gz	IOQZZGPYJTUURO-SFHVURJKSA-N	0	3	336.520	3.117	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCCCN1C(=O)Cc1ccccc1F	ZINC001753788159	1440488624	/nfs/dbraw/zinc/48/86/24/1440488624.db2.gz	NZIJKYVHYPLOSO-MRXNPFEDSA-N	0	3	338.854	3.482	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1ccnc(-c2ccco2)c1)C(C)C	ZINC001753832342	1440500043	/nfs/dbraw/zinc/50/00/43/1440500043.db2.gz	LYJSNHHYFJDXJO-INIZCTEOSA-N	0	3	347.846	3.438	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H]2[C@@H](CCN2Cc2cc(C)ns2)C1	ZINC001753872848	1440517983	/nfs/dbraw/zinc/51/79/83/1440517983.db2.gz	PAQLXDATZKEYPK-RDJZCZTQSA-N	0	3	347.528	3.477	20	30		EGEDHN
C=CC1(CC(=O)N[C@@H](C)CCNCc2cc(C)ncn2)CCCCC1	ZINC001754014139	1440531454	/nfs/dbraw/zinc/53/14/54/1440531454.db2.gz	ADZLPXGGRSDCEF-INIZCTEOSA-N	0	3	344.503	3.296	20	30		EGEDHN
C=C[C@H](C(=O)N[C@H](C)CCNCc1ncc(C)s1)c1ccccc1	ZINC001754024337	1440532904	/nfs/dbraw/zinc/53/29/04/1440532904.db2.gz	OQFZGLYJCVXNMO-PBHICJAKSA-N	0	3	343.496	3.406	20	30		EGEDHN
CCN(CCNCc1ccc(OC)c(C#N)c1)C(=O)/C=C/C(C)(C)C	ZINC001754038209	1440534314	/nfs/dbraw/zinc/53/43/14/1440534314.db2.gz	BMTXPBLLIPJXKO-MDZDMXLPSA-N	0	3	343.471	3.107	20	30		EGEDHN
CCN(CCNC1c2ccccc2-c2ccccc21)C(=O)[C@H](C)C#N	ZINC001754039476	1440534498	/nfs/dbraw/zinc/53/44/98/1440534498.db2.gz	VUMNVIORUATROE-OAHLLOKOSA-N	0	3	333.435	3.354	20	30		EGEDHN
CCOc1cccc(C(=O)NC/C=C/CNCc2ccc(C#N)cc2)c1	ZINC001754175935	1440547581	/nfs/dbraw/zinc/54/75/81/1440547581.db2.gz	VNDMNBBWTDVVAV-ONEGZZNKSA-N	0	3	349.434	3.033	20	30		EGEDHN
C[C@H](CNCC#Cc1ccc(F)cc1)NC(=O)C1(C)CCCCC1	ZINC001754241417	1440555865	/nfs/dbraw/zinc/55/58/65/1440555865.db2.gz	JCBSAQBECVKFJS-MRXNPFEDSA-N	0	3	330.447	3.242	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H](C)CN[C@H](C)C(=O)Nc1ccccc1C	ZINC001754242748	1440556055	/nfs/dbraw/zinc/55/60/55/1440556055.db2.gz	QQZHJCXAMQTUTA-HZPDHXFCSA-N	0	3	345.487	3.019	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H](C)CNCc2ccc(F)c(C#N)c2)ccc1F	ZINC001754281165	1440563241	/nfs/dbraw/zinc/56/32/41/1440563241.db2.gz	ZKUPPGOXMOWAEU-ZDUSSCGKSA-N	0	3	343.377	3.053	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)NC(=O)[C@H]1C[C@@H]1c1ccccc1	ZINC001754286774	1440564384	/nfs/dbraw/zinc/56/43/84/1440564384.db2.gz	YIWUTVUOSVRUDQ-VHSSKADRSA-N	0	3	339.464	3.018	20	30		EGEDHN
CC[C@H](CC(=O)N[C@@H](C)CNCc1ccc(F)c(C#N)c1)C(C)C	ZINC001754292471	1440565597	/nfs/dbraw/zinc/56/55/97/1440565597.db2.gz	YSNYYNOKVWJYRM-GOEBONIOSA-N	0	3	333.451	3.364	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H](C)CN(C)Cc1cc2ccccc2s1	ZINC001754311641	1440573409	/nfs/dbraw/zinc/57/34/09/1440573409.db2.gz	QQRDUNILLCPJNX-OAHLLOKOSA-N	0	3	328.481	3.497	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1CCCC[C@@H]1CNCc1ocnc1C	ZINC001754344479	1440589472	/nfs/dbraw/zinc/58/94/72/1440589472.db2.gz	DRSQNEYJUNDAFN-CVEARBPZSA-N	0	3	333.476	3.350	20	30		EGEDHN
CN(CCCNCc1ccc(C#N)cc1F)C(=O)C12CCC(CC1)C2	ZINC001754379291	1440593186	/nfs/dbraw/zinc/59/31/86/1440593186.db2.gz	PJEWRBIZDCTOJP-UHFFFAOYSA-N	0	3	343.446	3.216	20	30		EGEDHN
CN(CCCNCc1ccc(C#N)cc1F)C(=O)C[C@@H]1CC[C@H]2C[C@H]21	ZINC001754381076	1440593458	/nfs/dbraw/zinc/59/34/58/1440593458.db2.gz	NOZRTBASXBSTMF-XYJFISCASA-N	0	3	343.446	3.072	20	30		EGEDHN
C=Cc1ccc(C(=O)N(C)CCCNCc2ccccc2C#N)cc1	ZINC001754397595	1440594806	/nfs/dbraw/zinc/59/48/06/1440594806.db2.gz	NPLWXCFLBQMCGK-UHFFFAOYSA-N	0	3	333.435	3.453	20	30		EGEDHN
CC/C=C(/C)C(=O)N[C@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001754435176	1440597873	/nfs/dbraw/zinc/59/78/73/1440597873.db2.gz	XXYBTYPDLFXNFB-TUTQCMMDSA-N	0	3	329.419	3.038	20	30		EGEDHN
C=CCCCN1CC[C@H]1CNC(=O)c1cc(F)cc2ccncc21	ZINC001754482229	1440607915	/nfs/dbraw/zinc/60/79/15/1440607915.db2.gz	JVLOWQRWVNWIOP-INIZCTEOSA-N	0	3	327.403	3.144	20	30		EGEDHN
CC(C)=C(C)CC(=O)NCC1(NCc2ccc(C#N)c(F)c2)CC1	ZINC001754528853	1440621832	/nfs/dbraw/zinc/62/18/32/1440621832.db2.gz	TYZBOJXJIDAIMQ-UHFFFAOYSA-N	0	3	329.419	3.182	20	30		EGEDHN
CC[C@H](C)[C@H](C)C(=O)NCC1(NCc2ccc(F)c(C#N)c2)CC1	ZINC001754530623	1440622320	/nfs/dbraw/zinc/62/23/20/1440622320.db2.gz	YNRPDPZLNAMNAT-KBPBESRZSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)CCCc1csc(C)n1	ZINC001754543128	1440626460	/nfs/dbraw/zinc/62/64/60/1440626460.db2.gz	RPSVTFIRKBELAO-MSOLQXFVSA-N	0	3	347.528	3.416	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@@H](CC)CC(F)F)C2)CC1	ZINC001754560382	1440633431	/nfs/dbraw/zinc/63/34/31/1440633431.db2.gz	JOCPMHRYXUTDCG-HNNXBMFYSA-N	0	3	326.431	3.006	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@H](CC)CC(F)F)C2)CC1	ZINC001754560383	1440633575	/nfs/dbraw/zinc/63/35/75/1440633575.db2.gz	JOCPMHRYXUTDCG-OAHLLOKOSA-N	0	3	326.431	3.006	20	30		EGEDHN
C#CCCCC(=O)NC1(C)CCN(CCc2ccccc2F)CC1	ZINC001754625718	1440646326	/nfs/dbraw/zinc/64/63/26/1440646326.db2.gz	FGLJDOREBVRCSD-UHFFFAOYSA-N	0	3	330.447	3.142	20	30		EGEDHN
C#CCN(C(=O)C#CC1CC1)C1CCN(Cc2ccc(CC)cc2)CC1	ZINC001754637181	1440648786	/nfs/dbraw/zinc/64/87/86/1440648786.db2.gz	ATBBZCYIMSSLGL-UHFFFAOYSA-N	0	3	348.490	3.089	20	30		EGEDHN
C#CCN(C(=O)[C@@H]1C[C@@]1(C)C(C)C)C1CCN(CCOC(C)C)CC1	ZINC001754641481	1440649193	/nfs/dbraw/zinc/64/91/93/1440649193.db2.gz	CRUANZUVDCUDQU-FPOVZHCZSA-N	0	3	348.531	3.020	20	30		EGEDHN
C#CCNC[C@@H](NC(=O)CSCCC)c1ccc2ccccc2c1	ZINC001754644149	1440649669	/nfs/dbraw/zinc/64/96/69/1440649669.db2.gz	PBLVJGVBHMSJPW-LJQANCHMSA-N	0	3	340.492	3.363	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)[C@H](C)CCOc2ccccc2)C1	ZINC001754686052	1440665013	/nfs/dbraw/zinc/66/50/13/1440665013.db2.gz	XXDAFXFJDCSSCL-YLJYHZDGSA-N	0	3	330.472	3.248	20	30		EGEDHN
CCC1(C(=O)N2CC[C@@](C)(CNCc3ccccc3C#N)C2)CCC1	ZINC001754702345	1440668240	/nfs/dbraw/zinc/66/82/40/1440668240.db2.gz	AHPKWYMQIWPVJT-FQEVSTJZSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC1(C)CCN(Cc2ocnc2C)CC1	ZINC001754720149	1440672831	/nfs/dbraw/zinc/67/28/31/1440672831.db2.gz	JCEBXXAFFIVURD-IBGZPJMESA-N	0	3	333.476	3.304	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC1(C)CCN(Cc2cc(C)no2)CC1	ZINC001754720356	1440673010	/nfs/dbraw/zinc/67/30/10/1440673010.db2.gz	MTXPCETWXIVDPO-LJQANCHMSA-N	0	3	333.476	3.304	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC1(C)CCN(Cc2ocnc2C)CC1	ZINC001754721040	1440673175	/nfs/dbraw/zinc/67/31/75/1440673175.db2.gz	ZSFCKGXBYXWPCI-UHFFFAOYSA-N	0	3	333.476	3.304	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@]1(C)CCCN(Cc2cccnc2C)C1	ZINC001754725010	1440675485	/nfs/dbraw/zinc/67/54/85/1440675485.db2.gz	IXRKFGVEKLVWAM-OAQYLSRUSA-N	0	3	341.499	3.302	20	30		EGEDHN
Cc1ccc(F)cc1CN1CCC[C@@](C)(CNC(=O)C#CC2CC2)C1	ZINC001754726487	1440676492	/nfs/dbraw/zinc/67/64/92/1440676492.db2.gz	BDTBVJJVOCMDSO-NRFANRHFSA-N	0	3	342.458	3.266	20	30		EGEDHN
CC#CCN1CCC[C@](C)(CNC(=O)c2cc(CC(C)C)c[nH]2)C1	ZINC001754732452	1440680473	/nfs/dbraw/zinc/68/04/73/1440680473.db2.gz	UWXSHOVSXMBEII-HXUWFJFHSA-N	0	3	329.488	3.068	20	30		EGEDHN
C=CCCOCC(=O)NC[C@@]1(C)CCCN(Cc2ccsc2)C1	ZINC001754733337	1440681008	/nfs/dbraw/zinc/68/10/08/1440681008.db2.gz	BVPYYWZCPOVHJR-GOSISDBHSA-N	0	3	336.501	3.059	20	30		EGEDHN
C=CCN1CCC[C@@](C)(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2F)C1	ZINC001754735754	1440682267	/nfs/dbraw/zinc/68/22/67/1440682267.db2.gz	JQPWQUTTXCEMMD-QKLQHJQFSA-N	0	3	348.437	3.473	20	30		EGEDHN
C#CCNCCN(Cc1ccccc1)C(=O)c1ccc2cc[nH]c2c1	ZINC001754837837	1440697212	/nfs/dbraw/zinc/69/72/12/1440697212.db2.gz	TWOALHCEQKMBID-UHFFFAOYSA-N	0	3	331.419	3.033	20	30		EGEDHN
C#CCC1(C(=O)N2C[C@H]3CN(C/C=C\Cl)C[C@H]3C2)CCCCC1	ZINC001754848078	1440699727	/nfs/dbraw/zinc/69/97/27/1440699727.db2.gz	QJHMMJPFCFRYIO-RBHTYBDBSA-N	0	3	334.891	3.103	20	30		EGEDHN
C=CCCN1CCC[C@](CO)(NC(=O)c2cc(C(C)(C)C)oc2C)C1	ZINC001754858580	1440700621	/nfs/dbraw/zinc/70/06/21/1440700621.db2.gz	DNASKYPJKSSSFU-FQEVSTJZSA-N	0	3	348.487	3.018	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3cc(CCCCC)n[nH]3)[C@@H]2C1	ZINC001754873530	1440706083	/nfs/dbraw/zinc/70/60/83/1440706083.db2.gz	MPNLDFLPDVWZGX-QFBILLFUSA-N	0	3	344.503	3.255	20	30		EGEDHN
C=C1CC(C)(C(=O)NCc2ccccc2CN(C)C[C@@H](C)OC)C1	ZINC001754946747	1440713522	/nfs/dbraw/zinc/71/35/22/1440713522.db2.gz	VCMFHWMGZHEWQQ-MRXNPFEDSA-N	0	3	330.472	3.126	20	30		EGEDHN
COCC#CCN[C@@H](C)c1ccc(CNC(=O)[C@H](C)C(C)(C)C)cc1	ZINC001754947298	1440713749	/nfs/dbraw/zinc/71/37/49/1440713749.db2.gz	JEOGFPZPKDRCMD-IRXDYDNUSA-N	0	3	344.499	3.285	20	30		EGEDHN
C#CCN[C@H](C)c1ccc(CNC(=O)CC[C@H]2CC(C)(C)CO2)cc1	ZINC001754948352	1440714161	/nfs/dbraw/zinc/71/41/61/1440714161.db2.gz	HTKBLUOEXSGRDW-APWZRJJASA-N	0	3	342.483	3.182	20	30		EGEDHN
COCC#CCN[C@H](C)c1ccc(CNC(=O)C2CCCCC2)cc1	ZINC001754954813	1440716042	/nfs/dbraw/zinc/71/60/42/1440716042.db2.gz	SWMONSAMAOFFRD-QGZVFWFLSA-N	0	3	342.483	3.184	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC1(NCc2ccc(F)c(C#N)c2)CCC1	ZINC001754986557	1440722943	/nfs/dbraw/zinc/72/29/43/1440722943.db2.gz	KPLZAYFSUJSMCG-UHFFFAOYSA-N	0	3	343.446	3.428	20	30		EGEDHN
C=C(C)CCN1CCN([C@H]2CCN(C(=O)[C@@H](C)C(CC)CC)C2)CC1	ZINC001755019977	1440726411	/nfs/dbraw/zinc/72/64/11/1440726411.db2.gz	VTBCDEZDHYGNRD-ICSRJNTNSA-N	0	3	349.563	3.243	20	30		EGEDHN
C=C[C@H](C(=O)N(C)CCCN(C)Cc1cccnc1)c1ccccc1	ZINC001755046908	1440741517	/nfs/dbraw/zinc/74/15/17/1440741517.db2.gz	BTXCABDPUPVRGA-FQEVSTJZSA-N	0	3	337.467	3.332	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC(CC)(NCc3nocc3C)CC2)C1	ZINC001755072678	1440747141	/nfs/dbraw/zinc/74/71/41/1440747141.db2.gz	PJHCGRLSNUIUBU-UHFFFAOYSA-N	0	3	331.460	3.200	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC[C@@H]1Cc2ccccc2CN1CC(C)C	ZINC001755074436	1440748028	/nfs/dbraw/zinc/74/80/28/1440748028.db2.gz	ZBHFPUZAQYOVIS-PXNSSMCTSA-N	0	3	344.499	3.167	20	30		EGEDHN
C=C(C)CCN1Cc2ccccc2C[C@H]1CNC(=O)CC[C@@H](C)OC	ZINC001755075589	1440748493	/nfs/dbraw/zinc/74/84/93/1440748493.db2.gz	JRYNCTWNSUJAEH-XLIONFOSSA-N	0	3	344.499	3.311	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)CCCc1ccccc1)C2	ZINC001755079513	1440750567	/nfs/dbraw/zinc/75/05/67/1440750567.db2.gz	LOWSWJYFJNVTOB-JOCHJYFZSA-N	0	3	338.495	3.347	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)C(C)(C)COC)cc2C1	ZINC001755102549	1440753501	/nfs/dbraw/zinc/75/35/01/1440753501.db2.gz	XTIXBWARVKQQBB-UHFFFAOYSA-N	0	3	330.472	3.257	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)CC(C)(C)c2ccc(F)cc2)C[C@H]1C	ZINC001755162436	1440765187	/nfs/dbraw/zinc/76/51/87/1440765187.db2.gz	VBYITEKJNPILQK-QAPCUYQASA-N	0	3	330.447	3.096	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CCN(Cc2ncccc2C)[C@H](C)C1	ZINC001755166899	1440767553	/nfs/dbraw/zinc/76/75/53/1440767553.db2.gz	HOCABAYSPLDTCS-IAGOWNOFSA-N	0	3	329.488	3.461	20	30		EGEDHN
C=CCCCN1CCOC2(CCN(C(=O)[C@H]3CCC[C@H]3CC)CC2)C1	ZINC001755174037	1440770225	/nfs/dbraw/zinc/77/02/25/1440770225.db2.gz	HJYVQPKRMJQIRK-MOPGFXCFSA-N	0	3	348.531	3.472	20	30		EGEDHN
C#CCCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccn(C(C)C)c1C	ZINC001755187103	1440773488	/nfs/dbraw/zinc/77/34/88/1440773488.db2.gz	VPJCGEZVSHQEHK-NHCUHLMSSA-N	0	3	349.478	3.386	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](C2CCN(C(=O)C[C@H](C)OC)CC2)C1	ZINC001755205235	1440781973	/nfs/dbraw/zinc/78/19/73/1440781973.db2.gz	QUVRDOFCGHLSGN-RDJZCZTQSA-N	0	3	342.911	3.115	20	30		EGEDHN
CC(C)C(=O)N[C@@H](C)[C@@H](C)NCC#Cc1ccc(C(F)(F)F)cc1	ZINC001755226877	1440786212	/nfs/dbraw/zinc/78/62/12/1440786212.db2.gz	QRXPHOMXTTZZRY-KGLIPLIRSA-N	0	3	340.389	3.196	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](C)[C@H](C)NCC#Cc2cccc(Cl)c2)co1	ZINC001755235123	1440788063	/nfs/dbraw/zinc/78/80/63/1440788063.db2.gz	YMYZQHHLXUPDNN-LSDHHAIUSA-N	0	3	344.842	3.390	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](C)[C@H](C)NCc2cccc(Cl)n2)CC1	ZINC001755253804	1440792716	/nfs/dbraw/zinc/79/27/16/1440792716.db2.gz	WPZGLZLMJMUSNJ-KBPBESRZSA-N	0	3	335.879	3.464	20	30		EGEDHN
C[C@@H](NC(=O)C1(c2ccccc2)CC1)[C@H](C)NCC#Cc1ccccc1	ZINC001755269019	1440797125	/nfs/dbraw/zinc/79/71/25/1440797125.db2.gz	UJKNFPAVVTVKRA-RBUKOAKNSA-N	0	3	346.474	3.253	20	30		EGEDHN
C=CC(C)(C)CC(=O)N(C)C1CCC(NCc2ocnc2C)CC1	ZINC001755273863	1440798378	/nfs/dbraw/zinc/79/83/78/1440798378.db2.gz	GJXLLOURULRNBI-UHFFFAOYSA-N	0	3	333.476	3.445	20	30		EGEDHN
C#CCCCCCC(=O)N(C)C1CCC(NCc2conc2C)CC1	ZINC001755275465	1440798946	/nfs/dbraw/zinc/79/89/46/1440798946.db2.gz	XMJIISWWIAGLCZ-UHFFFAOYSA-N	0	3	345.487	3.426	20	30		EGEDHN
CN(CC(C)(C)CNCc1ccncc1Cl)C(=O)C#CC(C)(C)C	ZINC001755281144	1440800692	/nfs/dbraw/zinc/80/06/92/1440800692.db2.gz	ZLZGUPLDQGEOMX-UHFFFAOYSA-N	0	3	349.906	3.359	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)C[C@H]1CC(C)(C)CO1	ZINC001755283815	1440801458	/nfs/dbraw/zinc/80/14/58/1440801458.db2.gz	WSVIKPPMKLPGPR-AWEZNQCLSA-N	0	3	330.900	3.018	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)[C@@H]1Cc2ccc(F)cc21	ZINC001755284355	1440801551	/nfs/dbraw/zinc/80/15/51/1440801551.db2.gz	PFDBFOFZPLUALB-MRXNPFEDSA-N	0	3	338.854	3.292	20	30		EGEDHN
C[C@@H](CNC(=O)c1c[nH]cc1C1CC1)N(C)Cc1ccc(C#N)cc1	ZINC001755321893	1440819057	/nfs/dbraw/zinc/81/90/57/1440819057.db2.gz	WEMGIKAKDHWNOJ-AWEZNQCLSA-N	0	3	336.439	3.014	20	30		EGEDHN
CCCC[C@H](CNCC#Cc1ccccc1)NC(=O)Cc1ccoc1	ZINC001755358787	1440830848	/nfs/dbraw/zinc/83/08/48/1440830848.db2.gz	VRGPGSWNFHMYIL-HXUWFJFHSA-N	0	3	338.451	3.138	20	30		EGEDHN
C#CCN1CCCCC[C@@H]1CNC(=O)C[C@@H](C)c1ccc(F)cc1	ZINC001755367892	1440835616	/nfs/dbraw/zinc/83/56/16/1440835616.db2.gz	KOCSIQZRWFLWHI-VQIMIIECSA-N	0	3	330.447	3.313	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@]2(CCN(C(=O)c3sccc3C)C2)C1	ZINC001755399831	1440842862	/nfs/dbraw/zinc/84/28/62/1440842862.db2.gz	RLILLVVZXGSNPW-VQIMIIECSA-N	0	3	348.512	3.328	20	30		EGEDHN
CC#CCN1C[C@@H]2[C@@H](CNC(=O)C[C@@H](C)c3ccc(CC)cc3)[C@@H]2C1	ZINC001755432011	1440851310	/nfs/dbraw/zinc/85/13/10/1440851310.db2.gz	QHSQVDOWVZWTRJ-OTNPHJDUSA-N	0	3	338.495	3.060	20	30		EGEDHN
CCC[C@H](C)CC(=O)N[C@H]1C[C@H](CNCc2ccccc2C#N)C1	ZINC001755467240	1440858441	/nfs/dbraw/zinc/85/84/41/1440858441.db2.gz	QDYTUTCCBDJVMK-BXWFABGCSA-N	0	3	327.472	3.369	20	30		EGEDHN
C[C@H](CCCNCc1ccccc1C#N)NC(=O)[C@H]1CCC1(C)C	ZINC001755513875	1440863845	/nfs/dbraw/zinc/86/38/45/1440863845.db2.gz	XASQQQYIQRQAGO-CRAIPNDOSA-N	0	3	327.472	3.369	20	30		EGEDHN
C[C@H]1C[C@H]1C(=O)N1CCC(N(C)CC#Cc2ccccc2Cl)CC1	ZINC001755525599	1440865697	/nfs/dbraw/zinc/86/56/97/1440865697.db2.gz	KHEDJBQPDAGFNS-MAUKXSAKSA-N	0	3	344.886	3.270	20	30		EGEDHN
CC#CCCCC(=O)N1CCC(N(C)Cc2oc(CC)nc2C)CC1	ZINC001755532643	1440867901	/nfs/dbraw/zinc/86/79/01/1440867901.db2.gz	UYGHDTVGFXAZRM-UHFFFAOYSA-N	0	3	345.487	3.162	20	30		EGEDHN
C[C@@H](NC[C@@H](C1CC1)N(C)C(=O)C#CC1CC1)c1ccccc1F	ZINC001755572919	1440877526	/nfs/dbraw/zinc/87/75/26/1440877526.db2.gz	SENRYMRWQKGHIP-KUHUBIRLSA-N	0	3	328.431	3.127	20	30		EGEDHN
C=CC(C)(C)C(=O)N(C)C[C@@H](C)NCc1ccccc1OC1CC1	ZINC001755600810	1440884094	/nfs/dbraw/zinc/88/40/94/1440884094.db2.gz	STCDFQWGMWCADC-OAHLLOKOSA-N	0	3	330.472	3.377	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](NCc2cc(C)ccc2OC)[C@H]1C	ZINC001755657935	1440892321	/nfs/dbraw/zinc/89/23/21/1440892321.db2.gz	DKBZYPDYGXLHFQ-AEFFLSMTSA-N	0	3	330.472	3.439	20	30		EGEDHN
CC#CCN[C@H]1C[C@@H](C)N(C(=O)c2cc3c(o2)c(F)ccc3C)C1	ZINC001755685508	1440895769	/nfs/dbraw/zinc/89/57/69/1440895769.db2.gz	YMEIHILYSMVNHB-KGLIPLIRSA-N	0	3	328.387	3.096	20	30		EGEDHN
C[C@@H]1C[C@@H](NCC#Cc2ccccc2)CN1C(=O)[C@@H]1CC[C@@H](C)CC1	ZINC001755689110	1440896462	/nfs/dbraw/zinc/89/64/62/1440896462.db2.gz	MSEOVJKDMCAQMX-VURPSTOHSA-N	0	3	338.495	3.443	20	30		EGEDHN
C[C@H]1C[C@H](NCC#Cc2ccccc2)CN1C(=O)C1CCC=CCC1	ZINC001755692433	1440897013	/nfs/dbraw/zinc/89/70/13/1440897013.db2.gz	KYDWKLNOOBXQET-RXVVDRJESA-N	0	3	336.479	3.364	20	30		EGEDHN
C#CCN1CC[C@]2(NC(=O)C[C@H](C)c3ccc(CC)cc3)CCC[C@H]12	ZINC001755699929	1440899436	/nfs/dbraw/zinc/89/94/36/1440899436.db2.gz	DGEUFXYGYVCXLL-RBDMOPTHSA-N	0	3	338.495	3.489	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CCCN(Cc2ccc(CO)cc2)[C@H]1C	ZINC001755716933	1440905319	/nfs/dbraw/zinc/90/53/19/1440905319.db2.gz	CUUOMQVJHFUCRC-QFBILLFUSA-N	0	3	330.472	3.004	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@H](NCc2cnccc2C)C(C)(C)C1	ZINC001755759047	1440914609	/nfs/dbraw/zinc/91/46/09/1440914609.db2.gz	KAQHCUZTXXLOOW-IBGZPJMESA-N	0	3	341.499	3.485	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCN(CCOC)[C@@H](C)c2ccccc2C)C1	ZINC001755840600	1440931572	/nfs/dbraw/zinc/93/15/72/1440931572.db2.gz	DKLHQNDYTLOUQI-SFHVURJKSA-N	0	3	344.499	3.477	20	30		EGEDHN
C#CCN1CCC([C@H](C)NC(=O)[C@H](C)Cc2ccccc2C)CC1	ZINC001755851197	1440935005	/nfs/dbraw/zinc/93/50/05/1440935005.db2.gz	QWIVWUAQOHZFPV-MSOLQXFVSA-N	0	3	326.484	3.024	20	30		EGEDHN
C=CCNCc1ccc(CNC(=O)C2Cc3ccccc3C2)c(F)c1	ZINC001755902045	1440944253	/nfs/dbraw/zinc/94/42/53/1440944253.db2.gz	MICXUYIBKQYURQ-UHFFFAOYSA-N	0	3	338.426	3.133	20	30		EGEDHN
COc1ccc([C@@H](CNCc2ccc(C#N)o2)N2CCCCC2)cc1	ZINC000174241287	231157778	/nfs/dbraw/zinc/15/77/78/231157778.db2.gz	PDXAKKNNTACQQE-HXUWFJFHSA-N	0	3	339.439	3.477	20	30		EGEDHN
Cc1cc(C(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)ccc1F	ZINC000103380321	219294807	/nfs/dbraw/zinc/29/48/07/219294807.db2.gz	VSJXTQSHAGCRRH-UHFFFAOYSA-N	0	3	339.414	3.210	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)Nc1ccc(OCCN(C)C)c(Cl)c1	ZINC000078765514	217116521	/nfs/dbraw/zinc/11/65/21/217116521.db2.gz	GUCMMOVXOYZELY-CYBMUJFWSA-N	0	3	340.851	3.200	20	30		EGEDHN
C=CCOCCCC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000079552045	217241407	/nfs/dbraw/zinc/24/14/07/217241407.db2.gz	MORZGJVFZXGDAQ-IEBWSBKVSA-N	0	3	330.472	3.139	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)c2ccc(C#N)cc2)CCN1Cc1ccccc1	ZINC000079553071	217241662	/nfs/dbraw/zinc/24/16/62/217241662.db2.gz	NITNEYMCOGYBFK-OXJNMPFZSA-N	0	3	333.435	3.341	20	30		EGEDHN
C[C@H](NC(=O)N1CCC[C@@H]1CN1CCCCC1)c1ccc(C#N)cc1	ZINC000264280885	246285110	/nfs/dbraw/zinc/28/51/10/246285110.db2.gz	ROEVFXLLDHATJC-QFBILLFUSA-N	0	3	340.471	3.279	20	30		EGEDHN
Cc1nc([C@@H](C)NC2CCN(c3ccc(C#N)cn3)CC2)cs1	ZINC000378199238	169084502	/nfs/dbraw/zinc/08/45/02/169084502.db2.gz	ISCMTCLYBNBOQG-GFCCVEGCSA-N	0	3	327.457	3.038	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN2CCC(OCc3ccccc3)CC2)cc1	ZINC000268653432	252105183	/nfs/dbraw/zinc/10/51/83/252105183.db2.gz	WKJJMZLNODNCSW-OAQYLSRUSA-N	0	3	336.435	3.273	20	30		EGEDHN
CN(C[C@H](O)c1ccc(C#N)cc1)[C@@H]1CCCN(c2ccccc2)C1	ZINC000268703593	252154056	/nfs/dbraw/zinc/15/40/56/252154056.db2.gz	RUDLJXFATAQPJP-RTWAWAEBSA-N	0	3	335.451	3.192	20	30		EGEDHN
C[C@H](N[C@@H]1CCCN(C(=O)Cc2ccccc2)C1)c1cccc(C#N)c1	ZINC000338014250	141073751	/nfs/dbraw/zinc/07/37/51/141073751.db2.gz	FCLMHKQOWDXBNR-LAUBAEHRSA-N	0	3	347.462	3.443	20	30		EGEDHN
CCO[C@H]1C[C@H](N[C@@H](C)C(=O)Nc2ccccc2C#N)C1(CC)CC	ZINC000178667934	144074656	/nfs/dbraw/zinc/07/46/56/144074656.db2.gz	PWLRHSWCMFNHQE-WBAXXEDZSA-N	0	3	343.471	3.459	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)c1ccnc(C2CC2)c1	ZINC000341088317	155151345	/nfs/dbraw/zinc/15/13/45/155151345.db2.gz	ICVHGTFEVSEJHV-UHFFFAOYSA-N	0	3	348.450	3.035	20	30		EGEDHN
C[C@H]1CC=CC[C@@H]1C(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000341146473	155189803	/nfs/dbraw/zinc/18/98/03/155189803.db2.gz	LAGSXYQTRNRIIH-LPHOPBHVSA-N	0	3	325.456	3.051	20	30		EGEDHN
CCN1CCC[C@H]1CNc1c(C#N)cnc2c(OC)cc(OC)cc21	ZINC000341281409	155227248	/nfs/dbraw/zinc/22/72/48/155227248.db2.gz	UMOCHGZKMXYVIG-AWEZNQCLSA-N	0	3	340.427	3.020	20	30		EGEDHN
C[C@@H](N[C@H](C)c1cccc(NS(C)(=O)=O)c1)c1ccc(C#N)cc1	ZINC000154345795	152580335	/nfs/dbraw/zinc/58/03/35/152580335.db2.gz	ROLPKGNHXPYYPM-ZIAGYGMSSA-N	0	3	343.452	3.342	20	30		EGEDHN
Cc1ccnc(N2C[C@H]3CCN(Cc4ccccc4)C[C@H]3C2)c1C#N	ZINC000310994019	154145205	/nfs/dbraw/zinc/14/52/05/154145205.db2.gz	HEPUSQONBQGKNE-MOPGFXCFSA-N	0	3	332.451	3.220	20	30		EGEDHN
N#Cc1ccc(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)cc1	ZINC000311172205	154147141	/nfs/dbraw/zinc/14/71/41/154147141.db2.gz	UEXJHAVDQDVERO-IBGZPJMESA-N	0	3	333.435	3.200	20	30		EGEDHN
CC(C)n1nccc1CN[C@@H]1CCCN(c2ccc(C#N)cc2F)C1	ZINC000365434626	157123432	/nfs/dbraw/zinc/12/34/32/157123432.db2.gz	ZLKBTZJMADDGKI-MRXNPFEDSA-N	0	3	341.434	3.233	20	30		EGEDHN
CCS[C@@H]1CCCCN([C@@H]2CCN(c3ccc(C#N)cc3)C2=O)C1	ZINC000112089348	162162205	/nfs/dbraw/zinc/16/22/05/162162205.db2.gz	ILWORGYAAVLVCB-QZTJIDSGSA-N	0	3	343.496	3.271	20	30		EGEDHN
COc1cccc(N2C[C@@H](N[C@@H](C)c3ccc(C#N)cc3)CC2=O)c1	ZINC000344172080	164119528	/nfs/dbraw/zinc/11/95/28/164119528.db2.gz	OCFJPHLMACRRNF-YOEHRIQHSA-N	0	3	335.407	3.023	20	30		EGEDHN
CC[C@H](CNC(=O)Cc1ccc(C#N)cc1)N1CCc2ccccc2C1	ZINC000345556133	164213960	/nfs/dbraw/zinc/21/39/60/164213960.db2.gz	NJYXYDTUFOLEQQ-OAQYLSRUSA-N	0	3	347.462	3.054	20	30		EGEDHN
CC[C@@H]1CCCCN1CCNC(=O)N[C@@H](C)c1ccc(C#N)cc1	ZINC000354865993	166051240	/nfs/dbraw/zinc/05/12/40/166051240.db2.gz	YTWWOEMXNQWEAA-MAUKXSAKSA-N	0	3	328.460	3.183	20	30		EGEDHN
CCOC[C@H](N[C@H](C)C(=O)Nc1sc2c(c1C#N)CCC2)C(C)C	ZINC000348467729	164748416	/nfs/dbraw/zinc/74/84/16/164748416.db2.gz	JAACMBAQQWFCER-DOMZBBRYSA-N	0	3	349.500	3.086	20	30		EGEDHN
CN(CCCN1CCN(c2ccccc2)CC1)Cc1ccc(C#N)cc1	ZINC000352102418	165236862	/nfs/dbraw/zinc/23/68/62/165236862.db2.gz	NMNIONYNQYADCL-UHFFFAOYSA-N	0	3	348.494	3.202	20	30		EGEDHN
COc1cc2c(cc1OC)[C@H](NCCOc1ccc(C#N)cc1)CC2	ZINC000358970396	167023820	/nfs/dbraw/zinc/02/38/20/167023820.db2.gz	ULQRKJYBEVTLOX-GOSISDBHSA-N	0	3	338.407	3.231	20	30		EGEDHN
Cc1ccc2c(ncc(C#N)c2NCCN(C)C)c1Br	ZINC000359363386	167137249	/nfs/dbraw/zinc/13/72/49/167137249.db2.gz	BLXIBEYQWHURLK-UHFFFAOYSA-N	0	3	333.233	3.151	20	30		EGEDHN
CC[C@@H](C)N[C@@H](CNC(=O)c1cccc(F)c1C#N)c1ccco1	ZINC000359528893	167179918	/nfs/dbraw/zinc/17/99/18/167179918.db2.gz	BHVHNJJIPAZSFY-WBMJQRKESA-N	0	3	329.375	3.150	20	30		EGEDHN
COc1ccc(CN[C@@H](C)C[C@@H](O)c2ccc(F)cc2)cc1C#N	ZINC000130731833	533685091	/nfs/dbraw/zinc/68/50/91/533685091.db2.gz	WITQOYQUWPAGMC-SCLBCKFNSA-N	0	3	328.387	3.308	20	30		EGEDHN
C[C@H](c1ccccc1)[C@H](C)N[C@H]1CCN(c2ccc(C#N)cc2)C1=O	ZINC000476824468	269888399	/nfs/dbraw/zinc/88/83/99/269888399.db2.gz	OTZYKZVNNJLTEO-FTRWYGJKSA-N	0	3	333.435	3.445	20	30		EGEDHN
N#Cc1ccc(OCCN[C@@H](c2cccs2)C2(CO)CCC2)cc1	ZINC000452061652	269966302	/nfs/dbraw/zinc/96/63/02/269966302.db2.gz	PVPLXWHIKQVHET-SFHVURJKSA-N	0	3	342.464	3.492	20	30		EGEDHN
N#Cc1cccc(COc2cccc(CN3CCC[C@@H](O)CC3)c2)c1	ZINC000294079459	270042353	/nfs/dbraw/zinc/04/23/53/270042353.db2.gz	QYIAXKLEXJHXGI-HXUWFJFHSA-N	0	3	336.435	3.484	20	30		EGEDHN
CN(C)c1ncc(CNCCSCc2ccccc2C#N)s1	ZINC000298754053	270043085	/nfs/dbraw/zinc/04/30/85/270043085.db2.gz	NLLZDZYZKMBJAE-UHFFFAOYSA-N	0	3	332.498	3.104	20	30		EGEDHN
COc1ccc(OCCCNCc2ccc(C#N)c(OC)c2)cc1	ZINC000440811095	270051782	/nfs/dbraw/zinc/05/17/82/270051782.db2.gz	GGKSGLFRZYAXME-UHFFFAOYSA-N	0	3	326.396	3.134	20	30		EGEDHN
CCCN(C)[C@H](CNc1cncc(C#N)n1)c1ccc(Cl)cc1	ZINC000420607536	270048681	/nfs/dbraw/zinc/04/86/81/270048681.db2.gz	CDKQSJYMULJJJO-MRXNPFEDSA-N	0	3	329.835	3.497	20	30		EGEDHN
CC(C)[C@]1(C)C[C@@H]1NC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000459248369	270054751	/nfs/dbraw/zinc/05/47/51/270054751.db2.gz	MLIJBNFFZDUGHX-ICSRJNTNSA-N	0	3	342.487	3.066	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@H](NCc1cccc(N3CCOC3=O)c1)CC2	ZINC000496976976	270059104	/nfs/dbraw/zinc/05/91/04/270059104.db2.gz	IFCYOERLPXAIHH-LJQANCHMSA-N	0	3	333.391	3.292	20	30		EGEDHN
CCOCc1ccc(CNC(=O)C(C#N)Cc2ccc(C#N)cc2)cc1	ZINC000279820938	266285570	/nfs/dbraw/zinc/28/55/70/266285570.db2.gz	YEXCXZWCMNGHNP-FQEVSTJZSA-N	0	3	347.418	3.093	20	30		EGEDHN
CCO[C@@H]1C[C@@H](N[C@H](C)C(=O)Nc2oc(C)c(C)c2C#N)C12CCC2	ZINC000296038492	266293841	/nfs/dbraw/zinc/29/38/41/266293841.db2.gz	FCYGJOKIRJHINY-DAXOMENPSA-N	0	3	345.443	3.032	20	30		EGEDHN
CC(C)CN1CCCC[C@H]1CNC(=O)CSc1ccc(C#N)cc1	ZINC000439693829	266904144	/nfs/dbraw/zinc/90/41/44/266904144.db2.gz	HLMHCXBPRKMVOE-KRWDZBQOSA-N	0	3	345.512	3.277	20	30		EGEDHN
C[C@@H](NCCOc1cccc(C#N)c1)c1ccc(Br)cn1	ZINC000280644337	266965696	/nfs/dbraw/zinc/96/56/96/266965696.db2.gz	YLLLOFGXEJAGTI-GFCCVEGCSA-N	0	3	346.228	3.445	20	30		EGEDHN
CCCCOCCN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000439002555	267011414	/nfs/dbraw/zinc/01/14/14/267011414.db2.gz	FADDCHIRCNRZLR-UHFFFAOYSA-N	0	3	329.444	3.025	20	30		EGEDHN
C[C@@H](C1CCN(C)CC1)N(C)C(=O)Nc1ccc(C#N)cc1Cl	ZINC000273449299	267041103	/nfs/dbraw/zinc/04/11/03/267041103.db2.gz	OHTINMOJPJISQQ-LBPRGKRZSA-N	0	3	334.851	3.406	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(CNCc3ccc(C#N)o3)cc2)C[C@H](C)O1	ZINC000174257357	267053854	/nfs/dbraw/zinc/05/38/54/267053854.db2.gz	FYFDDSJXZRLLBR-IYBDPMFKSA-N	0	3	339.439	3.050	20	30		EGEDHN
CCO[C@@H]1C[C@H](NCc2ccc(C#N)c(F)c2)[C@@H]1Oc1ccccc1	ZINC000453368733	267152179	/nfs/dbraw/zinc/15/21/79/267152179.db2.gz	DTSUHVZIBLUSBR-ZCNNSNEGSA-N	0	3	340.398	3.412	20	30		EGEDHN
CC[C@@H](C)N[C@@H](CNC(=O)NCc1ccc(C#N)cc1)c1ccco1	ZINC000479271332	267186795	/nfs/dbraw/zinc/18/67/95/267186795.db2.gz	FOYSBIMIYMGQLR-PBHICJAKSA-N	0	3	340.427	3.080	20	30		EGEDHN
C[C@@H](CCN1CCN(C)CC1)Nc1ccc(C(F)(F)F)c(C#N)c1	ZINC000274467144	267242427	/nfs/dbraw/zinc/24/24/27/267242427.db2.gz	LPAXHSVCMBQGOJ-ZDUSSCGKSA-N	0	3	340.393	3.015	20	30		EGEDHN
CCc1cc(N2CCN(c3c(C#N)cnc4ccccc43)CC2)ccn1	ZINC000450294690	267245980	/nfs/dbraw/zinc/24/59/80/267245980.db2.gz	QKIHFWUUSFFGSN-UHFFFAOYSA-N	0	3	343.434	3.390	20	30		EGEDHN
N#Cc1ccc(-c2nnc(CN[C@H]3CCCC34CCOCC4)o2)cc1	ZINC000282209744	268029171	/nfs/dbraw/zinc/02/91/71/268029171.db2.gz	XVUZSSBIYJEFRJ-INIZCTEOSA-N	0	3	338.411	3.047	20	30		EGEDHN
Cc1cccc([C@H]2CCN(C[C@@H](O)COc3ccccc3C#N)C2)c1	ZINC000528440823	268057924	/nfs/dbraw/zinc/05/79/24/268057924.db2.gz	GHQHBNYJUNJCTK-VQTJNVASSA-N	0	3	336.435	3.096	20	30		EGEDHN
N#Cc1ccc(CNC(=O)CN[C@H]2CCC[C@H]2c2ccccc2)cc1	ZINC000275674553	268068689	/nfs/dbraw/zinc/06/86/89/268068689.db2.gz	XUICREGDSVWLNM-PMACEKPBSA-N	0	3	333.435	3.100	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@@H]2CCc3cc(F)ccc32)cc1	ZINC000279395044	268086450	/nfs/dbraw/zinc/08/64/50/268086450.db2.gz	UPNMBGSYMDEBED-QFBILLFUSA-N	0	3	333.366	3.183	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCCC2Cc3ccccc3C2)cc1	ZINC000280194534	268090163	/nfs/dbraw/zinc/09/01/63/268090163.db2.gz	UHNXRSWCTRKCFM-OAQYLSRUSA-N	0	3	343.430	3.162	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@@H]2C[C@H]2c2ccc(F)cc2)cc1	ZINC000279875867	268092242	/nfs/dbraw/zinc/09/22/42/268092242.db2.gz	CFTZNEOVOKPFTR-NZSAHSFTSA-N	0	3	333.366	3.052	20	30		EGEDHN
N#Cc1cccc(C(=O)N2CC[C@]3(CCN(Cc4ccccc4)C3)C2)c1	ZINC000285936857	268237196	/nfs/dbraw/zinc/23/71/96/268237196.db2.gz	UPLHXMJKFPNIJV-QFIPXVFZSA-N	0	3	345.446	3.296	20	30		EGEDHN
N#Cc1cccc(OCCCN[C@]2(CO)CCCc3ccccc32)c1	ZINC000440820412	268284933	/nfs/dbraw/zinc/28/49/33/268284933.db2.gz	OJUHSWOHQYVKTL-NRFANRHFSA-N	0	3	336.435	3.141	20	30		EGEDHN
N#Cc1cccc(OCCN(CCc2ccccc2)[C@H]2CCOC2)c1	ZINC000437541301	268284984	/nfs/dbraw/zinc/28/49/84/268284984.db2.gz	SMACEAJNNSKSBY-FQEVSTJZSA-N	0	3	336.435	3.271	20	30		EGEDHN
CS[C@@H]1CN(c2ccc(C(F)(F)F)c(C#N)c2)C[C@H]1N(C)C	ZINC000361704081	274182527	/nfs/dbraw/zinc/18/25/27/274182527.db2.gz	FLHBBUWQTWRNOC-ZIAGYGMSSA-N	0	3	329.391	3.059	20	30		EGEDHN
CC(C)CN(CC(=O)Nc1c(C#N)cnn1-c1ccccc1)C(C)C	ZINC000065950280	307360659	/nfs/dbraw/zinc/36/06/59/307360659.db2.gz	XVYOKOHHARMQRV-UHFFFAOYSA-N	0	3	339.443	3.049	20	30		EGEDHN
COC(=O)[C@H](C)[C@@H](NCCOc1cccc(C#N)c1)c1ccccc1	ZINC000079923781	307430100	/nfs/dbraw/zinc/43/01/00/307430100.db2.gz	OIFNSZQUDMWETF-DNVCBOLYSA-N	0	3	338.407	3.077	20	30		EGEDHN
C[C@H]1CN(Cc2cn(C)nc2-c2ccc(C#N)cc2)C[C@H](C)S1	ZINC000537612875	314195829	/nfs/dbraw/zinc/19/58/29/314195829.db2.gz	HVQAUIXHKGHFFY-KBPBESRZSA-N	0	3	326.469	3.285	20	30		EGEDHN
COc1ccc([C@@H](C)CN2CCN(c3ccccc3C#N)CC2)cc1	ZINC000538307702	314239453	/nfs/dbraw/zinc/23/94/53/314239453.db2.gz	DLBZDXJRKAGEPK-KRWDZBQOSA-N	0	3	335.451	3.493	20	30		EGEDHN
CSc1ccc([C@H](CNc2ccc(Cl)c(C#N)n2)N(C)C)cc1	ZINC000549686056	315100847	/nfs/dbraw/zinc/10/08/47/315100847.db2.gz	UHRLLBNXIFQTRK-INIZCTEOSA-N	0	3	346.887	3.465	20	30		EGEDHN
Cc1ccccc1[C@@H]([C@@H](C)Nc1nccc(C#N)c1Cl)N(C)C	ZINC000561408589	315760799	/nfs/dbraw/zinc/76/07/99/315760799.db2.gz	PLTNWDXQJYDGFO-CXAGYDPISA-N	0	3	328.847	3.440	20	30		EGEDHN
COc1cccc([C@H](CNc2ncc3c(c2C#N)CCC3)N(C)C)c1	ZINC000563883552	316085563	/nfs/dbraw/zinc/08/55/63/316085563.db2.gz	LORJVDBMZYMPJY-IBGZPJMESA-N	0	3	336.439	3.165	20	30		EGEDHN
COC(=O)C[C@H](NCc1ccc(C#N)cc1[N+](=O)[O-])C1CCCCC1	ZINC000565043759	316255201	/nfs/dbraw/zinc/25/52/01/316255201.db2.gz	KIAWVBJQOOLPMU-INIZCTEOSA-N	0	3	345.399	3.068	20	30		EGEDHN
Cc1ccccc1C[C@@H]1CCCN1Cc1cnc2c(C#N)cnn2c1	ZINC000565303892	316307026	/nfs/dbraw/zinc/30/70/26/316307026.db2.gz	VWIMAAQIAUJFLB-IBGZPJMESA-N	0	3	331.423	3.117	20	30		EGEDHN
CN(C)C[C@@H](CNC(=O)c1ccc(C#N)cc1)c1ccc(Cl)cc1	ZINC000569131730	316870664	/nfs/dbraw/zinc/87/06/64/316870664.db2.gz	ODKOIQRRZJENCH-QGZVFWFLSA-N	0	3	341.842	3.287	20	30		EGEDHN
C=CCN1CCC(Nc2ccnc3cc(Br)cnc32)CC1	ZINC000274577927	456261704	/nfs/dbraw/zinc/26/17/04/456261704.db2.gz	GYSJXRGDYCVOMC-UHFFFAOYSA-N	0	3	347.260	3.455	20	30		EGEDHN
N#Cc1cc(Br)ccc1N1CCN(c2ccncc2)CC1	ZINC000302205661	456316963	/nfs/dbraw/zinc/31/69/63/456316963.db2.gz	WYKSFXAQCXVQCE-UHFFFAOYSA-N	0	3	343.228	3.042	20	30		EGEDHN
COc1ccc([C@@H](NCC(=O)Nc2ccc(C#N)cc2)C2CC2)cc1	ZINC000193344431	323835997	/nfs/dbraw/zinc/83/59/97/323835997.db2.gz	BMHUMHCXHQTUJC-FQEVSTJZSA-N	0	3	335.407	3.246	20	30		EGEDHN
CCc1ccc(CN[C@H]2CCN(Cc3ccc(C#N)cc3)C2=O)s1	ZINC000576565777	324639660	/nfs/dbraw/zinc/63/96/60/324639660.db2.gz	MLZOCMGYSGHAAO-SFHVURJKSA-N	0	3	339.464	3.073	20	30		EGEDHN
CCN(C(=O)Nc1cccc(C#N)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000580443560	325251174	/nfs/dbraw/zinc/25/11/74/325251174.db2.gz	ZZPAXHCROCFOIW-GOSISDBHSA-N	0	3	349.438	3.082	20	30		EGEDHN
CC(C)N1CCCN(c2cc(Br)c(C#N)cc2F)CC1	ZINC000580844224	325301623	/nfs/dbraw/zinc/30/16/23/325301623.db2.gz	NBCSANKYVBVHFU-UHFFFAOYSA-N	0	3	340.240	3.380	20	30		EGEDHN
CCc1cccc(CN[C@H]2CCN(Cc3ccc(C#N)cc3)C2=O)c1	ZINC000581015993	325321349	/nfs/dbraw/zinc/32/13/49/325321349.db2.gz	RJSMDGOGCZZVQV-FQEVSTJZSA-N	0	3	333.435	3.011	20	30		EGEDHN
COc1ccc(C2(NCc3cnc4c(C#N)cnn4c3)CCCC2)cc1	ZINC000581824998	325391426	/nfs/dbraw/zinc/39/14/26/325391426.db2.gz	RQLMLKCSBFDUPE-UHFFFAOYSA-N	0	3	347.422	3.169	20	30		EGEDHN
C[C@@H](CNC(=O)[C@H](N)CCCC#N)c1c(Cl)cccc1Cl	ZINC000424112909	458560413	/nfs/dbraw/zinc/56/04/13/458560413.db2.gz	LEDNKHLBAWUFPQ-GXFFZTMASA-N	0	3	328.243	3.234	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1sc(C)cc1OC)C(C)C	ZINC000505517143	458745068	/nfs/dbraw/zinc/74/50/68/458745068.db2.gz	WIIWDEQMNAAVNW-HNNXBMFYSA-N	0	3	336.501	3.494	20	30		EGEDHN
CC(C#N)C(=O)N1CCC(C)(c2ccc(Br)cc2)CC1	ZINC000442976507	459069783	/nfs/dbraw/zinc/06/97/83/459069783.db2.gz	XELKZPDLGHLIHB-LBPRGKRZSA-N	0	3	335.245	3.489	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)NC1CC(C(F)(F)F)C1)C(C)C	ZINC000480518096	459202157	/nfs/dbraw/zinc/20/21/57/459202157.db2.gz	JFWISAMSCGVLQC-YMAMQOFZSA-N	0	3	347.425	3.325	20	30		EGEDHN
N#Cc1ccc(CNCc2ccc(C(=O)N3CCCCC3)cc2)cc1	ZINC000238162870	455257766	/nfs/dbraw/zinc/25/77/66/455257766.db2.gz	SEMGOQAQTLFUOQ-UHFFFAOYSA-N	0	3	333.435	3.474	20	30		EGEDHN
CCCO[C@H]1CCCN(CCOc2ccc(C#N)cc2OC)CC1	ZINC000158050674	455263520	/nfs/dbraw/zinc/26/35/20/455263520.db2.gz	FMNPFNYXDZJKDR-KRWDZBQOSA-N	0	3	332.444	3.227	20	30		EGEDHN
CCN(Cc1ccccc1N(C)C1CCN(C)CC1)C[C@H](C)C#N	ZINC000245545662	455326889	/nfs/dbraw/zinc/32/68/89/455326889.db2.gz	UGYYASXDDLBQHO-QGZVFWFLSA-N	0	3	328.504	3.199	20	30		EGEDHN
CC[C@H](C(=O)NCC#Cc1cccc(C(F)(F)F)c1)N(CC)CC	ZINC000605451595	460584897	/nfs/dbraw/zinc/58/48/97/460584897.db2.gz	QMODRMGICYJVOK-MRXNPFEDSA-N	0	3	340.389	3.294	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1C[C@H]1c1cccc(Cl)c1	ZINC000600735608	460584346	/nfs/dbraw/zinc/58/43/46/460584346.db2.gz	MPFITWDCCMWHML-FGTMMUONSA-N	0	3	342.826	3.097	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@@H](CO)CC(F)F)cc1OC	ZINC000623507652	460587421	/nfs/dbraw/zinc/58/74/21/460587421.db2.gz	UOXYPPBZWLRJPV-LLVKDONJSA-N	0	3	335.778	3.019	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](CN(C)Cc3scnc3C)C2)CCC1	ZINC000190640940	455357630	/nfs/dbraw/zinc/35/76/30/455357630.db2.gz	NXPCZDZGTGCLHM-MRXNPFEDSA-N	0	3	347.528	3.478	20	30		EGEDHN
C[C@@H](NC[C@H](O)COc1ccc(C#N)cc1)c1ccc(Cl)cc1	ZINC000023410142	453710116	/nfs/dbraw/zinc/71/01/16/453710116.db2.gz	WZRTZXXLUFGPCL-DYVFJYSZSA-N	0	3	330.815	3.302	20	30		EGEDHN
C[C@@H](NC[C@@H](O)COc1ccc(CC#N)cc1)c1ccc(Cl)cc1	ZINC000025867546	453788468	/nfs/dbraw/zinc/78/84/68/453788468.db2.gz	AMFBRMZMAJNPHG-RDTXWAMCSA-N	0	3	344.842	3.497	20	30		EGEDHN
COc1cccc([C@@H](CNc2ccc(C#N)cc2[N+](=O)[O-])N(C)C)c1	ZINC000032534033	453877845	/nfs/dbraw/zinc/87/78/45/453877845.db2.gz	PQAFAIWCOCVSSF-GOSISDBHSA-N	0	3	340.383	3.190	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H](C)c2ccccc2C(F)(F)F)CC1	ZINC000066922352	453886006	/nfs/dbraw/zinc/88/60/06/453886006.db2.gz	PNWKDTACZJYRJG-ZDUSSCGKSA-N	0	3	338.373	3.228	20	30		EGEDHN
C[C@H]1C[C@H]1c1ccc(CNC2CCN(c3ccc(C#N)cn3)CC2)o1	ZINC000067011023	453893929	/nfs/dbraw/zinc/89/39/29/453893929.db2.gz	CWOMLGRSMVEOKJ-KBXCAEBGSA-N	0	3	336.439	3.428	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccccc2OC2CCCC2)CC1	ZINC000067204238	453911180	/nfs/dbraw/zinc/91/11/80/453911180.db2.gz	RYSZQUYCYXSJMN-UHFFFAOYSA-N	0	3	326.440	3.292	20	30		EGEDHN
CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1cc(C#N)cs1	ZINC000084110666	453969483	/nfs/dbraw/zinc/96/94/83/453969483.db2.gz	OQPOLQILBPLGOJ-UHFFFAOYSA-N	0	3	347.871	3.477	20	30		EGEDHN
COC(=O)c1ccc(C(=O)C(C#N)c2ccc(C(F)(F)F)cn2)cc1	ZINC000041556421	453971082	/nfs/dbraw/zinc/97/10/82/453971082.db2.gz	BYXQEZPKKRNQID-CYBMUJFWSA-N	0	3	348.280	3.377	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000068216918	454008556	/nfs/dbraw/zinc/00/85/56/454008556.db2.gz	PCPQKRWWVQJADB-RDJZCZTQSA-N	0	3	331.435	3.046	20	30		EGEDHN
COc1ccc(CNC[C@@H](O)C2CCCCC2)cc1OCCCC#N	ZINC000069170540	454084705	/nfs/dbraw/zinc/08/47/05/454084705.db2.gz	VWFSXMWCHZOIGP-GOSISDBHSA-N	0	3	346.471	3.409	20	30		EGEDHN
CCCCS[C@H](C)C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000057489933	454132585	/nfs/dbraw/zinc/13/25/85/454132585.db2.gz	TZBKXNCAXNXDLV-MRXNPFEDSA-N	0	3	347.528	3.370	20	30		EGEDHN
CCCCS[C@@H](C)C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000057489931	454132784	/nfs/dbraw/zinc/13/27/84/454132784.db2.gz	TZBKXNCAXNXDLV-INIZCTEOSA-N	0	3	347.528	3.370	20	30		EGEDHN
Cc1cccc2c1ncc(C#N)c2NC1CCN([C@@H]2CCOC2)CC1	ZINC000089603036	454166850	/nfs/dbraw/zinc/16/68/50/454166850.db2.gz	KVRSUEDQNRQOJC-QGZVFWFLSA-N	0	3	336.439	3.080	20	30		EGEDHN
N#Cc1cc(Cl)ccc1NC[C@H]1C[C@@H](O)CN1Cc1ccccc1	ZINC000089644770	454173295	/nfs/dbraw/zinc/17/32/95/454173295.db2.gz	NHPLTOXVPAERCB-QZTJIDSGSA-N	0	3	341.842	3.259	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H](C)Cc2ccc(OC)cc2)CC1	ZINC000130895093	454224388	/nfs/dbraw/zinc/22/43/88/454224388.db2.gz	RKNFPXDXZKYTBS-MRXNPFEDSA-N	0	3	330.472	3.031	20	30		EGEDHN
N#Cc1ccccc1OCCNC1(c2ccc(F)cc2)CCOCC1	ZINC000071886834	454243996	/nfs/dbraw/zinc/24/39/96/454243996.db2.gz	UJZAMYBKAFJHBO-UHFFFAOYSA-N	0	3	340.398	3.372	20	30		EGEDHN
CC(C)[C@H](NCC(=O)N[C@@](C)(C#N)C1CC1)c1ccc(Cl)cc1	ZINC000078396181	454247654	/nfs/dbraw/zinc/24/76/54/454247654.db2.gz	UYPAMOLDYZXPKW-ROUUACIJSA-N	0	3	333.863	3.435	20	30		EGEDHN
Cc1ccc(C)c(CC(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)c1	ZINC000078462285	454256494	/nfs/dbraw/zinc/25/64/94/454256494.db2.gz	WCDFOBOTUJHBLF-UHFFFAOYSA-N	0	3	349.478	3.308	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC2(c3cccc(F)c3)CC2)CC1	ZINC000120230030	454275065	/nfs/dbraw/zinc/27/50/65/454275065.db2.gz	YUJWYDQSQSDJAC-UHFFFAOYSA-N	0	3	331.435	3.155	20	30		EGEDHN
C=CCOc1ccc(C(=O)Nc2ccc(OCCN(C)C)cc2)cc1	ZINC000046724157	454277115	/nfs/dbraw/zinc/27/71/15/454277115.db2.gz	FCSPFGIPGGXXIF-UHFFFAOYSA-N	0	3	340.423	3.444	20	30		EGEDHN
CC1CCN(CCNC(=O)N[C@H](CCC#N)c2ccccc2)CC1	ZINC000131976062	454303707	/nfs/dbraw/zinc/30/37/07/454303707.db2.gz	IEMBIZKAWUFBMK-GOSISDBHSA-N	0	3	328.460	3.063	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)c1ccccc1Cl	ZINC000047010692	454318624	/nfs/dbraw/zinc/31/86/24/454318624.db2.gz	QWSRTDQBZLPEOS-UHFFFAOYSA-N	0	3	341.842	3.416	20	30		EGEDHN
CCN(Cc1cccc(Cl)c1)C[C@@H](O)COc1ccc(C#N)cc1	ZINC000047958318	454424304	/nfs/dbraw/zinc/42/43/04/454424304.db2.gz	VBYURHQEUIGIAJ-GOSISDBHSA-N	0	3	344.842	3.473	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)n1	ZINC000048789497	454516279	/nfs/dbraw/zinc/51/62/79/454516279.db2.gz	SNBLRAIMIZVZSM-JTQLQIEISA-N	0	3	326.337	3.331	20	30		EGEDHN
COc1ccc([C@@H](NCC(=O)NC2(C#N)CCCCC2)C(C)C)cc1	ZINC000102693450	454516542	/nfs/dbraw/zinc/51/65/42/454516542.db2.gz	WODHOYALZUVABG-IBGZPJMESA-N	0	3	343.471	3.325	20	30		EGEDHN
CC(=O)c1cc(C(=O)C(C#N)c2ccc(C(F)(F)F)cn2)n(C)c1	ZINC000048828553	454518523	/nfs/dbraw/zinc/51/85/23/454518523.db2.gz	HLPVWCSIHVQXAG-LBPRGKRZSA-N	0	3	335.285	3.132	20	30		EGEDHN
C=CCOCCCC(=O)NCC1CCN(Cc2ccccc2F)CC1	ZINC000080107099	454534517	/nfs/dbraw/zinc/53/45/17/454534517.db2.gz	XVHNHSRLTNADKD-UHFFFAOYSA-N	0	3	348.462	3.137	20	30		EGEDHN
C[C@@H](CNC(=O)N[C@@H](C)c1ccc(C#N)cc1)N1CCC[C@@H](C)C1	ZINC000049198707	454538754	/nfs/dbraw/zinc/53/87/54/454538754.db2.gz	MUAXUOLHFPYRSF-PMPSAXMXSA-N	0	3	328.460	3.039	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cn(C)nc1C(C)(C)C)C(C)C	ZINC000092237455	454540366	/nfs/dbraw/zinc/54/03/66/454540366.db2.gz	VXGQJODCAXTAGU-KRWDZBQOSA-N	0	3	346.519	3.146	20	30		EGEDHN
C[C@H](CC(=O)C(C#N)C(=O)Nc1ccccn1)c1ccc(F)cc1	ZINC000103717464	454564601	/nfs/dbraw/zinc/56/46/01/454564601.db2.gz	PNMKKOHWQDTUTQ-IUODEOHRSA-N	0	3	325.343	3.062	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)OC(C)(C)C)CCN1Cc1ccc(C#N)cc1	ZINC000134641529	454573085	/nfs/dbraw/zinc/57/30/85/454573085.db2.gz	JBFHLCWEXSORQD-RHSMWYFYSA-N	0	3	329.444	3.436	20	30		EGEDHN
N#Cc1cccc(OC2CCN(C[C@H](O)Cc3ccccc3)CC2)c1	ZINC000104713174	454598775	/nfs/dbraw/zinc/59/87/75/454598775.db2.gz	VTDWMOQFFMLFNL-LJQANCHMSA-N	0	3	336.435	3.005	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(F)cc1	ZINC000065987097	454647948	/nfs/dbraw/zinc/64/79/48/454647948.db2.gz	LZRZBMDBQDNTBS-UHFFFAOYSA-N	0	3	340.402	3.293	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)c1sccc1C#N)c1ccsc1	ZINC000052035054	454650642	/nfs/dbraw/zinc/65/06/42/454650642.db2.gz	KBVDINRPXFOZMJ-CQSZACIVSA-N	0	3	333.482	3.494	20	30		EGEDHN
COc1ccc(C(=O)C2CCN(CCCSCC#N)CC2)cc1	ZINC000074980914	454668911	/nfs/dbraw/zinc/66/89/11/454668911.db2.gz	FQJRZSWQKVYYCC-UHFFFAOYSA-N	0	3	332.469	3.237	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2nc(-c3ccco3)sc2C)CC1	ZINC000106037024	454674846	/nfs/dbraw/zinc/67/48/46/454674846.db2.gz	GUDIETCMFIKZSQ-UHFFFAOYSA-N	0	3	345.468	3.482	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Cc2c[nH]c3cccc(C)c23)CC1	ZINC000106035012	454675141	/nfs/dbraw/zinc/67/51/41/454675141.db2.gz	WCRXBBINRCCXDT-UHFFFAOYSA-N	0	3	325.456	3.176	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)/C=C/c2cc(C)ccc2OC)CC1	ZINC000106038978	454675437	/nfs/dbraw/zinc/67/54/37/454675437.db2.gz	MQNURLQKWHQOLK-SOFGYWHQSA-N	0	3	328.456	3.174	20	30		EGEDHN
CN(C)[C@H](CNc1ccc([N+](=O)[O-])cc1C#N)c1ccc(F)cc1	ZINC000052486043	454676782	/nfs/dbraw/zinc/67/67/82/454676782.db2.gz	AGKSVKJXYDIBJI-QGZVFWFLSA-N	0	3	328.347	3.320	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCC(C)(C)c2ccccc2)CC1	ZINC000106259355	454688875	/nfs/dbraw/zinc/68/88/75/454688875.db2.gz	FBAJSNANZNMVEL-UHFFFAOYSA-N	0	3	329.488	3.304	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2ccc(OC(C)C)cc2)CC1	ZINC000106257352	454688918	/nfs/dbraw/zinc/68/89/18/454688918.db2.gz	QIAMDWBXOGZPHP-UHFFFAOYSA-N	0	3	345.487	3.314	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2ccc(COCC)cc2)CC1	ZINC000106259014	454689059	/nfs/dbraw/zinc/68/90/59/454689059.db2.gz	OAIIABXIPXKTBE-UHFFFAOYSA-N	0	3	345.487	3.063	20	30		EGEDHN
C=CCOc1cccc(CN2CCC[C@@H](CNC(=O)CCC)C2)c1	ZINC000124219346	454707319	/nfs/dbraw/zinc/70/73/19/454707319.db2.gz	VFXFKXFSMONGRQ-SFHVURJKSA-N	0	3	330.472	3.380	20	30		EGEDHN
N#CC1CCN(CCC(=O)Nc2cccc(Br)c2)CC1	ZINC000124227887	454707957	/nfs/dbraw/zinc/70/79/57/454707957.db2.gz	PMVOBLAFIPVISU-UHFFFAOYSA-N	0	3	336.233	3.013	20	30		EGEDHN
N#CCN(Cc1ccc(OCCN2CCCC2)cc1)C1CCCC1	ZINC000093563436	454720924	/nfs/dbraw/zinc/72/09/24/454720924.db2.gz	TVXSMBIJNKDCOO-UHFFFAOYSA-N	0	3	327.472	3.429	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@@H](C)CSc2ccc(F)cc2)CC1	ZINC000176301741	454725921	/nfs/dbraw/zinc/72/59/21/454725921.db2.gz	RECYBUMEWAATHO-AWEZNQCLSA-N	0	3	336.476	3.321	20	30		EGEDHN
C[C@H](C(=O)N(CCC#N)c1ccc(F)cc1)N1C[C@H]2CCC[C@@H]2C1	ZINC000152848741	454733073	/nfs/dbraw/zinc/73/30/73/454733073.db2.gz	UYCFKZRATWTNNK-BZUAXINKSA-N	0	3	329.419	3.193	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2Cc3ccccc3C[C@H]2C)CC1	ZINC000176501149	454752465	/nfs/dbraw/zinc/75/24/65/454752465.db2.gz	XUBRZWWXSVLAOZ-MRXNPFEDSA-N	0	3	327.472	3.183	20	30		EGEDHN
N#Cc1ccc(CN(CCC2OCCO2)Cc2cccc(F)c2)cc1	ZINC000124809627	454771880	/nfs/dbraw/zinc/77/18/80/454771880.db2.gz	LQAPBGAQNKZTDB-UHFFFAOYSA-N	0	3	340.398	3.463	20	30		EGEDHN
Cc1cc(N2CCN(C)CC2)ccc1NCc1ccc(C#N)s1	ZINC000176952030	454803316	/nfs/dbraw/zinc/80/33/16/454803316.db2.gz	KNRCVBFKPXRDBE-UHFFFAOYSA-N	0	3	326.469	3.292	20	30		EGEDHN
N#CC(C(=O)c1cnn(-c2ccccc2F)c1)c1nc2ccccc2[nH]1	ZINC000126214873	454878757	/nfs/dbraw/zinc/87/87/57/454878757.db2.gz	FRMDQDORCFBKKP-ZDUSSCGKSA-N	0	3	345.337	3.378	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN2CCC[C@@H](Nc3ccccc3)C2)c1	ZINC000155068603	454959703	/nfs/dbraw/zinc/95/97/03/454959703.db2.gz	HIEXZDQWJTWYOC-HXUWFJFHSA-N	0	3	348.450	3.463	20	30		EGEDHN
Cc1nc2c(s1)[C@@H](N(C)C[C@H](O)c1ccc(C#N)cc1)CCC2	ZINC000127390815	454960239	/nfs/dbraw/zinc/96/02/39/454960239.db2.gz	KIRAONIPOIGCJA-IRXDYDNUSA-N	0	3	327.453	3.366	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@H](OC(C)(C)C)c2ccccc2)CC1	ZINC000179248223	455024508	/nfs/dbraw/zinc/02/45/08/455024508.db2.gz	HINRMAUQKPCVBD-GOSISDBHSA-N	0	3	330.472	3.309	20	30		EGEDHN
CC[C@@H](CC#N)NC(=O)Nc1ccc(CCN2CCSCC2)cc1	ZINC000155931076	455062902	/nfs/dbraw/zinc/06/29/02/455062902.db2.gz	RFKDGRFUJQJKQN-INIZCTEOSA-N	0	3	346.500	3.092	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN(C)[C@@H](C)c1ccncc1	ZINC000179671674	455066356	/nfs/dbraw/zinc/06/63/56/455066356.db2.gz	HNSXEVCHGVCSIH-LPHOPBHVSA-N	0	3	326.440	3.243	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCc3c2cc(F)cc3F)CC1	ZINC000171607274	455079981	/nfs/dbraw/zinc/07/99/81/455079981.db2.gz	GXODKVSEYFWNLN-UHFFFAOYSA-N	0	3	335.398	3.077	20	30		EGEDHN
N#CCc1ccccc1C(=O)NC[C@@H](c1ccccc1)N1CCCC1	ZINC000600966521	460661104	/nfs/dbraw/zinc/66/11/04/460661104.db2.gz	PSROGAJJLBBVDO-FQEVSTJZSA-N	0	3	333.435	3.320	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC[C@@H](c2ccccc2)C(C)C)CC1	ZINC000171716376	455088746	/nfs/dbraw/zinc/08/87/46/455088746.db2.gz	RLZXQEQRDRENBM-LJQANCHMSA-N	0	3	329.488	3.376	20	30		EGEDHN
C[C@](C#N)(NC(=O)CN[C@H](c1ccccc1)C1CCCC1)C1CC1	ZINC000171935039	455102746	/nfs/dbraw/zinc/10/27/46/455102746.db2.gz	HAIDYVIKIGVOSD-WOJBJXKFSA-N	0	3	325.456	3.316	20	30		EGEDHN
CCN(CC)C(=O)C1(NCCOc2ccccc2C#N)CCCCC1	ZINC000118847170	455114731	/nfs/dbraw/zinc/11/47/31/455114731.db2.gz	XUIBWEXUPOCSDT-UHFFFAOYSA-N	0	3	343.471	3.098	20	30		EGEDHN
CC[C@H](NCC(=O)N[C@@](C)(C#N)C1CC1)C(C)(C)c1ccccc1	ZINC000180008486	455115804	/nfs/dbraw/zinc/11/58/04/455115804.db2.gz	MRUXLORHFBTNTL-PXNSSMCTSA-N	0	3	327.472	3.141	20	30		EGEDHN
C=CCC[C@H](NCC(=O)NC(=O)NC1CCCC1)c1ccccc1	ZINC000180042586	455120995	/nfs/dbraw/zinc/12/09/95/455120995.db2.gz	ZXQMFJLKTWCUHG-KRWDZBQOSA-N	0	3	329.444	3.052	20	30		EGEDHN
Cc1cc(NC(=O)C2(C#N)CCC2)ccc1OCCN1CCCC1	ZINC000119160998	455129617	/nfs/dbraw/zinc/12/96/17/455129617.db2.gz	SRAQYPFOXOMJDS-UHFFFAOYSA-N	0	3	327.428	3.102	20	30		EGEDHN
C=CCCCN1CCc2cc(OC)c(OC)cc2[C@H]1CC(=O)OC	ZINC000172173634	455131837	/nfs/dbraw/zinc/13/18/37/455131837.db2.gz	HARUBENVMTXVMY-MRXNPFEDSA-N	0	3	333.428	3.132	20	30		EGEDHN
COc1ccc(C#N)cc1CN(CCc1ccccc1)[C@@H]1CCOC1	ZINC000156717273	455146517	/nfs/dbraw/zinc/14/65/17/455146517.db2.gz	UEBNKFXVKGELDM-HXUWFJFHSA-N	0	3	336.435	3.400	20	30		EGEDHN
Cc1cc(CN(C)C)cc(NC(=O)Cc2cccc(OCC#N)c2)c1	ZINC000157010727	455161014	/nfs/dbraw/zinc/16/10/14/455161014.db2.gz	GIAIFEUKYRWELI-UHFFFAOYSA-N	0	3	337.423	3.140	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN2CCCN(C3CCCC3)CC2)c1C	ZINC000172579814	455162790	/nfs/dbraw/zinc/16/27/90/455162790.db2.gz	IPCAIYRYKSXJII-UHFFFAOYSA-N	0	3	343.515	3.424	20	30		EGEDHN
Cc1ccccc1NC(=O)C[C@H](C)NCc1ccc(OCC#N)cc1	ZINC000180552810	455195272	/nfs/dbraw/zinc/19/52/72/455195272.db2.gz	NCHJGCUUMMJKNF-INIZCTEOSA-N	0	3	337.423	3.404	20	30		EGEDHN
C[C@@H](CC(=O)Nc1ccc(F)cc1)NCc1ccc(OCC#N)cc1	ZINC000180556022	455195991	/nfs/dbraw/zinc/19/59/91/455195991.db2.gz	UWIWJIZEIQMPTF-AWEZNQCLSA-N	0	3	341.386	3.235	20	30		EGEDHN
C[C@H](NCc1ccc(OCC#N)cc1)c1ccc([S@](C)=O)cc1	ZINC000180558388	455196552	/nfs/dbraw/zinc/19/65/52/455196552.db2.gz	OAFYJJNIEBSRCT-PSLXWICFSA-N	0	3	328.437	3.177	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC[C@H](c3ccccc3C)C2)CC1	ZINC000264362345	455197905	/nfs/dbraw/zinc/19/79/05/455197905.db2.gz	OSJGJTJFTCRFJH-KRWDZBQOSA-N	0	3	327.472	3.144	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2COc3c2ccc(C)c3C)CC1	ZINC000264369484	455199689	/nfs/dbraw/zinc/19/96/89/455199689.db2.gz	IWDQUBWGBRVZNG-GOSISDBHSA-N	0	3	343.471	3.077	20	30		EGEDHN
N#Cc1ccc(CN2CCC(CCCN3CCOCC3)CC2)c(F)c1	ZINC000182963146	455199852	/nfs/dbraw/zinc/19/98/52/455199852.db2.gz	LXLHMCVAIWQTKY-UHFFFAOYSA-N	0	3	345.462	3.022	20	30		EGEDHN
Cc1cccc(C)c1OCCCNCc1cnc2ccc(C#N)cn12	ZINC000237651524	455202915	/nfs/dbraw/zinc/20/29/15/455202915.db2.gz	YREZIHYGNSHFKF-UHFFFAOYSA-N	0	3	334.423	3.382	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@@H](C)N[C@H](CC)c1ccc2c(c1)OCCO2	ZINC000180642622	455216380	/nfs/dbraw/zinc/21/63/80/455216380.db2.gz	ZNYIEYFHSLQYQV-NVXWUHKLSA-N	0	3	344.455	3.088	20	30		EGEDHN
C[C@@H]1CSCCN(Cc2cn(C)nc2-c2ccc(C#N)cc2)C1	ZINC000190461565	455323060	/nfs/dbraw/zinc/32/30/60/455323060.db2.gz	OPWZTBVLORZBGQ-AWEZNQCLSA-N	0	3	326.469	3.144	20	30		EGEDHN
C[C@H](CN(C)CCC(=O)Nc1sccc1C#N)c1nccs1	ZINC000183946625	455342932	/nfs/dbraw/zinc/34/29/32/455342932.db2.gz	FWZFNINUZJOHAB-LLVKDONJSA-N	0	3	334.470	3.140	20	30		EGEDHN
C[C@@H](N[C@H]1CC(=O)N(c2ccccc2)C1)c1ccc(OCC#N)cc1	ZINC000181589983	455358716	/nfs/dbraw/zinc/35/87/16/455358716.db2.gz	AQTRRBWLZNZJCR-WBVHZDCISA-N	0	3	335.407	3.045	20	30		EGEDHN
CN1CCC[C@H](CNC(=O)c2cccc(Nc3ccc(C#N)cc3)c2)C1	ZINC000159512798	455381928	/nfs/dbraw/zinc/38/19/28/455381928.db2.gz	OOMBKWBPNIHUQN-QGZVFWFLSA-N	0	3	348.450	3.373	20	30		EGEDHN
Cc1cnc(CNC2CCN(Cc3ccc(C#N)cc3)CC2)s1	ZINC000181824797	455387046	/nfs/dbraw/zinc/38/70/46/455387046.db2.gz	BNMHDUAIUCMIHI-UHFFFAOYSA-N	0	3	326.469	3.077	20	30		EGEDHN
C[C@H](N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)c1ccc(C#N)cc1	ZINC000181890067	455395301	/nfs/dbraw/zinc/39/53/01/455395301.db2.gz	BCDFSCFBFHPKPH-LAUBAEHRSA-N	0	3	347.462	3.443	20	30		EGEDHN
CN1CCN(CCOc2ccc(NCC(C)(C)CCC#N)cc2)CC1	ZINC000174653154	455409341	/nfs/dbraw/zinc/40/93/41/455409341.db2.gz	TXFKMHAMFPXJNZ-UHFFFAOYSA-N	0	3	344.503	3.055	20	30		EGEDHN
C[C@H](N[C@H]1C[C@H](C)N(c2ccccc2)C1=O)c1ccc(OCC#N)cc1	ZINC000181995635	455412051	/nfs/dbraw/zinc/41/20/51/455412051.db2.gz	ZPAQWQFQIDHZHR-FTRWYGJKSA-N	0	3	349.434	3.434	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN2CCC[C@@H]2C[C@H](O)c2cccs2)cc1	ZINC000246106147	455427946	/nfs/dbraw/zinc/42/79/46/455427946.db2.gz	WYJQVVLTUPRZKW-FGTMMUONSA-N	0	3	342.464	3.241	20	30		EGEDHN
C=CCC[C@@H](C)NCc1ccccc1S(=O)(=O)N1CCCCC1	ZINC000184966189	455479376	/nfs/dbraw/zinc/47/93/76/455479376.db2.gz	CTCDDSKUWCZDQO-MRXNPFEDSA-N	0	3	336.501	3.306	20	30		EGEDHN
Cc1nnc(N[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)c(C#N)c1C	ZINC000267208736	455516355	/nfs/dbraw/zinc/51/63/55/455516355.db2.gz	LGFKYWZEWILRSI-IFXJQAMLSA-N	0	3	335.455	3.288	20	30		EGEDHN
CCc1ccc(CN[C@H]2CCN(Cc3ccc(C#N)cc3)C2=O)cc1	ZINC000192244423	455581036	/nfs/dbraw/zinc/58/10/36/455581036.db2.gz	VPQMOSMTLGCZRD-FQEVSTJZSA-N	0	3	333.435	3.011	20	30		EGEDHN
C#CCCCCC(=O)NC[C@H](c1cccc(OC)c1)N(CC)CC	ZINC000271338433	455603292	/nfs/dbraw/zinc/60/32/92/455603292.db2.gz	CFZOBCXWJHZZIT-LJQANCHMSA-N	0	3	330.472	3.388	20	30		EGEDHN
N#C[C@@H]1CCC[C@@H](NCc2cc3c(c(Br)c2)OCO3)C1	ZINC000185882425	455642829	/nfs/dbraw/zinc/64/28/29/455642829.db2.gz	HGIBKJPYAGJJPJ-ZYHUDNBSSA-N	0	3	337.217	3.350	20	30		EGEDHN
C[C@@H](NCC(=O)N[C@](C)(C#N)C1CC1)C1(c2ccccc2)CCCC1	ZINC000185953851	455661010	/nfs/dbraw/zinc/66/10/10/455661010.db2.gz	WJGAOMVXHBTHLP-OXQOHEQNSA-N	0	3	339.483	3.285	20	30		EGEDHN
C#CC[C@@H](N[C@H](C)Cn1cc(Br)cn1)c1ccccc1	ZINC000271579723	455691535	/nfs/dbraw/zinc/69/15/35/455691535.db2.gz	WUXUDWGSHWKFRJ-CZUORRHYSA-N	0	3	332.245	3.388	20	30		EGEDHN
COc1ccc([C@H](OC)[C@@H](C)NCc2ccc(OC)c(C#N)c2)cc1	ZINC000271589471	455693903	/nfs/dbraw/zinc/69/39/03/455693903.db2.gz	WPTDZDXZLHPKBH-JLTOFOAXSA-N	0	3	340.423	3.441	20	30		EGEDHN
CN(C(=O)/C=C/c1ccc(C#N)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000268509011	455702188	/nfs/dbraw/zinc/70/21/88/455702188.db2.gz	CXNJNXILQBLDOC-RJRNSMGGSA-N	0	3	345.446	3.304	20	30		EGEDHN
CN1CCO[C@H]([C@H](N[C@@H]2CCC[C@@H](C#N)C2)c2ccc(Cl)cc2)C1	ZINC000248747808	455728310	/nfs/dbraw/zinc/72/83/10/455728310.db2.gz	FPODCTBXHNWGEE-DQEVTTJGSA-N	0	3	347.890	3.384	20	30		EGEDHN
C[C@@H]1CN(Cc2cccc(CN[C@H]3CCC[C@H](C#N)C3)c2)CCO1	ZINC000248855903	455734248	/nfs/dbraw/zinc/73/42/48/455734248.db2.gz	PHJDQHIGWRDRNY-UWVAXJGDSA-N	0	3	327.472	3.079	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)N[C@H]1CCO[C@H]1c1ccc(Cl)cc1	ZINC000249069796	455743375	/nfs/dbraw/zinc/74/33/75/455743375.db2.gz	QGZJWFAGESDVPQ-WBAXXEDZSA-N	0	3	348.874	3.349	20	30		EGEDHN
C=CCOCCN1CCC[C@H](CNC(=O)Nc2ccc(C)cc2)C1	ZINC000292750344	455746720	/nfs/dbraw/zinc/74/67/20/455746720.db2.gz	IAGXTSUQFALQQC-QGZVFWFLSA-N	0	3	331.460	3.031	20	30		EGEDHN
N#C[C@H]1CCC[C@H](N[C@@H]2CCCN(Cc3ccc(F)cc3F)C2=O)C1	ZINC000193343628	455754469	/nfs/dbraw/zinc/75/44/69/455754469.db2.gz	KPYVOGGMXRAVQD-QANKJYHBSA-N	0	3	347.409	3.128	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(OC(C)(C)C)cn2)CC1	ZINC000293002430	455769608	/nfs/dbraw/zinc/76/96/08/455769608.db2.gz	GHTKUXZUGQAAOE-UHFFFAOYSA-N	0	3	331.460	3.029	20	30		EGEDHN
Cc1cc(CN(C)C)cc(NC(=O)c2cc(C#N)cc(N(C)C)c2)c1	ZINC000293585188	455791552	/nfs/dbraw/zinc/79/15/52/455791552.db2.gz	WUGNGJGJVIIUIZ-UHFFFAOYSA-N	0	3	336.439	3.247	20	30		EGEDHN
C#CC[C@H](NCc1ccc(O[C@H](C)C(=O)OC)cc1)c1ccccc1	ZINC000271868095	455793589	/nfs/dbraw/zinc/79/35/89/455793589.db2.gz	WQCXUHHHWZVABG-UZLBHIALSA-N	0	3	337.419	3.481	20	30		EGEDHN
C[C@H](C#N)CN(C)C(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000269141542	455797806	/nfs/dbraw/zinc/79/78/06/455797806.db2.gz	OGKDFKKBDOHKEW-MRXNPFEDSA-N	0	3	344.459	3.175	20	30		EGEDHN
COc1cc(OC)cc(OCCN[C@@H](C)c2ccc(C#N)c(F)c2)c1	ZINC000271919581	455799353	/nfs/dbraw/zinc/79/93/53/455799353.db2.gz	DGDIPBZOMSXSHV-ZDUSSCGKSA-N	0	3	344.386	3.444	20	30		EGEDHN
N#CCOc1ccccc1C(=O)N1C[C@H]2CCCN2Cc2ccccc21	ZINC000194204968	455814865	/nfs/dbraw/zinc/81/48/65/455814865.db2.gz	GTAGVMLDMJOOAN-QGZVFWFLSA-N	0	3	347.418	3.214	20	30		EGEDHN
N#Cc1ccc(Cl)c(C(=O)N2CCC[C@@H]2CN2CCCCC2)c1	ZINC000285345602	455828123	/nfs/dbraw/zinc/82/81/23/455828123.db2.gz	PEWLAGPHJKDKGG-OAHLLOKOSA-N	0	3	331.847	3.302	20	30		EGEDHN
CC[C@@H](N[C@H]1CCCN(CC(F)(F)F)C1=O)c1ccc(C#N)cc1	ZINC000278358538	455828423	/nfs/dbraw/zinc/82/84/23/455828423.db2.gz	BFDYRWXAQVWQTP-CABCVRRESA-N	0	3	339.361	3.152	20	30		EGEDHN
CCn1cc([C@@H](C)NC2CCN(Cc3ccc(C#N)cc3)CC2)cn1	ZINC000294854289	455830073	/nfs/dbraw/zinc/83/00/73/455830073.db2.gz	NQDZFSBPVNWQQY-MRXNPFEDSA-N	0	3	337.471	3.090	20	30		EGEDHN
N#Cc1c2c(sc1NC(=O)CCN1CCC(CF)CC1)CCC2	ZINC000295233048	455843358	/nfs/dbraw/zinc/84/33/58/455843358.db2.gz	ZGXOQFIGFKIXPC-UHFFFAOYSA-N	0	3	335.448	3.119	20	30		EGEDHN
COc1cc(C#N)ccc1OCCNC(C)(C)c1c(C)noc1C	ZINC000285472513	455852427	/nfs/dbraw/zinc/85/24/27/455852427.db2.gz	AXLPZAXZAVAOIH-UHFFFAOYSA-N	0	3	329.400	3.075	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)N[C@@H](C[C@@H]1CCOC1)c1ccccc1	ZINC000279131118	455858838	/nfs/dbraw/zinc/85/88/38/455858838.db2.gz	WBRLYPIUSLIKHX-BJLQDIEVSA-N	0	3	342.483	3.333	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@@H]1CCC[C@@H]1CCO	ZINC000279196947	455860323	/nfs/dbraw/zinc/86/03/23/455860323.db2.gz	FOYGXZUALRWCGB-HUUCEWRRSA-N	0	3	334.485	3.044	20	30		EGEDHN
Cc1ccc2c(c1)CC[C@@H]2NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000279281362	455862367	/nfs/dbraw/zinc/86/23/67/455862367.db2.gz	KGCPJMVFEPEYHE-ICSRJNTNSA-N	0	3	329.403	3.353	20	30		EGEDHN
C=CCN1CCC(NC(=O)/C=C\c2cccc(OC(C)C)c2)CC1	ZINC000255544460	455869036	/nfs/dbraw/zinc/86/90/36/455869036.db2.gz	IGAPJYLTRTUWPC-HJWRWDBZSA-N	0	3	328.456	3.254	20	30		EGEDHN
C=CCOc1ccc(CNCc2ccc(N(C)CCOC)nc2)cc1	ZINC000285631133	455885110	/nfs/dbraw/zinc/88/51/10/455885110.db2.gz	REHZIPSUEVBVBK-UHFFFAOYSA-N	0	3	341.455	3.019	20	30		EGEDHN
CC(C)CSCCNCc1cn(C)nc1-c1ccc(C#N)cc1	ZINC000272269308	455897038	/nfs/dbraw/zinc/89/70/38/455897038.db2.gz	KHKXLKBBXVOSHW-UHFFFAOYSA-N	0	3	328.485	3.438	20	30		EGEDHN
COC1(C)CCN(Cc2cn(CCC#N)nc2-c2ccccc2)CC1	ZINC000272364023	455925948	/nfs/dbraw/zinc/92/59/48/455925948.db2.gz	NVCVIZIPGVJQGQ-UHFFFAOYSA-N	0	3	338.455	3.465	20	30		EGEDHN
C[C@@H](O)[C@H]1CCN(Cc2cccc(OCc3cccc(C#N)c3)c2)C1	ZINC000272470353	455961532	/nfs/dbraw/zinc/96/15/32/455961532.db2.gz	AEUBJMVHIULWLC-UZLBHIALSA-N	0	3	336.435	3.340	20	30		EGEDHN
C#CCCN1CCC(C(=O)Nc2cccc(Br)c2)CC1	ZINC000270568740	455984502	/nfs/dbraw/zinc/98/45/02/455984502.db2.gz	ZTFQKNCRIGWWJQ-UHFFFAOYSA-N	0	3	335.245	3.123	20	30		EGEDHN
Cc1ccc(O[C@H](C)CNC(=O)C(C#N)Cc2ccc(C#N)cc2)cc1	ZINC000280540009	455994949	/nfs/dbraw/zinc/99/49/49/455994949.db2.gz	SXGCMKKXGRJDTL-VQIMIIECSA-N	0	3	347.418	3.133	20	30		EGEDHN
COCC[C@@H](NC1CCN(c2ccc(C#N)cc2)CC1)c1ccco1	ZINC000286349643	456030146	/nfs/dbraw/zinc/03/01/46/456030146.db2.gz	ZELYMROVAUHXGJ-LJQANCHMSA-N	0	3	339.439	3.487	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N1CC[C@](C)(COC)C1	ZINC000296834498	456048447	/nfs/dbraw/zinc/04/84/47/456048447.db2.gz	SKKINRMZNWSCJN-YJBOKZPZSA-N	0	3	336.501	3.010	20	30		EGEDHN
CC(C)Oc1ccc([C@H](CNC(=O)NCCCCC#N)N(C)C)cc1	ZINC000287216590	456063960	/nfs/dbraw/zinc/06/39/60/456063960.db2.gz	AIINMBBVGJTDLQ-SFHVURJKSA-N	0	3	346.475	3.070	20	30		EGEDHN
C=CCN1CCC(N[C@H](COC)c2cccc(Cl)c2F)CC1	ZINC000287891695	456082265	/nfs/dbraw/zinc/08/22/65/456082265.db2.gz	YZSSLOUNGFGIQO-MRXNPFEDSA-N	0	3	326.843	3.407	20	30		EGEDHN
C[C@H]1[C@H](NC(=O)C2(C#N)CCCCC2)CCN1Cc1ccccc1	ZINC000288246295	456090969	/nfs/dbraw/zinc/09/09/69/456090969.db2.gz	OPLZSUMYMLMEIP-FUHWJXTLSA-N	0	3	325.456	3.240	20	30		EGEDHN
Cc1ccc2ncc(CN(CCN(C)C)Cc3ccc(C#N)cc3)n2c1	ZINC000289678585	456136251	/nfs/dbraw/zinc/13/62/51/456136251.db2.gz	DXHGAGPMMWMZMD-UHFFFAOYSA-N	0	3	347.466	3.078	20	30		EGEDHN
COc1cc(CNCCCC#N)ccc1OCc1c(C)noc1C	ZINC000273043678	456158153	/nfs/dbraw/zinc/15/81/53/456158153.db2.gz	IZIWYYVEPHZJMT-UHFFFAOYSA-N	0	3	329.400	3.272	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1c2ccc(C)cc2[C@H]2CN(C)CC[C@@H]21	ZINC000281205785	456164584	/nfs/dbraw/zinc/16/45/84/456164584.db2.gz	QDZMAONZQTYNNO-WDYCEAGBSA-N	0	3	328.456	3.111	20	30		EGEDHN
N#Cc1ccc(CN(CCOCC(F)(F)C(F)F)C2CC2)cc1	ZINC000188917002	456170358	/nfs/dbraw/zinc/17/03/58/456170358.db2.gz	SVIVVCLQEAFTOZ-UHFFFAOYSA-N	0	3	330.325	3.440	20	30		EGEDHN
C=C[C@H](CO)NCc1ccc(OCc2ccccc2)c(OCC)c1	ZINC000289903599	456174284	/nfs/dbraw/zinc/17/42/84/456174284.db2.gz	RCJUZWOKUHMBTL-GOSISDBHSA-N	0	3	327.424	3.301	20	30		EGEDHN
COc1ccc([C@H](CN2CCCC2)NC(=O)c2ccc(C#N)cc2)cc1	ZINC000271241687	456188125	/nfs/dbraw/zinc/18/81/25/456188125.db2.gz	BMQHQHQDQLSSLP-FQEVSTJZSA-N	0	3	349.434	3.134	20	30		EGEDHN
C=CCNC(=O)CN(C)CCCCCc1cc(-c2ccccc2)no1	ZINC000263705620	456198167	/nfs/dbraw/zinc/19/81/67/456198167.db2.gz	MDAMZXLLKARHEU-UHFFFAOYSA-N	0	3	341.455	3.288	20	30		EGEDHN
C=CCc1cc(CN[C@H](CO)Cc2cccc(C)c2)cc(OC)c1O	ZINC000189026142	456203698	/nfs/dbraw/zinc/20/36/98/456203698.db2.gz	WVQDIKJNXYIRMM-IBGZPJMESA-N	0	3	341.451	3.131	20	30		EGEDHN
C[C@]12CN(C(=O)C(C#N)Cc3ccc(C#N)cc3)C[C@H]1[C@@H]1CC[C@H]2C1	ZINC000333546762	456232972	/nfs/dbraw/zinc/23/29/72/456232972.db2.gz	TUFDMFJJAVYTTG-XLIFZOOWSA-N	0	3	333.435	3.135	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)N(C)[C@@H](C)C1CCN(C)CC1	ZINC000273588966	456239018	/nfs/dbraw/zinc/23/90/18/456239018.db2.gz	LEXBTUVFHJOOKV-INIZCTEOSA-N	0	3	345.487	3.123	20	30		EGEDHN
COc1ccc([C@@H](OC)[C@H](C)NCc2ccc(C#N)c(OC)c2)cc1	ZINC000281467654	456242514	/nfs/dbraw/zinc/24/25/14/456242514.db2.gz	BHJICEZOLVWNJW-XOBRGWDASA-N	0	3	340.423	3.441	20	30		EGEDHN
C=CCOCCCc1nc(-c2ccc3c(c2)C(SC)C(=O)N3)no1	ZINC000273912160	456247034	/nfs/dbraw/zinc/24/70/34/456247034.db2.gz	QRTTUFYQIQDNTK-HNNXBMFYSA-N	0	3	345.424	3.228	20	30		EGEDHN
C=CCS(=O)(=O)CCN[C@H]1CCCc2c3cc(C)ccc3[nH]c21	ZINC000290213334	456268294	/nfs/dbraw/zinc/26/82/94/456268294.db2.gz	HJDATPDOINQLCD-KRWDZBQOSA-N	0	3	332.469	3.044	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@@H]1CCCC[C@H]1OC	ZINC000275285995	456272264	/nfs/dbraw/zinc/27/22/64/456272264.db2.gz	WXXPWAWIKRPJOR-GDBMZVCRSA-N	0	3	334.485	3.450	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NC[C@@H](c1ccccc1)N1CCCC1	ZINC000275643680	456278177	/nfs/dbraw/zinc/27/81/77/456278177.db2.gz	AWTKDBRACWNJOS-ICSRJNTNSA-N	0	3	330.472	3.169	20	30		EGEDHN
CCCN(Cc1cc(C(=O)OC)n(C)c1)Cc1ccc(C#N)cc1	ZINC000347657859	456285894	/nfs/dbraw/zinc/28/58/94/456285894.db2.gz	VALQPMYZAKTFOO-UHFFFAOYSA-N	0	3	325.412	3.096	20	30		EGEDHN
N#Cc1ccccc1CN1CCN(c2ccnc3ccccc32)CC1	ZINC000347685264	456305534	/nfs/dbraw/zinc/30/55/34/456305534.db2.gz	HFZKXUYVLZEUGX-UHFFFAOYSA-N	0	3	328.419	3.429	20	30		EGEDHN
CN(C)[C@H](CNc1nccnc1C#N)c1cccc(C(F)(F)F)c1	ZINC000302211727	456319556	/nfs/dbraw/zinc/31/95/56/456319556.db2.gz	DNZJEGRMSCONFB-CQSZACIVSA-N	0	3	335.333	3.082	20	30		EGEDHN
CC(C)[C@@H](CNCc1nc(C#N)cs1)N1CCc2ccccc2C1	ZINC000352821506	456335980	/nfs/dbraw/zinc/33/59/80/456335980.db2.gz	HEWPQVPJOCHSIH-GOSISDBHSA-N	0	3	340.496	3.187	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/Cc2csc(COC)n2)c([O-])c1	ZINC000290500993	456345667	/nfs/dbraw/zinc/34/56/67/456345667.db2.gz	IVOFWDCAKIYILV-GIJQJNRQSA-N	0	3	333.457	3.460	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCc2ccc3sccc3c2)CC1	ZINC000290623347	456386616	/nfs/dbraw/zinc/38/66/16/456386616.db2.gz	CGIWSUQSHGMQAL-UHFFFAOYSA-N	0	3	329.469	3.351	20	30		EGEDHN
C=CCOCCCN1CCC(Oc2c(OC)cccc2OC)CC1	ZINC000347969954	456431397	/nfs/dbraw/zinc/43/13/97/456431397.db2.gz	UVSHLYABPGOKPS-UHFFFAOYSA-N	0	3	335.444	3.140	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cc(F)cc(F)c2OC)CC1	ZINC000352994610	456436087	/nfs/dbraw/zinc/43/60/87/456436087.db2.gz	ZCCGDQFGWOPTJG-UHFFFAOYSA-N	0	3	339.386	3.135	20	30		EGEDHN
CC(C)(C)n1cc(C#N)cc1NC(=O)NCCN1CCCCCC1	ZINC000337701354	456490120	/nfs/dbraw/zinc/49/01/20/456490120.db2.gz	CBPYNAGLFJHZOE-UHFFFAOYSA-N	0	3	331.464	3.112	20	30		EGEDHN
N#Cc1csc(C(=O)NCCN2CCC3(CCCCC3)CC2)c1	ZINC000337737552	456514998	/nfs/dbraw/zinc/51/49/98/456514998.db2.gz	QJDSGFAIWPREQY-UHFFFAOYSA-N	0	3	331.485	3.396	20	30		EGEDHN
Cc1ccc(CNC(=O)C2CCN([C@H](C)CCC#N)CC2)cc1F	ZINC000276601314	456527214	/nfs/dbraw/zinc/52/72/14/456527214.db2.gz	RCQVCVHOPZQSPD-OAHLLOKOSA-N	0	3	331.435	3.155	20	30		EGEDHN
C[C@@H](O)[C@@](C)(CNCc1ccc(C#N)cc1F)Cc1ccccc1	ZINC000276699619	456556164	/nfs/dbraw/zinc/55/61/64/456556164.db2.gz	MWUDNGDPEROUTL-FOIQADDNSA-N	0	3	326.415	3.417	20	30		EGEDHN
CCc1nc(C#N)cc(N(C)[C@H]2CCCN(Cc3ccccc3)C2)n1	ZINC000308178116	456571117	/nfs/dbraw/zinc/57/11/17/456571117.db2.gz	KVPRVCZSITZOBJ-SFHVURJKSA-N	0	3	335.455	3.011	20	30		EGEDHN
C[C@H](N[C@H]1CCN(C(=O)Cc2ccccc2)C1)c1cccc(C#N)c1	ZINC000340621998	456577947	/nfs/dbraw/zinc/57/79/47/456577947.db2.gz	UAHIOBSXZNPMGP-JXFKEZNVSA-N	0	3	333.435	3.052	20	30		EGEDHN
C=CCC1([NH2+]Cc2nc3c(cnn3-c3ccccc3)c(=O)[n-]2)CCCC1	ZINC000661852377	462439159	/nfs/dbraw/zinc/43/91/59/462439159.db2.gz	SUNPVQIJJXEDQB-UHFFFAOYSA-N	0	3	349.438	3.500	20	30		EGEDHN
C=CCC1(NCc2nc3c(cnn3-c3ccccc3)c(=O)[nH]2)CCCC1	ZINC000661852377	462439163	/nfs/dbraw/zinc/43/91/63/462439163.db2.gz	SUNPVQIJJXEDQB-UHFFFAOYSA-N	0	3	349.438	3.500	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@H](N[C@H](Cc1ccccc1)[C@@H](O)C(F)F)CC2	ZINC000353250726	456587067	/nfs/dbraw/zinc/58/70/67/456587067.db2.gz	GICYJRNTTNPMNV-GUDVDZBRSA-N	0	3	342.389	3.372	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000337980216	456635601	/nfs/dbraw/zinc/63/56/01/456635601.db2.gz	LKZVJTUFWCFTMB-UHFFFAOYSA-N	0	3	347.462	3.304	20	30		EGEDHN
Cc1ccc(CCCN2CCCN(Cc3ccc(C#N)cc3)CC2)cn1	ZINC000353387650	456666184	/nfs/dbraw/zinc/66/61/84/456666184.db2.gz	ZFYPJTJQMABJMJ-UHFFFAOYSA-N	0	3	348.494	3.402	20	30		EGEDHN
Cc1cccn2c(=O)cc(CN(Cc3ccc(C#N)cc3)C(C)C)nc12	ZINC000299380057	456673901	/nfs/dbraw/zinc/67/39/01/456673901.db2.gz	NPZDLNWTLYOISF-UHFFFAOYSA-N	0	3	346.434	3.285	20	30		EGEDHN
CO[C@@H]1CCCC[C@@H]1N[C@H](C)C(=O)N(CCC#N)c1ccc(F)cc1	ZINC000277083332	456675292	/nfs/dbraw/zinc/67/52/92/456675292.db2.gz	YFEQNQPQIWLINT-FHLIZLRMSA-N	0	3	347.434	3.008	20	30		EGEDHN
C=CCN1CCC(NC(=O)CCOc2ccc3ccccc3c2)CC1	ZINC000291569544	456683661	/nfs/dbraw/zinc/68/36/61/456683661.db2.gz	SRKNFRDEESDEMQ-UHFFFAOYSA-N	0	3	338.451	3.375	20	30		EGEDHN
COc1cc(NC(C)=O)ccc1[C@H](C)NCCc1cccc(C#N)c1	ZINC000343528807	456685597	/nfs/dbraw/zinc/68/55/97/456685597.db2.gz	BUJIOBZECJHWBM-AWEZNQCLSA-N	0	3	337.423	3.419	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)NCc1oc(CC)nc1C)C(C)C	ZINC000291597620	456690282	/nfs/dbraw/zinc/69/02/82/456690282.db2.gz	IERZSBOHNDOYEO-MRXNPFEDSA-N	0	3	348.491	3.043	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@H](NC[C@H]1CN(Cc3ccccc3)CCO1)CC2	ZINC000353426631	456693097	/nfs/dbraw/zinc/69/30/97/456693097.db2.gz	NDZVEKSRKAYRHR-RBBKRZOGSA-N	0	3	347.462	3.036	20	30		EGEDHN
N#Cc1cccc(NC(=O)CN[C@@H]2CCC[C@@H]2OCc2ccccc2)c1	ZINC000348520352	456732087	/nfs/dbraw/zinc/73/20/87/456732087.db2.gz	JFHKYVWUWKZUNX-UXHICEINSA-N	0	3	349.434	3.224	20	30		EGEDHN
CN(C)C[C@H](NC(=O)Nc1ccc(C#N)c(F)c1)c1ccc(F)cc1	ZINC000353524172	456735334	/nfs/dbraw/zinc/73/53/34/456735334.db2.gz	SKSMAYRFVXXZTG-KRWDZBQOSA-N	0	3	344.365	3.261	20	30		EGEDHN
CC[C@H](N[C@@H](C)C(=O)N[C@@](C)(C#N)C(C)C)c1ccc(OC)cc1	ZINC000340897812	456748003	/nfs/dbraw/zinc/74/80/03/456748003.db2.gz	KDNJLZPOBQGTDX-FNHZYXHNSA-N	0	3	331.460	3.179	20	30		EGEDHN
CCCN1CCC[C@@H]1C(=O)N[C@H]1CCN(C(C)=O)c2ccccc21	ZINC000328800101	456764599	/nfs/dbraw/zinc/76/45/99/456764599.db2.gz	HXGGZNQJVQUOJS-FUHWJXTLSA-N	0	3	329.444	3.315	20	30		EGEDHN
O=C(N[C@@H]1CCCN(Cc2ccccc2)C1)[C@H]1CCn2cncc2C1	ZINC000328922708	456792152	/nfs/dbraw/zinc/79/21/52/456792152.db2.gz	COXOQQXOKXSBEZ-ZWKOTPCHSA-N	0	3	338.455	3.067	20	30		EGEDHN
O=C(CN[C@H]1CCC(=O)N[C@H]1C1CC1)Nc1nc2c(s1)CCCC2	ZINC000328930633	456794276	/nfs/dbraw/zinc/79/42/76/456794276.db2.gz	ZDDRZRKGDASOKJ-LRDDRELGSA-N	0	3	348.472	3.097	20	30		EGEDHN
C=C(C)CN1CCC(Nc2nc(-c3ccncc3)nc3c2CCC3)CC1	ZINC000301154197	456809057	/nfs/dbraw/zinc/80/90/57/456809057.db2.gz	CBTMOYWNKVHFPT-UHFFFAOYSA-N	0	3	349.482	3.480	20	30		EGEDHN
CC[C@](C)(C#N)C(=O)N1CC[C@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000353647088	456828563	/nfs/dbraw/zinc/82/85/63/456828563.db2.gz	GDJBMGGQSUFAAJ-NHCUHLMSSA-N	0	3	339.483	3.441	20	30		EGEDHN
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H]2CC[C@H](C)O2)cc1	ZINC000329089502	456832564	/nfs/dbraw/zinc/83/25/64/456832564.db2.gz	ILVUSZLIGMWUKE-WBAXXEDZSA-N	0	3	332.444	3.356	20	30		EGEDHN
C[C@@H]1CCN(CC(=O)NCc2ccc3c(c2)OCO3)CC12CCC2	ZINC000329161711	456845586	/nfs/dbraw/zinc/84/55/86/456845586.db2.gz	ZEAWXLWCLXJWBY-CQSZACIVSA-N	0	3	330.428	3.384	20	30		EGEDHN
COc1ccc(CN[C@@H]2C[C@@H](OC)C2(C)C)cc1OCCCC#N	ZINC000344700566	456848999	/nfs/dbraw/zinc/84/89/99/456848999.db2.gz	QSYFWCULIMBVIG-QZTJIDSGSA-N	0	3	332.444	3.281	20	30		EGEDHN
C=C(C)Cn1c(C2CC2)nnc1N1CCN(CCC(C)(C)C)CC1	ZINC000338843638	456862828	/nfs/dbraw/zinc/86/28/28/456862828.db2.gz	CYZNQZCUFBJZEM-UHFFFAOYSA-N	0	3	331.508	3.290	20	30		EGEDHN
O=C(CCc1ncc[nH]1)NCC1(N2CCSCC2)CCCCC1	ZINC000329274339	456865019	/nfs/dbraw/zinc/86/50/19/456865019.db2.gz	JGVUWLLVJZOWCD-UHFFFAOYSA-N	0	3	336.505	3.051	20	30		EGEDHN
C[C@H](NC(=O)CSc1nccn1C(C)(C)C)C1=CCN(C)CC1	ZINC000329301338	456869033	/nfs/dbraw/zinc/86/90/33/456869033.db2.gz	MXCDKENXGDCCIK-ZDUSSCGKSA-N	0	3	336.505	3.337	20	30		EGEDHN
Cn1cc2c(n1)CCC[C@@H]2C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000329310010	456870377	/nfs/dbraw/zinc/87/03/77/456870377.db2.gz	ZIAXNFMXKCZGMN-IRXDYDNUSA-N	0	3	338.455	3.071	20	30		EGEDHN
C[C@@H](NC(=O)COc1cccc2c1OC(C)(C)C2)C1=CCN(C)CC1	ZINC000329339328	456875781	/nfs/dbraw/zinc/87/57/81/456875781.db2.gz	NPHBFVAJMKWEBP-CQSZACIVSA-N	0	3	344.455	3.386	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C	ZINC000341578227	456878592	/nfs/dbraw/zinc/87/85/92/456878592.db2.gz	VMNMMOAYJJROEQ-SFHVURJKSA-N	0	3	343.496	3.429	20	30		EGEDHN
COC(=O)c1cccc(CNCc2cccc(OCCCC#N)c2)c1	ZINC000348917904	456888203	/nfs/dbraw/zinc/88/82/03/456888203.db2.gz	AAHHJOBBRHKWHX-UHFFFAOYSA-N	0	3	338.407	3.446	20	30		EGEDHN
CN(CC(=O)NC(=O)NC1CC1)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1	ZINC000329462757	456895137	/nfs/dbraw/zinc/89/51/37/456895137.db2.gz	TVEHXCMORMMQSA-HZPDHXFCSA-N	0	3	349.406	3.011	20	30		EGEDHN
CCN1CCC(NC(=O)N2CCCCC[C@H]2c2c(C)n[nH]c2C)CC1	ZINC000329529574	456905066	/nfs/dbraw/zinc/90/50/66/456905066.db2.gz	VGNLXKCGZVQAJE-KRWDZBQOSA-N	0	3	347.507	3.342	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CN1C(=O)N[C@@H](c2ccsc2)C1=O)C(C)C	ZINC000349234810	456919310	/nfs/dbraw/zinc/91/93/10/456919310.db2.gz	RBKXFNFETZCVDS-HOTGVXAUSA-N	0	3	347.484	3.040	20	30		EGEDHN
COc1ccc(CCCN(C)[C@H](C)C(=O)N[C@@](C)(C#N)C(C)C)cc1	ZINC000345093065	456923281	/nfs/dbraw/zinc/92/32/81/456923281.db2.gz	RTVLHVUWDLAKOA-UZLBHIALSA-N	0	3	345.487	3.003	20	30		EGEDHN
C=CC[C@H](C)[C@@H](C)[NH2+]Cc1cccc(-c2n[n-]c(C(=O)OCC)n2)c1	ZINC000349254660	456925296	/nfs/dbraw/zinc/92/52/96/456925296.db2.gz	ZYJFWQLKFXKMNV-UONOGXRCSA-N	0	3	342.443	3.339	20	30		EGEDHN
O=C(N[C@@H]1CCc2nc[nH]c2C1)N[C@H]1CCSc2ccccc21	ZINC000329701056	456930051	/nfs/dbraw/zinc/93/00/51/456930051.db2.gz	HFIHYTHGDCOIJM-YPMHNXCESA-N	0	3	328.441	3.008	20	30		EGEDHN
O=C(N[C@@H]1CCc2[nH]cnc2C1)N[C@H]1CCSc2ccccc21	ZINC000329701056	456930055	/nfs/dbraw/zinc/93/00/55/456930055.db2.gz	HFIHYTHGDCOIJM-YPMHNXCESA-N	0	3	328.441	3.008	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)[C@@H]2CCCCN2C(=O)c2cccs2)CCN1C	ZINC000329703759	456930174	/nfs/dbraw/zinc/93/01/74/456930174.db2.gz	ILLZJKCXIHKIJP-KFWWJZLASA-N	0	3	349.500	3.182	20	30		EGEDHN
CC[C@@H]1C[C@@H](C(=O)NCC2(N(C)C)Cc3ccccc3C2)CC(=O)N1	ZINC000329757366	456936517	/nfs/dbraw/zinc/93/65/17/456936517.db2.gz	MWQRVZBWVBNDPT-IAGOWNOFSA-N	0	3	343.471	3.187	20	30		EGEDHN
Cc1cc(CCNC(=O)N2CCCC23CCN(C)CC3)cc(C)c1O	ZINC000329871535	456954332	/nfs/dbraw/zinc/95/43/32/456954332.db2.gz	COGXXVQHQGQICA-UHFFFAOYSA-N	0	3	345.487	3.026	20	30		EGEDHN
CC(C)(CCC#N)CNC(=O)NC[C@@H](c1ccccc1)N1CCCC1	ZINC000349381576	456959164	/nfs/dbraw/zinc/95/91/64/456959164.db2.gz	IVOVIJBAUXLVRV-SFHVURJKSA-N	0	3	342.487	3.453	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@@H](Nc2ncc([N+](=O)[O-])cc2C#N)C1	ZINC000341925901	457005899	/nfs/dbraw/zinc/00/58/99/457005899.db2.gz	HSYWLPUYYRMQEE-CZUORRHYSA-N	0	3	337.383	3.109	20	30		EGEDHN
CCCNC(=O)c1cccc(C(=O)N(C)[C@@H](C)C2CCN(C)CC2)c1	ZINC000330567854	457056548	/nfs/dbraw/zinc/05/65/48/457056548.db2.gz	WPYKTZISKNVHKM-HNNXBMFYSA-N	0	3	345.487	3.204	20	30		EGEDHN
CN(C)CCOc1cccc(-c2noc(-c3cc(C#N)cs3)n2)c1	ZINC000356564308	457057557	/nfs/dbraw/zinc/05/75/57/457057557.db2.gz	OKDCMKHIRWWGRI-UHFFFAOYSA-N	0	3	340.408	3.277	20	30		EGEDHN
CC[C@H](C)n1nc(NC(=O)NC[C@H](C)N2CCC(C)CC2)cc1C	ZINC000330693517	457071259	/nfs/dbraw/zinc/07/12/59/457071259.db2.gz	SFCKIKKGDVUYJA-HOCLYGCPSA-N	0	3	335.496	3.031	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H]2CCSc3ccccc32)CC1	ZINC000359414386	457081755	/nfs/dbraw/zinc/08/17/55/457081755.db2.gz	QNWRSKOOOPDJCX-QGZVFWFLSA-N	0	3	330.497	3.423	20	30		EGEDHN
C=CCOc1cccnc1C(=O)NC[C@@H](N[C@@H](C)CC)c1ccco1	ZINC000359569474	457097622	/nfs/dbraw/zinc/09/76/22/457097622.db2.gz	YSDBLWIXXFWWCT-LSDHHAIUSA-N	0	3	343.427	3.099	20	30		EGEDHN
CC#CCCNCc1cn(-c2ccc(Br)cc2)nc1C	ZINC000354177487	457112085	/nfs/dbraw/zinc/11/20/85/457112085.db2.gz	HMXDHLHZKBYBED-UHFFFAOYSA-N	0	3	332.245	3.446	20	30		EGEDHN
CC(C)OCCCN(C)[C@@H](C)C(=O)N(C)C1(C#N)CCC(C)CC1	ZINC000354211335	457132770	/nfs/dbraw/zinc/13/27/70/457132770.db2.gz	WFUQXHRDOWKHNB-HFCFLWKCSA-N	0	3	337.508	3.053	20	30		EGEDHN
C=C(CN[C@@H](C)c1cccc(NS(C)(=O)=O)c1)c1ccccc1	ZINC000346782130	457166656	/nfs/dbraw/zinc/16/66/56/457166656.db2.gz	TVELWKVOSOCNQA-HNNXBMFYSA-N	0	3	330.453	3.422	20	30		EGEDHN
C[C@@H](CC(=O)c1ccccc1)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000350360671	457176670	/nfs/dbraw/zinc/17/66/70/457176670.db2.gz	BRLZMAYKAYNUTO-KXBFYZLASA-N	0	3	345.402	3.018	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CCC[C@@H]1c1cccnc1	ZINC000347001479	457194154	/nfs/dbraw/zinc/19/41/54/457194154.db2.gz	AJWOOFSXMFRFJB-WOJBJXKFSA-N	0	3	338.451	3.387	20	30		EGEDHN
C=CCn1c(-c2ccc(C)s2)nnc1N(C)[C@H]1CCN(C2CC2)C1	ZINC000350753330	457206565	/nfs/dbraw/zinc/20/65/65/457206565.db2.gz	YSZXNFHCVGIZLE-HNNXBMFYSA-N	0	3	343.500	3.174	20	30		EGEDHN
COc1ccc(Br)cc1[C@H]1CCCN1C(=O)C(C)C#N	ZINC000347099653	457228096	/nfs/dbraw/zinc/22/80/96/457228096.db2.gz	DWVOLOTWPHPCGM-ZWNOBZJWSA-N	0	3	337.217	3.281	20	30		EGEDHN
Cc1cc(C(=O)C(C#N)c2ccncn2)c(C)cc1Br	ZINC000354460712	457238546	/nfs/dbraw/zinc/23/85/46/457238546.db2.gz	FQFKXJQRPGBEGP-GFCCVEGCSA-N	0	3	330.185	3.346	20	30		EGEDHN
N#CC(C(=O)c1ccccc1NC(=O)c1cccs1)c1ccncn1	ZINC000354473655	457246533	/nfs/dbraw/zinc/24/65/33/457246533.db2.gz	VVVINLNVPSCGSR-ZDUSSCGKSA-N	0	3	348.387	3.280	20	30		EGEDHN
COc1ccc(C[C@@H](NC(=O)C(C)C#N)c2ccccc2)cc1OC	ZINC000347131294	457247034	/nfs/dbraw/zinc/24/70/34/457247034.db2.gz	IXWXFSVQDZVRBH-WMLDXEAASA-N	0	3	338.407	3.263	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N[C@@H]1CCN(C2CC2)C1)c1ccc(F)c(F)c1	ZINC000357066560	457306175	/nfs/dbraw/zinc/30/61/75/457306175.db2.gz	CJMOZUBSLPHMGI-DYVFJYSZSA-N	0	3	335.398	3.118	20	30		EGEDHN
CC(C)(C)N1C[C@H](C(=O)N(CCC#N)CC2CC2)[C@H](C(F)(F)F)C1	ZINC000339931607	457316014	/nfs/dbraw/zinc/31/60/14/457316014.db2.gz	MXIYMMXIQWNICG-UONOGXRCSA-N	0	3	345.409	3.047	20	30		EGEDHN
C=C(C)COc1cc(CN2CC[C@@H](C(=O)OC)[C@H]2C)ccc1OC	ZINC000347258330	457316383	/nfs/dbraw/zinc/31/63/83/457316383.db2.gz	BIEGDUSBUSJXJR-GDBMZVCRSA-N	0	3	333.428	3.034	20	30		EGEDHN
CCOC(=O)c1ccc(C(=O)C(C#N)c2nc3ccccc3n2C)cc1	ZINC000355112407	457342538	/nfs/dbraw/zinc/34/25/38/457342538.db2.gz	GNISVFNROHSDGP-OAHLLOKOSA-N	0	3	347.374	3.240	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CC[C@H](N(C)Cc2ccccc2)C1)OCC	ZINC000360777284	457346826	/nfs/dbraw/zinc/34/68/26/457346826.db2.gz	XSVQUCYYWBHAOM-OALUTQOASA-N	0	3	330.472	3.091	20	30		EGEDHN
C[C@@H](N[C@@H](C)C(=O)N(C)CCC#N)c1ccc(F)c2ccccc21	ZINC000352249011	457352151	/nfs/dbraw/zinc/35/21/51/457352151.db2.gz	FTGFHXJDKQQFIR-KGLIPLIRSA-N	0	3	327.403	3.390	20	30		EGEDHN
C=CCNC(=O)NC(=O)[C@@H](C)N[C@H](C)c1ccc(F)c2ccccc21	ZINC000352277427	457353470	/nfs/dbraw/zinc/35/34/70/457353470.db2.gz	BXGYZWGEQWBNDL-CHWSQXEVSA-N	0	3	343.402	3.030	20	30		EGEDHN
CSC1(CNC(=O)C[C@@H](CC#N)c2ccccc2)CCN(C)CC1	ZINC000355447259	457373839	/nfs/dbraw/zinc/37/38/39/457373839.db2.gz	SCGOQZDSYPOTLT-QGZVFWFLSA-N	0	3	345.512	3.018	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@H](CN(C)Cc3cccnc3)C2)CC1	ZINC000356069972	457444872	/nfs/dbraw/zinc/44/48/72/457444872.db2.gz	SMQVKVJNAJEHNX-GOSISDBHSA-N	0	3	327.472	3.108	20	30		EGEDHN
CCCCCCCC(=O)N1CCC(C)(CN2CCN(C)CC2)CC1	ZINC000363832165	457455130	/nfs/dbraw/zinc/45/51/30/457455130.db2.gz	OZAIGZCWERCJBW-UHFFFAOYSA-N	0	3	337.552	3.223	20	30		EGEDHN
Cc1oc(Br)cc1C(=O)C(C#N)c1cc(C)nc(C)n1	ZINC000425279029	457480487	/nfs/dbraw/zinc/48/04/87/457480487.db2.gz	ZTYDMVRXFRHLIV-LLVKDONJSA-N	0	3	334.173	3.247	20	30		EGEDHN
C[C@@H](NCCN1CCCC1=O)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000369984350	457487675	/nfs/dbraw/zinc/48/76/75/457487675.db2.gz	LAEYNUHAJSLTFB-MRXNPFEDSA-N	0	3	333.435	3.498	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NC1CCN(Cc2cccc(C)c2)CC1	ZINC000364124468	457489494	/nfs/dbraw/zinc/48/94/94/457489494.db2.gz	ZCESBLNZCYICQC-NRFANRHFSA-N	0	3	344.499	3.304	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C1(C#N)CCCCC1	ZINC000398162625	457496362	/nfs/dbraw/zinc/49/63/62/457496362.db2.gz	LIYRTRMEWLEUTH-IEBWSBKVSA-N	0	3	339.483	3.487	20	30		EGEDHN
CN1CCC[C@@]2(CCN(C(=O)C[C@H](CC#N)c3ccccc3)C2)C1	ZINC000356243459	457549498	/nfs/dbraw/zinc/54/94/98/457549498.db2.gz	BZWQLTSJFPFHIN-AZUAARDMSA-N	0	3	325.456	3.018	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@@H](C)N[C@H](C)c1ccc(OC)c(OC)c1C	ZINC000347638435	457567728	/nfs/dbraw/zinc/56/77/28/457567728.db2.gz	JNQQARGRIGZTLD-HZPDHXFCSA-N	0	3	346.471	3.252	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)C(=O)N[C@@H](C)CN1CCC[C@@H](C)C1	ZINC000425474611	457569361	/nfs/dbraw/zinc/56/93/61/457569361.db2.gz	LHBVPRQIXCQWPL-IXDOHACOSA-N	0	3	342.487	3.381	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)N[C@@H]2CC[C@H](C#N)C2)CCN1Cc1ccccc1	ZINC000425497012	457577303	/nfs/dbraw/zinc/57/73/03/457577303.db2.gz	WEZXTLIVBQHFMQ-KANFNMMFSA-N	0	3	340.471	3.031	20	30		EGEDHN
CCCCCCCCC(=O)N1CC[C@H](N2CCN(C)CC2)[C@@H](C)C1	ZINC000374316848	457582189	/nfs/dbraw/zinc/58/21/89/457582189.db2.gz	JABABJDAKFWBIU-OALUTQOASA-N	0	3	337.552	3.221	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N(C)C[C@H](O)COCc1cccs1	ZINC000425538148	457590126	/nfs/dbraw/zinc/59/01/26/457590126.db2.gz	ROXJPMQFTJLTEL-YOEHRIQHSA-N	0	3	330.453	3.190	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)CCc1nc2ccccc2c(=O)[nH]1	ZINC000425539353	457590171	/nfs/dbraw/zinc/59/01/71/457590171.db2.gz	UBICSSCNYMVJNO-CQSZACIVSA-N	0	3	332.407	3.443	20	30		EGEDHN
CCc1cnccc1[C@H](C)NCCC(=O)Nc1sccc1C#N	ZINC000361132166	457601731	/nfs/dbraw/zinc/60/17/31/457601731.db2.gz	NZGVKBMKFZZAHZ-LBPRGKRZSA-N	0	3	328.441	3.257	20	30		EGEDHN
CCc1cnccc1[C@H](C)NCCOc1ccc(C#N)cc1OC	ZINC000361135647	457604448	/nfs/dbraw/zinc/60/44/48/457604448.db2.gz	MXOYZFIKQUMBKM-AWEZNQCLSA-N	0	3	325.412	3.254	20	30		EGEDHN
CN(Cc1ccc2c(c1)OCO2)C(=O)C(C#N)CCc1ccccc1	ZINC000433113651	457760253	/nfs/dbraw/zinc/76/02/53/457760253.db2.gz	LPZPUFVICIMLFY-QGZVFWFLSA-N	0	3	336.391	3.146	20	30		EGEDHN
CN(CC#Cc1ccc(OC(F)(F)F)cc1)[C@@H]1CCCC[C@H]1O	ZINC000426206731	457787890	/nfs/dbraw/zinc/78/78/90/457787890.db2.gz	RDYNEIWFXYAZBF-HZPDHXFCSA-N	0	3	327.346	3.172	20	30		EGEDHN
CC1(C)CN(C(=O)C(C#N)CCc2ccccc2)[C@@H]1[C@H]1CCCO1	ZINC000426238644	457793163	/nfs/dbraw/zinc/79/31/63/457793163.db2.gz	LNPUHXIYSQHRRY-RCCFBDPRSA-N	0	3	326.440	3.175	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1)C(=O)[C@@H](C#N)CCc1ccccc1	ZINC000433320795	457810308	/nfs/dbraw/zinc/81/03/08/457810308.db2.gz	VTYKVJJDBCDSBQ-OAQYLSRUSA-N	0	3	349.478	3.349	20	30		EGEDHN
CN(C)[C@@H](CC(=O)N(CCC#N)Cc1ccco1)c1ccccc1	ZINC000433343827	457815745	/nfs/dbraw/zinc/81/57/45/457815745.db2.gz	PKHSYUAQBCWRJE-SFHVURJKSA-N	0	3	325.412	3.215	20	30		EGEDHN
CC(=O)Nc1ccc(CCNC(=O)C(C#N)CCc2ccccc2)cc1	ZINC000433350822	457818513	/nfs/dbraw/zinc/81/85/13/457818513.db2.gz	GFEUJCPJLPIXJC-IBGZPJMESA-N	0	3	349.434	3.076	20	30		EGEDHN
CCc1ccc([C@H](COC)NC(=O)C(C#N)CCc2ccccc2)o1	ZINC000433369920	457823166	/nfs/dbraw/zinc/82/31/66/457823166.db2.gz	AXOUVTXPJDJLGX-AEFFLSMTSA-N	0	3	340.423	3.418	20	30		EGEDHN
Cc1cccc2nc(CNC(=O)C(C#N)CCc3ccccc3)n(C)c21	ZINC000433370444	457823557	/nfs/dbraw/zinc/82/35/57/457823557.db2.gz	GNIZFSNEJVEWLY-QGZVFWFLSA-N	0	3	346.434	3.271	20	30		EGEDHN
C[C@H](CNC(=O)C(C#N)CCc1ccccc1)Oc1ccc(F)cc1	ZINC000433380805	457826178	/nfs/dbraw/zinc/82/61/78/457826178.db2.gz	FOZKSRCZMJLZLH-WBVHZDCISA-N	0	3	340.398	3.482	20	30		EGEDHN
Cc1cc(CN[C@@H]2CC(=O)N(c3ccccc3Cl)C2)ccc1C#N	ZINC000443967113	457831822	/nfs/dbraw/zinc/83/18/22/457831822.db2.gz	TXTGFMNWGDALPO-MRXNPFEDSA-N	0	3	339.826	3.415	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H]2CN(Cc3cccc(C#N)c3)CC[C@@H]21	ZINC000366536860	457842540	/nfs/dbraw/zinc/84/25/40/457842540.db2.gz	ZNNDISRFMHLJPN-ROUUACIJSA-N	0	3	341.455	3.390	20	30		EGEDHN
C[C@H](CN[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1)S(C)(=O)=O	ZINC000411503209	457904038	/nfs/dbraw/zinc/90/40/38/457904038.db2.gz	KCRJVXCIZRNSNE-CABCVRRESA-N	0	3	342.464	3.309	20	30		EGEDHN
C=CCN1CC[C@H](N2CCC(c3c(C)[nH]c4ccccc43)CC2)C1=O	ZINC000366890468	457905993	/nfs/dbraw/zinc/90/59/93/457905993.db2.gz	DQVYIWRJOIHCOI-IBGZPJMESA-N	0	3	337.467	3.443	20	30		EGEDHN
C=CCC[C@@H](C(=O)N1CCC(OCCN(C)C)CC1)c1ccccc1	ZINC000426821803	457910787	/nfs/dbraw/zinc/91/07/87/457910787.db2.gz	WTJXRRJDEHYSSO-HXUWFJFHSA-N	0	3	344.499	3.306	20	30		EGEDHN
C#C[C@H](NC(=O)NC[C@H]1CCCN(C)[C@H]1c1cccs1)C(C)C	ZINC000366999663	457919435	/nfs/dbraw/zinc/91/94/35/457919435.db2.gz	XUWFEFSTTRRJTJ-HLLBOEOZSA-N	0	3	333.501	3.088	20	30		EGEDHN
CC1(C)CCCN(C(=O)[C@H]2CCCN(Cc3ccccc3)C2)[C@@H]1C#N	ZINC000434032357	457934116	/nfs/dbraw/zinc/93/41/16/457934116.db2.gz	REKGMKQLZWJYLV-RBUKOAKNSA-N	0	3	339.483	3.439	20	30		EGEDHN
C=CCC1(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)CCC1	ZINC000358342328	457945127	/nfs/dbraw/zinc/94/51/27/457945127.db2.gz	VDXXAGUSFAKIFM-UHFFFAOYSA-N	0	3	328.456	3.328	20	30		EGEDHN
CN(C)c1noc([C@@H]2CCCN(CCC3(C#N)CCCCC3)C2)n1	ZINC000411685237	457950452	/nfs/dbraw/zinc/95/04/52/457950452.db2.gz	ALBASANVGUTKLT-OAHLLOKOSA-N	0	3	331.464	3.179	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)Nc1ccc(OCCN(C)C)c(C)c1	ZINC000458220103	457975166	/nfs/dbraw/zinc/97/51/66/457975166.db2.gz	SIJCAANDIVTHIM-IBGZPJMESA-N	0	3	334.460	3.103	20	30		EGEDHN
CC(C)(C(=O)N1CCC[C@@H](N2CCCC2)C1)c1cc(F)cc(C#N)c1	ZINC000375666072	458010070	/nfs/dbraw/zinc/01/00/70/458010070.db2.gz	PGYFWHAHWXELBY-GOSISDBHSA-N	0	3	343.446	3.062	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2[C@H](C)[C@H](CC(F)(F)F)C[C@@H]2C)CC1	ZINC000458331033	458014406	/nfs/dbraw/zinc/01/44/06/458014406.db2.gz	HNDNOPSGPAWRSQ-MJBXVCDLSA-N	0	3	347.425	3.398	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](C)CCCc2cccnc2)CC1	ZINC000458328008	458014764	/nfs/dbraw/zinc/01/47/64/458014764.db2.gz	WVPWARSRAGVBSA-QGZVFWFLSA-N	0	3	344.503	3.133	20	30		EGEDHN
N#Cc1ccc(CNC2(C3CC3)CCOCC2)c(Br)c1	ZINC000375697006	458025239	/nfs/dbraw/zinc/02/52/39/458025239.db2.gz	JTRBGTOMXFQQLO-UHFFFAOYSA-N	0	3	335.245	3.370	20	30		EGEDHN
N#CC(C(=O)c1cccc2c1OCCO2)c1cc(C(F)(F)F)ccn1	ZINC000362129684	458032455	/nfs/dbraw/zinc/03/24/55/458032455.db2.gz	NJOUUSONRCUEGT-GFCCVEGCSA-N	0	3	348.280	3.362	20	30		EGEDHN
C=C(C)CNC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1	ZINC000428108239	458081629	/nfs/dbraw/zinc/08/16/29/458081629.db2.gz	QPRCZPMVKZVLKU-INIZCTEOSA-N	0	3	326.362	3.133	20	30		EGEDHN
C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)c1cccc(SCC#N)c1	ZINC000375822481	458081909	/nfs/dbraw/zinc/08/19/09/458081909.db2.gz	FHFAQRWNWYJDIW-GDBMZVCRSA-N	0	3	329.469	3.001	20	30		EGEDHN
C=CCSc1ccccc1C(=O)N1C[C@H](SC)[C@@H](N(C)C)C1	ZINC000362402512	458155435	/nfs/dbraw/zinc/15/54/35/458155435.db2.gz	MPKZWWAWUYSUSM-HOCLYGCPSA-N	0	3	336.526	3.082	20	30		EGEDHN
CCCN(CCN1CCCCC1)C(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1	ZINC000412337808	458174044	/nfs/dbraw/zinc/17/40/44/458174044.db2.gz	MVKXDZVDQAQGLR-VQTJNVASSA-N	0	3	339.483	3.386	20	30		EGEDHN
C=CCOc1ccccc1CN[C@H]1CC[C@@H](C(=O)N2CCCC2)C1	ZINC000435740544	458194961	/nfs/dbraw/zinc/19/49/61/458194961.db2.gz	KVPJKALCAMJLNC-AEFFLSMTSA-N	0	3	328.456	3.132	20	30		EGEDHN
COC(=O)[C@@]1(c2ccccc2)CCN(Cc2ccc(C#N)c(C)c2)C1	ZINC000428803187	458214775	/nfs/dbraw/zinc/21/47/75/458214775.db2.gz	FMDRFEIFJRHIDB-NRFANRHFSA-N	0	3	334.419	3.183	20	30		EGEDHN
COC(=O)[C@@](C)(CN[C@@H](C)c1cccc(C#N)c1)c1ccc(F)cc1	ZINC000447017703	458256845	/nfs/dbraw/zinc/25/68/45/458256845.db2.gz	PLJJOHYIINFUCK-XOBRGWDASA-N	0	3	340.398	3.479	20	30		EGEDHN
Cn1cc(C(=O)C(C#N)c2nc3ccccc3o2)c2ccccc2c1=O	ZINC000429104519	458272840	/nfs/dbraw/zinc/27/28/40/458272840.db2.gz	FWWYMRDZKNHJQL-AWEZNQCLSA-N	0	3	343.342	3.170	20	30		EGEDHN
CN(C)C[C@@H](NC(=O)NCC(C)(C)CC#N)c1ccc(Cl)cc1	ZINC000459234932	458296866	/nfs/dbraw/zinc/29/68/66/458296866.db2.gz	KDSOYWWDYVKSQH-OAHLLOKOSA-N	0	3	336.867	3.182	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@H]2CN(C)CC[C@@H]21	ZINC000413824182	458308182	/nfs/dbraw/zinc/30/81/82/458308182.db2.gz	CATCXLLWOVOKOS-ZCNNSNEGSA-N	0	3	341.499	3.300	20	30		EGEDHN
C=C(C)[C@H](CC(=O)Nc1ccc(OCCN(C)C)cc1F)OCC	ZINC000413896353	458311705	/nfs/dbraw/zinc/31/17/05/458311705.db2.gz	BWNJJYCTEGEGIA-KRWDZBQOSA-N	0	3	338.423	3.076	20	30		EGEDHN
C[C@@H](c1ccc(C#N)cc1)N1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000376480609	458314276	/nfs/dbraw/zinc/31/42/76/458314276.db2.gz	ZWEDPWFWAKHZNI-ZDUSSCGKSA-N	0	3	325.372	3.061	20	30		EGEDHN
COc1ccc([C@@H](CO)CN[C@@H](C)c2ccc(C#N)c(F)c2)cc1	ZINC000414177065	458315983	/nfs/dbraw/zinc/31/59/83/458315983.db2.gz	JLCDCFNLSRPQPD-SUMWQHHRSA-N	0	3	328.387	3.133	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NC(=O)Nc1cc(CN)cc(C(F)(F)F)c1	ZINC000415970032	458335472	/nfs/dbraw/zinc/33/54/72/458335472.db2.gz	LECDNMRKENFWHM-KGLIPLIRSA-N	0	3	343.349	3.019	20	30		EGEDHN
CC(C)c1ccc([C@@H](N)CNC(=O)NCC#Cc2ccccc2)cc1	ZINC000416955366	458358367	/nfs/dbraw/zinc/35/83/67/458358367.db2.gz	XIAIWJKKQDAUKG-FQEVSTJZSA-N	0	3	335.451	3.161	20	30		EGEDHN
C=CCN(C)CCN(CC)CC(=O)Nc1cccc2ccccc21	ZINC000429705448	458359831	/nfs/dbraw/zinc/35/98/31/458359831.db2.gz	AYRKKRWTZFWHHD-UHFFFAOYSA-N	0	3	325.456	3.218	20	30		EGEDHN
C[C@H](N[C@H]1CCCc2cc(C#N)ccc21)c1ccc(-n2cnnn2)cc1	ZINC000417360050	458362382	/nfs/dbraw/zinc/36/23/82/458362382.db2.gz	HKZXVLCUIAQMRZ-XOBRGWDASA-N	0	3	344.422	3.262	20	30		EGEDHN
C[C@@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1cccc(C#N)c1	ZINC000436714536	458365992	/nfs/dbraw/zinc/36/59/92/458365992.db2.gz	MMPFOANATUIQHR-OAHLLOKOSA-N	0	3	349.434	3.219	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)NCc1ccc2c(c1)CNC2	ZINC000418547347	458375176	/nfs/dbraw/zinc/37/51/76/458375176.db2.gz	AOCYCANPEIWQKY-UHFFFAOYSA-N	0	3	327.453	3.249	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](CC(F)F)c2ccccc2)CC1	ZINC000420918575	458404248	/nfs/dbraw/zinc/40/42/48/458404248.db2.gz	PZUWVJLOIOOZAI-INIZCTEOSA-N	0	3	337.414	3.333	20	30		EGEDHN
C[C@](C#N)(NC(=O)CN1CC[C@@H](c2ccccc2)C1(C)C)C1CC1	ZINC000421013197	458405901	/nfs/dbraw/zinc/40/59/01/458405901.db2.gz	FYXBHRVKWMCOPN-FXAWDEMLSA-N	0	3	325.456	3.063	20	30		EGEDHN
COc1ccccc1NC(=O)C[C@@H](C)NCc1ccc(C#N)s1	ZINC000421347864	458411466	/nfs/dbraw/zinc/41/14/66/458411466.db2.gz	DNVMPADWNYSAKX-GFCCVEGCSA-N	0	3	329.425	3.135	20	30		EGEDHN
N#Cc1ccc(CN[C@H](Cc2ccccc2)[C@H](O)C(F)F)cc1F	ZINC000421368459	458412061	/nfs/dbraw/zinc/41/20/61/458412061.db2.gz	UZXKMUFDUWYMTM-SJORKVTESA-N	0	3	334.341	3.024	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Cc2cccc(OC/C=C\C)c2)CC1	ZINC000448923725	458415778	/nfs/dbraw/zinc/41/57/78/458415778.db2.gz	VRVGEKDHVHUTSO-PLNGDYQASA-N	0	3	342.483	3.341	20	30		EGEDHN
CC(C)(C)O[C@@H]1C[C@@H](NCc2ccc(C#N)s2)[C@@H]1n1cccn1	ZINC000449657169	458428734	/nfs/dbraw/zinc/42/87/34/458428734.db2.gz	NWYNTCBXMIFRNG-OAGGEKHMSA-N	0	3	330.457	3.103	20	30		EGEDHN
C=C(CC)CNCc1ccc(Br)cc1N1CCOCC1	ZINC000449733657	458429830	/nfs/dbraw/zinc/42/98/30/458429830.db2.gz	JCPGPWFAZGEZSW-UHFFFAOYSA-N	0	3	339.277	3.342	20	30		EGEDHN
C=CCc1cc(CN2CCC[C@H](c3nccn3C)C2)cc(OC)c1O	ZINC000373227094	458436575	/nfs/dbraw/zinc/43/65/75/458436575.db2.gz	JETOYJCMKRUKOF-KRWDZBQOSA-N	0	3	341.455	3.242	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)CN(C)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000459669801	458442435	/nfs/dbraw/zinc/44/24/35/458442435.db2.gz	DXDPWCZQEKBMLY-GGPKGHCWSA-N	0	3	327.472	3.309	20	30		EGEDHN
COCCN(Cc1ccc(C#N)cc1)C[C@@H](O)[C@@H](C)c1ccccc1	ZINC000450312847	458445656	/nfs/dbraw/zinc/44/56/56/458445656.db2.gz	JFULNAAISGXNKG-LAUBAEHRSA-N	0	3	338.451	3.171	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1S[C@H]1CC[C@@H](C#N)C1	ZINC000450743781	458456166	/nfs/dbraw/zinc/45/61/66/458456166.db2.gz	JEOUCXGUDXXXAZ-CVEARBPZSA-N	0	3	345.516	3.277	20	30		EGEDHN
C[C@H](c1ccccc1)[C@@H](O)CN(C)CCOCc1ccc(C#N)cc1	ZINC000451037421	458464033	/nfs/dbraw/zinc/46/40/33/458464033.db2.gz	OZTSLVGWLTVROH-UTKZUKDTSA-N	0	3	338.451	3.171	20	30		EGEDHN
N#Cc1csc(C(=O)NC[C@H]2CCCN2CC2CCCCC2)c1	ZINC000437562009	458466684	/nfs/dbraw/zinc/46/66/84/458466684.db2.gz	WGEAVCUCKDBGMR-MRXNPFEDSA-N	0	3	331.485	3.394	20	30		EGEDHN
CC[C@@H]1OCC[C@H]1NCC(=O)N(CCC#N)c1ccc(Cl)c(C)c1	ZINC000459781386	458477908	/nfs/dbraw/zinc/47/79/08/458477908.db2.gz	SKALUYVGKLHQIN-SJORKVTESA-N	0	3	349.862	3.052	20	30		EGEDHN
Cc1sc(NC(=O)CN[C@@H]2C[C@@H](OC(C)C)C2(C)C)c(C#N)c1C	ZINC000451509647	458479711	/nfs/dbraw/zinc/47/97/11/458479711.db2.gz	YKWGGJYTPHLCII-HUUCEWRRSA-N	0	3	349.500	3.357	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCC(=O)N[C@H](C)c1ccc(Cl)c(Cl)c1	ZINC000451599171	458482620	/nfs/dbraw/zinc/48/26/20/458482620.db2.gz	NMCWYHSHAPYCAY-KMUNFCNLSA-N	0	3	343.254	3.104	20	30		EGEDHN
N#Cc1ccc(Br)c(CN[C@H]([C@@H](CO)C2CC2)C2CC2)c1	ZINC000451618207	458483472	/nfs/dbraw/zinc/48/34/72/458483472.db2.gz	VQNQKZKRLHCYBG-RDJZCZTQSA-N	0	3	349.272	3.207	20	30		EGEDHN
CCOC(=O)[C@@H]1CCC[C@@H]1NCC#Cc1ccc(C(F)(F)F)cc1	ZINC000451775012	458487211	/nfs/dbraw/zinc/48/72/11/458487211.db2.gz	PXBODLYHDSGHSE-CVEARBPZSA-N	0	3	339.357	3.378	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN1CCN([C@H](C)CC)CC1	ZINC000451821835	458488223	/nfs/dbraw/zinc/48/82/23/458488223.db2.gz	ICSBYIZBWCRMMI-MRXNPFEDSA-N	0	3	347.528	3.319	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCOC[C@@H]1[C@H]1CCCN1C(=O)OC(C)(C)C	ZINC000373422616	458488343	/nfs/dbraw/zinc/48/83/43/458488343.db2.gz	OOUCXCBTALJHRH-RRFJBIMHSA-N	0	3	344.883	3.133	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCC[C@H]2CCc3ccccc32)cc1	ZINC000452314845	458498593	/nfs/dbraw/zinc/49/85/93/458498593.db2.gz	LOKOFPRLBDLRHY-UXHICEINSA-N	0	3	343.430	3.477	20	30		EGEDHN
CC(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)c2ccccc2C1	ZINC000453375150	458526290	/nfs/dbraw/zinc/52/62/90/458526290.db2.gz	HPFFMOQFOXJEMS-HXUWFJFHSA-N	0	3	337.398	3.280	20	30		EGEDHN
C=C(C)Cn1c([C@@H]2CC[C@H](C)O2)nnc1N1C[C@@H](C)N(CC)C[C@@H]1C	ZINC000453462643	458533018	/nfs/dbraw/zinc/53/30/18/458533018.db2.gz	PNHBDOIKXZLLRB-QZWWFDLISA-N	0	3	347.507	3.013	20	30		EGEDHN
COc1ccccc1Oc1ccc(NC(=O)[C@@H](N)CCCC#N)cc1	ZINC000424067378	458548952	/nfs/dbraw/zinc/54/89/52/458548952.db2.gz	VSGUPWJJRWGCKD-INIZCTEOSA-N	0	3	339.395	3.447	20	30		EGEDHN
Cc1ccc(-c2csc(NC(=O)[C@H](N)CCCC#N)n2)cc1C	ZINC000424076518	458551892	/nfs/dbraw/zinc/55/18/92/458551892.db2.gz	MFNOTOGTVKKNOH-CQSZACIVSA-N	0	3	328.441	3.387	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)NCCC(c1ccccc1)c1ccccc1	ZINC000424085809	458555857	/nfs/dbraw/zinc/55/58/57/458555857.db2.gz	ZRUOGGLLQOBIGE-FQEVSTJZSA-N	0	3	335.451	3.346	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)NCC1(c2ccc(Cl)cc2)CCCC1	ZINC000424101285	458558112	/nfs/dbraw/zinc/55/81/12/458558112.db2.gz	JKTADJYPFYMWIR-INIZCTEOSA-N	0	3	333.863	3.289	20	30		EGEDHN
C[C@H](NC(=O)[C@@H](N)CCCC#N)C(c1ccccc1)c1ccccc1	ZINC000424101759	458558640	/nfs/dbraw/zinc/55/86/40/458558640.db2.gz	PKSZTEAEDPDNGT-LPHOPBHVSA-N	0	3	335.451	3.344	20	30		EGEDHN
C=CCn1c(C2CC2)nnc1N1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1	ZINC000424113081	458561020	/nfs/dbraw/zinc/56/10/20/458561020.db2.gz	LWMKXTMAHQNNIQ-RBUKOAKNSA-N	0	3	349.482	3.052	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2C[C@H]3[C@@H]4CC[C@@H](C4)[C@@]3(C)C2)CC1	ZINC000454462224	458563697	/nfs/dbraw/zinc/56/36/97/458563697.db2.gz	KHBVNYOWSDTMBJ-NDUPCHFUSA-N	0	3	331.504	3.105	20	30		EGEDHN
C[C@@H](Cc1c(Cl)cccc1Cl)NC(=O)[C@H](N)CCCC#N	ZINC000424172430	458576538	/nfs/dbraw/zinc/57/65/38/458576538.db2.gz	NXTSRCAYISUYRS-IINYFYTJSA-N	0	3	328.243	3.062	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cccc(-c3ncco3)c2C)CC1	ZINC000455494050	458602325	/nfs/dbraw/zinc/60/23/25/458602325.db2.gz	SZUOVBNQMULDCQ-UHFFFAOYSA-N	0	3	340.427	3.422	20	30		EGEDHN
C[C@H](NC(=O)Nc1ccc(CC#N)cc1Cl)C1=CCN(C)CC1	ZINC000455702315	458607548	/nfs/dbraw/zinc/60/75/48/458607548.db2.gz	KYUFOKDGUZSILS-LBPRGKRZSA-N	0	3	332.835	3.178	20	30		EGEDHN
CCN1CCC[C@H]1CN(C)C(=O)C(C)(C)Cc1ccc(C#N)cc1	ZINC000455826486	458617426	/nfs/dbraw/zinc/61/74/26/458617426.db2.gz	MXIFAUMDTUMTNB-SFHVURJKSA-N	0	3	327.472	3.070	20	30		EGEDHN
CCN1CCC[C@@H]1CN(C)C(=O)C(C)(C)Cc1ccc(C#N)cc1	ZINC000455826485	458617475	/nfs/dbraw/zinc/61/74/75/458617475.db2.gz	MXIFAUMDTUMTNB-GOSISDBHSA-N	0	3	327.472	3.070	20	30		EGEDHN
C[C@@H](C(=O)N[C@@H](CN(C)C)c1ccc(F)cc1)c1cccc(C#N)c1	ZINC000462465975	458622324	/nfs/dbraw/zinc/62/23/24/458622324.db2.gz	MYDSQTIVJOBHPV-KUHUBIRLSA-N	0	3	339.414	3.220	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC000494080029	458624597	/nfs/dbraw/zinc/62/45/97/458624597.db2.gz	YABPFHXIINDGJC-INIZCTEOSA-N	0	3	333.407	3.090	20	30		EGEDHN
CC(C)[C@H](NCC(=O)NCc1cccc(C#N)c1)c1ccc(F)cc1	ZINC000502560629	458657224	/nfs/dbraw/zinc/65/72/24/458657224.db2.gz	RZDCWAQIROGDAY-FQEVSTJZSA-N	0	3	339.414	3.300	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@@H](Cc2ccccc2)C2CC2)cc1	ZINC000470974066	458672706	/nfs/dbraw/zinc/67/27/06/458672706.db2.gz	GVQLCSUWSUPVRL-SFTDATJTSA-N	0	3	343.430	3.378	20	30		EGEDHN
C[C@@H]1CCCC[C@@H]1C(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000424610747	458679304	/nfs/dbraw/zinc/67/93/04/458679304.db2.gz	CCCFRUZCGOBMHP-APWZRJJASA-N	0	3	327.472	3.275	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCC2C3CC4CC(C3)CC2C4)cc1	ZINC000471090830	458679677	/nfs/dbraw/zinc/67/96/77/458679677.db2.gz	NANIBPVCBZRBEA-XIWZRWORSA-N	0	3	347.462	3.429	20	30		EGEDHN
C#CC[C@@H](C)N[C@@H](C)c1ccc(CNC(=O)OC(C)(C)C)nc1C	ZINC000494556682	458698719	/nfs/dbraw/zinc/69/87/19/458698719.db2.gz	XXXQRRGMMXQRHN-KGLIPLIRSA-N	0	3	331.460	3.477	20	30		EGEDHN
C=C(C)CN(CC)C[C@@H](O)COc1cc(F)cc(Br)c1	ZINC000439458612	458705088	/nfs/dbraw/zinc/70/50/88/458705088.db2.gz	SWCQMESLCBFRDP-CQSZACIVSA-N	0	3	346.240	3.226	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCCCOc2cccc(C)c2C)CC1	ZINC000494870408	458759579	/nfs/dbraw/zinc/75/95/79/458759579.db2.gz	HVLFLXXTYGQVDT-UHFFFAOYSA-N	0	3	345.487	3.022	20	30		EGEDHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@@H](C#N)CCc1ccccc1	ZINC000495003344	458781418	/nfs/dbraw/zinc/78/14/18/458781418.db2.gz	HSLOOJDAHJFRFL-WIYYLYMNSA-N	0	3	349.478	3.396	20	30		EGEDHN
N#CC1(CCCN2CCC(Nc3ccccn3)CC2)CCOCC1	ZINC000530568739	458792577	/nfs/dbraw/zinc/79/25/77/458792577.db2.gz	LVEWCJPIKQVIMF-UHFFFAOYSA-N	0	3	328.460	3.058	20	30		EGEDHN
Cc1ccc(C)c(OC[C@H](O)CNCc2ccc(C#N)s2)c1C	ZINC000515347801	458808453	/nfs/dbraw/zinc/80/84/53/458808453.db2.gz	NNIGAQWKRMWPRC-OAHLLOKOSA-N	0	3	330.453	3.075	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccnc(N3CCC[C@H](C)C3)c2)nc(C)n1	ZINC000517004091	458824992	/nfs/dbraw/zinc/82/49/92/458824992.db2.gz	JOFOFCPORRKAPX-SUMWQHHRSA-N	0	3	349.438	3.215	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CCC(OC(C)C)CC1	ZINC000531163979	458881633	/nfs/dbraw/zinc/88/16/33/458881633.db2.gz	IRMLGOCTLWOOSW-GOSISDBHSA-N	0	3	333.472	3.044	20	30		EGEDHN
CC(C)(C#N)c1ccc(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000474431241	458885949	/nfs/dbraw/zinc/88/59/49/458885949.db2.gz	GWJSQDJUYJXKDP-FQEVSTJZSA-N	0	3	347.462	3.492	20	30		EGEDHN
N#Cc1cccc(C2(NCCCOc3ccc4c(c3)OCO4)CC2)c1	ZINC000518777915	458893400	/nfs/dbraw/zinc/89/34/00/458893400.db2.gz	CCNGJTURPLPGIF-UHFFFAOYSA-N	0	3	336.391	3.335	20	30		EGEDHN
CC[C@@](C)(C#N)c1nc(-c2ccc3c(c2)C(SC)C(=O)N3)no1	ZINC000554808082	458901735	/nfs/dbraw/zinc/90/17/35/458901735.db2.gz	KKJFIMLEYBXHST-WBMJQRKESA-N	0	3	328.397	3.284	20	30		EGEDHN
CC1CC(C#N)(C(=O)Nc2ccc(CCN3CCSCC3)cc2)C1	ZINC000531562398	458936812	/nfs/dbraw/zinc/93/68/12/458936812.db2.gz	ZCBCRRURIGVADA-UHFFFAOYSA-N	0	3	343.496	3.156	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000457380317	458936842	/nfs/dbraw/zinc/93/68/42/458936842.db2.gz	GJLGRAZKCAJBIP-PMACEKPBSA-N	0	3	342.483	3.139	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CCC(OCC2CC2)CC1	ZINC000441687573	458970495	/nfs/dbraw/zinc/97/04/95/458970495.db2.gz	MGCHVEONTXEGGH-LJQANCHMSA-N	0	3	345.483	3.046	20	30		EGEDHN
CC1CC(C#N)(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)C1	ZINC000532018419	459018316	/nfs/dbraw/zinc/01/83/16/459018316.db2.gz	KARKIJAZVKMPAF-UHFFFAOYSA-N	0	3	341.455	3.430	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1ccc(C)c([N+](=O)[O-])c1)C(C)C	ZINC000495966805	459022357	/nfs/dbraw/zinc/02/23/57/459022357.db2.gz	SAYOBGVSZWADCI-SFHVURJKSA-N	0	3	345.443	3.332	20	30		EGEDHN
CCN1CCN(c2ccc(NC(=O)C3(C#N)CC(C)C3)c(C)c2)CC1	ZINC000532065610	459025062	/nfs/dbraw/zinc/02/50/62/459025062.db2.gz	HCJWTQIFSOIRJK-UHFFFAOYSA-N	0	3	340.471	3.015	20	30		EGEDHN
C[C@@H]1CCN(CC(=O)NCc2cccc(C#N)c2)[C@@H]2CCCC[C@@H]12	ZINC000520172945	459035599	/nfs/dbraw/zinc/03/55/99/459035599.db2.gz	WESMOLOTVJXEMO-AYOQOUSVSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1ccc(C)c(OC)c1)C(C)C	ZINC000496012880	459036580	/nfs/dbraw/zinc/03/65/80/459036580.db2.gz	FXKFKGWABPRJJI-GOSISDBHSA-N	0	3	330.472	3.432	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1ccn(C2CCCC2)n1)C(C)C	ZINC000477231650	459036907	/nfs/dbraw/zinc/03/69/07/459036907.db2.gz	NEYRQKBBVQBXLZ-LJQANCHMSA-N	0	3	344.503	3.427	20	30		EGEDHN
CC(C)(C)OC(=O)NC1C[C@H]2CC[C@@H](C1)C2NC[C@@H](C#N)CCC#N	ZINC000496039466	459045821	/nfs/dbraw/zinc/04/58/21/459045821.db2.gz	IFQAHOCYGDHBNC-BKYIEACKSA-N	0	3	346.475	3.101	20	30		EGEDHN
C[C@@H]1CN(C(=O)C(C#N)Cc2ccc(C#N)cc2)[C@@H]1c1ccccc1	ZINC000577517807	459045918	/nfs/dbraw/zinc/04/59/18/459045918.db2.gz	RVFYGZJGXZVEQO-YSGRDPCXSA-N	0	3	329.403	3.460	20	30		EGEDHN
Cc1cccc(CN(C)C[C@H](O)COc2ccc(CC#N)cc2)c1C	ZINC000589998994	459065320	/nfs/dbraw/zinc/06/53/20/459065320.db2.gz	JICYJUFDSUOMTM-FQEVSTJZSA-N	0	3	338.451	3.241	20	30		EGEDHN
CC(C)(NC[C@@H](O)COc1ccc(CC#N)cc1)c1ccccc1F	ZINC000590020200	459067282	/nfs/dbraw/zinc/06/72/82/459067282.db2.gz	HDVXWPRQOFCZRP-MRXNPFEDSA-N	0	3	342.414	3.156	20	30		EGEDHN
N#CCCCOc1cccc(NC2CCN(C[C@H]3CCCO3)CC2)c1	ZINC000594516380	459074708	/nfs/dbraw/zinc/07/47/08/459074708.db2.gz	YTEODNVNXBXHIC-HXUWFJFHSA-N	0	3	343.471	3.424	20	30		EGEDHN
N#Cc1ccc(-n2cc(CCN3CCCCC3)nn2)cc1C(F)(F)F	ZINC000594657324	459123321	/nfs/dbraw/zinc/12/33/21/459123321.db2.gz	QJILCPZTVKNAIW-UHFFFAOYSA-N	0	3	349.360	3.186	20	30		EGEDHN
CN1CC[C@]2(CCN(C(=O)c3c(Cl)cc(C#N)cc3Cl)C2)C1	ZINC000590456379	459133276	/nfs/dbraw/zinc/13/32/76/459133276.db2.gz	CCVYQNCKDJRMTN-INIZCTEOSA-N	0	3	338.238	3.033	20	30		EGEDHN
CCN1CC[C@@H](N[C@@H](C)c2ccc(-c3cccc(C#N)c3)cc2)C1=O	ZINC000594712157	459137105	/nfs/dbraw/zinc/13/71/05/459137105.db2.gz	ZMUVTFVDOKRCNR-MGPUTAFESA-N	0	3	333.435	3.497	20	30		EGEDHN
CC(C#N)C(=O)N1CCCC[C@H]1[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000496295787	459140459	/nfs/dbraw/zinc/14/04/59/459140459.db2.gz	QNDDPCGBOQHYGN-OAGGEKHMSA-N	0	3	349.475	3.174	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN(C(=O)C(C)(C)C)C1	ZINC000590603384	459159984	/nfs/dbraw/zinc/15/99/84/459159984.db2.gz	UIIHMRJZXFUUOA-SFHVURJKSA-N	0	3	327.472	3.275	20	30		EGEDHN
C[C@@H](C(=O)Nc1cccc(C#N)c1)N1CC[C@H](Cc2ccccc2)C1	ZINC000532971123	459168362	/nfs/dbraw/zinc/16/83/62/459168362.db2.gz	ACLOUUKIVKVZIK-QFBILLFUSA-N	0	3	333.435	3.450	20	30		EGEDHN
CC(C)(C)N1CC[C@H](N[C@@H]2CCCCc3cc(C#N)ccc32)C1=O	ZINC000567856162	459179040	/nfs/dbraw/zinc/17/90/40/459179040.db2.gz	DBLWLIRWWJGSQN-MSOLQXFVSA-N	0	3	325.456	3.315	20	30		EGEDHN
C[C@]1(NC(=O)Nc2cccc(C#N)c2)CCN(Cc2ccccc2)C1	ZINC000567996101	459205286	/nfs/dbraw/zinc/20/52/86/459205286.db2.gz	BDDGQLJAOZCIOO-FQEVSTJZSA-N	0	3	334.423	3.344	20	30		EGEDHN
C[C@H](CN1CCN(c2nccnc2C#N)C[C@@H]1C)C1CCCCC1	ZINC000559113735	459238089	/nfs/dbraw/zinc/23/80/89/459238089.db2.gz	XSTYRJLZVUPIOH-CVEARBPZSA-N	0	3	327.476	3.075	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN[C@H](C)C1(c2ccccc2)CCCC1	ZINC000481825666	459276942	/nfs/dbraw/zinc/27/69/42/459276942.db2.gz	PULVOLWHSQXMTE-QZTJIDSGSA-N	0	3	341.499	3.485	20	30		EGEDHN
N#C[C@H]1CC[C@H](NCc2ccc(N3CCc4ccccc4C3)nc2)C1	ZINC000582101207	459306880	/nfs/dbraw/zinc/30/68/80/459306880.db2.gz	UHWUCOFEQJNKNB-JXFKEZNVSA-N	0	3	332.451	3.426	20	30		EGEDHN
N#CCC[C@@H](NC(=O)NCc1ccc2c(c1)CNC2)c1ccccc1	ZINC000591355252	459360887	/nfs/dbraw/zinc/36/08/87/459360887.db2.gz	IPMKMWHYGJMRGU-LJQANCHMSA-N	0	3	334.423	3.134	20	30		EGEDHN
C=C(CC)CN1CCCN(C(=O)CCc2ccc(OC)cc2)CC1	ZINC000536891995	459362256	/nfs/dbraw/zinc/36/22/56/459362256.db2.gz	AVPZGFGGSPVMNW-UHFFFAOYSA-N	0	3	330.472	3.128	20	30		EGEDHN
N#CC[C@H]1CCCN(CCC(=O)N[C@@H]2CCCc3ccccc32)C1	ZINC000595612436	459367659	/nfs/dbraw/zinc/36/76/59/459367659.db2.gz	WQKSDEVHJCPIFO-VQIMIIECSA-N	0	3	325.456	3.196	20	30		EGEDHN
C=CCNC(=O)NC(=O)CN[C@@H](c1ccc(Cl)cc1)[C@@H](C)CC	ZINC000538214719	459369617	/nfs/dbraw/zinc/36/96/17/459369617.db2.gz	JOLQJJXJQLXSAU-BLLLJJGKSA-N	0	3	337.851	3.029	20	30		EGEDHN
N#CC[C@H]1CCCN(CCC(=O)Nc2sc3c(c2C#N)CCC3)C1	ZINC000595616511	459370559	/nfs/dbraw/zinc/37/05/59/459370559.db2.gz	RMLXBFJWFWAWFB-CYBMUJFWSA-N	0	3	342.468	3.063	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)N2CCC(CCC#N)CC2)N(C)C)cc1	ZINC000582543699	459383091	/nfs/dbraw/zinc/38/30/91/459383091.db2.gz	PMVODKWTRWPNQI-IBGZPJMESA-N	0	3	342.487	3.323	20	30		EGEDHN
C=CC[C@@H](CC)NC(=O)NC[C@H](c1ccc(OC)cc1)N1CCCC1	ZINC000540699510	459383775	/nfs/dbraw/zinc/38/37/75/459383775.db2.gz	CBFXWUPLGIANSV-IEBWSBKVSA-N	0	3	345.487	3.486	20	30		EGEDHN
C=CCN(CC=C)C(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000483731520	459386263	/nfs/dbraw/zinc/38/62/63/459386263.db2.gz	LFFGIESUPGALAG-UHFFFAOYSA-N	0	3	337.533	3.122	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(c3ccc(F)cc3F)C2)cc1F	ZINC000591503734	459393548	/nfs/dbraw/zinc/39/35/48/459393548.db2.gz	PEAHDEJOCRBUEG-OAHLLOKOSA-N	0	3	331.341	3.344	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H]1CCN(C(C)(C)C)C1	ZINC000595704511	459406374	/nfs/dbraw/zinc/40/63/74/459406374.db2.gz	RZRZOKKYLHEZDT-GOSISDBHSA-N	0	3	342.487	3.353	20	30		EGEDHN
CC#CCCN(CCC(=O)OC)Cc1cccc(Br)c1	ZINC000484299002	459411007	/nfs/dbraw/zinc/41/10/07/459411007.db2.gz	NZMAOMOFFFKNNT-UHFFFAOYSA-N	0	3	338.245	3.228	20	30		EGEDHN
CN(CCCN(C)C(=O)OC(C)(C)C)Cc1ccc(OCC#N)cc1	ZINC000497041475	459415165	/nfs/dbraw/zinc/41/51/65/459415165.db2.gz	VFGQDIBDHXZVMY-UHFFFAOYSA-N	0	3	347.459	3.278	20	30		EGEDHN
N#Cc1ccc(CNC(=O)CN2CC[C@@H](C3CCCCC3)C2)cc1	ZINC000595732971	459418960	/nfs/dbraw/zinc/41/89/60/459418960.db2.gz	GTFDQVMFWHXRAX-LJQANCHMSA-N	0	3	325.456	3.077	20	30		EGEDHN
N#CCC1CCN(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1	ZINC000541024411	459419498	/nfs/dbraw/zinc/41/94/98/459419498.db2.gz	YAMKBBISRAZRRG-UHFFFAOYSA-N	0	3	340.383	3.418	20	30		EGEDHN
N#Cc1ccc2c(c1)CC[C@@H]2NC[C@@H](O)COc1ccccc1Cl	ZINC000591764222	459431392	/nfs/dbraw/zinc/43/13/92/459431392.db2.gz	XSZCNFWQTGCNLY-QAPCUYQASA-N	0	3	342.826	3.228	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N1C[C@@H](C)S[C@@H](C)C1)C(C)C	ZINC000525295176	459444646	/nfs/dbraw/zinc/44/46/46/459444646.db2.gz	XXCPYYLFLKNMKO-BBWFWOEESA-N	0	3	339.549	3.220	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](O)COc2cccc3ccccc32)s1	ZINC000561437724	459451799	/nfs/dbraw/zinc/45/17/99/459451799.db2.gz	WXDFFEZKFISJHH-HNNXBMFYSA-N	0	3	338.432	3.302	20	30		EGEDHN
CC(C)(C)OC(=O)NCc1ccc(CN[C@@H]2CC[C@H](C#N)C2)cc1	ZINC000497137777	459456207	/nfs/dbraw/zinc/45/62/07/459456207.db2.gz	ZOBOUXLGNITMOI-DLBZAZTESA-N	0	3	329.444	3.493	20	30		EGEDHN
N#Cc1ccccc1NC(=O)CCN1Cc2ccc(O)cc2C2(CC2)C1	ZINC000569521177	459464375	/nfs/dbraw/zinc/46/43/75/459464375.db2.gz	UIZXMAWVKBHCQT-UHFFFAOYSA-N	0	3	347.418	3.140	20	30		EGEDHN
CC(C)[C@@H]1N(C(=O)C(C#N)CCc2ccccc2)CC12CCOCC2	ZINC000569555106	459470580	/nfs/dbraw/zinc/47/05/80/459470580.db2.gz	YHGLEWDQQKJVRL-MOPGFXCFSA-N	0	3	340.467	3.423	20	30		EGEDHN
CC#CCCNC(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000541772735	459491158	/nfs/dbraw/zinc/49/11/58/459491158.db2.gz	KDDKCIQHRIJWSB-UHFFFAOYSA-N	0	3	329.444	3.086	20	30		EGEDHN
Cc1ccc(SC[C@@H](C)NCc2cnc3c(C#N)cnn3c2)cc1	ZINC000569723382	459500221	/nfs/dbraw/zinc/50/02/21/459500221.db2.gz	KOIOGODSXXMYDB-CQSZACIVSA-N	0	3	337.452	3.180	20	30		EGEDHN
C[C@H](Cc1ccsc1)N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000541882248	459506438	/nfs/dbraw/zinc/50/64/38/459506438.db2.gz	TXZRJXHLMMEPMA-KDOFPFPSSA-N	0	3	339.464	3.336	20	30		EGEDHN
C[C@@H]1CCN(CC(=O)NCc2ccc(C#N)cc2)[C@@H]2CCCC[C@H]12	ZINC000562140541	459513638	/nfs/dbraw/zinc/51/36/38/459513638.db2.gz	DAEIKVSZQPLDJI-ATZDWAIDSA-N	0	3	325.456	3.075	20	30		EGEDHN
CCCN(C(=O)N[C@@H]1CCCc2cc(C#N)ccc21)[C@@H]1CCN(C)C1	ZINC000592034446	459514668	/nfs/dbraw/zinc/51/46/68/459514668.db2.gz	MIJAAQWKNLQPOW-IEBWSBKVSA-N	0	3	340.471	3.061	20	30		EGEDHN
C[C@@H](C(=O)N(C)Cc1cccc(F)c1)N1CCC(CCC#N)CC1	ZINC000592135776	459532325	/nfs/dbraw/zinc/53/23/25/459532325.db2.gz	LLAGLVDCBQISHG-HNNXBMFYSA-N	0	3	331.435	3.188	20	30		EGEDHN
C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)CC1CCN(C)CC1	ZINC000487756092	459533354	/nfs/dbraw/zinc/53/33/54/459533354.db2.gz	YUJYCMZPBGXVIK-UHFFFAOYSA-N	0	3	332.492	3.101	20	30		EGEDHN
C[C@H](NCC1(c2ccccc2)CCCCC1)C(=O)NC1(C#N)CCC1	ZINC000526047815	459538989	/nfs/dbraw/zinc/53/89/89/459538989.db2.gz	HLLWXWSVXMYSPJ-KRWDZBQOSA-N	0	3	339.483	3.429	20	30		EGEDHN
CCc1nc(C#N)cc(N(CCN(C)C)Cc2cccc(Cl)c2)n1	ZINC000596157875	459542272	/nfs/dbraw/zinc/54/22/72/459542272.db2.gz	IRMDJCGTRDMTHI-UHFFFAOYSA-N	0	3	343.862	3.132	20	30		EGEDHN
C[C@@H]1C[C@@H](Nc2nc(C#N)c(Cl)s2)CN1Cc1ccccc1	ZINC000596160877	459544038	/nfs/dbraw/zinc/54/40/38/459544038.db2.gz	JFKWFHBHXQNEJF-DGCLKSJQSA-N	0	3	332.860	3.165	20	30		EGEDHN
Cc1cc(CN(C)CCN2CCN(c3ccccc3)CC2)ccc1C#N	ZINC000488442189	459544548	/nfs/dbraw/zinc/54/45/48/459544548.db2.gz	DVQMMXJPNVZCHR-UHFFFAOYSA-N	0	3	348.494	3.121	20	30		EGEDHN
CC(C)(C)[C@@H]1CCN([C@H]2CCCN(c3ccc(C#N)cc3)C2=O)C1	ZINC000542320826	459547414	/nfs/dbraw/zinc/54/74/14/459547414.db2.gz	WVCMEKUQUQMFIX-AEFFLSMTSA-N	0	3	325.456	3.422	20	30		EGEDHN
CC(C)(CCC#N)CNC(=O)N[C@@]1(C)CCN(Cc2ccccc2)C1	ZINC000570051027	459551446	/nfs/dbraw/zinc/55/14/46/459551446.db2.gz	SBKXQULPQBVBNR-FQEVSTJZSA-N	0	3	342.487	3.280	20	30		EGEDHN
CN(C(=O)Nc1cccc(C#N)n1)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000592267244	459564210	/nfs/dbraw/zinc/56/42/10/459564210.db2.gz	JZSPBJNVGBFOAH-GOSISDBHSA-N	0	3	349.438	3.082	20	30		EGEDHN
C=C[C@H]1CCCCN1C[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000489481111	459566237	/nfs/dbraw/zinc/56/62/37/459566237.db2.gz	OGTOUUCRILPWOA-GJZGRUSLSA-N	0	3	329.362	3.486	20	30		EGEDHN
C=C[C@@H]1CCCCN1C[C@H](O)COc1ccccc1C(F)(F)F	ZINC000489506456	459567369	/nfs/dbraw/zinc/56/73/69/459567369.db2.gz	HCZKHDZNCBAVQJ-KGLIPLIRSA-N	0	3	329.362	3.486	20	30		EGEDHN
C#CCN1CCC(C(=O)NC2(c3ccc(F)cc3)CCCC2)CC1	ZINC000490593521	459580758	/nfs/dbraw/zinc/58/07/58/459580758.db2.gz	BERYOBATQRTZFX-UHFFFAOYSA-N	0	3	328.431	3.056	20	30		EGEDHN
CC[C@@H](NCc1ccc(C#N)c(C)c1)C(=O)NCc1cccs1	ZINC000592374094	459583284	/nfs/dbraw/zinc/58/32/84/459583284.db2.gz	DGLWICDISXGISL-QGZVFWFLSA-N	0	3	327.453	3.113	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H](CC)Cc2ccc(Cl)cc2)CC1	ZINC000490670153	459583765	/nfs/dbraw/zinc/58/37/65/459583765.db2.gz	LHQROVMQKIFNQD-GOSISDBHSA-N	0	3	332.875	3.123	20	30		EGEDHN
C[C@@]1(NC(=O)NCC#Cc2ccccc2)CCN(Cc2ccccc2)C1	ZINC000572885783	459590619	/nfs/dbraw/zinc/59/06/19/459590619.db2.gz	MYWOZEMWTKOFOB-JOCHJYFZSA-N	0	3	347.462	3.002	20	30		EGEDHN
CC[C@@H](c1ccccc1)[C@H]1CCCN1CC(=O)NC1(C#N)CCC1	ZINC000527127687	459596175	/nfs/dbraw/zinc/59/61/75/459596175.db2.gz	OZUHWPXKSRLFEZ-ZWKOTPCHSA-N	0	3	325.456	3.207	20	30		EGEDHN
C#CCNC(=O)C1CCN(Cc2cc(-c3ccccc3)cs2)CC1	ZINC000491122653	459599606	/nfs/dbraw/zinc/59/96/06/459599606.db2.gz	XDLVQJIZHXUAPM-UHFFFAOYSA-N	0	3	338.476	3.377	20	30		EGEDHN
C#C[C@@H](NC(=O)C1CCN(C2CC2)CC1)c1ccc(Cl)cc1F	ZINC000491126393	459600642	/nfs/dbraw/zinc/60/06/42/459600642.db2.gz	NTAOEFAHYWJOLL-QGZVFWFLSA-N	0	3	334.822	3.144	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(Cc3ccc4c(n3)CCC4)CC2)cc1	ZINC000562679147	459619794	/nfs/dbraw/zinc/61/97/94/459619794.db2.gz	OOYJUAOGWCJUDE-UHFFFAOYSA-N	0	3	346.478	3.150	20	30		EGEDHN
C#CCN(C)C(=O)Nc1ccc(SCCN2CCCCC2)cc1	ZINC000491404626	459624161	/nfs/dbraw/zinc/62/41/61/459624161.db2.gz	CWMKGCPIESPDMZ-UHFFFAOYSA-N	0	3	331.485	3.362	20	30		EGEDHN
C=CCN1CC[C@@H](N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)C1=O	ZINC000499618818	459642698	/nfs/dbraw/zinc/64/26/98/459642698.db2.gz	KVUOTERZMVLZNI-GDBMZVCRSA-N	0	3	338.373	3.282	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN[C@H](C)c1cnn(C(C)C)c1	ZINC000543502921	459664097	/nfs/dbraw/zinc/66/40/97/459664097.db2.gz	APUNXGFRPKMEHS-VQIMIIECSA-N	0	3	343.471	3.283	20	30		EGEDHN
CC(C)N(C(=O)c1ccc(C#N)cn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000592693998	459669023	/nfs/dbraw/zinc/66/90/23/459669023.db2.gz	HFZHABVWHOGCTE-LJQANCHMSA-N	0	3	348.450	3.078	20	30		EGEDHN
CN(C)Cc1c2ccccc2oc1C(=O)N1CCC(CC#N)CC1	ZINC000543835373	459705359	/nfs/dbraw/zinc/70/53/59/459705359.db2.gz	UWOJQTLKJJFUSC-UHFFFAOYSA-N	0	3	325.412	3.260	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)/C=C/c2cc(F)c(F)c(F)c2)CC1	ZINC000492587850	459711864	/nfs/dbraw/zinc/71/18/64/459711864.db2.gz	BVQODCPMXWCASQ-ONEGZZNKSA-N	0	3	338.373	3.274	20	30		EGEDHN
COc1ccccc1N(CCC#N)C(=O)[C@@H](C)NC1(C2CCC2)CC1	ZINC000593083152	459767796	/nfs/dbraw/zinc/76/77/96/459767796.db2.gz	ZOCNGIIIXWCRNL-OAHLLOKOSA-N	0	3	341.455	3.253	20	30		EGEDHN
C=CCn1c(CC)nnc1N1CC[C@H](C)N(Cc2ccccc2)CC1	ZINC000564376526	459773131	/nfs/dbraw/zinc/77/31/31/459773131.db2.gz	FTVCSTZUOKPCHA-KRWDZBQOSA-N	0	3	339.487	3.127	20	30		EGEDHN
CN(CCCN1CCC(C#N)(c2ccccn2)CC1)c1ccccc1	ZINC000565715311	459787041	/nfs/dbraw/zinc/78/70/41/459787041.db2.gz	XRGULICHPSMDDX-UHFFFAOYSA-N	0	3	334.467	3.465	20	30		EGEDHN
N#Cc1nn(C[C@H]2CN(Cc3ccccc3)CCCO2)c2ccccc12	ZINC000584735547	459793736	/nfs/dbraw/zinc/79/37/36/459793736.db2.gz	QVMBUOGTPSYSLA-GOSISDBHSA-N	0	3	346.434	3.199	20	30		EGEDHN
N#Cc1cccc(CNC[C@@H](O)Cc2ccccc2C(F)(F)F)c1	ZINC000566106778	459806117	/nfs/dbraw/zinc/80/61/17/459806117.db2.gz	ZLORKYHWIRCHBF-INIZCTEOSA-N	0	3	334.341	3.270	20	30		EGEDHN
CCC(C#N)(CC)C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1	ZINC000528883046	459816009	/nfs/dbraw/zinc/81/60/09/459816009.db2.gz	YPCLVLZENLUDGO-HNNXBMFYSA-N	0	3	328.460	3.053	20	30		EGEDHN
CCC(C#N)(CC)C(=O)NC1CCN([C@H](C)c2ccncc2)CC1	ZINC000528883048	459816124	/nfs/dbraw/zinc/81/61/24/459816124.db2.gz	YPCLVLZENLUDGO-OAHLLOKOSA-N	0	3	328.460	3.053	20	30		EGEDHN
N#CC(C(=O)NC1CCCCC1)C(=O)[C@@H]1Cc2c1cccc2Cl	ZINC000528919614	459817576	/nfs/dbraw/zinc/81/75/76/459817576.db2.gz	MHUQRNJIIVJUCC-HUUCEWRRSA-N	0	3	330.815	3.137	20	30		EGEDHN
C[C@H]1O[C@@H](C)[C@@H](C)[C@H]1C(=O)C(C#N)c1nc(-c2ccncc2)cs1	ZINC000528932585	459818378	/nfs/dbraw/zinc/81/83/78/459818378.db2.gz	HSLVBRTYMJKGFM-WGPBJTTCSA-N	0	3	341.436	3.441	20	30		EGEDHN
CC(=O)c1ccc(NC(=O)CCN2CCC(CCC#N)CC2)cc1	ZINC000566172943	459819050	/nfs/dbraw/zinc/81/90/50/459819050.db2.gz	HYJGUFNVRCDYEH-UHFFFAOYSA-N	0	3	327.428	3.234	20	30		EGEDHN
N#CCc1cccc(NC(=O)NC[C@H]2CCN2C2CCCCC2)c1	ZINC000529116623	459822920	/nfs/dbraw/zinc/82/29/20/459822920.db2.gz	QDHBIXDLFSSOPP-GOSISDBHSA-N	0	3	326.444	3.281	20	30		EGEDHN
CCN(CCOc1ccccc1OC)Cc1ccc(C#N)c(OC)c1	ZINC000597240643	459891296	/nfs/dbraw/zinc/89/12/96/459891296.db2.gz	XWJXUAYFGTVZOX-UHFFFAOYSA-N	0	3	340.423	3.476	20	30		EGEDHN
N#CCN(C(=O)C1CCN(Cc2ccccc2)CC1)c1ccccc1	ZINC000608941412	459895761	/nfs/dbraw/zinc/89/57/61/459895761.db2.gz	KQAQHWQAOSAKQY-UHFFFAOYSA-N	0	3	333.435	3.455	20	30		EGEDHN
CN(C)Cc1cccc(NC(=O)c2cc3ccccc3n2CC#N)c1	ZINC000609162905	459916172	/nfs/dbraw/zinc/91/61/72/459916172.db2.gz	JZNHGLBXSUZPAC-UHFFFAOYSA-N	0	3	332.407	3.479	20	30		EGEDHN
Cc1cc(NC(=O)CC2(C#N)CCCCC2)n(C2CCN(C)CC2)n1	ZINC000597360395	459928973	/nfs/dbraw/zinc/92/89/73/459928973.db2.gz	KKEHLWFXLYFGKZ-UHFFFAOYSA-N	0	3	343.475	3.261	20	30		EGEDHN
CCC(C#N)C(=O)N[C@](C)(C(=O)OC)c1ccc(Cl)c(Cl)c1	ZINC000593614748	459933465	/nfs/dbraw/zinc/93/34/65/459933465.db2.gz	AFRMDROXTBFMSP-PSLIRLAXSA-N	0	3	343.210	3.048	20	30		EGEDHN
C=CCC1(NC(=O)C2CCN(Cc3ccccc3)CC2)CCOCC1	ZINC000618247416	459939047	/nfs/dbraw/zinc/93/90/47/459939047.db2.gz	VNOSVGZQDGOGLM-UHFFFAOYSA-N	0	3	342.483	3.140	20	30		EGEDHN
CC(C)[C@@H]1CN(C(=O)c2ccccc2-c2ccccc2C#N)CCN1	ZINC000598577780	459946980	/nfs/dbraw/zinc/94/69/80/459946980.db2.gz	XIXAANMFKWSRMX-FQEVSTJZSA-N	0	3	333.435	3.295	20	30		EGEDHN
N#Cc1cccc(CN2CCC(NCc3cc4cnccc4o3)CC2)c1	ZINC000593692054	459953169	/nfs/dbraw/zinc/95/31/69/459953169.db2.gz	WVMGHSYEMFERJH-UHFFFAOYSA-N	0	3	346.434	3.454	20	30		EGEDHN
CN(Cc1cccc(OC(F)(F)F)c1)C[C@@H](O)CC(C)(C)C#N	ZINC000598593404	459955393	/nfs/dbraw/zinc/95/53/93/459955393.db2.gz	SLRRWJQMHJKPFD-ZDUSSCGKSA-N	0	3	330.350	3.318	20	30		EGEDHN
CCN(CC)[C@H](CN[C@@H](C)CC1(C#N)CCOCC1)c1ccco1	ZINC000602525938	459982978	/nfs/dbraw/zinc/98/29/78/459982978.db2.gz	UFCRTTDPGYBENB-DLBZAZTESA-N	0	3	333.476	3.351	20	30		EGEDHN
N#Cc1cccc(CNCCCc2cccc(Br)c2)n1	ZINC000602544137	459990517	/nfs/dbraw/zinc/99/05/17/459990517.db2.gz	DQZZMYRGZPMFJH-UHFFFAOYSA-N	0	3	330.229	3.438	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccnn2CCc2ccccc2)nc(C)n1	ZINC000621706154	460013623	/nfs/dbraw/zinc/01/36/23/460013623.db2.gz	KSCZMNFVVBDNBV-QGZVFWFLSA-N	0	3	345.406	3.023	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)C(=O)N(CCN(C)C)c1ccccc1	ZINC000593969427	460033519	/nfs/dbraw/zinc/03/35/19/460033519.db2.gz	GWFDICVODRDBOA-QGZVFWFLSA-N	0	3	335.451	3.332	20	30		EGEDHN
N#Cc1cccc(CNCCc2cccc(OCC(F)(F)F)c2)n1	ZINC000602643992	460038570	/nfs/dbraw/zinc/03/85/70/460038570.db2.gz	JIAUIJJPSMUZKR-UHFFFAOYSA-N	0	3	335.329	3.227	20	30		EGEDHN
C[C@@H](CC1(C#N)CCOCC1)NC[C@@]1(C)OCCc2sccc21	ZINC000602669038	460056149	/nfs/dbraw/zinc/05/61/49/460056149.db2.gz	ZHJNOLXCCHWNIH-WMLDXEAASA-N	0	3	334.485	3.225	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2NCCOCC(F)(F)C(F)F	ZINC000618577771	460070381	/nfs/dbraw/zinc/07/03/81/460070381.db2.gz	HCMNMMCWPKGMQZ-CQSZACIVSA-N	0	3	330.325	3.442	20	30		EGEDHN
N#Cc1cccc(CNC[C@@H]2CCN(c3ccccc3Cl)C2)n1	ZINC000602707896	460076401	/nfs/dbraw/zinc/07/64/01/460076401.db2.gz	VXDYSANAZCCSQN-AWEZNQCLSA-N	0	3	326.831	3.223	20	30		EGEDHN
COc1cccc([C@@H](CN[C@H](C)CC2(C#N)CCOCC2)OC)c1	ZINC000602720662	460084264	/nfs/dbraw/zinc/08/42/64/460084264.db2.gz	KPGRONPGVMOBEV-CRAIPNDOSA-N	0	3	332.444	3.071	20	30		EGEDHN
C[C@H]1C[C@H](N(C)C(=O)c2cccc(C#N)n2)CCN1Cc1ccccc1	ZINC000589427936	460085780	/nfs/dbraw/zinc/08/57/80/460085780.db2.gz	QZJDZNDGPSRMDN-QFBILLFUSA-N	0	3	348.450	3.078	20	30		EGEDHN
CCC(C)(C)N1CCN(C(=O)Nc2cc(C#N)cn2C(C)(C)C)CC1	ZINC000594096446	460099725	/nfs/dbraw/zinc/09/97/25/460099725.db2.gz	UMPMWKDISCKYDR-UHFFFAOYSA-N	0	3	345.491	3.453	20	30		EGEDHN
COc1ccccc1NC(=O)C1CCN(CC2(CC#N)CC2)CC1	ZINC000602782528	460122210	/nfs/dbraw/zinc/12/22/10/460122210.db2.gz	HEIIBXURZKOHBZ-UHFFFAOYSA-N	0	3	327.428	3.040	20	30		EGEDHN
N#Cc1ccc(N2CCC(N[C@@H]3CCCc4scnc43)CC2)nc1	ZINC000599027730	460132724	/nfs/dbraw/zinc/13/27/24/460132724.db2.gz	QLANLYKLEWFCPU-OAHLLOKOSA-N	0	3	339.468	3.046	20	30		EGEDHN
C[C@](CO)(NCCCSCC#N)c1cccc(C(F)(F)F)c1	ZINC000610409940	460145477	/nfs/dbraw/zinc/14/54/77/460145477.db2.gz	YJDSCTSMBOHGTN-CQSZACIVSA-N	0	3	332.391	3.149	20	30		EGEDHN
CN(C)CCc1ccccc1NC(=O)N[C@@H]1CCc2cc(C#N)ccc21	ZINC000618766928	460162524	/nfs/dbraw/zinc/16/25/24/460162524.db2.gz	QFVVFQNPFLIORU-HXUWFJFHSA-N	0	3	348.450	3.471	20	30		EGEDHN
CN(C[C@H](O)COc1cc(Cl)cc(Cl)c1)[C@H]1CC[C@@H](C#N)C1	ZINC000602924595	460188108	/nfs/dbraw/zinc/18/81/08/460188108.db2.gz	GHICDIALGHSVFR-UGFHNGPFSA-N	0	3	343.254	3.357	20	30		EGEDHN
C[C@@H](CCC#N)N(C)C[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000602924559	460188303	/nfs/dbraw/zinc/18/83/03/460188303.db2.gz	FNTUXBYVQSOZAC-SMDDNHRTSA-N	0	3	331.243	3.357	20	30		EGEDHN
CC[C@](C)(NCC(=O)NCc1ccc(C#N)cc1)c1ccc(F)cc1	ZINC000602924265	460188468	/nfs/dbraw/zinc/18/84/68/460188468.db2.gz	BVYUUGPDVLOLPU-FQEVSTJZSA-N	0	3	339.414	3.229	20	30		EGEDHN
C[C@@H](c1ccc(F)c(F)c1)N(C)C[C@@H](O)COc1ccccc1C#N	ZINC000599255732	460206251	/nfs/dbraw/zinc/20/62/51/460206251.db2.gz	IWPCHZVTUNUWFS-XJKSGUPXSA-N	0	3	346.377	3.269	20	30		EGEDHN
CCO[C@H]1C[C@H](NCC(=O)NC2(C#N)CCCCC2)C12CCCCC2	ZINC000618902417	460216191	/nfs/dbraw/zinc/21/61/91/460216191.db2.gz	AGWOIYUPPZASBR-IRXDYDNUSA-N	0	3	347.503	3.047	20	30		EGEDHN
Cc1nc(C)c([C@@H](C)N(C)C[C@@H](O)COc2ccccc2C#N)s1	ZINC000599294734	460220164	/nfs/dbraw/zinc/22/01/64/460220164.db2.gz	HNPYLGXHIRIGBD-CZUORRHYSA-N	0	3	345.468	3.064	20	30		EGEDHN
CCOc1cccc([C@@H](C)NC[C@H](O)COc2ccccc2C#N)c1	ZINC000599349034	460234739	/nfs/dbraw/zinc/23/47/39/460234739.db2.gz	JVHOFUDTUNROPO-QAPCUYQASA-N	0	3	340.423	3.047	20	30		EGEDHN
N#CCCn1cc(CN[C@H]2CCC(F)(F)C2)c(-c2ccncc2)n1	ZINC000618966621	460236404	/nfs/dbraw/zinc/23/64/04/460236404.db2.gz	QMVVHJTVZPOTIJ-HNNXBMFYSA-N	0	3	331.370	3.136	20	30		EGEDHN
C[C@H](NC1CCN(CC#N)CC1)c1nc(-c2ccccc2)cs1	ZINC000610814009	460242359	/nfs/dbraw/zinc/24/23/59/460242359.db2.gz	YRHMOMHQQTYICG-AWEZNQCLSA-N	0	3	326.469	3.449	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)Nc2ccnc(C#N)c2)CCN1Cc1ccccc1	ZINC000603132901	460250002	/nfs/dbraw/zinc/25/00/02/460250002.db2.gz	ZVMKHNXDTBUWJZ-CRAIPNDOSA-N	0	3	349.438	3.128	20	30		EGEDHN
CC(C)(C)[C@@H](N)c1cn(Cc2ccc(Br)cc2C#N)nn1	ZINC000603240708	460270736	/nfs/dbraw/zinc/27/07/36/460270736.db2.gz	CKUUXMXXHMLUJP-AWEZNQCLSA-N	0	3	348.248	3.006	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN1CCc2cc(C(F)(F)F)ccc2C1	ZINC000599636130	460293909	/nfs/dbraw/zinc/29/39/09/460293909.db2.gz	OBAXIAFCKYHGIX-HNNXBMFYSA-N	0	3	326.362	3.364	20	30		EGEDHN
Cc1ccc(CN2CC[C@@H](CN(C)c3ncccc3C#N)C2)s1	ZINC000603402428	460297868	/nfs/dbraw/zinc/29/78/68/460297868.db2.gz	RSWCRVSGPWSTKK-HNNXBMFYSA-N	0	3	326.469	3.282	20	30		EGEDHN
C[C@@H](NCCC(=O)N1CCc2sccc2C1)c1cccc(C#N)c1	ZINC000611438348	460365782	/nfs/dbraw/zinc/36/57/82/460365782.db2.gz	ZCSSABNIJXLJGU-CQSZACIVSA-N	0	3	339.464	3.245	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@H]2Cc2ccccc2C)CC1	ZINC000604109772	460379319	/nfs/dbraw/zinc/37/93/19/460379319.db2.gz	AOABBYVTJHTQQS-FQEVSTJZSA-N	0	3	341.499	3.362	20	30		EGEDHN
C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@H]1CCN(C2CC2)C1	ZINC000604203117	460390024	/nfs/dbraw/zinc/39/00/24/460390024.db2.gz	LQABUMUMPRCZFR-LBPRGKRZSA-N	0	3	339.892	3.336	20	30		EGEDHN
CCc1cccnc1[C@@H](C)NC1CCN(c2ccc(C#N)cn2)CC1	ZINC000611559522	460398191	/nfs/dbraw/zinc/39/81/91/460398191.db2.gz	QHKPWTIJCMHRAS-OAHLLOKOSA-N	0	3	335.455	3.230	20	30		EGEDHN
N#Cc1ccc(CN[C@@H](CO)C2CCCCC2)c(Br)c1	ZINC000611684724	460429139	/nfs/dbraw/zinc/42/91/39/460429139.db2.gz	PZZTTWNJPOLMQZ-INIZCTEOSA-N	0	3	337.261	3.352	20	30		EGEDHN
C[C@@H](CN1CCC[C@H](C)C1)NC(=O)NCc1ccc(C#N)c(Cl)c1	ZINC000619759479	460435240	/nfs/dbraw/zinc/43/52/40/460435240.db2.gz	NKGCIOSNXDDZNV-KBPBESRZSA-N	0	3	348.878	3.131	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN(C)C[C@H](O)C2CC2)cc1OC	ZINC000628279379	461070330	/nfs/dbraw/zinc/07/03/30/461070330.db2.gz	HUSWDDTUJKVAEK-HNNXBMFYSA-N	0	3	325.836	3.116	20	30		EGEDHN
C=CCCCCCN(C)Cc1ccc(S(N)(=O)=O)c(Cl)c1	ZINC000638095094	461236733	/nfs/dbraw/zinc/23/67/33/461236733.db2.gz	QCNTXJHBZXOZDF-UHFFFAOYSA-N	0	3	330.881	3.166	20	30		EGEDHN
C=CCn1c(C)nnc1N1C[C@H](C)N(Cc2ccccc2)[C@H](C)[C@@H]1C	ZINC000652567377	461268206	/nfs/dbraw/zinc/26/82/06/461268206.db2.gz	UESINPZCDBGXAH-BBWFWOEESA-N	0	3	339.487	3.260	20	30		EGEDHN
N#CC(C(=O)c1ccnn1CC1CCC1)c1cnc2ccccc2n1	ZINC000633980298	461368406	/nfs/dbraw/zinc/36/84/06/461368406.db2.gz	PRAAOTSEQLLIOL-AWEZNQCLSA-N	0	3	331.379	3.116	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1ccc2c(c1)CCOC2)C(C)C	ZINC000668683177	461380015	/nfs/dbraw/zinc/38/00/15/461380015.db2.gz	SXBCHNBFRDPLFO-HXUWFJFHSA-N	0	3	342.483	3.188	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cc(C(C)(C)C)n[nH]1)C(C)C	ZINC000642631746	461541140	/nfs/dbraw/zinc/54/11/40/461541140.db2.gz	RKRBRJPSOHSLRK-INIZCTEOSA-N	0	3	332.492	3.136	20	30		EGEDHN
C[C@@H](C[C@H]1CCCC(=O)N1)NCC#Cc1ccc(C(F)(F)F)cc1	ZINC000638897351	461643226	/nfs/dbraw/zinc/64/32/26/461643226.db2.gz	GVEABNGEYRTQAU-XJKSGUPXSA-N	0	3	338.373	3.094	20	30		EGEDHN
C=CCN(C(=O)N[C@@H](CN1CCCC1)c1ccccc1)[C@H](C)COC	ZINC000663644520	461733076	/nfs/dbraw/zinc/73/30/76/461733076.db2.gz	XMQRYQHKGROPID-MJGOQNOKSA-N	0	3	345.487	3.056	20	30		EGEDHN
COCCOc1cncc(C(=O)C(C#N)c2ccc3ccccc3n2)c1	ZINC000670115191	461888078	/nfs/dbraw/zinc/88/80/78/461888078.db2.gz	PUYFKQRJXXIWQE-KRWDZBQOSA-N	0	3	347.374	3.145	20	30		EGEDHN
C=CCCn1cc(CNCC(C)(C)N[C@H](C)c2ccccc2)nn1	ZINC000657365731	462075424	/nfs/dbraw/zinc/07/54/24/462075424.db2.gz	GDIYSWCMWJQHBJ-MRXNPFEDSA-N	0	3	327.476	3.073	20	30		EGEDHN
C=CCN(C[C@H](O)Cc1ccccc1C(F)(F)F)[C@H](C)COC	ZINC000661239689	462165614	/nfs/dbraw/zinc/16/56/14/462165614.db2.gz	INVLGIKEFBPEGZ-UKRRQHHQSA-N	0	3	331.378	3.132	20	30		EGEDHN
C=CCN(CCC(=O)Nc1ccc(OC)c(Cl)c1)[C@H](C)COC	ZINC000661242327	462165991	/nfs/dbraw/zinc/16/59/91/462165991.db2.gz	NHJDDGIINWFIPU-CYBMUJFWSA-N	0	3	340.851	3.200	20	30		EGEDHN
C=CCN1CCC(NC(=O)C2(c3cccc(OC)c3)CCCC2)CC1	ZINC000171716589	526420652	/nfs/dbraw/zinc/42/06/52/526420652.db2.gz	PETXRADLQVGOPB-UHFFFAOYSA-N	0	3	342.483	3.274	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC(C)(C)Cc2ccccc2C)CC1	ZINC000171733642	526430183	/nfs/dbraw/zinc/43/01/83/526430183.db2.gz	BZQPPVPJGNVQCJ-UHFFFAOYSA-N	0	3	329.488	3.266	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@](C)(NCc1ccc(C#N)s1)C1CC1	ZINC000177578942	526475721	/nfs/dbraw/zinc/47/57/21/526475721.db2.gz	OECQZPVXTGZSAW-KRWDZBQOSA-N	0	3	335.473	3.403	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)C1C(C)(C)C1(C)C	ZINC000344469996	535861103	/nfs/dbraw/zinc/86/11/03/535861103.db2.gz	VUZSPFVNWKOEQV-UHFFFAOYSA-N	0	3	327.472	3.131	20	30		EGEDHN
C[C@H](C(=O)NC[C@@H]1COc2ccccc2O1)N1CCC[C@@H](C2CC2)C1	ZINC000329644659	547504103	/nfs/dbraw/zinc/50/41/03/547504103.db2.gz	JEOTYWCWYNZPCZ-DJIMGWMZSA-N	0	3	344.455	3.293	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN2CC[C@](CO)(c3ccccc3)C2)cc1	ZINC000365835900	547778569	/nfs/dbraw/zinc/77/85/69/547778569.db2.gz	GDYRPNHTSZENHO-UTKZUKDTSA-N	0	3	336.435	3.113	20	30		EGEDHN
C[C@@H]1C[C@H](N(C)C(=O)Nc2ccc(CC#N)cc2Cl)CCN1C	ZINC000455698136	547938063	/nfs/dbraw/zinc/93/80/63/547938063.db2.gz	FOQTXCFFXRAJJY-TZMCWYRMSA-N	0	3	334.851	3.352	20	30		EGEDHN
C=C(CNC(=O)[C@@H]1CCCN(Cc2cccnc2)C1)c1ccccc1	ZINC000673341753	548549897	/nfs/dbraw/zinc/54/98/97/548549897.db2.gz	QISJIFLEZYMANW-HXUWFJFHSA-N	0	3	335.451	3.123	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@@H](C)N1CC[C@H](N(C)Cc2ccccc2)C1	ZINC000674252209	548712605	/nfs/dbraw/zinc/71/26/05/548712605.db2.gz	XTKCQXJYSYRUNX-QUCCMNQESA-N	0	3	343.515	3.006	20	30		EGEDHN
CCC(=O)N[C@@H](C)C(=O)C(C#N)c1nc2cc(Cl)ccc2s1	ZINC000729069502	574810514	/nfs/dbraw/zinc/81/05/14/574810514.db2.gz	FXMYRUALHRRHJK-WPRPVWTQSA-N	0	3	335.816	3.041	20	30		EGEDHN
C#CCOc1ccc(NC(=O)NCC(C)(C)N2CCCCC2)cc1	ZINC000731113522	575055633	/nfs/dbraw/zinc/05/56/33/575055633.db2.gz	BLZZDVZWILYTTK-UHFFFAOYSA-N	0	3	329.444	3.085	20	30		EGEDHN
C=CC[C@H](NC(=O)NC[C@H](C)N1CCCC[C@H]1C)c1ccncc1	ZINC000734658890	575533135	/nfs/dbraw/zinc/53/31/35/575533135.db2.gz	NDFWHCDCZCNHHX-RYRKJORJSA-N	0	3	330.476	3.261	20	30		EGEDHN
C#Cc1ccc(C(=O)NC2CCN([C@@H](C)c3ccccc3)CC2)nc1	ZINC000734784172	575551389	/nfs/dbraw/zinc/55/13/89/575551389.db2.gz	ZBFWVISOLCLAKC-INIZCTEOSA-N	0	3	333.435	3.018	20	30		EGEDHN
CC(C)[C@H](C(=O)NCc1cccc(-c2ccc(C#N)s2)c1)N(C)C	ZINC000739749452	576502993	/nfs/dbraw/zinc/50/29/93/576502993.db2.gz	GIHNRYYMKMKLDE-GOSISDBHSA-N	0	3	341.480	3.489	20	30		EGEDHN
CC[C@H](C)c1ccc(NC(=O)C(C#N)C(=O)C[C@H]2CCOC2)cc1	ZINC000740534811	576593798	/nfs/dbraw/zinc/59/37/98/576593798.db2.gz	IBJZRBKPTUQCTF-VBQJREDUSA-N	0	3	328.412	3.274	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2cc3cc(Cl)ccc3o2)CC1	ZINC000740736331	576621777	/nfs/dbraw/zinc/62/17/77/576621777.db2.gz	OZSRJGQERBEIOC-UHFFFAOYSA-N	0	3	330.815	3.304	20	30		EGEDHN
C#CCCN1CCC(NC(=O)C2(c3cccc(C)c3)CCCC2)CC1	ZINC000740738601	576622122	/nfs/dbraw/zinc/62/21/22/576622122.db2.gz	IQLKLKMZKMIDHS-UHFFFAOYSA-N	0	3	338.495	3.411	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/C[C@@H](CC(C)C)C(=O)OC)c([O-])c1	ZINC000741463195	576687971	/nfs/dbraw/zinc/68/79/71/576687971.db2.gz	ASGRXPRBCVYOTQ-DDLUMYACSA-N	0	3	334.460	3.493	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1	ZINC000741532503	576697570	/nfs/dbraw/zinc/69/75/70/576697570.db2.gz	ZXIRQNGSCQZHRM-NRFANRHFSA-N	0	3	348.446	3.266	20	30		EGEDHN
C#CCOc1cc(F)ccc1NC(=O)NC[C@H](C)N1CCCC[C@H]1C	ZINC000743194180	576802931	/nfs/dbraw/zinc/80/29/31/576802931.db2.gz	GNQAQECKZJRLNA-CABCVRRESA-N	0	3	347.434	3.222	20	30		EGEDHN
C#CCOc1ccc(F)cc1NC(=O)NC[C@H](C)N1CCC[C@H](C)C1	ZINC000743201514	576803311	/nfs/dbraw/zinc/80/33/11/576803311.db2.gz	XAGKIYFCXFBAKJ-GJZGRUSLSA-N	0	3	347.434	3.080	20	30		EGEDHN
C#Cc1ccc(C(=O)N(CC)C[C@@H]2CCN(Cc3ccccc3)C2)nc1	ZINC000743781778	576815806	/nfs/dbraw/zinc/81/58/06/576815806.db2.gz	GJOHZIUFQQOFMD-HXUWFJFHSA-N	0	3	347.462	3.047	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)[C@H](C)c1ccc(C)o1	ZINC000744031122	576819178	/nfs/dbraw/zinc/81/91/78/576819178.db2.gz	QUMVYFGWPFPSDU-ZIAGYGMSSA-N	0	3	340.379	3.438	20	30		EGEDHN
C=CC[C@H]([NH2+][C@@H](C)c1ccc(-c2nnn[n-]2)c(F)c1)c1ccncc1	ZINC000823888869	609143735	/nfs/dbraw/zinc/14/37/35/609143735.db2.gz	ZDVATLPVBSIOOG-SJCJKPOMSA-N	0	3	338.390	3.369	20	30		EGEDHN
N#CCN1CCC(NCc2cccc(Cl)c2Br)CC1	ZINC000873048070	1297246844	/nfs/dbraw/zinc/24/68/44/1297246844.db2.gz	OFWUAZYINFASQR-UHFFFAOYSA-N	0	3	342.668	3.180	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CNCc2ccc([S@](C)=O)cc2)cc1	ZINC000751151814	1299517135	/nfs/dbraw/zinc/51/71/35/1299517135.db2.gz	FYFDPDXYIYFVML-PSLXWICFSA-N	0	3	328.437	3.005	20	30		EGEDHN
C=C(Cl)CNC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F	ZINC000796564281	1310036027	/nfs/dbraw/zinc/03/60/27/1310036027.db2.gz	SSQJFOKDZZFURA-AWEZNQCLSA-N	0	3	328.790	3.013	20	30		EGEDHN
C[C@@H](SCc1ccccc1)C(=O)C(C#N)C(=O)NC1CCCCC1	ZINC000050683766	1291654452	/nfs/dbraw/zinc/65/44/52/1291654452.db2.gz	ADUWXCLBTHANHH-PBHICJAKSA-N	0	3	344.480	3.466	20	30		EGEDHN
N#CC(C(=O)CCc1ccc(Cl)cc1)C(=O)NC1CCCCC1	ZINC000050682315	1291655092	/nfs/dbraw/zinc/65/50/92/1291655092.db2.gz	BRMUOWKQBLYKCY-MRXNPFEDSA-N	0	3	332.831	3.430	20	30		EGEDHN
C=CCOc1ccccc1CNC[C@H](O)c1cc(OC)ccc1OC	ZINC000075735054	1292408206	/nfs/dbraw/zinc/40/82/06/1292408206.db2.gz	VVZOFOMSJKAHIJ-SFHVURJKSA-N	0	3	343.423	3.092	20	30		EGEDHN
CCCC(=O)N1CCC[C@@H]1C(=O)C(C#N)c1nc(C(C)C)cs1	ZINC000080451716	1292604507	/nfs/dbraw/zinc/60/45/07/1292604507.db2.gz	KPMFLKMDHIPINZ-TZMCWYRMSA-N	0	3	333.457	3.234	20	30		EGEDHN
C[C@H](NCc1ccc(F)c(C#N)c1)c1ccc(N2CCNC2=O)cc1	ZINC000829739382	1292612696	/nfs/dbraw/zinc/61/26/96/1292612696.db2.gz	KTCCBPUACXDSJC-ZDUSSCGKSA-N	0	3	338.386	3.078	20	30		EGEDHN
C[C@@H](NCc1ccc(F)c(C#N)c1)c1ccc(N2CCNC2=O)cc1	ZINC000829739381	1292613029	/nfs/dbraw/zinc/61/30/29/1292613029.db2.gz	KTCCBPUACXDSJC-CYBMUJFWSA-N	0	3	338.386	3.078	20	30		EGEDHN
CS[C@H](C)C(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000103330231	1293001856	/nfs/dbraw/zinc/00/18/56/1293001856.db2.gz	AAILXGGFDCQSPQ-APPZFPTMSA-N	0	3	331.224	3.392	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)c2cc3c(s2)CCOC3)c1	ZINC000103330027	1293002575	/nfs/dbraw/zinc/00/25/75/1293002575.db2.gz	HBFPHQSWYVVFRS-AWEZNQCLSA-N	0	3	340.404	3.090	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1N[C@@H](C)c1ccc(N2CCOCC2)cc1Cl	ZINC000834888806	1293164797	/nfs/dbraw/zinc/16/47/97/1293164797.db2.gz	QAHPUKUOJYFCQY-VHSSKADRSA-N	0	3	336.863	3.171	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)[C@H]1CC12CCSCC2	ZINC000835034976	1293191503	/nfs/dbraw/zinc/19/15/03/1293191503.db2.gz	DBZSHKPKHBENLM-CHWSQXEVSA-N	0	3	325.437	3.283	20	30		EGEDHN
Cc1cc(C(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)nn1C(C)C	ZINC000835061377	1293195991	/nfs/dbraw/zinc/19/59/91/1293195991.db2.gz	RZGPHPJKZLCTFO-CQSZACIVSA-N	0	3	344.802	3.387	20	30		EGEDHN
CC(C)CN(Cc1cnn(C)c1)Cc1ccc(O[C@H](C)C#N)cc1	ZINC000835076146	1293202738	/nfs/dbraw/zinc/20/27/38/1293202738.db2.gz	DLALQVWZHTYHDU-MRXNPFEDSA-N	0	3	326.444	3.369	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN1CCCCC[C@@H]1C[C@H](O)c1ccco1	ZINC000121790311	1293390450	/nfs/dbraw/zinc/39/04/50/1293390450.db2.gz	ZLUJTQNWBGNBCH-MSOLQXFVSA-N	0	3	346.471	3.148	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(Cl)cc1Cl)C(=O)[C@H]1CCCCO1	ZINC000121989513	1293397821	/nfs/dbraw/zinc/39/78/21/1293397821.db2.gz	UGLQUERERDFKRE-ZWNOBZJWSA-N	0	3	341.194	3.210	20	30		EGEDHN
C#CCOc1ccc(Br)cc1CNCCOCC(=C)C	ZINC000125819003	1293517939	/nfs/dbraw/zinc/51/79/39/1293517939.db2.gz	GXSXKFGBWDDJKS-UHFFFAOYSA-N	0	3	338.245	3.143	20	30		EGEDHN
CC(C)c1cc(C(=O)C(C#N)C(=O)Nc2ccc(F)c(Cl)c2)n[nH]1	ZINC000130232785	1293649741	/nfs/dbraw/zinc/64/97/41/1293649741.db2.gz	QIBWQPCYOXGWBV-SNVBAGLBSA-N	0	3	348.765	3.287	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@](C)(NCC#Cc1ccc(F)cc1)C1CC1	ZINC000133263714	1293740585	/nfs/dbraw/zinc/74/05/85/1293740585.db2.gz	BGTNHKDOAFOVKW-FQEVSTJZSA-N	0	3	346.446	3.460	20	30		EGEDHN
CC[C@@H](SC)C(=O)C(C#N)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000156512730	1294147429	/nfs/dbraw/zinc/14/74/29/1294147429.db2.gz	RJXLGYXZWXUOKA-JOYOIKCWSA-N	0	3	328.796	3.268	20	30		EGEDHN
C[C@H](CC(=O)C(C#N)C(=O)Nc1ccccn1)c1ccccc1F	ZINC000170673417	1294376527	/nfs/dbraw/zinc/37/65/27/1294376527.db2.gz	KGWCNTQRUOTMBJ-TZMCWYRMSA-N	0	3	325.343	3.062	20	30		EGEDHN
CC[C@H](C)c1ccc(NC(=O)C(C#N)C(=O)[C@@H]2CCCOC2)cc1	ZINC000171037367	1294392124	/nfs/dbraw/zinc/39/21/24/1294392124.db2.gz	IZUBECNOLRJXNN-YSVLISHTSA-N	0	3	328.412	3.274	20	30		EGEDHN
C[C@@H](NCc1ccc(-n2cncn2)cc1)c1ccc(OCC#N)cc1	ZINC000171768527	1294416813	/nfs/dbraw/zinc/41/68/13/1294416813.db2.gz	UFOQMWXNORCOON-OAHLLOKOSA-N	0	3	333.395	3.020	20	30		EGEDHN
COCCOc1ccc([C@@H](C)NCc2ccc(OCC#N)cc2)cc1	ZINC000180552887	1294899003	/nfs/dbraw/zinc/89/90/03/1294899003.db2.gz	OVTBOIZGIJPDEZ-MRXNPFEDSA-N	0	3	340.423	3.465	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)COc1ccc(Cl)cc1C	ZINC000193368921	1295856002	/nfs/dbraw/zinc/85/60/02/1295856002.db2.gz	FTCOIGBHMSDHBB-AWEZNQCLSA-N	0	3	336.819	3.043	20	30		EGEDHN
N#CC(C(=O)C=Cc1ccc(Cl)s1)C(=O)Nc1ccccn1	ZINC000193529217	1295883915	/nfs/dbraw/zinc/88/39/15/1295883915.db2.gz	OGYKGNHZEJDNMQ-MALLOTDXSA-N	0	3	331.784	3.157	20	30		EGEDHN
N#CCOc1ccccc1C(=O)NC[C@H](c1ccccc1)N1CCCC1	ZINC000194055244	1295938316	/nfs/dbraw/zinc/93/83/16/1295938316.db2.gz	MWJSWVPIVXCNOO-LJQANCHMSA-N	0	3	349.434	3.156	20	30		EGEDHN
CO[C@H](C)CC(=O)C(C#N)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000195492370	1296071795	/nfs/dbraw/zinc/07/17/95/1296071795.db2.gz	ZFBOOURVDAZXRY-PRHODGIISA-N	0	3	329.183	3.066	20	30		EGEDHN
C#CCOc1ccccc1CN[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000236727647	1296199672	/nfs/dbraw/zinc/19/96/72/1296199672.db2.gz	MFWKGLBSFSGTNG-KRWDZBQOSA-N	0	3	344.455	3.188	20	30		EGEDHN
CCOc1ccc(OCC)c(NC(=[NH2+])NCc2ccc([O-])c(F)c2)c1	ZINC000304765387	1296942578	/nfs/dbraw/zinc/94/25/78/1296942578.db2.gz	ZGFTZCDKVWZLJJ-UHFFFAOYSA-N	0	3	347.390	3.256	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2Cc3ccccc3[C@H](C)C2)CC1	ZINC000872882049	1297153842	/nfs/dbraw/zinc/15/38/42/1297153842.db2.gz	SBACENSANOQXGC-MRXNPFEDSA-N	0	3	327.472	3.356	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)C2CCC=CCC2)cc1OC	ZINC000873497021	1297543092	/nfs/dbraw/zinc/54/30/92/1297543092.db2.gz	BSYBKVMANCPFAK-OAHLLOKOSA-N	0	3	342.395	3.098	20	30		EGEDHN
CCc1nc(C#N)cc(N2CCN(Cc3ccccc3)[C@@H](C(C)C)C2)n1	ZINC000704721529	1298206681	/nfs/dbraw/zinc/20/66/81/1298206681.db2.gz	YLQBFCMSRPRJMW-LJQANCHMSA-N	0	3	349.482	3.257	20	30		EGEDHN
COCCN(CCC(=O)OC(C)(C)C)[C@@H](C)c1ccc(C#N)cc1	ZINC000746660784	1298634786	/nfs/dbraw/zinc/63/47/86/1298634786.db2.gz	ZXGWNFNAMYLUFX-HNNXBMFYSA-N	0	3	332.444	3.299	20	30		EGEDHN
O=C(C#Cc1ccccc1)N[C@@H](CN1CCCCC1)c1ccccc1	ZINC000747379334	1298771104	/nfs/dbraw/zinc/77/11/04/1298771104.db2.gz	BXKKTLCJNVSHRY-NRFANRHFSA-N	0	3	332.447	3.382	20	30		EGEDHN
Cc1ccc(C[NH2+]C2CCC(Oc3ccc(C#N)cn3)CC2)c([O-])c1	ZINC000877119432	1299165915	/nfs/dbraw/zinc/16/59/15/1299165915.db2.gz	YDKSYEKYYKCVMI-UHFFFAOYSA-N	0	3	337.423	3.447	20	30		EGEDHN
CCCN(Cc1ccnc(C#N)c1)[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000749513362	1299228324	/nfs/dbraw/zinc/22/83/24/1299228324.db2.gz	CKJDEPOXNUXLAR-KRWDZBQOSA-N	0	3	344.459	3.175	20	30		EGEDHN
N#Cc1cccc(CNCC[C@@H](O)c2ccc(Cl)c(Cl)c2)n1	ZINC000877528448	1299370831	/nfs/dbraw/zinc/37/08/31/1299370831.db2.gz	ACOFFFCHYCZRPD-MRXNPFEDSA-N	0	3	336.222	3.473	20	30		EGEDHN
CN(C)CCN(C)C(=O)Nc1ccc([C@@H](C#N)c2ccccc2)cc1	ZINC000750588770	1299431356	/nfs/dbraw/zinc/43/13/56/1299431356.db2.gz	WMKUSPAVHHNFHR-IBGZPJMESA-N	0	3	336.439	3.367	20	30		EGEDHN
CC(=O)[C@](C#N)(CCN1CCc2ccc(O)cc2CC1)c1ccccc1	ZINC000878233170	1299847421	/nfs/dbraw/zinc/84/74/21/1299847421.db2.gz	RSSDRFXQBXYVSK-JOCHJYFZSA-N	0	3	348.446	3.233	20	30		EGEDHN
CC(=O)[C@](C#N)(CCN(C)CC1(O)CCCCCC1)c1ccccc1	ZINC000878465788	1300020683	/nfs/dbraw/zinc/02/06/83/1300020683.db2.gz	GJPGSYJYSLOYMT-OAQYLSRUSA-N	0	3	342.483	3.444	20	30		EGEDHN
CC(=O)[C@](C#N)(CCN1CCC[C@H]1[C@H]1CCCO1)c1ccccc1	ZINC000878573381	1300086936	/nfs/dbraw/zinc/08/69/36/1300086936.db2.gz	SPMBWJJAWYRAPF-XUVXKRRUSA-N	0	3	326.440	3.070	20	30		EGEDHN
Cc1ccc2c(c1)CC[C@@H]2N[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000754105585	1300088283	/nfs/dbraw/zinc/08/82/83/1300088283.db2.gz	OOQKXQMVBPAMBV-LEWJYISDSA-N	0	3	345.446	3.245	20	30		EGEDHN
CC(=O)[C@@](C#N)(CCN1CCC[C@](CO)(C(C)C)C1)c1ccccc1	ZINC000878655265	1300128856	/nfs/dbraw/zinc/12/88/56/1300128856.db2.gz	KRAARICIJGKFSS-SFTDATJTSA-N	0	3	342.483	3.158	20	30		EGEDHN
CC(=O)[C@@](C#N)(CCN1CC[C@H](c2cccnc2)C1)c1ccccc1	ZINC000878761176	1300179513	/nfs/dbraw/zinc/17/95/13/1300179513.db2.gz	UMOLNWNYXMNWHA-FPOVZHCZSA-N	0	3	333.435	3.312	20	30		EGEDHN
CCC1(C(=O)C(C#N)c2nc(-c3ccc(OC)cc3)cs2)COC1	ZINC000756243745	1300456788	/nfs/dbraw/zinc/45/67/88/1300456788.db2.gz	MSUOVRPXYCGBDZ-AWEZNQCLSA-N	0	3	342.420	3.422	20	30		EGEDHN
CC[C@@H]1CC[C@H](C(=O)C(C#N)C(=O)Nc2ccc(F)c(Cl)c2)O1	ZINC000757304691	1300663349	/nfs/dbraw/zinc/66/33/49/1300663349.db2.gz	MKPSIPZWLNCVGC-JTNHKYCSSA-N	0	3	338.766	3.084	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)Cc3ccccc3CC#N)nc21	ZINC000761106566	1301404244	/nfs/dbraw/zinc/40/42/44/1301404244.db2.gz	JHDNTLOQTWUOSP-INIZCTEOSA-N	0	3	328.375	3.356	20	30		EGEDHN
C=CC[C@H](N[C@@H](C)c1ccc(NS(C)(=O)=O)cc1)c1ccncc1	ZINC000766019532	1302371201	/nfs/dbraw/zinc/37/12/01/1302371201.db2.gz	MGVPPCWXQMBKCX-KSSFIOAISA-N	0	3	345.468	3.421	20	30		EGEDHN
COc1ccc(C(=O)C(C#N)c2nc3ccccc3[nH]2)nc1Cl	ZINC000766836736	1302528892	/nfs/dbraw/zinc/52/88/92/1302528892.db2.gz	CNTMERIVPNEUOW-VIFPVBQESA-N	0	3	326.743	3.110	20	30		EGEDHN
CC(C)c1nc2cc(NC(=O)C3CC4(C3)CNC[C@H]4C#N)ccc2o1	ZINC000884083692	1302725554	/nfs/dbraw/zinc/72/55/54/1302725554.db2.gz	WHZNDCXLAPSZLT-FWHMADFJSA-N	0	3	338.411	3.029	20	30		EGEDHN
C#CCCCCNC(=O)N[C@@H](CN(C)Cc1ccccc1)C(C)C	ZINC000768948936	1303019821	/nfs/dbraw/zinc/01/98/21/1303019821.db2.gz	AKDKKJYQOCXEGH-IBGZPJMESA-N	0	3	329.488	3.246	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cccc(COC(C)(C)C)c2)CC1	ZINC000885624592	1303207714	/nfs/dbraw/zinc/20/77/14/1303207714.db2.gz	USMILCWQNRFCHM-UHFFFAOYSA-N	0	3	328.456	3.285	20	30		EGEDHN
N#Cc1cccc(OCCCCC(=O)OCCN2CCCCC2)c1	ZINC000770369765	1303255218	/nfs/dbraw/zinc/25/52/18/1303255218.db2.gz	NHWOFJYMTFOSHV-UHFFFAOYSA-N	0	3	330.428	3.136	20	30		EGEDHN
COc1ccc(C(C)=NNC[C@@H](C)C#N)cc1CN1CCCCC1	ZINC000771103824	1303360291	/nfs/dbraw/zinc/36/02/91/1303360291.db2.gz	QCTYKUMXLGVRMD-HNNXBMFYSA-N	0	3	328.460	3.154	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)CC[C@H](C)SC	ZINC000773769711	1303737450	/nfs/dbraw/zinc/73/74/50/1303737450.db2.gz	KQMBZZYNLWZUOY-QWHCGFSZSA-N	0	3	334.441	3.264	20	30		EGEDHN
Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@@H]1N2C(=O)c1cc(C#N)ccc1F	ZINC000887857975	1303959467	/nfs/dbraw/zinc/95/94/67/1303959467.db2.gz	XIAKDSVBCHCTNL-PXNSSMCTSA-N	0	3	349.409	3.454	20	30		EGEDHN
CC1CCC(N2CCN(C(=O)Cc3ccccc3CC#N)CC2)CC1	ZINC000776929786	1304220154	/nfs/dbraw/zinc/22/01/54/1304220154.db2.gz	VWXDUMVDSZLPHG-UHFFFAOYSA-N	0	3	339.483	3.018	20	30		EGEDHN
CCN(CC)C(=O)[C@H](Cc1ccccc1)NCc1cccc(C#N)c1	ZINC000779007486	1304516893	/nfs/dbraw/zinc/51/68/93/1304516893.db2.gz	FJOSRBBZRLXICT-FQEVSTJZSA-N	0	3	335.451	3.128	20	30		EGEDHN
C#C[C@H]([NH2+][C@H](C)c1cc(Br)cc(C)c1[O-])[C@@H]1CCCO1	ZINC000779052388	1304523148	/nfs/dbraw/zinc/52/31/48/1304523148.db2.gz	PKJMUEWJVGWLPG-UGFHNGPFSA-N	0	3	338.245	3.295	20	30		EGEDHN
CC(=NNC1=N[C@@H](C)CN1)[C@@H](C)Oc1ccc(Cl)cc1Cl	ZINC000779798412	1304606553	/nfs/dbraw/zinc/60/65/53/1304606553.db2.gz	CMEMYLTUORKYOY-WCBMZHEXSA-N	0	3	329.231	3.074	20	30		EGEDHN
C#CCCCCCC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000779845214	1304614202	/nfs/dbraw/zinc/61/42/02/1304614202.db2.gz	NJNMIFRRYIUTHN-UHFFFAOYSA-N	0	3	325.456	3.032	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)C(=O)Nc1ccccn1)c1c[nH]c2ccccc21	ZINC000786329043	1305557639	/nfs/dbraw/zinc/55/76/39/1305557639.db2.gz	KSYJWAQQNYLACY-DZGCQCFKSA-N	0	3	346.390	3.404	20	30		EGEDHN
CC(=O)N[C@H](CC1CCC1)C(=O)C(C#N)c1nc(C(C)C)cs1	ZINC000786444486	1305576573	/nfs/dbraw/zinc/57/65/73/1305576573.db2.gz	RNIZJXPLHRCKCA-ZIAGYGMSSA-N	0	3	333.457	3.138	20	30		EGEDHN
C[C@H](N[C@@H](C)c1cccc(C#N)c1)c1ccc(N2CCNC2=O)cc1	ZINC000786835877	1305640000	/nfs/dbraw/zinc/64/00/00/1305640000.db2.gz	JZMAVICQNDWXBF-GJZGRUSLSA-N	0	3	334.423	3.500	20	30		EGEDHN
CCOC(=O)C1(CC(=O)C(C#N)c2nc3ccccc3o2)CCC1	ZINC000789350836	1306144902	/nfs/dbraw/zinc/14/49/02/1306144902.db2.gz	MKKQKKHHKZFTAG-LBPRGKRZSA-N	0	3	326.352	3.128	20	30		EGEDHN
CC(=N[N-]c1[nH+]ccn1C)c1ccc(OC[C@H]2CCCCO2)c(F)c1	ZINC000790303874	1306294740	/nfs/dbraw/zinc/29/47/40/1306294740.db2.gz	YVCDGFIZBHEPDL-OAHLLOKOSA-N	0	3	346.406	3.343	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/Cc2cnc3n2CCCC3)c([O-])c1	ZINC000790575156	1306355205	/nfs/dbraw/zinc/35/52/05/1306355205.db2.gz	PHFXYQVFYFFHRC-UDWIEESQSA-N	0	3	326.444	3.390	20	30		EGEDHN
N#Cc1c2[nH]c3ccccc3n2c(=O)cc1CN1CCC(C2CC2)CC1	ZINC000794893949	1309616280	/nfs/dbraw/zinc/61/62/80/1309616280.db2.gz	SJPBQTMVPFPDDT-KRWDZBQOSA-N	0	3	346.434	3.346	20	30		EGEDHN
COc1ccc(C2=NO[C@@H](CN[C@H](C)CC(C)(C)C#N)C2)cc1C	ZINC000895976764	1309623520	/nfs/dbraw/zinc/62/35/20/1309623520.db2.gz	JSTULYVMTBYIML-GDBMZVCRSA-N	0	3	329.444	3.415	20	30		EGEDHN
COc1ccc(C2=NO[C@H](CN[C@H](C)CC(C)(C)C#N)C2)cc1F	ZINC000895977431	1309624281	/nfs/dbraw/zinc/62/42/81/1309624281.db2.gz	NVYCRSCNOFARNY-OCCSQVGLSA-N	0	3	333.407	3.245	20	30		EGEDHN
C=CCNC(=S)NC[C@H](c1ccc(Cl)cc1)N(C)CCC	ZINC000795090128	1309664918	/nfs/dbraw/zinc/66/49/18/1309664918.db2.gz	FNQBPWZSEHCNQO-OAHLLOKOSA-N	0	3	325.909	3.373	20	30		EGEDHN
CCCCOC(=O)CCN1CCC(Oc2ccc(C#N)cc2F)CC1	ZINC000796516848	1310018463	/nfs/dbraw/zinc/01/84/63/1310018463.db2.gz	PWEVBGFJHDXHLN-UHFFFAOYSA-N	0	3	348.418	3.274	20	30		EGEDHN
C#CCCOc1ccc(CNCc2ccc(C[S@](C)=O)cc2)cc1	ZINC000796526440	1310020365	/nfs/dbraw/zinc/02/03/65/1310020365.db2.gz	MZDRKZXUWTTXHE-DEOSSOPVSA-N	0	3	341.476	3.257	20	30		EGEDHN
N#CC[C@H](CC(=O)C(C#N)C(=O)NC1CCCCC1)c1ccccc1	ZINC000796632344	1310051307	/nfs/dbraw/zinc/05/13/07/1310051307.db2.gz	KIBWQXGSGBMDPH-AEFFLSMTSA-N	0	3	337.423	3.232	20	30		EGEDHN
N#Cc1ccc(NCCNCc2cc(F)cc(C(F)(F)F)c2)nc1	ZINC000897398423	1310320707	/nfs/dbraw/zinc/32/07/07/1310320707.db2.gz	DMFLCNYEMCUTRN-UHFFFAOYSA-N	0	3	338.308	3.313	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)cc1C#N	ZINC000799335922	1310527260	/nfs/dbraw/zinc/52/72/60/1310527260.db2.gz	LKILKVCJYCEULB-FQEVSTJZSA-N	0	3	333.435	3.261	20	30		EGEDHN
C[C@H](N[C@@H]1CC[C@@H](C#N)C1)c1cc(F)ccc1N1CCC(O)CC1	ZINC000799717692	1310604875	/nfs/dbraw/zinc/60/48/75/1310604875.db2.gz	SSAXGCYIEOXYKD-SQWLQELKSA-N	0	3	331.435	3.130	20	30		EGEDHN
CCCC[N@H+](Cc1ccccc1[O-])[C@@H](C)C(=O)N[C@@](C)(C#N)C(C)C	ZINC000801597513	1310971413	/nfs/dbraw/zinc/97/14/13/1310971413.db2.gz	JAYWPIUINYRPHA-JXFKEZNVSA-N	0	3	345.487	3.437	20	30		EGEDHN
CCCC[N@@H+](Cc1ccccc1[O-])[C@@H](C)C(=O)N[C@@](C)(C#N)C(C)C	ZINC000801597513	1310971419	/nfs/dbraw/zinc/97/14/19/1310971419.db2.gz	JAYWPIUINYRPHA-JXFKEZNVSA-N	0	3	345.487	3.437	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCc1ccc(Br)c([N+](=O)[O-])c1	ZINC000824955637	1320300465	/nfs/dbraw/zinc/30/04/65/1320300465.db2.gz	XYHKTSBLOTXDFI-OCCSQVGLSA-N	0	3	341.205	3.181	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N(C)Cc1cc(Cl)cc(Cl)c1	ZINC000836488423	1320493741	/nfs/dbraw/zinc/49/37/41/1320493741.db2.gz	WQGQXARIEMUKOV-UHFFFAOYSA-N	0	3	342.270	3.090	20	30		EGEDHN
C[C@@H](C#N)OCCN1CC[C@@H](Oc2ccc(Cl)c(Cl)c2)C1	ZINC000801927135	1316966768	/nfs/dbraw/zinc/96/67/68/1316966768.db2.gz	IGQLSGQGCSHNEO-WCQYABFASA-N	0	3	329.227	3.375	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CC[C@H](NCc3cc4ccccc4o3)C2)cc1	ZINC001019223116	1317111488	/nfs/dbraw/zinc/11/14/88/1317111488.db2.gz	GYXNZUILKBHFJU-IBGZPJMESA-N	0	3	344.414	3.418	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H](NCc2cn(C(C)C)nc2C)C1	ZINC001019331680	1317173101	/nfs/dbraw/zinc/17/31/01/1317173101.db2.gz	BHOGVCFPHNOPOK-PKOBYXMFSA-N	0	3	332.492	3.065	20	30		EGEDHN
CCN(C)C(=O)OC[C@@H]1CCCCN1Cc1ccc(CC#N)cc1	ZINC000805760274	1317417929	/nfs/dbraw/zinc/41/79/29/1317417929.db2.gz	BRNPBJWFLBDPIB-SFHVURJKSA-N	0	3	329.444	3.195	20	30		EGEDHN
C#CCN(Cc1ccccc1)C(=O)NC[C@@H](Cc1ccccc1)N(C)C	ZINC000806308745	1317478258	/nfs/dbraw/zinc/47/82/58/1317478258.db2.gz	XQJCQNYYJZAUAN-OAQYLSRUSA-N	0	3	349.478	3.004	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@H](NC(=O)C3CCCCCC3)C2)c(F)c1	ZINC001020021770	1317504843	/nfs/dbraw/zinc/50/48/43/1317504843.db2.gz	BZPWMVXFJOBSJA-IYARVYRRSA-N	0	3	343.446	3.405	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)cc1	ZINC000807738237	1317581545	/nfs/dbraw/zinc/58/15/45/1317581545.db2.gz	CBVOPSPBVVIDIE-UTKZUKDTSA-N	0	3	348.446	3.091	20	30		EGEDHN
C[C@H]1[C@@H](NC(=O)Cc2ccccc2CC#N)CCN1Cc1ccccc1	ZINC000807738869	1317581946	/nfs/dbraw/zinc/58/19/46/1317581946.db2.gz	HVBIFQHDTCMPSE-UWJYYQICSA-N	0	3	347.462	3.074	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1C[C@H](NCc2cccc(F)c2F)C1	ZINC001020240136	1317605318	/nfs/dbraw/zinc/60/53/18/1317605318.db2.gz	XNVNHLREIJJOBI-SHTZXODSSA-N	0	3	345.393	3.003	20	30		EGEDHN
CC[C@@H](NCc1cccc(NS(C)(=O)=O)c1)c1cccc(C#N)c1	ZINC000902732466	1317608978	/nfs/dbraw/zinc/60/89/78/1317608978.db2.gz	DLBUXNOWPNDWGU-GOSISDBHSA-N	0	3	343.452	3.171	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)[C@@]2(C)CCC[C@H]2CC)C1	ZINC001020295136	1317630937	/nfs/dbraw/zinc/63/09/37/1317630937.db2.gz	MGHKBNKEZKVXTB-KQTLUZQSSA-N	0	3	343.309	3.348	20	30		EGEDHN
C[C@H](NCCCONC(=O)OC(C)(C)C)c1ccc(C#N)cc1F	ZINC000903238975	1317679656	/nfs/dbraw/zinc/67/96/56/1317679656.db2.gz	CPVZNIJBQCEKIV-LBPRGKRZSA-N	0	3	337.395	3.194	20	30		EGEDHN
C=C(Cl)COc1ccc([C@H](C)N[C@@H]2COCC[C@H]2OC)cc1	ZINC000903300208	1317685378	/nfs/dbraw/zinc/68/53/78/1317685378.db2.gz	WMJWWVWKBPBMPU-IAOVAPTHSA-N	0	3	325.836	3.272	20	30		EGEDHN
CCCOc1ccc(/C=C2\C(=O)c3ncnn3C2C)cc1OCC	ZINC000905080931	1317921126	/nfs/dbraw/zinc/92/11/26/1317921126.db2.gz	OKNUWRBUGFMBFP-OJLMPMFISA-N	0	3	327.384	3.307	20	30		EGEDHN
COc1ccc(/C=C2/C(=O)c3ncnn3C2C)cc1OCC(C)C	ZINC000905081277	1317922000	/nfs/dbraw/zinc/92/20/00/1317922000.db2.gz	QQVUXGQDWFMJRK-FUEWVNAISA-N	0	3	327.384	3.162	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)[C@@H]2C[C@@]2(CC)C(C)C)C1	ZINC001020853565	1317956818	/nfs/dbraw/zinc/95/68/18/1317956818.db2.gz	RUXOXTHUCJWINC-YXWQFLTLSA-N	0	3	343.309	3.204	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc(C)n(CC3CC3)c2C)C1	ZINC001020936090	1318003175	/nfs/dbraw/zinc/00/31/75/1318003175.db2.gz	VXNTZXGRFGXPGG-WKILWMFISA-N	0	3	335.879	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc(OCC(C)C)cc2)C1	ZINC001021014102	1318046347	/nfs/dbraw/zinc/04/63/47/1318046347.db2.gz	RIYZLGJULUGNCP-WKILWMFISA-N	0	3	336.863	3.324	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2c[nH]c3c2cccc3CC)C1	ZINC001021096784	1318081701	/nfs/dbraw/zinc/08/17/01/1318081701.db2.gz	YMCHZWYXQGNDFP-HDJSIYSDSA-N	0	3	331.847	3.333	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1	ZINC000811505413	1318187138	/nfs/dbraw/zinc/18/71/38/1318187138.db2.gz	KXXCMTOYKGDSAL-IBGZPJMESA-N	0	3	340.854	3.283	20	30		EGEDHN
CN(C)c1cc(Cl)cc(Cl)c1C=NNCCN1CCCCC1	ZINC000811638886	1318217024	/nfs/dbraw/zinc/21/70/24/1318217024.db2.gz	FXAXQNBORXZKSL-UHFFFAOYSA-N	0	3	343.302	3.469	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)C2CCCC2)cc1F	ZINC000959847244	1318224613	/nfs/dbraw/zinc/22/46/13/1318224613.db2.gz	YNMUPAFIJOTDCU-SFHVURJKSA-N	0	3	343.446	3.358	20	30		EGEDHN
C#C[C@H](NC(=O)NC[C@@H]1CCCCN1C1CC1)c1ccc(Cl)cc1	ZINC000811911467	1318289940	/nfs/dbraw/zinc/28/99/40/1318289940.db2.gz	PPOKIJDYWXKERK-ROUUACIJSA-N	0	3	345.874	3.330	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@H](CCCN3C(=O)c3ccc[nH]3)C2)c1	ZINC001021519372	1318347490	/nfs/dbraw/zinc/34/74/90/1318347490.db2.gz	NIQRUBURQYCLQW-QUCCMNQESA-N	0	3	348.450	3.013	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC000960101984	1318356516	/nfs/dbraw/zinc/35/65/16/1318356516.db2.gz	SGZCQVZCVBSXKE-FUHWJXTLSA-N	0	3	349.425	3.162	20	30		EGEDHN
C=C(C)CC[N@@H+]1CC[C@@H]2[C@H](CCCN2C(=O)c2ccccc2[O-])C1	ZINC001021529288	1318367026	/nfs/dbraw/zinc/36/70/26/1318367026.db2.gz	LYVXGBRTQRWYAJ-SJLPKXTDSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=C(C)CC[N@H+]1CC[C@@H]2[C@H](CCCN2C(=O)c2ccccc2[O-])C1	ZINC001021529288	1318367035	/nfs/dbraw/zinc/36/70/35/1318367035.db2.gz	LYVXGBRTQRWYAJ-SJLPKXTDSA-N	0	3	328.456	3.285	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@H](CCCN3C(=O)C=C3CCC3)C2)c1	ZINC001021559525	1318408693	/nfs/dbraw/zinc/40/86/93/1318408693.db2.gz	SBYLRRUCBGWSRP-NHCUHLMSSA-N	0	3	349.478	3.481	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@H](CCCN3C(=O)c3cc[nH]c3)C2)cc1	ZINC001021587194	1318430665	/nfs/dbraw/zinc/43/06/65/1318430665.db2.gz	BAVHFSIQKKDFIF-UXHICEINSA-N	0	3	348.450	3.013	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1Cc2ccccc2[C@H]1NCC(=C)C	ZINC000960270784	1318437715	/nfs/dbraw/zinc/43/77/15/1318437715.db2.gz	JUZRIMOSVODHNF-UYAOXDASSA-N	0	3	335.451	3.236	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc3occc3c2)C1	ZINC001021594765	1318439217	/nfs/dbraw/zinc/43/92/17/1318439217.db2.gz	PRVOBTCAFQLLHN-OALUTQOASA-N	0	3	336.435	3.383	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccsc1COC	ZINC000960279064	1318440945	/nfs/dbraw/zinc/44/09/45/1318440945.db2.gz	QXRUQPVYHSQQEK-SJLPKXTDSA-N	0	3	342.464	3.066	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1c(C)noc1C1CC1	ZINC000960288336	1318446010	/nfs/dbraw/zinc/44/60/10/1318446010.db2.gz	OIAXZRPLXDKLQT-SJLPKXTDSA-N	0	3	337.423	3.032	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@@H]1CCOc2ccccc21	ZINC000960316783	1318457841	/nfs/dbraw/zinc/45/78/41/1318457841.db2.gz	JBGCSUBTJDGYRQ-SFHLNBCPSA-N	0	3	348.446	3.111	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cncc2ccccc21	ZINC000960333249	1318465895	/nfs/dbraw/zinc/46/58/95/1318465895.db2.gz	GQSZNWPZPHDXSO-NHCUHLMSSA-N	0	3	343.430	3.406	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2c(C)cccc2Cl)C1	ZINC001021625379	1318475131	/nfs/dbraw/zinc/47/51/31/1318475131.db2.gz	PMFXIXUAXFHPOF-QFBILLFUSA-N	0	3	344.886	3.137	20	30		EGEDHN
CO[C@](C)(C(=O)C(C#N)c1nc2ccccc2n1C(F)F)C1CC1	ZINC000813061195	1318492544	/nfs/dbraw/zinc/49/25/44/1318492544.db2.gz	UFMDADGPFUIPFA-DIFFPNOSSA-N	0	3	333.338	3.423	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)/C=C\c1ccco1	ZINC000960370822	1318493010	/nfs/dbraw/zinc/49/30/10/1318493010.db2.gz	BOPYZXAENBBBKR-ZBTAVZRMSA-N	0	3	349.434	3.287	20	30		EGEDHN
CC(COC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)[N+](=O)[O-]	ZINC000813108351	1318500251	/nfs/dbraw/zinc/50/02/51/1318500251.db2.gz	DMNFFHIMQVSBRN-ZDUSSCGKSA-N	0	3	340.335	3.367	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2coc(C(F)F)c2)C1	ZINC001021660076	1318523773	/nfs/dbraw/zinc/52/37/73/1318523773.db2.gz	YDFSSWXCZVJEJJ-DZGCQCFKSA-N	0	3	336.382	3.167	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(C(C)C)cn2)C1	ZINC001021667523	1318530395	/nfs/dbraw/zinc/53/03/95/1318530395.db2.gz	INOSQJGSLONDCB-AZUAARDMSA-N	0	3	339.483	3.155	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)CC(C)(C)C	ZINC000960432431	1318555081	/nfs/dbraw/zinc/55/50/81/1318555081.db2.gz	JCAOVTJVKVPTBG-GOSISDBHSA-N	0	3	327.472	3.417	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2oc(C(C)C)nc2C)C1	ZINC001021686991	1318561208	/nfs/dbraw/zinc/56/12/08/1318561208.db2.gz	DNBZBDBBDSVJCN-IAGOWNOFSA-N	0	3	343.471	3.056	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)Cc2cccc3ccccc32)C1	ZINC001021716153	1318596265	/nfs/dbraw/zinc/59/62/65/1318596265.db2.gz	CJXOUWLCKYPWMX-IFMALSPDSA-N	0	3	346.474	3.328	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@@H]1CN(C)Cc1ccc(C(F)F)cc1	ZINC000960503159	1318611745	/nfs/dbraw/zinc/61/17/45/1318611745.db2.gz	PMDSHJMIIGHBFH-CZUORRHYSA-N	0	3	335.398	3.207	20	30		EGEDHN
Cc1cc(Cl)ccc1CN(C)C[C@@H]1CCCN1C(=O)[C@@H](C)C#N	ZINC000960502893	1318612437	/nfs/dbraw/zinc/61/24/37/1318612437.db2.gz	ONMQRTWIVMQPCG-YOEHRIQHSA-N	0	3	333.863	3.231	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccsc2C(F)F)C1	ZINC001021724932	1318616812	/nfs/dbraw/zinc/61/68/12/1318616812.db2.gz	PJDIFAXHOOFYKK-TZMCWYRMSA-N	0	3	338.423	3.245	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)Cc2ccccc2Cl)C1	ZINC001021726315	1318619135	/nfs/dbraw/zinc/61/91/35/1318619135.db2.gz	BCNFJRDQASRSLD-HKUYNNGSSA-N	0	3	344.886	3.219	20	30		EGEDHN
C#CCOc1ccc([C@@H](C)NCc2cc3ccccc3n(C)c2=O)cc1	ZINC000813883760	1318649604	/nfs/dbraw/zinc/64/96/04/1318649604.db2.gz	WPHUWZNREBJQGV-MRXNPFEDSA-N	0	3	346.430	3.401	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(C3CCCC3)no2)C1	ZINC001021742434	1318655923	/nfs/dbraw/zinc/65/59/23/1318655923.db2.gz	LDORJROINKAUFV-WMZOPIPTSA-N	0	3	343.471	3.445	20	30		EGEDHN
C[C@H](c1cccc(F)c1)N(C)C[C@H]1CCCN1C(=O)C#CC1CC1	ZINC000960624895	1318749811	/nfs/dbraw/zinc/74/98/11/1318749811.db2.gz	ROIJZMMXNGUWPB-DNVCBOLYSA-N	0	3	328.431	3.223	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@@H](NC(=O)C3=CCCCCC3)C2)c(F)c1	ZINC001022007037	1318766874	/nfs/dbraw/zinc/76/68/74/1318766874.db2.gz	OXFLBGGUPOFVTO-HDICACEKSA-N	0	3	341.430	3.325	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)NCCc1csc(-c2ccccc2)n1	ZINC000912000410	1318793235	/nfs/dbraw/zinc/79/32/35/1318793235.db2.gz	DFHKWMJEMOGMAY-INIZCTEOSA-N	0	3	329.469	3.152	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)NCc1cccc(NC(C)=O)c1	ZINC000912250694	1318855037	/nfs/dbraw/zinc/85/50/37/1318855037.db2.gz	URPVDJZSLFBKOT-SFHVURJKSA-N	0	3	333.476	3.339	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@@H](NC(=O)C[C@H]3C=CCCC3)C2)c(F)c1	ZINC001022269570	1318866117	/nfs/dbraw/zinc/86/61/17/1318866117.db2.gz	BFCHJMCIJDDZCD-JCGIZDLHSA-N	0	3	341.430	3.181	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)[C@]1(C)C=CCC1	ZINC000960792973	1318901488	/nfs/dbraw/zinc/90/14/88/1318901488.db2.gz	SHMSIRAEAOATRL-TZIWHRDSSA-N	0	3	337.467	3.337	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)[C@H]1C[C@H]2C[C@H]2C1	ZINC000960808473	1318923524	/nfs/dbraw/zinc/92/35/24/1318923524.db2.gz	KKRYOALJZHKCND-NMLBUPMWSA-N	0	3	337.467	3.027	20	30		EGEDHN
Cc1coc(C(=O)N2CCC[C@H]2CN(C)Cc2cccc(C#N)c2)c1	ZINC000960808550	1318924627	/nfs/dbraw/zinc/92/46/27/1318924627.db2.gz	LFDKDBCUEIFIRJ-SFHVURJKSA-N	0	3	337.423	3.196	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)[C@H]1CCC1(C)C	ZINC000960813573	1318931910	/nfs/dbraw/zinc/93/19/10/1318931910.db2.gz	GMSVHKGVIZPNMA-RTBURBONSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc(-c3cccs3)on2)C1	ZINC001022508611	1318972386	/nfs/dbraw/zinc/97/23/86/1318972386.db2.gz	UKMIVGNAKBTTDA-PHIMTYICSA-N	0	3	337.832	3.006	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2C[C@@H](NCc3sccc3Cl)C2)cc1	ZINC001022526640	1318978593	/nfs/dbraw/zinc/97/85/93/1318978593.db2.gz	JAXNNPZZPDTVFH-GASCZTMLSA-N	0	3	344.867	3.433	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)C1CC2(CC2)C1	ZINC000960853823	1318996747	/nfs/dbraw/zinc/99/67/47/1318996747.db2.gz	UILFEOBQJAQBCC-IBGZPJMESA-N	0	3	337.467	3.171	20	30		EGEDHN
CCc1ccc(C#CC(=O)N(CCN(C)C)Cc2cccs2)cc1	ZINC000815770237	1319052398	/nfs/dbraw/zinc/05/23/98/1319052398.db2.gz	VQNICUDQPCHECK-UHFFFAOYSA-N	0	3	340.492	3.252	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)[C@H]2CCC[C@@H](OC)C2)cc1	ZINC000815907796	1319071483	/nfs/dbraw/zinc/07/14/83/1319071483.db2.gz	KPJVCTMDOCXJCL-USXIJHARSA-N	0	3	328.412	3.102	20	30		EGEDHN
C=Cc1ccc(C(=O)N[C@H]2C[C@@H](NCC(=C)Br)C2)cc1	ZINC001022755454	1319089206	/nfs/dbraw/zinc/08/92/06/1319089206.db2.gz	CZILWHSZQXCUPT-GASCZTMLSA-N	0	3	335.245	3.089	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)[C@H]2CC[C@H](CC)CC2)C1	ZINC001022998230	1319207693	/nfs/dbraw/zinc/20/76/93/1319207693.db2.gz	BHCBZBYEGXMSLG-JNCCQOAMSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccccc2C(F)(F)F)C1	ZINC001023006589	1319214550	/nfs/dbraw/zinc/21/45/50/1319214550.db2.gz	QJCBNDSVTGQIRP-PHIMTYICSA-N	0	3	332.753	3.308	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)c2ccc(C)cc2C)C1	ZINC001023046842	1319235603	/nfs/dbraw/zinc/23/56/03/1319235603.db2.gz	GZFWHOAPSICZDS-OKILXGFUSA-N	0	3	337.261	3.062	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@H]([C@@H]2CCN(Cc3ccc(C#N)s3)C2)C1	ZINC000961139028	1319258502	/nfs/dbraw/zinc/25/85/02/1319258502.db2.gz	LOJOVEHMTJIRNK-JKSUJKDBSA-N	0	3	345.512	3.336	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@@H](C)c2ccc(F)c(F)c2)C1	ZINC001023110251	1319263972	/nfs/dbraw/zinc/26/39/72/1319263972.db2.gz	UZSZHNQFBHLQDD-WCFLWFBJSA-N	0	3	328.790	3.058	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@H]2CCCCc3ccccc32)C1	ZINC001023137687	1319280814	/nfs/dbraw/zinc/28/08/14/1319280814.db2.gz	QGQKZHHIPLVFRB-JZXOWHBKSA-N	0	3	332.875	3.486	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@H](CNC(=O)[C@@H]3CC=CCC3)C2)c1	ZINC001023230343	1319371463	/nfs/dbraw/zinc/37/14/63/1319371463.db2.gz	TVBZUPYZXBYCJA-VQTJNVASSA-N	0	3	337.467	3.243	20	30		EGEDHN
N#Cc1c[nH]c(C(=O)NC[C@@H]2CCCN(C/C=C\c3ccccc3)C2)c1	ZINC001023296498	1319424031	/nfs/dbraw/zinc/42/40/31/1319424031.db2.gz	YQRGLZBSPDNOGI-MSEQUDFZSA-N	0	3	348.450	3.042	20	30		EGEDHN
CC1(c2ccc(Br)cc2)CCN(C[C@H](O)CC#N)CC1	ZINC000930319469	1328832777	/nfs/dbraw/zinc/83/27/77/1328832777.db2.gz	OZGAKQKVJAGKCN-OAHLLOKOSA-N	0	3	337.261	3.077	20	30		EGEDHN
C#CCN(C)CCCNC(=O)CC1(CSc2ccccc2)CC1	ZINC000818609079	1319568403	/nfs/dbraw/zinc/56/84/03/1319568403.db2.gz	KDWUTIJVRGXXFZ-UHFFFAOYSA-N	0	3	330.497	3.020	20	30		EGEDHN
C#CCN1CCC[C@H](CNC(=O)c2sc3ccccc3c2C)C1	ZINC001023475621	1319576628	/nfs/dbraw/zinc/57/66/28/1319576628.db2.gz	BNPMEZAGIMAQDZ-OAHLLOKOSA-N	0	3	326.465	3.285	20	30		EGEDHN
CC(C)[C@H](NC[C@H](O)c1ccc(C#N)cc1)c1nc2ccccc2[nH]1	ZINC000818947681	1319585581	/nfs/dbraw/zinc/58/55/81/1319585581.db2.gz	QOLKNCZOZZIPTG-OALUTQOASA-N	0	3	334.423	3.455	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc3cscc3s2)C1	ZINC001023496987	1319603158	/nfs/dbraw/zinc/60/31/58/1319603158.db2.gz	UNNHLWMIKZMMOA-CYBMUJFWSA-N	0	3	332.494	3.428	20	30		EGEDHN
N#Cc1ccc(F)c(CNCC2CC(NC(=O)C3CCCCC3)C2)c1	ZINC000961501892	1319620511	/nfs/dbraw/zinc/62/05/11/1319620511.db2.gz	WQVAHEQPJAAFEI-UHFFFAOYSA-N	0	3	343.446	3.262	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)c2ccc(C(F)(F)F)cn2)c1	ZINC000916896636	1319721467	/nfs/dbraw/zinc/72/14/67/1319721467.db2.gz	MYWRHURGECCMOP-ZDUSSCGKSA-N	0	3	347.296	3.370	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000916912039	1319725342	/nfs/dbraw/zinc/72/53/42/1319725342.db2.gz	IDPNEFXYHTYMLS-MRXNPFEDSA-N	0	3	337.335	3.118	20	30		EGEDHN
N#CC(C(=O)COC1CCCC1)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000916940185	1319725872	/nfs/dbraw/zinc/72/58/72/1319725872.db2.gz	VOXVMOMFXVIKRH-GFCCVEGCSA-N	0	3	338.766	3.086	20	30		EGEDHN
Cc1ccc(SCC(=O)C(C#N)C(=O)NC2CCCC2)c(C)c1	ZINC000917040819	1319742946	/nfs/dbraw/zinc/74/29/46/1319742946.db2.gz	MSZCOJZKWMBUBH-HNNXBMFYSA-N	0	3	330.453	3.163	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)[C@@H]2C[C@H]2c2ccc(C)c(C)c2)C1	ZINC001023637543	1319758866	/nfs/dbraw/zinc/75/88/66/1319758866.db2.gz	OVKMCMOHTVIHGX-SESVDKBCSA-N	0	3	338.495	3.258	20	30		EGEDHN
C=C1CC(C)(C(=O)NC2CC(CNCc3cc(F)ccc3F)C2)C1	ZINC000962266567	1319891265	/nfs/dbraw/zinc/89/12/65/1319891265.db2.gz	FQSQHRKFSHUQKL-UHFFFAOYSA-N	0	3	334.410	3.306	20	30		EGEDHN
CCCCCCCOc1ccc(CN2CC[C@@H](O)[C@@H](CO)C2)cc1	ZINC000840976970	1321192199	/nfs/dbraw/zinc/19/21/99/1321192199.db2.gz	ZWJHQIICEMWRAL-UYAOXDASSA-N	0	3	335.488	3.211	20	30		EGEDHN
CC(C)n1cnnc1SCC(=O)C(C#N)c1nc(C2CC2)cs1	ZINC000842940052	1321451430	/nfs/dbraw/zinc/45/14/30/1321451430.db2.gz	WKIBARKYRJQFFK-LLVKDONJSA-N	0	3	347.469	3.161	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-]	ZINC000845876005	1321748622	/nfs/dbraw/zinc/74/86/22/1321748622.db2.gz	PEHZAZAJGWWCKX-ZOWXZIJZSA-N	0	3	325.336	3.056	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H]2C[C@@H](O)c2ccc(F)cc2)nc1	ZINC000846831710	1321813543	/nfs/dbraw/zinc/81/35/43/1321813543.db2.gz	KSEJURKZHRMBCS-RTBURBONSA-N	0	3	325.387	3.180	20	30		EGEDHN
CCC(C)(C)N1CCN(C(=O)Nc2ccccc2O[C@H](C)C#N)CC1	ZINC000847166137	1321847819	/nfs/dbraw/zinc/84/78/19/1321847819.db2.gz	IQKIKNJLQOCIPO-OAHLLOKOSA-N	0	3	344.459	3.316	20	30		EGEDHN
CC[C@@](C)(OC)C(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847747671	1321900556	/nfs/dbraw/zinc/90/05/56/1321900556.db2.gz	MRHCYWBGGHLXTC-LJQANCHMSA-N	0	3	344.455	3.151	20	30		EGEDHN
C[C@@]1(C(=O)OCC2(C#N)CCN(Cc3ccccc3)CC2)CC1(F)F	ZINC000847746781	1321900641	/nfs/dbraw/zinc/90/06/41/1321900641.db2.gz	QPPXHOVZUCCYFQ-KRWDZBQOSA-N	0	3	348.393	3.381	20	30		EGEDHN
N#CC1(COC(=O)/C=C\c2ccc[nH]2)CCN(Cc2ccccc2)CC1	ZINC000847747424	1321900690	/nfs/dbraw/zinc/90/06/90/1321900690.db2.gz	HITIGFRIKQDLBJ-HJWRWDBZSA-N	0	3	349.434	3.377	20	30		EGEDHN
N#CC1(COC(=O)CSC2CC2)CCN(Cc2ccccc2)CC1	ZINC000847747063	1321900830	/nfs/dbraw/zinc/90/08/30/1321900830.db2.gz	WUCCAUHKCJXSJA-UHFFFAOYSA-N	0	3	344.480	3.231	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)[C@@H]1C[C@H]1OC(C)(C)C)c1ccccc1	ZINC000850977903	1322318590	/nfs/dbraw/zinc/31/85/90/1322318590.db2.gz	GPNOOQVYHRGJDW-WCXIOVBPSA-N	0	3	342.439	3.166	20	30		EGEDHN
CC[C@@H](NC(=O)C(C#N)C(=O)[C@@H]1C[C@H]1OC(C)(C)C)c1ccccc1	ZINC000850977902	1322318706	/nfs/dbraw/zinc/31/87/06/1322318706.db2.gz	GPNOOQVYHRGJDW-QBPKDAKJSA-N	0	3	342.439	3.166	20	30		EGEDHN
Cc1ccc(CCNCc2cc(C#N)ccc2Br)cn1	ZINC000921723615	1322385955	/nfs/dbraw/zinc/38/59/55/1322385955.db2.gz	BKORPFXRXWVTQT-UHFFFAOYSA-N	0	3	330.229	3.357	20	30		EGEDHN
Cc1cnccc1CCNCc1cc(C#N)ccc1Br	ZINC000921931076	1322424954	/nfs/dbraw/zinc/42/49/54/1322424954.db2.gz	ANWSDOWVXMZQFJ-UHFFFAOYSA-N	0	3	330.229	3.357	20	30		EGEDHN
CCC1(O)CCC(NCc2cc(C#N)ccc2Br)CC1	ZINC000921960984	1322430542	/nfs/dbraw/zinc/43/05/42/1322430542.db2.gz	QPDSLTXRCJSEBJ-UHFFFAOYSA-N	0	3	337.261	3.494	20	30		EGEDHN
CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)N1CCC[C@@H](C#N)C1	ZINC000922021179	1322441514	/nfs/dbraw/zinc/44/15/14/1322441514.db2.gz	MSGAGIPSUAFJLM-RBUKOAKNSA-N	0	3	342.487	3.088	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(OCC#N)cc2)CC[C@H]1C(=O)OC(C)(C)C	ZINC000859614823	1329035234	/nfs/dbraw/zinc/03/52/34/1329035234.db2.gz	JVLHAXHQDHARQA-CRAIPNDOSA-N	0	3	344.455	3.389	20	30		EGEDHN
CC(=O)N[C@H](c1ccccc1F)[C@@H](C)NCc1ccc(C#N)cc1	ZINC000924701871	1323119767	/nfs/dbraw/zinc/11/97/67/1323119767.db2.gz	SOMCMWRWULLJTF-YJYMSZOUSA-N	0	3	325.387	3.053	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H](CNCc2ccccc2C#N)C1	ZINC001024090766	1323122972	/nfs/dbraw/zinc/12/29/72/1323122972.db2.gz	QARMDEWMYKFJRH-QGZVFWFLSA-N	0	3	339.483	3.489	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)N1CCC[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001024107744	1323140079	/nfs/dbraw/zinc/14/00/79/1323140079.db2.gz	WHVCRIYYPKCXTH-RDTXWAMCSA-N	0	3	349.425	3.020	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H](CNCc2ncc(C)s2)C1	ZINC001024137918	1323162772	/nfs/dbraw/zinc/16/27/72/1323162772.db2.gz	VXORISZRNIFSCR-CRAIPNDOSA-N	0	3	335.517	3.382	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@@H](CNCc3cc(F)ccc3C#N)C2)CC1	ZINC001024138528	1323164207	/nfs/dbraw/zinc/16/42/07/1323164207.db2.gz	MUDZIIPMUNGUHV-HNNXBMFYSA-N	0	3	343.446	3.216	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N1CCC[C@@H](CNCc2ccccc2C#N)C1	ZINC001024143688	1323168800	/nfs/dbraw/zinc/16/88/00/1323168800.db2.gz	RTSXOYOPPDPOPN-SQGPQFPESA-N	0	3	339.483	3.323	20	30		EGEDHN
N#Cc1ccccc1-c1ccc(CN2CC[C@H](N3CCOC3=O)C2)cc1	ZINC000852433888	1323193052	/nfs/dbraw/zinc/19/30/52/1323193052.db2.gz	BSVQMWONMFOMSK-IBGZPJMESA-N	0	3	347.418	3.252	20	30		EGEDHN
CN(CC(=O)C(C#N)c1nc2ccccc2s1)C[C@H]1CC1(C)C	ZINC000852771138	1323239892	/nfs/dbraw/zinc/23/98/92/1323239892.db2.gz	CGDAWHKDXZTJKI-CHWSQXEVSA-N	0	3	327.453	3.450	20	30		EGEDHN
CCC(=O)N1CCC[C@@H]([C@@H]2CCCN2Cc2ccc(F)c(C#N)c2)C1	ZINC000963213976	1323240114	/nfs/dbraw/zinc/24/01/14/1323240114.db2.gz	CQEHKRZTLGMGGR-APWZRJJASA-N	0	3	343.446	3.310	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)c2ccncc2)C1	ZINC000963242992	1323249573	/nfs/dbraw/zinc/24/95/73/1323249573.db2.gz	HIPWRKSWWMBLML-IRXDYDNUSA-N	0	3	333.863	3.151	20	30		EGEDHN
C=C(Br)CNC1CCC(N(C)C(=O)[C@@H]2CC2(C)C)CC1	ZINC000963246287	1323255970	/nfs/dbraw/zinc/25/59/70/1323255970.db2.gz	AYHLHQAJOKWRAR-RUXDESIVSA-N	0	3	343.309	3.300	20	30		EGEDHN
C[C@H](CC(=O)N1CCC[C@H](CNCc2ccccc2C#N)C1)C1CC1	ZINC001024280605	1323257806	/nfs/dbraw/zinc/25/78/06/1323257806.db2.gz	DKLIBWFJRMEOBR-IAGOWNOFSA-N	0	3	339.483	3.323	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1cccc(C(F)F)c1F	ZINC001024440878	1323402140	/nfs/dbraw/zinc/40/21/40/1323402140.db2.gz	UHWSLPFUTCGVMH-CYBMUJFWSA-N	0	3	338.373	3.371	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@@H]1CC[C@H](c2ccccc2)O1	ZINC001024442665	1323404652	/nfs/dbraw/zinc/40/46/52/1323404652.db2.gz	VGYXCKCCRNUYPB-ZCNNSNEGSA-N	0	3	342.483	3.454	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccnn1C1CCCC1	ZINC001024463957	1323420465	/nfs/dbraw/zinc/42/04/65/1323420465.db2.gz	MSWFTUHKNPRSGU-KRWDZBQOSA-N	0	3	330.476	3.159	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1cc(F)cc2ccoc21	ZINC001024519942	1323468717	/nfs/dbraw/zinc/46/87/17/1323468717.db2.gz	ZXGQEKZIONZDAS-INIZCTEOSA-N	0	3	328.387	3.180	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1coc2ccc(OC)cc21	ZINC001024547526	1323489181	/nfs/dbraw/zinc/48/91/81/1323489181.db2.gz	MJDMVDJEEIMRJI-OAHLLOKOSA-N	0	3	340.423	3.049	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccncc1OC(C)C	ZINC001024576517	1323512575	/nfs/dbraw/zinc/51/25/75/1323512575.db2.gz	VXLWVOQYZMBBCQ-INIZCTEOSA-N	0	3	331.460	3.029	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cc2ccccc2n1C	ZINC001024621017	1323549006	/nfs/dbraw/zinc/54/90/06/1323549006.db2.gz	HXVFWILFMQCBOC-QGZVFWFLSA-N	0	3	325.456	3.339	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@@H]1CCc2ccccc2C1	ZINC001024681988	1323596625	/nfs/dbraw/zinc/59/66/25/1323596625.db2.gz	UZNMQJPZRAGYJB-WOJBJXKFSA-N	0	3	326.484	3.338	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cccc(-n2cccn2)c1	ZINC001024706026	1323617754	/nfs/dbraw/zinc/61/77/54/1323617754.db2.gz	QXTKTQVKPOJZRE-LJQANCHMSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=CCCN1CCCC[C@H]1CNC(=O)c1occc1Br	ZINC001024712622	1323620762	/nfs/dbraw/zinc/62/07/62/1323620762.db2.gz	CIOQMCZQSNGHKR-LBPRGKRZSA-N	0	3	341.249	3.203	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccc(C(F)F)cc1F	ZINC001024726642	1323628151	/nfs/dbraw/zinc/62/81/51/1323628151.db2.gz	WZXAXUBFLHMJPN-CQSZACIVSA-N	0	3	338.373	3.371	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccc(O[C@H](C)CC)cc1	ZINC001024750055	1323653339	/nfs/dbraw/zinc/65/33/39/1323653339.db2.gz	KPKMEBHEERFGBV-MJGOQNOKSA-N	0	3	342.483	3.472	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCCCN2Cc2ccccc2C)nc1	ZINC001024764107	1323664219	/nfs/dbraw/zinc/66/42/19/1323664219.db2.gz	MUWVFNQIMQVGTD-HXUWFJFHSA-N	0	3	347.462	3.156	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)C12CC3CC(CC(C3)C1)C2	ZINC001024776297	1323677260	/nfs/dbraw/zinc/67/72/60/1323677260.db2.gz	WUNIJSUMTBETRV-TWJKGYNYSA-N	0	3	328.500	3.197	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1cc(C)nc2ccccc21	ZINC001024790446	1323695568	/nfs/dbraw/zinc/69/55/68/1323695568.db2.gz	JASRMJREAYXWOV-KRWDZBQOSA-N	0	3	335.451	3.151	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)c2ccsc2)s1	ZINC001024860892	1323751991	/nfs/dbraw/zinc/75/19/91/1323751991.db2.gz	HWRDZHOXLYGJRK-CQSZACIVSA-N	0	3	345.493	3.466	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC001025041047	1323843540	/nfs/dbraw/zinc/84/35/40/1323843540.db2.gz	RURQYHGGWNKWIW-KRWDZBQOSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCCC[C@@H]1CNCc1cccc(OC)n1	ZINC001025069909	1323870924	/nfs/dbraw/zinc/87/09/24/1323870924.db2.gz	RQTXTVLQZPBEQC-YLJYHZDGSA-N	0	3	345.487	3.163	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)Cc1cccs1	ZINC001025190920	1323970207	/nfs/dbraw/zinc/97/02/07/1323970207.db2.gz	CTPVYQQTKPLKHD-ROUUACIJSA-N	0	3	330.497	3.159	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1scnc1C	ZINC001025197014	1323981718	/nfs/dbraw/zinc/98/17/18/1323981718.db2.gz	FEZUKQKGSHGZJX-HOTGVXAUSA-N	0	3	333.501	3.487	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(C(C)C)n(C)n1	ZINC001025229419	1324015608	/nfs/dbraw/zinc/01/56/08/1324015608.db2.gz	JNTSBUOBSGCRNY-MSOLQXFVSA-N	0	3	344.503	3.189	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc2cc(C)cn2c1	ZINC001025238617	1324030087	/nfs/dbraw/zinc/03/00/87/1324030087.db2.gz	UAHZYWPFRQJNPR-NHCUHLMSSA-N	0	3	349.478	3.340	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1nc(C)sc1C	ZINC001025239341	1324031636	/nfs/dbraw/zinc/03/16/36/1324031636.db2.gz	DDPAFBLGYDCXBV-HOTGVXAUSA-N	0	3	333.501	3.405	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc(CC)o1	ZINC001025243719	1324039737	/nfs/dbraw/zinc/03/97/37/1324039737.db2.gz	DXGMMAAPTQRLGQ-MSOLQXFVSA-N	0	3	328.456	3.324	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(F)ccc1CC	ZINC001025247848	1324048980	/nfs/dbraw/zinc/04/89/80/1324048980.db2.gz	RHLUSZAEWIRDHZ-UXHICEINSA-N	0	3	342.458	3.480	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc(C)c(F)c1	ZINC001025250694	1324053233	/nfs/dbraw/zinc/05/32/33/1324053233.db2.gz	MPZOSVNNVRMEOT-RTBURBONSA-N	0	3	328.431	3.226	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)CCc1ccc(C)cc1	ZINC001025251540	1324054881	/nfs/dbraw/zinc/05/48/81/1324054881.db2.gz	SFVRWWLNGWXQQR-NHCUHLMSSA-N	0	3	338.495	3.406	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1c(C)cncc1C	ZINC001025252621	1324057141	/nfs/dbraw/zinc/05/71/41/1324057141.db2.gz	YTOKNUXBVHYANZ-MOPGFXCFSA-N	0	3	339.483	3.181	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccn2ccccc12	ZINC001025252551	1324057431	/nfs/dbraw/zinc/05/74/31/1324057431.db2.gz	XUYKLYHAVXURGM-VQTJNVASSA-N	0	3	335.451	3.032	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(C2CC2)on1	ZINC001025254590	1324061886	/nfs/dbraw/zinc/06/18/86/1324061886.db2.gz	LEMOZJOJQALFAC-SJORKVTESA-N	0	3	329.444	3.197	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)C1(C2CCC2)CCC1	ZINC001025256509	1324064886	/nfs/dbraw/zinc/06/48/86/1324064886.db2.gz	YCFUAVPJINRJQA-RTBURBONSA-N	0	3	328.500	3.436	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cccc(OC)c1C	ZINC001025274345	1324091300	/nfs/dbraw/zinc/09/13/00/1324091300.db2.gz	XALTVILXOYGTAD-MOPGFXCFSA-N	0	3	340.467	3.096	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc2ccccn2c1	ZINC001025275220	1324095353	/nfs/dbraw/zinc/09/53/53/1324095353.db2.gz	UUHXSAJVKOOQEU-VQTJNVASSA-N	0	3	335.451	3.032	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1nc(CC)oc1C	ZINC001025278483	1324099442	/nfs/dbraw/zinc/09/94/42/1324099442.db2.gz	SWOOFSYLLGLSHF-IAGOWNOFSA-N	0	3	343.471	3.028	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1c[nH]cc1C1CC1	ZINC001025284833	1324106451	/nfs/dbraw/zinc/10/64/51/1324106451.db2.gz	OHIYZPFYXJRMLL-UXHICEINSA-N	0	3	339.483	3.375	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(CC(C)C)c[nH]1	ZINC001025287003	1324108445	/nfs/dbraw/zinc/10/84/45/1324108445.db2.gz	BIJRATUBAKVNEC-WOJBJXKFSA-N	0	3	341.499	3.306	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)C1(C)CC(F)(F)C1	ZINC001025287828	1324109963	/nfs/dbraw/zinc/10/99/63/1324109963.db2.gz	GYNCNNPXBXVEBS-JKSUJKDBSA-N	0	3	338.442	3.291	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc(C2CC2)cn1	ZINC001025296315	1324127005	/nfs/dbraw/zinc/12/70/05/1324127005.db2.gz	JJTUNUWHAZIGLH-WOJBJXKFSA-N	0	3	337.467	3.051	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1c(C)nsc1C	ZINC001025300092	1324133295	/nfs/dbraw/zinc/13/32/95/1324133295.db2.gz	BGGVUPOQHOAIPI-IAGOWNOFSA-N	0	3	345.512	3.242	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cnc(CC)s1	ZINC001025301613	1324134707	/nfs/dbraw/zinc/13/47/07/1324134707.db2.gz	MWQDVIMBCAICMH-GJZGRUSLSA-N	0	3	333.501	3.351	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1c(C)cccc1F	ZINC001025303141	1324137656	/nfs/dbraw/zinc/13/76/56/1324137656.db2.gz	FELSNZAKUPMFCM-MSOLQXFVSA-N	0	3	328.431	3.226	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cccc3c(C)c(C)[nH]c32)C1	ZINC001025459823	1324304930	/nfs/dbraw/zinc/30/49/30/1324304930.db2.gz	SVHHRXQQHXLQMU-DLBZAZTESA-N	0	3	337.467	3.248	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(F)cc3ccoc32)C1	ZINC001025465879	1324310357	/nfs/dbraw/zinc/31/03/57/1324310357.db2.gz	WVVSJXMSDBAOMG-ZBFHGGJFSA-N	0	3	342.414	3.426	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(CCC)cc2)C1	ZINC001025522887	1324369205	/nfs/dbraw/zinc/36/92/05/1324369205.db2.gz	IPDYEOWIIKDTLT-YLJYHZDGSA-N	0	3	326.484	3.493	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cccc3c2ccn3C)C1	ZINC001025560115	1324407976	/nfs/dbraw/zinc/40/79/76/1324407976.db2.gz	ANXGQDYIRNUWDF-IRXDYDNUSA-N	0	3	337.467	3.032	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cccn2C2CCCC2)C1	ZINC001025574874	1324414024	/nfs/dbraw/zinc/41/40/24/1324414024.db2.gz	WEKFXKNYOIYYAA-ZWKOTPCHSA-N	0	3	341.499	3.457	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(OC)c(C3CC3)c2)C1	ZINC001025578421	1324417838	/nfs/dbraw/zinc/41/78/38/1324417838.db2.gz	IDSATLITFJGUDT-MAUKXSAKSA-N	0	3	340.467	3.036	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc3sccc3c2)C1	ZINC001025582179	1324422783	/nfs/dbraw/zinc/42/27/83/1324422783.db2.gz	PHQQOPAKXBJEFJ-PBHICJAKSA-N	0	3	326.465	3.365	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc3nc(C)sc3c2)C1	ZINC001025587427	1324431081	/nfs/dbraw/zinc/43/10/81/1324431081.db2.gz	MMSQVNKNEXVYCC-XJKSGUPXSA-N	0	3	341.480	3.068	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc3c(s2)CCCC3)C1	ZINC001025614672	1324468190	/nfs/dbraw/zinc/46/81/90/1324468190.db2.gz	NSIGEURVUGFHRF-WBVHZDCISA-N	0	3	344.524	3.481	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2c[nH]c3ccc(C)cc23)C1	ZINC001025629746	1324481393	/nfs/dbraw/zinc/48/13/93/1324481393.db2.gz	JWOMUZIGIFARHQ-DLBZAZTESA-N	0	3	337.467	3.330	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cnc(CC(C)C)s2)C1	ZINC001025632357	1324484342	/nfs/dbraw/zinc/48/43/42/1324484342.db2.gz	JYXSEMCBQSKCMR-JKSUJKDBSA-N	0	3	347.528	3.195	20	30		EGEDHN
CC(C)=C(F)C(=O)N1C[C@@H]2CC[C@@H](NCc3ccccc3C#N)[C@H]2C1	ZINC001026240675	1324683777	/nfs/dbraw/zinc/68/37/77/1324683777.db2.gz	MRDROSNRZZXCCR-OKZBNKHCSA-N	0	3	341.430	3.148	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H]2CC[C@H](NCc3ncc(C)s3)[C@@H]2C1	ZINC001026330913	1324731052	/nfs/dbraw/zinc/73/10/52/1324731052.db2.gz	MYQLJDXFPYKHSB-XHSDSOJGSA-N	0	3	347.528	3.380	20	30		EGEDHN
N#Cc1ccccc1CNC1CCC(NC(=O)C[C@@H]2C=CCC2)CC1	ZINC001026450154	1324814329	/nfs/dbraw/zinc/81/43/29/1324814329.db2.gz	MEGVISFHFBRKAE-PBPGXSGUSA-N	0	3	337.467	3.432	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)NC1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001026475238	1324834475	/nfs/dbraw/zinc/83/44/75/1324834475.db2.gz	ANSBKWRUXFFQPU-DAWZGUTISA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)C2(F)CCCC2)CC1	ZINC001026518089	1324863629	/nfs/dbraw/zinc/86/36/29/1324863629.db2.gz	FXPIWALRMAGZRY-UHFFFAOYSA-N	0	3	347.272	3.194	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)CC(F)(F)F)C1	ZINC000963272029	1325050822	/nfs/dbraw/zinc/05/08/22/1325050822.db2.gz	RBYPXSGVLJZLPT-CHWSQXEVSA-N	0	3	338.801	3.394	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](CNCc2cc(-c3ccco3)on2)C1	ZINC001026992757	1325130533	/nfs/dbraw/zinc/13/05/33/1325130533.db2.gz	RYYXRPGKUAOXOD-CQSZACIVSA-N	0	3	343.427	3.085	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](CNCc2ccn(C(CC)CC)n2)C1	ZINC001026992460	1325131140	/nfs/dbraw/zinc/13/11/40/1325131140.db2.gz	MZQNZWREHNWPKA-MRXNPFEDSA-N	0	3	346.519	3.395	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCN(C(=O)c2ccoc2C2CC2)C1	ZINC001027022389	1325159159	/nfs/dbraw/zinc/15/91/59/1325159159.db2.gz	MDYDMZPOZHCJKT-OAHLLOKOSA-N	0	3	349.434	3.281	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H](CNCc2oc(CCC)nc2C)C1	ZINC001027039060	1325172977	/nfs/dbraw/zinc/17/29/77/1325172977.db2.gz	UZWUVJHLSLFZMC-OXQOHEQNSA-N	0	3	347.503	3.476	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCN(C(=O)c2occc2Cl)C1	ZINC001027044855	1325180641	/nfs/dbraw/zinc/18/06/41/1325180641.db2.gz	HCMKHNNDBLKJMA-CYBMUJFWSA-N	0	3	343.814	3.057	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)Cc2ccco2)C1	ZINC000963374708	1325180756	/nfs/dbraw/zinc/18/07/56/1325180756.db2.gz	RXSBZRXMDYRYEX-WBVHZDCISA-N	0	3	336.863	3.278	20	30		EGEDHN
Cc1cccc(C(=O)N2CC[C@@H](CNCc3ccccc3C#N)C2)c1C	ZINC001027198414	1325296628	/nfs/dbraw/zinc/29/66/28/1325296628.db2.gz	WJCZRMZLTHHKFA-SFHVURJKSA-N	0	3	347.462	3.427	20	30		EGEDHN
C=C[C@@H](C(=O)N1CC[C@@H](CNCc2nccs2)C1)c1ccccc1	ZINC001027231329	1325326670	/nfs/dbraw/zinc/32/66/70/1325326670.db2.gz	QRSJDZQMNDNRDP-DOTOQJQBSA-N	0	3	341.480	3.051	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)C2CCCC2)C1	ZINC001027269130	1325372741	/nfs/dbraw/zinc/37/27/41/1325372741.db2.gz	FXYLWOVERMYFLJ-LJQANCHMSA-N	0	3	325.456	3.171	20	30		EGEDHN
Cc1cc[nH]c1C(=O)NC1CC2(CC(NCc3ccccc3C#N)C2)C1	ZINC000963730382	1325389969	/nfs/dbraw/zinc/38/99/69/1325389969.db2.gz	BGRPLDHVQHNUPQ-UHFFFAOYSA-N	0	3	348.450	3.026	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)[C@H]1CCC[C@H](F)C1)C2	ZINC000963790264	1325401341	/nfs/dbraw/zinc/40/13/41/1325401341.db2.gz	ICUSKYJWIWILPW-IZHXIGCISA-N	0	3	328.859	3.284	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)CCC2CC2)C1	ZINC001027339876	1325498372	/nfs/dbraw/zinc/49/83/72/1325498372.db2.gz	JIPYGAXGPUHIPE-IBGZPJMESA-N	0	3	325.456	3.171	20	30		EGEDHN
C#CCN1CCC(C(=O)NCC(CC)(CC)c2ccc(F)cc2)CC1	ZINC000856519378	1325510458	/nfs/dbraw/zinc/51/04/58/1325510458.db2.gz	CGSNRFFGULWCMI-UHFFFAOYSA-N	0	3	344.474	3.345	20	30		EGEDHN
C[C@@]1(C(=O)NC2CC3(CC(NCc4ccccc4C#N)C3)C2)C=CCC1	ZINC000964617462	1325581816	/nfs/dbraw/zinc/58/18/16/1325581816.db2.gz	JWGQTZHEYDJHKO-QXXBNALYSA-N	0	3	349.478	3.432	20	30		EGEDHN
CN(Cc1cccc(Cl)c1)[C@H]1CCCN(C(=O)C#CC2CC2)C1	ZINC001027405394	1327632556	/nfs/dbraw/zinc/63/25/56/1327632556.db2.gz	GSLQKPQXWVXNLQ-SFHVURJKSA-N	0	3	330.859	3.176	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1nc(Cl)cs1)C2	ZINC000964671929	1327633300	/nfs/dbraw/zinc/63/33/00/1327633300.db2.gz	ZTOJIODHOTWNFL-UHFFFAOYSA-N	0	3	346.283	3.180	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)[C@@H]2CCC2(F)F)C1	ZINC001027458446	1327701779	/nfs/dbraw/zinc/70/17/79/1327701779.db2.gz	JHSCVFNXRKMUIX-IRXDYDNUSA-N	0	3	347.409	3.026	20	30		EGEDHN
CN(Cc1ccc(C#N)c(F)c1)[C@H]1CCCN(C(=O)CC2(C)CC2)C1	ZINC001027496879	1327761306	/nfs/dbraw/zinc/76/13/06/1327761306.db2.gz	ZGNDLTBNRHHAAW-KRWDZBQOSA-N	0	3	343.446	3.310	20	30		EGEDHN
CC(C)[C@H](F)C(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)c(F)c2)C1	ZINC001027535243	1327825609	/nfs/dbraw/zinc/82/56/09/1327825609.db2.gz	WOFVMLUEHPGKEL-WMZOPIPTSA-N	0	3	349.425	3.114	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@H](N(C)Cc3cccc(C#N)c3)C2)CC1	ZINC001027562432	1327882547	/nfs/dbraw/zinc/88/25/47/1327882547.db2.gz	PFDRZQKTYULHJC-SFHVURJKSA-N	0	3	325.456	3.171	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H](N(C)CCc3csc(C)n3)C2)C1	ZINC001027566103	1327894145	/nfs/dbraw/zinc/89/41/45/1327894145.db2.gz	GFUMXNGYTWPGPN-KRWDZBQOSA-N	0	3	347.528	3.273	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H](N(C)Cc3cccc(C#N)c3)C2)C1	ZINC001027567740	1327897682	/nfs/dbraw/zinc/89/76/82/1327897682.db2.gz	ZNHSMKLBVUIBEO-LJQANCHMSA-N	0	3	337.467	3.337	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H](N(C)Cc2cccc(C#N)c2)C1)C(C)(F)F	ZINC001027580516	1327915852	/nfs/dbraw/zinc/91/58/52/1327915852.db2.gz	XGTVRWZNGUXTAM-PBHICJAKSA-N	0	3	349.425	3.272	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)c2ccccc2O[C@@H](C)CC)C1	ZINC001027596650	1327948189	/nfs/dbraw/zinc/94/81/89/1327948189.db2.gz	XZOTYALHCWETDE-IRXDYDNUSA-N	0	3	328.456	3.034	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)c(F)c2)C1	ZINC001027604878	1327961654	/nfs/dbraw/zinc/96/16/54/1327961654.db2.gz	UDAOKCYKFIKIPJ-MAUKXSAKSA-N	0	3	345.462	3.412	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)c2ccc(O[C@@H](C)CC)cc2)C1	ZINC001027640338	1328012926	/nfs/dbraw/zinc/01/29/26/1328012926.db2.gz	QURIQGSZEXXWMH-FUHWJXTLSA-N	0	3	328.456	3.034	20	30		EGEDHN
C=C(Cl)CN(C)[C@@H]1CCCN(C(=O)c2cccc(CN(C)C)c2)C1	ZINC001027692348	1328096522	/nfs/dbraw/zinc/09/65/22/1328096522.db2.gz	GPLOXHRNYIDGDK-GOSISDBHSA-N	0	3	349.906	3.037	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cc(C(F)F)ccc2F)C1	ZINC000966164543	1328210792	/nfs/dbraw/zinc/21/07/92/1328210792.db2.gz	CAEUXDIMBQQGEA-WBMJQRKESA-N	0	3	338.373	3.227	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CN(Cc2ccccc2)CC[C@H]1C	ZINC000966691132	1328382646	/nfs/dbraw/zinc/38/26/46/1328382646.db2.gz	DJIAPNSHAAHVDY-IEBWSBKVSA-N	0	3	337.467	3.315	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1ocnc1-c1ccccc1	ZINC001027925970	1328404573	/nfs/dbraw/zinc/40/45/73/1328404573.db2.gz	HLYALZKUGMUDNF-INIZCTEOSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1cc(C2CCCCC2)n[nH]1	ZINC001027935887	1328414106	/nfs/dbraw/zinc/41/41/06/1328414106.db2.gz	UCONFYRZCUBMQE-INIZCTEOSA-N	0	3	330.476	3.228	20	30		EGEDHN
C=C(C)CCN1CCC[C@H]1CNC(=O)c1scnc1C(F)(F)F	ZINC001027939609	1328416816	/nfs/dbraw/zinc/41/68/16/1328416816.db2.gz	USJMZHXWTYLTOW-NSHDSACASA-N	0	3	347.406	3.322	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1cc(C)n(C(CC)CC)n1	ZINC001027983564	1328455980	/nfs/dbraw/zinc/45/59/80/1328455980.db2.gz	APUFZZKORYMQCX-KRWDZBQOSA-N	0	3	332.492	3.323	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2ccccc2-c2ccncc2)C1	ZINC000966908982	1328469531	/nfs/dbraw/zinc/46/95/31/1328469531.db2.gz	YBCSQMOSGAQNMR-LAUBAEHRSA-N	0	3	347.462	3.212	20	30		EGEDHN
C#CCCN1CCC[C@H]1CNC(=O)c1cc(C2CC2)oc1C1CC1	ZINC001028037517	1328503092	/nfs/dbraw/zinc/50/30/92/1328503092.db2.gz	ZNCDXGOPUDIUQF-INIZCTEOSA-N	0	3	326.440	3.252	20	30		EGEDHN
C#CCN1CCC(C(=O)NCc2cc(C)n(-c3ccccc3)c2C)CC1	ZINC000863165195	1329531608	/nfs/dbraw/zinc/53/16/08/1329531608.db2.gz	NKTMFOULSRMMMJ-UHFFFAOYSA-N	0	3	349.478	3.056	20	30		EGEDHN
CCN1CCN(c2ccc(NC(=O)c3ccccc3CC#N)cc2)CC1	ZINC000864567465	1329626382	/nfs/dbraw/zinc/62/63/82/1329626382.db2.gz	KZISIYPABVQANV-UHFFFAOYSA-N	0	3	348.450	3.147	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC2(C1)CCN(Cc1c(C)onc1CC)CC2	ZINC001050618460	1348304195	/nfs/dbraw/zinc/30/41/95/1348304195.db2.gz	WILKNVHFYQEQGW-UHFFFAOYSA-N	0	3	345.487	3.182	20	30		EGEDHN
CN(C)C[C@H](NC(=O)Nc1sccc1C#N)c1ccc(F)cc1	ZINC000931838355	1329765332	/nfs/dbraw/zinc/76/53/32/1329765332.db2.gz	WKEOHRKUSJDSCQ-AWEZNQCLSA-N	0	3	332.404	3.183	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@H](N[C@H](c3ccncc3)C3CC3)C2=O)cc1	ZINC000934695923	1330000614	/nfs/dbraw/zinc/00/06/14/1330000614.db2.gz	DUDBFSCCQUPLOP-PMACEKPBSA-N	0	3	346.434	3.190	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc(N(CC)CC)cc2)CC1	ZINC001052892580	1348729052	/nfs/dbraw/zinc/72/90/52/1348729052.db2.gz	GEQVEAHTBJKQSD-IBGZPJMESA-N	0	3	341.499	3.140	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccc3ccc(C)nc32)[C@H](C)C1	ZINC000942168659	1331857396	/nfs/dbraw/zinc/85/73/96/1331857396.db2.gz	YBSYPUHPIQTPKE-DNVCBOLYSA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(C)CCC(F)(F)CC2)[C@H](C)C1	ZINC000942192216	1331872799	/nfs/dbraw/zinc/87/27/99/1331872799.db2.gz	MMUFLNODIPGFRE-HUUCEWRRSA-N	0	3	326.431	3.052	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2c(C)c(F)ccc2Cl)[C@@H](C)C1	ZINC000942194167	1331873552	/nfs/dbraw/zinc/87/35/52/1331873552.db2.gz	ZSTVMXCLWYBMOI-LRDDRELGSA-N	0	3	336.838	3.251	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2cccc(C)c2Cl)[C@@H](C)C1	ZINC000942467978	1331941169	/nfs/dbraw/zinc/94/11/69/1331941169.db2.gz	VRAIURDRYSTSEB-DOTOQJQBSA-N	0	3	332.875	3.041	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccccc2OCC(C)C)[C@@H](C)C1	ZINC000943688634	1332238920	/nfs/dbraw/zinc/23/89/20/1332238920.db2.gz	FBDQFDRASBJEMS-PKOBYXMFSA-N	0	3	342.483	3.185	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(-c3ccccc3)ccn2)[C@@H](C)C1	ZINC000943767176	1332259451	/nfs/dbraw/zinc/25/94/51/1332259451.db2.gz	RQDOOXUKGHRUPM-LPHOPBHVSA-N	0	3	335.451	3.375	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnc(-c3ccco3)s2)[C@@H](C)C1	ZINC000944243244	1332352840	/nfs/dbraw/zinc/35/28/40/1332352840.db2.gz	ZUELCZWQPBHLHT-QWHCGFSZSA-N	0	3	331.441	3.029	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccsc2C(F)(F)F)[C@@H](C)C1	ZINC000944345296	1332380037	/nfs/dbraw/zinc/38/00/37/1332380037.db2.gz	FJUKIUABJKFURU-WCQYABFASA-N	0	3	344.402	3.230	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccsc2C(F)F)[C@H](C)C1	ZINC000944535783	1332415651	/nfs/dbraw/zinc/41/56/51/1332415651.db2.gz	ZBMJFEDGLSGAKW-YPMHNXCESA-N	0	3	326.412	3.149	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3ccc(Cl)cc3)CC2)[C@@H](C)C1	ZINC000944655460	1332421515	/nfs/dbraw/zinc/42/15/15/1332421515.db2.gz	QNPFTCYDAHQLNE-MAUKXSAKSA-N	0	3	344.886	3.222	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3c(s2)CCCC3)[C@@H](C)C1	ZINC000944702791	1332423152	/nfs/dbraw/zinc/42/31/52/1332423152.db2.gz	UGABXHQWFZJFQG-GOEBONIOSA-N	0	3	330.497	3.090	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(COC(C)C)cc2)[C@@H](C)C1	ZINC000944810302	1332426357	/nfs/dbraw/zinc/42/63/57/1332426357.db2.gz	HONHCFGRKWYEHD-PXNSSMCTSA-N	0	3	342.483	3.075	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc3ccccc3c2)[C@H](C)C1	ZINC000944814237	1332428086	/nfs/dbraw/zinc/42/80/86/1332428086.db2.gz	XQTPGJWMVNUYBZ-DYESRHJHSA-N	0	3	334.463	3.232	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3cccc(F)c3o2)[C@H](C)C1	ZINC000945061994	1332491117	/nfs/dbraw/zinc/49/11/17/1332491117.db2.gz	KPSLONGXBKQTKC-CZUORRHYSA-N	0	3	328.387	3.035	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2c(C)oc3ccccc32)[C@H](C)C1	ZINC000946315065	1332786086	/nfs/dbraw/zinc/78/60/86/1332786086.db2.gz	WKTGQXVXCPTZNK-BEFAXECRSA-N	0	3	338.451	3.134	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cscc2C(F)(F)F)[C@@H](C)C1	ZINC000946315476	1332786624	/nfs/dbraw/zinc/78/66/24/1332786624.db2.gz	XCYJZKQOWYLSIG-GWCFXTLKSA-N	0	3	332.391	3.393	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3[nH]ccc3C3CC3)CC[C@@H]2C1	ZINC000946617457	1332864146	/nfs/dbraw/zinc/86/41/46/1332864146.db2.gz	INJDDUGVIZCOJG-IYBDPMFKSA-N	0	3	347.890	3.429	20	30		EGEDHN
Cc1ccoc1C(=O)N[C@@H]1CCN(Cc2cccc(C#N)c2)[C@@H](C)C1	ZINC000947057324	1332994135	/nfs/dbraw/zinc/99/41/35/1332994135.db2.gz	QNMJBVYPAXNOIO-MAUKXSAKSA-N	0	3	337.423	3.243	20	30		EGEDHN
Cc1cccc(C(=O)N[C@@H]2CCN(Cc3cccc(C#N)c3)[C@@H](C)C2)n1	ZINC000947075317	1333003073	/nfs/dbraw/zinc/00/30/73/1333003073.db2.gz	PEDLXXOKXCZHMR-QFBILLFUSA-N	0	3	348.450	3.045	20	30		EGEDHN
Cc1cccnc1C(=O)N[C@H]1CCN(Cc2cccc(C#N)c2)[C@H](C)C1	ZINC000947157460	1333028096	/nfs/dbraw/zinc/02/80/96/1333028096.db2.gz	PLLUKTHJSORXFY-APWZRJJASA-N	0	3	348.450	3.045	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc3nccc(C)c3c2)C[C@@H]1C	ZINC000947346866	1333098029	/nfs/dbraw/zinc/09/80/29/1333098029.db2.gz	BNMBDYIQEQCQMH-WMZOPIPTSA-N	0	3	335.451	3.149	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc(-c3ccncc3)o2)C[C@H]1C	ZINC000947381811	1333109467	/nfs/dbraw/zinc/10/94/67/1333109467.db2.gz	CFZKEXFBKKHVBO-ZBFHGGJFSA-N	0	3	325.412	3.110	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2sc(C)nc2CC(C)C)C[C@H]1C	ZINC000947506306	1333149348	/nfs/dbraw/zinc/14/93/48/1333149348.db2.gz	NLASSHRBISRVPS-ZBFHGGJFSA-N	0	3	347.528	3.256	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(-c3ccccc3)on2)C[C@@H]1C	ZINC000947523526	1333157068	/nfs/dbraw/zinc/15/70/68/1333157068.db2.gz	DSGGJJGXJLNXGG-HOCLYGCPSA-N	0	3	325.412	3.110	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3cccc(F)c3)CCC2)C[C@@H]1C	ZINC000947599647	1333188894	/nfs/dbraw/zinc/18/88/94/1333188894.db2.gz	XDCFMDOJAXHZAO-LPHOPBHVSA-N	0	3	342.458	3.240	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3cccc(C)c3)CCC2)C[C@@H]1C	ZINC000947602216	1333189884	/nfs/dbraw/zinc/18/98/84/1333189884.db2.gz	JCWJXMALNXAATL-ICSRJNTNSA-N	0	3	338.495	3.409	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2c(F)ccc(F)c2Cl)C[C@H]1C	ZINC000947741191	1333246823	/nfs/dbraw/zinc/24/68/23/1333246823.db2.gz	JCBYMKXWPRSOGU-NEPJUHHUSA-N	0	3	340.801	3.224	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2c(F)ccc(F)c2Cl)C[C@@H]1C	ZINC000947741193	1333246987	/nfs/dbraw/zinc/24/69/87/1333246987.db2.gz	JCBYMKXWPRSOGU-RYUDHWBXSA-N	0	3	340.801	3.224	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc(F)c(Cl)c2)C[C@@H]1C	ZINC000947747342	1333249162	/nfs/dbraw/zinc/24/91/62/1333249162.db2.gz	WLGBFTWJYWNOHI-DZGCQCFKSA-N	0	3	336.838	3.014	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2csc(-c3ccoc3)n2)C[C@@H]1C	ZINC000947820394	1333270860	/nfs/dbraw/zinc/27/08/60/1333270860.db2.gz	LCTNTUAITFQDRW-JSGCOSHPSA-N	0	3	331.441	3.172	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(-c3ccccc3)nc2)C[C@@H]1C	ZINC000947849965	1333279618	/nfs/dbraw/zinc/27/96/18/1333279618.db2.gz	WIBFJKPVDPZRQO-FXAWDEMLSA-N	0	3	347.462	3.355	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2sc(CC3CC3)nc2C)C[C@H]1C	ZINC000947861458	1333284196	/nfs/dbraw/zinc/28/41/96/1333284196.db2.gz	MSJCVRSIVKQTIE-CZUORRHYSA-N	0	3	345.512	3.010	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cccc(-c3cnco3)c2)C[C@H]1C	ZINC000947882802	1333290897	/nfs/dbraw/zinc/29/08/97/1333290897.db2.gz	XHNFEXZOKXVIFT-RHSMWYFYSA-N	0	3	325.412	3.110	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnn(C3CCCCC3)c2)C[C@H]1C	ZINC000947899035	1333297053	/nfs/dbraw/zinc/29/70/53/1333297053.db2.gz	DERGNCQINKYKPJ-NVXWUHKLSA-N	0	3	330.476	3.157	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C(C)(C)c2ccc(F)cc2)C[C@@H]1C	ZINC000947943181	1333313711	/nfs/dbraw/zinc/31/37/11/1333313711.db2.gz	JADFFGXRJIKRHH-YJBOKZPZSA-N	0	3	330.447	3.096	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)c(F)cc2Cl)C[C@@H]1C	ZINC000947975302	1333329149	/nfs/dbraw/zinc/32/91/49/1333329149.db2.gz	LZJSQGUFGANLEC-UONOGXRCSA-N	0	3	336.838	3.394	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(F)c(F)cc2Cl)C[C@@H]1C	ZINC000947998822	1333337442	/nfs/dbraw/zinc/33/74/42/1333337442.db2.gz	PKNLSVQAIDDCMK-NWDGAFQWSA-N	0	3	340.801	3.224	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccccc2OCC2CC2)C[C@H]1C	ZINC000948067792	1333362817	/nfs/dbraw/zinc/36/28/17/1333362817.db2.gz	YZRMUSLBSXTPKF-AEFFLSMTSA-N	0	3	340.467	3.081	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2cc(Br)co2)CC1	ZINC001197339653	1368791210	/nfs/dbraw/zinc/79/12/10/1368791210.db2.gz	ZRUDXKCFZICUNA-UHFFFAOYSA-N	0	3	341.249	3.156	20	30		EGEDHN
CN(C(=O)C=C1CCC1)[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948286291	1333463767	/nfs/dbraw/zinc/46/37/67/1333463767.db2.gz	PPIIYCUHZBMPSG-HXUWFJFHSA-N	0	3	337.467	3.481	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)[C@@H]2C[C@H]2c2sccc2C)CC1	ZINC000948368272	1333496844	/nfs/dbraw/zinc/49/68/44/1333496844.db2.gz	HBCZJHPFCUTDFV-BRWVUGGUSA-N	0	3	330.497	3.106	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N(C)[C@H]1CCCN(C/C=C\Cl)CC1	ZINC000948385011	1333504241	/nfs/dbraw/zinc/50/42/41/1333504241.db2.gz	HECBZAWFPDAHSG-CMADERHVSA-N	0	3	340.895	3.033	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)Cc2ccc(C(F)F)cc2)CC1	ZINC000948612064	1333595626	/nfs/dbraw/zinc/59/56/26/1333595626.db2.gz	KWJSYFSGHTUDDJ-KRWDZBQOSA-N	0	3	334.410	3.113	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)Cc2cccc(C(F)F)c2)CC1	ZINC000948612718	1333596835	/nfs/dbraw/zinc/59/68/35/1333596835.db2.gz	QPIRZISWKZJPJZ-KRWDZBQOSA-N	0	3	334.410	3.113	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2ccc(C)c3cccnc23)CC1	ZINC000948626052	1333602046	/nfs/dbraw/zinc/60/20/46/1333602046.db2.gz	XEDHGPYKGCYFDG-SFHVURJKSA-N	0	3	349.478	3.493	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)[C@H]2CCc3ccccc3C2)CC1	ZINC000948813163	1333694154	/nfs/dbraw/zinc/69/41/54/1333694154.db2.gz	VQCHMOGLWYIZGY-SFTDATJTSA-N	0	3	338.495	3.128	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2cc(C)oc2C(F)(F)F)CC1	ZINC000948820163	1333697758	/nfs/dbraw/zinc/69/77/58/1333697758.db2.gz	AVPWXQFICBUQPW-ZDUSSCGKSA-N	0	3	342.361	3.167	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N(C)[C@H]1CCCN(C/C=C\Cl)CC1	ZINC000948852977	1333710132	/nfs/dbraw/zinc/71/01/32/1333710132.db2.gz	ZGDLBNYHRLPNDN-LGYLBKJUSA-N	0	3	340.895	3.033	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@H]1CNC(=O)[C@@H]1CCCOC1	ZINC000948899235	1333724155	/nfs/dbraw/zinc/72/41/55/1333724155.db2.gz	RMYNIDAFJUFSDX-UYAOXDASSA-N	0	3	342.483	3.095	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NC[C@@H]1c2ccccc2CCN1C(C)C	ZINC000948970492	1333751472	/nfs/dbraw/zinc/75/14/72/1333751472.db2.gz	YVYSZOHNFNXEGL-ZCNNSNEGSA-N	0	3	342.483	3.092	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccc(CCC)s1)CCO2	ZINC000949108847	1333779141	/nfs/dbraw/zinc/77/91/41/1333779141.db2.gz	ZASBPWKROJDJTG-UHFFFAOYSA-N	0	3	348.512	3.194	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1CCC[C@H]1CCC)CCO2	ZINC000949129551	1333781886	/nfs/dbraw/zinc/78/18/86/1333781886.db2.gz	NQKADBQIEWXHHN-MSOLQXFVSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)CC(C)(C)C3CC3)CC2)C1	ZINC000949358371	1333829614	/nfs/dbraw/zinc/82/96/14/1333829614.db2.gz	RCPRQHYZLUJYBJ-UHFFFAOYSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@H]3CCCC4(CC4)C3)CC2)C1	ZINC000949366178	1333831451	/nfs/dbraw/zinc/83/14/51/1333831451.db2.gz	XFVWRHRIVBDBCE-SFHVURJKSA-N	0	3	346.515	3.226	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C[C@@H]3CC[C@@H](C)C3)CC2)C1	ZINC000949445049	1333849020	/nfs/dbraw/zinc/84/90/20/1333849020.db2.gz	SPGZAUVPTSBOFW-RTBURBONSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@H]3CCC[C@H]3CC)CC2)C1	ZINC000949466837	1333855719	/nfs/dbraw/zinc/85/57/19/1333855719.db2.gz	UMJDQDSSZWFNDE-MSOLQXFVSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)c3csc(C)c3)CC2)C1	ZINC000949495946	1333861210	/nfs/dbraw/zinc/86/12/10/1333861210.db2.gz	JAOALKKFTODBOX-UHFFFAOYSA-N	0	3	348.512	3.330	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)Cc2ccc(CC(C)C)cc2)C1	ZINC000967274683	1335684047	/nfs/dbraw/zinc/68/40/47/1335684047.db2.gz	RQYIJDJBQRCOIV-WIYYLYMNSA-N	0	3	340.511	3.278	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)Cc2cccc3ncccc23)C1	ZINC000967290968	1335691966	/nfs/dbraw/zinc/69/19/66/1335691966.db2.gz	GJQMBFQHFMAKOJ-OXQOHEQNSA-N	0	3	337.467	3.180	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2cc3ccccc3cc2F)C1	ZINC000967307634	1335695170	/nfs/dbraw/zinc/69/51/70/1335695170.db2.gz	AIFJITVHPDZZIE-YWZLYKJASA-N	0	3	338.426	3.442	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccc(C)c(Cl)c2F)C1	ZINC000967420882	1335733223	/nfs/dbraw/zinc/73/32/23/1335733223.db2.gz	ZHIIMDFVALXWJD-IUODEOHRSA-N	0	3	336.838	3.251	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2sccc2-n2cccc2)C1	ZINC000967619210	1335793833	/nfs/dbraw/zinc/79/38/33/1335793833.db2.gz	BTZIJDNMPSVBHA-JKSUJKDBSA-N	0	3	341.480	3.002	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)C2(c3cccc(C)c3)CCC2)C1	ZINC000967660733	1335802858	/nfs/dbraw/zinc/80/28/58/1335802858.db2.gz	XLFKMNWWXBBBOR-ICSRJNTNSA-N	0	3	338.495	3.267	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2cc3ccccc3n2C)C1	ZINC000968078257	1335854021	/nfs/dbraw/zinc/85/40/21/1335854021.db2.gz	KFKWFGXQHCOALO-WBVHZDCISA-N	0	3	325.456	3.195	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)Cc2cccc(Cl)c2F)C1	ZINC000968354150	1335899440	/nfs/dbraw/zinc/89/94/40/1335899440.db2.gz	NQPCNAWPUXCPLX-BBRMVZONSA-N	0	3	338.854	3.424	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(OCC)c(C)c2)C1	ZINC000968375386	1335909010	/nfs/dbraw/zinc/90/90/10/1335909010.db2.gz	WECYKEXPEBSEMP-QAPCUYQASA-N	0	3	330.472	3.410	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2oc(CC(C)C)nc2C)C1	ZINC000968401625	1335921293	/nfs/dbraw/zinc/92/12/93/1335921293.db2.gz	ZKFWHBOASUNLAE-GOEBONIOSA-N	0	3	333.476	3.198	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2cccc3c2ccn3C)C1	ZINC000968423639	1335926030	/nfs/dbraw/zinc/92/60/30/1335926030.db2.gz	VCTSRWPYRWFKSY-YJBOKZPZSA-N	0	3	325.456	3.195	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2c[nH]nc2-c2ccsc2)C1	ZINC000968480543	1335936754	/nfs/dbraw/zinc/93/67/54/1335936754.db2.gz	NTGMZQBQTZGHAF-XJKSGUPXSA-N	0	3	344.484	3.155	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2ccc(OC(C)C)cc2)C1	ZINC000968611515	1335984257	/nfs/dbraw/zinc/98/42/57/1335984257.db2.gz	XCMDCXPQZBJOQP-QFBILLFUSA-N	0	3	330.472	3.490	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)Cc2ccc3ccccc3c2)C1	ZINC000968627499	1335989338	/nfs/dbraw/zinc/98/93/38/1335989338.db2.gz	IXNYBRKFBXEDCM-UWJYYQICSA-N	0	3	334.463	3.232	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2cc3c(cccc3OC)[nH]2)C1	ZINC000968643625	1335995220	/nfs/dbraw/zinc/99/52/20/1335995220.db2.gz	OFGGDNJTQNIOQW-RDTXWAMCSA-N	0	3	341.455	3.193	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(-c3ccccc3)[nH]2)C1	ZINC000968695385	1336015268	/nfs/dbraw/zinc/01/52/68/1336015268.db2.gz	OEXZDSOLMONTDX-UZLBHIALSA-N	0	3	335.451	3.145	20	30		EGEDHN
CC1CC(C(=O)NC[C@H]2CCCCCN2Cc2cccc(C#N)c2)C1	ZINC000968807132	1336057598	/nfs/dbraw/zinc/05/75/98/1336057598.db2.gz	ZJIBVYPOBUAXPI-RRWXTXHCSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1c(C)nn(C(C)(C)C)c1C	ZINC000968879963	1336078222	/nfs/dbraw/zinc/07/82/22/1336078222.db2.gz	UJCSTGODOISUNS-QGZVFWFLSA-N	0	3	346.519	3.415	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cnn2cccc(Cl)c12	ZINC000968941159	1336098048	/nfs/dbraw/zinc/09/80/48/1336098048.db2.gz	JGTAUOSRAGVWFJ-CQSZACIVSA-N	0	3	346.862	3.148	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccc(-n2ccnc2)cc1	ZINC000968965696	1336103960	/nfs/dbraw/zinc/10/39/60/1336103960.db2.gz	VQZYYKYFDKNJMA-IBGZPJMESA-N	0	3	338.455	3.033	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(C(=O)C[C@@H]3C=CCCC3)C2)s1	ZINC000969063451	1336135734	/nfs/dbraw/zinc/13/57/34/1336135734.db2.gz	NDLYUSUZYZFCMD-HUUCEWRRSA-N	0	3	329.469	3.057	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cccc(C(F)(F)F)n1	ZINC000969087831	1336139060	/nfs/dbraw/zinc/13/90/60/1336139060.db2.gz	GEOCONZYYVGDMS-ZDUSSCGKSA-N	0	3	341.377	3.261	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1nc(C2CC2)oc1C	ZINC000969097387	1336141697	/nfs/dbraw/zinc/14/16/97/1336141697.db2.gz	KVTWATRHFWBNHO-MRXNPFEDSA-N	0	3	331.460	3.411	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1csc(Cl)n1	ZINC000969105877	1336146067	/nfs/dbraw/zinc/14/60/67/1336146067.db2.gz	PYVKVMFBGNUKCD-LBPRGKRZSA-N	0	3	327.881	3.347	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccnc(O[C@@H](C)CC)c1	ZINC000969105977	1336146198	/nfs/dbraw/zinc/14/61/98/1336146198.db2.gz	QFTVXHQLMGSSIJ-WMZOPIPTSA-N	0	3	345.487	3.419	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1ccc(OC(C)C)cc1	ZINC000969133602	1336155341	/nfs/dbraw/zinc/15/53/41/1336155341.db2.gz	QBIZTYASGZGSMQ-LJQANCHMSA-N	0	3	342.483	3.472	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cnn(C(C)(C)C)c1CC	ZINC000969144470	1336161319	/nfs/dbraw/zinc/16/13/19/1336161319.db2.gz	MHAZZNXWDRLGKS-INIZCTEOSA-N	0	3	346.519	3.361	20	30		EGEDHN
CC1(C)CC[C@H](C(=O)N2CC[C@@H](NCc3ccc(C#N)s3)C2)C1	ZINC000969867548	1336254814	/nfs/dbraw/zinc/25/48/14/1336254814.db2.gz	QPSLSBQDGGDXTQ-UONOGXRCSA-N	0	3	331.485	3.137	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N[C@H](C)C1CN(CC[C@@H](C)F)C1	ZINC000969990782	1336269911	/nfs/dbraw/zinc/26/99/11/1336269911.db2.gz	ULXMVVUZCCUGIZ-HUUCEWRRSA-N	0	3	334.435	3.050	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cc(C3CCCCC3)n[nH]2)CC1	ZINC001005510381	1336364196	/nfs/dbraw/zinc/36/41/96/1336364196.db2.gz	RHARYNIUTHRBGS-UHFFFAOYSA-N	0	3	330.476	3.180	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccc3oc(C)nc3c2)CC1	ZINC001005563432	1336372128	/nfs/dbraw/zinc/37/21/28/1336372128.db2.gz	AJIAIXSYYQZAHF-UHFFFAOYSA-N	0	3	327.428	3.249	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cc3c(cn2)CCCC3)CC1	ZINC001005689229	1336393275	/nfs/dbraw/zinc/39/32/75/1336393275.db2.gz	OMNWNJXJKCRBLC-UHFFFAOYSA-N	0	3	327.472	3.073	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2c(C)nn(CCC)c2C)CC1	ZINC001006252899	1336477148	/nfs/dbraw/zinc/47/71/48/1336477148.db2.gz	WJSJUBMSKYDOGL-UHFFFAOYSA-N	0	3	332.492	3.022	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cc(C3CCCC3)no2)CC1	ZINC001006429028	1336504145	/nfs/dbraw/zinc/50/41/45/1336504145.db2.gz	OPTIOWTYFYPPRP-UHFFFAOYSA-N	0	3	331.460	3.445	20	30		EGEDHN
C=C(Cl)CN1CCC(N(C)C(=O)c2ccccc2CN(C)C)CC1	ZINC001006445202	1336507582	/nfs/dbraw/zinc/50/75/82/1336507582.db2.gz	ZTZBMSJBTGIYKM-UHFFFAOYSA-N	0	3	349.906	3.037	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cc(NC(C)=O)ccc2C)CC1	ZINC001006478032	1336514387	/nfs/dbraw/zinc/51/43/87/1336514387.db2.gz	KQAUFCAEDOZSFK-UHFFFAOYSA-N	0	3	343.471	3.066	20	30		EGEDHN
C#CCCN1CCC[C@@H](NC(=O)Cc2cc3ccccc3s2)C1	ZINC001007913541	1336731759	/nfs/dbraw/zinc/73/17/59/1336731759.db2.gz	JEKPUYGSYVYGPE-MRXNPFEDSA-N	0	3	326.465	3.048	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2cnc3c(F)cccc3c2)C1	ZINC001007953078	1336738055	/nfs/dbraw/zinc/73/80/55/1336738055.db2.gz	RLFCFICLSDHSLA-INIZCTEOSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)C[C@@H]2CCOc3ccccc32)C1	ZINC001008180436	1336785735	/nfs/dbraw/zinc/78/57/35/1336785735.db2.gz	ZZPBKTGMYPPARU-DLBZAZTESA-N	0	3	328.456	3.100	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H](NC(=O)c2cc3ncccc3s2)C1	ZINC001008185901	1336787430	/nfs/dbraw/zinc/78/74/30/1336787430.db2.gz	YINXKDNLQBIRIJ-CQSZACIVSA-N	0	3	329.469	3.457	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)Cc2c(C)[nH]c3ccccc32)C1	ZINC001008383496	1336838421	/nfs/dbraw/zinc/83/84/21/1336838421.db2.gz	IBMPQJJLLGRSND-INIZCTEOSA-N	0	3	325.456	3.176	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2ncc(Cl)cc2Cl)C1	ZINC001008982335	1336952459	/nfs/dbraw/zinc/95/24/59/1336952459.db2.gz	QUWDMTOVYDDVPU-LBPRGKRZSA-N	0	3	328.243	3.159	20	30		EGEDHN
C=C(C)CCN1CC[C@H](NC(=O)c2sc(CC3CC3)nc2C)C1	ZINC001015904205	1338355736	/nfs/dbraw/zinc/35/57/36/1338355736.db2.gz	FNJRTMYCQUXIDI-HNNXBMFYSA-N	0	3	333.501	3.174	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@H]1CCN(Cc2cc(C)ccc2C)C1	ZINC001016113685	1338467259	/nfs/dbraw/zinc/46/72/59/1338467259.db2.gz	LQNZEHJQCYZEHF-QFIPXVFZSA-N	0	3	346.474	3.218	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cccc3c2CCCC3)CC1	ZINC001016639967	1338673654	/nfs/dbraw/zinc/67/36/54/1338673654.db2.gz	DVSIVSQJDKZHIL-FQEVSTJZSA-N	0	3	336.479	3.173	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2cc3cccc(C)c3s2)CC1	ZINC001016691781	1338692751	/nfs/dbraw/zinc/69/27/51/1338692751.db2.gz	WLJRURWOFNFXTF-QGZVFWFLSA-N	0	3	338.476	3.427	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(-n3cccc3)cc2)CC1	ZINC001016713961	1338699903	/nfs/dbraw/zinc/69/99/03/1338699903.db2.gz	CXCSBFBFWJGOHG-FQEVSTJZSA-N	0	3	347.462	3.085	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2cc3c(ccc(C)c3C)[nH]2)CC1	ZINC001016764941	1338716948	/nfs/dbraw/zinc/71/69/48/1338716948.db2.gz	ZYMMYTFYNMVNMW-LJQANCHMSA-N	0	3	335.451	3.002	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cc(C(C)(C)C)oc2C)CC1	ZINC001016843937	1338744533	/nfs/dbraw/zinc/74/45/33/1338744533.db2.gz	SJNFWXXSILCWEG-QGZVFWFLSA-N	0	3	342.483	3.493	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2)CC1	ZINC001016866320	1338752435	/nfs/dbraw/zinc/75/24/35/1338752435.db2.gz	FTTPYLAPJZVINP-KSZLIROESA-N	0	3	342.870	3.047	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@@H]3NC(=O)[C@@H]3C[C@H]3C3CC3)CC2)c1	ZINC001016871039	1338754092	/nfs/dbraw/zinc/75/40/92/1338754092.db2.gz	VKBLMICPZHEXOV-ZCNNSNEGSA-N	0	3	349.478	3.075	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2cccc(-c3ccoc3)c2)CC1	ZINC001016916191	1338768541	/nfs/dbraw/zinc/76/85/41/1338768541.db2.gz	KSYHDGXBQPIMOK-LJQANCHMSA-N	0	3	334.419	3.164	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)[C@H](C)c2ccc(Cl)s2)CC1	ZINC001016919046	1338769585	/nfs/dbraw/zinc/76/95/85/1338769585.db2.gz	JPEVQTFLZFBECR-TZMCWYRMSA-N	0	3	336.888	3.109	20	30		EGEDHN
CC(C)(C)C(=O)N[C@H]1CC12CCN(Cc1cccc(C#N)c1)CC2	ZINC001016939701	1338776111	/nfs/dbraw/zinc/77/61/11/1338776111.db2.gz	IDJIOPZGHGJUNV-KRWDZBQOSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)Cc2cccc3ccccc32)CC1	ZINC001016941369	1338777263	/nfs/dbraw/zinc/77/72/63/1338777263.db2.gz	YFIRRGXOLNIGGQ-NRFANRHFSA-N	0	3	346.474	3.376	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2c(Cl)cccc2Cl)CC1	ZINC001016946128	1338779634	/nfs/dbraw/zinc/77/96/34/1338779634.db2.gz	IOEBGRGCBPHRFV-AWEZNQCLSA-N	0	3	337.250	3.211	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(C(C)(C)C)s2)CC1	ZINC001016986843	1338793337	/nfs/dbraw/zinc/79/33/37/1338793337.db2.gz	RBRBDPWARDMJJQ-HNNXBMFYSA-N	0	3	330.497	3.263	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCCN(C(=O)CC2CC2)C1	ZINC001017014145	1338806960	/nfs/dbraw/zinc/80/69/60/1338806960.db2.gz	LHQYBCWQBJWZOU-OAHLLOKOSA-N	0	3	331.485	3.090	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](CN(C)[C@H](C)c2cnc(C)cn2)C1	ZINC001017179160	1338922391	/nfs/dbraw/zinc/92/23/91/1338922391.db2.gz	FEJQELXBMOGOCA-IAGOWNOFSA-N	0	3	344.503	3.229	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H](CN(C)Cc2cn(C)nc2C)C1	ZINC001017201674	1338947042	/nfs/dbraw/zinc/94/70/42/1338947042.db2.gz	KRXGZBBRMGGPRU-PXNSSMCTSA-N	0	3	346.519	3.001	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc(OC)cc1C	ZINC001017583203	1339372976	/nfs/dbraw/zinc/37/29/76/1339372976.db2.gz	IVLQWWUJVDWHQW-KDURUIRLSA-N	0	3	342.483	3.188	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cn(C)c2ccccc12	ZINC001017711176	1339398167	/nfs/dbraw/zinc/39/81/67/1339398167.db2.gz	NDAVYVXAUVUAJL-CALCHBBNSA-N	0	3	337.467	3.433	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C(C)(C)C1CCOCC1	ZINC001017720896	1339400623	/nfs/dbraw/zinc/40/06/23/1339400623.db2.gz	IMNAXKOGIIUORD-HDICACEKSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1Cc2ccc(Cl)cc21	ZINC001018227940	1339540632	/nfs/dbraw/zinc/54/06/32/1339540632.db2.gz	QGYUOMYPPLKZQA-SOLBZPMBSA-N	0	3	330.859	3.231	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1nsc2ccccc21	ZINC001018299849	1339568183	/nfs/dbraw/zinc/56/81/83/1339568183.db2.gz	UOTVKMIDUMNCQV-GASCZTMLSA-N	0	3	341.480	3.090	20	30		EGEDHN
Cc1ccccc1C(=O)N1CC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001018444408	1339622536	/nfs/dbraw/zinc/62/25/36/1339622536.db2.gz	RHZAPQFBNVEJAW-KRWDZBQOSA-N	0	3	337.398	3.010	20	30		EGEDHN
C#CCCN1CCC[C@H]1CNC(=O)c1ccccc1O[C@H](C)CC	ZINC001028171320	1340466739	/nfs/dbraw/zinc/46/67/39/1340466739.db2.gz	FACLFDUWEVVKJV-SJORKVTESA-N	0	3	328.456	3.081	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1cnc2ccc(F)cc2c1	ZINC001028240656	1340501150	/nfs/dbraw/zinc/50/11/50/1340501150.db2.gz	DABQSGMAMNDECM-KRWDZBQOSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)C1CC(c2cccc(F)c2)C1	ZINC001028349092	1340588540	/nfs/dbraw/zinc/58/85/40/1340588540.db2.gz	HODFDTNHYOXTQA-TVPLGVNVSA-N	0	3	330.447	3.476	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NC[C@@H]1CCN(C[C@@H](F)CC)C1	ZINC001028637611	1340738727	/nfs/dbraw/zinc/73/87/27/1340738727.db2.gz	SSULUPOAAWVXJU-HOTGVXAUSA-N	0	3	334.435	3.051	20	30		EGEDHN
CC1(C)CC[C@@H](C(=O)NC[C@@H]2CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001028788114	1340819003	/nfs/dbraw/zinc/81/90/03/1340819003.db2.gz	JBVZWQWREXQUKU-RBUKOAKNSA-N	0	3	339.483	3.323	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)c2ccccc2-c2ccccc2)C1	ZINC001028968750	1340896441	/nfs/dbraw/zinc/89/64/41/1340896441.db2.gz	ZSYUMOFVUHYXGJ-GOSISDBHSA-N	0	3	332.447	3.429	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)C1CCN(C(=O)C(C)(C)F)CC1	ZINC001029034698	1340913424	/nfs/dbraw/zinc/91/34/24/1340913424.db2.gz	DHFPCWYFCKXYGO-AWEZNQCLSA-N	0	3	331.435	3.023	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)C1CCN(C(=O)[C@@H](C)C2CC2)CC1	ZINC001029076852	1340924516	/nfs/dbraw/zinc/92/45/16/1340924516.db2.gz	DJNWDSCDQXZLLC-HOTGVXAUSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC([C@H](C)NCc2nccs2)CC1	ZINC001029123985	1340935822	/nfs/dbraw/zinc/93/58/22/1340935822.db2.gz	CHKQEKMVZFKDRA-AWEZNQCLSA-N	0	3	335.517	3.462	20	30		EGEDHN
N#Cc1c[nH]c(C(=O)N2C[C@H]3CC[C@@H](C2)N3CCC2=CCCCC2)c1	ZINC001029260778	1340962707	/nfs/dbraw/zinc/96/27/07/1340962707.db2.gz	WSJRMIOEQULXKT-HDICACEKSA-N	0	3	338.455	3.066	20	30		EGEDHN
N#Cc1ccc(C(=O)N2C[C@H]3CC[C@@H](C2)N3CCCC2CCCC2)[nH]1	ZINC001029275838	1340966150	/nfs/dbraw/zinc/96/61/50/1340966150.db2.gz	QITGDCHKJJIFBW-HDICACEKSA-N	0	3	340.471	3.146	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CC[C@@H](C1)N2CCC1CCOCC1	ZINC001029419588	1340986157	/nfs/dbraw/zinc/98/61/57/1340986157.db2.gz	GSCXUJCKEHXIIV-HDICACEKSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CC[C@@H](C1)N2CCC[C@@H]1CCOC1	ZINC001029456774	1340994527	/nfs/dbraw/zinc/99/45/27/1340994527.db2.gz	PQMHNRRDOHAIJX-XSYGEPLQSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N1C[C@H]2CC[C@@H](C1)N2CCCC1CCCC1	ZINC001029480872	1340998678	/nfs/dbraw/zinc/99/86/78/1340998678.db2.gz	NWUGSLHMARCTIH-WCIQWLHISA-N	0	3	346.515	3.223	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N1C[C@H]2CC[C@@H](C1)N2CCCC1CCC1	ZINC001029511361	1341003346	/nfs/dbraw/zinc/00/33/46/1341003346.db2.gz	JNNQJBWGOIFIOB-YRPNKDGESA-N	0	3	346.515	3.223	20	30		EGEDHN
Cc1cccc(Cl)c1CN(C)C[C@H]1CCN(C(=O)[C@@H](C)C#N)C1	ZINC001029676488	1341040586	/nfs/dbraw/zinc/04/05/86/1341040586.db2.gz	BXANQOIQKZLMID-LSDHHAIUSA-N	0	3	333.863	3.088	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](CN(C)Cc3cncc(F)c3)C2)CC1	ZINC001029826788	1341088152	/nfs/dbraw/zinc/08/81/52/1341088152.db2.gz	VUUFASXHPRJNFZ-MRXNPFEDSA-N	0	3	345.462	3.247	20	30		EGEDHN
C=CCCN1CCC[C@H](N(Cc2ccccc2)C(=O)c2ccon2)C1	ZINC001029916639	1341116848	/nfs/dbraw/zinc/11/68/48/1341116848.db2.gz	BGHNDGFNLBKVBL-SFHVURJKSA-N	0	3	339.439	3.358	20	30		EGEDHN
C[C@H]1C[C@H]1CC(=O)N1CCC(CN(C)Cc2ccc(C#N)s2)CC1	ZINC001029991237	1341148493	/nfs/dbraw/zinc/14/84/93/1341148493.db2.gz	VTESKZVERHRDJM-HOCLYGCPSA-N	0	3	345.512	3.336	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC(CN(C)Cc2cnc(C)cn2)CC1	ZINC001029992306	1341149451	/nfs/dbraw/zinc/14/94/51/1341149451.db2.gz	SFOZYJNBUVAAKB-FQEVSTJZSA-N	0	3	344.503	3.058	20	30		EGEDHN
Cc1ccc2ccccc2c1CN1C[C@@H]2C[C@H]1CN2C(=O)[C@H](C)C#N	ZINC001032317617	1341494257	/nfs/dbraw/zinc/49/42/57/1341494257.db2.gz	XOYWHZAHHCQBIC-NJAFHUGGSA-N	0	3	333.435	3.093	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H]1COc2cc(C)c(C)cc21	ZINC001032541014	1341535319	/nfs/dbraw/zinc/53/53/19/1341535319.db2.gz	XLNWDDVGJIOYFE-JENIJYKNSA-N	0	3	340.467	3.031	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H](c1ccncc1)C(C)C	ZINC001032587287	1341549681	/nfs/dbraw/zinc/54/96/81/1341549681.db2.gz	SUGZFUOVJKLXJC-GBESFXJTSA-N	0	3	327.472	3.073	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)Cn1cc(C)c2ccccc21	ZINC001032679061	1341580064	/nfs/dbraw/zinc/58/00/64/1341580064.db2.gz	ZGRGLRWCAFQVBX-ROUUACIJSA-N	0	3	337.467	3.201	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)COc1ccccc1C(C)C	ZINC001032770570	1341608946	/nfs/dbraw/zinc/60/89/46/1341608946.db2.gz	FZFXGZBUSDWYLY-IRXDYDNUSA-N	0	3	328.456	3.050	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H]1Cc2c1cccc2Cl	ZINC001032810035	1341622788	/nfs/dbraw/zinc/62/27/88/1341622788.db2.gz	OWGJQEBZPUGPAM-GRDNDAEWSA-N	0	3	330.859	3.231	20	30		EGEDHN
CN(C(=O)c1ccc(C#N)[nH]1)[C@H]1CCN(Cc2ccccc2C2CC2)C1	ZINC001033022266	1341699101	/nfs/dbraw/zinc/69/91/01/1341699101.db2.gz	LWTRTNMMGGTYHO-SFHVURJKSA-N	0	3	348.450	3.110	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)[C@@H]2CCc3c2cccc3Cl)C1	ZINC001033267177	1341763683	/nfs/dbraw/zinc/76/36/83/1341763683.db2.gz	AQJBCRXKYPGSQK-WMLDXEAASA-N	0	3	332.875	3.479	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2sccc2-n2cccc2)C1	ZINC001033307838	1341775803	/nfs/dbraw/zinc/77/58/03/1341775803.db2.gz	DXZNYHVRWSNXFC-HNNXBMFYSA-N	0	3	329.469	3.261	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2ccc(C(F)F)c(F)c2)C1	ZINC001033419688	1341821548	/nfs/dbraw/zinc/82/15/48/1341821548.db2.gz	DCXPPTYJQHCQKN-CYBMUJFWSA-N	0	3	326.362	3.486	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@H]2CCN([C@@H](C)c3cccc(C)c3)C2)nc1	ZINC001033597048	1341889875	/nfs/dbraw/zinc/88/98/75/1341889875.db2.gz	QXVZSDWLUZNLSJ-PXNSSMCTSA-N	0	3	347.462	3.279	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2cc(C)n(CC3CC3)c2C)C1	ZINC001033596163	1341889947	/nfs/dbraw/zinc/88/99/47/1341889947.db2.gz	WREANIRJBNYMTQ-SFHVURJKSA-N	0	3	329.488	3.237	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)C2(c3ccc(Cl)cc3)CC2)C1	ZINC001033637934	1341920651	/nfs/dbraw/zinc/92/06/51/1341920651.db2.gz	AIUOBUHXRKYQLT-QGZVFWFLSA-N	0	3	332.875	3.480	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N(C)[C@H]2CCN(CC=C(C)C)C2)cc1	ZINC001033690300	1341954521	/nfs/dbraw/zinc/95/45/21/1341954521.db2.gz	HZLQNODSXBZARV-IBGZPJMESA-N	0	3	342.483	3.293	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)Cc2c(C)oc3ccccc32)C1	ZINC001033728333	1341980027	/nfs/dbraw/zinc/98/00/27/1341980027.db2.gz	LUSVPXREAZTHJZ-INIZCTEOSA-N	0	3	326.440	3.393	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@@H]2CC[C@H](c3ccccc3)O2)C1	ZINC001033829913	1342030275	/nfs/dbraw/zinc/03/02/75/1342030275.db2.gz	CNCUVJTWDFTXNR-AQNXPRMDSA-N	0	3	342.483	3.406	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cc3ccccc3c(=O)[nH]2)C1	ZINC001033853396	1342044651	/nfs/dbraw/zinc/04/46/51/1342044651.db2.gz	AIYDVZQRRWZHHD-INIZCTEOSA-N	0	3	339.439	3.053	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N(CC)[C@H]1CCN(Cc2cccc(C)c2)C1	ZINC001033960687	1342113551	/nfs/dbraw/zinc/11/35/51/1342113551.db2.gz	ZVEVEZGMZORYPV-ZCNNSNEGSA-N	0	3	342.483	3.009	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cc(C)nn3C(CC)CC)[C@@H]2C1	ZINC001075972631	1356459710	/nfs/dbraw/zinc/45/97/10/1356459710.db2.gz	ASCKXYGQRZQEOU-QFBILLFUSA-N	0	3	344.503	3.275	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC001034267840	1342359110	/nfs/dbraw/zinc/35/91/10/1342359110.db2.gz	ZCSNRYOKEFKBGQ-OALUTQOASA-N	0	3	341.499	3.060	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)[C@@H]2CC=CC[C@H]2C(F)(F)F)C1	ZINC001034270388	1342361105	/nfs/dbraw/zinc/36/11/05/1342361105.db2.gz	GHSUQWLGNOKGPV-RRFJBIMHSA-N	0	3	330.394	3.288	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cc(C)nc3onc(C)c32)C1	ZINC001034329469	1342404300	/nfs/dbraw/zinc/40/43/00/1342404300.db2.gz	IKMKRXHMTSYLOH-OAHLLOKOSA-N	0	3	342.443	3.000	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc3c(c2)[C@H](C)CO3)C1	ZINC001034357878	1342428541	/nfs/dbraw/zinc/42/85/41/1342428541.db2.gz	FLTBPPUIGUUUME-WBVHZDCISA-N	0	3	328.456	3.343	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2c(F)ccc(F)c2F)C1	ZINC001034372515	1342441674	/nfs/dbraw/zinc/44/16/74/1342441674.db2.gz	NALAENHUUUSBAR-LBPRGKRZSA-N	0	3	326.362	3.264	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCCCN(CCOC3CCC3)C2)CC1	ZINC001034381599	1342450647	/nfs/dbraw/zinc/45/06/47/1342450647.db2.gz	OMTVEBHHVJYYFX-SFHVURJKSA-N	0	3	334.504	3.273	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCCCN(CCOc3ccccc3)C2)C1	ZINC001034387954	1342456646	/nfs/dbraw/zinc/45/66/46/1342456646.db2.gz	ZCIVXWXRADKWPO-SFHVURJKSA-N	0	3	342.483	3.392	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cc(F)c(F)c(F)c2)C1	ZINC001034425546	1342487455	/nfs/dbraw/zinc/48/74/55/1342487455.db2.gz	VIYUFHFBLCRGGQ-ZDUSSCGKSA-N	0	3	326.362	3.264	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@H]2CCCCN(CC=C(C)C)C2)cc1	ZINC001034431655	1342493578	/nfs/dbraw/zinc/49/35/78/1342493578.db2.gz	LKIPNNODVJHTHG-IBGZPJMESA-N	0	3	340.467	3.249	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)c2ccc(OC)c(C3CC3)c2)C1	ZINC001034464283	1342519783	/nfs/dbraw/zinc/51/97/83/1342519783.db2.gz	ZYFKVPZULMPLOJ-QGZVFWFLSA-N	0	3	328.456	3.343	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc3[nH]c(C)nc3c2)C1	ZINC001034468596	1342523941	/nfs/dbraw/zinc/52/39/41/1342523941.db2.gz	SCBMLFFEUXJGAG-INIZCTEOSA-N	0	3	326.444	3.032	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCCN(Cc3cccc(C)c3)C2)nc1	ZINC001034493648	1342549204	/nfs/dbraw/zinc/54/92/04/1342549204.db2.gz	OGKBTHBEVDTHJN-HXUWFJFHSA-N	0	3	347.462	3.156	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc(N(C)CC)cc2)C1	ZINC001034546557	1342609439	/nfs/dbraw/zinc/60/94/39/1342609439.db2.gz	HRWIOEVZXPRSFI-SFHVURJKSA-N	0	3	329.488	3.303	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@@]2(C)OCCc3ccccc32)C1	ZINC001034552493	1342615110	/nfs/dbraw/zinc/61/51/10/1342615110.db2.gz	NGPBGAFYGSUYCQ-NQIIRXRSSA-N	0	3	342.483	3.021	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)C2CC(c3cccc(F)c3)C2)C1	ZINC001034554721	1342616745	/nfs/dbraw/zinc/61/67/45/1342616745.db2.gz	TWWWSAWXWLFAMX-TVPLGVNVSA-N	0	3	330.447	3.476	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)[C@@]2(C)CCc3ccccc3C2)C1	ZINC001034556819	1342618488	/nfs/dbraw/zinc/61/84/88/1342618488.db2.gz	IREYSGOHGOEMAF-CTNGQTDRSA-N	0	3	326.484	3.338	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1CC[C@H](NC(=O)c2cccs2)CC1	ZINC001034582626	1342628564	/nfs/dbraw/zinc/62/85/64/1342628564.db2.gz	YASHBRPHVOLNCZ-QAQDUYKDSA-N	0	3	339.464	3.451	20	30		EGEDHN
N#Cc1ccc(C[NH2+][C@H]2CC[C@H](NC(=O)c3ccccc3[O-])CC2)cc1	ZINC001034596930	1342640694	/nfs/dbraw/zinc/64/06/94/1342640694.db2.gz	NGWYHWSOKTZZHS-IYARVYRRSA-N	0	3	349.434	3.095	20	30		EGEDHN
CC1(C(=O)N[C@H]2CC[C@H](NCc3ccccc3C#N)CC2)CCC1	ZINC001034709705	1342705478	/nfs/dbraw/zinc/70/54/78/1342705478.db2.gz	NWEPOJVNGMIVRB-IYARVYRRSA-N	0	3	325.456	3.265	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2c(F)cccc2F)C12CCC2	ZINC001078791319	1357085762	/nfs/dbraw/zinc/08/57/62/1357085762.db2.gz	HTDIHJLUPDZBHZ-UONOGXRCSA-N	0	3	340.801	3.348	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)C2(C)CC(=C)C2)CC1	ZINC001034727547	1342722529	/nfs/dbraw/zinc/72/25/29/1342722529.db2.gz	VXONKMCFKZZRPX-HDJSIYSDSA-N	0	3	341.293	3.268	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)[C@@H]2C[C@@]2(C)CC)CC1	ZINC001034765689	1342745401	/nfs/dbraw/zinc/74/54/01/1342745401.db2.gz	GWJHLFNYEYGNDN-RZLSGREXSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)Cc2ccc(F)cc2)C12CCC2	ZINC001078796564	1357090160	/nfs/dbraw/zinc/09/01/60/1357090160.db2.gz	BJQCGKAVMFJCTD-HOTGVXAUSA-N	0	3	336.838	3.138	20	30		EGEDHN
CC(C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)cc1F)=C1CCC1	ZINC001034932921	1342842710	/nfs/dbraw/zinc/84/27/10/1342842710.db2.gz	QAYWCYNSYGLSLW-GOSISDBHSA-N	0	3	341.430	3.278	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)C[C@@H]2C=CCCC2)s1	ZINC001034974236	1342860118	/nfs/dbraw/zinc/86/01/18/1342860118.db2.gz	SVCWKCJZWNAUPF-HZPDHXFCSA-N	0	3	343.496	3.447	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)C2(F)CCCC2)c(F)c1	ZINC001034980792	1342863038	/nfs/dbraw/zinc/86/30/38/1342863038.db2.gz	WJPAFSCBTMNIHC-MRXNPFEDSA-N	0	3	347.409	3.060	20	30		EGEDHN
C[C@@]1(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)c(F)c2)C=CCC1	ZINC001035017237	1342878222	/nfs/dbraw/zinc/87/82/22/1342878222.db2.gz	MDCNSENMPYYWIZ-YLJYHZDGSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H]1CNCc1cnn(C(C)(C)C)c1	ZINC001035037131	1342891383	/nfs/dbraw/zinc/89/13/83/1342891383.db2.gz	OVRWJOZGOKWJPH-XLIONFOSSA-N	0	3	346.519	3.321	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)c2occc2Cl)s1	ZINC001035039132	1342891679	/nfs/dbraw/zinc/89/16/79/1342891679.db2.gz	WGEYQDZJOFOXDK-LLVKDONJSA-N	0	3	349.843	3.261	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC2(CCN(Cc3ccccc3F)C2)CC1	ZINC001035183609	1342997737	/nfs/dbraw/zinc/99/77/37/1342997737.db2.gz	RUWYEMWOJLGAKE-UHFFFAOYSA-N	0	3	340.442	3.054	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC2(CCN([C@@H](C)c3cnccn3)C2)CC1	ZINC001035212857	1343031399	/nfs/dbraw/zinc/03/13/99/1343031399.db2.gz	ALSLOSILFNBAIO-INIZCTEOSA-N	0	3	342.487	3.064	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC2(CCN(Cc3cnoc3C)C2)CC1	ZINC001035212950	1343031629	/nfs/dbraw/zinc/03/16/29/1343031629.db2.gz	BDFYFMQEXXHHLY-UHFFFAOYSA-N	0	3	331.460	3.010	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cn(C(C)(C)C)nc1C)CC2	ZINC001035707633	1343144501	/nfs/dbraw/zinc/14/45/01/1343144501.db2.gz	POTUBNKZBRTXKJ-UHFFFAOYSA-N	0	3	344.503	3.061	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cc1ccc3cnccc3c1)CC2	ZINC001035750599	1343169741	/nfs/dbraw/zinc/16/97/41/1343169741.db2.gz	NLOONRNACXLFOM-UHFFFAOYSA-N	0	3	349.478	3.278	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC2(CN(C[C@@H]3CCCCO3)C2)CC1	ZINC001035785509	1343196164	/nfs/dbraw/zinc/19/61/64/1343196164.db2.gz	ULZSPKBDDKQUJJ-PKOBYXMFSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC2(CN(CCOC3CCC3)C2)CC1	ZINC001035787606	1343199140	/nfs/dbraw/zinc/19/91/40/1343199140.db2.gz	QVRKUNTYHJCZFS-IBGZPJMESA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H]1C[C@H]1c1ccccc1F)CC2	ZINC001035814103	1343212366	/nfs/dbraw/zinc/21/23/66/1343212366.db2.gz	LNEPWOSKUWLRPP-ZWKOTPCHSA-N	0	3	342.458	3.430	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc3cccnc3c1)CC2	ZINC001035820123	1343214497	/nfs/dbraw/zinc/21/44/97/1343214497.db2.gz	VZTYGDHZKIMODJ-UHFFFAOYSA-N	0	3	335.451	3.349	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc3[nH]ccc3s1)CC2	ZINC001035844868	1343226102	/nfs/dbraw/zinc/22/61/02/1343226102.db2.gz	WMYMBVRSKVYMOL-UHFFFAOYSA-N	0	3	329.469	3.344	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)CC(C)(C)c1ccccc1)CC2	ZINC001035857278	1343233932	/nfs/dbraw/zinc/23/39/32/1343233932.db2.gz	LBRJOYSPCLYVHO-UHFFFAOYSA-N	0	3	338.495	3.302	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@]1(C)CCc3ccccc31)CC2	ZINC001035860387	1343236554	/nfs/dbraw/zinc/23/65/54/1343236554.db2.gz	LYYONLSAXDFZCC-OAQYLSRUSA-N	0	3	338.495	3.391	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cnc(C(C)C)s1)CC2	ZINC001035862033	1343237769	/nfs/dbraw/zinc/23/77/69/1343237769.db2.gz	CRQZOPVUFOXGPL-UHFFFAOYSA-N	0	3	333.501	3.381	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3nccs3)[C@@H](C)C2)CC1	ZINC001036163291	1343338321	/nfs/dbraw/zinc/33/83/21/1343338321.db2.gz	CZBSMOOCZDWWGQ-HOCLYGCPSA-N	0	3	333.501	3.216	20	30		EGEDHN
CCC1(C(=O)N2CC[C@H](NCc3cc(F)ccc3C#N)[C@@H](C)C2)CC1	ZINC001036163968	1343338811	/nfs/dbraw/zinc/33/88/11/1343338811.db2.gz	DJROSZWBDFBEBA-KSSFIOAISA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](NCc3ccn(C(C)C)n3)[C@H](C)C2)C1	ZINC001036170747	1343343873	/nfs/dbraw/zinc/34/38/73/1343343873.db2.gz	UDEZBGHFKCKHGM-AEFFLSMTSA-N	0	3	344.503	3.147	20	30		EGEDHN
C[C@H](NCc1cc(F)ccc1C#N)[C@H]1CCCN(C(=O)CC2CC2)C1	ZINC001036344132	1343430663	/nfs/dbraw/zinc/43/06/63/1343430663.db2.gz	LXFCOAKMDZVXDO-YOEHRIQHSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCCN(C(=O)c2ccoc2)C1	ZINC001036361503	1343443160	/nfs/dbraw/zinc/44/31/60/1343443160.db2.gz	JUBJJVAYOMUOBM-CRAIPNDOSA-N	0	3	337.423	3.182	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCCN(C(=O)C=C2CCC2)C1	ZINC001036380488	1343453288	/nfs/dbraw/zinc/45/32/88/1343453288.db2.gz	CMYYCPOSYBKBNV-OXQOHEQNSA-N	0	3	337.467	3.385	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC[C@H]([C@H](C)NCc2ccccc2C#N)C1	ZINC001036394990	1343463090	/nfs/dbraw/zinc/46/30/90/1343463090.db2.gz	SIVYTQPIUQUZIE-WIMZTDEYSA-N	0	3	325.456	3.241	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]([C@H](C)NCc2cc(C3CC3)no2)C1	ZINC001036429400	1343481871	/nfs/dbraw/zinc/48/18/71/1343481871.db2.gz	ULYDERLUODWTER-HOCLYGCPSA-N	0	3	345.487	3.481	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]([C@H](C)NCc2csc(C)n2)C1	ZINC001036429956	1343482396	/nfs/dbraw/zinc/48/23/96/1343482396.db2.gz	XSZLHCXLOYZKFH-ZFWWWQNUSA-N	0	3	335.517	3.380	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]([C@@H](C)NCc2nc(C)cs2)C1	ZINC001036439691	1343488471	/nfs/dbraw/zinc/48/84/71/1343488471.db2.gz	LMSNPFNQDVEHAD-CABCVRRESA-N	0	3	335.517	3.380	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]([C@@H](C)NCc2cscn2)C1	ZINC001036443633	1343491416	/nfs/dbraw/zinc/49/14/16/1343491416.db2.gz	WBWXQPFXUGNQAS-HUUCEWRRSA-N	0	3	335.517	3.462	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@H](C)[C@@H]1CNCc1cc(C#N)ccc1F	ZINC001036510751	1343526895	/nfs/dbraw/zinc/52/68/95/1343526895.db2.gz	QRASJHBFSLAGRN-KSSFIOAISA-N	0	3	331.435	3.070	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC[C@H](C)[C@H]2CNCc2ccccn2)cc1	ZINC001036567804	1343557449	/nfs/dbraw/zinc/55/74/49/1343557449.db2.gz	MZFWIWGITQXRGE-LAUBAEHRSA-N	0	3	347.462	3.093	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@@H]2CN(C(=O)c3ccccc3)CC[C@@H]21	ZINC001036627001	1343584430	/nfs/dbraw/zinc/58/44/30/1343584430.db2.gz	GGFIKOCDCVVKGP-RTWAWAEBSA-N	0	3	345.446	3.295	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@H]2[C@H](CCN2CC#Cc2ccccc2)C1	ZINC001036651805	1343600849	/nfs/dbraw/zinc/60/08/49/1343600849.db2.gz	JTJBZEACDWMVOU-RTWAWAEBSA-N	0	3	338.495	3.397	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@@H]2[C@@H](CCN2Cc2ccccc2Cl)C1	ZINC001036714094	1343646962	/nfs/dbraw/zinc/64/69/62/1343646962.db2.gz	SIASPDXQFAVIAT-PKOBYXMFSA-N	0	3	342.870	3.176	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2[C@H](CCN2Cc2ccccc2C#N)C1	ZINC001036789871	1343719663	/nfs/dbraw/zinc/71/96/63/1343719663.db2.gz	YXFLNTREQUBNNK-MOPGFXCFSA-N	0	3	337.467	3.193	20	30		EGEDHN
CC1(C(=O)N2CC[C@@H]3[C@@H](CCN3Cc3ccccc3C#N)C2)CCC1	ZINC001036791973	1343723177	/nfs/dbraw/zinc/72/31/77/1343723177.db2.gz	IGEYAAKXIHIMFQ-RBUKOAKNSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H]3[C@@H](CCN3Cc3cncs3)C2)CC1	ZINC001036810460	1343745083	/nfs/dbraw/zinc/74/50/83/1343745083.db2.gz	CJTSVYBPUGKODF-FUHWJXTLSA-N	0	3	345.512	3.312	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H]3[C@@H](CCN3Cc3cnc(C)o3)C2)CC1	ZINC001036811935	1343747086	/nfs/dbraw/zinc/74/70/86/1343747086.db2.gz	YZTWGEPWJBTIIJ-HKUYNNGSSA-N	0	3	343.471	3.152	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]3[C@H](CCN3Cc3ccccc3C#N)C2)C1	ZINC001036815936	1343753062	/nfs/dbraw/zinc/75/30/62/1343753062.db2.gz	NEUMHVHEXKLPGQ-UXHICEINSA-N	0	3	349.478	3.337	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@H]2[C@H](CCN2Cc2ccc(C#N)c(F)c2)C1	ZINC001036876351	1343815019	/nfs/dbraw/zinc/81/50/19/1343815019.db2.gz	OEUKYDUHQICXJG-AEFFLSMTSA-N	0	3	343.446	3.166	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@H]1CCC[C@@H]1NC(=O)C1CC=CC1	ZINC001036970643	1343900169	/nfs/dbraw/zinc/90/01/69/1343900169.db2.gz	PQOCGCUHPXHVEN-APWZRJJASA-N	0	3	341.430	3.038	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@@H]1CCC[C@H]1NC(=O)C1CC=CC1	ZINC001036970645	1343900231	/nfs/dbraw/zinc/90/02/31/1343900231.db2.gz	PQOCGCUHPXHVEN-QFBILLFUSA-N	0	3	341.430	3.038	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@H]1CCC[C@H]1NC(=O)C1=CCCC1	ZINC001036981390	1343908877	/nfs/dbraw/zinc/90/88/77/1343908877.db2.gz	WRTWVAIDLHGGIN-VQIMIIECSA-N	0	3	341.430	3.182	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCC[C@H]1NC(=O)C1CC=CC1	ZINC001037180333	1344023358	/nfs/dbraw/zinc/02/33/58/1344023358.db2.gz	FZHIPDWDLKTBPF-WOJBJXKFSA-N	0	3	337.467	3.289	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)NC[C@@H]1CCN1CCCC1CCC1	ZINC001038800979	1344589399	/nfs/dbraw/zinc/58/93/99/1344589399.db2.gz	WPYJDBJIBAACNR-FHWLQOOXSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1cnn(C2CCCC2)c1C	ZINC001038901662	1344641909	/nfs/dbraw/zinc/64/19/09/1344641909.db2.gz	WMBKTLCJNBKJDF-QGZVFWFLSA-N	0	3	330.476	3.077	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H]2CC=CCC2)CC[C@H]1c1ccc(F)cc1	ZINC001079148589	1357196738	/nfs/dbraw/zinc/19/67/38/1357196738.db2.gz	BGAGGGORXJGRAW-YZGWKJHDSA-N	0	3	340.442	3.089	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C2=CCCCCC2)C[C@H]1c1cccc(F)c1	ZINC001079180530	1357202254	/nfs/dbraw/zinc/20/22/54/1357202254.db2.gz	YVLCTJZEAWFKGH-VQTJNVASSA-N	0	3	340.442	3.233	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2nccc3ccccc32)C1	ZINC001039224244	1344941791	/nfs/dbraw/zinc/94/17/91/1344941791.db2.gz	DQIZWNQFBJNPBA-ICSRJNTNSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccoc2C2CC2)C1	ZINC001039225046	1344943048	/nfs/dbraw/zinc/94/30/48/1344943048.db2.gz	KZSQMZHNPHNTEP-WMZOPIPTSA-N	0	3	326.440	3.107	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc3occc3s2)C1	ZINC001039228732	1344948706	/nfs/dbraw/zinc/94/87/06/1344948706.db2.gz	HMQRSVQZHFYHGU-HUUCEWRRSA-N	0	3	342.464	3.444	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(F)cc(Cl)c2)C1	ZINC001039240551	1344965461	/nfs/dbraw/zinc/96/54/61/1344965461.db2.gz	XZARZRBZHPMSTR-KDOFPFPSSA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccc(C)cc2F)C1	ZINC001039240520	1344965870	/nfs/dbraw/zinc/96/58/70/1344965870.db2.gz	XMLRIAQRJHUFBG-QFBILLFUSA-N	0	3	328.431	3.084	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cccc(F)c2F)C1	ZINC001039242112	1344967575	/nfs/dbraw/zinc/96/75/75/1344967575.db2.gz	AEMNMLWWAMWWJD-CRAIPNDOSA-N	0	3	346.421	3.305	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccc(C)nc2C)C1	ZINC001039242656	1344969088	/nfs/dbraw/zinc/96/90/88/1344969088.db2.gz	QIUJFABVVUFKRI-AZUAARDMSA-N	0	3	339.483	3.038	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)CCc1ncc(C(C)(C)C)o1	ZINC001039387542	1345039723	/nfs/dbraw/zinc/03/97/23/1345039723.db2.gz	VYOOPKBPQILKOX-CVEARBPZSA-N	0	3	345.487	3.156	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cnoc1-c1ccco1	ZINC001039395938	1345044540	/nfs/dbraw/zinc/04/45/40/1345044540.db2.gz	RDPRQUYUYZVLLI-CABCVRRESA-N	0	3	341.411	3.190	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc(OC)c(F)c1	ZINC001039400912	1345047342	/nfs/dbraw/zinc/04/73/42/1345047342.db2.gz	BXNPQPJFFOXLIP-SJORKVTESA-N	0	3	346.446	3.018	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1c(C)ccnc1OCC	ZINC001039411403	1345053976	/nfs/dbraw/zinc/05/39/76/1345053976.db2.gz	TWPSBLARKYPMON-SJORKVTESA-N	0	3	343.471	3.044	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cncc(OC(C)C)c1	ZINC001039415643	1345056833	/nfs/dbraw/zinc/05/68/33/1345056833.db2.gz	OMGJAIHVNKEETP-MSOLQXFVSA-N	0	3	343.471	3.124	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccc(F)c1Cl	ZINC001039443736	1345069652	/nfs/dbraw/zinc/06/96/52/1345069652.db2.gz	GCTDQBFOLTTWHV-KGLIPLIRSA-N	0	3	334.822	3.181	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(C)c(OCC)c1	ZINC001039447123	1345071719	/nfs/dbraw/zinc/07/17/19/1345071719.db2.gz	DFYXWKCGDVVAMT-MOPGFXCFSA-N	0	3	340.467	3.096	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1coc2ccccc12	ZINC001039455737	1345076911	/nfs/dbraw/zinc/07/69/11/1345076911.db2.gz	OLNITXIUKBFXAW-MSOLQXFVSA-N	0	3	336.435	3.064	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C(C)(C)Cc1ccccc1	ZINC001039459217	1345078469	/nfs/dbraw/zinc/07/84/69/1345078469.db2.gz	LAUJJKBBRWXAKA-UXHICEINSA-N	0	3	338.495	3.344	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](F)CC1CCCCC1	ZINC001039460484	1345079165	/nfs/dbraw/zinc/07/91/65/1345079165.db2.gz	RTNUSWOJOMQPFK-CEXWTWQISA-N	0	3	334.479	3.384	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)COc1cccc(CC)c1	ZINC001039466832	1345085010	/nfs/dbraw/zinc/08/50/10/1345085010.db2.gz	HWHDUFBNOXAHLC-MOPGFXCFSA-N	0	3	342.483	3.269	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@]3(CCN(C(=O)/C=C\C4CC4)C3)C2)cc1	ZINC001040134434	1345346327	/nfs/dbraw/zinc/34/63/27/1345346327.db2.gz	POGLEYFZEXDJDQ-BVGULUMVSA-N	0	3	349.478	3.339	20	30		EGEDHN
CC1(C(=O)N2CC[C@]3(C2)CCCN(Cc2ccc(C#N)cc2)C3)CC1	ZINC001040223403	1345382353	/nfs/dbraw/zinc/38/23/53/1345382353.db2.gz	MKQQGXLXGPLAIX-OAQYLSRUSA-N	0	3	337.467	3.173	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3cccc(OCCC)c3)C2)C1	ZINC001040229616	1345384999	/nfs/dbraw/zinc/38/49/99/1345384999.db2.gz	UWOBYOCAJNBGKO-NRFANRHFSA-N	0	3	340.467	3.037	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3sc(C)cc3C)C2)C1	ZINC001040228987	1345385074	/nfs/dbraw/zinc/38/50/74/1345385074.db2.gz	OLVORDOMPLAGHD-IBGZPJMESA-N	0	3	330.497	3.316	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cscc3Cl)C2)C1	ZINC001040253111	1345396900	/nfs/dbraw/zinc/39/69/00/1345396900.db2.gz	HCZKHIILSOWZGB-KRWDZBQOSA-N	0	3	336.888	3.353	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cc(C)c(F)cc3F)C2)C1	ZINC001040255636	1345397734	/nfs/dbraw/zinc/39/77/34/1345397734.db2.gz	VNGKYQIFGCDXPM-LJQANCHMSA-N	0	3	334.410	3.387	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cc(C)sc3C)C2)C1	ZINC001040282475	1345410645	/nfs/dbraw/zinc/41/06/45/1345410645.db2.gz	IWJMJAHULJCOHI-LJQANCHMSA-N	0	3	330.497	3.316	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cc4c(cn3)CCCC4)C2)C1	ZINC001040289296	1345413799	/nfs/dbraw/zinc/41/37/99/1345413799.db2.gz	NRICPAYESAIKKT-OAQYLSRUSA-N	0	3	339.483	3.075	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@@H]3C[C@@H]4CCCC[C@H]34)C2)C1	ZINC001040301530	1345422021	/nfs/dbraw/zinc/42/20/21/1345422021.db2.gz	AKMWIIDYBNARSI-CTAFRAEOSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@@H]3CCCCC3(F)F)C2)C1	ZINC001040313969	1345425918	/nfs/dbraw/zinc/42/59/18/1345425918.db2.gz	PXHQMJKENLCVCL-WMZOPIPTSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3cc4c(cc(C)cc4C)[nH]3)C2)C1	ZINC001040317518	1345428398	/nfs/dbraw/zinc/42/83/98/1345428398.db2.gz	MGRWBMKMCRLGLM-JOCHJYFZSA-N	0	3	349.478	3.346	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3c(C)cccc3Cl)C2)C1	ZINC001040372079	1345460546	/nfs/dbraw/zinc/46/05/46/1345460546.db2.gz	OIWBRRCOCUTXSN-IBGZPJMESA-N	0	3	330.859	3.210	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cc(C)ccc3F)C2)C1	ZINC001040417593	1345486130	/nfs/dbraw/zinc/48/61/30/1345486130.db2.gz	GVCQWONDHWPBEU-FQEVSTJZSA-N	0	3	328.431	3.086	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@@]3(C)C[C@@H]3c3ccccc3)C2)C1	ZINC001040443979	1345503006	/nfs/dbraw/zinc/50/30/06/1345503006.db2.gz	OAZYAICTZGSCEJ-BAGYTPMASA-N	0	3	336.479	3.128	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)C[C@@H]3CCc4ccccc43)C2)C1	ZINC001040461530	1345509494	/nfs/dbraw/zinc/50/94/94/1345509494.db2.gz	WFOQMVHFTHTFSE-SIKLNZKXSA-N	0	3	336.479	3.054	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3cccc(C(F)F)c3)C2)C1	ZINC001040500187	1345520816	/nfs/dbraw/zinc/52/08/16/1345520816.db2.gz	IYXHRNAWGLEXHQ-LJQANCHMSA-N	0	3	332.394	3.186	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3cc(C)c(F)cc3Cl)C2)C1	ZINC001040510018	1345526351	/nfs/dbraw/zinc/52/63/51/1345526351.db2.gz	LJDNXYWZACTKFC-LJQANCHMSA-N	0	3	348.849	3.349	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3ccc4c(c3)CCCC4)C2)C1	ZINC001040518583	1345529381	/nfs/dbraw/zinc/52/93/81/1345529381.db2.gz	CGQJJOJLSZWNDO-QFIPXVFZSA-N	0	3	336.479	3.127	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@H](C)c3cccc(Cl)c3)C2)C1	ZINC001040537529	1345536150	/nfs/dbraw/zinc/53/61/50/1345536150.db2.gz	ATMWSAFLUNBAPA-OXQOHEQNSA-N	0	3	344.886	3.391	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3cc4ccccc4n3CC)C2)C1	ZINC001040541625	1345537603	/nfs/dbraw/zinc/53/76/03/1345537603.db2.gz	CIQSUCDOVBUFQX-JOCHJYFZSA-N	0	3	349.478	3.223	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CCN(C(=O)c4ccco4)C3)CC2)c1	ZINC001040582828	1345549835	/nfs/dbraw/zinc/54/98/35/1345549835.db2.gz	UOPSWBSZLPXZKV-UHFFFAOYSA-N	0	3	349.434	3.280	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cccc(C)c3F)C2)CC1	ZINC001040708175	1345567975	/nfs/dbraw/zinc/56/79/75/1345567975.db2.gz	QEUUXKMZBDJREB-UHFFFAOYSA-N	0	3	328.431	3.086	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@H]3CCC=CCCC3)C2)CC1	ZINC001040745096	1345573075	/nfs/dbraw/zinc/57/30/75/1345573075.db2.gz	HUJLUDIQMWGWRM-IBGZPJMESA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cc(C)c4ccccc4n3)C2)CC1	ZINC001040747086	1345573783	/nfs/dbraw/zinc/57/37/83/1345573783.db2.gz	LKUVEMGTFGHBCS-UHFFFAOYSA-N	0	3	347.462	3.105	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC3(C2)CCN(Cc2ccccn2)CC3)C1	ZINC001040839322	1345586090	/nfs/dbraw/zinc/58/60/90/1345586090.db2.gz	FDFAHNYJFJBVBJ-UHFFFAOYSA-N	0	3	339.483	3.252	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3scnc3C(C)(C)C)C2)CC1	ZINC001040876864	1345593096	/nfs/dbraw/zinc/59/30/96/1345593096.db2.gz	NZCUFQFYFBRZGH-UHFFFAOYSA-N	0	3	345.512	3.002	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cc(C(C)C)oc3C)C2)CC1	ZINC001040902545	1345596796	/nfs/dbraw/zinc/59/67/96/1345596796.db2.gz	VOKYUNUCFZFBRL-UHFFFAOYSA-N	0	3	328.456	3.273	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cccc4ccsc43)C2)CC1	ZINC001040907353	1345597548	/nfs/dbraw/zinc/59/75/48/1345597548.db2.gz	WSYSVJLASISECF-UHFFFAOYSA-N	0	3	338.476	3.463	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cnc(C(C)C)s3)C2)CC1	ZINC001040960543	1345611094	/nfs/dbraw/zinc/61/10/94/1345611094.db2.gz	SAXFIGIYALPGDH-UHFFFAOYSA-N	0	3	345.512	3.218	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@@]3(CCN(Cc4cccc(C#N)c4)C3)C2)o1	ZINC001041042196	1345633403	/nfs/dbraw/zinc/63/34/03/1345633403.db2.gz	LTWJWNLKNCODFI-OAQYLSRUSA-N	0	3	349.434	3.198	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@]3(CCN(C(=O)C[C@@H]4C=CCC4)C3)C2)c1	ZINC001041055816	1345639022	/nfs/dbraw/zinc/63/90/22/1345639022.db2.gz	ZDOBNPJCSQHPTP-XMSQKQJNSA-N	0	3	349.478	3.339	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3oc4c(cccc4F)c3C)C2)C1	ZINC001041354072	1345708947	/nfs/dbraw/zinc/70/89/47/1345708947.db2.gz	LWDMWONZMCBINI-FQEVSTJZSA-N	0	3	340.398	3.052	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)CCc3ccc(C)c(Cl)c3)C2)C1	ZINC001041514827	1345749617	/nfs/dbraw/zinc/74/96/17/1345749617.db2.gz	LMDIGEAQPZDRHX-HXUWFJFHSA-N	0	3	344.886	3.139	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@]2(CCN(CCc3csc(C)n3)C2)C1	ZINC001041543336	1345758173	/nfs/dbraw/zinc/75/81/73/1345758173.db2.gz	IRHVUVWUIDOHLL-IBGZPJMESA-N	0	3	347.528	3.131	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@]2(CCN(Cc3sc(C)nc3C)C2)C1	ZINC001041543914	1345758552	/nfs/dbraw/zinc/75/85/52/1345758552.db2.gz	LVLCYXSRVSXVCN-LJQANCHMSA-N	0	3	347.528	3.397	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)[C@@H](CC)Cc3ccccc3)C2)C1	ZINC001041720036	1345830276	/nfs/dbraw/zinc/83/02/76/1345830276.db2.gz	HKZFOCJGCNQFRF-UNMCSNQZSA-N	0	3	338.495	3.203	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)[C@@H](CC)Cc3cccc(C)c3)C2)C1	ZINC001041727617	1345833527	/nfs/dbraw/zinc/83/35/27/1345833527.db2.gz	KXWHGGZYGDTGCO-RBBKRZOGSA-N	0	3	338.495	3.121	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)[C@@H]3C[C@H]3c3cccc(C)c3)C2)C1	ZINC001041735152	1345835739	/nfs/dbraw/zinc/83/57/39/1345835739.db2.gz	CSBNDTFOMBHJED-TUNNFDKTSA-N	0	3	336.479	3.046	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)C(C)(C)c3ccc(CC)cc3)C2)C1	ZINC001041782031	1345847928	/nfs/dbraw/zinc/84/79/28/1345847928.db2.gz	OYRNFUKUOWQZTA-QFIPXVFZSA-N	0	3	338.495	3.084	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)CC(C)(C)c3ccccc3)C2)C1	ZINC001041842468	1345869669	/nfs/dbraw/zinc/86/96/69/1345869669.db2.gz	GNBXVSXJOWBTOA-QFIPXVFZSA-N	0	3	338.495	3.302	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)C3(C(F)(F)F)CCCC3)C2)C1	ZINC001041855737	1345875140	/nfs/dbraw/zinc/87/51/40/1345875140.db2.gz	NHRGDJKJFXGNLS-INIZCTEOSA-N	0	3	342.405	3.057	20	30		EGEDHN
C/C(=C\C(=O)N1CC[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@H]2C1)C1CC1	ZINC001041962090	1345907638	/nfs/dbraw/zinc/90/76/38/1345907638.db2.gz	QIJPCQHZWKDTNI-DDNLZUTRSA-N	0	3	349.478	3.337	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3CCN(C(=O)CC4CCC4)C[C@H]32)c1	ZINC001041997938	1345917697	/nfs/dbraw/zinc/91/76/97/1345917697.db2.gz	WDTYHOGWMPKIMM-VQTJNVASSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3c(C)noc3CCC)C[C@H]21	ZINC001042053660	1345932361	/nfs/dbraw/zinc/93/23/61/1345932361.db2.gz	CQDIEOZIDJFXID-HZPDHXFCSA-N	0	3	331.460	3.048	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3ccc(CCC)s3)C[C@@H]21	ZINC001042080484	1345939587	/nfs/dbraw/zinc/93/95/87/1345939587.db2.gz	LXJYUVDENXFQHI-WBVHZDCISA-N	0	3	330.497	3.260	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cccc4ccc(C)nc43)C[C@@H]21	ZINC001042111664	1345947072	/nfs/dbraw/zinc/94/70/72/1345947072.db2.gz	MJLXYSYVTZUWSR-PXNSSMCTSA-N	0	3	347.462	3.103	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc(C)c4cccnc34)C[C@@H]21	ZINC001042154866	1345957723	/nfs/dbraw/zinc/95/77/23/1345957723.db2.gz	GHEMGIYIYLWZNS-XLIONFOSSA-N	0	3	347.462	3.103	20	30		EGEDHN
C#CCN1CC[C@H]2CCN(C(=O)CCc3ccc(C)c(Cl)c3)C[C@H]21	ZINC001042168362	1345964163	/nfs/dbraw/zinc/96/41/63/1345964163.db2.gz	USJIMOKJJJIGHH-PKOBYXMFSA-N	0	3	344.886	3.137	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3ccc(F)cc3)[C@@H]2C1	ZINC001042184825	1345971988	/nfs/dbraw/zinc/97/19/88/1345971988.db2.gz	ZTDAPWSSLYKKBW-FUHWJXTLSA-N	0	3	330.447	3.461	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3scnc3C)[C@@H]2C1	ZINC001042187892	1345975016	/nfs/dbraw/zinc/97/50/16/1345975016.db2.gz	OVSDZOORVVDRHP-LSDHHAIUSA-N	0	3	333.501	3.087	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(C)oc3C(F)(F)F)C[C@H]21	ZINC001042249743	1346005644	/nfs/dbraw/zinc/00/56/44/1346005644.db2.gz	PLTLEMCWXCKCEM-TZMCWYRMSA-N	0	3	342.361	3.329	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3cc(C(CC)CC)no3)C[C@H]21	ZINC001042263006	1346010162	/nfs/dbraw/zinc/01/01/62/1346010162.db2.gz	RIKSPTBXZBAPSN-SJLPKXTDSA-N	0	3	343.471	3.138	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3scnc3C(C)C)C[C@@H]21	ZINC001042263939	1346011116	/nfs/dbraw/zinc/01/11/16/1346011116.db2.gz	ZRIVRBGLTXUGSE-CABCVRRESA-N	0	3	333.501	3.379	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3csc(-c4ccoc4)n3)C[C@@H]21	ZINC001042271991	1346014617	/nfs/dbraw/zinc/01/46/17/1346014617.db2.gz	JSOFXAFXDANENQ-CJNGLKHVSA-N	0	3	343.452	3.126	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(-c4ccccc4)ccn3)C[C@@H]21	ZINC001042288526	1346018204	/nfs/dbraw/zinc/01/82/04/1346018204.db2.gz	UAMWMWBCVYZNAM-RXVVDRJESA-N	0	3	347.462	3.471	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cccc(-c4cnco4)c3)C[C@@H]21	ZINC001042297455	1346022092	/nfs/dbraw/zinc/02/20/92/1346022092.db2.gz	PDIRSSDCVFFWCR-QAPCUYQASA-N	0	3	337.423	3.064	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3coc4ccc(F)cc34)C[C@H]21	ZINC001042326082	1346035037	/nfs/dbraw/zinc/03/50/37/1346035037.db2.gz	LIKKVHZZZUVKRD-SUMWQHHRSA-N	0	3	328.387	3.294	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C34CC(c5ccccc5)(C3)C4)C[C@@H]21	ZINC001042376048	1346063426	/nfs/dbraw/zinc/06/34/26/1346063426.db2.gz	NSKFPGUNJGJDLU-LGRHEBEHSA-N	0	3	336.479	3.217	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C3(C(F)(F)F)CCCC3)C[C@@H]21	ZINC001042379155	1346064459	/nfs/dbraw/zinc/06/44/59/1346064459.db2.gz	HFRSTOSQEOGUDK-CABCVRRESA-N	0	3	342.405	3.055	20	30		EGEDHN
C[C@H]1C[C@H](NCc2cc(F)ccc2C#N)CCN1C(=O)c1ccco1	ZINC001044425893	1346325821	/nfs/dbraw/zinc/32/58/21/1346325821.db2.gz	PUVBCLTYHHAAFR-SUMWQHHRSA-N	0	3	341.386	3.073	20	30		EGEDHN
C[C@H]1C[C@@H]([NH2+]Cc2ccc(C#N)cc2)CCN1C(=O)c1ccccc1[O-]	ZINC001044477227	1346344220	/nfs/dbraw/zinc/34/42/20/1346344220.db2.gz	ZXNACIYOXXQECJ-YJBOKZPZSA-N	0	3	349.434	3.047	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2cc(F)ccc2C#N)CCN1C(=O)CCC1CC1	ZINC001044511158	1346353275	/nfs/dbraw/zinc/35/32/75/1346353275.db2.gz	UZKSBBDOFKTRFJ-AUUYWEPGSA-N	0	3	343.446	3.357	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2cc(F)ccc2C#N)CCN1C(=O)/C=C\C1CC1	ZINC001044523459	1346356055	/nfs/dbraw/zinc/35/60/55/1346356055.db2.gz	ORQPVZSOVLPYLU-ZPQAWGLFSA-N	0	3	341.430	3.133	20	30		EGEDHN
Cc1cccnc1C(=O)N1CC[C@H](NCc2ccccc2C#N)C[C@@H]1C	ZINC001044540000	1346363631	/nfs/dbraw/zinc/36/36/31/1346363631.db2.gz	QUZITNPFNLAPCW-LPHOPBHVSA-N	0	3	348.450	3.045	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@@H](NCc2ccccc2C#N)C[C@@H]1C	ZINC001044541404	1346364574	/nfs/dbraw/zinc/36/45/74/1346364574.db2.gz	CLCAGPFFAAUXHQ-WMLDXEAASA-N	0	3	329.419	3.291	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)CC1(C)CC1	ZINC001044690786	1346404415	/nfs/dbraw/zinc/40/44/15/1346404415.db2.gz	XRZWCVJRVLRQIR-CRAIPNDOSA-N	0	3	325.456	3.218	20	30		EGEDHN
C/C(=C/C(=O)N1CCC[C@H]1CNCc1ccc(C#N)c(F)c1)C1CC1	ZINC001044943030	1346467151	/nfs/dbraw/zinc/46/71/51/1346467151.db2.gz	IQRMGYAKLJYBFU-WAFIBAPDSA-N	0	3	341.430	3.134	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H]1CNCc1ccc(C#N)c(F)c1)C1CCC1	ZINC001045087452	1346491789	/nfs/dbraw/zinc/49/17/89/1346491789.db2.gz	HFWZVMULWADIDK-KSSFIOAISA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@H]2CNCc2c(C)noc2CC)CC1	ZINC001045182082	1346517769	/nfs/dbraw/zinc/51/77/69/1346517769.db2.gz	LQLKIGGMVLKZPV-KRWDZBQOSA-N	0	3	345.487	3.372	20	30		EGEDHN
C=C[C@@H](C(=O)N1CCC[C@H]1CNCc1ncccc1C)c1ccccc1	ZINC001045320314	1346558895	/nfs/dbraw/zinc/55/88/95/1346558895.db2.gz	QLXNNVYCZMQGDR-VQTJNVASSA-N	0	3	349.478	3.440	20	30		EGEDHN
CC1(NC(=O)C2C=CC=CC=C2)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045452915	1346597186	/nfs/dbraw/zinc/59/71/86/1346597186.db2.gz	QTMBOXUNTKCVSG-UHFFFAOYSA-N	0	3	347.462	3.327	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2ccc(C)c(OCC)c2)CC1	ZINC001045579048	1346634643	/nfs/dbraw/zinc/63/46/43/1346634643.db2.gz	VPPSUADLMSHHGC-UHFFFAOYSA-N	0	3	328.456	3.001	20	30		EGEDHN
CC[C@]1(C)C[C@H]1C(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1	ZINC001045604848	1346642592	/nfs/dbraw/zinc/64/25/92/1346642592.db2.gz	AYOHLIHYSCSFHD-AZUAARDMSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2ccc3[nH]c(C)c(C)c3c2)CC1	ZINC001045638344	1346655361	/nfs/dbraw/zinc/65/53/61/1346655361.db2.gz	VMWTZYWSOPBOOF-UHFFFAOYSA-N	0	3	337.467	3.392	20	30		EGEDHN
CCC(=O)N1CCCC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001045902933	1346739872	/nfs/dbraw/zinc/73/98/72/1346739872.db2.gz	IFQGSMVANWLEPX-FQEVSTJZSA-N	0	3	325.456	3.173	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)Cc1ccsc1)C2	ZINC001045909249	1346746063	/nfs/dbraw/zinc/74/60/63/1346746063.db2.gz	KYHZDTOHYNMQOK-IBGZPJMESA-N	0	3	330.497	3.019	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccoc1Cl)C2	ZINC001045932559	1346770208	/nfs/dbraw/zinc/77/02/08/1346770208.db2.gz	LHLQIZBYOJDOSH-SFHVURJKSA-N	0	3	334.847	3.275	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@]1(C)CC=CCC1)C2	ZINC001045940094	1346775845	/nfs/dbraw/zinc/77/58/45/1346775845.db2.gz	PZRNRFJBMDRLIN-NHCUHLMSSA-N	0	3	328.500	3.461	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc(Cl)[nH]1)C2	ZINC001045964089	1346798729	/nfs/dbraw/zinc/79/87/29/1346798729.db2.gz	YAYOVLAQHCDZKN-SFHVURJKSA-N	0	3	333.863	3.010	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@H](C)C(C)(F)F)C2	ZINC001045967644	1346802136	/nfs/dbraw/zinc/80/21/36/1346802136.db2.gz	ZCDKYEGCEFCAHH-MAUKXSAKSA-N	0	3	326.431	3.006	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc(C)cc1F)C2	ZINC001045969368	1346804832	/nfs/dbraw/zinc/80/48/32/1346804832.db2.gz	PJECHZABCOPFAZ-FQEVSTJZSA-N	0	3	328.431	3.086	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cccc3ccncc31)C2	ZINC001045977733	1346813867	/nfs/dbraw/zinc/81/38/67/1346813867.db2.gz	HJRMUUZTGYPPEC-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1sccc1CC)C2	ZINC001045986653	1346828575	/nfs/dbraw/zinc/82/85/75/1346828575.db2.gz	XGABDCFYRWUAJM-IBGZPJMESA-N	0	3	330.497	3.262	20	30		EGEDHN
C=CCCN1CC[C@@](C)(NC(=O)c2cnc(-c3ccco3)s2)C1	ZINC001046785581	1347100507	/nfs/dbraw/zinc/10/05/07/1347100507.db2.gz	IUESZMVCFCULDM-QGZVFWFLSA-N	0	3	331.441	3.173	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2ccc(F)cc2)C1	ZINC001046909558	1347149318	/nfs/dbraw/zinc/14/93/18/1347149318.db2.gz	DNKJLFNNLXAIRD-AWEZNQCLSA-N	0	3	326.362	3.089	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2occc2Cl)C1	ZINC001046969066	1347171086	/nfs/dbraw/zinc/17/10/86/1347171086.db2.gz	VNECYJIAQHHUCR-LLVKDONJSA-N	0	3	332.778	3.196	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2ccc3cc[nH]c3c2)C1	ZINC001046978772	1347174866	/nfs/dbraw/zinc/17/48/66/1347174866.db2.gz	SGIYMSSCRRFQHQ-MRXNPFEDSA-N	0	3	347.409	3.431	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2c(C)cccc2F)C1	ZINC001046995515	1347177570	/nfs/dbraw/zinc/17/75/70/1347177570.db2.gz	KDECJZILVMGYED-CQSZACIVSA-N	0	3	340.389	3.397	20	30		EGEDHN
Cc1coc(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)N(CC#Cc2ccccc2)C3)c1	ZINC001047129205	1347214827	/nfs/dbraw/zinc/21/48/27/1347214827.db2.gz	QSAMPQVZRVIYBT-ZCNNSNEGSA-N	0	3	348.446	3.222	20	30		EGEDHN
CC(C)(C)C(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(Cc1ccc(C#N)c(F)c1)C2	ZINC001047187594	1347235410	/nfs/dbraw/zinc/23/54/10/1347235410.db2.gz	DXUFPHZLRSARPM-UAGQMJEPSA-N	0	3	343.446	3.213	20	30		EGEDHN
CCC(=O)N1CCC[C@H](C2CCN(Cc3ccc(C#N)s3)CC2)C1	ZINC001047217961	1347249013	/nfs/dbraw/zinc/24/90/13/1347249013.db2.gz	YDDJRVZDGOFZTK-INIZCTEOSA-N	0	3	345.512	3.480	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3ccc(C)s3)C2)CC1	ZINC001047219677	1347251325	/nfs/dbraw/zinc/25/13/25/1347251325.db2.gz	PKMUPPFLNUSQAR-KRWDZBQOSA-N	0	3	330.497	3.254	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)c3ccoc3C)C2)CC1	ZINC001047224156	1347254096	/nfs/dbraw/zinc/25/40/96/1347254096.db2.gz	VUMDHNKGGHODQX-GOSISDBHSA-N	0	3	328.456	3.176	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)c3cc(C)c(C)o3)C2)CC1	ZINC001047234655	1347262682	/nfs/dbraw/zinc/26/26/82/1347262682.db2.gz	OMTFUVBWGJZPPG-LJQANCHMSA-N	0	3	342.483	3.484	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3cc(F)ccc3F)C2)CC1	ZINC001047244212	1347270084	/nfs/dbraw/zinc/27/00/84/1347270084.db2.gz	QPDDNCUHJBZANE-INIZCTEOSA-N	0	3	346.421	3.162	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@@H]3CCCC34CC4)C2)CC1	ZINC001047245161	1347270574	/nfs/dbraw/zinc/27/05/74/1347270574.db2.gz	WZBIVSDOLSELPR-OALUTQOASA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)c3[nH]c(C)cc3C)C2)CC1	ZINC001047245531	1347270835	/nfs/dbraw/zinc/27/08/35/1347270835.db2.gz	YPEAARFMGATZRF-IBGZPJMESA-N	0	3	341.499	3.219	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)[C@H](C)C(F)(F)F)C2)CC1	ZINC001047248528	1347273597	/nfs/dbraw/zinc/27/35/97/1347273597.db2.gz	RPJFIKLBJONHRA-GOEBONIOSA-N	0	3	344.421	3.159	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3ccn4ccccc34)C2)CC1	ZINC001047249772	1347274030	/nfs/dbraw/zinc/27/40/30/1347274030.db2.gz	BVQXABKAWKLKBF-IBGZPJMESA-N	0	3	349.478	3.137	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)Cc3occc3C)C2)CC1	ZINC001047254162	1347278271	/nfs/dbraw/zinc/27/82/71/1347278271.db2.gz	ODEDXWLYDUZXLH-IBGZPJMESA-N	0	3	342.483	3.104	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3occc3Cl)C2)CC1	ZINC001047254763	1347278740	/nfs/dbraw/zinc/27/87/40/1347278740.db2.gz	RUJFTELTFPSGII-HNNXBMFYSA-N	0	3	334.847	3.130	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3ccc(C)cc3F)C2)CC1	ZINC001047259106	1347281742	/nfs/dbraw/zinc/28/17/42/1347281742.db2.gz	KVLOUFLWEITWSM-GOSISDBHSA-N	0	3	342.458	3.332	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@@H](F)c3ccccc3)C2)CC1	ZINC001047259199	1347281776	/nfs/dbraw/zinc/28/17/76/1347281776.db2.gz	MGNBLMJTEGGABH-PMACEKPBSA-N	0	3	342.458	3.281	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)C[C@@H](C)n3cccc3)C2)CC1	ZINC001047263913	1347285124	/nfs/dbraw/zinc/28/51/24/1347285124.db2.gz	KNFSMPWFRWIWDQ-QUCCMNQESA-N	0	3	341.499	3.023	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)CC(C3CC3)C3CC3)C2)CC1	ZINC001047266008	1347286880	/nfs/dbraw/zinc/28/68/80/1347286880.db2.gz	NUEARFLMTMUVRE-HXUWFJFHSA-N	0	3	342.527	3.397	20	30		EGEDHN
C=CCCN1C[C@H](O)[C@@H](N(C)C(=O)C2CCC(CCCC)CC2)C1	ZINC001047618568	1347314420	/nfs/dbraw/zinc/31/44/20/1347314420.db2.gz	CXOXZCITZNKQSA-BTRQGYIVSA-N	0	3	336.520	3.063	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)C2C=CC=CC=C2)C1	ZINC001047859737	1347391713	/nfs/dbraw/zinc/39/17/13/1347391713.db2.gz	WMMQMQCOSGSEME-UTKZUKDTSA-N	0	3	347.462	3.183	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H]([C@H](C)NCc3cc(C)no3)C2)CC1	ZINC001047960593	1347425012	/nfs/dbraw/zinc/42/50/12/1347425012.db2.gz	UNXRFYWWYUHEAT-DOTOQJQBSA-N	0	3	331.460	3.056	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]([C@@H](C)NCc3nc(C)sc3C)C2)C1	ZINC001047965307	1347426835	/nfs/dbraw/zinc/42/68/35/1347426835.db2.gz	LXQGPWUSKRUFRJ-CZUORRHYSA-N	0	3	347.528	3.443	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](CNCc2cc(F)ccc2C#N)[C@H](C)C1	ZINC001048345466	1347525326	/nfs/dbraw/zinc/52/53/26/1347525326.db2.gz	UEGXMBFMHWHIIJ-RHSMWYFYSA-N	0	3	343.446	3.094	20	30		EGEDHN
C[C@H]1CN(C(=O)C(C)(C)C2CC2)C[C@H]1CNCc1ccccc1C#N	ZINC001048347426	1347526145	/nfs/dbraw/zinc/52/61/45/1347526145.db2.gz	DDJLYIAPLMPSFF-MAUKXSAKSA-N	0	3	339.483	3.179	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H](C)[C@H](CNCc3csc(C)n3)C2)CC1	ZINC001048375737	1347535509	/nfs/dbraw/zinc/53/55/09/1347535509.db2.gz	XBTHFEQOEGOMIY-WMLDXEAASA-N	0	3	347.528	3.382	20	30		EGEDHN
CCC1(C(=O)N2C[C@@H](CNCc3cc(F)ccc3C#N)[C@H](C)C2)CC1	ZINC001048379470	1347536844	/nfs/dbraw/zinc/53/68/44/1347536844.db2.gz	PJORIBOFKILXKU-RHSMWYFYSA-N	0	3	343.446	3.072	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@H](CC3CCCC3)C(C)C)C[C@@H]2C1	ZINC001049100336	1347725706	/nfs/dbraw/zinc/72/57/06/1347725706.db2.gz	YBDXCDCOUDOJFV-HSALFYBXSA-N	0	3	330.516	3.252	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc4c(s3)CCCCC4)C[C@@H]2C1	ZINC001049200102	1347744880	/nfs/dbraw/zinc/74/48/80/1347744880.db2.gz	JOYRPCOSIBMYQH-CALCHBBNSA-N	0	3	342.508	3.044	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccccc3-c3ccccc3)C[C@@H]2C1	ZINC001049200475	1347745779	/nfs/dbraw/zinc/74/57/79/1347745779.db2.gz	PORXHABPTQHFTG-BGYRXZFFSA-N	0	3	344.458	3.381	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)C[C@H]2C=CCC2)c1	ZINC001049314024	1347787365	/nfs/dbraw/zinc/78/73/65/1347787365.db2.gz	KXUCIZXHPCRNRW-DZFGPLHGSA-N	0	3	349.478	3.480	20	30		EGEDHN
Cc1cc[nH]c1C(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1cccc(C#N)c1	ZINC001049459033	1347858476	/nfs/dbraw/zinc/85/84/76/1347858476.db2.gz	SGVMWYMWFWCHHL-RTBURBONSA-N	0	3	348.450	3.074	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1oc(CC2CC2)nc1C	ZINC001049470944	1347864395	/nfs/dbraw/zinc/86/43/95/1347864395.db2.gz	URYUBEZYAVQWJS-IRXDYDNUSA-N	0	3	343.471	3.191	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)CC1(c2ccccc2)CC1	ZINC001049513081	1347886074	/nfs/dbraw/zinc/88/60/74/1347886074.db2.gz	VTSFPSYKFBSEKD-UXHICEINSA-N	0	3	336.479	3.197	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc2nc(C)oc2c1	ZINC001049530406	1347894475	/nfs/dbraw/zinc/89/44/75/1347894475.db2.gz	CCADJAGHAMRMMF-IAGOWNOFSA-N	0	3	325.412	3.001	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cnc(-c2ccccc2)o1	ZINC001049537322	1347896419	/nfs/dbraw/zinc/89/64/19/1347896419.db2.gz	NIBLDFAOADJPAF-QZTJIDSGSA-N	0	3	349.434	3.044	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(-n2cccc2)cc1	ZINC001049579541	1347919535	/nfs/dbraw/zinc/91/95/35/1347919535.db2.gz	LMFULJQLCVWLAS-SFTDATJTSA-N	0	3	347.462	3.180	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](c1ccccc1)C1CC1	ZINC001049594145	1347927777	/nfs/dbraw/zinc/92/77/77/1347927777.db2.gz	PHYIQDYOJPKMEF-NJYVYQBISA-N	0	3	336.479	3.269	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccncc1OC(C)C	ZINC001049615834	1347936311	/nfs/dbraw/zinc/93/63/11/1347936311.db2.gz	ODAYGFAVDADRLT-ZWKOTPCHSA-N	0	3	343.471	3.124	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1cccc2cccnc21	ZINC001049626750	1347941394	/nfs/dbraw/zinc/94/13/94/1347941394.db2.gz	SBEJLJSAGCYNAD-RTBURBONSA-N	0	3	335.451	3.029	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)[C@H]2C[C@H]3C[C@H]3C2)cc1	ZINC001049657192	1347957980	/nfs/dbraw/zinc/95/79/80/1347957980.db2.gz	BTOGNIAJRRFHOF-XDWAVFMPSA-N	0	3	349.478	3.170	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(F)c(Cl)c1F	ZINC001049690061	1347973075	/nfs/dbraw/zinc/97/30/75/1347973075.db2.gz	NNUGEYYBELFTHF-KGLIPLIRSA-N	0	3	340.801	3.483	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@@H]3[C@@H]2CCN3Cc2cccc(C#N)c2)CC1	ZINC001049704316	1347982394	/nfs/dbraw/zinc/98/23/94/1347982394.db2.gz	PLUFRIYPMNJNFF-MOPGFXCFSA-N	0	3	337.467	3.314	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](C)OC1CCCCCC1	ZINC001049710100	1347985318	/nfs/dbraw/zinc/98/53/18/1347985318.db2.gz	UISFGCPVFFEAKW-BHIYHBOVSA-N	0	3	334.504	3.366	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049734565	1347993639	/nfs/dbraw/zinc/99/36/39/1347993639.db2.gz	FHZSSVGKNKOMNL-ZRNYENFQSA-N	0	3	337.467	3.170	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1ccc(F)c(Cl)c1	ZINC001049747881	1347998548	/nfs/dbraw/zinc/99/85/48/1347998548.db2.gz	LGCRJJHGHOOKMO-MSOLQXFVSA-N	0	3	348.849	3.110	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccn(C(CC)CC)n1	ZINC001049766431	1348009824	/nfs/dbraw/zinc/00/98/24/1348009824.db2.gz	KYKRAAAPXGSOPU-OALUTQOASA-N	0	3	344.503	3.499	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)COc1ccsc1Cl	ZINC001049784049	1348020814	/nfs/dbraw/zinc/02/08/14/1348020814.db2.gz	WSPDQJIUQDWELJ-QWHCGFSZSA-N	0	3	340.876	3.032	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ncc(Cl)cc1Cl	ZINC001049807103	1348029589	/nfs/dbraw/zinc/02/95/89/1348029589.db2.gz	RDLZAVAZNNASFX-KBPBESRZSA-N	0	3	340.254	3.253	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cccn1C1CCCC1	ZINC001049812735	1348032559	/nfs/dbraw/zinc/03/25/59/1348032559.db2.gz	XNKJAPBTDQYZGE-ZWKOTPCHSA-N	0	3	327.472	3.468	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1coc(-c2ccccc2)n1	ZINC001049847824	1348056663	/nfs/dbraw/zinc/05/66/63/1348056663.db2.gz	FSTLWYYOMMMQEX-OALUTQOASA-N	0	3	349.434	3.044	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1oc(CCC)nc1C	ZINC001049849112	1348058084	/nfs/dbraw/zinc/05/80/84/1348058084.db2.gz	NTMQVSSDOYJBJH-CVEARBPZSA-N	0	3	331.460	3.191	20	30		EGEDHN
CC(C)(C)C(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049860099	1348066588	/nfs/dbraw/zinc/06/65/88/1348066588.db2.gz	ZECDRYDTIQMANH-MSOLQXFVSA-N	0	3	325.456	3.170	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H]1Cc2ccc(Cl)cc21	ZINC001049869095	1348074758	/nfs/dbraw/zinc/07/47/58/1348074758.db2.gz	CEQIFLDTIPFQFI-OKZBNKHCSA-N	0	3	330.859	3.231	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc2c(c1)CCCC2	ZINC001049878825	1348083564	/nfs/dbraw/zinc/08/35/64/1348083564.db2.gz	VQKPPTODMUKNTB-RTWAWAEBSA-N	0	3	336.479	3.268	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1sc(CCC)nc1C	ZINC001049888851	1348093766	/nfs/dbraw/zinc/09/37/66/1348093766.db2.gz	ABNGAWNWZSSEGX-CVEARBPZSA-N	0	3	345.512	3.106	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(C)n(C(C)(C)C)n1	ZINC001049899763	1348100104	/nfs/dbraw/zinc/10/01/04/1348100104.db2.gz	GQYKTXLEHUBLAV-ROUUACIJSA-N	0	3	344.503	3.202	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(C)c(F)c(C)c1	ZINC001049901734	1348101635	/nfs/dbraw/zinc/10/16/35/1348101635.db2.gz	AUIFOJJNRDZHTK-ZWKOTPCHSA-N	0	3	328.431	3.145	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1csc(CC(C)C)n1	ZINC001049927492	1348118600	/nfs/dbraw/zinc/11/86/00/1348118600.db2.gz	LCQROPINIXCZTQ-JKSUJKDBSA-N	0	3	333.501	3.207	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1c[nH]c2ccc(F)cc12	ZINC001049937285	1348122666	/nfs/dbraw/zinc/12/26/66/1348122666.db2.gz	RKDYPKDZRSDYCL-MOPGFXCFSA-N	0	3	339.414	3.009	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3cc(F)c(C)cc3F)[C@@H]2C1	ZINC001050069898	1348172368	/nfs/dbraw/zinc/17/23/68/1348172368.db2.gz	UBEGXXHAJDTDBR-KBXCAEBGSA-N	0	3	334.410	3.386	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)C3CCc4ccccc4CC3)[C@@H]2C1	ZINC001050077989	1348175239	/nfs/dbraw/zinc/17/52/39/1348175239.db2.gz	JTZKMKLHDIAJKN-LEWJYISDSA-N	0	3	338.495	3.290	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)[C@H]3[C@@H]4CCCCCC[C@@H]43)[C@@H]2C1	ZINC001050149314	1348196582	/nfs/dbraw/zinc/19/65/82/1348196582.db2.gz	GVEYVDQRDORMDL-CENDIDJXSA-N	0	3	328.500	3.149	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)C[C@@H]3CCc4ccccc4C3)[C@@H]2C1	ZINC001050190650	1348206450	/nfs/dbraw/zinc/20/64/50/1348206450.db2.gz	MTSUYDCKRYDTJE-JRGCBEDISA-N	0	3	338.495	3.290	20	30		EGEDHN
CC1(C(=O)N[C@H]2CC[C@H](CNCc3cc(F)ccc3C#N)CC2)CC1	ZINC001050330104	1348228952	/nfs/dbraw/zinc/22/89/52/1348228952.db2.gz	WUWAOQNQRAVZMQ-PPUGGXLSSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC[C@H](CNCc3nccs3)CC2)C1	ZINC001050363482	1348239366	/nfs/dbraw/zinc/23/93/66/1348239366.db2.gz	ZUVNOZBQYJJASB-SHTZXODSSA-N	0	3	333.501	3.264	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)c4ccccc4)C3)CC2)c1	ZINC001050414765	1348257488	/nfs/dbraw/zinc/25/74/88/1348257488.db2.gz	WYHTTWSHENOZGR-UHFFFAOYSA-N	0	3	345.446	3.296	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cc(F)cc4ccoc43)C2)CC1	ZINC001050574377	1348292289	/nfs/dbraw/zinc/29/22/89/1348292289.db2.gz	PKKOTFHTBVTONB-UHFFFAOYSA-N	0	3	340.398	3.133	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1cccnc1C)CC2	ZINC001050645407	1348313735	/nfs/dbraw/zinc/31/37/35/1348313735.db2.gz	LOORUMXOAZEAFV-FQEVSTJZSA-N	0	3	341.499	3.417	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3cc(C(C)(C)C)oc3C)C2)CC1	ZINC001050677823	1348323717	/nfs/dbraw/zinc/32/37/17/1348323717.db2.gz	FYZKOKOKVHLQGO-UHFFFAOYSA-N	0	3	328.456	3.057	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@@H](CC3CCCC3)C(C)C)C2)CC1	ZINC001050687815	1348327354	/nfs/dbraw/zinc/32/73/54/1348327354.db2.gz	USLGPTGNOFBCAF-IBGZPJMESA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H]3C[C@H]3c3ccccc3C)C2)CC1	ZINC001050695637	1348330041	/nfs/dbraw/zinc/33/00/41/1348330041.db2.gz	NWCXLIGYPYELCW-VQTJNVASSA-N	0	3	336.479	3.046	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C(C)(C)c3ccccc3F)C2)CC1	ZINC001050701100	1348331228	/nfs/dbraw/zinc/33/12/28/1348331228.db2.gz	TVLAYMNZZUROGO-UHFFFAOYSA-N	0	3	342.458	3.051	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc(C4CC4)s3)C2)CC1	ZINC001050730649	1348340029	/nfs/dbraw/zinc/34/00/29/1348340029.db2.gz	LSFDGCRZGDMRMA-UHFFFAOYSA-N	0	3	328.481	3.187	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)Cc3cccc4ccccc43)C2)CC1	ZINC001050736353	1348342246	/nfs/dbraw/zinc/34/22/46/1348342246.db2.gz	BAFUPZUXDICREI-UHFFFAOYSA-N	0	3	346.474	3.330	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H](C)c3ccc(F)c(F)c3)C2)CC1	ZINC001050759759	1348350670	/nfs/dbraw/zinc/35/06/70/1348350670.db2.gz	SBRUGVSPUBVZHY-OAHLLOKOSA-N	0	3	346.421	3.016	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cc4c(cccc4C)o3)C2)CC1	ZINC001050768476	1348353275	/nfs/dbraw/zinc/35/32/75/1348353275.db2.gz	VSKOXARPMWZSDS-UHFFFAOYSA-N	0	3	336.435	3.303	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3oc4ccccc4c3CC)C2)CC1	ZINC001050771787	1348355056	/nfs/dbraw/zinc/35/50/56/1348355056.db2.gz	YZBFXICPHOPYLS-UHFFFAOYSA-N	0	3	336.435	3.166	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3ccccc3C)cccc2C1	ZINC001051277729	1348414506	/nfs/dbraw/zinc/41/45/06/1348414506.db2.gz	USPFQEYPNNHPRE-UHFFFAOYSA-N	0	3	332.447	3.306	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)[C@H]3CCC3(F)F)cccc2C1	ZINC001051292520	1348421770	/nfs/dbraw/zinc/42/17/70/1348421770.db2.gz	AUBAJLUEBJUXEB-QGZVFWFLSA-N	0	3	334.410	3.282	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H](NC(=O)Cc3ccccc3)CC2)cc1	ZINC001052501029	1348560749	/nfs/dbraw/zinc/56/07/49/1348560749.db2.gz	VOMADGSPMIDJMJ-NRFANRHFSA-N	0	3	347.462	3.272	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)Cc2cccc(C(F)F)c2)CC1	ZINC001052552848	1348577373	/nfs/dbraw/zinc/57/73/73/1348577373.db2.gz	BDGOYSOESHYIMG-KRWDZBQOSA-N	0	3	334.410	3.161	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@@H]2CCCN(C/C=C/Cl)CC2)cc1	ZINC001052772659	1348672993	/nfs/dbraw/zinc/67/29/93/1348672993.db2.gz	BRYLINZWOJAALH-DPTHPHEISA-N	0	3	346.858	3.035	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc(-c3ccccc3)nc2)CC1	ZINC001052816546	1348687902	/nfs/dbraw/zinc/68/79/02/1348687902.db2.gz	NGMDDXPFGGJGCB-HXUWFJFHSA-N	0	3	347.462	3.356	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)C(C)(C)c2ccc(C)cc2)CC1	ZINC001052877259	1348714525	/nfs/dbraw/zinc/71/45/25/1348714525.db2.gz	HHQAKSOEQPIMNE-LJQANCHMSA-N	0	3	326.484	3.267	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)C(C)(C)c2ccc(F)cc2)CC1	ZINC001052877404	1348715048	/nfs/dbraw/zinc/71/50/48/1348715048.db2.gz	LOLPXUUSPQBLBX-GOSISDBHSA-N	0	3	330.447	3.097	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)C[C@@H]2CCc3ccccc3C2)CC1	ZINC001052893847	1348731411	/nfs/dbraw/zinc/73/14/11/1348731411.db2.gz	FIEWDUAVKKIPIG-NQIIRXRSSA-N	0	3	338.495	3.176	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)C(C)(C)c2ccccc2C)CC1	ZINC001052974998	1348782315	/nfs/dbraw/zinc/78/23/15/1348782315.db2.gz	SFWMODVRBIZVQA-SFHVURJKSA-N	0	3	326.484	3.267	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)C2C(C)(C)C2(C)C)C1	ZINC001053076553	1348894860	/nfs/dbraw/zinc/89/48/60/1348894860.db2.gz	PPUHJELNFKCUJV-IAGOWNOFSA-N	0	3	330.516	3.395	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2coc(C)c2)C1	ZINC001053080553	1348901517	/nfs/dbraw/zinc/90/15/17/1348901517.db2.gz	PZGYUHUKAMVZHR-PKOBYXMFSA-N	0	3	328.456	3.318	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cc(Cl)no2)C1	ZINC001053104340	1348939696	/nfs/dbraw/zinc/93/96/96/1348939696.db2.gz	OFRRTMUXZYEXFR-HUUCEWRRSA-N	0	3	349.862	3.058	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)Cc2ccccc2F)C1	ZINC001053107086	1348945589	/nfs/dbraw/zinc/94/55/89/1348945589.db2.gz	YZMXGFWFMQUPHV-UYAOXDASSA-N	0	3	342.458	3.095	20	30		EGEDHN
C=C(C)CCN1Cc2ccccc2C[C@H]1CNC(=O)[C@@H]1CCCCO1	ZINC001054037329	1349134070	/nfs/dbraw/zinc/13/40/70/1349134070.db2.gz	BWQVOCJFQKWZNL-PMACEKPBSA-N	0	3	342.483	3.065	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2Cc3ccccc3CN2CCCC)cn1	ZINC001054058785	1349141156	/nfs/dbraw/zinc/14/11/56/1349141156.db2.gz	WYRBVUDYYCUJTP-NRFANRHFSA-N	0	3	347.462	3.020	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H]1CCCc3ccccc31)C2	ZINC001054153368	1349156065	/nfs/dbraw/zinc/15/60/65/1349156065.db2.gz	PWJJBWDZDZABAT-IFMALSPDSA-N	0	3	336.479	3.054	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc(C)c3ccccc3n1)C2	ZINC001054154880	1349157967	/nfs/dbraw/zinc/15/79/67/1349157967.db2.gz	XSUSHMVKNLQYQK-JOCHJYFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)Cc1cccc(C(C)C)c1)C2	ZINC001054160235	1349162228	/nfs/dbraw/zinc/16/22/28/1349162228.db2.gz	ZFGAVEXVFNVPIC-JOCHJYFZSA-N	0	3	338.495	3.300	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)Cc1cccc(C3CC3)c1)C2	ZINC001054171267	1349173252	/nfs/dbraw/zinc/17/32/52/1349173252.db2.gz	MVGLMAKQLKGRHZ-JOCHJYFZSA-N	0	3	336.479	3.054	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)CCc1cccc(Cl)c1)C2	ZINC001054172526	1349173706	/nfs/dbraw/zinc/17/37/06/1349173706.db2.gz	QUHSQHVQXILQDN-HXUWFJFHSA-N	0	3	344.886	3.220	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)CCc1ccc(Cl)cc1)C2	ZINC001054172768	1349173848	/nfs/dbraw/zinc/17/38/48/1349173848.db2.gz	WYMVSYYZLRPIQS-HXUWFJFHSA-N	0	3	344.886	3.220	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@]2(CCN(Cc3ccccn3)C2)C1	ZINC001054174931	1349176492	/nfs/dbraw/zinc/17/64/92/1349176492.db2.gz	DGYMDILOFWHEDZ-NRFANRHFSA-N	0	3	341.499	3.498	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@]2(CCN(Cc3cccnc3)C2)C1	ZINC001054177278	1349179752	/nfs/dbraw/zinc/17/97/52/1349179752.db2.gz	IRMIIDHMEQCBFE-HXUWFJFHSA-N	0	3	327.472	3.108	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H](c1ccccc1)C(C)C)C2	ZINC001054202852	1349204213	/nfs/dbraw/zinc/20/42/13/1349204213.db2.gz	BFAPMNCJQWASAA-IFMALSPDSA-N	0	3	338.495	3.374	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H]1C[C@H]1c1ccccc1)C2	ZINC001054230131	1349224231	/nfs/dbraw/zinc/22/42/31/1349224231.db2.gz	MWVOUBNXPSHLIL-TUNNFDKTSA-N	0	3	336.479	3.128	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)[C@H](C)c1cccc(Cl)c1)C2	ZINC001054242615	1349235922	/nfs/dbraw/zinc/23/59/22/1349235922.db2.gz	PCUGNQLVLRRFEA-UZLBHIALSA-N	0	3	344.886	3.391	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@]1(C)CC=C(C)CC1)C2	ZINC001054244135	1349237590	/nfs/dbraw/zinc/23/75/90/1349237590.db2.gz	SNHQEJVIEGJBRU-LEWJYISDSA-N	0	3	328.500	3.461	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1sccc1CC)C2	ZINC001054245587	1349239239	/nfs/dbraw/zinc/23/92/39/1349239239.db2.gz	WBUDAYAZDHJGAU-LJQANCHMSA-N	0	3	330.497	3.262	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cc(Cl)c[nH]3)cc2C1	ZINC001054255103	1349250762	/nfs/dbraw/zinc/25/07/62/1349250762.db2.gz	YPVIVOQZTQURGH-UHFFFAOYSA-N	0	3	329.831	3.490	20	30		EGEDHN
C#Cc1ccc(C(=O)NCc2ccc3c(c2)CN(CC2CC2)C3)cc1	ZINC001054277231	1349278141	/nfs/dbraw/zinc/27/81/41/1349278141.db2.gz	QIOCYMPJNZSWLD-UHFFFAOYSA-N	0	3	330.431	3.324	20	30		EGEDHN
CC(C(=O)N1C[C@H](C)[C@H](NCc2ccc(C#N)s2)C1)=C1CCCC1	ZINC001054546481	1349394583	/nfs/dbraw/zinc/39/45/83/1349394583.db2.gz	FUULKEPZFXDUSQ-SCLBCKFNSA-N	0	3	343.496	3.447	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@@H](C)Cc3ccc(F)cc3)[C@@H]2C1	ZINC001084863588	1358334962	/nfs/dbraw/zinc/33/49/62/1358334962.db2.gz	HUXVNYZTGNVUHA-KVSKMBFKSA-N	0	3	330.447	3.113	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc(Cl)c(Cl)n1C	ZINC001085628515	1358645707	/nfs/dbraw/zinc/64/57/07/1358645707.db2.gz	YQYCXKHIQKRUQW-GFCCVEGCSA-N	0	3	344.286	3.444	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)CC(C)(C)C1CC1)C[C@H](C)O2	ZINC001071164050	1354483481	/nfs/dbraw/zinc/48/34/81/1354483481.db2.gz	GVYXQPQXTFAWEL-OXJNMPFZSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1cc(F)ccc1C)C[C@H](C)O2	ZINC001071195513	1354496419	/nfs/dbraw/zinc/49/64/19/1354496419.db2.gz	YMQKTZQGEMSMBP-JXFKEZNVSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H](C)O[C@@]3(CCN(CC=C(C)C)C3)C2)CC1	ZINC001071202311	1354502856	/nfs/dbraw/zinc/50/28/56/1354502856.db2.gz	SXNRSGUOMGTJOD-GHTZIAJQSA-N	0	3	346.515	3.391	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1c(C)cccc1C)C[C@H](C)O2	ZINC001071211365	1354507893	/nfs/dbraw/zinc/50/78/93/1354507893.db2.gz	GRLSPYJGEUSWKJ-RXVVDRJESA-N	0	3	342.483	3.185	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1ccoc1CCC)C[C@H](C)O2	ZINC001071228443	1354514095	/nfs/dbraw/zinc/51/40/95/1354514095.db2.gz	UUZNPBGEZNAJGQ-OXJNMPFZSA-N	0	3	346.471	3.114	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1ccc(Cl)cc1)C[C@H](C)O2	ZINC001071234407	1354517850	/nfs/dbraw/zinc/51/78/50/1354517850.db2.gz	YRZFMFFJSRCNHD-KXBFYZLASA-N	0	3	348.874	3.222	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1ccccc1Cl)C[C@@H](C)O2	ZINC001071234097	1354518457	/nfs/dbraw/zinc/51/84/57/1354518457.db2.gz	TXPHHEYUVUNMTM-DNVCBOLYSA-N	0	3	348.874	3.222	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C13CCC(CC1)CC3)C[C@@H](C)O2	ZINC001071244118	1354524791	/nfs/dbraw/zinc/52/47/91/1354524791.db2.gz	PSAWGUWKRFHQOG-AXIYNFMDSA-N	0	3	346.515	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1ccoc1C(C)C)C[C@@H](C)O2	ZINC001071245576	1354525396	/nfs/dbraw/zinc/52/53/96/1354525396.db2.gz	GEKLDPHMOUXTDI-OXQOHEQNSA-N	0	3	346.471	3.285	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1ccoc1C(C)C)C[C@H](C)O2	ZINC001071245575	1354525528	/nfs/dbraw/zinc/52/55/28/1354525528.db2.gz	GEKLDPHMOUXTDI-OXJNMPFZSA-N	0	3	346.471	3.285	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2oc(CC3CC3)nc2C)CC[C@H]1C	ZINC001071504645	1354732677	/nfs/dbraw/zinc/73/26/77/1354732677.db2.gz	IKUYJVVTGZANPV-CZUORRHYSA-N	0	3	331.460	3.094	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2CCCCCN(C(=O)C3CCC3)C2)c1	ZINC001088246280	1359815082	/nfs/dbraw/zinc/81/50/82/1359815082.db2.gz	OVQFAVHAOVURQJ-SFHVURJKSA-N	0	3	343.446	3.358	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2(c3cccc(Cl)c3)CC2)CC[C@H]1C	ZINC001071544457	1354757715	/nfs/dbraw/zinc/75/77/15/1354757715.db2.gz	YWJKVHWXGFFXPZ-QAPCUYQASA-N	0	3	344.886	3.364	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc(Cl)c(Cl)n2C)CC[C@@H]1C	ZINC001071548517	1354760637	/nfs/dbraw/zinc/76/06/37/1354760637.db2.gz	HHHDKTKFWDLUEP-RYUDHWBXSA-N	0	3	344.286	3.491	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2cncc3ccccc32)CC[C@H]1C	ZINC001071584635	1354778668	/nfs/dbraw/zinc/77/86/68/1354778668.db2.gz	RLMQYNXZZHITOM-VQIMIIECSA-N	0	3	337.467	3.323	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc(C)c3ccccc3n2)CC[C@@H]1C	ZINC001071612621	1354797336	/nfs/dbraw/zinc/79/73/36/1354797336.db2.gz	LBPBCBVRIIDKKX-IRXDYDNUSA-N	0	3	335.451	3.149	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2cc(C)ccc2OC)CC[C@H]1C	ZINC001071664175	1354836782	/nfs/dbraw/zinc/83/67/82/1354836782.db2.gz	ZMVLUXOOCCMHMI-AEFFLSMTSA-N	0	3	330.472	3.091	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(C)nc2C(C)C)CC[C@@H]1C	ZINC001071715463	1354873539	/nfs/dbraw/zinc/87/35/39/1354873539.db2.gz	IBXLEUHRPXDDAO-DLBZAZTESA-N	0	3	327.472	3.119	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc3ccccc3[nH]c2=O)CC[C@@H]1C	ZINC001071724593	1354880988	/nfs/dbraw/zinc/88/09/88/1354880988.db2.gz	JMXVMCXWEVEIKU-HOCLYGCPSA-N	0	3	339.439	3.099	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc(F)c(Cl)cc2F)CC[C@H]1C	ZINC001071779843	1354929477	/nfs/dbraw/zinc/92/94/77/1354929477.db2.gz	PPFBXFVGHRLFTJ-NEPJUHHUSA-N	0	3	340.801	3.224	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CC[C@H](C)N(Cc3ccc(C)cc3)C2)c1	ZINC001071816020	1354956937	/nfs/dbraw/zinc/95/69/37/1354956937.db2.gz	TUHUMNHQEGQSQE-LAUBAEHRSA-N	0	3	347.462	3.154	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2csc(C3CC3)n2)CC[C@H]1C	ZINC001071879457	1355002634	/nfs/dbraw/zinc/00/26/34/1355002634.db2.gz	CZSYRUJHQUPOIW-UKRRQHHQSA-N	0	3	333.501	3.108	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(C(F)F)cc2F)CC[C@H]1C	ZINC001071920366	1355025489	/nfs/dbraw/zinc/02/54/89/1355025489.db2.gz	PXTSRFRRHVXROL-TZMCWYRMSA-N	0	3	338.373	3.369	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc3nc(C)ccc3c2)CC[C@H]1C	ZINC001071920874	1355025557	/nfs/dbraw/zinc/02/55/57/1355025557.db2.gz	YQQDAMHNBUPKJY-VQIMIIECSA-N	0	3	335.451	3.149	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(C(F)F)cc2F)CC[C@@H]1C	ZINC001071920363	1355025951	/nfs/dbraw/zinc/02/59/51/1355025951.db2.gz	PXTSRFRRHVXROL-GXTWGEPZSA-N	0	3	338.373	3.369	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc3nc(C)sc3c2)CC[C@H]1C	ZINC001071960822	1355045238	/nfs/dbraw/zinc/04/52/38/1355045238.db2.gz	IHLKGYAVTHEABB-CJNGLKHVSA-N	0	3	341.480	3.211	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc(C)n(CC3CC3)c2C)CC[C@H]1C	ZINC001072002724	1355068078	/nfs/dbraw/zinc/06/80/78/1355068078.db2.gz	NYHNXJZDZYUTJW-DNVCBOLYSA-N	0	3	341.499	3.121	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccccc2C(F)(F)F)CC[C@@H]1C	ZINC001072016037	1355079115	/nfs/dbraw/zinc/07/91/15/1355079115.db2.gz	LKMQAILUTVZFHX-UONOGXRCSA-N	0	3	338.373	3.311	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2(c3ccccc3C)CCC2)CC[C@H]1C	ZINC001072026523	1355087987	/nfs/dbraw/zinc/08/79/87/1355087987.db2.gz	KDHSTHZDQGJQRE-MOPGFXCFSA-N	0	3	338.495	3.409	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2ccc3c(c2)CCC3)CC[C@@H]1C	ZINC001072070648	1355111823	/nfs/dbraw/zinc/11/18/23/1355111823.db2.gz	RJTPWAXWQLWCPO-OXJNMPFZSA-N	0	3	326.484	3.263	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C23CC(c4ccccc4)(C2)C3)CC[C@@H]1C	ZINC001072110322	1355136492	/nfs/dbraw/zinc/13/64/92/1355136492.db2.gz	WDOUGRHMBJVJSI-MCNZBGGYSA-N	0	3	336.479	3.101	20	30		EGEDHN
C[C@@H]1CCN(C(=O)C2CCC2)C[C@H]1CNCc1cc(F)ccc1C#N	ZINC001072153917	1355155014	/nfs/dbraw/zinc/15/50/14/1355155014.db2.gz	JZGKWHAIKRADBR-RDTXWAMCSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](C)[C@@H](CNCc3cnc(C)o3)C2)CC1	ZINC001072356160	1355254598	/nfs/dbraw/zinc/25/45/98/1355254598.db2.gz	HIGKXZVBWGXRNO-YJBOKZPZSA-N	0	3	345.487	3.304	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC2(C1)CCN([C@@H]1CCc3c1cccc3Cl)C2	ZINC001072552099	1355331148	/nfs/dbraw/zinc/33/11/48/1355331148.db2.gz	MNQFUSVVPJRNHT-SUMWQHHRSA-N	0	3	343.858	3.021	20	30		EGEDHN
Cc1cc(C(=O)N2CC3(C2)CCN(Cc2ccc(C#N)cc2)C3)oc1C	ZINC001072625449	1355364701	/nfs/dbraw/zinc/36/47/01/1355364701.db2.gz	LGMXTSJAWNOIJH-UHFFFAOYSA-N	0	3	349.434	3.116	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CN(C(=O)C4=CCCCCC4)C3)C2)cc1	ZINC001072657901	1355377950	/nfs/dbraw/zinc/37/79/50/1355377950.db2.gz	GTGBNFRYCOAYNV-UHFFFAOYSA-N	0	3	349.478	3.483	20	30		EGEDHN
C[C@H](C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2)C1CCC1	ZINC001072846323	1355462665	/nfs/dbraw/zinc/46/26/65/1355462665.db2.gz	RYPNADUGRBDKQG-INIZCTEOSA-N	0	3	337.467	3.029	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H]3C[C@H]3c3cccc(Cl)c3)C2)C1	ZINC001073043886	1355567009	/nfs/dbraw/zinc/56/70/09/1355567009.db2.gz	GQEFUHDSTBYSIY-ZWKOTPCHSA-N	0	3	342.870	3.001	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2ccc(C)c(Cl)c2)C1	ZINC001073756313	1355890505	/nfs/dbraw/zinc/89/05/05/1355890505.db2.gz	ZNCGWZXCMUSUQQ-MRXNPFEDSA-N	0	3	336.863	3.045	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2cc(C(C)C)oc2C)C1	ZINC001073841395	1355914792	/nfs/dbraw/zinc/91/47/92/1355914792.db2.gz	JUJMEHDYZAQLPE-INIZCTEOSA-N	0	3	334.460	3.108	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC001073869953	1355928476	/nfs/dbraw/zinc/92/84/76/1355928476.db2.gz	LUHDZPHDONYXHF-LJQANCHMSA-N	0	3	344.499	3.381	20	30		EGEDHN
C[C@H]1[C@@H](NCc2ccc(C#N)s2)CCN1C(=O)C[C@@H]1C=CCCC1	ZINC001074707983	1356226957	/nfs/dbraw/zinc/22/69/57/1356226957.db2.gz	ZZTGNZCVVWHFNS-DAYGRLMNSA-N	0	3	343.496	3.445	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@@H](CNCc2ccccc2C#N)[C@@H](C)C1	ZINC001075209772	1356344028	/nfs/dbraw/zinc/34/40/28/1356344028.db2.gz	QMPYPOXLBHPDFR-WMZOPIPTSA-N	0	3	325.456	3.099	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)c3ccc(O[C@H](C)CC)cc3)[C@@H]2C1	ZINC001076438597	1356578218	/nfs/dbraw/zinc/57/82/18/1356578218.db2.gz	IDSJALBSZMFJMS-HHXXYDBFSA-N	0	3	328.456	3.196	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)C3CC(c4cccc(F)c4)C3)[C@@H]2C1	ZINC001076638102	1356640163	/nfs/dbraw/zinc/64/01/63/1356640163.db2.gz	IZEFDMYXZQLAIN-BOMAWHNGSA-N	0	3	328.431	3.038	20	30		EGEDHN
C=C(C)CCN1C[C@@H](O)[C@H](NC(=O)c2ccc(C(C)(C)CC)cc2)C1	ZINC001077197689	1356743280	/nfs/dbraw/zinc/74/32/80/1356743280.db2.gz	AJODNAHKWOOSOL-RTBURBONSA-N	0	3	344.499	3.115	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)C[C@H](C)c1ccncc1	ZINC001099125918	1363638990	/nfs/dbraw/zinc/63/89/90/1363638990.db2.gz	MPPAQLIAQNKESQ-WMZOPIPTSA-N	0	3	329.488	3.368	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)Cn1ccc2ccccc21	ZINC001099344442	1363762645	/nfs/dbraw/zinc/76/26/45/1363762645.db2.gz	KWKMCYIDJLMGDO-GOSISDBHSA-N	0	3	339.483	3.434	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@@H](NCc3ccns3)C23CCC3)C1	ZINC001078720582	1357065974	/nfs/dbraw/zinc/06/59/74/1357065974.db2.gz	NJMOGMIPQLCOFX-CABCVRRESA-N	0	3	331.485	3.016	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2ccc(C(C)C)cn2)C[C@H]1c1ccccc1	ZINC001081179739	1357847678	/nfs/dbraw/zinc/84/76/78/1357847678.db2.gz	HXTFWFVUHNLORF-PZJWPPBQSA-N	0	3	347.462	3.036	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2ccsc2Cl)C[C@H]1c1ccccc1	ZINC001081190516	1357848670	/nfs/dbraw/zinc/84/86/70/1357848670.db2.gz	GPNCNDGPZCQJIJ-JKSUJKDBSA-N	0	3	344.867	3.233	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2cscc2C(F)F)[C@H](OC)C1	ZINC001081680928	1357861762	/nfs/dbraw/zinc/86/17/62/1357861762.db2.gz	QMADYQFLDGMBED-ZIAGYGMSSA-N	0	3	344.427	3.081	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2cc3cc(C)ccc3o2)[C@H](OC)C1	ZINC001082384077	1358024863	/nfs/dbraw/zinc/02/48/63/1358024863.db2.gz	BTGLJOXBRKIMJS-VQIMIIECSA-N	0	3	342.439	3.136	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)[C@H](C)CC3CCCCC3)[C@H]2C1	ZINC001083212898	1358124140	/nfs/dbraw/zinc/12/41/40/1358124140.db2.gz	GEBGVVDXDWHAQT-NZSAHSFTSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)C[C@H](C)c3ccccc3)[C@H]2C1	ZINC001083266106	1358128368	/nfs/dbraw/zinc/12/83/68/1358128368.db2.gz	HSPUMWNBUITWMR-YSIASYRMSA-N	0	3	342.483	3.058	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CN(CCC3CCCCCC3)C[C@@H]2O)CC1	ZINC001083754659	1358134523	/nfs/dbraw/zinc/13/45/23/1358134523.db2.gz	FPHQYFVRCYKFRW-UXHICEINSA-N	0	3	348.531	3.255	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)CC3CC(c4ccccc4)C3)[C@@H]2C1	ZINC001084465252	1358220517	/nfs/dbraw/zinc/22/05/17/1358220517.db2.gz	FPCQLFZUWTYCSU-BCKAPOECSA-N	0	3	336.479	3.126	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3cc(-c4ccccc4)on3)[C@@H]2C1	ZINC001084502144	1358226849	/nfs/dbraw/zinc/22/68/49/1358226849.db2.gz	DPAKADJAFJPRFH-SJLPKXTDSA-N	0	3	337.423	3.064	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)c3cccc(-c4ccoc4)c3)[C@@H]2C1	ZINC001084762527	1358303635	/nfs/dbraw/zinc/30/36/35/1358303635.db2.gz	CJUAAEGODSZASL-UYAOXDASSA-N	0	3	334.419	3.116	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3cnc(C4CC4)s3)[C@@H]2C1	ZINC001084788568	1358309291	/nfs/dbraw/zinc/30/92/91/1358309291.db2.gz	NNSCEXBVDTVYFC-HUUCEWRRSA-N	0	3	331.485	3.133	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)C[C@@H]3CCc4ccccc4C3)[C@@H]2C1	ZINC001084795816	1358313346	/nfs/dbraw/zinc/31/33/46/1358313346.db2.gz	VVKNCPPLFJHSCC-DUXKGJEZSA-N	0	3	338.495	3.290	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)CC(C)(C)c3ccc(C)cc3)[C@@H]2C1	ZINC001084819021	1358320102	/nfs/dbraw/zinc/32/01/02/1358320102.db2.gz	DJENZULMVSEZPP-UYAOXDASSA-N	0	3	338.495	3.219	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)[C@@H](c3ccc(F)cc3)C(C)C)[C@@H]2C1	ZINC001084857959	1358331741	/nfs/dbraw/zinc/33/17/41/1358331741.db2.gz	CHSRCCKFEQDMQZ-MISYRCLQSA-N	0	3	342.458	3.121	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@]3(C)CCCc4ccccc43)C[C@@H]21	ZINC001085056986	1358380635	/nfs/dbraw/zinc/38/06/35/1358380635.db2.gz	XBJMRCHDCLPVAZ-CBQOVEMMSA-N	0	3	338.495	3.389	20	30		EGEDHN
CC1CC(C(=O)N[C@@H]2CCCC[C@H]2NCc2cc(C#N)ccc2F)C1	ZINC001085165955	1358420337	/nfs/dbraw/zinc/42/03/37/1358420337.db2.gz	DCWNKNHJJWDTHA-NHADURIESA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)C1=CCCC1	ZINC001085168273	1358421070	/nfs/dbraw/zinc/42/10/70/1358421070.db2.gz	GRZBMBWGACCWPF-ZIAGYGMSSA-N	0	3	327.266	3.022	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccn(C(C)(C)C)n1	ZINC001085215636	1358435723	/nfs/dbraw/zinc/43/57/23/1358435723.db2.gz	GZHWNTQZNRQYLF-ZIAGYGMSSA-N	0	3	338.883	3.021	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H]1CCC1(C)C	ZINC001085303565	1358459466	/nfs/dbraw/zinc/45/94/66/1358459466.db2.gz	PZHCAUKNUYGWBJ-MGPQQGTHSA-N	0	3	343.309	3.348	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@@H]2CCCC[C@H]2NC(=O)[C@H]2CC23CC3)c1	ZINC001085344132	1358472967	/nfs/dbraw/zinc/47/29/67/1358472967.db2.gz	QNWCLKKLKXKSOL-KBAYOESNSA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H]1CCOc2ccccc21	ZINC001085365391	1358479883	/nfs/dbraw/zinc/47/98/83/1358479883.db2.gz	UTHPPXKAVCGHLE-GVDBMIGSSA-N	0	3	348.874	3.322	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)Cc1ccc(C)s1	ZINC001085432051	1358498127	/nfs/dbraw/zinc/49/81/27/1358498127.db2.gz	GMTGPDORUQJQGQ-HUUCEWRRSA-N	0	3	326.893	3.369	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1Cc2cccc(C)c2O1	ZINC001085444778	1358501682	/nfs/dbraw/zinc/50/16/82/1358501682.db2.gz	PMEMHWSXQCIAIK-ZACQAIPSSA-N	0	3	348.874	3.068	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1ccn(C2CCCCC2)n1	ZINC001085595875	1358622210	/nfs/dbraw/zinc/62/22/10/1358622210.db2.gz	PDKMXCBPVFTQLE-QGZVFWFLSA-N	0	3	330.476	3.111	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ncn2cc(Cl)ccc12	ZINC001085605722	1358628374	/nfs/dbraw/zinc/62/83/74/1358628374.db2.gz	RHBWYUDRNBNMHA-HNNXBMFYSA-N	0	3	346.862	3.100	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N(C)C[C@@H]1CCN1CC1CC(C)C1	ZINC001085678393	1358681664	/nfs/dbraw/zinc/68/16/64/1358681664.db2.gz	IPHSEZTUQAMWEM-ABHNRTSZSA-N	0	3	342.483	3.444	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@@H]1Cc2cc(Cl)ccc2O1	ZINC001085707100	1358698837	/nfs/dbraw/zinc/69/88/37/1358698837.db2.gz	CSXZMDCGCDVFSU-AEFFLSMTSA-N	0	3	348.874	3.142	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1cnc2c(F)cccc2c1	ZINC001085725386	1358713633	/nfs/dbraw/zinc/71/36/33/1358713633.db2.gz	URLNTUCQMUVRDD-MRXNPFEDSA-N	0	3	327.403	3.096	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cnn(C(C)C)c1Cl	ZINC001085746033	1358727910	/nfs/dbraw/zinc/72/79/10/1358727910.db2.gz	WVKZVYSHBILTFU-CQSZACIVSA-N	0	3	338.883	3.230	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cnc2ccsc2c1	ZINC001085761988	1358740085	/nfs/dbraw/zinc/74/00/85/1358740085.db2.gz	YKZMDMRWCCEEJH-HNNXBMFYSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=C1CCC(C(=O)N(C)C[C@@H]2CCN2C[C@H](OC)C2CCCC2)CC1	ZINC001085801158	1358776125	/nfs/dbraw/zinc/77/61/25/1358776125.db2.gz	LDLIQVSPTIKFQP-PMACEKPBSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C1CCC(C(=O)N(C)C[C@@H]2CCN2CCC[C@H]2CCOC2)CC1	ZINC001085801484	1358777083	/nfs/dbraw/zinc/77/70/83/1358777083.db2.gz	UIOAVNOLPQYJHC-HKUYNNGSSA-N	0	3	334.504	3.082	20	30		EGEDHN
C#Cc1cncc(C(=O)N(C)C[C@@H]2CCN2[C@H](CC)c2ccccc2)c1	ZINC001085809590	1358787877	/nfs/dbraw/zinc/78/78/77/1358787877.db2.gz	IVCCOUDNYUYHDI-LEWJYISDSA-N	0	3	347.462	3.361	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cnc(C)nc1C(C)C	ZINC001085855262	1358822819	/nfs/dbraw/zinc/82/28/19/1358822819.db2.gz	UDNMKTHAVNRLGD-INIZCTEOSA-N	0	3	330.476	3.021	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C[C@H]2CCN2CCC2=CCCCC2)nc1	ZINC001085933699	1358887835	/nfs/dbraw/zinc/88/78/35/1358887835.db2.gz	IHRKKGORURBMKG-LJQANCHMSA-N	0	3	337.467	3.100	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@@H]1Cc2ccc(Cl)cc21	ZINC001085951349	1358907105	/nfs/dbraw/zinc/90/71/05/1358907105.db2.gz	DLXJEAXXSXRBSJ-FUHWJXTLSA-N	0	3	332.875	3.479	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@@H]1Cc2cc(C)c(C)cc2O1	ZINC001085982916	1358935070	/nfs/dbraw/zinc/93/50/70/1358935070.db2.gz	UTROEGJLSQISIF-ICSRJNTNSA-N	0	3	342.483	3.106	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(F)c(Cl)c2)C1	ZINC001086183591	1359019590	/nfs/dbraw/zinc/01/95/90/1359019590.db2.gz	JQZYBQMRKGOZSU-KLPPZKSPSA-N	0	3	331.218	3.330	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc3nc(C)sc3c2)C1	ZINC001086245629	1359040923	/nfs/dbraw/zinc/04/09/23/1359040923.db2.gz	RBMBZYNRPJMCPW-XBXGTLAGSA-N	0	3	349.887	3.455	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(N(C)C(C)C)cc2)C1	ZINC001086284079	1359055316	/nfs/dbraw/zinc/05/53/16/1359055316.db2.gz	RCTVSVQSVZUXIO-WOVMCDHWSA-N	0	3	349.906	3.382	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cccc([C@H]3CCOC3)c2)C1	ZINC001086410699	1359090263	/nfs/dbraw/zinc/09/02/63/1359090263.db2.gz	GCHZQFPSSKMCHY-WBAXXEDZSA-N	0	3	348.874	3.041	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cccc3ncccc32)C1	ZINC001086442925	1359098120	/nfs/dbraw/zinc/09/81/20/1359098120.db2.gz	VJCVTJRZUOLLJE-HDJSIYSDSA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)[C@H]2CCCC[C@H]2C)C1	ZINC001086462965	1359106457	/nfs/dbraw/zinc/10/64/57/1359106457.db2.gz	WECFHFYUOAPDIL-NGFQHRJXSA-N	0	3	343.309	3.206	20	30		EGEDHN
C[C@@H]1CC[C@@H](C(=O)NC[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)C1	ZINC001086496095	1359119988	/nfs/dbraw/zinc/11/99/88/1359119988.db2.gz	NAYYXABQHCGBCF-GFOCRRMGSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(OC)c(C3CC3)c2)C1	ZINC001086521223	1359129887	/nfs/dbraw/zinc/12/98/87/1359129887.db2.gz	QWNJNHYVRGRJMH-SAZUREKKSA-N	0	3	348.874	3.423	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)[C@H]2C[C@@]2(C)C(C)C)C1	ZINC001086522394	1359130561	/nfs/dbraw/zinc/13/05/61/1359130561.db2.gz	UFHGYAJFNZMZEP-KQTLUZQSSA-N	0	3	343.309	3.062	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cnn([C@@H](C)CC)c2C)C1	ZINC001086530211	1359133806	/nfs/dbraw/zinc/13/38/06/1359133806.db2.gz	MIZUSOMJFLTBEJ-QEJZJMRPSA-N	0	3	338.883	3.013	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc3c(C)cccn3c2)C1	ZINC001086532816	1359134322	/nfs/dbraw/zinc/13/43/22/1359134322.db2.gz	KTTBCPYWNHCOIA-KOMQPUFPSA-N	0	3	331.847	3.098	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)[C@@H]2CCC(F)(F)C2)C1	ZINC001086591729	1359157833	/nfs/dbraw/zinc/15/78/33/1359157833.db2.gz	CFNIUOKYJOGQEW-FGTMMUONSA-N	0	3	346.421	3.029	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccc3nc(C)oc3c2)C1	ZINC001086722948	1359191436	/nfs/dbraw/zinc/19/14/36/1359191436.db2.gz	IIUIHWVGZDIFFK-DZGCQCFKSA-N	0	3	347.846	3.377	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccc(OC)cc2F)C1	ZINC001086747152	1359194225	/nfs/dbraw/zinc/19/42/25/1359194225.db2.gz	JZODHTXRCWZJNF-QWHCGFSZSA-N	0	3	340.826	3.075	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cccc3cccnc32)C1	ZINC001086748903	1359194602	/nfs/dbraw/zinc/19/46/02/1359194602.db2.gz	YXOZOLHQMYFPKI-GOEBONIOSA-N	0	3	343.858	3.475	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccn3ccccc23)C1	ZINC001086755059	1359195445	/nfs/dbraw/zinc/19/54/45/1359195445.db2.gz	ZKVKOOTYQQTRGG-LSDHHAIUSA-N	0	3	331.847	3.180	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2coc(C(F)F)c2)C1	ZINC001086786643	1359201318	/nfs/dbraw/zinc/20/13/18/1359201318.db2.gz	KYKZXYKJWMETQF-CMPLNLGQSA-N	0	3	332.778	3.458	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cc3nc(C)ccc3o2)C1	ZINC001086859644	1359215286	/nfs/dbraw/zinc/21/52/86/1359215286.db2.gz	LYVYIHTWEQQNCY-UONOGXRCSA-N	0	3	347.846	3.377	20	30		EGEDHN
C[C@H]1CC2(CN1C(=O)C(F)F)CCN(Cc1cccc(C#N)c1)CC2	ZINC001086895714	1359225176	/nfs/dbraw/zinc/22/51/76/1359225176.db2.gz	RZTPGWZEFKYYSD-AWEZNQCLSA-N	0	3	347.409	3.026	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3cccc(F)c3)C2)CC1	ZINC001086899248	1359228973	/nfs/dbraw/zinc/22/89/73/1359228973.db2.gz	FGBNEXRXTJSQAI-INIZCTEOSA-N	0	3	328.431	3.166	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3cscc3C)C2)CC1	ZINC001086914782	1359242616	/nfs/dbraw/zinc/24/26/16/1359242616.db2.gz	SRLQXODBRDEZEL-MRXNPFEDSA-N	0	3	330.497	3.396	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3cc(C)c(C)o3)C2)CC1	ZINC001086917073	1359245270	/nfs/dbraw/zinc/24/52/70/1359245270.db2.gz	YYUWFXUMADJXNF-INIZCTEOSA-N	0	3	328.456	3.236	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H]3CCC(F)(F)C3)C2)CC1	ZINC001086926917	1359252027	/nfs/dbraw/zinc/25/20/27/1359252027.db2.gz	NPDOCGPTZFPCPW-JKSUJKDBSA-N	0	3	338.442	3.148	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)C[C@@H]3C=CCCC3)C2)CC1	ZINC001086929039	1359253650	/nfs/dbraw/zinc/25/36/50/1359253650.db2.gz	VDLPLKCZJHQZPQ-RBUKOAKNSA-N	0	3	328.500	3.459	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H]3C[C@@H]4CCCC[C@H]34)C2)CC1	ZINC001086934434	1359257828	/nfs/dbraw/zinc/25/78/28/1359257828.db2.gz	PJMGTSRSXREEIB-CADBVGFASA-N	0	3	328.500	3.149	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)C3CC4(CCC4)C3)C2)CC1	ZINC001086938447	1359261070	/nfs/dbraw/zinc/26/10/70/1359261070.db2.gz	QGVJXWCVRBAETA-QGZVFWFLSA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc(F)c(C)c3)C2)CC1	ZINC001086939254	1359261633	/nfs/dbraw/zinc/26/16/33/1359261633.db2.gz	LKUCUURAGZJNAR-MRXNPFEDSA-N	0	3	328.431	3.084	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc4ncccc4c3)C2)CC1	ZINC001086941013	1359262611	/nfs/dbraw/zinc/26/26/11/1359262611.db2.gz	HFSDSGZWUOAFKF-KRWDZBQOSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)C3CCC(F)(F)CC3)C2)CC1	ZINC001086944673	1359266031	/nfs/dbraw/zinc/26/60/31/1359266031.db2.gz	GEZDPTXWKWHVLL-HNNXBMFYSA-N	0	3	338.442	3.148	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cc([C@H](C)CC)no3)C2)CC1	ZINC001086947012	1359267946	/nfs/dbraw/zinc/26/79/46/1359267946.db2.gz	OCKIMFCPGDTJCA-CVEARBPZSA-N	0	3	343.471	3.138	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc(Cl)cc3)C2)CC1	ZINC001086953572	1359273652	/nfs/dbraw/zinc/27/36/52/1359273652.db2.gz	MBNIGFUZYAPWGV-HNNXBMFYSA-N	0	3	330.859	3.290	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc(F)ccc1F	ZINC001087289759	1359368657	/nfs/dbraw/zinc/36/86/57/1359368657.db2.gz	RQBLFEJFRIDIJL-FHLIZLRMSA-N	0	3	346.421	3.207	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)CC3CC(F)(F)C3)C(C)(C)[C@H]21	ZINC001087292970	1359373370	/nfs/dbraw/zinc/37/33/70/1359373370.db2.gz	VMETTWUUHDRHCQ-OIISXLGYSA-N	0	3	338.442	3.050	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cccc(C(C)C)n1	ZINC001087294989	1359375871	/nfs/dbraw/zinc/37/58/71/1359375871.db2.gz	BXSZFQVWFCGMEU-AYOQOUSVSA-N	0	3	339.483	3.057	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3occ4c3CCC4)C(C)(C)[C@H]21	ZINC001087297003	1359378440	/nfs/dbraw/zinc/37/84/40/1359378440.db2.gz	JMYUPMMJJCLVAM-QRQLOZEOSA-N	0	3	340.467	3.010	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc4[nH]ccc4c3)C(C)(C)[C@H]21	ZINC001087300093	1359382218	/nfs/dbraw/zinc/38/22/18/1359382218.db2.gz	GSJYRNRSRDJBRI-QRQLOZEOSA-N	0	3	335.451	3.020	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc4[nH]ccc4c3)C(C)(C)[C@@H]21	ZINC001087299939	1359382311	/nfs/dbraw/zinc/38/23/11/1359382311.db2.gz	DPAIYWXTTKUFHO-MISYRCLQSA-N	0	3	349.478	3.410	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccoc1C1CC1	ZINC001087300900	1359384018	/nfs/dbraw/zinc/38/40/18/1359384018.db2.gz	SHRGYZNFVOAEGQ-NZSAHSFTSA-N	0	3	340.467	3.399	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccoc1C1CC1	ZINC001087302150	1359385185	/nfs/dbraw/zinc/38/51/85/1359385185.db2.gz	OGWPSMZEEPWFJA-BPQIPLTHSA-N	0	3	326.440	3.009	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc2ccccn2c1	ZINC001087305418	1359390386	/nfs/dbraw/zinc/39/03/86/1359390386.db2.gz	SDEYLNAVMPALQK-HSALFYBXSA-N	0	3	349.478	3.181	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc4cc[nH]c4c3)C(C)(C)[C@H]21	ZINC001087307371	1359394394	/nfs/dbraw/zinc/39/43/94/1359394394.db2.gz	YTYJGBMCJFTYQP-QRQLOZEOSA-N	0	3	335.451	3.020	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc(CC(C)C)c[nH]1	ZINC001087314693	1359404143	/nfs/dbraw/zinc/40/41/43/1359404143.db2.gz	PHXUIPBSPHZASG-NZSAHSFTSA-N	0	3	341.499	3.065	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cccc(C(F)F)c3)C(C)(C)[C@H]21	ZINC001087315328	1359405307	/nfs/dbraw/zinc/40/53/07/1359405307.db2.gz	ZTCQXALNDMCJRN-IKGGRYGDSA-N	0	3	346.421	3.476	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)Cc3ccccc3Cl)C(C)(C)[C@H]21	ZINC001087315775	1359405749	/nfs/dbraw/zinc/40/57/49/1359405749.db2.gz	HWSKDDPVXSPKFV-LZQZEXGQSA-N	0	3	344.886	3.121	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc(Cl)cn1CC	ZINC001087319363	1359411158	/nfs/dbraw/zinc/41/11/58/1359411158.db2.gz	MMSPIIFOMGCONW-HYVNUMGLSA-N	0	3	347.890	3.013	20	30		EGEDHN
CCCC(=O)N1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1CC#Cc1ccccc1	ZINC001087329683	1359419430	/nfs/dbraw/zinc/41/94/30/1359419430.db2.gz	SKLUWBXFJPULRG-BURNTYAHSA-N	0	3	336.479	3.007	20	30		EGEDHN
C#CCCN1CC[C@@H](c2ccc(OCC)cc2)[C@@H](NC(=O)C(C)C)C1	ZINC001087470193	1359480544	/nfs/dbraw/zinc/48/05/44/1359480544.db2.gz	RPEDWGOCVAYJIP-PMACEKPBSA-N	0	3	342.483	3.039	20	30		EGEDHN
C=CCCN1CC[C@@H](c2ccc(OC)cc2)[C@@H](NC(=O)C(C)(C)F)C1	ZINC001087472838	1359482111	/nfs/dbraw/zinc/48/21/11/1359482111.db2.gz	ZZWYMIRHGRHFSV-ROUUACIJSA-N	0	3	348.462	3.294	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc3c(c2)C(C)(C)CO3)[C@H]1CC	ZINC001087653236	1359573471	/nfs/dbraw/zinc/57/34/71/1359573471.db2.gz	LKUWMBBLZWXKRO-DLBZAZTESA-N	0	3	328.456	3.125	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cccc(C)c2Cl)[C@H]1CC	ZINC001087655240	1359574129	/nfs/dbraw/zinc/57/41/29/1359574129.db2.gz	QFBLPHZTJALDLQ-DLBZAZTESA-N	0	3	332.875	3.183	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)[C@@]2(C)C=CCC2)CCN1Cc1ccc(C#N)cc1	ZINC001087690650	1359591693	/nfs/dbraw/zinc/59/16/93/1359591693.db2.gz	LNTXIZFOCMRCIT-ZVDOUQERSA-N	0	3	337.467	3.384	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccnc(OC3CCC3)c2)[C@H]1CC	ZINC001087777130	1359639176	/nfs/dbraw/zinc/63/91/76/1359639176.db2.gz	MGVMFNHEFKWJAQ-ZWKOTPCHSA-N	0	3	343.471	3.172	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)[C@H]2Cc3cc(C)c(C)cc3O2)[C@H]1CC	ZINC001087835507	1359671328	/nfs/dbraw/zinc/67/13/28/1359671328.db2.gz	CVPFNDQJMRCUBP-NLWGTHIKSA-N	0	3	342.483	3.152	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccc(OCC3CC3)nc2)[C@H]1CC	ZINC001087840600	1359673637	/nfs/dbraw/zinc/67/36/37/1359673637.db2.gz	FEQDRDWQPAFXCG-ZWKOTPCHSA-N	0	3	343.471	3.029	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccccc2OCC2CC2)[C@H]1CC	ZINC001087839732	1359674359	/nfs/dbraw/zinc/67/43/59/1359674359.db2.gz	RJJJULAGYOXXBW-ZWKOTPCHSA-N	0	3	328.456	3.244	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)[C@@H]2CCCCc3ccccc32)[C@H]1CC	ZINC001087843285	1359675779	/nfs/dbraw/zinc/67/57/79/1359675779.db2.gz	OOPIJOJWSFVJLS-QHAWAJNXSA-N	0	3	338.495	3.489	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CCN(Cc4cccc(C#N)c4)C[C@H]3C2)C1	ZINC001088097807	1359754995	/nfs/dbraw/zinc/75/49/95/1359754995.db2.gz	JZOMKWGZIOXLFV-UXHICEINSA-N	0	3	349.478	3.195	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3ccccc3C3(C)CC3)C[C@@H]2C1	ZINC001088103740	1359758127	/nfs/dbraw/zinc/75/81/27/1359758127.db2.gz	HIKGCKACWIEKBW-MSOLQXFVSA-N	0	3	336.479	3.155	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1C[C@H]2CCN(Cc3cccc(C#N)c3)C[C@H]2C1	ZINC001088127759	1359766194	/nfs/dbraw/zinc/76/61/94/1359766194.db2.gz	MGEYHYWRBUQOMJ-DBVUQKKJSA-N	0	3	339.483	3.131	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3cccc4ccccc43)C[C@@H]2C1	ZINC001088189695	1359787827	/nfs/dbraw/zinc/78/78/27/1359787827.db2.gz	PCMXYXCECCMGLL-MOPGFXCFSA-N	0	3	332.447	3.257	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2ccc3c(c2)COC3)C1	ZINC001088397310	1359872488	/nfs/dbraw/zinc/87/24/88/1359872488.db2.gz	FLXJKNZMYMCWEA-SFHVURJKSA-N	0	3	348.874	3.444	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2sc(C)nc2C)C1	ZINC001088421903	1359891592	/nfs/dbraw/zinc/89/15/92/1359891592.db2.gz	CPGHVSJNDWXYBW-AWEZNQCLSA-N	0	3	341.908	3.487	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)CCc2cscn2)C1	ZINC001088433075	1359901744	/nfs/dbraw/zinc/90/17/44/1359901744.db2.gz	LTZLVMYJZTYZLB-AWEZNQCLSA-N	0	3	341.908	3.189	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](CNC/C(Cl)=C\Cl)[C@@H](C)C1	ZINC001184311593	1387426931	/nfs/dbraw/zinc/42/69/31/1387426931.db2.gz	KDJWRDZDDQAHIQ-WIGWJDOSSA-N	0	3	331.287	3.183	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)C2CCc3ccccc3CC2)[C@H]1C	ZINC001088688526	1360013579	/nfs/dbraw/zinc/01/35/79/1360013579.db2.gz	PCKVUSUIHASQCO-UZLBHIALSA-N	0	3	326.484	3.337	20	30		EGEDHN
C=CCCN1CC[C@H](NC(=O)c2oc3ccccc3c2OC)[C@H]1C	ZINC001088792337	1360045958	/nfs/dbraw/zinc/04/59/58/1360045958.db2.gz	HZPBBQOYMWUNLN-HIFRSBDPSA-N	0	3	328.412	3.210	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2ccc(-c3cccs3)o2)[C@H]1C	ZINC001089015173	1360135888	/nfs/dbraw/zinc/13/58/88/1360135888.db2.gz	HFESELROKKKMKO-KGLIPLIRSA-N	0	3	328.437	3.224	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cc(F)c(F)cc2Cl)[C@H]1C	ZINC001089018751	1360138725	/nfs/dbraw/zinc/13/87/25/1360138725.db2.gz	ZQYGEDKCRWWJAX-BMIGLBTASA-N	0	3	328.790	3.387	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCCN1C(=O)C1CCC1	ZINC001089097975	1360166750	/nfs/dbraw/zinc/16/67/50/1360166750.db2.gz	VWFCZVGSJLJGRH-IBGZPJMESA-N	0	3	325.456	3.171	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCCN1C(=O)[C@@H]1CC1(C)C	ZINC001089160667	1360216577	/nfs/dbraw/zinc/21/65/77/1360216577.db2.gz	LIDQTTLTECYWAX-OALUTQOASA-N	0	3	339.483	3.417	20	30		EGEDHN
CN(Cc1ccc(CF)cc1)C[C@@H]1CCCCN1C(=O)C#CC1CC1	ZINC001089174401	1360228102	/nfs/dbraw/zinc/22/81/02/1360228102.db2.gz	ALIHEMODJMCSNU-FQEVSTJZSA-N	0	3	342.458	3.382	20	30		EGEDHN
Cc1nc(CNC[C@@H]2CCN(C(=O)C#CC(C)(C)C)C[C@H]2C)cs1	ZINC001184371398	1387442639	/nfs/dbraw/zinc/44/26/39/1387442639.db2.gz	LZYCISUUQUUQAU-ZBFHGGJFSA-N	0	3	347.528	3.075	20	30		EGEDHN
CC1(C)C[C@@H](NC(=O)C2CCC2)CCN(CC#Cc2ccccc2)C1	ZINC001089293446	1360310842	/nfs/dbraw/zinc/31/08/42/1360310842.db2.gz	PNQBOJGXJQOZDQ-FQEVSTJZSA-N	0	3	338.495	3.445	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2nsc3ccccc32)CC(C)(C)C1	ZINC001089395882	1360395251	/nfs/dbraw/zinc/39/52/51/1360395251.db2.gz	BHDBGYPGXKBNHB-CQSZACIVSA-N	0	3	341.480	3.150	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cccc3c2CCCC3)CC(C)(C)C1	ZINC001089397208	1360396903	/nfs/dbraw/zinc/39/69/03/1360396903.db2.gz	LSOZJJRMDWCJDD-SFHVURJKSA-N	0	3	338.495	3.419	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2conc2C(C)C)CC(C)(C)C1	ZINC001089406313	1360405001	/nfs/dbraw/zinc/40/50/01/1360405001.db2.gz	KWENTCPAUHWAOR-HNNXBMFYSA-N	0	3	331.460	3.042	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cccc3ccc(C)nc32)CC(C)(C)C1	ZINC001089417173	1360410883	/nfs/dbraw/zinc/41/08/83/1360410883.db2.gz	VWZGLSLQFXERLC-SFHVURJKSA-N	0	3	349.478	3.397	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cccc3cccnc32)CC(C)(C)C1	ZINC001089432318	1360423670	/nfs/dbraw/zinc/42/36/70/1360423670.db2.gz	ABYNGIAPRPMKIB-QGZVFWFLSA-N	0	3	335.451	3.088	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2cc3ccccc3o2)CC(C)(C)C1	ZINC001089448206	1360437222	/nfs/dbraw/zinc/43/72/22/1360437222.db2.gz	BHVHWAMPEWMNPW-QGZVFWFLSA-N	0	3	338.451	3.215	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(OC)cs2)CC(C)(C)C1	ZINC001089457258	1360444137	/nfs/dbraw/zinc/44/41/37/1360444137.db2.gz	TWFSGPUFJOMILT-CQSZACIVSA-N	0	3	334.485	3.000	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cncc3sccc32)CC(C)(C)C1	ZINC001089471099	1360454556	/nfs/dbraw/zinc/45/45/56/1360454556.db2.gz	QFQSCMUIKAURKY-AWEZNQCLSA-N	0	3	341.480	3.150	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2nc(Cl)cs2)CC(C)(C)C1	ZINC001089477078	1360459623	/nfs/dbraw/zinc/45/96/23/1360459623.db2.gz	LAVFXLCRSLPSPP-LBPRGKRZSA-N	0	3	339.892	3.040	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(Cl)c(F)c2)CC(C)(C)C1	ZINC001089500756	1360475219	/nfs/dbraw/zinc/47/52/19/1360475219.db2.gz	VUEYRCKVCKWAQY-AWEZNQCLSA-N	0	3	336.838	3.333	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(C)c(OCC)c2)CC(C)(C)C1	ZINC001089504014	1360477486	/nfs/dbraw/zinc/47/74/86/1360477486.db2.gz	XEPSIOCRQPUHJV-GOSISDBHSA-N	0	3	342.483	3.247	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(OCC)c(C)c2)CC(C)(C)C1	ZINC001089510557	1360482336	/nfs/dbraw/zinc/48/23/36/1360482336.db2.gz	XHLOOTSMKUFKPL-SFHVURJKSA-N	0	3	342.483	3.247	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@@H](C)c2ccc(F)c(F)c2)CC(C)(C)C1	ZINC001089561298	1360509333	/nfs/dbraw/zinc/50/93/33/1360509333.db2.gz	ONIHSMWLDXLANL-HOCLYGCPSA-N	0	3	348.437	3.308	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc2occc2[nH]1	ZINC001089649119	1360561333	/nfs/dbraw/zinc/56/13/33/1360561333.db2.gz	BDQHPGVCYKLLAS-CQSZACIVSA-N	0	3	327.428	3.005	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cncc2[nH]ccc21	ZINC001089665079	1360575089	/nfs/dbraw/zinc/57/50/89/1360575089.db2.gz	SVFMHSWJNFJTBL-HNNXBMFYSA-N	0	3	340.471	3.359	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccn2ccccc12	ZINC001089670165	1360579840	/nfs/dbraw/zinc/57/98/40/1360579840.db2.gz	ZWOPUOOQMOOUAV-INIZCTEOSA-N	0	3	325.456	3.346	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc2nonc2c1	ZINC001089687435	1360593375	/nfs/dbraw/zinc/59/33/75/1360593375.db2.gz	JTFKOYMPACWQOL-HNNXBMFYSA-N	0	3	342.443	3.019	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(C)nc(OC)c1	ZINC001089688625	1360595009	/nfs/dbraw/zinc/59/50/09/1360595009.db2.gz	XEAIYRYDMASLKI-QGZVFWFLSA-N	0	3	345.487	3.195	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc2n[nH]cc2c1	ZINC001089688707	1360595048	/nfs/dbraw/zinc/59/50/48/1360595048.db2.gz	YIPKUGUBRBBHRW-KRWDZBQOSA-N	0	3	340.471	3.359	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cnn(CC(C)C)c1	ZINC001089716741	1360618250	/nfs/dbraw/zinc/61/82/50/1360618250.db2.gz	QCCWQIFGMGUAJV-SFHVURJKSA-N	0	3	346.519	3.336	20	30		EGEDHN
C=C(C)CC[N@@H+]1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1ccccc1[O-]	ZINC001089776659	1360659566	/nfs/dbraw/zinc/65/95/66/1360659566.db2.gz	GMSXJQMTUPQIDW-KANFNMMFSA-N	0	3	340.467	3.141	20	30		EGEDHN
C=C(C)CC[N@H+]1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1ccccc1[O-]	ZINC001089776659	1360659568	/nfs/dbraw/zinc/65/95/68/1360659568.db2.gz	GMSXJQMTUPQIDW-KANFNMMFSA-N	0	3	340.467	3.141	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1CC2(CCC2)C1	ZINC001089849597	1360696532	/nfs/dbraw/zinc/69/65/32/1360696532.db2.gz	HENHKMSJTYLALQ-OWLYRPNTSA-N	0	3	348.918	3.488	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](CNCc2oc(CC)nc2C)[C@H](C)C1	ZINC001184497795	1387473194	/nfs/dbraw/zinc/47/31/94/1387473194.db2.gz	NBPZIKWNAAJSLI-NVXWUHKLSA-N	0	3	347.503	3.476	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)c2ccc(C)c(C)c2)CC2(CCOCC2)C1	ZINC001089969243	1360772392	/nfs/dbraw/zinc/77/23/92/1360772392.db2.gz	RJROLRFETFVFRE-LJQANCHMSA-N	0	3	342.483	3.090	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](CNCc2oc(C)nc2C)[C@@H](C)C1	ZINC001184499381	1387475077	/nfs/dbraw/zinc/47/50/77/1387475077.db2.gz	ZERSEEVJGIYMIL-WMLDXEAASA-N	0	3	333.476	3.222	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](CNCc2csc(C)n2)[C@H](C)C1	ZINC001184512415	1387480055	/nfs/dbraw/zinc/48/00/55/1387480055.db2.gz	LQLYDEJXYPIACB-ZBFHGGJFSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C(C)CN1CC[C@@H](NC(=O)c2ccccc2C(C)(C)CC)[C@H](O)C1	ZINC001090348500	1360894423	/nfs/dbraw/zinc/89/44/23/1360894423.db2.gz	YGARPARHDZCUOS-RTBURBONSA-N	0	3	344.499	3.115	20	30		EGEDHN
N#Cc1ccc(F)c(CNC2CC(CNC(=O)[C@@H]3CC=CCC3)C2)c1	ZINC001090922656	1360954366	/nfs/dbraw/zinc/95/43/66/1360954366.db2.gz	QGYBFQNUUKHJJV-UPTPFMHGSA-N	0	3	341.430	3.038	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H]2C[C@H]2c2sccc2C)C1	ZINC001091026601	1360982199	/nfs/dbraw/zinc/98/21/99/1360982199.db2.gz	RJKJAXDVPPESBB-NEXFUWMNSA-N	0	3	338.904	3.397	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2c(C)[nH]c3ccccc32)C1	ZINC001091132742	1360995898	/nfs/dbraw/zinc/99/58/98/1360995898.db2.gz	IBJDKZOLLFUILJ-UHFFFAOYSA-N	0	3	331.847	3.327	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cccc(C)c2Cl)C1	ZINC001091288171	1361032424	/nfs/dbraw/zinc/03/24/24/1361032424.db2.gz	HDTWJDLKQXZIOX-UHFFFAOYSA-N	0	3	327.255	3.499	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc3ccccc3n2)C1	ZINC001091339199	1361051252	/nfs/dbraw/zinc/05/12/52/1361051252.db2.gz	BDABVOCKPIRDKM-UHFFFAOYSA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2csc3c2CCCC3)C1	ZINC001091356239	1361058710	/nfs/dbraw/zinc/05/87/10/1361058710.db2.gz	OSJGTXHCCKQDFT-UHFFFAOYSA-N	0	3	338.904	3.477	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(OC3CCC3)cc2)C1	ZINC001091373971	1361067301	/nfs/dbraw/zinc/06/73/01/1361067301.db2.gz	NGSGGRRHBMOJLK-UHFFFAOYSA-N	0	3	348.874	3.468	20	30		EGEDHN
C[C@@]12CN(Cc3cccc(C#N)c3)C[C@@H]1CN(C(=O)CC1CCC1)C2	ZINC001091565892	1361146880	/nfs/dbraw/zinc/14/68/80/1361146880.db2.gz	FTKPJFHWQRJYJG-CTNGQTDRSA-N	0	3	337.467	3.029	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3coc4cc(C)c(C)cc43)C[C@]2(C)C1	ZINC001091883321	1361240119	/nfs/dbraw/zinc/24/01/19/1361240119.db2.gz	FWVXKLTWZLRWPR-IERDGZPVSA-N	0	3	336.435	3.077	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc4c(ccc(C)c4C)[nH]3)C[C@]2(C)C1	ZINC001091911081	1361244131	/nfs/dbraw/zinc/24/41/31/1361244131.db2.gz	OPYUFAOJQLZRRS-VGSWGCGISA-N	0	3	349.478	3.202	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3[nH]ccc3-c3ccccc3)C[C@]2(C)C1	ZINC001092192595	1361319243	/nfs/dbraw/zinc/31/92/43/1361319243.db2.gz	QMYGHUQXYDNLNV-GCJKJVERSA-N	0	3	347.462	3.099	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3ccc(Cl)c4occc43)C[C@]2(C)C1	ZINC001092192921	1361319362	/nfs/dbraw/zinc/31/93/62/1361319362.db2.gz	ZLJFWYZAZYAMQJ-YJYMSZOUSA-N	0	3	342.826	3.113	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)CC(C)(C)c3ccc(C)cc3)C[C@]2(C)C1	ZINC001092261399	1361347638	/nfs/dbraw/zinc/34/76/38/1361347638.db2.gz	WPJIPAZNRPMKPM-KNQAVFIVSA-N	0	3	338.495	3.076	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)c2oc(C)cc2C)CC1	ZINC001093363978	1361574966	/nfs/dbraw/zinc/57/49/66/1361574966.db2.gz	LMHPEMIUIIVMIE-LJQANCHMSA-N	0	3	340.467	3.236	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3c(C)csc3Cl)CCC[C@@H]12	ZINC001094567039	1361864155	/nfs/dbraw/zinc/86/41/55/1361864155.db2.gz	FEFPQABSHSWMKA-CXAGYDPISA-N	0	3	336.888	3.318	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3sccc3C(F)F)CCC[C@@H]12	ZINC001094571831	1361865832	/nfs/dbraw/zinc/86/58/32/1361865832.db2.gz	IPDNXTNMJFZUEF-CXAGYDPISA-N	0	3	338.423	3.293	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3ccc(F)c4occc43)CCC[C@@H]12	ZINC001094582774	1361870221	/nfs/dbraw/zinc/87/02/21/1361870221.db2.gz	WVCZXGGSNUVPPR-YLJYHZDGSA-N	0	3	340.398	3.180	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1C[C@H]2C[C@@H](C1)N(C(=O)c1ccccc1)C2	ZINC001094847471	1361924559	/nfs/dbraw/zinc/92/45/59/1361924559.db2.gz	DWRIGXLZLBBWMT-NDXORKPFSA-N	0	3	345.446	3.341	20	30		EGEDHN
CCN(CC)CC(=O)NCCCCCCNc1cccc(F)c1C#N	ZINC001094958141	1361962132	/nfs/dbraw/zinc/96/21/32/1361962132.db2.gz	DFLGOJOFQFXBMQ-UHFFFAOYSA-N	0	3	348.466	3.128	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3[C@H](C)c2ccccc2)c1	ZINC001095988682	1362324739	/nfs/dbraw/zinc/32/47/39/1362324739.db2.gz	NEZMIQIBGMQKMO-IDCXYZFESA-N	0	3	345.446	3.159	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C1(c3cccc(F)c3)CC1)C2	ZINC001096100132	1362381951	/nfs/dbraw/zinc/38/19/51/1362381951.db2.gz	SSUCVEQQHSJEPS-SQNIBIBYSA-N	0	3	328.431	3.155	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccc(C)s1)C2	ZINC001096133320	1362399646	/nfs/dbraw/zinc/39/96/46/1362399646.db2.gz	FLBHHSKFQXCMGD-MTSZKFMLSA-N	0	3	330.497	3.458	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc(C(F)(F)F)ccn1)C2	ZINC001096280420	1362453459	/nfs/dbraw/zinc/45/34/59/1362453459.db2.gz	DYZMQRLHQSKHSY-IPYPFGDCSA-N	0	3	339.361	3.012	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cccc(Cl)c1Cl)C2	ZINC001096416111	1362499762	/nfs/dbraw/zinc/49/97/62/1362499762.db2.gz	WJDBDABMLQUHFG-UGFHNGPFSA-N	0	3	337.250	3.352	20	30		EGEDHN
C[C@H](C(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1)C1CC1	ZINC001324308709	1387589368	/nfs/dbraw/zinc/58/93/68/1387589368.db2.gz	QOLHDFCSKBTWBM-HNNXBMFYSA-N	0	3	325.456	3.075	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C1(c3cccc(Cl)c3)CC1)C2	ZINC001097177067	1362874912	/nfs/dbraw/zinc/87/49/12/1362874912.db2.gz	HPRLNVTVEKOJJZ-KURKYZTESA-N	0	3	342.870	3.116	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C1([C@@H]3CCCCO3)CCC1)C2	ZINC001097521648	1363037561	/nfs/dbraw/zinc/03/75/61/1363037561.db2.gz	ASCNAJVLSBGYKF-BDXSIMOUSA-N	0	3	332.488	3.023	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1cc(F)c(C)cc1F)C2	ZINC001097575642	1363058943	/nfs/dbraw/zinc/05/89/43/1363058943.db2.gz	LHAWWVFQAUKEQB-OLMNPRSZSA-N	0	3	334.410	3.113	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1cccc3sccc31)C2	ZINC001097977193	1363186680	/nfs/dbraw/zinc/18/66/80/1363186680.db2.gz	GMEXEBKBICIYKB-NXHRZFHOSA-N	0	3	338.476	3.189	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1scnc1C1CC1)C2	ZINC001097999701	1363193467	/nfs/dbraw/zinc/19/34/67/1363193467.db2.gz	JUMJCNBRSYHMCU-KFWWJZLASA-N	0	3	331.485	3.322	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1F)C2	ZINC001098005062	1363194831	/nfs/dbraw/zinc/19/48/31/1363194831.db2.gz	HTZYHXJTSOCFCW-OYMYKWPDSA-N	0	3	328.431	3.227	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1[nH]c3ccc(C)cc3c1C)C2	ZINC001098132840	1363230230	/nfs/dbraw/zinc/23/02/30/1363230230.db2.gz	BUKBICBKXMQFGU-LZQZEXGQSA-N	0	3	335.451	3.143	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1csc(C(F)(F)F)n1)C2	ZINC001098162329	1363240258	/nfs/dbraw/zinc/24/02/58/1363240258.db2.gz	YJMXAWJLXNMRFA-FOGDFJRCSA-N	0	3	345.390	3.073	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@H](CNCc3cnc(C)o3)[C@H](C)C2)CC1	ZINC001185096094	1387618302	/nfs/dbraw/zinc/61/83/02/1387618302.db2.gz	YGSQUEASPLWYGU-NVXWUHKLSA-N	0	3	345.487	3.304	20	30		EGEDHN
CCCCCCCNCc1cn([C@H]2CCN(C(=O)CC(C)C)C2)nn1	ZINC001098601408	1363394228	/nfs/dbraw/zinc/39/42/28/1363394228.db2.gz	PKWVLFMYOGKERP-SFHVURJKSA-N	0	3	349.523	3.158	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1cc(C)ccc1F)C[C@H](C)O2	ZINC001098642400	1363413364	/nfs/dbraw/zinc/41/33/64/1363413364.db2.gz	BOKPNVAIXOYNDC-INIZCTEOSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H]1CCCCC1(C)C)C[C@@H](C)O2	ZINC001098664035	1363425422	/nfs/dbraw/zinc/42/54/22/1363425422.db2.gz	MNGRPWAIMANOQB-MSOLQXFVSA-N	0	3	348.531	3.471	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3CCC[C@]3(NC(=O)CC3CCC3)C2)cc1	ZINC001098771059	1363462265	/nfs/dbraw/zinc/46/22/65/1363462265.db2.gz	LNDURFKYUDULHW-FPOVZHCZSA-N	0	3	337.467	3.219	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H]2CC[C@H](c3ccccc3)O2)C1	ZINC001098841802	1363489035	/nfs/dbraw/zinc/48/90/35/1363489035.db2.gz	KIMJDMUVFSDIRQ-JTJHWIPRSA-N	0	3	340.467	3.063	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@H]1[C@@H]2CCCC[C@@H]21	ZINC001099001856	1363565561	/nfs/dbraw/zinc/56/55/61/1363565561.db2.gz	XJLABPGBOJGJAU-INDMIFKZSA-N	0	3	348.531	3.232	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc[nH]c1CC	ZINC001099042723	1363589674	/nfs/dbraw/zinc/58/96/74/1363589674.db2.gz	AIJXIJYYHJCTOW-MRXNPFEDSA-N	0	3	347.503	3.000	20	30		EGEDHN
CC(C)(C)C#CC(=O)NC[C@H]1CCC(C)(C)CN1CCOC1CCC1	ZINC001099070314	1363606879	/nfs/dbraw/zinc/60/68/79/1363606879.db2.gz	VQGMZUGJSNQWTJ-QGZVFWFLSA-N	0	3	348.531	3.212	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)C(C)(C)[C@@H]1CCCCO1	ZINC001099080495	1363611655	/nfs/dbraw/zinc/61/16/55/1363611655.db2.gz	QPCSKLLSZDDZCG-ROUUACIJSA-N	0	3	348.531	3.212	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)c2[nH]c3ccc(C)cc3c2C)C1	ZINC001099102190	1363623548	/nfs/dbraw/zinc/62/35/48/1363623548.db2.gz	NXZNSQPGKZLNQL-JTSKRJEESA-N	0	3	349.478	3.392	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)Cc1c(F)cccc1F	ZINC001099200241	1363689288	/nfs/dbraw/zinc/68/92/88/1363689288.db2.gz	XLUNUOMWNCDSQA-CQSZACIVSA-N	0	3	336.426	3.300	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2sccc2C)C[C@H]1C(F)(F)F	ZINC001099203365	1363690935	/nfs/dbraw/zinc/69/09/35/1363690935.db2.gz	JDBGMBASPAIZQD-VXGBXAGGSA-N	0	3	332.391	3.225	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2ccoc2Cl)C[C@H]1C(F)(F)F	ZINC001099243109	1363710783	/nfs/dbraw/zinc/71/07/83/1363710783.db2.gz	ITFDWWDTVFHFDD-GHMZBOCLSA-N	0	3	336.741	3.102	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H](C)Cc1c(C)noc1C	ZINC001099258648	1363719439	/nfs/dbraw/zinc/71/94/39/1363719439.db2.gz	SHSSHWRVHMDYOU-WMLDXEAASA-N	0	3	347.503	3.263	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2scnc2C(C)C)C[C@H]1C(F)(F)F	ZINC001099318048	1363747001	/nfs/dbraw/zinc/74/70/01/1363747001.db2.gz	CYFLLBVIZTXTOP-GHMZBOCLSA-N	0	3	347.406	3.045	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@H](C)c2ccc(C)s2)C[C@H]1C(F)(F)F	ZINC001099332715	1363754904	/nfs/dbraw/zinc/75/49/04/1363754904.db2.gz	JCQPPFUGILFWGN-JHJVBQTASA-N	0	3	346.418	3.325	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@H](C)c2ccccc2)C[C@H]1C(F)(F)F	ZINC001099334633	1363756112	/nfs/dbraw/zinc/75/61/12/1363756112.db2.gz	WZYDPWUFSXAZSO-FVQBIDKESA-N	0	3	340.389	3.345	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2cccc(Cl)c2)C[C@H]1C(F)(F)F	ZINC001099336312	1363757768	/nfs/dbraw/zinc/75/77/68/1363757768.db2.gz	FRIOKNQBMGSXHE-CHWSQXEVSA-N	0	3	332.753	3.119	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2cccn2C(C)C)C[C@H]1C(F)(F)F	ZINC001099342891	1363761336	/nfs/dbraw/zinc/76/13/36/1363761336.db2.gz	YKZZOHAXZCCSER-ZIAGYGMSSA-N	0	3	343.393	3.238	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@@H]2CCCCC2(C)C)C[C@H]1C(F)(F)F	ZINC001099347349	1363764146	/nfs/dbraw/zinc/76/41/46/1363764146.db2.gz	FCYOQUYPBIOLGY-BFHYXJOUSA-N	0	3	332.410	3.368	20	30		EGEDHN
C=C[C@@H](C(=O)NC[C@H]1CCC(C)(C)CN1CCOC)c1ccccc1	ZINC001099348735	1363765319	/nfs/dbraw/zinc/76/53/19/1363765319.db2.gz	LKVYLAFGNFFQPX-RTBURBONSA-N	0	3	344.499	3.209	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H](C)OCCC(C)C	ZINC001099360670	1363773291	/nfs/dbraw/zinc/77/32/91/1363773291.db2.gz	ZSWJDMKAHOUCIB-ZWKOTPCHSA-N	0	3	336.520	3.068	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)[C@H](C)CCCC)CC2(CCOCC2)C1	ZINC001099579328	1363862063	/nfs/dbraw/zinc/86/20/63/1363862063.db2.gz	OZTRPCYXURWIBM-QZTJIDSGSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)[C@H](CCC)C(C)C)CC2(CCOCC2)C1	ZINC001099593424	1363875980	/nfs/dbraw/zinc/87/59/80/1363875980.db2.gz	YLGIAGMCTHXHNC-ZWKOTPCHSA-N	0	3	336.520	3.232	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCC1CC(NCc2cc(Cl)ccc2Cl)C1	ZINC001100196554	1364042200	/nfs/dbraw/zinc/04/22/00/1364042200.db2.gz	MYYSXPAPGBVDLY-IFQILLTASA-N	0	3	340.254	3.137	20	30		EGEDHN
C[C@H](C(=O)NCC1CC(NCC#Cc2cccc(Cl)c2)C1)C1CC1	ZINC001100225817	1364050203	/nfs/dbraw/zinc/05/02/03/1364050203.db2.gz	UECPMTAYACJNSL-ASFAAARLSA-N	0	3	344.886	3.222	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](CNCc2nccn2CC)[C@H](C)C1	ZINC001185227183	1387656807	/nfs/dbraw/zinc/65/68/07/1387656807.db2.gz	VDQPSENVQXHVQG-SJORKVTESA-N	0	3	346.519	3.080	20	30		EGEDHN
Cc1sccc1C(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100304715	1364073430	/nfs/dbraw/zinc/07/34/30/1364073430.db2.gz	JBPYSMLKCXLREV-UHFFFAOYSA-N	0	3	338.476	3.206	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCC1CC(NCc2ccncc2Cl)C1	ZINC001100358409	1364090247	/nfs/dbraw/zinc/09/02/47/1364090247.db2.gz	PVSABWJTJSWJGE-UHFFFAOYSA-N	0	3	347.890	3.488	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCC1CC(N[C@H](C)c2cnc(C)cn2)C1	ZINC001100359970	1364091119	/nfs/dbraw/zinc/09/11/19/1364091119.db2.gz	SXBRYXDJOJWPJK-KLHKWILBSA-N	0	3	342.487	3.099	20	30		EGEDHN
C#CCCCCCC(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100570323	1364167708	/nfs/dbraw/zinc/16/77/08/1364167708.db2.gz	NNEMTVGQJGWPRV-UHFFFAOYSA-N	0	3	336.479	3.106	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCC1CC(NCc2oc(CC)nc2C)C1	ZINC001100595011	1364180609	/nfs/dbraw/zinc/18/06/09/1364180609.db2.gz	JYDHPVUQHPIVFF-IUDNXUCKSA-N	0	3	333.476	3.132	20	30		EGEDHN
CCc1ccccc1C(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100618446	1364191975	/nfs/dbraw/zinc/19/19/75/1364191975.db2.gz	JFVWCZKIURHYOJ-UHFFFAOYSA-N	0	3	346.474	3.399	20	30		EGEDHN
Cc1cc(C)cc(C(=O)NCC2CC(NCC#Cc3ccccc3)C2)c1	ZINC001100911352	1364328231	/nfs/dbraw/zinc/32/82/31/1364328231.db2.gz	NXOPXZVTHNOBNC-UHFFFAOYSA-N	0	3	346.474	3.453	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C2(c3cccc(C)c3)CC2)C1	ZINC001101039394	1364385593	/nfs/dbraw/zinc/38/55/93/1364385593.db2.gz	JQKBGEZGDGUWMT-UHFFFAOYSA-N	0	3	332.875	3.264	20	30		EGEDHN
C=CCN1CC[C@H](Oc2ccnc(CNC(=O)[C@@H](C)CCCC)c2)C1	ZINC001101093935	1364410832	/nfs/dbraw/zinc/41/08/32/1364410832.db2.gz	NCOHMAVLKRRAFF-LPHOPBHVSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=CCN1CC[C@@H](Oc2ccnc(CNC(=O)CC(C)(C)CC)c2)C1	ZINC001101094174	1364410963	/nfs/dbraw/zinc/41/09/63/1364410963.db2.gz	RMWBCXHAXGREPD-GOSISDBHSA-N	0	3	345.487	3.163	20	30		EGEDHN
C#CCCCC(=O)N1C[C@H]2CN([C@H](C)c3cccc(F)c3)C[C@@]2(C)C1	ZINC001101212994	1364464528	/nfs/dbraw/zinc/46/45/28/1364464528.db2.gz	MYUHIFGRBYKBKF-BLIXFSHQSA-N	0	3	342.458	3.471	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@H]2CN(Cc3cnc(C)s3)C[C@@]2(C)C1	ZINC001101333251	1364513482	/nfs/dbraw/zinc/51/34/82/1364513482.db2.gz	NAACFYJLGBTJRE-GMBSWORKSA-N	0	3	347.528	3.334	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@H]2CN(Cc3cccnc3C)C[C@@]2(C)C1	ZINC001101337568	1364515924	/nfs/dbraw/zinc/51/59/24/1364515924.db2.gz	DUSJBLUYPFJCDX-DSKINZAPSA-N	0	3	341.499	3.273	20	30		EGEDHN
C=CCCCC(=O)N1C[C@H]2CN(Cc3scnc3C)C[C@@]2(C)C1	ZINC001101346998	1364520457	/nfs/dbraw/zinc/52/04/57/1364520457.db2.gz	QSGIYGSDUDYXTI-QAPCUYQASA-N	0	3	333.501	3.088	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)C[C@H](CC)c3ccc(C)cc3)C[C@]2(C)C1	ZINC001101363334	1364528309	/nfs/dbraw/zinc/52/83/09/1364528309.db2.gz	SPGSTYBVOBUENO-DWLFOUALSA-N	0	3	338.495	3.292	20	30		EGEDHN
C=C[C@H](CC(=O)N1C[C@H]2CN(CC#CC)C[C@@]2(C)C1)c1ccccc1	ZINC001101471552	1364574960	/nfs/dbraw/zinc/57/49/60/1364574960.db2.gz	XDLSMBRQPKDGDV-UZKOGDIHSA-N	0	3	336.479	3.150	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@H]1CC2(CN(CCC(C)C)C2)n2ccnc21	ZINC001101638044	1364664343	/nfs/dbraw/zinc/66/43/43/1364664343.db2.gz	UDMKGUUZEKQMHP-IRXDYDNUSA-N	0	3	344.503	3.103	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CNC(=O)CC1CCCC1	ZINC001101692303	1364691585	/nfs/dbraw/zinc/69/15/85/1364691585.db2.gz	JTJABFYBARLZAJ-GDBMZVCRSA-N	0	3	345.512	3.384	20	30		EGEDHN
CC/C=C(\C)C(=O)NC[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1C	ZINC001101778001	1364723470	/nfs/dbraw/zinc/72/34/70/1364723470.db2.gz	WQVNLGKITDINLR-FVNTZPODSA-N	0	3	342.458	3.218	20	30		EGEDHN
CC(C)[C@@H](C)CC(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C	ZINC001101808292	1364735359	/nfs/dbraw/zinc/73/53/59/1364735359.db2.gz	ZXUMSSFTRJRCNG-QKNQBKEWSA-N	0	3	340.511	3.404	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CNC(=O)/C=C/C(C)(C)C	ZINC001101824958	1364740351	/nfs/dbraw/zinc/74/03/51/1364740351.db2.gz	JPASQHXKOCTAGM-FHFZEBMASA-N	0	3	345.512	3.406	20	30		EGEDHN
CC[C@@H](C)CC(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C	ZINC001101918201	1364774072	/nfs/dbraw/zinc/77/40/72/1364774072.db2.gz	LOURBEZFYJEPMR-QWFCFKBJSA-N	0	3	326.484	3.158	20	30		EGEDHN
C[C@@H](C(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C)C1CCC1	ZINC001102079965	1364841771	/nfs/dbraw/zinc/84/17/71/1364841771.db2.gz	MAZZHXZZTBDWQJ-DBXWQHBBSA-N	0	3	338.495	3.158	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CNC(=O)C1(C)CCCC1	ZINC001102200486	1364930160	/nfs/dbraw/zinc/93/01/60/1364930160.db2.gz	FXXXTLRPKVOGEE-HUUCEWRRSA-N	0	3	345.512	3.384	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@@H]1CN(Cc2c(C)onc2CC)C[C@H]1C	ZINC001102328252	1365004020	/nfs/dbraw/zinc/00/40/20/1365004020.db2.gz	BNRYTPUFYUCVFO-KKVAFCGZSA-N	0	3	347.503	3.332	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H]2CN(Cc3conc3C)C[C@H]2C)CCCC1	ZINC001102620637	1365139570	/nfs/dbraw/zinc/13/95/70/1365139570.db2.gz	NZYCLHRLPZHDNA-NVXWUHKLSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)CCC(F)(F)F)C1	ZINC001102817817	1365233576	/nfs/dbraw/zinc/23/35/76/1365233576.db2.gz	YNANROYRYUEUGP-ZYHUDNBSSA-N	0	3	326.790	3.156	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)[C@@H](CC)CC(F)F)C1	ZINC001103074375	1365365325	/nfs/dbraw/zinc/36/53/25/1365365325.db2.gz	DRMFSUSZQVXSAR-KWCYVHTRSA-N	0	3	336.854	3.495	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)C[C@H](C)c2ccncc2)C1	ZINC001103138680	1365402888	/nfs/dbraw/zinc/40/28/88/1365402888.db2.gz	YHBWOOJJTDHSCS-HDMKZQKVSA-N	0	3	349.906	3.402	20	30		EGEDHN
CC[C@@H](F)C(=O)NCC[C@@H]1CN(Cc2cc(C#N)ccc2F)C[C@H]1C	ZINC001103320102	1365491733	/nfs/dbraw/zinc/49/17/33/1365491733.db2.gz	MHYJGNYMOAZZBE-FRFSOERESA-N	0	3	349.425	3.020	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)C2(C(F)F)CCC2)C1	ZINC001103362228	1365517894	/nfs/dbraw/zinc/51/78/94/1365517894.db2.gz	XTGLIFZFNMHUDN-DGCLKSJQSA-N	0	3	334.838	3.249	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)Cc2cccc(C)c2)C1	ZINC001103386989	1365528893	/nfs/dbraw/zinc/52/88/93/1365528893.db2.gz	CQEJRHMNDGOXHO-CRAIPNDOSA-N	0	3	334.891	3.364	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)C2(C(C)(F)F)CC2)C1	ZINC001103443623	1365563293	/nfs/dbraw/zinc/56/32/93/1365563293.db2.gz	CXZOARAOBRKFGD-DGCLKSJQSA-N	0	3	334.838	3.249	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)NCC[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1C	ZINC001103489649	1365593494	/nfs/dbraw/zinc/59/34/94/1365593494.db2.gz	OCTSWYVNHHTWCB-ZHALLVOQSA-N	0	3	341.499	3.425	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2ncc(C)cc2C)C[C@H]1C	ZINC001104438595	1366028936	/nfs/dbraw/zinc/02/89/36/1366028936.db2.gz	HWTBCWQMYLNVER-GDBMZVCRSA-N	0	3	335.879	3.139	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2cccc(OC)n2)C1	ZINC001104607120	1366099045	/nfs/dbraw/zinc/09/90/45/1366099045.db2.gz	KPMAHQBVUDEGJM-IAGOWNOFSA-N	0	3	345.487	3.021	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2oc(C)nc2C)C1	ZINC001104607106	1366099472	/nfs/dbraw/zinc/09/94/72/1366099472.db2.gz	KDBIYRFLXPUNCT-RHSMWYFYSA-N	0	3	333.476	3.222	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H](C)[C@H](CCNCc2ccc(F)cn2)C1	ZINC001104631389	1366110015	/nfs/dbraw/zinc/11/00/15/1366110015.db2.gz	LFCDTKXJWCWZBW-QINHECLXSA-N	0	3	347.478	3.397	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2nc(C)c(C)s2)C[C@H]1C	ZINC001105031970	1366285725	/nfs/dbraw/zinc/28/57/25/1366285725.db2.gz	QPAFMQYFIXCHLX-QMTHXVAHSA-N	0	3	341.908	3.200	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)/C=C\C(C)(C)C)CC1	ZINC001105391851	1366439859	/nfs/dbraw/zinc/43/98/59/1366439859.db2.gz	NXEKRUHVOGSZKY-DIBVOSKASA-N	0	3	328.500	3.315	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@H]1C[C@@](CNCCF)(c2ccccc2)C1	ZINC001105435230	1366466941	/nfs/dbraw/zinc/46/69/41/1366466941.db2.gz	FBIQYPJKEZXIHZ-POAQFYNOSA-N	0	3	332.463	3.364	20	30		EGEDHN
CC(=O)N1CCCC[C@H]1C1(CNCc2ccccc2C#N)CCC1	ZINC001105491844	1366491683	/nfs/dbraw/zinc/49/16/83/1366491683.db2.gz	NLXYCEBIRJBBRM-IBGZPJMESA-N	0	3	325.456	3.219	20	30		EGEDHN
CCCCCC(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001105830137	1366593668	/nfs/dbraw/zinc/59/36/68/1366593668.db2.gz	QFJMCLLQYLRCLA-VQIMIIECSA-N	0	3	327.472	3.323	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@@H](CN[C@@H](C)c2c(F)cccc2F)[C@H](C)C1	ZINC001106105419	1366611750	/nfs/dbraw/zinc/61/17/50/1366611750.db2.gz	TWOYAHLHVJJTDW-OWCLPIDISA-N	0	3	348.437	3.369	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)[C@H](C)CC3CCCCC3)[C@@H]2C1	ZINC001189317547	1366986977	/nfs/dbraw/zinc/98/69/77/1366986977.db2.gz	PYKGQPWHCSWITO-YZGWKJHDSA-N	0	3	348.531	3.328	20	30		EGEDHN
CC#CCCCC(=O)NC[C@]12CCC[C@H]1N(Cc1cncs1)CC2	ZINC001107512828	1367011650	/nfs/dbraw/zinc/01/16/50/1367011650.db2.gz	KBUVHEYXYUKVBZ-IEBWSBKVSA-N	0	3	345.512	3.198	20	30		EGEDHN
Cc1cc(C)c(CN2[C@@H]3CC[C@H]2[C@@H](NC(=O)C#CC2CC2)C3)c(C)c1	ZINC001109251982	1367027436	/nfs/dbraw/zinc/02/74/36/1367027436.db2.gz	TYZZDAFJZJWREK-GIVPXCGWSA-N	0	3	336.479	3.247	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@]23CCC[C@H]2N(Cc2cnoc2C)CC3)C1	ZINC001107543386	1367034888	/nfs/dbraw/zinc/03/48/88/1367034888.db2.gz	HBXIJIZDOKBCJD-YLJYHZDGSA-N	0	3	343.471	3.200	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)[C@@H](C)CCCCCC)[C@@H]2C1	ZINC001189506775	1367038228	/nfs/dbraw/zinc/03/82/28/1367038228.db2.gz	IEGJVWNXDCNYBZ-GBESFXJTSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCOCCCC(=O)N1CC[C@@H](N(C)C/C=C\c2ccccc2)C1	ZINC001189564638	1367055201	/nfs/dbraw/zinc/05/52/01/1367055201.db2.gz	FOPKGLSSFIKFFC-RVPHRTOXSA-N	0	3	342.483	3.215	20	30		EGEDHN
C=CCOCCCC(=O)N1CC[C@@H](N(C)Cc2csc(C)c2)C1	ZINC001189573155	1367057174	/nfs/dbraw/zinc/05/71/74/1367057174.db2.gz	CISDKJJYCXNRAO-QGZVFWFLSA-N	0	3	336.501	3.072	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](N(C)Cc2ccc(C)c(OC)c2)C1	ZINC001189744032	1367100839	/nfs/dbraw/zinc/10/08/39/1367100839.db2.gz	LGOIKKLCKKAUIH-IBGZPJMESA-N	0	3	342.483	3.230	20	30		EGEDHN
C#CCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3Cc2ccc(C)cc2)CCC1	ZINC001109392038	1367101677	/nfs/dbraw/zinc/10/16/77/1367101677.db2.gz	MOQFNWSGNRYYFQ-AABGKKOBSA-N	0	3	336.479	3.410	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CC1=CCCCC1	ZINC001109563053	1367199955	/nfs/dbraw/zinc/19/99/55/1367199955.db2.gz	GFDDYYIFRUSMPB-JKBKZWBZSA-N	0	3	346.515	3.437	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2cscc2C(F)F)C1	ZINC001190213566	1367200991	/nfs/dbraw/zinc/20/09/91/1367200991.db2.gz	MJLMAWXUBKUQEY-GFCCVEGCSA-N	0	3	344.427	3.035	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2cc(C)cs2)C1	ZINC001107921970	1367202979	/nfs/dbraw/zinc/20/29/79/1367202979.db2.gz	JMOPDDPXZKWFRU-MAUKXSAKSA-N	0	3	336.501	3.232	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@]1(C)CN(CC2CCCCC2)CCO1	ZINC001107972082	1367224899	/nfs/dbraw/zinc/22/48/99/1367224899.db2.gz	FDSMPNMLSZDJTJ-HXUWFJFHSA-N	0	3	336.520	3.376	20	30		EGEDHN
C#CCC1(C(=O)NC[C@@]2(C)CN(C[C@@H](C)CC(C)C)CCO2)CCC1	ZINC001107990923	1367232020	/nfs/dbraw/zinc/23/20/20/1367232020.db2.gz	QWIGGBHFMJIRJT-ICSRJNTNSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CC1CC(F)(F)C1	ZINC001109634219	1367252910	/nfs/dbraw/zinc/25/29/10/1367252910.db2.gz	HBOOQAVFRUYWIM-OJLVUWQFSA-N	0	3	326.431	3.356	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3C[C@H]2CCCCO2)CCC1	ZINC001109680737	1367278877	/nfs/dbraw/zinc/27/88/77/1367278877.db2.gz	WOOXTZBRYPRMSX-BDXSIMOUSA-N	0	3	332.488	3.023	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@]1(C)CN(CC2CCC3(CC3)CC2)CCO1	ZINC001108122352	1367292681	/nfs/dbraw/zinc/29/26/81/1367292681.db2.gz	RJTKGGVZLZMZLP-FQEVSTJZSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@@H](C)CC(C)(C)C)C2	ZINC001109759180	1367305575	/nfs/dbraw/zinc/30/55/75/1367305575.db2.gz	PQYSXUOCXSJXJD-BDXSIMOUSA-N	0	3	336.520	3.373	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@@]1(C)CN(CC2CCCCC2)CCO1	ZINC001108149405	1367310225	/nfs/dbraw/zinc/31/02/25/1367310225.db2.gz	VLIQVYVWINYXDX-PXNSSMCTSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2C[C@H]1CC(C)(C)CO1	ZINC001109767857	1367310907	/nfs/dbraw/zinc/31/09/07/1367310907.db2.gz	OAAUCWLNVJWOGV-NCOADZHNSA-N	0	3	334.504	3.125	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@@]1(C)CN(CC2CCCCC2)CCO1	ZINC001108150535	1367311265	/nfs/dbraw/zinc/31/12/65/1367311265.db2.gz	FAQRONCHPKRYEQ-PXNSSMCTSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)C2(CCC=C)CC2)C1	ZINC001108185868	1367328489	/nfs/dbraw/zinc/32/84/89/1367328489.db2.gz	GPPFKJJAEXTTFI-PKOBYXMFSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CCCC1(C(=O)NC[C@@]2(C)CN(CCC(C)(C)C)CCO2)CC1	ZINC001108185524	1367329109	/nfs/dbraw/zinc/32/91/09/1367329109.db2.gz	AWEHGOMLELQLCW-IBGZPJMESA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)Nc1ccccc1OC(F)(F)F	ZINC001190700816	1367330921	/nfs/dbraw/zinc/33/09/21/1367330921.db2.gz	NNSXDYNFNLJYBY-LBPRGKRZSA-N	0	3	343.349	3.357	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCO[C@@H]1C1CCN(C(=O)CCCC)CC1	ZINC001186114849	1387873489	/nfs/dbraw/zinc/87/34/89/1387873489.db2.gz	QAGSWJGXCBJCNM-SJLPKXTDSA-N	0	3	342.911	3.305	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCOc1ccccc1CC)C2	ZINC001109962466	1367429511	/nfs/dbraw/zinc/42/95/11/1367429511.db2.gz	XTTHVWKJQTWMNI-QYZOEREBSA-N	0	3	342.483	3.316	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2cccn2C(C)C)C1	ZINC001108400561	1367434365	/nfs/dbraw/zinc/43/43/65/1367434365.db2.gz	JHCRQPGFDDLMSR-XLIONFOSSA-N	0	3	347.503	3.244	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C1CCC(C3CC3)CC1)C2	ZINC001110048351	1367482178	/nfs/dbraw/zinc/48/21/78/1367482178.db2.gz	YVNVNMPNAZQQNK-PBDJWPIDSA-N	0	3	346.515	3.127	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](C)CCc1cccc(F)c1)C2	ZINC001110129151	1367513263	/nfs/dbraw/zinc/51/32/63/1367513263.db2.gz	SKLYOGHCIBRZCU-LDTOTXGLSA-N	0	3	342.458	3.139	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3[C@H](C)COC)CCCCC1	ZINC001110135967	1367517978	/nfs/dbraw/zinc/51/79/78/1367517978.db2.gz	YQLOTLMJUFXBTN-BDXSIMOUSA-N	0	3	334.504	3.269	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2csc3ccccc23)C1	ZINC001191596115	1367539130	/nfs/dbraw/zinc/53/91/30/1367539130.db2.gz	VAFMURZMKUZQKE-HNNXBMFYSA-N	0	3	344.480	3.250	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001191753616	1367576601	/nfs/dbraw/zinc/57/66/01/1367576601.db2.gz	FQGSSCHFUBRRQK-FQEVSTJZSA-N	0	3	337.467	3.175	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](N(C)CCc2ccccc2F)C1	ZINC001191754545	1367577458	/nfs/dbraw/zinc/57/74/58/1367577458.db2.gz	QFRBDAKFFSFGSM-LJQANCHMSA-N	0	3	344.474	3.485	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](N(C)Cc2ccc(F)cc2C)C1	ZINC001191859348	1367617070	/nfs/dbraw/zinc/61/70/70/1367617070.db2.gz	KJHJCFQAMXBIFU-LJQANCHMSA-N	0	3	330.447	3.360	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](N(C)CCOC2CCCCCC2)C1	ZINC001191868637	1367622269	/nfs/dbraw/zinc/62/22/69/1367622269.db2.gz	XIDXWDWFPQCJGL-LJQANCHMSA-N	0	3	348.531	3.452	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@@H](N(C)CCc2csc(C)n2)C1	ZINC001191889595	1367627585	/nfs/dbraw/zinc/62/75/85/1367627585.db2.gz	IPDHJBACWIQKTQ-DOTOQJQBSA-N	0	3	335.517	3.129	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@@H](N(C)Cc2cccc(OC)c2)C1	ZINC001191911252	1367635666	/nfs/dbraw/zinc/63/56/66/1367635666.db2.gz	DCDQDGPWWZADJK-SJLPKXTDSA-N	0	3	330.472	3.330	20	30		EGEDHN
CC#CCN1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)[C@H](C)CC)C1	ZINC001186181289	1387892616	/nfs/dbraw/zinc/89/26/16/1387892616.db2.gz	UFYKSSQAYIGTKH-YVWKXTFCSA-N	0	3	344.474	3.417	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](N(C)Cc2cccc(COC)c2)C1	ZINC001192073717	1367681835	/nfs/dbraw/zinc/68/18/35/1367681835.db2.gz	VPWKVPLBBSTYDQ-IBGZPJMESA-N	0	3	330.472	3.222	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@H](N(C)CCOc3ccccc3)C2)CC1	ZINC001192218878	1367722070	/nfs/dbraw/zinc/72/20/70/1367722070.db2.gz	XJRSSQUCTXNRBP-SFHVURJKSA-N	0	3	342.483	3.345	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCOC1CCCCCC1	ZINC001110497498	1367785924	/nfs/dbraw/zinc/78/59/24/1367785924.db2.gz	XAKJSYIDWXMAGZ-RLLQIKCJSA-N	0	3	346.515	3.251	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2[C@H]1CCc2ccccc21	ZINC001110543881	1367822198	/nfs/dbraw/zinc/82/21/98/1367822198.db2.gz	MGBMVBGOYQUNQR-LMCOJAPRSA-N	0	3	336.479	3.445	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](N(C)CCc2scnc2C)C1	ZINC001192587050	1367826024	/nfs/dbraw/zinc/82/60/24/1367826024.db2.gz	ZAXONDBAMRQDDK-HNNXBMFYSA-N	0	3	335.517	3.129	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCOCCC(C)C	ZINC001110602229	1367863863	/nfs/dbraw/zinc/86/38/63/1367863863.db2.gz	IOIPMWNEDZCEGV-KURKYZTESA-N	0	3	336.520	3.373	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccccc1)OCC	ZINC001110616938	1367872919	/nfs/dbraw/zinc/87/29/19/1367872919.db2.gz	WMCYHWHOBZFFCK-YSTOQKLRSA-N	0	3	342.483	3.279	20	30		EGEDHN
CCC(CC)CC(=O)N1CC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001193077958	1367937843	/nfs/dbraw/zinc/93/78/43/1367937843.db2.gz	PHFYVDWMXKNLBM-LJQANCHMSA-N	0	3	327.472	3.417	20	30		EGEDHN
CCC[C@H](CC)C(=O)N1CC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001193122163	1367949951	/nfs/dbraw/zinc/94/99/51/1367949951.db2.gz	IGUJIIQVVOJZDB-RBUKOAKNSA-N	0	3	327.472	3.417	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCc1cccc(Cl)c1)C2	ZINC001110873403	1368050421	/nfs/dbraw/zinc/05/04/21/1368050421.db2.gz	XBGNVTRKYITWJQ-KURKYZTESA-N	0	3	330.859	3.017	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCOCCC(C)C	ZINC001110934508	1368104524	/nfs/dbraw/zinc/10/45/24/1368104524.db2.gz	GGAYIIZVVVNFDB-MANSERQUSA-N	0	3	336.520	3.373	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](CC)c1c(C)noc1C)C2	ZINC001111148384	1368165126	/nfs/dbraw/zinc/16/51/26/1368165126.db2.gz	IKTBIHYPCXBGHV-VQHPVUNQSA-N	0	3	331.460	3.083	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@H](C)c1ccccc1OC)C2	ZINC001111292562	1368255145	/nfs/dbraw/zinc/25/51/45/1368255145.db2.gz	GUMGZJWLBQAHDT-ISARSNTHSA-N	0	3	342.483	3.486	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCOc1cc(C)ccc1C)C2	ZINC001111351746	1368271728	/nfs/dbraw/zinc/27/17/28/1368271728.db2.gz	HNXXRVSQSSBNLW-QRVBRYPASA-N	0	3	342.483	3.370	20	30		EGEDHN
C=CCC[C@@H](C)N1[C@@H]2CC[C@H]1[C@H](NC(=O)c1scnc1Cl)C2	ZINC001111410381	1368303273	/nfs/dbraw/zinc/30/32/73/1368303273.db2.gz	DLRCCHAIYICVJU-LPWJVIDDSA-N	0	3	339.892	3.486	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H]1CCCC(C)(C)C1)C2	ZINC001111477991	1368315958	/nfs/dbraw/zinc/31/59/58/1368315958.db2.gz	HVSBUPBPQXTYPO-MLHJIOFPSA-N	0	3	334.504	3.127	20	30		EGEDHN
C#CC[C@@H](CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CC(=C)C)c1ccccc1	ZINC001111511181	1368323106	/nfs/dbraw/zinc/32/31/06/1368323106.db2.gz	AHFDVKNQOMHVJT-BQJUDKOJSA-N	0	3	336.479	3.481	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)C[C@H](NC(=O)CCCC)c1ccccc1O2	ZINC001111529092	1368327566	/nfs/dbraw/zinc/32/75/66/1368327566.db2.gz	DMPQMCHHDNTMAD-RXVVDRJESA-N	0	3	340.467	3.284	20	30		EGEDHN
CCC[C@@H](C)C(=O)N[C@]12CCC[C@H]1CN(Cc1cccc(C#N)c1)C2	ZINC001111673099	1368418681	/nfs/dbraw/zinc/41/86/81/1368418681.db2.gz	XYJUVVQJGJKCOX-PBEJRMEISA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C[C@@](C)(O)CC(=O)N1CCCN(Cc2ccccc2C(C)C)CC1	ZINC001195681630	1368471905	/nfs/dbraw/zinc/47/19/05/1368471905.db2.gz	HLGULOZQEIIWEC-OAQYLSRUSA-N	0	3	344.499	3.171	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H](C)Cc2ccccc2F)C1	ZINC001111871056	1368518190	/nfs/dbraw/zinc/51/81/90/1368518190.db2.gz	YAZIHLQIXQLAOV-KNBMTAEXSA-N	0	3	330.447	3.161	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CCCN(CCCCCF)CC1)OCC	ZINC001196025448	1368537766	/nfs/dbraw/zinc/53/77/66/1368537766.db2.gz	QHODJFXYSOQZIF-QGZVFWFLSA-N	0	3	328.472	3.032	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)[C@@](C)(OC)c2ccccc2F)CC1	ZINC001196092877	1368547289	/nfs/dbraw/zinc/54/72/89/1368547289.db2.gz	NNTWYUZYLPNNNN-FQEVSTJZSA-N	0	3	348.462	3.188	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cnn(C)c2Cl)CC1	ZINC001196295725	1368585442	/nfs/dbraw/zinc/58/54/42/1368585442.db2.gz	PFOAUTWDCLECIZ-UHFFFAOYSA-N	0	3	340.899	3.192	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cc(C)nnc2CC)CC1	ZINC001196325440	1368589923	/nfs/dbraw/zinc/58/99/23/1368589923.db2.gz	PJSDEJAKCUSKSV-UHFFFAOYSA-N	0	3	344.503	3.242	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)c2c(C)cccc2C)C1	ZINC001196352770	1368595516	/nfs/dbraw/zinc/59/55/16/1368595516.db2.gz	WNPKWKMOFHVAQR-QZTJIDSGSA-N	0	3	332.488	3.049	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2cc(-c3ccccc3)on2)CC1	ZINC001196454403	1368617920	/nfs/dbraw/zinc/61/79/20/1368617920.db2.gz	LQYHWPBBMDIFAT-UHFFFAOYSA-N	0	3	339.439	3.456	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cc(Cl)n(C)n2)CC1	ZINC001196461397	1368619947	/nfs/dbraw/zinc/61/99/47/1368619947.db2.gz	GTOQHRVJNVWIOO-UHFFFAOYSA-N	0	3	340.899	3.192	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2ncsc2C(F)(F)F)CC1	ZINC001196493165	1368626734	/nfs/dbraw/zinc/62/67/34/1368626734.db2.gz	RYIZYNWURHJKQO-UHFFFAOYSA-N	0	3	347.406	3.276	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](C(F)(F)F)[C@H](NCCC(F)(F)F)C1	ZINC001112156958	1368689133	/nfs/dbraw/zinc/68/91/33/1368689133.db2.gz	KCFRMTQUMWSCPW-GHMZBOCLSA-N	0	3	346.315	3.274	20	30		EGEDHN
C=CCCCC(=O)N1CCCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC001197000073	1368728448	/nfs/dbraw/zinc/72/84/48/1368728448.db2.gz	JHQRKSIUESAGAN-HXUWFJFHSA-N	0	3	344.499	3.135	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cnc(C3CC3)nc2)CC1	ZINC001197346287	1368793432	/nfs/dbraw/zinc/79/34/32/1368793432.db2.gz	MTDMARNDTSVYFD-UHFFFAOYSA-N	0	3	342.487	3.248	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H]2CCC[C@]2(CNCc2cscn2)C1	ZINC001112375489	1368801504	/nfs/dbraw/zinc/80/15/04/1368801504.db2.gz	VSGHMGMSDNMPHP-KXBFYZLASA-N	0	3	347.528	3.464	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cn(CCC)nc2C)CC1	ZINC001197536878	1368834489	/nfs/dbraw/zinc/83/44/89/1368834489.db2.gz	SLLYHZSTMLGTPT-UHFFFAOYSA-N	0	3	346.519	3.496	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cnn3c2CCCC3)CC1	ZINC001197691146	1368873760	/nfs/dbraw/zinc/87/37/60/1368873760.db2.gz	CYHGTWPVVUSRNK-UHFFFAOYSA-N	0	3	344.503	3.114	20	30		EGEDHN
C#CCCN1CCCN(C(=O)C[C@H](c2ccccc2)C(C)C)CC1	ZINC001197795238	1368899037	/nfs/dbraw/zinc/89/90/37/1368899037.db2.gz	UXNYDFYABYJCIH-FQEVSTJZSA-N	0	3	326.484	3.374	20	30		EGEDHN
CCCCCCCCCC(=O)N[C@@H]1CN(CCCCC)C[C@H]1O	ZINC001198103653	1368960038	/nfs/dbraw/zinc/96/00/38/1368960038.db2.gz	MSINUHAAZGLQQN-QZTJIDSGSA-N	0	3	326.525	3.479	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)CCCC2CC2)C1	ZINC001325438316	1387972181	/nfs/dbraw/zinc/97/21/81/1387972181.db2.gz	NTXDUFNADHCYBE-UZLBHIALSA-N	0	3	339.483	3.465	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)C[C@H](C)c2ccccc2)C1	ZINC001198374555	1369018147	/nfs/dbraw/zinc/01/81/47/1369018147.db2.gz	XMFVSYCCUDHTRC-DFQSSKMNSA-N	0	3	346.515	3.312	20	30		EGEDHN
C=CCC[C@H](C)N[C@@H](CNC(=O)C(F)F)c1ccccc1OC	ZINC001198472321	1369040266	/nfs/dbraw/zinc/04/02/66/1369040266.db2.gz	OYKYNKKOQOAKPM-JSGCOSHPSA-N	0	3	326.387	3.062	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)C(C)(F)F)c1ccccc1OC	ZINC001198493136	1369045374	/nfs/dbraw/zinc/04/53/74/1369045374.db2.gz	WYJJGGJLABBITM-CQSZACIVSA-N	0	3	326.387	3.064	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)CCCC(C)=O)c1ccccc1OC	ZINC001198529506	1369054747	/nfs/dbraw/zinc/05/47/47/1369054747.db2.gz	GHRQGDNNIAIKGA-GOSISDBHSA-N	0	3	346.471	3.168	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)CCOC(C)C)c1ccccc1OC	ZINC001198552386	1369059307	/nfs/dbraw/zinc/05/93/07/1369059307.db2.gz	DBHXDNKEIGUKQH-GOSISDBHSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCCCCN[C@@H](CNC(=O)[C@H](C)OC)c1ccccc1OC	ZINC001198577755	1369065516	/nfs/dbraw/zinc/06/55/16/1369065516.db2.gz	LQPZYUDZYTYMDV-WMZOPIPTSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCC(=O)NC[C@@H](NCC1CC(C)C1)c1ccccc1OC	ZINC001198597501	1369069599	/nfs/dbraw/zinc/06/95/99/1369069599.db2.gz	ZORIBFGBFFXKRI-LEOMRAHMSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)C1CC=CC1)c1ccccc1OC	ZINC001198638523	1369079595	/nfs/dbraw/zinc/07/95/95/1369079595.db2.gz	YIQMDUZCAAGETA-SFHVURJKSA-N	0	3	328.456	3.375	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)[C@H](C)C1CC1)c1ccccc1OC	ZINC001198647372	1369081449	/nfs/dbraw/zinc/08/14/49/1369081449.db2.gz	MTGVPTDIDLITSM-CRAIPNDOSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)[C@@H]1CC1(C)C)c1ccccc1OC	ZINC001198667182	1369086294	/nfs/dbraw/zinc/08/62/94/1369086294.db2.gz	DPRXDMJGCPTSRH-DLBZAZTESA-N	0	3	330.472	3.454	20	30		EGEDHN
C#CCCCC(=O)NC[C@H](NCCCC=C)c1ccccc1OC	ZINC001198696326	1369093367	/nfs/dbraw/zinc/09/33/67/1369093367.db2.gz	WPXJQCABUIRNQJ-SFHVURJKSA-N	0	3	328.456	3.212	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)C#CC(C)C)c1ccccc1OC	ZINC001198714271	1369098281	/nfs/dbraw/zinc/09/82/81/1369098281.db2.gz	WCTPOLQDOMHMTE-GOSISDBHSA-N	0	3	328.456	3.068	20	30		EGEDHN
C#CCC1(C(=O)NC[C@@H](NCC2CC2)c2ccccc2OC)CCC1	ZINC001198752449	1369105115	/nfs/dbraw/zinc/10/51/15/1369105115.db2.gz	PVDSHEIHXGHCRI-GOSISDBHSA-N	0	3	340.467	3.046	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H](NCC1CC1)c1ccccc1OC	ZINC001198825298	1369123006	/nfs/dbraw/zinc/12/30/06/1369123006.db2.gz	BLBAPLDQVLXNPL-QGZVFWFLSA-N	0	3	330.472	3.454	20	30		EGEDHN
CC#CCCCC(=O)NC[C@H](NCCC1CC1)c1ccccc1OC	ZINC001198856927	1369131747	/nfs/dbraw/zinc/13/17/47/1369131747.db2.gz	LUKGUOITJRCLQI-IBGZPJMESA-N	0	3	342.483	3.436	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@@H](NCCCOC)c1ccccc1OC	ZINC001198857711	1369132662	/nfs/dbraw/zinc/13/26/62/1369132662.db2.gz	WHALFHHNKFQGMT-SJLPKXTDSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@@H](NCCCF)c1ccccc1OC	ZINC001198916553	1369148692	/nfs/dbraw/zinc/14/86/92/1369148692.db2.gz	OZCSZJCQZNEGCZ-MRXNPFEDSA-N	0	3	336.451	3.404	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)C[C@H](C)c2c(C)noc2C)CC1	ZINC001113030084	1369150897	/nfs/dbraw/zinc/15/08/97/1369150897.db2.gz	JQMHEAZYLFXJMS-LSDHHAIUSA-N	0	3	333.476	3.284	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)C[C@@H](C)COC)c1ccccc1OC	ZINC001198952909	1369157179	/nfs/dbraw/zinc/15/71/79/1369157179.db2.gz	DJKRIRKIZJJKMU-SJLPKXTDSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NC[C@H](NCCCCC)c1ccccc1OC	ZINC001199001898	1369170222	/nfs/dbraw/zinc/17/02/22/1369170222.db2.gz	MMSYUKFHBXPKPE-WMZOPIPTSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)C2(CC=C)CCCC2)C1	ZINC001199567525	1369238398	/nfs/dbraw/zinc/23/83/98/1369238398.db2.gz	RZLZGNJOMBXVJV-QZTJIDSGSA-N	0	3	334.504	3.031	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)c2cc3ccccc3[nH]c2=O)CC1	ZINC001113174621	1369244795	/nfs/dbraw/zinc/24/47/95/1369244795.db2.gz	SUYHVLHSAIDRHU-OAHLLOKOSA-N	0	3	339.439	3.053	20	30		EGEDHN
N#Cc1ccc2ccccc2c1NC(=S)NCCN1CCCCC1	ZINC001200432121	1369366616	/nfs/dbraw/zinc/36/66/16/1369366616.db2.gz	VALIJPMVVNEIKI-UHFFFAOYSA-N	0	3	338.480	3.484	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)Cc2cc(F)c(F)cc2F)CC1	ZINC001113380407	1369380370	/nfs/dbraw/zinc/38/03/70/1369380370.db2.gz	MNHYONVTTMWBKG-ZDUSSCGKSA-N	0	3	340.389	3.145	20	30		EGEDHN
C=C(C)CCC(=O)N1CCCO[C@@H](CN[C@@H](C)c2ccccc2F)C1	ZINC001200621464	1369401265	/nfs/dbraw/zinc/40/12/65/1369401265.db2.gz	JAISOEZWSCSBLY-IRXDYDNUSA-N	0	3	348.462	3.450	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC(NCc2nc(C)cs2)CC1	ZINC001200747168	1369422451	/nfs/dbraw/zinc/42/24/51/1369422451.db2.gz	BMJIZPXVPRKQTA-UHFFFAOYSA-N	0	3	333.501	3.301	20	30		EGEDHN
CC#CCNC[C@@H]1CN(C(=O)C2CC(C)(C)CC(C)(C)C2)CCCO1	ZINC001201089756	1369478802	/nfs/dbraw/zinc/47/88/02/1369478802.db2.gz	RUEQDCWOPZPACB-GOSISDBHSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCCO[C@H](CNCc2ccccc2F)C1	ZINC001201233390	1369501559	/nfs/dbraw/zinc/50/15/59/1369501559.db2.gz	PABRKXZBYWXBHQ-FUHWJXTLSA-N	0	3	348.462	3.135	20	30		EGEDHN
O=C(CC#Cc1ccccc1)N1CCN(C[C@@H]2CC[C@H]3C[C@H]3C2)CC1	ZINC001113668629	1369556628	/nfs/dbraw/zinc/55/66/28/1369556628.db2.gz	QWGLBHGHGUPIHR-QHAWAJNXSA-N	0	3	336.479	3.009	20	30		EGEDHN
C#CCNC[C@@H]1CN(C(=O)[C@H](CC2CCCCC2)C(C)C)CCCO1	ZINC001201546138	1369571198	/nfs/dbraw/zinc/57/11/98/1369571198.db2.gz	GDTIGOSCAJXQGC-WOJBJXKFSA-N	0	3	348.531	3.069	20	30		EGEDHN
CCCCCCCN1C[C@@H]2[C@H](C1)OCCN2Cc1c(C)noc1C	ZINC001201777303	1369622994	/nfs/dbraw/zinc/62/29/94/1369622994.db2.gz	VPCUFIUBWYSYHQ-MOPGFXCFSA-N	0	3	335.492	3.147	20	30		EGEDHN
CC#CCNC[C@@H]1CN(C(=O)[C@@H](CCCCC)C(C)C)CCCO1	ZINC001201822438	1369628980	/nfs/dbraw/zinc/62/89/80/1369628980.db2.gz	AORSQBBMGRQZTL-MOPGFXCFSA-N	0	3	336.520	3.069	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001202053409	1369677368	/nfs/dbraw/zinc/67/73/68/1369677368.db2.gz	CIORXZJMSQSHJA-SYZQJQIISA-N	0	3	341.430	3.300	20	30		EGEDHN
C#CCNC[C@H]1CN(C(=O)[C@@H](C)CCCCCCCC)CCCO1	ZINC001202142520	1369700597	/nfs/dbraw/zinc/70/05/97/1369700597.db2.gz	XPFKWBKYWAYMRJ-OALUTQOASA-N	0	3	336.520	3.213	20	30		EGEDHN
CCC(=O)N[C@@H]1C[C@H](NCC#Cc2cccc(Cl)c2)C12CCC2	ZINC001202257370	1369724209	/nfs/dbraw/zinc/72/42/09/1369724209.db2.gz	AJNGCBAHJQKSMK-DLBZAZTESA-N	0	3	330.859	3.119	20	30		EGEDHN
CC(C)CC(=O)N[C@@H]1C[C@H](NCC#Cc2ccc(F)cc2)C12CCC2	ZINC001202341042	1369742977	/nfs/dbraw/zinc/74/29/77/1369742977.db2.gz	MAFAIWPFVBQPMF-RBUKOAKNSA-N	0	3	342.458	3.240	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1[C@H]2CN([C@H](C)c3ccc(F)cc3)C[C@H]21	ZINC001114165790	1369772117	/nfs/dbraw/zinc/77/21/17/1369772117.db2.gz	KDNDVRXEZBVXEG-QKUWSGOFSA-N	0	3	328.431	3.127	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@H](NC(=O)CCCCC)C12CCC2	ZINC001202470226	1369781780	/nfs/dbraw/zinc/78/17/80/1369781780.db2.gz	PGCMYHLELAKANJ-KGLIPLIRSA-N	0	3	343.309	3.492	20	30		EGEDHN
C=CCNC(=O)NC1CCN(Cc2ccc(C(F)(F)F)cc2)CC1	ZINC001202576291	1369811895	/nfs/dbraw/zinc/81/18/95/1369811895.db2.gz	QRTLBVIMKHSTCM-UHFFFAOYSA-N	0	3	341.377	3.155	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@H](NC(=O)/C(C)=C\CC)C12CCC2	ZINC001202583605	1369813966	/nfs/dbraw/zinc/81/39/66/1369813966.db2.gz	ZFTGPTHVESHJGY-FGHOCRGKSA-N	0	3	341.293	3.268	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@@H](NCc2oc(CCC)nc2C)C12CCC2	ZINC001202597861	1369818520	/nfs/dbraw/zinc/81/85/20/1369818520.db2.gz	BRPLNAFUVCTEQL-IAGOWNOFSA-N	0	3	345.487	3.419	20	30		EGEDHN
CC[C@@H](c1ccc(Cl)cc1)N1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)C#CC1CC1	ZINC001114258069	1369833204	/nfs/dbraw/zinc/83/32/04/1369833204.db2.gz	KSRNDMYTWYHXKF-HLNWXESRSA-N	0	3	342.870	3.251	20	30		EGEDHN
CCCC[C@H](CNc1cccc(F)c1C#N)NC(=O)CN(C)CCC	ZINC001114269861	1369841189	/nfs/dbraw/zinc/84/11/89/1369841189.db2.gz	RDGLFKWTQRGMBT-OAHLLOKOSA-N	0	3	348.466	3.126	20	30		EGEDHN
C/C=C(/C)C(=O)N[C@@H]1C[C@@H](NCc2cc(C#N)ccc2F)C12CCC2	ZINC001202725564	1369867621	/nfs/dbraw/zinc/86/76/21/1369867621.db2.gz	OEMIDSQLDCXUCX-YYQAOVIASA-N	0	3	341.430	3.181	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1C[C@H](NCc2ccc(F)cc2F)C12CCC2	ZINC001202845193	1369905943	/nfs/dbraw/zinc/90/59/43/1369905943.db2.gz	BSPNUTSBHSYSMV-ZWKOTPCHSA-N	0	3	346.421	3.285	20	30		EGEDHN
O=C(C#CC1CC1)N[C@@H]1C[C@H](NCc2ccccc2Cl)C12CCC2	ZINC001202888080	1369917865	/nfs/dbraw/zinc/91/78/65/1369917865.db2.gz	OSWIQYGQVBEYKY-ZWKOTPCHSA-N	0	3	342.870	3.270	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@H]1C[C@@H](NCC=C(Cl)Cl)C12CCC2	ZINC001202919645	1369926658	/nfs/dbraw/zinc/92/66/58/1369926658.db2.gz	GDDRQIQTMRAPDT-OLZOCXBDSA-N	0	3	343.298	3.372	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@@H]1C[C@H](NCC=C(Cl)Cl)C12CCC2	ZINC001202919646	1369926893	/nfs/dbraw/zinc/92/68/93/1369926893.db2.gz	GDDRQIQTMRAPDT-QWHCGFSZSA-N	0	3	343.298	3.372	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1C[C@H](NCc2conc2C)C12CCC2	ZINC001202959896	1369937238	/nfs/dbraw/zinc/93/72/38/1369937238.db2.gz	IAVWKQBBGIIZRT-HOTGVXAUSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1C[C@@H](NCC(=C)Br)C12CCC2	ZINC001202977664	1369943847	/nfs/dbraw/zinc/94/38/47/1369943847.db2.gz	FJJDNAZIQNVVFU-KGLIPLIRSA-N	0	3	341.293	3.268	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1C[C@H](NCc2conc2CC)C12CCC2	ZINC001202986147	1369946182	/nfs/dbraw/zinc/94/61/82/1369946182.db2.gz	GYPZWGXKOUCNBX-DLBZAZTESA-N	0	3	331.460	3.110	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1C[C@@H](NCc2oc(C)nc2C)C12CCC2	ZINC001202987812	1369946548	/nfs/dbraw/zinc/94/65/48/1369946548.db2.gz	OUOVYFCEMUCNMC-SJORKVTESA-N	0	3	331.460	3.165	20	30		EGEDHN
CCC(CC)CC(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001203085511	1369977698	/nfs/dbraw/zinc/97/76/98/1369977698.db2.gz	LPOFTCUJIJYAGE-UHFFFAOYSA-N	0	3	327.472	3.465	20	30		EGEDHN
C=C(Br)CNC1CCN(C(=O)[C@@H](C)CC(C)C)CC1	ZINC001203107316	1369985349	/nfs/dbraw/zinc/98/53/49/1369985349.db2.gz	DMMVCJJDWRIXLU-LBPRGKRZSA-N	0	3	331.298	3.158	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)CCc2cncc(C)c2)C12CCC2	ZINC001203161506	1370005447	/nfs/dbraw/zinc/00/54/47/1370005447.db2.gz	RITACRFZDWXXGQ-DLBZAZTESA-N	0	3	347.890	3.092	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1[C@H]2CN([C@@H](C)c3cccc(OC)c3)C[C@H]21	ZINC001114686983	1370025003	/nfs/dbraw/zinc/02/50/03/1370025003.db2.gz	VOMIEDGIVMHGPI-VIBAHUMZSA-N	0	3	328.456	3.015	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1C[C@H](NCc2ccccn2)C12CCC2	ZINC001203259979	1370047467	/nfs/dbraw/zinc/04/74/67/1370047467.db2.gz	ZMDFSTRQPUQERC-IRXDYDNUSA-N	0	3	327.472	3.201	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001203275444	1370055863	/nfs/dbraw/zinc/05/58/63/1370055863.db2.gz	UWSJAHGVRBRRPM-RTBURBONSA-N	0	3	336.479	3.267	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1C[C@H](NCc2c(C)onc2CC)C12CCC2	ZINC001203341132	1370089898	/nfs/dbraw/zinc/08/98/98/1370089898.db2.gz	OPFLTNPJEWCHLS-ZWKOTPCHSA-N	0	3	345.487	3.419	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2C[C@@H](NCc3cnc(C)o3)C23CCC3)CCC1	ZINC001203368113	1370101946	/nfs/dbraw/zinc/10/19/46/1370101946.db2.gz	YQKQLQWAPXURTH-IAGOWNOFSA-N	0	3	343.471	3.246	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CC[N@@H+](Cc3ccccc3[O-])C2)C1	ZINC001203550065	1370166213	/nfs/dbraw/zinc/16/62/13/1370166213.db2.gz	GQCKUYDNOYOTJT-IBGZPJMESA-N	0	3	330.428	3.003	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CC[N@H+](Cc3ccccc3[O-])C2)C1	ZINC001203550065	1370166214	/nfs/dbraw/zinc/16/62/14/1370166214.db2.gz	GQCKUYDNOYOTJT-IBGZPJMESA-N	0	3	330.428	3.003	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)C(C)(C)C(F)(F)F)C12CCC2	ZINC001203642187	1370198800	/nfs/dbraw/zinc/19/88/00/1370198800.db2.gz	XAEUQKWTCBSUDW-WDEREUQCSA-N	0	3	338.801	3.344	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)CC#Cc2ccccc2)C12CCC2	ZINC001203762892	1370254368	/nfs/dbraw/zinc/25/43/68/1370254368.db2.gz	VABGXRGZJFYWBS-ZWKOTPCHSA-N	0	3	342.870	3.198	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCCN(Cc2cccc(C#N)c2)CCC1	ZINC001203763759	1370255402	/nfs/dbraw/zinc/25/54/02/1370255402.db2.gz	KELRXTIOWSDPQQ-UHFFFAOYSA-N	0	3	329.444	3.391	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CCN(Cc3cccc(F)c3)C2)C1	ZINC001203784064	1370262137	/nfs/dbraw/zinc/26/21/37/1370262137.db2.gz	BZUSBDUYSWHECX-LJQANCHMSA-N	0	3	332.419	3.436	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@]3(C[C@@H](Oc4ccccn4)CO3)C2)cc1	ZINC001203904136	1370308590	/nfs/dbraw/zinc/30/85/90/1370308590.db2.gz	XRXJSRBKBQGQNK-TZIWHRDSSA-N	0	3	349.434	3.156	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H]2CN(Cc3cc(C)ccc3OC)C[C@H]21	ZINC001187208356	1388071961	/nfs/dbraw/zinc/07/19/61/1388071961.db2.gz	FYEUIQSXSMEVJZ-FUHWJXTLSA-N	0	3	328.456	3.003	20	30		EGEDHN
O=C(CC1CC1)NCC1(NCC#Cc2ccc(F)cc2)CCCCC1	ZINC001115378039	1370418000	/nfs/dbraw/zinc/41/80/00/1370418000.db2.gz	QSSRAZZIOAQVAY-UHFFFAOYSA-N	0	3	342.458	3.386	20	30		EGEDHN
C=CCOc1ccc(CN2CCCN(c3ccc(C#N)cn3)CC2)cc1	ZINC001204299938	1370436697	/nfs/dbraw/zinc/43/66/97/1370436697.db2.gz	FNZTZTCTBLDZJV-UHFFFAOYSA-N	0	3	348.450	3.230	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cc(C)sn2)CCCCC1	ZINC001115508979	1370507812	/nfs/dbraw/zinc/50/78/12/1370507812.db2.gz	LNJBZQFBSUOSOK-UHFFFAOYSA-N	0	3	327.881	3.226	20	30		EGEDHN
COc1ccc(Nc2cccc(CN3CCN(C)CC3)c2)cc1C#N	ZINC001204537268	1370508499	/nfs/dbraw/zinc/50/84/99/1370508499.db2.gz	HLLDETJSABSPNY-UHFFFAOYSA-N	0	3	336.439	3.058	20	30		EGEDHN
C=CCCC(=O)N1CCC(CNCc2oc(CCC)nc2C)CC1	ZINC001204749015	1370564188	/nfs/dbraw/zinc/56/41/88/1370564188.db2.gz	XKDLHYWGUFLKFX-UHFFFAOYSA-N	0	3	333.476	3.230	20	30		EGEDHN
COc1ccc(Nc2ccc(CN3CCN(C)CC3)cc2)cc1C#N	ZINC001204747316	1370564545	/nfs/dbraw/zinc/56/45/45/1370564545.db2.gz	RADMDJFJIDAFAY-UHFFFAOYSA-N	0	3	336.439	3.058	20	30		EGEDHN
CN1CCN(Cc2ccc(Nc3cc(F)cc(F)c3C#N)cc2)CC1	ZINC001204765228	1370570522	/nfs/dbraw/zinc/57/05/22/1370570522.db2.gz	CAYORRRKEPVNIU-UHFFFAOYSA-N	0	3	342.393	3.327	20	30		EGEDHN
C#CCCCCC(=O)N1CCC(CNCc2c(F)cccc2F)CC1	ZINC001205027395	1370632617	/nfs/dbraw/zinc/63/26/17/1370632617.db2.gz	PFFLBZWJIKGJSA-UHFFFAOYSA-N	0	3	348.437	3.487	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCC1(NCc2ccccn2)CCCCC1	ZINC001115678499	1370661032	/nfs/dbraw/zinc/66/10/32/1370661032.db2.gz	JBZDPDYWJWTHOA-DLBZAZTESA-N	0	3	329.488	3.449	20	30		EGEDHN
CC(C)[C@H](F)C(=O)NCC1(NCC#Cc2ccccc2)CCCCC1	ZINC001115679279	1370661812	/nfs/dbraw/zinc/66/18/12/1370661812.db2.gz	ZHHRIGBXTZIIDW-IBGZPJMESA-N	0	3	344.474	3.441	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCC1(NCc2nccnc2C)CCCCC1	ZINC001115679619	1370663139	/nfs/dbraw/zinc/66/31/39/1370663139.db2.gz	KMGJUHWZZOHNRS-HOTGVXAUSA-N	0	3	344.503	3.152	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCC1(NCc2cc(C)ncn2)CCCCC1	ZINC001115679891	1370663149	/nfs/dbraw/zinc/66/31/49/1370663149.db2.gz	RBINYYIJJJYIIR-WBVHZDCISA-N	0	3	344.503	3.152	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N(Cc1ccccc1)[C@@H]1CN(CCC)C[C@H]1O	ZINC001205175250	1370671375	/nfs/dbraw/zinc/67/13/75/1370671375.db2.gz	RRMZRQQYHUZWHS-MISYRCLQSA-N	0	3	344.499	3.073	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC(CNCc2cc(O)ccc2Cl)CC1	ZINC001205217553	1370684452	/nfs/dbraw/zinc/68/44/52/1370684452.db2.gz	FSOXFRWBUSECPD-UHFFFAOYSA-N	0	3	348.874	3.033	20	30		EGEDHN
C[C@H]1C[C@@H]1CC(=O)NCC1(NCC#Cc2ccccc2)CCCCC1	ZINC001115710437	1370689249	/nfs/dbraw/zinc/68/92/49/1370689249.db2.gz	KUCAMDIGEYKLMV-AZUAARDMSA-N	0	3	338.495	3.493	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CCc2cc(C)on2)CCCCC1	ZINC001115725118	1370705449	/nfs/dbraw/zinc/70/54/49/1370705449.db2.gz	LEPQFMRNXUXDLW-UHFFFAOYSA-N	0	3	339.867	3.077	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC(CNCc2nccs2)CC1	ZINC001205384263	1370737802	/nfs/dbraw/zinc/73/78/02/1370737802.db2.gz	KJVZJHJYMSPUKO-UHFFFAOYSA-N	0	3	333.501	3.240	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC(CNCc2ccccc2C#N)CC1	ZINC001205394891	1370742221	/nfs/dbraw/zinc/74/22/21/1370742221.db2.gz	CIYVRKUAPIWCIE-UHFFFAOYSA-N	0	3	339.483	3.489	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C=C(CC)CC)C[C@H]1c1cccc(F)c1	ZINC001205398321	1370743939	/nfs/dbraw/zinc/74/39/39/1370743939.db2.gz	DZDVJDKSVIELFS-RBUKOAKNSA-N	0	3	328.431	3.089	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC(CNCc2csc(CC)n2)CC1	ZINC001205407498	1370746537	/nfs/dbraw/zinc/74/65/37/1370746537.db2.gz	OIIOPBGYPYNXLQ-UHFFFAOYSA-N	0	3	335.517	3.390	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cccc3[nH]cnc32)CCCCC1	ZINC001115785660	1370768265	/nfs/dbraw/zinc/76/82/65/1370768265.db2.gz	JPFKGMYOFPGREF-UHFFFAOYSA-N	0	3	346.862	3.338	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)N1CCC(CNCc2oc(C)nc2C)CC1	ZINC001205953904	1370921292	/nfs/dbraw/zinc/92/12/92/1370921292.db2.gz	AZUDFJYCERNLBO-KBPBESRZSA-N	0	3	333.476	3.078	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)N1CCC(CNCc2csc(C)n2)CC1	ZINC001205961506	1370923990	/nfs/dbraw/zinc/92/39/90/1370923990.db2.gz	YRSJSSQJJWYJDJ-UONOGXRCSA-N	0	3	335.517	3.238	20	30		EGEDHN
CC#CCCCC(=O)N1CCC(CNC/C(Cl)=C\Cl)CC1	ZINC001205970211	1370925148	/nfs/dbraw/zinc/92/51/48/1370925148.db2.gz	MXPVACDBPMZXOK-RVDMUPIBSA-N	0	3	331.287	3.327	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC(CNCc2nc(C)cs2)CC1	ZINC001205981052	1370928258	/nfs/dbraw/zinc/92/82/58/1370928258.db2.gz	JWOLNVZZMZBYTI-AWEZNQCLSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC(CNCc2nc(C)cs2)CC1	ZINC001205988611	1370931019	/nfs/dbraw/zinc/93/10/19/1370931019.db2.gz	ISUKYFPCEDHJEL-HNNXBMFYSA-N	0	3	335.517	3.382	20	30		EGEDHN
Cc1cc([C@@H](C)NC[C@@H](O)COc2ccc(CC#N)cc2)c(C)o1	ZINC001326148448	1388119422	/nfs/dbraw/zinc/11/94/22/1388119422.db2.gz	ZSQMKPZKPVLLAM-RHSMWYFYSA-N	0	3	328.412	3.053	20	30		EGEDHN
C[C@@H]1[C@@H](CNC(=O)OC(C)(C)C)CCCN1Cc1cc(C#N)n(C)c1	ZINC001207103050	1371294734	/nfs/dbraw/zinc/29/47/34/1371294734.db2.gz	KTJXQXAFISAMTI-GDBMZVCRSA-N	0	3	346.475	3.022	20	30		EGEDHN
CCCCCCC(=O)N1CC[C@@H](NCc2ccc(OC)c(C#N)c2)C1	ZINC001187581122	1388127509	/nfs/dbraw/zinc/12/75/09/1388127509.db2.gz	HDTXZWJARUCRDM-GOSISDBHSA-N	0	3	343.471	3.228	20	30		EGEDHN
O=C([C@H]1CC=CCC1)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207257997	1371342651	/nfs/dbraw/zinc/34/26/51/1371342651.db2.gz	CCIMFVHXCHCYSL-AZUAARDMSA-N	0	3	340.442	3.114	20	30		EGEDHN
O=C(c1ccoc1)N1CCC[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207277602	1371347706	/nfs/dbraw/zinc/34/77/06/1371347706.db2.gz	UINSANXFBPHQGD-SFHVURJKSA-N	0	3	342.826	3.179	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC[C@@H](NCC#Cc2ccccc2Cl)C1	ZINC001207363016	1371374764	/nfs/dbraw/zinc/37/47/64/1371374764.db2.gz	KTPZJJFVGFGKIG-NVXWUHKLSA-N	0	3	332.875	3.318	20	30		EGEDHN
C=CCOC(=O)N[C@H]1CCCN(CCCc2ccc(OC)cc2)C1	ZINC001207585379	1371443451	/nfs/dbraw/zinc/44/34/51/1371443451.db2.gz	UFVAXUSGJFUQTA-KRWDZBQOSA-N	0	3	332.444	3.004	20	30		EGEDHN
CC(C)[C@H](C)CC(=O)N1CCC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001207646362	1371462956	/nfs/dbraw/zinc/46/29/56/1371462956.db2.gz	SPCUWORJOITGTL-CRAIPNDOSA-N	0	3	345.462	3.460	20	30		EGEDHN
O=C(/C=C\C1CC1)N1CCC[C@@H](NCC#Cc2ccccc2Cl)C1	ZINC001207742623	1371490721	/nfs/dbraw/zinc/49/07/21/1371490721.db2.gz	VZIOJUQKVXMJQP-YUIUBULTSA-N	0	3	342.870	3.238	20	30		EGEDHN
CC1CC(C(=O)N2CCC[C@H](NCC#Cc3cccc(Cl)c3)C2)C1	ZINC001207782363	1371502023	/nfs/dbraw/zinc/50/20/23/1371502023.db2.gz	DDQAGLNITBBVED-KVWWFHCMSA-N	0	3	344.886	3.318	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC2(CC(CN3CC(CC#N)C3)C2)CC1	ZINC001207803318	1371508780	/nfs/dbraw/zinc/50/87/80/1371508780.db2.gz	WNMOTRDFICKXTE-UHFFFAOYSA-N	0	3	333.476	3.259	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N1CCC[C@@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207818952	1371512151	/nfs/dbraw/zinc/51/21/51/1371512151.db2.gz	CTHGZBOUUGNBJP-MSOLQXFVSA-N	0	3	344.886	3.318	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)CCSC)C1	ZINC001120320378	1371532717	/nfs/dbraw/zinc/53/27/17/1371532717.db2.gz	OCAKBKPNKCFDGS-CABCVRRESA-N	0	3	330.925	3.195	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H]([C@H]2CCCN2Cc2ccns2)C1	ZINC001120382764	1371554962	/nfs/dbraw/zinc/55/49/62/1371554962.db2.gz	RERHUTPECZVOFH-SJLPKXTDSA-N	0	3	345.512	3.150	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC[C@@H](NCc2cccc(Cl)c2F)C1	ZINC001207995979	1371562442	/nfs/dbraw/zinc/56/24/42/1371562442.db2.gz	VSKWJQDLSYKETR-OAHLLOKOSA-N	0	3	336.838	3.219	20	30		EGEDHN
Cc1ccc(CN[C@H]2CCCN(C(=O)C#CC(C)C)C2)c(Cl)c1	ZINC001208005325	1371566041	/nfs/dbraw/zinc/56/60/41/1371566041.db2.gz	CMARIOBSKNAODQ-KRWDZBQOSA-N	0	3	332.875	3.388	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H]2CN(Cc3ccc4c(c3)CCC4)C[C@H]21	ZINC001187706169	1388146830	/nfs/dbraw/zinc/14/68/30/1388146830.db2.gz	GEZWKKHJRISFEO-LEWJYISDSA-N	0	3	336.479	3.012	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N[C@@H]1CN(Cc2cccc(C)c2)C[C@H]1C	ZINC001208129411	1371603655	/nfs/dbraw/zinc/60/36/55/1371603655.db2.gz	UZFZUJWLAFXCPG-YFVAEKQCSA-N	0	3	344.499	3.160	20	30		EGEDHN
C=C(C)[C@@H]1CC=C(CN2CC[C@@H](Oc3nccc(OC)n3)C2)CC1	ZINC001208178460	1371620819	/nfs/dbraw/zinc/62/08/19/1371620819.db2.gz	FOSSLZRNBFOQKI-IAGOWNOFSA-N	0	3	329.444	3.241	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001208255718	1371686030	/nfs/dbraw/zinc/68/60/30/1371686030.db2.gz	POIKHFKHMSGTSF-KRWDZBQOSA-N	0	3	329.419	3.134	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CN(Cc2cccc(N(C)C)c2)C[C@H]1C	ZINC001208292358	1371703248	/nfs/dbraw/zinc/70/32/48/1371703248.db2.gz	SQZRNGKYLQTTPN-VQIMIIECSA-N	0	3	343.515	3.291	20	30		EGEDHN
O=C([C@H]1CCC(F)(F)C1)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001208296093	1371705058	/nfs/dbraw/zinc/70/50/58/1371705058.db2.gz	LWWMDXGUEIMYJP-ZWKOTPCHSA-N	0	3	346.421	3.054	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1CN(Cc2cccc(OC)c2)C[C@H]1C	ZINC001208315239	1371712822	/nfs/dbraw/zinc/71/28/22/1371712822.db2.gz	QAEDTSKKRAENKH-YLJYHZDGSA-N	0	3	342.483	3.215	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCC[C@H](NCC=C(Cl)Cl)C1	ZINC001208337545	1371723951	/nfs/dbraw/zinc/72/39/51/1371723951.db2.gz	MBVAGTFZOXXJOX-ZDUSSCGKSA-N	0	3	342.270	3.187	20	30		EGEDHN
C[C@@H]1[C@H](NC(=O)OC(C)(C)C)CCCN1CCc1ccc(C#N)cc1	ZINC001208928440	1371948139	/nfs/dbraw/zinc/94/81/39/1371948139.db2.gz	CEUHILRZIGRCEF-CRAIPNDOSA-N	0	3	343.471	3.478	20	30		EGEDHN
N#Cc1ccc(CCN2CCCN(C(=O)C3CCCCC3)CC2)cc1	ZINC001208928507	1371948180	/nfs/dbraw/zinc/94/81/80/1371948180.db2.gz	FRFCMFYXHLCSNL-UHFFFAOYSA-N	0	3	339.483	3.215	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CN(CCOc2ccccc2C)C[C@H]1C	ZINC001208954779	1371962415	/nfs/dbraw/zinc/96/24/15/1371962415.db2.gz	SPHUASPOQWADNG-QZTJIDSGSA-N	0	3	344.499	3.413	20	30		EGEDHN
CC1(C)CCC[C@@H]1C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001209061865	1371987761	/nfs/dbraw/zinc/98/77/61/1371987761.db2.gz	USXZIFFNGSGNQE-WOJBJXKFSA-N	0	3	338.495	3.445	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)[C@H](CC)CC2CCCC2)C1	ZINC001209126183	1372005637	/nfs/dbraw/zinc/00/56/37/1372005637.db2.gz	ZCUTVDKLZJIBDZ-BHIYHBOVSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCCCN1CCC[C@@]2(CC(C(=O)Nc3ccccc3)=NO2)C1	ZINC001209162163	1372019986	/nfs/dbraw/zinc/01/99/86/1372019986.db2.gz	SWOJSSIQWXKHMW-LJQANCHMSA-N	0	3	327.428	3.202	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC1CC2(CC(NCc3conc3CC)C2)C1	ZINC001121610205	1372023963	/nfs/dbraw/zinc/02/39/63/1372023963.db2.gz	JBNBFUXTBVGSJQ-IRRXANFSSA-N	0	3	345.487	3.356	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC1CC2(CC(NCc3cc(C)no3)C2)C1	ZINC001121616359	1372026009	/nfs/dbraw/zinc/02/60/09/1372026009.db2.gz	ILDQIAGWKBPCKJ-PXLHRZOGSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC1CC2(CC(NCc3oc(C)nc3C)C2)C1	ZINC001121616364	1372026158	/nfs/dbraw/zinc/02/61/58/1372026158.db2.gz	INNWFMFYORLUCY-AKJOHPPZSA-N	0	3	345.487	3.411	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC1CC2(CC(NCc3nccs3)C2)C1	ZINC001121616621	1372026776	/nfs/dbraw/zinc/02/67/76/1372026776.db2.gz	NBPUZEIBZIVAHY-OQDWRCPYSA-N	0	3	333.501	3.262	20	30		EGEDHN
C=CCCC1(C(=O)NC2CC3(CC(NCc4nccs4)C3)C2)CC1	ZINC001121709134	1372054694	/nfs/dbraw/zinc/05/46/94/1372054694.db2.gz	TWTBIIJUGMWSJZ-UHFFFAOYSA-N	0	3	345.512	3.407	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC1CC2(CC(NCc3nccs3)C2)C1	ZINC001121713211	1372056309	/nfs/dbraw/zinc/05/63/09/1372056309.db2.gz	DMVMIJLSRCDXQN-WCNMNQKQSA-N	0	3	333.501	3.262	20	30		EGEDHN
C=C(Br)CNC1CC2(C1)CC(NC(=O)C1(CC)CC1)C2	ZINC001121717891	1372058184	/nfs/dbraw/zinc/05/81/84/1372058184.db2.gz	JWWHBFHMGWWJBZ-UHFFFAOYSA-N	0	3	341.293	3.102	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)C(C)(C)C2CCCCC2)C1	ZINC001209291945	1372058808	/nfs/dbraw/zinc/05/88/08/1372058808.db2.gz	KDXWLHRCZDRXDN-SJLPKXTDSA-N	0	3	336.520	3.232	20	30		EGEDHN
CCCC(C)(C)C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001209355757	1372076673	/nfs/dbraw/zinc/07/66/73/1372076673.db2.gz	LCXHZGMMSLNVJU-LJQANCHMSA-N	0	3	326.484	3.445	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N1CCc2c(Br)cccc2C1	ZINC001121944440	1372130051	/nfs/dbraw/zinc/13/00/51/1372130051.db2.gz	PCDAIXLOSAXDHO-HNNXBMFYSA-N	0	3	337.261	3.017	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)c2cccc3ccsc32)C1	ZINC001210002268	1372252255	/nfs/dbraw/zinc/25/22/55/1372252255.db2.gz	RQANHLURDIZPFK-RHSMWYFYSA-N	0	3	344.480	3.154	20	30		EGEDHN
CC(C)C[C@@H](C)C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001210357386	1372331341	/nfs/dbraw/zinc/33/13/41/1372331341.db2.gz	AVBOVQTZKFGRDK-QUCCMNQESA-N	0	3	326.484	3.301	20	30		EGEDHN
CC(C)C[C@H](C)C(=O)N1CCC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001210358749	1372332200	/nfs/dbraw/zinc/33/22/00/1372332200.db2.gz	NXIVEKXRQBSNBX-MAUKXSAKSA-N	0	3	345.462	3.460	20	30		EGEDHN
CCC[C@@H](CC)C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001210378064	1372337447	/nfs/dbraw/zinc/33/74/47/1372337447.db2.gz	QDNHKPCNXQGNJR-WOJBJXKFSA-N	0	3	326.484	3.445	20	30		EGEDHN
CN(c1ccc(C#N)cc1)c1ccc(CN2CCNC[C@H](F)C2)cc1	ZINC001210581562	1372384471	/nfs/dbraw/zinc/38/44/71/1372384471.db2.gz	RGGJXEXYGPTMSN-SFHVURJKSA-N	0	3	338.430	3.069	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)COc2ccccc2C(C)C)C1	ZINC001210843439	1372438765	/nfs/dbraw/zinc/43/87/65/1372438765.db2.gz	VHRAEUDUUJCFPK-SJLPKXTDSA-N	0	3	330.472	3.201	20	30		EGEDHN
C=C(CN1CCCCC1)c1nc(-c2cc(OC)c(OC)cc2F)no1	ZINC001211436825	1372558459	/nfs/dbraw/zinc/55/84/59/1372558459.db2.gz	ZMJUNHOJCWIBRR-UHFFFAOYSA-N	0	3	347.390	3.392	20	30		EGEDHN
C=C(CN1CCCCC1)c1nc(-c2ccc(OC)c(OC)c2)no1	ZINC001211436451	1372559052	/nfs/dbraw/zinc/55/90/52/1372559052.db2.gz	LSPBDVXIARXSNS-UHFFFAOYSA-N	0	3	329.400	3.253	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CCOCCCC)C[C@H]2C)CCCC1	ZINC001211495698	1372568730	/nfs/dbraw/zinc/56/87/30/1372568730.db2.gz	UAXKCRFVHMCJDC-QZTJIDSGSA-N	0	3	336.520	3.376	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](c2ccccc2)[C@H](NC[C@@H](F)CC)C1	ZINC001211590871	1372587342	/nfs/dbraw/zinc/58/73/42/1372587342.db2.gz	WHNLIACUEKYJAH-GBESFXJTSA-N	0	3	330.447	3.122	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C[C@@H]2C=CCCC2)C[C@H]1c1ccccc1	ZINC001211622304	1372591701	/nfs/dbraw/zinc/59/17/01/1372591701.db2.gz	OCYWRJVZGSUTKX-HLAWJBBLSA-N	0	3	336.479	3.340	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)C2C(C)(C)C2(C)C)[C@H](OC)C1	ZINC001212073528	1372653442	/nfs/dbraw/zinc/65/34/42/1372653442.db2.gz	DXQFJJGFTAGCIP-HZPDHXFCSA-N	0	3	336.520	3.230	20	30		EGEDHN
CCCCCCCC[C@H](C)C(=O)N1CC[C@@H](NCc2ccnn2C)C1	ZINC001188016249	1388215137	/nfs/dbraw/zinc/21/51/37/1388215137.db2.gz	VIWTXOXFYSSJIO-ZWKOTPCHSA-N	0	3	348.535	3.497	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@@]2(C)CC=CCC2)[C@H](OC)C1	ZINC001212316843	1372684963	/nfs/dbraw/zinc/68/49/63/1372684963.db2.gz	XIOXSPWHZPZLPR-GGPKGHCWSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1CN(CCC2=CCCCC2)C[C@H]1OC	ZINC001212320981	1372685603	/nfs/dbraw/zinc/68/56/03/1372685603.db2.gz	MGZLOENEMQJWMQ-WOJBJXKFSA-N	0	3	346.515	3.461	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2c(C)oc(C)c2C)[C@H](OC)C1	ZINC001213141610	1372848219	/nfs/dbraw/zinc/84/82/19/1372848219.db2.gz	XOPDVFFHPCTHGF-QZTJIDSGSA-N	0	3	348.487	3.380	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN(CC/C=C/c2ccccc2)C[C@H]1OC	ZINC001213356881	1372890481	/nfs/dbraw/zinc/89/04/81/1372890481.db2.gz	CUNYAMDPAAIPBI-LRHIHOEBSA-N	0	3	342.483	3.262	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CN(CC/C=C/CCC)C[C@H]2OC)CC1	ZINC001213379677	1372896013	/nfs/dbraw/zinc/89/60/13/1372896013.db2.gz	BLTRCKVVYMDIEP-LXORQPIJSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@H]2CC[C@H](C)CC2)[C@H](OC)C1	ZINC001213745021	1372955180	/nfs/dbraw/zinc/95/51/80/1372955180.db2.gz	USQCSAIPFVUFQN-NCXUSEDFSA-N	0	3	336.520	3.375	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)C(C)(C)C(C)(F)F)[C@H](OC)C1	ZINC001213792791	1372962438	/nfs/dbraw/zinc/96/24/38/1372962438.db2.gz	SWMNZYSHYWMAET-HUUCEWRRSA-N	0	3	348.478	3.454	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2oc3ccccc3c2C)[C@H](OC)C1	ZINC001213814928	1372965387	/nfs/dbraw/zinc/96/53/87/1372965387.db2.gz	WIMQCZFKIXSPBU-SJLPKXTDSA-N	0	3	342.439	3.136	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CCC(=C)C)C[C@H]2OC)CCCCC1	ZINC001213903398	1372978411	/nfs/dbraw/zinc/97/84/11/1372978411.db2.gz	UUHTWDQBOWINIR-QZTJIDSGSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@@H]2CC3CCC2CC3)[C@H](OC)C1	ZINC001213929647	1372981380	/nfs/dbraw/zinc/98/13/80/1372981380.db2.gz	FQDRXBZYOMRWDW-WFAGLZIHSA-N	0	3	348.531	3.375	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CC/C=C\CC)C[C@H]2OC)CCCC1	ZINC001214003987	1372993254	/nfs/dbraw/zinc/99/32/54/1372993254.db2.gz	FICVKTAQORYRJY-XXCOWLKOSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CCC[C@@H](C(=O)N[C@@H]1CN(CCCC)C[C@H]1OC)c1ccccc1	ZINC001214001744	1372993325	/nfs/dbraw/zinc/99/33/25/1372993325.db2.gz	GMGIBRNLKPUIQV-VAMGGRTRSA-N	0	3	344.499	3.352	20	30		EGEDHN
O=C(C#CC1CC1)NCCNCc1cccc(Oc2ccccc2)c1	ZINC001126875660	1373044795	/nfs/dbraw/zinc/04/47/95/1373044795.db2.gz	JIWOCQYOBNJNQC-UHFFFAOYSA-N	0	3	334.419	3.098	20	30		EGEDHN
O=C(C#CC1CC1)NCCN[C@H]1CCc2c1cc(Cl)cc2Cl	ZINC001126875798	1373045123	/nfs/dbraw/zinc/04/51/23/1373045123.db2.gz	NUFDUMFYCSDMQD-INIZCTEOSA-N	0	3	337.250	3.100	20	30		EGEDHN
CCCC[C@@H](C)C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001214550751	1373078707	/nfs/dbraw/zinc/07/87/07/1373078707.db2.gz	QPCXFZQADHPBDE-SPYBWZPUSA-N	0	3	345.462	3.460	20	30		EGEDHN
CCC(C)(C)CC(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001214710996	1373107103	/nfs/dbraw/zinc/10/71/03/1373107103.db2.gz	YZHTVAGOZOMJCZ-RDTXWAMCSA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@@H](C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2)C1)C(C)(C)C	ZINC001214967341	1373149514	/nfs/dbraw/zinc/14/95/14/1373149514.db2.gz	XIDVBZNRQZZGLF-ZIFCJYIRSA-N	0	3	326.484	3.157	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)[C@H](C)C(CC)CC)C1	ZINC001130402109	1373521115	/nfs/dbraw/zinc/52/11/15/1373521115.db2.gz	WCBMUGXCMDBDTE-GDBMZVCRSA-N	0	3	332.492	3.074	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCO[C@@H]2CN(CC/C=C\CCC)C[C@@H]21	ZINC001217988758	1373528395	/nfs/dbraw/zinc/52/83/95/1373528395.db2.gz	XUGGDNSXBNOBRQ-MITRTKIPSA-N	0	3	346.515	3.413	20	30		EGEDHN
COc1ccccc1/C=C\C(=O)c1ccccc1O[C@H]1CNC[C@@H]1F	ZINC001218016825	1373538134	/nfs/dbraw/zinc/53/81/34/1373538134.db2.gz	JOAXNAUOPMUXCA-PLWNRMESSA-N	0	3	341.382	3.280	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCO[C@@H]2CN(CCCC3CCC3)C[C@@H]21	ZINC001218023415	1373540685	/nfs/dbraw/zinc/54/06/85/1373540685.db2.gz	SHQJOPYSSYVAQO-ZWKOTPCHSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)CCC2CCCCC2)C1	ZINC001130442645	1373541998	/nfs/dbraw/zinc/54/19/98/1373541998.db2.gz	NOURFJMWKJRDSX-QGZVFWFLSA-N	0	3	344.503	3.362	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cc3ccccc3s2)s1	ZINC001130923908	1373609199	/nfs/dbraw/zinc/60/91/99/1373609199.db2.gz	DEXFBUYLAGTMTE-UHFFFAOYSA-N	0	3	341.461	3.354	20	30		EGEDHN
C=CC[C@H](Oc1ccc(C[C@H](N)C(N)=O)cc1)c1ccc(Cl)cc1	ZINC001218443186	1373613173	/nfs/dbraw/zinc/61/31/73/1373613173.db2.gz	RGLYOWCMABHBEA-ROUUACIJSA-N	0	3	344.842	3.391	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2OCCN(C(=O)c3ccc(F)c(C)c3)[C@H]2C1	ZINC001218558127	1373632574	/nfs/dbraw/zinc/63/25/74/1373632574.db2.gz	UXKBVNATMMQPIQ-AYOQOUSVSA-N	0	3	346.446	3.014	20	30		EGEDHN
CC(C)(C)n1cc(C#N)cc1NC(=O)C[C@@H]1Cc2ccccc2CN1	ZINC001218561388	1373632881	/nfs/dbraw/zinc/63/28/81/1373632881.db2.gz	ZCINDJJHYYDLQR-KRWDZBQOSA-N	0	3	336.439	3.158	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)Nc1cccc(-c2cccc(N)n2)n1	ZINC001218559437	1373633066	/nfs/dbraw/zinc/63/30/66/1373633066.db2.gz	OTUSRJYPYIIDBD-AWEZNQCLSA-N	0	3	339.443	3.128	20	30		EGEDHN
C=C[C@@H]1C[C@]1(N)C(=O)Nc1cc(C(C)(C)C)nn1-c1cccc(C)c1	ZINC001218678493	1373643437	/nfs/dbraw/zinc/64/34/37/1373643437.db2.gz	YTHJILIOAQPJKU-JLTOFOAXSA-N	0	3	338.455	3.320	20	30		EGEDHN
N#Cc1nc2ccc(NC(=O)C[C@@H]3Cc4ccccc4CN3)cc2s1	ZINC001218910449	1373666755	/nfs/dbraw/zinc/66/67/55/1373666755.db2.gz	LIDZCFQFKIFJFK-HNNXBMFYSA-N	0	3	348.431	3.211	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)Nc1cc(C(=O)OC)cc(C)c1C	ZINC001219402451	1373707120	/nfs/dbraw/zinc/70/71/20/1373707120.db2.gz	MBWZOHIDZKWVAJ-INIZCTEOSA-N	0	3	332.444	3.492	20	30		EGEDHN
CC(C)(C)CCN1CCN(C(=O)Nc2cc(F)cc(C#N)c2)CC1	ZINC001219797218	1373732359	/nfs/dbraw/zinc/73/23/59/1373732359.db2.gz	JEMSMTRNLLZANU-UHFFFAOYSA-N	0	3	332.423	3.283	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](C)O[C@]3(CCN(CC(=C)C)C3)C2)CCCC1	ZINC001131703569	1373772029	/nfs/dbraw/zinc/77/20/29/1373772029.db2.gz	DQTHHRUJVDWREV-NQIIRXRSSA-N	0	3	346.515	3.391	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)[C@@H]2CCCC[C@H]2C2CC2)s1	ZINC001131742037	1373780283	/nfs/dbraw/zinc/78/02/83/1373780283.db2.gz	PTTWEYFFJRZLEI-DLBZAZTESA-N	0	3	331.485	3.042	20	30		EGEDHN
CCCCCC(=O)NCC1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001222377595	1373828919	/nfs/dbraw/zinc/82/89/19/1373828919.db2.gz	UYBJFWAOATUETB-UHFFFAOYSA-N	0	3	327.472	3.467	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](NCc3cncc(F)c3)C2)CCCC1	ZINC001188490510	1388318579	/nfs/dbraw/zinc/31/85/79/1388318579.db2.gz	PVCGBSUVZAJXOF-QGZVFWFLSA-N	0	3	331.435	3.048	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC[C@H](C)N(CCc2ccc3c(c2)CCO3)C1	ZINC001131896928	1375033636	/nfs/dbraw/zinc/03/36/36/1375033636.db2.gz	XLWISOBUPMCPHW-LPHOPBHVSA-N	0	3	342.483	3.099	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCC1CCN(Cc2c(C)noc2CC)CC1	ZINC001224165181	1375057923	/nfs/dbraw/zinc/05/79/23/1375057923.db2.gz	HPQJVHPSEXXSLH-HUUCEWRRSA-N	0	3	347.503	3.332	20	30		EGEDHN
O=C(N[C@@H]1CCCC[C@H]1NCC#Cc1ccc(F)cc1)C1CCCC1	ZINC001224447083	1375067278	/nfs/dbraw/zinc/06/72/78/1375067278.db2.gz	PWDYERRGKGNZKD-WOJBJXKFSA-N	0	3	342.458	3.384	20	30		EGEDHN
C=CCCCCCN1C[C@H](NC(=O)c2cc(OC)no2)CC[C@@H]1C	ZINC001131979777	1375080822	/nfs/dbraw/zinc/08/08/22/1375080822.db2.gz	AXHYOACSHXPAKP-LSDHHAIUSA-N	0	3	335.448	3.012	20	30		EGEDHN
CCCSCC(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1	ZINC001225090657	1375092351	/nfs/dbraw/zinc/09/23/51/1375092351.db2.gz	IWEBRHIVLSYJQY-RTBURBONSA-N	0	3	344.524	3.198	20	30		EGEDHN
CCc1cccc(CN2C[C@H](NC(=O)C#CC(C)C)CC[C@@H]2C)c1	ZINC001132018283	1375100730	/nfs/dbraw/zinc/10/07/30/1375100730.db2.gz	WFRQUNAISYIIAW-FXAWDEMLSA-N	0	3	326.484	3.378	20	30		EGEDHN
C[C@@H]1CC[C@@H](NC(=O)C#CC2CC2)CN1Cc1ccc(C2CC2)cc1	ZINC001132033580	1375108712	/nfs/dbraw/zinc/10/87/12/1375108712.db2.gz	IJSXIJXFAPISJF-IIBYNOLFSA-N	0	3	336.479	3.447	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)COc2cccc(C(C)C)c2)CC[C@@H]1C	ZINC001132054060	1375120210	/nfs/dbraw/zinc/12/02/10/1375120210.db2.gz	JOLPLQCOJQKVFA-PKOBYXMFSA-N	0	3	342.483	3.181	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1CC[C@@H](C)N(CCOCC2CC2)C1	ZINC001132056661	1375121755	/nfs/dbraw/zinc/12/17/55/1375121755.db2.gz	BDXXFLCKLAUXBO-APWZRJJASA-N	0	3	334.504	3.151	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCOc2c(C)cccc2C)CC[C@@H]1C	ZINC001132098196	1375147322	/nfs/dbraw/zinc/14/73/22/1375147322.db2.gz	VKGMMTOAJSYVRH-ROUUACIJSA-N	0	3	330.472	3.227	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCc2nc3ccccc3[nH]2)CC[C@H]1C	ZINC001132159766	1375176972	/nfs/dbraw/zinc/17/69/72/1375176972.db2.gz	FMYIGKBZKKPYTI-CVEARBPZSA-N	0	3	340.471	3.041	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2nc3cnccc3s2)CC[C@H]1C	ZINC001132164885	1375180910	/nfs/dbraw/zinc/18/09/10/1375180910.db2.gz	LGTRYUSUQFWCQH-KGLIPLIRSA-N	0	3	344.484	3.240	20	30		EGEDHN
Cc1ncc(CN[C@@H]2CCCC[C@H]2NC(=O)C#CC(C)(C)C)s1	ZINC001226133915	1375209030	/nfs/dbraw/zinc/20/90/30/1375209030.db2.gz	LWAMRXNRLCAJNI-HZPDHXFCSA-N	0	3	333.501	3.018	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1CC[C@H](C)N(CCn2nc(C)cc2C)C1	ZINC001132218544	1375217202	/nfs/dbraw/zinc/21/72/02/1375217202.db2.gz	RMVKSEIQOZZPDT-WMZOPIPTSA-N	0	3	346.519	3.071	20	30		EGEDHN
CC/C=C(/C)C(=O)NC1CCN(Cc2ccc(OCC#N)cc2)CC1	ZINC001226369815	1375247862	/nfs/dbraw/zinc/24/78/62/1375247862.db2.gz	QZOPIUKZDAZZHD-XRVIQIRUSA-N	0	3	341.455	3.026	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2ccccc2CC)CC[C@H]1C	ZINC001132260049	1375252171	/nfs/dbraw/zinc/25/21/71/1375252171.db2.gz	AGRAXZXNCSNGEH-AEFFLSMTSA-N	0	3	330.472	3.034	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2CC[C@@H](C)N(CCOCC(C)C)C2)CC1	ZINC001132279064	1375263592	/nfs/dbraw/zinc/26/35/92/1375263592.db2.gz	UQOWZCGXNUTPNI-QZTJIDSGSA-N	0	3	336.520	3.375	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC1CCN([C@@H]2CCc3ccc(Cl)cc32)CC1	ZINC001226641286	1375298202	/nfs/dbraw/zinc/29/82/02/1375298202.db2.gz	XYEJFCHNGJWPPJ-YVEFUNNKSA-N	0	3	331.847	3.068	20	30		EGEDHN
Cc1cc(Cl)c(C(=O)NCCNCc2ccc(C#N)s2)cc1C	ZINC001132324065	1375303748	/nfs/dbraw/zinc/30/37/48/1375303748.db2.gz	UKKDVECQBVELFO-UHFFFAOYSA-N	0	3	347.871	3.410	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CC[C@@H](C)N(Cc2ccc(CO)cc2)C1	ZINC001132330278	1375309088	/nfs/dbraw/zinc/30/90/88/1375309088.db2.gz	DOKZNZDJCOIKKH-VQIMIIECSA-N	0	3	344.499	3.250	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCN(C)c2ccccc2)CC[C@@H]1C	ZINC001132365423	1375329638	/nfs/dbraw/zinc/32/96/38/1375329638.db2.gz	KCHFCMGXOYNWJQ-ROUUACIJSA-N	0	3	329.488	3.058	20	30		EGEDHN
C=CCCCN1C[C@H](NC(=O)c2snnc2C(C)C)CC[C@@H]1C	ZINC001132367949	1375331682	/nfs/dbraw/zinc/33/16/82/1375331682.db2.gz	GWGRXUINCNLCCB-UONOGXRCSA-N	0	3	336.505	3.210	20	30		EGEDHN
C#CCCCCCC(=O)NCCN[C@@H]1CCc2c1cc(F)cc2F	ZINC001132402728	1375355227	/nfs/dbraw/zinc/35/52/27/1375355227.db2.gz	XGZBPOMJTBFVIN-GOSISDBHSA-N	0	3	334.410	3.242	20	30		EGEDHN
CCCCCCCCCCC(=O)N[C@@H]1CC[C@@H](C)N(CCO)C1	ZINC001132435982	1375381383	/nfs/dbraw/zinc/38/13/83/1375381383.db2.gz	IJNMCQCVXVIZLU-QZTJIDSGSA-N	0	3	326.525	3.479	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2cc(C)ccc2C)CC[C@@H]1C	ZINC001132444725	1375387629	/nfs/dbraw/zinc/38/76/29/1375387629.db2.gz	FEZOHZALHBKFKL-ZWKOTPCHSA-N	0	3	330.472	3.089	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCOc2ccccc2OC)CC[C@@H]1C	ZINC001132472529	1375412851	/nfs/dbraw/zinc/41/28/51/1375412851.db2.gz	IJQBFBFFIZTUHS-IRXDYDNUSA-N	0	3	346.471	3.009	20	30		EGEDHN
C=CCCC(=O)N(Cc1ccccn1)[C@H]1CCCN(CC#CC)CC1	ZINC001132551036	1375456527	/nfs/dbraw/zinc/45/65/27/1375456527.db2.gz	AHHHZOBQAHGMNJ-FQEVSTJZSA-N	0	3	339.483	3.254	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](C)[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001132696241	1375518319	/nfs/dbraw/zinc/51/83/19/1375518319.db2.gz	IJCGILVGXOOUCW-YJBOKZPZSA-N	0	3	343.446	3.238	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](C)[C@H](CNCc2c(F)cccc2F)C1	ZINC001132786740	1375564927	/nfs/dbraw/zinc/56/49/27/1375564927.db2.gz	ZURTYMVJZKIVQO-HZPDHXFCSA-N	0	3	348.437	3.343	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC001228747448	1375659761	/nfs/dbraw/zinc/65/97/61/1375659761.db2.gz	AYMAXCXVQXFFAT-CVEARBPZSA-N	0	3	348.462	3.243	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NC1CCN(CCOc2ccccc2C)CC1	ZINC001228747475	1375660433	/nfs/dbraw/zinc/66/04/33/1375660433.db2.gz	BGOKCCNEODGCIE-FUHWJXTLSA-N	0	3	344.499	3.413	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC1CCN(CCOc2ccccc2)CC1	ZINC001228794812	1375679359	/nfs/dbraw/zinc/67/93/59/1375679359.db2.gz	NCEMYYPLURPTRC-KRWDZBQOSA-N	0	3	330.472	3.248	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC1CCN(C[C@@H](O)c2ccc(F)cc2)CC1	ZINC001228795170	1375679540	/nfs/dbraw/zinc/67/95/40/1375679540.db2.gz	RXGOBGUNMGPWAE-DNVCBOLYSA-N	0	3	348.462	3.042	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC001228809121	1375683643	/nfs/dbraw/zinc/68/36/43/1375683643.db2.gz	FIJPLTAWPGZVKW-MRXNPFEDSA-N	0	3	330.472	3.378	20	30		EGEDHN
COc1cc2c(Cl)c(C#N)cnc2cc1OC1CCN(C)CC1	ZINC001229112603	1375766191	/nfs/dbraw/zinc/76/61/91/1375766191.db2.gz	XKABZVPPRKKTOL-UHFFFAOYSA-N	0	3	331.803	3.241	20	30		EGEDHN
CCCc1ccc(C(=O)NCCNCc2ccc(C#N)c(F)c2)cc1	ZINC001133089211	1375767394	/nfs/dbraw/zinc/76/73/94/1375767394.db2.gz	AGCPXJMDSWKVDL-UHFFFAOYSA-N	0	3	339.414	3.169	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cc(F)c(Cl)cc2F)cc1	ZINC001133118705	1375785223	/nfs/dbraw/zinc/78/52/23/1375785223.db2.gz	RATGINRSAWPYAF-UHFFFAOYSA-N	0	3	349.768	3.009	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1ccns1	ZINC001133398080	1375981584	/nfs/dbraw/zinc/98/15/84/1375981584.db2.gz	CAKGKYWKYKKKIZ-UHFFFAOYSA-N	0	3	347.871	3.052	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1cc(C)co1	ZINC001133401330	1375984925	/nfs/dbraw/zinc/98/49/25/1375984925.db2.gz	AFDZLHGQPYBHLY-UHFFFAOYSA-N	0	3	344.842	3.497	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)C1(CF)CC1	ZINC001133403695	1375988357	/nfs/dbraw/zinc/98/83/57/1375988357.db2.gz	FBQWWDGZSMZFFP-UHFFFAOYSA-N	0	3	336.838	3.031	20	30		EGEDHN
C=CCCOCC(=O)NC1CCN([C@H](CC)c2ccc(F)cc2)CC1	ZINC001230411837	1376022441	/nfs/dbraw/zinc/02/24/41/1376022441.db2.gz	VGGUMQKANRXAOX-LJQANCHMSA-N	0	3	348.462	3.450	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)C1CCCC1)NCc1cc(F)ccc1C#N	ZINC001133464997	1376023517	/nfs/dbraw/zinc/02/35/17/1376023517.db2.gz	HUNANAPNJVWALP-ZIAGYGMSSA-N	0	3	331.435	3.260	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NC1CCN(Cc2ccc(C3CC3)cc2)CC1	ZINC001230414746	1376024247	/nfs/dbraw/zinc/02/42/47/1376024247.db2.gz	GDOZAWIKGAPEAL-INIZCTEOSA-N	0	3	342.483	3.236	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCNCc2cc(C(C)C)ccc2OC)C1	ZINC001133564104	1376091222	/nfs/dbraw/zinc/09/12/22/1376091222.db2.gz	JTMJECQPEWYSEM-UHFFFAOYSA-N	0	3	330.472	3.381	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)C1CCCCC1	ZINC001133590323	1376107940	/nfs/dbraw/zinc/10/79/40/1376107940.db2.gz	JEFGNGJDILZNAL-QWHCGFSZSA-N	0	3	331.298	3.348	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)CCc1ccco1)NCc1ccccc1C#N	ZINC001133648745	1376135797	/nfs/dbraw/zinc/13/57/97/1376135797.db2.gz	GCXQCKXKMNXQIU-HZPDHXFCSA-N	0	3	339.439	3.157	20	30		EGEDHN
C=C(C)CCC(=O)NCCCN(CCCOCC)Cc1cccnc1	ZINC001230771626	1376148588	/nfs/dbraw/zinc/14/85/88/1376148588.db2.gz	NVTCGUKDKQHUID-UHFFFAOYSA-N	0	3	347.503	3.173	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)[C@H]1CC[C@H](F)C1)Cc1cccnc1	ZINC001230824542	1376160681	/nfs/dbraw/zinc/16/06/81/1376160681.db2.gz	FHOIZXONGOIZKP-ROUUACIJSA-N	0	3	333.451	3.104	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCCN(CCCOC)Cc1cccnc1	ZINC001230859924	1376168141	/nfs/dbraw/zinc/16/81/41/1376168141.db2.gz	WLDUVDJJVAOZJN-UHFFFAOYSA-N	0	3	347.503	3.029	20	30		EGEDHN
C=CCCC(=O)N[C@@H](C)C[C@@H](C)NCc1ccn(-c2ccccc2)n1	ZINC001133884158	1376249480	/nfs/dbraw/zinc/24/94/80/1376249480.db2.gz	LZUOORPSRWWOBK-SJORKVTESA-N	0	3	340.471	3.211	20	30		EGEDHN
C=CCOCC(=O)N[C@H](C)C[C@@H](C)NCc1cccc(F)c1Cl	ZINC001133910058	1376261226	/nfs/dbraw/zinc/26/12/26/1376261226.db2.gz	VIYUPKGIQHLKLL-CHWSQXEVSA-N	0	3	342.842	3.055	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1cc(F)ccc1C#N)NC(=O)CCC1CC1	ZINC001133960862	1376285640	/nfs/dbraw/zinc/28/56/40/1376285640.db2.gz	SJMPFOKNOFIADO-UONOGXRCSA-N	0	3	331.435	3.260	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)CCC(F)(F)F	ZINC001134003336	1376306865	/nfs/dbraw/zinc/30/68/65/1376306865.db2.gz	IQRGHEUCCGJUSZ-UWVGGRQHSA-N	0	3	345.203	3.110	20	30		EGEDHN
C=CCOCCCC(=O)N[C@H](C)C[C@H](C)NC/C(Cl)=C/Cl	ZINC001134019123	1376315279	/nfs/dbraw/zinc/31/52/79/1376315279.db2.gz	RUKIKFMLSKRIPH-UDVMBWJESA-N	0	3	337.291	3.161	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)CCC1CCC1	ZINC001134036088	1376323424	/nfs/dbraw/zinc/32/34/24/1376323424.db2.gz	ZMTVSLQMSYOPFU-QWHCGFSZSA-N	0	3	331.298	3.348	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001134119148	1376376994	/nfs/dbraw/zinc/37/69/94/1376376994.db2.gz	MGPOJSGKVORBCG-IRXDYDNUSA-N	0	3	325.456	3.125	20	30		EGEDHN
C#CCCCC(=O)N[C@H](C)C[C@@H](C)NCc1ccn(C2CCCC2)n1	ZINC001134200909	1376415031	/nfs/dbraw/zinc/41/50/31/1376415031.db2.gz	JSGZAXBHRFNQNE-IAGOWNOFSA-N	0	3	344.503	3.175	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H](C)C[C@H](C)NCc2ccccc2C#N)ns1	ZINC001134214379	1376421463	/nfs/dbraw/zinc/42/14/63/1376421463.db2.gz	OSBGRUZLWPQDAQ-STQMWFEESA-N	0	3	342.468	3.010	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)c1ccoc1Cl	ZINC001134250794	1376434155	/nfs/dbraw/zinc/43/41/55/1376434155.db2.gz	AYJAKRGLDZEKNK-NXEZZACHSA-N	0	3	349.656	3.328	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H](C)C[C@@H](C)NCc1nc(C(C)(C)C)cs1	ZINC001134316850	1376471955	/nfs/dbraw/zinc/47/19/55/1376471955.db2.gz	BWOTZFFZAKIEQP-HUUCEWRRSA-N	0	3	349.544	3.473	20	30		EGEDHN
COc1cccc(Cl)c1CN[C@H](C)C[C@H](C)NC(=O)C#CC1CC1	ZINC001134322681	1376475146	/nfs/dbraw/zinc/47/51/46/1376475146.db2.gz	VJJKEPGOOXZJOB-KGLIPLIRSA-N	0	3	348.874	3.135	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H](C)C[C@H](C)NCc1nccn1C(F)F	ZINC001134448873	1376543295	/nfs/dbraw/zinc/54/32/95/1376543295.db2.gz	PUGSVXSGLGQCED-QWHCGFSZSA-N	0	3	342.434	3.253	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@H](C)C[C@@H](C)NCc1conc1CC	ZINC001134456763	1376547841	/nfs/dbraw/zinc/54/78/41/1376547841.db2.gz	CWQKILNYZLHRDE-VXGBXAGGSA-N	0	3	341.883	3.389	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H](C)C[C@H](C)NCc1csnc1OC	ZINC001134457710	1376548720	/nfs/dbraw/zinc/54/87/20/1376548720.db2.gz	SCDDDLZFVHOERC-QWHCGFSZSA-N	0	3	339.505	3.127	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)C1C=CC=CC=C1	ZINC001134476547	1376559754	/nfs/dbraw/zinc/55/97/54/1376559754.db2.gz	UAKDNVFDTYCKAM-UONOGXRCSA-N	0	3	339.277	3.066	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCC2(CCCN2c2ncccn2)CC1	ZINC001233080526	1376566631	/nfs/dbraw/zinc/56/66/31/1376566631.db2.gz	ZOOGLDWXAOXCEM-UHFFFAOYSA-N	0	3	347.466	3.292	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1sncc1C)[C@@H]2CC	ZINC001233319582	1376613967	/nfs/dbraw/zinc/61/39/67/1376613967.db2.gz	ULURLGLKUJRFTQ-AEFFLSMTSA-N	0	3	333.501	3.373	20	30		EGEDHN
CC[C@H](CC1CCCC1)C(=O)NCCNCc1ccc(C#N)s1	ZINC001134689011	1376659279	/nfs/dbraw/zinc/65/92/79/1376659279.db2.gz	ZXYVSTAGFLPFEM-OAHLLOKOSA-N	0	3	333.501	3.432	20	30		EGEDHN
CCCCCCCN1CC[C@@H]1CN(C)C(=O)[C@@H]1CCCc2cn[nH]c21	ZINC001234322092	1376808352	/nfs/dbraw/zinc/80/83/52/1376808352.db2.gz	FSZDKGPZPMFTSC-QZTJIDSGSA-N	0	3	346.519	3.333	20	30		EGEDHN
CCCCCCCN1CC[C@H]1CN(C)C(=O)c1c(Cl)cnn1C	ZINC001234322979	1376810130	/nfs/dbraw/zinc/81/01/30/1376810130.db2.gz	MBBYBYNEPDVAJJ-AWEZNQCLSA-N	0	3	340.899	3.190	20	30		EGEDHN
C=CCCCCCN1CC[C@H]1CN(C)C(=O)c1ccc2cc[nH]c2n1	ZINC001235589268	1376876923	/nfs/dbraw/zinc/87/69/23/1376876923.db2.gz	POSZKYQBYFLCCH-KRWDZBQOSA-N	0	3	340.471	3.456	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H](C)C[C@@H](C)NCc2ncc(C)s2)cc1	ZINC001135184975	1376958475	/nfs/dbraw/zinc/95/84/75/1376958475.db2.gz	RQIMKSHAYZCONL-ZIAGYGMSSA-N	0	3	341.480	3.120	20	30		EGEDHN
Cc1c(O)cccc1-c1nccnc1C(C#N)C(=O)OC(C)(C)C	ZINC001244956765	1377041216	/nfs/dbraw/zinc/04/12/16/1377041216.db2.gz	MQNJOOSSPDUFEF-ZDUSSCGKSA-N	0	3	325.368	3.107	20	30		EGEDHN
C=CCCCC(=O)N[C@H](C)C[C@@H](C)NCc1cc(F)ccc1C#N	ZINC001135358368	1377051653	/nfs/dbraw/zinc/05/16/53/1377051653.db2.gz	QYSUUDNBEUHNDU-HUUCEWRRSA-N	0	3	331.435	3.427	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](C)C[C@H](C)NCc2conc2CC)CC1	ZINC001135416140	1377083140	/nfs/dbraw/zinc/08/31/40/1377083140.db2.gz	QUMVFJRXPPUHBR-LSDHHAIUSA-N	0	3	333.476	3.356	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H](C)C[C@@H](C)NCc2ccccc2C#N)C1	ZINC001135426673	1377089735	/nfs/dbraw/zinc/08/97/35/1377089735.db2.gz	GNGCAAWSHICWFU-CVEARBPZSA-N	0	3	325.456	3.287	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1cc(F)ccc1C#N)NC(=O)C1(CF)CCC1	ZINC001135501466	1377120696	/nfs/dbraw/zinc/12/06/96/1377120696.db2.gz	POWCGEDIIFWKRT-UONOGXRCSA-N	0	3	349.425	3.210	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)c1cc(C)[nH]c1C	ZINC001135561571	1377145358	/nfs/dbraw/zinc/14/53/58/1377145358.db2.gz	SSXASZQVOHQKEI-QWRGUYRKSA-N	0	3	342.281	3.027	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)c1ccc(C)cc1	ZINC001136006165	1377296638	/nfs/dbraw/zinc/29/66/38/1377296638.db2.gz	JCCAEGLRMKMEPV-UONOGXRCSA-N	0	3	339.277	3.390	20	30		EGEDHN
CC[C@H]1CCCC[C@@H]1C(=O)NCCNCc1ccc(C#N)c(F)c1	ZINC001136081176	1377333891	/nfs/dbraw/zinc/33/38/91/1377333891.db2.gz	QIBBAAHUBQHIGF-RDJZCZTQSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CC[C@@H](N(C)Cc2ccc(C)c(F)c2)C1	ZINC001189251262	1388496593	/nfs/dbraw/zinc/49/65/93/1388496593.db2.gz	OUAYTDPYDBQKMS-SJLPKXTDSA-N	0	3	348.462	3.148	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2cccc(COC)c2)CCCC1	ZINC001267841969	1377474824	/nfs/dbraw/zinc/47/48/24/1377474824.db2.gz	ZHOVXVSNCJTTEO-UHFFFAOYSA-N	0	3	336.863	3.218	20	30		EGEDHN
C=CCN1C(=O)CC[C@@]12CCCN(Cc1c(F)cccc1OC)CC2	ZINC001138382526	1377712707	/nfs/dbraw/zinc/71/27/07/1377712707.db2.gz	BKJBBZLWSRBWJV-HXUWFJFHSA-N	0	3	346.446	3.367	20	30		EGEDHN
C#CCOc1ccc(CN2CCC[C@@](O)(C(F)(F)F)[C@H](C)C2)cc1	ZINC001138556006	1377741781	/nfs/dbraw/zinc/74/17/81/1377741781.db2.gz	AUSNMSNNCQSSKF-PBHICJAKSA-N	0	3	341.373	3.224	20	30		EGEDHN
C#CCOc1ccc(CN2CCCN(c3ncccc3C)CC2)cc1	ZINC001138559058	1377742023	/nfs/dbraw/zinc/74/20/23/1377742023.db2.gz	NMMJBENHDJZOBN-UHFFFAOYSA-N	0	3	335.451	3.114	20	30		EGEDHN
C#CCOc1ccc(CN2CCC[C@@H](c3nc(CC)no3)C2)cc1	ZINC001138557390	1377742036	/nfs/dbraw/zinc/74/20/36/1377742036.db2.gz	JLARRTREWHIIFR-MRXNPFEDSA-N	0	3	325.412	3.024	20	30		EGEDHN
C=CCO[C@H]1CO[C@]2(C1)CCC[N@@H+](Cc1cccc(CC=C)c1[O-])C2	ZINC001138628843	1377756888	/nfs/dbraw/zinc/75/68/88/1377756888.db2.gz	HKJBGESBXJWDAT-CTNGQTDRSA-N	0	3	343.467	3.447	20	30		EGEDHN
C=CCO[C@H]1CO[C@]2(C1)CCC[N@H+](Cc1cccc(CC=C)c1[O-])C2	ZINC001138628843	1377756889	/nfs/dbraw/zinc/75/68/89/1377756889.db2.gz	HKJBGESBXJWDAT-CTNGQTDRSA-N	0	3	343.467	3.447	20	30		EGEDHN
CC(=O)N1CCC[C@@H](N(C)Cc2ccc(-c3cc(C#N)ccn3)cc2)C1	ZINC001139406235	1377879855	/nfs/dbraw/zinc/87/98/55/1377879855.db2.gz	NOCRPSLZDLFOTM-HXUWFJFHSA-N	0	3	348.450	3.063	20	30		EGEDHN
C[C@]1(O)CCCN(Cc2ccc(Oc3ccc(C#N)cc3)nc2)CC1	ZINC001139424364	1377880816	/nfs/dbraw/zinc/88/08/16/1377880816.db2.gz	PTBXUXGCJRSKBQ-FQEVSTJZSA-N	0	3	337.423	3.482	20	30		EGEDHN
CN(C)c1ccc(CN2CCC(Cc3ccc(C#N)cc3)CC2)cn1	ZINC001139456848	1377885310	/nfs/dbraw/zinc/88/53/10/1377885310.db2.gz	PQLZMUKCFKKYFN-UHFFFAOYSA-N	0	3	334.467	3.474	20	30		EGEDHN
CCOC[C@@H]1COCCC12CCN(Cc1ccc(C#N)c(F)c1)CC2	ZINC001139527391	1377897336	/nfs/dbraw/zinc/89/73/36/1377897336.db2.gz	DCBSJEWOQISYBP-GOSISDBHSA-N	0	3	346.446	3.353	20	30		EGEDHN
N#Cc1cccc2c(CN3CCC4(CC(F)(F)CO4)CC3)c[nH]c21	ZINC001139703469	1377937862	/nfs/dbraw/zinc/93/78/62/1377937862.db2.gz	OQTPQYYUDGAHDE-UHFFFAOYSA-N	0	3	331.366	3.430	20	30		EGEDHN
Cc1cncnc1O[C@@H]1CCCN(Cc2c[nH]c3c2cccc3C#N)C1	ZINC001139707618	1377938097	/nfs/dbraw/zinc/93/80/97/1377938097.db2.gz	MDOKKGUUUQYEPG-QGZVFWFLSA-N	0	3	347.422	3.181	20	30		EGEDHN
Cc1ccc(O[C@H]2CCN(Cc3c[nH]c4c3cccc4C#N)C2)nc1	ZINC001139706631	1377938133	/nfs/dbraw/zinc/93/81/33/1377938133.db2.gz	BZXNGQROOHCLJT-KRWDZBQOSA-N	0	3	332.407	3.396	20	30		EGEDHN
Cc1ccc(CN2CCC[C@@](O)(C(F)(F)F)[C@@H](C)C2)cc1C#N	ZINC001139723182	1377941468	/nfs/dbraw/zinc/94/14/68/1377941468.db2.gz	URUFXAXBEXTZBY-BBRMVZONSA-N	0	3	326.362	3.392	20	30		EGEDHN
Cc1ccc(CN2CCC3(C[C@H](OCC4CC4)CO3)CC2)cc1C#N	ZINC001139725517	1377941950	/nfs/dbraw/zinc/94/19/50/1377941950.db2.gz	SCYKJYRFSTZHPS-FQEVSTJZSA-N	0	3	340.467	3.417	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1ccc(C)cn1)[C@H]2CC	ZINC001139837380	1377959613	/nfs/dbraw/zinc/95/96/13/1377959613.db2.gz	VFWLJJUAMMATEB-ICSRJNTNSA-N	0	3	327.472	3.312	20	30		EGEDHN
Cn1ncc2cc(CN3CCC[C@@H](Oc4ccc(C#N)cc4)C3)ccc21	ZINC001139953301	1377982320	/nfs/dbraw/zinc/98/23/20/1377982320.db2.gz	KTTYTJRBWUBZHW-HXUWFJFHSA-N	0	3	346.434	3.488	20	30		EGEDHN
Cc1ccnc(O[C@@H]2CCCN(Cc3c[nH]c4ccc(C#N)cc34)C2)n1	ZINC001140117032	1378012153	/nfs/dbraw/zinc/01/21/53/1378012153.db2.gz	KQTAWXRJGVJMJA-QGZVFWFLSA-N	0	3	347.422	3.181	20	30		EGEDHN
N#CCCCN1CC[C@]2(CCN(Cc3cccc(F)c3Cl)C2)C1=O	ZINC001272608404	1378076042	/nfs/dbraw/zinc/07/60/42/1378076042.db2.gz	PQGXQJWZPBLVCJ-SFHVURJKSA-N	0	3	349.837	3.207	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(CCN(Cc3cccc(Cl)c3OC)C2)C1=O	ZINC001273285294	1378094492	/nfs/dbraw/zinc/09/44/92/1378094492.db2.gz	PNISSBQJQQNJFI-LJQANCHMSA-N	0	3	348.874	3.349	20	30		EGEDHN
CCc1cccc(CN2CCC[C@]23CCN(CCCC#N)C3=O)c1	ZINC001273651453	1378107916	/nfs/dbraw/zinc/10/79/16/1378107916.db2.gz	KKBFGLGCRCIADD-HXUWFJFHSA-N	0	3	325.456	3.120	20	30		EGEDHN
Cn1cnc2ccc(CN3CCC[C@@H](Oc4cccc(C#N)c4)C3)cc21	ZINC001140739023	1378127917	/nfs/dbraw/zinc/12/79/17/1378127917.db2.gz	ZPTHRDYQYHAYOT-LJQANCHMSA-N	0	3	346.434	3.488	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@@H]1CC[N@@H+](Cc1ccc(C)cc1[O-])C2	ZINC001140952056	1378190225	/nfs/dbraw/zinc/19/02/25/1378190225.db2.gz	CRRRTHZQRAKIKM-WOJBJXKFSA-N	0	3	331.456	3.274	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@@H]1CC[N@H+](Cc1ccc(C)cc1[O-])C2	ZINC001140952056	1378190229	/nfs/dbraw/zinc/19/02/29/1378190229.db2.gz	CRRRTHZQRAKIKM-WOJBJXKFSA-N	0	3	331.456	3.274	20	30		EGEDHN
CN1CCN(c2ccccc2CN(CCC#N)C2CCCC2)CC1	ZINC001140974014	1378197849	/nfs/dbraw/zinc/19/78/49/1378197849.db2.gz	VGCNTXQVZMSNCD-UHFFFAOYSA-N	0	3	326.488	3.097	20	30		EGEDHN
N#Cc1cccc(O[C@H]2CCCN(Cc3ccn4ccnc4c3)C2)c1	ZINC001141046496	1378219048	/nfs/dbraw/zinc/21/90/48/1378219048.db2.gz	CKHHVAZTGZMEJS-IBGZPJMESA-N	0	3	332.407	3.249	20	30		EGEDHN
CC(C)(C)N1CCN(Cc2cc(C#N)ccc2Br)CC1	ZINC001141661198	1378359403	/nfs/dbraw/zinc/35/94/03/1378359403.db2.gz	ZYRJWVUFXQMZRQ-UHFFFAOYSA-N	0	3	336.277	3.237	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@H]1CCN(Cc1[nH]cnc1C(C)(C)C)C2	ZINC001142217741	1378421792	/nfs/dbraw/zinc/42/17/92/1378421792.db2.gz	RJQFSAHJFBONPR-PXNSSMCTSA-N	0	3	347.503	3.281	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@@H]1CCN(Cc1[nH]cnc1C(C)(C)C)C2	ZINC001142217743	1378421912	/nfs/dbraw/zinc/42/19/12/1378421912.db2.gz	RJQFSAHJFBONPR-YLJYHZDGSA-N	0	3	347.503	3.281	20	30		EGEDHN
N#Cc1ccccc1O[C@H]1CCCN(Cc2ccnc3[nH]ccc32)C1	ZINC001142882339	1378503840	/nfs/dbraw/zinc/50/38/40/1378503840.db2.gz	KTFQCIQMKBIBFO-KRWDZBQOSA-N	0	3	332.407	3.478	20	30		EGEDHN
COC(=O)c1cccc(CN(C)Cc2c[nH]c3cc(C#N)ccc23)c1	ZINC001142926678	1378510051	/nfs/dbraw/zinc/51/00/51/1378510051.db2.gz	XOSFGLNCIQHSBB-UHFFFAOYSA-N	0	3	333.391	3.458	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCCN(Cc3cccn4ccnc34)C2)cc1	ZINC001142963120	1378517720	/nfs/dbraw/zinc/51/77/20/1378517720.db2.gz	MDAJKPLMNHEYCF-LJQANCHMSA-N	0	3	332.407	3.249	20	30		EGEDHN
C=CCN(CC=C)CCN1CCN(Cc2ccc(C(F)F)cc2)CC1	ZINC001143253434	1378569777	/nfs/dbraw/zinc/56/97/77/1378569777.db2.gz	SYJSLGUGYFRKBK-UHFFFAOYSA-N	0	3	349.469	3.416	20	30		EGEDHN
N#Cc1cncc(CN2CCC3(C[C@H](c4ccccc4)CO3)CC2)c1	ZINC001144080743	1378680508	/nfs/dbraw/zinc/68/05/08/1378680508.db2.gz	XANMYSMDGREQSS-FQEVSTJZSA-N	0	3	333.435	3.492	20	30		EGEDHN
O=C1C=C2CN(Cc3ccc(O)cc3C(F)(F)F)CCC2S1	ZINC001144387698	1378724076	/nfs/dbraw/zinc/72/40/76/1378724076.db2.gz	ZCZJAPMXHQJOIU-CYBMUJFWSA-N	0	3	329.343	3.185	20	30		EGEDHN
Cc1oc(C(C)C)cc1C(=O)NCCNCc1ccc(C#N)cc1	ZINC001146338642	1378820780	/nfs/dbraw/zinc/82/07/80/1378820780.db2.gz	OIHBTDURCZEQDL-UHFFFAOYSA-N	0	3	325.412	3.103	20	30		EGEDHN
Cc1oc(C(C)C)cc1C(=O)NCCNCc1ccc(C#N)c(F)c1	ZINC001146350316	1378824795	/nfs/dbraw/zinc/82/47/95/1378824795.db2.gz	USNCIJDXFYRFCG-UHFFFAOYSA-N	0	3	343.402	3.242	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2cnc(C)o2)CCCCC1	ZINC001146699025	1378899350	/nfs/dbraw/zinc/89/93/50/1378899350.db2.gz	BQPBUQBJOMURPW-HOTGVXAUSA-N	0	3	345.487	3.330	20	30		EGEDHN
CC(C)(C)/C=C/C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001147239897	1378994165	/nfs/dbraw/zinc/99/41/65/1378994165.db2.gz	FOUMSGSZXBBFTG-CMDGGOBGSA-N	0	3	337.467	3.195	20	30		EGEDHN
C=CCOCCCC(=O)N1CC2(C1)CCN(Cc1csc(C)c1)C2	ZINC001147297195	1379002264	/nfs/dbraw/zinc/00/22/64/1379002264.db2.gz	JVQIMVLKLOABDF-UHFFFAOYSA-N	0	3	348.512	3.074	20	30		EGEDHN
C#CCCCC(=O)N1CC2(C1)CCN([C@H](C)c1ccccc1F)C2	ZINC001147462056	1379025216	/nfs/dbraw/zinc/02/52/16/1379025216.db2.gz	MPULWOJSZDREMT-MRXNPFEDSA-N	0	3	328.431	3.225	20	30		EGEDHN
Cc1cc(F)ccc1CN1CCC2(CN(C(=O)C#CC(C)(C)C)C2)C1	ZINC001147541380	1379039919	/nfs/dbraw/zinc/03/99/19/1379039919.db2.gz	OHZUEWWHIPKHPL-UHFFFAOYSA-N	0	3	342.458	3.218	20	30		EGEDHN
C[C@H](CN(C)C(=O)C1C(C)(C)C1(C)C)NCc1ccc(F)c(C#N)c1	ZINC001283593804	1379040043	/nfs/dbraw/zinc/04/00/43/1379040043.db2.gz	FCQFPXOACIOBDX-CYBMUJFWSA-N	0	3	345.462	3.316	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2[nH]ccc2-c2ccccc2)c1	ZINC001147562654	1379042985	/nfs/dbraw/zinc/04/29/85/1379042985.db2.gz	RLAAJXMWTOJOFX-UHFFFAOYSA-N	0	3	344.418	3.073	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)CCCc3ccccc3Cl)C2)C1	ZINC001147676736	1379059397	/nfs/dbraw/zinc/05/93/97/1379059397.db2.gz	UFSFIIZZWKHACM-UHFFFAOYSA-N	0	3	344.886	3.220	20	30		EGEDHN
Cc1cc2cc(C(=O)NCCNCc3cccc(C#N)c3)oc2cc1C	ZINC001148033221	1379106965	/nfs/dbraw/zinc/10/69/65/1379106965.db2.gz	IOUKSPBFQWVLSV-UHFFFAOYSA-N	0	3	347.418	3.441	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC2(C1)CCN(Cc1ncccc1C)C2	ZINC001148130660	1379122550	/nfs/dbraw/zinc/12/25/50/1379122550.db2.gz	NYNCKLJJUHXGPH-KRWDZBQOSA-N	0	3	327.472	3.027	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001148147487	1379124518	/nfs/dbraw/zinc/12/45/18/1379124518.db2.gz	TXXNZEUDSKZMMT-KRWDZBQOSA-N	0	3	337.467	3.195	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001148147488	1379124548	/nfs/dbraw/zinc/12/45/48/1379124548.db2.gz	TXXNZEUDSKZMMT-QGZVFWFLSA-N	0	3	337.467	3.195	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@@H](C)CCc3ccccc3F)C2)C1	ZINC001148298203	1379148875	/nfs/dbraw/zinc/14/88/75/1379148875.db2.gz	LVQUGLWFGIYPKQ-INIZCTEOSA-N	0	3	330.447	3.115	20	30		EGEDHN
CCCCCCCCC(=O)NCCNCc1ccc2c(c1)OCCO2	ZINC001148727773	1379254837	/nfs/dbraw/zinc/25/48/37/1379254837.db2.gz	KLUMMDYGYNCHRU-UHFFFAOYSA-N	0	3	348.487	3.414	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)CCCCc3ccc(C)cc3)C2)C1	ZINC001148881593	1379290166	/nfs/dbraw/zinc/29/01/66/1379290166.db2.gz	UVIYKRWTHLHQJU-UHFFFAOYSA-N	0	3	326.484	3.428	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@H]1CN(Cc2ccc(C)c(C)c2)CCCO1	ZINC001149796753	1379449315	/nfs/dbraw/zinc/44/93/15/1379449315.db2.gz	NNVHRNUNCMNFHB-FQEVSTJZSA-N	0	3	344.499	3.367	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@H]1CN(Cc2ccccc2C)CCCO1	ZINC001149797027	1379449458	/nfs/dbraw/zinc/44/94/58/1379449458.db2.gz	QBLYNCJPDQQUCY-IBGZPJMESA-N	0	3	330.472	3.058	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2sccc2C2CC2)c1	ZINC001150035468	1379487964	/nfs/dbraw/zinc/48/79/64/1379487964.db2.gz	UMVAHVBNCRAZKP-UHFFFAOYSA-N	0	3	325.437	3.017	20	30		EGEDHN
Cc1cc(C(=O)NCCNCc2cccc(C#N)c2)c(C)n1C(C)C	ZINC001150508630	1379559911	/nfs/dbraw/zinc/55/99/11/1379559911.db2.gz	CHDABNMXXJYZHJ-UHFFFAOYSA-N	0	3	338.455	3.077	20	30		EGEDHN
C#CCCN1CCCO[C@H](CNC(=O)[C@H](CCCCC)C(C)C)C1	ZINC001150562921	1379569595	/nfs/dbraw/zinc/56/95/95/1379569595.db2.gz	UDZHAYTUNWRIBD-RTBURBONSA-N	0	3	336.520	3.069	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2cscc2Cl)CC1	ZINC001151168912	1379670807	/nfs/dbraw/zinc/67/08/07/1379670807.db2.gz	RTIRMNRGMAWBLH-UHFFFAOYSA-N	0	3	342.892	3.188	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)CCCc2ccccc2)CC1	ZINC001151281570	1379692735	/nfs/dbraw/zinc/69/27/35/1379692735.db2.gz	NKIXHHMBPDSHQH-UHFFFAOYSA-N	0	3	344.499	3.183	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@H]2CCC[C@H]2CC)CC1	ZINC001151294581	1379694833	/nfs/dbraw/zinc/69/48/33/1379694833.db2.gz	MEXPTGPJPXHJAV-MSOLQXFVSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@H](C)c2cccs2)CC1	ZINC001151302688	1379696495	/nfs/dbraw/zinc/69/64/95/1379696495.db2.gz	OPQOWFLVZHSCPI-OAHLLOKOSA-N	0	3	336.501	3.025	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@H]2C[C@@]2(CC)C(C)C)CC1	ZINC001151381335	1379708423	/nfs/dbraw/zinc/70/84/23/1379708423.db2.gz	NNJKBABXHNLBDZ-XLIONFOSSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2ccc(F)cc2C)CC1	ZINC001151399197	1379711036	/nfs/dbraw/zinc/71/10/36/1379711036.db2.gz	SUAPZZBYMAUVSA-UHFFFAOYSA-N	0	3	348.462	3.311	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2cccc(C)c2C)CC1	ZINC001151405964	1379712331	/nfs/dbraw/zinc/71/23/31/1379712331.db2.gz	QNDKYQPRKNNIIT-UHFFFAOYSA-N	0	3	330.472	3.090	20	30		EGEDHN
C[C@H](C(=O)NCCNCc1ccc(C#N)cc1)c1cccc(Cl)c1	ZINC001151642682	1379753935	/nfs/dbraw/zinc/75/39/35/1379753935.db2.gz	ZYHJRLXQDXASIY-AWEZNQCLSA-N	0	3	341.842	3.221	20	30		EGEDHN
CCN(Cc1ccc(OC)c(C#N)c1)[C@H](C)CNC(=O)CC(C)(C)C	ZINC001151937671	1379819152	/nfs/dbraw/zinc/81/91/52/1379819152.db2.gz	JDBUPDVJQBHQHS-OAHLLOKOSA-N	0	3	345.487	3.330	20	30		EGEDHN
C=CCOCC(=O)NC[C@@H](C)N(CC)Cc1ccc(Cl)c(F)c1	ZINC001152370938	1379922469	/nfs/dbraw/zinc/92/24/69/1379922469.db2.gz	UROPPXRVBUHBQZ-CYBMUJFWSA-N	0	3	342.842	3.008	20	30		EGEDHN
CCN(Cc1cccc(C(F)(F)F)c1)[C@H](C)CNC(=O)[C@@H](C)C#N	ZINC001152420330	1379931708	/nfs/dbraw/zinc/93/17/08/1379931708.db2.gz	PKPHBHNUJWYLAB-QWHCGFSZSA-N	0	3	341.377	3.192	20	30		EGEDHN
CC(C)(C)[C@H](CNCc1ccc(C#N)cc1F)NC(=O)C(C)(C)F	ZINC001284562802	1379971915	/nfs/dbraw/zinc/97/19/15/1379971915.db2.gz	RHESWLYUKBZFTF-HNNXBMFYSA-N	0	3	337.414	3.066	20	30		EGEDHN
CC(C)(C)[C@H](CNCc1ccc(C#N)cc1F)NC(=O)c1ccco1	ZINC001284562608	1379971959	/nfs/dbraw/zinc/97/19/59/1379971959.db2.gz	NFVGOEDGMVPNAF-KRWDZBQOSA-N	0	3	343.402	3.225	20	30		EGEDHN
CCC[C@@H](CC(C)C)C(=O)NCCNCc1ccc(C#N)c(F)c1	ZINC001152876202	1379989643	/nfs/dbraw/zinc/98/96/43/1379989643.db2.gz	IRSFMXFJCLJTLS-INIZCTEOSA-N	0	3	333.451	3.366	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)C1CC(C)(C)C1	ZINC001153096629	1380019821	/nfs/dbraw/zinc/01/98/21/1380019821.db2.gz	NRWDWVLNGJCTQB-CQSZACIVSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C(Cl)CNC[C@@H](NC(=O)c1ccn2cc(C)nc2c1)C(C)(C)C	ZINC001284623695	1380024286	/nfs/dbraw/zinc/02/42/86/1380024286.db2.gz	ASBHHKKLPDLZGA-OAHLLOKOSA-N	0	3	348.878	3.129	20	30		EGEDHN
CCc1[nH]ccc1C(=O)NC[C@@H](C)N(CC)Cc1cccc(C#N)c1	ZINC001153126598	1380025997	/nfs/dbraw/zinc/02/59/97/1380025997.db2.gz	GDVVMIFPPTVKHJ-OAHLLOKOSA-N	0	3	338.455	3.089	20	30		EGEDHN
CCN(Cc1ccc(F)c(Cl)c1)[C@H](C)CNC(=O)C#CC(C)C	ZINC001153207729	1380035611	/nfs/dbraw/zinc/03/56/11/1380035611.db2.gz	RJMKVFJIEXDBAJ-CQSZACIVSA-N	0	3	338.854	3.465	20	30		EGEDHN
CCN(Cc1ccc(OC)c(Cl)c1)[C@H](C)CNC(=O)C#CC1CC1	ZINC001153232502	1380041063	/nfs/dbraw/zinc/04/10/63/1380041063.db2.gz	FNNMFRZURDHAMU-CQSZACIVSA-N	0	3	348.874	3.089	20	30		EGEDHN
C#CC[C@@H](CC(=O)NCCNCc1ccsc1)c1ccccc1	ZINC001153715210	1380117742	/nfs/dbraw/zinc/11/77/42/1380117742.db2.gz	ZCEFKMHAEHRKQT-SFHVURJKSA-N	0	3	326.465	3.151	20	30		EGEDHN
C=CCC[C@H](C(=O)NCCNCc1cncc(C)c1)c1ccccc1	ZINC001153818138	1380136085	/nfs/dbraw/zinc/13/60/85/1380136085.db2.gz	YBKRSVQYWVSMLX-FQEVSTJZSA-N	0	3	337.467	3.346	20	30		EGEDHN
Cc1ccc(CCCC(=O)NCCNCc2ccc(C#N)cc2)s1	ZINC001153882404	1380149138	/nfs/dbraw/zinc/14/91/38/1380149138.db2.gz	DOYCIOWRQDDHFB-UHFFFAOYSA-N	0	3	341.480	3.157	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)Cc1cccc(C)c1	ZINC001154980592	1380384050	/nfs/dbraw/zinc/38/40/50/1380384050.db2.gz	GDVNNAHHAVIQSL-GOSISDBHSA-N	0	3	349.478	3.436	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)cc1	ZINC001155066626	1380401433	/nfs/dbraw/zinc/40/14/33/1380401433.db2.gz	LSVJGYBSAWQOFK-OXQOHEQNSA-N	0	3	327.472	3.487	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@@H](C)N(CC)Cc2csc(C)c2)c1	ZINC001155185677	1380420530	/nfs/dbraw/zinc/42/05/30/1380420530.db2.gz	HVQDNQQTEOSMOO-CQSZACIVSA-N	0	3	341.480	3.073	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)[C@@H](C)C(C)(F)F	ZINC001155288991	1380433602	/nfs/dbraw/zinc/43/36/02/1380433602.db2.gz	GHVBXBNMWJZCNE-ZIAGYGMSSA-N	0	3	337.414	3.176	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@@H](C)N(CC)Cc1ccc2nonc2c1	ZINC001155489983	1380459745	/nfs/dbraw/zinc/45/97/45/1380459745.db2.gz	SCBAYRKSKMJRNA-CQSZACIVSA-N	0	3	344.459	3.152	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)[C@@H]1CC12CCC2	ZINC001155503054	1380461729	/nfs/dbraw/zinc/46/17/29/1380461729.db2.gz	GCHBTDGNCAPQEP-PBHICJAKSA-N	0	3	343.446	3.214	20	30		EGEDHN
CCN(Cc1ccc(OC)c(C#N)c1)[C@H](C)CNC(=O)[C@@H](C)C(C)C	ZINC001155581527	1380470454	/nfs/dbraw/zinc/47/04/54/1380470454.db2.gz	TYQQTXSFCZGIOJ-CVEARBPZSA-N	0	3	345.487	3.186	20	30		EGEDHN
C=CCCC(=O)NCCCNCc1ccc(C)cc1Br	ZINC001155587137	1380470832	/nfs/dbraw/zinc/47/08/32/1380470832.db2.gz	YVHSFHKKGIAHJM-UHFFFAOYSA-N	0	3	339.277	3.320	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1cc(-c2ccccc2)ccn1	ZINC001156006303	1380512741	/nfs/dbraw/zinc/51/27/41/1380512741.db2.gz	LSDSFOPTAWOSFO-QGZVFWFLSA-N	0	3	335.451	3.212	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H](C)N(CC)C/C=C\c2ccccc2)cn1	ZINC001156460441	1380578767	/nfs/dbraw/zinc/57/87/67/1380578767.db2.gz	JTHLSXHSECUOSE-ZVBPTUHVSA-N	0	3	347.462	3.217	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@@H](CC)c1ccc(OC)cc1	ZINC001157046975	1380759231	/nfs/dbraw/zinc/75/92/31/1380759231.db2.gz	GNOYIJYWDZLXQM-APWZRJJASA-N	0	3	330.472	3.039	20	30		EGEDHN
C=CCOCC(=O)N1CCCC[C@@H]1CN(C)Cc1csc(C)c1	ZINC001157706274	1381009366	/nfs/dbraw/zinc/00/93/66/1381009366.db2.gz	WVNSTWAXVZSVKY-QGZVFWFLSA-N	0	3	336.501	3.072	20	30		EGEDHN
CN(C[C@@H]1CC(C)(C)CO1)C[C@H]1CCCCN1C(=O)C#CC(C)(C)C	ZINC001157965039	1381083538	/nfs/dbraw/zinc/08/35/38/1381083538.db2.gz	LOAQDNAZECPYDS-MSOLQXFVSA-N	0	3	348.531	3.164	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1C[C@@H]2C=C[C@H]1CC2	ZINC001157982127	1381092122	/nfs/dbraw/zinc/09/21/22/1381092122.db2.gz	NNAVANUMSACCNU-IYWMVGAKSA-N	0	3	346.515	3.104	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1[nH]ccc1C1CC1	ZINC001158050316	1381113715	/nfs/dbraw/zinc/11/37/15/1381113715.db2.gz	ONAQNFSDSCKLGQ-QGZVFWFLSA-N	0	3	345.487	3.021	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccoc1Br	ZINC001158704922	1381360643	/nfs/dbraw/zinc/36/06/43/1381360643.db2.gz	ZJDCBNUUPBSXHP-GFCCVEGCSA-N	0	3	341.249	3.155	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H](C)n1cnc2ccccc21	ZINC001158709121	1381361583	/nfs/dbraw/zinc/36/15/83/1381361583.db2.gz	JUWQHPCHMGSVDG-DLBZAZTESA-N	0	3	340.471	3.096	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cnn(CCCC)c1C	ZINC001158732289	1381373776	/nfs/dbraw/zinc/37/37/76/1381373776.db2.gz	ORQCKZPBVTUIDH-QGZVFWFLSA-N	0	3	332.492	3.104	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1cccc2c1CCCC2	ZINC001158740628	1381377522	/nfs/dbraw/zinc/37/75/22/1381377522.db2.gz	HDSSIHFAVJVZIG-UHFFFAOYSA-N	0	3	347.462	3.347	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H](C)Oc1cccc(C)c1	ZINC001158829613	1381422813	/nfs/dbraw/zinc/42/28/13/1381422813.db2.gz	CKIDVXWEZAEJRS-QZTJIDSGSA-N	0	3	330.472	3.261	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCCNCc1nsc2ccccc12	ZINC001158894139	1381452101	/nfs/dbraw/zinc/45/21/01/1381452101.db2.gz	ARIBFGYJTVYJPV-UHFFFAOYSA-N	0	3	331.485	3.495	20	30		EGEDHN
C=C[C@@H](CC(=O)N1CCCC[C@@H]1CN(C)CCOC)c1ccccc1	ZINC001158900377	1381455502	/nfs/dbraw/zinc/45/55/02/1381455502.db2.gz	BKCVSVCBOKMVDQ-AZUAARDMSA-N	0	3	344.499	3.306	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)NCCC1=CCN(Cc2csc(C)c2)CC1	ZINC001159979281	1381956693	/nfs/dbraw/zinc/95/66/93/1381956693.db2.gz	LEMPBIHVXFYKOO-IBGZPJMESA-N	0	3	348.512	3.022	20	30		EGEDHN
Cc1ccc(C#N)cc1C(=O)N[C@H](CN1CCCC1)c1ccccc1	ZINC001290115980	1382061309	/nfs/dbraw/zinc/06/13/09/1382061309.db2.gz	LPEZUYJWBXLDCW-HXUWFJFHSA-N	0	3	333.435	3.434	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@]2(C)[C@@H]3Cc4ccccc4[C@@H]32)CC1	ZINC001160551408	1382139705	/nfs/dbraw/zinc/13/97/05/1382139705.db2.gz	KXHYZOKIKBXCAI-FUPPJEDESA-N	0	3	348.490	3.124	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)Cc2cccc(C3CC3)c2)CC1	ZINC001160778071	1382193810	/nfs/dbraw/zinc/19/38/10/1382193810.db2.gz	FUCYYTIXQIPWAQ-UHFFFAOYSA-N	0	3	336.479	3.268	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H](C)OCc2cccc(C)c2)CC1	ZINC001160792828	1382197509	/nfs/dbraw/zinc/19/75/09/1382197509.db2.gz	LXXGDNNSZYINNC-SFHVURJKSA-N	0	3	342.483	3.225	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc(C)nc2C2CC2)CC1	ZINC001160798253	1382199469	/nfs/dbraw/zinc/19/94/69/1382199469.db2.gz	CCMAQDAVXNMTIC-UHFFFAOYSA-N	0	3	325.456	3.205	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCCC1=CCN(CCOCC(C)C)CC1	ZINC001160967056	1382254030	/nfs/dbraw/zinc/25/40/30/1382254030.db2.gz	AKNPIKAFMAYLBJ-SFHVURJKSA-N	0	3	336.520	3.400	20	30		EGEDHN
C[C@H]1C[C@@H]1CC(=O)NCCC1=CCN(Cc2ccc(C#N)cc2)CC1	ZINC001161114539	1382303580	/nfs/dbraw/zinc/30/35/80/1382303580.db2.gz	ZXHVIIULJHZYSA-OXJNMPFZSA-N	0	3	337.467	3.243	20	30		EGEDHN
N#Cc1nc(NC2CCN(Cc3ccc(O)cc3)CC2)ccc1Cl	ZINC001161131816	1382312335	/nfs/dbraw/zinc/31/23/35/1382312335.db2.gz	YZCKLMNYIJAIOD-UHFFFAOYSA-N	0	3	342.830	3.389	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCC2=CCN(CCOCC(C)C)CC2)C1	ZINC001161178022	1382326939	/nfs/dbraw/zinc/32/69/39/1382326939.db2.gz	JFSOBZZXAHDDLE-UHFFFAOYSA-N	0	3	334.504	3.154	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc(C3CC3)nc2C)CC1	ZINC001161248646	1382354164	/nfs/dbraw/zinc/35/41/64/1382354164.db2.gz	FOGKUAUALUADCB-UHFFFAOYSA-N	0	3	337.467	3.043	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCC1=CCN(CCc2ccns2)CC1	ZINC001161343718	1382375874	/nfs/dbraw/zinc/37/58/74/1382375874.db2.gz	QIHDSIZGBRRBHO-UHFFFAOYSA-N	0	3	347.528	3.426	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H](CC)Cc2ccccc2)CC1	ZINC001161363693	1382384571	/nfs/dbraw/zinc/38/45/71/1382384571.db2.gz	JKTMNVKMXKORHH-NRFANRHFSA-N	0	3	338.495	3.417	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C2(c3cccc(F)c3)CC2)CC1	ZINC001161404877	1382400525	/nfs/dbraw/zinc/40/05/25/1382400525.db2.gz	MUBBOMKLMYDWJS-UHFFFAOYSA-N	0	3	328.431	3.182	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H](c2cccnc2)C(C)C)CC1	ZINC001161554338	1382438265	/nfs/dbraw/zinc/43/82/65/1382438265.db2.gz	OCJHTWWCRDBIDW-IBGZPJMESA-N	0	3	327.472	3.146	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc3cnccc3c2)CC1	ZINC001161645482	1382469429	/nfs/dbraw/zinc/46/94/29/1382469429.db2.gz	HXTROGJTFHFYMG-UHFFFAOYSA-N	0	3	333.435	3.010	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C[C@H]2CCO[C@H](C(C)C)C2)CC1	ZINC001161656057	1382472753	/nfs/dbraw/zinc/47/27/53/1382472753.db2.gz	PTCLYNFFXGBUCN-OALUTQOASA-N	0	3	334.504	3.152	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H](C)Oc2cccc(C)c2)CC1	ZINC001161824696	1382521689	/nfs/dbraw/zinc/52/16/89/1382521689.db2.gz	NTDGAIGVZPIIOL-KRWDZBQOSA-N	0	3	328.456	3.087	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2sc(CCC)nc2C)CC1	ZINC001161862329	1382533536	/nfs/dbraw/zinc/53/35/36/1382533536.db2.gz	AGGZNBAXIQWNLU-UHFFFAOYSA-N	0	3	345.512	3.179	20	30		EGEDHN
C#CCN1CCC(CNC(=O)C(C)(C)C2CCCCC2)(COC)CC1	ZINC001162528053	1382781482	/nfs/dbraw/zinc/78/14/82/1382781482.db2.gz	QZOCLZLBQYUMQQ-UHFFFAOYSA-N	0	3	348.531	3.071	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)c1cc(C)c(C)o1	ZINC001162774140	1382868644	/nfs/dbraw/zinc/86/86/44/1382868644.db2.gz	SGVCRJITKPQKQS-UHFFFAOYSA-N	0	3	338.451	3.194	20	30		EGEDHN
C[C@H](N)c1nc2ccccc2n1-c1c(Br)cncc1C#N	ZINC001162776768	1382869066	/nfs/dbraw/zinc/86/90/66/1382869066.db2.gz	BWVQGQZHLXLXLO-VIFPVBQESA-N	0	3	342.200	3.074	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1C[C@H]1CC(C)(C)C	ZINC001162810890	1382880689	/nfs/dbraw/zinc/88/06/89/1382880689.db2.gz	UDOLMTDYCMYYAK-VQTJNVASSA-N	0	3	340.511	3.353	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C[C@@H]1CCC[C@@H]1C	ZINC001162822381	1382886775	/nfs/dbraw/zinc/88/67/75/1382886775.db2.gz	NJQHYKGIBHWENK-FPOVZHCZSA-N	0	3	340.511	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1ccc(CC)s1	ZINC001162857035	1382897077	/nfs/dbraw/zinc/89/70/77/1382897077.db2.gz	XUFBFQIUFHWTJI-UHFFFAOYSA-N	0	3	340.492	3.218	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CCC[C@@H]1CC	ZINC001162918884	1382915997	/nfs/dbraw/zinc/91/59/97/1382915997.db2.gz	IGGFAMWXRCTQGJ-PMACEKPBSA-N	0	3	326.484	3.107	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CCC(C)(C)C1	ZINC001162924307	1382918489	/nfs/dbraw/zinc/91/84/89/1382918489.db2.gz	MGQABXNUOFBAHI-FQEVSTJZSA-N	0	3	340.511	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CC2CCC1CC2	ZINC001163007590	1382946634	/nfs/dbraw/zinc/94/66/34/1382946634.db2.gz	VHBQHPRHJIMGNZ-CBNMVNINSA-N	0	3	338.495	3.107	20	30		EGEDHN
C=CCCN1CCN(Cc2ccc(CNC(=O)[C@@H](C)CC)cc2)CC1	ZINC001163018635	1382949287	/nfs/dbraw/zinc/94/92/87/1382949287.db2.gz	VTKBIPLWQSTQDI-SFHVURJKSA-N	0	3	343.515	3.043	20	30		EGEDHN
COc1cc(CCC#N)c(N[C@@H]2CNCc3ccsc32)cc1OC	ZINC001163230654	1383000863	/nfs/dbraw/zinc/00/08/63/1383000863.db2.gz	YXPJRJFIARHDOX-OAHLLOKOSA-N	0	3	343.452	3.478	20	30		EGEDHN
N#Cc1c(Cl)nc2cccc(F)c2c1N[C@H]1CN2CCC1CC2	ZINC001163387832	1383038989	/nfs/dbraw/zinc/03/89/89/1383038989.db2.gz	IHKUMCZPBKUPJN-AWEZNQCLSA-N	0	3	330.794	3.405	20	30		EGEDHN
Cc1cc(N2C[C@@H](C)N(C)[C@@H](C)C2)n2c3ccccc3nc2c1C#N	ZINC001163411687	1383045957	/nfs/dbraw/zinc/04/59/57/1383045957.db2.gz	GRTPNTDCYMMYGP-GASCZTMLSA-N	0	3	333.439	3.196	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)C[C@@H](C)C(C)C)CC1	ZINC001163757661	1383118385	/nfs/dbraw/zinc/11/83/85/1383118385.db2.gz	UPHPHQQZKQKOQF-CYBMUJFWSA-N	0	3	345.325	3.453	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCC1(CNCc2cccc(F)c2Cl)CC1	ZINC001163860044	1383130355	/nfs/dbraw/zinc/13/03/55/1383130355.db2.gz	WSYHHNIAZQZWIG-LBPRGKRZSA-N	0	3	337.826	3.015	20	30		EGEDHN
CCC1CCN(c2nccnc2C(C#N)C(=O)OC(C)(C)C)CC1	ZINC001164455193	1383188415	/nfs/dbraw/zinc/18/84/15/1383188415.db2.gz	CAEHSRODSHOWBU-AWEZNQCLSA-N	0	3	330.432	3.052	20	30		EGEDHN
C[C@@H]1CCN(Cc2ccccc2)C[C@@H]1N(C)c1nccc(F)c1C#N	ZINC001165184264	1383243922	/nfs/dbraw/zinc/24/39/22/1383243922.db2.gz	VTPOLLAYMGPITO-BEFAXECRSA-N	0	3	338.430	3.439	20	30		EGEDHN
COc1cc(N2C[C@@H](C)N(Cc3ccccc3)C[C@@H]2C)ncc1C#N	ZINC001165201164	1383247047	/nfs/dbraw/zinc/24/70/47/1383247047.db2.gz	LLYFQVBIMYQKBT-CVEARBPZSA-N	0	3	336.439	3.061	20	30		EGEDHN
C[C@H]1CCC[C@]1(C)C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001166053421	1383383132	/nfs/dbraw/zinc/38/31/32/1383383132.db2.gz	CLYBGGKTFFMGHA-LIRRHRJNSA-N	0	3	331.435	3.120	20	30		EGEDHN
CC#CCCCC(=O)NCCC1(CNCc2ccncc2Cl)CC1	ZINC001166704602	1383464358	/nfs/dbraw/zinc/46/43/58/1383464358.db2.gz	VTURUNFYGLLIJT-UHFFFAOYSA-N	0	3	347.890	3.305	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)NCCC1(CNCc2ccc(C#N)cc2F)CC1	ZINC001166722293	1383467053	/nfs/dbraw/zinc/46/70/53/1383467053.db2.gz	CHDGOXDIBDPDJE-QGZVFWFLSA-N	0	3	349.425	3.068	20	30		EGEDHN
CCC[C@H](C(=O)NCCCNCc1cc(C#N)ccc1F)C(C)C	ZINC001167471556	1383643134	/nfs/dbraw/zinc/64/31/34/1383643134.db2.gz	JSRKNHTXICFURG-KRWDZBQOSA-N	0	3	333.451	3.366	20	30		EGEDHN
CC(=O)N(C)c1ccc(CNC2CC(C#N)(c3ccccc3)C2)cc1	ZINC001328801008	1388870531	/nfs/dbraw/zinc/87/05/31/1388870531.db2.gz	YFXOFMNUSQBVGD-UHFFFAOYSA-N	0	3	333.435	3.383	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)[C@H]2C[C@]2(C)CC)CC1	ZINC001167583369	1383679043	/nfs/dbraw/zinc/67/90/43/1383679043.db2.gz	KUCMFCHSCBBARI-HIFRSBDPSA-N	0	3	343.309	3.207	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@H](F)Cc2ccccc2)CC1	ZINC001168283742	1383863054	/nfs/dbraw/zinc/86/30/54/1383863054.db2.gz	TXBMPMYOWGSAOC-MRXNPFEDSA-N	0	3	338.854	3.196	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H](NCC2(C#N)CC2)C[C@@H]1C(F)(F)F	ZINC001168523767	1383929977	/nfs/dbraw/zinc/92/99/77/1383929977.db2.gz	MGQMXTMDOONODJ-NWDGAFQWSA-N	0	3	347.381	3.210	20	30		EGEDHN
N#Cc1ccc(N2CC[C@@H](N3CCCc4ccccc4CC3)C2=O)cc1	ZINC001307775198	1384030555	/nfs/dbraw/zinc/03/05/55/1384030555.db2.gz	ZJOPHPGEIMUJRH-OAQYLSRUSA-N	0	3	345.446	3.154	20	30		EGEDHN
C[C@H](COCC1CCCCC1)N[C@H](C)C(=O)Nc1cccc(C#N)c1	ZINC001308093388	1384090211	/nfs/dbraw/zinc/09/02/11/1384090211.db2.gz	UEQHDFWBBFGMEA-HZPDHXFCSA-N	0	3	343.471	3.460	20	30		EGEDHN
Cc1ccc(C(=NO)Nc2ccc([C@H]3CCCCN3C)cn2)nc1	ZINC001169405756	1384144652	/nfs/dbraw/zinc/14/46/52/1384144652.db2.gz	XLDUIFYZTRCEKK-MRXNPFEDSA-N	0	3	325.416	3.190	20	30		EGEDHN
C=CCCC(=O)N[C@@H](C)CCCCNCc1cc(F)ccc1C#N	ZINC001169704468	1384175296	/nfs/dbraw/zinc/17/52/96/1384175296.db2.gz	BOAGXPJGEZGUGY-HNNXBMFYSA-N	0	3	331.435	3.428	20	30		EGEDHN
C[C@H](CCCCNC/C(Cl)=C/Cl)NC(=O)c1cc(C#N)c[nH]1	ZINC001170043817	1384224427	/nfs/dbraw/zinc/22/44/27/1384224427.db2.gz	SKRKSKUJQHIZSG-NUBYWOLOSA-N	0	3	343.258	3.084	20	30		EGEDHN
C[C@@H](CCCCNC/C(Cl)=C\Cl)NC(=O)c1cc(C#N)c[nH]1	ZINC001170043815	1384224709	/nfs/dbraw/zinc/22/47/09/1384224709.db2.gz	SKRKSKUJQHIZSG-DELQEKLWSA-N	0	3	343.258	3.084	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)C=C1CCC1	ZINC001170143762	1384247678	/nfs/dbraw/zinc/24/76/78/1384247678.db2.gz	XGCJCKITTRZCKC-MRXNPFEDSA-N	0	3	325.456	3.433	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)C1=CCCC1	ZINC001170160596	1384251298	/nfs/dbraw/zinc/25/12/98/1384251298.db2.gz	DAVIRSOOXAFUFV-INIZCTEOSA-N	0	3	325.456	3.433	20	30		EGEDHN
CS[C@@H](C)CC(=O)N[C@@H](C)CCCCNCc1ccccc1C#N	ZINC001170230193	1384271049	/nfs/dbraw/zinc/27/10/49/1384271049.db2.gz	ACTTXVDUXOGMSB-HOTGVXAUSA-N	0	3	347.528	3.464	20	30		EGEDHN
C[C@H](N)c1ncc(-c2ccccc2)n1-c1cnc2[nH]cc(C#N)c2c1	ZINC001170686388	1384366244	/nfs/dbraw/zinc/36/62/44/1384366244.db2.gz	PYTVAEQEMFOREG-LBPRGKRZSA-N	0	3	328.379	3.307	20	30		EGEDHN
N=C(N[C@H]1CCc2ccc(Br)cc2C1)c1ccc(F)cn1	ZINC001170853400	1384399452	/nfs/dbraw/zinc/39/94/52/1384399452.db2.gz	HIJBKTVVEWWZIH-AWEZNQCLSA-N	0	3	348.219	3.246	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H](C)CCCCNCc1cc2n(n1)CCCC2	ZINC001171043088	1384435274	/nfs/dbraw/zinc/43/52/74/1384435274.db2.gz	IETBIGZEXLIOAF-QGZVFWFLSA-N	0	3	346.519	3.340	20	30		EGEDHN
C[C@@H](Cc1cccc(C#N)c1)N1CC2(C1)CCN(Cc1cccnc1)C2	ZINC001171212871	1384470341	/nfs/dbraw/zinc/47/03/41/1384470341.db2.gz	RBNHKRTZJITREX-SFHVURJKSA-N	0	3	346.478	3.092	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1C[C@@H]2CN(C(=O)OC(C)(C)C)[C@@H]2C1	ZINC001171232473	1384475492	/nfs/dbraw/zinc/47/54/92/1384475492.db2.gz	STKVSKJSEDFSJZ-ZTFGCOKTSA-N	0	3	341.455	3.040	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1ccc2c(c1)CCC=C2	ZINC001171362204	1384502550	/nfs/dbraw/zinc/50/25/50/1384502550.db2.gz	LRGVSOXPNAUISU-UHFFFAOYSA-N	0	3	349.272	3.264	20	30		EGEDHN
Cc1ccc(CC[C@@H](C)N2CCN(c3cc(C#N)ccn3)CC2)cc1	ZINC001171680323	1384600302	/nfs/dbraw/zinc/60/03/02/1384600302.db2.gz	QCRMKBJEGDBJIT-GOSISDBHSA-N	0	3	334.467	3.405	20	30		EGEDHN
CCCCCCCCCC(=O)NCCCNCc1cc(C)n(C)n1	ZINC001171864872	1384664375	/nfs/dbraw/zinc/66/43/75/1384664375.db2.gz	JWLILEKWVWQVII-UHFFFAOYSA-N	0	3	336.524	3.465	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CCCN(C(=O)c2ccccc2)CC1	ZINC001171870773	1384666543	/nfs/dbraw/zinc/66/65/43/1384666543.db2.gz	USZXGICRQIUQBA-HXUWFJFHSA-N	0	3	333.435	3.343	20	30		EGEDHN
N#CC1(CNC2CCN(c3ccc(Br)cc3)CC2)CC1	ZINC001171992932	1384707308	/nfs/dbraw/zinc/70/73/08/1384707308.db2.gz	RJPCAPSHWLUMAS-UHFFFAOYSA-N	0	3	334.261	3.311	20	30		EGEDHN
CCCCCCCN1CC[C@H](NC(=O)c2c(C)nn(C)c2Cl)C1	ZINC001316981738	1384739322	/nfs/dbraw/zinc/73/93/22/1384739322.db2.gz	QTRDMZBWZFECJX-AWEZNQCLSA-N	0	3	340.899	3.156	20	30		EGEDHN
COc1cccc(CN2CCN([C@@H](C)Cc3ccc(C#N)cc3)CC2)c1	ZINC001172310564	1384766396	/nfs/dbraw/zinc/76/63/96/1384766396.db2.gz	GGVQXCROFNEUBS-SFHVURJKSA-N	0	3	349.478	3.316	20	30		EGEDHN
CC[C@@H](N[C@H]1CCN(C(=O)OC(C)(C)C)[C@H](C#N)C1)c1ccccn1	ZINC001172972539	1384893663	/nfs/dbraw/zinc/89/36/63/1384893663.db2.gz	BAVJIZAJVFMFMB-HRCADAONSA-N	0	3	344.459	3.414	20	30		EGEDHN
C=CCOC1CCC(N2CCN(C(=O)OC(C)(C)C)C[C@@H]2C)CC1	ZINC001173322329	1384958982	/nfs/dbraw/zinc/95/89/82/1384958982.db2.gz	CABQHPHTNWQFPD-GTPINHCMSA-N	0	3	338.492	3.441	20	30		EGEDHN
N#Cc1coc(CNC2CCN(C(=O)c3ccc(Cl)cc3)CC2)c1	ZINC001173417026	1384968038	/nfs/dbraw/zinc/96/80/38/1384968038.db2.gz	LQAZSVXKNLSJEI-UHFFFAOYSA-N	0	3	343.814	3.199	20	30		EGEDHN
C=C(Br)CN[C@@H](C)CCNC(=O)c1sc(C)cc1C	ZINC001317395593	1385112894	/nfs/dbraw/zinc/11/28/94/1385112894.db2.gz	RGQQPFGKSKLUNO-NSHDSACASA-N	0	3	345.306	3.372	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)Cc1cccc(C)c1Cl	ZINC001317398516	1385114361	/nfs/dbraw/zinc/11/43/61/1385114361.db2.gz	DTFPRJJLMVOMDF-CYBMUJFWSA-N	0	3	329.271	3.428	20	30		EGEDHN
Cc1cnccc1Nc1cc(C#N)ccc1I	ZINC001174539435	1385117583	/nfs/dbraw/zinc/11/75/83/1385117583.db2.gz	DXYFYNAJNGQCPD-UHFFFAOYSA-N	0	3	335.148	3.032	20	30		EGEDHN
C=CCCCC(=O)N[C@@H](C)CCCCN[C@H](C)c1nnc(CC)[nH]1	ZINC001174979382	1385177982	/nfs/dbraw/zinc/17/79/82/1385177982.db2.gz	YPTXJROQVJKPGX-LSDHHAIUSA-N	0	3	335.496	3.049	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](C)CCCCNCc2cc(OC)no2)CC1	ZINC001175074661	1385190698	/nfs/dbraw/zinc/19/06/98/1385190698.db2.gz	YBBIPMKQDDLKCM-HNNXBMFYSA-N	0	3	349.475	3.194	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@H](C)CCCCNCc1ccn(CC)n1	ZINC001175082250	1385191501	/nfs/dbraw/zinc/19/15/01/1385191501.db2.gz	MYHDUZVOVAFPDE-VQIMIIECSA-N	0	3	334.508	3.270	20	30		EGEDHN
Cc1ccc(C(=O)NCCCNCc2ccc(C#N)cc2F)c(C)c1	ZINC001175105232	1385195593	/nfs/dbraw/zinc/19/55/93/1385195593.db2.gz	GEDHDZCVRWBSOK-UHFFFAOYSA-N	0	3	339.414	3.224	20	30		EGEDHN
Cc1ccc(C(=O)NCCCNCc2cc(C#N)ccc2F)cc1C	ZINC001175134788	1385200061	/nfs/dbraw/zinc/20/00/61/1385200061.db2.gz	SRTFUCOYOFDNAR-UHFFFAOYSA-N	0	3	339.414	3.224	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)C1(CF)CCC1	ZINC001175340867	1385257773	/nfs/dbraw/zinc/25/77/73/1385257773.db2.gz	BAKGWJWVOBNDCO-MRXNPFEDSA-N	0	3	345.462	3.463	20	30		EGEDHN
CC1=CC[C@](C)(C(=O)NCCCNCc2ccc(C#N)cc2F)CC1	ZINC001176744136	1385679371	/nfs/dbraw/zinc/67/93/71/1385679371.db2.gz	GOEVFNLHOURAGJ-FQEVSTJZSA-N	0	3	343.446	3.430	20	30		EGEDHN
C=C[C@H](C(=O)NCCCNCc1nc(C)c(C)s1)c1ccccc1	ZINC001176779016	1385693358	/nfs/dbraw/zinc/69/33/58/1385693358.db2.gz	SQBOBZVXUMPLAW-KRWDZBQOSA-N	0	3	343.496	3.326	20	30		EGEDHN
CCc1ccsc1C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001176839611	1385720541	/nfs/dbraw/zinc/72/05/41/1385720541.db2.gz	ZFFWCIIRJNAYRL-UHFFFAOYSA-N	0	3	345.443	3.231	20	30		EGEDHN
N#Cc1ccccc1CNCCCN(CC1CCCC1)C(=O)C1CC1	ZINC001177178422	1385846374	/nfs/dbraw/zinc/84/63/74/1385846374.db2.gz	KOEQFGSDXCKMBC-UHFFFAOYSA-N	0	3	339.483	3.467	20	30		EGEDHN
CC1CCC(C)(C(=O)NCCCNCc2ccccc2C#N)CC1	ZINC001177201971	1385861084	/nfs/dbraw/zinc/86/10/84/1385861084.db2.gz	WCLNABAWGCCXTP-UHFFFAOYSA-N	0	3	327.472	3.371	20	30		EGEDHN
C#CCC1(C(=O)NCCCNCC=C(Cl)Cl)CCCCC1	ZINC001177224023	1385874641	/nfs/dbraw/zinc/87/46/41/1385874641.db2.gz	OBRNHUAHMNSQQO-UHFFFAOYSA-N	0	3	331.287	3.375	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@@H]1CCCCO1	ZINC001177281075	1385895568	/nfs/dbraw/zinc/89/55/68/1385895568.db2.gz	HSRLYEIFMKNKGS-KRWDZBQOSA-N	0	3	342.911	3.307	20	30		EGEDHN
C=CCC[C@H](C(=O)NCCCNCc1cc(C)no1)c1ccccc1	ZINC001177548140	1385993518	/nfs/dbraw/zinc/99/35/18/1385993518.db2.gz	RHUWRFDSQQTEHK-IBGZPJMESA-N	0	3	341.455	3.329	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCCCCCN[C@@H](C)c1nc2ccccc2o1	ZINC001178053483	1386117643	/nfs/dbraw/zinc/11/76/43/1386117643.db2.gz	SRCJCAPEHSTUPE-CABCVRRESA-N	0	3	342.443	3.315	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CC[C@H](NCC#Cc2ccc(Cl)cc2)[C@@H]1C	ZINC001178134419	1386138403	/nfs/dbraw/zinc/13/84/03/1386138403.db2.gz	CWJHMOPQXBAYAO-VKJFTORMSA-N	0	3	332.875	3.317	20	30		EGEDHN
CCCCC(=O)N1CC[C@H](NCC#Cc2ccccc2Cl)[C@@H]1C	ZINC001178140087	1386140121	/nfs/dbraw/zinc/14/01/21/1386140121.db2.gz	VWFGCPBFDOVIJS-YJBOKZPZSA-N	0	3	332.875	3.461	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](NCC#Cc2ccccc2Cl)[C@@H]1C	ZINC001178312441	1386186323	/nfs/dbraw/zinc/18/63/23/1386186323.db2.gz	ZYYGOAHPDUVFMP-YJBOKZPZSA-N	0	3	330.859	3.237	20	30		EGEDHN
Cc1cc[nH]c1C(=O)NCCCCCCNCc1ccccc1C#N	ZINC001178364741	1386197588	/nfs/dbraw/zinc/19/75/88/1386197588.db2.gz	JMCQJBGHBPNQCJ-UHFFFAOYSA-N	0	3	338.455	3.275	20	30		EGEDHN
C/C=C(\C)C(=O)N1CC[C@H](NCC#Cc2ccc(Cl)cc2)[C@@H]1C	ZINC001178437697	1386217451	/nfs/dbraw/zinc/21/74/51/1386217451.db2.gz	NEDWMVUJBOBKMS-ZGTQULCZSA-N	0	3	330.859	3.237	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](NCc2cccc(Cl)n2)[C@@H]1C	ZINC001178503812	1386238109	/nfs/dbraw/zinc/23/81/09/1386238109.db2.gz	RDPVSXXWZVCTRY-HOCLYGCPSA-N	0	3	333.863	3.008	20	30		EGEDHN
CCCC(=O)N1CCC(CCN(C)Cc2ccc(C#N)s2)CC1	ZINC001319868068	1386346815	/nfs/dbraw/zinc/34/68/15/1386346815.db2.gz	IPNSUYDTMNRCSE-UHFFFAOYSA-N	0	3	333.501	3.480	20	30		EGEDHN
N#Cc1ccccc1CNCCCCCCNC(=O)C1(CCF)CC1	ZINC001179118594	1386404068	/nfs/dbraw/zinc/40/40/68/1386404068.db2.gz	LJOBATVRQMXVLI-UHFFFAOYSA-N	0	3	345.462	3.464	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)NCCCCCCNCc1ccccc1C#N	ZINC001179302083	1386442585	/nfs/dbraw/zinc/44/25/85/1386442585.db2.gz	KEKNQRZXFYZBDF-GOSISDBHSA-N	0	3	333.451	3.319	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCCCCCNCc1ccn(CC)n1	ZINC001179306329	1386445333	/nfs/dbraw/zinc/44/53/33/1386445333.db2.gz	HDJIAEKLMJXEQP-SJORKVTESA-N	0	3	334.508	3.127	20	30		EGEDHN
CC[C@H](F)C(=O)N1CC[C@H](NCC#Cc2cccc(Cl)c2)[C@@H]1C	ZINC001179314693	1386448336	/nfs/dbraw/zinc/44/83/36/1386448336.db2.gz	ZIRNQRNAQKAXMA-JQFCIGGWSA-N	0	3	336.838	3.019	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCCCCCCNCc1nccn1CC	ZINC001179340119	1386456684	/nfs/dbraw/zinc/45/66/84/1386456684.db2.gz	TXSAMKUDEJCXBW-KRWDZBQOSA-N	0	3	334.508	3.272	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H](NCc2ccc(C#N)s2)[C@@H]1C	ZINC001179381276	1386468038	/nfs/dbraw/zinc/46/80/38/1386468038.db2.gz	WUZVNXPLIXDFDD-KEYYUXOJSA-N	0	3	331.485	3.301	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2Cl)CCN1C(=O)[C@H]1CC12CC2	ZINC001179598219	1386528533	/nfs/dbraw/zinc/52/85/33/1386528533.db2.gz	BWXBZEKLIQQPCI-LESCRADOSA-N	0	3	342.870	3.071	20	30		EGEDHN
CCC(CC)CC(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C	ZINC001179790474	1386586996	/nfs/dbraw/zinc/58/69/96/1386586996.db2.gz	BLQWBVPUYZJXGO-PXNSSMCTSA-N	0	3	326.484	3.443	20	30		EGEDHN
CCN(CCN[C@H](C)c1ccc(F)c(Cl)c1)C(=O)[C@@H](C)C#N	ZINC001320694502	1386694564	/nfs/dbraw/zinc/69/45/64/1386694564.db2.gz	NUCHZYFZDBWMQX-NWDGAFQWSA-N	0	3	325.815	3.138	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@H]2CC2(C)C)C[C@@]1(C)CNCc1ccccc1C#N	ZINC001181142477	1386944698	/nfs/dbraw/zinc/94/46/98/1386944698.db2.gz	GGYKVIBLZSHBTP-FQELHTAISA-N	0	3	339.483	3.179	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](NCc2ccc(Br)s2)C1	ZINC001181542930	1387013845	/nfs/dbraw/zinc/01/38/45/1387013845.db2.gz	HOAOVUPNUYLVIK-LLVKDONJSA-N	0	3	343.290	3.167	20	30		EGEDHN
N#CCOc1cccc(CNCc2ccc(Oc3cnccn3)cc2)c1	ZINC001322144095	1387072825	/nfs/dbraw/zinc/07/28/25/1387072825.db2.gz	GNUCKKLVMMTMPB-UHFFFAOYSA-N	0	3	346.390	3.461	20	30		EGEDHN
CC[C@H](F)C(=O)N1C[C@@H](C)[C@](C)(CNCc2cc(F)ccc2C#N)C1	ZINC001182208577	1387120864	/nfs/dbraw/zinc/12/08/64/1387120864.db2.gz	WPTJEJXKQWWYAW-XVGQJIODSA-N	0	3	349.425	3.020	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2cnc(C)o2)C1	ZINC001182750612	1387218574	/nfs/dbraw/zinc/21/85/74/1387218574.db2.gz	OPYGUTRCEGKQDX-AUUYWEPGSA-N	0	3	333.476	3.160	20	30		EGEDHN
C#CC[C@H](CCOC)NCc1cnc(NC(=O)OC(C)(C)C)s1	ZINC001330109996	1389309674	/nfs/dbraw/zinc/30/96/74/1389309674.db2.gz	ZCOGPFDCYMJPOD-GFCCVEGCSA-N	0	3	339.461	3.008	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CCC[C@@H]1CNCc1ccccc1F)OCC	ZINC001698729641	1406380082	/nfs/dbraw/zinc/38/00/82/1406380082.db2.gz	DTHJTAMNLFXARJ-IEBWSBKVSA-N	0	3	348.462	3.278	20	30		EGEDHN
N#CCn1c(-c2nc([C@H]3CN4CCC3CC4)no2)cc2ccccc21	ZINC001337930178	1389486636	/nfs/dbraw/zinc/48/66/36/1389486636.db2.gz	UNUGRGOHWOXXST-HNNXBMFYSA-N	0	3	333.395	3.024	20	30		EGEDHN
Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@@H]1N2C(=O)c1ccc(C#N)cc1F	ZINC001338834752	1389784495	/nfs/dbraw/zinc/78/44/95/1389784495.db2.gz	PATSJHLLVNNMRC-PXNSSMCTSA-N	0	3	349.409	3.454	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccccc1-c1n[nH]c(C(C)C)n1	ZINC001340604478	1390326050	/nfs/dbraw/zinc/32/60/50/1390326050.db2.gz	IOYYCSPZJOPAFV-AWEZNQCLSA-N	0	3	327.432	3.217	20	30		EGEDHN
C[C@H](c1ccncc1)N1CCC(Nc2ccc(C#N)cc2CO)CC1	ZINC001333685250	1390374218	/nfs/dbraw/zinc/37/42/18/1390374218.db2.gz	OMGCGKPQGDTRJE-OAHLLOKOSA-N	0	3	336.439	3.083	20	30		EGEDHN
CC[C@]1(CCc2ccccc2)CCCN1C(=O)[C@@H](N)CCCC#N	ZINC001333729600	1390386525	/nfs/dbraw/zinc/38/65/25/1390386525.db2.gz	AUISBBFDRLWTTI-AZUAARDMSA-N	0	3	327.472	3.412	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N(C)Cc1cscc1Br	ZINC001341594455	1390507442	/nfs/dbraw/zinc/50/74/42/1390507442.db2.gz	SOZPHRQSPLFLCZ-LBPRGKRZSA-N	0	3	331.279	3.153	20	30		EGEDHN
C=C(C)Cn1c(CCCCC#N)nnc1N1C[C@@H](C)N(CC)C[C@@H]1C	ZINC001341940759	1390552282	/nfs/dbraw/zinc/55/22/82/1390552282.db2.gz	SFENYDQBQWXUQP-SJORKVTESA-N	0	3	344.507	3.009	20	30		EGEDHN
CCCc1c(C(=O)C(C#N)c2nccn2C)cnn1-c1ccccc1	ZINC001342924296	1390673176	/nfs/dbraw/zinc/67/31/76/1390673176.db2.gz	LHEKZQVCQBOSBF-OAHLLOKOSA-N	0	3	333.395	3.048	20	30		EGEDHN
C=C(C)Cn1c([C@H](C)CCC#N)nnc1N1C[C@H](C)N(CC)C[C@H]1C	ZINC001342964446	1390678414	/nfs/dbraw/zinc/67/84/14/1390678414.db2.gz	SFFROBXYRVEREV-IXDOHACOSA-N	0	3	344.507	3.180	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)NCc1cccc(NC(=O)C2CCCC2)c1	ZINC001343180916	1390697613	/nfs/dbraw/zinc/69/76/13/1390697613.db2.gz	QRSCSRACJUGKGO-SFHVURJKSA-N	0	3	343.471	3.115	20	30		EGEDHN
CC[C@@H](C)N1CCN(c2nnc(CCCCC#N)n2CC(C)C)CC1	ZINC001347585951	1391096606	/nfs/dbraw/zinc/09/66/06/1391096606.db2.gz	DANULMJBWCWIAS-QGZVFWFLSA-N	0	3	346.523	3.091	20	30		EGEDHN
N#Cc1cc(C(=O)N[C@H](CN2CCCC2)c2ccccc2)cs1	ZINC001347770273	1391122424	/nfs/dbraw/zinc/12/24/24/1391122424.db2.gz	DATPRTUCERLRLB-QGZVFWFLSA-N	0	3	325.437	3.187	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)N(C)C(=O)c1ccc(F)c(F)c1	ZINC001698827992	1406521260	/nfs/dbraw/zinc/52/12/60/1406521260.db2.gz	JQKNZYDQLSLJDE-LLVKDONJSA-N	0	3	349.406	3.148	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)N[C@@H](C)c1ccc2c(c1)CC(=O)N2	ZINC001353193218	1391956185	/nfs/dbraw/zinc/95/61/85/1391956185.db2.gz	TWNWGWYASSYDPF-YOEHRIQHSA-N	0	3	345.487	3.436	20	30		EGEDHN
Cc1ccc(C)c(CN2CC[C@@H](NC(=O)CC#Cc3ccccc3)C2)c1	ZINC001479971728	1392507564	/nfs/dbraw/zinc/50/75/64/1392507564.db2.gz	HVIORXLXCDKDFL-JOCHJYFZSA-N	0	3	346.474	3.436	20	30		EGEDHN
CCc1ccc(C(=O)NCCN(CC)Cc2ccc(C#N)cc2)cc1	ZINC001481015360	1393091632	/nfs/dbraw/zinc/09/16/32/1393091632.db2.gz	SUVIPPUACMRGDL-UHFFFAOYSA-N	0	3	335.451	3.373	20	30		EGEDHN
CCCN(CCNC(=O)c1cccs1)Cc1cccc(C#N)c1	ZINC001481129310	1393128058	/nfs/dbraw/zinc/12/80/58/1393128058.db2.gz	KOMVXIDAXPTVMW-UHFFFAOYSA-N	0	3	327.453	3.262	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1CCN([C@@H](C)c2ccc3c(c2)CCC3)C1	ZINC001481696937	1394458048	/nfs/dbraw/zinc/45/80/48/1394458048.db2.gz	LSVPPKQLKBAHQC-JXFKEZNVSA-N	0	3	342.483	3.020	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2ncccc2C)CCCC[C@H]1C	ZINC001481957842	1394619623	/nfs/dbraw/zinc/61/96/23/1394619623.db2.gz	SFYYBTGJEUCAHX-RDTXWAMCSA-N	0	3	335.879	3.411	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)c1cccc2cc[nH]c21	ZINC001482141624	1394766679	/nfs/dbraw/zinc/76/66/79/1394766679.db2.gz	FXPMDARNKLAGNV-OAHLLOKOSA-N	0	3	346.434	3.195	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccc3c(c2)CCN3C)CCCC1	ZINC001482234193	1394829121	/nfs/dbraw/zinc/82/91/21/1394829121.db2.gz	RCZCTLTVADMBFE-UHFFFAOYSA-N	0	3	347.890	3.064	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1ccc(C2CC2)nc1C)C(C)C	ZINC001482552077	1395085509	/nfs/dbraw/zinc/08/55/09/1395085509.db2.gz	BXOTYQIBVXHXJT-QGZVFWFLSA-N	0	3	335.879	3.364	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cnc2ccc(F)cc2c1)C(C)C	ZINC001698978488	1406750863	/nfs/dbraw/zinc/75/08/63/1406750863.db2.gz	UAMGCAKYKDLRAP-QGZVFWFLSA-N	0	3	349.837	3.470	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cncc2ccccc21)C(C)C	ZINC001698980302	1406757093	/nfs/dbraw/zinc/75/70/93/1406757093.db2.gz	JAIDUMYPXRTPAI-QGZVFWFLSA-N	0	3	331.847	3.331	20	30		EGEDHN
C=C(Cl)CNCC1(c2ccccc2)CCN(C(=O)C2CC2)CC1	ZINC001484947007	1395597989	/nfs/dbraw/zinc/59/79/89/1395597989.db2.gz	RUWKTJOJYWXSQK-UHFFFAOYSA-N	0	3	332.875	3.299	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1cnn2ccccc12	ZINC001689908288	1404200235	/nfs/dbraw/zinc/20/02/35/1404200235.db2.gz	BCYKXLNNJMAYSB-ZBFHGGJFSA-N	0	3	346.862	3.060	20	30		EGEDHN
C[C@H](CNC(=O)C12CCC(CC1)CC2)NCc1ccc(F)c(C#N)c1	ZINC001690650995	1404682477	/nfs/dbraw/zinc/68/24/77/1404682477.db2.gz	WCECVVJETYVMCP-ZUIJCZDSSA-N	0	3	343.446	3.262	20	30		EGEDHN
CC1(C(=O)NC[C@H]2C[C@H](NCc3ccc(C#N)cc3F)C2)CCCC1	ZINC001691158383	1405092540	/nfs/dbraw/zinc/09/25/40/1405092540.db2.gz	BTLGFDBVSPGGRJ-JCNLHEQBSA-N	0	3	343.446	3.262	20	30		EGEDHN
CCC(CC)C(=O)NC[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001691768858	1405481391	/nfs/dbraw/zinc/48/13/91/1405481391.db2.gz	ZGQWEPPOCDFOJQ-CZIWCDLHSA-N	0	3	331.435	3.118	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](CCNC(=O)c3ccsc3)C2)s1	ZINC001691872943	1405595848	/nfs/dbraw/zinc/59/58/48/1405595848.db2.gz	PBPUTWAVFDEAJZ-ZDUSSCGKSA-N	0	3	345.493	3.323	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)C[C@@H](C)c2ccc(OC)cc2)C1	ZINC001692159749	1405813107	/nfs/dbraw/zinc/81/31/07/1405813107.db2.gz	JRLOAZUKBCPMIE-AEFFLSMTSA-N	0	3	330.472	3.346	20	30		EGEDHN
CC[C@H](CNC(=O)c1c(C)oc(C)c1C)NCc1ccc(C#N)s1	ZINC001698606281	1406234039	/nfs/dbraw/zinc/23/40/39/1406234039.db2.gz	PXXVQTVJPKEBRV-CQSZACIVSA-N	0	3	345.468	3.436	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCC1CCN(Cc2cccc(Cl)c2)CC1	ZINC001732320006	1428529870	/nfs/dbraw/zinc/52/98/70/1428529870.db2.gz	XXJKPNCYTXJCBS-CQSZACIVSA-N	0	3	333.863	3.218	20	30		EGEDHN
Cc1cccc(CC(=O)N[C@H](C)CN(C)Cc2cccc(C#N)c2)c1	ZINC001699458386	1412806548	/nfs/dbraw/zinc/80/65/48/1412806548.db2.gz	AAFKDJFOZQBBJH-QGZVFWFLSA-N	0	3	335.451	3.046	20	30		EGEDHN
CC(C)(F)C(=O)NC[C@@]1(C)CCCN(Cc2cccc(C#N)c2)C1	ZINC001699867183	1413307652	/nfs/dbraw/zinc/30/76/52/1413307652.db2.gz	UGOOLWFPXKQKLJ-LJQANCHMSA-N	0	3	331.435	3.025	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)NC[C@@]1(C)CCCN(Cc2cccc(C#N)c2)C1	ZINC001699869617	1413314838	/nfs/dbraw/zinc/31/48/38/1413314838.db2.gz	GEOJXEVLJPFMSH-WIYYLYMNSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1ccccc1OC1CCC1	ZINC001700327923	1413798476	/nfs/dbraw/zinc/79/84/76/1413798476.db2.gz	RAAFTALWRDXFNN-AWEZNQCLSA-N	0	3	336.863	3.468	20	30		EGEDHN
C=C(Br)CNCC(C)(C)CN(C)C(=O)C[C@H](C)C1CC1	ZINC001700448667	1414028526	/nfs/dbraw/zinc/02/85/26/1414028526.db2.gz	TYRVXDXVZMEYHE-LBPRGKRZSA-N	0	3	345.325	3.405	20	30		EGEDHN
C[C@H](CNC(=O)c1cc2ccccn2c1)N(C)Cc1ccc(C#N)cc1	ZINC001700478340	1414108844	/nfs/dbraw/zinc/10/88/44/1414108844.db2.gz	VZIBEXXYNOONFL-MRXNPFEDSA-N	0	3	346.434	3.061	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1ccc2cc[nH]c2n1	ZINC001712998397	1417550021	/nfs/dbraw/zinc/55/00/21/1417550021.db2.gz	GTQODNVVUSIZOV-BBRMVZONSA-N	0	3	346.862	3.288	20	30		EGEDHN
N#Cc1cc(CN2CC[C@@H](CCNC(=O)CCC3CC3)C2)ccc1F	ZINC001713726345	1418505944	/nfs/dbraw/zinc/50/59/44/1418505944.db2.gz	MPGPIBWGMIQRCL-MRXNPFEDSA-N	0	3	343.446	3.216	20	30		EGEDHN
C=C(Br)CNCC1(NC(=O)C2CCCC2)CCCC1	ZINC001714126858	1418931358	/nfs/dbraw/zinc/93/13/58/1418931358.db2.gz	XOHFKYYPAMXOKB-UHFFFAOYSA-N	0	3	329.282	3.104	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)c1ccsc1C	ZINC001714465977	1419194733	/nfs/dbraw/zinc/19/47/33/1419194733.db2.gz	IBYVODZWYGYYJS-SNVBAGLBSA-N	0	3	331.279	3.063	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)C[C@H](C)c2ccc(OC)cc2)C1	ZINC001714923212	1419676537	/nfs/dbraw/zinc/67/65/37/1419676537.db2.gz	JRLOAZUKBCPMIE-FUHWJXTLSA-N	0	3	330.472	3.346	20	30		EGEDHN
C=C(Br)CNC[C@](C)(NC(=O)C1CC(C)(C)C1)C1CC1	ZINC001715109801	1419852229	/nfs/dbraw/zinc/85/22/29/1419852229.db2.gz	PYROEBKCEMHACD-INIZCTEOSA-N	0	3	343.309	3.206	20	30		EGEDHN
CCCC1(C(=O)N2CC[C@@H](NCc3ccccc3C#N)[C@H](C)C2)CC1	ZINC001715064225	1419802087	/nfs/dbraw/zinc/80/20/87/1419802087.db2.gz	XBWMFENYJIJDSI-VQIMIIECSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)[C@@H]1CCCC1(C)C	ZINC001715243695	1419971511	/nfs/dbraw/zinc/97/15/11/1419971511.db2.gz	CDNJNCFBGVCNDH-QAPCUYQASA-N	0	3	327.472	3.226	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cnc(-c2ccccc2)[nH]1)C(C)C	ZINC001715501948	1420184452	/nfs/dbraw/zinc/18/44/52/1420184452.db2.gz	HKBFOWRUKNYBAV-OAHLLOKOSA-N	0	3	346.862	3.173	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@@H](NCc2ccc(C#N)cc2F)C(C)C)o1	ZINC001715518109	1420203904	/nfs/dbraw/zinc/20/39/04/1420203904.db2.gz	VITBWHPUNGSNCF-QGZVFWFLSA-N	0	3	343.402	3.143	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cnoc1-c1ccccc1)C(C)C	ZINC001715689148	1420295546	/nfs/dbraw/zinc/29/55/46/1420295546.db2.gz	DRYPJEPNYGEBIC-MRXNPFEDSA-N	0	3	347.846	3.438	20	30		EGEDHN
C[C@H](CN(C)Cc1cccc(C#N)c1)NC(=O)c1ccc2c(c1)CCC2	ZINC001716504383	1420734743	/nfs/dbraw/zinc/73/47/43/1420734743.db2.gz	LLTVCLDFEVRYGH-MRXNPFEDSA-N	0	3	347.462	3.297	20	30		EGEDHN
C[C@@]1(CNC(=O)c2ccoc2)CCCN(Cc2ccc(C#N)cc2)C1	ZINC001716891954	1421017290	/nfs/dbraw/zinc/01/72/90/1421017290.db2.gz	RTISBTLNTFTNHU-FQEVSTJZSA-N	0	3	337.423	3.183	20	30		EGEDHN
CCC1(C(=O)NC[C@@H](C)N(C)Cc2ccc(OCC#N)cc2)CCC1	ZINC001717483874	1421419242	/nfs/dbraw/zinc/41/92/42/1421419242.db2.gz	QQCXTWHTQYDFOF-MRXNPFEDSA-N	0	3	343.471	3.106	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@@](C)(CNCc3ccccc3C#N)C2)o1	ZINC001733416848	1429621221	/nfs/dbraw/zinc/62/12/21/1429621221.db2.gz	DIRGHLPPZCPWRV-FQEVSTJZSA-N	0	3	337.423	3.102	20	30		EGEDHN
C[C@H](C#N)C(=O)NCC1(C)CCN(Cc2ccc(Cl)cc2)CC1	ZINC001733445948	1429655481	/nfs/dbraw/zinc/65/54/81/1429655481.db2.gz	IBFJBRNQJQVRJR-CQSZACIVSA-N	0	3	333.863	3.218	20	30		EGEDHN
Cc1cccc(C(=O)N[C@H](C)CN(C)Cc2ccc(C#N)cc2)c1C	ZINC001722912983	1424243621	/nfs/dbraw/zinc/24/36/21/1424243621.db2.gz	GCUASTQJZRQFMH-MRXNPFEDSA-N	0	3	335.451	3.425	20	30		EGEDHN
CCC(CC)[C@H](C)C(=O)NCC1(NCc2ccc(C#N)cc2)CC1	ZINC001723531507	1424454116	/nfs/dbraw/zinc/45/41/16/1424454116.db2.gz	FIVXHTOOOQYDKZ-HNNXBMFYSA-N	0	3	327.472	3.369	20	30		EGEDHN
Cc1ccc(CCN2Cc3ccc(CNC(=O)[C@H](C)C#N)cc3C2)cc1	ZINC001724920952	1425304175	/nfs/dbraw/zinc/30/41/75/1425304175.db2.gz	AMNITELPPDNTBI-QGZVFWFLSA-N	0	3	347.462	3.329	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)COc1ccsc1	ZINC001731290536	1427232814	/nfs/dbraw/zinc/23/28/14/1427232814.db2.gz	AAPRPKNZFMZBGS-UKRRQHHQSA-N	0	3	342.892	3.239	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCN(C)Cc1ccc(-c2ccsc2)cc1	ZINC001731766992	1427875537	/nfs/dbraw/zinc/87/55/37/1427875537.db2.gz	QYONRDRYILPWOP-CQSZACIVSA-N	0	3	327.453	3.123	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)CC2(C)CC2)CCN1Cc1cccc(C#N)c1	ZINC001733902545	1437720402	/nfs/dbraw/zinc/72/04/02/1437720402.db2.gz	VKCIHKYEGHWYOE-CRAIPNDOSA-N	0	3	325.456	3.218	20	30		EGEDHN
C=C(Br)CNC[C@@H](C1CC1)N(C)C(=O)c1cccs1	ZINC001734291707	1438021586	/nfs/dbraw/zinc/02/15/86/1438021586.db2.gz	GDIZFRSFZMIYST-LBPRGKRZSA-N	0	3	343.290	3.097	20	30		EGEDHN
COc1ccc(CN[C@@H]2C[C@H](C)N(C(=O)CCC(C)C)C2)cc1C#N	ZINC001734407130	1438085079	/nfs/dbraw/zinc/08/50/79/1438085079.db2.gz	SZFLERHMFCBMQP-MAUKXSAKSA-N	0	3	343.471	3.082	20	30		EGEDHN
C=C(Br)CNC[C@H](NC(=O)C1(C)CCC1)C(C)(C)C	ZINC001734569812	1438164452	/nfs/dbraw/zinc/16/44/52/1438164452.db2.gz	OFAQPTAPTLLNKZ-LBPRGKRZSA-N	0	3	331.298	3.206	20	30		EGEDHN
C=CCCC(=O)N(C)C1CCN(CCOCc2ccccc2)CC1	ZINC001752295615	1440167037	/nfs/dbraw/zinc/16/70/37/1440167037.db2.gz	SUMMHYJFZWHWCB-UHFFFAOYSA-N	0	3	330.472	3.092	20	30		EGEDHN
C=C(C)CN1CCN(CCCNC(=O)CC2(C)CCCCC2)CC1	ZINC001752350099	1440171869	/nfs/dbraw/zinc/17/18/69/1440171869.db2.gz	VMWLAKBDYNDWLB-UHFFFAOYSA-N	0	3	335.536	3.047	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1CC12CCN(Cc1cccc(C#N)c1)CC2	ZINC001752422704	1440176170	/nfs/dbraw/zinc/17/61/70/1440176170.db2.gz	ZADHBLSLQHWRLV-FQEVSTJZSA-N	0	3	349.478	3.223	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CC12CCN(Cc1cnc(C)s1)CC2	ZINC001752426749	1440177244	/nfs/dbraw/zinc/17/72/44/1440177244.db2.gz	KMMVHTKJFHMAHT-MRXNPFEDSA-N	0	3	333.501	3.279	20	30		EGEDHN
C=C(C)CN1CCC(N(CCC)C(=O)Cc2ccncc2C)CC1	ZINC001752433167	1440179383	/nfs/dbraw/zinc/17/93/83/1440179383.db2.gz	CWYMLPOGOSOFHV-UHFFFAOYSA-N	0	3	329.488	3.212	20	30		EGEDHN
CC(C)C(C)(C)C(=O)NC[C@H](NCC#Cc1ccccc1)C1CC1	ZINC001752458696	1440183425	/nfs/dbraw/zinc/18/34/25/1440183425.db2.gz	HBQWLLOMFMUXLE-IBGZPJMESA-N	0	3	326.484	3.205	20	30		EGEDHN
C=CCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)COc1cccc(C)c1	ZINC001752545172	1440194957	/nfs/dbraw/zinc/19/49/57/1440194957.db2.gz	MOXKQOYTLYMRAV-HDICACEKSA-N	0	3	328.456	3.015	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](OC)C1CCCC1	ZINC001752544561	1440194960	/nfs/dbraw/zinc/19/49/60/1440194960.db2.gz	BXLYOEHLSBUFRA-YSHGAJCASA-N	0	3	334.504	3.222	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC[C@@H](CNCc2nc(C)sc2C)C1	ZINC001752798990	1440214682	/nfs/dbraw/zinc/21/46/82/1440214682.db2.gz	KAIIWZOZTDCLFR-INIZCTEOSA-N	0	3	335.517	3.444	20	30		EGEDHN
C=CCC1(C(=O)N2CCC[C@H](CNCc3oc(C)nc3C)C2)CCC1	ZINC001752806153	1440215832	/nfs/dbraw/zinc/21/58/32/1440215832.db2.gz	GBJXDMGGVVHQQO-QGZVFWFLSA-N	0	3	345.487	3.366	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H]1CCCCN1C[C@H]1CC(C)(C)CO1	ZINC001752826660	1440223811	/nfs/dbraw/zinc/22/38/11/1440223811.db2.gz	ALOPROUUJYLYSY-DLBZAZTESA-N	0	3	336.520	3.375	20	30		EGEDHN
C#CCCCC(=O)NC1CCC(NCc2oc(C(C)C)nc2C)CC1	ZINC001752848035	1440233010	/nfs/dbraw/zinc/23/30/10/1440233010.db2.gz	GMTUWLMGYOLFLA-UHFFFAOYSA-N	0	3	345.487	3.427	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC1CCC(N[C@@H](C)c2cnc(C)cn2)CC1	ZINC001752850159	1440233429	/nfs/dbraw/zinc/23/34/29/1440233429.db2.gz	MVKOBGNFCFMPED-GTPINHCMSA-N	0	3	344.503	3.465	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)C1(Cc2ccccc2F)CC1	ZINC001753015658	1440268358	/nfs/dbraw/zinc/26/83/58/1440268358.db2.gz	SHRXOOKQNYLVNZ-CQSZACIVSA-N	0	3	338.854	3.385	20	30		EGEDHN
C[C@@H](C(=O)NCCC[C@H]1CCCN1Cc1ccccc1C#N)C1CC1	ZINC001753025648	1440271234	/nfs/dbraw/zinc/27/12/34/1440271234.db2.gz	YKQRJSRJKUCNHU-UZLBHIALSA-N	0	3	339.483	3.465	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCN(C)[C@H](CC)c2ccc(F)cc2)cn1	ZINC001753071166	1440288422	/nfs/dbraw/zinc/28/84/22/1440288422.db2.gz	BLMJBRSYXRVUOI-LJQANCHMSA-N	0	3	339.414	3.015	20	30		EGEDHN
CCN(CCNC(=O)C(C)(C)C(F)(F)F)Cc1ccc(C#N)cc1	ZINC001753093390	1440300691	/nfs/dbraw/zinc/30/06/91/1440300691.db2.gz	UFVUYFSIOLTNSR-UHFFFAOYSA-N	0	3	341.377	3.085	20	30		EGEDHN
C#CCCCC(=O)NC[C@@H]1CCCN1CCOc1ccc(Cl)cc1	ZINC001753105964	1440306250	/nfs/dbraw/zinc/30/62/50/1440306250.db2.gz	SXEMMIQDAAAOJP-KRWDZBQOSA-N	0	3	348.874	3.103	20	30		EGEDHN
CC#CCN(CCC)CCNC(=O)c1c2ccccc2oc1CC	ZINC001753150920	1440328142	/nfs/dbraw/zinc/32/81/42/1440328142.db2.gz	UEYBOGGWYRYXKV-UHFFFAOYSA-N	0	3	326.440	3.460	20	30		EGEDHN
C=C(C)CN(CCNC(=O)c1cccc(-c2cnco2)c1)C1CC1	ZINC001753161451	1440334023	/nfs/dbraw/zinc/33/40/23/1440334023.db2.gz	FPLLULHPMGAPSR-UHFFFAOYSA-N	0	3	325.412	3.112	20	30		EGEDHN
CCCCC(=O)N1CCC([C@H](C)NCc2ccccc2C#N)CC1	ZINC001753270133	1440345311	/nfs/dbraw/zinc/34/53/11/1440345311.db2.gz	KBWQOLKVDBANPP-INIZCTEOSA-N	0	3	327.472	3.465	20	30		EGEDHN
CC(C)N(CCCNC(=O)C#CC(C)(C)C)Cc1cc(C2CC2)no1	ZINC001753285222	1440348623	/nfs/dbraw/zinc/34/86/23/1440348623.db2.gz	BPRCDMAGGIPBGD-UHFFFAOYSA-N	0	3	345.487	3.318	20	30		EGEDHN
CC(C)[C@H](F)C(=O)NCCCN(Cc1ccc(C#N)s1)C(C)C	ZINC001753291213	1440350303	/nfs/dbraw/zinc/35/03/03/1440350303.db2.gz	ZLQZMRPKSSHTBB-INIZCTEOSA-N	0	3	339.480	3.331	20	30		EGEDHN
COCCN[C@@H](CNC(=O)C#CC(C)(C)C)c1ccc(C(C)C)cc1	ZINC001753294721	1440351706	/nfs/dbraw/zinc/35/17/06/1440351706.db2.gz	TXALFXRXWODYBD-IBGZPJMESA-N	0	3	344.499	3.253	20	30		EGEDHN
C#CCCN[C@H](CNC(=O)Cc1ccoc1)c1ccc(C(C)C)cc1	ZINC001753294893	1440351893	/nfs/dbraw/zinc/35/18/93/1440351893.db2.gz	XCFUXXQDXZQGCS-HXUWFJFHSA-N	0	3	338.451	3.416	20	30		EGEDHN
C=C(C)CN[C@@H](CNC(=O)Cc1ccn(C(C)C)n1)c1ccccc1	ZINC001753299775	1440353550	/nfs/dbraw/zinc/35/35/50/1440353550.db2.gz	HMWNURIAICFGSV-IBGZPJMESA-N	0	3	340.471	3.030	20	30		EGEDHN
C#CCCN[C@H](CNC(=O)c1coc(C(F)F)c1)c1ccccc1	ZINC001753301290	1440354034	/nfs/dbraw/zinc/35/40/34/1440354034.db2.gz	FDTMMTSFLUZDJI-OAHLLOKOSA-N	0	3	332.350	3.301	20	30		EGEDHN
C#CCCN[C@H](CNC(=O)C1(c2ccccc2)CC1)c1ccccc1	ZINC001753303241	1440354813	/nfs/dbraw/zinc/35/48/13/1440354813.db2.gz	UNSCFXXSOJVWGZ-HXUWFJFHSA-N	0	3	332.447	3.189	20	30		EGEDHN
C=CC1(CC(=O)NC[C@H](NC[C@H](C)O)c2ccccc2)CCCCC1	ZINC001753309027	1440356109	/nfs/dbraw/zinc/35/61/09/1440356109.db2.gz	AWBFZUUWMUHYPV-HKUYNNGSSA-N	0	3	344.499	3.341	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CCC)C(=O)c2ccc3c(c2)ncn3C)C1	ZINC001753317934	1440360797	/nfs/dbraw/zinc/36/07/97/1440360797.db2.gz	YSWIIBQQQRAXCP-KRWDZBQOSA-N	0	3	340.471	3.076	20	30		EGEDHN
C=CCOCCN1CC[C@@H](N(CCC)C(=O)c2ccc(C)cc2C)C1	ZINC001753322956	1440364970	/nfs/dbraw/zinc/36/49/70/1440364970.db2.gz	KWZYVDSNTZHARR-LJQANCHMSA-N	0	3	344.499	3.433	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CCC)C(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)C1	ZINC001753324218	1440365503	/nfs/dbraw/zinc/36/55/03/1440365503.db2.gz	ZTNPJQKCKAAPID-HSALFYBXSA-N	0	3	342.458	3.265	20	30		EGEDHN
C#CCCN1CC[C@H](N(CCC)C(=O)[C@@H](C)OC2CCCCCC2)C1	ZINC001753328920	1440368312	/nfs/dbraw/zinc/36/83/12/1440368312.db2.gz	QJLCZNWOSXXBGA-MOPGFXCFSA-N	0	3	348.531	3.451	20	30		EGEDHN
COCC#CCN1CC[C@@H](CCNC(=O)C[C@@H]2CCCCC2(C)C)C1	ZINC001753341358	1440375754	/nfs/dbraw/zinc/37/57/54/1440375754.db2.gz	WHKWFYLFKMSOEA-MOPGFXCFSA-N	0	3	348.531	3.071	20	30		EGEDHN
C=CCC1(C(=O)NCC2CN(C[C@H]3CC[C@H](C)O3)C2)CCCCC1	ZINC001753417380	1440394621	/nfs/dbraw/zinc/39/46/21/1440394621.db2.gz	OJZMXBXSODQATA-FUHWJXTLSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCC1(C(=O)N(C)[C@H]2CCN(C[C@@H]3CCCCO3)C2)CCCC1	ZINC001753451168	1440405949	/nfs/dbraw/zinc/40/59/49/1440405949.db2.gz	YMQPDQWXRPRIDQ-ROUUACIJSA-N	0	3	334.504	3.225	20	30		EGEDHN
CC[C@@H](CNC(=O)CCc1cccc(C)c1)NCC#Cc1ccccc1	ZINC001753481312	1440416642	/nfs/dbraw/zinc/41/66/42/1440416642.db2.gz	NVWPBZKBNVCTBZ-QFIPXVFZSA-N	0	3	348.490	3.464	20	30		EGEDHN
CC/C(C)=C/C(=O)N[C@@](C)(CNCc1ccc(C#N)cc1F)C1CC1	ZINC001753515728	1440427331	/nfs/dbraw/zinc/42/73/31/1440427331.db2.gz	GIESNQKHDDGGML-PCLFDXGNSA-N	0	3	343.446	3.428	20	30		EGEDHN
CC/C(C)=C\C(=O)N[C@](C)(CNCc1ccc(C#N)cc1F)C1CC1	ZINC001753515727	1440427358	/nfs/dbraw/zinc/42/73/58/1440427358.db2.gz	GIESNQKHDDGGML-KRBJHKROSA-N	0	3	343.446	3.428	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)CCc1scnc1C)C1CC1	ZINC001753525621	1440429484	/nfs/dbraw/zinc/42/94/84/1440429484.db2.gz	DXIBKLQBBBJYKW-MRXNPFEDSA-N	0	3	341.908	3.011	20	30		EGEDHN
C[C@H]1CCCC[C@]1(CNCC#Cc1ccccc1)NC(=O)C(C)(C)F	ZINC001753530029	1440430700	/nfs/dbraw/zinc/43/07/00/1440430700.db2.gz	NKIWBCPNMNIHCF-LAUBAEHRSA-N	0	3	344.474	3.441	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H](CCNCc2ocnc2C)C1	ZINC001753554789	1440435766	/nfs/dbraw/zinc/43/57/66/1440435766.db2.gz	HOWLIQCWWZTYBN-LPHOPBHVSA-N	0	3	333.476	3.304	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@@H](CCNCc3ocnc3C)C2)CC1	ZINC001753555278	1440435880	/nfs/dbraw/zinc/43/58/80/1440435880.db2.gz	RORWMTHUHDXWHJ-KRWDZBQOSA-N	0	3	345.487	3.448	20	30		EGEDHN
C#CCNCc1ccc(CNC(=O)c2ccc3nc(C)ccc3c2)cc1	ZINC001753591875	1440443110	/nfs/dbraw/zinc/44/31/10/1440443110.db2.gz	QMTIWJOHVRDRIP-UHFFFAOYSA-N	0	3	343.430	3.196	20	30		EGEDHN
C[C@@H](NC[C@H](C)CNC(=O)C#CC(C)(C)C)c1nc2ccccc2o1	ZINC001753612855	1440449277	/nfs/dbraw/zinc/44/92/77/1440449277.db2.gz	LJZWQSPWIXVVBW-LSDHHAIUSA-N	0	3	341.455	3.280	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H](C)CNCc2ccccc2C#N)CCC1	ZINC001753630462	1440452082	/nfs/dbraw/zinc/45/20/82/1440452082.db2.gz	QCPVXPPMKNFVCS-INIZCTEOSA-N	0	3	325.456	3.147	20	30		EGEDHN
C#CCC1(C(=O)NC[C@H](C)CNCc2csc(C)n2)CCCCC1	ZINC001753644499	1440455359	/nfs/dbraw/zinc/45/53/59/1440455359.db2.gz	HKOHWOUTWMGVIB-OAHLLOKOSA-N	0	3	347.528	3.267	20	30		EGEDHN
COc1cccc(CNC2(CNC(=O)[C@H](C)C#N)CCCC2)c1Cl	ZINC001753661844	1440458998	/nfs/dbraw/zinc/45/89/98/1440458998.db2.gz	XSMYGHDTXVFVIE-CYBMUJFWSA-N	0	3	349.862	3.027	20	30		EGEDHN
C#CCCCC(=O)N1CCC2(CN(Cc3ccc(CF)cc3)C2)CC1	ZINC001753673205	1440462734	/nfs/dbraw/zinc/46/27/34/1440462734.db2.gz	AXIIUEQLGLVDEY-UHFFFAOYSA-N	0	3	342.458	3.384	20	30		EGEDHN
Cc1ccsc1C(=O)N(C)[C@@H](C)CNCc1ccc(C#N)c(F)c1	ZINC001753676678	1440463455	/nfs/dbraw/zinc/46/34/55/1440463455.db2.gz	GELQBCNLGSRSIK-ZDUSSCGKSA-N	0	3	345.443	3.318	20	30		EGEDHN
CC(C)C[C@@H](CNCc1ccc(F)c(C#N)c1)NC(=O)C(C)(C)F	ZINC001753731732	1440476174	/nfs/dbraw/zinc/47/61/74/1440476174.db2.gz	ZESMJBZJBOEDDA-HNNXBMFYSA-N	0	3	337.414	3.066	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCCCN1C(=O)Cc1ccccc1F	ZINC001753788158	1440488563	/nfs/dbraw/zinc/48/85/63/1440488563.db2.gz	NZIJKYVHYPLOSO-INIZCTEOSA-N	0	3	338.854	3.482	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H]([C@@H](C)NCc2nc(C)sc2C)C1	ZINC001753794038	1440489298	/nfs/dbraw/zinc/48/92/98/1440489298.db2.gz	JPPAQVZOAUMXJK-PBHICJAKSA-N	0	3	347.528	3.280	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H]([C@H](C)NCc2nc(C)sc2C)C1	ZINC001753794041	1440489349	/nfs/dbraw/zinc/48/93/49/1440489349.db2.gz	JPPAQVZOAUMXJK-YOEHRIQHSA-N	0	3	347.528	3.280	20	30		EGEDHN
CC[C@H](C)C(=O)NC[C@@H](NCC#Cc1cccc(Cl)c1)C(C)C	ZINC001753825290	1440498030	/nfs/dbraw/zinc/49/80/30/1440498030.db2.gz	VCDZEBVKMLTFJF-MAUKXSAKSA-N	0	3	334.891	3.468	20	30		EGEDHN
CCc1cccc(C(=O)NC[C@H](NCC#Cc2ccccc2)C(C)C)n1	ZINC001753831708	1440499852	/nfs/dbraw/zinc/49/98/52/1440499852.db2.gz	ZDDJVFSOUUIWMD-NRFANRHFSA-N	0	3	349.478	3.040	20	30		EGEDHN
Cc1cccc(CC(=O)NC[C@@H](NCC#Cc2ccccc2)C(C)C)c1	ZINC001753837011	1440501403	/nfs/dbraw/zinc/50/14/03/1440501403.db2.gz	IWBXFRDUTJNLEC-JOCHJYFZSA-N	0	3	348.490	3.320	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)[C@@H](C)Cc1ccccc1F)C(C)C	ZINC001753837595	1440501541	/nfs/dbraw/zinc/50/15/41/1440501541.db2.gz	GRSYXPGLWGBFJQ-GUYCJALGSA-N	0	3	340.870	3.487	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N(C)CCN(C)[C@@H](C)c1ccc(F)cc1	ZINC001753865629	1440514155	/nfs/dbraw/zinc/51/41/55/1440514155.db2.gz	YODHRHIVBQTADR-SNRMKQJTSA-N	0	3	348.462	3.258	20	30		EGEDHN
C=C(Cl)CNCC[C@H](C)NC(=O)CCc1cc(F)ccc1F	ZINC001754025632	1440533090	/nfs/dbraw/zinc/53/30/90/1440533090.db2.gz	NSXODHIMHWLNPZ-LBPRGKRZSA-N	0	3	330.806	3.134	20	30		EGEDHN
CCN(CCNCc1cccc(C#N)c1)C(=O)CCc1ccccc1	ZINC001754078003	1440539023	/nfs/dbraw/zinc/53/90/23/1440539023.db2.gz	SBXBPNROGYLUAC-UHFFFAOYSA-N	0	3	335.451	3.129	20	30		EGEDHN
N#Cc1ccc(CNC/C=C/CNC(=O)c2cscc2Cl)cc1	ZINC001754134424	1440543797	/nfs/dbraw/zinc/54/37/97/1440543797.db2.gz	CXKLPTNZUMICKS-OWOJBTEDSA-N	0	3	345.855	3.349	20	30		EGEDHN
Cc1ccc(F)c(C(=O)NC/C=C/CNCc2cccc(C#N)c2)c1	ZINC001754175403	1440547463	/nfs/dbraw/zinc/54/74/63/1440547463.db2.gz	MCMQRBNGNFMVOL-NSCUHMNNSA-N	0	3	337.398	3.082	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H](C)CNCc2cc3ccccc3o2)cc1	ZINC001754237455	1440555092	/nfs/dbraw/zinc/55/50/92/1440555092.db2.gz	HOLOBHYNOBKEIV-OAHLLOKOSA-N	0	3	332.403	3.322	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](C)CNCC#Cc2ccccc2)sc1C	ZINC001754251701	1440558199	/nfs/dbraw/zinc/55/81/99/1440558199.db2.gz	HFCQSSINBLCPBQ-OAHLLOKOSA-N	0	3	326.465	3.125	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)NC(=O)c1cscc1Cl	ZINC001754272056	1440561505	/nfs/dbraw/zinc/56/15/05/1440561505.db2.gz	PXOLEUOQJODECT-VIFPVBQESA-N	0	3	339.873	3.243	20	30		EGEDHN
CC[C@H]1CC[C@H](C(=O)N[C@@H](C)CNCC#Cc2ccc(F)cc2)CC1	ZINC001754291910	1440565382	/nfs/dbraw/zinc/56/53/82/1440565382.db2.gz	FLJWVLRMYWKWNE-LNLFQRSKSA-N	0	3	344.474	3.488	20	30		EGEDHN
C[C@H](CN(C)Cc1cccc(C#N)c1)NC(=O)[C@@H](F)c1ccccc1	ZINC001754326821	1440581147	/nfs/dbraw/zinc/58/11/47/1440581147.db2.gz	RSFLUOFMYOLZJG-BEFAXECRSA-N	0	3	339.414	3.206	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H](C)CN(C)Cc1ccc2c(c1)COC2	ZINC001754329526	1440582735	/nfs/dbraw/zinc/58/27/35/1440582735.db2.gz	YRAVTXVLDOFRAE-OAHLLOKOSA-N	0	3	330.472	3.256	20	30		EGEDHN
C[C@H](CN(C)Cc1cccc(C#N)c1)NC(=O)C1(F)CCCCC1	ZINC001754330896	1440583576	/nfs/dbraw/zinc/58/35/76/1440583576.db2.gz	OTVFPAGVEQIFHQ-OAHLLOKOSA-N	0	3	331.435	3.167	20	30		EGEDHN
CN(CCCNCc1ccccc1C#N)C(=O)C[C@H]1CCC(F)(F)C1	ZINC001754377332	1440593039	/nfs/dbraw/zinc/59/30/39/1440593039.db2.gz	VEPMCGKVKSOVEU-OAHLLOKOSA-N	0	3	349.425	3.322	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)N(C)CCCNCc2ccc(C#N)cc2F)C1	ZINC001754400894	1440595254	/nfs/dbraw/zinc/59/52/54/1440595254.db2.gz	KHNVIZGNEDVKET-HOCLYGCPSA-N	0	3	331.435	3.072	20	30		EGEDHN
CC1(C)CC[C@@H]1C(=O)N[C@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001754448719	1440600443	/nfs/dbraw/zinc/60/04/43/1440600443.db2.gz	DPWAADWOIPBTHY-HZPDHXFCSA-N	0	3	331.485	3.040	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@H](CNCc1c(C)nsc1C)C1CC1	ZINC001754450135	1440600874	/nfs/dbraw/zinc/60/08/74/1440600874.db2.gz	HJIHPEODRFREDU-AEFFLSMTSA-N	0	3	335.517	3.347	20	30		EGEDHN
C=CCC[C@@H](C)N1CC[C@@H]1CNC(=O)c1cnoc1-c1ccco1	ZINC001754487940	1440609115	/nfs/dbraw/zinc/60/91/15/1440609115.db2.gz	SXGFNJHNGIULAL-ZIAGYGMSSA-N	0	3	329.400	3.093	20	30		EGEDHN
CCCCCCCN1CC[C@H]1CNC(=O)c1nncc2ccccc21	ZINC001754488409	1440609240	/nfs/dbraw/zinc/60/92/40/1440609240.db2.gz	CBDCXYDBRVNWIV-KRWDZBQOSA-N	0	3	340.471	3.404	20	30		EGEDHN
Cc1ccccc1[C@H](C)C(=O)NCC1(NCc2ccc(C#N)cc2)CC1	ZINC001754533997	1440623487	/nfs/dbraw/zinc/62/34/87/1440623487.db2.gz	BOWIIXFXQUAFJJ-KRWDZBQOSA-N	0	3	347.462	3.409	20	30		EGEDHN
C=CCCC(=O)N1CCCC[C@@H]1[C@H]1CCN(Cc2cccnc2)C1	ZINC001754539687	1440625781	/nfs/dbraw/zinc/62/57/81/1440625781.db2.gz	UKPFAYLTTLQDSU-RBUKOAKNSA-N	0	3	327.472	3.251	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@]3(CCN(Cc4ccccn4)C3)C2)CCC1	ZINC001754566691	1440635936	/nfs/dbraw/zinc/63/59/36/1440635936.db2.gz	AQBXNRUCZUSULU-HXUWFJFHSA-N	0	3	339.483	3.252	20	30		EGEDHN
CC1(C)CCC[C@@H]1C(=O)N1CCC[C@H]1CNCC#Cc1ccccc1	ZINC001754615355	1440644411	/nfs/dbraw/zinc/64/44/11/1440644411.db2.gz	LJDJOKQDPGCSPY-VQTJNVASSA-N	0	3	338.495	3.445	20	30		EGEDHN
CC1(C)CCC[C@H]1C(=O)N1CCC[C@H]1CNCC#Cc1ccccc1	ZINC001754615354	1440644450	/nfs/dbraw/zinc/64/44/50/1440644450.db2.gz	LJDJOKQDPGCSPY-PMACEKPBSA-N	0	3	338.495	3.445	20	30		EGEDHN
CC(F)(F)C1(C(=O)N2CCC[C@H]2CNCC#Cc2ccccc2)CC1	ZINC001754617569	1440644699	/nfs/dbraw/zinc/64/46/99/1440644699.db2.gz	HGLQEANWBNYUQG-KRWDZBQOSA-N	0	3	346.421	3.054	20	30		EGEDHN
C#CCCCC(=O)NC1(C)CCN(Cc2ccc(OC)c(C)c2)CC1	ZINC001754625684	1440646167	/nfs/dbraw/zinc/64/61/67/1440646167.db2.gz	DGMIQTJYYWXAHU-UHFFFAOYSA-N	0	3	342.483	3.278	20	30		EGEDHN
C#CCN(C(=O)[C@@H](C)c1ccccc1F)C1CCN(CC(=C)C)CC1	ZINC001754641681	1440649140	/nfs/dbraw/zinc/64/91/40/1440649140.db2.gz	JTZSFMVWGWBVQD-KRWDZBQOSA-N	0	3	342.458	3.432	20	30		EGEDHN
C=CCCC(=O)N1CCCC[C@@]2(CCN(Cc3cccnc3)C2)C1	ZINC001754660182	1440654513	/nfs/dbraw/zinc/65/45/13/1440654513.db2.gz	CKGAFRIQPONZRO-FQEVSTJZSA-N	0	3	327.472	3.252	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@]1(C)CCN(Cc2ccc3cc[nH]c3c2)C1	ZINC001754669383	1440657478	/nfs/dbraw/zinc/65/74/78/1440657478.db2.gz	AVYUMSNJMKMZBO-OAQYLSRUSA-N	0	3	337.467	3.298	20	30		EGEDHN
CC/C=C(\C)C(=O)N1CC[C@@](C)(CNCc2ccccc2C#N)C1	ZINC001754688766	1440665780	/nfs/dbraw/zinc/66/57/80/1440665780.db2.gz	BQGQXNBTADMYOE-QDGSLSSCSA-N	0	3	325.456	3.243	20	30		EGEDHN
C=CCN1CCC[C@](C)(CNC(=O)c2c(F)cc(F)cc2F)C1	ZINC001754729352	1440678162	/nfs/dbraw/zinc/67/81/62/1440678162.db2.gz	IJSRBLOFFBKGMF-QGZVFWFLSA-N	0	3	326.362	3.122	20	30		EGEDHN
C=CCN1CCC[C@@](C)(CNC(=O)c2ccncc2C(F)(F)F)C1	ZINC001754730961	1440679090	/nfs/dbraw/zinc/67/90/90/1440679090.db2.gz	AGNMOVNCGUADDG-INIZCTEOSA-N	0	3	341.377	3.118	20	30		EGEDHN
O=C(CCC(F)F)N[C@@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1ccccc1)C2	ZINC001754785971	1440687833	/nfs/dbraw/zinc/68/78/33/1440687833.db2.gz	TXJWVLASJYMHIO-KSZLIROESA-N	0	3	346.421	3.053	20	30		EGEDHN
CC/C=C(\C)C(=O)N1CC[C@H]([C@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001754787934	1440688163	/nfs/dbraw/zinc/68/81/63/1440688163.db2.gz	PWSHBRIKBCVHOW-BOOSFHONSA-N	0	3	343.446	3.380	20	30		EGEDHN
CC#CCNCCN(Cc1ccccc1)C(=O)c1cc(F)cc(F)c1	ZINC001754839404	1440697477	/nfs/dbraw/zinc/69/74/77/1440697477.db2.gz	PDCMYONQKVJKMG-UHFFFAOYSA-N	0	3	342.389	3.220	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@H]3CN(CCC(F)(F)F)C[C@H]3C2)CCCC1	ZINC001754848201	1440699809	/nfs/dbraw/zinc/69/98/09/1440699809.db2.gz	WBCMERHSAQLOAX-GASCZTMLSA-N	0	3	344.421	3.466	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)CCC(F)F)c1	ZINC001754869402	1440704456	/nfs/dbraw/zinc/70/44/56/1440704456.db2.gz	WUUOHEZPPSWCTJ-IAGOWNOFSA-N	0	3	347.409	3.169	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](CCNCc2ncc(C)s2)C1	ZINC001754917215	1440708874	/nfs/dbraw/zinc/70/88/74/1440708874.db2.gz	KPANKDAMRQXRBO-OAHLLOKOSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCN(C(=O)C2(C(F)F)CCCC2)C1	ZINC001754927732	1440710055	/nfs/dbraw/zinc/71/00/55/1440710055.db2.gz	GASOZFFPPXVDMJ-CYBMUJFWSA-N	0	3	334.838	3.393	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](CCNCc3oc(C)nc3C)C2)CCC1	ZINC001754930696	1440710404	/nfs/dbraw/zinc/71/04/04/1440710404.db2.gz	NNXJSGZFCSNXHQ-KRWDZBQOSA-N	0	3	345.487	3.366	20	30		EGEDHN
C#CCCN(C)Cc1ccccc1CNC(=O)c1occ2c1CCC2	ZINC001754946522	1440713284	/nfs/dbraw/zinc/71/32/84/1440713284.db2.gz	LMQXQJVRXUEEQB-UHFFFAOYSA-N	0	3	336.435	3.153	20	30		EGEDHN
C=C(C)CN(C)Cc1ccccc1CNC(=O)CCc1cncs1	ZINC001754946771	1440713497	/nfs/dbraw/zinc/71/34/97/1440713497.db2.gz	WIUQJJSDLMITIY-UHFFFAOYSA-N	0	3	343.496	3.400	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)CC[C@@H]3CCCO3)cccc2C1	ZINC001754975277	1440719614	/nfs/dbraw/zinc/71/96/14/1440719614.db2.gz	ZJPYJIQMOIPQCO-IBGZPJMESA-N	0	3	342.483	3.196	20	30		EGEDHN
CCC1(NC/C(Cl)=C/Cl)CCN(C(=O)C#CC(C)C)CC1	ZINC001755068424	1440745872	/nfs/dbraw/zinc/74/58/72/1440745872.db2.gz	DKNAZDVEVTWHJH-KAMYIIQDSA-N	0	3	331.287	3.326	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC(CC)(NCc2cc3n(n2)CCC3)CC1	ZINC001755069385	1440746106	/nfs/dbraw/zinc/74/61/06/1440746106.db2.gz	QRZQWVPCQCVPKG-UHFFFAOYSA-N	0	3	344.503	3.046	20	30		EGEDHN
C=CCCN1Cc2ccccc2C[C@@H]1CNC(=O)Cc1cnccc1C	ZINC001755075254	1440748323	/nfs/dbraw/zinc/74/83/23/1440748323.db2.gz	CKKLUFXQVLQPJC-OAQYLSRUSA-N	0	3	349.478	3.052	20	30		EGEDHN
C=CCCN1Cc2ccccc2C[C@H]1CNC(=O)CCc1ccoc1	ZINC001755075917	1440748539	/nfs/dbraw/zinc/74/85/39/1440748539.db2.gz	PHMVTNMFUKDFTQ-FQEVSTJZSA-N	0	3	338.451	3.331	20	30		EGEDHN
C=CCOCCCC(=O)N1CCC[C@@]2(CCN(C/C=C\Cl)C2)C1	ZINC001755077084	1440749226	/nfs/dbraw/zinc/74/92/26/1440749226.db2.gz	NOYTZUGELRULQO-ZETNRXDVSA-N	0	3	340.895	3.036	20	30		EGEDHN
CC/C(C)=C\C(=O)N1C[C@H](NCC#Cc2ccccc2Cl)[C@@H](C)C1	ZINC001755108828	1440753998	/nfs/dbraw/zinc/75/39/98/1440753998.db2.gz	MDLSQDILJILWQG-YQFFJRNJSA-N	0	3	344.886	3.484	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CCN(Cc2sc(C)nc2C)CC1(C)C	ZINC001755137444	1440758966	/nfs/dbraw/zinc/75/89/66/1440758966.db2.gz	SSKBGJYLJNXHSW-MRXNPFEDSA-N	0	3	335.517	3.443	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)[C@@H](c2cccnc2)C(C)C)C(C)(C)C1	ZINC001755141652	1440760745	/nfs/dbraw/zinc/76/07/45/1440760745.db2.gz	IUTNTNCWBOCNKW-QZTJIDSGSA-N	0	3	329.488	3.224	20	30		EGEDHN
C=CCN(C)C[C@@H]1CCCN1C(=O)c1cccc(C(F)(F)F)c1	ZINC001755201364	1440779913	/nfs/dbraw/zinc/77/99/13/1440779913.db2.gz	QPCRWDSJLLKSNO-HNNXBMFYSA-N	0	3	326.362	3.428	20	30		EGEDHN
C=CCN(C)C[C@@H]1CCCN1C(=O)c1ccc(C(F)F)cc1F	ZINC001755208856	1440782758	/nfs/dbraw/zinc/78/27/58/1440782758.db2.gz	CGUFUCMNMAHLQM-ZDUSSCGKSA-N	0	3	326.362	3.486	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC1CC(CNCc2oc(CC)nc2C)C1	ZINC001755214950	1440783936	/nfs/dbraw/zinc/78/39/36/1440783936.db2.gz	AYUBNEMTGKFWNP-UHFFFAOYSA-N	0	3	333.476	3.132	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H](C)[C@H](C)NCc2ccc(C#N)s2)s1	ZINC001755222379	1440785041	/nfs/dbraw/zinc/78/50/41/1440785041.db2.gz	CNKLXWXWXXOBLR-NWDGAFQWSA-N	0	3	333.482	3.286	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)c(F)c1)[C@@H](C)NC(=O)c1ccoc1Cl	ZINC001755235136	1440787926	/nfs/dbraw/zinc/78/79/26/1440787926.db2.gz	YTWMHMHSLJYGDK-GHMZBOCLSA-N	0	3	349.793	3.240	20	30		EGEDHN
CC(C)=C(C)CC(=O)N[C@@H](C)[C@H](C)NCC#Cc1ccc(F)cc1	ZINC001755250238	1440791610	/nfs/dbraw/zinc/79/16/10/1440791610.db2.gz	VUAJQTYKRWOLBV-IRXDYDNUSA-N	0	3	330.447	3.406	20	30		EGEDHN
C[C@@H](NCC#Cc1ccc(Cl)cc1)[C@H](C)NC(=O)C#CC(C)(C)C	ZINC001755254428	1440792866	/nfs/dbraw/zinc/79/28/66/1440792866.db2.gz	QDWYHHQMCDLXSI-CVEARBPZSA-N	0	3	344.886	3.224	20	30		EGEDHN
C=C(Br)CNC1CCC(N(C)C(=O)[C@@H](C)CC)CC1	ZINC001755273284	1440798283	/nfs/dbraw/zinc/79/82/83/1440798283.db2.gz	PWJOBEPEJSUNTH-XGNXJENSSA-N	0	3	331.298	3.300	20	30		EGEDHN
Cc1cc(C(=O)N(C)CC(C)(C)CNCc2ccccc2C#N)co1	ZINC001755280827	1440800472	/nfs/dbraw/zinc/80/04/72/1440800472.db2.gz	WRXDAYCZERVISQ-UHFFFAOYSA-N	0	3	339.439	3.348	20	30		EGEDHN
C=CCOCCN(C)[C@H](C)CNC(=O)c1c(Cl)cccc1Cl	ZINC001755322397	1440819509	/nfs/dbraw/zinc/81/95/09/1440819509.db2.gz	HXEIBVVJPNUXHO-GFCCVEGCSA-N	0	3	345.270	3.246	20	30		EGEDHN
C=CCOCCN1CCCCC[C@@H]1CNC(=O)c1cccc(C)c1F	ZINC001755363313	1440832819	/nfs/dbraw/zinc/83/28/19/1440832819.db2.gz	HIHYTPCWWYUMMF-QGZVFWFLSA-N	0	3	348.462	3.311	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)COc1ccc(CC)cc1	ZINC001755367057	1440835278	/nfs/dbraw/zinc/83/52/78/1440835278.db2.gz	BVWMIHPPOVTQLY-IBGZPJMESA-N	0	3	342.483	3.012	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H](C)C1CN(Cc2cc(C)ccc2C)C1	ZINC001755384327	1440840237	/nfs/dbraw/zinc/84/02/37/1440840237.db2.gz	OWRCAAPKILUHJQ-SFHVURJKSA-N	0	3	326.484	3.434	20	30		EGEDHN
C=CCOCCN1CC([C@H](C)NC(=O)c2cccc(C(C)C)c2)C1	ZINC001755388445	1440841273	/nfs/dbraw/zinc/84/12/73/1440841273.db2.gz	CUOGHCUISAXZQU-INIZCTEOSA-N	0	3	330.472	3.063	20	30		EGEDHN
C=CCCC(=O)N1C[C@@]2(C)CN(CCc3csc(C)n3)C[C@@]2(C)C1	ZINC001755461156	1440857395	/nfs/dbraw/zinc/85/73/95/1440857395.db2.gz	ZLCOWJFIFURVDT-KDURUIRLSA-N	0	3	347.528	3.131	20	30		EGEDHN
C=C(Br)CNC[C@H]1C[C@H](NC(=O)C2CCC(=C)CC2)C1	ZINC001755477802	1440859645	/nfs/dbraw/zinc/85/96/45/1440859645.db2.gz	FMIWMVSFTYOJSD-CTYIDZIISA-N	0	3	341.293	3.126	20	30		EGEDHN
C=C(Cl)CNC[C@H]1C[C@H](NC(=O)c2cnc3ccccc3c2)C1	ZINC001755479422	1440859858	/nfs/dbraw/zinc/85/98/58/1440859858.db2.gz	MRQDAXYSXIPDKD-SAZUREKKSA-N	0	3	329.831	3.085	20	30		EGEDHN
CN(C(=O)C1(C)CC=CC1)[C@@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001755566570	1440875927	/nfs/dbraw/zinc/87/59/27/1440875927.db2.gz	WSRUZHFXPAHVES-KRWDZBQOSA-N	0	3	343.496	3.303	20	30		EGEDHN
C[C@@H](CN(C)C(=O)CCc1ccsc1)NCC#Cc1ccccc1	ZINC001755590277	1440881258	/nfs/dbraw/zinc/88/12/58/1440881258.db2.gz	LDIIYLKBDBBYMF-KRWDZBQOSA-N	0	3	340.492	3.169	20	30		EGEDHN
C[C@@H](CN(C)C(=O)CCC(F)F)NCC#Cc1ccc(Cl)cc1	ZINC001755595542	1440882573	/nfs/dbraw/zinc/88/25/73/1440882573.db2.gz	RAZCTGYFFAGVJW-ZDUSSCGKSA-N	0	3	342.817	3.173	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H]1C(=O)N(C)C[C@@H](C)NCc1ccc(F)c(C#N)c1	ZINC001755605063	1440885276	/nfs/dbraw/zinc/88/52/76/1440885276.db2.gz	COVSSJRMPXMHAY-QGPMSJSTSA-N	0	3	345.462	3.316	20	30		EGEDHN
C[C@H](CN(C)C(=O)CC#Cc1ccccc1)NCc1ccsc1	ZINC001755618886	1440889788	/nfs/dbraw/zinc/88/97/88/1440889788.db2.gz	PJCAJKSREGCSKG-MRXNPFEDSA-N	0	3	326.465	3.126	20	30		EGEDHN
C[C@H](CN(C)C(=O)C1CCC=CCC1)NCC#Cc1ccc(F)cc1	ZINC001755618852	1440889880	/nfs/dbraw/zinc/88/98/80/1440889880.db2.gz	ZVLFUYSEVZXSQG-QGZVFWFLSA-N	0	3	342.458	3.360	20	30		EGEDHN
Cc1cccc(C(=O)N2CC[C@@H](NCC#Cc3ccccc3)[C@H]2C)c1	ZINC001755648627	1440891187	/nfs/dbraw/zinc/89/11/87/1440891187.db2.gz	HDHMNVSVWSKMEE-WIYYLYMNSA-N	0	3	332.447	3.239	20	30		EGEDHN
Cc1ccccc1C(=O)N1CC[C@@H](NCC#Cc2ccccc2)[C@H]1C	ZINC001755649325	1440891224	/nfs/dbraw/zinc/89/12/24/1440891224.db2.gz	RXFNRTLZXMXARG-WIYYLYMNSA-N	0	3	332.447	3.239	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](NCc2cc(C)ccc2OC)[C@@H]1C	ZINC001755657936	1440892312	/nfs/dbraw/zinc/89/23/12/1440892312.db2.gz	DKBZYPDYGXLHFQ-FUHWJXTLSA-N	0	3	330.472	3.439	20	30		EGEDHN
C[C@@H]1[C@H](NCc2ccc(C#N)c(F)c2)CCN1C(=O)CCC1(C)CC1	ZINC001755665236	1440893380	/nfs/dbraw/zinc/89/33/80/1440893380.db2.gz	UWSOTBDTSDOKAF-RDTXWAMCSA-N	0	3	343.446	3.357	20	30		EGEDHN
Cc1ccsc1C(=O)N1C[C@H](NCC#Cc2ccccc2)C[C@@H]1C	ZINC001755670119	1440893958	/nfs/dbraw/zinc/89/39/58/1440893958.db2.gz	PITJGDCTBMPEAP-FUHWJXTLSA-N	0	3	338.476	3.301	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](NCc2cc(Cl)cc3c2OCC3)C[C@H]1C	ZINC001755671784	1440894138	/nfs/dbraw/zinc/89/41/38/1440894138.db2.gz	BWCIIPFBZLWDRS-DYVFJYSZSA-N	0	3	348.874	3.320	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2ccc(F)c(F)c2)CN1C(=O)C#CC(C)(C)C	ZINC001755679288	1440894958	/nfs/dbraw/zinc/89/49/58/1440894958.db2.gz	VICVVPXTINUSKB-HIFRSBDPSA-N	0	3	334.410	3.093	20	30		EGEDHN
CC#CCN[C@@H]1C[C@H](C)N(C(=O)Cc2ccc(CCCC)cc2)C1	ZINC001755682463	1440895378	/nfs/dbraw/zinc/89/53/78/1440895378.db2.gz	SLHQDLIMZBPNSD-FXAWDEMLSA-N	0	3	326.484	3.174	20	30		EGEDHN
C=CCOCCN1CC[C@]2(NC(=O)C(F)=C3CCCC3)CCC[C@@H]12	ZINC001755699418	1440899135	/nfs/dbraw/zinc/89/91/35/1440899135.db2.gz	WFWGXUSPJSQBAI-VQIMIIECSA-N	0	3	336.451	3.100	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CCCN(Cc2ccc3cc[nH]c3c2)[C@@H]1C	ZINC001755731235	1440910170	/nfs/dbraw/zinc/91/01/70/1440910170.db2.gz	OGTAVKDEAMEUIW-APWZRJJASA-N	0	3	337.467	3.441	20	30		EGEDHN
CCCCCC(C)(C)C(=O)N1C[C@@H](NCC#CCOC)C(C)(C)C1	ZINC001755767066	1440916390	/nfs/dbraw/zinc/91/63/90/1440916390.db2.gz	UYDFJNOWSGECRS-QGZVFWFLSA-N	0	3	336.520	3.069	20	30		EGEDHN
CC(C)N(CCN(C)CCOC1CCCCCC1)C(=O)[C@H](C)C#N	ZINC001755811513	1440920512	/nfs/dbraw/zinc/92/05/12/1440920512.db2.gz	XHXBXVLOVKOFEA-QGZVFWFLSA-N	0	3	337.508	3.054	20	30		EGEDHN
C#CCCN(C)CCN(C(=O)c1ccc2c(c1)C(C)(C)CO2)C(C)C	ZINC001755811602	1440920516	/nfs/dbraw/zinc/92/05/16/1440920516.db2.gz	ASWXNSANIXVMNJ-UHFFFAOYSA-N	0	3	342.483	3.162	20	30		EGEDHN
C#Cc1cncc(C(=O)N(CCN(C)Cc2cccc(C)c2)C(C)C)c1	ZINC001755811918	1440920878	/nfs/dbraw/zinc/92/08/78/1440920878.db2.gz	GAECNGWUDGHYPO-UHFFFAOYSA-N	0	3	349.478	3.354	20	30		EGEDHN
C=C(C)CN(C)CCN(C(=O)c1cc(OC)c(OC)cc1C)C(C)C	ZINC001755815185	1440923197	/nfs/dbraw/zinc/92/31/97/1440923197.db2.gz	CUTOTYSWSDDWJJ-UHFFFAOYSA-N	0	3	348.487	3.371	20	30		EGEDHN
CC[C@@H](C)C(=O)N[C@H](CNCc1cc(C#N)ccc1OC)C(C)(C)C	ZINC001755818592	1440924976	/nfs/dbraw/zinc/92/49/76/1440924976.db2.gz	OVGBEKXBAPAFIG-RDTXWAMCSA-N	0	3	345.487	3.233	20	30		EGEDHN
C=CCCC(=O)N[C@H](CNCc1cnn(C(C)(C)C)c1)C(C)(C)C	ZINC001755821912	1440925864	/nfs/dbraw/zinc/92/58/64/1440925864.db2.gz	QLPYBQVFSZXWHX-MRXNPFEDSA-N	0	3	334.508	3.225	20	30		EGEDHN
C#CCN1CCC([C@@H](C)NC(=O)C[C@@H]2C[C@H]2Cc2ccccc2)CC1	ZINC001755844233	1440932711	/nfs/dbraw/zinc/93/27/11/1440932711.db2.gz	NABUHMZVNGFAOI-UIFIKXQLSA-N	0	3	338.495	3.105	20	30		EGEDHN
C#CCN1CCC([C@H](C)NC(=O)Cc2coc3cc(C)ccc23)CC1	ZINC001755850988	1440934968	/nfs/dbraw/zinc/93/49/68/1440934968.db2.gz	QPPABXKPYNXVGF-INIZCTEOSA-N	0	3	338.451	3.134	20	30		EGEDHN
CC(C)C#CC(=O)N(C)C1CC(N[C@@H](C)c2ccc(F)cc2F)C1	ZINC001755856641	1440935909	/nfs/dbraw/zinc/93/59/09/1440935909.db2.gz	GRIVBRZPZDSDGZ-JEYLPNPQSA-N	0	3	334.410	3.264	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(-c2nnn[n-]2)c(OC)c1	ZINC001573325894	947364751	/nfs/dbraw/zinc/36/47/51/947364751.db2.gz	HXAAVCOXPPLKAP-KRWDZBQOSA-N	0	3	349.438	3.152	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(-c2nn[n-]n2)c(OC)c1	ZINC001573325894	947364763	/nfs/dbraw/zinc/36/47/63/947364763.db2.gz	HXAAVCOXPPLKAP-KRWDZBQOSA-N	0	3	349.438	3.152	20	30		EGEDHN
Cc1cccc([C@H](CNCc2ccc(C#N)s2)N2CCOCC2)c1	ZINC000176947165	231764449	/nfs/dbraw/zinc/76/44/49/231764449.db2.gz	SZLMIMKNHNZWMN-IBGZPJMESA-N	0	3	341.480	3.091	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](C)Cc2ccc(C)cc2C)CC1	ZINC000066704203	215070995	/nfs/dbraw/zinc/07/09/95/215070995.db2.gz	XJLZJYZNVGTRCJ-KRWDZBQOSA-N	0	3	329.488	3.184	20	30		EGEDHN
N#Cc1ccc(CN2CCC([NH2+]Cc3ccc([O-])c(F)c3)CC2)cc1	ZINC000181782624	234322087	/nfs/dbraw/zinc/32/20/87/234322087.db2.gz	SKHLQGLGAAUCTN-UHFFFAOYSA-N	0	3	339.414	3.157	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCN[C@@H]2CCO[C@H]2c2ccccc2)cc1	ZINC000191955396	283175314	/nfs/dbraw/zinc/17/53/14/283175314.db2.gz	WVVLIXVXDFCGDW-QUCCMNQESA-N	0	3	335.407	3.007	20	30		EGEDHN
C[C@@H](O)CN(CC(=O)Nc1cc(Cl)ccc1C#N)C1CCCCC1	ZINC000264201348	246173879	/nfs/dbraw/zinc/17/38/79/246173879.db2.gz	PPKGRUUUWFXBIZ-CYBMUJFWSA-N	0	3	349.862	3.166	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](C)CCc2ccccc2)CC1	ZINC000264351998	246388043	/nfs/dbraw/zinc/38/80/43/246388043.db2.gz	DDLOOUUOQZNSAQ-QGZVFWFLSA-N	0	3	329.488	3.347	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000265782959	247791204	/nfs/dbraw/zinc/79/12/04/247791204.db2.gz	KGOVLQMWKNSKRM-UHFFFAOYSA-N	0	3	345.443	3.029	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN2CC[C@]3(C2)CCc2ccccc2O3)cc1	ZINC000377657917	169056148	/nfs/dbraw/zinc/05/61/48/169056148.db2.gz	IRRVDCFYOUFLIY-CTNGQTDRSA-N	0	3	334.419	3.061	20	30		EGEDHN
CN(CCCN(C)c1c(C#N)cccc1[N+](=O)[O-])Cc1ccco1	ZINC000425254593	269686582	/nfs/dbraw/zinc/68/65/82/269686582.db2.gz	NUBIVHKOHQSGMW-UHFFFAOYSA-N	0	3	328.372	3.018	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CCCN1C[C@@H](O)c1ccc(C#N)cc1	ZINC000268676150	252128299	/nfs/dbraw/zinc/12/82/99/252128299.db2.gz	LJDQAGVWDYWBOB-XMSQKQJNSA-N	0	3	349.478	3.188	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1	ZINC000153299626	224085109	/nfs/dbraw/zinc/08/51/09/224085109.db2.gz	PTIGYXVKRBIUSK-LJQANCHMSA-N	0	3	337.379	3.164	20	30		EGEDHN
COC(=O)[C@H](C)Oc1ccc(CN(C)Cc2ccc(C#N)cc2)cc1	ZINC000131202024	533207620	/nfs/dbraw/zinc/20/76/20/533207620.db2.gz	SPTVVRLBJTXSFJ-HNNXBMFYSA-N	0	3	338.407	3.131	20	30		EGEDHN
COc1ccc(CNC[C@@](C)(O)c2ccccc2Cl)cc1C#N	ZINC000156708371	533668971	/nfs/dbraw/zinc/66/89/71/533668971.db2.gz	XMGWWEWAZDSVSK-GOSISDBHSA-N	0	3	330.815	3.218	20	30		EGEDHN
C#CCOc1ccc(F)cc1NC1CCN(c2ccncc2)CC1	ZINC000297887655	135742484	/nfs/dbraw/zinc/74/24/84/135742484.db2.gz	QTBSGJXBNUCQHI-UHFFFAOYSA-N	0	3	325.387	3.314	20	30		EGEDHN
CCN(CCOc1cccc(C#N)c1)C[C@@H]1COc2ccccc2O1	ZINC000338357311	141106507	/nfs/dbraw/zinc/10/65/07/141106507.db2.gz	ZJPWROQPHDCFGW-GOSISDBHSA-N	0	3	338.407	3.099	20	30		EGEDHN
N#Cc1cccc(CCNCc2cnn(Cc3ccc(F)cc3)c2)c1	ZINC000341449456	155297306	/nfs/dbraw/zinc/29/73/06/155297306.db2.gz	DDLXOPPYVQGXCO-UHFFFAOYSA-N	0	3	334.398	3.274	20	30		EGEDHN
CN(C)CCNC(=O)c1cccc(Oc2cccc(Cl)c2C#N)c1	ZINC000116988596	152084370	/nfs/dbraw/zinc/08/43/70/152084370.db2.gz	FHCWMFQXRJDHIX-UHFFFAOYSA-N	0	3	343.814	3.295	20	30		EGEDHN
Cc1ccccc1[C@@H]([C@H](C)NC(=O)c1ccc(F)c(C#N)c1)N(C)C	ZINC000341566762	155360666	/nfs/dbraw/zinc/36/06/66/155360666.db2.gz	PJEWBLURQHTZGA-IFXJQAMLSA-N	0	3	339.414	3.427	20	30		EGEDHN
Cc1ccc(C(=O)NCCN[C@@H](C)c2ccc(C#N)c(F)c2)cc1F	ZINC000271912768	154001040	/nfs/dbraw/zinc/00/10/40/154001040.db2.gz	FDVTZHQAAZTDPL-ZDUSSCGKSA-N	0	3	343.377	3.226	20	30		EGEDHN
Cc1ccnc(N2C[C@@H]3CCN(Cc4ccccc4)C[C@H]3C2)c1C#N	ZINC000310994021	154144801	/nfs/dbraw/zinc/14/48/01/154144801.db2.gz	HEPUSQONBQGKNE-OALUTQOASA-N	0	3	332.451	3.220	20	30		EGEDHN
CCN1C[C@@H](C)N(Cc2ccc(C#N)cc2Br)C[C@H]1C	ZINC000350991613	165088715	/nfs/dbraw/zinc/08/87/15/165088715.db2.gz	ONFJQCIERDDERV-CHWSQXEVSA-N	0	3	336.277	3.235	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1CCC[C@H](C[C@H]2CCOC2)C1	ZINC000367403345	168221464	/nfs/dbraw/zinc/22/14/64/168221464.db2.gz	OSTHAHCKFMHKFG-QZTJIDSGSA-N	0	3	344.455	3.084	20	30		EGEDHN
N#Cc1cccc(NC(=O)CN[C@H](c2ccccc2)C2CCOCC2)c1	ZINC000367723536	168262774	/nfs/dbraw/zinc/26/27/74/168262774.db2.gz	MJNLJTMXPSVDCQ-OAQYLSRUSA-N	0	3	349.434	3.254	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NC2CCc3ccccc3CC2)cc1	ZINC000456462299	269963378	/nfs/dbraw/zinc/96/33/78/269963378.db2.gz	RHQDOIHINVAEDT-HXUWFJFHSA-N	0	3	343.430	3.304	20	30		EGEDHN
C[C@H](N[C@@H]1CCO[C@H](c2cncn2C)C1)c1ccc(C#N)cc1F	ZINC000332429646	270045239	/nfs/dbraw/zinc/04/52/39/270045239.db2.gz	PTJVNLVFEIXGCV-WRSAYESZSA-N	0	3	328.391	3.002	20	30		EGEDHN
N#Cc1cc(F)ccc1NC(=O)N1CCN(CC2CCCCC2)CC1	ZINC000435169464	270051181	/nfs/dbraw/zinc/05/11/81/270051181.db2.gz	VZHODHCRYDNKQJ-UHFFFAOYSA-N	0	3	344.434	3.427	20	30		EGEDHN
Cc1cccc(CN(CCN(C)C)c2ccc(C#N)cc2[N+](=O)[O-])c1	ZINC000470065496	270055232	/nfs/dbraw/zinc/05/52/32/270055232.db2.gz	ILMDUKQOQVVSQK-UHFFFAOYSA-N	0	3	338.411	3.343	20	30		EGEDHN
CCc1ccc(CN(C)C(=O)C(C#N)Cc2ccc(C#N)cc2)cc1	ZINC000470731101	270055235	/nfs/dbraw/zinc/05/52/35/270055235.db2.gz	CCYFPFGXGCXCQG-FQEVSTJZSA-N	0	3	331.419	3.462	20	30		EGEDHN
N#Cc1ccc(OCCN2CCC(N3CCc4ccccc43)CC2)cc1	ZINC000503368712	270059141	/nfs/dbraw/zinc/05/91/41/270059141.db2.gz	NPGCRYQNWCQKFJ-UHFFFAOYSA-N	0	3	347.462	3.464	20	30		EGEDHN
CCC[C@@H](C)NC(=O)[C@H]1CCCN(Cc2ccc(C#N)c(OC)c2)C1	ZINC000282482381	266066648	/nfs/dbraw/zinc/06/66/48/266066648.db2.gz	WXLVCFOENVUGGF-QAPCUYQASA-N	0	3	343.471	3.084	20	30		EGEDHN
CCC(CC)C(=O)N1CCC(NCc2ccc(C#N)cc2F)CC1	ZINC000269409943	266289406	/nfs/dbraw/zinc/28/94/06/266289406.db2.gz	ITIQQQYDLJSNIK-UHFFFAOYSA-N	0	3	331.435	3.214	20	30		EGEDHN
CCOc1cc(C)ccc1CNC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000348350350	266308690	/nfs/dbraw/zinc/30/86/90/266308690.db2.gz	NRWRUKYVHODSHG-LJQANCHMSA-N	0	3	347.418	3.264	20	30		EGEDHN
C=C(C)CN1CCC(Nc2nc3cc(Cl)ccn3c2C#N)CC1	ZINC000516201907	266811060	/nfs/dbraw/zinc/81/10/60/266811060.db2.gz	CUIKISBCVAFZTK-UHFFFAOYSA-N	0	3	329.835	3.312	20	30		EGEDHN
COc1cc(OC)c(CCNCc2ccc(C#N)cc2F)c(OC)c1	ZINC000269385898	266840260	/nfs/dbraw/zinc/84/02/60/266840260.db2.gz	AZCBWKPPINYYTD-UHFFFAOYSA-N	0	3	344.386	3.055	20	30		EGEDHN
COc1ccccc1N1CC[C@@H](CNCc2ccc(C#N)cc2F)C1	ZINC000269467155	266900870	/nfs/dbraw/zinc/90/08/70/266900870.db2.gz	ZHSGRBPEDXECLX-INIZCTEOSA-N	0	3	339.414	3.322	20	30		EGEDHN
C[C@@H]([NH2+][C@@H]1CCCN(c2ccc(C#N)cc2)C1=O)c1ccccc1[O-]	ZINC000272553053	266976160	/nfs/dbraw/zinc/97/61/60/266976160.db2.gz	SUVMSSOUASECJW-RDTXWAMCSA-N	0	3	335.407	3.110	20	30		EGEDHN
CCCCN(C)CCNC(=O)Nc1ccc(OC(C)C)c(C#N)c1	ZINC000435544971	267005997	/nfs/dbraw/zinc/00/59/97/267005997.db2.gz	HJBWFLUXDJVGSZ-UHFFFAOYSA-N	0	3	332.448	3.199	20	30		EGEDHN
CCCN1CCC[C@H]1CNC(=O)N(C)[C@H](C)c1cccc(C#N)c1	ZINC000425784534	267019023	/nfs/dbraw/zinc/01/90/23/267019023.db2.gz	RHIVOKMJORYMPX-QAPCUYQASA-N	0	3	328.460	3.135	20	30		EGEDHN
C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCN2[C@@H](C(N)=O)c2ccc(C#N)cc2)C1	ZINC000331918350	267032393	/nfs/dbraw/zinc/03/23/93/267032393.db2.gz	LKTPIFUBTJCJJQ-QWQQUQAHSA-N	0	3	341.455	3.396	20	30		EGEDHN
CCOC(=O)N1CCC[C@@H]([C@H](C)NCc2cc(C#N)ccc2F)C1	ZINC000495521675	267123256	/nfs/dbraw/zinc/12/32/56/267123256.db2.gz	WUMHNDUYGTXZLX-DZGCQCFKSA-N	0	3	333.407	3.044	20	30		EGEDHN
C[C@H](Cn1cc(Br)cn1)NC1(c2cccc(C#N)c2)CC1	ZINC000272195692	267168439	/nfs/dbraw/zinc/16/84/39/267168439.db2.gz	IEZUIUIFQXWQHP-GFCCVEGCSA-N	0	3	345.244	3.185	20	30		EGEDHN
CC[C@H](Cc1ccc(C)cc1)N(C)CC(=O)NCc1ccc(C#N)cc1	ZINC000441385342	267214419	/nfs/dbraw/zinc/21/44/19/267214419.db2.gz	ZMFIXRZZCJHPLT-OAQYLSRUSA-N	0	3	349.478	3.436	20	30		EGEDHN
CC[C@H]1CCC[C@H]1C(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000448816193	267227706	/nfs/dbraw/zinc/22/77/06/267227706.db2.gz	NDONCXHRVBYVKL-RBUKOAKNSA-N	0	3	327.472	3.275	20	30		EGEDHN
CCO[C@@H]1C[C@H](NC2(c3cccc(C#N)c3)CC2)C12CCOCC2	ZINC000274514032	267248784	/nfs/dbraw/zinc/24/87/84/267248784.db2.gz	XAXWEZACKDNRJO-ZWKOTPCHSA-N	0	3	326.440	3.111	20	30		EGEDHN
CC1(C)CC[C@H](CN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)O1	ZINC000274760710	267282517	/nfs/dbraw/zinc/28/25/17/267282517.db2.gz	DKDDJEPTSKRPLI-GOSISDBHSA-N	0	3	341.455	3.166	20	30		EGEDHN
CN(C)[C@@]1(CNc2nc3c(cc2C#N)CCCC3(C)C)CCSC1	ZINC000428148963	267288222	/nfs/dbraw/zinc/28/82/22/267288222.db2.gz	ZFQLUXJZDNHSKW-LJQANCHMSA-N	0	3	344.528	3.416	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1OC(F)F)[C@@H](CO)CC(C)(C)C	ZINC000451781851	267315498	/nfs/dbraw/zinc/31/54/98/267315498.db2.gz	PSICSHPWFDMVHJ-CQSZACIVSA-N	0	3	326.387	3.389	20	30		EGEDHN
CO[C@@H]1CCCC[C@H]1N[C@@H](C)C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000275253300	267336251	/nfs/dbraw/zinc/33/62/51/267336251.db2.gz	QLPVSHCICZGPCI-IUIKQTSFSA-N	0	3	335.835	3.086	20	30		EGEDHN
Cc1cc(N2CC[C@@H](N3CC=CC3)C2)n2c3ccccc3nc2c1C#N	ZINC000301436894	267340756	/nfs/dbraw/zinc/34/07/56/267340756.db2.gz	HOEOZRJLXBPTFZ-MRXNPFEDSA-N	0	3	343.434	3.118	20	30		EGEDHN
COC(=O)[C@]1(c2ccccc2)CCN(Cc2ccc(C#N)c(C)c2)C1	ZINC000428803189	267395373	/nfs/dbraw/zinc/39/53/73/267395373.db2.gz	FMDRFEIFJRHIDB-OAQYLSRUSA-N	0	3	334.419	3.183	20	30		EGEDHN
COC(=O)c1cccc(OCCN(C)[C@@H](C)c2cccc(C#N)c2)c1	ZINC000425542085	267421551	/nfs/dbraw/zinc/42/15/51/267421551.db2.gz	YCCQGKHAXKTXJT-HNNXBMFYSA-N	0	3	338.407	3.417	20	30		EGEDHN
Cc1cccc([C@@H]2CCN(C[C@H](O)COc3ccccc3C#N)C2)c1	ZINC000528440820	268057288	/nfs/dbraw/zinc/05/72/88/268057288.db2.gz	GHQHBNYJUNJCTK-UXHICEINSA-N	0	3	336.435	3.096	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)Nc3ccccc3)C2)s1	ZINC000283115925	268076213	/nfs/dbraw/zinc/07/62/13/268076213.db2.gz	YMBSXMMOOQSAQG-AWEZNQCLSA-N	0	3	326.425	3.016	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CC[C@@H](c3cccc(F)c3)C2)cc1	ZINC000279263716	268083859	/nfs/dbraw/zinc/08/38/59/268083859.db2.gz	ILUCCARBIUZFLX-MOPGFXCFSA-N	0	3	347.393	3.396	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NC23CC4CC(CC(C4)C2)C3)cc1	ZINC000279348871	268089983	/nfs/dbraw/zinc/08/99/83/268089983.db2.gz	JFUNZZOIRHZZCX-VJJCQHNBSA-N	0	3	333.435	3.326	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCc2c(F)cccc2Cl)cc1	ZINC000348063701	268091353	/nfs/dbraw/zinc/09/13/53/268091353.db2.gz	GNCNOCKVFXSGKN-CQSZACIVSA-N	0	3	341.773	3.349	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CNC2(c3cccc(Cl)c3)CC2)cc1	ZINC000271766247	268178874	/nfs/dbraw/zinc/17/88/74/268178874.db2.gz	ITXIPCCZWALLSY-QGZVFWFLSA-N	0	3	342.826	3.230	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN[C@@H](c2ccccc2)C2(CO)CCC2)cc1	ZINC000292553207	268212171	/nfs/dbraw/zinc/21/21/71/268212171.db2.gz	ALCMWCFAXFABKN-PMACEKPBSA-N	0	3	336.435	3.085	20	30		EGEDHN
N#Cc1ccc(CN2CCN(C[C@@H]3C[C@@H]3c3ccccc3)CC2)cc1	ZINC000506086554	268220393	/nfs/dbraw/zinc/22/03/93/268220393.db2.gz	PZHDEOGZPATHBU-FCHUYYIVSA-N	0	3	331.463	3.480	20	30		EGEDHN
N#Cc1ccc(CNC[C@]2(CO)C[C@@H]2c2ccc(F)cc2)c(F)c1	ZINC000428543446	268233437	/nfs/dbraw/zinc/23/34/37/268233437.db2.gz	SERXFMDIKQHJND-MJGOQNOKSA-N	0	3	328.362	3.092	20	30		EGEDHN
N#Cc1ccc(CNC[C@]2(O)CCC[C@H](C(F)(F)F)C2)cc1F	ZINC000421383034	268233517	/nfs/dbraw/zinc/23/35/17/268233517.db2.gz	JQIRGEOEUGZACC-ZFWWWQNUSA-N	0	3	330.325	3.271	20	30		EGEDHN
N#Cc1cccc(C2(NCCc3nc(-c4ccccc4)no3)CC2)c1	ZINC000299079116	268241298	/nfs/dbraw/zinc/24/12/98/268241298.db2.gz	TZCNMSICLIBILB-UHFFFAOYSA-N	0	3	330.391	3.430	20	30		EGEDHN
N#Cc1cccc(C2(NCCC(=O)Nc3ccccc3C#N)CC2)c1	ZINC000299022829	268241423	/nfs/dbraw/zinc/24/14/23/268241423.db2.gz	RCXGGMLRXRZGNI-UHFFFAOYSA-N	0	3	330.391	3.037	20	30		EGEDHN
N#Cc1cccc(Cl)c1NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000273222323	268256804	/nfs/dbraw/zinc/25/68/04/268256804.db2.gz	QPJBTNHMGCNCOZ-QGZVFWFLSA-N	0	3	341.842	3.390	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CN[C@H]1CCc2sc(Cl)cc21	ZINC000530234657	268305371	/nfs/dbraw/zinc/30/53/71/268305371.db2.gz	SFJJGHBGTAEOBA-OCCSQVGLSA-N	0	3	348.855	3.290	20	30		EGEDHN
N#Cc1ncc(NC(=O)N2CCN(C3CCCCC3)CC2)cc1Cl	ZINC000455789890	268322440	/nfs/dbraw/zinc/32/24/40/268322440.db2.gz	PKJNUKMRJALKDU-UHFFFAOYSA-N	0	3	347.850	3.089	20	30		EGEDHN
N#Cc1sc(NCC2(N3CCCCC3)CCOCC2)nc1Cl	ZINC000287202471	276095993	/nfs/dbraw/zinc/09/59/93/276095993.db2.gz	HTVWKNLKJUNLGA-UHFFFAOYSA-N	0	3	340.880	3.115	20	30		EGEDHN
CC(C)(CO)[C@@H](NC[C@H](O)c1ccc(C#N)cc1)c1cccs1	ZINC000289782828	276393569	/nfs/dbraw/zinc/39/35/69/276393569.db2.gz	MSYMSZMJODCUFG-RDJZCZTQSA-N	0	3	330.453	3.003	20	30		EGEDHN
CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1cc(C#N)cs1	ZINC000177066417	289145673	/nfs/dbraw/zinc/14/56/73/289145673.db2.gz	NCXRIFZNRFTKIP-UHFFFAOYSA-N	0	3	349.406	3.102	20	30		EGEDHN
CN(C)CCOc1ccc(NC(=O)c2c(F)cc(C#N)cc2F)cc1	ZINC000123058214	307535534	/nfs/dbraw/zinc/53/55/34/307535534.db2.gz	HBVDVWHFOTZDRM-UHFFFAOYSA-N	0	3	345.349	3.029	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@H](N[C@@H](COC(N)=O)Cc1ccccc1)CC2	ZINC000495884860	311626736	/nfs/dbraw/zinc/62/67/36/311626736.db2.gz	JNUGNQAEFFFMLP-IEBWSBKVSA-N	0	3	335.407	3.256	20	30		EGEDHN
Cc1ccccc1[C@H](NCC(=O)NCc1cccc(C#N)c1)C1CC1	ZINC000537289504	314172357	/nfs/dbraw/zinc/17/23/57/314172357.db2.gz	FIGPTAOFIWCCOW-OAQYLSRUSA-N	0	3	333.435	3.224	20	30		EGEDHN
C[C@@H](NCCNc1ccc(-c2ccccc2)nn1)c1cccc(C#N)c1	ZINC000539496421	314317443	/nfs/dbraw/zinc/31/74/43/314317443.db2.gz	MQYJEKFDJKHLHA-MRXNPFEDSA-N	0	3	343.434	3.200	20	30		EGEDHN
CN(C)CCOc1ccc(NC(=O)c2ccc(Cl)c(C#N)c2)cc1	ZINC000539786166	314337254	/nfs/dbraw/zinc/33/72/54/314337254.db2.gz	YUDUEKHFOKXHFV-UHFFFAOYSA-N	0	3	343.814	3.404	20	30		EGEDHN
CC(C)(CNCc1cnc2c(C#N)cnn2c1)c1ccc(Cl)cc1	ZINC000550578465	315130412	/nfs/dbraw/zinc/13/04/12/315130412.db2.gz	KQDHORDZHZARTD-UHFFFAOYSA-N	0	3	339.830	3.322	20	30		EGEDHN
COC1CCN(C2(CNc3snc(C)c3C#N)CCCC2)CC1	ZINC000553057755	315243161	/nfs/dbraw/zinc/24/31/61/315243161.db2.gz	SRNVNJRQCHUVLR-UHFFFAOYSA-N	0	3	334.489	3.159	20	30		EGEDHN
Cc1cccc(C2(NCc3cnc4c(C#N)cnn4c3)CCCC2)c1	ZINC000556092913	315415776	/nfs/dbraw/zinc/41/57/76/315415776.db2.gz	BKOWGBGQRMWREO-UHFFFAOYSA-N	0	3	331.423	3.469	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](C(=O)Nc2ccc(Br)cn2)C1	ZINC000103469089	454558705	/nfs/dbraw/zinc/55/87/05/454558705.db2.gz	VMXQNVPEHYTHAW-GFCCVEGCSA-N	0	3	338.249	3.071	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)Nc2cccc(C#N)n2)CCN1Cc1ccccc1	ZINC000564943242	316236142	/nfs/dbraw/zinc/23/61/42/316236142.db2.gz	YCEYMUKUHBHPGS-WBVHZDCISA-N	0	3	349.438	3.128	20	30		EGEDHN
Cc1cccc([C@@H](CNCc2cc(C#N)cs2)N2CCOCC2)c1	ZINC000177684828	323343643	/nfs/dbraw/zinc/34/36/43/323343643.db2.gz	BYBPKFCZYNORLY-LJQANCHMSA-N	0	3	341.480	3.091	20	30		EGEDHN
Cc1ccc([C@@H](C)CNCCS(=O)(=O)c2ccc(C#N)cc2)cc1	ZINC000577384898	324798084	/nfs/dbraw/zinc/79/80/84/324798084.db2.gz	AFQMWCGBGDSUII-INIZCTEOSA-N	0	3	342.464	3.034	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](NC[C@H]3C[C@H]3c3ccccc3)C2=O)cc1	ZINC000579123142	325066564	/nfs/dbraw/zinc/06/65/64/325066564.db2.gz	GWMXSJPNVASDPI-HKBOAZHASA-N	0	3	345.446	3.052	20	30		EGEDHN
CC(C)[C@H]1CCC[C@@H](NCCS(=O)(=O)c2ccc(C#N)cc2)C1	ZINC000580947692	325312667	/nfs/dbraw/zinc/31/26/67/325312667.db2.gz	YMEIDZJFKMHKLC-DLBZAZTESA-N	0	3	334.485	3.136	20	30		EGEDHN
CC[C@@]1(CO)CCCN1CC#Cc1ccc(OC(F)(F)F)cc1	ZINC000189634794	455225074	/nfs/dbraw/zinc/22/50/74/455225074.db2.gz	WAUVKTCVYYHECE-INIZCTEOSA-N	0	3	327.346	3.174	20	30		EGEDHN
C=CCN1CCC(NC(=O)C[C@@H](c2ccccc2)C(F)(F)F)CC1	ZINC000264519070	455229251	/nfs/dbraw/zinc/22/92/51/455229251.db2.gz	WAZMVRZCEHQDIT-INIZCTEOSA-N	0	3	340.389	3.489	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Nc1cccc(C#N)c1	ZINC000157773692	455229858	/nfs/dbraw/zinc/22/98/58/455229858.db2.gz	WPFCHBIHIBLVQI-BEFAXECRSA-N	0	3	334.423	3.200	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1N[C@H](C)C(=O)Nc1cc(Cl)ccc1Cl	ZINC000451601875	458482291	/nfs/dbraw/zinc/48/22/91/458482291.db2.gz	CAVKJZUESPMFNW-IUPBHXKESA-N	0	3	329.227	3.254	20	30		EGEDHN
CC(C)Oc1ccc(NC(=O)N2CC[C@H](N3CCCC3)C2)cc1C#N	ZINC000157870643	455242807	/nfs/dbraw/zinc/24/28/07/455242807.db2.gz	SQFQKSMYAGNDSN-KRWDZBQOSA-N	0	3	342.443	3.047	20	30		EGEDHN
C=CCN(CC1CCCCC1)C(=O)c1ccnc(OCCN(C)C)c1	ZINC000183205200	455249877	/nfs/dbraw/zinc/24/98/77/455249877.db2.gz	RIAMVNJVSODWAZ-UHFFFAOYSA-N	0	3	345.487	3.231	20	30		EGEDHN
N#CC[C@@H]1CCCN(C[C@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000595609124	459363920	/nfs/dbraw/zinc/36/39/20/459363920.db2.gz	GOAWNVIDBFRCPQ-JSGCOSHPSA-N	0	3	343.254	3.359	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@@H](NCc2ccc(OCC#N)cc2)C1	ZINC000180848399	455255818	/nfs/dbraw/zinc/25/58/18/455255818.db2.gz	QRQZBACFBRRDHU-MRXNPFEDSA-N	0	3	345.443	3.078	20	30		EGEDHN
N#Cc1cccc(OCCN2CC[C@@H](Oc3cccc(F)c3)C2)c1	ZINC000612174534	460561900	/nfs/dbraw/zinc/56/19/00/460561900.db2.gz	FBYGXYYVMVWRAC-LJQANCHMSA-N	0	3	326.371	3.229	20	30		EGEDHN
C[C@@H](NC1CC(C#N)(c2ccccc2)C1)c1ccc(NC(N)=O)cc1	ZINC000158471238	455305544	/nfs/dbraw/zinc/30/55/44/455305544.db2.gz	NYNFFQKMJLECAS-FHTBDLFWSA-N	0	3	334.423	3.452	20	30		EGEDHN
C[C@H](NCc1ccc(Cn2cncn2)cc1)c1ccc(OCC#N)cc1	ZINC000181444901	455335281	/nfs/dbraw/zinc/33/52/81/455335281.db2.gz	MYOVSVYEEYLUPO-INIZCTEOSA-N	0	3	347.422	3.080	20	30		EGEDHN
CN(CCOc1ccccc1F)CCC(=O)Nc1sccc1C#N	ZINC000021672651	453679939	/nfs/dbraw/zinc/67/99/39/453679939.db2.gz	BOPSYBHVVSQUIE-UHFFFAOYSA-N	0	3	347.415	3.098	20	30		EGEDHN
Cc1ccnc(CN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1	ZINC000616763645	460617274	/nfs/dbraw/zinc/61/72/74/460617274.db2.gz	YIFUTQJYZSQTEV-UHFFFAOYSA-N	0	3	334.423	3.112	20	30		EGEDHN
C[C@H](NC[C@@H](O)COc1ccc(CC#N)cc1)c1ccc(F)c(F)c1	ZINC000025867590	453788161	/nfs/dbraw/zinc/78/81/61/453788161.db2.gz	OZBQVSOVTVXHIY-XJKSGUPXSA-N	0	3	346.377	3.121	20	30		EGEDHN
Cc1ccc(C)c(OC[C@@H](O)CN(C)Cc2cccc(C#N)c2)c1C	ZINC000027208280	453813107	/nfs/dbraw/zinc/81/31/07/453813107.db2.gz	RBILMSLLEAWWIQ-FQEVSTJZSA-N	0	3	338.451	3.355	20	30		EGEDHN
CN(CCOc1ccc(F)cc1)CCC(=O)Nc1ccccc1C#N	ZINC000028901247	453825341	/nfs/dbraw/zinc/82/53/41/453825341.db2.gz	AABTYLCVFCKRLG-UHFFFAOYSA-N	0	3	341.386	3.037	20	30		EGEDHN
N#CCC[C@@H](C#N)CNCC1(c2ccc(Cl)cc2)CCOCC1	ZINC000066484189	453848367	/nfs/dbraw/zinc/84/83/67/453848367.db2.gz	STMOORLNAXSIPK-HNNXBMFYSA-N	0	3	331.847	3.421	20	30		EGEDHN
CCCN(CCc1nc2ccccc2c(=O)[nH]1)Cc1ccc(C#N)cc1	ZINC000054175299	453915516	/nfs/dbraw/zinc/91/55/16/453915516.db2.gz	DKSJFACQTJNHOS-UHFFFAOYSA-N	0	3	346.434	3.249	20	30		EGEDHN
N#CCc1cccc(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)c1	ZINC000067361314	453924661	/nfs/dbraw/zinc/92/46/61/453924661.db2.gz	QRCRSZJGXKLAEY-HXUWFJFHSA-N	0	3	347.462	3.395	20	30		EGEDHN
CCc1ncc(CN[C@@H]2CCCN(c3ccc(C#N)cc3F)C2)s1	ZINC000084023632	453965664	/nfs/dbraw/zinc/96/56/64/453965664.db2.gz	FPYWFSGXDJPSKV-CQSZACIVSA-N	0	3	344.459	3.475	20	30		EGEDHN
Cc1ccccc1[C@@H]1C[C@H](C)N([C@H](C(N)=O)c2ccc(C#N)cc2)C1	ZINC000076384587	453994793	/nfs/dbraw/zinc/99/47/93/453994793.db2.gz	NPDAWDYVPUBIKA-CVAIRZPRSA-N	0	3	333.435	3.271	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)c2cccc(CC#N)c2)N(C)C)cc1	ZINC000042379220	454008936	/nfs/dbraw/zinc/00/89/36/454008936.db2.gz	IYACECVEERGAOY-HXUWFJFHSA-N	0	3	335.451	3.348	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)C(=O)NC1CCN(C2CC2)CC1	ZINC000056828736	454083370	/nfs/dbraw/zinc/08/33/70/454083370.db2.gz	YOLFDUPXRZUAQB-UHFFFAOYSA-N	0	3	343.471	3.020	20	30		EGEDHN
CC(C)(C)[C@@H](NCC(=O)NCC#N)c1cccc(C(F)(F)F)c1	ZINC000181972661	455406783	/nfs/dbraw/zinc/40/67/83/455406783.db2.gz	ZXXXYLADKWIARW-AWEZNQCLSA-N	0	3	327.350	3.022	20	30		EGEDHN
C[C@@H](c1ccc(F)c(F)c1)N(C)C[C@H](O)COc1ccc(C#N)cc1	ZINC000045492584	454163558	/nfs/dbraw/zinc/16/35/58/454163558.db2.gz	RDYCDNRIMOXPPU-BBRMVZONSA-N	0	3	346.377	3.269	20	30		EGEDHN
C[C@@H](N[C@@H]1CCCN(Cc2ccccc2)C1=O)c1ccc(C#N)cc1	ZINC000089596477	454165614	/nfs/dbraw/zinc/16/56/14/454165614.db2.gz	CKAFSZYLXNKQEB-OXQOHEQNSA-N	0	3	333.435	3.400	20	30		EGEDHN
COC[C@H](N[C@H](C)C(=O)N(CCC#N)c1cc(C)cc(C)c1)C(C)C	ZINC000130281024	454187565	/nfs/dbraw/zinc/18/75/65/454187565.db2.gz	KNSVBQWOIJOZSO-MJGOQNOKSA-N	0	3	345.487	3.199	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)CC1	ZINC000119831831	454225709	/nfs/dbraw/zinc/22/57/09/454225709.db2.gz	CWFQBQKACDZLON-UHFFFAOYSA-N	0	3	346.431	3.374	20	30		EGEDHN
CN(C)c1cccc(CN(C)CCC(=O)Nc2sccc2C#N)c1	ZINC000089922028	454235014	/nfs/dbraw/zinc/23/50/14/454235014.db2.gz	GBOKRTTYXBSEIV-UHFFFAOYSA-N	0	3	342.468	3.146	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC1CCN([C@H](C)c2ccccc2)CC1	ZINC000071909308	454252067	/nfs/dbraw/zinc/25/20/67/454252067.db2.gz	MXFZCFWSIZCTPK-SJORKVTESA-N	0	3	330.472	3.309	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(c3ccc(Cl)cn3)CC2)cc1	ZINC000078627785	454288933	/nfs/dbraw/zinc/28/89/33/454288933.db2.gz	ZNCHTRGIRKDQMM-UHFFFAOYSA-N	0	3	326.831	3.319	20	30		EGEDHN
Cc1cc(C(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)c(C)s1	ZINC000047011111	454318346	/nfs/dbraw/zinc/31/83/46/454318346.db2.gz	OUZDCWGVUNQPGL-UHFFFAOYSA-N	0	3	341.480	3.441	20	30		EGEDHN
CCc1nc(CO/N=C/c2ccc(N3CCOCC3)cc2)cs1	ZINC000121009952	454377916	/nfs/dbraw/zinc/37/79/16/454377916.db2.gz	BMGOKTQPGVFRKE-WOJGMQOQSA-N	0	3	331.441	3.093	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCN2CCC(OC3CCCC3)CC2)cc1	ZINC000121127778	454395493	/nfs/dbraw/zinc/39/54/93/454395493.db2.gz	IGHLIQUXIJHUJX-UHFFFAOYSA-N	0	3	341.455	3.310	20	30		EGEDHN
N#Cc1ccc(CNC(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1	ZINC000047949040	454423263	/nfs/dbraw/zinc/42/32/63/454423263.db2.gz	RTOQLXYZZBQMFZ-FQEVSTJZSA-N	0	3	348.450	3.195	20	30		EGEDHN
CN(C)Cc1ccccc1CNC(=O)c1cccc(SCC#N)c1	ZINC000079505672	454427839	/nfs/dbraw/zinc/42/78/39/454427839.db2.gz	YDZNVGUHRWLRMP-UHFFFAOYSA-N	0	3	339.464	3.294	20	30		EGEDHN
CCC(CC)CN(CCC#N)C(=O)CC1(N2CCOCC2)CCCC1	ZINC000073428618	454435334	/nfs/dbraw/zinc/43/53/34/454435334.db2.gz	HINCOKDHBFWAFZ-UHFFFAOYSA-N	0	3	349.519	3.200	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)C2CCN(Cc3ccc(C#N)cc3)CC2)C1	ZINC000048046516	454436047	/nfs/dbraw/zinc/43/60/47/454436047.db2.gz	AYOQHLLUVVYJIK-MRXNPFEDSA-N	0	3	325.456	3.029	20	30		EGEDHN
Cc1nc(C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)ccc1C#N	ZINC000079557800	454439882	/nfs/dbraw/zinc/43/98/82/454439882.db2.gz	VKVOOEFVMHUFFO-DNVCBOLYSA-N	0	3	348.450	3.045	20	30		EGEDHN
CC(C)(CNC(=O)CSCc1ccc(C#N)cc1)N1CCCCC1	ZINC000048092840	454442075	/nfs/dbraw/zinc/44/20/75/454442075.db2.gz	LCDOBAZQKLLZDQ-UHFFFAOYSA-N	0	3	345.512	3.172	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)cc1)C[C@H](O)COc1ccc(C#N)cc1	ZINC000063750856	454445248	/nfs/dbraw/zinc/44/52/48/454445248.db2.gz	QSROJPASIBCJDK-FQEVSTJZSA-N	0	3	349.434	3.080	20	30		EGEDHN
N#CC(C(=O)Nc1ccccn1)C(=O)c1cc2c(s1)CCCCC2	ZINC000102387418	454502265	/nfs/dbraw/zinc/50/22/65/454502265.db2.gz	ZDCWSVUHPFVZRL-CYBMUJFWSA-N	0	3	339.420	3.373	20	30		EGEDHN
C=CCOc1ccc(CN(C)C[C@@H]2CCN(C(C)=O)C2)cc1Cl	ZINC000092100354	454521851	/nfs/dbraw/zinc/52/18/51/454521851.db2.gz	JPXQAVWVLMXLJT-INIZCTEOSA-N	0	3	336.863	3.205	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H]2c3cccc(F)c3CC[C@H]2C)CC1	ZINC000080121048	454536878	/nfs/dbraw/zinc/53/68/78/454536878.db2.gz	MRTTXBQPVKWCQC-AUUYWEPGSA-N	0	3	345.462	3.399	20	30		EGEDHN
CCc1ccccc1CC(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000191159808	455454885	/nfs/dbraw/zinc/45/48/85/455454885.db2.gz	UDUHTEUIOOSJQI-UHFFFAOYSA-N	0	3	349.478	3.254	20	30		EGEDHN
C[C@@H](CNC(=O)Nc1ccc(C#N)c(Cl)c1)N1CCC(C)CC1	ZINC000065357870	454552747	/nfs/dbraw/zinc/55/27/47/454552747.db2.gz	DGQIELQOCGAOSO-ZDUSSCGKSA-N	0	3	334.851	3.454	20	30		EGEDHN
C=C(C)CN1CCC(C(=O)Nc2ccc(Br)cn2)CC1	ZINC000103469110	454558689	/nfs/dbraw/zinc/55/86/89/454558689.db2.gz	FKABNULOEMZJQU-UHFFFAOYSA-N	0	3	338.249	3.071	20	30		EGEDHN
N#CC(C(=O)CCc1c[nH]c2ccccc12)C(=O)NCc1ccccc1	ZINC000103503564	454561068	/nfs/dbraw/zinc/56/10/68/454561068.db2.gz	JGITZTLLTXASFV-GOSISDBHSA-N	0	3	345.402	3.126	20	30		EGEDHN
Cc1noc(C)c1CCC(=O)C(C#N)C(=O)Nc1ccccc1Cl	ZINC000103504496	454561317	/nfs/dbraw/zinc/56/13/17/454561317.db2.gz	KDRYCBVHRZIQOF-ZDUSSCGKSA-N	0	3	345.786	3.225	20	30		EGEDHN
COc1ccc(CC(=O)C(C#N)C(=O)Nc2cccc(C)c2)cc1F	ZINC000103504110	454561390	/nfs/dbraw/zinc/56/13/90/454561390.db2.gz	SDGTYBBZYBDPCP-HNNXBMFYSA-N	0	3	340.354	3.033	20	30		EGEDHN
CCc1ccc(C(C)(C)CN[C@@H](C(N)=O)c2ccc(C#N)cc2)cc1	ZINC000080298473	454564055	/nfs/dbraw/zinc/56/40/55/454564055.db2.gz	KQWDMZODNYLZME-LJQANCHMSA-N	0	3	335.451	3.214	20	30		EGEDHN
CN(CCC1CCN(c2ccncc2)CC1)C(=O)NCCCCC#N	ZINC000092488374	454574249	/nfs/dbraw/zinc/57/42/49/454574249.db2.gz	RRDQANATMDTGNU-UHFFFAOYSA-N	0	3	343.475	3.023	20	30		EGEDHN
N#CC(C(=O)C=Cc1ccc(Cl)cc1)C(=O)Nc1ccccn1	ZINC000104130217	454574937	/nfs/dbraw/zinc/57/49/37/454574937.db2.gz	AXRVNIRPJJZWDQ-DEBLGDTFSA-N	0	3	325.755	3.096	20	30		EGEDHN
CN(CCC1CCN(c2ccncc2)CC1)C(=O)C1(C#N)CCCC1	ZINC000092505190	454576050	/nfs/dbraw/zinc/57/60/50/454576050.db2.gz	IYZJHUHGQAVACH-UHFFFAOYSA-N	0	3	340.471	3.230	20	30		EGEDHN
CN(C(=O)c1ccc(C#N)cc1)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000074447781	454583399	/nfs/dbraw/zinc/58/33/99/454583399.db2.gz	DVEOCCOJQZAUQB-HXUWFJFHSA-N	0	3	333.435	3.295	20	30		EGEDHN
C=CCN(CCC(=O)Nc1ccc2c(c1)OCO2)Cc1ccccc1	ZINC000051400812	454622992	/nfs/dbraw/zinc/62/29/92/454622992.db2.gz	XVDIDYBTFQTKSD-UHFFFAOYSA-N	0	3	338.407	3.432	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)c1cc(F)ccc1F	ZINC000065931088	454641055	/nfs/dbraw/zinc/64/10/55/454641055.db2.gz	BLRTYRITYIRASN-UHFFFAOYSA-N	0	3	343.377	3.040	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1)C(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1	ZINC000080858923	454642538	/nfs/dbraw/zinc/64/25/38/454642538.db2.gz	XQKUCFRUKVWVIC-LEWJYISDSA-N	0	3	347.462	3.252	20	30		EGEDHN
C=CCN(CCc1ccccc1)C[C@H](O)COc1ccccc1C	ZINC000065959253	454644486	/nfs/dbraw/zinc/64/44/86/454644486.db2.gz	JXBPAOZXLBGKKE-FQEVSTJZSA-N	0	3	325.452	3.465	20	30		EGEDHN
C[C@@H](NC(=O)N1CCN(CCC(C)(C)C)CC1)c1cccc(C#N)c1	ZINC000074916868	454658264	/nfs/dbraw/zinc/65/82/64/454658264.db2.gz	DWBUJOVJNFGKTD-MRXNPFEDSA-N	0	3	342.487	3.383	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Cn2ccc3ccc(Cl)cc32)CC1	ZINC000106034819	454675185	/nfs/dbraw/zinc/67/51/85/454675185.db2.gz	SKVLMKOWIOMGQJ-UHFFFAOYSA-N	0	3	345.874	3.451	20	30		EGEDHN
CC(C)n1cc([C@@H](C)NC2CCN(c3ccc(C#N)cn3)CC2)cn1	ZINC000161771553	454722057	/nfs/dbraw/zinc/72/20/57/454722057.db2.gz	KLGJEBQFCOJMHT-OAHLLOKOSA-N	0	3	338.459	3.050	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2Cc3ccccc3C[C@@H]2C)CC1	ZINC000176501165	454752456	/nfs/dbraw/zinc/75/24/56/454752456.db2.gz	XUBRZWWXSVLAOZ-INIZCTEOSA-N	0	3	327.472	3.183	20	30		EGEDHN
CCC[C@H](NCCS(=O)(=O)c1ccc(C#N)cc1)c1ccccc1	ZINC000176880755	454794424	/nfs/dbraw/zinc/79/44/24/454794424.db2.gz	MIBWPKUXFVSQHD-IBGZPJMESA-N	0	3	342.464	3.463	20	30		EGEDHN
CCN1CCN(Cc2ccccc2CNc2nc(C)ccc2C#N)CC1	ZINC000160567239	455474717	/nfs/dbraw/zinc/47/47/17/455474717.db2.gz	JKIOQUVWRMGBGR-UHFFFAOYSA-N	0	3	349.482	3.011	20	30		EGEDHN
N#CCSCc1nc(-c2cccc(CN3CCCCC3)c2)no1	ZINC000109570025	454830835	/nfs/dbraw/zinc/83/08/35/454830835.db2.gz	WYEROUPGGFXHNL-UHFFFAOYSA-N	0	3	328.441	3.479	20	30		EGEDHN
N#CC1CCN(C[C@H](O)Cn2c3ccccc3c3ccccc32)CC1	ZINC000141989434	454833165	/nfs/dbraw/zinc/83/31/65/454833165.db2.gz	NGBCJQBGIQNABW-KRWDZBQOSA-N	0	3	333.435	3.391	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CNCC(C)(C)NC(=O)OC(C)(C)C)cc1	ZINC000177591410	454881164	/nfs/dbraw/zinc/88/11/64/454881164.db2.gz	IZPCSMMRJSUWGQ-AWEZNQCLSA-N	0	3	347.459	3.370	20	30		EGEDHN
COc1ccc(CN2CCC[C@@H]2C(C)(C)O)cc1OCCCC#N	ZINC000154466867	454900094	/nfs/dbraw/zinc/90/00/94/454900094.db2.gz	OAFWXUSWCACGCE-GOSISDBHSA-N	0	3	332.444	3.113	20	30		EGEDHN
CN(C(=O)C1(C#N)CCCC1)c1ccc(OCCN2CCCC2)cc1	ZINC000126813809	454919973	/nfs/dbraw/zinc/91/99/73/454919973.db2.gz	OYDYNUILFDNIOX-UHFFFAOYSA-N	0	3	341.455	3.208	20	30		EGEDHN
C#CCOc1ccc([C@H](C)N[C@@H]2CCN(c3ncccc3F)C2)cc1	ZINC000168152763	454924949	/nfs/dbraw/zinc/92/49/49/454924949.db2.gz	XEGGNQYSYBOWLZ-DOTOQJQBSA-N	0	3	339.414	3.162	20	30		EGEDHN
C=CCSCCNC(=O)NCC(C)(C)N[C@@H](C)c1ccccc1	ZINC000113606471	454931636	/nfs/dbraw/zinc/93/16/36/454931636.db2.gz	XIQCJXWPSOIVGN-HNNXBMFYSA-N	0	3	335.517	3.334	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H]2CCC[C@@H](SCC)C2)CC1	ZINC000175742275	455490427	/nfs/dbraw/zinc/49/04/27/455490427.db2.gz	AOBPSFADCKIULG-JKSUJKDBSA-N	0	3	325.522	3.000	20	30		EGEDHN
C[C@@H]1CCC[C@@H](C(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)C1	ZINC000151146195	454943905	/nfs/dbraw/zinc/94/39/05/454943905.db2.gz	LGEBIHWJPQFUDY-VQIMIIECSA-N	0	3	327.472	3.275	20	30		EGEDHN
COc1ccc(C#N)cc1CN1CCCN(Cc2ccccc2)CC1	ZINC000127269285	454949671	/nfs/dbraw/zinc/94/96/71/454949671.db2.gz	XGLNEIJDGXYWKR-UHFFFAOYSA-N	0	3	335.451	3.275	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN(C)C1CCN(Cc2ccccc2)CC1	ZINC000114480874	454956915	/nfs/dbraw/zinc/95/69/15/454956915.db2.gz	ZZNCQMBCLFEAKZ-UHFFFAOYSA-N	0	3	343.515	3.007	20	30		EGEDHN
COc1cc(N[C@H]2CCCN(CCCSCC#N)C2)cc(OC)c1	ZINC000155105943	454963564	/nfs/dbraw/zinc/96/35/64/454963564.db2.gz	PUSOZFICJRCBQI-HNNXBMFYSA-N	0	3	349.500	3.227	20	30		EGEDHN
N#CC1(C(=O)NC[C@H]2CCCN2Cc2ccccc2)CCCCC1	ZINC000114642411	454965327	/nfs/dbraw/zinc/96/53/27/454965327.db2.gz	MBMWIYIJQXIWFC-GOSISDBHSA-N	0	3	325.456	3.241	20	30		EGEDHN
COc1cc([C@@H](C)NCCCCC#N)ccc1S(=O)(=O)C(F)F	ZINC000178646220	454966702	/nfs/dbraw/zinc/96/67/02/454966702.db2.gz	LTAJUZKEVXHHHZ-LLVKDONJSA-N	0	3	346.399	3.036	20	30		EGEDHN
Cn1c2ccccc2nc1N1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC000178802361	454979233	/nfs/dbraw/zinc/97/92/33/454979233.db2.gz	HLGPBOBOCHCECK-UHFFFAOYSA-N	0	3	345.450	3.157	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2c(C)cc(N(C)C)cc2C)CC1	ZINC000178938858	454991508	/nfs/dbraw/zinc/99/15/08/454991508.db2.gz	FGKIVJKLABWUAW-UHFFFAOYSA-N	0	3	330.476	3.141	20	30		EGEDHN
COc1ccc([C@@H](CCO)NC2CC(C#N)(c3ccccc3)C2)cc1	ZINC000127781253	454997179	/nfs/dbraw/zinc/99/71/79/454997179.db2.gz	YKQJLVQTJAHOPT-VEDCXYSMSA-N	0	3	336.435	3.332	20	30		EGEDHN
CC(C)(C)CCN1CCN(CCCOc2cccc(C#N)c2)CC1	ZINC000155675204	455029758	/nfs/dbraw/zinc/02/97/58/455029758.db2.gz	PQWDEOXHMHMLTD-UHFFFAOYSA-N	0	3	329.488	3.381	20	30		EGEDHN
C[C@@H](NCC(=O)N[C@@](C)(C#N)C1CC1)c1ccc2c(c1)CCCC2	ZINC000128214182	455035471	/nfs/dbraw/zinc/03/54/71/455035471.db2.gz	JYCJCNNXCHTENO-VLIAUNLRSA-N	0	3	325.456	3.024	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cccn2Cc2cccs2)CC1	ZINC000171728334	455089268	/nfs/dbraw/zinc/08/92/68/455089268.db2.gz	QYSKLHBLACQUEI-UHFFFAOYSA-N	0	3	343.496	3.368	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccccc2OC(F)(F)F)CC1	ZINC000171738100	455090030	/nfs/dbraw/zinc/09/00/30/455090030.db2.gz	BSAFXOADPLYJRM-UHFFFAOYSA-N	0	3	343.349	3.357	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](CCC)Cc2ccccc2)CC1	ZINC000171733548	455090359	/nfs/dbraw/zinc/09/03/59/455090359.db2.gz	POFIKFNZYKJBDU-LJQANCHMSA-N	0	3	329.488	3.347	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cccc(Oc3ccncc3)c2)CC1	ZINC000172001773	455107830	/nfs/dbraw/zinc/10/78/30/455107830.db2.gz	GGOAWBBLEFZGNW-UHFFFAOYSA-N	0	3	337.423	3.254	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(Cc2ccc(F)cc2)CC2CC2)CC1	ZINC000172150922	455128843	/nfs/dbraw/zinc/12/88/43/455128843.db2.gz	ZQFLPIGCTCNAMP-UHFFFAOYSA-N	0	3	345.462	3.398	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN2CCC(OCC3CCCC3)CC2)cc1	ZINC000156673733	455143427	/nfs/dbraw/zinc/14/34/27/455143427.db2.gz	GETXBTCOCDQBLO-HXUWFJFHSA-N	0	3	328.456	3.263	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](CC)c2ccc(F)cc2F)CC1	ZINC000172384065	455150320	/nfs/dbraw/zinc/15/03/20/455150320.db2.gz	HAKZNVLEHQTSPL-KRWDZBQOSA-N	0	3	337.414	3.366	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccnc(O[C@@H](C)CC)c2)CC1	ZINC000180287436	455154886	/nfs/dbraw/zinc/15/48/86/455154886.db2.gz	QTCAPYLWWZXVFF-HNNXBMFYSA-N	0	3	331.460	3.029	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC=C(CNCc2cc(C#N)cs2)CC1	ZINC000189493530	455207329	/nfs/dbraw/zinc/20/73/29/455207329.db2.gz	FJNVTIZOFPXQDS-UHFFFAOYSA-N	0	3	333.457	3.277	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)C[C@@H](C)c2ccccc2)CC1	ZINC000264431341	455212431	/nfs/dbraw/zinc/21/24/31/455212431.db2.gz	ZTTPYTXPPXDQAZ-QGZVFWFLSA-N	0	3	329.488	3.472	20	30		EGEDHN
COc1ccccc1NC(=O)C1CCN(CCC(C)(C)C#N)CC1	ZINC000157655303	455217088	/nfs/dbraw/zinc/21/70/88/455217088.db2.gz	ROUIDGZGNCBKLY-UHFFFAOYSA-N	0	3	329.444	3.286	20	30		EGEDHN
C=CC[C@@H](C(=O)NC1CCN(CCOC(C)C)CC1)c1ccccc1	ZINC000190072314	455277785	/nfs/dbraw/zinc/27/77/85/455277785.db2.gz	MAEPGHDCWFLVHC-HXUWFJFHSA-N	0	3	344.499	3.352	20	30		EGEDHN
CC(C)(C#N)CN[C@@H]1CCCC[C@@H](N2C(=O)c3ccccc3C2=O)C1	ZINC000612585239	460669689	/nfs/dbraw/zinc/66/96/89/460669689.db2.gz	TWJPUJXVZIOVBC-HUUCEWRRSA-N	0	3	339.439	3.123	20	30		EGEDHN
C[C@@H](N[C@H]1CCN(C(=O)CCc2ccccc2)C1)c1cccc(C#N)c1	ZINC000181890291	455395321	/nfs/dbraw/zinc/39/53/21/455395321.db2.gz	WCHHAMWSTYFWEE-UTKZUKDTSA-N	0	3	347.462	3.443	20	30		EGEDHN
COc1ccc(CNC[C@@H](O)c2ccc(C)o2)cc1OCCCC#N	ZINC000265943256	455412162	/nfs/dbraw/zinc/41/21/62/455412162.db2.gz	GBYNYLYXYUSXLK-MRXNPFEDSA-N	0	3	344.411	3.102	20	30		EGEDHN
C[C@H](NC[C@H]1COC2(CCCCC2)O1)c1ccc(OCC#N)cc1	ZINC000182130660	455442182	/nfs/dbraw/zinc/44/21/82/455442182.db2.gz	YCCTYMDXEVNKPY-YJBOKZPZSA-N	0	3	330.428	3.315	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC[C@@H](c2cccnc2)C(C)C)CC1	ZINC000175417267	455446587	/nfs/dbraw/zinc/44/65/87/455446587.db2.gz	SGHAZZAACHVGDF-LJQANCHMSA-N	0	3	344.503	3.161	20	30		EGEDHN
CC1CCN([C@H](CNC(=O)c2ccc(C#N)[nH]2)c2ccccc2)CC1	ZINC000160408500	455455770	/nfs/dbraw/zinc/45/57/70/455455770.db2.gz	TZXZVKKSRHRMJF-LJQANCHMSA-N	0	3	336.439	3.089	20	30		EGEDHN
C=CCn1c(SC[C@H]2CCN(C)C2)nnc1-c1ccccc1C	ZINC000191198456	455462476	/nfs/dbraw/zinc/46/24/76/455462476.db2.gz	QGBWUUJIDNEOIS-HNNXBMFYSA-N	0	3	328.485	3.483	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc3ccccc3n2CCC)CC1	ZINC000191276195	455474319	/nfs/dbraw/zinc/47/43/19/455474319.db2.gz	JTQDRVSHLXDYEA-UHFFFAOYSA-N	0	3	325.456	3.432	20	30		EGEDHN
C=CCCCC(=O)NCC1(N[C@H](C)c2ccccc2)CCOCC1	ZINC000175658225	455478070	/nfs/dbraw/zinc/47/80/70/455478070.db2.gz	CAKPVZKVWIFVLV-QGZVFWFLSA-N	0	3	330.472	3.359	20	30		EGEDHN
CC[C@@H](NCC#Cc1ccc(OC(F)(F)F)cc1)[C@H]1CCCO1	ZINC000182371259	455499708	/nfs/dbraw/zinc/49/97/08/455499708.db2.gz	ZJPDSGSNOZCEIB-HZPDHXFCSA-N	0	3	327.346	3.484	20	30		EGEDHN
COc1ccc(NC(=[NH2+])NCc2c([O-])ccc3c2CCCC3)cc1	ZINC000267453779	455550821	/nfs/dbraw/zinc/55/08/21/455550821.db2.gz	SFNBFNKFHYBOBR-UHFFFAOYSA-N	0	3	325.412	3.206	20	30		EGEDHN
C[C@H]1CC[C@H](NC(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)CC1	ZINC000247084554	455557749	/nfs/dbraw/zinc/55/77/49/455557749.db2.gz	IOGBNMJOHNITBR-RUCARUNLSA-N	0	3	342.487	3.210	20	30		EGEDHN
C[C@@H]1CCN(Cc2cn(C)nc2-c2ccc(C#N)cc2)CCS1	ZINC000192188285	455570937	/nfs/dbraw/zinc/57/09/37/455570937.db2.gz	SACBJCWVTFANQQ-CQSZACIVSA-N	0	3	326.469	3.286	20	30		EGEDHN
Cc1nc(C(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)ccc1C#N	ZINC000247261590	455579970	/nfs/dbraw/zinc/57/99/70/455579970.db2.gz	VKVOOEFVMHUFFO-KXBFYZLASA-N	0	3	348.450	3.045	20	30		EGEDHN
C[C@@H]1CN(C[C@@H](O)COc2ccc(CC#N)cc2)[C@H]1c1ccccc1	ZINC000247380857	455593383	/nfs/dbraw/zinc/59/33/83/455593383.db2.gz	UGHWGKNRVUZVSU-OZOXKJRCSA-N	0	3	336.435	3.185	20	30		EGEDHN
N#Cc1csc(CNC[C@@H]2CN(Cc3ccccc3)CCCO2)c1	ZINC000192357601	455597130	/nfs/dbraw/zinc/59/71/30/455597130.db2.gz	SYWOZOWDGZJZQH-GOSISDBHSA-N	0	3	341.480	3.000	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CN2CCC[C@H]2c2ccsc2)cc1	ZINC000247642548	455632664	/nfs/dbraw/zinc/63/26/64/455632664.db2.gz	IIFXTTHDPMJCMI-WMZOPIPTSA-N	0	3	328.437	3.197	20	30		EGEDHN
C=C(C)[C@@H](NC(=O)N1CC[C@H]2CC[C@@H](C1)N2C)c1ccc(F)c(F)c1	ZINC000185843981	455633693	/nfs/dbraw/zinc/63/36/93/455633693.db2.gz	ZSCSFXUQRKQNON-RVKKMQEKSA-N	0	3	349.425	3.460	20	30		EGEDHN
N#CCc1ccc(OC[C@H](O)CN2CCC[C@H]2c2cccs2)cc1	ZINC000247708471	455639772	/nfs/dbraw/zinc/63/97/72/455639772.db2.gz	HCZQTRLDYKKAFJ-AEFFLSMTSA-N	0	3	342.464	3.391	20	30		EGEDHN
CC(C)Oc1ccc(NC(=O)C2CCN(C3CC3)CC2)cc1C#N	ZINC000192763594	455689355	/nfs/dbraw/zinc/68/93/55/455689355.db2.gz	ZQXUOCMYNKZOIN-UHFFFAOYSA-N	0	3	327.428	3.158	20	30		EGEDHN
CC[C@@H](NCCC(=O)N(C)CCC#N)c1ccccc1OC(F)F	ZINC000271659876	455715009	/nfs/dbraw/zinc/71/50/09/455715009.db2.gz	GQEZVVNFVLGJRU-CQSZACIVSA-N	0	3	339.386	3.091	20	30		EGEDHN
COc1ccc(CN[C@@H](C)c2ccc(OCC#N)cc2)cc1OC	ZINC000192934752	455721339	/nfs/dbraw/zinc/72/13/39/455721339.db2.gz	NCAHHTDUSCTJGF-AWEZNQCLSA-N	0	3	326.396	3.457	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000248729963	455727484	/nfs/dbraw/zinc/72/74/84/455727484.db2.gz	MGJPHMKQOMZBCJ-PKOBYXMFSA-N	0	3	330.472	3.091	20	30		EGEDHN
C=CCc1cc(CN2CCCC[C@H]2CC(=O)NCC)cc(OC)c1O	ZINC000284882266	455756397	/nfs/dbraw/zinc/75/63/97/455756397.db2.gz	FBXIODWILODVKZ-KRWDZBQOSA-N	0	3	346.471	3.010	20	30		EGEDHN
CC1(C)CCCN(C(=O)C2CCN(Cc3ccccc3)CC2)[C@H]1C#N	ZINC000278098486	455757339	/nfs/dbraw/zinc/75/73/39/455757339.db2.gz	ZEYOKJCRJYUSKM-IBGZPJMESA-N	0	3	339.483	3.439	20	30		EGEDHN
Cc1ccc(OC[C@H](O)CNC2(c3cccc(C#N)c3)CC2)c(C)c1	ZINC000271814319	455771033	/nfs/dbraw/zinc/77/10/33/455771033.db2.gz	RHYUXLCFBHUFRW-LJQANCHMSA-N	0	3	336.435	3.194	20	30		EGEDHN
C[C@@H](NCc1ccccc1CN1CCC(O)CC1)c1cccc(C#N)c1	ZINC000271862237	455791489	/nfs/dbraw/zinc/79/14/89/455791489.db2.gz	KUMRHNHXGGAYOD-QGZVFWFLSA-N	0	3	349.478	3.366	20	30		EGEDHN
C=C(Cl)COc1ccc([C@@H](C)NC[C@H]2CC[C@@H](CO)O2)cc1	ZINC000293694817	455795276	/nfs/dbraw/zinc/79/52/76/455795276.db2.gz	LLUZZKYKJCKHFP-XYPHTWIQSA-N	0	3	325.836	3.008	20	30		EGEDHN
CC[C@H](NCCNC(=O)c1ccccc1F)c1ccc(C#N)cc1	ZINC000278251496	455798146	/nfs/dbraw/zinc/79/81/46/455798146.db2.gz	MNPRMCDTZMSUQF-SFHVURJKSA-N	0	3	325.387	3.168	20	30		EGEDHN
Cc1ccc(C(=O)NCCN[C@@H](C)c2ccc(C#N)c(F)c2)cc1	ZINC000271929630	455799409	/nfs/dbraw/zinc/79/94/09/455799409.db2.gz	KJMPIKROJCCVFF-AWEZNQCLSA-N	0	3	325.387	3.086	20	30		EGEDHN
COc1cc(OC)cc([C@@H](O)CN[C@@H](C)c2ccc(C#N)c(F)c2)c1	ZINC000271969356	455807845	/nfs/dbraw/zinc/80/78/45/455807845.db2.gz	UBRTYDUVFNOPLX-BUXKBTBVSA-N	0	3	344.386	3.099	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ocnc2-c2ccccc2)CC1	ZINC000294496558	455818500	/nfs/dbraw/zinc/81/85/00/455818500.db2.gz	FJHQWDIVQFPUQS-UHFFFAOYSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1C(=O)N(C)C1CCN(Cc2ccccc2)CC1	ZINC000278344466	455824539	/nfs/dbraw/zinc/82/45/39/455824539.db2.gz	MIVRXMAAIQWVLO-WOJBJXKFSA-N	0	3	342.483	3.091	20	30		EGEDHN
C=CCOc1cccc(CN2C[C@H]3C[C@@H](C2)Cn2c(=O)cccc23)c1	ZINC000294797114	455828344	/nfs/dbraw/zinc/82/83/44/455828344.db2.gz	MOLAMXRBMSHYAQ-ZWKOTPCHSA-N	0	3	336.435	3.032	20	30		EGEDHN
Cc1ccc(CNC(=O)C2CCN(CCC(C)(C)C#N)CC2)cc1F	ZINC000272039212	455828696	/nfs/dbraw/zinc/82/86/96/455828696.db2.gz	QPGHVQXISVXXPT-UHFFFAOYSA-N	0	3	345.462	3.402	20	30		EGEDHN
COc1cc(OC)cc(N2CCCN(CCC(C)(C)C#N)CC2)c1	ZINC000272044089	455830541	/nfs/dbraw/zinc/83/05/41/455830541.db2.gz	RPVDEOSLWCJIHT-UHFFFAOYSA-N	0	3	331.460	3.156	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N(CC(C)C)C2CCN(C)CC2)cc1	ZINC000294958373	455833701	/nfs/dbraw/zinc/83/37/01/455833701.db2.gz	OXRZPOYXOZLRCS-UHFFFAOYSA-N	0	3	344.499	3.373	20	30		EGEDHN
COc1ncc(CNCc2ccc(N(C)CCC#N)cc2)cc1Cl	ZINC000295080399	455837847	/nfs/dbraw/zinc/83/78/47/455837847.db2.gz	RZCWXHBHEVGEIR-UHFFFAOYSA-N	0	3	344.846	3.383	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@]1(C#N)CC12CCCC2	ZINC000295330986	455846350	/nfs/dbraw/zinc/84/63/50/455846350.db2.gz	MIVMKUCBNKEMEJ-HGHGUNKESA-N	0	3	337.467	3.097	20	30		EGEDHN
CC(C)(C)C1CCN(NC(=O)C(C#N)Cc2ccc(C#N)cc2)CC1	ZINC000295387400	455847684	/nfs/dbraw/zinc/84/76/84/455847684.db2.gz	KXDOAOPDAXEAFX-QGZVFWFLSA-N	0	3	338.455	3.030	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cc(-c3ccco3)nn2C(C)C)CC1	ZINC000279091824	455858424	/nfs/dbraw/zinc/85/84/24/455858424.db2.gz	NQWRRVGCHLXPEV-UHFFFAOYSA-N	0	3	340.427	3.008	20	30		EGEDHN
COc1ccc(CN(C)C(=O)C(C#N)Cc2ccc(C#N)cc2)cc1C	ZINC000279332343	455862014	/nfs/dbraw/zinc/86/20/14/455862014.db2.gz	OYKSYSQUYFIBPZ-IBGZPJMESA-N	0	3	347.418	3.216	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)Nc1ccc(N2CCCN(C)CC2)cc1)OCC	ZINC000270046245	455864709	/nfs/dbraw/zinc/86/47/09/455864709.db2.gz	PTOWGFFHVCMCKU-LJQANCHMSA-N	0	3	345.487	3.138	20	30		EGEDHN
C=C(C)[C@H](CC(=O)Nc1ccc(N2CCCN(C)CC2)cc1)OCC	ZINC000270046243	455864858	/nfs/dbraw/zinc/86/48/58/455864858.db2.gz	PTOWGFFHVCMCKU-IBGZPJMESA-N	0	3	345.487	3.138	20	30		EGEDHN
CN(C)Cc1cccc(NC(=O)/C=C\c2ccc(OCC#N)cc2)c1	ZINC000255364736	455866456	/nfs/dbraw/zinc/86/64/56/455866456.db2.gz	GVNHTOFPPCVCSN-FLIBITNWSA-N	0	3	335.407	3.302	20	30		EGEDHN
C[C@H]1COc2ccccc2CN1C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000280019301	455880235	/nfs/dbraw/zinc/88/02/35/455880235.db2.gz	MLGBREXPICFWKS-KXBFYZLASA-N	0	3	345.402	3.050	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C)OCC	ZINC000270204400	455901710	/nfs/dbraw/zinc/90/17/10/455901710.db2.gz	QWGFXWCOMSWSNR-HOJAQTOUSA-N	0	3	344.499	3.385	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](CCOC)c2ccc(C)o2)CC1	ZINC000272287324	455902760	/nfs/dbraw/zinc/90/27/60/455902760.db2.gz	FHNHMADMMANPPP-QGZVFWFLSA-N	0	3	349.475	3.005	20	30		EGEDHN
N#CCc1ccc(C(=O)NC[C@H](c2cccs2)N2CCCC2)cc1	ZINC000270242194	455910268	/nfs/dbraw/zinc/91/02/68/455910268.db2.gz	RNVAYHZIYGAQJE-QGZVFWFLSA-N	0	3	339.464	3.381	20	30		EGEDHN
C=CCN(CCC(=O)N1CCc2sccc2C1)CCc1ccco1	ZINC000272327206	455913870	/nfs/dbraw/zinc/91/38/70/455913870.db2.gz	VMVYYOCHPLXIKD-UHFFFAOYSA-N	0	3	344.480	3.347	20	30		EGEDHN
C=CCn1c(SC[C@H]2CCN(C)C2)nnc1-c1ccc(OC)cc1	ZINC000187667334	455935311	/nfs/dbraw/zinc/93/53/11/455935311.db2.gz	XIJFJFWXJBPBIT-AWEZNQCLSA-N	0	3	344.484	3.184	20	30		EGEDHN
C#CCOc1ccc([C@@H](C)N2CCC[C@H](CC(C)(C)C(N)=O)C2)cc1	ZINC000296473775	455948948	/nfs/dbraw/zinc/94/89/48/455948948.db2.gz	NWTQJFIZVUDHPL-IAGOWNOFSA-N	0	3	342.483	3.373	20	30		EGEDHN
C[C@@]1(CCCO)CCCN1Cc1ccc(C#N)cc1Br	ZINC000272530970	455983975	/nfs/dbraw/zinc/98/39/75/455983975.db2.gz	MLVXXYVNUOKQIO-INIZCTEOSA-N	0	3	337.261	3.448	20	30		EGEDHN
Cc1nnc(N2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)c(C#N)c1C	ZINC000286247012	456008559	/nfs/dbraw/zinc/00/85/59/456008559.db2.gz	FTPWPKAKVCMDOT-OAQYLSRUSA-N	0	3	347.466	3.068	20	30		EGEDHN
COC[C@]1(C)CCN(CC#Cc2ccc(OC(F)(F)F)cc2)C1	ZINC000296723522	456020292	/nfs/dbraw/zinc/02/02/92/456020292.db2.gz	NOTKDBYCKHLIQW-MRXNPFEDSA-N	0	3	327.346	3.295	20	30		EGEDHN
CN(C)CCN(CC1CCCCC1)C(=O)NCC#Cc1ccccc1	ZINC000606632548	460708332	/nfs/dbraw/zinc/70/83/32/460708332.db2.gz	BYVMHKABFKGMAG-UHFFFAOYSA-N	0	3	341.499	3.192	20	30		EGEDHN
C=CC[C@@H](C)NC(=O)N1CC[C@@]2(CCN(Cc3ccccc3)C2)C1	ZINC000286874578	456056381	/nfs/dbraw/zinc/05/63/81/456056381.db2.gz	YXZSOCORTOEKAW-YLJYHZDGSA-N	0	3	327.472	3.259	20	30		EGEDHN
CC(C)C[C@@H](CN1CCCC1)NC(=O)N(C)Cc1cccc(C#N)c1	ZINC000296981093	456082907	/nfs/dbraw/zinc/08/29/07/456082907.db2.gz	SZJVUDSGOLNBOT-IBGZPJMESA-N	0	3	342.487	3.210	20	30		EGEDHN
COC[C@@H](NC[C@H](O)c1ccc(C#N)cc1)c1cccc(Cl)c1	ZINC000288819415	456106327	/nfs/dbraw/zinc/10/63/27/456106327.db2.gz	MZSAAEHPXFCELY-MSOLQXFVSA-N	0	3	330.815	3.222	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N(C)Cc1conc1CC)C(C)C	ZINC000297079280	456112265	/nfs/dbraw/zinc/11/22/65/456112265.db2.gz	LZFGZRRNYJLXGE-SFHVURJKSA-N	0	3	348.491	3.077	20	30		EGEDHN
N#Cc1cc(Br)ccc1N1CCN(C2CCCC2)CC1	ZINC000227635167	456116655	/nfs/dbraw/zinc/11/66/55/456116655.db2.gz	WBRSLLXUYQYOAF-UHFFFAOYSA-N	0	3	334.261	3.385	20	30		EGEDHN
Cn1cc(CN[C@@H]2c3ccccc3CC[C@@H]2n2ccnc2)cc1C#N	ZINC000289242728	456118717	/nfs/dbraw/zinc/11/87/17/456118717.db2.gz	AALVGQFUGSQLNZ-VQTJNVASSA-N	0	3	331.423	3.112	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)C2(C#N)CCCCC2)C1	ZINC000332770295	456120435	/nfs/dbraw/zinc/12/04/35/456120435.db2.gz	IHMOYHLEJGBQHJ-FUHWJXTLSA-N	0	3	325.456	3.412	20	30		EGEDHN
CC1CCN([C@H](CNC(=O)NCCCC#N)c2cccs2)CC1	ZINC000273279545	456221407	/nfs/dbraw/zinc/22/14/07/456221407.db2.gz	DAOXLTSGOGYUGU-OAHLLOKOSA-N	0	3	334.489	3.124	20	30		EGEDHN
C#C[C@H](NCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C(C)(C)C	ZINC000290052429	456227191	/nfs/dbraw/zinc/22/71/91/456227191.db2.gz	DRGTUMWLOMCRKJ-INIZCTEOSA-N	0	3	326.400	3.133	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC[C@@H](c3cccc(C)c3)C2)CC1	ZINC000273453945	456231738	/nfs/dbraw/zinc/23/17/38/456231738.db2.gz	CYTGAFXYXXANQU-GOSISDBHSA-N	0	3	327.472	3.144	20	30		EGEDHN
CSC1c2cc(-c3noc(C4(C#N)CCCC4)n3)ccc2NC1=O	ZINC000274075372	456250050	/nfs/dbraw/zinc/25/00/50/456250050.db2.gz	XEECHJUPHDDPNP-CYBMUJFWSA-N	0	3	340.408	3.428	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000290356755	456304026	/nfs/dbraw/zinc/30/40/26/456304026.db2.gz	LCJSHSMIMQWPKD-PGRDOPGGSA-N	0	3	346.474	3.237	20	30		EGEDHN
COc1ccc(CN(Cc2ccco2)C2CCN(C)CC2)cc1C#N	ZINC000290553575	456362188	/nfs/dbraw/zinc/36/21/88/456362188.db2.gz	RXIPCSLGTDKSSZ-UHFFFAOYSA-N	0	3	339.439	3.256	20	30		EGEDHN
C=CC[C@@H](CC)NC(=O)Nc1cccc(N2CCN(CC)CC2)c1	ZINC000282008414	456388980	/nfs/dbraw/zinc/38/89/80/456388980.db2.gz	RBLOZKDHGRFPFJ-MRXNPFEDSA-N	0	3	330.476	3.305	20	30		EGEDHN
CC(C)Cc1ccc([C@@H](CNC(=O)NCCCCC#N)N(C)C)cc1	ZINC000352898145	456399125	/nfs/dbraw/zinc/39/91/25/456399125.db2.gz	FDFZWWCLYCBZQD-LJQANCHMSA-N	0	3	344.503	3.481	20	30		EGEDHN
C#CCOc1ccccc1CN[C@@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000282148446	456425977	/nfs/dbraw/zinc/42/59/77/456425977.db2.gz	AGGTUSDECPQOHD-LJQANCHMSA-N	0	3	349.434	3.095	20	30		EGEDHN
CN(CC(=O)N(C)C1(C#N)CCCCC1)[C@H]1CCc2ccccc2C1	ZINC000303627282	456471517	/nfs/dbraw/zinc/47/15/17/456471517.db2.gz	XYBBTZALXVQFFO-IBGZPJMESA-N	0	3	339.483	3.161	20	30		EGEDHN
C=CCn1c(-c2ccc(C)o2)nnc1N1CC[C@@H](N2CCCCC2)C1	ZINC000282310913	456473516	/nfs/dbraw/zinc/47/35/16/456473516.db2.gz	PLGRBGDUNHBKRM-MRXNPFEDSA-N	0	3	341.459	3.097	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1C[C@H](F)CN1Cc1nccs1	ZINC000348108639	456486882	/nfs/dbraw/zinc/48/68/82/456486882.db2.gz	ULDFBSWCOOHWRC-DLBZAZTESA-N	0	3	344.459	3.059	20	30		EGEDHN
COc1cc(CN2CCC[C@@H]2C[C@H](O)c2ccco2)ccc1C#N	ZINC000282384054	456496728	/nfs/dbraw/zinc/49/67/28/456496728.db2.gz	QVMNZMPJWFIIGB-SJORKVTESA-N	0	3	326.396	3.248	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@@H](C)[C@@H]1CCCOC1	ZINC000348142354	456511488	/nfs/dbraw/zinc/51/14/88/456511488.db2.gz	NEOFIMLHLQFTNT-LSDHHAIUSA-N	0	3	334.485	3.308	20	30		EGEDHN
C=CCn1c(-c2ccc(C)s2)nnc1N1CCN(CC2CC2)CC1	ZINC000337836749	456569126	/nfs/dbraw/zinc/56/91/26/456569126.db2.gz	COBWCFDDWIXMPP-UHFFFAOYSA-N	0	3	343.500	3.033	20	30		EGEDHN
COc1cc(CN[C@@H]2CCc3ccc(C#N)cc32)cc(OC)c1OC	ZINC000353268220	456599527	/nfs/dbraw/zinc/59/95/27/456599527.db2.gz	QTGUXZXGZSUGBN-QGZVFWFLSA-N	0	3	338.407	3.361	20	30		EGEDHN
Cc1nc2ccccc2c(N2CCN(c3cc(C#N)ccn3)CC2)c1C	ZINC000343436952	456620951	/nfs/dbraw/zinc/62/09/51/456620951.db2.gz	MCLWOCBOPWDTDN-UHFFFAOYSA-N	0	3	343.434	3.445	20	30		EGEDHN
CN(CC[C@H]1CCCO1)Cc1cn(CCC#N)nc1-c1ccccc1	ZINC000343459579	456636115	/nfs/dbraw/zinc/63/61/15/456636115.db2.gz	DUFRMBATRIUJFJ-LJQANCHMSA-N	0	3	338.455	3.465	20	30		EGEDHN
CN(CCC#N)c1ccc(CN2CC(C)(C)[C@H]2[C@H]2CCCO2)cc1	ZINC000291460772	456650622	/nfs/dbraw/zinc/65/06/22/456650622.db2.gz	DCZZIFUDUCFBHX-RTBURBONSA-N	0	3	327.472	3.426	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N(C)C[C@H]1CCN(C)[C@@H]1c1cccnc1	ZINC000338225997	456717366	/nfs/dbraw/zinc/71/73/66/456717366.db2.gz	LNEOSNQVAARZBV-UYAOXDASSA-N	0	3	348.450	3.027	20	30		EGEDHN
COc1cc(CN[C@@H]2CCN(c3ccccc3F)C2)ccc1C#N	ZINC000291690846	456722127	/nfs/dbraw/zinc/72/21/27/456722127.db2.gz	JAAWSEXQJJBWPD-MRXNPFEDSA-N	0	3	325.387	3.074	20	30		EGEDHN
Cc1cc(CN(C)C(=O)C(C#N)Cc2ccc(C#N)cc2)ccc1F	ZINC000348510996	456723032	/nfs/dbraw/zinc/72/30/32/456723032.db2.gz	RHPFXIQYXYDFCV-GOSISDBHSA-N	0	3	335.382	3.347	20	30		EGEDHN
CN(Cc1cc(F)cc(F)c1)C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000348514053	456726104	/nfs/dbraw/zinc/72/61/04/456726104.db2.gz	ZJJSWLPRSZMFFD-MRXNPFEDSA-N	0	3	339.345	3.177	20	30		EGEDHN
N#CCCn1cc(CNCc2ccc(O)cc2)c(-c2ccccc2)n1	ZINC000343965779	456785876	/nfs/dbraw/zinc/78/58/76/456785876.db2.gz	RHXBIOZDXHXIRN-UHFFFAOYSA-N	0	3	332.407	3.459	20	30		EGEDHN
Cc1nc([C@@H]2CCCOC2)sc1C(=O)NCC1(N(C)C)CCC1	ZINC000329014132	456814087	/nfs/dbraw/zinc/81/40/87/456814087.db2.gz	PQGUMGOZSZPHLJ-CYBMUJFWSA-N	0	3	337.489	3.134	20	30		EGEDHN
Cc1nn(-c2ccccn2)c(C)c1CNCCc1cccc(C#N)c1	ZINC000338448009	456825132	/nfs/dbraw/zinc/82/51/32/456825132.db2.gz	TUKLVONSNLAHMI-UHFFFAOYSA-N	0	3	331.423	3.088	20	30		EGEDHN
C=CC[C@@H](CO)CNCc1c(C)nn(-c2ccc(F)cc2F)c1C	ZINC000341261840	456826922	/nfs/dbraw/zinc/82/69/22/456826922.db2.gz	DRCIGZLSKSKQST-CQSZACIVSA-N	0	3	335.398	3.042	20	30		EGEDHN
CC1(O)CCN(Cc2cccc(OCc3ccccc3C#N)c2)CC1	ZINC000353679519	456850553	/nfs/dbraw/zinc/85/05/53/456850553.db2.gz	HDJMLTVVIRORBS-UHFFFAOYSA-N	0	3	336.435	3.484	20	30		EGEDHN
CCCN1CCC[C@H]1CNC(=O)[C@H]1CCCN1C(=O)c1ccccc1	ZINC000329215217	456854553	/nfs/dbraw/zinc/85/45/53/456854553.db2.gz	MIVQBFXEWNAOMF-ZWKOTPCHSA-N	0	3	343.471	3.122	20	30		EGEDHN
CO[C@@H]1[C@H](C)[C@H](NC(=O)CC2(N3CCOCC3)CCCC2)C1(C)C	ZINC000329222143	456855565	/nfs/dbraw/zinc/85/55/65/456855565.db2.gz	VWYMAXZHABQFCK-HYVNUMGLSA-N	0	3	338.492	3.038	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccc([C@H]3CCCOC3)cc2)nc(C)n1	ZINC000329251165	456860750	/nfs/dbraw/zinc/86/07/50/456860750.db2.gz	BGWFDYBEDRCCOZ-ZWKOTPCHSA-N	0	3	335.407	3.478	20	30		EGEDHN
CCc1nc2n(n1)CCC[C@@H]2NC(=O)[C@H]1CCCN1C1CCCC1	ZINC000329352947	456877299	/nfs/dbraw/zinc/87/72/99/456877299.db2.gz	FWOACHCOUPKUID-LSDHHAIUSA-N	0	3	331.464	3.039	20	30		EGEDHN
CN(CCC#N)C(=O)CCN[C@H](CC(F)(F)F)c1ccccc1	ZINC000341593742	456879618	/nfs/dbraw/zinc/87/96/18/456879618.db2.gz	QKQALZSCAMBWMV-CQSZACIVSA-N	0	3	327.350	3.032	20	30		EGEDHN
C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)N[C@@H]1CCCOc2cc(F)ccc21	ZINC000329516698	456903500	/nfs/dbraw/zinc/90/35/00/456903500.db2.gz	YWWRTNDWAKIUNI-JLZZUVOBSA-N	0	3	347.434	3.026	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](CO)Cc2ccccc2C(F)(F)F)o1	ZINC000345044713	456907738	/nfs/dbraw/zinc/90/77/38/456907738.db2.gz	WAAOVVCPXAXROZ-GFCCVEGCSA-N	0	3	338.329	3.111	20	30		EGEDHN
C[C@H](NCc1ccc(C[S@](C)=O)cc1)c1ccc(C#N)c(F)c1	ZINC000353813674	456919250	/nfs/dbraw/zinc/91/92/50/456919250.db2.gz	YXIUSDSGXAAHFE-NPMABZOXSA-N	0	3	330.428	3.427	20	30		EGEDHN
CCc1nccn1[C@@H]1CCCN(C([O-])=[NH+]CC2CCSCC2)C1	ZINC000329656556	456922621	/nfs/dbraw/zinc/92/26/21/456922621.db2.gz	GIEPGHAKWOMTEJ-OAHLLOKOSA-N	0	3	336.505	3.140	20	30		EGEDHN
CC(C)(C)CN1CCC[C@H](N2CCC[C@H](C(=O)NCC3CC3)C2)C1=O	ZINC000329757682	456936646	/nfs/dbraw/zinc/93/66/46/456936646.db2.gz	ZMGWORKNJVTVPO-IRXDYDNUSA-N	0	3	349.519	3.102	20	30		EGEDHN
C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)CCc1nc(C2CCCC2)no1	ZINC000330004347	456973279	/nfs/dbraw/zinc/97/32/79/456973279.db2.gz	AZGHXVMKBPDTEZ-IUODEOHRSA-N	0	3	332.448	3.099	20	30		EGEDHN
C=CC[C@@H](CO)CN[C@@H]1CCCOc2cc(Br)ccc21	ZINC000341885214	456986515	/nfs/dbraw/zinc/98/65/15/456986515.db2.gz	LBKQVFICASPTHC-IUODEOHRSA-N	0	3	340.261	3.437	20	30		EGEDHN
CC(C)C[C@@H]1OCCC[C@H]1NCC(=O)Nc1nc2c(s1)CCC2	ZINC000330136801	456990416	/nfs/dbraw/zinc/99/04/16/456990416.db2.gz	HQUKQWGXLGEZCR-OCCSQVGLSA-N	0	3	337.489	3.403	20	30		EGEDHN
Cc1ccccc1[C@H]1CCCN1CC(=O)NCc1cccc(C#N)c1	ZINC000339211722	456993735	/nfs/dbraw/zinc/99/37/35/456993735.db2.gz	HKEFYGKPHZNSBV-HXUWFJFHSA-N	0	3	333.435	3.320	20	30		EGEDHN
C[C@H](CNC(=O)CSCc1ccc(C#N)cc1)N1CCC[C@H](C)C1	ZINC000345810635	456997630	/nfs/dbraw/zinc/99/76/30/456997630.db2.gz	AVQNPEAHHRQAAW-JKSUJKDBSA-N	0	3	345.512	3.028	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NC[C@@H]1CCCN1Cc1ccccc1)OCC	ZINC000339220857	456998310	/nfs/dbraw/zinc/99/83/10/456998310.db2.gz	VATUGKNBNNDKJS-RBUKOAKNSA-N	0	3	330.472	3.139	20	30		EGEDHN
CCN1CCCC[C@@H]1CNC(=O)N[C@H]1CCOC2(CCCCC2)C1	ZINC000330227239	457007414	/nfs/dbraw/zinc/00/74/14/457007414.db2.gz	PCVGZQZJLJAWAR-DLBZAZTESA-N	0	3	337.508	3.246	20	30		EGEDHN
CN1CCN(CCC(=O)Nc2cccc(C#N)c2)C2(CCCCC2)C1	ZINC000330240964	457010494	/nfs/dbraw/zinc/01/04/94/457010494.db2.gz	FMGYLAUWAUXPLH-UHFFFAOYSA-N	0	3	340.471	3.487	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)CC(C)(C)C#N)c1cccc(OC)c1	ZINC000346015460	457012944	/nfs/dbraw/zinc/01/29/44/457012944.db2.gz	LIYHRHNCYPRWCM-KRWDZBQOSA-N	0	3	331.460	3.134	20	30		EGEDHN
Cc1nn(C)c(C)c1[C@H]1OCC[C@@H]1NC(=O)[C@H](C)N1CCCCCC1	ZINC000330285111	457021897	/nfs/dbraw/zinc/02/18/97/457021897.db2.gz	YJPGTAGXIIEZAV-BQFCYCMXSA-N	0	3	348.491	3.088	20	30		EGEDHN
CCCc1nc(C)c(CNC(=O)C(C#N)CCc2ccccc2)o1	ZINC000346501169	457047180	/nfs/dbraw/zinc/04/71/80/457047180.db2.gz	NOZJCMHLHMLJSC-MRXNPFEDSA-N	0	3	325.412	3.324	20	30		EGEDHN
C=CCOc1ccc(OC[C@@H](O)CN2CCc3ccccc3C2)cc1	ZINC000339338635	457059001	/nfs/dbraw/zinc/05/90/01/457059001.db2.gz	PAEHROBKCDZOLQ-IBGZPJMESA-N	0	3	339.435	3.049	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1)OCC	ZINC000339437914	457117345	/nfs/dbraw/zinc/11/73/45/457117345.db2.gz	HWDLXLUGIPMQMJ-UHOSZYNNSA-N	0	3	330.472	3.137	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N(Cc1ccccc1)C1CCN(C)CC1	ZINC000362859622	457129600	/nfs/dbraw/zinc/12/96/00/457129600.db2.gz	NIQWEJDHXJSZRC-QGZVFWFLSA-N	0	3	330.472	3.091	20	30		EGEDHN
CCCN(CCN1CCCC1)C(=O)c1cccc(SCC#N)c1	ZINC000342152013	457137634	/nfs/dbraw/zinc/13/76/34/457137634.db2.gz	AVQSFGALKZOBHU-UHFFFAOYSA-N	0	3	331.485	3.250	20	30		EGEDHN
CC[C@@H]1CN(CC(=O)N(CC)CCC#N)CC[C@H]1c1ccccc1	ZINC000350040974	457151880	/nfs/dbraw/zinc/15/18/80/457151880.db2.gz	LZBWNXBJHQKDQX-IEBWSBKVSA-N	0	3	327.472	3.264	20	30		EGEDHN
CN(C)CCOc1ccccc1-c1noc(CCCCCC#N)n1	ZINC000350055787	457157791	/nfs/dbraw/zinc/15/77/91/457157791.db2.gz	ZPIHEYLCTGPNFS-UHFFFAOYSA-N	0	3	328.416	3.303	20	30		EGEDHN
CC(=O)Nc1ccc(F)c(C(=O)NCCN2CCCC(C)(C)C2)c1	ZINC000331301074	457163231	/nfs/dbraw/zinc/16/32/31/457163231.db2.gz	RHVOFFXLKPEFHX-UHFFFAOYSA-N	0	3	335.423	3.211	20	30		EGEDHN
C[C@@H]1[C@H](NC(=O)NCC#Cc2ccccc2)CCN1Cc1ccccc1	ZINC000350124225	457166196	/nfs/dbraw/zinc/16/61/96/457166196.db2.gz	XJCQYUKXKZYPNC-WIYYLYMNSA-N	0	3	347.462	3.000	20	30		EGEDHN
CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1ccc(C#N)s1	ZINC000362993822	457188525	/nfs/dbraw/zinc/18/85/25/457188525.db2.gz	SULRUAGAHFJEKY-UHFFFAOYSA-N	0	3	349.406	3.102	20	30		EGEDHN
C=CCn1c(-c2sccc2C)nnc1N1CCCN(CC)CC1	ZINC000350741187	457202893	/nfs/dbraw/zinc/20/28/93/457202893.db2.gz	LNWNDPRLVLCJOL-UHFFFAOYSA-N	0	3	331.489	3.033	20	30		EGEDHN
C=CCn1c(-c2sccc2C)nnc1N(C)[C@@H]1CCN(C2CC2)C1	ZINC000351077161	457219981	/nfs/dbraw/zinc/21/99/81/457219981.db2.gz	VBFOCZOFJLVYFO-OAHLLOKOSA-N	0	3	343.500	3.174	20	30		EGEDHN
CC(C)(CCC#N)CNCc1cn(-c2ccc(F)c(Cl)c2)nn1	ZINC000342306959	457227511	/nfs/dbraw/zinc/22/75/11/457227511.db2.gz	WGNHFMKRFQIBFS-UHFFFAOYSA-N	0	3	335.814	3.479	20	30		EGEDHN
CC1(C)CN(CC(=O)N(CCC#N)c2ccccc2)[C@H]2CCC[C@H]21	ZINC000339715262	457230178	/nfs/dbraw/zinc/23/01/78/457230178.db2.gz	FXPJDVXGKIWYRN-MSOLQXFVSA-N	0	3	325.456	3.444	20	30		EGEDHN
N#CC(C(=O)c1ccnc(SCC(F)(F)F)c1)c1ccncn1	ZINC000354467382	457242173	/nfs/dbraw/zinc/24/21/73/457242173.db2.gz	LJBWXBAUAFFWBU-JTQLQIEISA-N	0	3	338.314	3.016	20	30		EGEDHN
N#CC(C(=O)c1cccc(NC(=O)c2cccs2)c1)c1ccncn1	ZINC000354480116	457249420	/nfs/dbraw/zinc/24/94/20/457249420.db2.gz	WWXOJKUCTNGHRD-AWEZNQCLSA-N	0	3	348.387	3.280	20	30		EGEDHN
CC[C@H]1Cc2ccccc2CN1C[C@H](O)COc1ccc(C#N)cc1	ZINC000342350189	457250927	/nfs/dbraw/zinc/25/09/27/457250927.db2.gz	SOKBTTMZXDBQND-PMACEKPBSA-N	0	3	336.435	3.135	20	30		EGEDHN
C=C(C)CN1CCC(N[C@@H](c2nccn2C)c2cccc(F)c2)CC1	ZINC000357029307	457285623	/nfs/dbraw/zinc/28/56/23/457285623.db2.gz	SMNXPYLPUDJHQN-LJQANCHMSA-N	0	3	342.462	3.279	20	30		EGEDHN
CN1CCCC(C)(C)[C@H]1CNC(=O)C[C@@H](CC#N)c1ccccc1	ZINC000357169515	457356727	/nfs/dbraw/zinc/35/67/27/457356727.db2.gz	LTDTVJVKKANXKK-QZTJIDSGSA-N	0	3	327.472	3.311	20	30		EGEDHN
COC[C@H]1CCCCN([C@@H](C)C(=O)N(CCC#N)c2ccccc2)C1	ZINC000342575359	457373230	/nfs/dbraw/zinc/37/32/30/457373230.db2.gz	XVOBBJIQNZICOR-ROUUACIJSA-N	0	3	343.471	3.070	20	30		EGEDHN
Cn1nccc1[C@@H]1CCCN(Cc2cccc(OCCCC#N)c2)C1	ZINC000378334919	457388756	/nfs/dbraw/zinc/38/87/56/457388756.db2.gz	NZVJBVDBHPSPKX-GOSISDBHSA-N	0	3	338.455	3.482	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C[C@H](CC#N)c2ccccc2)CC1	ZINC000355654241	457396915	/nfs/dbraw/zinc/39/69/15/457396915.db2.gz	GSZKUURUVUJGQW-SFHVURJKSA-N	0	3	325.456	3.231	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN2CC[C@](O)(c3ccc(F)cc3)C2)cc1	ZINC000378520347	457406286	/nfs/dbraw/zinc/40/62/86/457406286.db2.gz	NBDJGBUFLALQGX-FOIQADDNSA-N	0	3	340.398	3.210	20	30		EGEDHN
N#Cc1ccc2c(c1)CCCC[C@@H]2NCC(=O)NCCc1ccccc1	ZINC000360883692	457407432	/nfs/dbraw/zinc/40/74/32/457407432.db2.gz	KWXQXQVWRRTQTA-NRFANRHFSA-N	0	3	347.462	3.274	20	30		EGEDHN
N#CC[C@@H](CC(=O)N1CC[C@H](N2CCCCC2)C1)c1ccccc1	ZINC000355806679	457419683	/nfs/dbraw/zinc/41/96/83/457419683.db2.gz	CFACSLRMYULFKI-OALUTQOASA-N	0	3	325.456	3.161	20	30		EGEDHN
CCC(C#N)(CC)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000383380254	457423091	/nfs/dbraw/zinc/42/30/91/457423091.db2.gz	AXSFXTMKXLQCDS-SFHVURJKSA-N	0	3	327.472	3.345	20	30		EGEDHN
CC1(C)CCCN(CCNC(=O)c2cccc(SCC#N)c2)C1	ZINC000347444711	457431862	/nfs/dbraw/zinc/43/18/62/457431862.db2.gz	NQNALBGILXSARD-UHFFFAOYSA-N	0	3	331.485	3.154	20	30		EGEDHN
C=CCCC1(C(=O)N(C)C[C@H]2CCN(C)[C@H]2c2cccnc2)CC1	ZINC000356088775	457446487	/nfs/dbraw/zinc/44/64/87/457446487.db2.gz	JPIHQTBCJMNXTL-MSOLQXFVSA-N	0	3	327.472	3.279	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000363859822	457455728	/nfs/dbraw/zinc/45/57/28/457455728.db2.gz	WLDATYKVMOANFP-PZJWPPBQSA-N	0	3	344.499	3.244	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000363859824	457456221	/nfs/dbraw/zinc/45/62/21/457456221.db2.gz	WLDATYKVMOANFP-TZIWHRDSSA-N	0	3	344.499	3.244	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NC1CCN(Cc2cccc(C)c2)CC1	ZINC000364124469	457489474	/nfs/dbraw/zinc/48/94/74/457489474.db2.gz	ZCESBLNZCYICQC-OAQYLSRUSA-N	0	3	344.499	3.304	20	30		EGEDHN
C[C@@H]1[C@@H](c2ccccc2)CCN1CC(=O)NCc1cccc(C#N)c1	ZINC000374210598	457522773	/nfs/dbraw/zinc/52/27/73/457522773.db2.gz	VYNQBMYGYDGPSB-UZLBHIALSA-N	0	3	333.435	3.052	20	30		EGEDHN
COCC1(C#N)CCN(Cc2ccc(C)cc2-c2ccnn2C)CC1	ZINC000342835516	457550027	/nfs/dbraw/zinc/55/00/27/457550027.db2.gz	HEARLGJXTSXQOZ-UHFFFAOYSA-N	0	3	338.455	3.148	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)[C@H](C)c2cccc(C#N)c2)CC1	ZINC000425475862	457569887	/nfs/dbraw/zinc/56/98/87/457569887.db2.gz	LBCHKPNSWXHHJD-MRXNPFEDSA-N	0	3	340.471	3.301	20	30		EGEDHN
CCOc1ncc(C(=O)C(C#N)c2cc(C)nc(C)n2)cc1Cl	ZINC000352751901	457581859	/nfs/dbraw/zinc/58/18/59/457581859.db2.gz	HZGXIZIQEIIAQM-LBPRGKRZSA-N	0	3	330.775	3.031	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2nc(-c3ccccc3)oc2C)CC1	ZINC000357579496	457604522	/nfs/dbraw/zinc/60/45/22/457604522.db2.gz	IBWGCPYXBUYPHO-UHFFFAOYSA-N	0	3	325.412	3.030	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N1c2ccccc2CC[C@@H]1CN(C)C	ZINC000425601061	457609485	/nfs/dbraw/zinc/60/94/85/457609485.db2.gz	FIKWCPRUKDZFCM-GOSISDBHSA-N	0	3	333.435	3.390	20	30		EGEDHN
C=CCC[C@@H](C(=O)NC1CCN([C@H]2CCOC2)CC1)c1ccccc1	ZINC000364462471	457614015	/nfs/dbraw/zinc/61/40/15/457614015.db2.gz	PQJSKJIMGCCZMQ-VQTJNVASSA-N	0	3	342.483	3.106	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)N[C@H](C)[C@@H](c1ccccc1C)N(C)C	ZINC000357859384	457714165	/nfs/dbraw/zinc/71/41/65/457714165.db2.gz	VMIVHGSSNQCXQF-ACJLOTCBSA-N	0	3	325.412	3.189	20	30		EGEDHN
Cc1ccccc1[C@@H]([C@H](C)NC(=O)c1cccc(CC#N)c1)N(C)C	ZINC000357866715	457717415	/nfs/dbraw/zinc/71/74/15/457717415.db2.gz	JXNSVBBYAZZPDF-OXJNMPFZSA-N	0	3	335.451	3.482	20	30		EGEDHN
Cc1ccccc1[C@H]([C@@H](C)NC(=O)c1cccc(F)c1C#N)N(C)C	ZINC000357879212	457721513	/nfs/dbraw/zinc/72/15/13/457721513.db2.gz	VJXNBBJXRZOYTN-KUHUBIRLSA-N	0	3	339.414	3.427	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@H]1CCO[C@H]1C1CC1	ZINC000365340329	457744688	/nfs/dbraw/zinc/74/46/88/457744688.db2.gz	ARKIBPMBYABKFX-YJBOKZPZSA-N	0	3	332.469	3.060	20	30		EGEDHN
C[C@H](CNC(=O)C(C#N)CCc1ccccc1)N(C)c1ccccc1	ZINC000433225746	457784501	/nfs/dbraw/zinc/78/45/01/457784501.db2.gz	JWBWMUMBBJNKJQ-IEBWSBKVSA-N	0	3	335.451	3.400	20	30		EGEDHN
CC(C)(CC#N)CNC(=O)N[C@H](CN1CCCC1)c1ccccc1	ZINC000457765824	457821146	/nfs/dbraw/zinc/82/11/46/457821146.db2.gz	XUHPXOVFPOWCOT-QGZVFWFLSA-N	0	3	328.460	3.063	20	30		EGEDHN
Cc1cc(CN[C@H]2CC(=O)N(c3ccccc3Cl)C2)ccc1C#N	ZINC000443967109	457831501	/nfs/dbraw/zinc/83/15/01/457831501.db2.gz	TXTGFMNWGDALPO-INIZCTEOSA-N	0	3	339.826	3.415	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)Cc2cc(F)cc(F)c2)CC1	ZINC000433607530	457858723	/nfs/dbraw/zinc/85/87/23/457858723.db2.gz	KFSKRVNINYFZHW-UHFFFAOYSA-N	0	3	337.414	3.147	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NC1CCN(Cc2cccc(C)c2)CC1)OCC	ZINC000366845520	457903024	/nfs/dbraw/zinc/90/30/24/457903024.db2.gz	UGUKYUGTBZFUJH-HXUWFJFHSA-N	0	3	344.499	3.447	20	30		EGEDHN
C[C@H](CCC#N)N1C[C@H]2CCC[C@@]2(c2nc(-c3cccnc3)no2)C1	ZINC000411639337	457937105	/nfs/dbraw/zinc/93/71/05/457937105.db2.gz	VQZGQALEOFHCEJ-IDHHARJASA-N	0	3	337.427	3.177	20	30		EGEDHN
C=C(C)[C@H](CC(=O)Nc1ccc(OCCN(C)C)c(C)c1)OCC	ZINC000458190656	457963807	/nfs/dbraw/zinc/96/38/07/457963807.db2.gz	ABBBDTZTHYXMCV-SFHVURJKSA-N	0	3	334.460	3.245	20	30		EGEDHN
Cc1ccc(C#N)c(N2C[C@@H]3CCN(Cc4ccccc4)C[C@H]3C2)n1	ZINC000368130296	458014451	/nfs/dbraw/zinc/01/44/51/458014451.db2.gz	AOCSWDFUJCKVGE-PMACEKPBSA-N	0	3	332.451	3.220	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1C(=O)NC1CCN([C@H](C)c2ccccc2)CC1	ZINC000375716976	458035581	/nfs/dbraw/zinc/03/55/81/458035581.db2.gz	CGFLUIFILAUYGN-NSISKUIASA-N	0	3	342.483	3.309	20	30		EGEDHN
CC(C)(C#N)CC(=O)N1CC[C@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000375719244	458035600	/nfs/dbraw/zinc/03/56/00/458035600.db2.gz	MESPOCJAHXTQBI-OAQYLSRUSA-N	0	3	339.483	3.441	20	30		EGEDHN
C[C@@H](C(=O)N(C)CCC#N)N1CC[C@@](C)(CCc2ccccc2)C1	ZINC000434904793	458064113	/nfs/dbraw/zinc/06/41/13/458064113.db2.gz	GWGXTHKXSBFWCZ-FXAWDEMLSA-N	0	3	327.472	3.092	20	30		EGEDHN
C=CCSc1ccccc1C(=O)NC[C@@]1(N(C)C)CCSC1	ZINC000362388621	458144628	/nfs/dbraw/zinc/14/46/28/458144628.db2.gz	IADLCPVWQRUHHM-KRWDZBQOSA-N	0	3	336.526	3.132	20	30		EGEDHN
CN(C)CCN(Cc1cccc(F)c1)C(=O)NCC(C)(C)CCC#N	ZINC000358680499	458148519	/nfs/dbraw/zinc/14/85/19/458148519.db2.gz	HGIQRERIUWKKQS-UHFFFAOYSA-N	0	3	348.466	3.229	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN2CCC3(CC2)OCc2ccccc23)cc1	ZINC000372010223	458159470	/nfs/dbraw/zinc/15/94/70/458159470.db2.gz	NEHGNGGFNUMQGD-FQEVSTJZSA-N	0	3	334.419	3.113	20	30		EGEDHN
CN(C)CCN(Cc1cccs1)C(=O)NCC(C)(C)CCC#N	ZINC000358707454	458162260	/nfs/dbraw/zinc/16/22/60/458162260.db2.gz	DGDDIYWCRJKSCL-UHFFFAOYSA-N	0	3	336.505	3.151	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cccc(NC(=O)CCC)c2)CC1	ZINC000358812535	458233634	/nfs/dbraw/zinc/23/36/34/458233634.db2.gz	CSNCMHCPAHCRKH-UHFFFAOYSA-N	0	3	344.459	3.197	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)NCC(C)(C)CC#N	ZINC000459262626	458307088	/nfs/dbraw/zinc/30/70/88/458307088.db2.gz	VKRATHPEUCMVSX-KRWDZBQOSA-N	0	3	342.487	3.232	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21	ZINC000413824179	458308753	/nfs/dbraw/zinc/30/87/53/458308753.db2.gz	CATCXLLWOVOKOS-AQNXPRMDSA-N	0	3	341.499	3.300	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)NC(=O)N(C)[C@H]1CCN(C(C)C)C1	ZINC000413843213	458310643	/nfs/dbraw/zinc/31/06/43/458310643.db2.gz	ZKDFAOCHQBWOTQ-OALUTQOASA-N	0	3	329.488	3.298	20	30		EGEDHN
COc1cc(OCCN(C)C)ccc1NC(=O)C1(C#N)CCCCC1	ZINC000413965216	458312895	/nfs/dbraw/zinc/31/28/95/458312895.db2.gz	WXGSLXVLCCBEKT-UHFFFAOYSA-N	0	3	345.443	3.048	20	30		EGEDHN
CN(C)[C@@H](CC(=O)N[C@H](C#N)c1ccccc1F)c1ccccc1	ZINC000416152093	458340641	/nfs/dbraw/zinc/34/06/41/458340641.db2.gz	UVAOTMXNJVLWEV-MSOLQXFVSA-N	0	3	325.387	3.200	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1CNC(=O)NC[C@@H](N)c1ccc(C(C)C)cc1	ZINC000418130949	458371095	/nfs/dbraw/zinc/37/10/95/458371095.db2.gz	GYAYQKAOFIRFEU-QRVBRYPASA-N	0	3	345.487	3.090	20	30		EGEDHN
CCN1CCC[C@@H]1CNC(=O)c1sc2ccc(C#N)cc2c1C	ZINC000429935971	458383642	/nfs/dbraw/zinc/38/36/42/458383642.db2.gz	JUFGMFONHDIPCP-CQSZACIVSA-N	0	3	327.453	3.296	20	30		EGEDHN
C=CCN(CCc1ccco1)C(=O)NC[C@H]1N(C)CCCC1(C)C	ZINC000448250921	458399257	/nfs/dbraw/zinc/39/92/57/458399257.db2.gz	ZKHQGWOVFXYGJU-QGZVFWFLSA-N	0	3	333.476	3.140	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN[C@@H](CC(F)F)c2ccccc2)cc1	ZINC000420990081	458405406	/nfs/dbraw/zinc/40/54/06/458405406.db2.gz	ZSUNRHILUJMUML-AEFFLSMTSA-N	0	3	346.377	3.284	20	30		EGEDHN
COc1ccc(NC(=O)C[C@@H](C)NCc2ccc(C#N)s2)cc1	ZINC000421347857	458411387	/nfs/dbraw/zinc/41/13/87/458411387.db2.gz	DLXLADYATXCQFM-GFCCVEGCSA-N	0	3	329.425	3.135	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)NC[C@@H]1CCC(F)(F)C1)C(C)C	ZINC000430175872	458415616	/nfs/dbraw/zinc/41/56/16/458415616.db2.gz	DNLYIOUXRHAEQW-HZPDHXFCSA-N	0	3	343.462	3.420	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)s1)c1cccc(OCCN(C)C)c1	ZINC000421872526	458423009	/nfs/dbraw/zinc/42/30/09/458423009.db2.gz	GVJZYJRYWZWMTP-AWEZNQCLSA-N	0	3	329.469	3.411	20	30		EGEDHN
Cc1cc(NC2CCN(Cc3ccc(C#N)cc3)CC2)cc(C(N)=O)c1	ZINC000449525500	458426630	/nfs/dbraw/zinc/42/66/30/458426630.db2.gz	BLNSTYWCDPSMSJ-UHFFFAOYSA-N	0	3	348.450	3.042	20	30		EGEDHN
C=CCc1cc(CN2CC[C@@H]3C[C@H](O)CC[C@H]3C2)cc(OC)c1O	ZINC000449558234	458427066	/nfs/dbraw/zinc/42/70/66/458427066.db2.gz	WCYXIMZQXAVZNF-BPQIPLTHSA-N	0	3	331.456	3.112	20	30		EGEDHN
C=CCc1cc(CN2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)cc(OC)c1O	ZINC000449558237	458427492	/nfs/dbraw/zinc/42/74/92/458427492.db2.gz	WCYXIMZQXAVZNF-NXHRZFHOSA-N	0	3	331.456	3.112	20	30		EGEDHN
CCOC(=O)[C@@H]1CCC[C@@H]1NCc1cccc(OCCCC#N)c1	ZINC000449576783	458427527	/nfs/dbraw/zinc/42/75/27/458427527.db2.gz	BMDGTRVMQIQFIZ-MSOLQXFVSA-N	0	3	330.428	3.191	20	30		EGEDHN
C[C@H]1C[C@]1(C#N)C(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000450162825	458440728	/nfs/dbraw/zinc/44/07/28/458440728.db2.gz	RCASUWLYPFAPRD-HNAYVOBHSA-N	0	3	327.428	3.040	20	30		EGEDHN
C=CCC1(C(=O)N2CCN(C3CCN(C)CC3)[C@@H](C)C2)CCCCC1	ZINC000450362313	458445907	/nfs/dbraw/zinc/44/59/07/458445907.db2.gz	HNQDAEYCBOFYGX-SFHVURJKSA-N	0	3	347.547	3.140	20	30		EGEDHN
CO[C@H]1C[C@@H](NCc2ccc(C#N)cc2Br)C12CCC2	ZINC000459748903	458467638	/nfs/dbraw/zinc/46/76/38/458467638.db2.gz	GVWSTWYLVUNWQL-CABCVRRESA-N	0	3	335.245	3.368	20	30		EGEDHN
CO[C@@H]1C[C@@H](N[C@@H](C)C(=O)Nc2ccc(C#N)c(Cl)c2)C12CCC2	ZINC000459766870	458473109	/nfs/dbraw/zinc/47/31/09/458473109.db2.gz	PYIXMRVJKWNFMA-IUIKQTSFSA-N	0	3	347.846	3.086	20	30		EGEDHN
CCN(C(=O)c1ccc(CC#N)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000373381235	458476309	/nfs/dbraw/zinc/47/63/09/458476309.db2.gz	BBVOZPYDGRUDTJ-OAQYLSRUSA-N	0	3	347.462	3.489	20	30		EGEDHN
N[C@@H](CC(F)F)C(=O)Nc1ccc(OC(F)F)c(C(F)(F)F)c1	ZINC000423738794	458478123	/nfs/dbraw/zinc/47/81/23/458478123.db2.gz	CABXGLODRJQIKQ-ZETCQYMHSA-N	0	3	348.218	3.228	20	30		EGEDHN
C[C@@H]1CCC[C@H](C)N1CCNC(=O)c1cccc(SCC#N)c1	ZINC000430692852	458480969	/nfs/dbraw/zinc/48/09/69/458480969.db2.gz	WRFJERKPDWEXBP-GASCZTMLSA-N	0	3	331.485	3.295	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCc1ccc(OCc2ccccc2F)nc1	ZINC000451608292	458483370	/nfs/dbraw/zinc/48/33/70/458483370.db2.gz	MWOPAMVFQKEKPA-MSOLQXFVSA-N	0	3	328.387	3.233	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NC[C@H](CC)N1CCc2ccccc2C1	ZINC000437727410	458486611	/nfs/dbraw/zinc/48/66/11/458486611.db2.gz	QBGNIOKFQFCKBW-PZJWPPBQSA-N	0	3	344.499	3.168	20	30		EGEDHN
CCO[C@@H]1CCC[C@H]1NCC(=O)N(CCC#N)c1cccc(C)c1C	ZINC000452026597	458492415	/nfs/dbraw/zinc/49/24/15/458492415.db2.gz	VFVNSEHXJVYQLE-IEBWSBKVSA-N	0	3	343.471	3.097	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CCC(F)(F)[C@@H](C)C1)C(C)C	ZINC000460129951	458501331	/nfs/dbraw/zinc/50/13/31/458501331.db2.gz	WTNIPSOCVFEADG-JKSUJKDBSA-N	0	3	343.462	3.372	20	30		EGEDHN
CC(C)[C@@]1(CO)CCN(CC#Cc2ccc(OC(F)(F)F)cc2)C1	ZINC000377645665	458508988	/nfs/dbraw/zinc/50/89/88/458508988.db2.gz	CKXZEXPJXYFKRG-KRWDZBQOSA-N	0	3	341.373	3.277	20	30		EGEDHN
CCOC(=O)[C@@H](C)[C@H](C)NCC#Cc1ccc(C(F)(F)F)cc1	ZINC000460352129	458512449	/nfs/dbraw/zinc/51/24/49/458512449.db2.gz	VPGIKJZZAINUBC-STQMWFEESA-N	0	3	327.346	3.234	20	30		EGEDHN
CC(C)(C[C@H]1CCCN([C@H]2CCc3ccc(C#N)cc32)C1)C(N)=O	ZINC000453271993	458522650	/nfs/dbraw/zinc/52/26/50/458522650.db2.gz	DODPQMHXFGQYOS-QAPCUYQASA-N	0	3	325.456	3.159	20	30		EGEDHN
CC(C)(C[C@@H]1CCCN([C@H]2CCc3ccc(C#N)cc32)C1)C(N)=O	ZINC000453271994	458523071	/nfs/dbraw/zinc/52/30/71/458523071.db2.gz	DODPQMHXFGQYOS-YJBOKZPZSA-N	0	3	325.456	3.159	20	30		EGEDHN
C=CCC[C@@H](CO)N[C@@H]1CCc2c1c(Br)ccc2F	ZINC000453338996	458524166	/nfs/dbraw/zinc/52/41/66/458524166.db2.gz	CTFLNNOGTDECBI-IINYFYTJSA-N	0	3	328.225	3.492	20	30		EGEDHN
C=CCn1c(-c2sccc2C)nnc1N1CCCN(C(C)C)CC1	ZINC000453429884	458528938	/nfs/dbraw/zinc/52/89/38/458528938.db2.gz	CMVMZBZBMZIDDU-UHFFFAOYSA-N	0	3	345.516	3.422	20	30		EGEDHN
C[C@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)[C@@H](N)CCCC#N	ZINC000424085931	458555641	/nfs/dbraw/zinc/55/56/41/458555641.db2.gz	CYEYABQQIOZIRY-RISCZKNCSA-N	0	3	327.350	3.246	20	30		EGEDHN
Cc1nc(NC(=O)[C@H](N)CCCC#N)sc1Cc1ccccc1F	ZINC000424089968	458556985	/nfs/dbraw/zinc/55/69/85/458556985.db2.gz	JOSRXUIPOUOUQE-CQSZACIVSA-N	0	3	346.431	3.141	20	30		EGEDHN
Cc1cccc(C2(CNC(=O)[C@@H](N)CCCC#N)CCCCC2)c1	ZINC000424095825	458557089	/nfs/dbraw/zinc/55/70/89/458557089.db2.gz	OGCCWLPVLWCSRJ-SFHVURJKSA-N	0	3	327.472	3.334	20	30		EGEDHN
CC(C)C[C@@H](CN1CCCC1)NC(=O)N[C@H](C)c1ccc(C#N)cc1	ZINC000454349784	458558507	/nfs/dbraw/zinc/55/85/07/458558507.db2.gz	PKGQXKKUKZXJSN-APWZRJJASA-N	0	3	342.487	3.429	20	30		EGEDHN
Cc1cccn2cc(-c3ccc(NC(=O)[C@H](N)CCCC#N)cc3)nc12	ZINC000424128520	458565606	/nfs/dbraw/zinc/56/56/06/458565606.db2.gz	FOJOLGDPLMDUOA-QGZVFWFLSA-N	0	3	347.422	3.269	20	30		EGEDHN
Cc1ccc(Oc2ccc(NC(=O)[C@H](N)CCCC#N)cn2)cc1C	ZINC000424135739	458567870	/nfs/dbraw/zinc/56/78/70/458567870.db2.gz	PLEZDFUMNSGHMJ-QGZVFWFLSA-N	0	3	338.411	3.450	20	30		EGEDHN
Cc1ccc(Oc2ccccc2CNC(=O)[C@H](N)CCCC#N)cc1	ZINC000424146826	458569886	/nfs/dbraw/zinc/56/98/86/458569886.db2.gz	XKXXKQKOPRSTLF-GOSISDBHSA-N	0	3	337.423	3.425	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)NCc1cnc(-c2ccc(Cl)cc2)s1	ZINC000424166001	458575410	/nfs/dbraw/zinc/57/54/10/458575410.db2.gz	FSMIWKPFSHIZTN-CQSZACIVSA-N	0	3	348.859	3.101	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)[C@H](C)c1cccc(C#N)c1)C(C)C	ZINC000461893699	458577111	/nfs/dbraw/zinc/57/71/11/458577111.db2.gz	FWCHAIYGNWTTQD-YLJYHZDGSA-N	0	3	339.483	3.477	20	30		EGEDHN
C[C@H](C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1)c1cccc(C#N)c1	ZINC000461903816	458577880	/nfs/dbraw/zinc/57/78/80/458577880.db2.gz	UYTBKUVKRQFXAT-LAUBAEHRSA-N	0	3	347.462	3.443	20	30		EGEDHN
C[C@H](C(=O)N1CCN(CC2CCCCC2)CC1)c1cccc(C#N)c1	ZINC000461925455	458579401	/nfs/dbraw/zinc/57/94/01/458579401.db2.gz	HBTZWYRJCVRYLN-KRWDZBQOSA-N	0	3	339.483	3.386	20	30		EGEDHN
COC(=O)c1cc2c(o1)c(OC)ccc2CN[C@@H]1CC[C@H](C#N)C1	ZINC000424190940	458581705	/nfs/dbraw/zinc/58/17/05/458581705.db2.gz	GUXVRGLOWAWZOR-WCQYABFASA-N	0	3	328.368	3.010	20	30		EGEDHN
CCc1c(NC(=O)[C@@H](N)CCCC#N)cnn1-c1cccc(Cl)c1	ZINC000424194480	458581764	/nfs/dbraw/zinc/58/17/64/458581764.db2.gz	XOEQYDWLIIHREL-AWEZNQCLSA-N	0	3	345.834	3.048	20	30		EGEDHN
C[C@@H]1C[C@@H](N(C)C(=O)Nc2ccc(CC#N)cc2Cl)CCN1C	ZINC000455698132	458606711	/nfs/dbraw/zinc/60/67/11/458606711.db2.gz	FOQTXCFFXRAJJY-OCCSQVGLSA-N	0	3	334.851	3.352	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC2CCC3(CCOCC3)CC2)CC1	ZINC000378051671	458611894	/nfs/dbraw/zinc/61/18/94/458611894.db2.gz	VDFWZFBCSLBZTO-UHFFFAOYSA-N	0	3	349.519	3.066	20	30		EGEDHN
C=CCOc1cccc(CNC[C@](C)(C(=O)OC)c2ccccc2)c1	ZINC000470134111	458614484	/nfs/dbraw/zinc/61/44/84/458614484.db2.gz	CIZBMFHSPQBTMO-NRFANRHFSA-N	0	3	339.435	3.472	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Nc1cccc(CC#N)c1	ZINC000455911619	458621896	/nfs/dbraw/zinc/62/18/96/458621896.db2.gz	WJQCXKDUQZVPDI-JXFKEZNVSA-N	0	3	348.450	3.395	20	30		EGEDHN
C=CCC[C@H](O)CN(CCOC)Cc1cc(Br)cs1	ZINC000494056629	458622431	/nfs/dbraw/zinc/62/24/31/458622431.db2.gz	AQYDEADMCMORSL-ZDUSSCGKSA-N	0	3	348.306	3.286	20	30		EGEDHN
Cc1cc(C#N)cc(NC(=O)N(CCN(C)C)Cc2ccccc2)c1	ZINC000456002549	458626768	/nfs/dbraw/zinc/62/67/68/458626768.db2.gz	MXRRWCXFWIFBPS-UHFFFAOYSA-N	0	3	336.439	3.462	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)[C@@H](C)c1cccc(C#N)c1	ZINC000462541681	458630192	/nfs/dbraw/zinc/63/01/92/458630192.db2.gz	GLBZXMJZENMQQH-IRXDYDNUSA-N	0	3	335.451	3.298	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000424505769	458651867	/nfs/dbraw/zinc/65/18/67/458651867.db2.gz	DOOPDRSTRHPYHH-AQNXPRMDSA-N	0	3	342.483	3.091	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(Br)oc2C)CC1	ZINC000424643929	458693539	/nfs/dbraw/zinc/69/35/39/458693539.db2.gz	GPBUAOYIBHOPTJ-UHFFFAOYSA-N	0	3	341.249	3.121	20	30		EGEDHN
C[C@@H](NCC(C)(C)c1c(F)cccc1Cl)C(=O)N(C)CCC#N	ZINC000439652190	458737044	/nfs/dbraw/zinc/73/70/44/458737044.db2.gz	VOXVTAJONQTRLD-GFCCVEGCSA-N	0	3	339.842	3.107	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@H](C)N1CC[C@@H](c2ccc(OC)cc2)C1	ZINC000504488609	458738735	/nfs/dbraw/zinc/73/87/35/458738735.db2.gz	MUZXOKQNZPFMSM-FUHWJXTLSA-N	0	3	330.472	3.298	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F	ZINC000504579129	458739334	/nfs/dbraw/zinc/73/93/34/458739334.db2.gz	KHYZVNHFTUTNCC-QGZVFWFLSA-N	0	3	334.410	3.344	20	30		EGEDHN
C=CCN(C/C=C\c1ccncc1)[C@H](C)c1cccc(-n2cnnn2)c1	ZINC000494929675	458768619	/nfs/dbraw/zinc/76/86/19/458768619.db2.gz	JNESQHAROLIHTK-KEGWNNHHSA-N	0	3	346.438	3.320	20	30		EGEDHN
CN(CCc1nc(-c2ccccc2)no1)Cc1ccc(C#N)c(F)c1	ZINC000512218479	458784562	/nfs/dbraw/zinc/78/45/62/458784562.db2.gz	KBAKALGTJXKNGD-UHFFFAOYSA-N	0	3	336.370	3.422	20	30		EGEDHN
CC(C)(CNCc1cnc2c(C#N)cnn2c1)c1cccc(Cl)c1	ZINC000514593779	458798015	/nfs/dbraw/zinc/79/80/15/458798015.db2.gz	YBOCGHWCLUZSKN-UHFFFAOYSA-N	0	3	339.830	3.322	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CCC([C@@H]2NC(=O)C2(C)C)CC1	ZINC000515970871	458814194	/nfs/dbraw/zinc/81/41/94/458814194.db2.gz	YOYGXWAEKQZJTH-SFHVURJKSA-N	0	3	339.483	3.224	20	30		EGEDHN
C[C@H](S[C@@H]1CCCN(Cc2ccccc2)C1)C(=O)N(C)CCC#N	ZINC000516062459	458814259	/nfs/dbraw/zinc/81/42/59/458814259.db2.gz	AKYCRDHFNZVHSA-FUHWJXTLSA-N	0	3	345.512	3.145	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](c2ccccc2)C(F)(F)F)CC1	ZINC000518024230	458838360	/nfs/dbraw/zinc/83/83/60/458838360.db2.gz	ZPHLFDSRTWPBAQ-OAHLLOKOSA-N	0	3	341.377	3.240	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1c[nH]nc1C(C)(C)C)C(C)C	ZINC000551099318	458887961	/nfs/dbraw/zinc/88/79/61/458887961.db2.gz	IKXBBFLCEKQHOD-INIZCTEOSA-N	0	3	332.492	3.136	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1	ZINC000551465001	458889229	/nfs/dbraw/zinc/88/92/29/458889229.db2.gz	RKTNDUSBMOWVQA-IRXDYDNUSA-N	0	3	336.520	3.327	20	30		EGEDHN
CN(C)C[C@H](NC(=O)c1ccc(C#N)c(Cl)c1)c1ccc(F)cc1	ZINC000576853211	458935697	/nfs/dbraw/zinc/93/56/97/458935697.db2.gz	OHWUPUXJMMLMTK-KRWDZBQOSA-N	0	3	345.805	3.383	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)NCC(C)(C)CC#N)c1ccccc1	ZINC000457462443	458964832	/nfs/dbraw/zinc/96/48/32/458964832.db2.gz	TYDDMXWFHPVWGK-KRWDZBQOSA-N	0	3	330.476	3.309	20	30		EGEDHN
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCc1cc(C#N)ccc1F	ZINC000556516703	458968769	/nfs/dbraw/zinc/96/87/69/458968769.db2.gz	MGOLHOFRFPRXGI-RDTXWAMCSA-N	0	3	340.398	3.207	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cnc2ccccc2n1)C(C)C	ZINC000495917125	459005344	/nfs/dbraw/zinc/00/53/44/459005344.db2.gz	GOSOESNYCSSUPN-IBGZPJMESA-N	0	3	338.455	3.058	20	30		EGEDHN
C=CCN(CCc1ccco1)C(=O)Nc1cccc2c1CCNC2	ZINC000566903050	459019337	/nfs/dbraw/zinc/01/93/37/459019337.db2.gz	DXDWFPJXUJADRS-UHFFFAOYSA-N	0	3	325.412	3.188	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cc(F)ccc1OC)C(C)C	ZINC000495967906	459022315	/nfs/dbraw/zinc/02/23/15/459022315.db2.gz	YAYXHXRSKMPFRR-KRWDZBQOSA-N	0	3	334.435	3.263	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N(C)CCN1CCN(c2ccccc2)CC1	ZINC000442676501	459023474	/nfs/dbraw/zinc/02/34/74/459023474.db2.gz	CVHVBOIQBNYBGP-IBGZPJMESA-N	0	3	348.494	3.373	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)C1(C#N)CC(C)C1)N1CCc2ccccc2C1	ZINC000532066918	459025111	/nfs/dbraw/zinc/02/51/11/459025111.db2.gz	YJBPIUMJFJZLEM-IPFXWSOASA-N	0	3	339.483	3.125	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1ccc(OC)c(F)c1)C(C)C	ZINC000496014378	459037133	/nfs/dbraw/zinc/03/71/33/459037133.db2.gz	OBPWHGOFPGRZEQ-KRWDZBQOSA-N	0	3	334.435	3.263	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H]2CN(Cc3cccc(C#N)c3)C[C@@H]2C1	ZINC000496027732	459042062	/nfs/dbraw/zinc/04/20/62/459042062.db2.gz	IXIOBKYTPBOIRV-ZWKOTPCHSA-N	0	3	341.455	3.247	20	30		EGEDHN
COC(=O)c1csc(-c2cccc(CN[C@@H]3CC[C@H](C#N)C3)c2)n1	ZINC000442859213	459047446	/nfs/dbraw/zinc/04/74/46/459047446.db2.gz	QHFMTWRPTCHVJI-SWLSCSKDSA-N	0	3	341.436	3.379	20	30		EGEDHN
CCC1(CC)[C@H](N[C@H](C)C(=O)NC2(C#N)CCCCC2)[C@@H](C)[C@H]1OC	ZINC000557127540	459050494	/nfs/dbraw/zinc/05/04/94/459050494.db2.gz	QKIUHMIIDKSSPM-QBPKDAKJSA-N	0	3	349.519	3.147	20	30		EGEDHN
CCC1(CC)[C@H](N[C@H](C)C(=O)NC2(C#N)CCCCC2)[C@@H](C)[C@@H]1OC	ZINC000557127541	459050723	/nfs/dbraw/zinc/05/07/23/459050723.db2.gz	QKIUHMIIDKSSPM-VQHPVUNQSA-N	0	3	349.519	3.147	20	30		EGEDHN
C[C@H](NC(=O)NCC#Cc1ccccc1)[C@@H](c1ccccc1)N(C)C	ZINC000477820120	459060796	/nfs/dbraw/zinc/06/07/96/459060796.db2.gz	PMLRHHPDBCNRFJ-PXNSSMCTSA-N	0	3	335.451	3.029	20	30		EGEDHN
N#CCN1CCC(NCc2cc3cc(Br)ccc3o2)CC1	ZINC000594926830	459178828	/nfs/dbraw/zinc/17/88/28/459178828.db2.gz	SJWQRQJAAYVJIL-UHFFFAOYSA-N	0	3	348.244	3.273	20	30		EGEDHN
C[C@@H](N[C@@H]1CCCc2cc(C#N)ccc21)C(=O)NCCc1ccccc1	ZINC000590780375	459215058	/nfs/dbraw/zinc/21/50/58/459215058.db2.gz	DKDNJUPOHKNHEA-IIBYNOLFSA-N	0	3	347.462	3.273	20	30		EGEDHN
C=CCCS(=O)(=O)NC[C@@H](CC(C)C)N[C@H](C)c1ccccc1	ZINC000480975883	459226014	/nfs/dbraw/zinc/22/60/14/459226014.db2.gz	CVTDARNXNHIEBV-SJLPKXTDSA-N	0	3	338.517	3.247	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@H](N[C@@H]1CCc2ccc(C#N)cc21)C1CC1	ZINC000496604204	459256684	/nfs/dbraw/zinc/25/66/84/459256684.db2.gz	LSTNFFCTARYKGF-MSOLQXFVSA-N	0	3	341.455	3.438	20	30		EGEDHN
CN(Cc1ccccc1)CC(C)(C)NC(=O)NCC#Cc1ccccc1	ZINC000533616599	459259069	/nfs/dbraw/zinc/25/90/69/459259069.db2.gz	JWHBPMDOANLCFO-UHFFFAOYSA-N	0	3	349.478	3.248	20	30		EGEDHN
C[C@H](NC(=O)N1CCC(CC#N)CC1)[C@@H](c1ccccc1)N(C)C	ZINC000580483791	459260505	/nfs/dbraw/zinc/26/05/05/459260505.db2.gz	OAJIKZJKBXYWAG-YJBOKZPZSA-N	0	3	328.460	3.013	20	30		EGEDHN
CC#CCN(C)C[C@@H](O)CO[C@@H](c1ccccc1)c1ccc(C)cc1	ZINC000559458941	459261769	/nfs/dbraw/zinc/26/17/69/459261769.db2.gz	QFROLZYMNUFDGO-YADHBBJMSA-N	0	3	337.463	3.417	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC(=O)N(C)[C@H](C)c1cc2ccccc2o1	ZINC000581173133	459268480	/nfs/dbraw/zinc/26/84/80/459268480.db2.gz	RFTQIUJDKTYYAJ-OIISXLGYSA-N	0	3	342.439	3.275	20	30		EGEDHN
N#Cc1ccccc1N1CCCN(CCOCc2ccccc2)CC1	ZINC000595293822	459269214	/nfs/dbraw/zinc/26/92/14/459269214.db2.gz	BBCZVPVINDPVHM-UHFFFAOYSA-N	0	3	335.451	3.287	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@@H](C)N1CC[C@H](Cc2ccc(F)cc2)C1	ZINC000523011144	459276343	/nfs/dbraw/zinc/27/63/43/459276343.db2.gz	FFRDLRKMKGIZGX-SJLPKXTDSA-N	0	3	330.447	3.279	20	30		EGEDHN
C[C@@H](CCCCNC(=O)OC(C)(C)C)NCc1nc(C#N)cs1	ZINC000496676691	459282421	/nfs/dbraw/zinc/28/24/21/459282421.db2.gz	JRHYQYVVWQEXGZ-LBPRGKRZSA-N	0	3	338.477	3.188	20	30		EGEDHN
CC(C)N(CCc1ccc(C#N)cc1)CC(=O)N1CCCCCC1	ZINC000595484175	459320453	/nfs/dbraw/zinc/32/04/53/459320453.db2.gz	OHNQIPKPGBUKBH-UHFFFAOYSA-N	0	3	327.472	3.214	20	30		EGEDHN
CC(C)(C)N1CCCN(c2cc(C(F)(F)F)cnc2C#N)CC1	ZINC000591143020	459322259	/nfs/dbraw/zinc/32/22/59/459322259.db2.gz	CXWFXIXQZHJDMU-UHFFFAOYSA-N	0	3	326.366	3.283	20	30		EGEDHN
N#CC[C@@H]1CCCN(C[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000595610241	459365897	/nfs/dbraw/zinc/36/58/97/459365897.db2.gz	ULCMEEVVDVIOAN-STQMWFEESA-N	0	3	343.254	3.359	20	30		EGEDHN
N#CCc1ccc(NC(=O)N2CC[C@H](N3CCCC3)C2)c(Cl)c1	ZINC000582469970	459370001	/nfs/dbraw/zinc/37/00/01/459370001.db2.gz	GKJUEPBZDYEPIP-AWEZNQCLSA-N	0	3	332.835	3.108	20	30		EGEDHN
CN1CC[C@H]2CCN(C(=O)c3ccc(C#Cc4ccccc4)cc3)[C@@H]2C1	ZINC000538713898	459373952	/nfs/dbraw/zinc/37/39/52/459373952.db2.gz	BWLQKXPUERVWCF-RBBKRZOGSA-N	0	3	344.458	3.253	20	30		EGEDHN
C=CCN(CC=C)C(=O)NC[C@H](C1CC1)N(C)Cc1ccccc1	ZINC000483691317	459383705	/nfs/dbraw/zinc/38/37/05/459383705.db2.gz	TWPZBYKVMJBPIY-LJQANCHMSA-N	0	3	327.472	3.281	20	30		EGEDHN
C=CCN(CC(=O)NC(=O)NCc1cccs1)CC1CCCCC1	ZINC000484512453	459416370	/nfs/dbraw/zinc/41/63/70/459416370.db2.gz	GFDZUAICZMAKTM-UHFFFAOYSA-N	0	3	349.500	3.142	20	30		EGEDHN
COc1ccc(C#N)cc1CN1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000595747101	459423083	/nfs/dbraw/zinc/42/30/83/459423083.db2.gz	GFBTWNJPFKJDBB-VQTJNVASSA-N	0	3	336.435	3.165	20	30		EGEDHN
Cc1cccc(C)c1OC[C@H](O)CN[C@@H]1CCc2cc(C#N)ccc21	ZINC000591763769	459430235	/nfs/dbraw/zinc/43/02/35/459430235.db2.gz	IFJPTNKSCNDDRC-UYAOXDASSA-N	0	3	336.435	3.192	20	30		EGEDHN
C=CCC1(NCC(=O)Nc2c(C#N)cnn2-c2ccccc2)CCCC1	ZINC000595780562	459437474	/nfs/dbraw/zinc/43/74/74/459437474.db2.gz	VCHRZOKDAANCMD-UHFFFAOYSA-N	0	3	349.438	3.161	20	30		EGEDHN
C[C@]1(NCC#Cc2ccc(OC(F)(F)F)cc2)CCO[C@H]1C1CC1	ZINC000541384351	459450834	/nfs/dbraw/zinc/45/08/34/459450834.db2.gz	UILOMVBSXSDTGF-IRXDYDNUSA-N	0	3	339.357	3.484	20	30		EGEDHN
CN(C)C[C@@H](CNC(=O)C1(C#N)CCCC1)c1ccc(Cl)cc1	ZINC000561688929	459474342	/nfs/dbraw/zinc/47/43/42/459474342.db2.gz	DJFCNTOAVHKXLB-OAHLLOKOSA-N	0	3	333.863	3.185	20	30		EGEDHN
COc1ccc2ncc(C#N)c(N3CC[C@@H](N4CCCCC4)C3)c2c1	ZINC000591909515	459481669	/nfs/dbraw/zinc/48/16/69/459481669.db2.gz	SWGCNYJSVVOGGS-MRXNPFEDSA-N	0	3	336.439	3.180	20	30		EGEDHN
CCCN(C(=O)N[C@H](CCC#N)c1ccccc1)[C@@H]1CCN(C)C1	ZINC000591992390	459507441	/nfs/dbraw/zinc/50/74/41/459507441.db2.gz	LGGSXOKCNVNADQ-QZTJIDSGSA-N	0	3	328.460	3.157	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N[C@@H]1CCO[C@@H](c2ccccn2)C1	ZINC000569802653	459513181	/nfs/dbraw/zinc/51/31/81/459513181.db2.gz	NXGBKNGFFXGHRI-NLWGTHIKSA-N	0	3	349.434	3.190	20	30		EGEDHN
CC[C@@H](C)N[C@@H](CNC(=O)N1CCC(CCC#N)CC1)c1ccco1	ZINC000592022785	459513283	/nfs/dbraw/zinc/51/32/83/459513283.db2.gz	FWZPCNDYJGEMPO-WBVHZDCISA-N	0	3	346.475	3.434	20	30		EGEDHN
N#CCC1CCN(C(=O)NC[C@@H](c2cccs2)N2CCCC2)CC1	ZINC000541967335	459514809	/nfs/dbraw/zinc/51/48/09/459514809.db2.gz	UOQQDZDWESBWLH-INIZCTEOSA-N	0	3	346.500	3.220	20	30		EGEDHN
N#CC[C@H]1CCCN(C(=O)NC[C@@H](c2cccs2)N2CCCC2)C1	ZINC000596092003	459517545	/nfs/dbraw/zinc/51/75/45/459517545.db2.gz	HFWMQKOICCJDJO-CVEARBPZSA-N	0	3	346.500	3.220	20	30		EGEDHN
Cc1cc(CN2CCC[C@H](CNC(=O)C(C)(C)C)C2)ccc1C#N	ZINC000487878785	459535458	/nfs/dbraw/zinc/53/54/58/459535458.db2.gz	LGNBRKFZTQUWTJ-QGZVFWFLSA-N	0	3	327.472	3.241	20	30		EGEDHN
N#CC[C@@]1(O)CCN(CCCCOc2ccccc2C(F)(F)F)C1	ZINC000592151416	459538169	/nfs/dbraw/zinc/53/81/69/459538169.db2.gz	OQIWMAMUGKOMKS-MRXNPFEDSA-N	0	3	342.361	3.215	20	30		EGEDHN
CC(C)[C@@H]1CN(Cc2ccc(C#N)cc2Br)CCN1C	ZINC000488073064	459538260	/nfs/dbraw/zinc/53/82/60/459538260.db2.gz	KXVXHPJTDHPGAE-INIZCTEOSA-N	0	3	336.277	3.093	20	30		EGEDHN
Cc1nc(NC[C@@H]2CCCN(C)[C@H]2c2cccs2)ccc1C#N	ZINC000488062880	459538628	/nfs/dbraw/zinc/53/86/28/459538628.db2.gz	IEWIRJADAPOJSJ-MAUKXSAKSA-N	0	3	326.469	3.240	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CC[C@H]1Nc1nc(C#N)c(Cl)s1	ZINC000596151836	459538997	/nfs/dbraw/zinc/53/89/97/459538997.db2.gz	BLDOBBWSOZHBMS-GXTWGEPZSA-N	0	3	346.887	3.413	20	30		EGEDHN
C=CC1CCN(C[C@@H](O)COc2ccccc2C(F)(F)F)CC1	ZINC000542281089	459543158	/nfs/dbraw/zinc/54/31/58/459543158.db2.gz	UVZQNASAMSDWFU-CQSZACIVSA-N	0	3	329.362	3.343	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1CN[C@H](C)c1ccc(Br)cn1	ZINC000562439551	459562103	/nfs/dbraw/zinc/56/21/03/459562103.db2.gz	UDDQKMUZCCGMMG-XUJVJEKNSA-N	0	3	325.250	3.476	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(Cl)c3cccnc23)CC1	ZINC000490590868	459580517	/nfs/dbraw/zinc/58/05/17/459580517.db2.gz	XIVLDKLSAMXBMD-UHFFFAOYSA-N	0	3	327.815	3.172	20	30		EGEDHN
C[C@H](NCC1(c2ccccc2)CCCC1)C(=O)NC1(C#N)CCC1	ZINC000527039892	459580658	/nfs/dbraw/zinc/58/06/58/459580658.db2.gz	NDUZGPNMLVJHEV-INIZCTEOSA-N	0	3	325.456	3.039	20	30		EGEDHN
N#CCc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3sccc32)cc1	ZINC000583689420	459581741	/nfs/dbraw/zinc/58/17/41/459581741.db2.gz	QBFMGDXVDYEBLR-MAUKXSAKSA-N	0	3	342.464	3.221	20	30		EGEDHN
CC[C@H](N[C@@H](C)c1ccc(C#N)cc1)C(=O)NCc1cccs1	ZINC000592396052	459590772	/nfs/dbraw/zinc/59/07/72/459590772.db2.gz	NMWFIPUFEYIOOH-GUYCJALGSA-N	0	3	327.453	3.365	20	30		EGEDHN
CC[C@@H](N[C@@H](C)c1ccc(C#N)cc1)C(=O)NCc1cccs1	ZINC000592396059	459591077	/nfs/dbraw/zinc/59/10/77/459591077.db2.gz	NMWFIPUFEYIOOH-SUMWQHHRSA-N	0	3	327.453	3.365	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1c[nH]nc1-c1ccoc1)C(C)C	ZINC000562592047	459595652	/nfs/dbraw/zinc/59/56/52/459595652.db2.gz	IJONTVRGWWWWAC-KRWDZBQOSA-N	0	3	342.443	3.098	20	30		EGEDHN
C#CCNC(=O)C1CCN(Cc2ccc(OCCCCC)cc2)CC1	ZINC000491203449	459604150	/nfs/dbraw/zinc/60/41/50/459604150.db2.gz	WFVWTXVGCHGLFJ-UHFFFAOYSA-N	0	3	342.483	3.217	20	30		EGEDHN
CCCN(C(=O)NC[C@@H](C)C#N)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000542875471	459605160	/nfs/dbraw/zinc/60/51/60/459605160.db2.gz	JYYHODUMPCPVIV-HKUYNNGSSA-N	0	3	342.487	3.232	20	30		EGEDHN
C#CCN(C(=O)[C@H]1CCCN(Cc2cccnc2)C1)C1CCCCC1	ZINC000491230228	459607183	/nfs/dbraw/zinc/60/71/83/459607183.db2.gz	LHOIMNAKONCFOP-IBGZPJMESA-N	0	3	339.483	3.088	20	30		EGEDHN
C[C@H]1CCCN(CC#Cc2ccc(OC(F)(F)F)cc2)[C@H]1CO	ZINC000499055954	459617716	/nfs/dbraw/zinc/61/77/16/459617716.db2.gz	ZBVKBVPXZDRCBS-BBRMVZONSA-N	0	3	327.346	3.030	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)[C@@H]2CCCc3ccccc32)CC1	ZINC000592526143	459625813	/nfs/dbraw/zinc/62/58/13/459625813.db2.gz	UQBBDJYRHLPGKM-LJQANCHMSA-N	0	3	327.472	3.356	20	30		EGEDHN
C=CCN(CCc1ccco1)C[C@@H](O)COc1ccc(Cl)cc1	ZINC000491424647	459626270	/nfs/dbraw/zinc/62/62/70/459626270.db2.gz	VWTFNRUUADXOME-MRXNPFEDSA-N	0	3	335.831	3.403	20	30		EGEDHN
C=CCN1CCC(NC(=O)/C=C\c2ccc(OC)c(Cl)c2)CC1	ZINC000491550126	459636167	/nfs/dbraw/zinc/63/61/67/459636167.db2.gz	YPABPUZIZSSLNO-ALCCZGGFSA-N	0	3	334.847	3.128	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)/C=C\c1ccccc1	ZINC000491574593	459638788	/nfs/dbraw/zinc/63/87/88/459638788.db2.gz	FFTCMJMQXFSMAH-QXMHVHEDSA-N	0	3	333.435	3.162	20	30		EGEDHN
C[C@@H](O)[C@H]1CCCN(Cc2cn(CCC#N)nc2-c2ccccc2)C1	ZINC000543748508	459694056	/nfs/dbraw/zinc/69/40/56/459694056.db2.gz	TZRGCVWOCUZKRX-AEFFLSMTSA-N	0	3	338.455	3.057	20	30		EGEDHN
Cc1cc(C(C)(C)C)ccc1OC[C@@H](O)CN[C@@H]1CC[C@H](C#N)C1	ZINC000573596741	459703166	/nfs/dbraw/zinc/70/31/66/459703166.db2.gz	NVCPQIYOSCMFSW-JQHSSLGASA-N	0	3	330.472	3.314	20	30		EGEDHN
CCn1cc(CN(CCC(=O)Nc2ccccc2C#N)C(C)C)cn1	ZINC000593080335	459767176	/nfs/dbraw/zinc/76/71/76/459767176.db2.gz	MRBJMYRXOGFKDY-UHFFFAOYSA-N	0	3	339.443	3.014	20	30		EGEDHN
Cc1cc(C)cc(N(CCC#N)C(=O)CNC2(C3CCC3)CC2)c1	ZINC000593084461	459769135	/nfs/dbraw/zinc/76/91/35/459769135.db2.gz	PPOZELKZUCSANJ-UHFFFAOYSA-N	0	3	325.456	3.472	20	30		EGEDHN
CCc1ccc([C@H](C#N)NC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000564224638	459772341	/nfs/dbraw/zinc/77/23/41/459772341.db2.gz	NULFNJDSPYLIDA-RTWAWAEBSA-N	0	3	347.462	3.452	20	30		EGEDHN
C[C@H](NCC(=O)N[C@](C)(C#N)C1CC1)c1ccc(F)c2ccccc21	ZINC000565269786	459781984	/nfs/dbraw/zinc/78/19/84/459781984.db2.gz	JXHLUVVYVRCEFN-RNODOKPDSA-N	0	3	339.414	3.438	20	30		EGEDHN
C[C@@H](C(=O)NC1(C#N)CCC1)N1CCC[C@H](c2ccc(F)cc2)CC1	ZINC000565456364	459785002	/nfs/dbraw/zinc/78/50/02/459785002.db2.gz	TUDWRFPNRQTEGG-HOTGVXAUSA-N	0	3	343.446	3.346	20	30		EGEDHN
N#Cc1ccc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)cc1F	ZINC000593158159	459791447	/nfs/dbraw/zinc/79/14/47/459791447.db2.gz	SJLOWSYIDHSDOX-VXGBXAGGSA-N	0	3	330.281	3.383	20	30		EGEDHN
CCCN1CC[C@@H](NC(=O)Nc2ccc(OC(C)(C)C)c(C#N)c2)C1	ZINC000596927588	459797695	/nfs/dbraw/zinc/79/76/95/459797695.db2.gz	JVHJKRHBLLVSRS-MRXNPFEDSA-N	0	3	344.459	3.341	20	30		EGEDHN
C[C@@H]1CCN(C[C@H](O)COc2ccccc2C#N)[C@@H](c2ccco2)C1	ZINC000528394347	459805393	/nfs/dbraw/zinc/80/53/93/459805393.db2.gz	JZTFIHDTGFYQOX-BPQIPLTHSA-N	0	3	340.423	3.364	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]2c2ccc(Cl)cc2)cc1	ZINC000566123578	459810622	/nfs/dbraw/zinc/81/06/22/459810622.db2.gz	CBWVPUWSEJAFOK-NZSAHSFTSA-N	0	3	342.826	3.097	20	30		EGEDHN
CN(CCN1CCCCC1)C(=O)N[C@H]1CCCc2cc(C#N)ccc21	ZINC000593414941	459882219	/nfs/dbraw/zinc/88/22/19/459882219.db2.gz	CSHMIMDKHVPMCY-IBGZPJMESA-N	0	3	340.471	3.063	20	30		EGEDHN
CN(Cc1cccc(OCc2ccccc2C#N)c1)C1(CO)CCC1	ZINC000597254295	459896688	/nfs/dbraw/zinc/89/66/88/459896688.db2.gz	INXJUOQYNQHMON-UHFFFAOYSA-N	0	3	336.435	3.484	20	30		EGEDHN
Cn1nc(CNCCSCc2ccccc2C#N)c2ccccc21	ZINC000608982523	459898720	/nfs/dbraw/zinc/89/87/20/459898720.db2.gz	PXEIJBIBNMQWQD-UHFFFAOYSA-N	0	3	336.464	3.468	20	30		EGEDHN
CC(C)(CNC(=O)c1cc2ccccc2n1CC#N)N1CCCCC1	ZINC000609200270	459923091	/nfs/dbraw/zinc/92/30/91/459923091.db2.gz	QRSZQXHCNOTYCF-UHFFFAOYSA-N	0	3	338.455	3.159	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN2CCCc3sccc3C2)c1	ZINC000609323101	459942633	/nfs/dbraw/zinc/94/26/33/459942633.db2.gz	SQLZFAIMFQECFN-UHFFFAOYSA-N	0	3	325.437	3.397	20	30		EGEDHN
N#Cc1cccc(CN2CCC(NCc3ncc(Cl)s3)CC2)c1	ZINC000593693348	459954140	/nfs/dbraw/zinc/95/41/40/459954140.db2.gz	VRPJEEGWFMXUSY-UHFFFAOYSA-N	0	3	346.887	3.422	20	30		EGEDHN
COc1cccc(C=C2CCN(C[C@@H](O)CC(C)(C)C#N)CC2)c1	ZINC000598593316	459954914	/nfs/dbraw/zinc/95/49/14/459954914.db2.gz	QYFOIGNZMLFTFP-SFHVURJKSA-N	0	3	328.456	3.475	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN1CCC(OCc2ccccc2F)CC1	ZINC000598601138	459959573	/nfs/dbraw/zinc/95/95/73/459959573.db2.gz	QRQGWBLJJQKISA-MRXNPFEDSA-N	0	3	334.435	3.107	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN[C@H](CN1CCCCC1)c1ccccc1	ZINC000598604016	459961107	/nfs/dbraw/zinc/96/11/07/459961107.db2.gz	NNRGZTRPVSNLMI-RBUKOAKNSA-N	0	3	329.488	3.104	20	30		EGEDHN
COc1ccc(CN(C[C@H](O)CC(C)(C)C#N)CC2CC2)c(OC)c1	ZINC000598619308	459965746	/nfs/dbraw/zinc/96/57/46/459965746.db2.gz	NNPXUYFJHOZTAR-QGZVFWFLSA-N	0	3	346.471	3.217	20	30		EGEDHN
CC[C@@H](C#N)C(=O)Nc1cc(Cl)ccc1OC1CCN(C)CC1	ZINC000593739276	459968906	/nfs/dbraw/zinc/96/89/06/459968906.db2.gz	XQXRYITZBXWTKP-LBPRGKRZSA-N	0	3	335.835	3.301	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CC1(C#N)CCCCC1	ZINC000597515647	459982122	/nfs/dbraw/zinc/98/21/22/459982122.db2.gz	CTAQOGJWYZCQCN-MJGOQNOKSA-N	0	3	339.483	3.487	20	30		EGEDHN
C=CCCOCC(=O)N(CCC)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000624956410	459985337	/nfs/dbraw/zinc/98/53/37/459985337.db2.gz	RFHIVCBFTQQYBN-HXUWFJFHSA-N	0	3	344.499	3.482	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CNCc1ccnc(Oc2ccc(F)cc2)c1	ZINC000598718709	460004585	/nfs/dbraw/zinc/00/45/85/460004585.db2.gz	CUBNQVUMUQFWJW-MRXNPFEDSA-N	0	3	343.402	3.403	20	30		EGEDHN
CC[C@](C)(COc1ncccc1Cl)NCc1cccc(C#N)n1	ZINC000602583088	460009776	/nfs/dbraw/zinc/00/97/76/460009776.db2.gz	PNKZQESHTLSCOM-QGZVFWFLSA-N	0	3	330.819	3.339	20	30		EGEDHN
C[C@H](CCC#N)CNc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1	ZINC000602656494	460047462	/nfs/dbraw/zinc/04/74/62/460047462.db2.gz	YSDCPWIKFMNOII-VQIMIIECSA-N	0	3	342.487	3.205	20	30		EGEDHN
CCN(C[C@@H]1CCCN1CC)C(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000576063623	460062689	/nfs/dbraw/zinc/06/26/89/460062689.db2.gz	PVMSSBWZQBVGTB-SFHVURJKSA-N	0	3	327.472	3.434	20	30		EGEDHN
COc1cccc([C@@H](CN[C@@H](C)CC2(C#N)CCOCC2)OC)c1	ZINC000602720663	460084343	/nfs/dbraw/zinc/08/43/43/460084343.db2.gz	KPGRONPGVMOBEV-MAUKXSAKSA-N	0	3	332.444	3.071	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)N[C@@H]1CCCN2CCCC[C@@H]12	ZINC000594071567	460086832	/nfs/dbraw/zinc/08/68/32/460086832.db2.gz	PSZBTJQWBAZWEU-WBVHZDCISA-N	0	3	342.443	3.095	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)N[C@@H]1CCCN2CCCC[C@H]12	ZINC000594071565	460087125	/nfs/dbraw/zinc/08/71/25/460087125.db2.gz	PSZBTJQWBAZWEU-NVXWUHKLSA-N	0	3	342.443	3.095	20	30		EGEDHN
Cc1cccc2c1ncc(C#N)c2NCCN1CCc2ccccc2C1	ZINC000610245715	460094364	/nfs/dbraw/zinc/09/43/64/460094364.db2.gz	BOIFJWLAGRQGOF-UHFFFAOYSA-N	0	3	342.446	3.307	20	30		EGEDHN
N#Cc1ccc(OCCN[C@H](Cn2cccn2)c2ccccc2)cc1	ZINC000610432865	460151294	/nfs/dbraw/zinc/15/12/94/460151294.db2.gz	FTMBJZLMCZXOHX-HXUWFJFHSA-N	0	3	332.407	3.165	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN[C@@H]([C@@H]1CCCO1)C1(CO)CCC1	ZINC000602890277	460172920	/nfs/dbraw/zinc/17/29/20/460172920.db2.gz	GCHCCAPXGPDHSH-OALUTQOASA-N	0	3	342.483	3.288	20	30		EGEDHN
C[C@@H](CNC(=O)N[C@@H]1CCc2cc(C#N)ccc21)N1CCCC[C@H]1C	ZINC000618797758	460178975	/nfs/dbraw/zinc/17/89/75/460178975.db2.gz	TXNYEMFMFHEZCI-ZRGWGRIASA-N	0	3	340.471	3.108	20	30		EGEDHN
COc1ccc2cc(CN(C)C(=O)[C@@H](N)CCCCC#N)ccc2c1	ZINC000594425992	460215806	/nfs/dbraw/zinc/21/58/06/460215806.db2.gz	OAXQRESFJNHPGP-IBGZPJMESA-N	0	3	339.439	3.218	20	30		EGEDHN
Cc1nc(NC(=O)[C@H](N)CCCCC#N)sc1Cc1ccccc1	ZINC000594429626	460216316	/nfs/dbraw/zinc/21/63/16/460216316.db2.gz	VACKIFATAHYOGR-OAHLLOKOSA-N	0	3	342.468	3.392	20	30		EGEDHN
COc1ccc2c(c1)C[C@H](C(C)C)CN2C(=O)[C@H](N)CCCCC#N	ZINC000594449810	460224990	/nfs/dbraw/zinc/22/49/90/460224990.db2.gz	OMSAVJSAZXAXEK-FUHWJXTLSA-N	0	3	343.471	3.268	20	30		EGEDHN
CC(C)(C#N)CCCCN(Cc1ccccc1)[C@@]1(CO)CCOC1	ZINC000599395648	460245728	/nfs/dbraw/zinc/24/57/28/460245728.db2.gz	GXKVTNYNPMEGLS-HXUWFJFHSA-N	0	3	330.472	3.360	20	30		EGEDHN
C[C@@H]1CN(CCC(=O)Nc2sccc2C#N)C[C@H](C)C1(F)F	ZINC000599512153	460264839	/nfs/dbraw/zinc/26/48/39/460264839.db2.gz	DGLSNDFVLRULPE-PHIMTYICSA-N	0	3	327.400	3.171	20	30		EGEDHN
CN(C(=O)C1CCN(Cc2ccccc2)CC1)c1ccccc1C#N	ZINC000611071822	460285876	/nfs/dbraw/zinc/28/58/76/460285876.db2.gz	OJCOQIQPVBSDEH-UHFFFAOYSA-N	0	3	333.435	3.433	20	30		EGEDHN
Cc1ccc(CN2CC[C@@H](CN(C)c3ncc(C#N)cc3F)C2)s1	ZINC000603403742	460298030	/nfs/dbraw/zinc/29/80/30/460298030.db2.gz	XYZXUPPFKXEYDT-AWEZNQCLSA-N	0	3	344.459	3.421	20	30		EGEDHN
C[C@@H](N[C@@H](CCC#N)c1ccccc1)c1cccc(-n2cnnn2)c1	ZINC000611337081	460339373	/nfs/dbraw/zinc/33/93/73/460339373.db2.gz	VJPLRMGTZZDAFX-BEFAXECRSA-N	0	3	332.411	3.358	20	30		EGEDHN
C[C@@H](NC[C@H](O)COc1ccc(Cl)cc1)c1cccc(C#N)c1	ZINC000611387281	460351545	/nfs/dbraw/zinc/35/15/45/460351545.db2.gz	JFPMNWMHSMTUJN-DYVFJYSZSA-N	0	3	330.815	3.302	20	30		EGEDHN
COCCOc1ccc(CN[C@H]2CCCc3cc(C#N)ccc32)cn1	ZINC000611390892	460352707	/nfs/dbraw/zinc/35/27/07/460352707.db2.gz	WBHNCMJOYQVGEK-IBGZPJMESA-N	0	3	337.423	3.146	20	30		EGEDHN
N#Cc1cccc(NC(=O)C2CCN(Cc3ccc(O)cc3)CC2)c1	ZINC000611526213	460389182	/nfs/dbraw/zinc/38/91/82/460389182.db2.gz	DIOIOCBQOULMBN-UHFFFAOYSA-N	0	3	335.407	3.115	20	30		EGEDHN
CC(C#N)C(=O)N1CC[C@@H](Sc2ccc(Br)cc2)C1	ZINC000600216148	460446414	/nfs/dbraw/zinc/44/64/14/460446414.db2.gz	VTVJTUUMYIFILY-GXFFZTMASA-N	0	3	339.258	3.302	20	30		EGEDHN
C[C@H](NC(=O)C(C#N)CCc1ccccc1)c1ccc2[nH]c(=O)oc2c1	ZINC000601864971	460930055	/nfs/dbraw/zinc/93/00/55/460930055.db2.gz	NLMVPVFHKZFRNB-XJKSGUPXSA-N	0	3	349.390	3.483	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN(C)CC2(O)CCC2)cc1OC	ZINC000628238598	461058886	/nfs/dbraw/zinc/05/88/86/461058886.db2.gz	GDOAHBKMLAEJHQ-UHFFFAOYSA-N	0	3	325.836	3.260	20	30		EGEDHN
C=C(C)[C@H]1OCCC[C@H]1C(=O)Nc1ccc(CN(C)C)cc1OC	ZINC000633378353	461065486	/nfs/dbraw/zinc/06/54/86/461065486.db2.gz	IZPMQGHWMIRKCQ-CRAIPNDOSA-N	0	3	332.444	3.067	20	30		EGEDHN
C=CCN1CCC(NC(=O)Cc2nc(-c3ccccc3)cs2)CC1	ZINC000668368728	461258340	/nfs/dbraw/zinc/25/83/40/461258340.db2.gz	FDGHUEONHFKLHP-UHFFFAOYSA-N	0	3	341.480	3.119	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C(C)(C)Oc2ccc(OC)cc2)CC1	ZINC000668369664	461259126	/nfs/dbraw/zinc/25/91/26/461259126.db2.gz	APICGJDFMXSJJV-UHFFFAOYSA-N	0	3	346.471	3.009	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1ccc2c(c1)CCOC2)C(C)C	ZINC000668683176	461380096	/nfs/dbraw/zinc/38/00/96/461380096.db2.gz	SXBCHNBFRDPLFO-FQEVSTJZSA-N	0	3	342.483	3.188	20	30		EGEDHN
Cc1ccc(NC(=O)[C@@H](N)CCCC#N)cc1C(=O)c1ccccc1	ZINC000639002177	461674643	/nfs/dbraw/zinc/67/46/43/461674643.db2.gz	YTEYPDQAZDEMRW-SFHVURJKSA-N	0	3	335.407	3.186	20	30		EGEDHN
C=CCCn1cc(CN[C@@H](Cc2ccccc2OC)C(C)C)nn1	ZINC000653614387	461760019	/nfs/dbraw/zinc/76/00/19/461760019.db2.gz	ZYHZJWUPHLCMRP-SFHVURJKSA-N	0	3	328.460	3.220	20	30		EGEDHN
C=CCN(C(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1)[C@H](C)COC	ZINC000663785803	461805660	/nfs/dbraw/zinc/80/56/60/461805660.db2.gz	ZNJVTBQNJAZTLM-ZHALLVOQSA-N	0	3	345.487	3.054	20	30		EGEDHN
C=CC[C@@H]1CCCN(Cc2cnn3cc(Br)cnc23)C1	ZINC000639308227	461855108	/nfs/dbraw/zinc/85/51/08/461855108.db2.gz	DFDJJUIUSVKJIX-GFCCVEGCSA-N	0	3	335.249	3.280	20	30		EGEDHN
C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H]1CCN(CCC)C1	ZINC000666922220	461870282	/nfs/dbraw/zinc/87/02/82/461870282.db2.gz	MJHFSYBDZKEDHW-GOSISDBHSA-N	0	3	347.507	3.036	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCC([C@H]3CCCCO3)CC2)CC1	ZINC000660597504	461872330	/nfs/dbraw/zinc/87/23/30/461872330.db2.gz	QDWDVVGVOHOWSU-LJQANCHMSA-N	0	3	349.519	3.018	20	30		EGEDHN
C=CCOc1cccc(NC[C@H](O)CN(C)Cc2ccccc2)c1	ZINC000644686625	462039129	/nfs/dbraw/zinc/03/91/29/462039129.db2.gz	IJPMJSVQSIOPSH-IBGZPJMESA-N	0	3	326.440	3.156	20	30		EGEDHN
C=CCCn1cc(CNc2cccc(CN3CCSCC3)c2)nn1	ZINC000657406790	462101974	/nfs/dbraw/zinc/10/19/74/462101974.db2.gz	DTKKQUDWROYECE-UHFFFAOYSA-N	0	3	343.500	3.015	20	30		EGEDHN
C=CCN(CCC(=O)N[C@H]1CCCc2ccccc21)[C@@H](C)COC	ZINC000661245397	462168642	/nfs/dbraw/zinc/16/86/42/462168642.db2.gz	ZZZFNFMSTYWNBN-LPHOPBHVSA-N	0	3	330.472	3.093	20	30		EGEDHN
C=CC[C@@H](CC)NC(=O)N1CC[C@H](N(C)CCc2ccccc2)C1	ZINC000664809066	462196373	/nfs/dbraw/zinc/19/63/73/462196373.db2.gz	HMFYTKGOCYWPLJ-MOPGFXCFSA-N	0	3	329.488	3.300	20	30		EGEDHN
C=CC[C@H]1CCCN(CC(=O)N2CCO[C@H](c3ccc(F)cc3)C2)C1	ZINC000661381278	462225313	/nfs/dbraw/zinc/22/53/13/462225313.db2.gz	ZBQBQXAFWXHUOT-LPHOPBHVSA-N	0	3	346.446	3.014	20	30		EGEDHN
C=CCN(CCc1ccco1)C(=O)N[C@H]1CCCN2CCCC[C@@H]12	ZINC000654731987	462358468	/nfs/dbraw/zinc/35/84/68/462358468.db2.gz	QIVJFMKVYUGFFZ-ROUUACIJSA-N	0	3	331.460	3.037	20	30		EGEDHN
C=CCN(CC(=O)N(Cc1ccco1)CC(F)(F)F)C(C)(C)C	ZINC000661755880	462398756	/nfs/dbraw/zinc/39/87/56/462398756.db2.gz	SXKXMWFCSHKTAZ-UHFFFAOYSA-N	0	3	332.366	3.457	20	30		EGEDHN
C=CCC1(NCC(=O)Nc2ccccc2N2CCCC2=O)CCCC1	ZINC000661848484	462436968	/nfs/dbraw/zinc/43/69/68/462436968.db2.gz	FANGMNJHDSWOOU-UHFFFAOYSA-N	0	3	341.455	3.230	20	30		EGEDHN
C[C@H](N[C@@H]1CN(Cc2ccccc2)CC[C@@H]1CO)c1cccc(C#N)c1	ZINC000181784588	533991872	/nfs/dbraw/zinc/99/18/72/533991872.db2.gz	LJUZYHQDSZUATK-MTNREXPMSA-N	0	3	349.478	3.092	20	30		EGEDHN
Cc1oc(NC(=O)CN[C@H](C)[C@H](C)c2ccccc2)c(C#N)c1C	ZINC000181528156	534549061	/nfs/dbraw/zinc/54/90/61/534549061.db2.gz	MQCABMIPWQWEFP-GXTWGEPZSA-N	0	3	325.412	3.488	20	30		EGEDHN
Cc1oc([N-]C(=O)C[NH2+][C@H](C)[C@H](C)c2ccccc2)c(C#N)c1C	ZINC000181528156	534549068	/nfs/dbraw/zinc/54/90/68/534549068.db2.gz	MQCABMIPWQWEFP-GXTWGEPZSA-N	0	3	325.412	3.488	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)CCc2c(C)noc2C)cc1	ZINC000103504568	523989140	/nfs/dbraw/zinc/98/91/40/523989140.db2.gz	DYGWVWCYMDBCGG-QGZVFWFLSA-N	0	3	339.395	3.134	20	30		EGEDHN
N#Cc1ccnc(NC[C@@H](c2ccccc2)N2CCCC2)c1[N+](=O)[O-]	ZINC000132544435	534824940	/nfs/dbraw/zinc/82/49/40/534824940.db2.gz	IEJOZCIERHQEPI-INIZCTEOSA-N	0	3	337.383	3.110	20	30		EGEDHN
C=CCN1CCC(N[C@@H](C)c2ncc(Br)cc2F)CC1	ZINC000187178021	526453602	/nfs/dbraw/zinc/45/36/02/526453602.db2.gz	YEFIAYBLLIIZRS-NSHDSACASA-N	0	3	342.256	3.284	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)CCCc2ccccc2)CC1	ZINC000171560885	526583874	/nfs/dbraw/zinc/58/38/74/526583874.db2.gz	PRJSGPMQMMRPMO-UHFFFAOYSA-N	0	3	329.488	3.301	20	30		EGEDHN
C#CCCCCNC(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000155038320	526696821	/nfs/dbraw/zinc/69/68/21/526696821.db2.gz	YPMVLZFZLDSJRD-ICSRJNTNSA-N	0	3	341.499	3.484	20	30		EGEDHN
C#CCOc1ccc([C@H](C)NC[C@H](O)c2cccc(OC)c2)cc1	ZINC000178083938	527115786	/nfs/dbraw/zinc/11/57/86/527115786.db2.gz	HKEZAIQKTBUNCG-YWZLYKJASA-N	0	3	325.408	3.091	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)N[C@H](C)c1ccc(-n2cccn2)cc1	ZINC000174367811	527636880	/nfs/dbraw/zinc/63/68/80/527636880.db2.gz	MHIJOVGDAQVHRG-SJORKVTESA-N	0	3	338.455	3.112	20	30		EGEDHN
CC1CCN([C@H](CNC(=O)c2c[nH]c(C#N)c2)c2cccs2)CC1	ZINC000181154690	528261544	/nfs/dbraw/zinc/26/15/44/528261544.db2.gz	CIXUMAHFHXRUTG-MRXNPFEDSA-N	0	3	342.468	3.151	20	30		EGEDHN
CC1(C)C[C@@H](NCC(=O)Nc2cc(Cl)ccc2C#N)C(C)(C)O1	ZINC000132658863	529138888	/nfs/dbraw/zinc/13/88/88/529138888.db2.gz	URGXKNYFGSSGBI-CQSZACIVSA-N	0	3	335.835	3.086	20	30		EGEDHN
C=CCC[C@H](NC(=O)N[C@@H]1CCN(CC2CC2)C1)c1ccccc1	ZINC000158689775	546930427	/nfs/dbraw/zinc/93/04/27/546930427.db2.gz	IFOJLSJXYWKGOL-MOPGFXCFSA-N	0	3	327.472	3.477	20	30		EGEDHN
C[C@@H]1CC[C@@H](C)N1CC(=O)N1CCC(NC(=O)C2CCCCC2)CC1	ZINC000329587326	547501756	/nfs/dbraw/zinc/50/17/56/547501756.db2.gz	RXRKLCAXXMIVDY-HZPDHXFCSA-N	0	3	349.519	3.387	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Nc1cnn(C(C)(C)C)c1)C(C)C	ZINC000357723372	547739915	/nfs/dbraw/zinc/73/99/15/547739915.db2.gz	DBZDVVKWVSQDIJ-KRWDZBQOSA-N	0	3	347.507	3.458	20	30		EGEDHN
C[C@@H]1CCCCN1CCNC(=O)Nc1ccc(CC#N)cc1Cl	ZINC000455698054	547938024	/nfs/dbraw/zinc/93/80/24/547938024.db2.gz	FNNCXQLDZKNAQA-CYBMUJFWSA-N	0	3	334.851	3.402	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N[C@H](C)c1cnccc1C)C(C)C	ZINC000678436188	549492131	/nfs/dbraw/zinc/49/21/31/549492131.db2.gz	MINHOQWRAYOKKS-IEBWSBKVSA-N	0	3	344.503	3.449	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN[C@@H](CN1CCCCC1)c1ccccc1	ZINC000679939854	549793895	/nfs/dbraw/zinc/79/38/95/549793895.db2.gz	ZXHRSMOAGFBOMC-FQEVSTJZSA-N	0	3	343.515	3.228	20	30		EGEDHN
CN(C)CCNC(=S)Nc1cccc(Oc2ccc(C#N)cc2)c1	ZINC000729158751	574819125	/nfs/dbraw/zinc/81/91/25/574819125.db2.gz	SNKNCXXUKHDWCI-UHFFFAOYSA-N	0	3	340.452	3.199	20	30		EGEDHN
CCCCNC(=O)[C@H]1CC[C@@H](C)N(Cc2ccc(OCC#N)cc2)C1	ZINC000729268185	574834452	/nfs/dbraw/zinc/83/44/52/574834452.db2.gz	PPPXQBHMJLNGGK-AEFFLSMTSA-N	0	3	343.471	3.106	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(OC)c3ncccc23)CC1	ZINC000730125551	574922146	/nfs/dbraw/zinc/92/21/46/574922146.db2.gz	VPUZGOXGTHAVBW-UHFFFAOYSA-N	0	3	340.427	3.015	20	30		EGEDHN
C#CCOc1cccc(NC(=O)NC[C@@H](C)N2CCCC[C@@H]2C)c1	ZINC000731111120	575055095	/nfs/dbraw/zinc/05/50/95/575055095.db2.gz	JKQYQTVJPTZYCV-JKSUJKDBSA-N	0	3	329.444	3.083	20	30		EGEDHN
C=CCN(CC=C)C(=O)C[N@@H+](Cc1ccccc1[O-])C1CCCC1	ZINC000732204293	575244169	/nfs/dbraw/zinc/24/41/69/575244169.db2.gz	HZPWKMWVHBRULE-UHFFFAOYSA-N	0	3	328.456	3.337	20	30		EGEDHN
C=CCN(CC=C)C(=O)C[N@H+](Cc1ccccc1[O-])C1CCCC1	ZINC000732204293	575244171	/nfs/dbraw/zinc/24/41/71/575244171.db2.gz	HZPWKMWVHBRULE-UHFFFAOYSA-N	0	3	328.456	3.337	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](C)c2nc3ccccc3s2)CC1	ZINC000734215387	575453146	/nfs/dbraw/zinc/45/31/46/575453146.db2.gz	JHHONNUUKRGLPR-ZDUSSCGKSA-N	0	3	344.484	3.307	20	30		EGEDHN
C#CCCN1CCC(NC(=O)Cc2coc3c2ccc(C)c3C)CC1	ZINC000740736356	576621731	/nfs/dbraw/zinc/62/17/31/576621731.db2.gz	PZWPJBXFPPMEDV-UHFFFAOYSA-N	0	3	338.451	3.196	20	30		EGEDHN
C#CCNC(=O)CCNCc1ccc(N(CC)c2ccccc2)cc1	ZINC000742368653	576774434	/nfs/dbraw/zinc/77/44/34/576774434.db2.gz	KEIQPRBXKPORET-UHFFFAOYSA-N	0	3	335.451	3.074	20	30		EGEDHN
C#CCOc1cc(F)ccc1NC(=O)N[C@@H](C)CN1CCC[C@H](C)C1	ZINC000743199579	576803207	/nfs/dbraw/zinc/80/32/07/576803207.db2.gz	HMMHFQIBJCMVQG-GJZGRUSLSA-N	0	3	347.434	3.080	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@@H]1C[C@]12CCc1ccccc12	ZINC000744022796	576818954	/nfs/dbraw/zinc/81/89/54/576818954.db2.gz	SPDMJICNMTUKJT-MMOPVJDHSA-N	0	3	338.451	3.296	20	30		EGEDHN
C[C@H](C(=O)N(C)CCC#N)N1CCC(c2cc3ccccc3[nH]2)CC1	ZINC000744233075	576823645	/nfs/dbraw/zinc/82/36/45/576823645.db2.gz	ZOAPUEMANBPTCI-OAHLLOKOSA-N	0	3	338.455	3.108	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(C[C@@H]3CC3(Cl)Cl)CC2)cc1	ZINC000022850939	1291226505	/nfs/dbraw/zinc/22/65/05/1291226505.db2.gz	AWPKRWZKXWUMPJ-INIZCTEOSA-N	0	3	338.282	3.260	20	30		EGEDHN
N#CC(C(=O)CCc1ccc(Cl)s1)C(=O)NC1CCCCC1	ZINC000050685341	1291656007	/nfs/dbraw/zinc/65/60/07/1291656007.db2.gz	HAEYKFKYPNCMHA-ZDUSSCGKSA-N	0	3	338.860	3.492	20	30		EGEDHN
C[C@H](Cc1cccc(F)c1)C(=O)C(C#N)C(=O)NC1CCCCC1	ZINC000069285180	1292238733	/nfs/dbraw/zinc/23/87/33/1292238733.db2.gz	RGBYMEXZHPLRRP-DYVFJYSZSA-N	0	3	330.403	3.162	20	30		EGEDHN
N#Cc1ccc(OCCCN[C@@H](CCO)c2ccccc2F)cc1	ZINC000830350679	1292709740	/nfs/dbraw/zinc/70/97/40/1292709740.db2.gz	GGKFQVCANCBNLV-IBGZPJMESA-N	0	3	328.387	3.180	20	30		EGEDHN
COc1ccc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)cc1C#N	ZINC000830413075	1292717221	/nfs/dbraw/zinc/71/72/21/1292717221.db2.gz	FGXUSPJBPOCSAO-QWHCGFSZSA-N	0	3	342.317	3.253	20	30		EGEDHN
C[C@@H](NC(=O)c1cc(C#N)ccc1F)[C@@H](c1ccccc1)N(C)C	ZINC000832319940	1292988406	/nfs/dbraw/zinc/98/84/06/1292988406.db2.gz	NKCMXRLHVMAVRK-ACJLOTCBSA-N	0	3	325.387	3.119	20	30		EGEDHN
CCCCOC(=O)CCN1CCC(Oc2cccc(C#N)c2)CC1	ZINC000104963200	1293028436	/nfs/dbraw/zinc/02/84/36/1293028436.db2.gz	GCGZUNCXXYIJPX-UHFFFAOYSA-N	0	3	330.428	3.135	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)[C@@H](C)Cc1ccc(Cl)cc1Cl	ZINC000107409401	1293066734	/nfs/dbraw/zinc/06/67/34/1293066734.db2.gz	AEWDLVLJPMWSER-GXFFZTMASA-N	0	3	341.238	3.405	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)CC[C@@H]2CCCCO2)cc1	ZINC000111945038	1293113509	/nfs/dbraw/zinc/11/35/09/1293113509.db2.gz	NMSXJKAVLZTBAJ-DLBZAZTESA-N	0	3	328.412	3.246	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)c(F)c1)c1ccc(N2CCNC2=O)cc1	ZINC000834903432	1293171286	/nfs/dbraw/zinc/17/12/86/1293171286.db2.gz	PLGMZHAABAWTHU-CYBMUJFWSA-N	0	3	338.386	3.078	20	30		EGEDHN
CN(C)C[C@@](C)(C=NNc1nc(=O)c2ccccc2[nH]1)c1ccccc1	ZINC000834960829	1293181497	/nfs/dbraw/zinc/18/14/97/1293181497.db2.gz	CSVNJLQLNPVVDW-HXUWFJFHSA-N	0	3	349.438	3.253	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)C(C#N)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000119627347	1293280552	/nfs/dbraw/zinc/28/05/52/1293280552.db2.gz	AJRHPXKPWFCGPW-CMPLNLGQSA-N	0	3	338.766	3.108	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@@H](C)Oc1cccc(C)c1	ZINC000125597801	1293511602	/nfs/dbraw/zinc/51/16/02/1293511602.db2.gz	YPNNAYVKKAGZHT-WBVHZDCISA-N	0	3	330.428	3.168	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)COC2CCCCC2)cc1	ZINC000128542479	1293597618	/nfs/dbraw/zinc/59/76/18/1293597618.db2.gz	AETAPYLJRCQXAN-KRWDZBQOSA-N	0	3	328.412	3.246	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)CCCc1ccccc1	ZINC000129959542	1293639898	/nfs/dbraw/zinc/63/98/98/1293639898.db2.gz	ZNNDHUXJUIALBL-MRXNPFEDSA-N	0	3	336.391	3.365	20	30		EGEDHN
CCc1nc(C)c(C(=O)C(C#N)C(=O)Nc2cccc(C)c2)s1	ZINC000140308298	1293849849	/nfs/dbraw/zinc/84/98/49/1293849849.db2.gz	OPICFVJOVGVQEW-ZDUSSCGKSA-N	0	3	327.409	3.284	20	30		EGEDHN
CC[C@@H](CC(=O)C(C#N)C(=O)NC1CCCC1)c1ccc(OC)cc1	ZINC000152457385	1293969645	/nfs/dbraw/zinc/96/96/45/1293969645.db2.gz	OCPYJRHBLOZNBU-KBXCAEBGSA-N	0	3	342.439	3.347	20	30		EGEDHN
CCCCCCCN1CCN(Cc2nc3ccccc3c(=O)[nH]2)CC1	ZINC000157384506	1294176535	/nfs/dbraw/zinc/17/65/35/1294176535.db2.gz	ODFAGKLLDPOGEB-UHFFFAOYSA-N	0	3	342.487	3.011	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)c2cccc(OC(C)C)n2)c1	ZINC000167800554	1294367241	/nfs/dbraw/zinc/36/72/41/1294367241.db2.gz	LHXNBKCWSBEEPD-OAHLLOKOSA-N	0	3	337.379	3.138	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)[C@H]2CCCOC2)cc1	ZINC000171036284	1294391952	/nfs/dbraw/zinc/39/19/52/1294391952.db2.gz	NYDSFGYWNAFDNC-DOTOQJQBSA-N	0	3	328.412	3.103	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)COc1cccc2ccccc21	ZINC000193377191	1295857841	/nfs/dbraw/zinc/85/78/41/1295857841.db2.gz	YDHRQMOKRGGTCE-QGZVFWFLSA-N	0	3	338.407	3.234	20	30		EGEDHN
N#CCOc1ccccc1C(=O)NC[C@@H](c1ccccc1)N1CCCC1	ZINC000194055257	1295937682	/nfs/dbraw/zinc/93/76/82/1295937682.db2.gz	MWJSWVPIVXCNOO-IBGZPJMESA-N	0	3	349.434	3.156	20	30		EGEDHN
N#CC(C(=O)C=CSc1ccccc1)c1nnc2n1CCCCC2	ZINC000195287547	1296052955	/nfs/dbraw/zinc/05/29/55/1296052955.db2.gz	MEDRCCPUHAPZJZ-HBIYDYFMSA-N	0	3	338.436	3.487	20	30		EGEDHN
N#CC(C(=O)Nc1ccccn1)C(=O)[C@@H]1C[C@]12CCCc1ccccc12	ZINC000246461972	1296354711	/nfs/dbraw/zinc/35/47/11/1296354711.db2.gz	ADWBJJKHNAJVAJ-WJPUGNRLSA-N	0	3	345.402	3.023	20	30		EGEDHN
CCO[C@@H]1C[C@@H]1C(=O)C(C#N)C(=O)Nc1ccc([C@@H](C)CC)cc1	ZINC000249739241	1296451562	/nfs/dbraw/zinc/45/15/62/1296451562.db2.gz	XCYIDFPMOYQIIR-OSMBCOQSSA-N	0	3	328.412	3.272	20	30		EGEDHN
N#CC(C(=O)C=CSCc1ccco1)c1nnc2n1CCCCC2	ZINC000255139139	1296503403	/nfs/dbraw/zinc/50/34/03/1296503403.db2.gz	PIOBBMMCOVPJLS-JKEYDSJLSA-N	0	3	342.424	3.221	20	30		EGEDHN
C[C@H](CNC(=O)OC(C)(C)C)NC1CC(C#N)(c2ccccc2)C1	ZINC000302127135	1296799309	/nfs/dbraw/zinc/79/93/09/1296799309.db2.gz	XOQXOPQIFMTOGQ-ICXUMSERSA-N	0	3	329.444	3.113	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(F)c3ncccc3c2)CC1	ZINC000874436825	1297886634	/nfs/dbraw/zinc/88/66/34/1297886634.db2.gz	UQYPCROOPMEHKS-UHFFFAOYSA-N	0	3	327.403	3.144	20	30		EGEDHN
C[C@H]1CCN(Cc2ccccc2)C[C@@H]1NC(=O)c1cccc(C#N)c1	ZINC000716261099	1298295067	/nfs/dbraw/zinc/29/50/67/1298295067.db2.gz	DBXNQWJNWANRTQ-JXFKEZNVSA-N	0	3	333.435	3.199	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)C#Cc1ccccc1	ZINC000747401008	1298776982	/nfs/dbraw/zinc/77/69/82/1298776982.db2.gz	BLJTYRPIQDFDCU-LJQANCHMSA-N	0	3	332.447	3.161	20	30		EGEDHN
C=C(Cl)C[C@@H](N)C(=O)Nc1cc(Cl)ccc1OCCOCC	ZINC000876644903	1298894608	/nfs/dbraw/zinc/89/46/08/1298894608.db2.gz	GDSJIZRBZXREIJ-GFCCVEGCSA-N	0	3	347.242	3.164	20	30		EGEDHN
CC(=O)[C@](C#N)(CCN1CCC[C@@](CO)(C(C)C)C1)c1ccccc1	ZINC000878655263	1300129341	/nfs/dbraw/zinc/12/93/41/1300129341.db2.gz	KRAARICIJGKFSS-NHCUHLMSSA-N	0	3	342.483	3.158	20	30		EGEDHN
CSC1CCN(CC(=O)C(C#N)c2nc3ccccc3s2)CC1	ZINC000879098359	1300366576	/nfs/dbraw/zinc/36/65/76/1300366576.db2.gz	CAWNBJYMTPHGAM-CYBMUJFWSA-N	0	3	345.493	3.300	20	30		EGEDHN
C=CCCOCCNCc1ccc(N2CCCCC2)c([N+](=O)[O-])c1	ZINC000756989809	1300604762	/nfs/dbraw/zinc/60/47/62/1300604762.db2.gz	HOBLBIYVBRLWCO-UHFFFAOYSA-N	0	3	333.432	3.267	20	30		EGEDHN
C#CCCOc1ccc(CN[C@H]2CC(=O)N(C3CCCCC3)C2)cc1	ZINC000757923643	1300757759	/nfs/dbraw/zinc/75/77/59/1300757759.db2.gz	LXAYBSCSOQNRAO-SFHVURJKSA-N	0	3	340.467	3.112	20	30		EGEDHN
C#CCCCCNC(=O)[C@H](C)N1CCC(Cc2ccccc2)CC1	ZINC000758627191	1300925714	/nfs/dbraw/zinc/92/57/14/1300925714.db2.gz	LMVDXGLVUBPQMH-SFHVURJKSA-N	0	3	326.484	3.249	20	30		EGEDHN
C=CCCN(C(C)C)[C@@H](C)C(=O)Nc1c(C)csc1C(=O)OC	ZINC000880219725	1300987599	/nfs/dbraw/zinc/98/75/99/1300987599.db2.gz	OCXGVBVJUZKYIG-ZDUSSCGKSA-N	0	3	338.473	3.457	20	30		EGEDHN
CCN(CCC#N)C(=O)CNC(C)(C)c1ccc(C(F)(F)F)cc1	ZINC000880383643	1301094555	/nfs/dbraw/zinc/09/45/55/1301094555.db2.gz	HKUBVWGNVMVGIA-UHFFFAOYSA-N	0	3	341.377	3.292	20	30		EGEDHN
C=C(C)CN1CCC(N2C(=O)N[C@](C)(CCCCCC)C2=O)CC1	ZINC000761251495	1301428484	/nfs/dbraw/zinc/42/84/84/1301428484.db2.gz	GVARERUGCVHHQW-LJQANCHMSA-N	0	3	335.492	3.308	20	30		EGEDHN
C#CCCc1noc([C@@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)n1	ZINC000762013181	1301589917	/nfs/dbraw/zinc/58/99/17/1301589917.db2.gz	BOMMGRLDWCBKIG-QGZVFWFLSA-N	0	3	349.356	3.341	20	30		EGEDHN
N#CC(C(=O)Nc1ccccn1)C(=O)c1ccc(-c2ccco2)s1	ZINC000766279064	1302420712	/nfs/dbraw/zinc/42/07/12/1302420712.db2.gz	XRABRFBZDKWSDV-LLVKDONJSA-N	0	3	337.360	3.364	20	30		EGEDHN
C#CCN1CCC[C@H](N[C@H](c2cccnc2)c2ccc(F)c(C)c2)C1	ZINC000886663205	1303544106	/nfs/dbraw/zinc/54/41/06/1303544106.db2.gz	VVQACOVMXDXBFA-FPOVZHCZSA-N	0	3	337.442	3.306	20	30		EGEDHN
Cc1nc(C(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)sc1C	ZINC000774044294	1303767067	/nfs/dbraw/zinc/76/70/67/1303767067.db2.gz	SQUFNWLESYCFQT-GFCCVEGCSA-N	0	3	333.800	3.375	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)c2nc(C)c(C)s2)cc1	ZINC000774049542	1303768072	/nfs/dbraw/zinc/76/80/72/1303768072.db2.gz	BDIZDOPZTALNPS-CQSZACIVSA-N	0	3	327.409	3.284	20	30		EGEDHN
C[C@H](NCCNC(=O)CC1CCCCC1)c1ccc(C#N)c(F)c1	ZINC000776746266	1304192212	/nfs/dbraw/zinc/19/22/12/1304192212.db2.gz	MMYJKNFLQPEVBE-AWEZNQCLSA-N	0	3	331.435	3.435	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)Cc2ccccc2CC#N)CN1Cc1ccccc1	ZINC000777408997	1304291332	/nfs/dbraw/zinc/29/13/32/1304291332.db2.gz	FBBOQMHFJKRUOJ-DYESRHJHSA-N	0	3	347.462	3.074	20	30		EGEDHN
CCn1c(=O)c2ccccc2nc1N=NC(C)CN1CCCCCC1	ZINC000777429416	1304295269	/nfs/dbraw/zinc/29/52/69/1304295269.db2.gz	KENWYBBMEPUMCH-UHFFFAOYSA-N	0	3	341.459	3.080	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CNCCCCn1ccnc1C	ZINC000778173331	1304409962	/nfs/dbraw/zinc/40/99/62/1304409962.db2.gz	UEEKHHJVRQGJRH-UHFFFAOYSA-N	0	3	331.847	3.427	20	30		EGEDHN
N#Cc1ccc(CN2CCN(C[C@H]3CCc4ccccc43)CC2)cc1	ZINC000780287591	1304671766	/nfs/dbraw/zinc/67/17/66/1304671766.db2.gz	MVGSBINPLFYCGG-OAQYLSRUSA-N	0	3	331.463	3.406	20	30		EGEDHN
C#CCCCCCC(=O)Nc1ccc(CN2CCC(O)CC2)cc1	ZINC000780998223	1304758889	/nfs/dbraw/zinc/75/88/89/1304758889.db2.gz	ZEINLDVVKSMVDV-UHFFFAOYSA-N	0	3	328.456	3.166	20	30		EGEDHN
N#Cc1ccc(NC[C@H](c2ccco2)N2CCCCC2)c(CO)c1	ZINC000891484137	1305064139	/nfs/dbraw/zinc/06/41/39/1305064139.db2.gz	BZJPSPGRHOFEQS-GOSISDBHSA-N	0	3	325.412	3.283	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC000785408991	1305347428	/nfs/dbraw/zinc/34/74/28/1305347428.db2.gz	REIXHAGCPCIXNN-HXUWFJFHSA-N	0	3	330.472	3.378	20	30		EGEDHN
Cc1nc(CC(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)c(C)s1	ZINC000786302764	1305553762	/nfs/dbraw/zinc/55/37/62/1305553762.db2.gz	BDUMJTIBOAESRY-ZDUSSCGKSA-N	0	3	347.827	3.303	20	30		EGEDHN
N#CC(C(=O)NC1CCCC1)C(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1	ZINC000786324296	1305556195	/nfs/dbraw/zinc/55/61/95/1305556195.db2.gz	PWKMIPWLTYPGOL-IJLUTSLNSA-N	0	3	336.844	3.273	20	30		EGEDHN
CC(C)CN(CCC#N)C[C@H]1CN(Cc2ccccc2)CCCO1	ZINC000792868301	1309247608	/nfs/dbraw/zinc/24/76/08/1309247608.db2.gz	SWJJLKIHRRCRFN-FQEVSTJZSA-N	0	3	329.488	3.149	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN2CCN(C)[C@H](Cc3ccccc3)C2)cc1	ZINC000793621040	1309419121	/nfs/dbraw/zinc/41/91/21/1309419121.db2.gz	WYLTUEKVAOOPQP-GHTZIAJQSA-N	0	3	349.478	3.336	20	30		EGEDHN
Cc1ccc2c(c1)CC[C@@H](C(=O)C(C#N)C(=O)Nc1ccccc1)O2	ZINC000796633788	1310052285	/nfs/dbraw/zinc/05/22/85/1310052285.db2.gz	OYLQKVPFXHOBJJ-WMZOPIPTSA-N	0	3	334.375	3.036	20	30		EGEDHN
C[C@H](NC(=O)c1ccoc1)C(=O)C(C#N)c1ncc(C(C)(C)C)s1	ZINC000797570948	1310213339	/nfs/dbraw/zinc/21/33/39/1310213339.db2.gz	MDKMNPRHSBCXPD-JQWIXIFHSA-N	0	3	345.424	3.028	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)[C@H]2CCCC(F)(F)C2)c1	ZINC000800385092	1310747733	/nfs/dbraw/zinc/74/77/33/1310747733.db2.gz	RLIYIHXURMIGDV-SMDDNHRTSA-N	0	3	336.338	3.168	20	30		EGEDHN
CN1c2ccc(CNCc3ccc(C#N)c(Cl)c3)cc2CCC1=O	ZINC000800895338	1310829877	/nfs/dbraw/zinc/82/98/77/1310829877.db2.gz	CHCXPMVHUHELTP-UHFFFAOYSA-N	0	3	339.826	3.410	20	30		EGEDHN
CC(C)(CC#N)CNCc1c[nH]c(C(=O)OCc2ccccc2)c1	ZINC000839163805	1320882764	/nfs/dbraw/zinc/88/27/64/1320882764.db2.gz	QOZKUTQRZJRLIP-UHFFFAOYSA-N	0	3	325.412	3.401	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)CCc3ccsc3)C2)s1	ZINC001018968879	1316989028	/nfs/dbraw/zinc/98/90/28/1316989028.db2.gz	AQXUYUVGHHZDGS-AWEZNQCLSA-N	0	3	345.493	3.005	20	30		EGEDHN
COc1ccc(C(NCCO[C@H](C)C#N)c2ccc(OC)cc2)cc1	ZINC000802741679	1317034395	/nfs/dbraw/zinc/03/43/95/1317034395.db2.gz	RLQZVYWFBZNTBO-OAHLLOKOSA-N	0	3	340.423	3.311	20	30		EGEDHN
CC1(C)CC(CC(=O)N2CC[C@H](NCc3ccc(C#N)c(F)c3)C2)C1	ZINC001019278883	1317142650	/nfs/dbraw/zinc/14/26/50/1317142650.db2.gz	YRUVJUMODUSNOJ-KRWDZBQOSA-N	0	3	343.446	3.214	20	30		EGEDHN
CCN1CCN(c2ccc(NC(=O)CCCCCC#N)cc2)CC1	ZINC000805159252	1317321400	/nfs/dbraw/zinc/32/14/00/1317321400.db2.gz	CODDGZHVXABHDX-UHFFFAOYSA-N	0	3	328.460	3.241	20	30		EGEDHN
CCc1ccc(C(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)cc1	ZINC001019728381	1317376205	/nfs/dbraw/zinc/37/62/05/1317376205.db2.gz	GQWOCDLRECYUKT-INIZCTEOSA-N	0	3	339.464	3.186	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)c(C)c1	ZINC001019729390	1317377513	/nfs/dbraw/zinc/37/75/13/1317377513.db2.gz	NZAOZBBEOPOVHO-HNNXBMFYSA-N	0	3	339.464	3.241	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)[C@H]2CCC(C)=C(C)C2)C1	ZINC001020189467	1317584634	/nfs/dbraw/zinc/58/46/34/1317584634.db2.gz	ZSBCOSYQTQQORN-KKUMJFAQSA-N	0	3	341.293	3.268	20	30		EGEDHN
CC[C@@H](NCc1cccc(NC(=O)COC)c1)c1cccc(C#N)c1	ZINC000902733487	1317610616	/nfs/dbraw/zinc/61/06/16/1317610616.db2.gz	OHFXKUHKBWVXAX-LJQANCHMSA-N	0	3	337.423	3.384	20	30		EGEDHN
C[C@@H](O)c1ncc(CNCCSCc2ccccc2C#N)s1	ZINC000809603459	1317841185	/nfs/dbraw/zinc/84/11/85/1317841185.db2.gz	POAQIRRJKVNNPO-GFCCVEGCSA-N	0	3	333.482	3.091	20	30		EGEDHN
CN(C)CC[N@H+](Cc1ccc(C#N)cc1)Cc1cccc(Cl)c1[O-]	ZINC000809731102	1317882276	/nfs/dbraw/zinc/88/22/76/1317882276.db2.gz	BRJIHMUYANUOMW-UHFFFAOYSA-N	0	3	343.858	3.481	20	30		EGEDHN
CN(C)CC[N@@H+](Cc1ccc(C#N)cc1)Cc1cccc(Cl)c1[O-]	ZINC000809731102	1317882282	/nfs/dbraw/zinc/88/22/82/1317882282.db2.gz	BRJIHMUYANUOMW-UHFFFAOYSA-N	0	3	343.858	3.481	20	30		EGEDHN
CCOc1c(Cl)cc(/C=C2\C(=O)c3ncnn3C2C)cc1OC	ZINC000905079318	1317920573	/nfs/dbraw/zinc/92/05/73/1317920573.db2.gz	ATDBDKDGUUZLMM-BVBCSLMJSA-N	0	3	333.775	3.180	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@H](N[C@H]1CCCN(Cc3ccccc3)C1=O)CC2	ZINC000810229022	1317981351	/nfs/dbraw/zinc/98/13/51/1317981351.db2.gz	QCUGDZGZNNBGFB-RTWAWAEBSA-N	0	3	345.446	3.326	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H]2CCCCc3ccccc32)C1	ZINC001021103120	1318084951	/nfs/dbraw/zinc/08/49/51/1318084951.db2.gz	QGQKZHHIPLVFRB-JFIYKMOQSA-N	0	3	332.875	3.486	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCCC[C@H]1CNCc1sccc1Cl	ZINC000959924383	1318267838	/nfs/dbraw/zinc/26/78/38/1318267838.db2.gz	KCZRRODHMJWOMD-RYUDHWBXSA-N	0	3	325.865	3.032	20	30		EGEDHN
CCCCN(CCCCC1(C#N)CCC1)[C@@H]1CCS(=O)(=O)C1	ZINC000929969487	1328753114	/nfs/dbraw/zinc/75/31/14/1328753114.db2.gz	BFMFIYPLNSKTIQ-MRXNPFEDSA-N	0	3	326.506	3.140	20	30		EGEDHN
C=CC(C)(C)CC(=O)N(C[C@H](O)CC(C)(C)C)C1CCN(C)CC1	ZINC000907994246	1318289031	/nfs/dbraw/zinc/28/90/31/1318289031.db2.gz	VLZKVFZXZOTSBT-QGZVFWFLSA-N	0	3	338.536	3.309	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@H](CCCN3C(=O)CC3CC3)C2)c1	ZINC001021497629	1318303577	/nfs/dbraw/zinc/30/35/77/1318303577.db2.gz	ZIKMQBDLFSKUPO-UXHICEINSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C[C@H]2CCC[C@H](C)C2)OC)CC1	ZINC000812032959	1318313632	/nfs/dbraw/zinc/31/36/32/1318313632.db2.gz	VGUNKANRDWZQIH-IRXDYDNUSA-N	0	3	337.508	3.426	20	30		EGEDHN
CC(F)(F)C(=O)N1CCC[C@H]2CN(Cc3ccc(C#N)cc3)CC[C@@H]21	ZINC001021502688	1318314804	/nfs/dbraw/zinc/31/48/04/1318314804.db2.gz	OOBUYNUBEDFKIS-IRXDYDNUSA-N	0	3	347.409	3.026	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@@H]2CN(Cc3cccc(C#N)c3)CC[C@@H]21	ZINC001021505291	1318320310	/nfs/dbraw/zinc/32/03/10/1318320310.db2.gz	JSFDTUMBMBSHDM-UXHICEINSA-N	0	3	339.483	3.417	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@@H](CCCN3C(=O)C=C3CCC3)C2)c1	ZINC001021559527	1318408914	/nfs/dbraw/zinc/40/89/14/1318408914.db2.gz	SBYLRRUCBGWSRP-SFTDATJTSA-N	0	3	349.478	3.481	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)C[C@H]1CCCC1(F)F	ZINC000960300852	1318450647	/nfs/dbraw/zinc/45/06/47/1318450647.db2.gz	TVAURKFMOOLFQL-QGPMSJSTSA-N	0	3	334.410	3.370	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)Cc1cc(C)cc(C)c1	ZINC000960303983	1318452123	/nfs/dbraw/zinc/45/21/23/1318452123.db2.gz	UENBHTKJRNXYDH-IFMALSPDSA-N	0	3	334.463	3.404	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cccc2c1OCC2	ZINC000960307854	1318453009	/nfs/dbraw/zinc/45/30/09/1318453009.db2.gz	QUKNRZQHWYZCRI-WOJBJXKFSA-N	0	3	348.446	3.183	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc2c(c1)C[C@H](C)O2	ZINC000960313229	1318455649	/nfs/dbraw/zinc/45/56/49/1318455649.db2.gz	KHERQMIUSJKUFL-UQIDSAAFSA-N	0	3	348.446	3.181	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2oc(C(F)F)cc2C)C1	ZINC001021609220	1318457015	/nfs/dbraw/zinc/45/70/15/1318457015.db2.gz	XBMWJHPDKDLIMO-UONOGXRCSA-N	0	3	336.382	3.085	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)Cc2ccc(C(F)F)cc2)C1	ZINC001021628282	1318479947	/nfs/dbraw/zinc/47/99/47/1318479947.db2.gz	AGCZXEMFUYIQPB-ROUUACIJSA-N	0	3	346.421	3.113	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(Cl)cc2F)C1	ZINC001021627628	1318480412	/nfs/dbraw/zinc/48/04/12/1318480412.db2.gz	OMCRZGBQQMKGCR-DYVFJYSZSA-N	0	3	334.822	3.039	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc3ccsc3[nH]2)C1	ZINC001021643952	1318502011	/nfs/dbraw/zinc/50/20/11/1318502011.db2.gz	DSLKDUZIOCTUDL-RDJZCZTQSA-N	0	3	341.480	3.179	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc3ccsc3[nH]2)C1	ZINC001021643950	1318502829	/nfs/dbraw/zinc/50/28/29/1318502829.db2.gz	DSLKDUZIOCTUDL-NVXWUHKLSA-N	0	3	341.480	3.179	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccn(C(C)C)c2C)C1	ZINC001021656267	1318519171	/nfs/dbraw/zinc/51/91/71/1318519171.db2.gz	SQKFARHNNYLPNB-UYAOXDASSA-N	0	3	341.499	3.327	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cccc(Cl)c2F)C1	ZINC001021667036	1318529193	/nfs/dbraw/zinc/52/91/93/1318529193.db2.gz	YMGQJUFDAQJQPM-XJKSGUPXSA-N	0	3	334.822	3.039	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(C)cc2F)C1	ZINC001021676663	1318544321	/nfs/dbraw/zinc/54/43/21/1318544321.db2.gz	MBFXHOLBOWGDHR-LPHOPBHVSA-N	0	3	328.431	3.084	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc3cc(F)ccc3o2)C1	ZINC001021682400	1318554866	/nfs/dbraw/zinc/55/48/66/1318554866.db2.gz	QMCXZYDQDPXYGQ-YOEHRIQHSA-N	0	3	340.398	3.132	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cccn2C2CCCC2)C1	ZINC001021691422	1318566225	/nfs/dbraw/zinc/56/62/25/1318566225.db2.gz	AOCAPBXUUWPRBU-MJGOQNOKSA-N	0	3	339.483	3.163	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(Cl)ccc2C)C1	ZINC001021694587	1318568412	/nfs/dbraw/zinc/56/84/12/1318568412.db2.gz	XICVBPNPMDHOKA-CRAIPNDOSA-N	0	3	330.859	3.208	20	30		EGEDHN
C/C(=C/C(=O)N1CCC[C@H]1CN(C)Cc1ccc(C#N)cc1)C1CC1	ZINC000960465425	1318582760	/nfs/dbraw/zinc/58/27/60/1318582760.db2.gz	LXKHOWDKDAKIMW-WNJRYGEDSA-N	0	3	337.467	3.337	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(C)c(F)cc2Cl)C1	ZINC001021715932	1318595902	/nfs/dbraw/zinc/59/59/02/1318595902.db2.gz	BDGKXFFDHXTJOW-KBXCAEBGSA-N	0	3	348.849	3.347	20	30		EGEDHN
COc1ccc2c(c1)nccc2N1CC[C@@H](Oc2ccc(C#N)cn2)C1	ZINC000813615035	1318606642	/nfs/dbraw/zinc/60/66/42/1318606642.db2.gz	SEZKRXCQPDIZJW-MRXNPFEDSA-N	0	3	346.390	3.168	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@@H]1CN(C)Cc1cccc(C#N)c1)C1CC1	ZINC000960522350	1318633292	/nfs/dbraw/zinc/63/32/92/1318633292.db2.gz	VPYKXNMHCODKQY-DNVCBOLYSA-N	0	3	325.456	3.027	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2c[nH]c3ccc(C)cc32)C1	ZINC001021740975	1318650098	/nfs/dbraw/zinc/65/00/98/1318650098.db2.gz	XTNIJJBWOFPWFQ-OXQOHEQNSA-N	0	3	335.451	3.036	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2c[nH]c3ccc(C)cc32)C1	ZINC001021740972	1318650787	/nfs/dbraw/zinc/65/07/87/1318650787.db2.gz	XTNIJJBWOFPWFQ-OXJNMPFZSA-N	0	3	335.451	3.036	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)N1CCC[C@H](c2nc(C)no2)C1	ZINC000911643657	1318755410	/nfs/dbraw/zinc/75/54/10/1318755410.db2.gz	VHHAZGUKBJKSEH-HOTGVXAUSA-N	0	3	336.480	3.162	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1C[C@@H](NCc2cccc(F)c2F)C1	ZINC001022203273	1318841185	/nfs/dbraw/zinc/84/11/85/1318841185.db2.gz	XNVNHLREIJJOBI-GASCZTMLSA-N	0	3	345.393	3.003	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)NC1(c2noc(C)n2)CCCC1	ZINC000912201850	1318848199	/nfs/dbraw/zinc/84/81/99/1318848199.db2.gz	XLLBKJKHNVXPKZ-HNNXBMFYSA-N	0	3	336.480	3.341	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)Nc1ccc(C(N)=O)c(Cl)c1	ZINC000912300922	1318864429	/nfs/dbraw/zinc/86/44/29/1318864429.db2.gz	LUXNFBCAAUZJLO-OAHLLOKOSA-N	0	3	339.867	3.455	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)C2(C3CCC3)CCC2)C1	ZINC001022505193	1318969820	/nfs/dbraw/zinc/96/98/20/1318969820.db2.gz	BAOUTGXTJIRDIQ-OKILXGFUSA-N	0	3	341.293	3.102	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@@H](NC(=O)C[C@@H]3CC=CCC3)C2)c(F)c1	ZINC001022550137	1318983849	/nfs/dbraw/zinc/98/38/49/1318983849.db2.gz	VBWKZACKECCXSD-OLMNPRSZSA-N	0	3	341.430	3.181	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@@H](NCc3oc(CCC)nc3C)C2)C1	ZINC001022675571	1319061643	/nfs/dbraw/zinc/06/16/43/1319061643.db2.gz	ZDFVXJOLPXRENK-GASCZTMLSA-N	0	3	331.460	3.029	20	30		EGEDHN
Cc1cc(C#N)cnc1C(=O)OC[C@@]1(C)CCCN1Cc1ccccc1	ZINC000815967353	1319081162	/nfs/dbraw/zinc/08/11/62/1319081162.db2.gz	YTBLCERHQOCHDC-OAQYLSRUSA-N	0	3	349.434	3.473	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N[C@H]1C[C@@H](N[C@H](C)c2ccccc2Cl)C1	ZINC001022738317	1319083965	/nfs/dbraw/zinc/08/39/65/1319083965.db2.gz	ZFDLQMFQUQOBTE-CNKGYHKASA-N	0	3	348.874	3.229	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2c(F)ccc(F)c2Cl)C1	ZINC001022759312	1319092764	/nfs/dbraw/zinc/09/27/64/1319092764.db2.gz	KJZSNCWMBHYBBM-DTORHVGOSA-N	0	3	335.181	3.221	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1CCC[C@H]1CN(C)Cc1ccccc1	ZINC000960991430	1319123492	/nfs/dbraw/zinc/12/34/92/1319123492.db2.gz	KTSHMJCUHQDHPU-QFIPXVFZSA-N	0	3	346.474	3.333	20	30		EGEDHN
CN(Cc1ccc(OCC#N)cc1)C[C@H]1CCCN1C(=O)C(C)(C)C	ZINC000960994046	1319123903	/nfs/dbraw/zinc/12/39/03/1319123903.db2.gz	PYQULDFHQDERBT-QGZVFWFLSA-N	0	3	343.471	3.058	20	30		EGEDHN
C#CCOc1ccccc1CN1CCC(CO)(c2ccccc2)CC1	ZINC000816624966	1319196655	/nfs/dbraw/zinc/19/66/55/1319196655.db2.gz	MYYISOZBCPKSGV-UHFFFAOYSA-N	0	3	335.447	3.225	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@H]2CCCN(Cc3ccc(C#N)cc3)C2)o1	ZINC001023217453	1319352908	/nfs/dbraw/zinc/35/29/08/1319352908.db2.gz	GTKPGZSBHGBXRE-GOSISDBHSA-N	0	3	337.423	3.102	20	30		EGEDHN
N#Cc1ccc(C(=O)NC[C@H]2CCCN(C/C=C/c3ccccc3)C2)[nH]1	ZINC001023318395	1319444138	/nfs/dbraw/zinc/44/41/38/1319444138.db2.gz	IFXNRUKDGABRRR-SBLNNXNXSA-N	0	3	348.450	3.042	20	30		EGEDHN
CC[C@@H](C#N)Oc1cc(CN[C@H](C)c2cnccc2N)ccc1OC	ZINC000817917036	1319460658	/nfs/dbraw/zinc/46/06/58/1319460658.db2.gz	DKUCBAGDRHHCOZ-HIFRSBDPSA-N	0	3	340.427	3.035	20	30		EGEDHN
CC(=O)N1CCC([C@H]2CCCN(Cc3ccc(F)c(C#N)c3)C2)CC1	ZINC000961299192	1319461227	/nfs/dbraw/zinc/46/12/27/1319461227.db2.gz	OKOWOZMTOIMFIU-SFHVURJKSA-N	0	3	343.446	3.168	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cccc3c2CCCCC3)C1	ZINC001023434971	1319531389	/nfs/dbraw/zinc/53/13/89/1319531389.db2.gz	XAFZNLVZZFFZOY-GOSISDBHSA-N	0	3	338.495	3.421	20	30		EGEDHN
CC[NH+](CC)Cc1cc(C(C)N=Nc2cc(C)nc(C)n2)ccc1[O-]	ZINC000915968321	1319573568	/nfs/dbraw/zinc/57/35/68/1319573568.db2.gz	SUJGIGYUHHBWLS-UHFFFAOYSA-N	0	3	341.459	3.477	20	30		EGEDHN
CC(C)[C@@H](NC[C@H](O)c1ccc(C#N)cc1)c1nc2ccccc2[nH]1	ZINC000818947682	1319586542	/nfs/dbraw/zinc/58/65/42/1319586542.db2.gz	QOLKNCZOZZIPTG-RBUKOAKNSA-N	0	3	334.423	3.455	20	30		EGEDHN
Cc1nn(-c2ccccc2)c(N2CCCC2)c1C=NNCC(C)C	ZINC000916366132	1319646134	/nfs/dbraw/zinc/64/61/34/1319646134.db2.gz	PUQRORXTBOWHPX-UHFFFAOYSA-N	0	3	325.460	3.360	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc(F)c(Cl)cc2F)C1	ZINC001023563114	1319675701	/nfs/dbraw/zinc/67/57/01/1319675701.db2.gz	SYSGLFCJWYBUOZ-GFCCVEGCSA-N	0	3	340.801	3.083	20	30		EGEDHN
CC1(C)C(C(=O)NC2CC(CNCc3ccccc3C#N)C2)C1(C)C	ZINC000961676188	1319690580	/nfs/dbraw/zinc/69/05/80/1319690580.db2.gz	DPPIWSHNJFBTRE-UHFFFAOYSA-N	0	3	339.483	3.225	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1Cl)C(=O)c1ccc([N+](=O)[O-])cc1	ZINC000916905284	1319723792	/nfs/dbraw/zinc/72/37/92/1319723792.db2.gz	KBYSMCJYJDDEHW-LBPRGKRZSA-N	0	3	343.726	3.209	20	30		EGEDHN
CCCc1cc(C(=O)C(C#N)C(=O)Nc2ccc(F)c(Cl)c2)n[nH]1	ZINC000916939540	1319726442	/nfs/dbraw/zinc/72/64/42/1319726442.db2.gz	PLELBFLHFFCGKG-LLVKDONJSA-N	0	3	348.765	3.116	20	30		EGEDHN
C#CCN1CCC[C@@H](CNC(=O)[C@@H]2C[C@H]2c2ccc3ccccc3c2)C1	ZINC001023655560	1319775643	/nfs/dbraw/zinc/77/56/43/1319775643.db2.gz	KKLMEZBALOSLGN-BULFRSBZSA-N	0	3	346.474	3.405	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc(O[C@@H](C)CC)cc2)C1	ZINC001023691468	1319810238	/nfs/dbraw/zinc/81/02/38/1319810238.db2.gz	KPCQCGZLJNYCTG-ROUUACIJSA-N	0	3	342.483	3.329	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc(Cl)cc(Cl)c2)C1	ZINC001023719591	1319855244	/nfs/dbraw/zinc/85/52/44/1319855244.db2.gz	CVGUGVGHGBAKPZ-CYBMUJFWSA-N	0	3	339.266	3.459	20	30		EGEDHN
CC(C)(C(=O)NC1CC(CNCc2cc(C#N)ccc2F)C1)C1CC1	ZINC000962206649	1319859944	/nfs/dbraw/zinc/85/99/44/1319859944.db2.gz	DWJOXSYJLAOCEJ-UHFFFAOYSA-N	0	3	343.446	3.118	20	30		EGEDHN
C#CCN1CCC[C@H](CNC(=O)c2cc3cc(F)ccc3s2)C1	ZINC001023741592	1319887841	/nfs/dbraw/zinc/88/78/41/1319887841.db2.gz	YCLWRWOEZVLIRF-CYBMUJFWSA-N	0	3	330.428	3.115	20	30		EGEDHN
N#Cc1ccccc1CNCC1CC(NC(=O)[C@]23C[C@H]2CCCC3)C1	ZINC000962283549	1319900834	/nfs/dbraw/zinc/90/08/34/1319900834.db2.gz	UICYWZYASOECAY-CXAGJLLJSA-N	0	3	337.467	3.123	20	30		EGEDHN
C=CCN1CCC[C@@H](CNC(=O)c2coc(C3CCCCC3)n2)C1	ZINC001023770056	1319920184	/nfs/dbraw/zinc/92/01/84/1319920184.db2.gz	OJPUZVMQINDVES-HNNXBMFYSA-N	0	3	331.460	3.350	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc(C(F)(F)F)s2)C1	ZINC001023773258	1319924831	/nfs/dbraw/zinc/92/48/31/1319924831.db2.gz	PMVCXSDJLMNBCJ-GFCCVEGCSA-N	0	3	344.402	3.232	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCN(C(=O)/C=C\c2ccco2)C1	ZINC001023811759	1319955424	/nfs/dbraw/zinc/95/54/24/1319955424.db2.gz	RWNIPBJWONSPME-DOOKAGJSSA-N	0	3	349.434	3.193	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCN(C(=O)/C=C/c2ccco2)C1	ZINC001023811760	1319955488	/nfs/dbraw/zinc/95/54/88/1319955488.db2.gz	RWNIPBJWONSPME-FVNWOWOISA-N	0	3	349.434	3.193	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCN(C(=O)C[C@@H]2C=CCC2)C1	ZINC001023831492	1319975349	/nfs/dbraw/zinc/97/53/49/1319975349.db2.gz	MWXPJIIHANPXFH-QZTJIDSGSA-N	0	3	337.467	3.243	20	30		EGEDHN
C#CCCOc1ccc(CN2CCC(OCCOC(C)C)CC2)cc1	ZINC000825207155	1320318071	/nfs/dbraw/zinc/31/80/71/1320318071.db2.gz	FQKNQCGCJZJIFF-UHFFFAOYSA-N	0	3	345.483	3.495	20	30		EGEDHN
C#Cc1cnc(NC[C@H](c2cccs2)N2CCC(C)CC2)nc1	ZINC000827298014	1320441978	/nfs/dbraw/zinc/44/19/78/1320441978.db2.gz	FXODVZMUXUCISW-MRXNPFEDSA-N	0	3	326.469	3.405	20	30		EGEDHN
C#Cc1cnc(NCC2CCN(Cc3ccccc3Cl)CC2)nc1	ZINC000827588470	1320460586	/nfs/dbraw/zinc/46/05/86/1320460586.db2.gz	HQFUQKCSSLYAHY-UHFFFAOYSA-N	0	3	340.858	3.435	20	30		EGEDHN
C[C@@H](N[C@H]1CCc2ccccc2NC1=O)c1ccc(OCC#N)cc1	ZINC000839539407	1320934865	/nfs/dbraw/zinc/93/48/65/1320934865.db2.gz	MRKCHWRYVWTBCV-KUHUBIRLSA-N	0	3	335.407	3.193	20	30		EGEDHN
CCCCCCCOc1cccc(CN2CC[C@@H](O)[C@H](CO)C2)c1	ZINC000840975299	1321192293	/nfs/dbraw/zinc/19/22/93/1321192293.db2.gz	MZQQZRWAQWYPIM-AZUAARDMSA-N	0	3	335.488	3.211	20	30		EGEDHN
N#CC(C(=O)[C@@H]1CCc2ncncc2C1)c1ccc2ccccc2n1	ZINC000842677417	1321416445	/nfs/dbraw/zinc/41/64/45/1321416445.db2.gz	OYONUVXYFYAZEA-GDBMZVCRSA-N	0	3	328.375	3.006	20	30		EGEDHN
CC[N@H+](CCC/N=C\c1c([O-])c(C)ncc1CO)C1CCCCC1	ZINC000844272101	1321583756	/nfs/dbraw/zinc/58/37/56/1321583756.db2.gz	UNQJCIBTVRKVND-MOSHPQCFSA-N	0	3	333.476	3.052	20	30		EGEDHN
CC[N@@H+](CCC/N=C\c1c([O-])c(C)ncc1CO)C1CCCCC1	ZINC000844272101	1321583760	/nfs/dbraw/zinc/58/37/60/1321583760.db2.gz	UNQJCIBTVRKVND-MOSHPQCFSA-N	0	3	333.476	3.052	20	30		EGEDHN
Cc1ncccc1C(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847749475	1321900268	/nfs/dbraw/zinc/90/02/68/1321900268.db2.gz	QVVJYOHVXUAMMD-UHFFFAOYSA-N	0	3	349.434	3.353	20	30		EGEDHN
CC[C@@H](C)OCC(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847749601	1321900473	/nfs/dbraw/zinc/90/04/73/1321900473.db2.gz	WDRCKLNUXWNCHY-QGZVFWFLSA-N	0	3	344.455	3.151	20	30		EGEDHN
CCO[C@H](CC)C(=O)C(C#N)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000920111026	1322137944	/nfs/dbraw/zinc/13/79/44/1322137944.db2.gz	IERGFFCDGKGMOR-CHWSQXEVSA-N	0	3	343.210	3.456	20	30		EGEDHN
CCC[C@@H](CCO)CNCc1cc(C#N)ccc1Br	ZINC000921804088	1322400666	/nfs/dbraw/zinc/40/06/66/1322400666.db2.gz	LQOQMHYNBOMENT-LBPRGKRZSA-N	0	3	325.250	3.209	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCN(C(=O)CCC2CCC2)C1	ZINC001023919922	1323026266	/nfs/dbraw/zinc/02/62/66/1323026266.db2.gz	AWQLDLFGURTTPZ-GOSISDBHSA-N	0	3	339.483	3.467	20	30		EGEDHN
Cc1cc(C(=O)N2CCC[C@@H](CNCc3ccccc3C#N)C2)co1	ZINC001023953796	1323050009	/nfs/dbraw/zinc/05/00/09/1323050009.db2.gz	QLRBJHAESAJHMM-INIZCTEOSA-N	0	3	337.423	3.102	20	30		EGEDHN
CC(C)(C(=O)N1CCC[C@@H](CNCc2ccccc2C#N)C1)C1CC1	ZINC001024111048	1323142427	/nfs/dbraw/zinc/14/24/27/1323142427.db2.gz	FGXGINOOYCDFKH-INIZCTEOSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@@H](CN[C@H](C)c3cnccn3)C2)CC1	ZINC001024133798	1323157408	/nfs/dbraw/zinc/15/74/08/1323157408.db2.gz	OQMNTGAHJGLZTB-SJORKVTESA-N	0	3	342.487	3.112	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@@H](CNCc3ocnc3C)C2)CC1	ZINC001024133215	1323157517	/nfs/dbraw/zinc/15/75/17/1323157517.db2.gz	JONSVPWOLHLUDT-INIZCTEOSA-N	0	3	331.460	3.058	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H](CNCc2csc(C)n2)C1	ZINC001024138051	1323162903	/nfs/dbraw/zinc/16/29/03/1323162903.db2.gz	YTNGGBUJXRCGRU-YJBOKZPZSA-N	0	3	335.517	3.382	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN2CCC3(CCc4ccccc4O3)CC2)cc1	ZINC000852674556	1323224577	/nfs/dbraw/zinc/22/45/77/1323224577.db2.gz	HWDMGTHFYVMIQI-HXUWFJFHSA-N	0	3	348.446	3.451	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)c2cscn2)C1	ZINC000963262062	1323277129	/nfs/dbraw/zinc/27/71/29/1323277129.db2.gz	DGIQLOJFAVEBQG-ZFWWWQNUSA-N	0	3	339.892	3.212	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cccc2scnc21	ZINC001024438447	1323400421	/nfs/dbraw/zinc/40/04/21/1323400421.db2.gz	OVZBEPOGSBFKBA-CQSZACIVSA-N	0	3	329.469	3.457	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@H]1CCc2ccc(OC)cc21	ZINC001024484284	1323438744	/nfs/dbraw/zinc/43/87/44/1323438744.db2.gz	PCCKJWDOZQSOCN-MJGOQNOKSA-N	0	3	342.483	3.272	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@H]2CCCCN2CC(=C)C)cc1	ZINC001024512140	1323462202	/nfs/dbraw/zinc/46/22/02/1323462202.db2.gz	SHOIZLMRKNCFPA-GOSISDBHSA-N	0	3	328.456	3.412	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cc(C)n([C@H](C)CC)n1	ZINC001024517679	1323467590	/nfs/dbraw/zinc/46/75/90/1323467590.db2.gz	CQTGQCKZOUUNJD-NVXWUHKLSA-N	0	3	332.492	3.323	20	30		EGEDHN
C=CCN1CCCC[C@@H]1CNC(=O)c1ccc(F)c2ccncc12	ZINC001024618612	1323547316	/nfs/dbraw/zinc/54/73/16/1323547316.db2.gz	WPGNQNRAOBQOEN-CQSZACIVSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@H]1CCOc2ccccc21	ZINC001024712378	1323618539	/nfs/dbraw/zinc/61/85/39/1323618539.db2.gz	WINMZLVIQZARNS-AEFFLSMTSA-N	0	3	328.456	3.100	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccc(-c2c[nH]cn2)cc1	ZINC001024743743	1323642718	/nfs/dbraw/zinc/64/27/18/1323642718.db2.gz	RRTDHVKLNYFNRF-GOSISDBHSA-N	0	3	338.455	3.237	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCCCN2Cc2cccc(C)c2)cn1	ZINC001024770603	1323669822	/nfs/dbraw/zinc/66/98/22/1323669822.db2.gz	VLQKYGMDZANMDN-OAQYLSRUSA-N	0	3	347.462	3.156	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cc(OC)c(OC)cc1C	ZINC001024808927	1323711530	/nfs/dbraw/zinc/71/15/30/1323711530.db2.gz	MIIRSQHRSCHMOH-INIZCTEOSA-N	0	3	346.471	3.173	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)C12CC(C(F)(F)F)(C1)C2	ZINC001024813923	1323715566	/nfs/dbraw/zinc/71/55/66/1323715566.db2.gz	JNEMMZUOWZMXMD-JEYLPNPQSA-N	0	3	330.394	3.266	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)C1CC(c2ccc(F)cc2)C1	ZINC001024825274	1323730608	/nfs/dbraw/zinc/73/06/08/1323730608.db2.gz	YSCHFJLPTTXTFX-QLOJAFMTSA-N	0	3	342.458	3.313	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)CCC2CC2)cc1F	ZINC001024906843	1323774831	/nfs/dbraw/zinc/77/48/31/1323774831.db2.gz	XULKMVAGQIETCJ-GOSISDBHSA-N	0	3	343.446	3.358	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)c(F)c1	ZINC001024919010	1323782919	/nfs/dbraw/zinc/78/29/19/1323782919.db2.gz	RLESKFTYEXPESK-UEHGYGDOSA-N	0	3	329.419	3.134	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)C2(C3CC3)CC2)s1	ZINC001024993716	1323815746	/nfs/dbraw/zinc/81/57/46/1323815746.db2.gz	KBHLRLRXXADQAP-HNNXBMFYSA-N	0	3	343.496	3.281	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@@H]1CNCc1cnc(Cl)s1	ZINC001025040814	1323843092	/nfs/dbraw/zinc/84/30/92/1323843092.db2.gz	MPAIWXVEBWTPBP-GFCCVEGCSA-N	0	3	341.908	3.479	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001025105336	1323897813	/nfs/dbraw/zinc/89/78/13/1323897813.db2.gz	UJDKQDPRZGLZST-MAUKXSAKSA-N	0	3	345.462	3.460	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cccc(C)c1F	ZINC001025234263	1324022267	/nfs/dbraw/zinc/02/22/67/1324022267.db2.gz	GNNSMVPBGXOUOA-MSOLQXFVSA-N	0	3	328.431	3.226	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1[nH]ccc1C1CC1	ZINC001025234830	1324022860	/nfs/dbraw/zinc/02/28/60/1324022860.db2.gz	LCKWSDDGQZCNLE-OALUTQOASA-N	0	3	339.483	3.375	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1[nH]ccc1C1CC1	ZINC001025234829	1324023082	/nfs/dbraw/zinc/02/30/82/1324023082.db2.gz	LCKWSDDGQZCNLE-MOPGFXCFSA-N	0	3	339.483	3.375	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)Cc1cccc(CC)c1	ZINC001025243388	1324039260	/nfs/dbraw/zinc/03/92/60/1324039260.db2.gz	NXLNCGDLHNXIHB-NHCUHLMSSA-N	0	3	338.495	3.270	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(OCC)no1	ZINC001025252414	1324057268	/nfs/dbraw/zinc/05/72/68/1324057268.db2.gz	OMOYFTOZLKUZTK-HZPDHXFCSA-N	0	3	347.459	3.109	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(C2CC2)on1	ZINC001025254366	1324060833	/nfs/dbraw/zinc/06/08/33/1324060833.db2.gz	IFJRZMJVCZUMBE-MSOLQXFVSA-N	0	3	341.455	3.034	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(OC)cs1	ZINC001025258407	1324065769	/nfs/dbraw/zinc/06/57/69/1324065769.db2.gz	JWWIDASLVLMWKS-CVEARBPZSA-N	0	3	334.485	3.402	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc[nH]c1C1CC1	ZINC001025259134	1324069475	/nfs/dbraw/zinc/06/94/75/1324069475.db2.gz	LPNGTAYPESYBGI-RBUKOAKNSA-N	0	3	339.483	3.375	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc(OC)cc1C	ZINC001025263962	1324074593	/nfs/dbraw/zinc/07/45/93/1324074593.db2.gz	STUAJXBHIYCHHK-PMACEKPBSA-N	0	3	340.467	3.096	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)Cc1cc(C)ccc1C	ZINC001025264085	1324076590	/nfs/dbraw/zinc/07/65/90/1324076590.db2.gz	VTPIPMXBJKMTTI-SFTDATJTSA-N	0	3	338.495	3.325	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)C1CCC(F)(F)CC1	ZINC001025273527	1324088437	/nfs/dbraw/zinc/08/84/37/1324088437.db2.gz	PVTOERAQFLIGRE-DLBZAZTESA-N	0	3	338.442	3.291	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(C2CC2)no1	ZINC001025275167	1324094653	/nfs/dbraw/zinc/09/46/53/1324094653.db2.gz	TWYFRXNPDYTDRS-IAGOWNOFSA-N	0	3	329.444	3.197	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc2sccc2[nH]1	ZINC001025283980	1324105445	/nfs/dbraw/zinc/10/54/45/1324105445.db2.gz	DAPCDWOZFNZFPT-IAGOWNOFSA-N	0	3	341.480	3.322	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ncoc1C1CC1	ZINC001025284417	1324106536	/nfs/dbraw/zinc/10/65/36/1324106536.db2.gz	HAKABVLUVPSRAF-DLBZAZTESA-N	0	3	341.455	3.034	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)Cc1ccccc1F	ZINC001025294789	1324123985	/nfs/dbraw/zinc/12/39/85/1324123985.db2.gz	CRVMGYOTAGYFHX-WOJBJXKFSA-N	0	3	342.458	3.237	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc(F)cc1F	ZINC001025298748	1324133191	/nfs/dbraw/zinc/13/31/91/1324133191.db2.gz	ZUJMMBAAJUATPK-MOPGFXCFSA-N	0	3	346.421	3.447	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)C2CCc3ccccc3CC2)C1	ZINC001025464521	1324310085	/nfs/dbraw/zinc/31/00/85/1324310085.db2.gz	QSWQYFPDKRBUSB-LAUBAEHRSA-N	0	3	338.495	3.032	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cccc(C(C)C)n2)C1	ZINC001025473143	1324318722	/nfs/dbraw/zinc/31/87/22/1324318722.db2.gz	ZPCQJOVVDXMMQM-DLBZAZTESA-N	0	3	327.472	3.059	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2scnc2C2CCCC2)C1	ZINC001025474090	1324319114	/nfs/dbraw/zinc/31/91/14/1324319114.db2.gz	IPXOKRKGLBNCIG-GDBMZVCRSA-N	0	3	345.512	3.264	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(-n3cccc3)cc2)C1	ZINC001025474769	1324320077	/nfs/dbraw/zinc/32/00/77/1324320077.db2.gz	NRDONNRWTMLNDW-UYAOXDASSA-N	0	3	349.478	3.331	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccn(C(C)C)c2C)C1	ZINC001025519051	1324362473	/nfs/dbraw/zinc/36/24/73/1324362473.db2.gz	JLDLAYLQDMKIEE-AEFFLSMTSA-N	0	3	329.488	3.231	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](C)[C@H]2CCCN(Cc3ocnc3C)C2)CC1	ZINC001025523029	1324368670	/nfs/dbraw/zinc/36/86/70/1324368670.db2.gz	LFJIYEFRRZBSGA-YJBOKZPZSA-N	0	3	345.487	3.446	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(F)c(Cl)c2)C1	ZINC001025522935	1324368830	/nfs/dbraw/zinc/36/88/30/1324368830.db2.gz	JDJDHJDDMQUIQU-UKRRQHHQSA-N	0	3	336.838	3.333	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(-c3ccccc3)o2)C1	ZINC001025539878	1324387802	/nfs/dbraw/zinc/38/78/02/1324387802.db2.gz	QOXDWHDOVCZLBY-AEFFLSMTSA-N	0	3	336.435	3.410	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccn(C(CC)CC)n2)C1	ZINC001025545715	1324392983	/nfs/dbraw/zinc/39/29/83/1324392983.db2.gz	LBBOVIVEHSDSNC-IRXDYDNUSA-N	0	3	344.503	3.098	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cnc(CC(C)(C)C)s2)C1	ZINC001025590783	1324436722	/nfs/dbraw/zinc/43/67/22/1324436722.db2.gz	RQTZYDKPEKNBLQ-CABCVRRESA-N	0	3	347.528	3.195	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(C(F)(F)F)cc2)C1	ZINC001025603200	1324452502	/nfs/dbraw/zinc/45/25/02/1324452502.db2.gz	RNRUOTVCZWFACD-HIFRSBDPSA-N	0	3	338.373	3.169	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2c(CC)oc3ccccc32)C1	ZINC001025630159	1324482366	/nfs/dbraw/zinc/48/23/66/1324482366.db2.gz	PXRJLISFSALQKD-CVEARBPZSA-N	0	3	338.451	3.459	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2csc(CC(C)C)n2)C1	ZINC001025631670	1324483215	/nfs/dbraw/zinc/48/32/15/1324483215.db2.gz	CTBQIWFZLWRUMQ-HZPDHXFCSA-N	0	3	347.528	3.195	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CC[C@H]2CN(C(=O)c3ccccc3)C[C@H]21	ZINC001026180374	1324646978	/nfs/dbraw/zinc/64/69/78/1324646978.db2.gz	JCADEYRSDFBSHH-PWRODBHTSA-N	0	3	345.446	3.199	20	30		EGEDHN
Cc1occc1C(=O)N1C[C@@H]2CC[C@H](NCc3ccccc3C#N)[C@H]2C1	ZINC001026193670	1324656379	/nfs/dbraw/zinc/65/63/79/1324656379.db2.gz	SZHHIWBKHQDYTH-IHPCNDPISA-N	0	3	349.434	3.100	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H]2CC[C@@H](NCc3csc(C)n3)[C@H]2C1	ZINC001026330841	1324730890	/nfs/dbraw/zinc/73/08/90/1324730890.db2.gz	LZGQLIASCILLKF-BHYGNILZSA-N	0	3	347.528	3.380	20	30		EGEDHN
CCC1(C(=O)N2C[C@@H]3CC[C@H](NCc4ccccc4C#N)[C@@H]3C2)CC1	ZINC001026353509	1324747998	/nfs/dbraw/zinc/74/79/98/1324747998.db2.gz	GJCKIJYHEAJNJK-OTWHNJEPSA-N	0	3	337.467	3.075	20	30		EGEDHN
N#Cc1ccccc1CNC1CCC(NC(=O)c2ccsc2)CC1	ZINC001026447956	1324811063	/nfs/dbraw/zinc/81/10/63/1324811063.db2.gz	DKZYIOZOCFDSGQ-UHFFFAOYSA-N	0	3	339.464	3.451	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)C[C@H]2C=CCC2)CC1	ZINC001026449823	1324812924	/nfs/dbraw/zinc/81/29/24/1324812924.db2.gz	CJVAFUKZWAFYPZ-NFOMZHRRSA-N	0	3	341.293	3.268	20	30		EGEDHN
Cc1cc(C(=O)NC2CCC(NCc3ccccc3C#N)CC2)co1	ZINC001026484394	1324840813	/nfs/dbraw/zinc/84/08/13/1324840813.db2.gz	SGYUJWPCORTVBQ-UHFFFAOYSA-N	0	3	337.423	3.291	20	30		EGEDHN
Cc1sccc1C(=O)N1CC[C@@H](CNCc2ccccc2C#N)C1	ZINC001026831117	1325039153	/nfs/dbraw/zinc/03/91/53/1325039153.db2.gz	RYXMYRAFHUGRKY-HNNXBMFYSA-N	0	3	339.464	3.180	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)c2cncs2)C1	ZINC000963273566	1325051941	/nfs/dbraw/zinc/05/19/41/1325051941.db2.gz	WSTNPZSAMIRGNC-UONOGXRCSA-N	0	3	339.892	3.212	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H](CNCc2ccccc2C#N)C1	ZINC001026866516	1325053943	/nfs/dbraw/zinc/05/39/43/1325053943.db2.gz	XUEHPQCFNPHENC-HNNXBMFYSA-N	0	3	345.874	3.275	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H](CNCc2nc(C)cs2)C1	ZINC001026865204	1325054433	/nfs/dbraw/zinc/05/44/33/1325054433.db2.gz	YBWLDRWZOQPZAU-ZDUSSCGKSA-N	0	3	341.908	3.168	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001027028879	1325164620	/nfs/dbraw/zinc/16/46/20/1325164620.db2.gz	QQFILWNIEMJOOP-AWEZNQCLSA-N	0	3	331.435	3.072	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](CNCc3nc(C)c(C)s3)C2)CC1	ZINC001027041077	1325176089	/nfs/dbraw/zinc/17/60/89/1325176089.db2.gz	OLKRDSYPPGUOQZ-INIZCTEOSA-N	0	3	347.528	3.444	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](CNCc3ccn(C(C)C)n3)C2)CC1	ZINC001027041619	1325176642	/nfs/dbraw/zinc/17/66/42/1325176642.db2.gz	XFCWAMYSBGPSRV-KRWDZBQOSA-N	0	3	344.503	3.149	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@@H](CNCc2ccccc2C#N)C1)C1CCCC1	ZINC001027163693	1325264618	/nfs/dbraw/zinc/26/46/18/1325264618.db2.gz	IDPXDTFLOQTHHD-SJORKVTESA-N	0	3	339.483	3.323	20	30		EGEDHN
C#C[C@@](C)(CC)NC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F	ZINC000854704440	1325297900	/nfs/dbraw/zinc/29/79/00/1325297900.db2.gz	SDPRWPAZPAPEAR-AEFFLSMTSA-N	0	3	334.410	3.062	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCN(C(=O)C2CCC=CCC2)C1	ZINC001027222446	1325317231	/nfs/dbraw/zinc/31/72/31/1325317231.db2.gz	GKZDEKFNXZWAMI-QGZVFWFLSA-N	0	3	337.467	3.243	20	30		EGEDHN
Cc1ccoc1C(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001027300542	1325441267	/nfs/dbraw/zinc/44/12/67/1325441267.db2.gz	UPGMPHSRVHVVRX-GOSISDBHSA-N	0	3	337.423	3.196	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC[C@@H](N(C)Cc2ccc(F)c(Cl)c2)C1	ZINC001027335077	1325494118	/nfs/dbraw/zinc/49/41/18/1325494118.db2.gz	BNFXZWXTRHCVJB-GXTWGEPZSA-N	0	3	337.826	3.062	20	30		EGEDHN
CC(C)Oc1cccc(CN(C)[C@H]2CCCN(C(=O)[C@H](C)C#N)C2)c1	ZINC001027337179	1325496824	/nfs/dbraw/zinc/49/68/24/1325496824.db2.gz	ZMCXHVCSNZURSU-AEFFLSMTSA-N	0	3	343.471	3.056	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)CCC2CC2)C1	ZINC001027339877	1325498985	/nfs/dbraw/zinc/49/89/85/1325498985.db2.gz	JIPYGAXGPUHIPE-LJQANCHMSA-N	0	3	325.456	3.171	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)[C@H]2[C@@H]3CCC[C@@H]32)C1	ZINC001027354109	1325526899	/nfs/dbraw/zinc/52/68/99/1325526899.db2.gz	XSQDNZRAVIDPQD-ZRNYENFQSA-N	0	3	337.467	3.027	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC[C@@H](N(C)Cc2ccc(F)c(C#N)c2)C1	ZINC001027361033	1325542763	/nfs/dbraw/zinc/54/27/63/1325542763.db2.gz	XHKYIPLPWMFPOG-XIYYVKAQSA-N	0	3	329.419	3.086	20	30		EGEDHN
CN(Cc1ccc(C#N)c(F)c1)[C@@H]1CCCN(C(=O)[C@H]2CC2(C)C)C1	ZINC001027373241	1325567508	/nfs/dbraw/zinc/56/75/08/1325567508.db2.gz	IUEOSVBLYSNYRU-IAGOWNOFSA-N	0	3	343.446	3.166	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC2(CC(NCC3(C#N)CCC3)C2)CC1	ZINC000926626570	1327641816	/nfs/dbraw/zinc/64/18/16/1327641816.db2.gz	KHZMIVSUJYOPJU-UHFFFAOYSA-N	0	3	333.476	3.450	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)[C@]23C[C@H]2CCC3)C1	ZINC001027497166	1327761035	/nfs/dbraw/zinc/76/10/35/1327761035.db2.gz	GDYKMONPQLKILI-SVFBPWRDSA-N	0	3	337.467	3.171	20	30		EGEDHN
C[C@H](NC[C@@H]1CCCN1CC(F)(F)F)c1ccc(C#N)cc1F	ZINC000926919439	1327776165	/nfs/dbraw/zinc/77/61/65/1327776165.db2.gz	DBJXTNCHRCJKLV-AAEUAGOBSA-N	0	3	329.341	3.375	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)C2(C)CCC2)C1	ZINC001027527245	1327801825	/nfs/dbraw/zinc/80/18/25/1327801825.db2.gz	BDNRAXUBJVQWRG-SFHVURJKSA-N	0	3	325.456	3.171	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H](N(C)CCc3csc(C)n3)C2)C1	ZINC001027566104	1327892566	/nfs/dbraw/zinc/89/25/66/1327892566.db2.gz	GFUMXNGYTWPGPN-QGZVFWFLSA-N	0	3	347.528	3.273	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2C2CC2)C1	ZINC001027609617	1327971131	/nfs/dbraw/zinc/97/11/31/1327971131.db2.gz	YMSUXFHKUCPDQL-SLFFLAALSA-N	0	3	337.467	3.027	20	30		EGEDHN
N#Cc1ccccc1CNC1CC2(C1)CC(NC(=O)[C@H]1CC13CCC3)C2	ZINC000965295320	1327974872	/nfs/dbraw/zinc/97/48/72/1327974872.db2.gz	LGSDFQKFNIUUSZ-MBEFBZSESA-N	0	3	349.478	3.265	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)c2ccc(-c3ccco3)s2)C1	ZINC001027638291	1328005324	/nfs/dbraw/zinc/00/53/24/1328005324.db2.gz	XJGKNBBLCYUENX-CQSZACIVSA-N	0	3	328.437	3.178	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)c2cc3cc(F)ccc3s2)C1	ZINC001027675499	1328072216	/nfs/dbraw/zinc/07/22/16/1328072216.db2.gz	DNVSVSQKNGSJDV-HNNXBMFYSA-N	0	3	330.428	3.210	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(C(=O)CCC3CCCC3)C2)cc1F	ZINC000966561717	1328340845	/nfs/dbraw/zinc/34/08/45/1328340845.db2.gz	IVJPZMDSPJEMSZ-GOSISDBHSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccc(-c3cc[nH]n3)s2)C1	ZINC000966884371	1328451684	/nfs/dbraw/zinc/45/16/84/1328451684.db2.gz	LDZLZNNZAIVDJT-UKRRQHHQSA-N	0	3	344.484	3.155	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)Cc2ccc3cccnc3c2)C1	ZINC000966903357	1328464806	/nfs/dbraw/zinc/46/48/06/1328464806.db2.gz	FNGBRKKLGGLROA-OXJNMPFZSA-N	0	3	337.467	3.180	20	30		EGEDHN
CC1(C)CN(Cc2ccc(C#N)cc2)CC[C@@H]1NC(=O)c1ccoc1	ZINC000940573746	1331115524	/nfs/dbraw/zinc/11/55/24/1331115524.db2.gz	FRLNSHPDBGWXLR-SFHVURJKSA-N	0	3	337.423	3.182	20	30		EGEDHN
CC(C)(C)C(=O)N[C@H]1CCN(Cc2cccc(C#N)c2)CC1(C)C	ZINC000941177833	1331372400	/nfs/dbraw/zinc/37/24/00/1331372400.db2.gz	PCZGOPLJAPDTMB-KRWDZBQOSA-N	0	3	327.472	3.321	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cn(CC)c3ccccc23)[C@H](C)C1	ZINC000942394629	1331924180	/nfs/dbraw/zinc/92/41/80/1331924180.db2.gz	SWBUQRVZQUHIPC-QAPCUYQASA-N	0	3	325.456	3.287	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3cccc(F)c3)CCC2)[C@@H](C)C1	ZINC000942546834	1331968211	/nfs/dbraw/zinc/96/82/11/1331968211.db2.gz	BGOYOPRFNJCLOQ-QFBILLFUSA-N	0	3	342.458	3.097	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3cccc(F)c3)CCC2)[C@@H](C)C1	ZINC000942546833	1331968484	/nfs/dbraw/zinc/96/84/84/1331968484.db2.gz	BGOYOPRFNJCLOQ-LPHOPBHVSA-N	0	3	342.458	3.097	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3sc(C)nc3C)C[C@H]2C)C1	ZINC000942603342	1332001633	/nfs/dbraw/zinc/00/16/33/1332001633.db2.gz	VXNLSWBDCBVIBF-CJNGLKHVSA-N	0	3	347.528	3.443	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C(C)(C)c2cccc(Cl)c2)[C@@H](C)C1	ZINC000943211110	1332122441	/nfs/dbraw/zinc/12/24/41/1332122441.db2.gz	WYTDZEYBWDJZPZ-YOEHRIQHSA-N	0	3	332.875	3.077	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(F)cc3cccnc32)[C@H](C)C1	ZINC000943210777	1332122573	/nfs/dbraw/zinc/12/25/73/1332122573.db2.gz	VWCFAQYBYNHAQV-CXAGYDPISA-N	0	3	327.403	3.000	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ncoc2-c2cccs2)[C@@H](C)C1	ZINC000943690744	1332239666	/nfs/dbraw/zinc/23/96/66/1332239666.db2.gz	VXFNOXUGESGAHC-STQMWFEESA-N	0	3	331.441	3.029	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)CC23CC4CC(CC(C4)C2)C3)[C@H](C)C1	ZINC000944307279	1332369153	/nfs/dbraw/zinc/36/91/53/1332369153.db2.gz	XENPYXRRMPSAFD-AGWGEYTISA-N	0	3	328.500	3.053	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2c[nH]cc2-c2ccccc2)[C@@H](C)C1	ZINC000944921052	1332454628	/nfs/dbraw/zinc/45/46/28/1332454628.db2.gz	XXQZTUXJWBCZDQ-OXJNMPFZSA-N	0	3	335.451	3.145	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)Cc3ccsc3)CC[C@@H]2C1	ZINC000946460988	1332836067	/nfs/dbraw/zinc/83/60/67/1332836067.db2.gz	XWBHXSBBVJBGFQ-IYBDPMFKSA-N	0	3	338.904	3.214	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3sccc3F)CC[C@@H]2C1	ZINC000946576623	1332857251	/nfs/dbraw/zinc/85/72/51/1332857251.db2.gz	XPASQVULCRNNHW-BETUJISGSA-N	0	3	342.867	3.424	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccccc2CC(C)(C)C)C[C@@H]1C	ZINC000947429461	1333124887	/nfs/dbraw/zinc/12/48/87/1333124887.db2.gz	IDDSRDXXZLTENB-FUHWJXTLSA-N	0	3	326.484	3.491	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc(C)c(Cl)c2)C[C@H]1C	ZINC000947441658	1333128688	/nfs/dbraw/zinc/12/86/88/1333128688.db2.gz	KAPWLOGPNYBVBH-NVXWUHKLSA-N	0	3	332.875	3.183	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)C2(F)CCCC2)CCN1Cc1cccc(C#N)c1	ZINC000947464145	1333138280	/nfs/dbraw/zinc/13/82/80/1333138280.db2.gz	RPOAHLBDVJRTBT-YJBOKZPZSA-N	0	3	343.446	3.310	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(F)cc3ccoc32)C[C@H]1C	ZINC000947468332	1333140270	/nfs/dbraw/zinc/14/02/70/1333140270.db2.gz	IQCBTCGVEAFELZ-CZUORRHYSA-N	0	3	328.387	3.178	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](NC(=O)c2n[nH]c3ccc(C)cc32)C[C@H]1C	ZINC000947492986	1333145754	/nfs/dbraw/zinc/14/57/54/1333145754.db2.gz	OINVWZPELQPVNY-KGLIPLIRSA-N	0	3	346.862	3.207	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cn(CC)c3ccccc23)C[C@@H]1C	ZINC000947524193	1333158153	/nfs/dbraw/zinc/15/81/53/1333158153.db2.gz	PIGXRFOWSAJDKQ-HOTGVXAUSA-N	0	3	325.456	3.430	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2coc3ccc(OC)cc32)C[C@@H]1C	ZINC000947537712	1333162787	/nfs/dbraw/zinc/16/27/87/1333162787.db2.gz	POYAOIWKRDFBAV-KBPBESRZSA-N	0	3	328.412	3.210	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2cc3ccccc3s2)C[C@H]1C	ZINC000947540749	1333164897	/nfs/dbraw/zinc/16/48/97/1333164897.db2.gz	YBMJXTBSUCGAEH-NVXWUHKLSA-N	0	3	340.492	3.436	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C)c(Cl)c2F)C[C@H]1C	ZINC000947569277	1333175254	/nfs/dbraw/zinc/17/52/54/1333175254.db2.gz	VFAIKQHVFWSARG-ZIAGYGMSSA-N	0	3	336.838	3.394	20	30		EGEDHN
Cc1coc(C(=O)N[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@H](C)C2)c1	ZINC000947630271	1333201138	/nfs/dbraw/zinc/20/11/38/1333201138.db2.gz	XTHIHRCJJKZIND-CRAIPNDOSA-N	0	3	337.423	3.243	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCN(CCc3ccns3)[C@@H](C)C2)CC1	ZINC000947685940	1333223098	/nfs/dbraw/zinc/22/30/98/1333223098.db2.gz	QPWZRZVPEWHTBN-DOTOQJQBSA-N	0	3	347.528	3.401	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)C2CC3(CC3)C2)CCN1Cc1ccc(C#N)cc1	ZINC000947701297	1333230539	/nfs/dbraw/zinc/23/05/39/1333230539.db2.gz	AEWGIVMTQYLDHE-BEFAXECRSA-N	0	3	337.467	3.218	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3cccc(C#N)c3)[C@H](C)C2)C1	ZINC000947702348	1333232442	/nfs/dbraw/zinc/23/24/42/1333232442.db2.gz	MVXGBBRCXOIMRV-VQIMIIECSA-N	0	3	337.467	3.384	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C(C)(C)C)oc2C)C[C@@H]1C	ZINC000947751241	1333250501	/nfs/dbraw/zinc/25/05/01/1333250501.db2.gz	WIRJWOLNLHMHDP-GOEBONIOSA-N	0	3	330.472	3.492	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2csc(C(C)(C)C)n2)C[C@@H]1C	ZINC000947810579	1333268081	/nfs/dbraw/zinc/26/80/81/1333268081.db2.gz	MLEXNQPROQIYOL-UONOGXRCSA-N	0	3	333.501	3.047	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnn(C(CC)CC)c2C)C[C@H]1C	ZINC000947907724	1333301197	/nfs/dbraw/zinc/30/11/97/1333301197.db2.gz	JPLCBNFSKKLHOH-ZBFHGGJFSA-N	0	3	332.492	3.321	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2c[nH]nc2C2CCCCC2)C[C@@H]1C	ZINC000947917153	1333306810	/nfs/dbraw/zinc/30/68/10/1333306810.db2.gz	VMXUTVIXQNOELJ-HOCLYGCPSA-N	0	3	330.476	3.226	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)n(CC3CC3)c2C)C[C@@H]1C	ZINC000947938735	1333312705	/nfs/dbraw/zinc/31/27/05/1333312705.db2.gz	ATYZTSSINKMWPR-HNAYVOBHSA-N	0	3	341.499	3.121	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccccc2C(F)(F)F)C[C@@H]1C	ZINC000947962448	1333321696	/nfs/dbraw/zinc/32/16/96/1333321696.db2.gz	MZIUCBXLRDBBLO-KBPBESRZSA-N	0	3	338.373	3.311	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2sc(Cl)nc2Cl)C[C@H]1C	ZINC000948044346	1333352424	/nfs/dbraw/zinc/35/24/24/1333352424.db2.gz	PHHNETUOSWBYKV-RKDXNWHRSA-N	0	3	334.272	3.219	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(F)c3occc32)C[C@@H]1C	ZINC000948044293	1333352154	/nfs/dbraw/zinc/35/21/54/1333352154.db2.gz	OUPJDKIPPRETIF-UONOGXRCSA-N	0	3	328.387	3.178	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2coc3c2cccc3OC)CC1	ZINC000948368880	1333497318	/nfs/dbraw/zinc/49/73/18/1333497318.db2.gz	STJBFVURMRSJRG-HNNXBMFYSA-N	0	3	340.423	3.001	20	30		EGEDHN
CN(C(=O)c1cc[nH]c1)[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948396694	1333508542	/nfs/dbraw/zinc/50/85/42/1333508542.db2.gz	CXPGOVDEQGWXHZ-LJQANCHMSA-N	0	3	336.439	3.013	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2ccc3cc(C)cn3c2)CC1	ZINC000948431647	1333521857	/nfs/dbraw/zinc/52/18/57/1333521857.db2.gz	BPKGDIFXWSDBQK-IBGZPJMESA-N	0	3	337.467	3.198	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2ccc(-n3cccc3)cc2)CC1	ZINC000948591353	1333587578	/nfs/dbraw/zinc/58/75/78/1333587578.db2.gz	VPZSLKPVFLQMRD-HXUWFJFHSA-N	0	3	349.478	3.427	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)Cc2ccc(CC(C)C)cc2)CC1	ZINC000948599670	1333590892	/nfs/dbraw/zinc/59/08/92/1333590892.db2.gz	WMVOCOVBPSYBAZ-NRFANRHFSA-N	0	3	340.511	3.374	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](N(C)C(=O)c2ccc3cncn3c2)CC1	ZINC000948621958	1333600537	/nfs/dbraw/zinc/60/05/37/1333600537.db2.gz	YUEOHYXTKJACHR-INIZCTEOSA-N	0	3	346.862	3.013	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2nc3ccccc3cc2C)CC1	ZINC000948629624	1333603213	/nfs/dbraw/zinc/60/32/13/1333603213.db2.gz	VTJGYYSWHWIRLU-SFHVURJKSA-N	0	3	335.451	3.103	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2ccc(C)nc2C(C)C)CC1	ZINC000948655843	1333615055	/nfs/dbraw/zinc/61/50/55/1333615055.db2.gz	NHTPWMOWVAJBJS-QGZVFWFLSA-N	0	3	327.472	3.073	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2nsc3ccc(C)cc32)CC1	ZINC000948674462	1333623818	/nfs/dbraw/zinc/62/38/18/1333623818.db2.gz	YHSVLDRJWDPLPQ-HNNXBMFYSA-N	0	3	341.480	3.164	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cccc(Cl)c2F)CC1	ZINC000948734430	1333651340	/nfs/dbraw/zinc/65/13/40/1333651340.db2.gz	QWBNPQODPUHXDK-AWEZNQCLSA-N	0	3	336.838	3.429	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)[C@@H](C)c2ccc(Cl)cc2)CC1	ZINC000948742486	1333655054	/nfs/dbraw/zinc/65/50/54/1333655054.db2.gz	KYRBWMOSMLQDAY-YJBOKZPZSA-N	0	3	332.875	3.390	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)Cc2ccc(C(C)(C)C)cc2)CC1	ZINC000948804656	1333687229	/nfs/dbraw/zinc/68/72/29/1333687229.db2.gz	PYRHDOGPLMVVEQ-HXUWFJFHSA-N	0	3	340.511	3.473	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2ccccc2O[C@H](C)CC)CC1	ZINC000948820896	1333698182	/nfs/dbraw/zinc/69/81/82/1333698182.db2.gz	UQCBOJBUQJERLH-QZTJIDSGSA-N	0	3	342.483	3.424	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@@H]1CNC(=O)c1cc(C)n[nH]1	ZINC000948898118	1333724363	/nfs/dbraw/zinc/72/43/63/1333724363.db2.gz	DCXMDYYODGYHQW-IBGZPJMESA-N	0	3	338.455	3.014	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H]1CCCC[C@H]1CC)CCO2	ZINC000949221205	1333797712	/nfs/dbraw/zinc/79/77/12/1333797712.db2.gz	UZFKEQZCKXLBSG-QZTJIDSGSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1CCC(C)(C)CC1)CCO2	ZINC000949250872	1333804204	/nfs/dbraw/zinc/80/42/04/1333804204.db2.gz	BQCHZVHHDWLKTA-UHFFFAOYSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)c3oc(C)cc3C)CC2)C1	ZINC000949331680	1333825405	/nfs/dbraw/zinc/82/54/05/1333825405.db2.gz	CIUWDQWOEWBBHY-UHFFFAOYSA-N	0	3	346.471	3.170	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C3=CCCCCC3)CC2)C1	ZINC000949348497	1333828561	/nfs/dbraw/zinc/82/85/61/1333828561.db2.gz	FJPGQFMCWQUFMW-UHFFFAOYSA-N	0	3	332.488	3.146	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@@H]3CCCC3(C)C)CC2)C1	ZINC000949445301	1333849199	/nfs/dbraw/zinc/84/91/99/1333849199.db2.gz	WFXMSDQRHBXHFM-SFHVURJKSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@H]3C[C@]3(C)C(C)C)CC2)C1	ZINC000949501536	1333861440	/nfs/dbraw/zinc/86/14/40/1333861440.db2.gz	WYGIKJFZZJCPJM-UYAOXDASSA-N	0	3	348.531	3.328	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@H]3CC[C@H](CC)CC3)CC2)C1	ZINC000949515167	1333865088	/nfs/dbraw/zinc/86/50/88/1333865088.db2.gz	BXEIEHVPXVYIKH-WGSAOQKQSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@H]3CCCC(C)(C)C3)CC2)C1	ZINC000949534258	1333870481	/nfs/dbraw/zinc/87/04/81/1333870481.db2.gz	SYZIVAOIKICJAF-SFHVURJKSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)Cc2ccc3cnccc3c2)C1	ZINC000967293184	1335692613	/nfs/dbraw/zinc/69/26/13/1335692613.db2.gz	VGBRUUFRHHLBBW-UZLBHIALSA-N	0	3	337.467	3.180	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2ccc3c(c2)C(C)(C)CO3)C1	ZINC000967319898	1335700358	/nfs/dbraw/zinc/70/03/58/1335700358.db2.gz	ZPVJWGKXLGTSPL-YJBOKZPZSA-N	0	3	342.483	3.373	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2noc3c2CC(C)(C)CC3)C1	ZINC000967424556	1335734309	/nfs/dbraw/zinc/73/43/09/1335734309.db2.gz	SDIVQQYDGLZQFE-GOEBONIOSA-N	0	3	345.487	3.206	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2cc3ccccc3n2C)C1	ZINC000968078255	1335854142	/nfs/dbraw/zinc/85/41/42/1335854142.db2.gz	KFKWFGXQHCOALO-NVXWUHKLSA-N	0	3	325.456	3.195	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2c(F)ccc(F)c2F)C1	ZINC000968105156	1335857595	/nfs/dbraw/zinc/85/75/95/1335857595.db2.gz	IJCIKTYJBOWDGT-RISCZKNCSA-N	0	3	326.362	3.120	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)Cc2c(C)cc(C)cc2C)C1	ZINC000968170975	1335865706	/nfs/dbraw/zinc/86/57/06/1335865706.db2.gz	ANGSTTGSLLWLTP-OXJNMPFZSA-N	0	3	326.484	3.004	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2ccc(N3CC=CC3)cc2)C1	ZINC000968320955	1335889623	/nfs/dbraw/zinc/88/96/23/1335889623.db2.gz	BQAQDQCESPHFLU-PXNSSMCTSA-N	0	3	339.483	3.079	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(C(C)C)nc2CC)C1	ZINC000968334836	1335892977	/nfs/dbraw/zinc/89/29/77/1335892977.db2.gz	KZFYNFFFHCWIIR-UZLBHIALSA-N	0	3	341.499	3.231	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)Cc2c[nH]c3ccc(F)cc23)C1	ZINC000968354702	1335900648	/nfs/dbraw/zinc/90/06/48/1335900648.db2.gz	VMRMVBGNAPSPKU-KUHUBIRLSA-N	0	3	343.446	3.252	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2c(C)noc2C(F)(F)F)C1	ZINC000968369330	1335907031	/nfs/dbraw/zinc/90/70/31/1335907031.db2.gz	ITLFHWQHXOIWPI-ZYHUDNBSSA-N	0	3	345.365	3.018	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2oc(CC(C)C)nc2C)C1	ZINC000968401630	1335921308	/nfs/dbraw/zinc/92/13/08/1335921308.db2.gz	ZKFWHBOASUNLAE-HOCLYGCPSA-N	0	3	333.476	3.198	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccccc2OCC(C)C)C1	ZINC000968430492	1335927848	/nfs/dbraw/zinc/92/78/48/1335927848.db2.gz	CWMCNSKLMSUPQU-HKUYNNGSSA-N	0	3	342.483	3.185	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)Cc2c[nH]c3cccc(C)c23)C1	ZINC000968544879	1335958754	/nfs/dbraw/zinc/95/87/54/1335958754.db2.gz	VZIDRSSVZHIJRL-DNVCBOLYSA-N	0	3	339.483	3.422	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2ccc(OC)c(OCC)c2)C1	ZINC000968624161	1335987814	/nfs/dbraw/zinc/98/78/14/1335987814.db2.gz	OKKOWDAMWMXFRF-DOTOQJQBSA-N	0	3	346.471	3.110	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2ccc(OCC3CC3)cc2)C1	ZINC000968669324	1336003600	/nfs/dbraw/zinc/00/36/00/1336003600.db2.gz	LFHZYPYFHXXRPC-OXJNMPFZSA-N	0	3	342.483	3.492	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2c[nH]c3c2cccc3CC)C1	ZINC000968680978	1336008562	/nfs/dbraw/zinc/00/85/62/1336008562.db2.gz	FRIZDOGAONWNPU-BEFAXECRSA-N	0	3	337.467	3.194	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2c(CC)oc3ccccc32)C1	ZINC000968685695	1336010764	/nfs/dbraw/zinc/01/07/64/1336010764.db2.gz	XQSLOGPPOFYKFQ-WBVHZDCISA-N	0	3	338.451	3.459	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)C(C)(C)c2ccccc2OC)C1	ZINC000968697777	1336016634	/nfs/dbraw/zinc/01/66/34/1336016634.db2.gz	IVWGTZFROCAHII-WMZOPIPTSA-N	0	3	344.499	3.376	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1oc(CC2CC2)nc1C	ZINC000968856503	1336069594	/nfs/dbraw/zinc/06/95/94/1336069594.db2.gz	JJTZKVKHCJVLMG-QGZVFWFLSA-N	0	3	345.487	3.486	20	30		EGEDHN
N#Cc1ccc(CN2CCCCC[C@H]2CNC(=O)c2cc[nH]c2)cc1	ZINC000968871027	1336073763	/nfs/dbraw/zinc/07/37/63/1336073763.db2.gz	IWSVIOYDKPTOKF-IBGZPJMESA-N	0	3	336.439	3.061	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1ccc(C)c(OC)c1	ZINC000968940826	1336097984	/nfs/dbraw/zinc/09/79/84/1336097984.db2.gz	AUFKIVQANMAVGE-GOSISDBHSA-N	0	3	328.456	3.001	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cc2cc(OC)ccc2[nH]1	ZINC000969007639	1336116302	/nfs/dbraw/zinc/11/63/02/1336116302.db2.gz	GJBSJWHDFRHJIW-MRXNPFEDSA-N	0	3	341.455	3.337	20	30		EGEDHN
C#CCCN1CCCCC[C@@H]1CNC(=O)c1cc2occc2s1	ZINC000969022296	1336120217	/nfs/dbraw/zinc/12/02/17/1336120217.db2.gz	BKCVJDIWXALYAZ-CQSZACIVSA-N	0	3	330.453	3.492	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1ccc(C)c(OCC)c1	ZINC000969057001	1336131363	/nfs/dbraw/zinc/13/13/63/1336131363.db2.gz	PPLGKQGCXHIRIG-LJQANCHMSA-N	0	3	342.483	3.391	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1cnc(C(C)C)nc1C	ZINC000969059510	1336133067	/nfs/dbraw/zinc/13/30/67/1336133067.db2.gz	MNEMBSSIENKPGX-KRWDZBQOSA-N	0	3	344.503	3.459	20	30		EGEDHN
C#CCCN1CCCCC[C@@H]1CNC(=O)c1cc([C@H](C)CC)no1	ZINC000969061575	1336134213	/nfs/dbraw/zinc/13/42/13/1336134213.db2.gz	BYRGLXBFQHZDKJ-HZPDHXFCSA-N	0	3	331.460	3.186	20	30		EGEDHN
C#CCCN1CCCCC[C@H]1CNC(=O)c1scnc1C(C)C	ZINC000969061937	1336134260	/nfs/dbraw/zinc/13/42/60/1336134260.db2.gz	HIOXOSYSIABYFR-HNNXBMFYSA-N	0	3	333.501	3.264	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cccc(-n2ccnc2)c1	ZINC000969101047	1336143724	/nfs/dbraw/zinc/14/37/24/1336143724.db2.gz	OTGWKMZJJGXHRX-LJQANCHMSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=CCOc1cccnc1C(=O)NC[C@@H]1CCCCCN1CC(=C)C	ZINC000969108542	1336146948	/nfs/dbraw/zinc/14/69/48/1336146948.db2.gz	FKNYYGNWCMBIAO-KRWDZBQOSA-N	0	3	343.471	3.197	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)[C@@H]1CCCc2sc(C)nc21	ZINC000969114276	1336148943	/nfs/dbraw/zinc/14/89/43/1336148943.db2.gz	DXQJFDLPWHUIOA-JKSUJKDBSA-N	0	3	347.528	3.418	20	30		EGEDHN
C#CCCN1CCCCC[C@@H]1CNC(=O)c1cc2[nH]ccc2s1	ZINC000969127066	1336152268	/nfs/dbraw/zinc/15/22/68/1336152268.db2.gz	RESGGNGBBXHMRR-CQSZACIVSA-N	0	3	329.469	3.227	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1cccc2cnccc21	ZINC000969145163	1336161651	/nfs/dbraw/zinc/16/16/51/1336161651.db2.gz	ZFVFXSPYJRPCMN-SFHVURJKSA-N	0	3	335.451	3.233	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cc(Cl)cc2c1OCC2	ZINC000969160456	1336167582	/nfs/dbraw/zinc/16/75/82/1336167582.db2.gz	DCWQGFMZVSEREQ-INIZCTEOSA-N	0	3	348.874	3.435	20	30		EGEDHN
Cc1cccc([C@H](C)N2CC([C@@H](C)NC(=O)c3cc(C#N)c[nH]3)C2)c1	ZINC000969465767	1336214695	/nfs/dbraw/zinc/21/46/95/1336214695.db2.gz	GYOPQSNHHXGIHC-CABCVRRESA-N	0	3	336.439	3.006	20	30		EGEDHN
C#CCCN1CC([C@@H](C)NC(=O)c2csc3cc(C)ccc23)C1	ZINC000969748573	1336242592	/nfs/dbraw/zinc/24/25/92/1336242592.db2.gz	HOSZSEOTTYHFOL-CQSZACIVSA-N	0	3	326.465	3.283	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](NCc2cc(C)ccc2OC)C1	ZINC000969831498	1336252272	/nfs/dbraw/zinc/25/22/72/1336252272.db2.gz	HAJDKFHRUIEVSX-YLJYHZDGSA-N	0	3	330.472	3.296	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)c2ccccc2-c2ccncc2)C1	ZINC000969956953	1336266216	/nfs/dbraw/zinc/26/62/16/1336266216.db2.gz	BKHVPTHUPKWKTA-MRXNPFEDSA-N	0	3	335.451	3.375	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)[C@@H]2CCCC[C@@H]2C(F)(F)F)C1	ZINC000969962466	1336266937	/nfs/dbraw/zinc/26/69/37/1336266937.db2.gz	TYVXKPDRSHLQSZ-CFVMTHIKSA-N	0	3	332.410	3.368	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)c2cccc3c(C)c(C)[nH]c32)C1	ZINC000969986385	1336269383	/nfs/dbraw/zinc/26/93/83/1336269383.db2.gz	YSCQLHFUNTYWQT-HNNXBMFYSA-N	0	3	325.456	3.411	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cnc3ccsc3c2)CC1	ZINC001005814356	1336404046	/nfs/dbraw/zinc/40/40/46/1336404046.db2.gz	ADQNQDLSZSZSKV-UHFFFAOYSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccnc(O[C@@H](C)CC)c2)CC1	ZINC001006274218	1336479577	/nfs/dbraw/zinc/47/95/77/1336479577.db2.gz	HXXRHGJBEIIYDF-INIZCTEOSA-N	0	3	345.487	3.371	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cccc(OCC(C)C)c2)CC1	ZINC001006377347	1336497503	/nfs/dbraw/zinc/49/75/03/1336497503.db2.gz	MJXVSXBWOAJYHI-UHFFFAOYSA-N	0	3	330.472	3.444	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)Cc2cccc(OC(C)C)c2)CC1	ZINC001006459127	1336510598	/nfs/dbraw/zinc/51/05/98/1336510598.db2.gz	SCJXQBIVDVDGJN-UHFFFAOYSA-N	0	3	330.472	3.125	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2c(C)occ2C(F)(F)F)C1	ZINC001007948271	1336737429	/nfs/dbraw/zinc/73/74/29/1336737429.db2.gz	BWPFSHKSQHFOKO-LBPRGKRZSA-N	0	3	330.350	3.377	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CCCN([C@H](C)c3ccccc3C)C2)c1	ZINC001008469373	1336864557	/nfs/dbraw/zinc/86/45/57/1336864557.db2.gz	PRPXUUTTXUNBFP-XLIONFOSSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CCCN([C@H](C)c3ccccc3C)C2)c1	ZINC001008469374	1336864586	/nfs/dbraw/zinc/86/45/86/1336864586.db2.gz	PRPXUUTTXUNBFP-YLJYHZDGSA-N	0	3	347.462	3.327	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2coc(-c3ccccc3)n2)C1	ZINC001009256401	1336992034	/nfs/dbraw/zinc/99/20/34/1336992034.db2.gz	ZTTFFNFQPVSPRC-MRXNPFEDSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H](NC(=O)c2ccc(Br)o2)C1	ZINC001009314607	1337004559	/nfs/dbraw/zinc/00/45/59/1337004559.db2.gz	VPLSELXLLUYNOJ-GFCCVEGCSA-N	0	3	341.249	3.203	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@H]1CCCN(CC2=CCCCC2)C1	ZINC001009350514	1337009181	/nfs/dbraw/zinc/00/91/81/1337009181.db2.gz	FHHDXFKFGMXJGJ-NRFANRHFSA-N	0	3	336.479	3.291	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CCN([C@@H]2CCc3ccccc32)C1	ZINC001014731023	1337890150	/nfs/dbraw/zinc/89/01/50/1337890150.db2.gz	HSOULKZBKOWKID-PKOBYXMFSA-N	0	3	335.451	3.166	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@@H]2CCN(Cc3ccccc3C)C2)cc1	ZINC001015809929	1338321903	/nfs/dbraw/zinc/32/19/03/1338321903.db2.gz	XANNXHJAMHCIMG-HXUWFJFHSA-N	0	3	348.446	3.011	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@@H]3NC(=O)[C@H]3[C@@H]4CCC[C@@H]43)CC2)c1	ZINC001016561651	1338646200	/nfs/dbraw/zinc/64/62/00/1338646200.db2.gz	BKIRKYOBDGHBOK-ZGXWSNOMSA-N	0	3	349.478	3.075	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)Cc2ccc(CCCC)cc2)CC1	ZINC001016707687	1338697551	/nfs/dbraw/zinc/69/75/51/1338697551.db2.gz	ZKBSGQAIQSEXQX-FQEVSTJZSA-N	0	3	338.495	3.176	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2ccc3c4c(cccc42)CC3)CC1	ZINC001016714404	1338699919	/nfs/dbraw/zinc/69/99/19/1338699919.db2.gz	ASDHNOHOQYMJBH-FQEVSTJZSA-N	0	3	344.458	3.156	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@H]3NC(=O)[C@]34C[C@H]3CCC4)CC2)c1	ZINC001016739128	1338707906	/nfs/dbraw/zinc/70/79/06/1338707906.db2.gz	ZRYCGFZNEPHMHS-WOIUINJBSA-N	0	3	349.478	3.219	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)C2(c3cccc(C)c3)CCC2)CC1	ZINC001016763719	1338716566	/nfs/dbraw/zinc/71/65/66/1338716566.db2.gz	QYQBKTFRMWDDCI-IBGZPJMESA-N	0	3	336.479	3.021	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)Cc2c(C)[nH]c3ccccc32)CC1	ZINC001016797014	1338730131	/nfs/dbraw/zinc/73/01/31/1338730131.db2.gz	WPVRFLZAFFXZJG-FQEVSTJZSA-N	0	3	349.478	3.013	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)[C@]2(C)CC[C@H](C)C2(C)C)CC1	ZINC001016862564	1338751246	/nfs/dbraw/zinc/75/12/46/1338751246.db2.gz	GFEPLMSPXCMELY-QKLQHJQFSA-N	0	3	330.516	3.443	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)[C@@H]2C[C@H]2c2ccc(C)s2)CC1	ZINC001016869827	1338753252	/nfs/dbraw/zinc/75/32/52/1338753252.db2.gz	JXDLEYGFTJQYOZ-NUJGCVRESA-N	0	3	342.508	3.154	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)C23CC4CC(CC(C4)C2)C3)CC1	ZINC001016940080	1338776660	/nfs/dbraw/zinc/77/66/60/1338776660.db2.gz	MRRZCGCSKRSCIG-ONUXSRJRSA-N	0	3	340.511	3.197	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2c(C)csc2Cl)CC1	ZINC001016946889	1338780067	/nfs/dbraw/zinc/78/00/67/1338780067.db2.gz	HGGQBFHEUQOQMP-CYBMUJFWSA-N	0	3	336.888	3.318	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2cc3c(s2)CCCCC3)CC1	ZINC001016954566	1338782848	/nfs/dbraw/zinc/78/28/48/1338782848.db2.gz	COWREJPEDSBLAP-SFHVURJKSA-N	0	3	342.508	3.235	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cc(C)c(CC)s2)CC1	ZINC001016965803	1338786974	/nfs/dbraw/zinc/78/69/74/1338786974.db2.gz	SOXTZAHSBLMRSZ-QGZVFWFLSA-N	0	3	330.497	3.227	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2ccc3[nH]c(C)c(C)c3c2)CC1	ZINC001016969953	1338787549	/nfs/dbraw/zinc/78/75/49/1338787549.db2.gz	XLUWEMUPHXALIU-LJQANCHMSA-N	0	3	335.451	3.002	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)[C@H](C)c2ccc(F)c(F)c2)CC1	ZINC001016985880	1338792968	/nfs/dbraw/zinc/79/29/68/1338792968.db2.gz	LITJEKPCIXANSU-RDTXWAMCSA-N	0	3	346.421	3.062	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2c(CC)oc3ccccc32)CC1	ZINC001016988960	1338794934	/nfs/dbraw/zinc/79/49/34/1338794934.db2.gz	JVLRWLLDQUGASK-SFHVURJKSA-N	0	3	336.435	3.213	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCCN(C(=O)C=C2CCC2)C1	ZINC001017101935	1338868205	/nfs/dbraw/zinc/86/82/05/1338868205.db2.gz	OSMJIDSBCFQMGU-INIZCTEOSA-N	0	3	343.496	3.400	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCCN(C(=O)C2=CCCC2)C1	ZINC001017105562	1338870209	/nfs/dbraw/zinc/87/02/09/1338870209.db2.gz	YQTKFGJEMCFDJW-HNNXBMFYSA-N	0	3	343.496	3.400	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H](CN(C)[C@@H](C)c2cnccn2)C1	ZINC001017179460	1338923155	/nfs/dbraw/zinc/92/31/55/1338923155.db2.gz	JNIBQWHNOOVIBA-IRXDYDNUSA-N	0	3	344.503	3.310	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H](CN(C)Cc2cn(C)nc2C)C1	ZINC001017179734	1338924250	/nfs/dbraw/zinc/92/42/50/1338924250.db2.gz	NPDNRJPMWHOBDN-KRWDZBQOSA-N	0	3	346.519	3.001	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@@H](CN(C)Cc3ocnc3C)C2)CC1	ZINC001017199148	1338944402	/nfs/dbraw/zinc/94/44/02/1338944402.db2.gz	ZQMFODPABGVSHG-KRWDZBQOSA-N	0	3	345.487	3.400	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@H]1Cc2ccccc2O1	ZINC001017582749	1339372516	/nfs/dbraw/zinc/37/25/16/1339372516.db2.gz	PSKVSBKWOMJLBU-CEXWTWQISA-N	0	3	340.467	3.022	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1CCc2cc(F)ccc21	ZINC001017739803	1339407904	/nfs/dbraw/zinc/40/79/04/1339407904.db2.gz	QVGDGZWMZNJFLS-SCTDSRPQSA-N	0	3	328.431	3.107	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC001018041205	1339489142	/nfs/dbraw/zinc/48/91/42/1339489142.db2.gz	NZDJQDJVAVWRCS-KVPLUYHFSA-N	0	3	340.467	3.050	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2c(c1)C[C@H](C)O2	ZINC001018064596	1339493590	/nfs/dbraw/zinc/49/35/90/1339493590.db2.gz	GFOHGEUANBKLFH-ZYSHUDEJSA-N	0	3	340.467	3.265	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1CCO[C@@H](CCC)C1	ZINC001018106542	1339502468	/nfs/dbraw/zinc/50/24/68/1339502468.db2.gz	CFHSBMOPGFVZNE-OKYOBFRVSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C1(c2ccccc2F)CC1	ZINC001018134255	1339509995	/nfs/dbraw/zinc/50/99/95/1339509995.db2.gz	GHHOUBPWWRMSCF-CALCHBBNSA-N	0	3	342.458	3.499	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc(C)c(C)c1	ZINC001018246594	1339548394	/nfs/dbraw/zinc/54/83/94/1339548394.db2.gz	PGDPSRUPPFFGSE-BGYRXZFFSA-N	0	3	326.484	3.487	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@H](NCc2ccc(Cl)nc2)C1	ZINC001018910128	1339750578	/nfs/dbraw/zinc/75/05/78/1339750578.db2.gz	KQNIZTKFENVPHN-ZDUSSCGKSA-N	0	3	342.270	3.204	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCCN2Cc2ccc(C)cc2)cc1	ZINC001028067601	1340407066	/nfs/dbraw/zinc/40/70/66/1340407066.db2.gz	XWTOIBUNUDHWID-NRFANRHFSA-N	0	3	332.447	3.371	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1c(Cl)cncc1Cl	ZINC001028110796	1340432766	/nfs/dbraw/zinc/43/27/66/1340432766.db2.gz	KXBYDMQYXGBVSS-LLVKDONJSA-N	0	3	328.243	3.159	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@H]2CCCN2[C@@H](C)c2ccccc2)c1	ZINC001028129217	1340447218	/nfs/dbraw/zinc/44/72/18/1340447218.db2.gz	MUCVDTVKPOGBHH-OXJNMPFZSA-N	0	3	333.435	3.018	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H]1CNC(=O)c1cnc([C@H]2CCCO2)s1	ZINC001028187447	1340475271	/nfs/dbraw/zinc/47/52/71/1340475271.db2.gz	JZSFXHAQRQMPBT-HUUCEWRRSA-N	0	3	349.500	3.155	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NC[C@@H]1CCCN1Cc1ccc(C)cc1	ZINC001028197296	1340480420	/nfs/dbraw/zinc/48/04/20/1340480420.db2.gz	DOKIQMXOONNEDQ-UFYCRDLUSA-N	0	3	342.483	3.057	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCCN2Cc2cccc(CC)c2)cn1	ZINC001028271225	1340524520	/nfs/dbraw/zinc/52/45/20/1340524520.db2.gz	CDQRCWGRNSAAQF-NRFANRHFSA-N	0	3	347.462	3.020	20	30		EGEDHN
C#CCCN1CCC[C@@H]1CNC(=O)c1cc2c(s1)CC[C@H](C)C2	ZINC001028306153	1340555232	/nfs/dbraw/zinc/55/52/32/1340555232.db2.gz	DJBDBQMFNOBFMO-GOEBONIOSA-N	0	3	330.497	3.090	20	30		EGEDHN
Cc1cc(C(=O)NC[C@H]2CCN(Cc3cccc(C#N)c3)C2)c(C)o1	ZINC001028404593	1340626488	/nfs/dbraw/zinc/62/64/88/1340626488.db2.gz	UENVYDUGVNBXER-GOSISDBHSA-N	0	3	337.423	3.020	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)c2ccc(C(C)(C)CC)cc2)C1	ZINC001028617959	1340726021	/nfs/dbraw/zinc/72/60/21/1340726021.db2.gz	LBIDOEAUFBPKKT-KRWDZBQOSA-N	0	3	326.484	3.449	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](CNC(=O)[C@@H]3CCCC34CC4)C2)cc1	ZINC001028628663	1340733435	/nfs/dbraw/zinc/73/34/35/1340733435.db2.gz	XNIZEOWIBBTJIY-OALUTQOASA-N	0	3	337.467	3.077	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@@H]2CCN(C[C@@H](F)CC)C2)cc1	ZINC001028637272	1340738520	/nfs/dbraw/zinc/73/85/20/1340738520.db2.gz	PFIXPSQMRLVDGF-RDJZCZTQSA-N	0	3	334.435	3.051	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CCN(CCc3csc(C)n3)C2)CC1	ZINC001028780827	1340812944	/nfs/dbraw/zinc/81/29/44/1340812944.db2.gz	NILNYIUXJBILQD-MRXNPFEDSA-N	0	3	347.528	3.179	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC([C@H](C)NCc2ccccc2C#N)CC1	ZINC001029078261	1340925143	/nfs/dbraw/zinc/92/51/43/1340925143.db2.gz	NSOXFRDJSPHEKL-MRJCOXNESA-N	0	3	325.456	3.241	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC([C@@H](C)NCc2nccs2)CC1	ZINC001029123986	1340935902	/nfs/dbraw/zinc/93/59/02/1340935902.db2.gz	CHKQEKMVZFKDRA-CQSZACIVSA-N	0	3	335.517	3.462	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC([C@@H](C)NCc2nccs2)CC1	ZINC001029136181	1340939657	/nfs/dbraw/zinc/93/96/57/1340939657.db2.gz	AVCGLWVIOHNMTJ-RDTXWAMCSA-N	0	3	335.517	3.462	20	30		EGEDHN
C=CCn1cccc1C(=O)N1C[C@H]2CC[C@@H](C1)N2CCc1ccccc1	ZINC001029338048	1340973961	/nfs/dbraw/zinc/97/39/61/1340973961.db2.gz	QKUMOZXVBVSLRM-BGYRXZFFSA-N	0	3	349.478	3.206	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CC[C@@H](C1)N2CC[C@H]1CCCCO1	ZINC001029419598	1340986106	/nfs/dbraw/zinc/98/61/06/1340986106.db2.gz	HDUJMLKZASHNFQ-FGTMMUONSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H]3CC[C@@H](C2)N3CC2CC(F)(F)C2)CC1	ZINC001029455541	1340994169	/nfs/dbraw/zinc/99/41/69/1340994169.db2.gz	CALQQSDTEWOBQB-CALCHBBNSA-N	0	3	338.442	3.453	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@@H](CN(C)Cc2ccc(C#N)s2)C1)C1CCC1	ZINC001029766409	1341066158	/nfs/dbraw/zinc/06/61/58/1341066158.db2.gz	AKLUGNNKMCWGCX-CABCVRRESA-N	0	3	345.512	3.336	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](CN(C)Cc2cncc(F)c2)C1	ZINC001029825511	1341086962	/nfs/dbraw/zinc/08/69/62/1341086962.db2.gz	FMLRQMWFFGFYJR-HNAYVOBHSA-N	0	3	333.451	3.103	20	30		EGEDHN
C=CCCN1CCC[C@H](N(Cc2ccccc2)C(=O)c2cocn2)C1	ZINC001029917782	1341117730	/nfs/dbraw/zinc/11/77/30/1341117730.db2.gz	PKBSDKHQHDYHEI-SFHVURJKSA-N	0	3	339.439	3.358	20	30		EGEDHN
CCCC(=O)N1CCC(CN(C)Cc2cc(C#N)ccc2OC)CC1	ZINC001029926072	1341122396	/nfs/dbraw/zinc/12/23/96/1341122396.db2.gz	YGWJNJCVIJHOHY-UHFFFAOYSA-N	0	3	343.471	3.037	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC(CN(C)[C@@H](C)c2ccc(F)cc2F)CC1	ZINC001029945967	1341130648	/nfs/dbraw/zinc/13/06/48/1341130648.db2.gz	YZIOVGONMPYFRQ-KBPBESRZSA-N	0	3	349.425	3.356	20	30		EGEDHN
Cc1ccc(F)c(CN(C)CC2CCN(C(=O)C#CC3CC3)CC2)c1	ZINC001029965034	1341136894	/nfs/dbraw/zinc/13/68/94/1341136894.db2.gz	JGLBBTUBLOEHIE-UHFFFAOYSA-N	0	3	342.458	3.218	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2C[C@@H]3C[C@H]2CN3C[C@H](C)CC)cc1	ZINC001032483855	1341520994	/nfs/dbraw/zinc/52/09/94/1341520994.db2.gz	KXVZMBWJYLKNGO-NJAFHUGGSA-N	0	3	328.456	3.196	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2C[C@@H]3C[C@H]2CN3CC2CC(C)C2)cc1	ZINC001032484541	1341521331	/nfs/dbraw/zinc/52/13/31/1341521331.db2.gz	VBNWISALSOUYDI-VHZYLWGESA-N	0	3	340.467	3.196	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H](C)c1c(F)cccc1F	ZINC001032520845	1341529560	/nfs/dbraw/zinc/52/95/60/1341529560.db2.gz	ICSKTTPXCBYPOP-KKUMJFAQSA-N	0	3	334.410	3.320	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H]1CCc2cc(F)ccc21	ZINC001032524253	1341530998	/nfs/dbraw/zinc/53/09/98/1341530998.db2.gz	ZRXOFRQXVMMHSK-JENIJYKNSA-N	0	3	328.431	3.107	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1c(C)[nH]c2ccccc21	ZINC001032596408	1341552991	/nfs/dbraw/zinc/55/29/91/1341552991.db2.gz	AHEAPAKRQMSPJJ-IRXDYDNUSA-N	0	3	337.467	3.270	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cnn(CCC)c1C1CC1	ZINC001032723187	1341591770	/nfs/dbraw/zinc/59/17/70/1341591770.db2.gz	VGJWFHDIRBRPEV-IRXDYDNUSA-N	0	3	342.487	3.035	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C[C@@H]1CCc2ccccc2C1	ZINC001032751991	1341603149	/nfs/dbraw/zinc/60/31/49/1341603149.db2.gz	WMVBXFRUBJARIU-QMMLZNLJSA-N	0	3	338.495	3.433	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1csc2c1CCCC2	ZINC001032771336	1341609748	/nfs/dbraw/zinc/60/97/48/1341609748.db2.gz	XHLAKZGNJIKBTP-GJZGRUSLSA-N	0	3	330.497	3.492	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2cc(Cl)c(Cl)n2C)C1	ZINC001033131718	1341735925	/nfs/dbraw/zinc/73/59/25/1341735925.db2.gz	OMEBTDJJHDKYGB-NSHDSACASA-N	0	3	330.259	3.054	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)[C@@H]2CCCC[C@H]2C(F)(F)F)C1	ZINC001033160423	1341741514	/nfs/dbraw/zinc/74/15/14/1341741514.db2.gz	HBVUHLHHBZNPGK-RBSFLKMASA-N	0	3	332.410	3.464	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)C2CCc3ccccc3CC2)C1	ZINC001033214414	1341754104	/nfs/dbraw/zinc/75/41/04/1341754104.db2.gz	NFLUDHVVKQAIIU-FQEVSTJZSA-N	0	3	326.484	3.290	20	30		EGEDHN
C#CCCN1CC[C@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccc3ccccc3c2)C1	ZINC001033514229	1341853974	/nfs/dbraw/zinc/85/39/74/1341853974.db2.gz	ZYEQONUNGKHCCI-FDFHNCONSA-N	0	3	346.474	3.499	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2ccc(OC)c(C3CC3)c2)C1	ZINC001033535629	1341861886	/nfs/dbraw/zinc/86/18/86/1341861886.db2.gz	DDJOFEFRFWCOID-QGZVFWFLSA-N	0	3	328.456	3.295	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@@H]2CCN(Cc3ccc(C)cc3C)C2)nc1	ZINC001033595121	1341889550	/nfs/dbraw/zinc/88/95/50/1341889550.db2.gz	ATFZNPKUIHLEOW-HXUWFJFHSA-N	0	3	347.462	3.026	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@H]2CCN(Cc3ccc(C)c(C)c3)C2)cn1	ZINC001033598261	1341890803	/nfs/dbraw/zinc/89/08/03/1341890803.db2.gz	IIXWNEZKSCMLKD-NRFANRHFSA-N	0	3	347.462	3.026	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)C2CC(c3ccc(F)cc3)C2)C1	ZINC001033707684	1341969797	/nfs/dbraw/zinc/96/97/97/1341969797.db2.gz	OQENQUTVUFAMBW-FAFZWHIHSA-N	0	3	330.447	3.428	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2cccc(-n3cccc3)c2)C1	ZINC001033886892	1342059588	/nfs/dbraw/zinc/05/95/88/1342059588.db2.gz	CRSYKRMCLVTLET-HXUWFJFHSA-N	0	3	335.451	3.037	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cccc3c2O[C@@H](C)C3)C1	ZINC001033898995	1342070937	/nfs/dbraw/zinc/07/09/37/1342070937.db2.gz	FGPJXKCDMOJZCT-RDJZCZTQSA-N	0	3	328.456	3.123	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccc(Cl)c(OC)c2)C1	ZINC001033975263	1342124857	/nfs/dbraw/zinc/12/48/57/1342124857.db2.gz	DUTCKXNHVKDEJC-HNNXBMFYSA-N	0	3	336.863	3.461	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccc(Cl)c(OC)c2)C1	ZINC001033975264	1342124872	/nfs/dbraw/zinc/12/48/72/1342124872.db2.gz	DUTCKXNHVKDEJC-OAHLLOKOSA-N	0	3	336.863	3.461	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2)C1	ZINC001033983351	1342129561	/nfs/dbraw/zinc/12/95/61/1342129561.db2.gz	PZBKDDBDJGRQHO-CEXWTWQISA-N	0	3	344.886	3.390	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cncc(C(F)(F)F)c2)C1	ZINC001034008103	1342145925	/nfs/dbraw/zinc/14/59/25/1342145925.db2.gz	ZERJNJMRCRFLBN-HNNXBMFYSA-N	0	3	341.377	3.213	20	30		EGEDHN
C#Cc1ccc(C(=O)N(CC)[C@H]2CCN(Cc3cccc(C)c3)C2)nc1	ZINC001034012742	1342150218	/nfs/dbraw/zinc/15/02/18/1342150218.db2.gz	JAYAPICYKGKNAT-FQEVSTJZSA-N	0	3	347.462	3.108	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccc(COC)c(F)c2)C1	ZINC001034026847	1342165557	/nfs/dbraw/zinc/16/55/57/1342165557.db2.gz	WDLLAXUWHYUKSR-KRWDZBQOSA-N	0	3	334.435	3.085	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2ccc(C(C)(F)F)cc2)C1	ZINC001034057152	1342197671	/nfs/dbraw/zinc/19/76/71/1342197671.db2.gz	RKEUCIMIIMEIOV-QGZVFWFLSA-N	0	3	334.410	3.358	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@H]2CCN(C)c3ccccc32)C1	ZINC001034247886	1342346108	/nfs/dbraw/zinc/34/61/08/1342346108.db2.gz	VSPSGOLJGAXYLF-MJGOQNOKSA-N	0	3	341.499	3.157	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@H]2CCN(c3ccccc3)C2)C1	ZINC001034267842	1342359383	/nfs/dbraw/zinc/35/93/83/1342359383.db2.gz	ZCSNRYOKEFKBGQ-RBUKOAKNSA-N	0	3	341.499	3.060	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)c2cn(CC)c3ccccc23)C1	ZINC001034294861	1342378182	/nfs/dbraw/zinc/37/81/82/1342378182.db2.gz	BVGGQAVOWXRDDI-INIZCTEOSA-N	0	3	325.456	3.432	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc(C(F)(F)F)cn2)C1	ZINC001034334824	1342409416	/nfs/dbraw/zinc/40/94/16/1342409416.db2.gz	MZELRUJPVBHREA-CQSZACIVSA-N	0	3	341.377	3.261	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cccc(N3CC=CC3)c2)C1	ZINC001034415351	1342477245	/nfs/dbraw/zinc/47/72/45/1342477245.db2.gz	HCXWONQYMMIZTJ-LJQANCHMSA-N	0	3	339.483	3.223	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)c2cc(F)cc3cccnc32)C1	ZINC001034427708	1342490118	/nfs/dbraw/zinc/49/01/18/1342490118.db2.gz	IFJLQLYWAYJIJY-INIZCTEOSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cccc(OC(C)C)n2)C1	ZINC001034462757	1342518652	/nfs/dbraw/zinc/51/86/52/1342518652.db2.gz	MKCQMWCJKMYSOY-INIZCTEOSA-N	0	3	331.460	3.029	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCCN(Cc3cccc(C)c3)C2)cn1	ZINC001034494142	1342550147	/nfs/dbraw/zinc/55/01/47/1342550147.db2.gz	UNGZSJNYCSCTIH-NRFANRHFSA-N	0	3	347.462	3.156	20	30		EGEDHN
C[C@H]1C[C@H]1CC(=O)N[C@H]1CC[C@H](NCc2ccccc2C#N)CC1	ZINC001034724857	1342718488	/nfs/dbraw/zinc/71/84/88/1342718488.db2.gz	VTJAVVRAOXJIPX-QZHFEQFPSA-N	0	3	325.456	3.121	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)[C@@H]2CC23CCC3)CC1	ZINC001034746058	1342733858	/nfs/dbraw/zinc/73/38/58/1342733858.db2.gz	PSWKVCVSVYPZKS-IHRRRGAJSA-N	0	3	341.293	3.102	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)C[C@@H]2C=CCC2)c(F)c1	ZINC001034853737	1342805573	/nfs/dbraw/zinc/80/55/73/1342805573.db2.gz	IVYKGJUGCXYUMC-CRAIPNDOSA-N	0	3	341.430	3.134	20	30		EGEDHN
Cc1cscc1C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)s1	ZINC001034896079	1342825827	/nfs/dbraw/zinc/82/58/27/1342825827.db2.gz	VWYKJUYGNGYULE-CYBMUJFWSA-N	0	3	345.493	3.384	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)[C@@H]2CCCC23CC3)s1	ZINC001034971634	1342857737	/nfs/dbraw/zinc/85/77/37/1342857737.db2.gz	SETCNLVJRDEWSM-PBHICJAKSA-N	0	3	343.496	3.281	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)s1)C(C)(C)C	ZINC001034973093	1342858590	/nfs/dbraw/zinc/85/85/90/1342858590.db2.gz	LPKBMTYNMMKOIP-UONOGXRCSA-N	0	3	333.501	3.383	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]1CNCc1cc(F)ccc1OC	ZINC001035012777	1342874709	/nfs/dbraw/zinc/87/47/09/1342874709.db2.gz	MYDGHVNZJXKZPC-MRXNPFEDSA-N	0	3	334.435	3.127	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]1CNCc1cn(C(C)C)nc1C	ZINC001035014878	1342876655	/nfs/dbraw/zinc/87/66/55/1342876655.db2.gz	USZPNYKQNCNDLT-QGZVFWFLSA-N	0	3	332.492	3.065	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)s1	ZINC001035036206	1342889468	/nfs/dbraw/zinc/88/94/68/1342889468.db2.gz	YHQMASFUSMVIMO-RDTXWAMCSA-N	0	3	331.485	3.303	20	30		EGEDHN
CC(C)C1(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)cc2F)CC1	ZINC001035042325	1342894397	/nfs/dbraw/zinc/89/43/97/1342894397.db2.gz	ANJJQDXSDMSYSG-QGZVFWFLSA-N	0	3	343.446	3.214	20	30		EGEDHN
O=C(/C=C/C1CC1)N1CCC2(CCN(CC#Cc3ccccc3)C2)CC1	ZINC001035170495	1342986451	/nfs/dbraw/zinc/98/64/51/1342986451.db2.gz	QKZMAZCGHRTRCJ-ZHACJKMWSA-N	0	3	348.490	3.319	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cc1ccc(OC)cc1C)CC2	ZINC001035714558	1343147842	/nfs/dbraw/zinc/14/78/42/1343147842.db2.gz	SKEDPMJROGKRDT-UHFFFAOYSA-N	0	3	342.483	3.047	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C[C@@H]1CCC(F)(F)C1)CC2	ZINC001035718611	1343150679	/nfs/dbraw/zinc/15/06/79/1343150679.db2.gz	OGIDXVSODHIACS-HNNXBMFYSA-N	0	3	326.431	3.312	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1c(C)cc(C)nc1C)CC2	ZINC001035753068	1343170953	/nfs/dbraw/zinc/17/09/53/1343170953.db2.gz	LDUCULPEEQVVIR-UHFFFAOYSA-N	0	3	327.472	3.121	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)Cc1cccc(C3CC3)c1)CC2	ZINC001035755925	1343171785	/nfs/dbraw/zinc/17/17/85/1343171785.db2.gz	VATLYTSECWICDK-UHFFFAOYSA-N	0	3	336.479	3.054	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@]1(C)CCC(C)=C(C)C1)CC2	ZINC001035861425	1343236856	/nfs/dbraw/zinc/23/68/56/1343236856.db2.gz	HPCXIGYHRKWFCS-HXUWFJFHSA-N	0	3	328.500	3.461	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](NCc2ncc(C)s2)[C@@H](C)C1	ZINC001036138141	1343323326	/nfs/dbraw/zinc/32/33/26/1343323326.db2.gz	REYORLYSHFZCAG-DZGCQCFKSA-N	0	3	335.517	3.380	20	30		EGEDHN
CCC1(C(=O)N2CC[C@@H](NCc3ccccc3C#N)[C@H](C)C2)CCC1	ZINC001036160380	1343336366	/nfs/dbraw/zinc/33/63/66/1343336366.db2.gz	VGRAFWAXRBJKOY-VQIMIIECSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@@H](NCc1cc(F)ccc1C#N)[C@H]1CCCN(C(=O)CC2CC2)C1	ZINC001036344129	1343430652	/nfs/dbraw/zinc/43/06/52/1343430652.db2.gz	LXFCOAKMDZVXDO-PBHICJAKSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCCN(C(=O)/C=C/C2CC2)C1	ZINC001036389442	1343459613	/nfs/dbraw/zinc/45/96/13/1343459613.db2.gz	ROKJPGLAGINHIQ-LHZNOMQLSA-N	0	3	337.467	3.241	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@H](C)[C@@H]2CNCc2cnoc2C)CC1	ZINC001036574590	1343561191	/nfs/dbraw/zinc/56/11/91/1343561191.db2.gz	NXLGPRQCYKPHFN-KXBFYZLASA-N	0	3	345.487	3.446	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccc(F)c(C#N)c2)C1	ZINC001036628201	1343585595	/nfs/dbraw/zinc/58/55/95/1343585595.db2.gz	XQVVAEROHCHJQR-QFBILLFUSA-N	0	3	343.446	3.166	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccc(C#N)cc2F)C1	ZINC001036632322	1343589523	/nfs/dbraw/zinc/58/95/23/1343589523.db2.gz	LWQNPKDMSFKJSS-PKOBYXMFSA-N	0	3	341.430	3.086	20	30		EGEDHN
O=C(CC1CCC1)N1CC[C@H]2[C@H](CCN2CC#Cc2ccccc2)C1	ZINC001036677665	1343618036	/nfs/dbraw/zinc/61/80/36/1343618036.db2.gz	FOTHNISOSFCLPC-RTWAWAEBSA-N	0	3	336.479	3.151	20	30		EGEDHN
CC1(CC(=O)N2CC[C@@H]3[C@H](CCN3Cc3ccccc3C#N)C2)CC1	ZINC001036775754	1343705568	/nfs/dbraw/zinc/70/55/68/1343705568.db2.gz	ACCKGVPFFFUPGI-RTBURBONSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2[C@H](CCN2Cc2cc(C)ns2)C1	ZINC001036789191	1343718800	/nfs/dbraw/zinc/71/88/00/1343718800.db2.gz	NMAXUUDMIHEADC-GDBMZVCRSA-N	0	3	333.501	3.087	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2[C@@H](CCN2Cc2ocnc2C)C1	ZINC001036794504	1343726859	/nfs/dbraw/zinc/72/68/59/1343726859.db2.gz	WFZTTXYVNSOCPN-HOTGVXAUSA-N	0	3	331.460	3.008	20	30		EGEDHN
CC1(C(=O)N2CC[C@H]3[C@@H](CCN3Cc3ccccc3C#N)C2)CC=CC1	ZINC001036812815	1343749103	/nfs/dbraw/zinc/74/91/03/1343749103.db2.gz	MTWSHAXWNHBVAW-PMACEKPBSA-N	0	3	349.478	3.337	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]3[C@@H](CCN3Cc3oc(C)nc3C)C2)C1	ZINC001036815955	1343753822	/nfs/dbraw/zinc/75/38/22/1343753822.db2.gz	NQSKAXQXTDSNDS-DLBZAZTESA-N	0	3	343.471	3.071	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCC[C@H]2CNCc2nc(C)c(C)s2)C1	ZINC001037075128	1343968647	/nfs/dbraw/zinc/96/86/47/1343968647.db2.gz	LXPCEUJHKJEJPL-HOTGVXAUSA-N	0	3	347.528	3.491	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCCC[C@H]2CNCc2ocnc2C)CC1	ZINC001037237625	1344060839	/nfs/dbraw/zinc/06/08/39/1344060839.db2.gz	VQUSVSUOBYHGOC-ZWKOTPCHSA-N	0	3	345.487	3.494	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](NCc3nocc3C)[C@@H](CC)C2)C1	ZINC001037915773	1344176172	/nfs/dbraw/zinc/17/61/72/1344176172.db2.gz	RVAIQPGGIPIKMC-JKSUJKDBSA-N	0	3	331.460	3.056	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NC[C@@H]1CCN1CC1CC(C)(C)C1	ZINC001038427541	1344424132	/nfs/dbraw/zinc/42/41/32/1344424132.db2.gz	JMXFOSTUNJUBAQ-KRWDZBQOSA-N	0	3	342.483	3.492	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCN2C[C@@H]2CCCC(F)(F)C2)cc1	ZINC001038582679	1344493201	/nfs/dbraw/zinc/49/32/01/1344493201.db2.gz	QNDGEHCFMXYTPW-SJLPKXTDSA-N	0	3	346.421	3.298	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@H]2CCN2CCC2CCCCCC2)c1	ZINC001038684309	1344542109	/nfs/dbraw/zinc/54/21/09/1344542109.db2.gz	ITUULYAVUSKLRW-HXUWFJFHSA-N	0	3	339.483	3.228	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1cccc(N2CCCC2)c1	ZINC001038850442	1344610579	/nfs/dbraw/zinc/61/05/79/1344610579.db2.gz	SVLDIXIAKABGRE-LJQANCHMSA-N	0	3	327.472	3.057	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@]2(C)C=CCC2)CC[C@H]1c1ccc(F)cc1	ZINC001079157020	1357198070	/nfs/dbraw/zinc/19/80/70/1357198070.db2.gz	UTMFXZRABNETRH-QKNQBKEWSA-N	0	3	340.442	3.089	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C2(C(C)C)CC2)CC[C@H]1c1ccc(F)cc1	ZINC001079158040	1357198606	/nfs/dbraw/zinc/19/86/06/1357198606.db2.gz	OSWYOWZASBMKNI-RBUKOAKNSA-N	0	3	342.458	3.169	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)CC2(C)CCCC2)C[C@H]1c1cccc(F)c1	ZINC001079182453	1357203176	/nfs/dbraw/zinc/20/31/76/1357203176.db2.gz	JRWAIRMNQHPFOS-RBUKOAKNSA-N	0	3	342.458	3.313	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)c3ccc(C)n3C)CC2)C1	ZINC001039098596	1344770833	/nfs/dbraw/zinc/77/08/33/1344770833.db2.gz	RFRPHGCCPXDHQA-QGZVFWFLSA-N	0	3	349.906	3.260	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)[C@H](CC)SC)CC2)C1	ZINC001039119055	1344792594	/nfs/dbraw/zinc/79/25/94/1344792594.db2.gz	VMFOILYRGCRSCJ-CVEARBPZSA-N	0	3	344.952	3.441	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC([C@H]2CCN(CC=C(Cl)Cl)C2)CC1	ZINC001039127679	1344804818	/nfs/dbraw/zinc/80/48/18/1344804818.db2.gz	SDPMUDWMIDHKAO-OCCSQVGLSA-N	0	3	344.286	3.026	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)[C@]34C[C@H]3CCC4)CC2)C1	ZINC001039146927	1344830094	/nfs/dbraw/zinc/83/00/94/1344830094.db2.gz	SWHSKRPCXXSQJS-YQVWRLOYSA-N	0	3	336.907	3.490	20	30		EGEDHN
CC(C)C(=O)N1CCCC[C@@H]1[C@@H]1CCN(Cc2ccc(C#N)s2)C1	ZINC001039188885	1344891350	/nfs/dbraw/zinc/89/13/50/1344891350.db2.gz	FNAJOKTVZQPXNK-CRAIPNDOSA-N	0	3	345.512	3.479	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cccc(C)c2F)C1	ZINC001039210208	1344923183	/nfs/dbraw/zinc/92/31/83/1344923183.db2.gz	OPTCMDFSOHGJRZ-IEBWSBKVSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)Cc2c(C)cccc2C)C1	ZINC001039210001	1344923503	/nfs/dbraw/zinc/92/35/03/1344923503.db2.gz	MEJCDUPYXCQTKC-FPOVZHCZSA-N	0	3	338.495	3.182	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(C)c(C)cn2)C1	ZINC001039227019	1344946073	/nfs/dbraw/zinc/94/60/73/1344946073.db2.gz	ANZCYWSMCXBBNU-QUCCMNQESA-N	0	3	339.483	3.038	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2occ3c2CCC3)C1	ZINC001039229918	1344949232	/nfs/dbraw/zinc/94/92/32/1344949232.db2.gz	OZXDLJKJYKSKQL-LPHOPBHVSA-N	0	3	340.467	3.108	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc(C)c(C)s2)C1	ZINC001039238505	1344961951	/nfs/dbraw/zinc/96/19/51/1344961951.db2.gz	IQHRMAVPGGBZSS-IRXDYDNUSA-N	0	3	330.497	3.315	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccncc2Cl)C1	ZINC001039240808	1344965692	/nfs/dbraw/zinc/96/56/92/1344965692.db2.gz	YYVQSACMLVDIKG-QAPCUYQASA-N	0	3	345.874	3.075	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccccc2OC)C1	ZINC001039244326	1344972399	/nfs/dbraw/zinc/97/23/99/1344972399.db2.gz	IDCQCJRDTGOFQV-PKOBYXMFSA-N	0	3	340.467	3.035	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(Cl)cc2)C1	ZINC001039247590	1344976853	/nfs/dbraw/zinc/97/68/53/1344976853.db2.gz	XLZCIOPXVJBOAO-AEFFLSMTSA-N	0	3	330.859	3.290	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc(CC)c(CC)o2)C1	ZINC001039247563	1344976862	/nfs/dbraw/zinc/97/68/62/1344976862.db2.gz	XDJDDBFAJURFJW-ROUUACIJSA-N	0	3	342.483	3.354	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)Cc2ccc(F)cc2)C1	ZINC001039248284	1344978265	/nfs/dbraw/zinc/97/82/65/1344978265.db2.gz	AXXJATVSFQWXQD-AZUAARDMSA-N	0	3	342.458	3.095	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc3c(s2)CCC3)C1	ZINC001039249237	1344979279	/nfs/dbraw/zinc/97/92/79/1344979279.db2.gz	HGYBKWUEMISLKJ-IRXDYDNUSA-N	0	3	342.508	3.187	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ncccc2Cl)C1	ZINC001039249989	1344980562	/nfs/dbraw/zinc/98/05/62/1344980562.db2.gz	LFKGSILYMCUTRF-RDJZCZTQSA-N	0	3	345.874	3.075	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)Cc2ccc(C)s2)C1	ZINC001039250411	1344981612	/nfs/dbraw/zinc/98/16/12/1344981612.db2.gz	KHNUYBPDPGLQOR-PKOBYXMFSA-N	0	3	344.524	3.325	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2c(C)nsc2C)C1	ZINC001039251904	1344983660	/nfs/dbraw/zinc/98/36/60/1344983660.db2.gz	WQAONAHWRCLSKB-IAGOWNOFSA-N	0	3	345.512	3.100	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C(C)(C)[C@H]1CCCCO1	ZINC001039375925	1345033928	/nfs/dbraw/zinc/03/39/28/1345033928.db2.gz	DHUTWAREWSSMNH-FGTMMUONSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(C(F)F)nc1	ZINC001039384525	1345038263	/nfs/dbraw/zinc/03/82/63/1345038263.db2.gz	ZKDPLPBIEKTOGO-CABCVRRESA-N	0	3	335.398	3.274	20	30		EGEDHN
C=CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1oc(C2CC2)nc1C	ZINC001039448547	1345073334	/nfs/dbraw/zinc/07/33/34/1345073334.db2.gz	UUQNEZMJDRXFKM-CVEARBPZSA-N	0	3	329.444	3.115	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1c(F)cccc1Cl	ZINC001039461672	1345080227	/nfs/dbraw/zinc/08/02/27/1345080227.db2.gz	CZNWXDLSCOJUGR-KGLIPLIRSA-N	0	3	334.822	3.181	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)CC[C@H]1CC(C)(C)CO1	ZINC001039464522	1345082246	/nfs/dbraw/zinc/08/22/46/1345082246.db2.gz	LNHSWXMGBXZIIW-SQNIBIBYSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc(OCC)cc1	ZINC001039466126	1345084426	/nfs/dbraw/zinc/08/44/26/1345084426.db2.gz	UAQXZXNKGBLDJH-MOPGFXCFSA-N	0	3	342.483	3.269	20	30		EGEDHN
O=C(C#CC1CC1)N1C[C@H]2CCC[C@@H](C1)N2CC1CCC2(CC2)CC1	ZINC001039578752	1345145116	/nfs/dbraw/zinc/14/51/16/1345145116.db2.gz	AQZNQSWXBZXZBB-BGYRXZFFSA-N	0	3	340.511	3.436	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@@]2(C1)CCCN(Cc1cccc(C#N)c1)C2	ZINC001040051646	1345313150	/nfs/dbraw/zinc/31/31/50/1345313150.db2.gz	XAMQMIHYPQOZNX-NRFANRHFSA-N	0	3	337.467	3.339	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CC[C@@]2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001040084247	1345329517	/nfs/dbraw/zinc/32/95/17/1345329517.db2.gz	RZADBQAHAKTBQG-UTKZUKDTSA-N	0	3	339.483	3.419	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3c(C)noc3C(F)F)C2)C1	ZINC001040254097	1345397071	/nfs/dbraw/zinc/39/70/71/1345397071.db2.gz	MTZJRPDSNYHCDJ-KRWDZBQOSA-N	0	3	339.386	3.035	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cnoc3-c3ccco3)C2)C1	ZINC001040263630	1345402365	/nfs/dbraw/zinc/40/23/65/1345402365.db2.gz	GQWBZIJGQIYYLJ-IBGZPJMESA-N	0	3	341.411	3.049	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3ccsc3COC)C2)C1	ZINC001040263718	1345402521	/nfs/dbraw/zinc/40/25/21/1345402521.db2.gz	HPNFGRPAQWYNBL-SFHVURJKSA-N	0	3	334.485	3.009	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cccc(C(C)C)n3)C2)C1	ZINC001040283729	1345411591	/nfs/dbraw/zinc/41/15/91/1345411591.db2.gz	PVXKRZUBFYCXBO-OAQYLSRUSA-N	0	3	339.483	3.156	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cc(-c4ccco4)on3)C2)C1	ZINC001040318618	1345429134	/nfs/dbraw/zinc/42/91/34/1345429134.db2.gz	WAEMPNYJFTZPEB-LJQANCHMSA-N	0	3	341.411	3.049	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cc(C)cc(F)c3)C2)C1	ZINC001040416501	1345485275	/nfs/dbraw/zinc/48/52/75/1345485275.db2.gz	WMOMZJDJBSFUPY-FQEVSTJZSA-N	0	3	328.431	3.086	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cccc(OCC)c3)C2)C1	ZINC001040423397	1345489436	/nfs/dbraw/zinc/48/94/36/1345489436.db2.gz	UDUWRYWCJKYXNE-OAQYLSRUSA-N	0	3	340.467	3.037	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ccc4cnccc4c3)C2)C1	ZINC001040485182	1345516117	/nfs/dbraw/zinc/51/61/17/1345516117.db2.gz	XOOIGKJMLAXXAH-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ccoc3CCC)C2)C1	ZINC001040492382	1345518257	/nfs/dbraw/zinc/51/82/57/1345518257.db2.gz	QPLVMOGWIKHSCB-FQEVSTJZSA-N	0	3	328.456	3.184	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)C[C@@H](C)c3ccco3)C2)C1	ZINC001040493460	1345518724	/nfs/dbraw/zinc/51/87/24/1345518724.db2.gz	LIPJJSBHBYYXLN-XLIONFOSSA-N	0	3	328.456	3.111	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)C3(C4CCCCC4)CC3)C2)C1	ZINC001040509210	1345526071	/nfs/dbraw/zinc/52/60/71/1345526071.db2.gz	FNTGASHLQSOUPA-HXUWFJFHSA-N	0	3	328.500	3.295	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cc(Cl)ccc3OC)C2)C1	ZINC001040518526	1345529469	/nfs/dbraw/zinc/52/94/69/1345529469.db2.gz	AYDGLKQFAYNFHN-IBGZPJMESA-N	0	3	348.874	3.463	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)C(C)(C)c3ccccc3)C2)C1	ZINC001040521157	1345531083	/nfs/dbraw/zinc/53/10/83/1345531083.db2.gz	WZCVKHFFUDIDLG-QFIPXVFZSA-N	0	3	338.495	3.302	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3ccc4[nH]c(C)c(C)c4c3)C2)C1	ZINC001040524976	1345533024	/nfs/dbraw/zinc/53/30/24/1345533024.db2.gz	PIIQVXGBGWOCCE-JOCHJYFZSA-N	0	3	349.478	3.346	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cccn3C(C)C)C2)C1	ZINC001040534796	1345535352	/nfs/dbraw/zinc/53/53/52/1345535352.db2.gz	MLRCUJGLQJJRIY-FQEVSTJZSA-N	0	3	327.472	3.020	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cccn3C(C)C)C2)C1	ZINC001040534798	1345535499	/nfs/dbraw/zinc/53/54/99/1345535499.db2.gz	MLRCUJGLQJJRIY-HXUWFJFHSA-N	0	3	327.472	3.020	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)C3(C)C(C)(C)C3(C)C)C2)C1	ZINC001040551766	1345543499	/nfs/dbraw/zinc/54/34/99/1345543499.db2.gz	QTFBERZMFOYJPI-NRFANRHFSA-N	0	3	330.516	3.397	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC2(C1)CCN(Cc1scnc1C)CC2	ZINC001040803172	1345579880	/nfs/dbraw/zinc/57/98/80/1345579880.db2.gz	ZTQIJCACXHDOLD-UHFFFAOYSA-N	0	3	347.528	3.478	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)C[C@H]3CCCC3(F)F)C2)CC1	ZINC001040821462	1345583115	/nfs/dbraw/zinc/58/31/15/1345583115.db2.gz	HBCYFHHANLRXJT-MRXNPFEDSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@@H](C)c3cccc(C)c3)C2)CC1	ZINC001040867384	1345590390	/nfs/dbraw/zinc/59/03/90/1345590390.db2.gz	DOISYCKZXLOINT-IBGZPJMESA-N	0	3	338.495	3.436	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@@H]3C[C@H]3c3ccccc3C)C2)CC1	ZINC001040882206	1345593607	/nfs/dbraw/zinc/59/36/07/1345593607.db2.gz	ANCFULCDYMEEQA-VQTJNVASSA-N	0	3	336.479	3.046	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@@H]3C[C@H]3c3cccc(C)c3)C2)CC1	ZINC001040883449	1345594132	/nfs/dbraw/zinc/59/41/32/1345594132.db2.gz	UAGYJFVEERKABK-VQTJNVASSA-N	0	3	336.479	3.046	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)CCc3ccc(CC)cc3)C2)CC1	ZINC001040936069	1345605176	/nfs/dbraw/zinc/60/51/76/1345605176.db2.gz	TWFJZTHLQFUCEO-UHFFFAOYSA-N	0	3	338.495	3.129	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@@H](C)Cc3ccc(C)cc3)C2)CC1	ZINC001040947891	1345607774	/nfs/dbraw/zinc/60/77/74/1345607774.db2.gz	HQJYNIHDKRNHIF-IBGZPJMESA-N	0	3	338.495	3.121	20	30		EGEDHN
CC(C)(C)CC(=O)N1CC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001041071986	1345644817	/nfs/dbraw/zinc/64/48/17/1345644817.db2.gz	GFBZEYGYTUWKBT-OAQYLSRUSA-N	0	3	339.483	3.419	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@]2(CCN(C/C=C\c3ccccc3)C2)C1	ZINC001041273557	1345691581	/nfs/dbraw/zinc/69/15/81/1345691581.db2.gz	OBEFSJODVOTRRI-FDQBOKQBSA-N	0	3	334.463	3.038	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)[C@@H](c3ccccc3)C3CC3)C2)C1	ZINC001041463631	1345735379	/nfs/dbraw/zinc/73/53/79/1345735379.db2.gz	IEKXVLWIWDMQJO-UNMCSNQZSA-N	0	3	336.479	3.128	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccc(C)c4cccnc34)C2)C1	ZINC001041484193	1345742013	/nfs/dbraw/zinc/74/20/13/1345742013.db2.gz	WGOJCZKGYKVMKW-JOCHJYFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@]2(CCN(CCc3csc(C)n3)C2)C1	ZINC001041543337	1345757973	/nfs/dbraw/zinc/75/79/73/1345757973.db2.gz	IRHVUVWUIDOHLL-LJQANCHMSA-N	0	3	347.528	3.131	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3c(Cl)oc4ccccc43)C2)C1	ZINC001041584506	1345782254	/nfs/dbraw/zinc/78/22/54/1345782254.db2.gz	AHDPHSIQULTWFN-IBGZPJMESA-N	0	3	342.826	3.257	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@]2(CCN(Cc3cnccc3C)C2)C1	ZINC001041625703	1345800139	/nfs/dbraw/zinc/80/01/39/1345800139.db2.gz	KKWIUZRNPHJRCU-LEWJYISDSA-N	0	3	341.499	3.417	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccc(Cl)c(C)c3)C2)C1	ZINC001041625473	1345800221	/nfs/dbraw/zinc/80/02/21/1345800221.db2.gz	IJMXQSWWEDGVEU-IBGZPJMESA-N	0	3	330.859	3.210	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@]3(CCN(Cc4cccnc4)C3)C2)CC1	ZINC001041635258	1345804875	/nfs/dbraw/zinc/80/48/75/1345804875.db2.gz	KLJXRWAAOYRMRN-OAQYLSRUSA-N	0	3	339.483	3.252	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@]3(CCN(Cc4scnc4C)C3)C2)C1	ZINC001041658569	1345814058	/nfs/dbraw/zinc/81/40/58/1345814058.db2.gz	YKWRICUIEJWLPC-IBGZPJMESA-N	0	3	345.512	3.232	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@]3(CCN(C(=O)[C@@H]4CC45CCC5)C3)C2)cc1	ZINC001041713126	1345828454	/nfs/dbraw/zinc/82/84/54/1345828454.db2.gz	CWYXPYLDNPGTHL-FPOVZHCZSA-N	0	3	349.478	3.173	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cc4cc(F)ccc4o3)C2)C1	ZINC001041716136	1345828908	/nfs/dbraw/zinc/82/89/08/1345828908.db2.gz	OWFNZTUEYGSSQN-HXUWFJFHSA-N	0	3	340.398	3.133	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)C[C@H](C)c3ccccc3C)C2)C1	ZINC001041724043	1345832447	/nfs/dbraw/zinc/83/24/47/1345832447.db2.gz	MQJYTOSVXJXZRY-SIKLNZKXSA-N	0	3	338.495	3.436	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)[C@@H]3C[C@H]3c3cccc(Cl)c3)C2)C1	ZINC001041730085	1345834874	/nfs/dbraw/zinc/83/48/74/1345834874.db2.gz	IZQQPIIUTTWKCY-NLWGTHIKSA-N	0	3	342.870	3.001	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@]3(CCN(C(=O)[C@@H]4C[C@H]4C4CC4)C3)C2)c1	ZINC001041731990	1345834928	/nfs/dbraw/zinc/83/49/28/1345834928.db2.gz	COHZDBZAKFVVAW-TUNNFDKTSA-N	0	3	349.478	3.029	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccc(C(F)F)cc3)C2)C1	ZINC001041739926	1345837574	/nfs/dbraw/zinc/83/75/74/1345837574.db2.gz	ACADGVOZHASAAB-LJQANCHMSA-N	0	3	332.394	3.186	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)C(C)(C)c3ccccc3Cl)C2)C1	ZINC001041793317	1345851995	/nfs/dbraw/zinc/85/19/95/1345851995.db2.gz	JAXFQUFTBZHSAF-FQEVSTJZSA-N	0	3	344.886	3.175	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)Cc3ccc4ccccc4c3)C2)C1	ZINC001041821020	1345863318	/nfs/dbraw/zinc/86/33/18/1345863318.db2.gz	CAJKRWMTDMJANX-QHCPKHFHSA-N	0	3	346.474	3.330	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3CCN(C(=O)c4ccccc4)C[C@@H]32)cc1	ZINC001041906525	1345890917	/nfs/dbraw/zinc/89/09/17/1345890917.db2.gz	KJMCAGUMSUDBBI-FPOVZHCZSA-N	0	3	345.446	3.295	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3CCN(C(=O)CC4CCC4)C[C@H]32)cc1	ZINC001041998257	1345917664	/nfs/dbraw/zinc/91/76/64/1345917664.db2.gz	XFHFKUHRUNQFSX-VQTJNVASSA-N	0	3	337.467	3.171	20	30		EGEDHN
CC(C(=O)N1CC[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@@H]2C1)=C1CCC1	ZINC001042054755	1345932400	/nfs/dbraw/zinc/93/24/00/1345932400.db2.gz	LXQOVRRBUONLOE-LEWJYISDSA-N	0	3	349.478	3.481	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(F)cc4ccncc43)C[C@H]21	ZINC001042065184	1345933843	/nfs/dbraw/zinc/93/38/43/1345933843.db2.gz	PWLFABCHFDIVBB-AUUYWEPGSA-N	0	3	339.414	3.096	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3ccn(C4CCCC4)n3)C[C@@H]21	ZINC001042079340	1345939490	/nfs/dbraw/zinc/93/94/90/1345939490.db2.gz	CAXJQMJORGAIAG-LPHOPBHVSA-N	0	3	342.487	3.111	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3c(C)noc3C(C)C)C[C@H]21	ZINC001042100454	1345943852	/nfs/dbraw/zinc/94/38/52/1345943852.db2.gz	GCZJKPKJBJHKJE-HZPDHXFCSA-N	0	3	331.460	3.219	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)Cc3ccc(C)c(Cl)c3)C[C@@H]21	ZINC001042114478	1345947457	/nfs/dbraw/zinc/94/74/57/1345947457.db2.gz	KTUTTZDWKKHLQS-HKUYNNGSSA-N	0	3	344.886	3.137	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cnc4c(F)cccc4c3)C[C@H]21	ZINC001042153500	1345957664	/nfs/dbraw/zinc/95/76/64/1345957664.db2.gz	SUGOZBVMSGQWKZ-KBXCAEBGSA-N	0	3	339.414	3.096	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cc(C)cc(Cl)c3)C[C@H]21	ZINC001042156453	1345958920	/nfs/dbraw/zinc/95/89/20/1345958920.db2.gz	JCSNOTGGWAQSMF-CRAIPNDOSA-N	0	3	330.859	3.208	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)CCc3ccc(Cl)cc3)C[C@H]21	ZINC001042168431	1345963672	/nfs/dbraw/zinc/96/36/72/1345963672.db2.gz	UZDCJESPMBZXAC-IEBWSBKVSA-N	0	3	344.886	3.219	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)CCc3cccc(Cl)c3)C[C@@H]21	ZINC001042168277	1345963882	/nfs/dbraw/zinc/96/38/82/1345963882.db2.gz	UOAPFGCVKKEXKQ-MJGOQNOKSA-N	0	3	344.886	3.219	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2CCN(Cc3cnccc3C)[C@@H]2C1	ZINC001042182169	1345969990	/nfs/dbraw/zinc/96/99/90/1345969990.db2.gz	CJEAFHHGXVIGSE-IEBWSBKVSA-N	0	3	341.499	3.415	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2CCN(CCC(F)(F)F)[C@@H]2C1	ZINC001042183754	1345971333	/nfs/dbraw/zinc/97/13/33/1345971333.db2.gz	MGZGLHJNEVGQEA-ZIAGYGMSSA-N	0	3	332.410	3.464	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3sc(C)nc3C)[C@H]2C1	ZINC001042183538	1345971428	/nfs/dbraw/zinc/97/14/28/1345971428.db2.gz	KYHIOFXEWMIWQK-CVEARBPZSA-N	0	3	347.528	3.395	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3c(C)cc(F)cc3C)C[C@H]21	ZINC001042184006	1345972119	/nfs/dbraw/zinc/97/21/19/1345972119.db2.gz	SHMLDWVVTYMLEM-SJLPKXTDSA-N	0	3	328.431	3.002	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2CCN(CCc3ccns3)[C@H]2C1	ZINC001042185576	1345972688	/nfs/dbraw/zinc/97/26/88/1345972688.db2.gz	VFDTTWVOAVAXEM-WBVHZDCISA-N	0	3	347.528	3.211	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3c(F)cc(F)cc3F)C[C@H]21	ZINC001042207523	1345985354	/nfs/dbraw/zinc/98/53/54/1345985354.db2.gz	PCPLGQILJZPQOD-BLLLJJGKSA-N	0	3	338.373	3.216	20	30		EGEDHN
CC1(C(=O)N2CC[C@H]3CCN(Cc4ccc(C#N)cc4)[C@@H]3C2)CC=CC1	ZINC001042220834	1345992097	/nfs/dbraw/zinc/99/20/97/1345992097.db2.gz	GBLBIKWVMREHEY-WOJBJXKFSA-N	0	3	349.478	3.337	20	30		EGEDHN
C#CCN1CC[C@H]2CCN(C(=O)Cc3ccc(C(C)(C)C)cc3)C[C@@H]21	ZINC001042247261	1346004361	/nfs/dbraw/zinc/00/43/61/1346004361.db2.gz	NLFGMIHQXIWMIU-ICSRJNTNSA-N	0	3	338.495	3.083	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(C)c(OCC)c3)C[C@@H]21	ZINC001042256814	1346007996	/nfs/dbraw/zinc/00/79/96/1346007996.db2.gz	ZZUSYTUQRXFHLP-AEFFLSMTSA-N	0	3	328.456	3.116	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3ccn(C(CC)CC)n3)C[C@@H]21	ZINC001042257217	1346008486	/nfs/dbraw/zinc/00/84/86/1346008486.db2.gz	FHWOAQSIGODZPL-LPHOPBHVSA-N	0	3	344.503	3.357	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3ccn(C(CC)CC)n3)C[C@@H]21	ZINC001042257216	1346008503	/nfs/dbraw/zinc/00/85/03/1346008503.db2.gz	FHWOAQSIGODZPL-APWZRJJASA-N	0	3	344.503	3.357	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cccc(N4CCCC4)c3)C[C@H]21	ZINC001042286763	1346018010	/nfs/dbraw/zinc/01/80/10/1346018010.db2.gz	CLQJLEXPGZQWRQ-FXAWDEMLSA-N	0	3	339.483	3.009	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cccc(C(F)F)c3)C[C@@H]21	ZINC001042316402	1346030884	/nfs/dbraw/zinc/03/08/84/1346030884.db2.gz	LRHCRTPRSQUWHK-PBHICJAKSA-N	0	3	332.394	3.184	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccccc3OC(C)C)C[C@H]21	ZINC001042320531	1346031502	/nfs/dbraw/zinc/03/15/02/1346031502.db2.gz	RTUXTYVXYHTUJE-SJLPKXTDSA-N	0	3	328.456	3.196	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3cc(C4CCCC4)no3)C[C@@H]21	ZINC001042363469	1346057403	/nfs/dbraw/zinc/05/74/03/1346057403.db2.gz	UIGZFXHHSAMMSI-AEFFLSMTSA-N	0	3	343.471	3.445	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)CC3C4CC5CC(C4)CC3C5)C[C@@H]21	ZINC001042366839	1346058814	/nfs/dbraw/zinc/05/88/14/1346058814.db2.gz	YJKSWHMKAVUOGZ-RHQGADHGSA-N	0	3	340.511	3.005	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3sccc3C(C)C)C[C@@H]21	ZINC001042368275	1346059172	/nfs/dbraw/zinc/05/91/72/1346059172.db2.gz	OYNFTUDYWIYMSR-WBVHZDCISA-N	0	3	330.497	3.431	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc(-c4ccccc4)[nH]3)C[C@@H]21	ZINC001042373483	1346061867	/nfs/dbraw/zinc/06/18/67/1346061867.db2.gz	GPHFLTOHTHFTPL-RXVVDRJESA-N	0	3	347.462	3.241	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C(C)(C)c3ccccc3C)C[C@H]21	ZINC001042380182	1346065618	/nfs/dbraw/zinc/06/56/18/1346065618.db2.gz	RYEBPHHWPDJQNZ-PKOBYXMFSA-N	0	3	326.484	3.381	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C(C)(C)c3ccccc3OC)C[C@H]21	ZINC001042385727	1346066698	/nfs/dbraw/zinc/06/66/98/1346066698.db2.gz	VPWPQWICNWDCTP-SJLPKXTDSA-N	0	3	342.483	3.082	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC[C@H]1CNCc1cc(Cl)ccc1Cl	ZINC001044961771	1346470263	/nfs/dbraw/zinc/47/02/63/1346470263.db2.gz	UDQYHKAPBWUXQQ-FZMZJTMJSA-N	0	3	340.254	3.234	20	30		EGEDHN
Cc1csc(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)s2)c1	ZINC001045026796	1346482674	/nfs/dbraw/zinc/48/26/74/1346482674.db2.gz	OJNCJGSPQHYTNV-ZDUSSCGKSA-N	0	3	345.493	3.384	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H]1CNCc1ccc(C#N)cc1F)C1CCC1	ZINC001045087632	1346492429	/nfs/dbraw/zinc/49/24/29/1346492429.db2.gz	NYPFYLYDBZSFAJ-KDOFPFPSSA-N	0	3	343.446	3.214	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2F)CC1	ZINC001045510989	1346613462	/nfs/dbraw/zinc/61/34/62/1346613462.db2.gz	QQOOUJRWORBXQP-DLBZAZTESA-N	0	3	346.421	3.062	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2F)CC1	ZINC001045513164	1346614289	/nfs/dbraw/zinc/61/42/89/1346614289.db2.gz	HDFVBWAURCLBBD-JKSUJKDBSA-N	0	3	334.410	3.225	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2ncc(Cl)cc2Cl)CC1	ZINC001045600464	1346641321	/nfs/dbraw/zinc/64/13/21/1346641321.db2.gz	RQWNBKFBQNMBDY-UHFFFAOYSA-N	0	3	328.243	3.159	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)[C@H]2CCCCc3ccccc32)CC1	ZINC001045647622	1346658432	/nfs/dbraw/zinc/65/84/32/1346658432.db2.gz	NBSOEQOIAJEOSY-FQEVSTJZSA-N	0	3	338.495	3.491	20	30		EGEDHN
C[C@@]1(C(=O)N2CC[C@H]3CC[C@@H](C2)N3Cc2cccc(C#N)c2)C=CCC1	ZINC001045829429	1346712079	/nfs/dbraw/zinc/71/20/79/1346712079.db2.gz	AAOFSJFGVKZWEA-RZUBCFFCSA-N	0	3	349.478	3.480	20	30		EGEDHN
C=C(C)C[N@@H+]1CC[C@]2(C1)CCCCN(C(=O)c1ccccc1[O-])C2	ZINC001045918529	1346755476	/nfs/dbraw/zinc/75/54/76/1346755476.db2.gz	LHCZNCDMFWCTQN-FQEVSTJZSA-N	0	3	328.456	3.287	20	30		EGEDHN
C=C(C)C[N@H+]1CC[C@]2(C1)CCCCN(C(=O)c1ccccc1[O-])C2	ZINC001045918529	1346755478	/nfs/dbraw/zinc/75/54/78/1346755478.db2.gz	LHCZNCDMFWCTQN-FQEVSTJZSA-N	0	3	328.456	3.287	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@H]1[C@@H]3CCCC[C@@H]31)C2	ZINC001045926826	1346762829	/nfs/dbraw/zinc/76/28/29/1346762829.db2.gz	LEZZTSVMGPLIHO-PXCRPINLSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cccc(C)c1F)C2	ZINC001045940124	1346775558	/nfs/dbraw/zinc/77/55/58/1346775558.db2.gz	QXJMAUVROPRHLB-HXUWFJFHSA-N	0	3	328.431	3.086	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1c(C)oc(C)c1C)C2	ZINC001045950892	1346785854	/nfs/dbraw/zinc/78/58/54/1346785854.db2.gz	OBTIRKJFXPOZBY-HXUWFJFHSA-N	0	3	328.456	3.156	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H](C)c1ccco1)C2	ZINC001045965419	1346800279	/nfs/dbraw/zinc/80/02/79/1346800279.db2.gz	HAXFOJYFOZHIMN-PXNSSMCTSA-N	0	3	328.456	3.111	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1csc(Cl)c1)C2	ZINC001045971009	1346806845	/nfs/dbraw/zinc/80/68/45/1346806845.db2.gz	KZFBVWCECMLGAJ-QGZVFWFLSA-N	0	3	336.888	3.353	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H](C)c1ccc(C)o1)C2	ZINC001045971602	1346807742	/nfs/dbraw/zinc/80/77/42/1346807742.db2.gz	QWRVJXPILZULFG-PXNSSMCTSA-N	0	3	328.456	3.029	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc([C@@H](C)CC)no1)C2	ZINC001045972447	1346808840	/nfs/dbraw/zinc/80/88/40/1346808840.db2.gz	AXWGKBZFNUTFQX-OXJNMPFZSA-N	0	3	343.471	3.140	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cccc3ccncc31)C2	ZINC001045977734	1346813958	/nfs/dbraw/zinc/81/39/58/1346813958.db2.gz	HJRMUUZTGYPPEC-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H](C)Cc1ccccc1)C2	ZINC001045986647	1346828356	/nfs/dbraw/zinc/82/83/56/1346828356.db2.gz	WXHLOMITWQDTSA-SIKLNZKXSA-N	0	3	338.495	3.203	20	30		EGEDHN
C#CCCN1CC[C@@](C)(NC(=O)c2csc3cc(C)ccc23)C1	ZINC001046354975	1346947691	/nfs/dbraw/zinc/94/76/91/1346947691.db2.gz	IAJMXIXJYCCNHZ-LJQANCHMSA-N	0	3	326.465	3.427	20	30		EGEDHN
C#CCCN1CC[C@@](C)(NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)s2)C1	ZINC001046569485	1347022185	/nfs/dbraw/zinc/02/21/85/1347022185.db2.gz	ZHYQPTZPMHALDN-PBFPGSCMSA-N	0	3	336.888	3.109	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@]2(C)CCN(Cc3ccc(CC)cc3)C2)c1	ZINC001046605238	1347036190	/nfs/dbraw/zinc/03/61/90/1347036190.db2.gz	QRHGLUKOCATRMU-QFIPXVFZSA-N	0	3	347.462	3.020	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@]2(C)CCN(Cc3ccc(C)cc3C)C2)nc1	ZINC001046783764	1347098254	/nfs/dbraw/zinc/09/82/54/1347098254.db2.gz	SZFGHZOKJWOAFF-JOCHJYFZSA-N	0	3	347.462	3.074	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2c(C)nsc2C)C1	ZINC001046996656	1347179373	/nfs/dbraw/zinc/17/93/73/1347179373.db2.gz	WLRKSAZOFJZTAS-CYBMUJFWSA-N	0	3	343.443	3.023	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3sccc3C)C2)CC1	ZINC001047214642	1347246823	/nfs/dbraw/zinc/24/68/23/1347246823.db2.gz	FCPUKFILGCBYPC-QGZVFWFLSA-N	0	3	330.497	3.254	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)c3csnc3C)C2)CC1	ZINC001047234700	1347262942	/nfs/dbraw/zinc/26/29/42/1347262942.db2.gz	PDGJQAGEPQVKBB-KRWDZBQOSA-N	0	3	345.512	3.039	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)[C@H](C)C3CCC3)C2)CC1	ZINC001047243288	1347269223	/nfs/dbraw/zinc/26/92/23/1347269223.db2.gz	JSMAZUXHAYGVQC-YLJYHZDGSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)C3(F)CCCC3)C2)CC1	ZINC001047246104	1347271279	/nfs/dbraw/zinc/27/12/79/1347271279.db2.gz	IQGSCMXLVBGDQY-GOSISDBHSA-N	0	3	334.479	3.243	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3ccccc3CC)C2)CC1	ZINC001047247570	1347273163	/nfs/dbraw/zinc/27/31/63/1347273163.db2.gz	GZJJDJLHJUTAPF-FQEVSTJZSA-N	0	3	338.495	3.446	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@@H](C)c3ccsc3)C2)CC1	ZINC001047253873	1347277566	/nfs/dbraw/zinc/27/75/66/1347277566.db2.gz	JRXGKLMXAWRHAM-FUHWJXTLSA-N	0	3	344.524	3.435	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)C[C@H](C)c3ccco3)C2)CC1	ZINC001047263165	1347284394	/nfs/dbraw/zinc/28/43/94/1347284394.db2.gz	ATYLWGANSNEDNK-PKOBYXMFSA-N	0	3	342.483	3.357	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@@H]([C@@H](C)NCc3ccccc3C#N)C2)co1	ZINC001047815191	1347380333	/nfs/dbraw/zinc/38/03/33/1347380333.db2.gz	OBFBBULVSBCXSG-CRAIPNDOSA-N	0	3	337.423	3.100	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]([C@H](C)NCc2cc(C3CC3)no2)C1	ZINC001047924105	1347411308	/nfs/dbraw/zinc/41/13/08/1347411308.db2.gz	LLXOEHZARAEZAG-HOCLYGCPSA-N	0	3	345.487	3.481	20	30		EGEDHN
C[C@@H](NCc1cc(F)ccc1C#N)[C@@H]1CCN(C(=O)C(C)(C)C)C1	ZINC001048039134	1347447644	/nfs/dbraw/zinc/44/76/44/1347447644.db2.gz	ZPZCNQCDCKEUFE-UKRRQHHQSA-N	0	3	331.435	3.070	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H](C)[C@@H](CNCc2nc(C)c(C)s2)C1	ZINC001048341195	1347523592	/nfs/dbraw/zinc/52/35/92/1347523592.db2.gz	YSPPWLRDSGDIKX-WFASDCNBSA-N	0	3	335.517	3.156	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H](C)[C@@H](CNCc2nc3ccccc3o2)C1	ZINC001048346509	1347525751	/nfs/dbraw/zinc/52/57/51/1347525751.db2.gz	YSZQNDJQDLIXBG-GJZGRUSLSA-N	0	3	341.455	3.224	20	30		EGEDHN
C[C@H]1C[C@H]1C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccc(C#N)s1	ZINC001048499624	1347569311	/nfs/dbraw/zinc/56/93/11/1347569311.db2.gz	RXBDQMZYHZKHLG-PYOGLGTISA-N	0	3	343.496	3.135	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)C2CCCC2)c1	ZINC001049282183	1347768840	/nfs/dbraw/zinc/76/88/40/1347768840.db2.gz	WLLZOMXGSLOVHY-WOJBJXKFSA-N	0	3	337.467	3.314	20	30		EGEDHN
C/C(=C/C(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1ccc(C#N)cc1)C1CC1	ZINC001049351607	1347801428	/nfs/dbraw/zinc/80/14/28/1347801428.db2.gz	LYDRVKAVUCWMCG-IDBNTSCLSA-N	0	3	349.478	3.480	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@H]2[C@H]1CCN2Cc1ccc(CF)cc1	ZINC001049466892	1347863386	/nfs/dbraw/zinc/86/33/86/1347863386.db2.gz	LGLJJJRDPAROFP-VQTJNVASSA-N	0	3	340.442	3.135	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cccc2scnc21	ZINC001049468264	1347864002	/nfs/dbraw/zinc/86/40/02/1347864002.db2.gz	GXPVSCLIXWMDGL-LSDHHAIUSA-N	0	3	327.453	3.161	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1nsc2ccccc21	ZINC001049494006	1347875920	/nfs/dbraw/zinc/87/59/20/1347875920.db2.gz	FGTJWLFBRVOCDX-GJZGRUSLSA-N	0	3	327.453	3.161	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1c(C)noc1C(C)C	ZINC001049531245	1347894402	/nfs/dbraw/zinc/89/44/02/1347894402.db2.gz	IWILCAYKLPMIQO-CVEARBPZSA-N	0	3	331.460	3.361	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1c(C)cccc1Cl	ZINC001049566239	1347913656	/nfs/dbraw/zinc/91/36/56/1347913656.db2.gz	ASIUXKDYANSNFP-QZTJIDSGSA-N	0	3	332.875	3.442	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc2c(cn1)CCCC2	ZINC001049581723	1347921269	/nfs/dbraw/zinc/92/12/69/1347921269.db2.gz	HUBYXVAKWDYBBU-VQTJNVASSA-N	0	3	339.483	3.215	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1cccc(C)c1Cl	ZINC001049595100	1347928266	/nfs/dbraw/zinc/92/82/66/1347928266.db2.gz	TUSJVGVETSUJKZ-QZTJIDSGSA-N	0	3	344.886	3.280	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc2ncccc2o1	ZINC001049600488	1347930279	/nfs/dbraw/zinc/93/02/79/1347930279.db2.gz	AUOKKSDFHUIXGE-HZPDHXFCSA-N	0	3	325.412	3.083	20	30		EGEDHN
CC1(CC(=O)N2CCC[C@@H]3[C@@H]2CCN3Cc2cccc(C#N)c2)CC1	ZINC001049600760	1347930422	/nfs/dbraw/zinc/93/04/22/1347930422.db2.gz	CPFIRDJBEJMKDH-MOPGFXCFSA-N	0	3	337.467	3.314	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1F	ZINC001049611786	1347935681	/nfs/dbraw/zinc/93/56/81/1347935681.db2.gz	KOROLUWPYLLWJC-ISARSNTHSA-N	0	3	346.421	3.320	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1ccc(C2CCC2)cc1	ZINC001049622423	1347939950	/nfs/dbraw/zinc/93/99/50/1347939950.db2.gz	UTIZKAUCXTUFOH-LEWJYISDSA-N	0	3	336.479	3.195	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1ncccc1C	ZINC001049635905	1347946443	/nfs/dbraw/zinc/94/64/43/1347946443.db2.gz	NQVZBUINXACWSV-QZTJIDSGSA-N	0	3	327.472	3.168	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1c(F)cc(F)cc1F	ZINC001049681467	1347970073	/nfs/dbraw/zinc/97/00/73/1347970073.db2.gz	OZAAJBKXOFIHCQ-HZPDHXFCSA-N	0	3	338.373	3.359	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccccc1OC1CCC1	ZINC001049705095	1347982015	/nfs/dbraw/zinc/98/20/15/1347982015.db2.gz	CUPXSBQZSCVXLQ-MOPGFXCFSA-N	0	3	340.467	3.483	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]3[C@H]2CCN3Cc2ccc(C#N)cc2)C1	ZINC001049711541	1347986634	/nfs/dbraw/zinc/98/66/34/1347986634.db2.gz	MXNDVBGVZYXRKK-WOJBJXKFSA-N	0	3	349.478	3.480	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](C)Cc1ccccc1F	ZINC001049714653	1347988253	/nfs/dbraw/zinc/98/82/53/1347988253.db2.gz	PLMOHSJVBUGXBI-FFZOFVMBSA-N	0	3	342.458	3.093	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cn1cc(C)c2ccccc21	ZINC001049775430	1348015590	/nfs/dbraw/zinc/01/55/90/1348015590.db2.gz	DFTKUDFGXAPCNH-LEWJYISDSA-N	0	3	349.478	3.038	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1coc2ccccc12	ZINC001049810434	1348030385	/nfs/dbraw/zinc/03/03/85/1348030385.db2.gz	LMPAIDVCUZUGQU-RTBURBONSA-N	0	3	336.435	3.064	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(OC)c(C2CC2)c1	ZINC001049815221	1348033900	/nfs/dbraw/zinc/03/39/00/1348033900.db2.gz	DFRPBSMGBTYPBI-OALUTQOASA-N	0	3	340.467	3.438	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C(C)(C)CC1CCOCC1	ZINC001049816791	1348035035	/nfs/dbraw/zinc/03/50/35/1348035035.db2.gz	KANWHSZLBPQHPO-QZTJIDSGSA-N	0	3	334.504	3.081	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1c[nH]c2cccc(C)c12	ZINC001049846819	1348055956	/nfs/dbraw/zinc/05/59/56/1348055956.db2.gz	NFQTUFJJZWHSAT-VQTJNVASSA-N	0	3	349.478	3.107	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(CC)c(CC)o1	ZINC001049850666	1348058743	/nfs/dbraw/zinc/05/87/43/1348058743.db2.gz	UCJAVVLLBYUZFL-IAGOWNOFSA-N	0	3	328.456	3.107	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc2c(s1)CCC2	ZINC001049874698	1348080072	/nfs/dbraw/zinc/08/00/72/1348080072.db2.gz	BBZJIYNIJDWTGM-CVEARBPZSA-N	0	3	330.497	3.492	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](C)Oc1ccc(C)cc1	ZINC001049880184	1348085203	/nfs/dbraw/zinc/08/52/03/1348085203.db2.gz	BHSFEMCLZAFOSX-QXAKKESOSA-N	0	3	328.456	3.014	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(C)n(C(C)C)c1C	ZINC001049884191	1348089598	/nfs/dbraw/zinc/08/95/98/1348089598.db2.gz	AMNCFGVKKHIUGO-VQTJNVASSA-N	0	3	341.499	3.388	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)CCc1ccc(CC)cc1	ZINC001049888308	1348092444	/nfs/dbraw/zinc/09/24/44/1348092444.db2.gz	GFWUKDSNCPMHDZ-RTWAWAEBSA-N	0	3	338.495	3.270	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(COC(C)C)cc1	ZINC001049888820	1348093586	/nfs/dbraw/zinc/09/35/86/1348093586.db2.gz	LCPRRICGCRRKJF-UXHICEINSA-N	0	3	342.483	3.477	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1c[nH]cc1-c1ccccc1	ZINC001049898015	1348099598	/nfs/dbraw/zinc/09/95/98/1348099598.db2.gz	VQOOEOVIMIEGJV-NHCUHLMSSA-N	0	3	347.462	3.384	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(OCC2CC2)cc1	ZINC001049901273	1348101184	/nfs/dbraw/zinc/10/11/84/1348101184.db2.gz	OCQAIWOZGGQLKK-VQTJNVASSA-N	0	3	340.467	3.340	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccccc1OCC1CC1	ZINC001049913462	1348108648	/nfs/dbraw/zinc/10/86/48/1348108648.db2.gz	YHEQXINTMPIJPW-RBUKOAKNSA-N	0	3	340.467	3.340	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc2cc(C)ccc2o1	ZINC001049915170	1348109822	/nfs/dbraw/zinc/10/98/22/1348109822.db2.gz	TYXLRJKPVSIQGP-ROUUACIJSA-N	0	3	336.435	3.443	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc2cccc(C)c2o1	ZINC001049918390	1348111593	/nfs/dbraw/zinc/11/15/93/1348111593.db2.gz	HMZNGZMVBPTJLG-MSOLQXFVSA-N	0	3	336.435	3.443	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)C3C4CC5CC(C4)CC3C5)[C@@H]2C1	ZINC001050066353	1348171210	/nfs/dbraw/zinc/17/12/10/1348171210.db2.gz	HVQYRVLVHDNROR-XOMCCCRZSA-N	0	3	328.500	3.168	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3ccc4oc(C)nc4c3)[C@@H]2C1	ZINC001050073679	1348173022	/nfs/dbraw/zinc/17/30/22/1348173022.db2.gz	KRRGIBDQNAOZLV-FUHWJXTLSA-N	0	3	339.439	3.249	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)Cc3c(C)cccc3Cl)[C@@H]2C1	ZINC001050086058	1348177316	/nfs/dbraw/zinc/17/73/16/1348177316.db2.gz	RCQUISCSMVRIFL-QFBILLFUSA-N	0	3	344.886	3.137	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3cc(-c4ccco4)on3)[C@@H]2C1	ZINC001050106063	1348184639	/nfs/dbraw/zinc/18/46/39/1348184639.db2.gz	FLGSDHWZTFJTER-GOEBONIOSA-N	0	3	341.411	3.047	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3CCCN(C(=O)[C@H]4C[C@H]5C[C@H]5C4)[C@@H]3C2)cc1	ZINC001050121476	1348188799	/nfs/dbraw/zinc/18/87/99/1348188799.db2.gz	KUMLACHOXGLRRG-WRTQPQOASA-N	0	3	349.478	3.027	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)Cc3c(C)cc(C)cc3C)[C@@H]2C1	ZINC001050130336	1348191306	/nfs/dbraw/zinc/19/13/06/1348191306.db2.gz	TUCQVOAIBCQHTD-PZJWPPBQSA-N	0	3	338.495	3.100	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)Cc3c[nH]c4cc(C)ccc34)[C@@H]2C1	ZINC001050163249	1348200790	/nfs/dbraw/zinc/20/07/90/1348200790.db2.gz	IZBBBDLJRGEMHT-OXJNMPFZSA-N	0	3	337.467	3.128	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)C[C@@H](C)c3ccccc3OC)[C@@H]2C1	ZINC001050184190	1348205104	/nfs/dbraw/zinc/20/51/04/1348205104.db2.gz	OEHWRVNKITVBDY-ZIFCJYIRSA-N	0	3	342.483	3.298	20	30		EGEDHN
C[C@H](C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)CC2)C1CC1	ZINC001050474165	1348274317	/nfs/dbraw/zinc/27/43/17/1348274317.db2.gz	HMPUTHHIDVRGCN-INIZCTEOSA-N	0	3	337.467	3.029	20	30		EGEDHN
C[C@H](c1ccccc1F)N1CCC2(CN(C(=O)C#CC3CC3)C2)CC1	ZINC001050514672	1348281909	/nfs/dbraw/zinc/28/19/09/1348281909.db2.gz	SKOSLHFDUWOQLR-MRXNPFEDSA-N	0	3	340.442	3.225	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@H]3CCC[C@@H]3c3ccccc3)C2)CC1	ZINC001050587225	1348294532	/nfs/dbraw/zinc/29/45/32/1348294532.db2.gz	IANXBWCBBVFYDQ-UXHICEINSA-N	0	3	336.479	3.128	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)CCc3cccc(Cl)c3)C2)CC1	ZINC001050607871	1348299816	/nfs/dbraw/zinc/29/98/16/1348299816.db2.gz	ZSQSJXPMHMOWGV-UHFFFAOYSA-N	0	3	344.886	3.220	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1scnc1C)CC2	ZINC001050645629	1348313960	/nfs/dbraw/zinc/31/39/60/1348313960.db2.gz	RWKCWPNYYNORFL-SFHVURJKSA-N	0	3	347.528	3.478	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C[C@@H](C)c3cccc(F)c3)C2)CC1	ZINC001050656125	1348319167	/nfs/dbraw/zinc/31/91/67/1348319167.db2.gz	YJELLOPRQYAQKE-QGZVFWFLSA-N	0	3	342.458	3.267	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC3(C2)CCN(CCC(F)(F)F)CC3)C1	ZINC001050658083	1348319906	/nfs/dbraw/zinc/31/99/06/1348319906.db2.gz	ZTLKIAAYUNFARH-UHFFFAOYSA-N	0	3	330.394	3.220	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cc(F)ccc3Cl)C2)CC1	ZINC001050677084	1348324084	/nfs/dbraw/zinc/32/40/84/1348324084.db2.gz	NWRSZDPQKXAIKH-UHFFFAOYSA-N	0	3	334.822	3.040	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3ccc(O[C@@H](C)CC)cc3)C2)CC1	ZINC001050720814	1348336811	/nfs/dbraw/zinc/33/68/11/1348336811.db2.gz	URLKGWUELSGFRE-KRWDZBQOSA-N	0	3	340.467	3.035	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3ccc(Cl)c(CCC)c3)C2)CC1	ZINC001050726592	1348339311	/nfs/dbraw/zinc/33/93/11/1348339311.db2.gz	OCNYBAHPLDGMGJ-UHFFFAOYSA-N	0	3	344.886	3.464	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3coc4ccc(Cl)cc34)C2)CC1	ZINC001050741301	1348344823	/nfs/dbraw/zinc/34/48/23/1348344823.db2.gz	IPMXHPQQSZIACL-UHFFFAOYSA-N	0	3	342.826	3.257	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3sc(C(C)C)nc3C)C2)CC1	ZINC001050753634	1348349300	/nfs/dbraw/zinc/34/93/00/1348349300.db2.gz	VOQSBPBSFLCQCD-UHFFFAOYSA-N	0	3	345.512	3.136	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cc4cc(C)ccc4o3)C2)CC1	ZINC001050764710	1348352048	/nfs/dbraw/zinc/35/20/48/1348352048.db2.gz	FOXHSOOKPJTCLC-UHFFFAOYSA-N	0	3	336.435	3.303	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3oc(C)nc3C)cccc2C1	ZINC001051283436	1348417595	/nfs/dbraw/zinc/41/75/95/1348417595.db2.gz	BAEJXVSIOVDPEB-UHFFFAOYSA-N	0	3	339.439	3.156	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)C3CC(F)(F)C3)cccc2C1	ZINC001051284366	1348418029	/nfs/dbraw/zinc/41/80/29/1348418029.db2.gz	QAKHJRRPBWCTNY-UHFFFAOYSA-N	0	3	334.410	3.282	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3ccn(CC)c3C)cccc2C1	ZINC001051298325	1348423821	/nfs/dbraw/zinc/42/38/21/1348423821.db2.gz	LYGRSGDFLURQOW-UHFFFAOYSA-N	0	3	349.478	3.128	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)[C@H]3CCO[C@H](C)C3)cccc2C1	ZINC001051303877	1348426836	/nfs/dbraw/zinc/42/68/36/1348426836.db2.gz	QAOJVUYKDYSIOB-SJORKVTESA-N	0	3	342.483	3.052	20	30		EGEDHN
C=CCCN1CCN([C@@H]2CCN(C(=O)C3(C)CCCCCC3)C2)CC1	ZINC001052037488	1348499145	/nfs/dbraw/zinc/49/91/45/1348499145.db2.gz	MGQUXYYXOAPJRB-LJQANCHMSA-N	0	3	347.547	3.142	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cc(C)c3ccccc3n2)CC1	ZINC001052496980	1348558650	/nfs/dbraw/zinc/55/86/50/1348558650.db2.gz	NDICYNLHYNHRRU-KRWDZBQOSA-N	0	3	335.451	3.151	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)Cc2ccc(CCCC)cc2)CC1	ZINC001052532412	1348568385	/nfs/dbraw/zinc/56/83/85/1348568385.db2.gz	FQRMZAPYCGLHGZ-FQEVSTJZSA-N	0	3	326.484	3.176	20	30		EGEDHN
Cc1coc(C(=O)N[C@@H]2CCCN(Cc3cccc(C#N)c3)CC2)c1	ZINC001052642042	1348608734	/nfs/dbraw/zinc/60/87/34/1348608734.db2.gz	VGJAQEOEEHXCNG-GOSISDBHSA-N	0	3	337.423	3.244	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCCN(Cc3ccccn3)CC2)CC1	ZINC001052682731	1348630127	/nfs/dbraw/zinc/63/01/27/1348630127.db2.gz	YCGGABHXVOQXKM-SFHVURJKSA-N	0	3	327.472	3.299	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCN(Cc3oc(C)nc3C)CC2)C1	ZINC001052693279	1348637075	/nfs/dbraw/zinc/63/70/75/1348637075.db2.gz	QZLRDCBTUHFHEA-MRXNPFEDSA-N	0	3	331.460	3.118	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc(OCC)c(C)c2)CC1	ZINC001052762048	1348667605	/nfs/dbraw/zinc/66/76/05/1348667605.db2.gz	TWNRKVVITMYNSH-SFHVURJKSA-N	0	3	328.456	3.001	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)C2(c3ccccc3C)CCC2)CC1	ZINC001052893537	1348730884	/nfs/dbraw/zinc/73/08/84/1348730884.db2.gz	BNEGECUAZSJQEG-IBGZPJMESA-N	0	3	338.495	3.411	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cscc2C(F)(F)F)CC1	ZINC001052982192	1348786839	/nfs/dbraw/zinc/78/68/39/1348786839.db2.gz	UYQVSKOSXRRGKT-LBPRGKRZSA-N	0	3	344.402	3.375	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)Cc2cccs2)C1	ZINC001053060896	1348870124	/nfs/dbraw/zinc/87/01/24/1348870124.db2.gz	KFDXEPLOEKLVKW-WMZOPIPTSA-N	0	3	330.497	3.017	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)Cc2ccsc2)C1	ZINC001053061696	1348871576	/nfs/dbraw/zinc/87/15/76/1348871576.db2.gz	UNLMTLSKBPIDAG-OALUTQOASA-N	0	3	344.524	3.407	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2c(C)noc2C)C1	ZINC001053067899	1348880883	/nfs/dbraw/zinc/88/08/83/1348880883.db2.gz	SLBLEZFENBGKEZ-MSOLQXFVSA-N	0	3	343.471	3.021	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2c(C)noc2C)C1	ZINC001053067901	1348881128	/nfs/dbraw/zinc/88/11/28/1348881128.db2.gz	SLBLEZFENBGKEZ-ROUUACIJSA-N	0	3	343.471	3.021	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)CCc2ccco2)C1	ZINC001053067786	1348881697	/nfs/dbraw/zinc/88/16/97/1348881697.db2.gz	JEHTVOWXDBGZIF-UYAOXDASSA-N	0	3	342.483	3.329	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)CCc2ccoc2)C1	ZINC001053074643	1348892226	/nfs/dbraw/zinc/89/22/26/1348892226.db2.gz	DMYGUPCMCOURIR-UXHICEINSA-N	0	3	342.483	3.329	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)C2C=CC=CC=C2)C1	ZINC001053085129	1348905790	/nfs/dbraw/zinc/90/57/90/1348905790.db2.gz	CCROATSZKKZKFA-NHCUHLMSSA-N	0	3	338.495	3.401	20	30		EGEDHN
O=C(C#CC1CC1)N1CCCC[C@@H]1[C@@H]1CCCN(C/C=C/Cl)C1	ZINC001053087409	1348910484	/nfs/dbraw/zinc/91/04/84/1348910484.db2.gz	SYEOTPWLGLTSKE-IVEIAJHPSA-N	0	3	334.891	3.245	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cc(OC)cs2)C1	ZINC001053092415	1348919547	/nfs/dbraw/zinc/91/95/47/1348919547.db2.gz	GXOKQSHBPWALCC-DOTOQJQBSA-N	0	3	346.496	3.097	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cc(C(C)C)on2)C1	ZINC001053094593	1348924371	/nfs/dbraw/zinc/92/43/71/1348924371.db2.gz	WVLOHWTXHQXDJU-SJLPKXTDSA-N	0	3	343.471	3.138	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccoc2C2CC2)C1	ZINC001053095212	1348925317	/nfs/dbraw/zinc/92/53/17/1348925317.db2.gz	IHYUARXPCXBWMO-PKOBYXMFSA-N	0	3	340.467	3.497	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2csc(C)n2)C1	ZINC001053095571	1348925616	/nfs/dbraw/zinc/92/56/16/1348925616.db2.gz	KALUTTHPMAMOSK-FUHWJXTLSA-N	0	3	345.512	3.182	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)C2CC3(CC3)C2)C1	ZINC001053098928	1348930046	/nfs/dbraw/zinc/93/00/46/1348930046.db2.gz	RBDKNTQPQGELBY-PKOBYXMFSA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(C)cc2F)C1	ZINC001053099713	1348932656	/nfs/dbraw/zinc/93/26/56/1348932656.db2.gz	XYOVCMNOKVGMHI-YLJYHZDGSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(C)c(CC)o2)C1	ZINC001053103636	1348937758	/nfs/dbraw/zinc/93/77/58/1348937758.db2.gz	JNKOVHWCADAFMH-MSOLQXFVSA-N	0	3	342.483	3.490	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2c(C)nsc2C)C1	ZINC001053104740	1348939963	/nfs/dbraw/zinc/93/99/63/1348939963.db2.gz	IUUZCRKPLHUQIM-SJORKVTESA-N	0	3	345.512	3.100	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cccn2CC)C1	ZINC001053104799	1348941519	/nfs/dbraw/zinc/94/15/19/1348941519.db2.gz	JOEBHMZNHCMFFS-MOPGFXCFSA-N	0	3	341.499	3.238	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)CCc2ccc(C)o2)C1	ZINC001053105416	1348941829	/nfs/dbraw/zinc/94/18/29/1348941829.db2.gz	OJBHQYJMJZYNBF-ICSRJNTNSA-N	0	3	342.483	3.247	20	30		EGEDHN
C=CCCN1Cc2ccccc2C[C@@H]1CNC(=O)c1c(C)ccn1C	ZINC001054038475	1349134536	/nfs/dbraw/zinc/13/45/36/1349134536.db2.gz	CQHZLTADUYNSAH-LJQANCHMSA-N	0	3	337.467	3.066	20	30		EGEDHN
C=C(C)CCN1Cc2ccccc2C[C@H]1CNC(=O)[C@H]1CC1(F)F	ZINC001054039749	1349135214	/nfs/dbraw/zinc/13/52/14/1349135214.db2.gz	IJDGLWDPGPTBOS-DLBZAZTESA-N	0	3	334.410	3.151	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001054074893	1349146977	/nfs/dbraw/zinc/14/69/77/1349146977.db2.gz	CDYPLCGXHDDTBH-OAQYLSRUSA-N	0	3	339.483	3.419	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)C1(C(F)(F)F)CCC1)C2	ZINC001054153494	1349156865	/nfs/dbraw/zinc/15/68/65/1349156865.db2.gz	RZAMJSHUFYCINH-INIZCTEOSA-N	0	3	342.405	3.057	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1c(C)oc(C)c1C)C2	ZINC001054162002	1349164221	/nfs/dbraw/zinc/16/42/21/1349164221.db2.gz	UUZNKTDRFPGFAW-HXUWFJFHSA-N	0	3	328.456	3.156	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(F)c(Cl)c1)C2	ZINC001054187194	1349189874	/nfs/dbraw/zinc/18/98/74/1349189874.db2.gz	MTITZJKQMDUKSX-GOSISDBHSA-N	0	3	334.822	3.040	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@H](C)c1ccsc1)C2	ZINC001054195725	1349198772	/nfs/dbraw/zinc/19/87/72/1349198772.db2.gz	CAHVRNZAZQXWSX-APWZRJJASA-N	0	3	330.497	3.189	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc(C)cc(F)c1)C2	ZINC001054202948	1349204014	/nfs/dbraw/zinc/20/40/14/1349204014.db2.gz	NNEJVOABKDSGSW-HXUWFJFHSA-N	0	3	328.431	3.086	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cccc(C)c1Cl)C2	ZINC001054215530	1349214519	/nfs/dbraw/zinc/21/45/19/1349214519.db2.gz	XHKBKTWUDZYFAI-LJQANCHMSA-N	0	3	330.859	3.210	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cccc3ccncc31)C2	ZINC001054223439	1349218048	/nfs/dbraw/zinc/21/80/48/1349218048.db2.gz	VELUAMKMCWVXOE-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)C13CC4CC(CC(C4)C1)C3)C2	ZINC001054231813	1349225578	/nfs/dbraw/zinc/22/55/78/1349225578.db2.gz	AQKVXQCXFUVDQV-OTNIWXAGSA-N	0	3	340.511	3.151	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(F)c3occc31)C2	ZINC001054241994	1349235103	/nfs/dbraw/zinc/23/51/03/1349235103.db2.gz	CNVSFCQTDLTLHP-FQEVSTJZSA-N	0	3	340.398	3.133	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)C1CC(c3ccccc3)C1)C2	ZINC001054246765	1349242242	/nfs/dbraw/zinc/24/22/42/1349242242.db2.gz	ITTZXLVTTAZKLX-AOMIVXANSA-N	0	3	336.479	3.128	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(CF)cc1)C2	ZINC001054247651	1349244082	/nfs/dbraw/zinc/24/40/82/1349244082.db2.gz	ZVHHPEPZLASFFG-FQEVSTJZSA-N	0	3	328.431	3.108	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)CCc1ccc(C)s1)C2	ZINC001054248994	1349244707	/nfs/dbraw/zinc/24/47/07/1349244707.db2.gz	IMFNHFANYSRRQL-HXUWFJFHSA-N	0	3	344.524	3.327	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3ccc(F)nc3)cc2C1	ZINC001054258555	1349254557	/nfs/dbraw/zinc/25/45/57/1349254557.db2.gz	TVUCEQGHXVUWES-UHFFFAOYSA-N	0	3	325.387	3.042	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@H]3CCCCO3)cc2C1	ZINC001054261109	1349257382	/nfs/dbraw/zinc/25/73/82/1349257382.db2.gz	PVHOXSCAPNVRKF-LJQANCHMSA-N	0	3	328.456	3.154	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@H]3CCCO[C@@H]3CC)cc2C1	ZINC001054267667	1349266176	/nfs/dbraw/zinc/26/61/76/1349266176.db2.gz	BHPHSCYDFYVJLT-VQTJNVASSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@@H]3Cc4ccccc4O3)cc2C1	ZINC001054272792	1349271829	/nfs/dbraw/zinc/27/18/29/1349271829.db2.gz	FFGCACMUNYUKTM-NRFANRHFSA-N	0	3	348.446	3.198	20	30		EGEDHN
C#CCOc1ccc(C(=O)NCc2ccc3c(c2)CN(CCC)C3)cc1	ZINC001054284770	1349287558	/nfs/dbraw/zinc/28/75/58/1349287558.db2.gz	HHPPBWHFQIEAKF-UHFFFAOYSA-N	0	3	348.446	3.354	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3oc(CC)nc3C)cc2C1	ZINC001054289096	1349293426	/nfs/dbraw/zinc/29/34/26/1349293426.db2.gz	VGVFVXRUKNBPDD-UHFFFAOYSA-N	0	3	339.439	3.367	20	30		EGEDHN
C[C@H]1CN(C(=O)CC2CCCC2)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054346509	1349325897	/nfs/dbraw/zinc/32/58/97/1349325897.db2.gz	JNMLFDRHHWWWKJ-GUYCJALGSA-N	0	3	331.485	3.137	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2CCCC2)C[C@@H]1NCc1ccc(C#N)c(F)c1	ZINC001054347022	1349326486	/nfs/dbraw/zinc/32/64/86/1349326486.db2.gz	MSDPYDWDCCKEPS-KUHUBIRLSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@@H]1CN(C(=O)C=C2CCCCC2)C[C@H]1NCc1ccc(C#N)s1	ZINC001054447487	1349362300	/nfs/dbraw/zinc/36/23/00/1349362300.db2.gz	GNJFVPNCCCBISP-RDTXWAMCSA-N	0	3	343.496	3.447	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCC2CCC2)C[C@@H]1NCc1ccc(C#N)c(F)c1	ZINC001054523058	1349382785	/nfs/dbraw/zinc/38/27/85/1349382785.db2.gz	CESLPIHZYYURQP-KUHUBIRLSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2sccc2F)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054624325	1349419769	/nfs/dbraw/zinc/41/97/69/1349419769.db2.gz	SMGLAUWUFYBXCJ-YGRLFVJLSA-N	0	3	349.456	3.071	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2[nH]c3ccccc3c2Cl)C1	ZINC001080036338	1357463070	/nfs/dbraw/zinc/46/30/70/1357463070.db2.gz	REKFNBIBFJSMMU-IUODEOHRSA-N	0	3	331.847	3.448	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](C)[C@H](NCc2cccc(OCC)n2)C1	ZINC001054971583	1349531823	/nfs/dbraw/zinc/53/18/23/1349531823.db2.gz	RDCCKBSGYQIGKJ-DOTOQJQBSA-N	0	3	345.487	3.019	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](NC(=O)CC2CCCC2)C2CC2)c(F)c1	ZINC001322955318	1387255729	/nfs/dbraw/zinc/25/57/29/1387255729.db2.gz	SQCGXGQNVAKKOC-IBGZPJMESA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CN(CC[C@@H]3CC3(Cl)Cl)C[C@H]2C)C1	ZINC001080406776	1357610450	/nfs/dbraw/zinc/61/04/50/1357610450.db2.gz	ZYJGDXZBPCPJEK-MGPQQGTHSA-N	0	3	345.314	3.363	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCO[C@H]1C1CCN(C(=O)[C@H](C)C(C)C)CC1	ZINC001071091372	1354453664	/nfs/dbraw/zinc/45/36/64/1354453664.db2.gz	BAYTVUVMYFZABV-OIISXLGYSA-N	0	3	342.911	3.017	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)CC(C)(C)C1CC1)C[C@H](C)O2	ZINC001071164049	1354483383	/nfs/dbraw/zinc/48/33/83/1354483383.db2.gz	GVYXQPQXTFAWEL-JXFKEZNVSA-N	0	3	334.504	3.081	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)CN(C(=O)CC1(C)CCCCC1)C[C@@H](C)O2	ZINC001071190170	1354494936	/nfs/dbraw/zinc/49/49/36/1354494936.db2.gz	VFJPKQPSQNBSJC-WIYYLYMNSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C1CCC3(CC3)CC1)C[C@H](C)O2	ZINC001071189742	1354495286	/nfs/dbraw/zinc/49/52/86/1354495286.db2.gz	OWTSWMNOHVSWTJ-UWJYYQICSA-N	0	3	346.515	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1cc(F)ccc1C)C[C@@H](C)O2	ZINC001071195516	1354496443	/nfs/dbraw/zinc/49/64/43/1354496443.db2.gz	YMQKTZQGEMSMBP-UZLBHIALSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1cc[nH]c1C(C)C)C[C@@H](C)O2	ZINC001071201514	1354501796	/nfs/dbraw/zinc/50/17/96/1354501796.db2.gz	FXGMOTJSGLHISV-UZLBHIALSA-N	0	3	345.487	3.020	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1ccc(CF)cc1)C[C@H](C)O2	ZINC001071245836	1354525313	/nfs/dbraw/zinc/52/53/13/1354525313.db2.gz	KERRGWCDXZBWQR-JXFKEZNVSA-N	0	3	346.446	3.038	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3cccc(C)c3F)C2)CC1	ZINC001086924007	1359249772	/nfs/dbraw/zinc/24/97/72/1359249772.db2.gz	HSPLRQLPAHQGTJ-KRWDZBQOSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2coc3c2cccc3OC)CC[C@@H]1C	ZINC001071512584	1354736532	/nfs/dbraw/zinc/73/65/32/1354736532.db2.gz	ZKUMEVNLLQLMHD-GJZGRUSLSA-N	0	3	340.423	3.047	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2c(F)c(F)cc(F)c2F)CC[C@@H]1C	ZINC001071526853	1354747064	/nfs/dbraw/zinc/74/70/64/1354747064.db2.gz	VGPHPBXGHVAWEQ-QWRGUYRKSA-N	0	3	344.352	3.402	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2c(Cl)n[nH]c2C2CC2)CC[C@H]1C	ZINC001071561166	1354764741	/nfs/dbraw/zinc/76/47/41/1354764741.db2.gz	JZENTZPXWMHOIT-YPMHNXCESA-N	0	3	336.867	3.099	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CC[C@H](C)N(Cc2ccccc2)C1	ZINC001071571730	1354771281	/nfs/dbraw/zinc/77/12/81/1354771281.db2.gz	KZYGFTFRELCRAX-PKOBYXMFSA-N	0	3	337.467	3.457	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc(C(C)C)nn2CC)CC[C@H]1C	ZINC001071642601	1354821091	/nfs/dbraw/zinc/82/10/91/1354821091.db2.gz	SZIDGHDGMKUVOX-HZPDHXFCSA-N	0	3	332.492	3.185	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2ccc3cnccc3c2)CC[C@@H]1C	ZINC001071678031	1354845501	/nfs/dbraw/zinc/84/55/01/1354845501.db2.gz	XYCNGIKCUQOEAK-JXFKEZNVSA-N	0	3	337.467	3.323	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(C)nc2C2CC2)CC[C@H]1C	ZINC001071704512	1354862895	/nfs/dbraw/zinc/86/28/95/1354862895.db2.gz	AJLCCFJCDUQWCH-NVXWUHKLSA-N	0	3	327.472	3.426	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2(c3cccc(C)c3)CCC2)CC[C@H]1C	ZINC001071728130	1354884048	/nfs/dbraw/zinc/88/40/48/1354884048.db2.gz	HWHRNOWJCUCVKK-UYAOXDASSA-N	0	3	338.495	3.409	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2(c3cccc(C)c3)CCC2)CC[C@@H]1C	ZINC001071728128	1354884215	/nfs/dbraw/zinc/88/42/15/1354884215.db2.gz	HWHRNOWJCUCVKK-ICSRJNTNSA-N	0	3	338.495	3.409	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccccc2-n2cccc2)CC[C@H]1C	ZINC001071793159	1354939380	/nfs/dbraw/zinc/93/93/80/1354939380.db2.gz	WASUABFYDCHBHX-MSOLQXFVSA-N	0	3	335.451	3.083	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2cc(Br)co2)CC[C@H]1C	ZINC001071868654	1354994489	/nfs/dbraw/zinc/99/44/89/1354994489.db2.gz	LWFVAZXCTNQVEF-YPMHNXCESA-N	0	3	341.249	3.201	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cccc(-n3cccn3)c2)CC[C@@H]1C	ZINC001071898188	1355013546	/nfs/dbraw/zinc/01/35/46/1355013546.db2.gz	WZTTZHTUTIGCJX-FUHWJXTLSA-N	0	3	338.455	3.031	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(-n3cccc3)nc2)CC[C@H]1C	ZINC001071899537	1355013796	/nfs/dbraw/zinc/01/37/96/1355013796.db2.gz	AUOXEABARLYWRU-SJLPKXTDSA-N	0	3	338.455	3.031	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cccc3c2ccn3C)CC[C@H]1C	ZINC001071900571	1355014607	/nfs/dbraw/zinc/01/46/07/1355014607.db2.gz	KKQFEYOQGDXHCD-CVEARBPZSA-N	0	3	325.456	3.337	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CC[C@H](C)N(Cc3ccc(C)cc3)C2)cn1	ZINC001072002956	1355067848	/nfs/dbraw/zinc/06/78/48/1355067848.db2.gz	PZFCLSUZQQIQTP-LAUBAEHRSA-N	0	3	347.462	3.154	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C(C)(C)c2ccc(F)cc2)CC[C@@H]1C	ZINC001072007278	1355071603	/nfs/dbraw/zinc/07/16/03/1355071603.db2.gz	ZKJJHIHTLCBDRO-YJBOKZPZSA-N	0	3	330.447	3.096	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2(c3ccccc3C)CCC2)CC[C@@H]1C	ZINC001072026525	1355087366	/nfs/dbraw/zinc/08/73/66/1355087366.db2.gz	KDHSTHZDQGJQRE-RBUKOAKNSA-N	0	3	338.495	3.409	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)Cc2coc3cc(C)ccc23)CC[C@@H]1C	ZINC001072050277	1355104259	/nfs/dbraw/zinc/10/42/59/1355104259.db2.gz	UQKZNYLZMUFNOF-RDJZCZTQSA-N	0	3	326.440	3.439	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc3c(cccc3OC)[nH]2)CC[C@@H]1C	ZINC001072070966	1355112268	/nfs/dbraw/zinc/11/22/68/1355112268.db2.gz	UGOQLBDYTZTTGN-LSDHHAIUSA-N	0	3	341.455	3.335	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2ccc(P(C)(C)=O)cc2)CC[C@@H]1C	ZINC001072087821	1355120724	/nfs/dbraw/zinc/12/07/24/1355120724.db2.gz	BRINKHTWQSVSNV-RDJZCZTQSA-N	0	3	348.427	3.093	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cn2ccc3ccccc32)CC[C@@H]1C	ZINC001072088742	1355122427	/nfs/dbraw/zinc/12/24/27/1355122427.db2.gz	PDFJVMXZJNEWGM-WMZOPIPTSA-N	0	3	325.456	3.187	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(C(C)C)[nH]c1=O	ZINC001089704960	1360607201	/nfs/dbraw/zinc/60/72/01/1360607201.db2.gz	AEFNOVSARKGJHM-OAHLLOKOSA-N	0	3	345.487	3.317	20	30		EGEDHN
CCCC(=O)N1CC[C@@H](C)[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001072162898	1355160320	/nfs/dbraw/zinc/16/03/20/1355160320.db2.gz	GMAHHAFDWWRDEP-RHSMWYFYSA-N	0	3	331.435	3.072	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@H](C)[C@H](CNCc2ccccc2C#N)C1	ZINC001072171781	1355167152	/nfs/dbraw/zinc/16/71/52/1355167152.db2.gz	PMJSOZUOCQCRPM-QFBILLFUSA-N	0	3	325.456	3.099	20	30		EGEDHN
C[C@@H]1CCN(C(=O)C2=CCCC2)C[C@H]1CNCc1ccccc1C#N	ZINC001072248407	1355206661	/nfs/dbraw/zinc/20/66/61/1355206661.db2.gz	QBDKTLIDKFKKNT-OXQOHEQNSA-N	0	3	337.467	3.243	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](C)[C@@H](CNCc2ccn(CC)n2)C1	ZINC001072334619	1355243666	/nfs/dbraw/zinc/24/36/66/1355243666.db2.gz	DXMKRMWRYSZFMW-IRXDYDNUSA-N	0	3	346.519	3.080	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](C)[C@H](CNCc2nc(C)cs2)C1	ZINC001072338547	1355246150	/nfs/dbraw/zinc/24/61/50/1355246150.db2.gz	CZWCWVBEJCQXOL-DZGCQCFKSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](C)[C@H](CNCc3cscn3)C2)CC1	ZINC001072352710	1355254027	/nfs/dbraw/zinc/25/40/27/1355254027.db2.gz	JYVZUCVQBNPHTG-NVXWUHKLSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](C)[C@H](CNCc3ncc(C)s3)C2)C1	ZINC001072363369	1355257908	/nfs/dbraw/zinc/25/79/08/1355257908.db2.gz	DHSNRGAZCUVTGL-GDBMZVCRSA-N	0	3	347.528	3.382	20	30		EGEDHN
C[C@H](C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2)C1CCC1	ZINC001072844482	1355461972	/nfs/dbraw/zinc/46/19/72/1355461972.db2.gz	BCMIHBIOOKFOAL-INIZCTEOSA-N	0	3	337.467	3.029	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H](C)c3ccc(Cl)cc3)C2)C1	ZINC001072941245	1355510581	/nfs/dbraw/zinc/51/05/81/1355510581.db2.gz	HLEDYWJRIJWTDW-HNNXBMFYSA-N	0	3	330.859	3.001	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)[C@@]45C[C@@H]4CCCC5)C3)C2)c1	ZINC001072964212	1355527354	/nfs/dbraw/zinc/52/73/54/1355527354.db2.gz	NTAUHKNPOKXNID-UGKGYDQZSA-N	0	3	349.478	3.173	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C3CCC(C(C)(C)C)CC3)C2)C1	ZINC001073399953	1355754971	/nfs/dbraw/zinc/75/49/71/1355754971.db2.gz	FDUQBYISSSJSBN-UHFFFAOYSA-N	0	3	330.516	3.397	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3cc4c(cccc4F)s3)C2)C1	ZINC001073412899	1355765487	/nfs/dbraw/zinc/76/54/87/1355765487.db2.gz	KQTHXIGWCWTGKL-UHFFFAOYSA-N	0	3	330.428	3.374	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2cccc(C(C)(C)C)c2)C1	ZINC001073830562	1355910737	/nfs/dbraw/zinc/91/07/37/1355910737.db2.gz	LYQJAHLSYNLYJM-IBGZPJMESA-N	0	3	344.499	3.381	20	30		EGEDHN
CS[C@@H](C)C(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(C#N)cc1	ZINC001073954660	1355990360	/nfs/dbraw/zinc/99/03/60/1355990360.db2.gz	ZXYJEWQXLAJDID-MAUKXSAKSA-N	0	3	345.512	3.123	20	30		EGEDHN
Cc1ccc(CN(C)C[C@H]2CCCCN2C(=O)[C@H](C)C#N)cc1F	ZINC001073970374	1356003393	/nfs/dbraw/zinc/00/33/93/1356003393.db2.gz	LUZPZVSKJZXKQQ-NVXWUHKLSA-N	0	3	331.435	3.107	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@H](NCc2ccc(C#N)s2)[C@@H]1C)C1CCC1	ZINC001074707264	1356226391	/nfs/dbraw/zinc/22/63/91/1356226391.db2.gz	YEHKTQLHMUVVRV-IGCXYCKISA-N	0	3	331.485	3.135	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccc(C)c4cccnc34)[C@@H]2C1	ZINC001076057896	1356477651	/nfs/dbraw/zinc/47/76/51/1356477651.db2.gz	HKGMAJKBGNXTMN-QFBILLFUSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@@H](C)Cc3cccc(F)c3)[C@@H]2C1	ZINC001076623336	1356636920	/nfs/dbraw/zinc/63/69/20/1356636920.db2.gz	QNMNMQHCAVASID-VDZJLULYSA-N	0	3	330.447	3.113	20	30		EGEDHN
C=CCCN1C[C@@H]2CCN(C(=O)c3sc(C(C)(C)C)nc3C)[C@@H]2C1	ZINC001076636669	1356638899	/nfs/dbraw/zinc/63/88/99/1356638899.db2.gz	HDOHGKFGXMXTRG-LSDHHAIUSA-N	0	3	347.528	3.471	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2cnc3ccc(F)cc3c2)C1	ZINC001080725551	1357728448	/nfs/dbraw/zinc/72/84/48/1357728448.db2.gz	SXGCVLTUZLMRTF-FZKQIMNGSA-N	0	3	327.403	3.000	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@@H](NC(=O)C=C2CCC2)C12CCC2	ZINC001078593897	1357026749	/nfs/dbraw/zinc/02/67/49/1357026749.db2.gz	KMZKGUVRMDYAOT-ZIAGYGMSSA-N	0	3	339.277	3.022	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc(C)nc(C)c2)C12CCC2	ZINC001078637579	1357046643	/nfs/dbraw/zinc/04/66/43/1357046643.db2.gz	RDJGVUGAZIUTFH-JKSUJKDBSA-N	0	3	333.863	3.082	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc3occc3[nH]2)C12CCC2	ZINC001078639948	1357047678	/nfs/dbraw/zinc/04/76/78/1357047678.db2.gz	PXWMWEKQYPDPDO-LSDHHAIUSA-N	0	3	333.819	3.144	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cncc(CC)c2)C12CCC2	ZINC001078683722	1357053768	/nfs/dbraw/zinc/05/37/68/1357053768.db2.gz	VXCHUWXEFODRJH-JKSUJKDBSA-N	0	3	333.863	3.027	20	30		EGEDHN
C=CCCN1C[C@@H](C)[C@H](NC(=O)c2sc(Cl)nc2Cl)C1	ZINC001080951520	1357768742	/nfs/dbraw/zinc/76/87/42/1357768742.db2.gz	ZUAQUCWKKFEYOG-RKDXNWHRSA-N	0	3	334.272	3.076	20	30		EGEDHN
C=CCCN1C[C@@H](C)[C@H](NC(=O)c2sc(C(C)(C)C)nc2C)C1	ZINC001081047434	1357798038	/nfs/dbraw/zinc/79/80/38/1357798038.db2.gz	CWWKVRLZCUMLAI-TZMCWYRMSA-N	0	3	335.517	3.375	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C(C)(C)C(C)(C)C)C[C@H]1c1ccccc1	ZINC001081157728	1357846292	/nfs/dbraw/zinc/84/62/92/1357846292.db2.gz	CGFSBEKZPBGJGY-ZWKOTPCHSA-N	0	3	326.484	3.276	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H]2CC3CCC2CC3)C[C@H]1c1ccccc1	ZINC001081231539	1357851999	/nfs/dbraw/zinc/85/19/99/1357851999.db2.gz	KFMWIYFPQPWCDV-ZRTAOYRGSA-N	0	3	336.479	3.030	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)[C@@H](C)CC3CCCC3)[C@H]2C1	ZINC001083212940	1358124261	/nfs/dbraw/zinc/12/42/61/1358124261.db2.gz	HPRSHOPMGQYWNN-YTQUADARSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)C3CCC(C4CC4)CC3)[C@H]2C1	ZINC001083261798	1358127746	/nfs/dbraw/zinc/12/77/46/1358127746.db2.gz	MXPPFMKFIZRGJC-GHBBCFCZSA-N	0	3	346.515	3.081	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)c3ccc([C@H](C)CC)cc3)[C@H]2C1	ZINC001083284652	1358129760	/nfs/dbraw/zinc/12/97/60/1358129760.db2.gz	HHADBJMJDOTOTR-LSTHTHJFSA-N	0	3	342.483	3.301	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2cccc(C3CCCC3)c2)[C@@H](O)C1	ZINC001083954215	1358135375	/nfs/dbraw/zinc/13/53/75/1358135375.db2.gz	PNNJUZSNKKAYMY-UXHICEINSA-N	0	3	342.483	3.085	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)c3cccc4scnc43)[C@@H]2C1	ZINC001084341305	1358196410	/nfs/dbraw/zinc/19/64/10/1358196410.db2.gz	HOJSKZVUVAOXJL-UKRRQHHQSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3cc4ncccc4s3)[C@@H]2C1	ZINC001084572725	1358240642	/nfs/dbraw/zinc/24/06/42/1358240642.db2.gz	WUDGJERUHQTLSH-GDBMZVCRSA-N	0	3	341.480	3.409	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)CC(C3CCC3)C3CCC3)[C@@H]2C1	ZINC001084666415	1358272831	/nfs/dbraw/zinc/27/28/31/1358272831.db2.gz	AKBMLCSMJHLBKY-UYAOXDASSA-N	0	3	328.500	3.149	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)[C@H](CC3CCCC3)C(C)C)[C@@H]2C1	ZINC001084698568	1358285104	/nfs/dbraw/zinc/28/51/04/1358285104.db2.gz	ZQMCQGFDRXJBBZ-VAMGGRTRSA-N	0	3	330.516	3.395	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3sc(CC4CC4)nc3C)[C@@H]2C1	ZINC001084741640	1358297548	/nfs/dbraw/zinc/29/75/48/1358297548.db2.gz	LVEQPRDRJRVBNP-HZPDHXFCSA-N	0	3	345.512	3.126	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)[C@@H](CC)Cc3ccccc3C)[C@@H]2C1	ZINC001084775679	1358307101	/nfs/dbraw/zinc/30/71/01/1358307101.db2.gz	QADSTNNXSUZQDG-CEWLAPEOSA-N	0	3	338.495	3.120	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3cscc3C(F)(F)F)[C@@H]2C1	ZINC001084873704	1358337036	/nfs/dbraw/zinc/33/70/36/1358337036.db2.gz	PVDHXYHWYBMSCK-BXUZGUMPSA-N	0	3	344.402	3.489	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3c3sccc3C)C[C@@H]21	ZINC001084940018	1358351944	/nfs/dbraw/zinc/35/19/44/1358351944.db2.gz	XYZOPNWPRRTWMU-VQHPVUNQSA-N	0	3	330.497	3.269	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H]2CCN(Cc3cccnc3C)[C@H]2C1	ZINC001085023900	1358369502	/nfs/dbraw/zinc/36/95/02/1358369502.db2.gz	DIFSGQJVAHGKAN-SLYNCCJLSA-N	0	3	341.499	3.415	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)C1CCCCC1	ZINC001085119475	1358398554	/nfs/dbraw/zinc/39/85/54/1358398554.db2.gz	XDJOBKAIBIEGBB-HUUCEWRRSA-N	0	3	343.309	3.492	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N[C@@H]1CCCC[C@H]1NCc1ccc(C#N)cc1F	ZINC001085337695	1358470600	/nfs/dbraw/zinc/47/06/00/1358470600.db2.gz	OSNXTPNJLAZXPH-YCEFEEMOSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccc(F)c(OC)c1	ZINC001085340645	1358471208	/nfs/dbraw/zinc/47/12/08/1358471208.db2.gz	DEULTNNDNNQZRG-HUUCEWRRSA-N	0	3	340.826	3.217	20	30		EGEDHN
Cc1ccccc1[C@H](C)N1CC[C@@H]1CN(C)C(=O)c1cc(C#N)c[nH]1	ZINC001085534912	1358571440	/nfs/dbraw/zinc/57/14/40/1358571440.db2.gz	WASKFODKIMXWSD-DOTOQJQBSA-N	0	3	336.439	3.102	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N(C)C[C@@H]1CCN1CC1CCC1	ZINC001085678663	1358681802	/nfs/dbraw/zinc/68/18/02/1358681802.db2.gz	OYAVWLNTGXVJJW-KRWDZBQOSA-N	0	3	328.456	3.198	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1cc(C)n(C(CC)CC)n1	ZINC001085685193	1358686445	/nfs/dbraw/zinc/68/64/45/1358686445.db2.gz	LQDLNXSCUPQACC-KRWDZBQOSA-N	0	3	332.492	3.275	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C[C@H]2CCN2C[C@H]2CCC(F)(F)C2)cc1	ZINC001085758099	1358737798	/nfs/dbraw/zinc/73/77/98/1358737798.db2.gz	ZLPRCKIMPUMEPO-FUHWJXTLSA-N	0	3	346.421	3.250	20	30		EGEDHN
C=C1CCC(C(=O)N(C)C[C@@H]2CCN2C[C@H](OC)C2CCC2)CC1	ZINC001085801615	1358776860	/nfs/dbraw/zinc/77/68/60/1358776860.db2.gz	XRJDICGZCSRPPK-OALUTQOASA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@H]1CCOc2ccccc21	ZINC001085876160	1358840369	/nfs/dbraw/zinc/84/03/69/1358840369.db2.gz	SUANXIKGNORBBD-AEFFLSMTSA-N	0	3	328.456	3.052	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1c[nH]nc1-c1ccsc1	ZINC001085897235	1358856438	/nfs/dbraw/zinc/85/64/38/1358856438.db2.gz	ZBBGPBXIAQGAPT-OAHLLOKOSA-N	0	3	344.484	3.251	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc2ccn(C)c2c1	ZINC001085906197	1358865121	/nfs/dbraw/zinc/86/51/21/1358865121.db2.gz	BSVPODHPBJXMTK-GOSISDBHSA-N	0	3	325.456	3.291	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccnc(O[C@H](C)CC)c1	ZINC001085915451	1358875631	/nfs/dbraw/zinc/87/56/31/1358875631.db2.gz	BGELRTWSBIOQKP-AEFFLSMTSA-N	0	3	345.487	3.371	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cnn([C@@H](C)CC)c1C	ZINC001085916883	1358876323	/nfs/dbraw/zinc/87/63/23/1358876323.db2.gz	LHJOIUXEDAIDAV-RDJZCZTQSA-N	0	3	332.492	3.275	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cccc2c1OCC2(C)C	ZINC001086005408	1358959550	/nfs/dbraw/zinc/95/95/50/1358959550.db2.gz	DRQRYMKAINBANE-MRXNPFEDSA-N	0	3	342.483	3.469	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2oc(C(F)F)cc2C)C1	ZINC001086112380	1359000225	/nfs/dbraw/zinc/00/02/25/1359000225.db2.gz	GUUSQKQJNACMFB-PHIMTYICSA-N	0	3	332.778	3.376	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2oc3ccccc3c2OC)C1	ZINC001086165812	1359012795	/nfs/dbraw/zinc/01/27/95/1359012795.db2.gz	JTQUXWPMRIRBNV-BETUJISGSA-N	0	3	348.830	3.292	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc(Cl)ccc2OC)C1	ZINC001086266973	1359048595	/nfs/dbraw/zinc/04/85/95/1359048595.db2.gz	FRMJVCOHGZDAKR-BJHJDKERSA-N	0	3	343.254	3.199	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cnc(C(C)C)s2)C1	ZINC001086287820	1359055667	/nfs/dbraw/zinc/05/56/67/1359055667.db2.gz	SUKBYFMLAUHYOF-TXEJJXNPSA-N	0	3	327.881	3.117	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@H](CNC(=O)c3ccsc3)C2)c(F)c1	ZINC001086303974	1359062039	/nfs/dbraw/zinc/06/20/39/1359062039.db2.gz	GTBKTTLSPMGWAB-SAZUREKKSA-N	0	3	343.427	3.057	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@H](CNC(=O)[C@@H]3CC=CCC3)C2)c1	ZINC001086306688	1359063057	/nfs/dbraw/zinc/06/30/57/1359063057.db2.gz	QGYBFQNUUKHJJV-JFIYKMOQSA-N	0	3	341.430	3.038	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(C)c(Cl)c2)C1	ZINC001086467053	1359108479	/nfs/dbraw/zinc/10/84/79/1359108479.db2.gz	JWMJHYMRGDVNJD-MQMHXKEQSA-N	0	3	327.255	3.499	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(Cl)c(OC)c2)C1	ZINC001086496959	1359120462	/nfs/dbraw/zinc/12/04/62/1359120462.db2.gz	OMJHMKLQGKBSKM-AULYBMBSSA-N	0	3	343.254	3.199	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@@H]2C[C@H]2c2ccccc2C)C1	ZINC001086503224	1359122095	/nfs/dbraw/zinc/12/20/95/1359122095.db2.gz	IVLZCIFFBCLDGU-UOVPBQLFSA-N	0	3	332.875	3.335	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccccc2OCC2CC2)C1	ZINC001086557661	1359144640	/nfs/dbraw/zinc/14/46/40/1359144640.db2.gz	ADJYMGRHCBZOAV-WKILWMFISA-N	0	3	348.874	3.326	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2cccc(F)c2)C1	ZINC001086572959	1359152154	/nfs/dbraw/zinc/15/21/54/1359152154.db2.gz	VPHHHCJRFHJMSQ-VQTJNVASSA-N	0	3	336.410	3.047	20	30		EGEDHN
C=CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2cc(C)sn2)C1	ZINC001086585702	1359156368	/nfs/dbraw/zinc/15/63/68/1359156368.db2.gz	LJNXPCPLMJQKOL-FUHWJXTLSA-N	0	3	341.480	3.225	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2ccccc2CC)C1	ZINC001086606747	1359162593	/nfs/dbraw/zinc/16/25/93/1359162593.db2.gz	VZKQMKJBEXWYOB-FCHUYYIVSA-N	0	3	346.474	3.470	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cc3c(cn2)CCCC3)C1	ZINC001086751218	1359195045	/nfs/dbraw/zinc/19/50/45/1359195045.db2.gz	DFEPTNRUUKCJCD-WMLDXEAASA-N	0	3	347.890	3.201	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cc(F)c(F)cc2F)C1	ZINC001086789430	1359201619	/nfs/dbraw/zinc/20/16/19/1359201619.db2.gz	MWQRLEOKQXVOCM-WDEREUQCSA-N	0	3	346.780	3.345	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CC[C@@H](N[C@@H](C)c3cnccn3)C2)CC1	ZINC001086794865	1359203276	/nfs/dbraw/zinc/20/32/76/1359203276.db2.gz	OEWBDSMUJJGTNB-XYJFISCASA-N	0	3	342.487	3.159	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)NC[C@H]1CC[C@@H](NCc2ccccc2C#N)C1	ZINC001086796409	1359203578	/nfs/dbraw/zinc/20/35/78/1359203578.db2.gz	MIQXWITWOWDEJW-LNKGRISISA-N	0	3	339.483	3.369	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)[C@H]2CCCC(F)(F)C2)C1	ZINC001086800857	1359204587	/nfs/dbraw/zinc/20/45/87/1359204587.db2.gz	FRGZDTGKLCLIKK-MELADBBJSA-N	0	3	334.838	3.439	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2sc(C)nc2C)C1	ZINC001086871483	1359218532	/nfs/dbraw/zinc/21/85/32/1359218532.db2.gz	HCISUUUIWPAIPZ-QWHCGFSZSA-N	0	3	327.881	3.001	20	30		EGEDHN
C[C@H](C(=O)NCC1(NCc2cccc(C#N)c2)CC1)c1cccs1	ZINC001323542681	1387384394	/nfs/dbraw/zinc/38/43/94/1387384394.db2.gz	RFNUMTAQWCRHSF-AWEZNQCLSA-N	0	3	339.464	3.162	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3cc(F)ccc3F)C2)CC1	ZINC001086927020	1359251808	/nfs/dbraw/zinc/25/18/08/1359251808.db2.gz	QFESKZOZCLSYBD-HNNXBMFYSA-N	0	3	346.421	3.305	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc(C)c(F)c3)C2)CC1	ZINC001086931883	1359255836	/nfs/dbraw/zinc/25/58/36/1359255836.db2.gz	UTGUFZTWLCBNDV-KRWDZBQOSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)C[C@H]3CCCC3(F)F)C2)CC1	ZINC001086939196	1359261678	/nfs/dbraw/zinc/26/16/78/1359261678.db2.gz	KCOVCPVBPRKIKO-JKSUJKDBSA-N	0	3	338.442	3.148	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H](C)c3ccc(C)o3)C2)CC1	ZINC001086946984	1359267922	/nfs/dbraw/zinc/26/79/22/1359267922.db2.gz	NLBIEVUGCWRAOA-RDJZCZTQSA-N	0	3	328.456	3.028	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3cncc(Cl)c3)C2)CC1	ZINC001086947744	1359269125	/nfs/dbraw/zinc/26/91/25/1359269125.db2.gz	GMRWXDXVTYRVFF-HNNXBMFYSA-N	0	3	345.874	3.075	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3csc(C)c3)C2)CC1	ZINC001086948576	1359269796	/nfs/dbraw/zinc/26/97/96/1359269796.db2.gz	BZAKIPGNBMDMQR-OAHLLOKOSA-N	0	3	330.497	3.396	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc4ccn(C)c4c3)C2)CC1	ZINC001086951765	1359272207	/nfs/dbraw/zinc/27/22/07/1359272207.db2.gz	PHTRKJFFMXCDRE-QGZVFWFLSA-N	0	3	349.478	3.128	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)Cc3cc(C)ccc3F)C2)CC1	ZINC001086953788	1359274316	/nfs/dbraw/zinc/27/43/16/1359274316.db2.gz	SLEVWDGSAFROTL-KRWDZBQOSA-N	0	3	342.458	3.013	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)Cc3ccccc3Cl)C2)CC1	ZINC001086955308	1359276309	/nfs/dbraw/zinc/27/63/09/1359276309.db2.gz	KJDMTUSSQJEZLK-MRXNPFEDSA-N	0	3	344.886	3.219	20	30		EGEDHN
C[C@@H]1CCN(C(=O)[C@H]2CC2(C)C)[C@H](CNCc2ccc(C#N)s2)C1	ZINC001087151074	1359308011	/nfs/dbraw/zinc/30/80/11/1359308011.db2.gz	WBEWWYXSUHIBQN-JKIFEVAISA-N	0	3	345.512	3.383	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CC[C@@H](C)C[C@H]2CNCc2cccnc2)cc1	ZINC001087197181	1359317678	/nfs/dbraw/zinc/31/76/78/1359317678.db2.gz	BBWQWKNPNBHVKY-UTKZUKDTSA-N	0	3	347.462	3.093	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](CNCc2csc(CC)n2)[C@@H](C)C1	ZINC001184079117	1387389765	/nfs/dbraw/zinc/38/97/65/1387389765.db2.gz	TYZQIVHIIJLPBT-LSDHHAIUSA-N	0	3	335.517	3.246	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1sccc1C	ZINC001087265330	1359334860	/nfs/dbraw/zinc/33/48/60/1359334860.db2.gz	SWDIGPCVPAJRHH-HYVNUMGLSA-N	0	3	330.497	3.299	20	30		EGEDHN
CC(C)C(=O)N[C@@H]1[C@H]2CCCN(Cc3ccc(C#N)cc3)[C@H]2C1(C)C	ZINC001087274228	1359348089	/nfs/dbraw/zinc/34/80/89/1359348089.db2.gz	MUAOOKGRHDOEHX-GUDVDZBRSA-N	0	3	339.483	3.319	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3cccc(C)c3F)C(C)(C)[C@H]21	ZINC001087287416	1359365732	/nfs/dbraw/zinc/36/57/32/1359365732.db2.gz	HGEHKMOVSAMPDE-NEWSRXKRSA-N	0	3	342.458	3.376	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3sc(C)cc3C)C(C)(C)[C@H]21	ZINC001087289993	1359368994	/nfs/dbraw/zinc/36/89/94/1359368994.db2.gz	VQZUPPMVXODTRA-OIISXLGYSA-N	0	3	330.497	3.217	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cccc4ncccc43)C(C)(C)[C@H]21	ZINC001087299048	1359381217	/nfs/dbraw/zinc/38/12/17/1359381217.db2.gz	PDSSRVQQTQQOKB-HOJAQTOUSA-N	0	3	347.462	3.087	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(C)cc3F)C(C)(C)[C@H]21	ZINC001087305735	1359390856	/nfs/dbraw/zinc/39/08/56/1359390856.db2.gz	XRRNQMWXOHENBM-QRQLOZEOSA-N	0	3	342.458	3.376	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc(Cl)cs1	ZINC001087307090	1359394071	/nfs/dbraw/zinc/39/40/71/1359394071.db2.gz	TVYCYOJULNZHQE-VHDGCEQUSA-N	0	3	336.888	3.254	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc4c(c3)C=CCC4)C(C)(C)[C@@H]21	ZINC001087307774	1359394951	/nfs/dbraw/zinc/39/49/51/1359394951.db2.gz	GQUCEMJOAMVZNQ-NJDAHSKKSA-N	0	3	348.490	3.498	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(Cl)cc3)C(C)(C)[C@H]21	ZINC001087313853	1359402896	/nfs/dbraw/zinc/40/28/96/1359402896.db2.gz	BAGWJUFPBJHEQD-ZACQAIPSSA-N	0	3	330.859	3.192	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)C3CCC(C)(C)CC3)C(C)(C)[C@H]21	ZINC001087318699	1359410947	/nfs/dbraw/zinc/41/09/47/1359410947.db2.gz	BKOAGZSNUFFGND-KURKYZTESA-N	0	3	330.516	3.441	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cnc(C(C)C)s3)C(C)(C)[C@H]21	ZINC001087320434	1359412950	/nfs/dbraw/zinc/41/29/50/1359412950.db2.gz	DUURQMCQAYFHAL-BMFZPTHFSA-N	0	3	345.512	3.119	20	30		EGEDHN
C#CCCN1CC[C@H](c2cccc(F)c2)[C@H](NC(=O)C=C2CCC2)C1	ZINC001087454574	1359474567	/nfs/dbraw/zinc/47/45/67/1359474567.db2.gz	ZFIOTNWFACEIFK-WOJBJXKFSA-N	0	3	340.442	3.233	20	30		EGEDHN
C=CCCN1CC[C@H](c2cccc(F)c2)[C@H](NC(=O)[C@H]2CC23CC3)C1	ZINC001087458505	1359475075	/nfs/dbraw/zinc/47/50/75/1359475075.db2.gz	FLMILMFTKHGAIY-GUDVDZBRSA-N	0	3	342.458	3.476	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ocnc2-c2ccccc2)[C@H]1CC	ZINC001087596892	1359548404	/nfs/dbraw/zinc/54/84/04/1359548404.db2.gz	CYCLLQQRWGRXFV-JKSUJKDBSA-N	0	3	325.412	3.110	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccc3oc(C)nc3c2)[C@H]1CC	ZINC001087618151	1359556346	/nfs/dbraw/zinc/55/63/46/1359556346.db2.gz	DVTXVADFPBDAQW-DOTOQJQBSA-N	0	3	327.428	3.295	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cnn(C(C)C)c2Cl)[C@H]1CC	ZINC001087674306	1359583101	/nfs/dbraw/zinc/58/31/01/1359583101.db2.gz	BSFUWFJXOCBEMY-LSDHHAIUSA-N	0	3	338.883	3.276	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2ccc(C(C)(C)C)cc2)[C@H]1CC	ZINC001087741156	1359621612	/nfs/dbraw/zinc/62/16/12/1359621612.db2.gz	SMCMKXPONIQYGO-RBUKOAKNSA-N	0	3	326.484	3.129	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cnn(CC3CCCC3)c2)[C@H]1CC	ZINC001087775078	1359637732	/nfs/dbraw/zinc/63/77/32/1359637732.db2.gz	ZPHQUMJKSKJCLT-RBUKOAKNSA-N	0	3	344.503	3.232	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2ccsc2C(F)(F)F)[C@H]1CC	ZINC001087811131	1359659215	/nfs/dbraw/zinc/65/92/15/1359659215.db2.gz	CRBRJVPITGLONB-QWHCGFSZSA-N	0	3	344.402	3.373	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)Cc2ccc3c(c2)CCCC3)[C@H]1CC	ZINC001087824315	1359666430	/nfs/dbraw/zinc/66/64/30/1359666430.db2.gz	VPACSPWVAPBRMZ-VQTJNVASSA-N	0	3	326.484	3.263	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)C[C@@H](C)c3cccc(F)c3)C[C@@H]2C1	ZINC001088100667	1359756655	/nfs/dbraw/zinc/75/66/55/1359756655.db2.gz	WWGWCXAGACFURW-QRQLOZEOSA-N	0	3	342.458	3.123	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)C(C)(C)c3ccc(C)cc3)C[C@@H]2C1	ZINC001088175283	1359780609	/nfs/dbraw/zinc/78/06/09/1359780609.db2.gz	OFUVIRNFLBEBND-MOPGFXCFSA-N	0	3	338.495	3.076	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](CNCc2nc(C)cs2)[C@H](C)C1	ZINC001184209721	1387415392	/nfs/dbraw/zinc/41/53/92/1387415392.db2.gz	PWOCAWKLNXCFTI-WBVHZDCISA-N	0	3	347.528	3.219	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3c[nH]c4c3cccc4CC)C[C@@H]2C1	ZINC001088212440	1359797884	/nfs/dbraw/zinc/79/78/84/1359797884.db2.gz	LZNDAZDLKBZGEZ-MSOLQXFVSA-N	0	3	349.478	3.148	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCCCN(C(=O)C(C)(C)F)C1	ZINC001088247371	1359817413	/nfs/dbraw/zinc/81/74/13/1359817413.db2.gz	QFPVVJFJMFSZEK-GFCCVEGCSA-N	0	3	335.261	3.004	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCCCN(C(=O)[C@H](C)SC)C1	ZINC001088267485	1359822184	/nfs/dbraw/zinc/82/21/84/1359822184.db2.gz	VWJMHCPKPFEGLI-QWHCGFSZSA-N	0	3	349.338	3.007	20	30		EGEDHN
C=C(Br)CN[C@H]1CCCCCN(C(=O)C2CC(C)C2)C1	ZINC001088293888	1359828189	/nfs/dbraw/zinc/82/81/89/1359828189.db2.gz	JFMMZSJQYFKDDO-ZALBZXLWSA-N	0	3	343.309	3.302	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)[C@H]2CCc3cccnc32)C1	ZINC001088370102	1359853061	/nfs/dbraw/zinc/85/30/61/1359853061.db2.gz	AHGCJKREJDAZMB-SJORKVTESA-N	0	3	347.890	3.225	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2ccc(Cl)cn2)C1	ZINC001088416065	1359885876	/nfs/dbraw/zinc/88/58/76/1359885876.db2.gz	BYXGXKYTZDOAKS-AWEZNQCLSA-N	0	3	342.270	3.462	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)[C@@H]2COc3ccccc32)C1	ZINC001088433782	1359902189	/nfs/dbraw/zinc/90/21/89/1359902189.db2.gz	FTEVTWILDPFVQP-NVXWUHKLSA-N	0	3	348.874	3.276	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2c[nH]nc2C2CCCCC2)[C@H]1C	ZINC001088972871	1360120521	/nfs/dbraw/zinc/12/05/21/1360120521.db2.gz	ILVRDALFVRHCEH-PBHICJAKSA-N	0	3	330.476	3.226	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)C[C@H]2CCc3ccccc3C2)[C@H]1C	ZINC001089001477	1360132991	/nfs/dbraw/zinc/13/29/91/1360132991.db2.gz	JJKKZYTXOONTIO-UWVAXJGDSA-N	0	3	326.484	3.337	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)C(C)(C)c2ccc(OC)cc2)[C@H]1C	ZINC001089055599	1360150969	/nfs/dbraw/zinc/15/09/69/1360150969.db2.gz	SGFQYUCMARXBTF-QAPCUYQASA-N	0	3	330.472	3.128	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCCC[C@H]1CN(C)Cc1ccc(C#N)cc1	ZINC001089124149	1360186916	/nfs/dbraw/zinc/18/69/16/1360186916.db2.gz	SNJNFZIKKDIIDR-LPHOPBHVSA-N	0	3	327.472	3.417	20	30		EGEDHN
Cc1ccc(F)cc1CN(C)C[C@@H]1CCCCN1C(=O)[C@H](C)C#N	ZINC001089139549	1360196844	/nfs/dbraw/zinc/19/68/44/1360196844.db2.gz	DXAVLKQUNVXGJQ-QAPCUYQASA-N	0	3	331.435	3.107	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCCN1C(=O)/C=C/C1CC1	ZINC001089145115	1360199903	/nfs/dbraw/zinc/19/99/03/1360199903.db2.gz	KOKXXKGPQZKZLT-CFGKVWFZSA-N	0	3	337.467	3.337	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@@H]2C[C@]2(C)c2ccccc2)CC(C)(C)C1	ZINC001089447617	1360436833	/nfs/dbraw/zinc/43/68/33/1360436833.db2.gz	JDAPFNZLRHDHKU-XQBPLPMBSA-N	0	3	338.495	3.204	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc([C@H](C)CC)no2)CC(C)(C)C1	ZINC001089509401	1360481097	/nfs/dbraw/zinc/48/10/97/1360481097.db2.gz	BOXOQVUPUKUAPE-HZPDHXFCSA-N	0	3	345.487	3.432	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cccc3ccncc32)CC(C)(C)C1	ZINC001089530600	1360492615	/nfs/dbraw/zinc/49/26/15/1360492615.db2.gz	DHGGKAGJGSRSKY-KRWDZBQOSA-N	0	3	335.451	3.088	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc3ccn(C)c3c2)CC(C)(C)C1	ZINC001089535854	1360495276	/nfs/dbraw/zinc/49/52/76/1360495276.db2.gz	VPNGXEZHERIUFT-GOSISDBHSA-N	0	3	337.467	3.032	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2occ3c2CCCC3)CC(C)(C)C1	ZINC001089549373	1360503171	/nfs/dbraw/zinc/50/31/71/1360503171.db2.gz	XJBJMVMFHBMSIK-MRXNPFEDSA-N	0	3	328.456	3.012	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc3c(s2)CCCC3)CC(C)(C)C1	ZINC001089557241	1360506469	/nfs/dbraw/zinc/50/64/69/1360506469.db2.gz	YZTIGBUZILTJOL-MRXNPFEDSA-N	0	3	344.524	3.481	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H]1CCCc2n[nH]cc21	ZINC001089641808	1360554295	/nfs/dbraw/zinc/55/42/95/1360554295.db2.gz	UEKYMTWTJGMTSQ-CVEARBPZSA-N	0	3	344.503	3.013	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cn2c(n1)CCCC2	ZINC001089648347	1360561135	/nfs/dbraw/zinc/56/11/35/1360561135.db2.gz	JPKPLWBKWNCIEO-MRXNPFEDSA-N	0	3	344.503	3.016	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(C(C)C)nc1	ZINC001089652030	1360564837	/nfs/dbraw/zinc/56/48/37/1360564837.db2.gz	UPLWXLJUJIQLIO-GOSISDBHSA-N	0	3	341.499	3.449	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1c2c[nH]nc2ccc1C	ZINC001089664107	1360574129	/nfs/dbraw/zinc/57/41/29/1360574129.db2.gz	ZSFTXAQOBSTZKL-OAHLLOKOSA-N	0	3	340.471	3.278	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)[C@H]1Cc2ccccc2O1	ZINC001089668549	1360578800	/nfs/dbraw/zinc/57/88/00/1360578800.db2.gz	XUFYMYUSPSYETJ-PKOBYXMFSA-N	0	3	342.483	3.173	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(C)nc1OC	ZINC001089705412	1360608485	/nfs/dbraw/zinc/60/84/85/1360608485.db2.gz	FGOCQORDLFRJPO-INIZCTEOSA-N	0	3	345.487	3.195	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)[C@H]1CCOc2ccccc21	ZINC001089710130	1360613982	/nfs/dbraw/zinc/61/39/82/1360613982.db2.gz	BOTLREVSHVXKTF-WMZOPIPTSA-N	0	3	342.483	3.346	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ncoc1C1CC1	ZINC001089721284	1360623867	/nfs/dbraw/zinc/62/38/67/1360623867.db2.gz	GBBQEXOSLKDZRV-OAHLLOKOSA-N	0	3	331.460	3.349	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1coc(CCC)n1	ZINC001089726088	1360629047	/nfs/dbraw/zinc/62/90/47/1360629047.db2.gz	MZACOCDPNLKZOS-HNNXBMFYSA-N	0	3	333.476	3.424	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1cc[nH]c1CC	ZINC001089809733	1360672820	/nfs/dbraw/zinc/67/28/20/1360672820.db2.gz	TUAYVPCHBWVDHQ-ZDRJDWQYSA-N	0	3	347.890	3.112	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C12CCC(CC1)C2	ZINC001089826022	1360682041	/nfs/dbraw/zinc/68/20/41/1360682041.db2.gz	FOWBOGONNSBYPL-AXKMMPPPSA-N	0	3	348.918	3.488	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)C2(CF)CCC2)C1	ZINC001089867445	1360709690	/nfs/dbraw/zinc/70/96/90/1360709690.db2.gz	JFOSIRSMPTYRFH-VGWMRTNUSA-N	0	3	340.870	3.048	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C(C)=C2CCC2)CC2(CCOCC2)C1	ZINC001089934941	1360751901	/nfs/dbraw/zinc/75/19/01/1360751901.db2.gz	KNZWHXJTONGPNP-SFHVURJKSA-N	0	3	332.488	3.050	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](CNCc2ncc(C)s2)[C@H](C)C1	ZINC001184497998	1387473079	/nfs/dbraw/zinc/47/30/79/1387473079.db2.gz	OHOAQVKVEJVILW-ZBFHGGJFSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C(C)CN1CC[C@@H](NC(=O)c2ccccc2C(C)(C)CC)[C@@H](O)C1	ZINC001090348494	1360894756	/nfs/dbraw/zinc/89/47/56/1360894756.db2.gz	YGARPARHDZCUOS-MOPGFXCFSA-N	0	3	344.499	3.115	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)c2cscc2C)C1	ZINC001090974777	1360966143	/nfs/dbraw/zinc/96/61/43/1360966143.db2.gz	FCECHSRXJUEGAM-UHFFFAOYSA-N	0	3	343.290	3.063	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2nsc3ccc(C)cc32)C1	ZINC001091181701	1361001094	/nfs/dbraw/zinc/00/10/94/1361001094.db2.gz	RRBGNDUQLRDXIP-UHFFFAOYSA-N	0	3	349.887	3.455	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc3cnccc3c2)C1	ZINC001091312986	1361040541	/nfs/dbraw/zinc/04/05/41/1361040541.db2.gz	VTHINGHKVLEASQ-UHFFFAOYSA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C23CC4CC(CC(C4)C2)C3)C1	ZINC001091338940	1361050851	/nfs/dbraw/zinc/05/08/51/1361050851.db2.gz	ORTRIFQCEXCEPD-UHFFFAOYSA-N	0	3	336.907	3.440	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2csc(CC(C)C)n2)C1	ZINC001091388601	1361075147	/nfs/dbraw/zinc/07/51/47/1361075147.db2.gz	MDLXZAZQAVYWCT-UHFFFAOYSA-N	0	3	341.908	3.192	20	30		EGEDHN
C[C@@]12CN(Cc3ccc(C#N)cc3)C[C@@H]1CN(C(=O)C[C@H]1C=CCC1)C2	ZINC001091466033	1361108361	/nfs/dbraw/zinc/10/83/61/1361108361.db2.gz	ZJFFBZGBUJLFEJ-WEYGHZABSA-N	0	3	349.478	3.195	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CN(Cc3c(C)noc3C)C[C@@]2(C)C1	ZINC001091909859	1361243376	/nfs/dbraw/zinc/24/33/76/1361243376.db2.gz	AJWPUANAWHCMOD-UZLBHIALSA-N	0	3	345.487	3.174	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)CCc3cc(C)cc(C)c3)C[C@]2(C)C1	ZINC001092174538	1361315775	/nfs/dbraw/zinc/31/57/75/1361315775.db2.gz	BQYWSYDUTCDFSR-IRLDBZIGSA-N	0	3	338.495	3.040	20	30		EGEDHN
C[C@@H]1CN(C(=O)C[C@H]2C=CCC2)C[C@H]1CNCc1ccccc1C#N	ZINC001093627334	1361663045	/nfs/dbraw/zinc/66/30/45/1361663045.db2.gz	CHDLBPAAKBUYNC-FUHIMQAGSA-N	0	3	337.467	3.099	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cccc(Cl)c3F)CCC[C@@H]12	ZINC001094500990	1361833026	/nfs/dbraw/zinc/83/30/26/1361833026.db2.gz	CBIVFJJIENTAFF-CRAIPNDOSA-N	0	3	334.822	3.087	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cc(F)cc(Cl)c3)CCC[C@@H]12	ZINC001094522827	1361842372	/nfs/dbraw/zinc/84/23/72/1361842372.db2.gz	HDKWKLKLLREPSA-SJLPKXTDSA-N	0	3	334.822	3.087	20	30		EGEDHN
Cc1cccc([C@H](C)N2[C@@H]3CC[C@H]2[C@@H](NC(=O)c2cc(C#N)c[nH]2)C3)c1	ZINC001095285206	1362083449	/nfs/dbraw/zinc/08/34/49/1362083449.db2.gz	IHZYFHXDAUAHQG-MKNHVETJSA-N	0	3	348.450	3.291	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc3cc(F)ccc3[nH]1)C2	ZINC001095847919	1362253416	/nfs/dbraw/zinc/25/34/16/1362253416.db2.gz	UKDOEXPRCFFTJG-HFTRVMKXSA-N	0	3	327.403	3.218	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1c(Cl)cncc1Cl)C2	ZINC001095965588	1362312546	/nfs/dbraw/zinc/31/25/46/1362312546.db2.gz	WKGMQPHSHCIDRZ-SWHYSGLUSA-N	0	3	340.254	3.300	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C1CCC(C(F)F)CC1)C2	ZINC001096455448	1362518033	/nfs/dbraw/zinc/51/80/33/1362518033.db2.gz	ZIOZHFLKWWLKLB-NCOXYXGASA-N	0	3	326.431	3.356	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1csc3c1CC[C@H](C)C3)C2	ZINC001096481329	1362530162	/nfs/dbraw/zinc/53/01/62/1362530162.db2.gz	VJKKAUYANNBDIW-DACLVMHWSA-N	0	3	342.508	3.231	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](CNCc2nc(C)cs2)[C@@H](C)C1	ZINC001184977865	1387578046	/nfs/dbraw/zinc/57/80/46/1387578046.db2.gz	FSBXRBOTEUMZEQ-RDJZCZTQSA-N	0	3	347.528	3.219	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1c[nH]cc1-c1ccccc1)C2	ZINC001096544078	1362568928	/nfs/dbraw/zinc/56/89/28/1362568928.db2.gz	AZGTVFPFZSWQBB-UXPWSPDFSA-N	0	3	333.435	3.040	20	30		EGEDHN
Cc1cc(C)cc(CN2[C@@H]3CC[C@H]2[C@H](NC(=O)c2ccc(C#N)[nH]2)C3)c1	ZINC001096971622	1362798836	/nfs/dbraw/zinc/79/88/36/1362798836.db2.gz	SDUXKIJIVGKLBH-RLLQIKCJSA-N	0	3	348.450	3.039	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CC[C@@H](C)F	ZINC001097357305	1362950231	/nfs/dbraw/zinc/95/02/31/1362950231.db2.gz	KOFSGQACIXWNOP-AHCXZYCDSA-N	0	3	346.446	3.335	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cn1c(C)cc3ccccc31)C2	ZINC001097476085	1363010823	/nfs/dbraw/zinc/01/08/23/1363010823.db2.gz	OXPZCOAIASNAQN-GGPKGHCWSA-N	0	3	337.467	3.247	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc3cc(Cl)ccc3[nH]1)C2	ZINC001097623159	1363079181	/nfs/dbraw/zinc/07/91/81/1363079181.db2.gz	NGSIMSOIZIFVHG-KYJSFNMBSA-N	0	3	341.842	3.180	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccccc1O[C@@H](C)CC)C2	ZINC001097945977	1363175130	/nfs/dbraw/zinc/17/51/30/1363175130.db2.gz	AIHCXFADNQGQNC-ISARSNTHSA-N	0	3	340.467	3.222	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](CNCc3cnc(C)o3)[C@H](C)C2)CCC1	ZINC001185093806	1387617076	/nfs/dbraw/zinc/61/70/76/1387617076.db2.gz	DAFUWAGLTPJYPK-WBVHZDCISA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1coc(-c3ccccc3)n1)C2	ZINC001098233927	1363264210	/nfs/dbraw/zinc/26/42/10/1363264210.db2.gz	ABBNVMYOBOJINO-NUJGCVRESA-N	0	3	337.423	3.253	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc3nc(C)ccc3o1)C2	ZINC001098255097	1363272839	/nfs/dbraw/zinc/27/28/39/1363272839.db2.gz	YNYNFAWWKZYNIA-INMHGKMJSA-N	0	3	339.439	3.438	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H]1Cc3ccc(Cl)cc31)C2	ZINC001098305994	1363292428	/nfs/dbraw/zinc/29/24/28/1363292428.db2.gz	SWHGMZFKVWPKKY-DDBAPUKQSA-N	0	3	330.859	3.277	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(F)c3occc31)C2	ZINC001098438578	1363325939	/nfs/dbraw/zinc/32/59/39/1363325939.db2.gz	UFLWATXBLDBLOM-JLZZUVOBSA-N	0	3	328.387	3.483	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H]1Cc3c1cccc3Cl)C2	ZINC001098482111	1363339357	/nfs/dbraw/zinc/33/93/57/1363339357.db2.gz	QSHHVMBHUKLWLN-QVDUIBETSA-N	0	3	330.859	3.277	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccc(F)cc1C)C[C@@H](C)O2	ZINC001098654757	1363419953	/nfs/dbraw/zinc/41/99/53/1363419953.db2.gz	GHLZJZHFEMBIQD-MRXNPFEDSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H](C)c1ccccc1)C[C@H](C)O2	ZINC001098655039	1363420528	/nfs/dbraw/zinc/42/05/28/1363420528.db2.gz	ILHWKRVYRCDGAB-ROUUACIJSA-N	0	3	342.483	3.058	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1sccc1CC)C[C@H](C)O2	ZINC001098662876	1363424918	/nfs/dbraw/zinc/42/49/18/1363424918.db2.gz	OFFIIFLHUFJQAY-HNNXBMFYSA-N	0	3	348.512	3.192	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1c(C)cccc1F)C[C@@H](C)O2	ZINC001098668075	1363427678	/nfs/dbraw/zinc/42/76/78/1363427678.db2.gz	FHTAVGMVWGPJOS-MRXNPFEDSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(C)c(OC)c(C)c2)C1	ZINC001098850785	1363491855	/nfs/dbraw/zinc/49/18/55/1363491855.db2.gz	NCHNDJNCFCRDGP-PXNSSMCTSA-N	0	3	328.456	3.082	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@H]1CC=CCC1	ZINC001098881340	1363504157	/nfs/dbraw/zinc/50/41/57/1363504157.db2.gz	ZJRNBTAATHRASK-ROUUACIJSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2cnc3ccsc3c2)C1	ZINC001098974343	1363549513	/nfs/dbraw/zinc/54/95/13/1363549513.db2.gz	QBCNRTYKONFBSP-KXBFYZLASA-N	0	3	341.480	3.457	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC[C@@H]1CCC(C)(C)CN1CCc1ccccc1F	ZINC001098981892	1363555477	/nfs/dbraw/zinc/55/54/77/1363555477.db2.gz	GTJPLOVTKWXDHP-RDJZCZTQSA-N	0	3	345.462	3.135	20	30		EGEDHN
CC(C)(C)C#CC(=O)NC[C@H]1CCC(C)(C)CN1C[C@@H]1CCCCO1	ZINC001099070321	1363606453	/nfs/dbraw/zinc/60/64/53/1363606453.db2.gz	VUUFLCQGTNUVMP-MSOLQXFVSA-N	0	3	348.531	3.212	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H]2C[C@H]2c2ccc(C)s2)C1	ZINC001099071544	1363607417	/nfs/dbraw/zinc/60/74/17/1363607417.db2.gz	BBTURIBMZRDCEN-XLSPSMHOSA-N	0	3	342.508	3.154	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)C(C)(C)[C@@H]1CCCCO1	ZINC001099080492	1363611888	/nfs/dbraw/zinc/61/18/88/1363611888.db2.gz	QPCSKLLSZDDZCG-MSOLQXFVSA-N	0	3	348.531	3.212	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)C(C)(C)C(C)C	ZINC001099092329	1363617850	/nfs/dbraw/zinc/61/78/50/1363617850.db2.gz	COHSNMUIHIFMBM-KRWDZBQOSA-N	0	3	338.536	3.478	20	30		EGEDHN
CN1CCC[C@@H](CNC(=O)C#Cc2cccs2)[C@H]1c1cccs1	ZINC001324476956	1387636476	/nfs/dbraw/zinc/63/64/76/1387636476.db2.gz	YRZGPCPBRTZJKC-KSSFIOAISA-N	0	3	344.505	3.360	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@@H]1CCC(C)(C)CN1CCn1cccn1	ZINC001099187989	1363680127	/nfs/dbraw/zinc/68/01/27/1363680127.db2.gz	AQBJJTNJTGIGPR-MSOLQXFVSA-N	0	3	346.519	3.092	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@H]1CCC(C)(C)CN1CCn1cccn1	ZINC001099187992	1363680183	/nfs/dbraw/zinc/68/01/83/1363680183.db2.gz	AQBJJTNJTGIGPR-ZWKOTPCHSA-N	0	3	346.519	3.092	20	30		EGEDHN
CC#CCCCC(=O)NC[C@H]1CCC(C)(C)CN1CCOC1CCC1	ZINC001099189816	1363682477	/nfs/dbraw/zinc/68/24/77/1363682477.db2.gz	XLLNAQVZXVHXJG-GOSISDBHSA-N	0	3	348.531	3.356	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)C1(CCC)CC1	ZINC001099230812	1363703995	/nfs/dbraw/zinc/70/39/95/1363703995.db2.gz	XGWIKWXPWNFULK-QGZVFWFLSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2oc(C)cc2C)C[C@H]1C(F)(F)F	ZINC001099234756	1363705249	/nfs/dbraw/zinc/70/52/49/1363705249.db2.gz	YLENDAIHBUPUHQ-CHWSQXEVSA-N	0	3	330.350	3.065	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)Cc1ccncc1Cl	ZINC001099239128	1363708172	/nfs/dbraw/zinc/70/81/72/1363708172.db2.gz	AINULPSWXQCVAE-OAHLLOKOSA-N	0	3	335.879	3.070	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@H]2CCCC3(CC3)C2)C[C@H]1C(F)(F)F	ZINC001099252270	1363715266	/nfs/dbraw/zinc/71/52/66/1363715266.db2.gz	KSYFHBOGRWIWIG-BFHYXJOUSA-N	0	3	330.394	3.122	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2cscc2Cl)C[C@H]1C(F)(F)F	ZINC001099265091	1363722611	/nfs/dbraw/zinc/72/26/11/1363722611.db2.gz	AYMIVEOXYHNMIF-MWLCHTKSSA-N	0	3	338.782	3.180	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)Cc2ccc(C)cc2)C[C@H]1C(F)(F)F	ZINC001099276872	1363727763	/nfs/dbraw/zinc/72/77/63/1363727763.db2.gz	LTDCTKXAUKHWDL-HZPDHXFCSA-N	0	3	340.389	3.093	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@H]2CC[C@@H]3C[C@@H]3CC2)C[C@H]1C(F)(F)F	ZINC001099283584	1363731470	/nfs/dbraw/zinc/73/14/70/1363731470.db2.gz	FJXFHEXMEYINSX-YIDVYQOGSA-N	0	3	344.421	3.368	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)CCc1scnc1C	ZINC001099286331	1363733324	/nfs/dbraw/zinc/73/33/24/1363733324.db2.gz	UTGMONVEAATPBE-HNNXBMFYSA-N	0	3	335.517	3.177	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2ccc(CCC)cc2)C[C@H]1C(F)(F)F	ZINC001099299674	1363738072	/nfs/dbraw/zinc/73/80/72/1363738072.db2.gz	ISOMWQMXYANDET-HZPDHXFCSA-N	0	3	340.389	3.418	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2ccc(C)c(Cl)c2)C[C@H]1C(F)(F)F	ZINC001099301504	1363738707	/nfs/dbraw/zinc/73/87/07/1363738707.db2.gz	JQMOTHOCDFJTKT-TZMCWYRMSA-N	0	3	346.780	3.427	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)COc1ccc(C)cc1	ZINC001099329873	1363753922	/nfs/dbraw/zinc/75/39/22/1363753922.db2.gz	WNZKVJYIHZRPKO-QGZVFWFLSA-N	0	3	330.472	3.167	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2cc3ccccc3o2)C[C@H]1C(F)(F)F	ZINC001099340472	1363760885	/nfs/dbraw/zinc/76/08/85/1363760885.db2.gz	UIUUZUXVJICINQ-CHWSQXEVSA-N	0	3	338.329	3.211	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)CCc2ccc(C)o2)C[C@H]1C(F)(F)F	ZINC001099345588	1363763404	/nfs/dbraw/zinc/76/34/04/1363763404.db2.gz	JSDGDUZSFPKIJV-HUUCEWRRSA-N	0	3	344.377	3.076	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)[C@@H](C)CC2CCCC2)CC2(CCOCC2)C1	ZINC001099594484	1363877370	/nfs/dbraw/zinc/87/73/70/1363877370.db2.gz	DSTAQTOLURDQAN-PKOBYXMFSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CCN(Cc2ccc(C(C)C)cc2)C[C@@H]1O	ZINC001099855153	1363965468	/nfs/dbraw/zinc/96/54/68/1363965468.db2.gz	CZAXKXUYJKXFAF-UXHICEINSA-N	0	3	344.499	3.218	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CCN(Cc2ccccc2C(C)C)C[C@H]1O	ZINC001099858429	1363965752	/nfs/dbraw/zinc/96/57/52/1363965752.db2.gz	LNMXASDYXRLEQE-WOJBJXKFSA-N	0	3	344.499	3.218	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C[C@H](C)CCC)C[C@H]1c1ccc(OC)cc1	ZINC001100153790	1364029109	/nfs/dbraw/zinc/02/91/09/1364029109.db2.gz	FYSCSEDTQXEPSS-LSTHTHJFSA-N	0	3	342.483	3.039	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)CC(C)(C)CC)C[C@H]1c1ccc(OC)cc1	ZINC001100161559	1364032364	/nfs/dbraw/zinc/03/23/64/1364032364.db2.gz	XTDJOYALOZZVCW-RBUKOAKNSA-N	0	3	342.483	3.039	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](CNCc2ccn(CC)n2)[C@@H](C)C1	ZINC001185223983	1387656379	/nfs/dbraw/zinc/65/63/79/1387656379.db2.gz	CEIWVWVRRZMMNT-DLBZAZTESA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NCC1CC(NCc2ncccc2C)C1	ZINC001100362081	1364091715	/nfs/dbraw/zinc/09/17/15/1364091715.db2.gz	PEBVEEUFJBNRFL-UHFFFAOYSA-N	0	3	335.879	3.153	20	30		EGEDHN
C#CCCCCCC(=O)NCC1CC(NCc2ccccc2F)C1	ZINC001100570349	1364167557	/nfs/dbraw/zinc/16/75/57/1364167557.db2.gz	OWJNKLBZMQBHGW-UHFFFAOYSA-N	0	3	330.447	3.394	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC1CC(NCc2cnc(Cl)s2)C1	ZINC001100645046	1364202863	/nfs/dbraw/zinc/20/28/63/1364202863.db2.gz	RLGGQRMBMTTYBR-PPUFBPAQSA-N	0	3	341.908	3.383	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)Cc2c[nH]c3c2cccc3C)C1	ZINC001100733892	1364240880	/nfs/dbraw/zinc/24/08/80/1364240880.db2.gz	CIBFCHIBZCVLSY-UHFFFAOYSA-N	0	3	345.874	3.256	20	30		EGEDHN
CC(C)C[C@@H](C)C(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100795813	1364265172	/nfs/dbraw/zinc/26/51/72/1364265172.db2.gz	JPOBCHVPBKPHAZ-QHGAOEGBSA-N	0	3	326.484	3.205	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)CCc2cc(C)cc(C)c2)C1	ZINC001100831457	1364282865	/nfs/dbraw/zinc/28/28/65/1364282865.db2.gz	WTFIPRCIBOHZTI-UHFFFAOYSA-N	0	3	334.891	3.473	20	30		EGEDHN
C=CCN1CC[C@@H](Oc2ccnc(CNC(=O)CCCCCC)c2)C1	ZINC001101097508	1364413736	/nfs/dbraw/zinc/41/37/36/1364413736.db2.gz	ULMUUPSRZZLTDI-LJQANCHMSA-N	0	3	345.487	3.307	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@H]2CN(Cc3c(C)noc3C)C[C@@]2(C)C1	ZINC001101332059	1364512520	/nfs/dbraw/zinc/51/25/20/1364512520.db2.gz	RDVFOLNCZGGZDB-ZTQAJYAQSA-N	0	3	345.487	3.174	20	30		EGEDHN
C=CCCCC(=O)N1C[C@H]2CN(Cc3c(C)noc3CC)C[C@@]2(C)C1	ZINC001101346701	1364520145	/nfs/dbraw/zinc/52/01/45/1364520145.db2.gz	CECOAISKDMTWGC-UZLBHIALSA-N	0	3	345.487	3.182	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)CC[C@@H](C)c3ccccc3)C[C@]2(C)C1	ZINC001101383583	1364538815	/nfs/dbraw/zinc/53/88/15/1364538815.db2.gz	PRDDNYMWEZYCKM-UZKOGDIHSA-N	0	3	338.495	3.374	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)C[C@@H](C)CCc3ccccc3)C[C@]2(C)C1	ZINC001101482527	1364577955	/nfs/dbraw/zinc/57/79/55/1364577955.db2.gz	GMNZKQFSPKSVGZ-DWLFOUALSA-N	0	3	338.495	3.059	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC2(CN(CCC3CCCC3)C2)n2ccnc21	ZINC001101615331	1364656390	/nfs/dbraw/zinc/65/63/90/1364656390.db2.gz	HDYZSQGKADJMSJ-KRWDZBQOSA-N	0	3	342.487	3.002	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC2(CN(CCCC(C)(C)C)C2)n2ccnc21	ZINC001101615406	1364656604	/nfs/dbraw/zinc/65/66/04/1364656604.db2.gz	JLLVEPPIIGIKAT-MRXNPFEDSA-N	0	3	344.503	3.248	20	30		EGEDHN
CCC(CC)C(=O)NC[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1C	ZINC001101744387	1364710888	/nfs/dbraw/zinc/71/08/88/1364710888.db2.gz	KYZSCVRFJVWZQE-RDTXWAMCSA-N	0	3	345.462	3.318	20	30		EGEDHN
CCC[C@H](C)C(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C	ZINC001101829260	1364743028	/nfs/dbraw/zinc/74/30/28/1364743028.db2.gz	VEQLVULTCUJRBM-NLWGTHIKSA-N	0	3	326.484	3.158	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H]1CN(Cc2oc(CCC)nc2C)C[C@H]1C	ZINC001102011871	1364811168	/nfs/dbraw/zinc/81/11/68/1364811168.db2.gz	VGCCUJBSPPJDNB-NVXWUHKLSA-N	0	3	347.503	3.476	20	30		EGEDHN
C[C@@H](C(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C)C(C)(C)C	ZINC001102088977	1364848673	/nfs/dbraw/zinc/84/86/73/1364848673.db2.gz	BHDKFWGOHPSADM-WSTZPKSXSA-N	0	3	340.511	3.404	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1CNC(=O)CCC(C)(F)F	ZINC001102100134	1364855713	/nfs/dbraw/zinc/85/57/13/1364855713.db2.gz	MIVZTEBQCMKOOM-SJLPKXTDSA-N	0	3	348.437	3.158	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@@H]1CN(Cc2cnc(C)s2)C[C@H]1C	ZINC001102228997	1364945978	/nfs/dbraw/zinc/94/59/78/1364945978.db2.gz	QIJQRYFHIKSBDJ-NVXWUHKLSA-N	0	3	347.528	3.219	20	30		EGEDHN
CCC(C)(C)C(=O)NC[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1C	ZINC001102299029	1364989367	/nfs/dbraw/zinc/98/93/67/1364989367.db2.gz	IRTAKGJRUZWQIS-SJLPKXTDSA-N	0	3	344.474	3.298	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001102328287	1365003767	/nfs/dbraw/zinc/00/37/67/1365003767.db2.gz	CQVPVXNHHCLOBQ-SPYBWZPUSA-N	0	3	345.512	3.406	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1CCNC(=O)C(C)(C)F	ZINC001102635951	1365147334	/nfs/dbraw/zinc/14/73/34/1365147334.db2.gz	IBUZFOAMJPOMCD-CZUORRHYSA-N	0	3	349.425	3.020	20	30		EGEDHN
CC(C)=CC(=O)NCC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001102647844	1365153639	/nfs/dbraw/zinc/15/36/39/1365153639.db2.gz	DMKJOZSNDXXUDM-HUUCEWRRSA-N	0	3	331.485	3.160	20	30		EGEDHN
CC[C@H](C)C(=O)NCC[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1C	ZINC001102678688	1365166420	/nfs/dbraw/zinc/16/64/20/1365166420.db2.gz	YFNBBEHJMOQGBK-HDMKZQKVSA-N	0	3	345.462	3.318	20	30		EGEDHN
CC[C@H](C)C(=O)NCC[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1C	ZINC001102678096	1365166601	/nfs/dbraw/zinc/16/66/01/1365166601.db2.gz	NWKHLGPDBUTGOW-YQVWRLOYSA-N	0	3	344.474	3.298	20	30		EGEDHN
CC/C=C(\C)C(=O)NCC[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1C	ZINC001102727864	1365191117	/nfs/dbraw/zinc/19/11/17/1365191117.db2.gz	CWXGPJQMLSSZAP-VHWOIRFASA-N	0	3	339.483	3.489	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CCNC(=O)CCC1CC1	ZINC001102797504	1365224383	/nfs/dbraw/zinc/22/43/83/1365224383.db2.gz	PGGUQWXYIHUXQO-GDBMZVCRSA-N	0	3	345.512	3.384	20	30		EGEDHN
CC1CC(C(=O)NCC[C@@H]2CN(Cc3ccc(C#N)s3)C[C@H]2C)C1	ZINC001102846068	1365248534	/nfs/dbraw/zinc/24/85/34/1365248534.db2.gz	XPQAKXWYXALJPV-LVDPKSTMSA-N	0	3	345.512	3.240	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1CCNC(=O)C1(C)CC1	ZINC001103013574	1365336964	/nfs/dbraw/zinc/33/69/64/1365336964.db2.gz	KALGPWTYQGUVNZ-GDBMZVCRSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)C2(COC)CCCC2)C1	ZINC001103061794	1365360155	/nfs/dbraw/zinc/36/01/55/1365360155.db2.gz	DHWOTTNAMDKTGC-GDBMZVCRSA-N	0	3	342.911	3.020	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2ccncc2CC)C1	ZINC001103166965	1365417819	/nfs/dbraw/zinc/41/78/19/1365417819.db2.gz	WDRHYBVMYYFCKO-CZUORRHYSA-N	0	3	335.879	3.084	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC[C@@H]1CN(Cc2cncs2)C[C@H]1C	ZINC001103307863	1365485740	/nfs/dbraw/zinc/48/57/40/1365485740.db2.gz	IXGHHZAJMLEOCR-HUUCEWRRSA-N	0	3	335.517	3.320	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCC[C@@H]1CN(Cc2cncc(F)c2)C[C@H]1C	ZINC001103346238	1365510890	/nfs/dbraw/zinc/51/08/90/1365510890.db2.gz	HAACJONFDRXANW-JFIYKMOQSA-N	0	3	347.478	3.397	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2ccc3n[nH]cc3c2)C1	ZINC001103376074	1365523783	/nfs/dbraw/zinc/52/37/83/1365523783.db2.gz	JNPOKEMVBJCHGF-IUODEOHRSA-N	0	3	346.862	3.003	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)[C@@H](C)CC(F)(F)F)C1	ZINC001103394774	1365534338	/nfs/dbraw/zinc/53/43/38/1365534338.db2.gz	LHRZRSZBWXDICU-DMDPSCGWSA-N	0	3	340.817	3.402	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC[C@@H]1CN(Cc2cc(C)no2)C[C@H]1C	ZINC001103401438	1365537377	/nfs/dbraw/zinc/53/73/77/1365537377.db2.gz	BLLJEEZUAQFGKC-OGWOLHLISA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2ccc(C3CC3)cn2)C1	ZINC001103687302	1365728230	/nfs/dbraw/zinc/72/82/30/1365728230.db2.gz	VCVHHCFMMFUHDN-CXAGYDPISA-N	0	3	347.890	3.399	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CN(C(=O)[C@H]2CC2(C)C)C[C@H]1C	ZINC001104078865	1365902267	/nfs/dbraw/zinc/90/22/67/1365902267.db2.gz	TYDSDILPOGOXDC-MRVWCRGKSA-N	0	3	343.309	3.015	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CN(C(=O)C[C@@H](C)CC)C[C@H]1C	ZINC001104122098	1365917623	/nfs/dbraw/zinc/91/76/23/1365917623.db2.gz	QCSMWOKQDHWOPZ-GZBFAFLISA-N	0	3	345.325	3.405	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)[C@H](CCNCc2cc(C3CC3)no2)C1	ZINC001104246967	1365967440	/nfs/dbraw/zinc/96/74/40/1365967440.db2.gz	PSTDSSJTULDAIN-NVXWUHKLSA-N	0	3	345.487	3.483	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2ccnc(CCC)c2)C[C@H]1C	ZINC001104320888	1365979998	/nfs/dbraw/zinc/97/99/98/1365979998.db2.gz	JXBNJFAYDHQGAB-RHSMWYFYSA-N	0	3	349.906	3.474	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H](C)[C@H](CCNCc2ocnc2C)C1	ZINC001104631457	1366110293	/nfs/dbraw/zinc/11/02/93/1366110293.db2.gz	NUVILFMNKSIPRP-OGWOLHLISA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2ccncc2Cl)C[C@H]1C	ZINC001104717661	1366142418	/nfs/dbraw/zinc/14/24/18/1366142418.db2.gz	NGJSJAWNLAEVNB-DGCLKSJQSA-N	0	3	342.270	3.175	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)C2(CC)CCOCC2)C[C@H]1C	ZINC001104848745	1366198983	/nfs/dbraw/zinc/19/89/83/1366198983.db2.gz	VWZKWHBPQKAWSV-GDBMZVCRSA-N	0	3	342.911	3.020	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C[C@H](C=C)CC)CC1	ZINC001105394469	1366443280	/nfs/dbraw/zinc/44/32/80/1366443280.db2.gz	XULSHKPZQNBFJT-XLIONFOSSA-N	0	3	328.500	3.315	20	30		EGEDHN
CCCCCCCNCc1cn([C@@H]2CCCN(C(=O)C(C)C)C2)nn1	ZINC001185872682	1387821522	/nfs/dbraw/zinc/82/15/22/1387821522.db2.gz	KTCKFSFQXOCNCF-GOSISDBHSA-N	0	3	349.523	3.158	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@@H](CN[C@H](C)c2c(F)cccc2F)[C@H](C)C1	ZINC001106105417	1366611722	/nfs/dbraw/zinc/61/17/22/1366611722.db2.gz	TWOYAHLHVJJTDW-BZUAXINKSA-N	0	3	348.437	3.369	20	30		EGEDHN
C=CCCC1(C(=O)N2C[C@@H](CNCc3cscn3)[C@H](C)C2)CC1	ZINC001106629297	1366759646	/nfs/dbraw/zinc/75/96/46/1366759646.db2.gz	JZSFCUATNASWLP-HUUCEWRRSA-N	0	3	333.501	3.074	20	30		EGEDHN
C=CCCC1(C(=O)N2C[C@@H](CNCc3nccs3)[C@H](C)C2)CC1	ZINC001106633661	1366761404	/nfs/dbraw/zinc/76/14/04/1366761404.db2.gz	RAZFUUXSPLMQGF-HUUCEWRRSA-N	0	3	333.501	3.074	20	30		EGEDHN
C=CCCC(=O)NC[C@]12CCC[C@H]1N(Cc1conc1CC)CC2	ZINC001107327224	1366928980	/nfs/dbraw/zinc/92/89/80/1366928980.db2.gz	SPSDVHDLOYZZBA-IEBWSBKVSA-N	0	3	331.460	3.064	20	30		EGEDHN
C#CCCCCC(=O)NC[C@]12CCC[C@H]1N(Cc1cccnc1)CC2	ZINC001107366532	1366944430	/nfs/dbraw/zinc/94/44/30/1366944430.db2.gz	INMRPCBPJAWQKJ-TZIWHRDSSA-N	0	3	339.483	3.136	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCN(C(=O)/C=C\C(C)(C)C)C1	ZINC001189427180	1367018729	/nfs/dbraw/zinc/01/87/29/1367018729.db2.gz	FIKYNYYDRMBLAX-IQBZNYMQSA-N	0	3	325.456	3.193	20	30		EGEDHN
O=C(C#CC1CC1)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1cccc2ccccc21	ZINC001109252098	1367027224	/nfs/dbraw/zinc/02/72/24/1367027224.db2.gz	YWUHURBXZHWMAH-HJNYFJLDSA-N	0	3	344.458	3.475	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCOc1cccc(C)c1C)C2	ZINC001109372862	1367091817	/nfs/dbraw/zinc/09/18/17/1367091817.db2.gz	UKEWQYFKTGIMDP-QYZOEREBSA-N	0	3	342.483	3.370	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCCc1ccc(Cl)cc1)C2	ZINC001109483303	1367151191	/nfs/dbraw/zinc/15/11/91/1367151191.db2.gz	XOMYXLPYTZVPPQ-QYZOEREBSA-N	0	3	344.886	3.408	20	30		EGEDHN
CN(C/C=C\c1ccc(Cl)cc1)[C@H]1CCN(C(=O)C#CC2CC2)C1	ZINC001190037573	1367158766	/nfs/dbraw/zinc/15/87/66/1367158766.db2.gz	UNGJTGLRIKJSEL-AXMVSILFSA-N	0	3	342.870	3.299	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)C2=CCCCCC2)C1	ZINC001107894528	1367193625	/nfs/dbraw/zinc/19/36/25/1367193625.db2.gz	ZCRDDVWCXTZSKM-YLJYHZDGSA-N	0	3	334.504	3.439	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@@]1(C)CN(CC2CCCCC2)CCO1	ZINC001107972081	1367224014	/nfs/dbraw/zinc/22/40/14/1367224014.db2.gz	FDSMPNMLSZDJTJ-FQEVSTJZSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NC[C@]1(C)CN(CC2CCCC2)CCO1	ZINC001107970998	1367224248	/nfs/dbraw/zinc/22/42/48/1367224248.db2.gz	LNRWORATSCKFHE-GOSISDBHSA-N	0	3	342.911	3.162	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](N(C)CCOCCC(C)C)C1	ZINC001190327925	1367227810	/nfs/dbraw/zinc/22/78/10/1367227810.db2.gz	GIKNDLBYOIGWSU-LJQANCHMSA-N	0	3	336.520	3.350	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](N(C)Cc2ccc(OC)cc2)C1	ZINC001190344299	1367232521	/nfs/dbraw/zinc/23/25/21/1367232521.db2.gz	HPPRWMLNNSXJAI-LJQANCHMSA-N	0	3	342.483	3.496	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](N(C)Cc2ccccc2N(C)C)C1	ZINC001190398446	1367253755	/nfs/dbraw/zinc/25/37/55/1367253755.db2.gz	VWAKZNGPFVHOIO-GOSISDBHSA-N	0	3	343.515	3.388	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)Cc2ccc(C)cc2)C1	ZINC001108058688	1367261118	/nfs/dbraw/zinc/26/11/18/1367261118.db2.gz	FIBBADRSJMDVQH-NQIIRXRSSA-N	0	3	344.499	3.099	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](CCC)c1ccccn1)C2	ZINC001109647108	1367262010	/nfs/dbraw/zinc/26/20/10/1367262010.db2.gz	LYCXXDAQRKKMDG-NEPXVJNWSA-N	0	3	327.472	3.263	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](N(C)C[C@H](O)c2ccc(CC)cc2)C1	ZINC001190429285	1367262823	/nfs/dbraw/zinc/26/28/23/1367262823.db2.gz	ZUKDMDLWIQAADF-UXHICEINSA-N	0	3	344.499	3.171	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](N(C)CCOc2ccc(F)cc2)C1	ZINC001190436025	1367265192	/nfs/dbraw/zinc/26/51/92/1367265192.db2.gz	OMHPEIGYTUNSOH-QGZVFWFLSA-N	0	3	334.435	3.094	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@@H](N(C)Cc3csc(C)c3)C2)CCC1	ZINC001190603211	1367304915	/nfs/dbraw/zinc/30/49/15/1367304915.db2.gz	ABIRJFRYPMYFTK-QGZVFWFLSA-N	0	3	330.497	3.283	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@H](N(C)Cc3ccc(F)cc3C)C2)CCC1	ZINC001190603837	1367305468	/nfs/dbraw/zinc/30/54/68/1367305468.db2.gz	KCLJXXKBZIRKSA-IBGZPJMESA-N	0	3	342.458	3.360	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@@]1(C)CN(CC2CC(C)(C)C2)CCO1	ZINC001108188492	1367331699	/nfs/dbraw/zinc/33/16/99/1367331699.db2.gz	UEUJDRHNEUUVBP-PMACEKPBSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1oc(C3CC3)nc1C)C2	ZINC001109817820	1367339516	/nfs/dbraw/zinc/33/95/16/1367339516.db2.gz	LKCKXQMOFICARH-PMPSAXMXSA-N	0	3	329.444	3.162	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)[C@H]2CC[C@H](C)CC2)C1	ZINC001108353912	1367407229	/nfs/dbraw/zinc/40/72/29/1367407229.db2.gz	RWBNQJMLFMSIPL-JPLJXNOCSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2cc(C)ccc2C)C1	ZINC001108364956	1367414603	/nfs/dbraw/zinc/41/46/03/1367414603.db2.gz	YRQCQFJODVJUSZ-GHTZIAJQSA-N	0	3	344.499	3.479	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCc1ccc(CC)cc1)C2	ZINC001110091955	1367499745	/nfs/dbraw/zinc/49/97/45/1367499745.db2.gz	LCBTXRJVOZYYQV-AABGKKOBSA-N	0	3	326.484	3.479	20	30		EGEDHN
C=CC[C@H](C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCCF)c1ccccc1	ZINC001110130818	1367514298	/nfs/dbraw/zinc/51/42/98/1367514298.db2.gz	GDBIOWOIUAOPCO-XWSJACJDSA-N	0	3	330.447	3.427	20	30		EGEDHN
CCCCCCCC[C@H](C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCCO	ZINC001110131172	1367515278	/nfs/dbraw/zinc/51/52/78/1367515278.db2.gz	VTTVEBXJBBZGNI-RDGPPVDQSA-N	0	3	338.536	3.477	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](C)Cc1ccc(F)cc1)C2	ZINC001110189856	1367555818	/nfs/dbraw/zinc/55/58/18/1367555818.db2.gz	SKJWKGCZJQZMON-OAOYMFHYSA-N	0	3	330.447	3.302	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](N(C)Cc2ccc(C)c(OC)c2)C1	ZINC001191859640	1367617153	/nfs/dbraw/zinc/61/71/53/1367617153.db2.gz	OXHUPBJYIZUSPH-LJQANCHMSA-N	0	3	342.483	3.230	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H](N(C)Cc2ccc3c(c2)COC3)C1	ZINC001191868197	1367620235	/nfs/dbraw/zinc/62/02/35/1367620235.db2.gz	PUWBIMAZDJPQDE-UZLBHIALSA-N	0	3	342.483	3.352	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](N(C)CCOc2cccc(C)c2)C1	ZINC001192095021	1367686777	/nfs/dbraw/zinc/68/67/77/1367686777.db2.gz	YIGBAFBGYICDLR-GOSISDBHSA-N	0	3	330.472	3.263	20	30		EGEDHN
C=CCN1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)CCCF)C1	ZINC001186195981	1387893471	/nfs/dbraw/zinc/89/34/71/1387893471.db2.gz	BRXIFIQNIOSUIC-SJLPKXTDSA-N	0	3	336.426	3.283	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](N(C)CCc3csc(C)n3)C2)CC1	ZINC001192207802	1367718144	/nfs/dbraw/zinc/71/81/44/1367718144.db2.gz	ZMSHRXNKYDHFMK-QGZVFWFLSA-N	0	3	347.528	3.273	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2[C@@H](C)c1cccc(OC)c1	ZINC001109058727	1367743865	/nfs/dbraw/zinc/74/38/65/1367743865.db2.gz	IXCIOFKOQDNLLO-FXECBMLZSA-N	0	3	328.456	3.444	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)[C@@H](CC)CC2CCCC2)C1	ZINC001192657700	1367844042	/nfs/dbraw/zinc/84/40/42/1367844042.db2.gz	ZHBNQWYTTCEZHV-RBUKOAKNSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CC1CC(F)(F)C1	ZINC001110603527	1367864801	/nfs/dbraw/zinc/86/48/01/1367864801.db2.gz	IFTUCVGRLAUGRR-KFWWJZLASA-N	0	3	326.431	3.356	20	30		EGEDHN
C=CCC[C@@H](C)N1[C@@H]2CC[C@H]1[C@H](NC(=O)c1scnc1CC)C2	ZINC001110634496	1367878484	/nfs/dbraw/zinc/87/84/84/1367878484.db2.gz	JKECTECFRDBFNF-XOUADPBQSA-N	0	3	333.501	3.395	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCN(C(=O)CCC(C)(C)C)C1	ZINC001192947700	1367908837	/nfs/dbraw/zinc/90/88/37/1367908837.db2.gz	KOIPLPLVKUZBTH-SFHVURJKSA-N	0	3	327.472	3.417	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2sccc2C(F)F)C1	ZINC001193755321	1368109081	/nfs/dbraw/zinc/10/90/81/1368109081.db2.gz	IMVRTVXEOZRMED-GFCCVEGCSA-N	0	3	344.427	3.035	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)C(C)(C)C2CCCC2)C1	ZINC001193829150	1368124289	/nfs/dbraw/zinc/12/42/89/1368124289.db2.gz	XHYJZSRIQDISAG-QZTJIDSGSA-N	0	3	338.536	3.335	20	30		EGEDHN
C=C[C@@H](C(=O)N1CC[C@H](N(C)CCOC2CCC2)C1)c1ccccc1	ZINC001194183805	1368202948	/nfs/dbraw/zinc/20/29/48/1368202948.db2.gz	URZZIQPQQAKCBP-AZUAARDMSA-N	0	3	342.483	3.058	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)C[C@H](C=C)c2ccccc2)C1	ZINC001194200932	1368207700	/nfs/dbraw/zinc/20/77/00/1368207700.db2.gz	QENUQARDKMZXMI-AZUAARDMSA-N	0	3	342.483	3.082	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@H](CC)C(C)(C)C)C2	ZINC001111269040	1368235732	/nfs/dbraw/zinc/23/57/32/1368235732.db2.gz	MZLXXVHIKISYPC-MLHJIOFPSA-N	0	3	336.520	3.373	20	30		EGEDHN
C=C[C@H](CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCCF)c1ccccc1	ZINC001111440330	1368308145	/nfs/dbraw/zinc/30/81/45/1368308145.db2.gz	KHJVWVMPGRBBMB-OWYHZJEWSA-N	0	3	330.447	3.427	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3C[C@H](C)OC)CCCCC1	ZINC001111441211	1368308166	/nfs/dbraw/zinc/30/81/66/1368308166.db2.gz	BGEJJSVZPAPVLB-MLHJIOFPSA-N	0	3	334.504	3.269	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H](C)CC(C)(C)C)C[C@H](C)O2	ZINC001111550915	1368343213	/nfs/dbraw/zinc/34/32/13/1368343213.db2.gz	NPCYGMGIQZHHBL-IRXDYDNUSA-N	0	3	336.520	3.327	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)C/C=C/Cc2ccccc2)C1	ZINC001111782329	1368459804	/nfs/dbraw/zinc/45/98/04/1368459804.db2.gz	DQMZIOSWCMSZOB-KXEJLBPOSA-N	0	3	336.479	3.169	20	30		EGEDHN
CC#CCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1ccsc1)C2	ZINC001111845974	1368500503	/nfs/dbraw/zinc/50/05/03/1368500503.db2.gz	KSEHIXQOBIVYOW-HKUYNNGSSA-N	0	3	330.497	3.412	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@]12CCC[C@H]1CN(Cc1ncccc1C)C2	ZINC001111848772	1368502654	/nfs/dbraw/zinc/50/26/54/1368502654.db2.gz	SPQMYKMWKHYZQS-LQWHRVPQSA-N	0	3	341.499	3.463	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2c(C3CC3)cnn2C)CC1	ZINC001196100742	1368548788	/nfs/dbraw/zinc/54/87/88/1368548788.db2.gz	SZLVOSSNCXKROD-UHFFFAOYSA-N	0	3	346.519	3.416	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@@H](C)c2cccc(C)c2)C1	ZINC001196460428	1368619991	/nfs/dbraw/zinc/61/99/91/1368619991.db2.gz	IUBDNGUQMKSRDF-DFQSSKMNSA-N	0	3	344.499	3.006	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2cnc(CC3CC3)s2)CC1	ZINC001196627654	1368652239	/nfs/dbraw/zinc/65/22/39/1368652239.db2.gz	UHCIKFUBZNYVTP-UHFFFAOYSA-N	0	3	333.501	3.210	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCCN(C[C@H](O)C2CCCCC2)CC1	ZINC001196881236	1368706051	/nfs/dbraw/zinc/70/60/51/1368706051.db2.gz	RDZGYZQQXBGBOC-HKUYNNGSSA-N	0	3	336.520	3.064	20	30		EGEDHN
CCc1cc(C(=O)N2CCN(CC3CCCCC3)CC2)ccc1C#N	ZINC001197273499	1368776656	/nfs/dbraw/zinc/77/66/56/1368776656.db2.gz	LRDUGKUAZCUETE-UHFFFAOYSA-N	0	3	339.483	3.459	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H]2CCC[C@]2(CNCc2nccs2)C1	ZINC001112373724	1368800310	/nfs/dbraw/zinc/80/03/10/1368800310.db2.gz	DXPZTCQOKHNFFF-KXBFYZLASA-N	0	3	347.528	3.464	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)C[C@@H](CC)C(C)(C)C)C1	ZINC001197744170	1368887388	/nfs/dbraw/zinc/88/73/88/1368887388.db2.gz	SIENMLQYARUFRN-KZNAEPCWSA-N	0	3	338.536	3.357	20	30		EGEDHN
C=CCC[C@@H](C(=O)N1CCCN([C@@H](C)COC)CC1)c1ccccc1	ZINC001198411258	1369026267	/nfs/dbraw/zinc/02/62/67/1369026267.db2.gz	NZFUMSVOQHAATB-AZUAARDMSA-N	0	3	344.499	3.306	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)c2c(C)cc(C)cc2C)C1	ZINC001198416774	1369027829	/nfs/dbraw/zinc/02/78/29/1369027829.db2.gz	PRXPPGDGPPLWCR-RTBURBONSA-N	0	3	344.499	3.133	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)/C=C/c1ccco1)c1ccccc1OC	ZINC001198498928	1369046800	/nfs/dbraw/zinc/04/68/00/1369046800.db2.gz	FOLVUORTAQANOF-IENJSVCTSA-N	0	3	340.423	3.325	20	30		EGEDHN
C=CCC[C@@H](C)N[C@@H](CNC(=O)c1cocn1)c1ccccc1OC	ZINC001198605059	1369070625	/nfs/dbraw/zinc/07/06/25/1369070625.db2.gz	DMTLSLGKXZFFMS-ZBFHGGJFSA-N	0	3	343.427	3.099	20	30		EGEDHN
C=CCOCC(=O)NC[C@H](NCCC(C)(C)C)c1ccccc1OC	ZINC001198606550	1369071528	/nfs/dbraw/zinc/07/15/28/1369071528.db2.gz	UERIXQGPZWMDMN-KRWDZBQOSA-N	0	3	348.487	3.081	20	30		EGEDHN
CCCCCCN[C@H](CNC(=O)[C@@H](C)C#N)c1ccccc1OC	ZINC001198616276	1369073769	/nfs/dbraw/zinc/07/37/69/1369073769.db2.gz	GXKMUVWPRZNFKO-DOTOQJQBSA-N	0	3	331.460	3.182	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)CCCOCC=C)c1ccccc1OC	ZINC001198635879	1369078294	/nfs/dbraw/zinc/07/82/94/1369078294.db2.gz	IEQQYWJKZBDCIJ-GOSISDBHSA-N	0	3	346.471	3.001	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@H]1[C@@H]2CCCC[C@@H]21)c1ccccc1OC	ZINC001198634939	1369078604	/nfs/dbraw/zinc/07/86/04/1369078604.db2.gz	AVHIPRDHZHAVLM-HNAWSFBYSA-N	0	3	342.483	3.454	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@H](NCC1CC1)c1ccccc1OC	ZINC001198856496	1369130793	/nfs/dbraw/zinc/13/07/93/1369130793.db2.gz	IMKPOMRXTVCFJH-YJBOKZPZSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@H](NCCCF)c2ccccc2OC)C1	ZINC001198895621	1369143310	/nfs/dbraw/zinc/14/33/10/1369143310.db2.gz	URVJSXAWAILTHG-INIZCTEOSA-N	0	3	334.435	3.158	20	30		EGEDHN
CCC(CC)CC(=O)N1CC[C@@H](NCc2ccc(OC)c(C#N)c2)C1	ZINC001186622160	1387988036	/nfs/dbraw/zinc/98/80/36/1387988036.db2.gz	HGFXLELVNJOLSU-GOSISDBHSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=C(C)CCC(=O)N1CCCO[C@H](CNCc2cc(C)ccc2F)C1	ZINC001200626959	1369402260	/nfs/dbraw/zinc/40/22/60/1369402260.db2.gz	FMMDNJQHAWRDCT-GOSISDBHSA-N	0	3	348.462	3.198	20	30		EGEDHN
C=CC1(CC(=O)N2CCN(C[C@H]3CCO[C@@H](C)C3)CC2)CCCCC1	ZINC001113428272	1369420915	/nfs/dbraw/zinc/42/09/15/1369420915.db2.gz	NWCFHCQTLCEZHB-OALUTQOASA-N	0	3	348.531	3.472	20	30		EGEDHN
CCCCCCCN1CC[C@](NC(=O)OC(C)(C)C)(C(=O)OC)C1	ZINC001201797629	1369625619	/nfs/dbraw/zinc/62/56/19/1369625619.db2.gz	AGZSIYGOMAEHOX-GOSISDBHSA-N	0	3	342.480	3.099	20	30		EGEDHN
CCCCCCCCCN1C[C@@H]2[C@H](C1)OCCN2c1cnccn1	ZINC001201838669	1369632266	/nfs/dbraw/zinc/63/22/66/1369632266.db2.gz	BNILUFIMKYGHAR-MSOLQXFVSA-N	0	3	332.492	3.117	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001202130219	1369696124	/nfs/dbraw/zinc/69/61/24/1369696124.db2.gz	JOKUJXJKXGDQLG-INIZCTEOSA-N	0	3	325.456	3.241	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC(NCc2ccn(C(C)C)n2)CC1	ZINC001202138770	1369698878	/nfs/dbraw/zinc/69/88/78/1369698878.db2.gz	PPCQNRLILHQHCX-INIZCTEOSA-N	0	3	332.492	3.147	20	30		EGEDHN
C=CCC1(C(=O)N2CCCO[C@H](CNC[C@@H](F)CC)C2)CCCC1	ZINC001202243624	1369722218	/nfs/dbraw/zinc/72/22/18/1369722218.db2.gz	OSTKBVVQWGSKEB-DLBZAZTESA-N	0	3	340.483	3.078	20	30		EGEDHN
O=C(N[C@@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2)C1CCCC1	ZINC001202290855	1369731722	/nfs/dbraw/zinc/73/17/22/1369731722.db2.gz	PQPSFPDWGIXUEM-WOJBJXKFSA-N	0	3	336.479	3.245	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1[C@H]2CN([C@@H](CC)c3ccc(F)cc3)C[C@H]21	ZINC001114201755	1369791851	/nfs/dbraw/zinc/79/18/51/1369791851.db2.gz	VHZVBDKVZCNZQJ-HLNWXESRSA-N	0	3	328.431	3.127	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@@H](NCc2cc(F)ccc2F)C12CCC2	ZINC001202592502	1369816565	/nfs/dbraw/zinc/81/65/65/1369816565.db2.gz	UDPJFXYGYGSVDS-IAGOWNOFSA-N	0	3	334.410	3.448	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@H](NCc2cccc(F)c2F)C12CCC2	ZINC001202597730	1369818316	/nfs/dbraw/zinc/81/83/16/1369818316.db2.gz	ATYRPTNIVQZUAK-HOTGVXAUSA-N	0	3	334.410	3.448	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@H](NCc2cc(F)ccc2OC)C12CCC2	ZINC001202625999	1369829905	/nfs/dbraw/zinc/82/99/05/1369829905.db2.gz	RCJYMPMKBRZFAV-ROUUACIJSA-N	0	3	346.446	3.318	20	30		EGEDHN
C/C=C(/C)C(=O)N[C@@H]1C[C@@H](NCc2ccc(C#N)cc2F)C12CCC2	ZINC001202726756	1369868235	/nfs/dbraw/zinc/86/82/35/1369868235.db2.gz	USSCMZVXGUZHSZ-YYQAOVIASA-N	0	3	341.430	3.181	20	30		EGEDHN
CC(C)=C(F)C(=O)N[C@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202736464	1369873687	/nfs/dbraw/zinc/87/36/87/1369873687.db2.gz	QGUAOFMGZWCZSR-ROUUACIJSA-N	0	3	340.442	3.319	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1C[C@@H](NCc2ncccc2C)C12CCC2	ZINC001202785072	1369890899	/nfs/dbraw/zinc/89/08/99/1369890899.db2.gz	OOQPSGVSKPZZDD-RTBURBONSA-N	0	3	339.483	3.101	20	30		EGEDHN
Cc1cc[nH]c1C(=O)N[C@@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202824751	1369902812	/nfs/dbraw/zinc/90/28/12/1369902812.db2.gz	SSYRRKKYQYAANO-RBUKOAKNSA-N	0	3	347.462	3.005	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCCN(Cc3cccc4nonc43)C2)cc1	ZINC001203143123	1369998102	/nfs/dbraw/zinc/99/81/02/1369998102.db2.gz	QUEZSHORMMOCKO-KRWDZBQOSA-N	0	3	334.379	3.138	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1C[C@@H](NCc2conc2CC)C12CCC2	ZINC001203259637	1370046226	/nfs/dbraw/zinc/04/62/26/1370046226.db2.gz	XTSSKRMNLNDNPF-IAGOWNOFSA-N	0	3	345.487	3.356	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1C[C@@H](NCc2oc(CC)nc2C)C12CCC2	ZINC001203279916	1370058695	/nfs/dbraw/zinc/05/86/95/1370058695.db2.gz	CEGGSESAHBHLLG-HZPDHXFCSA-N	0	3	345.487	3.275	20	30		EGEDHN
O=C(N[C@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2)[C@H]1C[C@H]2C[C@H]2C1	ZINC001203290951	1370064600	/nfs/dbraw/zinc/06/46/00/1370064600.db2.gz	ZIZOJESDIPITQZ-ZPAWYTMASA-N	0	3	348.490	3.101	20	30		EGEDHN
C=CCC1(C(=O)NC2[C@H]3CN(C/C=C\c4ccccc4)C[C@@H]23)CCC1	ZINC001114785621	1370079306	/nfs/dbraw/zinc/07/93/06/1370079306.db2.gz	RJCXXURLSVWUCZ-UHYKABCUSA-N	0	3	336.479	3.493	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1C[C@H](NCc2oc(C)nc2C)C12CCC2	ZINC001203339507	1370089073	/nfs/dbraw/zinc/08/90/73/1370089073.db2.gz	HZXRUYRKBKEZHN-DLBZAZTESA-N	0	3	331.460	3.165	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H](NCc3cncs3)C23CCC3)CCC1	ZINC001203366554	1370100505	/nfs/dbraw/zinc/10/05/05/1370100505.db2.gz	NUNSHDQGJWQWJH-HOTGVXAUSA-N	0	3	345.512	3.407	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2C[C@H](NCc3ocnc3C)C23CCC3)CC1	ZINC001203375605	1370104704	/nfs/dbraw/zinc/10/47/04/1370104704.db2.gz	RJXVILHQVAJLMM-DLBZAZTESA-N	0	3	343.471	3.246	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)C2(C(C)(F)F)CC2)C12CCC2	ZINC001203419131	1370118226	/nfs/dbraw/zinc/11/82/26/1370118226.db2.gz	KMHZDYSIGCBOKL-NEPJUHHUSA-N	0	3	332.822	3.191	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1C[C@H](NCc2ccc(F)cn2)C12CCC2	ZINC001203454320	1370132879	/nfs/dbraw/zinc/13/28/79/1370132879.db2.gz	YOQBSQVBWDSGFI-DLBZAZTESA-N	0	3	345.462	3.340	20	30		EGEDHN
Cc1cccc(N2C[C@]3(CCN(Cc4cccc(C#N)c4)C3)CC2=O)c1	ZINC001203761936	1370253931	/nfs/dbraw/zinc/25/39/31/1370253931.db2.gz	IMWATZKXBXICCI-JOCHJYFZSA-N	0	3	345.446	3.496	20	30		EGEDHN
CC(C)C[C@@H](C)CC(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001115107544	1370283864	/nfs/dbraw/zinc/28/38/64/1370283864.db2.gz	DNZBDRZIKMQDJU-ZXFPDNNPSA-N	0	3	339.483	3.177	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@@H]2CN(Cc3ccc(C#N)cc3)C[C@@H]21	ZINC001203900342	1370306186	/nfs/dbraw/zinc/30/61/86/1370306186.db2.gz	ZLRXKGQJEQOLFO-MSOLQXFVSA-N	0	3	341.455	3.390	20	30		EGEDHN
CC[C@@H](CC(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21)C(C)C	ZINC001115145355	1370307890	/nfs/dbraw/zinc/30/78/90/1370307890.db2.gz	FLXWSMOYAHCZOK-CTAFRAEOSA-N	0	3	339.483	3.177	20	30		EGEDHN
N#Cc1cccc(N2C[C@@]3(CCN(Cc4ccc(F)cc4)C3)CC2=O)c1	ZINC001203914874	1370312256	/nfs/dbraw/zinc/31/22/56/1370312256.db2.gz	TWNQKNPOMNLZCQ-NRFANRHFSA-N	0	3	349.409	3.326	20	30		EGEDHN
CCCCCCCCC(=O)N[C@@H]1[C@H]2CN(CCOC3CCC3)C[C@H]21	ZINC001115163867	1370322566	/nfs/dbraw/zinc/32/25/66/1370322566.db2.gz	MBTZWPHITDBZPG-RUYXUALKSA-N	0	3	336.520	3.353	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CCCN(Cc3ccccn3)C2)CC1	ZINC001204055840	1370362759	/nfs/dbraw/zinc/36/27/59/1370362759.db2.gz	NCPCXYMEZDVGKE-UHFFFAOYSA-N	0	3	329.444	3.082	20	30		EGEDHN
C=CCOC(=O)N1CCCC2(CCN(Cc3cccnc3)CC2)C1	ZINC001204069012	1370366150	/nfs/dbraw/zinc/36/61/50/1370366150.db2.gz	KHEILFIAACRRLX-UHFFFAOYSA-N	0	3	329.444	3.082	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1ccc(F)c(F)c1)CC2	ZINC001204223491	1370413766	/nfs/dbraw/zinc/41/37/66/1370413766.db2.gz	HOWKFNWCRRUSMP-IBGZPJMESA-N	0	3	334.410	3.498	20	30		EGEDHN
N#Cc1ccc(F)c(CNC2(CNC(=O)C3CC3)CCCCC2)c1	ZINC001115374222	1370415274	/nfs/dbraw/zinc/41/52/74/1370415274.db2.gz	PMSWBELUQVTVQY-UHFFFAOYSA-N	0	3	329.419	3.016	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)NCC1(NCc2cc(C#N)ccc2F)CCCCC1	ZINC001115389325	1370426388	/nfs/dbraw/zinc/42/63/88/1370426388.db2.gz	OGAPIMCMAWTVCF-YOEHRIQHSA-N	0	3	343.446	3.262	20	30		EGEDHN
CSCCC(=O)NCC1(NCC#Cc2ccccc2)CCCCC1	ZINC001115398189	1370431603	/nfs/dbraw/zinc/43/16/03/1370431603.db2.gz	UUWYMXIUPWKGQG-UHFFFAOYSA-N	0	3	344.524	3.200	20	30		EGEDHN
CCCc1nc(C)c(CNC2(CNC(=O)[C@H](C)C#N)CCCCC2)o1	ZINC001115452408	1370460187	/nfs/dbraw/zinc/46/01/87/1370460187.db2.gz	ZSSFHDLKKPJBDO-CQSZACIVSA-N	0	3	346.475	3.004	20	30		EGEDHN
COc1cccc(Nc2cccc(CN3CCN(C)CC3)c2)c1C#N	ZINC001204574860	1370520461	/nfs/dbraw/zinc/52/04/61/1370520461.db2.gz	QDXWDIFLZQZMCZ-UHFFFAOYSA-N	0	3	336.439	3.058	20	30		EGEDHN
CC(C)(C)C#CC(=O)NCC1(NCc2ccccn2)CCCCC1	ZINC001115528536	1370527384	/nfs/dbraw/zinc/52/73/84/1370527384.db2.gz	PXBGDNLXAIKPAM-UHFFFAOYSA-N	0	3	327.472	3.040	20	30		EGEDHN
CC/C=C(\C)C(=O)N1CCC(CNCc2cc(F)ccc2C#N)CC1	ZINC001204663461	1370539604	/nfs/dbraw/zinc/53/96/04/1370539604.db2.gz	XBHWVTVZENIZIS-SYZQJQIISA-N	0	3	343.446	3.382	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H]2CN(CCCc3c(F)cccc3F)C[C@H]21	ZINC001187239886	1388079025	/nfs/dbraw/zinc/07/90/25/1388079025.db2.gz	JENAMKKZQGIFAT-HNAYVOBHSA-N	0	3	348.437	3.396	20	30		EGEDHN
C=CCN1C(=O)CC[C@@]12CCCN(Cc1ccc(OC)cc1F)CC2	ZINC001204913862	1370604397	/nfs/dbraw/zinc/60/43/97/1370604397.db2.gz	DMSNRYSLCNMNNJ-HXUWFJFHSA-N	0	3	346.446	3.367	20	30		EGEDHN
O=C(CCC(F)F)NCC1(NCC#Cc2ccccc2)CCCCC1	ZINC001115630125	1370622943	/nfs/dbraw/zinc/62/29/43/1370622943.db2.gz	AUWOXVKGSDLQML-UHFFFAOYSA-N	0	3	348.437	3.492	20	30		EGEDHN
CN(C)Cc1ccc(C(=O)Nc2ccc3nc(C#N)sc3c2)cc1	ZINC001187293968	1388090244	/nfs/dbraw/zinc/09/02/44/1388090244.db2.gz	WMTWYGMRRYUWQM-UHFFFAOYSA-N	0	3	336.420	3.482	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCC1(NCc2conc2C)CCCCC1	ZINC001115684616	1370666845	/nfs/dbraw/zinc/66/68/45/1370666845.db2.gz	BAVXYQKETQIFQR-HNNXBMFYSA-N	0	3	333.476	3.494	20	30		EGEDHN
C=CCCCC(=O)NCC1(NCc2nccnc2C)CCCCC1	ZINC001115701565	1370682815	/nfs/dbraw/zinc/68/28/15/1370682815.db2.gz	VCDDZNIBLRYZTJ-UHFFFAOYSA-N	0	3	330.476	3.050	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C2(CC)CCC2)C[C@H]1c1cccc(F)c1	ZINC001205427096	1370751402	/nfs/dbraw/zinc/75/14/02/1370751402.db2.gz	UNAKNTUSJDHDSM-RBUKOAKNSA-N	0	3	342.458	3.313	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H](CC)CCC)C[C@H]1c1cccc(F)c1	ZINC001205449000	1370759085	/nfs/dbraw/zinc/75/90/85/1370759085.db2.gz	OXIGKPNGTOIHFK-ZYSHUDEJSA-N	0	3	330.447	3.169	20	30		EGEDHN
CCOC(=O)[C@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]2CCCC[C@@H]12	ZINC001205459489	1370762428	/nfs/dbraw/zinc/76/24/28/1370762428.db2.gz	VQJZPSNWBCSCNQ-NXHRZFHOSA-N	0	3	344.430	3.499	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC(CNCc3cnc(C)o3)CC2)CC1	ZINC001206181817	1370983922	/nfs/dbraw/zinc/98/39/22/1370983922.db2.gz	TWOOKOZNGSPZQZ-UHFFFAOYSA-N	0	3	331.460	3.058	20	30		EGEDHN
COc1ccc(C#N)cc1CN[C@@H]1CCCN(C(=O)CCC(C)C)C1	ZINC001207221500	1371332841	/nfs/dbraw/zinc/33/28/41/1371332841.db2.gz	GSBZFGKMFSWVGJ-GOSISDBHSA-N	0	3	343.471	3.084	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2CN(Cc3ccc(CC)cc3)C[C@H]2C)CCC1	ZINC001207522061	1371424158	/nfs/dbraw/zinc/42/41/58/1371424158.db2.gz	UPLCJBCTVSEBIL-YLJYHZDGSA-N	0	3	338.495	3.379	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207635492	1371459763	/nfs/dbraw/zinc/45/97/63/1371459763.db2.gz	LAFNJVYROAENTF-GOSISDBHSA-N	0	3	330.859	3.238	20	30		EGEDHN
O=C([C@H]1[C@@H]2CCCC[C@@H]21)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001207743837	1371491448	/nfs/dbraw/zinc/49/14/48/1371491448.db2.gz	GSAYYOQUAZVKAB-CGXNFDGLSA-N	0	3	336.479	3.055	20	30		EGEDHN
O=C(C=C1CCC1)N1CCC[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207777398	1371501687	/nfs/dbraw/zinc/50/16/87/1371501687.db2.gz	PDEFZXLNPZQRKY-IBGZPJMESA-N	0	3	342.870	3.382	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N1CCC[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207819279	1371512303	/nfs/dbraw/zinc/51/23/03/1371512303.db2.gz	HPPBTDJPFAYEAS-ZWKOTPCHSA-N	0	3	344.886	3.318	20	30		EGEDHN
C=CCOC[C@H]1c2c(ncn2C)CCN1C[C@H](C)c1ccccc1	ZINC001207904158	1371533157	/nfs/dbraw/zinc/53/31/57/1371533157.db2.gz	CNKURKKSZAMQNB-LPHOPBHVSA-N	0	3	325.456	3.326	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H](N[C@@H]2CCc3c2c(F)ccc3F)C1	ZINC001207943971	1371545097	/nfs/dbraw/zinc/54/50/97/1371545097.db2.gz	GXHTZWPVBFMULQ-KBXCAEBGSA-N	0	3	346.421	3.336	20	30		EGEDHN
COc1cc(Cl)ccc1CN[C@H]1CCCN(C(=O)C#CC(C)C)C1	ZINC001208006055	1371565630	/nfs/dbraw/zinc/56/56/30/1371565630.db2.gz	UWVKSSORAAQFKB-KRWDZBQOSA-N	0	3	348.874	3.089	20	30		EGEDHN
C=CCCOCC(=O)N1CCC[C@@H]([C@@H]2CCCN2CC(=C)Cl)C1	ZINC001120467757	1371586763	/nfs/dbraw/zinc/58/67/63/1371586763.db2.gz	BJKUNBBXUWPABF-SJORKVTESA-N	0	3	340.895	3.035	20	30		EGEDHN
CC(F)(F)CCC(=O)N1CCC[C@H](NCc2ccc(C#N)s2)C1	ZINC001208443285	1371767610	/nfs/dbraw/zinc/76/76/10/1371767610.db2.gz	BEDPMMUHNOFHEP-LBPRGKRZSA-N	0	3	341.427	3.136	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2CN(CCOCCC(C)C)C[C@H]2C)CC1	ZINC001208508989	1371792286	/nfs/dbraw/zinc/79/22/86/1371792286.db2.gz	NUPDONJMFNDGGS-QZTJIDSGSA-N	0	3	336.520	3.232	20	30		EGEDHN
COC(=O)c1ccc2c(c1)CN(CCCc1cccc(C#N)c1)CC2	ZINC001208853392	1371918852	/nfs/dbraw/zinc/91/88/52/1371918852.db2.gz	KOWUAZWYKSEBOA-UHFFFAOYSA-N	0	3	334.419	3.336	20	30		EGEDHN
C[C@@H]1CC[C@@H](NC(=O)OC(C)(C)C)CN1CCc1ccc(C#N)cc1	ZINC001208927657	1371948847	/nfs/dbraw/zinc/94/88/47/1371948847.db2.gz	NYGYRWFHKCDUKO-CRAIPNDOSA-N	0	3	343.471	3.478	20	30		EGEDHN
C[C@H]1[C@@H](NC(=O)OC(C)(C)C)CCCN1CCc1ccc(C#N)cc1	ZINC001208928447	1371948993	/nfs/dbraw/zinc/94/89/93/1371948993.db2.gz	CEUHILRZIGRCEF-YJBOKZPZSA-N	0	3	343.471	3.478	20	30		EGEDHN
C=CCN(CCN1CCC[C@@H]1c1cccc(OC)c1)C(=O)OCC	ZINC001209022489	1371976816	/nfs/dbraw/zinc/97/68/16/1371976816.db2.gz	LQGUQYNOHIOYKJ-GOSISDBHSA-N	0	3	332.444	3.477	20	30		EGEDHN
C[C@]1(C(=O)N2CCC[C@H](NCC#Cc3ccc(F)cc3)C2)C=CCC1	ZINC001209040652	1371980881	/nfs/dbraw/zinc/98/08/81/1371980881.db2.gz	XNPGWDCLTGYPFV-FPOVZHCZSA-N	0	3	340.442	3.114	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CC2(CC(NCC(=C)Br)C2)C1	ZINC001121515532	1371996495	/nfs/dbraw/zinc/99/64/95/1371996495.db2.gz	KMCLOKIBQKUBHC-UHFFFAOYSA-N	0	3	341.293	3.124	20	30		EGEDHN
O=C(C1CC2(CCC2)C1)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001209099799	1371996903	/nfs/dbraw/zinc/99/69/03/1371996903.db2.gz	ALUPNQFTVXNMGH-HXUWFJFHSA-N	0	3	336.479	3.199	20	30		EGEDHN
CC1(C)CC[C@H]1C(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001209120466	1372003577	/nfs/dbraw/zinc/00/35/77/1372003577.db2.gz	FLDQFCQOFNKJME-MOPGFXCFSA-N	0	3	342.458	3.194	20	30		EGEDHN
O=C(CCCC1CC1)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001209144961	1372013107	/nfs/dbraw/zinc/01/31/07/1372013107.db2.gz	BBKNWXXNKVWUKM-FQEVSTJZSA-N	0	3	342.458	3.338	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N1CCC2(C1)CCCCC2	ZINC001121595497	1372019428	/nfs/dbraw/zinc/01/94/28/1372019428.db2.gz	SSYUJENWQRAILJ-KRWDZBQOSA-N	0	3	343.519	3.434	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC[C@H](NCc2cc(CO)ccc2F)C1	ZINC001209183787	1372028333	/nfs/dbraw/zinc/02/83/33/1372028333.db2.gz	PVNIRQRHIGGAAC-YJBOKZPZSA-N	0	3	348.462	3.001	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC[C@@H](NCc2ccc(Cl)nc2)C1	ZINC001209184199	1372029091	/nfs/dbraw/zinc/02/90/91/1372029091.db2.gz	RRPXNRMSQZSQMT-GOEBONIOSA-N	0	3	335.879	3.418	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC[C@@H](NCc2ccc(C#N)s2)C1	ZINC001209192929	1372032948	/nfs/dbraw/zinc/03/29/48/1372032948.db2.gz	DTYFQPZDZHMAJW-HUUCEWRRSA-N	0	3	331.485	3.303	20	30		EGEDHN
C=CCCCCN1CCCC[C@]12CC(=O)N(Cc1cccnc1)C2	ZINC001209202761	1372036219	/nfs/dbraw/zinc/03/62/19/1372036219.db2.gz	IANLBNSTHURWFW-HXUWFJFHSA-N	0	3	327.472	3.395	20	30		EGEDHN
CC1(C(=O)N2CCC[C@H](NCC#Cc3ccc(F)cc3)C2)CC=CC1	ZINC001209432611	1372104338	/nfs/dbraw/zinc/10/43/38/1372104338.db2.gz	LWGWBBUJQDBQPN-IBGZPJMESA-N	0	3	340.442	3.114	20	30		EGEDHN
C=CCCCCCCN1C[C@@H]2[C@H](C1)OCCN2Cc1c(C)noc1C	ZINC001209436904	1372106496	/nfs/dbraw/zinc/10/64/96/1372106496.db2.gz	CTPAIVNPVSEJIK-UXHICEINSA-N	0	3	347.503	3.313	20	30		EGEDHN
C=CCC1(C(=O)N2CCC[C@@H](NCc3cncc(C)c3)C2)CCC1	ZINC001209504222	1372123623	/nfs/dbraw/zinc/12/36/23/1372123623.db2.gz	QUGGOMIPYDBEFE-GOSISDBHSA-N	0	3	327.472	3.217	20	30		EGEDHN
O=C(N1CCC[C@H](NCC#Cc2ccccc2)C1)[C@@]12C[C@@H]1CCCC2	ZINC001209523201	1372127510	/nfs/dbraw/zinc/12/75/10/1372127510.db2.gz	GXTBDQHWCYASLW-ONTIZHBOSA-N	0	3	336.479	3.199	20	30		EGEDHN
CC1(C)CC[C@H](C(=O)N2CCC[C@H](NCC#Cc3ccccc3)C2)C1	ZINC001209523056	1372127818	/nfs/dbraw/zinc/12/78/18/1372127818.db2.gz	FVPXNRXOAVDQLG-PMACEKPBSA-N	0	3	338.495	3.445	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)NCc1cccc(OC)c1OC1CCCC1	ZINC001121955692	1372133115	/nfs/dbraw/zinc/13/31/15/1372133115.db2.gz	XDDKMEDTKFLFGG-QGZVFWFLSA-N	0	3	346.471	3.316	20	30		EGEDHN
O=C(N1CCC[C@@H](NCC#Cc2ccccc2Cl)C1)C1(CF)CC1	ZINC001209579042	1372141635	/nfs/dbraw/zinc/14/16/35/1372141635.db2.gz	QJOIZVLPCZXWHB-MRXNPFEDSA-N	0	3	348.849	3.022	20	30		EGEDHN
CC[C@@H](c1ccc(F)cc1)N1C[C@@H]2CCN(C(=O)C#CC(C)C)[C@@H]2C1	ZINC001187849208	1388177178	/nfs/dbraw/zinc/17/71/78/1388177178.db2.gz	MDEOYUJPDQVVHS-YSIASYRMSA-N	0	3	342.458	3.469	20	30		EGEDHN
O=C([C@@H]1CC12CC2)N1CCC[C@@H](NCC#Cc2ccccc2Cl)C1	ZINC001209808952	1372204802	/nfs/dbraw/zinc/20/48/02/1372204802.db2.gz	QOOZJYAFJBRTCP-SJORKVTESA-N	0	3	342.870	3.072	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1Cl)C(=O)c1cnn(C2CCC2)c1	ZINC001122449064	1372249919	/nfs/dbraw/zinc/24/99/19/1372249919.db2.gz	RLTBWRBPSIRJTR-CYBMUJFWSA-N	0	3	342.786	3.223	20	30		EGEDHN
CN1C(=O)CCC[C@@H]1C(=O)C(C#N)c1nc2cc(Cl)ccc2s1	ZINC001122474086	1372254612	/nfs/dbraw/zinc/25/46/12/1372254612.db2.gz	HMKVRNQCOWSWIB-CMPLNLGQSA-N	0	3	347.827	3.137	20	30		EGEDHN
CC[C@@H](C)c1ccc(NC(=O)C(C#N)C(=O)[C@@H]2[C@H]3CCCO[C@H]32)cc1	ZINC001122546894	1372271744	/nfs/dbraw/zinc/27/17/44/1372271744.db2.gz	DAHVPIGJUDMARY-XGIOVGQOSA-N	0	3	340.423	3.272	20	30		EGEDHN
CC[C@@H](C)CCC(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001210263539	1372308704	/nfs/dbraw/zinc/30/87/04/1372308704.db2.gz	DNNCNFYXKUZHQB-QUCCMNQESA-N	0	3	326.484	3.445	20	30		EGEDHN
CC(C)(C)C(=O)N1CCC[C@@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001210788393	1372426686	/nfs/dbraw/zinc/42/66/86/1372426686.db2.gz	CPGNTDRPRGHMKW-QGZVFWFLSA-N	0	3	332.875	3.318	20	30		EGEDHN
Cn1c(Cl)cnc1C(C#N)C(=O)CCCOCc1ccccc1	ZINC001123336551	1372430684	/nfs/dbraw/zinc/43/06/84/1372430684.db2.gz	IPYLDWBMEJWOTN-AWEZNQCLSA-N	0	3	331.803	3.247	20	30		EGEDHN
Cn1c(Cl)cnc1C(C#N)C(=O)C[C@H](CC#N)c1ccccc1	ZINC001123337906	1372431364	/nfs/dbraw/zinc/43/13/64/1372431364.db2.gz	VVACLRGHKCWSAC-UONOGXRCSA-N	0	3	326.787	3.337	20	30		EGEDHN
CCCCCCCC[C@H](C)C(=O)N[C@@H]1CN(CCOC)C[C@H]1C	ZINC001211206068	1372501871	/nfs/dbraw/zinc/50/18/71/1372501871.db2.gz	ATLTUKUQSLQOEV-RCCFBDPRSA-N	0	3	326.525	3.456	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)C[C@@H](C)c2cccc(OC)c2)C1	ZINC001211403616	1372551932	/nfs/dbraw/zinc/55/19/32/1372551932.db2.gz	YCXBHAAOIYVEHJ-GPMSIDNRSA-N	0	3	330.472	3.201	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](c2ccccc2)[C@H](NCc2ccccn2)C1	ZINC001211551414	1372578563	/nfs/dbraw/zinc/57/85/63/1372578563.db2.gz	NNGYZIQJMUIYGM-VQTJNVASSA-N	0	3	335.451	3.132	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2sccc2F)C[C@H]1c1ccccc1	ZINC001211592816	1372587328	/nfs/dbraw/zinc/58/73/28/1372587328.db2.gz	CBAMNYSEZQXPDE-DOTOQJQBSA-N	0	3	342.439	3.108	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2[nH]ccc2C2CC2)C[C@H]1c1ccccc1	ZINC001211613432	1372590984	/nfs/dbraw/zinc/59/09/84/1372590984.db2.gz	NYNDHMJZDVNTKK-VQTJNVASSA-N	0	3	347.462	3.113	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C2(CC(C)C)CCC2)C[C@H]1c1ccccc1	ZINC001211631907	1372592792	/nfs/dbraw/zinc/59/27/92/1372592792.db2.gz	VJPGGCHXWYMLMM-VQTJNVASSA-N	0	3	338.495	3.420	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C2(CC#C)CCCCC2)C[C@H]1c1ccccc1	ZINC001211732382	1372608895	/nfs/dbraw/zinc/60/88/95/1372608895.db2.gz	DUNZMYSBSYFOLS-LEWJYISDSA-N	0	3	348.490	3.178	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN([C@H](C)c2ccccc2C)C[C@H]1OC	ZINC001212346968	1372691325	/nfs/dbraw/zinc/69/13/25/1372691325.db2.gz	LYTOIBCZZMYZRV-BHIYHBOVSA-N	0	3	330.472	3.228	20	30		EGEDHN
CC[C@@H](NCCNC(=O)[C@H](C)C#N)c1ccc(Cl)cc1Cl	ZINC001124895534	1372738298	/nfs/dbraw/zinc/73/82/98/1372738298.db2.gz	HNXUVFMUUMFGIY-QMTHXVAHSA-N	0	3	328.243	3.310	20	30		EGEDHN
C=CCOCCCC(=O)NCCNCc1cc(Cl)cc(Cl)c1	ZINC001125252486	1372763494	/nfs/dbraw/zinc/76/34/94/1372763494.db2.gz	FTVVXIYZHAWRCX-UHFFFAOYSA-N	0	3	345.270	3.182	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)CC2CC(C)(C)C2)[C@H](OC)C1	ZINC001213324204	1372884136	/nfs/dbraw/zinc/88/41/36/1372884136.db2.gz	SPENLBWHHDUCJG-QZTJIDSGSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H](NC(=O)c2ccoc2CCC)[C@H](OC)C1	ZINC001213716610	1372950333	/nfs/dbraw/zinc/95/03/33/1372950333.db2.gz	CMKZSQRTKUOYSY-YXJHDRRASA-N	0	3	334.460	3.016	20	30		EGEDHN
C=C[C@@](C)(O)CC(=O)NCCN[C@@H](C)c1ccc(Cl)c(Cl)c1	ZINC001126377433	1372961426	/nfs/dbraw/zinc/96/14/26/1372961426.db2.gz	AOCVJVPGWSWQCY-MEDUHNTESA-N	0	3	345.270	3.087	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)[C@@H](CC)c2ccc(F)cc2)[C@H](OC)C1	ZINC001213951506	1372986408	/nfs/dbraw/zinc/98/64/08/1372986408.db2.gz	VEWWHDILCALHIT-IPMKNSEASA-N	0	3	348.462	3.101	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H]2CN(Cc3ccc(OC)c(C)c3)C[C@H]21	ZINC001188080650	1388237861	/nfs/dbraw/zinc/23/78/61/1388237861.db2.gz	FVMUTRKCXZBNFZ-RBUKOAKNSA-N	0	3	342.483	3.393	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1C[C@@H](C)[C@H](NCc2cc(C)ccc2F)C1	ZINC001214282072	1373037423	/nfs/dbraw/zinc/03/74/23/1373037423.db2.gz	BDKUWAWPUOOICF-JTDSTZFVSA-N	0	3	348.462	3.052	20	30		EGEDHN
C[C@@H](NCCNC(=O)C#CC1CC1)c1ccc(Cl)c(Cl)c1	ZINC001126881507	1373046462	/nfs/dbraw/zinc/04/64/62/1373046462.db2.gz	VPUIONKRFPLRPK-LLVKDONJSA-N	0	3	325.239	3.174	20	30		EGEDHN
C[C@@H](C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2Cl)C1)C1CC1	ZINC001214401106	1373055362	/nfs/dbraw/zinc/05/53/62/1373055362.db2.gz	RQBJTPRGIVMGPQ-SPYBWZPUSA-N	0	3	344.886	3.174	20	30		EGEDHN
CC/C(C)=C/C(=O)N1C[C@@H](C)[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001214576457	1373083090	/nfs/dbraw/zinc/08/30/90/1373083090.db2.gz	XOXIQUYXSOOPIG-XFXDYTQGSA-N	0	3	344.886	3.484	20	30		EGEDHN
C=C(C)CNCc1ccncc1O[C@H]1CCN(C(=O)/C(C)=C\CC)C1	ZINC001127883565	1373195222	/nfs/dbraw/zinc/19/52/22/1373195222.db2.gz	QCEBQXXSEHATND-LQAFDQLZSA-N	0	3	343.471	3.083	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@H](C)CCC)[C@@H](n2ccnn2)C1	ZINC001128851473	1373316331	/nfs/dbraw/zinc/31/63/31/1373316331.db2.gz	OTYIIJKODDHTCA-KURKYZTESA-N	0	3	349.523	3.026	20	30		EGEDHN
C#CCC1(C(=O)NCCNCc2cc(C(C)C)ccc2OC)CCC1	ZINC001129124656	1373349153	/nfs/dbraw/zinc/34/91/53/1373349153.db2.gz	CCDYUXPWGCIRQW-UHFFFAOYSA-N	0	3	342.483	3.218	20	30		EGEDHN
CCCCCCCCOCC(=O)NCCNCc1ccc(C)nc1C	ZINC001129523175	1373393863	/nfs/dbraw/zinc/39/38/63/1373393863.db2.gz	VOYZIHMSOOIKMQ-UHFFFAOYSA-N	0	3	349.519	3.281	20	30		EGEDHN
C=C(C)CN1CC[C@H](Oc2cnccc2CNC(=O)[C@@H](C)C(C)C)C1	ZINC001130323309	1373493209	/nfs/dbraw/zinc/49/32/09/1373493209.db2.gz	FCSKGUSZMQPLIC-WMZOPIPTSA-N	0	3	345.487	3.019	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)CC2(C)CCCCC2)C1	ZINC001130401823	1373520866	/nfs/dbraw/zinc/52/08/66/1373520866.db2.gz	NYHDUTYMEQCMBO-INIZCTEOSA-N	0	3	344.503	3.362	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCO[C@@H]2CN(CCCCCCC)C[C@@H]21	ZINC001218517108	1373628299	/nfs/dbraw/zinc/62/82/99/1373628299.db2.gz	JFGAPEKTCDEXHK-CEXWTWQISA-N	0	3	336.520	3.471	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCO[C@@H]2CN(CC/C=C\CCC)C[C@@H]21	ZINC001218524407	1373629945	/nfs/dbraw/zinc/62/99/45/1373629945.db2.gz	XAVTUECMIQYEJE-YBXURTSQSA-N	0	3	334.504	3.247	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)[C@H](C)c3ccco3)[C@H]2C1	ZINC001218617277	1373637636	/nfs/dbraw/zinc/63/76/36/1373637636.db2.gz	HHXHFXGIYVQFNK-ZIFCJYIRSA-N	0	3	346.471	3.041	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)[C@H]2CCC[C@H]2c2ccccc2)cc1	ZINC001131157251	1373654269	/nfs/dbraw/zinc/65/42/69/1373654269.db2.gz	SVJRLPHZVOIMBN-SFTDATJTSA-N	0	3	347.462	3.348	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)C[C@@H](C)CCCCCC)[C@H]2C1	ZINC001218946314	1373669669	/nfs/dbraw/zinc/66/96/69/1373669669.db2.gz	OKQOTRJFRJURFJ-GBESFXJTSA-N	0	3	336.520	3.471	20	30		EGEDHN
CNc1ccc(C#N)cc1NC(=O)[C@H]1CCC[C@@H](c2ccccc2)N1	ZINC001218980699	1373674207	/nfs/dbraw/zinc/67/42/07/1373674207.db2.gz	IUFKDMDBSMMFQV-FUHWJXTLSA-N	0	3	334.423	3.422	20	30		EGEDHN
C[Si](C)(C)C#Cc1cccc(NC(=O)C[C@@H]2CCNC[C@H]2F)c1	ZINC001219311152	1373699774	/nfs/dbraw/zinc/69/97/74/1373699774.db2.gz	TXVHWTDASLQWHG-DOTOQJQBSA-N	0	3	332.495	3.192	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)Nc1ccc2c(c1)CC[C@@H]2C(=O)OC	ZINC001219425796	1373709144	/nfs/dbraw/zinc/70/91/44/1373709144.db2.gz	VDAVPFCHFVBEKU-ROUUACIJSA-N	0	3	344.455	3.292	20	30		EGEDHN
CC(C)(C)c1ccc(C[C@@H](N)C(=O)N[C@@H](C#N)c2ccccc2)cc1	ZINC001219557626	1373716540	/nfs/dbraw/zinc/71/65/40/1373716540.db2.gz	BUTYMGGZBYPPEZ-MOPGFXCFSA-N	0	3	335.451	3.235	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2cc(C)sc2C)[C@@H](O)C1	ZINC001219957034	1373742479	/nfs/dbraw/zinc/74/24/79/1373742479.db2.gz	WXDQQYMVMFRJIS-SJORKVTESA-N	0	3	338.517	3.110	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](C)O[C@]2(CCN(CC=C(C)C)C2)C1	ZINC001131661970	1373750089	/nfs/dbraw/zinc/75/00/89/1373750089.db2.gz	RVYAMAUNOBQWOL-XLIONFOSSA-N	0	3	334.504	3.247	20	30		EGEDHN
C=CCC[C@H](C)N1CC[C@@H]2CN(C(=O)c3scnc3CC)[C@@H]2C1	ZINC001221600175	1373782699	/nfs/dbraw/zinc/78/26/99/1373782699.db2.gz	LGPIDLGDKXJEDF-SQWLQELKSA-N	0	3	333.501	3.207	20	30		EGEDHN
C=CCOCCN1CC[C@@H]2CN(C(=O)CCCC3CCCC3)[C@@H]2C1	ZINC001222058597	1373814800	/nfs/dbraw/zinc/81/48/00/1373814800.db2.gz	YITKZDGINZDRSZ-RTBURBONSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCC1CCN(Cc2c(C)noc2CC)CC1	ZINC001224165179	1375057980	/nfs/dbraw/zinc/05/79/80/1375057980.db2.gz	HPQJVHPSEXXSLH-CABCVRRESA-N	0	3	347.503	3.332	20	30		EGEDHN
C=CCOCCCC(=O)N[C@H]1CC[C@@H](C)N(Cc2ccc(C)cc2)C1	ZINC001131940185	1375058293	/nfs/dbraw/zinc/05/82/93/1375058293.db2.gz	ZTEPEHZVYBGNRC-QUCCMNQESA-N	0	3	344.499	3.447	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCC1CCN(Cc2c(C)noc2CC)CC1	ZINC001224165180	1375058356	/nfs/dbraw/zinc/05/83/56/1375058356.db2.gz	HPQJVHPSEXXSLH-GJZGRUSLSA-N	0	3	347.503	3.332	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C/C=C/c3ccc(C)cc3)C[C@@H]21	ZINC001224394831	1375066620	/nfs/dbraw/zinc/06/66/20/1375066620.db2.gz	MPRMDSNFARPJEA-DXRKNVDNSA-N	0	3	336.479	3.344	20	30		EGEDHN
CSC[C@@H](C)C(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1	ZINC001225367855	1375107256	/nfs/dbraw/zinc/10/72/56/1375107256.db2.gz	HFOGYHVYHZMHLP-BHIYHBOVSA-N	0	3	344.524	3.054	20	30		EGEDHN
C[C@@H]1CC[C@@H](NC(=O)C#CC2CC2)CN1Cc1ccc2c(c1)CCC2	ZINC001132034180	1375108753	/nfs/dbraw/zinc/10/87/53/1375108753.db2.gz	PEJIONRPUKJOLJ-IIBYNOLFSA-N	0	3	336.479	3.058	20	30		EGEDHN
Cc1cc(=O)c(C#N)c(O[C@H]2CCN(Cc3ccccc3)C[C@H]2C)[nH]1	ZINC001225469039	1375114434	/nfs/dbraw/zinc/11/44/34/1375114434.db2.gz	GIGRBOWBWXVFFU-KUHUBIRLSA-N	0	3	337.423	3.257	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@H]1CC[C@@H](C)N(CCOCC2CC2)C1	ZINC001132077941	1375135642	/nfs/dbraw/zinc/13/56/42/1375135642.db2.gz	JLQAAUMRVKKJIA-CJNGLKHVSA-N	0	3	342.911	3.161	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCOc2cc(C)cc(C)c2)CC[C@@H]1C	ZINC001132097265	1375145254	/nfs/dbraw/zinc/14/52/54/1375145254.db2.gz	HRXAUGUMXCTAJH-ZWKOTPCHSA-N	0	3	330.472	3.227	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2ccccc2CCC)CC[C@H]1C	ZINC001132165465	1375182008	/nfs/dbraw/zinc/18/20/08/1375182008.db2.gz	VMDSGGQGBYDIIY-IEBWSBKVSA-N	0	3	344.499	3.424	20	30		EGEDHN
Cc1ccc(F)c(CN[C@@H]2CCCC[C@H]2NC(=O)C#CC(C)C)c1	ZINC001226095649	1375203869	/nfs/dbraw/zinc/20/38/69/1375203869.db2.gz	PDTKJDFHKGESIE-RTBURBONSA-N	0	3	330.447	3.311	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CC[C@@H](C)N(CCc2ccc(OC)cc2)C1	ZINC001132228077	1375223407	/nfs/dbraw/zinc/22/34/07/1375223407.db2.gz	LTYFTFZUIQWPNJ-SJLPKXTDSA-N	0	3	344.499	3.419	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)C(C2CCC2)C2CCC2)CC[C@H]1C	ZINC001132249548	1375246107	/nfs/dbraw/zinc/24/61/07/1375246107.db2.gz	QGMOAQIJDWEBKY-APWZRJJASA-N	0	3	348.531	3.375	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@@H](C)OCc3ccccc3C)[C@@H]2C1	ZINC001188715440	1388366081	/nfs/dbraw/zinc/36/60/81/1388366081.db2.gz	RAHYFFAWDYORFJ-WSTZPKSXSA-N	0	3	342.483	3.009	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC1CCN([C@H](C)c2ccc(F)cc2)CC1	ZINC001226446895	1375260236	/nfs/dbraw/zinc/26/02/36/1375260236.db2.gz	HRNUDJGIZXEEQI-CVEARBPZSA-N	0	3	348.462	3.449	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC1CCN([C@H]2CCc3c2cccc3Cl)CC1	ZINC001226626241	1375296053	/nfs/dbraw/zinc/29/60/53/1375296053.db2.gz	WJDILYSGXJUFKO-SJCJKPOMSA-N	0	3	331.847	3.068	20	30		EGEDHN
C=CCOCCCC(=O)NC1CCN(C/C=C\c2ccccc2)CC1	ZINC001226761114	1375327769	/nfs/dbraw/zinc/32/77/69/1375327769.db2.gz	ZIHZYDZXYGMGPD-POHAHGRESA-N	0	3	342.483	3.263	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCNCc1ccccc1OCC(F)(F)F	ZINC001132395636	1375349983	/nfs/dbraw/zinc/34/99/83/1375349983.db2.gz	JDDGVSINBYODJH-UHFFFAOYSA-N	0	3	344.377	3.046	20	30		EGEDHN
C=CCCCCCN1C[C@H](NC(=O)c2c[nH]c(C)cc2=O)CC[C@H]1C	ZINC001132403371	1375356270	/nfs/dbraw/zinc/35/62/70/1375356270.db2.gz	VZHXFYBWYNDALX-IAGOWNOFSA-N	0	3	345.487	3.012	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCCOc2ccc(C)cc2)CC[C@@H]1C	ZINC001132459655	1375402510	/nfs/dbraw/zinc/40/25/10/1375402510.db2.gz	CLHMFRJVGLUMFE-ZWKOTPCHSA-N	0	3	330.472	3.309	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)C(C)(C)c2ccccc2)CC[C@@H]1C	ZINC001132467745	1375409570	/nfs/dbraw/zinc/40/95/70/1375409570.db2.gz	KHIFZZLECNTZRA-PKOBYXMFSA-N	0	3	344.499	3.136	20	30		EGEDHN
Cc1nc(OC2CCN(C3CC3)CC2)c(C#N)cc1-c1ccncc1	ZINC001227267654	1375414074	/nfs/dbraw/zinc/41/40/74/1375414074.db2.gz	JLXLHVZQPKKJDS-UHFFFAOYSA-N	0	3	334.423	3.329	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COc2ccc(C)cc2C)CC[C@@H]1C	ZINC001132481577	1375417886	/nfs/dbraw/zinc/41/78/86/1375417886.db2.gz	HQCCYSKBOXKKDH-ROUUACIJSA-N	0	3	330.472	3.227	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COc2cc(C)cc(C)c2)CC[C@H]1C	ZINC001132486742	1375420017	/nfs/dbraw/zinc/42/00/17/1375420017.db2.gz	PECFOVSWJVLOQN-MSOLQXFVSA-N	0	3	330.472	3.227	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(OCCCC)cc2)CC[C@@H]1C	ZINC001132487051	1375420768	/nfs/dbraw/zinc/42/07/68/1375420768.db2.gz	QXIMJHDQLQIGGW-PKOBYXMFSA-N	0	3	342.483	3.472	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCOc2ccc(OC)cc2)CC[C@@H]1C	ZINC001132499009	1375426402	/nfs/dbraw/zinc/42/64/02/1375426402.db2.gz	AJKRCNWVCLSREN-IRXDYDNUSA-N	0	3	346.471	3.009	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)C2CCC(C)(C)CC2)CC[C@@H]1C	ZINC001132522931	1375439602	/nfs/dbraw/zinc/43/96/02/1375439602.db2.gz	VEAMUESQJAQADK-FUHWJXTLSA-N	0	3	336.520	3.375	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2CC[C@@H](C)N(CCOCC=C)C2)CCCCC1	ZINC001132529624	1375443253	/nfs/dbraw/zinc/44/32/53/1375443253.db2.gz	PCNKKXKBQDXTRL-RTBURBONSA-N	0	3	346.515	3.132	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1CC[C@H](C)N(Cc2ccc(C)cc2C)C1	ZINC001132532461	1375444932	/nfs/dbraw/zinc/44/49/32/1375444932.db2.gz	DIUCSWNFLVUYIL-AZUAARDMSA-N	0	3	344.499	3.365	20	30		EGEDHN
C=C(C)CCC(=O)NC1CCN(Cc2cccc(COC)c2)CC1	ZINC001227588231	1375448180	/nfs/dbraw/zinc/44/81/80/1375448180.db2.gz	KBLUUGSAFOODDJ-UHFFFAOYSA-N	0	3	330.472	3.270	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)CC(C)C)CC1	ZINC001132549602	1375455227	/nfs/dbraw/zinc/45/52/27/1375455227.db2.gz	WBGSTBNMNQDZAR-HXUWFJFHSA-N	0	3	341.499	3.334	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)/C(C)=C/C)CC1	ZINC001132554054	1375459963	/nfs/dbraw/zinc/45/99/63/1375459963.db2.gz	BTFOSQNOEKKNLU-OVYCDTAVSA-N	0	3	339.483	3.254	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2N(Cc2nccs2)C(=O)CC(C)C)CC1	ZINC001132566651	1375469908	/nfs/dbraw/zinc/46/99/08/1375469908.db2.gz	QQFVQMMQZXRUNI-INIZCTEOSA-N	0	3	345.512	3.006	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCNCc1ccccc1C(F)(F)F	ZINC001132574297	1375472147	/nfs/dbraw/zinc/47/21/47/1375472147.db2.gz	ZALHGHPIEONDHC-OLZOCXBDSA-N	0	3	328.378	3.369	20	30		EGEDHN
CCCCC(=O)N1CC[C@@H](C)[C@@H](CNCc2ccccc2C#N)C1	ZINC001132669935	1375506299	/nfs/dbraw/zinc/50/62/99/1375506299.db2.gz	LBIULKZQNHYMGG-APWZRJJASA-N	0	3	327.472	3.323	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](C)[C@@H](CNCc2nc3ccccc3o2)C1	ZINC001132696574	1375518279	/nfs/dbraw/zinc/51/82/79/1375518279.db2.gz	LPUUVDRPXNSNGX-CVEARBPZSA-N	0	3	341.455	3.368	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](C)[C@H](CNCc2nc3ccccc3o2)C1	ZINC001132696577	1375518511	/nfs/dbraw/zinc/51/85/11/1375518511.db2.gz	LPUUVDRPXNSNGX-JKSUJKDBSA-N	0	3	341.455	3.368	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](C)[C@@H](CNCc2ccccc2C#N)C1	ZINC001132698010	1375520588	/nfs/dbraw/zinc/52/05/88/1375520588.db2.gz	VMJZNBGQDPLGPI-APWZRJJASA-N	0	3	325.456	3.099	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](C)[C@@H](CNCc2cc(C3CC3)no2)C1	ZINC001132866151	1375610343	/nfs/dbraw/zinc/61/03/43/1375610343.db2.gz	WNRVSYCDDWBRBH-WBVHZDCISA-N	0	3	345.487	3.483	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NC1CCN(CCOc2ccccc2C)CC1	ZINC001228747474	1375660066	/nfs/dbraw/zinc/66/00/66/1375660066.db2.gz	BGOKCCNEODGCIE-AEFFLSMTSA-N	0	3	344.499	3.413	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC1CCN(CCOc2ccccc2)CC1	ZINC001228810614	1375685023	/nfs/dbraw/zinc/68/50/23/1375685023.db2.gz	YGNFMPOPTGPZJV-QGZVFWFLSA-N	0	3	330.472	3.248	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](C)[C@H](CNCc2nccs2)C1	ZINC001133038341	1375729091	/nfs/dbraw/zinc/72/90/91/1375729091.db2.gz	APFSXSPCGKFVIZ-IAGOWNOFSA-N	0	3	347.528	3.301	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](C)[C@H](CNCc2ocnc2C)C1	ZINC001133039053	1375729938	/nfs/dbraw/zinc/72/99/38/1375729938.db2.gz	KDRRFLHGQREEFR-SJLPKXTDSA-N	0	3	345.487	3.141	20	30		EGEDHN
C=CCC1(C(=O)NC2CCN(Cc3ccc(CO)cc3)CC2)CCC1	ZINC001229030414	1375745325	/nfs/dbraw/zinc/74/53/25/1375745325.db2.gz	NBOOWPJCCHZVJZ-UHFFFAOYSA-N	0	3	342.483	3.006	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](C)[C@@H](CNCc2ncc(C)s2)C1	ZINC001133073384	1375759722	/nfs/dbraw/zinc/75/97/22/1375759722.db2.gz	UHGOQYFKDGPXNS-ZBFHGGJFSA-N	0	3	335.517	3.382	20	30		EGEDHN
COc1cc2c(Cl)c(C#N)cnc2cc1O[C@H]1CCCN(C)C1	ZINC001229106327	1375765269	/nfs/dbraw/zinc/76/52/69/1375765269.db2.gz	NDNHWCBXHCMFKB-LBPRGKRZSA-N	0	3	331.803	3.241	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](C)[C@@H](CNCc3cnc(C)o3)C2)CCC1	ZINC001133104786	1375777720	/nfs/dbraw/zinc/77/77/20/1375777720.db2.gz	KCYFOESLJPQXCD-RDJZCZTQSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](C)[C@H](CNCc3nccs3)C2)CC1	ZINC001133105518	1375778837	/nfs/dbraw/zinc/77/88/37/1375778837.db2.gz	UTQCPXFUYMWIOB-HZPDHXFCSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H]2CN(Cc3ccc(OC)cc3)C[C@H]21	ZINC001188886826	1388400897	/nfs/dbraw/zinc/40/08/97/1388400897.db2.gz	ZYTRTFUWGNKZMQ-IMFGXOCKSA-N	0	3	342.483	3.330	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)[C@H](C)CC2CCCCC2)CC1	ZINC001229446525	1375837120	/nfs/dbraw/zinc/83/71/20/1375837120.db2.gz	YJYOTSPUBUULHJ-QGZVFWFLSA-N	0	3	336.520	3.376	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H]2CN(Cc3cc(F)ccc3C)C[C@H]21	ZINC001188903115	1388405269	/nfs/dbraw/zinc/40/52/69/1388405269.db2.gz	ITWZEBWUQHFBEY-FXAWDEMLSA-N	0	3	342.458	3.360	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H]2CN(C/C=C/c3ccccc3)C[C@H]21	ZINC001188903060	1388405349	/nfs/dbraw/zinc/40/53/49/1388405349.db2.gz	FNMJZQUOUKNIIE-QOANIYFMSA-N	0	3	336.479	3.426	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)COCCCCCC	ZINC001229923943	1375918804	/nfs/dbraw/zinc/91/88/04/1375918804.db2.gz	CTXAMWDIARFJIJ-HZPDHXFCSA-N	0	3	330.900	3.353	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@H](C)C(F)(F)F	ZINC001133403757	1375988721	/nfs/dbraw/zinc/98/87/21/1375988721.db2.gz	HHUADDZYSVROHE-LBPRGKRZSA-N	0	3	346.780	3.090	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)Cc1occc1C	ZINC001133404019	1375989330	/nfs/dbraw/zinc/98/93/30/1375989330.db2.gz	UYOFAGATWGPRJV-UHFFFAOYSA-N	0	3	344.842	3.036	20	30		EGEDHN
C=C[C@@H](C(=O)NC1CCN(CCOCC(C)C)CC1)c1ccccc1	ZINC001230332161	1375999398	/nfs/dbraw/zinc/99/93/98/1375999398.db2.gz	VWMURPHXXDPFPO-HXUWFJFHSA-N	0	3	344.499	3.209	20	30		EGEDHN
C=CCCOCC(=O)NC1CCN(Cc2ccc(CCC)cc2)CC1	ZINC001230411835	1376022222	/nfs/dbraw/zinc/02/22/22/1376022222.db2.gz	VGEIKZVNLSLIOK-UHFFFAOYSA-N	0	3	344.499	3.312	20	30		EGEDHN
C=CCCOCC(=O)NC1CCN([C@@H](CC)c2ccc(F)cc2)CC1	ZINC001230411836	1376022997	/nfs/dbraw/zinc/02/29/97/1376022997.db2.gz	VGGUMQKANRXAOX-IBGZPJMESA-N	0	3	348.462	3.450	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1C1CCN(C(=O)[C@@H](CC)OCC)CC1	ZINC001230522173	1376053252	/nfs/dbraw/zinc/05/32/52/1376053252.db2.gz	INIBCXASILMJID-IAGOWNOFSA-N	0	3	342.911	3.257	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)c1cccs1)NCc1cc(F)ccc1C#N	ZINC001133580831	1376103822	/nfs/dbraw/zinc/10/38/22/1376103822.db2.gz	DCTLIFRRNMUJKH-OLZOCXBDSA-N	0	3	345.443	3.446	20	30		EGEDHN
Cc1occc1C(=O)N[C@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001133628404	1376126352	/nfs/dbraw/zinc/12/63/52/1376126352.db2.gz	UCMHSTHYICUIIH-ZIAGYGMSSA-N	0	3	325.412	3.146	20	30		EGEDHN
C#CCCN(CCCNC(=O)CC(C)(C)C=C)Cc1cccnc1	ZINC001230769330	1376144951	/nfs/dbraw/zinc/14/49/51/1376144951.db2.gz	LHCLEZOKWGUUCM-UHFFFAOYSA-N	0	3	327.472	3.016	20	30		EGEDHN
C#CCCN(CCCNC(=O)c1c(C)cccc1C)Cc1cccnc1	ZINC001230859975	1376167513	/nfs/dbraw/zinc/16/75/13/1376167513.db2.gz	YHLXNNLZFCSNRW-UHFFFAOYSA-N	0	3	349.478	3.344	20	30		EGEDHN
C#CCCN(CCCNC(=O)c1ccc(C)cc1)Cc1cccnc1	ZINC001230911722	1376182950	/nfs/dbraw/zinc/18/29/50/1376182950.db2.gz	NWCYALXPISBUTP-UHFFFAOYSA-N	0	3	335.451	3.035	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)c2cc3occc3s2)ccc1F	ZINC001133771257	1376200264	/nfs/dbraw/zinc/20/02/64/1376200264.db2.gz	XLNPKYQHIDLXSX-UHFFFAOYSA-N	0	3	343.383	3.025	20	30		EGEDHN
C=CCCC(=O)N(C)C[C@@H]1CCN1CC[C@@H](C)OCc1ccccc1	ZINC001231168872	1376211946	/nfs/dbraw/zinc/21/19/46/1376211946.db2.gz	BXLZFYKUJURRTD-QUCCMNQESA-N	0	3	344.499	3.481	20	30		EGEDHN
CC/C=C(/C)C(=O)N[C@H](C)C[C@@H](C)NCc1cc(F)ccc1C#N	ZINC001133839337	1376226544	/nfs/dbraw/zinc/22/65/44/1376226544.db2.gz	FHKHEUHOEKGSKT-CGHRZIEDSA-N	0	3	331.435	3.427	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)CC(F)(F)F)NCc1cc(F)ccc1C#N	ZINC001133849329	1376232696	/nfs/dbraw/zinc/23/26/96/1376232696.db2.gz	VWYRRPOUSOVQPK-QWRGUYRKSA-N	0	3	345.340	3.023	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H]2CN(CCc3ccc(F)c(F)c3)C[C@H]21	ZINC001188999749	1388432157	/nfs/dbraw/zinc/43/21/57/1388432157.db2.gz	ZQGKXWLDYVSMTG-QFBILLFUSA-N	0	3	348.437	3.396	20	30		EGEDHN
C#Cc1cccc(CN2CC[C@@]3(CCN3C(=O)OC(C)(C)C)C2)c1	ZINC001231656158	1376296012	/nfs/dbraw/zinc/29/60/12/1376296012.db2.gz	GALSXVNTAYHZIW-HXUWFJFHSA-N	0	3	326.440	3.253	20	30		EGEDHN
C#Cc1cccc(CN2CCC3(CC2)C(=O)NC[C@@H]3c2ccccc2)c1	ZINC001231658055	1376297736	/nfs/dbraw/zinc/29/77/36/1376297736.db2.gz	XSDXBSGJBQNGQO-OAQYLSRUSA-N	0	3	344.458	3.164	20	30		EGEDHN
Cc1cc(C)c(C(=O)N[C@H](C)C[C@@H](C)NCc2ccccc2C#N)o1	ZINC001134041811	1376327568	/nfs/dbraw/zinc/32/75/68/1376327568.db2.gz	JHDIFMIVAZMWGT-HUUCEWRRSA-N	0	3	339.439	3.455	20	30		EGEDHN
CC(C)=C(F)C(=O)N[C@@H](C)C[C@@H](C)NCc1cc(F)ccc1C#N	ZINC001134080644	1376355345	/nfs/dbraw/zinc/35/53/45/1376355345.db2.gz	APXJCYZNENKBKB-OLZOCXBDSA-N	0	3	335.398	3.334	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cnc(F)cc1C)[C@H]2CC	ZINC001231981901	1376370639	/nfs/dbraw/zinc/37/06/39/1376370639.db2.gz	QVFZPZINBMRZKH-PXNSSMCTSA-N	0	3	345.462	3.451	20	30		EGEDHN
CCN1CC[C@]2(CCCN(Cc3ccc(C#N)c(Cl)c3)C2)C1=O	ZINC001232114392	1376402257	/nfs/dbraw/zinc/40/22/57/1376402257.db2.gz	IELBVEABVWIKOQ-SFHVURJKSA-N	0	3	331.847	3.046	20	30		EGEDHN
C#CCCCC(=O)N[C@H](C)C[C@H](C)NCc1oc(C(C)C)nc1C	ZINC001134201851	1376415124	/nfs/dbraw/zinc/41/51/24/1376415124.db2.gz	SWZAJCMDSOJIJE-LSDHHAIUSA-N	0	3	333.476	3.283	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)c1ccoc1CC	ZINC001134248686	1376433147	/nfs/dbraw/zinc/43/31/47/1376433147.db2.gz	SXXXFQZQVYGCRF-RYUDHWBXSA-N	0	3	343.265	3.237	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3c(C)cccc3OC)C2)C1=O	ZINC001232619583	1376490212	/nfs/dbraw/zinc/49/02/12/1376490212.db2.gz	CHEOPLYPGMYFST-HXUWFJFHSA-N	0	3	328.456	3.004	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC([C@H]2CCN(Cc3ccc(C#N)s3)C2)C1	ZINC001232844143	1376523188	/nfs/dbraw/zinc/52/31/88/1376523188.db2.gz	HANYBCWLROSQEA-ZDUSSCGKSA-N	0	3	347.484	3.309	20	30		EGEDHN
COC(=O)[C@H]1CN(Cc2ccc(C#N)s2)C[C@@H]1c1ccc(F)cc1	ZINC001232847490	1376524536	/nfs/dbraw/zinc/52/45/36/1376524536.db2.gz	YCRKQCZBWCDPIO-SJORKVTESA-N	0	3	344.411	3.147	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H](C)C[C@@H](C)NCc1nc2ccccc2n1C	ZINC001134471220	1376555739	/nfs/dbraw/zinc/55/57/39/1376555739.db2.gz	VMKXFBAZHCZZIG-CVEARBPZSA-N	0	3	342.487	3.303	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCC2(CC1)NC(=O)Nc1ccccc12	ZINC001233082756	1376568190	/nfs/dbraw/zinc/56/81/90/1376568190.db2.gz	XJCYORAIOFQFNK-UHFFFAOYSA-N	0	3	346.434	3.493	20	30		EGEDHN
N#Cc1ccc(C[N@@H+]2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)c([O-])c1	ZINC001233387018	1376633418	/nfs/dbraw/zinc/63/34/18/1376633418.db2.gz	QQNHDPLHYQJOCM-JOCHJYFZSA-N	0	3	347.462	3.362	20	30		EGEDHN
N#Cc1ccc(C[N@H+]2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)c([O-])c1	ZINC001233387018	1376633424	/nfs/dbraw/zinc/63/34/24/1376633424.db2.gz	QQNHDPLHYQJOCM-JOCHJYFZSA-N	0	3	347.462	3.362	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H](C)C[C@H](C)NCc1ncc(C)s1	ZINC001134637624	1376636473	/nfs/dbraw/zinc/63/64/73/1376636473.db2.gz	DNZHDUMGNIYUNM-KBPBESRZSA-N	0	3	346.500	3.126	20	30		EGEDHN
C#CCCCCC(=O)N(C)C[C@@H]1CCN1CCCc1ccccc1	ZINC001233801844	1376720180	/nfs/dbraw/zinc/72/01/80/1376720180.db2.gz	RZHWEHLESWAHER-FQEVSTJZSA-N	0	3	326.484	3.346	20	30		EGEDHN
C#CCCCC(=O)N(C)C[C@@H]1CCN1C[C@H]1CCCC(F)(F)C1	ZINC001233948590	1376741733	/nfs/dbraw/zinc/74/17/33/1376741733.db2.gz	YXDTYXDUSFJZHW-HOTGVXAUSA-N	0	3	326.431	3.148	20	30		EGEDHN
C=CCC[C@@H](C)N1CC[C@@H]1CN(C)C(=O)c1coc(C(C)(C)C)n1	ZINC001234265088	1376794639	/nfs/dbraw/zinc/79/46/39/1376794639.db2.gz	HBODPBXIXBQDJH-HUUCEWRRSA-N	0	3	333.476	3.473	20	30		EGEDHN
C=CCCCN1CC[C@H]1CN(C)C(=O)c1ccnc(-c2ccco2)c1	ZINC001235632765	1376880527	/nfs/dbraw/zinc/88/05/27/1376880527.db2.gz	LCUWRLFCJYFZIP-KRWDZBQOSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=CC1(CC(=O)NCCNCc2ccc(C#N)cc2)CCCCC1	ZINC001135190389	1376962991	/nfs/dbraw/zinc/96/29/91/1376962991.db2.gz	DKESEMZAZKGRMO-UHFFFAOYSA-N	0	3	325.456	3.291	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)C1(C)CCC1)NCc1cc(F)ccc1C#N	ZINC001135206649	1376976695	/nfs/dbraw/zinc/97/66/95/1376976695.db2.gz	CDRKUIOFOVBQJE-KGLIPLIRSA-N	0	3	331.435	3.260	20	30		EGEDHN
C[C@H](CC(=O)NCCNCc1cccc(C#N)c1)C1CCCCC1	ZINC001135227716	1376988600	/nfs/dbraw/zinc/98/86/00/1376988600.db2.gz	LLFPVRCRPINOID-MRXNPFEDSA-N	0	3	327.472	3.371	20	30		EGEDHN
C=CCOC(=O)Nc1sc2c(c1C(=O)OC(C)(C)C)CCNC2	ZINC001239312319	1377006929	/nfs/dbraw/zinc/00/69/29/1377006929.db2.gz	KOOAAYIFXVJUNC-UHFFFAOYSA-N	0	3	338.429	3.084	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2conc2CC)CC1	ZINC001135383805	1377066397	/nfs/dbraw/zinc/06/63/97/1377066397.db2.gz	WMUUACOXOWLYOC-HUUCEWRRSA-N	0	3	333.476	3.356	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc(C(F)F)cc2)s1	ZINC001135385354	1377066817	/nfs/dbraw/zinc/06/68/17/1377066817.db2.gz	ZGUIBURKOVWAQU-UHFFFAOYSA-N	0	3	335.379	3.077	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H](C)C[C@@H](C)NCc2nc(C)c(C)s2)C1	ZINC001135418501	1377084672	/nfs/dbraw/zinc/08/46/72/1377084672.db2.gz	FQVVCQYQEMBFFA-CHWSQXEVSA-N	0	3	335.517	3.489	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H](C)C[C@@H](C)NCc2nc(C)c(C)s2)C1	ZINC001135418502	1377084832	/nfs/dbraw/zinc/08/48/32/1377084832.db2.gz	FQVVCQYQEMBFFA-OLZOCXBDSA-N	0	3	335.517	3.489	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)C1(C(C)C)CC1	ZINC001135434459	1377094924	/nfs/dbraw/zinc/09/49/24/1377094924.db2.gz	JITARHYXXFZUTK-QWHCGFSZSA-N	0	3	331.298	3.204	20	30		EGEDHN
CCCCCCCCCCC[C@@H](C)N1CCN(CC(N)=O)CC1	ZINC001258052312	1377115642	/nfs/dbraw/zinc/11/56/42/1377115642.db2.gz	OMAHHIMVKJUIHR-GOSISDBHSA-N	0	3	325.541	3.399	20	30		EGEDHN
CN(C(=O)CC(C)(F)F)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001266190236	1377221095	/nfs/dbraw/zinc/22/10/95/1377221095.db2.gz	QDWUBZCOLSHTRF-UHFFFAOYSA-N	0	3	335.398	3.026	20	30		EGEDHN
CCCCC(=O)N1CC[C@H]2[C@@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001268260887	1377503420	/nfs/dbraw/zinc/50/34/20/1377503420.db2.gz	AIQHDJSGBJEBKU-YOEHRIQHSA-N	0	3	331.485	3.233	20	30		EGEDHN
C#CCOc1ccc(CN2CCC[C@H]2CC(=O)OC(C)(C)C)cc1	ZINC001138560224	1377741847	/nfs/dbraw/zinc/74/18/47/1377741847.db2.gz	MLIJBMJKHHGNGG-KRWDZBQOSA-N	0	3	329.440	3.395	20	30		EGEDHN
C=CCO[C@@H]1CO[C@@]2(C1)CCCN(Cc1c[nH]nc1C(C)(C)C)C2	ZINC001138578949	1377747003	/nfs/dbraw/zinc/74/70/03/1377747003.db2.gz	HHSQHMIBIOUHSM-QFBILLFUSA-N	0	3	333.476	3.033	20	30		EGEDHN
C=CCc1cccc(C[N@H+](C)CCCNC(=O)OC(C)(C)C)c1[O-]	ZINC001138626598	1377756182	/nfs/dbraw/zinc/75/61/82/1377756182.db2.gz	LJWYCRHYSZDFNA-UHFFFAOYSA-N	0	3	334.460	3.467	20	30		EGEDHN
C=CCc1cccc(C[N@@H+](C)CCCNC(=O)OC(C)(C)C)c1[O-]	ZINC001138626598	1377756183	/nfs/dbraw/zinc/75/61/83/1377756183.db2.gz	LJWYCRHYSZDFNA-UHFFFAOYSA-N	0	3	334.460	3.467	20	30		EGEDHN
C=CCO[C@@H]1CO[C@@]2(C1)CCC[N@@H+](Cc1cccc(CC=C)c1[O-])C2	ZINC001138628845	1377756900	/nfs/dbraw/zinc/75/69/00/1377756900.db2.gz	HKJBGESBXJWDAT-PZJWPPBQSA-N	0	3	343.467	3.447	20	30		EGEDHN
C=CCO[C@@H]1CO[C@@]2(C1)CCC[N@H+](Cc1cccc(CC=C)c1[O-])C2	ZINC001138628845	1377756901	/nfs/dbraw/zinc/75/69/01/1377756901.db2.gz	HKJBGESBXJWDAT-PZJWPPBQSA-N	0	3	343.467	3.447	20	30		EGEDHN
C=CCOc1ccccc1CN1CC[C@@]2(C[C@@H](OCC3CC3)CO2)C1	ZINC001139032360	1377820267	/nfs/dbraw/zinc/82/02/67/1377820267.db2.gz	LMXYTBXOYRBKJN-TZIWHRDSSA-N	0	3	343.467	3.411	20	30		EGEDHN
N#Cc1ccc(Oc2ccc(CN3CC[C@@H]4OCC[C@@H]4C3)cn2)cc1	ZINC001139427687	1377882209	/nfs/dbraw/zinc/88/22/09/1377882209.db2.gz	NQFUBEOSIAXBBC-MJGOQNOKSA-N	0	3	335.407	3.356	20	30		EGEDHN
N#Cc1cccc2c(CN3CCCC[C@](O)(C(F)(F)F)C3)c[nH]c21	ZINC001139701360	1377937263	/nfs/dbraw/zinc/93/72/63/1377937263.db2.gz	FPJQLZGPJDLFAJ-MRXNPFEDSA-N	0	3	337.345	3.319	20	30		EGEDHN
N#Cc1cccc2c(CN3CCC(N4CCCCC4=O)CC3)c[nH]c21	ZINC001139704764	1377938234	/nfs/dbraw/zinc/93/82/34/1377938234.db2.gz	CYALQTCPOWGCGR-UHFFFAOYSA-N	0	3	336.439	3.016	20	30		EGEDHN
Cc1ccc(CN2C[C@@H]3[C@@H](CNC(=O)OC(C)(C)C)[C@@H]3C2)cc1C#N	ZINC001139722640	1377941147	/nfs/dbraw/zinc/94/11/47/1377941147.db2.gz	DLPKNMIXYRHVCV-NNZMDNLPSA-N	0	3	341.455	3.069	20	30		EGEDHN
Cc1ccc(CN2CCC3(CC2)c2cccc(F)c2NC3=O)cc1C#N	ZINC001139723659	1377941439	/nfs/dbraw/zinc/94/14/39/1377941439.db2.gz	CXBBYUPOTKKVNA-UHFFFAOYSA-N	0	3	349.409	3.492	20	30		EGEDHN
Cc1ccc(CN2CCC(C)(C(=O)N3CCCC3)CC2)cc1C#N	ZINC001139726288	1377942016	/nfs/dbraw/zinc/94/20/16/1377942016.db2.gz	FMWBSWRCZACRDX-UHFFFAOYSA-N	0	3	325.456	3.091	20	30		EGEDHN
Cc1ccc(CN2CCC[C@H](Oc3ccc(C(N)=O)cc3)C2)cc1C#N	ZINC001139727271	1377942664	/nfs/dbraw/zinc/94/26/64/1377942664.db2.gz	LLVWTUVBYYOPJD-FQEVSTJZSA-N	0	3	349.434	3.009	20	30		EGEDHN
N#Cc1ccc(N2CCCN(Cc3cncc4ccccc43)CC2)nc1	ZINC001139894910	1377974505	/nfs/dbraw/zinc/97/45/05/1377974505.db2.gz	JMEUXNPWXQCYIG-UHFFFAOYSA-N	0	3	343.434	3.214	20	30		EGEDHN
Cn1ncc2cc(CN3CCC[C@@H](Oc4cccc(C#N)c4)C3)ccc21	ZINC001139951978	1377981375	/nfs/dbraw/zinc/98/13/75/1377981375.db2.gz	DURMSBUFVRIHPD-HXUWFJFHSA-N	0	3	346.434	3.488	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCC[N@@H+](Cc1cc(F)ccc1[O-])CC2	ZINC001140054221	1377996932	/nfs/dbraw/zinc/99/69/32/1377996932.db2.gz	MLHZUXNVBPMELV-IBGZPJMESA-N	0	3	332.419	3.064	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCC[N@H+](Cc1cc(F)ccc1[O-])CC2	ZINC001140054221	1377996933	/nfs/dbraw/zinc/99/69/33/1377996933.db2.gz	MLHZUXNVBPMELV-IBGZPJMESA-N	0	3	332.419	3.064	20	30		EGEDHN
CC(C)(C)C(=O)NC1CCN(Cc2c[nH]c3ccc(C#N)cc23)CC1	ZINC001140117563	1378012418	/nfs/dbraw/zinc/01/24/18/1378012418.db2.gz	UUCCSLBOCRYMDD-UHFFFAOYSA-N	0	3	338.455	3.166	20	30		EGEDHN
COc1ccc(CN2CCC3SC(=O)C=C3C2)cc1OCC1CC1	ZINC001140488927	1378071016	/nfs/dbraw/zinc/07/10/16/1378071016.db2.gz	SZSPYWFWGKAWLZ-GOSISDBHSA-N	0	3	345.464	3.258	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@@]23CCN([C@H](C)CC)C3=O)c1[O-]	ZINC001273360222	1378099049	/nfs/dbraw/zinc/09/90/49/1378099049.db2.gz	JCZRFAVIROLLOV-IERDGZPVSA-N	0	3	342.483	3.486	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@@]23CCN([C@H](C)CC)C3=O)c1[O-]	ZINC001273360222	1378099051	/nfs/dbraw/zinc/09/90/51/1378099051.db2.gz	JCZRFAVIROLLOV-IERDGZPVSA-N	0	3	342.483	3.486	20	30		EGEDHN
N#Cc1ccc2[nH]cc(CN3CC4(C3)CCN(Cc3ccc[nH]3)C4)c2c1	ZINC001279224076	1378303496	/nfs/dbraw/zinc/30/34/96/1378303496.db2.gz	LYODVSUUQDIROP-UHFFFAOYSA-N	0	3	345.450	3.076	20	30		EGEDHN
CCN1CCN(Cc2cc(C#N)ccc2Br)C(C)(C)C1	ZINC001141664517	1378359789	/nfs/dbraw/zinc/35/97/89/1378359789.db2.gz	OITPGDQXUXDJPC-UHFFFAOYSA-N	0	3	336.277	3.237	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3c[nH]c4cc(C#N)ccc34)C2)C1=O	ZINC001142916615	1378508416	/nfs/dbraw/zinc/50/84/16/1378508416.db2.gz	GLRKBPLYDJKPRC-OAQYLSRUSA-N	0	3	348.450	3.040	20	30		EGEDHN
C#Cc1ccc(CN2CCC[C@@H]2CN(C)C(=O)OC(C)(C)C)cc1	ZINC001144578406	1378747435	/nfs/dbraw/zinc/74/74/35/1378747435.db2.gz	BXNAPDDQUQRLOB-GOSISDBHSA-N	0	3	328.456	3.499	20	30		EGEDHN
N#CC[C@@H]1CCCN(Cc2c[nH]c3cc(Br)cnc23)C1	ZINC001144700874	1378761121	/nfs/dbraw/zinc/76/11/21/1378761121.db2.gz	QEEBVJWFCVQDDS-NSHDSACASA-N	0	3	333.233	3.451	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C[C@H](C)NCc2cnc(C)o2)CCCC1	ZINC001146819611	1378927501	/nfs/dbraw/zinc/92/75/01/1378927501.db2.gz	BFYIMGVTSIDLGQ-LSDHHAIUSA-N	0	3	333.476	3.492	20	30		EGEDHN
C[C@H](C(=O)NCCNCc1cccc(C#N)c1)c1cc2ccccc2o1	ZINC001147196432	1378985408	/nfs/dbraw/zinc/98/54/08/1378985408.db2.gz	XYFQVMYBFGIBDF-HNNXBMFYSA-N	0	3	347.418	3.314	20	30		EGEDHN
CCC(C)(C)CC(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001147625064	1379051459	/nfs/dbraw/zinc/05/14/59/1379051459.db2.gz	NWGNSELJINMBDI-UHFFFAOYSA-N	0	3	339.483	3.419	20	30		EGEDHN
C[C@H](CN(C)C(=O)c1cc(F)ccc1F)NCc1ccc(C#N)s1	ZINC001283620950	1379059558	/nfs/dbraw/zinc/05/95/58/1379059558.db2.gz	GSRXQMXJQBCZPG-LLVKDONJSA-N	0	3	349.406	3.148	20	30		EGEDHN
Cc1ccc(C(=O)NCCNCc2ccc(C#N)s2)c(Cl)c1C	ZINC001147807325	1379082509	/nfs/dbraw/zinc/08/25/09/1379082509.db2.gz	ZDHUFZIHWRSDHE-UHFFFAOYSA-N	0	3	347.871	3.410	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC2(C1)CCN(Cc1cnccc1C)C2	ZINC001148131189	1379122674	/nfs/dbraw/zinc/12/26/74/1379122674.db2.gz	QRVBXQZIJAGXCC-QGZVFWFLSA-N	0	3	327.472	3.027	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cccc(C(F)F)c2)s1	ZINC001148572835	1379214853	/nfs/dbraw/zinc/21/48/53/1379214853.db2.gz	NDCSXHQLEAAXJX-UHFFFAOYSA-N	0	3	335.379	3.077	20	30		EGEDHN
CCC[C@@H](C(=O)NCCNCc1ccc(C#N)cc1)c1ccccc1	ZINC001150043968	1379488847	/nfs/dbraw/zinc/48/88/47/1379488847.db2.gz	JKOWYZLVMIQVFI-HXUWFJFHSA-N	0	3	335.451	3.348	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@H]1CN([C@H](C)c2ccccc2)CCCO1	ZINC001150084761	1379492006	/nfs/dbraw/zinc/49/20/06/1379492006.db2.gz	GYJMSVQOWARYQM-AEFFLSMTSA-N	0	3	330.472	3.167	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)C2(c3ccccc3)CCCC2)cc1	ZINC001150104411	1379495447	/nfs/dbraw/zinc/49/54/47/1379495447.db2.gz	UGRMAKSLFSTABA-UHFFFAOYSA-N	0	3	347.462	3.276	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@H]2CN(Cc3ccc(C)cc3)CCCO2)C1	ZINC001150299878	1379529884	/nfs/dbraw/zinc/52/98/84/1379529884.db2.gz	WJNQDPCUEPYLAE-LJQANCHMSA-N	0	3	342.483	3.058	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)C[C@H]2CCCC(C)(C)C2)C1	ZINC001150590110	1379574697	/nfs/dbraw/zinc/57/46/97/1379574697.db2.gz	YVJIFFANIUGDCY-MSOLQXFVSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)C2(F)CCCCC2)CC1	ZINC001151387622	1379709312	/nfs/dbraw/zinc/70/93/12/1379709312.db2.gz	ONQOMALOCDXBGF-UHFFFAOYSA-N	0	3	340.483	3.222	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@H](C)c2ccccc2C)CC1	ZINC001151409835	1379713187	/nfs/dbraw/zinc/71/31/87/1379713187.db2.gz	JGIDTUUDVCTBHV-GOSISDBHSA-N	0	3	344.499	3.272	20	30		EGEDHN
CCN(Cc1ccc(OC)c(C#N)c1)[C@H](C)CNC(=O)CCC1CC1	ZINC001152488167	1379941441	/nfs/dbraw/zinc/94/14/41/1379941441.db2.gz	AEENFZUSVCUCIA-OAHLLOKOSA-N	0	3	343.471	3.084	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)COc1cccc(C(C)C)c1	ZINC001153548612	1380091111	/nfs/dbraw/zinc/09/11/11/1380091111.db2.gz	JFSNMVLAIJFTTK-QGZVFWFLSA-N	0	3	330.472	3.039	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)[C@H]1CCC(F)(F)C1	ZINC001153748864	1380121754	/nfs/dbraw/zinc/12/17/54/1380121754.db2.gz	HSMDEEDBFYCALR-PBHICJAKSA-N	0	3	349.425	3.320	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)[C@H](C)C1CCC1	ZINC001153974590	1380166110	/nfs/dbraw/zinc/16/61/10/1380166110.db2.gz	PUACFLBDWBMMEP-HUUCEWRRSA-N	0	3	345.462	3.460	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)[C@@H]1CCCC12CC2	ZINC001154009363	1380177933	/nfs/dbraw/zinc/17/79/33/1380177933.db2.gz	LRVQNZOXKATUPO-APWZRJJASA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C(Cl)CNC1CC(N(C)C(=O)CCc2ccc(C)s2)C1	ZINC001284826828	1380249698	/nfs/dbraw/zinc/24/96/98/1380249698.db2.gz	IGPPNABTMONREE-UHFFFAOYSA-N	0	3	326.893	3.321	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)[C@@H](C)CC(F)F	ZINC001154359653	1380263889	/nfs/dbraw/zinc/26/38/89/1380263889.db2.gz	FJMMFFCGDFZVMX-UONOGXRCSA-N	0	3	337.414	3.176	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)[C@]12C[C@H]1CCC2	ZINC001154400285	1380270452	/nfs/dbraw/zinc/27/04/52/1380270452.db2.gz	QXFYMMXFDNGSBP-XFQXTVEOSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)cc1	ZINC001154584562	1380310695	/nfs/dbraw/zinc/31/06/95/1380310695.db2.gz	NGLIYUKTIBTYLH-MRXNPFEDSA-N	0	3	327.472	3.487	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)[C@@]1(C)C=CCC1	ZINC001154681927	1380330698	/nfs/dbraw/zinc/33/06/98/1380330698.db2.gz	CUSXPHIHFWBNMV-QRWLVFNGSA-N	0	3	343.446	3.380	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@H](C)N(CC)CCc1csc(C)n1	ZINC001154719590	1380339691	/nfs/dbraw/zinc/33/96/91/1380339691.db2.gz	IEBCDTKLGCEUKE-OAHLLOKOSA-N	0	3	335.517	3.014	20	30		EGEDHN
C=CCCC1(C(=O)NC[C@@H](C)N(CC)CCc2ccns2)CC1	ZINC001155037489	1380396130	/nfs/dbraw/zinc/39/61/30/1380396130.db2.gz	SCYZLTHMLVHAJO-OAHLLOKOSA-N	0	3	335.517	3.259	20	30		EGEDHN
CSc1nc(Cl)c(C#N)c(-n2c3ccccc3nc2[C@@H](C)N)n1	ZINC001155247161	1380428938	/nfs/dbraw/zinc/42/89/38/1380428938.db2.gz	BTFXQZLSUSTTOL-MRVPVSSYSA-N	0	3	344.831	3.082	20	30		EGEDHN
C=CCCC(=O)NCCCNCc1cc(-c2ccc(C)cc2)no1	ZINC001155593664	1380471294	/nfs/dbraw/zinc/47/12/94/1380471294.db2.gz	NQCJSZGRCHWWEM-UHFFFAOYSA-N	0	3	327.428	3.212	20	30		EGEDHN
C=CCOCCCC(=O)NCCCN[C@H](C)c1cc(F)ccc1F	ZINC001156165132	1380534856	/nfs/dbraw/zinc/53/48/56/1380534856.db2.gz	BKPYRFUDUNPZKT-CQSZACIVSA-N	0	3	340.414	3.105	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1ccc(Cl)c(Cl)c1	ZINC001156567792	1380595305	/nfs/dbraw/zinc/59/53/05/1380595305.db2.gz	WYGYUFRRFHPVTR-GFCCVEGCSA-N	0	3	327.255	3.457	20	30		EGEDHN
CC1(C)CCCc2cc(C#N)c(-n3nc(CN)c4ccccc43)nc21	ZINC001156865417	1380709684	/nfs/dbraw/zinc/70/96/84/1380709684.db2.gz	ZMVJDGWKGREVKN-UHFFFAOYSA-N	0	3	331.423	3.365	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)C[C@H](C)C1CC1	ZINC001157145662	1380785646	/nfs/dbraw/zinc/78/56/46/1380785646.db2.gz	HENUUVMDPAFVLL-JKSUJKDBSA-N	0	3	327.472	3.321	20	30		EGEDHN
N#Cc1ccc2c(c1)CCN(C(=O)[C@@H]1CCC[C@@H](c3ccccc3)N1)C2	ZINC001157936434	1381075917	/nfs/dbraw/zinc/07/59/17/1381075917.db2.gz	FYRCXKXFCFJCSR-SFTDATJTSA-N	0	3	345.446	3.326	20	30		EGEDHN
CC(C)C#CC(=O)N1CCCC[C@@H]1CN(C)Cc1cccc(F)c1	ZINC001157940099	1381076514	/nfs/dbraw/zinc/07/65/14/1381076514.db2.gz	TWMIDHCTSAJBAL-LJQANCHMSA-N	0	3	330.447	3.298	20	30		EGEDHN
CC#CCCCC(=O)N1CCCC[C@@H]1CN(C)C[C@@H]1CC(C)(C)CO1	ZINC001158357915	1381216422	/nfs/dbraw/zinc/21/64/22/1381216422.db2.gz	SWQGDICMNZNCAC-MOPGFXCFSA-N	0	3	348.531	3.308	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCCC[C@@H]1CN(C)CCOC1CCC1	ZINC001158377489	1381225011	/nfs/dbraw/zinc/22/50/11/1381225011.db2.gz	MUFIKCWAKCFESD-QZTJIDSGSA-N	0	3	336.520	3.471	20	30		EGEDHN
N#Cc1c(Cl)cc(Cl)nc1N1CCCc2ccc(CN)nc21	ZINC001158656274	1381339239	/nfs/dbraw/zinc/33/92/39/1381339239.db2.gz	XCXIVRBHJOKPBO-UHFFFAOYSA-N	0	3	334.210	3.198	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)[C@H]1CC12CCCC2	ZINC001158723968	1381367754	/nfs/dbraw/zinc/36/77/54/1381367754.db2.gz	SEJZNVKWTFTOAF-QZTJIDSGSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)Cc1c(C)nn(C(C)C)c1C	ZINC001158744141	1381379226	/nfs/dbraw/zinc/37/92/26/1381379226.db2.gz	DAOWQUHGRKPYMZ-GOSISDBHSA-N	0	3	346.519	3.122	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001158746892	1381380112	/nfs/dbraw/zinc/38/01/12/1381380112.db2.gz	KYWBAJDLBMVVSY-UHFFFAOYSA-N	0	3	329.419	3.062	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NCCCNCc1cnc(Cl)s1	ZINC001158857053	1381437798	/nfs/dbraw/zinc/43/77/98/1381437798.db2.gz	LXPWHUFDOUUYLC-UHFFFAOYSA-N	0	3	336.288	3.171	20	30		EGEDHN
CN(C)Cc1ccnc(N2CCC(C#N)(c3ccccc3F)CC2)c1	ZINC001158892204	1381451015	/nfs/dbraw/zinc/45/10/15/1381451015.db2.gz	RBUAQWPCHRJQJS-UHFFFAOYSA-N	0	3	338.430	3.344	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1CC2CCC1CC2	ZINC001158928447	1381468665	/nfs/dbraw/zinc/46/86/65/1381468665.db2.gz	VDUWXUNDWALDGA-NTFDOXNWSA-N	0	3	348.531	3.328	20	30		EGEDHN
C[C@H](N)c1ncc(-c2ccccc2)n1-c1nc2c(cc1C#N)CCC2	ZINC001159594299	1381840753	/nfs/dbraw/zinc/84/07/53/1381840753.db2.gz	DZOZYMRVSMZTEM-ZDUSSCGKSA-N	0	3	329.407	3.314	20	30		EGEDHN
N=C(Nc1ncccc1CN1CCCC1)c1ccc2ccccc2n1	ZINC001159906957	1381933071	/nfs/dbraw/zinc/93/30/71/1381933071.db2.gz	VTAMNEFAHKSTJI-UHFFFAOYSA-N	0	3	331.423	3.263	20	30		EGEDHN
N=C(Nc1ccc(CN2CCCC2)cn1)c1ccc2ccccc2n1	ZINC001159903930	1381933413	/nfs/dbraw/zinc/93/34/13/1381933413.db2.gz	FKHBRTFQOTVMPC-UHFFFAOYSA-N	0	3	331.423	3.263	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2sc(C3CC3)nc2C)CC1	ZINC001160142331	1382015092	/nfs/dbraw/zinc/01/50/92/1382015092.db2.gz	GLXSZWQGRAPGAH-UHFFFAOYSA-N	0	3	331.485	3.267	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc(-c3cnco3)cc2)CC1	ZINC001160508895	1382126395	/nfs/dbraw/zinc/12/63/95/1382126395.db2.gz	YGZRKOXAQVTURS-UHFFFAOYSA-N	0	3	349.434	3.117	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cccc(-n3cccc3)c2)CC1	ZINC001160612867	1382152892	/nfs/dbraw/zinc/15/28/92/1382152892.db2.gz	FXQYXEHYYDODDE-UHFFFAOYSA-N	0	3	335.451	3.415	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cnc3ccccc3c2C)CC1	ZINC001160700319	1382174146	/nfs/dbraw/zinc/17/41/46/1382174146.db2.gz	VADPOYXJKULLBF-UHFFFAOYSA-N	0	3	335.451	3.481	20	30		EGEDHN
COc1cccc(CN2CC[C@H](Nc3ccc4[nH]c(C#N)cc4n3)C2)c1	ZINC001161192124	1382335386	/nfs/dbraw/zinc/33/53/86/1382335386.db2.gz	BFXPXQDVIVIDHX-HNNXBMFYSA-N	0	3	347.422	3.130	20	30		EGEDHN
N#Cc1nc(NCC2CCN(Cc3ccccn3)CC2)ccc1Cl	ZINC001161240956	1382352070	/nfs/dbraw/zinc/35/20/70/1382352070.db2.gz	LMSDCWXIORIDIU-UHFFFAOYSA-N	0	3	341.846	3.326	20	30		EGEDHN
C[C@H](c1ccccc1)N(C(=O)[C@H]1CCNC[C@@H]1F)C1=CC(=O)CCC1	ZINC001161509431	1382426355	/nfs/dbraw/zinc/42/63/55/1382426355.db2.gz	PEZMCMDNEFEFLD-CCKFTAQKSA-N	0	3	344.430	3.161	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C(C)(C)c2cccc(OC)c2)CC1	ZINC001161665172	1382475009	/nfs/dbraw/zinc/47/50/09/1382475009.db2.gz	JLGDHFWICJCIHI-UHFFFAOYSA-N	0	3	342.483	3.297	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@]2(c3ccccc3)C[C@H](F)C2)CC1	ZINC001161801991	1382510713	/nfs/dbraw/zinc/51/07/13/1382510713.db2.gz	WOVNWTPWQIHCDX-XUTJKUGGSA-N	0	3	342.458	3.381	20	30		EGEDHN
C=C(Cl)CN1CC=C(CCNC(=O)c2n[nH]c3ccccc32)CC1	ZINC001161809585	1382514973	/nfs/dbraw/zinc/51/49/73/1382514973.db2.gz	ZXQMLGZZGVWUPS-UHFFFAOYSA-N	0	3	344.846	3.067	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2c[nH]c3ccc(C)cc23)CC1	ZINC001161963335	1382574127	/nfs/dbraw/zinc/57/41/27/1382574127.db2.gz	AQAPJFHTOKQMLL-UHFFFAOYSA-N	0	3	335.451	3.252	20	30		EGEDHN
C#CC[C@H](CC(=O)NCCC1=CCN(CC#CC)CC1)c1ccccc1	ZINC001162003036	1382595997	/nfs/dbraw/zinc/59/59/97/1382595997.db2.gz	UFNDLQBYSJRUOI-JOCHJYFZSA-N	0	3	348.490	3.345	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCC1(COC)CCN(C[C@H](F)CC)CC1	ZINC001162424987	1382755339	/nfs/dbraw/zinc/75/53/39/1382755339.db2.gz	XNAHETBMSUQKCZ-DLBZAZTESA-N	0	3	342.499	3.182	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@H](C)CC2CCCC2)(COC)CC1	ZINC001162513388	1382778543	/nfs/dbraw/zinc/77/85/43/1382778543.db2.gz	LAOYGTIIRLSCBN-GOSISDBHSA-N	0	3	348.531	3.071	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@H]2CC[C@H](CC)CC2)(COC)CC1	ZINC001162582198	1382798859	/nfs/dbraw/zinc/79/88/59/1382798859.db2.gz	XROLDUNMJKDGMJ-WGSAOQKQSA-N	0	3	348.531	3.071	20	30		EGEDHN
C#CCN1CCC(CNC(=O)CCCC2CCCCC2)(COC)CC1	ZINC001162595473	1382802944	/nfs/dbraw/zinc/80/29/44/1382802944.db2.gz	XKOFJJJEOOJUFU-UHFFFAOYSA-N	0	3	348.531	3.215	20	30		EGEDHN
C[C@H](N)c1nc2ccccc2n1-c1cc(C#N)cc(C(F)(F)F)n1	ZINC001162758701	1382860989	/nfs/dbraw/zinc/86/09/89/1382860989.db2.gz	KROMXMGTEFKSQB-VIFPVBQESA-N	0	3	331.301	3.331	20	30		EGEDHN
C[C@H](N)c1nc2ccccc2n1-c1ccc(C(F)(F)F)c(C#N)n1	ZINC001162758795	1382861407	/nfs/dbraw/zinc/86/14/07/1382861407.db2.gz	MSMMZKGTOUXCDO-VIFPVBQESA-N	0	3	331.301	3.331	20	30		EGEDHN
C[C@@H](N)c1nc2ccccc2n1-c1c(Br)cncc1C#N	ZINC001162776767	1382869937	/nfs/dbraw/zinc/86/99/37/1382869937.db2.gz	BWVQGQZHLXLXLO-SECBINFHSA-N	0	3	342.200	3.074	20	30		EGEDHN
C[C@@H](N)c1nc2ccccc2n1-c1cc(Br)cc(C#N)n1	ZINC001162779352	1382870477	/nfs/dbraw/zinc/87/04/77/1382870477.db2.gz	YLBBPZFNZLWADG-SECBINFHSA-N	0	3	342.200	3.074	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C[C@H](CC)C(C)C	ZINC001162983098	1382937248	/nfs/dbraw/zinc/93/72/48/1382937248.db2.gz	YMFOKIVGBFBJTM-FQEVSTJZSA-N	0	3	328.500	3.353	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)Cc1ccccc1C	ZINC001162997356	1382942803	/nfs/dbraw/zinc/94/28/03/1382942803.db2.gz	SOHBZFRAQIFLDT-UHFFFAOYSA-N	0	3	348.490	3.222	20	30		EGEDHN
CCCCC(=O)NCCC1(CNCc2cc(C#N)ccc2F)CC1	ZINC001163464736	1383057237	/nfs/dbraw/zinc/05/72/37/1383057237.db2.gz	ZNUZQSIGOSWWMR-UHFFFAOYSA-N	0	3	331.435	3.264	20	30		EGEDHN
C[C@@H](NCC1(CCNC(=O)[C@@H](C)C#N)CC1)c1cc(F)ccc1F	ZINC001163842391	1383128107	/nfs/dbraw/zinc/12/81/07/1383128107.db2.gz	YRZZJIXZNZEZDS-QWHCGFSZSA-N	0	3	335.398	3.062	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCCNCc1cnc(-c2ccccc2)o1	ZINC001163953452	1383139229	/nfs/dbraw/zinc/13/92/29/1383139229.db2.gz	RRJGJBJMLODZJT-UHFFFAOYSA-N	0	3	327.428	3.150	20	30		EGEDHN
CN(C)/C=N/c1ccc(NCCOc2ccccc2F)cc1C#N	ZINC001163959801	1383139971	/nfs/dbraw/zinc/13/99/71/1383139971.db2.gz	ZGFQNBOMBMJDPF-LPYMAVHISA-N	0	3	326.375	3.410	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCCNCC(=O)Nc1ccccc1C(C)C	ZINC001163963596	1383140419	/nfs/dbraw/zinc/14/04/19/1383140419.db2.gz	GDHRJNZDQAEOOM-UHFFFAOYSA-N	0	3	345.487	3.057	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCCNCc1nsc2ccccc12	ZINC001164222279	1383167525	/nfs/dbraw/zinc/16/75/25/1383167525.db2.gz	JXTJNDARUJHHDW-KGLIPLIRSA-N	0	3	331.485	3.350	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCC1(CNCc2ccc(F)cn2)CC1	ZINC001164648801	1383213731	/nfs/dbraw/zinc/21/37/31/1383213731.db2.gz	OVVATVAJVLHUNW-UHFFFAOYSA-N	0	3	345.462	3.365	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCC1(CNCc2ocnc2C)CC1	ZINC001164649025	1383214344	/nfs/dbraw/zinc/21/43/44/1383214344.db2.gz	SIMYBZVIJZGHFW-UHFFFAOYSA-N	0	3	331.460	3.128	20	30		EGEDHN
CCN1CCC(N(C)C(F)(F)c2ccc(C#N)c(Cl)n2)CC1	ZINC001165068430	1383220920	/nfs/dbraw/zinc/22/09/20/1383220920.db2.gz	LVRZTUKCFIDRBU-UHFFFAOYSA-N	0	3	328.794	3.072	20	30		EGEDHN
N#CCc1ccc(NCC2CN(Cc3ccccc3)C2)cc1[N+](=O)[O-]	ZINC001165455156	1383298099	/nfs/dbraw/zinc/29/80/99/1383298099.db2.gz	VEACKAJSCDDSSV-UHFFFAOYSA-N	0	3	336.395	3.205	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@@H]2CCC[C@H]2C(F)F)CC1	ZINC001165465082	1383298655	/nfs/dbraw/zinc/29/86/55/1383298655.db2.gz	SKPDWQMTAKHQEP-CHWSQXEVSA-N	0	3	334.838	3.296	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)Cc2cccc(CC)c2)CC1	ZINC001165828684	1383350921	/nfs/dbraw/zinc/35/09/21/1383350921.db2.gz	ZCTZRIAGVCGQJK-UHFFFAOYSA-N	0	3	334.891	3.420	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCC1(CNCc2nc(C)cs2)CC1	ZINC001166692123	1383461525	/nfs/dbraw/zinc/46/15/25/1383461525.db2.gz	AZWWWDXMHUKQLO-DZGCQCFKSA-N	0	3	335.517	3.286	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@H]2CCCc3cccnc32)CC1	ZINC001166793007	1383477982	/nfs/dbraw/zinc/47/79/82/1383477982.db2.gz	AYOOWUJEXLPLRR-INIZCTEOSA-N	0	3	347.890	3.130	20	30		EGEDHN
C=CCCC1(C(=O)NCCC2(CNCc3oc(C)nc3C)CC2)CC1	ZINC001167025337	1383522156	/nfs/dbraw/zinc/52/21/56/1383522156.db2.gz	FMACIFIVIGXROV-UHFFFAOYSA-N	0	3	345.487	3.414	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2oc(C(C)C)nc2C)CC1	ZINC001167414653	1383627962	/nfs/dbraw/zinc/62/79/62/1383627962.db2.gz	PWIBKHJYUNFCKP-UHFFFAOYSA-N	0	3	339.867	3.349	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@H]2CCOc3ccccc32)CC1	ZINC001167466388	1383640390	/nfs/dbraw/zinc/64/03/90/1383640390.db2.gz	KSIOLKKSKAZBHX-INIZCTEOSA-N	0	3	348.874	3.181	20	30		EGEDHN
C=C(Cl)Cn1c([C@H](C)CC)nnc1N1CCN(C(C)(C)C)CC1	ZINC001301018204	1383690275	/nfs/dbraw/zinc/69/02/75/1383690275.db2.gz	WVOJGQMVPWLTMF-CYBMUJFWSA-N	0	3	339.915	3.465	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1ccsc1Cl	ZINC001167651116	1383698395	/nfs/dbraw/zinc/69/83/95/1383698395.db2.gz	ZWQILDKNEAENJP-UHFFFAOYSA-N	0	3	333.844	3.183	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cc3ccccc3[nH]2)CC1	ZINC001168023538	1383799436	/nfs/dbraw/zinc/79/94/36/1383799436.db2.gz	JAAJUUYHFFUIDH-UHFFFAOYSA-N	0	3	331.847	3.410	20	30		EGEDHN
C[C@@H](C(=O)NCCCNCc1ccccc1C#N)[C@H](C)C(C)(C)C	ZINC001168163759	1383830552	/nfs/dbraw/zinc/83/05/52/1383830552.db2.gz	BJOYHZSLCRCCPM-CVEARBPZSA-N	0	3	329.488	3.472	20	30		EGEDHN
C[C@@H](Cc1ccc(Cl)cc1)N1CCN(c2cc(C#N)ccn2)CC1	ZINC001168187545	1383839153	/nfs/dbraw/zinc/83/91/53/1383839153.db2.gz	GYUSSNPBQBRVRO-HNNXBMFYSA-N	0	3	340.858	3.360	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CN([C@H](C)Cc3cccc(F)c3)C2)CC1	ZINC001168476287	1383917738	/nfs/dbraw/zinc/91/77/38/1383917738.db2.gz	SGFGQANBGZRGTI-MRXNPFEDSA-N	0	3	346.446	3.477	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)c1cccnc1	ZINC001168805982	1384012398	/nfs/dbraw/zinc/01/23/98/1384012398.db2.gz	MYIYQUALQSWJEG-MRXNPFEDSA-N	0	3	336.439	3.032	20	30		EGEDHN
C[C@@H]1C[C@H](N(C)Cc2ccc(C#N)cc2)CN1C(=O)OC(C)(C)C	ZINC001168865453	1384039709	/nfs/dbraw/zinc/03/97/09/1384039709.db2.gz	MPAZRSVFBKCHGH-PBHICJAKSA-N	0	3	329.444	3.388	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@@H]1CCCC[C@@H]1CC	ZINC001169720866	1384178547	/nfs/dbraw/zinc/17/85/47/1384178547.db2.gz	WJUGNVSKCURBSJ-UONOGXRCSA-N	0	3	331.298	3.207	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@H]1C[C@@]1(CC)C(C)C	ZINC001169729660	1384179504	/nfs/dbraw/zinc/17/95/04/1384179504.db2.gz	NRDISXMRQHQUCG-HIFRSBDPSA-N	0	3	331.298	3.063	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)C1CC(C)C1	ZINC001170109719	1384237058	/nfs/dbraw/zinc/23/70/58/1384237058.db2.gz	CNXVKMLGAAXRLO-KOHRHEQBSA-N	0	3	327.472	3.369	20	30		EGEDHN
CCc1oc(C(=O)NCCCNCc2ccc(C#N)cc2F)cc1C	ZINC001170995166	1384426760	/nfs/dbraw/zinc/42/67/60/1384426760.db2.gz	WNGXRGJUYTXZLA-UHFFFAOYSA-N	0	3	343.402	3.071	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H](C)CCCCN[C@H](C)c1nnc(CC)[nH]1	ZINC001171043891	1384435846	/nfs/dbraw/zinc/43/58/46/1384435846.db2.gz	QNYIXLCWVITPQO-HUUCEWRRSA-N	0	3	335.496	3.049	20	30		EGEDHN
CN1CCN(c2ccc(NC(=N)c3ccc4ccccc4n3)cc2)CC1	ZINC001171048658	1384436212	/nfs/dbraw/zinc/43/62/12/1384436212.db2.gz	QSUDERDFOGAXAX-UHFFFAOYSA-N	0	3	345.450	3.024	20	30		EGEDHN
Cc1nc2c(ncc(NC(=N)c3ccc4cc(O)ccc4c3)c2C)[nH]1	ZINC001171185119	1384462929	/nfs/dbraw/zinc/46/29/29/1384462929.db2.gz	GDFSNAMGCNYPMX-UHFFFAOYSA-N	0	3	331.379	3.471	20	30		EGEDHN
C[C@@H](Cc1cccc(C#N)c1)N1CCC[C@H](NC(=O)OC(C)(C)C)C1	ZINC001171204096	1384467947	/nfs/dbraw/zinc/46/79/47/1384467947.db2.gz	SXKNXGSYKBRYJS-YJBOKZPZSA-N	0	3	343.471	3.478	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1CC[C@H](F)[C@](O)(C(F)(F)F)CC1	ZINC001171210748	1384469883	/nfs/dbraw/zinc/46/98/83/1384469883.db2.gz	WEEQGHVPRRDTAS-KCXAZCMYSA-N	0	3	344.352	3.217	20	30		EGEDHN
Cc1nccnc1O[C@@H]1CCCN([C@@H](C)Cc2cccc(C#N)c2)C1	ZINC001171231622	1384475570	/nfs/dbraw/zinc/47/55/70/1384475570.db2.gz	KLKKYOUSMAEQGM-HNAYVOBHSA-N	0	3	336.439	3.131	20	30		EGEDHN
CCCCCCC[NH2+]CCCC[C@@H](C)NC(=O)c1cnc[n-]c1=O	ZINC001171436814	1384523409	/nfs/dbraw/zinc/52/34/09/1384523409.db2.gz	NRUBVHJHPXASTD-OAHLLOKOSA-N	0	3	336.480	3.031	20	30		EGEDHN
C[C@@H](CC#N)N[C@H]1CC[C@H]2CN(C(=O)c3ccccc3)CC[C@H]2C1	ZINC001172520452	1384808545	/nfs/dbraw/zinc/80/85/45/1384808545.db2.gz	NJCSCFVZKTZSPM-WNHJNPCNSA-N	0	3	325.456	3.209	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H](N[C@@H]2CCCC[C@H]2F)C[C@H]1C#N	ZINC001172967572	1384892135	/nfs/dbraw/zinc/89/21/35/1384892135.db2.gz	YLQSXPSPNCBEGO-LXTVHRRPSA-N	0	3	325.428	3.148	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H](NC(C)(C)c2ccncc2)C[C@H]1C#N	ZINC001172981089	1384894289	/nfs/dbraw/zinc/89/42/89/1384894289.db2.gz	JLBRLFJOIHRFHL-HOTGVXAUSA-N	0	3	344.459	3.198	20	30		EGEDHN
C=CCOC[C@H]1c2c(ncn2C)CCN1C1CCC(OCCC)CC1	ZINC001173097600	1384914112	/nfs/dbraw/zinc/91/41/12/1384914112.db2.gz	CRFFRYGIJSPNFR-TVPLGVNVSA-N	0	3	347.503	3.260	20	30		EGEDHN
C=CCOC1CCC(NCc2nc(SC)ncc2Cl)CC1	ZINC001173318078	1384956925	/nfs/dbraw/zinc/95/69/25/1384956925.db2.gz	PHVURUYTKXQWRV-UHFFFAOYSA-N	0	3	327.881	3.455	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)CCC2CC2)CC1	ZINC001317219742	1384999944	/nfs/dbraw/zinc/99/99/44/1384999944.db2.gz	SLWBRTVNAYMVKB-UHFFFAOYSA-N	0	3	329.282	3.102	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@H](C)NCc2ccc(F)c(C#N)c2)c(C)c1	ZINC001317279202	1385049478	/nfs/dbraw/zinc/04/94/78/1385049478.db2.gz	AWEWDIWMKFGFOD-HNNXBMFYSA-N	0	3	339.414	3.222	20	30		EGEDHN
C=Cc1ccc(C(=O)NCC[C@@H](C)NCC(=C)Br)cc1	ZINC001317409774	1385120952	/nfs/dbraw/zinc/12/09/52/1385120952.db2.gz	RZBNWZUXLWMRSB-CYBMUJFWSA-N	0	3	337.261	3.336	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)C1(c2ccccc2F)CCC1	ZINC001317412121	1385122835	/nfs/dbraw/zinc/12/28/35/1385122835.db2.gz	IVCJRLAJWOJMKN-CQSZACIVSA-N	0	3	338.854	3.484	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H](C)CCCCN[C@@H](C)c1nnc(C)[nH]1	ZINC001174673490	1385132644	/nfs/dbraw/zinc/13/26/44/1385132644.db2.gz	XSVLDFJXUXXXFA-KGLIPLIRSA-N	0	3	335.496	3.041	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@H](C)CCCCNCc1cc(OC)no1	ZINC001175082685	1385192069	/nfs/dbraw/zinc/19/20/69/1385192069.db2.gz	RFFRQPDWRAZYDR-KDOFPFPSSA-N	0	3	337.464	3.050	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H](C)CCCCNCc2nccn2CC)C1	ZINC001175151301	1385205911	/nfs/dbraw/zinc/20/59/11/1385205911.db2.gz	XUAUQOCELUVRDU-MRXNPFEDSA-N	0	3	332.492	3.024	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H](C)CCCCNCc1ccn(CC)n1	ZINC001175469500	1385301556	/nfs/dbraw/zinc/30/15/56/1385301556.db2.gz	SGTORXOCHOULTF-MRXNPFEDSA-N	0	3	334.508	3.270	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](CCNC(=O)c3ccccc3)C2)s1	ZINC001317774587	1385468677	/nfs/dbraw/zinc/46/86/77/1385468677.db2.gz	ZXYJOWRGULEKHM-HNNXBMFYSA-N	0	3	339.464	3.262	20	30		EGEDHN
CC1(C(=O)NCC[C@@H]2CCN(Cc3ccccc3C#N)C2)CCCC1	ZINC001317795049	1385487199	/nfs/dbraw/zinc/48/71/99/1385487199.db2.gz	HELYMJBRLLWVTH-QGZVFWFLSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=C[C@@H](CC(=O)NCCCNCc1c(C)noc1C)c1ccccc1	ZINC001176762493	1385687654	/nfs/dbraw/zinc/68/76/54/1385687654.db2.gz	DFJVLLCKPUUNPI-KRWDZBQOSA-N	0	3	341.455	3.247	20	30		EGEDHN
Cc1ccccc1[C@@H](C)C(=O)NCCCNCc1ccccc1C#N	ZINC001176790430	1385700338	/nfs/dbraw/zinc/70/03/38/1385700338.db2.gz	MRJPFASTMKGMTG-QGZVFWFLSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=CCC1(C(=O)NCCCN[C@@H](C)c2cnc(C)cn2)CCCCC1	ZINC001176790595	1385700416	/nfs/dbraw/zinc/70/04/16/1385700416.db2.gz	OEKUSDFHOMHURV-KRWDZBQOSA-N	0	3	344.503	3.469	20	30		EGEDHN
C#CCC1(C(=O)NCCCNCc2c(C)noc2CC)CCCCC1	ZINC001177224056	1385874076	/nfs/dbraw/zinc/87/40/76/1385874076.db2.gz	PETXPDDJUWMTRZ-UHFFFAOYSA-N	0	3	345.487	3.115	20	30		EGEDHN
C=CCCC(=O)N(CCCNCc1cnc(C)o1)CC1CCCC1	ZINC001177245780	1385882914	/nfs/dbraw/zinc/88/29/14/1385882914.db2.gz	IGNCIUICIVYWPL-UHFFFAOYSA-N	0	3	333.476	3.448	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NCCCNCc1ccc(Cl)cc1Cl	ZINC001177273100	1385892287	/nfs/dbraw/zinc/89/22/87/1385892287.db2.gz	HKVQRZFCQXMEJP-LBPRGKRZSA-N	0	3	345.270	3.180	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@@H]1C[C@@H](C)CO1	ZINC001177368803	1385932390	/nfs/dbraw/zinc/93/23/90/1385932390.db2.gz	XZLHNNRXNNXLMI-PBHICJAKSA-N	0	3	342.911	3.162	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@@H](C)CCOC	ZINC001177484720	1385974497	/nfs/dbraw/zinc/97/44/97/1385974497.db2.gz	IPWZBTAIMNCCRJ-HNNXBMFYSA-N	0	3	344.927	3.410	20	30		EGEDHN
N#CC(Cc1cccs1)C(=O)NCc1cccc(-c2c[nH]cn2)c1	ZINC001177917150	1386083321	/nfs/dbraw/zinc/08/33/21/1386083321.db2.gz	DMACWISFXKOVOC-HNNXBMFYSA-N	0	3	336.420	3.137	20	30		EGEDHN
C/C=C(\C)C(=O)N1CC[C@H](NCC#Cc2cccc(Cl)c2)[C@@H]1C	ZINC001178442520	1386218978	/nfs/dbraw/zinc/21/89/78/1386218978.db2.gz	LDGBCVNCOMMQBD-ZGTQULCZSA-N	0	3	330.859	3.237	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](NCc2cccc(C(C)C)n2)[C@@H]1C	ZINC001178503698	1386237559	/nfs/dbraw/zinc/23/75/59/1386237559.db2.gz	LXWVTFGGWXQNHY-PXNSSMCTSA-N	0	3	341.499	3.478	20	30		EGEDHN
CC/C(C)=C/C(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@@H]1C	ZINC001178637324	1386266120	/nfs/dbraw/zinc/26/61/20/1386266120.db2.gz	NMQOGYCOWNFKJC-OPUXSOHZSA-N	0	3	328.431	3.113	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)[C@@H]1C	ZINC001178802824	1386309746	/nfs/dbraw/zinc/30/97/46/1386309746.db2.gz	VWCNCVKJYKMEQY-KSSFIOAISA-N	0	3	329.419	3.133	20	30		EGEDHN
CC#CCCCC(=O)NCCCCCCNCc1csc(C)n1	ZINC001179320553	1386451516	/nfs/dbraw/zinc/45/15/16/1386451516.db2.gz	VVIDDYHJWALFPO-UHFFFAOYSA-N	0	3	335.517	3.411	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCCCCCN[C@@H](C)c1nnc(C)[nH]1	ZINC001179481497	1386494481	/nfs/dbraw/zinc/49/44/81/1386494481.db2.gz	GOXJOJXKWNAXBY-KBXCAEBGSA-N	0	3	335.496	3.043	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCCCCCNCc1nccn1CC	ZINC001179692113	1386555167	/nfs/dbraw/zinc/55/51/67/1386555167.db2.gz	CDQNFMVVJGPUOU-UHFFFAOYSA-N	0	3	334.508	3.272	20	30		EGEDHN
C[C@H](C#N)C(=O)N(Cc1ccccc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC001179895353	1386621120	/nfs/dbraw/zinc/62/11/20/1386621120.db2.gz	MPZXPABPBUUBAQ-WIYYLYMNSA-N	0	3	347.462	3.449	20	30		EGEDHN
C[C@@H](C#N)C(=O)Nc1ccc(N2CCN(Cc3ccccc3)CC2)cc1	ZINC001179896898	1386621823	/nfs/dbraw/zinc/62/18/23/1386621823.db2.gz	RQGJNWGDSGLQOP-KRWDZBQOSA-N	0	3	348.450	3.107	20	30		EGEDHN
CCc1ccc(C(=O)N2CC[C@H](NCC#Cc3ccccc3)[C@@H]2C)cc1	ZINC001180042399	1386678773	/nfs/dbraw/zinc/67/87/73/1386678773.db2.gz	XXTUFHNKZWGTLT-AVRDEDQJSA-N	0	3	346.474	3.493	20	30		EGEDHN
C=CCCOCC(=O)N1CC[C@H](N[C@H](C)c2ccccc2F)[C@@H]1C	ZINC001180264327	1386750146	/nfs/dbraw/zinc/75/01/46/1386750146.db2.gz	HTBUWYZVDUMDHX-VKJFTORMSA-N	0	3	334.435	3.058	20	30		EGEDHN
CS[C@@H]1CC[C@H](N(C)[C@H]2CCCN(c3ccc(C#N)cc3)C2=O)C1	ZINC001321021876	1386785869	/nfs/dbraw/zinc/78/58/69/1386785869.db2.gz	MXVDGFGZNAIETM-KSZLIROESA-N	0	3	343.496	3.270	20	30		EGEDHN
C=CCSCC(=O)N1CCC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC001180559247	1386835600	/nfs/dbraw/zinc/83/56/00/1386835600.db2.gz	LSOJJNSPTRSQFF-MSOLQXFVSA-N	0	3	330.497	3.029	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2cc(C3CC3)no2)C1	ZINC001180846734	1386883020	/nfs/dbraw/zinc/88/30/20/1386883020.db2.gz	VHFCYJNSIWSTNZ-AUUYWEPGSA-N	0	3	331.460	3.092	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)c1ccccc1Cl	ZINC001322284643	1387139123	/nfs/dbraw/zinc/13/91/23/1387139123.db2.gz	DMIPTVOZFAKZGB-CQSZACIVSA-N	0	3	341.842	3.462	20	30		EGEDHN
C=CCCC1(C(=O)N2C[C@@H](C)[C@](C)(CNCc3nccs3)C2)CC1	ZINC001182498367	1387177523	/nfs/dbraw/zinc/17/75/23/1387177523.db2.gz	DRXBVQPEHBFPKD-CRAIPNDOSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](NCc2ccc(OC)c(F)c2)C1	ZINC001182818254	1387229305	/nfs/dbraw/zinc/22/93/05/1387229305.db2.gz	BENJRTZTMQNRIE-QGZVFWFLSA-N	0	3	346.446	3.293	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](NCc2ccccc2N(C)C)C1	ZINC001182898227	1387242286	/nfs/dbraw/zinc/24/22/86/1387242286.db2.gz	RLMPGNYJGDFDKO-QGZVFWFLSA-N	0	3	329.488	3.045	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](NCc2cc(F)c(OC)c(F)c2)C1	ZINC001182940279	1387249476	/nfs/dbraw/zinc/24/94/76/1387249476.db2.gz	LGUQGMUNSNYOKN-CQSZACIVSA-N	0	3	338.398	3.020	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccc(Cl)o1)N(C)Cc1cccc(C#N)c1	ZINC001329386745	1389089062	/nfs/dbraw/zinc/08/90/62/1389089062.db2.gz	SSLJMKIOMCLOJI-LBPRGKRZSA-N	0	3	331.803	3.055	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1cccc(OCc2cscn2)c1	ZINC001340201270	1390248434	/nfs/dbraw/zinc/24/84/34/1390248434.db2.gz	NCLCKMTWWKRTMM-MRXNPFEDSA-N	0	3	331.441	3.344	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N(CC1CC1)C1CCC1	ZINC001340206970	1390250401	/nfs/dbraw/zinc/25/04/01/1390250401.db2.gz	GPMJZOPGYBQMTD-INIZCTEOSA-N	0	3	329.492	3.042	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)[C@@H](C)c1ccccc1	ZINC001698771771	1406432222	/nfs/dbraw/zinc/43/22/22/1406432222.db2.gz	PXUWYDUCRPOMAJ-SJORKVTESA-N	0	3	335.451	3.204	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)NC[C@@H]1CCN(c2cc(Cl)ccc2C)C1	ZINC001340847569	1390383378	/nfs/dbraw/zinc/38/33/78/1390383378.db2.gz	ZTVSDLRPUNIBLU-RDJZCZTQSA-N	0	3	349.906	3.275	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N[C@@H](CC(C)C)c1nc2ccccc2[nH]1	ZINC001341540726	1390499603	/nfs/dbraw/zinc/49/96/03/1390499603.db2.gz	RVKYSMPSZJBHCT-YOEHRIQHSA-N	0	3	328.460	3.450	20	30		EGEDHN
C=CCn1c([C@H](C)SC)nnc1N1CCN(C2CCCCC2)CC1	ZINC001342219870	1390586804	/nfs/dbraw/zinc/58/68/04/1390586804.db2.gz	HSQMTRBJPAVVQM-HNNXBMFYSA-N	0	3	349.548	3.343	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)NCc1ccc(Oc2ccccc2)nc1	ZINC001343408681	1390712014	/nfs/dbraw/zinc/71/20/14/1390712014.db2.gz	DHBXEGMVIGZVNP-QGZVFWFLSA-N	0	3	325.412	3.174	20	30		EGEDHN
Cc1cnc2ccccc2c1N1CC[C@H](Oc2ccc(C#N)cn2)C1	ZINC001343741767	1390734321	/nfs/dbraw/zinc/73/43/21/1390734321.db2.gz	DMQWHMMYDXLAJH-INIZCTEOSA-N	0	3	330.391	3.468	20	30		EGEDHN
N#CC(C(=O)c1ccc2c(c1)CCC2)c1nc(N)c2ccccc2n1	ZINC001343983906	1390748300	/nfs/dbraw/zinc/74/83/00/1390748300.db2.gz	ZPYPPAFAMKLXNT-MRXNPFEDSA-N	0	3	328.375	3.191	20	30		EGEDHN
CC(C)Cn1c([C@H](C)CCC#N)nnc1N1CCN(C(C)(C)C)CC1	ZINC001344846544	1390818825	/nfs/dbraw/zinc/81/88/25/1390818825.db2.gz	BHUAFELULBSMDQ-MRXNPFEDSA-N	0	3	346.523	3.262	20	30		EGEDHN
CCc1c(C(=O)C(C#N)c2nccn2CC)cnn1-c1ccccc1C	ZINC001346096773	1390907325	/nfs/dbraw/zinc/90/73/25/1390907325.db2.gz	UQHHNOALBICPLJ-HNNXBMFYSA-N	0	3	347.422	3.450	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)Cc2csc(CC)n2)CCCC1	ZINC001698802298	1406479577	/nfs/dbraw/zinc/47/95/77/1406479577.db2.gz	DOSJOIHZKVRELY-UHFFFAOYSA-N	0	3	341.908	3.019	20	30		EGEDHN
Cc1cccc(C(=O)N(C)[C@H](C)CNCc2ccc(C#N)s2)c1	ZINC001698812935	1406501714	/nfs/dbraw/zinc/50/17/14/1406501714.db2.gz	YXZUUVCFQDAWGR-CQSZACIVSA-N	0	3	327.453	3.179	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N1CCCC2(CCCC2)C1	ZINC001351543592	1391650176	/nfs/dbraw/zinc/65/01/76/1391650176.db2.gz	ICWRTMANWSMCLA-KRWDZBQOSA-N	0	3	343.519	3.434	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N1CCO[C@H](c2c(F)cccc2Cl)C1	ZINC001354145789	1392122842	/nfs/dbraw/zinc/12/28/42/1392122842.db2.gz	QTZQTWIYMLXQQI-GJZGRUSLSA-N	0	3	340.826	3.063	20	30		EGEDHN
Cc1cc(C(=O)NCC[C@H](C)NCc2cc(C#N)ccc2F)c(C)o1	ZINC001480750882	1392913759	/nfs/dbraw/zinc/91/37/59/1392913759.db2.gz	PWQVMLAQJNUNEH-LBPRGKRZSA-N	0	3	343.402	3.205	20	30		EGEDHN
CCCN(CCNC(=O)c1ccc(Cl)[nH]1)Cc1ccc(C#N)cc1	ZINC001481145990	1393133144	/nfs/dbraw/zinc/13/31/44/1393133144.db2.gz	RPTJOEWFALGTOV-UHFFFAOYSA-N	0	3	344.846	3.182	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1ccc2cc[nH]c2c1)C1CC1	ZINC001481943246	1394608777	/nfs/dbraw/zinc/60/87/77/1394608777.db2.gz	DEPVQDSVAKCOID-GOSISDBHSA-N	0	3	331.847	3.409	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1cccc2c1CCC2)C1CC1	ZINC001481952006	1394615194	/nfs/dbraw/zinc/61/51/94/1394615194.db2.gz	ONJFIEXKZNKIPF-IBGZPJMESA-N	0	3	332.875	3.416	20	30		EGEDHN
COc1ccc(Cl)cc1CNC1(CNC(=O)[C@@H](C)C#N)CCCC1	ZINC001482213402	1394807046	/nfs/dbraw/zinc/80/70/46/1394807046.db2.gz	MQKLNNDEYAHWFI-ZDUSSCGKSA-N	0	3	349.862	3.027	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cccc(N(C)C)c2)CCCC1	ZINC001482236655	1394832252	/nfs/dbraw/zinc/83/22/52/1394832252.db2.gz	NPAQATGPCYHSOT-UHFFFAOYSA-N	0	3	335.879	3.137	20	30		EGEDHN
Cc1sccc1C(=O)N(C)[C@H](C)CNCc1ccc(C#N)s1	ZINC001482280585	1394863628	/nfs/dbraw/zinc/86/36/28/1394863628.db2.gz	HTGIXBUZGNKLFP-LLVKDONJSA-N	0	3	333.482	3.240	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cnc2ccccc2c1)C(C)C	ZINC001698971189	1406734991	/nfs/dbraw/zinc/73/49/91/1406734991.db2.gz	MHHHNNCEPQFUHJ-KRWDZBQOSA-N	0	3	331.847	3.331	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cncc2ccccc21)C(C)C	ZINC001698980301	1406757048	/nfs/dbraw/zinc/75/70/48/1406757048.db2.gz	JAIDUMYPXRTPAI-KRWDZBQOSA-N	0	3	331.847	3.331	20	30		EGEDHN
C=C(Br)CNCC(C)(C)CN(C)C(=O)c1cocc1C	ZINC001485257146	1395743882	/nfs/dbraw/zinc/74/38/82/1395743882.db2.gz	GNFDUZUJVFZLKO-UHFFFAOYSA-N	0	3	343.265	3.184	20	30		EGEDHN
Cc1ccc(C)c(C(=O)NCC[C@H](C)NCc2ccccc2C#N)c1	ZINC001503594366	1396259587	/nfs/dbraw/zinc/25/95/87/1396259587.db2.gz	GXOOCFLLLFSYFN-KRWDZBQOSA-N	0	3	335.451	3.473	20	30		EGEDHN
C[C@@H](CCNC(=O)[C@H]1[C@@H]2CCCC[C@@H]21)NCc1cc(C#N)ccc1F	ZINC001492000593	1396302191	/nfs/dbraw/zinc/30/21/91/1396302191.db2.gz	IQPLNRRAWIZBPZ-CKNFYHOISA-N	0	3	343.446	3.118	20	30		EGEDHN
C[C@@H](CCNC(=O)[C@H]1CCCC(F)(F)C1)NCc1ccccc1C#N	ZINC001492082971	1396303139	/nfs/dbraw/zinc/30/31/39/1396303139.db2.gz	HNRFYBGMCXFYCU-GJZGRUSLSA-N	0	3	349.425	3.368	20	30		EGEDHN
CCN(CCNC(=O)C1CCC2(CC2)CC1)Cc1ccc(C#N)cc1	ZINC001492993239	1396330911	/nfs/dbraw/zinc/33/09/11/1396330911.db2.gz	QZEZTPKKFRVOKJ-UHFFFAOYSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2ncccc2F)CCCC[C@H]1C	ZINC001495325059	1396532999	/nfs/dbraw/zinc/53/29/99/1396532999.db2.gz	LDZQONURXLKHOL-PXAZEXFGSA-N	0	3	339.842	3.242	20	30		EGEDHN
C[C@@H](C#N)C(=O)N(C)C1CCN(Cc2cc3ccccc3o2)CC1	ZINC001690018371	1404259000	/nfs/dbraw/zinc/25/90/00/1404259000.db2.gz	CPNWYRDCFXIXMJ-AWEZNQCLSA-N	0	3	325.412	3.015	20	30		EGEDHN
CC[C@@H](c1ccc(F)cc1)N1CCC(N(C)C(=O)[C@@H](C)C#N)CC1	ZINC001690018882	1404259451	/nfs/dbraw/zinc/25/94/51/1404259451.db2.gz	VFKBJZMSQWEMCB-KSSFIOAISA-N	0	3	331.435	3.359	20	30		EGEDHN
CCCC1(C(=O)NC[C@H](NCc2cc(C#N)ccc2F)C2CC2)CC1	ZINC001690166750	1404365264	/nfs/dbraw/zinc/36/52/64/1404365264.db2.gz	KVMADMDBOOGKBX-SFHVURJKSA-N	0	3	343.446	3.262	20	30		EGEDHN
CCC1(C(=O)N[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)CCC1	ZINC001690286203	1404447958	/nfs/dbraw/zinc/44/79/58/1404447958.db2.gz	LVZPHYLLRYHPJY-WKILWMFISA-N	0	3	329.419	3.014	20	30		EGEDHN
Cc1ccc(C)c(C(=O)NC[C@H](C)NCc2ccc(F)c(C#N)c2)c1	ZINC001690641608	1404673640	/nfs/dbraw/zinc/67/36/40/1404673640.db2.gz	NOLSFDSJEHZTRY-HNNXBMFYSA-N	0	3	339.414	3.222	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1cc2c(cccc2OC)[nH]1	ZINC001690880008	1404794066	/nfs/dbraw/zinc/79/40/66/1404794066.db2.gz	YAXPGSROLCVGPA-GFCCVEGCSA-N	0	3	335.835	3.027	20	30		EGEDHN
CCN(CCNC(=O)c1cc(C)sc1C)Cc1ccc(C#N)cc1	ZINC001691029997	1404939739	/nfs/dbraw/zinc/93/97/39/1404939739.db2.gz	ZZZBMQYNGRSSFN-UHFFFAOYSA-N	0	3	341.480	3.489	20	30		EGEDHN
CCCC(C)(C)C(=O)N(C)[C@@H](C)CNCc1cc(C#N)ccc1OC	ZINC001732436061	1428579927	/nfs/dbraw/zinc/57/99/27/1428579927.db2.gz	GEDCHPKZJIOXQX-HNNXBMFYSA-N	0	3	345.487	3.330	20	30		EGEDHN
C=C(Br)CNC[C@@H]1[C@@H](C)CCCN1C(=O)CCCC	ZINC001732535433	1428655863	/nfs/dbraw/zinc/65/58/63/1428655863.db2.gz	XODSIMWMYZMIKS-GXTWGEPZSA-N	0	3	331.298	3.302	20	30		EGEDHN
CC(C)CCC(=O)N[C@@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001699568496	1412924770	/nfs/dbraw/zinc/92/47/70/1412924770.db2.gz	CICDMVLEZYNFOD-SFHVURJKSA-N	0	3	331.435	3.118	20	30		EGEDHN
CCCOc1cccc(CN2CCC(C)(NC(=O)[C@@H](C)C#N)CC2)c1	ZINC001699772080	1413179569	/nfs/dbraw/zinc/17/95/69/1413179569.db2.gz	XKERAZONYNMYHH-INIZCTEOSA-N	0	3	343.471	3.106	20	30		EGEDHN
CC(C)[C@H](CNC(=O)C1=CCCC1)NCc1cc(C#N)ccc1F	ZINC001732559146	1428747710	/nfs/dbraw/zinc/74/77/10/1428747710.db2.gz	UAVRMIPADMTIPK-SFHVURJKSA-N	0	3	329.419	3.038	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1ccc(Cl)cc1OC)C(C)C	ZINC001732564021	1428755002	/nfs/dbraw/zinc/75/50/02/1428755002.db2.gz	DAILUDNEHVOFJD-CQSZACIVSA-N	0	3	345.270	3.445	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)CCc2ccncc2)CC1	ZINC001700340681	1413819848	/nfs/dbraw/zinc/81/98/48/1413819848.db2.gz	GBSITJSQBGIJDF-UHFFFAOYSA-N	0	3	349.906	3.327	20	30		EGEDHN
CCCCC(=O)N1CCCC[C@H]1CNCc1cc(C#N)ccc1OC	ZINC001700343561	1413830470	/nfs/dbraw/zinc/83/04/70/1413830470.db2.gz	IMPIPBICINAIQI-SFHVURJKSA-N	0	3	343.471	3.228	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)COc1ccc(Cl)cc1)C(C)C	ZINC001732571305	1428766468	/nfs/dbraw/zinc/76/64/68/1428766468.db2.gz	BJLNYDCDIITDBP-HNNXBMFYSA-N	0	3	345.270	3.202	20	30		EGEDHN
C=C(Br)CNCC(C)(C)CN(C)C(=O)C(CC)CC	ZINC001700456420	1414047403	/nfs/dbraw/zinc/04/74/03/1414047403.db2.gz	LNAQMORBBOWJPP-UHFFFAOYSA-N	0	3	333.314	3.405	20	30		EGEDHN
C[C@@H](CN(C)C(=O)CCC1(C)CC1)NCc1ccc(F)c(C#N)c1	ZINC001700774468	1414453120	/nfs/dbraw/zinc/45/31/20/1414453120.db2.gz	WVUNQEACGMZVIF-AWEZNQCLSA-N	0	3	331.435	3.214	20	30		EGEDHN
C[C@H]1C[C@H](NCc2ccc(C#N)s2)CN1C(=O)CCCC1CC1	ZINC001700843133	1414492673	/nfs/dbraw/zinc/49/26/73/1414492673.db2.gz	SZTYAFBMCGTJRY-ZFWWWQNUSA-N	0	3	331.485	3.279	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)NC(=O)Cc1ccc(Cl)cc1	ZINC001732981504	1429108916	/nfs/dbraw/zinc/10/89/16/1429108916.db2.gz	YQMQUGXOAMTCTG-GFCCVEGCSA-N	0	3	347.871	3.110	20	30		EGEDHN
C=C(Cn1c(C)nnc1N1C[C@@H](C)N(CC)C[C@H]1C)c1ccccc1	ZINC001705742080	1417133461	/nfs/dbraw/zinc/13/34/61/1417133461.db2.gz	JDWJADBQTLHBBB-IAGOWNOFSA-N	0	3	339.487	3.219	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1cncc(CC)c1	ZINC001707447750	1417351320	/nfs/dbraw/zinc/35/13/20/1417351320.db2.gz	YEJSFVZZAHZAGN-WMLDXEAASA-N	0	3	335.879	3.369	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1cc(Cl)no1	ZINC001713002280	1417556375	/nfs/dbraw/zinc/55/63/75/1417556375.db2.gz	JFJRCUPEMICOND-WDEREUQCSA-N	0	3	332.231	3.053	20	30		EGEDHN
N#Cc1ccc(CN[C@@H](CNC(=O)CCC2CCC2)C2CC2)c(F)c1	ZINC001713106800	1417667053	/nfs/dbraw/zinc/66/70/53/1417667053.db2.gz	HMELLRWFTWTSBR-IBGZPJMESA-N	0	3	343.446	3.262	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CCC[C@H](NC(=O)CC(F)(F)F)C1	ZINC001713369635	1417981770	/nfs/dbraw/zinc/98/17/70/1417981770.db2.gz	UJVYPXVZJNLVFT-CABCVRRESA-N	0	3	339.361	3.028	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)c1ccc(C)s1	ZINC001713401274	1418023028	/nfs/dbraw/zinc/02/30/28/1418023028.db2.gz	PNJHDVRIZWGJQA-SNVBAGLBSA-N	0	3	331.279	3.063	20	30		EGEDHN
CCN(CCNC(=O)[C@@H]1CC12CCCC2)Cc1ccc(C#N)cc1	ZINC001713496154	1418205159	/nfs/dbraw/zinc/20/51/59/1418205159.db2.gz	KUJAINJNNMNSRC-SFHVURJKSA-N	0	3	325.456	3.077	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](NC(=O)C2CCCCC2)C2CC2)c(F)c1	ZINC001733162615	1429265033	/nfs/dbraw/zinc/26/50/33/1429265033.db2.gz	IQBVOWRLMDYAKQ-IBGZPJMESA-N	0	3	343.446	3.262	20	30		EGEDHN
CCCCCCCN1CCC[C@@H](NC(=O)c2n[nH]c3c2CCCC3)C1	ZINC001713786578	1418603626	/nfs/dbraw/zinc/60/36/26/1418603626.db2.gz	PIZDDEJREOIIAA-MRXNPFEDSA-N	0	3	346.519	3.453	20	30		EGEDHN
C#CCCN1CCC[C@H](NC(=O)CCc2ccc(C(C)C)cc2)C1	ZINC001713790365	1418607969	/nfs/dbraw/zinc/60/79/69/1418607969.db2.gz	CQDBAYRHTNCLSA-FQEVSTJZSA-N	0	3	326.484	3.347	20	30		EGEDHN
CC1(CCC(=O)NC[C@H]2CCCN(Cc3cccc(C#N)c3)C2)CC1	ZINC001714050624	1418849686	/nfs/dbraw/zinc/84/96/86/1418849686.db2.gz	ZQUKJXWTHCPOGJ-LJQANCHMSA-N	0	3	339.483	3.467	20	30		EGEDHN
C[C@H](CNC(=O)[C@@H](C)Cc1ccccc1)NCc1ccc(C#N)s1	ZINC001714303734	1419083890	/nfs/dbraw/zinc/08/38/90/1419083890.db2.gz	HOBLTOICHMMAIL-LSDHHAIUSA-N	0	3	341.480	3.093	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC[C@@H]1CNCC#Cc1ccccc1Cl	ZINC001714332290	1419112743	/nfs/dbraw/zinc/11/27/43/1419112743.db2.gz	PTRGVHBCPZVBQY-DOTOQJQBSA-N	0	3	332.875	3.318	20	30		EGEDHN
Cc1csc(C(=O)NC[C@@H](C)CNCc2ccccc2C#N)c1	ZINC001714389287	1419138134	/nfs/dbraw/zinc/13/81/34/1419138134.db2.gz	UYTOGTIZSNQEFS-AWEZNQCLSA-N	0	3	327.453	3.084	20	30		EGEDHN
CC(F)(F)CC(=O)N[C@@H]1CCC[C@H](NCc2ccccc2C#N)C1	ZINC001714410016	1419149494	/nfs/dbraw/zinc/14/94/94/1419149494.db2.gz	CNCSVVBWUGJXFY-JKSUJKDBSA-N	0	3	335.398	3.121	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1cc(Cl)cc(OC)c1	ZINC001714494063	1419218017	/nfs/dbraw/zinc/21/80/17/1419218017.db2.gz	OSNDVMRNAAWYTA-NSHDSACASA-N	0	3	331.243	3.199	20	30		EGEDHN
Cc1cccc(Cl)c1CNC[C@H](C)N(C)C(=O)c1cc(C#N)c[nH]1	ZINC001714575763	1419311614	/nfs/dbraw/zinc/31/16/14/1419311614.db2.gz	LTGQSSUWCWIKPN-ZDUSSCGKSA-N	0	3	344.846	3.099	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H]2OCCc3ccccc32)CCCC1	ZINC001715301406	1420009244	/nfs/dbraw/zinc/00/92/44/1420009244.db2.gz	ODJMUQLPSWZLCR-KRWDZBQOSA-N	0	3	348.874	3.072	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cc2ccsc2[nH]1)C(C)C	ZINC001715624852	1420270197	/nfs/dbraw/zinc/27/01/97/1420270197.db2.gz	RRIWJISKLIZSBM-CYBMUJFWSA-N	0	3	325.865	3.326	20	30		EGEDHN
C[C@@H](C(=O)N[C@@H](C)CNCc1ccc(C#N)s1)c1ccccc1	ZINC001716460555	1420673740	/nfs/dbraw/zinc/67/37/40/1420673740.db2.gz	VDCJPWALNAECJS-UONOGXRCSA-N	0	3	327.453	3.018	20	30		EGEDHN
CCCC[C@@](C)(F)C(=O)NCC1(NCc2ccc(F)c(C#N)c2)CC1	ZINC001716685782	1420838880	/nfs/dbraw/zinc/83/88/80/1420838880.db2.gz	MUWNOMULTZCIIC-GOSISDBHSA-N	0	3	349.425	3.354	20	30		EGEDHN
CCCCC(=O)N1CCC[C@@H]1CN(C)Cc1ccc(OC)c(C#N)c1	ZINC001717363348	1421298014	/nfs/dbraw/zinc/29/80/14/1421298014.db2.gz	HPWSBLKPLIJLEE-GOSISDBHSA-N	0	3	343.471	3.180	20	30		EGEDHN
CC(C)SCC(=O)N1CC[C@@H]([C@@H](C)NCc2ccccc2C#N)C1	ZINC001733523306	1429731530	/nfs/dbraw/zinc/73/15/30/1429731530.db2.gz	BASJTOVNKMNVIJ-CRAIPNDOSA-N	0	3	345.512	3.026	20	30		EGEDHN
CCCC1(C(=O)N2CC[C@@H]([C@H](C)NCc3ccccc3C#N)C2)CC1	ZINC001733539860	1429745692	/nfs/dbraw/zinc/74/56/92/1429745692.db2.gz	RZHUMGZSPWEOCG-QFBILLFUSA-N	0	3	339.483	3.465	20	30		EGEDHN
Cc1cc(C)c(C(=O)NC[C@H](C)N(C)Cc2ccc(C#N)cc2)o1	ZINC001725166646	1425671729	/nfs/dbraw/zinc/67/17/29/1425671729.db2.gz	ZETQPZPEGGUTJN-AWEZNQCLSA-N	0	3	325.412	3.018	20	30		EGEDHN
CCc1ccc(C(=O)NC[C@H](C)N(C)Cc2ccc(C#N)cc2)s1	ZINC001725173403	1425685288	/nfs/dbraw/zinc/68/52/88/1425685288.db2.gz	PHZTYAZSHOAZRB-AWEZNQCLSA-N	0	3	341.480	3.432	20	30		EGEDHN
Cc1ccsc1C(=O)N(C)C[C@H](C)NCc1ccc(F)c(C#N)c1	ZINC001725471188	1426142239	/nfs/dbraw/zinc/14/22/39/1426142239.db2.gz	IIRIDULAYOEANB-ZDUSSCGKSA-N	0	3	345.443	3.318	20	30		EGEDHN
Cc1cc(F)ccc1C(=O)N(C)C[C@@H](C)NCc1ccc(C#N)s1	ZINC001725514360	1426204234	/nfs/dbraw/zinc/20/42/34/1426204234.db2.gz	IYJLXIJPXANJQW-CYBMUJFWSA-N	0	3	345.443	3.318	20	30		EGEDHN
CC(C)(C(=O)N[C@H]1CC[C@H](CNCc2ccccc2C#N)C1)C(F)F	ZINC001725660303	1426342882	/nfs/dbraw/zinc/34/28/82/1426342882.db2.gz	KSSOEOCFYFASJL-BBRMVZONSA-N	0	3	349.425	3.224	20	30		EGEDHN
CC(C)(C)[C@H](CNCc1ccc(C#N)s1)NC(=O)Cc1ccco1	ZINC001725756277	1426435725	/nfs/dbraw/zinc/43/57/25/1426435725.db2.gz	NIPJVSREEDDGIV-INIZCTEOSA-N	0	3	345.468	3.076	20	30		EGEDHN
CCC(CC)C(=O)NC[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001731496438	1427473219	/nfs/dbraw/zinc/47/32/19/1427473219.db2.gz	YGDMKQOCGWREBD-GOSISDBHSA-N	0	3	327.472	3.323	20	30		EGEDHN
Cc1nc(C(C)C)ccc1CN[C@H]1CCN(C(=O)C#CC(C)(C)C)C1	ZINC001731646227	1427703457	/nfs/dbraw/zinc/70/34/57/1427703457.db2.gz	YUXDXWLFDCIJOM-SFHVURJKSA-N	0	3	341.499	3.253	20	30		EGEDHN
CCCN(CCNC(=O)[C@@H](F)C(C)C)Cc1ccc(F)c(C#N)c1	ZINC001731868641	1428120925	/nfs/dbraw/zinc/12/09/25/1428120925.db2.gz	KNYRGIDQEYYCHP-KRWDZBQOSA-N	0	3	337.414	3.020	20	30		EGEDHN
Cc1sccc1C(=O)NCC1(NCc2ccc(C#N)s2)CCC1	ZINC001733716195	1429935214	/nfs/dbraw/zinc/93/52/14/1429935214.db2.gz	DUEZOPIYYLLREP-UHFFFAOYSA-N	0	3	345.493	3.432	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1cc(Cl)cn1C	ZINC001734020152	1437809236	/nfs/dbraw/zinc/80/92/36/1437809236.db2.gz	OAMQYMPCRJYUBU-UHFFFAOYSA-N	0	3	332.275	3.119	20	30		EGEDHN
C=C(Br)CNC[C@H](NC(=O)c1occc1C)C(C)(C)C	ZINC001734557166	1438155839	/nfs/dbraw/zinc/15/58/39/1438155839.db2.gz	FWQXNUJFFMOUJW-LBPRGKRZSA-N	0	3	343.265	3.231	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)CCc1ccccn1	ZINC001752146249	1440145981	/nfs/dbraw/zinc/14/59/81/1440145981.db2.gz	ZFZIMGKWGZERAV-DOTOQJQBSA-N	0	3	335.879	3.126	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1c(C)nsc1C	ZINC001752156805	1440147358	/nfs/dbraw/zinc/14/73/58/1440147358.db2.gz	MESNISOTYZLBLW-RISCZKNCSA-N	0	3	341.908	3.485	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1cccc2nc[nH]c21	ZINC001752156520	1440147398	/nfs/dbraw/zinc/14/73/98/1440147398.db2.gz	HLECUACPRJDFHU-CJNGLKHVSA-N	0	3	346.862	3.288	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N(C)C1CCN(CCc2ccns2)CC1	ZINC001752307688	1440168724	/nfs/dbraw/zinc/16/87/24/1440168724.db2.gz	DBEFRCCFZKQYQC-HNNXBMFYSA-N	0	3	335.517	3.211	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CC12CCN(Cc1ccccn1)CC2	ZINC001752428533	1440177736	/nfs/dbraw/zinc/17/77/36/1440177736.db2.gz	ZXAVOMOBGJJKHF-QGZVFWFLSA-N	0	3	327.472	3.155	20	30		EGEDHN
Cc1cccc(Cl)c1CN[C@@H](CNC(=O)C#CC1CC1)C1CC1	ZINC001752465493	1440183968	/nfs/dbraw/zinc/18/39/68/1440183968.db2.gz	YIICEVBXKNPNMM-SFHVURJKSA-N	0	3	330.859	3.046	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC[C@@H](CN(C)CC#Cc2ccccc2)C1	ZINC001752498313	1440187849	/nfs/dbraw/zinc/18/78/49/1440187849.db2.gz	XYWNXGUYUBTFNY-ICSRJNTNSA-N	0	3	326.484	3.255	20	30		EGEDHN
C=CCCCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CCCOCC1	ZINC001752532325	1440193994	/nfs/dbraw/zinc/19/39/94/1440193994.db2.gz	IQAQNDCXNSMFMQ-QRVBRYPASA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCCCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)CCc1ccon1	ZINC001752538958	1440194376	/nfs/dbraw/zinc/19/43/76/1440194376.db2.gz	VJENPZFETQRRML-HDICACEKSA-N	0	3	331.460	3.029	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)CCCc2ccsc2)C1	ZINC001752704978	1440202286	/nfs/dbraw/zinc/20/22/86/1440202286.db2.gz	IKXWCNDUHHBNFO-RBUKOAKNSA-N	0	3	344.524	3.407	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N[C@H]1C[C@@H](N[C@H](C)c2ccccc2F)C1	ZINC001752714280	1440203608	/nfs/dbraw/zinc/20/36/08/1440203608.db2.gz	GRRUQGGAOMLKJQ-FPCVCCKLSA-N	0	3	334.435	3.105	20	30		EGEDHN
C=C[C@@H](CC(=O)N[C@H]1C[C@@H](NCc2conc2C)C1)c1ccccc1	ZINC001752774375	1440206561	/nfs/dbraw/zinc/20/65/61/1440206561.db2.gz	VKZNJJXSFUWGLC-ZYSHUDEJSA-N	0	3	339.439	3.080	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@@H](NCc3c(C)noc3C)C2)CCCC1	ZINC001752776095	1440206878	/nfs/dbraw/zinc/20/68/78/1440206878.db2.gz	HPIHQBONXQXPPB-IYBDPMFKSA-N	0	3	331.460	3.165	20	30		EGEDHN
CC(C)SCC(=O)NC[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001752776863	1440206923	/nfs/dbraw/zinc/20/69/23/1440206923.db2.gz	FKNDINOAYARFOF-GOSISDBHSA-N	0	3	345.512	3.028	20	30		EGEDHN
CC(C)SCC(=O)NC[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001752776864	1440206993	/nfs/dbraw/zinc/20/69/93/1440206993.db2.gz	FKNDINOAYARFOF-SFHVURJKSA-N	0	3	345.512	3.028	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H]1CCCN(Cc2cnccc2C)C1	ZINC001752784993	1440210975	/nfs/dbraw/zinc/21/09/75/1440210975.db2.gz	NOFIJWZGPHTLMW-KRWDZBQOSA-N	0	3	329.488	3.321	20	30		EGEDHN
C#CCN1CCC[C@@H](CNC(=O)[C@H](CC)Cc2cccc(C)c2)C1	ZINC001752787079	1440211813	/nfs/dbraw/zinc/21/18/13/1440211813.db2.gz	FZDNEMZELDXUAJ-VQTJNVASSA-N	0	3	326.484	3.025	20	30		EGEDHN
C#CCCCC(=O)N[C@@H](C)[C@H]1CCCN(Cc2ccccc2F)C1	ZINC001752838751	1440229101	/nfs/dbraw/zinc/22/91/01/1440229101.db2.gz	WMRKKLJYHKVELY-IRXDYDNUSA-N	0	3	330.447	3.346	20	30		EGEDHN
C[C@@H](CNC(=O)C(C)(C)c1ccccc1)NCc1ccc(C#N)s1	ZINC001752918598	1440247837	/nfs/dbraw/zinc/24/78/37/1440247837.db2.gz	KGGDQVNWZUXTQM-AWEZNQCLSA-N	0	3	341.480	3.192	20	30		EGEDHN
CCCC[C@@](C)(F)C(=O)N1CC[C@@H](CNCc2ccccc2C#N)C1	ZINC001752943308	1440251082	/nfs/dbraw/zinc/25/10/82/1440251082.db2.gz	KRWXUFGLEZBTEF-OXJNMPFZSA-N	0	3	345.462	3.415	20	30		EGEDHN
CC#CCN(C)[C@@H]1CCCN(C(=O)C[C@@H](C)c2cccc(OC)c2)C1	ZINC001752999811	1440263905	/nfs/dbraw/zinc/26/39/05/1440263905.db2.gz	ICKVBFDSEQDQRS-IEBWSBKVSA-N	0	3	342.483	3.135	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1c(F)c(F)cc(F)c1F	ZINC001753006113	1440265790	/nfs/dbraw/zinc/26/57/90/1440265790.db2.gz	AQOPMMUKNZJSCK-MRVPVSSYSA-N	0	3	338.732	3.094	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H]2CCCNC(=O)C2CCC2)c(F)c1	ZINC001753021839	1440270244	/nfs/dbraw/zinc/27/02/44/1440270244.db2.gz	GKPQZVIRZCIPHM-SFHVURJKSA-N	0	3	343.446	3.358	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCN(C)[C@@H](C)c2cccc(Cl)c2)nc1	ZINC001753071497	1440288538	/nfs/dbraw/zinc/28/85/38/1440288538.db2.gz	PWEZTTDROFGGGI-AWEZNQCLSA-N	0	3	341.842	3.139	20	30		EGEDHN
CCN(CCNC(=O)Cc1cc(C)ccc1C)Cc1cccc(C#N)c1	ZINC001753087098	1440296766	/nfs/dbraw/zinc/29/67/66/1440296766.db2.gz	SQTMLAMCELOLEB-UHFFFAOYSA-N	0	3	349.478	3.356	20	30		EGEDHN
Cc1cc(CN2CCC[C@H]2CNC(=O)C#CC(C)(C)C)c(C)s1	ZINC001753103119	1440304952	/nfs/dbraw/zinc/30/49/52/1440304952.db2.gz	PJWGCSDXLMTUHX-KRWDZBQOSA-N	0	3	332.513	3.495	20	30		EGEDHN
C=CCOCCN1CCC[C@@H]1CNC(=O)c1cscc1C(F)F	ZINC001753103217	1440305305	/nfs/dbraw/zinc/30/53/05/1440305305.db2.gz	QVTCNZVNPIMOCS-GFCCVEGCSA-N	0	3	344.427	3.083	20	30		EGEDHN
CCCN(CCNC(=O)C#CC(C)(C)C)Cc1ccccc1N(C)C	ZINC001753143443	1440322865	/nfs/dbraw/zinc/32/28/65/1440322865.db2.gz	SESZYYQZKHSGRX-UHFFFAOYSA-N	0	3	343.515	3.130	20	30		EGEDHN
CN(CCNCc1ccc(C#N)c(F)c1)C(=O)CC1CCCCC1	ZINC001753167986	1440336209	/nfs/dbraw/zinc/33/62/09/1440336209.db2.gz	ICKAIHQNQBFABY-UHFFFAOYSA-N	0	3	331.435	3.216	20	30		EGEDHN
CN(CCNCc1ccc(C#N)c(F)c1)C(=O)C1=CCCCCC1	ZINC001753183459	1440337052	/nfs/dbraw/zinc/33/70/52/1440337052.db2.gz	LQXQNLMKUGXFEP-UHFFFAOYSA-N	0	3	329.419	3.136	20	30		EGEDHN
CC[C@@H]1CCCC[C@@H]1C(=O)N(C)CCNCc1ccc(C#N)cc1	ZINC001753248667	1440342747	/nfs/dbraw/zinc/34/27/47/1440342747.db2.gz	VLZOLNTWLHLCRR-MOPGFXCFSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C(C)CN[C@H](CNC(=O)c1cncnc1)c1ccc(C(C)C)cc1	ZINC001753294665	1440351845	/nfs/dbraw/zinc/35/18/45/1440351845.db2.gz	SDASSRCFRQEEEJ-LJQANCHMSA-N	0	3	338.455	3.237	20	30		EGEDHN
C#CCCN[C@H](CNC(=O)c1ccc2cc[nH]c2c1)c1ccccc1	ZINC001753311282	1440356615	/nfs/dbraw/zinc/35/66/15/1440356615.db2.gz	LDCRYAZQSJOKBM-HXUWFJFHSA-N	0	3	331.419	3.252	20	30		EGEDHN
CCCN(C(=O)C#CC1CC1)[C@H]1CCN(Cc2ccc(CC)cc2)C1	ZINC001753316386	1440359748	/nfs/dbraw/zinc/35/97/48/1440359748.db2.gz	QSGIDHYZIKYLRU-NRFANRHFSA-N	0	3	338.495	3.475	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CCC)C(=O)C[C@@H]2CCC(C)(C)CO2)C1	ZINC001753318192	1440360953	/nfs/dbraw/zinc/36/09/53/1440360953.db2.gz	FHSGDOYNLAIYFS-MSOLQXFVSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCOCCN1CC[C@@H](N(CCC)C(=O)[C@H]2CCCC2(C)C)C1	ZINC001753318279	1440361068	/nfs/dbraw/zinc/36/10/68/1440361068.db2.gz	GSJAJMOOQJPHQM-QZTJIDSGSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CCC)C(=O)C[C@@H](C)n2nc(C)cc2C)C1	ZINC001753321759	1440363926	/nfs/dbraw/zinc/36/39/26/1440363926.db2.gz	DLOVBLXLRUSHGI-RTBURBONSA-N	0	3	346.519	3.340	20	30		EGEDHN
CC(C(=O)NCC[C@H]1CCN(Cc2ccc(C#N)s2)C1)=C1CCC1	ZINC001753328284	1440367800	/nfs/dbraw/zinc/36/78/00/1440367800.db2.gz	PLUILUAGZGETNF-HNNXBMFYSA-N	0	3	343.496	3.448	20	30		EGEDHN
C#CCCN1CC[C@H](N(CCC)C(=O)[C@@H](C)Cc2ccccc2F)C1	ZINC001753329220	1440368263	/nfs/dbraw/zinc/36/82/63/1440368263.db2.gz	XHRKGNDEHLZYIB-HKUYNNGSSA-N	0	3	344.474	3.341	20	30		EGEDHN
CC(C)C#CC(=O)NCC1CN(C2c3ccccc3-c3ccccc32)C1	ZINC001753401846	1440391229	/nfs/dbraw/zinc/39/12/29/1440391229.db2.gz	SWPYTFLHQFYBBZ-UHFFFAOYSA-N	0	3	344.458	3.464	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NCC1CN(Cc2ccc(C)cc2C)C1	ZINC001753407382	1440392419	/nfs/dbraw/zinc/39/24/19/1440392419.db2.gz	HJXDUHPEBKQLJR-NRFANRHFSA-N	0	3	344.499	3.080	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H]2C[C@H]1CN2C(=O)c1ncccc1OCCC	ZINC001753424132	1440396224	/nfs/dbraw/zinc/39/62/24/1440396224.db2.gz	MDSJRFRRLDVLRF-IKGGRYGDSA-N	0	3	343.471	3.124	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H]2C[C@H]1CN2C(=O)COc1ccc(C)cc1C	ZINC001753427820	1440397506	/nfs/dbraw/zinc/39/75/06/1440397506.db2.gz	OWQQPFVYMCVXBP-FHWLQOOXSA-N	0	3	342.483	3.322	20	30		EGEDHN
C=CCC1(C(=O)N(C)[C@H]2CCN(CCOCC(C)C)C2)CCCC1	ZINC001753449853	1440405446	/nfs/dbraw/zinc/40/54/46/1440405446.db2.gz	KHOSZRPHDXLFIQ-SFHVURJKSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCCC(=O)NC[C@@H](CC)NCc1cc(Cl)cc2c1OCC2	ZINC001753466881	1440412983	/nfs/dbraw/zinc/41/29/83/1440412983.db2.gz	MLSGLRDSAMXSFE-MRXNPFEDSA-N	0	3	336.863	3.226	20	30		EGEDHN
CC[C@H](CNC(=O)c1cscc1C)NCc1ccc(C#N)c(F)c1	ZINC001753469813	1440413735	/nfs/dbraw/zinc/41/37/35/1440413735.db2.gz	HABAOFKNGCVDNT-OAHLLOKOSA-N	0	3	345.443	3.366	20	30		EGEDHN
CC[C@H](CNC(=O)c1c[nH]c(C#N)c1)N[C@H](C)c1ccccc1Cl	ZINC001753473818	1440414698	/nfs/dbraw/zinc/41/46/98/1440414698.db2.gz	VRNYDVZRSWZSHU-TZMCWYRMSA-N	0	3	344.846	3.399	20	30		EGEDHN
CC[C@@H](CNC(=O)[C@H](C)C(C)(C)C)NCC#Cc1ccc(F)cc1	ZINC001753478793	1440415952	/nfs/dbraw/zinc/41/59/52/1440415952.db2.gz	MNKUMXXUHUTJPN-YJBOKZPZSA-N	0	3	332.463	3.344	20	30		EGEDHN
CC[C@H](CNC(=O)[C@H]1C[C@H]2C[C@H]2C1)NCC#Cc1ccccc1Cl	ZINC001753483416	1440417220	/nfs/dbraw/zinc/41/72/20/1440417220.db2.gz	KDOLQXSFDBPVEQ-VSZNYVQBSA-N	0	3	344.886	3.222	20	30		EGEDHN
CC[C@H](CNC(=O)[C@@H]1C[C@H]1CC)NCC#Cc1ccc(Cl)cc1	ZINC001753486189	1440417789	/nfs/dbraw/zinc/41/77/89/1440417789.db2.gz	KXUVDDYPCVASHH-KBAYOESNSA-N	0	3	332.875	3.222	20	30		EGEDHN
C=CCC1(C(=O)NC[C@H](CC)NCc2c(C)nsc2C)CCC1	ZINC001753490006	1440419219	/nfs/dbraw/zinc/41/92/19/1440419219.db2.gz	OBFQFZNYVMRRET-HNNXBMFYSA-N	0	3	335.517	3.491	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@](C)(CNCc1cccc(C(C)C)n1)C1CC1	ZINC001753516914	1440427612	/nfs/dbraw/zinc/42/76/12/1440427612.db2.gz	UAXZSMQYFVRINE-NRFANRHFSA-N	0	3	341.499	3.239	20	30		EGEDHN
C=C(C)CCC(=O)N[C@]1(CNCc2conc2C)CCCC[C@H]1C	ZINC001753534070	1440431929	/nfs/dbraw/zinc/43/19/29/1440431929.db2.gz	PFUNSHZNTLZERK-BEFAXECRSA-N	0	3	333.476	3.494	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@H](CCNCc2ccc(C#N)cc2F)C1	ZINC001753538415	1440433122	/nfs/dbraw/zinc/43/31/22/1440433122.db2.gz	CLKDKFFPRALGRT-MRXNPFEDSA-N	0	3	345.462	3.462	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCCN(C(=O)c2cnc(C3CC3)o2)C1	ZINC001753547232	1440434437	/nfs/dbraw/zinc/43/44/37/1440434437.db2.gz	ALJONTWQONUJIV-CYBMUJFWSA-N	0	3	337.851	3.136	20	30		EGEDHN
C#CCCCC(=O)N1CCC(CCNC/C(Cl)=C\Cl)CC1	ZINC001753569714	1440438231	/nfs/dbraw/zinc/43/82/31/1440438231.db2.gz	ZFJNQYUXDJNBHM-NTCAYCPXSA-N	0	3	331.287	3.327	20	30		EGEDHN
CCCC(=O)NCc1ccc(CNCc2ccc(C#N)c(F)c2)cc1	ZINC001753588209	1440442064	/nfs/dbraw/zinc/44/20/64/1440442064.db2.gz	DXWMSDRZSNDQOC-UHFFFAOYSA-N	0	3	339.414	3.403	20	30		EGEDHN
C#CCNCc1ccc(CNC(=O)c2cc(F)cc3ccncc32)cc1	ZINC001753590168	1440442573	/nfs/dbraw/zinc/44/25/73/1440442573.db2.gz	CDXSVCNFKOQWNV-UHFFFAOYSA-N	0	3	347.393	3.027	20	30		EGEDHN
C=CCCCC(=O)NCCC1CCN([C@@H](C)c2cnccn2)CC1	ZINC001753596840	1440445013	/nfs/dbraw/zinc/44/50/13/1440445013.db2.gz	IRYJSLNNMRCFFG-INIZCTEOSA-N	0	3	330.476	3.112	20	30		EGEDHN
Cc1ccsc1C(=O)NC[C@H](C)CNCc1cc(F)ccc1C#N	ZINC001753615960	1440449713	/nfs/dbraw/zinc/44/97/13/1440449713.db2.gz	YKPLIWILABROGT-GFCCVEGCSA-N	0	3	345.443	3.223	20	30		EGEDHN
C=CCC1(C(=O)NC[C@H](C)CNCc2nccnc2C)CCCCC1	ZINC001753644655	1440455297	/nfs/dbraw/zinc/45/52/97/1440455297.db2.gz	KKEORTKUIWNROU-MRXNPFEDSA-N	0	3	344.503	3.154	20	30		EGEDHN
CCC(C)(C)CC(=O)N(C)[C@H](C)CNCc1cc(C#N)ccc1OC	ZINC001753694010	1440467066	/nfs/dbraw/zinc/46/70/66/1440467066.db2.gz	UYPJKVPTRWMZJG-OAHLLOKOSA-N	0	3	345.487	3.330	20	30		EGEDHN
CCC(C)(C)CC(=O)N(C)[C@@H](C)CNCc1cc(C#N)ccc1OC	ZINC001753694009	1440467166	/nfs/dbraw/zinc/46/71/66/1440467166.db2.gz	UYPJKVPTRWMZJG-HNNXBMFYSA-N	0	3	345.487	3.330	20	30		EGEDHN
C[C@H](CNCC#Cc1ccccc1)N(C)C(=O)C[C@H]1CCC(F)(F)C1	ZINC001753694717	1440467236	/nfs/dbraw/zinc/46/72/36/1440467236.db2.gz	FGNOEQUHMMSWPB-SJLPKXTDSA-N	0	3	348.437	3.300	20	30		EGEDHN
Cc1ccc([C@H](C)C(=O)N(C)[C@@H](C)CNCc2ccc(C#N)s2)o1	ZINC001753716538	1440472050	/nfs/dbraw/zinc/47/20/50/1440472050.db2.gz	WCHSKCBOPGQHDP-JSGCOSHPSA-N	0	3	345.468	3.261	20	30		EGEDHN
C=C(Cl)CNC[C@@H](CC(C)C)NC(=O)c1ccn2c(C)cnc2c1	ZINC001753734889	1440477366	/nfs/dbraw/zinc/47/73/66/1440477366.db2.gz	KZRHKTKWGAAOPD-MRXNPFEDSA-N	0	3	348.878	3.129	20	30		EGEDHN
N#Cc1ccccc1CNCC[C@H]1CCCCN1C(=O)c1cc[nH]c1	ZINC001753777515	1440486768	/nfs/dbraw/zinc/48/67/68/1440486768.db2.gz	RUEWQKRPYVEVKR-LJQANCHMSA-N	0	3	336.439	3.061	20	30		EGEDHN
C=CCCC(=O)N1CCC(CCN(C)Cc2cccc(OC)n2)CC1	ZINC001753817691	1440494432	/nfs/dbraw/zinc/49/44/32/1440494432.db2.gz	ATMDPFAWXVSAFW-UHFFFAOYSA-N	0	3	345.487	3.117	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)[C@H](C)Oc1cccc(C)c1)C(C)C	ZINC001753843587	1440503596	/nfs/dbraw/zinc/50/35/96/1440503596.db2.gz	SCDOAVTXCLKEMZ-RDJZCZTQSA-N	0	3	338.879	3.245	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)CCN(C)Cc2ccc(C(C)C)cc2)nc1	ZINC001753867158	1440515314	/nfs/dbraw/zinc/51/53/14/1440515314.db2.gz	GOLZKDKDACRBRC-UHFFFAOYSA-N	0	3	349.478	3.390	20	30		EGEDHN
C[C@@H](CCNCc1cc(C#N)ccc1F)NC(=O)C[C@@H]1C[C@H]1C1CC1	ZINC001753985631	1440528494	/nfs/dbraw/zinc/52/84/94/1440528494.db2.gz	YFGCGYOTGGKJAP-OWQGQXMQSA-N	0	3	343.446	3.118	20	30		EGEDHN
C[C@H](CCNCc1ccccc1C#N)NC(=O)[C@H](C)C1CCCC1	ZINC001754011901	1440531368	/nfs/dbraw/zinc/53/13/68/1440531368.db2.gz	FXEYROBXUHJNRO-HZPDHXFCSA-N	0	3	327.472	3.369	20	30		EGEDHN
CCN(CCNCc1ccc(C#N)s1)C(=O)C[C@H]1C=CCCC1	ZINC001754051336	1440535752	/nfs/dbraw/zinc/53/57/52/1440535752.db2.gz	HHEUWPSKTNKVCB-HNNXBMFYSA-N	0	3	331.485	3.304	20	30		EGEDHN
O=C(C#CC1CC1)NC/C=C\CN[C@H]1CCc2c1cccc2Cl	ZINC001754119524	1440542751	/nfs/dbraw/zinc/54/27/51/1440542751.db2.gz	MICXKBPVKPFPPU-LPQSXRFUSA-N	0	3	328.843	3.003	20	30		EGEDHN
CC(C)(CC(=O)NC/C=C/CNCc1ccc(F)c(C#N)c1)C1CC1	ZINC001754131487	1440543664	/nfs/dbraw/zinc/54/36/64/1440543664.db2.gz	JPMUSTBHKQRSBV-ONEGZZNKSA-N	0	3	343.446	3.286	20	30		EGEDHN
C[C@H]1CC(C(=O)NC/C=C/CNCc2ccc(C#N)cc2)C[C@H](C)C1	ZINC001754213960	1440551622	/nfs/dbraw/zinc/55/16/22/1440551622.db2.gz	OUKSKLSBZIAOFC-MULDZMIYSA-N	0	3	339.483	3.393	20	30		EGEDHN
Cc1ccc(F)c(C(=O)N[C@@H](C)CNCc2ccc(C#N)s2)c1F	ZINC001754281569	1440563194	/nfs/dbraw/zinc/56/31/94/1440563194.db2.gz	RSBNYMFMEFHLIN-NSHDSACASA-N	0	3	349.406	3.115	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)CNCC#Cc2ccc(F)cc2)CCC1	ZINC001754282145	1440563399	/nfs/dbraw/zinc/56/33/99/1440563399.db2.gz	OLFUYCVEIWYIBQ-INIZCTEOSA-N	0	3	328.431	3.018	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(C(F)F)cc1)NC(=O)c1ccc(C#N)[nH]1	ZINC001754305360	1440570498	/nfs/dbraw/zinc/57/04/98/1440570498.db2.gz	QTTCNCUZAHNMIG-GFCCVEGCSA-N	0	3	346.381	3.074	20	30		EGEDHN
Cc1cc(F)cc(C(=O)N[C@H](C)CN(C)Cc2cccc(C#N)c2)c1	ZINC001754329558	1440582687	/nfs/dbraw/zinc/58/26/87/1440582687.db2.gz	ZSKYUJUNPYVUPS-OAHLLOKOSA-N	0	3	339.414	3.256	20	30		EGEDHN
C=C(Br)CNCCCN(C)C(=O)CCc1ccsc1	ZINC001754375633	1440592975	/nfs/dbraw/zinc/59/29/75/1440592975.db2.gz	JQEFKCVREMRQHN-UHFFFAOYSA-N	0	3	345.306	3.027	20	30		EGEDHN
CC(C)n1cccc1C(=O)N(C)CCCNCc1ccccc1C#N	ZINC001754412888	1440596554	/nfs/dbraw/zinc/59/65/54/1440596554.db2.gz	BIQBLDIIMXDMJE-UHFFFAOYSA-N	0	3	338.455	3.193	20	30		EGEDHN
C[C@@]1(C(=O)N[C@@H](CNCc2ccc(C#N)c(F)c2)C2CC2)C=CCC1	ZINC001754449737	1440600745	/nfs/dbraw/zinc/60/07/45/1440600745.db2.gz	YCAGMRCTUQMXPL-AZUAARDMSA-N	0	3	341.430	3.038	20	30		EGEDHN
C=CCC[C@@H](C)N1CC[C@@H]1CNC(=O)c1c(F)cc(OC)cc1F	ZINC001754493875	1440610956	/nfs/dbraw/zinc/61/09/56/1440610956.db2.gz	HIIVMLLCCGXNRF-CHWSQXEVSA-N	0	3	338.398	3.132	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)C[C@H](C)c1ccccc1OC	ZINC001754501667	1440614771	/nfs/dbraw/zinc/61/47/71/1440614771.db2.gz	ZTPQDCVRFHQZIR-IRXDYDNUSA-N	0	3	330.472	3.346	20	30		EGEDHN
C#CCCCC(=O)NCC1(NCc2ccc(C(C)C)nc2C)CC1	ZINC001754513387	1440618133	/nfs/dbraw/zinc/61/81/33/1440618133.db2.gz	QUTCALVFIJCYRH-UHFFFAOYSA-N	0	3	327.472	3.055	20	30		EGEDHN
CC[C@@H](C)[C@@H](C)C(=O)NCC1(NCc2ccc(F)c(C#N)c2)CC1	ZINC001754530626	1440622420	/nfs/dbraw/zinc/62/24/20/1440622420.db2.gz	YNRPDPZLNAMNAT-ZIAGYGMSSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=CCOCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccc(F)c1C	ZINC001754543105	1440626514	/nfs/dbraw/zinc/62/65/14/1440626514.db2.gz	QYVXUSKBUZWABJ-SJORKVTESA-N	0	3	346.446	3.016	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)CCCc1cccnc1	ZINC001754543736	1440626625	/nfs/dbraw/zinc/62/66/25/1440626625.db2.gz	NZMXZVPUSZDNCV-MOPGFXCFSA-N	0	3	327.472	3.046	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC1(C)CCN([C@@H]2CCc3ccc(Cl)cc32)CC1	ZINC001754623447	1440645769	/nfs/dbraw/zinc/64/57/69/1440645769.db2.gz	DTCXTKHJNQBNBI-SUMWQHHRSA-N	0	3	345.874	3.458	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)CCOc2ccccc2CC)CC1	ZINC001754630710	1440647767	/nfs/dbraw/zinc/64/77/67/1440647767.db2.gz	MUJWJYUKQLIRIE-UHFFFAOYSA-N	0	3	342.483	3.012	20	30		EGEDHN
C#CCN(C(=O)C[C@H]1CC[C@@H](C)C1)C1CCN(CCOC(C)C)CC1	ZINC001754639772	1440649052	/nfs/dbraw/zinc/64/90/52/1440649052.db2.gz	VZTICUDCMCAXJQ-MOPGFXCFSA-N	0	3	348.531	3.164	20	30		EGEDHN
CCC(=O)N[C@@H](CNCC#Cc1cccc(Cl)c1)C1CCCC1	ZINC001754643925	1440649577	/nfs/dbraw/zinc/64/95/77/1440649577.db2.gz	KOLNAQJTVPVERE-SFHVURJKSA-N	0	3	332.875	3.366	20	30		EGEDHN
C=CCCC(=O)N[C@]1(C)CCN(CCOc2c(C)cccc2C)C1	ZINC001754667335	1440657131	/nfs/dbraw/zinc/65/71/31/1440657131.db2.gz	PPYZQWZLBQXQCZ-HXUWFJFHSA-N	0	3	330.472	3.229	20	30		EGEDHN
Cc1cccnc1CN1CCC[C@](C)(CNC(=O)C#CC(C)(C)C)C1	ZINC001754726730	1440676794	/nfs/dbraw/zinc/67/67/94/1440676794.db2.gz	HANCZWHXPSBNPZ-OAQYLSRUSA-N	0	3	341.499	3.158	20	30		EGEDHN
C=CCN1CCC[C@](C)(CNC(=O)c2cccc3oc(C)nc32)C1	ZINC001754734036	1440681239	/nfs/dbraw/zinc/68/12/39/1440681239.db2.gz	IHBNEBOWQSNQCF-LJQANCHMSA-N	0	3	327.428	3.154	20	30		EGEDHN
CC/C=C(/C)C(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1cccc(C#N)c1	ZINC001754863263	1440701774	/nfs/dbraw/zinc/70/17/74/1440701774.db2.gz	UXLJBPKZFHJIIG-OASRTCMFSA-N	0	3	337.467	3.480	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC[C@H]2CN(Cc3cccnc3C)C[C@H]21	ZINC001754873269	1440705709	/nfs/dbraw/zinc/70/57/09/1440705709.db2.gz	CHFRYWWCVWNVQL-YZGWKJHDSA-N	0	3	341.499	3.415	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@H]2CN(Cc3ccc(F)cc3)C[C@H]21	ZINC001754873404	1440705921	/nfs/dbraw/zinc/70/59/21/1440705921.db2.gz	IBNZHZUSUKIYLJ-AZUAARDMSA-N	0	3	342.458	3.442	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCN(C(=O)c2c3c[nH]nc3ccc2C)C1	ZINC001754921139	1440709307	/nfs/dbraw/zinc/70/93/07/1440709307.db2.gz	ODVIZRYPQCJTCM-CQSZACIVSA-N	0	3	346.862	3.066	20	30		EGEDHN
CC#CCN[C@@H](C)c1ccc(CNC(=O)c2cc(C3CC3)no2)cc1	ZINC001754948228	1440714126	/nfs/dbraw/zinc/71/41/26/1440714126.db2.gz	GUHVFEMMZQVCIC-AWEZNQCLSA-N	0	3	337.423	3.156	20	30		EGEDHN
C#CCN[C@@H](C)c1ccc(CNC(=O)c2ccc(COC)cc2)cc1	ZINC001754951594	1440715071	/nfs/dbraw/zinc/71/50/71/1440715071.db2.gz	YXRABPXHOPEQJG-INIZCTEOSA-N	0	3	336.435	3.047	20	30		EGEDHN
C=CCN(C)Cc1ccccc1CNC(=O)[C@H]1COc2ccccc21	ZINC001754952681	1440715427	/nfs/dbraw/zinc/71/54/27/1440715427.db2.gz	GAWFHPJMQXOOSB-IBGZPJMESA-N	0	3	336.435	3.097	20	30		EGEDHN
Cc1nc(C(C)C)ccc1CN(C)CCCN(C)C(=O)C#CC(C)C	ZINC001755035764	1440734345	/nfs/dbraw/zinc/73/43/45/1440734345.db2.gz	CKJSODJVQHYTMQ-UHFFFAOYSA-N	0	3	343.515	3.453	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC(CC)(NCc2nocc2C)CC1	ZINC001755071494	1440746784	/nfs/dbraw/zinc/74/67/84/1440746784.db2.gz	VYHYPQCIAFPCST-MRXNPFEDSA-N	0	3	333.476	3.446	20	30		EGEDHN
C=CCCC(=O)NCc1ccc2c(c1)CN(CC[C@@H]1CCOC1)C2	ZINC001755101052	1440752241	/nfs/dbraw/zinc/75/22/41/1440752241.db2.gz	PLPDQYOIBPHNEH-MRXNPFEDSA-N	0	3	328.456	3.011	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)[C@@H](C)OCc2ccc(F)cc2)C(C)(C)C1	ZINC001755142966	1440761832	/nfs/dbraw/zinc/76/18/32/1440761832.db2.gz	FWXOJURGFCLSIL-CRAIPNDOSA-N	0	3	348.462	3.134	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)[C@H](C)OCc2ccc(F)cc2)C(C)(C)C1	ZINC001755142969	1440761835	/nfs/dbraw/zinc/76/18/35/1440761835.db2.gz	FWXOJURGFCLSIL-YJBOKZPZSA-N	0	3	348.462	3.134	20	30		EGEDHN
C[C@H](C(=O)NC1CC(CNCc2cc(C#N)ccc2F)C1)C(C)(C)C	ZINC001755213436	1440783687	/nfs/dbraw/zinc/78/36/87/1440783687.db2.gz	GUIDENYJBOPJPL-BZOOQXSSSA-N	0	3	345.462	3.364	20	30		EGEDHN
CC#CCCCC(=O)N[C@H](C)[C@@H](C)NCc1cc(C)ccc1OC	ZINC001755248361	1440791282	/nfs/dbraw/zinc/79/12/82/1440791282.db2.gz	IRRIFWDGHQTKIQ-IAGOWNOFSA-N	0	3	330.472	3.180	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)C[C@@H]1CCC[C@@H](OC)C1	ZINC001755282291	1440800884	/nfs/dbraw/zinc/80/08/84/1440800884.db2.gz	LZSWMIGDMNTISM-HZPDHXFCSA-N	0	3	344.927	3.408	20	30		EGEDHN
C=C(Br)CNCC(C)(C)CN(C)C(=O)[C@H]1CCC1(C)C	ZINC001755284322	1440801594	/nfs/dbraw/zinc/80/15/94/1440801594.db2.gz	OBJKMJUHHOYDIQ-CYBMUJFWSA-N	0	3	345.325	3.405	20	30		EGEDHN
CCCc1ccc(CN(C)[C@@H](C)CNC(=O)c2ccc(C#N)[nH]2)cc1	ZINC001755296897	1440806671	/nfs/dbraw/zinc/80/66/71/1440806671.db2.gz	RPQARDZQFKNFJT-HNNXBMFYSA-N	0	3	338.455	3.089	20	30		EGEDHN
Cc1sccc1C(=O)NC[C@H](C)N(C)Cc1ccc(C#N)cc1	ZINC001755298138	1440807295	/nfs/dbraw/zinc/80/72/95/1440807295.db2.gz	GVHHHXVHAQFIEM-ZDUSSCGKSA-N	0	3	327.453	3.179	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H](C)N(C)Cc2cc3ccccc3o2)nc1	ZINC001755323998	1440820496	/nfs/dbraw/zinc/82/04/96/1440820496.db2.gz	YPEBJEWMYUYKMP-HNNXBMFYSA-N	0	3	347.418	3.059	20	30		EGEDHN
C=CCOCCN1CCCCC[C@H]1CNC(=O)c1c(C)coc1C	ZINC001755364818	1440833871	/nfs/dbraw/zinc/83/38/71/1440833871.db2.gz	YYILPQKIHOCMDU-KRWDZBQOSA-N	0	3	334.460	3.073	20	30		EGEDHN
C#CCN1CCCCC[C@@H]1CNC(=O)C[C@H](C)c1ccc(F)cc1	ZINC001755367891	1440835661	/nfs/dbraw/zinc/83/56/61/1440835661.db2.gz	KOCSIQZRWFLWHI-QFBILLFUSA-N	0	3	330.447	3.313	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@]2(CCN(C(=O)c3sccc3C)C2)C1	ZINC001755399830	1440842790	/nfs/dbraw/zinc/84/27/90/1440842790.db2.gz	RLILLVVZXGSNPW-QFBILLFUSA-N	0	3	348.512	3.328	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCCOc2ccc(F)cc2)C(C)(C)C1	ZINC001755410131	1440845785	/nfs/dbraw/zinc/84/57/85/1440845785.db2.gz	LRGYJEVYMOKRND-SFHVURJKSA-N	0	3	348.462	3.387	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CC[C@H](NC(=O)CCc3ccco3)C[C@H]2C1	ZINC001755449464	1440852754	/nfs/dbraw/zinc/85/27/54/1440852754.db2.gz	FXTWUZOSCGODPQ-JYJNAYRXSA-N	0	3	336.863	3.181	20	30		EGEDHN
N#Cc1ccc(F)c(CNC[C@H]2C[C@H](NC(=O)CCC3CCC3)C2)c1	ZINC001755468345	1440858541	/nfs/dbraw/zinc/85/85/41/1440858541.db2.gz	QWBLNPLAHOZRHZ-SAABIXHNSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C(Cl)CNC[C@H]1C[C@H](NC(=O)C[C@H]2CCO[C@H](C(C)C)C2)C1	ZINC001755481119	1440860073	/nfs/dbraw/zinc/86/00/73/1440860073.db2.gz	DQNUVXIKNQZJEG-QAETUUGQSA-N	0	3	342.911	3.065	20	30		EGEDHN
C[C@H](CCCNCc1ccc(C#N)cc1F)NC(=O)c1cccs1	ZINC001755489307	1440861306	/nfs/dbraw/zinc/86/13/06/1440861306.db2.gz	WIWAUAFZSOVUSR-CYBMUJFWSA-N	0	3	345.443	3.447	20	30		EGEDHN
C=C(Cl)CNCCC[C@H](C)NC(=O)[C@@H]1CCN(C)c2ccccc21	ZINC001755501291	1440862708	/nfs/dbraw/zinc/86/27/08/1440862708.db2.gz	JUIQXFSGZZLUGL-DOTOQJQBSA-N	0	3	349.906	3.237	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N(C)C[C@@H](C)NCc1ccc(C#N)c(F)c1	ZINC001755605001	1440885073	/nfs/dbraw/zinc/88/50/73/1440885073.db2.gz	GJJJPLLQMOBXNO-AUUYWEPGSA-N	0	3	331.435	3.236	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N(C)C[C@H](C)NCc1ccc(C#N)c(F)c1	ZINC001755605002	1440885209	/nfs/dbraw/zinc/88/52/09/1440885209.db2.gz	GJJJPLLQMOBXNO-IFXJQAMLSA-N	0	3	331.435	3.236	20	30		EGEDHN
C[C@H]1[C@H](NCC#Cc2ccccc2Cl)CCN1C(=O)C(C)(C)F	ZINC001755648799	1440891166	/nfs/dbraw/zinc/89/11/66/1440891166.db2.gz	JRXHRWCAGHZJHM-XJKSGUPXSA-N	0	3	336.838	3.019	20	30		EGEDHN
C[C@H]1C[C@H](NCC#Cc2ccc(F)cc2)CN1C(=O)C1(F)CCCC1	ZINC001755680166	1440895068	/nfs/dbraw/zinc/89/50/68/1440895068.db2.gz	DJLHDFBZOWXDIG-YJBOKZPZSA-N	0	3	346.421	3.039	20	30		EGEDHN
CCCc1[nH]ccc1C(=O)N1C[C@@H](NCC#Cc2ccccc2)C[C@@H]1C	ZINC001755683814	1440895577	/nfs/dbraw/zinc/89/55/77/1440895577.db2.gz	YZFXTDQSNKRXFG-HKUYNNGSSA-N	0	3	349.478	3.212	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)COc2cc(C)cc(C)c2)[C@H]1C	ZINC001755720289	1440907115	/nfs/dbraw/zinc/90/71/15/1440907115.db2.gz	HDEKJPXQDNGUQV-MJGOQNOKSA-N	0	3	330.472	3.227	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)COc2c(C)cccc2C)[C@@H]1C	ZINC001755722146	1440908091	/nfs/dbraw/zinc/90/80/91/1440908091.db2.gz	QUDWKSJYQSOSIH-ZWKOTPCHSA-N	0	3	330.472	3.227	20	30		EGEDHN
CC/C(C)=C\C(=O)N1C[C@H](NCc2ccc(F)c(C#N)c2)C(C)(C)C1	ZINC001755759153	1440914595	/nfs/dbraw/zinc/91/45/95/1440914595.db2.gz	LNTUGFOMFWWUJF-PIJNTSGSSA-N	0	3	343.446	3.380	20	30		EGEDHN
CC(C)(C)[C@H](CNCc1cc(C#N)ccc1F)NC(=O)C1CCC1	ZINC001755815344	1440923305	/nfs/dbraw/zinc/92/33/05/1440923305.db2.gz	IFKKMDIZRRTOCC-KRWDZBQOSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@H](C)C1CCN(Cc2cn(C)nc2C)CC1	ZINC001755844664	1440932772	/nfs/dbraw/zinc/93/27/72/1440932772.db2.gz	FFAHPUYJGUOFFC-WBVHZDCISA-N	0	3	346.519	3.048	20	30		EGEDHN
CN(C(=O)[C@@]1(C)CC=CCC1)C1CC(NCC#Cc2ccccc2)C1	ZINC001755857774	1440936151	/nfs/dbraw/zinc/93/61/51/1440936151.db2.gz	BOEWQDHFCCLOOP-AOMIVXANSA-N	0	3	336.479	3.364	20	30		EGEDHN
N#CC1(c2ccccc2)CC(N[C@@H](COC(N)=O)Cc2ccccc2)C1	ZINC001771735180	1441415476	/nfs/dbraw/zinc/41/54/76/1441415476.db2.gz	TXINTAJJQBPRQV-LWEYNCJUSA-N	0	3	349.434	3.321	20	30		EGEDHN
C=CC[C@H]1CCCC[C@H]1[NH2+]CCCOc1ccc(-c2nn[n-]n2)cc1	ZINC001573329711	947425224	/nfs/dbraw/zinc/42/52/24/947425224.db2.gz	NQAVYFCZRZPWFY-MAUKXSAKSA-N	0	3	341.459	3.360	20	30		EGEDHN
C[C@H](NCc1ccc(N2CCO[C@H](C)C2)nc1)c1cccc(C#N)c1	ZINC000181510558	234211514	/nfs/dbraw/zinc/21/15/14/234211514.db2.gz	FCYXQPWOVHEPTN-CVEARBPZSA-N	0	3	336.439	3.029	20	30		EGEDHN
Cc1cccc(CCC(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)c1	ZINC000040108353	213267435	/nfs/dbraw/zinc/26/74/35/213267435.db2.gz	RUBUWUAKJHZFNF-UHFFFAOYSA-N	0	3	349.478	3.390	20	30		EGEDHN
N#Cc1ccc(C(=O)N2C[C@H]3CN(Cc4ccccc4)CC[C@@H]3C2)cc1	ZINC000312071675	283128233	/nfs/dbraw/zinc/12/82/33/283128233.db2.gz	OAHJUZNURAGQPO-NHCUHLMSSA-N	0	3	345.446	3.152	20	30		EGEDHN
CC[C@H]1CN(CCC(=O)Nc2sc3c(c2C#N)CCC3)CCS1	ZINC000072861951	216321250	/nfs/dbraw/zinc/32/12/50/216321250.db2.gz	YRKCIOYCIZBLLK-LBPRGKRZSA-N	0	3	349.525	3.264	20	30		EGEDHN
Cn1cc(CN[C@H]2CCN(c3ccc(Cl)c(F)c3)C2)cc1C#N	ZINC000191520358	239164784	/nfs/dbraw/zinc/16/47/84/239164784.db2.gz	YMOCIHVNRILQIA-ZDUSSCGKSA-N	0	3	332.810	3.058	20	30		EGEDHN
N#Cc1ccnc(NC[C@H](c2ccccc2)N2CCCC2)c1[N+](=O)[O-]	ZINC000132544219	223341075	/nfs/dbraw/zinc/34/10/75/223341075.db2.gz	IEJOZCIERHQEPI-MRXNPFEDSA-N	0	3	337.383	3.110	20	30		EGEDHN
C[C@@H](N[C@H](CN1CCOCC1)c1ccccc1)c1cccc(C#N)c1	ZINC000181421394	296159754	/nfs/dbraw/zinc/15/97/54/296159754.db2.gz	OCVSPFXVWCZIOK-DYESRHJHSA-N	0	3	335.451	3.282	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2ccc(C#N)cc2)CCN1Cc1ccccc1	ZINC000079553076	217241586	/nfs/dbraw/zinc/24/15/86/217241586.db2.gz	NITNEYMCOGYBFK-UZLBHIALSA-N	0	3	333.435	3.341	20	30		EGEDHN
Cc1cccc(CN(CCN(C)C)C(=O)c2cc(C#N)cs2)c1	ZINC000084107833	217576282	/nfs/dbraw/zinc/57/62/82/217576282.db2.gz	WTEBUNCFHJCLNJ-UHFFFAOYSA-N	0	3	327.453	3.132	20	30		EGEDHN
COCCN1CCC(Nc2c(C#N)cnc3c(C)cc(C)cc32)CC1	ZINC000266424212	248293916	/nfs/dbraw/zinc/29/39/16/248293916.db2.gz	SKKNVVLUSIOHEA-UHFFFAOYSA-N	0	3	338.455	3.246	20	30		EGEDHN
N#Cc1ccc(N2CCC(NCc3ccc(Cl)nc3)CC2)cc1	ZINC000267629988	251207249	/nfs/dbraw/zinc/20/72/49/251207249.db2.gz	SDVZKTUXFMIPOB-UHFFFAOYSA-N	0	3	326.831	3.365	20	30		EGEDHN
COc1cc(CN(C)C[C@H](O)c2ccc(C#N)cc2)ccc1SC	ZINC000268641268	252094328	/nfs/dbraw/zinc/09/43/28/252094328.db2.gz	DNXJUGNTKITELH-KRWDZBQOSA-N	0	3	342.464	3.454	20	30		EGEDHN
COCCO[C@@H]1CCN(Cc2ccc(-c3ccccc3C#N)cc2)C1	ZINC000189727191	533172505	/nfs/dbraw/zinc/17/25/05/533172505.db2.gz	BTHURQNFQANXGY-HXUWFJFHSA-N	0	3	336.435	3.463	20	30		EGEDHN
COC(=O)COc1ccc(CN(C)[C@H](C)c2cccc(C#N)c2)cc1	ZINC000187728671	533557371	/nfs/dbraw/zinc/55/73/71/533557371.db2.gz	BRBXLEJCKNFAAC-OAHLLOKOSA-N	0	3	338.407	3.303	20	30		EGEDHN
CCS[C@H]1CCCCN([C@H]2CCN(c3ccc(C#N)cc3)C2=O)C1	ZINC000246587155	141016717	/nfs/dbraw/zinc/01/67/17/141016717.db2.gz	ILWORGYAAVLVCB-ROUUACIJSA-N	0	3	343.496	3.271	20	30		EGEDHN
COCC[C@@H](NCCC(=O)Nc1cccc(C#N)c1)c1ccc(C)o1	ZINC000348141542	141237755	/nfs/dbraw/zinc/23/77/55/141237755.db2.gz	DLVHDPWVSRRKBF-QGZVFWFLSA-N	0	3	341.411	3.156	20	30		EGEDHN
C[C@H]1CCC[C@H](C(=O)N(CCN(C)C)Cc2cccc(C#N)c2)C1	ZINC000172849753	144029911	/nfs/dbraw/zinc/02/99/11/144029911.db2.gz	FAWGGKNPNOBCCT-LPHOPBHVSA-N	0	3	327.472	3.275	20	30		EGEDHN
CCO[C@@H]1C[C@@H](NCC(=O)Nc2oc(C)c(C)c2C#N)C1(CC)CC	ZINC000187051764	144151433	/nfs/dbraw/zinc/15/14/33/144151433.db2.gz	RYEFEKLWECVRAR-HZPDHXFCSA-N	0	3	347.459	3.280	20	30		EGEDHN
C[C@H]1CC[C@H](CC(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)C1	ZINC000122101869	152390481	/nfs/dbraw/zinc/39/04/81/152390481.db2.gz	JVVHYAVPRYKTGT-LPHOPBHVSA-N	0	3	327.472	3.275	20	30		EGEDHN
CCCCNC(=O)[C@H]1CC[C@@H](C)N(Cc2ccc(C#N)c(F)c2)C1	ZINC000191964379	153235199	/nfs/dbraw/zinc/23/51/99/153235199.db2.gz	UGXXDWGTUONKLS-PBHICJAKSA-N	0	3	331.435	3.214	20	30		EGEDHN
COc1ccc(C#N)cc1CN1CCCC[C@@H]1[C@H]1CCCC[C@H]1O	ZINC000326518642	154183450	/nfs/dbraw/zinc/18/34/50/154183450.db2.gz	UGXBNOAAKOEYPN-GUDVDZBRSA-N	0	3	328.456	3.472	20	30		EGEDHN
CC(C)(COCc1ccccc1)NCC(=O)Nc1ccc(C#N)cc1	ZINC000337301226	154268650	/nfs/dbraw/zinc/26/86/50/154268650.db2.gz	WXWJJKSTULRBDN-UHFFFAOYSA-N	0	3	337.423	3.082	20	30		EGEDHN
COc1ccc(CN(CCN(C)C)Cc2ccc(C#N)cc2)cc1F	ZINC000348898109	156281970	/nfs/dbraw/zinc/28/19/70/156281970.db2.gz	WQXJYTNJPJLSPG-UHFFFAOYSA-N	0	3	341.430	3.270	20	30		EGEDHN
CCc1cnc(CN(CCN(C)C)Cc2ccc(C#N)cc2)s1	ZINC000348921482	156287776	/nfs/dbraw/zinc/28/77/76/156287776.db2.gz	NEBAHMMVKOHLAU-UHFFFAOYSA-N	0	3	328.485	3.141	20	30		EGEDHN
N#Cc1cccc(CN(Cc2ccc(-n3cncn3)cc2)C2CC2)c1	ZINC000338598153	163287150	/nfs/dbraw/zinc/28/71/50/163287150.db2.gz	OYDJBHIDEHOEGJ-UHFFFAOYSA-N	0	3	329.407	3.304	20	30		EGEDHN
COCCN(CCC(=O)Nc1ccc(C#N)cc1)Cc1cccs1	ZINC000358926956	167007745	/nfs/dbraw/zinc/00/77/45/167007745.db2.gz	TZZHMFNHAIOMMO-UHFFFAOYSA-N	0	3	343.452	3.097	20	30		EGEDHN
C[C@H](NCC(=O)N1CCCC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000359847048	167247678	/nfs/dbraw/zinc/24/76/78/167247678.db2.gz	NUSSBRKWWQQXRA-INIZCTEOSA-N	0	3	333.435	3.498	20	30		EGEDHN
N#Cc1ccc(C2=CCN(C[C@H](O)c3ccc(C#N)cc3)CC2)cc1	ZINC000362423811	167753675	/nfs/dbraw/zinc/75/36/75/167753675.db2.gz	CCVWPLAFWSBADK-NRFANRHFSA-N	0	3	329.403	3.253	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@@H](C)N(CC)C[C@H]1CCOC1	ZINC000677885896	549351451	/nfs/dbraw/zinc/35/14/51/549351451.db2.gz	MLSXKQUMNPLUMQ-HZPDHXFCSA-N	0	3	336.501	3.010	20	30		EGEDHN
C[C@H](NC[C@@H]1CN(C)C(=O)O1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000495726430	269878182	/nfs/dbraw/zinc/87/81/82/269878182.db2.gz	HFADSHGBQPSJCM-IFXJQAMLSA-N	0	3	335.407	3.326	20	30		EGEDHN
N#Cc1ccccc1OCCN1CC2(CCC2)[C@H]1C1CCOCC1	ZINC000425553240	270049322	/nfs/dbraw/zinc/04/93/22/270049322.db2.gz	LVUZUABRCTVABW-LJQANCHMSA-N	0	3	326.440	3.218	20	30		EGEDHN
Cc1ccc(C#N)cc1NC(=O)N[C@@H](CC(C)C)CN1CCCC1	ZINC000454632900	270053963	/nfs/dbraw/zinc/05/39/63/270053963.db2.gz	APMSIPOSECENCD-KRWDZBQOSA-N	0	3	328.460	3.499	20	30		EGEDHN
N#Cc1ccccc1OC1CCC(NCc2cn3cccnc3n2)CC1	ZINC000459438114	270054712	/nfs/dbraw/zinc/05/47/12/270054712.db2.gz	CMUITEDUSGKREM-UHFFFAOYSA-N	0	3	347.422	3.081	20	30		EGEDHN
Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)/C=C\CN(C)C	ZINC000491644876	270058162	/nfs/dbraw/zinc/05/81/62/270058162.db2.gz	QWXUHQSHUKHXHJ-ALCCZGGFSA-N	0	3	336.395	3.110	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)c1cc(C#N)cs1)c1ccccc1	ZINC000176867515	266119275	/nfs/dbraw/zinc/11/92/75/266119275.db2.gz	SQFIENORTRFZJU-INIZCTEOSA-N	0	3	327.453	3.433	20	30		EGEDHN
CCO[C@H](CNC(=O)C(C#N)Cc1ccc(C#N)cc1)c1ccccc1	ZINC000279912264	266300707	/nfs/dbraw/zinc/30/07/07/266300707.db2.gz	FJPNEHGMAXOHRB-VQTJNVASSA-N	0	3	347.418	3.135	20	30		EGEDHN
CCSCC[C@H](C)N(C)C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000280298978	266344252	/nfs/dbraw/zinc/34/42/52/266344252.db2.gz	FPVVMHWQKWGOKW-YOEHRIQHSA-N	0	3	329.469	3.231	20	30		EGEDHN
C[C@@H]1CCC[C@@H]1CC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000185896258	267015552	/nfs/dbraw/zinc/01/55/52/267015552.db2.gz	OSSDDXKVAGNZHO-VQIMIIECSA-N	0	3	327.472	3.275	20	30		EGEDHN
CCCN1CCC[C@H]1CNC(=O)N(C)[C@@H](C)c1cccc(C#N)c1	ZINC000425784536	267018806	/nfs/dbraw/zinc/01/88/06/267018806.db2.gz	RHIVOKMJORYMPX-YJBOKZPZSA-N	0	3	328.460	3.135	20	30		EGEDHN
CCC[C@@H](C)NC(=O)[C@H]1CCCN(Cc2ccc(C#N)c(C)c2)C1	ZINC000486674068	267031232	/nfs/dbraw/zinc/03/12/32/267031232.db2.gz	HTQFJALPXGPGRQ-APWZRJJASA-N	0	3	327.472	3.384	20	30		EGEDHN
Cc1c(Cl)cnc(NC2CCN(CCOC(C)C)CC2)c1C#N	ZINC000273390173	267031515	/nfs/dbraw/zinc/03/15/15/267031515.db2.gz	UTBGGBVKVWOITF-UHFFFAOYSA-N	0	3	336.867	3.216	20	30		EGEDHN
CCC[C@]1(CO)CCCN1Cc1ccc(C#N)cc1Br	ZINC000444774879	267040829	/nfs/dbraw/zinc/04/08/29/267040829.db2.gz	KZCKWKSPNOIZKF-MRXNPFEDSA-N	0	3	337.261	3.448	20	30		EGEDHN
C[C@@H]1CN(Cc2cn(C)nc2-c2ccc(C#N)cc2)CCC1(F)F	ZINC000289836470	267055116	/nfs/dbraw/zinc/05/51/16/267055116.db2.gz	OXHLQLYMIAJABV-CYBMUJFWSA-N	0	3	330.382	3.436	20	30		EGEDHN
C[C@@H]1[C@@H](NC(=O)NCc2ccc(C#N)cc2)CCN1Cc1ccccc1	ZINC000287083060	267105040	/nfs/dbraw/zinc/10/50/40/267105040.db2.gz	MAXNHPOPXDOIRO-UZLBHIALSA-N	0	3	348.450	3.020	20	30		EGEDHN
C[C@H](CNC(=O)Nc1ccc(F)cc1C#N)N(C)Cc1ccccc1	ZINC000177929775	267159862	/nfs/dbraw/zinc/15/98/62/267159862.db2.gz	BHOPXSZUFBAXRP-CQSZACIVSA-N	0	3	340.402	3.339	20	30		EGEDHN
C[C@H](NCc1ccccc1OCCN(C)C)c1ccc(C#N)c(F)c1	ZINC000271955786	267185321	/nfs/dbraw/zinc/18/53/21/267185321.db2.gz	PSNFVXVRGPVZHL-HNNXBMFYSA-N	0	3	341.430	3.489	20	30		EGEDHN
C[C@@H](CCN1CCN(C)CC1)Nc1ccc(C#N)c(C(F)(F)F)c1	ZINC000274495974	267246821	/nfs/dbraw/zinc/24/68/21/267246821.db2.gz	QXBLBGOOYAWFPD-ZDUSSCGKSA-N	0	3	340.393	3.015	20	30		EGEDHN
CN(C)CCOc1ccc(CCNc2ccc(F)cc2C#N)cc1	ZINC000462829058	267281536	/nfs/dbraw/zinc/28/15/36/267281536.db2.gz	WAXJIQWGWKVPQT-UHFFFAOYSA-N	0	3	327.403	3.292	20	30		EGEDHN
CN(C)[C@@H](CNc1ccc(C(F)(F)F)c(C#N)n1)c1ccsc1	ZINC000443519565	267285699	/nfs/dbraw/zinc/28/56/99/267285699.db2.gz	OSVZYKYQQZQVDU-ZDUSSCGKSA-N	0	3	340.374	3.170	20	30		EGEDHN
CN(CC(=O)NCc1cccc(C#N)c1)[C@@H]1CCC[C@@H]1C(C)(C)C	ZINC000419328409	267297973	/nfs/dbraw/zinc/29/79/73/267297973.db2.gz	OSTMEFVSJMTQAX-ZWKOTPCHSA-N	0	3	327.472	3.321	20	30		EGEDHN
Cc1cc(C)cc(-c2ccc(CNCCn3cnc(C#N)n3)cc2)c1	ZINC000285493073	267321277	/nfs/dbraw/zinc/32/12/77/267321277.db2.gz	MEWFFCWLSOBDJW-UHFFFAOYSA-N	0	3	331.423	3.223	20	30		EGEDHN
Cc1cc(NC(=O)[C@@H](C)Oc2ccc(C#N)cc2)ccc1CN(C)C	ZINC000458329439	268010553	/nfs/dbraw/zinc/01/05/53/268010553.db2.gz	XNNPVUIFBJIXLE-OAHLLOKOSA-N	0	3	337.423	3.334	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCC(F)(F)c2ccccc2)cc1	ZINC000356921833	268085400	/nfs/dbraw/zinc/08/54/00/268085400.db2.gz	AVFJYGPMWLJMMD-INIZCTEOSA-N	0	3	339.345	3.149	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCc2cccc3cc[nH]c32)cc1	ZINC000352043618	268086757	/nfs/dbraw/zinc/08/67/57/268086757.db2.gz	ABZBRMBSTJURTA-SFHVURJKSA-N	0	3	328.375	3.038	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCC2(c3ccccc3)CCC2)cc1	ZINC000280891612	268089915	/nfs/dbraw/zinc/08/99/15/268089915.db2.gz	SIUGBQJRATXUNE-LJQANCHMSA-N	0	3	343.430	3.479	20	30		EGEDHN
N#Cc1ccc(NC(=O)N2CCC(N3CC=CC3)CC2)c(Cl)c1	ZINC000275820182	268143832	/nfs/dbraw/zinc/14/38/32/268143832.db2.gz	ZXRBQNZVZKLAHZ-UHFFFAOYSA-N	0	3	330.819	3.080	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCN(CCCCC3CCOCC3)C2)nc1	ZINC000292242902	268181731	/nfs/dbraw/zinc/18/17/31/268181731.db2.gz	QIVUFRCWCBSNKL-GOSISDBHSA-N	0	3	329.444	3.003	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CN1CCC[C@@H]1c1ccc(F)cc1	ZINC000528336394	268300422	/nfs/dbraw/zinc/30/04/22/268300422.db2.gz	BGTPRQMRXURENE-RTBURBONSA-N	0	3	340.398	3.274	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@H](NCc1ccc(C#N)c(F)c1)C1CC1	ZINC000192177977	275223665	/nfs/dbraw/zinc/22/36/65/275223665.db2.gz	NTNVVIUQRFYVOE-INIZCTEOSA-N	0	3	333.407	3.090	20	30		EGEDHN
COc1ccc(CN2CCC(CNc3cccnc3C#N)CC2)cc1	ZINC000290686960	276529026	/nfs/dbraw/zinc/52/90/26/276529026.db2.gz	TXUCSPZMBIIRBY-UHFFFAOYSA-N	0	3	336.439	3.286	20	30		EGEDHN
C[C@@H]1C[C@H](N2CCCC2)CN1c1ccc(C#N)cc1Br	ZINC000343614769	278970015	/nfs/dbraw/zinc/97/00/15/278970015.db2.gz	SFMKNUOATVBOGZ-OCCSQVGLSA-N	0	3	334.261	3.384	20	30		EGEDHN
CN(C)CCN(Cc1cccc(F)c1)C(=O)Nc1ccc(C#N)cc1	ZINC000065984258	307360622	/nfs/dbraw/zinc/36/06/22/307360622.db2.gz	PUDBROKHLKUCLY-UHFFFAOYSA-N	0	3	340.402	3.293	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)Nc1cccc(C#N)c1	ZINC000065987075	307361039	/nfs/dbraw/zinc/36/10/39/307361039.db2.gz	QUIBGEMEAPLMLQ-UHFFFAOYSA-N	0	3	347.422	3.026	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)c1cccc2[nH]ccc21	ZINC000081613812	307441510	/nfs/dbraw/zinc/44/15/10/307441510.db2.gz	IQWBZRJQCRQPQP-UHFFFAOYSA-N	0	3	346.434	3.244	20	30		EGEDHN
CC[C@H](N[C@H](C)C(=O)Nc1ccc(C#N)c(Cl)c1)[C@H]1CCCO1	ZINC000248642665	308008270	/nfs/dbraw/zinc/00/82/70/308008270.db2.gz	ZUIAHMFWCSABCL-XFBWCDHKSA-N	0	3	335.835	3.086	20	30		EGEDHN
Cc1ccccc1[C@@H](NCC(=O)NCc1ccc(C#N)cc1)C(C)C	ZINC000538160395	314230371	/nfs/dbraw/zinc/23/03/71/314230371.db2.gz	VTGSLNCXKIIUIJ-NRFANRHFSA-N	0	3	335.451	3.470	20	30		EGEDHN
CN(C)CCOc1ccccc1-c1noc(-c2ccc(C#N)cc2)n1	ZINC000545791553	314781856	/nfs/dbraw/zinc/78/18/56/314781856.db2.gz	IGJAQEITJNQGAP-UHFFFAOYSA-N	0	3	334.379	3.216	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@H](N[C@@H]1CCCN(C3CCCCC3)C1=O)CC2	ZINC000555002992	315361644	/nfs/dbraw/zinc/36/16/44/315361644.db2.gz	MQECROHOUUXEDX-WOJBJXKFSA-N	0	3	337.467	3.459	20	30		EGEDHN
CC(C)(C)c1ccc(CNC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000568710270	316810295	/nfs/dbraw/zinc/81/02/95/316810295.db2.gz	RIQUJWABQQPKGR-LJQANCHMSA-N	0	3	338.451	3.385	20	30		EGEDHN
N#Cc1cncnc1N1CCN(Cc2ccccc2)C2(CCCCC2)C1	ZINC000570327092	317039651	/nfs/dbraw/zinc/03/96/51/317039651.db2.gz	OMOVPUVBDPESNJ-UHFFFAOYSA-N	0	3	347.466	3.373	20	30		EGEDHN
COc1ccc([C@@H](NCc2cnc3c(C#N)cnn3c2)C(C)C)cc1	ZINC000571983038	317274727	/nfs/dbraw/zinc/27/47/27/317274727.db2.gz	LQSDZHWGCMZXBF-SFHVURJKSA-N	0	3	335.411	3.096	20	30		EGEDHN
CC(C)(C)c1cccc(OCCNCc2cnc3c(C#N)cnn3c2)c1	ZINC000572001304	317277022	/nfs/dbraw/zinc/27/70/22/317277022.db2.gz	FRZMQONYVRCUIW-UHFFFAOYSA-N	0	3	349.438	3.067	20	30		EGEDHN
CC[C@H](NC[C@@H](O)COc1ccc(C#N)cc1)c1ccc(F)cc1F	ZINC000179633937	323397630	/nfs/dbraw/zinc/39/76/30/323397630.db2.gz	TUJBRHARPPJGIV-BEFAXECRSA-N	0	3	346.377	3.317	20	30		EGEDHN
N#Cc1cc(Br)ccc1CN[C@H](CO)C1CCCCC1	ZINC000386059686	324266015	/nfs/dbraw/zinc/26/60/15/324266015.db2.gz	AZECAMVGUUTMDV-MRXNPFEDSA-N	0	3	337.261	3.352	20	30		EGEDHN
O[C@H](CNCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)F	ZINC000319147927	456622410	/nfs/dbraw/zinc/62/24/10/456622410.db2.gz	GJQWAJYRAKMCEC-SECBINFHSA-N	0	3	337.210	3.440	20	30		EGEDHN
CN1CCN(Cc2ccc(NCc3ccc(C#N)c(F)c3)cc2)CC1	ZINC000580180252	325213578	/nfs/dbraw/zinc/21/35/78/325213578.db2.gz	MDSCQCBDFMSCEP-UHFFFAOYSA-N	0	3	338.430	3.057	20	30		EGEDHN
CC(C(=O)NCC1(C)CCCCCC1)S(=O)(=O)C1CCOCC1	ZINC000329250157	456861007	/nfs/dbraw/zinc/86/10/07/456861007.db2.gz	XNKQXWWGRGUCNL-AWEZNQCLSA-N	0	3	345.505	3.286	20	30		EGEDHN
C=CCOc1ccc(CNC[C@@](C)(O)c2ccc(F)cc2)cc1OC	ZINC000157820107	455236174	/nfs/dbraw/zinc/23/61/74/455236174.db2.gz	IMBLNSWKGLENGF-HXUWFJFHSA-N	0	3	345.414	3.396	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@@H](C)N[C@@H](C)c1cccc(-n2cccn2)c1	ZINC000173206527	455247978	/nfs/dbraw/zinc/24/79/78/455247978.db2.gz	SLMHMXCQNIOEFY-DLBZAZTESA-N	0	3	340.471	3.336	20	30		EGEDHN
CC(C)(O)CN(CC#Cc1ccc(OC(F)(F)F)cc1)C1CC1	ZINC000189939055	455257647	/nfs/dbraw/zinc/25/76/47/455257647.db2.gz	BGWGJKBXBZEQBO-UHFFFAOYSA-N	0	3	327.346	3.172	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CN[C@H]1CCSc2ccccc21	ZINC000600714698	460576836	/nfs/dbraw/zinc/57/68/36/460576836.db2.gz	OWAAHINJPCPZFF-WBVHZDCISA-N	0	3	340.448	3.125	20	30		EGEDHN
CN1CCC[C@@H](CNC(=O)N2CCC(C#N)CC2)[C@H]1c1cccs1	ZINC000245671340	455353263	/nfs/dbraw/zinc/35/32/63/455353263.db2.gz	FKXGMIBIDKKUAP-RDJZCZTQSA-N	0	3	346.500	3.076	20	30		EGEDHN
C[C@@]1(C#N)CCCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000612369238	460607790	/nfs/dbraw/zinc/60/77/90/460607790.db2.gz	QOLXFIHEBAGQCF-FQEVSTJZSA-N	0	3	325.456	3.051	20	30		EGEDHN
Cc1cccc(OCCN2CCCN(Cc3ccc(C#N)cc3)CC2)c1	ZINC000022850290	453700063	/nfs/dbraw/zinc/70/00/63/453700063.db2.gz	HLMBQYYPPDJPEY-UHFFFAOYSA-N	0	3	349.478	3.453	20	30		EGEDHN
C[C@@H](NCCC(=O)N(C)CCC#N)c1cccc(C(F)(F)F)c1	ZINC000181611686	455362086	/nfs/dbraw/zinc/36/20/86/455362086.db2.gz	VXWPAWMMJFMNLI-GFCCVEGCSA-N	0	3	327.350	3.118	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN(Cc2ccc(F)cc2)C2CC2)cc1	ZINC000066402154	453842683	/nfs/dbraw/zinc/84/26/83/453842683.db2.gz	CWFSLRLPPYVDMY-LJQANCHMSA-N	0	3	340.398	3.102	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](C)c2c(F)cccc2Cl)CC1	ZINC000081493743	453877490	/nfs/dbraw/zinc/87/74/90/453877490.db2.gz	JJJYUIHGUSZLPT-GFCCVEGCSA-N	0	3	339.842	3.490	20	30		EGEDHN
CCN(Cc1ccc(CN(C)C)cc1)C(=O)NCC#Cc1ccccc1	ZINC000067042638	453896587	/nfs/dbraw/zinc/89/65/87/453896587.db2.gz	GKMRCMDXQKIRLI-UHFFFAOYSA-N	0	3	349.478	3.331	20	30		EGEDHN
CN(CCC#N)c1ccc(CNCc2ccnc(N3CCCC3)c2)cc1	ZINC000075761117	453925237	/nfs/dbraw/zinc/92/52/37/453925237.db2.gz	BZDAOPZCMHSIQL-UHFFFAOYSA-N	0	3	349.482	3.321	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cccc(-c3nccs3)c2)CC1	ZINC000067710074	453958999	/nfs/dbraw/zinc/95/89/99/453958999.db2.gz	IWUPMOCZZSJOCC-UHFFFAOYSA-N	0	3	325.437	3.094	20	30		EGEDHN
C[C@@H](NC(=O)NC[C@H](C)N1CCC(C)CC1)c1ccc(C#N)cc1	ZINC000067706533	453959282	/nfs/dbraw/zinc/95/92/82/453959282.db2.gz	KRBGFNAVJUWHSB-JKSUJKDBSA-N	0	3	328.460	3.039	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)c2ccc(OC[C@@H]3CCCO3)cc2)n1	ZINC000041521743	453969965	/nfs/dbraw/zinc/96/99/65/453969965.db2.gz	PWJOAKGQNJKFJV-JKSUJKDBSA-N	0	3	342.420	3.499	20	30		EGEDHN
Cc1c(C(=O)C(C#N)c2cc(C)nc(C)n2)cnn1-c1ccc(F)cc1	ZINC000041560379	453972212	/nfs/dbraw/zinc/97/22/12/453972212.db2.gz	KALRIQRLEXNFLT-INIZCTEOSA-N	0	3	349.369	3.217	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1F)C(=O)c1cccc(CC#N)c1	ZINC000068230273	454009709	/nfs/dbraw/zinc/00/97/09/454009709.db2.gz	REDLGOUHYGPZLC-UHFFFAOYSA-N	0	3	339.414	3.096	20	30		EGEDHN
C[C@H](CNc1c(C#N)nnc2ccccc21)N1CCc2ccccc2C1	ZINC000077188992	454072738	/nfs/dbraw/zinc/07/27/38/454072738.db2.gz	NNEUUZNIUKUERF-OAHLLOKOSA-N	0	3	343.434	3.360	20	30		EGEDHN
CN(C)[C@@H](CNc1c(C#N)nnc2ccccc21)c1ccc(F)cc1	ZINC000077192433	454073559	/nfs/dbraw/zinc/07/35/59/454073559.db2.gz	KFWCIORYBWJNNV-SFHVURJKSA-N	0	3	335.386	3.355	20	30		EGEDHN
N#Cc1nnc2ccccc2c1N1CCN(CC2CCCCC2)CC1	ZINC000077213466	454076604	/nfs/dbraw/zinc/07/66/04/454076604.db2.gz	SPIQRCCTBDCLFR-UHFFFAOYSA-N	0	3	335.455	3.204	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1CC[C@@H](Nc2ccccc2)C1	ZINC000077277187	454084299	/nfs/dbraw/zinc/08/42/99/454084299.db2.gz	HGFFBDDSCYKLMY-GOSISDBHSA-N	0	3	337.423	3.132	20	30		EGEDHN
CN(CCC(=O)Nc1ccc(C#N)cc1)Cc1ccc(F)c(F)c1	ZINC000044438860	454101524	/nfs/dbraw/zinc/10/15/24/454101524.db2.gz	VQLMHIMCYKHYPY-UHFFFAOYSA-N	0	3	329.350	3.297	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCNC2(c3ccccc3)CCOCC2)cc1	ZINC000069739416	454139144	/nfs/dbraw/zinc/13/91/44/454139144.db2.gz	ROFSBNTVIZKVSK-UHFFFAOYSA-N	0	3	349.434	3.182	20	30		EGEDHN
Cc1cc(C)c(C#N)c(SC[C@@H](O)CN(C)Cc2ccccc2)n1	ZINC000060368080	454282268	/nfs/dbraw/zinc/28/22/68/454282268.db2.gz	OXDLCHDSNUSDHW-KRWDZBQOSA-N	0	3	341.480	3.155	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1ccc2nccnc2c1)C(C)C	ZINC000120284992	454283089	/nfs/dbraw/zinc/28/30/89/454283089.db2.gz	KTMQRNWPOZTFLM-IBGZPJMESA-N	0	3	338.455	3.058	20	30		EGEDHN
C[C@@H]1CN(CCC(=O)Nc2sc3c(c2C#N)CCC3)C[C@@H](C)S1	ZINC000072770110	454337931	/nfs/dbraw/zinc/33/79/31/454337931.db2.gz	ZQPBFPGQSXLJSB-VXGBXAGGSA-N	0	3	349.525	3.263	20	30		EGEDHN
CO[C@H](CNCc1cn(CCC#N)nc1-c1ccccc1)C(C)C	ZINC000072924545	454363532	/nfs/dbraw/zinc/36/35/32/454363532.db2.gz	LKTHDQDFMWWPJW-GOSISDBHSA-N	0	3	326.444	3.224	20	30		EGEDHN
Cc1ccc2cc(C(=O)C(C#N)c3nnc4n3CCCCC4)ccc2n1	ZINC000097022168	454389404	/nfs/dbraw/zinc/38/94/04/454389404.db2.gz	CIVUCECDINPCFH-INIZCTEOSA-N	0	3	345.406	3.351	20	30		EGEDHN
Cc1ccc([C@@H](C)N(C)C[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000047964679	454424144	/nfs/dbraw/zinc/42/41/44/454424144.db2.gz	JCHQSKIBSKNAHB-XLIONFOSSA-N	0	3	338.451	3.494	20	30		EGEDHN
Cc1ccc(CN(CCN(C)C)C(=O)Nc2ccc(C#N)cc2)o1	ZINC000048051701	454437170	/nfs/dbraw/zinc/43/71/70/454437170.db2.gz	DHNUCBKPHGUMBL-UHFFFAOYSA-N	0	3	326.400	3.055	20	30		EGEDHN
COc1ccccc1N(CCC#N)C(=O)[C@@H](C)N(C)CC1CCCC1	ZINC000064014553	454463515	/nfs/dbraw/zinc/46/35/15/454463515.db2.gz	VINPWWPCJGAESC-MRXNPFEDSA-N	0	3	343.471	3.452	20	30		EGEDHN
N#CC(C(=O)c1ccc(-c2cnco2)cc1)c1nnc2n1CCCCC2	ZINC000064102160	454467030	/nfs/dbraw/zinc/46/70/30/454467030.db2.gz	VOWPIKFWYQNGJT-OAHLLOKOSA-N	0	3	347.378	3.150	20	30		EGEDHN
N#CC(C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc21)c1nc2ccccc2[nH]1	ZINC000048790232	454515489	/nfs/dbraw/zinc/51/54/89/454515489.db2.gz	FZVRVRQTROBCSN-LBPRGKRZSA-N	0	3	345.318	3.442	20	30		EGEDHN
COc1ccc([C@H](NCC(=O)Nc2cccc(C#N)c2)C(C)C)cc1	ZINC000102692988	454516095	/nfs/dbraw/zinc/51/60/95/454516095.db2.gz	DBWGZRNRYNLNIZ-HXUWFJFHSA-N	0	3	337.423	3.492	20	30		EGEDHN
COc1ccc([C@@H](NCC(=O)N[C@](C)(C#N)C(C)C)C(C)C)cc1	ZINC000102693301	454516436	/nfs/dbraw/zinc/51/64/36/454516436.db2.gz	OEFBKMBTNHYQIF-RBUKOAKNSA-N	0	3	331.460	3.036	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)[C@H]1CCOc2ccccc21)C(C)C	ZINC000102941952	454527246	/nfs/dbraw/zinc/52/72/46/454527246.db2.gz	INEOBSBGZXISLU-RBUKOAKNSA-N	0	3	342.483	3.368	20	30		EGEDHN
C=CCOCCCC(=O)NCC1CCN(Cc2ccc(C)cc2)CC1	ZINC000080102917	454533675	/nfs/dbraw/zinc/53/36/75/454533675.db2.gz	VEBSCMUEEZXTKX-UHFFFAOYSA-N	0	3	344.499	3.306	20	30		EGEDHN
CN(C)Cc1ccc(CNC(=O)c2ccc(C#N)c(Cl)c2)cc1	ZINC000122552054	454546322	/nfs/dbraw/zinc/54/63/22/454546322.db2.gz	VTCRFWLUIYYDNN-UHFFFAOYSA-N	0	3	327.815	3.203	20	30		EGEDHN
N#CC(C(=O)Cc1ccc(Cl)c(Cl)c1)C(=O)Nc1ccccn1	ZINC000103717495	454564614	/nfs/dbraw/zinc/56/46/14/454564614.db2.gz	ZHRBSNRGGFHCBC-LLVKDONJSA-N	0	3	348.189	3.278	20	30		EGEDHN
CC(C)N1CCN(c2ccc(C(=O)Nc3cccc(C#N)c3)cc2)CC1	ZINC000065736714	454616789	/nfs/dbraw/zinc/61/67/89/454616789.db2.gz	GKJUCCRTKXEZGS-UHFFFAOYSA-N	0	3	348.450	3.341	20	30		EGEDHN
C=C(C)COCCNC(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1	ZINC000135036483	454626748	/nfs/dbraw/zinc/62/67/48/454626748.db2.gz	SHEKLORNASJPGM-IBGZPJMESA-N	0	3	345.487	3.024	20	30		EGEDHN
C[C@H](CO)CSCC(=O)C(C#N)c1nc(-c2ccccc2)cs1	ZINC000074787372	454636567	/nfs/dbraw/zinc/63/65/67/454636567.db2.gz	YOGQXTOJHIFKRB-OCCSQVGLSA-N	0	3	346.477	3.348	20	30		EGEDHN
COc1ccc(CN(CCc2ccccc2)[C@H]2CCOC2)cc1C#N	ZINC000135137781	454636979	/nfs/dbraw/zinc/63/69/79/454636979.db2.gz	JQRLJFFSFMYUAK-FQEVSTJZSA-N	0	3	336.435	3.400	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)c1ccc(F)c(F)c1	ZINC000065931116	454641129	/nfs/dbraw/zinc/64/11/29/454641129.db2.gz	MOQRZUKMKMTWBR-UHFFFAOYSA-N	0	3	343.377	3.040	20	30		EGEDHN
CN(CCC(=O)Nc1ccc(C#N)c(Cl)c1)Cc1cccc(O)c1	ZINC000080917266	454646792	/nfs/dbraw/zinc/64/67/92/454646792.db2.gz	KJLLVEFBTUTUDS-UHFFFAOYSA-N	0	3	343.814	3.378	20	30		EGEDHN
CN(C)CCOc1cc(CNc2ccc3cc(C#N)ccc3n2)ccn1	ZINC000092940570	454656570	/nfs/dbraw/zinc/65/65/70/454656570.db2.gz	ZJFMVEGMJDGDAM-UHFFFAOYSA-N	0	3	347.422	3.054	20	30		EGEDHN
CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1ccc(C#N)cc1	ZINC000123752821	454672019	/nfs/dbraw/zinc/67/20/19/454672019.db2.gz	HXEKYCZRNALHDY-FQEVSTJZSA-N	0	3	348.450	3.080	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H](C)Sc2ccc(OC)cc2)CC1	ZINC000106035796	454674482	/nfs/dbraw/zinc/67/44/82/454674482.db2.gz	UPAGUDLTZBYNDT-HNNXBMFYSA-N	0	3	348.512	3.333	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H]2CCCO[C@H]2c2ccccc2)CC1	ZINC000106035039	454674951	/nfs/dbraw/zinc/67/49/51/454674951.db2.gz	GZPQDYIWZSNDBN-UXHICEINSA-N	0	3	342.483	3.311	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Cc2ccccc2OC(C)C)CC1	ZINC000106035229	454675168	/nfs/dbraw/zinc/67/51/68/454675168.db2.gz	PVWLBRAPQDOKKB-UHFFFAOYSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H]2COc3ccc(Cl)cc3C2)CC1	ZINC000106038434	454676103	/nfs/dbraw/zinc/67/61/03/454676103.db2.gz	ZFHTXTZMRFRKTH-OAHLLOKOSA-N	0	3	348.874	3.048	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](C)CCc2ccc(O)cc2)CC1	ZINC000106257839	454689028	/nfs/dbraw/zinc/68/90/28/454689028.db2.gz	UCNVDHBJRCFBAA-INIZCTEOSA-N	0	3	345.487	3.053	20	30		EGEDHN
N#CCCN(C(=O)CN1CC[C@@H](Cc2ccccc2)C1)c1ccccc1	ZINC000124051152	454696643	/nfs/dbraw/zinc/69/66/43/454696643.db2.gz	COJSWVRUHAOEMS-FQEVSTJZSA-N	0	3	347.462	3.498	20	30		EGEDHN
CCN(Cc1cc(=O)n2cccc(C)c2n1)[C@@H](C)c1ccc(C#N)cc1	ZINC000125768821	454844496	/nfs/dbraw/zinc/84/44/96/454844496.db2.gz	SCNKKWWADIBXDC-INIZCTEOSA-N	0	3	346.434	3.458	20	30		EGEDHN
C=C(CN[C@@H](C)c1cccc(S(=O)(=O)N(C)C)c1)c1ccccc1	ZINC000266876734	455467149	/nfs/dbraw/zinc/46/71/49/455467149.db2.gz	OIYVZKQQHXEEOR-INIZCTEOSA-N	0	3	344.480	3.301	20	30		EGEDHN
N#CCSc1cccc(C(=O)N2CCN(C3CCCCC3)CC2)c1	ZINC000154660878	454916344	/nfs/dbraw/zinc/91/63/44/454916344.db2.gz	DUAFWUYUZWKDJA-UHFFFAOYSA-N	0	3	343.496	3.393	20	30		EGEDHN
C#CCOc1ccc(CNCc2cccc(N3CCCC3=O)c2)cc1	ZINC000113321735	454923020	/nfs/dbraw/zinc/92/30/20/454923020.db2.gz	VLCBYQAYLBVYAC-UHFFFAOYSA-N	0	3	334.419	3.115	20	30		EGEDHN
C[C@@H](CC#N)N(C)C(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000127320412	454954008	/nfs/dbraw/zinc/95/40/08/454954008.db2.gz	AMJTUZPSBQASDO-INIZCTEOSA-N	0	3	344.459	3.317	20	30		EGEDHN
N#CC(C(=O)c1cnc2ccc(F)cc2c1)c1nnc2n1CCCCC2	ZINC000179000247	454997297	/nfs/dbraw/zinc/99/72/97/454997297.db2.gz	YMRKZLMVDHKTKO-OAHLLOKOSA-N	0	3	349.369	3.182	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cccc(C)c2Br)CC1	ZINC000179312664	455031866	/nfs/dbraw/zinc/03/18/66/455031866.db2.gz	OUVCXGCASYLYAF-UHFFFAOYSA-N	0	3	337.261	3.138	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CCC(NC(=O)C2(C#N)CCCC2)CC1	ZINC000116065778	455040674	/nfs/dbraw/zinc/04/06/74/455040674.db2.gz	GWJCEJAFVPZJAQ-INIZCTEOSA-N	0	3	325.456	3.412	20	30		EGEDHN
COc1ccc(CN(Cc2ccccc2)[C@@H](CO)C2CC2)cc1C#N	ZINC000155896613	455058919	/nfs/dbraw/zinc/05/89/19/455058919.db2.gz	ISWNVAOWOBVFHV-FQEVSTJZSA-N	0	3	336.435	3.340	20	30		EGEDHN
COc1ccc(OC)c(CN2CCN(CC(C)(C)CCC#N)CC2)c1	ZINC000179638147	455063747	/nfs/dbraw/zinc/06/37/47/455063747.db2.gz	JTTUUYTWCRXHHT-UHFFFAOYSA-N	0	3	345.487	3.151	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@@H](C)N(C)CC1CCOCC1	ZINC000156024723	455073700	/nfs/dbraw/zinc/07/37/00/455073700.db2.gz	VIMQKZYYJLOVFX-OAHLLOKOSA-N	0	3	336.501	3.010	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2csc(-c3ccccc3)n2)CC1	ZINC000171722040	455089753	/nfs/dbraw/zinc/08/97/53/455089753.db2.gz	FNBGODCVHWYFKT-UHFFFAOYSA-N	0	3	327.453	3.190	20	30		EGEDHN
CC(C)(CCC#N)CN1CCCN(C(=O)c2cccc(F)c2)CC1	ZINC000129026238	455094855	/nfs/dbraw/zinc/09/48/55/455094855.db2.gz	PYZAGQJSEUBDJM-UHFFFAOYSA-N	0	3	331.435	3.304	20	30		EGEDHN
C[C@@H](C(=O)NCCCCC#N)N1CCC(Cc2ccccc2)CC1	ZINC000171806461	455095362	/nfs/dbraw/zinc/09/53/62/455095362.db2.gz	ZJUKMSQGPMYZFK-KRWDZBQOSA-N	0	3	327.472	3.140	20	30		EGEDHN
C[C@](C#N)(NC(=O)CN[C@@H](c1ccccc1)C1CCCC1)C1CC1	ZINC000171935028	455102727	/nfs/dbraw/zinc/10/27/27/455102727.db2.gz	HAIDYVIKIGVOSD-VQTJNVASSA-N	0	3	325.456	3.316	20	30		EGEDHN
C[C@@](C#N)(NC(=O)CN[C@@H](c1ccccc1)C1CCCC1)C1CC1	ZINC000171935033	455102890	/nfs/dbraw/zinc/10/28/90/455102890.db2.gz	HAIDYVIKIGVOSD-PMACEKPBSA-N	0	3	325.456	3.316	20	30		EGEDHN
C=CCNC(=O)NC(=O)[C@H](C)N[C@H](c1ccc(Cl)cc1)[C@@H]1C[C@H]1C	ZINC000180022109	455117645	/nfs/dbraw/zinc/11/76/45/455117645.db2.gz	MPWJGJPVMGWHDU-NOXHYTERSA-N	0	3	349.862	3.027	20	30		EGEDHN
N#CC1(c2ccccc2)CC(NCc2ccc(N3CCOC3=O)cc2)C1	ZINC000129659463	455120088	/nfs/dbraw/zinc/12/00/88/455120088.db2.gz	RUBBLQYRKYEWQR-UHFFFAOYSA-N	0	3	347.418	3.357	20	30		EGEDHN
N#Cc1c(Cl)nsc1NCC1CCN(c2ccncc2)CC1	ZINC000180041441	455121068	/nfs/dbraw/zinc/12/10/68/455121068.db2.gz	AWUGGIBUOGBBED-UHFFFAOYSA-N	0	3	333.848	3.392	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H]2CCC[C@H]2Cc2ccccc2)CC1	ZINC000172384115	455150277	/nfs/dbraw/zinc/15/02/77/455150277.db2.gz	IROADYXAFMMBQV-ICSRJNTNSA-N	0	3	341.499	3.347	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc3nc(C)sc3c2)CC1	ZINC000264372266	455200349	/nfs/dbraw/zinc/20/03/49/455200349.db2.gz	RMGBURFMIGZBFP-UHFFFAOYSA-N	0	3	330.457	3.377	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](C)COc2cccc(C)c2)CC1	ZINC000264416924	455209666	/nfs/dbraw/zinc/20/96/66/455209666.db2.gz	VJHZFJIYBAYDLC-QGZVFWFLSA-N	0	3	345.487	3.102	20	30		EGEDHN
C=C(Cl)CNC(=O)NC[C@@H]1CCCN(Cc2cccs2)C1	ZINC000265594902	455347441	/nfs/dbraw/zinc/34/74/41/455347441.db2.gz	VCCNZPJKXXVEID-ZDUSSCGKSA-N	0	3	327.881	3.012	20	30		EGEDHN
C[C@H](CCc1ccccc1)N[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000190613055	455352769	/nfs/dbraw/zinc/35/27/69/455352769.db2.gz	NHIJFKRBHXJZMJ-DYESRHJHSA-N	0	3	347.462	3.270	20	30		EGEDHN
CN1CCC[C@@H](CNC(=O)c2ccccc2Oc2ccccc2C#N)C1	ZINC000181721324	455376693	/nfs/dbraw/zinc/37/66/93/455376693.db2.gz	NKYFAJRHLVAPHU-INIZCTEOSA-N	0	3	349.434	3.422	20	30		EGEDHN
COCCCOc1ccc(C(=O)C(C#N)c2nc(C)cs2)cc1	ZINC000175082307	455421886	/nfs/dbraw/zinc/42/18/86/455421886.db2.gz	SIKLCVCXBVDUOJ-OAHLLOKOSA-N	0	3	330.409	3.357	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@@H](C)N1CC[C@@H](COCC)C1	ZINC000246101595	455427097	/nfs/dbraw/zinc/42/70/97/455427097.db2.gz	BBFFNZLERGNGEM-HZPDHXFCSA-N	0	3	336.501	3.010	20	30		EGEDHN
COc1ccc(CN2CCN(C)C[C@H]2C(C)C)cc1OCCCC#N	ZINC000184740802	455440480	/nfs/dbraw/zinc/44/04/80/455440480.db2.gz	QRQBBJODUVKPAD-SFHVURJKSA-N	0	3	345.487	3.150	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC[C@@H](c3ccccc3)[C@H]2C)CC1	ZINC000175439436	455448585	/nfs/dbraw/zinc/44/85/85/455448585.db2.gz	VTGCREMQYDCTSF-VQIMIIECSA-N	0	3	327.472	3.224	20	30		EGEDHN
CN(C)Cc1ccc(-c2noc(Cc3ccc(OCC#N)cc3)n2)cc1	ZINC000267080685	455498793	/nfs/dbraw/zinc/49/87/93/455498793.db2.gz	PWYRQNDCYQGFDQ-UHFFFAOYSA-N	0	3	348.406	3.291	20	30		EGEDHN
Cc1nnc(N[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)c(C#N)c1C	ZINC000267208741	455516748	/nfs/dbraw/zinc/51/67/48/455516748.db2.gz	LGFKYWZEWILRSI-LIRRHRJNSA-N	0	3	335.455	3.288	20	30		EGEDHN
C=CCCOCC(=O)N(CC)[C@@H]1CCN([C@H](C)c2ccccc2)C1	ZINC000620531720	460680011	/nfs/dbraw/zinc/68/00/11/460680011.db2.gz	NNFLORWIYPJXOK-IEBWSBKVSA-N	0	3	330.472	3.263	20	30		EGEDHN
CC(=O)N1CCC(N(CCCC(C)(C)C#N)Cc2cncs2)CC1	ZINC000292286266	455619142	/nfs/dbraw/zinc/61/91/42/455619142.db2.gz	CCVLDGLKIRYFIH-UHFFFAOYSA-N	0	3	348.516	3.286	20	30		EGEDHN
CC[C@H](Cc1ccc(C)cc1)N(C)CC(=O)N[C@](C)(C#N)C(C)C	ZINC000247536894	455621334	/nfs/dbraw/zinc/62/13/34/455621334.db2.gz	OTTLRTVMQSWVLQ-UYAOXDASSA-N	0	3	329.488	3.302	20	30		EGEDHN
C[C@@H](N[C@H]1CCC[C@H](C#N)C1)c1cc(F)ccc1N1CCN(C)CC1	ZINC000185821959	455628940	/nfs/dbraw/zinc/62/89/40/455628940.db2.gz	KKODVTATIYYGEC-RYRKJORJSA-N	0	3	344.478	3.310	20	30		EGEDHN
N#Cc1cccc(OCCN2CCC[C@H]2C[C@H](O)c2ccco2)c1	ZINC000268247713	455629931	/nfs/dbraw/zinc/62/99/31/455629931.db2.gz	ILQJDHSDHSMXRN-WMZOPIPTSA-N	0	3	326.396	3.118	20	30		EGEDHN
C#CC[C@@H](N[C@H](C)c1ccc(NS(C)(=O)=O)cc1)c1ccccc1	ZINC000271445326	455639090	/nfs/dbraw/zinc/63/90/90/455639090.db2.gz	FQTWYGTXCJRBRI-DNVCBOLYSA-N	0	3	342.464	3.473	20	30		EGEDHN
C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NCc1ccc(C#N)cc1F	ZINC000277740826	455652499	/nfs/dbraw/zinc/65/24/99/455652499.db2.gz	KDDUURGTFRYALG-CXAGYDPISA-N	0	3	347.434	3.432	20	30		EGEDHN
CC1(C)CCCN(C(=O)c2ccc(CN3CCCC3)cc2)[C@H]1C#N	ZINC000277994746	455729607	/nfs/dbraw/zinc/72/96/07/455729607.db2.gz	RLWJFZQZCMAPSV-SFHVURJKSA-N	0	3	325.456	3.437	20	30		EGEDHN
N#C[C@@H]1CCC[C@@H](Nc2cccc(CN3CCC(CO)CC3)c2)C1	ZINC000193101915	455741886	/nfs/dbraw/zinc/74/18/86/455741886.db2.gz	LKCLCDDWGOFMJX-IEBWSBKVSA-N	0	3	327.472	3.385	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CCC[C@@H]1[C@@H](O)C(F)(F)F	ZINC000268960465	455745222	/nfs/dbraw/zinc/74/52/22/455745222.db2.gz	ICRXFMAEAMFNLM-HUUCEWRRSA-N	0	3	326.362	3.375	20	30		EGEDHN
C#CC[C@@H](NCCCS(=O)(=O)c1ccccc1)c1ccccc1	ZINC000271752109	455746988	/nfs/dbraw/zinc/74/69/88/455746988.db2.gz	XRSQPBVBZVVCLX-LJQANCHMSA-N	0	3	327.449	3.205	20	30		EGEDHN
CC[C@@](C)(C#N)C(=O)Nc1cccc(N2CCN(CC3CC3)CC2)c1	ZINC000285120088	455791951	/nfs/dbraw/zinc/79/19/51/455791951.db2.gz	NKWXMVHIDLQOMS-FQEVSTJZSA-N	0	3	340.471	3.097	20	30		EGEDHN
Cn1c2ccccc2nc1C(C)(C)NCCOc1cccc(C#N)c1	ZINC000186572488	455797509	/nfs/dbraw/zinc/79/75/09/455797509.db2.gz	RWMHBNWEXFRLHJ-UHFFFAOYSA-N	0	3	334.423	3.349	20	30		EGEDHN
Cc1ccc(C(=O)NCCN[C@H](C)c2ccc(C#N)c(F)c2)cc1	ZINC000271929632	455798866	/nfs/dbraw/zinc/79/88/66/455798866.db2.gz	KJMPIKROJCCVFF-CQSZACIVSA-N	0	3	325.387	3.086	20	30		EGEDHN
C[C@@H](N[C@@H](CO)Cc1c[nH]c2ccccc12)c1ccc(C#N)c(F)c1	ZINC000271929904	455799517	/nfs/dbraw/zinc/79/95/17/455799517.db2.gz	HNUDIACRUXANPN-CXAGYDPISA-N	0	3	337.398	3.433	20	30		EGEDHN
COc1cc(NC2CCN([C@@H]3CC[C@@H](C#N)C3)CC2)cc(OC)c1	ZINC000293931269	455801400	/nfs/dbraw/zinc/80/14/00/455801400.db2.gz	YWJBTWSEQFAWRK-RHSMWYFYSA-N	0	3	329.444	3.272	20	30		EGEDHN
CSc1ccc([C@H](CNC(=O)C2(C#N)CCCC2)N(C)C)cc1	ZINC000294269030	455809381	/nfs/dbraw/zinc/80/93/81/455809381.db2.gz	GHXPLSPRPMJBAL-INIZCTEOSA-N	0	3	331.485	3.211	20	30		EGEDHN
COc1ccc2c(c1)OC[C@@H](N[C@H](C)c1ccc(C#N)c(F)c1)C2	ZINC000271977224	455811086	/nfs/dbraw/zinc/81/10/86/455811086.db2.gz	VVXAIJMFWCOPBW-WBMJQRKESA-N	0	3	326.371	3.360	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)[C@]2(C#N)CC23CCCC3)N(C)C)cc1	ZINC000294652420	455822380	/nfs/dbraw/zinc/82/23/80/455822380.db2.gz	HQEKUKYYOFYTNI-FXAWDEMLSA-N	0	3	325.456	3.188	20	30		EGEDHN
Cc1ccccc1[C@H](NCC(=O)NC1(C#N)CCCCC1)C1CC1	ZINC000272021129	455823410	/nfs/dbraw/zinc/82/34/10/455823410.db2.gz	LKUSDYDZKNOQIF-LJQANCHMSA-N	0	3	325.456	3.378	20	30		EGEDHN
C=CCOc1cccc(CN2CCC[C@H](CC(C)(C)C(N)=O)C2)c1	ZINC000294775724	455827883	/nfs/dbraw/zinc/82/78/83/455827883.db2.gz	KPQMHZSOCKWIPR-QGZVFWFLSA-N	0	3	330.472	3.365	20	30		EGEDHN
CC(C)CCOC1CCN(CCC(=O)Nc2sccc2C#N)CC1	ZINC000194337029	455829546	/nfs/dbraw/zinc/82/95/46/455829546.db2.gz	JQVCJLQQXFMOER-UHFFFAOYSA-N	0	3	349.500	3.475	20	30		EGEDHN
CC[C@H](N[C@H]1CCCN(Cc2ccccn2)C1=O)c1ccc(C#N)cc1	ZINC000278367265	455830450	/nfs/dbraw/zinc/83/04/50/455830450.db2.gz	BVNBHMVSFYFCFO-PMACEKPBSA-N	0	3	348.450	3.185	20	30		EGEDHN
C=CCOc1ccc(CN(C)[C@@H](CO)c2ccccc2)cc1OC	ZINC000294996487	455834707	/nfs/dbraw/zinc/83/47/07/455834707.db2.gz	HZLFHDOMXPQXSD-SFHVURJKSA-N	0	3	327.424	3.425	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)NCC2(C)CCCC2)cc1	ZINC000278516750	455839206	/nfs/dbraw/zinc/83/92/06/455839206.db2.gz	BZXXUDWCOVVEGE-CYBMUJFWSA-N	0	3	349.456	3.074	20	30		EGEDHN
C[C@H](CC#N)Sc1ccccc1NC(=O)NCC1=CCN(C)CC1	ZINC000272097279	455845730	/nfs/dbraw/zinc/84/57/30/455845730.db2.gz	ZACHCLVDFRHTNK-CQSZACIVSA-N	0	3	344.484	3.464	20	30		EGEDHN
CC[C@H](NCc1ccccc1CS(C)(=O)=O)c1ccc(C#N)cc1	ZINC000278744911	455847629	/nfs/dbraw/zinc/84/76/29/455847629.db2.gz	NLSCYVWUPHAROI-IBGZPJMESA-N	0	3	342.464	3.344	20	30		EGEDHN
CN(CCC#N)C(=O)CCNC(C)(C)c1cccc(Cl)c1F	ZINC000186894473	455847839	/nfs/dbraw/zinc/84/78/39/455847839.db2.gz	GHQVGQNVQSGMLH-UHFFFAOYSA-N	0	3	325.815	3.066	20	30		EGEDHN
N#CCC[C@@H](NC(=O)N1CC[C@H](N2CCCCC2)C1)c1ccccc1	ZINC000269636379	455852044	/nfs/dbraw/zinc/85/20/44/455852044.db2.gz	WBMIAFBHVFTKRY-RBUKOAKNSA-N	0	3	340.471	3.301	20	30		EGEDHN
C=CCc1ccc(OC[C@@H](O)CN2CCCC3(CC3)C2)c(OC)c1	ZINC000186961833	455856468	/nfs/dbraw/zinc/85/64/68/455856468.db2.gz	SVFNQOQDXXHCOV-KRWDZBQOSA-N	0	3	331.456	3.039	20	30		EGEDHN
C=C(C)CN(Cc1ccccc1)C(=O)NC1CCN(C2CC2)CC1	ZINC000279324991	455862526	/nfs/dbraw/zinc/86/25/26/455862526.db2.gz	AGWJQAFBVQPUSA-UHFFFAOYSA-N	0	3	327.472	3.401	20	30		EGEDHN
COc1cc(CN[C@@H](c2cccs2)C(C)(C)CO)ccc1C#N	ZINC000295965700	455864620	/nfs/dbraw/zinc/86/46/20/455864620.db2.gz	IOGNTABXKAMNAB-KRWDZBQOSA-N	0	3	330.453	3.478	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)/C=C\c2ccc(OCC)cc2)CC1	ZINC000255494416	455868422	/nfs/dbraw/zinc/86/84/22/455868422.db2.gz	PMNCJAVSXIFPEJ-YFHOEESVSA-N	0	3	328.456	3.255	20	30		EGEDHN
C=CC[C@H](C)[C@@H](C)N[C@@H](C(N)=O)c1cccc(Br)c1	ZINC000279685497	455870399	/nfs/dbraw/zinc/87/03/99/455870399.db2.gz	PEPKTGCGWOCTLK-MISXGVKJSA-N	0	3	325.250	3.166	20	30		EGEDHN
COc1ccc(C)cc1[C@@H](C)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000279684087	455870599	/nfs/dbraw/zinc/87/05/99/455870599.db2.gz	HEISEZMLGFSRSM-QAPCUYQASA-N	0	3	347.418	3.435	20	30		EGEDHN
CC1(C)[C@H](NCc2ccc(C#N)cc2Br)[C@@H]2CCO[C@H]21	ZINC000296215100	455881980	/nfs/dbraw/zinc/88/19/80/455881980.db2.gz	MPIHCKQAJORQBE-NWANDNLSSA-N	0	3	335.245	3.224	20	30		EGEDHN
C[C@@H](CN[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O)c1ccccc1	ZINC000194891897	455897387	/nfs/dbraw/zinc/89/73/87/455897387.db2.gz	NLWLKNMEXQZXKE-OXJNMPFZSA-N	0	3	333.435	3.052	20	30		EGEDHN
C[C@@H](CCN[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O)c1ccccc1	ZINC000194891858	455897439	/nfs/dbraw/zinc/89/74/39/455897439.db2.gz	JPCAPQYSOJADSX-UWJYYQICSA-N	0	3	347.462	3.443	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccc(C(C)(C)C#N)cc1)N1CCC[C@H](C)C1	ZINC000280124754	455898127	/nfs/dbraw/zinc/89/81/27/455898127.db2.gz	CTCVOIOCOFTMIB-HOTGVXAUSA-N	0	3	327.472	3.338	20	30		EGEDHN
N#CCc1ccc(C(=O)NC[C@@H](c2cccs2)N2CCCC2)cc1	ZINC000270242192	455910040	/nfs/dbraw/zinc/91/00/40/455910040.db2.gz	RNVAYHZIYGAQJE-KRWDZBQOSA-N	0	3	339.464	3.381	20	30		EGEDHN
COc1cc(C#N)cc(Cl)c1OC(=O)C1CCN(C2CC2)CC1	ZINC000195303685	455942700	/nfs/dbraw/zinc/94/27/00/455942700.db2.gz	BBRNBBWCFLKYRT-UHFFFAOYSA-N	0	3	334.803	3.000	20	30		EGEDHN
C#CC[C@@H](NC(=O)NCc1cccc(CN(C)C)c1)c1ccccc1	ZINC000270384679	455944608	/nfs/dbraw/zinc/94/46/08/455944608.db2.gz	GVIWHHWMNKJDNE-HXUWFJFHSA-N	0	3	335.451	3.312	20	30		EGEDHN
CC(C)N1CCN(C2CCN(c3cc(Cl)ccc3C#N)CC2)CC1	ZINC000270500684	455969465	/nfs/dbraw/zinc/96/94/65/455969465.db2.gz	UPYSGWKAYMNIFM-UHFFFAOYSA-N	0	3	346.906	3.206	20	30		EGEDHN
Cc1ccc(CN(C)C)cc1NC(=O)[C@@H](C#N)Cc1ccc(C#N)cc1	ZINC000280506712	455985188	/nfs/dbraw/zinc/98/51/88/455985188.db2.gz	WUZYEUKWIKJABJ-LJQANCHMSA-N	0	3	346.434	3.249	20	30		EGEDHN
Cc1ccc(O[C@@H](C)CNC(=O)C(C#N)Cc2ccc(C#N)cc2)cc1	ZINC000280540003	455994954	/nfs/dbraw/zinc/99/49/54/455994954.db2.gz	SXGCMKKXGRJDTL-LPHOPBHVSA-N	0	3	347.418	3.133	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000280561749	455999085	/nfs/dbraw/zinc/99/90/85/455999085.db2.gz	FVAISIGKNCMGRQ-YOEHRIQHSA-N	0	3	337.423	3.243	20	30		EGEDHN
CC(C)(C#N)c1ccc(C(=O)N2CC[C@@H](N3CCCCC3)C2)cc1	ZINC000280635066	456019006	/nfs/dbraw/zinc/01/90/06/456019006.db2.gz	XSXYONHZRPVRKX-GOSISDBHSA-N	0	3	325.456	3.188	20	30		EGEDHN
CCC(CC)(CCO)NCc1ccc(Br)cc1C#N	ZINC000286817040	456054966	/nfs/dbraw/zinc/05/49/66/456054966.db2.gz	KACZOQJSDJWQRD-UHFFFAOYSA-N	0	3	325.250	3.352	20	30		EGEDHN
N#CCOc1ccc(CN[C@H](CCO)c2ccc(Cl)cc2)cc1	ZINC000287101135	456061344	/nfs/dbraw/zinc/06/13/44/456061344.db2.gz	XTFDAZJPEWROCA-GOSISDBHSA-N	0	3	330.815	3.456	20	30		EGEDHN
C[C@@H]1[C@H](NC(=O)c2ccc(CC#N)cc2)CCN1Cc1ccccc1	ZINC000288024694	456084317	/nfs/dbraw/zinc/08/43/17/456084317.db2.gz	CIDRITMMZUOTHU-OXQOHEQNSA-N	0	3	333.435	3.145	20	30		EGEDHN
CCCN(CCN1CCCCCC1)C(=O)c1ccccc1OCC#N	ZINC000288899807	456108987	/nfs/dbraw/zinc/10/89/87/456108987.db2.gz	IGHASCWFWONSIU-UHFFFAOYSA-N	0	3	343.471	3.317	20	30		EGEDHN
C=CCn1c(C2CC2)nnc1N(C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000289542671	456130031	/nfs/dbraw/zinc/13/00/31/456130031.db2.gz	DSULFUDAAPAOHE-SFHVURJKSA-N	0	3	337.471	3.052	20	30		EGEDHN
COc1ccsc1CN(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000289684684	456137036	/nfs/dbraw/zinc/13/70/36/456137036.db2.gz	FGDJBMICKCONSD-UHFFFAOYSA-N	0	3	329.469	3.192	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N(C)C1CCN(Cc2ccccc2)CC1	ZINC000188793985	456138879	/nfs/dbraw/zinc/13/88/79/456138879.db2.gz	QCMRRFPDFYCFEB-OAQYLSRUSA-N	0	3	344.499	3.338	20	30		EGEDHN
COc1ccc(CN[C@@]2(C)CCO[C@@H]2C2CC2)cc1OCCCC#N	ZINC000273046123	456158801	/nfs/dbraw/zinc/15/88/01/456158801.db2.gz	BNGJEMBDZZZMAT-UXHICEINSA-N	0	3	344.455	3.425	20	30		EGEDHN
C=CCN1CCC(Nc2cc(Br)ccc2[N+](=O)[O-])CC1	ZINC000301692177	456188293	/nfs/dbraw/zinc/18/82/93/456188293.db2.gz	WYJYKJHTRAIRBN-UHFFFAOYSA-N	0	3	340.221	3.420	20	30		EGEDHN
C[C@@H](C1CCN(C)CC1)N(C)C(=O)N[C@H](CCC#N)c1ccccc1	ZINC000273404286	456229207	/nfs/dbraw/zinc/22/92/07/456229207.db2.gz	HIZNWFNECUUBSM-QFBILLFUSA-N	0	3	342.487	3.403	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H]2C[C@@H](OCC)[C@@]23CCCO3)cc1OC	ZINC000273544192	456237725	/nfs/dbraw/zinc/23/77/25/456237725.db2.gz	BOHHEYLHZKKWHI-VAMGGRTRSA-N	0	3	347.455	3.076	20	30		EGEDHN
C=C(C)[C@@H](Cc1nc(-c2cccc(OCCN(C)C)c2)no1)OCC	ZINC000273871435	456247350	/nfs/dbraw/zinc/24/73/50/456247350.db2.gz	NBIIFXLKAHJQPG-QGZVFWFLSA-N	0	3	345.443	3.201	20	30		EGEDHN
CN1CCN(CCNc2ccc(C(F)(F)F)c(C#N)c2)CC1(C)C	ZINC000281580442	456269831	/nfs/dbraw/zinc/26/98/31/456269831.db2.gz	FWHCVJKQCVYDNU-UHFFFAOYSA-N	0	3	340.393	3.015	20	30		EGEDHN
Cc1ccc([C@@H](CNC(=O)NCC2CCC(C#N)CC2)N(C)C)cc1	ZINC000281610873	456275170	/nfs/dbraw/zinc/27/51/70/456275170.db2.gz	GWIVHJGDOONTLI-FAFZWHIHSA-N	0	3	342.487	3.227	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc3c(c2)CCCCC3=O)CC1	ZINC000290255561	456275633	/nfs/dbraw/zinc/27/56/33/456275633.db2.gz	NOJUEJPSZVIUPG-UHFFFAOYSA-N	0	3	340.467	3.366	20	30		EGEDHN
CCc1ccc(CN[C@H]2CCCN(c3ccc(C#N)cc3F)C2)cn1	ZINC000352763765	456285679	/nfs/dbraw/zinc/28/56/79/456285679.db2.gz	HEKOUBURRSVSAK-SFHVURJKSA-N	0	3	338.430	3.413	20	30		EGEDHN
N#Cc1c(NC(=O)c2cccc(CN3CCCC3)c2)n[nH]c1C1CC1	ZINC000290436599	456327553	/nfs/dbraw/zinc/32/75/53/456327553.db2.gz	KLNCPMIZLVMRBH-UHFFFAOYSA-N	0	3	335.411	3.007	20	30		EGEDHN
C=CCN1CC[C@H](N[C@@H](Cc2ccccc2)c2cccs2)C1=O	ZINC000337205217	456338046	/nfs/dbraw/zinc/33/80/46/456338046.db2.gz	KAQIPWXDBJCBPR-IRXDYDNUSA-N	0	3	326.465	3.408	20	30		EGEDHN
COc1ccc(CN2CC[C@@H](OC)C[C@H]2C)cc1OCCCC#N	ZINC000282307692	456471829	/nfs/dbraw/zinc/47/18/29/456471829.db2.gz	MTWNVMKZRRIFRN-NVXWUHKLSA-N	0	3	332.444	3.377	20	30		EGEDHN
Cc1ccccc1[C@H]1CCN([C@H]2CCN(c3ccc(C#N)cc3)C2=O)C1	ZINC000337696851	456487812	/nfs/dbraw/zinc/48/78/12/456487812.db2.gz	TVEKJRDYCHXVTF-RXVVDRJESA-N	0	3	345.446	3.462	20	30		EGEDHN
C=CCc1ccc(OC[C@H](O)CN2CCCC3(CCC3)C2)c(OC)c1	ZINC000348166624	456514314	/nfs/dbraw/zinc/51/43/14/456514314.db2.gz	HOYKUHASZQKXLX-GOSISDBHSA-N	0	3	345.483	3.430	20	30		EGEDHN
C[C@@H](NCc1cc(C#N)n(C)c1)[C@H](O)c1c(Cl)cccc1Cl	ZINC000276676526	456548745	/nfs/dbraw/zinc/54/87/45/456548745.db2.gz	ZRVGYZIDEXPNBR-HWPZZCPQSA-N	0	3	338.238	3.415	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H]2CCOC[C@H]2OCC)cc1Cl	ZINC000353197958	456553582	/nfs/dbraw/zinc/55/35/82/456553582.db2.gz	ZUVFTMCQRYNVPW-NVXWUHKLSA-N	0	3	325.836	3.188	20	30		EGEDHN
Cn1cc(CN[C@]2(Cc3ccc(Cl)cc3)CCOC2)cc1C#N	ZINC000282590524	456563255	/nfs/dbraw/zinc/56/32/55/456563255.db2.gz	GTKOATQCGJGDMY-SFHVURJKSA-N	0	3	329.831	3.042	20	30		EGEDHN
COc1cc(CN[C@H]2C[C@H](C)N(Cc3ccccc3)C2)ccc1C#N	ZINC000353215009	456565470	/nfs/dbraw/zinc/56/54/70/456565470.db2.gz	VQNQFBOQYJBYKF-JXFKEZNVSA-N	0	3	335.451	3.319	20	30		EGEDHN
C=CCOc1cccc(CNCc2ccccc2Cn2cncn2)c1	ZINC000337819066	456566573	/nfs/dbraw/zinc/56/65/73/456566573.db2.gz	QMTOQQNJQPECOL-UHFFFAOYSA-N	0	3	334.423	3.181	20	30		EGEDHN
CC(C)(CNCCS(=O)(=O)c1ccc(C#N)cc1)C1=CCCC1	ZINC000308765846	456573512	/nfs/dbraw/zinc/57/35/12/456573512.db2.gz	JPZHXYRLZRKVJE-UHFFFAOYSA-N	0	3	332.469	3.058	20	30		EGEDHN
C[C@H](NCCC(=O)N1CCOc2ccccc21)c1ccc(C#N)cc1	ZINC000348320247	456620898	/nfs/dbraw/zinc/62/08/98/456620898.db2.gz	NVJNHQUGMKBGGO-HNNXBMFYSA-N	0	3	335.407	3.025	20	30		EGEDHN
CS[C@@H]1CN(c2ccc(C(F)(F)F)cc2C#N)C[C@@H]1N(C)C	ZINC000340737097	456658268	/nfs/dbraw/zinc/65/82/68/456658268.db2.gz	CXBXKVVTEZUIRL-UONOGXRCSA-N	0	3	329.391	3.059	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)Nc1ccc(CCN2CCSCC2)cc1	ZINC000299406131	456683230	/nfs/dbraw/zinc/68/32/30/456683230.db2.gz	JRBWDHAHWJBDIO-MRXNPFEDSA-N	0	3	348.512	3.198	20	30		EGEDHN
CC[C@@H](N[C@@H]1CCN(c2ccc(C#N)cc2)C1=O)c1ccc(OC)cc1	ZINC000299555438	456726701	/nfs/dbraw/zinc/72/67/01/456726701.db2.gz	GIPFHZYLKSUPLZ-WOJBJXKFSA-N	0	3	349.434	3.413	20	30		EGEDHN
CCc1ccccc1NC(=O)[C@H](C)N1CCC[C@@H]1[C@H]1COCC[C@H]1O	ZINC000328691006	456738278	/nfs/dbraw/zinc/73/82/78/456738278.db2.gz	BVQMEYQVXJSPIL-RGIVZKHGSA-N	0	3	346.471	3.087	20	30		EGEDHN
COc1cccc([C@@H](CNc2ccc(Cl)c(C#N)n2)N(C)C)c1	ZINC000299625209	456747184	/nfs/dbraw/zinc/74/71/84/456747184.db2.gz	KGBMJPPRFBXNJQ-MRXNPFEDSA-N	0	3	330.819	3.330	20	30		EGEDHN
C=CCN(CCSC(C)C)[C@H](C)c1cccc(-n2cnnn2)c1	ZINC000338309483	456764464	/nfs/dbraw/zinc/76/44/64/456764464.db2.gz	VJFGQPKFRQBOEL-OAHLLOKOSA-N	0	3	331.489	3.353	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)N1CCC(F)(C#N)CC1)c1ccccc1	ZINC000343821208	456775907	/nfs/dbraw/zinc/77/59/07/456775907.db2.gz	WDCPPCZEYZVAQM-QGZVFWFLSA-N	0	3	346.450	3.107	20	30		EGEDHN
Cc1noc(C[C@H](NCCOc2ccccc2C#N)c2ccccc2)n1	ZINC000277323820	456777440	/nfs/dbraw/zinc/77/74/40/456777440.db2.gz	VGFNUVWVGASPCC-SFHVURJKSA-N	0	3	348.406	3.202	20	30		EGEDHN
Cc1ccc(CN(C)C)cc1NC(=O)Cc1c(F)cccc1C#N	ZINC000353584699	456782405	/nfs/dbraw/zinc/78/24/05/456782405.db2.gz	JZYOLLNBGOOMIG-UHFFFAOYSA-N	0	3	325.387	3.249	20	30		EGEDHN
C[C@H]1CCCCN1CCNC(=O)Cc1cc(F)cc2c1OCOC2	ZINC000328940089	456796602	/nfs/dbraw/zinc/79/66/02/456796602.db2.gz	DXYZTFZVSIKTNJ-ZDUSSCGKSA-N	0	3	336.407	3.066	20	30		EGEDHN
Cc1ccnc2ccc(C(=O)C(C#N)c3nnc4n3CCCCC4)cc12	ZINC000353635456	456818997	/nfs/dbraw/zinc/81/89/97/456818997.db2.gz	ALIHVJRVFUZGAF-MRXNPFEDSA-N	0	3	345.406	3.351	20	30		EGEDHN
C[C@@H]1CC[C@H](C)N1CC(=O)N1CCC[C@@H](C(=O)Nc2ccccc2)C1	ZINC000329070460	456827029	/nfs/dbraw/zinc/82/70/29/456827029.db2.gz	YNQMYWJLUVUTKR-IXDOHACOSA-N	0	3	343.471	3.386	20	30		EGEDHN
CC(C#N)C(=O)N1CCC[C@@H]1c1cc(F)cc(Br)c1	ZINC000345004794	456893785	/nfs/dbraw/zinc/89/37/85/456893785.db2.gz	QXSFTFFCIWGJNL-TVQRCGJNSA-N	0	3	325.181	3.411	20	30		EGEDHN
C[C@H]1Oc2ccccc2OC1C(=O)Nc1cc(C#N)c2ccccc2n1	ZINC000345015069	456898090	/nfs/dbraw/zinc/89/80/90/456898090.db2.gz	HAZLREJMLRHSNT-BLVKFPJESA-N	0	3	345.358	3.273	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2cc(C3CC3)n(C)n2)C1	ZINC000329615000	456915498	/nfs/dbraw/zinc/91/54/98/456915498.db2.gz	PJMQSUFWYPDWDB-PBHICJAKSA-N	0	3	338.455	3.438	20	30		EGEDHN
CCc1nccn1[C@H]1CCCN(C([O-])=[NH+]CC2CCSCC2)C1	ZINC000329656555	456922118	/nfs/dbraw/zinc/92/21/18/456922118.db2.gz	GIEPGHAKWOMTEJ-HNNXBMFYSA-N	0	3	336.505	3.140	20	30		EGEDHN
O=C(NCC1CCN(c2ccncc2)CC1)NC[C@H]1CCCCS1	ZINC000329754561	456935902	/nfs/dbraw/zinc/93/59/02/456935902.db2.gz	KWDBZRHJRDNGDL-QGZVFWFLSA-N	0	3	348.516	3.087	20	30		EGEDHN
CC1(C)CN(CCC(=O)Nc2cccc(C#N)c2)[C@@H]1[C@@H]1CCCO1	ZINC000329791276	456940867	/nfs/dbraw/zinc/94/08/67/456940867.db2.gz	UKKDZUXHRKHUJE-FUHWJXTLSA-N	0	3	327.428	3.426	20	30		EGEDHN
CC1(C)CN(CCC(=O)Nc2cccc(C#N)c2)[C@H]1[C@@H]1CCCO1	ZINC000329791280	456941121	/nfs/dbraw/zinc/94/11/21/456941121.db2.gz	UKKDZUXHRKHUJE-WMZOPIPTSA-N	0	3	327.428	3.426	20	30		EGEDHN
C[C@H]1Oc2c(cccc2C(=O)NCCN2CCCC(C)(C)C2)NC1=O	ZINC000329890694	456956399	/nfs/dbraw/zinc/95/63/99/456956399.db2.gz	GRBUGNHEPNJACP-CYBMUJFWSA-N	0	3	345.443	3.482	20	30		EGEDHN
CC1(C)CCCN(CCNC(=O)c2cc(-c3ccncc3)on2)C1	ZINC000329913551	456960230	/nfs/dbraw/zinc/96/02/30/456960230.db2.gz	XLKVTQPUUYLXRT-UHFFFAOYSA-N	0	3	328.416	3.163	20	30		EGEDHN
CCN1CCC[C@H](NC(=O)N[C@@H]2CCCO[C@H]2c2ccc(C)cc2)C1	ZINC000329966530	456968326	/nfs/dbraw/zinc/96/83/26/456968326.db2.gz	UZVZUBUCBLYFDK-OTWHNJEPSA-N	0	3	345.487	3.203	20	30		EGEDHN
Cn1cc(C(F)(F)F)nc1[C@@H]1CCCN([C@H]2CC[C@@H](C#N)C2)C1	ZINC000339174045	456977185	/nfs/dbraw/zinc/97/71/85/456977185.db2.gz	ISJKWAZUODYJMS-UPJWGTAASA-N	0	3	326.366	3.311	20	30		EGEDHN
Cn1cc(C(F)(F)F)nc1[C@@H]1CCCN([C@@H]2CC[C@@H](C#N)C2)C1	ZINC000339174043	456977525	/nfs/dbraw/zinc/97/75/25/456977525.db2.gz	ISJKWAZUODYJMS-JHJVBQTASA-N	0	3	326.366	3.311	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1)OCC	ZINC000339203948	456991316	/nfs/dbraw/zinc/99/13/16/456991316.db2.gz	NODXLAXMZCZNRR-UHOSZYNNSA-N	0	3	330.472	3.309	20	30		EGEDHN
CCN1CCN([C@@H](C)CNC(=O)c2coc(C3CCCCC3)n2)CC1	ZINC000330178345	456996734	/nfs/dbraw/zinc/99/67/34/456996734.db2.gz	LNCGYHDSESALRV-HNNXBMFYSA-N	0	3	348.491	3.053	20	30		EGEDHN
C=C[C@H](C)NC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1	ZINC000362613620	457005369	/nfs/dbraw/zinc/00/53/69/457005369.db2.gz	KUEPBJSTPFNGFF-XJKSGUPXSA-N	0	3	326.362	3.132	20	30		EGEDHN
C[C@@H]1C[C@H]1N1CCN(C(=O)c2ccc(C(C)(C)C#N)cc2)C[C@@H](C)C1	ZINC000346163875	457021613	/nfs/dbraw/zinc/02/16/13/457021613.db2.gz	DCVQUGUBFPKPKZ-FRQCXROJSA-N	0	3	339.483	3.290	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)[C@@H]2CCCN2C2CCCC2)cc1	ZINC000359064638	457049438	/nfs/dbraw/zinc/04/94/38/457049438.db2.gz	WHKGAJBXBKMONA-IBGZPJMESA-N	0	3	328.456	3.275	20	30		EGEDHN
C=CCOc1ccc(CN2CCN(C3CCCC3)CC2)cc1OC	ZINC000349802546	457057282	/nfs/dbraw/zinc/05/72/82/457057282.db2.gz	SXPZJSIZNHFLOL-UHFFFAOYSA-N	0	3	330.472	3.320	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1)OCC	ZINC000339383560	457081927	/nfs/dbraw/zinc/08/19/27/457081927.db2.gz	WEZMQJIJXMZKMB-VQTJNVASSA-N	0	3	344.499	3.481	20	30		EGEDHN
CC[C@H](C)N[C@@H](CNC(=O)c1ccc(CC#N)cc1)c1ccco1	ZINC000359536415	457092374	/nfs/dbraw/zinc/09/23/74/457092374.db2.gz	DYDJYZIQXMNUHI-YOEHRIQHSA-N	0	3	325.412	3.205	20	30		EGEDHN
COCC(C)(C)NC(=O)NC[C@@H]1CCCN(C)[C@H]1c1cccs1	ZINC000330935748	457106579	/nfs/dbraw/zinc/10/65/79/457106579.db2.gz	OTBPQYHEZCIRED-DZGCQCFKSA-N	0	3	339.505	3.060	20	30		EGEDHN
CC(C)C[C@H](C)n1nccc1NC(=O)N[C@@H](C)C1=CCN(C)CC1	ZINC000331132135	457135765	/nfs/dbraw/zinc/13/57/65/457135765.db2.gz	QMMQDEKQBMUHDU-GJZGRUSLSA-N	0	3	333.480	3.467	20	30		EGEDHN
C[C@H](CC1CCOCC1)CN1CCN(Cc2ccc(C#N)cc2)CC1	ZINC000350011590	457142677	/nfs/dbraw/zinc/14/26/77/457142677.db2.gz	MCHXQABCXJOKPQ-GOSISDBHSA-N	0	3	341.499	3.129	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CCC(O[C@H]2CCOC2)CC1	ZINC000362950660	457171112	/nfs/dbraw/zinc/17/11/12/457171112.db2.gz	GHZUXVQPSQXUSZ-SFHVURJKSA-N	0	3	328.456	3.258	20	30		EGEDHN
CC1CCN([C@@H](CNC(=O)NCC(C)(C)C#N)c2ccccc2)CC1	ZINC000351765176	457317000	/nfs/dbraw/zinc/31/70/00/457317000.db2.gz	SRADUOMARZCCKW-SFHVURJKSA-N	0	3	342.487	3.309	20	30		EGEDHN
COc1ccc(CN2CCCN3c4ccccc4C[C@H]3C2)cc1C#N	ZINC000352006875	457328986	/nfs/dbraw/zinc/32/89/86/457328986.db2.gz	KLZDAZOGSWRESJ-IBGZPJMESA-N	0	3	333.435	3.204	20	30		EGEDHN
CO[C@]1(C)CCCN([C@H](C)C(=O)N(CCC#N)c2ccccc2)CC1	ZINC000332350509	457353379	/nfs/dbraw/zinc/35/33/79/457353379.db2.gz	URPXOTHSWFHZPC-YLJYHZDGSA-N	0	3	343.471	3.213	20	30		EGEDHN
CSC1(CNC(=O)C[C@H](CC#N)c2ccccc2)CCN(C)CC1	ZINC000355447257	457374175	/nfs/dbraw/zinc/37/41/75/457374175.db2.gz	SCGOQZDSYPOTLT-KRWDZBQOSA-N	0	3	345.512	3.018	20	30		EGEDHN
N#CCc1ccc(CN2CCC(NC(=O)c3ccccc3)CC2)cc1	ZINC000342706208	457469518	/nfs/dbraw/zinc/46/95/18/457469518.db2.gz	MGPGXTHGMZKJDU-UHFFFAOYSA-N	0	3	333.435	3.147	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C1(C#N)CCCC1	ZINC000398171764	457496433	/nfs/dbraw/zinc/49/64/33/457496433.db2.gz	PAGFWIDHMUXMCJ-SJLPKXTDSA-N	0	3	325.456	3.097	20	30		EGEDHN
C=CCN(CCC(=O)Nc1cccc(OC)c1)CCc1ccco1	ZINC000352700909	457541135	/nfs/dbraw/zinc/54/11/35/457541135.db2.gz	BPRYFMCWMCXRGV-UHFFFAOYSA-N	0	3	328.412	3.348	20	30		EGEDHN
CCN1CCCC[C@@H]1CNC(=O)N(C)[C@H](C)c1cccc(C#N)c1	ZINC000425449056	457557117	/nfs/dbraw/zinc/55/71/17/457557117.db2.gz	WHYNZWHWUQOFMG-CRAIPNDOSA-N	0	3	328.460	3.135	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N(C)C[C@@H](O)COc1ccccc1F	ZINC000425544352	457592959	/nfs/dbraw/zinc/59/29/59/457592959.db2.gz	SKPAZSUIIRPBIC-WMLDXEAASA-N	0	3	328.387	3.130	20	30		EGEDHN
N#Cc1ccc(CN(CCO)[C@@H]2CCCSC2)c(C(F)(F)F)c1	ZINC000356398101	457605103	/nfs/dbraw/zinc/60/51/03/457605103.db2.gz	QXYKRNFSPYXZKY-CQSZACIVSA-N	0	3	344.402	3.267	20	30		EGEDHN
Cn1c2ccccc2nc1CCN1CCC(C#N)(c2ccccn2)CC1	ZINC000370294575	457611353	/nfs/dbraw/zinc/61/13/53/457611353.db2.gz	QKTIIMZRAZWCCS-UHFFFAOYSA-N	0	3	345.450	3.068	20	30		EGEDHN
C=CCN1CC[C@@H](N(CCc2ccc(F)cc2)C2CCCC2)C1=O	ZINC000410339365	457638033	/nfs/dbraw/zinc/63/80/33/457638033.db2.gz	RZVPMBDTNCMYAZ-LJQANCHMSA-N	0	3	330.447	3.400	20	30		EGEDHN
C=CCN1CC[C@H](N(CCc2cccc(F)c2)C2CCCC2)C1=O	ZINC000410407259	457640052	/nfs/dbraw/zinc/64/00/52/457640052.db2.gz	KCLBZJDNQLEKPH-IBGZPJMESA-N	0	3	330.447	3.400	20	30		EGEDHN
COc1cccc(CN(CCN(C)C)c2ccc(Cl)c(C#N)n2)c1	ZINC000357678108	457652282	/nfs/dbraw/zinc/65/22/82/457652282.db2.gz	ZCRMSDIXPJDHFF-UHFFFAOYSA-N	0	3	344.846	3.183	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)c1ccc(OC(F)F)cn1	ZINC000357776670	457685762	/nfs/dbraw/zinc/68/57/62/457685762.db2.gz	AWKWXZPCBPKCDA-LLVKDONJSA-N	0	3	342.305	3.060	20	30		EGEDHN
Cc1ccc2c(c1)[C@H]1CN(C)CC[C@H]1N2C(=O)c1sccc1C#N	ZINC000365080751	457726522	/nfs/dbraw/zinc/72/65/22/457726522.db2.gz	BOPJRMOXSHRQJW-NVXWUHKLSA-N	0	3	337.448	3.376	20	30		EGEDHN
C[C@H](O)[C@H]1C[C@H](C)CCN1CC#Cc1ccc(OC(F)(F)F)cc1	ZINC000443346024	457753143	/nfs/dbraw/zinc/75/31/43/457753143.db2.gz	LYKYXVSNXBHLBW-JKIFEVAISA-N	0	3	341.373	3.418	20	30		EGEDHN
CC(=O)Nc1cccc(CNC(=O)C(C#N)CCc2ccccc2)c1	ZINC000433223535	457783777	/nfs/dbraw/zinc/78/37/77/457783777.db2.gz	QBIAOTAGRDMKIE-SFHVURJKSA-N	0	3	335.407	3.034	20	30		EGEDHN
Cc1cccc2nc(CNC(=O)C(C#N)CCc3ccccc3)n(C)c21	ZINC000433370443	457822552	/nfs/dbraw/zinc/82/25/52/457822552.db2.gz	GNIZFSNEJVEWLY-KRWDZBQOSA-N	0	3	346.434	3.271	20	30		EGEDHN
N#Cc1c(C#N)c(N2CC[C@H](N3CCCC3)C2)nc2c1CCCCCC2	ZINC000366496708	457830192	/nfs/dbraw/zinc/83/01/92/457830192.db2.gz	YMQRQAJREHLJOF-INIZCTEOSA-N	0	3	349.482	3.158	20	30		EGEDHN
CN1CC[C@@]2(CCN(C(=O)Nc3ccc(C(C)(C)C#N)cc3)C2)C1	ZINC000366632434	457873735	/nfs/dbraw/zinc/87/37/35/457873735.db2.gz	SOABPOHPPDSYGJ-LJQANCHMSA-N	0	3	326.444	3.047	20	30		EGEDHN
N#CC1(CCN2CC[C@H]3[C@H](CCC(=O)N3C3CC3)C2)CCCCC1	ZINC000411398480	457875632	/nfs/dbraw/zinc/87/56/32/457875632.db2.gz	OSTGPRUXBFSPND-AEFFLSMTSA-N	0	3	329.488	3.326	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H]2C[C@H](c3cc(F)cc(F)c3)C2)CC1	ZINC000366723232	457892530	/nfs/dbraw/zinc/89/25/30/457892530.db2.gz	LQPCKBXDNNOEQO-PPUGGXLSSA-N	0	3	349.425	3.160	20	30		EGEDHN
CCCN1CCC[C@@H]1CNC(=O)N(Cc1ccc(C#N)cc1)C1CC1	ZINC000358270773	457901660	/nfs/dbraw/zinc/90/16/60/457901660.db2.gz	FRTKDRPHXSVQGA-LJQANCHMSA-N	0	3	340.471	3.107	20	30		EGEDHN
C=CCN(C)CCN(CC)[C@@H](C)C(=O)Nc1ccc(SC)cc1	ZINC000411634702	457934808	/nfs/dbraw/zinc/93/48/08/457934808.db2.gz	APEZINOTVWOJCF-HNNXBMFYSA-N	0	3	335.517	3.175	20	30		EGEDHN
C=CC[C@H]1N(CC(=O)NCc2cccc(C#N)c2)CCCC1(C)C	ZINC000444786095	457976794	/nfs/dbraw/zinc/97/67/94/457976794.db2.gz	MZYABYHTFWOOTF-GOSISDBHSA-N	0	3	325.456	3.241	20	30		EGEDHN
CN(CCN1CCOC(C)(C)C1)Cc1ccccc1C(C)(C)C#N	ZINC000434696223	458038314	/nfs/dbraw/zinc/03/83/14/458038314.db2.gz	CYPZOMNQTCTBMQ-UHFFFAOYSA-N	0	3	329.488	3.030	20	30		EGEDHN
N#Cc1ccc(OC2CCN(C[C@H](O)c3ccccc3)CC2)c(F)c1	ZINC000375745388	458045685	/nfs/dbraw/zinc/04/56/85/458045685.db2.gz	VATWKNWHEYBROF-IBGZPJMESA-N	0	3	340.398	3.274	20	30		EGEDHN
C[C@H](C(=O)N(C)CCC#N)N1CC[C@](C)(CCc2ccccc2)C1	ZINC000434904796	458064627	/nfs/dbraw/zinc/06/46/27/458064627.db2.gz	GWGXTHKXSBFWCZ-XLIONFOSSA-N	0	3	327.472	3.092	20	30		EGEDHN
C=CCC1(NC(=O)NC[C@@]2(N(C)C)CCSC2)CCCCC1	ZINC000458503629	458073109	/nfs/dbraw/zinc/07/31/09/458073109.db2.gz	KITBYIPVVCLVOY-KRWDZBQOSA-N	0	3	325.522	3.002	20	30		EGEDHN
CC(C)C[C@H](CN[C@H](C)c1ccc(C#N)cc1F)N1CCOCC1	ZINC000358582906	458091149	/nfs/dbraw/zinc/09/11/49/458091149.db2.gz	FSUBIDGGHRGVCT-NVXWUHKLSA-N	0	3	333.451	3.095	20	30		EGEDHN
Cc1ccc([O-])c([C@@H](C)[NH2+]C2CCN(c3ccc(C#N)cn3)CC2)c1	ZINC000371877501	458105334	/nfs/dbraw/zinc/10/53/34/458105334.db2.gz	WRFQPRRDGOXBHD-OAHLLOKOSA-N	0	3	336.439	3.287	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Cc1cccc(F)c1F)C(C)C	ZINC000446114455	458150174	/nfs/dbraw/zinc/15/01/74/458150174.db2.gz	RXICPHGKQTWGFU-KRWDZBQOSA-N	0	3	336.426	3.322	20	30		EGEDHN
CC[C@@H]1CCCCN1CCNC(=O)[C@H](C#N)CCc1ccccc1	ZINC000435928223	458226155	/nfs/dbraw/zinc/22/61/55/458226155.db2.gz	OVDURZDKTIMNEJ-RBUKOAKNSA-N	0	3	327.472	3.140	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2cnccc2C(C)(C)C)CC1	ZINC000413230848	458295067	/nfs/dbraw/zinc/29/50/67/458295067.db2.gz	FFWJCRURDJABJI-UHFFFAOYSA-N	0	3	344.503	3.219	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cn(C)nc1C1CCC1)C(C)C	ZINC000413445944	458300929	/nfs/dbraw/zinc/30/09/29/458300929.db2.gz	UBZLGSKDBMPHQU-SFHVURJKSA-N	0	3	344.503	3.116	20	30		EGEDHN
C=CCCC[C@H](C)NC(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000369644834	458301632	/nfs/dbraw/zinc/30/16/32/458301632.db2.gz	APXOQTCNIMCMMU-WDSOQIARSA-N	0	3	344.503	3.461	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NC(=O)N1CCCC12CCN(C)CC2	ZINC000413841776	458310741	/nfs/dbraw/zinc/31/07/41/458310741.db2.gz	XCXYJNHPQLXTOY-LJQANCHMSA-N	0	3	341.499	3.444	20	30		EGEDHN
CC[C@H](NCC(C)(C)CC#N)c1ccccc1OCC(=O)N(C)C	ZINC000414162195	458315857	/nfs/dbraw/zinc/31/58/57/458315857.db2.gz	GRYLGEKSXXLLSC-INIZCTEOSA-N	0	3	331.460	3.134	20	30		EGEDHN
C=CCOc1cccc(NC(=O)NC[C@H]2NCCc3ccccc32)c1	ZINC000415011708	458326473	/nfs/dbraw/zinc/32/64/73/458326473.db2.gz	HYIKDRWILZTVRC-LJQANCHMSA-N	0	3	337.423	3.260	20	30		EGEDHN
C=CCC(C)(C)CN[C@H](C(N)=O)c1ccc(Br)cc1	ZINC000419183883	458379446	/nfs/dbraw/zinc/37/94/46/458379446.db2.gz	MZEUBVLXYQTWDG-ZDUSSCGKSA-N	0	3	325.250	3.167	20	30		EGEDHN
CC1(C)[C@@H](CN[C@H](C(N)=O)c2ccc(C#N)cc2)[C@@H]1c1ccccc1	ZINC000419296633	458380036	/nfs/dbraw/zinc/38/00/36/458380036.db2.gz	DROKECDGIQVYRF-FHWLQOOXSA-N	0	3	333.435	3.114	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCc1ccc(OC)c(OCCCC#N)c1	ZINC000449549137	458426663	/nfs/dbraw/zinc/42/66/63/458426663.db2.gz	VCKTWZRBHAQKFT-SJORKVTESA-N	0	3	330.428	3.201	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCc1ccc(OC(F)F)c(Br)c1	ZINC000449516695	458426699	/nfs/dbraw/zinc/42/66/99/458426699.db2.gz	BTDSMQJRNJKJDS-NEPJUHHUSA-N	0	3	348.187	3.484	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)Nc1ccc2c(c1)CNCC2	ZINC000422832356	458428932	/nfs/dbraw/zinc/42/89/32/458428932.db2.gz	FVWWGJLPTNTVRX-UHFFFAOYSA-N	0	3	338.407	3.158	20	30		EGEDHN
C=CCC1(C(=O)NCc2cccc(OCCN(C)C)c2)CCCC1	ZINC000449811647	458432236	/nfs/dbraw/zinc/43/22/36/458432236.db2.gz	RTTNAZDTWAUYDX-UHFFFAOYSA-N	0	3	330.472	3.380	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)CN(C)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000459669806	458442191	/nfs/dbraw/zinc/44/21/91/458442191.db2.gz	DXDPWCZQEKBMLY-NSHGMRRFSA-N	0	3	327.472	3.309	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)CN1[C@H](C)C[C@H](c2ccccc2)[C@@H]1C	ZINC000451184169	458469560	/nfs/dbraw/zinc/46/95/60/458469560.db2.gz	LLMVOWWRGMYOGF-JMVFIXPQSA-N	0	3	327.472	3.307	20	30		EGEDHN
CO[C@@H]1C[C@H](N[C@@H](C)C(=O)Nc2ccc(C#N)c(Cl)c2)C12CCC2	ZINC000459766873	458472699	/nfs/dbraw/zinc/47/26/99/458472699.db2.gz	PYIXMRVJKWNFMA-KNXALSJPSA-N	0	3	347.846	3.086	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2[C@H]3CCO[C@H]3C23CCC3)c(OC(F)F)c1	ZINC000451506680	458479461	/nfs/dbraw/zinc/47/94/61/458479461.db2.gz	UZRLXFGCAUHZRX-FVQBIDKESA-N	0	3	334.366	3.207	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCc1c2ccccc2oc1C(=O)OCC	ZINC000451678133	458485636	/nfs/dbraw/zinc/48/56/36/458485636.db2.gz	VZKWDQNEELMIMN-CVEARBPZSA-N	0	3	329.396	3.433	20	30		EGEDHN
C=CCC[C@@H](CO)N[C@H](C)c1ccccc1I	ZINC000453346458	458524741	/nfs/dbraw/zinc/52/47/41/458524741.db2.gz	IDSDZBFOXOIPIH-NEPJUHHUSA-N	0	3	345.224	3.269	20	30		EGEDHN
CCO[C@@H]1CCCC[C@H]1N[C@@H](C)C(=O)N(CCC#N)c1ccccc1	ZINC000452037405	458494362	/nfs/dbraw/zinc/49/43/62/458494362.db2.gz	ULQWLSQMQSHDMU-QXAKKESOSA-N	0	3	343.471	3.259	20	30		EGEDHN
C=CCCCC(=O)NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000453004020	458516588	/nfs/dbraw/zinc/51/65/88/458516588.db2.gz	FSGFSVWBLUDZQW-UHFFFAOYSA-N	0	3	343.471	3.082	20	30		EGEDHN
C=C(C)Cn1c(-c2sccc2C)nnc1N1CCCN(CC)CC1	ZINC000460580513	458526000	/nfs/dbraw/zinc/52/60/00/458526000.db2.gz	WSMMDPMMKURVMT-UHFFFAOYSA-N	0	3	345.516	3.423	20	30		EGEDHN
C=C(CC)CN[C@H](C)c1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000453377019	458526393	/nfs/dbraw/zinc/52/63/93/458526393.db2.gz	VADHWSFZUVVBIC-MRXNPFEDSA-N	0	3	336.501	3.478	20	30		EGEDHN
C=CCn1c(-c2ccc(C)s2)nnc1N1CCCN(C(C)C)CC1	ZINC000453444731	458530677	/nfs/dbraw/zinc/53/06/77/458530677.db2.gz	NLICQYCQQDATOK-UHFFFAOYSA-N	0	3	345.516	3.422	20	30		EGEDHN
COc1ccc(C)cc1-c1csc(NC(=O)[C@@H](N)CCCC#N)n1	ZINC000424064429	458549225	/nfs/dbraw/zinc/54/92/25/458549225.db2.gz	KCVBKRIBZOGAML-ZDUSSCGKSA-N	0	3	344.440	3.087	20	30		EGEDHN
CCOc1ccc(-c2csc(NC(=O)[C@@H](N)CCCC#N)n2)cc1	ZINC000424098395	458558274	/nfs/dbraw/zinc/55/82/74/458558274.db2.gz	KUJAYQTZIHWMML-AWEZNQCLSA-N	0	3	344.440	3.168	20	30		EGEDHN
CC(C)Cc1ccc([C@H](NC(=O)[C@H](N)CCCC#N)C2CC2)cc1	ZINC000424109736	458560807	/nfs/dbraw/zinc/56/08/07/458560807.db2.gz	BDQPDOVJSMCJGG-MOPGFXCFSA-N	0	3	327.472	3.474	20	30		EGEDHN
Cc1ccsc1[C@@H](Cc1ccccc1)NC(=O)[C@H](N)CCCC#N	ZINC000424123780	458564117	/nfs/dbraw/zinc/56/41/17/458564117.db2.gz	LINRDMXCZRKQLS-IAGOWNOFSA-N	0	3	341.480	3.478	20	30		EGEDHN
COc1ccc(-c2ccc(CNC(=O)[C@@H](N)CCCC#N)s2)cc1	ZINC000424123730	458564340	/nfs/dbraw/zinc/56/43/40/458564340.db2.gz	NCGPQMOFQUWHQO-INIZCTEOSA-N	0	3	343.452	3.061	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC2(C(F)F)CCCCC2)CC1	ZINC000493814827	458575730	/nfs/dbraw/zinc/57/57/30/458575730.db2.gz	WYXYBFQWLJNILO-UHFFFAOYSA-N	0	3	329.435	3.294	20	30		EGEDHN
CN(Cc1ccccc1)C1(CNC(=O)NCC2(CC#N)CC2)CCC1	ZINC000454893441	458578869	/nfs/dbraw/zinc/57/88/69/458578869.db2.gz	VNPTXLRWOKUVAF-UHFFFAOYSA-N	0	3	340.471	3.034	20	30		EGEDHN
COc1ccc(CN[C@@H]2CC[C@H](C#N)C2)c(OCc2cccnc2)c1	ZINC000424209050	458584619	/nfs/dbraw/zinc/58/46/19/458584619.db2.gz	YXBCSOWALRNUNT-MAUKXSAKSA-N	0	3	337.423	3.451	20	30		EGEDHN
CC[C@@H](CN(CC)[C@@H](C)C(=O)NC1(C#N)CCC1)c1ccccc1	ZINC000469790539	458592177	/nfs/dbraw/zinc/59/21/77/458592177.db2.gz	KKVNUEYKGABZIS-IRXDYDNUSA-N	0	3	327.472	3.453	20	30		EGEDHN
C=CC(C)(C)CNC(=O)NC[C@@H](c1ccc(OC)cc1)N1CCCC1	ZINC000455370459	458595339	/nfs/dbraw/zinc/59/53/39/458595339.db2.gz	RFZGQOXEBOFUCL-SFHVURJKSA-N	0	3	345.487	3.344	20	30		EGEDHN
C[C@H]1C[C@@H](CNC(=O)OC(C)(C)C)CN1Cc1ccc(C#N)cc1	ZINC000493915074	458599477	/nfs/dbraw/zinc/59/94/77/458599477.db2.gz	RKLQVSWZYWXADD-YOEHRIQHSA-N	0	3	329.444	3.293	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)CCN1C	ZINC000438627416	458607714	/nfs/dbraw/zinc/60/77/14/458607714.db2.gz	AQCHEKDEEVADPY-ZWNOBZJWSA-N	0	3	340.349	3.181	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCCc2ccccc2Cl)cc1	ZINC000470868098	458657277	/nfs/dbraw/zinc/65/72/77/458657277.db2.gz	HYWIIVUEKQCXII-KRWDZBQOSA-N	0	3	337.810	3.253	20	30		EGEDHN
CN(C)CCOc1ccccc1-c1noc(-c2ccc(C#N)s2)n1	ZINC000547102111	458698701	/nfs/dbraw/zinc/69/87/01/458698701.db2.gz	CELQJRYVLIDOCY-UHFFFAOYSA-N	0	3	340.408	3.277	20	30		EGEDHN
Cc1cc(C)cc(N(CCC#N)C(=O)[C@H](C)N[C@@H]2CSC[C@@H]2C)c1	ZINC000507252141	458753884	/nfs/dbraw/zinc/75/38/84/458753884.db2.gz	LTAFDEVUAZDGHA-XYJFISCASA-N	0	3	345.512	3.280	20	30		EGEDHN
CC(C)CN(C(=O)[C@@H](C)c1cccc(C#N)c1)C1CCN(C)CC1	ZINC000464538666	458759148	/nfs/dbraw/zinc/75/91/48/458759148.db2.gz	PZZYCKCEIWTGMP-INIZCTEOSA-N	0	3	327.472	3.241	20	30		EGEDHN
C=CCSCCNC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C	ZINC000509172230	458769897	/nfs/dbraw/zinc/76/98/97/458769897.db2.gz	OXWSJMUFVNFYTN-QGZVFWFLSA-N	0	3	347.528	3.212	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NC[C@@H](CO)C1CCCCC1	ZINC000509887820	458773812	/nfs/dbraw/zinc/77/38/12/458773812.db2.gz	ZCTYBZPXZDRVSQ-MOPGFXCFSA-N	0	3	328.456	3.064	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NC[C@@H]1CCOC2(CCC2)C1	ZINC000515464482	458809835	/nfs/dbraw/zinc/80/98/35/458809835.db2.gz	KVROVZSJGHCZID-MSOLQXFVSA-N	0	3	326.440	3.224	20	30		EGEDHN
CC(C)CC[C@@H]1CCCCN1CC(=O)NCc1ccc(C#N)cc1	ZINC000472827371	458809900	/nfs/dbraw/zinc/80/99/00/458809900.db2.gz	OLSJQWSQPNCCTL-IBGZPJMESA-N	0	3	327.472	3.465	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(CC#N)cc2)CC[C@@H]1NC(=O)OC(C)(C)C	ZINC000495291316	458828113	/nfs/dbraw/zinc/82/81/13/458828113.db2.gz	HAILJXFLJRQMGY-QAPCUYQASA-N	0	3	343.471	3.488	20	30		EGEDHN
CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@H]1CCN(C)[C@H](C)C1	ZINC000466032512	458872963	/nfs/dbraw/zinc/87/29/63/458872963.db2.gz	ISPFVFCYGOBWHR-APWZRJJASA-N	0	3	342.487	3.209	20	30		EGEDHN
C=C(C)Cn1c(CC2CC2)nnc1N1CCN(C2CCCCC2)CC1	ZINC000549639143	458881939	/nfs/dbraw/zinc/88/19/39/458881939.db2.gz	HBEITDQHIPUKNJ-UHFFFAOYSA-N	0	3	343.519	3.261	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C2(Oc3ccc(Cl)cc3)CC2)CC1	ZINC000550707658	458886497	/nfs/dbraw/zinc/88/64/97/458886497.db2.gz	VUFQKNMOPKLQSI-UHFFFAOYSA-N	0	3	348.874	3.408	20	30		EGEDHN
C=C(C)Cn1c(N2CC[C@H](N3CCCCC3)C2)nnc1C(C)(C)C	ZINC000555269517	458904930	/nfs/dbraw/zinc/90/49/30/458904930.db2.gz	PDVLWMZBJNSGIE-INIZCTEOSA-N	0	3	331.508	3.216	20	30		EGEDHN
CN(CCC#N)C(=O)CCN1CCC(=Cc2cccc(F)c2)CC1	ZINC000555879194	458916545	/nfs/dbraw/zinc/91/65/45/458916545.db2.gz	WGFNQLIAVDCLBZ-UHFFFAOYSA-N	0	3	329.419	3.067	20	30		EGEDHN
C[C@H](NC[C@H]1CN(C)C(=O)O1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000495726434	458932107	/nfs/dbraw/zinc/93/21/07/458932107.db2.gz	HFADSHGBQPSJCM-LIRRHRJNSA-N	0	3	335.407	3.326	20	30		EGEDHN
CC(C)(CC#N)CNC(=O)NC[C@@H](c1ccccc1)N1CCCC1	ZINC000457369591	458933823	/nfs/dbraw/zinc/93/38/23/458933823.db2.gz	CENNIXGSNMNJHR-KRWDZBQOSA-N	0	3	328.460	3.063	20	30		EGEDHN
CC1CC(C#N)(C(=O)N(C)[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)C1	ZINC000531569175	458937596	/nfs/dbraw/zinc/93/75/96/458937596.db2.gz	UOVSDVFVADWABF-JTEYQQGYSA-N	0	3	339.483	3.438	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)N(C)CC(C)(C)C#N)c1ccccc1	ZINC000457466310	458966892	/nfs/dbraw/zinc/96/68/92/458966892.db2.gz	XMKIVMIJGWCMIU-KRWDZBQOSA-N	0	3	330.476	3.261	20	30		EGEDHN
C=C(CC)CNC(=O)NC[C@@H](c1cccc(OC)c1)N1CCCC1	ZINC000457483180	458973823	/nfs/dbraw/zinc/97/38/23/458973823.db2.gz	LWRNCDTYBGUEEI-SFHVURJKSA-N	0	3	331.460	3.098	20	30		EGEDHN
CO[C@@H](Cc1ccccc1)CN1CCC(C#N)(c2ccccn2)CC1	ZINC000519625231	458976480	/nfs/dbraw/zinc/97/64/80/458976480.db2.gz	OZJGEKHUWHWZQK-IBGZPJMESA-N	0	3	335.451	3.196	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](O)Cc2ccccc2C(F)(F)F)s1	ZINC000566674036	458980320	/nfs/dbraw/zinc/98/03/20/458980320.db2.gz	NKAALYBSKGIZDE-LBPRGKRZSA-N	0	3	340.370	3.332	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cnc2ccccc2n1)C(C)C	ZINC000495917126	459005154	/nfs/dbraw/zinc/00/51/54/459005154.db2.gz	GOSOESNYCSSUPN-LJQANCHMSA-N	0	3	338.455	3.058	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1CCC[C@H](Cc2ccc(C)cc2)C1	ZINC000566991950	459032285	/nfs/dbraw/zinc/03/22/85/459032285.db2.gz	DUEBDVFZJZLAAK-UYAOXDASSA-N	0	3	341.499	3.258	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2CN[C@@H]2CC[C@H](C#N)C2)C[C@H](C)O1	ZINC000442781594	459035501	/nfs/dbraw/zinc/03/55/01/459035501.db2.gz	JKUQNASMLAFRIN-PFRQMTDMSA-N	0	3	327.472	3.078	20	30		EGEDHN
Cc1cc(C)cc(OCCN2CC[C@@H](Oc3ccc(C#N)cn3)C2)c1	ZINC000590005484	459064508	/nfs/dbraw/zinc/06/45/08/459064508.db2.gz	JAMOMNJAVMXWEG-GOSISDBHSA-N	0	3	337.423	3.102	20	30		EGEDHN
N#Cc1c(N[C@H]2CCCN3CCCC[C@@H]23)nc2cc(Cl)ccn21	ZINC000594600002	459104455	/nfs/dbraw/zinc/10/44/55/459104455.db2.gz	KYWANCYDFJQASW-KBPBESRZSA-N	0	3	329.835	3.288	20	30		EGEDHN
C=CC1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)CC1	ZINC000557885842	459116108	/nfs/dbraw/zinc/11/61/08/459116108.db2.gz	WAQUIGNZNJMCCJ-QFBILLFUSA-N	0	3	327.472	3.257	20	30		EGEDHN
C=CC1CCN(C(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)CC1	ZINC000557885841	459116326	/nfs/dbraw/zinc/11/63/26/459116326.db2.gz	WAQUIGNZNJMCCJ-LPHOPBHVSA-N	0	3	327.472	3.257	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CNCc2ccc(C3CCC3)cc2)cc1	ZINC000521228200	459132565	/nfs/dbraw/zinc/13/25/65/459132565.db2.gz	PCCCARKRHBMYNR-HXUWFJFHSA-N	0	3	336.435	3.355	20	30		EGEDHN
N#Cc1cccc(CCNC(=O)[C@@H]2CCCCN2C2CCCC2)c1	ZINC000578027494	459135712	/nfs/dbraw/zinc/13/57/12/459135712.db2.gz	MCCNXKMDCITQND-IBGZPJMESA-N	0	3	325.456	3.014	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H](CNC[C@@H](C#N)CCC#N)C1	ZINC000496329134	459152210	/nfs/dbraw/zinc/15/22/10/459152210.db2.gz	SIRBSLRTRXCHSF-BZUAXINKSA-N	0	3	334.464	3.103	20	30		EGEDHN
Cc1csc(NC(=O)N(CCN(C)C)Cc2ccco2)c1C#N	ZINC000590605613	459161799	/nfs/dbraw/zinc/16/17/99/459161799.db2.gz	SZAFPXFSBZLWFB-UHFFFAOYSA-N	0	3	332.429	3.117	20	30		EGEDHN
C=C(C)COc1cc(CN[C@H]2CCC[C@H]2C(=O)OC)ccc1OC	ZINC000590657729	459174095	/nfs/dbraw/zinc/17/40/95/459174095.db2.gz	PNAFMNHISBHWAM-CVEARBPZSA-N	0	3	333.428	3.081	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1CNCc1cnc(NC(=O)OC(C)(C)C)s1	ZINC000496424404	459188334	/nfs/dbraw/zinc/18/83/34/459188334.db2.gz	KRKTZVNOWOVGCO-AAEUAGOBSA-N	0	3	339.461	3.171	20	30		EGEDHN
CC(C)n1ccnc1CNC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000594950213	459188642	/nfs/dbraw/zinc/18/86/42/459188642.db2.gz	RDYYPAUEVWHBGQ-UHFFFAOYSA-N	0	3	337.471	3.090	20	30		EGEDHN
C=CCCNCc1cc(OC)c(OCC(F)(F)F)cc1[N+](=O)[O-]	ZINC000594970171	459201072	/nfs/dbraw/zinc/20/10/72/459201072.db2.gz	VCVOITMLNOAZIE-UHFFFAOYSA-N	0	3	334.294	3.210	20	30		EGEDHN
COc1ccc2c(c1)C[C@H](NCc1ccc(C#N)c(Cl)c1)CO2	ZINC000590778620	459214140	/nfs/dbraw/zinc/21/41/40/459214140.db2.gz	JJWZSIPBUMQGEU-HNNXBMFYSA-N	0	3	328.799	3.314	20	30		EGEDHN
CC(C)(C)N1C[C@@H](C(=O)NC2(C#N)CCCCC2)[C@H](C(F)(F)F)C1	ZINC000559372513	459256855	/nfs/dbraw/zinc/25/68/55/459256855.db2.gz	UXYCTRKZAXHHDK-CHWSQXEVSA-N	0	3	345.409	3.238	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)c1cnc(C(C)(C)C)nc1	ZINC000581036414	459267951	/nfs/dbraw/zinc/26/79/51/459267951.db2.gz	IXLQURZSUKNONF-ZDUSSCGKSA-N	0	3	333.395	3.151	20	30		EGEDHN
C[C@H]1CCCN(C(=O)C2CCN(CCc3ccc(C#N)cc3)CC2)C1	ZINC000595292844	459269064	/nfs/dbraw/zinc/26/90/64/459269064.db2.gz	BRELKOSEMHODQX-KRWDZBQOSA-N	0	3	339.483	3.071	20	30		EGEDHN
C[C@@H]1C[C@H](NC2CCN(Cc3ccc(C#N)cc3)CC2)c2nccn21	ZINC000568355101	459273577	/nfs/dbraw/zinc/27/35/77/459273577.db2.gz	ORWWRXSSCJRHEQ-BEFAXECRSA-N	0	3	335.455	3.015	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)[C@@]2(C#N)CC23CCCC3)CN1Cc1ccccc1	ZINC000581648029	459276026	/nfs/dbraw/zinc/27/60/26/459276026.db2.gz	PPHSBQBRSUVFFE-MMOPVJDHSA-N	0	3	337.467	3.240	20	30		EGEDHN
N#CC(C(=O)c1ccc2c(c1)CCC=C2)c1nnc2n1CCCCC2	ZINC000560230824	459314164	/nfs/dbraw/zinc/31/41/64/459314164.db2.gz	LOHYGEFYVZHSMP-KRWDZBQOSA-N	0	3	332.407	3.454	20	30		EGEDHN
CC(C)(C)c1ccc(OC[C@@H](O)CN2CCC[C@H](CC#N)C2)cc1	ZINC000595608905	459364089	/nfs/dbraw/zinc/36/40/89/459364089.db2.gz	BPTKMJNOJNCKHA-AEFFLSMTSA-N	0	3	330.472	3.349	20	30		EGEDHN
C=CCCC[C@H](C)NC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000538332548	459371078	/nfs/dbraw/zinc/37/10/78/459371078.db2.gz	HIIABGUWKREEBN-SFHVURJKSA-N	0	3	329.488	3.060	20	30		EGEDHN
N#CC[C@H]1CCCN(C[C@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000595619563	459371371	/nfs/dbraw/zinc/37/13/71/459371371.db2.gz	DFEICHDIULRBDI-UKRRQHHQSA-N	0	3	326.362	3.234	20	30		EGEDHN
CN(CC(=O)NC1(C#N)CCC1)[C@H]1CCCC[C@H]1c1ccccc1	ZINC000560725217	459390210	/nfs/dbraw/zinc/39/02/10/459390210.db2.gz	XHLCYLLTGGEVJY-ROUUACIJSA-N	0	3	325.456	3.207	20	30		EGEDHN
C=C(C)CN(CC)C(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000483852435	459396313	/nfs/dbraw/zinc/39/63/13/459396313.db2.gz	DGFQKUCZANKVMQ-UHFFFAOYSA-N	0	3	339.549	3.346	20	30		EGEDHN
N#CCC[C@H](NC[C@H](O)COc1ccccc1F)c1ccccc1	ZINC000561189950	459429967	/nfs/dbraw/zinc/42/99/67/459429967.db2.gz	BDHGYAJDSSJMGV-WMZOPIPTSA-N	0	3	328.387	3.200	20	30		EGEDHN
Cc1cccc(C)c1OC[C@@H](O)CNCc1ccc(C#N)c(Cl)c1	ZINC000591765874	459431515	/nfs/dbraw/zinc/43/15/15/459431515.db2.gz	NHKLYPMHOGMGPF-KRWDZBQOSA-N	0	3	344.842	3.358	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1CCC[C@@H]([C@@H]2CCCCO2)C1	ZINC000595790402	459443267	/nfs/dbraw/zinc/44/32/67/459443267.db2.gz	PSCOHGQINPUEIU-MSOLQXFVSA-N	0	3	344.455	3.227	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@@H](NC/C=C/c3ccccc3)C2=O)cc1	ZINC000485257668	459446567	/nfs/dbraw/zinc/44/65/67/459446567.db2.gz	GJDXJUYQRAAGCT-BTZGUFSASA-N	0	3	331.419	3.357	20	30		EGEDHN
C[C@]1(NCC#Cc2ccc(OC(F)(F)F)cc2)CCO[C@@H]1C1CC1	ZINC000541384353	459450887	/nfs/dbraw/zinc/45/08/87/459450887.db2.gz	UILOMVBSXSDTGF-SJORKVTESA-N	0	3	339.357	3.484	20	30		EGEDHN
COc1ccccc1N(CCC#N)C(=O)[C@H](C)N(C)C[C@H]1CC1(C)C	ZINC000595912919	459484920	/nfs/dbraw/zinc/48/49/20/459484920.db2.gz	PHPZENMFPHYSIL-JKSUJKDBSA-N	0	3	343.471	3.308	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CCC(F)(F)[C@H](C)C1	ZINC000562046951	459505817	/nfs/dbraw/zinc/50/58/17/459505817.db2.gz	RRHWRGBVXJEECS-GDBMZVCRSA-N	0	3	325.399	3.132	20	30		EGEDHN
COCCN(CC(=O)Nc1ccc(C#N)c(Cl)c1)[C@@H]1CCC[C@@H]1C	ZINC000487964052	459537140	/nfs/dbraw/zinc/53/71/40/459537140.db2.gz	OMAGSNDANRIKDX-SUMWQHHRSA-N	0	3	349.862	3.287	20	30		EGEDHN
Cc1cc(CN2CCC(OC[C@@H]3CCCCO3)CC2)ccc1C#N	ZINC000488175257	459540759	/nfs/dbraw/zinc/54/07/59/459540759.db2.gz	JASZVEUPEJKGEU-FQEVSTJZSA-N	0	3	328.456	3.417	20	30		EGEDHN
C=CCn1cccc1C(=O)NCC(C)(C)N1CCc2ccccc2C1	ZINC000488397350	459543367	/nfs/dbraw/zinc/54/33/67/459543367.db2.gz	KWRCHEBPAFHBRB-UHFFFAOYSA-N	0	3	337.467	3.241	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000488733661	459548938	/nfs/dbraw/zinc/54/89/38/459548938.db2.gz	PEUJEEXAZMJKCQ-HKUYNNGSSA-N	0	3	337.467	3.315	20	30		EGEDHN
Cc1ccc(C#N)nc1N(C)CCC1CCN(c2ccncc2)CC1	ZINC000596182824	459551490	/nfs/dbraw/zinc/55/14/90/459551490.db2.gz	UGFCAGHZONGGEU-UHFFFAOYSA-N	0	3	335.455	3.400	20	30		EGEDHN
C=CCN(CCc1ccco1)C(=O)NCCN1CCCC[C@H]1CC	ZINC000497676183	459551891	/nfs/dbraw/zinc/55/18/91/459551891.db2.gz	GTNDRPCJTIFJLT-QGZVFWFLSA-N	0	3	333.476	3.284	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2ccc([C@@H]3C[C@@H]3C)o2)CC1	ZINC000592293637	459571864	/nfs/dbraw/zinc/57/18/64/459571864.db2.gz	DWHFWMLETOLHMZ-WMLDXEAASA-N	0	3	331.460	3.243	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H](C)c2ccc(SCC)cc2)CC1	ZINC000490618068	459581929	/nfs/dbraw/zinc/58/19/29/459581929.db2.gz	USJBXAOYCJRCGJ-HNNXBMFYSA-N	0	3	330.497	3.321	20	30		EGEDHN
C#CCNC(=O)C1CCN(Cc2ccc(-c3ccc(C)cc3)o2)CC1	ZINC000491121617	459599785	/nfs/dbraw/zinc/59/97/85/459599785.db2.gz	RJOXUYZDQLLFRO-UHFFFAOYSA-N	0	3	336.435	3.216	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc3c(c2)CCCC3=O)CC1	ZINC000562614163	459602129	/nfs/dbraw/zinc/60/21/29/459602129.db2.gz	ZQPFDELUNWSHDL-UHFFFAOYSA-N	0	3	341.455	3.368	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(Oc3cccnc3)cc2)CC1	ZINC000491392150	459622387	/nfs/dbraw/zinc/62/23/87/459622387.db2.gz	AILRUPDRRROKOU-UHFFFAOYSA-N	0	3	335.407	3.158	20	30		EGEDHN
C#C[C@@H](C)N(C)C(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000491524935	459634024	/nfs/dbraw/zinc/63/40/24/459634024.db2.gz	PBMANWIQFGHFKD-MRXNPFEDSA-N	0	3	329.444	3.037	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H]2CC[C@H](c3ccc(Cl)cc3)C2)CC1	ZINC000491556770	459636936	/nfs/dbraw/zinc/63/69/36/459636936.db2.gz	YYVDUZWCKNZTOR-PKOBYXMFSA-N	0	3	344.886	3.438	20	30		EGEDHN
C#C[C@@H](NC(=O)NCc1cccc(CN(C)C)c1)c1ccc(F)cc1	ZINC000491636650	459644842	/nfs/dbraw/zinc/64/48/42/459644842.db2.gz	TWGMIVHOWLGVEL-LJQANCHMSA-N	0	3	339.414	3.061	20	30		EGEDHN
C[C@@H](CN1CCC(C)CC1)NC(=O)Nc1cc(C#N)cn1C(C)(C)C	ZINC000596477348	459650596	/nfs/dbraw/zinc/65/05/96/459650596.db2.gz	XJOAZFMPIJMEIG-HNNXBMFYSA-N	0	3	345.491	3.357	20	30		EGEDHN
C[C@H](CN1CCC(C)CC1)Nc1ncc(Br)cc1C#N	ZINC000596488277	459654572	/nfs/dbraw/zinc/65/45/72/459654572.db2.gz	PNIXWFRQVLMEHI-GFCCVEGCSA-N	0	3	337.265	3.248	20	30		EGEDHN
C=C[C@@H]1CCCCN1C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H]1C	ZINC000573353860	459663583	/nfs/dbraw/zinc/66/35/83/459663583.db2.gz	FWXQWGIYPAUTKV-QXAKKESOSA-N	0	3	327.472	3.400	20	30		EGEDHN
Cc1ccc(C[C@@H]2CCCN2CC(=O)NCc2cccc(C#N)c2)cc1	ZINC000500207666	459671626	/nfs/dbraw/zinc/67/16/26/459671626.db2.gz	IJMRSNZYLATUSI-NRFANRHFSA-N	0	3	347.462	3.190	20	30		EGEDHN
C=CCCSCCNC(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C	ZINC000596596978	459690636	/nfs/dbraw/zinc/69/06/36/459690636.db2.gz	HRIZZVWVXIRODI-DOTOQJQBSA-N	0	3	335.517	3.286	20	30		EGEDHN
N#CCC1CCN(Cc2cccc(C(=O)NCc3ccco3)c2)CC1	ZINC000543807335	459702603	/nfs/dbraw/zinc/70/26/03/459702603.db2.gz	NCELTWMYHJISFT-UHFFFAOYSA-N	0	3	337.423	3.335	20	30		EGEDHN
CN(C)Cc1ccccc1NC(=O)/C=C\c1ccc(OCC#N)cc1	ZINC000492769586	459720478	/nfs/dbraw/zinc/72/04/78/459720478.db2.gz	FMEJRWIWQZSHOW-XFXZXTDPSA-N	0	3	335.407	3.302	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCCOc1cncc(Cl)c1	ZINC000563631446	459767266	/nfs/dbraw/zinc/76/72/66/459767266.db2.gz	QZSRFAKJKYHFFL-HNNXBMFYSA-N	0	3	343.814	3.003	20	30		EGEDHN
C=CCn1c(CC)nnc1N1CC[C@@H](C)N(Cc2ccccc2)CC1	ZINC000564376528	459773180	/nfs/dbraw/zinc/77/31/80/459773180.db2.gz	FTVCSTZUOKPCHA-QGZVFWFLSA-N	0	3	339.487	3.127	20	30		EGEDHN
N#CCC[C@@H](C#N)CNCC1(c2ccccc2Cl)CCOCC1	ZINC000564600026	459775370	/nfs/dbraw/zinc/77/53/70/459775370.db2.gz	LHMFPMHDFYUUFE-HNNXBMFYSA-N	0	3	331.847	3.421	20	30		EGEDHN
N#CCC1(CNC[C@H](O)COc2ccc(-c3ccccc3)cc2)CC1	ZINC000564864422	459778196	/nfs/dbraw/zinc/77/81/96/459778196.db2.gz	NZJBIOPVANNOMF-IBGZPJMESA-N	0	3	336.435	3.377	20	30		EGEDHN
CC#CCNC(=O)Nc1ccc(SCCN2CCCCC2)cc1	ZINC000564940625	459780027	/nfs/dbraw/zinc/78/00/27/459780027.db2.gz	XYJDJRVMXWCMTA-UHFFFAOYSA-N	0	3	331.485	3.409	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CCC[C@@H]1[C@H]1CCCOC1	ZINC000565021260	459780434	/nfs/dbraw/zinc/78/04/34/459780434.db2.gz	SAAXGUYJDPSZKR-GBESFXJTSA-N	0	3	326.440	3.177	20	30		EGEDHN
CN(CCOCc1ccc(C#N)cc1)C[C@H]1CCC2(CCCC2)O1	ZINC000584678597	459782735	/nfs/dbraw/zinc/78/27/35/459782735.db2.gz	YEXJVBQODCZTNU-LJQANCHMSA-N	0	3	328.456	3.498	20	30		EGEDHN
C=CCn1c(C2CCCC2)nnc1N1CCN(C2CCCC2)CC1	ZINC000565668634	459787125	/nfs/dbraw/zinc/78/71/25/459787125.db2.gz	BIZOULPXZWPKHJ-UHFFFAOYSA-N	0	3	329.492	3.186	20	30		EGEDHN
C[C@@H]1CCN(C[C@@H](O)COc2ccccc2C#N)[C@@H](c2ccco2)C1	ZINC000528394349	459805338	/nfs/dbraw/zinc/80/53/38/459805338.db2.gz	JZTFIHDTGFYQOX-KBAYOESNSA-N	0	3	340.423	3.364	20	30		EGEDHN
COc1cc(C#N)ccc1NC(=O)NC[C@H]1CCN1C1CCCCC1	ZINC000529061687	459821955	/nfs/dbraw/zinc/82/19/55/459821955.db2.gz	BVPOIFKOCFGGJP-MRXNPFEDSA-N	0	3	342.443	3.095	20	30		EGEDHN
CCCN1CC[C@@H](NC(=O)c2sc3ccc(C#N)cc3c2C)C1	ZINC000598342719	459871726	/nfs/dbraw/zinc/87/17/26/459871726.db2.gz	PLECOQZGEKXESG-CQSZACIVSA-N	0	3	327.453	3.296	20	30		EGEDHN
C[C@H](CCC#N)CN1CCCC[C@@H]1C(=O)Nc1ccc2c(c1)CCO2	ZINC000602471300	459953223	/nfs/dbraw/zinc/95/32/23/459953223.db2.gz	LLKKBARNEVNMKB-CRAIPNDOSA-N	0	3	341.455	3.354	20	30		EGEDHN
CN(Cc1cccc(Br)c1)C[C@@H](O)CC(C)(C)C#N	ZINC000598586798	459954450	/nfs/dbraw/zinc/95/44/50/459954450.db2.gz	ZYUBWVSILSRZKR-AWEZNQCLSA-N	0	3	325.250	3.182	20	30		EGEDHN
C[C@@H]1[C@H](C)N(Cc2ccccc2)[C@@H](C)CN1C[C@@H](O)CC(C)(C)C#N	ZINC000598622319	459966363	/nfs/dbraw/zinc/96/63/63/459966363.db2.gz	HUFDBKABOLKLKH-DMUMMCEESA-N	0	3	343.515	3.270	20	30		EGEDHN
CC(C)(C)OC(=O)CC[C@H]1CCCCN1C[C@H](O)CC(C)(C)C#N	ZINC000598622131	459966508	/nfs/dbraw/zinc/96/65/08/459966508.db2.gz	LQKHBQYSWIFSQZ-HZPDHXFCSA-N	0	3	338.492	3.264	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000598621893	459966550	/nfs/dbraw/zinc/96/65/50/459966550.db2.gz	YNAIATXDNAAARJ-DOTOQJQBSA-N	0	3	331.416	3.075	20	30		EGEDHN
COC(=O)c1cc(CN[C@H](C)c2cccc(C#N)c2)n2c1CCCC2	ZINC000598632774	459970152	/nfs/dbraw/zinc/97/01/52/459970152.db2.gz	ATDXTZMAZVFJTJ-CQSZACIVSA-N	0	3	337.423	3.333	20	30		EGEDHN
C[C@H](CNCc1cccc(C#N)n1)Oc1cccc(Br)c1	ZINC000602561571	459997315	/nfs/dbraw/zinc/99/73/15/459997315.db2.gz	SQJOSPHNSPSITF-GFCCVEGCSA-N	0	3	346.228	3.273	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CNCc1ccccc1OCC(F)(F)F	ZINC000598700556	459998688	/nfs/dbraw/zinc/99/86/88/459998688.db2.gz	OQUNHSBWEXHQBY-CYBMUJFWSA-N	0	3	330.350	3.018	20	30		EGEDHN
C[C@H](CCC#N)CN[C@@H](c1ccc(Cl)cc1)[C@@H]1CN(C)CCO1	ZINC000602579272	460005438	/nfs/dbraw/zinc/00/54/38/460005438.db2.gz	ISRPLZIFESTRGW-JLSDUUJJSA-N	0	3	335.879	3.241	20	30		EGEDHN
COc1ccccc1[C@@H](CNC[C@H](O)CC(C)(C)C#N)OC(C)C	ZINC000598723451	460006656	/nfs/dbraw/zinc/00/66/56/460006656.db2.gz	HZJJFWARKJSBBG-CRAIPNDOSA-N	0	3	334.460	3.052	20	30		EGEDHN
CC(C)[C@@](C)(Cc1ccc(Cl)cc1)NC(=O)[C@H](N)CCCC#N	ZINC000602586798	460012960	/nfs/dbraw/zinc/01/29/60/460012960.db2.gz	VSSZICJVSBTLHQ-SJLPKXTDSA-N	0	3	335.879	3.435	20	30		EGEDHN
C[C@@H](CC1(C#N)CCOCC1)NCc1cc(Cl)cc2c1OCC2	ZINC000602614194	460022352	/nfs/dbraw/zinc/02/23/52/460022352.db2.gz	MKAGMMKZVGPING-ZDUSSCGKSA-N	0	3	334.847	3.463	20	30		EGEDHN
Cc1cc(Br)cn2cc(CNC[C@@H](C)CCC#N)nc12	ZINC000602612625	460022482	/nfs/dbraw/zinc/02/24/82/460022482.db2.gz	IBGRPJSZPWXMMI-NSHDSACASA-N	0	3	335.249	3.435	20	30		EGEDHN
CN1CC[C@]2(C1)CCCN(C(=O)c1ccc(C(C)(C)C#N)cc1)C2	ZINC000597710317	460035005	/nfs/dbraw/zinc/03/50/05/460035005.db2.gz	KDJNKMPGMCGZGF-FQEVSTJZSA-N	0	3	325.456	3.046	20	30		EGEDHN
C[C@H](CC1(C#N)CCOCC1)N[C@@H](C)c1ccc2c(c1)CCC(=O)N2	ZINC000602658457	460048647	/nfs/dbraw/zinc/04/86/47/460048647.db2.gz	YERKRDWNXOFGQA-CABCVRRESA-N	0	3	341.455	3.321	20	30		EGEDHN
C[C@H](CC1(C#N)CCOCC1)N[C@H](C)c1ccc2c(c1)CCC(=O)N2	ZINC000602658459	460049111	/nfs/dbraw/zinc/04/91/11/460049111.db2.gz	YERKRDWNXOFGQA-HUUCEWRRSA-N	0	3	341.455	3.321	20	30		EGEDHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@H](C)Cc1ccc(C#N)cc1	ZINC000594002012	460050630	/nfs/dbraw/zinc/05/06/30/460050630.db2.gz	QZSYXLSBPRPFCU-QZTJIDSGSA-N	0	3	349.478	3.374	20	30		EGEDHN
N#Cc1ccc2c(c1)CCN2C(=O)c1cccc(CN2CCCC2)c1	ZINC000597778963	460058585	/nfs/dbraw/zinc/05/85/85/460058585.db2.gz	WHVQWKPMMQBGCU-UHFFFAOYSA-N	0	3	331.419	3.357	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CNCc1cccc(N(C)C)c1	ZINC000576149487	460079433	/nfs/dbraw/zinc/07/94/33/460079433.db2.gz	YZYRHLTVPQHPIR-HXUWFJFHSA-N	0	3	340.467	3.011	20	30		EGEDHN
COc1ccc(-c2cnc3c(cnn3C3CCN(C)CC3)c2)cc1C#N	ZINC000598929877	460093508	/nfs/dbraw/zinc/09/35/08/460093508.db2.gz	KFTTWUIIFPGEPN-UHFFFAOYSA-N	0	3	347.422	3.245	20	30		EGEDHN
N#Cc1ccc(CCNC(=O)[C@@H]2CCCCN2C2CCCC2)cc1	ZINC000597890231	460096794	/nfs/dbraw/zinc/09/67/94/460096794.db2.gz	QXGSPVMCNPUXRA-IBGZPJMESA-N	0	3	325.456	3.014	20	30		EGEDHN
CN(Cc1ccccc1)[C@H]1CCN(c2ccc(C#N)cc2[N+](=O)[O-])C1	ZINC000610281803	460105383	/nfs/dbraw/zinc/10/53/83/460105383.db2.gz	OUIWXIABPBOBCW-KRWDZBQOSA-N	0	3	336.395	3.177	20	30		EGEDHN
CCOC(=O)c1[nH]c(C)c(CN[C@H]2CCc3cc(C#N)ccc32)c1C	ZINC000598973949	460111754	/nfs/dbraw/zinc/11/17/54/460111754.db2.gz	IJVHYAOYRMVPML-SFHVURJKSA-N	0	3	337.423	3.457	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCN(CCc2cccs2)CC1	ZINC000614397701	460128046	/nfs/dbraw/zinc/12/80/46/460128046.db2.gz	RDMPYWNKOZKFPA-UHFFFAOYSA-N	0	3	325.481	3.289	20	30		EGEDHN
C[C@H](CN1CCCCC1)Nc1c(C#N)cnc2c(F)ccc(F)c21	ZINC000610514813	460172223	/nfs/dbraw/zinc/17/22/23/460172223.db2.gz	YIRZZHYWEKVADL-GFCCVEGCSA-N	0	3	330.382	3.093	20	30		EGEDHN
CN(CCN1CCC(C#N)(c2ccccn2)CC1)Cc1ccccc1	ZINC000576790940	460213024	/nfs/dbraw/zinc/21/30/24/460213024.db2.gz	YXTFDTHZEIIYMN-UHFFFAOYSA-N	0	3	334.467	3.071	20	30		EGEDHN
CN(Cc1c(Cl)cccc1Cl)C(=O)[C@H](N)CCCCC#N	ZINC000594426893	460216385	/nfs/dbraw/zinc/21/63/85/460216385.db2.gz	HPCOHCJDHRUNRM-CQSZACIVSA-N	0	3	328.243	3.363	20	30		EGEDHN
Cc1ccc(Cc2ccccn2)cc1NC(=O)[C@H](N)CCCCC#N	ZINC000594443157	460221709	/nfs/dbraw/zinc/22/17/09/460221709.db2.gz	MNICPDWUTOSUMA-GOSISDBHSA-N	0	3	336.439	3.331	20	30		EGEDHN
C[C@@H](NC[C@@H](O)COc1ccccc1C#N)c1cc2ccccc2o1	ZINC000599358404	460237339	/nfs/dbraw/zinc/23/73/39/460237339.db2.gz	HYKBALRELCWPKJ-RHSMWYFYSA-N	0	3	336.391	3.395	20	30		EGEDHN
CC(C)(C)[C@H](N)c1cn(Cc2ccc(Br)cc2C#N)nn1	ZINC000603240709	460270712	/nfs/dbraw/zinc/27/07/12/460270712.db2.gz	CKUUXMXXHMLUJP-CQSZACIVSA-N	0	3	348.248	3.006	20	30		EGEDHN
CC(C)(C)[C@H](N)c1cn(Cc2ccc(C#N)cc2Br)nn1	ZINC000603243808	460271145	/nfs/dbraw/zinc/27/11/45/460271145.db2.gz	OKYVZQMXCVPQTL-CQSZACIVSA-N	0	3	348.248	3.006	20	30		EGEDHN
N#CC1(C(=O)Nc2ccc(CN3CCC(O)CC3)cc2)CCCCC1	ZINC000611197688	460306183	/nfs/dbraw/zinc/30/61/83/460306183.db2.gz	XSMSMHYAIXEDAK-UHFFFAOYSA-N	0	3	341.455	3.056	20	30		EGEDHN
N#Cc1cccc(COc2cccc(CN(CCCO)C3CC3)c2)c1	ZINC000611271599	460323888	/nfs/dbraw/zinc/32/38/88/460323888.db2.gz	KDRPJTCPBFFOOZ-UHFFFAOYSA-N	0	3	336.435	3.484	20	30		EGEDHN
C[C@@H](NCCC(=O)Nc1ccccc1[N+](=O)[O-])c1cccc(C#N)c1	ZINC000611388895	460351013	/nfs/dbraw/zinc/35/10/13/460351013.db2.gz	UHCJXKYPUCOWRA-CYBMUJFWSA-N	0	3	338.367	3.146	20	30		EGEDHN
CN(C)C(=O)c1cccc(CN[C@H]2CCCc3cc(C#N)ccc32)c1	ZINC000611391007	460352854	/nfs/dbraw/zinc/35/28/54/460352854.db2.gz	ZJLJURMKBHZJMY-FQEVSTJZSA-N	0	3	333.435	3.427	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2N[C@H]1CCN(C(=O)C2CCCC2)C1	ZINC000611393768	460353956	/nfs/dbraw/zinc/35/39/56/460353956.db2.gz	WXMDCYVBRXLQNV-AZUAARDMSA-N	0	3	337.467	3.316	20	30		EGEDHN
CN(C[C@H](O)COc1ccc(CC#N)cc1)[C@H]1CCc2ccccc21	ZINC000599969848	460365177	/nfs/dbraw/zinc/36/51/77/460365177.db2.gz	FSPYLORDWVMIOP-RXVVDRJESA-N	0	3	336.435	3.112	20	30		EGEDHN
Cc1noc(C)c1[C@H](C)NC1CCN(Cc2ccc(C#N)cc2)CC1	ZINC000611438570	460365524	/nfs/dbraw/zinc/36/55/24/460365524.db2.gz	BUBIUZPKANSKRM-AWEZNQCLSA-N	0	3	338.455	3.478	20	30		EGEDHN
Cc1ccccc1[C@@H]([C@H](C)NC(=O)c1ccccc1CC#N)N(C)C	ZINC000601521816	460825104	/nfs/dbraw/zinc/82/51/04/460825104.db2.gz	XYYRUNUYDRYCPK-OXJNMPFZSA-N	0	3	335.451	3.482	20	30		EGEDHN
COc1cc(CN(C)C)ccc1NC(=O)[C@@]1(C#N)CC12CCCC2	ZINC000601621980	460849611	/nfs/dbraw/zinc/84/96/11/460849611.db2.gz	QMAZQSDQFIRFQA-IBGZPJMESA-N	0	3	327.428	3.169	20	30		EGEDHN
Cc1cccc(CN2CC[C@H](NC(=O)c3ccccc3CC#N)C2)c1	ZINC000601851487	460924667	/nfs/dbraw/zinc/92/46/67/460924667.db2.gz	SXYBVUOMSKLMKD-IBGZPJMESA-N	0	3	333.435	3.065	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN1CCC(C(=O)c2ccc(F)cc2)CC1	ZINC000621287803	460975121	/nfs/dbraw/zinc/97/51/21/460975121.db2.gz	APQNCYYMTLEVOF-QGZVFWFLSA-N	0	3	332.419	3.021	20	30		EGEDHN
C=C(C)Cn1c(-c2ccc[nH]2)nnc1N1CCN(C(C)(C)CC)CC1	ZINC000655631543	461339098	/nfs/dbraw/zinc/33/90/98/461339098.db2.gz	NDHDZTOOWLYNTO-UHFFFAOYSA-N	0	3	342.491	3.160	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@@H](C)N(C)CCN1CCCCC1	ZINC000649888635	461423359	/nfs/dbraw/zinc/42/33/59/461423359.db2.gz	AKCZROURXKGLRG-QGZVFWFLSA-N	0	3	349.544	3.069	20	30		EGEDHN
COCCOc1cncc(C(=O)C(C#N)c2ccc3ccccc3n2)c1	ZINC000670115192	461888056	/nfs/dbraw/zinc/88/80/56/461888056.db2.gz	PUYFKQRJXXIWQE-QGZVFWFLSA-N	0	3	347.374	3.145	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN1CCCN(CC)C[C@@H]1C	ZINC000660792843	461974998	/nfs/dbraw/zinc/97/49/98/461974998.db2.gz	JQPZZCXRJGMDRU-INIZCTEOSA-N	0	3	347.528	3.319	20	30		EGEDHN
C=CCCn1cc(CN[C@@H](C)Cc2ccc(Br)cc2)nn1	ZINC000657312902	462038286	/nfs/dbraw/zinc/03/82/86/462038286.db2.gz	LWAVAEBYMAOSSK-ZDUSSCGKSA-N	0	3	349.276	3.338	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N[C@@H]1CCN(CCC)C1)c1ccc(F)c(F)c1	ZINC000661036970	462074687	/nfs/dbraw/zinc/07/46/87/462074687.db2.gz	NCFHKNQLDYDNCO-PBHICJAKSA-N	0	3	337.414	3.366	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C2CC(c3ccc(F)cc3)C2)CC1	ZINC000644794787	462080474	/nfs/dbraw/zinc/08/04/74/462080474.db2.gz	SMEXODLSBBXZAQ-UHFFFAOYSA-N	0	3	330.447	3.476	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2Cc3cc(F)c(F)cc3C2)CC1	ZINC000654431238	462220112	/nfs/dbraw/zinc/22/01/12/462220112.db2.gz	BPEOKZWPMLPTQL-UHFFFAOYSA-N	0	3	335.398	3.031	20	30		EGEDHN
C=CC[C@@H]1CCCN(CC(=O)NCc2ccccc2COCC)C1	ZINC000661379864	462225247	/nfs/dbraw/zinc/22/52/47/462225247.db2.gz	IZHXOVZIZQDULA-QGZVFWFLSA-N	0	3	330.472	3.127	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2snc3ccccc32)CC1	ZINC000640247474	462333711	/nfs/dbraw/zinc/33/37/11/462333711.db2.gz	YLNTVDAFRZHFPT-UHFFFAOYSA-N	0	3	330.457	3.458	20	30		EGEDHN
C=CCN(CC(=O)N(CC)Cc1ccc2c(c1)OCCO2)C(C)(C)C	ZINC000661754748	462398175	/nfs/dbraw/zinc/39/81/75/462398175.db2.gz	CVWDQXBIJIWIGG-UHFFFAOYSA-N	0	3	346.471	3.093	20	30		EGEDHN
C=CCN(CC(=O)N[C@@H](C)c1cc(OC)ccc1OC)C(C)(C)C	ZINC000661755198	462399352	/nfs/dbraw/zinc/39/93/52/462399352.db2.gz	IWHCJOHGMBHAHS-AWEZNQCLSA-N	0	3	334.460	3.168	20	30		EGEDHN
Cc1c(CN2CCSCC2)cccc1NCc1cc(C#N)n(C)c1	ZINC000191419020	533848267	/nfs/dbraw/zinc/84/82/67/533848267.db2.gz	OJBVHUPSFDUFGX-UHFFFAOYSA-N	0	3	340.496	3.366	20	30		EGEDHN
Cc1nc(NC[C@H](c2cccc(C(F)(F)F)c2)N(C)C)ccc1C#N	ZINC000487721334	518185665	/nfs/dbraw/zinc/18/56/65/518185665.db2.gz	JWUOCPOTQDRXOF-MRXNPFEDSA-N	0	3	348.372	3.417	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC(c3ccsc3)CC2)CC1	ZINC000186905847	526425063	/nfs/dbraw/zinc/42/50/63/526425063.db2.gz	KECMKNWABPHUNL-UHFFFAOYSA-N	0	3	333.501	3.288	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCCCCOc2ccc(C)cc2)CC1	ZINC000171712710	526433063	/nfs/dbraw/zinc/43/30/63/526433063.db2.gz	YBDRWDGLMOQRRE-UHFFFAOYSA-N	0	3	345.487	3.104	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@H](C)CSCc2ccccc2)CC1	ZINC000178525787	526444371	/nfs/dbraw/zinc/44/43/71/526444371.db2.gz	JBQQXFHUSWPWDZ-MRXNPFEDSA-N	0	3	332.513	3.323	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2csc(-c3cccs3)n2)CC1	ZINC000171721761	526449366	/nfs/dbraw/zinc/44/93/66/526449366.db2.gz	QZOMHPDKCCUSLS-UHFFFAOYSA-N	0	3	333.482	3.252	20	30		EGEDHN
CC(C)(C)[C@@H](CCO)NCc1ccc(C#N)cc1Br	ZINC000183700929	526615967	/nfs/dbraw/zinc/61/59/67/526615967.db2.gz	ZOCWWJARWMPXBU-CQSZACIVSA-N	0	3	325.250	3.207	20	30		EGEDHN
C#CCCCCC(=O)NC[C@H](c1ccc(OC)cc1)N1CCCC1	ZINC000179637607	526688802	/nfs/dbraw/zinc/68/88/02/526688802.db2.gz	QUFBSHFMBUCCCW-LJQANCHMSA-N	0	3	328.456	3.142	20	30		EGEDHN
C#CCCCN[C@@H](c1ccccc1)c1cccc(S(C)(=O)=O)c1	ZINC000179458948	526715438	/nfs/dbraw/zinc/71/54/38/526715438.db2.gz	ADVOITOJNZADGA-IBGZPJMESA-N	0	3	327.449	3.183	20	30		EGEDHN
C/C(=C\c1ccccc1)CN[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000192713819	527534045	/nfs/dbraw/zinc/53/40/45/527534045.db2.gz	KLPHGZVHSWAXDX-RYEVTAHJSA-N	0	3	345.446	3.352	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Cc1nc(C)sc1C)C(C)C	ZINC000130316132	527645012	/nfs/dbraw/zinc/64/50/12/527645012.db2.gz	JCGZDZIQBADVMV-KRWDZBQOSA-N	0	3	335.517	3.117	20	30		EGEDHN
CCC1(CC)[C@@H](N[C@@H](C)C(=O)Nc2ccccc2C#N)C[C@@H]1OC	ZINC000178363526	529094685	/nfs/dbraw/zinc/09/46/85/529094685.db2.gz	YGECSTIFTRQMNG-JQFCIGGWSA-N	0	3	329.444	3.069	20	30		EGEDHN
CN(C)CCN(C(=O)CSc1ccc(C#N)cc1)C1CCCCC1	ZINC000343203953	535841045	/nfs/dbraw/zinc/84/10/45/535841045.db2.gz	DTQQWIYOCGOZBU-UHFFFAOYSA-N	0	3	345.512	3.373	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2C[C@H](C)C[C@@H]2c2ccccc2)CC1	ZINC000287580781	547400317	/nfs/dbraw/zinc/40/03/17/547400317.db2.gz	XLPIDKVMSRDCSH-VQIMIIECSA-N	0	3	327.472	3.430	20	30		EGEDHN
C=C(CNC(=O)NC[C@@H](Cc1ccccc1)N(C)C)c1ccccc1	ZINC000672681369	548461423	/nfs/dbraw/zinc/46/14/23/548461423.db2.gz	NTNCTEXSUXYKQI-HXUWFJFHSA-N	0	3	337.467	3.172	20	30		EGEDHN
C=CCc1cc(OCC)cc(C[N@@H+]2CCCC[C@@H]2CC(=O)OC)c1[O-]	ZINC000726588488	574562660	/nfs/dbraw/zinc/56/26/60/574562660.db2.gz	POXTXOSYTXEUBX-QGZVFWFLSA-N	0	3	347.455	3.437	20	30		EGEDHN
C=CCc1cc(OCC)cc(C[N@H+]2CCCC[C@@H]2CC(=O)OC)c1[O-]	ZINC000726588488	574562662	/nfs/dbraw/zinc/56/26/62/574562662.db2.gz	POXTXOSYTXEUBX-QGZVFWFLSA-N	0	3	347.455	3.437	20	30		EGEDHN
C=CCNC(=O)C(C#N)C(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000727953826	574706170	/nfs/dbraw/zinc/70/61/70/574706170.db2.gz	OMJFSULALBNLID-QJPTWQEYSA-N	0	3	337.206	3.108	20	30		EGEDHN
C=C(C)CN(CC)C(=O)Nc1ccc(N2CCN(CC)CC2)cc1	ZINC000729548985	574870083	/nfs/dbraw/zinc/87/00/83/574870083.db2.gz	HEUNXHIGHYTYPZ-UHFFFAOYSA-N	0	3	330.476	3.258	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](CC)c2ccccc2OC)CC1	ZINC000730030252	574908140	/nfs/dbraw/zinc/90/81/40/574908140.db2.gz	ZLBDKOWKHXTBIO-GOSISDBHSA-N	0	3	345.487	3.486	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/C2CCC(C(=O)OC)CC2)c([O-])c1	ZINC000730148155	574925215	/nfs/dbraw/zinc/92/52/15/574925215.db2.gz	YHBZQOFUYTZSFG-DEDYPNTBSA-N	0	3	332.444	3.389	20	30		EGEDHN
C#CCOc1cccc(NC(=O)NC[C@H](C)N2CCCC[C@H]2C)c1	ZINC000731111117	575055045	/nfs/dbraw/zinc/05/50/45/575055045.db2.gz	JKQYQTVJPTZYCV-CVEARBPZSA-N	0	3	329.444	3.083	20	30		EGEDHN
C[C@H]1CCCCN1CCOc1ccccc1C(=O)OCCCC#N	ZINC000731252572	575062257	/nfs/dbraw/zinc/06/22/57/575062257.db2.gz	HYXPJGJYCPADTL-INIZCTEOSA-N	0	3	330.428	3.400	20	30		EGEDHN
C=CCc1cc(CNCCN2CCc3ccccc32)cc(OC)c1O	ZINC000733325890	575327880	/nfs/dbraw/zinc/32/78/80/575327880.db2.gz	WOTJHCKCHJCMDY-UHFFFAOYSA-N	0	3	338.451	3.282	20	30		EGEDHN
C=CC[C@H](NC(=O)NC1CCN(CC(=C)C)CC1)c1ccncc1	ZINC000734668826	575534732	/nfs/dbraw/zinc/53/47/32/575534732.db2.gz	INTIZTZCVSOTMZ-SFHVURJKSA-N	0	3	328.460	3.039	20	30		EGEDHN
CC[C@H](C(=O)NCc1cccc(O[C@H](C#N)CC)c1)N(CC)CC	ZINC000736018427	575752136	/nfs/dbraw/zinc/75/21/36/575752136.db2.gz	BXADCNRQMFPYTG-FUHWJXTLSA-N	0	3	331.460	3.104	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2cc(Cl)cc(Cl)c2)CC1	ZINC000740735373	576621429	/nfs/dbraw/zinc/62/14/29/576621429.db2.gz	CAHHWJXESAEGPB-UHFFFAOYSA-N	0	3	325.239	3.211	20	30		EGEDHN
C#CCCN1CCC(NC(=O)[C@H](C)Oc2ccc(Cl)c(C)c2)CC1	ZINC000740736524	576621695	/nfs/dbraw/zinc/62/16/95/576621695.db2.gz	XSXKJHQFVXENQW-HNNXBMFYSA-N	0	3	348.874	3.020	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2cc3c(cccc3F)s2)CC1	ZINC000740737176	576621724	/nfs/dbraw/zinc/62/17/24/576621724.db2.gz	CLVNKXLTKFYKDX-UHFFFAOYSA-N	0	3	330.428	3.258	20	30		EGEDHN
CCCCCCCN1CCC(NS(=O)(=O)c2cccs2)CC1	ZINC000740873491	576632480	/nfs/dbraw/zinc/63/24/80/576632480.db2.gz	FLADACNPXMHIRV-UHFFFAOYSA-N	0	3	344.546	3.461	20	30		EGEDHN
CC(C)(CCC#N)CNCC(=O)Nc1ccc(Br)cc1	ZINC000742367190	576774221	/nfs/dbraw/zinc/77/42/21/576774221.db2.gz	JMYYJZPHBYAMRQ-UHFFFAOYSA-N	0	3	338.249	3.307	20	30		EGEDHN
C=CCN1CCC(NC(=S)Nc2cc(OC)ccc2Cl)CC1	ZINC000742996483	576799118	/nfs/dbraw/zinc/79/91/18/576799118.db2.gz	FXRWOWYNFLNHND-UHFFFAOYSA-N	0	3	339.892	3.285	20	30		EGEDHN
C#CCCN1CCC(NC(=O)C[C@H](CC)c2ccc(C)cc2)CC1	ZINC000743493405	576810404	/nfs/dbraw/zinc/81/04/04/576810404.db2.gz	QYMPGTUWOUZNKG-SFHVURJKSA-N	0	3	326.484	3.483	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)C=C(C)C(C)(C)C)cc1OC	ZINC000744031883	576819259	/nfs/dbraw/zinc/81/92/59/576819259.db2.gz	CWNBAMOBAVNOFR-BRADTZPFSA-N	0	3	344.411	3.344	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)[C@@H](C)c1ccc(C)o1	ZINC000744031735	576819324	/nfs/dbraw/zinc/81/93/24/576819324.db2.gz	BTFVRNSCWGQQNF-QWHCGFSZSA-N	0	3	326.352	3.048	20	30		EGEDHN
C#CCN(Cc1ccc(F)cc1)C(=O)N[C@@H](C)CN1CCC[C@H](C)C1	ZINC000744857803	576835669	/nfs/dbraw/zinc/83/56/69/576835669.db2.gz	ZDGOYYLLWCBBLH-IRXDYDNUSA-N	0	3	345.462	3.091	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CNCc2ccc([S@@](C)=O)cc2)cc1	ZINC000751151816	1299516317	/nfs/dbraw/zinc/51/63/17/1299516317.db2.gz	FYFDPDXYIYFVML-QKFKETGDSA-N	0	3	328.437	3.005	20	30		EGEDHN
COc1ccc(OCCC(=O)C(C#N)c2nc3ccccc3o2)cc1	ZINC000078735906	1292523321	/nfs/dbraw/zinc/52/33/21/1292523321.db2.gz	FXZXHVSHLBXJPE-HNNXBMFYSA-N	0	3	336.347	3.482	20	30		EGEDHN
CC(=O)N[C@@H](C(=O)C(C#N)c1nc(C(C)C)cs1)C1CCCC1	ZINC000080456645	1292604413	/nfs/dbraw/zinc/60/44/13/1292604413.db2.gz	AZCYDKUIGXNQPD-UKRRQHHQSA-N	0	3	333.457	3.138	20	30		EGEDHN
CO[C@](C)(C(=O)C(C#N)c1nc2ccccc2n1C)c1ccccc1	ZINC000106982427	1293055198	/nfs/dbraw/zinc/05/51/98/1293055198.db2.gz	BSKIHZQJUCPCAU-QRWLVFNGSA-N	0	3	333.391	3.311	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)CC[C@@H]2CCCCO2)cc1	ZINC000111945036	1293113620	/nfs/dbraw/zinc/11/36/20/1293113620.db2.gz	NMSXJKAVLZTBAJ-IRXDYDNUSA-N	0	3	328.412	3.246	20	30		EGEDHN
CC1(C)CCCN(Cc2cc(=O)n3c4ccccc4[nH]c3c2C#N)C1	ZINC000112702049	1293132166	/nfs/dbraw/zinc/13/21/66/1293132166.db2.gz	CSLDLVJSMBLVMH-OAHLLOKOSA-N	0	3	334.423	3.346	20	30		EGEDHN
C[C@H](CC(=O)C(C#N)C(=O)Nc1ccccn1)c1cccc(F)c1	ZINC000116593559	1293207974	/nfs/dbraw/zinc/20/79/74/1293207974.db2.gz	IQQUANVPLNOURU-DOMZBBRYSA-N	0	3	325.343	3.062	20	30		EGEDHN
C=CCNC(=O)C(C#N)C(=O)CCCc1csc2ccccc12	ZINC000120036010	1293299899	/nfs/dbraw/zinc/29/98/99/1293299899.db2.gz	ZLSHVGWMBHLJOF-OAHLLOKOSA-N	0	3	326.421	3.235	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)COc2ccc3c(c2)CCC3)c1	ZINC000127509378	1293565749	/nfs/dbraw/zinc/56/57/49/1293565749.db2.gz	RNCLPRHZHSGBRH-IBGZPJMESA-N	0	3	348.402	3.210	20	30		EGEDHN
N#CC1(c2ccccc2)CC(NC[C@H](O)c2c(F)cccc2F)C1	ZINC000127964348	1293578770	/nfs/dbraw/zinc/57/87/70/1293578770.db2.gz	WKNFJSLQUPQIJO-KGYZHSKHSA-N	0	3	328.362	3.212	20	30		EGEDHN
COc1ccc([C@H](CCO)NCc2ccc(O[C@H](C)C#N)cc2)cc1	ZINC000128725849	1293602160	/nfs/dbraw/zinc/60/21/60/1293602160.db2.gz	KYASBIYSXVTIKZ-QRWLVFNGSA-N	0	3	340.423	3.199	20	30		EGEDHN
CNC(=O)C(C#N)C(=O)COc1ccc(C(C)(C)C)cc1C(C)(C)C	ZINC000133451518	1293745182	/nfs/dbraw/zinc/74/51/82/1293745182.db2.gz	BRENDITZBXSYBF-CQSZACIVSA-N	0	3	344.455	3.115	20	30		EGEDHN
N#CC(C(=O)CCc1nc(C2CCCC2)no1)c1nc2ccccc2[nH]1	ZINC000134964623	1293784989	/nfs/dbraw/zinc/78/49/89/1293784989.db2.gz	NFJJMINHTACBMF-CYBMUJFWSA-N	0	3	349.394	3.413	20	30		EGEDHN
N#CC(C(=O)C=CSCc1ccco1)c1nnc2n1CCCCC2	ZINC000151029011	1293903590	/nfs/dbraw/zinc/90/35/90/1293903590.db2.gz	PIOBBMMCOVPJLS-DNGMOHDESA-N	0	3	342.424	3.221	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)CO[C@@H](C)CC)cc1	ZINC000152323705	1293964543	/nfs/dbraw/zinc/96/45/43/1293964543.db2.gz	BGXZVNWSLGZDAS-WMLDXEAASA-N	0	3	330.428	3.492	20	30		EGEDHN
CC[C@H](CC(=O)C(C#N)C(=O)NC1CCCC1)c1ccc(OC)cc1	ZINC000152457477	1293970068	/nfs/dbraw/zinc/97/00/68/1293970068.db2.gz	OCPYJRHBLOZNBU-RDTXWAMCSA-N	0	3	342.439	3.347	20	30		EGEDHN
CCCNC(=O)C1(NCc2ccc(O[C@@H](C)C#N)cc2)CCCCC1	ZINC000154539779	1294059409	/nfs/dbraw/zinc/05/94/09/1294059409.db2.gz	MIWLDWRNENPMDI-INIZCTEOSA-N	0	3	343.471	3.296	20	30		EGEDHN
N#CC(C(=O)CCc1nnc(C2CCCC2)o1)c1nc2ccccc2[nH]1	ZINC000161177479	1294286923	/nfs/dbraw/zinc/28/69/23/1294286923.db2.gz	DILGZHSODDFEJH-ZDUSSCGKSA-N	0	3	349.394	3.413	20	30		EGEDHN
C[C@H](CCc1ccccc1F)C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000174013088	1294476889	/nfs/dbraw/zinc/47/68/89/1294476889.db2.gz	WNBVNZCAEMKHCR-UKRRQHHQSA-N	0	3	339.370	3.137	20	30		EGEDHN
C=CCc1cc(C[N@@H+]2CCC[C@H](C3(C)OCCO3)C2)c([O-])c(OC)c1	ZINC000182829052	1295076747	/nfs/dbraw/zinc/07/67/47/1295076747.db2.gz	DLKREOHJORGVAW-KRWDZBQOSA-N	0	3	347.455	3.104	20	30		EGEDHN
C=CCc1cc(C[N@H+]2CCC[C@H](C3(C)OCCO3)C2)c([O-])c(OC)c1	ZINC000182829052	1295076753	/nfs/dbraw/zinc/07/67/53/1295076753.db2.gz	DLKREOHJORGVAW-KRWDZBQOSA-N	0	3	347.455	3.104	20	30		EGEDHN
N#CC(C(=O)CCNC(=O)c1ccc2ccccc2c1)c1ccccn1	ZINC000193252172	1295846404	/nfs/dbraw/zinc/84/64/04/1295846404.db2.gz	LBCVFUMALIPDDQ-SFHVURJKSA-N	0	3	343.386	3.231	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@H](C)Oc1cccc(Cl)c1	ZINC000193371833	1295858694	/nfs/dbraw/zinc/85/86/94/1295858694.db2.gz	LEHLFHXPVWGRSK-WFASDCNBSA-N	0	3	336.819	3.123	20	30		EGEDHN
N#CC(C(=O)COc1ccc(F)cc1Cl)C(=O)Nc1ccccc1	ZINC000193444313	1295870913	/nfs/dbraw/zinc/87/09/13/1295870913.db2.gz	AZLBZWSENVJROW-CYBMUJFWSA-N	0	3	346.745	3.205	20	30		EGEDHN
FC(F)(F)Oc1ccc(C#CCN2CC[C@@H]3OCCC[C@H]3C2)cc1	ZINC000245985397	1296333688	/nfs/dbraw/zinc/33/36/88/1296333688.db2.gz	ZOTSCDHHSHXVAS-RDJZCZTQSA-N	0	3	339.357	3.438	20	30		EGEDHN
CC[C@H](C)c1ccc(NC(=O)C(C#N)C(=O)C[C@H]2CCCO2)cc1	ZINC000249727673	1296450627	/nfs/dbraw/zinc/45/06/27/1296450627.db2.gz	QZONXRVNYMZEGY-IAOVAPTHSA-N	0	3	328.412	3.417	20	30		EGEDHN
N#CCc1ccnc(NC(=O)NC[C@H](c2ccccc2)N2CCCC2)c1	ZINC000871719227	1296498729	/nfs/dbraw/zinc/49/87/29/1296498729.db2.gz	USCVLLLMDDSQCH-GOSISDBHSA-N	0	3	349.438	3.106	20	30		EGEDHN
CCOc1ccc(O)c(/C=N\CCN(C)Cc2ccc(F)cc2)c1	ZINC000255383021	1296527256	/nfs/dbraw/zinc/52/72/56/1296527256.db2.gz	ZQKVKWYOAVUQFF-BKUYFWCQSA-N	0	3	330.403	3.481	20	30		EGEDHN
CN(C)[C@@H](C/N=C/c1ccc(O)c(O)c1O)c1ccc(Cl)cc1	ZINC000746815352	1298663879	/nfs/dbraw/zinc/66/38/79/1298663879.db2.gz	HRLGXEJHVZJFSK-FRSZACSASA-N	0	3	334.803	3.179	20	30		EGEDHN
CN(C(=O)C#Cc1ccccc1)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000747422019	1298780376	/nfs/dbraw/zinc/78/03/76/1298780376.db2.gz	OVVZFROBKKXTGC-OAQYLSRUSA-N	0	3	332.447	3.161	20	30		EGEDHN
C#CCN(C[C@H](O)COc1ccccc1F)[C@@H]1CCc2ccccc21	ZINC000747528701	1298796830	/nfs/dbraw/zinc/79/68/30/1298796830.db2.gz	NUBMJGONAXHPJE-FXAWDEMLSA-N	0	3	339.410	3.188	20	30		EGEDHN
C=C(Cl)C[C@@H](N)C(=O)NCc1ccc(-c2csc(C)n2)s1	ZINC000876565496	1298832338	/nfs/dbraw/zinc/83/23/38/1298832338.db2.gz	KHAPMEAQKTWXQD-LLVKDONJSA-N	0	3	341.889	3.266	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)Cc1ccc(N2CCC(O)CC2)cc1	ZINC000876574134	1298839735	/nfs/dbraw/zinc/83/97/35/1298839735.db2.gz	NLCUSHMIUHNWHC-UHFFFAOYSA-N	0	3	335.451	3.151	20	30		EGEDHN
C=C(Cl)C[C@H](N)C(=O)N(C)Cc1cccc(OC(F)(F)F)c1	ZINC000876704323	1298932643	/nfs/dbraw/zinc/93/26/43/1298932643.db2.gz	YFVOWCKYVJXPTM-LBPRGKRZSA-N	0	3	336.741	3.014	20	30		EGEDHN
C=CC[C@H](CC)NCc1cc(C2CN(C(=O)OC(C)(C)C)C2)no1	ZINC000877496996	1299348151	/nfs/dbraw/zinc/34/81/51/1299348151.db2.gz	AXFZQYKPDTYPOH-AWEZNQCLSA-N	0	3	335.448	3.453	20	30		EGEDHN
CC[C@H]1CN(C(C)=O)[C@@H](CC)CN1CCCOc1ccc(C#N)cc1	ZINC000752090842	1299692878	/nfs/dbraw/zinc/69/28/78/1299692878.db2.gz	DKYJHDPOCKQXHJ-OALUTQOASA-N	0	3	343.471	3.048	20	30		EGEDHN
CCc1cc(N=NC2CN(C(C)C)C[C@@H]2C)nc(-c2ccccn2)n1	ZINC000754261031	1300112442	/nfs/dbraw/zinc/11/24/42/1300112442.db2.gz	TWNZXVYOEHRMGS-AWEZNQCLSA-N	0	3	338.459	3.229	20	30		EGEDHN
N#Cc1ccc(-c2ccn(CN3CC[C@H](C4CCOCC4)C3)n2)cc1	ZINC000754782619	1300214953	/nfs/dbraw/zinc/21/49/53/1300214953.db2.gz	JHYSTNUWSUHAIS-IBGZPJMESA-N	0	3	336.439	3.128	20	30		EGEDHN
C#CC[C@H](NC(=O)NCCN(C)Cc1ccccc1)c1ccccc1	ZINC000757017140	1300612649	/nfs/dbraw/zinc/61/26/49/1300612649.db2.gz	WIFABANXWYSSLN-FQEVSTJZSA-N	0	3	335.451	3.182	20	30		EGEDHN
N#Cc1c2[nH]c3ccccc3n2c(=O)cc1CN1CCC2(CC2)CC1	ZINC000761063468	1301398375	/nfs/dbraw/zinc/39/83/75/1301398375.db2.gz	WJBVGSXXVXSFSX-HNNXBMFYSA-N	0	3	332.407	3.100	20	30		EGEDHN
C[C@H](N)c1cn(CCC(C#N)(c2ccccc2)c2ccccc2)nn1	ZINC000881038657	1301404135	/nfs/dbraw/zinc/40/41/35/1301404135.db2.gz	HIINVYSRZMIIDQ-INIZCTEOSA-N	0	3	331.423	3.198	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1	ZINC000763928159	1301983152	/nfs/dbraw/zinc/98/31/52/1301983152.db2.gz	BOACVQANVCMYKP-BBRMVZONSA-N	0	3	345.399	3.104	20	30		EGEDHN
CN(CCOC(C)(C)C)CC(=O)C(C#N)c1nc2ccccc2s1	ZINC000767905371	1302781145	/nfs/dbraw/zinc/78/11/45/1302781145.db2.gz	MEXHGYOYLDJXRK-CYBMUJFWSA-N	0	3	345.468	3.219	20	30		EGEDHN
C[C@H](C#N)Oc1ccccc1NC(=O)NCCN1CCCC(C)(C)C1	ZINC000770655084	1303301073	/nfs/dbraw/zinc/30/10/73/1303301073.db2.gz	SUPUXIMMCIWJFO-OAHLLOKOSA-N	0	3	344.459	3.221	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)CCCC(F)(F)F)cc1	ZINC000771261395	1303381913	/nfs/dbraw/zinc/38/19/13/1303381913.db2.gz	OHUFLSFEJDVUIJ-LBPRGKRZSA-N	0	3	328.290	3.075	20	30		EGEDHN
C=CCC1(O)CCN(Cc2cc(=O)oc3c(C)c(C)ccc23)CC1	ZINC000886768431	1303591135	/nfs/dbraw/zinc/59/11/35/1303591135.db2.gz	ANYSSJZVISBQPR-UHFFFAOYSA-N	0	3	327.424	3.313	20	30		EGEDHN
C#CCSCCNCc1ccc(-c2ccc(C(=O)OC)cc2)o1	ZINC000775953925	1304069571	/nfs/dbraw/zinc/06/95/71/1304069571.db2.gz	DBFWKGNNXOMSEI-UHFFFAOYSA-N	0	3	329.421	3.189	20	30		EGEDHN
C[C@@H](NCCNC(=O)CC1CCCCC1)c1ccc(C#N)c(F)c1	ZINC000776746268	1304192402	/nfs/dbraw/zinc/19/24/02/1304192402.db2.gz	MMYJKNFLQPEVBE-CQSZACIVSA-N	0	3	331.435	3.435	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)c1cc(C)nc(Cl)c1	ZINC000778604566	1304472823	/nfs/dbraw/zinc/47/28/23/1304472823.db2.gz	CKAJRZSTSMPWTM-LBPRGKRZSA-N	0	3	343.770	3.013	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)CCCc2ccsc2)cc1	ZINC000783355859	1305083249	/nfs/dbraw/zinc/08/32/49/1305083249.db2.gz	OJDMIFPPYRPBCZ-INIZCTEOSA-N	0	3	342.420	3.427	20	30		EGEDHN
N#CCC[C@@H](NC(=O)NC[C@H]1Cc2ccccc2CN1)c1ccccc1	ZINC000891703678	1305140221	/nfs/dbraw/zinc/14/02/21/1305140221.db2.gz	DLXGCEQYNHYVBF-WOJBJXKFSA-N	0	3	348.450	3.045	20	30		EGEDHN
CC(C)(CO)CNN=Cc1ccc2c(c1)CCN2Cc1ccccc1	ZINC000794939254	1309627792	/nfs/dbraw/zinc/62/77/92/1309627792.db2.gz	YGHNBQOCRKRBAM-UHFFFAOYSA-N	0	3	337.467	3.191	20	30		EGEDHN
CCC(=O)N1CCCC[C@@H]1C(=O)C(C#N)c1ncc(C(C)(C)C)s1	ZINC000797572863	1310213590	/nfs/dbraw/zinc/21/35/90/1310213590.db2.gz	JUFJRGOOCSGOMC-QWHCGFSZSA-N	0	3	347.484	3.408	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)CCCC2CCOCC2)cc1	ZINC000798815938	1310445855	/nfs/dbraw/zinc/44/58/55/1310445855.db2.gz	FVLNOGBYTOULLB-SFHVURJKSA-N	0	3	342.439	3.493	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)Cc1ccc(Cl)s1	ZINC000802039399	1316976050	/nfs/dbraw/zinc/97/60/50/1316976050.db2.gz	HEZPEAXFUHCSRG-GFCCVEGCSA-N	0	3	326.849	3.349	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CC[C@H](NCc2ccc(Cl)s2)C1	ZINC001018969210	1316990212	/nfs/dbraw/zinc/99/02/12/1316990212.db2.gz	SBOMXDGTPRBPFP-ZDUSSCGKSA-N	0	3	349.887	3.393	20	30		EGEDHN
N#Cc1cc(CN[C@H]2CCN(C(=O)C[C@@H]3CC=CCC3)C2)ccc1F	ZINC001019244255	1317120794	/nfs/dbraw/zinc/12/07/94/1317120794.db2.gz	ZJYWNWZMDGNFIJ-QAPCUYQASA-N	0	3	341.430	3.134	20	30		EGEDHN
CC1(C(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)CCCCC1	ZINC001019324218	1317168918	/nfs/dbraw/zinc/16/89/18/1317168918.db2.gz	YBVDRYUMOWDVDC-AWEZNQCLSA-N	0	3	331.485	3.281	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H](NCc2ccccc2N(C)C)C1	ZINC001019331712	1317173120	/nfs/dbraw/zinc/17/31/20/1317173120.db2.gz	BQMWQBBUXCCXMK-PXNSSMCTSA-N	0	3	329.488	3.045	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@H](NCc2ccc(C#N)s2)C1)C1CCCC1	ZINC001019632179	1317311524	/nfs/dbraw/zinc/31/15/24/1317311524.db2.gz	DDXCQUWIYTULCJ-HIFRSBDPSA-N	0	3	331.485	3.137	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1F)CC1CCN(C(=O)C(C)C)CC1	ZINC000957676853	1317548479	/nfs/dbraw/zinc/54/84/79/1317548479.db2.gz	FUQNBRFUKJNRQH-UHFFFAOYSA-N	0	3	345.462	3.414	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)cc1C#N	ZINC000807738790	1317581869	/nfs/dbraw/zinc/58/18/69/1317581869.db2.gz	GVKPKQQCVMBSSN-OXQOHEQNSA-N	0	3	333.435	3.260	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)cc1	ZINC000807738236	1317581962	/nfs/dbraw/zinc/58/19/62/1317581962.db2.gz	CBVOPSPBVVIDIE-LAUBAEHRSA-N	0	3	348.446	3.091	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)c2csc(C)c2C)C1	ZINC001020193372	1317587282	/nfs/dbraw/zinc/58/72/82/1317587282.db2.gz	SGWOUXKETDYIJE-HAQNSBGRSA-N	0	3	343.290	3.124	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)Cc2coc3ccc(C)cc23)C1	ZINC001020204168	1317593009	/nfs/dbraw/zinc/59/30/09/1317593009.db2.gz	XXSGASOHRDAFCH-SHTZXODSSA-N	0	3	332.831	3.273	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@H](NC(=O)[C@H]3CCCC34CC4)C2)c(F)c1	ZINC001020290167	1317628843	/nfs/dbraw/zinc/62/88/43/1317628843.db2.gz	KBIOROGPJAUUOF-BRWVUGGUSA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H](C)c2ccc(Cl)cc2)C1	ZINC001020540079	1317753083	/nfs/dbraw/zinc/75/30/83/1317753083.db2.gz	PALMLAUEUBSDBI-CQDKDKBSSA-N	0	3	327.255	3.433	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@H](NCc3cc(F)ccc3OC)C2)CC1	ZINC001020544247	1317758429	/nfs/dbraw/zinc/75/84/29/1317758429.db2.gz	NSBYUQKLRZJIBO-IYARVYRRSA-N	0	3	346.446	3.318	20	30		EGEDHN
CC1(C)CC[C@@H](C(=O)N[C@H]2C[C@H](NCc3ccc(C#N)cc3F)C2)C1	ZINC001020561873	1317772847	/nfs/dbraw/zinc/77/28/47/1317772847.db2.gz	MZWCCPBBZFQHDD-DJIMGWMZSA-N	0	3	343.446	3.260	20	30		EGEDHN
C#C[C@@H](C)NCc1ccc(OC)c(OCc2ccc([N+](=O)[O-])cc2)c1	ZINC000809683141	1317861564	/nfs/dbraw/zinc/86/15/64/1317861564.db2.gz	QYVQKOGXWRSUQF-CQSZACIVSA-N	0	3	340.379	3.294	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CN(C)CCCn1ccnc1C	ZINC000809752555	1317890838	/nfs/dbraw/zinc/89/08/38/1317890838.db2.gz	GFHYUJSBFAPXEY-UHFFFAOYSA-N	0	3	331.847	3.379	20	30		EGEDHN
CC(C)n1ncc2cc(/C=C3/C(=O)c4ncnn4C3C)c(Cl)nc21	ZINC000905079885	1317920404	/nfs/dbraw/zinc/92/04/04/1317920404.db2.gz	GNNAIGIAQKODFA-JOZRWXFHSA-N	0	3	342.790	3.098	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@H](NC(=O)C3(F)CCCCC3)C2)c(F)c1	ZINC001020877933	1317979299	/nfs/dbraw/zinc/97/92/99/1317979299.db2.gz	PTEXDJKHMJCRHA-WKILWMFISA-N	0	3	347.409	3.107	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)N[C@H]2C[C@H](NCc3ccc(C#N)cc3F)C2)CC1	ZINC001020952058	1318010325	/nfs/dbraw/zinc/01/03/25/1318010325.db2.gz	DBMHZGIDBXDYCT-CXHKNCAGSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc(C)c(F)cc2Cl)C1	ZINC001020987654	1318032562	/nfs/dbraw/zinc/03/25/62/1318032562.db2.gz	MXKWRFBNAPSJPY-XYPYZODXSA-N	0	3	331.218	3.390	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)C2(c3ccccc3)CCCC2)C1	ZINC001021016546	1318047324	/nfs/dbraw/zinc/04/73/24/1318047324.db2.gz	BILBICSNYLMOGP-QAQDUYKDSA-N	0	3	332.875	3.488	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@H](C)c2cccc(Cl)c2)C1	ZINC001021074367	1318069074	/nfs/dbraw/zinc/06/90/74/1318069074.db2.gz	PWBCMFOOCCYNSO-KCPJHIHWSA-N	0	3	327.255	3.433	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccsc2C#N)C1	ZINC000906382695	1318090057	/nfs/dbraw/zinc/09/00/57/1318090057.db2.gz	RJVIBGVTTQNCRU-DZGCQCFKSA-N	0	3	325.437	3.185	20	30		EGEDHN
Cc1coc(C(=O)NC2C[C@H]3CC[C@@H](C2)N3Cc2ccc(C#N)cc2)c1	ZINC001021355607	1318206713	/nfs/dbraw/zinc/20/67/13/1318206713.db2.gz	UCBYNTASUWNZBI-YQQQUEKLSA-N	0	3	349.434	3.385	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)cc1F	ZINC000959888185	1318252333	/nfs/dbraw/zinc/25/23/33/1318252333.db2.gz	LFMYDVBNBPTJRH-YOEHRIQHSA-N	0	3	331.435	3.214	20	30		EGEDHN
C[C@@H](C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)cc1F)C1CC1	ZINC000959945756	1318278790	/nfs/dbraw/zinc/27/87/90/1318278790.db2.gz	ZMGPPUFTBHQUNV-KDOFPFPSSA-N	0	3	343.446	3.214	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)C2=CCCC2)c(F)c1	ZINC000959956071	1318287382	/nfs/dbraw/zinc/28/73/82/1318287382.db2.gz	BZMOFJUBMGHFOZ-SFHVURJKSA-N	0	3	341.430	3.278	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)s1	ZINC000959972807	1318295179	/nfs/dbraw/zinc/29/51/79/1318295179.db2.gz	SJNYTSLOOFGPDA-BBRMVZONSA-N	0	3	331.485	3.137	20	30		EGEDHN
CC(C)(F)C(=O)N1CCC[C@@H]2CN(Cc3cccc(C#N)c3)CC[C@@H]21	ZINC001021494390	1318298018	/nfs/dbraw/zinc/29/80/18/1318298018.db2.gz	AXHMFTFZQBMHAQ-MSOLQXFVSA-N	0	3	343.446	3.119	20	30		EGEDHN
C#C[C@H](NC(=O)NC[C@@H](c1cccs1)N1CCCC1)C(C)(C)C	ZINC000811992719	1318304207	/nfs/dbraw/zinc/30/42/07/1318304207.db2.gz	LSDKHJCZKHVJKT-HOCLYGCPSA-N	0	3	333.501	3.232	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@@H](CCCN3C(=O)c3ccco3)C2)c1	ZINC001021507417	1318324758	/nfs/dbraw/zinc/32/47/58/1318324758.db2.gz	YTYKKWQDXIEBFG-RBUKOAKNSA-N	0	3	349.434	3.278	20	30		EGEDHN
C=CCSc1nc2ccccc2n1CN1CC[C@@H](n2cccn2)C1	ZINC000812293977	1318359549	/nfs/dbraw/zinc/35/95/49/1318359549.db2.gz	BYBWPGBNCBMDLY-OAHLLOKOSA-N	0	3	339.468	3.415	20	30		EGEDHN
C#C[C@@H](C)N(C)C(=O)NC[C@H](c1ccc(Cl)cc1)N(C)CCC	ZINC000812345589	1318371594	/nfs/dbraw/zinc/37/15/94/1318371594.db2.gz	FOSKBKCSKVXQHE-RHSMWYFYSA-N	0	3	335.879	3.386	20	30		EGEDHN
C#C[C@@H](C)N(C)C(=O)NC[C@@H](c1ccc(CC(C)C)cc1)N(C)C	ZINC000812390261	1318381000	/nfs/dbraw/zinc/38/10/00/1318381000.db2.gz	ZFUXCZKTRCSCFA-APWZRJJASA-N	0	3	329.488	3.151	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@@H](CCCN3C(=O)C3CC=CC3)C2)cc1	ZINC001021552033	1318392402	/nfs/dbraw/zinc/39/24/02/1318392402.db2.gz	VXHXGRATBZSSCV-SFTDATJTSA-N	0	3	349.478	3.337	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@@H](CCCN3C(=O)C3=CCCC3)C2)cc1	ZINC001021561651	1318410224	/nfs/dbraw/zinc/41/02/24/1318410224.db2.gz	FPJPXEKONOQEFU-SFTDATJTSA-N	0	3	349.478	3.481	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2scc(C)c2Cl)C1	ZINC001021586718	1318431769	/nfs/dbraw/zinc/43/17/69/1318431769.db2.gz	DARUGVZTAHLGIA-UONOGXRCSA-N	0	3	336.888	3.270	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc(F)ccc1F	ZINC000960270617	1318436511	/nfs/dbraw/zinc/43/65/11/1318436511.db2.gz	HJNOMVKHCOXYEP-QZTJIDSGSA-N	0	3	328.362	3.136	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc(OCC=C)cc1	ZINC000960276092	1318440065	/nfs/dbraw/zinc/44/00/65/1318440065.db2.gz	SCBKLAOBJNVSKD-NHCUHLMSSA-N	0	3	348.446	3.423	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cccnc1C1CC1	ZINC000960281571	1318443283	/nfs/dbraw/zinc/44/32/83/1318443283.db2.gz	MUSKXBLEUBKYJF-UYAOXDASSA-N	0	3	333.435	3.130	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cncc2[nH]ccc21	ZINC000960282449	1318443663	/nfs/dbraw/zinc/44/36/63/1318443663.db2.gz	TUEWEVKGCIXGSG-UYAOXDASSA-N	0	3	346.434	3.124	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)CC2(c3ccccc3)CC2)C1	ZINC001021601014	1318444566	/nfs/dbraw/zinc/44/45/66/1318444566.db2.gz	BKXVLGBVDMMGPB-AZUAARDMSA-N	0	3	336.479	3.054	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@@H]1[C@@H]2Cc3ccccc3[C@@H]21	ZINC000960315316	1318456607	/nfs/dbraw/zinc/45/66/07/1318456607.db2.gz	WHBCFJUTKPFAOU-QMCAAQAGSA-N	0	3	344.458	3.130	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc2cccnc2s1	ZINC000960319151	1318460006	/nfs/dbraw/zinc/46/00/06/1318460006.db2.gz	ZMRQMLWUFYKAHX-SJLPKXTDSA-N	0	3	349.459	3.468	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cscc2Cl)C1	ZINC001021612120	1318459957	/nfs/dbraw/zinc/45/99/57/1318459957.db2.gz	XAEKQMTXVAVMNI-BBRMVZONSA-N	0	3	336.888	3.351	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ncoc1C(C)C	ZINC000960323505	1318461796	/nfs/dbraw/zinc/46/17/96/1318461796.db2.gz	GZVBIWUTAFWTJL-IAGOWNOFSA-N	0	3	339.439	3.360	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)CCc2cccc(Cl)c2)C1	ZINC001021642406	1318500420	/nfs/dbraw/zinc/50/04/20/1318500420.db2.gz	QDVCRHGHWVWIIE-PKOBYXMFSA-N	0	3	344.886	3.219	20	30		EGEDHN
COc1ccc(CN(C)C[C@H]2CCCN2C(=O)CC(C)C)cc1C#N	ZINC000960382607	1318511624	/nfs/dbraw/zinc/51/16/24/1318511624.db2.gz	IPPFLGNNZOZHKR-GOSISDBHSA-N	0	3	343.471	3.036	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc[nH]c2C(C)C)C1	ZINC001021654558	1318516819	/nfs/dbraw/zinc/51/68/19/1318516819.db2.gz	FVJXHJAKNXLAAA-SJLPKXTDSA-N	0	3	327.472	3.088	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc[nH]c2C(C)C)C1	ZINC001021654556	1318516951	/nfs/dbraw/zinc/51/69/51/1318516951.db2.gz	FVJXHJAKNXLAAA-AEFFLSMTSA-N	0	3	327.472	3.088	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(F)c(Cl)c2)C1	ZINC001021658470	1318521077	/nfs/dbraw/zinc/52/10/77/1318521077.db2.gz	NPJBKKYEVGOIEJ-QAPCUYQASA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(Cl)c(C)c2)C1	ZINC001021665447	1318527625	/nfs/dbraw/zinc/52/76/25/1318527625.db2.gz	KNXSXBYIVROTNT-AEFFLSMTSA-N	0	3	330.859	3.208	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)Cc2cc(C)cc(C)c2)C1	ZINC001021666047	1318528332	/nfs/dbraw/zinc/52/83/32/1318528332.db2.gz	OBOVWMTWPVFBRB-SFTDATJTSA-N	0	3	338.495	3.182	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(Cl)c(F)c2)C1	ZINC001021678358	1318547756	/nfs/dbraw/zinc/54/77/56/1318547756.db2.gz	XHWLQPACKHECHT-MAUKXSAKSA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(C)c(F)cc2Cl)C1	ZINC001021715934	1318595336	/nfs/dbraw/zinc/59/53/36/1318595336.db2.gz	BDGKXFFDHXTJOW-KSSFIOAISA-N	0	3	348.849	3.347	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2coc3ccc(F)cc32)C1	ZINC001021725318	1318616520	/nfs/dbraw/zinc/61/65/20/1318616520.db2.gz	RLZTZDGPLBBNHT-RDTXWAMCSA-N	0	3	340.398	3.132	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc3c(s2)CCC3)C1	ZINC001021727899	1318624607	/nfs/dbraw/zinc/62/46/07/1318624607.db2.gz	OZDBBKVYVLQVPE-SJORKVTESA-N	0	3	342.508	3.187	20	30		EGEDHN
CCCCCCCS(=O)(=O)N1CCN(C2CCC2)C[C@H](C)C1	ZINC000813752829	1318626883	/nfs/dbraw/zinc/62/68/83/1318626883.db2.gz	YPAYMUOKEFIEIT-INIZCTEOSA-N	0	3	330.538	3.093	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)Cc2ccc(C)c(C)c2)C1	ZINC001021730053	1318632827	/nfs/dbraw/zinc/63/28/27/1318632827.db2.gz	KWJBQPNTHVQZPF-NHCUHLMSSA-N	0	3	338.495	3.182	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)CCc2ccc(CC)cc2)C1	ZINC001021733294	1318639149	/nfs/dbraw/zinc/63/91/49/1318639149.db2.gz	LOHKNPNYHFKVPZ-RTWAWAEBSA-N	0	3	338.495	3.128	20	30		EGEDHN
CC[C@@H](SC)C(=O)N1CCC[C@H]1CN(C)Cc1cccc(C#N)c1	ZINC000960558344	1318689082	/nfs/dbraw/zinc/68/90/82/1318689082.db2.gz	SRCZAQHALSDYAL-ZWKOTPCHSA-N	0	3	345.512	3.123	20	30		EGEDHN
C[C@@]1(C(=O)N[C@H]2C[C@@H](NCc3ccc(C#N)cc3F)C2)CC=CCC1	ZINC001022132558	1318812647	/nfs/dbraw/zinc/81/26/47/1318812647.db2.gz	JIYVMFGWUULALD-FUHIMQAGSA-N	0	3	341.430	3.181	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)Nc1cnn(C[C@H]2CCCO2)c1	ZINC000912483109	1318893105	/nfs/dbraw/zinc/89/31/05/1318893105.db2.gz	YKEQZIWXPVUDPW-IAGOWNOFSA-N	0	3	336.480	3.079	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)[C@@H]2CCC[C@H]2CCC)C1	ZINC001022333169	1318895496	/nfs/dbraw/zinc/89/54/96/1318895496.db2.gz	NWWJDFILMLUFTK-APIJFGDWSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc(-n3cccc3)cc2)C1	ZINC001022379402	1318914005	/nfs/dbraw/zinc/91/40/05/1318914005.db2.gz	CYARRKJNGCHFQO-IYBDPMFKSA-N	0	3	329.831	3.080	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)[C@H]1CCC1(C)C	ZINC000960813571	1318932572	/nfs/dbraw/zinc/93/25/72/1318932572.db2.gz	GMSVHKGVIZPNMA-RBUKOAKNSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@H]2CN(C)C[C@@H]2CC(C)(C)CO2)CC1	ZINC000960835263	1318965855	/nfs/dbraw/zinc/96/58/55/1318965855.db2.gz	XPGZZCNQNGGEJP-OALUTQOASA-N	0	3	348.531	3.471	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)C1(C)CC=CC1	ZINC000960836367	1318967745	/nfs/dbraw/zinc/96/77/45/1318967745.db2.gz	FWOGBMWZNFKSRL-IBGZPJMESA-N	0	3	337.467	3.337	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2C[C@@H](NCc3cc(C)ccc3F)C2)cc1	ZINC001022527305	1318978879	/nfs/dbraw/zinc/97/88/79/1318978879.db2.gz	UIRCVPBMWWKYJH-KDURUIRLSA-N	0	3	336.410	3.166	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)C(C)(C)C(F)F	ZINC000960851384	1318991588	/nfs/dbraw/zinc/99/15/88/1318991588.db2.gz	LYEMAHMMPLYYIL-INIZCTEOSA-N	0	3	349.425	3.272	20	30		EGEDHN
C[C@@H]1CCCC[C@H]1C(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001022620882	1319020043	/nfs/dbraw/zinc/02/00/43/1319020043.db2.gz	SNSQTFSMLQKESA-NKGKWGDASA-N	0	3	343.446	3.260	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)[C@H]2CCC[C@H](OC)C2)cc1	ZINC000815907793	1319071108	/nfs/dbraw/zinc/07/11/08/1319071108.db2.gz	KPJVCTMDOCXJCL-BHYGNILZSA-N	0	3	328.412	3.102	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc(-c3ccccc3)nc2)C1	ZINC001022881109	1319147613	/nfs/dbraw/zinc/14/76/13/1319147613.db2.gz	AOGXCMAXYWSXEL-CALCHBBNSA-N	0	3	341.842	3.352	20	30		EGEDHN
O=C(C1CC1)N1CCC[C@@H]([C@H]2CCN(CC#Cc3ccccc3)C2)C1	ZINC000961075756	1319186684	/nfs/dbraw/zinc/18/66/84/1319186684.db2.gz	FEKHOAINCOHCDA-RTWAWAEBSA-N	0	3	336.479	3.009	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]([C@H]2CCN(Cc3cnoc3C)C2)C1	ZINC000961229633	1319359736	/nfs/dbraw/zinc/35/97/36/1319359736.db2.gz	NCCJBTIUVPRSMI-SJORKVTESA-N	0	3	345.487	3.256	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]([C@H]2CCN(Cc3cnoc3C)C2)C1	ZINC000961229630	1319360069	/nfs/dbraw/zinc/36/00/69/1319360069.db2.gz	NCCJBTIUVPRSMI-IRXDYDNUSA-N	0	3	345.487	3.256	20	30		EGEDHN
CC[C@H](C#N)Oc1cc(CN[C@H](C)c2cnccc2N)ccc1OC	ZINC000817917037	1319459703	/nfs/dbraw/zinc/45/97/03/1319459703.db2.gz	DKUCBAGDRHHCOZ-UKRRQHHQSA-N	0	3	340.427	3.035	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](C2CCN(C(=O)C(C)(C)F)CC2)C1	ZINC000961303332	1319463191	/nfs/dbraw/zinc/46/31/91/1319463191.db2.gz	BCKFHXSIHIRJOY-OAHLLOKOSA-N	0	3	330.875	3.438	20	30		EGEDHN
C#CCN(C)CCCNC(=O)[C@@H](C)c1ccc(Cl)c(Cl)c1	ZINC000818602735	1319567281	/nfs/dbraw/zinc/56/72/81/1319567281.db2.gz	BAYTUOKVIUMJKO-LBPRGKRZSA-N	0	3	327.255	3.168	20	30		EGEDHN
C#CCN(C)CCCNC(=O)/C=C(\C)c1ccc(C(F)(F)F)cc1	ZINC000818608948	1319568166	/nfs/dbraw/zinc/56/81/66/1319568166.db2.gz	AGDAEWOAHIDYDL-BUHFOSPRSA-N	0	3	338.373	3.180	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](C2CCN(C(=O)Cc3ccc[nH]3)CC2)C1	ZINC000961434881	1319589323	/nfs/dbraw/zinc/58/93/23/1319589323.db2.gz	JGZWGNFNEUATMF-KRWDZBQOSA-N	0	3	349.906	3.260	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc(C)c(C)cc2Cl)C1	ZINC001023529746	1319635833	/nfs/dbraw/zinc/63/58/33/1319635833.db2.gz	INGIPAZMCYUQRH-INIZCTEOSA-N	0	3	332.875	3.422	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC000819137987	1319645828	/nfs/dbraw/zinc/64/58/28/1319645828.db2.gz	GHSXENDOBJMHOE-UHFFFAOYSA-N	0	3	330.472	3.378	20	30		EGEDHN
Cc1ccc(OC(F)F)c(CNC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000819150100	1319649568	/nfs/dbraw/zinc/64/95/68/1319649568.db2.gz	PRQMSBBRIZTECU-MRXNPFEDSA-N	0	3	332.350	3.291	20	30		EGEDHN
C[C@@H]1C[C@@H](C)CN(CC(=O)C(C#N)c2nc3ccccc3s2)C1	ZINC000916622791	1319686712	/nfs/dbraw/zinc/68/67/12/1319686712.db2.gz	LOCDRXJCGRMXGH-MGPQQGTHSA-N	0	3	327.453	3.450	20	30		EGEDHN
N#Cc1ccccc1CNCC1CC(NC(=O)C(F)=C2CCCC2)C1	ZINC000961709363	1319709140	/nfs/dbraw/zinc/70/91/40/1319709140.db2.gz	UWLSCBXSODADBT-UHFFFAOYSA-N	0	3	341.430	3.340	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2[C@H]3CN(Cc4ccc(F)cc4C)C[C@H]32)C1	ZINC000961732732	1319718059	/nfs/dbraw/zinc/71/80/59/1319718059.db2.gz	NKTXVHPLGKWSQT-PIIMJCKOSA-N	0	3	328.431	3.037	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)COc1cccc(Cl)c1	ZINC000916876349	1319718919	/nfs/dbraw/zinc/71/89/19/1319718919.db2.gz	ZTTHLPHHYIAKAB-OAHLLOKOSA-N	0	3	336.819	3.124	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)COc1ccccc1C(C)(C)C	ZINC000916877531	1319719257	/nfs/dbraw/zinc/71/92/57/1319719257.db2.gz	UAYTYOUNLCKJOC-HNNXBMFYSA-N	0	3	344.455	3.378	20	30		EGEDHN
CCOCCCC(=O)C(C#N)C(=O)Nc1c(CC)cccc1CC	ZINC000916905787	1319723312	/nfs/dbraw/zinc/72/33/12/1319723312.db2.gz	FIQULWRNFGCAPE-INIZCTEOSA-N	0	3	330.428	3.275	20	30		EGEDHN
N#CC(C(=O)Cc1coc2ccc3ccccc3c12)C(=O)NC1CC1	ZINC000916926823	1319726234	/nfs/dbraw/zinc/72/62/34/1319726234.db2.gz	YSMPJVQFWVLYDZ-MRXNPFEDSA-N	0	3	332.359	3.116	20	30		EGEDHN
N#CC(C(=O)CCn1c2ccccc2c2ccccc21)C(=O)NC1CC1	ZINC000916931132	1319726737	/nfs/dbraw/zinc/72/67/37/1319726737.db2.gz	NHLQAISVWBDSRH-KRWDZBQOSA-N	0	3	345.402	3.172	20	30		EGEDHN
CN(CCCOc1ccc(C#N)cc1)C[C@@H]1COc2ccccc2O1	ZINC000917022663	1319740395	/nfs/dbraw/zinc/74/03/95/1319740395.db2.gz	PIQVZSVBDVRASU-GOSISDBHSA-N	0	3	338.407	3.099	20	30		EGEDHN
CN(CC(=O)C(C#N)c1nc2ccccc2s1)Cc1ccco1	ZINC000917030769	1319741746	/nfs/dbraw/zinc/74/17/46/1319741746.db2.gz	ZDCPQDJFFJIKLG-CYBMUJFWSA-N	0	3	325.393	3.198	20	30		EGEDHN
N#Cc1ccccc1CNCC1CC(NC(=O)c2[nH]ccc2C2CC2)C1	ZINC000961917889	1319773981	/nfs/dbraw/zinc/77/39/81/1319773981.db2.gz	ARSQNIIEVNIGMX-UHFFFAOYSA-N	0	3	348.450	3.062	20	30		EGEDHN
C#CCN1CCC[C@@H](CNC(=O)c2ccc(-c3ccco3)s2)C1	ZINC001023678355	1319792894	/nfs/dbraw/zinc/79/28/94/1319792894.db2.gz	UUDCQYWRAOFJPZ-AWEZNQCLSA-N	0	3	328.437	3.083	20	30		EGEDHN
CC[C@@H](Cc1ccccc1C)C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000819952696	1319809602	/nfs/dbraw/zinc/80/96/02/1319809602.db2.gz	VASICXGZEOJJIQ-RDJZCZTQSA-N	0	3	335.407	3.306	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc(Cl)cc2Cl)C1	ZINC001023718622	1319855695	/nfs/dbraw/zinc/85/56/95/1319855695.db2.gz	ZWJVFXRUOVSVRH-CYBMUJFWSA-N	0	3	339.266	3.459	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc3cccc(F)c3o2)C1	ZINC001023758659	1319904592	/nfs/dbraw/zinc/90/45/92/1319904592.db2.gz	ZFFWQZCJKQHPDU-AWEZNQCLSA-N	0	3	328.387	3.037	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)c1ccc(CF)cc1	ZINC000824366722	1320251742	/nfs/dbraw/zinc/25/17/42/1320251742.db2.gz	FETFGRBOKBRHNX-UHFFFAOYSA-N	0	3	339.414	3.232	20	30		EGEDHN
COc1cc(CN(C)CC(C)(C)NC(=O)OC(C)(C)C)ccc1C#N	ZINC000826810529	1320406064	/nfs/dbraw/zinc/40/60/64/1320406064.db2.gz	SHGYRFHBEAVCQN-UHFFFAOYSA-N	0	3	347.459	3.302	20	30		EGEDHN
Cc1ccc([C@@H](C)N[C@H]2CCN(c3ccc(C#N)cc3)C2=O)s1	ZINC000839551614	1320936739	/nfs/dbraw/zinc/93/67/39/1320936739.db2.gz	DJGAWQVBISUBAZ-CJNGLKHVSA-N	0	3	325.437	3.384	20	30		EGEDHN
C=C(Br)CNC(=O)c1cccc(CN2CCCCC2)c1	ZINC000839585786	1320941179	/nfs/dbraw/zinc/94/11/79/1320941179.db2.gz	VWBPPKVOOHICCR-UHFFFAOYSA-N	0	3	337.261	3.311	20	30		EGEDHN
C[C@@H]1CN(CC(=O)C(C#N)c2nc3ccccc3s2)[C@@H](C)[C@H]1C	ZINC000842166251	1321356753	/nfs/dbraw/zinc/35/67/53/1321356753.db2.gz	JVWBDPYOHFJDFU-RFGFWPKPSA-N	0	3	327.453	3.449	20	30		EGEDHN
C[C@H](NC(=O)c1cccs1)C(=O)C(C#N)c1nc(C2CC2)cs1	ZINC000842938176	1321450962	/nfs/dbraw/zinc/45/09/62/1321450962.db2.gz	IYIGMYQMJGYHBX-ONGXEEELSA-N	0	3	345.449	3.077	20	30		EGEDHN
C[C@@H](NC(=O)CC(C)(C)C)C(=O)C(C#N)c1nc(C2CC2)cs1	ZINC000842947181	1321453115	/nfs/dbraw/zinc/45/31/15/1321453115.db2.gz	ZKGZQUCBUPXPJX-ZYHUDNBSSA-N	0	3	333.457	3.138	20	30		EGEDHN
CCc1cccc(CC)c1NC(=O)C(C#N)C(=O)C[C@H]1CCCO1	ZINC000845441027	1321707525	/nfs/dbraw/zinc/70/75/25/1321707525.db2.gz	BHDHCZJNLLJMER-CVEARBPZSA-N	0	3	328.412	3.028	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)CC2CC(F)(F)C2)C1	ZINC001103159722	1365415325	/nfs/dbraw/zinc/41/53/25/1365415325.db2.gz	WQULHTUJQATJFK-BXUZGUMPSA-N	0	3	334.838	3.249	20	30		EGEDHN
CC[C@](C)(OC)C(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847747670	1321900743	/nfs/dbraw/zinc/90/07/43/1321900743.db2.gz	MRHCYWBGGHLXTC-IBGZPJMESA-N	0	3	344.455	3.151	20	30		EGEDHN
C[C@H](COC(=O)c1cnc(C(F)(F)F)c(C#N)c1)N1CCCCC1	ZINC000847963200	1321917179	/nfs/dbraw/zinc/91/71/79/1321917179.db2.gz	OFFUZKUPWYMAQK-LLVKDONJSA-N	0	3	341.333	3.003	20	30		EGEDHN
N#CC(C(=O)Cc1cc2ccccc2o1)C(=O)NCc1ccccc1	ZINC000920107828	1322138049	/nfs/dbraw/zinc/13/80/49/1322138049.db2.gz	HBFDJXGVZBHBIS-KRWDZBQOSA-N	0	3	332.359	3.001	20	30		EGEDHN
CCc1cccc(CC)c1NC(=O)C(C#N)C(=O)[C@@H](C)OCC1CC1	ZINC000920789811	1322223090	/nfs/dbraw/zinc/22/30/90/1322223090.db2.gz	GNAJWDMWJDVBHZ-CXAGYDPISA-N	0	3	342.439	3.274	20	30		EGEDHN
CCOC(=O)N1CCC(/[NH+]=C\c2ccc(N(CC)CC)cc2[O-])CC1	ZINC000920944483	1322238397	/nfs/dbraw/zinc/23/83/97/1322238397.db2.gz	YBYCWIIDAGRDNU-ZHZULCJRSA-N	0	3	347.459	3.278	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)CCCc2cccnc2)cc1	ZINC000850759926	1322285921	/nfs/dbraw/zinc/28/59/21/1322285921.db2.gz	OZNBWPBPPLVLBC-SFHVURJKSA-N	0	3	335.407	3.314	20	30		EGEDHN
C[C@@H]([C@H](OC(=O)c1cccc(C#N)n1)c1ccccc1)N1CCCC1	ZINC000851134780	1322339154	/nfs/dbraw/zinc/33/91/54/1322339154.db2.gz	YKZWEESVXRZEIS-KXBFYZLASA-N	0	3	335.407	3.336	20	30		EGEDHN
N#Cc1ccc(Br)c(CNCCCNc2ccccn2)c1	ZINC000921822864	1322405607	/nfs/dbraw/zinc/40/56/07/1322405607.db2.gz	YUNBSBSEWSSISN-UHFFFAOYSA-N	0	3	345.244	3.308	20	30		EGEDHN
CCN(CC)C(=O)[C@H](Cc1ccccc1)N[C@H](C)CC(C)(C)C#N	ZINC000924530821	1323044048	/nfs/dbraw/zinc/04/40/48/1323044048.db2.gz	BVFJORHNOZWJKP-AEFFLSMTSA-N	0	3	329.488	3.384	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H](CNCc2ccn(C(C)C)n2)C1	ZINC001024090771	1323122623	/nfs/dbraw/zinc/12/26/23/1323122623.db2.gz	QJDRQODEZBMLJO-KRWDZBQOSA-N	0	3	346.519	3.395	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H](CNCc2ccn(C(C)C)n2)C1	ZINC001024090772	1323122765	/nfs/dbraw/zinc/12/27/65/1323122765.db2.gz	QJDRQODEZBMLJO-QGZVFWFLSA-N	0	3	346.519	3.395	20	30		EGEDHN
C#C[C@](C)(CC)NCC(=O)N[C@@H](C)c1ccc(Br)cc1	ZINC000852098928	1323145511	/nfs/dbraw/zinc/14/55/11/1323145511.db2.gz	ZKCNPPQHUDEHMY-BLLLJJGKSA-N	0	3	337.261	3.018	20	30		EGEDHN
C#C[C@@](C)(CC)NCC(=O)N1CC=C(c2c[nH]c3ccccc32)CC1	ZINC000852100922	1323147984	/nfs/dbraw/zinc/14/79/84/1323147984.db2.gz	KZNJJMNQBDOMSB-NRFANRHFSA-N	0	3	335.451	3.175	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H](CNCc2cc(C3CC3)no2)C1	ZINC001024137550	1323163209	/nfs/dbraw/zinc/16/32/09/1323163209.db2.gz	NOUNKIQQHRDWIT-MGPUTAFESA-N	0	3	345.487	3.483	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H](CNCc3nc(C)c(C)s3)C2)C1	ZINC001024146124	1323171936	/nfs/dbraw/zinc/17/19/36/1323171936.db2.gz	NSGQWKIYFZVVQO-MRXNPFEDSA-N	0	3	347.528	3.444	20	30		EGEDHN
CN(C(=O)C1CC=CC1)C1CCC(NCc2ccccc2C#N)CC1	ZINC000963171343	1323223735	/nfs/dbraw/zinc/22/37/35/1323223735.db2.gz	GRFUZOWRCAHHBA-UHFFFAOYSA-N	0	3	337.467	3.384	20	30		EGEDHN
CC(C)(C)C(=O)N1CCC[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001024246367	1323230407	/nfs/dbraw/zinc/23/04/07/1323230407.db2.gz	CGRSEMUVBWUDKA-AWEZNQCLSA-N	0	3	331.435	3.072	20	30		EGEDHN
C#CCCN(CCOC)Cc1ccc(C(=O)Nc2ccccc2)cc1	ZINC000852752236	1323235964	/nfs/dbraw/zinc/23/59/64/1323235964.db2.gz	RFHVVCDKKOQENT-UHFFFAOYSA-N	0	3	336.435	3.411	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1nccc2ccsc21	ZINC001024491985	1323444533	/nfs/dbraw/zinc/44/45/33/1323444533.db2.gz	IWBWDURQWHYZDV-OAHLLOKOSA-N	0	3	329.469	3.457	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccnn1-c1ccccc1	ZINC001024509119	1323456775	/nfs/dbraw/zinc/45/67/75/1323456775.db2.gz	RFSGLJVYUJYJRM-GOSISDBHSA-N	0	3	338.455	3.033	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1csc(C(F)(F)F)c1	ZINC001024528076	1323472602	/nfs/dbraw/zinc/47/26/02/1323472602.db2.gz	DXATZDVBFBVTBI-CYBMUJFWSA-N	0	3	344.402	3.375	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1csc(C(F)(F)F)c1	ZINC001024528077	1323474063	/nfs/dbraw/zinc/47/40/63/1323474063.db2.gz	DXATZDVBFBVTBI-ZDUSSCGKSA-N	0	3	344.402	3.375	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccc(OC)c(C(C)C)c1	ZINC001024534303	1323477873	/nfs/dbraw/zinc/47/78/73/1323477873.db2.gz	GUGWTKUCQOPTOL-SFHVURJKSA-N	0	3	342.483	3.426	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@@H]1CCc2ccc(F)cc2O1	ZINC001024554395	1323495242	/nfs/dbraw/zinc/49/52/42/1323495242.db2.gz	LSCXSYAYXMXQSC-MSOLQXFVSA-N	0	3	346.446	3.066	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@H]1CCc2cc(F)ccc21	ZINC001024556366	1323496134	/nfs/dbraw/zinc/49/61/34/1323496134.db2.gz	FTEAQWBHCZVFTB-MJGOQNOKSA-N	0	3	330.447	3.402	20	30		EGEDHN
C=C(C)CCN1CCCC[C@@H]1CNC(=O)c1snnc1C(C)C	ZINC001024726780	1323629151	/nfs/dbraw/zinc/62/91/51/1323629151.db2.gz	ATIDANBVTHFBJU-CQSZACIVSA-N	0	3	336.505	3.212	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccc2[nH]c(C)nc2c1	ZINC001024732468	1323634567	/nfs/dbraw/zinc/63/45/67/1323634567.db2.gz	ANYMXBOFRLNSQV-INIZCTEOSA-N	0	3	326.444	3.032	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cccc2[nH]c(C)nc21	ZINC001024743759	1323643559	/nfs/dbraw/zinc/64/35/59/1323643559.db2.gz	RXNVLWFYZGBMIS-HNNXBMFYSA-N	0	3	326.444	3.032	20	30		EGEDHN
C=C(Cl)CN1CCCC[C@@H]1CNC(=O)c1ccccc1CN(C)C	ZINC001024814366	1323718329	/nfs/dbraw/zinc/71/83/29/1323718329.db2.gz	RRXIIJQTIAQMTO-QGZVFWFLSA-N	0	3	349.906	3.085	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)C1CC(c2ccc(F)cc2)C1	ZINC001024825273	1323730680	/nfs/dbraw/zinc/73/06/80/1323730680.db2.gz	YSCHFJLPTTXTFX-AFMYVXGZSA-N	0	3	342.458	3.313	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccc(CC)c(CC)c1	ZINC001024830196	1323733901	/nfs/dbraw/zinc/73/39/01/1323733901.db2.gz	MVYAWQXFCYZLJG-FQEVSTJZSA-N	0	3	326.484	3.419	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCCC[C@@H]1CNCc1ccc(Cl)cc1F	ZINC001024901994	1323772029	/nfs/dbraw/zinc/77/20/29/1323772029.db2.gz	GAIICBZLEDPKGP-SWLSCSKDSA-N	0	3	337.826	3.109	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCCC[C@@H]1CNCc1cccc(Cl)c1F	ZINC001024902700	1323772565	/nfs/dbraw/zinc/77/25/65/1323772565.db2.gz	YBAGYXPUMHYJDR-TZMCWYRMSA-N	0	3	337.826	3.109	20	30		EGEDHN
Cc1cccc(Cl)c1CNC[C@H]1CCCCN1C(=O)[C@@H](C)C#N	ZINC001024903138	1323773285	/nfs/dbraw/zinc/77/32/85/1323773285.db2.gz	RUOGLTYQSBSFCV-LSDHHAIUSA-N	0	3	333.863	3.279	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCCC[C@@H]1CNCc1n[nH]c(C(C)C)n1	ZINC001025037801	1323840866	/nfs/dbraw/zinc/84/08/66/1323840866.db2.gz	BXBMJAPLJNKQEZ-OAHLLOKOSA-N	0	3	347.507	3.001	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCCC[C@H]1CN[C@@H](C)c1n[nH]c(CC)n1	ZINC001025039687	1323841574	/nfs/dbraw/zinc/84/15/74/1323841574.db2.gz	UYRNZTRDQKYHIX-GJZGRUSLSA-N	0	3	347.507	3.001	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCCC[C@@H]2CNCc2ncccc2C)cc1	ZINC001025038463	1323841826	/nfs/dbraw/zinc/84/18/26/1323841826.db2.gz	YCQDXJNWXYROTM-HXUWFJFHSA-N	0	3	347.462	3.156	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCCC[C@@H]1CNCc1c(C)noc1C	ZINC001025069577	1323870186	/nfs/dbraw/zinc/87/01/86/1323870186.db2.gz	LUUKBDBNUABCMA-APWZRJJASA-N	0	3	333.476	3.364	20	30		EGEDHN
CC(F)(F)CC(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)s1	ZINC001025071585	1323873674	/nfs/dbraw/zinc/87/36/74/1323873674.db2.gz	KDGRWAGSVSVIER-GFCCVEGCSA-N	0	3	341.427	3.136	20	30		EGEDHN
Cc1c[nH]cc1C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)s1	ZINC001025159798	1323930199	/nfs/dbraw/zinc/93/01/99/1323930199.db2.gz	MSIWQRGZMQTFAV-CQSZACIVSA-N	0	3	342.468	3.041	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc(F)cc1	ZINC001025190781	1323969684	/nfs/dbraw/zinc/96/96/84/1323969684.db2.gz	AZFVRUCXRFOAEL-MOPGFXCFSA-N	0	3	328.431	3.308	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc2c[nH]ccc-2n1	ZINC001025243697	1324040338	/nfs/dbraw/zinc/04/03/38/1324040338.db2.gz	DMSOPZWIFBBDNT-RBUKOAKNSA-N	0	3	338.455	3.208	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(C)sc1C	ZINC001025248451	1324048857	/nfs/dbraw/zinc/04/88/57/1324048857.db2.gz	ZYIJESWTKYYPPU-MSOLQXFVSA-N	0	3	330.497	3.457	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc(COC)o1	ZINC001025250531	1324051604	/nfs/dbraw/zinc/05/16/04/1324051604.db2.gz	KTAJBYGWRHGGHX-IRXDYDNUSA-N	0	3	332.444	3.071	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc2ncccc2o1	ZINC001025251754	1324055745	/nfs/dbraw/zinc/05/57/45/1324055745.db2.gz	KLDVHDPPEWMEAK-DLBZAZTESA-N	0	3	339.439	3.473	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ncc(C)cc1C	ZINC001025252098	1324055851	/nfs/dbraw/zinc/05/58/51/1324055851.db2.gz	MHPREUIOFWSNCQ-RTBURBONSA-N	0	3	339.483	3.181	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(F)ccc1OC	ZINC001025254520	1324061551	/nfs/dbraw/zinc/06/15/51/1324061551.db2.gz	KDPNPEHEBBROSC-QZTJIDSGSA-N	0	3	346.446	3.479	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)C1(C(F)F)CCC1	ZINC001025258538	1324067458	/nfs/dbraw/zinc/06/74/58/1324067458.db2.gz	HFHNXXOBYAQTOT-HOTGVXAUSA-N	0	3	338.442	3.291	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1csc(Cl)c1	ZINC001025273171	1324088981	/nfs/dbraw/zinc/08/89/81/1324088981.db2.gz	BGAHXIHZEWYLRL-CABCVRRESA-N	0	3	336.888	3.494	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cncc(Cl)c1	ZINC001025276272	1324097998	/nfs/dbraw/zinc/09/79/98/1324097998.db2.gz	IMUKBBXAMSOHJP-IAGOWNOFSA-N	0	3	333.863	3.380	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1nc(CC)oc1C	ZINC001025277068	1324098186	/nfs/dbraw/zinc/09/81/86/1324098186.db2.gz	NAFYDSCNWYTDCL-JKSUJKDBSA-N	0	3	331.460	3.191	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc2ccncc2c1	ZINC001025286902	1324108908	/nfs/dbraw/zinc/10/89/08/1324108908.db2.gz	MBQPXIYSSCESLV-NHCUHLMSSA-N	0	3	347.462	3.327	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(Cl)no1	ZINC001025289580	1324113529	/nfs/dbraw/zinc/11/35/29/1324113529.db2.gz	QVLWLYIYBWXWPY-UONOGXRCSA-N	0	3	337.851	3.363	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)Cc1cc(C)ccc1F	ZINC001025291485	1324116173	/nfs/dbraw/zinc/11/61/73/1324116173.db2.gz	AFXFLOUBFCFWKR-WOJBJXKFSA-N	0	3	342.458	3.155	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1c(F)cccc1F	ZINC001025292196	1324116711	/nfs/dbraw/zinc/11/67/11/1324116711.db2.gz	GQYZIJLUEWFBDY-QZTJIDSGSA-N	0	3	346.421	3.447	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)Cc1ccc(C)s1	ZINC001025301682	1324134733	/nfs/dbraw/zinc/13/47/33/1324134733.db2.gz	OBNVBLXYQOEJHV-RBUKOAKNSA-N	0	3	344.524	3.468	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cncc2ccccc21	ZINC001025301877	1324135051	/nfs/dbraw/zinc/13/50/51/1324135051.db2.gz	QHZLZCQNZWZOQP-SFTDATJTSA-N	0	3	347.462	3.327	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)Cc1ccc(C)s1	ZINC001025301680	1324135189	/nfs/dbraw/zinc/13/51/89/1324135189.db2.gz	OBNVBLXYQOEJHV-MOPGFXCFSA-N	0	3	344.524	3.468	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ncccc1OCC	ZINC001025303512	1324137994	/nfs/dbraw/zinc/13/79/94/1324137994.db2.gz	HZMAZOQERJKAAW-SJORKVTESA-N	0	3	343.471	3.125	20	30		EGEDHN
C[C@H](NC(=O)c1ccco1)[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001025320607	1324157982	/nfs/dbraw/zinc/15/79/82/1324157982.db2.gz	NQQLDZAEFWWYJK-YJBOKZPZSA-N	0	3	337.423	3.182	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2coc3ccc(CC)cc23)C1	ZINC001025418960	1324250002	/nfs/dbraw/zinc/25/00/02/1324250002.db2.gz	GWISYLHUTADWAE-NVXWUHKLSA-N	0	3	338.451	3.459	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cccc3ccc(C)nc32)C1	ZINC001025457271	1324298414	/nfs/dbraw/zinc/29/84/14/1324298414.db2.gz	ULCFVTZVWLROOM-AEFFLSMTSA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cccc3ccc(C)nc32)C1	ZINC001025458072	1324299320	/nfs/dbraw/zinc/29/93/20/1324299320.db2.gz	YBKQZEZIVQUFPR-IEBWSBKVSA-N	0	3	349.478	3.397	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc3sccc3s2)C1	ZINC001025458883	1324301040	/nfs/dbraw/zinc/30/10/40/1324301040.db2.gz	JUTXDCFTMVMVTA-OLZOCXBDSA-N	0	3	332.494	3.426	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(C)nc2C(C)C)C1	ZINC001025489747	1324340827	/nfs/dbraw/zinc/34/08/27/1324340827.db2.gz	QIZUYMRXIBBVSI-ROUUACIJSA-N	0	3	341.499	3.367	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc3cc(F)ccc3o2)C1	ZINC001025548875	1324398248	/nfs/dbraw/zinc/39/82/48/1324398248.db2.gz	KVXWUFCVKXXZBH-KBPBESRZSA-N	0	3	328.387	3.035	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cccc(C(C)(C)C)c2)C1	ZINC001025576608	1324415185	/nfs/dbraw/zinc/41/51/85/1324415185.db2.gz	LMMZEMGEAQOUJV-AEFFLSMTSA-N	0	3	326.484	3.448	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(Cl)cc2Cl)C1	ZINC001025608903	1324459522	/nfs/dbraw/zinc/45/95/22/1324459522.db2.gz	MIUKBRRLXRQJLU-STQMWFEESA-N	0	3	339.266	3.457	20	30		EGEDHN
Cc1ccc(C(=O)N2C[C@@H]3CC[C@@H](NCc4ccccc4C#N)[C@H]3C2)o1	ZINC001026188719	1324653865	/nfs/dbraw/zinc/65/38/65/1324653865.db2.gz	KHSFZVZTGCZIEW-GBESFXJTSA-N	0	3	349.434	3.100	20	30		EGEDHN
CC1(CC(=O)N2C[C@@H]3CC[C@@H](NCc4ccccc4C#N)[C@H]3C2)CC1	ZINC001026317967	1324721943	/nfs/dbraw/zinc/72/19/43/1324721943.db2.gz	QWMCHKQRRVOLFM-GBESFXJTSA-N	0	3	337.467	3.075	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)[C@@H]2CC=CCC2)CC1	ZINC001026451533	1324814809	/nfs/dbraw/zinc/81/48/09/1324814809.db2.gz	VSUTWHWPABQWJQ-WLYUNCDWSA-N	0	3	341.293	3.268	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@H](CNCc3ccccc3C#N)C2)s1	ZINC001026650710	1324950725	/nfs/dbraw/zinc/95/07/25/1324950725.db2.gz	QBTLLDBRGZJYFT-OAHLLOKOSA-N	0	3	339.464	3.180	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@H](CNCc3ccccc3C#N)C2)c(C)o1	ZINC001026677249	1324968569	/nfs/dbraw/zinc/96/85/69/1324968569.db2.gz	VWNACNMPPQPXQQ-MRXNPFEDSA-N	0	3	337.423	3.020	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)c2cncs2)C1	ZINC000963273567	1325052758	/nfs/dbraw/zinc/05/27/58/1325052758.db2.gz	WSTNPZSAMIRGNC-ZIAGYGMSSA-N	0	3	339.892	3.212	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)c2ccns2)C1	ZINC000963311208	1325096437	/nfs/dbraw/zinc/09/64/37/1325096437.db2.gz	QLQLOCCTDHUQRZ-UONOGXRCSA-N	0	3	339.892	3.212	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](CNCc2nc3ccccc3o2)C1	ZINC001026988474	1325127518	/nfs/dbraw/zinc/12/75/18/1325127518.db2.gz	HDBBBQBMFYECDS-OAHLLOKOSA-N	0	3	341.455	3.368	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](CNCc2nc3ccccc3o2)C1	ZINC001026988473	1325127533	/nfs/dbraw/zinc/12/75/33/1325127533.db2.gz	HDBBBQBMFYECDS-HNNXBMFYSA-N	0	3	341.455	3.368	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](CNCc2csc(CCC)n2)C1	ZINC001026992572	1325130864	/nfs/dbraw/zinc/13/08/64/1325130864.db2.gz	PIKNLFWVHIQMPU-CQSZACIVSA-N	0	3	335.517	3.246	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001027028880	1325164922	/nfs/dbraw/zinc/16/49/22/1325164922.db2.gz	QQFILWNIEMJOOP-CQSZACIVSA-N	0	3	331.435	3.072	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](CNCc2ccn(C(C)C)n2)C1	ZINC001027041161	1325176153	/nfs/dbraw/zinc/17/61/53/1325176153.db2.gz	QJXDYCWHFBPIPM-QFBILLFUSA-N	0	3	332.492	3.004	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)Cc2ccc[nH]2)C1	ZINC000963427130	1325235829	/nfs/dbraw/zinc/23/58/29/1325235829.db2.gz	DPGQDPSBRDRISL-NVXWUHKLSA-N	0	3	335.879	3.013	20	30		EGEDHN
C[C@@H](CC(=O)N1CC[C@H](CNCc2cc(F)ccc2C#N)C1)C1CC1	ZINC001027237586	1325331857	/nfs/dbraw/zinc/33/18/57/1325331857.db2.gz	QOYSJQSNUQWKDG-LSDHHAIUSA-N	0	3	343.446	3.072	20	30		EGEDHN
CCC(CC)C(=O)N1CCC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001027302029	1325445157	/nfs/dbraw/zinc/44/51/57/1325445157.db2.gz	YRXCTIBJKBAHMX-LJQANCHMSA-N	0	3	327.472	3.417	20	30		EGEDHN
N#Cc1ccccc1CNC1CC2(C1)CC(NC(=O)[C@]13C[C@H]1CCC3)C2	ZINC000964455249	1325533118	/nfs/dbraw/zinc/53/31/18/1325533118.db2.gz	RUYMPEKPBRJRBK-PRUIEMQUSA-N	0	3	349.478	3.265	20	30		EGEDHN
CC1CC(C(=O)N2CCC[C@@H](N(C)Cc3ccc(C#N)c(F)c3)C2)C1	ZINC001027361346	1325544923	/nfs/dbraw/zinc/54/49/23/1325544923.db2.gz	GLBCNXQMLDQXBL-IUPXNIOVSA-N	0	3	343.446	3.166	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001027363129	1325549538	/nfs/dbraw/zinc/54/95/38/1325549538.db2.gz	BLLDFLQHKRMUNJ-QGZVFWFLSA-N	0	3	329.419	3.244	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)[C@H]2CC2(C)C)C1	ZINC001027373998	1325569068	/nfs/dbraw/zinc/56/90/68/1325569068.db2.gz	WYKQANWGFOOERR-QZTJIDSGSA-N	0	3	325.456	3.027	20	30		EGEDHN
CN(Cc1ccc(C#N)c(F)c1)[C@H]1CCCN(C(=O)[C@@H]2CC2(C)C)C1	ZINC001027374754	1325571180	/nfs/dbraw/zinc/57/11/80/1325571180.db2.gz	IUEOSVBLYSNYRU-IRXDYDNUSA-N	0	3	343.446	3.166	20	30		EGEDHN
Cc1cc(C(=O)N2CCC[C@H](N(C)Cc3cccc(C#N)c3)C2)co1	ZINC001027381722	1325580087	/nfs/dbraw/zinc/58/00/87/1325580087.db2.gz	GBOGCKYVNILIKA-IBGZPJMESA-N	0	3	337.423	3.196	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)/C=C/c2ccc[nH]2)C1	ZINC001027382320	1325581023	/nfs/dbraw/zinc/58/10/23/1325581023.db2.gz	QQPDRKQUOOCKQJ-CTDFXDFQSA-N	0	3	348.450	3.023	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)C(=O)NCc1ccc(F)c(F)c1)c1ccco1	ZINC000860692561	1329344957	/nfs/dbraw/zinc/34/49/57/1329344957.db2.gz	NKCCYGRZZDHTJW-AAEUAGOBSA-N	0	3	346.333	3.077	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)C2CC(C)(C)C2)C1	ZINC001027396547	1327614216	/nfs/dbraw/zinc/61/42/16/1327614216.db2.gz	YVDDMGNJBYPZQX-IBGZPJMESA-N	0	3	339.483	3.417	20	30		EGEDHN
CN(Cc1ccc(F)c(Cl)c1)[C@@H]1CCCN(C(=O)C#CC2CC2)C1	ZINC001027406569	1327631511	/nfs/dbraw/zinc/63/15/11/1327631511.db2.gz	VLGGNHJSHWNBIC-MRXNPFEDSA-N	0	3	348.849	3.315	20	30		EGEDHN
C[C@@H](NC[C@H]1CCN1C(=O)OC(C)(C)C)c1ccc(C#N)c(F)c1	ZINC000927000933	1327813869	/nfs/dbraw/zinc/81/38/69/1327813869.db2.gz	NJJWLEGRMBTJLI-IUODEOHRSA-N	0	3	333.407	3.357	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)[C@@H]2CCC2(C)C)C1	ZINC001027535525	1327825343	/nfs/dbraw/zinc/82/53/43/1327825343.db2.gz	HZSYEDYLQGYPEQ-MOPGFXCFSA-N	0	3	339.483	3.417	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)[C@@H](Cc2ccccc2)C(C)C)C1	ZINC001027571784	1327905949	/nfs/dbraw/zinc/90/59/49/1327905949.db2.gz	GURXNOAMUWWPOO-UXHICEINSA-N	0	3	326.484	3.057	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)c2ccc(-c3ccco3)s2)C1	ZINC001027638289	1328006031	/nfs/dbraw/zinc/00/60/31/1328006031.db2.gz	XJGKNBBLCYUENX-AWEZNQCLSA-N	0	3	328.437	3.178	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)CC2C3CC4CC(C3)CC2C4)C1	ZINC001027686871	1328087073	/nfs/dbraw/zinc/08/70/73/1328087073.db2.gz	FWFMQXRCUJPJEK-BIKXEMDZSA-N	0	3	328.500	3.005	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccccc2COC(C)(C)C)CC1	ZINC000928394972	1328307095	/nfs/dbraw/zinc/30/70/95/1328307095.db2.gz	IPVSPWMAQIITHG-UHFFFAOYSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@@H]1CCCN1Cc1ccc(C)cc1	ZINC001027931191	1328409423	/nfs/dbraw/zinc/40/94/23/1328409423.db2.gz	AEKMUCQKZJJYSZ-IBGZPJMESA-N	0	3	337.467	3.377	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)[C@H]2CC[C@H](C3CCC3)CC2)C1	ZINC000966874182	1328447428	/nfs/dbraw/zinc/44/74/28/1328447428.db2.gz	DCDPUDSICWAODH-VBSBHUPXSA-N	0	3	330.516	3.443	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1cc(C)nn1C(CC)CC	ZINC001027981943	1328454098	/nfs/dbraw/zinc/45/40/98/1328454098.db2.gz	IZXGCTFGQMIDFO-KRWDZBQOSA-N	0	3	332.492	3.323	20	30		EGEDHN
C=C(C)CCN1CC[C@H](C)[C@H](NC(=O)c2cc(C(F)(F)F)no2)C1	ZINC000966889386	1328455181	/nfs/dbraw/zinc/45/51/81/1328455181.db2.gz	YAVIVQWOGBLXHR-NWDGAFQWSA-N	0	3	345.365	3.100	20	30		EGEDHN
CCCC(=O)Nc1ccc(O)c(C(C)=NNc2ccnc(C)c2)c1	ZINC000863158851	1329530797	/nfs/dbraw/zinc/53/07/97/1329530797.db2.gz	UMFMEUBTEMOIKX-UHFFFAOYSA-N	0	3	326.400	3.092	20	30		EGEDHN
CC(C)(C)OC(=O)N1[C@@H]2CC[C@H]1C[C@@H](CNCc1ccc(C#N)o1)C2	ZINC000865793456	1329739161	/nfs/dbraw/zinc/73/91/61/1329739161.db2.gz	LODZNSAYNVBDOS-QDMKHBRRSA-N	0	3	345.443	3.419	20	30		EGEDHN
C[C@H](c1ccccc1)[C@@H]1CCCN1CC(=O)N[C@](C)(C#N)C1CC1	ZINC000932279656	1329802996	/nfs/dbraw/zinc/80/29/96/1329802996.db2.gz	RVYFVQYCFHZUIO-MOXGXCLJSA-N	0	3	325.456	3.063	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)Cc2ccc(C)c(Cl)c2)CC1	ZINC001052486655	1348554175	/nfs/dbraw/zinc/55/41/75/1348554175.db2.gz	ODHWTTCZSHDWPC-KRWDZBQOSA-N	0	3	332.875	3.185	20	30		EGEDHN
N#Cc1ccc(C2CCN([C@@H]3C[C@H]4CCCC[C@H]4NC3=O)CC2)cc1	ZINC000933606287	1329905487	/nfs/dbraw/zinc/90/54/87/1329905487.db2.gz	HONFDZJBXDENIL-VAMGGRTRSA-N	0	3	337.467	3.185	20	30		EGEDHN
CC(C)N1CCC[C@H](N2CCC(c3ccc(C#N)cc3)CC2)C1=O	ZINC000933612105	1329905716	/nfs/dbraw/zinc/90/57/16/1329905716.db2.gz	DOHLPEJMEHIAOI-IBGZPJMESA-N	0	3	325.456	3.137	20	30		EGEDHN
C[C@H](C(=O)N1CCCCC1)N1CCC(c2ccc(C#N)cc2)CC1	ZINC000933613650	1329906085	/nfs/dbraw/zinc/90/60/85/1329906085.db2.gz	DNFPXUYDOJRRLZ-MRXNPFEDSA-N	0	3	325.456	3.139	20	30		EGEDHN
N#CCCCC[C@H](N)C(=O)NCC1(c2cccc(Cl)c2)CCC1	ZINC000867992257	1330238340	/nfs/dbraw/zinc/23/83/40/1330238340.db2.gz	BRLNLERYMWBNIV-INIZCTEOSA-N	0	3	333.863	3.289	20	30		EGEDHN
CC1(C)CN(Cc2cccc(C#N)c2)CC[C@@H]1NC(=O)CC1CCC1	ZINC000940635793	1331134660	/nfs/dbraw/zinc/13/46/60/1331134660.db2.gz	VDJDAPMNXBVCFJ-IBGZPJMESA-N	0	3	339.483	3.465	20	30		EGEDHN
CC1(C(=O)N[C@@H]2CCN(Cc3ccc(C#N)cc3)CC2(C)C)CC1	ZINC000940769281	1331184385	/nfs/dbraw/zinc/18/43/85/1331184385.db2.gz	UFGFHVGTMLRSDE-QGZVFWFLSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3cccc(Cl)c3)CC2)[C@H](C)C1	ZINC000942107145	1331833607	/nfs/dbraw/zinc/83/36/07/1331833607.db2.gz	UPVLWEZIXMXWFC-CRAIPNDOSA-N	0	3	344.886	3.222	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc(C)c(Cl)c2)[C@H](C)C1	ZINC000942175673	1331861071	/nfs/dbraw/zinc/86/10/71/1331861071.db2.gz	JGZNBHOVLMYSEL-CRAIPNDOSA-N	0	3	332.875	3.041	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2nc3ccccc3cc2C)[C@@H](C)C1	ZINC000942525121	1331954819	/nfs/dbraw/zinc/95/48/19/1331954819.db2.gz	KBNNZBIPCNPSJH-WMZOPIPTSA-N	0	3	335.451	3.007	20	30		EGEDHN
Cc1cocc1C(=O)N[C@H]1CCN(Cc2ccc(C#N)cc2)C[C@H]1C	ZINC000942558313	1331973647	/nfs/dbraw/zinc/97/36/47/1331973647.db2.gz	VHOMWBQUMMNJNQ-KUHUBIRLSA-N	0	3	337.423	3.100	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(F)c(Cl)cc2F)[C@@H](C)C1	ZINC000942585392	1331991188	/nfs/dbraw/zinc/99/11/88/1331991188.db2.gz	DSSRSIQRBTYLEY-BONVTDFDSA-N	0	3	328.790	3.244	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnc(-c3ccoc3)s2)[C@@H](C)C1	ZINC000943333265	1332151067	/nfs/dbraw/zinc/15/10/67/1332151067.db2.gz	HTYOZWSVEWOBRU-GXTWGEPZSA-N	0	3	331.441	3.029	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C(CC)CC)no2)[C@H](C)C1	ZINC000943374652	1332161234	/nfs/dbraw/zinc/16/12/34/1332161234.db2.gz	ONDHNZLPDBYMOR-GDBMZVCRSA-N	0	3	331.460	3.042	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2csc(-c3ccoc3)n2)[C@H](C)C1	ZINC000943688543	1332238972	/nfs/dbraw/zinc/23/89/72/1332238972.db2.gz	DZNQKVCQIFLWKH-TZMCWYRMSA-N	0	3	331.441	3.029	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2[nH]c3ccc(C)cc3c2C)[C@H](C)C1	ZINC000943813795	1332271792	/nfs/dbraw/zinc/27/17/92/1332271792.db2.gz	FKJNYNVROMZXAM-QAPCUYQASA-N	0	3	337.467	3.248	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc3sccc3c2)[C@@H](C)C1	ZINC000943818052	1332273760	/nfs/dbraw/zinc/27/37/60/1332273760.db2.gz	VKFXPZAPFKOBQB-WMLDXEAASA-N	0	3	326.465	3.365	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3ccccc3F)CCC2)[C@H](C)C1	ZINC000944099223	1332325907	/nfs/dbraw/zinc/32/59/07/1332325907.db2.gz	QHTYPKLJMHABJP-APWZRJJASA-N	0	3	342.458	3.097	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C(C)(C)c2ccc(C)cc2)[C@@H](C)C1	ZINC000944230101	1332350073	/nfs/dbraw/zinc/35/00/73/1332350073.db2.gz	YUVSXVAVMJUAIW-PKOBYXMFSA-N	0	3	326.484	3.123	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2coc3ccc(F)cc23)[C@@H](C)C1	ZINC000944492142	1332413858	/nfs/dbraw/zinc/41/38/58/1332413858.db2.gz	OBFQSIINCMZDIA-SUMWQHHRSA-N	0	3	328.387	3.035	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2c[nH]cc2-c2ccccc2)[C@@H](C)C1	ZINC000944921051	1332454183	/nfs/dbraw/zinc/45/41/83/1332454183.db2.gz	XXQZTUXJWBCZDQ-JXFKEZNVSA-N	0	3	335.451	3.145	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3ccc(C)cc3)CCC2)[C@H](C)C1	ZINC000945365623	1332568233	/nfs/dbraw/zinc/56/82/33/1332568233.db2.gz	LHJVIVNDJVIUKI-UYAOXDASSA-N	0	3	338.495	3.267	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C(C)(C)c2ccccc2C)[C@H](C)C1	ZINC000945806512	1332678691	/nfs/dbraw/zinc/67/86/91/1332678691.db2.gz	DRYRXCVWMZPESC-MJGOQNOKSA-N	0	3	326.484	3.123	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@H](C)c3ccco3)CC[C@@H]2C1	ZINC000946776598	1332897324	/nfs/dbraw/zinc/89/73/24/1332897324.db2.gz	PFJMDSPGWSQTBC-OAGGEKHMSA-N	0	3	336.863	3.306	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3ccccc3OC)CC[C@@H]2C1	ZINC000946872068	1332920768	/nfs/dbraw/zinc/92/07/68/1332920768.db2.gz	BNUFMAFERFMIDQ-IYBDPMFKSA-N	0	3	348.874	3.232	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3ccc(F)s3)CC[C@@H]2C1	ZINC000946908589	1332931141	/nfs/dbraw/zinc/93/11/41/1332931141.db2.gz	DRTVCVLKZJIMSQ-BETUJISGSA-N	0	3	342.867	3.424	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccc(C(F)F)c2F)C[C@H]1C	ZINC000947319872	1333087196	/nfs/dbraw/zinc/08/71/96/1333087196.db2.gz	VLGOEPOAKARUTP-CHWSQXEVSA-N	0	3	338.373	3.369	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2c(F)c(F)cc(F)c2F)C[C@H]1C	ZINC000947327501	1333090500	/nfs/dbraw/zinc/09/05/00/1333090500.db2.gz	DQSYZYZVRYYTSE-NXEZZACHSA-N	0	3	330.325	3.012	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2c(C)nn(C(C)(C)C)c2C)C[C@@H]1C	ZINC000947369187	1333106517	/nfs/dbraw/zinc/10/65/17/1333106517.db2.gz	HSJSFGBIIUDWAZ-BBRMVZONSA-N	0	3	332.492	3.024	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)Cc2ccccc2)CCN1Cc1cccc(C#N)c1	ZINC000947454313	1333134832	/nfs/dbraw/zinc/13/48/32/1333134832.db2.gz	JLMDFQIUZLWNBH-UTKZUKDTSA-N	0	3	347.462	3.270	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(-c3ccccc3)no2)C[C@H]1C	ZINC000947487575	1333144555	/nfs/dbraw/zinc/14/45/55/1333144555.db2.gz	GDELUSOJIMIGBG-GDBMZVCRSA-N	0	3	325.412	3.110	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc3cc(C)ccc3n2)C[C@H]1C	ZINC000947532763	1333160945	/nfs/dbraw/zinc/16/09/45/1333160945.db2.gz	MPLYTUBXIYCTHW-AEFFLSMTSA-N	0	3	335.451	3.149	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2coc3ccc(OC)cc32)C[C@H]1C	ZINC000947537715	1333162843	/nfs/dbraw/zinc/16/28/43/1333162843.db2.gz	POYAOIWKRDFBAV-ZIAGYGMSSA-N	0	3	328.412	3.210	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cccc(C(F)F)c2)C[C@H]1C	ZINC000947540612	1333164005	/nfs/dbraw/zinc/16/40/05/1333164005.db2.gz	WFEBXTHIDKPKHI-PBHICJAKSA-N	0	3	334.410	3.159	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2cc3ccccc3s2)C[C@@H]1C	ZINC000947540354	1333164187	/nfs/dbraw/zinc/16/41/87/1333164187.db2.gz	RZWSTEZMIQOOLH-HOCLYGCPSA-N	0	3	326.465	3.046	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2c(C)occ2C(F)(F)F)C[C@@H]1C	ZINC000947547897	1333167904	/nfs/dbraw/zinc/16/79/04/1333167904.db2.gz	VGOCCFUUADVAFN-WCQYABFASA-N	0	3	342.361	3.213	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(C3CCC3)cc2)C[C@@H]1C	ZINC000947584026	1333182336	/nfs/dbraw/zinc/18/23/36/1333182336.db2.gz	COYXXGBIOUEVHB-UWJYYQICSA-N	0	3	338.495	3.489	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc3cc(Cl)ccc3[nH]2)C[C@H]1C	ZINC000947607082	1333190462	/nfs/dbraw/zinc/19/04/62/1333190462.db2.gz	JXWMPUPSVFMXME-IUODEOHRSA-N	0	3	329.831	3.037	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3cccc(C#N)c3)[C@@H](C)C2)C1	ZINC000947702347	1333232456	/nfs/dbraw/zinc/23/24/56/1333232456.db2.gz	MVXGBBRCXOIMRV-QFBILLFUSA-N	0	3	337.467	3.384	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3ncccc3C)[C@H](C)C2)C1	ZINC000947703169	1333233385	/nfs/dbraw/zinc/23/33/85/1333233385.db2.gz	VYBMYPWXUWSFIL-SJORKVTESA-N	0	3	327.472	3.215	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3cc(F)ccc3o2)C[C@@H]1C	ZINC000947771739	1333256438	/nfs/dbraw/zinc/25/64/38/1333256438.db2.gz	QOXABXXGSIQOKM-XJKSGUPXSA-N	0	3	328.387	3.178	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ncoc2-c2cccs2)C[C@H]1C	ZINC000947825645	1333272021	/nfs/dbraw/zinc/27/20/21/1333272021.db2.gz	URCYJNZGPINVSU-CHWSQXEVSA-N	0	3	331.441	3.172	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc3nc(C)ccc3c2)C[C@@H]1C	ZINC000947845202	1333277119	/nfs/dbraw/zinc/27/71/19/1333277119.db2.gz	GOLPHQCIGKOKTI-LPHOPBHVSA-N	0	3	335.451	3.149	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2[nH]c3ccc(C)cc3c2C)C[C@@H]1C	ZINC000947878166	1333288950	/nfs/dbraw/zinc/28/89/50/1333288950.db2.gz	LPASXOMXSNXNPS-RDJZCZTQSA-N	0	3	337.467	3.391	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2c[nH]nc2C2CCCCC2)C[C@@H]1C	ZINC000947917531	1333306766	/nfs/dbraw/zinc/30/67/66/1333306766.db2.gz	XTIIEXOAVYMSRZ-DOTOQJQBSA-N	0	3	342.487	3.063	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccccc2OC(C)C)C[C@@H]1C	ZINC000947948139	1333315583	/nfs/dbraw/zinc/31/55/83/1333315583.db2.gz	KZMSUWPZPFOLKF-IRXDYDNUSA-N	0	3	328.456	3.080	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(CC(C)C)cc2)C[C@@H]1C	ZINC000948020299	1333343857	/nfs/dbraw/zinc/34/38/57/1333343857.db2.gz	BAZQNUUEOFMTNX-PXNSSMCTSA-N	0	3	326.484	3.491	20	30		EGEDHN
CN(C(=O)c1ccncc1)[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948141668	1333390106	/nfs/dbraw/zinc/39/01/06/1333390106.db2.gz	DFPZMJKXRIGDIW-HXUWFJFHSA-N	0	3	348.450	3.080	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)[C@@H]2[C@@H](c3ccccc3)C2(C)C)CC1	ZINC000948378558	1333502059	/nfs/dbraw/zinc/50/20/59/1333502059.db2.gz	XRXZNPDLVNQRQA-AQNXPRMDSA-N	0	3	338.495	3.372	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)Cc2c(C)cccc2C)CC1	ZINC000948416916	1333517289	/nfs/dbraw/zinc/51/72/89/1333517289.db2.gz	SICDXHKDUZEXAF-IBGZPJMESA-N	0	3	326.484	3.182	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2oc3ccc(F)cc3c2C)CC1	ZINC000948436007	1333523987	/nfs/dbraw/zinc/52/39/87/1333523987.db2.gz	RRPCITMABOVJKL-MRXNPFEDSA-N	0	3	342.414	3.440	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)[C@@H]2CCCC[C@H]2C(F)(F)F)CC1	ZINC000948448717	1333530554	/nfs/dbraw/zinc/53/05/54/1333530554.db2.gz	HGQWNJBTBOCSGP-ARFHVFGLSA-N	0	3	344.421	3.301	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2nc(C(C)(C)C)cs2)CC1	ZINC000948456026	1333532721	/nfs/dbraw/zinc/53/27/21/1333532721.db2.gz	HWFUNYAVNCBJBE-CQSZACIVSA-N	0	3	333.501	3.000	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)Cc2ccc(C)cc2Cl)CC1	ZINC000948553378	1333571535	/nfs/dbraw/zinc/57/15/35/1333571535.db2.gz	GRBYWRJDAJEZSS-KRWDZBQOSA-N	0	3	332.875	3.137	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)[C@@H]2CCCC[C@@H]2C(F)(F)F)CC1	ZINC000948553423	1333571876	/nfs/dbraw/zinc/57/18/76/1333571876.db2.gz	HGQWNJBTBOCSGP-OAGGEKHMSA-N	0	3	344.421	3.301	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)Cc2ccc(C(F)F)cc2)CC1	ZINC000948612065	1333595660	/nfs/dbraw/zinc/59/56/60/1333595660.db2.gz	KWJSYFSGHTUDDJ-QGZVFWFLSA-N	0	3	334.410	3.113	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)C2([C@H]3CCCCO3)CCC2)CC1	ZINC000948612353	1333596793	/nfs/dbraw/zinc/59/67/93/1333596793.db2.gz	NLTIIIPMYRZXQH-RTBURBONSA-N	0	3	346.515	3.062	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2c(F)cc(F)cc2F)CC1	ZINC000948722379	1333646948	/nfs/dbraw/zinc/64/69/48/1333646948.db2.gz	NPNVJSLQJKJMAI-CQSZACIVSA-N	0	3	338.373	3.054	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2oc(C(C)C)nc2C)CC1	ZINC000948840210	1333705266	/nfs/dbraw/zinc/70/52/66/1333705266.db2.gz	BFSKDCFFLVIUOR-MRXNPFEDSA-N	0	3	331.460	3.056	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)C[C@@H]2CCc3ccccc32)CC1	ZINC000948868542	1333715078	/nfs/dbraw/zinc/71/50/78/1333715078.db2.gz	ONAUJUAAFPGSKV-VQTJNVASSA-N	0	3	338.495	3.443	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)[C@@H](C)c2ccccc2F)CC1	ZINC000948868480	1333715253	/nfs/dbraw/zinc/71/52/53/1333715253.db2.gz	MARCQHUICSBCPI-DLBZAZTESA-N	0	3	330.447	3.265	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)[C@@]2(c3ccccc3)CC2(C)C)CC1	ZINC000948876714	1333717001	/nfs/dbraw/zinc/71/70/01/1333717001.db2.gz	BNDAOUYWPZLBKH-UGKGYDQZSA-N	0	3	338.495	3.300	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@H]1CNC(=O)[C@@H]1CC1(F)F	ZINC000948915933	1333732024	/nfs/dbraw/zinc/73/20/24/1333732024.db2.gz	IJFANEMWQFUZJL-DLBZAZTESA-N	0	3	334.410	3.323	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@@H]1c2ccccc2CCN1C(C)C	ZINC000948923719	1333736235	/nfs/dbraw/zinc/73/62/35/1333736235.db2.gz	RDKVVKPTDCODQU-HXUWFJFHSA-N	0	3	337.467	3.412	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C[C@@H]3CCC[C@@H]3C)CC2)C1	ZINC000949365842	1333831517	/nfs/dbraw/zinc/83/15/17/1333831517.db2.gz	ITDKQZCDQCNVGJ-OALUTQOASA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3cccc(C)c3F)CC2)C1	ZINC000949373206	1333832894	/nfs/dbraw/zinc/83/28/94/1333832894.db2.gz	NUGBPQNVMXFYFX-UHFFFAOYSA-N	0	3	346.446	3.017	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC2(CC1)CN(CCC(=C)C)CCO2	ZINC000949463763	1333854383	/nfs/dbraw/zinc/85/43/83/1333854383.db2.gz	QYHCQRCNFIWOEY-IBGZPJMESA-N	0	3	334.504	3.248	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@@H]3CCC[C@H]3CC)CC2)C1	ZINC000949466839	1333855423	/nfs/dbraw/zinc/85/54/23/1333855423.db2.gz	UMJDQDSSZWFNDE-QZTJIDSGSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@H]3C[C@]3(C)CC)CC2)C1	ZINC000949504377	1333861838	/nfs/dbraw/zinc/86/18/38/1333861838.db2.gz	RAPKNILZEKQKCM-MJGOQNOKSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@H]3C[C@@]3(C)CC)CC2)C1	ZINC000949504375	1333861864	/nfs/dbraw/zinc/86/18/64/1333861864.db2.gz	RAPKNILZEKQKCM-IEBWSBKVSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@@H]3C[C@@]3(CC)C(C)C)CC2)C1	ZINC000949504928	1333862360	/nfs/dbraw/zinc/86/23/60/1333862360.db2.gz	XABXBWBPRBEETO-RXVVDRJESA-N	0	3	348.531	3.328	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C[C@@H](C)c3ccco3)CC2)C1	ZINC000949512217	1333863650	/nfs/dbraw/zinc/86/36/50/1333863650.db2.gz	QZXUUHUZEWACAA-QGZVFWFLSA-N	0	3	346.471	3.043	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)Cc2c(C)cccc2Cl)C1	ZINC000967231348	1335677597	/nfs/dbraw/zinc/67/75/97/1335677597.db2.gz	PTZZTYJNKYPGHK-QAPCUYQASA-N	0	3	332.875	3.041	20	30		EGEDHN
C=C(C)CCN1CC[C@H](C)[C@H](NC(=O)c2nc3cnccc3s2)C1	ZINC000967315705	1335699024	/nfs/dbraw/zinc/69/90/24/1335699024.db2.gz	RDTAYGOUSWDUEQ-DZGCQCFKSA-N	0	3	344.484	3.098	20	30		EGEDHN
C=C(C)CCN1CC[C@H](C)[C@@H](NC(=O)c2nc3c(s2)CCC3)C1	ZINC000967376612	1335719728	/nfs/dbraw/zinc/71/97/28/1335719728.db2.gz	INNXYECXKMNHFW-ZFWWWQNUSA-N	0	3	333.501	3.038	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CN(Cc3ccccc3C)CC[C@@H]2C)c1	ZINC000968318401	1335889167	/nfs/dbraw/zinc/88/91/67/1335889167.db2.gz	UQLOYAPVLSIGKS-UWJYYQICSA-N	0	3	347.462	3.012	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2cccc(N3CC=CC3)c2)C1	ZINC000968364663	1335904739	/nfs/dbraw/zinc/90/47/39/1335904739.db2.gz	IPNKKOAONYTMFP-XLIONFOSSA-N	0	3	339.483	3.079	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2cnc(-c3ccoc3)s2)C1	ZINC000968400157	1335920041	/nfs/dbraw/zinc/92/00/41/1335920041.db2.gz	MVYACYWCPJCNAI-ZFWWWQNUSA-N	0	3	345.468	3.419	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2csc(-c3ccoc3)n2)C1	ZINC000968430847	1335927668	/nfs/dbraw/zinc/92/76/68/1335927668.db2.gz	GHNMEPZAYDSXTN-DZGCQCFKSA-N	0	3	345.468	3.419	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2csc(C(F)(F)F)n2)C1	ZINC000968500727	1335943755	/nfs/dbraw/zinc/94/37/55/1335943755.db2.gz	IVBJSKWVECPDBI-GHMZBOCLSA-N	0	3	347.406	3.178	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)[C@@]2(c3ccccc3)C[C@H](F)C2)C1	ZINC000968598485	1335978680	/nfs/dbraw/zinc/97/86/80/1335978680.db2.gz	GNHPQKKLJHPOAV-RDPOXOKHSA-N	0	3	344.474	3.459	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2cc(C)n(C(C)C)c2C)C1	ZINC000968630696	1335990062	/nfs/dbraw/zinc/99/00/62/1335990062.db2.gz	APWIQJAHTANGTR-KXBFYZLASA-N	0	3	329.488	3.149	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2cc3c(cccc3OC)[nH]2)C1	ZINC000968643623	1335994743	/nfs/dbraw/zinc/99/47/43/1335994743.db2.gz	OFGGDNJTQNIOQW-KDOFPFPSSA-N	0	3	341.455	3.193	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2c[nH]cc2-c2ccccc2)C1	ZINC000968646605	1335995120	/nfs/dbraw/zinc/99/51/20/1335995120.db2.gz	FHTMOWGXCCPJLK-OXQOHEQNSA-N	0	3	335.451	3.145	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)Cc2nsc3ccccc32)C1	ZINC000968668151	1336002564	/nfs/dbraw/zinc/00/25/64/1336002564.db2.gz	AEADTNMBGUGZEE-WMLDXEAASA-N	0	3	343.496	3.242	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)Cc2ccc(OC(C)C)cc2)C1	ZINC000968669565	1336003885	/nfs/dbraw/zinc/00/38/85/1336003885.db2.gz	OYAODTOVXYNZTG-XLIONFOSSA-N	0	3	344.499	3.419	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccc(OC3CCC3)cc2)C1	ZINC000968669769	1336004250	/nfs/dbraw/zinc/00/42/50/1336004250.db2.gz	STXQGMOOCJXNSV-OXQOHEQNSA-N	0	3	340.467	3.081	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2ccc(-c3ccccc3)[nH]2)C1	ZINC000968695383	1336015102	/nfs/dbraw/zinc/01/51/02/1336015102.db2.gz	OEXZDSOLMONTDX-OXJNMPFZSA-N	0	3	335.451	3.145	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1cc(C)c(OC)c(C)c1	ZINC000968869086	1336073178	/nfs/dbraw/zinc/07/31/78/1336073178.db2.gz	HVATYFGPMMJPTH-LJQANCHMSA-N	0	3	342.483	3.310	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccnn1C(CC)CC	ZINC000968890051	1336081410	/nfs/dbraw/zinc/08/14/10/1336081410.db2.gz	AKZYQWOQUANLSZ-QGZVFWFLSA-N	0	3	332.492	3.405	20	30		EGEDHN
C#CCCN1CCCCC[C@@H]1CNC(=O)c1cc2c(o1)CCCC2	ZINC000968890932	1336082111	/nfs/dbraw/zinc/08/21/11/1336082111.db2.gz	PFLQNOHWVAHKCY-QGZVFWFLSA-N	0	3	328.456	3.156	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1n[nH]c(CC)c1Cl	ZINC000968893125	1336082832	/nfs/dbraw/zinc/08/28/32/1336082832.db2.gz	GZQODMKNHDTQKB-CYBMUJFWSA-N	0	3	338.883	3.176	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cccc2c1O[C@H](C)C2	ZINC000968954276	1336101651	/nfs/dbraw/zinc/10/16/51/1336101651.db2.gz	AHUIBBXWCJAPTA-WBVHZDCISA-N	0	3	328.456	3.170	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)[C@@H]1COc2cc(C)c(C)cc21	ZINC000968965643	1336103982	/nfs/dbraw/zinc/10/39/82/1336103982.db2.gz	UPPLHQXHIDLFDH-IEBWSBKVSA-N	0	3	342.483	3.326	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccc(F)c(COC)c1	ZINC000969018158	1336119554	/nfs/dbraw/zinc/11/95/54/1336119554.db2.gz	XCUAVGJWJNFXJB-KRWDZBQOSA-N	0	3	334.435	3.133	20	30		EGEDHN
C#CCCN1CCCCC[C@@H]1CNC(=O)c1scnc1C(C)C	ZINC000969061938	1336134467	/nfs/dbraw/zinc/13/44/67/1336134467.db2.gz	HIOXOSYSIABYFR-OAHLLOKOSA-N	0	3	333.501	3.264	20	30		EGEDHN
C#CCCN1CCCCC[C@@H]1CNC(=O)c1oc(CC(C)C)nc1C	ZINC000969062554	1336135063	/nfs/dbraw/zinc/13/50/63/1336135063.db2.gz	ONJKPCYTYLGZTP-QGZVFWFLSA-N	0	3	345.487	3.179	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1coc(C2CCCC2)n1	ZINC000969096644	1336140567	/nfs/dbraw/zinc/14/05/67/1336140567.db2.gz	AWOJYBJGWIJKFH-INIZCTEOSA-N	0	3	331.460	3.493	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cccc(OC(C)C)n1	ZINC000969097153	1336141701	/nfs/dbraw/zinc/14/17/01/1336141701.db2.gz	IBKLOLXJAMWFKL-INIZCTEOSA-N	0	3	331.460	3.029	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1nc2ccccn2c1F	ZINC000969098181	1336141855	/nfs/dbraw/zinc/14/18/55/1336141855.db2.gz	YNRXHDNXDBFKQL-HNNXBMFYSA-N	0	3	344.434	3.024	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1c(C)nn(CCC)c1C	ZINC000969106285	1336146124	/nfs/dbraw/zinc/14/61/24/1336146124.db2.gz	WGTNDFUWDGUMBC-QGZVFWFLSA-N	0	3	332.492	3.070	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1sccc1COC	ZINC000969110861	1336147417	/nfs/dbraw/zinc/14/74/17/1336147417.db2.gz	FBUDHXCSAOMLOO-INIZCTEOSA-N	0	3	336.501	3.445	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cnn(CC(C)C)c1C	ZINC000969133670	1336155238	/nfs/dbraw/zinc/15/52/38/1336155238.db2.gz	RZSFRWFUWCSPEC-QGZVFWFLSA-N	0	3	332.492	3.008	20	30		EGEDHN
C#CCN1CCCCC[C@@H]1CNC(=O)c1c[nH]cc1-c1ccccc1	ZINC000969147271	1336161953	/nfs/dbraw/zinc/16/19/53/1336161953.db2.gz	BNYJPOUARZTAAO-GOSISDBHSA-N	0	3	335.451	3.289	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)[C@@H]1Cc2cc(C)c(C)cc2O1	ZINC000969153146	1336164750	/nfs/dbraw/zinc/16/47/50/1336164750.db2.gz	AZVOZUPXRWGNTO-QUCCMNQESA-N	0	3	342.483	3.154	20	30		EGEDHN
C[C@@H](NC(=O)c1cc(C#N)c[nH]1)C1CN(Cc2ccc(C3CC3)cc2)C1	ZINC000969461828	1336214065	/nfs/dbraw/zinc/21/40/65/1336214065.db2.gz	BKXIMOMJJHYJCC-CQSZACIVSA-N	0	3	348.450	3.014	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)c2cc(C)nn2C(CC)CC)C1	ZINC000970001299	1336270479	/nfs/dbraw/zinc/27/04/79/1336270479.db2.gz	QELRXHKFXHPMEO-OAHLLOKOSA-N	0	3	332.492	3.179	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)c2cc(F)cc3cccnc32)C1	ZINC000970523265	1336316496	/nfs/dbraw/zinc/31/64/96/1336316496.db2.gz	NELYAHLSTWXEPL-ZDUSSCGKSA-N	0	3	327.403	3.000	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)C2CCN(Cc3ccc(OC)cc3)CC2)C1	ZINC001005933034	1336424760	/nfs/dbraw/zinc/42/47/60/1336424760.db2.gz	MRFICNDKEMUGPR-UHFFFAOYSA-N	0	3	342.483	3.474	20	30		EGEDHN
C#Cc1cncc(C(=O)N(C)C2CCN(Cc3ccc(C)cc3)CC2)c1	ZINC001005967926	1336431337	/nfs/dbraw/zinc/43/13/37/1336431337.db2.gz	GYKWWXLOZHTXOI-UHFFFAOYSA-N	0	3	347.462	3.108	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cnc([C@H]3CCCO3)s2)CC1	ZINC001006103886	1336452784	/nfs/dbraw/zinc/45/27/84/1336452784.db2.gz	OGVQAEOTRHFHHV-OAHLLOKOSA-N	0	3	349.500	3.107	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2ccc(-c3ccccc3)nc2)CC1	ZINC001006181443	1336463652	/nfs/dbraw/zinc/46/36/52/1336463652.db2.gz	QCKZHKIANVRKEK-UHFFFAOYSA-N	0	3	335.451	3.471	20	30		EGEDHN
CC(C)[C@H]1C[C@H]1C(=O)N(C)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001006219311	1336468603	/nfs/dbraw/zinc/46/86/03/1336468603.db2.gz	OFTMZGGZNVFOBO-WOJBJXKFSA-N	0	3	339.483	3.273	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cccc(-c3cnco3)c2)CC1	ZINC001006231889	1336472714	/nfs/dbraw/zinc/47/27/14/1336472714.db2.gz	FBALMCLZBHKAOF-UHFFFAOYSA-N	0	3	325.412	3.064	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)C2(c3ccccc3F)CCC2)CC1	ZINC001006279883	1336481330	/nfs/dbraw/zinc/48/13/30/1336481330.db2.gz	VCDHWQOENXOVHH-UHFFFAOYSA-N	0	3	330.447	3.356	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCCN(CCc3ccc(OC)cc3)C2)C1	ZINC001008436310	1336852789	/nfs/dbraw/zinc/85/27/89/1336852789.db2.gz	FANTYXOLBDNZMC-SFHVURJKSA-N	0	3	342.483	3.175	20	30		EGEDHN
C=C(C)CCN1CCC[C@H](NC(=O)c2c(C)noc2C(F)(F)F)C1	ZINC001008698325	1336913495	/nfs/dbraw/zinc/91/34/95/1336913495.db2.gz	RMABTXCAXCXCRE-LBPRGKRZSA-N	0	3	345.365	3.162	20	30		EGEDHN
C#CCCN1CCC[C@H](NC(=O)C(C)(C)c2ccccc2Cl)C1	ZINC001009262356	1336992765	/nfs/dbraw/zinc/99/27/65/1336992765.db2.gz	FRDQVOMECAKHDL-HNNXBMFYSA-N	0	3	332.875	3.222	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN([C@@H](C)c3cccc(C)c3)C2)cn1	ZINC001009273185	1336995214	/nfs/dbraw/zinc/99/52/14/1336995214.db2.gz	DNBSFKLEAWOYGK-LAUBAEHRSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN([C@@H](CC)c3ccccc3)C2)cn1	ZINC001009278781	1336995545	/nfs/dbraw/zinc/99/55/45/1336995545.db2.gz	WFWZPXYPCMEQHY-RTWAWAEBSA-N	0	3	347.462	3.408	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)Cc2ccc3c(c2)CCCC3)C1	ZINC001009472742	1337028621	/nfs/dbraw/zinc/02/86/21/1337028621.db2.gz	VWVDAJKWCPYDQG-FQEVSTJZSA-N	0	3	326.484	3.265	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CCN(Cc2ccccc2CC)C1	ZINC001014725444	1337886768	/nfs/dbraw/zinc/88/67/68/1337886768.db2.gz	NTZGGUWVVBWMBU-LJQANCHMSA-N	0	3	337.467	3.241	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN([C@@H]3CCc4ccccc43)C2)cc1	ZINC001015482394	1338155086	/nfs/dbraw/zinc/15/50/86/1338155086.db2.gz	NUIHIYWLSWRBOA-TZIWHRDSSA-N	0	3	330.431	3.160	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CCN([C@@H](CC)c3ccccc3)C2)c1	ZINC001015679956	1338255475	/nfs/dbraw/zinc/25/54/75/1338255475.db2.gz	QRAXFTRMCCBXSL-UXHICEINSA-N	0	3	333.435	3.018	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2cc3ccc(F)cc3s2)CC1	ZINC001016715029	1338700318	/nfs/dbraw/zinc/70/03/18/1338700318.db2.gz	MMCLHJFZCXQXMP-QGZVFWFLSA-N	0	3	342.439	3.258	20	30		EGEDHN
Cc1cocc1C(=O)N[C@H]1CC12CCN(Cc1cccc(C#N)c1)CC2	ZINC001016768073	1338718273	/nfs/dbraw/zinc/71/82/73/1338718273.db2.gz	WIJQPCWKNYYREV-IBGZPJMESA-N	0	3	349.434	3.244	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cc(C(C)(C)C)oc2C)CC1	ZINC001016843936	1338744129	/nfs/dbraw/zinc/74/41/29/1338744129.db2.gz	SJNFWXXSILCWEG-KRWDZBQOSA-N	0	3	342.483	3.493	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)Cc2ccc(Cl)c(F)c2)CC1	ZINC001016848830	1338746842	/nfs/dbraw/zinc/74/68/42/1338746842.db2.gz	ZULVHVAQPPAGQZ-KRWDZBQOSA-N	0	3	348.849	3.016	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)C2(c3ccccc3C)CCC2)CC1	ZINC001016949390	1338781792	/nfs/dbraw/zinc/78/17/92/1338781792.db2.gz	DJANRZHTZYLACE-LJQANCHMSA-N	0	3	336.479	3.021	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCCN(C(=O)C(C)(C)F)C1	ZINC001017016360	1338809262	/nfs/dbraw/zinc/80/92/62/1338809262.db2.gz	BULCMAOTCXAILT-ZDUSSCGKSA-N	0	3	337.464	3.038	20	30		EGEDHN
CCCC(=O)N1CCC[C@@H](CN(C)Cc2cc(C#N)ccc2OC)C1	ZINC001017023082	1338814721	/nfs/dbraw/zinc/81/47/21/1338814721.db2.gz	LSROHLJYJMVCQQ-KRWDZBQOSA-N	0	3	343.471	3.037	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@H]1CCC(F)(F)C1	ZINC001017604800	1339376016	/nfs/dbraw/zinc/37/60/16/1339376016.db2.gz	KOQWAPXYIILFJQ-OAGGEKHMSA-N	0	3	326.431	3.453	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(F)c2ccncc12	ZINC001017835391	1339428678	/nfs/dbraw/zinc/42/86/78/1339428678.db2.gz	KYASNUJKWPVFMP-GASCZTMLSA-N	0	3	339.414	3.239	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CO[C@@H]1CCCC[C@H]1C	ZINC001018016331	1339481876	/nfs/dbraw/zinc/48/18/76/1339481876.db2.gz	JHCBLLGGZXHNGB-AKHDSKFASA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CO[C@H]1CCCC[C@H]1C	ZINC001018016334	1339482139	/nfs/dbraw/zinc/48/21/39/1339482139.db2.gz	JHCBLLGGZXHNGB-YRXWBPOGSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(C(C)C)[nH]c1=O	ZINC001018032933	1339487134	/nfs/dbraw/zinc/48/71/34/1339487134.db2.gz	PNUJTVGFIDQPKY-IYBDPMFKSA-N	0	3	343.471	3.166	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1C[C@H]1c1ccccc1F	ZINC001018041134	1339489139	/nfs/dbraw/zinc/48/91/39/1339489139.db2.gz	LEOVLSHXKWVKKS-CIRFHOKZSA-N	0	3	328.431	3.181	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@H]1CCO[C@H](C(C)C)C1	ZINC001018161448	1339518784	/nfs/dbraw/zinc/51/87/84/1339518784.db2.gz	ZHTKANVCUURJMP-HAGHYFMRSA-N	0	3	348.531	3.469	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(COC)c(F)c1	ZINC001018215778	1339536410	/nfs/dbraw/zinc/53/64/10/1339536410.db2.gz	QDKXWSKCXJEHFR-HDICACEKSA-N	0	3	346.446	3.227	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1C[C@@H]1c1cc(F)ccc1F	ZINC001018291728	1339565036	/nfs/dbraw/zinc/56/50/36/1339565036.db2.gz	LYTURDGFMLHNAE-HPFXQQBRSA-N	0	3	346.421	3.320	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cncc2ccccc21	ZINC001018300063	1339568339	/nfs/dbraw/zinc/56/83/39/1339568339.db2.gz	VUOXPFRPNTZTCT-HDICACEKSA-N	0	3	335.451	3.490	20	30		EGEDHN
Cc1ccsc1C(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001018424825	1339611889	/nfs/dbraw/zinc/61/18/89/1339611889.db2.gz	IORMBGYRMFCYPD-HNNXBMFYSA-N	0	3	343.427	3.072	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)CCC3CCCC3)C2)cc1F	ZINC001018445298	1339622480	/nfs/dbraw/zinc/62/24/80/1339622480.db2.gz	IVJPZMDSPJEMSZ-SFHVURJKSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CCCN2C[C@@H](O)c2ccccc2)CC1	ZINC001028117191	1340438398	/nfs/dbraw/zinc/43/83/98/1340438398.db2.gz	NBDXQBFDQUXKIG-VQTJNVASSA-N	0	3	342.483	3.047	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)NC[C@H]1CCCN1Cc1cc(C)sc1C	ZINC001028147275	1340452022	/nfs/dbraw/zinc/45/20/22/1340452022.db2.gz	SRMRCBBSFUVGCG-KURKYZTESA-N	0	3	348.512	3.037	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1ccc(N(C)C(C)C)cc1	ZINC001028347235	1340587369	/nfs/dbraw/zinc/58/73/69/1340587369.db2.gz	RAOLREVDFQLSPM-LJQANCHMSA-N	0	3	329.488	3.302	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](CNC(=O)c3ccc(Cl)o3)C2)cc1	ZINC001028408715	1340630118	/nfs/dbraw/zinc/63/01/18/1340630118.db2.gz	JJQLSQSSWNDOKT-OAHLLOKOSA-N	0	3	343.814	3.057	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](CNC(=O)c3ccoc3Cl)C2)cc1	ZINC001028508314	1340677382	/nfs/dbraw/zinc/67/73/82/1340677382.db2.gz	PBECKHUOIQFTGW-HNNXBMFYSA-N	0	3	343.814	3.057	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CCN(Cc3c(C)onc3CC)C2)CC1	ZINC001028781314	1340814001	/nfs/dbraw/zinc/81/40/01/1340814001.db2.gz	UIPYZLDTOLEKPT-INIZCTEOSA-N	0	3	345.487	3.230	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H](CNC(=O)c3c[nH]cc3C3CC3)C2)c1	ZINC001028900753	1340878624	/nfs/dbraw/zinc/87/86/24/1340878624.db2.gz	JSIQGKKMJNLACM-QGZVFWFLSA-N	0	3	348.450	3.016	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)NC[C@@H]2CCN(Cc3ccc(C#N)cc3)C2)CC1	ZINC001028938263	1340887636	/nfs/dbraw/zinc/88/76/36/1340887636.db2.gz	KTPPXHIMDZJJHA-VDGAXYAQSA-N	0	3	339.483	3.323	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)c2ccc(-c3cccs3)o2)C1	ZINC001028963365	1340894508	/nfs/dbraw/zinc/89/45/08/1340894508.db2.gz	MMVGWXDQUYJSRA-CQSZACIVSA-N	0	3	328.437	3.083	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC([C@H](C)NCc2ccccc2C#N)CC1	ZINC001029054368	1340920121	/nfs/dbraw/zinc/92/01/21/1340920121.db2.gz	UGEIGFMZLRNLNB-HOTGVXAUSA-N	0	3	327.472	3.321	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC([C@@H](C)NCc2ccccc2C#N)CC1	ZINC001029078260	1340925181	/nfs/dbraw/zinc/92/51/81/1340925181.db2.gz	NSOXFRDJSPHEKL-KUJWUYCRSA-N	0	3	325.456	3.241	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)C1CCN(C(=O)CC2(C)CC2)CC1	ZINC001029118860	1340934567	/nfs/dbraw/zinc/93/45/67/1340934567.db2.gz	MOUDQOGERQRGBE-MRXNPFEDSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC([C@@H](C)NCc2cnc(C)o2)CC1	ZINC001029125644	1340936235	/nfs/dbraw/zinc/93/62/35/1340936235.db2.gz	FTWWVQYZESCLRN-CQSZACIVSA-N	0	3	333.476	3.302	20	30		EGEDHN
C[C@@H](NCc1cc(F)ccc1C#N)C1CCN(C(=O)[C@H]2C[C@@H]2C)CC1	ZINC001029130309	1340938071	/nfs/dbraw/zinc/93/80/71/1340938071.db2.gz	VMVGXCZWUIAZDB-KSMMKXTCSA-N	0	3	343.446	3.070	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC([C@@H](C)NCc3ocnc3C)CC2)CC1	ZINC001029136775	1340939788	/nfs/dbraw/zinc/93/97/88/1340939788.db2.gz	LNVSHDDLTYHCPP-OAHLLOKOSA-N	0	3	345.487	3.446	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)C1CCN(C(=O)CC(C)(F)F)CC1	ZINC001029140508	1340940911	/nfs/dbraw/zinc/94/09/11/1340940911.db2.gz	XKKJBJOMPDHJRW-AWEZNQCLSA-N	0	3	349.425	3.320	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CC[C@@H](C1)N2CC[C@H]1CCCCO1	ZINC001029453734	1340993635	/nfs/dbraw/zinc/99/36/35/1340993635.db2.gz	JTQIDQXSRWGCCM-AJYBTWMASA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H]3CC[C@@H](C2)N3C[C@@H](OC)C2CCC2)CC1	ZINC001029457696	1340994661	/nfs/dbraw/zinc/99/46/61/1340994661.db2.gz	QVRKZBWZOVLHQK-HSALFYBXSA-N	0	3	346.515	3.223	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@H](CN(C)Cc2cnoc2C)C1	ZINC001029748922	1341063095	/nfs/dbraw/zinc/06/30/95/1341063095.db2.gz	OZVWSSDRVDHIRD-CQSZACIVSA-N	0	3	339.867	3.042	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](CN(C)Cc2oc(CC)nc2C)C1	ZINC001029801059	1341077162	/nfs/dbraw/zinc/07/71/62/1341077162.db2.gz	GBABBWUGYISFGR-HNNXBMFYSA-N	0	3	333.476	3.038	20	30		EGEDHN
Cc1coc(C(=O)N2CC[C@H](CN(C)Cc3ccc(C#N)s3)C2)c1	ZINC001029813520	1341083357	/nfs/dbraw/zinc/08/33/57/1341083357.db2.gz	WWLOOOSPWBAFFG-CQSZACIVSA-N	0	3	343.452	3.115	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](CN(C)[C@H](C)c3cnccn3)C2)CC1	ZINC001029825357	1341087203	/nfs/dbraw/zinc/08/72/03/1341087203.db2.gz	CENDPFMZWMAVKG-IAGOWNOFSA-N	0	3	342.487	3.064	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H](CN(C)Cc2oc(CC)nc2C)C1	ZINC001029828681	1341088807	/nfs/dbraw/zinc/08/88/07/1341088807.db2.gz	IGFXZMHGBWCPNI-UZLBHIALSA-N	0	3	347.503	3.428	20	30		EGEDHN
C=CCN1CCC[C@H](N(Cc2ccccc2)C(=O)c2cnc(C)[nH]2)C1	ZINC001029917810	1341118222	/nfs/dbraw/zinc/11/82/22/1341118222.db2.gz	QANMWNZNWNOUQC-SFHVURJKSA-N	0	3	338.455	3.011	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)CC1CCN(C(=O)c2ccco2)CC1	ZINC001029927540	1341123036	/nfs/dbraw/zinc/12/30/36/1341123036.db2.gz	DFIIXZMLVFAAMX-UHFFFAOYSA-N	0	3	343.452	3.197	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC(CN(C)Cc3cnc(C)s3)CC2)C1	ZINC001029993298	1341150162	/nfs/dbraw/zinc/15/01/62/1341150162.db2.gz	AVFNKQCQLVNKNS-UHFFFAOYSA-N	0	3	347.528	3.478	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC(CN(C)Cc3scnc3C)CC2)C1	ZINC001029993907	1341150437	/nfs/dbraw/zinc/15/04/37/1341150437.db2.gz	RKNBIMHUAKDOGG-UHFFFAOYSA-N	0	3	347.528	3.478	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccnc(-c2ccco2)c1	ZINC001032466038	1341515056	/nfs/dbraw/zinc/51/50/56/1341515056.db2.gz	KJJDEDBLAKLJEU-IRXDYDNUSA-N	0	3	337.423	3.207	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N1C[C@@H]2C[C@H]1CN2CCC1=CCCCC1	ZINC001032677571	1341578855	/nfs/dbraw/zinc/57/88/55/1341578855.db2.gz	MCCHATAJCKQOKM-MUGJNUQGSA-N	0	3	344.499	3.143	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N1C[C@@H]2C[C@H]1CN2CCCC1CCCC1	ZINC001032677994	1341579849	/nfs/dbraw/zinc/57/98/49/1341579849.db2.gz	ZWUHIBCGERNOAY-MUGJNUQGSA-N	0	3	346.515	3.223	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H](C)c1ccc(F)cc1F	ZINC001032792663	1341614810	/nfs/dbraw/zinc/61/48/10/1341614810.db2.gz	JDEMEPWYQUOKHO-KBMXLJTQSA-N	0	3	334.410	3.320	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC001033089774	1341719392	/nfs/dbraw/zinc/71/93/92/1341719392.db2.gz	CRZUKWSZOXYCGZ-ZDUSSCGKSA-N	0	3	326.362	3.486	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2ncoc2-c2ccccc2)C1	ZINC001033126666	1341733735	/nfs/dbraw/zinc/73/37/35/1341733735.db2.gz	OACSNAGENBCXSG-INIZCTEOSA-N	0	3	325.412	3.064	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@H]2CCN(CCOc3cccc(C)c3)C2)C1	ZINC001033394549	1341811226	/nfs/dbraw/zinc/81/12/26/1341811226.db2.gz	WHTKUOHFADXWMJ-SFHVURJKSA-N	0	3	342.483	3.263	20	30		EGEDHN
C#CCCN1CC[C@@H](N(C)C(=O)c2cc(Cl)cc(Cl)c2)C1	ZINC001033612446	1341902243	/nfs/dbraw/zinc/90/22/43/1341902243.db2.gz	DWHJQVZURDKDDB-OAHLLOKOSA-N	0	3	325.239	3.163	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)C2(c3cc(C)cc(C)c3)CC2)C1	ZINC001033674323	1341940799	/nfs/dbraw/zinc/94/07/99/1341940799.db2.gz	SWAALJSFVIIBAH-IBGZPJMESA-N	0	3	326.484	3.444	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)[C@@H]2C[C@H]2c2cccc(F)c2F)C1	ZINC001033679869	1341946808	/nfs/dbraw/zinc/94/68/08/1341946808.db2.gz	MHDXLFLRHGUFPA-VNQPRFMTSA-N	0	3	334.410	3.177	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](N(C)C(=O)c2cnc(CC(C)C)s2)C1	ZINC001033699941	1341966642	/nfs/dbraw/zinc/96/66/42/1341966642.db2.gz	NWUXTJDNACOCFT-OAHLLOKOSA-N	0	3	335.517	3.454	20	30		EGEDHN
C=CCN1CC[C@H](N(CC)C(=O)c2cn(C)c3ccc(F)cc23)C1	ZINC001033856658	1342046927	/nfs/dbraw/zinc/04/69/27/1342046927.db2.gz	VAYKDUWIUBUWSX-HNNXBMFYSA-N	0	3	329.419	3.040	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cnc3ccsc3c2)C1	ZINC001033920742	1342088862	/nfs/dbraw/zinc/08/88/62/1342088862.db2.gz	VIODNRWKYGWHNT-HNNXBMFYSA-N	0	3	329.469	3.409	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2[nH]c3ccc(C)cc3c2C)C1	ZINC001034004363	1342142057	/nfs/dbraw/zinc/14/20/57/1342142057.db2.gz	MDAVGEIWSPQTFU-QGZVFWFLSA-N	0	3	337.467	3.344	20	30		EGEDHN
C=CCCN1CC[C@H](N(CC)C(=O)c2ccc(Br)o2)C1	ZINC001034026873	1342166663	/nfs/dbraw/zinc/16/66/63/1342166663.db2.gz	ZEYRRFZADSDYFQ-LBPRGKRZSA-N	0	3	341.249	3.155	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@H]2Cc3c2cccc3Cl)C1	ZINC001034051632	1342193676	/nfs/dbraw/zinc/19/36/76/1342193676.db2.gz	XQORKNQHWACBBQ-YOEHRIQHSA-N	0	3	332.875	3.479	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cc(NC(C)=O)ccc2C)C1	ZINC001034053704	1342194859	/nfs/dbraw/zinc/19/48/59/1342194859.db2.gz	FMGOJBDKUAJKMC-GOSISDBHSA-N	0	3	343.471	3.066	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)C1	ZINC001034053671	1342194912	/nfs/dbraw/zinc/19/49/12/1342194912.db2.gz	VBLHQNPSJQDPEI-GBESFXJTSA-N	0	3	330.447	3.428	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccnn2C(CC)CC)C1	ZINC001034249121	1342347137	/nfs/dbraw/zinc/34/71/37/1342347137.db2.gz	IFXSFMKYINHNNW-MRXNPFEDSA-N	0	3	332.492	3.405	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@@H]2Cc3cc(Cl)ccc3O2)C1	ZINC001034296375	1342379879	/nfs/dbraw/zinc/37/98/79/1342379879.db2.gz	IXHPFMLVENEEGK-AEFFLSMTSA-N	0	3	348.874	3.190	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cncc3sccc32)C1	ZINC001034362098	1342433036	/nfs/dbraw/zinc/43/30/36/1342433036.db2.gz	YNMDXHFEHCMTIU-CQSZACIVSA-N	0	3	329.469	3.457	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)C2(c3cccnc3)CCCC2)C1	ZINC001034363713	1342434560	/nfs/dbraw/zinc/43/45/60/1342434560.db2.gz	FLKMFPQIVKXBSK-GOSISDBHSA-N	0	3	327.472	3.050	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)Cc2c[nH]c3ccc(F)cc23)C1	ZINC001034418835	1342480642	/nfs/dbraw/zinc/48/06/42/1342480642.db2.gz	WFXWIKVIULSECU-MRXNPFEDSA-N	0	3	329.419	3.006	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@H]2CCc3cccc(OC)c32)C1	ZINC001034432017	1342494188	/nfs/dbraw/zinc/49/41/88/1342494188.db2.gz	MZYCNAOGVRBWLL-ROUUACIJSA-N	0	3	342.483	3.272	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2ccc(-c3ccccc3)nc2)C1	ZINC001034462778	1342518722	/nfs/dbraw/zinc/51/87/22/1342518722.db2.gz	VTSGHJZYLXSCSL-HXUWFJFHSA-N	0	3	347.462	3.356	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@]2(C)CCOc3ccccc32)C1	ZINC001034485591	1342544132	/nfs/dbraw/zinc/54/41/32/1342544132.db2.gz	FJZYHAFGPMGOFS-LAUBAEHRSA-N	0	3	342.483	3.274	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cc(-c3ccc(C)o3)n[nH]2)C1	ZINC001034528021	1342583803	/nfs/dbraw/zinc/58/38/03/1342583803.db2.gz	ILLBFSAXZBDTMH-HNNXBMFYSA-N	0	3	342.443	3.139	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@]2(C)CCc3ccccc32)C1	ZINC001034543876	1342604272	/nfs/dbraw/zinc/60/42/72/1342604272.db2.gz	BPZISZGSECFIIY-GHTZIAJQSA-N	0	3	326.484	3.437	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)[C@H]2CC=CCC2)CC1	ZINC001034593488	1342638030	/nfs/dbraw/zinc/63/80/30/1342638030.db2.gz	VSUTWHWPABQWJQ-KKUMJFAQSA-N	0	3	341.293	3.268	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N[C@H]1CC[C@H](NCc2cc(F)ccc2C#N)CC1	ZINC001034624072	1342656778	/nfs/dbraw/zinc/65/67/78/1342656778.db2.gz	ANSBKWRUXFFQPU-KZNAEPCWSA-N	0	3	343.446	3.260	20	30		EGEDHN
CC1(C(=O)N[C@H]2CC[C@H](NCc3cc(F)ccc3C#N)CC2)CC1	ZINC001034653680	1342672738	/nfs/dbraw/zinc/67/27/38/1342672738.db2.gz	PXNMFNLMBKCXCR-QAQDUYKDSA-N	0	3	329.419	3.014	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC[C@H](NCc3ncc(C)s3)CC2)C1	ZINC001034729517	1342724739	/nfs/dbraw/zinc/72/47/39/1342724739.db2.gz	NSZPVOMCTHZZHA-SHTZXODSSA-N	0	3	333.501	3.325	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)Cc2ccc(OC)cc2)C12CCC2	ZINC001078793669	1357088087	/nfs/dbraw/zinc/08/80/87/1357088087.db2.gz	ZTJICJHARCUCEQ-IRXDYDNUSA-N	0	3	348.874	3.007	20	30		EGEDHN
Cc1ccc(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)s2)s1	ZINC001034842833	1342796825	/nfs/dbraw/zinc/79/68/25/1342796825.db2.gz	CJCOOLXHZVUIHT-CYBMUJFWSA-N	0	3	345.493	3.384	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)C2CCCCC2)c(F)c1	ZINC001034847741	1342801205	/nfs/dbraw/zinc/80/12/05/1342801205.db2.gz	ZFGNHQKKKSYUKZ-GOSISDBHSA-N	0	3	343.446	3.358	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)C[C@H]2C=CCC2)cc1F	ZINC001034853952	1342805477	/nfs/dbraw/zinc/80/54/77/1342805477.db2.gz	ONKXZLBPLZYCEX-MAUKXSAKSA-N	0	3	341.430	3.134	20	30		EGEDHN
CCc1occc1C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)s1	ZINC001034923866	1342838129	/nfs/dbraw/zinc/83/81/29/1342838129.db2.gz	HPSHWCYRETUJIC-CYBMUJFWSA-N	0	3	343.452	3.170	20	30		EGEDHN
CCc1ccc(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)s2)o1	ZINC001034977000	1342862227	/nfs/dbraw/zinc/86/22/27/1342862227.db2.gz	HTBQGPGDJGFQNN-CYBMUJFWSA-N	0	3	343.452	3.170	20	30		EGEDHN
C=C[C@H](C(=O)N1CCC[C@@H]1CNCc1ncccc1C)c1ccccc1	ZINC001035131417	1342947752	/nfs/dbraw/zinc/94/77/52/1342947752.db2.gz	QLXNNVYCZMQGDR-UXHICEINSA-N	0	3	349.478	3.440	20	30		EGEDHN
C=C[C@@H](C(=O)N1CCC[C@@H]1CNCc1cccnc1)c1ccccc1	ZINC001035133765	1342949760	/nfs/dbraw/zinc/94/97/60/1342949760.db2.gz	NHDNZBBQMLZFLW-WOJBJXKFSA-N	0	3	335.451	3.132	20	30		EGEDHN
CC(=O)N1CCC2(CCN(CC#Cc3ccc(Cl)cc3)C2)CC1	ZINC001035144431	1342957370	/nfs/dbraw/zinc/95/73/70/1342957370.db2.gz	YTGYSIJIGOIFNT-UHFFFAOYSA-N	0	3	330.859	3.026	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)Cc2ccc(C)s2)C12CCC2	ZINC001078819573	1357099818	/nfs/dbraw/zinc/09/98/18/1357099818.db2.gz	POUGEGYSSRORNS-CABCVRRESA-N	0	3	338.904	3.369	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC3(CCN(Cc4cncs4)C3)CC2)C1	ZINC001035227605	1343048631	/nfs/dbraw/zinc/04/86/31/1343048631.db2.gz	RYBJXGLCTJORHK-UHFFFAOYSA-N	0	3	345.512	3.314	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1nsc3ccccc31)CC2	ZINC001035715472	1343149022	/nfs/dbraw/zinc/14/90/22/1343149022.db2.gz	ZZEXQCKFGJZMQA-UHFFFAOYSA-N	0	3	341.480	3.410	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC2(CN(C[C@@H]3CCCCO3)C2)CC1	ZINC001035767530	1343180092	/nfs/dbraw/zinc/18/00/92/1343180092.db2.gz	SUERXVVOTCUYJT-KRWDZBQOSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC3(CN(C[C@@H]4CC[C@H](C)O4)C3)CC2)CC1	ZINC001035787282	1343199219	/nfs/dbraw/zinc/19/92/19/1343199219.db2.gz	OFLQCQASCYIGPK-HKUYNNGSSA-N	0	3	346.515	3.225	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)COc1cccc(Cl)c1)CC2	ZINC001035850214	1343229743	/nfs/dbraw/zinc/22/97/43/1343229743.db2.gz	RROBFTAXTVVGJQ-UHFFFAOYSA-N	0	3	348.874	3.219	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)C13CC(c4ccccc4)(C1)C3)CC2	ZINC001035858199	1343234660	/nfs/dbraw/zinc/23/46/60/1343234660.db2.gz	DWLRWZIFKLHMHD-UHFFFAOYSA-N	0	3	348.490	3.056	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC(C)(C)C)CC[C@@H]1NCc1cc(F)ccc1C#N	ZINC001035906170	1343262885	/nfs/dbraw/zinc/26/28/85/1343262885.db2.gz	APZIAUAGHZUAAA-KDOFPFPSSA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@H]1CN(C(=O)CC(C)(C)C)CC[C@H]1NCc1ccccc1C#N	ZINC001035907903	1343263857	/nfs/dbraw/zinc/26/38/57/1343263857.db2.gz	FIGUCNOHVLQEKM-MAUKXSAKSA-N	0	3	327.472	3.321	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](NCc2ccn(C(C)C)n2)[C@@H](C)C1	ZINC001036140662	1343325177	/nfs/dbraw/zinc/32/51/77/1343325177.db2.gz	CZSLVSLZCBRSMV-RDJZCZTQSA-N	0	3	332.492	3.003	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CC3(CC3)C2)CC[C@@H]1NCc1ccccc1C#N	ZINC001036186289	1343352009	/nfs/dbraw/zinc/35/20/09/1343352009.db2.gz	MHTMSBLIYCAIOT-BEFAXECRSA-N	0	3	337.467	3.075	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H]([C@@H](C)NCc2cc(C)n(C)n2)C1	ZINC001036436163	1343486325	/nfs/dbraw/zinc/48/63/25/1343486325.db2.gz	BUDUPVKSTZQEOB-SJORKVTESA-N	0	3	346.519	3.048	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]([C@H](C)NCc2nc(C)cs2)C1	ZINC001036439695	1343488423	/nfs/dbraw/zinc/48/84/23/1343488423.db2.gz	LMSNPFNQDVEHAD-GJZGRUSLSA-N	0	3	335.517	3.380	20	30		EGEDHN
CCCC(=O)N1CCC[C@H](C)[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001036492079	1343514956	/nfs/dbraw/zinc/51/49/56/1343514956.db2.gz	BMAIQOSVJLITIY-KSSFIOAISA-N	0	3	331.435	3.214	20	30		EGEDHN
C[C@H]1CCCN(C(=O)CC2CC2)[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001036492449	1343515029	/nfs/dbraw/zinc/51/50/29/1343515029.db2.gz	CXPMASHUUINJSK-IFXJQAMLSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)c2ccoc2)[C@@H]1CNCc1ccc(C#N)s1	ZINC001036501821	1343520111	/nfs/dbraw/zinc/52/01/11/1343520111.db2.gz	OGWCDHJSOJDXDL-CXAGYDPISA-N	0	3	343.452	3.243	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccc(C#N)c(F)c2)C1	ZINC001036631622	1343588949	/nfs/dbraw/zinc/58/89/49/1343588949.db2.gz	AKKIDKAIIPBJPD-PKOBYXMFSA-N	0	3	341.430	3.086	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@H]3[C@@H](CCN3CC#Cc3ccccc3)C2)o1	ZINC001036637535	1343593447	/nfs/dbraw/zinc/59/34/47/1343593447.db2.gz	PFRUXRUDQGGYOB-PMACEKPBSA-N	0	3	348.446	3.176	20	30		EGEDHN
O=C(CCC1CC1)N1CC[C@H]2[C@H](CCN2CC#Cc2ccccc2)C1	ZINC001036670581	1343613633	/nfs/dbraw/zinc/61/36/33/1343613633.db2.gz	WWOUDSPXJYUGBM-RTWAWAEBSA-N	0	3	336.479	3.151	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@H]2[C@@H](CCN2Cc2ccccc2C#N)C1	ZINC001036687125	1343629439	/nfs/dbraw/zinc/62/94/39/1343629439.db2.gz	XSIARGSBLQMTAT-ROUUACIJSA-N	0	3	341.430	3.244	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@H]2CN(C(=O)C=C3CCC3)CC[C@@H]21	ZINC001036688975	1343632198	/nfs/dbraw/zinc/63/21/98/1343632198.db2.gz	BCBGIGCGFAHMAI-PMACEKPBSA-N	0	3	335.451	3.091	20	30		EGEDHN
CCC1(C(=O)N2CC[C@@H]3[C@H](CCN3CC#Cc3ccccc3)C2)CC1	ZINC001036812342	1343748270	/nfs/dbraw/zinc/74/82/70/1343748270.db2.gz	GAGDKZSHMPZSMQ-WOJBJXKFSA-N	0	3	336.479	3.151	20	30		EGEDHN
CC1(C(=O)N2CC[C@H]3[C@@H](CCN3CC#Cc3ccccc3)C2)CC=CC1	ZINC001036813510	1343750503	/nfs/dbraw/zinc/75/05/03/1343750503.db2.gz	YINYVNMQYWESOY-SFTDATJTSA-N	0	3	348.490	3.317	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@H]2CN(C(=O)C3CC4(CC4)C3)CC[C@@H]21	ZINC001036818972	1343758042	/nfs/dbraw/zinc/75/80/42/1343758042.db2.gz	LMXIDOAISRZKQU-ICSRJNTNSA-N	0	3	349.478	3.171	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCC[C@@H]2CNCc2csc(CC)n2)C1	ZINC001037071431	1343964573	/nfs/dbraw/zinc/96/45/73/1343964573.db2.gz	HCHABRXGSRRJDN-GDBMZVCRSA-N	0	3	347.528	3.436	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCC[C@H]2CNCc2ncc(C)s2)C1	ZINC001037074736	1343967998	/nfs/dbraw/zinc/96/79/98/1343967998.db2.gz	FZESKNFTPNGECF-GJZGRUSLSA-N	0	3	333.501	3.182	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCC[C@@H]1NC(=O)CC1CC1	ZINC001037148966	1344000038	/nfs/dbraw/zinc/00/00/38/1344000038.db2.gz	MDEWOGXAMXPWNM-OALUTQOASA-N	0	3	325.456	3.123	20	30		EGEDHN
CC(C)(F)C(=O)N[C@H]1CCCC[C@H]1CNCc1ccccc1C#N	ZINC001037156071	1344006780	/nfs/dbraw/zinc/00/67/80/1344006780.db2.gz	LPSIELDXUUNGSK-IRXDYDNUSA-N	0	3	331.435	3.071	20	30		EGEDHN
CC[C@@H]1CN(C(=O)CC(C)C)CC[C@H]1NCc1cc(F)ccc1C#N	ZINC001037766647	1344079515	/nfs/dbraw/zinc/07/95/15/1344079515.db2.gz	NXGDFPZMZGUBPV-DNVCBOLYSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](NCc2cc(C)n(C)n2)[C@H](CC)C1	ZINC001037902771	1344167893	/nfs/dbraw/zinc/16/78/93/1344167893.db2.gz	GXTQSQUPZVSTQE-AEFFLSMTSA-N	0	3	346.519	3.048	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)C1CCc2ccccc2CC1	ZINC001038437863	1344427420	/nfs/dbraw/zinc/42/74/20/1344427420.db2.gz	UFHAGVYFYQLCHL-HXUWFJFHSA-N	0	3	326.484	3.338	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NC[C@@H]1CCN1CCC1CCCCC1	ZINC001038807702	1344592096	/nfs/dbraw/zinc/59/20/96/1344592096.db2.gz	LIRIVTZNKCASNJ-FHWLQOOXSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCOc1cccnc1C(=O)NC[C@@H]1CCN1CC1CCCCC1	ZINC001038902680	1344641284	/nfs/dbraw/zinc/64/12/84/1344641284.db2.gz	AFMCHYOTOFOBAH-KRWDZBQOSA-N	0	3	343.471	3.031	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc(C)oc2C)C1	ZINC001039191766	1344896622	/nfs/dbraw/zinc/89/66/22/1344896622.db2.gz	ALQKPZKGMLIFEM-PKOBYXMFSA-N	0	3	328.456	3.236	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(Cl)o2)C1	ZINC001039193469	1344899189	/nfs/dbraw/zinc/89/91/89/1344899189.db2.gz	NRVLHDRAUIFPNI-CABCVRRESA-N	0	3	334.847	3.273	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2nc(C(C)C)oc2C)C1	ZINC001039200764	1344910470	/nfs/dbraw/zinc/91/04/70/1344910470.db2.gz	REPQTPSWAUUBNQ-IAGOWNOFSA-N	0	3	343.471	3.056	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)Cc2ccsc2)C1	ZINC001039206196	1344917592	/nfs/dbraw/zinc/91/75/92/1344917592.db2.gz	GMIOOIOQKGWSRF-QZTJIDSGSA-N	0	3	330.497	3.017	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)Cc2cccc(CC)c2)C1	ZINC001039215022	1344930732	/nfs/dbraw/zinc/93/07/32/1344930732.db2.gz	VFRWIJSPZXSJRC-RTWAWAEBSA-N	0	3	338.495	3.128	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cscc2Cl)C1	ZINC001039216520	1344933124	/nfs/dbraw/zinc/93/31/24/1344933124.db2.gz	BAFLCUZCDGLZDO-BBRMVZONSA-N	0	3	336.888	3.351	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2c(C)coc2C)C1	ZINC001039221123	1344938891	/nfs/dbraw/zinc/93/88/91/1344938891.db2.gz	KPERNYPXYXLATJ-QZTJIDSGSA-N	0	3	328.456	3.236	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)CCc2cccc(C)c2)C1	ZINC001039224381	1344941969	/nfs/dbraw/zinc/94/19/69/1344941969.db2.gz	FQRYFCUKYXAMIJ-RTWAWAEBSA-N	0	3	338.495	3.264	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc(C(C)C)on2)C1	ZINC001039226206	1344944699	/nfs/dbraw/zinc/94/46/99/1344944699.db2.gz	STNYMSKDZNPRQJ-WMZOPIPTSA-N	0	3	343.471	3.138	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)Cc2ccsc2C)C1	ZINC001039230303	1344950371	/nfs/dbraw/zinc/95/03/71/1344950371.db2.gz	KAMNIIVHEGFAAX-OALUTQOASA-N	0	3	344.524	3.325	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cccc(F)c2Cl)C1	ZINC001039237826	1344960679	/nfs/dbraw/zinc/96/06/79/1344960679.db2.gz	LAHHOFYECIWVQU-PBHICJAKSA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccoc2C2CC2)C1	ZINC001039242110	1344968063	/nfs/dbraw/zinc/96/80/63/1344968063.db2.gz	ADWJIXIEHZKEIU-PKOBYXMFSA-N	0	3	340.467	3.497	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cccc(OC)c2)C1	ZINC001039248236	1344978061	/nfs/dbraw/zinc/97/80/61/1344978061.db2.gz	ACRAAXOSBITFGK-AZUAARDMSA-N	0	3	340.467	3.035	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc3ccccc3o2)C1	ZINC001039250832	1344982537	/nfs/dbraw/zinc/98/25/37/1344982537.db2.gz	QJBOBARWEWVCSN-ZWKOTPCHSA-N	0	3	336.435	3.383	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc2cnccc2c1	ZINC001039403840	1345049533	/nfs/dbraw/zinc/04/95/33/1345049533.db2.gz	SSYIJJSTTFPAEA-UXHICEINSA-N	0	3	335.451	3.029	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1CCCc2cccnc21	ZINC001039423732	1345061414	/nfs/dbraw/zinc/06/14/14/1345061414.db2.gz	JGLGFYDVWUHVKO-QYZOEREBSA-N	0	3	339.483	3.143	20	30		EGEDHN
C=C(C)CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1nc(Cl)cs1	ZINC001039425338	1345062193	/nfs/dbraw/zinc/06/21/93/1345062193.db2.gz	YHFOJESGPRSADY-OLZOCXBDSA-N	0	3	339.892	3.442	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc(F)c(Cl)c1	ZINC001039442811	1345068851	/nfs/dbraw/zinc/06/88/51/1345068851.db2.gz	UJCIPCPRYAAVQL-CABCVRRESA-N	0	3	336.838	3.273	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1[C@@H]2Cc3ccccc3[C@@H]21	ZINC001039450326	1345074130	/nfs/dbraw/zinc/07/41/30/1345074130.db2.gz	VEQOVIBLKAICDZ-LXDWIVHCSA-N	0	3	336.479	3.214	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C(C)(C)c1ccccc1F	ZINC001039452278	1345075547	/nfs/dbraw/zinc/07/55/47/1345075547.db2.gz	ONPDIOYFNCGPRY-SJORKVTESA-N	0	3	342.458	3.192	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](OC)C1CCCCC1	ZINC001039478087	1345092513	/nfs/dbraw/zinc/09/25/13/1345092513.db2.gz	XITAOAAHNCFQKF-CEXWTWQISA-N	0	3	334.504	3.223	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C1(C(F)(F)F)CCCC1	ZINC001039478941	1345093112	/nfs/dbraw/zinc/09/31/12/1345093112.db2.gz	ZAFVAFXKFPGIIC-CABCVRRESA-N	0	3	342.405	3.198	20	30		EGEDHN
C=CCn1cccc1C(=O)N1C[C@H]2CCC[C@@H](C1)N2CCC(C)C	ZINC001039644764	1345153114	/nfs/dbraw/zinc/15/31/14/1345153114.db2.gz	UYOWOXZEOSKGTA-HDICACEKSA-N	0	3	329.488	3.399	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CCC[C@@H](C1)N2C[C@@H]1CCO[C@H](C)C1	ZINC001039820631	1345199236	/nfs/dbraw/zinc/19/92/36/1345199236.db2.gz	KEIZOOBQLLMVCW-TVFCKZIOSA-N	0	3	334.504	3.079	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@]3(CCN(C(=O)C4CCC4)C3)C2)c1	ZINC001040032989	1345298186	/nfs/dbraw/zinc/29/81/86/1345298186.db2.gz	VMZDTTYANBBGLI-NRFANRHFSA-N	0	3	337.467	3.173	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)C[C@@H]3C[C@H]3c3ccccc3)C2)C1	ZINC001040204964	1345374952	/nfs/dbraw/zinc/37/49/52/1345374952.db2.gz	LHJOYTDVWHOSDV-ONTIZHBOSA-N	0	3	336.479	3.128	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@@H]3CCC(C)=C(C)C3)C2)C1	ZINC001040217054	1345378777	/nfs/dbraw/zinc/37/87/77/1345378777.db2.gz	RUMJCFZSZWAMCA-CTNGQTDRSA-N	0	3	328.500	3.461	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3nsc4ccccc43)C2)C1	ZINC001040221569	1345381004	/nfs/dbraw/zinc/38/10/04/1345381004.db2.gz	SXEOCTUHRBOGKG-IBGZPJMESA-N	0	3	341.480	3.410	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ccc4occc4c3)C2)C1	ZINC001040221610	1345381267	/nfs/dbraw/zinc/38/12/67/1345381267.db2.gz	TZSKIWGQEINEHV-NRFANRHFSA-N	0	3	336.435	3.384	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@]3(CCN(C(=O)c4cc[nH]c4)C3)C2)c1	ZINC001040222681	1345381925	/nfs/dbraw/zinc/38/19/25/1345381925.db2.gz	GWDJKXBCTJMZFM-OAQYLSRUSA-N	0	3	348.450	3.015	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cc(F)ccc3CC)C2)C1	ZINC001040281361	1345409746	/nfs/dbraw/zinc/40/97/46/1345409746.db2.gz	NNCGINOXWRGQKG-NRFANRHFSA-N	0	3	342.458	3.340	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3cc(C)cc(Cl)c3)C2)C1	ZINC001040293013	1345417034	/nfs/dbraw/zinc/41/70/34/1345417034.db2.gz	OTWSFNWLKXEYAZ-IBGZPJMESA-N	0	3	330.859	3.210	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cc4ccc(C)cc4[nH]3)C2)C1	ZINC001040318579	1345428684	/nfs/dbraw/zinc/42/86/84/1345428684.db2.gz	VOGLRPXPOZIPDM-QFIPXVFZSA-N	0	3	349.478	3.428	20	30		EGEDHN
CC[C@H](F)C(=O)N1CC[C@]2(C1)CCCN(Cc1cccc(C#N)c1)C2	ZINC001040337533	1345440822	/nfs/dbraw/zinc/44/08/22/1345440822.db2.gz	NEZJLIGIGDUPRK-AZUAARDMSA-N	0	3	343.446	3.121	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)Cc3cccc(Cl)c3)C2)C1	ZINC001040372813	1345460562	/nfs/dbraw/zinc/46/05/62/1345460562.db2.gz	ROGGICBHQFZBIZ-FQEVSTJZSA-N	0	3	344.886	3.220	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(C)c(Cl)c3)C2)C1	ZINC001040374088	1345461228	/nfs/dbraw/zinc/46/12/28/1345461228.db2.gz	YQDOFYIEBKWCAP-LJQANCHMSA-N	0	3	330.859	3.210	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@H](C)c3ccsc3)C2)C1	ZINC001040392859	1345473745	/nfs/dbraw/zinc/47/37/45/1345473745.db2.gz	XHHFDCIFROOACP-APWZRJJASA-N	0	3	330.497	3.189	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@]3(CCN(C(=O)[C@H]4CC45CC5)C3)C2)cc1	ZINC001040421063	1345488187	/nfs/dbraw/zinc/48/81/87/1345488187.db2.gz	DJYAYOIHCNIABL-CTNGQTDRSA-N	0	3	349.478	3.173	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3sc(C)cc3OC)C2)C1	ZINC001040432688	1345495748	/nfs/dbraw/zinc/49/57/48/1345495748.db2.gz	PWLAFHRWPJWPGP-IBGZPJMESA-N	0	3	346.496	3.017	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3oc(CCC)nc3C)C2)C1	ZINC001040496534	1345520424	/nfs/dbraw/zinc/52/04/24/1345520424.db2.gz	JIKJWNNDDYQECA-LJQANCHMSA-N	0	3	331.460	3.050	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cccc(Cl)c3)C2)C1	ZINC001040503505	1345523118	/nfs/dbraw/zinc/52/31/18/1345523118.db2.gz	UPLQFTIZPAZBEW-LJQANCHMSA-N	0	3	330.859	3.291	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@@]3(C)CC=C(C)CC3)C2)C1	ZINC001040539872	1345537624	/nfs/dbraw/zinc/53/76/24/1345537624.db2.gz	SCJUNENNLGWOKH-LEWJYISDSA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@H](C)Cc3ccc(C)cc3)C2)C1	ZINC001040542867	1345538755	/nfs/dbraw/zinc/53/87/55/1345538755.db2.gz	MKLJXLVJQQDNRO-KNQAVFIVSA-N	0	3	338.495	3.121	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC2(C1)CCN(Cc1ccccc1Cl)CC2	ZINC001040643236	1345558945	/nfs/dbraw/zinc/55/89/45/1345558945.db2.gz	HASJNTZLTGPRLK-HNNXBMFYSA-N	0	3	345.874	3.314	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CCN(C(=O)C4CC=CC4)C3)CC2)c1	ZINC001040650058	1345560003	/nfs/dbraw/zinc/56/00/03/1345560003.db2.gz	IVRGYHOJVRUTNQ-UHFFFAOYSA-N	0	3	349.478	3.339	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccc([C@H]4C[C@@H]4C)o3)C2)CC1	ZINC001040701193	1345567568	/nfs/dbraw/zinc/56/75/68/1345567568.db2.gz	WGTBNKHZSKBDIR-IRXDYDNUSA-N	0	3	340.467	3.354	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)Cc3ccc(C)cc3Cl)C2)CC1	ZINC001040753316	1345574910	/nfs/dbraw/zinc/57/49/10/1345574910.db2.gz	RYHSQKYRJAGZMZ-UHFFFAOYSA-N	0	3	344.886	3.139	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@H]3[C@@H](C=C(C)C)C3(C)C)C2)CC1	ZINC001040766035	1345576586	/nfs/dbraw/zinc/57/65/86/1345576586.db2.gz	YXCXJXZNAVUNAB-QZTJIDSGSA-N	0	3	328.500	3.173	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@@H]3[C@@H](C=C(C)C)C3(C)C)C2)CC1	ZINC001040766034	1345576667	/nfs/dbraw/zinc/57/66/67/1345576667.db2.gz	YXCXJXZNAVUNAB-MSOLQXFVSA-N	0	3	328.500	3.173	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CCC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001040804383	1345580234	/nfs/dbraw/zinc/58/02/34/1345580234.db2.gz	RQXJSACCASEKDS-GOSISDBHSA-N	0	3	343.446	3.121	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cc4occc4s3)C2)CC1	ZINC001040847767	1345587829	/nfs/dbraw/zinc/58/78/29/1345587829.db2.gz	YZFXEGQRHSAOPE-UHFFFAOYSA-N	0	3	328.437	3.056	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3scnc3C(C)C)C2)CC1	ZINC001040876097	1345593121	/nfs/dbraw/zinc/59/31/21/1345593121.db2.gz	AUXNGFNELOYFCM-UHFFFAOYSA-N	0	3	345.512	3.218	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)C(C)(C)Cc3ccccc3)C2)CC1	ZINC001040908326	1345597979	/nfs/dbraw/zinc/59/79/79/1345597979.db2.gz	LQEBOTZZBZEBNN-UHFFFAOYSA-N	0	3	338.495	3.203	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)Cc3cc(C)ccc3F)C2)CC1	ZINC001040920413	1345600894	/nfs/dbraw/zinc/60/08/94/1345600894.db2.gz	TTXGNHDQYZAYBX-UHFFFAOYSA-N	0	3	342.458	3.014	20	30		EGEDHN
Cc1cccc(Cl)c1CN1CC[C@]2(CCN(C(=O)[C@@H](C)C#N)C2)C1	ZINC001041137494	1345658939	/nfs/dbraw/zinc/65/89/39/1345658939.db2.gz	UBYRFBIJJJLRGJ-KXBFYZLASA-N	0	3	345.874	3.233	20	30		EGEDHN
C=CCN1CC[C@@]2(CCN(C(=O)c3snc(Cl)c3Cl)C2)C1	ZINC001041323811	1345702639	/nfs/dbraw/zinc/70/26/39/1345702639.db2.gz	POFGKJNQQCAANU-CQSZACIVSA-N	0	3	346.283	3.174	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3nc(C(C)(C)C)cs3)C2)C1	ZINC001041377100	1345712745	/nfs/dbraw/zinc/71/27/45/1345712745.db2.gz	BVGQKZSXTVHWGC-LJQANCHMSA-N	0	3	345.512	3.002	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3oc(C(F)F)cc3C)C2)C1	ZINC001041379163	1345712841	/nfs/dbraw/zinc/71/28/41/1345712841.db2.gz	OFVBIFMXIGQRMN-SFHVURJKSA-N	0	3	336.382	3.087	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)Cc3cccc(C(C)C)c3)C2)C1	ZINC001041441446	1345727926	/nfs/dbraw/zinc/72/79/26/1345727926.db2.gz	YSGSBUWIJYSWFA-QFIPXVFZSA-N	0	3	338.495	3.300	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001041545692	1345760243	/nfs/dbraw/zinc/76/02/43/1345760243.db2.gz	XPLHPXDZFCPWLQ-NRFANRHFSA-N	0	3	337.467	3.195	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@]3(CCN(C(=O)[C@H]4C[C@H]5C[C@H]5C4)C3)C2)c1	ZINC001041588362	1345784446	/nfs/dbraw/zinc/78/44/46/1345784446.db2.gz	WSQQHCQKIXEWRB-FCIYXJNOSA-N	0	3	349.478	3.029	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)C[C@@H](C)c3cccc(F)c3)C2)C1	ZINC001041660303	1345814396	/nfs/dbraw/zinc/81/43/96/1345814396.db2.gz	NMJCTIKPWUNGSA-DYESRHJHSA-N	0	3	342.458	3.267	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@]3(CCN(C(=O)[C@H]4CC45CCC5)C3)C2)cc1	ZINC001041713128	1345828396	/nfs/dbraw/zinc/82/83/96/1345828396.db2.gz	CWYXPYLDNPGTHL-TZIWHRDSSA-N	0	3	349.478	3.173	20	30		EGEDHN
C=CCN1CC[C@]2(CCN(C(=O)c3cc(C(CC)CC)no3)C2)C1	ZINC001041729920	1345834871	/nfs/dbraw/zinc/83/48/71/1345834871.db2.gz	XOKSPJMEQOIMHS-IBGZPJMESA-N	0	3	331.460	3.302	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)C(C)(C)c3ccccc3F)C2)C1	ZINC001041741915	1345838038	/nfs/dbraw/zinc/83/80/38/1345838038.db2.gz	WHMNBWRRTKXQIO-OAQYLSRUSA-N	0	3	342.458	3.051	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cc4c(s3)CCCC4)C2)C1	ZINC001041815504	1345861268	/nfs/dbraw/zinc/86/12/68/1345861268.db2.gz	DFWMOFBAVVPVGR-HXUWFJFHSA-N	0	3	342.508	3.188	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3cc4c(cccc4F)s3)C2)C1	ZINC001041823900	1345864610	/nfs/dbraw/zinc/86/46/10/1345864610.db2.gz	QTAHQNGTZHAPLI-LJQANCHMSA-N	0	3	342.439	3.212	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)C3(C(F)(F)F)CCCCC3)C2)C1	ZINC001041855764	1345875010	/nfs/dbraw/zinc/87/50/10/1345875010.db2.gz	NXOVJTAXBWMYFR-MRXNPFEDSA-N	0	3	342.405	3.057	20	30		EGEDHN
CC(C)(C)CC(=O)N1CC[C@H]2CCN(Cc3cccc(C#N)c3)[C@H]2C1	ZINC001041929953	1345900847	/nfs/dbraw/zinc/90/08/47/1345900847.db2.gz	VKZKYMCXNJATGH-MOPGFXCFSA-N	0	3	339.483	3.417	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cccc(Cl)c3C)C[C@H]21	ZINC001042067183	1345934813	/nfs/dbraw/zinc/93/48/13/1345934813.db2.gz	OHOCIPOAFKEDLC-MAUKXSAKSA-N	0	3	330.859	3.208	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3scc(C)c3Cl)C[C@H]21	ZINC001042077776	1345939103	/nfs/dbraw/zinc/93/91/03/1345939103.db2.gz	PDXIUSPPXYTVTO-UONOGXRCSA-N	0	3	336.888	3.270	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3nsc4ccccc43)C[C@@H]21	ZINC001042078751	1345939239	/nfs/dbraw/zinc/93/92/39/1345939239.db2.gz	YDGBFLUOVUOTQU-ZFWWWQNUSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(-c4ccncc4)o3)C[C@@H]21	ZINC001042094405	1345942074	/nfs/dbraw/zinc/94/20/74/1345942074.db2.gz	RNGUUSRJSGISTG-WBVHZDCISA-N	0	3	337.423	3.064	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(C)nn3C(CC)CC)C[C@@H]21	ZINC001042120821	1345949469	/nfs/dbraw/zinc/94/94/69/1345949469.db2.gz	BEXSKHOVTCFWEJ-APWZRJJASA-N	0	3	344.503	3.275	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(C)nn3C(CC)CC)C[C@@H]21	ZINC001042120822	1345949608	/nfs/dbraw/zinc/94/96/08/1345949608.db2.gz	BEXSKHOVTCFWEJ-LPHOPBHVSA-N	0	3	344.503	3.275	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3cc(COC)cs3)C[C@H]21	ZINC001042134966	1345952636	/nfs/dbraw/zinc/95/26/36/1345952636.db2.gz	RMAVPOBAZCYUNM-HZPDHXFCSA-N	0	3	334.485	3.007	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(-n4cccc4)cc3)C[C@@H]21	ZINC001042142006	1345955188	/nfs/dbraw/zinc/95/51/88/1345955188.db2.gz	JPEULEBSFHDFIE-PXNSSMCTSA-N	0	3	335.451	3.200	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc4c(c3)C(C)(C)CO4)C[C@H]21	ZINC001042147742	1345957081	/nfs/dbraw/zinc/95/70/81/1345957081.db2.gz	HJXCHUNWJMADOZ-MAUKXSAKSA-N	0	3	340.467	3.079	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(-c4ccco4)o3)C[C@H]21	ZINC001042150448	1345957145	/nfs/dbraw/zinc/95/71/45/1345957145.db2.gz	VIBZZXKQRQUURR-HUUCEWRRSA-N	0	3	326.396	3.262	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3ncccc3C)[C@@H]2C1	ZINC001042185162	1345972850	/nfs/dbraw/zinc/97/28/50/1345972850.db2.gz	QTZULRUGSIKBKT-PKOBYXMFSA-N	0	3	341.499	3.415	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@@H]2C1	ZINC001042188632	1345975747	/nfs/dbraw/zinc/97/57/47/1345975747.db2.gz	VNAXGLJMIPASMJ-RBUKOAKNSA-N	0	3	337.467	3.193	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cnc4ccsc4c3)C[C@H]21	ZINC001042189047	1345975896	/nfs/dbraw/zinc/97/58/96/1345975896.db2.gz	ZSCFSSQTRNKREM-CZUORRHYSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C3(c4cccnc4)CCCC3)C[C@H]21	ZINC001042205240	1345983397	/nfs/dbraw/zinc/98/33/97/1345983397.db2.gz	WNMVBADDTSHUFJ-IEBWSBKVSA-N	0	3	339.483	3.002	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3scnc3C(C)(C)C)C[C@@H]21	ZINC001042262223	1346010571	/nfs/dbraw/zinc/01/05/71/1346010571.db2.gz	HZSMURCLDJZHEE-CABCVRRESA-N	0	3	345.512	3.000	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(F)c4ncccc4c3)C[C@@H]21	ZINC001042271525	1346014626	/nfs/dbraw/zinc/01/46/26/1346014626.db2.gz	ZLUXQVJUPNIUBU-KDOFPFPSSA-N	0	3	339.414	3.096	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3coc(C4CCCC4)n3)C[C@@H]21	ZINC001042294622	1346020222	/nfs/dbraw/zinc/02/02/22/1346020222.db2.gz	ODJSZYZRNDSARS-QAPCUYQASA-N	0	3	343.471	3.445	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3coc(C4CCCC4)n3)C[C@@H]21	ZINC001042293645	1346020547	/nfs/dbraw/zinc/02/05/47/1346020547.db2.gz	HSVPMUJENYWYAD-PBHICJAKSA-N	0	3	329.444	3.055	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3c[nH]nc3C3CCCCC3)C[C@H]21	ZINC001042310495	1346027971	/nfs/dbraw/zinc/02/79/71/1346027971.db2.gz	SZYKDZGKRQVGAM-MAUKXSAKSA-N	0	3	342.487	3.180	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3ccc(C4CC4)s3)C[C@H]21	ZINC001042314048	1346029681	/nfs/dbraw/zinc/02/96/81/1346029681.db2.gz	XDFNJHGVFMYYRQ-GDBMZVCRSA-N	0	3	328.481	3.185	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(N(CC)CC)cc3)C[C@H]21	ZINC001042327488	1346036664	/nfs/dbraw/zinc/03/66/64/1346036664.db2.gz	XSFMOMZVYVXNPX-FXAWDEMLSA-N	0	3	341.499	3.255	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)C34CC5CC(CC(C5)C3)C4)C[C@H]21	ZINC001042327946	1346037232	/nfs/dbraw/zinc/03/72/32/1346037232.db2.gz	QJJYWFKOHNAWNT-GKHXVQBSSA-N	0	3	340.511	3.149	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C3(C4CCCCC4)CC3)C[C@H]21	ZINC001042336111	1346042021	/nfs/dbraw/zinc/04/20/21/1346042021.db2.gz	RZPITZDQCRGWTR-IEBWSBKVSA-N	0	3	328.500	3.293	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(F)c(F)cc3Cl)C[C@@H]21	ZINC001042338938	1346043610	/nfs/dbraw/zinc/04/36/10/1346043610.db2.gz	OEJGEGWEWSTEHA-BZNIZROVSA-N	0	3	340.801	3.341	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc(OC(C)C)cc3)C[C@@H]21	ZINC001042344685	1346047907	/nfs/dbraw/zinc/04/79/07/1346047907.db2.gz	ZMYKNHUZPHPMCX-PXNSSMCTSA-N	0	3	340.467	3.034	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc(CC(C)C)cc3)C[C@H]21	ZINC001042347651	1346049266	/nfs/dbraw/zinc/04/92/66/1346049266.db2.gz	ATXTVWQTHQVKBO-PZJWPPBQSA-N	0	3	338.495	3.445	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(N(C)C(C)C)cc3)C[C@@H]21	ZINC001042379269	1346064990	/nfs/dbraw/zinc/06/49/90/1346064990.db2.gz	IWKCMXWVVQYGRV-XLIONFOSSA-N	0	3	341.499	3.254	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N(C)C2CN(CC(CC)CC)C2)cc1	ZINC001044344304	1346303487	/nfs/dbraw/zinc/30/34/87/1346303487.db2.gz	KQOGDUXFSUUVDQ-UHFFFAOYSA-N	0	3	344.499	3.373	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)c1ccccc1	ZINC001044424955	1346326052	/nfs/dbraw/zinc/32/60/52/1346326052.db2.gz	HPYRCORPQVAIBP-UZLBHIALSA-N	0	3	333.435	3.341	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@H](NCc2ccccc2C#N)C[C@@H]1C	ZINC001044541407	1346364519	/nfs/dbraw/zinc/36/45/19/1346364519.db2.gz	CLCAGPFFAAUXHQ-YOEHRIQHSA-N	0	3	329.419	3.291	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3nccs3)C[C@H]2C)CC1	ZINC001044730063	1346414416	/nfs/dbraw/zinc/41/44/16/1346414416.db2.gz	MZZWOYHJAKKEPS-ZBFHGGJFSA-N	0	3	333.501	3.359	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3cc(C)no3)C[C@H]2C)CC1	ZINC001044730901	1346414902	/nfs/dbraw/zinc/41/49/02/1346414902.db2.gz	SBMHAJZZTHCSHB-NVXWUHKLSA-N	0	3	331.460	3.199	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@H](NCc3ccccc3C#N)C[C@@H]2C)ccn1	ZINC001044786129	1346428334	/nfs/dbraw/zinc/42/83/34/1346428334.db2.gz	ZLESAZOUBSCYDR-JXFKEZNVSA-N	0	3	348.450	3.045	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)c2ccccc2)cc1F	ZINC001044903211	1346458519	/nfs/dbraw/zinc/45/85/19/1346458519.db2.gz	DIPGJHKFYAKCAX-SFHVURJKSA-N	0	3	337.398	3.092	20	30		EGEDHN
Cc1cc(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)s2)c(C)o1	ZINC001044921412	1346463224	/nfs/dbraw/zinc/46/32/24/1346463224.db2.gz	SYJHPJOHPDPECL-AWEZNQCLSA-N	0	3	343.452	3.224	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H]1CNCc1cccc(Cl)n1	ZINC001045182198	1346517650	/nfs/dbraw/zinc/51/76/50/1346517650.db2.gz	NZVONWFBJHCNEJ-YJBOKZPZSA-N	0	3	335.879	3.418	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H]1CNCc1cnn(C(C)(C)C)c1	ZINC001045185907	1346522393	/nfs/dbraw/zinc/52/23/93/1346522393.db2.gz	OVRWJOZGOKWJPH-FXAWDEMLSA-N	0	3	346.519	3.321	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]2CNCc2cc(F)ccc2OC)C1	ZINC001045190928	1346524940	/nfs/dbraw/zinc/52/49/40/1346524940.db2.gz	NECJSNNHVPPJEY-KRWDZBQOSA-N	0	3	346.446	3.271	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]2CNCc2ccc(Cl)nc2)C1	ZINC001045190689	1346525077	/nfs/dbraw/zinc/52/50/77/1346525077.db2.gz	JRIPLNSCSNPSRK-HNNXBMFYSA-N	0	3	333.863	3.172	20	30		EGEDHN
C=C[C@H](C(=O)N1CCC[C@H]1CNCc1ccns1)c1ccccc1	ZINC001045319282	1346558490	/nfs/dbraw/zinc/55/84/90/1346558490.db2.gz	AOJWHCXHBFDKIK-WMZOPIPTSA-N	0	3	341.480	3.194	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2nsc3ccc(C)cc32)CC1	ZINC001045521014	1346616194	/nfs/dbraw/zinc/61/61/94/1346616194.db2.gz	IGNHSPWSSMQPGP-UHFFFAOYSA-N	0	3	329.469	3.375	20	30		EGEDHN
CC1(C)CC[C@H]1C(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1	ZINC001045527477	1346617070	/nfs/dbraw/zinc/61/70/70/1346617070.db2.gz	RJTWONICLQVPDS-SFHVURJKSA-N	0	3	339.483	3.465	20	30		EGEDHN
Cc1coc(C(=O)NC2(C)CCN(Cc3ccc(C#N)cc3)CC2)c1	ZINC001045529268	1346618633	/nfs/dbraw/zinc/61/86/33/1346618633.db2.gz	JHYOIISYUNZVGS-UHFFFAOYSA-N	0	3	337.423	3.244	20	30		EGEDHN
CC1(NC(=O)[C@H]2CC[C@@H](F)C2)CCN(Cc2cccc(C#N)c2)CC1	ZINC001045536575	1346620963	/nfs/dbraw/zinc/62/09/63/1346620963.db2.gz	AOMVZIUCUIKLQY-ZWKOTPCHSA-N	0	3	343.446	3.167	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045544325	1346624714	/nfs/dbraw/zinc/62/47/14/1346624714.db2.gz	CYVXLWQKMXUSBZ-RTBURBONSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC1(NC(=O)[C@H]2CC23CCC3)CCN(Cc2cccc(C#N)c2)CC1	ZINC001045572366	1346632551	/nfs/dbraw/zinc/63/25/51/1346632551.db2.gz	WLBIQDVJKJLMAI-GOSISDBHSA-N	0	3	337.467	3.219	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2)CC1	ZINC001045587094	1346638075	/nfs/dbraw/zinc/63/80/75/1346638075.db2.gz	ZOXRCGYMFHSDQA-ZWKOTPCHSA-N	0	3	344.886	3.438	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2ccnc(O[C@H](C)CC)c2)CC1	ZINC001045614624	1346648107	/nfs/dbraw/zinc/64/81/07/1346648107.db2.gz	PEQWEFXILJDMPI-OAHLLOKOSA-N	0	3	331.460	3.029	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2ccc(O[C@@H](C)CC)cc2)CC1	ZINC001045616509	1346648849	/nfs/dbraw/zinc/64/88/49/1346648849.db2.gz	BEAOASZZLZIIGX-KRWDZBQOSA-N	0	3	342.483	3.472	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC001045627702	1346651648	/nfs/dbraw/zinc/65/16/48/1346651648.db2.gz	ACLDJQJYQVYGPH-UHFFFAOYSA-N	0	3	326.362	3.476	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2ccc(OCC3CC3)cc2)CC1	ZINC001045643631	1346656862	/nfs/dbraw/zinc/65/68/62/1346656862.db2.gz	OLMCXUWIMYEDBH-UHFFFAOYSA-N	0	3	328.456	3.246	20	30		EGEDHN
CCC1(C(=O)N2CC[C@H]3CC[C@@H](C2)N3Cc2cccc(C#N)c2)CC1	ZINC001045842516	1346717620	/nfs/dbraw/zinc/71/76/20/1346717620.db2.gz	MKOSMKVDDMFNOC-MOPGFXCFSA-N	0	3	337.467	3.314	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCCC[C@@]2(CCN(CC#CC)C2)C1	ZINC001045944018	1346779779	/nfs/dbraw/zinc/77/97/79/1346779779.db2.gz	VBVHEPDLMIXDDK-NRFANRHFSA-N	0	3	339.483	3.016	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H]1CCC(F)(F)C1)C2	ZINC001045944252	1346780301	/nfs/dbraw/zinc/78/03/01/1346780301.db2.gz	IVBYIJZTVBKSAR-AEFFLSMTSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ncc(C)cc1C)C2	ZINC001045953685	1346788793	/nfs/dbraw/zinc/78/87/93/1346788793.db2.gz	GNOAQEPMYTXFTL-OAQYLSRUSA-N	0	3	339.483	3.040	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccoc1C1CC1)C2	ZINC001045960248	1346795337	/nfs/dbraw/zinc/79/53/37/1346795337.db2.gz	IAJYAHYHDJYXNH-HXUWFJFHSA-N	0	3	326.440	3.108	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1occc1CC)C2	ZINC001045964070	1346799014	/nfs/dbraw/zinc/79/90/14/1346799014.db2.gz	XSAMEQFVBXMWDB-FQEVSTJZSA-N	0	3	328.456	3.184	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H](C)c1cccc(C)c1)C2	ZINC001045969496	1346804948	/nfs/dbraw/zinc/80/49/48/1346804948.db2.gz	RNLPJVORXJVRJS-SIKLNZKXSA-N	0	3	338.495	3.436	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@H](C)c1ccccc1F)C2	ZINC001045974942	1346811472	/nfs/dbraw/zinc/81/14/72/1346811472.db2.gz	QPWNATXDOARULL-UTKZUKDTSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1oc(CC)cc1C)C2	ZINC001045980026	1346817134	/nfs/dbraw/zinc/81/71/34/1346817134.db2.gz	PGIMEGQLHYQYKX-FQEVSTJZSA-N	0	3	328.456	3.102	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H](C)c1ccc(C)cc1)C2	ZINC001045981172	1346819690	/nfs/dbraw/zinc/81/96/90/1346819690.db2.gz	QJUSRCUCTHPBGT-UGKGYDQZSA-N	0	3	338.495	3.436	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)Cc1ccc(Cl)cc1)C2	ZINC001045984262	1346824789	/nfs/dbraw/zinc/82/47/89/1346824789.db2.gz	ZCBGGXPEYLAJOU-FQEVSTJZSA-N	0	3	344.886	3.220	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc(F)s1)C2	ZINC001045987691	1346829066	/nfs/dbraw/zinc/82/90/66/1346829066.db2.gz	YZJOEBQBJGEWFQ-GOSISDBHSA-N	0	3	334.460	3.229	20	30		EGEDHN
C#CCCN1CC[C@](C)(NC(=O)c2cc(Cl)cc(Cl)c2)C1	ZINC001046799986	1347109993	/nfs/dbraw/zinc/10/99/93/1347109993.db2.gz	XGLOZJOOLJOYRZ-INIZCTEOSA-N	0	3	325.239	3.211	20	30		EGEDHN
C#CCCN1CC[C@](C)(NC(=O)c2cc(Cl)ccc2Cl)C1	ZINC001046799663	1347110062	/nfs/dbraw/zinc/11/00/62/1347110062.db2.gz	UPHWEDRYMQVVEM-INIZCTEOSA-N	0	3	325.239	3.211	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2ccc(COC(C)C)cc2)C1	ZINC001046826601	1347120990	/nfs/dbraw/zinc/12/09/90/1347120990.db2.gz	DWEIBDKEEBEHFF-FQEVSTJZSA-N	0	3	330.472	3.382	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@H](CNC(=O)C2CCCCCC2)C1	ZINC001046921920	1347154068	/nfs/dbraw/zinc/15/40/68/1347154068.db2.gz	QOHVDDIWMIPVCN-MRXNPFEDSA-N	0	3	326.431	3.054	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2cccc(C)c2F)C1	ZINC001046945309	1347160132	/nfs/dbraw/zinc/16/01/32/1347160132.db2.gz	RXBHJMFKYPOHRS-AWEZNQCLSA-N	0	3	340.389	3.397	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2cc(F)ccc2F)C1	ZINC001046947298	1347160235	/nfs/dbraw/zinc/16/02/35/1347160235.db2.gz	MVTAQEREVSONET-LBPRGKRZSA-N	0	3	344.352	3.228	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@H](CNC(=O)C2CCCCCCC2)C1	ZINC001046957987	1347164880	/nfs/dbraw/zinc/16/48/80/1347164880.db2.gz	VCDPYGOOYDKHOR-QGZVFWFLSA-N	0	3	340.458	3.444	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)c3ccsc3)C2)CC1	ZINC001047222936	1347253809	/nfs/dbraw/zinc/25/38/09/1347253809.db2.gz	FTBNXWPSAMZMJN-KRWDZBQOSA-N	0	3	330.497	3.336	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)/C=C(\C)C3CC3)C2)CC1	ZINC001047229589	1347259250	/nfs/dbraw/zinc/25/92/50/1347259250.db2.gz	QBUKMJQVVLZRPN-XBVMLYLOSA-N	0	3	328.500	3.317	20	30		EGEDHN
CC[C@H](F)CN1CCC([C@@H]2CCCN(C(=O)C#CC3CC3)C2)CC1	ZINC001047235688	1347263612	/nfs/dbraw/zinc/26/36/12/1347263612.db2.gz	AQFHMJGDOSSMHB-MOPGFXCFSA-N	0	3	334.479	3.099	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)[C@@H](C)n3cccc3)C2)CC1	ZINC001047236453	1347264416	/nfs/dbraw/zinc/26/44/16/1347264416.db2.gz	JZXQNWFGXMAYKJ-QUCCMNQESA-N	0	3	341.499	3.023	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@H]3CCC(C)(C)C3)C2)CC1	ZINC001047255165	1347279193	/nfs/dbraw/zinc/27/91/93/1347279193.db2.gz	WIULENAZDMMXCC-OALUTQOASA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@H](C)Cc3ccco3)C2)CC1	ZINC001047257733	1347280867	/nfs/dbraw/zinc/28/08/67/1347280867.db2.gz	PNOLTEAVMYHKQU-MJGOQNOKSA-N	0	3	342.483	3.042	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@@H](C)c3ccccc3)C2)CC1	ZINC001047263260	1347284607	/nfs/dbraw/zinc/28/46/07/1347284607.db2.gz	DMRURIHNTPHCEV-GHTZIAJQSA-N	0	3	338.495	3.374	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)c2ccsc2)C1	ZINC001047709485	1347343891	/nfs/dbraw/zinc/34/38/91/1347343891.db2.gz	MPXZSFDXIOEGFP-YOEHRIQHSA-N	0	3	339.464	3.260	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)C2(C)CCCC2)C1	ZINC001047925321	1347411561	/nfs/dbraw/zinc/41/15/61/1347411561.db2.gz	LTBBVZZIUHZKEJ-VQIMIIECSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)C2(C)CC=CC2)C1	ZINC001047962262	1347425685	/nfs/dbraw/zinc/42/56/85/1347425685.db2.gz	JZEWWSYNZQFMFZ-VQIMIIECSA-N	0	3	337.467	3.241	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]([C@H](C)NCc3csc(CC)n3)C2)C1	ZINC001047965108	1347426768	/nfs/dbraw/zinc/42/67/68/1347426768.db2.gz	JEEMUEGEXMEMDP-LSDHHAIUSA-N	0	3	347.528	3.388	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]([C@H](C)NCc3ccccc3C#N)C2)C1	ZINC001047966208	1347427149	/nfs/dbraw/zinc/42/71/49/1347427149.db2.gz	QQRMCFVXNULWAH-LPHOPBHVSA-N	0	3	337.467	3.241	20	30		EGEDHN
CCC1(C(=O)N2CC[C@@H]([C@H](C)NCc3ccccc3C#N)C2)CC1	ZINC001047971021	1347429405	/nfs/dbraw/zinc/42/94/05/1347429405.db2.gz	MLRQAPBKVPBOMO-MAUKXSAKSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@H]1CN(C(=O)C2(C)CC=CC2)C[C@H]1CNCc1ccccc1C#N	ZINC001048374233	1347534822	/nfs/dbraw/zinc/53/48/22/1347534822.db2.gz	OXTILXZYFVNPTD-QFBILLFUSA-N	0	3	337.467	3.099	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H](C)[C@@H](CNCc3cc(C4CC4)no3)C2)C1	ZINC001048375050	1347535224	/nfs/dbraw/zinc/53/52/24/1347535224.db2.gz	TYIHATHKFLHJHM-HOCLYGCPSA-N	0	3	343.471	3.092	20	30		EGEDHN
O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)N2CC#Cc1ccccc1)c1ccc[nH]1	ZINC001048503225	1347570338	/nfs/dbraw/zinc/57/03/38/1347570338.db2.gz	DKEXAGOGMKWCFE-ACDBMABISA-N	0	3	347.462	3.039	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)[C@@H]2CCC2(C)C)CC1	ZINC001048626210	1347624291	/nfs/dbraw/zinc/62/42/91/1347624291.db2.gz	FHIVYOHTJIMWDN-IBGZPJMESA-N	0	3	341.499	3.497	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CN(C(=O)C4CCCCC4)C[C@@H]3C2)c1	ZINC001048654296	1347632767	/nfs/dbraw/zinc/63/27/67/1347632767.db2.gz	WNSKCSDBJAIWOC-BGYRXZFFSA-N	0	3	337.467	3.029	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CN(Cc3c(C)onc3CC)C[C@H]2C1	ZINC001049026729	1347709831	/nfs/dbraw/zinc/70/98/31/1347709831.db2.gz	YNUFGGOPHXQMND-GQIGUUNPSA-N	0	3	345.487	3.038	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CN(C(=O)[C@]45C[C@H]4CCCC5)C[C@@H]3C2)c1	ZINC001049046165	1347715220	/nfs/dbraw/zinc/71/52/20/1347715220.db2.gz	JUOSDNWTLXEJJG-XAPVIXHLSA-N	0	3	349.478	3.029	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)[C@H]2CC=CCC2)c1	ZINC001049324536	1347791151	/nfs/dbraw/zinc/79/11/51/1347791151.db2.gz	ATQPWKRRQZAHTF-PWRODBHTSA-N	0	3	349.478	3.480	20	30		EGEDHN
Cc1cc(F)ccc1CN1CC[C@@H]2[C@@H]1CCCN2C(=O)C#CC1CC1	ZINC001049468476	1347864020	/nfs/dbraw/zinc/86/40/20/1347864020.db2.gz	VMLCEKYSOYBBSY-VQTJNVASSA-N	0	3	340.442	3.113	20	30		EGEDHN
Cc1cc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)C#CC2CC2)cs1	ZINC001049468768	1347864069	/nfs/dbraw/zinc/86/40/69/1347864069.db2.gz	XXWBSSHNZPJSJD-ZWKOTPCHSA-N	0	3	328.481	3.035	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@@H]2[C@H]1CCN2C/C=C/c1ccccc1	ZINC001049469979	1347864786	/nfs/dbraw/zinc/86/47/86/1347864786.db2.gz	FPHJPARYGPQPHQ-FTWXOEDXSA-N	0	3	334.463	3.179	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1conc1C1CCCC1	ZINC001049517658	1347888498	/nfs/dbraw/zinc/88/84/98/1347888498.db2.gz	LPIZRCWUAFFXBB-ZWKOTPCHSA-N	0	3	341.455	3.034	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC001049551437	1347904443	/nfs/dbraw/zinc/90/44/43/1347904443.db2.gz	FZZAPEZSLKQWMU-KLHDSHLOSA-N	0	3	342.405	3.382	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)CC1CC(c2ccccc2)C1	ZINC001049558187	1347908987	/nfs/dbraw/zinc/90/89/87/1347908987.db2.gz	NPAKCWXALVTAGF-BOWFFMLLSA-N	0	3	336.479	3.269	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1c(C)cccc1Cl	ZINC001049568698	1347914880	/nfs/dbraw/zinc/91/48/80/1347914880.db2.gz	WFLDRGFLJVMIQE-OALUTQOASA-N	0	3	344.886	3.280	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(-c2ccccc2)no1	ZINC001049576684	1347917602	/nfs/dbraw/zinc/91/76/02/1347917602.db2.gz	VRNLPZJDCLXLEF-RTBURBONSA-N	0	3	349.434	3.044	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1cccc(C)c1Cl	ZINC001049595102	1347928065	/nfs/dbraw/zinc/92/80/65/1347928065.db2.gz	TUSJVGVETSUJKZ-ZWKOTPCHSA-N	0	3	344.886	3.280	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1c(C)occ1C(F)(F)F	ZINC001049597597	1347929308	/nfs/dbraw/zinc/92/93/08/1347929308.db2.gz	FENOJGOAFKJKNU-ZIAGYGMSSA-N	0	3	342.361	3.472	20	30		EGEDHN
CC1(CC(=O)N2CCC[C@H]3[C@@H]2CCN3Cc2ccc(C#N)cc2)CC1	ZINC001049602135	1347931705	/nfs/dbraw/zinc/93/17/05/1347931705.db2.gz	LCYSFTMHGWUWPR-OALUTQOASA-N	0	3	337.467	3.314	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1cccc(C2CC2)c1	ZINC001049612096	1347935667	/nfs/dbraw/zinc/93/56/67/1347935667.db2.gz	LZHZELRITAZTKB-LEWJYISDSA-N	0	3	336.479	3.195	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)[C@H]2C[C@H]3C[C@H]3C2)cc1	ZINC001049657193	1347959142	/nfs/dbraw/zinc/95/91/42/1347959142.db2.gz	BTOGNIAJRRFHOF-XIYVOTBMSA-N	0	3	349.478	3.170	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H]1CCCN2C(=O)CC(C1CCC1)C1CCC1	ZINC001049717942	1347989410	/nfs/dbraw/zinc/98/94/10/1347989410.db2.gz	HRDAMHGIRZQLQB-UXHICEINSA-N	0	3	328.500	3.291	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ncsc1C1CC1	ZINC001049724772	1347991220	/nfs/dbraw/zinc/99/12/20/1347991220.db2.gz	TZAIZSDFMNZHAG-HUUCEWRRSA-N	0	3	331.485	3.276	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(C(C)C)nc1C	ZINC001049729885	1347992153	/nfs/dbraw/zinc/99/21/53/1347992153.db2.gz	YBNFXCQETJHLHY-RBUKOAKNSA-N	0	3	327.472	3.378	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1ccc(C(C)(C)C)cc1	ZINC001049748789	1347998931	/nfs/dbraw/zinc/99/89/31/1347998931.db2.gz	PFPKVEHLLNATGZ-PMACEKPBSA-N	0	3	338.495	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cn(CC)nc1C(C)C	ZINC001049757984	1348004229	/nfs/dbraw/zinc/00/42/29/1348004229.db2.gz	FHUIPRGROHZQSU-ROUUACIJSA-N	0	3	344.503	3.281	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(C)c(OCC)c1	ZINC001049763571	1348008894	/nfs/dbraw/zinc/00/88/94/1348008894.db2.gz	WUVZLUNUOJUIOU-ZWKOTPCHSA-N	0	3	328.456	3.259	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cnc(C)nc1C(C)C	ZINC001049768690	1348011371	/nfs/dbraw/zinc/01/13/71/1348011371.db2.gz	YQDKEIGRYAKGIW-QZTJIDSGSA-N	0	3	342.487	3.163	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](CC)Oc1cccc(C)c1	ZINC001049779152	1348017638	/nfs/dbraw/zinc/01/76/38/1348017638.db2.gz	SFHJBFSHRPWCAC-XUVXKRRUSA-N	0	3	342.483	3.404	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccc(C)s1	ZINC001049779025	1348017714	/nfs/dbraw/zinc/01/77/14/1348017714.db2.gz	BBTADIRSVFKNIA-QBPKDAKJSA-N	0	3	330.497	3.411	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)C1(Cc2ccccc2F)CC1	ZINC001049784348	1348020652	/nfs/dbraw/zinc/02/06/52/1348020652.db2.gz	VWDSQTQZILEKSA-MOPGFXCFSA-N	0	3	342.458	3.400	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C[C@@H](C)c1ccccc1F	ZINC001049788266	1348022091	/nfs/dbraw/zinc/02/20/91/1348022091.db2.gz	MVLWSOPQUFWQEA-ATZDWAIDSA-N	0	3	328.431	3.018	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](C)c1ccccc1F	ZINC001049799118	1348025654	/nfs/dbraw/zinc/02/56/54/1348025654.db2.gz	SZKPDHWCUZYPHK-AYOQOUSVSA-N	0	3	328.431	3.018	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ncc(Cl)cc1Cl	ZINC001049807110	1348029707	/nfs/dbraw/zinc/02/97/07/1348029707.db2.gz	RDLZAVAZNNASFX-ZIAGYGMSSA-N	0	3	340.254	3.253	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1csc(C(F)(F)F)n1	ZINC001049830435	1348044483	/nfs/dbraw/zinc/04/44/83/1348044483.db2.gz	FRXCIPXEWUDJGN-RYUDHWBXSA-N	0	3	345.390	3.027	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cnn(CCC(C)C)c1C	ZINC001049837304	1348049611	/nfs/dbraw/zinc/04/96/11/1348049611.db2.gz	ARWABYPTWRFGJY-OALUTQOASA-N	0	3	344.503	3.103	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](C)Oc1ccc(C)cc1	ZINC001049880182	1348084968	/nfs/dbraw/zinc/08/49/68/1348084968.db2.gz	BHSFEMCLZAFOSX-BHIYHBOVSA-N	0	3	328.456	3.014	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1ccc2ccccc2c1	ZINC001049884178	1348089283	/nfs/dbraw/zinc/08/92/83/1348089283.db2.gz	AGBLMSHKJJKJOK-NHCUHLMSSA-N	0	3	332.447	3.081	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)CC(C)(C)c1ccc(C)cc1	ZINC001049885951	1348090322	/nfs/dbraw/zinc/09/03/22/1348090322.db2.gz	QSMUBSVQVSVXKP-VQTJNVASSA-N	0	3	338.495	3.361	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1c[nH]c2c1cccc2CC	ZINC001049921710	1348113801	/nfs/dbraw/zinc/11/38/01/1348113801.db2.gz	XRIYIJQQHOCJHG-VQTJNVASSA-N	0	3	349.478	3.433	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C1CC(c2ccccc2)C1	ZINC001049928044	1348118451	/nfs/dbraw/zinc/11/84/51/1348118451.db2.gz	ZYAHTIJQFFXDHG-NSKBAKJYSA-N	0	3	336.479	3.269	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)CCc1ccc(C)s1	ZINC001049928531	1348118899	/nfs/dbraw/zinc/11/88/99/1348118899.db2.gz	UJVVOXWLKJXKPW-ROUUACIJSA-N	0	3	330.497	3.078	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)C[C@H]3CCOc4ccccc43)[C@@H]2C1	ZINC001050110104	1348185793	/nfs/dbraw/zinc/18/57/93/1348185793.db2.gz	FWAGTISKBFZPIZ-ZIFCJYIRSA-N	0	3	340.467	3.052	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)C[C@@H](C)c3cccc(F)c3)[C@@H]2C1	ZINC001050136836	1348193227	/nfs/dbraw/zinc/19/32/27/1348193227.db2.gz	LTAQXUMYROKRAM-HHXXYDBFSA-N	0	3	330.447	3.428	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)CCc3cc(Cl)cs3)[C@@H]2C1	ZINC001050152003	1348197553	/nfs/dbraw/zinc/19/75/53/1348197553.db2.gz	AZQCGVYZBFEFOP-XJKSGUPXSA-N	0	3	338.904	3.443	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3ccc4scnc4c3)[C@@H]2C1	ZINC001050175235	1348202875	/nfs/dbraw/zinc/20/28/75/1348202875.db2.gz	MKWSDGCDRZDFRE-DOTOQJQBSA-N	0	3	341.480	3.409	20	30		EGEDHN
C#CCCN1C[C@@H]2CCCN(C(=O)c3ccc(C4CC4)s3)[C@@H]2C1	ZINC001050183133	1348204733	/nfs/dbraw/zinc/20/47/33/1348204733.db2.gz	QHONTJSZUOTFAN-JKSUJKDBSA-N	0	3	328.481	3.185	20	30		EGEDHN
C/C(=C\C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)CC2)C1CC1	ZINC001050448294	1348269043	/nfs/dbraw/zinc/26/90/43/1348269043.db2.gz	XILKNASCJBBLQD-GZTJUZNOSA-N	0	3	349.478	3.339	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC2(C1)CCN(C[C@H](F)CC)CC2	ZINC001050531794	1348284737	/nfs/dbraw/zinc/28/47/37/1348284737.db2.gz	LVASHXYMSFMMPT-CQSZACIVSA-N	0	3	330.875	3.438	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@H](CC)C3CCC(C)CC3)C2)CC1	ZINC001050539135	1348285987	/nfs/dbraw/zinc/28/59/87/1348285987.db2.gz	NXOVYEQYLOIVDC-CTWPCTMYSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cc(C(CC)CC)no3)C2)CC1	ZINC001050692256	1348329211	/nfs/dbraw/zinc/32/92/11/1348329211.db2.gz	UMBVRTUOJPQUMD-UHFFFAOYSA-N	0	3	343.471	3.140	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cccc(C)c3Cl)C2)CC1	ZINC001050701468	1348331487	/nfs/dbraw/zinc/33/14/87/1348331487.db2.gz	HYZSIKOCGPSIEZ-UHFFFAOYSA-N	0	3	330.859	3.210	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C3CCC(C(F)F)CC3)C2)CC1	ZINC001050744147	1348345929	/nfs/dbraw/zinc/34/59/29/1348345929.db2.gz	YJTZNDDTRKUACK-UHFFFAOYSA-N	0	3	338.442	3.006	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)CC[C@H]3CCc4ccccc43)C2)CC1	ZINC001050766546	1348352384	/nfs/dbraw/zinc/35/23/84/1348352384.db2.gz	QPZIXQPVCVVSGM-LJQANCHMSA-N	0	3	336.479	3.054	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C34CC(c5ccccc5)(C3)C4)C2)CC1	ZINC001050767895	1348353338	/nfs/dbraw/zinc/35/33/38/1348353338.db2.gz	NTMWDACTLHCFOI-UHFFFAOYSA-N	0	3	348.490	3.056	20	30		EGEDHN
C=CCC[N@H+]1CCc2c(CNC(=O)c3ccccc3[O-])cccc2C1	ZINC001051279040	1348415493	/nfs/dbraw/zinc/41/54/93/1348415493.db2.gz	PUEGRBDONRSRCC-UHFFFAOYSA-N	0	3	336.435	3.256	20	30		EGEDHN
C=CCC[N@@H+]1CCc2c(CNC(=O)c3ccccc3[O-])cccc2C1	ZINC001051279040	1348415494	/nfs/dbraw/zinc/41/54/94/1348415494.db2.gz	PUEGRBDONRSRCC-UHFFFAOYSA-N	0	3	336.435	3.256	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)[C@H]3Cc4ccccc43)cccc2C1	ZINC001051300642	1348425575	/nfs/dbraw/zinc/42/55/75/1348425575.db2.gz	XXDWKXLWVPHFPV-QFIPXVFZSA-N	0	3	344.458	3.024	20	30		EGEDHN
CC1CC(C(=O)N[C@H]2CCCN(Cc3ccc(C#N)cc3)CC2)C1	ZINC001052295148	1348517667	/nfs/dbraw/zinc/51/76/67/1348517667.db2.gz	FASFSYNSHJEQSK-PPSBMQLTSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC001052386494	1348538126	/nfs/dbraw/zinc/53/81/26/1348538126.db2.gz	CYZHFPIPHGYYCJ-CQSZACIVSA-N	0	3	338.373	3.371	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)C2C3CC4CC(C3)CC2C4)CC1	ZINC001052447860	1348544175	/nfs/dbraw/zinc/54/41/75/1348544175.db2.gz	NVFPOJTYUIATLP-RDOIFFKNSA-N	0	3	328.500	3.053	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@@H]2CCCC[C@H]2C(F)(F)F)CC1	ZINC001052455134	1348545889	/nfs/dbraw/zinc/54/58/89/1348545889.db2.gz	PAKYGLYBBOWYRN-ARFHVFGLSA-N	0	3	344.421	3.349	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cc3c([nH]2)c(F)ccc3C)CC1	ZINC001052512645	1348563227	/nfs/dbraw/zinc/56/32/27/1348563227.db2.gz	OESKFXXRIWVMGX-HNNXBMFYSA-N	0	3	341.430	3.223	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2cc3cc(Cl)ccc3o2)CC1	ZINC001052535944	1348569344	/nfs/dbraw/zinc/56/93/44/1348569344.db2.gz	APDBHPNPXJKAQS-OAHLLOKOSA-N	0	3	330.815	3.304	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2cc3c(o2)c(F)ccc3C)CC1	ZINC001052588680	1348587794	/nfs/dbraw/zinc/58/77/94/1348587794.db2.gz	YSCRLXMPRAEDIQ-CQSZACIVSA-N	0	3	328.387	3.098	20	30		EGEDHN
CC1(C(=O)N[C@H]2CCCN(Cc3cccc(C#N)c3)CC2)CCC1	ZINC001052627323	1348600520	/nfs/dbraw/zinc/60/05/20/1348600520.db2.gz	MKOCWUKWNFNSGV-SFHVURJKSA-N	0	3	325.456	3.219	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCN(Cc3cnc(C)s3)CC2)C1	ZINC001052689727	1348633872	/nfs/dbraw/zinc/63/38/72/1348633872.db2.gz	IZWVZKPDDUULTD-OAHLLOKOSA-N	0	3	333.501	3.279	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H](NC(=O)[C@@H]3CC34CCC4)CC2)cc1	ZINC001052753802	1348663330	/nfs/dbraw/zinc/66/33/30/1348663330.db2.gz	IMWSXPGUNITWAY-OALUTQOASA-N	0	3	337.467	3.219	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)Cc2c[nH]c3c2cccc3C)CC1	ZINC001052766096	1348670983	/nfs/dbraw/zinc/67/09/83/1348670983.db2.gz	SDMWGRSLQWXBTJ-GOSISDBHSA-N	0	3	337.467	3.013	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N[C@@H]1CCCN(C/C=C\Cl)CC1	ZINC001052779507	1348676173	/nfs/dbraw/zinc/67/61/73/1348676173.db2.gz	GXUJCSCJIOQSBR-GWNMFIOISA-N	0	3	340.895	3.081	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)C(C)(C)c2ccccc2F)CC1	ZINC001052796670	1348683652	/nfs/dbraw/zinc/68/36/52/1348683652.db2.gz	UFGDEVYFTREMEB-MRXNPFEDSA-N	0	3	330.447	3.097	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc(-c3ccccc3)nc2)CC1	ZINC001052816544	1348687991	/nfs/dbraw/zinc/68/79/91/1348687991.db2.gz	NGMDDXPFGGJGCB-FQEVSTJZSA-N	0	3	347.462	3.356	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2csc3c2CC[C@H](C)C3)CC1	ZINC001052911641	1348743871	/nfs/dbraw/zinc/74/38/71/1348743871.db2.gz	LULROTTYEKSHBY-HOTGVXAUSA-N	0	3	344.524	3.481	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cc3c(s2)CC[C@@H](C)C3)CC1	ZINC001052924157	1348750431	/nfs/dbraw/zinc/75/04/31/1348750431.db2.gz	VPCWXABKGIQQKL-NVXWUHKLSA-N	0	3	344.524	3.481	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](NC(=O)c2cccc(CN(C)C)c2)CC1	ZINC001052954073	1348768587	/nfs/dbraw/zinc/76/85/87/1348768587.db2.gz	KRARHDVLWFNPED-SFHVURJKSA-N	0	3	349.906	3.085	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)C2CC(c3ccc(F)cc3)C2)CC1	ZINC001052970213	1348780980	/nfs/dbraw/zinc/78/09/80/1348780980.db2.gz	GZMZJIRGIOAREF-QLOJAFMTSA-N	0	3	342.458	3.313	20	30		EGEDHN
CC(=O)N1CCCC[C@@H]1[C@H]1CCCN(Cc2ccc(C#N)s2)C1	ZINC001053054959	1348861600	/nfs/dbraw/zinc/86/16/00/1348861600.db2.gz	TYWTZGUOQYHXES-MAUKXSAKSA-N	0	3	331.485	3.233	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)/C=C/c2ccco2)C1	ZINC001053060066	1348868924	/nfs/dbraw/zinc/86/89/24/1348868924.db2.gz	CRRYOAKHLPXIRD-UKMAJIJPSA-N	0	3	326.440	3.019	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(C)o2)C1	ZINC001053068765	1348882966	/nfs/dbraw/zinc/88/29/66/1348882966.db2.gz	WABDJFXMUIQFCJ-QZTJIDSGSA-N	0	3	328.456	3.318	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(C)nc2)C1	ZINC001053070386	1348884486	/nfs/dbraw/zinc/88/44/86/1348884486.db2.gz	YEQDVWFABTZWQG-WOJBJXKFSA-N	0	3	339.483	3.120	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(C)n2C)C1	ZINC001053070276	1348884549	/nfs/dbraw/zinc/88/45/49/1348884549.db2.gz	WJSOWVZRGUTVGM-OALUTQOASA-N	0	3	341.499	3.064	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cnc(C)s2)C1	ZINC001053070925	1348887124	/nfs/dbraw/zinc/88/71/24/1348887124.db2.gz	GQHBFLLLNGYIRM-IAGOWNOFSA-N	0	3	345.512	3.182	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cccc(C)n2)C1	ZINC001053072028	1348888102	/nfs/dbraw/zinc/88/81/02/1348888102.db2.gz	OSTXXTKFALUWKB-UYAOXDASSA-N	0	3	339.483	3.120	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cccc(F)c2C)C1	ZINC001053086519	1348908664	/nfs/dbraw/zinc/90/86/64/1348908664.db2.gz	MUCDUXHUWFMNLD-PXNSSMCTSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2scnc2CC)C1	ZINC001053088620	1348914267	/nfs/dbraw/zinc/91/42/67/1348914267.db2.gz	YFCNSALMHPVXPW-DOTOQJQBSA-N	0	3	345.512	3.045	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cc(Cl)cn2C)C1	ZINC001053092481	1348919513	/nfs/dbraw/zinc/91/95/13/1348919513.db2.gz	RTDVYAHRHHVHRB-NVXWUHKLSA-N	0	3	347.890	3.018	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccc(Cl)cn2)C1	ZINC001053103545	1348937108	/nfs/dbraw/zinc/93/71/08/1348937108.db2.gz	HXUMDNYSPPBVMQ-MAUKXSAKSA-N	0	3	345.874	3.075	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccnc(C)c2)C1	ZINC001053105290	1348942145	/nfs/dbraw/zinc/94/21/45/1348942145.db2.gz	SWGJILZCQZCPKP-WOJBJXKFSA-N	0	3	339.483	3.120	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccc(F)s2)C1	ZINC001053106115	1348944254	/nfs/dbraw/zinc/94/42/54/1348944254.db2.gz	SFRXFVUAFODMPP-LSDHHAIUSA-N	0	3	334.460	3.227	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cccc(OC)c2)C1	ZINC001053107024	1348945182	/nfs/dbraw/zinc/94/51/82/1348945182.db2.gz	YGIWOGGCPYUTEO-ICSRJNTNSA-N	0	3	340.467	3.035	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2c[nH]cc2C)C1	ZINC001053107413	1348945994	/nfs/dbraw/zinc/94/59/94/1348945994.db2.gz	HMFSWUJJXUJFPW-MJGOQNOKSA-N	0	3	327.472	3.053	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2c[nH]cc2C)C1	ZINC001053107411	1348946575	/nfs/dbraw/zinc/94/65/75/1348946575.db2.gz	HMFSWUJJXUJFPW-HKUYNNGSSA-N	0	3	327.472	3.053	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@@H]2CCCC[C@@H]2C(F)(F)F)C1	ZINC001079962341	1357439898	/nfs/dbraw/zinc/43/98/98/1357439898.db2.gz	DYWQLUFRSFFYMV-APIJFGDWSA-N	0	3	332.410	3.368	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H]1CCC=CCCC1)C2	ZINC001054152645	1349156151	/nfs/dbraw/zinc/15/61/51/1349156151.db2.gz	FVOUIPUYDCSROK-TZIWHRDSSA-N	0	3	328.500	3.461	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(Cl)cc1F)C2	ZINC001054162132	1349164587	/nfs/dbraw/zinc/16/45/87/1349164587.db2.gz	XXHOOFDIVGYDGO-IBGZPJMESA-N	0	3	348.849	3.431	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)C(C)(C)c1cccs1)C2	ZINC001054174384	1349175142	/nfs/dbraw/zinc/17/51/42/1349175142.db2.gz	OAUVSCRABYWJRP-FQEVSTJZSA-N	0	3	344.524	3.364	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc3c(ccc(C)c3C)[nH]1)C2	ZINC001054177859	1349180743	/nfs/dbraw/zinc/18/07/43/1349180743.db2.gz	SMXKOAJDFODIDT-JOCHJYFZSA-N	0	3	349.478	3.346	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H](F)c1ccccc1)C2	ZINC001054204865	1349207021	/nfs/dbraw/zinc/20/70/21/1349207021.db2.gz	FTNAGZOUJUDFCQ-ICSRJNTNSA-N	0	3	328.431	3.035	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc(Cl)cs1)C2	ZINC001054207673	1349210024	/nfs/dbraw/zinc/21/00/24/1349210024.db2.gz	FDFRJELZWYNOCF-KRWDZBQOSA-N	0	3	336.888	3.353	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@H]1C[C@@H]1c1ccccc1)C2	ZINC001054209274	1349210835	/nfs/dbraw/zinc/21/08/35/1349210835.db2.gz	MWVOUBNXPSHLIL-RZUBCFFCSA-N	0	3	336.479	3.128	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc(Cl)cn1CC)C2	ZINC001054241212	1349235149	/nfs/dbraw/zinc/23/51/49/1349235149.db2.gz	NBEIZWPDQFUORH-IBGZPJMESA-N	0	3	347.890	3.113	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc(C)c(F)c(C)c1)C2	ZINC001054241938	1349235248	/nfs/dbraw/zinc/23/52/48/1349235248.db2.gz	BEIVUUPMOFZJDE-NRFANRHFSA-N	0	3	342.458	3.394	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cnc(C(C)C)s1)C2	ZINC001054249611	1349245667	/nfs/dbraw/zinc/24/56/67/1349245667.db2.gz	ARISZAMKTMWHIK-LJQANCHMSA-N	0	3	345.512	3.218	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@H]3CC[C@H](CC)O3)cc2C1	ZINC001054267494	1349264643	/nfs/dbraw/zinc/26/46/43/1349264643.db2.gz	XMRBZKUGEAYQJO-RBUKOAKNSA-N	0	3	328.456	3.152	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3onc(C)c3C)cc2C1	ZINC001054269622	1349268986	/nfs/dbraw/zinc/26/89/86/1349268986.db2.gz	HWIMQMUGUPWIQA-UHFFFAOYSA-N	0	3	325.412	3.113	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@H]3Cc4ccccc4O3)cc2C1	ZINC001054272793	1349272502	/nfs/dbraw/zinc/27/25/02/1349272502.db2.gz	FFGCACMUNYUKTM-OAQYLSRUSA-N	0	3	348.446	3.198	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NCc1ccc2c(c1)CN(CC1CC1)C2	ZINC001054285495	1349288006	/nfs/dbraw/zinc/28/80/06/1349288006.db2.gz	KXCJCAAQJNRCHS-PMACEKPBSA-N	0	3	340.467	3.010	20	30		EGEDHN
C[C@H]1CN(C(=O)c2ccccc2F)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054341034	1349321019	/nfs/dbraw/zinc/32/10/19/1349321019.db2.gz	LIMOLXJXGJXHHW-SJCJKPOMSA-N	0	3	343.427	3.009	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccsc2)C[C@H]1NCc1ccc(C#N)c(F)c1	ZINC001054366435	1349336910	/nfs/dbraw/zinc/33/69/10/1349336910.db2.gz	LOYUTUNGOMYWBI-SJKOYZFVSA-N	0	3	343.427	3.009	20	30		EGEDHN
CC(C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1)=C1CCCC1	ZINC001054546480	1349394554	/nfs/dbraw/zinc/39/45/54/1349394554.db2.gz	FUULKEPZFXDUSQ-FZKQIMNGSA-N	0	3	343.496	3.447	20	30		EGEDHN
C[C@@H]1CN(C(=O)C23CCC(CC2)C3)C[C@H]1NCc1ccc(C#N)s1	ZINC001054800683	1349466802	/nfs/dbraw/zinc/46/68/02/1349466802.db2.gz	AQTLTUDUWICGIR-WKVNKLGWSA-N	0	3	343.496	3.137	20	30		EGEDHN
CCC1(C(=O)N2C[C@H](C)[C@H](NCc3ccc(C#N)c(F)c3)C2)CCC1	ZINC001054987219	1349540023	/nfs/dbraw/zinc/54/00/23/1349540023.db2.gz	VCBKIZUDXXWYNF-KBXCAEBGSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)C[C@@H]2C[C@H]2Cc2ccccc2)C1	ZINC001080177464	1357512466	/nfs/dbraw/zinc/51/24/66/1357512466.db2.gz	MSLQLZAWSCTIKO-RSPOEFSDSA-N	0	3	326.484	3.268	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)C2(c3cccc(C)c3)CCC2)C1	ZINC001080237523	1357533996	/nfs/dbraw/zinc/53/39/96/1357533996.db2.gz	ZIVYTDSYJMJBIM-IEBWSBKVSA-N	0	3	326.484	3.429	20	30		EGEDHN
O=C1C=C2CN(Cc3csc(Br)c3)CCC2S1	ZINC001233413039	1376641739	/nfs/dbraw/zinc/64/17/39/1376641739.db2.gz	DXWVMKBCNYWBOV-JTQLQIEISA-N	0	3	330.272	3.285	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2ccccc2O[C@H](C)CC)C1	ZINC001080530733	1357664674	/nfs/dbraw/zinc/66/46/74/1357664674.db2.gz	RPBPMHUCOKZPIE-JFIYKMOQSA-N	0	3	330.472	3.490	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2ccccc2OCC(C)C)C1	ZINC001080633560	1357709731	/nfs/dbraw/zinc/70/97/31/1357709731.db2.gz	JABAKKFTBVHCFQ-SJLPKXTDSA-N	0	3	330.472	3.348	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)C2CCC(C)(C)CC2)C1	ZINC001070435388	1354348297	/nfs/dbraw/zinc/34/82/97/1354348297.db2.gz	FDBSGNHPEIIYQC-MRXNPFEDSA-N	0	3	344.503	3.218	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)CC1=CCCCC1)C[C@@H](C)O2	ZINC001071146092	1354476111	/nfs/dbraw/zinc/47/61/11/1354476111.db2.gz	GMEHEJNHAAFEGI-YLJYHZDGSA-N	0	3	332.488	3.145	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C(F)=C1CCCC1)C[C@H](C)O2	ZINC001071156174	1354480977	/nfs/dbraw/zinc/48/09/77/1354480977.db2.gz	CPPJTJSPPHPTTK-KXBFYZLASA-N	0	3	336.451	3.052	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1sc(C)cc1C)C[C@H](C)O2	ZINC001071174090	1354487776	/nfs/dbraw/zinc/48/77/76/1354487776.db2.gz	SOOGKBMSACYHNX-KXBFYZLASA-N	0	3	348.512	3.246	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)CC1CC(C)(C)C1)C[C@@H](C)O2	ZINC001071201397	1354501590	/nfs/dbraw/zinc/50/15/90/1354501590.db2.gz	DMRDOVDZAMZYSD-OXQOHEQNSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C1CCC(=C)CC1)C[C@H](C)O2	ZINC001071201467	1354501760	/nfs/dbraw/zinc/50/17/60/1354501760.db2.gz	FMPQDTAJZQYAHW-FXAWDEMLSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)[C@H]1CC[C@H](C)CC1)C[C@@H](C)O2	ZINC001071232112	1354516157	/nfs/dbraw/zinc/51/61/57/1354516157.db2.gz	ZEBWWTFEWKJTJS-SOAMZJECSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)CC(C1CC1)C1CC1)C[C@@H](C)O2	ZINC001071244344	1354524325	/nfs/dbraw/zinc/52/43/25/1354524325.db2.gz	SYNUMJYMHVBGIW-IIBYNOLFSA-N	0	3	346.515	3.081	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2cccc3cccnc32)CC[C@H]1C	ZINC001071725098	1354881513	/nfs/dbraw/zinc/88/15/13/1354881513.db2.gz	QFRQEYJDISTWPV-VQIMIIECSA-N	0	3	337.467	3.323	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C(C)(C)c2c(C)noc2C)CC[C@H]1C	ZINC001071761500	1354908183	/nfs/dbraw/zinc/90/81/83/1354908183.db2.gz	YXJTXJWCXFOVAU-CJNGLKHVSA-N	0	3	333.476	3.114	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc3ccccc3n2C)CC[C@H]1C	ZINC001071773120	1354921036	/nfs/dbraw/zinc/92/10/36/1354921036.db2.gz	WQKGLUBINPDEBP-NVXWUHKLSA-N	0	3	325.456	3.337	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)Cc2cccc(Cl)c2F)CC[C@@H]1C	ZINC001071843767	1354973858	/nfs/dbraw/zinc/97/38/58/1354973858.db2.gz	APKWXOHAOHXLQE-DZGCQCFKSA-N	0	3	336.838	3.014	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2cc(F)c(F)cc2F)CC[C@H]1C	ZINC001071850054	1354978455	/nfs/dbraw/zinc/97/84/55/1354978455.db2.gz	AMIZJGJKKPCYBG-OCCSQVGLSA-N	0	3	340.389	3.192	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C2(c3cccc(OC)c3)CC2)CC[C@@H]1C	ZINC001071857028	1354985913	/nfs/dbraw/zinc/98/59/13/1354985913.db2.gz	CVFFRCOSZRSKDT-FUHWJXTLSA-N	0	3	342.483	3.272	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C2(c3cccc(OC)c3)CC2)CC[C@H]1C	ZINC001071857030	1354986309	/nfs/dbraw/zinc/98/63/09/1354986309.db2.gz	CVFFRCOSZRSKDT-SJLPKXTDSA-N	0	3	342.483	3.272	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2nccc3ccccc32)CC(C)(C)C1	ZINC001089476297	1360459225	/nfs/dbraw/zinc/45/92/25/1360459225.db2.gz	MCGYJZMGSYTFGK-QGZVFWFLSA-N	0	3	335.451	3.088	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(C(C)C)[nH]c2=O)CC[C@H]1C	ZINC001071879535	1355002327	/nfs/dbraw/zinc/00/23/27/1355002327.db2.gz	FJNCOFBEWBZUJK-CABCVRRESA-N	0	3	331.460	3.069	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(-c3cn[nH]c3)cc2)CC[C@H]1C	ZINC001071893347	1355010294	/nfs/dbraw/zinc/01/02/94/1355010294.db2.gz	NUPLBYHLXVNPAQ-BEFAXECRSA-N	0	3	338.455	3.236	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(-n3cccc3)nc2)CC[C@@H]1C	ZINC001071899538	1355013345	/nfs/dbraw/zinc/01/33/45/1355013345.db2.gz	AUOXEABARLYWRU-WMZOPIPTSA-N	0	3	338.455	3.031	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cccc(C(F)(F)F)n2)CC[C@H]1C	ZINC001071931555	1355032503	/nfs/dbraw/zinc/03/25/03/1355032503.db2.gz	XGGKVFNDEMSZQV-CHWSQXEVSA-N	0	3	341.377	3.259	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cnn(CCCC)c2CC)CC[C@H]1C	ZINC001071977299	1355056263	/nfs/dbraw/zinc/05/62/63/1355056263.db2.gz	OVORAARRRWGNSF-SJORKVTESA-N	0	3	346.519	3.404	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)Cc2c[nH]c3cccc(C)c23)CC[C@@H]1C	ZINC001071997871	1355065617	/nfs/dbraw/zinc/06/56/17/1355065617.db2.gz	FSUCIZJFKFXWHV-DOTOQJQBSA-N	0	3	325.456	3.174	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2c[nH]c3ccccc23)CC[C@H]1C	ZINC001072012948	1355076853	/nfs/dbraw/zinc/07/68/53/1355076853.db2.gz	VQRXEYJZYBAGJC-NVXWUHKLSA-N	0	3	325.456	3.256	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(C(F)(F)F)cc2)CC[C@H]1C	ZINC001072015241	1355077422	/nfs/dbraw/zinc/07/74/22/1355077422.db2.gz	ADPWIWAJZUOTJT-CZUORRHYSA-N	0	3	338.373	3.311	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)Cc2c(F)cccc2Cl)CC[C@H]1C	ZINC001072019138	1355081296	/nfs/dbraw/zinc/08/12/96/1355081296.db2.gz	DBLSXLWOPBUEGP-ZIAGYGMSSA-N	0	3	336.838	3.014	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2csc3c2CCCC3)CC[C@H]1C	ZINC001072055387	1355106129	/nfs/dbraw/zinc/10/61/29/1355106129.db2.gz	UGCONPUBMDTOIW-CABCVRRESA-N	0	3	330.497	3.233	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cnn(C(C)(C)C)c2CC)CC[C@H]1C	ZINC001072072291	1355112810	/nfs/dbraw/zinc/11/28/10/1355112810.db2.gz	IMJPQMCSYKKVIW-CVEARBPZSA-N	0	3	346.519	3.359	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cccc(OCC)c1	ZINC001089704044	1360607526	/nfs/dbraw/zinc/60/75/26/1360607526.db2.gz	SKXDISLCRFSHIA-GOSISDBHSA-N	0	3	342.483	3.329	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccccc2CC(C)C)CC[C@@H]1C	ZINC001072106998	1355134627	/nfs/dbraw/zinc/13/46/27/1355134627.db2.gz	ZDIFXLTYZHHGFP-PKOBYXMFSA-N	0	3	326.484	3.491	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@@H](C)[C@H](CNCc2ccccc2C#N)C1	ZINC001072171783	1355167053	/nfs/dbraw/zinc/16/70/53/1355167053.db2.gz	PMJSOZUOCQCRPM-VQIMIIECSA-N	0	3	325.456	3.099	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](C)[C@H](CNCc2cc(C3CC3)no2)C1	ZINC001072337565	1355245764	/nfs/dbraw/zinc/24/57/64/1355245764.db2.gz	YRWALHSTKOLZKT-GDBMZVCRSA-N	0	3	345.487	3.338	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](C)[C@H](CNCc3cc(C)no3)C2)CC1	ZINC001072356961	1355255083	/nfs/dbraw/zinc/25/50/83/1355255083.db2.gz	SSGYGEWLMBLYDO-CRAIPNDOSA-N	0	3	345.487	3.304	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001072962900	1355526396	/nfs/dbraw/zinc/52/63/96/1355526396.db2.gz	NFWXIZRJKWBLIO-RTBURBONSA-N	0	3	337.467	3.029	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3ccc(C(F)(F)F)s3)C2)C1	ZINC001073478135	1355813004	/nfs/dbraw/zinc/81/30/04/1355813004.db2.gz	AXZIRKYCILTMJX-UHFFFAOYSA-N	0	3	330.375	3.101	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCCN1C(=O)CC1CC1	ZINC001073927286	1355961957	/nfs/dbraw/zinc/96/19/57/1355961957.db2.gz	CDQJIMDTDDNSMC-LJQANCHMSA-N	0	3	325.456	3.171	20	30		EGEDHN
COc1ccc(CN(C)C[C@H]2CCCCN2C(=O)C(C)C)cc1C#N	ZINC001073952957	1355989765	/nfs/dbraw/zinc/98/97/65/1355989765.db2.gz	OTLPOKASMNETND-GOSISDBHSA-N	0	3	343.471	3.036	20	30		EGEDHN
C[C@H]1[C@@H](NCc2ccc(C#N)s2)CCN1C(=O)[C@@H]1C[C@H]1C(C)(C)C	ZINC001074740212	1356229721	/nfs/dbraw/zinc/22/97/21/1356229721.db2.gz	LPXMKGCGJZQFPI-DXEWXGHRSA-N	0	3	345.512	3.381	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001075209771	1356344140	/nfs/dbraw/zinc/34/41/40/1356344140.db2.gz	QMPYPOXLBHPDFR-SJLPKXTDSA-N	0	3	325.456	3.099	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](C2CCN(C(=O)C#CC3CC3)CC2)CC1	ZINC001075452723	1356387358	/nfs/dbraw/zinc/38/73/58/1356387358.db2.gz	ORDXQSJTPFBDCW-GOSISDBHSA-N	0	3	348.918	3.493	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cc(C)n(C(CC)CC)n3)[C@@H]2C1	ZINC001075972895	1356460064	/nfs/dbraw/zinc/46/00/64/1356460064.db2.gz	OHDSKVLLOZJADI-QFBILLFUSA-N	0	3	344.503	3.275	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccc(N(CC)CC)cc3)[C@@H]2C1	ZINC001076496604	1356597400	/nfs/dbraw/zinc/59/74/00/1356597400.db2.gz	SKNOFYAYJJEBBK-AZUAARDMSA-N	0	3	341.499	3.255	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3cc4c(s3)CC[C@@H](C)C4)[C@@H]2C1	ZINC001076556306	1356616327	/nfs/dbraw/zinc/61/63/27/1356616327.db2.gz	BUIWGEYNFVQMGW-HLLBOEOZSA-N	0	3	342.508	3.043	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@H](C)Cc3ccc(F)cc3)[C@@H]2C1	ZINC001076627110	1356637486	/nfs/dbraw/zinc/63/74/86/1356637486.db2.gz	QQMYVMLOIJYKNS-HHXXYDBFSA-N	0	3	330.447	3.113	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3csc(CC(C)C)n3)[C@@H]2C1	ZINC001076632351	1356638736	/nfs/dbraw/zinc/63/87/36/1356638736.db2.gz	WXBWIHMYANNSDH-GOEBONIOSA-N	0	3	333.501	3.064	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)Cc1cc(C)c(Cl)cn1	ZINC001099125746	1363639184	/nfs/dbraw/zinc/63/91/84/1363639184.db2.gz	KDSVJUJPFQWANG-INIZCTEOSA-N	0	3	349.906	3.379	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)CCCOc1cccnc1	ZINC001099343842	1363762208	/nfs/dbraw/zinc/76/22/08/1363762208.db2.gz	CJGIRBKIEPTXEY-KRWDZBQOSA-N	0	3	345.487	3.033	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@@H]2C[C@@H](NC(=O)C3CCC3)C23CCC3)c1	ZINC001078524656	1356993139	/nfs/dbraw/zinc/99/31/39/1356993139.db2.gz	VMBDEPFVELQFIS-QZTJIDSGSA-N	0	3	341.430	3.014	20	30		EGEDHN
CCCCCCCCOCC(=O)N1CC[C@@H](NC/C=C/Cl)C1	ZINC001183296246	1387292958	/nfs/dbraw/zinc/29/29/58/1387292958.db2.gz	YWKRZFNVNIAPIL-XAVKZTDYSA-N	0	3	330.900	3.307	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H](C)c2ccsc2)C[C@H]1c1ccccc1	ZINC001081178002	1357847964	/nfs/dbraw/zinc/84/79/64/1357847964.db2.gz	FVQOLOTUZCKLOR-ZYSHUDEJSA-N	0	3	338.476	3.069	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2cc3ccccc3o2)C[C@H]1c1ccccc1	ZINC001081221895	1357851499	/nfs/dbraw/zinc/85/14/99/1357851499.db2.gz	AHFZJUDEWQJWSA-RBUKOAKNSA-N	0	3	344.414	3.264	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2ccc(C)c(Cl)c2)[C@H](OC)C1	ZINC001082094951	1357942447	/nfs/dbraw/zinc/94/24/47/1357942447.db2.gz	LCWONBQPPNKRQQ-IAGOWNOFSA-N	0	3	336.863	3.044	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2c(CC)oc3ccccc32)[C@H](OC)C1	ZINC001082386865	1358024979	/nfs/dbraw/zinc/02/49/79/1358024979.db2.gz	ZJUNDENBMJKDSM-CRAIPNDOSA-N	0	3	342.439	3.000	20	30		EGEDHN
O=C(C#CC1CC1)N1C[C@H]2CCN(Cc3ccc4ccccc4c3)C[C@H]21	ZINC001084335116	1358194986	/nfs/dbraw/zinc/19/49/86/1358194986.db2.gz	ZTPQNNYVZWVFJQ-FGZHOGPDSA-N	0	3	344.458	3.286	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H]3CCN(CC4CC(F)(F)C4)C[C@H]32)CC1	ZINC001084634090	1358262377	/nfs/dbraw/zinc/26/23/77/1358262377.db2.gz	BFSUVNNXQFZGCU-IAGOWNOFSA-N	0	3	338.442	3.311	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)[C@@H](CC3CCCC3)C(C)C)[C@@H]2C1	ZINC001084698567	1358285006	/nfs/dbraw/zinc/28/50/06/1358285006.db2.gz	ZQMCQGFDRXJBBZ-HSALFYBXSA-N	0	3	330.516	3.395	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)c3cc(C)n(C(C)C)c3C)[C@@H]2C1	ZINC001084821354	1358320736	/nfs/dbraw/zinc/32/07/36/1358320736.db2.gz	SOAWYOBEPFLWQG-IEBWSBKVSA-N	0	3	329.488	3.408	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CCN(C(=O)[C@H]4CC=CCC4)C[C@@H]32)cc1	ZINC001084888182	1358340187	/nfs/dbraw/zinc/34/01/87/1358340187.db2.gz	AWHQEADERXQELO-HKBOAZHASA-N	0	3	349.478	3.337	20	30		EGEDHN
CC[C@H](C)C(=O)N1CC[C@H]2CCN(Cc3ccc(C#N)cc3)[C@H]2C1	ZINC001084891998	1358341790	/nfs/dbraw/zinc/34/17/90/1358341790.db2.gz	HJYFFEMYNBTRGS-IPELMVKDSA-N	0	3	325.456	3.027	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@H](C)c3c(F)cccc3F)C[C@@H]21	ZINC001084989945	1358360410	/nfs/dbraw/zinc/36/04/10/1358360410.db2.gz	MUGAMRQTXNUDHR-RKVPGOIHSA-N	0	3	346.421	3.014	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)C[C@@H]1Cc2ccccc2O1	ZINC001085208759	1358434493	/nfs/dbraw/zinc/43/44/93/1358434493.db2.gz	HLVTXQJMCVCKBK-GVDBMIGSSA-N	0	3	348.874	3.150	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1[nH]nc2ccc(C)cc21	ZINC001085257918	1358446100	/nfs/dbraw/zinc/44/61/00/1358446100.db2.gz	GPRBQQGASGRSSW-HZPDHXFCSA-N	0	3	346.862	3.254	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ncoc1C(C)C	ZINC001085385361	1358484425	/nfs/dbraw/zinc/48/44/25/1358484425.db2.gz	VIRLDMBVUGUBRT-CHWSQXEVSA-N	0	3	325.840	3.181	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cnc(C)nc1C1CC1	ZINC001085410364	1358492528	/nfs/dbraw/zinc/49/25/28/1358492528.db2.gz	QNANOYHYTNIWNI-HZPDHXFCSA-N	0	3	348.878	3.046	20	30		EGEDHN
CN(C[C@H]1CCN1[C@H]1CCCc2ccccc21)C(=O)c1c[nH]c(C#N)c1	ZINC001085556746	1358591657	/nfs/dbraw/zinc/59/16/57/1358591657.db2.gz	YURJRPTZLDLRJW-QUCCMNQESA-N	0	3	348.450	3.110	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc(C)n([C@H](C)C2CC2)n1	ZINC001085685323	1358686576	/nfs/dbraw/zinc/68/65/76/1358686576.db2.gz	OWEUWVZZTCALRZ-SJLPKXTDSA-N	0	3	344.503	3.275	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc(F)c(F)c1F	ZINC001085791876	1358767194	/nfs/dbraw/zinc/76/71/94/1358767194.db2.gz	VIPATFHFONUJBX-GFCCVEGCSA-N	0	3	326.362	3.216	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1ccc(C(F)F)c(F)c1	ZINC001085818158	1358792471	/nfs/dbraw/zinc/79/24/71/1358792471.db2.gz	SKAIBKOKEIYLAU-CYBMUJFWSA-N	0	3	326.362	3.486	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc(-c2cn[nH]c2)cc1	ZINC001085871292	1358836160	/nfs/dbraw/zinc/83/61/60/1358836160.db2.gz	QDLNXZNOCJCXQG-IBGZPJMESA-N	0	3	338.455	3.189	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc(C)nc1OCCC	ZINC001085900595	1358859264	/nfs/dbraw/zinc/85/92/64/1358859264.db2.gz	KOZAFIKUCURPMO-KRWDZBQOSA-N	0	3	345.487	3.291	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1ccc2nc(C)sc2c1	ZINC001085908986	1358868645	/nfs/dbraw/zinc/86/86/45/1358868645.db2.gz	XYDUEHVOGXOLQE-OAHLLOKOSA-N	0	3	329.469	3.327	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@@H]1Cc2ccc(Cl)cc21	ZINC001085951350	1358907802	/nfs/dbraw/zinc/90/78/02/1358907802.db2.gz	DLXJEAXXSXRBSJ-SJLPKXTDSA-N	0	3	332.875	3.479	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc(OC)c(C)c(OC)c1	ZINC001085959465	1358917035	/nfs/dbraw/zinc/91/70/35/1358917035.db2.gz	CSMZGAQUFSJANG-QGZVFWFLSA-N	0	3	346.471	3.125	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1c[nH]c2c1cccc2CC	ZINC001085988476	1358940240	/nfs/dbraw/zinc/94/02/40/1358940240.db2.gz	KOGMGTPUMSWDMX-MRXNPFEDSA-N	0	3	325.456	3.453	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@H]1C[C@@H](NCc2ccccc2F)C1	ZINC001086107874	1358999136	/nfs/dbraw/zinc/99/91/36/1358999136.db2.gz	RDRDVPYLHJEHJI-WOVMCDHWSA-N	0	3	341.430	3.111	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2c(Cl)cncc2Cl)C1	ZINC001086185969	1359020404	/nfs/dbraw/zinc/02/04/04/1359020404.db2.gz	BCEOHONXWGFKBR-AOOOYVTPSA-N	0	3	348.661	3.239	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(C)cc2Cl)C1	ZINC001086206183	1359025810	/nfs/dbraw/zinc/02/58/10/1359025810.db2.gz	DWFPQTXYTPMYQC-BETUJISGSA-N	0	3	327.255	3.499	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2scnc2C(C)C)C1	ZINC001086219155	1359031125	/nfs/dbraw/zinc/03/11/25/1359031125.db2.gz	NOXQFCMXVCTQNV-TXEJJXNPSA-N	0	3	327.881	3.117	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(OC)c(Cl)c2)C1	ZINC001086268840	1359049258	/nfs/dbraw/zinc/04/92/58/1359049258.db2.gz	AYOJNUSTINUBMZ-BJHJDKERSA-N	0	3	343.254	3.199	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)C23CC(c4ccccc4)(C2)C3)C1	ZINC001086280859	1359053844	/nfs/dbraw/zinc/05/38/44/1359053844.db2.gz	PRKUTGZOLUMCMD-UCHVWPQTSA-N	0	3	344.886	3.345	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)c2sccc2C)C1	ZINC001086294207	1359058687	/nfs/dbraw/zinc/05/86/87/1359058687.db2.gz	NLCWIJGWALSTHF-HAQNSBGRSA-N	0	3	343.290	3.063	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cncc3sccc32)C1	ZINC001086456620	1359102433	/nfs/dbraw/zinc/10/24/33/1359102433.db2.gz	OTBRERQKHHTHHO-HAQNSBGRSA-N	0	3	335.860	3.147	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccccc2OC(C)C)C1	ZINC001086538257	1359136286	/nfs/dbraw/zinc/13/62/86/1359136286.db2.gz	WDJSQBHAGSAEPC-SHTZXODSSA-N	0	3	336.863	3.324	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2c[nH]c3ccc(C)cc23)C1	ZINC001086559604	1359145435	/nfs/dbraw/zinc/14/54/35/1359145435.db2.gz	FFESIMDRYTWYIL-HDJSIYSDSA-N	0	3	331.847	3.327	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)C2CCC(F)CC2)C1	ZINC001086608291	1359163017	/nfs/dbraw/zinc/16/30/17/1359163017.db2.gz	ZHYQPFUGOWMJSJ-GHBBCFCZSA-N	0	3	342.458	3.122	20	30		EGEDHN
C=C(Br)CN[C@@H]1CC[C@H](CNC(=O)C2CCCCC2)C1	ZINC001086633188	1359171666	/nfs/dbraw/zinc/17/16/66/1359171666.db2.gz	ISMACQBHEMSNIX-DZGCQCFKSA-N	0	3	343.309	3.350	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccc(OC)c(F)c2)C1	ZINC001086722814	1359191627	/nfs/dbraw/zinc/19/16/27/1359191627.db2.gz	AHOIXSKDFWOGJU-GXTWGEPZSA-N	0	3	340.826	3.075	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2c[nH]c3ccccc23)C1	ZINC001086748303	1359194450	/nfs/dbraw/zinc/19/44/50/1359194450.db2.gz	SBZJPZHCCHJFEU-UONOGXRCSA-N	0	3	331.847	3.409	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CC[C@@H](NCc3nccn3CC)C2)CC1	ZINC001086793200	1359202633	/nfs/dbraw/zinc/20/26/33/1359202633.db2.gz	HNMKOGAKYJFUJD-FUHWJXTLSA-N	0	3	344.503	3.024	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccc(OC)c(C)c2)C1	ZINC001086828070	1359210043	/nfs/dbraw/zinc/21/00/43/1359210043.db2.gz	YHSKEBINSIMORQ-GOEBONIOSA-N	0	3	336.863	3.244	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3sccc3C)C2)CC1	ZINC001086898831	1359228623	/nfs/dbraw/zinc/22/86/23/1359228623.db2.gz	SUWCJEAQQGDLRI-INIZCTEOSA-N	0	3	330.497	3.396	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)Cc3ccsc3)C2)CC1	ZINC001086899315	1359229219	/nfs/dbraw/zinc/22/92/19/1359229219.db2.gz	GYDMVFPRACIYBT-MRXNPFEDSA-N	0	3	330.497	3.017	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC2(C[C@@H]1C)CCN(Cc1ccccc1F)CC2	ZINC001086910182	1359237591	/nfs/dbraw/zinc/23/75/91/1359237591.db2.gz	NPIFPAMUAOPCJY-HOTGVXAUSA-N	0	3	343.446	3.188	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3cc(OC)cs3)C2)CC1	ZINC001086936178	1359259407	/nfs/dbraw/zinc/25/94/07/1359259407.db2.gz	KJIQGAGAHGAVKY-HNNXBMFYSA-N	0	3	346.496	3.097	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3occ4c3CCCC4)C2)CC1	ZINC001086954596	1359274977	/nfs/dbraw/zinc/27/49/77/1359274977.db2.gz	PFDSLNGABGHQNJ-MRXNPFEDSA-N	0	3	340.467	3.108	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc(C(F)F)o3)C2)CC1	ZINC001086955130	1359275539	/nfs/dbraw/zinc/27/55/39/1359275539.db2.gz	DUQDIVXOTPXKDZ-ZDUSSCGKSA-N	0	3	336.382	3.167	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)Cc3ccccc3C)C2)CC1	ZINC001086956121	1359277173	/nfs/dbraw/zinc/27/71/73/1359277173.db2.gz	FQKNYZDCTFVHCR-IBGZPJMESA-N	0	3	338.495	3.264	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)C3CCC=CCC3)C2)CC1	ZINC001086957032	1359278124	/nfs/dbraw/zinc/27/81/24/1359278124.db2.gz	CRTIGWRQTJWHBS-GOSISDBHSA-N	0	3	328.500	3.459	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)CCc3ccc(C)s3)C2)CC1	ZINC001086960433	1359280347	/nfs/dbraw/zinc/28/03/47/1359280347.db2.gz	UDNKLLNNDVSORS-MRXNPFEDSA-N	0	3	344.524	3.325	20	30		EGEDHN
C/C=C(\C)C(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccc(C#N)cc1F	ZINC001087145100	1359305709	/nfs/dbraw/zinc/30/57/09/1359305709.db2.gz	IZIOXVZWSYNLCX-LABOVOQKSA-N	0	3	343.446	3.380	20	30		EGEDHN
CCC(=O)N[C@@H]1[C@@H]2CCCN(Cc3cccc(C#N)c3)[C@H]2C1(C)C	ZINC001087262417	1359332374	/nfs/dbraw/zinc/33/23/74/1359332374.db2.gz	BVYQVSGNLSLQCQ-QXAKKESOSA-N	0	3	325.456	3.073	20	30		EGEDHN
CCC(=O)N[C@@H]1[C@@H]2CCCN(Cc3ccc(C#N)cc3)[C@@H]2C1(C)C	ZINC001087262612	1359332388	/nfs/dbraw/zinc/33/23/88/1359332388.db2.gz	GAHXCIADGHXGTG-UHOSZYNNSA-N	0	3	325.456	3.073	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3cccc(F)c3C)C(C)(C)[C@H]21	ZINC001087288232	1359367240	/nfs/dbraw/zinc/36/72/40/1359367240.db2.gz	TXHLVLYHBVDRRM-NEWSRXKRSA-N	0	3	342.458	3.376	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc(F)c(C)cc1F	ZINC001087290478	1359369291	/nfs/dbraw/zinc/36/92/91/1359369291.db2.gz	CQDSHUQVBANAKJ-JEBQAFNWSA-N	0	3	346.421	3.125	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(CC)o3)C(C)(C)[C@@H]21	ZINC001087291921	1359372245	/nfs/dbraw/zinc/37/22/45/1359372245.db2.gz	CJAVDOABBFGDGR-KBAYOESNSA-N	0	3	328.456	3.084	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc4cccnc43)C(C)(C)[C@@H]21	ZINC001087294537	1359375437	/nfs/dbraw/zinc/37/54/37/1359375437.db2.gz	UYLFGGXGDACYTB-MISYRCLQSA-N	0	3	347.462	3.087	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(C(C)C)no3)C(C)(C)[C@H]21	ZINC001087304966	1359389542	/nfs/dbraw/zinc/38/95/42/1359389542.db2.gz	KLCQOEBAFROHHJ-OLMNPRSZSA-N	0	3	343.471	3.040	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc4[nH]ccc43)C(C)(C)[C@H]21	ZINC001087305206	1359390614	/nfs/dbraw/zinc/39/06/14/1359390614.db2.gz	ORRDIGRVYHSECI-RLLQIKCJSA-N	0	3	349.478	3.410	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc4cc[nH]c4c3)C(C)(C)[C@H]21	ZINC001087307369	1359394859	/nfs/dbraw/zinc/39/48/59/1359394859.db2.gz	YTYJGBMCJFTYQP-NEWSRXKRSA-N	0	3	335.451	3.020	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc(C)c(CC)o3)C(C)(C)[C@H]21	ZINC001087312533	1359400785	/nfs/dbraw/zinc/40/07/85/1359400785.db2.gz	GSEUHLASIZTJHQ-MNEFBYGVSA-N	0	3	342.483	3.393	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(C)c(CC)o3)C(C)(C)[C@H]21	ZINC001087312340	1359400868	/nfs/dbraw/zinc/40/08/68/1359400868.db2.gz	CTZLLLVOPQDOKX-OLMNPRSZSA-N	0	3	328.456	3.002	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)Cc1ccccc1Cl	ZINC001087315774	1359405741	/nfs/dbraw/zinc/40/57/41/1359405741.db2.gz	HWSKDDPVXSPKFV-AYOQOUSVSA-N	0	3	344.886	3.121	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc4ccccc4[nH]3)C(C)(C)[C@H]21	ZINC001087318284	1359409730	/nfs/dbraw/zinc/40/97/30/1359409730.db2.gz	UWPQJVVDTCNBJA-LZQZEXGQSA-N	0	3	335.451	3.020	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc(CF)cc1	ZINC001087319054	1359411439	/nfs/dbraw/zinc/41/14/39/1359411439.db2.gz	HZFVMRAZZLQPMC-CEXWTWQISA-N	0	3	342.458	3.398	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)[C@H]2CCC2(F)F)C1	ZINC001087430320	1359462992	/nfs/dbraw/zinc/46/29/92/1359462992.db2.gz	IXBPJBXAVLCOON-KZNAEPCWSA-N	0	3	346.421	3.029	20	30		EGEDHN
C=C(C)CN1CC[C@H](c2ccccc2)[C@H](NC(=O)Cc2ccc[nH]2)C1	ZINC001087443952	1359467591	/nfs/dbraw/zinc/46/75/91/1359467591.db2.gz	OTUAQAKLUGHYGJ-WOJBJXKFSA-N	0	3	337.467	3.108	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)c2cccn2CC)C1	ZINC001087443658	1359467695	/nfs/dbraw/zinc/46/76/95/1359467695.db2.gz	YHVNPOIRIAJIBD-WOJBJXKFSA-N	0	3	349.478	3.119	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)[C@@H]2CCCO[C@H]2c2ccccc2)[C@H]1CC	ZINC001087606939	1359553178	/nfs/dbraw/zinc/55/31/78/1359553178.db2.gz	AMLPOAIOMVCMKL-WCIQWLHISA-N	0	3	342.483	3.309	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)[C@@]2(C)OCCc3ccccc32)[C@H]1CC	ZINC001087847418	1359679048	/nfs/dbraw/zinc/67/90/48/1359679048.db2.gz	TVYRHYBOBIVFBX-ZVDOUQERSA-N	0	3	342.483	3.020	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CN(C(=O)C[C@@H]4C=CCC4)C[C@@H]3C2)c1	ZINC001087879544	1359694575	/nfs/dbraw/zinc/69/45/75/1359694575.db2.gz	UAJZGXAEOCQZFS-UIFIKXQLSA-N	0	3	349.478	3.195	20	30		EGEDHN
CC(C(=O)N1C[C@H]2CCN(Cc3cccc(C#N)c3)C[C@H]2C1)=C1CCC1	ZINC001087962480	1359720149	/nfs/dbraw/zinc/72/01/49/1359720149.db2.gz	SVRVKRZJITVTOZ-RTWAWAEBSA-N	0	3	349.478	3.339	20	30		EGEDHN
CC(C(=O)N1C[C@H]2CCN(Cc3ccc(C#N)cc3)C[C@H]2C1)=C1CCC1	ZINC001087962301	1359720215	/nfs/dbraw/zinc/72/02/15/1359720215.db2.gz	IAPHRZDDRNHOLN-RTWAWAEBSA-N	0	3	349.478	3.339	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3cc4c(cc(C)cc4C)[nH]3)C[C@@H]2C1	ZINC001088056782	1359738414	/nfs/dbraw/zinc/73/84/14/1359738414.db2.gz	QOHJDWZBESPQRN-MSOLQXFVSA-N	0	3	349.478	3.202	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CCN(Cc3cccc(F)c3)C[C@H]2C1	ZINC001088066308	1359740230	/nfs/dbraw/zinc/74/02/30/1359740230.db2.gz	FMNYPZVTBMVDTN-SJORKVTESA-N	0	3	330.447	3.318	20	30		EGEDHN
CCC1(C(=O)N2C[C@H]3CCN(Cc4cccc(C#N)c4)C[C@H]3C2)CC1	ZINC001088094668	1359753235	/nfs/dbraw/zinc/75/32/35/1359753235.db2.gz	XTVKCNXVICOOSH-MOPGFXCFSA-N	0	3	337.467	3.029	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3cc(CC)c(C)s3)C[C@@H]2C1	ZINC001088194728	1359790910	/nfs/dbraw/zinc/79/09/10/1359790910.db2.gz	TWYIMYCIUMGGKC-SJORKVTESA-N	0	3	330.497	3.036	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)[C@@]3(C)CCC(C)=C(C)C3)C[C@@H]2C1	ZINC001088216798	1359799601	/nfs/dbraw/zinc/79/96/01/1359799601.db2.gz	ZTSATXOOEXZZPF-DYXWJJEUSA-N	0	3	328.500	3.317	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3ccc(-c4ccccc4)[nH]3)C[C@@H]2C1	ZINC001088219245	1359801733	/nfs/dbraw/zinc/80/17/33/1359801733.db2.gz	SEAHYEPGLFGZFR-MOPGFXCFSA-N	0	3	347.462	3.099	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](CNCc2ncc(C)s2)[C@H](C)C1	ZINC001184232123	1387417182	/nfs/dbraw/zinc/41/71/82/1387417182.db2.gz	RKLVUWUALCGWFJ-WBVHZDCISA-N	0	3	347.528	3.219	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCCC[C@@H](NCc2cncc(F)c2)C1	ZINC001088360472	1359844394	/nfs/dbraw/zinc/84/43/94/1359844394.db2.gz	ZNUCFDCNJKJAAD-QGZVFWFLSA-N	0	3	333.451	3.294	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)CCC2CCOCC2)C1	ZINC001088393832	1359870302	/nfs/dbraw/zinc/87/03/02/1359870302.db2.gz	OFVRAPJTEQJAHH-QGZVFWFLSA-N	0	3	342.911	3.307	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)CCc2nccs2)C1	ZINC001088427899	1359895482	/nfs/dbraw/zinc/89/54/82/1359895482.db2.gz	GWSVBHZUSVFFRA-AWEZNQCLSA-N	0	3	341.908	3.189	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ocnc2-c2ccccc2)[C@H]1C	ZINC001088612011	1359991293	/nfs/dbraw/zinc/99/12/93/1359991293.db2.gz	WFWNVVWAGCQFMW-ZBFHGGJFSA-N	0	3	325.412	3.110	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2coc3ccc(OC)cc23)[C@H]1C	ZINC001088734043	1360025149	/nfs/dbraw/zinc/02/51/49/1360025149.db2.gz	CXKKTFFUGIZWQL-DYVFJYSZSA-N	0	3	328.412	3.210	20	30		EGEDHN
CC/C(C)=C\C(=O)N1CC[C@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001184328048	1387430811	/nfs/dbraw/zinc/43/08/11/1387430811.db2.gz	KXQITFOKKPYVTF-KNXLQNQVSA-N	0	3	339.483	3.489	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2ccccc2O[C@@H](C)CC)[C@H]1C	ZINC001088889859	1360093379	/nfs/dbraw/zinc/09/33/79/1360093379.db2.gz	OZXSBBFUYMPASS-JZXOWHBKSA-N	0	3	328.456	3.080	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2ccc(Cl)c(Cl)c2)[C@H]1C	ZINC001088999432	1360131911	/nfs/dbraw/zinc/13/19/11/1360131911.db2.gz	ZHWSRHNWOUHTAF-ABAIWWIYSA-N	0	3	325.239	3.209	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3cc(C)cc(C)c3)[C@@H]2C)cn1	ZINC001088990480	1360126223	/nfs/dbraw/zinc/12/62/23/1360126223.db2.gz	YIZLMEAZGUHEQS-UTKZUKDTSA-N	0	3	347.462	3.073	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2cc(Cl)ccc2Cl)[C@H]1C	ZINC001089001323	1360132778	/nfs/dbraw/zinc/13/27/78/1360132778.db2.gz	BLSMNNKKNHYHKV-ABAIWWIYSA-N	0	3	325.239	3.209	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2cc3c(s2)CC[C@H](C)C3)[C@H]1C	ZINC001089033341	1360143524	/nfs/dbraw/zinc/14/35/24/1360143524.db2.gz	MXWWDEJHYKKCDZ-LZWOXQAQSA-N	0	3	330.497	3.089	20	30		EGEDHN
CN(Cc1ccc(F)cc1)C[C@@H]1CCCCN1C(=O)C#CC1CC1	ZINC001089174550	1360227788	/nfs/dbraw/zinc/22/77/88/1360227788.db2.gz	DMLONOKVPSZIPJ-IBGZPJMESA-N	0	3	328.431	3.052	20	30		EGEDHN
CC[C@H](F)C(=O)N1CCCC[C@H]1CN(C)Cc1cccc(C#N)c1	ZINC001089209325	1360255134	/nfs/dbraw/zinc/25/51/34/1360255134.db2.gz	JIOKPHTVMKLLNY-ROUUACIJSA-N	0	3	331.435	3.119	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCCN1C(=O)CC(C)(F)F	ZINC001089222491	1360264931	/nfs/dbraw/zinc/26/49/31/1360264931.db2.gz	LHNOFFOJBFRZFI-KRWDZBQOSA-N	0	3	349.425	3.416	20	30		EGEDHN
CC1(C)C[C@H](NC(=O)C2CC2)CCN(Cc2ccc(C#N)s2)C1	ZINC001089294317	1360311962	/nfs/dbraw/zinc/31/19/62/1360311962.db2.gz	YRHNKUYYIKYTEN-CQSZACIVSA-N	0	3	331.485	3.137	20	30		EGEDHN
C#CC1CCN(C(=O)[C@@H]2CCCN(Cc3ccc(Cl)cc3)C2)CC1	ZINC001184400992	1387449203	/nfs/dbraw/zinc/44/92/03/1387449203.db2.gz	DWEZWBITVSCXIX-GOSISDBHSA-N	0	3	344.886	3.424	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2ccc3cccnc3c2)CC(C)(C)C1	ZINC001089417453	1360411744	/nfs/dbraw/zinc/41/17/44/1360411744.db2.gz	YZZJFQCBRONVNL-IBGZPJMESA-N	0	3	349.478	3.017	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cnc3ccccc3c2C)CC(C)(C)C1	ZINC001089442808	1360432698	/nfs/dbraw/zinc/43/26/98/1360432698.db2.gz	ULDGFPQCQWSIHO-QGZVFWFLSA-N	0	3	349.478	3.397	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc(F)ccc2Cl)CC(C)(C)C1	ZINC001089500813	1360475054	/nfs/dbraw/zinc/47/50/54/1360475054.db2.gz	WVXWOXPYGVVBHY-AWEZNQCLSA-N	0	3	336.838	3.333	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2oc(CC(C)C)nc2C)CC(C)(C)C1	ZINC001089515069	1360485766	/nfs/dbraw/zinc/48/57/66/1360485766.db2.gz	SPIBGYHHYSIWGM-MRXNPFEDSA-N	0	3	345.487	3.035	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)c(CC)o2)CC(C)(C)C1	ZINC001089542848	1360498736	/nfs/dbraw/zinc/49/87/36/1360498736.db2.gz	YOBXAAWNSUBBEW-MRXNPFEDSA-N	0	3	330.472	3.394	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@@H]2Cc3c2cccc3Cl)CC(C)(C)C1	ZINC001089569294	1360514504	/nfs/dbraw/zinc/51/45/04/1360514504.db2.gz	VKWLOAYVJCAYCI-WMLDXEAASA-N	0	3	344.886	3.220	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ccn(C(C)(C)C)n1	ZINC001089645852	1360557945	/nfs/dbraw/zinc/55/79/45/1360557945.db2.gz	BJIKGYPGOHEKSA-INIZCTEOSA-N	0	3	346.519	3.435	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ccnn1CC(C)C	ZINC001089646192	1360559173	/nfs/dbraw/zinc/55/91/73/1360559173.db2.gz	LNTZKTIOGXIUCX-KRWDZBQOSA-N	0	3	346.519	3.336	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](CNCc2ocnc2C)[C@@H](C)C1	ZINC001184448356	1387462795	/nfs/dbraw/zinc/46/27/95/1387462795.db2.gz	OBBBHYAPIUQJKK-MAUKXSAKSA-N	0	3	345.487	3.326	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(F)ccc1F	ZINC001089651919	1360564140	/nfs/dbraw/zinc/56/41/40/1360564140.db2.gz	QXWQWMKSLTXNDY-OAHLLOKOSA-N	0	3	334.410	3.209	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1c[nH]nc1C(C)C	ZINC001089664259	1360574194	/nfs/dbraw/zinc/57/41/94/1360574194.db2.gz	GMCFVBGQDHICDJ-OAHLLOKOSA-N	0	3	332.492	3.330	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cnn(C)c1CCC	ZINC001089664384	1360575196	/nfs/dbraw/zinc/57/51/96/1360575196.db2.gz	JRDCISRAKLWFJF-MRXNPFEDSA-N	0	3	346.519	3.169	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cnn(CCC)c1	ZINC001089703503	1360606471	/nfs/dbraw/zinc/60/64/71/1360606471.db2.gz	KXAPQONXZATJAO-KRWDZBQOSA-N	0	3	332.492	3.090	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1nc(CC)oc1C	ZINC001089707643	1360611052	/nfs/dbraw/zinc/61/10/52/1360611052.db2.gz	PGHAKKMZSRJQER-OAHLLOKOSA-N	0	3	333.476	3.342	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)[C@H]1CCO[C@H]1C(=C)C	ZINC001089708677	1360612485	/nfs/dbraw/zinc/61/24/85/1360612485.db2.gz	KCBZUOKOVDFXAG-BZSNNMDCSA-N	0	3	334.504	3.151	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc2c(c1)C[C@@H](C)O2	ZINC001089711727	1360615373	/nfs/dbraw/zinc/61/53/73/1360615373.db2.gz	ZNMZSUKPBUKCPT-CRAIPNDOSA-N	0	3	342.483	3.416	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1nc(C2CC2)oc1C	ZINC001089717565	1360619239	/nfs/dbraw/zinc/61/92/39/1360619239.db2.gz	BJROSLFFCBBLAU-MRXNPFEDSA-N	0	3	343.471	3.104	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(C2CC2)cn1	ZINC001089729472	1360632490	/nfs/dbraw/zinc/63/24/90/1360632490.db2.gz	OTFWJDBSYKJWOU-SFHVURJKSA-N	0	3	339.483	3.203	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1CCCCC1	ZINC001089761004	1360653259	/nfs/dbraw/zinc/65/32/59/1360653259.db2.gz	QHBCOGLQACUDSN-MHORFTMASA-N	0	3	336.907	3.488	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1ccoc1CC	ZINC001089804979	1360671023	/nfs/dbraw/zinc/67/10/23/1360671023.db2.gz	YKGCPONIAURZBI-LLLHUVSDSA-N	0	3	348.874	3.377	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)C2C=CC=CC=C2)C1	ZINC001089812838	1360674342	/nfs/dbraw/zinc/67/43/42/1360674342.db2.gz	PDFPUAIGOFYPPR-VJANTYMQSA-N	0	3	344.886	3.206	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](CNCc2ocnc2C)[C@H](C)C1	ZINC001184472672	1387467687	/nfs/dbraw/zinc/46/76/87/1387467687.db2.gz	KMFLVQUUPZYRTL-ZBFHGGJFSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)c2cc(C)[nH]c2C)C1	ZINC001089868703	1360710855	/nfs/dbraw/zinc/71/08/55/1360710855.db2.gz	FITRGDYRLUKOSQ-DKIMLUQUSA-N	0	3	347.890	3.166	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](CNCc2oc(C)nc2C)[C@@H](C)C1	ZINC001184499383	1387475000	/nfs/dbraw/zinc/47/50/00/1387475000.db2.gz	ZERSEEVJGIYMIL-YOEHRIQHSA-N	0	3	333.476	3.222	20	30		EGEDHN
CC[C@@H](C(=O)N[C@@H](C)CCCCNc1cccc(F)c1C#N)N(C)C	ZINC001090103451	1360826339	/nfs/dbraw/zinc/82/63/39/1360826339.db2.gz	OTMOSRZANJUDKP-KSSFIOAISA-N	0	3	348.466	3.124	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cccc3scnc32)C1	ZINC001091026055	1360982335	/nfs/dbraw/zinc/98/23/35/1360982335.db2.gz	FYAFWGUZHPOOIY-UHFFFAOYSA-N	0	3	335.860	3.147	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2conc2C2CCCC2)C1	ZINC001091066050	1360988401	/nfs/dbraw/zinc/98/84/01/1360988401.db2.gz	KTRPERVGHCDRTA-UHFFFAOYSA-N	0	3	337.851	3.183	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H]2C[C@]2(C)c2ccccc2)C1	ZINC001091151243	1360998976	/nfs/dbraw/zinc/99/89/76/1360998976.db2.gz	SDGILEZNRYALJX-HJRFIPHPSA-N	0	3	332.875	3.201	20	30		EGEDHN
C=C1CCC(C(=O)NCC2CC(NCc3ccncc3Cl)C2)CC1	ZINC001091213485	1361009464	/nfs/dbraw/zinc/00/94/64/1361009464.db2.gz	OTZLHONIBKBMCK-UHFFFAOYSA-N	0	3	347.890	3.466	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1	ZINC001091222381	1361013303	/nfs/dbraw/zinc/01/33/03/1361013303.db2.gz	MWNYYOXTGCLMRX-XPJGSDBHSA-N	0	3	343.446	3.118	20	30		EGEDHN
C[C@@]12CN(Cc3ccc(C#N)cc3)C[C@@H]1CN(C(=O)[C@@H]1CC13CCC3)C2	ZINC001092054712	1361284404	/nfs/dbraw/zinc/28/44/04/1361284404.db2.gz	ZTZNNMOBALZCCG-DYXWJJEUSA-N	0	3	349.478	3.029	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc(Cl)ccc3C)C[C@]2(C)C1	ZINC001092104377	1361301101	/nfs/dbraw/zinc/30/11/01/1361301101.db2.gz	GJQDEZYGCUNWOY-BEFAXECRSA-N	0	3	330.859	3.066	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc(C)c(C)c3Cl)C[C@]2(C)C1	ZINC001092199717	1361321038	/nfs/dbraw/zinc/32/10/38/1361321038.db2.gz	NKQDRJJJEZIUHH-UZLBHIALSA-N	0	3	344.886	3.374	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C(C)(C)C(=C)C)CC1	ZINC001093374448	1361584562	/nfs/dbraw/zinc/58/45/62/1361584562.db2.gz	JBLLHQJGWYBFBT-GOSISDBHSA-N	0	3	328.500	3.315	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)[C@@H]2CCC2(C)C)CC1	ZINC001093376271	1361586501	/nfs/dbraw/zinc/58/65/01/1361586501.db2.gz	IFQFWNYKVQNSMQ-ZWKOTPCHSA-N	0	3	328.500	3.149	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cc4cccc(C)c4o3)CCC[C@@H]12	ZINC001094585732	1361871140	/nfs/dbraw/zinc/87/11/40/1361871140.db2.gz	PIEHYJQWIPDDRB-WIYYLYMNSA-N	0	3	336.435	3.349	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cn3cc(C)nc3s1)C2	ZINC001095532929	1362162897	/nfs/dbraw/zinc/16/28/97/1362162897.db2.gz	VTWHVYUPXYVMKP-ILXRZTDVSA-N	0	3	344.484	3.006	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc3c(c1)C(C)(C)CO3)C2	ZINC001095743218	1362218379	/nfs/dbraw/zinc/21/83/79/1362218379.db2.gz	YWJINUATHBQWOF-NJAFHUGGSA-N	0	3	340.467	3.268	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1CC)C2	ZINC001095932877	1362292710	/nfs/dbraw/zinc/29/27/10/1362292710.db2.gz	NWMUEMKVGIXETI-VLQCVTHLSA-N	0	3	336.479	3.097	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccc(F)cc1)C2	ZINC001096637880	1362610988	/nfs/dbraw/zinc/61/09/88/1362610988.db2.gz	NRTXBBBMXIJXPO-LFDJNIOPSA-N	0	3	328.431	3.227	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(C(C)(F)F)cc1)C2	ZINC001096699386	1362644729	/nfs/dbraw/zinc/64/47/29/1362644729.db2.gz	XBICAKXRPDPIKI-IKGGRYGDSA-N	0	3	332.394	3.157	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1coc3ccc(C)cc13)C2	ZINC001097156413	1362868466	/nfs/dbraw/zinc/86/84/66/1362868466.db2.gz	ASCSWZUFBYFMKU-QRQLOZEOSA-N	0	3	336.435	3.029	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1c(C)onc1C1CC1)C2	ZINC001097556463	1363055909	/nfs/dbraw/zinc/05/59/09/1363055909.db2.gz	BQUWLBVFYAWTFI-OAGGEKHMSA-N	0	3	329.444	3.162	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)C[C@@H](NC(=O)C1CCC1)c1ccccc1O2	ZINC001098541667	1363363610	/nfs/dbraw/zinc/36/36/10/1363363610.db2.gz	QDFPGHAMYRLQSV-NQIIRXRSSA-N	0	3	340.467	3.447	20	30		EGEDHN
C=CCC[C@@H](C)NCc1cn([C@@H]2CCN(C(=O)CCCCC)C2)nn1	ZINC001098615018	1363399905	/nfs/dbraw/zinc/39/99/05/1363399905.db2.gz	GZRQEFZYWOAMJO-SJLPKXTDSA-N	0	3	347.507	3.076	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1cc(C)cc(F)c1)C[C@@H](C)O2	ZINC001098639597	1363411170	/nfs/dbraw/zinc/41/11/70/1363411170.db2.gz	ZYHHHOYTOVFNSL-MRXNPFEDSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H](C)C1CCCC1)C[C@H](C)O2	ZINC001098652416	1363418396	/nfs/dbraw/zinc/41/83/96/1363418396.db2.gz	CZEWSHWEPLKPFB-DLBZAZTESA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@]1(C)CC=C(C)CC1)C[C@H](C)O2	ZINC001098660715	1363423744	/nfs/dbraw/zinc/42/37/44/1363423744.db2.gz	XARJRUOMCNTDEI-ICSRJNTNSA-N	0	3	346.515	3.391	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1CCCCC1(C)C)C[C@H](C)O2	ZINC001098664059	1363425550	/nfs/dbraw/zinc/42/55/50/1363425550.db2.gz	MNGRPWAIMANOQB-ZWKOTPCHSA-N	0	3	348.531	3.471	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CCC[C@]3(NC(=O)c3ccccc3)C2)c1	ZINC001098707066	1363442622	/nfs/dbraw/zinc/44/26/22/1363442622.db2.gz	WFXJGJQQWDKVMY-UNMCSNQZSA-N	0	3	345.446	3.343	20	30		EGEDHN
C=CCCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1snnc1C	ZINC001098873103	1363500305	/nfs/dbraw/zinc/50/03/05/1363500305.db2.gz	JOZRJJJVAFWYRW-CQSZACIVSA-N	0	3	336.505	3.033	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)C[C@@H]1C=CCC1	ZINC001098890338	1363507068	/nfs/dbraw/zinc/50/70/68/1363507068.db2.gz	YDLGYJMONXWIBW-QZTJIDSGSA-N	0	3	334.504	3.152	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H]2CCCc3ccccc32)C1	ZINC001098903546	1363512697	/nfs/dbraw/zinc/51/26/97/1363512697.db2.gz	UCVUIFUBKZRAAL-DWLFOUALSA-N	0	3	336.479	3.101	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(Cl)c(C)c2)C1	ZINC001099009498	1363571663	/nfs/dbraw/zinc/57/16/63/1363571663.db2.gz	BLVKZQGVGWVRQC-LPHOPBHVSA-N	0	3	330.859	3.256	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)Cc2ccc(F)cc2Cl)C1	ZINC001099013613	1363574424	/nfs/dbraw/zinc/57/44/24/1363574424.db2.gz	PHZFZBRMKWTSJV-KXBFYZLASA-N	0	3	348.849	3.016	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2oc(C3CC3)nc2C)C1	ZINC001099068996	1363605937	/nfs/dbraw/zinc/60/59/37/1363605937.db2.gz	IHDGCVNEQCRTPA-KXBFYZLASA-N	0	3	329.444	3.021	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)Cc2c(F)cccc2Cl)C1	ZINC001099133622	1363645163	/nfs/dbraw/zinc/64/51/63/1363645163.db2.gz	VEXWKHUGCCEORJ-LIRRHRJNSA-N	0	3	348.849	3.016	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)CCc1cncc(C)c1	ZINC001099135799	1363646698	/nfs/dbraw/zinc/64/66/98/1363646698.db2.gz	PZBNDXQUQHXFTD-GOSISDBHSA-N	0	3	329.488	3.115	20	30		EGEDHN
CN1CCC[C@H](CNC(=O)C#Cc2cccs2)[C@@H]1c1cccs1	ZINC001324476957	1387636025	/nfs/dbraw/zinc/63/60/25/1387636025.db2.gz	YRZGPCPBRTZJKC-RDTXWAMCSA-N	0	3	344.505	3.360	20	30		EGEDHN
C#CCCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(C)c(CC)s2)C1	ZINC001099152408	1363658769	/nfs/dbraw/zinc/65/87/69/1363658769.db2.gz	HNPUPCQAHZVUFA-KXBFYZLASA-N	0	3	330.497	3.227	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H]1CCC1(C)C	ZINC001099182897	1363678044	/nfs/dbraw/zinc/67/80/44/1363678044.db2.gz	PAOBEOABWPOGDS-IRXDYDNUSA-N	0	3	336.520	3.232	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@H]1CCC(C)(C)CN1CCOCC1CC1	ZINC001099189457	1363681277	/nfs/dbraw/zinc/68/12/77/1363681277.db2.gz	RTPUGPLPBJXRKY-IBGZPJMESA-N	0	3	348.531	3.213	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)Cc1c(F)cccc1F	ZINC001099200240	1363689320	/nfs/dbraw/zinc/68/93/20/1363689320.db2.gz	XLUNUOMWNCDSQA-AWEZNQCLSA-N	0	3	336.426	3.300	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)C1(C)CC=CC1	ZINC001099214962	1363695538	/nfs/dbraw/zinc/69/55/38/1363695538.db2.gz	ORRGCNGHQBUUSN-QGZVFWFLSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@H](C)c1ccco1	ZINC001099230557	1363704056	/nfs/dbraw/zinc/70/40/56/1363704056.db2.gz	UOEBOBYHLACFAN-SJORKVTESA-N	0	3	348.487	3.193	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@H]2CCC(C)(C)CN2CCOC(C)C)C1	ZINC001099230249	1363704151	/nfs/dbraw/zinc/70/41/51/1363704151.db2.gz	RUGOUVDFNSFIIM-KRWDZBQOSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2cc(C)c(C)o2)C[C@H]1C(F)(F)F	ZINC001099239247	1363707977	/nfs/dbraw/zinc/70/79/77/1363707977.db2.gz	GMBNMUAXXJCNEN-CHWSQXEVSA-N	0	3	330.350	3.065	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2ccc(Cl)cc2C)C[C@H]1C(F)(F)F	ZINC001099301671	1363738650	/nfs/dbraw/zinc/73/86/50/1363738650.db2.gz	MTLPCBRKKCLQPT-ZIAGYGMSSA-N	0	3	346.780	3.427	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@@H](C)c2cccc(C)c2)C[C@H]1C(F)(F)F	ZINC001099313107	1363744473	/nfs/dbraw/zinc/74/44/73/1363744473.db2.gz	RDTCSNSJJYXXNU-NUEKZKHPSA-N	0	3	340.389	3.263	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H](OC)C1CCCC1	ZINC001099323863	1363750318	/nfs/dbraw/zinc/75/03/18/1363750318.db2.gz	CAQMKSHRBQTEIS-QZTJIDSGSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)CCc1ccc(OC)cc1	ZINC001099328431	1363752728	/nfs/dbraw/zinc/75/27/28/1363752728.db2.gz	DNLRICJNZZOSRG-GOSISDBHSA-N	0	3	344.499	3.421	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)C2CCC(C3CC3)CC2)C[C@H]1C(F)(F)F	ZINC001099335802	1363757791	/nfs/dbraw/zinc/75/77/91/1363757791.db2.gz	BMFHPAJOVIDHFZ-QDIHITRGSA-N	0	3	344.421	3.368	20	30		EGEDHN
C=C[C@H](C(=O)NC[C@H]1CCC(C)(C)CN1CCOC)c1ccccc1	ZINC001099348732	1363764632	/nfs/dbraw/zinc/76/46/32/1363764632.db2.gz	LKVYLAFGNFFQPX-MOPGFXCFSA-N	0	3	344.499	3.209	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)COCCc1ccccc1	ZINC001099363626	1363774715	/nfs/dbraw/zinc/77/47/15/1363774715.db2.gz	AGOJYUSTDZNUHM-LJQANCHMSA-N	0	3	344.499	3.039	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NC[C@H]1CCC(C)(C)CN1Cc1ccccc1	ZINC001099365188	1363775392	/nfs/dbraw/zinc/77/53/92/1363775392.db2.gz	WYQYZXGTFRWXJJ-IEBWSBKVSA-N	0	3	344.499	3.385	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)CCSCC	ZINC001099424751	1363794511	/nfs/dbraw/zinc/79/45/11/1363794511.db2.gz	LJCYNJSYJMWSTA-JONQDZQNSA-N	0	3	342.936	3.051	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2nccs2)C1	ZINC001099487140	1363815819	/nfs/dbraw/zinc/81/58/19/1363815819.db2.gz	BUZQNQBTDYXZIY-IPELMVKDSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1(CCF)CC1	ZINC001099507264	1363824899	/nfs/dbraw/zinc/82/48/99/1363824899.db2.gz	ZKOYYNCEDSGYTD-FZKCQIBNSA-N	0	3	340.870	3.048	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CC(C)(C)CC)CC2(CCOCC2)C1	ZINC001099582992	1363864251	/nfs/dbraw/zinc/86/42/51/1363864251.db2.gz	GUCGLICCAUYCGS-QGZVFWFLSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)[C@H](CC)CC(C)C)CC2(CCOCC2)C1	ZINC001099597040	1363880099	/nfs/dbraw/zinc/88/00/99/1363880099.db2.gz	RDXONZVAEJYZBA-QZTJIDSGSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1CCN(Cc2ccccc2C(C)C)C[C@@H]1O	ZINC001099858426	1363966008	/nfs/dbraw/zinc/96/60/08/1363966008.db2.gz	LNMXASDYXRLEQE-PMACEKPBSA-N	0	3	344.499	3.218	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CCN(Cc2ccccc2C(C)C)C[C@H]1O	ZINC001099959107	1363991739	/nfs/dbraw/zinc/99/17/39/1363991739.db2.gz	CGSOSHPJKVPHJQ-RTBURBONSA-N	0	3	344.499	3.074	20	30		EGEDHN
C#CCCN1CC[C@@H](NC(=O)CCCCCCCCCC)[C@H](O)C1	ZINC001100082363	1364011715	/nfs/dbraw/zinc/01/17/15/1364011715.db2.gz	AQOWHNMRKCQLAF-RTBURBONSA-N	0	3	336.520	3.092	20	30		EGEDHN
C[C@H](C#N)C(=O)NCC1CC(NCc2c(Cl)oc3ccccc32)C1	ZINC001100196434	1364042213	/nfs/dbraw/zinc/04/22/13/1364042213.db2.gz	JQLISHZVOJDVLJ-PNESKVBLSA-N	0	3	345.830	3.230	20	30		EGEDHN
C=CCOCCCC(=O)NCC1CC(N[C@@H](C)c2ccccc2F)C1	ZINC001100217676	1364046212	/nfs/dbraw/zinc/04/62/12/1364046212.db2.gz	YKDUMZQONCRFMM-GTPINHCMSA-N	0	3	348.462	3.354	20	30		EGEDHN
CC(C)C#CC(=O)NCC1CC(NCc2ccc(Cl)cc2F)C1	ZINC001100309050	1364075817	/nfs/dbraw/zinc/07/58/17/1364075817.db2.gz	HCYPHYJMJOLHSB-UHFFFAOYSA-N	0	3	336.838	3.123	20	30		EGEDHN
CC(C)C#CC(=O)NCC1CC(N[C@@H]2CCc3c2c(F)ccc3F)C1	ZINC001100309139	1364076217	/nfs/dbraw/zinc/07/62/17/1364076217.db2.gz	JEQORNVBPFICPB-WTNGLUPJSA-N	0	3	346.421	3.096	20	30		EGEDHN
CC(C)c1cccc(CNC2CC(CNC(=O)C#CC(C)(C)C)C2)n1	ZINC001100317466	1364078839	/nfs/dbraw/zinc/07/88/39/1364078839.db2.gz	WKOXDFNZKLEMDM-UHFFFAOYSA-N	0	3	341.499	3.239	20	30		EGEDHN
C[C@]1(C(=O)NCC2CC(NCC#Cc3ccc(F)cc3)C2)C=CCC1	ZINC001100583642	1364174505	/nfs/dbraw/zinc/17/45/05/1364174505.db2.gz	XYYCDEDAASOFOX-XTXLOEGASA-N	0	3	340.442	3.018	20	30		EGEDHN
C=CCC1(C(=O)NCC2CC(NCc3ncccc3C)C2)CCC1	ZINC001100648694	1364204554	/nfs/dbraw/zinc/20/45/54/1364204554.db2.gz	SEFLEHUADCZVCZ-UHFFFAOYSA-N	0	3	327.472	3.121	20	30		EGEDHN
CCC[C@H](CC)C(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100798108	1364266561	/nfs/dbraw/zinc/26/65/61/1364266561.db2.gz	RAYWWGXICWYKHU-GPJFCIFZSA-N	0	3	326.484	3.349	20	30		EGEDHN
CCCCCCC(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100940991	1364339585	/nfs/dbraw/zinc/33/95/85/1364339585.db2.gz	KFGPHOWGVITNSV-UHFFFAOYSA-N	0	3	326.484	3.493	20	30		EGEDHN
C=CCC1(C(=O)NCC2CC(NCc3conc3C)C2)CCCCC1	ZINC001101016879	1364375383	/nfs/dbraw/zinc/37/53/83/1364375383.db2.gz	JZKIYTMYQXNCPY-UHFFFAOYSA-N	0	3	345.487	3.494	20	30		EGEDHN
C[C@H](CC(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1)C1CC1	ZINC001101042586	1364387461	/nfs/dbraw/zinc/38/74/61/1364387461.db2.gz	HVLWOISQTSZECD-XRTORIHISA-N	0	3	342.458	3.098	20	30		EGEDHN
C=CCC1(C(=O)NCC2CC(NCc3oc(C)nc3C)C2)CCCC1	ZINC001101080569	1364404315	/nfs/dbraw/zinc/40/43/15/1364404315.db2.gz	XPOJYIRJBDOXNQ-UHFFFAOYSA-N	0	3	345.487	3.412	20	30		EGEDHN
C=C(C)CN1CC[C@H](Oc2ccnc(CNC(=O)C(CC)CC)c2)C1	ZINC001101090562	1364408610	/nfs/dbraw/zinc/40/86/10/1364408610.db2.gz	MLIHRWYYMRFDEW-IBGZPJMESA-N	0	3	345.487	3.163	20	30		EGEDHN
C=C(C)CN1CC[C@@H](Oc2ccnc(CNC(=O)[C@@H](C)CCC)c2)C1	ZINC001101092795	1364409746	/nfs/dbraw/zinc/40/97/46/1364409746.db2.gz	XTIWTAPOOWPLAF-QFBILLFUSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=CCN1CC[C@H](Oc2ccnc(CNC(=O)CCC(C)(C)C)c2)C1	ZINC001101097058	1364412808	/nfs/dbraw/zinc/41/28/08/1364412808.db2.gz	ICEZLZJIPLJCSD-SFHVURJKSA-N	0	3	345.487	3.163	20	30		EGEDHN
CCCCC(=O)N1C[C@H]2CN(Cc3ccc(C#N)cc3)C[C@@]2(C)C1	ZINC001101129527	1364423057	/nfs/dbraw/zinc/42/30/57/1364423057.db2.gz	IDQJWEVXWRSXCD-QUCCMNQESA-N	0	3	325.456	3.029	20	30		EGEDHN
C=CCCC(=O)N1C[C@H]2CN(Cc3oc(CCC)nc3C)C[C@@]2(C)C1	ZINC001101167821	1364443540	/nfs/dbraw/zinc/44/35/40/1364443540.db2.gz	WAEDIULZNKICSZ-UZLBHIALSA-N	0	3	345.487	3.182	20	30		EGEDHN
CC#CCCCC(=O)N1C[C@H]2CN(Cc3ccccc3F)C[C@@]2(C)C1	ZINC001101332930	1364513062	/nfs/dbraw/zinc/51/30/62/1364513062.db2.gz	AUNVPZUOQOLYFI-NQIIRXRSSA-N	0	3	342.458	3.300	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@H]2CN(Cc3ncccc3C)C[C@@]2(C)C1	ZINC001101333351	1364513270	/nfs/dbraw/zinc/51/32/70/1364513270.db2.gz	REPMOOHVDJSEDO-UEXGIBASSA-N	0	3	341.499	3.273	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@H]2CN(Cc3cncc(C)c3)C[C@@]2(C)C1	ZINC001101337709	1364516182	/nfs/dbraw/zinc/51/61/82/1364516182.db2.gz	IYBITOXYIMBGDV-QFUCXCTJSA-N	0	3	341.499	3.273	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)CC(C)(C)CC(F)(F)F)C[C@]2(C)C1	ZINC001101445875	1364568018	/nfs/dbraw/zinc/56/80/18/1364568018.db2.gz	IVUSRPBQHBSZFB-PBHICJAKSA-N	0	3	344.421	3.159	20	30		EGEDHN
C=CCC[C@H](C)N1CC2(C1)C[C@H](NC(=O)/C=C(/C)CC)c1nccn12	ZINC001101627889	1364661722	/nfs/dbraw/zinc/66/17/22/1364661722.db2.gz	PSTWJNCBHWJYHG-VIVNAEHYSA-N	0	3	342.487	3.166	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CC2(CN(C[C@@H](C)CC)C2)n2ccnc21	ZINC001101630451	1364662314	/nfs/dbraw/zinc/66/23/14/1364662314.db2.gz	HOCUTZKRSMKJKK-JKSUJKDBSA-N	0	3	344.503	3.103	20	30		EGEDHN
C=CCC[C@H](C)N1CC2(C1)C[C@@H](NC(=O)C(C)(C)C=C)c1nccn12	ZINC001101637377	1364663716	/nfs/dbraw/zinc/66/37/16/1364663716.db2.gz	KQSFNIHYACIEMQ-JKSUJKDBSA-N	0	3	342.487	3.022	20	30		EGEDHN
C=CCCCCC[N@@H+]1C[C@@H](CNC(=O)c2ccccc2[O-])[C@H](C)C1	ZINC001101726973	1364705438	/nfs/dbraw/zinc/70/54/38/1364705438.db2.gz	AVLPXUYOQAIZFH-IAGOWNOFSA-N	0	3	330.472	3.436	20	30		EGEDHN
C=CCCCCC[N@H+]1C[C@@H](CNC(=O)c2ccccc2[O-])[C@H](C)C1	ZINC001101726973	1364705440	/nfs/dbraw/zinc/70/54/40/1364705440.db2.gz	AVLPXUYOQAIZFH-IAGOWNOFSA-N	0	3	330.472	3.436	20	30		EGEDHN
C=CC[C@@H]1NC(=O)N(C[C@@H](c2cccs2)N2CCC(C)CC2)C1=O	ZINC001324607267	1387695576	/nfs/dbraw/zinc/69/55/76/1387695576.db2.gz	HAKJOAJRFTZQTO-GJZGRUSLSA-N	0	3	347.484	3.018	20	30		EGEDHN
CC[C@H](C)C(=O)NC[C@@H]1CN(CC#Cc2cccc(Cl)c2)C[C@H]1C	ZINC001101731907	1364707068	/nfs/dbraw/zinc/70/70/68/1364707068.db2.gz	NJOHKFYQBPAANA-LZLYRXPVSA-N	0	3	346.902	3.422	20	30		EGEDHN
C=CCCC(=O)NC[C@@H]1CN(Cc2cccc(C(C)C)n2)C[C@H]1C	ZINC001101805321	1364733252	/nfs/dbraw/zinc/73/32/52/1364733252.db2.gz	NAZOSNMLJGYESL-IAGOWNOFSA-N	0	3	329.488	3.355	20	30		EGEDHN
CC[C@H](C)CC(=O)NC[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1C	ZINC001101918684	1364774062	/nfs/dbraw/zinc/77/40/62/1364774062.db2.gz	ZIRWKACJZJNONQ-YQVWRLOYSA-N	0	3	344.474	3.298	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@@H]1CN(Cc2oc(C)nc2C)C[C@H]1C	ZINC001102006750	1364809250	/nfs/dbraw/zinc/80/92/50/1364809250.db2.gz	RNXQRCCPLXZYAP-CZUORRHYSA-N	0	3	333.476	3.078	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H]1CN(Cc2cnc(C)s2)C[C@H]1C	ZINC001102219355	1364940094	/nfs/dbraw/zinc/94/00/94/1364940094.db2.gz	DFDHQCQLYXRGLQ-UKRRQHHQSA-N	0	3	335.517	3.238	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1CNC(=O)[C@]1(C)C=CCC1	ZINC001102246439	1364961462	/nfs/dbraw/zinc/96/14/62/1364961462.db2.gz	GWBIZTFPDTTZGT-SYYKKAFVSA-N	0	3	336.479	3.079	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001102297159	1364988948	/nfs/dbraw/zinc/98/89/48/1364988948.db2.gz	LYKQCQFNEYLZPV-HUUCEWRRSA-N	0	3	331.485	3.160	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H]1CN(Cc2cccc(OCC)n2)C[C@H]1C	ZINC001102297380	1364989025	/nfs/dbraw/zinc/98/90/25/1364989025.db2.gz	XVWHEFXGJWIEQT-IAGOWNOFSA-N	0	3	345.487	3.021	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H]2CN(Cc3c(C)noc3C)C[C@H]2C)CCC1	ZINC001102330347	1365005132	/nfs/dbraw/zinc/00/51/32/1365005132.db2.gz	QEPBVHAOIWXLKS-RHSMWYFYSA-N	0	3	345.487	3.222	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@H]2CN(Cc3oc(CC)nc3C)C[C@H]2C)C1	ZINC001102349602	1365015835	/nfs/dbraw/zinc/01/58/35/1365015835.db2.gz	LXRGKYAFSMUTTE-GDBMZVCRSA-N	0	3	345.487	3.086	20	30		EGEDHN
CC(C)C[C@H](C)C(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001102484931	1365081971	/nfs/dbraw/zinc/08/19/71/1365081971.db2.gz	CNHDZXFCRMAYIB-ARFHVFGLSA-N	0	3	347.528	3.486	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccc(Cl)cc2)C[C@H]1CCNC(=O)C1CC1	ZINC001102631229	1365143561	/nfs/dbraw/zinc/14/35/61/1365143561.db2.gz	SUKGDXYEYIDFAE-CRAIPNDOSA-N	0	3	344.886	3.176	20	30		EGEDHN
CC[C@@H](C)C(=O)NCC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001102678300	1365166581	/nfs/dbraw/zinc/16/65/81/1365166581.db2.gz	RPKNHDGHOGXDQG-RBSFLKMASA-N	0	3	333.501	3.240	20	30		EGEDHN
CC[C@H](C)C(=O)NCC[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1C	ZINC001102678082	1365166739	/nfs/dbraw/zinc/16/67/39/1365166739.db2.gz	NOCWVLWSHOCLJE-ZMSDIMECSA-N	0	3	345.462	3.318	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1CCNC(=O)/C=C\C1CC1	ZINC001102822211	1365236202	/nfs/dbraw/zinc/23/62/02/1365236202.db2.gz	HBLHJDFTSUXNEE-BUFKOALHSA-N	0	3	337.467	3.099	20	30		EGEDHN
C/C=C(\C)C(=O)NCC[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1C	ZINC001102842185	1365247338	/nfs/dbraw/zinc/24/73/38/1365247338.db2.gz	RSWBLBINLUATPM-MCNOKXGWSA-N	0	3	342.458	3.218	20	30		EGEDHN
C#CCCCC(=O)NCC[C@@H]1CN(Cc2ccncc2Cl)C[C@H]1C	ZINC001102917154	1365290666	/nfs/dbraw/zinc/29/06/66/1365290666.db2.gz	PKMVNTBWYKABGV-HZPDHXFCSA-N	0	3	347.890	3.113	20	30		EGEDHN
C=C(C)CCC(=O)NCC[C@@H]1CN([C@H](C)c2ncc(C)o2)C[C@H]1C	ZINC001103040436	1365351633	/nfs/dbraw/zinc/35/16/33/1365351633.db2.gz	WJHKLTPAORQQBE-DJIMGWMZSA-N	0	3	333.476	3.475	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)[C@@H]2CCC(F)(F)C2)C1	ZINC001103068121	1365362862	/nfs/dbraw/zinc/36/28/62/1365362862.db2.gz	ARVKFLIQCNYKDC-MRVWCRGKSA-N	0	3	334.838	3.249	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cc3cnccc3o2)C1	ZINC001103192414	1365428858	/nfs/dbraw/zinc/42/88/58/1365428858.db2.gz	QUVJWGHFSVFEAN-TZMCWYRMSA-N	0	3	347.846	3.268	20	30		EGEDHN
CC(C)SCC(=O)N1CC[C@](C)(CNCc2ccccc2C#N)C1	ZINC001324695916	1387741268	/nfs/dbraw/zinc/74/12/68/1387741268.db2.gz	UCJNRESWSQPMLQ-LJQANCHMSA-N	0	3	345.512	3.028	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2ccn3ccccc23)C1	ZINC001103217352	1365439127	/nfs/dbraw/zinc/43/91/27/1365439127.db2.gz	CKAABNIOYXOJIC-GDBMZVCRSA-N	0	3	345.874	3.380	20	30		EGEDHN
CC[C@H](F)C(=O)NCC[C@@H]1CN(Cc2cc(C#N)ccc2F)C[C@H]1C	ZINC001103320103	1365491521	/nfs/dbraw/zinc/49/15/21/1365491521.db2.gz	MHYJGNYMOAZZBE-UNEWFSDZSA-N	0	3	349.425	3.020	20	30		EGEDHN
C=C[C@H](CC(=O)NCC[C@@H]1CN(CCF)C[C@H]1C)c1ccccc1	ZINC001103744590	1365760462	/nfs/dbraw/zinc/76/04/62/1365760462.db2.gz	ITTWIRJUYNHZPH-ZHALLVOQSA-N	0	3	332.463	3.390	20	30		EGEDHN
CC[C@@H](C)C(=O)N1C[C@@H](C)[C@H](CCNCc2ccc(C#N)cc2F)C1	ZINC001103904555	1365829159	/nfs/dbraw/zinc/82/91/59/1365829159.db2.gz	IYRXQWLYHPDMQX-IIDMSEBBSA-N	0	3	345.462	3.318	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CN(C(=O)/C(C)=C/CC)C[C@H]1C	ZINC001103946018	1365843242	/nfs/dbraw/zinc/84/32/42/1365843242.db2.gz	IJISIIVCAWPKTF-DUCLZDJCSA-N	0	3	343.309	3.326	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@H](CCNCc2cccc(Cl)n2)C1	ZINC001103979509	1365857593	/nfs/dbraw/zinc/85/75/93/1365857593.db2.gz	UJVZOKRSUUZHQR-HUUCEWRRSA-N	0	3	335.879	3.275	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CN(C(=O)CCC2CC2)C[C@H]1C	ZINC001104014870	1365874408	/nfs/dbraw/zinc/87/44/08/1365874408.db2.gz	ZBDMMLUENRUFPY-IUODEOHRSA-N	0	3	343.309	3.159	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)C2(COC)CCCC2)C[C@H]1C	ZINC001104268096	1365972738	/nfs/dbraw/zinc/97/27/38/1365972738.db2.gz	UFAHYGVQOYFBCF-GDBMZVCRSA-N	0	3	342.911	3.020	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cc3cnccc3o2)C[C@H]1C	ZINC001104389033	1365999344	/nfs/dbraw/zinc/99/93/44/1365999344.db2.gz	DMWFNSMDWJZUME-TZMCWYRMSA-N	0	3	347.846	3.268	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)[C@H](CCNCc2nc(C)cs2)C1	ZINC001104491816	1366046502	/nfs/dbraw/zinc/04/65/02/1366046502.db2.gz	DAEPDRLYLQYUIQ-UKRRQHHQSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)[C@H](CCNCc2conc2CC)C1	ZINC001104492174	1366046598	/nfs/dbraw/zinc/04/65/98/1366046598.db2.gz	SCNVQMRZSCKZQD-HUUCEWRRSA-N	0	3	333.476	3.023	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H](C)[C@H](CCNCc2cc(C)no2)C1	ZINC001104631626	1366110758	/nfs/dbraw/zinc/11/07/58/1366110758.db2.gz	VIWSNEQLNCPCKI-IDHHARJASA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2ccc3c(c2)COC3)C[C@H]1C	ZINC001104785901	1366172320	/nfs/dbraw/zinc/17/23/20/1366172320.db2.gz	IXTDHHKNQBHCJQ-CZUORRHYSA-N	0	3	348.874	3.157	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)[C@H]2[C@H]3[C@@H]2[C@@H]2CC[C@H]3C2)C[C@H]1C	ZINC001105084067	1366316806	/nfs/dbraw/zinc/31/68/06/1366316806.db2.gz	LTTCOAGQQXBBSQ-HFFDDPIYSA-N	0	3	336.907	3.105	20	30		EGEDHN
CCCCCCCNCc1cn(C2CN(C(=O)[C@H](C)C(C)C)C2)nn1	ZINC001105336286	1366423164	/nfs/dbraw/zinc/42/31/64/1366423164.db2.gz	BOFQCXJTQURUPT-MRXNPFEDSA-N	0	3	349.523	3.014	20	30		EGEDHN
CCCCCCCCC(=O)N1CC(n2cc(CNCC(C)C)nn2)C1	ZINC001105366542	1366428811	/nfs/dbraw/zinc/42/88/11/1366428811.db2.gz	VNSRJQIRXCZNOD-UHFFFAOYSA-N	0	3	349.523	3.158	20	30		EGEDHN
C=CCC[C@H](C)NCc1cn(C2CN(C(=O)CCCCCC)C2)nn1	ZINC001105370122	1366429260	/nfs/dbraw/zinc/42/92/60/1366429260.db2.gz	XLGRSWAANGYJBQ-INIZCTEOSA-N	0	3	347.507	3.076	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@H](C)CC(F)F)CC1	ZINC001105394243	1366443425	/nfs/dbraw/zinc/44/34/25/1366443425.db2.gz	RNSPUTQMSGZJHL-PBHICJAKSA-N	0	3	338.442	3.004	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C2(CCC=C)CC2)CC1	ZINC001105396696	1366445123	/nfs/dbraw/zinc/44/51/23/1366445123.db2.gz	SRMWIXZOMMUTCG-IBGZPJMESA-N	0	3	340.511	3.459	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@@H](CNCc2nc(C)cs2)[C@H](C)C1	ZINC001106567395	1366739497	/nfs/dbraw/zinc/73/94/97/1366739497.db2.gz	GCZLTYUIPSICMV-VNQPRFMTSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](CNCc2cc(F)ccc2C#N)[C@H](C)C1	ZINC001106606651	1366753500	/nfs/dbraw/zinc/75/35/00/1366753500.db2.gz	KIYJQGKZQNHJJO-CRAIPNDOSA-N	0	3	343.446	3.238	20	30		EGEDHN
CC(C)C[C@H](C)C(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001106807703	1366805394	/nfs/dbraw/zinc/80/53/94/1366805394.db2.gz	ZAJKACIFPMYSIR-SQGPQFPESA-N	0	3	341.499	3.425	20	30		EGEDHN
C=CCOCCCC(=O)NC[C@]12CCC[C@H]1N(C/C=C\Cl)CC2	ZINC001107350572	1366937646	/nfs/dbraw/zinc/93/76/46/1366937646.db2.gz	KZSGJVQQZBVWPT-LCNOEYSYSA-N	0	3	340.895	3.083	20	30		EGEDHN
C=CCCOCCCCC(=O)NC[C@]12CCC[C@H]1N(CCF)CC2	ZINC001107404767	1366953551	/nfs/dbraw/zinc/95/35/51/1366953551.db2.gz	MWDGTYGJXGJAAK-IEBWSBKVSA-N	0	3	340.483	3.080	20	30		EGEDHN
CC[C@@H](F)C(=O)NC[C@]12CCC[C@H]1N(Cc1ccc(C#N)s1)CC2	ZINC001107507557	1367008003	/nfs/dbraw/zinc/00/80/03/1367008003.db2.gz	CZANBQPHOFNWKZ-JFIYKMOQSA-N	0	3	349.475	3.229	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@]12CCC[C@H]1N(Cc1conc1C)CC2	ZINC001107514502	1367013221	/nfs/dbraw/zinc/01/32/21/1367013221.db2.gz	JKTORHZGIGEWSO-XFQXTVEOSA-N	0	3	345.487	3.446	20	30		EGEDHN
O=C(C#CC1CC1)N[C@H]1C[C@H]2CC[C@@H]1N2CCc1ccc(Cl)cc1	ZINC001109257665	1367028993	/nfs/dbraw/zinc/02/89/93/1367028993.db2.gz	HSMBCEHBBXHSCQ-QYZOEREBSA-N	0	3	342.870	3.017	20	30		EGEDHN
C=CCOCCCC(=O)N1CC[C@@H](N(C)[C@@H](C)c2ccc(F)cc2)C1	ZINC001189526855	1367045359	/nfs/dbraw/zinc/04/53/59/1367045359.db2.gz	KFIWIYQKCJCQPE-QFBILLFUSA-N	0	3	348.462	3.402	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](N(C)CCOC2CCCCCC2)C1	ZINC001189925369	1367132867	/nfs/dbraw/zinc/13/28/67/1367132867.db2.gz	AURCENMIRPCLQR-GOSISDBHSA-N	0	3	334.504	3.062	20	30		EGEDHN
C=CCCC(=O)NC[C@]1(C)CN(CC2CCC(C)(C)CC2)CCO1	ZINC001107801829	1367152782	/nfs/dbraw/zinc/15/27/82/1367152782.db2.gz	BWNDUGKRHIFKQJ-HXUWFJFHSA-N	0	3	336.520	3.376	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@]1(C)CN(CC2CCC(C)CC2)CCO1	ZINC001107882711	1367190920	/nfs/dbraw/zinc/19/09/20/1367190920.db2.gz	AJTYEBUQYOQZAJ-GRERDSQWSA-N	0	3	348.531	3.213	20	30		EGEDHN
CC(C)(C)C#CC(=O)NC[C@@]1(C)CN(CC2CCCCCC2)CCO1	ZINC001107934504	1367210614	/nfs/dbraw/zinc/21/06/14/1367210614.db2.gz	DFCUUONFJWHPAV-NRFANRHFSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2cccc(C)c2F)C1	ZINC001107961124	1367218745	/nfs/dbraw/zinc/21/87/45/1367218745.db2.gz	SOCIYVRDUWCQLJ-OXQOHEQNSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2scc(C)c2Cl)C1	ZINC001190320032	1367226161	/nfs/dbraw/zinc/22/61/61/1367226161.db2.gz	VIYDUZSQWFEWSG-CYBMUJFWSA-N	0	3	342.892	3.059	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CC[C@@H](N(C)Cc2cccc(F)c2)C1)OCC	ZINC001190443145	1367266869	/nfs/dbraw/zinc/26/68/69/1367266869.db2.gz	FGYPMIKVQUEXFG-RTBURBONSA-N	0	3	348.462	3.230	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCc1scnc1C	ZINC001109657581	1367267776	/nfs/dbraw/zinc/26/77/76/1367267776.db2.gz	VOUGISPHOBXXRU-PMPSAXMXSA-N	0	3	333.501	3.072	20	30		EGEDHN
CC[C@@H](CC(F)F)C(=O)N1CC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001190614396	1367308873	/nfs/dbraw/zinc/30/88/73/1367308873.db2.gz	YHCZUIVNNQNJIH-DLBZAZTESA-N	0	3	349.425	3.272	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@]2(C)CN(CCC(C)(C)C)CCO2)CCC1	ZINC001108188545	1367331774	/nfs/dbraw/zinc/33/17/74/1367331774.db2.gz	UXRNFWGBJVSHMP-IBGZPJMESA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CC1(CC(=O)N[C@H]2C[C@H]3CC[C@@H]2N3C[C@H](C)OC)CCCCC1	ZINC001109830068	1367345011	/nfs/dbraw/zinc/34/50/11/1367345011.db2.gz	KGGOVBPNCCPIFZ-MHORFTMASA-N	0	3	334.504	3.269	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2c(C)cccc2C)C1	ZINC001108236383	1367353605	/nfs/dbraw/zinc/35/36/05/1367353605.db2.gz	KQJJSGQXJAQSLB-WIYYLYMNSA-N	0	3	344.499	3.479	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2cc(C)ccc2F)C1	ZINC001108241589	1367356302	/nfs/dbraw/zinc/35/63/02/1367356302.db2.gz	FGGBIRJTHGGUFU-UZLBHIALSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1CC[C@H](N(C)CC=C(C)C)C1	ZINC001190973065	1367392901	/nfs/dbraw/zinc/39/29/01/1367392901.db2.gz	JUXDVMAZYIUWGT-KRWDZBQOSA-N	0	3	328.456	3.364	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2ccc(CC)cc2)C1	ZINC001108374390	1367422005	/nfs/dbraw/zinc/42/20/05/1367422005.db2.gz	KUIUYGFDUIPSCW-UTKZUKDTSA-N	0	3	344.499	3.424	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2ccc(F)s2)C1	ZINC001108437985	1367457559	/nfs/dbraw/zinc/45/75/59/1367457559.db2.gz	RUKHQMNOXPULBP-SUMWQHHRSA-N	0	3	340.464	3.063	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2ccc(F)s2)C1	ZINC001108437983	1367457636	/nfs/dbraw/zinc/45/76/36/1367457636.db2.gz	RUKHQMNOXPULBP-DYVFJYSZSA-N	0	3	340.464	3.063	20	30		EGEDHN
C=CCCCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc(Cl)no1)C2	ZINC001110012062	1367458222	/nfs/dbraw/zinc/45/82/22/1367458222.db2.gz	JFZQVGXZZDXXNG-RDBSUJKOSA-N	0	3	337.851	3.410	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCCc1sccc1C)C2	ZINC001110044168	1367479631	/nfs/dbraw/zinc/47/96/31/1367479631.db2.gz	YYCWLOTXGBLAPX-IKGGRYGDSA-N	0	3	330.497	3.124	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](C)CCCc1ccccc1)C2	ZINC001110172514	1367543801	/nfs/dbraw/zinc/54/38/01/1367543801.db2.gz	AIALQLOBUFJOHK-NRDMVMEKSA-N	0	3	338.495	3.390	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](N(C)CCOc2ccccc2)C1	ZINC001191765066	1367581735	/nfs/dbraw/zinc/58/17/35/1367581735.db2.gz	YEULBOVUIFQMAG-LJQANCHMSA-N	0	3	342.483	3.182	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H](N(C)CCc2csc(C)n2)C1	ZINC001191868100	1367620977	/nfs/dbraw/zinc/62/09/77/1367620977.db2.gz	NZOVHPJYZQFNEF-PBHICJAKSA-N	0	3	335.517	3.129	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](N(C)Cc2ccc(OC)c(C)c2)C1	ZINC001191868338	1367621712	/nfs/dbraw/zinc/62/17/12/1367621712.db2.gz	RUYGCMRRRMJKHD-IBGZPJMESA-N	0	3	342.483	3.230	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](N(C)Cc2ccc(OC)c(C)c2)C1	ZINC001192093749	1367685961	/nfs/dbraw/zinc/68/59/61/1367685961.db2.gz	MDBPTFMBDMAOPO-GOSISDBHSA-N	0	3	330.472	3.393	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](N(C)CCOc2ccc(C)cc2)C1	ZINC001192093933	1367686388	/nfs/dbraw/zinc/68/63/88/1367686388.db2.gz	OERWUYOMBCRNQZ-SFHVURJKSA-N	0	3	330.472	3.263	20	30		EGEDHN
C#CCN(C)CCCNC(=O)/C=C\c1cc(Cl)cc(Cl)c1	ZINC001325062433	1387893703	/nfs/dbraw/zinc/89/37/03/1387893703.db2.gz	CIPIYNOLVDNLOA-WAYWQWQTSA-N	0	3	325.239	3.078	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CC1=CCCCC1	ZINC001109038742	1367734709	/nfs/dbraw/zinc/73/47/09/1367734709.db2.gz	YIYFWVRONLEXRX-NQYYFHDYSA-N	0	3	332.488	3.190	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)c1csc(C#N)c1)c1ccsc1	ZINC001325103743	1387898933	/nfs/dbraw/zinc/89/89/33/1387898933.db2.gz	KHRNMYZILXKWMQ-OAHLLOKOSA-N	0	3	333.482	3.494	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001192585963	1367825747	/nfs/dbraw/zinc/82/57/47/1367825747.db2.gz	GBLOWWSIGYSELY-GOSISDBHSA-N	0	3	325.456	3.193	20	30		EGEDHN
C=CCC[C@@H](C)N1[C@@H]2CC[C@H]1[C@H](NC(=O)c1snnc1C1CC1)C2	ZINC001110688553	1367928490	/nfs/dbraw/zinc/92/84/90/1367928490.db2.gz	PMBJJYBPRJYFJS-NGFQHRJXSA-N	0	3	346.500	3.105	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)C[C@@H]2CCCC(C)(C)C2)C1	ZINC001193461125	1368035314	/nfs/dbraw/zinc/03/53/14/1368035314.db2.gz	FIXGUQZIHYTGLL-ZWKOTPCHSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)[C@@H](F)CC2CCCCC2)C1	ZINC001193468830	1368038566	/nfs/dbraw/zinc/03/85/66/1368038566.db2.gz	IUYKVDAHFRFZKY-MSOLQXFVSA-N	0	3	340.483	3.030	20	30		EGEDHN
CC1(C)CN(C[C@@H](O)c2cccc(C#N)c2)C[C@]2(C[C@@H]3CC[C@H]2C3)O1	ZINC001193818025	1368122028	/nfs/dbraw/zinc/12/20/28/1368122028.db2.gz	GCSKSTZCZABZTF-LKRGOLFISA-N	0	3	340.467	3.261	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CC1CC(F)(F)C1	ZINC001110984406	1368132679	/nfs/dbraw/zinc/13/26/79/1368132679.db2.gz	GMKWJBIZQOIJQI-AIANPOQGSA-N	0	3	326.431	3.356	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](C)c1cccc(C)c1)C2	ZINC001111071077	1368151596	/nfs/dbraw/zinc/15/15/96/1368151596.db2.gz	PCXBZNVMADDHAQ-NBYUQASBSA-N	0	3	342.483	3.023	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](c1cccnc1)C(C)C)C2	ZINC001111184983	1368181961	/nfs/dbraw/zinc/18/19/61/1368181961.db2.gz	NGKLHRNLAWZYNL-YRXWBPOGSA-N	0	3	327.472	3.119	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3C[C@@H](CC)OC)CCCCC1	ZINC001111483451	1368319025	/nfs/dbraw/zinc/31/90/25/1368319025.db2.gz	FGPZGUIXPKEUGB-MKXGPGLRSA-N	0	3	346.515	3.107	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3C[C@H]2CCCCO2)CCCC1	ZINC001111522835	1368324208	/nfs/dbraw/zinc/32/42/08/1368324208.db2.gz	LDFBDFNTVIVMAP-MKXGPGLRSA-N	0	3	346.515	3.414	20	30		EGEDHN
CC(C)C#CC(=O)N[C@]12CCC[C@H]1CN(C/C=C/c1ccccc1)C2	ZINC001111735704	1368434755	/nfs/dbraw/zinc/43/47/55/1368434755.db2.gz	MCZGASJTVLYEQI-RSDUVYJRSA-N	0	3	336.479	3.330	20	30		EGEDHN
C=CCOCCCC(=O)N1CCCN(Cc2ccccc2CC)CC1	ZINC001195452621	1368439209	/nfs/dbraw/zinc/43/92/09/1368439209.db2.gz	QQDCXZIBLVEZDW-UHFFFAOYSA-N	0	3	344.499	3.266	20	30		EGEDHN
Cc1ccc(C)c(CN2CCCN(C(=O)C#CC(C)(C)C)CC2)c1	ZINC001195785851	1368490214	/nfs/dbraw/zinc/49/02/14/1368490214.db2.gz	YSDFRCRSNGFANT-UHFFFAOYSA-N	0	3	326.484	3.387	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H](CCC)c2ccccn2)C1	ZINC001111853339	1368506474	/nfs/dbraw/zinc/50/64/74/1368506474.db2.gz	ULBLKONSKGAXIZ-QKLQHJQFSA-N	0	3	327.472	3.122	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2CN(CCC3CCCCCC3)C[C@H]2O)CC1	ZINC001195905931	1368513837	/nfs/dbraw/zinc/51/38/37/1368513837.db2.gz	GCSQCIBGZKJHMF-RTBURBONSA-N	0	3	348.531	3.255	20	30		EGEDHN
C=C(C)CCC(=O)N1CCCN(C[C@@H](Cc2ccccc2)OC)CC1	ZINC001196018180	1368536977	/nfs/dbraw/zinc/53/69/77/1368536977.db2.gz	MRIWHLNQAMJRMI-HXUWFJFHSA-N	0	3	344.499	3.135	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)CCCc2cccs2)C1	ZINC001111971438	1368581095	/nfs/dbraw/zinc/58/10/95/1368581095.db2.gz	DACLFVLDHUKMQQ-LPHOPBHVSA-N	0	3	330.497	3.065	20	30		EGEDHN
C=C[C@H](CC(=O)N[C@]12CCC[C@H]1CN(CC#CC)C2)c1ccccc1	ZINC001111999712	1368603764	/nfs/dbraw/zinc/60/37/64/1368603764.db2.gz	XNLBRDRBORINGW-CBQOVEMMSA-N	0	3	336.479	3.340	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H](C)Cc2ccccc2C)C1	ZINC001112014454	1368618675	/nfs/dbraw/zinc/61/86/75/1368618675.db2.gz	SPKMSVUDLYMZAH-CBQOVEMMSA-N	0	3	338.495	3.168	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N1CCCN(CC/C=C/CCC)CC1	ZINC001196665779	1368658605	/nfs/dbraw/zinc/65/86/05/1368658605.db2.gz	GSPYHAJSULIYHX-IBDYFIJFSA-N	0	3	336.520	3.496	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)N1CCCN(CCCOc2ccccc2)CC1	ZINC001196829680	1368692700	/nfs/dbraw/zinc/69/27/00/1368692700.db2.gz	HIRIQBXBEXQJSG-RBUKOAKNSA-N	0	3	344.499	3.448	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)C[C@H](C)CC(C)(C)C)C[C@H]1C(F)(F)F	ZINC001112169970	1368698347	/nfs/dbraw/zinc/69/83/47/1368698347.db2.gz	AAMWTNIPKNABOH-RRFJBIMHSA-N	0	3	346.437	3.451	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)C2(CC)CCCCC2)C[C@H]1C(F)(F)F	ZINC001112210165	1368719356	/nfs/dbraw/zinc/71/93/56/1368719356.db2.gz	ZHJDBCDEAHVRDA-HUUCEWRRSA-N	0	3	344.421	3.349	20	30		EGEDHN
C#CCC1(C(=O)N2C[C@@H](C(F)(F)F)[C@H](NCC=C)C2)CCCCC1	ZINC001112214367	1368722193	/nfs/dbraw/zinc/72/21/93/1368722193.db2.gz	WOSFSYQGBXKCIG-HUUCEWRRSA-N	0	3	342.405	3.125	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCCN(CCc2ccc(OC)cc2)CC1	ZINC001197278278	1368778574	/nfs/dbraw/zinc/77/85/74/1368778574.db2.gz	QXLISVAWEIVGMD-UHFFFAOYSA-N	0	3	344.499	3.374	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cnn(CCC)c2)CC1	ZINC001197283271	1368779593	/nfs/dbraw/zinc/77/95/93/1368779593.db2.gz	JAHCABBWWSFNES-UHFFFAOYSA-N	0	3	332.492	3.187	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@@H]2CCC[C@]2(CNCc2cnc(C)o2)C1	ZINC001112515228	1368909439	/nfs/dbraw/zinc/90/94/39/1368909439.db2.gz	ZABZHFBRURGEPI-ZWOKBUDYSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2cscn2)C1	ZINC001112515620	1368910008	/nfs/dbraw/zinc/91/00/08/1368910008.db2.gz	UHZHEDVKLQZLOM-GJYPPUQNSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)C(=O)N1CCCN(CCCF)CC1	ZINC001198197505	1368978651	/nfs/dbraw/zinc/97/86/51/1368978651.db2.gz	PAGDNNSHBIAUCB-IBGZPJMESA-N	0	3	332.463	3.315	20	30		EGEDHN
C#CCCN1CCCN(C(=O)CCC(C)(C)c2ccccc2)CC1	ZINC001198363664	1369015766	/nfs/dbraw/zinc/01/57/66/1369015766.db2.gz	GNYMAVLQMCRYRT-UHFFFAOYSA-N	0	3	326.484	3.302	20	30		EGEDHN
C=CCC[C@H](C(=O)N1CCCN([C@H](C)COC)CC1)c1ccccc1	ZINC001198411260	1369026225	/nfs/dbraw/zinc/02/62/25/1369026225.db2.gz	NZFUMSVOQHAATB-QUCCMNQESA-N	0	3	344.499	3.306	20	30		EGEDHN
C=CCC[C@H](C)N[C@@H](CNC(=O)CSC)c1ccccc1OC	ZINC001198516217	1369050528	/nfs/dbraw/zinc/05/05/28/1369050528.db2.gz	VTLRDWRWBQRXCG-HOCLYGCPSA-N	0	3	336.501	3.160	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)c1ccc[nH]1)c1ccccc1OC	ZINC001198522211	1369051467	/nfs/dbraw/zinc/05/14/67/1369051467.db2.gz	JESDYZPYCAIHGJ-QGZVFWFLSA-N	0	3	327.428	3.050	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)c1cccn1C)c1ccccc1OC	ZINC001198530040	1369054573	/nfs/dbraw/zinc/05/45/73/1369054573.db2.gz	MLNCYAJJUZQZML-KRWDZBQOSA-N	0	3	341.455	3.061	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)[C@H](C)SC)c1ccccc1OC	ZINC001198555409	1369060358	/nfs/dbraw/zinc/06/03/58/1369060358.db2.gz	UQLCTSFTECNKRI-GOEBONIOSA-N	0	3	336.501	3.160	20	30		EGEDHN
C=CCC[C@H](C)N[C@H](CNC(=O)CCCOC)c1ccccc1OC	ZINC001198567240	1369062149	/nfs/dbraw/zinc/06/21/49/1369062149.db2.gz	NWOQVDFUJJZLBQ-FUHWJXTLSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@H](C)OCC(C)C)c1ccccc1OC	ZINC001198577358	1369064248	/nfs/dbraw/zinc/06/42/48/1369064248.db2.gz	IXYSNYPOZZGOAS-WMZOPIPTSA-N	0	3	348.487	3.079	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)CC(F)(F)F)c1ccccc1OC	ZINC001198585716	1369066989	/nfs/dbraw/zinc/06/69/89/1369066989.db2.gz	YYAGBYNMHXHNKE-AWEZNQCLSA-N	0	3	344.377	3.361	20	30		EGEDHN
C=CCC[C@H](C)N[C@H](CNC(=O)c1cocn1)c1ccccc1OC	ZINC001198605056	1369070910	/nfs/dbraw/zinc/07/09/10/1369070910.db2.gz	DMTLSLGKXZFFMS-GOEBONIOSA-N	0	3	343.427	3.099	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)c1ocnc1C)c1ccccc1OC	ZINC001198646085	1369080435	/nfs/dbraw/zinc/08/04/35/1369080435.db2.gz	COBWEWNEUFVVNI-INIZCTEOSA-N	0	3	343.427	3.019	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)[C@H](C)C1CC1)c1ccccc1OC	ZINC001198647882	1369081161	/nfs/dbraw/zinc/08/11/61/1369081161.db2.gz	RCYYFOZLBYSJDQ-CRAIPNDOSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)[C@H]1[C@@H]2CCC[C@@H]21)c1ccccc1OC	ZINC001198647428	1369081751	/nfs/dbraw/zinc/08/17/51/1369081751.db2.gz	NVDKZCHSYZBDAO-WBQJQJEBSA-N	0	3	342.483	3.454	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)[C@H](C)C1CC1)c1ccccc1OC	ZINC001198647374	1369081756	/nfs/dbraw/zinc/08/17/56/1369081756.db2.gz	MTGVPTDIDLITSM-QAPCUYQASA-N	0	3	330.472	3.454	20	30		EGEDHN
COc1ccccc1[C@H](CNC(=O)C#CC1CC1)NCCCC(C)C	ZINC001198723021	1369099312	/nfs/dbraw/zinc/09/93/12/1369099312.db2.gz	AGCBXLJIISQHIJ-IBGZPJMESA-N	0	3	342.483	3.292	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@H](NCCCF)c1ccccc1OC	ZINC001198740864	1369103307	/nfs/dbraw/zinc/10/33/07/1369103307.db2.gz	GZCMTRCYYXUJFY-INIZCTEOSA-N	0	3	336.451	3.404	20	30		EGEDHN
C#CCC1(C(=O)NC[C@@H](NCCC=C)c2ccccc2OC)CCC1	ZINC001198752632	1369104976	/nfs/dbraw/zinc/10/49/76/1369104976.db2.gz	ROVZUXFXBQRBHQ-GOSISDBHSA-N	0	3	340.467	3.212	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@H](NCCCOCC)c1ccccc1OC	ZINC001198834264	1369125297	/nfs/dbraw/zinc/12/52/97/1369125297.db2.gz	KMHQHKXURZWRGZ-KRWDZBQOSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)Cc2cccc3cnccc32)CC1	ZINC001113012296	1369135850	/nfs/dbraw/zinc/13/58/50/1369135850.db2.gz	OJRUYRBAYVIBCL-QGZVFWFLSA-N	0	3	337.467	3.276	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)CC(C)(F)F)c1ccccc1OC	ZINC001198885342	1369139378	/nfs/dbraw/zinc/13/93/78/1369139378.db2.gz	DXSQUGKEKAGWTG-OAHLLOKOSA-N	0	3	340.414	3.454	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@H](NCCCOC)c1ccccc1OC	ZINC001198916976	1369149100	/nfs/dbraw/zinc/14/91/00/1369149100.db2.gz	YWHRAEQDUFIUJE-KRWDZBQOSA-N	0	3	348.487	3.081	20	30		EGEDHN
CC(C)[C@H](C)CC(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001199742064	1369266076	/nfs/dbraw/zinc/26/60/76/1369266076.db2.gz	SFJQIJKQKXWLMU-MRXNPFEDSA-N	0	3	327.472	3.321	20	30		EGEDHN
CC(C)(C#N)c1ccc(NC(=S)NCCN2CCCCC2)cc1	ZINC001200431273	1369366999	/nfs/dbraw/zinc/36/69/99/1369366999.db2.gz	SPJUNUFQAWSBRG-UHFFFAOYSA-N	0	3	330.501	3.260	20	30		EGEDHN
C=CC1(CC(=O)N2CCN(C[C@@H]3CCO[C@@H](C)C3)CC2)CCCCC1	ZINC001113428273	1369421095	/nfs/dbraw/zinc/42/10/95/1369421095.db2.gz	NWCFHCQTLCEZHB-RBUKOAKNSA-N	0	3	348.531	3.472	20	30		EGEDHN
C#CCNC[C@@H]1CN(C(=O)[C@H](CCC)CC2CCCCC2)CCCO1	ZINC001201548753	1369573141	/nfs/dbraw/zinc/57/31/41/1369573141.db2.gz	ZDLKKJJVPQKNMB-WOJBJXKFSA-N	0	3	348.531	3.213	20	30		EGEDHN
CCCCCCCN1CCN(c2ccnc(N3CCCC3)n2)CC1	ZINC001201798218	1369625753	/nfs/dbraw/zinc/62/57/53/1369625753.db2.gz	RDMHKAPHHNWKCS-UHFFFAOYSA-N	0	3	331.508	3.169	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC(N[C@H](C)c2cnc(C)cn2)CC1	ZINC001202004869	1369665075	/nfs/dbraw/zinc/66/50/75/1369665075.db2.gz	QBELNYHRHXLPMN-QGZVFWFLSA-N	0	3	342.487	3.010	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC(NCc2oc(CC)nc2C)CC1	ZINC001202130236	1369696106	/nfs/dbraw/zinc/69/61/06/1369696106.db2.gz	JZDNWCIXHOPVNA-OAHLLOKOSA-N	0	3	333.476	3.228	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@@H](NCC#Cc2ccc(F)cc2)C12CCC2	ZINC001202591601	1369816004	/nfs/dbraw/zinc/81/60/04/1369816004.db2.gz	PFZZFNYKPFCQOK-RTBURBONSA-N	0	3	340.442	3.160	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@@H](NCc2oc(CCC)nc2C)C12CCC2	ZINC001202597863	1369818281	/nfs/dbraw/zinc/81/82/81/1369818281.db2.gz	BRPLNAFUVCTEQL-SJORKVTESA-N	0	3	345.487	3.419	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1C[C@H](NCc2ncccc2C)C12CCC2	ZINC001202785070	1369891110	/nfs/dbraw/zinc/89/11/10/1369891110.db2.gz	OOQPSGVSKPZZDD-OALUTQOASA-N	0	3	339.483	3.101	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1C[C@@H](NCc2cccc(Cl)n2)C12CCC2	ZINC001202845728	1369906230	/nfs/dbraw/zinc/90/62/30/1369906230.db2.gz	DPWFLJJLNNFUBY-CVEARBPZSA-N	0	3	345.874	3.056	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@H](NC(=O)/C=C(/C)CC)C12CCC2	ZINC001202846327	1369906809	/nfs/dbraw/zinc/90/68/09/1369906809.db2.gz	JTOJZEQFLLXNRY-ZOAGNIGNSA-N	0	3	341.293	3.268	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1[C@H]2CN(CCOc3cccc(CC)c3)C[C@H]21	ZINC001114353632	1369907971	/nfs/dbraw/zinc/90/79/71/1369907971.db2.gz	WWVCRIRYFNAFPP-KXTWHKPSSA-N	0	3	342.483	3.031	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1C[C@@H](NCc2ocnc2C)C12CCC2	ZINC001202959124	1369936559	/nfs/dbraw/zinc/93/65/59/1369936559.db2.gz	AHUUEXVELGTHGP-QZTJIDSGSA-N	0	3	343.471	3.268	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1C[C@@H](NCc2cncs2)C12CCC2	ZINC001202967571	1369939254	/nfs/dbraw/zinc/93/92/54/1369939254.db2.gz	CHAGZQNNOHMJKR-HUUCEWRRSA-N	0	3	333.501	3.262	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1C[C@@H](NCc2conc2CC)C12CCC2	ZINC001202986148	1369945864	/nfs/dbraw/zinc/94/58/64/1369945864.db2.gz	GYPZWGXKOUCNBX-IAGOWNOFSA-N	0	3	331.460	3.110	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)CCc2ccsc2)C12CCC2	ZINC001203036295	1369962826	/nfs/dbraw/zinc/96/28/26/1369962826.db2.gz	NIIWIFHPKQYTQH-LSDHHAIUSA-N	0	3	338.904	3.450	20	30		EGEDHN
C=C(Br)CNC1CCN(C(=O)CC[C@@H](C)CC)CC1	ZINC001203038413	1369963130	/nfs/dbraw/zinc/96/31/30/1369963130.db2.gz	RWTOYMHPEMVTTF-LBPRGKRZSA-N	0	3	331.298	3.302	20	30		EGEDHN
CC1(CCC(=O)N2CCC(NCc3ccccc3C#N)CC2)CC1	ZINC001203181675	1370013874	/nfs/dbraw/zinc/01/38/74/1370013874.db2.gz	HRTAUFRUECODGL-UHFFFAOYSA-N	0	3	325.456	3.219	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1C[C@H](NCc2c(C)noc2CC)C12CCC2	ZINC001203281510	1370060425	/nfs/dbraw/zinc/06/04/25/1370060425.db2.gz	PWEKYJAPMYOATE-DLBZAZTESA-N	0	3	345.487	3.275	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1C[C@H](NCc2cnc(C)o2)C12CCC2	ZINC001203295504	1370066825	/nfs/dbraw/zinc/06/68/25/1370066825.db2.gz	LKZHYTTTXUVYGX-ROUUACIJSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H]2C[C@H](NCc3cnoc3C)C23CCC3)CC1	ZINC001203372426	1370102528	/nfs/dbraw/zinc/10/25/28/1370102528.db2.gz	FAUACKVFXJUWOY-IRXDYDNUSA-N	0	3	343.471	3.246	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)C2(C(F)(F)F)CC2)C12CCC2	ZINC001203435577	1370125251	/nfs/dbraw/zinc/12/52/51/1370125251.db2.gz	OSWDNRVYXCEFJW-QWRGUYRKSA-N	0	3	336.785	3.098	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)C2(C(F)(F)F)CC2)C12CCC2	ZINC001203435580	1370125620	/nfs/dbraw/zinc/12/56/20/1370125620.db2.gz	OSWDNRVYXCEFJW-WDEREUQCSA-N	0	3	336.785	3.098	20	30		EGEDHN
CN1CCN(Cc2ccc(Nc3cc(F)c(C#N)c(F)c3)cc2)CC1	ZINC001203675397	1370212203	/nfs/dbraw/zinc/21/22/03/1370212203.db2.gz	IDFZFOPZSDZSCD-UHFFFAOYSA-N	0	3	342.393	3.327	20	30		EGEDHN
CC(C)COC[C@H]1CC[C@@H]2[C@@H](CCN2Cc2ccc(C#N)cc2)O1	ZINC001203901274	1370307105	/nfs/dbraw/zinc/30/71/05/1370307105.db2.gz	JUPASMPARVMJSO-VAMGGRTRSA-N	0	3	328.456	3.353	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)CC(C)C)CCCCC1	ZINC001115385872	1370422932	/nfs/dbraw/zinc/42/29/32/1370422932.db2.gz	JFCASLHBGRGWTN-UHFFFAOYSA-N	0	3	331.298	3.350	20	30		EGEDHN
C=CCOc1ccc(CN2CC[C@H](Oc3ccnc(OC)c3)C2)cc1	ZINC001204302509	1370437753	/nfs/dbraw/zinc/43/77/53/1370437753.db2.gz	LCPFIVVBAFPUBS-IBGZPJMESA-N	0	3	340.423	3.308	20	30		EGEDHN
Cn1cccc1C(=O)NCC1(NCC#Cc2ccccc2)CCCCC1	ZINC001115411192	1370440405	/nfs/dbraw/zinc/44/04/05/1370440405.db2.gz	QWLNWGBXFMLWFA-UHFFFAOYSA-N	0	3	349.478	3.099	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)[C@H](C)CC)CCCCC1	ZINC001115414126	1370442129	/nfs/dbraw/zinc/44/21/29/1370442129.db2.gz	KWNOQJKJTBEBEO-GFCCVEGCSA-N	0	3	331.298	3.350	20	30		EGEDHN
CCCCCCCOc1ccc(CN2CC[C@H](CO)[C@@H](O)C2)cc1	ZINC001204369170	1370455428	/nfs/dbraw/zinc/45/54/28/1370455428.db2.gz	PUIXDEIITWBFRQ-QUCCMNQESA-N	0	3	335.488	3.211	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCC1(NCc2ccccc2Cl)CCCCC1	ZINC001115451698	1370459138	/nfs/dbraw/zinc/45/91/38/1370459138.db2.gz	CXQBNSVBAYSESF-AWEZNQCLSA-N	0	3	333.863	3.408	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)C[C@@H]2CCCCO2)CCCCC1	ZINC001115476730	1370482871	/nfs/dbraw/zinc/48/28/71/1370482871.db2.gz	AKKKHYVQEQZJMB-HNNXBMFYSA-N	0	3	328.884	3.107	20	30		EGEDHN
O=C1C=C2CN(Cc3ccc(Br)cc3F)CCC2S1	ZINC001204552530	1370512927	/nfs/dbraw/zinc/51/29/27/1370512927.db2.gz	ZCUAJVXSWPLONH-ZDUSSCGKSA-N	0	3	342.233	3.362	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@H]1CCN(Cc1ccc(F)c(OC)c1)C2	ZINC001204558326	1370514430	/nfs/dbraw/zinc/51/44/30/1370514430.db2.gz	XMMPDTKLPICQIZ-PMACEKPBSA-N	0	3	349.446	3.408	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCC1(NCc2nccnc2C)CCCCC1	ZINC001115554297	1370550921	/nfs/dbraw/zinc/55/09/21/1370550921.db2.gz	AXNIASYOACMOQO-UHFFFAOYSA-N	0	3	344.503	3.296	20	30		EGEDHN
C=C(C)CCC(=O)NCC1(NCc2cccc(OC)n2)CCCCC1	ZINC001115556851	1370554666	/nfs/dbraw/zinc/55/46/66/1370554666.db2.gz	FTUAJHSVDDHBPX-UHFFFAOYSA-N	0	3	345.487	3.355	20	30		EGEDHN
CN1CCN(Cc2ccc(Nc3ncc(C#N)cc3Cl)cc2)CC1	ZINC001204725309	1370555769	/nfs/dbraw/zinc/55/57/69/1370555769.db2.gz	VQCXLLSHJDLKRO-UHFFFAOYSA-N	0	3	341.846	3.098	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2c(F)cncc2F)CCCCC1	ZINC001115557088	1370555787	/nfs/dbraw/zinc/55/57/87/1370555787.db2.gz	SIMDQIIGXMANDE-UHFFFAOYSA-N	0	3	343.805	3.135	20	30		EGEDHN
C#CCC1(C(=O)NCC2(NCc3ccns3)CCCCC2)CCC1	ZINC001115567343	1370568338	/nfs/dbraw/zinc/56/83/38/1370568338.db2.gz	BXDLCYPNYRLXRR-UHFFFAOYSA-N	0	3	345.512	3.245	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCC1(NCc2ccccn2)CCCCC1	ZINC001115678500	1370661260	/nfs/dbraw/zinc/66/12/60/1370661260.db2.gz	JBZDPDYWJWTHOA-IAGOWNOFSA-N	0	3	329.488	3.449	20	30		EGEDHN
C=CCOC(=O)N1CC2(C1)CCN(Cc1ccc(C)c(F)c1)CC2	ZINC001205205784	1370679023	/nfs/dbraw/zinc/67/90/23/1370679023.db2.gz	HTXOHXAAHRZCQJ-UHFFFAOYSA-N	0	3	332.419	3.355	20	30		EGEDHN
C=CCCCC(=O)NCC1(NCc2cc(C)ncn2)CCCCC1	ZINC001115701390	1370682397	/nfs/dbraw/zinc/68/23/97/1370682397.db2.gz	LGMQKIJOONTHRG-UHFFFAOYSA-N	0	3	330.476	3.050	20	30		EGEDHN
N#Cc1cc(Cl)c(-c2noc([C@H]3CCNC[C@@H]3F)n2)cc1Cl	ZINC001205220624	1370685971	/nfs/dbraw/zinc/68/59/71/1370685971.db2.gz	ZDQHOXMLKCHWIA-UFBFGSQYSA-N	0	3	341.173	3.330	20	30		EGEDHN
Cc1nc(CNCC2CCN(C(=O)C#CC(C)(C)C)CC2)sc1C	ZINC001205236734	1370690406	/nfs/dbraw/zinc/69/04/06/1370690406.db2.gz	YJKPHSJVKQPIRK-UHFFFAOYSA-N	0	3	347.528	3.138	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C2CC=CC2)CC[C@H]1c1ccc(F)cc1	ZINC001205262973	1370699097	/nfs/dbraw/zinc/69/90/97/1370699097.db2.gz	HSUUGYXUZNNNLV-VQTJNVASSA-N	0	3	340.442	3.089	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)CC(CC)CC)C[C@H]1c1cccc(F)c1	ZINC001205445878	1370758241	/nfs/dbraw/zinc/75/82/41/1370758241.db2.gz	OICUPVRTLNKOGB-RBUKOAKNSA-N	0	3	330.447	3.169	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)C(C)(C)CCOC)CCCCC1	ZINC001115801118	1370784762	/nfs/dbraw/zinc/78/47/62/1370784762.db2.gz	ZUYOGLKDGXRGGF-UHFFFAOYSA-N	0	3	330.900	3.210	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](C)c2ccc(Cl)c(F)c2)CC1	ZINC001116427020	1370909098	/nfs/dbraw/zinc/90/90/98/1370909098.db2.gz	CHQNFEKFLVAFIW-LBPRGKRZSA-N	0	3	339.842	3.490	20	30		EGEDHN
C=C(CN1CCCC1)c1nc(-c2cncc(Br)c2C)no1	ZINC001206099667	1370959654	/nfs/dbraw/zinc/95/96/54/1370959654.db2.gz	ASBMECGBRPRSDP-UHFFFAOYSA-N	0	3	349.232	3.312	20	30		EGEDHN
C=CCCCC(=O)N1CCC(CN[C@@H](C)c2cnc(C)cn2)CC1	ZINC001206105662	1370961295	/nfs/dbraw/zinc/96/12/95/1370961295.db2.gz	PTTAUIGVPGYIHL-INIZCTEOSA-N	0	3	330.476	3.031	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(CNCc3cnc(C)o3)CC2)CCC1	ZINC001206186735	1370985805	/nfs/dbraw/zinc/98/58/05/1370985805.db2.gz	AFVJCAOJHDZPIM-UHFFFAOYSA-N	0	3	331.460	3.058	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC(CNCc2oc(CC)nc2C)CC1	ZINC001206427925	1371051232	/nfs/dbraw/zinc/05/12/32/1371051232.db2.gz	OXEHVOLURYQEEE-UHFFFAOYSA-N	0	3	347.503	3.476	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N[C@]1(C)CCN(Cc2ccccc2)C1	ZINC001118234320	1371151294	/nfs/dbraw/zinc/15/12/94/1371151294.db2.gz	GPECOIKHACJTSA-OAQYLSRUSA-N	0	3	333.435	3.261	20	30		EGEDHN
C=CCO[C@@H]1CO[C@]2(C1)CCCN(Cc1ccc(C)cc1OC)C2	ZINC001206762655	1371156485	/nfs/dbraw/zinc/15/64/85/1371156485.db2.gz	OJECNWDTIBUFQJ-ICSRJNTNSA-N	0	3	331.456	3.330	20	30		EGEDHN
COc1ccc(-c2cc(CN3CCC4SC(=O)C=C4C3)no2)cc1	ZINC001206826325	1371181690	/nfs/dbraw/zinc/18/16/90/1371181690.db2.gz	WMAJRYNXNGEOPB-KRWDZBQOSA-N	0	3	342.420	3.124	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cncc(OC)c1)[C@H]2CC	ZINC001206995447	1371262623	/nfs/dbraw/zinc/26/26/23/1371262623.db2.gz	IPJQOIYPXLPZGO-ICSRJNTNSA-N	0	3	343.471	3.012	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cncc(OC)c1)[C@@H]2CC	ZINC001206995449	1371262819	/nfs/dbraw/zinc/26/28/19/1371262819.db2.gz	IPJQOIYPXLPZGO-QUCCMNQESA-N	0	3	343.471	3.012	20	30		EGEDHN
Cc1ccc(C(=O)N2CCC[C@@H](NCC#Cc3ccccc3)C2)s1	ZINC001207083318	1371289110	/nfs/dbraw/zinc/28/91/10/1371289110.db2.gz	YOCBKVFUYOURAX-GOSISDBHSA-N	0	3	338.476	3.302	20	30		EGEDHN
O=C(c1cccc(F)c1)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001207126709	1371302626	/nfs/dbraw/zinc/30/26/26/1371302626.db2.gz	QXFBXLGYGLRRQZ-HXUWFJFHSA-N	0	3	336.410	3.072	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207167075	1371316812	/nfs/dbraw/zinc/31/68/12/1371316812.db2.gz	HKEVFYRZFSKAAD-GOSISDBHSA-N	0	3	330.859	3.238	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1ccnn1C(C)C)[C@H]2CC	ZINC001207171868	1371318741	/nfs/dbraw/zinc/31/87/41/1371318741.db2.gz	SUPOFPQBWWMBGH-ICSRJNTNSA-N	0	3	344.503	3.386	20	30		EGEDHN
CC1(C)C[C@H](CN2CCN(c3ccc(C#N)cc3F)CC2)CCO1	ZINC001207362748	1371374511	/nfs/dbraw/zinc/37/45/11/1371374511.db2.gz	JSONJSJHURQIJB-MRXNPFEDSA-N	0	3	331.435	3.025	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CCC[C@@H](NCc2cc(C)ccc2F)C1	ZINC001207622662	1371454629	/nfs/dbraw/zinc/45/46/29/1371454629.db2.gz	IGEFZAXGUGXCBG-SJLPKXTDSA-N	0	3	348.462	3.196	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccccc2OC)CCCCC1	ZINC001120049943	1371468672	/nfs/dbraw/zinc/46/86/72/1371468672.db2.gz	BPIDWEHLHRMFLI-UHFFFAOYSA-N	0	3	336.863	3.470	20	30		EGEDHN
CC(C)(C)/C=C/C(=O)N1CCC[C@@H](NCc2ccc(C#N)s2)C1	ZINC001207710955	1371482743	/nfs/dbraw/zinc/48/27/43/1371482743.db2.gz	VELVERJPVFTAQK-MYSGNRETSA-N	0	3	331.485	3.303	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H]2CCCC[C@H]2OC)CCCCC1	ZINC001120226291	1371509313	/nfs/dbraw/zinc/50/93/13/1371509313.db2.gz	JEMVLHKFBJDRJQ-JKSUJKDBSA-N	0	3	342.911	3.353	20	30		EGEDHN
CC/C(C)=C/C(=O)N1CCC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001208002206	1371563900	/nfs/dbraw/zinc/56/39/00/1371563900.db2.gz	PUVRAELGJPDWBD-ZGUWOUCSSA-N	0	3	329.419	3.134	20	30		EGEDHN
COc1ccc(C)cc1CN[C@H]1CCCN(C(=O)C#CC(C)(C)C)C1	ZINC001208014125	1371568673	/nfs/dbraw/zinc/56/86/73/1371568673.db2.gz	MFTCORXOGAEIMA-SFHVURJKSA-N	0	3	342.483	3.134	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H]2CN([C@H](C)c3cccc(F)c3)C[C@H]21	ZINC001187714572	1388148529	/nfs/dbraw/zinc/14/85/29/1388148529.db2.gz	UBKFEAMZTRDDIF-HHXXYDBFSA-N	0	3	328.431	3.223	20	30		EGEDHN
C=C(C)[C@@H]1CC=C(CN2CCC[C@@H](NC(=O)C3CCOCC3)C2)CC1	ZINC001208179321	1371622031	/nfs/dbraw/zinc/62/20/31/1371622031.db2.gz	UOWLTPQHTYGESB-UYAOXDASSA-N	0	3	346.515	3.296	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001208195143	1371634796	/nfs/dbraw/zinc/63/47/96/1371634796.db2.gz	XCUUHIKLLWSTOA-OAQYLSRUSA-N	0	3	336.479	3.387	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@H](NCc2c(C)nsc2C)C1	ZINC001208240785	1371676213	/nfs/dbraw/zinc/67/62/13/1371676213.db2.gz	QWJRZROHENLQSA-HNNXBMFYSA-N	0	3	335.517	3.443	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CCC[C@H](NCc2ccccc2F)C1)OCC	ZINC001208263791	1371690259	/nfs/dbraw/zinc/69/02/59/1371690259.db2.gz	CLXHJLLKJSNROL-HKUYNNGSSA-N	0	3	348.462	3.278	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN(CCOC2CCCCCC2)C[C@H]1C	ZINC001208318405	1371715414	/nfs/dbraw/zinc/71/54/14/1371715414.db2.gz	WZMDWVDWPFWHOJ-SJLPKXTDSA-N	0	3	336.520	3.375	20	30		EGEDHN
C#CCC1(C(=O)N2CCC[C@H](NCc3ccc(F)c(F)c3)C2)CCC1	ZINC001208319796	1371716785	/nfs/dbraw/zinc/71/67/85/1371716785.db2.gz	ZNQALMWSIWLDJA-INIZCTEOSA-N	0	3	346.421	3.239	20	30		EGEDHN
CC/C=C(\C)C(=O)NC1CC2(CC(NCc3ccccc3C#N)C2)C1	ZINC001120747729	1371739619	/nfs/dbraw/zinc/73/96/19/1371739619.db2.gz	VVEURNOFPUSDHK-GIDUJCDVSA-N	0	3	337.467	3.432	20	30		EGEDHN
CC/C=C(/C)C(=O)NC1CC2(CC(NCc3ccccc3C#N)C2)C1	ZINC001120747730	1371739780	/nfs/dbraw/zinc/73/97/80/1371739780.db2.gz	VVEURNOFPUSDHK-UUASQNMZSA-N	0	3	337.467	3.432	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CN(CCOCc2ccccc2)C[C@H]1C	ZINC001208391020	1371748980	/nfs/dbraw/zinc/74/89/80/1371748980.db2.gz	HXJNCACTAXKXDH-QWFCFKBJSA-N	0	3	344.499	3.242	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CN(CCCOc2ccccc2)C[C@H]1C	ZINC001208391123	1371749029	/nfs/dbraw/zinc/74/90/29/1371749029.db2.gz	JFTJKLCUBLDQCI-NLWGTHIKSA-N	0	3	344.499	3.494	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1CN(CCOc2cccc(C)c2)C[C@H]1C	ZINC001208396556	1371752817	/nfs/dbraw/zinc/75/28/17/1371752817.db2.gz	YBUXOTQQCSDFOM-QWFCFKBJSA-N	0	3	344.499	3.413	20	30		EGEDHN
C=CCCC(=O)NC1CC2(CC(NCc3cc(F)ccc3C#N)C2)C1	ZINC001120787711	1371758519	/nfs/dbraw/zinc/75/85/19/1371758519.db2.gz	UDSJUQLOCMRZQW-UHFFFAOYSA-N	0	3	341.430	3.181	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1CN(CCCOc2ccccc2)C[C@H]1C	ZINC001208497866	1371787799	/nfs/dbraw/zinc/78/77/99/1371787799.db2.gz	CCOCRMWVOIEJGN-YFVAEKQCSA-N	0	3	344.499	3.494	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1CN(Cc2ccccc2N(C)C)C[C@H]1C	ZINC001208508830	1371793043	/nfs/dbraw/zinc/79/30/43/1371793043.db2.gz	JCYFSJSVBLQCIK-BLIXFSHQSA-N	0	3	343.515	3.291	20	30		EGEDHN
C=C(C)CCC(=O)NC1CC2(CC(NCc3ccccc3C#N)C2)C1	ZINC001121179929	1371880856	/nfs/dbraw/zinc/88/08/56/1371880856.db2.gz	HCDRMDDAPLABEO-UHFFFAOYSA-N	0	3	337.467	3.432	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001208919555	1371945288	/nfs/dbraw/zinc/94/52/88/1371945288.db2.gz	UDCTVTLEQKSOON-IBGZPJMESA-N	0	3	342.458	3.360	20	30		EGEDHN
N#Cc1ccc(CCN2CCC(Oc3ccc(F)cn3)CC2)cc1	ZINC001208929103	1371948377	/nfs/dbraw/zinc/94/83/77/1371948377.db2.gz	NLQXWWSJHWQPFN-UHFFFAOYSA-N	0	3	325.387	3.178	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N1CCC[C@H](NCc2ccc(C#N)s2)C1	ZINC001209102257	1371998533	/nfs/dbraw/zinc/99/85/33/1371998533.db2.gz	VOZVUSITVMWGET-HVJNQHDOSA-N	0	3	329.469	3.223	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NC1CC2(CC(NCc3oc(C)nc3C)C2)C1	ZINC001121611064	1372024080	/nfs/dbraw/zinc/02/40/80/1372024080.db2.gz	OUPJFSCAXYKXPT-YQQSWPFXSA-N	0	3	345.487	3.267	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NC1CC2(CC(NCc3nc(C)cs3)C2)C1	ZINC001121611712	1372024575	/nfs/dbraw/zinc/02/45/75/1372024575.db2.gz	XNUYZCZGZGPLSE-ZAYNFQSFSA-N	0	3	347.528	3.427	20	30		EGEDHN
C=CCCCCN1CCCn2cnc(COc3cccnc3)c2C1	ZINC001209202563	1372035937	/nfs/dbraw/zinc/03/59/37/1372035937.db2.gz	FFSASKRUIISPCT-UHFFFAOYSA-N	0	3	326.444	3.419	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC1CC2(CC(NCc3cc(C)no3)C2)C1	ZINC001121713717	1372056180	/nfs/dbraw/zinc/05/61/80/1372056180.db2.gz	NBALMPHZAQRKAT-LZUQWOSISA-N	0	3	331.460	3.102	20	30		EGEDHN
C=CCC1(C(=O)NC2CC3(CC(NCc4ocnc4C)C3)C2)CCC1	ZINC001121714187	1372056860	/nfs/dbraw/zinc/05/68/60/1372056860.db2.gz	YOADSCIKIOKFKC-UHFFFAOYSA-N	0	3	343.471	3.246	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@@H](NCc2cc(C#N)ccc2OC)C1	ZINC001209335971	1372071488	/nfs/dbraw/zinc/07/14/88/1372071488.db2.gz	UHVUMSUSWQEGBB-GOSISDBHSA-N	0	3	341.455	3.004	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@@H](NCc2cccc(NC(C)=O)c2)C1	ZINC001209335956	1372071661	/nfs/dbraw/zinc/07/16/61/1372071661.db2.gz	UCPOHTRARYYOBM-LJQANCHMSA-N	0	3	343.471	3.082	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC1CC2(CC(NCc3ccn(CC)n3)C2)C1	ZINC001121842107	1372099336	/nfs/dbraw/zinc/09/93/36/1372099336.db2.gz	UNKDQVFGLCZPFG-UHFFFAOYSA-N	0	3	344.503	3.022	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001209456359	1372111544	/nfs/dbraw/zinc/11/15/44/1372111544.db2.gz	ZWORHNGVGLYDDH-PZJWPPBQSA-N	0	3	342.458	3.360	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1ccnc(OC)c1)[C@H]2CC	ZINC001209636781	1372157941	/nfs/dbraw/zinc/15/79/41/1372157941.db2.gz	QVTSAXLHOOWPIJ-PXNSSMCTSA-N	0	3	343.471	3.012	20	30		EGEDHN
N#Cc1ccc(C2CCN(C(=O)c3cccc4c3CNC4)CC2)cc1	ZINC001122364499	1372235626	/nfs/dbraw/zinc/23/56/26/1372235626.db2.gz	IZSMACXDCCUORE-UHFFFAOYSA-N	0	3	331.419	3.181	20	30		EGEDHN
CC(C)Cn1c(CCCCC#N)nnc1N1CCN(C(C)(C)C)CC1	ZINC001122813838	1372324782	/nfs/dbraw/zinc/32/47/82/1372324782.db2.gz	MJNLZKHLHCZWEB-UHFFFAOYSA-N	0	3	346.523	3.091	20	30		EGEDHN
CCC(CC)CC(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001210358422	1372331738	/nfs/dbraw/zinc/33/17/38/1372331738.db2.gz	KTCYQWPBHSVXJB-FQEVSTJZSA-N	0	3	326.484	3.445	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)c2ccccc2C2CCC2)C1	ZINC001210675242	1372404455	/nfs/dbraw/zinc/40/44/55/1372404455.db2.gz	DMYHWTSIKHWKHD-OXQOHEQNSA-N	0	3	342.483	3.207	20	30		EGEDHN
CC(C)(C)C(=O)N1CCC[C@@H](NCC#Cc2ccccc2Cl)C1	ZINC001210788297	1372426589	/nfs/dbraw/zinc/42/65/89/1372426589.db2.gz	APNUMMSGCZHXDW-MRXNPFEDSA-N	0	3	332.875	3.318	20	30		EGEDHN
CCCCCCCCC(=O)N1CCC[C@H](NCc2cncn2C)C1	ZINC001210805051	1372429992	/nfs/dbraw/zinc/42/99/92/1372429992.db2.gz	PRXKVGUELBQDCG-KRWDZBQOSA-N	0	3	334.508	3.251	20	30		EGEDHN
Cc1ccc(C(=O)N2CCC[C@@H](NCC#Cc3ccccc3)C2)cc1	ZINC001210824242	1372433610	/nfs/dbraw/zinc/43/36/10/1372433610.db2.gz	JJXHRBJWILZRNE-OAQYLSRUSA-N	0	3	332.447	3.241	20	30		EGEDHN
CC(F)(F)C(C)(C)C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001210853119	1372441310	/nfs/dbraw/zinc/44/13/10/1372441310.db2.gz	XJXPXIWHPCTYNP-QGZVFWFLSA-N	0	3	348.437	3.300	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)CCn2ccc3ccccc32)C1	ZINC001210905481	1372450669	/nfs/dbraw/zinc/45/06/69/1372450669.db2.gz	VRWPHNQOYDRKKS-SJLPKXTDSA-N	0	3	325.456	3.044	20	30		EGEDHN
C=CCCCN1C[C@@H](C)[C@H](NC(=O)c2sc(Cl)nc2Cl)C1	ZINC001211054866	1372479142	/nfs/dbraw/zinc/47/91/42/1372479142.db2.gz	XAXJXDNEMZVVKI-NXEZZACHSA-N	0	3	348.299	3.466	20	30		EGEDHN
CCCCCC[C@@](C)(CC)C(=O)N1CC[C@@H](NCC#CCOC)C1	ZINC001187989458	1388207098	/nfs/dbraw/zinc/20/70/98/1388207098.db2.gz	ZQRNNUKEKCERFY-UYAOXDASSA-N	0	3	336.520	3.213	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2ccc(CC)o2)C[C@H]1c1ccccc1	ZINC001211625601	1372592563	/nfs/dbraw/zinc/59/25/63/1372592563.db2.gz	NRSLXKYCSISKDJ-RBUKOAKNSA-N	0	3	336.435	3.063	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@H]2CCCC2(C)C)C[C@H]1c1ccccc1	ZINC001211650505	1372595554	/nfs/dbraw/zinc/59/55/54/1372595554.db2.gz	KVZISSCDYIOLKI-XUVXKRRUSA-N	0	3	338.495	3.420	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@@H]2C[C@H]2CC(C)C)C[C@H]1c1ccccc1	ZINC001211676041	1372601519	/nfs/dbraw/zinc/60/15/19/1372601519.db2.gz	ALTLWRXOJRXQDS-MXEMCNAFSA-N	0	3	338.495	3.276	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN(CC/C=C\c2ccccc2)C[C@H]1OC	ZINC001212349487	1372692383	/nfs/dbraw/zinc/69/23/83/1372692383.db2.gz	YCKJAKOKBYNIIC-RHHFQONYSA-N	0	3	342.483	3.262	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2[nH]ccc2C2CC2)[C@H](OC)C1	ZINC001212383357	1372698297	/nfs/dbraw/zinc/69/82/97/1372698297.db2.gz	PURCITATCRXMEC-QZTJIDSGSA-N	0	3	345.487	3.068	20	30		EGEDHN
C=C[C@@H](CC(=O)N1CC[C@@H](NCc2ncccc2C)C1)c1ccccc1	ZINC001188040222	1388224809	/nfs/dbraw/zinc/22/48/09/1388224809.db2.gz	PPHVLIRIQVAMMV-AZUAARDMSA-N	0	3	349.478	3.440	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@@H]2C[C@@H]3CCCC[C@H]23)[C@H](OC)C1	ZINC001213200800	1372857983	/nfs/dbraw/zinc/85/79/83/1372857983.db2.gz	BQXREYGNNCQJNX-CENDIDJXSA-N	0	3	348.531	3.375	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2ccc(C)c(Cl)c2)[C@H](OC)C1	ZINC001213369359	1372894709	/nfs/dbraw/zinc/89/47/09/1372894709.db2.gz	PLGDIQSZJSWIDA-IAGOWNOFSA-N	0	3	336.863	3.044	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@@H](C)C(C)(F)F)[C@H](OC)C1	ZINC001213451660	1372907696	/nfs/dbraw/zinc/90/76/96/1372907696.db2.gz	IEHBCRQDZDGHLC-RBSFLKMASA-N	0	3	334.451	3.064	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@H](C)Cc2ccco2)[C@H](OC)C1	ZINC001213569396	1372928007	/nfs/dbraw/zinc/92/80/07/1372928007.db2.gz	KXKOTVWIIFWAGH-BHIYHBOVSA-N	0	3	348.487	3.020	20	30		EGEDHN
C#CCCCC(=O)NCCN[C@H]1CCc2c1cc(Cl)cc2Cl	ZINC001126338442	1372958465	/nfs/dbraw/zinc/95/84/65/1372958465.db2.gz	ANJYKZXFLCYPEY-INIZCTEOSA-N	0	3	339.266	3.490	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2ccc(C)c(C)c2)[C@H](OC)C1	ZINC001213803288	1372963580	/nfs/dbraw/zinc/96/35/80/1372963580.db2.gz	BEYCJGJQVVMFKJ-WOJBJXKFSA-N	0	3	344.499	3.479	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2cc3c(cccc3C)o2)[C@H](OC)C1	ZINC001213949012	1372985199	/nfs/dbraw/zinc/98/51/99/1372985199.db2.gz	KXVBWORJMPEALR-VQIMIIECSA-N	0	3	342.439	3.136	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2CCCCC2)C[C@H]1NCC#Cc1ccccc1	ZINC001214087150	1373007096	/nfs/dbraw/zinc/00/70/96/1373007096.db2.gz	JHMACNGTNUELSB-WIYYLYMNSA-N	0	3	338.495	3.445	20	30		EGEDHN
C[C@@H]1CN(C(=O)/C=C/C(C)(C)C)C[C@H]1NCC#Cc1ccc(F)cc1	ZINC001214356423	1373048776	/nfs/dbraw/zinc/04/87/76/1373048776.db2.gz	UELBMRUYPADFFW-URWYZWATSA-N	0	3	342.458	3.216	20	30		EGEDHN
CCC[C@H](C)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001214364702	1373050031	/nfs/dbraw/zinc/05/00/31/1373050031.db2.gz	ZTAFSUXBZWXJSI-FRQCXROJSA-N	0	3	330.447	3.050	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@@H](C)[C@H](NCc2cccc(Cl)c2F)C1	ZINC001214582316	1373084801	/nfs/dbraw/zinc/08/48/01/1373084801.db2.gz	OPAKAULERIMFJJ-CZUORRHYSA-N	0	3	336.838	3.075	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCNCc1ccc(Cl)c(OC)c1	ZINC001128085255	1373216230	/nfs/dbraw/zinc/21/62/30/1373216230.db2.gz	QIBZWKZMMMSQEJ-UHFFFAOYSA-N	0	3	336.863	3.323	20	30		EGEDHN
CCC[C@@H](C)CCCC(=O)NCCNCc1ccc(OC)c(C#N)c1	ZINC001128152017	1373225063	/nfs/dbraw/zinc/22/50/63/1373225063.db2.gz	FGSJRGMGSMZPLY-MRXNPFEDSA-N	0	3	345.487	3.379	20	30		EGEDHN
CCC(CC)CC(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001216086054	1373259870	/nfs/dbraw/zinc/25/98/70/1373259870.db2.gz	HGPWAIWVKQYIPL-CXAGYDPISA-N	0	3	333.501	3.383	20	30		EGEDHN
C=CCCC(=O)N1CCO[C@@H]2CN([C@H](CC)c3ccccc3)C[C@@H]21	ZINC001217493616	1373454521	/nfs/dbraw/zinc/45/45/21/1373454521.db2.gz	NDHVMYVKXXPEHK-CEXWTWQISA-N	0	3	328.456	3.016	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)[C@H]2CCC=CCCC2)cc1F	ZINC001130163695	1373466359	/nfs/dbraw/zinc/46/63/59/1373466359.db2.gz	YNWWNENWPFYHGQ-INIZCTEOSA-N	0	3	329.419	3.040	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)[C@@H]3CCC(C)=C(C)C3)[C@H]2C1	ZINC001217960419	1373520462	/nfs/dbraw/zinc/52/04/62/1373520462.db2.gz	YNOJAWAWVVTJEC-CEXWTWQISA-N	0	3	332.488	3.001	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)[C@@H](CC)CC(C)C)C1	ZINC001130438602	1373539467	/nfs/dbraw/zinc/53/94/67/1373539467.db2.gz	MPJUZJOIADWBCW-HOTGVXAUSA-N	0	3	332.492	3.074	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)C(CC)(CC)CC)C1	ZINC001130438417	1373540161	/nfs/dbraw/zinc/54/01/61/1373540161.db2.gz	LBPVJQZAOFLGTE-HNNXBMFYSA-N	0	3	332.492	3.218	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)CC(C)(C)C=C)[C@H]2C1	ZINC001218023414	1373540590	/nfs/dbraw/zinc/54/05/90/1373540590.db2.gz	SGRQQBDYJSWYKL-ZWKOTPCHSA-N	0	3	334.504	3.247	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)C[C@@H](CC)C(C)C)C1	ZINC001130443196	1373542861	/nfs/dbraw/zinc/54/28/61/1373542861.db2.gz	RJOZEZBRNIWYKJ-CVEARBPZSA-N	0	3	332.492	3.074	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)C2(CC=C)CCCC2)C1	ZINC001130455845	1373546084	/nfs/dbraw/zinc/54/60/84/1373546084.db2.gz	HFUCIPNCZZTXJB-MRXNPFEDSA-N	0	3	342.487	3.138	20	30		EGEDHN
Cc1c(F)ccc(Cl)c1C(=O)NCCNCc1ccc(C#N)cc1	ZINC001130558638	1373559841	/nfs/dbraw/zinc/55/98/41/1373559841.db2.gz	IGQFGJRKCUVOTG-UHFFFAOYSA-N	0	3	345.805	3.179	20	30		EGEDHN
CCC[C@H]1CCC[C@H]1C(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001130567335	1373561552	/nfs/dbraw/zinc/56/15/52/1373561552.db2.gz	UJDHMARHLMMXAH-DOTOQJQBSA-N	0	3	331.435	3.120	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)[C@H]3CC34CCCC4)[C@H]2C1	ZINC001218899418	1373665502	/nfs/dbraw/zinc/66/55/02/1373665502.db2.gz	GLKYWMFXVQXOTI-CEXWTWQISA-N	0	3	348.531	3.449	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2ccc(C(C)(C)CC)cc2)[C@@H](O)C1	ZINC001219854910	1373736267	/nfs/dbraw/zinc/73/62/67/1373736267.db2.gz	AUWDILADPVMHOK-MOPGFXCFSA-N	0	3	344.499	3.115	20	30		EGEDHN
C[C@H](NC(=O)[C@H](N)C12CC3CC(CC(C3)C1)C2)c1cccc(C#N)c1	ZINC001220047626	1373748778	/nfs/dbraw/zinc/74/87/78/1373748778.db2.gz	ACIDQSTZBYISIC-KKSYVHHUSA-N	0	3	337.467	3.279	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2ccn(C(C)C)c2C)[C@@H](O)C1	ZINC001220201601	1373758252	/nfs/dbraw/zinc/75/82/52/1373758252.db2.gz	VQICWDIZXLIDHZ-MOPGFXCFSA-N	0	3	349.519	3.123	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CCCCCCC)C[C@@H]2O)CCCC1	ZINC001221199474	1373768375	/nfs/dbraw/zinc/76/83/75/1373768375.db2.gz	XAGVSZCHYJTHSJ-MSOLQXFVSA-N	0	3	336.520	3.255	20	30		EGEDHN
C=CCCCCCN1CC[C@@H]2CN(C(=O)c3ccc(OC)o3)[C@@H]2C1	ZINC001221888269	1373802212	/nfs/dbraw/zinc/80/22/12/1373802212.db2.gz	ZFBCANLZHKMEBU-HZPDHXFCSA-N	0	3	332.444	3.181	20	30		EGEDHN
C#CC[C@@H](CC(=O)N1CC[C@@H](NC/C=C/Cl)C1)c1ccccc1	ZINC001188438620	1388309481	/nfs/dbraw/zinc/30/94/81/1388309481.db2.gz	QDFURKZMIAIIOJ-GCYIJFDNSA-N	0	3	330.859	3.127	20	30		EGEDHN
COc1ccc(NC(=O)N2CCC3SC(=O)C=C3C2)cc1Cl	ZINC001188453411	1388311214	/nfs/dbraw/zinc/31/12/14/1388311214.db2.gz	ACTBWRAIFJMECX-ZDUSSCGKSA-N	0	3	338.816	3.155	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@H](C)N(CCOCc2ccccc2)C1	ZINC001131896546	1375031937	/nfs/dbraw/zinc/03/19/37/1375031937.db2.gz	TVGVXYRZXNTINV-PKOBYXMFSA-N	0	3	330.472	3.139	20	30		EGEDHN
C#CCN1CCC(CNC(=O)[C@H](CC(C)C)c2ccccc2)CC1	ZINC001224778595	1375076481	/nfs/dbraw/zinc/07/64/81/1375076481.db2.gz	LYKWTMVTDNLJSU-HXUWFJFHSA-N	0	3	326.484	3.278	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@]2(C)CCCc3ccccc32)CC1	ZINC001224862314	1375080761	/nfs/dbraw/zinc/08/07/61/1375080761.db2.gz	JYMMNMDAKHOIPW-JOCHJYFZSA-N	0	3	338.495	3.132	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CC[C@@H](C)N(CCOc2cccc(C)c2)C1	ZINC001131995117	1375088643	/nfs/dbraw/zinc/08/86/43/1375088643.db2.gz	GZEDGRHREBMADV-MOPGFXCFSA-N	0	3	342.483	3.146	20	30		EGEDHN
CCc1cccc(CN2C[C@@H](NC(=O)C#CC(C)C)CC[C@H]2C)c1	ZINC001132018285	1375101744	/nfs/dbraw/zinc/10/17/44/1375101744.db2.gz	WFRQUNAISYIIAW-XLIONFOSSA-N	0	3	326.484	3.378	20	30		EGEDHN
C[C@@H]1CC[C@@H](NC(=O)C#CC2CC2)CN1Cc1cccc2cccnc21	ZINC001132047405	1375115891	/nfs/dbraw/zinc/11/58/91/1375115891.db2.gz	XBHQRCUQZZZMGM-OXQOHEQNSA-N	0	3	347.462	3.117	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCOc2cccc(F)c2)CC[C@H]1C	ZINC001132097417	1375146473	/nfs/dbraw/zinc/14/64/73/1375146473.db2.gz	JKXWXEXQNQYJOG-WBVHZDCISA-N	0	3	334.435	3.140	20	30		EGEDHN
CC[C@H](SC)C(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1	ZINC001225699259	1375146941	/nfs/dbraw/zinc/14/69/41/1375146941.db2.gz	ZANVUCZCBFHDTB-QRVBRYPASA-N	0	3	344.524	3.197	20	30		EGEDHN
CC[C@@H](SC)C(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1	ZINC001225699258	1375147156	/nfs/dbraw/zinc/14/71/56/1375147156.db2.gz	ZANVUCZCBFHDTB-GUDVDZBRSA-N	0	3	344.524	3.197	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@@H]1CCCC[C@H]1NCc1ccncc1Cl	ZINC001226133691	1375208913	/nfs/dbraw/zinc/20/89/13/1375208913.db2.gz	ILHACSOSFITBHD-IAGOWNOFSA-N	0	3	347.890	3.302	20	30		EGEDHN
Cc1nsc(C)c1CN[C@@H]1CCCC[C@H]1NC(=O)C#CC(C)(C)C	ZINC001226133377	1375209013	/nfs/dbraw/zinc/20/90/13/1375209013.db2.gz	BGIAVKYPPKPKLK-IAGOWNOFSA-N	0	3	347.528	3.326	20	30		EGEDHN
CC[C@@H](c1ccc(F)cc1)N1CCC(NC(=O)CSCC#N)CC1	ZINC001226152183	1375211964	/nfs/dbraw/zinc/21/19/64/1375211964.db2.gz	DCGFWUSPWTYLMH-KRWDZBQOSA-N	0	3	349.475	3.114	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CC[C@H](C)N(Cc2ccc(CO)cc2)C1	ZINC001132217903	1375215875	/nfs/dbraw/zinc/21/58/75/1375215875.db2.gz	IRJGSAKYOSQELJ-QFBILLFUSA-N	0	3	344.499	3.250	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCNCc2ccccc2C(F)(F)F)cc1	ZINC001132222846	1375219716	/nfs/dbraw/zinc/21/97/16/1375219716.db2.gz	MIAAPBKMFXEMJO-UHFFFAOYSA-N	0	3	346.352	3.206	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCc2cccc(N(C)C)c2)CC[C@@H]1C	ZINC001132237623	1375233528	/nfs/dbraw/zinc/23/35/28/1375233528.db2.gz	KLKLKIONNXRYSE-PKOBYXMFSA-N	0	3	343.515	3.230	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2nc(Cl)cs2)CC[C@H]1C	ZINC001132238264	1375234423	/nfs/dbraw/zinc/23/44/23/1375234423.db2.gz	QMPBWOKKMKLNRP-NEPJUHHUSA-N	0	3	327.881	3.345	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1CC[C@H](C)N(CCOC2CCC2)C1	ZINC001132240223	1375234695	/nfs/dbraw/zinc/23/46/95/1375234695.db2.gz	CYBKRDJQCLYGLX-ZWKOTPCHSA-N	0	3	334.504	3.108	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)Cc2cc(C)ccc2C)CC[C@H]1C	ZINC001132266257	1375255447	/nfs/dbraw/zinc/25/54/47/1375255447.db2.gz	WFGOABQUAUNDPW-QUCCMNQESA-N	0	3	344.499	3.018	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC[C@@H](C)N(CCOCC3CCC3)C2)C1	ZINC001132273782	1375259967	/nfs/dbraw/zinc/25/99/67/1375259967.db2.gz	JXKJYOXSKVCMIF-AEFFLSMTSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CCCC[C@H]1NCc1conc1CC	ZINC001226474577	1375264815	/nfs/dbraw/zinc/26/48/15/1375264815.db2.gz	PAOVTLSLCKESKR-IAGOWNOFSA-N	0	3	333.476	3.356	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CCCC[C@H]1N[C@H](C)c1n[nH]c(CC)n1	ZINC001226482026	1375266813	/nfs/dbraw/zinc/26/68/13/1375266813.db2.gz	ULZVNFNNXHVENG-RBSFLKMASA-N	0	3	347.507	3.047	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC[C@@H](C)N(CCOCCC(C)C)C2)C1	ZINC001132286544	1375267540	/nfs/dbraw/zinc/26/75/40/1375267540.db2.gz	BNBPIGXPAPHCIU-MSOLQXFVSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CCCC[C@H]1N[C@@H](C)c1cnc(C)cn1	ZINC001226522574	1375274612	/nfs/dbraw/zinc/27/46/12/1375274612.db2.gz	DWGWTPQEMLRAFK-GVDBMIGSSA-N	0	3	330.476	3.219	20	30		EGEDHN
COCCN1CCC(Oc2c(Cl)cc(C#N)cc2Cl)CC1	ZINC001226587268	1375286233	/nfs/dbraw/zinc/28/62/33/1375286233.db2.gz	FWQUAHOJLRREGI-UHFFFAOYSA-N	0	3	329.227	3.355	20	30		EGEDHN
Cc1cc(Cl)c(C(=O)NCCNCc2ccc(C#N)cc2)cc1C	ZINC001132324091	1375303781	/nfs/dbraw/zinc/30/37/81/1375303781.db2.gz	VVPJGXKMTUGWPS-UHFFFAOYSA-N	0	3	341.842	3.348	20	30		EGEDHN
C=C(Cl)CN1C[C@H](NC(=O)CN(C)CCCCCC)CC[C@@H]1C	ZINC001132365694	1375330256	/nfs/dbraw/zinc/33/02/56/1375330256.db2.gz	OFFJIHDPDBUFHK-DLBZAZTESA-N	0	3	343.943	3.220	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCN(C)c2ccccc2)CC[C@H]1C	ZINC001132365422	1375330479	/nfs/dbraw/zinc/33/04/79/1375330479.db2.gz	KCHFCMGXOYNWJQ-QZTJIDSGSA-N	0	3	329.488	3.058	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)C[C@@H](C)c1ccncc1	ZINC001227047706	1375382303	/nfs/dbraw/zinc/38/23/03/1375382303.db2.gz	LFVQLPALLZHXQR-KBRIMQKVSA-N	0	3	335.879	3.345	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2ccc(Cl)cc2)CC[C@H]1C	ZINC001132441332	1375385586	/nfs/dbraw/zinc/38/55/86/1375385586.db2.gz	NOAFXMRENBICQK-RHSMWYFYSA-N	0	3	336.863	3.125	20	30		EGEDHN
C#CCCCC(=O)NC1CCN(Cc2ccc3ncccc3c2)CC1	ZINC001227084619	1375386163	/nfs/dbraw/zinc/38/61/63/1375386163.db2.gz	AQHMEKZZFDSMLS-UHFFFAOYSA-N	0	3	335.451	3.119	20	30		EGEDHN
C#CCCCC(=O)NC1CCN([C@H]2CCc3ccc(F)cc32)CC1	ZINC001227107603	1375391243	/nfs/dbraw/zinc/39/12/43/1375391243.db2.gz	FSUIVBKPQDQBCA-IBGZPJMESA-N	0	3	328.431	3.197	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COc2ccc(OCC)cc2)CC[C@H]1C	ZINC001132460208	1375403486	/nfs/dbraw/zinc/40/34/86/1375403486.db2.gz	HGOJISLKDWSKAJ-SJORKVTESA-N	0	3	346.471	3.009	20	30		EGEDHN
Cc1ccccc1OCCCN1CCC(NC(=O)C#CC(C)C)CC1	ZINC001227220005	1375407943	/nfs/dbraw/zinc/40/79/43/1375407943.db2.gz	ILVWYUFPGOPUIT-UHFFFAOYSA-N	0	3	342.483	3.004	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCOc2ccccc2F)CC[C@H]1C	ZINC001132472111	1375411873	/nfs/dbraw/zinc/41/18/73/1375411873.db2.gz	BKTWRJVUJCKRJM-CVEARBPZSA-N	0	3	334.435	3.140	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)C23CC(C(C)(C)C)(C2)C3)CC[C@H]1C	ZINC001132525201	1375441979	/nfs/dbraw/zinc/44/19/79/1375441979.db2.gz	OYSOPKKHKOFGJR-UUBYJMPYSA-N	0	3	348.531	3.375	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1CC[C@H](C)N(Cc2cccc(CC)c2)C1	ZINC001132529285	1375443836	/nfs/dbraw/zinc/44/38/36/1375443836.db2.gz	LAKXOXXFFFMKIH-FXAWDEMLSA-N	0	3	344.499	3.311	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1CC[C@@H](C)N(Cc2ccc(C)cc2C)C1	ZINC001132532465	1375444720	/nfs/dbraw/zinc/44/47/20/1375444720.db2.gz	DIUCSWNFLVUYIL-UYAOXDASSA-N	0	3	344.499	3.365	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1CC[C@H](C)N(Cc2ccccc2C)C1	ZINC001132530325	1375444980	/nfs/dbraw/zinc/44/49/80/1375444980.db2.gz	WQZCJHNZSMSQIC-HKUYNNGSSA-N	0	3	330.472	3.057	20	30		EGEDHN
C=C(C)CCC(=O)NC1CCN(Cc2ccc(COC)cc2)CC1	ZINC001227588729	1375448228	/nfs/dbraw/zinc/44/82/28/1375448228.db2.gz	UKIVPMFKHYVWNY-UHFFFAOYSA-N	0	3	330.472	3.270	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)C2(C)C(C)(C)C2(C)C)CC[C@@H]1C	ZINC001132546550	1375453073	/nfs/dbraw/zinc/45/30/73/1375453073.db2.gz	NVOXKIITVTWGDR-HOTGVXAUSA-N	0	3	336.520	3.230	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)[C@H](C)CC)CC1	ZINC001132552814	1375459912	/nfs/dbraw/zinc/45/99/12/1375459912.db2.gz	ZTAJALGQRNIGEJ-UYAOXDASSA-N	0	3	341.499	3.334	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2N(Cc2ccsc2)C(=O)C2(C)CC2)CC1	ZINC001132562976	1375469112	/nfs/dbraw/zinc/46/91/12/1375469112.db2.gz	OAJHMHBLXLMYIY-KRWDZBQOSA-N	0	3	342.508	3.365	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2N(Cc2nccs2)C(=O)C(C)C)CC1	ZINC001132567444	1375471075	/nfs/dbraw/zinc/47/10/75/1375471075.db2.gz	YYBVTBITFFVDPG-INIZCTEOSA-N	0	3	345.512	3.006	20	30		EGEDHN
C#CCC1(C(=O)NC2CCN(C/C=C/c3ccccc3)CC2)CCC1	ZINC001227755015	1375471892	/nfs/dbraw/zinc/47/18/92/1375471892.db2.gz	WGOAQXKZEGGRBG-UXBLZVDNSA-N	0	3	336.479	3.474	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCCNCc1csc(Br)c1	ZINC001132667841	1375505581	/nfs/dbraw/zinc/50/55/81/1375505581.db2.gz	URKKEXLSUZTAFX-NSHDSACASA-N	0	3	345.306	3.319	20	30		EGEDHN
C=CCc1cc(OC)c(OC2CCN(C3CC3)CC2)c(C(=O)OC)c1	ZINC001228243709	1375532077	/nfs/dbraw/zinc/53/20/77/1375532077.db2.gz	ABKYASAPGMTSMC-UHFFFAOYSA-N	0	3	345.439	3.216	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](C)[C@H](CNCc2csc(CC)n2)C1	ZINC001132789573	1375565521	/nfs/dbraw/zinc/56/55/21/1375565521.db2.gz	LSTARPHHVFSFAW-JKSUJKDBSA-N	0	3	347.528	3.083	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](C)[C@@H](CNCc2csc(CC)n2)C1	ZINC001132789570	1375566128	/nfs/dbraw/zinc/56/61/28/1375566128.db2.gz	LSTARPHHVFSFAW-CVEARBPZSA-N	0	3	347.528	3.083	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](C)[C@@H](CNCc2cnc(C)o2)C1	ZINC001132845898	1375597084	/nfs/dbraw/zinc/59/70/84/1375597084.db2.gz	CJETVLXVDWNZMJ-ZBFHGGJFSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](C)[C@H](CNCc2cnc(C)o2)C1	ZINC001132845896	1375597377	/nfs/dbraw/zinc/59/73/77/1375597377.db2.gz	CJETVLXVDWNZMJ-GOEBONIOSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC001228747465	1375660136	/nfs/dbraw/zinc/66/01/36/1375660136.db2.gz	BAAFOQKDNVFBBS-JKSUJKDBSA-N	0	3	330.472	3.234	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](C)[C@H](CNCc2ccn(C(C)C)n2)C1	ZINC001133072544	1375758373	/nfs/dbraw/zinc/75/83/73/1375758373.db2.gz	ITJWHFOCVYNSAJ-QZTJIDSGSA-N	0	3	346.519	3.395	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@H](C)[C@H](CNCc3ocnc3C)C2)CC1	ZINC001133105784	1375778150	/nfs/dbraw/zinc/77/81/50/1375778150.db2.gz	XMLPJMJAIDZCDC-DOTOQJQBSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H]2CN(CCc3scnc3C)C[C@H]21	ZINC001188886220	1388400638	/nfs/dbraw/zinc/40/06/38/1388400638.db2.gz	UXNUBYXFARTLRZ-HYVNUMGLSA-N	0	3	347.528	3.129	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2ccc(C)cc2Cl)CC1	ZINC001229289878	1375804134	/nfs/dbraw/zinc/80/41/34/1375804134.db2.gz	QBFQUSNJIBSDHV-UHFFFAOYSA-N	0	3	336.863	3.045	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)[C@H](c2ccccc2)C(C)C)CC1	ZINC001229363559	1375818308	/nfs/dbraw/zinc/81/83/08/1375818308.db2.gz	NGYXRSRDHLPEBX-FQEVSTJZSA-N	0	3	344.499	3.209	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC1CCN(Cc2cccc(N(C)C)c2)CC1	ZINC001229377575	1375823149	/nfs/dbraw/zinc/82/31/49/1375823149.db2.gz	YVQDFMULDJQORX-UHFFFAOYSA-N	0	3	343.515	3.436	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@H]1CC=CCC1	ZINC001133376786	1375956574	/nfs/dbraw/zinc/95/65/74/1375956574.db2.gz	BNSGPELWUNLGBL-KRWDZBQOSA-N	0	3	330.859	3.248	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2sccc2C2CC2)CC1	ZINC001230188460	1375961270	/nfs/dbraw/zinc/96/12/70/1375961270.db2.gz	CZTWALNYDWLXCN-UHFFFAOYSA-N	0	3	334.485	3.022	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCNCc1ccc(Br)s1	ZINC001133383679	1375964561	/nfs/dbraw/zinc/96/45/61/1375964561.db2.gz	WKMNFSKXLIISFV-AWEZNQCLSA-N	0	3	345.306	3.319	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C1CC2(CCC2)C1	ZINC001133404110	1375990288	/nfs/dbraw/zinc/99/02/88/1375990288.db2.gz	YNBIYNIELURAFX-UHFFFAOYSA-N	0	3	344.886	3.472	20	30		EGEDHN
C=C[C@H](C(=O)NC1CCN(CCOCC(C)C)CC1)c1ccccc1	ZINC001230332160	1375999474	/nfs/dbraw/zinc/99/94/74/1375999474.db2.gz	VWMURPHXXDPFPO-FQEVSTJZSA-N	0	3	344.499	3.209	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2sccc2C(C)C)CC1	ZINC001230334226	1376001138	/nfs/dbraw/zinc/00/11/38/1376001138.db2.gz	MLOKMTNZPHYVLC-UHFFFAOYSA-N	0	3	336.501	3.268	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)c1ccccc1F)NCc1ccccc1C#N	ZINC001133525698	1376061569	/nfs/dbraw/zinc/06/15/69/1376061569.db2.gz	OXCOTEOVRPCBJG-CABCVRRESA-N	0	3	339.414	3.384	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)Cc1ccsc1)NCc1ccccc1C#N	ZINC001133563723	1376091665	/nfs/dbraw/zinc/09/16/65/1376091665.db2.gz	LRDDWWQYZWRXIS-GJZGRUSLSA-N	0	3	341.480	3.235	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N1CCC([C@@H]2CCCN2CC(=C)Cl)CC1	ZINC001230630892	1376109524	/nfs/dbraw/zinc/10/95/24/1376109524.db2.gz	WMFBWNKEMZGWCB-RDJZCZTQSA-N	0	3	340.895	3.033	20	30		EGEDHN
C#CCCN(CCCNC(=O)C=C(CC)CC)Cc1cccnc1	ZINC001230731800	1376137128	/nfs/dbraw/zinc/13/71/28/1376137128.db2.gz	NTXQCVBNJUBTMO-UHFFFAOYSA-N	0	3	327.472	3.160	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCCN(Cc1cccnc1)C[C@@H](C)OC	ZINC001230769562	1376144848	/nfs/dbraw/zinc/14/48/48/1376144848.db2.gz	XQXZRENLSCHKOI-QGZVFWFLSA-N	0	3	347.503	3.027	20	30		EGEDHN
C=CCC1(C(=O)NCCCN(CCCF)Cc2cccnc2)CCC1	ZINC001230839038	1376164198	/nfs/dbraw/zinc/16/41/98/1376164198.db2.gz	YOHULZMWOPHSRU-UHFFFAOYSA-N	0	3	347.478	3.496	20	30		EGEDHN
C#CCCN(CCCNC(=O)c1ccc(C=C)cc1)Cc1cccnc1	ZINC001230859621	1376166749	/nfs/dbraw/zinc/16/67/49/1376166749.db2.gz	HQXVAWCCYCAECW-UHFFFAOYSA-N	0	3	347.462	3.370	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)[C@H]1C[C@H]1C(C)C)Cc1cccnc1	ZINC001230882057	1376176413	/nfs/dbraw/zinc/17/64/13/1376176413.db2.gz	MGJNQPGQNRBAFU-OALUTQOASA-N	0	3	329.488	3.258	20	30		EGEDHN
CC(C)[C@H](Cc1ccccc1)C(=O)NCCNCc1cccc(C#N)c1	ZINC001133777073	1376203558	/nfs/dbraw/zinc/20/35/58/1376203558.db2.gz	UXNZVKUBRJLTKB-NRFANRHFSA-N	0	3	349.478	3.279	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)/C=C/C1CC1)NCc1cc(F)ccc1C#N	ZINC001134009867	1376311496	/nfs/dbraw/zinc/31/14/96/1376311496.db2.gz	YRHDJDGNPVBRSK-AMVTZNPPSA-N	0	3	329.419	3.036	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1ccccc1C#N)NC(=O)CCc1ccoc1	ZINC001134057221	1376337222	/nfs/dbraw/zinc/33/72/22/1376337222.db2.gz	WOYCXBSHIIMYAD-JKSUJKDBSA-N	0	3	339.439	3.157	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H](C)C[C@@H](C)NCc1cc(F)ccc1C#N	ZINC001134113767	1376374086	/nfs/dbraw/zinc/37/40/86/1376374086.db2.gz	FNFRSKCJEWBONK-CVEARBPZSA-N	0	3	343.446	3.264	20	30		EGEDHN
C#CCCCCC(=O)N[C@H](C)C[C@@H](C)NCc1cc(F)ccc1C#N	ZINC001134113769	1376374265	/nfs/dbraw/zinc/37/42/65/1376374265.db2.gz	FNFRSKCJEWBONK-HZPDHXFCSA-N	0	3	343.446	3.264	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H](C)C[C@H](C)NCc1nc2ccccc2o1	ZINC001134115214	1376375666	/nfs/dbraw/zinc/37/56/66/1376375666.db2.gz	QLQKXIQBFOKVDR-HOTGVXAUSA-N	0	3	341.455	3.394	20	30		EGEDHN
N#Cc1ccccc1OC1CCN(Cc2cc3c[nH]ccc-3n2)CC1	ZINC001232015900	1376383236	/nfs/dbraw/zinc/38/32/36/1376383236.db2.gz	NUTIEDLMZMSIAQ-UHFFFAOYSA-N	0	3	332.407	3.478	20	30		EGEDHN
C=CCOC[C@H]1CCC[C@@]12CN(Cc1cc3c[nH]ccc-3n1)CCO2	ZINC001232014949	1376384074	/nfs/dbraw/zinc/38/40/74/1376384074.db2.gz	PGMCVOMHSYVMPM-YLJYHZDGSA-N	0	3	341.455	3.137	20	30		EGEDHN
C=CCOC[C@H]1CCC[C@@]12CN(Cc1cc3cnccc3[nH]1)CCO2	ZINC001232014949	1376384080	/nfs/dbraw/zinc/38/40/80/1376384080.db2.gz	PGMCVOMHSYVMPM-YLJYHZDGSA-N	0	3	341.455	3.137	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)C#CC(C)(C)C)NCc1cc(F)ccc1C#N	ZINC001134330087	1376479935	/nfs/dbraw/zinc/47/99/35/1376479935.db2.gz	VLJNYDHAHOOLTB-CABCVRRESA-N	0	3	343.446	3.120	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@H](C)C[C@H](C)NCc1conc1CC	ZINC001134456761	1376547940	/nfs/dbraw/zinc/54/79/40/1376547940.db2.gz	CWQKILNYZLHRDE-NWDGAFQWSA-N	0	3	341.883	3.389	20	30		EGEDHN
CC(=O)N1CCCCC12CCN(Cc1ccc(C#N)cc1C)CC2	ZINC001233080942	1376567247	/nfs/dbraw/zinc/56/72/47/1376567247.db2.gz	HRHUCZMEFYLARL-UHFFFAOYSA-N	0	3	325.456	3.234	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)C[C@H](C)NCc2nc(C)c(C)s2)CCC1	ZINC001134587698	1376611085	/nfs/dbraw/zinc/61/10/85/1376611085.db2.gz	GDZBRYMHDUNTMU-UONOGXRCSA-N	0	3	347.528	3.326	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H](C)C[C@H](C)NCc1ncc(C)s1	ZINC001134637626	1376636619	/nfs/dbraw/zinc/63/66/19/1376636619.db2.gz	DNZHDUMGNIYUNM-UONOGXRCSA-N	0	3	346.500	3.126	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)Cc1ccccc1	ZINC001134765493	1376708086	/nfs/dbraw/zinc/70/80/86/1376708086.db2.gz	ZJGRTUYDGBQQDU-KBPBESRZSA-N	0	3	339.277	3.011	20	30		EGEDHN
CN(C[C@H]1CCN1CC/C=C\c1ccccc1)C(=O)c1c[nH]c(C#N)c1	ZINC001233743052	1376709418	/nfs/dbraw/zinc/70/94/18/1376709418.db2.gz	URGPBXOFEGTQKN-FMSOUQGNSA-N	0	3	348.450	3.136	20	30		EGEDHN
C#CCCCC(=O)N(C)C[C@@H]1CCN1Cc1c(C)cc(C)cc1C	ZINC001233914716	1376737236	/nfs/dbraw/zinc/73/72/36/1376737236.db2.gz	DNRVFVTWZAGNIO-IBGZPJMESA-N	0	3	326.484	3.448	20	30		EGEDHN
CN(C[C@@H]1CCN1CCCc1ccc(Cl)cc1)C(=O)C#CC1CC1	ZINC001234196403	1376783729	/nfs/dbraw/zinc/78/37/29/1376783729.db2.gz	TUDWSXWRIWHNJF-IBGZPJMESA-N	0	3	344.886	3.219	20	30		EGEDHN
C=CCCCN1CC[C@H]1CN(C)C(=O)c1ccc2oc(C)nc2c1	ZINC001235665555	1376883060	/nfs/dbraw/zinc/88/30/60/1376883060.db2.gz	LWRRLAXKULRDPV-INIZCTEOSA-N	0	3	327.428	3.249	20	30		EGEDHN
CC(C)(C)C(=O)Nc1ccc(CN)nc1-c1ccc(C#N)cc1F	ZINC001236524568	1376955568	/nfs/dbraw/zinc/95/55/68/1376955568.db2.gz	ZUOOQXGLXDZPBL-UHFFFAOYSA-N	0	3	326.375	3.203	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)C(C)(C)C1CC1)NCc1ccccc1C#N	ZINC001135248292	1377001513	/nfs/dbraw/zinc/00/15/13/1377001513.db2.gz	YGZWMNNFIOGTJV-CABCVRRESA-N	0	3	327.472	3.367	20	30		EGEDHN
Cc1cccc(CC(=O)N[C@H](C)C[C@@H](C)NCc2ccccc2C#N)c1	ZINC001135350324	1377048435	/nfs/dbraw/zinc/04/84/35/1377048435.db2.gz	SLRMBLOWACFHLD-QZTJIDSGSA-N	0	3	349.478	3.482	20	30		EGEDHN
C=CCCCNC(=S)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC001247735959	1377063599	/nfs/dbraw/zinc/06/35/99/1377063599.db2.gz	TWUKMZVJJPRQRU-SFHVURJKSA-N	0	3	331.529	3.424	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C[C@H](C)NCc2nccn2CC)CCC1	ZINC001135390888	1377069655	/nfs/dbraw/zinc/06/96/55/1377069655.db2.gz	NXFYGRCCFRREHS-JKSUJKDBSA-N	0	3	332.492	3.022	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1cc(F)ccc1C#N)NC(=O)C1(C)CC=CC1	ZINC001135411170	1377080436	/nfs/dbraw/zinc/08/04/36/1377080436.db2.gz	LROCGJXJPMFWRS-LSDHHAIUSA-N	0	3	343.446	3.427	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CCN(CCCc2cccc(OC)c2)C1	ZINC001266344303	1377284659	/nfs/dbraw/zinc/28/46/59/1377284659.db2.gz	GFDHETIDMBSDII-GOSISDBHSA-N	0	3	344.499	3.421	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)C[C@@H](C)CC(C)(C)C)[C@@H]2C1	ZINC001189230677	1388490459	/nfs/dbraw/zinc/49/04/59/1388490459.db2.gz	VFCNVCZMKRBNGN-FGTMMUONSA-N	0	3	336.520	3.184	20	30		EGEDHN
O=C(C1CC2(CC2)C1)N1CCCC[C@@H]1CNCC#Cc1ccccc1	ZINC001266877645	1377399139	/nfs/dbraw/zinc/39/91/39/1377399139.db2.gz	FJYPUEDHYBXLCU-HXUWFJFHSA-N	0	3	336.479	3.199	20	30		EGEDHN
C=CCO[C@H]1CO[C@]2(C1)CCCN(Cc1ccc3c(c1)COC3)C2	ZINC001137025369	1377460378	/nfs/dbraw/zinc/46/03/78/1377460378.db2.gz	BTLYCOCPEDJNQF-UXHICEINSA-N	0	3	329.440	3.043	20	30		EGEDHN
COc1nc2ccccc2cc1CN1CCC2SC(=O)C=C2C1	ZINC001137202218	1377495908	/nfs/dbraw/zinc/49/59/08/1377495908.db2.gz	BYUYOWUZPDPIGR-MRXNPFEDSA-N	0	3	326.421	3.018	20	30		EGEDHN
C[C@](CNCc1cc(C#N)ccc1F)(NC(=O)CC1(C)CC1)C1CC1	ZINC001269625742	1377559885	/nfs/dbraw/zinc/55/98/85/1377559885.db2.gz	AXPLOIRJYZVVHI-HXUWFJFHSA-N	0	3	343.446	3.262	20	30		EGEDHN
CC(C)(C)N1CCN(Cc2ccc(C#N)cc2Br)CC1	ZINC001137637921	1377578952	/nfs/dbraw/zinc/57/89/52/1377578952.db2.gz	FMDAUCMBSXDUSJ-UHFFFAOYSA-N	0	3	336.277	3.237	20	30		EGEDHN
Cc1ccc2[nH]c(CN3CCCN(c4ccc(C#N)cn4)CC3)cc2c1	ZINC001138420360	1377720820	/nfs/dbraw/zinc/72/08/20/1377720820.db2.gz	YWYUIOMTFICASD-UHFFFAOYSA-N	0	3	345.450	3.455	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2C[C@@H]3C(=O)Nc4ccccc4[C@H]3C2)c1[O-]	ZINC001138625927	1377756227	/nfs/dbraw/zinc/75/62/27/1377756227.db2.gz	XBACKNFQXQRYAE-MSOLQXFVSA-N	0	3	334.419	3.288	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2C[C@@H]3C(=O)Nc4ccccc4[C@H]3C2)c1[O-]	ZINC001138625927	1377756228	/nfs/dbraw/zinc/75/62/28/1377756228.db2.gz	XBACKNFQXQRYAE-MSOLQXFVSA-N	0	3	334.419	3.288	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@]3(CCN(CC=C)C3=O)C2)c1[O-]	ZINC001138626829	1377756236	/nfs/dbraw/zinc/75/62/36/1377756236.db2.gz	PXJBGIDBPUHKJO-NRFANRHFSA-N	0	3	340.467	3.121	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@]3(CCN(CC=C)C3=O)C2)c1[O-]	ZINC001138626829	1377756237	/nfs/dbraw/zinc/75/62/37/1377756237.db2.gz	PXJBGIDBPUHKJO-NRFANRHFSA-N	0	3	340.467	3.121	20	30		EGEDHN
CCn1nc(C)c(CN2CCC[C@H](Oc3ccc(C#N)cc3)C2)c1C	ZINC001138646188	1377762149	/nfs/dbraw/zinc/76/21/49/1377762149.db2.gz	AEFBNBDBTSYVGD-IBGZPJMESA-N	0	3	338.455	3.435	20	30		EGEDHN
N#Cc1cccc(O[C@H]2CCCN(Cc3cnc4[nH]ccc4c3)C2)c1	ZINC001138737615	1377775741	/nfs/dbraw/zinc/77/57/41/1377775741.db2.gz	JKFSFNKRGUIGEU-IBGZPJMESA-N	0	3	332.407	3.478	20	30		EGEDHN
C=CCOC(=O)N[C@@H]1CCCN(Cc2ccc3cc(O)ccc3c2)C1	ZINC001139340144	1377871045	/nfs/dbraw/zinc/87/10/45/1377871045.db2.gz	JHCFAFMNDBGBKC-GOSISDBHSA-N	0	3	340.423	3.422	20	30		EGEDHN
N#Cc1ccc(Oc2ccc(CN3CC[C@]4(CCOC4)C3)cn2)cc1	ZINC001139426724	1377882200	/nfs/dbraw/zinc/88/22/00/1377882200.db2.gz	KMPGQBICQYGWEH-FQEVSTJZSA-N	0	3	335.407	3.358	20	30		EGEDHN
CCOC(=O)[C@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]2CCCC[C@@H]12	ZINC001139526680	1377897245	/nfs/dbraw/zinc/89/72/45/1377897245.db2.gz	FNSHWZASFYIEEP-KURKYZTESA-N	0	3	344.430	3.499	20	30		EGEDHN
Cc1cc(CN2CCN(c3cccc(C#N)c3)CC2)ccc1N(C)C	ZINC001139673194	1377931427	/nfs/dbraw/zinc/93/14/27/1377931427.db2.gz	CBQAHJNNQBWGQE-UHFFFAOYSA-N	0	3	334.467	3.255	20	30		EGEDHN
CCc1nc(C2CCN(Cc3c[nH]c4c3cccc4C#N)CC2)no1	ZINC001139705945	1377938058	/nfs/dbraw/zinc/93/80/58/1377938058.db2.gz	HKELLKLTHOUKCK-UHFFFAOYSA-N	0	3	335.411	3.365	20	30		EGEDHN
COC(=O)c1cccc(CN(C)Cc2c[nH]c3c2cccc3C#N)c1	ZINC001139707382	1377938187	/nfs/dbraw/zinc/93/81/87/1377938187.db2.gz	YNRVVUWNPLHKEL-UHFFFAOYSA-N	0	3	333.391	3.458	20	30		EGEDHN
CCc1noc(C2CCN(Cc3c[nH]c4c3cccc4C#N)CC2)n1	ZINC001139706485	1377938253	/nfs/dbraw/zinc/93/82/53/1377938253.db2.gz	WBEDSMKGWQIICV-UHFFFAOYSA-N	0	3	335.411	3.365	20	30		EGEDHN
Cc1cccc(O[C@@H]2CCN(Cc3c[nH]c4c3cccc4C#N)C2)n1	ZINC001139707864	1377939232	/nfs/dbraw/zinc/93/92/32/1377939232.db2.gz	WHYVCIMHVGTNIW-QGZVFWFLSA-N	0	3	332.407	3.396	20	30		EGEDHN
COC(=O)[C@@H]1CN(Cc2cc(F)cc(C#N)c2)C[C@H]1c1ccccc1	ZINC001139879802	1377970664	/nfs/dbraw/zinc/97/06/64/1377970664.db2.gz	UEXJCXIRFSCNNB-RBUKOAKNSA-N	0	3	338.382	3.086	20	30		EGEDHN
COC(=O)[C@@H]1CN(Cc2cc(F)cc(C#N)c2)C[C@@H]1c1ccccc1	ZINC001139879803	1377970797	/nfs/dbraw/zinc/97/07/97/1377970797.db2.gz	UEXJCXIRFSCNNB-RTBURBONSA-N	0	3	338.382	3.086	20	30		EGEDHN
C=C(C)CN1C(=O)CC[C@@H]2[C@H]1CCN2Cc1ccccc1OCC	ZINC001272618372	1378076531	/nfs/dbraw/zinc/07/65/31/1378076531.db2.gz	GUHJGWDQGHJPBX-QZTJIDSGSA-N	0	3	328.456	3.227	20	30		EGEDHN
C=C(C)CNC(=O)[C@H]1CC12CCN(Cc1ccc(C)c(F)c1)CC2	ZINC001272686419	1378078770	/nfs/dbraw/zinc/07/87/70/1378078770.db2.gz	JZEXTTOVHHPQTC-QGZVFWFLSA-N	0	3	330.447	3.429	20	30		EGEDHN
COC(=O)[C@@H](c1ccccc1)[C@H]1CCCCN1Cc1ccc(C#N)nc1	ZINC001140545940	1378082845	/nfs/dbraw/zinc/08/28/45/1378082845.db2.gz	QNNUXBGEKNPCQW-UXHICEINSA-N	0	3	349.434	3.265	20	30		EGEDHN
C=CCNC(=O)[C@H]1CC12CCN(Cc1[nH]c3ccccc3c1C)CC2	ZINC001273326373	1378098041	/nfs/dbraw/zinc/09/80/41/1378098041.db2.gz	CQGWSWLELRVAGZ-QGZVFWFLSA-N	0	3	337.467	3.381	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@@H]3[C@H]2CCC(=O)N3CCCC)c1[O-]	ZINC001273360779	1378098664	/nfs/dbraw/zinc/09/86/64/1378098664.db2.gz	VZVOLZRFALPDAC-RTBURBONSA-N	0	3	342.483	3.486	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@@H]3[C@H]2CCC(=O)N3CCCC)c1[O-]	ZINC001273360779	1378098666	/nfs/dbraw/zinc/09/86/66/1378098666.db2.gz	VZVOLZRFALPDAC-RTBURBONSA-N	0	3	342.483	3.486	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1sc(CC)nc1C	ZINC001275724720	1378153451	/nfs/dbraw/zinc/15/34/51/1378153451.db2.gz	AHIKTLIUEOSJFO-UHFFFAOYSA-N	0	3	343.924	3.454	20	30		EGEDHN
C=CCc1cccc(C[NH2+]C23CC(C(=O)N(CC)C(C)C)(C2)C3)c1[O-]	ZINC001277463521	1378224167	/nfs/dbraw/zinc/22/41/67/1378224167.db2.gz	LKCTVGASKPEGQR-UHFFFAOYSA-N	0	3	342.483	3.390	20	30		EGEDHN
N#CC1(NC(=O)C23CC(NCc4ccc(F)cc4Cl)(C2)C3)CCC1	ZINC001278273424	1378265923	/nfs/dbraw/zinc/26/59/23/1378265923.db2.gz	XMIGCBIYXNFPDW-UHFFFAOYSA-N	0	3	347.821	3.054	20	30		EGEDHN
CC[C@@H](CNC(=O)c1ccc(C)c(C#N)c1)N1CCc2ccccc2C1	ZINC001141569293	1378345007	/nfs/dbraw/zinc/34/50/07/1378345007.db2.gz	FPDRGBRXIUXJST-NRFANRHFSA-N	0	3	347.462	3.433	20	30		EGEDHN
CN(CCC1OCCO1)Cc1ccc(C#Cc2ccccc2)s1	ZINC001141977977	1378400659	/nfs/dbraw/zinc/40/06/59/1378400659.db2.gz	VJVUBGGZSBGDGB-UHFFFAOYSA-N	0	3	327.449	3.343	20	30		EGEDHN
N#Cc1ccc2c(CN3CCC(Oc4cccnc4)CC3)c[nH]c2c1	ZINC001142920780	1378509408	/nfs/dbraw/zinc/50/94/08/1378509408.db2.gz	BITIEKLMJJGIOC-UHFFFAOYSA-N	0	3	332.407	3.478	20	30		EGEDHN
CC(C)C(=O)N(C)C1CCN(Cc2c[nH]c3cc(C#N)ccc23)CC1	ZINC001142925603	1378509837	/nfs/dbraw/zinc/50/98/37/1378509837.db2.gz	AHLPEGXZAYLBIY-UHFFFAOYSA-N	0	3	338.455	3.118	20	30		EGEDHN
CCc1nnc(C2CCN(Cc3c[nH]c4cc(C#N)ccc34)CC2)o1	ZINC001142922602	1378510013	/nfs/dbraw/zinc/51/00/13/1378510013.db2.gz	NLIRNZCGCLFDOY-UHFFFAOYSA-N	0	3	335.411	3.365	20	30		EGEDHN
Cc1cnc(O[C@@H]2CCCN(Cc3c[nH]c4cc(C#N)ccc34)C2)nc1	ZINC001142932335	1378511334	/nfs/dbraw/zinc/51/13/34/1378511334.db2.gz	YXUGESZWUUJKGX-QGZVFWFLSA-N	0	3	347.422	3.181	20	30		EGEDHN
COc1cccnc1O[C@H]1CCN(Cc2c[nH]c3cc(C#N)ccc23)C1	ZINC001142932114	1378511511	/nfs/dbraw/zinc/51/15/11/1378511511.db2.gz	YBTSFTJMOMJUQE-INIZCTEOSA-N	0	3	348.406	3.096	20	30		EGEDHN
N#Cc1cccc(O[C@H]2CCCN(Cc3cccn4ccnc34)C2)c1	ZINC001142962279	1378518130	/nfs/dbraw/zinc/51/81/30/1378518130.db2.gz	WJUDYLZDHLPSDK-IBGZPJMESA-N	0	3	332.407	3.249	20	30		EGEDHN
CC(C)c1cccc(C(=O)NCCNCc2ccc(C#N)s2)c1	ZINC001146623072	1378878845	/nfs/dbraw/zinc/87/88/45/1378878845.db2.gz	GXSXDXNKPQCSGO-UHFFFAOYSA-N	0	3	327.453	3.263	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2cnc(C)cn2)CCCC1	ZINC001146819524	1378926970	/nfs/dbraw/zinc/92/69/70/1378926970.db2.gz	AUJUECGDMNEVSS-HOTGVXAUSA-N	0	3	344.503	3.294	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2cnc(C)o2)CCCC1	ZINC001146819604	1378927295	/nfs/dbraw/zinc/92/72/95/1378927295.db2.gz	BFYIMGVTSIDLGQ-CABCVRRESA-N	0	3	333.476	3.492	20	30		EGEDHN
C#CCCCC(=O)N1CC2(C1)CCN(Cc1c(C)cccc1Cl)C2	ZINC001147428523	1379019504	/nfs/dbraw/zinc/01/95/04/1379019504.db2.gz	VCXULNIMYCYOKP-UHFFFAOYSA-N	0	3	344.886	3.486	20	30		EGEDHN
C#CCCCC(=O)N1CC2(C1)CCN([C@@H]1CCc3ccc(F)cc31)C2	ZINC001147434735	1379019953	/nfs/dbraw/zinc/01/99/53/1379019953.db2.gz	IKDCISHJFOCMBD-LJQANCHMSA-N	0	3	340.442	3.151	20	30		EGEDHN
C=CCCCC(=O)N1CC2(C1)CCN(CCc1ccc(F)c(F)c1)C2	ZINC001148193968	1379131400	/nfs/dbraw/zinc/13/14/00/1379131400.db2.gz	OEVQZPYFZGWICE-UHFFFAOYSA-N	0	3	348.437	3.398	20	30		EGEDHN
C=CCOc1ccc(C(=O)N(C)CCN(C)Cc2ccccc2)cc1	ZINC001148463764	1379177964	/nfs/dbraw/zinc/17/79/64/1379177964.db2.gz	OZZRRBDVDJGHRV-UHFFFAOYSA-N	0	3	338.451	3.455	20	30		EGEDHN
CC(C)(C)c1ccc(C(=O)NCCNCc2ccc(C#N)s2)cc1	ZINC001148751426	1379260572	/nfs/dbraw/zinc/26/05/72/1379260572.db2.gz	JJXQTQXTJZVVRH-UHFFFAOYSA-N	0	3	341.480	3.437	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc3ccccc3c2)cc1	ZINC001148881381	1379289950	/nfs/dbraw/zinc/28/99/50/1379289950.db2.gz	PFFJQCHYWZXZET-UHFFFAOYSA-N	0	3	329.403	3.231	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@@H]1CN(CC2=CCCCC2)CCCO1	ZINC001149780399	1379444574	/nfs/dbraw/zinc/44/45/74/1379444574.db2.gz	GBTFDJRHKQFZRS-GOSISDBHSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@H]1CN(Cc2cc(C)ccc2C)CCCO1	ZINC001149788320	1379447065	/nfs/dbraw/zinc/44/70/65/1379447065.db2.gz	FEFAPUMZPKTZIO-FQEVSTJZSA-N	0	3	344.499	3.367	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@H]1CN(Cc2ccc(C)cc2C)CCCO1	ZINC001149796737	1379447559	/nfs/dbraw/zinc/44/75/59/1379447559.db2.gz	NITLRDCHUKFHID-FQEVSTJZSA-N	0	3	344.499	3.367	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H]1CN(Cc2ccc(C)cc2)CCCO1	ZINC001150077890	1379491511	/nfs/dbraw/zinc/49/15/11/1379491511.db2.gz	FLWFFXLRMSEQGO-LJQANCHMSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H]1CN(Cc2ccc(CC)cc2)CCCO1	ZINC001150213156	1379516937	/nfs/dbraw/zinc/51/69/37/1379516937.db2.gz	WIHUEWHWTNUEOG-HXUWFJFHSA-N	0	3	344.499	3.312	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@@H]1CN(Cc2ccc(C)cc2)CCCO1	ZINC001150253694	1379522725	/nfs/dbraw/zinc/52/27/25/1379522725.db2.gz	FREBXONIGBONQC-CTNGQTDRSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)[C@H](c2ccccc2)C(C)C)C1	ZINC001150380036	1379542152	/nfs/dbraw/zinc/54/21/52/1379542152.db2.gz	OLXGYYYJSJDWKT-UXHICEINSA-N	0	3	344.499	3.209	20	30		EGEDHN
CCc1cc(C(=O)NCCNCc2cccc(C#N)c2)sc1C	ZINC001150387827	1379544611	/nfs/dbraw/zinc/54/46/11/1379544611.db2.gz	PZVNZLDIXCZCRY-UHFFFAOYSA-N	0	3	327.453	3.010	20	30		EGEDHN
Cc1cc(C(=O)NCCNCc2ccc(C#N)s2)c(C)n1C(C)C	ZINC001150508596	1379559978	/nfs/dbraw/zinc/55/99/78/1379559978.db2.gz	AWMGYJZAWZTHRT-UHFFFAOYSA-N	0	3	344.484	3.139	20	30		EGEDHN
C#CCCN1CCCO[C@@H](CNC(=O)CCCCCCCCC)C1	ZINC001150641806	1379586649	/nfs/dbraw/zinc/58/66/49/1379586649.db2.gz	YXANYROCXNKLKF-IBGZPJMESA-N	0	3	336.520	3.358	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2ccc([C@H]3C[C@H]3C)o2)CC1	ZINC001151128608	1379665230	/nfs/dbraw/zinc/66/52/30/1379665230.db2.gz	QGKMTBUEGSOXDE-CVEARBPZSA-N	0	3	346.471	3.190	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@H]2CCC(C)=C(C)C2)CC1	ZINC001151144155	1379666930	/nfs/dbraw/zinc/66/69/30/1379666930.db2.gz	CAESXWODFRLXGY-SFHVURJKSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)C[C@@H](C)c2ccccc2)CC1	ZINC001151406300	1379712565	/nfs/dbraw/zinc/71/25/65/1379712565.db2.gz	AONBPUVQEXSZLX-GOSISDBHSA-N	0	3	344.499	3.354	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)/C=C/c1ccco1	ZINC001151597680	1379743834	/nfs/dbraw/zinc/74/38/34/1379743834.db2.gz	QOHZKJXVSBIFIX-SIFUEBAJSA-N	0	3	337.423	3.191	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)c1cccc(F)c1	ZINC001151648366	1379755898	/nfs/dbraw/zinc/75/58/98/1379755898.db2.gz	KARSSCRKDDAUIB-OAHLLOKOSA-N	0	3	339.414	3.338	20	30		EGEDHN
CCN(Cc1ccc(OC)c(C#N)c1)[C@H](C)CNC(=O)CCC(C)C	ZINC001151765795	1379775607	/nfs/dbraw/zinc/77/56/07/1379775607.db2.gz	BMNPLJKCJBNSQR-MRXNPFEDSA-N	0	3	345.487	3.330	20	30		EGEDHN
C=CC[C@@H](C(=O)NCCNCc1ccc(C#N)s1)c1ccccc1	ZINC001151838079	1379793253	/nfs/dbraw/zinc/79/32/53/1379793253.db2.gz	HYZLXRYMOMONDH-GOSISDBHSA-N	0	3	339.464	3.185	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)C(=O)NCCNCc1ccc(C#N)cc1	ZINC001151922784	1379816192	/nfs/dbraw/zinc/81/61/92/1379816192.db2.gz	FHWDEZYIVPIQLR-OAQYLSRUSA-N	0	3	347.462	3.199	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)/C=C(/C)C1CC1	ZINC001152128119	1379868157	/nfs/dbraw/zinc/86/81/57/1379868157.db2.gz	GJQUAWZMQYBSPY-DDITZMBXSA-N	0	3	325.456	3.241	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)C[C@@H](C)SC	ZINC001152820464	1379983199	/nfs/dbraw/zinc/98/31/99/1379983199.db2.gz	FHUQRFHZWDFMCJ-HUUCEWRRSA-N	0	3	333.501	3.026	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H](C)N(CC)Cc1ccccc1N(C)C	ZINC001152867392	1379988232	/nfs/dbraw/zinc/98/82/32/1379988232.db2.gz	NXROFPZQGHVRJE-GOSISDBHSA-N	0	3	343.515	3.273	20	30		EGEDHN
C#CC[C@@H](CC(=O)NCCNCc1ccc(C)nc1C)c1ccccc1	ZINC001153715135	1380117558	/nfs/dbraw/zinc/11/75/58/1380117558.db2.gz	YEBWXUPKFOWOPC-FQEVSTJZSA-N	0	3	349.478	3.101	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)[C@@H](C)C1CCC1	ZINC001153974947	1380166527	/nfs/dbraw/zinc/16/65/27/1380166527.db2.gz	RRFDMAHIUHZQIK-CABCVRRESA-N	0	3	345.462	3.460	20	30		EGEDHN
Cc1ccc(/C=C/CC(=O)NCCNCc2ccc(C#N)s2)cc1	ZINC001153979386	1380167550	/nfs/dbraw/zinc/16/75/50/1380167550.db2.gz	AMALIWRACBWFBO-NSCUHMNNSA-N	0	3	339.464	3.238	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)C1(C2CC2)CCC1	ZINC001154500834	1380291947	/nfs/dbraw/zinc/29/19/47/1380291947.db2.gz	MPHASFDZJQQDOV-MRXNPFEDSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C1(c2cccc(C)c2)CCC1	ZINC001154545645	1380302804	/nfs/dbraw/zinc/30/28/04/1380302804.db2.gz	IFINVMXCMTVSPW-GOSISDBHSA-N	0	3	326.484	3.267	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)c(F)c1	ZINC001155112746	1380411206	/nfs/dbraw/zinc/41/12/06/1380411206.db2.gz	VFJXPQOUXLIYOL-QGPMSJSTSA-N	0	3	345.462	3.460	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)C1(C(C)C)CC1	ZINC001155142615	1380415784	/nfs/dbraw/zinc/41/57/84/1380415784.db2.gz	XPYUIQAXIHRHKH-MRXNPFEDSA-N	0	3	327.472	3.321	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)C1(C)CC(F)(F)C1	ZINC001156318975	1380557234	/nfs/dbraw/zinc/55/72/34/1380557234.db2.gz	KUYSKEQOQVBLPR-CQSZACIVSA-N	0	3	349.425	3.320	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1cc(Cl)cc(Cl)c1	ZINC001156579043	1380596087	/nfs/dbraw/zinc/59/60/87/1380596087.db2.gz	LXJQKCUJNWRHDR-GFCCVEGCSA-N	0	3	327.255	3.457	20	30		EGEDHN
C=C(C)C(=O)NCCCNc1nc(N2CCCC2)cc2ccccc21	ZINC001156826156	1380656596	/nfs/dbraw/zinc/65/65/96/1380656596.db2.gz	MTQZZOWUMLRYPA-UHFFFAOYSA-N	0	3	338.455	3.329	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)s1)[C@@H](C)NC(=O)CCC(C)(F)F	ZINC001755239696	1440789087	/nfs/dbraw/zinc/78/90/87/1440789087.db2.gz	GFDUNEZCIJMURY-GHMZBOCLSA-N	0	3	329.416	3.038	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)CCCc1cc(C)ccc1C	ZINC001157035176	1380756484	/nfs/dbraw/zinc/75/64/84/1380756484.db2.gz	IVRGQKQIWZLYMR-LJQANCHMSA-N	0	3	328.500	3.476	20	30		EGEDHN
C#CCCCC(=O)NCCCNCc1nc(-c2ccccc2)cs1	ZINC001157171891	1380794997	/nfs/dbraw/zinc/79/49/97/1380794997.db2.gz	YRIZRPLQIWBPIB-UHFFFAOYSA-N	0	3	341.480	3.210	20	30		EGEDHN
C=C(Cl)CNCC1(O)CCN(C(=O)[C@H](CCCC)C(C)C)CC1	ZINC001328218174	1388690589	/nfs/dbraw/zinc/69/05/89/1388690589.db2.gz	YSJMPDFOVBLTCL-MRXNPFEDSA-N	0	3	344.927	3.144	20	30		EGEDHN
C=CCOCC(=O)N1CCCC[C@@H]1CN(C)C/C=C/c1ccccc1	ZINC001157701423	1381008324	/nfs/dbraw/zinc/00/83/24/1381008324.db2.gz	FOALVQDNSWJXIK-RGFVMQALSA-N	0	3	342.483	3.215	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1ccoc1Cl	ZINC001157875977	1381056089	/nfs/dbraw/zinc/05/60/89/1381056089.db2.gz	GEPWRTRSHBIGJK-CQSZACIVSA-N	0	3	340.851	3.062	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)COc1cc(C)ccc1F	ZINC001157957702	1381081445	/nfs/dbraw/zinc/08/14/45/1381081445.db2.gz	GDZOVBVFUXFBGR-MRXNPFEDSA-N	0	3	334.435	3.012	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H]1CCc2cc(OC)ccc21	ZINC001158061869	1381116586	/nfs/dbraw/zinc/11/65/86/1381116586.db2.gz	SSBRNYGMRKCDAF-XLIONFOSSA-N	0	3	342.483	3.224	20	30		EGEDHN
C=C(Cl)Cn1c(C(C)C)nnc1N1C[C@@H](C)N(CC)C[C@H]1C	ZINC001286620523	1381121964	/nfs/dbraw/zinc/12/19/64/1381121964.db2.gz	NOCVJAHTRSWYNI-ZIAGYGMSSA-N	0	3	325.888	3.073	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)CCC(C)(F)F)CCN1Cc1ccc(C#N)cc1	ZINC001328260650	1388702558	/nfs/dbraw/zinc/70/25/58/1388702558.db2.gz	SVXXKSVHSSJBIU-WMLDXEAASA-N	0	3	349.425	3.463	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cnc2c(F)cccc2c1	ZINC001158233215	1381169741	/nfs/dbraw/zinc/16/97/41/1381169741.db2.gz	LAHVIMXVMDRXFE-QGZVFWFLSA-N	0	3	341.430	3.486	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCCN1C(=O)CCC(F)F	ZINC001158233669	1381170799	/nfs/dbraw/zinc/17/07/99/1381170799.db2.gz	RHYIXBKGRYCMJU-QGZVFWFLSA-N	0	3	349.425	3.416	20	30		EGEDHN
C=CCCCC(=O)N1CCCC[C@@H]1CN(C)C[C@@H]1CC(C)(C)CO1	ZINC001158418922	1381240405	/nfs/dbraw/zinc/24/04/05/1381240405.db2.gz	DCVOCHWQCQQEOW-MSOLQXFVSA-N	0	3	336.520	3.471	20	30		EGEDHN
Cc1c(F)cccc1C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001158526151	1381283059	/nfs/dbraw/zinc/28/30/59/1381283059.db2.gz	OOLZCCCILDSNHV-UHFFFAOYSA-N	0	3	343.377	3.055	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1CCOc2ccccc21	ZINC001158616997	1381323430	/nfs/dbraw/zinc/32/34/30/1381323430.db2.gz	WSNDYGIFXKFYOF-SJLPKXTDSA-N	0	3	328.456	3.052	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cncc(C(F)(F)F)c1	ZINC001158689199	1381354666	/nfs/dbraw/zinc/35/46/66/1381354666.db2.gz	BLPIPJDVHDTOCP-OAHLLOKOSA-N	0	3	341.377	3.213	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cnn([C@H](C)CC)c1C	ZINC001158732157	1381374324	/nfs/dbraw/zinc/37/43/24/1381374324.db2.gz	KZPJHXBRBUVVNX-NVXWUHKLSA-N	0	3	332.492	3.275	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)COc1cccc(Cl)c1	ZINC001158838201	1381425488	/nfs/dbraw/zinc/42/54/88/1381425488.db2.gz	ULFGZNWFFGKUKH-MRXNPFEDSA-N	0	3	336.863	3.218	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)CC1(c2ccccc2)CC1	ZINC001159552926	1381828154	/nfs/dbraw/zinc/82/81/54/1381828154.db2.gz	HFTZQLXEHXKKKC-UHFFFAOYSA-N	0	3	347.462	3.276	20	30		EGEDHN
C[C@@H](C(=O)NCCC1=CCN(Cc2ccc(C#N)cc2)CC1)C1CC1	ZINC001159717088	1381878032	/nfs/dbraw/zinc/87/80/32/1381878032.db2.gz	BMOTXROJGSPKAH-MRXNPFEDSA-N	0	3	337.467	3.243	20	30		EGEDHN
N#Cc1cc(Nc2ccc(Cl)cc2[O-])ccc1N1CC[NH2+]CC1	ZINC001159748903	1381888355	/nfs/dbraw/zinc/88/83/55/1381888355.db2.gz	NXBVCUFNPYYCRM-UHFFFAOYSA-N	0	3	328.803	3.070	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc(-c3ccncc3)o2)CC1	ZINC001160353098	1382081478	/nfs/dbraw/zinc/08/14/78/1382081478.db2.gz	PMSRSRYOYHXBKI-UHFFFAOYSA-N	0	3	337.423	3.280	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc(C)n([C@@H](C)CC)n2)CC1	ZINC001160580931	1382147888	/nfs/dbraw/zinc/14/78/88/1382147888.db2.gz	YUPOLHTXJWRNKF-HNNXBMFYSA-N	0	3	330.476	3.101	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H](c2ccccc2)C2CC2)CC1	ZINC001160671466	1382166410	/nfs/dbraw/zinc/16/64/10/1382166410.db2.gz	JRQSWUUMBYVYRA-NRFANRHFSA-N	0	3	336.479	3.342	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C(C)(C)c2cccs2)CC1	ZINC001160860493	1382218010	/nfs/dbraw/zinc/21/80/10/1382218010.db2.gz	JBNHFMXAKGVMDC-UHFFFAOYSA-N	0	3	330.497	3.187	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCC1=CCN(CCc2ccns2)CC1	ZINC001160940873	1382243608	/nfs/dbraw/zinc/24/36/08/1382243608.db2.gz	HFGXRTUVNIGGEJ-HOTGVXAUSA-N	0	3	347.528	3.282	20	30		EGEDHN
C=CCN1CCC[C@H]1CNc1nc2ccccc2cc1C(=O)OC	ZINC001160954236	1382250368	/nfs/dbraw/zinc/25/03/68/1382250368.db2.gz	SOMXCGHKQWNORX-HNNXBMFYSA-N	0	3	325.412	3.084	20	30		EGEDHN
CCCCCCCCCCN(C)C(=O)[C@@H]1CNCc2ccnn2C1	ZINC001161220749	1382346062	/nfs/dbraw/zinc/34/60/62/1382346062.db2.gz	ATEQWYWQHIUEQC-QGZVFWFLSA-N	0	3	334.508	3.202	20	30		EGEDHN
CCCCCCCCCCN(C)C(=O)[C@H]1CNCc2ccnn2C1	ZINC001161220748	1382346433	/nfs/dbraw/zinc/34/64/33/1382346433.db2.gz	ATEQWYWQHIUEQC-KRWDZBQOSA-N	0	3	334.508	3.202	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H](CC)Oc2ccccc2C)CC1	ZINC001161356234	1382381005	/nfs/dbraw/zinc/38/10/05/1382381005.db2.gz	GWYQPQRNNABDTD-LJQANCHMSA-N	0	3	342.483	3.477	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)Cc2ccc(Cl)s2)CC1	ZINC001161417766	1382403450	/nfs/dbraw/zinc/40/34/50/1382403450.db2.gz	VGDGDBNKZVYWSX-UHFFFAOYSA-N	0	3	336.888	3.106	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@H]1CCC[C@H]1CCC	ZINC001161419854	1382404514	/nfs/dbraw/zinc/40/45/14/1382404514.db2.gz	UPINRRPWHJZOCS-KGLIPLIRSA-N	0	3	331.298	3.207	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CCOc2cc(C)ccc2C)CC1	ZINC001161814168	1382516971	/nfs/dbraw/zinc/51/69/71/1382516971.db2.gz	WLJDLUOIPMIICQ-UHFFFAOYSA-N	0	3	342.483	3.397	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)CCCOc2ccccc2)CC1	ZINC001161817638	1382517558	/nfs/dbraw/zinc/51/75/58/1382517558.db2.gz	APHLJXWPWNJFNK-UHFFFAOYSA-N	0	3	340.467	3.007	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc3ncsc3c2)CC1	ZINC001161817953	1382518895	/nfs/dbraw/zinc/51/88/95/1382518895.db2.gz	JUPCXPYBDMXSAK-UHFFFAOYSA-N	0	3	339.464	3.072	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)COc2cc(C)ccc2C)CC1	ZINC001161856874	1382533016	/nfs/dbraw/zinc/53/30/16/1382533016.db2.gz	KMKIWOHSTLPHAR-UHFFFAOYSA-N	0	3	328.456	3.007	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H](C)COc2ccccc2)CC1	ZINC001161883987	1382539417	/nfs/dbraw/zinc/53/94/17/1382539417.db2.gz	GAGXIHTVHYFIFB-QGZVFWFLSA-N	0	3	328.456	3.026	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H]2Cc3c2cccc3Cl)CC1	ZINC001161982144	1382586363	/nfs/dbraw/zinc/58/63/63/1382586363.db2.gz	AUVDRJUDCTZHDM-KRWDZBQOSA-N	0	3	330.859	3.304	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)C2(CC(C)C)CCC2)(COC)CC1	ZINC001162351229	1382738059	/nfs/dbraw/zinc/73/80/59/1382738059.db2.gz	LASPUTYVYNUXPT-UHFFFAOYSA-N	0	3	348.531	3.071	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC1(COC)CCN(C[C@H](F)CC)CC1	ZINC001162464791	1382764785	/nfs/dbraw/zinc/76/47/85/1382764785.db2.gz	VDPQOBUBLVBNNJ-AEFFLSMTSA-N	0	3	342.499	3.182	20	30		EGEDHN
CC(C)C#CC(=O)N(CCNC/C=C\Cl)CCc1ccccc1	ZINC001162806652	1382878975	/nfs/dbraw/zinc/87/89/75/1382878975.db2.gz	GTTRMIKDJKEGBT-SDQBBNPISA-N	0	3	332.875	3.059	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C[C@@H]1CC[C@H](C)C1	ZINC001162892106	1382906802	/nfs/dbraw/zinc/90/68/02/1382906802.db2.gz	HYCFFTAFQOMHHW-AZUAARDMSA-N	0	3	326.484	3.107	20	30		EGEDHN
C=CCCC1(C(=O)N(CCNCC#CC)CCc2ccccc2)CC1	ZINC001162919610	1382916932	/nfs/dbraw/zinc/91/69/32/1382916932.db2.gz	WRVQQACGYKBEQT-UHFFFAOYSA-N	0	3	338.495	3.417	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1cc(C)c(C)s1	ZINC001162997318	1382942705	/nfs/dbraw/zinc/94/27/05/1382942705.db2.gz	QKMUZSJPLGKIKD-UHFFFAOYSA-N	0	3	340.492	3.273	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)c1ccc(F)s1	ZINC001163006760	1382945642	/nfs/dbraw/zinc/94/56/42/1382945642.db2.gz	LPGIILLJLAXVIZ-UHFFFAOYSA-N	0	3	344.455	3.185	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C1(C)C(C)(C)C1(C)C	ZINC001163013676	1382948598	/nfs/dbraw/zinc/94/85/98/1382948598.db2.gz	TUDZQRMLJSSXCI-UHFFFAOYSA-N	0	3	340.511	3.353	20	30		EGEDHN
C=CCCC(=O)NCc1ccc(CN2CCN(CCCC)CC2)cc1	ZINC001163024813	1382951275	/nfs/dbraw/zinc/95/12/75/1382951275.db2.gz	VBJIGROLSPTKSH-UHFFFAOYSA-N	0	3	343.515	3.187	20	30		EGEDHN
C[Si](C)(C)C#Cc1cc(Cl)cnc1N[C@H]1CN2CCC1CC2	ZINC001163386474	1383038826	/nfs/dbraw/zinc/03/88/26/1383038826.db2.gz	TXIJQFSMACNZID-INIZCTEOSA-N	0	3	333.939	3.470	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)/C=C/C(C)(C)C)CC1	ZINC001163831261	1383126742	/nfs/dbraw/zinc/12/67/42/1383126742.db2.gz	SBPNKVFWCLEASF-AATRIKPKSA-N	0	3	343.309	3.373	20	30		EGEDHN
CC(C)(C)C(C)(C)C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001163977891	1383142742	/nfs/dbraw/zinc/14/27/42/1383142742.db2.gz	WWMUSJWMKQBUQS-UHFFFAOYSA-N	0	3	333.451	3.366	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCCNCc1cnc(-c2ccccc2)o1	ZINC001164223882	1383168018	/nfs/dbraw/zinc/16/80/18/1383168018.db2.gz	XFUAISUQZSUESN-JKSUJKDBSA-N	0	3	341.455	3.396	20	30		EGEDHN
C#CCCCC(=O)NCCC1(CNCc2cc(F)ccc2F)CC1	ZINC001164290801	1383175025	/nfs/dbraw/zinc/17/50/25/1383175025.db2.gz	CFBPBBVKPCNARN-UHFFFAOYSA-N	0	3	334.410	3.144	20	30		EGEDHN
CC(C)c1[nH]ccc1C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001164426661	1383185962	/nfs/dbraw/zinc/18/59/62/1383185962.db2.gz	QPQFHVLLXRCRAA-UHFFFAOYSA-N	0	3	342.418	3.059	20	30		EGEDHN
CC(C)c1ccoc1C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001164491365	1383192518	/nfs/dbraw/zinc/19/25/18/1383192518.db2.gz	GRXMWWNVYRJDCV-UHFFFAOYSA-N	0	3	343.402	3.323	20	30		EGEDHN
N#Cc1nc(Cl)ccc1C(F)(F)N1CCN[C@@H](c2ccccc2)C1	ZINC001165195526	1383244679	/nfs/dbraw/zinc/24/46/79/1383244679.db2.gz	DQKMNAWJUNOUKK-OAHLLOKOSA-N	0	3	348.784	3.302	20	30		EGEDHN
C=CCCCC(=O)NCCCNCc1ccc(-c2ncco2)cc1F	ZINC001165531613	1383308327	/nfs/dbraw/zinc/30/83/27/1383308327.db2.gz	UMXWLFCUWREESM-UHFFFAOYSA-N	0	3	345.418	3.433	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1c(C)cccc1Cl	ZINC001165805771	1383348160	/nfs/dbraw/zinc/34/81/60/1383348160.db2.gz	AOINCZWURHXNEW-UHFFFAOYSA-N	0	3	345.668	3.267	20	30		EGEDHN
C=C/C(C)=C\CC(=O)NCCC1(CNCC(=C)Br)CC1	ZINC001166678761	1383458527	/nfs/dbraw/zinc/45/85/27/1383458527.db2.gz	JIDZIOGSWFAELD-ACAGNQJTSA-N	0	3	341.293	3.294	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCC1(CNCc2cc(C3CC3)no2)CC1	ZINC001166704507	1383464437	/nfs/dbraw/zinc/46/44/37/1383464437.db2.gz	RCXHRWMZEQUUBW-GJZGRUSLSA-N	0	3	345.487	3.386	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCCC1(CN[C@H](C)c2cnccn2)CC1	ZINC001166755886	1383472545	/nfs/dbraw/zinc/47/25/45/1383472545.db2.gz	PCUDFCVETHMYIL-HZPDHXFCSA-N	0	3	330.476	3.016	20	30		EGEDHN
C=CCCCC(=O)NCCC1(CNCc2oc(CC)nc2C)CC1	ZINC001166910702	1383498486	/nfs/dbraw/zinc/49/84/86/1383498486.db2.gz	YURYVXQYYCCFLY-UHFFFAOYSA-N	0	3	333.476	3.278	20	30		EGEDHN
C=CCCCC(=O)NCCC1(CNCc2nc(C)c(C)s2)CC1	ZINC001166910730	1383498661	/nfs/dbraw/zinc/49/86/61/1383498661.db2.gz	ZSTDHZPAOFFYRD-UHFFFAOYSA-N	0	3	335.517	3.492	20	30		EGEDHN
C=C1CCC(C(=O)NCCC2(CNCc3oc(C)nc3C)CC2)CC1	ZINC001167025128	1383521127	/nfs/dbraw/zinc/52/11/27/1383521127.db2.gz	AUOCIBLXTCFMNF-UHFFFAOYSA-N	0	3	345.487	3.414	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCC1(CNCc2cccc(OC)n2)CC1	ZINC001167026168	1383522724	/nfs/dbraw/zinc/52/27/24/1383522724.db2.gz	SYKVPELILQYGNS-IBGZPJMESA-N	0	3	345.487	3.069	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCC2(CNCc3c(C)noc3C)CC2)C1	ZINC001167130262	1383547505	/nfs/dbraw/zinc/54/75/05/1383547505.db2.gz	OCKLESJVWYWMEH-UHFFFAOYSA-N	0	3	331.460	3.024	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)NCCC1(CNCc2cc(C#N)ccc2F)CC1	ZINC001167282725	1383584565	/nfs/dbraw/zinc/58/45/65/1383584565.db2.gz	GOEOXAULYKFGBG-NVXWUHKLSA-N	0	3	343.446	3.120	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCC1(CNCc2nc(C)cs2)CC1	ZINC001167340416	1383603562	/nfs/dbraw/zinc/60/35/62/1383603562.db2.gz	ZODUEKXLZWTWNX-UHFFFAOYSA-N	0	3	335.517	3.430	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCCNCc1nsc2ccccc12	ZINC001167362925	1383610612	/nfs/dbraw/zinc/61/06/12/1383610612.db2.gz	FKRMGCJBZGQPNT-UHFFFAOYSA-N	0	3	331.485	3.495	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@H](CC)OC2CCCC2)CC1	ZINC001167366637	1383611103	/nfs/dbraw/zinc/61/11/03/1383611103.db2.gz	MVAGVKKIKMEENB-INIZCTEOSA-N	0	3	342.911	3.353	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2csc(Cl)n2)CC1	ZINC001167657808	1383701133	/nfs/dbraw/zinc/70/11/33/1383701133.db2.gz	GXMMWBTXXAYTIR-UHFFFAOYSA-N	0	3	334.272	3.039	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@H](OC)c2ccccc2)CC1	ZINC001167794236	1383742354	/nfs/dbraw/zinc/74/23/54/1383742354.db2.gz	VFFWVUMDFLGMOE-MRXNPFEDSA-N	0	3	336.863	3.003	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C[C@@H]2OCc3ccccc32)CC1	ZINC001167915262	1383769415	/nfs/dbraw/zinc/76/94/15/1383769415.db2.gz	BMRPOOMUNVULAU-KRWDZBQOSA-N	0	3	348.874	3.277	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)Cc2ccc(C)c(C)c2)CC1	ZINC001168014552	1383797679	/nfs/dbraw/zinc/79/76/79/1383797679.db2.gz	UOMGTEVCYIGFSI-UHFFFAOYSA-N	0	3	334.891	3.475	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@@H](C)n2c(C)ccc2C)CC1	ZINC001168335723	1383876363	/nfs/dbraw/zinc/87/63/63/1383876363.db2.gz	RUHBAOQIHIBBCQ-MRXNPFEDSA-N	0	3	337.895	3.295	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H](NCC2(C#N)CC2)C[C@@H]1C(F)(F)F	ZINC001168523772	1383929618	/nfs/dbraw/zinc/92/96/18/1383929618.db2.gz	MGQMXTMDOONODJ-VXGBXAGGSA-N	0	3	347.381	3.210	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)/C=C\C1CC1	ZINC001169981702	1384209894	/nfs/dbraw/zinc/20/98/94/1384209894.db2.gz	GJVRUGJAYHKXCH-YUQCYMQKSA-N	0	3	325.456	3.289	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)COC(C)(C)C	ZINC001170292795	1384283565	/nfs/dbraw/zinc/28/35/65/1384283565.db2.gz	JOGKGXZBLNGJPO-MRXNPFEDSA-N	0	3	345.487	3.138	20	30		EGEDHN
N#CC1(c2ccccc2)CCC(N2CCN(c3cccnn3)CC2)CC1	ZINC001170389044	1384305396	/nfs/dbraw/zinc/30/53/96/1384305396.db2.gz	JRILDWMHJBTRAZ-UHFFFAOYSA-N	0	3	347.466	3.003	20	30		EGEDHN
C=CCC[C@H](C)[NH2+]CCCC[C@@H](C)NC(=O)c1cccc2n[n-]nc21	ZINC001170963737	1384419306	/nfs/dbraw/zinc/41/93/06/1384419306.db2.gz	SRKCUKJTBPTFBH-LSDHHAIUSA-N	0	3	343.475	3.191	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H](C)CCCCN[C@@H](C)c1nnc(C)[nH]1	ZINC001170998531	1384427269	/nfs/dbraw/zinc/42/72/69/1384427269.db2.gz	SZMBIJXIZHARCS-KGLIPLIRSA-N	0	3	335.496	3.041	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H](C)CCCCN[C@@H](C)c1nnc(CC)[nH]1	ZINC001171043889	1384435859	/nfs/dbraw/zinc/43/58/59/1384435859.db2.gz	QNYIXLCWVITPQO-CABCVRRESA-N	0	3	335.496	3.049	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1CC2(C1)CCN(Cc1cccnc1)C2	ZINC001171212870	1384470501	/nfs/dbraw/zinc/47/05/01/1384470501.db2.gz	RBNHKRTZJITREX-GOSISDBHSA-N	0	3	346.478	3.092	20	30		EGEDHN
CC(C)CC(=O)N1CCCN([C@H](C)Cc2cccc(C#N)c2)CC1	ZINC001171229548	1384474639	/nfs/dbraw/zinc/47/46/39/1384474639.db2.gz	OUAQZEIFHODVEJ-QGZVFWFLSA-N	0	3	327.472	3.070	20	30		EGEDHN
C[C@@H](CC(=O)NCCCNCc1ccc(C#N)cc1F)c1ccco1	ZINC001171387142	1384509356	/nfs/dbraw/zinc/50/93/56/1384509356.db2.gz	XOZWKGFRVWOZTN-AWEZNQCLSA-N	0	3	343.402	3.080	20	30		EGEDHN
CCOC(=O)C1(C#N)CCN([C@H](C)CCc2ccc(C)cc2)CC1	ZINC001171679558	1384600373	/nfs/dbraw/zinc/60/03/73/1384600373.db2.gz	LJWUPRBFOAZKPY-QGZVFWFLSA-N	0	3	328.456	3.485	20	30		EGEDHN
COC(=O)c1ccc2c(c1)CN([C@H](C)Cc1ccc(C#N)cc1)CC2	ZINC001172318803	1384768948	/nfs/dbraw/zinc/76/89/48/1384768948.db2.gz	JBLKYYFKJYCPHX-OAHLLOKOSA-N	0	3	334.419	3.334	20	30		EGEDHN
C[C@H](CCCC#N)N1CCO[C@H]2[C@H]1CC[C@H]2COCc1nccs1	ZINC001172500237	1384806950	/nfs/dbraw/zinc/80/69/50/1384806950.db2.gz	YCEBHIDJVNEZSZ-KYHPRHEASA-N	0	3	349.500	3.221	20	30		EGEDHN
C[C@H]1CC[C@@H](NCc2csc(C#N)c2)CN1C(=O)OC(C)(C)C	ZINC001173062374	1384904830	/nfs/dbraw/zinc/90/48/30/1384904830.db2.gz	UKAIPEAWFUITLV-GXTWGEPZSA-N	0	3	335.473	3.497	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccccc2)CCN1C1CCC(CC#N)CC1	ZINC001173340911	1384962279	/nfs/dbraw/zinc/96/22/79/1384962279.db2.gz	NCOYKFIQGHQKKJ-LRYGQEGESA-N	0	3	325.456	3.305	20	30		EGEDHN
C[C@H](CNC(=O)c1cc(C#N)c[nH]1)N[C@H](C)c1ccc(F)c(Cl)c1	ZINC001317230736	1385009185	/nfs/dbraw/zinc/00/91/85/1385009185.db2.gz	BRYDWLGPLPJOQL-GHMZBOCLSA-N	0	3	348.809	3.148	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H](C)CCCCNCc1nccs1	ZINC001174694908	1385135524	/nfs/dbraw/zinc/13/55/24/1385135524.db2.gz	ZKQZLQAGUYOFBE-INIZCTEOSA-N	0	3	335.517	3.491	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1cc2[nH]ccc2s1	ZINC001174698735	1385136150	/nfs/dbraw/zinc/13/61/50/1385136150.db2.gz	DPKIBRROXXXDAL-UHFFFAOYSA-N	0	3	338.436	3.011	20	30		EGEDHN
C[C@H](CCCCNCc1cc(F)ccc1C#N)NC(=O)[C@@H]1C[C@H]1C	ZINC001174713098	1385138848	/nfs/dbraw/zinc/13/88/48/1385138848.db2.gz	MLUDYVOBFJXSQH-HBUWYVDXSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H](C)CCCCNCc1cc(OC)no1	ZINC001174832871	1385156695	/nfs/dbraw/zinc/15/66/95/1385156695.db2.gz	GXHBQFWUJOWLAN-GJZGRUSLSA-N	0	3	337.464	3.050	20	30		EGEDHN
Cc1cc(C)c(CC(=O)NCCCNCc2ccccc2C#N)s1	ZINC001174901283	1385167714	/nfs/dbraw/zinc/16/77/14/1385167714.db2.gz	LNLDJVZYKWUANS-UHFFFAOYSA-N	0	3	341.480	3.075	20	30		EGEDHN
C=CCCCC(=O)N[C@@H](C)CCCCNCc1nnc(C(C)C)n1C	ZINC001174987607	1385179391	/nfs/dbraw/zinc/17/93/91/1385179391.db2.gz	QLCHKAWQIRYCCU-INIZCTEOSA-N	0	3	349.523	3.059	20	30		EGEDHN
CCN(CCNC(=O)Cc1cc(C)cc(C)c1)Cc1cccc(C#N)c1	ZINC001317486369	1385184231	/nfs/dbraw/zinc/18/42/31/1385184231.db2.gz	SKUFJPSMNAXZCQ-UHFFFAOYSA-N	0	3	349.478	3.356	20	30		EGEDHN
CCN(CCNC(=O)[C@H]1CC[C@H](C)CC1)Cc1ccc(C#N)cc1	ZINC001317491540	1385191763	/nfs/dbraw/zinc/19/17/63/1385191763.db2.gz	ZTCNRFWRWTVQPK-RUCARUNLSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)CCCCNCc2cc(OC)no2)CCC1	ZINC001175097755	1385194290	/nfs/dbraw/zinc/19/42/90/1385194290.db2.gz	KSPMGFHVCZIAEL-OAHLLOKOSA-N	0	3	349.475	3.194	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)CCCCN[C@@H](C)c2nnc(C)[nH]2)CCC1	ZINC001175097384	1385194316	/nfs/dbraw/zinc/19/43/16/1385194316.db2.gz	JHWLABDHNZHVJY-CABCVRRESA-N	0	3	347.507	3.185	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1cc(C)c(CC)s1	ZINC001175549388	1385329808	/nfs/dbraw/zinc/32/98/08/1385329808.db2.gz	KABFPKBJRVSZIX-UHFFFAOYSA-N	0	3	345.306	3.237	20	30		EGEDHN
CCc1ccc(CCC(=O)NCCCNCc2ccccc2C#N)cc1	ZINC001175904619	1385434014	/nfs/dbraw/zinc/43/40/14/1385434014.db2.gz	OZVDTONTCSQULW-UHFFFAOYSA-N	0	3	349.478	3.349	20	30		EGEDHN
Cc1cnccc1Nc1ccc(S(=O)(=O)OCC(C)(C)C)cc1	ZINC001176260325	1385530583	/nfs/dbraw/zinc/53/05/83/1385530583.db2.gz	BDMRWPWOSZPNFR-UHFFFAOYSA-N	0	3	334.441	3.307	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1ccc(C2CC2)cc1	ZINC001176737221	1385676772	/nfs/dbraw/zinc/67/67/72/1385676772.db2.gz	XDNKSZJHCLTBFE-UHFFFAOYSA-N	0	3	333.435	3.345	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)C(=O)NCCCNCc1cc(C)no1	ZINC001176743659	1385679597	/nfs/dbraw/zinc/67/95/97/1385679597.db2.gz	CATHPTGBJVMYGS-GOSISDBHSA-N	0	3	341.455	3.014	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)C(=O)NCCCNCc1cnoc1C	ZINC001176743927	1385679751	/nfs/dbraw/zinc/67/97/51/1385679751.db2.gz	FOZXFCKSISDAMY-SFHVURJKSA-N	0	3	341.455	3.014	20	30		EGEDHN
C=C[C@@H](CC(=O)NCCCNCc1conc1CC)c1ccccc1	ZINC001176762974	1385687828	/nfs/dbraw/zinc/68/78/28/1385687828.db2.gz	NBMSWPTZOMHEDL-INIZCTEOSA-N	0	3	341.455	3.193	20	30		EGEDHN
C=C[C@@H](CC(=O)NCCCNCc1ncc(C)s1)c1ccccc1	ZINC001176763119	1385688584	/nfs/dbraw/zinc/68/85/84/1385688584.db2.gz	RILFKMNRKIXKLB-INIZCTEOSA-N	0	3	343.496	3.407	20	30		EGEDHN
CC(C)CC(=O)NC1(CNCc2cc(C#N)ccc2F)CCCC1	ZINC001318612723	1385794758	/nfs/dbraw/zinc/79/47/58/1385794758.db2.gz	JKMNADIPBUCWLE-UHFFFAOYSA-N	0	3	331.435	3.262	20	30		EGEDHN
C=CCCC(=O)N(CCCNCc1cnns1)CC1CCCC1	ZINC001177245765	1385882686	/nfs/dbraw/zinc/88/26/86/1385882686.db2.gz	HOIBRHPKGJFBLW-UHFFFAOYSA-N	0	3	336.505	3.003	20	30		EGEDHN
C#CCCCC(=O)N(CCCNCc1conc1C)CC1CCCC1	ZINC001177304888	1385904639	/nfs/dbraw/zinc/90/46/39/1385904639.db2.gz	NJJIUXJSPHTDHZ-UHFFFAOYSA-N	0	3	345.487	3.285	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@@]1(C)CCOC1	ZINC001177449101	1385960321	/nfs/dbraw/zinc/96/03/21/1385960321.db2.gz	ZZGRZCROHRCENH-SFHVURJKSA-N	0	3	342.911	3.164	20	30		EGEDHN
C=CCC[C@H](C(=O)NCCCNCc1cnc(C)o1)c1ccccc1	ZINC001177552908	1385995161	/nfs/dbraw/zinc/99/51/61/1385995161.db2.gz	RHUFGYVDXDJPFM-IBGZPJMESA-N	0	3	341.455	3.329	20	30		EGEDHN
Cc1cccc(NC[C@@H]2CCCN2CCOc2ccccc2C#N)n1	ZINC001319388784	1386098644	/nfs/dbraw/zinc/09/86/44/1386098644.db2.gz	LSRGFCOLEYOBDV-SFHVURJKSA-N	0	3	336.439	3.217	20	30		EGEDHN
CCCc1nc(CNCCCCCCNC(=O)[C@@H](C)C#N)cs1	ZINC001178053300	1386117561	/nfs/dbraw/zinc/11/75/61/1386117561.db2.gz	PRGPRPPSRNCMCL-AWEZNQCLSA-N	0	3	336.505	3.021	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](N[C@H](C)c2ccc(F)cc2F)[C@@H]1C	ZINC001178587233	1386256036	/nfs/dbraw/zinc/25/60/36/1386256036.db2.gz	DJYVILZCIIGGGQ-GLJUWKHASA-N	0	3	334.410	3.408	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](N[C@@H](C)c2ccc(F)cc2F)[C@@H]1C	ZINC001178587232	1386256187	/nfs/dbraw/zinc/25/61/87/1386256187.db2.gz	DJYVILZCIIGGGQ-DEYYWGMASA-N	0	3	334.410	3.408	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](NCc2ncccc2C)[C@@H]1C	ZINC001178773452	1386299925	/nfs/dbraw/zinc/29/99/25/1386299925.db2.gz	KHJPBSKPKBYCNR-WMZOPIPTSA-N	0	3	327.472	3.237	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)[C@H]1CCC(F)(F)C1	ZINC001178844727	1386327162	/nfs/dbraw/zinc/32/71/62/1386327162.db2.gz	VDHDVMVBILGVKG-SZMVWBNQSA-N	0	3	346.421	3.053	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCCCCCNCc1cn(C(C)C)nn1	ZINC001179306752	1386445978	/nfs/dbraw/zinc/44/59/78/1386445978.db2.gz	LLTOSCPCHWCNJU-IAGOWNOFSA-N	0	3	349.523	3.083	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N1CC[C@H](NCc2ccc(C#N)s2)[C@@H]1C	ZINC001179351686	1386460296	/nfs/dbraw/zinc/46/02/96/1386460296.db2.gz	TYEFLBXXAGFSKC-RQFRMBLGSA-N	0	3	329.469	3.221	20	30		EGEDHN
C=CCC1(C(=O)NCCCCCCN[C@@H](C)c2nnc(C)[nH]2)CCC1	ZINC001179492698	1386496572	/nfs/dbraw/zinc/49/65/72/1386496572.db2.gz	NFNYGRLNWPFIAY-HNNXBMFYSA-N	0	3	347.507	3.187	20	30		EGEDHN
C=CC1(CC(=O)N2CC[C@H](NCc3ccnn3C)[C@@H]2C)CCCCC1	ZINC001179715005	1386562962	/nfs/dbraw/zinc/56/29/62/1386562962.db2.gz	VXPAGZBRQINKHE-WMZOPIPTSA-N	0	3	344.503	3.026	20	30		EGEDHN
CC(C#N)C(=O)N1CCN=C1CN(Cc1ccccc1)c1ccccc1	ZINC001179901380	1386622223	/nfs/dbraw/zinc/62/22/23/1386622223.db2.gz	LQUMXAYLJQWAFC-KRWDZBQOSA-N	0	3	346.434	3.094	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CC=CC2)C[C@@]1(C)CNCc1ccccc1C#N	ZINC001180973802	1386912231	/nfs/dbraw/zinc/91/22/31/1386912231.db2.gz	ZIKJXBZNMLOPOM-IIBYNOLFSA-N	0	3	337.467	3.099	20	30		EGEDHN
C/C=C(/C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2cc(F)ccc2C#N)C1	ZINC001181050071	1386925246	/nfs/dbraw/zinc/92/52/46/1386925246.db2.gz	YKAONIXVTQXHRP-ZDNXKBLRSA-N	0	3	343.446	3.238	20	30		EGEDHN
C=CCOCC(=O)N1CC[C@@H](NC2c3ccccc3-c3ccccc32)C1	ZINC001181618067	1387024844	/nfs/dbraw/zinc/02/48/44/1387024844.db2.gz	KAHHZCVLUGFOSV-MRXNPFEDSA-N	0	3	348.446	3.150	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](NCc2cc(C(C)C)ccc2OC)C1	ZINC001182214606	1387121461	/nfs/dbraw/zinc/12/14/61/1387121461.db2.gz	BRINVXZBADFBQL-LJQANCHMSA-N	0	3	342.483	3.313	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2cnc(C)o2)C1	ZINC001182305767	1387143848	/nfs/dbraw/zinc/14/38/48/1387143848.db2.gz	OKDSJZWGZZIFOR-QMTMVMCOSA-N	0	3	333.476	3.160	20	30		EGEDHN
C#CC(C)(C)C(=O)N(C)C[C@@H]1CCCCN1Cc1ccc(OC)cc1	ZINC001182637155	1387199511	/nfs/dbraw/zinc/19/95/11/1387199511.db2.gz	WIQNBVKZYSYTQV-SFHVURJKSA-N	0	3	342.483	3.168	20	30		EGEDHN
C[C@@H](C(=O)NC[C@@H]1CCCN1Cc1ccccc1)c1ccc(C#N)cc1	ZINC001182801005	1387226872	/nfs/dbraw/zinc/22/68/72/1387226872.db2.gz	WXVGNFQKLYDOAW-UTKZUKDTSA-N	0	3	347.462	3.443	20	30		EGEDHN
C=C[C@@H](COC)N[C@H]1CCc2ccc(I)cc21	ZINC001330316881	1389386427	/nfs/dbraw/zinc/38/64/27/1389386427.db2.gz	UOCFWWQLSSMSCS-JSGCOSHPSA-N	0	3	343.208	3.069	20	30		EGEDHN
CN(C(=O)c1ccsc1)[C@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001331252271	1389668534	/nfs/dbraw/zinc/66/85/34/1389668534.db2.gz	DEPXBGIJKAPNHT-MRXNPFEDSA-N	0	3	345.493	3.322	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N[C@H](C)c1noc(-c2ccc(Cl)cc2)n1	ZINC001340123975	1390231519	/nfs/dbraw/zinc/23/15/19/1390231519.db2.gz	WRURBEBVSJYRKY-RISCZKNCSA-N	0	3	348.834	3.251	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc(N2C[C@H](C)O[C@@H](C)C2)c(F)c1	ZINC001340173418	1390241857	/nfs/dbraw/zinc/24/18/57/1390241857.db2.gz	ROEOPZNFQJSIHA-ZQIUZPCESA-N	0	3	349.450	3.061	20	30		EGEDHN
C=C(Cl)CNC1CC(N(C)C(=O)CCCc2ccc(F)cc2)C1	ZINC001333119323	1390251883	/nfs/dbraw/zinc/25/18/83/1390251883.db2.gz	GOAGRWKTVPCYIE-UHFFFAOYSA-N	0	3	338.854	3.480	20	30		EGEDHN
C=C(Cl)C[C@H](N)C(=O)Nc1ccc(N2CCCCC2)c(F)c1	ZINC001333733364	1390386972	/nfs/dbraw/zinc/38/69/72/1390386972.db2.gz	UOEOAXDRISDLTI-AWEZNQCLSA-N	0	3	325.815	3.224	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N[C@H](C)c1ccc(OCC(F)(F)F)cc1	ZINC001341497905	1390494596	/nfs/dbraw/zinc/49/45/96/1390494596.db2.gz	ZODIZVFNYCMSMW-DOMZBBRYSA-N	0	3	344.377	3.489	20	30		EGEDHN
C=C(C)Cn1c(N2CCN(C3CCCC3)CC2)nnc1C(C)(C)F	ZINC001342042573	1390564725	/nfs/dbraw/zinc/56/47/25/1390564725.db2.gz	AEIUIBDJXSVOEI-UHFFFAOYSA-N	0	3	335.471	3.123	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)CCCC(=O)OC(C)(C)C)c1	ZINC001342617676	1390632908	/nfs/dbraw/zinc/63/29/08/1390632908.db2.gz	XRZCQCBAWSLFKE-OAHLLOKOSA-N	0	3	344.411	3.154	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N1CCC[C@@H](c2cncn2C(C)(C)C)C1	ZINC001342754949	1390650063	/nfs/dbraw/zinc/65/00/63/1390650063.db2.gz	NFTFLHOATYNHEY-HZPDHXFCSA-N	0	3	332.492	3.028	20	30		EGEDHN
CC[C@H](C)c1ccc(NC(=O)C(C#N)C(=O)Cc2cc(C)on2)cc1	ZINC001343599467	1390725573	/nfs/dbraw/zinc/72/55/73/1390725573.db2.gz	LNZKGYMNEQRUPR-YVEFUNNKSA-N	0	3	339.395	3.387	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)C#Cc1cccs1	ZINC001344099700	1390755424	/nfs/dbraw/zinc/75/54/24/1390755424.db2.gz	RVLMZVSAZXZBMQ-QGZVFWFLSA-N	0	3	338.476	3.223	20	30		EGEDHN
CCN1C[C@H](C)N(c2nnc([C@@H](C)CCC#N)n2CC(C)C)C[C@H]1C	ZINC001344342967	1390784885	/nfs/dbraw/zinc/78/48/85/1390784885.db2.gz	OKHWINPOAQQFJV-BBWFWOEESA-N	0	3	346.523	3.260	20	30		EGEDHN
CCC(C)(C)N1CCN(c2nnc(CCCC#N)n2CC(C)C)CC1	ZINC001344978334	1390828687	/nfs/dbraw/zinc/82/86/87/1390828687.db2.gz	SYSFQNPDYCCZSP-UHFFFAOYSA-N	0	3	346.523	3.091	20	30		EGEDHN
CC(C)n1cc(C(=O)C(C#N)c2nc3c(cccc3Cl)[nH]2)cn1	ZINC001345673447	1390874697	/nfs/dbraw/zinc/87/46/97/1390874697.db2.gz	QDKHGUOOFDXUBM-NSHDSACASA-N	0	3	327.775	3.484	20	30		EGEDHN
CCc1c(C(=O)C(C#N)c2nccn2CC)cnn1-c1ccccc1C	ZINC001346096775	1390907341	/nfs/dbraw/zinc/90/73/41/1390907341.db2.gz	UQHHNOALBICPLJ-OAHLLOKOSA-N	0	3	347.422	3.450	20	30		EGEDHN
N#CC(C(=O)c1c[nH]c(Br)c1)c1cnc2ccccc2n1	ZINC001348139309	1391178236	/nfs/dbraw/zinc/17/82/36/1391178236.db2.gz	LGCFRHHFAXRVIS-JTQLQIEISA-N	0	3	341.168	3.210	20	30		EGEDHN
C[C@H](NC[C@@H](O)COc1ccccc1C#N)c1ccc(Cl)c(F)c1	ZINC001348423522	1391217117	/nfs/dbraw/zinc/21/71/17/1391217117.db2.gz	TXWGTLGAJAQUAB-SWLSCSKDSA-N	0	3	348.805	3.441	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)N(C)C(=O)CC(C)(C)C1CC1	ZINC001698821583	1406513336	/nfs/dbraw/zinc/51/33/36/1406513336.db2.gz	QAEUHWPMSIJMFY-ZDUSSCGKSA-N	0	3	333.501	3.383	20	30		EGEDHN
N#Cc1ccc(CN[C@@H](CNC(=O)CC2CCCC2)C2CC2)s1	ZINC001479999702	1392529374	/nfs/dbraw/zinc/52/93/74/1392529374.db2.gz	LYEZDZPBVSSKOB-KRWDZBQOSA-N	0	3	331.485	3.184	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H](CNC(=O)CC3CCC3)C2)cc1	ZINC001480250214	1392637173	/nfs/dbraw/zinc/63/71/73/1392637173.db2.gz	QCOULPAPTIWIHK-IBGZPJMESA-N	0	3	325.456	3.077	20	30		EGEDHN
C[C@@H](CNC(=O)c1coc2ccccc21)NCc1ccc(C#N)s1	ZINC001480605209	1392817406	/nfs/dbraw/zinc/81/74/06/1392817406.db2.gz	VPCIDPVUAXNTEH-LBPRGKRZSA-N	0	3	339.420	3.274	20	30		EGEDHN
CCCCCCCN1CC[C@@H](NC(=O)c2cnc3ccccc3n2)C1	ZINC001481702895	1394462220	/nfs/dbraw/zinc/46/22/20/1394462220.db2.gz	WOCBVHJOKYOPFA-MRXNPFEDSA-N	0	3	340.471	3.404	20	30		EGEDHN
CC[C@H](CNC(=O)c1conc1C(C)C)NCc1ccc(C#N)s1	ZINC001481817925	1394544838	/nfs/dbraw/zinc/54/48/38/1394544838.db2.gz	CLRUNLSSDQMEKG-GFCCVEGCSA-N	0	3	346.456	3.029	20	30		EGEDHN
CC[C@@H](CNC(=O)Cc1ccc(C)cc1)NCc1ccc(C#N)s1	ZINC001481830234	1394549403	/nfs/dbraw/zinc/54/94/03/1394549403.db2.gz	IMIFKSXBQHQELS-INIZCTEOSA-N	0	3	341.480	3.155	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)Cc2sc(C)nc2C)CCCC1	ZINC001482225304	1394819298	/nfs/dbraw/zinc/81/92/98/1394819298.db2.gz	QCOHHHKUUJQBDD-UHFFFAOYSA-N	0	3	341.908	3.074	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cc2ccncc2s1)C(C)C	ZINC001482534994	1395075650	/nfs/dbraw/zinc/07/56/50/1395075650.db2.gz	VYZVVEQXXZZOAK-CYBMUJFWSA-N	0	3	337.876	3.393	20	30		EGEDHN
CS[C@H](C)CC(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001483964102	1395165757	/nfs/dbraw/zinc/16/57/57/1395165757.db2.gz	APAVDNKVBXCKRB-OAHLLOKOSA-N	0	3	345.512	3.171	20	30		EGEDHN
C[C@]1(CNCc2ccccc2C#N)CCN(C(=O)C2CCCCC2)C1	ZINC001484076209	1395237140	/nfs/dbraw/zinc/23/71/40/1395237140.db2.gz	FUZZKAQCFXGTEY-OAQYLSRUSA-N	0	3	339.483	3.467	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)CC(C)(F)F)CCN1Cc1ccc(C#N)cc1	ZINC001502985336	1396237357	/nfs/dbraw/zinc/23/73/57/1396237357.db2.gz	FRAOJIJYXMDUCD-CJNGLKHVSA-N	0	3	335.398	3.073	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)[C@H](CC(C)C)OC)CC1	ZINC001505399532	1396287227	/nfs/dbraw/zinc/28/72/27/1396287227.db2.gz	QIEZKLZSULBCSX-KRWDZBQOSA-N	0	3	344.927	3.361	20	30		EGEDHN
Cc1ccc(C)c(CC(=O)NCC[C@@H](C)NCc2ccccc2C#N)c1	ZINC001492077847	1396302761	/nfs/dbraw/zinc/30/27/61/1396302761.db2.gz	KGGHWIKBLUBXSN-GOSISDBHSA-N	0	3	349.478	3.402	20	30		EGEDHN
CCN(CCNC(=O)Cc1cc(C)ccc1C)Cc1ccc(C#N)cc1	ZINC001493008408	1396331615	/nfs/dbraw/zinc/33/16/15/1396331615.db2.gz	DAALZKASJWQVGA-UHFFFAOYSA-N	0	3	349.478	3.356	20	30		EGEDHN
C[C@H](CN(C)Cc1cccc(C#N)c1)NC(=O)c1c(F)cccc1F	ZINC001498436883	1396994859	/nfs/dbraw/zinc/99/48/59/1396994859.db2.gz	NYIUKVZEFFAPCD-CYBMUJFWSA-N	0	3	343.377	3.087	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](NCc2ccccc2OC(C)C)C1	ZINC001690224004	1404427512	/nfs/dbraw/zinc/42/75/12/1404427512.db2.gz	WHJYRXWVYOYYKS-IBGZPJMESA-N	0	3	342.483	3.358	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1sc(C2CC2)nc1C	ZINC001690843415	1404772808	/nfs/dbraw/zinc/77/28/08/1404772808.db2.gz	XQDREYTVJABEKB-SNVBAGLBSA-N	0	3	327.881	3.179	20	30		EGEDHN
CCC(C)(C)C(=O)NC[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001691461075	1405283179	/nfs/dbraw/zinc/28/31/79/1405283179.db2.gz	OJUFHNRAKFMJAP-FZNQNYSPSA-N	0	3	331.435	3.118	20	30		EGEDHN
CCC(CC)C(=O)NCC[C@H]1CCN(Cc2ccc(F)c(C#N)c2)C1	ZINC001691872654	1405595030	/nfs/dbraw/zinc/59/50/30/1405595030.db2.gz	JKULPXITJCBDEV-HNNXBMFYSA-N	0	3	345.462	3.462	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)CCc2ccncc2)CCCC[C@@H]1C	ZINC001732261173	1428501384	/nfs/dbraw/zinc/50/13/84/1428501384.db2.gz	XGXHZCUPQGXLDB-KXBFYZLASA-N	0	3	349.906	3.421	20	30		EGEDHN
N#Cc1cccc(CNCc2ccc(CNC(=O)CCCF)cc2)c1	ZINC001732319654	1428529479	/nfs/dbraw/zinc/52/94/79/1428529479.db2.gz	SCUDGCNUNOALLW-UHFFFAOYSA-N	0	3	339.414	3.214	20	30		EGEDHN
COc1cc(Cl)ccc1CNC1(CNC(=O)[C@H](C)C#N)CCCC1	ZINC001732389931	1428559705	/nfs/dbraw/zinc/55/97/05/1428559705.db2.gz	YHPUZZUQEZLJQY-CYBMUJFWSA-N	0	3	349.862	3.027	20	30		EGEDHN
CCCC1(C(=O)NCC2(NCc3cccc(C#N)c3)CC2)CCC1	ZINC001699660467	1413044041	/nfs/dbraw/zinc/04/40/41/1413044041.db2.gz	XKTNYPFXSFUATO-UHFFFAOYSA-N	0	3	325.456	3.267	20	30		EGEDHN
C=C(Cl)CN(CC1CC1)C1CCN(C(=O)c2cncs2)CC1	ZINC001699684921	1413082781	/nfs/dbraw/zinc/08/27/81/1413082781.db2.gz	XPLCBLYHFRZXLB-UHFFFAOYSA-N	0	3	339.892	3.212	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1CC2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001700616711	1414283413	/nfs/dbraw/zinc/28/34/13/1414283413.db2.gz	AZGUUXPTHWGUCL-QGZVFWFLSA-N	0	3	339.483	3.419	20	30		EGEDHN
CC(F)(F)CCC(=O)N[C@H]1CCC[C@@H]1CNCc1ccccc1C#N	ZINC001732617250	1428879764	/nfs/dbraw/zinc/87/97/64/1428879764.db2.gz	CXRIWVNIKFYNDG-SJORKVTESA-N	0	3	349.425	3.368	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H](C)CNCc2ccc(F)c(C#N)c2)c(C)c1	ZINC001733022493	1429142050	/nfs/dbraw/zinc/14/20/50/1429142050.db2.gz	NCEFNGQBCNAMFU-HNNXBMFYSA-N	0	3	339.414	3.222	20	30		EGEDHN
C=C(Cn1c(C)nnc1N1C[C@@H](C)N(CC)C[C@@H]1C)c1ccccc1	ZINC001705742082	1417133469	/nfs/dbraw/zinc/13/34/69/1417133469.db2.gz	JDWJADBQTLHBBB-SJORKVTESA-N	0	3	339.487	3.219	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)CCn2ccc3ccccc32)C1	ZINC001707089685	1417196265	/nfs/dbraw/zinc/19/62/65/1417196265.db2.gz	HZMVXOADABWIHF-JCNLHEQBSA-N	0	3	345.874	3.268	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1cc(C2CC2)no1	ZINC001707449362	1417353521	/nfs/dbraw/zinc/35/35/21/1417353521.db2.gz	WGXZKGVOQWQRKT-SWLSCSKDSA-N	0	3	337.851	3.277	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@H](CNC(=O)CCCC3CC3)C2)c1	ZINC001713217807	1417796670	/nfs/dbraw/zinc/79/66/70/1417796670.db2.gz	JCAXEHDSCWVQSY-FQEVSTJZSA-N	0	3	339.483	3.467	20	30		EGEDHN
CCN(CCNC(=O)[C@@H]1CCCC(F)(F)C1)Cc1ccc(C#N)cc1	ZINC001713492099	1418192344	/nfs/dbraw/zinc/19/23/44/1418192344.db2.gz	LLIRASKXSCRWPK-QGZVFWFLSA-N	0	3	349.425	3.322	20	30		EGEDHN
CCN(CCNC(=O)[C@H]1CCCC(F)(F)C1)Cc1ccc(C#N)cc1	ZINC001713492098	1418192363	/nfs/dbraw/zinc/19/23/63/1418192363.db2.gz	LLIRASKXSCRWPK-KRWDZBQOSA-N	0	3	349.425	3.322	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)CC[C@@H]2CC[C@H](C(F)(F)F)O2)C1	ZINC001713784793	1418601159	/nfs/dbraw/zinc/60/11/59/1418601159.db2.gz	JBDYHHYUOXVNLS-QLFBSQMISA-N	0	3	348.409	3.033	20	30		EGEDHN
C=C(Br)CNCC1(NC(=O)[C@H](CC)SC)CCCC1	ZINC001714132238	1418935682	/nfs/dbraw/zinc/93/56/82/1418935682.db2.gz	RLBIDYUYIVMEBB-LBPRGKRZSA-N	0	3	349.338	3.055	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CCc2nc(C)cs2)CCCC1	ZINC001714497564	1419222088	/nfs/dbraw/zinc/22/20/88/1419222088.db2.gz	OWXHYCDESWCGHS-UHFFFAOYSA-N	0	3	341.908	3.155	20	30		EGEDHN
CCN(CCNC(=O)c1cccc(Cl)c1)Cc1ccc(C#N)cc1	ZINC001714597470	1419351172	/nfs/dbraw/zinc/35/11/72/1419351172.db2.gz	UEOTXMXFRWPXDQ-UHFFFAOYSA-N	0	3	341.842	3.464	20	30		EGEDHN
CCN(CCNC(=O)c1cc(F)cc(F)c1)Cc1cccc(C#N)c1	ZINC001714601680	1419358966	/nfs/dbraw/zinc/35/89/66/1419358966.db2.gz	WNZXPNKKQLPIHE-UHFFFAOYSA-N	0	3	343.377	3.088	20	30		EGEDHN
CCCC1(C(=O)NCC[C@H]2CCN(Cc3ccccc3C#N)C2)CC1	ZINC001714879758	1419615578	/nfs/dbraw/zinc/61/55/78/1419615578.db2.gz	ZFAAOVDNCTWIJZ-KRWDZBQOSA-N	0	3	339.483	3.467	20	30		EGEDHN
CC(C)C[C@H](CNCc1ccc(C#N)s1)NC(=O)c1cscn1	ZINC001714905421	1419647836	/nfs/dbraw/zinc/64/78/36/1419647836.db2.gz	KTCUNMZRVARWGG-GFCCVEGCSA-N	0	3	348.497	3.011	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCC1CN([C@@H](C)c2ccc(C(C)(C)C)cc2)C1	ZINC001714962254	1419701231	/nfs/dbraw/zinc/70/12/31/1419701231.db2.gz	XTZYVVKBVPRWLR-GJZGRUSLSA-N	0	3	327.472	3.253	20	30		EGEDHN
COc1ccc(C#N)cc1CNCC1(NC(=O)CC(C)C)CCCC1	ZINC001715084304	1419822358	/nfs/dbraw/zinc/82/23/58/1419822358.db2.gz	MLRSSCWUDKUIJN-UHFFFAOYSA-N	0	3	343.471	3.132	20	30		EGEDHN
C[C@@H]1CCCC[C@@]1(CNCc1ccc(C#N)cc1F)NC(=O)C1CC1	ZINC001715133733	1419882930	/nfs/dbraw/zinc/88/29/30/1419882930.db2.gz	WZKUWZOXUIYJPG-VLIAUNLRSA-N	0	3	343.446	3.262	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)[C@H]1CCC(C)(C)C1	ZINC001715254383	1419977805	/nfs/dbraw/zinc/97/78/05/1419977805.db2.gz	YOKJOMHDNJORGP-CVEARBPZSA-N	0	3	327.472	3.226	20	30		EGEDHN
CC(C)(CC(=O)NCC1(NCc2ccc(C#N)cc2)CC1)C1CC1	ZINC001733244099	1429387696	/nfs/dbraw/zinc/38/76/96/1429387696.db2.gz	RFMXBFDYUJWPMC-UHFFFAOYSA-N	0	3	325.456	3.123	20	30		EGEDHN
Cc1cc(C)c(C(=O)N(C)[C@@H](C)CNCc2ccc(F)c(C#N)c2)o1	ZINC001715329629	1420035953	/nfs/dbraw/zinc/03/59/53/1420035953.db2.gz	MOOJQKASFYLELL-ZDUSSCGKSA-N	0	3	343.402	3.158	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1sc(Cl)nc1C)C(C)C	ZINC001715491263	1420172589	/nfs/dbraw/zinc/17/25/89/1420172589.db2.gz	DNCCBYHZUSBCKZ-SNVBAGLBSA-N	0	3	336.288	3.201	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)NCC2(NCc3ccc(F)c(C#N)c3)CC2)CC1	ZINC001733262758	1429418988	/nfs/dbraw/zinc/41/89/88/1429418988.db2.gz	ZOLROUFMCUOZBX-KOMQPUFPSA-N	0	3	343.446	3.262	20	30		EGEDHN
CCc1ccccc1C(=O)N[C@@H](C)CNCc1ccc(F)c(C#N)c1	ZINC001716450353	1420666235	/nfs/dbraw/zinc/66/62/35/1420666235.db2.gz	WQVDWABRVJPGPI-AWEZNQCLSA-N	0	3	339.414	3.168	20	30		EGEDHN
C=C(Cl)CN(CC1CC1)C1CCN(C(=O)c2ccc(C)nc2)CC1	ZINC001733279193	1429448781	/nfs/dbraw/zinc/44/87/81/1429448781.db2.gz	YGCHJYXJXISREM-UHFFFAOYSA-N	0	3	347.890	3.459	20	30		EGEDHN
C[C@H]1C[C@@H](NCc2ccc(C#N)s2)CN1C(=O)CCC(C)(F)F	ZINC001717817974	1421636837	/nfs/dbraw/zinc/63/68/37/1421636837.db2.gz	NNEXENHZVQWLAW-NWDGAFQWSA-N	0	3	341.427	3.134	20	30		EGEDHN
C[C@H](CN(C)Cc1cccc(C#N)c1)NC(=O)CC(C1CC1)C1CC1	ZINC001722917500	1424255704	/nfs/dbraw/zinc/25/57/04/1424255704.db2.gz	UXSSFQTTZMZEQY-OAHLLOKOSA-N	0	3	339.483	3.321	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](NC(=O)CCC2CCC2)C2CC2)c(F)c1	ZINC001723290222	1424336504	/nfs/dbraw/zinc/33/65/04/1424336504.db2.gz	VCWDDEBCKOGLAP-IBGZPJMESA-N	0	3	343.446	3.262	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)c3cc(Cl)cs3)CC2)cc1	ZINC001723572174	1424470300	/nfs/dbraw/zinc/47/03/00/1424470300.db2.gz	VQUOSLCMKZOXFE-UHFFFAOYSA-N	0	3	345.855	3.325	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)CSC(C)C)CC2)C1	ZINC001723597559	1424483913	/nfs/dbraw/zinc/48/39/13/1424483913.db2.gz	PNBILPDWWIHVIN-MRXNPFEDSA-N	0	3	344.952	3.441	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@H](C)N(C)Cc2ccc(C#N)cc2)c(F)c1	ZINC001725188483	1425726534	/nfs/dbraw/zinc/72/65/34/1425726534.db2.gz	ZUDGSCTTZSKGMK-HNNXBMFYSA-N	0	3	339.414	3.256	20	30		EGEDHN
C[C@H](CNC(=O)c1cccc(Cl)c1)N(C)Cc1cccc(C#N)c1	ZINC001725191520	1425737368	/nfs/dbraw/zinc/73/73/68/1425737368.db2.gz	WAFGEARJPLUSFW-CQSZACIVSA-N	0	3	341.842	3.462	20	30		EGEDHN
CC1(C(=O)NC[C@H](NCc2ccc(C#N)cc2F)C2CC2)CCCC1	ZINC001731401647	1427362126	/nfs/dbraw/zinc/36/21/26/1427362126.db2.gz	HGUMOLYYQQDIDG-SFHVURJKSA-N	0	3	343.446	3.262	20	30		EGEDHN
CC(C)SCC(=O)N[C@@H]1CCN(Cc2cccc(C#N)c2)[C@H](C)C1	ZINC001733895239	1437713182	/nfs/dbraw/zinc/71/31/82/1437713182.db2.gz	OTPCXYRMOGSYAI-CRAIPNDOSA-N	0	3	345.512	3.169	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@H](C)N(C)Cc2cccc(C#N)c2)c(C)c1	ZINC001734057837	1437849605	/nfs/dbraw/zinc/84/96/05/1437849605.db2.gz	GEQINQMBPQNOJQ-KRWDZBQOSA-N	0	3	335.451	3.425	20	30		EGEDHN
Cc1cc(C)cc(C(=O)N(C)C[C@@H](C)NCc2ccc(C#N)s2)c1	ZINC001734352291	1438069897	/nfs/dbraw/zinc/06/98/97/1438069897.db2.gz	LXPHAOJMCXMOMN-OAHLLOKOSA-N	0	3	341.480	3.487	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCCC[C@H]1[C@@H](C)NCc1cn(C)nc1C	ZINC001752146573	1440146036	/nfs/dbraw/zinc/14/60/36/1440146036.db2.gz	NDMLZSLUPAUFEC-AEFFLSMTSA-N	0	3	346.519	3.190	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)CN(C)c1ccccc1	ZINC001752153904	1440146375	/nfs/dbraw/zinc/14/63/75/1440146375.db2.gz	ADDIXZZXBKWCIT-FUHWJXTLSA-N	0	3	349.906	3.235	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1cc(C(F)F)n[nH]1	ZINC001752156603	1440147332	/nfs/dbraw/zinc/14/73/32/1440147332.db2.gz	HRTQXDIWQBLFRU-ZWNOBZJWSA-N	0	3	346.809	3.073	20	30		EGEDHN
CCN(CC#Cc1ccccc1)CCCNC(=O)[C@]12C[C@H]1CCCC2	ZINC001752209938	1440154938	/nfs/dbraw/zinc/15/49/38/1440154938.db2.gz	GSZASRSFYKCYJY-IFMALSPDSA-N	0	3	338.495	3.447	20	30		EGEDHN
CC#CCN(CCCNC(=O)CCc1cccc(Cl)c1)C1CC1	ZINC001752270136	1440162983	/nfs/dbraw/zinc/16/29/83/1440162983.db2.gz	XIYHPNWGXIJGQX-UHFFFAOYSA-N	0	3	332.875	3.267	20	30		EGEDHN
C=C(C)CN1CCC(N(CCC)C(=O)c2cc(C3CC3)n(C)n2)CC1	ZINC001752439741	1440180998	/nfs/dbraw/zinc/18/09/98/1440180998.db2.gz	JNKGZTPGZSDIBD-UHFFFAOYSA-N	0	3	344.503	3.190	20	30		EGEDHN
C=CCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C1CCC(F)(F)CC1	ZINC001752566362	1440195433	/nfs/dbraw/zinc/19/54/33/1440195433.db2.gz	RGJGQLNCNVQHHK-IYBDPMFKSA-N	0	3	326.431	3.453	20	30		EGEDHN
CC(C)[C@@H]1C[C@H]1C(=O)N[C@H]1C[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001752673544	1440199165	/nfs/dbraw/zinc/19/91/65/1440199165.db2.gz	GAOXFJHGRGHQKF-XLAORIBOSA-N	0	3	344.886	3.220	20	30		EGEDHN
CCC(C)(CC)C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001752682913	1440199822	/nfs/dbraw/zinc/19/98/22/1440199822.db2.gz	VHXLJHLCUASEGI-WKILWMFISA-N	0	3	331.435	3.260	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H]2CN(Cc3cccnc3C)CC[C@H]21	ZINC001752708358	1440203244	/nfs/dbraw/zinc/20/32/44/1440203244.db2.gz	ZZRYLOYJGZBEHV-VQTJNVASSA-N	0	3	339.483	3.006	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CCC[C@H](CNC/C(Cl)=C/Cl)C1	ZINC001752794974	1440214262	/nfs/dbraw/zinc/21/42/62/1440214262.db2.gz	VPSFONPBZTVTJY-OFGWCQOXSA-N	0	3	349.302	3.115	20	30		EGEDHN
C#CCCCCC(=O)N1CCC[C@H](CNCc2c(F)cccc2F)C1	ZINC001752797349	1440214589	/nfs/dbraw/zinc/21/45/89/1440214589.db2.gz	ZGFYKEPRDZAXAB-MRXNPFEDSA-N	0	3	348.437	3.487	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)[C@@]1(C)CCCc2ccccc21	ZINC001752823480	1440222286	/nfs/dbraw/zinc/22/22/86/1440222286.db2.gz	CMBDDJXSGINQBB-UGKGYDQZSA-N	0	3	338.495	3.275	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](C)[C@@H]1CCCN(Cc2ccccn2)C1	ZINC001752842487	1440231442	/nfs/dbraw/zinc/23/14/42/1440231442.db2.gz	XJCPNUNLHAMMSL-DLBZAZTESA-N	0	3	329.488	3.401	20	30		EGEDHN
C#CCCCCC(=O)NC1CCC(NCc2ccn(C(C)C)n2)CC1	ZINC001752849289	1440233134	/nfs/dbraw/zinc/23/31/34/1440233134.db2.gz	FLMFZUJJJYWTGI-UHFFFAOYSA-N	0	3	344.503	3.175	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC1CCC(N[C@H](C)c2cnccn2)CC1	ZINC001752852975	1440234109	/nfs/dbraw/zinc/23/41/09/1440234109.db2.gz	ZCSVZOCGVLKXAJ-QQFBHYJXSA-N	0	3	330.476	3.157	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H](C)NCc2ccc(C#N)c(F)c2)CCC1	ZINC001752899829	1440242599	/nfs/dbraw/zinc/24/25/99/1440242599.db2.gz	UCUZNMJRGKUCSA-CQSZACIVSA-N	0	3	329.419	3.038	20	30		EGEDHN
CC(C)SCC(=O)N1CCC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001752987424	1440258209	/nfs/dbraw/zinc/25/82/09/1440258209.db2.gz	RRGVJOMULNTJKH-GOSISDBHSA-N	0	3	345.512	3.123	20	30		EGEDHN
CC(C)n1cccc1C(=O)NCC[C@@H](C)NCc1ccccc1C#N	ZINC001753019057	1440269317	/nfs/dbraw/zinc/26/93/17/1440269317.db2.gz	FZYDQBJFPBAPDI-MRXNPFEDSA-N	0	3	338.455	3.239	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1ccc(OC2CCC2)cc1	ZINC001753020623	1440269864	/nfs/dbraw/zinc/26/98/64/1440269864.db2.gz	VBGUWGLFYVNODD-CQSZACIVSA-N	0	3	336.863	3.468	20	30		EGEDHN
C=C1CCC(C(=O)NCCC[C@@H]2CCCN2Cc2ccnn2C)CC1	ZINC001753033309	1440273527	/nfs/dbraw/zinc/27/35/27/1440273527.db2.gz	JVIORJZABDRMQE-GOSISDBHSA-N	0	3	344.503	3.027	20	30		EGEDHN
CCN(CCNC(=O)C#CC(C)(C)C)[C@H](C)c1cccc(OC)c1	ZINC001753081751	1440294094	/nfs/dbraw/zinc/29/40/94/1440294094.db2.gz	QXOKINMSSNGYOT-MRXNPFEDSA-N	0	3	330.472	3.244	20	30		EGEDHN
CCN(CCNC(=O)[C@@H]1C[C@H]1C(C)(C)C)Cc1cccc(C#N)c1	ZINC001753085377	1440295844	/nfs/dbraw/zinc/29/58/44/1440295844.db2.gz	CCOWYABCADHUQW-QZTJIDSGSA-N	0	3	327.472	3.179	20	30		EGEDHN
CCN(CCNC(=O)c1c(F)cccc1F)Cc1cccc(C#N)c1	ZINC001753094036	1440301172	/nfs/dbraw/zinc/30/11/72/1440301172.db2.gz	TWJGEEGGHPTDOD-UHFFFAOYSA-N	0	3	343.377	3.088	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](CNC(=O)CC3CCCC3)C2)cc1	ZINC001753118850	1440312973	/nfs/dbraw/zinc/31/29/73/1440312973.db2.gz	KUFBXJQAYQDKQE-IBGZPJMESA-N	0	3	325.456	3.077	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@H]1CCN(Cc2ccc(C#N)cc2)C1	ZINC001753131480	1440316767	/nfs/dbraw/zinc/31/67/67/1440316767.db2.gz	WFSOZKQMUKDDHH-GOSISDBHSA-N	0	3	325.456	3.099	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@@H]1CCN(Cc2cn(C(C)C)nc2C)C1	ZINC001753132290	1440317272	/nfs/dbraw/zinc/31/72/72/1440317272.db2.gz	LUMQFMVNHCJGRG-ROUUACIJSA-N	0	3	346.519	3.313	20	30		EGEDHN
CC#CCN(CCC)CCNC(=O)c1ccc(C(F)F)cc1F	ZINC001753149188	1440326693	/nfs/dbraw/zinc/32/66/93/1440326693.db2.gz	VUHSUPCKMWNAJM-UHFFFAOYSA-N	0	3	326.362	3.228	20	30		EGEDHN
C=C(C)CN[C@@H](CNC(=O)[C@H]1Cc2ccccc2O1)c1ccccc1	ZINC001753300405	1440353709	/nfs/dbraw/zinc/35/37/09/1440353709.db2.gz	RXKXZNHUXFDKNB-AZUAARDMSA-N	0	3	336.435	3.013	20	30		EGEDHN
C=CCN[C@@H](CNC(=O)Cc1cccc2ncccc12)c1ccccc1	ZINC001753300403	1440353736	/nfs/dbraw/zinc/35/37/36/1440353736.db2.gz	RXACATWJBTZUGD-NRFANRHFSA-N	0	3	345.446	3.410	20	30		EGEDHN
CC(C)N(CC#Cc1ccccc1)CCCNC(=O)[C@@H]1CC12CCC2	ZINC001753301002	1440354147	/nfs/dbraw/zinc/35/41/47/1440354147.db2.gz	UCZPPWHLVCLEPG-FQEVSTJZSA-N	0	3	338.495	3.445	20	30		EGEDHN
C#CCCCC(=O)N1C[C@H]2CC[C@@H](C1)N2[C@@H]1CCc2ccc(F)cc21	ZINC001753305865	1440355415	/nfs/dbraw/zinc/35/54/15/1440355415.db2.gz	VBOCMSZZSRWHTG-WSTZPKSXSA-N	0	3	340.442	3.292	20	30		EGEDHN
C=CCOCCN1CC[C@H](N(CCC)C(=O)[C@H]2CCCC2(C)C)C1	ZINC001753318281	1440360984	/nfs/dbraw/zinc/36/09/84/1440360984.db2.gz	GSJAJMOOQJPHQM-ZWKOTPCHSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CCC)C(=O)[C@@H]2CCc3ccccc3O2)C1	ZINC001753319883	1440362684	/nfs/dbraw/zinc/36/26/84/1440362684.db2.gz	OQESQSYTPPIAIO-ICSRJNTNSA-N	0	3	342.483	3.269	20	30		EGEDHN
CC(C(=O)NCC[C@H]1CCN(CC#Cc2ccccc2)C1)=C1CCC1	ZINC001753328748	1440368103	/nfs/dbraw/zinc/36/81/03/1440368103.db2.gz	ZKXUXLAQJRKAKN-FQEVSTJZSA-N	0	3	336.479	3.367	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CCC)C(=O)c2cc(F)cc(Cl)c2)C1	ZINC001753329113	1440368247	/nfs/dbraw/zinc/36/82/47/1440368247.db2.gz	UZPKVLLNELEJKA-QGZVFWFLSA-N	0	3	336.838	3.429	20	30		EGEDHN
C[C@@H](CC(=O)NCC[C@H]1CCN(Cc2ccc(C#N)s2)C1)C1CC1	ZINC001753340810	1440375316	/nfs/dbraw/zinc/37/53/16/1440375316.db2.gz	KEVLENJFCIONAQ-GJZGRUSLSA-N	0	3	345.512	3.384	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NCC1CN(Cc2cc(C)ccc2C)C1	ZINC001753407648	1440392319	/nfs/dbraw/zinc/39/23/19/1440392319.db2.gz	RPBRUDOALZOMIT-NRFANRHFSA-N	0	3	344.499	3.080	20	30		EGEDHN
C#CCCCC(=O)N(C)[C@H]1CCN(CCOC2CCCCCC2)C1	ZINC001753434371	1440399516	/nfs/dbraw/zinc/39/95/16/1440399516.db2.gz	CLFBJSCQKVNSJW-SFHVURJKSA-N	0	3	334.504	3.062	20	30		EGEDHN
CC[C@H](CNC(=O)C1(C)CCCC1)NCc1ccc(C#N)c(F)c1	ZINC001753481172	1440416615	/nfs/dbraw/zinc/41/66/15/1440416615.db2.gz	KSBFWPLALRFPKE-MRXNPFEDSA-N	0	3	331.435	3.262	20	30		EGEDHN
CC[C@H](CNC(=O)c1occc1Cl)NCC#Cc1ccccc1	ZINC001753490563	1440419406	/nfs/dbraw/zinc/41/94/06/1440419406.db2.gz	ZNBQVFQSKNENOY-OAHLLOKOSA-N	0	3	330.815	3.083	20	30		EGEDHN
C=C(Br)CNC[C@](C)(NC(=O)/C=C(/C)C1CC1)C1CC1	ZINC001753514458	1440426916	/nfs/dbraw/zinc/42/69/16/1440426916.db2.gz	ITNVFGDJEVDXME-CLOOOTJHSA-N	0	3	341.293	3.126	20	30		EGEDHN
CC/C(C)=C\C(=O)N[C@@](C)(CNCc1ccc(C#N)cc1F)C1CC1	ZINC001753515729	1440427401	/nfs/dbraw/zinc/42/74/01/1440427401.db2.gz	GIESNQKHDDGGML-VHNWJRSRSA-N	0	3	343.446	3.428	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@]1(CNCc2conc2C)CCCC[C@@H]1C	ZINC001753534072	1440431892	/nfs/dbraw/zinc/43/18/92/1440431892.db2.gz	PFUNSHZNTLZERK-HNAYVOBHSA-N	0	3	333.476	3.494	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@H](CCNCc2cccc(F)c2F)C1	ZINC001753547193	1440434444	/nfs/dbraw/zinc/43/44/44/1440434444.db2.gz	ZUDQNEYRAAJJQQ-MRXNPFEDSA-N	0	3	346.421	3.097	20	30		EGEDHN
C[C@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)c1ccccc1F	ZINC001753678002	1440463915	/nfs/dbraw/zinc/46/39/15/1440463915.db2.gz	UPYRWEKMFCEHLW-CYBMUJFWSA-N	0	3	343.377	3.087	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccccc1)N(C)C(=O)C1C(C)(C)C1(C)C	ZINC001753687626	1440466005	/nfs/dbraw/zinc/46/60/05/1440466005.db2.gz	QFNCKCXSPXYXBU-INIZCTEOSA-N	0	3	326.484	3.157	20	30		EGEDHN
C[C@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)C1CC(C)(C)C1	ZINC001753690962	1440466519	/nfs/dbraw/zinc/46/65/19/1440466519.db2.gz	ZGDDURXNZPFDNG-CYBMUJFWSA-N	0	3	331.435	3.070	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)N(C)C(=O)C[C@@H]1CC=CCC1	ZINC001753706404	1440469762	/nfs/dbraw/zinc/46/97/62/1440469762.db2.gz	NEQOGAXNCSLDFR-HUUCEWRRSA-N	0	3	331.485	3.303	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccccc1)N(C)C(=O)[C@@H]1CCC(C)(C)C1	ZINC001753710698	1440470564	/nfs/dbraw/zinc/47/05/64/1440470564.db2.gz	HBZGKHHFEJCITO-PKOBYXMFSA-N	0	3	326.484	3.301	20	30		EGEDHN
C=CC1(CC(=O)N(C)[C@H](C)CN[C@@H](C)c2n[nH]c(C)n2)CCCCC1	ZINC001753716623	1440472014	/nfs/dbraw/zinc/47/20/14/1440472014.db2.gz	YBZHZTLHBFDYGU-CABCVRRESA-N	0	3	347.507	3.137	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)C(C)(F)F)NCC#Cc1ccccc1Cl	ZINC001753822313	1440496792	/nfs/dbraw/zinc/49/67/92/1440496792.db2.gz	GONXNSAGHZPIDV-OAHLLOKOSA-N	0	3	342.817	3.077	20	30		EGEDHN
C=C(Br)CN[C@H](CNC(=O)c1ccc(F)s1)C(C)C	ZINC001753846063	1440504382	/nfs/dbraw/zinc/50/43/82/1440504382.db2.gz	YIYZTMDOWWHKFG-SNVBAGLBSA-N	0	3	349.269	3.140	20	30		EGEDHN
CC#CCCCC(=O)N[C@H]1CCC[C@H]1CNCc1ccccc1C#N	ZINC001753893322	1440522316	/nfs/dbraw/zinc/52/23/16/1440522316.db2.gz	AFLFVOAANRFJLZ-PMACEKPBSA-N	0	3	337.467	3.126	20	30		EGEDHN
C[C@H](CCNCc1cc(C#N)ccc1F)NC(=O)/C=C/C(C)(C)C	ZINC001753953478	1440525514	/nfs/dbraw/zinc/52/55/14/1440525514.db2.gz	NWYOOUYRRILMMX-RCQQVGEISA-N	0	3	331.435	3.284	20	30		EGEDHN
CCN(CCNCc1ccc(C#N)s1)C(=O)C(C)(C)C(F)(F)F	ZINC001754077742	1440538911	/nfs/dbraw/zinc/53/89/11/1440538911.db2.gz	GWBHMFNGNUNIBT-UHFFFAOYSA-N	0	3	347.406	3.146	20	30		EGEDHN
O=C(C#CC1CC1)NC/C=C/CN[C@H]1CCc2c1cccc2Cl	ZINC001754119522	1440542725	/nfs/dbraw/zinc/54/27/25/1440542725.db2.gz	MICXKBPVKPFPPU-KROLTMCQSA-N	0	3	328.843	3.003	20	30		EGEDHN
CCc1ccccc1C(=O)NC/C=C/CNCc1ccc(C#N)cc1	ZINC001754170966	1440546997	/nfs/dbraw/zinc/54/69/97/1440546997.db2.gz	CXZJIFPTYXWXOA-AATRIKPKSA-N	0	3	333.435	3.196	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NC/C=C/CNCc1cccc(Cl)c1	ZINC001754182249	1440548309	/nfs/dbraw/zinc/54/83/09/1440548309.db2.gz	PWLUKYCLKMRLOZ-ZFRRBFPSSA-N	0	3	348.874	3.083	20	30		EGEDHN
Cc1scc(C(=O)N[C@H](C)CNCC#Cc2ccccc2)c1C	ZINC001754227109	1440553450	/nfs/dbraw/zinc/55/34/50/1440553450.db2.gz	OGNPLIHQTMWJNV-CQSZACIVSA-N	0	3	326.465	3.125	20	30		EGEDHN
Cc1cc(F)ccc1C(=O)N[C@H](C)CNCc1ccc(F)c(C#N)c1	ZINC001754250334	1440557790	/nfs/dbraw/zinc/55/77/90/1440557790.db2.gz	ZJOGNHRIJVIJJJ-CYBMUJFWSA-N	0	3	343.377	3.053	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](C)CN(C)C[C@H](O)c1ccc(CC)cc1	ZINC001754317769	1440576574	/nfs/dbraw/zinc/57/65/74/1440576574.db2.gz	BHHSRYXFAMLYLA-LPHOPBHVSA-N	0	3	346.515	3.321	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H](C)CN(C)C/C=C/c2ccccc2)cc1	ZINC001754320456	1440577685	/nfs/dbraw/zinc/57/76/85/1440577685.db2.gz	WXAKBMBUOYJSHN-MZEUMTGBSA-N	0	3	332.447	3.431	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)c1ccc2c(c1)CCC2	ZINC001754332640	1440584973	/nfs/dbraw/zinc/58/49/73/1440584973.db2.gz	JDUYUJYKYFMNIU-MRXNPFEDSA-N	0	3	347.462	3.297	20	30		EGEDHN
Cc1cscc1C(=O)N(C)CCCNCc1ccc(C#N)cc1F	ZINC001754364283	1440592074	/nfs/dbraw/zinc/59/20/74/1440592074.db2.gz	PXLBCZYDGRLRET-UHFFFAOYSA-N	0	3	345.443	3.319	20	30		EGEDHN
C#CCCCCC(=O)NC[C@H]1CCN1C[C@H]1CCCC(F)(F)C1	ZINC001754480844	1440607368	/nfs/dbraw/zinc/60/73/68/1440607368.db2.gz	MZNJJQJMAKMZDT-JKSUJKDBSA-N	0	3	326.431	3.196	20	30		EGEDHN
C=CCC1(C(=O)NC[C@H]2CCN2C[C@H](OC)C2CCC2)CCCC1	ZINC001754505562	1440616317	/nfs/dbraw/zinc/61/63/17/1440616317.db2.gz	VTCHGVCKASHGEA-MSOLQXFVSA-N	0	3	334.504	3.129	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)c3ccc(Cl)s3)CC2)cc1	ZINC001754533357	1440623272	/nfs/dbraw/zinc/62/32/72/1440623272.db2.gz	WWAWRGIPCHYLNX-UHFFFAOYSA-N	0	3	345.855	3.325	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@H]2CCC[C@@H](C1)N2C[C@@H](OCC)C1CC1	ZINC001754553141	1440630542	/nfs/dbraw/zinc/63/05/42/1440630542.db2.gz	WJXJBFKFSZBNMA-IJXRJRJASA-N	0	3	348.531	3.469	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@]2(CCN(Cc3cccnc3)C2)C1	ZINC001754565482	1440635274	/nfs/dbraw/zinc/63/52/74/1440635274.db2.gz	KKXQYTDHPQUQEC-XLIONFOSSA-N	0	3	327.472	3.108	20	30		EGEDHN
C[C@H](C#N)C(=O)NC1(C)CCN([C@@H]2CCc3ccc(Cl)cc32)CC1	ZINC001754623444	1440645734	/nfs/dbraw/zinc/64/57/34/1440645734.db2.gz	DTCXTKHJNQBNBI-CXAGYDPISA-N	0	3	345.874	3.458	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)CCOc2cc(C)ccc2C)CC1	ZINC001754630790	1440647763	/nfs/dbraw/zinc/64/77/63/1440647763.db2.gz	CPNAQQBNCUATCH-UHFFFAOYSA-N	0	3	330.472	3.229	20	30		EGEDHN
C#CCN(C(=O)c1ccc(C)c(F)c1)C1CCN(CC(=C)C)CC1	ZINC001754638133	1440648796	/nfs/dbraw/zinc/64/87/96/1440648796.db2.gz	NANNWEXOQXWOES-UHFFFAOYSA-N	0	3	328.431	3.250	20	30		EGEDHN
C#CCN(C(=O)c1cccc2c1CCC2)C1CCN(CC(=C)C)CC1	ZINC001754642858	1440649416	/nfs/dbraw/zinc/64/94/16/1440649416.db2.gz	BLRMVZRNMQCZOR-UHFFFAOYSA-N	0	3	336.479	3.291	20	30		EGEDHN
Cc1ccc(F)c(CNC[C@@H](NC(=O)[C@H](C)C#N)C2CCCC2)c1	ZINC001754645312	1440650008	/nfs/dbraw/zinc/65/00/08/1440650008.db2.gz	KIBABDZKMDUUFW-RDTXWAMCSA-N	0	3	331.435	3.058	20	30		EGEDHN
CC[C@H](C)CC(=O)N1CC[C@](C)(CNCc2ccccc2C#N)C1	ZINC001754691757	1440666257	/nfs/dbraw/zinc/66/62/57/1440666257.db2.gz	CTBNXJUTMRUKNM-OXJNMPFZSA-N	0	3	327.472	3.323	20	30		EGEDHN
CCC1(C(=O)N2CC[C@](C)(CNCc3ccccc3C#N)C2)CCC1	ZINC001754702346	1440668196	/nfs/dbraw/zinc/66/81/96/1440668196.db2.gz	AHPKWYMQIWPVJT-HXUWFJFHSA-N	0	3	339.483	3.467	20	30		EGEDHN
C#CCN1CCC(C)(CNC(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2)CC1	ZINC001754720978	1440673266	/nfs/dbraw/zinc/67/32/66/1440673266.db2.gz	XTSBWZMVCVJLNO-ZWKOTPCHSA-N	0	3	344.886	3.295	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(Cc1cc(C)no1)C2	ZINC001754784580	1440687236	/nfs/dbraw/zinc/68/72/36/1440687236.db2.gz	FCZSHKVMNUYYLE-JQHSSLGASA-N	0	3	343.471	3.221	20	30		EGEDHN
CC/C(C)=C\C(=O)N1CC[C@H]([C@@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001754793589	1440688923	/nfs/dbraw/zinc/68/89/23/1440688923.db2.gz	YOWGKAXMKGQDRY-YLOBKTRHSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2Cc1cc(C)no1	ZINC001754831232	1440695428	/nfs/dbraw/zinc/69/54/28/1440695428.db2.gz	SZZSZMRBUKBCGG-BJWYYQGGSA-N	0	3	345.487	3.445	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@]1(CO)CCCN(Cc2ccccc2C)C1	ZINC001754858155	1440700527	/nfs/dbraw/zinc/70/05/27/1440700527.db2.gz	VNDBPEOSOXHYKQ-NQIIRXRSSA-N	0	3	344.499	3.040	20	30		EGEDHN
CC/C=C(\C)C(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1cccc(C#N)c1	ZINC001754863261	1440701667	/nfs/dbraw/zinc/70/16/67/1440701667.db2.gz	UXLJBPKZFHJIIG-LOYCOBDFSA-N	0	3	337.467	3.480	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)CCC(F)F)c1	ZINC001754869401	1440704257	/nfs/dbraw/zinc/70/42/57/1440704257.db2.gz	WUUOHEZPPSWCTJ-DLBZAZTESA-N	0	3	347.409	3.169	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](OCC)c1ccccc1	ZINC001754871241	1440705108	/nfs/dbraw/zinc/70/51/08/1440705108.db2.gz	GNXPKSAFNNPHNZ-GUDVDZBRSA-N	0	3	328.456	3.016	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](CCN[C@H](C)c2cnc(C)cn2)C1	ZINC001754917407	1440708896	/nfs/dbraw/zinc/70/88/96/1440708896.db2.gz	OVRMVHNFKLATSO-IAGOWNOFSA-N	0	3	330.476	3.031	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCN(C(=O)c2ccc(OC)c(C)c2)C1	ZINC001754935522	1440711069	/nfs/dbraw/zinc/71/10/69/1440711069.db2.gz	LHMWBGCVGKRUER-HNNXBMFYSA-N	0	3	336.863	3.198	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCN(C(=O)c2ccc(OC)c(C)c2)C1	ZINC001754935523	1440711109	/nfs/dbraw/zinc/71/11/09/1440711109.db2.gz	LHMWBGCVGKRUER-OAHLLOKOSA-N	0	3	336.863	3.198	20	30		EGEDHN
C=CCC1(C(=O)NCC2(NCc3cncn3C)CCC2)CCCCC1	ZINC001754992594	1440724969	/nfs/dbraw/zinc/72/49/69/1440724969.db2.gz	JFLILDYCKCEIFR-UHFFFAOYSA-N	0	3	344.503	3.075	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)CCc2ccc(Cl)s2)CC1	ZINC001755034746	1440733614	/nfs/dbraw/zinc/73/36/14/1440733614.db2.gz	YGKBYCOVEUFNHF-AWEZNQCLSA-N	0	3	338.904	3.328	20	30		EGEDHN
CN(CCCN(C)C(=O)[C@@]1(C)C=CCC1)Cc1ccc(F)c(C#N)c1	ZINC001755043072	1440738687	/nfs/dbraw/zinc/73/86/87/1440738687.db2.gz	YWUARSMEZFMESA-FQEVSTJZSA-N	0	3	343.446	3.334	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)CCCC(F)(F)F)C1	ZINC001755047038	1440741784	/nfs/dbraw/zinc/74/17/84/1440741784.db2.gz	LFMFYICUIDGUBO-HOTGVXAUSA-N	0	3	344.421	3.445	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)CCCOC(C)C)C1	ZINC001755047439	1440742044	/nfs/dbraw/zinc/74/20/44/1440742044.db2.gz	NTKUOOJNFRVOFB-WOJBJXKFSA-N	0	3	348.531	3.308	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H]1Cc2ccccc2CN1C[C@@H](CC)OC	ZINC001755075373	1440748475	/nfs/dbraw/zinc/74/84/75/1440748475.db2.gz	FKGPLDROSQYKDX-VQTJNVASSA-N	0	3	344.499	3.311	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)CC(C)(C)C(F)(F)F)C2	ZINC001755079723	1440750515	/nfs/dbraw/zinc/75/05/15/1440750515.db2.gz	PUSVHJLIRJZDJO-KRWDZBQOSA-N	0	3	344.421	3.303	20	30		EGEDHN
C=C[C@@](C)(O)CC(=O)NCc1ccc2c(c1)CN(CC/C=C\CC)C2	ZINC001755100816	1440752187	/nfs/dbraw/zinc/75/21/87/1440752187.db2.gz	HZZHHXDRFYAGDR-IZRJCCQOSA-N	0	3	342.483	3.302	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@@H](C)[C@@H](NCc2ccccc2OC(C)C)C1	ZINC001755109004	1440754140	/nfs/dbraw/zinc/75/41/40/1440754140.db2.gz	ORSNYJXLGMNTMV-MJGOQNOKSA-N	0	3	342.483	3.070	20	30		EGEDHN
CC(C)CCC(=O)N[C@H]1CCN(Cc2cccc(C#N)c2)[C@H](C)C1	ZINC001755157405	1440763378	/nfs/dbraw/zinc/76/33/78/1440763378.db2.gz	IDDFFDPIMPHJHZ-APWZRJJASA-N	0	3	327.472	3.464	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)CCOc2cccc(C)c2C)C[C@@H]1C	ZINC001755162714	1440765500	/nfs/dbraw/zinc/76/55/00/1440765500.db2.gz	YMYNXPRGXLJQJS-HKUYNNGSSA-N	0	3	342.483	3.065	20	30		EGEDHN
COc1ccc(CN(C)C[C@H]2CCCN2C(=O)C#CC(C)C)cc1C	ZINC001755193449	1440775456	/nfs/dbraw/zinc/77/54/56/1440775456.db2.gz	YIHQCSDNQTXVJJ-LJQANCHMSA-N	0	3	342.483	3.086	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@H]1CN(C)Cc1ccc(CO)cc1	ZINC001755199328	1440778800	/nfs/dbraw/zinc/77/88/00/1440778800.db2.gz	UYAQQALPDAWKCY-IBGZPJMESA-N	0	3	344.499	3.204	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](C)[C@H](C)NCc1cnn(C(C)(C)C)c1	ZINC001755248009	1440791209	/nfs/dbraw/zinc/79/12/09/1440791209.db2.gz	FSHHGJAHBCKERK-GJZGRUSLSA-N	0	3	334.508	3.223	20	30		EGEDHN
Cc1cocc1C(=O)N[C@@H](C)[C@H](C)NCC#Cc1ccc(Cl)cc1	ZINC001755248785	1440791422	/nfs/dbraw/zinc/79/14/22/1440791422.db2.gz	LFFVWGMUSNUVHE-GJZGRUSLSA-N	0	3	344.842	3.390	20	30		EGEDHN
CCCC1(C(=O)N[C@@H](C)[C@@H](C)NCC#Cc2ccc(F)cc2)CC1	ZINC001755252940	1440792445	/nfs/dbraw/zinc/79/24/45/1440792445.db2.gz	MXUDQFYGRNXXKJ-CVEARBPZSA-N	0	3	330.447	3.240	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](C)[C@@H](C)NCc2cccc(Cl)n2)CC1	ZINC001755253807	1440792747	/nfs/dbraw/zinc/79/27/47/1440792747.db2.gz	WPZGLZLMJMUSNJ-ZIAGYGMSSA-N	0	3	335.879	3.464	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)[C@H](C)c1c(C)noc1C	ZINC001755285437	1440801957	/nfs/dbraw/zinc/80/19/57/1440801957.db2.gz	JOYSRGFCOACIQH-GFCCVEGCSA-N	0	3	341.883	3.222	20	30		EGEDHN
CCc1cccc(OCCN(C)[C@@H](C)CNC(=O)C#CC(C)(C)C)c1	ZINC001755300405	1440808311	/nfs/dbraw/zinc/80/83/11/1440808311.db2.gz	PJWVPGFQLUJXOR-KRWDZBQOSA-N	0	3	344.499	3.114	20	30		EGEDHN
C[C@@H](CNC(=O)CCCC(F)(F)F)N(C)Cc1ccc(C#N)cc1	ZINC001755318546	1440816927	/nfs/dbraw/zinc/81/69/27/1440816927.db2.gz	LFPPPJNDQQVLKN-ZDUSSCGKSA-N	0	3	341.377	3.227	20	30		EGEDHN
C=CCOCCN(C)[C@H](C)CNC(=O)c1cccc2ccsc21	ZINC001755325475	1440821588	/nfs/dbraw/zinc/82/15/88/1440821588.db2.gz	WJAHZNQBTOHKRT-CQSZACIVSA-N	0	3	332.469	3.154	20	30		EGEDHN
Cc1ccccc1CC(=O)NC[C@@H](C)N(C)Cc1cccc(C#N)c1	ZINC001755326520	1440821944	/nfs/dbraw/zinc/82/19/44/1440821944.db2.gz	SAOSGTDAHGKGEZ-QGZVFWFLSA-N	0	3	335.451	3.046	20	30		EGEDHN
CCCC[C@H](CNCC#Cc1ccc(F)cc1)NC(=O)c1ccco1	ZINC001755356257	1440829513	/nfs/dbraw/zinc/82/95/13/1440829513.db2.gz	IZHJJWUYORAYSB-GOSISDBHSA-N	0	3	342.414	3.349	20	30		EGEDHN
C/C=C(\C)C(=O)NC[C@H]1CCCCCN1Cc1ccc(C#N)cc1	ZINC001755364928	1440833886	/nfs/dbraw/zinc/83/38/86/1440833886.db2.gz	MOSCDXYWJLCMJP-KVMOOHLOSA-N	0	3	325.456	3.385	20	30		EGEDHN
C=CCOCCN1CCCCC[C@@H]1CNC(=O)c1ccc(C)cc1F	ZINC001755367846	1440835636	/nfs/dbraw/zinc/83/56/36/1440835636.db2.gz	JKKCXJRZRBPEOQ-QGZVFWFLSA-N	0	3	348.462	3.311	20	30		EGEDHN
C[C@@H](NC(=O)C#CC1CC1)C1CN(CCc2ccc3ccccc3c2)C1	ZINC001755373849	1440837750	/nfs/dbraw/zinc/83/77/50/1440837750.db2.gz	LYFSQAJYVONUCM-QGZVFWFLSA-N	0	3	346.474	3.232	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CN(CCOCCCC)CC2(C)C)CC1	ZINC001755413516	1440847710	/nfs/dbraw/zinc/84/77/10/1440847710.db2.gz	FIMBHXJQQJWRRQ-GOSISDBHSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCCC(=O)N1C[C@@]2(C)CN(Cc3ccc(F)cc3)C[C@@]2(C)C1	ZINC001755460769	1440857475	/nfs/dbraw/zinc/85/74/75/1440857475.db2.gz	SKJAYXMEXUUWOA-BGYRXZFFSA-N	0	3	330.447	3.462	20	30		EGEDHN
Cc1occc1C(=O)N[C@H](C)CCCNCc1ccccc1C#N	ZINC001755486626	1440860885	/nfs/dbraw/zinc/86/08/85/1440860885.db2.gz	QGSCXBSDWJQULB-CQSZACIVSA-N	0	3	325.412	3.148	20	30		EGEDHN
C=C(Cl)CNCCC[C@@H](C)NC(=O)CC1(C(F)(F)F)CC1	ZINC001755501187	1440862627	/nfs/dbraw/zinc/86/26/27/1440862627.db2.gz	ALELHXGQNQIWJH-LLVKDONJSA-N	0	3	326.790	3.346	20	30		EGEDHN
CN(CC#Cc1ccccc1)C1CCN(C(=O)[C@H]2CCC2(F)F)CC1	ZINC001755530909	1440867254	/nfs/dbraw/zinc/86/72/54/1440867254.db2.gz	UAIDFQCQSHLSOR-GOSISDBHSA-N	0	3	346.421	3.006	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC(N(C)Cc2c(C)noc2C)CC1	ZINC001755532485	1440867893	/nfs/dbraw/zinc/86/78/93/1440867893.db2.gz	PENXYFKGNUSIFU-INIZCTEOSA-N	0	3	333.476	3.317	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H](CO)N[C@@H](C)c1ccc2ccccc2c1	ZINC001755630977	1440890659	/nfs/dbraw/zinc/89/06/59/1440890659.db2.gz	UYSYZJRHAPSJCN-JXFKEZNVSA-N	0	3	340.467	3.324	20	30		EGEDHN
CC#CCN[C@H]1C[C@H](C)N(C(=O)c2ccc(Cl)c3occc32)C1	ZINC001755691598	1440896836	/nfs/dbraw/zinc/89/68/36/1440896836.db2.gz	ZMYQZQRZKYWZAH-STQMWFEESA-N	0	3	330.815	3.302	20	30		EGEDHN
C[C@@H]1C[C@H](NCC#Cc2ccccc2)CN1C(=O)C1CCC=CCC1	ZINC001755692432	1440896931	/nfs/dbraw/zinc/89/69/31/1440896931.db2.gz	KYDWKLNOOBXQET-NQIIRXRSSA-N	0	3	336.479	3.364	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H]2CCC[C@@H](NCc3nccs3)[C@H]2C1	ZINC001755708219	1440903158	/nfs/dbraw/zinc/90/31/58/1440903158.db2.gz	WHRHONRQNBTRPJ-HRCADAONSA-N	0	3	333.501	3.216	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1CCCN(CCn2nc(C)cc2C)[C@@H]1C	ZINC001755720023	1440906746	/nfs/dbraw/zinc/90/67/46/1440906746.db2.gz	CDDLAHCCSJAKHA-MSOLQXFVSA-N	0	3	346.519	3.071	20	30		EGEDHN
CCC(=O)NCC[C@@H](Cc1ccccc1)NCc1ccccc1C#N	ZINC001755724529	1440908840	/nfs/dbraw/zinc/90/88/40/1440908840.db2.gz	XSDRNKKIJOZUGK-FQEVSTJZSA-N	0	3	335.451	3.175	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CCCN(Cc2ccc3c(c2)CCC3)[C@H]1C	ZINC001755730734	1440910056	/nfs/dbraw/zinc/91/00/56/1440910056.db2.gz	NCZNWCZMCNSOCK-UWJYYQICSA-N	0	3	338.495	3.448	20	30		EGEDHN
CC1(C)CN(C(=O)[C@]2(C)C=CCC2)C[C@@H]1NCC#Cc1ccccc1	ZINC001755773843	1440917160	/nfs/dbraw/zinc/91/71/60/1440917160.db2.gz	JZYSHELKSQZZFG-SIKLNZKXSA-N	0	3	336.479	3.221	20	30		EGEDHN
C#CCCN(C)CCN(C(=O)[C@@H]1C[C@]1(C)c1ccccc1)C(C)C	ZINC001755814227	1440922140	/nfs/dbraw/zinc/92/21/40/1440922140.db2.gz	UDCZQZPDNHUMSY-PZJWPPBQSA-N	0	3	326.484	3.156	20	30		EGEDHN
C=C(C)CN(C)CCN(C(=O)C[C@@H]1OCCc2ccccc21)C(C)C	ZINC001755817274	1440924069	/nfs/dbraw/zinc/92/40/69/1440924069.db2.gz	GVUFIMMZRHGECG-FQEVSTJZSA-N	0	3	344.499	3.435	20	30		EGEDHN
C#CCCCC(=O)N[C@H](CNCc1ccc(C#N)s1)C(C)(C)C	ZINC001755823600	1440926572	/nfs/dbraw/zinc/92/65/72/1440926572.db2.gz	IVAHKXORZQSLJQ-MRXNPFEDSA-N	0	3	331.485	3.044	20	30		EGEDHN
CC(C)=CC(=O)N[C@H](C)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001755841533	1440931774	/nfs/dbraw/zinc/93/17/74/1440931774.db2.gz	NNTBUYKBUSZLBI-MRXNPFEDSA-N	0	3	325.456	3.241	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](C)C1CCN(CCOCC(F)F)CC1	ZINC001755848818	1440934234	/nfs/dbraw/zinc/93/42/34/1440934234.db2.gz	ZWSRWOVXGUNTQR-AWEZNQCLSA-N	0	3	346.462	3.087	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC1=CCN(CCOc2ccccc2)CC1	ZINC001755892224	1440941888	/nfs/dbraw/zinc/94/18/88/1440941888.db2.gz	BRTSALQVFASNSF-OAQYLSRUSA-N	0	3	342.483	3.416	20	30		EGEDHN
C=C(Cl)Cn1c(C2CCC2)nnc1N1CCN(CC(C)C)CC1	ZINC001760375231	1441368086	/nfs/dbraw/zinc/36/80/86/1441368086.db2.gz	IBDYFFTTWUHVKQ-UHFFFAOYSA-N	0	3	337.899	3.076	20	30		EGEDHN
Cc1ccc([C@H](C#N)c2ccc(N3CCN(CC(C)C)CC3)nn2)cc1	ZINC001164651313	719329495	/nfs/dbraw/zinc/32/94/95/719329495.db2.gz	FNGPXNWFYXUVFR-IBGZPJMESA-N	0	3	349.482	3.219	20	30		EGEDHN
C=CC[C@@H]1CCCC[C@H]1[NH2+]CCCOc1ccc(-c2nn[n-]n2)cc1	ZINC001573329710	947425819	/nfs/dbraw/zinc/42/58/19/947425819.db2.gz	NQAVYFCZRZPWFY-CRAIPNDOSA-N	0	3	341.459	3.360	20	30		EGEDHN
C=CC[C@@H](C(=O)[O-])[NH+]1CCC(c2ccccc2)(N2CCCC2)CC1	ZINC001588728569	983983048	/nfs/dbraw/zinc/98/30/48/983983048.db2.gz	DCBXQMKCHAHYDO-SFHVURJKSA-N	0	3	328.456	3.103	20	30		EGEDHN
C=CC[C@@H](C(=O)[O-])N1CCC(c2ccccc2)([NH+]2CCCC2)CC1	ZINC001588728569	983983050	/nfs/dbraw/zinc/98/30/50/983983050.db2.gz	DCBXQMKCHAHYDO-SFHVURJKSA-N	0	3	328.456	3.103	20	30		EGEDHN
COc1ccccc1C(C)(C)NCCC(=O)Nc1ccc(C#N)cc1	ZINC000103484087	219305977	/nfs/dbraw/zinc/30/59/77/219305977.db2.gz	NPVLVGGJQFABLP-UHFFFAOYSA-N	0	3	337.423	3.420	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1	ZINC000130410423	223149990	/nfs/dbraw/zinc/14/99/90/223149990.db2.gz	QEAWDLMYOHMSOV-IBGZPJMESA-N	0	3	337.379	3.164	20	30		EGEDHN
CN(CCSCC(=O)Nc1sccc1C#N)Cc1ccccc1	ZINC000193628841	240243369	/nfs/dbraw/zinc/24/33/69/240243369.db2.gz	JBLLVUKTABAOHH-UHFFFAOYSA-N	0	3	345.493	3.423	20	30		EGEDHN
C=C(C)COc1cccc(NC(=O)N(C)C[C@H]2CCCN(C)C2)c1	ZINC000078801422	217125150	/nfs/dbraw/zinc/12/51/50/217125150.db2.gz	JRVYXVURABUMNC-INIZCTEOSA-N	0	3	331.460	3.447	20	30		EGEDHN
C[C@H]1C[C@@H](c2ccccc2)CN1CC(=O)NCc1ccc(C#N)cc1	ZINC000265258522	247346675	/nfs/dbraw/zinc/34/66/75/247346675.db2.gz	XSJNGDVZLHLXNT-OXJNMPFZSA-N	0	3	333.435	3.052	20	30		EGEDHN
C=CCc1cc(CN2CCC(n3ccnc3)CC2)cc(OC)c1O	ZINC000092648554	218155844	/nfs/dbraw/zinc/15/58/44/218155844.db2.gz	LQRKHMUEQRNUPJ-UHFFFAOYSA-N	0	3	327.428	3.163	20	30		EGEDHN
CCOCCN(C)CCC(=O)Nc1sc2c(c1C#N)CC[C@H](C)C2	ZINC000093312048	218212923	/nfs/dbraw/zinc/21/29/23/218212923.db2.gz	IDZZSUKUYVNVNW-ZDUSSCGKSA-N	0	3	349.500	3.041	20	30		EGEDHN
CN(CCN1CCCC1=O)Cc1ccc(-c2ccccc2C#N)cc1	ZINC000532573901	269688067	/nfs/dbraw/zinc/68/80/67/269688067.db2.gz	KAJYSWYCQYPGGN-UHFFFAOYSA-N	0	3	333.435	3.279	20	30		EGEDHN
N#Cc1ccccc1OCCN1CCC[C@@H]1C[C@@H](O)c1ccco1	ZINC000268236081	251750921	/nfs/dbraw/zinc/75/09/21/251750921.db2.gz	FUPFIJWXTGQWJD-IAGOWNOFSA-N	0	3	326.396	3.118	20	30		EGEDHN
CN(C[C@@H](O)c1ccc(C#N)cc1)[C@@H]1CCCN(c2ccccc2)C1	ZINC000268703592	252154767	/nfs/dbraw/zinc/15/47/67/252154767.db2.gz	RUDLJXFATAQPJP-NHCUHLMSSA-N	0	3	335.451	3.192	20	30		EGEDHN
C[C@@H](NCCNc1nccc(C(F)(F)F)n1)c1cccc(C#N)c1	ZINC000181777895	533397790	/nfs/dbraw/zinc/39/77/90/533397790.db2.gz	HZPZSOOANYKWKM-LLVKDONJSA-N	0	3	335.333	3.130	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2CNCc2ccc(C#N)o2)C[C@H](C)O1	ZINC000237621454	141010852	/nfs/dbraw/zinc/01/08/52/141010852.db2.gz	ZCUYLSSYPBLUHD-IYBDPMFKSA-N	0	3	339.439	3.050	20	30		EGEDHN
CCCN(CCN1CCCC1)C(=O)Nc1cc(C#N)cn1C(C)(C)C	ZINC000353345393	141291969	/nfs/dbraw/zinc/29/19/69/141291969.db2.gz	BPZHVCZGXSICFM-UHFFFAOYSA-N	0	3	345.491	3.454	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN[C@H]1CCCc2c(O)cccc21	ZINC000192367772	144173888	/nfs/dbraw/zinc/17/38/88/144173888.db2.gz	RVENDJRQCALHSN-KRWDZBQOSA-N	0	3	338.407	3.318	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccc(F)c(C#N)c2)C1	ZINC000341101269	155157343	/nfs/dbraw/zinc/15/73/43/155157343.db2.gz	DRRBSGHPBOYSDT-RDTXWAMCSA-N	0	3	337.398	3.263	20	30		EGEDHN
COc1cc(C#N)ccc1CN1CCCN(Cc2ccccc2)CC1	ZINC000120543341	152284374	/nfs/dbraw/zinc/28/43/74/152284374.db2.gz	WITOAFOYBYBQCN-UHFFFAOYSA-N	0	3	335.451	3.275	20	30		EGEDHN
COc1cc([C@H](C)N[C@@H](C)c2ccc(C#N)cc2)ccc1OCCO	ZINC000341590172	155370578	/nfs/dbraw/zinc/37/05/78/155370578.db2.gz	UJBQKEVFIHCHHC-GJZGRUSLSA-N	0	3	340.423	3.350	20	30		EGEDHN
C[C@H](N[C@@H]1[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]21)c1ccc(C#N)cc1	ZINC000302083802	154025283	/nfs/dbraw/zinc/02/52/83/154025283.db2.gz	FUZDCHGFCLLCCT-KKBVYLPWSA-N	0	3	327.428	3.074	20	30		EGEDHN
CSCC[C@@H](N[C@H]1CCCCc2cc(C#N)ccc21)C(=O)N(C)C	ZINC000352505187	286671397	/nfs/dbraw/zinc/67/13/97/286671397.db2.gz	YSRJKQSCQHLBPR-ZWKOTPCHSA-N	0	3	345.512	3.125	20	30		EGEDHN
COC(=O)[C@H]1CN(Cc2cc(C#N)cs2)C[C@@H]1c1ccccc1	ZINC000343636586	164000634	/nfs/dbraw/zinc/00/06/34/164000634.db2.gz	IZXHYSZKGWOLDX-SJORKVTESA-N	0	3	326.421	3.008	20	30		EGEDHN
C[C@@H](NCc1ccc(CN2CCOCC2)cc1)c1cccc(C#N)c1	ZINC000344087999	164100843	/nfs/dbraw/zinc/10/08/43/164100843.db2.gz	MVMGYMABBCYLFI-QGZVFWFLSA-N	0	3	335.451	3.241	20	30		EGEDHN
C[C@@H](N[C@@H](C)Cn1cc(Br)cn1)c1ccc(C#N)cc1	ZINC000154332071	287049557	/nfs/dbraw/zinc/04/95/57/287049557.db2.gz	IYXDCRCDXNIXON-NWDGAFQWSA-N	0	3	333.233	3.257	20	30		EGEDHN
CC[C@H](C(=O)N1CCC(Oc2cccc(C#N)c2)CC1)N(CC)CC	ZINC000346021286	164319116	/nfs/dbraw/zinc/31/91/16/164319116.db2.gz	CGLKHOSQWRZRRL-LJQANCHMSA-N	0	3	343.471	3.048	20	30		EGEDHN
CC[C@@H]1CCCCN1CCNC(=O)NC1(c2cccc(C#N)c2)CC1	ZINC000353547966	165799753	/nfs/dbraw/zinc/79/97/53/165799753.db2.gz	YZXCQPBFBPVIAX-GOSISDBHSA-N	0	3	340.471	3.111	20	30		EGEDHN
C[C@H](CNC(=O)c1ccc(Sc2ccccc2C#N)cc1)N(C)C	ZINC000359023776	167040936	/nfs/dbraw/zinc/04/09/36/167040936.db2.gz	ADWBIUQZBYKHJW-CQSZACIVSA-N	0	3	339.464	3.389	20	30		EGEDHN
Cn1cc(CNC2(c3ccc(Cl)cc3)CCOCC2)cc1C#N	ZINC000359733866	167218259	/nfs/dbraw/zinc/21/82/59/167218259.db2.gz	IRQGQSGAFOPTBZ-UHFFFAOYSA-N	0	3	329.831	3.346	20	30		EGEDHN
C[C@@H]1CN(CC2CCN(Cc3cc(F)ccc3C#N)CC2)C[C@H](C)O1	ZINC000159586015	225245519	/nfs/dbraw/zinc/24/55/19/225245519.db2.gz	TVWYVKWBPRLJAC-IYBDPMFKSA-N	0	3	345.462	3.019	20	30		EGEDHN
C[C@@H](N[C@@H](C)C(=O)Nc1cccc(C#N)c1)c1ccc2n[nH]cc2c1	ZINC000507267254	269845282	/nfs/dbraw/zinc/84/52/82/269845282.db2.gz	WWYKWFWEKJJNNP-OLZOCXBDSA-N	0	3	333.395	3.112	20	30		EGEDHN
COc1ccc([O-])c(C[NH2+]C2CCN(c3ccc(C#N)cc3)CC2)c1	ZINC000367601668	270045792	/nfs/dbraw/zinc/04/57/92/270045792.db2.gz	OVNLXNZPOVHEPM-UHFFFAOYSA-N	0	3	337.423	3.031	20	30		EGEDHN
CCCC[C@@H]1CCC[C@H]1NCCS(=O)(=O)c1ccc(C#N)cc1	ZINC000184696660	266038344	/nfs/dbraw/zinc/03/83/44/266038344.db2.gz	BKBZKGRWEHNJHM-SJLPKXTDSA-N	0	3	334.485	3.280	20	30		EGEDHN
CCN(CC)[C@@H](CNCc1ccc(C#N)c(OC)c1)c1ccco1	ZINC000281469676	266119874	/nfs/dbraw/zinc/11/98/74/266119874.db2.gz	BKPBPAOXGQBKIF-KRWDZBQOSA-N	0	3	327.428	3.333	20	30		EGEDHN
CCN(Cc1cccc(F)c1)C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000348011202	266135976	/nfs/dbraw/zinc/13/59/76/266135976.db2.gz	LNOXLQMJBVFWLI-SFHVURJKSA-N	0	3	335.382	3.428	20	30		EGEDHN
CN(C(=O)C(C#N)Cc1ccc(C#N)cc1)C1CCC(F)(F)CC1	ZINC000288834572	266481390	/nfs/dbraw/zinc/48/13/90/266481390.db2.gz	ACNJSHSTWWLWAE-HNNXBMFYSA-N	0	3	331.366	3.277	20	30		EGEDHN
COc1cc(NCCN[C@@H](C)c2ccc(C#N)c(F)c2)cc(OC)c1	ZINC000271945034	266838460	/nfs/dbraw/zinc/83/84/60/266838460.db2.gz	NAKNSLOGXXGLJG-ZDUSSCGKSA-N	0	3	343.402	3.477	20	30		EGEDHN
C[C@@H](NC[C@@H](O)COc1ccccc1Cl)c1ccc(C#N)cc1	ZINC000298401947	266967559	/nfs/dbraw/zinc/96/75/59/266967559.db2.gz	JWFSXMJFKPVMBA-CZUORRHYSA-N	0	3	330.815	3.302	20	30		EGEDHN
CCCCN1CCCC[C@@H]1CNC(=O)C1(c2cccc(C#N)c2)CC1	ZINC000435008385	267007399	/nfs/dbraw/zinc/00/73/99/267007399.db2.gz	MTMUKCFSSDHZOD-LJQANCHMSA-N	0	3	339.483	3.361	20	30		EGEDHN
C[C@@H]1CN(CCCCNc2c(C#N)cnc3ccccc32)C[C@@H](C)O1	ZINC000301704463	267047506	/nfs/dbraw/zinc/04/75/06/267047506.db2.gz	FVYSAJRZIUOVGC-HZPDHXFCSA-N	0	3	338.455	3.408	20	30		EGEDHN
C[C@H](NC(=O)N1CCCC12CCN(C)CC2)c1ccc(C#N)cc1	ZINC000329095330	267122033	/nfs/dbraw/zinc/12/20/33/267122033.db2.gz	XXDYAMOYGNLEEH-HNNXBMFYSA-N	0	3	326.444	3.093	20	30		EGEDHN
C[C@H](Cc1ccccc1F)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000279378172	267167078	/nfs/dbraw/zinc/16/70/78/267167078.db2.gz	SMMWNTDGARUGJF-KDOFPFPSSA-N	0	3	335.382	3.127	20	30		EGEDHN
C[C@H](NC(=O)C(C#N)Cc1ccc(C#N)cc1)c1c(F)cccc1F	ZINC000348090422	267176599	/nfs/dbraw/zinc/17/65/99/267176599.db2.gz	TYRSZWOXXCYISD-WFASDCNBSA-N	0	3	339.345	3.396	20	30		EGEDHN
CC[C@@H](C)N(CC(=O)NCc1cccc(C#N)c1)Cc1ccccc1	ZINC000507703415	267184785	/nfs/dbraw/zinc/18/47/85/267184785.db2.gz	BVCAABQGJUZPGG-QGZVFWFLSA-N	0	3	335.451	3.475	20	30		EGEDHN
CN(C)[C@H](CNc1ccc(C(F)(F)F)c(C#N)n1)c1ccsc1	ZINC000443519563	267287849	/nfs/dbraw/zinc/28/78/49/267287849.db2.gz	OSVZYKYQQZQVDU-CYBMUJFWSA-N	0	3	340.374	3.170	20	30		EGEDHN
Cc1cc([O-])c(C[NH2+]C2CCN(c3ccc(C#N)cn3)CC2)cc1C	ZINC000361452564	267350548	/nfs/dbraw/zinc/35/05/48/267350548.db2.gz	RZJGTXOZRJOBIK-UHFFFAOYSA-N	0	3	336.439	3.034	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@@H]2C[C@H]2c2cccc(F)c2)cc1	ZINC000280205109	268086809	/nfs/dbraw/zinc/08/68/09/268086809.db2.gz	ZQKHFSQDNHZEDB-YTQUADARSA-N	0	3	333.366	3.052	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@H]2CCc3cc(F)ccc32)cc1	ZINC000279395036	268092106	/nfs/dbraw/zinc/09/21/06/268092106.db2.gz	UPNMBGSYMDEBED-APWZRJJASA-N	0	3	333.366	3.183	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@@H]2CSc3ccccc32)cc1	ZINC000348294155	268092475	/nfs/dbraw/zinc/09/24/75/268092475.db2.gz	QJWWOHOPKHPPOH-NVXWUHKLSA-N	0	3	333.416	3.204	20	30		EGEDHN
N#Cc1ccc(NC(=O)NCCN2CCCCC2)cc1C(F)(F)F	ZINC000174093426	268147274	/nfs/dbraw/zinc/14/72/74/268147274.db2.gz	SSVXPEZEADLSIC-UHFFFAOYSA-N	0	3	340.349	3.184	20	30		EGEDHN
N#Cc1cc(Br)ccc1CN[C@H]([C@@H](CO)C1CC1)C1CC1	ZINC000451611109	268174483	/nfs/dbraw/zinc/17/44/83/268174483.db2.gz	LBQDANDNZKOEAS-IRXDYDNUSA-N	0	3	349.272	3.207	20	30		EGEDHN
N#Cc1cc(Br)ccc1CN[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2	ZINC000451487717	268174634	/nfs/dbraw/zinc/17/46/34/268174634.db2.gz	HNBBSTLJKSAODL-XHSDSOJGSA-N	0	3	347.256	3.368	20	30		EGEDHN
N#Cc1cccc(NCC2CCN(c3ccncc3)CC2)c1[N+](=O)[O-]	ZINC000450427331	268281825	/nfs/dbraw/zinc/28/18/25/268281825.db2.gz	YOWYJUVDJDJZAI-UHFFFAOYSA-N	0	3	337.383	3.190	20	30		EGEDHN
N#Cc1ccccc1OCCN1CC[C@H](COCc2ccccc2)C1	ZINC000173987164	268282739	/nfs/dbraw/zinc/28/27/39/268282739.db2.gz	WSLFZTQCKQTCPR-IBGZPJMESA-N	0	3	336.435	3.476	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CN1CCC[C@H]1c1ccc(F)cc1	ZINC000528336380	268300273	/nfs/dbraw/zinc/30/02/73/268300273.db2.gz	BGTPRQMRXURENE-MOPGFXCFSA-N	0	3	340.398	3.274	20	30		EGEDHN
N#Cc1ccncc1NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000271221868	268301193	/nfs/dbraw/zinc/30/11/93/268301193.db2.gz	CVHOFZPRMFVNKU-UHFFFAOYSA-N	0	3	340.402	3.048	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)C[C@@H](O)COc1ccc(F)cc1	ZINC000047740004	275143264	/nfs/dbraw/zinc/14/32/64/275143264.db2.gz	IEPKYSBPRCERHK-LJQANCHMSA-N	0	3	342.414	3.349	20	30		EGEDHN
CC1(C)CN(C2(CNc3ccc(C#N)nc3)CCCCC2)CCO1	ZINC000359478996	281230267	/nfs/dbraw/zinc/23/02/67/281230267.db2.gz	HSZYDEQKTMXXMW-UHFFFAOYSA-N	0	3	328.460	3.179	20	30		EGEDHN
Cc1ccccc1[C@@H]([C@@H](C)NC(=O)c1cccc(F)c1C#N)N(C)C	ZINC000357879206	302137972	/nfs/dbraw/zinc/13/79/72/302137972.db2.gz	VJXNBBJXRZOYTN-AUUYWEPGSA-N	0	3	339.414	3.427	20	30		EGEDHN
C[C@H](C(=O)NCCSCc1ccccc1C#N)N1[C@H](C)CC[C@@H]1C	ZINC000249907756	308029047	/nfs/dbraw/zinc/02/90/47/308029047.db2.gz	VGZYKYDZKDNPNE-OWCLPIDISA-N	0	3	345.512	3.169	20	30		EGEDHN
C[C@H](NCCN1CCN(c2ccccc2)CC1)c1ccc(C#N)cc1	ZINC000537297000	314172863	/nfs/dbraw/zinc/17/28/63/314172863.db2.gz	JHTMKSASUNTNSV-SFHVURJKSA-N	0	3	334.467	3.031	20	30		EGEDHN
CC[C@H]1CN(Cc2cccc(OCc3cccc(C#N)c3)c2)C[C@H]1O	ZINC000539899868	314350414	/nfs/dbraw/zinc/35/04/14/314350414.db2.gz	XYJZXUHOHFKKAK-PZJWPPBQSA-N	0	3	336.435	3.340	20	30		EGEDHN
C[C@@H](Cc1ccsc1)N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000541882249	314501182	/nfs/dbraw/zinc/50/11/82/314501182.db2.gz	TXZRJXHLMMEPMA-KSSFIOAISA-N	0	3	339.464	3.336	20	30		EGEDHN
CC(C)(C)c1ccc(CCNCc2cnc3c(C#N)cnn3c2)cc1	ZINC000555552195	315390201	/nfs/dbraw/zinc/39/02/01/315390201.db2.gz	KMLDIJURCRGULF-UHFFFAOYSA-N	0	3	333.439	3.231	20	30		EGEDHN
C[C@@H]1C[C@@H](C(C)(C)C)CCN1CC(=O)NCc1cccc(C#N)c1	ZINC000565125639	316271463	/nfs/dbraw/zinc/27/14/63/316271463.db2.gz	QYQSWURVBVZRLG-QAPCUYQASA-N	0	3	327.472	3.321	20	30		EGEDHN
CC(C)(C)[C@@H](CN1CCc2ccccc2C1)Nc1cc(C#N)ncn1	ZINC000565988271	316398253	/nfs/dbraw/zinc/39/82/53/316398253.db2.gz	WZXKTZYAPKNBOL-GOSISDBHSA-N	0	3	335.455	3.233	20	30		EGEDHN
CN(CCc1ccc(Br)cc1)Cc1ccc(C#N)cn1	ZINC000570383118	317047440	/nfs/dbraw/zinc/04/74/40/317047440.db2.gz	HHIXNMPGRSZJQU-UHFFFAOYSA-N	0	3	330.229	3.390	20	30		EGEDHN
COC(=O)c1cccc(CN[C@@H](C(C)C)C2(CO)CCCC2)c1C#N	ZINC000577359553	324792516	/nfs/dbraw/zinc/79/25/16/324792516.db2.gz	IGSUWTMLWZAZRX-SFHVURJKSA-N	0	3	344.455	3.012	20	30		EGEDHN
N#Cc1ccc(S(=O)(=O)CCN[C@@H]2CC[C@@H]3CCCC[C@@H]3C2)cc1	ZINC000579303505	325089355	/nfs/dbraw/zinc/08/93/55/325089355.db2.gz	KVFNRXIYWLPAQA-RCCFBDPRSA-N	0	3	346.496	3.280	20	30		EGEDHN
Cc1ccc(NC(=O)CCN2CC=C(c3ccc(C#N)cc3)CC2)nc1	ZINC000579698504	325146768	/nfs/dbraw/zinc/14/67/68/325146768.db2.gz	ANIFSIUHTZBTLX-UHFFFAOYSA-N	0	3	346.434	3.380	20	30		EGEDHN
C[C@H](c1ccccc1)N1CCC(NC(=O)Nc2cccc(C#N)n2)CC1	ZINC000581249801	325346193	/nfs/dbraw/zinc/34/61/93/325346193.db2.gz	QXDQSDRBPPBQTO-OAHLLOKOSA-N	0	3	349.438	3.300	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(N(CC)CCC)nc2)CC1	ZINC000264514143	455227746	/nfs/dbraw/zinc/22/77/46/455227746.db2.gz	UOBQTITXMDVXJM-UHFFFAOYSA-N	0	3	344.503	3.088	20	30		EGEDHN
C#Cc1cccc(NC(=O)NCC2CCN(c3ccncc3)CC2)c1	ZINC000180692167	455228233	/nfs/dbraw/zinc/22/82/33/455228233.db2.gz	RDSFSRPLHBJXLD-UHFFFAOYSA-N	0	3	334.423	3.101	20	30		EGEDHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccc(F)c(C#N)c1	ZINC000183097167	455228837	/nfs/dbraw/zinc/22/88/37/455228837.db2.gz	PNWYYLNZXAOLJP-CQSZACIVSA-N	0	3	340.402	3.339	20	30		EGEDHN
C=CCC[C@H](C)N[C@H]1CCN(c2cccc(Br)c2)C1=O	ZINC000447065681	458259339	/nfs/dbraw/zinc/25/93/39/458259339.db2.gz	IEOBHGKDXYMOLG-WFASDCNBSA-N	0	3	337.261	3.499	20	30		EGEDHN
N#Cc1ccc(Br)c(CN[C@H]([C@H](CO)C2CC2)C2CC2)c1	ZINC000451618208	458483553	/nfs/dbraw/zinc/48/35/53/458483553.db2.gz	VQNQKZKRLHCYBG-WBVHZDCISA-N	0	3	349.272	3.207	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@@H](C)N[C@@H](C)c1cccc(-n2cccn2)c1	ZINC000173202785	455247079	/nfs/dbraw/zinc/24/70/79/455247079.db2.gz	SFBCQWGXJUEZOS-DLBZAZTESA-N	0	3	338.455	3.112	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H]2CC[C@H](Cc3ccccc3)C2)CC1	ZINC000189887449	455250689	/nfs/dbraw/zinc/25/06/89/455250689.db2.gz	NPNDFZKBHRJBQX-UYAOXDASSA-N	0	3	341.499	3.347	20	30		EGEDHN
C=CCc1cc(CN2CCC[C@H](C3(C)OCCO3)C2)cc(OC)c1O	ZINC000183237162	455257054	/nfs/dbraw/zinc/25/70/54/455257054.db2.gz	QGOGDWVHVJEABS-KRWDZBQOSA-N	0	3	347.455	3.104	20	30		EGEDHN
C[C@H](NCC#Cc1ccc(F)cc1)c1ccc(N2CCOC2=O)cc1	ZINC000181271630	455310403	/nfs/dbraw/zinc/31/04/03/455310403.db2.gz	VLZPWHMLPJBSQG-HNNXBMFYSA-N	0	3	338.382	3.485	20	30		EGEDHN
C=CCCOCC(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1	ZINC000620206323	460572436	/nfs/dbraw/zinc/57/24/36/460572436.db2.gz	XTPHLSDUUUFFLM-LJQANCHMSA-N	0	3	330.472	3.169	20	30		EGEDHN
COc1ccc(CN(C)CCC(=O)Nc2sccc2C#N)cc1	ZINC000007652964	453099490	/nfs/dbraw/zinc/09/94/90/453099490.db2.gz	SHZTZOSTLOPNAO-UHFFFAOYSA-N	0	3	329.425	3.089	20	30		EGEDHN
CN1CCC[C@H](CNC(=O)N2CCC(C#N)CC2)[C@H]1c1cccs1	ZINC000245671343	455353225	/nfs/dbraw/zinc/35/32/25/455353225.db2.gz	FKXGMIBIDKKUAP-WBVHZDCISA-N	0	3	346.500	3.076	20	30		EGEDHN
CN(C)Cc1c2ccccc2oc1C(=O)N1CCC[C@](C)(C#N)C1	ZINC000612366877	460606588	/nfs/dbraw/zinc/60/65/88/460606588.db2.gz	YJCNSFYHEQHPJC-LJQANCHMSA-N	0	3	325.412	3.260	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)c1ccc(C#N)cc1)c1ccsc1	ZINC000031987618	453860687	/nfs/dbraw/zinc/86/06/87/453860687.db2.gz	FRVKETHODXYICF-KRWDZBQOSA-N	0	3	327.453	3.433	20	30		EGEDHN
CC[C@H](CNC(=O)c1cccc(C#N)c1)N1CCc2ccccc2C1	ZINC000032446154	453873327	/nfs/dbraw/zinc/87/33/27/453873327.db2.gz	AMCADATYDIEAMP-HXUWFJFHSA-N	0	3	333.435	3.125	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(F)c(Cl)c2F)CC1	ZINC000184504459	455392576	/nfs/dbraw/zinc/39/25/76/455392576.db2.gz	QWUMVYQIQHZESF-UHFFFAOYSA-N	0	3	328.790	3.389	20	30		EGEDHN
CN(C(=O)c1cc(C#N)cs1)C1CCN(Cc2ccccc2)CC1	ZINC000084111062	453969733	/nfs/dbraw/zinc/96/97/33/453969733.db2.gz	DJCQXOZOTCIMCN-UHFFFAOYSA-N	0	3	339.464	3.356	20	30		EGEDHN
CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1cccc(CC#N)c1	ZINC000068311313	454015702	/nfs/dbraw/zinc/01/57/02/454015702.db2.gz	ZXFRTISZKTWRGI-UHFFFAOYSA-N	0	3	339.414	3.096	20	30		EGEDHN
O=C(NCC#Cc1ccccc1)C1CCN(Cc2ccccc2)CC1	ZINC000057153462	454106804	/nfs/dbraw/zinc/10/68/04/454106804.db2.gz	TVFSHSVLNOFHNR-UHFFFAOYSA-N	0	3	332.447	3.067	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)C1(C)CCN(Cc2ccccc2)CC1	ZINC000184668130	455423888	/nfs/dbraw/zinc/42/38/88/455423888.db2.gz	WVRWJKJXLRNIJV-KRWDZBQOSA-N	0	3	327.472	3.297	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H]2C[C@H]2c2cccc(F)c2F)CC1	ZINC000119278657	454183353	/nfs/dbraw/zinc/18/33/53/454183353.db2.gz	OSQJLYNKRAMMGT-HOTGVXAUSA-N	0	3	334.410	3.225	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)N1CCCN(C(C)(C)C)CC1	ZINC000058433167	454203952	/nfs/dbraw/zinc/20/39/52/454203952.db2.gz	PCDDICQTCQRFMA-UHFFFAOYSA-N	0	3	344.459	3.295	20	30		EGEDHN
CN(CC#Cc1ccc(OC(F)(F)F)cc1)C[C@@H]1CCCOC1	ZINC000160098528	455428471	/nfs/dbraw/zinc/42/84/71/455428471.db2.gz	FBHKKKUVNRVZEZ-HNNXBMFYSA-N	0	3	327.346	3.295	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)C(=O)N[C@H]1C[C@@H](C)N(C2CC2)C1	ZINC000130563439	454205794	/nfs/dbraw/zinc/20/57/94/454205794.db2.gz	ZEDPBLZKUDJYOA-WBVHZDCISA-N	0	3	343.471	3.018	20	30		EGEDHN
C[C@@H](N[C@@H]1CC(C)(C)OC1(C)C)C(=O)N(C)C1(C#N)CCC(C)CC1	ZINC000119693015	454212683	/nfs/dbraw/zinc/21/26/83/454212683.db2.gz	IUZUCHBEMWILJW-KMFGOTIKSA-N	0	3	349.519	3.241	20	30		EGEDHN
CN(CCC#N)C(=O)CCN1CCC[C@H]1c1nc2ccccc2s1	ZINC000131035169	454232094	/nfs/dbraw/zinc/23/20/94/454232094.db2.gz	GBXOTLAFDYZQDI-HNNXBMFYSA-N	0	3	342.468	3.195	20	30		EGEDHN
CSCC[C@@H](NCCCC(C)(C)C#N)c1nnc2ccccn21	ZINC000119923483	454237325	/nfs/dbraw/zinc/23/73/25/454237325.db2.gz	KIMLNNYSQFJMRR-CQSZACIVSA-N	0	3	331.489	3.443	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H]2CCCOc3ccccc32)CC1	ZINC000071879846	454239649	/nfs/dbraw/zinc/23/96/49/454239649.db2.gz	GQGGFQUTDFZKHX-SFHVURJKSA-N	0	3	343.471	3.240	20	30		EGEDHN
C=CCNC(=O)[C@H](C)N[C@H](C)c1ccc(OCc2cccnc2)cc1	ZINC000120090099	454257361	/nfs/dbraw/zinc/25/73/61/454257361.db2.gz	DDQCMPJXOJZOPC-CVEARBPZSA-N	0	3	339.439	3.002	20	30		EGEDHN
C=C[C@H](CC(=O)N(CCN(C)C)Cc1ccccn1)c1ccccc1	ZINC000131497594	454259284	/nfs/dbraw/zinc/25/92/84/454259284.db2.gz	FTCHHXBXOOWVCZ-GOSISDBHSA-N	0	3	337.467	3.332	20	30		EGEDHN
C[C@@H](NCCC(=O)N(C)CCC#N)c1ccc(Cl)cc1Cl	ZINC000131807857	454288520	/nfs/dbraw/zinc/28/85/20/454288520.db2.gz	JPDKGEJETRKIIS-LLVKDONJSA-N	0	3	328.243	3.406	20	30		EGEDHN
CCn1cc([C@@H](C)N[C@@H]2CCCN(c3ccc(C#N)cc3F)C2)cn1	ZINC000160169725	455434004	/nfs/dbraw/zinc/43/40/04/455434004.db2.gz	UZFHKKQXDGEUBR-RHSMWYFYSA-N	0	3	341.434	3.233	20	30		EGEDHN
C[C@@H]1C[C@@H](N(C)C(=O)C2(C#N)CCC2)CCN1Cc1ccccc1	ZINC000132304005	454328190	/nfs/dbraw/zinc/32/81/90/454328190.db2.gz	OOROTCVQSLKIAV-AEFFLSMTSA-N	0	3	325.456	3.192	20	30		EGEDHN
C[C@H](N[C@H]1CC(C)(C)OC1(C)C)C(=O)N(CCC#N)c1ccccc1	ZINC000132492155	454343417	/nfs/dbraw/zinc/34/34/17/454343417.db2.gz	ZRSGEANPVOLRPU-RDJZCZTQSA-N	0	3	343.471	3.257	20	30		EGEDHN
C[C@@H](CNC(=O)N[C@@H](CCC#N)c1ccccc1)N1CCC[C@H](C)C1	ZINC000132860873	454372056	/nfs/dbraw/zinc/37/20/56/454372056.db2.gz	GUIOGTZJHXKBHU-LNLFQRSKSA-N	0	3	342.487	3.451	20	30		EGEDHN
Cc1cc(Oc2ccc(C#N)cc2)ccc1NC(=O)NCCN(C)C	ZINC000097051496	454398317	/nfs/dbraw/zinc/39/83/17/454398317.db2.gz	UUHOUWMSSMCFHQ-UHFFFAOYSA-N	0	3	338.411	3.342	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N[C@H](C)c1c(C)noc1C)C(C)C	ZINC000073202761	454407202	/nfs/dbraw/zinc/40/72/02/454407202.db2.gz	WYMUASLLKSQYOV-RHSMWYFYSA-N	0	3	348.491	3.350	20	30		EGEDHN
C[C@@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)C1)c1ccc(C#N)cc1	ZINC000047966362	454424429	/nfs/dbraw/zinc/42/44/29/454424429.db2.gz	CLEQSBXTFZSXHT-UZLBHIALSA-N	0	3	348.450	3.193	20	30		EGEDHN
N#CCSc1cccc(C(=O)N2CC[C@H](N3CCCCC3)C2)c1	ZINC000079542506	454434820	/nfs/dbraw/zinc/43/48/20/454434820.db2.gz	DDNXPNMBDFQSBU-INIZCTEOSA-N	0	3	329.469	3.003	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)C1CCCCCC1	ZINC000101814958	454483753	/nfs/dbraw/zinc/48/37/53/454483753.db2.gz	ULUGLQVNEOQVCP-UHFFFAOYSA-N	0	3	327.472	3.419	20	30		EGEDHN
C[C@H]1CCc2c(C(=O)C(C#N)C(=O)Nc3ccccn3)csc2C1	ZINC000102387410	454503123	/nfs/dbraw/zinc/50/31/23/454503123.db2.gz	VCPROIRKSMYFKZ-AAEUAGOBSA-N	0	3	339.420	3.229	20	30		EGEDHN
CC(C(=O)Nc1ccc(OCC(F)(F)C(F)F)nc1)C(F)(F)F	ZINC000080034846	454522764	/nfs/dbraw/zinc/52/27/64/454522764.db2.gz	OAPBGJPGYLNKOP-ZCFIWIBFSA-N	0	3	348.218	3.498	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)/C=C/c2cn(C)c3ccccc23)CC1	ZINC000080079979	454529327	/nfs/dbraw/zinc/52/93/27/454529327.db2.gz	GNJBMBAVJAFOGY-CMDGGOBGSA-N	0	3	337.467	3.348	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCCN2CCN(c3ccccc3)CC2)c1	ZINC000074271936	454554413	/nfs/dbraw/zinc/55/44/13/454554413.db2.gz	YNZJLIWDNHLCAY-UHFFFAOYSA-N	0	3	348.450	3.099	20	30		EGEDHN
Cc1cccc(OCC(=O)C(C#N)C(=O)Nc2ccccc2Cl)c1	ZINC000103504457	454560894	/nfs/dbraw/zinc/56/08/94/454560894.db2.gz	IEOBALJUYYFVLK-CQSZACIVSA-N	0	3	342.782	3.375	20	30		EGEDHN
N#CC(C(=O)C=Cc1ccc(Cl)cc1)C(=O)Nc1ccccn1	ZINC000104055967	454573548	/nfs/dbraw/zinc/57/35/48/454573548.db2.gz	AXRVNIRPJJZWDQ-MRZGDXHCSA-N	0	3	325.755	3.096	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)CCN1CCCSCC#N	ZINC000134646860	454573706	/nfs/dbraw/zinc/57/37/06/454573706.db2.gz	SEDRHOPGNYLGKS-KGLIPLIRSA-N	0	3	327.494	3.011	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN[C@@H](c1ccc(F)cc1)C1CCC1	ZINC000104702979	454596017	/nfs/dbraw/zinc/59/60/17/454596017.db2.gz	ICWFJMKPAUSDTI-IFXJQAMLSA-N	0	3	331.435	3.265	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@@H]2c2ccc(F)cc2)CC1	ZINC000065590290	454597317	/nfs/dbraw/zinc/59/73/17/454597317.db2.gz	FZZYPKQEQJTECR-GOSISDBHSA-N	0	3	331.435	3.323	20	30		EGEDHN
Cc1cc2ncn(C[C@@H](O)CN(C)Cc3ccc(C#N)cc3)c2cc1C	ZINC000051322713	454618604	/nfs/dbraw/zinc/61/86/04/454618604.db2.gz	WACOLGKHYAEFKJ-IBGZPJMESA-N	0	3	348.450	3.018	20	30		EGEDHN
CN(CCC#N)C(=O)CCN1CCc2cc(-c3ccccc3)oc2C1	ZINC000092805295	454636383	/nfs/dbraw/zinc/63/63/83/454636383.db2.gz	BASQJORZLMXQCG-UHFFFAOYSA-N	0	3	337.423	3.067	20	30		EGEDHN
C[C@H](c1ccc(-n2cncn2)cc1)N(C)CCOc1cccc(C#N)c1	ZINC000051855674	454638889	/nfs/dbraw/zinc/63/88/89/454638889.db2.gz	CVAIYINWWFKZJF-MRXNPFEDSA-N	0	3	347.422	3.211	20	30		EGEDHN
N#Cc1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1	ZINC000065965253	454646334	/nfs/dbraw/zinc/64/63/34/454646334.db2.gz	GMUZDKZZJUFQKG-UHFFFAOYSA-N	0	3	325.456	3.219	20	30		EGEDHN
Cc1ccccc1CN1CCC(NC(=O)c2sccc2C#N)CC1	ZINC000052035709	454650496	/nfs/dbraw/zinc/65/04/96/454650496.db2.gz	YICPPXXJYSLPPR-UHFFFAOYSA-N	0	3	339.464	3.323	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(-c3ccc(C)cc3)no2)CC1	ZINC000106036682	454674899	/nfs/dbraw/zinc/67/48/99/454674899.db2.gz	UJFLIZNPHQYWNA-UHFFFAOYSA-N	0	3	339.439	3.420	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCCOCCc2ccccc2)CC1	ZINC000106035825	454675160	/nfs/dbraw/zinc/67/51/60/454675160.db2.gz	GXSWCNGQEFKKRO-UHFFFAOYSA-N	0	3	344.499	3.183	20	30		EGEDHN
N#CCCn1cc(CN2CCC[C@H](CCO)C2)c(-c2ccccc2)n1	ZINC000093105888	454682835	/nfs/dbraw/zinc/68/28/35/454682835.db2.gz	CWUCKPVIMKCOQF-QGZVFWFLSA-N	0	3	338.455	3.058	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](C)CCc2ccc(O)cc2)CC1	ZINC000106257842	454688870	/nfs/dbraw/zinc/68/88/70/454688870.db2.gz	UCNVDHBJRCFBAA-MRXNPFEDSA-N	0	3	345.487	3.053	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)CCOc2cccc(C)c2)CC1	ZINC000106275764	454689562	/nfs/dbraw/zinc/68/95/62/454689562.db2.gz	HKQLTEIZHMPMOB-UHFFFAOYSA-N	0	3	345.487	3.056	20	30		EGEDHN
CN(C)Cc1ccccc1CNC(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1	ZINC000081114463	454689731	/nfs/dbraw/zinc/68/97/31/454689731.db2.gz	MPQIVWAEPUYXRG-VQTJNVASSA-N	0	3	333.435	3.040	20	30		EGEDHN
CC(C)[C@@H](CCO)NCC(=O)Nc1ccccc1S[C@@H](C)CC#N	ZINC000161851784	454728597	/nfs/dbraw/zinc/72/85/97/454728597.db2.gz	BUYUMIROCREHNG-LSDHHAIUSA-N	0	3	349.500	3.016	20	30		EGEDHN
C=CCc1cc(CN2CC[C@@H](Oc3ccncc3)C2)cc(OC)c1O	ZINC000093865891	454741613	/nfs/dbraw/zinc/74/16/13/454741613.db2.gz	UWVSNAGOKJUTTQ-GOSISDBHSA-N	0	3	340.423	3.178	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)c1ccc2[nH]ccc2c1	ZINC000107574698	454763453	/nfs/dbraw/zinc/76/34/53/454763453.db2.gz	LWDLTJDOAWXOSY-UHFFFAOYSA-N	0	3	346.434	3.244	20	30		EGEDHN
N#Cc1ccc(CNCc2ccc(CN3CCCC3=O)cc2)s1	ZINC000176952990	454803272	/nfs/dbraw/zinc/80/32/72/454803272.db2.gz	KXBBJSJIXDYAMJ-UHFFFAOYSA-N	0	3	325.437	3.032	20	30		EGEDHN
CCN(Cc1cc(=O)n2cccc(C)c2n1)[C@H](C)c1ccc(C#N)cc1	ZINC000125769050	454844968	/nfs/dbraw/zinc/84/49/68/454844968.db2.gz	SCNKKWWADIBXDC-MRXNPFEDSA-N	0	3	346.434	3.458	20	30		EGEDHN
C[C@@H](C(=O)N1CCC(C#N)CC1)N1CCC(Cc2ccccc2)CC1	ZINC000110673062	454851359	/nfs/dbraw/zinc/85/13/59/454851359.db2.gz	HFEVUCPOZPPRLT-KRWDZBQOSA-N	0	3	339.483	3.092	20	30		EGEDHN
C[C@H](C(=O)N(C)C1(C#N)CCC1)N1CCC(Cc2ccccc2)CC1	ZINC000110660780	454851415	/nfs/dbraw/zinc/85/14/15/454851415.db2.gz	GJNYRIOQUMPRSD-QGZVFWFLSA-N	0	3	339.483	3.234	20	30		EGEDHN
C=C(Cl)COc1ccc([C@H](C)N[C@@H]2CCN(C(=O)CC)C2)cc1	ZINC000126730132	454914852	/nfs/dbraw/zinc/91/48/52/454914852.db2.gz	UBXUNAMCQJQHGY-GOEBONIOSA-N	0	3	336.863	3.479	20	30		EGEDHN
C#CCCOc1ccc(CN[C@@H](C)c2ccc(NC(N)=O)cc2)cc1	ZINC000113351762	454923879	/nfs/dbraw/zinc/92/38/79/454923879.db2.gz	YCUGKHFWZFLIPD-HNNXBMFYSA-N	0	3	337.423	3.430	20	30		EGEDHN
C[C@H]1CCC[C@@H](C(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)C1	ZINC000151146244	454944207	/nfs/dbraw/zinc/94/42/07/454944207.db2.gz	LGEBIHWJPQFUDY-QFBILLFUSA-N	0	3	327.472	3.275	20	30		EGEDHN
N#Cc1ccc(CNC(=O)NC[C@H]2CCCN2Cc2ccccc2)cc1	ZINC000114784042	454978298	/nfs/dbraw/zinc/97/82/98/454978298.db2.gz	HZZKMNHQWJZVFO-HXUWFJFHSA-N	0	3	348.450	3.022	20	30		EGEDHN
N#Cc1cccc(CNC(=O)NC[C@@H]2CCCN2Cc2ccccc2)c1	ZINC000114785094	454978817	/nfs/dbraw/zinc/97/88/17/454978817.db2.gz	KKGNOWRCESAYDY-FQEVSTJZSA-N	0	3	348.450	3.022	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](c2ncccc2C)C(C)C)CC1	ZINC000115678887	455025386	/nfs/dbraw/zinc/02/53/86/455025386.db2.gz	TYTSAGSUTXAFJG-GOSISDBHSA-N	0	3	344.503	3.427	20	30		EGEDHN
C[C@H](c1ccccc1)N1CCC(NC(=O)C2(C#N)CCCC2)CC1	ZINC000116065781	455040880	/nfs/dbraw/zinc/04/08/80/455040880.db2.gz	GWJCEJAFVPZJAQ-MRXNPFEDSA-N	0	3	325.456	3.412	20	30		EGEDHN
Cc1cccc(S(=O)(=O)CCCN[C@@H](C)c2ccc(C#N)cc2)c1	ZINC000155796553	455046444	/nfs/dbraw/zinc/04/64/44/455046444.db2.gz	MIRGPIPIQHGHLO-INIZCTEOSA-N	0	3	342.464	3.381	20	30		EGEDHN
N#CCCCCNC(=O)Nc1ccc(CCN2CCSCC2)cc1	ZINC000171383255	455066657	/nfs/dbraw/zinc/06/66/57/455066657.db2.gz	RDNNWPCAUFJBBY-UHFFFAOYSA-N	0	3	346.500	3.093	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)NCCCCC#N)N2CCCC2)cc1	ZINC000171435453	455069529	/nfs/dbraw/zinc/06/95/29/455069529.db2.gz	IUCAPCWHRFMXNK-SFHVURJKSA-N	0	3	328.460	3.125	20	30		EGEDHN
CCC1(CC)[C@@H](N[C@@H](C)C(=O)Nc2ccccc2C#N)[C@H](C)[C@@H]1OC	ZINC000179794399	455080012	/nfs/dbraw/zinc/08/00/12/455080012.db2.gz	IWGZCTNEZVNCDP-USJZOSNVSA-N	0	3	343.471	3.315	20	30		EGEDHN
C[C@H](N[C@@H]1CC(=O)N(c2c(F)cccc2F)C1)c1ccc(C#N)cc1	ZINC000179798558	455080056	/nfs/dbraw/zinc/08/00/56/455080056.db2.gz	DEQDORFHVQRYOU-SWLSCSKDSA-N	0	3	341.361	3.293	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)c2ccccc2CC#N)N(C)C)cc1	ZINC000600966352	460660655	/nfs/dbraw/zinc/66/06/55/460660655.db2.gz	MYWKQXXOIYZIAF-FQEVSTJZSA-N	0	3	335.451	3.348	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H](c3nc(C4CC4)n[nH]3)C2)c(F)c1	ZINC000152240337	455091761	/nfs/dbraw/zinc/09/17/61/455091761.db2.gz	KGSWNJSCHRLKPQ-HNNXBMFYSA-N	0	3	325.391	3.072	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H](c3n[nH]c(C4CC4)n3)C2)c(F)c1	ZINC000152240337	455091764	/nfs/dbraw/zinc/09/17/64/455091764.db2.gz	KGSWNJSCHRLKPQ-HNNXBMFYSA-N	0	3	325.391	3.072	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2C[C@@H](c3ccccc3)C[C@@H]2C)CC1	ZINC000172150886	455128942	/nfs/dbraw/zinc/12/89/42/455128942.db2.gz	YGLBZVWQVVFEMV-WMZOPIPTSA-N	0	3	327.472	3.224	20	30		EGEDHN
C[C@@H]1C[C@@H](N(C)C(=O)NCCCCC#N)CCN1Cc1ccccc1	ZINC000172582850	455162759	/nfs/dbraw/zinc/16/27/59/455162759.db2.gz	WARYDSSVAAGEGZ-MJGOQNOKSA-N	0	3	342.487	3.375	20	30		EGEDHN
C[C@@H](NCc1ccc(OCC#N)cc1)c1ccc([S@@](C)=O)cc1	ZINC000180558445	455196498	/nfs/dbraw/zinc/19/64/98/455196498.db2.gz	OAFYJJNIEBSRCT-QKFKETGDSA-N	0	3	328.437	3.177	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)N1CC[C@@H](N2CCCCC2)C1	ZINC000264428461	455211582	/nfs/dbraw/zinc/21/15/82/455211582.db2.gz	AVVUJKPWOYYBNR-MRXNPFEDSA-N	0	3	342.443	3.049	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@@H](C)N[C@H](CC)c1ccc2c(c1)OCCO2	ZINC000180642703	455215873	/nfs/dbraw/zinc/21/58/73/455215873.db2.gz	UIPXQZTXZXUBIY-NVXWUHKLSA-N	0	3	346.471	3.312	20	30		EGEDHN
Cc1cccc([C@@H](C)N[C@H]2CCN(Cc3ccc(C#N)cc3)C2=O)c1	ZINC000190616747	455354037	/nfs/dbraw/zinc/35/40/37/455354037.db2.gz	KNHHVTJHJCNLFZ-UZLBHIALSA-N	0	3	333.435	3.318	20	30		EGEDHN
COc1cccc2c1OC[C@@H](N[C@@H](C)c1ccc(OCC#N)cc1)C2	ZINC000181679789	455370519	/nfs/dbraw/zinc/37/05/19/455370519.db2.gz	NLKNSXWPDGBODQ-YOEHRIQHSA-N	0	3	338.407	3.252	20	30		EGEDHN
C[C@H](N[C@@H]1C[C@@H](C)N(c2ccccc2)C1=O)c1ccc(OCC#N)cc1	ZINC000181995656	455412427	/nfs/dbraw/zinc/41/24/27/455412427.db2.gz	ZPAQWQFQIDHZHR-GQIGUUNPSA-N	0	3	349.434	3.434	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N[C@@H]1[C@H]2CCO[C@H]2C1(C)C	ZINC000265970597	455417078	/nfs/dbraw/zinc/41/70/78/455417078.db2.gz	KRJVWRCGWRTBON-RKTXRCNFSA-N	0	3	348.512	3.054	20	30		EGEDHN
CC1(C(=O)N2CCC(C#N)CC2)CCN(Cc2ccccc2)CC1	ZINC000184717847	455436604	/nfs/dbraw/zinc/43/66/04/455436604.db2.gz	GELWOKLDAJPQNB-UHFFFAOYSA-N	0	3	325.456	3.051	20	30		EGEDHN
COCCC1(CN[C@@H](C)C(=O)Nc2ccccc2C#N)CCCCC1	ZINC000184730446	455438130	/nfs/dbraw/zinc/43/81/30/455438130.db2.gz	NXMKGDFFMYXNQQ-INIZCTEOSA-N	0	3	343.471	3.462	20	30		EGEDHN
C=CCOc1c(Br)cc(CNC[C@@H](C)OC)cc1OC	ZINC000191144876	455452790	/nfs/dbraw/zinc/45/27/90/455452790.db2.gz	DWNRMHVNQBPMIT-LLVKDONJSA-N	0	3	344.249	3.147	20	30		EGEDHN
Cc1cscc1C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000175584747	455468030	/nfs/dbraw/zinc/46/80/30/455468030.db2.gz	XLZYATYGGOTJKH-UHFFFAOYSA-N	0	3	327.453	3.132	20	30		EGEDHN
CC[C@@H](NCC(=O)N(CCC#N)c1cccc(Cl)c1)[C@H]1CCCO1	ZINC000182325825	455488666	/nfs/dbraw/zinc/48/86/66/455488666.db2.gz	MSDOYAONBWRXBV-IAGOWNOFSA-N	0	3	349.862	3.134	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N1CC[C@H]2OCCC[C@H]2C1	ZINC000246788145	455524444	/nfs/dbraw/zinc/52/44/44/455524444.db2.gz	RDOXCRVYFDIKNG-XYJFISCASA-N	0	3	348.512	3.152	20	30		EGEDHN
CC#CCCCC(=O)Nc1ccc(CCN2CCSCC2)cc1	ZINC000185374151	455550727	/nfs/dbraw/zinc/55/07/27/455550727.db2.gz	PHNSCKFEHLTVAG-UHFFFAOYSA-N	0	3	330.497	3.410	20	30		EGEDHN
Cc1cc(C)cc(CN[C@H]2CCN(Cc3ccc(C#N)cc3)C2=O)c1	ZINC000192243197	455580233	/nfs/dbraw/zinc/58/02/33/455580233.db2.gz	RHNULVLPDXWXJT-FQEVSTJZSA-N	0	3	333.435	3.066	20	30		EGEDHN
C=CCN(C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C)C1CC1	ZINC000271354739	455608838	/nfs/dbraw/zinc/60/88/38/455608838.db2.gz	DUYOFXAWHCAFQE-APWZRJJASA-N	0	3	327.472	3.257	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1sccc1CN(C)C)C(C)C	ZINC000268202408	455618023	/nfs/dbraw/zinc/61/80/23/455618023.db2.gz	YYRUVQXIABWAAW-QGZVFWFLSA-N	0	3	349.544	3.238	20	30		EGEDHN
C=CCC(CC=C)C(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000268215294	455621203	/nfs/dbraw/zinc/62/12/03/455621203.db2.gz	RKAWBLLDULHYDB-UHFFFAOYSA-N	0	3	325.456	3.217	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1	ZINC000185789425	455622699	/nfs/dbraw/zinc/62/26/99/455622699.db2.gz	YTCQFXHLXZYVJG-BZSNNMDCSA-N	0	3	336.520	3.327	20	30		EGEDHN
N#C[C@@H]1CCC[C@H](NCc2ccc(C(=O)N3CCCCC3)cc2)C1	ZINC000185801393	455623947	/nfs/dbraw/zinc/62/39/47/455623947.db2.gz	XBUAKFBUDBHUHO-MJGOQNOKSA-N	0	3	325.456	3.485	20	30		EGEDHN
C=C(C)[C@@H](NC(=O)N(C)CCN(C)C1CC1)c1ccc(F)c(F)c1	ZINC000185842548	455633898	/nfs/dbraw/zinc/63/38/98/455633898.db2.gz	GLOVXESPSKUFIV-QGZVFWFLSA-N	0	3	337.414	3.318	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)[C@@H]1CCCc2cccnc21)C(C)C	ZINC000192554778	455641195	/nfs/dbraw/zinc/64/11/95/455641195.db2.gz	FQPKLQZVFVRYFD-MOPGFXCFSA-N	0	3	341.499	3.316	20	30		EGEDHN
N#Cc1ccc(OCCN2CCC[C@H]2C[C@H](O)c2ccco2)cc1	ZINC000268292130	455642400	/nfs/dbraw/zinc/64/24/00/455642400.db2.gz	RYOIKJCBPOGMAA-WMZOPIPTSA-N	0	3	326.396	3.118	20	30		EGEDHN
C#CC[C@H](N[C@@H](C)Cn1cc(Br)cn1)c1ccccc1	ZINC000271579716	455691684	/nfs/dbraw/zinc/69/16/84/455691684.db2.gz	WUXUDWGSHWKFRJ-BBRMVZONSA-N	0	3	332.245	3.388	20	30		EGEDHN
C#CC[C@@H](N[C@@H](C)Cn1cc(Br)cn1)c1ccccc1	ZINC000271579727	455691919	/nfs/dbraw/zinc/69/19/19/455691919.db2.gz	WUXUDWGSHWKFRJ-XJKSGUPXSA-N	0	3	332.245	3.388	20	30		EGEDHN
CN1CC[C@]2(CCN(C(=O)c3ccccc3-c3ccccc3C#N)C2)C1	ZINC000292544753	455692586	/nfs/dbraw/zinc/69/25/86/455692586.db2.gz	LUYWMVBGHCKDSS-QFIPXVFZSA-N	0	3	345.446	3.393	20	30		EGEDHN
C#CCCCCC(=O)N(Cc1ccc(O)cc1)C[C@H]1CCCN1CC	ZINC000271610789	455700305	/nfs/dbraw/zinc/70/03/05/455700305.db2.gz	VHCXWYNOGYVWMJ-LJQANCHMSA-N	0	3	342.483	3.399	20	30		EGEDHN
C=CCSCCN[C@@H](c1ccc(Cl)cc1)[C@@H]1CN(C)CCO1	ZINC000248699261	455726775	/nfs/dbraw/zinc/72/67/75/455726775.db2.gz	FQQLHFMIMJNJKX-IRXDYDNUSA-N	0	3	340.920	3.221	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1cccc(CC#N)c1	ZINC000248803786	455731623	/nfs/dbraw/zinc/73/16/23/455731623.db2.gz	JXUJLFDZNSBIJH-OXJNMPFZSA-N	0	3	333.435	3.003	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC[C@H](OCC)c2ccccc2)CC1	ZINC000193603335	455767134	/nfs/dbraw/zinc/76/71/34/455767134.db2.gz	PJTADFBJHVHMII-IBGZPJMESA-N	0	3	345.487	3.104	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN(Cc1ccccc1)[C@H](C)C1CC1	ZINC000249708335	455768846	/nfs/dbraw/zinc/76/88/46/455768846.db2.gz	BVONDDCSZAWGRY-DLBZAZTESA-N	0	3	327.472	3.295	20	30		EGEDHN
C=C(C)COc1cc(CNCCc2nccnc2C)ccc1OC	ZINC000293059117	455773825	/nfs/dbraw/zinc/77/38/25/455773825.db2.gz	SEBSHPMSTQQADS-UHFFFAOYSA-N	0	3	327.428	3.081	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCC[C@]2(CCC)COC)CC1	ZINC000193749909	455774313	/nfs/dbraw/zinc/77/43/13/455774313.db2.gz	XUXGVJBDCMHOAX-LJQANCHMSA-N	0	3	337.508	3.018	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](NCc3ccccc3C3CC3)C2=O)cc1	ZINC000616996490	460694292	/nfs/dbraw/zinc/69/42/92/460694292.db2.gz	VGEMKVYYIXJJGF-NRFANRHFSA-N	0	3	345.446	3.326	20	30		EGEDHN
C=CCN1CCC(NC(=O)Cc2cccc(Cl)c2Cl)CC1	ZINC000194052302	455796244	/nfs/dbraw/zinc/79/62/44/455796244.db2.gz	AFARNYNEFJUXRP-UHFFFAOYSA-N	0	3	327.255	3.303	20	30		EGEDHN
N#Cc1ccc(NC(=O)N2CC[C@@H](N3CCCCC3)C2)c(Cl)c1	ZINC000269158565	455800286	/nfs/dbraw/zinc/80/02/86/455800286.db2.gz	SWGUZQQUCZPJCT-CQSZACIVSA-N	0	3	332.835	3.304	20	30		EGEDHN
C=CCOCCN1CCC(C(=O)Nc2ccc(F)c(Cl)c2)CC1	ZINC000293922568	455801537	/nfs/dbraw/zinc/80/15/37/455801537.db2.gz	YCTAEZBYLWJGOJ-UHFFFAOYSA-N	0	3	340.826	3.332	20	30		EGEDHN
CC[C@H](NCc1ccc(CS(C)(=O)=O)cc1)c1ccc(C#N)cc1	ZINC000278314994	455814692	/nfs/dbraw/zinc/81/46/92/455814692.db2.gz	UIIFXUATDPPWLB-IBGZPJMESA-N	0	3	342.464	3.344	20	30		EGEDHN
CN(C)CCOc1ccc(NC(=O)[C@]2(C#N)CC23CCCC3)cc1	ZINC000294525260	455817981	/nfs/dbraw/zinc/81/79/81/455817981.db2.gz	QQALFXWZYPWABN-LJQANCHMSA-N	0	3	327.428	3.040	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)[C@H]1CCCCC1(F)F	ZINC000294856307	455830271	/nfs/dbraw/zinc/83/02/71/455830271.db2.gz	ZTDVKMSKNOZIKJ-QGZVFWFLSA-N	0	3	349.425	3.274	20	30		EGEDHN
CC1(C)[C@H](NCc2cc(C#N)ccc2Br)[C@@H]2CCO[C@@H]21	ZINC000295092036	455838498	/nfs/dbraw/zinc/83/84/98/455838498.db2.gz	ADCJFNTWNLKBTQ-CFVMTHIKSA-N	0	3	335.245	3.224	20	30		EGEDHN
CN(CCC1CCN(c2ccncc2)CC1)C(=O)CC(C)(C)C#N	ZINC000278732046	455845223	/nfs/dbraw/zinc/84/52/23/455845223.db2.gz	KZKHRYOAAXSADB-UHFFFAOYSA-N	0	3	328.460	3.086	20	30		EGEDHN
N#CCCn1cc(CNCCOc2ccccc2)c(-c2ccncc2)n1	ZINC000278719776	455846092	/nfs/dbraw/zinc/84/60/92/455846092.db2.gz	SSHVHBPQHUTXDN-UHFFFAOYSA-N	0	3	347.422	3.027	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCc3c(C)cc(C)cc3C2)CC1	ZINC000186905772	455848925	/nfs/dbraw/zinc/84/89/25/455848925.db2.gz	GIXBHIIKELCENC-UHFFFAOYSA-N	0	3	327.472	3.022	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN[C@@H](CC)c1ccc(OC)c(OC)c1	ZINC000285452977	455849367	/nfs/dbraw/zinc/84/93/67/455849367.db2.gz	MIPUVLOPTMCPGY-INIZCTEOSA-N	0	3	334.460	3.169	20	30		EGEDHN
N#CCc1ccc(OC[C@@H](O)CN2CC(C3CCCCC3)C2)cc1	ZINC000295815828	455860637	/nfs/dbraw/zinc/86/06/37/455860637.db2.gz	BVOILVCSLKOPDB-IBGZPJMESA-N	0	3	328.456	3.004	20	30		EGEDHN
CC[C@@H](C)N1CCN(CC#Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000295921068	455863161	/nfs/dbraw/zinc/86/31/61/455863161.db2.gz	FITJYXPZTLZEPL-OAHLLOKOSA-N	0	3	340.389	3.353	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(CC(=C)C)Cc2ccccc2)CC1	ZINC000279652519	455869714	/nfs/dbraw/zinc/86/97/14/455869714.db2.gz	XQNFFJQOLMVWLO-UHFFFAOYSA-N	0	3	327.472	3.425	20	30		EGEDHN
CCC[C@]1(NCc2ccc(OC)c(OCCCC#N)c2)CCOC1	ZINC000285569867	455872804	/nfs/dbraw/zinc/87/28/04/455872804.db2.gz	SHPOQBMGPYHPLD-IBGZPJMESA-N	0	3	332.444	3.427	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CN[C@@H](c1ncc[nH]1)c1cccnc1)C(C)C	ZINC000279985123	455879316	/nfs/dbraw/zinc/87/93/16/455879316.db2.gz	DVXJASIFYDAOLH-RBUKOAKNSA-N	0	3	339.487	3.182	20	30		EGEDHN
CC1(C)[C@H](NCc2ccc(C#N)cc2Br)[C@H]2CCO[C@H]21	ZINC000296215081	455882687	/nfs/dbraw/zinc/88/26/87/455882687.db2.gz	MPIHCKQAJORQBE-BPLDGKMQSA-N	0	3	335.245	3.224	20	30		EGEDHN
N#Cc1ccc(Br)c(CN[C@@H]2[C@@H]3CCO[C@H]3C23CCC3)c1	ZINC000296221321	455883842	/nfs/dbraw/zinc/88/38/42/455883842.db2.gz	WXDPQQKKJFRZBK-NUEKZKHPSA-N	0	3	347.256	3.368	20	30		EGEDHN
CN1CC[C@H]2CCN(C(=O)Nc3ccc(C(C)(C)C#N)cc3)[C@H]2C1	ZINC000272270785	455897395	/nfs/dbraw/zinc/89/73/95/455897395.db2.gz	LLBKICZOYIYLOG-YOEHRIQHSA-N	0	3	326.444	3.046	20	30		EGEDHN
CCOC[C@H](N[C@H](C)C(=O)N(CCC#N)c1ccc(C)cc1)C(C)C	ZINC000285703636	455900871	/nfs/dbraw/zinc/90/08/71/455900871.db2.gz	CVQDZCPOEACMHE-MJGOQNOKSA-N	0	3	345.487	3.281	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H](CNC(=O)c1cccc(CC#N)c1)C1CC1	ZINC000187460652	455913409	/nfs/dbraw/zinc/91/34/09/455913409.db2.gz	SDEDDWUIIPTNDL-NRFANRHFSA-N	0	3	347.462	3.393	20	30		EGEDHN
C[C@@H](c1ccc(OCC#N)cc1)N1CCC[C@@H](CC(C)(C)C(N)=O)C1	ZINC000296393559	455926274	/nfs/dbraw/zinc/92/62/74/455926274.db2.gz	KEXPFFOWHGAHJT-HOTGVXAUSA-N	0	3	343.471	3.264	20	30		EGEDHN
CN(CCC#N)C(=O)CCN1CC=C(c2cccc(Cl)c2)CC1	ZINC000280297247	455940285	/nfs/dbraw/zinc/94/02/85/455940285.db2.gz	VDORCLABIVSZJN-UHFFFAOYSA-N	0	3	331.847	3.191	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2ccc(CC#N)cc2)CN1Cc1ccccc1	ZINC000270382686	455943608	/nfs/dbraw/zinc/94/36/08/455943608.db2.gz	QCQNQCAIZNGZGV-UZLBHIALSA-N	0	3	333.435	3.145	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1CNCc1c(C)nn(-c2ccccn2)c1Cl	ZINC000285932093	455944392	/nfs/dbraw/zinc/94/43/92/455944392.db2.gz	LUHARMLSYPNHRZ-YOEHRIQHSA-N	0	3	346.862	3.300	20	30		EGEDHN
C=CCN(CCc1ccco1)C(=O)NCc1cccc(CN(C)C)c1	ZINC000272491459	455969477	/nfs/dbraw/zinc/96/94/77/455969477.db2.gz	TVXCEHPZXLQJTF-UHFFFAOYSA-N	0	3	341.455	3.282	20	30		EGEDHN
CC(C)(CNC(=O)C(C#N)Cc1ccc(C#N)cc1)c1cccs1	ZINC000280451643	455974538	/nfs/dbraw/zinc/97/45/38/455974538.db2.gz	NRSDELVWCMDGOU-MRXNPFEDSA-N	0	3	337.448	3.396	20	30		EGEDHN
CN(C(=O)C(C#N)Cc1ccc(C#N)cc1)[C@@H]1CCc2ccccc2C1	ZINC000280482815	455979985	/nfs/dbraw/zinc/97/99/85/455979985.db2.gz	PRRGSPBFXKEBSP-LEWJYISDSA-N	0	3	343.430	3.256	20	30		EGEDHN
Cc1nsc(NC2CCN(CCc3ccccc3)CC2)c1C#N	ZINC000286143096	455987386	/nfs/dbraw/zinc/98/73/86/455987386.db2.gz	NOIBYKJMHQDWQE-UHFFFAOYSA-N	0	3	326.469	3.442	20	30		EGEDHN
CC(C)[C@H](NCC(=O)NC1(C#N)CCCCC1)c1ccc(F)cc1	ZINC000198437758	456007305	/nfs/dbraw/zinc/00/73/05/456007305.db2.gz	SNPZEZKDVPZPTL-SFHVURJKSA-N	0	3	331.435	3.455	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000188215357	456022272	/nfs/dbraw/zinc/02/22/72/456022272.db2.gz	MJICULJIBWMTGW-OAQYLSRUSA-N	0	3	344.499	3.039	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)C1=CCN(C)CC1	ZINC000272653848	456027398	/nfs/dbraw/zinc/02/73/98/456027398.db2.gz	AYRNIYRKUNZCOG-MRXNPFEDSA-N	0	3	340.471	3.130	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)NCC1CCN(Cc2cccs2)CC1	ZINC000280691660	456031696	/nfs/dbraw/zinc/03/16/96/456031696.db2.gz	FUEYJTOLOBMNMS-UHFFFAOYSA-N	0	3	343.452	3.163	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000280736155	456041226	/nfs/dbraw/zinc/04/12/26/456041226.db2.gz	WJMPYXXSCNJTBF-AUUYWEPGSA-N	0	3	337.423	3.100	20	30		EGEDHN
CC[C@](C)(C#N)C(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000286507664	456048437	/nfs/dbraw/zinc/04/84/37/456048437.db2.gz	QBTPDARSFKKBDZ-XKGZKEIXSA-N	0	3	327.472	3.438	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)NC[C@@H]1CCCN(Cc2cccs2)C1	ZINC000280800367	456054382	/nfs/dbraw/zinc/05/43/82/456054382.db2.gz	RTQLXHZBXDZASR-AWEZNQCLSA-N	0	3	343.452	3.163	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000286910362	456056907	/nfs/dbraw/zinc/05/69/07/456056907.db2.gz	UHRCXJCBWOUOIG-IBGZPJMESA-N	0	3	330.472	3.386	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1CNCc1c(Cl)n(C)nc1C(F)(F)F	ZINC000280839839	456063875	/nfs/dbraw/zinc/06/38/75/456063875.db2.gz	YBWLKXJTOMRLPC-ONGXEEELSA-N	0	3	337.773	3.163	20	30		EGEDHN
CN(C)CCN(Cc1cccs1)C(=O)c1cc(C#N)ccc1Cl	ZINC000287410469	456069268	/nfs/dbraw/zinc/06/92/68/456069268.db2.gz	JOERRBFJRTUFTJ-UHFFFAOYSA-N	0	3	347.871	3.477	20	30		EGEDHN
C#Cc1ccc(CN[C@H](C)c2ccc(OCC(=O)NC3CC3)cc2)cc1	ZINC000289044809	456112953	/nfs/dbraw/zinc/11/29/53/456112953.db2.gz	AZDKECLUHYMCLN-MRXNPFEDSA-N	0	3	348.446	3.176	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N(C)C1CCN(Cc2ccccc2)CC1	ZINC000188793963	456140055	/nfs/dbraw/zinc/14/00/55/456140055.db2.gz	QCMRRFPDFYCFEB-NRFANRHFSA-N	0	3	344.499	3.338	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)C(=O)N[C@H](C)C1=CCN(C)CC1	ZINC000273042998	456156905	/nfs/dbraw/zinc/15/69/05/456156905.db2.gz	WKIKMYFVYQVPTJ-MRXNPFEDSA-N	0	3	343.471	3.043	20	30		EGEDHN
C[C@@H](C1CCN(C)CC1)N(C)C(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000281219176	456168630	/nfs/dbraw/zinc/16/86/30/456168630.db2.gz	OGMMUGARASQZQX-HNNXBMFYSA-N	0	3	327.472	3.290	20	30		EGEDHN
COc1ccc(CN2CCC3(C2)CCOCC3)cc1OCCCC#N	ZINC000271226812	456181692	/nfs/dbraw/zinc/18/16/92/456181692.db2.gz	RPRCOOIIOXZWOE-UHFFFAOYSA-N	0	3	344.455	3.380	20	30		EGEDHN
Cc1nnc(N2CCCN(CCCc3ccccc3)CC2)c(C#N)c1C	ZINC000263735071	456206133	/nfs/dbraw/zinc/20/61/33/456206133.db2.gz	QQNGHONSKWMTDN-UHFFFAOYSA-N	0	3	349.482	3.110	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@@H]1CNC(=O)c1ccc(CN2CCCCC2)cc1	ZINC000281447407	456238063	/nfs/dbraw/zinc/23/80/63/456238063.db2.gz	OJWASKJFLJGSGU-WOJBJXKFSA-N	0	3	342.483	3.384	20	30		EGEDHN
CN(C)CCOc1cccc(-c2noc(C3(C#N)CCCCC3)n2)c1	ZINC000273771837	456244354	/nfs/dbraw/zinc/24/43/54/456244354.db2.gz	DUYSIRWFIZBCAJ-UHFFFAOYSA-N	0	3	340.427	3.402	20	30		EGEDHN
CCN1CCN(c2cccc(NC(=O)c3ccc(CC#N)cc3)c2)CC1	ZINC000274450915	456259101	/nfs/dbraw/zinc/25/91/01/456259101.db2.gz	HDIQWYWODULBNT-UHFFFAOYSA-N	0	3	348.450	3.147	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000274541643	456261374	/nfs/dbraw/zinc/26/13/74/456261374.db2.gz	BVBHHBGBGIGUKM-MRXNPFEDSA-N	0	3	348.462	3.387	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H](CN1CCCC1)c1ccc(OC)cc1	ZINC000274588186	456261868	/nfs/dbraw/zinc/26/18/68/456261868.db2.gz	ZWHVGZOMYCNNEA-IBGZPJMESA-N	0	3	328.456	3.142	20	30		EGEDHN
CCC[C@@]1(CO)CCN(Cc2ccc(OC)c(OCCCC#N)c2)C1	ZINC000290222463	456269941	/nfs/dbraw/zinc/26/99/41/456269941.db2.gz	RUCFXRFNSGDZMQ-HXUWFJFHSA-N	0	3	346.471	3.362	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@H]1CCCC[C@@H]1OC	ZINC000275286001	456272145	/nfs/dbraw/zinc/27/21/45/456272145.db2.gz	WXXPWAWIKRPJOR-HOCLYGCPSA-N	0	3	334.485	3.450	20	30		EGEDHN
C=CCOc1cccc(CN2CCC[C@@H]2CN2C[C@@H](C)O[C@@H](C)C2)c1	ZINC000352766171	456287025	/nfs/dbraw/zinc/28/70/25/456287025.db2.gz	UZKHOUQSPNCPMZ-WSTZPKSXSA-N	0	3	344.499	3.325	20	30		EGEDHN
N#Cc1cccc(OCCCN2CCCC[C@H]2[C@@H](O)C(F)(F)F)c1	ZINC000340192833	456304444	/nfs/dbraw/zinc/30/44/44/456304444.db2.gz	PYLMLAJDTOQMGM-JKSUJKDBSA-N	0	3	342.361	3.105	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN1[C@@H](C)CN(CC)C[C@@H]1C	ZINC000347690179	456307847	/nfs/dbraw/zinc/30/78/47/456307847.db2.gz	MSPAUKWUYPHBDO-HOTGVXAUSA-N	0	3	347.528	3.318	20	30		EGEDHN
CC(C)c1csc(CNC(=O)C(C#N)Cc2ccc(C#N)cc2)n1	ZINC000281760774	456312613	/nfs/dbraw/zinc/31/26/13/456312613.db2.gz	YVIDPSZEFHQVKA-OAHLLOKOSA-N	0	3	338.436	3.137	20	30		EGEDHN
COc1cc(CNC[C@H](O)c2ccc(OC(C)C)cc2)ccc1C#N	ZINC000281770093	456315905	/nfs/dbraw/zinc/31/59/05/456315905.db2.gz	SGQFPVDNKCMAIC-IBGZPJMESA-N	0	3	340.423	3.177	20	30		EGEDHN
COc1cc(CNC[C@@H](c2c(F)cccc2F)N(C)C)ccc1C#N	ZINC000281784075	456318068	/nfs/dbraw/zinc/31/80/68/456318068.db2.gz	UACKQFXZLZJXEG-KRWDZBQOSA-N	0	3	345.393	3.238	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)s1)[C@H](c1ccccc1)N1CCOCC1	ZINC000342947663	456332639	/nfs/dbraw/zinc/33/26/39/456332639.db2.gz	SYXYSPVZRIWQGU-HNAYVOBHSA-N	0	3	341.480	3.171	20	30		EGEDHN
COc1ccc([C@H](N[C@@H](C)C(=O)N[C@@](C)(C#N)C(C)C)C2CC2)cc1	ZINC000343007988	456352168	/nfs/dbraw/zinc/35/21/68/456352168.db2.gz	LFYQLUWXBJCUTN-QMIHWGKISA-N	0	3	343.471	3.179	20	30		EGEDHN
COC[C@]1(CNCc2ccc(C#N)c(C)c2)OCCc2ccccc21	ZINC000352862167	456371404	/nfs/dbraw/zinc/37/14/04/456371404.db2.gz	MOJUWUFQMQCDTP-NRFANRHFSA-N	0	3	336.435	3.071	20	30		EGEDHN
N#Cc1c(NC[C@@H]2CCCCN2C2CC2)nc2cc(Cl)ccn21	ZINC000343108874	456412374	/nfs/dbraw/zinc/41/23/74/456412374.db2.gz	SHIIBBFQGAFQCB-AWEZNQCLSA-N	0	3	329.835	3.288	20	30		EGEDHN
C=CCOCCCN1CCCN(C(=O)c2cccc(Cl)c2)CC1	ZINC000347968353	456432382	/nfs/dbraw/zinc/43/23/82/456432382.db2.gz	QWOWOCNRRDTBDZ-UHFFFAOYSA-N	0	3	336.863	3.081	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)[C@@H]1CCCC(F)(F)C1	ZINC000282230904	456450682	/nfs/dbraw/zinc/45/06/82/456450682.db2.gz	RXSDENMODMUYBQ-QGZVFWFLSA-N	0	3	349.425	3.274	20	30		EGEDHN
CN(CCC(=O)Nc1cccc(C#N)c1)C[C@@H]1OCCc2ccccc21	ZINC000337643594	456451226	/nfs/dbraw/zinc/45/12/26/456451226.db2.gz	HDRJMWOOSQLKDV-FQEVSTJZSA-N	0	3	349.434	3.133	20	30		EGEDHN
CCN1CCN(c2cccc(NCc3ccc(C#N)cc3F)c2)CC1	ZINC000276474248	456493000	/nfs/dbraw/zinc/49/30/00/456493000.db2.gz	ZLVYHUYKMZBMMZ-UHFFFAOYSA-N	0	3	338.430	3.451	20	30		EGEDHN
CN1CC=C(CNC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)CC1	ZINC000343264782	456493814	/nfs/dbraw/zinc/49/38/14/456493814.db2.gz	LTLJMPDLXBNFNB-UHFFFAOYSA-N	0	3	347.418	3.342	20	30		EGEDHN
C=CCCN(C)Cc1cc(=O)oc2cc(NC(=O)OCC)ccc12	ZINC000276486264	456496421	/nfs/dbraw/zinc/49/64/21/456496421.db2.gz	UDKVITXQDMZPQO-UHFFFAOYSA-N	0	3	330.384	3.369	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@H](C)[C@@H]1CCCOC1	ZINC000348142352	456512294	/nfs/dbraw/zinc/51/22/94/456512294.db2.gz	NEOFIMLHLQFTNT-HUUCEWRRSA-N	0	3	334.485	3.308	20	30		EGEDHN
COc1cc(CN2CC[C@H]3[C@H](CCCN3C3CC3)C2)ccc1C#N	ZINC000282518483	456538898	/nfs/dbraw/zinc/53/88/98/456538898.db2.gz	ZLITXYRXSZLPOF-MJGOQNOKSA-N	0	3	325.456	3.016	20	30		EGEDHN
CC(C)N(CCCC1(C#N)CCOCC1)CC(=O)N1CCCCCC1	ZINC000353203968	456556744	/nfs/dbraw/zinc/55/67/44/456556744.db2.gz	MWNZJNZYBFCRRQ-UHFFFAOYSA-N	0	3	349.519	3.200	20	30		EGEDHN
C#CC[C@H](NCCC(=O)Nc1ccc2c(c1)OCO2)c1ccccc1	ZINC000298927267	456570923	/nfs/dbraw/zinc/57/09/23/456570923.db2.gz	NTBCOIWATPTPMW-KRWDZBQOSA-N	0	3	336.391	3.098	20	30		EGEDHN
C=CCn1c(C)nnc1N1CCN(Cc2ccccc2)[C@@H](CCC)C1	ZINC000337851190	456571131	/nfs/dbraw/zinc/57/11/31/456571131.db2.gz	JKNAZIQUCKHQIV-IBGZPJMESA-N	0	3	339.487	3.263	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N1C[C@H]2CCCN2Cc2ccccc21	ZINC000337878283	456582311	/nfs/dbraw/zinc/58/23/11/456582311.db2.gz	RZWHMSCSIFADQQ-GOSISDBHSA-N	0	3	331.419	3.492	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@@H](NCc1cccc(CN3CCCC3=O)c1)CC2	ZINC000353263498	456596435	/nfs/dbraw/zinc/59/64/35/456596435.db2.gz	JRBQASYUIKUBIS-NRFANRHFSA-N	0	3	345.446	3.458	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)CSCc1ccccn1)C(C)C	ZINC000299088641	456602126	/nfs/dbraw/zinc/60/21/26/456602126.db2.gz	GNXBROOCHLVDSX-GOSISDBHSA-N	0	3	347.528	3.130	20	30		EGEDHN
C[C@H](CNCc1cc(C#N)n(C)c1)Oc1ccc(Br)cc1	ZINC000276961190	456632932	/nfs/dbraw/zinc/63/29/32/456632932.db2.gz	MGDIXANNYJORAR-GFCCVEGCSA-N	0	3	348.244	3.216	20	30		EGEDHN
CN(C)CCOc1ccccc1CN[C@H]1CCc2ccc(C#N)cc21	ZINC000353394364	456671923	/nfs/dbraw/zinc/67/19/23/456671923.db2.gz	CAKGAQADUCOYJE-FQEVSTJZSA-N	0	3	335.451	3.276	20	30		EGEDHN
N#CCOc1ccc(CN[C@@H]2CCO[C@H]2c2ccc(F)c(F)c2)cc1	ZINC000277074011	456672475	/nfs/dbraw/zinc/67/24/75/456672475.db2.gz	PFAKGLFPYSDJKP-MOPGFXCFSA-N	0	3	344.361	3.487	20	30		EGEDHN
C[C@H](N[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2)C(=O)NC1(C#N)CCCCC1	ZINC000328683575	456734943	/nfs/dbraw/zinc/73/49/43/456734943.db2.gz	PHRAQZONDYPQQY-JONQDZQNSA-N	0	3	331.460	3.105	20	30		EGEDHN
Cc1nc(NC(=O)[C@H](C)N[C@H]2CCC(=O)NC23CCC3)sc1C	ZINC000328703724	456741280	/nfs/dbraw/zinc/74/12/80/456741280.db2.gz	OIQNBUUMTWVJLC-JQWIXIFHSA-N	0	3	336.461	3.368	20	30		EGEDHN
C=CCSCCNC(=O)NC[C@H](c1ccc(CC)cc1)N(C)C	ZINC000338273182	456743928	/nfs/dbraw/zinc/74/39/28/456743928.db2.gz	CBMDKFXHHXETSO-QGZVFWFLSA-N	0	3	335.517	3.070	20	30		EGEDHN
COc1ccccc1[C@H](C)NC(=O)CN1CC[C@@H](C2CCOCC2)C1	ZINC000328723905	456745550	/nfs/dbraw/zinc/74/55/50/456745550.db2.gz	APSHUJQQPIICMR-DOTOQJQBSA-N	0	3	346.471	3.461	20	30		EGEDHN
CN(C)[C@H](CNC(=O)c1cc(C#N)ccc1Cl)Cc1ccccc1	ZINC000348631162	456786780	/nfs/dbraw/zinc/78/67/80/456786780.db2.gz	YUNFXVCJHFSCBF-INIZCTEOSA-N	0	3	341.842	3.114	20	30		EGEDHN
O=C(CN1CCC[C@@H]1C1CCC1)NC(=O)Nc1ccc2c(c1)OCO2	ZINC000328911634	456789934	/nfs/dbraw/zinc/78/99/34/456789934.db2.gz	GNWFMKIQMJZURA-CQSZACIVSA-N	0	3	345.399	3.182	20	30		EGEDHN
CC(C)c1ccoc1C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000340976007	456793252	/nfs/dbraw/zinc/79/32/52/456793252.db2.gz	RELGEYYSSAZKLB-UHFFFAOYSA-N	0	3	339.439	3.479	20	30		EGEDHN
C[C@@H](NC(=O)C(C#N)CCc1ccccc1)c1c(F)cncc1F	ZINC000344148088	456801546	/nfs/dbraw/zinc/80/15/46/456801546.db2.gz	FEYZGDTZYMBIET-OCCSQVGLSA-N	0	3	329.350	3.310	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H]2CCN(C3CC3)C2)c2c(n1)onc2C(C)C	ZINC000328969145	456802454	/nfs/dbraw/zinc/80/24/54/456802454.db2.gz	APPICQYVTHZXQE-GFCCVEGCSA-N	0	3	328.416	3.196	20	30		EGEDHN
N#Cc1cc2c(nc1NCCCN1CCc3ccccc3C1)CCC2	ZINC000338427344	456812489	/nfs/dbraw/zinc/81/24/89/456812489.db2.gz	WDIAWWUKNNSLEH-UHFFFAOYSA-N	0	3	332.451	3.302	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)c1cc(F)cc([N+](=O)[O-])c1	ZINC000344557098	456837996	/nfs/dbraw/zinc/83/79/96/456837996.db2.gz	VTLHETAHGIQOBL-CYBMUJFWSA-N	0	3	338.298	3.111	20	30		EGEDHN
O=C(CN1CCC[C@H]1C1CCOCC1)NC(=O)NC1CCCCC1	ZINC000329410095	456886780	/nfs/dbraw/zinc/88/67/80/456886780.db2.gz	BKXOYVMZCSAGHH-INIZCTEOSA-N	0	3	337.464	3.081	20	30		EGEDHN
Cc1cc(=O)c(C(=O)NCC(C)(C)N2CCCCC2)cn1C1CC1	ZINC000329493148	456899232	/nfs/dbraw/zinc/89/92/32/456899232.db2.gz	WLCSOFJNIZGDHQ-UHFFFAOYSA-N	0	3	331.460	3.061	20	30		EGEDHN
Cc1nnc([C@@H]2CCCN([C@H](C)C(=O)N[C@@H]3CCC[C@H](C)[C@@H]3C)C2)[nH]1	ZINC000329491991	456899303	/nfs/dbraw/zinc/89/93/03/456899303.db2.gz	VVXXVHHXOXDSSA-AZGDMVHKSA-N	0	3	347.507	3.462	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1csc(C2CC2)n1)C(C)C	ZINC000353809471	456916361	/nfs/dbraw/zinc/91/63/61/456916361.db2.gz	AVMJHMXYRQLXKQ-INIZCTEOSA-N	0	3	333.501	3.449	20	30		EGEDHN
CN1CCC2(CC1)C[C@H](NC(=O)C[C@@H]1CCOC1)c1ccccc1O2	ZINC000329801913	456942928	/nfs/dbraw/zinc/94/29/28/456942928.db2.gz	YXMZDJNJEZVOMN-RDJZCZTQSA-N	0	3	344.455	3.358	20	30		EGEDHN
C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)CCc1nnc(C2CCCC2)o1	ZINC000329930689	456962359	/nfs/dbraw/zinc/96/23/59/456962359.db2.gz	ZUOWXFQKGSMGHW-DOMZBBRYSA-N	0	3	332.448	3.099	20	30		EGEDHN
C[C@H](NC(=O)N[C@H]1CCN(C2CC2)C1)c1cc2cccc(F)c2o1	ZINC000329940798	456963830	/nfs/dbraw/zinc/96/38/30/456963830.db2.gz	URGBDRSOXGXDOO-AAEUAGOBSA-N	0	3	331.391	3.373	20	30		EGEDHN
CC1(C)CCCN(CCNC(=O)c2csc([C@H]3CCCO3)n2)C1	ZINC000329962935	456967222	/nfs/dbraw/zinc/96/72/22/456967222.db2.gz	SJAYXQHANYWSOV-CQSZACIVSA-N	0	3	337.489	3.421	20	30		EGEDHN
COc1ccc(CC[C@@H]2CCCCN2C(=O)C(C)C#N)cc1OC	ZINC000345224210	456971704	/nfs/dbraw/zinc/97/17/04/456971704.db2.gz	CHKNTRYOIDWMDM-ZBFHGGJFSA-N	0	3	330.428	3.177	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)NC[C@H](C)N2CCC(C)CC2)cc1	ZINC000345373084	456977157	/nfs/dbraw/zinc/97/71/57/456977157.db2.gz	BKTCYKJMNBUPGY-KRWDZBQOSA-N	0	3	345.487	3.171	20	30		EGEDHN
C=CC[C@@H](CO)CN[C@@H]1CCc2c1c(Br)ccc2F	ZINC000341869951	456979428	/nfs/dbraw/zinc/97/94/28/456979428.db2.gz	AKHARSQKXXXRJI-QMTHXVAHSA-N	0	3	328.225	3.350	20	30		EGEDHN
N#C[C@@H]1CC[C@@H](N2CCC[C@H](NC(=O)CCCc3ccccc3)C2)C1	ZINC000339183413	456980912	/nfs/dbraw/zinc/98/09/12/456980912.db2.gz	GBIGNUWGHCICPI-HSALFYBXSA-N	0	3	339.483	3.282	20	30		EGEDHN
C=CCOc1ccc(C(=O)N(C)[C@H](C)C2CCN(C)CC2)cc1OC	ZINC000345584900	456983658	/nfs/dbraw/zinc/98/36/58/456983658.db2.gz	KNPZCDVSFOLLLN-OAHLLOKOSA-N	0	3	346.471	3.062	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C(=O)Nc2ccccc2)CCN1C	ZINC000330128331	456988746	/nfs/dbraw/zinc/98/87/46/456988746.db2.gz	JKHYBMNXOMGAFN-OIISXLGYSA-N	0	3	344.459	3.136	20	30		EGEDHN
C[C@H]1CCCCN(CC(=O)NC(=O)Nc2ccc3c(c2)OCCO3)C1	ZINC000330134080	456990294	/nfs/dbraw/zinc/99/02/94/456990294.db2.gz	GTQOGVGNFSRUQW-ZDUSSCGKSA-N	0	3	347.415	3.082	20	30		EGEDHN
C[C@@H](CN1CCCCC1)NC(=O)NC[C@H]1CCO[C@@H]1c1ccccc1	ZINC000330148385	456991795	/nfs/dbraw/zinc/99/17/95/456991795.db2.gz	MEHBOJFVBXSJNH-QXAKKESOSA-N	0	3	345.487	3.142	20	30		EGEDHN
COc1ccc(CN[C@@H]2[C@H]3CCO[C@H]3C23CCC3)cc1NC(C)=O	ZINC000330193938	457000046	/nfs/dbraw/zinc/00/00/46/457000046.db2.gz	AQWTZBQJHYFSKF-ZTFGCOKTSA-N	0	3	330.428	3.350	20	30		EGEDHN
O=C(CC1(N2CCOCC2)CCCC1)N[C@H]1CCOC2(CCC2)C1	ZINC000330229725	457007746	/nfs/dbraw/zinc/00/77/46/457007746.db2.gz	QFQAJIIYIYTHKC-INIZCTEOSA-N	0	3	336.476	3.080	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)CC(C)(C)C#N)c1cccc(OC)c1	ZINC000346015461	457012869	/nfs/dbraw/zinc/01/28/69/457012869.db2.gz	LIYHRHNCYPRWCM-QGZVFWFLSA-N	0	3	331.460	3.134	20	30		EGEDHN
O=C(NCC#Cc1ccccc1)NC[C@H]1CCCN1Cc1ccccc1	ZINC000359006164	457045569	/nfs/dbraw/zinc/04/55/69/457045569.db2.gz	HNMOSIXTLZEBCW-OAQYLSRUSA-N	0	3	347.462	3.002	20	30		EGEDHN
COCc1ncsc1C(=O)NCC(C)(C)N1C[C@H](C)C[C@H](C)C1	ZINC000330465725	457046390	/nfs/dbraw/zinc/04/63/90/457046390.db2.gz	GOBGCQFMLOQQRL-BETUJISGSA-N	0	3	339.505	3.351	20	30		EGEDHN
CC(C)CN(Cc1ccc(C#N)cc1)C(=O)CN1[C@H](C)CC[C@H]1C	ZINC000342032761	457069856	/nfs/dbraw/zinc/06/98/56/457069856.db2.gz	AMIMWTKQGQJFDQ-IAGOWNOFSA-N	0	3	327.472	3.416	20	30		EGEDHN
C[C@@H]1[C@H](NC(=O)c2cn(CCCC#N)c3ccccc23)CCCN1C	ZINC000346620229	457082689	/nfs/dbraw/zinc/08/26/89/457082689.db2.gz	RGVBGGZSSOTAGZ-CRAIPNDOSA-N	0	3	338.455	3.158	20	30		EGEDHN
C[C@@H](C1CCN(C)CC1)N(C)C(=O)C[C@@H](CC#N)c1ccccc1	ZINC000356632017	457091993	/nfs/dbraw/zinc/09/19/93/457091993.db2.gz	JCFKPSQJFGVDMT-QFBILLFUSA-N	0	3	327.472	3.263	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cnn(CC(C)C)c2C)CC1	ZINC000346770748	457161184	/nfs/dbraw/zinc/16/11/84/457161184.db2.gz	PXPGHWUZNOKTMK-UHFFFAOYSA-N	0	3	333.480	3.010	20	30		EGEDHN
Cc1cc(NCc2ccc(OCCN3CCCC3)cc2)cc(C#N)n1	ZINC000342212656	457170991	/nfs/dbraw/zinc/17/09/91/457170991.db2.gz	VPFMGVUMXZNIBY-UHFFFAOYSA-N	0	3	336.439	3.348	20	30		EGEDHN
N#CCCN(CCC#N)C(=O)CN1CCC[C@H]1CCC1CCCC1	ZINC000362950807	457171080	/nfs/dbraw/zinc/17/10/80/457171080.db2.gz	IACBWOBHPGABCU-SFHVURJKSA-N	0	3	330.476	3.077	20	30		EGEDHN
CC(C)(C)C[C@@H](NCC(=O)NC1(C#N)CCC1)c1ccc(F)cc1	ZINC000346939248	457189932	/nfs/dbraw/zinc/18/99/32/457189932.db2.gz	HLIRDSNDAQGLSR-MRXNPFEDSA-N	0	3	331.435	3.455	20	30		EGEDHN
CC(C)Cc1ccc([C@H](CNCc2cc(C#N)n(C)c2)N(C)C)cc1	ZINC000342305429	457225652	/nfs/dbraw/zinc/22/56/52/457225652.db2.gz	VSBVXPSYHSUROH-NRFANRHFSA-N	0	3	338.499	3.488	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1c1nc(-c2ccc3c(c2)C(SC)C(=O)N3)no1	ZINC000351126332	457227350	/nfs/dbraw/zinc/22/73/50/457227350.db2.gz	ZELWYZHPXPQSIW-SWHYSGLUSA-N	0	3	343.408	3.151	20	30		EGEDHN
COc1ccc(Br)cc1[C@H]1CCCN1C(=O)C(C)C#N	ZINC000347099637	457228019	/nfs/dbraw/zinc/22/80/19/457228019.db2.gz	DWVOLOTWPHPCGM-GXFFZTMASA-N	0	3	337.217	3.281	20	30		EGEDHN
COc1ccc(-c2nc(C)c([C@H](C)NC(=O)C(C)C#N)s2)cc1	ZINC000347109584	457234338	/nfs/dbraw/zinc/23/43/38/457234338.db2.gz	PWVXKUDBZBKUMS-QWRGUYRKSA-N	0	3	329.425	3.464	20	30		EGEDHN
N#CC(C(=O)c1ccc(NC(=O)c2cccs2)cc1)c1ccncn1	ZINC000354469622	457243561	/nfs/dbraw/zinc/24/35/61/457243561.db2.gz	RJHQPFVWNUABCP-CQSZACIVSA-N	0	3	348.387	3.280	20	30		EGEDHN
C[C@H](CNC(=O)C[C@@H](CC#N)c1ccccc1)N1CCCC[C@H]1C	ZINC000354559793	457288787	/nfs/dbraw/zinc/28/87/87/457288787.db2.gz	BSBRLDYBVZJPNT-ZHALLVOQSA-N	0	3	327.472	3.453	20	30		EGEDHN
C=CCN1CCC(NC(=O)C2(Oc3ccc(Cl)cc3)CC2)CC1	ZINC000339935176	457315969	/nfs/dbraw/zinc/31/59/69/457315969.db2.gz	OTUFKSDFKUSUPD-UHFFFAOYSA-N	0	3	334.847	3.018	20	30		EGEDHN
C=C(C)COc1cc(CN2CC[C@H](C(=O)OC)[C@@H]2C)ccc1OC	ZINC000347258334	457316068	/nfs/dbraw/zinc/31/60/68/457316068.db2.gz	BIEGDUSBUSJXJR-HOCLYGCPSA-N	0	3	333.428	3.034	20	30		EGEDHN
C=C(C)COc1cc(CN2CC[C@@H](C(=O)OC)[C@@H]2C)ccc1OC	ZINC000347258332	457316291	/nfs/dbraw/zinc/31/62/91/457316291.db2.gz	BIEGDUSBUSJXJR-GOEBONIOSA-N	0	3	333.428	3.034	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN2CCCC[C@H](C)C2)cc1	ZINC000360604661	457321787	/nfs/dbraw/zinc/32/17/87/457321787.db2.gz	MEJLUKNOAFNAHO-KRWDZBQOSA-N	0	3	343.471	3.454	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2nc(C)sc2-c2ccccc2)CC1	ZINC000352401211	457360252	/nfs/dbraw/zinc/36/02/52/457360252.db2.gz	XCJPTBBSBVURMD-UHFFFAOYSA-N	0	3	341.480	3.499	20	30		EGEDHN
C=C[C@@H](CO)NCc1ccc(Oc2cc(OC)cc(OC)c2)cc1	ZINC000352446049	457372597	/nfs/dbraw/zinc/37/25/97/457372597.db2.gz	BAUBPDJRFCHQLF-HNNXBMFYSA-N	0	3	329.396	3.133	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(CCCc3ccncc3)CC2)cc1	ZINC000347363753	457376543	/nfs/dbraw/zinc/37/65/43/457376543.db2.gz	PVQVFMHCVDNLJR-UHFFFAOYSA-N	0	3	334.467	3.094	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN[C@@H](c1ccccc1)C1CCOCC1	ZINC000378467530	457401259	/nfs/dbraw/zinc/40/12/59/457401259.db2.gz	UEDIRIWJMSHNGB-FQEVSTJZSA-N	0	3	330.472	3.169	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN2CC[C@@](O)(c3ccc(F)cc3)C2)cc1	ZINC000378520388	457407211	/nfs/dbraw/zinc/40/72/11/457407211.db2.gz	NBDJGBUFLALQGX-YWZLYKJASA-N	0	3	340.398	3.210	20	30		EGEDHN
Cc1cc(N[C@@H]2CCN(C3CC3)C2)n2c3ccccc3nc2c1C#N	ZINC000357306645	457435373	/nfs/dbraw/zinc/43/53/73/457435373.db2.gz	ORRBUIXUGKYKNA-CQSZACIVSA-N	0	3	331.423	3.316	20	30		EGEDHN
Cc1ccc(NC(=O)C2CCN(Cc3ccc(CC#N)cc3)CC2)nc1	ZINC000342733824	457487201	/nfs/dbraw/zinc/48/72/01/457487201.db2.gz	OSOBICBJMWUUTJ-UHFFFAOYSA-N	0	3	348.450	3.307	20	30		EGEDHN
COc1cc(OC)cc(Oc2ccc(CNC(=O)C(C)C#N)cc2)c1	ZINC000356168580	457503551	/nfs/dbraw/zinc/50/35/51/457503551.db2.gz	UPSHKCPADJGHTD-ZDUSSCGKSA-N	0	3	340.379	3.272	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@@H](CO)C1CCCC1	ZINC000352680438	457525421	/nfs/dbraw/zinc/52/54/21/457525421.db2.gz	TZBNBPPONPPTRH-INIZCTEOSA-N	0	3	334.485	3.044	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)N[C@@H]1CC[C@H](C#N)C1)c1ccccc1	ZINC000425410223	457540096	/nfs/dbraw/zinc/54/00/96/457540096.db2.gz	WJAQJHYNFHTUBD-CGTJXYLNSA-N	0	3	328.460	3.061	20	30		EGEDHN
CCN(CCC#N)C(=O)CN1C[C@H](c2ccccc2)[C@H]2CCC[C@@H]21	ZINC000352727105	457563870	/nfs/dbraw/zinc/56/38/70/457563870.db2.gz	SVUXJQZZXIEHCI-QRVBRYPASA-N	0	3	325.456	3.017	20	30		EGEDHN
CN(C)C[C@H]1CCc2ccccc2N1C(=O)c1ccc(C#N)s1	ZINC000425600636	457609433	/nfs/dbraw/zinc/60/94/33/457609433.db2.gz	DELYECVLOOVQDE-CQSZACIVSA-N	0	3	325.437	3.143	20	30		EGEDHN
CC(C)[C@H]1CN(Cc2ccc(C#N)cc2C(F)(F)F)CCN1C	ZINC000356430706	457621439	/nfs/dbraw/zinc/62/14/39/457621439.db2.gz	RPYGOSKJWVZZTG-MRXNPFEDSA-N	0	3	325.378	3.349	20	30		EGEDHN
C=CCN1CC[C@H](N(CCc2ccc(Cl)cc2)CC2CC2)C1=O	ZINC000410383411	457639244	/nfs/dbraw/zinc/63/92/44/457639244.db2.gz	OATGBIFZSDOALZ-SFHVURJKSA-N	0	3	332.875	3.381	20	30		EGEDHN
N#CC(C(=O)c1cccc2c1OCC(=O)N2)c1nccc2ccccc21	ZINC000361543231	457783975	/nfs/dbraw/zinc/78/39/75/457783975.db2.gz	LXNKNSMMABTYRL-OAHLLOKOSA-N	0	3	343.342	3.056	20	30		EGEDHN
COc1cccc(CNC(=O)C(C#N)CCc2ccccc2)c1OC	ZINC000433227396	457784908	/nfs/dbraw/zinc/78/49/08/457784908.db2.gz	RLBHLERWYNEPOA-INIZCTEOSA-N	0	3	338.407	3.093	20	30		EGEDHN
C=C[C@@H]1CCCCN1C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000426205917	457785294	/nfs/dbraw/zinc/78/52/94/457785294.db2.gz	BSMSDPRSJGHGHA-QGZVFWFLSA-N	0	3	328.460	3.048	20	30		EGEDHN
CN(CCOCc1ccccc1)C(=O)C(C#N)CCc1ccccc1	ZINC000433379504	457824925	/nfs/dbraw/zinc/82/49/25/457824925.db2.gz	VAFWXAPOBOLOQL-FQEVSTJZSA-N	0	3	336.435	3.434	20	30		EGEDHN
Cc1cc(C)cc(N(CCC#N)C(=O)CN2CC[C@H]3CCC[C@H]32)c1	ZINC000426479265	457838458	/nfs/dbraw/zinc/83/84/58/457838458.db2.gz	IJZOGLCKZODSFT-IEBWSBKVSA-N	0	3	325.456	3.425	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](C)c2cccc(OC)c2)CC1	ZINC000358197318	457852109	/nfs/dbraw/zinc/85/21/09/457852109.db2.gz	WUHCCFMHJQJLFH-OAHLLOKOSA-N	0	3	331.460	3.096	20	30		EGEDHN
C[C@H](NC[C@H](C)S(C)(=O)=O)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000411503211	457904008	/nfs/dbraw/zinc/90/40/08/457904008.db2.gz	KCRJVXCIZRNSNE-GJZGRUSLSA-N	0	3	342.464	3.309	20	30		EGEDHN
C#CC[C@@H](NC(=O)N1CCCC12CCN(C)CC2)c1ccccc1	ZINC000371404408	457913612	/nfs/dbraw/zinc/91/36/12/457913612.db2.gz	NKGXSDXYRCEKEL-GOSISDBHSA-N	0	3	325.456	3.021	20	30		EGEDHN
C=CC[C@H]1N(CC(=O)NCc2ccc(C#N)cc2)CCCC1(C)C	ZINC000444788069	457979800	/nfs/dbraw/zinc/97/98/00/457979800.db2.gz	ZZUSBKBBYVJSRQ-GOSISDBHSA-N	0	3	325.456	3.241	20	30		EGEDHN
N#Cc1cccc(OCCN2CCC(n3cc(Cl)cn3)CC2)c1	ZINC000371656292	458021629	/nfs/dbraw/zinc/02/16/29/458021629.db2.gz	RJIAAWSHTPCIPR-UHFFFAOYSA-N	0	3	330.819	3.124	20	30		EGEDHN
Cc1cccc2c1OC[C@@H](NC(=O)C(C#N)CCc1ccccc1)C2	ZINC000427987120	458062103	/nfs/dbraw/zinc/06/21/03/458062103.db2.gz	JIHCAAWUYYVJMS-OALUTQOASA-N	0	3	334.419	3.187	20	30		EGEDHN
C[C@](Cc1ccccc1)(NCC(=O)NC1(C#N)CCC1)c1ccccc1	ZINC000412096540	458088825	/nfs/dbraw/zinc/08/88/25/458088825.db2.gz	NEVQHXRDYLSFQU-OAQYLSRUSA-N	0	3	347.462	3.297	20	30		EGEDHN
Cc1ccc([C@@H](C)[NH2+]C2CCN(c3ccc(C#N)cn3)CC2)c([O-])c1	ZINC000371875782	458105914	/nfs/dbraw/zinc/10/59/14/458105914.db2.gz	GFMITVRDFOBXEU-OAHLLOKOSA-N	0	3	336.439	3.287	20	30		EGEDHN
N#CC[C@H](CC(=O)N1CCCN(CC2CCC2)CC1)c1ccccc1	ZINC000412319810	458166831	/nfs/dbraw/zinc/16/68/31/458166831.db2.gz	UPXBFVYIVPOJTQ-HXUWFJFHSA-N	0	3	339.483	3.408	20	30		EGEDHN
CC(C)C[C@@H](CN1CCCC1)NC(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1	ZINC000412379342	458186062	/nfs/dbraw/zinc/18/60/62/458186062.db2.gz	WFISGZFGHPDAPJ-SLFFLAALSA-N	0	3	339.483	3.288	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCN(CCCOc3ccc(F)cc3)C2)nc1	ZINC000428771531	458208367	/nfs/dbraw/zinc/20/83/67/458208367.db2.gz	IPVUJDHSDDXKBX-SFHVURJKSA-N	0	3	341.386	3.015	20	30		EGEDHN
C=CCOc1ccc(CN2CCC[C@H](c3ccnn3C)C2)cc1OC	ZINC000372433322	458302042	/nfs/dbraw/zinc/30/20/42/458302042.db2.gz	FTRZQHLWVTVDGI-KRWDZBQOSA-N	0	3	341.455	3.373	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)Nc1ccc(OCCN(C)C)cc1F)OCC	ZINC000413896355	458312009	/nfs/dbraw/zinc/31/20/09/458312009.db2.gz	BWNJJYCTEGEGIA-QGZVFWFLSA-N	0	3	338.423	3.076	20	30		EGEDHN
C=CCOc1ccc(CNCCC(C)(C)S(C)(=O)=O)cc1Cl	ZINC000414518849	458320732	/nfs/dbraw/zinc/32/07/32/458320732.db2.gz	VZXHAUCTFVPGBX-UHFFFAOYSA-N	0	3	345.892	3.208	20	30		EGEDHN
C=CCOc1ccc(CNC[C@@H](CO)c2ccc(F)cc2)cc1OC	ZINC000414555782	458324484	/nfs/dbraw/zinc/32/44/84/458324484.db2.gz	MNHMWJHJZQLRAJ-KRWDZBQOSA-N	0	3	345.414	3.265	20	30		EGEDHN
C[C@@H](N[C@H]1CCCc2cc(C#N)ccc21)c1ccc(-n2cnnn2)cc1	ZINC000417360049	458362352	/nfs/dbraw/zinc/36/23/52/458362352.db2.gz	HKZXVLCUIAQMRZ-VLIAUNLRSA-N	0	3	344.422	3.262	20	30		EGEDHN
C[C@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1cccc(C#N)c1	ZINC000436714533	458365877	/nfs/dbraw/zinc/36/58/77/458365877.db2.gz	MMPFOANATUIQHR-HNNXBMFYSA-N	0	3	349.434	3.219	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)N[C@@H]1CCN2CCCC[C@H]12	ZINC000429871933	458378875	/nfs/dbraw/zinc/37/88/75/458378875.db2.gz	WKIYUYAAEBRVTC-HZPDHXFCSA-N	0	3	339.464	3.438	20	30		EGEDHN
C=CCC(C)(C)CN[C@H](C(N)=O)c1cccc(Br)c1	ZINC000419176912	458379613	/nfs/dbraw/zinc/37/96/13/458379613.db2.gz	COXQPUGYKIIEPU-ZDUSSCGKSA-N	0	3	325.250	3.167	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)NCC2(C#N)CCC2)CCN1Cc1ccccc1	ZINC000419496459	458384311	/nfs/dbraw/zinc/38/43/11/458384311.db2.gz	LYUCMNZFAVUVFL-WMZOPIPTSA-N	0	3	340.471	3.033	20	30		EGEDHN
CC(C)N1CC[C@H](N(C)C(=O)N[C@H]2CCCc3cc(C#N)ccc32)C1	ZINC000419606476	458387446	/nfs/dbraw/zinc/38/74/46/458387446.db2.gz	FYLKOLXAGXEBRF-HKUYNNGSSA-N	0	3	340.471	3.060	20	30		EGEDHN
COc1ncccc1NC(=O)C(C#N)c1ncc(C(C)(C)C)s1	ZINC000419826654	458391860	/nfs/dbraw/zinc/39/18/60/458391860.db2.gz	ARPLRGHJRVBSHP-SNVBAGLBSA-N	0	3	330.413	3.090	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N(C)C2CC(C)(C)C2)cc1	ZINC000459522002	458398652	/nfs/dbraw/zinc/39/86/52/458398652.db2.gz	WINHTTVFESOSRH-LBPRGKRZSA-N	0	3	349.456	3.025	20	30		EGEDHN
C=CCOc1ccc(CC(=O)NC[C@H](c2ccccc2)N(C)C)cc1	ZINC000448576307	458402379	/nfs/dbraw/zinc/40/23/79/458402379.db2.gz	ZNXOHFLBSRIAHH-HXUWFJFHSA-N	0	3	338.451	3.213	20	30		EGEDHN
N#C[C@@]1(C(=O)NCCCN2CCc3ccccc3C2)CC12CCCC2	ZINC000448675912	458404895	/nfs/dbraw/zinc/40/48/95/458404895.db2.gz	PDHRFULZNGSMST-OAQYLSRUSA-N	0	3	337.467	3.025	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCc1ccc(OCC(F)(F)F)c(OC)c1	ZINC000449546670	458426107	/nfs/dbraw/zinc/42/61/07/458426107.db2.gz	CZQWDMMRWJDROS-KGLIPLIRSA-N	0	3	345.361	3.460	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCc1ccc(OC)cc1Br	ZINC000449546233	458426207	/nfs/dbraw/zinc/42/62/07/458426207.db2.gz	BAOHNJLAMWDBBF-CABCVRRESA-N	0	3	326.234	3.281	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCc1ccc(OCc2ccncc2)c(OC)c1	ZINC000449520778	458426329	/nfs/dbraw/zinc/42/63/29/458426329.db2.gz	QDCGNQTUJQAITO-MSOLQXFVSA-N	0	3	340.423	3.102	20	30		EGEDHN
COC(=O)[C@@H]1CN(Cc2ccc(C#N)c(C)c2)C[C@H]1c1ccccc1	ZINC000449752066	458431039	/nfs/dbraw/zinc/43/10/39/458431039.db2.gz	AXHNZFYHCTUYOH-VQTJNVASSA-N	0	3	334.419	3.255	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000449909200	458434474	/nfs/dbraw/zinc/43/44/74/458434474.db2.gz	YYHCYCAMOVLRLA-AFYVEPGGSA-N	0	3	342.483	3.089	20	30		EGEDHN
CC(C)O[C@@H]1C[C@@H](NCC(=O)Nc2cc(Cl)ccc2C#N)C1(C)C	ZINC000451496882	458478892	/nfs/dbraw/zinc/47/88/92/458478892.db2.gz	KUMIIKNFUKJVOQ-HZPDHXFCSA-N	0	3	349.862	3.332	20	30		EGEDHN
COc1ccc(CN[C@H]2C[C@H](OC)C23CCC3)cc1OCCCC#N	ZINC000459799202	458482832	/nfs/dbraw/zinc/48/28/32/458482832.db2.gz	YOXXJVKEFUDIBC-OALUTQOASA-N	0	3	344.455	3.425	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCC(=O)N[C@H](CC(C)(C)C)c1ccc(F)cc1	ZINC000451607757	458483533	/nfs/dbraw/zinc/48/35/33/458483533.db2.gz	QKYFHQBDGWLCHB-KURKYZTESA-N	0	3	348.462	3.352	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC(=O)N(Cc1cccc(F)c1)C(C)(C)C	ZINC000451671737	458484116	/nfs/dbraw/zinc/48/41/16/458484116.db2.gz	GKNGCMKJXJZTCX-MSOLQXFVSA-N	0	3	348.462	3.276	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CCC[C@]2(CCSC2)C1	ZINC000451970825	458491487	/nfs/dbraw/zinc/49/14/87/458491487.db2.gz	YXESZKVFONVAFG-QUCCMNQESA-N	0	3	347.524	3.374	20	30		EGEDHN
C=CCNC(=O)CN[C@@H]1CCCCc2ccc(Br)cc21	ZINC000453186993	458522014	/nfs/dbraw/zinc/52/20/14/458522014.db2.gz	UZDVEWUZWOPGNI-OAHLLOKOSA-N	0	3	337.261	3.108	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1N[C@@H](C)c1ccc(OCCOC)c(OC)c1	ZINC000453329507	458524560	/nfs/dbraw/zinc/52/45/60/458524560.db2.gz	AKPPFYYGQZQMPQ-UAGQMJEPSA-N	0	3	335.444	3.105	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)c(F)c1)c1cccc(OCCN(C)C)c1	ZINC000453391229	458526427	/nfs/dbraw/zinc/52/64/27/458526427.db2.gz	SVRLZFXFQJLKII-HNNXBMFYSA-N	0	3	341.430	3.489	20	30		EGEDHN
C=C(C)COc1cc(CNCCc2cnc(C)cn2)ccc1OC	ZINC000453590804	458536554	/nfs/dbraw/zinc/53/65/54/458536554.db2.gz	BKOXFCIAEOCFMT-UHFFFAOYSA-N	0	3	327.428	3.081	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1nc(-c2ccc3c(c2)CCC3)cs1	ZINC000424065497	458549357	/nfs/dbraw/zinc/54/93/57/458549357.db2.gz	LYMOZLJLLUYTOV-OAHLLOKOSA-N	0	3	340.452	3.258	20	30		EGEDHN
CSc1ccc(-c2csc(NC(=O)[C@@H](N)CCCC#N)n2)cc1	ZINC000424071294	458550588	/nfs/dbraw/zinc/55/05/88/458550588.db2.gz	ZKDLVZWKPCVMEZ-ZDUSSCGKSA-N	0	3	346.481	3.492	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N[C@@H](CCc1ccccc1)c1ccccc1	ZINC000424086312	458555535	/nfs/dbraw/zinc/55/55/35/458555535.db2.gz	BUNPJXGQHVELQF-PMACEKPBSA-N	0	3	335.451	3.498	20	30		EGEDHN
CC[C@@H](Cc1ccccc1)N(CC)CC(=O)N[C@](C)(C#N)C(C)C	ZINC000469142408	458557591	/nfs/dbraw/zinc/55/75/91/458557591.db2.gz	ZQSOSEAPWXMAPW-AZUAARDMSA-N	0	3	329.488	3.384	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1nc(-c2cccc(Cl)c2)cs1	ZINC000424099476	458557777	/nfs/dbraw/zinc/55/77/77/458557777.db2.gz	MIIZXMFOEXERME-GFCCVEGCSA-N	0	3	334.832	3.423	20	30		EGEDHN
C[C@H](C(=O)Nc1ccc(OCCN(C)C)cc1)c1cccc(C#N)c1	ZINC000461938619	458579881	/nfs/dbraw/zinc/57/98/81/458579881.db2.gz	TXQCEZNBEYZXLE-HNNXBMFYSA-N	0	3	337.423	3.241	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N(Cc1ccccc1)Cc1ccc(F)cc1	ZINC000424189313	458580181	/nfs/dbraw/zinc/58/01/81/458580181.db2.gz	KLJQWZDRHGKQNR-IBGZPJMESA-N	0	3	339.414	3.376	20	30		EGEDHN
C[C@@H](CNC(=O)C(C)(C)Cc1ccc(C#N)cc1)N1CCC(C)CC1	ZINC000455110271	458585588	/nfs/dbraw/zinc/58/55/88/458585588.db2.gz	ZAEIEHIIKQSIJR-KRWDZBQOSA-N	0	3	341.499	3.364	20	30		EGEDHN
C[C@H](C(=O)NC[C@H]1CCCN1Cc1ccccc1)c1cccc(C#N)c1	ZINC000462081603	458592977	/nfs/dbraw/zinc/59/29/77/458592977.db2.gz	CZETZYXFTVLIBM-LAUBAEHRSA-N	0	3	347.462	3.443	20	30		EGEDHN
C=CCOc1cccc(CNC[C@@](C)(C(=O)OC)c2ccccc2)c1	ZINC000470134118	458614785	/nfs/dbraw/zinc/61/47/85/458614785.db2.gz	CIZBMFHSPQBTMO-OAQYLSRUSA-N	0	3	339.435	3.472	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CC[C@@H](C(F)(F)F)[C@@H]1C	ZINC000470952680	458668648	/nfs/dbraw/zinc/66/86/48/458668648.db2.gz	GQDBUOYRQWLDGB-NUEKZKHPSA-N	0	3	343.389	3.428	20	30		EGEDHN
C=CC[C@@H](CO)CNCc1cccc2c1N(C(=O)OC(C)(C)C)CC2	ZINC000494590910	458705554	/nfs/dbraw/zinc/70/55/54/458705554.db2.gz	SIXVBIGSHQQYDW-OAHLLOKOSA-N	0	3	346.471	3.258	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)NC[C@@H](C)N1CCC[C@@H](C)C1	ZINC000463506293	458707641	/nfs/dbraw/zinc/70/76/41/458707641.db2.gz	JAUNNPGEWKLEBM-HZPDHXFCSA-N	0	3	346.471	3.110	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)NC[C@H](C)N1CCC(C)CC1	ZINC000463534462	458708901	/nfs/dbraw/zinc/70/89/01/458708901.db2.gz	VOHHJQCWIJOKTK-INIZCTEOSA-N	0	3	346.471	3.110	20	30		EGEDHN
C[C@@H](C(=O)Nc1cccc(OCCN(C)C)c1)c1cccc(C#N)c1	ZINC000463581322	458711633	/nfs/dbraw/zinc/71/16/33/458711633.db2.gz	FRVDMNDUKVDWKC-OAHLLOKOSA-N	0	3	337.423	3.241	20	30		EGEDHN
COc1cc(C#N)ccc1NC(=O)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000547415634	458735138	/nfs/dbraw/zinc/73/51/38/458735138.db2.gz	ATAFTTNONIAURW-SFHVURJKSA-N	0	3	349.434	3.418	20	30		EGEDHN
C[C@H](NCC(C)(C)c1c(F)cccc1Cl)C(=O)N(C)CCC#N	ZINC000439652198	458736697	/nfs/dbraw/zinc/73/66/97/458736697.db2.gz	VOXVTAJONQTRLD-LBPRGKRZSA-N	0	3	339.842	3.107	20	30		EGEDHN
C=CCn1c(-c2ccccc2C)nnc1N1CCN(C)[C@H](C(C)C)C1	ZINC000508493177	458759853	/nfs/dbraw/zinc/75/98/53/458759853.db2.gz	LACKMDWBMOZMHL-SFHVURJKSA-N	0	3	339.487	3.216	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)N(CCN(C)C)C2CCCC2)cc1	ZINC000509349292	458771704	/nfs/dbraw/zinc/77/17/04/458771704.db2.gz	FGLDFMJEUANBIO-UHFFFAOYSA-N	0	3	345.487	3.267	20	30		EGEDHN
C[C@H]1[C@@H](Cc2ccccc2)CCN1CC(=O)Nc1ccc(C#N)cc1	ZINC000472350417	458789076	/nfs/dbraw/zinc/78/90/76/458789076.db2.gz	UAODGLPSEBJCBQ-QFBILLFUSA-N	0	3	333.435	3.450	20	30		EGEDHN
C[C@@H]1[C@H](Cc2ccccc2)CCN1CC(=O)NCc1cccc(C#N)c1	ZINC000472353109	458790988	/nfs/dbraw/zinc/79/09/88/458790988.db2.gz	VWWCSFISEXWIKD-UTKZUKDTSA-N	0	3	347.462	3.128	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN(C)Cc1cccc(OC)c1	ZINC000514712717	458800384	/nfs/dbraw/zinc/80/03/84/458800384.db2.gz	BHGAWIVCNCEPHU-LJQANCHMSA-N	0	3	341.451	3.295	20	30		EGEDHN
C=CCN1CCC(N[C@@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)CC1	ZINC000514867934	458802785	/nfs/dbraw/zinc/80/27/85/458802785.db2.gz	YGYVGYCQSBKDDE-HNNXBMFYSA-N	0	3	343.349	3.438	20	30		EGEDHN
CN(C)[C@@H]1CCCN(C(=O)c2ccc(C#Cc3ccccc3)cc2)C1	ZINC000517348121	458828546	/nfs/dbraw/zinc/82/85/46/458828546.db2.gz	KSWGEVJLWLBARM-OAQYLSRUSA-N	0	3	332.447	3.253	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)c1cc2c(s1)CCOC2	ZINC000517743578	458831921	/nfs/dbraw/zinc/83/19/21/458831921.db2.gz	JDHDJHVEZYTGOR-LBPRGKRZSA-N	0	3	337.404	3.198	20	30		EGEDHN
COc1cc(CNC[C@@](C)(Cc2ccccc2)[C@@H](C)O)ccc1C#N	ZINC000440643030	458836652	/nfs/dbraw/zinc/83/66/52/458836652.db2.gz	ZEFCPNVYXJPMBU-IIBYNOLFSA-N	0	3	338.451	3.286	20	30		EGEDHN
C=CC[C@H](CO)N[C@H](C)c1ccc(CNC(=O)OC(C)(C)C)nc1C	ZINC000495377480	458844980	/nfs/dbraw/zinc/84/49/80/458844980.db2.gz	PSIWSJZGVWFEGT-GDBMZVCRSA-N	0	3	349.475	3.002	20	30		EGEDHN
C=CCc1ccc(OC[C@H](O)CNCc2cscc2C)c(OC)c1	ZINC000518171168	458845737	/nfs/dbraw/zinc/84/57/37/458845737.db2.gz	RIJINPCQHXTGEF-QGZVFWFLSA-N	0	3	347.480	3.323	20	30		EGEDHN
COc1ccc(O[C@@H](C)CNCc2ccc(C#N)c(OC)c2)cc1	ZINC000440823485	458858480	/nfs/dbraw/zinc/85/84/80/458858480.db2.gz	WBCNFIBPWBQRQA-AWEZNQCLSA-N	0	3	326.396	3.133	20	30		EGEDHN
N#Cc1csc(C(=O)N2CCN(c3ccnc4ccccc43)CC2)c1	ZINC000518411588	458865351	/nfs/dbraw/zinc/86/53/51/458865351.db2.gz	PEECPRZUFDCGNK-UHFFFAOYSA-N	0	3	348.431	3.130	20	30		EGEDHN
N#Cc1cccc(C2(NC(=O)C(C#N)CCc3ccccc3)CC2)c1	ZINC000552468633	458892218	/nfs/dbraw/zinc/89/22/18/458892218.db2.gz	VJTGDUURBNXWIR-SFHVURJKSA-N	0	3	329.403	3.436	20	30		EGEDHN
N#CCC[C@H](NC[C@H](O)COc1ccc(CC#N)cc1)c1ccccc1	ZINC000553385950	458895307	/nfs/dbraw/zinc/89/53/07/458895307.db2.gz	IULOHXCMHJXJDU-FPOVZHCZSA-N	0	3	349.434	3.127	20	30		EGEDHN
N#Cc1cccc(CCNCc2cc([N+](=O)[O-])ccc2OC(F)F)c1	ZINC000466424345	458899008	/nfs/dbraw/zinc/89/90/08/458899008.db2.gz	HOJFLOUTRYPDGK-UHFFFAOYSA-N	0	3	347.321	3.400	20	30		EGEDHN
CC(C)CN(Cc1ccc(C#N)cc1)C(=O)NC[C@H]1CCCN(C)C1	ZINC000531483883	458923566	/nfs/dbraw/zinc/92/35/66/458923566.db2.gz	CZSADULWIQESSK-LJQANCHMSA-N	0	3	342.487	3.068	20	30		EGEDHN
CC1CC(C#N)(C(=O)NC[C@@H]2CCCN(Cc3cccs3)C2)C1	ZINC000531554958	458934642	/nfs/dbraw/zinc/93/46/42/458934642.db2.gz	PLNHUFJRECXNLI-CSLYMUCUSA-N	0	3	331.485	3.016	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN2C[C@@H](C)C[C@@H]2CC)cc1	ZINC000466929091	458937434	/nfs/dbraw/zinc/93/74/34/458937434.db2.gz	NHYZLXRPTZSVPD-IRXDYDNUSA-N	0	3	343.471	3.452	20	30		EGEDHN
COc1ccc([C@@H](CNC[C@H](C#N)CCC#N)N2CCCCC2)cc1	ZINC000556483508	458965662	/nfs/dbraw/zinc/96/56/62/458965662.db2.gz	XTHBXCVZZGVOPI-FXAWDEMLSA-N	0	3	340.471	3.255	20	30		EGEDHN
CC(C)Sc1ccc([C@H](C)NC[C@@H](O)CN(C)CCC#N)cc1	ZINC000577097631	458979444	/nfs/dbraw/zinc/97/94/44/458979444.db2.gz	GHXNLRVJKUTZIS-DOTOQJQBSA-N	0	3	335.517	3.044	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC([C@@H]2C[C@H]2NCc2ccc(C#N)o2)CC1	ZINC000495856742	458979873	/nfs/dbraw/zinc/97/98/73/458979873.db2.gz	TXOPACGXPINFJH-DLBZAZTESA-N	0	3	345.443	3.276	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN[C@H]1CCCc2occc21	ZINC000566792296	459001221	/nfs/dbraw/zinc/00/12/21/459001221.db2.gz	QAWBSSLQXGXTNF-AEFFLSMTSA-N	0	3	327.424	3.415	20	30		EGEDHN
COc1ccc(OCCN(C)CCCOc2cccc(C#N)c2)cc1	ZINC000477144542	459033178	/nfs/dbraw/zinc/03/31/78/459033178.db2.gz	UMBSJHPHWABTNN-UHFFFAOYSA-N	0	3	340.423	3.347	20	30		EGEDHN
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@H](C#N)CCC#N)C[C@@H]2C1	ZINC000496040649	459047117	/nfs/dbraw/zinc/04/71/17/459047117.db2.gz	DLJCNFWLEOOTJL-NXOAAHMSSA-N	0	3	346.475	3.055	20	30		EGEDHN
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@@H](C#N)CCC#N)C[C@@H]2C1	ZINC000496040664	459047350	/nfs/dbraw/zinc/04/73/50/459047350.db2.gz	DLJCNFWLEOOTJL-TWMKSMIVSA-N	0	3	346.475	3.055	20	30		EGEDHN
COc1cc(CN(CCCO)[C@@H]2CCc3ccccc32)ccc1C#N	ZINC000442882497	459052111	/nfs/dbraw/zinc/05/21/11/459052111.db2.gz	REKPZJGLQNDDIM-HXUWFJFHSA-N	0	3	336.435	3.439	20	30		EGEDHN
C[C@H]1CC[C@H](C)N1CC(=O)NCC#Cc1ccc(C(F)(F)F)cc1	ZINC000477636586	459053363	/nfs/dbraw/zinc/05/33/63/459053363.db2.gz	FUGBLUNTYZBWBL-KBPBESRZSA-N	0	3	338.373	3.046	20	30		EGEDHN
CC[C@@H](NCc1ccc(OCCOC)nc1)c1ccc(C#N)cc1	ZINC000577814677	459099147	/nfs/dbraw/zinc/09/91/47/459099147.db2.gz	RECRMOBYSXVIST-GOSISDBHSA-N	0	3	325.412	3.219	20	30		EGEDHN
COc1ccc2c(c1)CCCN(CCC(=O)Nc1cccc(C#N)c1)C2	ZINC000532536873	459108109	/nfs/dbraw/zinc/10/81/09/459108109.db2.gz	UBPXWFUGYKYHAB-UHFFFAOYSA-N	0	3	349.434	3.344	20	30		EGEDHN
CC[C@H]1CCCC[C@H]1CNCCS(=O)(=O)c1ccc(C#N)cc1	ZINC000577860304	459108730	/nfs/dbraw/zinc/10/87/30/459108730.db2.gz	WCLGGJQMMLUFIR-IRXDYDNUSA-N	0	3	334.485	3.138	20	30		EGEDHN
N#CCSCCCN1CCC[C@H]1COC(=O)NC1CCCCC1	ZINC000496382045	459172971	/nfs/dbraw/zinc/17/29/71/459172971.db2.gz	MVBCIDPLATXCAF-INIZCTEOSA-N	0	3	339.505	3.157	20	30		EGEDHN
N#Cc1cccc(CNC(=O)CN2CCC[C@@H]2CCc2ccccc2)c1	ZINC000521814997	459178398	/nfs/dbraw/zinc/17/83/98/459178398.db2.gz	XQGOVGNMPHCFMU-OAQYLSRUSA-N	0	3	347.462	3.272	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H]1CCN(c2cccc(C#N)c2[N+](=O)[O-])C1	ZINC000590691244	459184052	/nfs/dbraw/zinc/18/40/52/459184052.db2.gz	MBLHDXZYGPSSFP-QGZVFWFLSA-N	0	3	336.395	3.177	20	30		EGEDHN
C=CCN1CC[C@@H](N2CCC(c3ccnc4ccccc43)CC2)C1=O	ZINC000578335459	459184680	/nfs/dbraw/zinc/18/46/80/459184680.db2.gz	ICPMYSHFXHCKQA-HXUWFJFHSA-N	0	3	335.451	3.201	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)N(C)[C@H](C)C1CCN(C)CC1	ZINC000567960883	459199103	/nfs/dbraw/zinc/19/91/03/459199103.db2.gz	CPQAVGOKWKEFMV-OAHLLOKOSA-N	0	3	346.471	3.062	20	30		EGEDHN
N#Cc1ccc2c(c1)CC[C@H]2NC(=O)[C@@H]1CCCCN1C1CCCC1	ZINC000590748491	459203493	/nfs/dbraw/zinc/20/34/93/459203493.db2.gz	BPDCELXOJITIJL-UXHICEINSA-N	0	3	337.467	3.459	20	30		EGEDHN
N#Cc1ccc2c(c1)CC[C@@H]2NC(=O)[C@H]1CCCCN1C1CCCC1	ZINC000590748492	459204006	/nfs/dbraw/zinc/20/40/06/459204006.db2.gz	BPDCELXOJITIJL-VQTJNVASSA-N	0	3	337.467	3.459	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C[C@@H]2CCc3ccccc3C2)CC1	ZINC000480596720	459207446	/nfs/dbraw/zinc/20/74/46/459207446.db2.gz	RXLGZRCMNRZQMG-QGZVFWFLSA-N	0	3	326.484	3.338	20	30		EGEDHN
C[C@@](C#N)(NC(=O)CN(CCc1ccccc1)C1CCCC1)C1CC1	ZINC000522083442	459210836	/nfs/dbraw/zinc/21/08/36/459210836.db2.gz	VXAYLDBGARJQES-NRFANRHFSA-N	0	3	339.483	3.282	20	30		EGEDHN
C=C(C)Cn1c(CC(C)C)nnc1N1CC[C@H](N2CCCCC2)C1	ZINC000559029901	459231275	/nfs/dbraw/zinc/23/12/75/459231275.db2.gz	SIZHSQUJSWXFMM-KRWDZBQOSA-N	0	3	331.508	3.117	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(CCOCc3ccccc3)CC2)cc1	ZINC000595292246	459269504	/nfs/dbraw/zinc/26/95/04/459269504.db2.gz	XJDSGYOJKDEBNE-UHFFFAOYSA-N	0	3	349.478	3.283	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CC2(CCC2)[C@@H]1C1CC1	ZINC000581222579	459269827	/nfs/dbraw/zinc/26/98/27/459269827.db2.gz	ADXLLTGCASPEFO-ICSRJNTNSA-N	0	3	327.468	3.419	20	30		EGEDHN
CC(C)N1CCN([C@@H]2CCN([C@H](C#N)c3ccc(Cl)cc3)C2)CC1	ZINC000595341726	459280549	/nfs/dbraw/zinc/28/05/49/459280549.db2.gz	YMFZHZMOTMAYRH-RTBURBONSA-N	0	3	346.906	3.005	20	30		EGEDHN
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NCc1cccc(C#N)c1F	ZINC000560178447	459309924	/nfs/dbraw/zinc/30/99/24/459309924.db2.gz	OAHCBCPDDHHFDV-KSSFIOAISA-N	0	3	340.398	3.207	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CNCc1ccnc(SC)c1	ZINC000568618971	459316694	/nfs/dbraw/zinc/31/66/94/459316694.db2.gz	ZPDUWCDAACFNDU-QGZVFWFLSA-N	0	3	344.480	3.062	20	30		EGEDHN
C[C@@H](CO)N(CC#Cc1ccc(OC(F)(F)F)cc1)CC1CCC1	ZINC000483135320	459343621	/nfs/dbraw/zinc/34/36/21/459343621.db2.gz	FSCKQRBZYOWNPP-AWEZNQCLSA-N	0	3	341.373	3.420	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1OC(F)F)[C@H](CO)Cc1ccccc1	ZINC000595599834	459360547	/nfs/dbraw/zinc/36/05/47/459360547.db2.gz	ZZRDTUIWUXMCON-KRWDZBQOSA-N	0	3	346.377	3.195	20	30		EGEDHN
Cc1ccccc1[C@@H]1C[C@H](C)N(CC(=O)NCc2cccc(C#N)c2)C1	ZINC000524593494	459373281	/nfs/dbraw/zinc/37/32/81/459373281.db2.gz	CLNBSHDVMLTMQJ-FXAWDEMLSA-N	0	3	347.462	3.361	20	30		EGEDHN
FC(F)CN1CCC(NCC#Cc2ccc(C(F)(F)F)cc2)CC1	ZINC000540494474	459382148	/nfs/dbraw/zinc/38/21/48/459382148.db2.gz	BMVQANATHDCSPU-UHFFFAOYSA-N	0	3	346.343	3.376	20	30		EGEDHN
Cc1nc(NC(=O)[C@H](N)CCCC#N)sc1Cc1ccccc1	ZINC000591599681	459409963	/nfs/dbraw/zinc/40/99/63/459409963.db2.gz	NXWJYTLVLDACCI-CQSZACIVSA-N	0	3	328.441	3.002	20	30		EGEDHN
CN1CCC[C@H](NCCC(=O)Nc2ccc(C#N)cc2)c2ccccc21	ZINC000569316660	459430296	/nfs/dbraw/zinc/43/02/96/459430296.db2.gz	NIKJRPKFGSQMJU-IBGZPJMESA-N	0	3	348.450	3.448	20	30		EGEDHN
Cc1ccc(C)c(OC[C@@H](O)CN[C@H]2CCc3cc(C#N)ccc32)c1	ZINC000591763854	459430403	/nfs/dbraw/zinc/43/04/03/459430403.db2.gz	MYBCCKSSLXLKHI-ICSRJNTNSA-N	0	3	336.435	3.192	20	30		EGEDHN
Cc1cccc(OC[C@H](O)CNCc2ccc(C#N)c(Cl)c2)c1	ZINC000591765946	459431251	/nfs/dbraw/zinc/43/12/51/459431251.db2.gz	VCWYLZFYMZWINT-MRXNPFEDSA-N	0	3	330.815	3.050	20	30		EGEDHN
CN(C)[C@H](CNC(=O)N1CCC(CCC#N)CC1)c1ccccc1	ZINC000591893951	459470039	/nfs/dbraw/zinc/47/00/39/459470039.db2.gz	JUBWDKNCJCIOJW-GOSISDBHSA-N	0	3	328.460	3.015	20	30		EGEDHN
CN(C)C[C@H](CNC(=O)C1(C#N)CCCC1)c1ccc(Cl)cc1	ZINC000561688928	459473509	/nfs/dbraw/zinc/47/35/09/459473509.db2.gz	DJFCNTOAVHKXLB-HNNXBMFYSA-N	0	3	333.863	3.185	20	30		EGEDHN
C[C@H](C(=O)N(CCC#N)c1ccc(F)cc1)N(C)C[C@@H]1CC1(C)C	ZINC000595909998	459483087	/nfs/dbraw/zinc/48/30/87/459483087.db2.gz	APVKDGOKEZJWAJ-CABCVRRESA-N	0	3	331.435	3.439	20	30		EGEDHN
N#CC1(NC(=O)CN2C[C@H](c3ccccc3)[C@H]3CCCC[C@@H]32)CCC1	ZINC000525886121	459511618	/nfs/dbraw/zinc/51/16/18/459511618.db2.gz	CGUMTUHLPVVXMA-QRVBRYPASA-N	0	3	337.467	3.207	20	30		EGEDHN
Cn1cc(CN2CCC(CC#N)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000541922834	459512070	/nfs/dbraw/zinc/51/20/70/459512070.db2.gz	SBOWNJDIINNSSO-UHFFFAOYSA-N	0	3	339.399	3.121	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN1CCC[C@H]1CCCc1ccccc1	ZINC000486809500	459524026	/nfs/dbraw/zinc/52/40/26/459524026.db2.gz	OAMSGQLLBSSIKX-AZUAARDMSA-N	0	3	341.499	3.482	20	30		EGEDHN
C=CCN(CCc1ccco1)C(=O)NCCN(C)Cc1ccccc1	ZINC000497369585	459528761	/nfs/dbraw/zinc/52/87/61/459528761.db2.gz	RBBFQMVLIQPONP-UHFFFAOYSA-N	0	3	341.455	3.152	20	30		EGEDHN
Cc1nc(NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)ccc1C#N	ZINC000488038236	459536225	/nfs/dbraw/zinc/53/62/25/459536225.db2.gz	ZDXACGOJEYKTTQ-LJQANCHMSA-N	0	3	338.455	3.186	20	30		EGEDHN
COCCN(CC(=O)Nc1ccc(C#N)c(Cl)c1)[C@@H]1CCC[C@H]1C	ZINC000487964049	459536978	/nfs/dbraw/zinc/53/69/78/459536978.db2.gz	OMAGSNDANRIKDX-CXAGYDPISA-N	0	3	349.862	3.287	20	30		EGEDHN
N#CC[C@@]1(O)CCN(CC/C=C\c2ccc(Br)cc2)C1	ZINC000592151178	459537598	/nfs/dbraw/zinc/53/75/98/459537598.db2.gz	NSVCYXGVDBBDGA-SSCKWRJFSA-N	0	3	335.245	3.203	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CC[C@H](C(=O)NCc2ccccc2)C1	ZINC000592155553	459537816	/nfs/dbraw/zinc/53/78/16/459537816.db2.gz	OVINRIPITPBKIH-FQEVSTJZSA-N	0	3	333.435	3.005	20	30		EGEDHN
C=CCN(CCc1ccco1)C(=O)NC[C@@H](C)N1CCC(C)CC1	ZINC000497691016	459551228	/nfs/dbraw/zinc/55/12/28/459551228.db2.gz	LXRYOQAAHJHZGU-QGZVFWFLSA-N	0	3	333.476	3.140	20	30		EGEDHN
N#Cc1ncccc1SC[C@@H]1CN(Cc2ccccc2)CCCO1	ZINC000583575268	459562037	/nfs/dbraw/zinc/56/20/37/459562037.db2.gz	YBSMCVWEWMRTGG-KRWDZBQOSA-N	0	3	339.464	3.336	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CCC[C@@H](c3ccncc3)C2)cc1	ZINC000570969574	459562878	/nfs/dbraw/zinc/56/28/78/459562878.db2.gz	FNRKKQJCGLXDFD-WOJBJXKFSA-N	0	3	344.418	3.042	20	30		EGEDHN
N#CC1CN(C(=O)Nc2ccc(SCCN3CCCCC3)cc2)C1	ZINC000592278364	459568375	/nfs/dbraw/zinc/56/83/75/459568375.db2.gz	PSUXZCUXHPKPMB-UHFFFAOYSA-N	0	3	344.484	3.252	20	30		EGEDHN
CC[C@H](N[C@H](C)c1ccc(C#N)cc1)C(=O)NCc1cccs1	ZINC000592396046	459591443	/nfs/dbraw/zinc/59/14/43/459591443.db2.gz	NMWFIPUFEYIOOH-DYVFJYSZSA-N	0	3	327.453	3.365	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCc2cccc(Cl)c2Cl)CC1	ZINC000592512571	459619654	/nfs/dbraw/zinc/61/96/54/459619654.db2.gz	LTPNDTGYPOVGIF-UHFFFAOYSA-N	0	3	342.270	3.443	20	30		EGEDHN
C[C@@]1(Cc2ccccc2F)CCCN1Cc1cnc2c(C#N)cnn2c1	ZINC000592525475	459625304	/nfs/dbraw/zinc/62/53/04/459625304.db2.gz	MLJXBKJDPJEHCM-FQEVSTJZSA-N	0	3	349.413	3.337	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC(C)(C)[C@@H]2c2ccccc2)CC1	ZINC000592526872	459626481	/nfs/dbraw/zinc/62/64/81/459626481.db2.gz	QKILVNJLEICRSP-SFHVURJKSA-N	0	3	327.472	3.430	20	30		EGEDHN
N#CCC[C@H](C#N)CNCC1(c2ccc3c(c2)OCCO3)CCCC1	ZINC000562862649	459661153	/nfs/dbraw/zinc/66/11/53/459661153.db2.gz	IZGANFGFAXCMIB-MRXNPFEDSA-N	0	3	339.439	3.303	20	30		EGEDHN
C=C[C@@H]1CCCCN1C(=O)N[C@H]1CCN(Cc2ccccc2)[C@H]1C	ZINC000573353861	459664183	/nfs/dbraw/zinc/66/41/83/459664183.db2.gz	FWXQWGIYPAUTKV-UHOSZYNNSA-N	0	3	327.472	3.400	20	30		EGEDHN
CC(C)N(C(=O)c1c[nH]c(C#N)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000592870039	459707299	/nfs/dbraw/zinc/70/72/99/459707299.db2.gz	CBQTXSKVTMNFQZ-IBGZPJMESA-N	0	3	336.439	3.011	20	30		EGEDHN
C=C(C)CN(CC)C(=O)NC[C@H](CC)N1CCc2ccccc2C1	ZINC000501388197	459725297	/nfs/dbraw/zinc/72/52/97/459725297.db2.gz	NTJNIVVUMOIKHI-IBGZPJMESA-N	0	3	329.488	3.431	20	30		EGEDHN
CN(C(=O)C(C[C@H]1CCCO1)C(F)(F)F)c1ccc(C#N)cc1F	ZINC000593051826	459755386	/nfs/dbraw/zinc/75/53/86/459755386.db2.gz	ONKSRSCYBOXOKG-NEPJUHHUSA-N	0	3	344.308	3.408	20	30		EGEDHN
N#Cc1cc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)ccc1F	ZINC000593050723	459755887	/nfs/dbraw/zinc/75/58/87/459755887.db2.gz	VIZBGSWGDVNOFH-NEPJUHHUSA-N	0	3	330.281	3.383	20	30		EGEDHN
CN(C(=O)C(C[C@@H]1CCCO1)C(F)(F)F)c1ccccc1C#N	ZINC000593095904	459771487	/nfs/dbraw/zinc/77/14/87/459771487.db2.gz	IUSOWFMTQMAIRR-QWHCGFSZSA-N	0	3	326.318	3.269	20	30		EGEDHN
C=CC[C@H](CC)NCc1cn(-c2ccccc2Br)nn1	ZINC000564414781	459773667	/nfs/dbraw/zinc/77/36/67/459773667.db2.gz	NHCZNYLLRGGMDO-LBPRGKRZSA-N	0	3	335.249	3.474	20	30		EGEDHN
C=CCCCCNCc1cn(-c2ccccc2Br)nn1	ZINC000564415291	459773819	/nfs/dbraw/zinc/77/38/19/459773819.db2.gz	OFJDQMBLAVEYPE-UHFFFAOYSA-N	0	3	335.249	3.476	20	30		EGEDHN
N#CCc1ccc(OC[C@H](O)CN[C@@H]2CCCc3ccccc32)cc1	ZINC000574107062	459779711	/nfs/dbraw/zinc/77/97/11/459779711.db2.gz	RPORWSHKAVHJRC-WIYYLYMNSA-N	0	3	336.435	3.160	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1N[C@H](C)c1ccc(S(=O)(=O)C2CCCC2)cc1	ZINC000584702685	459786140	/nfs/dbraw/zinc/78/61/40/459786140.db2.gz	WAZCHUBVGNMJCZ-ZMYBRWDISA-N	0	3	349.496	3.397	20	30		EGEDHN
N#Cc1ccc2c(c1)CCN2C(=O)C(C[C@@H]1CCCO1)C(F)(F)F	ZINC000593174242	459796457	/nfs/dbraw/zinc/79/64/57/459796457.db2.gz	UGYJXVYGLYULQJ-KBPBESRZSA-N	0	3	338.329	3.195	20	30		EGEDHN
N#Cc1cccc2c1CCN2C(=O)C(C[C@@H]1CCCO1)C(F)(F)F	ZINC000593175702	459797384	/nfs/dbraw/zinc/79/73/84/459797384.db2.gz	ZLQVBNLWMDITBT-GXTWGEPZSA-N	0	3	338.329	3.195	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H]2CC[C@H]2c2ccc(F)cc2)CC1	ZINC000528446607	459807474	/nfs/dbraw/zinc/80/74/74/459807474.db2.gz	BMGRTKJQLWWQPD-OALUTQOASA-N	0	3	330.447	3.476	20	30		EGEDHN
CN(C[C@H](O)CNc1ccc(Oc2cccc(C#N)c2)cc1)C1CC1	ZINC000566124136	459810586	/nfs/dbraw/zinc/81/05/86/459810586.db2.gz	DCSKXRSHMXTLCQ-GOSISDBHSA-N	0	3	337.423	3.218	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN2CCC[C@@]3(CCc4ccccc4O3)C2)cc1	ZINC000528737716	459813062	/nfs/dbraw/zinc/81/30/62/459813062.db2.gz	WSLQQNBGARFBSG-IFMALSPDSA-N	0	3	348.446	3.451	20	30		EGEDHN
CN(C)CCOc1cccc(NC(=O)CC2(C#N)CCCCC2)c1	ZINC000597025542	459820626	/nfs/dbraw/zinc/82/06/26/459820626.db2.gz	FFCXCCQGMYSATK-UHFFFAOYSA-N	0	3	329.444	3.430	20	30		EGEDHN
COCc1ccc(NC(=O)C[C@H](c2ccccc2)N(C)C)cc1C#N	ZINC000529815173	459850854	/nfs/dbraw/zinc/85/08/54/459850854.db2.gz	CSJYFEMRWGRHQG-LJQANCHMSA-N	0	3	337.423	3.336	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC(=O)Nc1c(Cl)cccc1Cl	ZINC000574761275	459868892	/nfs/dbraw/zinc/86/88/92/459868892.db2.gz	XRGNXBUODVEMKT-OLZOCXBDSA-N	0	3	329.227	3.255	20	30		EGEDHN
COc1cc(C#N)ccc1NC(=O)N1CCN(CCC(C)(C)C)CC1	ZINC000545998649	459884918	/nfs/dbraw/zinc/88/49/18/459884918.db2.gz	DBNBGUQKSFFTRY-UHFFFAOYSA-N	0	3	344.459	3.153	20	30		EGEDHN
Cc1cc(C)cc(N(CCC#N)C(=O)CN2CCC[C@@H]2C2CC2)c1	ZINC000609133569	459907672	/nfs/dbraw/zinc/90/76/72/459907672.db2.gz	IPASVWFCEVSTSE-LJQANCHMSA-N	0	3	325.456	3.425	20	30		EGEDHN
CC(C)[C@H]1CN(C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)CCN1	ZINC000598571138	459943217	/nfs/dbraw/zinc/94/32/17/459943217.db2.gz	GTEMPOIHFMPHKJ-HXUWFJFHSA-N	0	3	349.434	3.421	20	30		EGEDHN
CN(CCN(C)C1CC1)C(=O)c1c(Cl)cc(C#N)cc1Cl	ZINC000613838139	459947592	/nfs/dbraw/zinc/94/75/92/459947592.db2.gz	QLTYSJULBUZCEC-UHFFFAOYSA-N	0	3	326.227	3.031	20	30		EGEDHN
N#CCc1ccc(OC[C@@H](O)CN2CCCc3sccc3C2)cc1	ZINC000609338406	459948053	/nfs/dbraw/zinc/94/80/53/459948053.db2.gz	BEOCWPZNCIEPNH-KRWDZBQOSA-N	0	3	342.464	3.002	20	30		EGEDHN
COc1ccc([C@@H]2CCCN2C[C@@H](O)CC(C)(C)C#N)cc1OC	ZINC000598584575	459953280	/nfs/dbraw/zinc/95/32/80/459953280.db2.gz	OEWKHLUOHCWAQO-HOTGVXAUSA-N	0	3	332.444	3.141	20	30		EGEDHN
COc1ccc(OC)c([C@H]2CCCN2C[C@H](O)CC(C)(C)C#N)c1	ZINC000598587181	459954154	/nfs/dbraw/zinc/95/41/54/459954154.db2.gz	OMGGLCVDWYYOQQ-RHSMWYFYSA-N	0	3	332.444	3.141	20	30		EGEDHN
Cc1c([C@H](C)NC[C@H](O)CC(C)(C)C#N)cnn1-c1ccc(F)cc1	ZINC000598602073	459961061	/nfs/dbraw/zinc/96/10/61/459961061.db2.gz	KWDHRECJGYEKSN-SUMWQHHRSA-N	0	3	344.434	3.271	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN1CCCN(c2ccccc2Cl)CC1	ZINC000598616606	459965107	/nfs/dbraw/zinc/96/51/07/459965107.db2.gz	NIAHYGVWCYPAHW-OAHLLOKOSA-N	0	3	335.879	3.153	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN(Cc1ccccc1)[C@H]1COC(C)(C)C1	ZINC000598626032	459968386	/nfs/dbraw/zinc/96/83/86/459968386.db2.gz	XPKDTBDEBVRSNB-QZTJIDSGSA-N	0	3	330.472	3.357	20	30		EGEDHN
CCOc1cc(CCCNCc2cccc(C#N)n2)ccc1OC	ZINC000602554564	459996233	/nfs/dbraw/zinc/99/62/33/459996233.db2.gz	BEQZHGZFBBQNSX-UHFFFAOYSA-N	0	3	325.412	3.083	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CNCc1ccc(OC2CCCCC2)nc1	ZINC000598721462	460006561	/nfs/dbraw/zinc/00/65/61/460006561.db2.gz	VTIGBAPVZNSINO-MRXNPFEDSA-N	0	3	331.460	3.183	20	30		EGEDHN
N#Cc1ccc(NC(=O)N[C@@H]2CCCN3CCCC[C@@H]23)cc1Cl	ZINC000594058747	460079462	/nfs/dbraw/zinc/07/94/62/460079462.db2.gz	QTBZWLHUKVVIAM-CVEARBPZSA-N	0	3	332.835	3.350	20	30		EGEDHN
C[C@H](CNC(=O)N[C@H](C)c1cccc(C#N)c1)N1CCC[C@@H](C)C1	ZINC000610351889	460130962	/nfs/dbraw/zinc/13/09/62/460130962.db2.gz	OBLCHDLJNKWPTC-BZUAXINKSA-N	0	3	328.460	3.039	20	30		EGEDHN
C[C@H](CC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1)c1ccco1	ZINC000599089052	460157517	/nfs/dbraw/zinc/15/75/17/460157517.db2.gz	WROYPPHSHAFORI-MRXNPFEDSA-N	0	3	339.439	3.235	20	30		EGEDHN
N#Cc1ccc(CNC(=O)N[C@H]2CCCN3CCCC[C@@H]23)cc1Cl	ZINC000594247133	460170215	/nfs/dbraw/zinc/17/02/15/460170215.db2.gz	AIXDODANHCSPMY-IRXDYDNUSA-N	0	3	346.862	3.028	20	30		EGEDHN
C[C@@H]1CO[C@H](c2ccccc2Cl)CN1C(=O)[C@@H](N)CCCCC#N	ZINC000594433844	460218010	/nfs/dbraw/zinc/21/80/10/460218010.db2.gz	IBMJLPMEZXAOJW-COXVUDFISA-N	0	3	349.862	3.040	20	30		EGEDHN
C[C@H](NC[C@@H](O)COc1ccccc1C#N)c1cc2ccccc2o1	ZINC000599358405	460238877	/nfs/dbraw/zinc/23/88/77/460238877.db2.gz	HYKBALRELCWPKJ-WMLDXEAASA-N	0	3	336.391	3.395	20	30		EGEDHN
CC1(C)CN(Cc2ccc(-c3ccccc3C#N)cc2)CCN1CCO	ZINC000614923468	460246098	/nfs/dbraw/zinc/24/60/98/460246098.db2.gz	MXLHWQLWDLGWNG-UHFFFAOYSA-N	0	3	349.478	3.114	20	30		EGEDHN
C[C@@H]1CN(CCOc2cccc(C#N)c2)CC[C@H]1C(=O)OC(C)(C)C	ZINC000599586146	460281157	/nfs/dbraw/zinc/28/11/57/460281157.db2.gz	HBCCCKHAORSXOG-CRAIPNDOSA-N	0	3	344.455	3.237	20	30		EGEDHN
N#Cc1cc(Cl)c(C(=O)N[C@H]2CCN(CC3CC3)C2)c(Cl)c1	ZINC000611094769	460288110	/nfs/dbraw/zinc/28/81/10/460288110.db2.gz	XXPLXWPVLPFIQE-LBPRGKRZSA-N	0	3	338.238	3.079	20	30		EGEDHN
COc1cc(NC(=O)NC[C@H](C)N2CCCC[C@@H]2C)c(F)cc1C#N	ZINC000599818717	460340892	/nfs/dbraw/zinc/34/08/92/460340892.db2.gz	ZDWMLMWOOWRHKH-STQMWFEESA-N	0	3	348.422	3.090	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2NCc1ccc(Cn2cncn2)cc1	ZINC000611390507	460352464	/nfs/dbraw/zinc/35/24/64/460352464.db2.gz	FKFBVKLLHOLEGZ-NRFANRHFSA-N	0	3	343.434	3.365	20	30		EGEDHN
Cc1ccc(C(=O)NCCN[C@@H]2CCCc3cc(C#N)ccc32)cc1	ZINC000611391050	460352981	/nfs/dbraw/zinc/35/29/81/460352981.db2.gz	NXOYKOVQBOSOAX-HXUWFJFHSA-N	0	3	333.435	3.264	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2N[C@@H]1CCN(c2ccccc2F)C1=O	ZINC000611394138	460353221	/nfs/dbraw/zinc/35/32/21/460353221.db2.gz	LKYBNLPULNIGFC-RBUKOAKNSA-N	0	3	349.409	3.470	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2N[C@@H]1CCN(C(=O)C2CCCC2)C1	ZINC000611393771	460353775	/nfs/dbraw/zinc/35/37/75/460353775.db2.gz	WXMDCYVBRXLQNV-UYAOXDASSA-N	0	3	337.467	3.316	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2N[C@@H]1CC(=O)N(c2ccccc2)C1	ZINC000611391723	460354170	/nfs/dbraw/zinc/35/41/70/460354170.db2.gz	GFVGFAWSNPPLGU-XLIONFOSSA-N	0	3	331.419	3.331	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc3c(cnn3C(C)C)c2)CC1	ZINC000605041354	460531395	/nfs/dbraw/zinc/53/13/95/460531395.db2.gz	JEVBZLIZGQDKTB-UHFFFAOYSA-N	0	3	341.459	3.389	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@H]2CCCC[C@@H]2O)cc1OC	ZINC000623418239	460538270	/nfs/dbraw/zinc/53/82/70/460538270.db2.gz	ILMKVMIZKBCVAV-GJZGRUSLSA-N	0	3	325.836	3.307	20	30		EGEDHN
N#CC(C(=O)c1cccc(N2CCCC2)c1)c1nnc2n1CCCCC2	ZINC000659054235	461164359	/nfs/dbraw/zinc/16/43/59/461164359.db2.gz	XOHXMSRUMKTMLP-KRWDZBQOSA-N	0	3	349.438	3.095	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC23CC(c4ccccc4)(C2)C3)CC1	ZINC000641782544	461370938	/nfs/dbraw/zinc/37/09/38/461370938.db2.gz	DWOIHDCVIVFMCL-UHFFFAOYSA-N	0	3	339.483	3.200	20	30		EGEDHN
C=CCC[C@H]1NC(=O)N([C@@H](CN2CCCCC2)c2ccccc2)C1=O	ZINC000642927415	461580710	/nfs/dbraw/zinc/58/07/10/461580710.db2.gz	KUPGXVGITMRNQX-MSOLQXFVSA-N	0	3	341.455	3.100	20	30		EGEDHN
N#CC(C(=O)c1ccc2c(c1)CCC(=O)N2)c1nc(C2CC2)cs1	ZINC000647373884	461665355	/nfs/dbraw/zinc/66/53/55/461665355.db2.gz	QLFGGSBSBCBEGY-ZDUSSCGKSA-N	0	3	337.404	3.395	20	30		EGEDHN
C=C(CNC[C@@H](O)COc1ccc(OCC)cc1)c1ccccc1	ZINC000644647374	462021237	/nfs/dbraw/zinc/02/12/37/462021237.db2.gz	SJNHZWQVCZPWCC-GOSISDBHSA-N	0	3	327.424	3.128	20	30		EGEDHN
N#CC(C(=O)c1ccc2ccncc2c1)c1nnc2n1CCCCC2	ZINC000651268885	462161016	/nfs/dbraw/zinc/16/10/16/462161016.db2.gz	RWJQNDUDYCEYGO-MRXNPFEDSA-N	0	3	331.379	3.043	20	30		EGEDHN
C=CCN(CCC(=O)N[C@H]1CCCc2ccccc21)[C@H](C)COC	ZINC000661245395	462169053	/nfs/dbraw/zinc/16/90/53/462169053.db2.gz	ZZZFNFMSTYWNBN-APWZRJJASA-N	0	3	330.472	3.093	20	30		EGEDHN
C=CC[C@H]1N(C(=O)Nc2cnc3c(c2)CNCC3)CCCC1(C)C	ZINC000667804619	462270290	/nfs/dbraw/zinc/27/02/90/462270290.db2.gz	ICXHCMPZCUFHAL-QGZVFWFLSA-N	0	3	328.460	3.326	20	30		EGEDHN
C=C(C)CN(Cc1ccccc1)C(=O)Nc1cnc2c(c1)CNCC2	ZINC000667805120	462270521	/nfs/dbraw/zinc/27/05/21/462270521.db2.gz	YXQWSRPUTNXRRV-UHFFFAOYSA-N	0	3	336.439	3.338	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Nc1c(C)cnn1CC)C(C)C	ZINC000667821783	462278784	/nfs/dbraw/zinc/27/87/84/462278784.db2.gz	NSPIAVDRJFMXBJ-MRXNPFEDSA-N	0	3	333.480	3.032	20	30		EGEDHN
C=CCN(CC(=O)NCCc1ccc(OC(F)F)cc1)C(C)(C)C	ZINC000661755603	462399332	/nfs/dbraw/zinc/39/93/32/462399332.db2.gz	VPNCUWUOSFXTHG-UHFFFAOYSA-N	0	3	340.414	3.233	20	30		EGEDHN
C=CCN(CC(=O)NCCc1cccc2cccnc21)C(C)(C)C	ZINC000661760221	462400595	/nfs/dbraw/zinc/40/05/95/462400595.db2.gz	ODCWSTALKQMWPI-UHFFFAOYSA-N	0	3	325.456	3.180	20	30		EGEDHN
N#Cc1ccccc1NC(=O)CCN1CCC[C@@H](Nc2ccccc2)C1	ZINC000155053229	534817557	/nfs/dbraw/zinc/81/75/57/534817557.db2.gz	YAMOKQRMZKQHTG-LJQANCHMSA-N	0	3	348.450	3.463	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2c(C)onc2-c2ccccc2)CC1	ZINC000171723582	526446784	/nfs/dbraw/zinc/44/67/84/526446784.db2.gz	BMPXCPMJLKUPMI-UHFFFAOYSA-N	0	3	325.412	3.030	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(OCC(C)C)c(OC)c2)CC1	ZINC000171724841	526448485	/nfs/dbraw/zinc/44/84/85/526448485.db2.gz	VJNOPTHDWTVSEC-UHFFFAOYSA-N	0	3	346.471	3.110	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2csc(-c3ccccc3F)n2)CC1	ZINC000171714323	526449371	/nfs/dbraw/zinc/44/93/71/526449371.db2.gz	GTUSIWKSPSIXJF-UHFFFAOYSA-N	0	3	345.443	3.329	20	30		EGEDHN
N#CCc1ccc(OC[C@H](O)CN2CCC[C@@H]2c2cccs2)cc1	ZINC000025229117	526486498	/nfs/dbraw/zinc/48/64/98/526486498.db2.gz	HCZQTRLDYKKAFJ-SJLPKXTDSA-N	0	3	342.464	3.391	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(F)cc3cccnc32)CC1	ZINC000129665110	526599251	/nfs/dbraw/zinc/59/92/51/526599251.db2.gz	SHJRAXFURHJGTA-UHFFFAOYSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=CCOc1ccc(CNC[C@](C)(O)c2cc(C)oc2C)cc1OC	ZINC000174444271	526888191	/nfs/dbraw/zinc/88/81/91/526888191.db2.gz	RRBYALCAMRITPP-FQEVSTJZSA-N	0	3	345.439	3.467	20	30		EGEDHN
C=CCc1cc(CN2CCC(CC(=O)OCC)CC2)cc(OC)c1O	ZINC000159061788	527237021	/nfs/dbraw/zinc/23/70/21/527237021.db2.gz	VQWDASMDZJOMEV-UHFFFAOYSA-N	0	3	347.455	3.295	20	30		EGEDHN
CC#CCCN1CCC[C@@H](c2nnc3ccc(C(F)(F)F)cn32)C1	ZINC000156513901	546912511	/nfs/dbraw/zinc/91/25/11/546912511.db2.gz	BDTQGWZAPMYPQD-CYBMUJFWSA-N	0	3	336.361	3.341	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1coc(C2CCC2)n1)C(C)C	ZINC000683483920	550234176	/nfs/dbraw/zinc/23/41/76/550234176.db2.gz	IHNMMICWCGAHTC-KRWDZBQOSA-N	0	3	331.460	3.371	20	30		EGEDHN
C#Cc1cccc(NC(=S)N2CCC[C@@H]2CN2CCCCC2)c1	ZINC000727700140	574685706	/nfs/dbraw/zinc/68/57/06/574685706.db2.gz	HZPIOAMTGJROQP-GOSISDBHSA-N	0	3	327.497	3.315	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2nc(-c3cccs3)oc2C)CC1	ZINC000729976959	574900779	/nfs/dbraw/zinc/90/07/79/574900779.db2.gz	GIKROGAPITYUBW-UHFFFAOYSA-N	0	3	331.441	3.092	20	30		EGEDHN
C[C@H](CC(=O)C(C#N)C(=O)NC1CCCCC1)c1cccc(F)c1	ZINC000734964739	575582388	/nfs/dbraw/zinc/58/23/88/575582388.db2.gz	ZUXYGGYOINCEOO-CXAGYDPISA-N	0	3	330.403	3.477	20	30		EGEDHN
C=CC[C@@H](C)[NH2+]Cc1cccc(OCc2cccc(-c3nnn[n-]3)c2)c1	ZINC000735410208	575653525	/nfs/dbraw/zinc/65/35/25/575653525.db2.gz	XIKMRLAKHNIBPQ-OAHLLOKOSA-N	0	3	349.438	3.500	20	30		EGEDHN
C=CC[C@@H](C)[NH2+]Cc1cccc(OCc2cccc(-c3nn[n-]n3)c2)c1	ZINC000735410208	575653529	/nfs/dbraw/zinc/65/35/29/575653529.db2.gz	XIKMRLAKHNIBPQ-OAHLLOKOSA-N	0	3	349.438	3.500	20	30		EGEDHN
C#Cc1cccc(N(CC)C(=O)CC2(N3CCOCC3)CCCC2)c1	ZINC000736013054	575751284	/nfs/dbraw/zinc/75/12/84/575751284.db2.gz	OZQDLOXVIWBTGX-UHFFFAOYSA-N	0	3	340.467	3.056	20	30		EGEDHN
C#CCCN1CCC(NC(=O)[C@@H]2C[C@@H]2c2cccc(Cl)c2)CC1	ZINC000740736027	576621474	/nfs/dbraw/zinc/62/14/74/576621474.db2.gz	ASRNKIOIYBWFAA-QZTJIDSGSA-N	0	3	330.859	3.047	20	30		EGEDHN
C#CCCN1CCC(NC(=O)CCCOc2ccc(Cl)cc2)CC1	ZINC000740738160	576622081	/nfs/dbraw/zinc/62/20/81/576622081.db2.gz	WQXLRFRRLZVWFW-UHFFFAOYSA-N	0	3	348.874	3.103	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1nc(C)n2ccccc12)C(C)C	ZINC000741215948	576667187	/nfs/dbraw/zinc/66/71/87/576667187.db2.gz	OGEWMIQJTCEGIE-GOSISDBHSA-N	0	3	340.471	3.071	20	30		EGEDHN
C=CCn1c2ccccc2n(CN2CC[C@H](N3CC=CC3)C2)c1=S	ZINC000742162753	576753819	/nfs/dbraw/zinc/75/38/19/576753819.db2.gz	IWFJSNORPOAXDP-INIZCTEOSA-N	0	3	340.496	3.262	20	30		EGEDHN
C#CCOc1ccc(F)cc1NC(=O)N[C@H](C)CN1CCC[C@@H](C)C1	ZINC000743201955	576803347	/nfs/dbraw/zinc/80/33/47/576803347.db2.gz	SPRPNHVAGRDZMN-HUUCEWRRSA-N	0	3	347.434	3.080	20	30		EGEDHN
CC(N=Nc1ccccc1[N+](=O)[O-])c1cccc(OCCN(C)C)c1	ZINC000743525637	576811021	/nfs/dbraw/zinc/81/10/21/576811021.db2.gz	JMCSZHXDOOORAQ-UHFFFAOYSA-N	0	3	342.399	3.371	20	30		EGEDHN
C[C@@H](C(=O)C(C#N)C(=O)N1CCCC1)c1ccccc1C(F)(F)F	ZINC000744023435	576819037	/nfs/dbraw/zinc/81/90/37/576819037.db2.gz	JDYBQRJTTXIROA-YPMHNXCESA-N	0	3	338.329	3.140	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N[C@H]1CC[C@@H](SC)C1)C(C)C	ZINC000745537859	576849511	/nfs/dbraw/zinc/84/95/11/576849511.db2.gz	WEKFNVRLLDXPFN-GVDBMIGSSA-N	0	3	339.549	3.268	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1cccc(Cl)c1Br	ZINC000691634178	1298136733	/nfs/dbraw/zinc/13/67/33/1298136733.db2.gz	ZYPVRYBYMPAJRP-SECBINFHSA-N	0	3	330.613	3.062	20	30		EGEDHN
C=CCCCCN1CCN(c2cc(OC)c(OC)c(OC)c2)CC1	ZINC000828867580	1292509314	/nfs/dbraw/zinc/50/93/14/1292509314.db2.gz	DRLKDIWYIBPQBM-UHFFFAOYSA-N	0	3	334.460	3.191	20	30		EGEDHN
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)c1cnccc1C#N	ZINC000830969427	1292791620	/nfs/dbraw/zinc/79/16/20/1292791620.db2.gz	DXPQPWFWZRGRJM-LJQANCHMSA-N	0	3	348.450	3.080	20	30		EGEDHN
COc1ccccc1[C@@H](C)CC(=O)C(C#N)C(=O)NC1CCCCC1	ZINC000103329979	1293002027	/nfs/dbraw/zinc/00/20/27/1293002027.db2.gz	WXUXGZVCQMNYQP-YOEHRIQHSA-N	0	3	342.439	3.347	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)[C@H]1CC12CCSCC2	ZINC000835034978	1293191397	/nfs/dbraw/zinc/19/13/97/1293191397.db2.gz	DBZSHKPKHBENLM-QWHCGFSZSA-N	0	3	325.437	3.283	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN2CCN(CCc3ccccc3)CC2)cc1	ZINC000122314305	1293408268	/nfs/dbraw/zinc/40/82/68/1293408268.db2.gz	CHSUMVDPXYSTJD-LJQANCHMSA-N	0	3	349.478	3.338	20	30		EGEDHN
Cc1ccc(SCCC(=O)C(C#N)C(=O)N2CCCC2)cc1C	ZINC000124734425	1293483672	/nfs/dbraw/zinc/48/36/72/1293483672.db2.gz	ZLFXYQAFVKCDBE-MRXNPFEDSA-N	0	3	330.453	3.117	20	30		EGEDHN
N#CC(C(=O)Nc1ccccn1)=C([O-])c1cc(Cl)cc(Cl)c1	ZINC000126427556	1293534914	/nfs/dbraw/zinc/53/49/14/1293534914.db2.gz	GFXZSYRKVMPPSS-LBPRGKRZSA-N	0	3	334.162	3.350	20	30		EGEDHN
N#CC(C(=O)Nc1ccccn1)C(=O)c1cc(Cl)cc(Cl)c1	ZINC000126427556	1293534916	/nfs/dbraw/zinc/53/49/16/1293534916.db2.gz	GFXZSYRKVMPPSS-LBPRGKRZSA-N	0	3	334.162	3.350	20	30		EGEDHN
COCCCC(=O)C(C#N)C(=O)Nc1ccc(SC(F)F)cc1	ZINC000126609542	1293539842	/nfs/dbraw/zinc/53/98/42/1293539842.db2.gz	HEEULBJBOCSWDT-LBPRGKRZSA-N	0	3	342.367	3.075	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)c1ccc(C)s1	ZINC000128900025	1293606789	/nfs/dbraw/zinc/60/67/89/1293606789.db2.gz	XXJMKPIMKTZDTQ-LBPRGKRZSA-N	0	3	328.393	3.416	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(Cl)cc1Cl)C(=O)C1CCOCC1	ZINC000129670200	1293630159	/nfs/dbraw/zinc/63/01/59/1293630159.db2.gz	UZXQOFPBAGOXOH-LLVKDONJSA-N	0	3	341.194	3.067	20	30		EGEDHN
CCCCc1ccc(C(=O)CCC(=O)C(C#N)C(=O)NC(C)C)cc1	ZINC000131066599	1293677750	/nfs/dbraw/zinc/67/77/50/1293677750.db2.gz	JDQFDRJRVSVTTB-QGZVFWFLSA-N	0	3	342.439	3.226	20	30		EGEDHN
CN(C)CCN(C(=O)Nc1ccc(F)cc1OCC#N)C1CCCC1	ZINC000135308063	1293792296	/nfs/dbraw/zinc/79/22/96/1293792296.db2.gz	NOJHGASOXGVYJC-UHFFFAOYSA-N	0	3	348.422	3.066	20	30		EGEDHN
Cc1ccc([C@@H]2C[C@H]2C(=O)C(C#N)C(=O)Nc2ccccn2)cc1C	ZINC000138829813	1293838726	/nfs/dbraw/zinc/83/87/26/1293838726.db2.gz	WDVRDRVHAHROGS-GVDBMIGSSA-N	0	3	333.391	3.150	20	30		EGEDHN
C[C@H](CC(=O)C(C#N)C(=O)NC1CCCC1)c1ccc(F)cc1F	ZINC000152459441	1293969788	/nfs/dbraw/zinc/96/97/88/1293969788.db2.gz	AFYDQVORIIKACR-ABAIWWIYSA-N	0	3	334.366	3.226	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)C(=O)NC1CCCC1)c1ccc(F)cc1F	ZINC000152459214	1293969921	/nfs/dbraw/zinc/96/99/21/1293969921.db2.gz	AFYDQVORIIKACR-XHDPSFHLSA-N	0	3	334.366	3.226	20	30		EGEDHN
C[C@@H](Cc1ccccc1Cl)C(=O)C(C#N)C(=O)NC1CCCC1	ZINC000155179041	1294087643	/nfs/dbraw/zinc/08/76/43/1294087643.db2.gz	RNGDTGXYLBATGF-SWLSCSKDSA-N	0	3	332.831	3.286	20	30		EGEDHN
C[C@@H](OC1CCCCCC1)C(=O)C(C#N)C(=O)Nc1ccccc1	ZINC000162418869	1294314241	/nfs/dbraw/zinc/31/42/41/1294314241.db2.gz	KXWOERJDYZDZKA-RHSMWYFYSA-N	0	3	328.412	3.462	20	30		EGEDHN
C#CCCCOC(=O)C1CCN(c2cc(Cl)ccc2Cl)C1=O	ZINC000170711095	1294378362	/nfs/dbraw/zinc/37/83/62/1294378362.db2.gz	OSAVKZSQVAYTPJ-GFCCVEGCSA-N	0	3	340.206	3.303	20	30		EGEDHN
C#CCOc1ccccc1CN1CC[C@@H](CNC(=O)OC(C)(C)C)C1	ZINC000179740502	1294821224	/nfs/dbraw/zinc/82/12/24/1294821224.db2.gz	FRKLKTOAALLPDJ-INIZCTEOSA-N	0	3	344.455	3.045	20	30		EGEDHN
CC[C@@H](NCC(=O)N(CCC#N)c1ccc(C)c(C)c1)[C@H]1CCCO1	ZINC000182241748	1295029866	/nfs/dbraw/zinc/02/98/66/1295029866.db2.gz	KYAQHXPJBSGOFP-RTBURBONSA-N	0	3	343.471	3.097	20	30		EGEDHN
N#CC(C(=O)CCCOC1CCOCC1)c1ccc2ccccc2n1	ZINC000870123345	1295679208	/nfs/dbraw/zinc/67/92/08/1295679208.db2.gz	QJMLJNKZYFSBDA-KRWDZBQOSA-N	0	3	338.407	3.387	20	30		EGEDHN
CO[C@@H](C)CC(=O)C(C#N)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000195492373	1296072958	/nfs/dbraw/zinc/07/29/58/1296072958.db2.gz	ZFBOOURVDAZXRY-UFBFGSQYSA-N	0	3	329.183	3.066	20	30		EGEDHN
C#CCOc1ccc(Br)cc1CN[C@H]1CCSC1	ZINC000225515778	1296137370	/nfs/dbraw/zinc/13/73/70/1296137370.db2.gz	IGSRUKNQMPFCAA-ZDUSSCGKSA-N	0	3	326.259	3.056	20	30		EGEDHN
C#Cc1cccc(NC(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)c1	ZINC000248705426	1296425711	/nfs/dbraw/zinc/42/57/11/1296425711.db2.gz	ASNQIWSFOXJUHA-OXQOHEQNSA-N	0	3	333.435	3.310	20	30		EGEDHN
[NH2+]=C(NCc1ccc([O-])c(F)c1)Nc1ccc(OC(F)(F)F)cc1	ZINC000304755579	1296941067	/nfs/dbraw/zinc/94/10/67/1296941067.db2.gz	MWCWKWOTNYHJMF-UHFFFAOYSA-N	0	3	343.280	3.357	20	30		EGEDHN
CC[C@H](C)N1CCN(Cc2ccc(Br)cc2C#N)CC1	ZINC000312261009	1297115409	/nfs/dbraw/zinc/11/54/09/1297115409.db2.gz	HCFIALAWIXGQLG-ZDUSSCGKSA-N	0	3	336.277	3.237	20	30		EGEDHN
Cn1c(=O)cc(C(=O)C(C#N)c2nc3ccccc3o2)c2ccccc21	ZINC000340037404	1297308996	/nfs/dbraw/zinc/30/89/96/1297308996.db2.gz	JOOXAECSHOZTRW-AWEZNQCLSA-N	0	3	343.342	3.170	20	30		EGEDHN
C=C[C@H](COC)N[C@@H](C)c1ccc(I)cc1	ZINC000390507294	1297627377	/nfs/dbraw/zinc/62/73/77/1297627377.db2.gz	XTASAPYJYRNCSB-GXFFZTMASA-N	0	3	331.197	3.143	20	30		EGEDHN
CCc1nc(C#N)cc(N2C[C@H](C)N(Cc3ccccc3)[C@@H](C)[C@H]2C)n1	ZINC000404423344	1297754207	/nfs/dbraw/zinc/75/42/07/1297754207.db2.gz	JWIOHBUPBFLANL-YESZJQIVSA-N	0	3	349.482	3.398	20	30		EGEDHN
CC[C@](C)(C#N)C(=O)N(C)C[C@H]1CCCCN1Cc1ccccc1	ZINC000719963902	1298324901	/nfs/dbraw/zinc/32/49/01/1298324901.db2.gz	VICIZUGSBZCYHF-UYAOXDASSA-N	0	3	327.472	3.439	20	30		EGEDHN
CN(CC(=O)C(C#N)c1nc2ccccc2s1)Cc1nccs1	ZINC000746668700	1298637374	/nfs/dbraw/zinc/63/73/74/1298637374.db2.gz	AJQKBZOXBXOIEX-NSHDSACASA-N	0	3	342.449	3.061	20	30		EGEDHN
C=C(Cl)C[C@H](N)C(=O)N(C)Cc1ccccc1OC(F)(F)F	ZINC000876575018	1298840746	/nfs/dbraw/zinc/84/07/46/1298840746.db2.gz	RODUHDLXLYYOKM-NSHDSACASA-N	0	3	336.741	3.014	20	30		EGEDHN
C=C(Cl)C[C@@H](N)C(=O)N1CCC(C(=O)c2ccc(C)cc2C)CC1	ZINC000876602086	1298858719	/nfs/dbraw/zinc/85/87/19/1298858719.db2.gz	GWAXBEYDOYNAQN-QGZVFWFLSA-N	0	3	348.874	3.195	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2c(-c3ccccc3)ncn2C2CC2)CC1	ZINC000749599937	1299243485	/nfs/dbraw/zinc/24/34/85/1299243485.db2.gz	FUQLWURRXKTLIL-UHFFFAOYSA-N	0	3	348.450	3.169	20	30		EGEDHN
CC(=O)[C@@](C#N)(CCN1CCCC2(CCOCC2)C1)c1ccccc1	ZINC000878132365	1299767535	/nfs/dbraw/zinc/76/75/35/1299767535.db2.gz	SSCWHFXWFFVNKY-NRFANRHFSA-N	0	3	340.467	3.320	20	30		EGEDHN
C[C@H]1CC(N=Nc2ncnc3sc4c(c32)CCC4)CN1C1CC1	ZINC000753955640	1300053317	/nfs/dbraw/zinc/05/33/17/1300053317.db2.gz	RUEUWBXZWKHDFY-JTQLQIEISA-N	0	3	327.457	3.205	20	30		EGEDHN
C#CC[C@H](CO)NCc1ccc(OCc2ccccc2)c(OCC)c1	ZINC000883122885	1302260853	/nfs/dbraw/zinc/26/08/53/1302260853.db2.gz	CWKKUXUTECCIQA-LJQANCHMSA-N	0	3	339.435	3.138	20	30		EGEDHN
N#CC(C(=O)CCc1cncc2ccccc21)C(=O)NC1CCCCC1	ZINC000765589137	1302285620	/nfs/dbraw/zinc/28/56/20/1302285620.db2.gz	VZBQSLNLROLZAF-LJQANCHMSA-N	0	3	349.434	3.325	20	30		EGEDHN
CC(C)c1nc2cc(NC(=O)C3CC4(C3)CNC[C@@H]4C#N)ccc2o1	ZINC000884083693	1302725183	/nfs/dbraw/zinc/72/51/83/1302725183.db2.gz	WHZNDCXLAPSZLT-MLZJXEJWSA-N	0	3	338.411	3.029	20	30		EGEDHN
C=CCNC(=O)[C@H](C)N1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1	ZINC000767875135	1302775659	/nfs/dbraw/zinc/77/56/59/1302775659.db2.gz	JSBKLYODOPCCMP-GXTWGEPZSA-N	0	3	326.362	3.185	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)Cc1cc2c(cc1O)OC[C@H]2O	ZINC000768442819	1302904987	/nfs/dbraw/zinc/90/49/87/1302904987.db2.gz	OAMZQKMLBNZWAV-LJQANCHMSA-N	0	3	341.407	3.015	20	30		EGEDHN
C=CC[N@@H+](Cc1ccc(OC)cc1)Cc1cc2c(cc1[O-])OC[C@H]2O	ZINC000768442819	1302904993	/nfs/dbraw/zinc/90/49/93/1302904993.db2.gz	OAMZQKMLBNZWAV-LJQANCHMSA-N	0	3	341.407	3.015	20	30		EGEDHN
C=CC[N@H+](Cc1ccc(OC)cc1)Cc1cc2c(cc1[O-])OC[C@H]2O	ZINC000768442819	1302905002	/nfs/dbraw/zinc/90/50/02/1302905002.db2.gz	OAMZQKMLBNZWAV-LJQANCHMSA-N	0	3	341.407	3.015	20	30		EGEDHN
C#CCOc1ccccc1CN1CCC[C@H](C(=O)N[C@@H](C)CCC)C1	ZINC000769212497	1303071729	/nfs/dbraw/zinc/07/17/29/1303071729.db2.gz	KBVBJCSZKIPOHP-HKUYNNGSSA-N	0	3	342.483	3.215	20	30		EGEDHN
CN(CCCCC(C)(C)C#N)[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000769799481	1303175745	/nfs/dbraw/zinc/17/57/45/1303175745.db2.gz	GMGDTPJGNOVZOV-GOSISDBHSA-N	0	3	327.472	3.439	20	30		EGEDHN
N#CC(CCN1C[C@H]2C[C@@]2(CO)C1)(c1ccccc1)c1ccccc1	ZINC000769802909	1303177282	/nfs/dbraw/zinc/17/72/82/1303177282.db2.gz	XFXZPMVQCUWNSL-RTWAWAEBSA-N	0	3	332.447	3.201	20	30		EGEDHN
CC1(OCC(=O)C(C#N)C(=O)Nc2ccc(F)c(Cl)c2)CCC1	ZINC000772970148	1303599265	/nfs/dbraw/zinc/59/92/65/1303599265.db2.gz	ASYMJZGSWGUAMM-LLVKDONJSA-N	0	3	338.766	3.086	20	30		EGEDHN
C[C@@H](N[C@@H](C)c1ccc(N(C)C)cc1)C(=O)Nc1cccc(C#N)c1	ZINC000774478538	1303815343	/nfs/dbraw/zinc/81/53/43/1303815343.db2.gz	GXLZZLKIHOEEDP-LSDHHAIUSA-N	0	3	336.439	3.302	20	30		EGEDHN
C#C[C@H](N[C@H](C)CC(=O)Nc1ccc(C)c(Cl)c1)[C@@H]1CCCO1	ZINC000775573685	1303987446	/nfs/dbraw/zinc/98/74/46/1303987446.db2.gz	JBNLBDPHCWHTEK-COXVUDFISA-N	0	3	334.847	3.136	20	30		EGEDHN
C#C[C@@H](NCc1c(-c2ccccc2)nc2ccccn21)[C@H]1CCCO1	ZINC000775791617	1304038369	/nfs/dbraw/zinc/03/83/69/1304038369.db2.gz	WGMXGYXEOUUMDS-IEBWSBKVSA-N	0	3	331.419	3.272	20	30		EGEDHN
N#C[C@@H](OC(=O)C1CCN(c2ccc(F)cc2)C1=O)C1CCCCC1	ZINC000776378036	1304144311	/nfs/dbraw/zinc/14/43/11/1304144311.db2.gz	HYCSMEYRDPWMPK-IAGOWNOFSA-N	0	3	344.386	3.194	20	30		EGEDHN
CC(C)Cn1ccc(C([O-])=C(C#N)C(=O)Nc2ccccc2Cl)n1	ZINC000892488988	1305401270	/nfs/dbraw/zinc/40/12/70/1305401270.db2.gz	BPBUWNAMFGWUIW-LBPRGKRZSA-N	0	3	344.802	3.154	20	30		EGEDHN
CC(C)Cn1ccc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)n1	ZINC000892488988	1305401275	/nfs/dbraw/zinc/40/12/75/1305401275.db2.gz	BPBUWNAMFGWUIW-LBPRGKRZSA-N	0	3	344.802	3.154	20	30		EGEDHN
CS[C@@H](C)CCC(=O)C(C#N)C(=O)NCc1cccc(Cl)c1	ZINC000786531293	1305591109	/nfs/dbraw/zinc/59/11/09/1305591109.db2.gz	OEBCLTLJFHHPBV-SMDDNHRTSA-N	0	3	338.860	3.197	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CC1N=Nc1ccc2c(cc[nH]c2=O)c1	ZINC000789070156	1306082153	/nfs/dbraw/zinc/08/21/53/1306082153.db2.gz	GGUPTQYBURQBJD-OAHLLOKOSA-N	0	3	346.434	3.448	20	30		EGEDHN
CCOC(=O)c1[nH]c2ccc(C)cc2c1CN[C@@H]1CC[C@H](C#N)C1	ZINC000895053799	1309171031	/nfs/dbraw/zinc/17/10/31/1309171031.db2.gz	WESZBQJJKGTPIS-UONOGXRCSA-N	0	3	325.412	3.435	20	30		EGEDHN
CC(C)CN(CCC#N)C[C@@H]1CN(Cc2ccccc2)CCCO1	ZINC000792868303	1309247185	/nfs/dbraw/zinc/24/71/85/1309247185.db2.gz	SWJJLKIHRRCRFN-HXUWFJFHSA-N	0	3	329.488	3.149	20	30		EGEDHN
CC(C)OC(=O)C1CCN(Cc2ccc(N(C)CCC#N)cc2)CC1	ZINC000895828353	1309542610	/nfs/dbraw/zinc/54/26/10/1309542610.db2.gz	HQLPXAWKAINAKL-UHFFFAOYSA-N	0	3	343.471	3.200	20	30		EGEDHN
C=CCC1(O)CCN(Cc2cn(-c3cccc(C)c3)nc2C)CC1	ZINC000895834425	1309546014	/nfs/dbraw/zinc/54/60/14/1309546014.db2.gz	KSKLOZZWDDCHAI-UHFFFAOYSA-N	0	3	325.456	3.392	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CNCc2ccc(C[S@@](C)=O)cc2)cc1	ZINC000796525429	1310021090	/nfs/dbraw/zinc/02/10/90/1310021090.db2.gz	CPMWDDHCEJJBCE-IZHWHUGBSA-N	0	3	342.464	3.146	20	30		EGEDHN
N#CC(C(=O)CCSCc1ccccc1)C(=O)Nc1ccccn1	ZINC000796656421	1310057734	/nfs/dbraw/zinc/05/77/34/1310057734.db2.gz	WEBPAIQFHLJFLO-OAHLLOKOSA-N	0	3	339.420	3.052	20	30		EGEDHN
CC(=O)N[C@H](CC1CCC1)C(=O)C(C#N)c1ncc(C(C)(C)C)s1	ZINC000797566987	1310212303	/nfs/dbraw/zinc/21/23/03/1310212303.db2.gz	CGDMMWNKHSBCCY-ZIAGYGMSSA-N	0	3	347.484	3.312	20	30		EGEDHN
N#Cc1ccc(NCCNCc2ccccc2OC(F)(F)F)nc1	ZINC000897398381	1310320350	/nfs/dbraw/zinc/32/03/50/1310320350.db2.gz	CFDNWJJJAKBCHD-UHFFFAOYSA-N	0	3	336.317	3.054	20	30		EGEDHN
C[C@@H]1C[C@H](C)[C@H](C(=O)C(C#N)C(=O)Nc2cccc3ccccc32)O1	ZINC000800384925	1310747283	/nfs/dbraw/zinc/74/72/83/1310747283.db2.gz	NGEPXWXBVUPQQG-LTGQISBOSA-N	0	3	336.391	3.301	20	30		EGEDHN
Cc1cccc(CNC(=O)C(C#N)C(=O)[C@@H]2CCCC(F)(F)C2)c1	ZINC000800409209	1310749935	/nfs/dbraw/zinc/74/99/35/1310749935.db2.gz	KEELYUYVEMUWSL-HUUCEWRRSA-N	0	3	334.366	3.146	20	30		EGEDHN
N=C(N)NN=Cc1c(Cl)cccc1OCc1ccccc1Cl	ZINC000917545845	1319832363	/nfs/dbraw/zinc/83/23/63/1319832363.db2.gz	KDQUMYAESNIZFG-UHFFFAOYSA-N	0	3	337.210	3.389	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CC[C@@H](n2cc(C3CC3)nn2)C1	ZINC000826679155	1320397520	/nfs/dbraw/zinc/39/75/20/1320397520.db2.gz	FCGDTBZSUOARID-QGZVFWFLSA-N	0	3	335.455	3.404	20	30		EGEDHN
C#Cc1cccc(CNC(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)c1	ZINC000836249312	1320464404	/nfs/dbraw/zinc/46/44/04/1320464404.db2.gz	IUHVWVCRWUMTJJ-DYESRHJHSA-N	0	3	347.462	3.303	20	30		EGEDHN
C#Cc1cccc(CNC(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)c1	ZINC000836249330	1320464420	/nfs/dbraw/zinc/46/44/20/1320464420.db2.gz	IUHVWVCRWUMTJJ-UWJYYQICSA-N	0	3	347.462	3.303	20	30		EGEDHN
Cc1cc(C)nc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)c1	ZINC000802043270	1316975533	/nfs/dbraw/zinc/97/55/33/1316975533.db2.gz	VNRWZCMWPYQRAA-GFCCVEGCSA-N	0	3	327.771	3.313	20	30		EGEDHN
CC(C)(C)C(C)(C)C(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001019235978	1317116064	/nfs/dbraw/zinc/11/60/64/1317116064.db2.gz	VZJRJQPYNQSSKM-INIZCTEOSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](NCc2ccccc2OC2CC2)C1	ZINC001019238370	1317117402	/nfs/dbraw/zinc/11/74/02/1317117402.db2.gz	YSFGPODNDGQXJX-INIZCTEOSA-N	0	3	328.456	3.131	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H]1C(=O)N1CC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001019407728	1317222295	/nfs/dbraw/zinc/22/22/95/1317222295.db2.gz	RSQLMLINZCMXDP-BPQIPLTHSA-N	0	3	343.446	3.070	20	30		EGEDHN
C#CCCCNC(=O)NC[C@H](c1ccc(Cl)cc1)N(C)CCC	ZINC000805160639	1317321188	/nfs/dbraw/zinc/32/11/88/1317321188.db2.gz	CDXJCNWMTXFJDI-QGZVFWFLSA-N	0	3	335.879	3.436	20	30		EGEDHN
C#CCCCNC(=O)NC[C@@H](c1ccc(Cl)cc1)N(C)CCC	ZINC000805160638	1317321287	/nfs/dbraw/zinc/32/12/87/1317321287.db2.gz	CDXJCNWMTXFJDI-KRWDZBQOSA-N	0	3	335.879	3.436	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC2(CCN(C/C(Cl)=C/Cl)CC2)CC1	ZINC000957520090	1317421389	/nfs/dbraw/zinc/42/13/89/1317421389.db2.gz	NXENMCVEYAYKMH-ODUNQGDFSA-N	0	3	344.286	3.170	20	30		EGEDHN
CCCNC(=O)OC[C@H]1CCCCN1Cc1ccc(CC#N)cc1	ZINC000805772162	1317421597	/nfs/dbraw/zinc/42/15/97/1317421597.db2.gz	CLAOSYQGXXIIPK-GOSISDBHSA-N	0	3	329.444	3.243	20	30		EGEDHN
CCN(Cc1ccccc1C#N)CC1CCN(C(=O)C2(C)CC2)CC1	ZINC000957718686	1317587516	/nfs/dbraw/zinc/58/75/16/1317587516.db2.gz	RWWLFAYXDNMYOQ-UHFFFAOYSA-N	0	3	339.483	3.419	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC(CN(CC)Cc2cnc(C)o2)CC1	ZINC000957737321	1317601809	/nfs/dbraw/zinc/60/18/09/1317601809.db2.gz	AQURPQRISMHHFR-UHFFFAOYSA-N	0	3	333.476	3.256	20	30		EGEDHN
CC[C@@H](N[C@H]1CCN(Cc2ccccc2)C1=O)c1cccc(C#N)c1	ZINC000902853078	1317624110	/nfs/dbraw/zinc/62/41/10/1317624110.db2.gz	JBXCYARCSREIIV-UXHICEINSA-N	0	3	333.435	3.400	20	30		EGEDHN
CC[C@@H](N[C@@H]1CCCN(CC(F)(F)F)C1=O)c1cccc(C#N)c1	ZINC000902882158	1317627378	/nfs/dbraw/zinc/62/73/78/1317627378.db2.gz	PGRJPDRZVMKRQP-HUUCEWRRSA-N	0	3	339.361	3.152	20	30		EGEDHN
C#C[C@H](NC(=O)N[C@@H](CN1CCCC1)c1ccccc1)C(C)(C)C	ZINC000808213921	1317645447	/nfs/dbraw/zinc/64/54/47/1317645447.db2.gz	SSXYEUJISXECPS-ROUUACIJSA-N	0	3	327.472	3.171	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@H](NCc3cccc(Cl)n3)C2)CC1	ZINC001020544004	1317756831	/nfs/dbraw/zinc/75/68/31/1317756831.db2.gz	FLKMXCZPVNQYGV-WKILWMFISA-N	0	3	333.863	3.218	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)c2cc(Cl)cs2)C1	ZINC001020669107	1317845838	/nfs/dbraw/zinc/84/58/38/1317845838.db2.gz	NGJLHICZBJLDGX-MGCOHNPYSA-N	0	3	349.681	3.161	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@H](CN1CCCC1)c1ccccc1	ZINC000810056432	1317944281	/nfs/dbraw/zinc/94/42/81/1317944281.db2.gz	QEDVEPCAXWQBJM-OAQYLSRUSA-N	0	3	332.447	3.164	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@@H](CN1CCCC1)c1ccccc1	ZINC000810056431	1317944631	/nfs/dbraw/zinc/94/46/31/1317944631.db2.gz	QEDVEPCAXWQBJM-NRFANRHFSA-N	0	3	332.447	3.164	20	30		EGEDHN
CC(C)[C@@]1(C)C[C@H]1C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001020859654	1317968001	/nfs/dbraw/zinc/96/80/01/1317968001.db2.gz	CTJPMWKTAHKTSH-OGNFBWPZSA-N	0	3	343.446	3.116	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@H](NC(=O)[C@H]3CC34CCCC4)C2)c1	ZINC001020883979	1317983945	/nfs/dbraw/zinc/98/39/45/1317983945.db2.gz	XAXMMMVFASFQCD-BRWVUGGUSA-N	0	3	341.430	3.014	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)c2cccc(C#N)n2)cc1	ZINC000810532635	1318019011	/nfs/dbraw/zinc/01/90/11/1318019011.db2.gz	VJXSWCHEYQFQOP-QGZVFWFLSA-N	0	3	346.390	3.257	20	30		EGEDHN
C=CCn1cccc1C(=O)NC1C[C@H]2CC[C@@H](C1)N2C/C=C/Cl	ZINC001021281602	1318170578	/nfs/dbraw/zinc/17/05/78/1318170578.db2.gz	KRIKRCYYARGBBW-MLHWCBFKSA-N	0	3	333.863	3.152	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCCC[C@H]1CNCc1ccc(Cl)cc1F	ZINC000959923126	1318267230	/nfs/dbraw/zinc/26/72/30/1318267230.db2.gz	GAIICBZLEDPKGP-DOMZBBRYSA-N	0	3	337.826	3.109	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)/C=C\C2CC2)s1	ZINC000959937289	1318275045	/nfs/dbraw/zinc/27/50/45/1318275045.db2.gz	MLXQXAHWLRSXLI-AJHXJQRKSA-N	0	3	329.469	3.057	20	30		EGEDHN
C[C@H](C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)cc1F)C1CC1	ZINC000959945758	1318279538	/nfs/dbraw/zinc/27/95/38/1318279538.db2.gz	ZMGPPUFTBHQUNV-KSSFIOAISA-N	0	3	343.446	3.214	20	30		EGEDHN
C#C[C@H](NC(=O)NC[C@H]1CCCCN1C1CC1)c1ccc(Cl)cc1	ZINC000811911465	1318289282	/nfs/dbraw/zinc/28/92/82/1318289282.db2.gz	PPOKIJDYWXKERK-MSOLQXFVSA-N	0	3	345.874	3.330	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@@H](CCCN3C(=O)C3CCC3)C2)c1	ZINC001021493728	1318295565	/nfs/dbraw/zinc/29/55/65/1318295565.db2.gz	VPQDQFZGLLNOEV-VQTJNVASSA-N	0	3	337.467	3.171	20	30		EGEDHN
CC(C)(F)C(=O)N1CCC[C@@H]2CN(Cc3ccc(C#N)cc3)CC[C@@H]21	ZINC001021497469	1318305177	/nfs/dbraw/zinc/30/51/77/1318305177.db2.gz	XXTBREMNRRFMPG-MSOLQXFVSA-N	0	3	343.446	3.119	20	30		EGEDHN
C[C@H](NC[C@@H]1CCCCN1C(=O)C#CC1CC1)c1cc(F)ccc1F	ZINC000960005905	1318309134	/nfs/dbraw/zinc/30/91/34/1318309134.db2.gz	FSGAJDROBMMUPZ-YOEHRIQHSA-N	0	3	346.421	3.410	20	30		EGEDHN
C=C(C)CC[N@@H+]1CC[C@H]2[C@H](CCCN2C(=O)c2ccccc2[O-])C1	ZINC001021529286	1318366417	/nfs/dbraw/zinc/36/64/17/1318366417.db2.gz	LYVXGBRTQRWYAJ-AEFFLSMTSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=C(C)CC[N@H+]1CC[C@H]2[C@H](CCCN2C(=O)c2ccccc2[O-])C1	ZINC001021529286	1318366424	/nfs/dbraw/zinc/36/64/24/1318366424.db2.gz	LYVXGBRTQRWYAJ-AEFFLSMTSA-N	0	3	328.456	3.285	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC000960143185	1318378198	/nfs/dbraw/zinc/37/81/98/1318378198.db2.gz	JAFRHMYBDLFDBU-BPQIPLTHSA-N	0	3	343.446	3.214	20	30		EGEDHN
C#C[C@H](NC(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C)C(C)C	ZINC000812380302	1318379436	/nfs/dbraw/zinc/37/94/36/1318379436.db2.gz	BUKQDIYXLNEKBZ-OALUTQOASA-N	0	3	345.487	3.034	20	30		EGEDHN
COc1cccc([C@@H](C/N=C\c2c(O)cccc2OC)N(C)C)c1	ZINC000812396611	1318382221	/nfs/dbraw/zinc/38/22/21/1318382221.db2.gz	WYWKUWAXNBSPHW-SYERDGIWSA-N	0	3	328.412	3.131	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC[C@@H]2CN(Cc3ccc(C#N)cc3)CC[C@@H]21	ZINC001021554641	1318399174	/nfs/dbraw/zinc/39/91/74/1318399174.db2.gz	ODIYTTWHZZIBHA-QZKCSFHISA-N	0	3	337.467	3.337	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@H]2CN(Cc3cccc(F)c3)CC[C@@H]21	ZINC001021582132	1318425471	/nfs/dbraw/zinc/42/54/71/1318425471.db2.gz	TYECKOUDLODHFK-ICSRJNTNSA-N	0	3	340.442	3.052	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@@H]2CN(C/C=C/c3ccccc3)CC[C@H]21	ZINC001021586068	1318429495	/nfs/dbraw/zinc/42/94/95/1318429495.db2.gz	YSOXKXRRMKIOKU-DOTZPFNOSA-N	0	3	348.490	3.426	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@@H]2CN(C/C=C\c3ccccc3)CC[C@@H]21	ZINC001021586073	1318429982	/nfs/dbraw/zinc/42/99/82/1318429982.db2.gz	YSOXKXRRMKIOKU-SYGLWNPSSA-N	0	3	348.490	3.426	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2scc(C)c2Cl)C1	ZINC001021586717	1318430797	/nfs/dbraw/zinc/43/07/97/1318430797.db2.gz	DARUGVZTAHLGIA-KGLIPLIRSA-N	0	3	336.888	3.270	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2nc(C(C)C)oc2C)C1	ZINC001021587328	1318430833	/nfs/dbraw/zinc/43/08/33/1318430833.db2.gz	JNIDGKRVPRMKMC-DLBZAZTESA-N	0	3	343.471	3.056	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cccc(OCCC)c2)C1	ZINC001021590760	1318435753	/nfs/dbraw/zinc/43/57/53/1318435753.db2.gz	DVQYKUDXSLCASY-QUCCMNQESA-N	0	3	340.467	3.035	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc2c(o1)CCCC2	ZINC000960271660	1318437217	/nfs/dbraw/zinc/43/72/17/1318437217.db2.gz	SNQWHVZSAMZLJE-YLJYHZDGSA-N	0	3	336.435	3.330	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc3nccc(C)c3c2)C1	ZINC001021595520	1318441264	/nfs/dbraw/zinc/44/12/64/1318441264.db2.gz	ZICFRCISXSRAAS-WIYYLYMNSA-N	0	3	347.462	3.103	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2csc(C)c2C)C1	ZINC001021598455	1318443034	/nfs/dbraw/zinc/44/30/34/1318443034.db2.gz	VCTKJPXHZMJEQT-SJLPKXTDSA-N	0	3	330.497	3.315	20	30		EGEDHN
C=CCn1cccc1C(=O)NC1[C@H]2CN(C/C=C\c3ccccc3)C[C@@H]12	ZINC000960282706	1318444102	/nfs/dbraw/zinc/44/41/02/1318444102.db2.gz	QAFUWAYNIWQXJI-VNRQMOCBSA-N	0	3	347.462	3.048	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc(C(C)C)on1	ZINC000960297765	1318449056	/nfs/dbraw/zinc/44/90/56/1318449056.db2.gz	WHRNRXJDDBAEKV-VQIMIIECSA-N	0	3	339.439	3.360	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cccc(OC)c1	ZINC000960324891	1318461133	/nfs/dbraw/zinc/46/11/33/1318461133.db2.gz	GDELMPRQSGUGTA-WOJBJXKFSA-N	0	3	336.435	3.257	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1occ2c1CCCC2	ZINC000960325650	1318462322	/nfs/dbraw/zinc/46/23/22/1318462322.db2.gz	PSWMSGSPVSZNDC-RTBURBONSA-N	0	3	336.435	3.330	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(Cl)cc2F)C1	ZINC001021626164	1318477073	/nfs/dbraw/zinc/47/70/73/1318477073.db2.gz	DENBBYOCPMWZBT-KSSFIOAISA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(C)c(Cl)c2F)C1	ZINC001021637071	1318491844	/nfs/dbraw/zinc/49/18/44/1318491844.db2.gz	WYUVAQSTKPPDGZ-GOEBONIOSA-N	0	3	348.849	3.347	20	30		EGEDHN
CCc1cccc(CC)c1NC(=O)C(C#N)C(=O)[C@@H](C)[C@@H](C)COC	ZINC000813060060	1318492635	/nfs/dbraw/zinc/49/26/35/1318492635.db2.gz	ONSPFYOSCYHDFQ-GRDNDAEWSA-N	0	3	344.455	3.377	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(F)c(Cl)c2)C1	ZINC001021658468	1318520033	/nfs/dbraw/zinc/52/00/33/1318520033.db2.gz	NPJBKKYEVGOIEJ-CRAIPNDOSA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cccc(Cl)c2F)C1	ZINC001021658123	1318520593	/nfs/dbraw/zinc/52/05/93/1318520593.db2.gz	KIFKZFJBNCCGIT-PBHICJAKSA-N	0	3	348.849	3.429	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)c1ccccc1	ZINC000960397255	1318523904	/nfs/dbraw/zinc/52/39/04/1318523904.db2.gz	XGZDHRZNVJPFFY-HXUWFJFHSA-N	0	3	333.435	3.295	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc[nH]c2C2CCC2)C1	ZINC001021666850	1318528903	/nfs/dbraw/zinc/52/89/03/1318528903.db2.gz	CIQXFSOSEPACOL-HKUYNNGSSA-N	0	3	339.483	3.232	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(C)cc2Cl)C1	ZINC001021673886	1318537553	/nfs/dbraw/zinc/53/75/53/1318537553.db2.gz	NDCSKTCPJIFGSK-CRAIPNDOSA-N	0	3	330.859	3.208	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)[C@H]1CC=CCC1	ZINC000960417591	1318541743	/nfs/dbraw/zinc/54/17/43/1318541743.db2.gz	LJGZRFAWHKNGLR-PMACEKPBSA-N	0	3	337.467	3.337	20	30		EGEDHN
CCC(CC)C(=O)N1CCC[C@@H]1CN(C)Cc1ccc(C#N)cc1	ZINC000960420034	1318542450	/nfs/dbraw/zinc/54/24/50/1318542450.db2.gz	LZPGKNASHWBAEC-LJQANCHMSA-N	0	3	327.472	3.417	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(F)ccc2Cl)C1	ZINC001021676811	1318543456	/nfs/dbraw/zinc/54/34/56/1318543456.db2.gz	NGJKOCCLSQGSIE-KBXCAEBGSA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cccc(F)c2Cl)C1	ZINC001021678229	1318547213	/nfs/dbraw/zinc/54/72/13/1318547213.db2.gz	WRYMPDZEQPVTCJ-CZUORRHYSA-N	0	3	334.822	3.039	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc3c(c2)CCC=C3)C1	ZINC001021715686	1318594363	/nfs/dbraw/zinc/59/43/63/1318594363.db2.gz	IDDXTHPNJUVLCB-RTWAWAEBSA-N	0	3	334.463	3.206	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccccc2Cl)C1	ZINC001021720696	1318604750	/nfs/dbraw/zinc/60/47/50/1318604750.db2.gz	YQUQJOPZLAGTEU-CRAIPNDOSA-N	0	3	330.859	3.290	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)Cc2ccc(Cl)cc2)C1	ZINC001021725102	1318616382	/nfs/dbraw/zinc/61/63/82/1318616382.db2.gz	POQYBHZMQJSWPS-MJGOQNOKSA-N	0	3	344.886	3.219	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)Cc2ccc(Cl)cc2)C1	ZINC001021725100	1318616790	/nfs/dbraw/zinc/61/67/90/1318616790.db2.gz	POQYBHZMQJSWPS-IEBWSBKVSA-N	0	3	344.886	3.219	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc3c(s2)CCC3)C1	ZINC001021727896	1318624461	/nfs/dbraw/zinc/62/44/61/1318624461.db2.gz	OZDBBKVYVLQVPE-IAGOWNOFSA-N	0	3	342.508	3.187	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(C)c(C)s2)C1	ZINC001021730682	1318632247	/nfs/dbraw/zinc/63/22/47/1318632247.db2.gz	PNEMBFVBUZBQLH-IRXDYDNUSA-N	0	3	330.497	3.315	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)C23CC(C(C)(C)C)(C2)C3)C1	ZINC001021746175	1318661542	/nfs/dbraw/zinc/66/15/42/1318661542.db2.gz	IYMHWOYCBHPBCF-ZGDXVETISA-N	0	3	328.500	3.149	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(-c3ccccc3)[nH]2)C1	ZINC001021746408	1318663653	/nfs/dbraw/zinc/66/36/53/1318663653.db2.gz	LGOANPABEZEJOI-GHTZIAJQSA-N	0	3	347.462	3.241	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@@H](NC(=O)C3CCCCCC3)C2)c(F)c1	ZINC001021889110	1318722479	/nfs/dbraw/zinc/72/24/79/1318722479.db2.gz	BZPWMVXFJOBSJA-HDICACEKSA-N	0	3	343.446	3.405	20	30		EGEDHN
CN(Cc1ccc(C(F)F)cc1)C[C@@H]1CCCN1C(=O)C#CC1CC1	ZINC000960612066	1318738766	/nfs/dbraw/zinc/73/87/66/1318738766.db2.gz	DRCCMGXFYMPOID-SFHVURJKSA-N	0	3	346.421	3.460	20	30		EGEDHN
Cc1sccc1C(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001022048130	1318779572	/nfs/dbraw/zinc/77/95/72/1318779572.db2.gz	IUIAYPQWUKLNHQ-GASCZTMLSA-N	0	3	343.427	3.118	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)Nc1cnn(C[C@H]2CCCO2)c1	ZINC000912483111	1318893626	/nfs/dbraw/zinc/89/36/26/1318893626.db2.gz	YKEQZIWXPVUDPW-SJORKVTESA-N	0	3	336.480	3.079	20	30		EGEDHN
Cc1coc(C(=O)N2CCC[C@@H]2CN(C)Cc2ccc(C#N)cc2)c1	ZINC000960811451	1318930920	/nfs/dbraw/zinc/93/09/20/1318930920.db2.gz	ZHRPKKYBYHUMFV-GOSISDBHSA-N	0	3	337.423	3.196	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@H]2CN(C)C[C@H]2CCCCO2)CC1	ZINC000960827456	1318953334	/nfs/dbraw/zinc/95/33/34/1318953334.db2.gz	BMFJGSNTZDKOIB-RBUKOAKNSA-N	0	3	334.504	3.225	20	30		EGEDHN
C[C@@H]1CCN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccccc1CC#N	ZINC000913101196	1318976528	/nfs/dbraw/zinc/97/65/28/1318976528.db2.gz	CABLVMQXWFNWNU-UTKZUKDTSA-N	0	3	347.462	3.393	20	30		EGEDHN
CC1(C)CCC[C@@H]1C(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001022556730	1318987893	/nfs/dbraw/zinc/98/78/93/1318987893.db2.gz	BZPVBJTXAZUURD-IXDOHACOSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@@H](NCc3ccc(C#N)cc3F)C2)CC1	ZINC001022655663	1319045214	/nfs/dbraw/zinc/04/52/14/1319045214.db2.gz	JAQOIIODTJYVOA-HDICACEKSA-N	0	3	341.430	3.181	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@@H](NCc3cccc(F)c3F)C2)CC1	ZINC001022655615	1319045746	/nfs/dbraw/zinc/04/57/46/1319045746.db2.gz	IAMYWJQOPKJLKZ-IYBDPMFKSA-N	0	3	334.410	3.448	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@@H](NC(=O)C3(F)CCCCC3)C2)c1	ZINC001022930631	1319174599	/nfs/dbraw/zinc/17/45/99/1319174599.db2.gz	HBQGJOQYGXNUFO-IYBDPMFKSA-N	0	3	347.409	3.107	20	30		EGEDHN
CCC(=O)N1CCC[C@H]([C@H]2CCN(Cc3ccccc3C#N)C2)C1	ZINC000961065373	1319181213	/nfs/dbraw/zinc/18/12/13/1319181213.db2.gz	JOPAWXPREXICNC-OALUTQOASA-N	0	3	325.456	3.029	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)N[C@H]2C[C@@H](NCc3ccc(C#N)cc3F)C2)CC1	ZINC001022998336	1319207847	/nfs/dbraw/zinc/20/78/47/1319207847.db2.gz	DBMHZGIDBXDYCT-BLUWJVNFSA-N	0	3	343.446	3.260	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H]2C[C@@H](NCc3cc(C#N)ccc3F)C2)cc1	ZINC001023015515	1319221259	/nfs/dbraw/zinc/22/12/59/1319221259.db2.gz	QDLMHNVROVQFEI-HDICACEKSA-N	0	3	337.398	3.056	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@H]2CCCN(Cc3cccc(C#N)c3)C2)o1	ZINC001023218381	1319353843	/nfs/dbraw/zinc/35/38/43/1319353843.db2.gz	VVHOSVNVMUBDGX-GOSISDBHSA-N	0	3	337.423	3.102	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](C2CCN(C(=O)C(C)(F)F)CC2)C1	ZINC000961311354	1319471316	/nfs/dbraw/zinc/47/13/16/1319471316.db2.gz	HNHZFSTYGKBJSA-CQSZACIVSA-N	0	3	334.838	3.345	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc3nccc(C)c3c2)C1	ZINC001023390657	1319497522	/nfs/dbraw/zinc/49/75/22/1319497522.db2.gz	KFVPVLGRVSPYJT-QGZVFWFLSA-N	0	3	335.451	3.008	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](C2CCN(C(=O)[C@@H]3CC3(F)F)CC2)C1	ZINC000961358410	1319516570	/nfs/dbraw/zinc/51/65/70/1319516570.db2.gz	FVWYLOCCGOREDW-GJZGRUSLSA-N	0	3	346.849	3.345	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](C2CCN(C(=O)[C@@H](F)CC)CC2)C1	ZINC000961400380	1319555086	/nfs/dbraw/zinc/55/50/86/1319555086.db2.gz	IZGLJCMPIXFLKI-HOTGVXAUSA-N	0	3	330.875	3.438	20	30		EGEDHN
C#CCN(C)CCCNC(=O)/C=C/c1cccc(OC2CCCC2)c1	ZINC000818588720	1319563275	/nfs/dbraw/zinc/56/32/75/1319563275.db2.gz	DQXJTVMLCCFREI-OUKQBFOZSA-N	0	3	340.467	3.093	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1cc(SC)c(Cl)cc1Cl	ZINC000818584752	1319563777	/nfs/dbraw/zinc/56/37/77/1319563777.db2.gz	XGDYUDQRYNZKLI-UHFFFAOYSA-N	0	3	345.295	3.400	20	30		EGEDHN
C#CCN1CCC[C@@H](CNC(=O)c2sc3ccccc3c2C)C1	ZINC001023475619	1319575691	/nfs/dbraw/zinc/57/56/91/1319575691.db2.gz	BNPMEZAGIMAQDZ-HNNXBMFYSA-N	0	3	326.465	3.285	20	30		EGEDHN
COC(=O)[C@@H]1C[C@@H]2[C@H](CC[C@H](C)N2CCCCC2(C#N)CCC2)O1	ZINC000930350382	1328839430	/nfs/dbraw/zinc/83/94/30/1328839430.db2.gz	GYFWBYQELYQHDS-YVSFHVDLSA-N	0	3	334.460	3.034	20	30		EGEDHN
CCCCCn1cc(CNC[C@H](O)c2ccc(C#N)cc2)c(C)n1	ZINC000819201255	1319666821	/nfs/dbraw/zinc/66/68/21/1319666821.db2.gz	KZGMHOSHVWFGQW-IBGZPJMESA-N	0	3	326.444	3.077	20	30		EGEDHN
C=CCN1CCC[C@@H](CNC(=O)c2cc3cccc(OC)c3o2)C1	ZINC001023563293	1319677319	/nfs/dbraw/zinc/67/73/19/1319677319.db2.gz	ZRGCTVOZJSUICQ-AWEZNQCLSA-N	0	3	328.412	3.069	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](C#N)CCC#N)CC12CCC2	ZINC000819326233	1319698830	/nfs/dbraw/zinc/69/88/30/1319698830.db2.gz	LUQXKCRLYYYSBH-HZPDHXFCSA-N	0	3	346.475	3.342	20	30		EGEDHN
C#CCN1CCC[C@@H](CNC(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC001023602804	1319718151	/nfs/dbraw/zinc/71/81/51/1319718151.db2.gz	LACCGAMHQRGIOI-CEWLAPEOSA-N	0	3	338.495	3.422	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cnn(C(CC)CC)c2C)C1	ZINC001023692636	1319812544	/nfs/dbraw/zinc/81/25/44/1319812544.db2.gz	FRMXXTYTAAZOSK-KRWDZBQOSA-N	0	3	344.503	3.018	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc(C)c(C)c2Cl)C1	ZINC001023700275	1319829279	/nfs/dbraw/zinc/82/92/79/1319829279.db2.gz	LSBLCFFWDSSXIR-INIZCTEOSA-N	0	3	332.875	3.422	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2coc3ccc(F)cc23)C1	ZINC001023723221	1319863022	/nfs/dbraw/zinc/86/30/22/1319863022.db2.gz	ARGYDYZHBNZGRB-AWEZNQCLSA-N	0	3	328.387	3.037	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc(C)c(F)cc2Cl)C1	ZINC001023724469	1319863143	/nfs/dbraw/zinc/86/31/43/1319863143.db2.gz	FNEFPXCTQSTMGB-AWEZNQCLSA-N	0	3	336.838	3.253	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc3c(s2)CCCCC3)C1	ZINC001023733339	1319873327	/nfs/dbraw/zinc/87/33/27/1319873327.db2.gz	HXFVRCCHWUNBRY-INIZCTEOSA-N	0	3	344.524	3.482	20	30		EGEDHN
C=C1CCC(C(=O)NC2CC(CNCc3ccncc3Cl)C2)CC1	ZINC000962259498	1319885876	/nfs/dbraw/zinc/88/58/76/1319885876.db2.gz	LLWVJSYZJLRGKW-UHFFFAOYSA-N	0	3	347.890	3.466	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc3[nH]c(C)c(C)c3c2)C1	ZINC001023742111	1319886557	/nfs/dbraw/zinc/88/65/57/1319886557.db2.gz	CMTOUZHEVKPZLV-QGZVFWFLSA-N	0	3	337.467	3.250	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc(CCC)c(C)s2)C1	ZINC001023741389	1319886610	/nfs/dbraw/zinc/88/66/10/1319886610.db2.gz	VBLVGLMFEXUMAE-INIZCTEOSA-N	0	3	332.513	3.474	20	30		EGEDHN
C=C(C)CN1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1oc2ccccc2c1Cl	ZINC000962274630	1319895369	/nfs/dbraw/zinc/89/53/69/1319895369.db2.gz	WOCWKHCMCGMMOO-VIKVFOODSA-N	0	3	330.815	3.322	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2c3ccccc3oc2CC)C1	ZINC001023764582	1319913049	/nfs/dbraw/zinc/91/30/49/1319913049.db2.gz	MHKBQDLMHAJUMF-MRXNPFEDSA-N	0	3	338.451	3.460	20	30		EGEDHN
C#C[C@H](NC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1)c1ccccc1	ZINC000820591766	1319918239	/nfs/dbraw/zinc/91/82/39/1319918239.db2.gz	WVOMAYAXAYOOMK-OALUTQOASA-N	0	3	339.414	3.102	20	30		EGEDHN
C#CCCCOc1cccnc1NCCCCN1C[C@@H](C)O[C@H](C)C1	ZINC000820675611	1319932861	/nfs/dbraw/zinc/93/28/61/1319932861.db2.gz	JJPLXAQBCQZRNF-QZTJIDSGSA-N	0	3	345.487	3.175	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001023815501	1319960453	/nfs/dbraw/zinc/96/04/53/1319960453.db2.gz	UBSFJMLBANQNPC-OAHLLOKOSA-N	0	3	331.435	3.072	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCN(C(=O)[C@@H]2CC=CCC2)C1	ZINC001023837437	1319979033	/nfs/dbraw/zinc/97/90/33/1319979033.db2.gz	WQVMULNQQZKBRW-ZWKOTPCHSA-N	0	3	337.467	3.243	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1OC(F)F)C[C@@](C)(O)c1ccccc1	ZINC000823591423	1320189494	/nfs/dbraw/zinc/18/94/94/1320189494.db2.gz	LDADLQODLNVQOB-LJQANCHMSA-N	0	3	346.377	3.499	20	30		EGEDHN
COc1cc(C#N)ccc1C(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1	ZINC000930508112	1328881517	/nfs/dbraw/zinc/88/15/17/1328881517.db2.gz	NIYMFVSUPUBKGS-YJBOKZPZSA-N	0	3	349.434	3.132	20	30		EGEDHN
CN(CCC#N)c1ccc(CN2CCOC(C3CC3)(C3CC3)C2)cc1	ZINC000827537640	1320459168	/nfs/dbraw/zinc/45/91/68/1320459168.db2.gz	FYTBDYDQONGJRN-UHFFFAOYSA-N	0	3	339.483	3.427	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(Cc2ccccc2)OCC)CC1	ZINC000838324299	1320759895	/nfs/dbraw/zinc/75/98/95/1320759895.db2.gz	RPHSSMSMBIJAQG-UHFFFAOYSA-N	0	3	331.460	3.190	20	30		EGEDHN
C#Cc1cccc(CNC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)c1	ZINC000838586066	1320792907	/nfs/dbraw/zinc/79/29/07/1320792907.db2.gz	BKXUKWUMKFFIGF-UZLBHIALSA-N	0	3	335.451	3.159	20	30		EGEDHN
CC(C)(C)OC(=O)[C@@]1(C)CCN(Cc2ccc(OCC#N)cc2)C1	ZINC000839102860	1320870619	/nfs/dbraw/zinc/87/06/19/1320870619.db2.gz	SZTVGFCDMWSBMB-IBGZPJMESA-N	0	3	330.428	3.143	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCN2CC[C@@H](C(F)(F)F)C2)cc1Cl	ZINC000839535638	1320934453	/nfs/dbraw/zinc/93/44/53/1320934453.db2.gz	ZBDCYAZPJOWJCU-LLVKDONJSA-N	0	3	345.752	3.424	20	30		EGEDHN
Cc1ccc([C@@H](C)N[C@@H]2CCN(c3sccc3C#N)C2=O)s1	ZINC000839553418	1320937229	/nfs/dbraw/zinc/93/72/29/1320937229.db2.gz	QBICDBCQGSCCHW-DGCLKSJQSA-N	0	3	331.466	3.446	20	30		EGEDHN
C[C@H]1CN(C(=S)Nc2ccc(C#N)c(Cl)c2)CCN(C2CC2)C1	ZINC000840762812	1321143333	/nfs/dbraw/zinc/14/33/33/1321143333.db2.gz	DFNGOLKDOYLSIY-GFCCVEGCSA-N	0	3	348.903	3.325	20	30		EGEDHN
c1ccc([C@@H]2CC(N=Nc3nc4ccccn4n3)CCN2C2CC2)cc1	ZINC000841635288	1321290127	/nfs/dbraw/zinc/29/01/27/1321290127.db2.gz	IVDBGMFDZUFCKE-SFHVURJKSA-N	0	3	346.438	3.497	20	30		EGEDHN
CC[C@@H](NC[C@H](O)COc1ccccc1C#N)c1ccccc1OC	ZINC000859228618	1328951173	/nfs/dbraw/zinc/95/11/73/1328951173.db2.gz	UTWDBXUJAFCSDG-FUHWJXTLSA-N	0	3	340.423	3.047	20	30		EGEDHN
CCOc1ccc(C[C@H](C)C(=O)C(C#N)C(=O)NC2CCCC2)cc1	ZINC000842291332	1321368218	/nfs/dbraw/zinc/36/82/18/1321368218.db2.gz	IMZWDNJFBCYKLW-KSSFIOAISA-N	0	3	342.439	3.032	20	30		EGEDHN
C[C@H]1CC2(CN1Cn1ccc(-c3ccc(C#N)cc3)n1)CCOCC2	ZINC000842638384	1321411199	/nfs/dbraw/zinc/41/11/99/1321411199.db2.gz	KMIHEVCSJFVFMV-INIZCTEOSA-N	0	3	336.439	3.270	20	30		EGEDHN
N#CC(C(=O)[C@H]1CCc2ncncc2C1)c1ccc2ccccc2n1	ZINC000842677418	1321417300	/nfs/dbraw/zinc/41/73/00/1321417300.db2.gz	OYONUVXYFYAZEA-GOEBONIOSA-N	0	3	328.375	3.006	20	30		EGEDHN
CN(CC(=O)C(C#N)c1nc(C2CC2)cs1)C(=O)OC(C)(C)C	ZINC000842941793	1321452118	/nfs/dbraw/zinc/45/21/18/1321452118.db2.gz	KQYNAYHMEBVNFI-LLVKDONJSA-N	0	3	335.429	3.064	20	30		EGEDHN
C#CC1CCN(Cc2ccc(OCC(F)(F)F)c(OC)c2)CC1	ZINC000843427009	1321517591	/nfs/dbraw/zinc/51/75/91/1321517591.db2.gz	QNDLAJPHVWTVGG-UHFFFAOYSA-N	0	3	327.346	3.482	20	30		EGEDHN
C#CC1CCN(Cc2cc(OC)c(OCC(F)F)c(OC)c2)CC1	ZINC000843426602	1321517868	/nfs/dbraw/zinc/51/78/68/1321517868.db2.gz	BUQACKGOCNEVQL-UHFFFAOYSA-N	0	3	339.382	3.193	20	30		EGEDHN
C#CC1CCN(C(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)CC1	ZINC000843698902	1321537486	/nfs/dbraw/zinc/53/74/86/1321537486.db2.gz	FISLXGURUMORKT-SFHVURJKSA-N	0	3	346.421	3.016	20	30		EGEDHN
C#CCOc1ccc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)cc1	ZINC000844377641	1321595771	/nfs/dbraw/zinc/59/57/71/1321595771.db2.gz	HYCSMMKOZURWTH-CABCVRRESA-N	0	3	341.329	3.385	20	30		EGEDHN
CC(C)(C)OC(=O)C[C@H]1CCCCN1C[C@@H](O)c1ccc(C#N)cc1	ZINC000844427446	1321605759	/nfs/dbraw/zinc/60/57/59/1321605759.db2.gz	XWHWIJYQACQWBE-QZTJIDSGSA-N	0	3	344.455	3.178	20	30		EGEDHN
N#CC1(COC(=O)c2nccs2)CCN(Cc2ccccc2)CC1	ZINC000847748058	1321900458	/nfs/dbraw/zinc/90/04/58/1321900458.db2.gz	WYDFCQCEBMUMBZ-UHFFFAOYSA-N	0	3	341.436	3.106	20	30		EGEDHN
C[C@H](COC(=O)C(C)(C)Oc1ccc(C#N)cc1)N1CCCCC1	ZINC000847961160	1321916691	/nfs/dbraw/zinc/91/66/91/1321916691.db2.gz	STWDCAWVCAIQOY-OAHLLOKOSA-N	0	3	330.428	3.133	20	30		EGEDHN
CCN1CCN(c2ccc(NC(=O)C3(C#N)CCCCC3)cc2)CC1	ZINC000920020685	1322127914	/nfs/dbraw/zinc/12/79/14/1322127914.db2.gz	XOWAERYBYZKAGU-UHFFFAOYSA-N	0	3	340.471	3.241	20	30		EGEDHN
N#Cc1ccc(Br)c(CNC[C@@H]2CSCCS2)c1	ZINC000921828038	1322406642	/nfs/dbraw/zinc/40/66/42/1322406642.db2.gz	RSXNKSPXGWKJRP-GFCCVEGCSA-N	0	3	343.315	3.259	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(OCC#N)cc2)CC[C@@H]1C(=O)OC(C)(C)C	ZINC000859614829	1329034856	/nfs/dbraw/zinc/03/48/56/1329034856.db2.gz	JVLHAXHQDHARQA-QAPCUYQASA-N	0	3	344.455	3.389	20	30		EGEDHN
N#Cc1ccc(CC[N@@H+](Cc2ccccc2[O-])C[C@H]2CCCO2)cc1	ZINC000851841144	1323099895	/nfs/dbraw/zinc/09/98/95/1323099895.db2.gz	NHUUQSGXOVKQNF-HXUWFJFHSA-N	0	3	336.435	3.488	20	30		EGEDHN
N#Cc1ccc(CC[N@H+](Cc2ccccc2[O-])C[C@H]2CCCO2)cc1	ZINC000851841144	1323099905	/nfs/dbraw/zinc/09/99/05/1323099905.db2.gz	NHUUQSGXOVKQNF-HXUWFJFHSA-N	0	3	336.435	3.488	20	30		EGEDHN
C[C@]1(C(=O)N2CCC[C@@H](CNCc3ccccc3C#N)C2)C=CCC1	ZINC001024105317	1323137835	/nfs/dbraw/zinc/13/78/35/1323137835.db2.gz	IBGAWKYUEJRHKJ-UWJYYQICSA-N	0	3	337.467	3.243	20	30		EGEDHN
C#C[C@](C)(CC)NCC(=O)N[C@H](C)c1ccc(Br)cc1	ZINC000852098930	1323146058	/nfs/dbraw/zinc/14/60/58/1323146058.db2.gz	ZKCNPPQHUDEHMY-MLGOLLRUSA-N	0	3	337.261	3.018	20	30		EGEDHN
C=CCN1CCC(N[C@H](c2ccccn2)c2ccccc2OC)CC1	ZINC000924984923	1323236841	/nfs/dbraw/zinc/23/68/41/1323236841.db2.gz	YPZKOEZTXMXBEB-NRFANRHFSA-N	0	3	337.467	3.420	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)c2ccccn2)C1	ZINC000963236456	1323246885	/nfs/dbraw/zinc/24/68/85/1323246885.db2.gz	RRLAGBJPSNMATQ-NVXWUHKLSA-N	0	3	333.863	3.151	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccc2nccc(C)c2c1	ZINC001024454390	1323412995	/nfs/dbraw/zinc/41/29/95/1323412995.db2.gz	FNWACDPKVYKAQT-GOSISDBHSA-N	0	3	335.451	3.151	20	30		EGEDHN
C=C(C)CCN1CCCC[C@@H]1CNC(=O)c1ncc(Cl)s1	ZINC001024553125	1323494226	/nfs/dbraw/zinc/49/42/26/1323494226.db2.gz	SGWCLEBSZXVEAV-GFCCVEGCSA-N	0	3	327.881	3.347	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@@H]1CCc2cc(F)ccc21	ZINC001024556367	1323495697	/nfs/dbraw/zinc/49/56/97/1323495697.db2.gz	FTEAQWBHCZVFTB-PKOBYXMFSA-N	0	3	330.447	3.402	20	30		EGEDHN
C=CCCN1CCCC[C@@H]1CNC(=O)c1cc2c(C)nn(C)c2s1	ZINC001024577314	1323512731	/nfs/dbraw/zinc/51/27/31/1323512731.db2.gz	AQWJPIGLXWNMIC-CQSZACIVSA-N	0	3	346.500	3.104	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cnc2ccsc2c1	ZINC001024593941	1323526382	/nfs/dbraw/zinc/52/63/82/1323526382.db2.gz	UFUYXAXIMWSDOI-HNNXBMFYSA-N	0	3	329.469	3.457	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccc(N2CC=CC2)cc1	ZINC001024647626	1323572750	/nfs/dbraw/zinc/57/27/50/1323572750.db2.gz	QBYZQFZEVAMKKJ-HXUWFJFHSA-N	0	3	339.483	3.223	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001025049048	1323854382	/nfs/dbraw/zinc/85/43/82/1323854382.db2.gz	OYSHIPUVRPQJEP-SJLPKXTDSA-N	0	3	349.425	3.162	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCCC[C@H]1CNCc1ccnc(OC)c1	ZINC001025069755	1323871298	/nfs/dbraw/zinc/87/12/98/1323871298.db2.gz	ODCTZNRNPOLTLD-FXAWDEMLSA-N	0	3	345.487	3.163	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@H]2[C@@H]2CCCCN2C(=O)C2CC2)c1	ZINC001025183150	1323950879	/nfs/dbraw/zinc/95/08/79/1323950879.db2.gz	JEFNBYPVCCFTKW-UXHICEINSA-N	0	3	337.467	3.314	20	30		EGEDHN
C=CCC[N@H+]1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccccc1[O-]	ZINC001025202262	1323988348	/nfs/dbraw/zinc/98/83/48/1323988348.db2.gz	WHLBVEDBJWCIQI-ROUUACIJSA-N	0	3	328.456	3.427	20	30		EGEDHN
C=CCC[N@@H+]1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccccc1[O-]	ZINC001025202262	1323988351	/nfs/dbraw/zinc/98/83/51/1323988351.db2.gz	WHLBVEDBJWCIQI-ROUUACIJSA-N	0	3	328.456	3.427	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1oc(C)cc1C	ZINC001025215755	1324008117	/nfs/dbraw/zinc/00/81/17/1324008117.db2.gz	CIZYZESWFAFUNP-MSOLQXFVSA-N	0	3	328.456	3.379	20	30		EGEDHN
N#Cc1ccc(C(=O)N2CCCC[C@@H]2[C@@H]2CCCN2C/C=C\Cl)[nH]1	ZINC001025225075	1324013348	/nfs/dbraw/zinc/01/33/48/1324013348.db2.gz	YBCVKCDWVCTNHE-YCFODECYSA-N	0	3	346.862	3.098	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1c(F)cccc1OC	ZINC001025233301	1324020641	/nfs/dbraw/zinc/02/06/41/1324020641.db2.gz	WWUJMVCLCIGEGB-SJORKVTESA-N	0	3	346.446	3.479	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1c(C)[nH]nc1Cl	ZINC001025237704	1324030267	/nfs/dbraw/zinc/03/02/67/1324030267.db2.gz	OEDJXITWRKYGCY-ZIAGYGMSSA-N	0	3	336.867	3.017	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccnc(CCC)c1	ZINC001025240083	1324032936	/nfs/dbraw/zinc/03/29/36/1324032936.db2.gz	LAMZPIKCRSMZMU-UXHICEINSA-N	0	3	339.483	3.126	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc2c[nH]ccc-2n1	ZINC001025243698	1324039786	/nfs/dbraw/zinc/03/97/86/1324039786.db2.gz	DMSOPZWIFBBDNT-RTBURBONSA-N	0	3	338.455	3.208	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(C)c(C)cn1	ZINC001025252476	1324057233	/nfs/dbraw/zinc/05/72/33/1324057233.db2.gz	OUYQDNNKWDXIRN-VQTJNVASSA-N	0	3	339.483	3.181	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(C)ccc1OC	ZINC001025252564	1324057334	/nfs/dbraw/zinc/05/73/34/1324057334.db2.gz	XYERBQRXKHPHNE-RTBURBONSA-N	0	3	340.467	3.096	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cncc(CC)c1	ZINC001025252204	1324057438	/nfs/dbraw/zinc/05/74/38/1324057438.db2.gz	NNZJUUQOURJRFU-WOJBJXKFSA-N	0	3	339.483	3.126	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1c(C)cc(C)nc1C	ZINC001025253863	1324060254	/nfs/dbraw/zinc/06/02/54/1324060254.db2.gz	XMQAPDUDJQUULN-RBUKOAKNSA-N	0	3	339.483	3.099	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)C1CC2(CCC2)C1	ZINC001025257837	1324065743	/nfs/dbraw/zinc/06/57/43/1324065743.db2.gz	AJQNBJAVCPAUNW-RTBURBONSA-N	0	3	328.500	3.436	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)C1(C(F)F)CCCC1	ZINC001025261490	1324071616	/nfs/dbraw/zinc/07/16/16/1324071616.db2.gz	WGGZCTQBVHMXGA-HOTGVXAUSA-N	0	3	338.442	3.291	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc2ncccc2c1	ZINC001025264531	1324075978	/nfs/dbraw/zinc/07/59/78/1324075978.db2.gz	AVVURENUNUNVRD-NHCUHLMSSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc[nH]c1C1CCC1	ZINC001025269577	1324082852	/nfs/dbraw/zinc/08/28/52/1324082852.db2.gz	TUCUBOXIOBKLQS-RTBURBONSA-N	0	3	339.483	3.375	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(CCC)on1	ZINC001025283879	1324104026	/nfs/dbraw/zinc/10/40/26/1324104026.db2.gz	BZMXMOLJGBPCKZ-OALUTQOASA-N	0	3	343.471	3.110	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)Cn1ccc2ccccc21	ZINC001025293570	1324120241	/nfs/dbraw/zinc/12/02/41/1324120241.db2.gz	DQFMXMRCHMFUMW-LEWJYISDSA-N	0	3	349.478	3.120	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc2c(c1)CCC2	ZINC001025294088	1324123173	/nfs/dbraw/zinc/12/31/73/1324123173.db2.gz	HUNAEIHDTGNFDM-RTWAWAEBSA-N	0	3	336.479	3.268	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)Cc1sc(C)cc1C	ZINC001025297044	1324129042	/nfs/dbraw/zinc/12/90/42/1324129042.db2.gz	NTZJFRAXBCAYJF-MSOLQXFVSA-N	0	3	344.524	3.386	20	30		EGEDHN
C#CCCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc(F)s1	ZINC001025303560	1324137784	/nfs/dbraw/zinc/13/77/84/1324137784.db2.gz	IJRIYTJBSVRFCT-HUUCEWRRSA-N	0	3	334.460	3.370	20	30		EGEDHN
C[C@@H](NC(=O)c1ccoc1)[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001025346530	1324193049	/nfs/dbraw/zinc/19/30/49/1324193049.db2.gz	URUAATOFCNJKLV-QAPCUYQASA-N	0	3	337.423	3.182	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc3nccc(C)c3c2)C1	ZINC001025428036	1324262627	/nfs/dbraw/zinc/26/26/27/1324262627.db2.gz	KDWLCHALUANXKO-PKOBYXMFSA-N	0	3	349.478	3.397	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccccc2-c2ccncc2)C1	ZINC001025455367	1324296133	/nfs/dbraw/zinc/29/61/33/1324296133.db2.gz	CHEOGUNGOQZBML-IEBWSBKVSA-N	0	3	347.462	3.212	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(Cl)ccc2F)C1	ZINC001025480225	1324327940	/nfs/dbraw/zinc/32/79/40/1324327940.db2.gz	RJEGOZAGKBWCSD-KGLIPLIRSA-N	0	3	336.838	3.333	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2c(C)occ2C(F)(F)F)C1	ZINC001025484207	1324332125	/nfs/dbraw/zinc/33/21/25/1324332125.db2.gz	APORYUJCKFCHGS-AAEUAGOBSA-N	0	3	342.361	3.070	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc3cc(C)ccc3[nH]2)C1	ZINC001025501359	1324350158	/nfs/dbraw/zinc/35/01/58/1324350158.db2.gz	DCKUQGQIUQWVJJ-IRXDYDNUSA-N	0	3	337.467	3.330	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2c(F)ccc(F)c2Cl)C1	ZINC001025540750	1324388440	/nfs/dbraw/zinc/38/84/40/1324388440.db2.gz	YZEOOZNHMFHLBY-NEPJUHHUSA-N	0	3	340.801	3.082	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cnc3ccccc3c2)C1	ZINC001025543012	1324390473	/nfs/dbraw/zinc/39/04/73/1324390473.db2.gz	GIWTWXDXJCWMBT-AEFFLSMTSA-N	0	3	335.451	3.088	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(C)oc2C(F)(F)F)C1	ZINC001025546676	1324394508	/nfs/dbraw/zinc/39/45/08/1324394508.db2.gz	SMWORNTUVPJUPO-STQMWFEESA-N	0	3	342.361	3.070	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(C3CC3)s2)C1	ZINC001025593245	1324440405	/nfs/dbraw/zinc/44/04/05/1324440405.db2.gz	AGKHVKIWWLLERB-GDBMZVCRSA-N	0	3	330.497	3.479	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc3c(C)cccn3c2)C1	ZINC001025595426	1324443080	/nfs/dbraw/zinc/44/30/80/1324443080.db2.gz	OCFMLHWOHSRSBM-QZTJIDSGSA-N	0	3	337.467	3.101	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(C(F)(F)F)cc2)C1	ZINC001025603199	1324452241	/nfs/dbraw/zinc/45/22/41/1324452241.db2.gz	RNRUOTVCZWFACD-DZGCQCFKSA-N	0	3	338.373	3.169	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccsc2C(F)F)C1	ZINC001025607887	1324459135	/nfs/dbraw/zinc/45/91/35/1324459135.db2.gz	YDJBMOMKDQQFLQ-RYUDHWBXSA-N	0	3	326.412	3.149	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(Cl)cc2Cl)C1	ZINC001025608899	1324460091	/nfs/dbraw/zinc/46/00/91/1324460091.db2.gz	MIUKBRRLXRQJLU-OLZOCXBDSA-N	0	3	339.266	3.457	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(C)nc3ccccc32)C1	ZINC001025609136	1324460249	/nfs/dbraw/zinc/46/02/49/1324460249.db2.gz	DSSCBNOFLKTNKJ-MSOLQXFVSA-N	0	3	349.478	3.397	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2c[nH]cc2-c2ccccc2)C1	ZINC001025623195	1324472172	/nfs/dbraw/zinc/47/21/72/1324472172.db2.gz	ZCRLJTAXEFZGMJ-WMZOPIPTSA-N	0	3	335.451	3.145	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2c[nH]c3c2cccc3CC)C1	ZINC001025630394	1324481742	/nfs/dbraw/zinc/48/17/42/1324481742.db2.gz	SEFSOHQLADWVIY-WBVHZDCISA-N	0	3	337.467	3.194	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cscc2C(F)(F)F)C1	ZINC001025636947	1324487573	/nfs/dbraw/zinc/48/75/73/1324487573.db2.gz	JGISMOIGRFWZCD-NWDGAFQWSA-N	0	3	344.402	3.230	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CC[C@H]2CN(C(=O)C3CCCC3)C[C@H]21	ZINC001026168642	1324636615	/nfs/dbraw/zinc/63/66/15/1324636615.db2.gz	IMBFOVKABVGDHS-XUVXKRRUSA-N	0	3	337.467	3.075	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CC[C@@H]2CN(C(=O)C3CCCC3)C[C@@H]12	ZINC001026168641	1324636760	/nfs/dbraw/zinc/63/67/60/1324636760.db2.gz	IMBFOVKABVGDHS-VAMGGRTRSA-N	0	3	337.467	3.075	20	30		EGEDHN
C/C(=C\C(=O)N1C[C@@H]2CC[C@H](NCc3ccccc3C#N)[C@@H]2C1)C1CC1	ZINC001026207436	1324663267	/nfs/dbraw/zinc/66/32/67/1324663267.db2.gz	UNAZYSWAKFONQP-KERKAOBESA-N	0	3	349.478	3.241	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H](CNCc2oc(C)nc2C)C1	ZINC001026865833	1325054730	/nfs/dbraw/zinc/05/47/30/1325054730.db2.gz	MSVZBPMLYLYYKG-AWEZNQCLSA-N	0	3	339.867	3.008	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](CNCc3csc(CC)n3)C2)CC1	ZINC001027036857	1325170837	/nfs/dbraw/zinc/17/08/37/1325170837.db2.gz	JIWNPOAPHGMHMU-OAHLLOKOSA-N	0	3	347.528	3.390	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@H](CNCc2ccn(C(C)C)n2)C1	ZINC001027041160	1325175407	/nfs/dbraw/zinc/17/54/07/1325175407.db2.gz	QJXDYCWHFBPIPM-LPHOPBHVSA-N	0	3	332.492	3.004	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](CNCc3ncc(C)s3)C2)CC1	ZINC001027041440	1325177167	/nfs/dbraw/zinc/17/71/67/1325177167.db2.gz	VUHNEZFVUOSTLO-HNNXBMFYSA-N	0	3	333.501	3.136	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](CNCc3nc(C)c(C)s3)C2)C1	ZINC001027050435	1325189134	/nfs/dbraw/zinc/18/91/34/1325189134.db2.gz	BKEWSHGFUCEZQB-HNNXBMFYSA-N	0	3	333.501	3.054	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)c2c[nH]cc2C2CC2)C1	ZINC001027148642	1325252386	/nfs/dbraw/zinc/25/23/86/1325252386.db2.gz	INQRHMDIMQLONO-HNNXBMFYSA-N	0	3	348.450	3.016	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCN(C(=O)[C@@H]2CC23CCCC3)C1	ZINC001027155475	1325258542	/nfs/dbraw/zinc/25/85/42/1325258542.db2.gz	NNVNZUWIAOMWLG-APWZRJJASA-N	0	3	337.467	3.077	20	30		EGEDHN
C[C@@H]1[C@@H](NC(=O)c2cc(C#N)ccc2F)CCN1Cc1ccccc1	ZINC000854483807	1325264933	/nfs/dbraw/zinc/26/49/33/1325264933.db2.gz	JCFLIHQYFBFTPP-KUHUBIRLSA-N	0	3	337.398	3.090	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@H](CNCc3ccccc3C#N)C2)cc1C	ZINC001027201450	1325302827	/nfs/dbraw/zinc/30/28/27/1325302827.db2.gz	RGNJNRNVUDEUAZ-GOSISDBHSA-N	0	3	347.462	3.427	20	30		EGEDHN
C[C@H](CC(=O)N1CC[C@H](CNCc2cc(F)ccc2C#N)C1)C1CC1	ZINC001027237585	1325331692	/nfs/dbraw/zinc/33/16/92/1325331692.db2.gz	QOYSJQSNUQWKDG-HUUCEWRRSA-N	0	3	343.446	3.072	20	30		EGEDHN
C#CCN1CCC(C(=O)NCc2ccc(-c3cccs3)cc2)CC1	ZINC000855385179	1325375231	/nfs/dbraw/zinc/37/52/31/1325375231.db2.gz	JLFCRCKHHDDSNO-UHFFFAOYSA-N	0	3	338.476	3.377	20	30		EGEDHN
CCC(CC)C(=O)N1CCC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001027302028	1325445329	/nfs/dbraw/zinc/44/53/29/1325445329.db2.gz	YRXCTIBJKBAHMX-IBGZPJMESA-N	0	3	327.472	3.417	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC[C@H](N(C)Cc2ccc(F)c(C#N)c2)C1	ZINC001027305989	1325452615	/nfs/dbraw/zinc/45/26/15/1325452615.db2.gz	WWMATXJMIGLFQJ-PBHICJAKSA-N	0	3	331.435	3.166	20	30		EGEDHN
CC(=O)N1CC[C@@H](NCc2ccc(OCC#N)cc2)c2ccccc21	ZINC000857075544	1325569525	/nfs/dbraw/zinc/56/95/25/1325569525.db2.gz	CSMBHXYDRDSSOA-LJQANCHMSA-N	0	3	335.407	3.176	20	30		EGEDHN
C#CCCN1CC[C@H](N(C)C(=O)c2ccc(Cl)cc2Cl)C1	ZINC001033606707	1341897258	/nfs/dbraw/zinc/89/72/58/1341897258.db2.gz	PWNDTASAGBWAIM-ZDUSSCGKSA-N	0	3	325.239	3.163	20	30		EGEDHN
CCN(C(=O)OC(C)(C)C)[C@H](C)C(=O)C(C#N)c1nc(C)cs1	ZINC000860449618	1329318586	/nfs/dbraw/zinc/31/85/86/1329318586.db2.gz	CLUQLAYRROHFJP-VXGBXAGGSA-N	0	3	337.445	3.273	20	30		EGEDHN
CCC[C@H](OCC)C(=O)C(C#N)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000860474046	1329321659	/nfs/dbraw/zinc/32/16/59/1329321659.db2.gz	VRLONIPAMPSKQM-FZMZJTMJSA-N	0	3	340.782	3.332	20	30		EGEDHN
CCC[C@H](OCC)C(=O)C(C#N)C(=O)N[C@@H](CC)c1ccccc1	ZINC000860696108	1329345369	/nfs/dbraw/zinc/34/53/69/1329345369.db2.gz	YHKVPLIQJWDMFP-ULQDDVLXSA-N	0	3	330.428	3.168	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)C2C=CC=CC=C2)C1	ZINC001027431063	1327670286	/nfs/dbraw/zinc/67/02/86/1327670286.db2.gz	GTDXIRHKOUXVQB-OAQYLSRUSA-N	0	3	347.462	3.279	20	30		EGEDHN
C[C@@H]1C[C@H]1CC(=O)NC1CC2(CC(NCc3ccccc3C#N)C2)C1	ZINC000964853831	1327731100	/nfs/dbraw/zinc/73/11/00/1327731100.db2.gz	QIPNCXZFBHNIMQ-JIBPNWGFSA-N	0	3	337.467	3.121	20	30		EGEDHN
C=C1CCC(C(=O)NC2CC3(CC(NCc4cc(C)no4)C3)C2)CC1	ZINC000964880639	1327746411	/nfs/dbraw/zinc/74/64/11/1327746411.db2.gz	JVKFDJXUAKWSTN-UHFFFAOYSA-N	0	3	343.471	3.246	20	30		EGEDHN
COc1ccc(Cl)cc1[C@H](C)NCCNc1ccc(C#N)cn1	ZINC000927166717	1327903082	/nfs/dbraw/zinc/90/30/82/1327903082.db2.gz	YGQRDMPQAGDAAX-LBPRGKRZSA-N	0	3	330.819	3.378	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)[C@@H]2CC23CCC3)C1	ZINC001027597019	1327948521	/nfs/dbraw/zinc/94/85/21/1327948521.db2.gz	FWMPZZBFEBPNNZ-OALUTQOASA-N	0	3	337.467	3.171	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)[C@@H]1C[C@H]1c1ccco1)C2	ZINC000965250494	1327954988	/nfs/dbraw/zinc/95/49/88/1327954988.db2.gz	RZGUEOPLHIKISO-BSGOTLCWSA-N	0	3	334.847	3.153	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N1CCC[C@H](N(C)Cc2ccsc2)C1	ZINC001027612398	1327976378	/nfs/dbraw/zinc/97/63/78/1327976378.db2.gz	IOBSWCCUXKNDFR-BZSNNMDCSA-N	0	3	348.512	3.152	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)c2oc3ccccc3c2Cl)C1	ZINC001027646047	1328022491	/nfs/dbraw/zinc/02/24/91/1328022491.db2.gz	RDCUKFWTPUMDCG-CYBMUJFWSA-N	0	3	330.815	3.256	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)Cc1ccccc1C)C2	ZINC000965907321	1328096187	/nfs/dbraw/zinc/09/61/87/1328096187.db2.gz	GQRFBEOANRWTQY-UHFFFAOYSA-N	0	3	332.875	3.307	20	30		EGEDHN
C=C(Cl)CN(C)[C@H]1CCCN(C(=O)c2ccccc2CN(C)C)C1	ZINC001027693094	1328098854	/nfs/dbraw/zinc/09/88/54/1328098854.db2.gz	RMTZQQACLGYHML-KRWDZBQOSA-N	0	3	349.906	3.037	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1nc(C)c(C)s1)C2	ZINC000965922683	1328107135	/nfs/dbraw/zinc/10/71/35/1328107135.db2.gz	FEWLDJRLDDSNJE-UHFFFAOYSA-N	0	3	339.892	3.143	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2coc3c2cccc3OC)C1	ZINC000966136394	1328202727	/nfs/dbraw/zinc/20/27/27/1328202727.db2.gz	TUGIVDXIXAMARN-WMLDXEAASA-N	0	3	342.439	3.458	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccoc2C(F)(F)F)C1	ZINC000966389916	1328287914	/nfs/dbraw/zinc/28/79/14/1328287914.db2.gz	SYLXTDMTMNRUPI-YPMHNXCESA-N	0	3	330.350	3.315	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2cc(F)c3ccccc3c2)C1	ZINC000966600759	1328350366	/nfs/dbraw/zinc/35/03/66/1328350366.db2.gz	PLMWVPPGLPSSAY-FOIQADDNSA-N	0	3	338.426	3.442	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2ccc3cc(C)cn3c2)C1	ZINC000966632327	1328362403	/nfs/dbraw/zinc/36/24/03/1328362403.db2.gz	KLOODWIEEDTSDK-VQIMIIECSA-N	0	3	325.456	3.264	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)C2C3CC4CC(C3)CC2C4)C1	ZINC000966722849	1328393204	/nfs/dbraw/zinc/39/32/04/1328393204.db2.gz	MIVHXUMQPROGAK-NJKWNDLUSA-N	0	3	330.516	3.461	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](C)[C@H](NC(=O)c2c(C)noc2C(F)F)C1	ZINC000966887832	1328453531	/nfs/dbraw/zinc/45/35/31/1328453531.db2.gz	JCSIMXJNMFJCIX-DGCLKSJQSA-N	0	3	341.402	3.327	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1cc(C)n(C(CC)CC)n1	ZINC001027983565	1328456258	/nfs/dbraw/zinc/45/62/58/1328456258.db2.gz	APUFZZKORYMQCX-QGZVFWFLSA-N	0	3	332.492	3.323	20	30		EGEDHN
C=CCN1CCC(NC(=O)/C=C/c2ccccc2C(F)(F)F)CC1	ZINC000865193216	1329675583	/nfs/dbraw/zinc/67/55/83/1329675583.db2.gz	HWUSAIYGMKWVLM-BQYQJAHWSA-N	0	3	338.373	3.485	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC2(C1)CCN(Cc1ccc(C)nc1C)CC2	ZINC001050617689	1348304218	/nfs/dbraw/zinc/30/42/18/1348304218.db2.gz	MHCYHTUZCQQUSC-UHFFFAOYSA-N	0	3	341.499	3.335	20	30		EGEDHN
CC(C)N1CCC[C@@H]1C(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1	ZINC000933858670	1329928677	/nfs/dbraw/zinc/92/86/77/1329928677.db2.gz	QRGUSBXKTZKSBZ-GUDVDZBRSA-N	0	3	325.456	3.158	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccccc2C(C)(C)CC)[C@H](C)C1	ZINC000942163872	1331856310	/nfs/dbraw/zinc/85/63/10/1331856310.db2.gz	PAJNWSZXKFMPNY-APWZRJJASA-N	0	3	326.484	3.448	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc3cc(C)ccc3n2)[C@@H](C)C1	ZINC000942430007	1331932072	/nfs/dbraw/zinc/93/20/72/1331932072.db2.gz	FOLLNRYMOWWVCD-WMZOPIPTSA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2nc3ccccc3cc2C)[C@@H](C)C1	ZINC000942525119	1331954665	/nfs/dbraw/zinc/95/46/65/1331954665.db2.gz	KBNNZBIPCNPSJH-FUHWJXTLSA-N	0	3	335.451	3.007	20	30		EGEDHN
Cc1cocc1C(=O)N[C@@H]1CCN(Cc2cccc(C#N)c2)C[C@@H]1C	ZINC000942558448	1331973629	/nfs/dbraw/zinc/97/36/29/1331973629.db2.gz	WPBOCMSTMZILAI-IFXJQAMLSA-N	0	3	337.423	3.100	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)cc2)CC[C@@H]1NC(=O)C(C)(C)C1CC1	ZINC000942569344	1331980520	/nfs/dbraw/zinc/98/05/20/1331980520.db2.gz	JCAYLKYPVCGEIZ-BEFAXECRSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccc(-c3ccccc3)nc2)[C@H](C)C1	ZINC000943756628	1332255433	/nfs/dbraw/zinc/25/54/33/1332255433.db2.gz	SMXLAUMIMXAQJN-VQIMIIECSA-N	0	3	335.451	3.375	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3c(s2)CCCC3)[C@@H](C)C1	ZINC000944702792	1332423546	/nfs/dbraw/zinc/42/35/46/1332423546.db2.gz	UGABXHQWFZJFQG-HOCLYGCPSA-N	0	3	330.497	3.090	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)n(C(C)C)c2C)[C@H](C)C1	ZINC000944890679	1332445336	/nfs/dbraw/zinc/44/53/36/1332445336.db2.gz	MXKDPIHEMVLMCQ-BEFAXECRSA-N	0	3	329.488	3.149	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3cc(C)cc(C)c3)CC2)[C@H](C)C1	ZINC000944980948	1332468992	/nfs/dbraw/zinc/46/89/92/1332468992.db2.gz	YBZBTQZKDNVXBU-UYAOXDASSA-N	0	3	338.495	3.185	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3ccccc3n2CC)[C@@H](C)C1	ZINC000945088044	1332496314	/nfs/dbraw/zinc/49/63/14/1332496314.db2.gz	ADROQLKDTVEQCJ-FUHWJXTLSA-N	0	3	337.467	3.125	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@@H](C)C(C)(F)F)CC[C@@H]2C1	ZINC000946784274	1332898686	/nfs/dbraw/zinc/89/86/86/1332898686.db2.gz	FNPAHIQFCHYFAP-MCIONIFRSA-N	0	3	334.838	3.201	20	30		EGEDHN
Cc1cc(C(=O)N[C@H]2CCN(Cc3cccc(C#N)c3)[C@H](C)C2)co1	ZINC000947244676	1333063371	/nfs/dbraw/zinc/06/33/71/1333063371.db2.gz	NXYJTQQYMUYFLB-KUHUBIRLSA-N	0	3	337.423	3.243	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2c(F)ccc3ccncc32)C[C@@H]1C	ZINC000947328343	1333091275	/nfs/dbraw/zinc/09/12/75/1333091275.db2.gz	QMSHOAYXIOBALX-DZGCQCFKSA-N	0	3	327.403	3.143	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2snc(Cl)c2Cl)C[C@@H]1C	ZINC000947356521	1333101237	/nfs/dbraw/zinc/10/12/37/1333101237.db2.gz	MROKFYZNACOPMR-IUCAKERBSA-N	0	3	334.272	3.219	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)C2C=CC=CC=C2)CCN1Cc1ccc(C#N)cc1	ZINC000947362080	1333103984	/nfs/dbraw/zinc/10/39/84/1333103984.db2.gz	USYVIPKKQVNGBC-UTKZUKDTSA-N	0	3	347.462	3.326	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ocnc2-c2ccccc2)C[C@@H]1C	ZINC000947377399	1333107991	/nfs/dbraw/zinc/10/79/91/1333107991.db2.gz	GVSXBUUOXHVKLT-GOEBONIOSA-N	0	3	325.412	3.110	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc3ccc(C)nc32)C[C@@H]1C	ZINC000947432941	1333126396	/nfs/dbraw/zinc/12/63/96/1333126396.db2.gz	CUCMWMTWHPARLS-WMZOPIPTSA-N	0	3	335.451	3.149	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccccc2-c2ccncc2)C[C@@H]1C	ZINC000947442129	1333129271	/nfs/dbraw/zinc/12/92/71/1333129271.db2.gz	QDRQKDSMKWQZAD-HKUYNNGSSA-N	0	3	347.462	3.355	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2c(C)c(F)ccc2Cl)C[C@H]1C	ZINC000947467591	1333139433	/nfs/dbraw/zinc/13/94/33/1333139433.db2.gz	CPHMTJYKBBQLIP-OCCSQVGLSA-N	0	3	336.838	3.394	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3c(o2)c(F)ccc3C)C[C@H]1C	ZINC000947560539	1333172267	/nfs/dbraw/zinc/17/22/67/1333172267.db2.gz	SCCVTZKHSQVHLU-HUUCEWRRSA-N	0	3	342.414	3.486	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2nc(Cl)sc2Cl)C[C@@H]1C	ZINC000947610939	1333191110	/nfs/dbraw/zinc/19/11/10/1333191110.db2.gz	DAYACAGIAZHURA-DTWKUNHWSA-N	0	3	334.272	3.219	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2nc(Cl)sc2Cl)C[C@H]1C	ZINC000947610941	1333191280	/nfs/dbraw/zinc/19/12/80/1333191280.db2.gz	DAYACAGIAZHURA-RKDXNWHRSA-N	0	3	334.272	3.219	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)C(C)(C)C2CC2)CCN1Cc1cccc(C#N)c1	ZINC000947632745	1333201580	/nfs/dbraw/zinc/20/15/80/1333201580.db2.gz	FOSQVMFJIKIARS-HNAYVOBHSA-N	0	3	339.483	3.464	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc3cccc(OC)c3o2)C[C@@H]1C	ZINC000947667605	1333215973	/nfs/dbraw/zinc/21/59/73/1333215973.db2.gz	RPQIDKTVPUKVSY-DZGCQCFKSA-N	0	3	328.412	3.210	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2c(C)[nH]c3ccccc32)C[C@@H]1C	ZINC000947669985	1333216294	/nfs/dbraw/zinc/21/62/94/1333216294.db2.gz	ASUYXVKKQYEXHA-DOTOQJQBSA-N	0	3	337.467	3.011	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3cccnc3C)[C@H](C)C2)C1	ZINC000947703456	1333234187	/nfs/dbraw/zinc/23/41/87/1333234187.db2.gz	YVODJMNEPVCAJL-QAPCUYQASA-N	0	3	327.472	3.215	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(F)c(Cl)c2)C[C@@H]1C	ZINC000947747345	1333248721	/nfs/dbraw/zinc/24/87/21/1333248721.db2.gz	WLGBFTWJYWNOHI-ZFWWWQNUSA-N	0	3	336.838	3.014	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2c[nH]c3c2cccc3C)C[C@@H]1C	ZINC000947776866	1333258415	/nfs/dbraw/zinc/25/84/15/1333258415.db2.gz	ZSMYUXCUVMMCHZ-WMZOPIPTSA-N	0	3	337.467	3.011	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2cccc3sccc32)C[C@@H]1C	ZINC000947780211	1333259685	/nfs/dbraw/zinc/25/96/85/1333259685.db2.gz	XVOYKLHWTZLZMA-GOEBONIOSA-N	0	3	326.465	3.046	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2[nH]ccc2-c2ccccc2)C[C@@H]1C	ZINC000947916366	1333306797	/nfs/dbraw/zinc/30/67/97/1333306797.db2.gz	QMWZNILNXQVTJO-WMZOPIPTSA-N	0	3	335.451	3.288	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2sccc2C(F)F)C[C@@H]1C	ZINC000947984209	1333331005	/nfs/dbraw/zinc/33/10/05/1333331005.db2.gz	GCORKOTUAWLEDA-RYUDHWBXSA-N	0	3	326.412	3.292	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccsc2C(F)F)C[C@@H]1C	ZINC000947983497	1333331132	/nfs/dbraw/zinc/33/11/32/1333331132.db2.gz	BDKRVQFBQHOQJF-RYUDHWBXSA-N	0	3	326.412	3.292	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)nc3ccccc32)C[C@@H]1C	ZINC000947997650	1333336331	/nfs/dbraw/zinc/33/63/31/1333336331.db2.gz	FAMUAYYOGAASLD-DLBZAZTESA-N	0	3	335.451	3.149	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(F)c(F)cc2Cl)C[C@H]1C	ZINC000947999005	1333336990	/nfs/dbraw/zinc/33/69/90/1333336990.db2.gz	RZYBESCCUOWXPT-GHMZBOCLSA-N	0	3	328.790	3.387	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(OC(C)C)cc2)C[C@H]1C	ZINC000948003072	1333339279	/nfs/dbraw/zinc/33/92/79/1333339279.db2.gz	XULDSQGJTXUHCB-SJLPKXTDSA-N	0	3	328.456	3.080	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)n(C(C)C)c2C)C[C@@H]1C	ZINC000948017691	1333343688	/nfs/dbraw/zinc/34/36/88/1333343688.db2.gz	WOKSAUXNNFHRBL-MAUKXSAKSA-N	0	3	329.488	3.292	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2sc(Cl)nc2Cl)C[C@@H]1C	ZINC000948044344	1333352058	/nfs/dbraw/zinc/35/20/58/1333352058.db2.gz	PHHNETUOSWBYKV-DTWKUNHWSA-N	0	3	334.272	3.219	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C(F)(F)F)s2)C[C@H]1C	ZINC000948083342	1333370306	/nfs/dbraw/zinc/37/03/06/1333370306.db2.gz	ROUNKKRSECNNHL-NEPJUHHUSA-N	0	3	344.402	3.373	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(-c3ccccc3)[nH]2)C[C@@H]1C	ZINC000948094499	1333372813	/nfs/dbraw/zinc/37/28/13/1333372813.db2.gz	LQFUORMMVDRHOT-WMZOPIPTSA-N	0	3	335.451	3.288	20	30		EGEDHN
CN(C(=O)[C@@H]1CC1(C)C)[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948306794	1333473969	/nfs/dbraw/zinc/47/39/69/1333473969.db2.gz	PKOZTYIOTWVTAI-MOPGFXCFSA-N	0	3	339.483	3.417	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2cccc(C(F)F)c2F)CC1	ZINC000948378068	1333502387	/nfs/dbraw/zinc/50/23/87/1333502387.db2.gz	PZDVDWBXHBPWGJ-ZDUSSCGKSA-N	0	3	338.373	3.323	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2ccoc2C(F)(F)F)CC1	ZINC000948412262	1333515495	/nfs/dbraw/zinc/51/54/95/1333515495.db2.gz	JGJXRQYNDKAUNJ-ZDUSSCGKSA-N	0	3	342.361	3.248	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)C2C3CC4CC(C3)CC2C4)CC1	ZINC000948439063	1333525925	/nfs/dbraw/zinc/52/59/25/1333525925.db2.gz	GUHRRMFUGTXZJJ-OPFHRDBUSA-N	0	3	342.527	3.395	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)[C@@H]2CCCC[C@H]2C(F)(F)F)CC1	ZINC000948448718	1333530432	/nfs/dbraw/zinc/53/04/32/1333530432.db2.gz	HGQWNJBTBOCSGP-BZUAXINKSA-N	0	3	344.421	3.301	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2nc(C(C)(C)C)cs2)CC1	ZINC000948457447	1333533885	/nfs/dbraw/zinc/53/38/85/1333533885.db2.gz	VMMPRTJOEVBTPN-HNNXBMFYSA-N	0	3	347.528	3.390	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cc(C)c3ccccc3n2)CC1	ZINC000948547203	1333568417	/nfs/dbraw/zinc/56/84/17/1333568417.db2.gz	SRSXUVWLQCUBLG-SFHVURJKSA-N	0	3	349.478	3.493	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2cccc(-n3cccc3)c2)CC1	ZINC000948591329	1333587447	/nfs/dbraw/zinc/58/74/47/1333587447.db2.gz	UZCBKHDCIOQVKQ-LJQANCHMSA-N	0	3	335.451	3.037	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)[C@@H]2CCc3cc(F)ccc32)CC1	ZINC000948621634	1333600324	/nfs/dbraw/zinc/60/03/24/1333600324.db2.gz	SMSZXNJUBGYFRL-AZUAARDMSA-N	0	3	342.458	3.192	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2cc3c(o2)c(F)ccc3C)CC1	ZINC000948647466	1333611119	/nfs/dbraw/zinc/61/11/19/1333611119.db2.gz	IHQAXUXIFOMJBJ-OAHLLOKOSA-N	0	3	342.414	3.440	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2ccc(C(C)C)cn2)CC1	ZINC000948775444	1333673827	/nfs/dbraw/zinc/67/38/27/1333673827.db2.gz	IRCIVOJRAKUDEG-SFHVURJKSA-N	0	3	327.472	3.155	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N(C)[C@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948796483	1333682334	/nfs/dbraw/zinc/68/23/34/1333682334.db2.gz	IMVLXWSVCXVZFQ-HSALFYBXSA-N	0	3	339.483	3.417	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cc(F)cc(Cl)c2)CC1	ZINC000948805065	1333688096	/nfs/dbraw/zinc/68/80/96/1333688096.db2.gz	VLUCYQXFNDJMSQ-KRWDZBQOSA-N	0	3	336.838	3.429	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2ccc(OCC)c(C)c2)CC1	ZINC000948824630	1333698763	/nfs/dbraw/zinc/69/87/63/1333698763.db2.gz	KHANQSJGNFDQGL-LJQANCHMSA-N	0	3	342.483	3.344	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2sc(C)cc2OC)CC1	ZINC000948829859	1333702207	/nfs/dbraw/zinc/70/22/07/1333702207.db2.gz	XXAMMQYCEMIPFN-OAHLLOKOSA-N	0	3	334.485	3.015	20	30		EGEDHN
CCCCN1CCc2ccccc2[C@H]1CNC(=O)c1cc(C#N)c[nH]1	ZINC000948901808	1333726522	/nfs/dbraw/zinc/72/65/22/1333726522.db2.gz	DIGBRBZKQLQNOU-LJQANCHMSA-N	0	3	336.439	3.016	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NC[C@H]1c2ccccc2CCN1CCC	ZINC000948919931	1333734498	/nfs/dbraw/zinc/73/44/98/1333734498.db2.gz	UEBZWSNBHQKAKW-AABGKKOBSA-N	0	3	342.483	3.093	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C3CC(C)(C)C3)CC2)C1	ZINC000949354958	1333829206	/nfs/dbraw/zinc/82/92/06/1333829206.db2.gz	BAZUCDGQXLTKJE-UHFFFAOYSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)c3ccoc3CC)CC2)C1	ZINC000949355145	1333829509	/nfs/dbraw/zinc/82/95/09/1333829509.db2.gz	HEABZMFGNBLLBE-UHFFFAOYSA-N	0	3	346.471	3.115	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@@]3(C)CC=CCC3)CC2)C1	ZINC000949375979	1333833735	/nfs/dbraw/zinc/83/37/35/1333833735.db2.gz	LRBLGOAZBXWVGT-FQEVSTJZSA-N	0	3	346.515	3.392	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C[C@H]3CC[C@@H](C)C3)CC2)C1	ZINC000949445046	1333849280	/nfs/dbraw/zinc/84/92/80/1333849280.db2.gz	SPGZAUVPTSBOFW-MOPGFXCFSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C3CC(C(C)(C)C)C3)CC2)C1	ZINC000949531697	1333868858	/nfs/dbraw/zinc/86/88/58/1333868858.db2.gz	PIGWXGZPGYUWNF-UHFFFAOYSA-N	0	3	348.531	3.328	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2cc(Cl)c(Cl)[nH]2)C1	ZINC000967527103	1335768109	/nfs/dbraw/zinc/76/81/09/1335768109.db2.gz	PSTCOEUSAIAUJQ-MFKMUULPSA-N	0	3	330.259	3.338	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2c[nH]nc2-c2ccccc2)C1	ZINC000967553463	1335775784	/nfs/dbraw/zinc/77/57/84/1335775784.db2.gz	APXNRLQHPXLLCO-YJBOKZPZSA-N	0	3	338.455	3.093	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2oc3ccccc3c2OC)C1	ZINC000967726501	1335807759	/nfs/dbraw/zinc/80/77/59/1335807759.db2.gz	VYURUSISCKSYNB-GOEBONIOSA-N	0	3	342.439	3.458	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2csc(-c3ccco3)n2)C1	ZINC000968078826	1335854257	/nfs/dbraw/zinc/85/42/57/1335854257.db2.gz	LVGSVAVPOVMJFS-UONOGXRCSA-N	0	3	345.468	3.419	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccc3sccc3c2)C1	ZINC000968489677	1335939413	/nfs/dbraw/zinc/93/94/13/1335939413.db2.gz	SGAJDLIGXICJCC-YOEHRIQHSA-N	0	3	326.465	3.365	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccc3sccc3c2)C1	ZINC000968489675	1335939754	/nfs/dbraw/zinc/93/97/54/1335939754.db2.gz	SGAJDLIGXICJCC-RHSMWYFYSA-N	0	3	326.465	3.365	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)C(C)(C)c2cccc(OC)c2)C1	ZINC000968501044	1335943706	/nfs/dbraw/zinc/94/37/06/1335943706.db2.gz	ODUKJAKAPZSAKO-LPHOPBHVSA-N	0	3	344.499	3.376	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2ccoc2Br)C1	ZINC000968503893	1335944720	/nfs/dbraw/zinc/94/47/20/1335944720.db2.gz	CAFBUHNQPXDRHH-WCQYABFASA-N	0	3	341.249	3.058	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2ccc3ccn(C)c3c2)C1	ZINC000968506085	1335946180	/nfs/dbraw/zinc/94/61/80/1335946180.db2.gz	RVWWBCLFHOGPKB-QAPCUYQASA-N	0	3	325.456	3.195	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)C2(c3cccc(C)c3)CC2)C1	ZINC000968682166	1336008687	/nfs/dbraw/zinc/00/86/87/1336008687.db2.gz	OXOTWUDGVIXXAW-IEBWSBKVSA-N	0	3	326.484	3.429	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2cccc3oc(C)nc32)C1	ZINC000968688932	1336012442	/nfs/dbraw/zinc/01/24/42/1336012442.db2.gz	QJWBNLCVCYWDAH-CJNGLKHVSA-N	0	3	327.428	3.153	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ncn2cc(Cl)ccc12	ZINC000968864599	1336071970	/nfs/dbraw/zinc/07/19/70/1336071970.db2.gz	YKUMHWAUCMFQMM-HNNXBMFYSA-N	0	3	346.862	3.148	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1c(Cl)n[nH]c1C1CC1	ZINC000968891049	1336082537	/nfs/dbraw/zinc/08/25/37/1336082537.db2.gz	RTBCYJZICKBAFJ-ZDUSSCGKSA-N	0	3	336.867	3.101	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccc2oc(C)nc2c1	ZINC000968910519	1336086107	/nfs/dbraw/zinc/08/61/07/1336086107.db2.gz	WPFZFBJYXIGKLB-INIZCTEOSA-N	0	3	327.428	3.297	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cc(C(C)C)nn1CC	ZINC000968931391	1336094591	/nfs/dbraw/zinc/09/45/91/1336094591.db2.gz	MZHXHZJECFNVRN-MRXNPFEDSA-N	0	3	332.492	3.187	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000968954273	1336101623	/nfs/dbraw/zinc/10/16/23/1336101623.db2.gz	AHUIBBXWCJAPTA-DOTOQJQBSA-N	0	3	328.456	3.170	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cnc(-c2ccccc2)[nH]1	ZINC000969053895	1336130258	/nfs/dbraw/zinc/13/02/58/1336130258.db2.gz	NSXWNEBBYCNLIQ-QGZVFWFLSA-N	0	3	338.455	3.237	20	30		EGEDHN
C#CCCN1CCCCC[C@@H]1CNC(=O)c1sc(C)cc1OC	ZINC000969056570	1336131478	/nfs/dbraw/zinc/13/14/78/1336131478.db2.gz	KCYBCDZMJUFDCK-OAHLLOKOSA-N	0	3	334.485	3.063	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(C(=O)C[C@@H]3C=CCCC3)C2)cc1F	ZINC000969063387	1336135672	/nfs/dbraw/zinc/13/56/72/1336135672.db2.gz	LMJAYOHKBHJPIX-CRAIPNDOSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ncccc1OC(C)C	ZINC000969133668	1336155409	/nfs/dbraw/zinc/15/54/09/1336155409.db2.gz	RZLWQDMUMGWJQS-MRXNPFEDSA-N	0	3	331.460	3.029	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccc2ncsc2c1	ZINC000969133504	1336155616	/nfs/dbraw/zinc/15/56/16/1336155616.db2.gz	NYNBCMWJEDUSOL-OAHLLOKOSA-N	0	3	329.469	3.457	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1cnc(C(C)(C)C)nc1	ZINC000969163308	1336168820	/nfs/dbraw/zinc/16/88/20/1336168820.db2.gz	GKLFKXYQOPZKHZ-KRWDZBQOSA-N	0	3	344.503	3.325	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](NCc3ccccc3OC3CC3)C2)C1	ZINC000969883890	1336257181	/nfs/dbraw/zinc/25/71/81/1336257181.db2.gz	BUCRCHBRSRLSHB-QGZVFWFLSA-N	0	3	340.467	3.275	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)[C@@H]2CCc3c2cccc3Cl)C1	ZINC000970169018	1336287923	/nfs/dbraw/zinc/28/79/23/1336287923.db2.gz	JKTMIUCPEBZUHK-SUMWQHHRSA-N	0	3	332.875	3.382	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)[C@H]2CCc3c2cccc3Cl)C1	ZINC000970169017	1336288103	/nfs/dbraw/zinc/28/81/03/1336288103.db2.gz	JKTMIUCPEBZUHK-GUYCJALGSA-N	0	3	332.875	3.382	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)c2cnc3ccc(F)cc3c2)C1	ZINC000970690400	1336333680	/nfs/dbraw/zinc/33/36/80/1336333680.db2.gz	OUWUECUXGJBNFA-CYBMUJFWSA-N	0	3	327.403	3.000	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCN(C(=O)C2=CCCCCC2)C1	ZINC000971403250	1336341712	/nfs/dbraw/zinc/34/17/12/1336341712.db2.gz	GYPXZZGBFMUVJW-HXUWFJFHSA-N	0	3	337.467	3.481	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)[C@@H]2CC[C@H]2c2ccc(F)cc2)CC1	ZINC001005753702	1336398873	/nfs/dbraw/zinc/39/88/73/1336398873.db2.gz	GLFNGIGVBQTTIL-RBUKOAKNSA-N	0	3	330.447	3.428	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)C[C@@H]2C[C@H]2Cc2ccccc2)CC1	ZINC001005756472	1336399404	/nfs/dbraw/zinc/39/94/04/1336399404.db2.gz	PZAZKAFBPRVTNR-MOPGFXCFSA-N	0	3	326.484	3.364	20	30		EGEDHN
C[C@H]1C[C@@H]1CC(=O)N(C)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001005929653	1336423691	/nfs/dbraw/zinc/42/36/91/1336423691.db2.gz	KRUHYCCSYCPEFL-MAUKXSAKSA-N	0	3	325.456	3.027	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2c(F)cc(OC)cc2F)CC1	ZINC001006021037	1336438369	/nfs/dbraw/zinc/43/83/69/1336438369.db2.gz	WOFBTBFNSXBTIY-UHFFFAOYSA-N	0	3	338.398	3.086	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccn(C(CC)CC)n2)CC1	ZINC001006083020	1336449467	/nfs/dbraw/zinc/44/94/67/1336449467.db2.gz	HAKVFSUAJPTJIS-UHFFFAOYSA-N	0	3	332.492	3.357	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cncc(C(F)(F)F)c2)CC1	ZINC001006241684	1336474700	/nfs/dbraw/zinc/47/47/00/1336474700.db2.gz	UPNMDRKDMSFUAC-UHFFFAOYSA-N	0	3	341.377	3.213	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cc(F)c(F)cc2Cl)CC1	ZINC001006364333	1336495692	/nfs/dbraw/zinc/49/56/92/1336495692.db2.gz	NJEGTSXJMFEABJ-UHFFFAOYSA-N	0	3	328.790	3.341	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2ccc(OC3CCC3)cc2)CC1	ZINC001006434723	1336505414	/nfs/dbraw/zinc/50/54/14/1336505414.db2.gz	LMYBXHLJPLRKLF-UHFFFAOYSA-N	0	3	328.456	3.340	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2c[nH]c3c2cccc3CC)CC1	ZINC001006447572	1336507985	/nfs/dbraw/zinc/50/79/85/1336507985.db2.gz	WZIMGAWFKYKODS-UHFFFAOYSA-N	0	3	325.456	3.453	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)c2cn(C)c3ccc(F)cc23)C1	ZINC001007514952	1336662637	/nfs/dbraw/zinc/66/26/37/1336662637.db2.gz	PQHFLDTXRHBZQQ-HNNXBMFYSA-N	0	3	329.419	3.088	20	30		EGEDHN
C=C(C)CCN1CCC[C@H](NC(=O)c2noc3c2CC(C)(C)CC3)C1	ZINC001008048124	1336758266	/nfs/dbraw/zinc/75/82/66/1336758266.db2.gz	QVIJALZXWHHYQZ-HNNXBMFYSA-N	0	3	345.487	3.350	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)c2ccc(F)c3ccncc23)C1	ZINC001008269882	1336810940	/nfs/dbraw/zinc/81/09/40/1336810940.db2.gz	QRKLCDPQZLDXMN-AWEZNQCLSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCCN(CCc3ccc(C)cc3)C2)C1	ZINC001008466399	1336863513	/nfs/dbraw/zinc/86/35/13/1336863513.db2.gz	WERNPPQPKXDTET-IBGZPJMESA-N	0	3	326.484	3.474	20	30		EGEDHN
C#CCCN1CCC[C@@H](NC(=O)CC23CC4CC(CC(C4)C2)C3)C1	ZINC001009319120	1337005821	/nfs/dbraw/zinc/00/58/21/1337005821.db2.gz	PRZDECNPGQUQTN-VJJCQHNBSA-N	0	3	328.500	3.197	20	30		EGEDHN
CC(C)c1ccccc1CN1CC[C@H](NC(=O)c2c[nH]c(C#N)c2)C1	ZINC001010695952	1337242201	/nfs/dbraw/zinc/24/22/01/1337242201.db2.gz	FLPOFFDOJLFKNT-KRWDZBQOSA-N	0	3	336.439	3.014	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(CCc3ccc(C)cc3)C2)cc1	ZINC001015481426	1338155500	/nfs/dbraw/zinc/15/55/00/1338155500.db2.gz	GBPPELQNYNFMGI-OAQYLSRUSA-N	0	3	332.447	3.023	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN([C@@H](CC)c3ccccc3)C2)cn1	ZINC001016016815	1338407802	/nfs/dbraw/zinc/40/78/02/1338407802.db2.gz	OCUIVGYPMQFMSC-PMACEKPBSA-N	0	3	333.435	3.018	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cccc(Cl)c2C)CC1	ZINC001016634441	1338670885	/nfs/dbraw/zinc/67/08/85/1338670885.db2.gz	RYKBLLJKAFVURK-QGZVFWFLSA-N	0	3	330.859	3.256	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)Cc2cccc(C(F)F)c2)CC1	ZINC001016722645	1338702312	/nfs/dbraw/zinc/70/23/12/1338702312.db2.gz	BIJWQYMPNBDPGE-QGZVFWFLSA-N	0	3	346.421	3.161	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccc(Cl)c(C)c2)CC1	ZINC001016806167	1338732723	/nfs/dbraw/zinc/73/27/23/1338732723.db2.gz	HFYZDVZASKTOSN-QGZVFWFLSA-N	0	3	330.859	3.256	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CC23CCN(Cc2cncc(C)c2)CC3)C1	ZINC001016811157	1338734148	/nfs/dbraw/zinc/73/41/48/1338734148.db2.gz	ADKIEEXKSZJZAO-GOSISDBHSA-N	0	3	339.483	3.217	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)C(C)(C)c2cccc(Cl)c2)CC1	ZINC001016859107	1338749800	/nfs/dbraw/zinc/74/98/00/1338749800.db2.gz	LEQCUFNTNOKHIW-KRWDZBQOSA-N	0	3	344.886	3.222	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2)CC1	ZINC001016869960	1338753500	/nfs/dbraw/zinc/75/35/00/1338753500.db2.gz	NSAWAZZJKPSRKB-KSZLIROESA-N	0	3	342.870	3.047	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)C(C)(C)c2ccccc2Cl)CC1	ZINC001016934849	1338774557	/nfs/dbraw/zinc/77/45/57/1338774557.db2.gz	WCBSCPHYBBRNDQ-KRWDZBQOSA-N	0	3	344.886	3.222	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)Cc2cccc3ccccc32)CC1	ZINC001016941370	1338777518	/nfs/dbraw/zinc/77/75/18/1338777518.db2.gz	YFIRRGXOLNIGGQ-OAQYLSRUSA-N	0	3	346.474	3.376	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2sc(C(C)C)nc2C)CC1	ZINC001016970719	1338787321	/nfs/dbraw/zinc/78/73/21/1338787321.db2.gz	DTEPHJLXFBVAOS-OAHLLOKOSA-N	0	3	345.512	3.183	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2sc(C(C)C)nc2C)CC1	ZINC001016970718	1338787582	/nfs/dbraw/zinc/78/75/82/1338787582.db2.gz	DTEPHJLXFBVAOS-HNNXBMFYSA-N	0	3	345.512	3.183	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2ccc(C(C)(C)C)s2)CC1	ZINC001016986847	1338793747	/nfs/dbraw/zinc/79/37/47/1338793747.db2.gz	RBRBDPWARDMJJQ-OAHLLOKOSA-N	0	3	330.497	3.263	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccc(-c3ccccc3)[nH]2)CC1	ZINC001016998268	1338799266	/nfs/dbraw/zinc/79/92/66/1338799266.db2.gz	PIXUTJNCIMZZRO-HXUWFJFHSA-N	0	3	347.462	3.289	20	30		EGEDHN
Cc1ccc(CN(C)C[C@H]2CCCN(C(=O)[C@H](C)C#N)C2)c(Cl)c1	ZINC001017070869	1338847868	/nfs/dbraw/zinc/84/78/68/1338847868.db2.gz	JEYCQUHVUIZBMF-HZPDHXFCSA-N	0	3	347.890	3.479	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCCN(C(=O)C2=CCCC2)C1	ZINC001017105563	1338870580	/nfs/dbraw/zinc/87/05/80/1338870580.db2.gz	YQTKFGJEMCFDJW-OAHLLOKOSA-N	0	3	343.496	3.400	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H](CN(C)Cc2ccc(F)cn2)C1	ZINC001017202288	1338947159	/nfs/dbraw/zinc/94/71/59/1338947159.db2.gz	RZHCKYBRBFBZMH-OXJNMPFZSA-N	0	3	347.478	3.493	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H](CN(C)[C@H](C)c3cnccn3)C2)C1	ZINC001017208674	1338955036	/nfs/dbraw/zinc/95/50/36/1338955036.db2.gz	UBNOKMVXQGBNEO-SJORKVTESA-N	0	3	342.487	3.064	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccnn1C1CCCC1	ZINC001017592606	1339374855	/nfs/dbraw/zinc/37/48/55/1339374855.db2.gz	YREOHVBCMDPVJO-HDICACEKSA-N	0	3	342.487	3.253	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C1([C@H]2CCCCO2)CCC1	ZINC001017729362	1339405556	/nfs/dbraw/zinc/40/55/56/1339405556.db2.gz	AUFBLHKBRJTOLM-CEXWTWQISA-N	0	3	346.515	3.367	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc(C(F)F)cc1	ZINC001017730651	1339406252	/nfs/dbraw/zinc/40/62/52/1339406252.db2.gz	RLOURHLMKPNHMQ-CALCHBBNSA-N	0	3	334.410	3.418	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1CCOc2ccccc21	ZINC001018065679	1339494025	/nfs/dbraw/zinc/49/40/25/1339494025.db2.gz	WDZQZKUVNBFNBF-SCTDSRPQSA-N	0	3	340.467	3.194	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cc(C)n(CC2CC2)c1C	ZINC001018185191	1339524744	/nfs/dbraw/zinc/52/47/44/1339524744.db2.gz	ICNBDIAFTKJYGA-KDURUIRLSA-N	0	3	341.499	3.380	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc2c(c1)CCCC2	ZINC001018256011	1339551207	/nfs/dbraw/zinc/55/12/07/1339551207.db2.gz	LTHGTQBXZOTHFN-OYRHEFFESA-N	0	3	338.495	3.359	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc2c(c1)CCC2	ZINC001018259053	1339552561	/nfs/dbraw/zinc/55/25/61/1339552561.db2.gz	UQZKYYQPEBUIHD-OYRHEFFESA-N	0	3	338.495	3.359	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(N(C)C)c(F)c1	ZINC001018313382	1339572938	/nfs/dbraw/zinc/57/29/38/1339572938.db2.gz	NBKQOGUHTVZVMP-CALCHBBNSA-N	0	3	345.462	3.147	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1c(F)cccc1F	ZINC001028123242	1340442220	/nfs/dbraw/zinc/44/22/20/1340442220.db2.gz	PHZROVUCNBUBDD-RBSFLKMASA-N	0	3	334.410	3.225	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@H]2CCCN2Cc2cc(C)cc(C)c2)c1	ZINC001028128009	1340446925	/nfs/dbraw/zinc/44/69/25/1340446925.db2.gz	ZHZISFRMJZLSLC-OAQYLSRUSA-N	0	3	347.462	3.074	20	30		EGEDHN
CCc1ccccc1C(=O)NC[C@@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC001028767374	1340799592	/nfs/dbraw/zinc/79/95/92/1340799592.db2.gz	FEDMBBSNNQTISN-IBGZPJMESA-N	0	3	347.462	3.373	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)C1CCN(C(=O)[C@H]2CC2(C)C)CC1	ZINC001029083081	1340927051	/nfs/dbraw/zinc/92/70/51/1340927051.db2.gz	QSIKZXKLPBJFLX-HNAYVOBHSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC([C@H](C)NCc2nc(C)cs2)CC1	ZINC001029126857	1340936360	/nfs/dbraw/zinc/93/63/60/1340936360.db2.gz	ZFIUXNKPVHTHDY-AWEZNQCLSA-N	0	3	335.517	3.380	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC([C@H](C)NCc3cnc(C)o3)CC2)CC1	ZINC001029137213	1340940135	/nfs/dbraw/zinc/94/01/35/1340940135.db2.gz	TYFVCCJJHRMPGY-HNNXBMFYSA-N	0	3	345.487	3.446	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC([C@H](C)NCc3nccs3)CC2)C1	ZINC001029140769	1340941176	/nfs/dbraw/zinc/94/11/76/1340941176.db2.gz	GODRNIMNMPNZQP-AWEZNQCLSA-N	0	3	333.501	3.216	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CC[C@@H](C1)N2CCCC1CCOCC1	ZINC001029420148	1340986372	/nfs/dbraw/zinc/98/63/72/1340986372.db2.gz	RVFDVYLESCLOHN-KDURUIRLSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CC[C@@H](C1)N2C[C@@H](O)C1CCCCC1	ZINC001029454316	1340993580	/nfs/dbraw/zinc/99/35/80/1340993580.db2.gz	YPUNMVJQEUUMIC-HDAAZOAOSA-N	0	3	348.531	3.205	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCN(C(=O)C2CC(C)(C)C2)C1	ZINC001029726116	1341055103	/nfs/dbraw/zinc/05/51/03/1341055103.db2.gz	AIEDPUAXRFLBDH-AWEZNQCLSA-N	0	3	345.512	3.336	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCN(C(=O)C2CC(C)(C)C2)C1	ZINC001029726117	1341055289	/nfs/dbraw/zinc/05/52/89/1341055289.db2.gz	AIEDPUAXRFLBDH-CQSZACIVSA-N	0	3	345.512	3.336	20	30		EGEDHN
CCC1(C(=O)N2CC[C@H](CN(C)Cc3ccc(C#N)s3)C2)CCC1	ZINC001029811484	1341082095	/nfs/dbraw/zinc/08/20/95/1341082095.db2.gz	GLZLJYRAGGETOY-OAHLLOKOSA-N	0	3	345.512	3.480	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCN(C(=O)[C@H]2CCC2(C)C)C1	ZINC001029813210	1341083348	/nfs/dbraw/zinc/08/33/48/1341083348.db2.gz	RQARWQNRCNVANS-RHSMWYFYSA-N	0	3	345.512	3.336	20	30		EGEDHN
C=C(C)CN1CCC[C@H](N(Cc2ccccc2)C(=O)c2cc[nH]n2)C1	ZINC001029918141	1341118276	/nfs/dbraw/zinc/11/82/76/1341118276.db2.gz	XZZMXSLYUSUKBR-SFHVURJKSA-N	0	3	338.455	3.093	20	30		EGEDHN
C=C(C)CN1CCC[C@H](N(Cc2ccccc2)C(=O)c2ccn[nH]2)C1	ZINC001029918141	1341118277	/nfs/dbraw/zinc/11/82/77/1341118277.db2.gz	XZZMXSLYUSUKBR-SFHVURJKSA-N	0	3	338.455	3.093	20	30		EGEDHN
C#CCCN1CC(CNC(=O)[C@@H]2C[C@H]2c2ccc3ccccc3c2)C1	ZINC001032060903	1341447018	/nfs/dbraw/zinc/44/70/18/1341447018.db2.gz	KQURASSEXAGFQA-LEWJYISDSA-N	0	3	332.447	3.015	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)CC(C)(C)c1ccc(F)cc1	ZINC001032447393	1341512871	/nfs/dbraw/zinc/51/28/71/1341512871.db2.gz	KRJRONWQRYMHEI-ROUUACIJSA-N	0	3	330.447	3.355	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H]3C[C@H]2CN3C[C@H]2CCCC(F)(F)C2)C1	ZINC001032613972	1341559812	/nfs/dbraw/zinc/55/98/12/1341559812.db2.gz	FFMKSMJEFWUFQK-JYJNAYRXSA-N	0	3	338.442	3.453	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H](C)OC1CCCCCC1	ZINC001032618359	1341561409	/nfs/dbraw/zinc/56/14/09/1341561409.db2.gz	ULDBHEBSBHIYCK-BZSNNMDCSA-N	0	3	334.504	3.366	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N1C[C@@H]2C[C@H]1CN2CCC1CCCCCC1	ZINC001032637917	1341566624	/nfs/dbraw/zinc/56/66/24/1341566624.db2.gz	AZVNFUPFAXRNBD-HAGHYFMRSA-N	0	3	346.515	3.223	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C[C@H](C)c1ccccc1OC	ZINC001032737478	1341595686	/nfs/dbraw/zinc/59/56/86/1341595686.db2.gz	SHHBPXGQKAZZPF-BZSNNMDCSA-N	0	3	342.483	3.440	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H]1Cc2ccc(Cl)cc21	ZINC001032760077	1341605102	/nfs/dbraw/zinc/60/51/02/1341605102.db2.gz	MJGGHAIQSODOHG-XYJFISCASA-N	0	3	330.859	3.231	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H](C)Cc1ccc(F)cc1	ZINC001032812352	1341624777	/nfs/dbraw/zinc/62/47/77/1341624777.db2.gz	ZLISHWMEVPPHEQ-MNEFBYGVSA-N	0	3	330.447	3.256	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)Cc2coc3cc(F)ccc23)C1	ZINC001033082777	1341719226	/nfs/dbraw/zinc/71/92/26/1341719226.db2.gz	REZPJEVXCTYKFV-MRXNPFEDSA-N	0	3	330.403	3.223	20	30		EGEDHN
C=CCn1cccc1C(=O)N(C)[C@H]1CCN(Cc2ccccc2C)C1	ZINC001033144776	1341738703	/nfs/dbraw/zinc/73/87/03/1341738703.db2.gz	BRDMWZPDAMKWFN-IBGZPJMESA-N	0	3	337.467	3.329	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](N(C)C(=O)c2cc3cccnc3s2)C1	ZINC001033553593	1341869274	/nfs/dbraw/zinc/86/92/74/1341869274.db2.gz	WSBZNJPUXVPASH-OAHLLOKOSA-N	0	3	329.469	3.409	20	30		EGEDHN
C#CCCN1CC[C@@H](N(C)C(=O)c2coc3ccc(Cl)cc23)C1	ZINC001033623172	1341907073	/nfs/dbraw/zinc/90/70/73/1341907073.db2.gz	DJKSVLGGWWLPDU-CQSZACIVSA-N	0	3	330.815	3.256	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)Cc2ccc3c(c2)CCCC3)C1	ZINC001033655725	1341931698	/nfs/dbraw/zinc/93/16/98/1341931698.db2.gz	HKCGTRSKVSYZTB-HXUWFJFHSA-N	0	3	326.484	3.217	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2ccc(OCC3CC3)cc2)C1	ZINC001033667990	1341936337	/nfs/dbraw/zinc/93/63/37/1341936337.db2.gz	DGIOMVCTOQSNHJ-SFHVURJKSA-N	0	3	328.456	3.198	20	30		EGEDHN
C=CCCN1CC[C@H](N(CC)C(=O)c2oc(CC3CC3)nc2C)C1	ZINC001033837034	1342035587	/nfs/dbraw/zinc/03/55/87/1342035587.db2.gz	QPLRVSKXOFXWQD-INIZCTEOSA-N	0	3	331.460	3.048	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccc(C)c(NC(C)=O)c2)C1	ZINC001033851659	1342045029	/nfs/dbraw/zinc/04/50/29/1342045029.db2.gz	RMZHNKAGYPIYGL-GOSISDBHSA-N	0	3	343.471	3.066	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2ccc(C)c3cccnc23)C1	ZINC001033907512	1342079789	/nfs/dbraw/zinc/07/97/89/1342079789.db2.gz	UNJMPQHTXFIFAG-KRWDZBQOSA-N	0	3	335.451	3.103	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@@H]2CCc3cccc(OC)c32)C1	ZINC001033979069	1342127595	/nfs/dbraw/zinc/12/75/95/1342127595.db2.gz	FTVHNSVMTBJPOT-QZTJIDSGSA-N	0	3	342.483	3.224	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cnn(CC3CCCC3)c2)C1	ZINC001034006160	1342144085	/nfs/dbraw/zinc/14/40/85/1342144085.db2.gz	QJNHEBIGPJORMP-IBGZPJMESA-N	0	3	344.503	3.186	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cccc(NC(C)=O)c2C)C1	ZINC001034018828	1342155830	/nfs/dbraw/zinc/15/58/30/1342155830.db2.gz	JQCNRZRTIIEXGC-KRWDZBQOSA-N	0	3	343.471	3.066	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)C2CCC(C(F)F)CC2)C1	ZINC001034038842	1342179182	/nfs/dbraw/zinc/17/91/82/1342179182.db2.gz	XOCPBWAYBKPCLR-UYSNPLJNSA-N	0	3	326.431	3.004	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)C2(c3ccc(F)cc3)CC2)C1	ZINC001034230312	1342334517	/nfs/dbraw/zinc/33/45/17/1342334517.db2.gz	CIPJAFQDKWRRGG-SFHVURJKSA-N	0	3	330.447	3.404	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cc(Cl)c(Cl)[nH]2)C1	ZINC001034331019	1342405915	/nfs/dbraw/zinc/40/59/15/1342405915.db2.gz	TYEXOHYYXLVANN-LLVKDONJSA-N	0	3	330.259	3.482	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)C2(c3cccnc3)CCCC2)C1	ZINC001034365132	1342435594	/nfs/dbraw/zinc/43/55/94/1342435594.db2.gz	PNRJCZWCEMMVIF-IBGZPJMESA-N	0	3	341.499	3.440	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)Cc2c(C)[nH]c3ccccc32)C1	ZINC001034376234	1342445432	/nfs/dbraw/zinc/44/54/32/1342445432.db2.gz	SZZIJACWRPVHRA-MRXNPFEDSA-N	0	3	325.456	3.176	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cnn(CCCC)c2CC)C1	ZINC001034482394	1342539723	/nfs/dbraw/zinc/53/97/23/1342539723.db2.gz	BSMCANQWAOWNIR-QGZVFWFLSA-N	0	3	346.519	3.406	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)Cc2ccc3c(c2)CCCC3)C1	ZINC001034519770	1342578491	/nfs/dbraw/zinc/57/84/91/1342578491.db2.gz	LTEDOMFAHIWBOI-FQEVSTJZSA-N	0	3	326.484	3.265	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2csc3c2CCCC3)C1	ZINC001034522537	1342580818	/nfs/dbraw/zinc/58/08/18/1342580818.db2.gz	WKHFFEVCMFRIGC-HNNXBMFYSA-N	0	3	330.497	3.235	20	30		EGEDHN
C=CCCN1CCCC[C@@H](NC(=O)c2ccc(P(C)(C)=O)cc2)C1	ZINC001034537535	1342594428	/nfs/dbraw/zinc/59/44/28/1342594428.db2.gz	MMKYWXOOKNVRPP-QGZVFWFLSA-N	0	3	348.427	3.095	20	30		EGEDHN
C=C(Cl)CN1CCCC[C@H](NC(=O)c2cccc(CN(C)C)c2)C1	ZINC001034537959	1342595111	/nfs/dbraw/zinc/59/51/11/1342595111.db2.gz	PGBZZDUKEMTIIY-SFHVURJKSA-N	0	3	349.906	3.085	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@H]2Cc3cc(C)c(C)cc3O2)C1	ZINC001034540735	1342599679	/nfs/dbraw/zinc/59/96/79/1342599679.db2.gz	JJFSKWDDVDJLCS-AZUAARDMSA-N	0	3	342.483	3.154	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)[C@@H]2CC=CCC2)CC1	ZINC001034593489	1342637846	/nfs/dbraw/zinc/63/78/46/1342637846.db2.gz	VSUTWHWPABQWJQ-RBSFLKMASA-N	0	3	341.293	3.268	20	30		EGEDHN
Cc1cccnc1C(=O)N[C@H]1CC[C@H](NCc2ccccc2C#N)CC1	ZINC001034620372	1342653716	/nfs/dbraw/zinc/65/37/16/1342653716.db2.gz	NXSBWEOTTHCDPS-WGSAOQKQSA-N	0	3	348.450	3.093	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)C2CCCCC2)s1	ZINC001034846892	1342799774	/nfs/dbraw/zinc/79/97/74/1342799774.db2.gz	DDVSNOILXNJJRD-OAHLLOKOSA-N	0	3	331.485	3.281	20	30		EGEDHN
C/C(=C\C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)cc1F)C1CC1	ZINC001034873663	1342816258	/nfs/dbraw/zinc/81/62/58/1342816258.db2.gz	LTWVGKODDDTNDK-MOVXZBDNSA-N	0	3	341.430	3.134	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)cc1F)C1CCC1	ZINC001034973972	1342860014	/nfs/dbraw/zinc/86/00/14/1342860014.db2.gz	NYPFYLYDBZSFAJ-RDTXWAMCSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2nc(C)c(C)s2)C12CCC2	ZINC001078812005	1357093739	/nfs/dbraw/zinc/09/37/39/1357093739.db2.gz	CJIKPZFKEBOVSZ-CHWSQXEVSA-N	0	3	339.892	3.143	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cc3ccccc3nc1C)CC2	ZINC001035718339	1343150220	/nfs/dbraw/zinc/15/02/20/1343150220.db2.gz	DLFYABFELZTALV-UHFFFAOYSA-N	0	3	347.462	3.105	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@@H](c1ccccc1)C1CC1)CC2	ZINC001035748763	1343167410	/nfs/dbraw/zinc/16/74/10/1343167410.db2.gz	GXXOXOWYNCPYHA-FQEVSTJZSA-N	0	3	336.479	3.128	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H](c1ccncc1)C(C)C)CC2	ZINC001035779411	1343190151	/nfs/dbraw/zinc/19/01/51/1343190151.db2.gz	PRBRCJXUANSDOY-LJQANCHMSA-N	0	3	341.499	3.322	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC2(CN(C[C@@H]3CCCCO3)C2)CC1	ZINC001035785506	1343196505	/nfs/dbraw/zinc/19/65/05/1343196505.db2.gz	ULZSPKBDDKQUJJ-HKUYNNGSSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc(C)c(F)c1F)CC2	ZINC001035802838	1343205841	/nfs/dbraw/zinc/20/58/41/1343205841.db2.gz	BSRWCYFRRLWDDK-UHFFFAOYSA-N	0	3	334.410	3.387	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc([C@@H](C)CC)no1)CC2	ZINC001035813433	1343212316	/nfs/dbraw/zinc/21/23/16/1343212316.db2.gz	HVVOBTYEAFVOCO-HNNXBMFYSA-N	0	3	331.460	3.302	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C[C@@H]1CCO[C@H](C(C)C)C1)CC2	ZINC001035832289	1343219913	/nfs/dbraw/zinc/21/99/13/1343219913.db2.gz	FXSNCOIQIUUPDB-MOPGFXCFSA-N	0	3	348.531	3.328	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc(Cl)ccc1OC)CC2	ZINC001035847035	1343227576	/nfs/dbraw/zinc/22/75/76/1343227576.db2.gz	FGORSOMRBLIKAM-UHFFFAOYSA-N	0	3	348.874	3.463	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2CCCC2)CC[C@H]1NCc1ccccc1C#N	ZINC001035919919	1343272646	/nfs/dbraw/zinc/27/26/46/1343272646.db2.gz	XHBGYQUEXCHZHK-OXQOHEQNSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@H](NCc2ccccc2C#N)[C@H](C)C1	ZINC001035981584	1343299265	/nfs/dbraw/zinc/29/92/65/1343299265.db2.gz	SVCMBLOTPJITNO-PBHICJAKSA-N	0	3	329.419	3.148	20	30		EGEDHN
C[C@@H]1CN(C(=O)C=C2CCC2)CC[C@H]1NCc1cc(F)ccc1C#N	ZINC001035994857	1343305790	/nfs/dbraw/zinc/30/57/90/1343305790.db2.gz	ZNJUYGNVDHAFFB-AUUYWEPGSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](NCc3csc(C)n3)[C@H](C)C2)C1	ZINC001036167072	1343340341	/nfs/dbraw/zinc/34/03/41/1343340341.db2.gz	CPVXYYROEXXERV-CZUORRHYSA-N	0	3	333.501	3.134	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](NCc3csc(CC)n3)[C@H](C)C2)C1	ZINC001036169766	1343342497	/nfs/dbraw/zinc/34/24/97/1343342497.db2.gz	NSLIMIQWVQIHET-ZBFHGGJFSA-N	0	3	347.528	3.388	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]([C@H](C)NCc2ccn(C(C)C)n2)C1	ZINC001036425777	1343479144	/nfs/dbraw/zinc/47/91/44/1343479144.db2.gz	CGNRYQQVPTUMMR-DLBZAZTESA-N	0	3	346.519	3.393	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCCN(C(=O)C2(CF)CC2)C1	ZINC001036450351	1343494649	/nfs/dbraw/zinc/49/46/49/1343494649.db2.gz	KSDDSUHRDLBISZ-MAUKXSAKSA-N	0	3	343.446	3.025	20	30		EGEDHN
CC(C)C(=O)N1CC[C@H]2[C@H](CCN2CC#Cc2cccc(Cl)c2)C1	ZINC001036648965	1343599165	/nfs/dbraw/zinc/59/91/65/1343599165.db2.gz	PWAJUXZXFHORPB-MJGOQNOKSA-N	0	3	344.886	3.270	20	30		EGEDHN
C/C=C(/C)C(=O)N1CC[C@@H]2[C@H](CCN2CC#Cc2ccc(F)cc2)C1	ZINC001036683599	1343626576	/nfs/dbraw/zinc/62/65/76/1343626576.db2.gz	VGCUXRVZLPRAOC-DLLRLPTMSA-N	0	3	340.442	3.066	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@H]2CN(C(=O)C3=CCCC3)CC[C@@H]21	ZINC001036686795	1343629624	/nfs/dbraw/zinc/62/96/24/1343629624.db2.gz	SKZNABJYQWBVMO-PMACEKPBSA-N	0	3	335.451	3.091	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@@H]2CN(C(=O)C=C3CCC3)CC[C@@H]21	ZINC001036688976	1343632384	/nfs/dbraw/zinc/63/23/84/1343632384.db2.gz	BCBGIGCGFAHMAI-UXHICEINSA-N	0	3	335.451	3.091	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2[C@@H](CCN2Cc2cc(C)ns2)C1	ZINC001036789193	1343718228	/nfs/dbraw/zinc/71/82/28/1343718228.db2.gz	NMAXUUDMIHEADC-HOCLYGCPSA-N	0	3	333.501	3.087	20	30		EGEDHN
CCC1(C(=O)N2CC[C@H]3[C@@H](CCN3CC#Cc3ccccc3)C2)CC1	ZINC001036812339	1343747820	/nfs/dbraw/zinc/74/78/20/1343747820.db2.gz	GAGDKZSHMPZSMQ-PMACEKPBSA-N	0	3	336.479	3.151	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCC[C@@H]1NC(=O)C1CCCC1	ZINC001036923040	1343867013	/nfs/dbraw/zinc/86/70/13/1343867013.db2.gz	ZLKOHELCWIRTMQ-OALUTQOASA-N	0	3	325.456	3.123	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@H]1CCC[C@@H]1NC(=O)CC1CCC1	ZINC001036970999	1343900155	/nfs/dbraw/zinc/90/01/55/1343900155.db2.gz	VDXAOAHNIQOVOS-APWZRJJASA-N	0	3	343.446	3.262	20	30		EGEDHN
Cc1cocc1C(=O)N[C@@H]1CCC[C@@H]1CNCc1ccccc1C#N	ZINC001037057924	1343954163	/nfs/dbraw/zinc/95/41/63/1343954163.db2.gz	BVYXPJDOZHZPEC-IEBWSBKVSA-N	0	3	337.423	3.148	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCC[C@H]2CNCc2ocnc2C)CC1	ZINC001037070797	1343963557	/nfs/dbraw/zinc/96/35/57/1343963557.db2.gz	WXIOWQJLBCQQDW-IRXDYDNUSA-N	0	3	331.460	3.104	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCC[C@H]2CNCc2ocnc2C)CC1	ZINC001037070795	1343964262	/nfs/dbraw/zinc/96/42/62/1343964262.db2.gz	WXIOWQJLBCQQDW-DLBZAZTESA-N	0	3	331.460	3.104	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCC[C@H]2CNCc2nc(C)c(C)s2)C1	ZINC001037075130	1343968644	/nfs/dbraw/zinc/96/86/44/1343968644.db2.gz	LXPCEUJHKJEJPL-JKSUJKDBSA-N	0	3	347.528	3.491	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](NCc2cscn2)[C@@H](CC)C1	ZINC001037894430	1344165942	/nfs/dbraw/zinc/16/59/42/1344165942.db2.gz	YZMSRPQBTIZCHJ-HOCLYGCPSA-N	0	3	335.517	3.462	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1cc(F)c(Cl)cc1F	ZINC001038641567	1344518165	/nfs/dbraw/zinc/51/81/65/1344518165.db2.gz	OSCCTGFKNURVAJ-NSHDSACASA-N	0	3	328.790	3.389	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1cnc2ccc(F)cc2c1	ZINC001038880294	1344626875	/nfs/dbraw/zinc/62/68/75/1344626875.db2.gz	FBFTZASCZAPKIF-QGZVFWFLSA-N	0	3	327.403	3.144	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2ccsc2)CC[C@H]1c1ccc(F)cc1	ZINC001079148804	1357196667	/nfs/dbraw/zinc/19/66/67/1357196667.db2.gz	NEWCWFJRWQGSHL-ZWKOTPCHSA-N	0	3	342.439	3.108	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1ccccc1OCC1CC1	ZINC001039041485	1344729505	/nfs/dbraw/zinc/72/95/05/1344729505.db2.gz	DRTPAVNAFHNDKY-QGZVFWFLSA-N	0	3	328.456	3.246	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)CC(F)(F)F)CC2)C1	ZINC001039118700	1344791292	/nfs/dbraw/zinc/79/12/92/1344791292.db2.gz	DIVHLNGBPUANLB-ZDUSSCGKSA-N	0	3	338.801	3.252	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)/C=C/c3ccc[nH]3)CC2)C1	ZINC001039126766	1344803565	/nfs/dbraw/zinc/80/35/65/1344803565.db2.gz	IUEVSZPYRAXXEK-LAQIPUCWSA-N	0	3	347.890	3.341	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)C3CC(F)(F)C3)CC2)C1	ZINC001039128920	1344807517	/nfs/dbraw/zinc/80/75/17/1344807517.db2.gz	XGUAHANECZDBGG-CQSZACIVSA-N	0	3	346.849	3.345	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)CCn3cccc3)CC2)C1	ZINC001039166197	1344851937	/nfs/dbraw/zinc/85/19/37/1344851937.db2.gz	SKAFBKJQQWTAGQ-GOSISDBHSA-N	0	3	349.906	3.191	20	30		EGEDHN
CC(=O)N1CCCC[C@H]1[C@H]1CCN(CC#Cc2cccc(Cl)c2)C1	ZINC001039188380	1344890302	/nfs/dbraw/zinc/89/03/02/1344890302.db2.gz	KRQZEPVLNFVQGO-ICSRJNTNSA-N	0	3	344.886	3.414	20	30		EGEDHN
CC(C)C(=O)N1CCCC[C@H]1[C@@H]1CCN(Cc2ccc(C#N)s2)C1	ZINC001039188890	1344891508	/nfs/dbraw/zinc/89/15/08/1344891508.db2.gz	FNAJOKTVZQPXNK-QAPCUYQASA-N	0	3	345.512	3.479	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(C)oc2C)C1	ZINC001039191765	1344896312	/nfs/dbraw/zinc/89/63/12/1344896312.db2.gz	ALQKPZKGMLIFEM-MJGOQNOKSA-N	0	3	328.456	3.236	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)Cc2c(C)cccc2C)C1	ZINC001039210008	1344923723	/nfs/dbraw/zinc/92/37/23/1344923723.db2.gz	MEJCDUPYXCQTKC-TZIWHRDSSA-N	0	3	338.495	3.182	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc(C)cc(F)c2)C1	ZINC001039228685	1344948508	/nfs/dbraw/zinc/94/85/08/1344948508.db2.gz	HDQHLURCZLGANC-PXNSSMCTSA-N	0	3	342.458	3.474	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)CCc2cccs2)C1	ZINC001039238396	1344962256	/nfs/dbraw/zinc/96/22/56/1344962256.db2.gz	IDHICUKFUDBBOO-MJGOQNOKSA-N	0	3	344.524	3.407	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc(F)cc(F)c2)C1	ZINC001039240920	1344966390	/nfs/dbraw/zinc/96/63/90/1344966390.db2.gz	WIRCUBLXMIHDPE-HNAYVOBHSA-N	0	3	346.421	3.305	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cnc(CC)s2)C1	ZINC001039241594	1344967391	/nfs/dbraw/zinc/96/73/91/1344967391.db2.gz	DMEUGNMBKIWKFT-CVEARBPZSA-N	0	3	345.512	3.045	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cncc3ccccc32)C1	ZINC001039242021	1344967869	/nfs/dbraw/zinc/96/78/69/1344967869.db2.gz	MTQUAZRNFVXTEY-WIYYLYMNSA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccc(OC)cc2)C1	ZINC001039242377	1344969177	/nfs/dbraw/zinc/96/91/77/1344969177.db2.gz	BIRSTQQQLGONJN-AZUAARDMSA-N	0	3	340.467	3.035	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)CCc2ccccc2)C1	ZINC001039246019	1344975749	/nfs/dbraw/zinc/97/57/49/1344975749.db2.gz	OLJGUJYZFIRZKZ-RTWAWAEBSA-N	0	3	338.495	3.346	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(Cl)s2)C1	ZINC001039251638	1344982649	/nfs/dbraw/zinc/98/26/49/1344982649.db2.gz	WFYZQBPUWXMVTE-KBPBESRZSA-N	0	3	336.888	3.351	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(F)cc2C)C1	ZINC001039256241	1344985890	/nfs/dbraw/zinc/98/58/90/1344985890.db2.gz	ISRIBBPWLNTUFU-YLJYHZDGSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cccc3ccncc32)C1	ZINC001039258393	1344986709	/nfs/dbraw/zinc/98/67/09/1344986709.db2.gz	XCCPPRYODIHGTR-WIYYLYMNSA-N	0	3	347.462	3.185	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cn(CC)nc1C1CC1	ZINC001039382557	1345037351	/nfs/dbraw/zinc/03/73/51/1345037351.db2.gz	JKGCNJVXNBRYGI-SJORKVTESA-N	0	3	342.487	3.035	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1c(Cl)n[nH]c1C1CC1	ZINC001039383721	1345037813	/nfs/dbraw/zinc/03/78/13/1345037813.db2.gz	KDQLPHLOAZNIOE-KGLIPLIRSA-N	0	3	348.878	3.196	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccnn1C(CC)CC	ZINC001039386347	1345039118	/nfs/dbraw/zinc/03/91/18/1345039118.db2.gz	KNEDPOWJMBITOI-MSOLQXFVSA-N	0	3	344.503	3.499	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1cncc2ccccc21	ZINC001039388490	1345040225	/nfs/dbraw/zinc/04/02/25/1345040225.db2.gz	UTCFHEXFXLASNC-UXHICEINSA-N	0	3	349.478	3.419	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(C2CC2)nn1CC	ZINC001039390992	1345040778	/nfs/dbraw/zinc/04/07/78/1345040778.db2.gz	SALYQWBTKZJTHA-SJORKVTESA-N	0	3	342.487	3.035	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1noc2ccccc21	ZINC001039401058	1345047146	/nfs/dbraw/zinc/04/71/46/1345047146.db2.gz	HWXFALUKKXMAIU-CVEARBPZSA-N	0	3	339.439	3.012	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(C)ccc1OC	ZINC001039401329	1345047760	/nfs/dbraw/zinc/04/77/60/1345047760.db2.gz	VYUGBITZOGKBHT-SJORKVTESA-N	0	3	328.456	3.259	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](c1ccccc1)C1CC1	ZINC001039404661	1345049969	/nfs/dbraw/zinc/04/99/69/1345049969.db2.gz	NHCILWDWXWVERS-HKBOAZHASA-N	0	3	336.479	3.269	20	30		EGEDHN
C=CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc2ncccc2o1	ZINC001039406790	1345051742	/nfs/dbraw/zinc/05/17/42/1345051742.db2.gz	JDSRQJGCPFNIMR-CABCVRRESA-N	0	3	325.412	3.083	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)Cc1cccs1	ZINC001039445683	1345070702	/nfs/dbraw/zinc/07/07/02/1345070702.db2.gz	CSGRXCYNODYESQ-ZACQAIPSSA-N	0	3	330.497	3.015	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)Oc1ccc(F)cc1	ZINC001039468129	1345085732	/nfs/dbraw/zinc/08/57/32/1345085732.db2.gz	VNLNDTVNDHEENE-NXHRZFHOSA-N	0	3	346.446	3.234	20	30		EGEDHN
C#CCOc1ccc(C(=O)N2C[C@H]3CCC[C@@H](C2)N3CC(C)C)cc1	ZINC001039940433	1345253779	/nfs/dbraw/zinc/25/37/79/1345253779.db2.gz	TXRHPXSATKBJGJ-KDURUIRLSA-N	0	3	340.467	3.034	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@]3(CCN(C(=O)C4CCC4)C3)C2)c1	ZINC001040032990	1345298294	/nfs/dbraw/zinc/29/82/94/1345298294.db2.gz	VMZDTTYANBBGLI-OAQYLSRUSA-N	0	3	337.467	3.173	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@@]2(C1)CCCN(Cc1cccc(C#N)c1)C2	ZINC001040048544	1345311384	/nfs/dbraw/zinc/31/13/84/1345311384.db2.gz	YJICWPUEZTVNNZ-NRFANRHFSA-N	0	3	339.483	3.419	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3c(Cl)n[nH]c3C3CC3)C2)C1	ZINC001040235979	1345389609	/nfs/dbraw/zinc/38/96/09/1345389609.db2.gz	IVFCOCITJFULJX-SFHVURJKSA-N	0	3	348.878	3.055	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cccc4c3O[C@@H](C)C4)C2)C1	ZINC001040301438	1345422471	/nfs/dbraw/zinc/42/24/71/1345422471.db2.gz	YJANBRIZANRKGZ-HRAATJIYSA-N	0	3	340.467	3.124	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cc(F)ccc3C)C2)C1	ZINC001040319240	1345429427	/nfs/dbraw/zinc/42/94/27/1345429427.db2.gz	DIMSXHCTJKWFOP-HXUWFJFHSA-N	0	3	328.431	3.086	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)C[C@H]3CCCC3(F)F)C2)C1	ZINC001040353303	1345449910	/nfs/dbraw/zinc/44/99/10/1345449910.db2.gz	HTBLIGCRVXBESE-AEFFLSMTSA-N	0	3	338.442	3.150	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3ccc(Cl)cc3OC)C2)C1	ZINC001040355832	1345450876	/nfs/dbraw/zinc/45/08/76/1345450876.db2.gz	FLXDLKDLYIXNDH-IBGZPJMESA-N	0	3	348.874	3.463	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3nccc4ccccc43)C2)C1	ZINC001040361898	1345455337	/nfs/dbraw/zinc/45/53/37/1345455337.db2.gz	XSEWMDIKWVFQAS-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)Cc3cc(C)ccc3C)C2)C1	ZINC001040370780	1345460165	/nfs/dbraw/zinc/46/01/65/1345460165.db2.gz	DVDXEBOFHHLSDN-QFIPXVFZSA-N	0	3	338.495	3.184	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@@H](C)c3ccc(Cl)cc3)C2)C1	ZINC001040371988	1345460532	/nfs/dbraw/zinc/46/05/32/1345460532.db2.gz	NOETVHFHLFWQOX-JXFKEZNVSA-N	0	3	344.886	3.391	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@H](C)c3ccc(CC)cc3)C2)C1	ZINC001040451129	1345507325	/nfs/dbraw/zinc/50/73/25/1345507325.db2.gz	BELWUKDDTNKLRV-GCJKJVERSA-N	0	3	338.495	3.300	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)C[C@@H](C)c3ccccc3F)C2)C1	ZINC001040454447	1345508463	/nfs/dbraw/zinc/50/84/63/1345508463.db2.gz	VKTMBISAYNQLLN-DYESRHJHSA-N	0	3	342.458	3.267	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cnn([C@H](C)CC)c3C)C2)C1	ZINC001040493140	1345519196	/nfs/dbraw/zinc/51/91/96/1345519196.db2.gz	YYKZCGIZKRUXEH-UZLBHIALSA-N	0	3	344.503	3.277	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)C34CC5CC(CC(C5)C3)C4)C2)C1	ZINC001040508206	1345525559	/nfs/dbraw/zinc/52/55/59/1345525559.db2.gz	YSQLRHMXUQLTSL-OTNIWXAGSA-N	0	3	340.511	3.151	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)C[C@H](C)c3ccc(F)cc3)C2)C1	ZINC001040538584	1345537217	/nfs/dbraw/zinc/53/72/17/1345537217.db2.gz	KDXVVQWTKKYUNQ-LAUBAEHRSA-N	0	3	342.458	3.267	20	30		EGEDHN
Cc1ccc(F)c(CN2CCC3(CCN(C(=O)[C@@H](C)C#N)C3)CC2)c1	ZINC001040644474	1345559131	/nfs/dbraw/zinc/55/91/31/1345559131.db2.gz	PFEKHKCCJUOKSG-INIZCTEOSA-N	0	3	343.446	3.108	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3nc(C(C)C)oc3C)C2)CC1	ZINC001040703408	1345567464	/nfs/dbraw/zinc/56/74/64/1345567464.db2.gz	FDZVQHZEFSASJN-UHFFFAOYSA-N	0	3	343.471	3.058	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCC2(C1)CCN(C[C@H](F)CC)CC2	ZINC001040730154	1345571832	/nfs/dbraw/zinc/57/18/32/1345571832.db2.gz	RYDMAJJYHDLZAY-QGZVFWFLSA-N	0	3	347.478	3.350	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccc4cc(C)ccc4n3)C2)CC1	ZINC001040767713	1345577272	/nfs/dbraw/zinc/57/72/72/1345577272.db2.gz	CKWXYHXPMVUKCT-UHFFFAOYSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccc(F)c(C)c3)C2)CC1	ZINC001040823814	1345583085	/nfs/dbraw/zinc/58/30/85/1345583085.db2.gz	LGOYFZYXQAZFNV-UHFFFAOYSA-N	0	3	328.431	3.086	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)C[C@H](C)c3ccco3)C2)CC1	ZINC001040916812	1345599782	/nfs/dbraw/zinc/59/97/82/1345599782.db2.gz	JONDUPWFYXHRMY-KRWDZBQOSA-N	0	3	328.456	3.111	20	30		EGEDHN
C=C[C@@H](C(=O)N1CCC2(C1)CCN(CC#CC)CC2)c1ccccc1	ZINC001040946787	1345606773	/nfs/dbraw/zinc/60/67/73/1345606773.db2.gz	IVLYXOYGQIFKGX-HXUWFJFHSA-N	0	3	336.479	3.294	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@H](C)Cc3ccccc3C)C2)CC1	ZINC001040951762	1345608120	/nfs/dbraw/zinc/60/81/20/1345608120.db2.gz	JCOJILMKGHTWHK-LJQANCHMSA-N	0	3	338.495	3.121	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC[C@@]2(CCN(Cc3cccc(C(F)F)c3)C2)C1	ZINC001041136668	1345658741	/nfs/dbraw/zinc/65/87/41/1345658741.db2.gz	NFFSJYSIJJNNPR-AUUYWEPGSA-N	0	3	347.409	3.208	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@]3(CCN(C(=O)C=C4CCC4)C3)C2)cc1	ZINC001041201667	1345677376	/nfs/dbraw/zinc/67/73/76/1345677376.db2.gz	UHNJYZVKOZWOBK-OAQYLSRUSA-N	0	3	335.451	3.093	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)[C@H](CC)OC3CCCCC3)C2)C1	ZINC001041282295	1345693367	/nfs/dbraw/zinc/69/33/67/1345693367.db2.gz	JBYSWQWTJQXVNS-PZJWPPBQSA-N	0	3	346.515	3.062	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cccc(Cl)c3C)C2)C1	ZINC001041318090	1345700915	/nfs/dbraw/zinc/70/09/15/1345700915.db2.gz	QIRIAWFOHPGTDS-LJQANCHMSA-N	0	3	330.859	3.210	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)Cc3c(C)cccc3Cl)C2)C1	ZINC001041441100	1345728311	/nfs/dbraw/zinc/72/83/11/1345728311.db2.gz	VVZYRCSUKPWPRY-FQEVSTJZSA-N	0	3	344.886	3.139	20	30		EGEDHN
C=CCN1CC[C@]2(CCN(C(=O)c3cc(-c4cccs4)on3)C2)C1	ZINC001041520390	1345752125	/nfs/dbraw/zinc/75/21/25/1345752125.db2.gz	QXKFIVVUHWRRGG-SFHVURJKSA-N	0	3	343.452	3.127	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@]2(CCN(Cc3cncc(C)c3)C2)C1	ZINC001041537529	1345755804	/nfs/dbraw/zinc/75/58/04/1345755804.db2.gz	YMCPXXBWRRNLLC-OAQYLSRUSA-N	0	3	341.499	3.417	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@]2(CCN(Cc3c(C)onc3CC)C2)C1	ZINC001041545846	1345759994	/nfs/dbraw/zinc/75/99/94/1345759994.db2.gz	YNKVALGUSDZFIK-HXUWFJFHSA-N	0	3	345.487	3.182	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001041621826	1345798409	/nfs/dbraw/zinc/79/84/09/1345798409.db2.gz	FJONTQJALNBMGJ-NRFANRHFSA-N	0	3	339.483	3.419	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@]2(CCN(Cc3cccnc3C)C2)C1	ZINC001041624613	1345800127	/nfs/dbraw/zinc/80/01/27/1345800127.db2.gz	BWHMHKZFFYGZEX-RTWAWAEBSA-N	0	3	341.499	3.417	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3ccc(Cl)c4occc43)C2)C1	ZINC001041784472	1345849016	/nfs/dbraw/zinc/84/90/16/1345849016.db2.gz	PRLSYFKAMMPBEZ-LJQANCHMSA-N	0	3	342.826	3.257	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001041799563	1345854492	/nfs/dbraw/zinc/85/44/92/1345854492.db2.gz	CJOFNMOLKZJZSS-FQEVSTJZSA-N	0	3	325.456	3.029	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3cc(Cl)cc(Cl)c3)C2)C1	ZINC001041800945	1345854984	/nfs/dbraw/zinc/85/49/84/1345854984.db2.gz	CAVPWPIWPXZIPU-QGZVFWFLSA-N	0	3	337.250	3.165	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3ccc(Cl)cc3Cl)C2)C1	ZINC001041801150	1345855765	/nfs/dbraw/zinc/85/57/65/1345855765.db2.gz	HILRPBDMZMBHNX-KRWDZBQOSA-N	0	3	337.250	3.165	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)C3CCC(C4CC4)CC3)C2)C1	ZINC001041809347	1345857795	/nfs/dbraw/zinc/85/77/95/1345857795.db2.gz	HZXFQSAHLXRRMS-GZNCHQMQSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3oc4ccccc4c3C)C2)C1	ZINC001041817300	1345861339	/nfs/dbraw/zinc/86/13/39/1345861339.db2.gz	DUSIZNJSXVVEAW-NRFANRHFSA-N	0	3	336.435	3.303	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cc(C)c(CC)s3)C2)C1	ZINC001041820828	1345863648	/nfs/dbraw/zinc/86/36/48/1345863648.db2.gz	YMRXZUINIKKTAX-IBGZPJMESA-N	0	3	330.497	3.180	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)CC(C)(C)c3ccc(C)cc3)C2)C1	ZINC001041824850	1345863900	/nfs/dbraw/zinc/86/39/00/1345863900.db2.gz	XZXASFFDRHEEEO-QFIPXVFZSA-N	0	3	338.495	3.220	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cc4cccc(F)c4o3)C2)C1	ZINC001041838228	1345868140	/nfs/dbraw/zinc/86/81/40/1345868140.db2.gz	UXZTYXMURMTKRP-HXUWFJFHSA-N	0	3	340.398	3.133	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)[C@H](C)Cc3ccccc3C)C2)C1	ZINC001041850959	1345873087	/nfs/dbraw/zinc/87/30/87/1345873087.db2.gz	SDVPNXKEAUMNHW-KNQAVFIVSA-N	0	3	338.495	3.121	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@@H]2CCN(Cc3cccc(C#N)c3)[C@@H]2C1	ZINC001041906190	1345889847	/nfs/dbraw/zinc/88/98/47/1345889847.db2.gz	FOVXBRNWNNDXSD-RBUKOAKNSA-N	0	3	325.456	3.027	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CCN(C(=O)C=C4CCC4)C[C@H]32)cc1	ZINC001042006828	1345922486	/nfs/dbraw/zinc/92/24/86/1345922486.db2.gz	QRGQZOANWVEXKY-WOJBJXKFSA-N	0	3	335.451	3.091	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3c(F)ccc4ccncc43)C[C@@H]21	ZINC001042067610	1345934810	/nfs/dbraw/zinc/93/48/10/1345934810.db2.gz	RDNBVHZPOUUJDE-YJBOKZPZSA-N	0	3	339.414	3.096	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cccc(-n4cccc4)c3)C[C@H]21	ZINC001042139240	1345953785	/nfs/dbraw/zinc/95/37/85/1345953785.db2.gz	VXLUAOOTGHLFDN-GHTZIAJQSA-N	0	3	347.462	3.037	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cc4c(cc(C)cc4C)[nH]3)C[C@@H]21	ZINC001042168262	1345964153	/nfs/dbraw/zinc/96/41/53/1345964153.db2.gz	UKHRSSKCTZMKTF-UWJYYQICSA-N	0	3	349.478	3.344	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3cc(-c4ccco4)on3)C[C@@H]21	ZINC001042171615	1345965914	/nfs/dbraw/zinc/96/59/14/1345965914.db2.gz	XLJPCUOUOSUXOI-HOCLYGCPSA-N	0	3	341.411	3.047	20	30		EGEDHN
CC1(C(=O)N2CC[C@H]3CCN(Cc4cccc(C#N)c4)[C@H]3C2)CCC1	ZINC001042182987	1345971368	/nfs/dbraw/zinc/97/13/68/1345971368.db2.gz	HQYDDRCQOXPNLA-MOPGFXCFSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3ccc(OC)cc3)[C@H]2C1	ZINC001042186198	1345973156	/nfs/dbraw/zinc/97/31/56/1345973156.db2.gz	DXBMMNJHOWDTSH-MJGOQNOKSA-N	0	3	342.483	3.330	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3cccc(C#N)c3)[C@H]2C1	ZINC001042185775	1345973216	/nfs/dbraw/zinc/97/32/16/1345973216.db2.gz	XMFQQKCWPXCTOZ-OALUTQOASA-N	0	3	337.467	3.193	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3ccc(C#N)cc3)[C@H]2C1	ZINC001042188630	1345975700	/nfs/dbraw/zinc/97/57/00/1345975700.db2.gz	VNAXGLJMIPASMJ-MOPGFXCFSA-N	0	3	337.467	3.193	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3c(F)cc(F)cc3F)C[C@@H]21	ZINC001042207525	1345985393	/nfs/dbraw/zinc/98/53/93/1345985393.db2.gz	PCPLGQILJZPQOD-LRDDRELGSA-N	0	3	338.373	3.216	20	30		EGEDHN
CC1(C(=O)N2CC[C@@H]3CCN(Cc4ccc(C#N)cc4)[C@@H]3C2)CC=CC1	ZINC001042220833	1345992311	/nfs/dbraw/zinc/99/23/11/1345992311.db2.gz	GBLBIKWVMREHEY-VQTJNVASSA-N	0	3	349.478	3.337	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(C)c(OCC)c3)C[C@H]21	ZINC001042256816	1346007504	/nfs/dbraw/zinc/00/75/04/1346007504.db2.gz	ZZUSYTUQRXFHLP-SJLPKXTDSA-N	0	3	328.456	3.116	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C3(Cc4ccc(F)cc4)CC3)C[C@H]21	ZINC001042262075	1346009581	/nfs/dbraw/zinc/00/95/81/1346009581.db2.gz	FKTGKIBZSZSWCD-IEBWSBKVSA-N	0	3	342.458	3.257	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3[nH]c4ccc(C)cc4c3C)C[C@H]21	ZINC001042296604	1346021009	/nfs/dbraw/zinc/02/10/09/1346021009.db2.gz	CMIBUZKQNLHSMC-FXAWDEMLSA-N	0	3	349.478	3.344	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C(C)(C)Cc3ccccc3)C[C@@H]21	ZINC001042303491	1346025065	/nfs/dbraw/zinc/02/50/65/1346025065.db2.gz	HQJXWRDGQJCRQX-UXHICEINSA-N	0	3	338.495	3.201	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3coc(C4CCC4)n3)C[C@H]21	ZINC001042304514	1346025158	/nfs/dbraw/zinc/02/51/58/1346025158.db2.gz	ONAQHYUERXJFMI-RHSMWYFYSA-N	0	3	329.444	3.055	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cnn(C(CC)CC)c3C)C[C@H]21	ZINC001042305005	1346025339	/nfs/dbraw/zinc/02/53/39/1346025339.db2.gz	VRPGRKXSHFMMIH-VQIMIIECSA-N	0	3	344.503	3.275	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccsc3C(F)(F)F)C[C@@H]21	ZINC001042325997	1346034962	/nfs/dbraw/zinc/03/49/62/1346034962.db2.gz	KWFIZZHRRMCDMS-AAEUAGOBSA-N	0	3	344.402	3.489	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(C)nc4ccccc43)C[C@H]21	ZINC001042338915	1346043519	/nfs/dbraw/zinc/04/35/19/1346043519.db2.gz	NYJRSFOTMMIMGD-OXQOHEQNSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(C)nc4ccccc43)C[C@@H]21	ZINC001042338913	1346043676	/nfs/dbraw/zinc/04/36/76/1346043676.db2.gz	NYJRSFOTMMIMGD-JXFKEZNVSA-N	0	3	335.451	3.266	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3ccc(C(C)C)s3)C[C@@H]21	ZINC001042369821	1346060345	/nfs/dbraw/zinc/06/03/45/1346060345.db2.gz	AYGJSKQPLZSWDR-HOTGVXAUSA-N	0	3	330.497	3.431	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C(C)(C)c3ccccc3C)C[C@@H]21	ZINC001042382298	1346066138	/nfs/dbraw/zinc/06/61/38/1346066138.db2.gz	GJCKTPDYQWAABN-QUCCMNQESA-N	0	3	338.495	3.219	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2cc(F)ccc2C#N)CCN1C(=O)C1CCCC1	ZINC001044414798	1346321875	/nfs/dbraw/zinc/32/18/75/1346321875.db2.gz	WKXOILMQYTZGJZ-AUUYWEPGSA-N	0	3	343.446	3.357	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)/C=C\c1ccco1	ZINC001044430954	1346328332	/nfs/dbraw/zinc/32/83/32/1346328332.db2.gz	KKAMLHBANLDIRN-BUFKOALHSA-N	0	3	349.434	3.334	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2cc(F)ccc2C#N)CCN1C(=O)c1ccoc1	ZINC001044457217	1346337760	/nfs/dbraw/zinc/33/77/60/1346337760.db2.gz	FSGFDTGRVAXAQP-ACJLOTCBSA-N	0	3	341.386	3.073	20	30		EGEDHN
COc1ccc(C#N)cc1CNC[C@@H]1CCCN1C(=O)CC(C)(C)C	ZINC001044923002	1346463923	/nfs/dbraw/zinc/46/39/23/1346463923.db2.gz	GGRAYVZUOPXNEG-KRWDZBQOSA-N	0	3	343.471	3.084	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC[C@H]1CNCc1c(Cl)oc2ccccc21	ZINC001044960942	1346470528	/nfs/dbraw/zinc/47/05/28/1346470528.db2.gz	ISBSZGCULDVLBB-STQMWFEESA-N	0	3	345.830	3.326	20	30		EGEDHN
Cc1cscc1C(=O)N1CCC[C@H]1CNCc1ccc(C#N)s1	ZINC001044982551	1346473893	/nfs/dbraw/zinc/47/38/93/1346473893.db2.gz	VWYKJUYGNGYULE-ZDUSSCGKSA-N	0	3	345.493	3.384	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)C2(F)CCCC2)cc1F	ZINC001045097095	1346494480	/nfs/dbraw/zinc/49/44/80/1346494480.db2.gz	APNDTJIBWXKQPF-INIZCTEOSA-N	0	3	347.409	3.060	20	30		EGEDHN
CC1(NC(=O)c2ccccc2O)CCN(Cc2cccc(C#N)c2)CC1	ZINC001045365793	1346575758	/nfs/dbraw/zinc/57/57/58/1346575758.db2.gz	LXDGDJJNNCCGTC-UHFFFAOYSA-N	0	3	349.434	3.048	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2cnc(-c3ccoc3)s2)CC1	ZINC001045581409	1346636216	/nfs/dbraw/zinc/63/62/16/1346636216.db2.gz	VCZRCMSBAFJKBX-UHFFFAOYSA-N	0	3	331.441	3.173	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2CC[C@H]3CC[C@@H](C2)N3CC=C)cc1	ZINC001045806054	1346703425	/nfs/dbraw/zinc/70/34/25/1346703425.db2.gz	OUCDQLFGZLAVFY-MSOLQXFVSA-N	0	3	326.440	3.116	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc(CC)o1)C2	ZINC001045949161	1346784009	/nfs/dbraw/zinc/78/40/09/1346784009.db2.gz	YZOONZQNGBTPDB-HXUWFJFHSA-N	0	3	328.456	3.184	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ncc(C)cc1C)C2	ZINC001045953684	1346788587	/nfs/dbraw/zinc/78/85/87/1346788587.db2.gz	GNOAQEPMYTXFTL-NRFANRHFSA-N	0	3	339.483	3.040	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@H]1CCCCC1(F)F)C2	ZINC001045954869	1346789653	/nfs/dbraw/zinc/78/96/53/1346789653.db2.gz	JOFZAOJHNGZZOC-AEFFLSMTSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cccc(F)c1F)C2	ZINC001045961075	1346796490	/nfs/dbraw/zinc/79/64/90/1346796490.db2.gz	FOFQMWKYARPDSS-HXUWFJFHSA-N	0	3	346.421	3.306	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1occc1Cl)C2	ZINC001045964230	1346799946	/nfs/dbraw/zinc/79/99/46/1346799946.db2.gz	DEHCMJATZIWJLU-SFHVURJKSA-N	0	3	334.847	3.275	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@H](C)c1ccc(C)o1)C2	ZINC001045971720	1346807780	/nfs/dbraw/zinc/80/77/80/1346807780.db2.gz	QWRVJXPILZULFG-YLJYHZDGSA-N	0	3	328.456	3.029	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cnoc1C(C)C)C2	ZINC001045975856	1346812576	/nfs/dbraw/zinc/81/25/76/1346812576.db2.gz	KNSJGCKWFBVLRX-FQEVSTJZSA-N	0	3	343.471	3.140	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc(CC(C)C)c[nH]1)C2	ZINC001045979430	1346816348	/nfs/dbraw/zinc/81/63/48/1346816348.db2.gz	DKMDHWGFMAAKJO-OAQYLSRUSA-N	0	3	341.499	3.165	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)C(C1CC1)C1CC1)C2	ZINC001045979141	1346816850	/nfs/dbraw/zinc/81/68/50/1346816850.db2.gz	QFFOUAIQZKWGHD-OAQYLSRUSA-N	0	3	328.500	3.151	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2cn(C)c3ccc(F)cc23)C1	ZINC001046377679	1346955301	/nfs/dbraw/zinc/95/53/01/1346955301.db2.gz	CSUIEXKVHYRGLX-LJQANCHMSA-N	0	3	329.419	3.088	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@@]2(C)CCN(CC=C(C)C)C2)cc1	ZINC001046430198	1346973422	/nfs/dbraw/zinc/97/34/22/1346973422.db2.gz	YNSFGNKYFTXWBD-FQEVSTJZSA-N	0	3	328.456	3.412	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2ccc(F)c3ccncc23)C1	ZINC001046565797	1347020086	/nfs/dbraw/zinc/02/00/86/1347020086.db2.gz	UUEVZWYMGGRECI-IBGZPJMESA-N	0	3	327.403	3.144	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@]2(C)CCN([C@H](C)c3ccccc3)C2)cn1	ZINC001046778532	1347096049	/nfs/dbraw/zinc/09/60/49/1347096049.db2.gz	HDKJCTMSTVXUJF-IERDGZPVSA-N	0	3	333.435	3.018	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@]2(C)CCN([C@@H](C)c3ccccc3)C2)nc1	ZINC001046782990	1347098376	/nfs/dbraw/zinc/09/83/76/1347098376.db2.gz	HVNKDBCOHGIBGA-KKSFZXQISA-N	0	3	333.435	3.018	20	30		EGEDHN
C#CCCN1CC[C@@](C)(NC(=O)c2csc3c2CC[C@H](C)C3)C1	ZINC001046817024	1347116074	/nfs/dbraw/zinc/11/60/74/1347116074.db2.gz	RYDYRLPYLTXDJU-IFXJQAMLSA-N	0	3	330.497	3.090	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2cc3ccccc3n2CC)C1	ZINC001046849363	1347128725	/nfs/dbraw/zinc/12/87/25/1347128725.db2.gz	DMPHLNFYFIOFCS-HXUWFJFHSA-N	0	3	325.456	3.432	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2ccc(OCC3CC3)cc2)C1	ZINC001046847144	1347129006	/nfs/dbraw/zinc/12/90/06/1347129006.db2.gz	FISWLVAQYNEILB-HXUWFJFHSA-N	0	3	328.456	3.246	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2cc(C)oc2C)C1	ZINC001046919578	1347153619	/nfs/dbraw/zinc/15/36/19/1347153619.db2.gz	VSQZEYFBNNIABJ-CQSZACIVSA-N	0	3	326.387	3.160	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2cccc(F)c2F)C1	ZINC001046967596	1347170007	/nfs/dbraw/zinc/17/00/07/1347170007.db2.gz	VJOXWTVTJFMOHV-GFCCVEGCSA-N	0	3	344.352	3.228	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2occc2CC)C1	ZINC001046971455	1347172333	/nfs/dbraw/zinc/17/23/33/1347172333.db2.gz	PZQUPMJFLHNRHQ-CQSZACIVSA-N	0	3	326.387	3.105	20	30		EGEDHN
CCC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1ccc(Cl)cc1)C2	ZINC001047002119	1347182050	/nfs/dbraw/zinc/18/20/50/1347182050.db2.gz	UXXNWXAEEXOMLF-JQHSSLGASA-N	0	3	330.859	3.071	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)c3cc(Cl)c[nH]3)C2)CC1	ZINC001047223841	1347254016	/nfs/dbraw/zinc/25/40/16/1347254016.db2.gz	QZMMFCLLNCOTMU-MRXNPFEDSA-N	0	3	347.890	3.256	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)c3cnc(C)s3)C2)CC1	ZINC001047231052	1347259875	/nfs/dbraw/zinc/25/98/75/1347259875.db2.gz	KFCKUVVAILUMPA-QGZVFWFLSA-N	0	3	345.512	3.039	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)c3coc(C)c3)C2)CC1	ZINC001047240905	1347267127	/nfs/dbraw/zinc/26/71/27/1347267127.db2.gz	LHFZLIWOJOCBBH-SFHVURJKSA-N	0	3	328.456	3.176	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)[C@@H]3CCC3(C)C)C2)CC1	ZINC001047247098	1347272521	/nfs/dbraw/zinc/27/25/21/1347272521.db2.gz	AYXUCGGYUJDRQH-MOPGFXCFSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC[C@@H](C3CCN(CC#CC)CC3)C2)cc1	ZINC001047247825	1347272986	/nfs/dbraw/zinc/27/29/86/1347272986.db2.gz	MOQBGHGWXVJOBA-JOCHJYFZSA-N	0	3	348.490	3.255	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)C[C@@H]3C[C@H]3C3CC3)C2)CC1	ZINC001047249527	1347274293	/nfs/dbraw/zinc/27/42/93/1347274293.db2.gz	AFDPXNPVKAMDGM-ACRUOGEOSA-N	0	3	342.527	3.397	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)C[C@H]3CC=CCC3)C2)CC1	ZINC001047251444	1347276056	/nfs/dbraw/zinc/27/60/56/1347276056.db2.gz	JOPGVDMTUUXXHJ-ICSRJNTNSA-N	0	3	328.500	3.317	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)[C@H]3CC34CCC4)C2)CC1	ZINC001047258376	1347281117	/nfs/dbraw/zinc/28/11/17/1347281117.db2.gz	BFWBVWQAUCIREV-RTBURBONSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)c3cc(C)[nH]c3C)C2)CC1	ZINC001047260033	1347282616	/nfs/dbraw/zinc/28/26/16/1347282616.db2.gz	WREIAKMPLYBODR-IBGZPJMESA-N	0	3	341.499	3.219	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@@H](C)C3CCCC3)C2)CC1	ZINC001047263082	1347284065	/nfs/dbraw/zinc/28/40/65/1347284065.db2.gz	YRPSHRUUNAUNPJ-FXAWDEMLSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)Cc3ccccc3C)C2)CC1	ZINC001047264993	1347285935	/nfs/dbraw/zinc/28/59/35/1347285935.db2.gz	OLRYGLZQUJINOO-NRFANRHFSA-N	0	3	338.495	3.121	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)C2(C)CCC2)C1	ZINC001047939966	1347418009	/nfs/dbraw/zinc/41/80/09/1347418009.db2.gz	KGGWQPHQBOTXKT-CRAIPNDOSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@@H]1CN(C(=O)/C=C\c2ccco2)C[C@H]1CNCc1ccccc1C#N	ZINC001048108956	1347469233	/nfs/dbraw/zinc/46/92/33/1347469233.db2.gz	QAPQCRXAMDJCND-BUFKOALHSA-N	0	3	349.434	3.049	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2cccs2)C[C@H]1CNCc1ccccc1C#N	ZINC001048118697	1347472884	/nfs/dbraw/zinc/47/28/84/1347472884.db2.gz	MUFVJEHQGKMURW-RHSMWYFYSA-N	0	3	339.464	3.118	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCC2CCC2)C[C@H]1CNCc1ccccc1C#N	ZINC001048199489	1347491792	/nfs/dbraw/zinc/49/17/92/1347491792.db2.gz	YHHAXMHMANSVLD-OXQOHEQNSA-N	0	3	339.483	3.323	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1C[C@@H](C)[C@@H](CNCc2ccccc2C#N)C1	ZINC001048268911	1347506843	/nfs/dbraw/zinc/50/68/43/1347506843.db2.gz	HLSAMCOYNWWSAB-APWZRJJASA-N	0	3	341.499	3.425	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1C[C@H](C)[C@@H](CNCc2ccccc2C#N)C1	ZINC001048268912	1347506869	/nfs/dbraw/zinc/50/68/69/1347506869.db2.gz	HLSAMCOYNWWSAB-LPHOPBHVSA-N	0	3	341.499	3.425	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](C)[C@@H](CNCc2ncc(C)s2)C1	ZINC001048337489	1347521918	/nfs/dbraw/zinc/52/19/18/1347521918.db2.gz	DDLOPKYFECDDBJ-ZFWWWQNUSA-N	0	3	335.517	3.238	20	30		EGEDHN
O=C(C1=CCCCCC1)N1C[C@H]2CN(CC#Cc3ccccc3)C[C@H]2C1	ZINC001048784029	1347659330	/nfs/dbraw/zinc/65/93/30/1347659330.db2.gz	LZLLXTHGZBNJGT-SZPZYZBQSA-N	0	3	348.490	3.319	20	30		EGEDHN
C=C(CN1CCCC1)C(=O)Nc1nc(-c2ccc(C#N)s2)cs1	ZINC001183038533	1387255281	/nfs/dbraw/zinc/25/52/81/1387255281.db2.gz	AVGHPALASFUOPV-UHFFFAOYSA-N	0	3	344.465	3.334	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CN(Cc3ccc(Cl)cc3)C[C@H]2C1	ZINC001048981921	1347696889	/nfs/dbraw/zinc/69/68/89/1347696889.db2.gz	MWDVAINGOHPYJT-IYBDPMFKSA-N	0	3	332.875	3.442	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C[C@H](C)c3ccc(CC)cc3)C[C@@H]2C1	ZINC001049056576	1347717395	/nfs/dbraw/zinc/71/73/95/1347717395.db2.gz	RBHXQRQLNIEFFB-DZFGPLHGSA-N	0	3	338.495	3.156	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)[C@@H]2CC=CCC2)cc1	ZINC001049325983	1347792133	/nfs/dbraw/zinc/79/21/33/1347792133.db2.gz	LCAFJUXZLLSWAY-QHAWAJNXSA-N	0	3	349.478	3.480	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)/C=C\C2CC2)c1	ZINC001049399253	1347821406	/nfs/dbraw/zinc/82/14/06/1347821406.db2.gz	WSYAEJQHOAAVRA-MITRTKIPSA-N	0	3	335.451	3.090	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cccc2scnc21	ZINC001049468262	1347864033	/nfs/dbraw/zinc/86/40/33/1347864033.db2.gz	GXPVSCLIXWMDGL-GJZGRUSLSA-N	0	3	327.453	3.161	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1sccc1C	ZINC001049476886	1347867486	/nfs/dbraw/zinc/86/74/86/1347867486.db2.gz	ZKGHYEWMJANFMN-QBPKDAKJSA-N	0	3	330.497	3.411	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cccc(OCCC)c1	ZINC001049502438	1347880939	/nfs/dbraw/zinc/88/09/39/1347880939.db2.gz	NXJLXHVFSNMZGZ-OALUTQOASA-N	0	3	328.456	3.340	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H]1CCCN2C(=O)CC1CC(c2ccccc2)C1	ZINC001049558189	1347908760	/nfs/dbraw/zinc/90/87/60/1347908760.db2.gz	NPAKCWXALVTAGF-HXJFWZBSSA-N	0	3	336.479	3.269	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(C)n([C@H](C)CC)n1	ZINC001049566055	1347913140	/nfs/dbraw/zinc/91/31/40/1347913140.db2.gz	ZMSDQRVGQDPGST-AYOQOUSVSA-N	0	3	344.503	3.418	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc2cnccc2o1	ZINC001049572715	1347915762	/nfs/dbraw/zinc/91/57/62/1347915762.db2.gz	NFRNCLZMCKASIA-CVEARBPZSA-N	0	3	325.412	3.083	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@@H]2CCCN3C(=O)[C@]23C[C@H]2CCC3)c1	ZINC001049605864	1347933688	/nfs/dbraw/zinc/93/36/88/1347933688.db2.gz	RUDIIHWYWHLXNW-FCIYXJNOSA-N	0	3	349.478	3.314	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccncc1OC(C)C	ZINC001049615831	1347936436	/nfs/dbraw/zinc/93/64/36/1347936436.db2.gz	ODAYGFAVDADRLT-MSOLQXFVSA-N	0	3	343.471	3.124	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(-c2ccco2)on1	ZINC001049620413	1347938787	/nfs/dbraw/zinc/93/87/87/1347938787.db2.gz	KLDJCRVQVFBKRR-HZPDHXFCSA-N	0	3	341.411	3.190	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1c[nH]c2cc(C)ccc12	ZINC001049778062	1348016972	/nfs/dbraw/zinc/01/69/72/1348016972.db2.gz	MOSFKMGZDGCQFL-NHCUHLMSSA-N	0	3	349.478	3.107	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](CC)Oc1cccc(C)c1	ZINC001049779151	1348017690	/nfs/dbraw/zinc/01/76/90/1348017690.db2.gz	SFHJBFSHRPWCAC-VAMGGRTRSA-N	0	3	342.483	3.404	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](C)c1cc(C)oc1C	ZINC001049791267	1348023568	/nfs/dbraw/zinc/02/35/68/1348023568.db2.gz	RMMUBQDSQKOGST-ATZDWAIDSA-N	0	3	328.456	3.089	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](C)c1ccccc1F	ZINC001049799119	1348025750	/nfs/dbraw/zinc/02/57/50/1348025750.db2.gz	SZKPDHWCUZYPHK-KFKAGJAMSA-N	0	3	328.431	3.018	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cnn(C2CCCCC2)c1	ZINC001049830618	1348045382	/nfs/dbraw/zinc/04/53/82/1348045382.db2.gz	HHHYLEYMHJUIEN-RTBURBONSA-N	0	3	342.487	3.253	20	30		EGEDHN
CC(C)(C)C(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049860100	1348066752	/nfs/dbraw/zinc/06/67/52/1348066752.db2.gz	ZECDRYDTIQMANH-QZTJIDSGSA-N	0	3	325.456	3.170	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)C1CCC(C2CC2)CC1	ZINC001049869608	1348075623	/nfs/dbraw/zinc/07/56/23/1348075623.db2.gz	IJUOQDBVAAUGJH-TUNPWDSISA-N	0	3	328.500	3.291	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H]1CCCN2C(=O)CCc1ccc(Cl)s1	ZINC001049892090	1348096145	/nfs/dbraw/zinc/09/61/45/1348096145.db2.gz	ZKBLJWBJCQODLE-CABCVRRESA-N	0	3	336.888	3.033	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(C2CCCC2)no1	ZINC001049901641	1348101793	/nfs/dbraw/zinc/10/17/93/1348101793.db2.gz	ZYCGXVUMNFJXKA-ROUUACIJSA-N	0	3	341.455	3.034	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](C)Cc1ccc(C)cc1	ZINC001049916911	1348110926	/nfs/dbraw/zinc/11/09/26/1348110926.db2.gz	JMGDJXYLKABOOS-SESVDKBCSA-N	0	3	338.495	3.262	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](C)Cc1ccc(F)cc1	ZINC001049926891	1348118069	/nfs/dbraw/zinc/11/80/69/1348118069.db2.gz	SJGGXNWYZVQJCU-LSTHTHJFSA-N	0	3	342.458	3.093	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cccnc1OC(C)C	ZINC001049936749	1348122181	/nfs/dbraw/zinc/12/21/81/1348122181.db2.gz	XMYODYDLZOUPRW-QZTJIDSGSA-N	0	3	343.471	3.124	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3ccn(C4CCCCC4)n3)[C@@H]2C1	ZINC001050047572	1348165207	/nfs/dbraw/zinc/16/52/07/1348165207.db2.gz	NRBQJWFBWSXUAD-QFBILLFUSA-N	0	3	342.487	3.111	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)CCc3ncc(C(C)(C)C)o3)[C@@H]2C1	ZINC001050066061	1348171196	/nfs/dbraw/zinc/17/11/96/1348171196.db2.gz	CGWFKCNSDMZDNY-JKSUJKDBSA-N	0	3	345.487	3.014	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cc4c([nH]3)c(F)ccc4C)[C@@H]2C1	ZINC001050081427	1348176366	/nfs/dbraw/zinc/17/63/66/1348176366.db2.gz	XFASUWMLEASDDI-KBXCAEBGSA-N	0	3	341.430	3.338	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3ccc(C(C)C)cn3)[C@@H]2C1	ZINC001050140825	1348194791	/nfs/dbraw/zinc/19/47/91/1348194791.db2.gz	PSDZRVMTKCYACV-PKOBYXMFSA-N	0	3	327.472	3.318	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)C3[C@@H]4CCCCCC[C@@H]34)[C@@H]2C1	ZINC001050149315	1348196565	/nfs/dbraw/zinc/19/65/65/1348196565.db2.gz	GVEYVDQRDORMDL-WJFTUGDTSA-N	0	3	328.500	3.149	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3ccc(COC(C)C)cc3)[C@@H]2C1	ZINC001050198406	1348209313	/nfs/dbraw/zinc/20/93/13/1348209313.db2.gz	CRBVCRCSSBYYGF-VQTJNVASSA-N	0	3	342.483	3.334	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC2(C1)CCN(Cc1cccc(C(F)F)c1)CC2	ZINC001050463514	1348272257	/nfs/dbraw/zinc/27/22/57/1348272257.db2.gz	TZMKDRSBIFYGPZ-AWEZNQCLSA-N	0	3	347.409	3.208	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3coc4ccc(CC)cc34)C2)CC1	ZINC001050518734	1348282485	/nfs/dbraw/zinc/28/24/85/1348282485.db2.gz	HFYCNUUIIOKFQW-UHFFFAOYSA-N	0	3	336.435	3.166	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C[C@@H]3CCc4ccccc43)C2)CC1	ZINC001050703644	1348331662	/nfs/dbraw/zinc/33/16/62/1348331662.db2.gz	QWIOMBSFBJNIBD-IBGZPJMESA-N	0	3	336.479	3.054	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)CC34CC5CC(CC(C5)C3)C4)C2)CC1	ZINC001050739395	1348344016	/nfs/dbraw/zinc/34/40/16/1348344016.db2.gz	OGHFXRIUPJONSP-UHFFFAOYSA-N	0	3	340.511	3.151	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C34CC(C(C)(C)C)(C3)C4)C2)CC1	ZINC001050771766	1348354928	/nfs/dbraw/zinc/35/49/28/1348354928.db2.gz	YIAWMSYMKLAFHQ-UHFFFAOYSA-N	0	3	328.500	3.151	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2cc(C3CCCCC3)n[nH]2)C1	ZINC001079869168	1357406436	/nfs/dbraw/zinc/40/64/36/1357406436.db2.gz	BIBORDWZJYPBNM-RDTXWAMCSA-N	0	3	330.476	3.084	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3ncoc3CC)cccc2C1	ZINC001051283343	1348417522	/nfs/dbraw/zinc/41/75/22/1348417522.db2.gz	HFKORQSTGHRXNK-UHFFFAOYSA-N	0	3	339.439	3.101	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3nc(C)oc3C)cccc2C1	ZINC001051303609	1348426156	/nfs/dbraw/zinc/42/61/56/1348426156.db2.gz	LVMCAAQVEOGDHI-UHFFFAOYSA-N	0	3	339.439	3.156	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)[C@@H]3CCO[C@H](C)C3)cccc2C1	ZINC001051303872	1348426752	/nfs/dbraw/zinc/42/67/52/1348426752.db2.gz	QAOJVUYKDYSIOB-IAGOWNOFSA-N	0	3	342.483	3.052	20	30		EGEDHN
C=C(C)CCN1CCN([C@H]2CCN(C(=O)C=C3CCCCC3)C2)CC1	ZINC001051992354	1348494919	/nfs/dbraw/zinc/49/49/19/1348494919.db2.gz	WYIUJLZXYIUUCA-FQEVSTJZSA-N	0	3	345.531	3.062	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H](NC(=O)C3CCCC3)CC2)cc1	ZINC001052145336	1348507483	/nfs/dbraw/zinc/50/74/83/1348507483.db2.gz	ZJMCOJKPDXVJJJ-LJQANCHMSA-N	0	3	325.456	3.219	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H](NC(=O)C3CCCC3)CC2)cc1	ZINC001052145335	1348507851	/nfs/dbraw/zinc/50/78/51/1348507851.db2.gz	ZJMCOJKPDXVJJJ-IBGZPJMESA-N	0	3	325.456	3.219	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)C2(c3cccc(C)c3)CCC2)CC1	ZINC001052614457	1348597658	/nfs/dbraw/zinc/59/76/58/1348597658.db2.gz	RYJLYJZEUADUFR-HXUWFJFHSA-N	0	3	338.495	3.411	20	30		EGEDHN
Cc1ncccc1C(=O)N[C@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC001052669041	1348622552	/nfs/dbraw/zinc/62/25/52/1348622552.db2.gz	UWYRZIMSLLOQED-IBGZPJMESA-N	0	3	348.450	3.046	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc(F)c(Cl)c2F)CC1	ZINC001052682642	1348629555	/nfs/dbraw/zinc/62/95/55/1348629555.db2.gz	WPLRUQNPHOVADE-LBPRGKRZSA-N	0	3	340.801	3.226	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2)CC1	ZINC001052784251	1348678307	/nfs/dbraw/zinc/67/83/07/1348678307.db2.gz	OLMLOYDVMXLKBU-FGTMMUONSA-N	0	3	330.859	3.047	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H]2CCCN(Cc3cccc(C#N)c3)CC2)ccn1	ZINC001052802199	1348685310	/nfs/dbraw/zinc/68/53/10/1348685310.db2.gz	NHDFTOPFHRNELH-HXUWFJFHSA-N	0	3	348.450	3.046	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2[nH]ccc2-c2ccccc2)CC1	ZINC001052862100	1348706858	/nfs/dbraw/zinc/70/68/58/1348706858.db2.gz	GUSSZZMTHRNXOD-GOSISDBHSA-N	0	3	335.451	3.289	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC001052886459	1348723089	/nfs/dbraw/zinc/72/30/89/1348723089.db2.gz	LEXXKGYGFYJKOD-MRXNPFEDSA-N	0	3	338.373	3.313	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2cc3c(s2)CC[C@H](C)C3)CC1	ZINC001052923802	1348750465	/nfs/dbraw/zinc/75/04/65/1348750465.db2.gz	MPWMAAVTHDVHFU-GOEBONIOSA-N	0	3	330.497	3.090	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc(F)c3occc32)CC1	ZINC001052946723	1348763265	/nfs/dbraw/zinc/76/32/65/1348763265.db2.gz	CDHSDEJLGZZJCG-AWEZNQCLSA-N	0	3	328.387	3.180	20	30		EGEDHN
CC(=O)N1CCC[C@H]([C@H]2CCCN(Cc3ccc(F)c(C#N)c3)C2)C1	ZINC001052998076	1348795084	/nfs/dbraw/zinc/79/50/84/1348795084.db2.gz	UVQUFIKRYYABBV-ROUUACIJSA-N	0	3	343.446	3.168	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(F)cc2)C1	ZINC001053063432	1348875421	/nfs/dbraw/zinc/87/54/21/1348875421.db2.gz	MUONUBLDVMGPFF-MJGOQNOKSA-N	0	3	328.431	3.166	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2c(C)coc2C)C1	ZINC001053082661	1348904427	/nfs/dbraw/zinc/90/44/27/1348904427.db2.gz	GKHHZZYEZXYLRV-MSOLQXFVSA-N	0	3	328.456	3.236	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cccc(F)c2C)C1	ZINC001053086518	1348908380	/nfs/dbraw/zinc/90/83/80/1348908380.db2.gz	MUCDUXHUWFMNLD-FXAWDEMLSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cc(C)nc(C)c2)C1	ZINC001053087204	1348910585	/nfs/dbraw/zinc/91/05/85/1348910585.db2.gz	RJMKQEXIUJUFHL-UYAOXDASSA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cc(F)ccc2F)C1	ZINC001053087289	1348911031	/nfs/dbraw/zinc/91/10/31/1348911031.db2.gz	JUNQWFMGSZBLBW-DNVCBOLYSA-N	0	3	346.421	3.305	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(C)c(F)c2)C1	ZINC001053089519	1348915434	/nfs/dbraw/zinc/91/54/34/1348915434.db2.gz	BKCNFJVLOPPXGL-UYAOXDASSA-N	0	3	342.458	3.474	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)C2CC3(CC3)C2)C1	ZINC001053098926	1348930585	/nfs/dbraw/zinc/93/05/85/1348930585.db2.gz	RBDKNTQPQGELBY-IEBWSBKVSA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(C)cc2F)C1	ZINC001053099711	1348931915	/nfs/dbraw/zinc/93/19/15/1348931915.db2.gz	XYOVCMNOKVGMHI-PXNSSMCTSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2oc(CC)cc2C)C1	ZINC001053105018	1348940943	/nfs/dbraw/zinc/94/09/43/1348940943.db2.gz	LAESVYDQNDYKFS-IEBWSBKVSA-N	0	3	342.483	3.490	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)Cc2ccc(F)cc2)C1	ZINC001053105216	1348942560	/nfs/dbraw/zinc/94/25/60/1348942560.db2.gz	MVBMJTBZCGWEIX-ICSRJNTNSA-N	0	3	342.458	3.095	20	30		EGEDHN
C=CCCN1Cc2ccccc2C[C@@H]1CNC(=O)C1CC(F)(F)C1	ZINC001054036810	1349133228	/nfs/dbraw/zinc/13/32/28/1349133228.db2.gz	QWEQNRRMTYMWDG-QGZVFWFLSA-N	0	3	334.410	3.151	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cccc(-n3cccc3)c1)C2	ZINC001054160047	1349162209	/nfs/dbraw/zinc/16/22/09/1349162209.db2.gz	UCRBHEAACXVLIB-JOCHJYFZSA-N	0	3	347.462	3.039	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1c[nH]c3ccccc13)C2	ZINC001054161092	1349163762	/nfs/dbraw/zinc/16/37/62/1349163762.db2.gz	XDWPTFMDAVGJBI-NRFANRHFSA-N	0	3	335.451	3.119	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@]3(CCN(Cc4cccnc4)C3)C2)C1	ZINC001054194339	1349197256	/nfs/dbraw/zinc/19/72/56/1349197256.db2.gz	NSQZGDYNIGHUOY-NRFANRHFSA-N	0	3	339.483	3.252	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(Cl)c(F)c1)C2	ZINC001054204025	1349205205	/nfs/dbraw/zinc/20/52/05/1349205205.db2.gz	ZBCPTUOMFOZZTO-IBGZPJMESA-N	0	3	348.849	3.431	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc(F)ccc1Cl)C2	ZINC001054203650	1349205399	/nfs/dbraw/zinc/20/53/99/1349205399.db2.gz	VLTISQADFPTJFR-LJQANCHMSA-N	0	3	348.849	3.431	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cccc(OCC)c1)C2	ZINC001054205015	1349207127	/nfs/dbraw/zinc/20/71/27/1349207127.db2.gz	IQYAWLJQEULELX-NRFANRHFSA-N	0	3	340.467	3.037	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)C(C)(C)c1ccc(F)cc1)C2	ZINC001054228706	1349222648	/nfs/dbraw/zinc/22/26/48/1349222648.db2.gz	XUUSONHAYWKAHJ-NRFANRHFSA-N	0	3	342.458	3.051	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc3c(c1)CCCC3)C2	ZINC001054237450	1349230618	/nfs/dbraw/zinc/23/06/18/1349230618.db2.gz	XODWWRPGUOYACY-JOCHJYFZSA-N	0	3	336.479	3.127	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1sccc1C(C)C)C2	ZINC001054244670	1349238734	/nfs/dbraw/zinc/23/87/34/1349238734.db2.gz	XKJWJVMJRAEGBT-LJQANCHMSA-N	0	3	330.497	3.433	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H]1CC3CCC1CC3)C2	ZINC001054245755	1349239124	/nfs/dbraw/zinc/23/91/24/1349239124.db2.gz	BAPNHMIQLSNFOD-SDVBZNEUSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)C1(C(F)(F)F)CCCC1)C2	ZINC001054249349	1349244448	/nfs/dbraw/zinc/24/44/48/1349244448.db2.gz	SVVKIQHJJSQMDP-INIZCTEOSA-N	0	3	342.405	3.057	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@H]3C[C@@H]3C(F)F)cc2C1	ZINC001054263181	1349260750	/nfs/dbraw/zinc/26/07/50/1349260750.db2.gz	GLFKQTQVCKOSDC-IRXDYDNUSA-N	0	3	334.410	3.486	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@H]3CC[C@H](OC)C3)cc2C1	ZINC001054271007	1349269789	/nfs/dbraw/zinc/26/97/89/1349269789.db2.gz	FFICIIWHRCGXQO-PXNSSMCTSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)NCc1ccc2c(c1)CN(CCC(C)C)C2	ZINC001054283325	1349284538	/nfs/dbraw/zinc/28/45/38/1349284538.db2.gz	VYVVUNDPFJFWFR-UXHICEINSA-N	0	3	342.483	3.256	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cc(CC)on3)cc2C1	ZINC001054289509	1349293067	/nfs/dbraw/zinc/29/30/67/1349293067.db2.gz	JGAGNNRUXKDQQV-UHFFFAOYSA-N	0	3	325.412	3.059	20	30		EGEDHN
C=CCN1Cc2ccc(CNC(=O)c3cccc(CN(C)C)c3)cc2C1	ZINC001054292529	1349297773	/nfs/dbraw/zinc/29/77/73/1349297773.db2.gz	KBNCYSWKWSJZBK-UHFFFAOYSA-N	0	3	349.478	3.180	20	30		EGEDHN
C[C@@H]1CN(C(=O)C(F)=C2CCCC2)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054572291	1349403631	/nfs/dbraw/zinc/40/36/31/1349403631.db2.gz	WUAWXXYMLHBRRQ-WBMJQRKESA-N	0	3	347.459	3.354	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](NCc2cc(F)ccc2OC)[C@@H](C)C1	ZINC001054970995	1349532179	/nfs/dbraw/zinc/53/21/79/1349532179.db2.gz	KYFCLRVNNVHWFL-YOEHRIQHSA-N	0	3	348.462	3.373	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CN(CCOc3ccc(C)cc3)C[C@H]2C)C1	ZINC001080404385	1357608839	/nfs/dbraw/zinc/60/88/39/1357608839.db2.gz	FRUPEWCVXXRUND-IEBWSBKVSA-N	0	3	342.483	3.167	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2ccccc2OC2CCC2)C1	ZINC001080407460	1357609887	/nfs/dbraw/zinc/60/98/87/1357609887.db2.gz	BZIMFJQRMZXOAB-CRAIPNDOSA-N	0	3	328.456	3.244	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@@]2(C)CCCc3ccccc32)C1	ZINC001080621998	1357702999	/nfs/dbraw/zinc/70/29/99/1357702999.db2.gz	AJWFQHQDEQUULD-BSIFCXSSSA-N	0	3	326.484	3.293	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3scnc3C(C)C)[C@@H]2C1	ZINC001084708586	1358287618	/nfs/dbraw/zinc/28/76/18/1358287618.db2.gz	LHAHBBOFYVSBIP-HUUCEWRRSA-N	0	3	333.501	3.379	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1cc(Cl)c(Cl)n1C	ZINC001085627321	1358645396	/nfs/dbraw/zinc/64/53/96/1358645396.db2.gz	DSVLTLPKPHADBL-LLVKDONJSA-N	0	3	330.259	3.054	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)CC1(C)CCCC1)C[C@H](C)O2	ZINC001071164122	1354483947	/nfs/dbraw/zinc/48/39/47/1354483947.db2.gz	HMQPXAUIRKOYPQ-PXNSSMCTSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1c(C)oc(C)c1C)C[C@@H](C)O2	ZINC001071190433	1354494658	/nfs/dbraw/zinc/49/46/58/1354494658.db2.gz	ZGOVANKMICLVDB-VLIAUNLRSA-N	0	3	346.471	3.086	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C(C)(C)C(C)(C)C)C[C@@H](C)O2	ZINC001071197204	1354499105	/nfs/dbraw/zinc/49/91/05/1354499105.db2.gz	OOZLEEUDPYUXGW-OXQOHEQNSA-N	0	3	336.520	3.327	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C1(C)CCCCC1)C[C@@H](C)O2	ZINC001071206535	1354505147	/nfs/dbraw/zinc/50/51/47/1354505147.db2.gz	LQHGDNKPXNRFKG-YLJYHZDGSA-N	0	3	334.504	3.225	20	30		EGEDHN
C#CCCN1CC[C@]2(C1)CN(C(=O)CCC1CCCCC1)C[C@H](C)O2	ZINC001071233530	1354517342	/nfs/dbraw/zinc/51/73/42/1354517342.db2.gz	KGEDCQXJZABGJS-RXVVDRJESA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H]3CCC(C)=C(C)C3)C2)CC1	ZINC001086924459	1359249811	/nfs/dbraw/zinc/24/98/11/1359249811.db2.gz	SXBYOCPCDIAUKQ-RBUKOAKNSA-N	0	3	328.500	3.459	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccnn2C2CCCC2)CC[C@H]1C	ZINC001071542540	1354756350	/nfs/dbraw/zinc/75/63/50/1354756350.db2.gz	HGFLYOVDGJUQST-CVEARBPZSA-N	0	3	330.476	3.157	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cccc(OCCC)c2)CC[C@H]1C	ZINC001071544419	1354757928	/nfs/dbraw/zinc/75/79/28/1354757928.db2.gz	YPTFFKMRZAVSKL-AEFFLSMTSA-N	0	3	328.456	3.081	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccccc2-c2cn[nH]c2)CC[C@@H]1C	ZINC001071549005	1354761525	/nfs/dbraw/zinc/76/15/25/1354761525.db2.gz	NEOFAUBUZNFFEB-RDJZCZTQSA-N	0	3	338.455	3.236	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccnn2C(CC)CC)CC[C@H]1C	ZINC001071568243	1354768077	/nfs/dbraw/zinc/76/80/77/1354768077.db2.gz	KZCJPOSNULQPPQ-CVEARBPZSA-N	0	3	332.492	3.403	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)c2cn(C)c3ccc(F)cc23)CC[C@@H]1C	ZINC001071572434	1354771726	/nfs/dbraw/zinc/77/17/26/1354771726.db2.gz	VVCPIDVHOUABJA-ZFWWWQNUSA-N	0	3	329.419	3.086	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc(C3CCCCC3)n[nH]2)CC[C@@H]1C	ZINC001071576439	1354773750	/nfs/dbraw/zinc/77/37/50/1354773750.db2.gz	GOCZRRNZCUOPDK-DOTOQJQBSA-N	0	3	342.487	3.063	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2oc(CC)nc2C)C1	ZINC001088409916	1359881831	/nfs/dbraw/zinc/88/18/31/1359881831.db2.gz	VDKLUQKROLVWQV-CQSZACIVSA-N	0	3	339.867	3.272	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2cc(C)c(Cl)cn2)CC[C@@H]1C	ZINC001071601773	1354788637	/nfs/dbraw/zinc/78/86/37/1354788637.db2.gz	DSFGTSRKULIKFN-GJZGRUSLSA-N	0	3	335.879	3.131	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc(C)n(C(CC)CC)n2)CC[C@@H]1C	ZINC001071627277	1354812092	/nfs/dbraw/zinc/81/20/92/1354812092.db2.gz	BROHIWVUMKCARL-RDJZCZTQSA-N	0	3	344.503	3.159	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cnn(-c3ccccc3)c2)CC[C@H]1C	ZINC001071662290	1354834102	/nfs/dbraw/zinc/83/41/02/1354834102.db2.gz	BSJREIMFJKJJOP-AEFFLSMTSA-N	0	3	338.455	3.031	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2sccc2-n2cccc2)CC[C@@H]1C	ZINC001071724606	1354880758	/nfs/dbraw/zinc/88/07/58/1354880758.db2.gz	JRDTUZDWBSAPSI-JKSUJKDBSA-N	0	3	341.480	3.145	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc3ccccc3[nH]c2=O)CC[C@@H]1C	ZINC001071724592	1354880948	/nfs/dbraw/zinc/88/09/48/1354880948.db2.gz	JMXVMCXWEVEIKU-GOEBONIOSA-N	0	3	339.439	3.099	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc3ccccc3[nH]c2=O)CC[C@H]1C	ZINC001071724591	1354881225	/nfs/dbraw/zinc/88/12/25/1354881225.db2.gz	JMXVMCXWEVEIKU-GDBMZVCRSA-N	0	3	339.439	3.099	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2cc3ncccc3s2)CC[C@@H]1C	ZINC001071734749	1354887383	/nfs/dbraw/zinc/88/73/83/1354887383.db2.gz	AADCBINNUGDVBI-UONOGXRCSA-N	0	3	329.469	3.455	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CC[C@H](C)N(Cc3ccc(C)cc3)C2)c1	ZINC001071816022	1354957362	/nfs/dbraw/zinc/95/73/62/1354957362.db2.gz	TUHUMNHQEGQSQE-UWJYYQICSA-N	0	3	347.462	3.154	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccccc2OC2CCC2)CC[C@H]1C	ZINC001071819634	1354959854	/nfs/dbraw/zinc/95/98/54/1354959854.db2.gz	WBUQFXYABCXLHW-SJORKVTESA-N	0	3	340.467	3.224	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc3nc(C)ccc3c2)CC[C@H]1C	ZINC001071920871	1355025572	/nfs/dbraw/zinc/02/55/72/1355025572.db2.gz	YQQDAMHNBUPKJY-APWZRJJASA-N	0	3	335.451	3.149	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc3[nH]c(C)nc3c2)CC[C@@H]1C	ZINC001071938730	1355034906	/nfs/dbraw/zinc/03/49/06/1355034906.db2.gz	OUAHSVWIUMURGB-XJKSGUPXSA-N	0	3	326.444	3.030	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(C)nc2OCCC)CC[C@H]1C	ZINC001071937782	1355034965	/nfs/dbraw/zinc/03/49/65/1355034965.db2.gz	HISBVVNWMVIPRC-SJORKVTESA-N	0	3	345.487	3.338	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(-c3c[nH]cn3)cc2)CC[C@@H]1C	ZINC001071957052	1355042208	/nfs/dbraw/zinc/04/22/08/1355042208.db2.gz	BHSNCLCARVQQQC-MAUKXSAKSA-N	0	3	338.455	3.236	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(OC(C)C)cc2)CC[C@H]1C	ZINC001072049592	1355103586	/nfs/dbraw/zinc/10/35/86/1355103586.db2.gz	PUDMLFBXVWVYSR-SJLPKXTDSA-N	0	3	328.456	3.080	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc(-c3ccc(C)o3)n[nH]2)CC[C@@H]1C	ZINC001072072302	1355112870	/nfs/dbraw/zinc/11/28/70/1355112870.db2.gz	IODAHXXDQBVEGX-ZFWWWQNUSA-N	0	3	342.443	3.137	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(OC3CCC3)cc2)CC[C@H]1C	ZINC001072095683	1355126882	/nfs/dbraw/zinc/12/68/82/1355126882.db2.gz	MTPYDDFPCKZMJM-AEFFLSMTSA-N	0	3	340.467	3.224	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2(c3ccc(C)cc3)CCC2)CC[C@@H]1C	ZINC001072101932	1355130720	/nfs/dbraw/zinc/13/07/20/1355130720.db2.gz	LQGNPPGHDFJZPA-AZUAARDMSA-N	0	3	338.495	3.409	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C23CC(C(F)(F)F)(C2)C3)CC[C@@H]1C	ZINC001072102094	1355131072	/nfs/dbraw/zinc/13/10/72/1355131072.db2.gz	MRBWVLSGJHSIDP-VRLRAXNCSA-N	0	3	330.394	3.264	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)Cc2cccc(OC(C)C)c2)CC[C@H]1C	ZINC001072102659	1355131445	/nfs/dbraw/zinc/13/14/45/1355131445.db2.gz	QHKWNOMSRSVRBW-AEFFLSMTSA-N	0	3	330.472	3.171	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N[C@@H]2CC[C@H](C)N(CC(=C)C)C2)cc1	ZINC001072106898	1355134790	/nfs/dbraw/zinc/13/47/90/1355134790.db2.gz	XNVQUJZWQULSAG-PKOBYXMFSA-N	0	3	342.483	3.339	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2c[nH]c3ccc(F)cc23)CC[C@@H]1C	ZINC001072119807	1355141081	/nfs/dbraw/zinc/14/10/81/1355141081.db2.gz	JZNNCMVARYNYPB-DZGCQCFKSA-N	0	3	329.419	3.466	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(CC)c(CC)c2)CC[C@@H]1C	ZINC001072124356	1355142527	/nfs/dbraw/zinc/14/25/27/1355142527.db2.gz	ZITBTMOXXROXCF-OXJNMPFZSA-N	0	3	326.484	3.417	20	30		EGEDHN
C[C@@H]1CCN(C(=O)C(C)(C)F)C[C@H]1CNCc1cc(F)ccc1C#N	ZINC001072156135	1355157241	/nfs/dbraw/zinc/15/72/41/1355157241.db2.gz	KUMVMOGMZOJIIB-CZUORRHYSA-N	0	3	349.425	3.020	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@@H](C)[C@@H](CNCc2ccccc2C#N)C1	ZINC001072170125	1355165072	/nfs/dbraw/zinc/16/50/72/1355165072.db2.gz	CBNGPOBEHMYUDF-APWZRJJASA-N	0	3	327.472	3.179	20	30		EGEDHN
C[C@H]1CCN(C(=O)c2ccoc2)C[C@H]1CNCc1ccccc1C#N	ZINC001072194139	1355182139	/nfs/dbraw/zinc/18/21/39/1355182139.db2.gz	FXQSEHAXLGUHDW-HNAYVOBHSA-N	0	3	337.423	3.039	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@@H](C)[C@H](CNCc2ccccc2C#N)C1	ZINC001072252253	1355208977	/nfs/dbraw/zinc/20/89/77/1355208977.db2.gz	RTYGPSLJLXTKDK-CRAIPNDOSA-N	0	3	343.446	3.396	20	30		EGEDHN
C[C@H]1CCN(C(=O)C2(C)CC2)C[C@H]1CNCc1cc(F)ccc1C#N	ZINC001072288439	1355222149	/nfs/dbraw/zinc/22/21/49/1355222149.db2.gz	LKIKPAHGQAJJEY-WMLDXEAASA-N	0	3	343.446	3.072	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC2(C1)CCN(C/C=C\c1ccc(Cl)cc1)C2	ZINC001072551496	1355330408	/nfs/dbraw/zinc/33/04/08/1355330408.db2.gz	GBPMFHRMIRMYPG-MPNWYJEXSA-N	0	3	343.858	3.047	20	30		EGEDHN
C[C@@]1(C(=O)N2CC3(C2)CCN(Cc2ccc(C#N)cc2)C3)CC=CCC1	ZINC001072773842	1355430379	/nfs/dbraw/zinc/43/03/79/1355430379.db2.gz	HVSKRJVDDKDONP-OAQYLSRUSA-N	0	3	349.478	3.339	20	30		EGEDHN
C[C@@H](C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2)C(C)(C)C	ZINC001072854419	1355467085	/nfs/dbraw/zinc/46/70/85/1355467085.db2.gz	NJLKVFLFZRUOBJ-INIZCTEOSA-N	0	3	339.483	3.275	20	30		EGEDHN
C[C@H](C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2)C(C)(C)C	ZINC001072855717	1355467582	/nfs/dbraw/zinc/46/75/82/1355467582.db2.gz	FATLJIXFRTWJCL-MRXNPFEDSA-N	0	3	339.483	3.275	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1ncccc1C)C2	ZINC001072945329	1355513765	/nfs/dbraw/zinc/51/37/65/1355513765.db2.gz	ZOZHGSVCZREKGR-LJQANCHMSA-N	0	3	327.472	3.027	20	30		EGEDHN
C=C1CCC(C(=O)N2CC3(C2)CCN(Cc2ccc(C#N)cc2)C3)CC1	ZINC001072945998	1355514490	/nfs/dbraw/zinc/51/44/90/1355514490.db2.gz	ACWJFZCTROEFHZ-UHFFFAOYSA-N	0	3	349.478	3.339	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)CC(C3CCC3)C3CCC3)C2)C1	ZINC001072987296	1355535589	/nfs/dbraw/zinc/53/55/89/1355535589.db2.gz	KHFMCEFWHJDGSQ-UHFFFAOYSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H]3C[C@H]3c3ccc(Cl)cc3)C2)C1	ZINC001073050408	1355568707	/nfs/dbraw/zinc/56/87/07/1355568707.db2.gz	YRGLJQUDHPHRDO-ZWKOTPCHSA-N	0	3	342.870	3.001	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)CC34CC5CC(CC(C5)C3)C4)C2)C1	ZINC001073147538	1355626125	/nfs/dbraw/zinc/62/61/25/1355626125.db2.gz	ATHROPVFNIAEID-UHFFFAOYSA-N	0	3	328.500	3.313	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3cc4cc(F)ccc4s3)C2)C1	ZINC001073420253	1355769347	/nfs/dbraw/zinc/76/93/47/1355769347.db2.gz	UGDPSHLYPSJTMH-UHFFFAOYSA-N	0	3	330.428	3.374	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2c(C)oc3ccccc32)C1	ZINC001073617528	1355846361	/nfs/dbraw/zinc/84/63/61/1355846361.db2.gz	HCXNDYBLKDZYAQ-MRXNPFEDSA-N	0	3	342.439	3.138	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2sccc2C(C)C)C1	ZINC001073899267	1355946138	/nfs/dbraw/zinc/94/61/38/1355946138.db2.gz	PCWKCRKFFIDRKD-OAHLLOKOSA-N	0	3	336.501	3.268	20	30		EGEDHN
Cc1ccc(F)cc1CN(C)C[C@H]1CCCCN1C(=O)[C@H](C)C#N	ZINC001073972779	1356004016	/nfs/dbraw/zinc/00/40/16/1356004016.db2.gz	DXAVLKQUNVXGJQ-CRAIPNDOSA-N	0	3	331.435	3.107	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCCN1C(=O)[C@H]1CC1(F)F	ZINC001074012038	1356033844	/nfs/dbraw/zinc/03/38/44/1356033844.db2.gz	ADKBPNXPLPRPHC-IAGOWNOFSA-N	0	3	347.409	3.026	20	30		EGEDHN
C[C@H](CC(=O)N1CC[C@H](NCc2ccc(C#N)s2)[C@@H]1C)C1CC1	ZINC001075134070	1356324255	/nfs/dbraw/zinc/32/42/55/1356324255.db2.gz	ZCMQYOSJNVTRCT-IGCXYCKISA-N	0	3	331.485	3.135	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccccc2)CC[C@H]1CNCc1ccccc1C#N	ZINC001075205882	1356339520	/nfs/dbraw/zinc/33/95/20/1356339520.db2.gz	NUFWKQVYAVACKV-XLIONFOSSA-N	0	3	347.462	3.446	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1nc(Cl)cs1)C2	ZINC001097719247	1363108141	/nfs/dbraw/zinc/10/81/41/1363108141.db2.gz	ZQMMXNZANMIYCQ-UTUOFQBUSA-N	0	3	325.865	3.098	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](C)c1ccc(Cl)cc1)C2	ZINC001097773921	1363117816	/nfs/dbraw/zinc/11/78/16/1363117816.db2.gz	HMPJXLJCVWWDRK-PILAGYSTSA-N	0	3	330.859	3.188	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ocnc3-c3ccccc3)[C@@H]2C1	ZINC001075869251	1356435505	/nfs/dbraw/zinc/43/55/05/1356435505.db2.gz	JAJAGGMWZLNJGN-DLBZAZTESA-N	0	3	337.423	3.064	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3coc4ccc(OC)cc34)[C@@H]2C1	ZINC001076026343	1356468863	/nfs/dbraw/zinc/46/88/63/1356468863.db2.gz	VCZCWZQYOPHMIJ-KBXCAEBGSA-N	0	3	340.423	3.164	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)c3cc4cc(Cl)ccc4[nH]3)[C@@H]2C1	ZINC001076116315	1356494272	/nfs/dbraw/zinc/49/42/72/1356494272.db2.gz	PUWNMMOSQZCCPQ-YVEFUNNKSA-N	0	3	329.831	3.154	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)c3ccc(OCC(C)C)cc3)[C@@H]2C1	ZINC001076533304	1356608628	/nfs/dbraw/zinc/60/86/28/1356608628.db2.gz	SYRFVEITRKYNQP-PKOBYXMFSA-N	0	3	328.456	3.054	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@@H]1CCC(C)(C)CN1CCn1cccn1	ZINC001099250709	1363712971	/nfs/dbraw/zinc/71/29/71/1363712971.db2.gz	ACJZGVGHPQCASX-KRWDZBQOSA-N	0	3	346.519	3.092	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@@H]2C[C@H](NC(=O)C3CCC3)C23CCC3)c1	ZINC001078524655	1356993175	/nfs/dbraw/zinc/99/31/75/1356993175.db2.gz	VMBDEPFVELQFIS-MSOLQXFVSA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2cc(C)ccc2OC)C12CCC2	ZINC001078676629	1357050901	/nfs/dbraw/zinc/05/09/01/1357050901.db2.gz	ZOYCWMUOXSGFLR-IAGOWNOFSA-N	0	3	348.874	3.387	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2ncc(Cl)s2)C12CCC2	ZINC001078680915	1357053002	/nfs/dbraw/zinc/05/30/02/1357053002.db2.gz	VDFVIYKMJJXRBO-NXEZZACHSA-N	0	3	346.283	3.180	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2cc(OC)cs2)C12CCC2	ZINC001078695670	1357059040	/nfs/dbraw/zinc/05/90/40/1357059040.db2.gz	PSGNZTFODKVEGF-KGLIPLIRSA-N	0	3	340.876	3.140	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2ccc(C)cc2C)C[C@H]1c1ccccc1	ZINC001081222355	1357851282	/nfs/dbraw/zinc/85/12/82/1357851282.db2.gz	ZLHXZAFYGGIRDQ-LEWJYISDSA-N	0	3	332.447	3.134	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H](C)Cc2ccccc2)C[C@H]1c1ccccc1	ZINC001081230286	1357852017	/nfs/dbraw/zinc/85/20/17/1357852017.db2.gz	XPODALBMJXVBBY-BVYCBKJFSA-N	0	3	346.474	3.083	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2ccccc2CCC)[C@H](OC)C1	ZINC001081927131	1357896274	/nfs/dbraw/zinc/89/62/74/1357896274.db2.gz	DIEDTCOOAWQFPQ-RTBURBONSA-N	0	3	330.472	3.034	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H](C)[C@H](NCc2cccc(Cl)n2)C1	ZINC001082721839	1358079986	/nfs/dbraw/zinc/07/99/86/1358079986.db2.gz	MDURFWWNYPIOOJ-SIIHOXLZSA-N	0	3	335.879	3.274	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@@H]3C[C@H]3c3sccc3C)[C@@H]2C1	ZINC001084339272	1358196179	/nfs/dbraw/zinc/19/61/79/1358196179.db2.gz	VQDMDEFCTSPNBA-QBPKDAKJSA-N	0	3	330.497	3.269	20	30		EGEDHN
C#Cc1ccc(C(=O)N2C[C@H]3CCN(Cc4ccccc4)C[C@H]32)cc1	ZINC001084568105	1358239948	/nfs/dbraw/zinc/23/99/48/1358239948.db2.gz	YQGJPOFYSQRCRX-NHCUHLMSSA-N	0	3	330.431	3.014	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CCN(CC3CC(F)(F)C3)C[C@H]21	ZINC001084635257	1358263506	/nfs/dbraw/zinc/26/35/06/1358263506.db2.gz	TZMDLYDVEREEGX-INMHGKMJSA-N	0	3	326.431	3.167	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)c3coc4ccc(Cl)cc34)[C@@H]2C1	ZINC001084801838	1358314806	/nfs/dbraw/zinc/31/48/06/1358314806.db2.gz	TYMBIPKWZBZHIQ-CXAGYDPISA-N	0	3	342.826	3.256	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@@H](C)Cc3ccc(C)cc3)[C@@H]2C1	ZINC001084856012	1358330578	/nfs/dbraw/zinc/33/05/78/1358330578.db2.gz	PLKPNINVUSXBRR-DFQSSKMNSA-N	0	3	326.484	3.282	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N1CC[C@H]2CCN(Cc3ccc(C#N)cc3)[C@H]2C1	ZINC001084923361	1358349933	/nfs/dbraw/zinc/34/99/33/1358349933.db2.gz	MKWSVWGYAVAJNF-QYZOEREBSA-N	0	3	337.467	3.027	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C[C@H](C)c3ccccc3C)C[C@@H]21	ZINC001085048911	1358378310	/nfs/dbraw/zinc/37/83/10/1358378310.db2.gz	OZRKPHSGHNDRDB-ZVDOUQERSA-N	0	3	338.495	3.435	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@]3(C)CCCc4ccccc43)C[C@@H]21	ZINC001085056987	1358381089	/nfs/dbraw/zinc/38/10/89/1358381089.db2.gz	XBJMRCHDCLPVAZ-KAGYGMCKSA-N	0	3	338.495	3.389	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H]1CC=CCC1	ZINC001085131437	1358406345	/nfs/dbraw/zinc/40/63/45/1358406345.db2.gz	MSZNFZWAQDMZCN-RRFJBIMHSA-N	0	3	341.293	3.268	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cnn(C(C)(C)C)c1	ZINC001085253240	1358445449	/nfs/dbraw/zinc/44/54/49/1358445449.db2.gz	DRZGRRYCPAVSOE-HUUCEWRRSA-N	0	3	338.883	3.021	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ncc(Cl)s1	ZINC001085273261	1358448549	/nfs/dbraw/zinc/44/85/49/1358448549.db2.gz	XWMIGLZTLOXWNL-NXEZZACHSA-N	0	3	334.272	3.180	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)Cc1c[nH]c2ccccc12	ZINC001085402782	1358490493	/nfs/dbraw/zinc/49/04/93/1358490493.db2.gz	CZXHJJVYORILAF-QZTJIDSGSA-N	0	3	345.874	3.480	20	30		EGEDHN
C=C1CCC(C(=O)N(C)C[C@H]2CCN2C[C@@H](OC)C2CCC2)CC1	ZINC001085801617	1358776963	/nfs/dbraw/zinc/77/69/63/1358776963.db2.gz	XRJDICGZCSRPPK-RTBURBONSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1c[nH]c(-c2ccccc2)n1	ZINC001085846729	1358814579	/nfs/dbraw/zinc/81/45/79/1358814579.db2.gz	PRXOOGRBSHAMQN-QGZVFWFLSA-N	0	3	338.455	3.189	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@@H]1C[C@H]1c1ccccc1OC	ZINC001085865796	1358832058	/nfs/dbraw/zinc/83/20/58/1358832058.db2.gz	NORVWHJTMXBIJT-NZSAHSFTSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ncccc1C(F)(F)F	ZINC001085908796	1358868514	/nfs/dbraw/zinc/86/85/14/1358868514.db2.gz	RYXQUOGQDJQVMJ-ZDUSSCGKSA-N	0	3	341.377	3.213	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C[C@@H]2CCN2CCC2CCCCC2)cn1	ZINC001085932746	1358888005	/nfs/dbraw/zinc/88/80/05/1358888005.db2.gz	HWRDUAUOCUCRCZ-FQEVSTJZSA-N	0	3	339.483	3.180	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)c2ccc(C)s2)C1	ZINC001086014736	1358965037	/nfs/dbraw/zinc/96/50/37/1358965037.db2.gz	FIERZCGFNFUONN-TXEJJXNPSA-N	0	3	343.290	3.063	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)c2cccc(C)c2)C1	ZINC001086019208	1358968241	/nfs/dbraw/zinc/96/82/41/1358968241.db2.gz	CHHXPYAWLVXCLL-OTVXOJSOSA-N	0	3	337.261	3.002	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)c2cscc2C)C1	ZINC001086056234	1358981014	/nfs/dbraw/zinc/98/10/14/1358981014.db2.gz	FCECHSRXJUEGAM-TXEJJXNPSA-N	0	3	343.290	3.063	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccn(C(CC)CC)n2)C1	ZINC001086217181	1359030705	/nfs/dbraw/zinc/03/07/05/1359030705.db2.gz	RGFHALGPCBFOJW-OKILXGFUSA-N	0	3	338.883	3.095	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)[C@@H]2CCCC2(C)C)C1	ZINC001086450176	1359099817	/nfs/dbraw/zinc/09/98/17/1359099817.db2.gz	JHFORYLRUFXZFK-IHRRRGAJSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2C[C@H](NCc3c(C)nsc3C)C2)CC1	ZINC001086467734	1359108558	/nfs/dbraw/zinc/10/85/58/1359108558.db2.gz	RRNLDXQVXVDOEC-JCNLHEQBSA-N	0	3	347.528	3.491	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2ccn(CC)c2C)C1	ZINC001086605554	1359162153	/nfs/dbraw/zinc/16/21/53/1359162153.db2.gz	KISJUUZQZYXKLJ-LEWJYISDSA-N	0	3	349.478	3.038	20	30		EGEDHN
C=CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2ccc(OC)o2)C1	ZINC001086616777	1359165325	/nfs/dbraw/zinc/16/53/25/1359165325.db2.gz	XFZLTLQOERKDNH-DLBZAZTESA-N	0	3	340.423	3.062	20	30		EGEDHN
Cc1cc(C)cc(CC(=O)NCC2(NCc3ccc(C#N)cc3)CC2)c1	ZINC001323531602	1387383376	/nfs/dbraw/zinc/38/33/76/1387383376.db2.gz	ZDDGRVINLTWNJH-UHFFFAOYSA-N	0	3	347.462	3.156	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H]3C[C@@H]4C=C[C@H]3CC4)C2)CC1	ZINC001086925331	1359250962	/nfs/dbraw/zinc/25/09/62/1359250962.db2.gz	TVDIYFWENXUTRX-YSTOQKLRSA-N	0	3	340.511	3.315	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H]3C[C@@H]4CCCC[C@H]34)C2)CC1	ZINC001086934435	1359258024	/nfs/dbraw/zinc/25/80/24/1359258024.db2.gz	PJMGTSRSXREEIB-YDZRNGNQSA-N	0	3	328.500	3.149	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc(OCC)cc3)C2)CC1	ZINC001086955355	1359276249	/nfs/dbraw/zinc/27/62/49/1359276249.db2.gz	LKLJAIOWEUJQEN-KRWDZBQOSA-N	0	3	340.467	3.035	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)CCc3ccccc3F)C2)CC1	ZINC001086956179	1359277143	/nfs/dbraw/zinc/27/71/43/1359277143.db2.gz	HBZMWPIBEOOXDL-KRWDZBQOSA-N	0	3	342.458	3.095	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)[C@H]3[C@H]4[C@@H]3[C@@H]3CC[C@H]4C3)C2)CC1	ZINC001086958886	1359279644	/nfs/dbraw/zinc/27/96/44/1359279644.db2.gz	GPZWZWVRMGIEDQ-GTYQWKCWSA-N	0	3	340.511	3.005	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)C(F)=C3CCCC3)C(C)(C)[C@H]21	ZINC001087281717	1359360820	/nfs/dbraw/zinc/36/08/20/1359360820.db2.gz	LFPJFKIEJWBXMS-NXHRZFHOSA-N	0	3	332.463	3.413	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1sccc1Cl	ZINC001087287615	1359366369	/nfs/dbraw/zinc/36/63/69/1359366369.db2.gz	KCHREIWIZJNJEP-BYCMXARLSA-N	0	3	336.888	3.254	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1sc(C)cc1C	ZINC001087289992	1359368870	/nfs/dbraw/zinc/36/88/70/1359368870.db2.gz	VQZUPPMVXODTRA-HYVNUMGLSA-N	0	3	330.497	3.217	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(F)c(C)cc3F)C(C)(C)[C@H]21	ZINC001087290479	1359369327	/nfs/dbraw/zinc/36/93/27/1359369327.db2.gz	CQDSHUQVBANAKJ-XWIAVFTESA-N	0	3	346.421	3.125	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cccc2cccnc21	ZINC001087294539	1359374939	/nfs/dbraw/zinc/37/49/39/1359374939.db2.gz	UYLFGGXGDACYTB-YZGWKJHDSA-N	0	3	347.462	3.087	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(F)c(Cl)c3)C(C)(C)[C@@H]21	ZINC001087300291	1359382660	/nfs/dbraw/zinc/38/26/60/1359382660.db2.gz	IYDVGFPUYDRAOQ-KBRIMQKVSA-N	0	3	348.849	3.331	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc[nH]c1C1CC1	ZINC001087300540	1359383414	/nfs/dbraw/zinc/38/34/14/1359383414.db2.gz	MMKILZRXQGNIAO-NZSAHSFTSA-N	0	3	339.483	3.134	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc2ncccc2c1	ZINC001087302273	1359384869	/nfs/dbraw/zinc/38/48/69/1359384869.db2.gz	QBBYWXRZTYXTQO-YZGWKJHDSA-N	0	3	347.462	3.087	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(F)ccc3Cl)C(C)(C)[C@@H]21	ZINC001087305845	1359391049	/nfs/dbraw/zinc/39/10/49/1359391049.db2.gz	ZKLLAUKYNDFPSY-KBRIMQKVSA-N	0	3	348.849	3.331	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3csc(Cl)c3)C(C)(C)[C@@H]21	ZINC001087306876	1359394161	/nfs/dbraw/zinc/39/41/61/1359394161.db2.gz	PXQFEMACTFLATR-BPLDGKMQSA-N	0	3	336.888	3.254	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)[C@H]1CC[C@H](C)CC1	ZINC001087314155	1359403173	/nfs/dbraw/zinc/40/31/73/1359403173.db2.gz	GKKUSPITSYENAW-IEWDOMPSSA-N	0	3	330.516	3.441	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc(Cl)s3)C(C)(C)[C@H]21	ZINC001087316608	1359407618	/nfs/dbraw/zinc/40/76/18/1359407618.db2.gz	UWKJKNYBQQWLBJ-UGFHNGPFSA-N	0	3	336.888	3.254	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc4[nH]ccc4s3)C(C)(C)[C@H]21	ZINC001087316907	1359408211	/nfs/dbraw/zinc/40/82/11/1359408211.db2.gz	ZEFRJCFBHGQHHC-JLZZUVOBSA-N	0	3	341.480	3.081	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc4ccccc4[nH]3)C(C)(C)[C@H]21	ZINC001087317966	1359409671	/nfs/dbraw/zinc/40/96/71/1359409671.db2.gz	PFXZOQRXYYTMRX-AHRSYUTCSA-N	0	3	349.478	3.410	20	30		EGEDHN
C=CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)c2ncoc2C)C1	ZINC001087422464	1359459351	/nfs/dbraw/zinc/45/93/51/1359459351.db2.gz	DPUBWIQPPSDGBZ-QZTJIDSGSA-N	0	3	339.439	3.147	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cccc3c2O[C@@H](C)C3)[C@H]1CC	ZINC001087662150	1359577498	/nfs/dbraw/zinc/57/74/98/1359577498.db2.gz	VVMSEUKOCOMKJQ-JCGIZDLHSA-N	0	3	328.456	3.169	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc(OC)c(C3CC3)c2)[C@H]1CC	ZINC001087778432	1359639065	/nfs/dbraw/zinc/63/90/65/1359639065.db2.gz	YUCUYEMXSYOVFQ-ZWKOTPCHSA-N	0	3	328.456	3.341	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2cnc(C(C)(C)C)s2)[C@H]1CC	ZINC001087841524	1359674899	/nfs/dbraw/zinc/67/48/99/1359674899.db2.gz	BHBLVUSPDFGBEU-UONOGXRCSA-N	0	3	333.501	3.047	20	30		EGEDHN
C/C(=C/C(=O)N1C[C@H]2CCN(Cc3ccc(C#N)cc3)C[C@H]2C1)C1CC1	ZINC001087898772	1359701668	/nfs/dbraw/zinc/70/16/68/1359701668.db2.gz	ZQEHYPYTAVRXES-LREMZREWSA-N	0	3	349.478	3.195	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CCN(Cc3c(C)nsc3C)C[C@H]2C1	ZINC001088067180	1359741196	/nfs/dbraw/zinc/74/11/96/1359741196.db2.gz	RLKMAYWAPRBWQE-CVEARBPZSA-N	0	3	347.528	3.252	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CN(C(=O)[C@H]4CC45CCC5)C[C@@H]3C2)c1	ZINC001088123635	1359764306	/nfs/dbraw/zinc/76/43/06/1359764306.db2.gz	ZHGGZHNDMBEARN-HSALFYBXSA-N	0	3	349.478	3.029	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)[C@@H](CC)Cc3ccccc3)C[C@@H]2C1	ZINC001088125852	1359765386	/nfs/dbraw/zinc/76/53/86/1359765386.db2.gz	DDIKKGCVWRAALU-HBMCJLEFSA-N	0	3	338.495	3.059	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)[C@H](C)CC3CCCCC3)C[C@@H]2C1	ZINC001088126871	1359765980	/nfs/dbraw/zinc/76/59/80/1359765980.db2.gz	AWBQQOGRYPXUFR-RLLQIKCJSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3cccc(-c4ccoc4)c3)C[C@@H]2C1	ZINC001088163127	1359776668	/nfs/dbraw/zinc/77/66/68/1359776668.db2.gz	AZMDOSBUYNEQIM-CTNGQTDRSA-N	0	3	348.446	3.364	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)C3CCC(CCCC)CC3)C[C@@H]2C1	ZINC001088192078	1359789401	/nfs/dbraw/zinc/78/94/01/1359789401.db2.gz	ITCPTLRUWPZAOM-TUNPWDSISA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3cc(-c4ccccc4)co3)C[C@@H]2C1	ZINC001088223408	1359802947	/nfs/dbraw/zinc/80/29/47/1359802947.db2.gz	BRQXLWSYYGBPJT-QUCCMNQESA-N	0	3	348.446	3.364	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)C[C@@H]3CCCCC3(C)C)C[C@@H]2C1	ZINC001088223138	1359803071	/nfs/dbraw/zinc/80/30/71/1359803071.db2.gz	ODIIYLHUCWDZER-QYZOEREBSA-N	0	3	330.516	3.397	20	30		EGEDHN
C=CCN1CC[C@H](OCC2CCN(C(=O)C(C)(CC)CC)CC2)C1	ZINC001088241130	1359812713	/nfs/dbraw/zinc/81/27/13/1359812713.db2.gz	QBYPAAPTLUEOQV-SFHVURJKSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=C(Br)CN[C@H]1CCCCCN(C(=O)[C@H](C)SC)C1	ZINC001088267486	1359822733	/nfs/dbraw/zinc/82/27/33/1359822733.db2.gz	VWJMHCPKPFEGLI-STQMWFEESA-N	0	3	349.338	3.007	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2cc(OC)cs2)C1	ZINC001088357452	1359841583	/nfs/dbraw/zinc/84/15/83/1359841583.db2.gz	BUUGGNYAOZHXSZ-ZDUSSCGKSA-N	0	3	342.892	3.484	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CCN(Cc2cccc(C)c2)[C@@H]1C	ZINC001088623799	1359995152	/nfs/dbraw/zinc/99/51/52/1359995152.db2.gz	VOFDQWVLRYRTSQ-MJGOQNOKSA-N	0	3	337.467	3.375	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccccc2C(F)(F)F)[C@H]1C	ZINC001088998410	1360130555	/nfs/dbraw/zinc/13/05/55/1360130555.db2.gz	SQTNBJICTJUJDL-DOMZBBRYSA-N	0	3	326.362	3.474	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCCN1C(=O)C(C)(C)F	ZINC001089099941	1360167223	/nfs/dbraw/zinc/16/72/23/1360167223.db2.gz	JGCKPNYBRVRFGZ-KRWDZBQOSA-N	0	3	331.435	3.119	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCCN1C(=O)c1ccco1	ZINC001089108040	1360172068	/nfs/dbraw/zinc/17/20/68/1360172068.db2.gz	WZNJQXMVIJSEIC-SFHVURJKSA-N	0	3	337.423	3.278	20	30		EGEDHN
CN(Cc1cccc(F)c1)C[C@@H]1CCCCN1C(=O)C#CC1CC1	ZINC001089175589	1360228841	/nfs/dbraw/zinc/22/88/41/1360228841.db2.gz	XUDJNLQJYZYLFP-IBGZPJMESA-N	0	3	328.431	3.052	20	30		EGEDHN
CC1(C)C[C@H](NC(=O)CC2CC2)CCN(CC#Cc2ccccc2)C1	ZINC001089302038	1360321410	/nfs/dbraw/zinc/32/14/10/1360321410.db2.gz	XTYNRSCXQMFOEW-HXUWFJFHSA-N	0	3	338.495	3.445	20	30		EGEDHN
CC(C)C(=O)N[C@H]1CCN(Cc2ccc(C#N)s2)CC(C)(C)C1	ZINC001089320118	1360338679	/nfs/dbraw/zinc/33/86/79/1360338679.db2.gz	HBENJSQLFUMLGL-AWEZNQCLSA-N	0	3	333.501	3.383	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2conc2C2CCCC2)CC(C)(C)C1	ZINC001089405652	1360404499	/nfs/dbraw/zinc/40/44/99/1360404499.db2.gz	DAMJYTASGUEDSP-INIZCTEOSA-N	0	3	343.471	3.186	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C2(C)CCC(F)(F)CC2)CC(C)(C)C1	ZINC001089423341	1360417572	/nfs/dbraw/zinc/41/75/72/1360417572.db2.gz	IHUCUDMPMLGFFE-HNNXBMFYSA-N	0	3	340.458	3.442	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)N[C@H]1CCN(Cc2ccc(C#N)s2)CC(C)(C)C1	ZINC001089464730	1360449716	/nfs/dbraw/zinc/44/97/16/1360449716.db2.gz	KFTIGDGRABDRRZ-JKIFEVAISA-N	0	3	345.512	3.383	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccoc2C2CC2)CC(C)(C)C1	ZINC001089479256	1360461787	/nfs/dbraw/zinc/46/17/87/1360461787.db2.gz	YEZNELVDORWPMP-INIZCTEOSA-N	0	3	328.456	3.401	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CCN(C[C@H](F)CC)CC(C)(C)C2)c1	ZINC001089487157	1360467259	/nfs/dbraw/zinc/46/72/59/1360467259.db2.gz	IOGKIVWOSWYYCH-QZTJIDSGSA-N	0	3	345.462	3.031	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2C)CC(C)(C)C1	ZINC001089513948	1360484957	/nfs/dbraw/zinc/48/49/57/1360484957.db2.gz	GAFQXSOVDNRUMJ-YZGWKJHDSA-N	0	3	338.495	3.339	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(C[C@@H](F)CC)CC(C)(C)C2)nc1	ZINC001089543999	1360499288	/nfs/dbraw/zinc/49/92/88/1360499288.db2.gz	LALOBDYBIIJSSG-DLBZAZTESA-N	0	3	345.462	3.031	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2csc3c2CCCC3)CC(C)(C)C1	ZINC001089557230	1360506409	/nfs/dbraw/zinc/50/64/09/1360506409.db2.gz	YMCUZBVBEMYUKG-HNNXBMFYSA-N	0	3	344.524	3.481	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccn2c(C)cnc2c1	ZINC001089641645	1360554323	/nfs/dbraw/zinc/55/43/23/1360554323.db2.gz	PXGZFXSCMAQYFZ-KRWDZBQOSA-N	0	3	340.471	3.049	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](CNCc2ocnc2C)[C@H](C)C1	ZINC001184448355	1387462583	/nfs/dbraw/zinc/46/25/83/1387462583.db2.gz	OBBBHYAPIUQJKK-CRAIPNDOSA-N	0	3	345.487	3.326	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1conc1C(C)C	ZINC001089649142	1360561825	/nfs/dbraw/zinc/56/18/25/1360561825.db2.gz	BZUBRXQQULKXER-HNNXBMFYSA-N	0	3	331.460	3.042	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cncc(OC)c1C	ZINC001089659262	1360570428	/nfs/dbraw/zinc/57/04/28/1360570428.db2.gz	WJMZFPZMDPMLMP-MRXNPFEDSA-N	0	3	345.487	3.195	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(COC)o1	ZINC001089666877	1360577197	/nfs/dbraw/zinc/57/71/97/1360577197.db2.gz	ZWUCCWFILISSCZ-OAHLLOKOSA-N	0	3	334.460	3.223	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(C)cc(F)c1	ZINC001089696212	1360601039	/nfs/dbraw/zinc/60/10/39/1360601039.db2.gz	UVXUHQVUXHDYQZ-GOSISDBHSA-N	0	3	330.447	3.378	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(OC)c(C)c1	ZINC001089709805	1360614088	/nfs/dbraw/zinc/61/40/88/1360614088.db2.gz	YUZKPAWWIZHAJR-QGZVFWFLSA-N	0	3	330.472	3.410	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cccc(OC)c1	ZINC001089725185	1360628638	/nfs/dbraw/zinc/62/86/38/1360628638.db2.gz	BKXNQKZKNDCMGF-KRWDZBQOSA-N	0	3	330.472	3.492	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(N(C)C)cc1	ZINC001089728798	1360632126	/nfs/dbraw/zinc/63/21/26/1360632126.db2.gz	CWZUFQVHHMPGJH-GOSISDBHSA-N	0	3	329.488	3.159	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(C)n(C(C)C)n1	ZINC001089737569	1360642595	/nfs/dbraw/zinc/64/25/95/1360642595.db2.gz	XKHAQPBJVDWDKG-QGZVFWFLSA-N	0	3	344.503	3.016	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)CCc1ccoc1	ZINC001089790132	1360664380	/nfs/dbraw/zinc/66/43/80/1360664380.db2.gz	QMQYWMYRKAMUAD-FJIDUMEYSA-N	0	3	348.874	3.134	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](CNCc2ocnc2C)[C@@H](C)C1	ZINC001184472669	1387467625	/nfs/dbraw/zinc/46/76/25/1387467625.db2.gz	KMFLVQUUPZYRTL-GOEBONIOSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1(F)CCCC1	ZINC001089832806	1360685308	/nfs/dbraw/zinc/68/53/08/1360685308.db2.gz	ZQCIYOTVKLRPGK-FZKCQIBNSA-N	0	3	340.870	3.190	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc(C)oc2C)CC2(CCOCC2)C1	ZINC001089924774	1360747652	/nfs/dbraw/zinc/74/76/52/1360747652.db2.gz	UMUGRAUDUGSKHB-QGZVFWFLSA-N	0	3	346.471	3.073	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)[C@H]2CC[C@H](CC)CC2)CC2(CCOCC2)C1	ZINC001089969907	1360772460	/nfs/dbraw/zinc/77/24/60/1360772460.db2.gz	ZHUIGDDTKWCYKQ-GUDVDZBRSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2oc3ccccc3c2OC)C1	ZINC001091182393	1361001398	/nfs/dbraw/zinc/00/13/98/1361001398.db2.gz	JTQUXWPMRIRBNV-UHFFFAOYSA-N	0	3	348.830	3.292	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc3c(c2)[C@H](C)CO3)C1	ZINC001091195481	1361004353	/nfs/dbraw/zinc/00/43/53/1361004353.db2.gz	QJMMDJSYHZETJE-NUYPLMSZSA-N	0	3	334.847	3.033	20	30		EGEDHN
C[C@@]12CN(Cc3cccc(C#N)c3)C[C@@H]1CN(C(=O)c1ccccc1)C2	ZINC001091440240	1361098393	/nfs/dbraw/zinc/09/83/93/1361098393.db2.gz	GJADHAUENDLAJL-IRLDBZIGSA-N	0	3	345.446	3.152	20	30		EGEDHN
Cc1cc(C(=O)N2C[C@H]3CN(Cc4cccc(C#N)c4)C[C@@]3(C)C2)co1	ZINC001091623543	1361161807	/nfs/dbraw/zinc/16/18/07/1361161807.db2.gz	NQLGWDJOBBHULT-CTNGQTDRSA-N	0	3	349.434	3.054	20	30		EGEDHN
C[C@H](c1cccc(F)c1)N1C[C@@H]2CN(C(=O)C#CC3CC3)C[C@]2(C)C1	ZINC001091655106	1361170931	/nfs/dbraw/zinc/17/09/31/1361170931.db2.gz	BCNWCEHCMNGXME-FPDPHYFHSA-N	0	3	340.442	3.080	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3cc(C4CC4)oc3C3CC3)C[C@]2(C)C1	ZINC001091870965	1361238763	/nfs/dbraw/zinc/23/87/63/1361238763.db2.gz	RFDRXLSVPGPXDW-IERDGZPVSA-N	0	3	338.451	3.062	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CN(Cc3ccc(C)nc3C)C[C@@]2(C)C1	ZINC001091917378	1361247924	/nfs/dbraw/zinc/24/79/24/1361247924.db2.gz	VRJBMRLQYLYMDU-NQIIRXRSSA-N	0	3	341.499	3.191	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc(Cl)cc3C)C[C@]2(C)C1	ZINC001091971837	1361263435	/nfs/dbraw/zinc/26/34/35/1361263435.db2.gz	PFHABYVXEPHISJ-BEFAXECRSA-N	0	3	330.859	3.066	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C(C)(C)C3CCCCC3)C[C@]2(C)C1	ZINC001092081518	1361293744	/nfs/dbraw/zinc/29/37/44/1361293744.db2.gz	LKQVCKAPKQSUBL-NQIIRXRSSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cccn3C3CCCC3)C[C@]2(C)C1	ZINC001092135439	1361312304	/nfs/dbraw/zinc/31/23/04/1361312304.db2.gz	ICMYUJFNWGJPJO-UTKZUKDTSA-N	0	3	339.483	3.020	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)C(C)(C)c3ccccc3Cl)C[C@]2(C)C1	ZINC001092213907	1361325049	/nfs/dbraw/zinc/32/50/49/1361325049.db2.gz	XCNVTTRUVBGIOL-QRWLVFNGSA-N	0	3	344.886	3.031	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3csc4c3CCCC4)C[C@]2(C)C1	ZINC001092255552	1361344529	/nfs/dbraw/zinc/34/45/29/1361344529.db2.gz	OZASUOZDYPHBMU-QRWLVFNGSA-N	0	3	342.508	3.044	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc4cccc(C)c4o3)C[C@]2(C)C1	ZINC001092306289	1361360365	/nfs/dbraw/zinc/36/03/65/1361360365.db2.gz	RDYVEXXSCBRGMQ-UTKZUKDTSA-N	0	3	336.435	3.158	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)CCc3cc(C)sc3C)C[C@]2(C)C1	ZINC001092309672	1361361535	/nfs/dbraw/zinc/36/15/35/1361361535.db2.gz	VEMPMMJFSHGJSF-QUCCMNQESA-N	0	3	344.524	3.101	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3oc4ccccc4c3CC)C[C@]2(C)C1	ZINC001092313059	1361361956	/nfs/dbraw/zinc/36/19/56/1361361956.db2.gz	SNIYFQAORVPTQJ-VFNWGFHPSA-N	0	3	336.435	3.022	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)NC[C@@H]1CN(CC#Cc2ccc(Cl)cc2)C[C@H]1C	ZINC001092890549	1361479065	/nfs/dbraw/zinc/47/90/65/1361479065.db2.gz	ZRFYUJYJOLKKND-FXRXJOCMSA-N	0	3	344.886	3.032	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CNC(=O)[C@H]1CCC1(C)C	ZINC001092899534	1361481526	/nfs/dbraw/zinc/48/15/26/1361481526.db2.gz	DYCKHAHAJBWQFD-CKEIUWERSA-N	0	3	345.512	3.240	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)[C@@H]2CC=CCC2)CC1	ZINC001093354697	1361568458	/nfs/dbraw/zinc/56/84/58/1361568458.db2.gz	IDCDJEREPVNUKT-RTBURBONSA-N	0	3	326.484	3.069	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@@H]2CC=CCC2)CC1	ZINC001093354689	1361568572	/nfs/dbraw/zinc/56/85/72/1361568572.db2.gz	IDCDJEREPVNUKT-MOPGFXCFSA-N	0	3	326.484	3.069	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)c2ccc(Cl)o2)CC1	ZINC001093358278	1361570680	/nfs/dbraw/zinc/57/06/80/1361570680.db2.gz	BLHTVWVXLBKNRC-KRWDZBQOSA-N	0	3	346.858	3.273	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C2(C)CCCC2)CC1	ZINC001093375303	1361585617	/nfs/dbraw/zinc/58/56/17/1361585617.db2.gz	RYFWQPIUSXZCHH-GOSISDBHSA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)c2occc2CC)CC1	ZINC001093379009	1361590138	/nfs/dbraw/zinc/59/01/38/1361590138.db2.gz	XYPFLDUWPBTMKO-LJQANCHMSA-N	0	3	340.467	3.182	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@H](C)C(C)(F)F)CC1	ZINC001093380076	1361590254	/nfs/dbraw/zinc/59/02/54/1361590254.db2.gz	QAOITFDBNSOAKE-HOCLYGCPSA-N	0	3	338.442	3.004	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@@H]2CC=CCC2)C[C@H]1CNCc1ccccc1C#N	ZINC001093631512	1361664068	/nfs/dbraw/zinc/66/40/68/1361664068.db2.gz	PIRDJUKHNJNIQE-MBOZVWFJSA-N	0	3	337.467	3.099	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H](CNCc2nc(C)cs2)[C@H](C)C1	ZINC001094015928	1361724423	/nfs/dbraw/zinc/72/44/23/1361724423.db2.gz	MJMPCBJPCVNISN-SIIHOXLZSA-N	0	3	335.517	3.238	20	30		EGEDHN
Cc1cccc(CN2CC[C@H](NC(=O)Nc3ccc(C#N)cc3)C2)c1	ZINC001184774547	1387535485	/nfs/dbraw/zinc/53/54/85/1387535485.db2.gz	KSJRBGVGSMTHDZ-IBGZPJMESA-N	0	3	334.423	3.263	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3ccc4c(c3)CCCC4)CCC[C@@H]12	ZINC001094573941	1361866501	/nfs/dbraw/zinc/86/65/01/1361866501.db2.gz	PDDBLZRPCZMLLI-IFMALSPDSA-N	0	3	336.479	3.173	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H]1CNCc1cc(Cl)ccc1F	ZINC001324146587	1387548405	/nfs/dbraw/zinc/54/84/05/1387548405.db2.gz	OSTIBPCJICAIKM-MRXNPFEDSA-N	0	3	336.838	3.363	20	30		EGEDHN
Cc1ccc(CN2[C@@H]3CC[C@H]2[C@@H](NC(=O)c2c[nH]c(C#N)c2)C3)c(C)c1	ZINC001095337311	1362105461	/nfs/dbraw/zinc/10/54/61/1362105461.db2.gz	PGXNWNYKBLPUCK-AABGKKOBSA-N	0	3	348.450	3.039	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C1(c3cccc(Cl)c3)CC1)C2	ZINC001095498864	1362157315	/nfs/dbraw/zinc/15/73/15/1362157315.db2.gz	HPRLNVTVEKOJJZ-SQNIBIBYSA-N	0	3	342.870	3.116	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(-c3ccco3)o1)C2	ZINC001095737878	1362218093	/nfs/dbraw/zinc/21/80/93/1362218093.db2.gz	LMHAPTWRNWJMBH-ILXRZTDVSA-N	0	3	326.396	3.451	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3[C@@H](C)c2ccccc2)c1	ZINC001095988683	1362324865	/nfs/dbraw/zinc/32/48/65/1362324865.db2.gz	NEZMIQIBGMQKMO-ZFCZOSEKSA-N	0	3	345.446	3.159	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(O[C@H](C)CC)cc1)C2	ZINC001096296185	1362457223	/nfs/dbraw/zinc/45/72/23/1362457223.db2.gz	ZCLMPEFKVLHLFW-BEKAIBRUSA-N	0	3	340.467	3.222	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](CNCc2nc(C)cs2)[C@H](C)C1	ZINC001184977866	1387578458	/nfs/dbraw/zinc/57/84/58/1387578458.db2.gz	FSBXRBOTEUMZEQ-WBVHZDCISA-N	0	3	347.528	3.219	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C13CC(c4ccccc4)(C1)C3)C2	ZINC001096625469	1362604636	/nfs/dbraw/zinc/60/46/36/1362604636.db2.gz	BPJMMTISUVBOFC-MOXVSJGHSA-N	0	3	336.479	3.406	20	30		EGEDHN
COC(=O)CC(C)(C)N(C)CC#Cc1ccc(C(F)(F)F)cc1	ZINC001324315126	1387589984	/nfs/dbraw/zinc/58/99/84/1387589984.db2.gz	UQKJDIWJNUIPAV-UHFFFAOYSA-N	0	3	327.346	3.330	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@H](CNCc3ocnc3C)[C@@H](C)C2)CC1	ZINC001185094488	1387617349	/nfs/dbraw/zinc/61/73/49/1387617349.db2.gz	JHLRCMXJOLVKBR-DOTOQJQBSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1c[nH]nc1-c1ccsc1)C2	ZINC001098119829	1363226428	/nfs/dbraw/zinc/22/64/28/1363226428.db2.gz	IQMMLAVSFIFRKM-BMFZPTHFSA-N	0	3	342.468	3.049	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(Cl)c3occc31)C2	ZINC001098201640	1363254200	/nfs/dbraw/zinc/25/42/00/1363254200.db2.gz	BAUIABPYDWWONA-JLZZUVOBSA-N	0	3	342.826	3.445	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1[nH]ccc1-c1ccccc1)C2	ZINC001098203112	1363254717	/nfs/dbraw/zinc/25/47/17/1363254717.db2.gz	JXZFICORZJGKIK-QRQLOZEOSA-N	0	3	333.435	3.040	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@H]1CCc3ccccc3C1)C2	ZINC001098280147	1363283576	/nfs/dbraw/zinc/28/35/76/1363283576.db2.gz	JFRFHNXECAWFMH-ZXNZYJFHSA-N	0	3	338.495	3.479	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)C[C@@H](NC(=O)CC1CC1)c1ccccc1O2	ZINC001098541034	1363361650	/nfs/dbraw/zinc/36/16/50/1363361650.db2.gz	GHBFGUBBEJIUJI-WIYYLYMNSA-N	0	3	340.467	3.447	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccc(CC)s1)C[C@H](C)O2	ZINC001098614606	1363400100	/nfs/dbraw/zinc/40/01/00/1363400100.db2.gz	USHUUACHYRGQDC-HNNXBMFYSA-N	0	3	348.512	3.192	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1occc1C(C)C)C[C@H](C)O2	ZINC001098631384	1363407063	/nfs/dbraw/zinc/40/70/63/1363407063.db2.gz	WLHGKFJDTRLQRK-INIZCTEOSA-N	0	3	346.471	3.285	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1CC[C@H](CC)CC1)C[C@@H](C)O2	ZINC001098657141	1363421849	/nfs/dbraw/zinc/42/18/49/1363421849.db2.gz	XLDCTIWLOOVFEC-GUDVDZBRSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)CC1CCCC1	ZINC001098874075	1363500881	/nfs/dbraw/zinc/50/08/81/1363500881.db2.gz	VLSYAOVKUFSOPV-GOSISDBHSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)C[C@@H](C)C(C)C	ZINC001098961235	1363542133	/nfs/dbraw/zinc/54/21/33/1363542133.db2.gz	WDYANLNWJBVSDG-MSOLQXFVSA-N	0	3	338.536	3.478	20	30		EGEDHN
C=CCCC(=O)NC[C@@H]1CCC(C)(C)CN1C[C@@H](O)c1ccccc1	ZINC001098966704	1363544638	/nfs/dbraw/zinc/54/46/38/1363544638.db2.gz	TWGWACLNFVFWBR-RBUKOAKNSA-N	0	3	344.499	3.293	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2cncc(OC(C)C)c2)C1	ZINC001098975563	1363550379	/nfs/dbraw/zinc/55/03/79/1363550379.db2.gz	VHOKOTLWDVHQPB-PXNSSMCTSA-N	0	3	343.471	3.029	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H]1[C@@H]2CCCC[C@@H]21	ZINC001099001860	1363565575	/nfs/dbraw/zinc/56/55/75/1363565575.db2.gz	XJLABPGBOJGJAU-YRXWBPOGSA-N	0	3	348.531	3.232	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)c1coc(C)c1	ZINC001099039451	1363589011	/nfs/dbraw/zinc/58/90/11/1363589011.db2.gz	XAGYXWGIBJBKEW-KRWDZBQOSA-N	0	3	334.460	3.011	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2cccc(OC(C)C)n2)C1	ZINC001099100046	1363621939	/nfs/dbraw/zinc/62/19/39/1363621939.db2.gz	WHYAUVVSICOSBF-JXFKEZNVSA-N	0	3	343.471	3.029	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)Cc1nc(C)sc1C	ZINC001099120606	1363634457	/nfs/dbraw/zinc/63/44/57/1363634457.db2.gz	CZJXSDORKQWAIC-INIZCTEOSA-N	0	3	349.544	3.485	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(C)nc3ccccc32)C1	ZINC001099149123	1363656000	/nfs/dbraw/zinc/65/60/00/1363656000.db2.gz	SDDSMPZSHBBROP-JTSKRJEESA-N	0	3	347.462	3.151	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)Cc2coc3cc(C)ccc23)C1	ZINC001099148833	1363656017	/nfs/dbraw/zinc/65/60/17/1363656017.db2.gz	NUCVABIGHOFDTF-UWJYYQICSA-N	0	3	338.451	3.440	20	30		EGEDHN
C#CCCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(CC)c(C)s2)C1	ZINC001099152841	1363658401	/nfs/dbraw/zinc/65/84/01/1363658401.db2.gz	YFZHJZIHNVUOQV-LPHOPBHVSA-N	0	3	330.497	3.227	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H]1CCC1(C)C	ZINC001099182892	1363678542	/nfs/dbraw/zinc/67/85/42/1363678542.db2.gz	PAOBEOABWPOGDS-IAGOWNOFSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H](C)CC(=C)C	ZINC001099187980	1363679836	/nfs/dbraw/zinc/67/98/36/1363679836.db2.gz	AJNCTEJWHYCWOA-QZTJIDSGSA-N	0	3	336.520	3.398	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@H]2CCC(C)(C)CN2CCOCC2CC2)C1	ZINC001099230008	1363703057	/nfs/dbraw/zinc/70/30/57/1363703057.db2.gz	OZXDETXDXAHHLL-SFHVURJKSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)CCn1ccnc1C(C)C	ZINC001099259131	1363720354	/nfs/dbraw/zinc/72/03/54/1363720354.db2.gz	XOBHZMLZVHHOPA-KRWDZBQOSA-N	0	3	346.519	3.189	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@H](C)Cc2ccco2)C[C@H]1C(F)(F)F	ZINC001099318769	1363746897	/nfs/dbraw/zinc/74/68/97/1363746897.db2.gz	IQZHUPUDDJUFDV-BPLDGKMQSA-N	0	3	344.377	3.013	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)Cc1ccc2c(c1)COC2	ZINC001099320959	1363748049	/nfs/dbraw/zinc/74/80/49/1363748049.db2.gz	NEWMWVIRPNUQMY-LJQANCHMSA-N	0	3	342.483	3.052	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2cc(CC)c(CC)o2)C[C@H]1C(F)(F)F	ZINC001099333421	1363755485	/nfs/dbraw/zinc/75/54/85/1363755485.db2.gz	ZIRCEEPDKGVOKL-CHWSQXEVSA-N	0	3	344.377	3.183	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)C[C@H](C)c2ccco2)C[C@H]1C(F)(F)F	ZINC001099333476	1363755667	/nfs/dbraw/zinc/75/56/67/1363755667.db2.gz	JGNKFEVOBGXSGV-BFHYXJOUSA-N	0	3	344.377	3.328	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)CCc1ccccc1OC	ZINC001099334475	1363756072	/nfs/dbraw/zinc/75/60/72/1363756072.db2.gz	JPVQESAJCIPQDS-SFHVURJKSA-N	0	3	344.499	3.421	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2nc(C)cs2)C1	ZINC001099476011	1363811894	/nfs/dbraw/zinc/81/18/94/1363811894.db2.gz	XTMGWXURWQGPLD-KXBFYZLASA-N	0	3	347.528	3.382	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)[C@H](C)C(C)(C)C)CC2(CCOCC2)C1	ZINC001099583319	1363864631	/nfs/dbraw/zinc/86/46/31/1363864631.db2.gz	NZFCBVVLYYZVAE-IRXDYDNUSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N[C@H]1CN(CC(=C)C)CC2(CCOCC2)C1	ZINC001099586714	1363868079	/nfs/dbraw/zinc/86/80/79/1363868079.db2.gz	GCKABQCEPRWXHE-WLIXUPRESA-N	0	3	332.488	3.072	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C(C)(C)C(C)(C)C)CC2(CCOCC2)C1	ZINC001099586880	1363868627	/nfs/dbraw/zinc/86/86/27/1363868627.db2.gz	KGQMRTRINVMCJT-QGZVFWFLSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CC(C)=C(C)C)CC2(CCOCC2)C1	ZINC001099589140	1363871086	/nfs/dbraw/zinc/87/10/86/1363871086.db2.gz	QRCQXBNIMZXXAD-SFHVURJKSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1CN(CC(=C)C)CC2(CCOCC2)C1	ZINC001099590843	1363871919	/nfs/dbraw/zinc/87/19/19/1363871919.db2.gz	MCHPEXHTYUCYKI-HKUYNNGSSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)[C@H](C)CC(C)(C)C)CC2(CCOCC2)C1	ZINC001099592668	1363874610	/nfs/dbraw/zinc/87/46/10/1363874610.db2.gz	HPPVQMGGQTUMKU-SJORKVTESA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C(C)(CC)CC)CC2(CCOCC2)C1	ZINC001099596606	1363879422	/nfs/dbraw/zinc/87/94/22/1363879422.db2.gz	HMQHMBYSKGNEPA-QGZVFWFLSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1CCN(Cc2ccccc2C(C)C)C[C@@H]1O	ZINC001099973785	1363994902	/nfs/dbraw/zinc/99/49/02/1363994902.db2.gz	JGHZJTFJNIGJRM-PMACEKPBSA-N	0	3	344.499	3.218	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](CNCc2cc(C)no2)[C@@H](C)C1	ZINC001185223908	1387656252	/nfs/dbraw/zinc/65/62/52/1387656252.db2.gz	BLZQHFPAZOGJPE-GOEBONIOSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](CNCc2cc(C)no2)[C@H](C)C1	ZINC001185223906	1387656319	/nfs/dbraw/zinc/65/63/19/1387656319.db2.gz	BLZQHFPAZOGJPE-GDBMZVCRSA-N	0	3	333.476	3.160	20	30		EGEDHN
O=C(C=C1CCC1)NCC1CC(NCC#Cc2ccccc2Cl)C1	ZINC001100239487	1364053923	/nfs/dbraw/zinc/05/39/23/1364053923.db2.gz	VVHOCZLRIKRFAA-UHFFFAOYSA-N	0	3	342.870	3.286	20	30		EGEDHN
CCCC[C@@H](C)C(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100296655	1364071336	/nfs/dbraw/zinc/07/13/36/1364071336.db2.gz	LHOSYBFBRKQNSZ-QHGAOEGBSA-N	0	3	326.484	3.349	20	30		EGEDHN
O=C(NCC1CC(NCC#Cc2ccccc2)C1)[C@@H]1CCCC12CC2	ZINC001100442432	1364116504	/nfs/dbraw/zinc/11/65/04/1364116504.db2.gz	HGYOMIYSXBHMSQ-MHJFOBGBSA-N	0	3	336.479	3.103	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)C(C)(C)C2CCC2)C1	ZINC001100543494	1364154374	/nfs/dbraw/zinc/15/43/74/1364154374.db2.gz	JQWDAQRWZFLDMJ-UHFFFAOYSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCC1CC(NCc2cccc(Cl)n2)C1	ZINC001100587065	1364175927	/nfs/dbraw/zinc/17/59/27/1364175927.db2.gz	HPBBXNRNPXNDKV-HLIUYOAVSA-N	0	3	335.879	3.322	20	30		EGEDHN
CC#CCCCC(=O)NCC1CC(NCc2cccc(F)c2F)C1	ZINC001100591335	1364178034	/nfs/dbraw/zinc/17/80/34/1364178034.db2.gz	UVOIXPBRLZNHIS-UHFFFAOYSA-N	0	3	334.410	3.143	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1	ZINC001100594833	1364179752	/nfs/dbraw/zinc/17/97/52/1364179752.db2.gz	GYAXRVLKQLOPRO-NXVRBGIVSA-N	0	3	343.446	3.284	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCC1CC(NCc2c(C)nsc2C)C1	ZINC001100594962	1364180568	/nfs/dbraw/zinc/18/05/68/1364180568.db2.gz	ISAWCGULFWNZRZ-UWTIGNOOSA-N	0	3	335.517	3.347	20	30		EGEDHN
CC(C)(C(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1)C1CC1	ZINC001100598067	1364182296	/nfs/dbraw/zinc/18/22/96/1364182296.db2.gz	IUMGCTUSCIXDQC-UHFFFAOYSA-N	0	3	342.458	3.098	20	30		EGEDHN
C=CCCCC(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1	ZINC001100623317	1364194363	/nfs/dbraw/zinc/19/43/63/1364194363.db2.gz	IOYDKZMPUKSNKS-UHFFFAOYSA-N	0	3	329.419	3.038	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC1CC(NCc2cc(F)ccc2OC)C1	ZINC001100645128	1364202630	/nfs/dbraw/zinc/20/26/30/1364202630.db2.gz	VJVUWAOFYGCUBN-CODVMQSSSA-N	0	3	348.462	3.421	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)NCC1CC(NCC#Cc2cccc(Cl)c2)C1	ZINC001100688722	1364219611	/nfs/dbraw/zinc/21/96/11/1364219611.db2.gz	OOKHRQSHEKZQRY-JGJLBUBWSA-N	0	3	344.886	3.222	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)CC[C@@H](C)CC)C1	ZINC001100775688	1364256544	/nfs/dbraw/zinc/25/65/44/1364256544.db2.gz	DVHWKMKYZCATCH-XGNXJENSSA-N	0	3	331.298	3.206	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)Cc2coc3ccccc23)C1	ZINC001100787225	1364262000	/nfs/dbraw/zinc/26/20/00/1364262000.db2.gz	VTVZNNOXGFFTTG-UHFFFAOYSA-N	0	3	332.831	3.212	20	30		EGEDHN
CC1(CCC(=O)NCC2CC(NCC#Cc3ccc(F)cc3)C2)CC1	ZINC001100819526	1364277661	/nfs/dbraw/zinc/27/76/61/1364277661.db2.gz	YLGJQLMJCVSYMC-UHFFFAOYSA-N	0	3	342.458	3.242	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C2(c3ccccc3F)CC2)C1	ZINC001100821299	1364278207	/nfs/dbraw/zinc/27/82/07/1364278207.db2.gz	YUUOHBSCSFCQMG-UHFFFAOYSA-N	0	3	336.838	3.094	20	30		EGEDHN
C=CCN1CC[C@@H](Oc2ccnc(CNC(=O)C[C@H](C)CCC)c2)C1	ZINC001101090673	1364408251	/nfs/dbraw/zinc/40/82/51/1364408251.db2.gz	OQUOZEOFECYBQL-VQIMIIECSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=C(C)CN1CC[C@@H](Oc2ccnc(CNC(=O)[C@H](C)CCC)c2)C1	ZINC001101092796	1364409499	/nfs/dbraw/zinc/40/94/99/1364409499.db2.gz	XTIWTAPOOWPLAF-VQIMIIECSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=CCN1CC[C@@H](Oc2ccnc(CNC(=O)[C@H](C)CCCC)c2)C1	ZINC001101093937	1364411051	/nfs/dbraw/zinc/41/10/51/1364411051.db2.gz	NCOHMAVLKRRAFF-VQIMIIECSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=CCCC(=O)N1C[C@H]2CN(Cc3cccc(C(C)C)n3)C[C@@]2(C)C1	ZINC001101162999	1364440806	/nfs/dbraw/zinc/44/08/06/1364440806.db2.gz	QPMBDQCPNOWERD-UTKZUKDTSA-N	0	3	341.499	3.452	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@H]2CN(Cc3cccnc3C)C[C@@]2(C)C1	ZINC001101336878	1364515285	/nfs/dbraw/zinc/51/52/85/1364515285.db2.gz	TTXKDDIKECQLJL-BSIFCXSSSA-N	0	3	341.499	3.273	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@H]2CN(Cc3ncccc3C)C[C@@]2(C)C1	ZINC001101337959	1364516435	/nfs/dbraw/zinc/51/64/35/1364516435.db2.gz	RQEDAXFPBOUQDB-UEXGIBASSA-N	0	3	341.499	3.273	20	30		EGEDHN
C=CCCC(=O)N1CCC(C(C)(C)CNCc2coc(C)n2)CC1	ZINC001101519880	1364596013	/nfs/dbraw/zinc/59/60/13/1364596013.db2.gz	WHEJEDDRUHMTJQ-UHFFFAOYSA-N	0	3	333.476	3.304	20	30		EGEDHN
C=CCC[C@@H](C)N1CC2(C1)C[C@@H](NC(=O)CCCCC)c1nccn12	ZINC001101609102	1364654294	/nfs/dbraw/zinc/65/42/94/1364654294.db2.gz	UBSSIYSRVLZNIX-IAGOWNOFSA-N	0	3	344.503	3.390	20	30		EGEDHN
C=CCC[C@@H](C)N1CC2(C1)C[C@@H](NC(=O)C(C)(C)C=C)c1nccn12	ZINC001101637376	1364663788	/nfs/dbraw/zinc/66/37/88/1364663788.db2.gz	KQSFNIHYACIEMQ-HZPDHXFCSA-N	0	3	342.487	3.022	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CNC(=O)C[C@@H]1C=CCC1	ZINC001101713401	1364700200	/nfs/dbraw/zinc/70/02/00/1364700200.db2.gz	LJVHUDHAOSZVPD-BZUAXINKSA-N	0	3	343.496	3.160	20	30		EGEDHN
CCC[C@@H](C)C(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001101828944	1364742576	/nfs/dbraw/zinc/74/25/76/1364742576.db2.gz	OGFWLDBCWCZMLW-RBSFLKMASA-N	0	3	333.501	3.240	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H]1CN(Cc2cnn(C(C)(C)C)c2)C[C@H]1C	ZINC001102229964	1364946977	/nfs/dbraw/zinc/94/69/77/1364946977.db2.gz	MCAQKNKKOJNIMQ-NVXWUHKLSA-N	0	3	346.519	3.034	20	30		EGEDHN
C=CCC[C@H](C(=O)NC[C@@H]1CN(CCF)C[C@H]1C)c1ccccc1	ZINC001102621347	1365139558	/nfs/dbraw/zinc/13/95/58/1365139558.db2.gz	VXBFPMMGTLUNJS-QRQLOZEOSA-N	0	3	332.463	3.390	20	30		EGEDHN
CC(C)CC(=O)NCC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001102642496	1365150359	/nfs/dbraw/zinc/15/03/59/1365150359.db2.gz	BVFMFFVXLPMOMN-HUUCEWRRSA-N	0	3	333.501	3.240	20	30		EGEDHN
CC/C=C(/C)C(=O)NCC[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1C	ZINC001102727863	1365191281	/nfs/dbraw/zinc/19/12/81/1365191281.db2.gz	CWXGPJQMLSSZAP-KFBGUCGJSA-N	0	3	339.483	3.489	20	30		EGEDHN
C/C=C(/C)C(=O)NCC[C@@H]1CN(Cc2ccc(C#N)cc2F)C[C@H]1C	ZINC001102842000	1365247090	/nfs/dbraw/zinc/24/70/90/1365247090.db2.gz	PNYBHLQHQCQABV-TUCWUAQRSA-N	0	3	343.446	3.238	20	30		EGEDHN
CC[C@H](F)C(=O)NCC[C@@H]1CN(Cc2ccc(C#N)cc2F)C[C@H]1C	ZINC001103319999	1365491791	/nfs/dbraw/zinc/49/17/91/1365491791.db2.gz	GRNWVCCLWNFQRT-UNEWFSDZSA-N	0	3	349.425	3.020	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCC[C@@H]1CN(Cc2cnc(C)o2)C[C@H]1C	ZINC001103344704	1365510847	/nfs/dbraw/zinc/51/08/47/1365510847.db2.gz	PXQFESSACVLBAK-ZMSDIMECSA-N	0	3	333.476	3.160	20	30		EGEDHN
CCN1CCN(c2cccc(NC(=O)c3csc(C#N)c3)c2)CC1	ZINC001324722284	1387751845	/nfs/dbraw/zinc/75/18/45/1387751845.db2.gz	WLGNPAJPTYGRHZ-UHFFFAOYSA-N	0	3	340.452	3.014	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2ccc(N(C)C)cc2)C1	ZINC001103672951	1365719648	/nfs/dbraw/zinc/71/96/48/1365719648.db2.gz	IPEBWBNMVSGXJA-RHSMWYFYSA-N	0	3	349.906	3.193	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CCCC2)C[C@H]1CCNCc1ccccc1C#N	ZINC001103811202	1365792411	/nfs/dbraw/zinc/79/24/11/1365792411.db2.gz	HOCFTKINGIUCDH-OXQOHEQNSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CN(C(=O)C=C2CCC2)C[C@H]1C	ZINC001104060321	1365894712	/nfs/dbraw/zinc/89/47/12/1365894712.db2.gz	YWLCMWSTYSRIFH-IUODEOHRSA-N	0	3	341.293	3.080	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)[C@H](CCN[C@@H](C)c2cnc(C)cn2)C1	ZINC001104491889	1366046491	/nfs/dbraw/zinc/04/64/91/1366046491.db2.gz	GYARCPSQBQRNNU-HYVNUMGLSA-N	0	3	344.503	3.132	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)C2(C(F)F)CCC2)C[C@H]1C	ZINC001104578252	1366084578	/nfs/dbraw/zinc/08/45/78/1366084578.db2.gz	OQQRGYPBEDBXKQ-DGCLKSJQSA-N	0	3	334.838	3.249	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2cccnc2)C[C@H]1C	ZINC001104707140	1366138246	/nfs/dbraw/zinc/13/82/46/1366138246.db2.gz	BYHXKZIRKJQCNA-NKGKWGDASA-N	0	3	347.890	3.012	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2ccccc2OC)C[C@H]1C	ZINC001104941917	1366233411	/nfs/dbraw/zinc/23/34/11/1366233411.db2.gz	XFKMUCOPVOBDSE-UKRRQHHQSA-N	0	3	336.863	3.136	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)[C@H](OC)C2CCCC2)C[C@H]1C	ZINC001104958425	1366242341	/nfs/dbraw/zinc/24/23/41/1366242341.db2.gz	UWCZSEZYGKMOAT-KBRIMQKVSA-N	0	3	342.911	3.018	20	30		EGEDHN
CCCCCCCNCc1cn(C2CN(C(=O)[C@@H](C)CCC)C2)nn1	ZINC001105197002	1366367169	/nfs/dbraw/zinc/36/71/69/1366367169.db2.gz	BRFSORXERXEHGT-INIZCTEOSA-N	0	3	349.523	3.158	20	30		EGEDHN
CCCCCCCNCc1cn(C2CN(C(=O)C[C@@H](C)CC)C2)nn1	ZINC001105227545	1366378410	/nfs/dbraw/zinc/37/84/10/1366378410.db2.gz	OJBPRNOSLGEVML-INIZCTEOSA-N	0	3	349.523	3.158	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C[C@H](C=C)CC)CC1	ZINC001105394470	1366443572	/nfs/dbraw/zinc/44/35/72/1366443572.db2.gz	XULSHKPZQNBFJT-YLJYHZDGSA-N	0	3	328.500	3.315	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(c2ccccc2)C[C@H](NC(=O)[C@H]2CC23CC3)C1	ZINC001105441584	1366469773	/nfs/dbraw/zinc/46/97/73/1366469773.db2.gz	ZCSVRTGOMJDCNR-HLIPFELVSA-N	0	3	344.886	3.345	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(C(=O)CCCC(F)(F)F)C2)s1	ZINC001185866465	1387819503	/nfs/dbraw/zinc/81/95/03/1387819503.db2.gz	OHRPCTXOOGVQLY-LLVKDONJSA-N	0	3	345.390	3.043	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](CNCc2ccn(C(C)C)n2)[C@H](C)C1	ZINC001106185651	1366618155	/nfs/dbraw/zinc/61/81/55/1366618155.db2.gz	URZYJWDIXHIDOE-IAGOWNOFSA-N	0	3	346.519	3.250	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@@H](CNCc2ccn(C(C)C)n2)[C@H](C)C1	ZINC001106567578	1366739664	/nfs/dbraw/zinc/73/96/64/1366739664.db2.gz	KZOBGKJVMAHZAW-FGTMMUONSA-N	0	3	346.519	3.250	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](CNC/C(Cl)=C/Cl)[C@H](C)C2)C1	ZINC001106647390	1366765322	/nfs/dbraw/zinc/76/53/22/1366765322.db2.gz	NRQOWVWWZWBALU-PETVBWCUSA-N	0	3	331.287	3.346	20	30		EGEDHN
Cc1cc(N2CCN(C)[C@H](C)[C@H]2C)n2c3ccccc3nc2c1C#N	ZINC001185967804	1387837106	/nfs/dbraw/zinc/83/71/06/1387837106.db2.gz	CCZWVXYIERNRRV-HUUCEWRRSA-N	0	3	333.439	3.196	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@]12CCC[C@H]1N(Cc1conc1C)CC2	ZINC001107420758	1366959097	/nfs/dbraw/zinc/95/90/97/1366959097.db2.gz	GVKZFPYMMOJQRG-YLJYHZDGSA-N	0	3	345.487	3.446	20	30		EGEDHN
CC(C)[C@@H](C)CC(=O)N1CC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001189326202	1366992264	/nfs/dbraw/zinc/99/22/64/1366992264.db2.gz	DDBAZZZKEUAWPU-LPHOPBHVSA-N	0	3	327.472	3.273	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@]12CCC[C@H]1N(Cc1conc1C)CC2	ZINC001107502590	1367000128	/nfs/dbraw/zinc/00/01/28/1367000128.db2.gz	KOIFZHNCRUHLGK-VQIMIIECSA-N	0	3	331.460	3.056	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2[C@H](C)c1cccc(OC)c1	ZINC001109204254	1367001209	/nfs/dbraw/zinc/00/12/09/1367001209.db2.gz	JAPPHILPWITCCS-BEKAIBRUSA-N	0	3	340.467	3.281	20	30		EGEDHN
C=CCOCC(=O)N1CC[C@@H](N(C)C/C=C/c2ccc(Cl)cc2)C1	ZINC001189379630	1367007664	/nfs/dbraw/zinc/00/76/64/1367007664.db2.gz	LECDGLQBOMANJC-SHCNBLLESA-N	0	3	348.874	3.089	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCc1cccs1	ZINC001109260525	1367031276	/nfs/dbraw/zinc/03/12/76/1367031276.db2.gz	JVTRNYRODBPDKX-PVAVHDDUSA-N	0	3	330.497	3.062	20	30		EGEDHN
CCCCCCCCOCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCCF	ZINC001109409657	1367109214	/nfs/dbraw/zinc/10/92/14/1367109214.db2.gz	NVKALHJGTXTQLK-SQNIBIBYSA-N	0	3	342.499	3.445	20	30		EGEDHN
C=CCC[C@H](C)N1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1snnc1C1CC1)C2	ZINC001109422916	1367114361	/nfs/dbraw/zinc/11/43/61/1367114361.db2.gz	PMBJJYBPRJYFJS-ATGSNQNLSA-N	0	3	346.500	3.105	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](N(C)Cc2ccc(C(F)F)cc2)C1	ZINC001189910021	1367129796	/nfs/dbraw/zinc/12/97/96/1367129796.db2.gz	KXDGOGCCCATDOR-KRWDZBQOSA-N	0	3	334.410	3.460	20	30		EGEDHN
CN(Cc1ccc(CF)cc1)[C@H]1CCN(C(=O)C#CC(C)(C)C)C1	ZINC001190076800	1367167214	/nfs/dbraw/zinc/16/72/14/1367167214.db2.gz	WJXGTNLAOUGZGX-SFHVURJKSA-N	0	3	330.447	3.238	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)C2C(C)(C)C2(C)C)C1	ZINC001107846205	1367171510	/nfs/dbraw/zinc/17/15/10/1367171510.db2.gz	QNFWJNFPUWZZRA-MGPUTAFESA-N	0	3	336.520	3.230	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@]1(C)CN(C[C@@H](C)CC(C)C)CCO1	ZINC001107883158	1367190992	/nfs/dbraw/zinc/19/09/92/1367190992.db2.gz	MIVFLPPJRFJYLN-ICSRJNTNSA-N	0	3	336.520	3.069	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)CCCc3cc(C)ccc3C)[C@@H]2C1	ZINC001190289630	1367217978	/nfs/dbraw/zinc/21/79/78/1367217978.db2.gz	GBRVNKAZLOXABQ-VQTJNVASSA-N	0	3	326.484	3.345	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](N(C)CCc2csc(C)n2)C1	ZINC001190355162	1367237104	/nfs/dbraw/zinc/23/71/04/1367237104.db2.gz	UZJIWERFNXDIRL-SFHVURJKSA-N	0	3	347.528	3.295	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](N(C)CCOc2cccc(F)c2)C1	ZINC001190435851	1367264842	/nfs/dbraw/zinc/26/48/42/1367264842.db2.gz	KENOZQIABPKTOY-QGZVFWFLSA-N	0	3	334.435	3.094	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2ccccc2C(C)C)C1	ZINC001190522033	1367285212	/nfs/dbraw/zinc/28/52/12/1367285212.db2.gz	ZQHZNGPYLZHDHE-KRWDZBQOSA-N	0	3	330.472	3.159	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@]1(C)CN(C[C@H](C)CC(C)C)CCO1	ZINC001108114522	1367289076	/nfs/dbraw/zinc/28/90/76/1367289076.db2.gz	FYARAGFPRAYLGY-YLJYHZDGSA-N	0	3	338.536	3.478	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2coc3c2cccc3C)C1	ZINC001190675206	1367325427	/nfs/dbraw/zinc/32/54/27/1367325427.db2.gz	ILBAEOKIKQSGKK-MRXNPFEDSA-N	0	3	342.439	3.090	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@H](C)c1ccccc1F)C2	ZINC001109854873	1367360225	/nfs/dbraw/zinc/36/02/25/1367360225.db2.gz	CMMCMCHZRPHNPT-QXGSTGNESA-N	0	3	328.431	3.064	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2ccc(F)cc2C)C1	ZINC001108353460	1367406958	/nfs/dbraw/zinc/40/69/58/1367406958.db2.gz	IQZVRVGWYNNCTD-OXQOHEQNSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)C2CCC=CCC2)C1	ZINC001108402520	1367435038	/nfs/dbraw/zinc/43/50/38/1367435038.db2.gz	GXXPTYZGUOGXPV-PXNSSMCTSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)C2CCC=CCC2)C1	ZINC001108402521	1367435286	/nfs/dbraw/zinc/43/52/86/1367435286.db2.gz	GXXPTYZGUOGXPV-XLIONFOSSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](C)c1ccc(C)cc1)C2	ZINC001109992371	1367449381	/nfs/dbraw/zinc/44/93/81/1367449381.db2.gz	ZYQHCAYRASODCM-LMCOJAPRSA-N	0	3	342.483	3.023	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)CCC2CCCCCC2)C1	ZINC001191383076	1367489004	/nfs/dbraw/zinc/48/90/04/1367489004.db2.gz	PVLCUALMYNEEDN-LJQANCHMSA-N	0	3	336.520	3.472	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCCc1cc(C)ccc1C)C2	ZINC001110133050	1367515928	/nfs/dbraw/zinc/51/59/28/1367515928.db2.gz	VRKZLJPRKWZNCL-HKBOAZHASA-N	0	3	338.495	3.371	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C1(C(F)(F)F)CCCC1)C2	ZINC001110200326	1367561329	/nfs/dbraw/zinc/56/13/29/1367561329.db2.gz	BYRACLIFCRBMJF-RDBSUJKOSA-N	0	3	330.394	3.407	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](N(C)C[C@@H](OC)c2ccccc2)C1	ZINC001191718880	1367569852	/nfs/dbraw/zinc/56/98/52/1367569852.db2.gz	HTECOHKECDDMMQ-ZWKOTPCHSA-N	0	3	330.472	3.119	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](N(C)Cc2ccc(OC)cc2)C1	ZINC001191867635	1367619485	/nfs/dbraw/zinc/61/94/85/1367619485.db2.gz	GAFQUVGHFHOMES-WMZOPIPTSA-N	0	3	330.472	3.330	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@H](N(C)CCc2scnc2C)C1	ZINC001191889442	1367626528	/nfs/dbraw/zinc/62/65/28/1367626528.db2.gz	GLULCFRUFCJPHC-CVEARBPZSA-N	0	3	335.517	3.129	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H](N(C)CCOc2ccc(F)cc2)C1	ZINC001192163392	1367705606	/nfs/dbraw/zinc/70/56/06/1367705606.db2.gz	WKPRXVJLNKLSQW-FXAWDEMLSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@H](N(C)CCOCC3CCC3)C2)CC1	ZINC001192207214	1367718364	/nfs/dbraw/zinc/71/83/64/1367718364.db2.gz	VNGYGZCXIORERL-SFHVURJKSA-N	0	3	334.504	3.082	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)c1csc(C#N)c1)c1ccsc1	ZINC001325103742	1387899034	/nfs/dbraw/zinc/89/90/34/1387899034.db2.gz	KHRNMYZILXKWMQ-HNNXBMFYSA-N	0	3	333.482	3.494	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2[C@H](C)c1cccc(OC)c1	ZINC001110496952	1367784389	/nfs/dbraw/zinc/78/43/89/1367784389.db2.gz	JAPPHILPWITCCS-QOJCHSLYSA-N	0	3	340.467	3.281	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCN(C(=O)CCC2(C)CC2)C1	ZINC001193257920	1367982155	/nfs/dbraw/zinc/98/21/55/1367982155.db2.gz	PFVFAXXNXJROJB-SFHVURJKSA-N	0	3	325.456	3.171	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](C)Cc1ccccc1F)C2	ZINC001111021861	1368145102	/nfs/dbraw/zinc/14/51/02/1368145102.db2.gz	HBLITCVNPGAPJL-WLWJZTKJSA-N	0	3	330.447	3.302	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@H]2CCC=CCCC2)C1	ZINC001194033114	1368170895	/nfs/dbraw/zinc/17/08/95/1368170895.db2.gz	WXVHDQCEZRUTJB-IPMKNSEASA-N	0	3	334.504	3.031	20	30		EGEDHN
C=C[C@H](C(=O)N1CC[C@H](N(C)CCOC2CCC2)C1)c1ccccc1	ZINC001194183806	1368203247	/nfs/dbraw/zinc/20/32/47/1368203247.db2.gz	URZZIQPQQAKCBP-ICSRJNTNSA-N	0	3	342.483	3.058	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCCc1sccc1C)C2	ZINC001111327906	1368266269	/nfs/dbraw/zinc/26/62/69/1368266269.db2.gz	YYCWLOTXGBLAPX-ZACQAIPSSA-N	0	3	330.497	3.124	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](N(C)C[C@@H]3CCCCO3)C2)CCCC1	ZINC001194568557	1368288389	/nfs/dbraw/zinc/28/83/89/1368288389.db2.gz	UGLKEOKRKQRDJV-ROUUACIJSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](C)CCOc1ccccc1)C2	ZINC001111514913	1368323997	/nfs/dbraw/zinc/32/39/97/1368323997.db2.gz	CMCXTLAHFHAXKI-LFGUQSLTSA-N	0	3	342.483	3.389	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C(CCC)CCC)C[C@H](C)O2	ZINC001111546943	1368339963	/nfs/dbraw/zinc/33/99/63/1368339963.db2.gz	FJISBTHLYLNDNR-KRWDZBQOSA-N	0	3	336.520	3.471	20	30		EGEDHN
C[C@@H]1CC[C@@H](C(=O)OC(C)(C)C)CN1CCOc1ccccc1C#N	ZINC001195288313	1368414463	/nfs/dbraw/zinc/41/44/63/1368414463.db2.gz	FJYPKLUVXNRFQB-NVXWUHKLSA-N	0	3	344.455	3.379	20	30		EGEDHN
C[C@H]1CC[C@@H](C(=O)OC(C)(C)C)CN1CCOc1ccccc1C#N	ZINC001195288310	1368414661	/nfs/dbraw/zinc/41/46/61/1368414661.db2.gz	FJYPKLUVXNRFQB-DOTOQJQBSA-N	0	3	344.455	3.379	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@]12CCC[C@H]1CN(Cc1cnccc1C)C2	ZINC001111761897	1368448624	/nfs/dbraw/zinc/44/86/24/1368448624.db2.gz	RCJQBEGVWDPTCF-RXVVDRJESA-N	0	3	341.499	3.463	20	30		EGEDHN
C=C(C)CCC(=O)N[C@]12CCC[C@H]1CN(CCc1ccns1)C2	ZINC001111765104	1368452095	/nfs/dbraw/zinc/45/20/95/1368452095.db2.gz	UDHYWBYLVZZSMQ-YJBOKZPZSA-N	0	3	333.501	3.013	20	30		EGEDHN
CC#CCN[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2ccc3ccccc3c2)C1	ZINC001186428595	1387941070	/nfs/dbraw/zinc/94/10/70/1387941070.db2.gz	RYTKZKRTMHHLES-QHAWAJNXSA-N	0	3	332.447	3.157	20	30		EGEDHN
CC1(CC(=O)N[C@]23CCC[C@H]2CN(Cc2cccc(C#N)c2)C3)CC1	ZINC001111811631	1368475807	/nfs/dbraw/zinc/47/58/07/1368475807.db2.gz	JESKRBZMKVEAJU-RXVVDRJESA-N	0	3	337.467	3.219	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H](CC)Oc2ccccc2C)C1	ZINC001111885552	1368529290	/nfs/dbraw/zinc/52/92/90/1368529290.db2.gz	SHBMQVLTQSBJLY-WFXMLNOXSA-N	0	3	342.483	3.309	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)CCc2cc(C)cc(C)c2)C1	ZINC001111925794	1368564216	/nfs/dbraw/zinc/56/42/16/1368564216.db2.gz	KGVDLNGDCCTBCZ-UNMCSNQZSA-N	0	3	338.495	3.230	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2ccc3nc[nH]c3n2)CC1	ZINC001196258573	1368577845	/nfs/dbraw/zinc/57/78/45/1368577845.db2.gz	CADCQNNFSJEDFF-UHFFFAOYSA-N	0	3	343.475	3.076	20	30		EGEDHN
C=Cc1ccc(C(=O)N[C@@H]2CN(CCCCCCC)C[C@H]2O)cc1	ZINC001196351339	1368594860	/nfs/dbraw/zinc/59/48/60/1368594860.db2.gz	DVZMEINKHLDQQK-RTBURBONSA-N	0	3	330.472	3.075	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H](F)Cc2ccccc2)C1	ZINC001112000992	1368605065	/nfs/dbraw/zinc/60/50/65/1368605065.db2.gz	CTPCXYONUZKNMI-BJLQDIEVSA-N	0	3	330.447	3.114	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2nc(Cl)sc2C)CC1	ZINC001196471040	1368623141	/nfs/dbraw/zinc/62/31/41/1368623141.db2.gz	KNXMQSVKAKLLTN-UHFFFAOYSA-N	0	3	327.881	3.219	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H](C)Cc2ccc(F)cc2)C1	ZINC001112020635	1368623163	/nfs/dbraw/zinc/62/31/63/1368623163.db2.gz	QURJXBXSGOEFDR-KNBMTAEXSA-N	0	3	330.447	3.161	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)CCCc2ccc(C)s2)C1	ZINC001112027672	1368625897	/nfs/dbraw/zinc/62/58/97/1368625897.db2.gz	LLZIGVLUKNPPKL-PXNSSMCTSA-N	0	3	344.524	3.373	20	30		EGEDHN
C=CCC[C@H](C)N1CCCN(C(=O)c2ocnc2C(F)(F)F)CC1	ZINC001196619634	1368651015	/nfs/dbraw/zinc/65/10/15/1368651015.db2.gz	FSMFHMUYZCBFSM-LBPRGKRZSA-N	0	3	345.365	3.196	20	30		EGEDHN
C#CCC1(C(=O)N2C[C@@H](C(F)(F)F)[C@H](NCC=C(C)C)C2)CCC1	ZINC001112114297	1368663911	/nfs/dbraw/zinc/66/39/11/1368663911.db2.gz	JOPFGRAFBKEOSF-HUUCEWRRSA-N	0	3	342.405	3.125	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2cc(-c3ccco3)on2)CC1	ZINC001196689758	1368663974	/nfs/dbraw/zinc/66/39/74/1368663974.db2.gz	MQJTWIKUNWSMJP-UHFFFAOYSA-N	0	3	329.400	3.049	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)[C@H]2CCC=CCCC2)C[C@H]1C(F)(F)F	ZINC001112121402	1368668917	/nfs/dbraw/zinc/66/89/17/1368668917.db2.gz	KYBABKJFFHRNKU-ARFHVFGLSA-N	0	3	342.405	3.125	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCCN(C[C@@H](O)C2CCCCC2)CC1	ZINC001196881241	1368705849	/nfs/dbraw/zinc/70/58/49/1368705849.db2.gz	RDZGYZQQXBGBOC-PKOBYXMFSA-N	0	3	336.520	3.064	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)CC(C)(C)C(F)(F)F)C[C@H]1C(F)(F)F	ZINC001112200015	1368710626	/nfs/dbraw/zinc/71/06/26/1368710626.db2.gz	HWCSXRPHVIEXTJ-NXEZZACHSA-N	0	3	346.315	3.130	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)[C@@H]2CCCC(C)(C)C2)C[C@H]1C(F)(F)F	ZINC001112213600	1368721719	/nfs/dbraw/zinc/72/17/19/1368721719.db2.gz	POJBIIDTNJZMSJ-RBSFLKMASA-N	0	3	344.421	3.205	20	30		EGEDHN
C=CCCCC(=O)N1CCCN(CCc2ccc3c(c2)CCO3)CC1	ZINC001197000202	1368728951	/nfs/dbraw/zinc/72/89/51/1368728951.db2.gz	LQOADRHVBRZZQE-UHFFFAOYSA-N	0	3	342.483	3.055	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cc(C(C)C)n[nH]2)CC1	ZINC001197218792	1368766465	/nfs/dbraw/zinc/76/64/65/1368766465.db2.gz	XKIBIAMZVSOVMK-UHFFFAOYSA-N	0	3	332.492	3.427	20	30		EGEDHN
CC[C@@H](C)CCC(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001186537050	1387965663	/nfs/dbraw/zinc/96/56/63/1387965663.db2.gz	JYJUDXIUIXVYPC-RHSMWYFYSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2nnn(C(C)C)c2C)CC1	ZINC001197606837	1368853771	/nfs/dbraw/zinc/85/37/71/1368853771.db2.gz	VBRLRZABLFJWMG-UHFFFAOYSA-N	0	3	347.507	3.062	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2c[nH]nc2C2CC2)CC1	ZINC001197668835	1368869201	/nfs/dbraw/zinc/86/92/01/1368869201.db2.gz	GVNGWYVFEYMCDO-UHFFFAOYSA-N	0	3	330.476	3.181	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)CCC2CCCCC2)C1	ZINC001198337207	1369010812	/nfs/dbraw/zinc/01/08/12/1369010812.db2.gz	KNQMMVALCMOQCZ-RTBURBONSA-N	0	3	338.536	3.479	20	30		EGEDHN
C=CCCOCC(=O)N1CCCN([C@H](CC)c2ccccc2)CC1	ZINC001198336378	1369011503	/nfs/dbraw/zinc/01/15/03/1369011503.db2.gz	AWSZUKVTZBJESX-LJQANCHMSA-N	0	3	330.472	3.265	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N1CCCN([C@@H](C)c2cccc(C)c2)CC1	ZINC001198343971	1369013405	/nfs/dbraw/zinc/01/34/05/1369013405.db2.gz	POYAOHFFKLLUKK-ROUUACIJSA-N	0	3	330.472	3.181	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)c1cc(C)no1)c1ccccc1OC	ZINC001198522350	1369052917	/nfs/dbraw/zinc/05/29/17/1369052917.db2.gz	KCPZDELAFDBLOF-MRXNPFEDSA-N	0	3	343.427	3.019	20	30		EGEDHN
C=CCOCC(=O)NC[C@@H](NCC/C=C\CC)c1ccccc1OC	ZINC001198605878	1369071706	/nfs/dbraw/zinc/07/17/06/1369071706.db2.gz	LCHXRDZAXFTPMM-HPFMTEOYSA-N	0	3	346.471	3.001	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)Cc1ccoc1)c1ccccc1OC	ZINC001198685808	1369090733	/nfs/dbraw/zinc/09/07/33/1369090733.db2.gz	FRTWHGHWUNRDDK-SFHVURJKSA-N	0	3	342.439	3.244	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)C#CC(C)C)c1ccccc1OC	ZINC001198714272	1369097566	/nfs/dbraw/zinc/09/75/66/1369097566.db2.gz	WCTPOLQDOMHMTE-SFHVURJKSA-N	0	3	328.456	3.068	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NC[C@H](NC(C)C)c1ccccc1OC	ZINC001198820185	1369121996	/nfs/dbraw/zinc/12/19/96/1369121996.db2.gz	YWRCXKREVWGONT-FXAWDEMLSA-N	0	3	348.487	3.079	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@@H]1CCC1(C)C)c1ccccc1OC	ZINC001198855633	1369131138	/nfs/dbraw/zinc/13/11/38/1369131138.db2.gz	DNWWECYNXCMHCS-DLBZAZTESA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)c1conc1C)c1ccccc1OC	ZINC001198876491	1369136725	/nfs/dbraw/zinc/13/67/25/1369136725.db2.gz	SITLMBOWANWNCK-QGZVFWFLSA-N	0	3	343.427	3.019	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)[C@@H](OC)C(C)C)c1ccccc1OC	ZINC001198876360	1369137183	/nfs/dbraw/zinc/13/71/83/1369137183.db2.gz	RXJBYGDOLWXLJR-HKUYNNGSSA-N	0	3	348.487	3.079	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@@]2(C)CC=C(C)CC2)C1	ZINC001198880458	1369137789	/nfs/dbraw/zinc/13/77/89/1369137789.db2.gz	OGSHKTGDUALFKL-GGPKGHCWSA-N	0	3	336.520	3.255	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)Cn2c(C)cc3ccccc32)CC1	ZINC001113080855	1369187413	/nfs/dbraw/zinc/18/74/13/1369187413.db2.gz	WAGJXECIFHFAMA-QGZVFWFLSA-N	0	3	339.483	3.449	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)CCCC2CCCC2)C1	ZINC001199206281	1369190841	/nfs/dbraw/zinc/19/08/41/1369190841.db2.gz	OMZRSQDFEUYIAO-RTBURBONSA-N	0	3	338.536	3.479	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@H]2CCCC(C)(C)C2)C1	ZINC001199210913	1369191581	/nfs/dbraw/zinc/19/15/81/1369191581.db2.gz	MXJHRMCLDMZYPK-RCCFBDPRSA-N	0	3	336.520	3.111	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@H]2CCCCC2(C)C)C1	ZINC001199245645	1369197250	/nfs/dbraw/zinc/19/72/50/1369197250.db2.gz	HBZKVZFSZUARFE-KZNAEPCWSA-N	0	3	336.520	3.111	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CCCC(C)(C)C)C[C@H]2O)CCCC1	ZINC001199566552	1369238142	/nfs/dbraw/zinc/23/81/42/1369238142.db2.gz	BVAPPADOYHSNKW-IAGOWNOFSA-N	0	3	336.520	3.111	20	30		EGEDHN
C=CCN1CCC(Nc2ncnc3c(Cl)cc([N+](=O)[O-])cc23)CC1	ZINC001325488058	1387990069	/nfs/dbraw/zinc/99/00/69/1387990069.db2.gz	DWEFQGIBLCQKAN-UHFFFAOYSA-N	0	3	347.806	3.254	20	30		EGEDHN
CCCCCCC[NH2+]C[C@H]1CN(C(=O)c2ccccc2[O-])CCCO1	ZINC001199886174	1369284671	/nfs/dbraw/zinc/28/46/71/1369284671.db2.gz	GYQAFEMCJYQCRU-KRWDZBQOSA-N	0	3	348.487	3.183	20	30		EGEDHN
CC(C)C[C@H](C)C(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001186652724	1387994138	/nfs/dbraw/zinc/99/41/38/1387994138.db2.gz	PPGNSYCELCPBNJ-WMLDXEAASA-N	0	3	331.435	3.070	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC(NCc2ccncc2Cl)CC1	ZINC001200783051	1369427579	/nfs/dbraw/zinc/42/75/79/1369427579.db2.gz	KKCSHKKXSCOJSW-UHFFFAOYSA-N	0	3	335.879	3.418	20	30		EGEDHN
C=CCCC1(C(=O)N2CCCO[C@@H](CNCc3ccsc3)C2)CC1	ZINC001201335367	1369522151	/nfs/dbraw/zinc/52/21/51/1369522151.db2.gz	NOGOVSVSQDDCJB-KRWDZBQOSA-N	0	3	348.512	3.202	20	30		EGEDHN
CCCCCCCN1CCN(C(=O)c2cc(-c3ccoc3)[nH]n2)CC1	ZINC001113634833	1369534852	/nfs/dbraw/zinc/53/48/52/1369534852.db2.gz	YAKCBHSDSABBAY-UHFFFAOYSA-N	0	3	344.459	3.398	20	30		EGEDHN
CCCC[C@H](CC)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001113911034	1369655283	/nfs/dbraw/zinc/65/52/83/1369655283.db2.gz	NTLCKAUPYQUGDO-VNTMZGSJSA-N	0	3	339.483	3.321	20	30		EGEDHN
CC#CCCCC(=O)N1CCC(NCc2ccncc2Cl)CC1	ZINC001202075910	1369681926	/nfs/dbraw/zinc/68/19/26/1369681926.db2.gz	OMCATAXAYXRBGP-UHFFFAOYSA-N	0	3	333.863	3.009	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001202108621	1369688782	/nfs/dbraw/zinc/68/87/82/1369688782.db2.gz	LVQDGEPRQRSPSE-MRXNPFEDSA-N	0	3	325.456	3.241	20	30		EGEDHN
C=CCCCC(=O)N1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001202266372	1369725401	/nfs/dbraw/zinc/72/54/01/1369725401.db2.gz	BKECTAYSWIDPBK-UHFFFAOYSA-N	0	3	329.419	3.134	20	30		EGEDHN
CCCC(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C12CCC2	ZINC001202334311	1369741257	/nfs/dbraw/zinc/74/12/57/1369741257.db2.gz	BRAPAQKUMMZBNB-IRXDYDNUSA-N	0	3	329.419	3.014	20	30		EGEDHN
CCCC(=O)N[C@@H]1C[C@H](NCc2cc(C#N)ccc2F)C12CCC2	ZINC001202337662	1369741949	/nfs/dbraw/zinc/74/19/49/1369741949.db2.gz	UMKUJHSBXAHFBG-DLBZAZTESA-N	0	3	329.419	3.014	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H]2C[C@H](NCC#Cc3ccccc3)C23CCC3)o1	ZINC001202370573	1369753051	/nfs/dbraw/zinc/75/30/51/1369753051.db2.gz	IPOHIUGXUBPJKC-PMACEKPBSA-N	0	3	348.446	3.270	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1[C@H]2CN([C@@H](C)c3cccc(F)c3)C[C@H]21	ZINC001114166660	1369771712	/nfs/dbraw/zinc/77/17/12/1369771712.db2.gz	WFCZRCPNWGIRRN-FEUVXWNVSA-N	0	3	328.431	3.127	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@H](NC(=O)/C(C)=C/CC)C12CCC2	ZINC001202583604	1369814509	/nfs/dbraw/zinc/81/45/09/1369814509.db2.gz	ZFTGPTHVESHJGY-BLOBHPOZSA-N	0	3	341.293	3.268	20	30		EGEDHN
CC[C@H](c1ccc(Cl)cc1)N1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)C#CC(C)C	ZINC001114247111	1369826438	/nfs/dbraw/zinc/82/64/38/1369826438.db2.gz	DZHFKDNPSIOJCG-RMJJICAUSA-N	0	3	344.886	3.497	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@@H](NCc2cc(F)ccc2OC)C12CCC2	ZINC001202625994	1369830110	/nfs/dbraw/zinc/83/01/10/1369830110.db2.gz	RCJYMPMKBRZFAV-QZTJIDSGSA-N	0	3	346.446	3.318	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1C[C@@H](NCc2c(C)noc2C)C12CCC2	ZINC001202766684	1369885148	/nfs/dbraw/zinc/88/51/48/1369885148.db2.gz	WRGXBKOMIIMMJD-QZTJIDSGSA-N	0	3	343.471	3.002	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1C[C@@H](NCc2oc(C)nc2C)C12CCC2	ZINC001202786635	1369891486	/nfs/dbraw/zinc/89/14/86/1369891486.db2.gz	VFQHHEVWLLOBKT-MSOLQXFVSA-N	0	3	343.471	3.002	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(OC)cc3)C[C@H]21	ZINC001114336659	1369898000	/nfs/dbraw/zinc/89/80/00/1369898000.db2.gz	SRUPTNJWTDYVCM-FVQHAEBGSA-N	0	3	348.874	3.020	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@H]1C[C@H](NCc2ccccc2F)C12CCC2	ZINC001202920784	1369927208	/nfs/dbraw/zinc/92/72/08/1369927208.db2.gz	PAUQRUCAKAMRIF-ROUUACIJSA-N	0	3	342.458	3.392	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1C[C@H](NCc2cnc(C)o2)C12CCC2	ZINC001202961322	1369937712	/nfs/dbraw/zinc/93/77/12/1369937712.db2.gz	WUXWRMQJVZNDLS-ZWKOTPCHSA-N	0	3	343.471	3.268	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)C(C)(C)CC(F)F)C12CCC2	ZINC001203035440	1369961828	/nfs/dbraw/zinc/96/18/28/1369961828.db2.gz	BBWKQZSRVBAMIY-NWDGAFQWSA-N	0	3	334.838	3.437	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)COC2CCCCC2)C12CCC2	ZINC001203122913	1369990121	/nfs/dbraw/zinc/99/01/21/1369990121.db2.gz	LVQGJUBPINBQQJ-CVEARBPZSA-N	0	3	340.895	3.105	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)CCc2cncc(C)c2)C12CCC2	ZINC001203161507	1370005656	/nfs/dbraw/zinc/00/56/56/1370005656.db2.gz	RITACRFZDWXXGQ-IAGOWNOFSA-N	0	3	347.890	3.092	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1[C@H]2CN([C@H]3CCc4c3c(F)ccc4F)C[C@H]21	ZINC001114683853	1370023793	/nfs/dbraw/zinc/02/37/93/1370023793.db2.gz	WDUZUNSXGUDVCM-URLYELCFSA-N	0	3	346.421	3.211	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1[C@H]2CN([C@@H](C)c3cccc(F)c3)C[C@H]21	ZINC001114711686	1370040130	/nfs/dbraw/zinc/04/01/30/1370040130.db2.gz	ZCXNASLCOPTEKC-FEUVXWNVSA-N	0	3	328.431	3.127	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1C[C@H](NCc2ccns2)C12CCC2	ZINC001203258305	1370044617	/nfs/dbraw/zinc/04/46/17/1370044617.db2.gz	QXGJIQDRXCOJKC-LSDHHAIUSA-N	0	3	333.501	3.262	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1[C@H]2CN(CCCCC(F)(F)F)C[C@H]21	ZINC001114727376	1370049589	/nfs/dbraw/zinc/04/95/89/1370049589.db2.gz	VHANFSAKVUMCLG-NYTXWWLZSA-N	0	3	332.410	3.368	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1C[C@@H](NCc2c(C)noc2C)C12CCC2	ZINC001203272069	1370053494	/nfs/dbraw/zinc/05/34/94/1370053494.db2.gz	ASMGRLPGTONRPY-CVEARBPZSA-N	0	3	331.460	3.021	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1C[C@@H](NCc2ccncc2Cl)C12CCC2	ZINC001203273250	1370054058	/nfs/dbraw/zinc/05/40/58/1370054058.db2.gz	HUSGXMSISUJNHH-CVEARBPZSA-N	0	3	347.890	3.464	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1[C@H]2CN([C@@H]3CCc4c3c(F)ccc4F)C[C@H]21	ZINC001114754442	1370063661	/nfs/dbraw/zinc/06/36/61/1370063661.db2.gz	BRMHGUIPAHNQRW-QRKDATQKSA-N	0	3	346.421	3.355	20	30		EGEDHN
O=C(N[C@@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2)[C@H]1C[C@H]2C[C@H]2C1	ZINC001203290949	1370064281	/nfs/dbraw/zinc/06/42/81/1370064281.db2.gz	ZIZOJESDIPITQZ-XDWAVFMPSA-N	0	3	348.490	3.101	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1C[C@H](NCC(=C)Br)C12CCC2	ZINC001203339182	1370089392	/nfs/dbraw/zinc/08/93/92/1370089392.db2.gz	FYUKZHZGBANYOS-UONOGXRCSA-N	0	3	341.293	3.268	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H]2C[C@@H](NCc3cnc(C)o3)C23CCC3)CC1	ZINC001203374063	1370103368	/nfs/dbraw/zinc/10/33/68/1370103368.db2.gz	JTZFAARGGPUZJD-SJORKVTESA-N	0	3	343.471	3.246	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2C[C@@H](NCc3cncs3)C23CCC3)CC1	ZINC001203375613	1370104906	/nfs/dbraw/zinc/10/49/06/1370104906.db2.gz	RKACOEMMLJBPIU-HZPDHXFCSA-N	0	3	345.512	3.407	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1[C@H]2CN(CCOC3CCCCCC3)C[C@H]21	ZINC001114896542	1370135787	/nfs/dbraw/zinc/13/57/87/1370135787.db2.gz	OLDZOKIBBJLLSF-BWTSREIZSA-N	0	3	348.531	3.375	20	30		EGEDHN
Cc1ccc(N2C[C@]3(CCN(Cc4ccc(C#N)cc4)C3)CC2=O)cc1	ZINC001203903936	1370308488	/nfs/dbraw/zinc/30/84/88/1370308488.db2.gz	NMOQPWPAHUFDKA-JOCHJYFZSA-N	0	3	345.446	3.496	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CCN(Cc3cccc(C)n3)C2)C1	ZINC001204065913	1370365860	/nfs/dbraw/zinc/36/58/60/1370365860.db2.gz	NYFWNSBZLQQNAM-IBGZPJMESA-N	0	3	329.444	3.001	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(N[C@@H](C)c3cnccn3)CC2)CCCC1	ZINC001204157152	1370393635	/nfs/dbraw/zinc/39/36/35/1370393635.db2.gz	NYCMKNQQSXZEIU-INIZCTEOSA-N	0	3	342.487	3.255	20	30		EGEDHN
C=CCOc1ccc(CN2CC[C@@]3(C[C@@H](OCC4CC4)CO3)C2)cc1	ZINC001204300390	1370435912	/nfs/dbraw/zinc/43/59/12/1370435912.db2.gz	QKDVGSANCPQSAH-NHCUHLMSSA-N	0	3	343.467	3.411	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)c2ccoc2)CCCCC1	ZINC001115406868	1370438437	/nfs/dbraw/zinc/43/84/37/1370438437.db2.gz	LLVNXRZSGJAQGZ-UHFFFAOYSA-N	0	3	341.249	3.211	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)NCC1(NCC#Cc2ccccc2)CCCCC1	ZINC001115486361	1370490588	/nfs/dbraw/zinc/49/05/88/1370490588.db2.gz	OAAAYYYMJKYPHY-IBGZPJMESA-N	0	3	338.495	3.493	20	30		EGEDHN
C#CCCCCC(=O)NCC1(NCc2ccc(F)cn2)CCCCC1	ZINC001115490742	1370493346	/nfs/dbraw/zinc/49/33/46/1370493346.db2.gz	NBMNUTYGLHHTFO-UHFFFAOYSA-N	0	3	345.462	3.323	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)C2(c3ccccn3)CC2)CCCCC1	ZINC001115537060	1370534149	/nfs/dbraw/zinc/53/41/49/1370534149.db2.gz	UIVOCVOCQNGDJU-UHFFFAOYSA-N	0	3	347.890	3.274	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CCC(CNC/C(Cl)=C/Cl)CC1	ZINC001204692541	1370547222	/nfs/dbraw/zinc/54/72/22/1370547222.db2.gz	MAXCMPFBZPANAT-NWFCWYBLSA-N	0	3	349.302	3.115	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H]2CCCO[C@H]2CC)CCCCC1	ZINC001115567509	1370567908	/nfs/dbraw/zinc/56/79/08/1370567908.db2.gz	KBLZVVVGIFMIRM-HOTGVXAUSA-N	0	3	342.911	3.353	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cnc3cc[nH]c3c2)CCCCC1	ZINC001115588800	1370589237	/nfs/dbraw/zinc/58/92/37/1370589237.db2.gz	CUFJDHZRVOTWKO-UHFFFAOYSA-N	0	3	346.862	3.338	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1ccc(OC)cc1F)CC2	ZINC001204913861	1370604438	/nfs/dbraw/zinc/60/44/38/1370604438.db2.gz	DMSNRYSLCNMNNJ-FQEVSTJZSA-N	0	3	346.446	3.367	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cccc3n[nH]cc32)CCCCC1	ZINC001115658658	1370643545	/nfs/dbraw/zinc/64/35/45/1370643545.db2.gz	AXDWBOSQEMKRLT-UHFFFAOYSA-N	0	3	346.862	3.338	20	30		EGEDHN
C=CC(C)(C)C(=O)NCC1(NCc2oc(C)nc2C)CCCCC1	ZINC001115667044	1370648226	/nfs/dbraw/zinc/64/82/26/1370648226.db2.gz	OBVNKJOWRVSWAK-UHFFFAOYSA-N	0	3	333.476	3.412	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCC1(NCc2conc2C)CCCCC1	ZINC001115679542	1370662010	/nfs/dbraw/zinc/66/20/10/1370662010.db2.gz	HRPSTCGCJNLGNA-LSDHHAIUSA-N	0	3	333.476	3.350	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCC1(NCc2cnoc2C)CCCCC1	ZINC001115680225	1370663486	/nfs/dbraw/zinc/66/34/86/1370663486.db2.gz	WBMNRRAUUKMWOZ-CABCVRRESA-N	0	3	333.476	3.350	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCC1(NCc2conc2C)CCCCC1	ZINC001115684619	1370666928	/nfs/dbraw/zinc/66/69/28/1370666928.db2.gz	BFEOORKOYUCZDA-INIZCTEOSA-N	0	3	333.476	3.494	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCC1(NCc2cc(C)ncn2)CCCCC1	ZINC001115684898	1370667885	/nfs/dbraw/zinc/66/78/85/1370667885.db2.gz	MHHIUQYAYGEDSZ-MRXNPFEDSA-N	0	3	344.503	3.296	20	30		EGEDHN
C=CCCCN1C[C@@H](O)[C@H](N(Cc2ccccc2)C(=O)C(C)(C)C)C1	ZINC001205212287	1370683001	/nfs/dbraw/zinc/68/30/01/1370683001.db2.gz	SPORAYJKOUJUAK-RTBURBONSA-N	0	3	344.499	3.073	20	30		EGEDHN
N#Cc1cc(Cl)c(-c2noc([C@@H]3CCNC[C@H]3F)n2)cc1Cl	ZINC001205220620	1370686093	/nfs/dbraw/zinc/68/60/93/1370686093.db2.gz	ZDQHOXMLKCHWIA-PRHODGIISA-N	0	3	341.173	3.330	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC1(NCc2cc(C)ncn2)CCCCC1	ZINC001115712324	1370691609	/nfs/dbraw/zinc/69/16/09/1370691609.db2.gz	GPXJDSHQKLCJAI-LJQANCHMSA-N	0	3	344.503	3.296	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)CC(C)(C)C=C)CC[C@H]1c1ccc(F)cc1	ZINC001205283160	1370705923	/nfs/dbraw/zinc/70/59/23/1370705923.db2.gz	ZFDCEVREDIWNCP-RBUKOAKNSA-N	0	3	342.458	3.335	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)CC2CCCC2)C[C@H]1c1cccc(F)c1	ZINC001205349882	1370729510	/nfs/dbraw/zinc/72/95/10/1370729510.db2.gz	ISSXQTOHXMBRPR-VQTJNVASSA-N	0	3	342.458	3.313	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cnoc2CC)CCCCC1	ZINC001115752423	1370733580	/nfs/dbraw/zinc/73/35/80/1370733580.db2.gz	BKZMVXNVTYIEHA-UHFFFAOYSA-N	0	3	325.840	3.012	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H](c2cccc(F)c2)[C@H](NCC#CC)C1	ZINC001205432077	1370753485	/nfs/dbraw/zinc/75/34/85/1370753485.db2.gz	BDHHMOGNVMECES-ZVDOUQERSA-N	0	3	342.458	3.335	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3ccc(C)cc3OC)C2)C1=O	ZINC001206748765	1371153175	/nfs/dbraw/zinc/15/31/75/1371153175.db2.gz	JVSIWLWCEWXUBT-FQEVSTJZSA-N	0	3	328.456	3.004	20	30		EGEDHN
C[C@H]1CC[C@@H](CNC(=O)OC(C)(C)C)CN1Cc1cc(C#N)n(C)c1	ZINC001207102573	1371294886	/nfs/dbraw/zinc/29/48/86/1371294886.db2.gz	BRPKNGWHTJFKIG-GJZGRUSLSA-N	0	3	346.475	3.022	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H]1CN(C[C@H]2CC(C)(C)CO2)C[C@H]1C	ZINC001207152772	1371312826	/nfs/dbraw/zinc/31/28/26/1371312826.db2.gz	DUZXNOOPCDCXMR-BPLDGKMQSA-N	0	3	342.911	3.017	20	30		EGEDHN
C=CCN(CCN1CCC2(C[C@@H](F)CO2)CC1)C(=O)OC(C)(C)C	ZINC001207203691	1371329131	/nfs/dbraw/zinc/32/91/31/1371329131.db2.gz	NQIXYTHPLDSABS-OAHLLOKOSA-N	0	3	342.455	3.003	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN(Cc2ccc3cc[nH]c3c2)C[C@H]1C	ZINC001207215412	1371331586	/nfs/dbraw/zinc/33/15/86/1371331586.db2.gz	ISLBCLKGBJRDBW-DNVCBOLYSA-N	0	3	325.456	3.461	20	30		EGEDHN
N#Cc1ccsc1NC(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC001207287542	1371351061	/nfs/dbraw/zinc/35/10/61/1371351061.db2.gz	UQXRSULVPXQZFU-INIZCTEOSA-N	0	3	340.452	3.406	20	30		EGEDHN
CCCCCC(=O)N1CCC[C@H](NCc2cc(C#N)ccc2OC)C1	ZINC001207344045	1371365098	/nfs/dbraw/zinc/36/50/98/1371365098.db2.gz	RKOFGIGTIVROHQ-SFHVURJKSA-N	0	3	343.471	3.228	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2c[nH]c3cccnc23)CCCCC1	ZINC001120009638	1371453559	/nfs/dbraw/zinc/45/35/59/1371453559.db2.gz	CFJCKJZDKIBBMP-UHFFFAOYSA-N	0	3	346.862	3.338	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2[nH]nc3ccccc32)CCCCC1	ZINC001120088466	1371483059	/nfs/dbraw/zinc/48/30/59/1371483059.db2.gz	DJLDFCLXKQJJPP-UHFFFAOYSA-N	0	3	346.862	3.338	20	30		EGEDHN
CCC[C@H](C)C(=O)N1CCC[C@H](NCc2cc(C#N)ccc2OC)C1	ZINC001207718531	1371485290	/nfs/dbraw/zinc/48/52/90/1371485290.db2.gz	RNGDAGQEDZOWNX-YJBOKZPZSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=CCOCc1nn(C)c2c1CN(CC1(c3ccccc3)CC1)CC2	ZINC001207833027	1371515065	/nfs/dbraw/zinc/51/50/65/1371515065.db2.gz	WTDZXJJEBKVPMD-UHFFFAOYSA-N	0	3	337.467	3.213	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207943602	1371545056	/nfs/dbraw/zinc/54/50/56/1371545056.db2.gz	CBLVVINLRHVUEV-LJQANCHMSA-N	0	3	342.870	3.076	20	30		EGEDHN
C=CCCCN1C[C@@H](C)[C@H](NC(=O)c2scnc2C(F)F)C1	ZINC001207960598	1371551554	/nfs/dbraw/zinc/55/15/54/1371551554.db2.gz	ILCJDRUSAMZCSU-GHMZBOCLSA-N	0	3	329.416	3.097	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC[C@@H](N[C@H](C)c2ccc(F)cc2F)C1	ZINC001207991972	1371561902	/nfs/dbraw/zinc/56/19/02/1371561902.db2.gz	CCWCYBJGEBIFLB-GDBMZVCRSA-N	0	3	334.410	3.266	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC[C@H](NCc2ccccc2OC(C)C)C1	ZINC001207995358	1371562066	/nfs/dbraw/zinc/56/20/66/1371562066.db2.gz	GMXWGYNGLPNOSA-IBGZPJMESA-N	0	3	342.483	3.214	20	30		EGEDHN
Cc1cccc(Cl)c1CN[C@@H]1CCCN(C(=O)C#CC(C)C)C1	ZINC001208005788	1371565927	/nfs/dbraw/zinc/56/59/27/1371565927.db2.gz	OCOWKRFRLHGCMO-MRXNPFEDSA-N	0	3	332.875	3.388	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H]2CN([C@@H](C)c3cccc(F)c3)C[C@H]21	ZINC001187714573	1388148460	/nfs/dbraw/zinc/14/84/60/1388148460.db2.gz	UBKFEAMZTRDDIF-VDZJLULYSA-N	0	3	328.431	3.223	20	30		EGEDHN
COC(=O)C1(C#N)CCN(CC[C@@H](C)CCCC(C)(C)OC)CC1	ZINC001208213030	1371652612	/nfs/dbraw/zinc/65/26/12/1371652612.db2.gz	MIJJEBYXJWEKLT-INIZCTEOSA-N	0	3	338.492	3.387	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@H](NCc2ccnc(Cl)c2)C1	ZINC001208239885	1371675926	/nfs/dbraw/zinc/67/59/26/1371675926.db2.gz	GJACIHMAXSCZGS-HNNXBMFYSA-N	0	3	335.879	3.418	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CN(Cc2ccc(CC)cc2)C[C@H]1C	ZINC001208374150	1371741293	/nfs/dbraw/zinc/74/12/93/1371741293.db2.gz	ALVIPJOWLSGMMK-YLJYHZDGSA-N	0	3	326.484	3.379	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CN(Cc2ccc(OC)cc2)C[C@H]1C	ZINC001208387724	1371748295	/nfs/dbraw/zinc/74/82/95/1371748295.db2.gz	ANJARXOTMHCLCY-FRQCXROJSA-N	0	3	330.472	3.234	20	30		EGEDHN
C=CCCC(=O)NC1CC2(CC(NCc3cc(F)ccc3F)C2)C1	ZINC001120788025	1371759180	/nfs/dbraw/zinc/75/91/80/1371759180.db2.gz	ZLHPSSJLWGIGFX-UHFFFAOYSA-N	0	3	334.410	3.448	20	30		EGEDHN
C#CCCCC(=O)NC1CC2(CC(NCc3nc(C)c(C)s3)C2)C1	ZINC001121008132	1371833155	/nfs/dbraw/zinc/83/31/55/1371833155.db2.gz	YJEVFUIHCBUWIE-UHFFFAOYSA-N	0	3	345.512	3.080	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC1CC2(C1)CC(N[C@@H](C)c1cnccn1)C2	ZINC001121174845	1371878093	/nfs/dbraw/zinc/87/80/93/1371878093.db2.gz	BIRKJLKNOWFNMN-VPDSAYSTSA-N	0	3	342.487	3.157	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H]2[C@H]1CCN2CCc1ccc(C#N)cc1	ZINC001208925812	1371947150	/nfs/dbraw/zinc/94/71/50/1371947150.db2.gz	UBKAWNDGEBAYLC-ZWKOTPCHSA-N	0	3	341.455	3.184	20	30		EGEDHN
N#Cc1ccc(CCN2CCN(c3nccc4ccccc43)CC2)cc1	ZINC001208926018	1371947671	/nfs/dbraw/zinc/94/76/71/1371947671.db2.gz	DZHDRHWMZFPQMB-UHFFFAOYSA-N	0	3	342.446	3.471	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001209002373	1371971006	/nfs/dbraw/zinc/97/10/06/1371971006.db2.gz	AEEBYGABACUHND-NRFANRHFSA-N	0	3	336.479	3.202	20	30		EGEDHN
CC1(C(=O)N2CCC[C@@H](NCC#Cc3ccccc3Cl)C2)CCC1	ZINC001209004310	1371972155	/nfs/dbraw/zinc/97/21/55/1371972155.db2.gz	NOYXCJVDOPXLAL-QGZVFWFLSA-N	0	3	344.886	3.462	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CC2(CC(NCc3nc(C)sc3C)C2)C1	ZINC001121534459	1372002631	/nfs/dbraw/zinc/00/26/31/1372002631.db2.gz	JHZQXLULWYQAQY-UHFFFAOYSA-N	0	3	347.528	3.489	20	30		EGEDHN
CC1(C)CC[C@H]1C(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001209120469	1372003674	/nfs/dbraw/zinc/00/36/74/1372003674.db2.gz	FLDQFCQOFNKJME-OALUTQOASA-N	0	3	342.458	3.194	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@@H](NCc2ccc(Cl)nc2)C1	ZINC001209146477	1372014106	/nfs/dbraw/zinc/01/41/06/1372014106.db2.gz	ORHVWNIOQQIMOG-GDBMZVCRSA-N	0	3	335.879	3.418	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NC1CC2(CC(NCc3conc3CC)C2)C1	ZINC001121610728	1372024128	/nfs/dbraw/zinc/02/41/28/1372024128.db2.gz	MEWRALSDFMMAPL-DRDCGLAWSA-N	0	3	345.487	3.212	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC[C@H](NCc2cn(C(C)C)nc2C)C1	ZINC001209184410	1372029785	/nfs/dbraw/zinc/02/97/85/1372029785.db2.gz	SGFAFGOLRROFNF-LPHOPBHVSA-N	0	3	346.519	3.455	20	30		EGEDHN
C=CCCCCN1CCO[C@H]2[C@H]1CC[C@H]2COCc1nccs1	ZINC001209204128	1372036628	/nfs/dbraw/zinc/03/66/28/1372036628.db2.gz	ZOPPXBXGTGWVML-LZLYRXPVSA-N	0	3	336.501	3.495	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)CC[C@H]1CCCCO1)C2	ZINC001121853478	1372103227	/nfs/dbraw/zinc/10/32/27/1372103227.db2.gz	GJYADQPTTCBULS-LMBQMVEXSA-N	0	3	340.895	3.105	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)[C@H]2CC[C@H](C(C)C)CC2)C1	ZINC001209704498	1372174719	/nfs/dbraw/zinc/17/47/19/1372174719.db2.gz	CULXTAHZFNKIDB-NCXUSEDFSA-N	0	3	336.520	3.088	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CCCN(C)C2)nnc1N1CCC(C)=C(C)C1	ZINC001122543639	1372271078	/nfs/dbraw/zinc/27/10/78/1372271078.db2.gz	LSBQYMTYJHFEAM-KRWDZBQOSA-N	0	3	329.492	3.210	20	30		EGEDHN
C=CC1(CC(=O)N2CCC[C@H](NCc3ccnn3C)C2)CCCCC1	ZINC001210109010	1372273017	/nfs/dbraw/zinc/27/30/17/1372273017.db2.gz	XZOHNUYAQCWERT-KRWDZBQOSA-N	0	3	344.503	3.027	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCC(C)(C)NC(=O)OC(C)(C)C	ZINC001123236910	1372403836	/nfs/dbraw/zinc/40/38/36/1372403836.db2.gz	IHWYMPDMBYOAQC-CYBMUJFWSA-N	0	3	348.447	3.163	20	30		EGEDHN
CC(C)(C)C(=O)N1CCC[C@@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001210782905	1372426336	/nfs/dbraw/zinc/42/63/36/1372426336.db2.gz	PVYKRONHUKTZOD-QGZVFWFLSA-N	0	3	332.875	3.318	20	30		EGEDHN
CC(F)(F)C(C)(C)C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001210853118	1372441191	/nfs/dbraw/zinc/44/11/91/1372441191.db2.gz	XJXPXIWHPCTYNP-KRWDZBQOSA-N	0	3	348.437	3.300	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@@H](C)CCc2cccc(F)c2)C1	ZINC001211191889	1372497162	/nfs/dbraw/zinc/49/71/62/1372497162.db2.gz	VGNPGEJZJYOUQY-FRQCXROJSA-N	0	3	332.463	3.407	20	30		EGEDHN
C=C(CN1CCCCC1)c1nc(-c2cccc(OC)c2OC)no1	ZINC001211436793	1372558487	/nfs/dbraw/zinc/55/84/87/1372558487.db2.gz	XQWFTCZHRXXWOK-UHFFFAOYSA-N	0	3	329.400	3.253	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(C[C@H]3CC(C)(C)CO3)C[C@H]2C)CCCC1	ZINC001211495330	1372568217	/nfs/dbraw/zinc/56/82/17/1372568217.db2.gz	JDFFCCAMXQNHGS-KZNAEPCWSA-N	0	3	348.531	3.375	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H](CC)CCCC)C[C@H]1c1ccccc1	ZINC001211536129	1372575829	/nfs/dbraw/zinc/57/58/29/1372575829.db2.gz	WRPBOMYVTPNOTA-YZGWKJHDSA-N	0	3	326.484	3.420	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@H](C)C(C)(C)C)C[C@H]1c1ccccc1	ZINC001211623910	1372592178	/nfs/dbraw/zinc/59/21/78/1372592178.db2.gz	WZRWSQKEMOHGIH-YTQUADARSA-N	0	3	326.484	3.276	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C[C@H](C)C(C)(C)C)C[C@H]1c1ccccc1	ZINC001211713294	1372607527	/nfs/dbraw/zinc/60/75/27/1372607527.db2.gz	HDSWKTWDQLPBMN-YTQUADARSA-N	0	3	326.484	3.276	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2cccc(F)c2C)[C@H](OC)C1	ZINC001212301462	1372683898	/nfs/dbraw/zinc/68/38/98/1372683898.db2.gz	UPQLCYHYNKTFPK-RTBURBONSA-N	0	3	348.462	3.310	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)C23CCC(CC2)C3)[C@H](OC)C1	ZINC001212465040	1372710775	/nfs/dbraw/zinc/71/07/75/1372710775.db2.gz	BHHQBDZFHJOSBP-SFANZJOMSA-N	0	3	336.520	3.353	20	30		EGEDHN
C=C[C@H](CC(=O)N1CC[C@@H](NCc2cncc(C)c2)C1)c1ccccc1	ZINC001188040221	1388224870	/nfs/dbraw/zinc/22/48/70/1388224870.db2.gz	PKWJUJQVWDKZAV-TZIWHRDSSA-N	0	3	349.478	3.440	20	30		EGEDHN
C[C@H]1[C@H](NC(=O)c2csc(C#N)c2)CCN1Cc1ccccc1	ZINC001326517294	1388226522	/nfs/dbraw/zinc/22/65/22/1388226522.db2.gz	USJWQEVAGRZDLS-SUMWQHHRSA-N	0	3	325.437	3.013	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CN(CCCc2ccccc2)C[C@H]1OC	ZINC001213319741	1372883630	/nfs/dbraw/zinc/88/36/30/1372883630.db2.gz	AURSXQQYUMKDGI-DFQSSKMNSA-N	0	3	344.499	3.037	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2cc[nH]c2C2CC2)[C@H](OC)C1	ZINC001213335532	1372886769	/nfs/dbraw/zinc/88/67/69/1372886769.db2.gz	FXYFGRUWQZJVLV-QZTJIDSGSA-N	0	3	347.503	3.292	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)C2(CC=C)CCC2)[C@H](OC)C1	ZINC001213397379	1372900716	/nfs/dbraw/zinc/90/07/16/1372900716.db2.gz	KCEXOSSXGBQWSH-QZTJIDSGSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2ccccc2C2(C)CC2)[C@H](OC)C1	ZINC001213430343	1372905454	/nfs/dbraw/zinc/90/54/54/1372905454.db2.gz	FQUNBSXPAZSFRU-RTBURBONSA-N	0	3	342.483	3.133	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)[C@H](CC)CC2CCCCC2)[C@H](OC)C1	ZINC001213525245	1372919922	/nfs/dbraw/zinc/91/99/22/1372919922.db2.gz	XLIBRSZSBUXSQN-GUDVDZBRSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2ccc(C(C)C)cc2)[C@H](OC)C1	ZINC001213773012	1372959399	/nfs/dbraw/zinc/95/93/99/1372959399.db2.gz	ZMEGFOKQFMXNPB-RTBURBONSA-N	0	3	330.472	3.205	20	30		EGEDHN
C=C[C@@H](C(=O)N[C@@H]1CN(CC/C=C\CC)C[C@H]1OC)c1ccccc1	ZINC001213900213	1372977922	/nfs/dbraw/zinc/97/79/22/1372977922.db2.gz	VNAWFPQDRWLBCI-AHSYYPKJSA-N	0	3	342.483	3.128	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CCCCC2)C[C@H]1NCC#Cc1ccc(F)cc1	ZINC001214064101	1373002931	/nfs/dbraw/zinc/00/29/31/1373002931.db2.gz	XFNDUERBXNDXCX-OXQOHEQNSA-N	0	3	342.458	3.194	20	30		EGEDHN
CCCCCC(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001214147896	1373015549	/nfs/dbraw/zinc/01/55/49/1373015549.db2.gz	DTKWXXGBZLNKJD-RDTXWAMCSA-N	0	3	331.435	3.214	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2CCC2)C[C@H]1NCC#Cc1cccc(Cl)c1	ZINC001214391458	1373053396	/nfs/dbraw/zinc/05/33/96/1373053396.db2.gz	LKCMBLWXLGFLIH-DNVCBOLYSA-N	0	3	344.886	3.318	20	30		EGEDHN
C[C@@H]1CN(C(=O)C#CC(C)(C)C)C[C@H]1NCc1ccccc1Cl	ZINC001214588978	1373085717	/nfs/dbraw/zinc/08/57/17/1373085717.db2.gz	BNZRGLJVNHAOMY-RHSMWYFYSA-N	0	3	332.875	3.326	20	30		EGEDHN
CC[C@H](C)CCCCC(=O)NCCNCc1ccc(OC)c(C#N)c1	ZINC001128158253	1373225716	/nfs/dbraw/zinc/22/57/16/1373225716.db2.gz	DKSSSIHQOJFCGD-INIZCTEOSA-N	0	3	345.487	3.379	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](C)[C@H](NCc3cccnc3)C2)CCCC1	ZINC001217106290	1373387989	/nfs/dbraw/zinc/38/79/89/1373387989.db2.gz	PAGKUWQWMOAVLD-SJLPKXTDSA-N	0	3	327.472	3.155	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cccc3c2CCCCC3)cc1	ZINC001129998223	1373443838	/nfs/dbraw/zinc/44/38/38/1373443838.db2.gz	VWRRUPYYZJPAPL-UHFFFAOYSA-N	0	3	347.462	3.347	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)CCC3CCC3)[C@H]2C1	ZINC001217606096	1373471708	/nfs/dbraw/zinc/47/17/08/1373471708.db2.gz	APNWZUORCYEZQM-RBUKOAKNSA-N	0	3	336.520	3.449	20	30		EGEDHN
CC1(C)[NH2+][C@@H](CO[C@@H](/C(=N\[O-])c2ccccc2)c2ccccc2)CO1	ZINC001217841623	1373506719	/nfs/dbraw/zinc/50/67/19/1373506719.db2.gz	UDFJWCDREUUFHT-CBFYOKTRSA-N	0	3	340.423	3.347	20	30		EGEDHN
C=CCOc1ccc(C(=O)NCCNCc2cc(F)cc(F)c2)cc1	ZINC001130371538	1373508296	/nfs/dbraw/zinc/50/82/96/1373508296.db2.gz	YOIJZBDWIMCGFM-UHFFFAOYSA-N	0	3	346.377	3.049	20	30		EGEDHN
Cc1ccc(CC(=O)NCCNCc2ccc(C#N)s2)c(Cl)c1	ZINC001130398534	1373519210	/nfs/dbraw/zinc/51/92/10/1373519210.db2.gz	XGHKDVWJROAOTF-UHFFFAOYSA-N	0	3	347.871	3.030	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCO[C@@H]2CN(CCCC(C)(C)C)C[C@@H]21	ZINC001217988730	1373528289	/nfs/dbraw/zinc/52/82/89/1373528289.db2.gz	WUSDROIHQUTRBL-RBUKOAKNSA-N	0	3	348.531	3.493	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2OCCN(C(=O)c3sc(C)cc3C)[C@H]2C1	ZINC001217998168	1373531021	/nfs/dbraw/zinc/53/10/21/1373531021.db2.gz	USGZDGFANOHHJU-BHYGNILZSA-N	0	3	348.512	3.245	20	30		EGEDHN
C=C(C)CCC(=O)N1CCO[C@@H]2CN(CCCC3CCCC3)C[C@@H]21	ZINC001218037437	1373544592	/nfs/dbraw/zinc/54/45/92/1373544592.db2.gz	NCDAPKRSQGVSFY-RBUKOAKNSA-N	0	3	334.504	3.225	20	30		EGEDHN
CN1CCCC[C@H]1CNC(=O)Nc1ccc(OC(C)(C)C)c(C#N)c1	ZINC001218288922	1373589072	/nfs/dbraw/zinc/58/90/72/1373589072.db2.gz	VVNOXKRUMFHUTG-INIZCTEOSA-N	0	3	344.459	3.341	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cc3ccccc3s2)cc1	ZINC001130923870	1373608698	/nfs/dbraw/zinc/60/86/98/1373608698.db2.gz	BXPMTJHXUYGPQY-UHFFFAOYSA-N	0	3	335.432	3.293	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)[C@@H](C)c3ccco3)[C@H]2C1	ZINC001218617275	1373637196	/nfs/dbraw/zinc/63/71/96/1373637196.db2.gz	HHXHFXGIYVQFNK-JENIJYKNSA-N	0	3	346.471	3.041	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)C2CCCCCCC2)cc1F	ZINC001131146011	1373653067	/nfs/dbraw/zinc/65/30/67/1373653067.db2.gz	VKKVVHHCMWFLHN-UHFFFAOYSA-N	0	3	331.435	3.264	20	30		EGEDHN
CNc1ccc(C#N)cc1NC(=O)[C@H]1CCC[C@H](c2ccccc2)N1	ZINC001218980700	1373674468	/nfs/dbraw/zinc/67/44/68/1373674468.db2.gz	IUFKDMDBSMMFQV-SJLPKXTDSA-N	0	3	334.423	3.422	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)[C@@H]3CCCCC3(C)C)[C@H]2C1	ZINC001219058796	1373683861	/nfs/dbraw/zinc/68/38/61/1373683861.db2.gz	LWAYNFTXMKLVII-OKZBNKHCSA-N	0	3	334.504	3.081	20	30		EGEDHN
C[Si](C)(C)C#Cc1cccc(NC(=O)c2ccc3c(n2)CCNC3)c1	ZINC001219311049	1373700540	/nfs/dbraw/zinc/70/05/40/1373700540.db2.gz	RHKDIUSXTJMMKC-UHFFFAOYSA-N	0	3	349.510	3.209	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1CN(CCC2CCCCCC2)C[C@@H]1O	ZINC001219690011	1373726402	/nfs/dbraw/zinc/72/64/02/1373726402.db2.gz	TZWBPMMDFFQKKX-UXHICEINSA-N	0	3	348.531	3.277	20	30		EGEDHN
C=CCCC(=O)N1C[C@H](C)O[C@@]2(CCN(Cc3ccc(C)cc3)C2)C1	ZINC001131645603	1373741030	/nfs/dbraw/zinc/74/10/30/1373741030.db2.gz	HSNVVIAKHFTGPJ-GHTZIAJQSA-N	0	3	342.483	3.153	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)O[C@]2(CCN(Cc3ccc(C)cc3)C2)C1	ZINC001131645604	1373741652	/nfs/dbraw/zinc/74/16/52/1373741652.db2.gz	HSNVVIAKHFTGPJ-NQIIRXRSSA-N	0	3	342.483	3.153	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CN(CCC2CCCCCC2)C[C@@H]1O	ZINC001220201152	1373757730	/nfs/dbraw/zinc/75/77/30/1373757730.db2.gz	HRXRTMLSRGNALW-UHOSZYNNSA-N	0	3	336.520	3.111	20	30		EGEDHN
C#CCCN1CC[C@]2(C1)CN(C(=O)CCCCCC(C)C)C[C@H](C)O2	ZINC001131688013	1373763100	/nfs/dbraw/zinc/76/31/00/1373763100.db2.gz	GNPUFDFWHGOLJG-FPOVZHCZSA-N	0	3	348.531	3.308	20	30		EGEDHN
C=CCCC1(C(=O)N2C[C@H](C)O[C@]3(CCN(CC=C(C)C)C3)C2)CC1	ZINC001131688479	1373764845	/nfs/dbraw/zinc/76/48/45/1373764845.db2.gz	MRZDQLGGDCJWQL-RXVVDRJESA-N	0	3	346.515	3.391	20	30		EGEDHN
C=CCCCN1CC[C@@H]2CN(C(=O)c3cnc(CC(C)C)s3)[C@@H]2C1	ZINC001222093850	1373816012	/nfs/dbraw/zinc/81/60/12/1373816012.db2.gz	QPCMPEIDJKPQDR-HZPDHXFCSA-N	0	3	347.528	3.454	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CC[C@H]2CCN(Cc3ccsc3)[C@H]2C1	ZINC001222397822	1373835862	/nfs/dbraw/zinc/83/58/62/1373835862.db2.gz	LFQLJXIWPXTSFO-JQHSSLGASA-N	0	3	348.512	3.152	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)C[C@@H](CC)CCCC)[C@@H]2C1	ZINC001188617934	1388344882	/nfs/dbraw/zinc/34/48/82/1388344882.db2.gz	OBHNDHITYHOGDE-GBESFXJTSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC[C@@H](C)N(CCOCc2ccccc2)C1	ZINC001131896545	1375032956	/nfs/dbraw/zinc/03/29/56/1375032956.db2.gz	TVGVXYRZXNTINV-MJGOQNOKSA-N	0	3	330.472	3.139	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@H](C)N(Cc2ccc(COC)cc2)C1	ZINC001131899677	1375035910	/nfs/dbraw/zinc/03/59/10/1375035910.db2.gz	NWSHOPHXXKFGQF-QFBILLFUSA-N	0	3	330.472	3.268	20	30		EGEDHN
C=CCC1(C(=O)NCC2CCN(Cc3cccnc3C)CC2)CCC1	ZINC001224402345	1375066272	/nfs/dbraw/zinc/06/62/72/1375066272.db2.gz	FVDZDMYRZTYUGJ-UHFFFAOYSA-N	0	3	341.499	3.465	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1CC[C@@H](C)N(Cc2ccc3c(c2)CCC3)C1	ZINC001132017145	1375100694	/nfs/dbraw/zinc/10/06/94/1375100694.db2.gz	MIKPLWQLYPKECA-DYESRHJHSA-N	0	3	338.495	3.304	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)CC[C@@H]2CCc3ccccc32)CC1	ZINC001225542013	1375122043	/nfs/dbraw/zinc/12/20/43/1375122043.db2.gz	GCBMXDIRQQMZTK-FQEVSTJZSA-N	0	3	338.495	3.348	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CC[C@H](C)N(CCOCC2CCC2)C1	ZINC001132060531	1375126415	/nfs/dbraw/zinc/12/64/15/1375126415.db2.gz	HAHDUAZQZWSXRP-FUHWJXTLSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCCOCC(=O)NCC1CCN(Cc2ccc(F)cc2C)CC1	ZINC001225625843	1375134775	/nfs/dbraw/zinc/13/47/75/1375134775.db2.gz	PLPADBWUXSUIDA-UHFFFAOYSA-N	0	3	348.462	3.055	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H]1CC[C@@H](C)N(CCOCC(C)C)C1	ZINC001132079377	1375136037	/nfs/dbraw/zinc/13/60/37/1375136037.db2.gz	XOXXPAWITKKVRN-GDBMZVCRSA-N	0	3	344.927	3.407	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COCc2ccc(C)cc2)CC[C@@H]1C	ZINC001132082393	1375137372	/nfs/dbraw/zinc/13/73/72/1375137372.db2.gz	GOGXSICELAYZSG-HKUYNNGSSA-N	0	3	330.472	3.057	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCOc2cccc(C)c2C)CC[C@H]1C	ZINC001132094147	1375141836	/nfs/dbraw/zinc/14/18/36/1375141836.db2.gz	HUYZTARMJUHKHI-AEFFLSMTSA-N	0	3	330.472	3.227	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2nc3cccnc3s2)CC[C@H]1C	ZINC001132110846	1375153118	/nfs/dbraw/zinc/15/31/18/1375153118.db2.gz	MFVUAZXASQSSDI-KGLIPLIRSA-N	0	3	344.484	3.240	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCc2ncc(C(C)(C)C)o2)CC[C@@H]1C	ZINC001132117048	1375156971	/nfs/dbraw/zinc/15/69/71/1375156971.db2.gz	ZIWDRDWBVSWNNA-LSDHHAIUSA-N	0	3	333.476	3.060	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)CCc2ccc(C)cc2)CC[C@@H]1C	ZINC001132168616	1375182911	/nfs/dbraw/zinc/18/29/11/1375182911.db2.gz	FENKXMCBLVDKBW-ICSRJNTNSA-N	0	3	344.499	3.099	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)C2CCC3(CC3)CC2)CC[C@H]1C	ZINC001132173004	1375187519	/nfs/dbraw/zinc/18/75/19/1375187519.db2.gz	GAEKWKHKEUEDSA-AEFFLSMTSA-N	0	3	334.504	3.129	20	30		EGEDHN
CCCCCCC[N@@H+]1C[C@@H](NC(=O)c2c(C)nc[n-]c2=O)CC[C@H]1C	ZINC001132235687	1375230753	/nfs/dbraw/zinc/23/07/53/1375230753.db2.gz	ROKUPACLVQGOMW-ZBFHGGJFSA-N	0	3	348.491	3.044	20	30		EGEDHN
CCCCCCC[N@H+]1C[C@@H](NC(=O)c2c(C)nc[n-]c2=O)CC[C@H]1C	ZINC001132235687	1375230757	/nfs/dbraw/zinc/23/07/57/1375230757.db2.gz	ROKUPACLVQGOMW-ZBFHGGJFSA-N	0	3	348.491	3.044	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1CCCC[C@H]1NCc1cc(C)ncn1	ZINC001226435425	1375258322	/nfs/dbraw/zinc/25/83/22/1375258322.db2.gz	WNVZTNQYVQHKRF-RTBURBONSA-N	0	3	342.487	3.070	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC1CCN(Cc2csc(C)c2)CC1	ZINC001226447223	1375260217	/nfs/dbraw/zinc/26/02/17/1375260217.db2.gz	IUIZLJQKQUEDRD-OAHLLOKOSA-N	0	3	336.501	3.118	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2CC[C@@H](C)N(CCOCC(C)C)C2)CCC1	ZINC001132283176	1375267036	/nfs/dbraw/zinc/26/70/36/1375267036.db2.gz	TVZSNIVZFKKGSV-MSOLQXFVSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1CC[C@@H](C)N(CCc2cnn(CC)c2)C1	ZINC001132330563	1375310772	/nfs/dbraw/zinc/31/07/72/1375310772.db2.gz	JFUBMMYONNNKJN-AEFFLSMTSA-N	0	3	346.519	3.017	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COCc2ccccc2C)CC[C@@H]1C	ZINC001132340159	1375320409	/nfs/dbraw/zinc/32/04/09/1375320409.db2.gz	NPQBBGJAMLKDLP-PKOBYXMFSA-N	0	3	330.472	3.057	20	30		EGEDHN
CCCCCCCN1C[C@H](NC(=O)c2c[nH]c(C)cc2=O)CC[C@H]1C	ZINC001132403503	1375356389	/nfs/dbraw/zinc/35/63/89/1375356389.db2.gz	XWNMXAIYUCUFLZ-IAGOWNOFSA-N	0	3	347.503	3.236	20	30		EGEDHN
C#CCCCC(=O)NC1CCN([C@H]2CCc3c2cccc3F)CC1	ZINC001227108429	1375391491	/nfs/dbraw/zinc/39/14/91/1375391491.db2.gz	QGEXTJWULJSTPQ-IBGZPJMESA-N	0	3	328.431	3.197	20	30		EGEDHN
C#CCCCC(=O)NC1CCN([C@@H](C)c2cccc(OC)c2)CC1	ZINC001227108079	1375391551	/nfs/dbraw/zinc/39/15/51/1375391551.db2.gz	LIPBNNWAJWRJRM-INIZCTEOSA-N	0	3	328.456	3.140	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COc2ccc(CC)cc2)CC[C@H]1C	ZINC001132462388	1375405185	/nfs/dbraw/zinc/40/51/85/1375405185.db2.gz	ZKHFDJPYYXCOKJ-SJLPKXTDSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCc2c[nH]c3ccccc23)CC[C@@H]1C	ZINC001132463912	1375406656	/nfs/dbraw/zinc/40/66/56/1375406656.db2.gz	JZDNHKVGFVICEL-RDJZCZTQSA-N	0	3	325.456	3.256	20	30		EGEDHN
CC#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)/C(C)=C\C)CC1	ZINC001132554053	1375459836	/nfs/dbraw/zinc/45/98/36/1375459836.db2.gz	BTFOSQNOEKKNLU-LLOGYHTPSA-N	0	3	339.483	3.254	20	30		EGEDHN
C#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)CC2(C)CC2)CC1	ZINC001132554001	1375460016	/nfs/dbraw/zinc/46/00/16/1375460016.db2.gz	AGGDFARVTYRDPW-IBGZPJMESA-N	0	3	339.483	3.088	20	30		EGEDHN
CC#CCN1CC[C@@H](CN(Cc2scnc2C)C(=O)C=C(C)C)C1	ZINC001132557980	1375464828	/nfs/dbraw/zinc/46/48/28/1375464828.db2.gz	HOIJNYVVTVZWAO-QGZVFWFLSA-N	0	3	345.512	3.092	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2N(Cc2nccs2)C(=O)[C@H](C)CC)CC1	ZINC001132566091	1375470400	/nfs/dbraw/zinc/47/04/00/1375470400.db2.gz	HTEOLYUBQDLPGN-CVEARBPZSA-N	0	3	345.512	3.006	20	30		EGEDHN
C#CCC1(C(=O)NC2CCN(Cc3cc(F)ccc3C)CC2)CCC1	ZINC001227754452	1375471944	/nfs/dbraw/zinc/47/19/44/1375471944.db2.gz	MXEMYHIZVWLYMT-UHFFFAOYSA-N	0	3	342.458	3.408	20	30		EGEDHN
C=CCc1cc(OC)c(O[C@@H]2CCN(C(C)C)C2)c(C(=O)OC)c1	ZINC001228244683	1375532720	/nfs/dbraw/zinc/53/27/20/1375532720.db2.gz	KADZSBFULRTIEO-OAHLLOKOSA-N	0	3	333.428	3.072	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](C)[C@H](CNCc2nc(C)cs2)C1	ZINC001132761690	1375551882	/nfs/dbraw/zinc/55/18/82/1375551882.db2.gz	KRWJGWDSYDNLFO-DOTOQJQBSA-N	0	3	347.528	3.219	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1CCCC[C@H]1NCc1ccc(F)cn1	ZINC001228412986	1375568103	/nfs/dbraw/zinc/56/81/03/1375568103.db2.gz	DUANLRGRMXMKQH-ZHALLVOQSA-N	0	3	333.451	3.340	20	30		EGEDHN
Cc1csc(CNC[C@H]2CN(C(=O)C#CC(C)(C)C)CC[C@@H]2C)n1	ZINC001132818593	1375581444	/nfs/dbraw/zinc/58/14/44/1375581444.db2.gz	LECSPKKXYXMFDL-HOCLYGCPSA-N	0	3	347.528	3.075	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](C)[C@H](CNCc2ccn(C(C)C)n2)C1	ZINC001132864697	1375607708	/nfs/dbraw/zinc/60/77/08/1375607708.db2.gz	AIZQFTLCDLLNFS-QZTJIDSGSA-N	0	3	346.519	3.395	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NC1CCN(Cc2sc(C)nc2C)CC1	ZINC001228759716	1375666786	/nfs/dbraw/zinc/66/67/86/1375666786.db2.gz	CCNCBDSNRARGGU-OLZOCXBDSA-N	0	3	335.517	3.299	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC1CCN(CCOc2ccccc2)CC1	ZINC001228810613	1375684307	/nfs/dbraw/zinc/68/43/07/1375684307.db2.gz	YGNFMPOPTGPZJV-KRWDZBQOSA-N	0	3	330.472	3.248	20	30		EGEDHN
C=CCC1(C(=O)NC2CCN(C[C@@H](O)c3ccccc3)CC2)CCC1	ZINC001229029494	1375744534	/nfs/dbraw/zinc/74/45/34/1375744534.db2.gz	FIAUOGOXPIAVCV-LJQANCHMSA-N	0	3	342.483	3.047	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](C)[C@@H](CNCc2nccn2CC)C1	ZINC001133142863	1375804261	/nfs/dbraw/zinc/80/42/61/1375804261.db2.gz	PSGIMDYFWKENGR-IRXDYDNUSA-N	0	3	346.519	3.080	20	30		EGEDHN
CC(=O)N(CCNCc1ccc(C#N)cc1)Cc1cccc(Cl)c1	ZINC001133379872	1375959661	/nfs/dbraw/zinc/95/96/61/1375959661.db2.gz	KQHYPWBZOHGDRN-UHFFFAOYSA-N	0	3	341.842	3.350	20	30		EGEDHN
CC[C@H](F)CNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H](C)C#N	ZINC001133392650	1375976934	/nfs/dbraw/zinc/97/69/34/1375976934.db2.gz	HLWUACRQECPXDE-BBRMVZONSA-N	0	3	339.842	3.166	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C1(CCF)CC1	ZINC001133399118	1375982137	/nfs/dbraw/zinc/98/21/37/1375982137.db2.gz	DFARUTIQNVJLAY-UHFFFAOYSA-N	0	3	336.838	3.031	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H]1CC[C@H]2C[C@H]2C1	ZINC001133399572	1375983075	/nfs/dbraw/zinc/98/30/75/1375983075.db2.gz	SLGHENCKJXEUAK-KSZLIROESA-N	0	3	344.886	3.328	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@H](C)[C@H](C)C=C	ZINC001133403817	1375988765	/nfs/dbraw/zinc/98/87/65/1375988765.db2.gz	KTHKRWDTUGXSEW-HZPDHXFCSA-N	0	3	332.875	3.350	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)C1CCCC1)NCc1cc(F)ccc1C#N	ZINC001133464994	1376023979	/nfs/dbraw/zinc/02/39/79/1376023979.db2.gz	HUNANAPNJVWALP-KBPBESRZSA-N	0	3	331.435	3.260	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NC1CCN(Cc2cc(C)sc2C)CC1	ZINC001230415673	1376024286	/nfs/dbraw/zinc/02/42/86/1376024286.db2.gz	WHJXFRGUIQBQOQ-CQSZACIVSA-N	0	3	336.501	3.037	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)c1cc(C)oc1C	ZINC001133640491	1376131020	/nfs/dbraw/zinc/13/10/20/1376131020.db2.gz	IIIGHGMQILFMEB-QWRGUYRKSA-N	0	3	343.265	3.292	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)c1cc(Cl)c[nH]1)NCc1ccccc1C#N	ZINC001133670760	1376146972	/nfs/dbraw/zinc/14/69/72/1376146972.db2.gz	FCHKKIQUQDYZNF-CHWSQXEVSA-N	0	3	344.846	3.226	20	30		EGEDHN
C=C(C)CCC(=O)NCCCN(CC[C@@H](C)F)Cc1cccnc1	ZINC001230771896	1376148136	/nfs/dbraw/zinc/14/81/36/1376148136.db2.gz	VHNNOSTWGYKDQY-QGZVFWFLSA-N	0	3	335.467	3.494	20	30		EGEDHN
C=CCCCC(=O)NCCCN(Cc1cccnc1)C[C@H](CC)OC	ZINC001230829222	1376161807	/nfs/dbraw/zinc/16/18/07/1376161807.db2.gz	APJKEEGHYZBEAS-IBGZPJMESA-N	0	3	347.503	3.171	20	30		EGEDHN
C#CCCN(CCCNC(=O)[C@H]1C[C@]1(C)C(C)C)Cc1cccnc1	ZINC001230882326	1376175753	/nfs/dbraw/zinc/17/57/53/1376175753.db2.gz	OTRFHGZUULXFIF-TZIWHRDSSA-N	0	3	341.499	3.095	20	30		EGEDHN
C=CCCC(=O)N[C@@H](C)C[C@H](C)NCc1nc2ccc(F)cc2o1	ZINC001133887704	1376250760	/nfs/dbraw/zinc/25/07/60/1376250760.db2.gz	BFORZQDLGPRUGD-STQMWFEESA-N	0	3	333.407	3.306	20	30		EGEDHN
C=CCOc1cccc(CN2CCCN(c3ccc(F)cn3)CC2)c1	ZINC001231621011	1376283591	/nfs/dbraw/zinc/28/35/91/1376283591.db2.gz	LSTKBJVBCIDOIC-UHFFFAOYSA-N	0	3	341.430	3.498	20	30		EGEDHN
C=CCOc1cccc(CN2CC[C@]3(CCCN3C(=O)C(C)C)C2)c1	ZINC001231623813	1376285894	/nfs/dbraw/zinc/28/58/94/1376285894.db2.gz	WZRVPNYCVOHBBA-OAQYLSRUSA-N	0	3	342.483	3.474	20	30		EGEDHN
CC(C)=C(F)C(=O)N[C@H](C)C[C@H](C)NCc1cc(F)ccc1C#N	ZINC001134080645	1376355280	/nfs/dbraw/zinc/35/52/80/1376355280.db2.gz	APXJCYZNENKBKB-QWHCGFSZSA-N	0	3	335.398	3.334	20	30		EGEDHN
Cc1[nH]ccc1C(=O)N[C@@H](C)C[C@H](C)NCc1cc(F)ccc1C#N	ZINC001134104966	1376370656	/nfs/dbraw/zinc/37/06/56/1376370656.db2.gz	NROMIDWPVQLJRX-STQMWFEESA-N	0	3	342.418	3.021	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H](C)C[C@H](C)NCc1nc(C)c(C)s1	ZINC001134113203	1376373805	/nfs/dbraw/zinc/37/38/05/1376373805.db2.gz	ALFDUYSVEULHGK-KBPBESRZSA-N	0	3	335.517	3.326	20	30		EGEDHN
Cc1ccc(C(=O)NCCNCc2ccc(C#N)c(F)c2)c(Cl)c1	ZINC001134165578	1376396275	/nfs/dbraw/zinc/39/62/75/1376396275.db2.gz	TYANCRKNJUOYLM-UHFFFAOYSA-N	0	3	345.805	3.179	20	30		EGEDHN
COc1ccc(-c2c(CN3[C@@H]4CC[C@H]3C[C@H](C#N)C4)cnn2C)cc1	ZINC001232112066	1376400783	/nfs/dbraw/zinc/40/07/83/1376400783.db2.gz	GYCWSTNZHATFRO-GJWQZFMSSA-N	0	3	336.439	3.362	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](C)C[C@H](C)NCc2ccccc2C#N)co1	ZINC001134179355	1376403397	/nfs/dbraw/zinc/40/33/97/1376403397.db2.gz	UEETUOUZRVYEIU-UONOGXRCSA-N	0	3	325.412	3.146	20	30		EGEDHN
C#CCCCC(=O)N[C@H](C)C[C@@H](C)NCc1oc(CCC)nc1C	ZINC001134201270	1376415102	/nfs/dbraw/zinc/41/51/02/1376415102.db2.gz	NCQFUUNWZNPJPR-HUUCEWRRSA-N	0	3	333.476	3.112	20	30		EGEDHN
Cc1cc[nH]c1C(=O)N[C@@H](C)C[C@H](C)NCc1cc(F)ccc1C#N	ZINC001134273694	1376449808	/nfs/dbraw/zinc/44/98/08/1376449808.db2.gz	ITSZPNSODTXKMT-KBPBESRZSA-N	0	3	342.418	3.021	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1nsc2ccccc21)NC(=O)C#CC1CC1	ZINC001134321430	1376475441	/nfs/dbraw/zinc/47/54/41/1376475441.db2.gz	HEHNNELVKKKLTP-UONOGXRCSA-N	0	3	341.480	3.083	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)C#CC(C)(C)C)NCc1c(F)cccc1F	ZINC001134328664	1376479546	/nfs/dbraw/zinc/47/95/46/1376479546.db2.gz	FPVDKCUHPOXDMP-KGLIPLIRSA-N	0	3	336.426	3.387	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1ccncc1Cl)NC(=O)C#CC(C)(C)C	ZINC001134330209	1376480635	/nfs/dbraw/zinc/48/06/35/1376480635.db2.gz	XJLUYVMAVUCJGV-UONOGXRCSA-N	0	3	335.879	3.157	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001232844139	1376522962	/nfs/dbraw/zinc/52/29/62/1376522962.db2.gz	GTSYJNKQNCFVDK-XJKSGUPXSA-N	0	3	347.484	3.451	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC001232845821	1376524441	/nfs/dbraw/zinc/52/44/41/1376524441.db2.gz	SNJHPXVJJSXBQU-ZDUSSCGKSA-N	0	3	335.473	3.309	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H](C)C[C@H](C)NCc1nccn1C(F)F	ZINC001134448874	1376543548	/nfs/dbraw/zinc/54/35/48/1376543548.db2.gz	PUGSVXSGLGQCED-STQMWFEESA-N	0	3	342.434	3.253	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H](C)C[C@H](C)NCc1ccn(C(C)C)n1	ZINC001134457109	1376548031	/nfs/dbraw/zinc/54/80/31/1376548031.db2.gz	JTLLQVYHKPLCDW-HOTGVXAUSA-N	0	3	334.508	3.439	20	30		EGEDHN
COc1ccc(CCN(Cc2ccc(C)cc2C#N)C[C@@H](C)O)cc1	ZINC001232962928	1376548687	/nfs/dbraw/zinc/54/86/87/1376548687.db2.gz	UOYBGZOQUZQJSJ-QGZVFWFLSA-N	0	3	338.451	3.301	20	30		EGEDHN
O=C1C=C2CN(Cc3csc(Br)c3)CCC2S1	ZINC001233413040	1376641664	/nfs/dbraw/zinc/64/16/64/1376641664.db2.gz	DXWVMKBCNYWBOV-SNVBAGLBSA-N	0	3	330.272	3.285	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)CCC(C)(F)F)NCc1ccccc1C#N	ZINC001134761708	1376706184	/nfs/dbraw/zinc/70/61/84/1376706184.db2.gz	RZTJLADJOUJCJE-ZIAGYGMSSA-N	0	3	337.414	3.367	20	30		EGEDHN
C=CCC[C@H](C)N1CC[C@@H]1CN(C)C(=O)c1cc(C(F)(F)F)no1	ZINC001235632310	1376879984	/nfs/dbraw/zinc/87/99/84/1376879984.db2.gz	FXVVXPXGIFJYIM-NWDGAFQWSA-N	0	3	345.365	3.194	20	30		EGEDHN
COc1ccc(CNCCNC(=O)[C@@H](C)[C@H](C)C(C)(C)C)cc1C#N	ZINC001135177686	1376950348	/nfs/dbraw/zinc/95/03/48/1376950348.db2.gz	KBJJDWWCIDMFTR-GJZGRUSLSA-N	0	3	345.487	3.091	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](C)C[C@@H](C)NCc1ccn(C(C)C)n1	ZINC001135182189	1376954979	/nfs/dbraw/zinc/95/49/79/1376954979.db2.gz	ZGYGSNNXWSAAGT-CVEARBPZSA-N	0	3	334.508	3.439	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)C1(C(F)F)CCC1)NCc1ccccc1C#N	ZINC001135288731	1377022195	/nfs/dbraw/zinc/02/21/95/1377022195.db2.gz	JKNYQHNXSXTISP-ZIAGYGMSSA-N	0	3	349.425	3.367	20	30		EGEDHN
CCc1ccc([C@H](C)C(=O)NCCNCc2ccc(C#N)s2)cc1	ZINC001135368467	1377057800	/nfs/dbraw/zinc/05/78/00/1377057800.db2.gz	CNYMHSJBUWCYLG-AWEZNQCLSA-N	0	3	341.480	3.192	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H](C)C[C@H](C)NCc2oc(CC)nc2C)C1	ZINC001135426607	1377089825	/nfs/dbraw/zinc/08/98/25/1377089825.db2.gz	FTFGIGPUDZJEIJ-UONOGXRCSA-N	0	3	333.476	3.275	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)C1(F)CCCCC1	ZINC001135854308	1377235773	/nfs/dbraw/zinc/23/57/73/1377235773.db2.gz	CDOXFECFWSFZSY-STQMWFEESA-N	0	3	349.288	3.440	20	30		EGEDHN
CC[C@H]1CCCC[C@H]1C(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001136080308	1377333598	/nfs/dbraw/zinc/33/35/98/1377333598.db2.gz	DVXUHKQMMMNQJH-DOTOQJQBSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)CCc1nc(C)cs1)C1CC1	ZINC001267856624	1377475424	/nfs/dbraw/zinc/47/54/24/1377475424.db2.gz	UDHKQBYAQQKLRD-INIZCTEOSA-N	0	3	341.908	3.011	20	30		EGEDHN
CC(C)C[C@H](CNCc1ccc(F)c(C#N)c1)NC(=O)C1CCC1	ZINC001268101316	1377486460	/nfs/dbraw/zinc/48/64/60/1377486460.db2.gz	GNZPYARLFRZFEG-QGZVFWFLSA-N	0	3	331.435	3.118	20	30		EGEDHN
CN(c1ccc(C#N)cc1)c1ccc(CN2CC[C@@H](F)[C@H](O)C2)cc1	ZINC001137899637	1377641108	/nfs/dbraw/zinc/64/11/08/1377641108.db2.gz	BDDYOFSXLMJCDI-WOJBJXKFSA-N	0	3	339.414	3.231	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC(CCN(C)Cc2cccc(F)c2F)CC1	ZINC001271766620	1377651426	/nfs/dbraw/zinc/65/14/26/1377651426.db2.gz	SJTFNDVDKPHLMW-AWEZNQCLSA-N	0	3	349.425	3.185	20	30		EGEDHN
O=C1C=C2CN(Cc3ccc(N4CCCCC4)cc3)CCC2S1	ZINC001138216938	1377690434	/nfs/dbraw/zinc/69/04/34/1377690434.db2.gz	PZLLDVXSEWKRNF-SFHVURJKSA-N	0	3	328.481	3.451	20	30		EGEDHN
O=C1C=C2CN(Cc3ccc(N4CCCCC4)cc3)CC[C@@H]2S1	ZINC001138216938	1377690436	/nfs/dbraw/zinc/69/04/36/1377690436.db2.gz	PZLLDVXSEWKRNF-SFHVURJKSA-N	0	3	328.481	3.451	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@@H](C(=O)N3CCCCC3)C2)c1[O-]	ZINC001138628837	1377756718	/nfs/dbraw/zinc/75/67/18/1377756718.db2.gz	GWDSYJTXJBAFPY-LJQANCHMSA-N	0	3	342.483	3.345	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@@H](C(=O)N3CCCCC3)C2)c1[O-]	ZINC001138628837	1377756720	/nfs/dbraw/zinc/75/67/20/1377756720.db2.gz	GWDSYJTXJBAFPY-LJQANCHMSA-N	0	3	342.483	3.345	20	30		EGEDHN
C=C(C)COc1ccccc1CN1CCC2(CCNC(=O)O2)CC1	ZINC001138666006	1377765291	/nfs/dbraw/zinc/76/52/91/1377765291.db2.gz	FGZBDFSAEMKEKG-UHFFFAOYSA-N	0	3	330.428	3.106	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3cc(F)ccc3Cl)C2)C1=O	ZINC001138673755	1377765456	/nfs/dbraw/zinc/76/54/56/1377765456.db2.gz	SCEBEINTVSCGED-GOSISDBHSA-N	0	3	336.838	3.480	20	30		EGEDHN
CCOc1ccc(CN2CCC3SC(=O)C=C3C2)cc1OCC	ZINC001138972694	1377811166	/nfs/dbraw/zinc/81/11/66/1377811166.db2.gz	WYFLBTVPOJEIQR-KRWDZBQOSA-N	0	3	333.453	3.258	20	30		EGEDHN
C=CCOc1ccccc1CN1CC2(C1)CCN(Cc1cccnc1)C2	ZINC001139027824	1377819440	/nfs/dbraw/zinc/81/94/40/1377819440.db2.gz	DBOWVOWWIYGWRT-UHFFFAOYSA-N	0	3	349.478	3.354	20	30		EGEDHN
Cc1ccc(CN2CCC3(C[C@H](c4cncnc4)CO3)CC2)cc1C#N	ZINC001139724776	1377941313	/nfs/dbraw/zinc/94/13/13/1377941313.db2.gz	PKKCJVQNATUUBT-IBGZPJMESA-N	0	3	348.450	3.195	20	30		EGEDHN
Cc1ccc(CN2CCC3(CC2)C(=O)N[C@@H]3c2ccccc2)cc1C#N	ZINC001139724475	1377941648	/nfs/dbraw/zinc/94/16/48/1377941648.db2.gz	SRNRJUNWVGNWRD-HXUWFJFHSA-N	0	3	345.446	3.320	20	30		EGEDHN
Cc1ccc(CN2CCC3(CCC(=O)N3CC3CC3)CC2)cc1C#N	ZINC001139725433	1377941900	/nfs/dbraw/zinc/94/19/00/1377941900.db2.gz	PAHYELZHEBYDPS-UHFFFAOYSA-N	0	3	337.467	3.234	20	30		EGEDHN
Cn1ncc2cc(CN3CCC[C@H](Oc4ccc(C#N)cc4)C3)ccc21	ZINC001139953299	1377982279	/nfs/dbraw/zinc/98/22/79/1377982279.db2.gz	KTTYTJRBWUBZHW-FQEVSTJZSA-N	0	3	346.434	3.488	20	30		EGEDHN
C=CCO[C@H]1CO[C@]2(C1)CCCN(Cc1c[nH]c3cccc(O)c13)C2	ZINC001140233837	1378035108	/nfs/dbraw/zinc/03/51/08/1378035108.db2.gz	VQMDERJRRHLSDO-UZLBHIALSA-N	0	3	342.439	3.200	20	30		EGEDHN
COc1ccc(CN2CCC3SC(=O)C=C3C2)cc1OCC1CC1	ZINC001140488928	1378071295	/nfs/dbraw/zinc/07/12/95/1378071295.db2.gz	SZSPYWFWGKAWLZ-SFHVURJKSA-N	0	3	345.464	3.258	20	30		EGEDHN
CCCc1nc(CNC[C@H]2CC[C@H](NC(=O)[C@H](C)C#N)CC2)cs1	ZINC001272720332	1378080977	/nfs/dbraw/zinc/08/09/77/1378080977.db2.gz	GFGREMZPQOZPHC-RBSFLKMASA-N	0	3	348.516	3.020	20	30		EGEDHN
N#Cc1ccc(CN2CCc3ncnc(-c4ccsc4)c3CC2)cn1	ZINC001140541695	1378081789	/nfs/dbraw/zinc/08/17/89/1378081789.db2.gz	QNHYISCCNKBKLP-UHFFFAOYSA-N	0	3	347.447	3.073	20	30		EGEDHN
Cc1cccc(C)c1CN1CCC2(CCN(CCCC#N)C2=O)CC1	ZINC001273265922	1378093791	/nfs/dbraw/zinc/09/37/91/1378093791.db2.gz	MXWVLPVDBMBPRT-UHFFFAOYSA-N	0	3	339.483	3.422	20	30		EGEDHN
Cc1ccc(F)c(CN2CC[C@]3(CCN(CCCC#N)C3=O)C2)c1F	ZINC001273304053	1378096094	/nfs/dbraw/zinc/09/60/94/1378096094.db2.gz	RLHLMBXHNNYLIF-IBGZPJMESA-N	0	3	347.409	3.001	20	30		EGEDHN
Cn1cnc2ccc(CN3CCC[C@H](Oc4cccc(C#N)c4)C3)cc21	ZINC001140739022	1378128021	/nfs/dbraw/zinc/12/80/21/1378128021.db2.gz	ZPTHRDYQYHAYOT-IBGZPJMESA-N	0	3	346.434	3.488	20	30		EGEDHN
C=CCN1CCC2(CCN(Cc3ccc(C#N)c(Cl)c3)CC2)C1=O	ZINC001274492256	1378128241	/nfs/dbraw/zinc/12/82/41/1378128241.db2.gz	JHAUTMRDPNRXDO-UHFFFAOYSA-N	0	3	343.858	3.212	20	30		EGEDHN
COc1ccc(CN2CCC[C@H](Oc3ccccc3C#N)C2)cc1N	ZINC001140898263	1378174156	/nfs/dbraw/zinc/17/41/56/1378174156.db2.gz	DZBMXZYEKKKMCA-KRWDZBQOSA-N	0	3	337.423	3.192	20	30		EGEDHN
COC(=O)[C@H]1CCN(Cc2ccc(Oc3ccc(C#N)cc3)cc2)C1	ZINC001141289131	1378291678	/nfs/dbraw/zinc/29/16/78/1378291678.db2.gz	BHVFEVWYMHUSBN-KRWDZBQOSA-N	0	3	336.391	3.345	20	30		EGEDHN
COc1cc(C(F)(F)F)ccc1CN1CCC2SC(=O)C=C2C1	ZINC001141604532	1378349907	/nfs/dbraw/zinc/34/99/07/1378349907.db2.gz	GSPLRASEOYMDAC-CQSZACIVSA-N	0	3	343.370	3.488	20	30		EGEDHN
Cc1cc(O[C@H]2CCCN(Cc3c[nH]c4cc(C#N)ccc34)C2)ncn1	ZINC001142931630	1378511449	/nfs/dbraw/zinc/51/14/49/1378511449.db2.gz	SOIFQIPXDZLNNL-KRWDZBQOSA-N	0	3	347.422	3.181	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCCN(Cc3cccn4ccnc34)C2)cc1	ZINC001142963114	1378518056	/nfs/dbraw/zinc/51/80/56/1378518056.db2.gz	MDAJKPLMNHEYCF-IBGZPJMESA-N	0	3	332.407	3.249	20	30		EGEDHN
COc1ccc(Cl)c(CN2CCC3SC(=O)C=C3C2)c1F	ZINC001143892322	1378657463	/nfs/dbraw/zinc/65/74/63/1378657463.db2.gz	WIPKMQBUVWZWRZ-ZDUSSCGKSA-N	0	3	327.808	3.262	20	30		EGEDHN
C#Cc1ccc(CN2CC[C@H]3[C@@H]2CCN3C(=O)OC(C)(C)C)cc1	ZINC001144568057	1378745712	/nfs/dbraw/zinc/74/57/12/1378745712.db2.gz	JKUJCUDQDBLQCO-ROUUACIJSA-N	0	3	326.440	3.252	20	30		EGEDHN
C#Cc1ccc(CN2CCC3(CC2)C(=O)NC[C@H]3c2ccccc2)cc1	ZINC001144572025	1378747006	/nfs/dbraw/zinc/74/70/06/1378747006.db2.gz	NBYGFAWTPKEOLO-NRFANRHFSA-N	0	3	344.458	3.164	20	30		EGEDHN
C[C@@H](C(=O)NCCNCc1cccc(C#N)c1)c1cc2ccccc2o1	ZINC001147196433	1378985384	/nfs/dbraw/zinc/98/53/84/1378985384.db2.gz	XYFQVMYBFGIBDF-OAHLLOKOSA-N	0	3	347.418	3.314	20	30		EGEDHN
C=C(C)CCC(=O)N1CC2(C1)CCN(CCOc1ccc(C)cc1)C2	ZINC001147657934	1379056461	/nfs/dbraw/zinc/05/64/61/1379056461.db2.gz	IIRQJHXEXPFRTI-UHFFFAOYSA-N	0	3	342.483	3.264	20	30		EGEDHN
C[C@@H](CCC(C)(C)C)C(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001147786451	1379078537	/nfs/dbraw/zinc/07/85/37/1379078537.db2.gz	DVSUNWZSSCZXGK-AWEZNQCLSA-N	0	3	333.451	3.366	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001148129566	1379122274	/nfs/dbraw/zinc/12/22/74/1379122274.db2.gz	GLQKXEUXCGJEMY-QGZVFWFLSA-N	0	3	337.467	3.195	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC2(C1)CCN(Cc1cccnc1C)C2	ZINC001148146484	1379124726	/nfs/dbraw/zinc/12/47/26/1379124726.db2.gz	DTDSDFKRKWITHC-INIZCTEOSA-N	0	3	327.472	3.027	20	30		EGEDHN
C=CCCCC(=O)N1CC2(C1)CCN(Cc1ccc3c(c1)COC3)C2	ZINC001148193621	1379131382	/nfs/dbraw/zinc/13/13/82/1379131382.db2.gz	APSLXUMPBQTCSK-UHFFFAOYSA-N	0	3	340.467	3.107	20	30		EGEDHN
C=CCC1(C(=O)N2CC3(C2)CCN(Cc2cccnc2C)C3)CCC1	ZINC001148226308	1379136064	/nfs/dbraw/zinc/13/60/64/1379136064.db2.gz	BTRIFBSUKYGWCH-UHFFFAOYSA-N	0	3	339.483	3.171	20	30		EGEDHN
CCC[C@H](CC)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001148507913	1379197198	/nfs/dbraw/zinc/19/71/98/1379197198.db2.gz	UQRSGGAWZBZZKQ-IBGZPJMESA-N	0	3	339.483	3.419	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)C23CC4CC(CC(C4)C2)C3)s1	ZINC001148814260	1379273873	/nfs/dbraw/zinc/27/38/73/1379273873.db2.gz	CNIZKNUUIGRUMN-UHFFFAOYSA-N	0	3	343.496	3.042	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H]1CN(Cc2ccc(C)cc2)CCCO1	ZINC001149788361	1379447031	/nfs/dbraw/zinc/44/70/31/1379447031.db2.gz	GJDUVQWZZZNUOZ-LJQANCHMSA-N	0	3	330.472	3.058	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H]1CN([C@@H](C)c2ccccc2)CCCO1	ZINC001150084762	1379492032	/nfs/dbraw/zinc/49/20/32/1379492032.db2.gz	GYJMSVQOWARYQM-FUHWJXTLSA-N	0	3	330.472	3.167	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@H]1CN(Cc2ccc(C)cc2C)CCCO1	ZINC001150085573	1379492145	/nfs/dbraw/zinc/49/21/45/1379492145.db2.gz	QNOAIZRMWOBKMW-IBGZPJMESA-N	0	3	344.499	3.223	20	30		EGEDHN
C=CCCCC(=O)NC[C@H]1CN(Cc2cc(C)cc(C)c2)CCCO1	ZINC001150212239	1379516476	/nfs/dbraw/zinc/51/64/76/1379516476.db2.gz	PQTSUXINPIKDOM-FQEVSTJZSA-N	0	3	344.499	3.367	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)CC/C=C/c2ccccc2)C1	ZINC001150318700	1379533588	/nfs/dbraw/zinc/53/35/88/1379533588.db2.gz	UDQOWMFJQYMFDW-HSSRVXSRSA-N	0	3	342.483	3.263	20	30		EGEDHN
C=CC1(CC(=O)NC[C@H]2CN(CC(=C)C)CCCO2)CCCCC1	ZINC001150436475	1379552432	/nfs/dbraw/zinc/55/24/32/1379552432.db2.gz	SJCIBCMXGDTHOB-SFHVURJKSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)C[C@@H](C)c2ccccc2F)C1	ZINC001150445200	1379553834	/nfs/dbraw/zinc/55/38/34/1379553834.db2.gz	SYMJUFYNALGDAD-IAGOWNOFSA-N	0	3	348.462	3.103	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)C[C@@H](CC)c2ccccc2)C1	ZINC001150579132	1379572529	/nfs/dbraw/zinc/57/25/29/1379572529.db2.gz	KMKDSHYHDYOTHN-UYAOXDASSA-N	0	3	344.499	3.354	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)C2C(C)(C)C2(C)C)CC1	ZINC001151047901	1379654201	/nfs/dbraw/zinc/65/42/01/1379654201.db2.gz	ZENHFXRVELGWMX-UHFFFAOYSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@@H]2CCC[C@H](F)C2)CC1	ZINC001151128015	1379663799	/nfs/dbraw/zinc/66/37/99/1379663799.db2.gz	DGTOFCIFNVWWIQ-SJORKVTESA-N	0	3	340.483	3.078	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2ccc([C@@H]3C[C@H]3C)o2)CC1	ZINC001151128610	1379665081	/nfs/dbraw/zinc/66/50/81/1379665081.db2.gz	QGKMTBUEGSOXDE-HZPDHXFCSA-N	0	3	346.471	3.190	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@@H]2CCC=CCCC2)CC1	ZINC001151180140	1379673414	/nfs/dbraw/zinc/67/34/14/1379673414.db2.gz	FTNXXKBDODEBCL-GOSISDBHSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)C[C@@H]2CC[C@@H](C)C2)CC1	ZINC001151248160	1379687139	/nfs/dbraw/zinc/68/71/39/1379687139.db2.gz	JFVPFGMCKAXCPX-QZTJIDSGSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)CC2CC(C)(C)C2)CC1	ZINC001151266832	1379691313	/nfs/dbraw/zinc/69/13/13/1379691313.db2.gz	YXAKSPOFZQFCJN-UHFFFAOYSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@@H]2C[C@@]2(CC)C(C)C)CC1	ZINC001151381334	1379708693	/nfs/dbraw/zinc/70/86/93/1379708693.db2.gz	NNJKBABXHNLBDZ-PXNSSMCTSA-N	0	3	336.520	3.232	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)c1cccs1	ZINC001151662782	1379760153	/nfs/dbraw/zinc/76/01/53/1379760153.db2.gz	BECYEEHCLZPCKD-CQSZACIVSA-N	0	3	327.453	3.260	20	30		EGEDHN
C=CC[C@H](C(=O)NCCNCc1ccc(C#N)s1)c1ccccc1	ZINC001151838080	1379793409	/nfs/dbraw/zinc/79/34/09/1379793409.db2.gz	HYZLXRYMOMONDH-SFHVURJKSA-N	0	3	339.464	3.185	20	30		EGEDHN
CCCCC(=O)NC[C@@H](C)N(CC)Cc1ccc(OC)c(C#N)c1	ZINC001151921379	1379815819	/nfs/dbraw/zinc/81/58/19/1379815819.db2.gz	HMGAQYFHOXCPLT-OAHLLOKOSA-N	0	3	331.460	3.084	20	30		EGEDHN
CCC1(C(=O)NCCNCc2ccc(C#N)c(F)c2)CCCCC1	ZINC001152054164	1379852500	/nfs/dbraw/zinc/85/25/00/1379852500.db2.gz	SKNHWGCMUXZHAY-UHFFFAOYSA-N	0	3	331.435	3.264	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)[C@H](C)C1CC1	ZINC001152636334	1379960172	/nfs/dbraw/zinc/96/01/72/1379960172.db2.gz	IWDFCEKVQNJNCI-ZIAGYGMSSA-N	0	3	331.435	3.070	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)[C@H]1[C@@H]2CCC[C@@H]21	ZINC001152682034	1379969607	/nfs/dbraw/zinc/96/96/07/1379969607.db2.gz	LDKWIJNSVWYMLY-WKCGWZECSA-N	0	3	343.446	3.070	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)C1=CCCC1	ZINC001152734101	1379977192	/nfs/dbraw/zinc/97/71/92/1379977192.db2.gz	MMODDNGVDOBCAT-CQSZACIVSA-N	0	3	329.419	3.134	20	30		EGEDHN
CC[C@@H](C(=O)NCCNCc1cccc(C#N)c1)c1ccc(F)cc1	ZINC001152795946	1379982007	/nfs/dbraw/zinc/98/20/07/1379982007.db2.gz	FJHHBYWRQRPJGS-LJQANCHMSA-N	0	3	339.414	3.097	20	30		EGEDHN
CC1(C)CCC[C@H](C(=O)NCCNCc2ccc(F)c(C#N)c2)C1	ZINC001152832243	1379985417	/nfs/dbraw/zinc/98/54/17/1379985417.db2.gz	XXVHVCCWDJZDOK-HNNXBMFYSA-N	0	3	331.435	3.120	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H](C)N(CC)Cc1cccc(OC)c1	ZINC001152867504	1379988297	/nfs/dbraw/zinc/98/82/97/1379988297.db2.gz	ZJTALGHAFJUEFZ-QGZVFWFLSA-N	0	3	330.472	3.215	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H](C)N(CC)Cc1cccc(NC(C)=O)c1	ZINC001153642324	1380109216	/nfs/dbraw/zinc/10/92/16/1380109216.db2.gz	XPTFFJNKMQWMQA-MRXNPFEDSA-N	0	3	345.487	3.328	20	30		EGEDHN
Cc1oc2ccccc2c1CC(=O)NCCNCc1cccc(C#N)c1	ZINC001153897533	1380151839	/nfs/dbraw/zinc/15/18/39/1380151839.db2.gz	HPJRUUHOWLRRMS-UHFFFAOYSA-N	0	3	347.418	3.061	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)[C@@H](C)C1CCC1	ZINC001153985566	1380169281	/nfs/dbraw/zinc/16/92/81/1380169281.db2.gz	FPLCREZCXDYIHG-CVEARBPZSA-N	0	3	327.472	3.321	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1cc2c([nH]1)c(F)ccc2C	ZINC001154096071	1380206695	/nfs/dbraw/zinc/20/66/95/1380206695.db2.gz	MLHXXHRBQAHPLT-CQSZACIVSA-N	0	3	329.419	3.079	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)CC1(C)CC1	ZINC001154373359	1380266586	/nfs/dbraw/zinc/26/65/86/1380266586.db2.gz	FMVOUTKJNRLGQO-CQSZACIVSA-N	0	3	331.435	3.214	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H](C)N(CC)Cc2ccc(C#N)cc2)cc1	ZINC001154573755	1380307928	/nfs/dbraw/zinc/30/79/28/1380307928.db2.gz	FZHMKTZXCBOPEV-QGZVFWFLSA-N	0	3	345.446	3.180	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H](C)N(CC)Cc1ccc(F)c(C#N)c1	ZINC001154620548	1380319412	/nfs/dbraw/zinc/31/94/12/1380319412.db2.gz	LNYQNAHMZXLBCI-CQSZACIVSA-N	0	3	331.435	3.236	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)C1(C)CCC1	ZINC001154632636	1380321520	/nfs/dbraw/zinc/32/15/20/1380321520.db2.gz	ZUFZQICWUSXRFA-CQSZACIVSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@@H](C)N(CC)C[C@@H](O)c1ccccc1	ZINC001154743280	1380344414	/nfs/dbraw/zinc/34/44/14/1380344414.db2.gz	YAPYOVQSHFWALL-YQVWRLOYSA-N	0	3	332.488	3.149	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)C(C)(C)C1CC1	ZINC001154768702	1380347950	/nfs/dbraw/zinc/34/79/50/1380347950.db2.gz	WFBRIFIHGNDXSU-OAHLLOKOSA-N	0	3	327.472	3.321	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@@H](C)N(CC)C[C@@H](O)c1ccccc1	ZINC001155072385	1380402854	/nfs/dbraw/zinc/40/28/54/1380402854.db2.gz	BFDBGKIHVGFGLH-POAQFYNOSA-N	0	3	332.488	3.149	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)NC[C@@H](C)N(CC)C/C=C\c1ccccc1	ZINC001155321319	1380436868	/nfs/dbraw/zinc/43/68/68/1380436868.db2.gz	MHLKZYHPTYSEHV-SPNJVZHBSA-N	0	3	342.483	3.118	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NCCCNCc1c(F)cccc1Cl	ZINC001155428251	1380451551	/nfs/dbraw/zinc/45/15/51/1380451551.db2.gz	YRTXXTLVNKYPCS-ZDUSSCGKSA-N	0	3	342.842	3.056	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@@H](C)N(CC)CCc1csc(C)n1	ZINC001155489670	1380459489	/nfs/dbraw/zinc/45/94/89/1380459489.db2.gz	IMJHOIXHVYWEGE-CQSZACIVSA-N	0	3	337.533	3.423	20	30		EGEDHN
N#CCc1ccc(OCc2ccc(N[C@H]3CN4CCC3CC4)nc2)cc1	ZINC001155667245	1380480734	/nfs/dbraw/zinc/48/07/34/1380480734.db2.gz	GRWGRRVFRZQMSR-FQEVSTJZSA-N	0	3	348.450	3.233	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@@H](C)c1ccc(Cl)s1	ZINC001156248383	1380548320	/nfs/dbraw/zinc/54/83/20/1380548320.db2.gz	RNVHBEAHHCRNSV-OLZOCXBDSA-N	0	3	326.893	3.355	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@@H](CC)Cc1ccccc1C	ZINC001156390499	1380569757	/nfs/dbraw/zinc/56/97/57/1380569757.db2.gz	PLSLQTQPMGFNSR-MOPGFXCFSA-N	0	3	328.500	3.414	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NC[C@@H](C)N(CC)Cc1ccsc1	ZINC001156613602	1380599995	/nfs/dbraw/zinc/59/99/95/1380599995.db2.gz	XYYPYVDXQMJKPQ-MRXNPFEDSA-N	0	3	340.492	3.299	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1cc2c(s1)CC[C@@H](C)C2	ZINC001156858248	1380702838	/nfs/dbraw/zinc/70/28/38/1380702838.db2.gz	OHVZPYMDDVXKLQ-HUUCEWRRSA-N	0	3	332.513	3.336	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)C[C@H](C)C1CC1	ZINC001157146252	1380786350	/nfs/dbraw/zinc/78/63/50/1380786350.db2.gz	TYQAUMQIALXWKV-JKSUJKDBSA-N	0	3	327.472	3.321	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NC[C@@H](C)N(CC)Cc1ccc(C)c(F)c1	ZINC001157217406	1380813832	/nfs/dbraw/zinc/81/38/32/1380813832.db2.gz	PQRJMHHJQJKCNK-HZPDHXFCSA-N	0	3	336.451	3.052	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C[C@@H](C)CCc1ccccc1	ZINC001157229322	1380818621	/nfs/dbraw/zinc/81/86/21/1380818621.db2.gz	RWPLGKLYUXBOTR-RBUKOAKNSA-N	0	3	328.500	3.495	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)C[C@H](C)Cc1cccc(F)c1	ZINC001158046146	1381111142	/nfs/dbraw/zinc/11/11/42/1381111142.db2.gz	OXBBTDRJCYJMJV-CYBMUJFWSA-N	0	3	326.843	3.243	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1nccc2ccsc21	ZINC001158090274	1381125511	/nfs/dbraw/zinc/12/55/11/1381125511.db2.gz	RRONLWKZUKYOHI-OAHLLOKOSA-N	0	3	329.469	3.409	20	30		EGEDHN
CC(C)(C)C[C@@H]1C[C@H]1C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001158390068	1381228694	/nfs/dbraw/zinc/22/86/94/1381228694.db2.gz	PSMDMBHBGUHIRV-DLBZAZTESA-N	0	3	345.462	3.366	20	30		EGEDHN
C=C1CCC(C(=O)N2CCCC[C@@H]2CN(C)CCOCC2CC2)CC1	ZINC001158435155	1381245061	/nfs/dbraw/zinc/24/50/61/1381245061.db2.gz	UAOCRGQSVFAHSM-HXUWFJFHSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc(F)c(COC)c1	ZINC001158480436	1381260790	/nfs/dbraw/zinc/26/07/90/1381260790.db2.gz	MAARDBFOAKXICQ-QGZVFWFLSA-N	0	3	334.435	3.085	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc(F)cc2cccnc21	ZINC001158549820	1381293935	/nfs/dbraw/zinc/29/39/35/1381293935.db2.gz	LHQKRNSYWLTWEN-QGZVFWFLSA-N	0	3	341.430	3.486	20	30		EGEDHN
C=C(Cl)CNCCCN(Cc1ccccc1)C(=O)C(C)(C)F	ZINC001755537399	1440870016	/nfs/dbraw/zinc/87/00/16/1440870016.db2.gz	PGYZLXMTKLIQQW-UHFFFAOYSA-N	0	3	326.843	3.496	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc2ccn(C)c2c1	ZINC001158704318	1381360631	/nfs/dbraw/zinc/36/06/31/1381360631.db2.gz	JJEVAMIMNDWWFP-GOSISDBHSA-N	0	3	325.456	3.291	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc(OC)c(OC)cc1C	ZINC001158900558	1381454824	/nfs/dbraw/zinc/45/48/24/1381454824.db2.gz	GYZABFDIVQGRKW-MRXNPFEDSA-N	0	3	346.471	3.125	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1ccc(F)s1	ZINC001158942236	1381475612	/nfs/dbraw/zinc/47/56/12/1381475612.db2.gz	DWXJXTRUGDJVGU-CQSZACIVSA-N	0	3	340.464	3.016	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc(NC(C)=O)ccc1C	ZINC001158962382	1381487879	/nfs/dbraw/zinc/48/78/79/1381487879.db2.gz	PNMYUALPFULFAB-GOSISDBHSA-N	0	3	343.471	3.066	20	30		EGEDHN
C=CCCC(=O)NCCC1=CCN(CCOc2ccccc2C)CC1	ZINC001159544623	1381823604	/nfs/dbraw/zinc/82/36/04/1381823604.db2.gz	VQCDFQLUOLGVKW-UHFFFAOYSA-N	0	3	342.483	3.478	20	30		EGEDHN
C=CCOCC(=O)NCCC1=CCN([C@@H](C)c2ccc(F)cc2)CC1	ZINC001159619003	1381850887	/nfs/dbraw/zinc/85/08/87/1381850887.db2.gz	ROSDKSRIYQDFJH-INIZCTEOSA-N	0	3	346.446	3.228	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)C1(Cc2ccccc2)CC1	ZINC001160128923	1382006732	/nfs/dbraw/zinc/00/67/32/1382006732.db2.gz	JQPBYUKHDQWQGV-UHFFFAOYSA-N	0	3	347.462	3.177	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C[C@H](OCC)C2=CCCC2)CC1	ZINC001160131473	1382008164	/nfs/dbraw/zinc/00/81/64/1382008164.db2.gz	NBGQBKRFJYNFRH-FQEVSTJZSA-N	0	3	344.499	3.054	20	30		EGEDHN
Cc1cc(C(F)F)oc1C(=O)NCCCNCc1ccccc1C#N	ZINC001160351584	1382081268	/nfs/dbraw/zinc/08/12/68/1382081268.db2.gz	XJRMERKVFXJWEM-UHFFFAOYSA-N	0	3	347.365	3.307	20	30		EGEDHN
N#C[C@@H]1CCCN(C(=O)C[C@@H](N)c2ccc(Cl)cc2Cl)C1	ZINC001160642451	1382159405	/nfs/dbraw/zinc/15/94/05/1382159405.db2.gz	IROBAYDJSFRJCA-IINYFYTJSA-N	0	3	326.227	3.145	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H](C)OCc2cccc(C)c2)CC1	ZINC001160792827	1382196881	/nfs/dbraw/zinc/19/68/81/1382196881.db2.gz	LXXGDNNSZYINNC-GOSISDBHSA-N	0	3	342.483	3.225	20	30		EGEDHN
Cc1cocc1C(=O)NCCC1=CCN(Cc2ccc(C#N)cc2)CC1	ZINC001160904136	1382229386	/nfs/dbraw/zinc/22/93/86/1382229386.db2.gz	OQERYUWFKHRXCL-UHFFFAOYSA-N	0	3	349.434	3.412	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCC1=CCN(CCOCC2CC2)CC1	ZINC001160941215	1382245107	/nfs/dbraw/zinc/24/51/07/1382245107.db2.gz	LNZMXNNYYISTNA-SJORKVTESA-N	0	3	334.504	3.010	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@]1(C)CCC[C@H]1CC	ZINC001160980054	1382260369	/nfs/dbraw/zinc/26/03/69/1382260369.db2.gz	YCZHPHVVWMGNIA-UKRRQHHQSA-N	0	3	331.298	3.207	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc3c(c2)[C@@H](C)CO3)CC1	ZINC001161008174	1382269869	/nfs/dbraw/zinc/26/98/69/1382269869.db2.gz	JAMSXRMEEKJRCI-HNNXBMFYSA-N	0	3	326.440	3.121	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)N1CCC[C@H]1CC(=O)OC(C)(C)C	ZINC001161009633	1382271416	/nfs/dbraw/zinc/27/14/16/1382271416.db2.gz	GTDMOUKGYNVVET-HOTGVXAUSA-N	0	3	338.492	3.173	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)N(C)Cc1ccc(-n2ccnc2)cc1	ZINC001161030503	1382277694	/nfs/dbraw/zinc/27/76/94/1382277694.db2.gz	AEXXEVVYXXNOBB-IBGZPJMESA-N	0	3	340.471	3.295	20	30		EGEDHN
Cc1nc(NC2CCN(Cc3ccc(O)cc3)CC2)ccc1CC#N	ZINC001161136843	1382314415	/nfs/dbraw/zinc/31/44/15/1382314415.db2.gz	KVXVKIPRBATYPI-UHFFFAOYSA-N	0	3	336.439	3.238	20	30		EGEDHN
N#Cc1cc2nc(NC3CCN(Cc4ccc(O)cc4)CC3)ccc2[nH]1	ZINC001161136562	1382314993	/nfs/dbraw/zinc/31/49/93/1382314993.db2.gz	HAUFEYUROHQBNI-UHFFFAOYSA-N	0	3	347.422	3.217	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)N1CCC(c2ccc(N)cc2)CC1	ZINC001161192412	1382335096	/nfs/dbraw/zinc/33/50/96/1382335096.db2.gz	UFMOADCEJXOBCI-IBGZPJMESA-N	0	3	329.488	3.439	20	30		EGEDHN
CCC[C@H]1CCC[C@H]1C(=O)NCCCNCc1ccccc1C#N	ZINC001161428037	1382407549	/nfs/dbraw/zinc/40/75/49/1382407549.db2.gz	QIWFKPDPEZHZQS-QFBILLFUSA-N	0	3	327.472	3.371	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc(CCCCC)n[nH]2)CC1	ZINC001161446462	1382414038	/nfs/dbraw/zinc/41/40/38/1382414038.db2.gz	ZWCIKQGSIOIKSW-UHFFFAOYSA-N	0	3	330.476	3.080	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2coc(C3CCCC3)n2)CC1	ZINC001161598665	1382451901	/nfs/dbraw/zinc/45/19/01/1382451901.db2.gz	PHORIBXDXWOHKL-UHFFFAOYSA-N	0	3	329.444	3.270	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)COc2ccc(C)c(C)c2)CC1	ZINC001161856651	1382532745	/nfs/dbraw/zinc/53/27/45/1382532745.db2.gz	CATJPGRTQYYRNS-UHFFFAOYSA-N	0	3	328.456	3.007	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CCOc2ccccc2C)CC1	ZINC001161857223	1382533040	/nfs/dbraw/zinc/53/30/40/1382533040.db2.gz	NDTUFQJTMLETQB-UHFFFAOYSA-N	0	3	328.456	3.088	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cccc3cnccc32)CC1	ZINC001161874693	1382536183	/nfs/dbraw/zinc/53/61/83/1382536183.db2.gz	JGMPMFBWCAFOSM-UHFFFAOYSA-N	0	3	333.435	3.010	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc(N(C)CCC)cc2)CC1	ZINC001162002077	1382595825	/nfs/dbraw/zinc/59/58/25/1382595825.db2.gz	CIFRYRPPSQVGAP-UHFFFAOYSA-N	0	3	341.499	3.471	20	30		EGEDHN
CC(C)=C[C@H]1[C@@H](C(=O)NCCCNCc2ccccc2C#N)C1(C)C	ZINC001162157132	1382643490	/nfs/dbraw/zinc/64/34/90/1382643490.db2.gz	ROWVVIPKZNTMDI-OALUTQOASA-N	0	3	339.483	3.393	20	30		EGEDHN
C#CCN1CCC(CNC(=O)CCCCC(C)(C)C)(COC)CC1	ZINC001162288381	1382722294	/nfs/dbraw/zinc/72/22/94/1382722294.db2.gz	NHNJWKJLFIKNIK-UHFFFAOYSA-N	0	3	336.520	3.071	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@]2(C)CCC[C@@H]2CC)(COC)CC1	ZINC001162327052	1382731107	/nfs/dbraw/zinc/73/11/07/1382731107.db2.gz	OFKYUIKZDNKQRW-AZUAARDMSA-N	0	3	348.531	3.071	20	30		EGEDHN
CCC(=O)N(CCNCc1ccc(C#N)cc1)CCc1ccccc1	ZINC001162651292	1382821180	/nfs/dbraw/zinc/82/11/80/1382821180.db2.gz	KUVGAMFBHMPIJU-UHFFFAOYSA-N	0	3	335.451	3.129	20	30		EGEDHN
CC(C)C(=O)N(CCNCc1cccc(C#N)c1)CCc1ccccc1	ZINC001162707199	1382842068	/nfs/dbraw/zinc/84/20/68/1382842068.db2.gz	MOVQYAVWIZQGNO-UHFFFAOYSA-N	0	3	349.478	3.375	20	30		EGEDHN
C[C@@H](N)c1nc2ccccc2n1-c1ncc(C(F)(F)F)cc1C#N	ZINC001162760303	1382861915	/nfs/dbraw/zinc/86/19/15/1382861915.db2.gz	YJNRWESQLCEKLU-SECBINFHSA-N	0	3	331.301	3.331	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)c1cc(C)cs1	ZINC001162803008	1382877888	/nfs/dbraw/zinc/87/78/88/1382877888.db2.gz	RTMNNFPPJLOYDX-UHFFFAOYSA-N	0	3	340.492	3.354	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@](C)(F)CCCC	ZINC001162847751	1382893529	/nfs/dbraw/zinc/89/35/29/1382893529.db2.gz	BBDCJUCIONMQEA-HXUWFJFHSA-N	0	3	332.463	3.199	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CCC[C@H]2C[C@H]21	ZINC001162847825	1382893533	/nfs/dbraw/zinc/89/35/33/1382893533.db2.gz	CVWVOYPRUNILRS-PWRODBHTSA-N	0	3	338.495	3.107	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CC[C@H]2C[C@H]2C1	ZINC001162852065	1382895582	/nfs/dbraw/zinc/89/55/82/1382895582.db2.gz	YZFDIDYQRCROCZ-HBMCJLEFSA-N	0	3	338.495	3.107	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1c(C)oc(C)c1C	ZINC001162856676	1382895867	/nfs/dbraw/zinc/89/58/67/1382895867.db2.gz	LVUXETWUWZKLGS-UHFFFAOYSA-N	0	3	338.451	3.113	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@]12C[C@@H]1CCCC2	ZINC001162924122	1382917835	/nfs/dbraw/zinc/91/78/35/1382917835.db2.gz	IDMFQJHWMROBRQ-UNMCSNQZSA-N	0	3	338.495	3.251	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CC[C@@H](C)C1	ZINC001162952495	1382925840	/nfs/dbraw/zinc/92/58/40/1382925840.db2.gz	RBBRAOOJRJOPAN-QUCCMNQESA-N	0	3	326.484	3.107	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1cc2ccccc2o1	ZINC001162992543	1382940538	/nfs/dbraw/zinc/94/05/38/1382940538.db2.gz	RZQLJZXDLLHLKJ-UHFFFAOYSA-N	0	3	346.430	3.341	20	30		EGEDHN
CN1CCC(Oc2ccnc(NC3(C#N)Cc4ccccc4C3)c2)CC1	ZINC001163009737	1382947644	/nfs/dbraw/zinc/94/76/44/1382947644.db2.gz	RVLCXIYNZLYABF-UHFFFAOYSA-N	0	3	348.450	3.028	20	30		EGEDHN
C=CC(C)(C)C(=O)NCc1ccc(CN2CCN(C(C)C)CC2)cc1	ZINC001163024267	1382950380	/nfs/dbraw/zinc/95/03/80/1382950380.db2.gz	HPRNCMMIWYEEMX-UHFFFAOYSA-N	0	3	343.515	3.041	20	30		EGEDHN
C=CCCN1CCN(Cc2ccc(CNC(=O)C(C)(C)C)cc2)CC1	ZINC001163030304	1382951846	/nfs/dbraw/zinc/95/18/46/1382951846.db2.gz	SAOLTOMMVOOJBG-UHFFFAOYSA-N	0	3	343.515	3.043	20	30		EGEDHN
COCCN(C)[C@@H](CNc1ccc(C#N)cn1)c1ccc(Cl)cc1	ZINC001163385171	1383037692	/nfs/dbraw/zinc/03/76/92/1383037692.db2.gz	IILRQJWPGYZFRL-KRWDZBQOSA-N	0	3	344.846	3.338	20	30		EGEDHN
Cc1cccc(CCC(=O)NCCCNCc2ccccc2C#N)c1	ZINC001163463852	1383056646	/nfs/dbraw/zinc/05/66/46/1383056646.db2.gz	FKTQKFTYDPTOCO-UHFFFAOYSA-N	0	3	335.451	3.095	20	30		EGEDHN
C#CCCCCC(=O)NCCC1(CNCc2cc(C3CC3)no2)CC1	ZINC001164178905	1383163429	/nfs/dbraw/zinc/16/34/29/1383163429.db2.gz	PCKZWUDGQUYZGF-UHFFFAOYSA-N	0	3	343.471	3.122	20	30		EGEDHN
C[C@@H]1CC[C@H](CC(=O)NCCCNCc2cc(C#N)ccc2F)C1	ZINC001164188064	1383164257	/nfs/dbraw/zinc/16/42/57/1383164257.db2.gz	RAYFFWGQUYXOAL-CABCVRRESA-N	0	3	331.435	3.120	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCCNCc1ccn(C2CCCC2)n1	ZINC001164221926	1383167610	/nfs/dbraw/zinc/16/76/10/1383167610.db2.gz	GTFRUCPYORPUIW-CVEARBPZSA-N	0	3	332.492	3.052	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCCNCc1cc(-c2ccccc2)no1	ZINC001164234384	1383169217	/nfs/dbraw/zinc/16/92/17/1383169217.db2.gz	WTZPYSCQDSTYQR-CVEARBPZSA-N	0	3	341.455	3.396	20	30		EGEDHN
CC/C(C)=C/C(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001164448159	1383187975	/nfs/dbraw/zinc/18/79/75/1383187975.db2.gz	RRJWQFRVSUZOKC-FOWTUZBSSA-N	0	3	325.456	3.291	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCC1(CNCc2c(C)noc2C)CC1	ZINC001164647754	1383213634	/nfs/dbraw/zinc/21/36/34/1383213634.db2.gz	ICNHJWUELYZNTO-UHFFFAOYSA-N	0	3	345.487	3.436	20	30		EGEDHN
Cc1ccc([C@@H](C#N)c2ccc(N3CCN(C(C)(C)C)CC3)nn2)cc1	ZINC001165089091	1383226333	/nfs/dbraw/zinc/22/63/33/1383226333.db2.gz	VRNRUGFYZZTNFZ-GOSISDBHSA-N	0	3	349.482	3.361	20	30		EGEDHN
Cc1ncc(C#N)c(N(C)[C@H]2CN(Cc3ccccc3)CC[C@H]2C)n1	ZINC001165180872	1383242412	/nfs/dbraw/zinc/24/24/12/1383242412.db2.gz	FSKYZFPHERRTSG-BEFAXECRSA-N	0	3	335.455	3.004	20	30		EGEDHN
N#Cc1cc(Cl)ncc1C(F)(F)N1CCN[C@@H](c2ccccc2)C1	ZINC001165195533	1383244757	/nfs/dbraw/zinc/24/47/57/1383244757.db2.gz	FRTWVZSOOKMCGZ-OAHLLOKOSA-N	0	3	348.784	3.302	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccnn2[C@H](C)CC)CC1	ZINC001165244383	1383256334	/nfs/dbraw/zinc/25/63/34/1383256334.db2.gz	DXZMUGWPYDGEKO-CQSZACIVSA-N	0	3	338.883	3.096	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccccc2COC)CC1	ZINC001165962511	1383371005	/nfs/dbraw/zinc/37/10/05/1383371005.db2.gz	NGNLPFCWCWUIMT-UHFFFAOYSA-N	0	3	336.863	3.075	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCC1(CNCC(=C)Br)CC1	ZINC001166545445	1383436396	/nfs/dbraw/zinc/43/63/96/1383436396.db2.gz	MZLCLJPDRNMQST-UHFFFAOYSA-N	0	3	343.309	3.373	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)[C@]2(C)C=CCC2)CC1	ZINC001166654713	1383454140	/nfs/dbraw/zinc/45/41/40/1383454140.db2.gz	IMCKSDRVCABXFA-OAHLLOKOSA-N	0	3	341.293	3.127	20	30		EGEDHN
CC#CCCCC(=O)NCCC1(CNCc2cccc(Cl)n2)CC1	ZINC001166704562	1383464177	/nfs/dbraw/zinc/46/41/77/1383464177.db2.gz	TYVDLMKOAOXNIC-UHFFFAOYSA-N	0	3	347.890	3.305	20	30		EGEDHN
COc1cc(CN(C)C)ccc1NC(=O)c1cc(C#N)ccc1F	ZINC001299105121	1383466836	/nfs/dbraw/zinc/46/68/36/1383466836.db2.gz	BHIRWCNPXUFFOH-UHFFFAOYSA-N	0	3	327.359	3.020	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)Cc2cc(F)ccc2F)CC1	ZINC001166876532	1383491855	/nfs/dbraw/zinc/49/18/55/1383491855.db2.gz	YGKRYEHRSRTPGF-UHFFFAOYSA-N	0	3	342.817	3.136	20	30		EGEDHN
C=CCCCC(=O)NCCC1(CNCc2cc(C#N)ccc2F)CC1	ZINC001166910061	1383498602	/nfs/dbraw/zinc/49/86/02/1383498602.db2.gz	LCSABGFUGFIMRH-UHFFFAOYSA-N	0	3	343.446	3.430	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCC2(CNCc3oc(CC)nc3C)CC2)C1	ZINC001167130171	1383546922	/nfs/dbraw/zinc/54/69/22/1383546922.db2.gz	KSOKXUUACZCBTF-UHFFFAOYSA-N	0	3	345.487	3.278	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)C[C@@H](C)CC(C)(C)C	ZINC001167262759	1383578734	/nfs/dbraw/zinc/57/87/34/1383578734.db2.gz	YXRHAGBAIRLOCV-GFCCVEGCSA-N	0	3	333.314	3.453	20	30		EGEDHN
CC[C@]1(C)C[C@H]1C(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001167583028	1383678566	/nfs/dbraw/zinc/67/85/66/1383678566.db2.gz	FDCQFEACQVQBHV-AZUAARDMSA-N	0	3	339.483	3.371	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)Cc2cc(C)ccc2F)CC1	ZINC001167806233	1383744983	/nfs/dbraw/zinc/74/49/83/1383744983.db2.gz	FOCOGDHECMYZRF-UHFFFAOYSA-N	0	3	338.854	3.305	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccccc2OCC)CC1	ZINC001167946288	1383775272	/nfs/dbraw/zinc/77/52/72/1383775272.db2.gz	IWPAHORQMJAPPT-UHFFFAOYSA-N	0	3	336.863	3.328	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1ccc2c(c1)C=CCC2	ZINC001168189097	1383839023	/nfs/dbraw/zinc/83/90/23/1383839023.db2.gz	CHGAMYAHDRLJKN-UHFFFAOYSA-N	0	3	349.272	3.264	20	30		EGEDHN
N=C(NC1CCC(OC(=O)c2ccccc2)CC1)c1ccc(F)cn1	ZINC001169271416	1384130790	/nfs/dbraw/zinc/13/07/90/1384130790.db2.gz	APCJAFANDGTWOR-UHFFFAOYSA-N	0	3	341.386	3.094	20	30		EGEDHN
C[C@](C#N)(Nc1ccc2c(n1)OCCNC2)c1ccccc1Cl	ZINC001169379029	1384141958	/nfs/dbraw/zinc/14/19/58/1384141958.db2.gz	GEQVVIXKWGQVFN-QGZVFWFLSA-N	0	3	328.803	3.068	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)CC(F)(F)F	ZINC001169588806	1384162348	/nfs/dbraw/zinc/16/23/48/1384162348.db2.gz	CTPMACZDECKHBT-ZDUSSCGKSA-N	0	3	341.377	3.275	20	30		EGEDHN
C=CCCC(=O)N[C@H](C)CCCCNCc1c(C)nn(C)c1Cl	ZINC001169712330	1384176872	/nfs/dbraw/zinc/17/68/72/1384176872.db2.gz	BWOGQOVPZHQGRI-CYBMUJFWSA-N	0	3	340.899	3.113	20	30		EGEDHN
N#Cc1cc(CN[C@H]2CCCN(C(=O)c3ccccc3)C2)cs1	ZINC001169750655	1384182737	/nfs/dbraw/zinc/18/27/37/1384182737.db2.gz	LYFXGWWBFHWBSS-INIZCTEOSA-N	0	3	325.437	3.014	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)[C@H]1CC1(C)C	ZINC001170221294	1384268994	/nfs/dbraw/zinc/26/89/94/1384268994.db2.gz	IZVHNWQUBGLFTF-CRAIPNDOSA-N	0	3	327.472	3.369	20	30		EGEDHN
CO[C@@H]1[C@@H](C)[C@@H](NCc2ccc(C#N)cc2Br)C1(C)C	ZINC001170398976	1384307346	/nfs/dbraw/zinc/30/73/46/1384307346.db2.gz	GOSQBTLEEPSAJG-COLVAYQJSA-N	0	3	337.261	3.470	20	30		EGEDHN
C[C@H](Nc1c(F)c(F)c(C(F)(F)F)c(F)c1F)[C@@H]1CNCCO1	ZINC001170568272	1384344332	/nfs/dbraw/zinc/34/43/32/1384344332.db2.gz	FXSIEUXQHAKLKT-WDSKDSINSA-N	0	3	346.246	3.051	20	30		EGEDHN
C=C[C@@H]1C[C@]1(Nc1ccc([C@@H]2CCCCN2C)cn1)C(=O)OCC	ZINC001170924711	1384412135	/nfs/dbraw/zinc/41/21/35/1384412135.db2.gz	PMFXBZYMHQWIDZ-JTDSTZFVSA-N	0	3	329.444	3.158	20	30		EGEDHN
C[C@H](CCCCNCc1cc(F)ccc1C#N)NC(=O)c1cc[nH]c1	ZINC001170932503	1384413659	/nfs/dbraw/zinc/41/36/59/1384413659.db2.gz	IALNLCCEOUUABL-CQSZACIVSA-N	0	3	342.418	3.104	20	30		EGEDHN
CN1c2ccc(NC(=N)c3ccc4cc(O)ccc4c3)cc2CC1=O	ZINC001171185502	1384463088	/nfs/dbraw/zinc/46/30/88/1384463088.db2.gz	YTFXZEQUVXZURL-UHFFFAOYSA-N	0	3	331.375	3.101	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1CCC[C@H]1CNC(=O)OC(C)(C)C	ZINC001171221869	1384471772	/nfs/dbraw/zinc/47/17/72/1384471772.db2.gz	WJFSSYJHYKVBNO-QAPCUYQASA-N	0	3	343.471	3.478	20	30		EGEDHN
C[C@@H](Cc1cccc(C#N)c1)N1CCN(CCc2ccccc2)CC1	ZINC001171221221	1384472109	/nfs/dbraw/zinc/47/21/09/1384472109.db2.gz	JFOQFMQHQFNEKX-IBGZPJMESA-N	0	3	333.479	3.350	20	30		EGEDHN
Cc1cnc(O[C@@H]2CCCN([C@H](C)Cc3cccc(C#N)c3)C2)nc1	ZINC001171231347	1384474697	/nfs/dbraw/zinc/47/46/97/1384474697.db2.gz	IPZXTYVCOVKQLL-VQIMIIECSA-N	0	3	336.439	3.131	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1C[C@H]2[C@H](CN2C(=O)OC(C)(C)C)C1	ZINC001171232470	1384475500	/nfs/dbraw/zinc/47/55/00/1384475500.db2.gz	STKVSKJSEDFSJZ-JLSDUUJJSA-N	0	3	341.455	3.040	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1cnc(C)s1	ZINC001316874819	1384659837	/nfs/dbraw/zinc/65/98/37/1384659837.db2.gz	UJSOYQFVUQAOFY-YPMHNXCESA-N	0	3	327.881	3.177	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1cc(CCC)on1	ZINC001316879242	1384664609	/nfs/dbraw/zinc/66/46/09/1384664609.db2.gz	JVUAFFLHWMTBGB-XJKSGUPXSA-N	0	3	339.867	3.352	20	30		EGEDHN
C[C@@H](N[C@@H]1C[C@@H](NC(=O)[C@@H](C)C#N)C1)c1cc(Cl)ccc1Cl	ZINC001317073722	1384841194	/nfs/dbraw/zinc/84/11/94/1384841194.db2.gz	UVCNNNRZTNIVLN-LFSVMHDDSA-N	0	3	340.254	3.451	20	30		EGEDHN
CC[C@H](C)[C@H]([NH2+][C@@H](C)Cc1ccc(OC(F)(F)F)cc1)C(=O)N[O-]	ZINC001173090816	1384912303	/nfs/dbraw/zinc/91/23/03/1384912303.db2.gz	MHNRAMYPHOBCSL-MJVIPROJSA-N	0	3	348.365	3.026	20	30		EGEDHN
C[C@H](CNC(=O)c1sccc1C1CC1)NCc1ccc(C#N)s1	ZINC001317283140	1385054464	/nfs/dbraw/zinc/05/44/64/1385054464.db2.gz	IHMWKUFNDUDBKL-LLVKDONJSA-N	0	3	345.493	3.467	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)CCCC2CC2)C1	ZINC001317336658	1385089066	/nfs/dbraw/zinc/08/90/66/1385089066.db2.gz	ZMEWZRAJENANHS-KRWDZBQOSA-N	0	3	325.456	3.077	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)C1(c2ccccc2F)CCC1	ZINC001317412120	1385122783	/nfs/dbraw/zinc/12/27/83/1385122783.db2.gz	IVCJRLAJWOJMKN-AWEZNQCLSA-N	0	3	338.854	3.484	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H](C)CCCCNCc2ocnc2C)cc1	ZINC001174644015	1385129231	/nfs/dbraw/zinc/12/92/31/1385129231.db2.gz	YKHACMCTCFRQRV-OAHLLOKOSA-N	0	3	339.439	3.043	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@H](C)CCCCNCc1cc(OC)no1	ZINC001174848800	1385159412	/nfs/dbraw/zinc/15/94/12/1385159412.db2.gz	IESUUWNMJXEKTQ-LSDHHAIUSA-N	0	3	337.464	3.050	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)CCCCNCc2cc(C)no2)CCC1	ZINC001175089621	1385193039	/nfs/dbraw/zinc/19/30/39/1385193039.db2.gz	NMOPHBRKTKPEKH-HNNXBMFYSA-N	0	3	333.476	3.494	20	30		EGEDHN
CCCN(CCNC(=O)c1ccc(Cl)o1)Cc1ccc(C#N)cc1	ZINC001317541777	1385281718	/nfs/dbraw/zinc/28/17/18/1385281718.db2.gz	VFJYPBAKJARKGF-UHFFFAOYSA-N	0	3	345.830	3.447	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)[C@@H]1CC12CC2	ZINC001175453780	1385296651	/nfs/dbraw/zinc/29/66/51/1385296651.db2.gz	VXAJIMANYPBPFG-YJBOKZPZSA-N	0	3	325.456	3.123	20	30		EGEDHN
C[C@H](Cc1ccccc1)C(=O)NCCCNCc1ccccc1C#N	ZINC001176688213	1385660079	/nfs/dbraw/zinc/66/00/79/1385660079.db2.gz	GWBCUZTXOOLDJI-QGZVFWFLSA-N	0	3	335.451	3.033	20	30		EGEDHN
CC1=CC[C@@](C)(C(=O)NCCCNCc2ccccc2C#N)CC1	ZINC001176751784	1385682473	/nfs/dbraw/zinc/68/24/73/1385682473.db2.gz	FYZTYDOQOWKKKW-HXUWFJFHSA-N	0	3	325.456	3.291	20	30		EGEDHN
C=C[C@@H](C(=O)NCCCNCc1nc(C)cs1)c1ccccc1	ZINC001176778293	1385692421	/nfs/dbraw/zinc/69/24/21/1385692421.db2.gz	KUILZZJWQQBIGM-MRXNPFEDSA-N	0	3	329.469	3.017	20	30		EGEDHN
C[C@@H]1CC(C(=O)NCCCNCc2ccc(C#N)cc2F)C[C@@H](C)C1	ZINC001177137066	1385829107	/nfs/dbraw/zinc/82/91/07/1385829107.db2.gz	XQNQLAZQVBVEMG-GJZGRUSLSA-N	0	3	345.462	3.366	20	30		EGEDHN
C#CCC1(C(=O)NCCCNCc2nc(C)c(C)s2)CCCCC1	ZINC001177217702	1385870940	/nfs/dbraw/zinc/87/09/40/1385870940.db2.gz	KGRFRZHAICCNJC-UHFFFAOYSA-N	0	3	347.528	3.330	20	30		EGEDHN
C[C@@]1(C(=O)NCCCNCc2ccccc2C#N)CCc2ccccc21	ZINC001177247820	1385883663	/nfs/dbraw/zinc/88/36/63/1385883663.db2.gz	UYKZSHYDLRHMSU-JOCHJYFZSA-N	0	3	347.462	3.058	20	30		EGEDHN
C=CC(C)(C)C(=O)N(CCCNCc1nccn1C)CC1CCCC1	ZINC001177381386	1385935943	/nfs/dbraw/zinc/93/59/43/1385935943.db2.gz	XFUZJUGDYXBZOJ-UHFFFAOYSA-N	0	3	346.519	3.131	20	30		EGEDHN
CC(C)c1ncc(C(=O)NCCCNCc2ccccc2C#N)s1	ZINC001177637184	1386013346	/nfs/dbraw/zinc/01/33/46/1386013346.db2.gz	CRKPSWAOYMGVJR-UHFFFAOYSA-N	0	3	342.468	3.048	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCC1(NCc2cccc(Cl)c2F)CCCC1	ZINC001319340499	1386067836	/nfs/dbraw/zinc/06/78/36/1386067836.db2.gz	KSNLBCCHTSZIRC-LBPRGKRZSA-N	0	3	337.826	3.157	20	30		EGEDHN
C[C@@H](C(=O)NCC1(NCc2cc(C#N)ccc2F)CCCC1)C1CC1	ZINC001319342799	1386069919	/nfs/dbraw/zinc/06/99/19/1386069919.db2.gz	QOVDRMNPTMFNCO-CQSZACIVSA-N	0	3	343.446	3.262	20	30		EGEDHN
N#CC(Cc1cccs1)C(=O)Nc1c(N)cc(Cl)nc1Cl	ZINC001177904861	1386079308	/nfs/dbraw/zinc/07/93/08/1386079308.db2.gz	SVTNFQPRFHUZPU-ZETCQYMHSA-N	0	3	341.223	3.353	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2cccc(Cl)c2)CCN1C(=O)C1CCCC1	ZINC001178018668	1386109542	/nfs/dbraw/zinc/10/95/42/1386109542.db2.gz	BDBRTZCUWYJYHV-KXBFYZLASA-N	0	3	344.886	3.461	20	30		EGEDHN
C[C@@H](NCCCCCCNC(=O)[C@@H](C)C#N)c1nc2ccccc2o1	ZINC001178053488	1386117670	/nfs/dbraw/zinc/11/76/70/1386117670.db2.gz	SRCJCAPEHSTUPE-LSDHHAIUSA-N	0	3	342.443	3.315	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@H](NCC#Cc2cccc(Cl)c2)[C@@H]1C	ZINC001178070130	1386121666	/nfs/dbraw/zinc/12/16/66/1386121666.db2.gz	TZQUMJIWZGGTEK-YJBOKZPZSA-N	0	3	330.859	3.237	20	30		EGEDHN
C[C@H](C(=O)NCCCCCCNCc1ccccc1C#N)C1CC1	ZINC001178121688	1386136322	/nfs/dbraw/zinc/13/63/22/1386136322.db2.gz	KLSANKQYXZJVFP-INIZCTEOSA-N	0	3	327.472	3.371	20	30		EGEDHN
CC[C@H](SC)C(=O)NCCCCCCNCc1ccccc1C#N	ZINC001178204295	1386159227	/nfs/dbraw/zinc/15/92/27/1386159227.db2.gz	RJKZUZHUHPFQAK-SFHVURJKSA-N	0	3	347.528	3.466	20	30		EGEDHN
CCC[C@H](C)CC(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C	ZINC001178315734	1386187369	/nfs/dbraw/zinc/18/73/69/1386187369.db2.gz	MNAYIHIKXADYIP-BJLQDIEVSA-N	0	3	326.484	3.443	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCCCCCNCc1nccn1CC	ZINC001178564341	1386249503	/nfs/dbraw/zinc/24/95/03/1386249503.db2.gz	IRSNWTZJZYIGPP-UHFFFAOYSA-N	0	3	346.519	3.438	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CC[C@H](NCC=C(Cl)Cl)[C@@H]1C	ZINC001178896100	1386341643	/nfs/dbraw/zinc/34/16/43/1386341643.db2.gz	QXCAPIHOPRUODZ-STQMWFEESA-N	0	3	342.270	3.186	20	30		EGEDHN
C#CCCCCCC(=O)NCCCCCCN[C@H](C)c1nnc(C)[nH]1	ZINC001179239890	1386429989	/nfs/dbraw/zinc/42/99/89/1386429989.db2.gz	OVHCJTWJHIPTHO-MRXNPFEDSA-N	0	3	347.507	3.024	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C)C1CCCC1	ZINC001179897051	1386621653	/nfs/dbraw/zinc/62/16/53/1386621653.db2.gz	YAVWDCQJONENHJ-WFXMLNOXSA-N	0	3	338.495	3.443	20	30		EGEDHN
N#CCc1cccc(NCCCCN2CCN(c3ccccc3)CC2)n1	ZINC001320490079	1386625087	/nfs/dbraw/zinc/62/50/87/1386625087.db2.gz	JWJCQSVLXZLDHU-UHFFFAOYSA-N	0	3	349.482	3.162	20	30		EGEDHN
CN(CC(=O)N(CCC#N)Cc1ccc(Cl)cc1)C1CCCC1	ZINC001180627405	1386851077	/nfs/dbraw/zinc/85/10/77/1386851077.db2.gz	HHSCBECEPUJLTK-UHFFFAOYSA-N	0	3	333.863	3.457	20	30		EGEDHN
CC/C=C(/C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2ccccc2C#N)C1	ZINC001180779672	1386874981	/nfs/dbraw/zinc/87/49/81/1386874981.db2.gz	WPJQPPFNJKATLZ-VLTDAVSLSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2nccs2)C1	ZINC001181573096	1387017922	/nfs/dbraw/zinc/01/79/22/1387017922.db2.gz	IYDOWEXCVAXTDN-DNVCBOLYSA-N	0	3	347.528	3.486	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2cc(C3CC3)no2)C1	ZINC001182465048	1387171110	/nfs/dbraw/zinc/17/11/10/1387171110.db2.gz	IZCOWZTZSZWTET-FOIQADDNSA-N	0	3	345.487	3.483	20	30		EGEDHN
C[C@@H](CNC(=O)c1cc(C#N)c[nH]1)N(C)[C@@H](C)c1ccc(Cl)cc1	ZINC001329409940	1389100836	/nfs/dbraw/zinc/10/08/36/1389100836.db2.gz	MAGPVYJKGSDJGE-STQMWFEESA-N	0	3	344.846	3.351	20	30		EGEDHN
C[C@@H](NC(=O)c1ccc(C#N)cc1F)[C@H](c1ccccc1)N(C)C	ZINC001336444822	1389101018	/nfs/dbraw/zinc/10/10/18/1389101018.db2.gz	RXYUMSPXONPGNL-FZKQIMNGSA-N	0	3	325.387	3.119	20	30		EGEDHN
CN(C(=O)c1ccsc1)[C@@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001331252270	1389668475	/nfs/dbraw/zinc/66/84/75/1389668475.db2.gz	DEPXBGIJKAPNHT-INIZCTEOSA-N	0	3	345.493	3.322	20	30		EGEDHN
C[C@H](CN(C)C(=O)c1cccc(F)c1)NCc1ccc(F)c(C#N)c1	ZINC001331375181	1389723275	/nfs/dbraw/zinc/72/32/75/1389723275.db2.gz	HHPVAAYAPVNEJL-CYBMUJFWSA-N	0	3	343.377	3.087	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N1CCC[C@@](C)(CC)C1	ZINC001339486006	1390043867	/nfs/dbraw/zinc/04/38/67/1390043867.db2.gz	ZWQAIHJLBZHJNZ-QFBILLFUSA-N	0	3	331.508	3.290	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N1CCC(Nc2ccccc2Cl)CC1	ZINC001340198065	1390247718	/nfs/dbraw/zinc/24/77/18/1390247718.db2.gz	AFZIYCFFHMUNIU-INIZCTEOSA-N	0	3	335.879	3.427	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N1CCc2ccc(C(F)(F)F)cc2C1	ZINC001340875858	1390391597	/nfs/dbraw/zinc/39/15/97/1390391597.db2.gz	JYWQBMKRPKKHQW-OAHLLOKOSA-N	0	3	326.362	3.274	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccc(C(=O)NC(C)(C)CC)cc1	ZINC001341477240	1390491690	/nfs/dbraw/zinc/49/16/90/1390491690.db2.gz	CEESLTAVFSPPFS-MRXNPFEDSA-N	0	3	331.460	3.227	20	30		EGEDHN
Cn1c(C(=O)C(C#N)c2nc(N)c3ccccc3n2)cc2ccccc21	ZINC001343290890	1390705458	/nfs/dbraw/zinc/70/54/58/1390705458.db2.gz	BUQONGXEGCNXDL-CQSZACIVSA-N	0	3	341.374	3.194	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)[C@@H](C)OC2CCCCC2)cc1	ZINC001343337125	1390707990	/nfs/dbraw/zinc/70/79/90/1390707990.db2.gz	WZELENZNVLMSSJ-CXAGYDPISA-N	0	3	344.411	3.080	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N(C)Cc1ccc(F)cc1Br	ZINC001343647398	1390728688	/nfs/dbraw/zinc/72/86/88/1390728688.db2.gz	IQDAOGMZKMBVED-CQSZACIVSA-N	0	3	343.240	3.230	20	30		EGEDHN
C=C(C)Cn1c([C@H](C)SC)nnc1N1CCN([C@@H](C)CC)CC1	ZINC001343669622	1390729893	/nfs/dbraw/zinc/72/98/93/1390729893.db2.gz	OXQZLQOJRDRCAR-GJZGRUSLSA-N	0	3	337.537	3.199	20	30		EGEDHN
N#CC(C(=O)[C@H]1C[C@H]2CC(=O)[C@@H]1C2)c1nc2c(cccc2Cl)[nH]1	ZINC001345673689	1390874689	/nfs/dbraw/zinc/87/46/89/1390874689.db2.gz	WNEOZWAYBUWFKN-VLEAKVRGSA-N	0	3	327.771	3.008	20	30		EGEDHN
N#Cc1ccc(C(=O)C(C#N)c2nccn2Cc2ccccc2)cc1	ZINC001347064512	1390997616	/nfs/dbraw/zinc/99/76/16/1390997616.db2.gz	ZUVUQDWBLSVHMW-GOSISDBHSA-N	0	3	326.359	3.293	20	30		EGEDHN
C[C@@H](NC[C@@H](O)COc1ccccc1C#N)c1ccc(Cl)c(F)c1	ZINC001348423521	1391217108	/nfs/dbraw/zinc/21/71/08/1391217108.db2.gz	TXWGTLGAJAQUAB-IUODEOHRSA-N	0	3	348.805	3.441	20	30		EGEDHN
C[C@@H](CNCC#Cc1cccc(Cl)c1)N(C)C(=O)[C@H]1CC1(C)C	ZINC001698822583	1406514065	/nfs/dbraw/zinc/51/40/65/1406514065.db2.gz	NYNAFPNBJDCQBE-WMLDXEAASA-N	0	3	332.875	3.174	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@H](CC)Cc2ccccc2)C1	ZINC001479398951	1392234114	/nfs/dbraw/zinc/23/41/14/1392234114.db2.gz	MCBVGQNQFIKFAL-KZNAEPCWSA-N	0	3	334.891	3.492	20	30		EGEDHN
CC1(CCC(=O)NC[C@H](NCc2ccc(C#N)cc2F)C2CC2)CC1	ZINC001480055539	1392553931	/nfs/dbraw/zinc/55/39/31/1392553931.db2.gz	BTMXJIIWMYSIAI-SFHVURJKSA-N	0	3	343.446	3.262	20	30		EGEDHN
C[C@H](C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1)C(C)(C)C	ZINC001480147620	1392601296	/nfs/dbraw/zinc/60/12/96/1392601296.db2.gz	UVQJXVVHEAMEEV-DAXOMENPSA-N	0	3	331.435	3.116	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](N[C@@H]2CCc3c2cc(F)cc3F)C1	ZINC001480615571	1392821147	/nfs/dbraw/zinc/82/11/47/1392821147.db2.gz	ZHHNKXNZEGURKQ-KBXCAEBGSA-N	0	3	334.410	3.499	20	30		EGEDHN
CCC[C@@H](CC)C(=O)N1CC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001480622267	1392825774	/nfs/dbraw/zinc/82/57/74/1392825774.db2.gz	IDRBZZBJUTWZHK-WBVHZDCISA-N	0	3	331.435	3.214	20	30		EGEDHN
CCCN(CCNC(=O)c1ccsc1)Cc1ccc(C#N)cc1	ZINC001481129019	1393127671	/nfs/dbraw/zinc/12/76/71/1393127671.db2.gz	AFMNGMZWZMPNLN-UHFFFAOYSA-N	0	3	327.453	3.262	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC(CCN[C@@H](C)c2c(F)cccc2F)CC1	ZINC001481996401	1394655932	/nfs/dbraw/zinc/65/59/32/1394655932.db2.gz	FTVOQFGVFYKXCZ-KBPBESRZSA-N	0	3	349.425	3.404	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)CCc1ccc(F)cc1F)C(C)C	ZINC001482562680	1395090243	/nfs/dbraw/zinc/09/02/43/1395090243.db2.gz	APPMAIYEJLMFQJ-MRXNPFEDSA-N	0	3	344.833	3.380	20	30		EGEDHN
C[C@]1(CNC(=O)CCC2CC2)CCCN(Cc2ccc(C#N)cc2)C1	ZINC001484154543	1395290105	/nfs/dbraw/zinc/29/01/05/1395290105.db2.gz	KVHAPTGNERWKTM-OAQYLSRUSA-N	0	3	339.483	3.467	20	30		EGEDHN
CN(CCN(C)C(=O)C1(C)CCCC1)Cc1ccc(OCC#N)cc1	ZINC001698992622	1406785479	/nfs/dbraw/zinc/78/54/79/1406785479.db2.gz	BTWDVFISVKNMEW-UHFFFAOYSA-N	0	3	343.471	3.059	20	30		EGEDHN
Cc1sccc1CC(=O)NC[C@@H](C)N(C)Cc1ccc(C#N)cc1	ZINC001485358826	1395834034	/nfs/dbraw/zinc/83/40/34/1395834034.db2.gz	RSUXZVKRKLESLV-CQSZACIVSA-N	0	3	341.480	3.107	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)CC(C)(F)F)CCN1Cc1ccc(C#N)cc1	ZINC001502985338	1396237069	/nfs/dbraw/zinc/23/70/69/1396237069.db2.gz	FRAOJIJYXMDUCD-CZUORRHYSA-N	0	3	335.398	3.073	20	30		EGEDHN
CCN(CCNC(=O)c1cc2ccccc2[nH]1)Cc1ccc(C#N)cc1	ZINC001493056787	1396335057	/nfs/dbraw/zinc/33/50/57/1396335057.db2.gz	YLFYUMHRXCIUMF-UHFFFAOYSA-N	0	3	346.434	3.291	20	30		EGEDHN
CCc1ccc(CN2CC[C@H](NC(=O)CC#Cc3ccccc3)C2)cc1	ZINC001494738301	1396490831	/nfs/dbraw/zinc/49/08/31/1396490831.db2.gz	UZRGNUCBXBLGNJ-QFIPXVFZSA-N	0	3	346.474	3.381	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)[C@@H](C)C(C)C)CCCC1	ZINC001495950164	1396575537	/nfs/dbraw/zinc/57/55/37/1396575537.db2.gz	WUMPFXPGZIHCJV-ZDUSSCGKSA-N	0	3	331.298	3.206	20	30		EGEDHN
Cc1coc(C)c1C(=O)N[C@@H](C)CN(C)Cc1cccc(C#N)c1	ZINC001498270957	1396954001	/nfs/dbraw/zinc/95/40/01/1396954001.db2.gz	XQUDMGLZKFCXMI-AWEZNQCLSA-N	0	3	325.412	3.018	20	30		EGEDHN
C[C@@H](C(=O)NCC1(NCc2ccc(OCC#N)cc2)CC1)C(C)(C)C	ZINC001499264379	1397071383	/nfs/dbraw/zinc/07/13/83/1397071383.db2.gz	XZBJLPFIJDUAIN-HNNXBMFYSA-N	0	3	343.471	3.010	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)CCc1cccnc1	ZINC001689904829	1404197674	/nfs/dbraw/zinc/19/76/74/1404197674.db2.gz	DCROOWHEMVLGSC-NVXWUHKLSA-N	0	3	335.879	3.126	20	30		EGEDHN
C[C@H](C#N)C(=O)N(C)C1CCN(Cc2cc3ccccc3o2)CC1	ZINC001690018372	1404259042	/nfs/dbraw/zinc/25/90/42/1404259042.db2.gz	CPNWYRDCFXIXMJ-CQSZACIVSA-N	0	3	325.412	3.015	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CCN(CCn2ccc3cc(Cl)ccc32)C1	ZINC001690085153	1404291554	/nfs/dbraw/zinc/29/15/54/1404291554.db2.gz	GGVRQLWJYZLMQN-QGZVFWFLSA-N	0	3	345.874	3.451	20	30		EGEDHN
N#Cc1ccc(CN[C@H](CNC(=O)C2CCCCC2)C2CC2)c(F)c1	ZINC001690140932	1404339032	/nfs/dbraw/zinc/33/90/32/1404339032.db2.gz	KBLDKKGEQOTOIG-LJQANCHMSA-N	0	3	343.446	3.262	20	30		EGEDHN
C[C@@H](CNC(=O)C(C)(C)C1CCCC1)NCc1ccc(C#N)s1	ZINC001690586624	1404641167	/nfs/dbraw/zinc/64/11/67/1404641167.db2.gz	GVFHDAKFGTZKCR-ZDUSSCGKSA-N	0	3	333.501	3.430	20	30		EGEDHN
CCC1(C(=O)NCC[C@@H](C)NCc2cc(C#N)ccc2F)CCC1	ZINC001690858276	1404780667	/nfs/dbraw/zinc/78/06/67/1404780667.db2.gz	VRLKCJIZVLEYEX-CQSZACIVSA-N	0	3	331.435	3.262	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](CCNC(=O)c3ccsc3)C2)s1	ZINC001691872942	1405596267	/nfs/dbraw/zinc/59/62/67/1405596267.db2.gz	PBPUTWAVFDEAJZ-CYBMUJFWSA-N	0	3	345.493	3.323	20	30		EGEDHN
CC[C@@H](CNC(=O)c1cccc(C)c1)NCc1ccc(C#N)s1	ZINC001698591907	1406214807	/nfs/dbraw/zinc/21/48/07/1406214807.db2.gz	UTOKAFOUOSWVRL-HNNXBMFYSA-N	0	3	327.453	3.226	20	30		EGEDHN
C[C@H](C#N)C(=O)NCC1CN(Cc2ccc(-c3ccccc3)cc2)C1	ZINC001732122734	1428373469	/nfs/dbraw/zinc/37/34/69/1428373469.db2.gz	SVXPFGFKKTTXRQ-MRXNPFEDSA-N	0	3	333.435	3.061	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2csc(Cl)n2)CCCC1	ZINC001732234748	1428480958	/nfs/dbraw/zinc/48/09/58/1428480958.db2.gz	REZDZQPDAUOVOE-UHFFFAOYSA-N	0	3	334.272	3.181	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1cc2ccccc2[nH]1)C1CC1	ZINC001732252421	1428494133	/nfs/dbraw/zinc/49/41/33/1428494133.db2.gz	APWZZYCQMMORQL-SFHVURJKSA-N	0	3	331.847	3.409	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)CCc2ccncc2)CCCC[C@H]1C	ZINC001732261170	1428501255	/nfs/dbraw/zinc/50/12/55/1428501255.db2.gz	XGXHZCUPQGXLDB-BEFAXECRSA-N	0	3	349.906	3.421	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)C1(c2ccccc2)CC1	ZINC001732366902	1428550491	/nfs/dbraw/zinc/55/04/91/1428550491.db2.gz	FNVCOJATHZFBTI-QGZVFWFLSA-N	0	3	347.462	3.132	20	30		EGEDHN
C[C@H](CNCc1ccc(F)c(C#N)c1)NC(=O)c1ccc(CF)cc1	ZINC001699390998	1412704940	/nfs/dbraw/zinc/70/49/40/1412704940.db2.gz	BZCNVLVUBGOFJA-CYBMUJFWSA-N	0	3	343.377	3.075	20	30		EGEDHN
C[C@@H](CN(C)Cc1cccc(C#N)c1)NC(=O)C1=CCCCCC1	ZINC001699450135	1412787636	/nfs/dbraw/zinc/78/76/36/1412787636.db2.gz	MPNCLQVMUPDPKB-INIZCTEOSA-N	0	3	325.456	3.385	20	30		EGEDHN
C=C(Br)CN[C@@H](C)CCNC(=O)c1ccc(C)c(F)c1	ZINC001700325379	1413794446	/nfs/dbraw/zinc/79/44/46/1413794446.db2.gz	USJLTCAQDMYSKI-LBPRGKRZSA-N	0	3	343.240	3.141	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)CCc2ccc(F)cc2F)C1	ZINC001707090596	1417196452	/nfs/dbraw/zinc/19/64/52/1417196452.db2.gz	VCPDBHQPCRXFBX-NNUKFRKNSA-N	0	3	342.817	3.134	20	30		EGEDHN
C[C@@H](NC(=O)CC1(C)CC1)[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001713276366	1417896841	/nfs/dbraw/zinc/89/68/41/1417896841.db2.gz	UTJNVKBRBXWEDX-APWZRJJASA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@H](CCNC(=O)c1ccoc1Cl)NCc1cc(C#N)ccc1F	ZINC001713407223	1418030560	/nfs/dbraw/zinc/03/05/60/1418030560.db2.gz	XHCROJAYEIFYBY-LLVKDONJSA-N	0	3	349.793	3.242	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)Cc1ccc(C)c(Cl)c1	ZINC001713410063	1418033124	/nfs/dbraw/zinc/03/31/24/1418033124.db2.gz	FDOCKOOYUWJWDM-CYBMUJFWSA-N	0	3	329.271	3.428	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)CC(C)(C)c2ccc(F)cc2)C1	ZINC001713950869	1418735275	/nfs/dbraw/zinc/73/52/75/1418735275.db2.gz	JDURKAOLOOXVMZ-WKILWMFISA-N	0	3	338.854	3.483	20	30		EGEDHN
CC(C)c1ncc(C(=O)NC[C@H](C)NCc2ccc(C#N)s2)s1	ZINC001714312280	1419093174	/nfs/dbraw/zinc/09/31/74/1419093174.db2.gz	SOBMGSWQWCXYPB-NSHDSACASA-N	0	3	348.497	3.108	20	30		EGEDHN
C[C@H](C#N)C(=O)NC[C@@H](C)CNCc1cc(Cl)sc1Cl	ZINC001714377262	1419132250	/nfs/dbraw/zinc/13/22/50/1419132250.db2.gz	KSAUAYAHOWBYDH-DTWKUNHWSA-N	0	3	334.272	3.056	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)Cc2cc(F)ccc2F)CCCC1	ZINC001714502126	1419228380	/nfs/dbraw/zinc/22/83/80/1419228380.db2.gz	DIOALRGRGUNQHI-UHFFFAOYSA-N	0	3	342.817	3.278	20	30		EGEDHN
CCN(CCNC(=O)[C@H](C)c1cccs1)Cc1ccc(C#N)cc1	ZINC001714592318	1419340351	/nfs/dbraw/zinc/34/03/51/1419340351.db2.gz	LNKMGDKSIFKUJP-OAHLLOKOSA-N	0	3	341.480	3.362	20	30		EGEDHN
O=C(C#CC1CC1)N[C@H]1CCN(C2c3ccccc3-c3ccccc32)C1	ZINC001714996552	1419728842	/nfs/dbraw/zinc/72/88/42/1419728842.db2.gz	YYQKTVUNLFOOFK-KRWDZBQOSA-N	0	3	342.442	3.360	20	30		EGEDHN
CC[C@H](CNC(=O)[C@H]1CC[C@H](C)CC1)NCc1ccc(C#N)s1	ZINC001715085093	1419823626	/nfs/dbraw/zinc/82/36/26/1419823626.db2.gz	OXUULPMOUXHEAU-RBSFLKMASA-N	0	3	333.501	3.430	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cc(F)c(C)cc1F)C(C)C	ZINC001715595558	1420263706	/nfs/dbraw/zinc/26/37/06/1420263706.db2.gz	LEWFZVPAPFRPLL-OAHLLOKOSA-N	0	3	330.806	3.370	20	30		EGEDHN
CC(C)c1ccoc1C(=O)N[C@H](C)CNCc1ccc(F)c(C#N)c1	ZINC001715944759	1420413815	/nfs/dbraw/zinc/41/38/15/1420413815.db2.gz	MHMWYHBNAGTAFD-CYBMUJFWSA-N	0	3	343.402	3.322	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)NC(=O)Cc1ccccc1Cl	ZINC001716006863	1420460503	/nfs/dbraw/zinc/46/05/03/1420460503.db2.gz	NNWPRBDCMQFFBF-LBPRGKRZSA-N	0	3	347.871	3.110	20	30		EGEDHN
CCOc1cccc(C(=O)NCC2(NCc3ccc(C#N)cc3)CC2)c1	ZINC001716694228	1420846866	/nfs/dbraw/zinc/84/68/66/1420846866.db2.gz	DIRHZQJSVWDIOI-UHFFFAOYSA-N	0	3	349.434	3.009	20	30		EGEDHN
C[C@H](C#N)C(=O)NCc1ccc2c(c1)CN(CCc1ccccc1)C2	ZINC001717269731	1421225599	/nfs/dbraw/zinc/22/55/99/1421225599.db2.gz	XRJWDPCKHOTQBO-MRXNPFEDSA-N	0	3	333.435	3.021	20	30		EGEDHN
Cc1cccc(CC(=O)NCC[C@H](C)NCc2ccccc2C#N)c1	ZINC001717341553	1421279032	/nfs/dbraw/zinc/27/90/32/1421279032.db2.gz	YFONMZSYPACWNA-KRWDZBQOSA-N	0	3	335.451	3.094	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCC1(C)CCN(Cc2ccccc2Cl)CC1	ZINC001733445684	1429654647	/nfs/dbraw/zinc/65/46/47/1429654647.db2.gz	BISBRSPWBJLNCZ-AWEZNQCLSA-N	0	3	333.863	3.218	20	30		EGEDHN
C[C@H](C#N)C(=O)NCC1(NCc2ccc(-c3ccccc3)cc2)CC1	ZINC001723502063	1424443755	/nfs/dbraw/zinc/44/37/55/1424443755.db2.gz	XYSLAACBHMCREP-MRXNPFEDSA-N	0	3	333.435	3.252	20	30		EGEDHN
CCCC[C@@H](C)C(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@H]2C1	ZINC001733574214	1429777139	/nfs/dbraw/zinc/77/71/39/1429777139.db2.gz	NMAPCCVBTTUSLE-AHRSYUTCSA-N	0	3	339.483	3.275	20	30		EGEDHN
C=C(Br)CNC[C@H](C1CC1)N(C)C(=O)C1(F)CCCC1	ZINC001725461530	1426127905	/nfs/dbraw/zinc/12/79/05/1426127905.db2.gz	NJFUPOOLRQOTBQ-CYBMUJFWSA-N	0	3	347.272	3.004	20	30		EGEDHN
CCCC[C@H](C)C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001731442040	1427421110	/nfs/dbraw/zinc/42/11/10/1427421110.db2.gz	LMKAQTGMVRNSLW-JQFCIGGWSA-N	0	3	331.435	3.260	20	30		EGEDHN
CC(C)CC(=O)N(C)C1CCC(NCc2ccccc2C#N)CC1	ZINC001734007277	1437799123	/nfs/dbraw/zinc/79/91/23/1437799123.db2.gz	KRZIXBLMPPDDEM-UHFFFAOYSA-N	0	3	327.472	3.464	20	30		EGEDHN
C[C@H](CNC(=O)C1(C(F)F)CCCC1)N(C)Cc1cccc(C#N)c1	ZINC001734051765	1437841835	/nfs/dbraw/zinc/84/18/35/1437841835.db2.gz	QMRYRPIKJIQZSI-CQSZACIVSA-N	0	3	349.425	3.320	20	30		EGEDHN
CN(CCCNC(=O)C1(C)CCCC1)Cc1ccc(F)c(C#N)c1	ZINC001752034993	1440134303	/nfs/dbraw/zinc/13/43/03/1440134303.db2.gz	BUUYORBRUFBAOE-UHFFFAOYSA-N	0	3	331.435	3.216	20	30		EGEDHN
C=C(C)CCC(=O)N1CCCC[C@H]1[C@@H](C)NCc1cccnc1OC	ZINC001752146101	1440145835	/nfs/dbraw/zinc/14/58/35/1440145835.db2.gz	IXDWOJKQBWHWMC-AEFFLSMTSA-N	0	3	345.487	3.306	20	30		EGEDHN
C/C=C(\C)C(=O)NCCCN(CC)CC#Cc1ccc(Cl)cc1	ZINC001752172037	1440150605	/nfs/dbraw/zinc/15/06/05/1440150605.db2.gz	KHKBSKMLTUSHFW-AYSLTRBKSA-N	0	3	332.875	3.486	20	30		EGEDHN
N#Cc1cc(CN(CCCNC(=O)C=C2CCC2)C2CC2)ccc1F	ZINC001752256964	1440161456	/nfs/dbraw/zinc/16/14/56/1440161456.db2.gz	CIEOBMHJIRDVQE-UHFFFAOYSA-N	0	3	341.430	3.278	20	30		EGEDHN
C=CC(C)(C)CC(=O)N(C)C1CCN(Cc2ccc(CO)cc2)CC1	ZINC001752301350	1440167906	/nfs/dbraw/zinc/16/79/06/1440167906.db2.gz	KEJXXDNRXBKCGF-UHFFFAOYSA-N	0	3	344.499	3.204	20	30		EGEDHN
C=CCOCCN1CCC(N(C)C(=O)C2CCC3(CC3)CC2)CC1	ZINC001752303195	1440168113	/nfs/dbraw/zinc/16/81/13/1440168113.db2.gz	PEBURYGGSBIXAJ-UHFFFAOYSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCN1CCN([C@H](C)c2ccccc2C)CC1	ZINC001752371300	1440172426	/nfs/dbraw/zinc/17/24/26/1440172426.db2.gz	SKDJQRVHEFKMMP-GOSISDBHSA-N	0	3	343.515	3.002	20	30		EGEDHN
C=CCCCCCN1CC[C@@H](NC(=O)c2scnc2Cl)C1	ZINC001752409923	1440174331	/nfs/dbraw/zinc/17/43/31/1440174331.db2.gz	PBIJNKBZZIWZRI-GFCCVEGCSA-N	0	3	327.881	3.347	20	30		EGEDHN
C=C(C)CN1CCC(N(CCC)C(=O)C[C@@H](C)n2ccc(C)n2)CC1	ZINC001752440568	1440181360	/nfs/dbraw/zinc/18/13/60/1440181360.db2.gz	ZSVSBJIXHYINDV-GOSISDBHSA-N	0	3	346.519	3.422	20	30		EGEDHN
O=C(CCc1ccccc1)NC[C@H](NCC#Cc1ccccc1)C1CC1	ZINC001752491602	1440186876	/nfs/dbraw/zinc/18/68/76/1440186876.db2.gz	VGHMXYWGGYLWAE-QFIPXVFZSA-N	0	3	346.474	3.155	20	30		EGEDHN
C=CCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccc(F)c1F	ZINC001752567624	1440195563	/nfs/dbraw/zinc/19/55/63/1440195563.db2.gz	UULWEEMTBZIYRQ-IYBDPMFKSA-N	0	3	334.410	3.149	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1C[C@H](NCc2cccc(F)c2F)C1	ZINC001752650967	1440197947	/nfs/dbraw/zinc/19/79/47/1440197947.db2.gz	NQPDRFFIHKYZAF-WKILWMFISA-N	0	3	334.410	3.285	20	30		EGEDHN
C=Cc1ccc(C(=O)N[C@H]2C[C@H](NCC#Cc3ccccc3)C2)cc1	ZINC001752665066	1440198608	/nfs/dbraw/zinc/19/86/08/1440198608.db2.gz	GUUMXYKIXCJHJF-MEMLXQNLSA-N	0	3	330.431	3.232	20	30		EGEDHN
C[C@@H]1CC[C@@H](C(=O)N[C@H]2C[C@H](NCC#Cc3cccc(Cl)c3)C2)C1	ZINC001752670491	1440198938	/nfs/dbraw/zinc/19/89/38/1440198938.db2.gz	YKFDAZIQCBMJSW-YCEFEEMOSA-N	0	3	344.886	3.365	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1conc1CC	ZINC001752697997	1440201382	/nfs/dbraw/zinc/20/13/82/1440201382.db2.gz	YKUXRORKPHKEMO-CCNLRDMRSA-N	0	3	345.487	3.451	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)CCCc2ccsc2)C1	ZINC001752704976	1440202446	/nfs/dbraw/zinc/20/24/46/1440202446.db2.gz	IKXWCNDUHHBNFO-MOPGFXCFSA-N	0	3	344.524	3.407	20	30		EGEDHN
O=C(C[C@@H]1C=CCCC1)N[C@H]1C[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001752736481	1440204363	/nfs/dbraw/zinc/20/43/63/1440204363.db2.gz	AUFPJTHRCHSIMG-RLLQIKCJSA-N	0	3	340.442	3.160	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@@H]1CCCN(CC[C@H]2CC2(Cl)Cl)C1	ZINC001752780708	1440208778	/nfs/dbraw/zinc/20/87/78/1440208778.db2.gz	DPWZSIIWAUUWDD-GJZGRUSLSA-N	0	3	345.314	3.058	20	30		EGEDHN
C=CCCOCC(=O)NC[C@@H]1CCCN([C@@H](C)c2cccc(F)c2)C1	ZINC001752789992	1440213348	/nfs/dbraw/zinc/21/33/48/1440213348.db2.gz	PENJGHOSHCXWTE-IRXDYDNUSA-N	0	3	348.462	3.308	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)C(C)(C)c2ccccc2C)C1	ZINC001752791865	1440213915	/nfs/dbraw/zinc/21/39/15/1440213915.db2.gz	ATWABVJASKTFIS-SFHVURJKSA-N	0	3	326.484	3.124	20	30		EGEDHN
C[C@H](NC(=O)CC1CCC1)[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001752838358	1440229070	/nfs/dbraw/zinc/22/90/70/1440229070.db2.gz	QRXHQBJKOYODPK-OXJNMPFZSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@H](CNC(=O)C1(C)CCC(C)CC1)NCc1ccc(C#N)s1	ZINC001752921914	1440248846	/nfs/dbraw/zinc/24/88/46/1440248846.db2.gz	BFGQMEREGGLHKF-TXKKKEFDSA-N	0	3	333.501	3.430	20	30		EGEDHN
CC#CCN(C)[C@@H]1CCCN(C(=O)c2ccc3[nH]c(C)c(C)c3c2)C1	ZINC001752999824	1440263974	/nfs/dbraw/zinc/26/39/74/1440263974.db2.gz	IJEHENZAFMBKNI-GOSISDBHSA-N	0	3	337.467	3.344	20	30		EGEDHN
CC#CCN(C)[C@H]1CCCN(C(=O)[C@@H](C)Cc2ccc(C)cc2)C1	ZINC001753000375	1440264347	/nfs/dbraw/zinc/26/43/47/1440264347.db2.gz	RVCGTGJEJQCXJX-ICSRJNTNSA-N	0	3	326.484	3.120	20	30		EGEDHN
CC#CCN(C)[C@@H]1CCCN(C(=O)c2csc3c2CC[C@@H](C)C3)C1	ZINC001753001148	1440264568	/nfs/dbraw/zinc/26/45/68/1440264568.db2.gz	XOBRVHVJHGZULU-HZPDHXFCSA-N	0	3	344.524	3.433	20	30		EGEDHN
C[C@H](CCNC(=O)[C@@H]1C[C@@H]2CCCC[C@H]12)NCc1ccccc1C#N	ZINC001753009673	1440266702	/nfs/dbraw/zinc/26/67/02/1440266702.db2.gz	QRLIFUPXWOLBKW-GIYDNNGJSA-N	0	3	339.483	3.369	20	30		EGEDHN
C[C@H](CCNC(=O)[C@H](C)C1CCC1)NCc1cc(C#N)ccc1F	ZINC001753010135	1440266779	/nfs/dbraw/zinc/26/67/79/1440266779.db2.gz	OUKDBHMLXBIYHZ-ZIAGYGMSSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1CCCNC(=O)c1ccc(N(C)C)cc1	ZINC001753038798	1440275541	/nfs/dbraw/zinc/27/55/41/1440275541.db2.gz	ZGBDCLRJFWQYCQ-SFHVURJKSA-N	0	3	349.906	3.480	20	30		EGEDHN
CN(CCNC(=O)C#CC(C)(C)C)[C@@H]1CCc2ccc(Cl)cc21	ZINC001753048711	1440278419	/nfs/dbraw/zinc/27/84/19/1440278419.db2.gz	BZIBWGAKGABCSB-QGZVFWFLSA-N	0	3	332.875	3.425	20	30		EGEDHN
CCN(CCNC(=O)[C@H]1CCC[C@@H](C)C1)Cc1cccc(C#N)c1	ZINC001753087828	1440297322	/nfs/dbraw/zinc/29/73/22/1440297322.db2.gz	RZCCMQOSXALBEO-APWZRJJASA-N	0	3	327.472	3.323	20	30		EGEDHN
Cc1cccc(Cl)c1CN1CC[C@H](CNC(=O)C#CC(C)C)C1	ZINC001753126215	1440315017	/nfs/dbraw/zinc/31/50/17/1440315017.db2.gz	YTIHQUJNXUHGOB-MRXNPFEDSA-N	0	3	332.875	3.246	20	30		EGEDHN
CCCN(CCNC(=O)C1CCCCC1)Cc1cccc(C#N)c1	ZINC001753142336	1440321989	/nfs/dbraw/zinc/32/19/89/1440321989.db2.gz	XUQPFPCDLSTBLD-UHFFFAOYSA-N	0	3	327.472	3.467	20	30		EGEDHN
CCCN(CCNC(=O)C=C1CCC1)Cc1ccc(F)c(C#N)c1	ZINC001753144231	1440323254	/nfs/dbraw/zinc/32/32/54/1440323254.db2.gz	OSZSOJUBEPIYMA-UHFFFAOYSA-N	0	3	329.419	3.136	20	30		EGEDHN
CCCN(CCNC(=O)C1=CCCC1)Cc1ccc(F)c(C#N)c1	ZINC001753144224	1440323432	/nfs/dbraw/zinc/32/34/32/1440323432.db2.gz	OQCCRYMSCDQBNP-UHFFFAOYSA-N	0	3	329.419	3.136	20	30		EGEDHN
Cc1c(C(=O)N(C)CCNCc2cccc(C#N)c2)ccn1C(C)C	ZINC001753222978	1440340212	/nfs/dbraw/zinc/34/02/12/1440340212.db2.gz	SUSZPKYYXYSUGO-UHFFFAOYSA-N	0	3	338.455	3.111	20	30		EGEDHN
C=CCN[C@@H](CNC(=O)Cc1cn(C)c2ccccc12)c1ccccc1	ZINC001753301655	1440354249	/nfs/dbraw/zinc/35/42/49/1440354249.db2.gz	NCZYHDPBUQSQOI-FQEVSTJZSA-N	0	3	347.462	3.354	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@H]2CC[C@@H](C1)N2[C@H]1CCc2ccc(F)cc21	ZINC001753305062	1440355393	/nfs/dbraw/zinc/35/53/93/1440355393.db2.gz	IPDBUAFNGBQJGG-NSHGMRRFSA-N	0	3	340.442	3.148	20	30		EGEDHN
CC(C)CCC(=O)NCC[C@@H]1CCN(Cc2ccc(C#N)s2)C1	ZINC001753320709	1440363236	/nfs/dbraw/zinc/36/32/36/1440363236.db2.gz	GKYXAGMAQYKJOC-OAHLLOKOSA-N	0	3	333.501	3.384	20	30		EGEDHN
C=CCCN1CC[C@@H](N(CCC)C(=O)c2ocnc2C(F)F)C1	ZINC001753325780	1440366541	/nfs/dbraw/zinc/36/65/41/1440366541.db2.gz	DJUREWJEVFAIDO-GFCCVEGCSA-N	0	3	327.375	3.115	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](CN(C)Cc2oc(C)nc2C)C1	ZINC001753349030	1440377086	/nfs/dbraw/zinc/37/70/86/1440377086.db2.gz	HJKWWMBNBQMHAC-QGZVFWFLSA-N	0	3	345.487	3.340	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(COC)cc1	ZINC001753427449	1440397305	/nfs/dbraw/zinc/39/73/05/1440397305.db2.gz	IEQKTDKVDDIMCE-MNEFBYGVSA-N	0	3	328.456	3.086	20	30		EGEDHN
C=CCN1CC[C@H](N(CC)C(=O)CCn2ccc3ccccc32)C1	ZINC001753462729	1440411574	/nfs/dbraw/zinc/41/15/74/1440411574.db2.gz	ZWBNPQYRGUGEMQ-SFHVURJKSA-N	0	3	325.456	3.140	20	30		EGEDHN
O=C(C[C@@H]1C=CCC1)NC1(CNCC#Cc2ccccc2)CCCC1	ZINC001753499528	1440422946	/nfs/dbraw/zinc/42/29/46/1440422946.db2.gz	XOOAZQHUEGVIGI-HXUWFJFHSA-N	0	3	336.479	3.413	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)NC1(CNCC#Cc2ccccc2)CCCC1	ZINC001753507981	1440425099	/nfs/dbraw/zinc/42/50/99/1440425099.db2.gz	QYXPFFPZOSUYCF-WOJBJXKFSA-N	0	3	338.495	3.493	20	30		EGEDHN
CC(C)=CC(=O)N[C@](C)(CNCC#Cc1ccc(F)cc1)C1CC1	ZINC001753513293	1440426670	/nfs/dbraw/zinc/42/66/70/1440426670.db2.gz	MNHSDFHMGYTUFV-HXUWFJFHSA-N	0	3	328.431	3.018	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@](C)(CNCC#Cc1ccc(F)cc1)C1CC1	ZINC001753518862	1440427985	/nfs/dbraw/zinc/42/79/85/1440427985.db2.gz	RGBQHKKKHXDANW-NRFANRHFSA-N	0	3	342.458	3.408	20	30		EGEDHN
CC#CCCCC(=O)N[C@](C)(CNCc1cccc(Cl)n1)C1CC1	ZINC001753521855	1440428686	/nfs/dbraw/zinc/42/86/86/1440428686.db2.gz	VGTDMLCXGOCAOE-LJQANCHMSA-N	0	3	347.890	3.303	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2ccns2)CCCC[C@@H]1C	ZINC001753534384	1440431969	/nfs/dbraw/zinc/43/19/69/1440431969.db2.gz	SNQHMTBSKWKAMZ-NHYWBVRUSA-N	0	3	327.881	3.164	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2ccns2)CCCC[C@H]1C	ZINC001753534382	1440432011	/nfs/dbraw/zinc/43/20/11/1440432011.db2.gz	SNQHMTBSKWKAMZ-ABAIWWIYSA-N	0	3	327.881	3.164	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC[C@@H](CCNCc2ccc(C#N)cc2F)C1	ZINC001753544992	1440434031	/nfs/dbraw/zinc/43/40/31/1440434031.db2.gz	HPTRAQRAFFBQNH-HZRBCOPISA-N	0	3	343.446	3.382	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H](CCNCc2cc(C3CC3)no2)C1	ZINC001753547003	1440434468	/nfs/dbraw/zinc/43/44/68/1440434468.db2.gz	WICGXHGOSJCNLX-MRXNPFEDSA-N	0	3	343.471	3.074	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H](CCNCc2ocnc2C)C1	ZINC001753554791	1440435803	/nfs/dbraw/zinc/43/58/03/1440435803.db2.gz	HOWLIQCWWZTYBN-VQIMIIECSA-N	0	3	333.476	3.304	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)CSCCC)CC1	ZINC001753577919	1440439608	/nfs/dbraw/zinc/43/96/08/1440439608.db2.gz	FUPMDSKEQNVSCE-JOCQHMNTSA-N	0	3	349.338	3.055	20	30		EGEDHN
C#CCNCc1ccc(CNC(=O)[C@@]2(c3ccccc3)CC2(C)C)cc1	ZINC001753591906	1440443183	/nfs/dbraw/zinc/44/31/83/1440443183.db2.gz	RTJYYNYCVNLFOF-QHCPKHFHSA-N	0	3	346.474	3.394	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCC2CCN(Cc3cccnc3)CC2)cc1	ZINC001753596956	1440444969	/nfs/dbraw/zinc/44/49/69/1440444969.db2.gz	HVSJXVYRUABLNZ-UHFFFAOYSA-N	0	3	347.462	3.095	20	30		EGEDHN
CC[C@H](C)C(=O)NCc1ccc(CNCC#Cc2ccccc2)cc1	ZINC001753597718	1440445207	/nfs/dbraw/zinc/44/52/07/1440445207.db2.gz	HYJUGVSVRDKXEL-SFHVURJKSA-N	0	3	334.463	3.490	20	30		EGEDHN
Cc1oc(C)c(C(=O)NC[C@@H](C)CNCc2ccccc2C#N)c1C	ZINC001753623399	1440450906	/nfs/dbraw/zinc/45/09/06/1440450906.db2.gz	BNEAOVOYKKTAQA-ZDUSSCGKSA-N	0	3	339.439	3.232	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)c1cc2ccccc2[nH]1	ZINC001753642175	1440454705	/nfs/dbraw/zinc/45/47/05/1440454705.db2.gz	KEIUYYOKLNNFDF-OAHLLOKOSA-N	0	3	346.434	3.195	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccc3cccnc3n2)CCCC1	ZINC001753663735	1440459448	/nfs/dbraw/zinc/45/94/48/1440459448.db2.gz	GBUKPLPNPMOMTM-UHFFFAOYSA-N	0	3	344.846	3.015	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CO[C@H]2CCCC[C@H]2C)CCCC1	ZINC001753669468	1440461563	/nfs/dbraw/zinc/46/15/63/1440461563.db2.gz	SNJHRVWGFJBLRF-ZBFHGGJFSA-N	0	3	342.911	3.353	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cnn(C(C)C)c2C)CCCC1	ZINC001753671566	1440462320	/nfs/dbraw/zinc/46/23/20/1440462320.db2.gz	SUQUUEZMNPFGOU-UHFFFAOYSA-N	0	3	338.883	3.157	20	30		EGEDHN
C[C@H](CNCC#Cc1ccccc1)N(C)C(=O)C[C@@H]1CCC(F)(F)C1	ZINC001753694715	1440467321	/nfs/dbraw/zinc/46/73/21/1440467321.db2.gz	FGNOEQUHMMSWPB-AEFFLSMTSA-N	0	3	348.437	3.300	20	30		EGEDHN
C[C@@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)c1occc1Cl	ZINC001753710336	1440470470	/nfs/dbraw/zinc/47/04/70/1440470470.db2.gz	BXYXBDJKXIZKOC-NSHDSACASA-N	0	3	349.793	3.194	20	30		EGEDHN
CC(C)C[C@H](CNCC#Cc1ccc(F)cc1)NC(=O)C=C1CCC1	ZINC001753732569	1440476593	/nfs/dbraw/zinc/47/65/93/1440476593.db2.gz	GXQODRNKZUQSLP-HXUWFJFHSA-N	0	3	342.458	3.408	20	30		EGEDHN
CC(C)C[C@H](CNCC#Cc1ccc(F)cc1)NC(=O)C1(C)CC1	ZINC001753735070	1440477407	/nfs/dbraw/zinc/47/74/07/1440477407.db2.gz	OLRMOQVXKFQORK-GOSISDBHSA-N	0	3	330.447	3.098	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CCCCN1C(=O)C(C)(C)F	ZINC001753765143	1440484618	/nfs/dbraw/zinc/48/46/18/1440484618.db2.gz	CLMIGYPPEVIHSA-LBPRGKRZSA-N	0	3	335.261	3.004	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@H]([C@H](C)NCc2cscn2)C1	ZINC001753815523	1440493628	/nfs/dbraw/zinc/49/36/28/1440493628.db2.gz	OBAIOZRTZWHMAU-HOTGVXAUSA-N	0	3	333.501	3.053	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)/C=C\c1ccco1)NCC#Cc1ccccc1	ZINC001753822218	1440496685	/nfs/dbraw/zinc/49/66/85/1440496685.db2.gz	DTLUDCKPPSFXIA-GHYICZDASA-N	0	3	336.435	3.075	20	30		EGEDHN
CC[C@H](c1ccc(F)cc1)N(C)CCN(C)C(=O)c1c[nH]c(C#N)c1	ZINC001753851183	1440506971	/nfs/dbraw/zinc/50/69/71/1440506971.db2.gz	VPDNHIDQUHDIQD-GOSISDBHSA-N	0	3	342.418	3.181	20	30		EGEDHN
CCN(CCNC1c2ccccc2-c2ccccc21)C(=O)[C@@H](C)C#N	ZINC001754039475	1440534532	/nfs/dbraw/zinc/53/45/32/1440534532.db2.gz	VUMNVIORUATROE-HNNXBMFYSA-N	0	3	333.435	3.354	20	30		EGEDHN
CCN(CCNCc1ccc(C#N)s1)C(=O)C[C@@H]1C=CCCC1	ZINC001754051337	1440535856	/nfs/dbraw/zinc/53/58/56/1440535856.db2.gz	HHEUWPSKTNKVCB-OAHLLOKOSA-N	0	3	331.485	3.304	20	30		EGEDHN
CCN(CCNCc1ccc(F)c(C#N)c1)C(=O)C[C@@H](C)C1CC1	ZINC001754085307	1440540062	/nfs/dbraw/zinc/54/00/62/1440540062.db2.gz	XNOUOURDSXWXJV-CQSZACIVSA-N	0	3	331.435	3.072	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC/C=C/CNCc1cccc2c1CCOC2	ZINC001754166598	1440546558	/nfs/dbraw/zinc/54/65/58/1440546558.db2.gz	PDZMVMUMIKFVST-BXKJMJEDSA-N	0	3	342.483	3.124	20	30		EGEDHN
Cc1cc(C)c(C(=O)N[C@H](C)CNCC#Cc2ccc(Cl)cc2)[nH]1	ZINC001754232125	1440554198	/nfs/dbraw/zinc/55/41/98/1440554198.db2.gz	WWVXIUQPDJDVIB-OAHLLOKOSA-N	0	3	343.858	3.045	20	30		EGEDHN
CCc1cccc(CC(=O)N[C@H](C)CNCc2ccc(C#N)s2)c1	ZINC001754232047	1440554300	/nfs/dbraw/zinc/55/43/00/1440554300.db2.gz	VWRXNNDSXGQNDV-CQSZACIVSA-N	0	3	341.480	3.019	20	30		EGEDHN
C[C@H](CNCC#Cc1ccc(Cl)cc1)NC(=O)C1(C)CC=CC1	ZINC001754241408	1440555818	/nfs/dbraw/zinc/55/58/18/1440555818.db2.gz	ISLKCERHXWIEEH-OAHLLOKOSA-N	0	3	330.859	3.142	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)NC(=O)[C@@H]1CC[C@@H]2C[C@@H]2CC1	ZINC001754284149	1440563771	/nfs/dbraw/zinc/56/37/71/1440563771.db2.gz	VRJPTAAERHUBQB-ZQDZILKHSA-N	0	3	331.485	3.040	20	30		EGEDHN
CCc1cccc(CC(=O)N[C@@H](C)CN(C)Cc2cccc(C#N)c2)c1	ZINC001754315412	1440575211	/nfs/dbraw/zinc/57/52/11/1440575211.db2.gz	VITPXDLJRJQEBY-KRWDZBQOSA-N	0	3	349.478	3.300	20	30		EGEDHN
C=C(Cl)CNCCCN(C)C(=O)Cc1ccc(F)c(Cl)c1	ZINC001754398683	1440595014	/nfs/dbraw/zinc/59/50/14/1440595014.db2.gz	SBADTQLUKXMFSE-UHFFFAOYSA-N	0	3	333.234	3.212	20	30		EGEDHN
O=C(CCC1CCC1)N[C@@H](CNCC#Cc1ccc(F)cc1)C1CC1	ZINC001754438453	1440598606	/nfs/dbraw/zinc/59/86/06/1440598606.db2.gz	YOWFHMQJFJWSRT-FQEVSTJZSA-N	0	3	342.458	3.242	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001754442946	1440599633	/nfs/dbraw/zinc/59/96/33/1440599633.db2.gz	NBFKLIWKESDYQL-SFHVURJKSA-N	0	3	343.446	3.284	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H](CNCC#Cc1ccc(F)cc1)C1CC1	ZINC001754447350	1440600221	/nfs/dbraw/zinc/60/02/21/1440600221.db2.gz	CNWBFAMAVZEZBH-LJQANCHMSA-N	0	3	342.458	3.264	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H]1CCN1C[C@@H]1CCCC(F)(F)C1	ZINC001754480841	1440607428	/nfs/dbraw/zinc/60/74/28/1440607428.db2.gz	MZNJJQJMAKMZDT-CVEARBPZSA-N	0	3	326.431	3.196	20	30		EGEDHN
C=CCCCN1CC[C@@H]1CNC(=O)CCc1cc(Cl)cs1	ZINC001754496334	1440612237	/nfs/dbraw/zinc/61/22/37/1440612237.db2.gz	UOZPUSUDYYIWIT-CQSZACIVSA-N	0	3	326.893	3.491	20	30		EGEDHN
C=CCC[C@@H](C)N1CC[C@@H]1CNC(=O)c1c(C)nn(CCC)c1C	ZINC001754497914	1440612945	/nfs/dbraw/zinc/61/29/45/1440612945.db2.gz	RNUYATIVTOPHNT-RHSMWYFYSA-N	0	3	332.492	3.069	20	30		EGEDHN
C=CCCCN1CC[C@H]1CNC(=O)c1c[nH]nc1C1CCCCC1	ZINC001754501639	1440614553	/nfs/dbraw/zinc/61/45/53/1440614553.db2.gz	ZMFQOPVPUQICOG-INIZCTEOSA-N	0	3	330.476	3.228	20	30		EGEDHN
CC(C)[C@@]1(C)C[C@H]1C(=O)NCC1(NCc2ccc(F)c(C#N)c2)CC1	ZINC001754530569	1440622337	/nfs/dbraw/zinc/62/23/37/1440622337.db2.gz	WNDDRIFMXXVHNB-QFBILLFUSA-N	0	3	343.446	3.118	20	30		EGEDHN
CC#CCCCC(=O)N1C[C@H]2CCC[C@@H](C1)N2CCC[C@H]1CCOC1	ZINC001754552221	1440630170	/nfs/dbraw/zinc/63/01/70/1440630170.db2.gz	CEZQYQPQIKIMET-SLFFLAALSA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@]2(C1)CCCN(Cc1cccc(C#N)c1)C2	ZINC001754556233	1440631536	/nfs/dbraw/zinc/63/15/36/1440631536.db2.gz	XINOIEWILFAZBR-QFIPXVFZSA-N	0	3	349.478	3.176	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC2(C1)CCN(Cc1ccc(F)cc1)CC2	ZINC001754560394	1440633619	/nfs/dbraw/zinc/63/36/19/1440633619.db2.gz	JZHSMQUKXKRZTH-UHFFFAOYSA-N	0	3	342.458	3.300	20	30		EGEDHN
CCC[C@H](C)C(=O)N1CC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001754563545	1440634537	/nfs/dbraw/zinc/63/45/37/1440634537.db2.gz	LQGABUXZAODKTR-UWJYYQICSA-N	0	3	339.483	3.419	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1CC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001754563544	1440634563	/nfs/dbraw/zinc/63/45/63/1440634563.db2.gz	LQGABUXZAODKTR-UTKZUKDTSA-N	0	3	339.483	3.419	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC001754610299	1440643788	/nfs/dbraw/zinc/64/37/88/1440643788.db2.gz	BSVYTUXOAHTLKB-KRWDZBQOSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=CCC1(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)s2)CCC1	ZINC001754616975	1440644620	/nfs/dbraw/zinc/64/46/20/1440644620.db2.gz	YRDAGCWYIPHEPT-HNNXBMFYSA-N	0	3	343.496	3.447	20	30		EGEDHN
C[C@H](CC(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1)C1CC1	ZINC001754629428	1440647272	/nfs/dbraw/zinc/64/72/72/1440647272.db2.gz	CCZQTXWBDIARFI-MRXNPFEDSA-N	0	3	339.483	3.465	20	30		EGEDHN
C#CCNC[C@H](NC(=O)c1coc(CC)n1)c1ccc2ccccc2c1	ZINC001754644653	1440649845	/nfs/dbraw/zinc/64/98/45/1440649845.db2.gz	WFQYHPIXTHKKBJ-SFHVURJKSA-N	0	3	347.418	3.084	20	30		EGEDHN
C=CCCOCC(=O)N1CCCC[C@]2(CCN(C/C=C/Cl)C2)C1	ZINC001754661725	1440655105	/nfs/dbraw/zinc/65/51/05/1440655105.db2.gz	KEECUFLPMAYMBN-AHKGRUIUSA-N	0	3	340.895	3.036	20	30		EGEDHN
C#CCCCC(=O)NC[C@]1(C)CCCN(Cc2ccc(C)nc2C)C1	ZINC001754726193	1440676342	/nfs/dbraw/zinc/67/63/42/1440676342.db2.gz	VVLRUWWXTOOZOI-NRFANRHFSA-N	0	3	341.499	3.220	20	30		EGEDHN
CC#CCN1CCC[C@](C)(CNC(=O)[C@H](C)OC2CCCCCC2)C1	ZINC001754729929	1440678376	/nfs/dbraw/zinc/67/83/76/1440678376.db2.gz	ABIDDAZFEQZBLF-GHTZIAJQSA-N	0	3	348.531	3.356	20	30		EGEDHN
CC#CCN1CCC[C@](C)(CNC(=O)[C@@H](CC)CC(F)(F)F)C1	ZINC001754731360	1440679411	/nfs/dbraw/zinc/67/94/11/1440679411.db2.gz	FBMIFHPPAVHMJW-GOEBONIOSA-N	0	3	332.410	3.207	20	30		EGEDHN
CC#CCN1CCC[C@](C)(CNC(=O)Cc2ccc(C)c(C)c2)C1	ZINC001754732898	1440680730	/nfs/dbraw/zinc/68/07/30/1440680730.db2.gz	FBPIGWBZBNTHQU-OAQYLSRUSA-N	0	3	326.484	3.088	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H]1CN(CCCCCF)CCC1(F)F	ZINC001754743286	1440683601	/nfs/dbraw/zinc/68/36/01/1440683601.db2.gz	IJJGMAPODDWOQU-CQSZACIVSA-N	0	3	334.426	3.412	20	30		EGEDHN
C=C(C)CN1CC[C@](O)(CNC(=O)C[C@@H](CC)c2ccc(C)cc2)C1	ZINC001754757326	1440685245	/nfs/dbraw/zinc/68/52/45/1440685245.db2.gz	IVBMRVFVISRYME-NQIIRXRSSA-N	0	3	344.499	3.008	20	30		EGEDHN
C=CCN[C@H](CNC(=O)[C@@H](C)n1cccc1)c1ccccc1CC	ZINC001754786309	1440687918	/nfs/dbraw/zinc/68/79/18/1440687918.db2.gz	WUNGICVTRZBIDF-VQIMIIECSA-N	0	3	325.456	3.245	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H](NC[C@@H](C)O)c2ccccc2CC)CC1	ZINC001754792259	1440688685	/nfs/dbraw/zinc/68/86/85/1440688685.db2.gz	ZLGDWTVEOFUFBC-UZLBHIALSA-N	0	3	344.499	3.123	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCN(C(=O)c2ccnc(C3CC3)c2)C1	ZINC001754922188	1440709421	/nfs/dbraw/zinc/70/94/21/1440709421.db2.gz	LQHDLTMXFALBNC-AWEZNQCLSA-N	0	3	333.863	3.153	20	30		EGEDHN
C#CCN[C@@H](C)c1ccc(CNC(=O)c2c3c[nH]nc3ccc2C)cc1	ZINC001754947538	1440713804	/nfs/dbraw/zinc/71/38/04/1440713804.db2.gz	OFMVVVOUOHUTQL-HNNXBMFYSA-N	0	3	346.434	3.085	20	30		EGEDHN
CC#CCN[C@@H](C)c1ccc(CNC(=O)CC(C)(C)COC)cc1	ZINC001754948916	1440714399	/nfs/dbraw/zinc/71/43/99/1440714399.db2.gz	RWUZOVKMCFMJLJ-INIZCTEOSA-N	0	3	330.472	3.039	20	30		EGEDHN
C#CCCN(C)Cc1ccccc1CNC(=O)C(C)(C)C(C)(F)F	ZINC001754955261	1440716161	/nfs/dbraw/zinc/71/61/61/1440716161.db2.gz	YZSNIADVXCFGMA-UHFFFAOYSA-N	0	3	336.426	3.439	20	30		EGEDHN
Cc1ccc(CN2CCc3c(CNC(=O)[C@H](C)C#N)cccc3C2)cc1	ZINC001754973486	1440719243	/nfs/dbraw/zinc/71/92/43/1440719243.db2.gz	CDZMIPIGJLZGKF-QGZVFWFLSA-N	0	3	347.462	3.329	20	30		EGEDHN
C=C(C)CCN1CCc2c(CNC(=O)C(=O)C(C)(C)C)cccc2C1	ZINC001754974647	1440719519	/nfs/dbraw/zinc/71/95/19/1440719519.db2.gz	QYSGEBUIZQYPLR-UHFFFAOYSA-N	0	3	342.483	3.242	20	30		EGEDHN
CC[C@@H](C)CCCCC(=O)N[C@H]1CCCN(CC#CCOC)CC1	ZINC001755024664	1440728123	/nfs/dbraw/zinc/72/81/23/1440728123.db2.gz	GBHTXDLFYNJBEC-MOPGFXCFSA-N	0	3	336.520	3.213	20	30		EGEDHN
CCCCC[C@@H](CC)C(=O)N[C@@H]1CCCN(CC#CCOC)CC1	ZINC001755033799	1440733072	/nfs/dbraw/zinc/73/30/72/1440733072.db2.gz	FHEKTGZCULOBMN-RTBURBONSA-N	0	3	336.520	3.213	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC(CC)(NCc2nocc2C)CC1	ZINC001755071493	1440746726	/nfs/dbraw/zinc/74/67/26/1440746726.db2.gz	VYHYPQCIAFPCST-INIZCTEOSA-N	0	3	333.476	3.446	20	30		EGEDHN
C=CCCCN1Cc2ccccc2C[C@@H]1CNC(=O)Cc1ccoc1	ZINC001755075972	1440748715	/nfs/dbraw/zinc/74/87/15/1440748715.db2.gz	QPSXQDGMCFIYJK-HXUWFJFHSA-N	0	3	338.451	3.331	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@]2(CCN(Cc3ccc(F)cc3)C2)C1	ZINC001755077903	1440749601	/nfs/dbraw/zinc/74/96/01/1440749601.db2.gz	FERPDZABCBIFEN-NRFANRHFSA-N	0	3	342.458	3.444	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)NCc1ccc2c(c1)CN(CC/C=C\CC)C2	ZINC001755100817	1440752013	/nfs/dbraw/zinc/75/20/13/1440752013.db2.gz	HZZHHXDRFYAGDR-NGXITPROSA-N	0	3	342.483	3.302	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@H](OC)C3CCC3)cc2C1	ZINC001755102273	1440753504	/nfs/dbraw/zinc/75/35/04/1440753504.db2.gz	OUEMPGSZSCORPF-HXUWFJFHSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)[C@@H](c2cccnc2)C(C)C)C(C)(C)C1	ZINC001755141654	1440760883	/nfs/dbraw/zinc/76/08/83/1440760883.db2.gz	IUTNTNCWBOCNKW-ZWKOTPCHSA-N	0	3	329.488	3.224	20	30		EGEDHN
C=C(C)CCN1CC(N2CCN(C(=O)[C@@H](C)CCC(C)(C)C)CC2)C1	ZINC001755146080	1440762799	/nfs/dbraw/zinc/76/27/99/1440762799.db2.gz	JLOQZQXLGGJFRK-SFHVURJKSA-N	0	3	349.563	3.243	20	30		EGEDHN
C=CCCCN1CCOC2(CCN(C(=O)C[C@@H]3C=CCCC3)CC2)C1	ZINC001755174097	1440770112	/nfs/dbraw/zinc/77/01/12/1440770112.db2.gz	JMJKNRIBIXJYTM-LJQANCHMSA-N	0	3	346.515	3.392	20	30		EGEDHN
COCC#CCN1CCC2(CC1)CCN(C(=O)[C@@H](C)C(C)(C)C)CC2	ZINC001755175854	1440770782	/nfs/dbraw/zinc/77/07/82/1440770782.db2.gz	JYWAUTWHMWIBNG-GOSISDBHSA-N	0	3	348.531	3.023	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC(CN(CC)Cc2cncn2C)CC1	ZINC001755183853	1440771985	/nfs/dbraw/zinc/77/19/85/1440771985.db2.gz	IXOUNTUKJMTMKW-QGZVFWFLSA-N	0	3	346.519	3.083	20	30		EGEDHN
CS[C@@H](C)CC(=O)N1CCC[C@H]1CN(C)Cc1cccc(C#N)c1	ZINC001755191965	1440775189	/nfs/dbraw/zinc/77/51/89/1440775189.db2.gz	WSWGJCOXKBXWEV-YJBOKZPZSA-N	0	3	345.512	3.123	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCN1C(=O)CCc1ccc(OCC)cc1	ZINC001755193704	1440775701	/nfs/dbraw/zinc/77/57/01/1440775701.db2.gz	DZNXTQJPFKWOIP-GOSISDBHSA-N	0	3	330.472	3.127	20	30		EGEDHN
C=C(Cl)CNCC1CC(NC(=O)[C@H]2Cc3ccc(Cl)cc32)C1	ZINC001755221229	1440784673	/nfs/dbraw/zinc/78/46/73/1440784673.db2.gz	OSBNUBBFMIWMDI-INORYPFCSA-N	0	3	339.266	3.217	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H](C)[C@@H](C)NCc1cc(C)ccc1OC	ZINC001755248363	1440791277	/nfs/dbraw/zinc/79/12/77/1440791277.db2.gz	IRRIFWDGHQTKIQ-SJORKVTESA-N	0	3	330.472	3.180	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H](C)[C@@H](C)NCC#Cc1ccc(Cl)cc1	ZINC001755249568	1440791458	/nfs/dbraw/zinc/79/14/58/1440791458.db2.gz	QXWBTXDVRVXMKC-CABCVRRESA-N	0	3	332.875	3.387	20	30		EGEDHN
C[C@H](NCC#Cc1ccccc1)[C@H](C)NC(=O)C(C)(C)C(F)(F)F	ZINC001755262700	1440795037	/nfs/dbraw/zinc/79/50/37/1440795037.db2.gz	HOFNAGBHNNLZKA-KBPBESRZSA-N	0	3	340.389	3.109	20	30		EGEDHN
Cc1ccccc1CN1C[C@H](NC(=O)C#CC(C)(C)C)C(C)(C)C1	ZINC001755406082	1440844304	/nfs/dbraw/zinc/84/43/04/1440844304.db2.gz	BUQGJRMCWLFZRS-SFHVURJKSA-N	0	3	326.484	3.371	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN(CCOc2ccccc2)CC1(C)C	ZINC001755413934	1440847617	/nfs/dbraw/zinc/84/76/17/1440847617.db2.gz	MFWRNKHKEXJXQW-GOSISDBHSA-N	0	3	330.472	3.248	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3[C@@H](CNC(=O)C[C@H]4CC=CCC4)[C@@H]3C2)c1	ZINC001755427816	1440850654	/nfs/dbraw/zinc/85/06/54/1440850654.db2.gz	KQPAGAJXVXHXGD-LRGNLBRXSA-N	0	3	349.478	3.099	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2(CCc3ccccc3)CC2)C(C)(C)C1	ZINC001755432917	1440851478	/nfs/dbraw/zinc/85/14/78/1440851478.db2.gz	NECMHFXLXPLECM-IBGZPJMESA-N	0	3	338.495	3.249	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@@H]2CN(Cc3ccccc3C#N)C[C@@H]2C1	ZINC001755453753	1440854699	/nfs/dbraw/zinc/85/46/99/1440854699.db2.gz	SDTMUYJCTINPLY-QHAWAJNXSA-N	0	3	349.478	3.078	20	30		EGEDHN
C[C@H](CN(C)C(=O)C(F)=C1CCCC1)NCc1ccc(F)c(C#N)c1	ZINC001755581745	1440879552	/nfs/dbraw/zinc/87/95/52/1440879552.db2.gz	NJSRJFOTZUSULB-CYBMUJFWSA-N	0	3	347.409	3.431	20	30		EGEDHN
C[C@@H](CN(C)C(=O)c1sccc1F)NCc1ccc(C#N)c(F)c1	ZINC001755584886	1440880274	/nfs/dbraw/zinc/88/02/74/1440880274.db2.gz	GDRUNSYFZSFMAO-NSHDSACASA-N	0	3	349.406	3.148	20	30		EGEDHN
C=CC(C)(C)C(=O)N(C)C[C@H](C)NCc1cc(Cl)ccc1OC	ZINC001755600016	1440883700	/nfs/dbraw/zinc/88/37/00/1440883700.db2.gz	MJHYKGCWRPNXKY-ZDUSSCGKSA-N	0	3	338.879	3.497	20	30		EGEDHN
Cc1cccc(C(=O)N2CC[C@@H](NCC#Cc3ccccc3)[C@@H]2C)c1	ZINC001755648625	1440891217	/nfs/dbraw/zinc/89/12/17/1440891217.db2.gz	HDHMNVSVWSKMEE-GHTZIAJQSA-N	0	3	332.447	3.239	20	30		EGEDHN
Cc1cscc1C(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@H]1C	ZINC001755650629	1440891327	/nfs/dbraw/zinc/89/13/27/1440891327.db2.gz	OYIRCDDHVCKGIR-APWZRJJASA-N	0	3	338.476	3.301	20	30		EGEDHN
C[C@@H]1[C@H](NCC#Cc2ccccc2)CCN1C(=O)C1(F)CCCCC1	ZINC001755662934	1440892965	/nfs/dbraw/zinc/89/29/65/1440892965.db2.gz	BRTWYMFCCBVOMJ-IEBWSBKVSA-N	0	3	342.458	3.290	20	30		EGEDHN
Cc1ccsc1C(=O)N1C[C@H](NCC#Cc2ccccc2)C[C@H]1C	ZINC001755670120	1440893891	/nfs/dbraw/zinc/89/38/91/1440893891.db2.gz	PITJGDCTBMPEAP-SJLPKXTDSA-N	0	3	338.476	3.301	20	30		EGEDHN
C[C@H]1C[C@@H](NCc2cc(F)cc(F)c2)CN1C(=O)C#CC(C)(C)C	ZINC001755677990	1440894794	/nfs/dbraw/zinc/89/47/94/1440894794.db2.gz	FBQQERNUZWKYRA-SUMWQHHRSA-N	0	3	334.410	3.093	20	30		EGEDHN
CC#CCN1CC[C@]2(NC(=O)C/C=C/c3ccc(F)cc3)CCC[C@@H]12	ZINC001755700008	1440899564	/nfs/dbraw/zinc/89/95/64/1440899564.db2.gz	BPUXJHKCGGKVSH-KPMVZVDBSA-N	0	3	340.442	3.366	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)CCOCc2ccccc2)[C@@H]1C	ZINC001755719579	1440906797	/nfs/dbraw/zinc/90/67/97/1440906797.db2.gz	AMCULKNQPQAJTA-HKUYNNGSSA-N	0	3	330.472	3.139	20	30		EGEDHN
C=CCCC(=O)N1C[C@H](NCc2ccc(OC)c(F)c2)C(C)(C)C1	ZINC001755752237	1440913442	/nfs/dbraw/zinc/91/34/42/1440913442.db2.gz	FPXGJMCUAJDOSL-KRWDZBQOSA-N	0	3	334.435	3.127	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1C[C@@H](NCc2ccccc2F)C(C)(C)C1	ZINC001755752260	1440913459	/nfs/dbraw/zinc/91/34/59/1440913459.db2.gz	GAVNJCIRDMGYGN-MAUKXSAKSA-N	0	3	348.462	3.134	20	30		EGEDHN
C#CCCN(C)CCN(C(=O)Cc1ccc(Cl)s1)C(C)C	ZINC001755814440	1440922582	/nfs/dbraw/zinc/92/25/82/1440922582.db2.gz	CAJIQFFOMAGPTQ-UHFFFAOYSA-N	0	3	326.893	3.136	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H](CNCc1cncc(F)c1)C(C)(C)C	ZINC001755829361	1440928349	/nfs/dbraw/zinc/92/83/49/1440928349.db2.gz	AYRFPCKKAPQKMH-KRWDZBQOSA-N	0	3	333.451	3.035	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H](CNCc1cncc(F)c1)C(C)(C)C	ZINC001755831329	1440928660	/nfs/dbraw/zinc/92/86/60/1440928660.db2.gz	XHWGNMPTGVNGHJ-PBHICJAKSA-N	0	3	335.467	3.444	20	30		EGEDHN
CCC1(C(=O)N(C)C2CC(NCC#Cc3ccc(Cl)cc3)C2)CC1	ZINC001755861291	1440936714	/nfs/dbraw/zinc/93/67/14/1440936714.db2.gz	OWQKFNRYDPYXHO-UHFFFAOYSA-N	0	3	344.886	3.461	20	30		EGEDHN
CN(C(=O)C1CCC=CCC1)C1CC(NCC#Cc2ccccc2)C1	ZINC001755864923	1440937558	/nfs/dbraw/zinc/93/75/58/1440937558.db2.gz	INCJCXGIMZZAPM-UHFFFAOYSA-N	0	3	336.479	3.364	20	30		EGEDHN
C=C(Cl)Cn1c(N2CCN(C(C)(C)C)CC2)nnc1C(C)(C)C	ZINC001760388352	1441368177	/nfs/dbraw/zinc/36/81/77/1441368177.db2.gz	RRFRLLPLQWEEKG-UHFFFAOYSA-N	0	3	339.915	3.249	20	30		EGEDHN
C[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)c1cccc(C#N)c1	ZINC000181638545	234263796	/nfs/dbraw/zinc/26/37/96/234263796.db2.gz	OVKMYJWLIKYJPL-UWJYYQICSA-N	0	3	347.462	3.443	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1	ZINC000130410606	223150223	/nfs/dbraw/zinc/15/02/23/223150223.db2.gz	QEAWDLMYOHMSOV-LJQANCHMSA-N	0	3	337.379	3.164	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc3c(c2)C(=O)CCC3)CC1	ZINC000078811183	217127037	/nfs/dbraw/zinc/12/70/37/217127037.db2.gz	IABHFEWGFQVDSF-UHFFFAOYSA-N	0	3	341.455	3.368	20	30		EGEDHN
C=C(CN[C@H](C)c1ccc(S(C)(=O)=O)c(OC)c1)c1ccccc1	ZINC000268809094	252260816	/nfs/dbraw/zinc/26/08/16/252260816.db2.gz	IJOIERLKIBWDIR-OAHLLOKOSA-N	0	3	345.464	3.463	20	30		EGEDHN
COc1ccccc1[C@@H](CNCc1ccc(C#N)o1)N1CCCCC1	ZINC000174282248	532974073	/nfs/dbraw/zinc/97/40/73/532974073.db2.gz	QBFMBTJKPUWZTN-LJQANCHMSA-N	0	3	339.439	3.477	20	30		EGEDHN
Cc1cc(C#N)ccc1C(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000328628373	258030938	/nfs/dbraw/zinc/03/09/38/258030938.db2.gz	NRVVAPRENAJOFP-ICSRJNTNSA-N	0	3	348.450	3.027	20	30		EGEDHN
C[C@@H](N[C@@H]1CC(=O)N(c2c(F)cccc2F)C1)c1cccc(C#N)c1	ZINC000181916088	533515908	/nfs/dbraw/zinc/51/59/08/533515908.db2.gz	IIIDWVNGUJXGDI-IUODEOHRSA-N	0	3	341.361	3.293	20	30		EGEDHN
C[C@@H](N[C@H]1CN(Cc2ccccc2)CC[C@@H]1CO)c1cccc(C#N)c1	ZINC000181784649	533548041	/nfs/dbraw/zinc/54/80/41/533548041.db2.gz	LJUZYHQDSZUATK-YHYVQYDKSA-N	0	3	349.478	3.092	20	30		EGEDHN
C[C@@H](NCc1ccccc1Cn1cncn1)c1ccc(C#N)c(F)c1	ZINC000337816731	141061570	/nfs/dbraw/zinc/06/15/70/141061570.db2.gz	OYWVPXIUJMKQGI-CQSZACIVSA-N	0	3	335.386	3.188	20	30		EGEDHN
CO[C@@H]1[C@H](C)[C@H](N[C@H](C)C(=O)Nc2ccc(C#N)c(Cl)c2)C1(C)C	ZINC000344471382	141159016	/nfs/dbraw/zinc/15/90/16/141159016.db2.gz	UWTYEWFSSRPXAL-NSLUBLRVSA-N	0	3	349.862	3.188	20	30		EGEDHN
C[C@H](NC(=O)C1(c2cccc(C#N)c2)CC1)[C@H](c1ccccc1)N(C)C	ZINC000356233334	141324511	/nfs/dbraw/zinc/32/45/11/141324511.db2.gz	PTSIMJRFXSOKHD-OXJNMPFZSA-N	0	3	347.462	3.397	20	30		EGEDHN
CC(C)[C@]1(C)C[C@@H]1C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000185607631	144116051	/nfs/dbraw/zinc/11/60/51/144116051.db2.gz	KCGTXYXQFWAGPX-QUCCMNQESA-N	0	3	327.472	3.131	20	30		EGEDHN
N#Cc1ccc(OCCCN2CC[C@@]3(C2)OCc2ccccc23)cc1	ZINC000186666350	144140485	/nfs/dbraw/zinc/14/04/85/144140485.db2.gz	AGZPHQAYMJBEBO-NRFANRHFSA-N	0	3	334.419	3.459	20	30		EGEDHN
C[C@H]1[C@@H](c2ccccc2)CCN1CC(=O)NCc1ccc(C#N)cc1	ZINC000374202094	144531906	/nfs/dbraw/zinc/53/19/06/144531906.db2.gz	ZBWGRXVSJIHRCP-JXFKEZNVSA-N	0	3	333.435	3.052	20	30		EGEDHN
N#Cc1ccc([C@@H](NCC2(c3ccccc3)CCCC2)C(N)=O)cc1	ZINC000115596010	152020749	/nfs/dbraw/zinc/02/07/49/152020749.db2.gz	UIUXOXRRYUBSAA-LJQANCHMSA-N	0	3	333.435	3.186	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H](O)COc1ccccc1Cl	ZINC000192707039	153254660	/nfs/dbraw/zinc/25/46/60/153254660.db2.gz	UPGLSFIDDOVUGB-MRXNPFEDSA-N	0	3	330.815	3.083	20	30		EGEDHN
COCCN(C)CC[C@H](NCc1ccc(C#N)cc1)c1ccccc1	ZINC000348847948	156260571	/nfs/dbraw/zinc/26/05/71/156260571.db2.gz	IPQXQXGOUXYZHR-NRFANRHFSA-N	0	3	337.467	3.357	20	30		EGEDHN
COCCN(C)CC[C@@H](NCc1cccc(C#N)c1)c1ccccc1	ZINC000348848525	156261185	/nfs/dbraw/zinc/26/11/85/156261185.db2.gz	MQMQKJYDSHBRGR-OAQYLSRUSA-N	0	3	337.467	3.357	20	30		EGEDHN
CN(C)CCN(Cc1cc(C#N)cs1)Cc1ccc(F)c(F)c1	ZINC000349034382	156325404	/nfs/dbraw/zinc/32/54/04/156325404.db2.gz	COKJJZBOTCLGLC-UHFFFAOYSA-N	0	3	335.423	3.462	20	30		EGEDHN
N#Cc1cc(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)ccc1F	ZINC000345629518	164230365	/nfs/dbraw/zinc/23/03/65/164230365.db2.gz	NMRZOJFUEFNOMZ-IBGZPJMESA-N	0	3	337.398	3.264	20	30		EGEDHN
CCN1C[C@@H](C)N(Cc2ccc(C#N)cc2Br)C[C@@H]1C	ZINC000350991620	165089083	/nfs/dbraw/zinc/08/90/83/165089083.db2.gz	ONFJQCIERDDERV-QWHCGFSZSA-N	0	3	336.277	3.235	20	30		EGEDHN
N#Cc1ccc([C@H](NCC2(Cc3ccccc3)CCCC2)C(N)=O)cc1	ZINC000351910934	165147092	/nfs/dbraw/zinc/14/70/92/165147092.db2.gz	SVLNCUQMIRWKGO-FQEVSTJZSA-N	0	3	347.462	3.477	20	30		EGEDHN
CCN1CCN(Cc2ccc(NCc3cccc(C#N)c3)cc2)CC1	ZINC000122488675	222098942	/nfs/dbraw/zinc/09/89/42/222098942.db2.gz	BYDMDBAZXVWUFC-UHFFFAOYSA-N	0	3	334.467	3.308	20	30		EGEDHN
C[C@H](CNc1ccc(Cl)c(C#N)n1)N1CCc2ccccc2C1	ZINC000301187710	269873431	/nfs/dbraw/zinc/87/34/31/269873431.db2.gz	WFHDTNHJCYRBBY-CYBMUJFWSA-N	0	3	326.831	3.465	20	30		EGEDHN
Cc1ccc([C@@H](O)CN2CCCN(Cc3ccc(C#N)cc3)CC2)cc1	ZINC000174710203	265067634	/nfs/dbraw/zinc/06/76/34/265067634.db2.gz	IMVCUGGTPCBGLN-QFIPXVFZSA-N	0	3	349.478	3.108	20	30		EGEDHN
C#C[C@H](NC(=O)C(C#N)Cc1ccc(C#N)cc1)c1ccc(Cl)cc1	ZINC000491712721	270058038	/nfs/dbraw/zinc/05/80/38/270058038.db2.gz	AFFKCBXCOXLCCY-HKUYNNGSSA-N	0	3	347.805	3.385	20	30		EGEDHN
CCCN(CCN1CCCC1)C(=O)Nc1ccc(COC)c(C#N)c1	ZINC000529205042	270060530	/nfs/dbraw/zinc/06/05/30/270060530.db2.gz	AVSHGGOYSRFGMA-UHFFFAOYSA-N	0	3	344.459	3.044	20	30		EGEDHN
N#Cc1ccc(N2CC[C@@H](N3CC[C@H](Cc4ccccc4)C3)C2=O)cc1	ZINC000533293200	270060684	/nfs/dbraw/zinc/06/06/84/270060684.db2.gz	BNRBJSKYEPYFDK-TZIWHRDSSA-N	0	3	345.446	3.228	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)C(C#N)Cc2ccc(C#N)cc2)cc1	ZINC000359104327	265627608	/nfs/dbraw/zinc/62/76/08/265627608.db2.gz	HVPGTEAPVAPQMF-LJQANCHMSA-N	0	3	345.402	3.122	20	30		EGEDHN
CN(CCSCC(=O)Nc1cccc(C#N)c1)Cc1ccccc1	ZINC000193628738	266048217	/nfs/dbraw/zinc/04/82/17/266048217.db2.gz	MAUDZTUJLGNSEZ-UHFFFAOYSA-N	0	3	339.464	3.362	20	30		EGEDHN
CN(CCSCC(=O)Nc1ccc(C#N)cc1)Cc1ccccc1	ZINC000193625496	266048366	/nfs/dbraw/zinc/04/83/66/266048366.db2.gz	CJAGPGAFYFROHK-UHFFFAOYSA-N	0	3	339.464	3.362	20	30		EGEDHN
CCOCc1ccccc1CNC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000279784040	266287536	/nfs/dbraw/zinc/28/75/36/266287536.db2.gz	URHJACOJQVBUDT-FQEVSTJZSA-N	0	3	347.418	3.093	20	30		EGEDHN
CCO[C@@H](CNC(=O)C(C#N)Cc1ccc(C#N)cc1)c1ccccc1	ZINC000279912261	266289110	/nfs/dbraw/zinc/28/91/10/266289110.db2.gz	FJPNEHGMAXOHRB-UXHICEINSA-N	0	3	347.418	3.135	20	30		EGEDHN
C[C@H](c1ccncc1)N1CCC(NCc2ccc(C#N)cc2F)CC1	ZINC000269634824	266331893	/nfs/dbraw/zinc/33/18/93/266331893.db2.gz	VNWOVHKRILJGKJ-OAHLLOKOSA-N	0	3	338.430	3.408	20	30		EGEDHN
CCS[C@@H]1CC[C@@H](N(C)C(=O)C(C#N)Cc2ccc(C#N)cc2)C1	ZINC000348320673	266347693	/nfs/dbraw/zinc/34/76/93/266347693.db2.gz	NXNSBDTYJADFNV-RCCFBDPRSA-N	0	3	341.480	3.373	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1Nc1ccc(C#N)cc1[N+](=O)[O-]	ZINC000302187485	267056662	/nfs/dbraw/zinc/05/66/62/267056662.db2.gz	WHQAGMZWDFAGJE-KDOFPFPSSA-N	0	3	336.395	3.399	20	30		EGEDHN
C[C@@H]1COc2ccccc2CN1C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000280019283	267072106	/nfs/dbraw/zinc/07/21/06/267072106.db2.gz	MLGBREXPICFWKS-BEFAXECRSA-N	0	3	345.402	3.050	20	30		EGEDHN
C[C@@H]1[C@@H](NC(=O)NCc2cccc(C#N)c2)CCN1Cc1ccccc1	ZINC000287142302	267106353	/nfs/dbraw/zinc/10/63/53/267106353.db2.gz	PVUHYYQCEIPGEW-UZLBHIALSA-N	0	3	348.450	3.020	20	30		EGEDHN
C[C@H](CC(=O)N1CCCCCC1)NC1(c2cccc(C#N)c2)CC1	ZINC000272309098	267146482	/nfs/dbraw/zinc/14/64/82/267146482.db2.gz	SUOGFKYMQDCWQL-MRXNPFEDSA-N	0	3	325.456	3.318	20	30		EGEDHN
CCO[C@@H]1C[C@H](NCC(=O)Nc2ccc(C#N)c(Cl)c2)C12CCC2	ZINC000451480297	267152629	/nfs/dbraw/zinc/15/26/29/267152629.db2.gz	OLQCQBVLGCOIES-JKSUJKDBSA-N	0	3	347.846	3.087	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@@H]1Nc1nc2ccccn2c1C#N	ZINC000302175221	267234827	/nfs/dbraw/zinc/23/48/27/267234827.db2.gz	NYTUHYAIWTWTCQ-RDJZCZTQSA-N	0	3	331.423	3.138	20	30		EGEDHN
CN(C)[C@@H](CNC(=O)CSc1ccccc1C#N)c1ccccc1	ZINC000439695374	267286468	/nfs/dbraw/zinc/28/64/68/267286468.db2.gz	PYFFJQZXRKGKQL-KRWDZBQOSA-N	0	3	339.464	3.069	20	30		EGEDHN
CN(C)[C@H](CC(=O)NCc1ccc(C#N)c(F)c1)c1ccccc1	ZINC000416242578	267287736	/nfs/dbraw/zinc/28/77/36/267287736.db2.gz	GJOVJDZVONYMKA-GOSISDBHSA-N	0	3	325.387	3.007	20	30		EGEDHN
CN(C)[C@]1(CNc2nc3c(cc2C#N)CCCC3(C)C)CCSC1	ZINC000428148962	267290777	/nfs/dbraw/zinc/29/07/77/267290777.db2.gz	ZFQLUXJZDNHSKW-IBGZPJMESA-N	0	3	344.528	3.416	20	30		EGEDHN
Cc1cc(C)cc(CCNC(=O)C(C#N)Cc2ccc(C#N)cc2)c1	ZINC000280557174	267321236	/nfs/dbraw/zinc/32/12/36/267321236.db2.gz	USWQLEGSYXXGRT-FQEVSTJZSA-N	0	3	331.419	3.216	20	30		EGEDHN
Cc1ccc([C@H]2CCN(Cc3cnc4c(C#N)cnn4c3)C2)c(C)c1	ZINC000519651925	268046002	/nfs/dbraw/zinc/04/60/02/268046002.db2.gz	HQDHNSQLSUZYON-KRWDZBQOSA-N	0	3	331.423	3.207	20	30		EGEDHN
Cc1cccc([C@H](C)CNC(=O)C(C#N)Cc2ccc(C#N)cc2)c1	ZINC000470972903	268057532	/nfs/dbraw/zinc/05/75/32/268057532.db2.gz	BIDGUOVGYSUZJR-UZLBHIALSA-N	0	3	331.419	3.469	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCCSc2ccccc2)cc1	ZINC000347982932	268090418	/nfs/dbraw/zinc/09/04/18/268090418.db2.gz	FUANANZUUGJKSV-QGZVFWFLSA-N	0	3	335.432	3.149	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCc2ccc(Cl)cc2F)cc1	ZINC000348504936	268090546	/nfs/dbraw/zinc/09/05/46/268090546.db2.gz	DEYYFDOCEBZFTF-OAHLLOKOSA-N	0	3	341.773	3.349	20	30		EGEDHN
Cn1ncc(Cl)c1CNC1CCC(Oc2ccccc2C#N)CC1	ZINC000436235421	268134800	/nfs/dbraw/zinc/13/48/00/268134800.db2.gz	YJNCIYYVCSQIIS-UHFFFAOYSA-N	0	3	344.846	3.425	20	30		EGEDHN
N#Cc1cccc(C2(NC[C@@H](O)COc3ccccc3Cl)CC2)c1	ZINC000271819832	268241090	/nfs/dbraw/zinc/24/10/90/268241090.db2.gz	RXROJNBMUROWQW-MRXNPFEDSA-N	0	3	342.826	3.230	20	30		EGEDHN
N#Cc1ccc([C@H](NC[C@@H]2CCC[C@@H](C(F)(F)F)C2)C(N)=O)cc1	ZINC000437155648	268263526	/nfs/dbraw/zinc/26/35/26/268263526.db2.gz	PWTYYXNGTAUFNU-YUELXQCFSA-N	0	3	339.361	3.043	20	30		EGEDHN
N#Cc1ccccc1NC(=O)CCN1CCC[C@H](c2ccncc2)C1	ZINC000298437100	268278215	/nfs/dbraw/zinc/27/82/15/268278215.db2.gz	GSKCZPVBFHFHPM-SFHVURJKSA-N	0	3	334.423	3.161	20	30		EGEDHN
N#Cc1ccnc(SC[C@@H]2CN(Cc3ccccc3)CCCO2)c1	ZINC000278586051	268299729	/nfs/dbraw/zinc/29/97/29/268299729.db2.gz	PIMKNTXYYPOLIG-SFHVURJKSA-N	0	3	339.464	3.336	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CN1CCC[C@@H]1c1cccs1	ZINC000528339811	268300550	/nfs/dbraw/zinc/30/05/50/268300550.db2.gz	QHAWAWIRLOLFDT-HZPDHXFCSA-N	0	3	328.437	3.197	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CN1CCC[C@H]1c1cccs1	ZINC000528339805	268300950	/nfs/dbraw/zinc/30/09/50/268300950.db2.gz	QHAWAWIRLOLFDT-CVEARBPZSA-N	0	3	328.437	3.197	20	30		EGEDHN
CC(C)(C)[C@@H](CCO)NCc1ccc(Br)cc1C#N	ZINC000287855447	276163896	/nfs/dbraw/zinc/16/38/96/276163896.db2.gz	RLIRCJOZWSFCLU-CQSZACIVSA-N	0	3	325.250	3.207	20	30		EGEDHN
N#Cc1ccc(NCC2CCN(c3ccncc3)CC2)cc1[N+](=O)[O-]	ZINC000290880529	276554886	/nfs/dbraw/zinc/55/48/86/276554886.db2.gz	BVZARMKXKBFRPV-UHFFFAOYSA-N	0	3	337.383	3.190	20	30		EGEDHN
C[C@H](N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)c1ccc(C#N)cc1	ZINC000181638373	278269130	/nfs/dbraw/zinc/26/91/30/278269130.db2.gz	DXRMVUYGPKPROO-UWJYYQICSA-N	0	3	347.462	3.443	20	30		EGEDHN
COc1cccc(CN(CCN(C)C)Cc2ccc(C#N)c(C)c2)c1	ZINC000349408870	295296377	/nfs/dbraw/zinc/29/63/77/295296377.db2.gz	QRUMZMSZEGSMGO-UHFFFAOYSA-N	0	3	337.467	3.439	20	30		EGEDHN
N#Cc1ccccc1CSCCNCc1cccc2c1OCCO2	ZINC000054172820	307337171	/nfs/dbraw/zinc/33/71/71/307337171.db2.gz	UMIAWTYTYVDBIL-UHFFFAOYSA-N	0	3	340.448	3.352	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)CN1CCCCC1	ZINC000079292342	307424732	/nfs/dbraw/zinc/42/47/32/307424732.db2.gz	WPJFVTRSLJGBQH-QGZVFWFLSA-N	0	3	342.487	3.354	20	30		EGEDHN
Cc1ccc(CN(CCN(C)C)C(=O)c2ccc(C#N)c(Cl)c2)o1	ZINC000158747383	307863233	/nfs/dbraw/zinc/86/32/33/307863233.db2.gz	LHAZWDGRKIEMSX-UHFFFAOYSA-N	0	3	345.830	3.317	20	30		EGEDHN
C[C@@H](NCC(=O)NCc1cccc(C#N)c1)C(C)(C)c1ccccc1	ZINC000539256172	314303565	/nfs/dbraw/zinc/30/35/65/314303565.db2.gz	WCAUZVNECUZPQX-MRXNPFEDSA-N	0	3	335.451	3.130	20	30		EGEDHN
CC[C@@H]1CN(Cc2cccc(OCc3cccc(C#N)c3)c2)C[C@H]1O	ZINC000539899869	314350262	/nfs/dbraw/zinc/35/02/62/314350262.db2.gz	XYJZXUHOHFKKAK-TZIWHRDSSA-N	0	3	336.435	3.340	20	30		EGEDHN
CC[C@H](N[C@@H]1CCCN(c2ccc(C#N)cc2F)C1)c1ccn(C)n1	ZINC000541734837	314483361	/nfs/dbraw/zinc/48/33/61/314483361.db2.gz	NVEPYCBQBSJECI-WBVHZDCISA-N	0	3	341.434	3.141	20	30		EGEDHN
N#Cc1cc(C(=O)N2CCC[C@H]2CN2CCCCC2)ccc1Cl	ZINC000542730157	314572829	/nfs/dbraw/zinc/57/28/29/314572829.db2.gz	SBHZNGVTWVQGMB-INIZCTEOSA-N	0	3	331.847	3.302	20	30		EGEDHN
N#Cc1cccc(CNC[C@H](O)CO[C@H]2CCCc3ccccc32)c1	ZINC000564844044	316215559	/nfs/dbraw/zinc/21/55/59/316215559.db2.gz	HSYFGJOMYNUCLZ-FPOVZHCZSA-N	0	3	336.435	3.103	20	30		EGEDHN
Cc1ccc(Cl)c(OC[C@H](O)CNCc2ccc(C#N)s2)c1	ZINC000564856531	316219894	/nfs/dbraw/zinc/21/98/94/316219894.db2.gz	HMFONFHXEVARBT-GFCCVEGCSA-N	0	3	336.844	3.111	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)N(CCN(C)C)Cc2cccc(C#N)c2)CC1	ZINC000567993220	316707282	/nfs/dbraw/zinc/70/72/82/316707282.db2.gz	IQDLTERCZMMJSA-RUCARUNLSA-N	0	3	327.472	3.275	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)NC[C@H](CN(C)C)c1ccc(Cl)cc1	ZINC000568040138	316713898	/nfs/dbraw/zinc/71/38/98/316713898.db2.gz	BTOLYUSGHWPDAE-CQSZACIVSA-N	0	3	345.830	3.188	20	30		EGEDHN
C[C@H](N[C@H]1CCC[C@H](N2CCCC2=O)C1)c1ccc(C#N)cc1F	ZINC000572497853	317348516	/nfs/dbraw/zinc/34/85/16/317348516.db2.gz	ACCMWXYHJCEJKI-BPUTZDHNSA-N	0	3	329.419	3.282	20	30		EGEDHN
CCc1ccc(CC(=O)N(CCN(C)C)Cc2cccc(C#N)c2)cc1	ZINC000172849741	323290421	/nfs/dbraw/zinc/29/04/21/323290421.db2.gz	WOZBRHJJWOFMKU-UHFFFAOYSA-N	0	3	349.478	3.254	20	30		EGEDHN
C[C@H](NC1(CNCc2ccc(C#N)o2)CCOCC1)c1ccccc1	ZINC000174419227	323306365	/nfs/dbraw/zinc/30/63/65/323306365.db2.gz	NQMRLJBESMTMPF-INIZCTEOSA-N	0	3	339.439	3.141	20	30		EGEDHN
CN(C1Cc2ccccc2C1)[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000578721489	325007687	/nfs/dbraw/zinc/00/76/87/325007687.db2.gz	NLKNSLDQHQPLBU-NRFANRHFSA-N	0	3	345.446	3.153	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](NC[C@@H]3C[C@@H]3c3ccccc3)C2=O)cc1	ZINC000579123139	325066358	/nfs/dbraw/zinc/06/63/58/325066358.db2.gz	GWMXSJPNVASDPI-HBMCJLEFSA-N	0	3	345.446	3.052	20	30		EGEDHN
CC(C)(C)N1C[C@@H](C(=O)N[C@@](C)(C#N)C(C)(C)C)[C@H](C(F)(F)F)C1	ZINC000410677635	457657939	/nfs/dbraw/zinc/65/79/39/457657939.db2.gz	SSWDMCHQLCGWPG-HSMVNMDESA-N	0	3	347.425	3.340	20	30		EGEDHN
CCCCN(C)C(=O)C1CCN(Cc2ccc(OCC#N)cc2)CC1	ZINC000264530815	455231299	/nfs/dbraw/zinc/23/12/99/455231299.db2.gz	DOSFKZJXAMFTLH-UHFFFAOYSA-N	0	3	343.471	3.059	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1sc(C)cc1OC)C(C)C	ZINC000505517144	458744889	/nfs/dbraw/zinc/74/48/89/458744889.db2.gz	WIIWDEQMNAAVNW-OAHLLOKOSA-N	0	3	336.501	3.494	20	30		EGEDHN
C[C@@H](N[C@@H](C)c1ccc(-c2ccncc2)cc1)C(=O)N(C)CCC#N	ZINC000180911013	455263416	/nfs/dbraw/zinc/26/34/16/455263416.db2.gz	SFASHXQNLUCECB-JKSUJKDBSA-N	0	3	336.439	3.160	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cccc(OCC=C(C)C)c2)CC1	ZINC000173578958	455309671	/nfs/dbraw/zinc/30/96/71/455309671.db2.gz	OYYAEWMTTAQXKK-UHFFFAOYSA-N	0	3	328.456	3.412	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CNCc1ccc(C2CCC2)cc1	ZINC000600734762	460583052	/nfs/dbraw/zinc/58/30/52/460583052.db2.gz	PZRPEJQTRISHKS-HXUWFJFHSA-N	0	3	336.435	3.355	20	30		EGEDHN
Cc1ccc2c(c1)[C@@H](N[C@@H]1CCN(Cc3ccc(C#N)cc3)C1=O)CC2	ZINC000190633816	455357750	/nfs/dbraw/zinc/35/77/50/455357750.db2.gz	TUEWZKLQMYDEAC-LEWJYISDSA-N	0	3	345.446	3.245	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CCOc2cc(F)ccc2C1	ZINC000600802843	460609927	/nfs/dbraw/zinc/60/99/27/460609927.db2.gz	ANZLDVMBHOPWEB-MRXNPFEDSA-N	0	3	338.382	3.319	20	30		EGEDHN
CC[C@H](NC[C@@H](O)COc1ccc(C#N)cc1)c1ccc(OC)cc1	ZINC000024590869	453739365	/nfs/dbraw/zinc/73/93/65/453739365.db2.gz	MDHVSUBUBBFZAD-XLIONFOSSA-N	0	3	340.423	3.047	20	30		EGEDHN
N#Cc1ccc(NCCCN2CCc3ccccc3C2)c([N+](=O)[O-])c1	ZINC000025497585	453774860	/nfs/dbraw/zinc/77/48/60/453774860.db2.gz	HSKUZSKUXHDPTC-UHFFFAOYSA-N	0	3	336.395	3.327	20	30		EGEDHN
CN(C[C@@H](O)COc1ccc(CC#N)cc1)[C@@H]1CCc2ccccc21	ZINC000029339445	453828375	/nfs/dbraw/zinc/82/83/75/453828375.db2.gz	FSPYLORDWVMIOP-WIYYLYMNSA-N	0	3	336.435	3.112	20	30		EGEDHN
CC[C@@H](CNC(=O)c1cccc(C#N)c1)N1CCc2ccccc2C1	ZINC000032446153	453873437	/nfs/dbraw/zinc/87/34/37/453873437.db2.gz	AMCADATYDIEAMP-FQEVSTJZSA-N	0	3	333.435	3.125	20	30		EGEDHN
CCOc1ccc(CN(C)CCC(=O)Nc2sccc2C#N)cc1	ZINC000032654907	453882156	/nfs/dbraw/zinc/88/21/56/453882156.db2.gz	LPANUFCVMOEUFS-UHFFFAOYSA-N	0	3	343.452	3.479	20	30		EGEDHN
C[C@@H]1C[C@@H]1[C@@H](NCC(=O)N[C@@](C)(C#N)C1CC1)c1ccc(Cl)cc1	ZINC000245874810	455390632	/nfs/dbraw/zinc/39/06/32/455390632.db2.gz	JZURBRWCTHFZNH-RNHZPVLASA-N	0	3	345.874	3.435	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccc(Br)c(F)c2)nc(C)n1	ZINC000067798052	453967266	/nfs/dbraw/zinc/96/72/66/453967266.db2.gz	ZXJDOVOVDNJNLB-NSHDSACASA-N	0	3	348.175	3.485	20	30		EGEDHN
C=CCNC(=O)[C@H](C)NCC1(c2ccc(OC)cc2)CCCCC1	ZINC000067986204	453986129	/nfs/dbraw/zinc/98/61/29/453986129.db2.gz	GUJABCMVXHNJCR-INIZCTEOSA-N	0	3	330.472	3.177	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2C[C@@H](c3ccc(F)cc3)C[C@H]2C)CC1	ZINC000076984258	454056940	/nfs/dbraw/zinc/05/69/40/454056940.db2.gz	XEIPVYZAYBYTCJ-WBVHZDCISA-N	0	3	345.462	3.364	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc3c(c2)OCCCO3)CC1	ZINC000069592892	454122822	/nfs/dbraw/zinc/12/28/22/454122822.db2.gz	YPUYVEISZILEDM-UHFFFAOYSA-N	0	3	345.443	3.010	20	30		EGEDHN
CC(=O)Nc1cccc(CNCc2ccc(N(C)CCC#N)cc2)c1	ZINC000069831288	454151420	/nfs/dbraw/zinc/15/14/20/454151420.db2.gz	BBOOLJWVRUBYPK-UHFFFAOYSA-N	0	3	336.439	3.285	20	30		EGEDHN
N#CCc1cccc(C(=O)N2CCN(CC3CCCCC3)CC2)c1	ZINC000070825995	454178679	/nfs/dbraw/zinc/17/86/79/454178679.db2.gz	ZCTDKUMXOVNVMA-UHFFFAOYSA-N	0	3	325.456	3.091	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)cc1)C[C@H](O)COCc1cccs1	ZINC000058397075	454198083	/nfs/dbraw/zinc/19/80/83/454198083.db2.gz	OTEFMLWOOFJGAQ-SFHVURJKSA-N	0	3	344.480	3.408	20	30		EGEDHN
CC(C)N(CC(=O)NCC#Cc1cccc(C(F)(F)F)c1)C1CC1	ZINC000078339659	454235806	/nfs/dbraw/zinc/23/58/06/454235806.db2.gz	OCWMAJPTJVMLMK-UHFFFAOYSA-N	0	3	338.373	3.046	20	30		EGEDHN
CC(C)[C@@H](NCC(=O)N[C@@](C)(C#N)C1CC1)c1ccc(Cl)cc1	ZINC000078396184	454247153	/nfs/dbraw/zinc/24/71/53/454247153.db2.gz	UYPAMOLDYZXPKW-MSOLQXFVSA-N	0	3	333.863	3.435	20	30		EGEDHN
C=C(C)CN(CC)C(=O)NCC(C)(C)N1CCc2ccccc2C1	ZINC000046987254	454310421	/nfs/dbraw/zinc/31/04/21/454310421.db2.gz	GZLFIQJURHGSIK-UHFFFAOYSA-N	0	3	329.488	3.431	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)CC1CCCCC1	ZINC000047010473	454318189	/nfs/dbraw/zinc/31/81/89/454318189.db2.gz	UUFIIPSMFJQCSH-UHFFFAOYSA-N	0	3	327.472	3.419	20	30		EGEDHN
N#Cc1cccc(OC2CCN(Cc3ccc4c[nH]nc4c3)CC2)c1	ZINC000120938661	454367404	/nfs/dbraw/zinc/36/74/04/454367404.db2.gz	VPEMXUYSIKOYKW-UHFFFAOYSA-N	0	3	332.407	3.478	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N[C@H](C)c1cccnc1)C(C)C	ZINC000079268998	454390465	/nfs/dbraw/zinc/39/04/65/454390465.db2.gz	WXNKZCMVAXORHI-AEFFLSMTSA-N	0	3	330.476	3.140	20	30		EGEDHN
CN(CCC#N)c1ccc(CNC(C)(C)C(=O)NCC(C)(C)C)cc1	ZINC000121121687	454393866	/nfs/dbraw/zinc/39/38/66/454393866.db2.gz	AZTAWHUGJXAOFX-UHFFFAOYSA-N	0	3	344.503	3.067	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(C#N)c1	ZINC000047671757	454397775	/nfs/dbraw/zinc/39/77/75/454397775.db2.gz	KZWIDFXRKCWPKL-UHFFFAOYSA-N	0	3	347.422	3.026	20	30		EGEDHN
C[C@H](C(=O)N(CCN(C)C)Cc1cccc(C#N)c1)c1ccccc1	ZINC000121268414	454413685	/nfs/dbraw/zinc/41/36/85/454413685.db2.gz	ULQIGYZOHYUBFZ-KRWDZBQOSA-N	0	3	335.451	3.252	20	30		EGEDHN
C=CCOCCCC(=O)NC[C@H](C(C)C)N1CCc2ccccc2C1	ZINC000079494197	454425700	/nfs/dbraw/zinc/42/57/00/454425700.db2.gz	ZEWWVMRJWBWGLF-HXUWFJFHSA-N	0	3	344.499	3.168	20	30		EGEDHN
COCCN(CCOc1ccccc1OC)Cc1ccc(C#N)cc1	ZINC000063753489	454444585	/nfs/dbraw/zinc/44/45/85/454444585.db2.gz	SVSYMUNQZNKKBU-UHFFFAOYSA-N	0	3	340.423	3.094	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H](C)c2ccc(C(F)(F)F)cc2)CC1	ZINC000048264936	454464472	/nfs/dbraw/zinc/46/44/72/454464472.db2.gz	HSQFYVHZKGCGPD-ZDUSSCGKSA-N	0	3	338.373	3.228	20	30		EGEDHN
Cc1cc(N2CCN(CC(C)(C)CCC#N)CC2)nc(C(C)C)n1	ZINC000121741937	454471887	/nfs/dbraw/zinc/47/18/87/454471887.db2.gz	OWIJMGROMRTKTQ-UHFFFAOYSA-N	0	3	329.492	3.360	20	30		EGEDHN
COC(=O)[C@H](C)[C@H](NCCOc1cccc(C#N)c1)c1ccccc1	ZINC000079923775	454499868	/nfs/dbraw/zinc/49/98/68/454499868.db2.gz	OIFNSZQUDMWETF-BEFAXECRSA-N	0	3	338.407	3.077	20	30		EGEDHN
CNC(=O)C(C#N)C(=O)COc1ccc(Cl)cc1C1CCCCC1	ZINC000102389126	454502811	/nfs/dbraw/zinc/50/28/11/454502811.db2.gz	CJZFEKHZOSWIQH-OAHLLOKOSA-N	0	3	348.830	3.221	20	30		EGEDHN
COCCN(CCC(=O)Nc1sccc1C#N)Cc1ccccc1	ZINC000048811738	454517095	/nfs/dbraw/zinc/51/70/95/454517095.db2.gz	NICHQQRTFGNUGO-UHFFFAOYSA-N	0	3	343.452	3.097	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)[C@@H]1CCOc2ccccc21)C(C)C	ZINC000102941950	454527398	/nfs/dbraw/zinc/52/73/98/454527398.db2.gz	INEOBSBGZXISLU-MOPGFXCFSA-N	0	3	342.483	3.368	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cc(Cl)ccc2NCCC)CC1	ZINC000122509553	454540197	/nfs/dbraw/zinc/54/01/97/454540197.db2.gz	VJTSAPJKDVMIRS-UHFFFAOYSA-N	0	3	333.863	3.446	20	30		EGEDHN
CCN(C[C@H](O)COCc1ccco1)[C@H](C)c1ccc(C#N)cc1	ZINC000065432989	454567456	/nfs/dbraw/zinc/56/74/56/454567456.db2.gz	PRAIWGFBDZGIEW-QAPCUYQASA-N	0	3	328.412	3.112	20	30		EGEDHN
C=CCOc1cccc(CN2CCC(OC[C@H]3CCCO3)CC2)c1	ZINC000122970227	454587543	/nfs/dbraw/zinc/58/75/43/454587543.db2.gz	MYVIXRHJEQKIGG-HXUWFJFHSA-N	0	3	331.456	3.411	20	30		EGEDHN
Cc1ccc(/C=C/C(=O)N(CCN(C)C)Cc2cccc(C#N)c2)o1	ZINC000065931277	454641279	/nfs/dbraw/zinc/64/12/79/454641279.db2.gz	BFSAUOFDWLOELB-MDZDMXLPSA-N	0	3	337.423	3.063	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)c1sccc1C#N)c1ccccc1	ZINC000052028819	454649000	/nfs/dbraw/zinc/64/90/00/454649000.db2.gz	KZTNXSCEUYBFPQ-MRXNPFEDSA-N	0	3	327.453	3.433	20	30		EGEDHN
C[C@H](NC(=O)N1CCC[C@@H]1CN1CCCCC1)c1cccc(C#N)c1	ZINC000074917429	454658602	/nfs/dbraw/zinc/65/86/02/454658602.db2.gz	BSVPMBKSPYUBFI-QFBILLFUSA-N	0	3	340.471	3.279	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCOc2cc(C)ccc2C)CC1	ZINC000106040659	454675817	/nfs/dbraw/zinc/67/58/17/454675817.db2.gz	PCMAFTMOWBXCDJ-UHFFFAOYSA-N	0	3	330.472	3.229	20	30		EGEDHN
N#CCCn1cc(CN2CCC[C@@H](CCO)C2)c(-c2ccccc2)n1	ZINC000093105891	454683206	/nfs/dbraw/zinc/68/32/06/454683206.db2.gz	CWUCKPVIMKCOQF-KRWDZBQOSA-N	0	3	338.455	3.058	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](CC)Cc2ccccc2)CC1	ZINC000106270591	454689432	/nfs/dbraw/zinc/68/94/32/454689432.db2.gz	MZDSMCCEUVFOFD-GOSISDBHSA-N	0	3	329.488	3.347	20	30		EGEDHN
CC[C@]1(NCC(=O)Nc2ccccc2SC[C@@H](C)C#N)CCOC1	ZINC000616866130	460648347	/nfs/dbraw/zinc/64/83/47/460648347.db2.gz	QGBCZNPWCACOBG-KSSFIOAISA-N	0	3	347.484	3.036	20	30		EGEDHN
C=CCOc1cccc(CN2CCC[C@@H](CNC(=O)C(C)C)C2)c1	ZINC000124127623	454700956	/nfs/dbraw/zinc/70/09/56/454700956.db2.gz	BTNMTSOVCPMXRN-SFHVURJKSA-N	0	3	330.472	3.236	20	30		EGEDHN
C=CCOc1cccc(CN2CCC[C@H](CNC(=O)CCC)C2)c1	ZINC000124219610	454706678	/nfs/dbraw/zinc/70/66/78/454706678.db2.gz	VFXFKXFSMONGRQ-GOSISDBHSA-N	0	3	330.472	3.380	20	30		EGEDHN
CCN(C[C@H]1CCN(Cc2ccccc2)C1)C(=O)NCCCCC#N	ZINC000176391760	454738243	/nfs/dbraw/zinc/73/82/43/454738243.db2.gz	PKWQFUUUYKUMEU-IBGZPJMESA-N	0	3	342.487	3.234	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2cc(C(CC)CC)no2)CC1	ZINC000176500595	454752510	/nfs/dbraw/zinc/75/25/10/454752510.db2.gz	GBQRBZITVLRYGE-UHFFFAOYSA-N	0	3	348.491	3.418	20	30		EGEDHN
N#C[C@H](NC(=O)c1cccc(CN2CCCC2)c1)C1CCCCC1	ZINC000176638951	454767025	/nfs/dbraw/zinc/76/70/25/454767025.db2.gz	HTWBAKDTZSUFPO-IBGZPJMESA-N	0	3	325.456	3.485	20	30		EGEDHN
C=C(Br)CNCC1CCN(C(=O)OC(C)(C)C)CC1	ZINC000125407626	454819740	/nfs/dbraw/zinc/81/97/40/454819740.db2.gz	LCWQYPGNHGYTPJ-UHFFFAOYSA-N	0	3	333.270	3.132	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCN2CCS[C@@H]3CCCC[C@@H]32)cc1	ZINC000177194357	454834956	/nfs/dbraw/zinc/83/49/56/454834956.db2.gz	PPEQEFOXKJVUPC-DLBZAZTESA-N	0	3	329.469	3.247	20	30		EGEDHN
N#Cc1ccccc1NC(=O)CCN1CCS[C@H]2CCCC[C@@H]21	ZINC000177209331	454837828	/nfs/dbraw/zinc/83/78/28/454837828.db2.gz	CQHXGDAFPNLCOT-IRXDYDNUSA-N	0	3	329.469	3.247	20	30		EGEDHN
N#CC1(c2ccccc2)CC(NCc2ccnc(N3CCCC3)c2)C1	ZINC000125776039	454845189	/nfs/dbraw/zinc/84/51/89/454845189.db2.gz	OVCXXDUHXHOKDH-UHFFFAOYSA-N	0	3	332.451	3.395	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)[C@@H](CC)c2ccncc2)CC1	ZINC000125971950	454860660	/nfs/dbraw/zinc/86/06/60/454860660.db2.gz	PQMAKDHBEQITCY-SFHVURJKSA-N	0	3	330.476	3.215	20	30		EGEDHN
C=CCn1c(SCCN2CCC(C)CC2)nc2sccc2c1=O	ZINC000154204358	454874005	/nfs/dbraw/zinc/87/40/05/454874005.db2.gz	GXDFUANOBOTOQI-UHFFFAOYSA-N	0	3	349.525	3.468	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1)C(=O)c1c(F)cc(C#N)cc1F	ZINC000154301090	454883025	/nfs/dbraw/zinc/88/30/25/454883025.db2.gz	ANBICRCNZOEOLQ-UHFFFAOYSA-N	0	3	343.377	3.040	20	30		EGEDHN
C#CCOc1ccc([C@@H](C)NCc2ccc(-n3ccnc3C)nc2)cc1	ZINC000126359579	454888720	/nfs/dbraw/zinc/88/87/20/454888720.db2.gz	GBBMNXSLXPYINH-MRXNPFEDSA-N	0	3	346.434	3.439	20	30		EGEDHN
C[C@@H](N[C@@H](C)C(=O)N(C)CCC#N)c1ccc(C(F)(F)F)cc1	ZINC000112523196	454889423	/nfs/dbraw/zinc/88/94/23/454889423.db2.gz	JBAVKFMAXCHWJX-NEPJUHHUSA-N	0	3	327.350	3.117	20	30		EGEDHN
C=CCC[C@H](O)CN(C)[C@@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O	ZINC000178060750	454930997	/nfs/dbraw/zinc/93/09/97/454930997.db2.gz	DDVVHYPWYPWORV-KNXALSJPSA-N	0	3	330.255	3.210	20	30		EGEDHN
COCC(C)(C)NCC(=O)Nc1ccccc1S[C@H](C)CC#N	ZINC000178599960	454963981	/nfs/dbraw/zinc/96/39/81/454963981.db2.gz	AYYSCRKOOZHVHB-CYBMUJFWSA-N	0	3	335.473	3.034	20	30		EGEDHN
Cc1c(C(=O)C(C#N)c2nc3ccccc3n2C)cnn1CC(C)C	ZINC000155509687	455010229	/nfs/dbraw/zinc/01/02/29/455010229.db2.gz	WORGPWBTQSMWFB-AWEZNQCLSA-N	0	3	335.411	3.224	20	30		EGEDHN
COCc1cccc(CN2CCCN(c3ccccc3C#N)CC2)c1	ZINC000179195679	455019090	/nfs/dbraw/zinc/01/90/90/455019090.db2.gz	AGTROBCEJZZGEH-UHFFFAOYSA-N	0	3	335.451	3.417	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2CCOC3(CCCCC3)C2)CC1	ZINC000151937675	455050940	/nfs/dbraw/zinc/05/09/40/455050940.db2.gz	YOJTYZCVWPEUHU-GOSISDBHSA-N	0	3	349.519	3.208	20	30		EGEDHN
COC(=O)[C@@H](C)[C@H](NCCOc1ccccc1C#N)c1ccccc1	ZINC000152136655	455077702	/nfs/dbraw/zinc/07/77/02/455077702.db2.gz	IKOQSSQMQGMLOA-KXBFYZLASA-N	0	3	338.407	3.077	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2CCC[C@H](SC)C2)CC1	ZINC000117493431	455087375	/nfs/dbraw/zinc/08/73/75/455087375.db2.gz	GFHHGFQOIGHRPM-CVEARBPZSA-N	0	3	325.522	3.000	20	30		EGEDHN
N#Cc1ccc(F)c(CN2CCC[C@H](c3nc(C4CC4)n[nH]3)C2)c1	ZINC000152210538	455087856	/nfs/dbraw/zinc/08/78/56/455087856.db2.gz	PQTHBNDWYHJHGN-AWEZNQCLSA-N	0	3	325.391	3.072	20	30		EGEDHN
N#Cc1ccc(F)c(CN2CCC[C@H](c3n[nH]c(C4CC4)n3)C2)c1	ZINC000152210538	455087860	/nfs/dbraw/zinc/08/78/60/455087860.db2.gz	PQTHBNDWYHJHGN-AWEZNQCLSA-N	0	3	325.391	3.072	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2occc2COc2ccccc2)CC1	ZINC000171721272	455088575	/nfs/dbraw/zinc/08/85/75/455088575.db2.gz	PJBNSAPAIKRZKN-UHFFFAOYSA-N	0	3	340.423	3.239	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCCc2c(C)cc(C)cc2C)CC1	ZINC000171718318	455088591	/nfs/dbraw/zinc/08/85/91/455088591.db2.gz	PTDKYWWKJKVZJR-UHFFFAOYSA-N	0	3	329.488	3.104	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)COc2c(C)cc(C)cc2C)CC1	ZINC000171730159	455089174	/nfs/dbraw/zinc/08/91/74/455089174.db2.gz	ARMMXHIPGLHBHS-UHFFFAOYSA-N	0	3	330.472	3.147	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)/C=C/c2ccnc3ccccc23)CC1	ZINC000117793439	455094018	/nfs/dbraw/zinc/09/40/18/455094018.db2.gz	BGTHOSUYSMFDAW-BQYQJAHWSA-N	0	3	335.451	3.405	20	30		EGEDHN
CCN(CCC#N)C(=O)CN[C@H](c1ccc(Cl)cc1)[C@@H]1C[C@@H]1C	ZINC000180035434	455120193	/nfs/dbraw/zinc/12/01/93/455120193.db2.gz	RNQNXTNPDTZERQ-FDQGKXFDSA-N	0	3	333.863	3.389	20	30		EGEDHN
C[C@@H]1CN(CCC2CCN(Cc3ccc(C#N)s3)CC2)C[C@@H](C)O1	ZINC000180181812	455145779	/nfs/dbraw/zinc/14/57/79/455145779.db2.gz	MQFFYRDAEGWJDQ-HZPDHXFCSA-N	0	3	347.528	3.331	20	30		EGEDHN
CC1(C)[C@@H](O)C[C@@H]1NCc1cccc(OCc2cccc(C#N)c2)c1	ZINC000189327697	455177564	/nfs/dbraw/zinc/17/75/64/455177564.db2.gz	KOUVYXLAFGHOBZ-PMACEKPBSA-N	0	3	336.435	3.386	20	30		EGEDHN
CN1CCC(C(=O)N[C@@H](C#N)c2cccc(Cl)c2Cl)CC1	ZINC000172797567	455189181	/nfs/dbraw/zinc/18/91/81/455189181.db2.gz	MHAWYHREQLVGFB-ZDUSSCGKSA-N	0	3	326.227	3.016	20	30		EGEDHN
COc1cccc([C@@H](CNc2ccc([N+](=O)[O-])c(C#N)c2)N(C)C)c1	ZINC000157544930	455205653	/nfs/dbraw/zinc/20/56/53/455205653.db2.gz	OYVFECVUBRFBPZ-GOSISDBHSA-N	0	3	340.383	3.190	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2c(F)cccc2Cl)CC1	ZINC000264408814	455207185	/nfs/dbraw/zinc/20/71/85/455207185.db2.gz	SSJJFNKUYQIEFZ-UHFFFAOYSA-N	0	3	339.842	3.319	20	30		EGEDHN
CCS[C@H]1CCCC[C@@H]1NCC(=O)N(C)C1(C#N)CCCCC1	ZINC000189506109	455209384	/nfs/dbraw/zinc/20/93/84/455209384.db2.gz	OWNFGUJKJGQTND-HOTGVXAUSA-N	0	3	337.533	3.325	20	30		EGEDHN
CCN(CC(C)(C)O)[C@@H](C)C(=O)N(CCC#N)c1cc(C)cc(C)c1	ZINC000158181658	455277870	/nfs/dbraw/zinc/27/78/70/455277870.db2.gz	ZZUSLMVFQSIVOS-KRWDZBQOSA-N	0	3	345.487	3.031	20	30		EGEDHN
C=CCOc1cccc(CN[C@H]2CCCO[C@@H]2c2nccn2CC)c1	ZINC000190430544	455315745	/nfs/dbraw/zinc/31/57/45/455315745.db2.gz	LXAMSQSDAVKPGL-OALUTQOASA-N	0	3	341.455	3.478	20	30		EGEDHN
C[C@H](c1ccc(C#N)cc1)N1CCC(CC(=O)N2CCCC2)CC1	ZINC000265468346	455330494	/nfs/dbraw/zinc/33/04/94/455330494.db2.gz	ICIBXXVNFAXKLM-MRXNPFEDSA-N	0	3	325.456	3.344	20	30		EGEDHN
C[C@@H](CCc1ccccc1)N[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000190613035	455352816	/nfs/dbraw/zinc/35/28/16/455352816.db2.gz	NHIJFKRBHXJZMJ-LAUBAEHRSA-N	0	3	347.462	3.270	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CCOCC2(CCOCC2)C1	ZINC000184096844	455353577	/nfs/dbraw/zinc/35/35/77/455353577.db2.gz	BADBGNNZGGRHQX-UHFFFAOYSA-N	0	3	328.456	3.117	20	30		EGEDHN
C[C@@H](N[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O)[C@@H](C)c1ccccc1	ZINC000190622118	455355450	/nfs/dbraw/zinc/35/54/50/455355450.db2.gz	BHFQNSFPQNDDLZ-CBGDNZLLSA-N	0	3	347.462	3.441	20	30		EGEDHN
CN1CCC[C@H](CNC(=O)c2ccccc2Oc2ccccc2C#N)C1	ZINC000181721302	455376645	/nfs/dbraw/zinc/37/66/45/455376645.db2.gz	NKYFAJRHLVAPHU-MRXNPFEDSA-N	0	3	349.434	3.422	20	30		EGEDHN
C[C@H](N[C@H]1CCN(C(=O)CCc2ccccc2)C1)c1cccc(C#N)c1	ZINC000181890273	455395000	/nfs/dbraw/zinc/39/50/00/455395000.db2.gz	WCHHAMWSTYFWEE-UWJYYQICSA-N	0	3	347.462	3.443	20	30		EGEDHN
C[C@@H](NC[C@H]1COC2(CCCCC2)O1)c1ccc(OCC#N)cc1	ZINC000182130677	455442815	/nfs/dbraw/zinc/44/28/15/455442815.db2.gz	YCCTYMDXEVNKPY-QAPCUYQASA-N	0	3	330.428	3.315	20	30		EGEDHN
C=CCCCC(=O)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC000267231977	455519989	/nfs/dbraw/zinc/51/99/89/455519989.db2.gz	WITKEZSEODZSMY-UHFFFAOYSA-N	0	3	343.515	3.057	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1	ZINC000246847093	455530304	/nfs/dbraw/zinc/53/03/04/455530304.db2.gz	QYNODRJOMZPDCU-ROUUACIJSA-N	0	3	330.472	3.091	20	30		EGEDHN
C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000247062090	455553742	/nfs/dbraw/zinc/55/37/42/455553742.db2.gz	ZVHAPLBELRWNNV-BPQIPLTHSA-N	0	3	328.460	3.013	20	30		EGEDHN
COC(=O)COc1ccc([C@H](C)NCC#Cc2ccc(F)cc2)cc1	ZINC000185644764	455588670	/nfs/dbraw/zinc/58/86/70/455588670.db2.gz	QVLIBLDTBODXJX-HNNXBMFYSA-N	0	3	341.382	3.080	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN2CCC(O)(c3ccccc3)CC2)cc1	ZINC000185642319	455588859	/nfs/dbraw/zinc/58/88/59/455588859.db2.gz	JBSDBMPLPKADJB-QGZVFWFLSA-N	0	3	336.435	3.461	20	30		EGEDHN
C=CCN1CCC(NCc2c(F)cccc2OC(F)(F)F)CC1	ZINC000283802749	455595724	/nfs/dbraw/zinc/59/57/24/455595724.db2.gz	BVDUUWHLXFXLNX-UHFFFAOYSA-N	0	3	332.341	3.464	20	30		EGEDHN
Cc1nc(C)c(C#N)c(SCCN(C)Cc2ccc(F)cc2)n1	ZINC000185686893	455597532	/nfs/dbraw/zinc/59/75/32/455597532.db2.gz	KGGRXLNKCNJJLH-UHFFFAOYSA-N	0	3	330.432	3.328	20	30		EGEDHN
Cc1cnc(C2CCN(C[C@@H](O)c3ccc(C#N)cc3)CC2)s1	ZINC000277577997	455604152	/nfs/dbraw/zinc/60/41/52/455604152.db2.gz	VNCKLIBSAYVOIE-QGZVFWFLSA-N	0	3	327.453	3.236	20	30		EGEDHN
C[C@H](C(=O)N(CCC#N)c1ccc(F)cc1)N1C[C@@H]2CCC[C@H]2C1	ZINC000247467710	455605791	/nfs/dbraw/zinc/60/57/91/455605791.db2.gz	UYCFKZRATWTNNK-PMPSAXMXSA-N	0	3	329.419	3.193	20	30		EGEDHN
C=CCN(C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C)C1CC1	ZINC000271354741	455608702	/nfs/dbraw/zinc/60/87/02/455608702.db2.gz	DUYOFXAWHCAFQE-QFBILLFUSA-N	0	3	327.472	3.257	20	30		EGEDHN
CC[C@@H](N[C@H]1CCC[C@H](C#N)C1)c1ccccc1OCC(=O)N(C)C	ZINC000185786649	455621719	/nfs/dbraw/zinc/62/17/19/455621719.db2.gz	MFJJIZMBPXFHSU-XYJFISCASA-N	0	3	343.471	3.277	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1	ZINC000247635382	455631456	/nfs/dbraw/zinc/63/14/56/455631456.db2.gz	DFTOGTGOCLBCDS-UHFFFAOYSA-N	0	3	336.395	3.179	20	30		EGEDHN
C=CCN(C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1)C1CC1	ZINC000271487634	455656138	/nfs/dbraw/zinc/65/61/38/455656138.db2.gz	JJCXOPYQXHKNCR-SJLPKXTDSA-N	0	3	327.472	3.400	20	30		EGEDHN
C=CCN1CCC(NC(=O)C2(Cc3cccc(F)c3)CCC2)CC1	ZINC000185948789	455660182	/nfs/dbraw/zinc/66/01/82/455660182.db2.gz	GKYXJIHIHUDNPI-UHFFFAOYSA-N	0	3	330.447	3.305	20	30		EGEDHN
Cc1ccccc1[C@H](CC(C)C)NCC(=O)N(CCC#N)CCC#N	ZINC000271684653	455722018	/nfs/dbraw/zinc/72/20/18/455722018.db2.gz	JFHBUZNEPBYJQJ-IBGZPJMESA-N	0	3	340.471	3.328	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCC(OC[C@H]2CCCCO2)CC1	ZINC000186252757	455726359	/nfs/dbraw/zinc/72/63/59/455726359.db2.gz	GCOVIUDKLAVYJU-HXUWFJFHSA-N	0	3	328.456	3.417	20	30		EGEDHN
CNC(=O)[C@@H](C)CN(C)CCC(C#N)(c1ccccc1)c1ccccc1	ZINC000193062091	455740465	/nfs/dbraw/zinc/74/04/65/455740465.db2.gz	GYKGDOGCUXSHGY-SFHVURJKSA-N	0	3	349.478	3.200	20	30		EGEDHN
N#C[C@H]1CCC[C@H](Nc2cccc(CN3CCC(CO)CC3)c2)C1	ZINC000193101900	455742036	/nfs/dbraw/zinc/74/20/36/455742036.db2.gz	LKCLCDDWGOFMJX-HKUYNNGSSA-N	0	3	327.472	3.385	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1	ZINC000249053545	455742775	/nfs/dbraw/zinc/74/27/75/455742775.db2.gz	GMVQHFSYUZUJGG-ABSDTBQOSA-N	0	3	336.520	3.327	20	30		EGEDHN
C=C(C)[C@@H](NC(=O)N1CC[C@@]2(CCN(C)C2)C1)c1ccc(F)c(F)c1	ZINC000292732852	455743714	/nfs/dbraw/zinc/74/37/14/455743714.db2.gz	SQBNKQCCULTRFS-IEBWSBKVSA-N	0	3	349.425	3.319	20	30		EGEDHN
Cc1ccc(CN[C@@H]2CCC[C@H](C#N)C2)c(-n2cc(Cl)cn2)n1	ZINC000193338066	455752529	/nfs/dbraw/zinc/75/25/29/455752529.db2.gz	WEOCLROVMOBQGW-XJKSGUPXSA-N	0	3	329.835	3.401	20	30		EGEDHN
N#CCc1ccc(NC(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000193664596	455769096	/nfs/dbraw/zinc/76/90/96/455769096.db2.gz	VLXOQJFCTCLFQS-IBGZPJMESA-N	0	3	348.450	3.396	20	30		EGEDHN
COCCN(CCN[C@@H](C)c1cccc(C#N)c1)C(=O)OC(C)(C)C	ZINC000271905084	455799446	/nfs/dbraw/zinc/79/94/46/455799446.db2.gz	WKTKGEMNCPVQBV-HNNXBMFYSA-N	0	3	347.459	3.092	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1C(=O)N1CCCN(Cc2ccccc2)C[C@H]1C	ZINC000278262331	455801121	/nfs/dbraw/zinc/80/11/21/455801121.db2.gz	DCNMCALRNWFXLE-MISYRCLQSA-N	0	3	342.483	3.091	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1ccc(Cl)cc1C(F)(F)F	ZINC000294042206	455803867	/nfs/dbraw/zinc/80/38/67/455803867.db2.gz	SMULAXIRCLDXEA-UHFFFAOYSA-N	0	3	332.753	3.044	20	30		EGEDHN
N#C[C@@]1(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)CC12CCCC2	ZINC000294454193	455815555	/nfs/dbraw/zinc/81/55/55/455815555.db2.gz	PBQCAMNDTQEQFV-GHTZIAJQSA-N	0	3	337.467	3.414	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)[C@@]2(C#N)CC23CCCC3)N(C)C)cc1	ZINC000294652424	455822428	/nfs/dbraw/zinc/82/24/28/455822428.db2.gz	HQEKUKYYOFYTNI-PXNSSMCTSA-N	0	3	325.456	3.188	20	30		EGEDHN
CC[C@@H](C)[C@H](CNCc1cn(CCC#N)nc1-c1ccncc1)OC	ZINC000294744884	455826233	/nfs/dbraw/zinc/82/62/33/455826233.db2.gz	HQFBQEHLAXGDND-QAPCUYQASA-N	0	3	341.459	3.009	20	30		EGEDHN
C[C@H](CNC(=O)[C@@]1(C#N)CC12CCCC2)N(C)Cc1ccccc1	ZINC000294774352	455827831	/nfs/dbraw/zinc/82/78/31/455827831.db2.gz	ZHTZTVULZZVJKF-UZLBHIALSA-N	0	3	325.456	3.097	20	30		EGEDHN
C=CCN(CCc1c(C)nc2sccn2c1=O)Cc1ccccc1	ZINC000285349364	455829190	/nfs/dbraw/zinc/82/91/90/455829190.db2.gz	ZFBXONBYRYZJCG-UHFFFAOYSA-N	0	3	339.464	3.295	20	30		EGEDHN
COc1ccc(CNCc2cn(CCC#N)nc2-c2ccncc2)cc1	ZINC000278591100	455841226	/nfs/dbraw/zinc/84/12/26/455841226.db2.gz	GXYXWPLCFASADS-UHFFFAOYSA-N	0	3	347.422	3.157	20	30		EGEDHN
C=CCN1CCC(NCc2cccc(F)c2Br)CC1	ZINC000295259594	455843908	/nfs/dbraw/zinc/84/39/08/455843908.db2.gz	UXEJLYVTBDKCOO-UHFFFAOYSA-N	0	3	327.241	3.328	20	30		EGEDHN
C=CCOc1ccc(CN[C@H](COC)[C@@H]2CCCO2)cc1Cl	ZINC000278706542	455845426	/nfs/dbraw/zinc/84/54/26/455845426.db2.gz	RJSAKFRGIBNXCY-WBVHZDCISA-N	0	3	325.836	3.188	20	30		EGEDHN
CCCCO[C@@H]1C[C@H](N[C@H](C)C(=O)NC2(C#N)CCCCC2)C1(C)C	ZINC000253430373	455847782	/nfs/dbraw/zinc/84/77/82/455847782.db2.gz	QMAXBBCALVFHAA-IXDOHACOSA-N	0	3	349.519	3.291	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1c(Cl)cc(Cl)cc1Cl	ZINC000295473592	455850562	/nfs/dbraw/zinc/85/05/62/455850562.db2.gz	MSFFVMNPDNPLCN-UHFFFAOYSA-N	0	3	333.646	3.332	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN[C@@H](c1ccc(F)c(C)c1)C1CC1	ZINC000272125031	455852841	/nfs/dbraw/zinc/85/28/41/455852841.db2.gz	UTTRFIORDIOGHP-ORAYPTAESA-N	0	3	331.435	3.183	20	30		EGEDHN
C=CCSCCNC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000194565658	455859330	/nfs/dbraw/zinc/85/93/30/455859330.db2.gz	QYPOUNFCWNGRPP-UHFFFAOYSA-N	0	3	347.528	3.178	20	30		EGEDHN
C[C@@H](CNC(=O)C(C#N)Cc1ccc(C#N)cc1)c1ccc(F)cc1	ZINC000279368520	455863696	/nfs/dbraw/zinc/86/36/96/455863696.db2.gz	RPOVMFORDNUYSA-KBXCAEBGSA-N	0	3	335.382	3.300	20	30		EGEDHN
C=CCSCCNC(=O)N[C@@H](CN1CCCC1)c1ccccc1	ZINC000194628022	455865988	/nfs/dbraw/zinc/86/59/88/455865988.db2.gz	FKGYUNJFEHHKNZ-KRWDZBQOSA-N	0	3	333.501	3.042	20	30		EGEDHN
C=CCN1CCC(NC(=O)/C=C\c2ccc(Br)cc2)CC1	ZINC000255417747	455867291	/nfs/dbraw/zinc/86/72/91/455867291.db2.gz	ZKFUCMFTUMFLAI-YVMONPNESA-N	0	3	349.272	3.229	20	30		EGEDHN
C=CCC[C@H](CC)N[C@@H](C(N)=O)c1cccc(Br)c1	ZINC000279592178	455868164	/nfs/dbraw/zinc/86/81/64/455868164.db2.gz	CRKXYBYLGCYGMG-UONOGXRCSA-N	0	3	325.250	3.310	20	30		EGEDHN
CC(C)(C#N)c1ccc(C(=O)N2CCC[C@H]2CN2CCCC2)cc1	ZINC000279809644	455874131	/nfs/dbraw/zinc/87/41/31/455874131.db2.gz	OGVPWVZZWBXSGD-SFHVURJKSA-N	0	3	325.456	3.188	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NC[C@@H](c1cccs1)N1CCCC1)OCC	ZINC000270136915	455886777	/nfs/dbraw/zinc/88/67/77/455886777.db2.gz	QPBWTQKUZJCLCE-HOTGVXAUSA-N	0	3	336.501	3.373	20	30		EGEDHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(C(C)(C)C#N)cc2)C1	ZINC000280084703	455887492	/nfs/dbraw/zinc/88/74/92/455887492.db2.gz	YJELIIUTXBYLLX-FUHWJXTLSA-N	0	3	325.456	3.044	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N1CCN([C@H](C)CC)CC1	ZINC000296254658	455892855	/nfs/dbraw/zinc/89/28/55/455892855.db2.gz	XNVASJIWNNAWGH-SJORKVTESA-N	0	3	349.544	3.067	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C(F)(F)c2c(F)cccc2F)CC1	ZINC000270202244	455901505	/nfs/dbraw/zinc/90/15/05/455901505.db2.gz	MPOXFFSZQGHLRT-UHFFFAOYSA-N	0	3	344.352	3.213	20	30		EGEDHN
CN(CCNC(=O)c1ccc(C(C)(C)C#N)cc1)Cc1ccccc1	ZINC000280303117	455941429	/nfs/dbraw/zinc/94/14/29/455941429.db2.gz	BKEKFTZOWRLZQU-UHFFFAOYSA-N	0	3	335.451	3.350	20	30		EGEDHN
C=C[C@H](CC(=O)NCCCCN1C[C@@H](C)O[C@H](C)C1)c1ccccc1	ZINC000270379748	455943214	/nfs/dbraw/zinc/94/32/14/455943214.db2.gz	PBWSTGPSTPFZTE-GUDVDZBRSA-N	0	3	344.499	3.352	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)C(=O)C1CCN(C2CC2)CC1	ZINC000195369670	455951666	/nfs/dbraw/zinc/95/16/66/455951666.db2.gz	SVCOHWQRAVXBNO-UHFFFAOYSA-N	0	3	328.456	3.084	20	30		EGEDHN
N#CCCN(CCC#N)C(=O)CN[C@@H](CC1CCC1)c1ccccc1	ZINC000272441263	455951803	/nfs/dbraw/zinc/95/18/03/455951803.db2.gz	BCVLRCBZFGMPRO-IBGZPJMESA-N	0	3	338.455	3.163	20	30		EGEDHN
CC1(C#N)CCN(CCC(=O)N[C@H]2CCCc3ccccc32)CC1	ZINC000272604502	456010586	/nfs/dbraw/zinc/01/05/86/456010586.db2.gz	RGRXDXQQGYRAKT-SFHVURJKSA-N	0	3	325.456	3.196	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)Nc1ccc(OCCN(C)C)c(Cl)c1	ZINC000280620250	456015820	/nfs/dbraw/zinc/01/58/20/456015820.db2.gz	KVVJRQYGBJVYDY-UHFFFAOYSA-N	0	3	347.802	3.306	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc3c([nH]2)c(F)ccc3OC)CC1	ZINC000280638896	456019540	/nfs/dbraw/zinc/01/95/40/456019540.db2.gz	YEJXOKNSXCAJPE-UHFFFAOYSA-N	0	3	345.418	3.086	20	30		EGEDHN
OCC[C@@H]1CCC[C@H]1NCC#Cc1ccc(OC(F)(F)F)cc1	ZINC000286305879	456020101	/nfs/dbraw/zinc/02/01/01/456020101.db2.gz	VVLKBPHPQAGECM-GOEBONIOSA-N	0	3	327.346	3.077	20	30		EGEDHN
CC1(C#N)CCN(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1	ZINC000272641716	456022941	/nfs/dbraw/zinc/02/29/41/456022941.db2.gz	XTKDSDCRFXBCCI-UHFFFAOYSA-N	0	3	340.383	3.418	20	30		EGEDHN
CC1=C(C)CN(CCC(=O)Nc2sc3c(c2C#N)CCC3)CC1	ZINC000280741210	456041836	/nfs/dbraw/zinc/04/18/36/456041836.db2.gz	MJWAVIXMXXGJDB-UHFFFAOYSA-N	0	3	329.469	3.479	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)Nc1ccccc1NC1CCN(C)CC1	ZINC000280774509	456050281	/nfs/dbraw/zinc/05/02/81/456050281.db2.gz	ZZSMQUSWBOYPOZ-UHFFFAOYSA-N	0	3	338.411	3.218	20	30		EGEDHN
C=C(C)CN1CCC(Nc2ncnc3sc([N+](=O)[O-])cc32)CC1	ZINC000287284038	456065742	/nfs/dbraw/zinc/06/57/42/456065742.db2.gz	KXGWLOFOBWABIT-UHFFFAOYSA-N	0	3	333.417	3.052	20	30		EGEDHN
N#Cc1cnc2ccc(Cl)cc2c1N1CCN(c2ccncc2)CC1	ZINC000301374936	456101623	/nfs/dbraw/zinc/10/16/23/456101623.db2.gz	XBIGBBUVNVGQNW-UHFFFAOYSA-N	0	3	349.825	3.481	20	30		EGEDHN
C#Cc1ccc(CNc2ccccc2CN2CCC(CO)CC2)cc1	ZINC000289195369	456117092	/nfs/dbraw/zinc/11/70/92/456117092.db2.gz	HESNTIIDQCWTCY-UHFFFAOYSA-N	0	3	334.463	3.484	20	30		EGEDHN
Cc1cccnc1OC1CCN(CCCC2(C#N)CCOCC2)CC1	ZINC000289479840	456127510	/nfs/dbraw/zinc/12/75/10/456127510.db2.gz	XWAVIZXXAJJNQD-UHFFFAOYSA-N	0	3	343.471	3.334	20	30		EGEDHN
COc1ccc(CN[C@H](c2cccs2)C(C)(C)CO)cc1C#N	ZINC000289637962	456133749	/nfs/dbraw/zinc/13/37/49/456133749.db2.gz	FJURIJPCPAWMHD-QGZVFWFLSA-N	0	3	330.453	3.478	20	30		EGEDHN
N#CCC[C@H](NC(=O)C1C[C@@H](c2ccccc2)OC1=O)c1ccccc1	ZINC000289816564	456144035	/nfs/dbraw/zinc/14/40/35/456144035.db2.gz	NVVDWKNHPVXPIS-QYZOEREBSA-N	0	3	348.402	3.452	20	30		EGEDHN
N#CCC[C@H](NC(=O)C1C[C@H](c2ccccc2)OC1=O)c1ccccc1	ZINC000289816558	456144344	/nfs/dbraw/zinc/14/43/44/456144344.db2.gz	NVVDWKNHPVXPIS-CEXWTWQISA-N	0	3	348.402	3.452	20	30		EGEDHN
NC(=NOCc1cncc(F)c1)c1ccccc1CN1CCCCC1	ZINC000281179395	456155177	/nfs/dbraw/zinc/15/51/77/456155177.db2.gz	QMDREKWGDGRUSH-UHFFFAOYSA-N	0	3	342.418	3.044	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)C(=O)N[C@@H](C)C1=CCN(C)CC1	ZINC000273042997	456156685	/nfs/dbraw/zinc/15/66/85/456156685.db2.gz	WKIKMYFVYQVPTJ-INIZCTEOSA-N	0	3	343.471	3.043	20	30		EGEDHN
C=CC[C@H](CC)NC(=O)N(C)C1CCN(CCc2ccccn2)CC1	ZINC000281263126	456182664	/nfs/dbraw/zinc/18/26/64/456182664.db2.gz	HBUDKRJRQSWDCK-KRWDZBQOSA-N	0	3	344.503	3.085	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)CCC1	ZINC000188985018	456189817	/nfs/dbraw/zinc/18/98/17/456189817.db2.gz	QXPKQOAYECSALR-HDICACEKSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C[C@@H](CO)N[C@@H]1CCCc2c3cc(Br)ccc3[nH]c21	ZINC000289991923	456209128	/nfs/dbraw/zinc/20/91/28/456209128.db2.gz	YNFJUYOGLXQXDY-XHDPSFHLSA-N	0	3	335.245	3.444	20	30		EGEDHN
CN(CCNC(=O)OC(C)(C)C)Cc1ccccc1C(C)(C)C#N	ZINC000297413971	456215094	/nfs/dbraw/zinc/21/50/94/456215094.db2.gz	LQLKOQRQWQQHJW-UHFFFAOYSA-N	0	3	331.460	3.444	20	30		EGEDHN
COc1cc(CN[C@H](CN(C)C)c2ccc(F)cc2)ccc1C#N	ZINC000290103978	456241213	/nfs/dbraw/zinc/24/12/13/456241213.db2.gz	KOMXQWBJEYHQTQ-GOSISDBHSA-N	0	3	327.403	3.098	20	30		EGEDHN
CN(CC(=O)N[C@](C)(C#N)C1CC1)[C@H]1CCC[C@H]1c1ccccc1	ZINC000297622487	456265534	/nfs/dbraw/zinc/26/55/34/456265534.db2.gz	VYVNVHRNVKICKG-CMKODMSKSA-N	0	3	325.456	3.063	20	30		EGEDHN
CC[C@H](NCc1ccc(C#N)c(OC)c1)[C@@H](O)c1c(F)cccc1F	ZINC000281674553	456289155	/nfs/dbraw/zinc/28/91/55/456289155.db2.gz	LWGWIMXLKJLZFZ-QFBILLFUSA-N	0	3	346.377	3.447	20	30		EGEDHN
COc1ccc(CN2CCN(C3CCC(C)CC3)CC2)cc1C#N	ZINC000340196668	456307065	/nfs/dbraw/zinc/30/70/65/456307065.db2.gz	OKGTTXPFUKSTSF-UHFFFAOYSA-N	0	3	327.472	3.263	20	30		EGEDHN
CC1(C)CN(C[C@@H](O)c2ccc(C#N)cc2)C[C@]2(C[C@@H]3CC[C@H]2C3)O1	ZINC000281768073	456314499	/nfs/dbraw/zinc/31/44/99/456314499.db2.gz	SFFXTWKDQNOKOX-LYSIVYOWSA-N	0	3	340.467	3.261	20	30		EGEDHN
COc1cc(CN[C@H](C)c2ccc3c(c2)CCC(=O)N3)ccc1C#N	ZINC000281838284	456336156	/nfs/dbraw/zinc/33/61/56/456336156.db2.gz	YGBONCJYROXWNQ-CYBMUJFWSA-N	0	3	335.407	3.302	20	30		EGEDHN
C=CCc1cc(CN[C@@H]2CCC[C@H]2OC(F)F)cc(OC)c1O	ZINC000337318842	456346954	/nfs/dbraw/zinc/34/69/54/456346954.db2.gz	YOYIRWKEMZZDRF-ZIAGYGMSSA-N	0	3	327.371	3.379	20	30		EGEDHN
COc1ccc([C@H](N[C@H](C)C(=O)N[C@](C)(C#N)C(C)C)C2CC2)cc1	ZINC000343007987	456352868	/nfs/dbraw/zinc/35/28/68/456352868.db2.gz	LFYQLUWXBJCUTN-LXGCGDOSSA-N	0	3	343.471	3.179	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@H](C)N1CCCN(Cc2ccccc2)CC1	ZINC000302956236	456440513	/nfs/dbraw/zinc/44/05/13/456440513.db2.gz	NWOYMQHVUFTPDF-IBGZPJMESA-N	0	3	343.515	3.007	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(-c3ccccc3)c(C)n2)CC1	ZINC000290950810	456475957	/nfs/dbraw/zinc/47/59/57/456475957.db2.gz	PFOPZTHEYPCSTI-UHFFFAOYSA-N	0	3	333.435	3.341	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN(Cc1ccccc1)CC1CCOCC1	ZINC000348165323	456514181	/nfs/dbraw/zinc/51/41/81/456514181.db2.gz	IBSQLGDMGMBGGM-UHFFFAOYSA-N	0	3	344.499	3.340	20	30		EGEDHN
C[C@H](NCc1cccc(C#N)c1)c1ccc(N2CCCNC2=O)cc1	ZINC000291129141	456540098	/nfs/dbraw/zinc/54/00/98/456540098.db2.gz	WDCHMTFECIZYNF-HNNXBMFYSA-N	0	3	334.423	3.329	20	30		EGEDHN
COc1cc(CN[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)ccc1C#N	ZINC000353215015	456566169	/nfs/dbraw/zinc/56/61/69/456566169.db2.gz	VQNQFBOQYJBYKF-UZLBHIALSA-N	0	3	335.451	3.319	20	30		EGEDHN
CC(C)(CCC#N)CNCc1ncc(I)s1	ZINC000309709733	456576004	/nfs/dbraw/zinc/57/60/04/456576004.db2.gz	WRBSTFLXJJPQQT-UHFFFAOYSA-N	0	3	349.241	3.167	20	30		EGEDHN
C=C(Br)CN[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1C	ZINC000310009544	456578123	/nfs/dbraw/zinc/57/81/23/456578123.db2.gz	JNGJGSKXIHKJAH-PWSUYJOCSA-N	0	3	333.270	3.130	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1	ZINC000337877279	456582194	/nfs/dbraw/zinc/58/21/94/456582194.db2.gz	RLNBDJNMVMKTPG-APWZRJJASA-N	0	3	333.435	3.432	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N1C[C@@H]2CCCN2Cc2ccccc21	ZINC000337878287	456582457	/nfs/dbraw/zinc/58/24/57/456582457.db2.gz	RZWHMSCSIFADQQ-SFHVURJKSA-N	0	3	331.419	3.492	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H]2CCO[C@@H]2c2cccnc2)cc1OC	ZINC000343392539	456587221	/nfs/dbraw/zinc/58/72/21/456587221.db2.gz	PCPWCRPVPFPMSC-YLJYHZDGSA-N	0	3	340.423	3.275	20	30		EGEDHN
CCc1ccc([C@H]2CCCN([C@@H](C)C(=O)N(C)CCC#N)C2)cc1	ZINC000353257134	456592192	/nfs/dbraw/zinc/59/21/92/456592192.db2.gz	IEPLRSXUKSWBOF-LPHOPBHVSA-N	0	3	327.472	3.189	20	30		EGEDHN
CCN1CCO[C@H](CNCc2ccc(C#N)cc2)[C@@H]1c1ccccc1	ZINC000343406351	456600102	/nfs/dbraw/zinc/60/01/02/456600102.db2.gz	VAWQCRFHBACYBW-RTWAWAEBSA-N	0	3	335.451	3.110	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000276858210	456601520	/nfs/dbraw/zinc/60/15/20/456601520.db2.gz	CEPWOWUAVTZPGB-HXUWFJFHSA-N	0	3	348.462	3.387	20	30		EGEDHN
CO[C@@H]1CCCC[C@@H]1N[C@H](C)C(=O)N(CCC#N)c1ccc(C)cc1	ZINC000276909776	456617772	/nfs/dbraw/zinc/61/77/72/456617772.db2.gz	FQDIENCELCGTMR-NZSAHSFTSA-N	0	3	343.471	3.177	20	30		EGEDHN
CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1ccc(C#N)cc1	ZINC000299341959	456662772	/nfs/dbraw/zinc/66/27/72/456662772.db2.gz	MWGYAFZWXCXTCW-UHFFFAOYSA-N	0	3	343.377	3.040	20	30		EGEDHN
CCCN(CC(=O)N(CCC#N)CCC#N)[C@H]1CCc2ccccc21	ZINC000299383533	456676249	/nfs/dbraw/zinc/67/62/49/456676249.db2.gz	HSNZDFIDPZRBKW-IBGZPJMESA-N	0	3	338.455	3.042	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@H](NCc1cccc(N3CCCC3=O)c1)CC2	ZINC000353421792	456690083	/nfs/dbraw/zinc/69/00/83/456690083.db2.gz	AQALUYSDNCBKAJ-HXUWFJFHSA-N	0	3	331.419	3.462	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)c1ccc(C(F)(F)F)cn1	ZINC000338187127	456692344	/nfs/dbraw/zinc/69/23/44/456692344.db2.gz	HANVKMIXPZNBCD-NSHDSACASA-N	0	3	344.296	3.477	20	30		EGEDHN
Cc1noc(C[C@@H](NCCOc2cccc(C#N)c2)c2ccccc2)n1	ZINC000277156831	456701379	/nfs/dbraw/zinc/70/13/79/456701379.db2.gz	JXXFMEXUAYRMJQ-LJQANCHMSA-N	0	3	348.406	3.202	20	30		EGEDHN
CC(C)c1nc(C2CCN(CCOc3ccc(C#N)cc3)CC2)no1	ZINC000299565895	456730186	/nfs/dbraw/zinc/73/01/86/456730186.db2.gz	ADRHHJDVKNMPQR-UHFFFAOYSA-N	0	3	340.427	3.323	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN[C@@H]1CC[C@@H](c2ccccc2)C[C@H]1OC	ZINC000353575567	456775834	/nfs/dbraw/zinc/77/58/34/456775834.db2.gz	OZTHLKOEZSNUDA-VAMGGRTRSA-N	0	3	342.483	3.128	20	30		EGEDHN
Cc1nc([C@@H]2CCCOC2)sc1C(=O)NC[C@H](C)N(C)C1CC1	ZINC000328874162	456781415	/nfs/dbraw/zinc/78/14/15/456781415.db2.gz	RKTRCDJDWRIDTO-WCQYABFASA-N	0	3	337.489	3.133	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN1C[C@H](C)C[C@H]1c1cccc(OC)c1	ZINC000344023687	456789650	/nfs/dbraw/zinc/78/96/50/456789650.db2.gz	BDNWJPSLBWSEDW-APWZRJJASA-N	0	3	328.456	3.279	20	30		EGEDHN
C[C@@H](C(=O)N(CCC#N)c1ccc(F)cc1)N1CC[C@@H](C2CC2)C1	ZINC000344038221	456790371	/nfs/dbraw/zinc/79/03/71/456790371.db2.gz	QXLMCESACQJLRH-GOEBONIOSA-N	0	3	329.419	3.193	20	30		EGEDHN
CC(C#N)C(=O)N1C[C@H](c2cccc(C(F)(F)F)c2)OC[C@H]1C	ZINC000341000800	456807520	/nfs/dbraw/zinc/80/75/20/456807520.db2.gz	JCGUUUDVANGALO-JTNHKYCSSA-N	0	3	326.318	3.153	20	30		EGEDHN
C=CCOc1ccc(C(=O)N(CCN(C)C)Cc2ccccc2)cc1	ZINC000344552315	456836629	/nfs/dbraw/zinc/83/66/29/456836629.db2.gz	TYKHGEKVZBYRSV-UHFFFAOYSA-N	0	3	338.451	3.455	20	30		EGEDHN
N#CCc1ccc(CN(Cc2ccc(-n3cncn3)cc2)C2CC2)cc1	ZINC000338598085	456843713	/nfs/dbraw/zinc/84/37/13/456843713.db2.gz	NQUZLQXSQOBHDP-UHFFFAOYSA-N	0	3	343.434	3.498	20	30		EGEDHN
N#Cc1cc(CN(Cc2ccc(-n3cncn3)cc2)C2CC2)ccc1F	ZINC000338600010	456843807	/nfs/dbraw/zinc/84/38/07/456843807.db2.gz	ZJQNUUUNGAWGTQ-UHFFFAOYSA-N	0	3	347.397	3.443	20	30		EGEDHN
CSCC[C@](C)(C#N)NC(=O)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000344698580	456849444	/nfs/dbraw/zinc/84/94/44/456849444.db2.gz	JAVPYMAEUMIGSY-PKOBYXMFSA-N	0	3	345.512	3.050	20	30		EGEDHN
O=C(CC1CCCCC1)NCC(=O)N1CC[C@H](N2CCCCC2)C1	ZINC000329207688	456853477	/nfs/dbraw/zinc/85/34/77/456853477.db2.gz	BLKMMJKYZYMPJQ-KRWDZBQOSA-N	0	3	335.492	3.000	20	30		EGEDHN
C=C(C)Cn1c(C)nnc1N1CCN(Cc2ccccc2)[C@H](CC)C1	ZINC000338813629	456860890	/nfs/dbraw/zinc/86/08/90/456860890.db2.gz	VWBJPXSNMUVIDV-LJQANCHMSA-N	0	3	339.487	3.263	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C	ZINC000341463422	456865815	/nfs/dbraw/zinc/86/58/15/456865815.db2.gz	AYXZHXBFPNRWGW-SQNIBIBYSA-N	0	3	348.512	3.109	20	30		EGEDHN
CC(C)[C@H](NC(=O)N[C@@H]1CCN(C2CC2)C1)c1nc2ccccc2[nH]1	ZINC000329309898	456870151	/nfs/dbraw/zinc/87/01/51/456870151.db2.gz	QRSRNYYDPSBOSU-DYVFJYSZSA-N	0	3	341.459	3.000	20	30		EGEDHN
CCC(CC)[C@@H]1C[C@H](NC(=O)N[C@@H](C)C2=CCN(C)CC2)CCO1	ZINC000329354736	456877581	/nfs/dbraw/zinc/87/75/81/456877581.db2.gz	VMYLYQOHTYUBJU-QGTPRVQTSA-N	0	3	337.508	3.124	20	30		EGEDHN
C[C@@H](CN1C[C@H](C)C[C@H](C)C1)NC(=O)c1cc2nc[nH]c2cc1F	ZINC000329377021	456881380	/nfs/dbraw/zinc/88/13/80/456881380.db2.gz	MARMNOBIEFIROS-XQQFMLRXSA-N	0	3	332.423	3.373	20	30		EGEDHN
C[C@H](NC(=O)CC1CCCCC1)C(=O)N1C[C@H](N2CCCC2)C[C@@H]1C	ZINC000329405726	456885685	/nfs/dbraw/zinc/88/56/85/456885685.db2.gz	XDEOZVKYGWVTGT-XYJFISCASA-N	0	3	349.519	3.387	20	30		EGEDHN
CN(CC(=O)NC(=O)NC1CC1)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1	ZINC000329462756	456894903	/nfs/dbraw/zinc/89/49/03/456894903.db2.gz	TVEHXCMORMMQSA-CVEARBPZSA-N	0	3	349.406	3.011	20	30		EGEDHN
CN(Cc1cccc(OCCCC#N)c1)C[C@@H](O)Cc1ccccc1	ZINC000353771579	456899541	/nfs/dbraw/zinc/89/95/41/456899541.db2.gz	XDUMFFJKBCRSPM-FQEVSTJZSA-N	0	3	338.451	3.405	20	30		EGEDHN
CC(C)n1ncc2c1C[C@H](NC(=O)[C@H](C1CC1)N1CCCC1)CC2	ZINC000329544132	456906678	/nfs/dbraw/zinc/90/66/78/456906678.db2.gz	YQCHUHFXNONGAA-AEFFLSMTSA-N	0	3	330.476	3.152	20	30		EGEDHN
Cn1cc(C(F)(F)F)nc1[C@@H]1CCCN([C@H]2CC[C@H](C#N)C2)C1	ZINC000339174046	456977127	/nfs/dbraw/zinc/97/71/27/456977127.db2.gz	ISJKWAZUODYJMS-XQQFMLRXSA-N	0	3	326.366	3.311	20	30		EGEDHN
C[C@@H]1CCCc2ccccc2[C@@H]1NC([O-])=[NH+][C@H]1CCn2ccnc2C1	ZINC000330163084	456993920	/nfs/dbraw/zinc/99/39/20/456993920.db2.gz	ARMMPSFMCMKGCA-SIXWZSSISA-N	0	3	338.455	3.415	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C	ZINC000362607410	457001815	/nfs/dbraw/zinc/00/18/15/457001815.db2.gz	DCNMCALRNWFXLE-IHPCNDPISA-N	0	3	342.483	3.091	20	30		EGEDHN
C=C(C)COc1cc(CN[C@@H](CC)[C@H](O)C(F)(F)F)ccc1OC	ZINC000345859333	457002049	/nfs/dbraw/zinc/00/20/49/457002049.db2.gz	SGUAHLLOLBPUQZ-BBRMVZONSA-N	0	3	347.377	3.442	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2CCO[C@H](C(C)(C)C)C2)CC1	ZINC000330518294	457052419	/nfs/dbraw/zinc/05/24/19/457052419.db2.gz	OKGMGYYFAMGEKD-SJORKVTESA-N	0	3	337.508	3.124	20	30		EGEDHN
CCN1CCC[C@H]1CNC(=O)c1cnn(C(C)(C)C)c1C(F)(F)F	ZINC000330528364	457053030	/nfs/dbraw/zinc/05/30/30/457053030.db2.gz	NBFBLPAIBDQHGF-NSHDSACASA-N	0	3	346.397	3.446	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F	ZINC000349992349	457135514	/nfs/dbraw/zinc/13/55/14/457135514.db2.gz	REQXTOZPQYEXOI-WBVHZDCISA-N	0	3	349.425	3.152	20	30		EGEDHN
CC(C#N)C(=O)N1CCSC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000354248452	457153515	/nfs/dbraw/zinc/15/35/15/457153515.db2.gz	TVEPLRKZDYACKT-GWCFXTLKSA-N	0	3	328.359	3.482	20	30		EGEDHN
CC(C)(C#N)CNC(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000350185999	457169520	/nfs/dbraw/zinc/16/95/20/457169520.db2.gz	BNLIQUMUWPTBMD-UHFFFAOYSA-N	0	3	344.459	3.223	20	30		EGEDHN
CCO[C@H]1C[C@H](N(C)CCOc2ccc(C#N)cc2OC)C1(C)C	ZINC000354424897	457214783	/nfs/dbraw/zinc/21/47/83/457214783.db2.gz	HADBTBYXNHOPOS-ROUUACIJSA-N	0	3	332.444	3.081	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN1CCCC[C@H]1Cc1ccccc1	ZINC000339724620	457234152	/nfs/dbraw/zinc/23/41/52/457234152.db2.gz	ANRDXBLGHCJWQD-HKUYNNGSSA-N	0	3	327.472	3.092	20	30		EGEDHN
CC(C)n1cc(Br)cc1C(=O)C(C#N)c1ccncn1	ZINC000354466905	457242157	/nfs/dbraw/zinc/24/21/57/457242157.db2.gz	NKKRQPSBYJNMFZ-LLVKDONJSA-N	0	3	333.189	3.112	20	30		EGEDHN
N#CCCCOc1cccc(CNCc2cccc(-n3cncn3)c2)c1	ZINC000363234959	457266963	/nfs/dbraw/zinc/26/69/63/457266963.db2.gz	VMAAAMVHBLUVFR-UHFFFAOYSA-N	0	3	347.422	3.240	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H]1CN1CCCCC1)c1cccc(C#N)c1	ZINC000360157720	457280674	/nfs/dbraw/zinc/28/06/74/457280674.db2.gz	VXBJTRAHJQUULI-APWZRJJASA-N	0	3	325.456	3.139	20	30		EGEDHN
COc1ccc2nc(C)cc(C(=O)C(C#N)c3cc(C)nc(C)n3)c2c1	ZINC000354938966	457330806	/nfs/dbraw/zinc/33/08/06/457330806.db2.gz	HTFVAQPCOBQHIH-QGZVFWFLSA-N	0	3	346.390	3.449	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N2CCCCC[C@H]2C)cc1	ZINC000332291725	457342671	/nfs/dbraw/zinc/34/26/71/457342671.db2.gz	JPOCUWXEOWHQMX-KGLIPLIRSA-N	0	3	349.456	3.169	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1CCC[C@](C)(c2ccccc2)CC1	ZINC000352204548	457347784	/nfs/dbraw/zinc/34/77/84/457347784.db2.gz	XYUPODIFJOYYOH-NQIIRXRSSA-N	0	3	341.499	3.438	20	30		EGEDHN
N#Cc1ccc([C@H](NC[C@@H]2CCCC[C@@H]2C(F)(F)F)C(N)=O)cc1	ZINC000352271928	457353515	/nfs/dbraw/zinc/35/35/15/457353515.db2.gz	SVPVXLSIMPQIDW-KKUMJFAQSA-N	0	3	339.361	3.043	20	30		EGEDHN
N#C[C@H](c1cccc(Cl)c1)N1CCN(C[C@H]2CCSC2)CC1	ZINC000355291893	457355151	/nfs/dbraw/zinc/35/51/51/457355151.db2.gz	OGFMXMZCNAKGTE-RHSMWYFYSA-N	0	3	335.904	3.275	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)NCC(C)(C)CCC#N)N(C)C)cc1	ZINC000352339346	457356689	/nfs/dbraw/zinc/35/66/89/457356689.db2.gz	CHKYATLGBDBEPK-KRWDZBQOSA-N	0	3	330.476	3.227	20	30		EGEDHN
CC(=O)Nc1c[nH]nc1[C@H]1CCCN([C@@H](C)c2cccc(C#N)c2)C1	ZINC000332366011	457356626	/nfs/dbraw/zinc/35/66/26/457356626.db2.gz	VWLRIEQMPZWUTR-GUYCJALGSA-N	0	3	337.427	3.180	20	30		EGEDHN
C=CCOc1ccccc1CN1CCC[C@@H](Cc2nccn2C)C1	ZINC000357211886	457377905	/nfs/dbraw/zinc/37/79/05/457377905.db2.gz	HMVJDPFUDUFJTP-KRWDZBQOSA-N	0	3	325.456	3.440	20	30		EGEDHN
C=C[C@@H](CO)NCc1ccc(OC(F)(F)[C@@H](F)C(F)(F)F)cc1	ZINC000352452349	457379649	/nfs/dbraw/zinc/37/96/49/457379649.db2.gz	FDVOQOYZSIDPFF-JQWIXIFHSA-N	0	3	343.267	3.195	20	30		EGEDHN
CCC(C#N)(CC)C(=O)N[C@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000379717597	457417934	/nfs/dbraw/zinc/41/79/34/457417934.db2.gz	OPPWKICQLITOKT-AEFFLSMTSA-N	0	3	327.472	3.486	20	30		EGEDHN
CCN(CC)CC(=O)N(Cc1cccc(C(F)(F)F)c1)[C@H](C)C#N	ZINC000425085541	457434388	/nfs/dbraw/zinc/43/43/88/457434388.db2.gz	LYSIDCZHQHYAGY-CYBMUJFWSA-N	0	3	341.377	3.288	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN(C[C@H]1CCCO1)C1CCC(C)CC1	ZINC000347527489	457487002	/nfs/dbraw/zinc/48/70/02/457487002.db2.gz	RTJJAOHBQPXOEN-JWHDQAAXSA-N	0	3	349.519	3.054	20	30		EGEDHN
CCC(C#N)(CC)C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000398187765	457497068	/nfs/dbraw/zinc/49/70/68/457497068.db2.gz	VTBOYKXFCUCOJF-AEFFLSMTSA-N	0	3	327.472	3.343	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN1CC[C@H](Oc2ccccc2)C1	ZINC000374212949	457525258	/nfs/dbraw/zinc/52/52/58/457525258.db2.gz	FZFUBSYUXZRZME-INIZCTEOSA-N	0	3	341.436	3.102	20	30		EGEDHN
Cc1cc(C#N)nc(N2C[C@H](C)N(Cc3ccccc3)[C@H](C)[C@H]2C)n1	ZINC000404312565	457540962	/nfs/dbraw/zinc/54/09/62/457540962.db2.gz	MFKCKBUQNVFDRS-GVDBMIGSSA-N	0	3	335.455	3.144	20	30		EGEDHN
C=C[C@H](CO)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1	ZINC000356241241	457548971	/nfs/dbraw/zinc/54/89/71/457548971.db2.gz	TVQRMZPETCIFDB-GOSISDBHSA-N	0	3	337.398	3.315	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC[C@@H](C(C)C)N1CCc2ccccc2C1	ZINC000347613084	457550552	/nfs/dbraw/zinc/55/05/52/457550552.db2.gz	AKEGAMITGDPULE-PXNSSMCTSA-N	0	3	344.499	3.167	20	30		EGEDHN
COc1ccc(C#N)cc1CN1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1	ZINC000425501233	457578863	/nfs/dbraw/zinc/57/88/63/457578863.db2.gz	NUFHQURGRHIBLG-PZJWPPBQSA-N	0	3	347.462	3.273	20	30		EGEDHN
CCCCCCCCC(=O)N1CC[C@@H](N2CCN(C)CC2)[C@H](C)C1	ZINC000374316851	457582155	/nfs/dbraw/zinc/58/21/55/457582155.db2.gz	JABABJDAKFWBIU-RTBURBONSA-N	0	3	337.552	3.221	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)C[C@@H](O)COc1ccc(F)cc1	ZINC000425531938	457587231	/nfs/dbraw/zinc/58/72/31/457587231.db2.gz	AUNJOTUBNGYLIG-RDTXWAMCSA-N	0	3	328.387	3.130	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@@H](C)N1CC2(CCC2)[C@@H]1C1CCOCC1	ZINC000425555617	457596368	/nfs/dbraw/zinc/59/63/68/457596368.db2.gz	QYNYXQZHUUVNEO-AEFFLSMTSA-N	0	3	334.504	3.081	20	30		EGEDHN
COC(=O)[C@@H]1CC[C@H](NCc2ccc(C#N)cc2C(F)(F)F)C1	ZINC000356404053	457608498	/nfs/dbraw/zinc/60/84/98/457608498.db2.gz	IOQNCMPDBLYXQG-YPMHNXCESA-N	0	3	326.318	3.008	20	30		EGEDHN
N#Cc1cccc(CN2CCC(n3cc(Br)cn3)CC2)c1	ZINC000364528994	457633583	/nfs/dbraw/zinc/63/35/83/457633583.db2.gz	LGPKVQFYXHRZEN-UHFFFAOYSA-N	0	3	345.244	3.354	20	30		EGEDHN
C=CCN1CC[C@H](N(CCc2ccc(OC)cc2)CC(C)(C)C)C1=O	ZINC000410382985	457639222	/nfs/dbraw/zinc/63/92/22/457639222.db2.gz	MXCKLWAPWMFUCB-IBGZPJMESA-N	0	3	344.499	3.373	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NC[C@@]1(C)CCN(Cc2ccccc2)C1	ZINC000370590354	457678543	/nfs/dbraw/zinc/67/85/43/457678543.db2.gz	WAAXADLTGBVUIH-NHCUHLMSSA-N	0	3	344.499	3.244	20	30		EGEDHN
CO[C@H]1CCCN(CC#Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000374666599	457683793	/nfs/dbraw/zinc/68/37/93/457683793.db2.gz	XUBYTCDLBPATAX-HNNXBMFYSA-N	0	3	327.346	3.438	20	30		EGEDHN
C#CCOc1ccc([C@H](C)NCc2ccc(-n3ccnc3)nc2)cc1	ZINC000370670221	457695982	/nfs/dbraw/zinc/69/59/82/457695982.db2.gz	YJYOLQZQDVZFNL-INIZCTEOSA-N	0	3	332.407	3.130	20	30		EGEDHN
C[C@H](CN1CCC[C@@H](C)C1)NC(=O)Nc1ccc(C#N)cc1Cl	ZINC000426134023	457777019	/nfs/dbraw/zinc/77/70/19/457777019.db2.gz	QDQNMYDIJFDQHH-CHWSQXEVSA-N	0	3	334.851	3.454	20	30		EGEDHN
C#CCCCCNC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000366051350	457790047	/nfs/dbraw/zinc/79/00/47/457790047.db2.gz	BEMYVEOMGKGHIF-IBGZPJMESA-N	0	3	327.472	3.001	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCCCOc1ccc(F)cc1	ZINC000433298368	457802183	/nfs/dbraw/zinc/80/21/83/457802183.db2.gz	OHOFEBZSKRVNPI-KRWDZBQOSA-N	0	3	340.398	3.483	20	30		EGEDHN
C=C[C@H](CC(=O)N1C[C@@H](N2CCCC2)[C@@H](SC)C1)c1ccccc1	ZINC000361625757	457809746	/nfs/dbraw/zinc/80/97/46/457809746.db2.gz	VRZBSPZIJJNLHB-QRQLOZEOSA-N	0	3	344.524	3.385	20	30		EGEDHN
N#CCCn1cc(CNCc2cccc(F)c2)c(-c2ccncc2)n1	ZINC000433329032	457811851	/nfs/dbraw/zinc/81/18/51/457811851.db2.gz	XECWMPKIJURYNP-UHFFFAOYSA-N	0	3	335.386	3.288	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)NCc1ccc(C)c(C)n1)C(C)C	ZINC000457759148	457818169	/nfs/dbraw/zinc/81/81/69/457818169.db2.gz	VVFFRWIVXICHHM-IBGZPJMESA-N	0	3	344.503	3.196	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCc1ccccc1-n1ccnc1	ZINC000433376474	457825332	/nfs/dbraw/zinc/82/53/32/457825332.db2.gz	JTWDHJIAISVDBJ-SFHVURJKSA-N	0	3	344.418	3.261	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN2CC[C@H]3CCC[C@H]32)cc1	ZINC000426455620	457833577	/nfs/dbraw/zinc/83/35/77/457833577.db2.gz	CMSYKFJNKVHOEL-VQIMIIECSA-N	0	3	341.455	3.206	20	30		EGEDHN
Cc1cc(CNCc2ccccc2CN2CCC(O)CC2)ccc1C#N	ZINC000443984165	457834968	/nfs/dbraw/zinc/83/49/68/457834968.db2.gz	FHYRHLZCPDICCF-UHFFFAOYSA-N	0	3	349.478	3.113	20	30		EGEDHN
Cc1cc(CNC[C@H]2CN(Cc3ccccc3)CCCO2)ccc1C#N	ZINC000443997800	457837652	/nfs/dbraw/zinc/83/76/52/457837652.db2.gz	RUVFUAFHGJLMFP-QFIPXVFZSA-N	0	3	349.478	3.247	20	30		EGEDHN
CCO[C@@H]1C[C@@H](N(C)C(=O)C(C#N)CCc2ccccc2)C1(C)C	ZINC000433479984	457840519	/nfs/dbraw/zinc/84/05/19/457840519.db2.gz	ZPHHENPYJQXBQH-RCCFBDPRSA-N	0	3	328.456	3.421	20	30		EGEDHN
C=CCN(C)CCN(CC)[C@@H](C)c1nc(Cc2ccccc2)no1	ZINC000411640617	457936470	/nfs/dbraw/zinc/93/64/70/457936470.db2.gz	KXQBTLVCAVTXFQ-INIZCTEOSA-N	0	3	328.460	3.161	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccc(C(=O)c3cc[nH]c3)cc2)nc(C)n1	ZINC000361995696	457996810	/nfs/dbraw/zinc/99/68/10/457996810.db2.gz	HKQFSOMFMWDBFQ-KRWDZBQOSA-N	0	3	344.374	3.143	20	30		EGEDHN
Cc1ccc(C(=O)C(C#N)c2nc(-c3ccncc3)cs2)c(=O)[nH]1	ZINC000358656285	458132311	/nfs/dbraw/zinc/13/23/11/458132311.db2.gz	XTZAERPXYUDTNL-CYBMUJFWSA-N	0	3	336.376	3.104	20	30		EGEDHN
CC(C)(C#N)c1ccc(C(=O)N2CCCN(CC3CCC3)CC2)cc1	ZINC000412319542	458166595	/nfs/dbraw/zinc/16/65/95/458166595.db2.gz	TXMVRJQNUSQTDT-UHFFFAOYSA-N	0	3	339.483	3.436	20	30		EGEDHN
N#Cc1ccc(C2=CCN(C[C@@H](O)c3ccc(C#N)cc3)CC2)cc1	ZINC000362423812	458167164	/nfs/dbraw/zinc/16/71/64/458167164.db2.gz	CCVWPLAFWSBADK-OAQYLSRUSA-N	0	3	329.403	3.253	20	30		EGEDHN
COCC[C@H](c1ccccc1)N1CC[C@@H](Oc2ccc(C#N)cn2)C1	ZINC000428800211	458213319	/nfs/dbraw/zinc/21/33/19/458213319.db2.gz	FTQSACKALAOCAB-RTBURBONSA-N	0	3	337.423	3.184	20	30		EGEDHN
COCC[C@@H](c1ccccc1)N1CC[C@@H](Oc2ccc(C#N)cn2)C1	ZINC000428800205	458213452	/nfs/dbraw/zinc/21/34/52/458213452.db2.gz	FTQSACKALAOCAB-MOPGFXCFSA-N	0	3	337.423	3.184	20	30		EGEDHN
COc1ccc([C@H](CCn2cncn2)NCc2cccc(C#N)c2)cc1	ZINC000446746209	458224824	/nfs/dbraw/zinc/22/48/24/458224824.db2.gz	STKFHHHNFWJHTJ-FQEVSTJZSA-N	0	3	347.422	3.080	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1CN[C@H](c1cnn(C)c1)c1cccc(F)c1	ZINC000436310582	458286756	/nfs/dbraw/zinc/28/67/56/458286756.db2.gz	QLNGWMXJMGJUFY-SNRMKQJTSA-N	0	3	329.419	3.219	20	30		EGEDHN
CN(C)CCN(Cc1cccc(Cl)c1)c1ncc(C#N)cc1F	ZINC000413187166	458295540	/nfs/dbraw/zinc/29/55/40/458295540.db2.gz	DEEHGJATWUZRQB-UHFFFAOYSA-N	0	3	332.810	3.314	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NC(=O)N(C)C[C@@H]1CCCN(C)C1	ZINC000413828492	458308434	/nfs/dbraw/zinc/30/84/34/458308434.db2.gz	UXXGLVTXBXLRFY-RTBURBONSA-N	0	3	329.488	3.157	20	30		EGEDHN
CC(C)(C#N)c1ccc(NC(=O)NCc2ccc3c(c2)CNC3)cc1	ZINC000414819689	458325562	/nfs/dbraw/zinc/32/55/62/458325562.db2.gz	ARGWFTRRPCCRCR-UHFFFAOYSA-N	0	3	334.423	3.413	20	30		EGEDHN
N#C[C@H](NC(=O)C12CCCN1CCC2)c1cccc(C(F)(F)F)c1	ZINC000415383471	458331925	/nfs/dbraw/zinc/33/19/25/458331925.db2.gz	SVFGJWAUXMGQJA-AWEZNQCLSA-N	0	3	337.345	3.015	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)NCc1cc(C)cc(N)c1)C(C)C	ZINC000417065782	458359111	/nfs/dbraw/zinc/35/91/11/458359111.db2.gz	PWWVITGVFUUTLA-IBGZPJMESA-N	0	3	344.503	3.075	20	30		EGEDHN
C=CCN(C)CCN(CC)Cc1ccc(-n2nc(C)cc2C)cc1	ZINC000429704867	458360086	/nfs/dbraw/zinc/36/00/86/458360086.db2.gz	BIFTXSJZZVZUEH-UHFFFAOYSA-N	0	3	326.488	3.429	20	30		EGEDHN
CN(C)C(=O)c1ccccc1CN[C@@H]1CCCc2cc(C#N)ccc21	ZINC000418146108	458372722	/nfs/dbraw/zinc/37/27/22/458372722.db2.gz	OSLOXMMLOCGNGP-HXUWFJFHSA-N	0	3	333.435	3.427	20	30		EGEDHN
CN(C)C1(CN(C)C(=O)N[C@@H]2CCCc3cc(C#N)ccc32)CCC1	ZINC000419613449	458387424	/nfs/dbraw/zinc/38/74/24/458387424.db2.gz	NPSKGWDUKIUQCC-GOSISDBHSA-N	0	3	340.471	3.061	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)N1C[C@@H](N2CCCC2)C[C@H]1C	ZINC000376791827	458389713	/nfs/dbraw/zinc/38/97/13/458389713.db2.gz	IKNKOTPTGNTJLL-ZBFHGGJFSA-N	0	3	342.443	3.047	20	30		EGEDHN
C=CCC[C@H]1NC(=O)N(C[C@@H](c2ccsc2)N(CC)CC)C1=O	ZINC000419930079	458393054	/nfs/dbraw/zinc/39/30/54/458393054.db2.gz	XLHXXRNHDNISAS-CABCVRRESA-N	0	3	335.473	3.018	20	30		EGEDHN
CC1(C)CN(Cc2cccc(OCc3cccc(C#N)c3)c2)C[C@H]1O	ZINC000448354865	458400521	/nfs/dbraw/zinc/40/05/21/458400521.db2.gz	LSACHKMLENZZRF-HXUWFJFHSA-N	0	3	336.435	3.340	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N(C)C[C@@H]1CCCN1C)c1ccc(F)c(F)c1	ZINC000420826387	458402685	/nfs/dbraw/zinc/40/26/85/458402685.db2.gz	AHRPCBGGZNNECF-YOEHRIQHSA-N	0	3	337.414	3.318	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1	ZINC000448767230	458409195	/nfs/dbraw/zinc/40/91/95/458409195.db2.gz	JTHPLWJRDXXQHR-AQNXPRMDSA-N	0	3	342.483	3.167	20	30		EGEDHN
COC(=O)[C@@](C)(CNCc1ccc(C#N)c(F)c1)c1ccc(F)cc1	ZINC000421402695	458413277	/nfs/dbraw/zinc/41/32/77/458413277.db2.gz	WHMJPFJGJRBOFT-IBGZPJMESA-N	0	3	344.361	3.057	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1c(C)onc1C1CC1)C(C)C	ZINC000448976094	458417824	/nfs/dbraw/zinc/41/78/24/458417824.db2.gz	RZQKUGDQVTWYIH-INIZCTEOSA-N	0	3	331.460	3.289	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)NCC(C)(C)CCC#N)CN1Cc1ccccc1	ZINC000376916682	458421210	/nfs/dbraw/zinc/42/12/10/458421210.db2.gz	IMQPQZWFQPXIMV-WMZOPIPTSA-N	0	3	342.487	3.279	20	30		EGEDHN
N#CCCCOc1cccc(CNC[C@@H](O)Cc2cccc(F)c2)c1	ZINC000449362360	458423829	/nfs/dbraw/zinc/42/38/29/458423829.db2.gz	LCZDZYRUJCRSOG-IBGZPJMESA-N	0	3	342.414	3.201	20	30		EGEDHN
C=C(CC)CNCc1cn(C)nc1-c1ccc2c(c1)OCCCO2	ZINC000449733250	458429991	/nfs/dbraw/zinc/42/99/91/458429991.db2.gz	OHNWHWAXFKFWNF-UHFFFAOYSA-N	0	3	327.428	3.304	20	30		EGEDHN
C[C@@H]1C[C@]1(C#N)C(=O)N1CC[C@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000450024712	458437046	/nfs/dbraw/zinc/43/70/46/458437046.db2.gz	QNFIUICEBUBJDQ-DUXKGJEZSA-N	0	3	337.467	3.051	20	30		EGEDHN
CN(CCOCc1ccc(C#N)cc1)CCN(C)Cc1ccccc1	ZINC000451045784	458464246	/nfs/dbraw/zinc/46/42/46/458464246.db2.gz	YVDVFTMEIVSOGT-UHFFFAOYSA-N	0	3	337.467	3.139	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@@H]1C[C@@H](OC)C12CCC2	ZINC000459745818	458465818	/nfs/dbraw/zinc/46/58/18/458465818.db2.gz	FIKGGUIZYKKJFT-IAGOWNOFSA-N	0	3	346.496	3.450	20	30		EGEDHN
CC1(C)[C@H](NCc2ccc(C#N)cc2OC(F)F)[C@H]2CCCO[C@@H]21	ZINC000451477998	458478672	/nfs/dbraw/zinc/47/86/72/458478672.db2.gz	JIFAOXIYHWPOCU-BMFZPTHFSA-N	0	3	336.382	3.453	20	30		EGEDHN
CC(C)(CCC#N)CNC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000377169213	458481290	/nfs/dbraw/zinc/48/12/90/458481290.db2.gz	MBTZYUXHMLATIW-QGZVFWFLSA-N	0	3	345.462	3.484	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCC(=O)N[C@@H](c1ccc(F)cc1)C1CCCC1	ZINC000451604684	458482424	/nfs/dbraw/zinc/48/24/24/458482424.db2.gz	HXUGOKIAALFRAN-WSTZPKSXSA-N	0	3	346.446	3.106	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCC(=O)N[C@@H](CC(C)(C)C)c1ccc(F)cc1	ZINC000451607759	458483535	/nfs/dbraw/zinc/48/35/35/458483535.db2.gz	QKYFHQBDGWLCHB-SQNIBIBYSA-N	0	3	348.462	3.352	20	30		EGEDHN
CO[C@@H]1CCC[C@H]1NCC(=O)N(CCC#N)c1ccc(Cl)c(C)c1	ZINC000451625743	458484520	/nfs/dbraw/zinc/48/45/20/458484520.db2.gz	XVMYHESTIMIBJK-IAGOWNOFSA-N	0	3	349.862	3.052	20	30		EGEDHN
COC(=O)c1ccc(COc2ccccc2CNCCCC#N)cc1	ZINC000437768409	458491072	/nfs/dbraw/zinc/49/10/72/458491072.db2.gz	BLCPRGITWMMRJZ-UHFFFAOYSA-N	0	3	338.407	3.446	20	30		EGEDHN
CCO[C@@H]1CCC[C@H]1NCC(=O)N(CCC#N)c1cccc(Cl)c1	ZINC000452020659	458492690	/nfs/dbraw/zinc/49/26/90/458492690.db2.gz	NQWLGNOZYQXMSQ-IAGOWNOFSA-N	0	3	349.862	3.134	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N1CCCc2occc2C1)C(C)C	ZINC000460125256	458501195	/nfs/dbraw/zinc/50/11/95/458501195.db2.gz	PGXHHMZPTFFMSS-SFHVURJKSA-N	0	3	345.487	3.436	20	30		EGEDHN
Cc1nc2ccccc2cc1C(=O)C(C#N)c1nnc2n1CCCCC2	ZINC000453613917	458538982	/nfs/dbraw/zinc/53/89/82/458538982.db2.gz	CRUZXTKOFOSMEW-INIZCTEOSA-N	0	3	345.406	3.351	20	30		EGEDHN
COc1ccc(N(Cc2cccs2)C(=O)[C@@H](N)CCCC#N)cc1	ZINC000424071299	458550752	/nfs/dbraw/zinc/55/07/52/458550752.db2.gz	ZMPARMOBSJVCDA-KRWDZBQOSA-N	0	3	343.452	3.311	20	30		EGEDHN
C[C@@H](NC(=O)[C@H](N)CCCC#N)C(c1ccccc1)c1ccccc1	ZINC000424101762	458559010	/nfs/dbraw/zinc/55/90/10/458559010.db2.gz	PKSZTEAEDPDNGT-VQIMIIECSA-N	0	3	335.451	3.344	20	30		EGEDHN
C[C@H](CNC(=O)[C@@H](N)CCCC#N)c1c(Cl)cccc1Cl	ZINC000424112910	458561241	/nfs/dbraw/zinc/56/12/41/458561241.db2.gz	LEDNKHLBAWUFPQ-MFKMUULPSA-N	0	3	328.243	3.234	20	30		EGEDHN
C[C@H](CNC(=O)[C@H](N)CCCC#N)c1c(Cl)cccc1Cl	ZINC000424112911	458561263	/nfs/dbraw/zinc/56/12/63/458561263.db2.gz	LEDNKHLBAWUFPQ-ZWNOBZJWSA-N	0	3	328.243	3.234	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N[C@H](Cc1ccccc1)c1cccs1	ZINC000424120852	458563264	/nfs/dbraw/zinc/56/32/64/458563264.db2.gz	HKGWPTKMBNMLES-HZPDHXFCSA-N	0	3	327.453	3.169	20	30		EGEDHN
CC[C@H](CSc1ccc(C)c(C)c1)NC(=O)[C@H](N)CCCC#N	ZINC000424177426	458577740	/nfs/dbraw/zinc/57/77/40/458577740.db2.gz	UHCMIKZFMAECRE-NVXWUHKLSA-N	0	3	333.501	3.312	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NC[C@H]1CCOc2ccccc21	ZINC000469644880	458582513	/nfs/dbraw/zinc/58/25/13/458582513.db2.gz	PHDDKRJABMZAGO-ZWKOTPCHSA-N	0	3	334.419	3.441	20	30		EGEDHN
C[C@@H](C(=O)NC[C@H]1CCCN1Cc1ccccc1)c1cccc(C#N)c1	ZINC000462081602	458593835	/nfs/dbraw/zinc/59/38/35/458593835.db2.gz	CZETZYXFTVLIBM-DYESRHJHSA-N	0	3	347.462	3.443	20	30		EGEDHN
Cc1cc(C#N)cc(NC(=O)N(CCN(C)C)Cc2ccco2)c1	ZINC000456010577	458628272	/nfs/dbraw/zinc/62/82/72/458628272.db2.gz	UELDTSFCPZMLSQ-UHFFFAOYSA-N	0	3	326.400	3.055	20	30		EGEDHN
C[C@H](CC#N)Sc1ccccc1NC(=O)CN[C@]1(C)CCO[C@H]1C	ZINC000494214668	458642059	/nfs/dbraw/zinc/64/20/59/458642059.db2.gz	CBTWJENNVLYLGE-QWQRMKEZSA-N	0	3	347.484	3.176	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCCc2ccc(Cl)cc2)cc1	ZINC000470720474	458646711	/nfs/dbraw/zinc/64/67/11/458646711.db2.gz	VHYBVOLZYMTZNQ-QGZVFWFLSA-N	0	3	337.810	3.253	20	30		EGEDHN
CC(C)(CNC(=O)C(C#N)Cc1ccc(C#N)cc1)Oc1ccccc1	ZINC000470954869	458668991	/nfs/dbraw/zinc/66/89/91/458668991.db2.gz	DGOBPULMUPFYHH-GOSISDBHSA-N	0	3	347.418	3.214	20	30		EGEDHN
CC[C@](C)(C#N)C(=O)NC[C@@H](C(C)C)N1CCc2ccccc2C1	ZINC000505605754	458745450	/nfs/dbraw/zinc/74/54/50/458745450.db2.gz	FCHAUOWLSRVRBD-AZUAARDMSA-N	0	3	327.472	3.125	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@H](C)N1CC[C@H](COc2ccccc2)C1	ZINC000505862813	458748845	/nfs/dbraw/zinc/74/88/45/458748845.db2.gz	ONYNWISVUZMAGN-ROUUACIJSA-N	0	3	330.472	3.200	20	30		EGEDHN
CN(C)CCN(CC1CCCCC1)C(=O)c1ccc(F)c(C#N)c1	ZINC000507466166	458755110	/nfs/dbraw/zinc/75/51/10/458755110.db2.gz	RUUBVMGRNYPPMP-UHFFFAOYSA-N	0	3	331.435	3.281	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN1CC[C@H](CSc2ccccc2)C1	ZINC000464762494	458769862	/nfs/dbraw/zinc/76/98/62/458769862.db2.gz	WDROVOCJKNPQGC-KRWDZBQOSA-N	0	3	330.497	3.301	20	30		EGEDHN
C=CCC[C@H](CC)[NH2+]CC[N-]S(=O)(=O)c1ccc(F)cc1Cl	ZINC000511027184	458777615	/nfs/dbraw/zinc/77/76/15/458777615.db2.gz	IKBJWVIHMPNNGB-ZDUSSCGKSA-N	0	3	348.871	3.092	20	30		EGEDHN
N#Cc1cccc(NC(=O)C2CCN(C/C=C\c3ccncc3)CC2)c1	ZINC000494982921	458777821	/nfs/dbraw/zinc/77/78/21/458777821.db2.gz	YXYPFNUJSSJCOL-RQOWECAXSA-N	0	3	346.434	3.317	20	30		EGEDHN
C=CCN(CCc1ccccc1)C(=O)NC[C@@H]1CCCN1CCC	ZINC000511910592	458780537	/nfs/dbraw/zinc/78/05/37/458780537.db2.gz	OUYZENVTIQJPBN-IBGZPJMESA-N	0	3	329.488	3.301	20	30		EGEDHN
C[C@@H]1C[C@@H](N(C)C(=O)NCC(C)(C)C#N)CCN1Cc1ccccc1	ZINC000512797233	458788657	/nfs/dbraw/zinc/78/86/57/458788657.db2.gz	JUCFUQOEHFCFJW-AEFFLSMTSA-N	0	3	342.487	3.231	20	30		EGEDHN
C[C@@H]1CN(CCCNc2cc(C#N)ccc2C(F)(F)F)CCCO1	ZINC000432845137	458799427	/nfs/dbraw/zinc/79/94/27/458799427.db2.gz	BYICRDUZLSLMLS-CYBMUJFWSA-N	0	3	341.377	3.490	20	30		EGEDHN
Cc1cccc([C@H](C)NC[C@@H](O)COc2ccc(CC#N)cc2)c1C	ZINC000515319731	458807509	/nfs/dbraw/zinc/80/75/09/458807509.db2.gz	RNJGRSCGMIMKOD-PKOBYXMFSA-N	0	3	338.451	3.460	20	30		EGEDHN
Cn1cc([C@@H]2CN(CCCOc3cccc(C#N)c3)CC2(C)C)cn1	ZINC000515586593	458810665	/nfs/dbraw/zinc/81/06/65/458810665.db2.gz	CDARJMDLYYPZCB-IBGZPJMESA-N	0	3	338.455	3.186	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN(C)Cc1cc(C(C)(C)C)[nH]n1	ZINC000515979211	458814014	/nfs/dbraw/zinc/81/40/14/458814014.db2.gz	RFQXEKPLZGSOLZ-UHFFFAOYSA-N	0	3	342.443	3.098	20	30		EGEDHN
C[C@H]1CN(Cc2ccc(CC#N)cc2)CC[C@@H]1NC(=O)OC(C)(C)C	ZINC000495291317	458828071	/nfs/dbraw/zinc/82/80/71/458828071.db2.gz	HAILJXFLJRQMGY-YJBOKZPZSA-N	0	3	343.471	3.488	20	30		EGEDHN
N#CCCCCN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000440935928	458867497	/nfs/dbraw/zinc/86/74/97/458867497.db2.gz	LNYLOKDBPFCJEM-MRXNPFEDSA-N	0	3	325.412	3.321	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@@H]2CCc3ccc(F)cc32)cc1	ZINC000548753822	458873286	/nfs/dbraw/zinc/87/32/86/458873286.db2.gz	TWTRTYBXFRQNLJ-QFBILLFUSA-N	0	3	333.366	3.183	20	30		EGEDHN
C=CC[C@@H](CC)NC(=O)N(CCN(C)C)Cc1cccc(OC)c1	ZINC000466405920	458897607	/nfs/dbraw/zinc/89/76/07/458897607.db2.gz	QLPGFMDPNJOGAK-QGZVFWFLSA-N	0	3	333.476	3.123	20	30		EGEDHN
COC1(CN2CCN([C@@H](C#N)c3cccc(Cl)c3)CC2)CCCC1	ZINC000475339902	458937082	/nfs/dbraw/zinc/93/70/82/458937082.db2.gz	WOHYTUXPOXYUOM-SFHVURJKSA-N	0	3	347.890	3.481	20	30		EGEDHN
C[C@@H]1CC[C@@H](CNC(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)C1	ZINC000475476059	458944722	/nfs/dbraw/zinc/94/47/22/458944722.db2.gz	DMVDQOFBQFSYKL-VQIMIIECSA-N	0	3	342.487	3.068	20	30		EGEDHN
C[C@]1(Cc2ccccc2)CCCN1CC(=O)NCc1cccc(C#N)c1	ZINC000467240053	458960598	/nfs/dbraw/zinc/96/05/98/458960598.db2.gz	YQZVSMGNDZODBL-JOCHJYFZSA-N	0	3	347.462	3.272	20	30		EGEDHN
CN(C)CCN(Cc1ccsc1)C(=O)c1ccc(Cl)c(C#N)c1	ZINC000577039992	458968367	/nfs/dbraw/zinc/96/83/67/458968367.db2.gz	RHBYTSNRNDVJKQ-UHFFFAOYSA-N	0	3	347.871	3.477	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cn(C(C)C)nc1C)C(C)C	ZINC000519652458	458982362	/nfs/dbraw/zinc/98/23/62/458982362.db2.gz	RPUBGWYETPDEII-SFHVURJKSA-N	0	3	332.492	3.201	20	30		EGEDHN
C=C(C)Cn1c([C@H](C)CC)nnc1N1CCN(C2CCCC2)CC1	ZINC000577194794	458996119	/nfs/dbraw/zinc/99/61/19/458996119.db2.gz	OQMMCFMNSSYUJX-MRXNPFEDSA-N	0	3	331.508	3.432	20	30		EGEDHN
C[C@H](CC(=O)NCCc1ccccc1)N[C@H](C)c1ccc(C#N)cc1	ZINC000531951466	459006970	/nfs/dbraw/zinc/00/69/70/459006970.db2.gz	BYPFGBFYWQJCMP-IAGOWNOFSA-N	0	3	335.451	3.346	20	30		EGEDHN
C[C@@H](CC(=O)NCCc1ccccc1)N[C@@H](C)c1ccc(C#N)cc1	ZINC000531951467	459007008	/nfs/dbraw/zinc/00/70/08/459007008.db2.gz	BYPFGBFYWQJCMP-IRXDYDNUSA-N	0	3	335.451	3.346	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N[C@@H]1CN(C2CC2)C[C@H]1C)c1ccc(F)c(F)c1	ZINC000477227245	459036724	/nfs/dbraw/zinc/03/67/24/459036724.db2.gz	YQBXDYUMNYSQMR-PJSAGSTRSA-N	0	3	349.425	3.364	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)N[C@@H](c1ccc(OC)cc1)C1CC1	ZINC000477336374	459040749	/nfs/dbraw/zinc/04/07/49/459040749.db2.gz	HHOAIHSEHUVLTG-HNAYVOBHSA-N	0	3	328.456	3.325	20	30		EGEDHN
CCN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)C1(C#N)CC(C)C1	ZINC000532319858	459065947	/nfs/dbraw/zinc/06/59/47/459065947.db2.gz	XGTDUBFQCFQQRB-MOMVYJMYSA-N	0	3	339.483	3.297	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@@H](Cc3ccccc3)C2)CC1	ZINC000520710106	459085397	/nfs/dbraw/zinc/08/53/97/459085397.db2.gz	JZQVZNPHSMRHHT-IBGZPJMESA-N	0	3	341.499	3.301	20	30		EGEDHN
CC(C#N)C(=O)N[C@@H](Cc1cccc(Br)c1)CC1CC1	ZINC000479266835	459130484	/nfs/dbraw/zinc/13/04/84/459130484.db2.gz	OQXUKKVHTMBNAF-XHDPSFHLSA-N	0	3	335.245	3.436	20	30		EGEDHN
Cc1c(C#N)cccc1NC(=O)[C@H]1CCCN(Cc2cccnc2)C1	ZINC000532750189	459139587	/nfs/dbraw/zinc/13/95/87/459139587.db2.gz	NFSGHUXRAJSGOO-SFHVURJKSA-N	0	3	334.423	3.112	20	30		EGEDHN
CN(CCCOc1ccc(F)cc1)CCOc1cccc(C#N)c1	ZINC000521424437	459151267	/nfs/dbraw/zinc/15/12/67/459151267.db2.gz	BVZDLOMTFAWTKE-UHFFFAOYSA-N	0	3	328.387	3.477	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H](CNC[C@H](C#N)CCC#N)C1	ZINC000496329136	459152450	/nfs/dbraw/zinc/15/24/50/459152450.db2.gz	SIRBSLRTRXCHSF-OWCLPIDISA-N	0	3	334.464	3.103	20	30		EGEDHN
N#Cc1cccc(CNC(=O)CN2CCC[C@H]2CCc2ccccc2)c1	ZINC000521814996	459178218	/nfs/dbraw/zinc/17/82/18/459178218.db2.gz	XQGOVGNMPHCFMU-NRFANRHFSA-N	0	3	347.462	3.272	20	30		EGEDHN
CCC[C@@H]1CN(Cc2ccc(C#N)cn2)CCN1Cc1ccccc1	ZINC000567911576	459188963	/nfs/dbraw/zinc/18/89/63/459188963.db2.gz	UROYHHCALQUVOD-OAQYLSRUSA-N	0	3	334.467	3.440	20	30		EGEDHN
CCc1ccc2nccc(N3CCN(c4cnccc4C#N)CC3)c2c1	ZINC000590703286	459188966	/nfs/dbraw/zinc/18/89/66/459188966.db2.gz	BVFCRUOEBHQPNJ-UHFFFAOYSA-N	0	3	343.434	3.390	20	30		EGEDHN
CCOc1c(CNCCc2ccc(C#N)cc2)c(C)nn1CC(C)C	ZINC000594955257	459192671	/nfs/dbraw/zinc/19/26/71/459192671.db2.gz	MERKSPPXCVGTGZ-UHFFFAOYSA-N	0	3	340.471	3.450	20	30		EGEDHN
C=C(C)CN(C)C[C@@H](O)COc1ccc(Cl)cc1Br	ZINC000481308782	459244871	/nfs/dbraw/zinc/24/48/71/459244871.db2.gz	ASWWUTPLTBLATO-GFCCVEGCSA-N	0	3	348.668	3.350	20	30		EGEDHN
C[C@@H](N[C@H](COC(N)=O)Cc1ccccc1)c1ccc(C#N)c(F)c1	ZINC000496597113	459253375	/nfs/dbraw/zinc/25/33/75/459253375.db2.gz	UAKKYYXROCIYGF-DYVFJYSZSA-N	0	3	341.386	3.469	20	30		EGEDHN
C=CC[C@H](C)NCc1nc2c(s1)CN(C(=O)OC(C)(C)C)CC2	ZINC000496650445	459272871	/nfs/dbraw/zinc/27/28/71/459272871.db2.gz	ZDDJRCYYRXRMST-LBPRGKRZSA-N	0	3	337.489	3.491	20	30		EGEDHN
N#Cc1ccc(CCN2CCC(OC[C@@H]3CCCCO3)CC2)cc1	ZINC000595347332	459281363	/nfs/dbraw/zinc/28/13/63/459281363.db2.gz	SQFOJFSQRJRAKO-FQEVSTJZSA-N	0	3	328.456	3.151	20	30		EGEDHN
C[C@]1(C#N)CCCN(C(=O)c2cccc(CN3CCCCC3)c2)C1	ZINC000591075800	459306776	/nfs/dbraw/zinc/30/67/76/459306776.db2.gz	JTAHZBIVRRNWGA-HXUWFJFHSA-N	0	3	325.456	3.438	20	30		EGEDHN
N#C[C@@H]1CC[C@@H](N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2=O)C1	ZINC000582097037	459307069	/nfs/dbraw/zinc/30/70/69/459307069.db2.gz	SQUMQVROSPYTPR-IOASZLSFSA-N	0	3	349.381	3.065	20	30		EGEDHN
C[C@@H](CN1CCC(C)CC1)NC(=O)N[C@@H](C)c1ccc(C#N)cc1	ZINC000595460957	459309762	/nfs/dbraw/zinc/30/97/62/459309762.db2.gz	IPDLDNOTOLRPID-HOTGVXAUSA-N	0	3	328.460	3.039	20	30		EGEDHN
C[C@@H](NC(=O)[C@H]1CCCN(Cc2cccnc2)C1)c1ccc(C#N)cc1	ZINC000523668628	459321368	/nfs/dbraw/zinc/32/13/68/459321368.db2.gz	YAJKDGZRPWDASE-UZLBHIALSA-N	0	3	348.450	3.043	20	30		EGEDHN
N#CC(C(=O)c1ccc2c(c1)CCCC2=O)c1nnc2n1CCCCC2	ZINC000560350006	459329285	/nfs/dbraw/zinc/32/92/85/459329285.db2.gz	DXOFDNKGGLGJLX-INIZCTEOSA-N	0	3	348.406	3.014	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CCc2ccccc2CC1	ZINC000523861875	459335746	/nfs/dbraw/zinc/33/57/46/459335746.db2.gz	FDQMHKKHTHDYGD-NRFANRHFSA-N	0	3	337.463	3.256	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1nc(-c2c(F)cccc2F)cs1	ZINC000568745534	459338520	/nfs/dbraw/zinc/33/85/20/459338520.db2.gz	ZURVEOQPWYXUSO-LLVKDONJSA-N	0	3	336.367	3.048	20	30		EGEDHN
CC(C)C1CCC(N2CCN(Cc3cc(C#N)n(C)c3)CC2)CC1	ZINC000483255991	459354815	/nfs/dbraw/zinc/35/48/15/459354815.db2.gz	CFPCUPDYBGIPJG-UHFFFAOYSA-N	0	3	328.504	3.229	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN1CCC[C@H]1c1c(C)cccc1C	ZINC000595600061	459360687	/nfs/dbraw/zinc/36/06/87/459360687.db2.gz	FZTFUBRXLPZCDA-YJBOKZPZSA-N	0	3	327.472	3.449	20	30		EGEDHN
N#CC[C@@H]1CCCN(C[C@H](O)CO[C@H]2CCCc3ccccc32)C1	ZINC000595611911	459367479	/nfs/dbraw/zinc/36/74/79/459367479.db2.gz	OXNFWIJARGWGMM-QRFRQXIXSA-N	0	3	328.456	3.067	20	30		EGEDHN
CC[C@@H](CN1CCCC1)NC(=O)N[C@H]1CCCc2cc(C#N)ccc21	ZINC000591391203	459369283	/nfs/dbraw/zinc/36/92/83/459369283.db2.gz	QMMYBPIVYWSLQA-HKUYNNGSSA-N	0	3	340.471	3.109	20	30		EGEDHN
Cc1ccccc1[C@H]1C[C@H](C)N(CC(=O)NCc2cccc(C#N)c2)C1	ZINC000524593495	459373143	/nfs/dbraw/zinc/37/31/43/459373143.db2.gz	CLNBSHDVMLTMQJ-PXNSSMCTSA-N	0	3	347.462	3.361	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)NC[C@H]1CCCN(C)C1	ZINC000569009758	459381321	/nfs/dbraw/zinc/38/13/21/459381321.db2.gz	DANQIBJTIRXNDZ-CQSZACIVSA-N	0	3	327.453	3.153	20	30		EGEDHN
CN(C[C@H]1CCCN1C)C(=O)c1c(Cl)cc(C#N)cc1Cl	ZINC000591540948	459398532	/nfs/dbraw/zinc/39/85/32/459398532.db2.gz	QLXIYFSFNIXESV-LLVKDONJSA-N	0	3	326.227	3.031	20	30		EGEDHN
Cc1ccc(OC[C@@H](O)CNCc2ccc(C#N)c(Cl)c2)c(C)c1	ZINC000591765853	459431244	/nfs/dbraw/zinc/43/12/44/459431244.db2.gz	LNYGOHGNAMUPKR-KRWDZBQOSA-N	0	3	344.842	3.358	20	30		EGEDHN
CC(C)(C)OC(=O)NCC12CCC(CC1)CN2[C@H]1CC[C@@H](C#N)C1	ZINC000497100039	459439103	/nfs/dbraw/zinc/43/91/03/459439103.db2.gz	PXCUAWCZHYTERZ-BHEGOAEISA-N	0	3	333.476	3.448	20	30		EGEDHN
CC(C)(C)OC(=O)NCc1ccc(CN[C@@H]2CC[C@@H](C#N)C2)cc1	ZINC000497137794	459456225	/nfs/dbraw/zinc/45/62/25/459456225.db2.gz	ZOBOUXLGNITMOI-IAGOWNOFSA-N	0	3	329.444	3.493	20	30		EGEDHN
CCOC(=O)CC1(NCc2ccccc2C(C)(C)C#N)CCOCC1	ZINC000595873485	459469994	/nfs/dbraw/zinc/46/99/94/459469994.db2.gz	ACUGKDFODRNXRE-UHFFFAOYSA-N	0	3	344.455	3.080	20	30		EGEDHN
CCc1ccc(CN[C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)s1	ZINC000541871295	459502358	/nfs/dbraw/zinc/50/23/58/459502358.db2.gz	ULLBKBHUOIIZOP-GOSISDBHSA-N	0	3	339.464	3.467	20	30		EGEDHN
C=CCn1c(CC)nnc1N1C[C@@H](C)N(Cc2ccccc2)C[C@H]1C	ZINC000562030032	459505287	/nfs/dbraw/zinc/50/52/87/459505287.db2.gz	WDFOLNBFJHMIJZ-IAGOWNOFSA-N	0	3	339.487	3.126	20	30		EGEDHN
CCN(CCN1CCCCCC1)C(=O)Nc1ccc(C#N)cc1OC	ZINC000562248217	459522654	/nfs/dbraw/zinc/52/26/54/459522654.db2.gz	KKLGHJFHCAHPIC-UHFFFAOYSA-N	0	3	344.459	3.297	20	30		EGEDHN
C=C(CN[C@H](Cc1ccc(C(F)(F)F)cc1)C(N)=O)c1ccccc1	ZINC000488385427	459543337	/nfs/dbraw/zinc/54/33/37/459543337.db2.gz	PEOSRCUBRODTHK-QGZVFWFLSA-N	0	3	348.368	3.405	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCN(CCOC3CCCCCC3)C2)nc1	ZINC000562362770	459545973	/nfs/dbraw/zinc/54/59/73/459545973.db2.gz	OTNYSBGCSNALDR-SFHVURJKSA-N	0	3	329.444	3.146	20	30		EGEDHN
C=C(C)Cn1c(C2CCCC2)nnc1N1CCCN(C(C)C)CC1	ZINC000572355070	459578996	/nfs/dbraw/zinc/57/89/96/459578996.db2.gz	PCQZWXVUPQOSFA-UHFFFAOYSA-N	0	3	331.508	3.432	20	30		EGEDHN
C#CCN1CCC(C(=O)NCC2CCC(c3ccccc3)CC2)CC1	ZINC000490628354	459581671	/nfs/dbraw/zinc/58/16/71/459581671.db2.gz	HOIVISOQDOGCPK-UHFFFAOYSA-N	0	3	338.495	3.422	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCc2cc3c(s2)CCCC3)cc1	ZINC000527071552	459586619	/nfs/dbraw/zinc/58/66/19/459586619.db2.gz	MKLLJMICXNSFRQ-QGZVFWFLSA-N	0	3	349.459	3.497	20	30		EGEDHN
C#CCNC(=O)C1CCN(Cc2cccc(-c3ccccc3)c2)CC1	ZINC000491154787	459602062	/nfs/dbraw/zinc/60/20/62/459602062.db2.gz	MENZFIRQZAPREA-UHFFFAOYSA-N	0	3	332.447	3.315	20	30		EGEDHN
N#CCC1CCN(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)CC1	ZINC000542892908	459608422	/nfs/dbraw/zinc/60/84/22/459608422.db2.gz	GGYDMGGPCNGRCG-IBGZPJMESA-N	0	3	340.471	3.159	20	30		EGEDHN
C[C@@]1(CCc2ccccc2)CCN(Cc2cnc3c(C#N)cnn3c2)C1	ZINC000573121444	459629880	/nfs/dbraw/zinc/62/98/80/459629880.db2.gz	CWRCIFHFKVIABD-OAQYLSRUSA-N	0	3	345.450	3.446	20	30		EGEDHN
C#C[C@H](NC(=N)Nc1cc(OC)ccc1OC)c1ccc(F)cc1	ZINC000491619596	459639926	/nfs/dbraw/zinc/63/99/26/459639926.db2.gz	BBKLTVPGIUFQQB-HNNXBMFYSA-N	0	3	327.359	3.154	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cc(Cl)ccc2OC(F)F)CC1	ZINC000491626464	459642505	/nfs/dbraw/zinc/64/25/05/459642505.db2.gz	SQABWVSIQBTPGD-UHFFFAOYSA-N	0	3	342.773	3.225	20	30		EGEDHN
CN(CCc1ccccc1)[C@@H]1CCN(C(=O)Nc2ccc(C#N)cc2)C1	ZINC000596470764	459647951	/nfs/dbraw/zinc/64/79/51/459647951.db2.gz	HCCSLTBJWCDXIZ-HXUWFJFHSA-N	0	3	348.450	3.339	20	30		EGEDHN
C=CCOc1ccc(C(=O)Nc2cccc(OCCN(C)C)c2)cc1	ZINC000500295407	459674142	/nfs/dbraw/zinc/67/41/42/459674142.db2.gz	CKEOMXIUPQIELV-UHFFFAOYSA-N	0	3	340.423	3.444	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)NC[C@@H](C)C#N)N(CC)CC)cc1	ZINC000563032340	459700429	/nfs/dbraw/zinc/70/04/29/459700429.db2.gz	WDPKOPLQRWRBTF-MAUKXSAKSA-N	0	3	330.476	3.091	20	30		EGEDHN
Cc1cccc2nc(CCNC(=O)C(C#N)CCc3ccccc3)cn21	ZINC000592937845	459720099	/nfs/dbraw/zinc/72/00/99/459720099.db2.gz	HHRCUFSVULCIAQ-SFHVURJKSA-N	0	3	346.434	3.074	20	30		EGEDHN
C=CCCC[C@@H](C)NC(=O)N[C@@H](CN(C)C)c1ccc(OC)cc1	ZINC000501551522	459735768	/nfs/dbraw/zinc/73/57/68/459735768.db2.gz	GWNYEKZNQBITRG-QAPCUYQASA-N	0	3	333.476	3.342	20	30		EGEDHN
CC(C#N)C(=O)NCc1ccc([C@@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000493445333	459745151	/nfs/dbraw/zinc/74/51/51/459745151.db2.gz	RROMEQXPZULFEZ-QWHCGFSZSA-N	0	3	331.416	3.048	20	30		EGEDHN
CN(C(=O)C(C[C@H]1CCCO1)C(F)(F)F)c1ccc(C#N)cc1F	ZINC000593051829	459756005	/nfs/dbraw/zinc/75/60/05/459756005.db2.gz	ONKSRSCYBOXOKG-VXGBXAGGSA-N	0	3	344.308	3.408	20	30		EGEDHN
C=CCOc1ccc(CN2CCC[C@H](c3nc(N(C)C)no3)C2)cc1	ZINC000564285008	459772184	/nfs/dbraw/zinc/77/21/84/459772184.db2.gz	VREKMXPGGRJEDI-INIZCTEOSA-N	0	3	342.443	3.080	20	30		EGEDHN
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NCc1ccc(C#N)s1	ZINC000584581639	459772199	/nfs/dbraw/zinc/77/21/99/459772199.db2.gz	NUGZYNRXGRFZMU-GUYCJALGSA-N	0	3	328.437	3.130	20	30		EGEDHN
CCc1ccc([C@@H](C#N)NC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000564224634	459772211	/nfs/dbraw/zinc/77/22/11/459772211.db2.gz	NULFNJDSPYLIDA-LEWJYISDSA-N	0	3	347.462	3.452	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N[C@@H]1CCO[C@@H](c2ccncc2)C1	ZINC000564637051	459775336	/nfs/dbraw/zinc/77/53/36/459775336.db2.gz	DWRHEOOHFYKDPG-XUVXKRRUSA-N	0	3	349.434	3.190	20	30		EGEDHN
O[C@H](CNCC#Cc1ccccc1)CO[C@H]1CCCc2ccccc21	ZINC000565475862	459784577	/nfs/dbraw/zinc/78/45/77/459784577.db2.gz	GUHULEGWVLWJBZ-IRLDBZIGSA-N	0	3	335.447	3.083	20	30		EGEDHN
N#Cc1ccc2c(c1)CCN2C(=O)C(C[C@H]1CCCO1)C(F)(F)F	ZINC000593174245	459796859	/nfs/dbraw/zinc/79/68/59/459796859.db2.gz	UGYJXVYGLYULQJ-ZIAGYGMSSA-N	0	3	338.329	3.195	20	30		EGEDHN
N#Cc1cccc2c1CCN2C(=O)C(C[C@H]1CCCO1)C(F)(F)F	ZINC000593175705	459797264	/nfs/dbraw/zinc/79/72/64/459797264.db2.gz	ZLQVBNLWMDITBT-TZMCWYRMSA-N	0	3	338.329	3.195	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CCCc3ccccc3CC2)cc1	ZINC000584764126	459798459	/nfs/dbraw/zinc/79/84/59/459798459.db2.gz	NSOVUTGLSTUBPZ-NRFANRHFSA-N	0	3	343.430	3.258	20	30		EGEDHN
N#CC(C(=O)c1cnn(C2CC2)c1)c1nc2ccccc2n1C(F)F	ZINC000528924460	459818476	/nfs/dbraw/zinc/81/84/76/459818476.db2.gz	NRORIYVMIPRZEP-LBPRGKRZSA-N	0	3	341.321	3.453	20	30		EGEDHN
CCC(C#N)(CC)C(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1	ZINC000528946587	459818950	/nfs/dbraw/zinc/81/89/50/459818950.db2.gz	SZEJZEBSTCOEJO-UHFFFAOYSA-N	0	3	342.487	3.485	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc3c(c2)OCC3(C)C)CC1	ZINC000529152591	459823220	/nfs/dbraw/zinc/82/32/20/459823220.db2.gz	FSOHMWFSARMGSO-UHFFFAOYSA-N	0	3	329.444	3.129	20	30		EGEDHN
COCc1ccc(NC(=O)NC[C@@H](C)N2CCCC[C@H]2C)cc1C#N	ZINC000529211935	459825558	/nfs/dbraw/zinc/82/55/58/459825558.db2.gz	QCEUYVKXGOAGTO-HUUCEWRRSA-N	0	3	344.459	3.089	20	30		EGEDHN
COCc1ccc(NC(=O)[C@H]2CCCCN2C2CCCC2)cc1C#N	ZINC000529818081	459850816	/nfs/dbraw/zinc/85/08/16/459850816.db2.gz	USBVMWOOQQRAGV-LJQANCHMSA-N	0	3	341.455	3.440	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)CN1C[C@H](c2ccccc2)[C@@H]2CCC[C@H]21	ZINC000586776478	459870866	/nfs/dbraw/zinc/87/08/66/459870866.db2.gz	FNFMURZHKNLRLZ-PXCRPINLSA-N	0	3	339.483	3.309	20	30		EGEDHN
Cc1nsc(N2CCCN(Cc3ccccc3C)CC2)c1C#N	ZINC000587185575	459891344	/nfs/dbraw/zinc/89/13/44/459891344.db2.gz	GNBIRSYHOPXABO-UHFFFAOYSA-N	0	3	326.469	3.344	20	30		EGEDHN
CC[C@H](C#N)C(=O)N1CC[C@@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000593500727	459907957	/nfs/dbraw/zinc/90/79/57/459907957.db2.gz	SHQRTTBKHQOCTL-QUCCMNQESA-N	0	3	325.456	3.051	20	30		EGEDHN
N#Cc1ccccc1-c1ccc(CN(CC(N)=O)C2CCCC2)cc1	ZINC000609144040	459911068	/nfs/dbraw/zinc/91/10/68/459911068.db2.gz	FIEVBWJMWKLRAR-UHFFFAOYSA-N	0	3	333.435	3.455	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCN2CCCO[C@H](c3ccccc3)C2)cc1	ZINC000609234347	459929362	/nfs/dbraw/zinc/92/93/62/459929362.db2.gz	QILACDXORAZNQE-FQEVSTJZSA-N	0	3	349.434	3.350	20	30		EGEDHN
C[C@@H](CCC#N)CN1CCN(Cc2cn3cc(Cl)ccc3n2)CC1	ZINC000602449611	459944063	/nfs/dbraw/zinc/94/40/63/459944063.db2.gz	FEQGVVOSIDNHNH-HNNXBMFYSA-N	0	3	345.878	3.045	20	30		EGEDHN
COc1ccccc1CNC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000593687538	459950652	/nfs/dbraw/zinc/95/06/52/459950652.db2.gz	HZZGWKDKAFLDNH-UHFFFAOYSA-N	0	3	335.451	3.321	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN(Cc1cccc(F)c1)C[C@@H]1CCCO1	ZINC000598589578	459954959	/nfs/dbraw/zinc/95/49/59/459954959.db2.gz	GYRHGFPWFSCHMD-MSOLQXFVSA-N	0	3	334.435	3.107	20	30		EGEDHN
CN(Cc1ccc(OCC(F)(F)F)cc1)C[C@H](O)CC(C)(C)C#N	ZINC000598617491	459964747	/nfs/dbraw/zinc/96/47/47/459964747.db2.gz	SKCUJDKACXINIZ-CQSZACIVSA-N	0	3	344.377	3.360	20	30		EGEDHN
CC(C)(C)OC(=O)CC[C@H]1CCCCN1C[C@@H](O)CC(C)(C)C#N	ZINC000598622127	459966620	/nfs/dbraw/zinc/96/66/20/459966620.db2.gz	LQKHBQYSWIFSQZ-CVEARBPZSA-N	0	3	338.492	3.264	20	30		EGEDHN
CC(C)C(=O)Nc1ccc(CN[C@@H](C)CC2(C#N)CCOCC2)cc1	ZINC000602505527	459972150	/nfs/dbraw/zinc/97/21/50/459972150.db2.gz	FCCFBJHVQOJOAY-INIZCTEOSA-N	0	3	343.471	3.470	20	30		EGEDHN
C[C@H](Cc1ccc(Br)cc1)NCc1cccc(C#N)n1	ZINC000602515084	459978727	/nfs/dbraw/zinc/97/87/27/459978727.db2.gz	UAPLKVCBKONZGV-GFCCVEGCSA-N	0	3	330.229	3.437	20	30		EGEDHN
CC(C)(C)[C@H]1CCCN(CC(=O)NCc2cccc(C#N)c2)CC1	ZINC000609706129	460009048	/nfs/dbraw/zinc/00/90/48/460009048.db2.gz	AMHTVYWHHLZACN-SFHVURJKSA-N	0	3	327.472	3.323	20	30		EGEDHN
COc1ccc2c(c1)[C@@H](N[C@H](C)CC1(C#N)CCOCC1)CCO2	ZINC000602613344	460022661	/nfs/dbraw/zinc/02/26/61/460022661.db2.gz	YDLBXQZPZQGKCG-PBHICJAKSA-N	0	3	330.428	3.207	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN(C)[C@H]1CC[C@@H](C(F)(F)F)CC1	ZINC000575901441	460030020	/nfs/dbraw/zinc/03/00/20/460030020.db2.gz	KWFQVRLIPRDMJF-MELADBBJSA-N	0	3	333.398	3.047	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)C(=O)N(CCN(C)C)C1CCCC1	ZINC000593988798	460042704	/nfs/dbraw/zinc/04/27/04/460042704.db2.gz	HCMHQNCAYAXDJK-INIZCTEOSA-N	0	3	327.472	3.070	20	30		EGEDHN
Cc1cc(NC(=O)CNC[C@@H](C)CCC#N)ccc1Br	ZINC000602694352	460069157	/nfs/dbraw/zinc/06/91/57/460069157.db2.gz	LOZRDZXUSRFHIX-NSHDSACASA-N	0	3	338.249	3.226	20	30		EGEDHN
C[C@@H](CCC#N)CN1CCN(c2cc(C(F)(F)F)ccn2)CC1	ZINC000602713419	460080219	/nfs/dbraw/zinc/08/02/19/460080219.db2.gz	ADRFXEYDAPKUBG-ZDUSSCGKSA-N	0	3	326.366	3.162	20	30		EGEDHN
C[C@@H](CC1(C#N)CCOCC1)NCc1cccc2c1OC(F)(F)O2	ZINC000602720874	460083917	/nfs/dbraw/zinc/08/39/17/460083917.db2.gz	FIZSJGLFHKDEGI-LBPRGKRZSA-N	0	3	338.354	3.197	20	30		EGEDHN
CC1(F)CCN(Cc2cn(CCC#N)nc2-c2ccncc2)CC1	ZINC000602741812	460101508	/nfs/dbraw/zinc/10/15/08/460101508.db2.gz	NSFXXBHLCUFGGD-UHFFFAOYSA-N	0	3	327.407	3.183	20	30		EGEDHN
CC(C)(C)N1C[C@@H](C(=O)N2CCC[C@H](CC#N)C2)[C@H](C(F)(F)F)C1	ZINC000597901792	460101937	/nfs/dbraw/zinc/10/19/37/460101937.db2.gz	ZMXPNUHMZALZDZ-MGPQQGTHSA-N	0	3	345.409	3.047	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCc1cccnc1N1CCCC1	ZINC000597940304	460120568	/nfs/dbraw/zinc/12/05/68/460120568.db2.gz	IFFBTNWCLKGHEP-SFHVURJKSA-N	0	3	348.450	3.071	20	30		EGEDHN
Cc1ccc(CNC(=O)C2CCN(CC3(CC#N)CC3)CC2)cc1	ZINC000602783232	460121894	/nfs/dbraw/zinc/12/18/94/460121894.db2.gz	NZLHUWRCMYXZPU-UHFFFAOYSA-N	0	3	325.456	3.017	20	30		EGEDHN
C[C@@H](NC(=O)NCCN(C)Cc1ccccc1)c1cccc(C#N)c1	ZINC000610348981	460130248	/nfs/dbraw/zinc/13/02/48/460130248.db2.gz	LBAZEZKOWGTZAV-MRXNPFEDSA-N	0	3	336.439	3.050	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CN2CCC(C3CCCC3)CC2)cc1	ZINC000610370824	460138751	/nfs/dbraw/zinc/13/87/51/460138751.db2.gz	NDJNMORCZILMOB-IBGZPJMESA-N	0	3	328.456	3.200	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H]1CCN(CCOc2cccc(C#N)c2)C1	ZINC000610433587	460151064	/nfs/dbraw/zinc/15/10/64/460151064.db2.gz	VIKQSQHNVASUEK-HXUWFJFHSA-N	0	3	335.451	3.143	20	30		EGEDHN
N#Cc1ccc(CNC(=O)N[C@H]2CCCN3CCCC[C@H]23)cc1Cl	ZINC000594247131	460170739	/nfs/dbraw/zinc/17/07/39/460170739.db2.gz	AIXDODANHCSPMY-DLBZAZTESA-N	0	3	346.862	3.028	20	30		EGEDHN
N#Cc1ccc(CNC(=O)N[C@@H]2CCCN3CCCC[C@H]23)cc1Cl	ZINC000594247132	460170948	/nfs/dbraw/zinc/17/09/48/460170948.db2.gz	AIXDODANHCSPMY-IAGOWNOFSA-N	0	3	346.862	3.028	20	30		EGEDHN
CN(C[C@H](O)COc1cc(Cl)cc(Cl)c1)[C@H]1CC[C@H](C#N)C1	ZINC000602924592	460187359	/nfs/dbraw/zinc/18/73/59/460187359.db2.gz	GHICDIALGHSVFR-CQDKDKBSSA-N	0	3	343.254	3.357	20	30		EGEDHN
COCc1csc(CNC(=O)C(C#N)CCc2ccccc2)c1	ZINC000598207567	460204214	/nfs/dbraw/zinc/20/42/14/460204214.db2.gz	SZVHHZJOJNJBGX-INIZCTEOSA-N	0	3	328.437	3.283	20	30		EGEDHN
CC(C)N(Cc1ccc(F)cc1)C[C@@H](O)COc1ccccc1C#N	ZINC000599273437	460213902	/nfs/dbraw/zinc/21/39/02/460213902.db2.gz	DJHGCCSNBZXICR-LJQANCHMSA-N	0	3	342.414	3.348	20	30		EGEDHN
CN(Cc1cc2ccccc2o1)C[C@@H](O)COc1ccccc1C#N	ZINC000599308251	460222608	/nfs/dbraw/zinc/22/26/08/460222608.db2.gz	RWLSNHDBWKFPMD-QGZVFWFLSA-N	0	3	336.391	3.176	20	30		EGEDHN
CCN(C[C@@H](O)COc1ccccc1C#N)[C@H](C)c1cccc(O)c1	ZINC000599308091	460223290	/nfs/dbraw/zinc/22/32/90/460223290.db2.gz	RGSFFZVSTGSQQT-DNVCBOLYSA-N	0	3	340.423	3.087	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)NCCCc1c(Cl)cccc1Cl	ZINC000594448252	460223876	/nfs/dbraw/zinc/22/38/76/460223876.db2.gz	DAUOLRKLMZQVIW-AWEZNQCLSA-N	0	3	328.243	3.063	20	30		EGEDHN
C[C@H](NC(=O)N(CCN(C)C)C1CCCC1)c1cccc(C#N)c1	ZINC000610720787	460224859	/nfs/dbraw/zinc/22/48/59/460224859.db2.gz	ZCOHHIZFTOKJJP-HNNXBMFYSA-N	0	3	328.460	3.135	20	30		EGEDHN
C[C@@]1(NC[C@@H](O)COc2ccccc2C#N)CCCc2ccccc21	ZINC000599327317	460229549	/nfs/dbraw/zinc/22/95/49/460229549.db2.gz	RGNKSOXEJUDGRP-WIYYLYMNSA-N	0	3	336.435	3.139	20	30		EGEDHN
CC[C@H](NC[C@H](O)COc1ccccc1C#N)c1ccc(F)cc1F	ZINC000599355918	460236633	/nfs/dbraw/zinc/23/66/33/460236633.db2.gz	KDJDKNVUQPUOMB-YJBOKZPZSA-N	0	3	346.377	3.317	20	30		EGEDHN
CSc1ccccc1[C@H](C)NC[C@@H](O)COc1ccccc1C#N	ZINC000599398052	460247142	/nfs/dbraw/zinc/24/71/42/460247142.db2.gz	SBOHIHDHOFVNQU-GOEBONIOSA-N	0	3	342.464	3.371	20	30		EGEDHN
CN1CCC(N(Cc2ccccc2)C(=O)Nc2ccnc(C#N)c2)CC1	ZINC000603125649	460247844	/nfs/dbraw/zinc/24/78/44/460247844.db2.gz	APNWEJOIKOGDHP-UHFFFAOYSA-N	0	3	349.438	3.082	20	30		EGEDHN
Cc1cc(Cl)cc2c1OCCC[C@H]2NC1CCN(CC#N)CC1	ZINC000610898278	460258358	/nfs/dbraw/zinc/25/83/58/460258358.db2.gz	IHMRQOXCUJTYKK-QGZVFWFLSA-N	0	3	333.863	3.440	20	30		EGEDHN
CC[C@](C)(N)c1cn(Cc2ccc(-c3ccccc3C#N)cc2)nn1	ZINC000603192333	460262742	/nfs/dbraw/zinc/26/27/42/460262742.db2.gz	YDWURGQIYUSDKJ-FQEVSTJZSA-N	0	3	331.423	3.449	20	30		EGEDHN
Cc1ccc(CN2CC[C@@H](CN(C)c3ccc(C#N)cn3)C2)s1	ZINC000603400578	460297739	/nfs/dbraw/zinc/29/77/39/460297739.db2.gz	LPBAYRLDLJWUIO-INIZCTEOSA-N	0	3	326.469	3.282	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN[C@H](CCO)c1cc(Cl)cc(Cl)c1	ZINC000599676280	460306819	/nfs/dbraw/zinc/30/68/19/460306819.db2.gz	DFGZKKXDSIGQNH-HUUCEWRRSA-N	0	3	345.270	3.307	20	30		EGEDHN
Cn1c2ccc(C(=O)C(C#N)c3ccc4ccccc4n3)cc2[nH]c1=O	ZINC000603627823	460328619	/nfs/dbraw/zinc/32/86/19/460328619.db2.gz	XGKQOVFKTGCVBT-AWEZNQCLSA-N	0	3	342.358	3.317	20	30		EGEDHN
C[C@H](N[C@@H](CCC#N)c1ccccc1)c1cccc(-n2cnnn2)c1	ZINC000611337084	460339631	/nfs/dbraw/zinc/33/96/31/460339631.db2.gz	VJPLRMGTZZDAFX-KXBFYZLASA-N	0	3	332.411	3.358	20	30		EGEDHN
COc1ccc(OCCN[C@@H](C)c2cccc(C#N)c2)c([N+](=O)[O-])c1	ZINC000611387611	460351779	/nfs/dbraw/zinc/35/17/79/460351779.db2.gz	QMCRANRAQOJVBR-ZDUSSCGKSA-N	0	3	341.367	3.205	20	30		EGEDHN
CN(Cc1ccccc1)C(=O)CN[C@H]1CCCc2cc(C#N)ccc21	ZINC000611391162	460353196	/nfs/dbraw/zinc/35/31/96/460353196.db2.gz	XPXIZKJHTHYZGX-FQEVSTJZSA-N	0	3	333.435	3.184	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N(C)CC(O)(CC)CC	ZINC000626110770	460375080	/nfs/dbraw/zinc/37/50/80/460375080.db2.gz	QSJTZIYBYGOGHX-HNNXBMFYSA-N	0	3	338.517	3.134	20	30		EGEDHN
CCC(O)(CC)CN(C)Cc1cn(CCC#N)nc1-c1ccccc1	ZINC000600214644	460445091	/nfs/dbraw/zinc/44/50/91/460445091.db2.gz	CVCMOSVUUYLYJM-UHFFFAOYSA-N	0	3	340.471	3.447	20	30		EGEDHN
CCO[C@@H]1C[C@H](N[C@@H]2CCCc3cc(C#N)ccc32)[C@@]12CCCO2	ZINC000612829037	460744803	/nfs/dbraw/zinc/74/48/03/460744803.db2.gz	HAVZQHVTPLMTLK-WCIQWLHISA-N	0	3	326.440	3.252	20	30		EGEDHN
CC[C@@H](CC#N)NC(=O)c1ccccc1OCCN1CCCC[C@H]1C	ZINC000613037137	460809242	/nfs/dbraw/zinc/80/92/42/460809242.db2.gz	HXTHMDAPXDOVJJ-SJORKVTESA-N	0	3	343.471	3.362	20	30		EGEDHN
CN(C)CCN(Cc1ccco1)c1nc(C(C)(C)C)ccc1C#N	ZINC000613429841	460944356	/nfs/dbraw/zinc/94/43/56/460944356.db2.gz	UGJXWHVUKIRCMD-UHFFFAOYSA-N	0	3	326.444	3.412	20	30		EGEDHN
C=CCN(Cc1cc(Br)ccc1F)C(=O)[C@@H](C)NCC	ZINC000637968388	461161190	/nfs/dbraw/zinc/16/11/90/461161190.db2.gz	BLJWUVBOZARQFK-LLVKDONJSA-N	0	3	343.240	3.101	20	30		EGEDHN
C=CCN(Cc1ccccc1F)C(=O)c1cc2c(s1)CCNC2	ZINC000662400162	461232339	/nfs/dbraw/zinc/23/23/39/461232339.db2.gz	LCDCKXGCEDGOPD-UHFFFAOYSA-N	0	3	330.428	3.361	20	30		EGEDHN
CC#CC[C@H](CO)NCc1ccc(Br)cc1SC	ZINC000641767067	461362396	/nfs/dbraw/zinc/36/23/96/461362396.db2.gz	GLTXOZJDLCLOIG-CYBMUJFWSA-N	0	3	328.275	3.035	20	30		EGEDHN
C=CCCC(C)(C)NC(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000666148150	461473230	/nfs/dbraw/zinc/47/32/30/461473230.db2.gz	WMVXIPLCMDAHFI-UHFFFAOYSA-N	0	3	344.503	3.338	20	30		EGEDHN
C=CCc1ccc(OC[C@@H](O)CN2CCC(C3CC3)CC2)c(OC)c1	ZINC000644719047	462050710	/nfs/dbraw/zinc/05/07/10/462050710.db2.gz	PQSUDGWDADDGPH-IBGZPJMESA-N	0	3	345.483	3.285	20	30		EGEDHN
C=CCN(Cc1ccccc1F)C(=O)Nc1cnc2c(c1)CNCC2	ZINC000667794108	462265055	/nfs/dbraw/zinc/26/50/55/462265055.db2.gz	YVIOBSRUMLCCNG-UHFFFAOYSA-N	0	3	340.402	3.087	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Nc1c(C)cnn1CC)C(C)C	ZINC000667821781	462278677	/nfs/dbraw/zinc/27/86/77/462278677.db2.gz	NSPIAVDRJFMXBJ-INIZCTEOSA-N	0	3	333.480	3.032	20	30		EGEDHN
C=CC(C)(C)CNC(=O)N1CC[C@@H](N(C)CCc2ccccc2)C1	ZINC000665023227	462286152	/nfs/dbraw/zinc/28/61/52/462286152.db2.gz	LVIQEBCYIFSFNZ-GOSISDBHSA-N	0	3	329.488	3.157	20	30		EGEDHN
C[C@H](NCc1ccccc1CN1CCOCC1)c1ccc(C#N)cc1	ZINC000173821874	533933897	/nfs/dbraw/zinc/93/38/97/533933897.db2.gz	YCJVJFJPAYXPGU-KRWDZBQOSA-N	0	3	335.451	3.241	20	30		EGEDHN
C[C@H](CN(C)CCC(=O)Nc1ccc(C#N)cc1)c1nccs1	ZINC000183974307	534020402	/nfs/dbraw/zinc/02/04/02/534020402.db2.gz	VVMKAWVRQUOTJZ-CYBMUJFWSA-N	0	3	328.441	3.079	20	30		EGEDHN
N#Cc1ccccc1NC(=O)CCN1CCC[C@H](Nc2ccccc2)C1	ZINC000155053337	534817077	/nfs/dbraw/zinc/81/70/77/534817077.db2.gz	YAMOKQRMZKQHTG-IBGZPJMESA-N	0	3	348.450	3.463	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCC2(c3ccc(Cl)cc3)CC2)CC1	ZINC000171733026	526432796	/nfs/dbraw/zinc/43/27/96/526432796.db2.gz	MLKHIEZCISBJEH-UHFFFAOYSA-N	0	3	347.890	3.321	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H]2CC(C)(C)c3ccccc32)CC1	ZINC000178247423	526436691	/nfs/dbraw/zinc/43/66/91/526436691.db2.gz	FAADUASMJQMZGR-GOSISDBHSA-N	0	3	327.472	3.359	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@@H](C)CSCc2ccccc2)CC1	ZINC000178525777	526442435	/nfs/dbraw/zinc/44/24/35/526442435.db2.gz	JBQQXFHUSWPWDZ-INIZCTEOSA-N	0	3	332.513	3.323	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2nnc(CCCCC)s2)CC1	ZINC000171737709	526442981	/nfs/dbraw/zinc/44/29/81/526442981.db2.gz	DOKBSVNDDMQGOX-UHFFFAOYSA-N	0	3	337.493	3.043	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCCc2cc3ccccc3o2)CC1	ZINC000154186547	526590968	/nfs/dbraw/zinc/59/09/68/526590968.db2.gz	TWGBPDFDECAILB-UHFFFAOYSA-N	0	3	341.455	3.315	20	30		EGEDHN
C#CCCCCNC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000155038113	526695804	/nfs/dbraw/zinc/69/58/04/526695804.db2.gz	YPMVLZFZLDSJRD-AZUAARDMSA-N	0	3	341.499	3.484	20	30		EGEDHN
CC1(O)CCN(Cc2cccc(OCc3cccc(C#N)c3)c2)CC1	ZINC000179726136	528043313	/nfs/dbraw/zinc/04/33/13/528043313.db2.gz	BYTWKVYCXNSXIN-UHFFFAOYSA-N	0	3	336.435	3.484	20	30		EGEDHN
COc1cc(C(=O)C(C#N)c2nnc3n2CCCCC3)ccc1Cl	ZINC000137090672	546843474	/nfs/dbraw/zinc/84/34/74/546843474.db2.gz	DQBHMHCCLINJRC-GFCCVEGCSA-N	0	3	344.802	3.157	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cccc(CC#N)c1)C(C)C	ZINC000171980459	546996393	/nfs/dbraw/zinc/99/63/93/546996393.db2.gz	KKEHKMYVHKYDEJ-LJQANCHMSA-N	0	3	325.456	3.181	20	30		EGEDHN
O=C(N[C@H]1CCCN(C2CCCCC2)C1=O)C1CCN(C2CC2)CC1	ZINC000328708185	547483755	/nfs/dbraw/zinc/48/37/55/547483755.db2.gz	BARCFTTUTQMCFR-SFHVURJKSA-N	0	3	347.503	3.141	20	30		EGEDHN
CCN(CC#Cc1ccc(OC(F)(F)F)cc1)C[C@H]1CCOC1	ZINC000676557164	549109382	/nfs/dbraw/zinc/10/93/82/549109382.db2.gz	KQUHVLZKVGRQLT-OAHLLOKOSA-N	0	3	327.346	3.295	20	30		EGEDHN
COCC#CCN[C@@H](c1cc(F)cc(Br)c1)C1CC1	ZINC000681479448	550001864	/nfs/dbraw/zinc/00/18/64/550001864.db2.gz	RZMGRLHFETXMOG-OAHLLOKOSA-N	0	3	326.209	3.279	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1coc(C2CCC2)n1)C(C)C	ZINC000683483921	550234032	/nfs/dbraw/zinc/23/40/32/550234032.db2.gz	IHNMMICWCGAHTC-QGZVFWFLSA-N	0	3	331.460	3.371	20	30		EGEDHN
CCC#C[C@H](C)N1CC=C(CCN2C(=O)c3ccccc3C2=O)CC1	ZINC000684621441	550349863	/nfs/dbraw/zinc/34/98/63/550349863.db2.gz	PLUJIPNKERXTGV-INIZCTEOSA-N	0	3	336.435	3.107	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)cn1	ZINC000728862302	574779953	/nfs/dbraw/zinc/77/99/53/574779953.db2.gz	ZUAYLPMHXOOKPB-OAQYLSRUSA-N	0	3	347.462	3.266	20	30		EGEDHN
COc1ccc(O)c(/C=N/CCc2ccc(OCCN(C)C)cc2)c1	ZINC000729150284	574818957	/nfs/dbraw/zinc/81/89/57/574818957.db2.gz	UJDIHUNWPRUWFC-RCCKNPSSSA-N	0	3	342.439	3.003	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2nc(-c3cccs3)oc2C)CC1	ZINC000729976184	574900444	/nfs/dbraw/zinc/90/04/44/574900444.db2.gz	WPQFOLPREGPIDI-UHFFFAOYSA-N	0	3	345.468	3.482	20	30		EGEDHN
CNC(=O)c1ccc(CN(Cc2ccc(OCC#N)cc2)C2CC2)cc1	ZINC000731210599	575060283	/nfs/dbraw/zinc/06/02/83/575060283.db2.gz	UNQOLODIXZQBMC-UHFFFAOYSA-N	0	3	349.434	3.113	20	30		EGEDHN
CC(C)Oc1ccc(NC(=S)NN=C2CCN(C)[C@H](C)C2)cc1	ZINC000741463367	575073028	/nfs/dbraw/zinc/07/30/28/575073028.db2.gz	FIYDERMBYRTHHR-CYBMUJFWSA-N	0	3	334.489	3.230	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CCN1Cc1ccc(OCC#N)cc1	ZINC000732213783	575245842	/nfs/dbraw/zinc/24/58/42/575245842.db2.gz	HLAWICGTIVQOHX-GOSISDBHSA-N	0	3	335.451	3.295	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cc(F)ccc1[N+](=O)[O-])C(C)C	ZINC000733161173	575312405	/nfs/dbraw/zinc/31/24/05/575312405.db2.gz	MDDMGODWHVNYIZ-QGZVFWFLSA-N	0	3	349.406	3.162	20	30		EGEDHN
C[C@H](CCO)SCC(=O)C(C#N)c1nc(-c2ccccc2)cs1	ZINC000741733785	575331149	/nfs/dbraw/zinc/33/11/49/575331149.db2.gz	WXAKUVDBTZZSNN-TZMCWYRMSA-N	0	3	346.477	3.490	20	30		EGEDHN
C#CCCN1CCC(NC(=O)CCCCOc2cccc(C)c2)CC1	ZINC000740738338	576622037	/nfs/dbraw/zinc/62/20/37/576622037.db2.gz	AENJLILCYPBHIU-UHFFFAOYSA-N	0	3	342.483	3.148	20	30		EGEDHN
C#CCCN1CCC(NC(=O)CCOc2ccc(C(C)C)cc2)CC1	ZINC000740737909	576622090	/nfs/dbraw/zinc/62/20/90/576622090.db2.gz	MWVIKGFBFSBNTK-UHFFFAOYSA-N	0	3	342.483	3.183	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cc1	ZINC000741551081	576700172	/nfs/dbraw/zinc/70/01/72/576700172.db2.gz	SPQANFZUSCZVNW-PXNSSMCTSA-N	0	3	348.446	3.264	20	30		EGEDHN
C[C@@H]1CCCN(Cc2cc(=O)n3c4ccccc4[nH]c3c2C#N)[C@H]1C	ZINC000741790095	576721911	/nfs/dbraw/zinc/72/19/11/576721911.db2.gz	BFNMHFNSWOOBDO-YCPHGPKFSA-N	0	3	334.423	3.344	20	30		EGEDHN
CN(CC(=O)C(C#N)c1nc2ccccc2s1)c1cccc(O)c1	ZINC000741793116	576722540	/nfs/dbraw/zinc/72/25/40/576722540.db2.gz	YNLFAXSGXNHJNP-CQSZACIVSA-N	0	3	337.404	3.315	20	30		EGEDHN
C#CCOc1ccc(C(=O)N(C)Cc2ccc(CN(C)C)cc2)cc1	ZINC000743331518	576805873	/nfs/dbraw/zinc/80/58/73/576805873.db2.gz	RAUXUDPYZRMIGI-UHFFFAOYSA-N	0	3	336.435	3.032	20	30		EGEDHN
COc1cccc(NN=C(C)c2cccc(OCCN(C)C)c2)c1	ZINC000743531459	576811265	/nfs/dbraw/zinc/81/12/65/576811265.db2.gz	YBOYZRXXCHHHDH-UHFFFAOYSA-N	0	3	327.428	3.472	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)[C@@H](C)c1ccc(C)o1	ZINC000744031736	576819319	/nfs/dbraw/zinc/81/93/19/576819319.db2.gz	BTFVRNSCWGQQNF-STQMWFEESA-N	0	3	326.352	3.048	20	30		EGEDHN
C=CCN(Cc1cccc(C#N)c1)C(=O)NC[C@@H](C)N1CCCCC1	ZINC000745277256	576844933	/nfs/dbraw/zinc/84/49/33/576844933.db2.gz	LPRURBOJGBKMIJ-QGZVFWFLSA-N	0	3	340.471	3.130	20	30		EGEDHN
Cc1cc(F)c(Br)cc1NC(=O)[C@H](N)CCCCC#N	ZINC000691554109	1298133355	/nfs/dbraw/zinc/13/33/55/1298133355.db2.gz	MEJJPXMFQCNSHK-GFCCVEGCSA-N	0	3	342.212	3.246	20	30		EGEDHN
CCN(C(=O)C#Cc1cccs1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000829297965	1292559260	/nfs/dbraw/zinc/55/92/60/1292559260.db2.gz	LGTFKCYSLVHZSR-SFHVURJKSA-N	0	3	338.476	3.223	20	30		EGEDHN
CC(=O)N[C@H](C(=O)C(C#N)c1nc(C(C)C)cs1)C1CCCC1	ZINC000080456651	1292604107	/nfs/dbraw/zinc/60/41/07/1292604107.db2.gz	AZCYDKUIGXNQPD-HIFRSBDPSA-N	0	3	333.457	3.138	20	30		EGEDHN
Cc1cc(C#N)ccc1CN[C@@H](C)c1ccc(N2CCNC2=O)cc1	ZINC000829750787	1292614045	/nfs/dbraw/zinc/61/40/45/1292614045.db2.gz	DJHKYXBRGXERBQ-HNNXBMFYSA-N	0	3	334.423	3.247	20	30		EGEDHN
CCCC(=O)NC[C@@H]1CCCN(Cc2ccc(O[C@@H](C)C#N)cc2)C1	ZINC000092707636	1292884898	/nfs/dbraw/zinc/88/48/98/1292884898.db2.gz	QVHWOSDGPHQIBL-WMZOPIPTSA-N	0	3	343.471	3.106	20	30		EGEDHN
COc1cc(Cl)c(C)cc1NC(=O)C(C#N)C(=O)[C@@H](C)SC	ZINC000103330093	1293002524	/nfs/dbraw/zinc/00/25/24/1293002524.db2.gz	PXOVDBUITBSDCY-NXEZZACHSA-N	0	3	340.832	3.056	20	30		EGEDHN
CC[C@@H](CC(F)(F)F)C(=O)C(C#N)C(=O)NCc1cccc(C)c1	ZINC000835340521	1293268355	/nfs/dbraw/zinc/26/83/55/1293268355.db2.gz	NGHCSGIHYKTJLL-UONOGXRCSA-N	0	3	340.345	3.299	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)COCC1CCCC1)c1ccccc1	ZINC000835340979	1293268727	/nfs/dbraw/zinc/26/87/27/1293268727.db2.gz	QUZPYNFYYVHQIJ-MSOLQXFVSA-N	0	3	342.439	3.170	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)Cc2c(F)cccc2F)cc1	ZINC000120026835	1293298928	/nfs/dbraw/zinc/29/89/28/1293298928.db2.gz	SHUQAXLIMHUOPK-HNNXBMFYSA-N	0	3	342.345	3.417	20	30		EGEDHN
COCCCNC(=O)C(C#N)C(=O)C[C@H](C)c1ccc(C(C)C)cc1	ZINC000121595740	1293380542	/nfs/dbraw/zinc/38/05/42/1293380542.db2.gz	KSSSSDPOEOGIRG-YJBOKZPZSA-N	0	3	344.455	3.165	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(Cl)cc1Cl)C(=O)[C@H]1CCCCO1	ZINC000121989332	1293397786	/nfs/dbraw/zinc/39/77/86/1293397786.db2.gz	UGLQUERERDFKRE-GXFFZTMASA-N	0	3	341.194	3.210	20	30		EGEDHN
C[C@H](Oc1cccc(C(C)(C)C)c1)C(=O)C(C#N)C(=O)N1CCCC1	ZINC000124839537	1293486889	/nfs/dbraw/zinc/48/68/89/1293486889.db2.gz	XMIULMXVPUWOLY-YOEHRIQHSA-N	0	3	342.439	3.083	20	30		EGEDHN
Cc1cc2occ(CC(=O)C(C#N)C(=O)Nc3ccccn3)c2cc1C	ZINC000125121055	1293496593	/nfs/dbraw/zinc/49/65/93/1293496593.db2.gz	NOSSNIVBNYUMLW-MRXNPFEDSA-N	0	3	347.374	3.335	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H](NC2CC(C#N)(c3ccccc3)C2)C1	ZINC000126890088	1293547069	/nfs/dbraw/zinc/54/70/69/1293547069.db2.gz	IGQXTBMOBRIRIA-ZRZPHAQCSA-N	0	3	341.455	3.209	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)CCCc2cccs2)c1	ZINC000127047131	1293551634	/nfs/dbraw/zinc/55/16/34/1293551634.db2.gz	UDKYYZLJMPQXHD-MRXNPFEDSA-N	0	3	342.420	3.427	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)c1cc(C)oc1C	ZINC000128919752	1293608736	/nfs/dbraw/zinc/60/87/36/1293608736.db2.gz	LXRYRGXJMAXJLC-CQSZACIVSA-N	0	3	326.352	3.256	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN1CCC[C@H]1C[C@H](O)c1ccc(F)cc1	ZINC000134797353	1293781347	/nfs/dbraw/zinc/78/13/47/1293781347.db2.gz	NNGRBEFWNVIYAL-OALUTQOASA-N	0	3	348.462	3.138	20	30		EGEDHN
CC(C)Oc1ccccc1CC(=O)C(C#N)C(=O)NC1CCCCC1	ZINC000155465357	1294099921	/nfs/dbraw/zinc/09/99/21/1294099921.db2.gz	LRPYBINAGFPSHQ-KRWDZBQOSA-N	0	3	342.439	3.174	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)C[C@@H](C)c1cccc(OC)c1	ZINC000175940321	1294580979	/nfs/dbraw/zinc/58/09/79/1294580979.db2.gz	BDIHWGDPFZOLBK-PBHICJAKSA-N	0	3	330.428	3.204	20	30		EGEDHN
N#CC(C(=O)CC[C@H]1CCOC1)C(=O)Nc1cccc2ccccc21	ZINC000176092499	1294590701	/nfs/dbraw/zinc/59/07/01/1294590701.db2.gz	KALBUSSCGOSTFT-YOEHRIQHSA-N	0	3	336.391	3.304	20	30		EGEDHN
Cc1ncc(CNCc2ccc(OCC#N)cc2)n1-c1ccccc1	ZINC000176760139	1294629519	/nfs/dbraw/zinc/62/95/19/1294629519.db2.gz	OGKIZVQVRVMULC-UHFFFAOYSA-N	0	3	332.407	3.373	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)C[C@@H](C)C(=O)c1cccc(F)c1	ZINC000177594918	1294679406	/nfs/dbraw/zinc/67/94/06/1294679406.db2.gz	XXQLPRVCPLMYKK-CZUORRHYSA-N	0	3	346.402	3.050	20	30		EGEDHN
C[C@@H](NCc1cc(C#N)cs1)c1ccc(N2CCOC2=O)cc1	ZINC000177691158	1294686695	/nfs/dbraw/zinc/68/66/95/1294686695.db2.gz	ZUGSBOJGJYOMMN-GFCCVEGCSA-N	0	3	327.409	3.427	20	30		EGEDHN
C#CCCCCC(=O)Nc1cccc(CN2CCC(CO)CC2)c1	ZINC000180354543	1294881864	/nfs/dbraw/zinc/88/18/64/1294881864.db2.gz	MQNUFDWTSZNJSZ-UHFFFAOYSA-N	0	3	328.456	3.023	20	30		EGEDHN
CC(C)CN(CCN(C)C)C(=O)Nc1ccccc1O[C@@H](C)C#N	ZINC000184347489	1295191188	/nfs/dbraw/zinc/19/11/88/1295191188.db2.gz	JFSCCAUKFBZNFP-HNNXBMFYSA-N	0	3	332.448	3.029	20	30		EGEDHN
N#CC(C(=O)Cc1c(F)cccc1Cl)C(=O)NCc1ccccc1	ZINC000193406007	1295864875	/nfs/dbraw/zinc/86/48/75/1295864875.db2.gz	GRIHKPPRPPABNE-AWEZNQCLSA-N	0	3	344.773	3.047	20	30		EGEDHN
Cc1cc(C)c(OCC(=O)C(C#N)C(=O)Nc2ccccc2)c(C)c1	ZINC000193441469	1295869317	/nfs/dbraw/zinc/86/93/17/1295869317.db2.gz	HHZSEHGZMKNSCB-QGZVFWFLSA-N	0	3	336.391	3.338	20	30		EGEDHN
CCCC(=O)NC[C@@H]1CCCN(Cc2ccc(O[C@H](C)C#N)cc2)C1	ZINC000245564729	1296314889	/nfs/dbraw/zinc/31/48/89/1296314889.db2.gz	QVHWOSDGPHQIBL-AEFFLSMTSA-N	0	3	343.471	3.106	20	30		EGEDHN
CC[C@@H](Cc1cccc(C)c1)C(=O)C(C#N)C(=O)NC1CCCC1	ZINC000873498931	1297544307	/nfs/dbraw/zinc/54/43/07/1297544307.db2.gz	UUULPQWFRHBMJN-FUHWJXTLSA-N	0	3	326.440	3.331	20	30		EGEDHN
CC1CC(C#N)(C(=O)N(C)C[C@H]2CCCCN2Cc2ccccc2)C1	ZINC000719958763	1298324570	/nfs/dbraw/zinc/32/45/70/1298324570.db2.gz	CKPGWQFOKZFMHY-MOMVYJMYSA-N	0	3	339.483	3.439	20	30		EGEDHN
CN(C)[C@H](C/N=C/c1ccc(O)c(O)c1O)c1ccc(Cl)cc1	ZINC000746815354	1298664151	/nfs/dbraw/zinc/66/41/51/1298664151.db2.gz	HRLGXEJHVZJFSK-MRGVZLDZSA-N	0	3	334.803	3.179	20	30		EGEDHN
C=C(Cl)C[C@H](N)C(=O)NCc1cn(-c2ccccc2)nc1C(C)C	ZINC000876684660	1298917989	/nfs/dbraw/zinc/91/79/89/1298917989.db2.gz	QGHCTEGVSNHZTF-INIZCTEOSA-N	0	3	346.862	3.082	20	30		EGEDHN
N#Cc1ccc(C(=O)C(C#N)c2nc3ccccc3n2C(F)F)[nH]1	ZINC000752475961	1299743802	/nfs/dbraw/zinc/74/38/02/1299743802.db2.gz	HPHZDHZHWRNBGC-JTQLQIEISA-N	0	3	325.278	3.121	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC000878334748	1299923785	/nfs/dbraw/zinc/92/37/85/1299923785.db2.gz	FFWLNMWLYWYTOY-UHFFFAOYSA-N	0	3	330.472	3.378	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)c1cc(Cl)cs1	ZINC000758343104	1300856284	/nfs/dbraw/zinc/85/62/84/1300856284.db2.gz	OUABHEKDNXSGOZ-UHFFFAOYSA-N	0	3	347.871	3.477	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CN2C[C@@H]3CC[C@H]2c2ccccc23)cc1	ZINC000880540420	1301153985	/nfs/dbraw/zinc/15/39/85/1301153985.db2.gz	ZRVWVQLIRRRSLL-FIKGOQFSSA-N	0	3	334.419	3.232	20	30		EGEDHN
CCN(C(=O)C#Cc1ccccc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000760655267	1301314664	/nfs/dbraw/zinc/31/46/64/1301314664.db2.gz	QTVWBKKVPFUPEE-NRFANRHFSA-N	0	3	332.447	3.161	20	30		EGEDHN
C=C(C)CN1CCC(N2C(=O)CN([C@@H](C)c3ccccc3)C2=O)CC1	ZINC000761257431	1301429028	/nfs/dbraw/zinc/42/90/28/1301429028.db2.gz	RDGVPCMBHMBOIX-INIZCTEOSA-N	0	3	341.455	3.052	20	30		EGEDHN
COc1ccc(C(C)N=Nc2cnn(C)c2)cc1CN1CCCCC1	ZINC000761868004	1301558901	/nfs/dbraw/zinc/55/89/01/1301558901.db2.gz	YFBUMTGTNSIJGE-UHFFFAOYSA-N	0	3	341.459	3.251	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)CSCC(F)(F)F)nc21	ZINC000762063640	1301605421	/nfs/dbraw/zinc/60/54/21/1301605421.db2.gz	JMEQUHZJTFIZQP-SECBINFHSA-N	0	3	327.331	3.343	20	30		EGEDHN
Cc1cccc2nc(C(C#N)C(=O)CSCC(F)(F)F)[nH]c21	ZINC000762063640	1301605433	/nfs/dbraw/zinc/60/54/33/1301605433.db2.gz	JMEQUHZJTFIZQP-SECBINFHSA-N	0	3	327.331	3.343	20	30		EGEDHN
C#CCOc1ccc(C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000762369362	1301664804	/nfs/dbraw/zinc/66/48/04/1301664804.db2.gz	GQFFDYUNYQESDQ-FQEVSTJZSA-N	0	3	348.446	3.045	20	30		EGEDHN
CN(CC(=O)/C=C1\N(C)c2ccccc2C1(C)C)CC1CCOCC1	ZINC000767695129	1302747309	/nfs/dbraw/zinc/74/73/09/1302747309.db2.gz	AZMRVCKGCDSDSW-MOSHPQCFSA-N	0	3	342.483	3.225	20	30		EGEDHN
Cc1cccc([C@H](NC(=O)C2CC3(C2)CNC[C@@H]3C#N)C(C)(C)C)c1	ZINC000884159691	1302758795	/nfs/dbraw/zinc/75/87/95/1302758795.db2.gz	KLWRLUQBPPSMIJ-KQNFGGRRSA-N	0	3	339.483	3.338	20	30		EGEDHN
C#CCOc1ccc(CN(C)[C@@H](C)CNC(=O)OC(C)(C)C)cc1	ZINC000769402210	1303107445	/nfs/dbraw/zinc/10/74/45/1303107445.db2.gz	WXKCRILJGAINEN-HNNXBMFYSA-N	0	3	332.444	3.044	20	30		EGEDHN
C#CCOc1ccc(CNc2ccc(CN3CCN(C)CC3)cc2)cc1	ZINC000770487098	1303275159	/nfs/dbraw/zinc/27/51/59/1303275159.db2.gz	FMSUZYRTMOVQTL-UHFFFAOYSA-N	0	3	349.478	3.058	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(OC)c3cccnc23)CC1	ZINC000771283205	1303385589	/nfs/dbraw/zinc/38/55/89/1303385589.db2.gz	WGQCDYNEONUIKE-UHFFFAOYSA-N	0	3	340.427	3.015	20	30		EGEDHN
CCCN(Cc1ccccc1O)[C@@H]1CCN(c2ccc(C#N)cc2)C1=O	ZINC000772797147	1303577961	/nfs/dbraw/zinc/57/79/61/1303577961.db2.gz	DGQLHIUZNCAUQW-LJQANCHMSA-N	0	3	349.434	3.281	20	30		EGEDHN
CCC[N@H+](Cc1ccccc1[O-])[C@@H]1CCN(c2ccc(C#N)cc2)C1=O	ZINC000772797147	1303577965	/nfs/dbraw/zinc/57/79/65/1303577965.db2.gz	DGQLHIUZNCAUQW-LJQANCHMSA-N	0	3	349.434	3.281	20	30		EGEDHN
CCC[N@@H+](Cc1ccccc1[O-])[C@@H]1CCN(c2ccc(C#N)cc2)C1=O	ZINC000772797147	1303577968	/nfs/dbraw/zinc/57/79/68/1303577968.db2.gz	DGQLHIUZNCAUQW-LJQANCHMSA-N	0	3	349.434	3.281	20	30		EGEDHN
C#CC[C@@H](N[C@@H](C)c1cccc(NS(C)(=O)=O)c1)c1ccccc1	ZINC000773117747	1303628367	/nfs/dbraw/zinc/62/83/67/1303628367.db2.gz	VZPAMPWXCFALSP-HNAYVOBHSA-N	0	3	342.464	3.473	20	30		EGEDHN
C#CC[C@H](NC[C@H](O)COc1ccccc1Cl)c1ccccc1	ZINC000775401142	1303957316	/nfs/dbraw/zinc/95/73/16/1303957316.db2.gz	RAPMZAUHJWFQDI-WMZOPIPTSA-N	0	3	329.827	3.434	20	30		EGEDHN
Cc1ccc2c(c1)[C@H]1CN(C)CC[C@@H]1N2C(=O)c1cc(C#N)ccc1F	ZINC000887857976	1303959185	/nfs/dbraw/zinc/95/91/85/1303959185.db2.gz	XIAKDSVBCHCTNL-XLIONFOSSA-N	0	3	349.409	3.454	20	30		EGEDHN
N#CCC[C@@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1	ZINC000775553381	1303983328	/nfs/dbraw/zinc/98/33/28/1303983328.db2.gz	NQLHVEQMHWDZMU-QZTJIDSGSA-N	0	3	325.368	3.263	20	30		EGEDHN
N#Cc1ccc(F)c(NC(=O)N2CCN(C3CCCCC3)CC2)c1	ZINC000888362418	1304132526	/nfs/dbraw/zinc/13/25/26/1304132526.db2.gz	WKLNMUYHVNCUQJ-UHFFFAOYSA-N	0	3	330.407	3.180	20	30		EGEDHN
C#CCN(C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCc2ccccc21	ZINC000776580087	1304173617	/nfs/dbraw/zinc/17/36/17/1304173617.db2.gz	QZYWNPCQTJIRGL-PMACEKPBSA-N	0	3	336.391	3.251	20	30		EGEDHN
N#Cc1ccc(CN2CCN(C[C@@H]3CCc4ccccc43)CC2)cc1	ZINC000780287579	1304671437	/nfs/dbraw/zinc/67/14/37/1304671437.db2.gz	MVGSBINPLFYCGG-NRFANRHFSA-N	0	3	331.463	3.406	20	30		EGEDHN
Fc1ccc(CON=C2CCN3CCC[C@H]23)c(Br)c1	ZINC000780288505	1304673368	/nfs/dbraw/zinc/67/33/68/1304673368.db2.gz	VXVIEFSXHWUUNS-CQSZACIVSA-N	0	3	327.197	3.329	20	30		EGEDHN
C=CCN1CCC(NC(=S)NCCCCCCSC)CC1	ZINC000782204034	1304930962	/nfs/dbraw/zinc/93/09/62/1304930962.db2.gz	XLDOVOQEMBSHFQ-UHFFFAOYSA-N	0	3	329.579	3.024	20	30		EGEDHN
C=CCCN(OCc1ccccc1)C(=O)N[C@@H](C)C1=CCN(C)CC1	ZINC000782998336	1305034404	/nfs/dbraw/zinc/03/44/04/1305034404.db2.gz	SMDVMTFJDSXMNN-KRWDZBQOSA-N	0	3	343.471	3.356	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)[C@@H]1CCCCS1	ZINC000783352973	1305083000	/nfs/dbraw/zinc/08/30/00/1305083000.db2.gz	NZKOUKZJOOMTQA-DOMZBBRYSA-N	0	3	332.425	3.018	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)C(=O)Nc1ccccn1)c1c[nH]c2ccccc21	ZINC000786329052	1305557919	/nfs/dbraw/zinc/55/79/19/1305557919.db2.gz	KSYJWAQQNYLACY-ZFWWWQNUSA-N	0	3	346.390	3.404	20	30		EGEDHN
CC(C)(C#N)CC(=O)O[C@H]1CCN(Cc2ccc3c(c2)CCC3)C1	ZINC000786477853	1305582351	/nfs/dbraw/zinc/58/23/51/1305582351.db2.gz	JNMXHOKGCBNWKF-SFHVURJKSA-N	0	3	326.440	3.233	20	30		EGEDHN
CC[C@@H](NC(=O)C(C#N)C(=O)C1CCSCC1)c1ccccc1	ZINC000787045124	1305682705	/nfs/dbraw/zinc/68/27/05/1305682705.db2.gz	HXGPSQMVARQEPO-JKSUJKDBSA-N	0	3	330.453	3.106	20	30		EGEDHN
C#C[C@H](CCC)NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C	ZINC000791068736	1308919957	/nfs/dbraw/zinc/91/99/57/1308919957.db2.gz	BPVTVVPGQRGITH-PKOBYXMFSA-N	0	3	327.472	3.094	20	30		EGEDHN
N#Cc1c2[nH]c3ccccc3n2c(=O)cc1CN1CCC(C2CC2)CC1	ZINC000794893951	1309616903	/nfs/dbraw/zinc/61/69/03/1309616903.db2.gz	SJPBQTMVPFPDDT-QGZVFWFLSA-N	0	3	346.434	3.346	20	30		EGEDHN
COCCOC1CCC(C(=O)C(C#N)c2nc3ccccc3o2)CC1	ZINC000796654873	1310057869	/nfs/dbraw/zinc/05/78/69/1310057869.db2.gz	PYABYWGOSPLYNI-YMAMQOFZSA-N	0	3	342.395	3.226	20	30		EGEDHN
C=C(Br)CN[C@H](C)Cc1ccc(OC)c(OC)c1C	ZINC000796741076	1310077330	/nfs/dbraw/zinc/07/73/30/1310077330.db2.gz	ARGZPHVTEUCIPF-LLVKDONJSA-N	0	3	328.250	3.441	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(Cl)cc1)C(=O)c1occ2c1CCC2	ZINC000796781377	1310086951	/nfs/dbraw/zinc/08/69/51/1310086951.db2.gz	XYXXPBINAIYZGU-AWEZNQCLSA-N	0	3	328.755	3.383	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)[C@H]1CCC(F)(F)C1)c1ccccc1	ZINC000796894865	1310106290	/nfs/dbraw/zinc/10/62/90/1310106290.db2.gz	ZMJHAEZPVROUMZ-KKUMJFAQSA-N	0	3	334.366	3.398	20	30		EGEDHN
C[C@@H](NC(=O)C(C)(C)C)C(=O)C(C#N)c1ncc(C(C)(C)C)s1	ZINC000797571480	1310213747	/nfs/dbraw/zinc/21/37/47/1310213747.db2.gz	RZLGPEWVIXJUHT-GHMZBOCLSA-N	0	3	335.473	3.168	20	30		EGEDHN
C#Cc1ccc(C(=O)N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)cc1	ZINC000898012189	1310550261	/nfs/dbraw/zinc/55/02/61/1310550261.db2.gz	QJBJQTVZAUQENS-LEWJYISDSA-N	0	3	330.431	3.014	20	30		EGEDHN
CC[C@H](C)N[C@H](CNC(=O)c1cc(C#N)ccc1C)c1ccco1	ZINC000899078623	1310928630	/nfs/dbraw/zinc/92/86/30/1310928630.db2.gz	IQDPKIZTVFIFBF-WMLDXEAASA-N	0	3	325.412	3.319	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)C#CC1CC1	ZINC000837372610	1320606501	/nfs/dbraw/zinc/60/65/01/1320606501.db2.gz	PCZDTNOIBHKDFY-UHFFFAOYSA-N	0	3	338.373	3.009	20	30		EGEDHN
CC(C)N1CCC[C@@H]1C(=O)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000929691577	1328669217	/nfs/dbraw/zinc/66/92/17/1328669217.db2.gz	CNDGLUSGWKOQIA-MRXNPFEDSA-N	0	3	338.373	3.046	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@H](NCc2ccc(C#N)s2)C1)c1ccsc1	ZINC001019371860	1317199233	/nfs/dbraw/zinc/19/92/33/1317199233.db2.gz	OGYGWWWPWNMNAP-JSGCOSHPSA-N	0	3	345.493	3.175	20	30		EGEDHN
CCN1CC[C@H](N(C)C(=O)/C=C\C(=O)c2ccc(C)cc2)C[C@H]1C	ZINC000900803596	1317343185	/nfs/dbraw/zinc/34/31/85/1317343185.db2.gz	ZVDSYHCUJFQKHV-PJDFAFLYSA-N	0	3	328.456	3.065	20	30		EGEDHN
C=C[C@H](C(=O)N1CC[C@H](NCc2cc(C)ns2)C1)c1ccccc1	ZINC001019805205	1317433128	/nfs/dbraw/zinc/43/31/28/1317433128.db2.gz	WMUVYEDHNKKFAU-WMZOPIPTSA-N	0	3	341.480	3.112	20	30		EGEDHN
C#CCOc1ccccc1CN[C@H](C)c1cccc(-n2ccnn2)c1	ZINC000806146564	1317465532	/nfs/dbraw/zinc/46/55/32/1317465532.db2.gz	PDFHRYYUTZTEOR-MRXNPFEDSA-N	0	3	332.407	3.130	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@H](NC(=O)CC3CCCCC3)C2)c(F)c1	ZINC001019975312	1317482235	/nfs/dbraw/zinc/48/22/35/1317482235.db2.gz	XAFIINIKYHAEBC-IYARVYRRSA-N	0	3	343.446	3.405	20	30		EGEDHN
C[C@H]1CCC[C@H]1CC(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001020186387	1317581847	/nfs/dbraw/zinc/58/18/47/1317581847.db2.gz	OPYRCVDDEAQRDA-IKICRFKJSA-N	0	3	343.446	3.260	20	30		EGEDHN
C#C[C@@H](NC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F)C(C)(C)C	ZINC000807879129	1317597880	/nfs/dbraw/zinc/59/78/80/1317597880.db2.gz	OJYVZSPEURQQFA-IAGOWNOFSA-N	0	3	348.437	3.308	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC(CN(CC)Cc2conc2C)CC1	ZINC000957737620	1317601097	/nfs/dbraw/zinc/60/10/97/1317601097.db2.gz	PWDAADOCTQIJAY-UHFFFAOYSA-N	0	3	333.476	3.256	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc(C3CCCCC3)n[nH]2)C1	ZINC001020247365	1317608750	/nfs/dbraw/zinc/60/87/50/1317608750.db2.gz	FECACMYIQORAHN-HDJSIYSDSA-N	0	3	336.867	3.060	20	30		EGEDHN
CC[C@H](NCC1(S(C)(=O)=O)CCCCC1)c1cccc(C#N)c1	ZINC000903051003	1317642746	/nfs/dbraw/zinc/64/27/46/1317642746.db2.gz	BQINRBGRKAIZAT-KRWDZBQOSA-N	0	3	334.485	3.346	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@H]2CCC[C@@H](C(F)(F)F)C2)C1	ZINC001020335995	1317652048	/nfs/dbraw/zinc/65/20/48/1317652048.db2.gz	PISKDCDCTFXZJP-RNJOBUHISA-N	0	3	338.801	3.344	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)Cc2ccc(CC(C)C)cc2)C1	ZINC001020365120	1317663108	/nfs/dbraw/zinc/66/31/08/1317663108.db2.gz	GWGNAFXJHWZJIL-IYARVYRRSA-N	0	3	334.891	3.417	20	30		EGEDHN
CC[C@@H]1CCC[C@H]1C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001020554095	1317767301	/nfs/dbraw/zinc/76/73/01/1317767301.db2.gz	KTTKABXABKQFDC-VDHUWJSZSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=Cc1ccc(C(=O)N[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)cc1	ZINC001020621433	1317806013	/nfs/dbraw/zinc/80/60/13/1317806013.db2.gz	YMQFKSIQXHWVBV-WGSAOQKQSA-N	0	3	349.409	3.391	20	30		EGEDHN
C#Cc1ccc(CN[C@H](Cc2ccccc2)C(=O)N(CC)CC)cc1	ZINC000809603210	1317840880	/nfs/dbraw/zinc/84/08/80/1317840880.db2.gz	LQZCSMWMTMQTTK-OAQYLSRUSA-N	0	3	334.463	3.237	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2scnc2C(C)(C)C)C1	ZINC001020703925	1317878455	/nfs/dbraw/zinc/87/84/55/1317878455.db2.gz	TVAWOTSESKRKQD-XYPYZODXSA-N	0	3	327.881	3.044	20	30		EGEDHN
COCCCN(Cc1ccncc1)Cc1ccc(O[C@@H](C)C#N)cc1	ZINC000809741229	1317886016	/nfs/dbraw/zinc/88/60/16/1317886016.db2.gz	QHJMPQCFDXUTPI-KRWDZBQOSA-N	0	3	339.439	3.411	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)Cc2ccccc2OC(C)C)C1	ZINC001020744110	1317901267	/nfs/dbraw/zinc/90/12/67/1317901267.db2.gz	QELJEPIGZZYBMT-WKILWMFISA-N	0	3	336.863	3.006	20	30		EGEDHN
Cc1cc(C(=O)N[C@H]2C[C@H](NCc3ccc(C#N)cc3F)C2)cs1	ZINC001020751332	1317904120	/nfs/dbraw/zinc/90/41/20/1317904120.db2.gz	JLZKMWBKVOVQAS-WKILWMFISA-N	0	3	343.427	3.118	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NC[C@@H](c1ccc(CC)cc1)N(C)C	ZINC000809948620	1317922761	/nfs/dbraw/zinc/92/27/61/1317922761.db2.gz	ZRQGOSOEKRHLMI-NRFANRHFSA-N	0	3	334.463	3.192	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)Cc1ccc(Cl)c(F)c1	ZINC000810528584	1318018622	/nfs/dbraw/zinc/01/86/22/1318018622.db2.gz	VGKDUUGMCRFDMR-ZDUSSCGKSA-N	0	3	338.810	3.427	20	30		EGEDHN
C=C1CC(C)(C(=O)NC2C[C@H]3CC[C@@H](C2)N3Cc2oc(C)nc2C)C1	ZINC001021373305	1318218290	/nfs/dbraw/zinc/21/82/90/1318218290.db2.gz	ITYVNRXKNCSTNK-ALOPSCKCSA-N	0	3	343.471	3.259	20	30		EGEDHN
O=C(C#CC1CC1)N1CCCC[C@H]1CNCc1cc(Cl)ccc1F	ZINC000960002608	1318307595	/nfs/dbraw/zinc/30/75/95/1318307595.db2.gz	FWVBOFWLLPXZBK-KRWDZBQOSA-N	0	3	348.849	3.363	20	30		EGEDHN
C[C@@H](NC[C@@H]1CCCCN1C(=O)C#CC1CC1)c1ccccc1F	ZINC000960009333	1318311610	/nfs/dbraw/zinc/31/16/10/1318311610.db2.gz	YTAJVOYYDQADMH-WBVHZDCISA-N	0	3	328.431	3.271	20	30		EGEDHN
C[C@H]1[C@H](NC(=O)c2ccsc2C#N)CCN1Cc1ccccc1	ZINC000908230727	1318315775	/nfs/dbraw/zinc/31/57/75/1318315775.db2.gz	SXXMNKCXNHUOQF-XJKSGUPXSA-N	0	3	325.437	3.013	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCCC[C@H]2CNCc2ncccc2C)cc1	ZINC000960080409	1318341757	/nfs/dbraw/zinc/34/17/57/1318341757.db2.gz	YCQDXJNWXYROTM-FQEVSTJZSA-N	0	3	347.462	3.156	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@H](CCCN3C(=O)c3ccoc3)C2)c1	ZINC001021519177	1318346587	/nfs/dbraw/zinc/34/65/87/1318346587.db2.gz	KTIIDLZUXXIKDA-UYAOXDASSA-N	0	3	349.434	3.278	20	30		EGEDHN
CC(C)[C@H](F)C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)s1	ZINC000960099400	1318355071	/nfs/dbraw/zinc/35/50/71/1318355071.db2.gz	HEJVJXDQEOBUPV-BBRMVZONSA-N	0	3	337.464	3.085	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)cc1F	ZINC000960144344	1318379023	/nfs/dbraw/zinc/37/90/23/1318379023.db2.gz	ROCZEXNBSVBEAP-BPQIPLTHSA-N	0	3	343.446	3.214	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@H](CCCN3C(=O)/C=C\C3CC3)C2)cc1	ZINC001021550565	1318389368	/nfs/dbraw/zinc/38/93/68/1318389368.db2.gz	IMHLAPLSDIFZKD-KNLQKXEQSA-N	0	3	349.478	3.337	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@H](CCCN3C(=O)C=C3CCC3)C2)cc1	ZINC001021558665	1318406275	/nfs/dbraw/zinc/40/62/75/1318406275.db2.gz	KZBFWRQOOHVALI-NHCUHLMSSA-N	0	3	349.478	3.481	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cccc(OCCC)c2)C1	ZINC001021590749	1318435624	/nfs/dbraw/zinc/43/56/24/1318435624.db2.gz	DVQYKUDXSLCASY-AZUAARDMSA-N	0	3	340.467	3.035	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cnc(C2CC2)o1	ZINC000960271609	1318437274	/nfs/dbraw/zinc/43/72/74/1318437274.db2.gz	QPCCYGJEFNPRPZ-SJLPKXTDSA-N	0	3	337.423	3.114	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cccc(F)c2C)C1	ZINC001021594210	1318437691	/nfs/dbraw/zinc/43/76/91/1318437691.db2.gz	KETRLVUUABWDBV-VQIMIIECSA-N	0	3	328.431	3.084	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc[nH]c1C1CC1	ZINC000960298915	1318450428	/nfs/dbraw/zinc/45/04/28/1318450428.db2.gz	GBYJFNIPGVLXTH-UYAOXDASSA-N	0	3	335.451	3.454	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2nc(C(C)(C)C)cs2)C1	ZINC001021606072	1318452594	/nfs/dbraw/zinc/45/25/94/1318452594.db2.gz	GPWYELWCBZZSTA-LSDHHAIUSA-N	0	3	345.512	3.000	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@@H](C)c1ccsc1	ZINC000960304849	1318453191	/nfs/dbraw/zinc/45/31/91/1318453191.db2.gz	AEFPDIGKJUOXRM-MORSLUCNSA-N	0	3	326.465	3.409	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)Cc1c[nH]c2ccccc12	ZINC000960325041	1318462756	/nfs/dbraw/zinc/46/27/56/1318462756.db2.gz	LSKQWYWHLLHKGO-IFMALSPDSA-N	0	3	345.446	3.268	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1sccc1OC	ZINC000960328392	1318463136	/nfs/dbraw/zinc/46/31/36/1318463136.db2.gz	XWMGBLWFQKWECU-NVXWUHKLSA-N	0	3	342.464	3.318	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1c(C)noc1CC	ZINC000960334694	1318467669	/nfs/dbraw/zinc/46/76/69/1318467669.db2.gz	MBXUHLFZJFJNBI-VQIMIIECSA-N	0	3	339.439	3.107	20	30		EGEDHN
CC(COC(=O)c1cccc(Nc2ccc(C#N)cc2)c1)[N+](=O)[O-]	ZINC000813106471	1318500111	/nfs/dbraw/zinc/50/01/11/1318500111.db2.gz	CNMDIOFIDVZNCZ-LBPRGKRZSA-N	0	3	325.324	3.124	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cccc3ncccc32)C1	ZINC001021644986	1318502394	/nfs/dbraw/zinc/50/23/94/1318502394.db2.gz	JUFBXNPAGPEALX-UTKZUKDTSA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc3cc(C)ccc3[nH]2)C1	ZINC001021647857	1318506384	/nfs/dbraw/zinc/50/63/84/1318506384.db2.gz	GYONPDGHYSVMDQ-UWJYYQICSA-N	0	3	349.478	3.426	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(F)c(C)c2)C1	ZINC001021655385	1318516544	/nfs/dbraw/zinc/51/65/44/1318516544.db2.gz	OHNRUCBLFRQIMV-MJGOQNOKSA-N	0	3	328.431	3.084	20	30		EGEDHN
Cc1occc1C(=O)N1CCC[C@H]1CN(C)Cc1cccc(C#N)c1	ZINC000960395198	1318521334	/nfs/dbraw/zinc/52/13/34/1318521334.db2.gz	BDQWKGIHMFGRQF-SFHVURJKSA-N	0	3	337.423	3.196	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(Cl)c(C)c2)C1	ZINC001021665468	1318528372	/nfs/dbraw/zinc/52/83/72/1318528372.db2.gz	KNXSXBYIVROTNT-WMZOPIPTSA-N	0	3	330.859	3.208	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc3occc3s2)C1	ZINC001021667058	1318529964	/nfs/dbraw/zinc/52/99/64/1318529964.db2.gz	FSUHUDUBSJQOQX-GJZGRUSLSA-N	0	3	342.464	3.444	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cccc3cc[nH]c32)C1	ZINC001021672352	1318536896	/nfs/dbraw/zinc/53/68/96/1318536896.db2.gz	BBBUKPKQTDCMBL-IEBWSBKVSA-N	0	3	335.451	3.118	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)[C@@H]1CC=CCC1	ZINC000960417619	1318540828	/nfs/dbraw/zinc/54/08/28/1318540828.db2.gz	LJGZRFAWHKNGLR-WOJBJXKFSA-N	0	3	337.467	3.337	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(C)cc(F)c2)C1	ZINC001021675834	1318541647	/nfs/dbraw/zinc/54/16/47/1318541647.db2.gz	GQAIPZVEQXRNMJ-APWZRJJASA-N	0	3	328.431	3.084	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC[C@H]1CN(C)Cc1ccc(OCC#N)cc1	ZINC000960455050	1318577840	/nfs/dbraw/zinc/57/78/40/1318577840.db2.gz	ZSKHOHVHKZBXBD-WMZOPIPTSA-N	0	3	343.471	3.058	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(C)c(CC)o2)C1	ZINC001021709577	1318586423	/nfs/dbraw/zinc/58/64/23/1318586423.db2.gz	CFRUWTXSTVTIFV-IRXDYDNUSA-N	0	3	328.456	3.100	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc3ccccc3n2)C1	ZINC001021720098	1318603478	/nfs/dbraw/zinc/60/34/78/1318603478.db2.gz	VMGCCWINQRCQIG-WIYYLYMNSA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2sc(C)cc2C)C1	ZINC001021725763	1318616910	/nfs/dbraw/zinc/61/69/10/1318616910.db2.gz	VZDZNPDSTFIQPS-ZWKOTPCHSA-N	0	3	344.524	3.244	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(OC(C)C)cc2)C1	ZINC001021726798	1318621156	/nfs/dbraw/zinc/62/11/56/1318621156.db2.gz	GIGJEXHXPHYDHF-ICSRJNTNSA-N	0	3	340.467	3.034	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(F)cc2Cl)C1	ZINC001021727218	1318623850	/nfs/dbraw/zinc/62/38/50/1318623850.db2.gz	KKPANVBGWDYBPL-RDTXWAMCSA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc3ccccc3n2CC)C1	ZINC001021738872	1318646934	/nfs/dbraw/zinc/64/69/34/1318646934.db2.gz	CQAHKRWJUQBUAV-AZUAARDMSA-N	0	3	349.478	3.221	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cnc(C(C)C)s2)C1	ZINC001021746331	1318662976	/nfs/dbraw/zinc/66/29/76/1318662976.db2.gz	KRQAGCDQZQRWBA-HOTGVXAUSA-N	0	3	345.512	3.216	20	30		EGEDHN
C[C@@H](N[C@H]1C[C@@H](NC(=O)c2c[nH]c(C#N)c2)C1)c1ccccc1Cl	ZINC001021989981	1318762243	/nfs/dbraw/zinc/76/22/43/1318762243.db2.gz	HCOZFIMEVBZBRB-BNOWGMLFSA-N	0	3	342.830	3.151	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H]1CN(C)Cc1ccc(C#N)cc1)C1CCC1	ZINC000960712802	1318817348	/nfs/dbraw/zinc/81/73/48/1318817348.db2.gz	SYXIRHYQYZRNRQ-JXFKEZNVSA-N	0	3	339.483	3.417	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)N[C@H]1CCCc2[nH]c(=O)ccc21	ZINC000912196187	1318846808	/nfs/dbraw/zinc/84/68/08/1318846808.db2.gz	SOMJRSOGTFWDED-RDJZCZTQSA-N	0	3	333.476	3.359	20	30		EGEDHN
CCOc1ccc([N-][NH+]=Cc2ccc(N3CCN(C)CC3)cc2)cc1	ZINC000814985170	1318864906	/nfs/dbraw/zinc/86/49/06/1318864906.db2.gz	VMABYGYDOWBHAB-UHFFFAOYSA-N	0	3	338.455	3.283	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)Nc1ccccc1C(=O)N(C)C	ZINC000912359926	1318878307	/nfs/dbraw/zinc/87/83/07/1318878307.db2.gz	LSRZGRDQEYWSPJ-INIZCTEOSA-N	0	3	333.476	3.405	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@@H]2CCCC[C@@H]2C(F)(F)F)C1	ZINC001022287852	1318878705	/nfs/dbraw/zinc/87/87/05/1318878705.db2.gz	SCBOLYGCNSBUBA-XQHKEYJVSA-N	0	3	338.801	3.344	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N[C@H](C)c1ccc(OC(C)C)c(OC)c1	ZINC000912391138	1318881294	/nfs/dbraw/zinc/88/12/94/1318881294.db2.gz	PJAPLWLZVJDVHC-ZBFHGGJFSA-N	0	3	334.460	3.343	20	30		EGEDHN
C#CCNC(=O)CCN1CCCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000815094986	1318889237	/nfs/dbraw/zinc/88/92/37/1318889237.db2.gz	QPRFPQIQVHFORO-MRXNPFEDSA-N	0	3	338.373	3.372	20	30		EGEDHN
C=CCOCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)OC(C)(C)C)C1	ZINC000815109577	1318893474	/nfs/dbraw/zinc/89/34/74/1318893474.db2.gz	HDMRDLIKVREWAQ-ZWKOTPCHSA-N	0	3	346.471	3.182	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]2CN(C)C[C@@H]2CC(C)(C)CO2)C1	ZINC000960847644	1318986851	/nfs/dbraw/zinc/98/68/51/1318986851.db2.gz	RDVGPSJSAMSSAN-SJORKVTESA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]2CN(C)Cc2ccc(C#N)cc2)C1	ZINC000960848330	1318987493	/nfs/dbraw/zinc/98/74/93/1318987493.db2.gz	UYIHKKUAYSGQEE-IBGZPJMESA-N	0	3	337.467	3.337	20	30		EGEDHN
CC(C)C1(C(=O)N2CCC[C@@H]2CN(C)Cc2cccc(C#N)c2)CC1	ZINC000960847613	1318987989	/nfs/dbraw/zinc/98/79/89/1318987989.db2.gz	QMNONKWFMWIUMU-LJQANCHMSA-N	0	3	339.483	3.417	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@@H](NC(=O)C3CC4(CCC4)C3)C2)c1	ZINC001022568728	1318997213	/nfs/dbraw/zinc/99/72/13/1318997213.db2.gz	XIRFCMKUAFZQGL-CALCHBBNSA-N	0	3	341.430	3.014	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)CC(C)(F)F	ZINC000960862085	1319006065	/nfs/dbraw/zinc/00/60/65/1319006065.db2.gz	OGRRSWKUZWAMMG-MRXNPFEDSA-N	0	3	335.398	3.026	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2csc(-c3ccco3)n2)C1	ZINC001022615118	1319016530	/nfs/dbraw/zinc/01/65/30/1319016530.db2.gz	BVLQOISXTBHOGM-PHIMTYICSA-N	0	3	337.832	3.006	20	30		EGEDHN
C[C@H]1CCC[C@@H](C(=O)N[C@H]2C[C@@H](NCc3ccc(C#N)cc3F)C2)C1	ZINC001022623793	1319025496	/nfs/dbraw/zinc/02/54/96/1319025496.db2.gz	XTUJOHJKBMSYQP-UNQWWWNPSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@@H](NCc3oc(C(C)C)nc3C)C2)C1	ZINC001022674722	1319061105	/nfs/dbraw/zinc/06/11/05/1319061105.db2.gz	GFCFDAARPUSNMI-GASCZTMLSA-N	0	3	331.460	3.200	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)[C@@H]2CCC[C@H](OC)C2)cc1	ZINC000815907795	1319071691	/nfs/dbraw/zinc/07/16/91/1319071691.db2.gz	KPJVCTMDOCXJCL-HYVNUMGLSA-N	0	3	328.412	3.102	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@@]2(CC)C(C)C)C1	ZINC001022913774	1319164655	/nfs/dbraw/zinc/16/46/55/1319164655.db2.gz	RUXOXTHUCJWINC-FQLMCAECSA-N	0	3	343.309	3.204	20	30		EGEDHN
CCC(=O)N1CCC[C@@H]([C@H]2CCN(CC#Cc3ccc(F)cc3)C2)C1	ZINC000961082123	1319194590	/nfs/dbraw/zinc/19/45/90/1319194590.db2.gz	VYCAYLOJCUKEHT-MOPGFXCFSA-N	0	3	342.458	3.148	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@H](C)c2ccc(F)cc2F)C1	ZINC001023109906	1319264467	/nfs/dbraw/zinc/26/44/67/1319264467.db2.gz	KSKHEJOQPIJZTJ-RTXFEEFZSA-N	0	3	328.790	3.058	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Cc1csc2ccc(Cl)cc12	ZINC000818589165	1319563937	/nfs/dbraw/zinc/56/39/37/1319563937.db2.gz	SJHNNKJNRPVYOI-UHFFFAOYSA-N	0	3	334.872	3.169	20	30		EGEDHN
CCCC(=O)Nc1cccc(CNC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000818961046	1319591834	/nfs/dbraw/zinc/59/18/34/1319591834.db2.gz	NMPOIMCKZDRGDE-IBGZPJMESA-N	0	3	337.423	3.120	20	30		EGEDHN
COC(=O)[C@@H]1C[C@@H]2[C@@H](CC[C@H](C)N2CCCCC2(C#N)CCC2)O1	ZINC000930350376	1328839643	/nfs/dbraw/zinc/83/96/43/1328839643.db2.gz	GYFWBYQELYQHDS-HZMVEIRTSA-N	0	3	334.460	3.034	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2[C@H]3CN([C@H](C)c4ccc(F)cc4)C[C@H]32)C1	ZINC000961687454	1319698198	/nfs/dbraw/zinc/69/81/98/1319698198.db2.gz	MZAOOMCJKOUZRZ-ZSGPHXLJSA-N	0	3	328.431	3.289	20	30		EGEDHN
C#CCN1CCC[C@H](CNC(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC001023602805	1319716791	/nfs/dbraw/zinc/71/67/91/1319716791.db2.gz	LACCGAMHQRGIOI-HMXCVIKNSA-N	0	3	338.495	3.422	20	30		EGEDHN
COc1cc(Cl)c(C)cc1NC(=O)C(C#N)C(=O)c1cccnc1	ZINC000916901346	1319722855	/nfs/dbraw/zinc/72/28/55/1319722855.db2.gz	FSWYWOCGBHOSEN-LBPRGKRZSA-N	0	3	343.770	3.013	20	30		EGEDHN
CCc1cccc(CC)c1NC(=O)C(C#N)C(=O)C[C@@H]1CCCO1	ZINC000916905166	1319723929	/nfs/dbraw/zinc/72/39/29/1319723929.db2.gz	BHDHCZJNLLJMER-JKSUJKDBSA-N	0	3	328.412	3.028	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H](CNC(=O)[C@@H]3CC34CCC4)C2)cc1	ZINC001023624833	1319745920	/nfs/dbraw/zinc/74/59/20/1319745920.db2.gz	HKIQGWGPAHTJOC-MOPGFXCFSA-N	0	3	337.467	3.077	20	30		EGEDHN
C=C1CCC(C(=O)NC2CC(CNCc3nc(C)c(C)s3)C2)CC1	ZINC000962259617	1319885964	/nfs/dbraw/zinc/88/59/64/1319885964.db2.gz	OQIAMTWGQNURLR-UHFFFAOYSA-N	0	3	347.528	3.491	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001023853974	1319990185	/nfs/dbraw/zinc/99/01/85/1319990185.db2.gz	AMTBAPQXTKPJNB-GJZGRUSLSA-N	0	3	331.435	3.072	20	30		EGEDHN
C#Cc1cccc(CNC(=O)NC[C@@H](N[C@@H](C)CC)c2ccco2)c1	ZINC000838587910	1320793115	/nfs/dbraw/zinc/79/31/15/1320793115.db2.gz	RXAVAFBDMMGLBS-MAUKXSAKSA-N	0	3	339.439	3.190	20	30		EGEDHN
N#C[C@@H]1CCC[C@@H](OC(=O)C2CCN(c3ccc(Cl)cc3)C2=O)C1	ZINC000839049304	1320858307	/nfs/dbraw/zinc/85/83/07/1320858307.db2.gz	QKRCJORQZZOZRR-WQVCFCJDSA-N	0	3	346.814	3.318	20	30		EGEDHN
C=CCn1c2ccccc2n(CN2CCN(C)C[C@@H]2CC)c1=S	ZINC000840094552	1321027341	/nfs/dbraw/zinc/02/73/41/1321027341.db2.gz	VQISESAMNCXVIS-HNNXBMFYSA-N	0	3	330.501	3.342	20	30		EGEDHN
CC[C@@H](OC1CCCC1)C(=O)C(C#N)C(=O)Nc1cccc(OC)c1	ZINC000842288765	1321367841	/nfs/dbraw/zinc/36/78/41/1321367841.db2.gz	LLCLLNWRXMRBCI-DLBZAZTESA-N	0	3	344.411	3.080	20	30		EGEDHN
N#CC(C(=O)NC1CCCC1)C(=O)[C@H]1CCSc2ccccc21	ZINC000842291247	1321368373	/nfs/dbraw/zinc/36/83/73/1321368373.db2.gz	GJWXROBSJCMGFO-GJZGRUSLSA-N	0	3	328.437	3.034	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)C(C#N)c1nc(C2CC2)cs1	ZINC000842945210	1321452598	/nfs/dbraw/zinc/45/25/98/1321452598.db2.gz	OKDOQYGJPSHVGS-DGCLKSJQSA-N	0	3	347.440	3.206	20	30		EGEDHN
C[C@@H](C#N)Oc1ccccc1NC(=O)NC[C@H]1CCCCN1C1CC1	ZINC000930760836	1328960292	/nfs/dbraw/zinc/96/02/92/1328960292.db2.gz	LFZUFVXELRGPGF-GOEBONIOSA-N	0	3	342.443	3.116	20	30		EGEDHN
COc1ccc(N(C)CCN(C)Cc2ccc(C#N)c(F)c2)cc1	ZINC000844400756	1321600786	/nfs/dbraw/zinc/60/07/86/1321600786.db2.gz	DVBRHUNURKXCQI-UHFFFAOYSA-N	0	3	327.403	3.274	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-]	ZINC000845880051	1321750545	/nfs/dbraw/zinc/75/05/45/1321750545.db2.gz	KJHGLYJLJDRXRS-PSLIRLAXSA-N	0	3	332.287	3.162	20	30		EGEDHN
N#C[C@H]1CCCN(C(=O)N[C@@H](CN2CCCCC2)c2ccccc2)C1	ZINC000918861646	1322005435	/nfs/dbraw/zinc/00/54/35/1322005435.db2.gz	PJDQENDAVIUIPK-MJGOQNOKSA-N	0	3	340.471	3.159	20	30		EGEDHN
CCc1cccc(CN2CCN(Cc3ccc(C#N)cc3)CC2)c1O	ZINC000848881284	1322026365	/nfs/dbraw/zinc/02/63/65/1322026365.db2.gz	XDBDJCDSANANNO-UHFFFAOYSA-N	0	3	335.451	3.144	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CON=C(N)c2ccccc2C)c1C	ZINC000849214007	1322098914	/nfs/dbraw/zinc/09/89/14/1322098914.db2.gz	XUMWAEUIOUUUFU-UHFFFAOYSA-N	0	3	325.412	3.329	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@@H]1CCCN(C(=O)CC2CCC2)C1	ZINC001023909495	1323017495	/nfs/dbraw/zinc/01/74/95/1323017495.db2.gz	GBPBDDUMVHJVQN-INIZCTEOSA-N	0	3	343.446	3.216	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@H]1CCCN1CCc1ccc(C#N)cc1	ZINC000851791114	1323088860	/nfs/dbraw/zinc/08/88/60/1323088860.db2.gz	TYQVKJVQZQULBX-QGZVFWFLSA-N	0	3	329.444	3.090	20	30		EGEDHN
CO[C@@H]1CC[C@@H](N2CCN([C@H](C#N)c3cccc(Cl)c3)CC2)C1	ZINC000851998402	1323129374	/nfs/dbraw/zinc/12/93/74/1323129374.db2.gz	HKIDNAJGKZFDKX-KZNAEPCWSA-N	0	3	333.863	3.090	20	30		EGEDHN
CO[C@@H]1CC[C@H](N2CCN([C@H](C#N)c3cccc(Cl)c3)CC2)C1	ZINC000851998403	1323129973	/nfs/dbraw/zinc/12/99/73/1323129973.db2.gz	HKIDNAJGKZFDKX-RCCFBDPRSA-N	0	3	333.863	3.090	20	30		EGEDHN
CCC(C)(C)C(=O)N1CCC[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001024129654	1323155197	/nfs/dbraw/zinc/15/51/97/1323155197.db2.gz	WYNDDQWBYQBMHD-HNNXBMFYSA-N	0	3	345.462	3.462	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@H]([C@@H]2CCCN2Cc2ccccc2C#N)C1	ZINC000963260695	1323273556	/nfs/dbraw/zinc/27/35/56/1323273556.db2.gz	VTOZUXCZGGSBEM-PMACEKPBSA-N	0	3	339.483	3.417	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)[C@@H]1CCc2c1cccc2Cl	ZINC001024557348	1323497408	/nfs/dbraw/zinc/49/74/08/1323497408.db2.gz	RUTAUGIFBDENKP-MAUKXSAKSA-N	0	3	344.886	3.364	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@H]2CCCCN2Cc2ccc(C)cc2)c1	ZINC001024644258	1323569165	/nfs/dbraw/zinc/56/91/65/1323569165.db2.gz	OBYMKKUZDWTRCC-OAQYLSRUSA-N	0	3	347.462	3.156	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cc(F)c(F)c(F)c1	ZINC001024672032	1323584331	/nfs/dbraw/zinc/58/43/31/1323584331.db2.gz	PTNLFXGYJFSEQL-ZDUSSCGKSA-N	0	3	326.362	3.264	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cccc(OC(C)C)n1	ZINC001024735455	1323635043	/nfs/dbraw/zinc/63/50/43/1323635043.db2.gz	JVCSYEBZDBLPKH-MRXNPFEDSA-N	0	3	331.460	3.029	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cccc(-n2ccnc2)c1	ZINC001024737281	1323637053	/nfs/dbraw/zinc/63/70/53/1323637053.db2.gz	HUKIDJOYDWNYBS-IBGZPJMESA-N	0	3	338.455	3.033	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)c(F)c1	ZINC001024877116	1323761699	/nfs/dbraw/zinc/76/16/99/1323761699.db2.gz	ZATBIBJJWJMNPT-RHSMWYFYSA-N	0	3	331.435	3.214	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCCC[C@@H]1CNCc1ccc(F)cc1Cl	ZINC001024902136	1323772195	/nfs/dbraw/zinc/77/21/95/1323772195.db2.gz	IKLISWBNUJJXLA-SWLSCSKDSA-N	0	3	337.826	3.109	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)C2=CCCC2)c(F)c1	ZINC001024925153	1323786786	/nfs/dbraw/zinc/78/67/86/1323786786.db2.gz	BZMOFJUBMGHFOZ-GOSISDBHSA-N	0	3	341.430	3.278	20	30		EGEDHN
CC1(C(=O)N2CCCC[C@@H]2CNCc2ccc(C#N)c(F)c2)CCC1	ZINC001025045260	1323848723	/nfs/dbraw/zinc/84/87/23/1323848723.db2.gz	VDFDHCXSCPQHAI-QGZVFWFLSA-N	0	3	343.446	3.358	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H]2[C@@H]2CCCCN2C(=O)C(F)F)cc1	ZINC001025186160	1323957158	/nfs/dbraw/zinc/95/71/58/1323957158.db2.gz	XFXHUKZSGGNIFU-IRXDYDNUSA-N	0	3	347.409	3.169	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)CCc1ccsc1	ZINC001025239359	1324031570	/nfs/dbraw/zinc/03/15/70/1324031570.db2.gz	DLXKJDZMZPRKKF-ZWKOTPCHSA-N	0	3	330.497	3.159	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cccc(CC)n1	ZINC001025241550	1324036653	/nfs/dbraw/zinc/03/66/53/1324036653.db2.gz	YIYHMRFSJHYXBF-MOPGFXCFSA-N	0	3	327.472	3.289	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc2c[nH]ccc-2n1	ZINC001025243695	1324040717	/nfs/dbraw/zinc/04/07/17/1324040717.db2.gz	DMSOPZWIFBBDNT-MOPGFXCFSA-N	0	3	338.455	3.208	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1c[nH]c2ccccc12	ZINC001025248406	1324049051	/nfs/dbraw/zinc/04/90/51/1324049051.db2.gz	ZLCJXSDGYHWRQO-WOJBJXKFSA-N	0	3	335.451	3.260	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)Cc1cc(C)ccc1C	ZINC001025264084	1324076426	/nfs/dbraw/zinc/07/64/26/1324076426.db2.gz	VTPIPMXBJKMTTI-RTWAWAEBSA-N	0	3	338.495	3.325	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ocnc1C1CC1	ZINC001025268900	1324081070	/nfs/dbraw/zinc/08/10/70/1324081070.db2.gz	HWWKDVTYQFAZRD-HZPDHXFCSA-N	0	3	329.444	3.197	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)C1(C(F)(F)F)CC1	ZINC001025271888	1324087461	/nfs/dbraw/zinc/08/74/61/1324087461.db2.gz	JPJISVAJJJWBMH-GJZGRUSLSA-N	0	3	342.405	3.198	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)Cc1ccsc1C	ZINC001025273615	1324089130	/nfs/dbraw/zinc/08/91/30/1324089130.db2.gz	FUHZVIBLRWMBQA-MSOLQXFVSA-N	0	3	330.497	3.078	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1coc(C2CC2)n1	ZINC001025273930	1324090184	/nfs/dbraw/zinc/09/01/84/1324090184.db2.gz	IKDPQFAQVRWWKD-ZWKOTPCHSA-N	0	3	341.455	3.034	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(C(C)C)no1	ZINC001025273893	1324090767	/nfs/dbraw/zinc/09/07/67/1324090767.db2.gz	IATDDNADDLYSQG-IAGOWNOFSA-N	0	3	331.460	3.443	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccn(C(C)C)n1	ZINC001025275685	1324097214	/nfs/dbraw/zinc/09/72/14/1324097214.db2.gz	YJBDJOHYXAHXSP-ROUUACIJSA-N	0	3	330.476	3.109	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1coc(C2CC2)n1	ZINC001025278181	1324098978	/nfs/dbraw/zinc/09/89/78/1324098978.db2.gz	RNSWKZORSAMQAY-IRXDYDNUSA-N	0	3	329.444	3.197	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1coc(CCC)n1	ZINC001025289842	1324113633	/nfs/dbraw/zinc/11/36/33/1324113633.db2.gz	UCXRMYNZOTUBBZ-DLBZAZTESA-N	0	3	331.460	3.272	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc2c(c1)CCC2	ZINC001025294086	1324123025	/nfs/dbraw/zinc/12/30/25/1324123025.db2.gz	HUNAEIHDTGNFDM-LEWJYISDSA-N	0	3	336.479	3.268	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)Cc1ccccc1F	ZINC001025294788	1324124617	/nfs/dbraw/zinc/12/46/17/1324124617.db2.gz	CRVMGYOTAGYFHX-VQTJNVASSA-N	0	3	342.458	3.237	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cccc(C(F)F)c2F)C1	ZINC001025424937	1324259871	/nfs/dbraw/zinc/25/98/71/1324259871.db2.gz	JXCJGCFOQVKEQO-QWHCGFSZSA-N	0	3	338.373	3.227	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc3c(o2)CCCC3)C1	ZINC001025438760	1324277763	/nfs/dbraw/zinc/27/77/63/1324277763.db2.gz	IBFHHHOKSJLZGJ-DOTOQJQBSA-N	0	3	328.456	3.012	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2csc(C(F)(F)F)c2)C1	ZINC001025471727	1324316717	/nfs/dbraw/zinc/31/67/17/1324316717.db2.gz	IMPDQYFGNWGOAZ-RYUDHWBXSA-N	0	3	344.402	3.230	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc3ccccc3s2)C1	ZINC001025471455	1324316829	/nfs/dbraw/zinc/31/68/29/1324316829.db2.gz	FAXWTKSJTQTLKE-GDBMZVCRSA-N	0	3	326.465	3.365	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cnc3ccccc3c2C)C1	ZINC001025488281	1324339333	/nfs/dbraw/zinc/33/93/33/1324339333.db2.gz	JVIMZPJEKUZXNB-ZWKOTPCHSA-N	0	3	349.478	3.397	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(F)c(Cl)cc2F)C1	ZINC001025520086	1324364076	/nfs/dbraw/zinc/36/40/76/1324364076.db2.gz	ASRGFOIVRIPLRI-NEPJUHHUSA-N	0	3	340.801	3.082	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(Cl)c(OC)c2)C1	ZINC001025553019	1324400461	/nfs/dbraw/zinc/40/04/61/1324400461.db2.gz	QDMGVVRUFFTOHJ-ZBFHGGJFSA-N	0	3	348.874	3.202	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc3nc(C)ccc3c2)C1	ZINC001025564978	1324411486	/nfs/dbraw/zinc/41/14/86/1324411486.db2.gz	OBXSHFVSAUDGFV-QFBILLFUSA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc3[nH]ccc3s2)C1	ZINC001025602637	1324450152	/nfs/dbraw/zinc/45/01/52/1324450152.db2.gz	JEISJYXCCWKEOE-UONOGXRCSA-N	0	3	329.469	3.083	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccsc2C(F)(F)F)C1	ZINC001025603104	1324451317	/nfs/dbraw/zinc/45/13/17/1324451317.db2.gz	QPNCVKSOVHRSIW-NWDGAFQWSA-N	0	3	344.402	3.230	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(C(F)(F)F)cc2)C1	ZINC001025603201	1324452976	/nfs/dbraw/zinc/45/29/76/1324452976.db2.gz	RNRUOTVCZWFACD-UKRRQHHQSA-N	0	3	338.373	3.169	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(C)nc3ccccc32)C1	ZINC001025613675	1324465279	/nfs/dbraw/zinc/46/52/79/1324465279.db2.gz	YZISIBVXGXTAPS-SJORKVTESA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2csc3c2CCCC3)C1	ZINC001025613735	1324465522	/nfs/dbraw/zinc/46/55/22/1324465522.db2.gz	ZUFWIDAQCKELKP-JKSUJKDBSA-N	0	3	344.524	3.481	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2sc(CCC)nc2C)C1	ZINC001025618664	1324470494	/nfs/dbraw/zinc/47/04/94/1324470494.db2.gz	DOPHCWDCZREAGI-HOCLYGCPSA-N	0	3	347.528	3.258	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccccc2CC(C)C)C1	ZINC001025630408	1324482453	/nfs/dbraw/zinc/48/24/53/1324482453.db2.gz	SOGKUEPJPQPTBF-IEBWSBKVSA-N	0	3	326.484	3.349	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2c(Cl)cccc2OC)C1	ZINC001025630096	1324482545	/nfs/dbraw/zinc/48/25/45/1324482545.db2.gz	OWRBSJJDZRVIFO-GJZGRUSLSA-N	0	3	348.874	3.202	20	30		EGEDHN
CCC(CC)C(=O)N1C[C@@H]2CC[C@@H](NCc3ccccc3C#N)[C@@H]2C1	ZINC001026203859	1324662715	/nfs/dbraw/zinc/66/27/15/1324662715.db2.gz	YCSVWRSDODGNIP-XUVXKRRUSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H]2CC[C@@H](NCc3ncoc3C(C)C)[C@@H]2C1	ZINC001026329217	1324730366	/nfs/dbraw/zinc/73/03/66/1324730366.db2.gz	AAZWYDWIKHFYRA-ARFHVFGLSA-N	0	3	345.487	3.337	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H]3CC[C@@H](NCc4ncc(C)s4)[C@@H]3C2)C1	ZINC001026352895	1324747454	/nfs/dbraw/zinc/74/74/54/1324747454.db2.gz	WOBQIUASOPIZAP-ARFHVFGLSA-N	0	3	345.512	3.134	20	30		EGEDHN
CC1(C(=O)NC2CCC(NCc3ccccc3C#N)CC2)CCC1	ZINC001026542466	1324879921	/nfs/dbraw/zinc/87/99/21/1324879921.db2.gz	NWEPOJVNGMIVRB-UHFFFAOYSA-N	0	3	325.456	3.265	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)[C@@H]2CCC2(C)C)CC1	ZINC001026545612	1324882811	/nfs/dbraw/zinc/88/28/11/1324882811.db2.gz	HDHNMOKPJCEOKI-RUXDESIVSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=C1CCC(C(=O)NC2CCC(NCc3nccn3CC)CC2)CC1	ZINC001026554265	1324890329	/nfs/dbraw/zinc/89/03/29/1324890329.db2.gz	SKDQRUJRBGAHLC-UHFFFAOYSA-N	0	3	344.503	3.166	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)Cc2cccnc2)C1	ZINC000963289174	1325074934	/nfs/dbraw/zinc/07/49/34/1325074934.db2.gz	GVTICFTVJJXZKH-ROUUACIJSA-N	0	3	347.890	3.080	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@@H](CNCc2ccccc2C#N)C1)C(C)(C)C	ZINC001026919930	1325083459	/nfs/dbraw/zinc/08/34/59/1325083459.db2.gz	QQCXUHWQTOTVEP-HOTGVXAUSA-N	0	3	327.472	3.179	20	30		EGEDHN
N#Cc1ncc(Br)cc1NC[C@H]1CCCCN1C1CC1	ZINC000853539010	1325119603	/nfs/dbraw/zinc/11/96/03/1325119603.db2.gz	ZODCBCIRKLFAQG-CYBMUJFWSA-N	0	3	335.249	3.145	20	30		EGEDHN
N#Cc1ncc(Br)cc1N[C@@H]1CCCN2CCCC[C@@H]12	ZINC000853717502	1325151879	/nfs/dbraw/zinc/15/18/79/1325151879.db2.gz	GCBRFBHFMUIGHO-DOMZBBRYSA-N	0	3	335.249	3.145	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)c2c[nH]cc2C)C1	ZINC000963411939	1325216687	/nfs/dbraw/zinc/21/66/87/1325216687.db2.gz	AWYNAGGPXGJBPJ-RDJZCZTQSA-N	0	3	335.879	3.392	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)c2cc(C#N)ccc2F)N(C)C)cc1	ZINC000854304225	1325241856	/nfs/dbraw/zinc/24/18/56/1325241856.db2.gz	DCISTJPBRVQZMI-IBGZPJMESA-N	0	3	339.414	3.292	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1ccc(Cl)o1)C2	ZINC000963570991	1325326563	/nfs/dbraw/zinc/32/65/63/1325326563.db2.gz	PBOVUPVKBMUBNN-UHFFFAOYSA-N	0	3	329.227	3.316	20	30		EGEDHN
C[C@H](CC(C)(C)C#N)N[C@@H](Cc1ccccc1)[C@H](O)C(F)(F)F	ZINC000925850242	1325329056	/nfs/dbraw/zinc/32/90/56/1325329056.db2.gz	GYCUHDAOSDVLEY-SNPRPXQTSA-N	0	3	328.378	3.439	20	30		EGEDHN
C[C@H](CC(C)(C)C#N)N[C@@H](Cc1ccccc1)[C@@H](O)C(F)(F)F	ZINC000925850243	1325329712	/nfs/dbraw/zinc/32/97/12/1325329712.db2.gz	GYCUHDAOSDVLEY-VHDGCEQUSA-N	0	3	328.378	3.439	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)c2cccs2)C1	ZINC001027281817	1325408402	/nfs/dbraw/zinc/40/84/02/1325408402.db2.gz	ZSFXANSSLWBLPP-KRWDZBQOSA-N	0	3	339.464	3.356	20	30		EGEDHN
CCC(CC)C(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001027301105	1325443399	/nfs/dbraw/zinc/44/33/99/1325443399.db2.gz	HNASRURCQIVFIC-LJQANCHMSA-N	0	3	327.472	3.417	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H](N(C)Cc2cccc(C#N)c2)C1)C1CC1	ZINC001027350323	1325515778	/nfs/dbraw/zinc/51/57/78/1325515778.db2.gz	AOBFCVYBSQKVDX-BEFAXECRSA-N	0	3	325.456	3.027	20	30		EGEDHN
CC1CC(C(=O)N2CCC[C@@H](N(C)Cc3ccc(C#N)cc3)C2)C1	ZINC001027361379	1325545508	/nfs/dbraw/zinc/54/55/08/1325545508.db2.gz	HJDAPKPMXTYAFI-XUJQIHCRSA-N	0	3	325.456	3.027	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)[C@@H]2CC2(C)C)C1	ZINC001027374780	1325571301	/nfs/dbraw/zinc/57/13/01/1325571301.db2.gz	JGFSEBHKTYYYBD-ROUUACIJSA-N	0	3	325.456	3.027	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@@H](N(C)CCc3ccns3)C2)CC1	ZINC001027559369	1327871677	/nfs/dbraw/zinc/87/16/77/1327871677.db2.gz	WHRBNVVAEHIZHA-QGZVFWFLSA-N	0	3	347.528	3.355	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@H](N(C)Cc2ccc(F)c(C#N)c2)C1	ZINC001027585269	1327920798	/nfs/dbraw/zinc/92/07/98/1327920798.db2.gz	DYRWHFUGUFEVNW-BPQIPLTHSA-N	0	3	343.446	3.166	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCC[C@H](N(C)Cc2ccc(F)c(C#N)c2)C1	ZINC001027602816	1327954330	/nfs/dbraw/zinc/95/43/30/1327954330.db2.gz	FGUOGOAQCGAGHM-YJBOKZPZSA-N	0	3	345.462	3.412	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1nc(C3CC3)oc1C)C2	ZINC000965634441	1328016158	/nfs/dbraw/zinc/01/61/58/1328016158.db2.gz	AMFCUVIAKPNQAB-UHFFFAOYSA-N	0	3	349.862	3.244	20	30		EGEDHN
C#CCCN1CCC[C@H]1CNC(=O)c1csc2cc(C)ccc12	ZINC001027907682	1328380187	/nfs/dbraw/zinc/38/01/87/1328380187.db2.gz	BBIAJTCWOOSFKS-HNNXBMFYSA-N	0	3	326.465	3.427	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NC[C@@H]1CCCN1CC=C(C)C	ZINC001027977283	1328453074	/nfs/dbraw/zinc/45/30/74/1328453074.db2.gz	OYUFDDHVROBVCZ-KRWDZBQOSA-N	0	3	328.456	3.412	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1cn(CC)c2ccccc12	ZINC001028012042	1328474389	/nfs/dbraw/zinc/47/43/89/1328474389.db2.gz	FSKYVXDWZDTIKW-INIZCTEOSA-N	0	3	325.456	3.432	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)[C@@H]1C[C@H]1c1ccc(N(C)C)cc1	ZINC001028043706	1328509139	/nfs/dbraw/zinc/50/91/39/1328509139.db2.gz	VPWDNVICRZPWIU-SLFFLAALSA-N	0	3	341.499	3.013	20	30		EGEDHN
CCCCCCCC[C@H](C)CC(=O)N1CC[C@@H](N2CC[C@H](O)C2)C1	ZINC000861714198	1329437715	/nfs/dbraw/zinc/43/77/15/1329437715.db2.gz	JAGLBLWJXGBUIT-OTWHNJEPSA-N	0	3	338.536	3.431	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cnc4ccccc4c3C)C2)CC1	ZINC001050594110	1348296446	/nfs/dbraw/zinc/29/64/46/1348296446.db2.gz	IAXKAFMJRBFPIY-UHFFFAOYSA-N	0	3	347.462	3.105	20	30		EGEDHN
COC(=O)C[C@@H](NCc1cc(Cl)ccc1OCC#N)C(C)(C)C	ZINC000934030245	1329941627	/nfs/dbraw/zinc/94/16/27/1329941627.db2.gz	DEOQLBDQWPJCJR-OAHLLOKOSA-N	0	3	338.835	3.310	20	30		EGEDHN
CSCC(C)(C)NCC(=O)N(CCC#N)c1ccc(C)c(C)c1	ZINC000934672789	1329998611	/nfs/dbraw/zinc/99/86/11/1329998611.db2.gz	BZJJVVDXDWRAHE-UHFFFAOYSA-N	0	3	333.501	3.281	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CCN(Cc2ccsc2)C[C@@H]1C	ZINC000942128126	1331841159	/nfs/dbraw/zinc/84/11/59/1331841159.db2.gz	CDKWFYRVRMTYSO-DOTOQJQBSA-N	0	3	343.496	3.376	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc3ccc(C)nc32)[C@@H](C)C1	ZINC000942168661	1331857593	/nfs/dbraw/zinc/85/75/93/1331857593.db2.gz	YBSYPUHPIQTPKE-KXBFYZLASA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)nn2C(CC)CC)[C@H](C)C1	ZINC000942201826	1331876222	/nfs/dbraw/zinc/87/62/22/1331876222.db2.gz	AJWNDXPRLVOPSR-CRAIPNDOSA-N	0	3	344.503	3.016	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2coc3cc(F)ccc23)[C@H](C)C1	ZINC000942203918	1331877495	/nfs/dbraw/zinc/87/74/95/1331877495.db2.gz	LOENZKNGRDWEJN-DYVFJYSZSA-N	0	3	328.387	3.035	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2ccc(CCCC)cc2)[C@@H](C)C1	ZINC000942274826	1331892878	/nfs/dbraw/zinc/89/28/78/1331892878.db2.gz	YLYJGHWALYLRLV-FXAWDEMLSA-N	0	3	326.484	3.032	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2coc3ccc(OC)cc32)[C@H](C)C1	ZINC000942431101	1331933260	/nfs/dbraw/zinc/93/32/60/1331933260.db2.gz	KYRXMCMIXKICRS-DYVFJYSZSA-N	0	3	328.412	3.068	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2sccc2-n2cccc2)[C@H](C)C1	ZINC000942546352	1331967843	/nfs/dbraw/zinc/96/78/43/1331967843.db2.gz	SVHREGOMJFJPQF-CABCVRRESA-N	0	3	329.469	3.165	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2nsc3ccc(C)cc32)[C@H](C)C1	ZINC000942563437	1331977872	/nfs/dbraw/zinc/97/78/72/1331977872.db2.gz	XRQNPKPMSFDHEA-HIFRSBDPSA-N	0	3	329.469	3.231	20	30		EGEDHN
C[C@H]1CN(Cc2ccc(C#N)cc2)CC[C@@H]1NC(=O)C1(C)CC=CC1	ZINC000942603170	1332001170	/nfs/dbraw/zinc/00/11/70/1332001170.db2.gz	TUOVJUXGNJCVIX-LPHOPBHVSA-N	0	3	337.467	3.241	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccccc2OCC(C)C)[C@H](C)C1	ZINC000943688632	1332239022	/nfs/dbraw/zinc/23/90/22/1332239022.db2.gz	FBDQFDRASBJEMS-IEBWSBKVSA-N	0	3	342.483	3.185	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cnn(C(CC)CC)c2C)[C@@H](C)C1	ZINC000944033475	1332312354	/nfs/dbraw/zinc/31/23/54/1332312354.db2.gz	MHOXFFIVXBDUKW-HNAYVOBHSA-N	0	3	344.503	3.016	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C(C)(C)c2ccc(C)cc2)[C@H](C)C1	ZINC000944230098	1332349852	/nfs/dbraw/zinc/34/98/52/1332349852.db2.gz	YUVSXVAVMJUAIW-MJGOQNOKSA-N	0	3	326.484	3.123	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(Cl)c(Cl)c2)[C@@H](C)C1	ZINC000944305996	1332368691	/nfs/dbraw/zinc/36/86/91/1332368691.db2.gz	QFKSUUMMATUPHC-NHYWBVRUSA-N	0	3	325.239	3.067	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(F)c(F)cc2Cl)[C@H](C)C1	ZINC000944617936	1332417728	/nfs/dbraw/zinc/41/77/28/1332417728.db2.gz	ABYLTUQQXYKRER-BMIGLBTASA-N	0	3	328.790	3.244	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2sc(C(C)C)nc2C)[C@@H](C)C1	ZINC000944905673	1332450388	/nfs/dbraw/zinc/45/03/88/1332450388.db2.gz	DNMWTBQZQPZMDF-ZFWWWQNUSA-N	0	3	333.501	3.038	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2c[nH]cc2-c2ccccc2)[C@H](C)C1	ZINC000944921053	1332454610	/nfs/dbraw/zinc/45/46/10/1332454610.db2.gz	XXQZTUXJWBCZDQ-OXQOHEQNSA-N	0	3	335.451	3.145	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C(F)(F)F)s2)[C@H](C)C1	ZINC000945368864	1332569327	/nfs/dbraw/zinc/56/93/27/1332569327.db2.gz	ZHAOUPXTTATVEK-VXGBXAGGSA-N	0	3	344.402	3.230	20	30		EGEDHN
N#Cc1ccccc1CN1C[C@@H]2CCN(C(=O)c3ccco3)CC[C@@H]2C1	ZINC000946452069	1332832316	/nfs/dbraw/zinc/83/23/16/1332832316.db2.gz	AYUSUQWKFFPEKO-KDURUIRLSA-N	0	3	349.434	3.135	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)/C=C/c3ccco3)CC[C@@H]2C1	ZINC000946454645	1332833794	/nfs/dbraw/zinc/83/37/94/1332833794.db2.gz	QLKMSMHMXKHIOY-RYIQXIGLSA-N	0	3	334.847	3.216	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3ccc(CC)o3)CC[C@@H]2C1	ZINC000946649296	1332870413	/nfs/dbraw/zinc/87/04/13/1332870413.db2.gz	SWIYEXANSPDIBF-GASCZTMLSA-N	0	3	336.863	3.379	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)Cc3ccc(C)cc3)CC[C@@H]2C1	ZINC000946667615	1332874078	/nfs/dbraw/zinc/87/40/78/1332874078.db2.gz	CKKXGVIAIPAOJL-KDURUIRLSA-N	0	3	346.902	3.460	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)C2CCCC2)CCN1Cc1cccc(C#N)c1	ZINC000946976433	1332951331	/nfs/dbraw/zinc/95/13/31/1332951331.db2.gz	UYMRJVUEIWVPPU-BEFAXECRSA-N	0	3	325.456	3.218	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)C2CC(F)(F)C2)CCN1Cc1ccc(C#N)cc1	ZINC000947171399	1333035842	/nfs/dbraw/zinc/03/58/42/1333035842.db2.gz	UVLAIRIRLZFQAI-GUYCJALGSA-N	0	3	347.409	3.073	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2c[nH]c(C#N)c2)CCN1C/C=C/c1ccccc1	ZINC000947206011	1333052171	/nfs/dbraw/zinc/05/21/71/1333052171.db2.gz	ZQLCYRAEBMXNSF-HXSXWYSASA-N	0	3	348.450	3.182	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(C)c(Cl)c2)C[C@H]1C	ZINC000947441660	1333128679	/nfs/dbraw/zinc/12/86/79/1333128679.db2.gz	KAPWLOGPNYBVBH-WBVHZDCISA-N	0	3	332.875	3.183	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)Cc2ccccc2)CCN1Cc1cccc(C#N)c1	ZINC000947454311	1333134752	/nfs/dbraw/zinc/13/47/52/1333134752.db2.gz	JLMDFQIUZLWNBH-DYESRHJHSA-N	0	3	347.462	3.270	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(-c3ccco3)o2)C[C@H]1C	ZINC000947538144	1333163572	/nfs/dbraw/zinc/16/35/72/1333163572.db2.gz	VWLSGWQURDLJCP-CABCVRRESA-N	0	3	326.396	3.146	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2cc3ccccc3s2)C[C@@H]1C	ZINC000947540353	1333164107	/nfs/dbraw/zinc/16/41/07/1333164107.db2.gz	RZWSTEZMIQOOLH-GOEBONIOSA-N	0	3	326.465	3.046	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2nsc3ccc(C)cc32)C[C@H]1C	ZINC000947622021	1333196403	/nfs/dbraw/zinc/19/64/03/1333196403.db2.gz	ZTTOJQHMVDACJW-CABCVRRESA-N	0	3	341.480	3.211	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)C(C)(C)C2CC2)CCN1Cc1cccc(C#N)c1	ZINC000947632743	1333201217	/nfs/dbraw/zinc/20/12/17/1333201217.db2.gz	FOSQVMFJIKIARS-BEFAXECRSA-N	0	3	339.483	3.464	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2csc(-c3ccco3)n2)C[C@@H]1C	ZINC000947661834	1333212455	/nfs/dbraw/zinc/21/24/55/1333212455.db2.gz	AWOSTZKXZFVPHO-KBPBESRZSA-N	0	3	343.452	3.009	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2csc(-c3ccco3)n2)C[C@@H]1C	ZINC000947661790	1333212553	/nfs/dbraw/zinc/21/25/53/1333212553.db2.gz	AIVHOVCQXRMTER-QWHCGFSZSA-N	0	3	331.441	3.172	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2csc(-c3ccco3)n2)C[C@H]1C	ZINC000947661835	1333212822	/nfs/dbraw/zinc/21/28/22/1333212822.db2.gz	AWOSTZKXZFVPHO-KGLIPLIRSA-N	0	3	343.452	3.009	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(F)c(Cl)c2F)C[C@H]1C	ZINC000947693658	1333228035	/nfs/dbraw/zinc/22/80/35/1333228035.db2.gz	QAHPCCFPTMVRLQ-NEPJUHHUSA-N	0	3	340.801	3.224	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)C2(C)CC=CC2)CCN1Cc1cccc(C#N)c1	ZINC000947694429	1333228950	/nfs/dbraw/zinc/22/89/50/1333228950.db2.gz	XXLVKRDUQYGOJV-LPHOPBHVSA-N	0	3	337.467	3.384	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@H](C)C2)C1	ZINC000947701461	1333232171	/nfs/dbraw/zinc/23/21/71/1333232171.db2.gz	CCPASHKBXWULGG-VQIMIIECSA-N	0	3	337.467	3.384	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2ccc(C(C)(C)C)cc2)C[C@@H]1C	ZINC000947751266	1333250650	/nfs/dbraw/zinc/25/06/50/1333250650.db2.gz	WPCMEBULZNJANV-QFBILLFUSA-N	0	3	326.484	3.129	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnc(-c3ccoc3)s2)C[C@@H]1C	ZINC000947778365	1333258488	/nfs/dbraw/zinc/25/84/88/1333258488.db2.gz	BROKSPPMGHTXPR-JSGCOSHPSA-N	0	3	331.441	3.172	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2scnc2C(C)(C)C)C[C@H]1C	ZINC000947792392	1333263370	/nfs/dbraw/zinc/26/33/70/1333263370.db2.gz	LTXSOMIKFXNETA-ZIAGYGMSSA-N	0	3	333.501	3.047	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C(C)(C)c2ccccc2Cl)C[C@@H]1C	ZINC000947948414	1333315572	/nfs/dbraw/zinc/31/55/72/1333315572.db2.gz	NKAPCTSULDQCOS-LSDHHAIUSA-N	0	3	332.875	3.220	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc(C(F)(F)F)cc2)C[C@@H]1C	ZINC000947962857	1333322815	/nfs/dbraw/zinc/32/28/15/1333322815.db2.gz	OWFBEJUYKIDYRM-WFASDCNBSA-N	0	3	326.362	3.474	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2coc3cc(C)ccc23)C[C@H]1C	ZINC000948002096	1333339082	/nfs/dbraw/zinc/33/90/82/1333339082.db2.gz	KMQJQAGULAUYEN-SJLPKXTDSA-N	0	3	338.451	3.276	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(OCC(C)C)cc2)C[C@H]1C	ZINC000948002319	1333339109	/nfs/dbraw/zinc/33/91/09/1333339109.db2.gz	OGORBKNUGYFXFG-IEBWSBKVSA-N	0	3	342.483	3.327	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)CC2C3CC4CC(C3)CC2C4)C[C@H]1C	ZINC000948057742	1333358737	/nfs/dbraw/zinc/35/87/37/1333358737.db2.gz	YXCLHVZRHPLMNN-NJKWNDLUSA-N	0	3	328.500	3.051	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)C2C3CC4CC(C3)CC2C4)CC1	ZINC000948439174	1333525775	/nfs/dbraw/zinc/52/57/75/1333525775.db2.gz	JMTNJLRVJOHVDQ-RDOIFFKNSA-N	0	3	328.500	3.005	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)[C@H](C)c2c(F)cccc2F)CC1	ZINC000948620810	1333599843	/nfs/dbraw/zinc/59/98/43/1333599843.db2.gz	IQFHQXIZFMOKKL-HUUCEWRRSA-N	0	3	334.410	3.014	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cc3ccsc3[nH]2)CC1	ZINC000948662168	1333618091	/nfs/dbraw/zinc/61/80/91/1333618091.db2.gz	RYDUOMYJQXTTEO-HNNXBMFYSA-N	0	3	329.469	3.179	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@H]2CCCN(C/C=C\Cl)CC2)cc1	ZINC000948665947	1333620841	/nfs/dbraw/zinc/62/08/41/1333620841.db2.gz	WRVONKYEXHMPIH-KYDJUPTOSA-N	0	3	330.859	3.347	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@H]2CCCN(C[C@H](F)CC)CC2)cc1	ZINC000948665723	1333621228	/nfs/dbraw/zinc/62/12/28/1333621228.db2.gz	QJMGLQKAAKTQSM-MOPGFXCFSA-N	0	3	330.447	3.343	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)C2(c3ccc(F)cc3)CCC2)CC1	ZINC000948666017	1333621660	/nfs/dbraw/zinc/62/16/60/1333621660.db2.gz	YPAQZPANACVUOO-IBGZPJMESA-N	0	3	342.458	3.194	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2ccccc2OC2CCC2)CC1	ZINC000948762720	1333666875	/nfs/dbraw/zinc/66/68/75/1333666875.db2.gz	QRNOVFOLJORQAA-QGZVFWFLSA-N	0	3	340.467	3.178	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2ccc(C)c(F)c2F)CC1	ZINC000948799964	1333684341	/nfs/dbraw/zinc/68/43/41/1333684341.db2.gz	BRZJVVUPUKYCHN-OAHLLOKOSA-N	0	3	334.410	3.223	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2oc(C(C)C)nc2C)CC1	ZINC000948840209	1333705660	/nfs/dbraw/zinc/70/56/60/1333705660.db2.gz	BFSKDCFFLVIUOR-INIZCTEOSA-N	0	3	331.460	3.056	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@H]1CNC(=O)C1=COCCC1	ZINC000948898611	1333724902	/nfs/dbraw/zinc/72/49/02/1333724902.db2.gz	KBIJOAMUKAFGOA-HXUWFJFHSA-N	0	3	340.467	3.363	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2c3ccccc3CCN2CC(C)C)cn1	ZINC000948978913	1333755009	/nfs/dbraw/zinc/75/50/09/1333755009.db2.gz	PIDQSMRZZZYIHH-NRFANRHFSA-N	0	3	347.462	3.048	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@H](C)C1CCCCC1)CCO2	ZINC000949207039	1333795790	/nfs/dbraw/zinc/79/57/90/1333795790.db2.gz	IAQQDCYFLORXPF-SFHVURJKSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@H]3CC[C@@H]4C[C@@H]4CC3)CC2)C1	ZINC000949423410	1333844410	/nfs/dbraw/zinc/84/44/10/1333844410.db2.gz	AJWVZLPJXJMDQM-REPLKXPHSA-N	0	3	346.515	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3cc(C)cc(F)c3)CC2)C1	ZINC000949474742	1333858345	/nfs/dbraw/zinc/85/83/45/1333858345.db2.gz	KTVHPAAFUVQFFN-UHFFFAOYSA-N	0	3	346.446	3.017	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@@H]3CC[C@@H](C)C3)CC2)C1	ZINC000949486819	1333859760	/nfs/dbraw/zinc/85/97/60/1333859760.db2.gz	IFCJOANKTJMKED-QZTJIDSGSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@@H]3C[C@H]3C3CCCC3)CC2)C1	ZINC000949503259	1333862130	/nfs/dbraw/zinc/86/21/30/1333862130.db2.gz	AXSHFIGIXHDASN-RBUKOAKNSA-N	0	3	346.515	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C[C@@H](C)C3CC3)CC2)C1	ZINC000949532042	1333868899	/nfs/dbraw/zinc/86/88/99/1333868899.db2.gz	VWKBFRMFCIFLCH-QGZVFWFLSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N[C@H]1CN(CCCF)CC[C@H]1C	ZINC000967011935	1335641893	/nfs/dbraw/zinc/64/18/93/1335641893.db2.gz	ZIOJSPKEQKTUKJ-WBVHZDCISA-N	0	3	334.435	3.051	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)Cc2c(C)cccc2Cl)C1	ZINC000967231344	1335677275	/nfs/dbraw/zinc/67/72/75/1335677275.db2.gz	PTZZTYJNKYPGHK-CRAIPNDOSA-N	0	3	332.875	3.041	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2ccc3c(c2)C(C)(C)CO3)C1	ZINC000967319896	1335700321	/nfs/dbraw/zinc/70/03/21/1335700321.db2.gz	ZPVJWGKXLGTSPL-QAPCUYQASA-N	0	3	342.483	3.373	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2ccc3c(c2)C(C)(C)CO3)C1	ZINC000967319894	1335700336	/nfs/dbraw/zinc/70/03/36/1335700336.db2.gz	ZPVJWGKXLGTSPL-CRAIPNDOSA-N	0	3	342.483	3.373	20	30		EGEDHN
C=C(C)CCN1CC[C@H](C)[C@H](NC(=O)c2ocnc2C(F)(F)F)C1	ZINC000967435886	1335738344	/nfs/dbraw/zinc/73/83/44/1335738344.db2.gz	OSSXDTXEKMSCBN-NWDGAFQWSA-N	0	3	345.365	3.100	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2ccc(C)nc2C2CC2)C1	ZINC000967438082	1335739494	/nfs/dbraw/zinc/73/94/94/1335739494.db2.gz	TYOWFZPOKCDNCJ-RDTXWAMCSA-N	0	3	327.472	3.284	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CN(CC3=CCCCC3)CC[C@@H]2C)c1	ZINC000968317508	1335888384	/nfs/dbraw/zinc/88/83/84/1335888384.db2.gz	LAIYQGPZCNECQD-OXJNMPFZSA-N	0	3	337.467	3.004	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2ccc(N3CC=CC3)cc2)C1	ZINC000968320954	1335889672	/nfs/dbraw/zinc/88/96/72/1335889672.db2.gz	BQAQDQCESPHFLU-FXAWDEMLSA-N	0	3	339.483	3.079	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@H]2CN(CC=C(C)C)CC[C@@H]2C)cc1	ZINC000968391425	1335916940	/nfs/dbraw/zinc/91/69/40/1335916940.db2.gz	SBYKLBOYCBKEHF-PXNSSMCTSA-N	0	3	340.467	3.105	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2cc(-c3ccccc3)ccn2)C1	ZINC000968471348	1335934260	/nfs/dbraw/zinc/93/42/60/1335934260.db2.gz	DHZSRATZJKMHMB-UWJYYQICSA-N	0	3	347.462	3.212	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccc(OC)c(C3CC3)c2)C1	ZINC000968484717	1335937601	/nfs/dbraw/zinc/93/76/01/1335937601.db2.gz	TXHFPMJBKQOPJB-KXBFYZLASA-N	0	3	340.467	3.036	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CN(Cc3ccccc3C)CC[C@H]2C)nc1	ZINC000968549916	1335960096	/nfs/dbraw/zinc/96/00/96/1335960096.db2.gz	ZZFSCMWJUKKOTC-UTKZUKDTSA-N	0	3	347.462	3.012	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccsc2C(F)F)C1	ZINC000968598338	1335978834	/nfs/dbraw/zinc/97/88/34/1335978834.db2.gz	DCUUOGSNNCJICJ-DGCLKSJQSA-N	0	3	326.412	3.149	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2cc(OC)c(C)c(OC)c2)C1	ZINC000968624691	1335988282	/nfs/dbraw/zinc/98/82/82/1335988282.db2.gz	YFCIXOLZWMDYAH-WMLDXEAASA-N	0	3	346.471	3.029	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](C)[C@@H](NC(=O)c2scnc2Cl)C1	ZINC000968651043	1335995905	/nfs/dbraw/zinc/99/59/05/1335995905.db2.gz	COAFSRIRCNECDB-NEPJUHHUSA-N	0	3	327.881	3.203	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)C(C)(C)c2ccc(OC)cc2)C1	ZINC000968665022	1336001792	/nfs/dbraw/zinc/00/17/92/1336001792.db2.gz	LVUJJERDROTULE-LPHOPBHVSA-N	0	3	344.499	3.376	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2ccc(OCC3CC3)cc2)C1	ZINC000968669323	1336003631	/nfs/dbraw/zinc/00/36/31/1336003631.db2.gz	LFHZYPYFHXXRPC-JXFKEZNVSA-N	0	3	342.483	3.492	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2cnc(C(C)(C)C)s2)C1	ZINC000968681602	1336008986	/nfs/dbraw/zinc/00/89/86/1336008986.db2.gz	KKRQBQMRUICRFS-KBPBESRZSA-N	0	3	335.517	3.457	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccc(-c3ccccc3)[nH]2)C1	ZINC000968695384	1336014913	/nfs/dbraw/zinc/01/49/13/1336014913.db2.gz	OEXZDSOLMONTDX-OXQOHEQNSA-N	0	3	335.451	3.145	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cn(-c2ccccc2)cn1	ZINC000968866136	1336071916	/nfs/dbraw/zinc/07/19/16/1336071916.db2.gz	BNXNEKFZYFHSRZ-GOSISDBHSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1sccc1CN(C)C	ZINC000968877313	1336076743	/nfs/dbraw/zinc/07/67/43/1336076743.db2.gz	TURWJYIIPHJVBM-KRWDZBQOSA-N	0	3	349.544	3.360	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cncn1-c1ccccc1	ZINC000968890277	1336081525	/nfs/dbraw/zinc/08/15/25/1336081525.db2.gz	FUZWYEJKNPUOFT-SFHVURJKSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)[C@H]1CCc2ccc(F)cc2O1	ZINC000968952655	1336101390	/nfs/dbraw/zinc/10/13/90/1336101390.db2.gz	VUKHNMOHKFVADQ-ZWKOTPCHSA-N	0	3	346.446	3.066	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccc2nc(C)n(C)c2c1	ZINC000968973193	1336105909	/nfs/dbraw/zinc/10/59/09/1336105909.db2.gz	DNASTYKLCWWHNF-KRWDZBQOSA-N	0	3	340.471	3.042	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1ccc2c(c1)[C@@H](C)CO2	ZINC000968998529	1336114878	/nfs/dbraw/zinc/11/48/78/1336114878.db2.gz	YRWNUQLQDYIGRC-FUHWJXTLSA-N	0	3	340.467	3.180	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1n[nH]c2c1C[C@H](C)CC2	ZINC000969093736	1336140334	/nfs/dbraw/zinc/14/03/34/1336140334.db2.gz	XGEQRDDXSSATJZ-CVEARBPZSA-N	0	3	344.503	3.085	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccc(COC)c(F)c1	ZINC000969124850	1336151718	/nfs/dbraw/zinc/15/17/18/1336151718.db2.gz	WAXHKTCVWUNVLJ-QGZVFWFLSA-N	0	3	334.435	3.133	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)C1CCC(C(F)F)CC1	ZINC000969133418	1336155564	/nfs/dbraw/zinc/15/55/64/1336155564.db2.gz	LVXPCKKSYJBIMQ-OFLPRAFFSA-N	0	3	340.458	3.442	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1c[nH]c2ccc(C)cc12	ZINC000969158488	1336166319	/nfs/dbraw/zinc/16/63/19/1336166319.db2.gz	KMDUOZIQSSYICY-KRWDZBQOSA-N	0	3	337.467	3.474	20	30		EGEDHN
C[C@H](NC(=O)c1cc(C#N)c[nH]1)C1CN(Cc2ccc(C3CC3)cc2)C1	ZINC000969461827	1336214043	/nfs/dbraw/zinc/21/40/43/1336214043.db2.gz	BKXIMOMJJHYJCC-AWEZNQCLSA-N	0	3	348.450	3.014	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3ccc(F)c(C#N)c3)C2)CC1	ZINC000969830161	1336251962	/nfs/dbraw/zinc/25/19/62/1336251962.db2.gz	FOCIGZDBPCIADN-GOSISDBHSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](NCc2cn(C(C)C)nc2C)C1	ZINC000969831145	1336252235	/nfs/dbraw/zinc/25/22/35/1336252235.db2.gz	BHOGVCFPHNOPOK-IEBWSBKVSA-N	0	3	332.492	3.065	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)c2cc(C)nn2C(CC)CC)C1	ZINC000970001298	1336270705	/nfs/dbraw/zinc/27/07/05/1336270705.db2.gz	QELRXHKFXHPMEO-HNNXBMFYSA-N	0	3	332.492	3.179	20	30		EGEDHN
CC1=CC[C@@](C)(C(=O)N2CC[C@@H](NCc3ccc(C#N)s3)C2)CC1	ZINC000970773139	1336336860	/nfs/dbraw/zinc/33/68/60/1336336860.db2.gz	RDTCYZDDHLZPHP-DNVCBOLYSA-N	0	3	343.496	3.447	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ncoc2-c2ccccc2)CC1	ZINC001005478073	1336358249	/nfs/dbraw/zinc/35/82/49/1336358249.db2.gz	VJUBNDJSHNHGAG-UHFFFAOYSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)C2CCc3ccccc3CC2)CC1	ZINC001005632110	1336385793	/nfs/dbraw/zinc/38/57/93/1336385793.db2.gz	KOQWVRMPEJJKAX-UHFFFAOYSA-N	0	3	326.484	3.290	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccc(C(F)(F)F)cn2)CC1	ZINC001005795075	1336402791	/nfs/dbraw/zinc/40/27/91/1336402791.db2.gz	JAURXVVLPBLRDS-UHFFFAOYSA-N	0	3	341.377	3.213	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2ccc(OCC(C)C)cc2)CC1	ZINC001006371104	1336496935	/nfs/dbraw/zinc/49/69/35/1336496935.db2.gz	WAVGEJUGWAEJSY-UHFFFAOYSA-N	0	3	330.472	3.444	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)[C@@]2(C)CCc3ccccc3C2)CC1	ZINC001006489399	1336516296	/nfs/dbraw/zinc/51/62/96/1336516296.db2.gz	OGIGIUCGEPHKSI-NRFANRHFSA-N	0	3	326.484	3.290	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CCCN(Cc3ccccc3CC)C2)c1	ZINC001008468850	1336864865	/nfs/dbraw/zinc/86/48/65/1336864865.db2.gz	NNJIFMKZVTVMHT-OAQYLSRUSA-N	0	3	347.462	3.020	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)Cn2cc(C)c3ccccc32)C1	ZINC001008837265	1336932880	/nfs/dbraw/zinc/93/28/80/1336932880.db2.gz	ZYADKJSCTKQRRO-QGZVFWFLSA-N	0	3	325.456	3.106	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2cnn(C3CCCCC3)c2)C1	ZINC001009117515	1336971612	/nfs/dbraw/zinc/97/16/12/1336971612.db2.gz	REYWNQLPBGYLCQ-QGZVFWFLSA-N	0	3	330.476	3.159	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCN(Cc3cc(C)ccc3C)C2)cn1	ZINC001009268842	1336994146	/nfs/dbraw/zinc/99/41/46/1336994146.db2.gz	LIFQCUXWLKYVLM-NRFANRHFSA-N	0	3	347.462	3.074	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN([C@@H](C)c3ccccc3)C2)cn1	ZINC001009276356	1336995852	/nfs/dbraw/zinc/99/58/52/1336995852.db2.gz	OIBVIEOQSDNYHS-OXJNMPFZSA-N	0	3	333.435	3.018	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H](NC(=O)c2cc(F)c(F)c(F)c2F)C1	ZINC001009299452	1337001567	/nfs/dbraw/zinc/00/15/67/1337001567.db2.gz	HZPIGDKEFCMFGI-LLVKDONJSA-N	0	3	344.352	3.403	20	30		EGEDHN
N#Cc1cc(C(=O)N[C@@H]2CCN(Cc3ccc4ccccc4c3)C2)c[nH]1	ZINC001010694900	1337242145	/nfs/dbraw/zinc/24/21/45/1337242145.db2.gz	CEXKDMGJALMQLQ-LJQANCHMSA-N	0	3	344.418	3.044	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3ccc4cc[nH]c4c3)C2)cc1	ZINC001015482347	1338155489	/nfs/dbraw/zinc/15/54/89/1338155489.db2.gz	MMOAWFHPSSWOLW-FQEVSTJZSA-N	0	3	343.430	3.154	20	30		EGEDHN
C[C@@H](C(=O)N[C@H]1CC12CCN(Cc1cccc(C#N)c1)CC2)C1CC1	ZINC001016566092	1338649450	/nfs/dbraw/zinc/64/94/50/1338649450.db2.gz	RTTJUZFSTOQACF-BEFAXECRSA-N	0	3	337.467	3.075	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cc(C)ccc2C2CC2)CC1	ZINC001016748677	1338711083	/nfs/dbraw/zinc/71/10/83/1338711083.db2.gz	LLQKQOFVYMBELL-HXUWFJFHSA-N	0	3	336.479	3.480	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CC23CCN(Cc2cnc(C)s2)CC3)C1	ZINC001016811853	1338734710	/nfs/dbraw/zinc/73/47/10/1338734710.db2.gz	GORMVUIXHVJWSE-MRXNPFEDSA-N	0	3	345.512	3.279	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC23CCN(Cc2cccnc2C)CC3)C1	ZINC001016811286	1338734817	/nfs/dbraw/zinc/73/48/17/1338734817.db2.gz	CGCZNTZDAXTCBK-SFHVURJKSA-N	0	3	339.483	3.217	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2ccccc2O[C@@H](C)CC)CC1	ZINC001016854034	1338747866	/nfs/dbraw/zinc/74/78/66/1338747866.db2.gz	SRZAEERRFBZJDN-QFBILLFUSA-N	0	3	340.467	3.081	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)[C@H](C)c2ccc(CC)cc2)CC1	ZINC001016880315	1338757803	/nfs/dbraw/zinc/75/78/03/1338757803.db2.gz	SHUVMRYZVHRLQQ-YLJYHZDGSA-N	0	3	338.495	3.347	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)C[C@H]2CCc3ccccc32)CC1	ZINC001016886648	1338759317	/nfs/dbraw/zinc/75/93/17/1338759317.db2.gz	SYIUMMRFQPANJQ-UYAOXDASSA-N	0	3	336.479	3.101	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cc(C(C)C)oc2C)CC1	ZINC001016907453	1338766136	/nfs/dbraw/zinc/76/61/36/1338766136.db2.gz	RUTOAZWMOGWRRU-GOSISDBHSA-N	0	3	328.456	3.319	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccc3ccccc3c2)CC1	ZINC001016946139	1338779631	/nfs/dbraw/zinc/77/96/31/1338779631.db2.gz	ISFJXZCZIXORHD-HXUWFJFHSA-N	0	3	332.447	3.447	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cc(CC)c(C)s2)CC1	ZINC001016965708	1338786268	/nfs/dbraw/zinc/78/62/68/1338786268.db2.gz	RGIXBKQWXVAHSA-QGZVFWFLSA-N	0	3	330.497	3.227	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cc3cc(C)ccc3o2)CC1	ZINC001016983105	1338792019	/nfs/dbraw/zinc/79/20/19/1338792019.db2.gz	ORGZWWZMVSNDTD-IBGZPJMESA-N	0	3	336.435	3.349	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cnc(C(C)(C)C)s2)CC1	ZINC001016984022	1338792515	/nfs/dbraw/zinc/79/25/15/1338792515.db2.gz	BBPCQGNRSKBXGD-HNNXBMFYSA-N	0	3	345.512	3.048	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCCN(C(=O)c2ccco2)C1	ZINC001017025559	1338815708	/nfs/dbraw/zinc/81/57/08/1338815708.db2.gz	IEYWQRQWJLCDNV-CQSZACIVSA-N	0	3	343.452	3.197	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@@H](CN(C)Cc2ccccc2Cl)C1	ZINC001017071321	1338848208	/nfs/dbraw/zinc/84/82/08/1338848208.db2.gz	LEHZRMUOGIGJQV-CABCVRRESA-N	0	3	333.863	3.170	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H](CN(C)Cc2cnc(C)nc2)C1	ZINC001017178894	1338922405	/nfs/dbraw/zinc/92/24/05/1338922405.db2.gz	BYMMLBYAEPUKFI-QGZVFWFLSA-N	0	3	344.503	3.058	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H](CN(C)Cc2cnoc2C)C1	ZINC001017179679	1338923468	/nfs/dbraw/zinc/92/34/68/1338923468.db2.gz	MGSDXNHJTRHKQP-MRXNPFEDSA-N	0	3	333.476	3.256	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H]1CCC[C@@H](OC)C1	ZINC001017605709	1339376345	/nfs/dbraw/zinc/37/63/45/1339376345.db2.gz	JHUSJYYSGLVJPP-AKHDSKFASA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@H](C)c1ccncc1	ZINC001017654148	1339383992	/nfs/dbraw/zinc/38/39/92/1339383992.db2.gz	ASFBOKPNOGUAML-YTQUADARSA-N	0	3	327.472	3.217	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc2cnccc2c1	ZINC001017729721	1339406182	/nfs/dbraw/zinc/40/61/82/1339406182.db2.gz	JDHCVBMGRLMTDK-OYRHEFFESA-N	0	3	349.478	3.419	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1COc2cc(C)c(C)cc21	ZINC001017768733	1339414760	/nfs/dbraw/zinc/41/47/60/1339414760.db2.gz	HJFNTEWZIGRLFA-SCTDSRPQSA-N	0	3	340.467	3.031	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)COc1ccc(Cl)cc1	ZINC001018229529	1339541332	/nfs/dbraw/zinc/54/13/32/1339541332.db2.gz	JAWGBFJEGNQFFA-CALCHBBNSA-N	0	3	348.874	3.360	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1c(Cl)cncc1Cl	ZINC001028110797	1340432981	/nfs/dbraw/zinc/43/29/81/1340432981.db2.gz	KXBYDMQYXGBVSS-NSHDSACASA-N	0	3	328.243	3.159	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1cc(C)oc1C(F)(F)F	ZINC001028172756	1340466348	/nfs/dbraw/zinc/46/63/48/1340466348.db2.gz	KVWTWUVSQAVEPP-LBPRGKRZSA-N	0	3	330.350	3.377	20	30		EGEDHN
C#CCCN1CCC[C@H]1CNC(=O)c1ccc(-c2cccs2)o1	ZINC001028293374	1340542909	/nfs/dbraw/zinc/54/29/09/1340542909.db2.gz	JFLIMRLUGNIBJV-AWEZNQCLSA-N	0	3	328.437	3.226	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1ccc(OC2CCC2)cc1	ZINC001028329910	1340568298	/nfs/dbraw/zinc/56/82/98/1340568298.db2.gz	VHZPGUUAVRDUPU-QGZVFWFLSA-N	0	3	328.456	3.388	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1ccc(N(C)CCC)cc1	ZINC001028349540	1340588504	/nfs/dbraw/zinc/58/85/04/1340588504.db2.gz	OOXSPLDLHNONNC-LJQANCHMSA-N	0	3	329.488	3.303	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](CNC(=O)c3ccoc3Cl)C2)cc1	ZINC001028508315	1340677507	/nfs/dbraw/zinc/67/75/07/1340677507.db2.gz	PBECKHUOIQFTGW-OAHLLOKOSA-N	0	3	343.814	3.057	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NC[C@H]1CCN(C[C@@H](F)CC)C1	ZINC001028637609	1340738757	/nfs/dbraw/zinc/73/87/57/1340738757.db2.gz	SSULUPOAAWVXJU-CVEARBPZSA-N	0	3	334.435	3.051	20	30		EGEDHN
C=Cc1ccc(C(=O)NC[C@@H]2CCN(Cc3ccc(C#N)cc3)C2)cc1	ZINC001028822025	1340836435	/nfs/dbraw/zinc/83/64/35/1340836435.db2.gz	KNXLTTQNZZDBJW-FQEVSTJZSA-N	0	3	345.446	3.453	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC([C@H](C)NCc2ccccc2C#N)CC1	ZINC001029078262	1340925154	/nfs/dbraw/zinc/92/51/54/1340925154.db2.gz	NSOXFRDJSPHEKL-SSTBGOPISA-N	0	3	325.456	3.241	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC([C@@H](C)NCc3cc(C)no3)CC2)CC1	ZINC001029136189	1340939565	/nfs/dbraw/zinc/93/95/65/1340939565.db2.gz	BAEDXGFFVZKMLI-MRXNPFEDSA-N	0	3	345.487	3.446	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC([C@H](C)NCc2cc(C)no2)CC1	ZINC001029136614	1340939722	/nfs/dbraw/zinc/93/97/22/1340939722.db2.gz	JLTQKRSKPSTPED-HNAYVOBHSA-N	0	3	333.476	3.302	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC([C@H](C)NCc2cnc(C)cn2)CC1	ZINC001029139224	1340940496	/nfs/dbraw/zinc/94/04/96/1340940496.db2.gz	ATLGPVSPKZEKRW-JXFKEZNVSA-N	0	3	344.503	3.104	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC([C@@H](C)NCc2ccn(CC)n2)CC1	ZINC001029140167	1340940921	/nfs/dbraw/zinc/94/09/21/1340940921.db2.gz	RKDRODVQXLCLJY-OXQOHEQNSA-N	0	3	346.519	3.222	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)C1CCN(C(=O)C2(CF)CC2)CC1	ZINC001029143577	1340942037	/nfs/dbraw/zinc/94/20/37/1340942037.db2.gz	LRQSCNQDKNRMDA-OAHLLOKOSA-N	0	3	343.446	3.025	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@H]2CC[C@@H](C1)N2CC1CC(F)(F)C1	ZINC001029322970	1340971897	/nfs/dbraw/zinc/97/18/97/1340971897.db2.gz	JXOYBIPPQACGAO-OKILXGFUSA-N	0	3	346.849	3.486	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CC[C@@H](C1)N2C[C@H](OC)C1CCCC1	ZINC001029419421	1340986015	/nfs/dbraw/zinc/98/60/15/1340986015.db2.gz	BADLMKNZCUREQC-OTWHNJEPSA-N	0	3	348.531	3.469	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CC[C@@H](C1)N2C[C@H]1CCC(F)(F)C1	ZINC001029422162	1340986668	/nfs/dbraw/zinc/98/66/68/1340986668.db2.gz	XBCODBJWIBKWQY-SOUVJXGZSA-N	0	3	326.431	3.309	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N1C[C@H]2CC[C@@H](C1)N2[C@H](C)c1ccccc1	ZINC001029482180	1340998858	/nfs/dbraw/zinc/99/88/58/1340998858.db2.gz	YMEIKNJFDXWOAJ-PKOFMYQESA-N	0	3	340.467	3.014	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCN(C(=O)[C@@H]2CC=CCC2)C1	ZINC001029644787	1341031560	/nfs/dbraw/zinc/03/15/60/1341031560.db2.gz	DXNNPQLEHJMFPV-JKSUJKDBSA-N	0	3	343.496	3.256	20	30		EGEDHN
C[C@@H](c1ccccc1F)N(C)C[C@H]1CCN(C(=O)C#CC2CC2)C1	ZINC001029732774	1341056911	/nfs/dbraw/zinc/05/69/11/1341056911.db2.gz	BYDPKFFYLSCEGO-DOTOQJQBSA-N	0	3	328.431	3.080	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@H](CN(C)Cc2ccc(C#N)s2)C1)C1CCC1	ZINC001029766417	1341066047	/nfs/dbraw/zinc/06/60/47/1341066047.db2.gz	AKLUGNNKMCWGCX-LSDHHAIUSA-N	0	3	345.512	3.336	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](CN(C)Cc2oc(C)nc2C)C1	ZINC001029799571	1341076593	/nfs/dbraw/zinc/07/65/93/1341076593.db2.gz	AMUQFUSKEHVMON-MRXNPFEDSA-N	0	3	333.476	3.174	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001029801435	1341077316	/nfs/dbraw/zinc/07/73/16/1341077316.db2.gz	MPYKZFPMYOUEAG-CQSZACIVSA-N	0	3	331.485	3.112	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](CN(C)[C@@H](C)c3cnccn3)C2)CC1	ZINC001029825358	1341086936	/nfs/dbraw/zinc/08/69/36/1341086936.db2.gz	CENDPFMZWMAVKG-IRXDYDNUSA-N	0	3	342.487	3.064	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](CN(C)Cc2c(C)onc2CC)C1	ZINC001029826796	1341088018	/nfs/dbraw/zinc/08/80/18/1341088018.db2.gz	VWZQDMOCIKZBIJ-OXJNMPFZSA-N	0	3	347.503	3.428	20	30		EGEDHN
C=CCN1CCC[C@@H](N(Cc2ccccc2)C(=O)c2cnc(C)[nH]2)C1	ZINC001029917809	1341118215	/nfs/dbraw/zinc/11/82/15/1341118215.db2.gz	QANMWNZNWNOUQC-GOSISDBHSA-N	0	3	338.455	3.011	20	30		EGEDHN
C#CCCN1CCC[C@@H](N(Cc2ccccc2)C(=O)[C@H]2CC2(F)F)C1	ZINC001029919998	1341119533	/nfs/dbraw/zinc/11/95/33/1341119533.db2.gz	LWUAJKSRNWEHQX-QZTJIDSGSA-N	0	3	346.421	3.158	20	30		EGEDHN
C#Cc1ccc(C(=O)NCC2CN([C@H](C)c3cccc(C)c3)C2)cc1	ZINC001031892114	1341417626	/nfs/dbraw/zinc/41/76/26/1341417626.db2.gz	NCLDLBRLKIDMDT-QGZVFWFLSA-N	0	3	332.447	3.399	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1nsc2ccccc21	ZINC001032418986	1341507548	/nfs/dbraw/zinc/50/75/48/1341507548.db2.gz	NHHBYBSBSLGUQF-KBPBESRZSA-N	0	3	327.453	3.161	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(C)nc1C1CC1	ZINC001032544152	1341536692	/nfs/dbraw/zinc/53/66/92/1341536692.db2.gz	GVIXTEKSVHLXHH-IRXDYDNUSA-N	0	3	325.456	3.132	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccccc1-n1cccc1	ZINC001032602291	1341554389	/nfs/dbraw/zinc/55/43/89/1341554389.db2.gz	MRSSCJAMZDUSRQ-ROUUACIJSA-N	0	3	335.451	3.342	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H](CC)Oc1ccccc1C	ZINC001032657383	1341572406	/nfs/dbraw/zinc/57/24/06/1341572406.db2.gz	JVAUVFKSZDFQKN-FHWLQOOXSA-N	0	3	342.483	3.404	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C1(c2cccc(F)c2)CC1	ZINC001032662863	1341575125	/nfs/dbraw/zinc/57/51/25/1341575125.db2.gz	YFEWLCMJFBFKII-ROUUACIJSA-N	0	3	328.431	3.109	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cccc(-c2cnco2)c1	ZINC001032711400	1341587388	/nfs/dbraw/zinc/58/73/88/1341587388.db2.gz	UTVSXTOVNHMNSX-ROUUACIJSA-N	0	3	337.423	3.207	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cnn(C2CCCC2)c1C	ZINC001032722775	1341591832	/nfs/dbraw/zinc/59/18/32/1341591832.db2.gz	DCXXJVBQXCOVNG-ROUUACIJSA-N	0	3	342.487	3.172	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@]1(C)CCc2ccccc2C1	ZINC001032824155	1341627750	/nfs/dbraw/zinc/62/77/50/1341627750.db2.gz	SFANAFMSIVYCRS-JAXLGGSGSA-N	0	3	338.495	3.433	20	30		EGEDHN
C=CCCN1CC[C@@H](N(C)C(=O)c2oc3ccccc3c2OC)C1	ZINC001033319855	1341779984	/nfs/dbraw/zinc/77/99/84/1341779984.db2.gz	GMKSMOQPUAPPFZ-CQSZACIVSA-N	0	3	328.412	3.164	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)[C@@H]2C[C@H]2c2c(F)cccc2F)C1	ZINC001033406325	1341816816	/nfs/dbraw/zinc/81/68/16/1341816816.db2.gz	VMMCSUNUCGLWKY-RBSFLKMASA-N	0	3	334.410	3.177	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2nsc3ccccc32)C1	ZINC001033841672	1342037344	/nfs/dbraw/zinc/03/73/44/1342037344.db2.gz	YCYABZGGPGVCSH-CQSZACIVSA-N	0	3	329.469	3.409	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2ccc(OC)c(C(C)C)c2)C1	ZINC001033885603	1342058718	/nfs/dbraw/zinc/05/87/18/1342058718.db2.gz	VCFAXFOLVIALJL-SFHVURJKSA-N	0	3	342.483	3.378	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@@H]2CCc3ccc(F)cc3O2)C1	ZINC001033901913	1342074478	/nfs/dbraw/zinc/07/44/78/1342074478.db2.gz	SSBWSDVGSIJUGX-MSOLQXFVSA-N	0	3	346.446	3.018	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)[C@@H]2CCc3c2cccc3Cl)C1	ZINC001033902820	1342075814	/nfs/dbraw/zinc/07/58/14/1342075814.db2.gz	SBFMCHYHTHBKEG-CRAIPNDOSA-N	0	3	344.886	3.316	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cc3cc(F)ccc3[nH]2)C1	ZINC001033916119	1342085958	/nfs/dbraw/zinc/08/59/58/1342085958.db2.gz	LBUNITURVBTBKO-MRXNPFEDSA-N	0	3	329.419	3.420	20	30		EGEDHN
C=CCCN1CC[C@@H](N(CC)C(=O)c2oc(CC(C)C)nc2C)C1	ZINC001033978628	1342126788	/nfs/dbraw/zinc/12/67/88/1342126788.db2.gz	AWXSJMGQBVZNOY-MRXNPFEDSA-N	0	3	333.476	3.294	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccc3c(c2)C[C@@H](C)O3)C1	ZINC001033991754	1342134139	/nfs/dbraw/zinc/13/41/39/1342134139.db2.gz	LNEFPGRYICKACG-QAPCUYQASA-N	0	3	328.456	3.123	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2csc(C(C)(C)C)n2)C1	ZINC001033992322	1342134752	/nfs/dbraw/zinc/13/47/52/1342134752.db2.gz	QNSYURFIXPYYRT-AWEZNQCLSA-N	0	3	333.501	3.000	20	30		EGEDHN
C#Cc1ccc(C(=O)N(CC)[C@@H]2CCN(Cc3cccc(C)c3)C2)cn1	ZINC001034022400	1342159826	/nfs/dbraw/zinc/15/98/26/1342159826.db2.gz	HRMFFTUEVBKLAP-OAQYLSRUSA-N	0	3	347.462	3.108	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2coc3ccc(F)cc23)C1	ZINC001034027383	1342166037	/nfs/dbraw/zinc/16/60/37/1342166037.db2.gz	BTGLPVVYWZRVMI-OAHLLOKOSA-N	0	3	328.387	3.132	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccc(OC)c(Cl)c2)C1	ZINC001034040046	1342180107	/nfs/dbraw/zinc/18/01/07/1342180107.db2.gz	QSURRUSESKACLL-HNNXBMFYSA-N	0	3	336.863	3.461	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2csc([C@H](C)OC)n2)C1	ZINC001034212637	1342321339	/nfs/dbraw/zinc/32/13/39/1342321339.db2.gz	ZJPAXDREXYQPIR-UONOGXRCSA-N	0	3	337.489	3.011	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@H]2CCCN2c2ccccc2)C1	ZINC001034239688	1342340249	/nfs/dbraw/zinc/34/02/49/1342340249.db2.gz	AFQKCDXDXDKTJW-AZUAARDMSA-N	0	3	341.499	3.202	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@@H]2CCc3ccc(OC)cc32)C1	ZINC001034244440	1342344180	/nfs/dbraw/zinc/34/41/80/1342344180.db2.gz	BDZBXGYCYWMWAE-IEBWSBKVSA-N	0	3	342.483	3.272	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@H]2CCN(C)c3ccccc32)C1	ZINC001034247884	1342345923	/nfs/dbraw/zinc/34/59/23/1342345923.db2.gz	VSPSGOLJGAXYLF-HKUYNNGSSA-N	0	3	341.499	3.157	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)C2([C@H]3CCCCO3)CCC2)C1	ZINC001034305540	1342388766	/nfs/dbraw/zinc/38/87/66/1342388766.db2.gz	ABFLCZUVLHBRSM-ZWKOTPCHSA-N	0	3	334.504	3.273	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@H]2CCc3cc(C)ccc3O2)C1	ZINC001034311100	1342392314	/nfs/dbraw/zinc/39/23/14/1342392314.db2.gz	ZAVYHSKREJLCHY-UYAOXDASSA-N	0	3	342.483	3.235	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)C2(c3ccc(F)cc3)CCC2)C1	ZINC001034338971	1342412715	/nfs/dbraw/zinc/41/27/15/1342412715.db2.gz	RRQPNAFKFKONSY-SFHVURJKSA-N	0	3	330.447	3.404	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2ccc(-c3ccccc3)nc2)C1	ZINC001034462775	1342518699	/nfs/dbraw/zinc/51/86/99/1342518699.db2.gz	VTSGHJZYLXSCSL-FQEVSTJZSA-N	0	3	347.462	3.356	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cccc(N3CCCC3)c2)C1	ZINC001034463363	1342519670	/nfs/dbraw/zinc/51/96/70/1342519670.db2.gz	SQZRJYRQTOFNGE-LJQANCHMSA-N	0	3	341.499	3.447	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)C2(c3cc(C)cc(C)c3)CC2)C1	ZINC001034537762	1342594813	/nfs/dbraw/zinc/59/48/13/1342594813.db2.gz	KXACCPGKMZLQQG-LJQANCHMSA-N	0	3	326.484	3.492	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)Cc2cccc(OC(C)C)c2)C1	ZINC001034545495	1342606424	/nfs/dbraw/zinc/60/64/24/1342606424.db2.gz	UGWIIYXBAHTGMX-GOSISDBHSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2[nH]c3ccccc3c2OC)C1	ZINC001034546121	1342609426	/nfs/dbraw/zinc/60/94/26/1342609426.db2.gz	GSUPWSCWJUZYFQ-OAHLLOKOSA-N	0	3	341.455	3.337	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cc(NC(C)=O)ccc2C)C1	ZINC001034552182	1342614717	/nfs/dbraw/zinc/61/47/17/1342614717.db2.gz	ZUYBCPDPTIHHOS-SFHVURJKSA-N	0	3	343.471	3.114	20	30		EGEDHN
C[C@H](C(=O)N[C@H]1CC[C@H](NCc2ccccc2C#N)CC1)C1CC1	ZINC001034615147	1342649161	/nfs/dbraw/zinc/64/91/61/1342649161.db2.gz	GZMMOPGXTIXRJQ-JVPBZIDWSA-N	0	3	325.456	3.121	20	30		EGEDHN
Cc1cc(C(=O)N[C@H]2CC[C@H](NCc3ccccc3C#N)CC2)co1	ZINC001034633083	1342662640	/nfs/dbraw/zinc/66/26/40/1342662640.db2.gz	SGYUJWPCORTVBQ-WGSAOQKQSA-N	0	3	337.423	3.291	20	30		EGEDHN
CC1(C(=O)N[C@H]2CC[C@H](NCc3cc(F)ccc3C#N)CC2)CCC1	ZINC001034709401	1342705596	/nfs/dbraw/zinc/70/55/96/1342705596.db2.gz	HBMAWGNCLKISIP-IYARVYRRSA-N	0	3	343.446	3.405	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2ccc(N(C)C)cc2)C12CCC2	ZINC001078795546	1357088892	/nfs/dbraw/zinc/08/88/92/1357088892.db2.gz	RSRAJLJILCVPGL-SJORKVTESA-N	0	3	347.890	3.136	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)c2cccs2)s1	ZINC001034850012	1342802644	/nfs/dbraw/zinc/80/26/44/1342802644.db2.gz	UOUVZEFYFGTKQN-GFCCVEGCSA-N	0	3	331.466	3.076	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc(C3CC3)cn2)C12CCC2	ZINC001078798588	1357090696	/nfs/dbraw/zinc/09/06/96/1357090696.db2.gz	QUFUEGKSTBEHNY-IRXDYDNUSA-N	0	3	345.874	3.342	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCC[C@@H]1CNCc1ccccc1F	ZINC001034958020	1342852767	/nfs/dbraw/zinc/85/27/67/1342852767.db2.gz	UVDPZKRAQWUTAU-QGZVFWFLSA-N	0	3	341.430	3.208	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@@H]2CNCc2cncc(C)c2)CC1	ZINC001035039268	1342892753	/nfs/dbraw/zinc/89/27/53/1342892753.db2.gz	HFHAQEPEFCTVHX-LJQANCHMSA-N	0	3	327.472	3.217	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]2CNCc2cccc(Cl)n2)C1	ZINC001035041145	1342893168	/nfs/dbraw/zinc/89/31/68/1342893168.db2.gz	JIYXBTMHGWYRMG-OAHLLOKOSA-N	0	3	333.863	3.172	20	30		EGEDHN
CC(C)CC(=O)N1CCC2(CCN(Cc3ccccc3C#N)C2)CC1	ZINC001035150399	1342963288	/nfs/dbraw/zinc/96/32/88/1342963288.db2.gz	XIDCOGAANAHEBI-UHFFFAOYSA-N	0	3	339.483	3.419	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C[C@H]1CCC(F)(F)C1)CC2	ZINC001035718613	1343150248	/nfs/dbraw/zinc/15/02/48/1343150248.db2.gz	OGIDXVSODHIACS-OAHLLOKOSA-N	0	3	326.431	3.312	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cc1cccc3cnccc31)CC2	ZINC001035732192	1343158491	/nfs/dbraw/zinc/15/84/91/1343158491.db2.gz	WRKNWJIGRWBEIF-UHFFFAOYSA-N	0	3	349.478	3.278	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1CCC2(CN(CC(=C)C)C2)CC1	ZINC001035734297	1343160725	/nfs/dbraw/zinc/16/07/25/1343160725.db2.gz	BQNAQFBJLIVWTR-UHFFFAOYSA-N	0	3	340.467	3.366	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@@H]1[C@H](C=C(C)C)C1(C)C)CC2	ZINC001035747084	1343166931	/nfs/dbraw/zinc/16/69/31/1343166931.db2.gz	JHYXIKZOSYLABO-ROUUACIJSA-N	0	3	328.500	3.173	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C[C@@H]1CCCC1(F)F)CC2	ZINC001035775514	1343186513	/nfs/dbraw/zinc/18/65/13/1343186513.db2.gz	FAIKLVJRERZOLQ-HNNXBMFYSA-N	0	3	326.431	3.312	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@H](CC)OC1CCCC1)CC2	ZINC001035807556	1343208078	/nfs/dbraw/zinc/20/80/78/1343208078.db2.gz	QKSWYJDDNOIXLQ-SFHVURJKSA-N	0	3	334.504	3.225	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)C[C@H](C)c1ccccc1C)CC2	ZINC001035814282	1343212273	/nfs/dbraw/zinc/21/22/73/1343212273.db2.gz	ZTVKJWUEAMUDKJ-IBGZPJMESA-N	0	3	338.495	3.436	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccc(C(F)F)cc1)CC2	ZINC001035820057	1343214493	/nfs/dbraw/zinc/21/44/93/1343214493.db2.gz	SDZZHFMULDVMQH-UHFFFAOYSA-N	0	3	332.394	3.186	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H](c1cccnc1)C(C)C)CC2	ZINC001035824300	1343215884	/nfs/dbraw/zinc/21/58/84/1343215884.db2.gz	YGUOHQXSDZUUEW-LJQANCHMSA-N	0	3	341.499	3.322	20	30		EGEDHN
C[C@H]1CN(C(=O)c2ccccc2)CC[C@H]1NCc1ccccc1C#N	ZINC001035885939	1343248670	/nfs/dbraw/zinc/24/86/70/1343248670.db2.gz	CXNNCTVLBJWKOV-OXJNMPFZSA-N	0	3	333.435	3.199	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@H](NCc2cc(F)ccc2C#N)[C@H](C)C1	ZINC001035907373	1343263099	/nfs/dbraw/zinc/26/30/99/1343263099.db2.gz	KVVHAUHLTYTKMV-KDOFPFPSSA-N	0	3	331.435	3.070	20	30		EGEDHN
Cc1occc1C(=O)N1CC[C@@H](NCc2ccccc2C#N)[C@H](C)C1	ZINC001035908439	1343264713	/nfs/dbraw/zinc/26/47/13/1343264713.db2.gz	HCEKIKLUARMSCJ-AUUYWEPGSA-N	0	3	337.423	3.100	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](NCc2cc(C3CC3)no2)[C@@H](C)C1	ZINC001036144541	1343326996	/nfs/dbraw/zinc/32/69/96/1343326996.db2.gz	SWQQFDISHUORCP-BBRMVZONSA-N	0	3	331.460	3.091	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3cscn3)[C@H](C)C2)CC1	ZINC001036163555	1343338520	/nfs/dbraw/zinc/33/85/20/1343338520.db2.gz	LMCXORQTBDKWQC-PBHICJAKSA-N	0	3	333.501	3.216	20	30		EGEDHN
C[C@@H]1CN(C(=O)C(C)(C)C(F)F)CC[C@H]1NCc1ccccc1C#N	ZINC001036167686	1343340601	/nfs/dbraw/zinc/34/06/01/1343340601.db2.gz	BQTUJUCDDCZBTC-CZUORRHYSA-N	0	3	349.425	3.176	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCCN(C(=O)C2CCCC2)C1	ZINC001036356594	1343439456	/nfs/dbraw/zinc/43/94/56/1343439456.db2.gz	JDZIUWFYSVFENU-JXFKEZNVSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H]([C@H](C)NCc2cc(C)n(C)n2)C1	ZINC001036436162	1343486041	/nfs/dbraw/zinc/48/60/41/1343486041.db2.gz	BUDUPVKSTZQEOB-IRXDYDNUSA-N	0	3	346.519	3.048	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]([C@@H](C)NCc3cnc(C)o3)C2)C1	ZINC001036440549	1343488913	/nfs/dbraw/zinc/48/89/13/1343488913.db2.gz	ABVVQMKKURJLGS-GDBMZVCRSA-N	0	3	331.460	3.056	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)C(C)(C)F)[C@@H]1CNCc1ccc(C#N)s1	ZINC001036501680	1343519911	/nfs/dbraw/zinc/51/99/11/1343519911.db2.gz	POTOLUJQGONRFC-IUODEOHRSA-N	0	3	337.464	3.085	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@@H](C)[C@H]1CNCc1ccc(C#N)cc1F	ZINC001036502379	1343520746	/nfs/dbraw/zinc/52/07/46/1343520746.db2.gz	JCHKRXPKFNIMOH-DNVCBOLYSA-N	0	3	343.446	3.380	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)C(C)(C)F)[C@H]1CNCc1ccc(C#N)cc1F	ZINC001036503860	1343521951	/nfs/dbraw/zinc/52/19/51/1343521951.db2.gz	WQWWCLCQCXLLEI-DYVFJYSZSA-N	0	3	349.425	3.162	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccc(F)c(C#N)c2)C1	ZINC001036628230	1343585636	/nfs/dbraw/zinc/58/56/36/1343585636.db2.gz	YCDXAJLCQIGEKS-VQIMIIECSA-N	0	3	341.430	3.086	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@H]2[C@@H](CCN2CC#Cc2ccc(F)cc2)C1	ZINC001036632900	1343590628	/nfs/dbraw/zinc/59/06/28/1343590628.db2.gz	UHSBOEDZJOFKIZ-ICSRJNTNSA-N	0	3	340.442	3.066	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@@H]2[C@@H](CCN2CC#Cc2ccccc2)C1	ZINC001036651803	1343601114	/nfs/dbraw/zinc/60/11/14/1343601114.db2.gz	JTJBZEACDWMVOU-LEWJYISDSA-N	0	3	338.495	3.397	20	30		EGEDHN
C/C(=C\C(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccccc2C#N)C1)C1CC1	ZINC001036658370	1343606012	/nfs/dbraw/zinc/60/60/12/1343606012.db2.gz	HLKLMPJPDJAIFL-VEKUPORPSA-N	0	3	349.478	3.337	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2[C@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001036791679	1343721412	/nfs/dbraw/zinc/72/14/12/1343721412.db2.gz	CKEFXFAAGFKBKX-PBHICJAKSA-N	0	3	343.496	3.255	20	30		EGEDHN
CC1(C(=O)N2CC[C@@H]3[C@H](CCN3Cc3ccc(C#N)s3)C2)CCC1	ZINC001036792660	1343724028	/nfs/dbraw/zinc/72/40/28/1343724028.db2.gz	SHQIKMRQKFUYQX-RHSMWYFYSA-N	0	3	343.496	3.233	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H]3[C@@H](CCN3Cc3cnoc3C)C2)CC1	ZINC001036810514	1343745200	/nfs/dbraw/zinc/74/52/00/1343745200.db2.gz	DQAYDGXIKVRJAU-PKOBYXMFSA-N	0	3	343.471	3.152	20	30		EGEDHN
CC(F)(F)CC(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccccc2C#N)C1	ZINC001036811124	1343746141	/nfs/dbraw/zinc/74/61/41/1343746141.db2.gz	LWQASZHFHOJXGB-IAGOWNOFSA-N	0	3	347.409	3.026	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@H]2[C@@H](CCN2Cc2ccccc2C#N)C1	ZINC001036875493	1343813352	/nfs/dbraw/zinc/81/33/52/1343813352.db2.gz	BJZBVYCVAZSSIF-ROUUACIJSA-N	0	3	325.456	3.027	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@H]1CCC[C@H]1NC(=O)CC1CCC1	ZINC001036971002	1343900212	/nfs/dbraw/zinc/90/02/12/1343900212.db2.gz	VDXAOAHNIQOVOS-VQIMIIECSA-N	0	3	343.446	3.262	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCC[C@H]1NC(=O)C=C1CCC1	ZINC001037200084	1344037185	/nfs/dbraw/zinc/03/71/85/1344037185.db2.gz	ZCMJOTOAWZGDHR-WOJBJXKFSA-N	0	3	337.467	3.433	20	30		EGEDHN
CCCC(=O)N1CC[C@@H](NCc2cc(F)ccc2C#N)[C@H](CC)C1	ZINC001037762519	1344076601	/nfs/dbraw/zinc/07/66/01/1344076601.db2.gz	ACNLRTWTYZAKEF-RDTXWAMCSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NC[C@@H]1CCN1CC1CC(C)C1	ZINC001038427272	1344423838	/nfs/dbraw/zinc/42/38/38/1344423838.db2.gz	GOJCNOBGUYWURI-JCYILVPMSA-N	0	3	328.456	3.102	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1cc(F)c2ncccc2c1	ZINC001038830428	1344600742	/nfs/dbraw/zinc/60/07/42/1344600742.db2.gz	UQMLFOMUXPWQLE-INIZCTEOSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1ccc(OCC(C)C)cc1	ZINC001038986603	1344698528	/nfs/dbraw/zinc/69/85/28/1344698528.db2.gz	UNOWVONSMHCVHP-SFHVURJKSA-N	0	3	330.472	3.492	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C=C2CCCCC2)C[C@H]1c1cccc(F)c1	ZINC001079173622	1357201220	/nfs/dbraw/zinc/20/12/20/1357201220.db2.gz	DIPQTTRPLBMYAP-VQTJNVASSA-N	0	3	340.442	3.233	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)c3cncs3)CC2)C1	ZINC001039120615	1344795791	/nfs/dbraw/zinc/79/57/91/1344795791.db2.gz	FVKFDPUKOSAMMH-CQSZACIVSA-N	0	3	339.892	3.070	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)C2C(C)(C)C2(C)C)C1	ZINC001039201535	1344911100	/nfs/dbraw/zinc/91/11/00/1344911100.db2.gz	ALTUQGZTPMINCK-DLBZAZTESA-N	0	3	330.516	3.395	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)COC2CCCCC2)C1	ZINC001039214586	1344930763	/nfs/dbraw/zinc/93/07/63/1344930763.db2.gz	TWDYOSXYAOECCN-QUCCMNQESA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)CCc2ccc(F)cc2)C1	ZINC001039218447	1344935825	/nfs/dbraw/zinc/93/58/25/1344935825.db2.gz	MFYDDBBLGJBVNF-UYAOXDASSA-N	0	3	342.458	3.095	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccc3ncccc3c2)C1	ZINC001039224497	1344941828	/nfs/dbraw/zinc/94/18/28/1344941828.db2.gz	GSEGQPVKWRZBJF-PZJWPPBQSA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccn(CC)c2C)C1	ZINC001039226677	1344945266	/nfs/dbraw/zinc/94/52/66/1344945266.db2.gz	YUXUAPTXBZGEIN-QUCCMNQESA-N	0	3	341.499	3.156	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2occ3c2CCC3)C1	ZINC001039229916	1344949162	/nfs/dbraw/zinc/94/91/62/1344949162.db2.gz	OZXDLJKJYKSKQL-APWZRJJASA-N	0	3	340.467	3.108	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cncc(Cl)c2)C1	ZINC001039229984	1344949332	/nfs/dbraw/zinc/94/93/32/1344949332.db2.gz	HFFFJHCJOAMRQG-YJBOKZPZSA-N	0	3	345.874	3.075	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)C2CCC(F)(F)CC2)C1	ZINC001039238346	1344962442	/nfs/dbraw/zinc/96/24/42/1344962442.db2.gz	NDSXKMOZXOURJF-SJORKVTESA-N	0	3	338.442	3.148	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cncc3ccccc32)C1	ZINC001039242020	1344967664	/nfs/dbraw/zinc/96/76/64/1344967664.db2.gz	MTQUAZRNFVXTEY-RXVVDRJESA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cccc3cnccc32)C1	ZINC001039243353	1344970128	/nfs/dbraw/zinc/97/01/28/1344970128.db2.gz	UPZQSHCAZKPJOV-WIYYLYMNSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cccc3cnccc32)C1	ZINC001039243347	1344970653	/nfs/dbraw/zinc/97/06/53/1344970653.db2.gz	UPZQSHCAZKPJOV-GHTZIAJQSA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)Cc2ccc(F)cc2)C1	ZINC001039248287	1344978788	/nfs/dbraw/zinc/97/87/88/1344978788.db2.gz	AXXJATVSFQWXQD-UYAOXDASSA-N	0	3	342.458	3.095	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(C(F)F)o2)C1	ZINC001039248942	1344979774	/nfs/dbraw/zinc/97/97/74/1344979774.db2.gz	FUNQRWBEMLGTLO-ZIAGYGMSSA-N	0	3	336.382	3.167	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc3sccc3[nH]2)C1	ZINC001039256531	1344986311	/nfs/dbraw/zinc/98/63/11/1344986311.db2.gz	LAPLBOYJGWVQSC-PBHICJAKSA-N	0	3	341.480	3.179	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(-n2cccc2)cc1	ZINC001039401081	1345047082	/nfs/dbraw/zinc/04/70/82/1345047082.db2.gz	IRIGFDQIOQYXBG-RTWAWAEBSA-N	0	3	347.462	3.180	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C1(c2ccccc2)CCC1	ZINC001039402287	1345048209	/nfs/dbraw/zinc/04/82/09/1345048209.db2.gz	QJSFWZBUAXHNMW-UXHICEINSA-N	0	3	336.479	3.197	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)c1cccc(F)c1	ZINC001039471596	1345087078	/nfs/dbraw/zinc/08/70/78/1345087078.db2.gz	FIJBTOPBQFQEKA-IPELMVKDSA-N	0	3	328.431	3.018	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)Cc1cccc(F)c1	ZINC001039476464	1345091642	/nfs/dbraw/zinc/09/16/42/1345091642.db2.gz	VBRICFDOZCPXPM-AHRSYUTCSA-N	0	3	342.458	3.093	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@]2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001040049571	1345311232	/nfs/dbraw/zinc/31/12/32/1345311232.db2.gz	HDHIYLVEYLRRTC-OAQYLSRUSA-N	0	3	337.467	3.339	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@H]3CCC(C)=C(C)C3)C2)C1	ZINC001040217055	1345379175	/nfs/dbraw/zinc/37/91/75/1345379175.db2.gz	RUMJCFZSZWAMCA-FPOVZHCZSA-N	0	3	328.500	3.461	20	30		EGEDHN
CC1(C(=O)N2CC[C@@]3(C2)CCCN(Cc2cccc(C#N)c2)C3)CC1	ZINC001040220834	1345380310	/nfs/dbraw/zinc/38/03/10/1345380310.db2.gz	MPKGPBGPVYVFFE-NRFANRHFSA-N	0	3	337.467	3.173	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3cccc4ccc(C)nc43)C2)C1	ZINC001040258429	1345399106	/nfs/dbraw/zinc/39/91/06/1345399106.db2.gz	ODTLENGUCRSGFY-JOCHJYFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cc(C)n(CC)c3C)C2)C1	ZINC001040283855	1345411614	/nfs/dbraw/zinc/41/16/14/1345411614.db2.gz	OZLZYDQMBHIQQY-OAQYLSRUSA-N	0	3	341.499	3.076	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@]2(C1)CCCN(Cc1ccccn1)C2	ZINC001040373981	1345460943	/nfs/dbraw/zinc/46/09/43/1345460943.db2.gz	YFALXPJPSKZCMG-LEWJYISDSA-N	0	3	341.499	3.498	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@H](c3ccccc3)C(C)C)C2)C1	ZINC001040417409	1345485977	/nfs/dbraw/zinc/48/59/77/1345485977.db2.gz	FWPRNDDCYDRQRO-RBBKRZOGSA-N	0	3	338.495	3.374	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cc([C@@H](C)CC)no3)C2)C1	ZINC001040434712	1345497554	/nfs/dbraw/zinc/49/75/54/1345497554.db2.gz	KGZQJXCROTUXNM-JXFKEZNVSA-N	0	3	343.471	3.140	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ccc4ccncc4c3)C2)C1	ZINC001040482865	1345515337	/nfs/dbraw/zinc/51/53/37/1345515337.db2.gz	ACXPWTZMDFHQCZ-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3cc(C)c(F)cc3Cl)C2)C1	ZINC001040510016	1345525966	/nfs/dbraw/zinc/52/59/66/1345525966.db2.gz	LJDNXYWZACTKFC-IBGZPJMESA-N	0	3	348.849	3.349	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)Cc3sc(C)cc3C)C2)C1	ZINC001040514907	1345528120	/nfs/dbraw/zinc/52/81/20/1345528120.db2.gz	XMAJAYDHEPDTPG-HXUWFJFHSA-N	0	3	344.524	3.245	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@H]3CC4CCC3CC4)C2)C1	ZINC001040545901	1345540094	/nfs/dbraw/zinc/54/00/94/1345540094.db2.gz	XTNMJQIYIBSPJX-XSNSTOHYSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3ccccc3CC(C)C)C2)C1	ZINC001040547184	1345541085	/nfs/dbraw/zinc/54/10/85/1345541085.db2.gz	JJJXCHMBIMZAPM-JOCHJYFZSA-N	0	3	338.495	3.446	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)C[C@@H]3CCC(F)(F)C3)C2)CC1	ZINC001040725087	1345571204	/nfs/dbraw/zinc/57/12/04/1345571204.db2.gz	XDRWLNNNQNHSBO-INIZCTEOSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccc(C)c(F)c3)C2)CC1	ZINC001040765465	1345576773	/nfs/dbraw/zinc/57/67/73/1345576773.db2.gz	KMJBIZWVKQLNPR-UHFFFAOYSA-N	0	3	328.431	3.086	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3c(C)cc(F)cc3C)C2)CC1	ZINC001040800320	1345579360	/nfs/dbraw/zinc/57/93/60/1345579360.db2.gz	HTGIDAYXZCAUSU-UHFFFAOYSA-N	0	3	342.458	3.394	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cccc4[nH]ccc43)C2)CC1	ZINC001040862442	1345589326	/nfs/dbraw/zinc/58/93/26/1345589326.db2.gz	MERGAUSRRXPQLP-UHFFFAOYSA-N	0	3	335.451	3.119	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)Cc3ccc(CC)cc3)C2)CC1	ZINC001040868504	1345590262	/nfs/dbraw/zinc/59/02/62/1345590262.db2.gz	SVFDZWZGRZFXTJ-UHFFFAOYSA-N	0	3	338.495	3.129	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@@H](C)c3ccc(C)o3)C2)CC1	ZINC001040875709	1345592537	/nfs/dbraw/zinc/59/25/37/1345592537.db2.gz	FSSGCCVNGAAMIV-KRWDZBQOSA-N	0	3	328.456	3.029	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@@H](C)c3ccc(C)cc3)C2)CC1	ZINC001040919027	1345599857	/nfs/dbraw/zinc/59/98/57/1345599857.db2.gz	GCCALALZJQLIRZ-IBGZPJMESA-N	0	3	338.495	3.436	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cc(C)c(F)cc3Cl)C2)CC1	ZINC001040924468	1345601583	/nfs/dbraw/zinc/60/15/83/1345601583.db2.gz	NDTQYPWSXAKMMD-UHFFFAOYSA-N	0	3	348.849	3.349	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@H](C)c3ccc(F)c(F)c3)C2)CC1	ZINC001040945030	1345606424	/nfs/dbraw/zinc/60/64/24/1345606424.db2.gz	MAJGHTHWDJFIRP-OAHLLOKOSA-N	0	3	346.421	3.016	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@]3(CCN(C(=O)C[C@@H]4C=CCC4)C3)C2)cc1	ZINC001041053391	1345637150	/nfs/dbraw/zinc/63/71/50/1345637150.db2.gz	JBPLHWKDOXDCFL-XMSQKQJNSA-N	0	3	349.478	3.339	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC[C@]2(CCN(Cc3cccc(C(F)F)c3)C2)C1	ZINC001041136671	1345658345	/nfs/dbraw/zinc/65/83/45/1345658345.db2.gz	NFFSJYSIJJNNPR-LIRRHRJNSA-N	0	3	347.409	3.208	20	30		EGEDHN
CC1CC(C(=O)N2CC[C@]3(CCN(Cc4ccc(C#N)cc4)C3)C2)C1	ZINC001041198075	1345674872	/nfs/dbraw/zinc/67/48/72/1345674872.db2.gz	JGFPJXVGOVZYMX-IOYBJCICSA-N	0	3	337.467	3.029	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3oc(C(F)F)cc3C)C2)C1	ZINC001041379162	1345712729	/nfs/dbraw/zinc/71/27/29/1345712729.db2.gz	OFVBIFMXIGQRMN-GOSISDBHSA-N	0	3	336.382	3.087	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3sc4ccccc4c3C)C2)C1	ZINC001041452334	1345731352	/nfs/dbraw/zinc/73/13/52/1345731352.db2.gz	BTQZAQSJKBFECV-HXUWFJFHSA-N	0	3	338.476	3.381	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)Cc3ccc(C(F)F)cc3)C2)C1	ZINC001041464767	1345735989	/nfs/dbraw/zinc/73/59/89/1345735989.db2.gz	TWEXQIFCHLTOEV-FQEVSTJZSA-N	0	3	346.421	3.114	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3c(Cl)oc4ccccc43)C2)C1	ZINC001041584508	1345782135	/nfs/dbraw/zinc/78/21/35/1345782135.db2.gz	AHDPHSIQULTWFN-LJQANCHMSA-N	0	3	342.826	3.257	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@]3(CCN(Cc4ccccn4)C3)C2)CC1	ZINC001041634266	1345804252	/nfs/dbraw/zinc/80/42/52/1345804252.db2.gz	CAVCOVYOBCDULH-OAQYLSRUSA-N	0	3	339.483	3.252	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@]2(CCN(CCC(F)(F)F)C2)C1	ZINC001041638120	1345805419	/nfs/dbraw/zinc/80/54/19/1345805419.db2.gz	IGWICBPGJOUWSJ-HZPDHXFCSA-N	0	3	332.410	3.466	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)C(C)(C)c3ccc(F)cc3)C2)C1	ZINC001041792626	1345852430	/nfs/dbraw/zinc/85/24/30/1345852430.db2.gz	ROVPWWYWTUYWTN-NRFANRHFSA-N	0	3	342.458	3.051	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)CC(C)(C)c3ccc(C)cc3)C2)C1	ZINC001041824849	1345864434	/nfs/dbraw/zinc/86/44/34/1345864434.db2.gz	XZXASFFDRHEEEO-JOCHJYFZSA-N	0	3	338.495	3.220	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)CC[C@H]3CCc4ccccc43)C2)C1	ZINC001041842949	1345870243	/nfs/dbraw/zinc/87/02/43/1345870243.db2.gz	KPWVFWLMAZSXJX-DENIHFKCSA-N	0	3	336.479	3.054	20	30		EGEDHN
C/C(=C/C(=O)N1CC[C@@H]2CCN(Cc3cccc(C#N)c3)[C@H]2C1)C1CC1	ZINC001041962347	1345908847	/nfs/dbraw/zinc/90/88/47/1345908847.db2.gz	ROCRZYOECKKANA-QCMFMLLYSA-N	0	3	349.478	3.337	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3CCN(C(=O)CCC4CC4)C[C@H]32)cc1	ZINC001041991166	1345914956	/nfs/dbraw/zinc/91/49/56/1345914956.db2.gz	YLDOSYOZBVEXFC-VQTJNVASSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3nc(C(C)C)oc3C)C[C@H]21	ZINC001042059893	1345933235	/nfs/dbraw/zinc/93/32/35/1345933235.db2.gz	FSUWSQWJCCNBKY-JKSUJKDBSA-N	0	3	331.460	3.219	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3c(C)[nH]c4ccccc43)C[C@H]21	ZINC001042142027	1345955168	/nfs/dbraw/zinc/95/51/68/1345955168.db2.gz	KPSYNXZRZBRVKB-QFBILLFUSA-N	0	3	335.451	3.036	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)CCc3ccc4[nH]ccc4c3)C[C@@H]21	ZINC001042152026	1345957431	/nfs/dbraw/zinc/95/74/31/1345957431.db2.gz	DBBFWGDEZZZHAO-NQIIRXRSSA-N	0	3	349.478	3.047	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3cccc(F)c3)[C@@H]2C1	ZINC001042183685	1345971034	/nfs/dbraw/zinc/97/10/34/1345971034.db2.gz	PZFWVFJAWGDMGJ-SJLPKXTDSA-N	0	3	330.447	3.461	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cc4cc(C)ccc4[nH]3)C[C@@H]21	ZINC001042183987	1345972168	/nfs/dbraw/zinc/97/21/68/1345972168.db2.gz	SDFCZLYXTYGEOX-UZLBHIALSA-N	0	3	335.451	3.036	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3cccc(OC)c3)[C@H]2C1	ZINC001042184465	1345972266	/nfs/dbraw/zinc/97/22/66/1345972266.db2.gz	WSTGLFBCVFNBSH-MJGOQNOKSA-N	0	3	342.483	3.330	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cncc4sccc43)C[C@@H]21	ZINC001042205581	1345983470	/nfs/dbraw/zinc/98/34/70/1345983470.db2.gz	XUQLEHWFEBTCOQ-CJNGLKHVSA-N	0	3	327.453	3.019	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccccc3-n3cccc3)C[C@H]21	ZINC001042212315	1345987720	/nfs/dbraw/zinc/98/77/20/1345987720.db2.gz	BFQLWOGMEWINNW-WIYYLYMNSA-N	0	3	347.462	3.037	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc(C)c(Cl)c3)C[C@H]21	ZINC001042216010	1345988854	/nfs/dbraw/zinc/98/88/54/1345988854.db2.gz	KOORQGNOGHSGEY-MAUKXSAKSA-N	0	3	330.859	3.208	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3c(F)ccc(F)c3Cl)C[C@H]21	ZINC001042245634	1346003305	/nfs/dbraw/zinc/00/33/05/1346003305.db2.gz	RFIAHAROSVDYBN-SMDDNHRTSA-N	0	3	340.801	3.341	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3c(F)ccc(F)c3Cl)C[C@H]21	ZINC001042245631	1346003484	/nfs/dbraw/zinc/00/34/84/1346003484.db2.gz	RFIAHAROSVDYBN-BXUZGUMPSA-N	0	3	340.801	3.341	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)Cn3cc(C)c4ccccc43)C[C@H]21	ZINC001042262086	1346010345	/nfs/dbraw/zinc/01/03/45/1346010345.db2.gz	FREFOZSKRWDGEK-FXAWDEMLSA-N	0	3	337.467	3.059	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3scnc3C(C)(C)C)C[C@H]21	ZINC001042262226	1346010517	/nfs/dbraw/zinc/01/05/17/1346010517.db2.gz	HZSMURCLDJZHEE-LSDHHAIUSA-N	0	3	345.512	3.000	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(F)c4ncccc4c3)C[C@@H]21	ZINC001042271526	1346014393	/nfs/dbraw/zinc/01/43/93/1346014393.db2.gz	ZLUXQVJUPNIUBU-KSSFIOAISA-N	0	3	339.414	3.096	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(C(F)F)cc3F)C[C@@H]21	ZINC001042285248	1346017063	/nfs/dbraw/zinc/01/70/63/1346017063.db2.gz	MOPHWGKKCFTDMP-LRDDRELGSA-N	0	3	338.373	3.486	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)[C@H]3CC[C@H](C(C)C)CC3)C[C@H]21	ZINC001042288058	1346017787	/nfs/dbraw/zinc/01/77/87/1346017787.db2.gz	ALEPRYQFFMDSEU-LWYYNNOASA-N	0	3	330.516	3.395	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3coc(C4CCC4)n3)C[C@@H]21	ZINC001042304516	1346024906	/nfs/dbraw/zinc/02/49/06/1346024906.db2.gz	ONAQHYUERXJFMI-YOEHRIQHSA-N	0	3	329.444	3.055	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3c[nH]nc3C3CCCCC3)C[C@H]21	ZINC001042310494	1346028358	/nfs/dbraw/zinc/02/83/58/1346028358.db2.gz	SZYKDZGKRQVGAM-CRAIPNDOSA-N	0	3	342.487	3.180	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3cccc(C#N)c3)[C@H]2C1	ZINC001042324923	1346033375	/nfs/dbraw/zinc/03/33/75/1346033375.db2.gz	XSPFKQXIYBVLIV-MSOLQXFVSA-N	0	3	325.456	3.027	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3occ4c3CCCC4)C[C@H]21	ZINC001042330824	1346038781	/nfs/dbraw/zinc/03/87/81/1346038781.db2.gz	HFITWJMJIOQXJF-MAUKXSAKSA-N	0	3	328.456	3.271	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc4ccccc4c3)C[C@H]21	ZINC001042335558	1346042263	/nfs/dbraw/zinc/04/22/63/1346042263.db2.gz	LMXWPXQNFPOYFY-WIYYLYMNSA-N	0	3	332.447	3.400	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccccc3OCC3CC3)C[C@H]21	ZINC001042367836	1346059107	/nfs/dbraw/zinc/05/91/07/1346059107.db2.gz	MBOISDIVMHMWEL-PKOBYXMFSA-N	0	3	340.467	3.198	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3c(Cl)cccc3OC)C[C@H]21	ZINC001042370936	1346061008	/nfs/dbraw/zinc/06/10/08/1346061008.db2.gz	JBCSWKNYJGCUJU-GOEBONIOSA-N	0	3	348.874	3.461	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3csc(C4CC4)n3)C[C@H]21	ZINC001042375440	1346063334	/nfs/dbraw/zinc/06/33/34/1346063334.db2.gz	XHHCJBGXTZJEQK-CZUORRHYSA-N	0	3	331.485	3.133	20	30		EGEDHN
C[C@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)C1(F)CCCC1	ZINC001044655036	1346395142	/nfs/dbraw/zinc/39/51/42/1346395142.db2.gz	WFWLNCJQZCKHHX-MAUKXSAKSA-N	0	3	343.446	3.310	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3cnc(C)o3)C[C@H]2C)CC1	ZINC001044729148	1346414023	/nfs/dbraw/zinc/41/40/23/1346414023.db2.gz	FOADQWOAWZFHNI-PBHICJAKSA-N	0	3	331.460	3.199	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@H](NCc3ccccc3C#N)C[C@H]2C)ccn1	ZINC001044786132	1346428146	/nfs/dbraw/zinc/42/81/46/1346428146.db2.gz	ZLESAZOUBSCYDR-UZLBHIALSA-N	0	3	348.450	3.045	20	30		EGEDHN
Cc1ccsc1C(=O)N1CCC[C@H]1CNCc1ccc(C#N)s1	ZINC001044898887	1346457271	/nfs/dbraw/zinc/45/72/71/1346457271.db2.gz	BVFCXDGGSHMTDC-ZDUSSCGKSA-N	0	3	345.493	3.384	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)[C@H]2[C@@H]3CCCC[C@@H]32)s1	ZINC001044978629	1346473103	/nfs/dbraw/zinc/47/31/03/1346473103.db2.gz	NRFHMCXPQUXQTF-VIBAHUMZSA-N	0	3	343.496	3.137	20	30		EGEDHN
CC1(C)CC[C@@H]1C(=O)N1CCC[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC001045160709	1346510614	/nfs/dbraw/zinc/51/06/14/1346510614.db2.gz	SLCFFPXAMYWNPQ-DLBZAZTESA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H]1CNCc1ccc(Cl)nc1	ZINC001045181944	1346517034	/nfs/dbraw/zinc/51/70/34/1346517034.db2.gz	GZCLMDVWSJLENG-YJBOKZPZSA-N	0	3	335.879	3.418	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H]1CNCc1c(C)noc1CC	ZINC001045185823	1346522462	/nfs/dbraw/zinc/52/24/62/1346522462.db2.gz	MYRVPJRIJQCBSM-KXBFYZLASA-N	0	3	333.476	3.228	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)[C@H]2CC[C@H]2c2ccc(F)cc2)CC1	ZINC001045511588	1346613608	/nfs/dbraw/zinc/61/36/08/1346613608.db2.gz	SZRJAMCKDZKXPW-ROUUACIJSA-N	0	3	330.447	3.476	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045565647	1346630247	/nfs/dbraw/zinc/63/02/47/1346630247.db2.gz	RBBMLAHEMUKEKL-QZTJIDSGSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC1(NC(=O)[C@@H]2C[C@H]2C2CC2)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045584376	1346637169	/nfs/dbraw/zinc/63/71/69/1346637169.db2.gz	ZJFFDAPIJSYNDK-RBUKOAKNSA-N	0	3	337.467	3.075	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2ccc(OC3CCC3)cc2)CC1	ZINC001045647098	1346658342	/nfs/dbraw/zinc/65/83/42/1346658342.db2.gz	RMRMQRXEZUMRNP-UHFFFAOYSA-N	0	3	340.467	3.226	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2ccc(N(C)CCC)cc2)CC1	ZINC001045653866	1346660661	/nfs/dbraw/zinc/66/06/61/1346660661.db2.gz	HFCUANUJFLDHBF-UHFFFAOYSA-N	0	3	341.499	3.140	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]3CC[C@@H](C2)N3Cc2cccc(C#N)c2)C1	ZINC001045844334	1346718754	/nfs/dbraw/zinc/71/87/54/1346718754.db2.gz	KEGOKSSDWJNMSY-UXHICEINSA-N	0	3	349.478	3.480	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)C1(C3CC3)CCC1)C2	ZINC001045954617	1346789030	/nfs/dbraw/zinc/78/90/30/1346789030.db2.gz	FCIIWXVSGJMHSL-FQEVSTJZSA-N	0	3	328.500	3.295	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@]2(CCN(Cc3cnoc3C)C2)C1	ZINC001045958103	1346793250	/nfs/dbraw/zinc/79/32/50/1346793250.db2.gz	KTZJUWSAOQYAPA-HXUWFJFHSA-N	0	3	345.487	3.400	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc3ccncc3c1)C2	ZINC001045978117	1346814550	/nfs/dbraw/zinc/81/45/50/1346814550.db2.gz	RKFKUICWKZIHGA-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ncccc1Cl)C2	ZINC001045980992	1346818981	/nfs/dbraw/zinc/81/89/81/1346818981.db2.gz	ORFPIEYQJMBPKC-LJQANCHMSA-N	0	3	345.874	3.077	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)C1CC(C(C)(C)C)C1)C2	ZINC001045986121	1346826995	/nfs/dbraw/zinc/82/69/95/1346826995.db2.gz	HKSOJGNAURZKEG-NGICGMGXSA-N	0	3	330.516	3.397	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2cc(C)n(C(CC)CC)n2)C1	ZINC001046435335	1346975183	/nfs/dbraw/zinc/97/51/83/1346975183.db2.gz	CEGFFZNOVHEEFN-IBGZPJMESA-N	0	3	332.492	3.323	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2cc(F)ccc2F)C1	ZINC001046947297	1347160101	/nfs/dbraw/zinc/16/01/01/1347160101.db2.gz	MVTAQEREVSONET-GFCCVEGCSA-N	0	3	344.352	3.228	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CN(CCCF)CCC2(F)F)CC1	ZINC001046969375	1347170982	/nfs/dbraw/zinc/17/09/82/1347170982.db2.gz	ANZSDUQHAUXZPM-OAHLLOKOSA-N	0	3	332.410	3.166	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@H](CNC(=O)c2c(C)cc(C)cc2C)C1	ZINC001046997063	1347179899	/nfs/dbraw/zinc/17/98/99/1347179899.db2.gz	SNPSEXQGZWQIJI-QGZVFWFLSA-N	0	3	348.437	3.322	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)C3(C(F)F)CC3)C2)CC1	ZINC001047239457	1347265613	/nfs/dbraw/zinc/26/56/13/1347265613.db2.gz	OBIWTWGFHIAXJI-INIZCTEOSA-N	0	3	338.442	3.006	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)/C=C/c3ccc[nH]3)C2)CC1	ZINC001047241447	1347267498	/nfs/dbraw/zinc/26/74/98/1347267498.db2.gz	PXWOSIDVHDAAKI-SGQUHAKNSA-N	0	3	339.483	3.002	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)CCc3ccsc3)C2)CC1	ZINC001047242869	1347268955	/nfs/dbraw/zinc/26/89/55/1347268955.db2.gz	GUONWMJNDQFWPN-LJQANCHMSA-N	0	3	344.524	3.265	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@@H]3CCC(F)(F)C3)C2)CC1	ZINC001047243968	1347269354	/nfs/dbraw/zinc/26/93/54/1347269354.db2.gz	OHHJFNNMYGAFGV-SJORKVTESA-N	0	3	338.442	3.006	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)C(C)(C)C3CC3)C2)CC1	ZINC001047249074	1347274010	/nfs/dbraw/zinc/27/40/10/1347274010.db2.gz	RMLPVHXBBQRRCJ-SFHVURJKSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3occc3CC)C2)CC1	ZINC001047255425	1347279179	/nfs/dbraw/zinc/27/91/79/1347279179.db2.gz	ZHYWTKCPRXKHIY-SFHVURJKSA-N	0	3	328.456	3.039	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)Cc3ccsc3C)C2)CC1	ZINC001047259291	1347282025	/nfs/dbraw/zinc/28/20/25/1347282025.db2.gz	NJJKGSHWEZLRNM-LJQANCHMSA-N	0	3	344.524	3.183	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3ccc4cc[nH]c4c3)C2)CC1	ZINC001047259793	1347282344	/nfs/dbraw/zinc/28/23/44/1347282344.db2.gz	TYTYAQRWYAFQER-FQEVSTJZSA-N	0	3	349.478	3.365	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@H](C)c3ccccc3)C2)CC1	ZINC001047263261	1347284398	/nfs/dbraw/zinc/28/43/98/1347284398.db2.gz	DMRURIHNTPHCEV-NQIIRXRSSA-N	0	3	338.495	3.374	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)C2(C3CC3)CC2)C1	ZINC001047878728	1347396490	/nfs/dbraw/zinc/39/64/90/1347396490.db2.gz	CXTAHMYOXGQAKQ-MAUKXSAKSA-N	0	3	337.467	3.075	20	30		EGEDHN
Cc1cocc1C(=O)N1CC[C@H]([C@@H](C)NCc2ccccc2C#N)C1	ZINC001047922713	1347410565	/nfs/dbraw/zinc/41/05/65/1347410565.db2.gz	AWDDYOCZZMXRBS-QAPCUYQASA-N	0	3	337.423	3.100	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]([C@H](C)NCc2nc(C)sc2C)C1	ZINC001047924919	1347411799	/nfs/dbraw/zinc/41/17/99/1347411799.db2.gz	RGPGMLCWOYHZJR-SWLSCSKDSA-N	0	3	335.517	3.299	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]([C@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001047931524	1347414388	/nfs/dbraw/zinc/41/43/88/1347414388.db2.gz	KFBQKDBUSFPZMM-GOEBONIOSA-N	0	3	343.446	3.236	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]([C@@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001047931526	1347414428	/nfs/dbraw/zinc/41/44/28/1347414428.db2.gz	KFBQKDBUSFPZMM-ZBFHGGJFSA-N	0	3	343.446	3.236	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CCCC2)C[C@@H]1CNCc1cc(F)ccc1C#N	ZINC001048098476	1347465366	/nfs/dbraw/zinc/46/53/66/1347465366.db2.gz	XJSULAJOULNAHM-KDOFPFPSSA-N	0	3	343.446	3.072	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCC2CC2)C[C@@H]1CNCc1cc(F)ccc1C#N	ZINC001048181412	1347487503	/nfs/dbraw/zinc/48/75/03/1347487503.db2.gz	DZUAGGBCIYOZNK-KDOFPFPSSA-N	0	3	343.446	3.072	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2(C)CCCC2)C[C@@H]1CNCc1ccccc1C#N	ZINC001048328636	1347519594	/nfs/dbraw/zinc/51/95/94/1347519594.db2.gz	NWEYNQIENMGODT-APWZRJJASA-N	0	3	339.483	3.323	20	30		EGEDHN
CC(C)C1(C(=O)N2C[C@H](C)[C@@H](CNCc3ccccc3C#N)C2)CC1	ZINC001048374852	1347535308	/nfs/dbraw/zinc/53/53/08/1347535308.db2.gz	RTCFVSFLUOAPQP-LPHOPBHVSA-N	0	3	339.483	3.179	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)[C@@H]2C[C@]2(C)CC)CC1	ZINC001048629180	1347625080	/nfs/dbraw/zinc/62/50/80/1347625080.db2.gz	SALSBXPVRJXAPM-FPOVZHCZSA-N	0	3	341.499	3.497	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CN(C(=O)CCC4CCC4)C[C@@H]3C2)c1	ZINC001048751246	1347652606	/nfs/dbraw/zinc/65/26/06/1347652606.db2.gz	ASQQGHXNQZECFM-BGYRXZFFSA-N	0	3	337.467	3.029	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc(F)c4ccccc4c3)C[C@@H]2C1	ZINC001048852459	1347671183	/nfs/dbraw/zinc/67/11/83/1347671183.db2.gz	CPPPULFCGOMJGV-HDICACEKSA-N	0	3	336.410	3.006	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CN(Cc3cccc(F)c3)C[C@H]2C1	ZINC001049034622	1347711847	/nfs/dbraw/zinc/71/18/47/1347711847.db2.gz	GYUCEGRVVQZIJP-QKLQHJQFSA-N	0	3	330.447	3.318	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CN(Cc3oc(CC)nc3C)C[C@H]2C1	ZINC001049036073	1347712177	/nfs/dbraw/zinc/71/21/77/1347712177.db2.gz	SNZPBGJUEBUMFS-GQIGUUNPSA-N	0	3	345.487	3.038	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)[C@H](CC3CCCCC3)C(C)C)C[C@@H]2C1	ZINC001049100320	1347725905	/nfs/dbraw/zinc/72/59/05/1347725905.db2.gz	XSJAXALAWALQKN-HSALFYBXSA-N	0	3	330.516	3.252	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@@H]2CCCN3C(=O)c2ccccc2)cc1	ZINC001049299822	1347779072	/nfs/dbraw/zinc/77/90/72/1347779072.db2.gz	UGDCBNILUDIIDJ-SFTDATJTSA-N	0	3	345.446	3.437	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1ccc(C#N)cc1)C1CC1	ZINC001049403692	1347825528	/nfs/dbraw/zinc/82/55/28/1347825528.db2.gz	KAOJODVRYLPAAS-BEVDRBHNSA-N	0	3	337.467	3.170	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@@H]2CCCN3C(=O)C=C2CCC2)c1	ZINC001049414652	1347836300	/nfs/dbraw/zinc/83/63/00/1347836300.db2.gz	WOWHFTLPSXBPII-PMACEKPBSA-N	0	3	335.451	3.234	20	30		EGEDHN
Cc1cc[nH]c1C(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1cccc(C#N)c1	ZINC001049459027	1347858769	/nfs/dbraw/zinc/85/87/69/1347858769.db2.gz	SGVMWYMWFWCHHL-MOPGFXCFSA-N	0	3	348.450	3.074	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cccc2scnc21	ZINC001049468263	1347863958	/nfs/dbraw/zinc/86/39/58/1347863958.db2.gz	GXPVSCLIXWMDGL-HUUCEWRRSA-N	0	3	327.453	3.161	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccn(C2CCCC2)n1	ZINC001049506279	1347882814	/nfs/dbraw/zinc/88/28/14/1347882814.db2.gz	WFIBHZRFRCOAGA-RTBURBONSA-N	0	3	342.487	3.253	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ocnc1-c1ccccc1	ZINC001049519292	1347888664	/nfs/dbraw/zinc/88/86/64/1347888664.db2.gz	RDALUFJAHYIEIK-IAGOWNOFSA-N	0	3	337.423	3.207	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(C2CCCCC2)n[nH]1	ZINC001049522832	1347890845	/nfs/dbraw/zinc/89/08/45/1347890845.db2.gz	JFSVBBMCQUOEIV-RBUKOAKNSA-N	0	3	342.487	3.322	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H]1CCCc2ccccc21	ZINC001049550966	1347903641	/nfs/dbraw/zinc/90/36/41/1347903641.db2.gz	CXVXBJNASGMNFV-PCCBWWKXSA-N	0	3	336.479	3.195	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cccc([C@H]2CCOC2)c1	ZINC001049561479	1347910072	/nfs/dbraw/zinc/91/00/72/1347910072.db2.gz	LIIXAXACBZEGFW-SLFFLAALSA-N	0	3	340.467	3.055	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(C)nn1C(CC)CC	ZINC001049561508	1347910112	/nfs/dbraw/zinc/91/01/12/1347910112.db2.gz	MEAGYJNGRZLZCF-ROUUACIJSA-N	0	3	344.503	3.418	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc2c([nH]1)c(F)ccc2C	ZINC001049562507	1347910841	/nfs/dbraw/zinc/91/08/41/1347910841.db2.gz	WFXIEEQDSOWBEJ-ZWKOTPCHSA-N	0	3	341.430	3.480	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc2c(cn1)CCCC2	ZINC001049581725	1347920881	/nfs/dbraw/zinc/92/08/81/1347920881.db2.gz	HUBYXVAKWDYBBU-WOJBJXKFSA-N	0	3	339.483	3.215	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(-c2ccccc2)on1	ZINC001049584887	1347922734	/nfs/dbraw/zinc/92/27/34/1347922734.db2.gz	XGOAXNQFPIHXJI-OALUTQOASA-N	0	3	349.434	3.044	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)CCc1ccc2[nH]ccc2c1	ZINC001049592773	1347927277	/nfs/dbraw/zinc/92/72/77/1347927277.db2.gz	JSXRRGBANHTUPF-LEWJYISDSA-N	0	3	349.478	3.189	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cnc2c(F)cccc2c1	ZINC001049596913	1347929492	/nfs/dbraw/zinc/92/94/92/1347929492.db2.gz	ZZAFCYHNJPANCL-MSOLQXFVSA-N	0	3	339.414	3.239	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)[C@@H]1C[C@]1(C)c1ccccc1	ZINC001049612629	1347935976	/nfs/dbraw/zinc/93/59/76/1347935976.db2.gz	UXFCTGCCGDPLDL-CUXKYVRBSA-N	0	3	336.479	3.053	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)C1(c2ccc(F)cc2)CCC1	ZINC001049629861	1347943358	/nfs/dbraw/zinc/94/33/58/1347943358.db2.gz	MSFFWDCSGYVEMV-MOPGFXCFSA-N	0	3	342.458	3.499	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049649106	1347955114	/nfs/dbraw/zinc/95/51/14/1347955114.db2.gz	ZECKDJAGKNLLCG-OALUTQOASA-N	0	3	337.467	3.336	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(F)c(F)cc1F	ZINC001049676603	1347968006	/nfs/dbraw/zinc/96/80/06/1347968006.db2.gz	PITRVOQZPYIMCU-IAGOWNOFSA-N	0	3	338.373	3.359	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1ccc(F)cc1Cl	ZINC001049690055	1347973266	/nfs/dbraw/zinc/97/32/66/1347973266.db2.gz	NNKSGKFGRSZDJD-QZTJIDSGSA-N	0	3	348.849	3.110	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C[C@@H](C)c1cccc(F)c1	ZINC001049708123	1347984847	/nfs/dbraw/zinc/98/48/47/1347984847.db2.gz	OOHZLKNOJZPMPE-LSTHTHJFSA-N	0	3	342.458	3.408	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(F)c(F)c(F)c1	ZINC001049743604	1347996839	/nfs/dbraw/zinc/99/68/39/1347996839.db2.gz	QOGWDPJHLMIYQI-JKSUJKDBSA-N	0	3	338.373	3.359	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)CCc1cc(Cl)cs1	ZINC001049756423	1348003408	/nfs/dbraw/zinc/00/34/08/1348003408.db2.gz	VFSHBZIORJHTGY-HOTGVXAUSA-N	0	3	336.888	3.033	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(OCC)c(C)c1	ZINC001049762428	1348007102	/nfs/dbraw/zinc/00/71/02/1348007102.db2.gz	OWTRWJCOTQERGL-MOPGFXCFSA-N	0	3	340.467	3.096	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccn(C(CC)CC)n1	ZINC001049768512	1348011574	/nfs/dbraw/zinc/01/15/74/1348011574.db2.gz	WRBZNJVXXCZSHP-QZTJIDSGSA-N	0	3	330.476	3.109	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049768952	1348012360	/nfs/dbraw/zinc/01/23/60/1348012360.db2.gz	MABIHXRWGWXRMO-PWIZWCRZSA-N	0	3	339.483	3.416	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccc(C)s1	ZINC001049783305	1348019991	/nfs/dbraw/zinc/01/99/91/1348019991.db2.gz	SXOKIKQORCIYTM-ZJPYXAASSA-N	0	3	342.508	3.249	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C1(Cc2ccccc2F)CC1	ZINC001049784351	1348020895	/nfs/dbraw/zinc/02/08/95/1348020895.db2.gz	VWDSQTQZILEKSA-RTBURBONSA-N	0	3	342.458	3.400	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(Cl)cc(OC)c1	ZINC001049800438	1348026722	/nfs/dbraw/zinc/02/67/22/1348026722.db2.gz	BHSQWQWCKUHFPT-SJORKVTESA-N	0	3	334.847	3.214	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(C)nc1OCC	ZINC001049810958	1348031446	/nfs/dbraw/zinc/03/14/46/1348031446.db2.gz	DPDRWMKISRVPOY-ROUUACIJSA-N	0	3	343.471	3.044	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cnn(CCC)c1C1CC1	ZINC001049834359	1348047949	/nfs/dbraw/zinc/04/79/49/1348047949.db2.gz	AMRIWTVXTVDSEI-ZWKOTPCHSA-N	0	3	342.487	3.035	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1coc(C2CCC2)n1	ZINC001049842107	1348053460	/nfs/dbraw/zinc/05/34/60/1348053460.db2.gz	KBTMQKBDHQZJIW-SJORKVTESA-N	0	3	329.444	3.197	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H]1CCCc2sc(C)nc21	ZINC001049844545	1348054289	/nfs/dbraw/zinc/05/42/89/1348054289.db2.gz	QVLKFSVZFOIJGH-HRCADAONSA-N	0	3	345.512	3.123	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C(C)(C)c1ccc(F)cc1	ZINC001049854411	1348060898	/nfs/dbraw/zinc/06/08/98/1348060898.db2.gz	LAAOHGBQNKZZJR-ZWKOTPCHSA-N	0	3	330.447	3.355	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc2ccccc2n1	ZINC001049865407	1348072090	/nfs/dbraw/zinc/07/20/90/1348072090.db2.gz	VKXGKDOXYHUBDQ-UXHICEINSA-N	0	3	335.451	3.490	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)C1CCC(C(F)F)CC1	ZINC001049869811	1348075217	/nfs/dbraw/zinc/07/52/17/1348075217.db2.gz	JUIVWQWJWXCDDG-GQGLESIBSA-N	0	3	338.442	3.147	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C1CCC(C(F)F)CC1	ZINC001049869809	1348075376	/nfs/dbraw/zinc/07/53/76/1348075376.db2.gz	JUIVWQWJWXCDDG-BHUNQDJPSA-N	0	3	338.442	3.147	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ncccc1OC(C)C	ZINC001049870381	1348076154	/nfs/dbraw/zinc/07/61/54/1348076154.db2.gz	MWXWVLXUOPDUMV-DLBZAZTESA-N	0	3	343.471	3.124	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)CCn1ccc2ccccc21	ZINC001049880667	1348086034	/nfs/dbraw/zinc/08/60/34/1348086034.db2.gz	DCZIAYPZRTVASH-NHCUHLMSSA-N	0	3	349.478	3.120	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1ccc2ccccc2c1	ZINC001049890652	1348094983	/nfs/dbraw/zinc/09/49/83/1348094983.db2.gz	XOMMEFYJACIYBR-FGZHOGPDSA-N	0	3	346.474	3.471	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](C)c1ccc(F)cc1F	ZINC001049904179	1348103209	/nfs/dbraw/zinc/10/32/09/1348103209.db2.gz	NEOAECRJMKWWDI-GDIGMMSISA-N	0	3	346.421	3.157	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1cccc(F)c1F	ZINC001049906917	1348104698	/nfs/dbraw/zinc/10/46/98/1348104698.db2.gz	GUXMQEXCUMERAH-MVJTYMMSSA-N	0	3	346.421	3.320	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1	ZINC001049920306	1348112698	/nfs/dbraw/zinc/11/26/98/1348112698.db2.gz	AQIIXMBZJDRVBG-YRPNKDGESA-N	0	3	340.442	3.018	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(C)n(C(C)C)n1	ZINC001049934848	1348121435	/nfs/dbraw/zinc/12/14/35/1348121435.db2.gz	WFJYCYNAOYFKPJ-MSOLQXFVSA-N	0	3	330.476	3.027	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cc(F)cc4ccncc43)[C@@H]2C1	ZINC001050050224	1348165859	/nfs/dbraw/zinc/16/58/59/1348165859.db2.gz	YTICADAZMFJAQY-HNAYVOBHSA-N	0	3	339.414	3.096	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3ccc(F)c(F)c3F)[C@@H]2C1	ZINC001050128017	1348190915	/nfs/dbraw/zinc/19/09/15/1348190915.db2.gz	FCCQVWIKAZOOHR-SWLSCSKDSA-N	0	3	338.373	3.216	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3cnn([C@H](C)CC)c3C)[C@@H]2C1	ZINC001050179697	1348203341	/nfs/dbraw/zinc/20/33/41/1348203341.db2.gz	OTQKEBMVTHWHOW-HHXXYDBFSA-N	0	3	344.503	3.275	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cc(F)c(F)cc3Cl)[C@@H]2C1	ZINC001050197263	1348208194	/nfs/dbraw/zinc/20/81/94/1348208194.db2.gz	XYQYCZMHFVKKOO-MEDUHNTESA-N	0	3	340.801	3.341	20	30		EGEDHN
O=C(C#CC1CC1)N1CC2(C1)CCN(Cc1ccc(Cl)cc1)CC2	ZINC001050515958	1348282300	/nfs/dbraw/zinc/28/23/00/1348282300.db2.gz	WFZQUROPTJNEQW-UHFFFAOYSA-N	0	3	342.870	3.178	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)C3(CC)CCC(F)(F)CC3)C2)CC1	ZINC001050567815	1348291487	/nfs/dbraw/zinc/29/14/87/1348291487.db2.gz	BIFFFRWKJGUCTR-UHFFFAOYSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc(-c4ccco4)o3)C2)CC1	ZINC001050586043	1348294057	/nfs/dbraw/zinc/29/40/57/1348294057.db2.gz	ACLUKPDMXUKEIK-UHFFFAOYSA-N	0	3	338.407	3.101	20	30		EGEDHN
CC1(C(=O)N2CC3(C2)CCN(Cc2cccc(C#N)c2)CC3)CC=CC1	ZINC001050649589	1348315851	/nfs/dbraw/zinc/31/58/51/1348315851.db2.gz	DUIGCRIWEJWLIY-UHFFFAOYSA-N	0	3	349.478	3.339	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C34CC5CC(CC(C5)C3)C4)C2)CC1	ZINC001050737972	1348343330	/nfs/dbraw/zinc/34/33/30/1348343330.db2.gz	QLIFYSCVOYZUJM-UHFFFAOYSA-N	0	3	340.511	3.151	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3c(C)csc3Cl)C2)CC1	ZINC001050739158	1348343777	/nfs/dbraw/zinc/34/37/77/1348343777.db2.gz	NCBNQRXKOQMYIK-UHFFFAOYSA-N	0	3	336.888	3.271	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C3(C(F)(F)F)CCCC3)C2)CC1	ZINC001050770132	1348354598	/nfs/dbraw/zinc/35/45/98/1348354598.db2.gz	UDMKMTVFROFPAP-UHFFFAOYSA-N	0	3	342.405	3.057	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3ocnc3CC)cccc2C1	ZINC001051299153	1348424302	/nfs/dbraw/zinc/42/43/02/1348424302.db2.gz	XSEVGJKCNFVYLE-UHFFFAOYSA-N	0	3	339.439	3.101	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3cccc(OC)c3)cccc2C1	ZINC001051306776	1348428159	/nfs/dbraw/zinc/42/81/59/1348428159.db2.gz	PMJIESBVLHJWPA-UHFFFAOYSA-N	0	3	348.446	3.007	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3ccc(F)s3)cccc2C1	ZINC001051307804	1348429028	/nfs/dbraw/zinc/42/90/28/1348429028.db2.gz	IFPSNAXSRPHBNW-UHFFFAOYSA-N	0	3	342.439	3.199	20	30		EGEDHN
N#Cc1cccc(C[N@H+]2CCC[C@@H](NC(=O)c3ccccc3[O-])CC2)c1	ZINC001052212621	1348512709	/nfs/dbraw/zinc/51/27/09/1348512709.db2.gz	XASWZWNQNDEHBO-GOSISDBHSA-N	0	3	349.434	3.048	20	30		EGEDHN
N#Cc1cccc(C[N@@H+]2CCC[C@@H](NC(=O)c3ccccc3[O-])CC2)c1	ZINC001052212621	1348512712	/nfs/dbraw/zinc/51/27/12/1348512712.db2.gz	XASWZWNQNDEHBO-GOSISDBHSA-N	0	3	349.434	3.048	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cc(C3CCCCC3)n[nH]2)CC1	ZINC001052453394	1348545646	/nfs/dbraw/zinc/54/56/46/1348545646.db2.gz	OKULRUUPFUQTLG-KRWDZBQOSA-N	0	3	342.487	3.065	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)C[C@@H]2C[C@H]2c2ccc(OC)cc2)C1	ZINC001079887231	1357413696	/nfs/dbraw/zinc/41/36/96/1357413696.db2.gz	RQMUZOAEAVZZHW-DJABAAGCSA-N	0	3	342.483	3.201	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)Cc2c(C)cccc2Cl)CC1	ZINC001052527476	1348566715	/nfs/dbraw/zinc/56/67/15/1348566715.db2.gz	BBYFZMGYLPKUIS-MRXNPFEDSA-N	0	3	332.875	3.185	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)Cc2ccc(CCCC)cc2)CC1	ZINC001052532413	1348568556	/nfs/dbraw/zinc/56/85/56/1348568556.db2.gz	FQRMZAPYCGLHGZ-HXUWFJFHSA-N	0	3	326.484	3.176	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2sc3ccccc3c2C)CC1	ZINC001052541414	1348572630	/nfs/dbraw/zinc/57/26/30/1348572630.db2.gz	VOQJRHTWHKERLR-OAHLLOKOSA-N	0	3	326.465	3.427	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCN(CCC(F)(F)F)CC2)cc1	ZINC001052615782	1348597569	/nfs/dbraw/zinc/59/75/69/1348597569.db2.gz	RHYKPDLVQPINJU-INIZCTEOSA-N	0	3	338.373	3.205	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cc3cccc(OC)c3o2)CC1	ZINC001052666294	1348620795	/nfs/dbraw/zinc/62/07/95/1348620795.db2.gz	RKOUPZGAJGPRFB-MRXNPFEDSA-N	0	3	340.423	3.049	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC001052692745	1348635389	/nfs/dbraw/zinc/63/53/89/1348635389.db2.gz	ADRKQMBBBODVTP-VAMGGRTRSA-N	0	3	339.483	3.465	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N[C@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC001052692744	1348635588	/nfs/dbraw/zinc/63/55/88/1348635588.db2.gz	ADRKQMBBBODVTP-HSALFYBXSA-N	0	3	339.483	3.465	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H](NC(=O)[C@H]3CC34CCC4)CC2)cc1	ZINC001052753804	1348663627	/nfs/dbraw/zinc/66/36/27/1348663627.db2.gz	IMWSXPGUNITWAY-RTBURBONSA-N	0	3	337.467	3.219	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccccc2O[C@H](C)CC)CC1	ZINC001052755587	1348665159	/nfs/dbraw/zinc/66/51/59/1348665159.db2.gz	WOKZRBRQVPQCHD-MSOLQXFVSA-N	0	3	342.483	3.472	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2)CC1	ZINC001052778570	1348675577	/nfs/dbraw/zinc/67/55/77/1348675577.db2.gz	NYFSXDIWVXDWAX-CEXWTWQISA-N	0	3	344.886	3.438	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N[C@H]1CCCN(C/C=C\Cl)CC1	ZINC001052779508	1348675853	/nfs/dbraw/zinc/67/58/53/1348675853.db2.gz	GXUJCSCJIOQSBR-LGYLBKJUSA-N	0	3	340.895	3.081	20	30		EGEDHN
Cc1cc(C(=O)N[C@H]2CCCN(Cc3cccc(C#N)c3)CC2)ccn1	ZINC001052802198	1348685317	/nfs/dbraw/zinc/68/53/17/1348685317.db2.gz	NHDFTOPFHRNELH-FQEVSTJZSA-N	0	3	348.450	3.046	20	30		EGEDHN
COc1ccc(CN2CCC[C@H](NC(=O)C(C)(C)C)CC2)cc1C#N	ZINC001052886452	1348723676	/nfs/dbraw/zinc/72/36/76/1348723676.db2.gz	KWHDUKYPGZBHHS-KRWDZBQOSA-N	0	3	343.471	3.084	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cc3ccccc3n2CC)CC1	ZINC001052956402	1348770202	/nfs/dbraw/zinc/77/02/02/1348770202.db2.gz	SLCIBZLXEJUSIY-SFHVURJKSA-N	0	3	337.467	3.269	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@H]2CCCCc3ccccc32)CC1	ZINC001052960284	1348772661	/nfs/dbraw/zinc/77/26/61/1348772661.db2.gz	QCEURFFJUCRRPB-CTNGQTDRSA-N	0	3	338.495	3.491	20	30		EGEDHN
C#CCCN1C[C@@H](C)[C@H](NC(=O)c2ccccc2CC(C)(C)C)C1	ZINC001079924911	1357425370	/nfs/dbraw/zinc/42/53/70/1357425370.db2.gz	DORAFDTYOTZFTI-VQIMIIECSA-N	0	3	326.484	3.349	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc(C(F)(F)F)s2)CC1	ZINC001052969817	1348779351	/nfs/dbraw/zinc/77/93/51/1348779351.db2.gz	UTPAHWBSYBQOMV-LBPRGKRZSA-N	0	3	344.402	3.375	20	30		EGEDHN
CC#CC[N@@H+]1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001053065533	1348879431	/nfs/dbraw/zinc/87/94/31/1348879431.db2.gz	HGLAPQQXZUKDEW-MJGOQNOKSA-N	0	3	340.467	3.122	20	30		EGEDHN
CC#CC[N@H+]1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001053065533	1348879437	/nfs/dbraw/zinc/87/94/37/1348879437.db2.gz	HGLAPQQXZUKDEW-MJGOQNOKSA-N	0	3	340.467	3.122	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cnc(C)s2)C1	ZINC001053070926	1348887319	/nfs/dbraw/zinc/88/73/19/1348887319.db2.gz	GQHBFLLLNGYIRM-IRXDYDNUSA-N	0	3	345.512	3.182	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cscc2C)C1	ZINC001053077001	1348895795	/nfs/dbraw/zinc/89/57/95/1348895795.db2.gz	XFUQUPJLBHMPDP-FUHWJXTLSA-N	0	3	330.497	3.396	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cscc2C)C1	ZINC001053077003	1348895973	/nfs/dbraw/zinc/89/59/73/1348895973.db2.gz	XFUQUPJLBHMPDP-WMZOPIPTSA-N	0	3	330.497	3.396	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)Cc2ccc(C)o2)C1	ZINC001053080836	1348902413	/nfs/dbraw/zinc/90/24/13/1348902413.db2.gz	SZLLXSYJCDIOFS-QUCCMNQESA-N	0	3	342.483	3.247	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)COC2CCCCC2)C1	ZINC001053086919	1348909352	/nfs/dbraw/zinc/90/93/52/1348909352.db2.gz	GQLBGSARHZRLBY-UYAOXDASSA-N	0	3	346.515	3.062	20	30		EGEDHN
O=C(C#CC1CC1)N1CCCC[C@@H]1[C@H]1CCCN(C/C=C\Cl)C1	ZINC001053087407	1348910995	/nfs/dbraw/zinc/91/09/95/1348910995.db2.gz	SYEOTPWLGLTSKE-GLDSGCPRSA-N	0	3	334.891	3.245	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2nc(C)sc2C)C1	ZINC001053088207	1348912850	/nfs/dbraw/zinc/91/28/50/1348912850.db2.gz	QWOQDUPJYCMFMO-SJORKVTESA-N	0	3	345.512	3.100	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccc(F)c(F)c2)C1	ZINC001053088438	1348913031	/nfs/dbraw/zinc/91/30/31/1348913031.db2.gz	VIYVMZYHRVATHZ-QFBILLFUSA-N	0	3	346.421	3.305	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2[nH]c(C)cc2C)C1	ZINC001053090306	1348916617	/nfs/dbraw/zinc/91/66/17/1348916617.db2.gz	GNQHCMLMKOTSNC-RBUKOAKNSA-N	0	3	341.499	3.362	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cocc2C)C1	ZINC001053093259	1348920742	/nfs/dbraw/zinc/92/07/42/1348920742.db2.gz	XKODKOBPCKJQTI-IEBWSBKVSA-N	0	3	328.456	3.318	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(F)cc2C)C1	ZINC001053105300	1348941859	/nfs/dbraw/zinc/94/18/59/1348941859.db2.gz	TYGMIXMTDSDTRL-PXNSSMCTSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccc(OC)cc2)C1	ZINC001053105636	1348943503	/nfs/dbraw/zinc/94/35/03/1348943503.db2.gz	QCGAJZHAUOTRKV-AZUAARDMSA-N	0	3	340.467	3.035	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H]1C[C@H]1c1ccsc1)C2	ZINC001054153544	1349157009	/nfs/dbraw/zinc/15/70/09/1349157009.db2.gz	SRJILXCXIPBFFJ-NLWGTHIKSA-N	0	3	342.508	3.189	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc(F)ccc1C)C2	ZINC001054173877	1349175543	/nfs/dbraw/zinc/17/55/43/1349175543.db2.gz	UVEAYWWKLVCLFI-FQEVSTJZSA-N	0	3	328.431	3.086	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@]2(CCN(Cc3ccccn3)C2)C1	ZINC001054174932	1349176291	/nfs/dbraw/zinc/17/62/91/1349176291.db2.gz	DGYMDILOFWHEDZ-OAQYLSRUSA-N	0	3	341.499	3.498	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1c(F)ccc(C)c1F)C2	ZINC001054189386	1349191699	/nfs/dbraw/zinc/19/16/99/1349191699.db2.gz	INHKBTMMEGCSLP-FQEVSTJZSA-N	0	3	346.421	3.225	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1oc(C(C)C)nc1C)C2	ZINC001054210384	1349211414	/nfs/dbraw/zinc/21/14/14/1349211414.db2.gz	NBMUVRURSIQHRR-FQEVSTJZSA-N	0	3	343.471	3.058	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1csc(C(C)C)n1)C2	ZINC001054212638	1349212674	/nfs/dbraw/zinc/21/26/74/1349212674.db2.gz	JWEGQWJFRSECCH-LJQANCHMSA-N	0	3	345.512	3.218	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H]1C[C@H]1c1ccccc1)C2	ZINC001054230132	1349224390	/nfs/dbraw/zinc/22/43/90/1349224390.db2.gz	MWVOUBNXPSHLIL-VWPQPMDRSA-N	0	3	336.479	3.128	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc3ccccc3n1)C2	ZINC001054231677	1349225202	/nfs/dbraw/zinc/22/52/02/1349225202.db2.gz	XFUPVOVEMLLKOB-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(F)cc1Cl)C2	ZINC001054236278	1349229054	/nfs/dbraw/zinc/22/90/54/1349229054.db2.gz	JCGRTJZUFYUONN-SFHVURJKSA-N	0	3	334.822	3.040	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)Cc1ccccc1Cl)C2	ZINC001054237254	1349229749	/nfs/dbraw/zinc/22/97/49/1349229749.db2.gz	VZMJWROQEMGOPS-HXUWFJFHSA-N	0	3	344.886	3.220	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1c[nH]cc1-c1ccccc1)C2	ZINC001054240724	1349234675	/nfs/dbraw/zinc/23/46/75/1349234675.db2.gz	ZWPKITRFXHVPCE-QFIPXVFZSA-N	0	3	347.462	3.243	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1c[nH]c3ccc(C)cc13)C2	ZINC001054246027	1349240273	/nfs/dbraw/zinc/24/02/73/1349240273.db2.gz	KSHQSCLEWGTZIH-NRFANRHFSA-N	0	3	335.451	3.038	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)C1CC(c3ccccc3)C1)C2	ZINC001054246766	1349242293	/nfs/dbraw/zinc/24/22/93/1349242293.db2.gz	ITTZXLVTTAZKLX-QETWGEEDSA-N	0	3	336.479	3.128	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(C(C)C)s1)C2	ZINC001054247424	1349242757	/nfs/dbraw/zinc/24/27/57/1349242757.db2.gz	WITPIIGAFAGOEB-LJQANCHMSA-N	0	3	330.497	3.433	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3coc(CC)n3)cc2C1	ZINC001054262048	1349260163	/nfs/dbraw/zinc/26/01/63/1349260163.db2.gz	HRAFJMSZXAPAKN-UHFFFAOYSA-N	0	3	339.439	3.449	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3ccc(Cl)[nH]3)cc2C1	ZINC001054280856	1349282031	/nfs/dbraw/zinc/28/20/31/1349282031.db2.gz	VBUJEZYQKDREBR-UHFFFAOYSA-N	0	3	329.831	3.490	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccsc2)C[C@@H]1NCc1ccc(C#N)c(F)c1	ZINC001054366433	1349337316	/nfs/dbraw/zinc/33/73/16/1349337316.db2.gz	LOYUTUNGOMYWBI-PXAZEXFGSA-N	0	3	343.427	3.009	20	30		EGEDHN
C[C@H]1CN(C(=O)CC(C)(C)C)C[C@H]1NCc1ccc(C#N)c(F)c1	ZINC001054387252	1349344465	/nfs/dbraw/zinc/34/44/65/1349344465.db2.gz	CIJSUMHAORIFSM-SUMWQHHRSA-N	0	3	331.435	3.070	20	30		EGEDHN
C[C@H]1CN(C(=O)CCC2CCC2)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054525240	1349384562	/nfs/dbraw/zinc/38/45/62/1349384562.db2.gz	NPRBQNPRNKKAAZ-GUYCJALGSA-N	0	3	331.485	3.137	20	30		EGEDHN
C[C@@H]1CN(C(=O)C(F)=C2CCCC2)C[C@H]1NCc1ccc(C#N)s1	ZINC001054572274	1349403533	/nfs/dbraw/zinc/40/35/33/1349403533.db2.gz	WUAWXXYMLHBRRQ-MLGOLLRUSA-N	0	3	347.459	3.354	20	30		EGEDHN
CC(C(=O)N1C[C@H](NCc2ccc(C#N)s2)[C@@H](C)C1)=C1CCC1	ZINC001054638906	1349425016	/nfs/dbraw/zinc/42/50/16/1349425016.db2.gz	RDLLMERDGJGAQU-SJCJKPOMSA-N	0	3	329.469	3.057	20	30		EGEDHN
C[C@H]1CN(C(=O)C(C)(C)C2CC2)C[C@@H]1NCc1ccc(C#N)c(F)c1	ZINC001054990886	1349541169	/nfs/dbraw/zinc/54/11/69/1349541169.db2.gz	BZIUAUWVFRASJL-UGSOOPFHSA-N	0	3	343.446	3.070	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1coc(Br)c1	ZINC001085626691	1358645740	/nfs/dbraw/zinc/64/57/40/1358645740.db2.gz	QXVICTXMTDKALZ-CYBMUJFWSA-N	0	3	341.249	3.155	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCO[C@H]1C1CCN(C(=O)c2ccccc2)CC1	ZINC001071033113	1354440448	/nfs/dbraw/zinc/44/04/48/1354440448.db2.gz	OSUYZHWLGGULFI-MSOLQXFVSA-N	0	3	348.874	3.038	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc(Cl)c(Cl)[nH]1	ZINC001085750292	1358731610	/nfs/dbraw/zinc/73/16/10/1358731610.db2.gz	BCTQRPAKWPRXQZ-LLVKDONJSA-N	0	3	330.259	3.434	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C1CCC(=C)CC1)C[C@H](C)O2	ZINC001071201468	1354501609	/nfs/dbraw/zinc/50/16/09/1354501609.db2.gz	FMPQDTAJZQYAHW-PXNSSMCTSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C1CCC(=C)CC1)C[C@@H](C)O2	ZINC001071201470	1354501953	/nfs/dbraw/zinc/50/19/53/1354501953.db2.gz	FMPQDTAJZQYAHW-YLJYHZDGSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1occc1C(C)C)C[C@@H](C)O2	ZINC001071202577	1354502538	/nfs/dbraw/zinc/50/25/38/1354502538.db2.gz	XDQGJNZDNRKBAG-OXQOHEQNSA-N	0	3	346.471	3.285	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)CN(C(=O)CC1CCCCCC1)C[C@@H](C)O2	ZINC001071215393	1354510352	/nfs/dbraw/zinc/51/03/52/1354510352.db2.gz	AZQJVPHOWUMSNF-WIYYLYMNSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc2c(cccc2OC)[nH]1	ZINC001085967420	1358924043	/nfs/dbraw/zinc/92/40/43/1358924043.db2.gz	LPFPSNJRZXZQOT-HNNXBMFYSA-N	0	3	341.455	3.289	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1ccc(COC(C)C)cc1	ZINC001085966590	1358924539	/nfs/dbraw/zinc/92/45/39/1358924539.db2.gz	OCVFKDNJOVKDLG-IBGZPJMESA-N	0	3	330.472	3.334	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C13CCC(CC1)CC3)C[C@@H](C)O2	ZINC001071244121	1354524656	/nfs/dbraw/zinc/52/46/56/1354524656.db2.gz	PSAWGUWKRFHQOG-SDEKRAFDSA-N	0	3	346.515	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1c(C)cccc1F)C[C@@H](C)O2	ZINC001071245869	1354525863	/nfs/dbraw/zinc/52/58/63/1354525863.db2.gz	KYQCLAQTEBCTHQ-UZLBHIALSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)CC[C@@H]2CCCO2)C1	ZINC001088268404	1359823361	/nfs/dbraw/zinc/82/33/61/1359823361.db2.gz	NSWJNXSYHCYUDR-HOTGVXAUSA-N	0	3	328.884	3.059	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(-n3cccn3)cc2)CC[C@@H]1C	ZINC001071561890	1354765969	/nfs/dbraw/zinc/76/59/69/1354765969.db2.gz	WYBUXLVYDUDBQI-WMZOPIPTSA-N	0	3	338.455	3.031	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2C3CC4CC(C3)CC2C4)CC[C@@H]1C	ZINC001071572030	1354771752	/nfs/dbraw/zinc/77/17/52/1354771752.db2.gz	PBKWUBULSLFNGF-XVSCRIFDSA-N	0	3	328.500	3.051	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2sc3nccn3c2C)CC[C@@H]1C	ZINC001071574292	1354771967	/nfs/dbraw/zinc/77/19/67/1354771967.db2.gz	MXSGONOCYQUWDI-ZFWWWQNUSA-N	0	3	346.500	3.253	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2nccc3ccsc32)CC[C@H]1C	ZINC001071583376	1354778012	/nfs/dbraw/zinc/77/80/12/1354778012.db2.gz	HBOCFOBXKYOCGO-HIFRSBDPSA-N	0	3	329.469	3.455	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccnn2-c2ccccc2)CC[C@H]1C	ZINC001071610736	1354794915	/nfs/dbraw/zinc/79/49/15/1354794915.db2.gz	WLLLBVWWYZJEFZ-IAGOWNOFSA-N	0	3	338.455	3.031	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc(C)n(C(CC)CC)n2)CC[C@H]1C	ZINC001071627276	1354810979	/nfs/dbraw/zinc/81/09/79/1354810979.db2.gz	BROHIWVUMKCARL-NVXWUHKLSA-N	0	3	344.503	3.159	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc(C)cc(OC)c2C)CC[C@H]1C	ZINC001071647444	1354825024	/nfs/dbraw/zinc/82/50/24/1354825024.db2.gz	HCEVWFBKXBANPX-NVXWUHKLSA-N	0	3	330.472	3.471	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc3[nH]nc(C)c3c2)CC[C@@H]1C	ZINC001071676967	1354843888	/nfs/dbraw/zinc/84/38/88/1354843888.db2.gz	QDEGJFFIAPELBA-BBRMVZONSA-N	0	3	326.444	3.030	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2scnc2C(F)F)CC[C@H]1C	ZINC001071675728	1354844108	/nfs/dbraw/zinc/84/41/08/1354844108.db2.gz	GSUOVIDVTMTSLX-MNOVXSKESA-N	0	3	329.416	3.240	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(C)c3cccnc23)CC[C@H]1C	ZINC001071695524	1354858013	/nfs/dbraw/zinc/85/80/13/1354858013.db2.gz	QWHXPLGXJALUIB-IAGOWNOFSA-N	0	3	335.451	3.149	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2(c3cccc(C)c3)CCC2)CC[C@@H]1C	ZINC001071728127	1354883600	/nfs/dbraw/zinc/88/36/00/1354883600.db2.gz	HWHRNOWJCUCVKK-AZUAARDMSA-N	0	3	338.495	3.409	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc3nc(C)n(C)c3c2)CC[C@H]1C	ZINC001071738475	1354888551	/nfs/dbraw/zinc/88/85/51/1354888551.db2.gz	CWAHCQUCHQYDIZ-PBHICJAKSA-N	0	3	340.471	3.041	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2c(F)ccc(F)c2F)CC[C@H]1C	ZINC001071784098	1354932463	/nfs/dbraw/zinc/93/24/63/1354932463.db2.gz	YNTMQQKIGFFQTA-VXGBXAGGSA-N	0	3	326.362	3.263	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccccc2-n2cccc2)CC[C@@H]1C	ZINC001071793161	1354938683	/nfs/dbraw/zinc/93/86/83/1354938683.db2.gz	WASUABFYDCHBHX-ROUUACIJSA-N	0	3	335.451	3.083	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cnc(-c3ccccc3)[nH]2)CC[C@H]1C	ZINC001071857138	1354986366	/nfs/dbraw/zinc/98/63/66/1354986366.db2.gz	DQKKXRAIPYFWHG-WBVHZDCISA-N	0	3	338.455	3.236	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C2(c3cccc(OC)c3)CC2)CC[C@H]1C	ZINC001071857026	1354986776	/nfs/dbraw/zinc/98/67/76/1354986776.db2.gz	CVFFRCOSZRSKDT-AEFFLSMTSA-N	0	3	342.483	3.272	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)Cc2ccccc2OC(C)C)CC[C@@H]1C	ZINC001071890530	1355008805	/nfs/dbraw/zinc/00/88/05/1355008805.db2.gz	NSHWLZLFSGEGJH-WMZOPIPTSA-N	0	3	330.472	3.171	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc3[nH]c(C)nc3c2)CC[C@H]1C	ZINC001071938725	1355034839	/nfs/dbraw/zinc/03/48/39/1355034839.db2.gz	OUAHSVWIUMURGB-CJNGLKHVSA-N	0	3	326.444	3.030	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@H]1CC[C@H](C)N(Cc2ccccc2)C1	ZINC001072023611	1355085761	/nfs/dbraw/zinc/08/57/61/1355085761.db2.gz	UFGFYJSVTMJVRS-AVRDEDQJSA-N	0	3	346.474	3.380	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc(F)c(F)cc2Cl)CC[C@@H]1C	ZINC001072046086	1355101509	/nfs/dbraw/zinc/10/15/09/1355101509.db2.gz	VFHPLVIGOFEHCR-NWDGAFQWSA-N	0	3	340.801	3.224	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc(OC)c(C)c(OC)c2)CC[C@H]1C	ZINC001072050499	1355104420	/nfs/dbraw/zinc/10/44/20/1355104420.db2.gz	YNSKBYYBUGDZOR-PBHICJAKSA-N	0	3	346.471	3.171	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cccc(OCC(C)C)c2)CC[C@@H]1C	ZINC001072058963	1355107490	/nfs/dbraw/zinc/10/74/90/1355107490.db2.gz	WCXOLGWEBVATHD-HKUYNNGSSA-N	0	3	342.483	3.327	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc(C)n(C(C)C)c2C)CC[C@H]1C	ZINC001072063221	1355109418	/nfs/dbraw/zinc/10/94/18/1355109418.db2.gz	SNXLNKNVCDJTRX-QAPCUYQASA-N	0	3	329.488	3.292	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2cc(C3CCCC3)no2)CC[C@@H]1C	ZINC001072087864	1355120460	/nfs/dbraw/zinc/12/04/60/1355120460.db2.gz	CJMKVGBQVHRWBO-GOEBONIOSA-N	0	3	331.460	3.491	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(OCC3CC3)nc2)CC[C@@H]1C	ZINC001072098702	1355128304	/nfs/dbraw/zinc/12/83/04/1355128304.db2.gz	FAEVQUZLHUCNOM-YJBOKZPZSA-N	0	3	343.471	3.029	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2cc3ccccc3n2C)CC[C@H]1C	ZINC001072101275	1355130780	/nfs/dbraw/zinc/13/07/80/1355130780.db2.gz	FOUKCVMTSODZOL-AEFFLSMTSA-N	0	3	339.483	3.266	20	30		EGEDHN
CCCC(=O)N1CC[C@@H](C)[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001072162897	1355160307	/nfs/dbraw/zinc/16/03/07/1355160307.db2.gz	GMAHHAFDWWRDEP-PBHICJAKSA-N	0	3	331.435	3.072	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@@H](C)[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001072176893	1355171396	/nfs/dbraw/zinc/17/13/96/1355171396.db2.gz	RTOIDDUFUWGQCJ-CRAIPNDOSA-N	0	3	345.462	3.318	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](C)[C@H](CNCc2cscn2)C1	ZINC001072334524	1355243828	/nfs/dbraw/zinc/24/38/28/1355243828.db2.gz	CPIFVNRXSFISKT-LSDHHAIUSA-N	0	3	335.517	3.320	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)[C@@H]4CCCC45CC5)C3)C2)c1	ZINC001072850838	1355465177	/nfs/dbraw/zinc/46/51/77/1355465177.db2.gz	AEVFUCWGRBUFRK-IBGZPJMESA-N	0	3	349.478	3.173	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1cnccc1C)C2	ZINC001072945310	1355513441	/nfs/dbraw/zinc/51/34/41/1355513441.db2.gz	YQPCYLYJJGVLMW-LJQANCHMSA-N	0	3	327.472	3.027	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC2(C1)CCN(CCOc1ccccc1)C2	ZINC001072951452	1355518227	/nfs/dbraw/zinc/51/82/27/1355518227.db2.gz	FNXCKMZMERVRKC-HXUWFJFHSA-N	0	3	342.483	3.202	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)C[C@H](C)c3ccc(CC)cc3)C2)C1	ZINC001072975877	1355531922	/nfs/dbraw/zinc/53/19/22/1355531922.db2.gz	NLLQPHPELRMKGC-KRWDZBQOSA-N	0	3	326.484	3.463	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H](Cc3ccccc3)C(C)C)C2)C1	ZINC001072976323	1355532281	/nfs/dbraw/zinc/53/22/81/1355532281.db2.gz	VADWIAFQSMKAAN-HXUWFJFHSA-N	0	3	338.495	3.059	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2ccc(Cl)cc2C)C1	ZINC001073753316	1355888601	/nfs/dbraw/zinc/88/86/01/1355888601.db2.gz	UCMOZNAKNGONCL-INIZCTEOSA-N	0	3	336.863	3.045	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2ccc(C)c(Cl)c2)C1	ZINC001073756312	1355890265	/nfs/dbraw/zinc/89/02/65/1355890265.db2.gz	ZNCGWZXCMUSUQQ-INIZCTEOSA-N	0	3	336.863	3.045	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2ccsc2C(F)F)C1	ZINC001073874195	1355931215	/nfs/dbraw/zinc/93/12/15/1355931215.db2.gz	VTWCCJJEWKGUAJ-LBPRGKRZSA-N	0	3	344.427	3.083	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCCN1C(=O)C=C1CCC1	ZINC001073991901	1356019562	/nfs/dbraw/zinc/01/95/62/1356019562.db2.gz	CEDXGPUXSQGFLP-HXUWFJFHSA-N	0	3	337.467	3.481	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCCN1C(=O)C1=CCCC1	ZINC001073992435	1356020768	/nfs/dbraw/zinc/02/07/68/1356020768.db2.gz	UQDJZENFYXEQLW-HXUWFJFHSA-N	0	3	337.467	3.481	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC[C@H](NCc2cccc(Cl)c2Cl)[C@@H]1C	ZINC001074568529	1356209983	/nfs/dbraw/zinc/20/99/83/1356209983.db2.gz	RAYQCGCLIBARLC-SUNKGSAMSA-N	0	3	340.254	3.232	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CC[C@H]2CN(Cc3ccccc3)C[C@H]21	ZINC001075885045	1356439410	/nfs/dbraw/zinc/43/94/10/1356439410.db2.gz	BITBTUANHFFMAP-AZUAARDMSA-N	0	3	335.451	3.021	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3cc4cc(Cl)ccc4o3)[C@@H]2C1	ZINC001076008868	1356465709	/nfs/dbraw/zinc/46/57/09/1356465709.db2.gz	LEJPBGPVZLEFBE-XJKSGUPXSA-N	0	3	342.826	3.256	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@H]3CCc4c3cccc4Cl)[C@@H]2C1	ZINC001076053222	1356475899	/nfs/dbraw/zinc/47/58/99/1356475899.db2.gz	VMLWEGWWXPRLEI-UCLAIMLFSA-N	0	3	344.886	3.479	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3cc4cc(C)c(C)cc4o3)[C@@H]2C1	ZINC001076467547	1356584930	/nfs/dbraw/zinc/58/49/30/1356584930.db2.gz	MOBNQLLMHWFCRL-FUHWJXTLSA-N	0	3	336.435	3.219	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@@H](C)c3ccc(F)c(F)c3)[C@@H]2C1	ZINC001076590290	1356625911	/nfs/dbraw/zinc/62/59/11/1356625911.db2.gz	FABFNAKWBATJIR-DHSIGJKJSA-N	0	3	334.410	3.177	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@@H](C)Cc3ccccc3C)[C@@H]2C1	ZINC001076619869	1356634800	/nfs/dbraw/zinc/63/48/00/1356634800.db2.gz	ZBNQRVXVFSJNHQ-YSIASYRMSA-N	0	3	326.484	3.282	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(OC)c(C3CC3)c2)C1	ZINC001099099050	1363621401	/nfs/dbraw/zinc/62/14/01/1363621401.db2.gz	NLINUIVUTBUVLU-UWJYYQICSA-N	0	3	340.467	3.343	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2cc[nH]c2C2CC2)C[C@H]1C(F)(F)F	ZINC001099298593	1363737280	/nfs/dbraw/zinc/73/72/80/1363737280.db2.gz	WSYSHXMFUSIKNE-ZIAGYGMSSA-N	0	3	341.377	3.061	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2ccc(C)c(OC)c2)C12CCC2	ZINC001078676411	1357050456	/nfs/dbraw/zinc/05/04/56/1357050456.db2.gz	WFPFXBSCBPFYHI-SJORKVTESA-N	0	3	348.874	3.387	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2C[C@@H](NCc3cnoc3C)C23CCC3)CC1	ZINC001078716578	1357062731	/nfs/dbraw/zinc/06/27/31/1357062731.db2.gz	VGKTVVHWVBZFBQ-QZTJIDSGSA-N	0	3	343.471	3.246	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2cnoc2C(C)C)C12CCC2	ZINC001078768274	1357074830	/nfs/dbraw/zinc/07/48/30/1357074830.db2.gz	ODURMFBBRQGHBZ-KGLIPLIRSA-N	0	3	337.851	3.181	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)C2(F)CCCCC2)C12CCC2	ZINC001078771173	1357076242	/nfs/dbraw/zinc/07/62/42/1357076242.db2.gz	QJTGBOHCAWRFTN-UONOGXRCSA-N	0	3	328.859	3.428	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2csc(Cl)n2)C12CCC2	ZINC001078773176	1357077814	/nfs/dbraw/zinc/07/78/14/1357077814.db2.gz	CBAHHCFWRRYFFI-WDEREUQCSA-N	0	3	346.283	3.180	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2cc(C)n(CC3CC3)c2C)C1	ZINC001080796946	1357739874	/nfs/dbraw/zinc/73/98/74/1357739874.db2.gz	ZRGTVOIQGSPEDK-AUUYWEPGSA-N	0	3	329.488	3.141	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2cscc2Cl)C[C@H]1c1ccccc1	ZINC001081129995	1357843833	/nfs/dbraw/zinc/84/38/33/1357843833.db2.gz	QBEDJKXNSZDUIK-WMLDXEAASA-N	0	3	344.867	3.233	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C[C@@H]2CCCC2(F)F)C[C@H]1c1ccccc1	ZINC001081168241	1357847219	/nfs/dbraw/zinc/84/72/19/1357847219.db2.gz	NVMUIPRYQPKMAQ-OKZBNKHCSA-N	0	3	346.421	3.029	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2cccc(Cl)c2)C[C@H]1c1ccccc1	ZINC001081216488	1357849898	/nfs/dbraw/zinc/84/98/98/1357849898.db2.gz	DICFXEBCJMLZKV-RBUKOAKNSA-N	0	3	338.838	3.171	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2cc(C)c(CC)s2)[C@H](OC)C1	ZINC001082360888	1358023710	/nfs/dbraw/zinc/02/37/10/1358023710.db2.gz	YPNVTBUJGBVGOP-HUUCEWRRSA-N	0	3	336.501	3.014	20	30		EGEDHN
C=C[C@H](C(=O)N1C[C@@H](C)[C@H](NCc2ccns2)C1)c1ccccc1	ZINC001082937293	1358106120	/nfs/dbraw/zinc/10/61/20/1358106120.db2.gz	RBXFBWKDWAKMPY-FHLIZLRMSA-N	0	3	341.480	3.049	20	30		EGEDHN
C[C@H](CC(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1)C1CC1	ZINC001082945899	1358107238	/nfs/dbraw/zinc/10/72/38/1358107238.db2.gz	JJRYTAUWAZTZGU-PJIJBLCYSA-N	0	3	343.446	3.070	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)CCC3CCCCCC3)[C@H]2C1	ZINC001083145982	1358119639	/nfs/dbraw/zinc/11/96/39/1358119639.db2.gz	LSELGFBXBQFDLF-RBUKOAKNSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)C3C4CC5CC(C4)CC3C5)[C@@H]2C1	ZINC001084409907	1358209112	/nfs/dbraw/zinc/20/91/12/1358209112.db2.gz	OOCJIKFQSGCUQO-YXVJBPKESA-N	0	3	328.500	3.168	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)C3CCc4ccccc4CC3)[C@@H]2C1	ZINC001084473123	1358221782	/nfs/dbraw/zinc/22/17/82/1358221782.db2.gz	KGWRFKCLEKNZLT-NHCUHLMSSA-N	0	3	338.495	3.290	20	30		EGEDHN
C#Cc1ccc(C(=O)N2C[C@H]3CCN(Cc4ccccc4C)C[C@H]32)cc1	ZINC001084567960	1358240252	/nfs/dbraw/zinc/24/02/52/1358240252.db2.gz	RQFHKNZYAZXXLW-FGZHOGPDSA-N	0	3	344.458	3.323	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)Cc3c(C)[nH]c4ccccc43)[C@@H]2C1	ZINC001084622312	1358258205	/nfs/dbraw/zinc/25/82/05/1358258205.db2.gz	RZMFUYRRNOILNP-OXQOHEQNSA-N	0	3	337.467	3.128	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)[C@@H](C)Cc3ccccc3Cl)[C@@H]2C1	ZINC001084692956	1358282766	/nfs/dbraw/zinc/28/27/66/1358282766.db2.gz	HFAZZPLCZAYWKS-KVSKMBFKSA-N	0	3	344.886	3.075	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3coc(C4CCCC4)n3)[C@@H]2C1	ZINC001084747738	1358298696	/nfs/dbraw/zinc/29/86/96/1358298696.db2.gz	DCGGHIGLSXSZEC-SJLPKXTDSA-N	0	3	343.471	3.445	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)[C@@H](C)c3cc4ccccc4o3)[C@@H]2C1	ZINC001084765376	1358303880	/nfs/dbraw/zinc/30/38/80/1358303880.db2.gz	WYTODGZKHCWPBU-CGTJXYLNSA-N	0	3	336.435	3.092	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)C[C@@H]3CCCc4ccccc43)[C@@H]2C1	ZINC001084788896	1358310278	/nfs/dbraw/zinc/31/02/78/1358310278.db2.gz	HUSCWUGVWQLIIF-QKNQBKEWSA-N	0	3	336.479	3.053	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)Cc3ccc4c(c3)CCCC4)[C@@H]2C1	ZINC001084822807	1358320461	/nfs/dbraw/zinc/32/04/61/1358320461.db2.gz	SRRASUSEPUKMLN-NHCUHLMSSA-N	0	3	338.495	3.217	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@@H](C)Cc3cccc(F)c3)[C@@H]2C1	ZINC001084862746	1358333779	/nfs/dbraw/zinc/33/37/79/1358333779.db2.gz	ABTMCLAOAZRURP-KVSKMBFKSA-N	0	3	330.447	3.113	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)[C@H](C)Cc3cccc(Cl)c3)[C@@H]2C1	ZINC001084871084	1358336546	/nfs/dbraw/zinc/33/65/46/1358336546.db2.gz	SHPMMSSXHGUXPS-SZVBFZGTSA-N	0	3	344.886	3.075	20	30		EGEDHN
CC1CC(C(=O)N2CC[C@H]3CCN(Cc4ccc(C#N)cc4)[C@H]3C2)C1	ZINC001084917932	1358349207	/nfs/dbraw/zinc/34/92/07/1358349207.db2.gz	VSQOEFYJMJSFDS-TXQCFWEHSA-N	0	3	337.467	3.027	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@H]3CC[C@H](c4ccccc4)O3)C[C@@H]21	ZINC001084942015	1358352056	/nfs/dbraw/zinc/35/20/56/1358352056.db2.gz	UNMSAWCBQFVNPY-MDNKFWRPSA-N	0	3	340.467	3.016	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3c3ccccc3CC)C[C@@H]21	ZINC001085018882	1358369115	/nfs/dbraw/zinc/36/91/15/1358369115.db2.gz	VKYXPHLKYLMXIC-PMXSJFBMSA-N	0	3	338.495	3.461	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)C[C@@H]3CCCc4ccccc43)C[C@@H]21	ZINC001085079368	1358385607	/nfs/dbraw/zinc/38/56/07/1358385607.db2.gz	AKOOBXZVEOPRBS-DYXWJJEUSA-N	0	3	336.479	3.053	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCCC[C@H]2NC(=O)c2ccco2)c(F)c1	ZINC001085119798	1358398302	/nfs/dbraw/zinc/39/83/02/1358398302.db2.gz	DSMVYCKFDBHWJJ-IAGOWNOFSA-N	0	3	341.386	3.121	20	30		EGEDHN
CC1CC(C(=O)N[C@@H]2CCCC[C@H]2NCc2ccc(C#N)cc2F)C1	ZINC001085166032	1358420273	/nfs/dbraw/zinc/42/02/73/1358420273.db2.gz	HUMUNKAGPZXLBT-LNTOWLRNSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1nncc2ccccc21	ZINC001085269993	1358448110	/nfs/dbraw/zinc/44/81/10/1358448110.db2.gz	DYPGOBJICKLMNY-HZPDHXFCSA-N	0	3	344.846	3.013	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cccc(F)c1F	ZINC001085314177	1358462778	/nfs/dbraw/zinc/46/27/78/1358462778.db2.gz	JKFVQGVBSVELNU-ZIAGYGMSSA-N	0	3	328.790	3.348	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCC[C@H]2NCc2cc(OC)ns2)C1	ZINC001085324963	1358467916	/nfs/dbraw/zinc/46/79/16/1358467916.db2.gz	RRRUOLYEQGKDOI-HUUCEWRRSA-N	0	3	349.500	3.025	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1CCc2ccccc2O1	ZINC001085366946	1358480125	/nfs/dbraw/zinc/48/01/25/1358480125.db2.gz	MLGOFBHMSCBXKF-NUJGCVRESA-N	0	3	348.874	3.150	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cc2c([nH]1)CCCC2	ZINC001085385743	1358485196	/nfs/dbraw/zinc/48/51/96/1358485196.db2.gz	OEHLBDJLQITNCH-HZPDHXFCSA-N	0	3	335.879	3.277	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H]1Cc2cccc(C)c2O1	ZINC001085444777	1358501666	/nfs/dbraw/zinc/50/16/66/1358501666.db2.gz	PMEMHWSXQCIAIK-BRWVUGGUSA-N	0	3	348.874	3.068	20	30		EGEDHN
CN(C[C@@H]1CCN1CCC1CCCCCC1)C(=O)c1cc(C#N)c[nH]1	ZINC001085534455	1358571450	/nfs/dbraw/zinc/57/14/50/1358571450.db2.gz	KXIRIKXFOHPCEC-SFHVURJKSA-N	0	3	342.487	3.393	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc(C)c(OC)c(C)c1	ZINC001085611580	1358633873	/nfs/dbraw/zinc/63/38/73/1358633873.db2.gz	WHPVXWGKCZJLLO-GOSISDBHSA-N	0	3	330.472	3.425	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ncoc1-c1ccccc1	ZINC001085630399	1358647979	/nfs/dbraw/zinc/64/79/79/1358647979.db2.gz	SSFVNUPCHKHVCN-KRWDZBQOSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@@H]1CCOc2c(F)cccc21	ZINC001085714472	1358705316	/nfs/dbraw/zinc/70/53/16/1358705316.db2.gz	LHMMQQGIGHJHPS-NVXWUHKLSA-N	0	3	346.446	3.191	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc(C)nc1C1CC1	ZINC001085747666	1358729141	/nfs/dbraw/zinc/72/91/41/1358729141.db2.gz	MJPXZRLSOVOFBB-KRWDZBQOSA-N	0	3	327.472	3.380	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@H]1CCCc2cccnc21	ZINC001085781334	1358756932	/nfs/dbraw/zinc/75/69/32/1358756932.db2.gz	TXKBPXNRQDRDGE-MSOLQXFVSA-N	0	3	327.472	3.000	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1ccc(C(C)C)nc1CC	ZINC001085819229	1358793309	/nfs/dbraw/zinc/79/33/09/1358793309.db2.gz	SZRDIJJTCRKJCK-MRXNPFEDSA-N	0	3	329.488	3.490	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1c(F)cc(OC)cc1F	ZINC001085833086	1358799605	/nfs/dbraw/zinc/79/96/05/1358799605.db2.gz	AHZSMZQVGRTAQQ-CYBMUJFWSA-N	0	3	338.398	3.086	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccoc1Br	ZINC001085912112	1358873188	/nfs/dbraw/zinc/87/31/88/1358873188.db2.gz	XBJGQYGNLHYCPR-LBPRGKRZSA-N	0	3	341.249	3.155	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccoc1Br	ZINC001085912111	1358873226	/nfs/dbraw/zinc/87/32/26/1358873226.db2.gz	XBJGQYGNLHYCPR-GFCCVEGCSA-N	0	3	341.249	3.155	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc3cc(F)ccc3[nH]2)C1	ZINC001086162693	1359011982	/nfs/dbraw/zinc/01/19/82/1359011982.db2.gz	AXZQAFXZCKDMFU-VDISTLRHSA-N	0	3	335.810	3.158	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2nsc3ccc(C)cc32)C1	ZINC001086166811	1359012923	/nfs/dbraw/zinc/01/29/23/1359012923.db2.gz	RRBGNDUQLRDXIP-BETUJISGSA-N	0	3	349.887	3.455	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccccc2-n2cccc2)C1	ZINC001086186458	1359020353	/nfs/dbraw/zinc/02/03/53/1359020353.db2.gz	YFGATRMDCXYHJM-IYBDPMFKSA-N	0	3	343.858	3.328	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cnn([C@H](C)CC)c2C)C1	ZINC001086250297	1359042397	/nfs/dbraw/zinc/04/23/97/1359042397.db2.gz	MIZUSOMJFLTBEJ-YUELXQCFSA-N	0	3	338.883	3.013	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2coc3ccc(F)cc23)C1	ZINC001086262713	1359046845	/nfs/dbraw/zinc/04/68/45/1359046845.db2.gz	JJEFLQXWYWLNKG-BJHJDKERSA-N	0	3	336.794	3.422	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2csc3c2CCCC3)C1	ZINC001086268125	1359049041	/nfs/dbraw/zinc/04/90/41/1359049041.db2.gz	OSJGTXHCCKQDFT-BETUJISGSA-N	0	3	338.904	3.477	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cnc(C(C)(C)C)s2)C1	ZINC001086279041	1359051935	/nfs/dbraw/zinc/05/19/35/1359051935.db2.gz	HJHVPMYVAKRCSJ-TXEJJXNPSA-N	0	3	341.908	3.291	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)c2ccccc2C)C1	ZINC001086296702	1359059445	/nfs/dbraw/zinc/05/94/45/1359059445.db2.gz	WCNDKJOFPMZYDS-HDJSIYSDSA-N	0	3	337.261	3.002	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(-n3cccc3)cc2)C1	ZINC001086421036	1359092625	/nfs/dbraw/zinc/09/26/25/1359092625.db2.gz	YEMLZCXORPMMIL-JCNLHEQBSA-N	0	3	343.858	3.328	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2C[C@H](NCc3ncccc3C)C2)CC1	ZINC001086467466	1359108580	/nfs/dbraw/zinc/10/85/80/1359108580.db2.gz	FOGRRSMKEVMUBC-SAABIXHNSA-N	0	3	327.472	3.121	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)[C@H]2CCC(C)(C)C2)C1	ZINC001086468427	1359109137	/nfs/dbraw/zinc/10/91/37/1359109137.db2.gz	BKEUKWSCFRBGHN-IHRRRGAJSA-N	0	3	343.309	3.206	20	30		EGEDHN
CC[C@@]1(C)C[C@H]1C(=O)NC[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001086520416	1359128487	/nfs/dbraw/zinc/12/84/87/1359128487.db2.gz	FCAVKWUNBPCAMK-VERUCKTNSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)C23CC(c4ccccc4)(C2)C3)C1	ZINC001086561239	1359146322	/nfs/dbraw/zinc/14/63/22/1359146322.db2.gz	PRKUTGZOLUMCMD-GKTFFFRKSA-N	0	3	344.886	3.345	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@@H]2Cc3c2cccc3Cl)C1	ZINC001086562573	1359148276	/nfs/dbraw/zinc/14/82/76/1359148276.db2.gz	XWOHLCJQJSXKJW-LALPHHSUSA-N	0	3	339.266	3.217	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)C[C@@H]2C=CCCC2)C1	ZINC001086594783	1359159133	/nfs/dbraw/zinc/15/91/33/1359159133.db2.gz	SYLYEZINADPDFB-HLAWJBBLSA-N	0	3	336.479	3.340	20	30		EGEDHN
C=C(C)CCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2nccs2)C1	ZINC001086616483	1359165108	/nfs/dbraw/zinc/16/51/08/1359165108.db2.gz	HAIPLARRNBJWMX-DLBZAZTESA-N	0	3	341.480	3.307	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)C2CCC=CCC2)C1	ZINC001086624366	1359168276	/nfs/dbraw/zinc/16/82/76/1359168276.db2.gz	ATFSEZJLBSXIDP-LEWJYISDSA-N	0	3	336.479	3.340	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ncc(Cl)s2)C1	ZINC001086757849	1359196074	/nfs/dbraw/zinc/19/60/74/1359196074.db2.gz	XQDNWHWLIURVOI-VHSXEESVSA-N	0	3	334.272	3.037	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccc3cnccc3c2)C1	ZINC001086847467	1359213239	/nfs/dbraw/zinc/21/32/39/1359213239.db2.gz	VICSSAIHJGYFDP-KBXCAEBGSA-N	0	3	343.858	3.475	20	30		EGEDHN
C=CCC[NH+]1CCC2(C[C@H](C)N(C(=O)c3ccccc3[O-])C2)CC1	ZINC001086904680	1359234059	/nfs/dbraw/zinc/23/40/59/1359234059.db2.gz	KMYVGHLTGRMYNA-INIZCTEOSA-N	0	3	328.456	3.285	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H]3CCCC(F)(F)C3)C2)CC1	ZINC001086941086	1359263043	/nfs/dbraw/zinc/26/30/43/1359263043.db2.gz	IPYZLPHMCROVES-JKSUJKDBSA-N	0	3	338.442	3.148	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H](C)c3cccs3)C2)CC1	ZINC001086941963	1359263785	/nfs/dbraw/zinc/26/37/85/1359263785.db2.gz	FKHHSSHFMWFXIT-HOTGVXAUSA-N	0	3	330.497	3.188	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)[C@H]3CC34CCCC4)C2)CC1	ZINC001086951575	1359271820	/nfs/dbraw/zinc/27/18/20/1359271820.db2.gz	JOMGEICHTBJQSW-ZWKOTPCHSA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)Cc3ccc(Cl)cc3)C2)CC1	ZINC001086955756	1359276623	/nfs/dbraw/zinc/27/66/23/1359276623.db2.gz	VPPKZPNQZCECGN-MRXNPFEDSA-N	0	3	344.886	3.219	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H](C)c3ccccc3C)C2)CC1	ZINC001086956808	1359277499	/nfs/dbraw/zinc/27/74/99/1359277499.db2.gz	XYWFBVFNVBVBJE-OALUTQOASA-N	0	3	338.495	3.435	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)CC(C3CC3)C3CC3)C2)CC1	ZINC001086958095	1359278676	/nfs/dbraw/zinc/27/86/76/1359278676.db2.gz	DJQFXUFHOQNIBK-INIZCTEOSA-N	0	3	328.500	3.149	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H]3CC4CCC3CC4)C2)CC1	ZINC001086958509	1359279258	/nfs/dbraw/zinc/27/92/58/1359279258.db2.gz	SXSCZABIBVLYPZ-LWSMDNFKSA-N	0	3	328.500	3.149	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC001087114891	1359293361	/nfs/dbraw/zinc/29/33/61/1359293361.db2.gz	LTUWQIPRIZCGHP-QAPCUYQASA-N	0	3	343.446	3.380	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccccc1Cl	ZINC001087136442	1359301585	/nfs/dbraw/zinc/30/15/85/1359301585.db2.gz	USDNLRZEOGNHNU-YCPHGPKFSA-N	0	3	333.863	3.216	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC[C@@H](C)C[C@H]1CNCc1cc2ccccc2o1	ZINC001087136547	1359302000	/nfs/dbraw/zinc/30/20/00/1359302000.db2.gz	YOGDPJSORNMUOR-INMHGKMJSA-N	0	3	339.439	3.309	20	30		EGEDHN
CC1CC(C(=O)N2CC[C@@H](C)C[C@H]2CNCc2ccc(C#N)s2)C1	ZINC001087147069	1359306930	/nfs/dbraw/zinc/30/69/30/1359306930.db2.gz	GEQSHCPJDLJCGE-LMPOIIKSSA-N	0	3	345.512	3.383	20	30		EGEDHN
C=C(C)C[N@@H+]1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccccc1[O-]	ZINC001087271539	1359345267	/nfs/dbraw/zinc/34/52/67/1359345267.db2.gz	SSCFMEKYLNLVPL-BPQIPLTHSA-N	0	3	328.456	3.187	20	30		EGEDHN
C=C(C)C[N@H+]1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccccc1[O-]	ZINC001087271539	1359345270	/nfs/dbraw/zinc/34/52/70/1359345270.db2.gz	SSCFMEKYLNLVPL-BPQIPLTHSA-N	0	3	328.456	3.187	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3nc(C)sc3C)C(C)(C)[C@H]21	ZINC001087291343	1359370544	/nfs/dbraw/zinc/37/05/44/1359370544.db2.gz	SIJJDDIURIJKLM-PVAVHDDUSA-N	0	3	345.512	3.002	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cccc(C(C)C)n3)C(C)(C)[C@H]21	ZINC001087294991	1359375748	/nfs/dbraw/zinc/37/57/48/1359375748.db2.gz	BXSZFQVWFCGMEU-MNEFBYGVSA-N	0	3	339.483	3.057	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)Cc3cccc(C)c3)C(C)(C)[C@H]21	ZINC001087299849	1359382480	/nfs/dbraw/zinc/38/24/80/1359382480.db2.gz	CIIVPUOTOGXEND-NRSPTQNISA-N	0	3	338.495	3.166	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc[nH]c3CCC)C(C)(C)[C@H]21	ZINC001087300615	1359383118	/nfs/dbraw/zinc/38/31/18/1359383118.db2.gz	NYGWROJYEJPXLC-NEWSRXKRSA-N	0	3	341.499	3.209	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc[nH]c3CCC)C(C)(C)[C@H]21	ZINC001087300617	1359383350	/nfs/dbraw/zinc/38/33/50/1359383350.db2.gz	NYGWROJYEJPXLC-QRQLOZEOSA-N	0	3	341.499	3.209	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3cccc(F)c3F)C(C)(C)[C@H]21	ZINC001087301071	1359384066	/nfs/dbraw/zinc/38/40/66/1359384066.db2.gz	VTAYMJHGZCWKEM-JLSDUUJJSA-N	0	3	346.421	3.207	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)Cc3ccc(C)c(C)c3)C(C)(C)[C@@H]21	ZINC001087316423	1359406755	/nfs/dbraw/zinc/40/67/55/1359406755.db2.gz	RHBFRJIOHJXOEW-HMXCVIKNSA-N	0	3	338.495	3.084	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3[C@@H](C2)[C@@H]2CC[C@H]3CN2C/C=C\Cl)C1	ZINC001087390115	1359444953	/nfs/dbraw/zinc/44/49/53/1359444953.db2.gz	VTODLRMSVGJZMX-NSEZVHRPSA-N	0	3	334.891	3.264	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)C2CC3(CC3)C2)C1	ZINC001087436909	1359465282	/nfs/dbraw/zinc/46/52/82/1359465282.db2.gz	RCLGYBVMQAGCJR-WOJBJXKFSA-N	0	3	336.479	3.174	20	30		EGEDHN
C=CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)c2oncc2C)C1	ZINC001087441034	1359466731	/nfs/dbraw/zinc/46/67/31/1359466731.db2.gz	JQJPWWRSWMVTNK-QZTJIDSGSA-N	0	3	339.439	3.147	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)Cc2coc3cc(F)ccc23)[C@H]1CC	ZINC001087569434	1359536405	/nfs/dbraw/zinc/53/64/05/1359536405.db2.gz	WBTLIXKOILENHI-DLBZAZTESA-N	0	3	330.403	3.270	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(C)cc2Cl)[C@H]1CC	ZINC001087628580	1359563400	/nfs/dbraw/zinc/56/34/00/1359563400.db2.gz	BTXOLOLPZMZZAH-ZWKOTPCHSA-N	0	3	332.875	3.183	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cc(C)n([C@@H](C)C3CC3)n2)[C@H]1CC	ZINC001087635075	1359565800	/nfs/dbraw/zinc/56/58/00/1359565800.db2.gz	JCMNDYLZNXWIFW-VDZJLULYSA-N	0	3	344.503	3.321	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(C(F)F)cc2)[C@H]1CC	ZINC001087655443	1359574551	/nfs/dbraw/zinc/57/45/51/1359574551.db2.gz	BVZDXLRJSOOEIM-DLBZAZTESA-N	0	3	334.410	3.159	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)[C@H]2CC23CCC3)CCN1Cc1ccc(C#N)cc1	ZINC001087742819	1359621976	/nfs/dbraw/zinc/62/19/76/1359621976.db2.gz	FEUJNXWALAECLD-CEXWTWQISA-N	0	3	337.467	3.218	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)[C@@H]2CC23CCC3)CCN1Cc1ccc(C#N)cc1	ZINC001087742820	1359623251	/nfs/dbraw/zinc/62/32/51/1359623251.db2.gz	FEUJNXWALAECLD-GBESFXJTSA-N	0	3	337.467	3.218	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)[C@@]2(c3ccccc3)C[C@H](F)C2)[C@H]1CC	ZINC001087812747	1359660241	/nfs/dbraw/zinc/66/02/41/1359660241.db2.gz	FGRBMMHVIFDNEL-GNBUJSLZSA-N	0	3	330.447	3.211	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ncccc2OC(C)C)[C@H]1CC	ZINC001087813853	1359660758	/nfs/dbraw/zinc/66/07/58/1359660758.db2.gz	KLFLMWMQHSKJFE-JKSUJKDBSA-N	0	3	331.460	3.028	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)C2CC(c3cccc(F)c3)C2)[C@H]1CC	ZINC001087850247	1359681005	/nfs/dbraw/zinc/68/10/05/1359681005.db2.gz	UZZYHFSCOHKJHV-YVZJPGBNSA-N	0	3	330.447	3.474	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CN(C(=O)CCC4CC4)C[C@@H]3C2)c1	ZINC001087913626	1359704883	/nfs/dbraw/zinc/70/48/83/1359704883.db2.gz	ZONFXPDLUWVTOY-UXHICEINSA-N	0	3	337.467	3.029	20	30		EGEDHN
C[C@@H](c1ccc(F)cc1)N1CC[C@@H]2CN(C(=O)C#CC3CC3)C[C@@H]2C1	ZINC001087959461	1359719599	/nfs/dbraw/zinc/71/95/99/1359719599.db2.gz	ZKZBGWKTHQEFMX-IPELMVKDSA-N	0	3	340.442	3.080	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3cscc3C(F)F)C[C@@H]2C1	ZINC001087968950	1359723070	/nfs/dbraw/zinc/72/30/70/1359723070.db2.gz	TUOWZJIEOCJLNZ-OLZOCXBDSA-N	0	3	338.423	3.103	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)CC(C3CCC3)C3CCC3)C[C@@H]2C1	ZINC001088108854	1359758510	/nfs/dbraw/zinc/75/85/10/1359758510.db2.gz	XCUMTVYOOLZNBV-UXHICEINSA-N	0	3	342.527	3.397	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CN(C(=O)[C@H]4CC45CCC5)C[C@@H]3C2)cc1	ZINC001088123313	1359763874	/nfs/dbraw/zinc/76/38/74/1359763874.db2.gz	MKAQUQRBZUYRKG-HSALFYBXSA-N	0	3	349.478	3.029	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3cc(Cl)cc(Cl)c3)C[C@@H]2C1	ZINC001088180915	1359784113	/nfs/dbraw/zinc/78/41/13/1359784113.db2.gz	IUMUZZRBMHLBON-OCCSQVGLSA-N	0	3	337.250	3.021	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3cc4c(s3)CCCC4)C[C@@H]2C1	ZINC001088191327	1359788253	/nfs/dbraw/zinc/78/82/53/1359788253.db2.gz	URRYXIJKZSOGFQ-SJORKVTESA-N	0	3	342.508	3.044	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)[C@H](CC)c3ccc(Cl)cc3)C[C@@H]2C1	ZINC001088210162	1359796816	/nfs/dbraw/zinc/79/68/16/1359796816.db2.gz	ZIEKNRYXRLADGQ-ZIFCJYIRSA-N	0	3	344.886	3.247	20	30		EGEDHN
C=CCN1CC[C@@H](OCC2CCN(C(=O)CC3=CCCCC3)CC2)C1	ZINC001088230669	1359808882	/nfs/dbraw/zinc/80/88/82/1359808882.db2.gz	WPFCRJQOLXNQAP-HXUWFJFHSA-N	0	3	346.515	3.392	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](CNCc2csc(C)n2)[C@@H](C)C1	ZINC001184232788	1387418005	/nfs/dbraw/zinc/41/80/05/1387418005.db2.gz	XRUSVSTZWDMNQQ-DOTOQJQBSA-N	0	3	347.528	3.219	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2ncc(F)cc2F)C1	ZINC001088337245	1359832715	/nfs/dbraw/zinc/83/27/15/1359832715.db2.gz	ZSOCNNMBNOVVAB-CYBMUJFWSA-N	0	3	343.805	3.087	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)[C@H]2CCc3cccnc32)C1	ZINC001088370101	1359852954	/nfs/dbraw/zinc/85/29/54/1359852954.db2.gz	AHGCJKREJDAZMB-IRXDYDNUSA-N	0	3	347.890	3.225	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCCCC[C@@H](NCc2cnoc2C)C1	ZINC001088374224	1359855321	/nfs/dbraw/zinc/85/53/21/1359855321.db2.gz	BKZLQJNCFIAHED-IEBWSBKVSA-N	0	3	333.476	3.446	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCCCC[C@H](NCc2cnoc2C)C1	ZINC001088374226	1359855776	/nfs/dbraw/zinc/85/57/76/1359855776.db2.gz	BKZLQJNCFIAHED-PKOBYXMFSA-N	0	3	333.476	3.446	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2cncnc2C2CC2)C1	ZINC001088420715	1359890487	/nfs/dbraw/zinc/89/04/87/1359890487.db2.gz	XALXRUAPUASIHP-HNNXBMFYSA-N	0	3	348.878	3.081	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)Cc2ccc(C)nc2)C1	ZINC001088426979	1359895134	/nfs/dbraw/zinc/89/51/34/1359895134.db2.gz	KLQIRBFOLNIKBK-KRWDZBQOSA-N	0	3	335.879	3.046	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)[C@@H]2CC=CC[C@H]2C(F)(F)F)[C@H]1C	ZINC001088663636	1360005323	/nfs/dbraw/zinc/00/53/23/1360005323.db2.gz	MXPBKCZBEGMYCP-TUVASFSCSA-N	0	3	330.394	3.286	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)C(C)(C)c2ccc(Cl)cc2)[C@H]1C	ZINC001088831980	1360068495	/nfs/dbraw/zinc/06/84/95/1360068495.db2.gz	OFAJSUAWAXJVKW-PBHICJAKSA-N	0	3	332.875	3.220	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3ccc(COC)cc3)[C@@H]2C)C1	ZINC001088840634	1360075068	/nfs/dbraw/zinc/07/50/68/1360075068.db2.gz	PWHIGKQPDDGMDF-APWZRJJASA-N	0	3	342.483	3.268	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)Cc2c[nH]c3c2cccc3C)[C@H]1C	ZINC001088896503	1360095700	/nfs/dbraw/zinc/09/57/00/1360095700.db2.gz	MGUXXRPQNZYUTO-QAPCUYQASA-N	0	3	325.456	3.174	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccc3nc(C)sc3c2)[C@H]1C	ZINC001088957433	1360114664	/nfs/dbraw/zinc/11/46/64/1360114664.db2.gz	BXOVNADGUIUWOM-DOMZBBRYSA-N	0	3	329.469	3.373	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cnn(C3CCCC3)c2C)[C@H]1C	ZINC001088968997	1360119485	/nfs/dbraw/zinc/11/94/85/1360119485.db2.gz	BJUWYCRXBULHKC-QAPCUYQASA-N	0	3	330.476	3.075	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@H]1C	ZINC001088999036	1360131415	/nfs/dbraw/zinc/13/14/15/1360131415.db2.gz	DGZLZZQURXFSRF-DOMZBBRYSA-N	0	3	326.362	3.474	20	30		EGEDHN
CN(Cc1ccccc1)C[C@@H]1CCCCN1C(=O)c1ccc(C#N)[nH]1	ZINC001089160581	1360216851	/nfs/dbraw/zinc/21/68/51/1360216851.db2.gz	HJXFNDAGJCAFIA-SFHVURJKSA-N	0	3	336.439	3.013	20	30		EGEDHN
CC(C)(S)CNC(=O)[C@H]1CCCN(Cc2ccc(Cl)cc2)C1	ZINC001184403822	1387450453	/nfs/dbraw/zinc/45/04/53/1387450453.db2.gz	FUHJBZAUVTWIIH-AWEZNQCLSA-N	0	3	340.920	3.377	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2nccc3ccsc32)CC(C)(C)C1	ZINC001089413244	1360408772	/nfs/dbraw/zinc/40/87/72/1360408772.db2.gz	WPQPPZMQXDJVEC-OAHLLOKOSA-N	0	3	341.480	3.150	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2ccccc2CC)CC(C)(C)C1	ZINC001089416042	1360410608	/nfs/dbraw/zinc/41/06/08/1360410608.db2.gz	FWMFVEAJUALRMZ-LJQANCHMSA-N	0	3	326.484	3.032	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc(F)cc3ccoc32)CC(C)(C)C1	ZINC001089425626	1360418700	/nfs/dbraw/zinc/41/87/00/1360418700.db2.gz	BSCLEILZSXCPSB-INIZCTEOSA-N	0	3	342.414	3.426	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc(F)cc(Cl)c2)CC(C)(C)C1	ZINC001089501049	1360475242	/nfs/dbraw/zinc/47/52/42/1360475242.db2.gz	YVLTWCZDOIOXGN-INIZCTEOSA-N	0	3	336.838	3.333	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2ccc(Cl)cc2)CC(C)(C)C1	ZINC001089551205	1360502626	/nfs/dbraw/zinc/50/26/26/1360502626.db2.gz	DEKCBGZBDNKQKI-KRWDZBQOSA-N	0	3	332.875	3.123	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)n(C(C)C)n2)CC(C)(C)C1	ZINC001089570803	1360516108	/nfs/dbraw/zinc/51/61/08/1360516108.db2.gz	UMWUPLVQXJVQTR-KRWDZBQOSA-N	0	3	344.503	3.016	20	30		EGEDHN
C=C(C)CCN1CC(C)(C)CC[C@H]1CNC(=O)c1snnc1C	ZINC001089607677	1360530314	/nfs/dbraw/zinc/53/03/14/1360530314.db2.gz	PWOXVVGRUVADSH-AWEZNQCLSA-N	0	3	336.505	3.033	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cccnc1C1CC1	ZINC001089665094	1360575486	/nfs/dbraw/zinc/57/54/86/1360575486.db2.gz	TYHPBTJISMPKRY-QGZVFWFLSA-N	0	3	339.483	3.203	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccn2ccnc2c1	ZINC001089668365	1360577962	/nfs/dbraw/zinc/57/79/62/1360577962.db2.gz	VQBYZSCPWRURSE-QGZVFWFLSA-N	0	3	340.471	3.131	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1nccc2occc21	ZINC001089675618	1360583894	/nfs/dbraw/zinc/58/38/94/1360583894.db2.gz	MBAYQCKZPOQCRE-OAHLLOKOSA-N	0	3	339.439	3.072	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc2c(c1)CCO2	ZINC001089697215	1360601794	/nfs/dbraw/zinc/60/17/94/1360601794.db2.gz	MSVARBGMAIDIGN-SFHVURJKSA-N	0	3	342.483	3.418	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ncoc1C(C)(C)C	ZINC001089719723	1360621386	/nfs/dbraw/zinc/62/13/86/1360621386.db2.gz	KFSJMYAVUWWQGM-OAHLLOKOSA-N	0	3	345.487	3.216	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ncoc1C(C)C	ZINC001089720312	1360622300	/nfs/dbraw/zinc/62/23/00/1360622300.db2.gz	UXDCLCVQHCBOQK-HNNXBMFYSA-N	0	3	331.460	3.042	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCC(C)(C)CN2CC=C(C)C)nc1	ZINC001089723397	1360626669	/nfs/dbraw/zinc/62/66/69/1360626669.db2.gz	JJKGHIVAIONUPC-SFHVURJKSA-N	0	3	339.483	3.250	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(N(C)C)c(F)c1	ZINC001089734320	1360637905	/nfs/dbraw/zinc/63/79/05/1360637905.db2.gz	OSGLXMMHQWMPSR-MRXNPFEDSA-N	0	3	347.478	3.298	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cccn1C(C)C	ZINC001089735658	1360640629	/nfs/dbraw/zinc/64/06/29/1360640629.db2.gz	NUJOOUZVAGQOLF-KRWDZBQOSA-N	0	3	329.488	3.313	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1coc(C)c1	ZINC001089798931	1360668496	/nfs/dbraw/zinc/66/84/96/1360668496.db2.gz	BDCQASHXKZAWOJ-SVGFKBNWSA-N	0	3	334.847	3.123	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CC2CCCCC2)CC2(CCOCC2)C1	ZINC001089922295	1360746335	/nfs/dbraw/zinc/74/63/35/1360746335.db2.gz	JGOPLCTXKMUTPB-SFHVURJKSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C(C)=C2CCCC2)CC2(CCOCC2)C1	ZINC001089937241	1360752844	/nfs/dbraw/zinc/75/28/44/1360752844.db2.gz	VCVXFSFXUCCYHD-IBGZPJMESA-N	0	3	346.515	3.440	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C23CCC(CC2)C3)CC2(CCOCC2)C1	ZINC001089943323	1360756924	/nfs/dbraw/zinc/75/69/24/1360756924.db2.gz	OFEDJQIDDMZTQO-IDYZSHNDSA-N	0	3	346.515	3.130	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C[C@@H]2CC=CCC2)CC2(CCOCC2)C1	ZINC001089950968	1360760690	/nfs/dbraw/zinc/76/06/90/1360760690.db2.gz	DPKCOUQKGTWPLS-MOPGFXCFSA-N	0	3	346.515	3.296	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](CNCc2csc(C)n2)[C@H](C)C1	ZINC001184512412	1387479915	/nfs/dbraw/zinc/47/99/15/1387479915.db2.gz	LQLYDEJXYPIACB-GDBMZVCRSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H]2CCCc3ccccc32)C1	ZINC001091097992	1360991563	/nfs/dbraw/zinc/99/15/63/1360991563.db2.gz	AYDHOFUFMAWNTA-JFUPDXTOSA-N	0	3	332.875	3.343	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(Cl)c(OC)c2)C1	ZINC001091265909	1361026368	/nfs/dbraw/zinc/02/63/68/1361026368.db2.gz	OMJHMKLQGKBSKM-UHFFFAOYSA-N	0	3	343.254	3.199	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(C)c(OCC)c2)C1	ZINC001091266054	1361026419	/nfs/dbraw/zinc/02/64/19/1361026419.db2.gz	RPKVGSLYPKKVLH-UHFFFAOYSA-N	0	3	336.863	3.244	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc3nc(C)sc3c2)C1	ZINC001091311531	1361039624	/nfs/dbraw/zinc/03/96/24/1361039624.db2.gz	RBMBZYNRPJMCPW-UHFFFAOYSA-N	0	3	349.887	3.455	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CN(Cc3cncc(C)c3)C[C@@]2(C)C1	ZINC001091978622	1361265964	/nfs/dbraw/zinc/26/59/64/1361265964.db2.gz	YIWPZXMUMPYMIW-GIVPXCGWSA-N	0	3	341.499	3.273	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CN(Cc4ccccc4F)C[C@@]3(C)C2)C1	ZINC001091995694	1361270142	/nfs/dbraw/zinc/27/01/42/1361270142.db2.gz	JSAKOGJUOBLXSY-UTKZUKDTSA-N	0	3	342.458	3.462	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc(C(C)(C)C)oc3C)C[C@]2(C)C1	ZINC001092051639	1361283407	/nfs/dbraw/zinc/28/34/07/1361283407.db2.gz	GRTUJECHMUSIKK-IERDGZPVSA-N	0	3	342.483	3.303	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C(C)(C)c3ccccc3C)C[C@]2(C)C1	ZINC001092324358	1361364840	/nfs/dbraw/zinc/36/48/40/1361364840.db2.gz	PEBDGHZFBJMOFP-GCJKJVERSA-N	0	3	338.495	3.076	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CN(Cc3ccccn3)C[C@H]2C)CC1	ZINC001092940621	1361491130	/nfs/dbraw/zinc/49/11/30/1361491130.db2.gz	UQVYULMNKQFMFM-SJLPKXTDSA-N	0	3	327.472	3.012	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)c2cscc2C)CC1	ZINC001093364121	1361574997	/nfs/dbraw/zinc/57/49/97/1361574997.db2.gz	MKVWDBYQEKAUFT-SFHVURJKSA-N	0	3	342.508	3.396	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3c[nH]cc3-c3ccccc3)CCC[C@@H]12	ZINC001094579694	1361868540	/nfs/dbraw/zinc/86/85/40/1361868540.db2.gz	YOAPQQSOBQLWFP-IFMALSPDSA-N	0	3	347.462	3.289	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1ccc(C)c(Cl)c1)C2	ZINC001095608155	1362183986	/nfs/dbraw/zinc/18/39/86/1362183986.db2.gz	MKLMPQDGXKAXSY-NJAFHUGGSA-N	0	3	332.875	3.489	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1ccc(CC(C)C)cc1)C2	ZINC001095713277	1362209755	/nfs/dbraw/zinc/20/97/55/1362209755.db2.gz	OHTJZHUTZXMENV-HKBOAZHASA-N	0	3	338.495	3.172	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc3c(c1)[C@@H](C)CO3)C2	ZINC001095896339	1362277170	/nfs/dbraw/zinc/27/71/70/1362277170.db2.gz	LSGRWWYPBVCROG-DHXZDTOLSA-N	0	3	326.440	3.094	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccccc1-n1cccc1)C2	ZINC001095962024	1362310851	/nfs/dbraw/zinc/31/08/51/1362310851.db2.gz	ZRELFHIODZKZKJ-KPFFTGBYSA-N	0	3	335.451	3.389	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3CCc2cccs2)C1	ZINC001095984562	1362322515	/nfs/dbraw/zinc/32/25/15/1362322515.db2.gz	MOMORQAONXQXLB-PVAVHDDUSA-N	0	3	330.497	3.368	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc3c(s1)CCOC3)C2	ZINC001096372152	1362477111	/nfs/dbraw/zinc/47/71/11/1362477111.db2.gz	HHVVEEYVUNDOOR-PMPSAXMXSA-N	0	3	346.496	3.122	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1sc(C(C)C)nc1C)C2	ZINC001096539506	1362564556	/nfs/dbraw/zinc/56/45/56/1362564556.db2.gz	ZNXDWFIPBLBYBR-ILXRZTDVSA-N	0	3	333.501	3.486	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C1(c3cc(C)cc(C)c3)CC1)C2	ZINC001096555927	1362576719	/nfs/dbraw/zinc/57/67/19/1362576719.db2.gz	WOAGEQJURMRIHY-AABGKKOBSA-N	0	3	336.479	3.080	20	30		EGEDHN
CCCC1(C(=O)N2CC[C@@H](NCc3ccc(C#N)s3)C2)CCC1	ZINC001185007591	1387589113	/nfs/dbraw/zinc/58/91/13/1387589113.db2.gz	UXRWWWUQBSEQJC-CQSZACIVSA-N	0	3	331.485	3.281	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H]1CCc3cc(OC)ccc31)C2	ZINC001097183789	1362877080	/nfs/dbraw/zinc/87/70/80/1362877080.db2.gz	RPKOWMOLIQBRQY-XLNTUCKNSA-N	0	3	340.467	3.023	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](C)c1c(F)cccc1F)C2	ZINC001097549824	1363054220	/nfs/dbraw/zinc/05/42/20/1363054220.db2.gz	DUABMLACDFFVFJ-IXKJSCDLSA-N	0	3	334.410	3.366	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@@H](NCc2cc(C)ccc2OC)C1	ZINC001185064716	1387607286	/nfs/dbraw/zinc/60/72/86/1387607286.db2.gz	WAVWLRZPTSXVSK-SJLPKXTDSA-N	0	3	330.472	3.296	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc([C@@H](C)CC)no1)C2	ZINC001097997421	1363192255	/nfs/dbraw/zinc/19/22/55/1363192255.db2.gz	BWYUMDHAQMPRPK-ABFRBSLYSA-N	0	3	331.460	3.489	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](CNCc3cnc(C)o3)[C@@H](C)C2)CCC1	ZINC001185093801	1387617226	/nfs/dbraw/zinc/61/72/26/1387617226.db2.gz	DAFUWAGLTPJYPK-DOTOQJQBSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](CNCc3ocnc3C)[C@@H](C)C2)CC1	ZINC001185094491	1387617550	/nfs/dbraw/zinc/61/75/50/1387617550.db2.gz	JHLRCMXJOLVKBR-RDJZCZTQSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](CNCc3cc(C)no3)[C@H](C)C2)CCC1	ZINC001185095467	1387617566	/nfs/dbraw/zinc/61/75/66/1387617566.db2.gz	PVBLIIRQUQVJFS-WBVHZDCISA-N	0	3	345.487	3.304	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cccc(OCC(C)C)c1)C2	ZINC001098350499	1363305860	/nfs/dbraw/zinc/30/58/60/1363305860.db2.gz	HQYRISHFGMNAFW-RLLQIKCJSA-N	0	3	340.467	3.080	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C=C1CCCCC1)C[C@H](C)O2	ZINC001098571188	1363381842	/nfs/dbraw/zinc/38/18/42/1363381842.db2.gz	NUXFGYGBOCOFJM-KRWDZBQOSA-N	0	3	332.488	3.145	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1cccc(C)c1F)C[C@H](C)O2	ZINC001098603732	1363394868	/nfs/dbraw/zinc/39/48/68/1363394868.db2.gz	VWSVTGGHRNAUAP-INIZCTEOSA-N	0	3	346.446	3.016	20	30		EGEDHN
CCCCCCCNCc1cn([C@H]2CCN(C(=O)C=C(C)C)C2)nn1	ZINC001098607879	1363396768	/nfs/dbraw/zinc/39/67/68/1363396768.db2.gz	IBGCVWOXYZNBGL-SFHVURJKSA-N	0	3	347.507	3.078	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H]1C[C@@H]3CCCC[C@H]13)C[C@@H](C)O2	ZINC001098617182	1363400854	/nfs/dbraw/zinc/40/08/54/1363400854.db2.gz	WEYCRXNNUQATTP-YDZRNGNQSA-N	0	3	346.515	3.081	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1(C)C(C)(C)C1(C)C)C[C@H](C)O2	ZINC001098668650	1363428301	/nfs/dbraw/zinc/42/83/01/1363428301.db2.gz	SCJOFMCERUKFLQ-INIZCTEOSA-N	0	3	348.531	3.327	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CCC[C@]3(NC(=O)[C@H]3CC=CCC3)C2)c1	ZINC001098725656	1363451166	/nfs/dbraw/zinc/45/11/66/1363451166.db2.gz	JQDAKIHKJKZBNG-ONTIZHBOSA-N	0	3	349.478	3.385	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)Cc2cccc(C3CC3)c2)C1	ZINC001098958400	1363541030	/nfs/dbraw/zinc/54/10/30/1363541030.db2.gz	WYYYXYQZCBOPGG-UNMCSNQZSA-N	0	3	336.479	3.101	20	30		EGEDHN
C#CCN1C[C@@H]2CCC[C@]2(NC(=O)Cc2ccc(C3CCC3)cc2)C1	ZINC001098961468	1363543031	/nfs/dbraw/zinc/54/30/31/1363543031.db2.gz	NUKLXYBYNJILQF-UNMCSNQZSA-N	0	3	336.479	3.101	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)C(F)=C(C)C	ZINC001099017902	1363577591	/nfs/dbraw/zinc/57/75/91/1363577591.db2.gz	ZIKVUCRKJWZISY-HNNXBMFYSA-N	0	3	326.456	3.059	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)C(C)=C1CCC1	ZINC001099065140	1363604007	/nfs/dbraw/zinc/60/40/07/1363604007.db2.gz	NPWRYZOPIKAGOE-GOSISDBHSA-N	0	3	334.504	3.296	20	30		EGEDHN
C#CCCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(C(CC)CC)no2)C1	ZINC001099067879	1363604757	/nfs/dbraw/zinc/60/47/57/1363604757.db2.gz	GDNPORRQPCRFRR-JXFKEZNVSA-N	0	3	343.471	3.186	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2occ3c2CCCC3)C1	ZINC001099137446	1363647818	/nfs/dbraw/zinc/64/78/18/1363647818.db2.gz	OSNMWBSLCMCATO-JXFKEZNVSA-N	0	3	328.456	3.319	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(OCC(C)C)cc2)C1	ZINC001099148252	1363655103	/nfs/dbraw/zinc/65/51/03/1363655103.db2.gz	FGXGWNATIXTJAZ-RXVVDRJESA-N	0	3	342.483	3.492	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)C(C)(C)C(=C)C	ZINC001099170605	1363668195	/nfs/dbraw/zinc/66/81/95/1363668195.db2.gz	JFHMWLOFNPQXNR-QGZVFWFLSA-N	0	3	336.520	3.398	20	30		EGEDHN
C#CCN1C[C@@H]2CCC[C@]2(NC(=O)CC2C3CC4CC(C3)CC2C4)C1	ZINC001099171997	1363670344	/nfs/dbraw/zinc/67/03/44/1363670344.db2.gz	PFDACBUKKLHHLC-HGBKEOBVSA-N	0	3	340.511	3.053	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@]1(C)C=CCC1	ZINC001099183277	1363678857	/nfs/dbraw/zinc/67/88/57/1363678857.db2.gz	TVBVLKJINHPRRJ-YLJYHZDGSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@@H]2C[C@H]2CC(C)(C)C)C[C@H]1C(F)(F)F	ZINC001099254854	1363716823	/nfs/dbraw/zinc/71/68/23/1363716823.db2.gz	XYTOZUMOZDTCCG-REWJHTLYSA-N	0	3	332.410	3.224	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2sccc2Cl)C[C@H]1C(F)(F)F	ZINC001099256595	1363716966	/nfs/dbraw/zinc/71/69/66/1363716966.db2.gz	GSMAARJYCXMQAI-PSASIEDQSA-N	0	3	338.782	3.180	20	30		EGEDHN
C=CC1(CC(=O)NC[C@@H]2CCC(C)(C)CN2CCO)CCCCC1	ZINC001099269897	1363724620	/nfs/dbraw/zinc/72/46/20/1363724620.db2.gz	GMEKEERUBSMUJF-KRWDZBQOSA-N	0	3	336.520	3.112	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2ccccc2CCC)C[C@H]1C(F)(F)F	ZINC001099278475	1363728997	/nfs/dbraw/zinc/72/89/97/1363728997.db2.gz	DAMWEBXHEALLDW-HZPDHXFCSA-N	0	3	340.389	3.418	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2cc[nH]c2C(C)C)C[C@H]1C(F)(F)F	ZINC001099295206	1363736755	/nfs/dbraw/zinc/73/67/55/1363736755.db2.gz	PZSNNUOVZKXLPY-ZIAGYGMSSA-N	0	3	343.393	3.307	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2ccc(C)c(F)c2F)C[C@H]1C(F)(F)F	ZINC001099311660	1363744670	/nfs/dbraw/zinc/74/46/70/1363744670.db2.gz	KZYFCERZRXDWQN-VXGBXAGGSA-N	0	3	348.315	3.052	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)C1(CC=C)CCOCC1	ZINC001099323852	1363749847	/nfs/dbraw/zinc/74/98/47/1363749847.db2.gz	BUIPEQMRNCDMBJ-KRWDZBQOSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@@H](C)c2ccccc2)C[C@H]1C(F)(F)F	ZINC001099333761	1363755490	/nfs/dbraw/zinc/75/54/90/1363755490.db2.gz	WZYDPWUFSXAZSO-NUEKZKHPSA-N	0	3	340.389	3.345	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)COCc1ccccc1	ZINC001099334263	1363756354	/nfs/dbraw/zinc/75/63/54/1363756354.db2.gz	GHPLILCWRACJFL-LJQANCHMSA-N	0	3	344.499	3.386	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)COc1ccc(C)cc1C	ZINC001099334757	1363757198	/nfs/dbraw/zinc/75/71/98/1363757198.db2.gz	MUTQITAYZMNAQI-SFHVURJKSA-N	0	3	344.499	3.475	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2cc3c(s2)CCC3)C[C@H]1C(F)(F)F	ZINC001099340222	1363760447	/nfs/dbraw/zinc/76/04/47/1363760447.db2.gz	NYOUCBPKTIHICH-VXGBXAGGSA-N	0	3	344.402	3.015	20	30		EGEDHN
CC[C@H](C)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2ccccc2C#N)C1	ZINC001099380226	1363781340	/nfs/dbraw/zinc/78/13/40/1363781340.db2.gz	USIFCJCENFZGCJ-LRQRDZAKSA-N	0	3	339.483	3.323	20	30		EGEDHN
N#Cc1ccccc1CNC[C@]12CCC[C@H]1CN(C(=O)/C=C/C1CC1)C2	ZINC001099400789	1363787490	/nfs/dbraw/zinc/78/74/90/1363787490.db2.gz	FUORJEOLNLVSCY-DLKBPIKBSA-N	0	3	349.478	3.243	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)/C=C/C(C)(C)C)CC2(CCOCC2)C1	ZINC001099572133	1363857178	/nfs/dbraw/zinc/85/71/78/1363857178.db2.gz	SMOJLXCXHZPRAU-DKRLNXSXSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN(CC=C(C)C)CC2(CCOCC2)C1	ZINC001099587277	1363868928	/nfs/dbraw/zinc/86/89/28/1363868928.db2.gz	UNWWTOOFSHKMOA-KRWDZBQOSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=CCCC(=O)NCC1CC(NCc2ccc(Cl)cc2OC)C1	ZINC001100176872	1364036176	/nfs/dbraw/zinc/03/61/76/1364036176.db2.gz	KEHPVQPGNIHDIM-UHFFFAOYSA-N	0	3	336.863	3.299	20	30		EGEDHN
CCC[C@H](C)C(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1	ZINC001100196480	1364042183	/nfs/dbraw/zinc/04/21/83/1364042183.db2.gz	KTGNXKJNNPFBOB-KTAKPFMOSA-N	0	3	331.435	3.118	20	30		EGEDHN
CCC[C@@H](C)C(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1	ZINC001100196479	1364042292	/nfs/dbraw/zinc/04/22/92/1364042292.db2.gz	KTGNXKJNNPFBOB-BZOOQXSSSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCC1CC(NCc2cccc(Cl)n2)C1	ZINC001100587066	1364175626	/nfs/dbraw/zinc/17/56/26/1364175626.db2.gz	HPBBXNRNPXNDKV-VQCLRJIVSA-N	0	3	335.879	3.322	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCC1CC(NCc2c(C)onc2CC)C1	ZINC001100587524	1364176540	/nfs/dbraw/zinc/17/65/40/1364176540.db2.gz	SLDSSGRRVOOGQX-IUDNXUCKSA-N	0	3	333.476	3.132	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC1CC(NCc2c(C)onc2CC)C1	ZINC001100644717	1364202356	/nfs/dbraw/zinc/20/23/56/1364202356.db2.gz	DIUAALRILZVDMS-ZOJXTTQQSA-N	0	3	333.476	3.132	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)Cc2cccc(Cl)c2F)C1	ZINC001100703591	1364226876	/nfs/dbraw/zinc/22/68/76/1364226876.db2.gz	MSXXLKFHMMITJA-UHFFFAOYSA-N	0	3	345.245	3.259	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C(C)(C)c2ccccc2F)C1	ZINC001100758509	1364248238	/nfs/dbraw/zinc/24/82/38/1364248238.db2.gz	APPYASSIDYOZDM-UHFFFAOYSA-N	0	3	338.854	3.340	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H](c2cccnc2)C(C)C)C1	ZINC001100787140	1364261880	/nfs/dbraw/zinc/26/18/80/1364261880.db2.gz	RNGMAJRBUXFSOZ-BDVYOWHSSA-N	0	3	335.879	3.058	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)NCC2CC(NCC#Cc3ccccc3)C2)CC1	ZINC001100891644	1364315846	/nfs/dbraw/zinc/31/58/46/1364315846.db2.gz	BSEBODMAVQQVGH-QEZSOMHNSA-N	0	3	338.495	3.349	20	30		EGEDHN
CC(C)(C)C(=O)NCC1CC(NCC#Cc2ccccc2Cl)C1	ZINC001100903156	1364323351	/nfs/dbraw/zinc/32/33/51/1364323351.db2.gz	RYOHYUJZLYVHJD-UHFFFAOYSA-N	0	3	332.875	3.222	20	30		EGEDHN
C=CCN1CC[C@@H](Oc2ccnc(CNC(=O)C[C@@H](C)C(C)C)c2)C1	ZINC001101092720	1364409827	/nfs/dbraw/zinc/40/98/27/1364409827.db2.gz	WBZFVAUCDPSXBI-VQIMIIECSA-N	0	3	345.487	3.019	20	30		EGEDHN
C=CCN1CC[C@H](Oc2ccnc(CNC(=O)[C@@H](C)C(C)(C)C)c2)C1	ZINC001101095421	1364411515	/nfs/dbraw/zinc/41/15/15/1364411515.db2.gz	IIDOBRQDVCAWSR-QAPCUYQASA-N	0	3	345.487	3.019	20	30		EGEDHN
C=CCN1CC[C@H](Oc2ccnc(CNC(=O)CCCC(C)C)c2)C1	ZINC001101096979	1364412386	/nfs/dbraw/zinc/41/23/86/1364412386.db2.gz	GRMISJUJENSFCZ-IBGZPJMESA-N	0	3	345.487	3.163	20	30		EGEDHN
C=CCN1CC[C@@H](Oc2ccnc(CNC(=O)[C@H](CC)CCC)c2)C1	ZINC001101097516	1364413696	/nfs/dbraw/zinc/41/36/96/1364413696.db2.gz	UQGMCGZKLSBGFW-VQIMIIECSA-N	0	3	345.487	3.163	20	30		EGEDHN
CCC[C@H](C)C(=O)N1C[C@H]2CN(Cc3ccc(C#N)cc3)C[C@@]2(C)C1	ZINC001101182688	1364450596	/nfs/dbraw/zinc/45/05/96/1364450596.db2.gz	AIOUOCVYSJTSDF-SCWSEQNSSA-N	0	3	339.483	3.275	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@H]2CN(Cc3cnccc3C)C[C@@]2(C)C1	ZINC001101252036	1364486280	/nfs/dbraw/zinc/48/62/80/1364486280.db2.gz	YAOSXIHKARGEMX-NQIIRXRSSA-N	0	3	341.499	3.273	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@H]2CN(Cc3oc(C)nc3C)C[C@@]2(C)C1	ZINC001101252808	1364487182	/nfs/dbraw/zinc/48/71/82/1364487182.db2.gz	WIUCOJBGOSYEMD-UZLBHIALSA-N	0	3	345.487	3.174	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C/C=C\c3ccc(F)cc3)C[C@]2(C)C1	ZINC001101277332	1364496192	/nfs/dbraw/zinc/49/61/92/1364496192.db2.gz	CEDVMBWVRNFFRI-MKDNIMGSSA-N	0	3	340.442	3.033	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CC2(CN(CC(CC)CC)C2)n2ccnc21	ZINC001101641624	1364667250	/nfs/dbraw/zinc/66/72/50/1364667250.db2.gz	VQNCSYRFEMSADQ-QGZVFWFLSA-N	0	3	344.503	3.248	20	30		EGEDHN
CCC(CC)C(=O)NC[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1C	ZINC001101744215	1364711166	/nfs/dbraw/zinc/71/11/66/1364711166.db2.gz	HDJVVBNSMPOFTI-VQIMIIECSA-N	0	3	344.474	3.298	20	30		EGEDHN
CC(C)=C(F)C(=O)NC[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1C	ZINC001101876140	1364760927	/nfs/dbraw/zinc/76/09/27/1364760927.db2.gz	AJMFHUKODGEOKY-CZUORRHYSA-N	0	3	347.409	3.145	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H]1CN(Cc2cn(C(C)C)nc2C)C[C@H]1C	ZINC001102011671	1364811229	/nfs/dbraw/zinc/81/12/29/1364811229.db2.gz	LEBIYSVOXIOCLA-SJLPKXTDSA-N	0	3	346.519	3.313	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@@H]1CN(Cc2c(C)noc2CC)C[C@H]1C	ZINC001102261477	1364973614	/nfs/dbraw/zinc/97/36/14/1364973614.db2.gz	ZTSOGEHVLSUUSJ-ZMSDIMECSA-N	0	3	347.503	3.332	20	30		EGEDHN
CCC1(C(=O)NC[C@@H]2CN(Cc3ccc(C#N)c(F)c3)C[C@H]2C)CC1	ZINC001102332966	1365006689	/nfs/dbraw/zinc/00/66/89/1365006689.db2.gz	FJWGFFODSHMTOD-RHSMWYFYSA-N	0	3	343.446	3.072	20	30		EGEDHN
CC(C)=CC(=O)NCC[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1C	ZINC001102647812	1365153917	/nfs/dbraw/zinc/15/39/17/1365153917.db2.gz	CVCGCLOQJSPKJE-NVXWUHKLSA-N	0	3	343.446	3.238	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCC[C@@H]1CN(Cc2cncs2)C[C@H]1C	ZINC001103033657	1365348076	/nfs/dbraw/zinc/34/80/76/1365348076.db2.gz	XOTOUHVVTRUWLY-HUUCEWRRSA-N	0	3	335.517	3.320	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)CCc2cncc(C)c2)C1	ZINC001103213390	1365438292	/nfs/dbraw/zinc/43/82/92/1365438292.db2.gz	FDFKGYHQCCDXMP-CRAIPNDOSA-N	0	3	349.906	3.149	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2ccc3[nH]ccc3n2)C1	ZINC001103224233	1365443486	/nfs/dbraw/zinc/44/34/86/1365443486.db2.gz	QVQDKUKXUNIOTA-TZMCWYRMSA-N	0	3	346.862	3.003	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCC[C@@H]1CN(Cc2cc(C)no2)C[C@H]1C	ZINC001103346083	1365511250	/nfs/dbraw/zinc/51/12/50/1365511250.db2.gz	CVOYUBUARCWLFI-DJIMGWMZSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)CC[C@@H]2CCCOC2)C1	ZINC001103587301	1365654146	/nfs/dbraw/zinc/65/41/46/1365654146.db2.gz	OZMDQFFAILJKNR-HYVNUMGLSA-N	0	3	342.911	3.020	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2ncccc2Cl)C1	ZINC001103659443	1365708267	/nfs/dbraw/zinc/70/82/67/1365708267.db2.gz	AFTIFFFEUCSFPA-DGCLKSJQSA-N	0	3	342.270	3.175	20	30		EGEDHN
C[C@@H]1CN(C(=O)C(C)(C)F)C[C@H]1CCNCc1cc(C#N)ccc1F	ZINC001103813452	1365793869	/nfs/dbraw/zinc/79/38/69/1365793869.db2.gz	CNVNHBKRGTWGCV-UKRRQHHQSA-N	0	3	349.425	3.020	20	30		EGEDHN
CCCC(=O)N1C[C@@H](C)[C@H](CCNCc2ccc(C#N)cc2F)C1	ZINC001103819506	1365796918	/nfs/dbraw/zinc/79/69/18/1365796918.db2.gz	GENKLJFEFHWQIW-RHSMWYFYSA-N	0	3	331.435	3.072	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)C2C(C)(C)C2(C)C)C[C@H]1C	ZINC001104041648	1365886516	/nfs/dbraw/zinc/88/65/16/1365886516.db2.gz	PQFZZSRQLHBXTH-TZMCWYRMSA-N	0	3	326.912	3.495	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)[C@H](CCNCc2cccnc2OC)C1	ZINC001104245470	1365966829	/nfs/dbraw/zinc/96/68/29/1365966829.db2.gz	JVOOHQLIGWLAIJ-SJLPKXTDSA-N	0	3	345.487	3.021	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)[C@@H](CC)CC(F)F)C[C@H]1C	ZINC001104280037	1365975344	/nfs/dbraw/zinc/97/53/44/1365975344.db2.gz	ZWTNAWSCKPVJAH-KWCYVHTRSA-N	0	3	336.854	3.495	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)[C@H](CC)CC(F)F)C[C@H]1C	ZINC001104280038	1365975603	/nfs/dbraw/zinc/97/56/03/1365975603.db2.gz	ZWTNAWSCKPVJAH-MRVWCRGKSA-N	0	3	336.854	3.495	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)[C@H](C)CC(F)(F)F)C[C@H]1C	ZINC001104442882	1366030384	/nfs/dbraw/zinc/03/03/84/1366030384.db2.gz	RHISKQMDKQYOOL-NQBHXWOUSA-N	0	3	340.817	3.402	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@@H](C)[C@H](CCNCc2cnc(C)o2)C1	ZINC001104564489	1366078788	/nfs/dbraw/zinc/07/87/88/1366078788.db2.gz	MNZDENNNLDKKMB-DJIMGWMZSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2cc(OC)ccn2)C1	ZINC001104606701	1366098830	/nfs/dbraw/zinc/09/88/30/1366098830.db2.gz	BHQRNCBAHVGCFI-IAGOWNOFSA-N	0	3	345.487	3.021	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2csc(C)c2)C[C@H]1C	ZINC001104793903	1366175751	/nfs/dbraw/zinc/17/57/51/1366175751.db2.gz	OHGQFLMYFYODJR-BXUZGUMPSA-N	0	3	326.893	3.497	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2csc(Cl)n2)C[C@H]1C	ZINC001104875979	1366206708	/nfs/dbraw/zinc/20/67/08/1366206708.db2.gz	BLIFZWKBEJXUKK-MWLCHTKSSA-N	0	3	348.299	3.237	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2ccc(C3CC3)cn2)C[C@H]1C	ZINC001104965639	1366244734	/nfs/dbraw/zinc/24/47/34/1366244734.db2.gz	ZRBGQXRHKOYAHV-CXAGYDPISA-N	0	3	347.890	3.399	20	30		EGEDHN
C=CCCCCCNCc1cn(C2CN(C(=O)CCCCC)C2)nn1	ZINC001105159658	1366350184	/nfs/dbraw/zinc/35/01/84/1366350184.db2.gz	UKBIITPOKMDBOX-UHFFFAOYSA-N	0	3	347.507	3.078	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)CCC(F)(F)F)CC1	ZINC001105391431	1366439026	/nfs/dbraw/zinc/43/90/26/1366439026.db2.gz	DYUVJAMYOSJNGW-MRXNPFEDSA-N	0	3	342.405	3.055	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC([C@H]2N(CC#C)CC23CCC3)CC1	ZINC001105394430	1366443351	/nfs/dbraw/zinc/44/33/51/1366443351.db2.gz	WUFKXCRORBBYGV-OAQYLSRUSA-N	0	3	340.511	3.296	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C(C)(C)CC=C)CC1	ZINC001105396688	1366445429	/nfs/dbraw/zinc/44/54/29/1366445429.db2.gz	SJWRQNSAEXBZRG-GOSISDBHSA-N	0	3	328.500	3.315	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(c2ccccc2)C[C@H](NC(=O)[C@H](F)CC)C1	ZINC001105433971	1366466411	/nfs/dbraw/zinc/46/64/11/1366466411.db2.gz	VGRRFWQSWQNHIU-NUJGCVRESA-N	0	3	338.854	3.293	20	30		EGEDHN
CC(C)C[C@@H](C)C(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001106807702	1366805016	/nfs/dbraw/zinc/80/50/16/1366805016.db2.gz	ZAJKACIFPMYSIR-MBOZVWFJSA-N	0	3	341.499	3.425	20	30		EGEDHN
CC(C)C(=O)NC[C@]12CCC[C@H]1N(Cc1ccc(C#N)c(F)c1)CC2	ZINC001107283414	1366915576	/nfs/dbraw/zinc/91/55/76/1366915576.db2.gz	BQYDNLOBIFXRDI-UYAOXDASSA-N	0	3	343.446	3.214	20	30		EGEDHN
C/C=C(\C)C(=O)NC[C@]12CCC[C@H]1N(CC#Cc1ccccc1)CC2	ZINC001107355950	1366940385	/nfs/dbraw/zinc/94/03/85/1366940385.db2.gz	PSLZEKPJDBXDMF-MHDKIHMSSA-N	0	3	336.479	3.365	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1cc(C)sc1C	ZINC001109205392	1367001238	/nfs/dbraw/zinc/00/12/38/1367001238.db2.gz	BSNMNMJDCXSYEK-SQNIBIBYSA-N	0	3	330.497	3.390	20	30		EGEDHN
C=CCCCC(=O)NC[C@]12CCC[C@H]1N(Cc1ocnc1C)CC2	ZINC001107524204	1367018018	/nfs/dbraw/zinc/01/80/18/1367018018.db2.gz	NGMSSPDPCGAQPE-IEBWSBKVSA-N	0	3	331.460	3.200	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@]12CCC[C@H]1N(Cc1cnoc1C)CC2	ZINC001107534120	1367026020	/nfs/dbraw/zinc/02/60/20/1367026020.db2.gz	YFOPYQBFMAJZGP-YZGWKJHDSA-N	0	3	345.487	3.446	20	30		EGEDHN
CCC(=CC(=O)N1CC[C@H](N(C)Cc2ccc(C#N)cc2)C1)CC	ZINC001189632299	1367073709	/nfs/dbraw/zinc/07/37/09/1367073709.db2.gz	NCTMGFXTNMFXJN-IBGZPJMESA-N	0	3	325.456	3.337	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](N(C)Cc2cccc(COC)c2)C1	ZINC001189704311	1367090745	/nfs/dbraw/zinc/09/07/45/1367090745.db2.gz	AEUYMBXRZCEFPA-HXUWFJFHSA-N	0	3	342.483	3.059	20	30		EGEDHN
CCCCCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C1(F)CCOCC1)C2	ZINC001109382532	1367097758	/nfs/dbraw/zinc/09/77/58/1367097758.db2.gz	FZVHYOJCMRDHTO-IKGGRYGDSA-N	0	3	340.483	3.197	20	30		EGEDHN
C#CCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3Cc2ccccc2C)CCC1	ZINC001109391938	1367101423	/nfs/dbraw/zinc/10/14/23/1367101423.db2.gz	JARUGLQLWJURLW-AABGKKOBSA-N	0	3	336.479	3.410	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2ccccc2C)C1	ZINC001107706742	1367113292	/nfs/dbraw/zinc/11/32/92/1367113292.db2.gz	XKRKFQMAKQSWGR-XLIONFOSSA-N	0	3	330.472	3.170	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](N(C)CCOc2ccc(Cl)cc2)C1	ZINC001189925941	1367132257	/nfs/dbraw/zinc/13/22/57/1367132257.db2.gz	IKXSLQUCMVQNRE-KRWDZBQOSA-N	0	3	348.874	3.055	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)COc1ccc(C(C)C)cc1)C2	ZINC001109492013	1367156935	/nfs/dbraw/zinc/15/69/35/1367156935.db2.gz	CMLPGMMPJCNLGK-HOJAQTOUSA-N	0	3	342.483	3.486	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)C2C(C)(C)C2(C)C)C1	ZINC001107846207	1367172343	/nfs/dbraw/zinc/17/23/43/1367172343.db2.gz	QNFWJNFPUWZZRA-YWZLYKJASA-N	0	3	336.520	3.230	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC[C@@]1(C)CN(CCC(C)(C)C)CCO1	ZINC001107967994	1367222377	/nfs/dbraw/zinc/22/23/77/1367222377.db2.gz	ZXCUOUDBFDRXDY-FQEVSTJZSA-N	0	3	336.520	3.398	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2c(C)oc3ccccc32)C1	ZINC001190319059	1367225943	/nfs/dbraw/zinc/22/59/43/1367225943.db2.gz	NLPSPLOIXQRORB-MRXNPFEDSA-N	0	3	342.439	3.090	20	30		EGEDHN
CCC(C)(C)CC(=O)N1CC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001190345827	1367233710	/nfs/dbraw/zinc/23/37/10/1367233710.db2.gz	YIWPUQZRINNPEL-GOSISDBHSA-N	0	3	327.472	3.417	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](N(C)Cc2cccc(COC)c2)C1	ZINC001190396922	1367252527	/nfs/dbraw/zinc/25/25/27/1367252527.db2.gz	HMMZQRWHRVWHFF-IBGZPJMESA-N	0	3	344.499	3.468	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](N(C)Cc2cccc(COC)c2)C1	ZINC001190396924	1367253003	/nfs/dbraw/zinc/25/30/03/1367253003.db2.gz	HMMZQRWHRVWHFF-LJQANCHMSA-N	0	3	344.499	3.468	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@@]1(C)CN(CCC(C)(C)C)CCO1	ZINC001108122535	1367292863	/nfs/dbraw/zinc/29/28/63/1367292863.db2.gz	UHSYNBKWYNXAGK-FQEVSTJZSA-N	0	3	336.520	3.213	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCN(C(=O)C(C)(C)CC(F)F)C1	ZINC001190605474	1367306190	/nfs/dbraw/zinc/30/61/90/1367306190.db2.gz	XDGQMAPLKRTMCM-INIZCTEOSA-N	0	3	349.425	3.272	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2cc[nH]c2C(C)C)C1	ZINC001108153533	1367313593	/nfs/dbraw/zinc/31/35/93/1367313593.db2.gz	QLMMXFGPZKQFQO-OXQOHEQNSA-N	0	3	347.503	3.314	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2coc3c2cccc3C)C1	ZINC001190675205	1367325782	/nfs/dbraw/zinc/32/57/82/1367325782.db2.gz	ILBAEOKIKQSGKK-INIZCTEOSA-N	0	3	342.439	3.090	20	30		EGEDHN
N#CC1(c2ccccc2)CC(NCc2cccc(N3CCOCC3)c2)C1	ZINC001325011389	1387874486	/nfs/dbraw/zinc/87/44/86/1387874486.db2.gz	QHIONFKJPJWICE-UHFFFAOYSA-N	0	3	347.462	3.237	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)C(C)(C)C(C)(F)F)C1	ZINC001108369232	1367418179	/nfs/dbraw/zinc/41/81/79/1367418179.db2.gz	NBHOJPAQYJCDBI-YOEHRIQHSA-N	0	3	346.462	3.230	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)Cc2ccccc2C)C1	ZINC001108390076	1367431363	/nfs/dbraw/zinc/43/13/63/1367431363.db2.gz	SJMGJSGNFUYCQU-RXVVDRJESA-N	0	3	344.499	3.099	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)COC[C@@H](C)c1ccccc1)C2	ZINC001110047169	1367481629	/nfs/dbraw/zinc/48/16/29/1367481629.db2.gz	QJXCSTQVYMOUNP-LMCOJAPRSA-N	0	3	342.483	3.104	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@@H](C)c1ccccc1)C2	ZINC001110065816	1367491028	/nfs/dbraw/zinc/49/10/28/1367491028.db2.gz	KIORPXZJVMZACT-LMCOJAPRSA-N	0	3	342.483	3.104	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2cc(C)ccc2C2CC2)C1	ZINC001191499811	1367515631	/nfs/dbraw/zinc/51/56/31/1367515631.db2.gz	HUAMKQTUTDEJBX-GOSISDBHSA-N	0	3	342.483	3.221	20	30		EGEDHN
C=CC[C@H](C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCOCC)c1ccccc1	ZINC001110131204	1367515675	/nfs/dbraw/zinc/51/56/75/1367515675.db2.gz	XANNZRJAMGPTAW-FYQPLNBISA-N	0	3	342.483	3.104	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](N(C)CCOc2c(C)cccc2C)C1	ZINC001191726911	1367571560	/nfs/dbraw/zinc/57/15/60/1367571560.db2.gz	DJCATTYFBCUJSO-SFHVURJKSA-N	0	3	344.499	3.427	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001191727351	1367571636	/nfs/dbraw/zinc/57/16/36/1367571636.db2.gz	JPXYVARVCYCWIM-FQEVSTJZSA-N	0	3	337.467	3.175	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](N(C)Cc2cccc3c2CCOC3)C1	ZINC001192094549	1367685676	/nfs/dbraw/zinc/68/56/76/1367685676.db2.gz	VAMCAHFNVQIOKB-IBGZPJMESA-N	0	3	342.483	3.148	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](N(C)CCOCc2ccccc2)C1	ZINC001192162494	1367705072	/nfs/dbraw/zinc/70/50/72/1367705072.db2.gz	PDMFNXROYYDUJJ-TZIWHRDSSA-N	0	3	344.499	3.338	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@H](N(C)CCOc2ccc(F)cc2)C1	ZINC001192163394	1367705412	/nfs/dbraw/zinc/70/54/12/1367705412.db2.gz	WKPRXVJLNKLSQW-XLIONFOSSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2ccccc2C2(C)CC2)C1	ZINC001192317734	1367748454	/nfs/dbraw/zinc/74/84/54/1367748454.db2.gz	UPXLGNUFBWSDDA-QGZVFWFLSA-N	0	3	342.483	3.087	20	30		EGEDHN
CC(C)c1ccccc1CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](C)C#N)C2	ZINC001109087791	1367759953	/nfs/dbraw/zinc/75/99/53/1367759953.db2.gz	BYUVDFPNGICBNN-FXECBMLZSA-N	0	3	325.456	3.191	20	30		EGEDHN
Cc1ccccc1CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C#CC(C)C)C2	ZINC001110538153	1367817768	/nfs/dbraw/zinc/81/77/68/1367817768.db2.gz	PYXUYHREZGVBDY-NJYVYQBISA-N	0	3	338.495	3.309	20	30		EGEDHN
CCC[C@@H](CC)C(=O)N1CC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001193122159	1367949715	/nfs/dbraw/zinc/94/97/15/1367949715.db2.gz	IGUJIIQVVOJZDB-MOPGFXCFSA-N	0	3	327.472	3.417	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCN(C(=O)CCC2(C)CC2)C1	ZINC001193228161	1367971372	/nfs/dbraw/zinc/97/13/72/1367971372.db2.gz	MGSSZWBVYKFTBR-SFHVURJKSA-N	0	3	325.456	3.171	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3C[C@@H]2CCCCO2)CC1	ZINC001110987709	1368135152	/nfs/dbraw/zinc/13/51/52/1368135152.db2.gz	BHGXKUVIJLDHES-XDNAFOTISA-N	0	3	332.488	3.023	20	30		EGEDHN
C=CCC[C@@H](C)N1[C@@H]2CC[C@H]1[C@H](NC(=O)c1snnc1C(C)C)C2	ZINC001111175316	1368180918	/nfs/dbraw/zinc/18/09/18/1368180918.db2.gz	YMUKJBBRMUXBBD-TUVASFSCSA-N	0	3	348.516	3.351	20	30		EGEDHN
CCCCCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1coc(COC)n1)C2	ZINC001111199246	1368186450	/nfs/dbraw/zinc/18/64/50/1368186450.db2.gz	NJSPPRGOEJXKNP-INMHGKMJSA-N	0	3	349.475	3.127	20	30		EGEDHN
C=CCCOCC(=O)N1CC[C@@H](N(C)[C@H](C)c2ccc(F)cc2)C1	ZINC001194396591	1368251643	/nfs/dbraw/zinc/25/16/43/1368251643.db2.gz	GDFIMSIAAPOYOW-CRAIPNDOSA-N	0	3	334.435	3.012	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3CC=C(C)C)CCOCC1	ZINC001111330700	1368266646	/nfs/dbraw/zinc/26/66/46/1368266646.db2.gz	PLKCGTOFXHYLBX-KURKYZTESA-N	0	3	332.488	3.047	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCC1CCCCC1)C2	ZINC001111347144	1368270844	/nfs/dbraw/zinc/27/08/44/1368270844.db2.gz	MNVKHHRCISHOEI-QRVBRYPASA-N	0	3	334.504	3.271	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCOc1cccc(C)c1)C2	ZINC001111400756	1368296982	/nfs/dbraw/zinc/29/69/82/1368296982.db2.gz	QSHARFWERMLKIO-QRQLOZEOSA-N	0	3	328.456	3.062	20	30		EGEDHN
C=CC[C@H](C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCCF)c1ccccc1	ZINC001111436413	1368306911	/nfs/dbraw/zinc/30/69/11/1368306911.db2.gz	GDBIOWOIUAOPCO-HCXYKTFWSA-N	0	3	330.447	3.427	20	30		EGEDHN
O=C(CC#Cc1ccccc1)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccccc1	ZINC001111441210	1368307838	/nfs/dbraw/zinc/30/78/38/1368307838.db2.gz	BBXCLNNECLHZMM-VSKRKVRLSA-N	0	3	344.458	3.350	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3CCC[C@@H](C)O)CCCCC1	ZINC001111442269	1368308796	/nfs/dbraw/zinc/30/87/96/1368308796.db2.gz	IRVHJESCCRFHGX-MKXGPGLRSA-N	0	3	348.531	3.396	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](C)Cc1ccc(F)cc1)C2	ZINC001111496214	1368320921	/nfs/dbraw/zinc/32/09/21/1368320921.db2.gz	SKJWKGCZJQZMON-PIKADFDJSA-N	0	3	330.447	3.302	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)C[C@@H](NC(=O)CCC)c1ccccc1O2	ZINC001111529105	1368327763	/nfs/dbraw/zinc/32/77/63/1368327763.db2.gz	DOIJDFWHGVLJSP-YLJYHZDGSA-N	0	3	328.456	3.447	20	30		EGEDHN
C#CCCN1CC[C@]2(C1)C[C@H](NC(=O)C=C(C)C)c1ccccc1O2	ZINC001111530203	1368330157	/nfs/dbraw/zinc/33/01/57/1368330157.db2.gz	UVQFRNMDWCWRMF-GHTZIAJQSA-N	0	3	338.451	3.060	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H](CC)CC(C)C)C[C@@H](C)O2	ZINC001111552424	1368343925	/nfs/dbraw/zinc/34/39/25/1368343925.db2.gz	DXXBBOFWMZIICY-MSOLQXFVSA-N	0	3	336.520	3.327	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CCCN([C@@H](C)c2ccccc2)CC1	ZINC001195125368	1368384114	/nfs/dbraw/zinc/38/41/14/1368384114.db2.gz	LATOBUFNMBLFSW-ROUUACIJSA-N	0	3	330.472	3.263	20	30		EGEDHN
C#CCCCCC(=O)N1CCCN(Cc2ccc3cc[nH]c3c2)CC1	ZINC001195562174	1368454177	/nfs/dbraw/zinc/45/41/77/1368454177.db2.gz	DVKHKVFJGLAXIJ-UHFFFAOYSA-N	0	3	337.467	3.396	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@]12CCC[C@H]1CN(Cc1cccnc1C)C2	ZINC001111848756	1368503047	/nfs/dbraw/zinc/50/30/47/1368503047.db2.gz	RYRPCICPQWSAFI-LRQRDZAKSA-N	0	3	341.499	3.463	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N[C@]12CCC[C@H]1CN(Cc1cccc(C#N)c1)C2	ZINC001111889113	1368533532	/nfs/dbraw/zinc/53/35/32/1368533532.db2.gz	XBDSMXNDDSKURK-PBEJRMEISA-N	0	3	339.483	3.321	20	30		EGEDHN
C=C(C)CCC(=O)N1CCCN(CCCOCc2ccccc2)CC1	ZINC001196018106	1368536566	/nfs/dbraw/zinc/53/65/66/1368536566.db2.gz	JJHVTZKOACIWFH-UHFFFAOYSA-N	0	3	344.499	3.484	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2nc(C)c(C)nc2C)CC1	ZINC001196461473	1368620001	/nfs/dbraw/zinc/62/00/01/1368620001.db2.gz	KFQDSEOXFFEJHE-UHFFFAOYSA-N	0	3	344.503	3.296	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H](C)Cc2cccc(F)c2)C1	ZINC001112019634	1368622067	/nfs/dbraw/zinc/62/20/67/1368622067.db2.gz	GBULBDILFQBNEC-SYNHAJSKSA-N	0	3	330.447	3.161	20	30		EGEDHN
C=CC1(CC(=O)N[C@@H]2CN(CCCC(C)C)C[C@H]2O)CCCCC1	ZINC001196860454	1368701783	/nfs/dbraw/zinc/70/17/83/1368701783.db2.gz	HYJHJHJNXPRPKT-QZTJIDSGSA-N	0	3	336.520	3.111	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H]2CCC[C@]2(CNCc2nccs2)C1	ZINC001112375132	1368801550	/nfs/dbraw/zinc/80/15/50/1368801550.db2.gz	CEHWECNRWWYNAR-YJBOKZPZSA-N	0	3	333.501	3.218	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@@H](F)CCCCCC)C1	ZINC001197783746	1368896248	/nfs/dbraw/zinc/89/62/48/1368896248.db2.gz	QEYMCPUVRJPRBH-RCCFBDPRSA-N	0	3	344.515	3.427	20	30		EGEDHN
N#Cc1ccccc1CNC[C@]12CCC[C@H]1CN(C(=O)CCCF)C2	ZINC001112512230	1368908312	/nfs/dbraw/zinc/90/83/12/1368908312.db2.gz	SYWVESKJVZIPBW-ICSRJNTNSA-N	0	3	343.446	3.026	20	30		EGEDHN
C=CC[C@@H](C(=O)N1CCCN(C[C@H](CC)OC)CC1)c1ccccc1	ZINC001198197488	1368978532	/nfs/dbraw/zinc/97/85/32/1368978532.db2.gz	OPUIJDJIKAOUMD-VQTJNVASSA-N	0	3	344.499	3.306	20	30		EGEDHN
C=CC[C@H](C(=O)N1CCCN(C[C@H](CC)OC)CC1)c1ccccc1	ZINC001198197484	1368979079	/nfs/dbraw/zinc/97/90/79/1368979079.db2.gz	OPUIJDJIKAOUMD-PMACEKPBSA-N	0	3	344.499	3.306	20	30		EGEDHN
C=CCOCCCC(=O)N1CCN(CC2CCC3(CC3)CC2)CC1	ZINC001112757730	1368988932	/nfs/dbraw/zinc/98/89/32/1368988932.db2.gz	VCPMXUVSMMGNPA-UHFFFAOYSA-N	0	3	334.504	3.084	20	30		EGEDHN
C=CCCOCC(=O)N1CCCN(CCCc2cccc(C)c2)CC1	ZINC001198323661	1369009033	/nfs/dbraw/zinc/00/90/33/1369009033.db2.gz	ACSIZTUPZYXQRP-UHFFFAOYSA-N	0	3	344.499	3.055	20	30		EGEDHN
C=CCC1(C(=O)N2CCCN(CCCCCOC)CC2)CCCC1	ZINC001198423655	1369029931	/nfs/dbraw/zinc/02/99/31/1369029931.db2.gz	VGXASRNLIMKDAS-UHFFFAOYSA-N	0	3	336.520	3.474	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)c1cccc(F)c1)c1ccccc1OC	ZINC001198509111	1369048943	/nfs/dbraw/zinc/04/89/43/1369048943.db2.gz	RNIBNKOLQRFZAV-GOSISDBHSA-N	0	3	342.414	3.471	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)CCSC)c1ccccc1OC	ZINC001198515085	1369050017	/nfs/dbraw/zinc/05/00/17/1369050017.db2.gz	KDBAVYBNRKBYMM-INIZCTEOSA-N	0	3	336.501	3.161	20	30		EGEDHN
C=CCC[C@@H](C)N[C@@H](CNC(=O)CCOCC)c1ccccc1OC	ZINC001198606272	1369072397	/nfs/dbraw/zinc/07/23/97/1369072397.db2.gz	PSGSTMBJMFFZAI-AEFFLSMTSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)C1CC(C)C1)c1ccccc1OC	ZINC001198655888	1369084464	/nfs/dbraw/zinc/08/44/64/1369084464.db2.gz	IAZQOJATGFECLI-LEOMRAHMSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCC[C@@H](C)N[C@@H](CNC(=O)C#CC1CC1)c1ccccc1OC	ZINC001198723843	1369099995	/nfs/dbraw/zinc/09/99/95/1369099995.db2.gz	LJBZOOOXUJLZPY-APWZRJJASA-N	0	3	340.467	3.210	20	30		EGEDHN
COc1ccccc1[C@H](CNC(=O)C#CC(C)(C)C)NCC(C)C	ZINC001198723465	1369100023	/nfs/dbraw/zinc/10/00/23/1369100023.db2.gz	HYPJXBVHAXARGH-KRWDZBQOSA-N	0	3	330.472	3.148	20	30		EGEDHN
CCCCN[C@H](CNC(=O)C#CC(C)(C)C)c1ccccc1OC	ZINC001198724502	1369100547	/nfs/dbraw/zinc/10/05/47/1369100547.db2.gz	WPMAXOHULYNHOG-QGZVFWFLSA-N	0	3	330.472	3.292	20	30		EGEDHN
CCCCCCN[C@@H](CNC(=O)C#CC1CC1)c1ccccc1OC	ZINC001198724081	1369100774	/nfs/dbraw/zinc/10/07/74/1369100774.db2.gz	PHBIUORJWJEHSA-IBGZPJMESA-N	0	3	342.483	3.436	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@@H](NCCCF)c1ccccc1OC	ZINC001198740865	1369102954	/nfs/dbraw/zinc/10/29/54/1369102954.db2.gz	GZCMTRCYYXUJFY-MRXNPFEDSA-N	0	3	336.451	3.404	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NC[C@@H](NCCC)c1ccccc1OC)OCC	ZINC001198752173	1369105057	/nfs/dbraw/zinc/10/50/57/1369105057.db2.gz	MYBMMKFRZDGHOB-MJGOQNOKSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@H](C)C1CCC1)c1ccccc1OC	ZINC001198777280	1369112176	/nfs/dbraw/zinc/11/21/76/1369112176.db2.gz	XTJOHBXWGAERBB-QAPCUYQASA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)CCC(F)F)c1ccccc1OC	ZINC001198796959	1369116683	/nfs/dbraw/zinc/11/66/83/1369116683.db2.gz	OUDIAKZPWPCXDT-AWEZNQCLSA-N	0	3	326.387	3.064	20	30		EGEDHN
C=CC[C@@H](C(=O)N[C@@H]1CN(CCCCCC)C[C@H]1O)c1ccccc1	ZINC001198880972	1369137741	/nfs/dbraw/zinc/13/77/41/1369137741.db2.gz	RASOTFKNONEPMI-VAMGGRTRSA-N	0	3	344.499	3.088	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)C(C)(C)C(F)F)c1ccccc1OC	ZINC001198893960	1369141807	/nfs/dbraw/zinc/14/18/07/1369141807.db2.gz	CISOIERNLYPKDO-CQSZACIVSA-N	0	3	340.414	3.310	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@H](NCC1CC1)c1ccccc1OC	ZINC001198915799	1369147953	/nfs/dbraw/zinc/14/79/53/1369147953.db2.gz	BEUROQKWRWFKAW-KRWDZBQOSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)C(C)(C)CCOC)c1ccccc1OC	ZINC001198953568	1369156644	/nfs/dbraw/zinc/15/66/44/1369156644.db2.gz	QEVQMBZIBHZJPE-QGZVFWFLSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@@H]2CCCCC2(C)C)C1	ZINC001199245646	1369197290	/nfs/dbraw/zinc/19/72/90/1369197290.db2.gz	HBZKVZFSZUARFE-RCCFBDPRSA-N	0	3	336.520	3.111	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CCC(NCc2cc(O)ccc2Cl)CC1	ZINC001200471400	1369375905	/nfs/dbraw/zinc/37/59/05/1369375905.db2.gz	GVTOEMKMUMKDRQ-UHFFFAOYSA-N	0	3	348.874	3.176	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)C[C@H]2OCCc3ccccc32)CC1	ZINC001113559425	1369493322	/nfs/dbraw/zinc/49/33/22/1369493322.db2.gz	SRIJJZDBWZKEKO-YLJYHZDGSA-N	0	3	342.483	3.189	20	30		EGEDHN
C#CCNC[C@@H]1CN(C(=O)[C@@H](CC2CCCCC2)C(C)C)CCCO1	ZINC001201546136	1369571227	/nfs/dbraw/zinc/57/12/27/1369571227.db2.gz	GDTIGOSCAJXQGC-UXHICEINSA-N	0	3	348.531	3.069	20	30		EGEDHN
CC#CCNC[C@H]1CN(C(=O)[C@@H](CCCCC)C(C)C)CCCO1	ZINC001201822439	1369629300	/nfs/dbraw/zinc/62/93/00/1369629300.db2.gz	AORSQBBMGRQZTL-OALUTQOASA-N	0	3	336.520	3.069	20	30		EGEDHN
CCCCCCCCCCS(=O)(=O)N1CC2(C1)CCN(C)CC2	ZINC001201836541	1369631693	/nfs/dbraw/zinc/63/16/93/1369631693.db2.gz	KAGQYJUWFYJOPC-UHFFFAOYSA-N	0	3	344.565	3.485	20	30		EGEDHN
CCCCCCCCCN1C[C@@H]2[C@H](C1)OCCN2c1ccc(C)nn1	ZINC001201838974	1369632170	/nfs/dbraw/zinc/63/21/70/1369632170.db2.gz	GYAJUEQVXIVEMP-MOPGFXCFSA-N	0	3	346.519	3.425	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC(NCc2ncc(C)s2)CC1	ZINC001202004837	1369664717	/nfs/dbraw/zinc/66/47/17/1369664717.db2.gz	OYTORFHUAAOLIK-UHFFFAOYSA-N	0	3	333.501	3.116	20	30		EGEDHN
C#CCNC[C@H]1CN(C(=O)CC2CCC(C(C)(C)C)CC2)CCCO1	ZINC001202164404	1369705152	/nfs/dbraw/zinc/70/51/52/1369705152.db2.gz	LYHUIXIKMSHSRV-ACBHZAAOSA-N	0	3	348.531	3.069	20	30		EGEDHN
CCCC(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C12CCC2	ZINC001202337664	1369742453	/nfs/dbraw/zinc/74/24/53/1369742453.db2.gz	UMKUJHSBXAHFBG-IRXDYDNUSA-N	0	3	329.419	3.014	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC(NCc2nc(C)c(C)s2)CC1	ZINC001202694921	1369854597	/nfs/dbraw/zinc/85/45/97/1369854597.db2.gz	WFANTVKCWQEONE-UHFFFAOYSA-N	0	3	335.517	3.443	20	30		EGEDHN
O=C(/C=C\C1CC1)N[C@@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202713326	1369862448	/nfs/dbraw/zinc/86/24/48/1369862448.db2.gz	LYWWPNUZEMHJJY-BKXKBDSGSA-N	0	3	334.463	3.021	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1[C@H]2CN(Cc3cccc(OC)c3C)C[C@H]21	ZINC001114340542	1369900919	/nfs/dbraw/zinc/90/09/19/1369900919.db2.gz	IHJKQNYFGCOZOQ-YRWFTTLQSA-N	0	3	342.483	3.152	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1[C@H]2CN([C@H](C)c3cccc(OC)c3)C[C@H]21	ZINC001114353700	1369908146	/nfs/dbraw/zinc/90/81/46/1369908146.db2.gz	YEQXPYGPSAKLMZ-QKUWSGOFSA-N	0	3	328.456	3.159	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@@H]1C[C@@H](NCc2ccccc2F)C12CCC2	ZINC001202920783	1369927248	/nfs/dbraw/zinc/92/72/48/1369927248.db2.gz	PAUQRUCAKAMRIF-QZTJIDSGSA-N	0	3	342.458	3.392	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1C[C@H](NCc2ccccn2)C12CCC2	ZINC001202952287	1369934709	/nfs/dbraw/zinc/93/47/09/1369934709.db2.gz	VMQQSHGYDBGOJR-OALUTQOASA-N	0	3	339.483	3.367	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1C[C@@H](NCc2ocnc2C)C12CCC2	ZINC001202959122	1369936652	/nfs/dbraw/zinc/93/66/52/1369936652.db2.gz	AHUUEXVELGTHGP-MSOLQXFVSA-N	0	3	343.471	3.268	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1C[C@@H](NCc2ccc(F)cn2)C12CCC2	ZINC001202988230	1369947376	/nfs/dbraw/zinc/94/73/76/1369947376.db2.gz	RKKKEBMWMGWPQT-IAGOWNOFSA-N	0	3	331.435	3.094	20	30		EGEDHN
CC[C@H](C)[C@@H](C)C(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001203091727	1369979958	/nfs/dbraw/zinc/97/99/58/1369979958.db2.gz	FKAXTUNHLMIGRI-JKSUJKDBSA-N	0	3	327.472	3.321	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1[C@H]2CN(CCc3ccc(F)c(F)c3)C[C@H]21	ZINC001114681322	1370022475	/nfs/dbraw/zinc/02/24/75/1370022475.db2.gz	SBFOEWUNTABUNG-HWWDLCQESA-N	0	3	348.437	3.156	20	30		EGEDHN
CC[NH+](CC)CCn1cc([N-]c2onc(C(C)(C)C)c2C#N)cn1	ZINC001203252073	1370042021	/nfs/dbraw/zinc/04/20/21/1370042021.db2.gz	OKHQLYAUPLUXDP-UHFFFAOYSA-N	0	3	330.436	3.126	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1[C@H]2CN(CCOc3cccc(C)c3)C[C@H]21	ZINC001114720636	1370044996	/nfs/dbraw/zinc/04/49/96/1370044996.db2.gz	ZWQVYBJTHQRZTN-RBAQFSTRSA-N	0	3	342.483	3.023	20	30		EGEDHN
CC1(C(=O)N[C@@H]2C[C@H](NCC#Cc3ccccc3)C23CCC3)CCC1	ZINC001203259009	1370045632	/nfs/dbraw/zinc/04/56/32/1370045632.db2.gz	UKEZSMXWBYSFLL-RBUKOAKNSA-N	0	3	336.479	3.245	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1[C@H]2CN(Cc3ccc(F)cc3C)C[C@H]21	ZINC001114725900	1370048866	/nfs/dbraw/zinc/04/88/66/1370048866.db2.gz	DFMVJHUUZXQMBJ-QKUWSGOFSA-N	0	3	330.447	3.283	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1[C@H]2CN([C@@H](C)c3cccc(OC)c3)C[C@H]21	ZINC001114759048	1370064978	/nfs/dbraw/zinc/06/49/78/1370064978.db2.gz	AYCDDOQEIZOQFK-FEUVXWNVSA-N	0	3	328.456	3.159	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2[C@H]3CN(Cc4csc(C)c4)C[C@H]32)CCC1	ZINC001114783243	1370077492	/nfs/dbraw/zinc/07/74/92/1370077492.db2.gz	MPJBCZPWLYXRIU-FVQHAEBGSA-N	0	3	330.497	3.349	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001203341893	1370090636	/nfs/dbraw/zinc/09/06/36/1370090636.db2.gz	UNJLCFXFKJBTEX-WOJBJXKFSA-N	0	3	336.479	3.411	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CCN(Cc3ccccc3F)C2)C1	ZINC001203345949	1370092322	/nfs/dbraw/zinc/09/23/22/1370092322.db2.gz	DWWUYYIYAFGZCO-LJQANCHMSA-N	0	3	332.419	3.436	20	30		EGEDHN
O=C(N[C@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2)C1CC2(CC2)C1	ZINC001203402612	1370113433	/nfs/dbraw/zinc/11/34/33/1370113433.db2.gz	IQRJSJSNWRWPPN-PMACEKPBSA-N	0	3	348.490	3.245	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)CCCCCOCC)C12CCC2	ZINC001203804428	1370271312	/nfs/dbraw/zinc/27/13/12/1370271312.db2.gz	SXQQUUOFPFKULQ-HZPDHXFCSA-N	0	3	342.911	3.353	20	30		EGEDHN
CC[C@H](CC(C)C)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001115090916	1370271838	/nfs/dbraw/zinc/27/18/38/1370271838.db2.gz	FYRHRKNQSLPZNM-ZRNYENFQSA-N	0	3	339.483	3.177	20	30		EGEDHN
C=CCOC(=O)N1CCCC2(CCN(Cc3cccc(O)c3)CC2)C1	ZINC001203858383	1370291229	/nfs/dbraw/zinc/29/12/29/1370291229.db2.gz	LECFKDJRVLOFGL-UHFFFAOYSA-N	0	3	344.455	3.393	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@]3(C[C@H](Oc4ccccn4)CO3)C2)cc1	ZINC001203902248	1370306646	/nfs/dbraw/zinc/30/66/46/1370306646.db2.gz	XRXJSRBKBQGQNK-PZJWPPBQSA-N	0	3	349.434	3.156	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CCN(Cc3ccc(F)cc3)C2)C1	ZINC001203912290	1370312033	/nfs/dbraw/zinc/31/20/33/1370312033.db2.gz	PXDCTWSIYLDTKA-LJQANCHMSA-N	0	3	332.419	3.436	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)C(C)(C)F)CCCCC1	ZINC001115378663	1370418075	/nfs/dbraw/zinc/41/80/75/1370418075.db2.gz	AKRPQHHBYVJEBD-UHFFFAOYSA-N	0	3	335.261	3.052	20	30		EGEDHN
CN1CCN(Cc2cccc(Nc3cc(F)c(F)cc3C#N)c2)CC1	ZINC001204575181	1370520896	/nfs/dbraw/zinc/52/08/96/1370520896.db2.gz	ZVYHOYITPIBMMA-UHFFFAOYSA-N	0	3	342.393	3.327	20	30		EGEDHN
O=C(NCC1(NCC#Cc2ccccc2)CCCCC1)[C@H]1CC1(F)F	ZINC001115522377	1370521347	/nfs/dbraw/zinc/52/13/47/1370521347.db2.gz	OVHSVRCPHSSEFD-QGZVFWFLSA-N	0	3	346.421	3.102	20	30		EGEDHN
O=C(NCC1(NCC#Cc2ccccc2)CCCCC1)c1cc[nH]c1	ZINC001115550295	1370546567	/nfs/dbraw/zinc/54/65/67/1370546567.db2.gz	DENWRPCVOVTFRE-UHFFFAOYSA-N	0	3	335.451	3.089	20	30		EGEDHN
C=C(C)CCC(=O)NCC1(NCc2cnc(C)nc2)CCCCC1	ZINC001115556817	1370554776	/nfs/dbraw/zinc/55/47/76/1370554776.db2.gz	DDRUYHVIOXURCO-UHFFFAOYSA-N	0	3	330.476	3.050	20	30		EGEDHN
C=CCCC(=O)N1CCC(CNCc2nc3ccccc3o2)CC1	ZINC001204748336	1370564624	/nfs/dbraw/zinc/56/46/24/1370564624.db2.gz	LFGZZRBLMQSOSN-UHFFFAOYSA-N	0	3	327.428	3.122	20	30		EGEDHN
C#CCOc1ccc(Nc2ccc(CN3CCN(C)CC3)cc2)cc1	ZINC001204751559	1370565599	/nfs/dbraw/zinc/56/55/99/1370565599.db2.gz	UWNGBNRBHMLHHF-UHFFFAOYSA-N	0	3	335.451	3.190	20	30		EGEDHN
Cc1cc(C#N)c(Nc2ccc(CN3CCN(C)CC3)cc2)cc1F	ZINC001204765768	1370571490	/nfs/dbraw/zinc/57/14/90/1370571490.db2.gz	LWZJKLYOQFHTMG-UHFFFAOYSA-N	0	3	338.430	3.497	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cccc(CC)n2)CCCCC1	ZINC001115574584	1370577932	/nfs/dbraw/zinc/57/79/32/1370577932.db2.gz	DZEQRHOUSIXLCR-UHFFFAOYSA-N	0	3	335.879	3.419	20	30		EGEDHN
N[C@H]1CN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C[C@H]1F	ZINC001204819022	1370582634	/nfs/dbraw/zinc/58/26/34/1370582634.db2.gz	BFFDYOBMJBTRNJ-MNOVXSKESA-N	0	3	330.247	3.205	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccn3ccnc3c2)CCCCC1	ZINC001115627791	1370621337	/nfs/dbraw/zinc/62/13/37/1370621337.db2.gz	RCNGBIDYDKRXEX-UHFFFAOYSA-N	0	3	346.862	3.109	20	30		EGEDHN
CC[C@H](F)C(=O)NCC1(NCC#Cc2ccccc2)CCCCC1	ZINC001115670255	1370651794	/nfs/dbraw/zinc/65/17/94/1370651794.db2.gz	DYXRVSVMYHYBJQ-SFHVURJKSA-N	0	3	330.447	3.195	20	30		EGEDHN
CC[C@@H](C)CC(=O)N1CCC(CNCc2cc(F)ccc2C#N)CC1	ZINC001205108507	1370652756	/nfs/dbraw/zinc/65/27/56/1370652756.db2.gz	ZKFCCHXZTJGIGB-OAHLLOKOSA-N	0	3	345.462	3.462	20	30		EGEDHN
CN1CCN(C2(c3ccc(Nc4ccc(O)cc4C#N)cc3)CC2)CC1	ZINC001205121323	1370656555	/nfs/dbraw/zinc/65/65/55/1370656555.db2.gz	VGYCODKPNBKSCT-UHFFFAOYSA-N	0	3	348.450	3.244	20	30		EGEDHN
C#CCCCC(=O)N1CCC(CNCc2oc(C(C)C)nc2C)CC1	ZINC001205131873	1370659860	/nfs/dbraw/zinc/65/98/60/1370659860.db2.gz	YZXZGFLKDWRWEO-UHFFFAOYSA-N	0	3	345.487	3.238	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)C2CCC(OC)CC2)CCCCC1	ZINC001115699384	1370681083	/nfs/dbraw/zinc/68/10/83/1370681083.db2.gz	DNMPTXKOOAHRDV-UHFFFAOYSA-N	0	3	342.911	3.353	20	30		EGEDHN
C=CCCCC(=O)NCC1(NCc2cnc(C)cn2)CCCCC1	ZINC001115701685	1370683518	/nfs/dbraw/zinc/68/35/18/1370683518.db2.gz	ZXLYISKFKFRKNS-UHFFFAOYSA-N	0	3	330.476	3.050	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)/C(C)=C\CC)CC[C@H]1c1ccc(F)cc1	ZINC001205257712	1370697620	/nfs/dbraw/zinc/69/76/20/1370697620.db2.gz	XDWXUMLZBBRRFK-DRRIMPMXSA-N	0	3	328.431	3.089	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)[C@H]2CC23CC3)CCCCC1	ZINC001115747668	1370728362	/nfs/dbraw/zinc/72/83/62/1370728362.db2.gz	UTXGNFBNBRJMOH-CYBMUJFWSA-N	0	3	341.293	3.104	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccn(C(C)C)n2)CCCCC1	ZINC001115753855	1370735438	/nfs/dbraw/zinc/73/54/38/1370735438.db2.gz	CQEPVSZMYGNCPK-UHFFFAOYSA-N	0	3	338.883	3.239	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC(CN[C@H](C)c2cnccn2)CC1	ZINC001205384474	1370738499	/nfs/dbraw/zinc/73/84/99/1370738499.db2.gz	VISMEKAVINQWEM-MRXNPFEDSA-N	0	3	342.487	3.134	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H](C)CCCC)C[C@H]1c1cccc(F)c1	ZINC001205406061	1370746053	/nfs/dbraw/zinc/74/60/53/1370746053.db2.gz	CTOLBVAQTKAAJY-ZYSHUDEJSA-N	0	3	330.447	3.169	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)CC(C)=C(C)C)C[C@H]1c1cccc(F)c1	ZINC001205424603	1370751230	/nfs/dbraw/zinc/75/12/30/1370751230.db2.gz	KFOICCVXXWIYCL-RBUKOAKNSA-N	0	3	328.431	3.089	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2nc(CC)oc2C)CCCCC1	ZINC001115769113	1370753500	/nfs/dbraw/zinc/75/35/00/1370753500.db2.gz	WIMTXUYAWLMJPS-UHFFFAOYSA-N	0	3	339.867	3.320	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)N1CCC(CNCc2cc(C3CC3)no2)CC1	ZINC001205955326	1370922322	/nfs/dbraw/zinc/92/23/22/1370922322.db2.gz	PRUIFWUSEXYBTQ-HUUCEWRRSA-N	0	3	345.487	3.338	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)N1CCC(CNCc2ncc(C)s2)CC1	ZINC001205954557	1370922698	/nfs/dbraw/zinc/92/26/98/1370922698.db2.gz	HMILXJKAGKAFHF-ZFWWWQNUSA-N	0	3	335.517	3.238	20	30		EGEDHN
CC#CCCCC(=O)N1CCC(CNCc2ccncc2Cl)CC1	ZINC001205966226	1370924348	/nfs/dbraw/zinc/92/43/48/1370924348.db2.gz	OOAXNBUVGKQXHN-UHFFFAOYSA-N	0	3	347.890	3.257	20	30		EGEDHN
C=CCOCCCC(=O)N[C@@H]1CN(C/C=C/c2ccccc2)C[C@H]1C	ZINC001206778737	1371162092	/nfs/dbraw/zinc/16/20/92/1371162092.db2.gz	ICDRVYYRFJNPAZ-ZPPSIVDRSA-N	0	3	342.483	3.119	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CN(Cc2cccc(OC)c2C)C[C@H]1C	ZINC001206886119	1371206936	/nfs/dbraw/zinc/20/69/36/1371206936.db2.gz	SRWKPZXEHITADT-VQIMIIECSA-N	0	3	342.483	3.134	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CN([C@H]2CCc3c2cccc3F)C[C@H]1C	ZINC001206911101	1371220638	/nfs/dbraw/zinc/22/06/38/1371220638.db2.gz	BQNUMGDOVRNLSN-ZMYBRWDISA-N	0	3	328.431	3.053	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1CN(Cc2ccc(C(C)C)cc2)C[C@H]1C	ZINC001206938212	1371234174	/nfs/dbraw/zinc/23/41/74/1371234174.db2.gz	MBMRPHSOVDHEDP-YLJYHZDGSA-N	0	3	326.484	3.406	20	30		EGEDHN
COc1cccc(OCC2CCN(Cc3cc(C#N)n(C)c3)CC2)c1	ZINC001207109487	1371296619	/nfs/dbraw/zinc/29/66/19/1371296619.db2.gz	MGDNQRBVJNJCTR-UHFFFAOYSA-N	0	3	339.439	3.196	20	30		EGEDHN
Cc1cccc(C(=O)N2CCC[C@H](NCC#Cc3ccccc3)C2)c1	ZINC001207136593	1371305689	/nfs/dbraw/zinc/30/56/89/1371305689.db2.gz	UURBJLQAKRIAGK-NRFANRHFSA-N	0	3	332.447	3.241	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H](CN2CCc3cc(C#N)ccc3C2)C1	ZINC001207206736	1371329034	/nfs/dbraw/zinc/32/90/34/1371329034.db2.gz	QMPVQHXCCBDJLX-INIZCTEOSA-N	0	3	341.455	3.173	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN(CCOc2ccccc2C)C[C@H]1C	ZINC001207215512	1371331600	/nfs/dbraw/zinc/33/16/00/1371331600.db2.gz	JXPCUIAAEBBHEJ-QZTJIDSGSA-N	0	3	330.472	3.167	20	30		EGEDHN
CCOC(=O)COc1ccc(CN[C@@H](C)c2cccc(C#N)c2)cc1	ZINC001119496784	1371355893	/nfs/dbraw/zinc/35/58/93/1371355893.db2.gz	VJNVXPISTVIJGX-HNNXBMFYSA-N	0	3	338.407	3.351	20	30		EGEDHN
CCCCCC(=O)N1CCC[C@@H](NCc2cc(C#N)ccc2OC)C1	ZINC001207344043	1371365174	/nfs/dbraw/zinc/36/51/74/1371365174.db2.gz	RKOFGIGTIVROHQ-GOSISDBHSA-N	0	3	343.471	3.228	20	30		EGEDHN
CC(C)(C)C(=O)NCC1(NCC#Cc2ccccc2)CCCCC1	ZINC001120046469	1371468050	/nfs/dbraw/zinc/46/80/50/1371468050.db2.gz	ZTINSSMVHAKCLS-UHFFFAOYSA-N	0	3	326.484	3.493	20	30		EGEDHN
CC(C)(C)/C=C/C(=O)N1CCC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001207710840	1371482025	/nfs/dbraw/zinc/48/20/25/1371482025.db2.gz	SJYQWBLMGULWCP-KBOKABMXSA-N	0	3	343.446	3.380	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC[C@@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207763566	1371497802	/nfs/dbraw/zinc/49/78/02/1371497802.db2.gz	FBFOVDGTKWUKQN-KPGDTVGWSA-N	0	3	330.859	3.238	20	30		EGEDHN
CC1CC(C(=O)N2CCC[C@@H](NCC#Cc3cccc(Cl)c3)C2)C1	ZINC001207782362	1371502030	/nfs/dbraw/zinc/50/20/30/1371502030.db2.gz	DDQAGLNITBBVED-GXOAENINSA-N	0	3	344.886	3.318	20	30		EGEDHN
C=CCOC[C@H]1c2c(ncn2C)CCN1CC1(c2ccccc2)CC1	ZINC001207838224	1371516614	/nfs/dbraw/zinc/51/66/14/1371516614.db2.gz	XRSSVHYJXYHYLX-IBGZPJMESA-N	0	3	337.467	3.254	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H]([C@H]2CCCN2Cc2nc(C)oc2C)C1	ZINC001120348582	1371542939	/nfs/dbraw/zinc/54/29/39/1371542939.db2.gz	YSSMJRDKYVLMDU-IEBWSBKVSA-N	0	3	345.487	3.461	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H](N[C@H]2CCc3c2c(F)ccc3F)C1	ZINC001207943973	1371545312	/nfs/dbraw/zinc/54/53/12/1371545312.db2.gz	GXHTZWPVBFMULQ-KSSFIOAISA-N	0	3	346.421	3.336	20	30		EGEDHN
Cc1coc(C)c1C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001207966779	1371554464	/nfs/dbraw/zinc/55/44/64/1371554464.db2.gz	ZWGIBYGPPPZZNT-LJQANCHMSA-N	0	3	336.435	3.142	20	30		EGEDHN
C=CCCOCC(=O)N1CCC[C@H]([C@@H]2CCCN2CC(=C)Cl)C1	ZINC001120467756	1371587192	/nfs/dbraw/zinc/58/71/92/1371587192.db2.gz	BJKUNBBXUWPABF-IRXDYDNUSA-N	0	3	340.895	3.035	20	30		EGEDHN
C=CCOCc1nn(C)c2c1CN(C[C@H]1CCC(C)=C[C@H]1C)CC2	ZINC001208171159	1371617029	/nfs/dbraw/zinc/61/70/29/1371617029.db2.gz	SODGJQYPHPEOPC-IAGOWNOFSA-N	0	3	329.488	3.473	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CCC[C@@H](NCc2ccccc2F)C1)OCC	ZINC001208263793	1371690942	/nfs/dbraw/zinc/69/09/42/1371690942.db2.gz	CLXHJLLKJSNROL-MJGOQNOKSA-N	0	3	348.462	3.278	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CN(Cc2cccc(COC)c2)C[C@H]1C	ZINC001208292265	1371703754	/nfs/dbraw/zinc/70/37/54/1371703754.db2.gz	PGWXLNQVBBFJPL-VQIMIIECSA-N	0	3	344.499	3.372	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN(CCOc2c(C)cccc2C)C[C@H]1C	ZINC001208318141	1371715827	/nfs/dbraw/zinc/71/58/27/1371715827.db2.gz	LRAMPBNNVDAYDD-QZTJIDSGSA-N	0	3	344.499	3.331	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1CN(CCOc2cccc(F)c2)C[C@H]1C	ZINC001208395675	1371753379	/nfs/dbraw/zinc/75/33/79/1371753379.db2.gz	BABFEHYNJQSIJF-JTDSTZFVSA-N	0	3	348.462	3.243	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N1CCC[C@H](NCc2ccccc2F)C1	ZINC001208797821	1371899594	/nfs/dbraw/zinc/89/95/94/1371899594.db2.gz	VGECMELFQUFLEC-FXAWDEMLSA-N	0	3	348.462	3.135	20	30		EGEDHN
N#Cc1cccc(CCCN2CCN(c3ccccc3C#N)CC2)c1	ZINC001208844102	1371915040	/nfs/dbraw/zinc/91/50/40/1371915040.db2.gz	DKYUPXRBZYDXNM-UHFFFAOYSA-N	0	3	330.435	3.185	20	30		EGEDHN
N#Cc1ccc(CCCN2CCN(CCc3cccs3)CC2)cc1	ZINC001208859388	1371921539	/nfs/dbraw/zinc/92/15/39/1371921539.db2.gz	YSUXNPPRHCRHHC-UHFFFAOYSA-N	0	3	339.508	3.413	20	30		EGEDHN
N#Cc1ccc(CCCN2CCN(c3cccc(C#N)c3)CC2)cc1	ZINC001208864127	1371923745	/nfs/dbraw/zinc/92/37/45/1371923745.db2.gz	IVWHDRVZTBRNBP-UHFFFAOYSA-N	0	3	330.435	3.185	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC[C@@H](NCC=C(Cl)Cl)C2)cc1	ZINC001208901161	1371938307	/nfs/dbraw/zinc/93/83/07/1371938307.db2.gz	MJJLAOVXHOUIND-OAHLLOKOSA-N	0	3	337.250	3.181	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001208962679	1371963328	/nfs/dbraw/zinc/96/33/28/1371963328.db2.gz	OXDPWMMSOFVULY-SFHVURJKSA-N	0	3	344.886	3.484	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC[C@H](NCc2c(C)nsc2C)C1	ZINC001209002347	1371971293	/nfs/dbraw/zinc/97/12/93/1371971293.db2.gz	AAQKUKDTPAWNTG-KRWDZBQOSA-N	0	3	347.528	3.424	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CCC[C@@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001209020950	1371977216	/nfs/dbraw/zinc/97/72/16/1371977216.db2.gz	XSQCAZZXHZFMNH-IAGOWNOFSA-N	0	3	336.838	3.020	20	30		EGEDHN
C#CCCCCCC(=O)NC1CC2(CC(NCc3cnc(C)o3)C2)C1	ZINC001121534640	1372002359	/nfs/dbraw/zinc/00/23/59/1372002359.db2.gz	QLKYIMUQZGIXFS-UHFFFAOYSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NC1CC2(CC(NCc3ncc(C)s3)C2)C1	ZINC001121609378	1372023194	/nfs/dbraw/zinc/02/31/94/1372023194.db2.gz	CNFRMGWBWPJSEE-YQBUTTRJSA-N	0	3	347.528	3.427	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC1CC2(CC(NCc3ccn(CC)n3)C2)C1	ZINC001121617234	1372027568	/nfs/dbraw/zinc/02/75/68/1372027568.db2.gz	UNXCVJXTQBRHIL-YUCHZMFVSA-N	0	3	344.503	3.022	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@H]2CN(Cc3ccc(C(F)F)cc3)C[C@H]21	ZINC001187840205	1388174885	/nfs/dbraw/zinc/17/48/85/1388174885.db2.gz	AGZMTMULWJMFJN-ZWKOTPCHSA-N	0	3	346.421	3.316	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@@H](NCc2cc(C)ccc2OC)C1	ZINC001209346927	1372073910	/nfs/dbraw/zinc/07/39/10/1372073910.db2.gz	XBQQUWUOOWBJPL-GOSISDBHSA-N	0	3	330.472	3.441	20	30		EGEDHN
C=CCOCc1nn(CC2CC2)c2c1CN(CCC(C)(C)OC)CC2	ZINC001209405557	1372095803	/nfs/dbraw/zinc/09/58/03/1372095803.db2.gz	HNGHTSBKKGVKBY-UHFFFAOYSA-N	0	3	347.503	3.169	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3c[nH]c4c3cccc4C)C2)C1=O	ZINC001209482207	1372117642	/nfs/dbraw/zinc/11/76/42/1372117642.db2.gz	GIUDVVIEYCHGCH-NRFANRHFSA-N	0	3	337.467	3.477	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)NCc1csc(CCc2ccccc2)n1	ZINC001121926392	1372124991	/nfs/dbraw/zinc/12/49/91/1372124991.db2.gz	NEXKJURETCTFQU-QGZVFWFLSA-N	0	3	343.496	3.228	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)COc1cccc(C)c1)C2	ZINC001122177869	1372195202	/nfs/dbraw/zinc/19/52/02/1372195202.db2.gz	LFAIVEFUSYUYFQ-UHFFFAOYSA-N	0	3	348.874	3.143	20	30		EGEDHN
CC(C)n1ccc(CC(=O)C(C#N)C(=O)Nc2ccccc2Cl)n1	ZINC001122498143	1372260450	/nfs/dbraw/zinc/26/04/50/1372260450.db2.gz	KRFXWVGJQOJPFZ-ZDUSSCGKSA-N	0	3	344.802	3.007	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CCCN(C)C2)nnc1N1C[C@H](C)[C@H](C)[C@@H]1C	ZINC001122544009	1372271058	/nfs/dbraw/zinc/27/10/58/1372271058.db2.gz	QXWGFUAUUKLLDX-QAETUUGQSA-N	0	3	331.508	3.144	20	30		EGEDHN
CC[C@H](C)c1ccc(NC(=O)C(C#N)C(=O)[C@@H]2[C@H]3CCCO[C@H]32)cc1	ZINC001122546892	1372271929	/nfs/dbraw/zinc/27/19/29/1372271929.db2.gz	DAHVPIGJUDMARY-IMRCUXDRSA-N	0	3	340.423	3.272	20	30		EGEDHN
N#CC(C(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1cccc(F)n1	ZINC001122714045	1372304342	/nfs/dbraw/zinc/30/43/42/1372304342.db2.gz	HXGSUGPUUPSXJY-CQSZACIVSA-N	0	3	342.330	3.197	20	30		EGEDHN
CC(C)Cn1c([C@H](C)CCC#N)nnc1N1CCN(CC(C)C)CC1	ZINC001122762620	1372316011	/nfs/dbraw/zinc/31/60/11/1372316011.db2.gz	HYIQLKFFNRTUOC-QGZVFWFLSA-N	0	3	346.523	3.119	20	30		EGEDHN
CCCCCCCCC(=O)N[C@@H]1CN(CCc2cnn(C)c2)C[C@H]1C	ZINC001210546854	1372375482	/nfs/dbraw/zinc/37/54/82/1372375482.db2.gz	BLGZZABCVRRTMR-IEBWSBKVSA-N	0	3	348.535	3.150	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCCC(=O)c1cccc(OC)c1	ZINC001123336022	1372430884	/nfs/dbraw/zinc/43/08/84/1372430884.db2.gz	BRFSPJGCYNBSNW-INIZCTEOSA-N	0	3	339.395	3.141	20	30		EGEDHN
CC(C)n1cccc1C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001211098793	1372484880	/nfs/dbraw/zinc/48/48/80/1372484880.db2.gz	UFIRZPISFXHVOG-HXUWFJFHSA-N	0	3	349.478	3.315	20	30		EGEDHN
C=CCCOCC(=O)N1CCC[C@@H](NCc2ccccc2Cl)C1	ZINC001211355463	1372539224	/nfs/dbraw/zinc/53/92/24/1372539224.db2.gz	SBFYSIRKFARMBT-MRXNPFEDSA-N	0	3	336.863	3.013	20	30		EGEDHN
C=C(CN1CCCCC1)c1nc(-c2ccc(OC)cc2OC)no1	ZINC001211436110	1372559064	/nfs/dbraw/zinc/55/90/64/1372559064.db2.gz	BAGFNQCTPOHHAZ-UHFFFAOYSA-N	0	3	329.400	3.253	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2ccc(Cl)o2)C[C@H]1c1ccccc1	ZINC001211532236	1372574050	/nfs/dbraw/zinc/57/40/50/1372574050.db2.gz	MXHQRBHCOXKGLF-JKSUJKDBSA-N	0	3	342.826	3.154	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@@H]2CCC(F)(F)C2)C[C@H]1c1ccccc1	ZINC001211611241	1372590136	/nfs/dbraw/zinc/59/01/36/1372590136.db2.gz	RRQNWFUENRJWAB-FGTMMUONSA-N	0	3	346.421	3.029	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)Cc2cccs2)[C@H](OC)C1	ZINC001211764364	1372612843	/nfs/dbraw/zinc/61/28/43/1372612843.db2.gz	FIKKRSVUHRCADP-IAGOWNOFSA-N	0	3	338.517	3.076	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN(CCCc2ccccc2C)C[C@H]1OC	ZINC001212344731	1372691180	/nfs/dbraw/zinc/69/11/80/1372691180.db2.gz	KCTUKYIOVZVORU-WOJBJXKFSA-N	0	3	344.499	3.099	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H](NC(=O)c2cscc2Cl)[C@H](OC)C1	ZINC001212440805	1372707136	/nfs/dbraw/zinc/70/71/36/1372707136.db2.gz	LTTAODICBUTMKZ-NILFDRSVSA-N	0	3	342.892	3.185	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CN([C@H](C)c2ccccc2C)C[C@H]1OC	ZINC001213260224	1372869606	/nfs/dbraw/zinc/86/96/06/1372869606.db2.gz	AOQMPDPKCWDYSH-BHIYHBOVSA-N	0	3	344.499	3.474	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN([C@@H](C)c2ccccc2C)C[C@H]1OC	ZINC001213267961	1372871480	/nfs/dbraw/zinc/87/14/80/1372871480.db2.gz	CTWFXLYSZIFWNO-CGTJXYLNSA-N	0	3	330.472	3.084	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CN([C@@H](C)c2cccc(C)c2)C[C@H]1OC	ZINC001213310101	1372881422	/nfs/dbraw/zinc/88/14/22/1372881422.db2.gz	CYLQRJCEIRPPNU-DFQSSKMNSA-N	0	3	342.483	3.065	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)C[C@H](C)c2ccc(CC)cc2)[C@H](OC)C1	ZINC001213442700	1372906804	/nfs/dbraw/zinc/90/68/04/1372906804.db2.gz	URXDZDQVXTXSDF-PWIZWCRZSA-N	0	3	344.499	3.134	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@@H](C)c2ccc(C)o2)[C@H](OC)C1	ZINC001213545286	1372924005	/nfs/dbraw/zinc/92/40/05/1372924005.db2.gz	LDCCVPZGYDZLOP-YQVWRLOYSA-N	0	3	348.487	3.253	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)[C@H](F)CCCCCC)[C@H](OC)C1	ZINC001213723288	1372951676	/nfs/dbraw/zinc/95/16/76/1372951676.db2.gz	CIMBDFSJCUEDTI-BRWVUGGUSA-N	0	3	328.472	3.077	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2ccc(F)cc2C)[C@H](OC)C1	ZINC001213751508	1372956962	/nfs/dbraw/zinc/95/69/62/1372956962.db2.gz	HUTPVHSRZOZPRV-RTBURBONSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2c(C)csc2Cl)[C@H](OC)C1	ZINC001213783229	1372961977	/nfs/dbraw/zinc/96/19/77/1372961977.db2.gz	KHBAGQRRCYNLHW-CHWSQXEVSA-N	0	3	342.892	3.105	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2ccc(C)cc2C)[C@H](OC)C1	ZINC001213801746	1372963079	/nfs/dbraw/zinc/96/30/79/1372963079.db2.gz	BTDWIFMWJJDRFT-WOJBJXKFSA-N	0	3	344.499	3.479	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2ccc(C)nc2C)[C@H](OC)C1	ZINC001213901697	1372977839	/nfs/dbraw/zinc/97/78/39/1372977839.db2.gz	YYTAPZSXCOFBDI-RTBURBONSA-N	0	3	347.503	3.098	20	30		EGEDHN
CC(C)CC(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001214056736	1373001834	/nfs/dbraw/zinc/00/18/34/1373001834.db2.gz	RJTJBPNCHSUYCU-CRAIPNDOSA-N	0	3	332.875	3.174	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H]2CN(CCc3ccc(F)c(F)c3)C[C@H]21	ZINC001188081002	1388237052	/nfs/dbraw/zinc/23/70/52/1388237052.db2.gz	TZQKFQMAZGNZQE-QFBILLFUSA-N	0	3	348.437	3.396	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H]2CN(Cc3cccc(OC)c3C)C[C@H]21	ZINC001188081017	1388237353	/nfs/dbraw/zinc/23/73/53/1388237353.db2.gz	UNFVUFDAWBLNII-RBUKOAKNSA-N	0	3	342.483	3.393	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H]2CN(C[C@H](OC)c3ccccc3)C[C@H]21	ZINC001188080863	1388238008	/nfs/dbraw/zinc/23/80/08/1388238008.db2.gz	NUTROGVJBZEWCZ-ZCNNSNEGSA-N	0	3	342.483	3.263	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@@H](C)[C@H](NCc2cc(C)ccc2F)C1	ZINC001214468064	1373066641	/nfs/dbraw/zinc/06/66/41/1373066641.db2.gz	SYRPKSUWVJHIBK-VQIMIIECSA-N	0	3	330.447	3.264	20	30		EGEDHN
CC1(C)[C@H](C(=O)NCCNCc2ccc(C#N)cc2)[C@H]1c1ccccc1	ZINC001127485401	1373131155	/nfs/dbraw/zinc/13/11/55/1373131155.db2.gz	BPXDDGVJKZSSOD-UXHICEINSA-N	0	3	347.462	3.204	20	30		EGEDHN
C[C@H](C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(F)cc2)C1)C(C)(C)C	ZINC001214967158	1373149411	/nfs/dbraw/zinc/14/94/11/1373149411.db2.gz	QRLATRIBUHXYAY-GPMSIDNRSA-N	0	3	344.474	3.296	20	30		EGEDHN
C[C@@H]1CN(C(=O)C(C)(C)C2CCC2)C[C@H]1NCC#Cc1ccccc1	ZINC001215245247	1373190110	/nfs/dbraw/zinc/19/01/10/1373190110.db2.gz	WHYHEQRYCOBISD-YLJYHZDGSA-N	0	3	338.495	3.301	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NCCNCc1ccc(F)c(Cl)c1)OCC	ZINC001128529172	1373284271	/nfs/dbraw/zinc/28/42/71/1373284271.db2.gz	ZUOWRDADNTVZEM-INIZCTEOSA-N	0	3	342.842	3.056	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NCCN[C@H](C)c1ccc(F)c(F)c1)OCC	ZINC001128539812	1373286230	/nfs/dbraw/zinc/28/62/30/1373286230.db2.gz	LAXBGPILXZOXHF-DYVFJYSZSA-N	0	3	340.414	3.103	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cc(F)c3ccccc3c2)cc1	ZINC001128890820	1373321161	/nfs/dbraw/zinc/32/11/61/1373321161.db2.gz	PFCQHEXDEASKBN-UHFFFAOYSA-N	0	3	347.393	3.370	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2cc(F)c3ccccc3c2)c1	ZINC001128891022	1373321460	/nfs/dbraw/zinc/32/14/60/1373321460.db2.gz	UJNNLNAKBZAJGI-UHFFFAOYSA-N	0	3	347.393	3.370	20	30		EGEDHN
CO/N=C/c1ccc(-c2nc(-c3ccc(CN(C)C)cc3)no2)cc1	ZINC001217065446	1373384232	/nfs/dbraw/zinc/38/42/32/1373384232.db2.gz	VJZNNYFCXSNSAF-UDWIEESQSA-N	0	3	336.395	3.446	20	30		EGEDHN
C=CCOc1ccc(C(=O)NCCNCc2cccc(Cl)c2)cc1	ZINC001130371542	1373508497	/nfs/dbraw/zinc/50/84/97/1373508497.db2.gz	YVIUUAWGZUZVFR-UHFFFAOYSA-N	0	3	344.842	3.424	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2OCCN(C(=O)c3cccc(C)c3F)[C@H]2C1	ZINC001217953263	1373517424	/nfs/dbraw/zinc/51/74/24/1373517424.db2.gz	BOCKBBIXHFBQBT-BPQIPLTHSA-N	0	3	346.446	3.014	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)C(CC=C)CC=C)[C@H]2C1	ZINC001217988723	1373528340	/nfs/dbraw/zinc/52/83/40/1373528340.db2.gz	WRXAFFBHYTWJIT-VQTJNVASSA-N	0	3	346.515	3.413	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)[C@@H](CCC)C(C)C)C1	ZINC001130431350	1373536105	/nfs/dbraw/zinc/53/61/05/1373536105.db2.gz	VYUTVORWSAEGGT-WBVHZDCISA-N	0	3	332.492	3.074	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCO[C@@H]2CN(CCCCCCC)C[C@@H]21	ZINC001218023057	1373540508	/nfs/dbraw/zinc/54/05/08/1373540508.db2.gz	KVRMQXWLPQVJCJ-ZWKOTPCHSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)[C@H](CCC)CC(C)C)C1	ZINC001130452462	1373544984	/nfs/dbraw/zinc/54/49/84/1373544984.db2.gz	FWRDJNQQSWICHO-IAGOWNOFSA-N	0	3	346.519	3.464	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)[C@H](C)C3CCC3)[C@H]2C1	ZINC001218153453	1373570711	/nfs/dbraw/zinc/57/07/11/1373570711.db2.gz	JRZRMFRFWCZDIK-NZSAHSFTSA-N	0	3	334.504	3.081	20	30		EGEDHN
CCCCCCCOC(=O)c1ccc(OC[C@H]2CNCCO2)cc1	ZINC001218179003	1373572897	/nfs/dbraw/zinc/57/28/97/1373572897.db2.gz	JISLOJLTTIYTRJ-GOSISDBHSA-N	0	3	335.444	3.181	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@@H](CC)CCCCC)C[C@H]1c1cn(C)cn1	ZINC001130731890	1373585556	/nfs/dbraw/zinc/58/55/56/1373585556.db2.gz	SICHBLHWKNRBKT-JENIJYKNSA-N	0	3	346.519	3.097	20	30		EGEDHN
Cc1cccc(Cl)c1CC(=O)NCCNCc1ccc(C#N)s1	ZINC001130834280	1373597890	/nfs/dbraw/zinc/59/78/90/1373597890.db2.gz	ZHAXOELHJJBWPI-UHFFFAOYSA-N	0	3	347.871	3.030	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)C[C@@H](CC)CCCC)[C@H]2C1	ZINC001218333834	1373599317	/nfs/dbraw/zinc/59/93/17/1373599317.db2.gz	XKNCRUXKUHVCPL-GBESFXJTSA-N	0	3	336.520	3.471	20	30		EGEDHN
CC(C)Cc1ccc(CC(=O)NCCNCc2cccc(C#N)c2)cc1	ZINC001130987842	1373621808	/nfs/dbraw/zinc/62/18/08/1373621808.db2.gz	PYGOULHZNYRDLQ-UHFFFAOYSA-N	0	3	349.478	3.205	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCO[C@@H]2CN(CC/C=C\CCC)C[C@@H]21	ZINC001218516522	1373627960	/nfs/dbraw/zinc/62/79/60/1373627960.db2.gz	DCLGWVJBBWVHDQ-LZZOGUTLSA-N	0	3	334.504	3.247	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2occc2-c2ccccc2)c1	ZINC001131055223	1373634034	/nfs/dbraw/zinc/63/40/34/1373634034.db2.gz	LTGSOFPBXBOQST-UHFFFAOYSA-N	0	3	345.402	3.338	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)CCc2cc3ccccc3o2)c1	ZINC001131068784	1373636191	/nfs/dbraw/zinc/63/61/91/1373636191.db2.gz	PAIPWGYOMZWYAJ-UHFFFAOYSA-N	0	3	347.418	3.143	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)[C@@H](C)CC3CCCCC3)[C@H]2C1	ZINC001218716112	1373646925	/nfs/dbraw/zinc/64/69/25/1373646925.db2.gz	UURMRHBRNAQPME-YSIASYRMSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)Nc1ccc(N2CCOCC2)c(C)c1	ZINC001218874730	1373663261	/nfs/dbraw/zinc/66/32/61/1373663261.db2.gz	XFQUDUSIOKWCSA-SFHVURJKSA-N	0	3	345.487	3.234	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)CCCC3CCCCC3)[C@H]2C1	ZINC001219019413	1373680670	/nfs/dbraw/zinc/68/06/70/1373680670.db2.gz	FXEDSBWSYJZSSE-RBUKOAKNSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)C[C@H](C)C3CC3)[C@H]2C1	ZINC001219053404	1373682991	/nfs/dbraw/zinc/68/29/91/1373682991.db2.gz	BZFKUFCYVGFUQG-YTQUADARSA-N	0	3	334.504	3.081	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@@H](NCc3cnc(C)s3)C2)CCCCC1	ZINC001188257941	1388276058	/nfs/dbraw/zinc/27/60/58/1388276058.db2.gz	QOLQGYJLXMVKCZ-MRXNPFEDSA-N	0	3	345.512	3.116	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@@H](CC)CCCC)[C@@H](O)C1	ZINC001219240180	1373695662	/nfs/dbraw/zinc/69/56/62/1373695662.db2.gz	DXFGZTZJCSSQPW-KSZLIROESA-N	0	3	326.525	3.335	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@H](C)O[C@]2(CCN(CC=C(C)C)C2)C1	ZINC001131661277	1373749012	/nfs/dbraw/zinc/74/90/12/1373749012.db2.gz	LZDFIGNIRHDFHI-RXVVDRJESA-N	0	3	346.515	3.413	20	30		EGEDHN
Cc1ccc(F)c(CN2CCC(CNC(=O)C#CC(C)C)CC2)c1	ZINC001223114428	1375032947	/nfs/dbraw/zinc/03/29/47/1375032947.db2.gz	LEGZATRFJWFVPX-UHFFFAOYSA-N	0	3	330.447	3.122	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCC1CCN(Cc2c(C)noc2CC)CC1	ZINC001224165182	1375058068	/nfs/dbraw/zinc/05/80/68/1375058068.db2.gz	HPQJVHPSEXXSLH-LSDHHAIUSA-N	0	3	347.503	3.332	20	30		EGEDHN
C=CCOCC(=O)N[C@H]1CC[C@@H](C)N(Cc2ccc(CCC)cc2)C1	ZINC001131946047	1375062000	/nfs/dbraw/zinc/06/20/00/1375062000.db2.gz	GAIYYRGDWPZWGX-XLIONFOSSA-N	0	3	344.499	3.311	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CC[C@@H](C)N(CCCc2ccsc2)C1	ZINC001132002308	1375092632	/nfs/dbraw/zinc/09/26/32/1375092632.db2.gz	IKVBBRDRXRYBTD-AEFFLSMTSA-N	0	3	332.513	3.453	20	30		EGEDHN
Cc1ccc(C)c(CN2C[C@@H](NC(=O)C#CC(C)C)CC[C@H]2C)c1	ZINC001132017260	1375100663	/nfs/dbraw/zinc/10/06/63/1375100663.db2.gz	NJADDAFEQDMIKZ-QUCCMNQESA-N	0	3	326.484	3.432	20	30		EGEDHN
C/C=C(\C)C(=O)N[C@@H]1CCCC[C@H]1NCc1cc(C#N)ccc1OC	ZINC001225592123	1375128832	/nfs/dbraw/zinc/12/88/32/1375128832.db2.gz	CMYOVWHGMGMOGE-UBCOOJSMSA-N	0	3	341.455	3.050	20	30		EGEDHN
C=CCCOCC(=O)NCC1CCN([C@@H](C)c2ccc(F)cc2)CC1	ZINC001225626268	1375134583	/nfs/dbraw/zinc/13/45/83/1375134583.db2.gz	WQZAVMHKXYXXMB-INIZCTEOSA-N	0	3	348.462	3.308	20	30		EGEDHN
C=CCCCN1C[C@H](NC(=O)c2cn3cc(C)nc3s2)CC[C@@H]1C	ZINC001132097273	1375144888	/nfs/dbraw/zinc/14/48/88/1375144888.db2.gz	HUKLASLUOUKYKZ-LSDHHAIUSA-N	0	3	346.500	3.253	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H](CC)SC	ZINC001225698234	1375147231	/nfs/dbraw/zinc/14/72/31/1375147231.db2.gz	IVDBTBFSKJVVRT-UPJWGTAASA-N	0	3	349.338	3.054	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CC[C@H](C)N(CCOCCCC)C1	ZINC001132106173	1375151170	/nfs/dbraw/zinc/15/11/70/1375151170.db2.gz	QSVXLORQENPKBI-ROUUACIJSA-N	0	3	347.503	3.074	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCc2ncc(C(C)(C)C)o2)CC[C@@H]1C	ZINC001132114284	1375155161	/nfs/dbraw/zinc/15/51/61/1375155161.db2.gz	GRZLRRIBEIEIGN-HOTGVXAUSA-N	0	3	347.503	3.450	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CC[C@@H](C)N(Cc2ccc(CO)cc2)C1	ZINC001132256287	1375250628	/nfs/dbraw/zinc/25/06/28/1375250628.db2.gz	MBHPSYPPFMEVMC-VQIMIIECSA-N	0	3	330.472	3.004	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CC[C@@H](C)N(CCOCCC(C)C)C2)C1	ZINC001132286545	1375267741	/nfs/dbraw/zinc/26/77/41/1375267741.db2.gz	BNBPIGXPAPHCIU-QZTJIDSGSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CCCC[C@H]1NCC(=C)Br	ZINC001226522476	1375274630	/nfs/dbraw/zinc/27/46/30/1375274630.db2.gz	AYICRCZHBCDSRZ-ZIAGYGMSSA-N	0	3	329.282	3.268	20	30		EGEDHN
Cc1cc(Cl)c(C(=O)NCCNCc2cccc(C#N)c2)cc1C	ZINC001132323778	1375301416	/nfs/dbraw/zinc/30/14/16/1375301416.db2.gz	FMZQIPPJUJUBOF-UHFFFAOYSA-N	0	3	341.842	3.348	20	30		EGEDHN
C=C(Cl)CN1C[C@H](NC(=O)CN(C)CCCCCC)CC[C@H]1C	ZINC001132365695	1375329743	/nfs/dbraw/zinc/32/97/43/1375329743.db2.gz	OFFJIHDPDBUFHK-IAGOWNOFSA-N	0	3	343.943	3.220	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)[C@H]2CC[C@H](CC)CC2)CC[C@H]1C	ZINC001132429817	1375377315	/nfs/dbraw/zinc/37/73/15/1375377315.db2.gz	PXAHXNOQIBLDAW-NCXUSEDFSA-N	0	3	336.520	3.375	20	30		EGEDHN
C[C@H](C(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1)C1CCC1	ZINC001227005198	1375379988	/nfs/dbraw/zinc/37/99/88/1375379988.db2.gz	LSQWBQCBFHMHMF-IOMROCGXSA-N	0	3	338.495	3.491	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2c(C)cc(C)cc2C)CC[C@@H]1C	ZINC001132464888	1375407716	/nfs/dbraw/zinc/40/77/16/1375407716.db2.gz	ZFSKSLXFDUVQQU-RBUKOAKNSA-N	0	3	344.499	3.397	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCOc2ccccc2C)CC[C@H]1C	ZINC001132501589	1375428181	/nfs/dbraw/zinc/42/81/81/1375428181.db2.gz	ZFKZWXGMKOWSNJ-MSOLQXFVSA-N	0	3	330.472	3.309	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC1CCN(CCOCc2ccccc2)CC1	ZINC001227562745	1375444087	/nfs/dbraw/zinc/44/40/87/1375444087.db2.gz	XHNSXHYGDPDTIN-UHFFFAOYSA-N	0	3	344.499	3.386	20	30		EGEDHN
C#CCN1CC[C@H](CN(Cc2scnc2C)C(=O)/C(C)=C\CC)C1	ZINC001132558274	1375465846	/nfs/dbraw/zinc/46/58/46/1375465846.db2.gz	KDZJEPKDAWVNNY-OLMDTSMNSA-N	0	3	345.512	3.092	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2N(Cc2ccsc2)C(=O)CCC)CC1	ZINC001132562298	1375468516	/nfs/dbraw/zinc/46/85/16/1375468516.db2.gz	HKQBIWSTYLZCPN-KRWDZBQOSA-N	0	3	330.497	3.365	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2N(Cc2nccs2)C(=O)[C@@H](C)CC)CC1	ZINC001132566092	1375469807	/nfs/dbraw/zinc/46/98/07/1375469807.db2.gz	HTEOLYUBQDLPGN-HOTGVXAUSA-N	0	3	345.512	3.006	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCNCc1cccc(C(F)(F)F)c1	ZINC001132575966	1375473023	/nfs/dbraw/zinc/47/30/23/1375473023.db2.gz	FORCFIUFHLZRMJ-STQMWFEESA-N	0	3	328.378	3.369	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CCCC[C@H]2NCc2cc(C)ncn2)CCC1	ZINC001228406840	1375566858	/nfs/dbraw/zinc/56/68/58/1375566858.db2.gz	UXTRLMCBMGHRSA-QZTJIDSGSA-N	0	3	342.487	3.048	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CCCC[C@H]2NCc2ccccn2)CCC1	ZINC001228406486	1375567035	/nfs/dbraw/zinc/56/70/35/1375567035.db2.gz	IVIIQPIWZFERBV-QZTJIDSGSA-N	0	3	327.472	3.345	20	30		EGEDHN
Cc1nc(CNC[C@H]2CN(C(=O)C#CC(C)(C)C)CC[C@@H]2C)cs1	ZINC001132831317	1375588412	/nfs/dbraw/zinc/58/84/12/1375588412.db2.gz	MXVRHTISAFSODR-HOCLYGCPSA-N	0	3	347.528	3.075	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](C)[C@@H](CNCc2csc(C)n2)C1	ZINC001132866146	1375610258	/nfs/dbraw/zinc/61/02/58/1375610258.db2.gz	WMUOSWIAPQXLDN-HOCLYGCPSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CCN(CCO[C@@H]2CCCC[C@H]2C)CC1	ZINC001228631973	1375622970	/nfs/dbraw/zinc/62/29/70/1375622970.db2.gz	ZAMQOLVIGIWIQO-SJLPKXTDSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NC1CCN(Cc2ccc3c(c2)COC3)CC1	ZINC001228750179	1375664398	/nfs/dbraw/zinc/66/43/98/1375664398.db2.gz	XAYLTBRGYXKFIZ-HZPDHXFCSA-N	0	3	342.483	3.256	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC1CCN(Cc2cccc(N(C)C)c2)CC1	ZINC001228809463	1375683866	/nfs/dbraw/zinc/68/38/66/1375683866.db2.gz	IPLCRKWRLLHJBK-KRWDZBQOSA-N	0	3	343.515	3.436	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)CC[C@@H]1CCCCO1	ZINC001228877246	1375702998	/nfs/dbraw/zinc/70/29/98/1375702998.db2.gz	CDBRBAAUEUQRTA-ARFHVFGLSA-N	0	3	328.884	3.105	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](C)[C@@H](CNCc2ocnc2C)C1	ZINC001133039054	1375730203	/nfs/dbraw/zinc/73/02/03/1375730203.db2.gz	KDRRFLHGQREEFR-WMZOPIPTSA-N	0	3	345.487	3.141	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC1CCN(CCOc2cccc(F)c2)CC1	ZINC001229016939	1375738957	/nfs/dbraw/zinc/73/89/57/1375738957.db2.gz	ODRUAEUIEHEHDC-FQEVSTJZSA-N	0	3	348.462	3.387	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@@H]1Oc1cccc(C#N)c1[N+](=O)[O-]	ZINC001229603168	1375864498	/nfs/dbraw/zinc/86/44/98/1375864498.db2.gz	SDWAWBKMSVVDEE-KSSFIOAISA-N	0	3	337.379	3.366	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)CC[C@H]1CC(C)(C)CO1	ZINC001229933517	1375920868	/nfs/dbraw/zinc/92/08/68/1375920868.db2.gz	QTSZPPASKJZMMF-ARFHVFGLSA-N	0	3	342.911	3.351	20	30		EGEDHN
C=CCCC1(C(=O)NCCNCc2ccc(Cl)c(OC)c2)CC1	ZINC001133373997	1375953436	/nfs/dbraw/zinc/95/34/36/1375953436.db2.gz	MUTXJMVPLCCSME-UHFFFAOYSA-N	0	3	336.863	3.301	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)CCC1CC1	ZINC001133389584	1375973765	/nfs/dbraw/zinc/97/37/65/1375973765.db2.gz	WZDVAGVIOWLKRP-UHFFFAOYSA-N	0	3	332.875	3.472	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)Cc1ccoc1	ZINC001133392916	1375978618	/nfs/dbraw/zinc/97/86/18/1375978618.db2.gz	SWWICOLAWMCFMS-UHFFFAOYSA-N	0	3	344.842	3.117	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1cc[nH]c1CC	ZINC001133395891	1375980193	/nfs/dbraw/zinc/98/01/93/1375980193.db2.gz	HBLJOSQGHSGKPA-UHFFFAOYSA-N	0	3	343.858	3.096	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)CCCC1CC1	ZINC001133401611	1375985700	/nfs/dbraw/zinc/98/57/00/1375985700.db2.gz	IYRLPFPUBFNDPO-UHFFFAOYSA-N	0	3	332.875	3.472	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)Cc1ccsc1)NCc1ccccc1C#N	ZINC001133563724	1376091156	/nfs/dbraw/zinc/09/11/56/1376091156.db2.gz	LRDDWWQYZWRXIS-HUUCEWRRSA-N	0	3	341.480	3.235	20	30		EGEDHN
C=CCCOCC(=O)N1CCC([C@@H]2CCCN2CC(=C)Cl)CC1	ZINC001230630281	1376107567	/nfs/dbraw/zinc/10/75/67/1376107567.db2.gz	RKZRKWUTRJFHPH-KRWDZBQOSA-N	0	3	340.895	3.035	20	30		EGEDHN
Cc1occc1C(=O)N[C@@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001133628402	1376127018	/nfs/dbraw/zinc/12/70/18/1376127018.db2.gz	UCMHSTHYICUIIH-KGLIPLIRSA-N	0	3	325.412	3.146	20	30		EGEDHN
Cc1occc1C(=O)N[C@@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001133628401	1376127089	/nfs/dbraw/zinc/12/70/89/1376127089.db2.gz	UCMHSTHYICUIIH-KBPBESRZSA-N	0	3	325.412	3.146	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](C)C[C@@H](C)NCc2ccccc2C#N)c(C)o1	ZINC001133641558	1376132809	/nfs/dbraw/zinc/13/28/09/1376132809.db2.gz	UJBKJAASPIUBFT-ZIAGYGMSSA-N	0	3	339.439	3.455	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H](C)C[C@H](C)NCc2cc(F)ccc2C#N)o1	ZINC001133652389	1376137553	/nfs/dbraw/zinc/13/75/53/1376137553.db2.gz	ASCPETFPGKXUFG-STQMWFEESA-N	0	3	343.402	3.286	20	30		EGEDHN
C#CCCN(CCCNC(=O)[C@H](C)CCCC)Cc1cccnc1	ZINC001230749290	1376139223	/nfs/dbraw/zinc/13/92/23/1376139223.db2.gz	ZLADOGJITRITBO-GOSISDBHSA-N	0	3	329.488	3.240	20	30		EGEDHN
C#CCCN(CCCNC(=O)C1CCC(=C)CC1)Cc1cccnc1	ZINC001230838895	1376164056	/nfs/dbraw/zinc/16/40/56/1376164056.db2.gz	VMYDAFIHTYTTLZ-UHFFFAOYSA-N	0	3	339.483	3.160	20	30		EGEDHN
CC1(c2ccccc2C(=O)NCCNCc2ccc(C#N)cc2)CC1	ZINC001133716204	1376171835	/nfs/dbraw/zinc/17/18/35/1376171835.db2.gz	NEFCIABVAXILLY-UHFFFAOYSA-N	0	3	333.435	3.129	20	30		EGEDHN
C#CCCN(CCCNC(=O)[C@H]1CC[C@H](C)CC1)Cc1cccnc1	ZINC001230907030	1376180389	/nfs/dbraw/zinc/18/03/89/1376180389.db2.gz	ZHIKJMRDCIOPNZ-KESTWPANSA-N	0	3	341.499	3.240	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cc3occc3s2)cc1F	ZINC001133770809	1376200334	/nfs/dbraw/zinc/20/03/34/1376200334.db2.gz	FROFUAFNQLDSJN-UHFFFAOYSA-N	0	3	343.383	3.025	20	30		EGEDHN
CN(CCCNC(=O)CC1CCCC1)Cc1ccc(C#N)c(F)c1	ZINC001231379337	1376234046	/nfs/dbraw/zinc/23/40/46/1376234046.db2.gz	QOLJSRQATSIPIL-UHFFFAOYSA-N	0	3	331.435	3.216	20	30		EGEDHN
C=CCOCC(=O)N[C@@H](C)C[C@H](C)NCc1c(F)cccc1Cl	ZINC001133908813	1376259919	/nfs/dbraw/zinc/25/99/19/1376259919.db2.gz	CGJCGJDEUALWDC-STQMWFEESA-N	0	3	342.842	3.055	20	30		EGEDHN
C#Cc1cccc(CN2CCC3(CC2)NC(=O)C[C@@H]3c2ccccc2)c1	ZINC001231656657	1376296594	/nfs/dbraw/zinc/29/65/94/1376296594.db2.gz	CVRZLGDREPJOMB-OAQYLSRUSA-N	0	3	344.458	3.306	20	30		EGEDHN
C=CCN1C(=O)CC[C@@]12CCCN(Cc1cnc(F)cc1C)CC2	ZINC001231982792	1376372283	/nfs/dbraw/zinc/37/22/83/1376372283.db2.gz	IGKDNSPDDZCLSC-LJQANCHMSA-N	0	3	331.435	3.062	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@]3(C2)C(=O)Nc2ccccc23)cc1Cl	ZINC001232114923	1376401597	/nfs/dbraw/zinc/40/15/97/1376401597.db2.gz	ZPURMIYJXQFEGO-IBGZPJMESA-N	0	3	337.810	3.307	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2c(F)ccc(F)c2Cl)cc1	ZINC001134255362	1376438908	/nfs/dbraw/zinc/43/89/08/1376438908.db2.gz	XQLCFONTKJKSCX-UHFFFAOYSA-N	0	3	349.768	3.009	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)c2cc(F)ccc2Cl)ccc1F	ZINC001134272944	1376448765	/nfs/dbraw/zinc/44/87/65/1376448765.db2.gz	RNTHFCAJSRQNMO-UHFFFAOYSA-N	0	3	349.768	3.009	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)C#CC1CC1)NCc1cc(F)ccc1Cl	ZINC001134329990	1376479890	/nfs/dbraw/zinc/47/98/90/1376479890.db2.gz	UDMFYGNUGWWROZ-STQMWFEESA-N	0	3	336.838	3.265	20	30		EGEDHN
C=CCN1C(=O)CCC12CCN(Cc1ccc3ncsc3c1)CC2	ZINC001232739412	1376510377	/nfs/dbraw/zinc/51/03/77/1376510377.db2.gz	CRGZTIWMIHFGPZ-UHFFFAOYSA-N	0	3	341.480	3.439	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@@H](CN(C)CCC(F)(F)F)C1	ZINC001752517650	1440191705	/nfs/dbraw/zinc/19/17/05/1440191705.db2.gz	JRTPQWABOPWPTP-HNNXBMFYSA-N	0	3	332.410	3.303	20	30		EGEDHN
CC(C)[C@H](C(=O)NCCNCc1ccc(C#N)s1)c1ccccc1	ZINC001134417226	1376522195	/nfs/dbraw/zinc/52/21/95/1376522195.db2.gz	RPWMPNLDUMRQQA-SFHVURJKSA-N	0	3	341.480	3.265	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H](C)C[C@H](C)NCc1nccn1CC	ZINC001134418291	1376523243	/nfs/dbraw/zinc/52/32/43/1376523243.db2.gz	IIOIOWOMKAYCCB-JKSUJKDBSA-N	0	3	332.492	3.044	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H](C)C[C@@H](C)NCc1oc(C)nc1C	ZINC001134419240	1376524156	/nfs/dbraw/zinc/52/41/56/1376524156.db2.gz	UYYMUURDZBYEBZ-ZIAGYGMSSA-N	0	3	333.476	3.433	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H](C)C[C@@H](C)NCC(=C)Br	ZINC001134447069	1376542483	/nfs/dbraw/zinc/54/24/83/1376542483.db2.gz	FYNBGSAVMRWHPP-CHWSQXEVSA-N	0	3	331.298	3.370	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)CCc2cc(Cl)cs2)c1	ZINC001134460826	1376549676	/nfs/dbraw/zinc/54/96/76/1376549676.db2.gz	KVJKSVYHQIPDJH-UHFFFAOYSA-N	0	3	347.871	3.112	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H](C)C[C@@H](C)NCc1c(C)nn(C)c1Cl	ZINC001134471077	1376555538	/nfs/dbraw/zinc/55/55/38/1376555538.db2.gz	UFYGFZAVUBZJGL-CHWSQXEVSA-N	0	3	340.899	3.111	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2nc(C)sc2C)CCC1	ZINC001134592388	1376614256	/nfs/dbraw/zinc/61/42/56/1376614256.db2.gz	CSWXPHWNATZJKT-KBPBESRZSA-N	0	3	347.528	3.326	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2oc(CC)nc2C)CCC1	ZINC001134593518	1376616223	/nfs/dbraw/zinc/61/62/23/1376616223.db2.gz	NYCYNBUTODGGKO-GJZGRUSLSA-N	0	3	345.487	3.112	20	30		EGEDHN
C=CCOCCCC(=O)N(C)C[C@@H]1CCN1Cc1ccccc1CC	ZINC001233488007	1376652946	/nfs/dbraw/zinc/65/29/46/1376652946.db2.gz	AIMVTAXEBKSCRP-FQEVSTJZSA-N	0	3	344.499	3.265	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)Cc1ccccc1)NCc1ccccc1C#N	ZINC001134747290	1376696736	/nfs/dbraw/zinc/69/67/36/1376696736.db2.gz	CLLHQGBENZKUHK-SJORKVTESA-N	0	3	335.451	3.174	20	30		EGEDHN
Cc1cc(C)c(C(=O)N[C@H](C)C[C@H](C)NCc2ccccc2C#N)[nH]1	ZINC001134757147	1376702335	/nfs/dbraw/zinc/70/23/35/1376702335.db2.gz	UNNUPDWIVHAULC-GOEBONIOSA-N	0	3	338.455	3.190	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)c1[nH]c(C)cc1C	ZINC001134757026	1376702716	/nfs/dbraw/zinc/70/27/16/1376702716.db2.gz	TVMOGAGSDCKVJQ-WCQYABFASA-N	0	3	342.281	3.027	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)c1[nH]c(C)cc1C	ZINC001134757023	1376702956	/nfs/dbraw/zinc/70/29/56/1376702956.db2.gz	TVMOGAGSDCKVJQ-AAEUAGOBSA-N	0	3	342.281	3.027	20	30		EGEDHN
C#CCCCC(=O)N(C)C[C@H]1CCN1C[C@H]1CCCC(F)(F)C1	ZINC001233948592	1376742054	/nfs/dbraw/zinc/74/20/54/1376742054.db2.gz	YXDTYXDUSFJZHW-JKSUJKDBSA-N	0	3	326.431	3.148	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N(C)C[C@H]2CCN2CCCCC)cc1	ZINC001234255922	1376792786	/nfs/dbraw/zinc/79/27/86/1376792786.db2.gz	SBCLRTZSSMPVGI-LJQANCHMSA-N	0	3	342.483	3.425	20	30		EGEDHN
CC(C)(C(=O)NCCNCc1ccc(C#N)s1)C1CCCCC1	ZINC001135004553	1376840070	/nfs/dbraw/zinc/84/00/70/1376840070.db2.gz	MYOFEAAGXGMWMR-UHFFFAOYSA-N	0	3	333.501	3.432	20	30		EGEDHN
C=CCCCN1CC[C@H]1CN(C)C(=O)[C@@](C)(OC)c1ccccc1F	ZINC001235125067	1376854910	/nfs/dbraw/zinc/85/49/10/1376854910.db2.gz	VCDCVUCRYMKXKL-JXFKEZNVSA-N	0	3	348.462	3.186	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H](C)C[C@@H](C)NCc1cc2n(n1)CCCC2	ZINC001135181675	1376954245	/nfs/dbraw/zinc/95/42/45/1376954245.db2.gz	SVUOCCQAMYBQMZ-HZPDHXFCSA-N	0	3	346.519	3.195	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H](C)C[C@@H](C)NCC(=C)Br)cc1	ZINC001135184403	1376957220	/nfs/dbraw/zinc/95/72/20/1376957220.db2.gz	HFYWECVYDQKZKI-ZIAGYGMSSA-N	0	3	349.272	3.063	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001135239630	1376997062	/nfs/dbraw/zinc/99/70/62/1376997062.db2.gz	ZTCAAGBHBZLLJH-SJORKVTESA-N	0	3	325.456	3.125	20	30		EGEDHN
CCc1cc(CN2CCC3(CCCCN3C(C)=O)CC2)ccc1C#N	ZINC001238774762	1377001061	/nfs/dbraw/zinc/00/10/61/1377001061.db2.gz	MBGNZEPVLDTWKQ-UHFFFAOYSA-N	0	3	339.483	3.488	20	30		EGEDHN
CCc1cc(CN2CCCN(c3ccc(C#N)cn3)CC2)ccc1C#N	ZINC001238777896	1377001329	/nfs/dbraw/zinc/00/13/29/1377001329.db2.gz	JSVWXNJOYWWUMW-UHFFFAOYSA-N	0	3	345.450	3.100	20	30		EGEDHN
C=CCCCC(=O)N[C@@H](C)C[C@@H](C)NCc1c(C)nn(C)c1Cl	ZINC001135353579	1377049025	/nfs/dbraw/zinc/04/90/25/1377049025.db2.gz	JMIJNUACMFBOPH-OLZOCXBDSA-N	0	3	340.899	3.111	20	30		EGEDHN
CCc1ccoc1C(=O)N[C@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001135387273	1377067400	/nfs/dbraw/zinc/06/74/00/1377067400.db2.gz	MRBFYKXBDSMHON-HUUCEWRRSA-N	0	3	339.439	3.400	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2nccn2CC)CCC1	ZINC001135390886	1377069610	/nfs/dbraw/zinc/06/96/10/1377069610.db2.gz	NXFYGRCCFRREHS-HOTGVXAUSA-N	0	3	332.492	3.022	20	30		EGEDHN
C[C@H](CC(=O)NCCNCc1ccc(C#N)s1)c1ccccc1F	ZINC001135391515	1377070332	/nfs/dbraw/zinc/07/03/32/1377070332.db2.gz	WVVJVZIEJINDPY-CYBMUJFWSA-N	0	3	345.443	3.158	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CCN(Cc3ccc4n3CCC4)C2)C1	ZINC001248821157	1377071177	/nfs/dbraw/zinc/07/11/77/1377071177.db2.gz	QDXNKQYFMWPWGO-FQEVSTJZSA-N	0	3	343.471	3.045	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H](C)C[C@H](C)NCc2nccn2C(F)F)C1	ZINC001135420712	1377086227	/nfs/dbraw/zinc/08/62/27/1377086227.db2.gz	YPDAFJLKHKVTQF-STQMWFEESA-N	0	3	340.418	3.007	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H](C)C[C@H](C)NCc2ccn(C(C)C)n2)C1	ZINC001135428057	1377092554	/nfs/dbraw/zinc/09/25/54/1377092554.db2.gz	YHKMBMPNEKOWHD-JKSUJKDBSA-N	0	3	332.492	3.193	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H](C)C[C@H](C)NCc1ccn(C(C)C)n1	ZINC001135565359	1377147571	/nfs/dbraw/zinc/14/75/71/1377147571.db2.gz	UEWQKCQMRVPCLC-HOTGVXAUSA-N	0	3	334.508	3.439	20	30		EGEDHN
C[C@@H](CNC(=O)c1c[nH]c2ccccc21)NCc1ccc(C#N)s1	ZINC001265797327	1377167042	/nfs/dbraw/zinc/16/70/42/1377167042.db2.gz	YUWSEDGQQOAKLD-LBPRGKRZSA-N	0	3	338.436	3.009	20	30		EGEDHN
C=CCO[C@@H]1CO[C@]2(C1)CCCN(Cc1ccc3c(c1)COC3)C2	ZINC001137025368	1377460670	/nfs/dbraw/zinc/46/06/70/1377460670.db2.gz	BTLYCOCPEDJNQF-PMACEKPBSA-N	0	3	329.440	3.043	20	30		EGEDHN
N#CCOc1ccc(CN2CCC3(CC2)C(=O)Nc2ccccc23)cc1	ZINC001137115550	1377481328	/nfs/dbraw/zinc/48/13/28/1377481328.db2.gz	VEYNMAFXHSHUSF-UHFFFAOYSA-N	0	3	347.418	3.075	20	30		EGEDHN
N#Cc1cccc(N2CCN(Cc3cccc4cccnc43)CC2)c1	ZINC001137178075	1377491068	/nfs/dbraw/zinc/49/10/68/1377491068.db2.gz	QSBAHYJJZOCYKV-UHFFFAOYSA-N	0	3	328.419	3.429	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3c[nH]c4ccc(F)cc34)C2)C1=O	ZINC001137336429	1377523524	/nfs/dbraw/zinc/52/35/24/1377523524.db2.gz	ADOGIPKMEGEXKE-FQEVSTJZSA-N	0	3	341.430	3.308	20	30		EGEDHN
C=CCN(CC=C)CCN1CCN(Cc2ccc(C(C)(C)C)[nH]2)CC1	ZINC001137379610	1377535521	/nfs/dbraw/zinc/53/55/21/1377535521.db2.gz	YFSMYCVZEJIHTE-UHFFFAOYSA-N	0	3	344.547	3.104	20	30		EGEDHN
CCCCN1CCN(Cc2ccc(C#N)cc2Br)CC1	ZINC001137636835	1377578924	/nfs/dbraw/zinc/57/89/24/1377578924.db2.gz	OSXVTFLVEAECQP-UHFFFAOYSA-N	0	3	336.277	3.238	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3ccc(Cl)c(F)c3)C2)C1=O	ZINC001137650269	1377581416	/nfs/dbraw/zinc/58/14/16/1377581416.db2.gz	FWMWZDRJAXIKCF-GOSISDBHSA-N	0	3	336.838	3.480	20	30		EGEDHN
C#CCOc1ccc(CN2CCC3(CC2)OC(=O)c2ccccc23)cc1	ZINC001138559111	1377742006	/nfs/dbraw/zinc/74/20/06/1377742006.db2.gz	PDECSDCUEHWTEO-UHFFFAOYSA-N	0	3	347.414	3.360	20	30		EGEDHN
C=CCc1cccc(C[NH+]2C[C@H]3CN(Cc4cccnc4)C[C@@H]3C2)c1[O-]	ZINC001138626594	1377755534	/nfs/dbraw/zinc/75/55/34/1377755534.db2.gz	LJASTBLBPSKGNR-NHCUHLMSSA-N	0	3	349.478	3.080	20	30		EGEDHN
C=C(C)COc1ccccc1CN1CCC[C@]2(CCN(CC)C2=O)C1	ZINC001138664680	1377764914	/nfs/dbraw/zinc/76/49/14/1377764914.db2.gz	UVCAUEFPDLXFGS-NRFANRHFSA-N	0	3	342.483	3.476	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cccnc1NC)[C@@H]2CC	ZINC001138690115	1377768790	/nfs/dbraw/zinc/76/87/90/1377768790.db2.gz	CUSNEPDMAAFFBU-XLIONFOSSA-N	0	3	342.487	3.045	20	30		EGEDHN
N#Cc1ccnc(-c2ccc(CN3CC(N4CCCCC4)C3)cc2)c1	ZINC001139405532	1377879908	/nfs/dbraw/zinc/87/99/08/1377879908.db2.gz	SRTDOTQZDNXZFG-UHFFFAOYSA-N	0	3	332.451	3.290	20	30		EGEDHN
CCOC(=O)C[C@@H]1CCCN(Cc2c[nH]c3ccc(C#N)cc23)C1	ZINC001140110924	1378009770	/nfs/dbraw/zinc/00/97/70/1378009770.db2.gz	VCFWGXIMHDPGTD-HNNXBMFYSA-N	0	3	325.412	3.205	20	30		EGEDHN
Cc1cccc(N2CCCN(Cc3c[nH]c4ccc(C#N)cc34)CC2)n1	ZINC001140116046	1378011591	/nfs/dbraw/zinc/01/15/91/1378011591.db2.gz	PLCUAIBGZURLEQ-UHFFFAOYSA-N	0	3	345.450	3.455	20	30		EGEDHN
CCc1nnc(C2CCN(Cc3c[nH]c4ccc(C#N)cc34)CC2)o1	ZINC001140115445	1378011722	/nfs/dbraw/zinc/01/17/22/1378011722.db2.gz	AHWADUJTNVIUQQ-UHFFFAOYSA-N	0	3	335.411	3.365	20	30		EGEDHN
COc1cc(O[C@@H]2CCN(Cc3c[nH]c4ccc(C#N)cc34)C2)ccn1	ZINC001140116861	1378011803	/nfs/dbraw/zinc/01/18/03/1378011803.db2.gz	IFGKPDBCHWFMFH-QGZVFWFLSA-N	0	3	348.406	3.096	20	30		EGEDHN
C=CCOC(=O)N[C@H]1CCCN(Cc2cccc3cnccc32)C1	ZINC001140146686	1378020952	/nfs/dbraw/zinc/02/09/52/1378020952.db2.gz	PDWWRRAVRAMXTQ-KRWDZBQOSA-N	0	3	325.412	3.111	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3nc(Cl)ccc3C)C2)C1=O	ZINC001140444378	1378063971	/nfs/dbraw/zinc/06/39/71/1378063971.db2.gz	HNEDCMGUDSVUCL-SFHVURJKSA-N	0	3	333.863	3.044	20	30		EGEDHN
CN1c2ccccc2C2(CCN(Cc3cccc(C#N)c3)CC2)C1=O	ZINC001272651413	1378077442	/nfs/dbraw/zinc/07/74/42/1378077442.db2.gz	SXKOYQIPELKHBG-UHFFFAOYSA-N	0	3	331.419	3.068	20	30		EGEDHN
C=C(C)CNC(=O)[C@@H]1CC12CCN(Cc1cccc(OCC)c1)CC2	ZINC001273303946	1378096177	/nfs/dbraw/zinc/09/61/77/1378096177.db2.gz	PISNFRCDOHZNRA-IBGZPJMESA-N	0	3	342.483	3.380	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@@]3(CCN(CC(C)C)C3=O)C2)c1[O-]	ZINC001273360778	1378098721	/nfs/dbraw/zinc/09/87/21/1378098721.db2.gz	VYRRTGADUJRQGO-OAQYLSRUSA-N	0	3	342.483	3.201	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@@]3(CCN(CC(C)C)C3=O)C2)c1[O-]	ZINC001273360778	1378098723	/nfs/dbraw/zinc/09/87/23/1378098723.db2.gz	VYRRTGADUJRQGO-OAQYLSRUSA-N	0	3	342.483	3.201	20	30		EGEDHN
Cc1sccc1C(=O)NC[C@H](C)N(C)Cc1cccc(C#N)c1	ZINC001275827023	1378158724	/nfs/dbraw/zinc/15/87/24/1378158724.db2.gz	FEHPOKJSHHRAET-ZDUSSCGKSA-N	0	3	327.453	3.179	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CC[N@@H+](Cc3ccc(C)cc3[O-])C2)C1	ZINC001140948541	1378188553	/nfs/dbraw/zinc/18/85/53/1378188553.db2.gz	MVJKLTROMFTBCD-HXUWFJFHSA-N	0	3	344.455	3.311	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CC[N@H+](Cc3ccc(C)cc3[O-])C2)C1	ZINC001140948541	1378188558	/nfs/dbraw/zinc/18/85/58/1378188558.db2.gz	MVJKLTROMFTBCD-HXUWFJFHSA-N	0	3	344.455	3.311	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@H]1CCN(Cc1sccc1OC)C2	ZINC001141323364	1378301577	/nfs/dbraw/zinc/30/15/77/1378301577.db2.gz	WWVSYESOAZJUPH-ZWKOTPCHSA-N	0	3	337.485	3.330	20	30		EGEDHN
CCOC(=O)C1(C)CCN(Cc2c[nH]c3cc(C#N)ccc23)CC1	ZINC001142920761	1378509337	/nfs/dbraw/zinc/50/93/37/1378509337.db2.gz	APWUTRJKGRCBCE-UHFFFAOYSA-N	0	3	325.412	3.205	20	30		EGEDHN
Cc1ccnc(O[C@H]2CCCN(Cc3c[nH]c4cc(C#N)ccc34)C2)n1	ZINC001142931962	1378512141	/nfs/dbraw/zinc/51/21/41/1378512141.db2.gz	UHGIBJXQZCYXCV-KRWDZBQOSA-N	0	3	347.422	3.181	20	30		EGEDHN
COc1c(F)cc(CN2CCC3SC(=O)C=C3C2)cc1Cl	ZINC001143841685	1378652390	/nfs/dbraw/zinc/65/23/90/1378652390.db2.gz	OCBGNUPHRSFKCB-ZDUSSCGKSA-N	0	3	327.808	3.262	20	30		EGEDHN
N#Cc1cncc(CN2C[C@H]3CCC[C@@]3(COCc3cccnc3)C2)c1	ZINC001144075975	1378679908	/nfs/dbraw/zinc/67/99/08/1378679908.db2.gz	XRKBEHPYGJRPHB-RTWAWAEBSA-N	0	3	348.450	3.167	20	30		EGEDHN
Cc1ccccc1CC(=O)N[C@@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001146205672	1378795215	/nfs/dbraw/zinc/79/52/15/1378795215.db2.gz	OLBXMXCLOHQNJK-ROUUACIJSA-N	0	3	349.478	3.482	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C[C@H](C)NCc2cc(C)ncn2)CCCC1	ZINC001146820458	1378927233	/nfs/dbraw/zinc/92/72/33/1378927233.db2.gz	GATMIRHVDAQXKH-DOTOQJQBSA-N	0	3	344.503	3.294	20	30		EGEDHN
CN(C(=O)CCC1CC1)[C@@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001283493726	1378985856	/nfs/dbraw/zinc/98/58/56/1378985856.db2.gz	QRJRTGVUXFBCMV-KRWDZBQOSA-N	0	3	331.485	3.137	20	30		EGEDHN
CC(C)C#CC(=O)N1CC2(C1)CCN([C@H](C)c1ccc(F)cc1)C2	ZINC001147483041	1379031105	/nfs/dbraw/zinc/03/11/05/1379031105.db2.gz	JSMMGJIFQGTASS-MRXNPFEDSA-N	0	3	328.431	3.080	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)N1CC2(C1)CCN(Cc1ccc(OC)cc1)C2	ZINC001148087510	1379114767	/nfs/dbraw/zinc/11/47/67/1379114767.db2.gz	DJJQYNXYEGDVTI-SJORKVTESA-N	0	3	342.483	3.188	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001148089437	1379115483	/nfs/dbraw/zinc/11/54/83/1379115483.db2.gz	WCLCKFDURULIAV-SJORKVTESA-N	0	3	337.467	3.051	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)N1CC2(C1)CCN(CCc1ccccc1F)C2	ZINC001148095598	1379117043	/nfs/dbraw/zinc/11/70/43/1379117043.db2.gz	MMMHHRUOIKPECG-SJORKVTESA-N	0	3	344.474	3.361	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC2(C1)CCN(Cc1ccc(OC)cc1)C2	ZINC001148131120	1379122836	/nfs/dbraw/zinc/12/28/36/1379122836.db2.gz	QARRXUJZTNLYAL-KRWDZBQOSA-N	0	3	342.483	3.332	20	30		EGEDHN
C=CCCC1(C(=O)N2CC3(C2)CCN(Cc2ncccc2C)C3)CC1	ZINC001148263308	1379141434	/nfs/dbraw/zinc/14/14/34/1379141434.db2.gz	XTWWEMMJLQUBGN-UHFFFAOYSA-N	0	3	339.483	3.171	20	30		EGEDHN
CC(C)CCCC(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001148327273	1379152764	/nfs/dbraw/zinc/15/27/64/1379152764.db2.gz	FRTCKRDSJGWZLS-UHFFFAOYSA-N	0	3	339.483	3.419	20	30		EGEDHN
CC[C@H](C)[C@H](C)C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001148500823	1379194016	/nfs/dbraw/zinc/19/40/16/1379194016.db2.gz	LRJJFVFZFAEODN-IRXDYDNUSA-N	0	3	339.483	3.275	20	30		EGEDHN
CCCCCCCCCCC(=O)NCCN[C@@H](CCCC)C(N)=O	ZINC001148751623	1379260569	/nfs/dbraw/zinc/26/05/69/1379260569.db2.gz	ORYUKFAIHBTSKH-KRWDZBQOSA-N	0	3	341.540	3.267	20	30		EGEDHN
CCCCCCCCCC(=O)NCCNCc1ccnc(N(C)C)c1	ZINC001148820165	1379275573	/nfs/dbraw/zinc/27/55/73/1379275573.db2.gz	DTUBUPXPXXWKRT-UHFFFAOYSA-N	0	3	348.535	3.494	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)C2(C3CCCCC3)CC2)c1	ZINC001149133741	1379330249	/nfs/dbraw/zinc/33/02/49/1379330249.db2.gz	AMSSUJHCMXCMCT-UHFFFAOYSA-N	0	3	325.456	3.125	20	30		EGEDHN
C=CCCC(=O)NC[C@@H]1CN([C@H](C)c2cccc(C)c2)CCCO1	ZINC001149376122	1379372014	/nfs/dbraw/zinc/37/20/14/1379372014.db2.gz	VPOXHGYKNVUZDH-IEBWSBKVSA-N	0	3	330.472	3.229	20	30		EGEDHN
C#CCCN1CCCO[C@H](CNC(=O)[C@@H](CC)CCCCCC)C1	ZINC001150100415	1379495085	/nfs/dbraw/zinc/49/50/85/1379495085.db2.gz	POMZUVKOXZIQRX-RBUKOAKNSA-N	0	3	336.520	3.213	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@H]1CN(Cc2ccc(C)cc2)CCCO1	ZINC001150138526	1379501106	/nfs/dbraw/zinc/50/11/06/1379501106.db2.gz	AKQAXBWTPMLWHF-ICSRJNTNSA-N	0	3	344.499	3.304	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2csc3c2CCCC3)c1	ZINC001150301715	1379530757	/nfs/dbraw/zinc/53/07/57/1379530757.db2.gz	XLSWBDPLJNYNCP-UHFFFAOYSA-N	0	3	339.464	3.018	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)C/C=C\c2ccc(C)cc2)C1	ZINC001150848070	1379621428	/nfs/dbraw/zinc/62/14/28/1379621428.db2.gz	DFHANTUMPOBWEZ-RDBXKPKDSA-N	0	3	342.483	3.182	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2ccccc2F)CC1	ZINC001150910943	1379630509	/nfs/dbraw/zinc/63/05/09/1379630509.db2.gz	JCOHEUFJHPOZBU-UHFFFAOYSA-N	0	3	334.435	3.003	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2oc(C)cc2C)CC1	ZINC001151053514	1379654961	/nfs/dbraw/zinc/65/49/61/1379654961.db2.gz	VVOKTDHKLISCJU-UHFFFAOYSA-N	0	3	334.460	3.073	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@H]2CCC[C@@H](F)C2)CC1	ZINC001151128012	1379664142	/nfs/dbraw/zinc/66/41/42/1379664142.db2.gz	DGTOFCIFNVWWIQ-DLBZAZTESA-N	0	3	340.483	3.078	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)CCc2ccc(C)cc2)CC1	ZINC001151209854	1379677570	/nfs/dbraw/zinc/67/75/70/1379677570.db2.gz	PAEGVKPIWWVMDL-UHFFFAOYSA-N	0	3	344.499	3.101	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@@H]2C[C@@H]3CCCC[C@H]23)CC1	ZINC001151232604	1379683240	/nfs/dbraw/zinc/68/32/40/1379683240.db2.gz	PFVYIMSRXVZYML-GBESFXJTSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2ccc(F)c(C)c2)CC1	ZINC001151287969	1379694294	/nfs/dbraw/zinc/69/42/94/1379694294.db2.gz	HJUXQLKPYZALAY-UHFFFAOYSA-N	0	3	348.462	3.311	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2cccc(C)c2C)CC1	ZINC001151405786	1379712280	/nfs/dbraw/zinc/71/22/80/1379712280.db2.gz	IGZOLMUXOQZLHI-UHFFFAOYSA-N	0	3	344.499	3.480	20	30		EGEDHN
C=CC[C@H](C(=O)NCCNCc1scnc1C)c1ccccc1	ZINC001151837987	1379793739	/nfs/dbraw/zinc/79/37/39/1379793739.db2.gz	FCCASVQYPFQISM-INIZCTEOSA-N	0	3	329.469	3.017	20	30		EGEDHN
C=C[C@@H](CC(=O)NCCNCc1ccc(F)cc1)c1ccccc1	ZINC001151941777	1379820012	/nfs/dbraw/zinc/82/00/12/1379820012.db2.gz	AJQCCSGRZNREOD-KRWDZBQOSA-N	0	3	326.415	3.391	20	30		EGEDHN
CC(C)c1ccsc1C(=O)NCCNCc1ccc(C#N)s1	ZINC001152126784	1379867781	/nfs/dbraw/zinc/86/77/81/1379867781.db2.gz	PWLNQEKWOPHKLU-UHFFFAOYSA-N	0	3	333.482	3.324	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC[C@@H](C)N(CC)Cc1cccc(OC)c1	ZINC001152233805	1379892400	/nfs/dbraw/zinc/89/24/00/1379892400.db2.gz	BFOZRLSFMFYZIK-IAGOWNOFSA-N	0	3	348.487	3.003	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)C=C1CCC1	ZINC001152706167	1379973778	/nfs/dbraw/zinc/97/37/78/1379973778.db2.gz	AFKOGQIXEUVWSC-CQSZACIVSA-N	0	3	329.419	3.134	20	30		EGEDHN
C=C(Br)CNC[C@H](NC(=O)c1ccsc1)C(C)(C)C	ZINC001284566171	1379975780	/nfs/dbraw/zinc/97/57/80/1379975780.db2.gz	TXFFFLLDMZHZDV-LBPRGKRZSA-N	0	3	345.306	3.391	20	30		EGEDHN
C[C@@H](CCc1ccccc1)CC(=O)NCCNCc1cccc(C#N)c1	ZINC001153213669	1380036869	/nfs/dbraw/zinc/03/68/69/1380036869.db2.gz	FNWPFNAMEODIDE-SFHVURJKSA-N	0	3	349.478	3.423	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@@H](C)N(CC)Cc1ccnc(N(C)C)c1	ZINC001153594221	1380100051	/nfs/dbraw/zinc/10/00/51/1380100051.db2.gz	KPTROFBRBNAKON-MRXNPFEDSA-N	0	3	346.519	3.077	20	30		EGEDHN
C=CCC[C@@H](C(=O)NCCNCc1cccnc1C)c1ccccc1	ZINC001153816271	1380135655	/nfs/dbraw/zinc/13/56/55/1380135655.db2.gz	BIVLKIZVFQDKMP-HXUWFJFHSA-N	0	3	337.467	3.346	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)C1(C2CC2)CC1	ZINC001153956394	1380162003	/nfs/dbraw/zinc/16/20/03/1380162003.db2.gz	DAWBCWMJVAPCSA-CQSZACIVSA-N	0	3	343.446	3.214	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)[C@H](C)C(F)(F)F	ZINC001154648195	1380323284	/nfs/dbraw/zinc/32/32/84/1380323284.db2.gz	CIHYGJCUCYNGOT-OLZOCXBDSA-N	0	3	341.377	3.083	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)[C@@H]1Cc2ccccc21	ZINC001154920964	1380376213	/nfs/dbraw/zinc/37/62/13/1380376213.db2.gz	JHVBBPLAMPXJQN-IIBYNOLFSA-N	0	3	347.462	3.225	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@@H](C)N(CC)CCc1csc(C)n1	ZINC001155067382	1380402338	/nfs/dbraw/zinc/40/23/38/1380402338.db2.gz	YKBUBAIOHXBMBE-RDTXWAMCSA-N	0	3	337.533	3.423	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)C1CC2(CC2)C1	ZINC001155167347	1380418117	/nfs/dbraw/zinc/41/81/17/1380418117.db2.gz	JGGBUHFEPHLSDJ-OAHLLOKOSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC[C@H](CC(=O)NC[C@@H](C)N(CC)CC#CCOC)c1ccccc1	ZINC001156318425	1380557426	/nfs/dbraw/zinc/55/74/26/1380557426.db2.gz	ADGILJOUTAQJID-RTBURBONSA-N	0	3	344.499	3.047	20	30		EGEDHN
C#CCCCC(=O)NCCCNCc1c(Cl)oc2ccccc21	ZINC001157170267	1380793603	/nfs/dbraw/zinc/79/36/03/1380793603.db2.gz	FAHILWQTDMPNGU-UHFFFAOYSA-N	0	3	332.831	3.486	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NC[C@@H](C)N(CC)Cc1ccc(Cl)cc1	ZINC001157216899	1380813711	/nfs/dbraw/zinc/81/37/11/1380813711.db2.gz	BXUWJHAFOQDBDW-HUUCEWRRSA-N	0	3	338.879	3.258	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C1CC(c2ccc(F)cc2)C1	ZINC001157320009	1380841431	/nfs/dbraw/zinc/84/14/31/1380841431.db2.gz	RKQRFLAKZDTYIB-FAEJEUNOSA-N	0	3	330.447	3.169	20	30		EGEDHN
CSCCC(=O)N1CCCC[C@@H]1CN(C)Cc1cccc(C#N)c1	ZINC001157498836	1380944467	/nfs/dbraw/zinc/94/44/67/1380944467.db2.gz	MDMAZRSGFDMHMI-GOSISDBHSA-N	0	3	345.512	3.124	20	30		EGEDHN
CC(C)C#CC(=O)NCCCNCc1ncc(-c2ccccc2)s1	ZINC001157638461	1380988411	/nfs/dbraw/zinc/98/84/11/1380988411.db2.gz	DKINGJVVMSESEA-UHFFFAOYSA-N	0	3	341.480	3.065	20	30		EGEDHN
C#CCCCC(=O)N1CCCC[C@@H]1CN(C)CCOCCC(C)C	ZINC001157908158	1381067239	/nfs/dbraw/zinc/06/72/39/1381067239.db2.gz	MHWKDZZVQROIIE-LJQANCHMSA-N	0	3	336.520	3.166	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)CCCc1csc(C)n1	ZINC001157957701	1381081590	/nfs/dbraw/zinc/08/15/90/1381081590.db2.gz	GDYCDHCYERERGG-QGZVFWFLSA-N	0	3	335.517	3.273	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1[nH]nc(C2CC2)c1Cl	ZINC001158185775	1381151347	/nfs/dbraw/zinc/15/13/47/1381151347.db2.gz	HUQVAMRGZNEWFB-CYBMUJFWSA-N	0	3	336.867	3.053	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cccc2c1O[C@@H](C)C2	ZINC001158254576	1381174481	/nfs/dbraw/zinc/17/44/81/1381174481.db2.gz	NFPHIUGBYSMDLH-DOTOQJQBSA-N	0	3	328.456	3.123	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cnn(C(C)C)c1Cl	ZINC001158277256	1381182256	/nfs/dbraw/zinc/18/22/56/1381182256.db2.gz	OQXLUNQQHCILSX-CQSZACIVSA-N	0	3	338.883	3.230	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc(F)c(F)c1F	ZINC001158413621	1381237219	/nfs/dbraw/zinc/23/72/19/1381237219.db2.gz	VLQGMUZKTBDYFX-GFCCVEGCSA-N	0	3	326.362	3.216	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1occc1Cl	ZINC001158438231	1381247062	/nfs/dbraw/zinc/24/70/62/1381247062.db2.gz	OPAXSADBYTXKEN-CQSZACIVSA-N	0	3	340.851	3.062	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)[C@H](C)c1ccccc1	ZINC001158768159	1381389314	/nfs/dbraw/zinc/38/93/14/1381389314.db2.gz	LSUAIFHCIHVBQN-UYAOXDASSA-N	0	3	344.499	3.306	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1ccc(C)cc1C	ZINC001158811924	1381410388	/nfs/dbraw/zinc/41/03/88/1381410388.db2.gz	TUAKSCBMBDNIGC-LJQANCHMSA-N	0	3	344.499	3.433	20	30		EGEDHN
Cc1cc(C)cc(CC(=O)NCC[C@H](C)NCc2ccccc2C#N)c1	ZINC001328402337	1388737868	/nfs/dbraw/zinc/73/78/68/1388737868.db2.gz	GJLVNRMIGRMWPP-SFHVURJKSA-N	0	3	349.478	3.402	20	30		EGEDHN
C=CCCC(=O)NCCC1=CCN(CCOc2ccc(C)cc2)CC1	ZINC001159538661	1381821819	/nfs/dbraw/zinc/82/18/19/1381821819.db2.gz	GGFIREVVZKVDBA-UHFFFAOYSA-N	0	3	342.483	3.478	20	30		EGEDHN
C[C@H](c1ccc(F)cc1)N1CC=C(CCNC(=O)[C@@H](C)C#N)CC1	ZINC001159594386	1381840483	/nfs/dbraw/zinc/84/04/83/1381840483.db2.gz	PWJXXKGYVLGAHM-LSDHHAIUSA-N	0	3	329.419	3.185	20	30		EGEDHN
N#Cc1ccc(CN2CC=C(CCNC(=O)CCC3CC3)CC2)cc1	ZINC001159647168	1381859117	/nfs/dbraw/zinc/85/91/17/1381859117.db2.gz	ZLTKVUZKQDUPEQ-UHFFFAOYSA-N	0	3	337.467	3.387	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccnn2C(CC)CC)CC1	ZINC001160359965	1382082450	/nfs/dbraw/zinc/08/24/50/1382082450.db2.gz	HXBCYHADFKWGLG-UHFFFAOYSA-N	0	3	342.487	3.020	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccnc(-c3ccco3)c2)CC1	ZINC001160450152	1382106972	/nfs/dbraw/zinc/10/69/72/1382106972.db2.gz	ULBOEFXHJZYUKT-UHFFFAOYSA-N	0	3	337.423	3.280	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C[C@H](C)c2c(C)noc2C)CC1	ZINC001160518179	1382129051	/nfs/dbraw/zinc/12/90/51/1382129051.db2.gz	ILGJQFXBDKRGRK-AWEZNQCLSA-N	0	3	331.460	3.109	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc(-c3ccco3)o2)CC1	ZINC001160641128	1382158435	/nfs/dbraw/zinc/15/84/35/1382158435.db2.gz	IFKPODLGAPKDMW-UHFFFAOYSA-N	0	3	326.396	3.478	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2scnc2C(F)F)CC1	ZINC001160645777	1382159359	/nfs/dbraw/zinc/15/93/59/1382159359.db2.gz	KCNKQMWLQSPASN-UHFFFAOYSA-N	0	3	327.400	3.019	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H]2COc3ccc(Cl)cc32)CC1	ZINC001160695140	1382173438	/nfs/dbraw/zinc/17/34/38/1382173438.db2.gz	WNMRIVPPUASLPV-KRWDZBQOSA-N	0	3	346.858	3.140	20	30		EGEDHN
CC[C@@H]1CCC[C@@]1(C)C(=O)NCCCNCc1ccccc1C#N	ZINC001160978435	1382259766	/nfs/dbraw/zinc/25/97/66/1382259766.db2.gz	IJOASIWFADIJIK-UYAOXDASSA-N	0	3	327.472	3.371	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H]2CC[C@H](C(F)(F)F)C2)CC1	ZINC001161019244	1382274489	/nfs/dbraw/zinc/27/44/89/1382274489.db2.gz	AKKBVYVIJYQFAU-CABCVRRESA-N	0	3	330.394	3.289	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc(Cl)cc2OC)CC1	ZINC001161020740	1382276121	/nfs/dbraw/zinc/27/61/21/1382276121.db2.gz	IUSLMMLJNBVRMT-UHFFFAOYSA-N	0	3	334.847	3.287	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc(F)c(Cl)c2)CC1	ZINC001161050163	1382283356	/nfs/dbraw/zinc/28/33/56/1382283356.db2.gz	ATHCHUQXIFHJCZ-UHFFFAOYSA-N	0	3	334.822	3.254	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@H](CC)Cc2ccccc2)CC1	ZINC001161363694	1382384082	/nfs/dbraw/zinc/38/40/82/1382384082.db2.gz	JKTMNVKMXKORHH-OAQYLSRUSA-N	0	3	338.495	3.417	20	30		EGEDHN
N#Cc1ccc(CN2CC=C(CCNC(=O)[C@@H]3C[C@H]3C3CC3)CC2)cc1	ZINC001161439338	1382411537	/nfs/dbraw/zinc/41/15/37/1382411537.db2.gz	KPIAFWCUPMHUQP-LEWJYISDSA-N	0	3	349.478	3.243	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2oc(CC(C)C)nc2C)CC1	ZINC001161444783	1382412870	/nfs/dbraw/zinc/41/28/70/1382412870.db2.gz	KXVIMFVUQDMAMJ-UHFFFAOYSA-N	0	3	331.460	3.120	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H](CC)c2c(C)noc2C)CC1	ZINC001161472358	1382417567	/nfs/dbraw/zinc/41/75/67/1382417567.db2.gz	PPHQWOYXLGYLTN-KRWDZBQOSA-N	0	3	331.460	3.109	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc(Cl)cc(OC)c2)CC1	ZINC001161530456	1382430930	/nfs/dbraw/zinc/43/09/30/1382430930.db2.gz	AXVMBSNSUAUMTD-UHFFFAOYSA-N	0	3	346.858	3.124	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc3scnc3c2)CC1	ZINC001161621816	1382461923	/nfs/dbraw/zinc/46/19/23/1382461923.db2.gz	ABDURPXESPRVPA-UHFFFAOYSA-N	0	3	339.464	3.072	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C2(c3ccccc3F)CC2)CC1	ZINC001161623067	1382463213	/nfs/dbraw/zinc/46/32/13/1382463213.db2.gz	ZSIHZKFUILZNSS-UHFFFAOYSA-N	0	3	340.442	3.019	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cnn(CCC)c2C2CC2)CC1	ZINC001161674653	1382477358	/nfs/dbraw/zinc/47/73/58/1382477358.db2.gz	QOPDQETZCHJSGL-UHFFFAOYSA-N	0	3	342.487	3.109	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)Cc2c[nH]c3cccc(C)c23)CC1	ZINC001161708975	1382486668	/nfs/dbraw/zinc/48/66/68/1382486668.db2.gz	AKBVKBINPXHQAU-UHFFFAOYSA-N	0	3	337.467	3.343	20	30		EGEDHN
CC(C)(C)C(=O)Nc1ccc(CN)nc1N[C@@H](C#N)c1ccccc1	ZINC001161714281	1382487527	/nfs/dbraw/zinc/48/75/27/1382487527.db2.gz	QTRRMMBKPJIHGX-INIZCTEOSA-N	0	3	337.427	3.202	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)COc2ccc(Cl)cc2)CC1	ZINC001161805450	1382512848	/nfs/dbraw/zinc/51/28/48/1382512848.db2.gz	JNSCMTHAOHPOKU-UHFFFAOYSA-N	0	3	334.847	3.043	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2sc(Cl)nc2Cl)CC1	ZINC001161878824	1382537990	/nfs/dbraw/zinc/53/79/90/1382537990.db2.gz	BUSGRABBFRCHCY-UHFFFAOYSA-N	0	3	346.283	3.388	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cnc(C(C)(C)C)s2)CC1	ZINC001161952029	1382567840	/nfs/dbraw/zinc/56/78/40/1382567840.db2.gz	APVQUURJMAUVCY-UHFFFAOYSA-N	0	3	345.512	3.216	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cnc(CC(C)C)s2)CC1	ZINC001161987514	1382590952	/nfs/dbraw/zinc/59/09/52/1382590952.db2.gz	ZVZDGRSSTRPKJN-UHFFFAOYSA-N	0	3	333.501	3.280	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)CCc2ccc(C)s2)CC1	ZINC001162006281	1382597751	/nfs/dbraw/zinc/59/77/51/1382597751.db2.gz	CTZQYOVHXVROFU-UHFFFAOYSA-N	0	3	330.497	3.151	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1cc(Cl)ccc1F	ZINC001162069316	1382618971	/nfs/dbraw/zinc/61/89/71/1382618971.db2.gz	HDAAMFCMFZKKAL-UHFFFAOYSA-N	0	3	345.805	3.260	20	30		EGEDHN
N#Cc1c(Cl)c2cc(F)cc(Cl)c2nc1-n1nccc1CN	ZINC001162592676	1382801960	/nfs/dbraw/zinc/80/19/60/1382801960.db2.gz	MARKCQXRVMJUDD-UHFFFAOYSA-N	0	3	336.157	3.197	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)CCCC2CCCC2)(COC)CC1	ZINC001162617849	1382811672	/nfs/dbraw/zinc/81/16/72/1382811672.db2.gz	OTYGRABUOMWKAG-UHFFFAOYSA-N	0	3	348.531	3.215	20	30		EGEDHN
C[C@H](N)c1nc2ccccc2n1-c1nccc(Br)c1C#N	ZINC001162777314	1382869827	/nfs/dbraw/zinc/86/98/27/1382869827.db2.gz	PRCDMUBOKWPQNT-VIFPVBQESA-N	0	3	342.200	3.074	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C(C)(C)C1CCC1	ZINC001162871389	1382900567	/nfs/dbraw/zinc/90/05/67/1382900567.db2.gz	PLTKURUJSZMMOP-UHFFFAOYSA-N	0	3	340.511	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H](CCC)C(C)C	ZINC001162946934	1382924087	/nfs/dbraw/zinc/92/40/87/1382924087.db2.gz	TZQVYGPCPJJXKJ-HXUWFJFHSA-N	0	3	328.500	3.353	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CCCC[C@@H]1CC	ZINC001162970982	1382932908	/nfs/dbraw/zinc/93/29/08/1382932908.db2.gz	RQEOVFKTELWLMU-SFTDATJTSA-N	0	3	340.511	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CCCC(C)(C)C1	ZINC001163007025	1382946624	/nfs/dbraw/zinc/94/66/24/1382946624.db2.gz	NFIFQTLONOFXPY-FQEVSTJZSA-N	0	3	340.511	3.497	20	30		EGEDHN
N#Cc1cnc2nc(Cl)ccc2c1N[C@H]1CNCc2ccsc21	ZINC001163221724	1382996625	/nfs/dbraw/zinc/99/66/25/1382996625.db2.gz	XMDDGFTWBOMGEH-LBPRGKRZSA-N	0	3	341.827	3.473	20	30		EGEDHN
CS[C@@H](C)CC(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001164156219	1383161560	/nfs/dbraw/zinc/16/15/60/1383161560.db2.gz	MJUKDGIZMRGCPF-HNNXBMFYSA-N	0	3	345.512	3.076	20	30		EGEDHN
CC#CCCCC(=O)NCCCNCc1cc(-c2ccccc2)no1	ZINC001164251429	1383171551	/nfs/dbraw/zinc/17/15/51/1383171551.db2.gz	KOQGCZGAMLUTTG-UHFFFAOYSA-N	0	3	339.439	3.131	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCCCNCc1nsc2ccccc12	ZINC001164324484	1383177764	/nfs/dbraw/zinc/17/77/64/1383177764.db2.gz	VHJAMNGSPRRDBR-CQSZACIVSA-N	0	3	331.485	3.495	20	30		EGEDHN
C=CCCOCCCCC(=O)NCCC1(CNCC(=C)Cl)CC1	ZINC001164513889	1383195020	/nfs/dbraw/zinc/19/50/20/1383195020.db2.gz	KEBRBWJXXLLWKW-UHFFFAOYSA-N	0	3	342.911	3.378	20	30		EGEDHN
Cc1ncc(C#N)c(N(C)[C@@H]2CN(Cc3ccccc3)CC[C@@H]2C)n1	ZINC001165180874	1383242305	/nfs/dbraw/zinc/24/23/05/1383242305.db2.gz	FSKYZFPHERRTSG-HNAYVOBHSA-N	0	3	335.455	3.004	20	30		EGEDHN
C[C@@H]1CCCC[C@@H]1C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001165410515	1383289349	/nfs/dbraw/zinc/28/93/49/1383289349.db2.gz	QBSBFIOKNGNVLY-PBHICJAKSA-N	0	3	331.435	3.120	20	30		EGEDHN
C[C@H]1CCC[C@H](C(=O)NCCCNCc2ccc(C#N)cc2F)C1	ZINC001165424090	1383293398	/nfs/dbraw/zinc/29/33/98/1383293398.db2.gz	JCMWDAJKYHVDBU-HOCLYGCPSA-N	0	3	331.435	3.120	20	30		EGEDHN
CC1(C(=O)NCCCNCc2cc(C#N)ccc2F)CCCCC1	ZINC001165761168	1383340836	/nfs/dbraw/zinc/34/08/36/1383340836.db2.gz	NVGDZYXZULYRAI-UHFFFAOYSA-N	0	3	331.435	3.264	20	30		EGEDHN
CCCCC1(C(=O)NCCCNCc2ccc(C#N)cc2F)CC1	ZINC001165895441	1383359912	/nfs/dbraw/zinc/35/99/12/1383359912.db2.gz	LVVMORUIRPEUQO-UHFFFAOYSA-N	0	3	331.435	3.264	20	30		EGEDHN
C=CCCC1(C(=O)NCCCNCc2cc(C#N)ccc2F)CC1	ZINC001165913854	1383364126	/nfs/dbraw/zinc/36/41/26/1383364126.db2.gz	LEDVLILUWHYPGY-UHFFFAOYSA-N	0	3	329.419	3.040	20	30		EGEDHN
C=CCCC1(C(=O)NCCCNCc2cc(O)ccc2Cl)CC1	ZINC001165921987	1383365228	/nfs/dbraw/zinc/36/52/28/1383365228.db2.gz	XTYFTUWQFFYKPH-UHFFFAOYSA-N	0	3	336.863	3.388	20	30		EGEDHN
CC[C@@H]1CCC[C@H]1C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001166036237	1383380095	/nfs/dbraw/zinc/38/00/95/1383380095.db2.gz	MAHASJHDEXHMSI-NVXWUHKLSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cc(-c3ccco3)on2)CC1	ZINC001166453281	1383424172	/nfs/dbraw/zinc/42/41/72/1383424172.db2.gz	NZDDKORQNXICFB-UHFFFAOYSA-N	0	3	349.818	3.177	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCC1(CN[C@@H](C)c2cnccn2)CC1	ZINC001166541958	1383435501	/nfs/dbraw/zinc/43/55/01/1383435501.db2.gz	WKWBSNBYADRQHU-HNNXBMFYSA-N	0	3	330.476	3.016	20	30		EGEDHN
C#CCCCCCC(=O)NCCC1(CNCc2nc(C)cs2)CC1	ZINC001166589320	1383442053	/nfs/dbraw/zinc/44/20/53/1383442053.db2.gz	VUISWJHWSZWOOK-UHFFFAOYSA-N	0	3	347.528	3.411	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCC1(CNCc2conc2CC)CC1	ZINC001166694686	1383462128	/nfs/dbraw/zinc/46/21/28/1383462128.db2.gz	OBWDAGRQFBCWBF-LSDHHAIUSA-N	0	3	333.476	3.071	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)CCCC2CC2)CC1	ZINC001166715847	1383465658	/nfs/dbraw/zinc/46/56/58/1383465658.db2.gz	CWYOUCVRCMVPTK-UHFFFAOYSA-N	0	3	343.309	3.351	20	30		EGEDHN
N#Cc1ccccc1CNCC1(CCNC(=O)[C@@H]2CC[C@@H](F)C2)CC1	ZINC001166850979	1383487412	/nfs/dbraw/zinc/48/74/12/1383487412.db2.gz	QMQXOZURYYTMBO-CRAIPNDOSA-N	0	3	343.446	3.073	20	30		EGEDHN
C=CCCCC(=O)NCCC1(CN[C@H](C)c2cnc(C)cn2)CC1	ZINC001166910004	1383498331	/nfs/dbraw/zinc/49/83/31/1383498331.db2.gz	IILYSOHZKCRURE-MRXNPFEDSA-N	0	3	330.476	3.078	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc3ncccc3c2)CC1	ZINC001166971071	1383506974	/nfs/dbraw/zinc/50/69/74/1383506974.db2.gz	GHUIPAQIITVYRF-UHFFFAOYSA-N	0	3	343.858	3.477	20	30		EGEDHN
C=CCCC1(C(=O)NCCC2(CN[C@H](C)c3cnccn3)CC2)CC1	ZINC001167025134	1383521065	/nfs/dbraw/zinc/52/10/65/1383521065.db2.gz	BAVADLZIJQAKQN-MRXNPFEDSA-N	0	3	342.487	3.160	20	30		EGEDHN
C=CCCC1(C(=O)NCCC2(CNCc3ccc(F)cn3)CC2)CC1	ZINC001167029819	1383523407	/nfs/dbraw/zinc/52/34/07/1383523407.db2.gz	HQLYXRDDWIOOSA-UHFFFAOYSA-N	0	3	345.462	3.343	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@H](C)c2ccsc2)CC1	ZINC001167193994	1383563357	/nfs/dbraw/zinc/56/33/57/1383563357.db2.gz	IYUXICSXSUACPQ-CYBMUJFWSA-N	0	3	326.893	3.480	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C2CCC(F)(F)CC2)CC1	ZINC001167326627	1383598733	/nfs/dbraw/zinc/59/87/33/1383598733.db2.gz	YOTZYRZTYBWJDM-UHFFFAOYSA-N	0	3	334.838	3.441	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)[C@H](F)c2ccccc2)c(F)c1	ZINC001167372505	1383613583	/nfs/dbraw/zinc/61/35/83/1383613583.db2.gz	MEBZGRMKIJGIRX-GOSISDBHSA-N	0	3	343.377	3.004	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cc(C)cc3c[nH]nc32)CC1	ZINC001167455948	1383637721	/nfs/dbraw/zinc/63/77/21/1383637721.db2.gz	KLSVQKNUWUMQPO-UHFFFAOYSA-N	0	3	346.862	3.114	20	30		EGEDHN
CCC[C@H](C(=O)NCCCNCc1ccc(C#N)cc1F)C(C)C	ZINC001167471322	1383643631	/nfs/dbraw/zinc/64/36/31/1383643631.db2.gz	FQTYDNJTFCISQM-KRWDZBQOSA-N	0	3	333.451	3.366	20	30		EGEDHN
N#Cc1ccccc1N1CCN([C@@H]2CCc3cc(F)ccc3C2)CC1	ZINC001168420844	1383901557	/nfs/dbraw/zinc/90/15/57/1383901557.db2.gz	MVODLPAIXKOHEK-HXUWFJFHSA-N	0	3	335.426	3.377	20	30		EGEDHN
C[C@H](CCCCNCc1cc(F)ccc1C#N)NC(=O)c1ccco1	ZINC001168830910	1384023299	/nfs/dbraw/zinc/02/32/99/1384023299.db2.gz	IULBTQRKODEVLK-CQSZACIVSA-N	0	3	343.402	3.369	20	30		EGEDHN
N#CC1(c2ccccc2F)CCN([C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1	ZINC001169055897	1384101506	/nfs/dbraw/zinc/10/15/06/1384101506.db2.gz	RACWMHWFFIJBLF-GJZGRUSLSA-N	0	3	331.391	3.128	20	30		EGEDHN
N#CC12CCC(Nc3cncc([C@H]4CN5CCC4CC5)n3)(CC1)CC2	ZINC001169748391	1384182021	/nfs/dbraw/zinc/18/20/21/1384182021.db2.gz	XHHGCTREVPPTQF-DZIBYMRMSA-N	0	3	337.471	3.314	20	30		EGEDHN
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@H]1NCc1cc(C#N)ccn1	ZINC001170050748	1384225358	/nfs/dbraw/zinc/22/53/58/1384225358.db2.gz	CWCYGUWYORDFCD-KEYYUXOJSA-N	0	3	344.459	3.077	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1cc2sccc2[nH]1	ZINC001170122659	1384240508	/nfs/dbraw/zinc/24/05/08/1384240508.db2.gz	ZQYRBAHMJIYFRM-UHFFFAOYSA-N	0	3	338.436	3.011	20	30		EGEDHN
N#CC1(c2ccccc2)CCC(NCc2ccn(CCF)n2)CC1	ZINC001170371684	1384301986	/nfs/dbraw/zinc/30/19/86/1384301986.db2.gz	IPXKWNMZBIYXRI-UHFFFAOYSA-N	0	3	326.419	3.346	20	30		EGEDHN
COC[C@H](NC[C@@H](O)c1cccc(C#N)c1)c1cccc(Cl)c1	ZINC001170864521	1384401021	/nfs/dbraw/zinc/40/10/21/1384401021.db2.gz	YFNQGNQAWDOZND-ZWKOTPCHSA-N	0	3	330.815	3.222	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC001171220735	1384472090	/nfs/dbraw/zinc/47/20/90/1384472090.db2.gz	BMGQTCSBCPHCJD-GOSISDBHSA-N	0	3	331.463	3.307	20	30		EGEDHN
C[C@@H](Cc1cccc(C#N)c1)N1CC[C@H](N2Cc3ccccc3C2=O)C1	ZINC001171230280	1384474967	/nfs/dbraw/zinc/47/49/67/1384474967.db2.gz	CAISKCUVZOPJIJ-JXFKEZNVSA-N	0	3	345.446	3.220	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)CC2CCCCC2)C1	ZINC001316627201	1384492430	/nfs/dbraw/zinc/49/24/30/1384492430.db2.gz	UJKGCZBEIKJWQR-SHTZXODSSA-N	0	3	343.309	3.350	20	30		EGEDHN
C=CCOc1ccccc1[C@@H](C)Nc1ccc2c(n1)OCCNC2	ZINC001171370687	1384504087	/nfs/dbraw/zinc/50/40/87/1384504087.db2.gz	YPNKYFLSZPINOD-CQSZACIVSA-N	0	3	325.412	3.302	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)[C@H]1CCC1(F)F	ZINC001171446262	1384526304	/nfs/dbraw/zinc/52/63/04/1384526304.db2.gz	YNHRTOKMKNNIFM-WMLDXEAASA-N	0	3	349.425	3.368	20	30		EGEDHN
CN(C)/C=N/c1ccc(NCCOc2ccc(C#N)cc2)cc1C#N	ZINC001171484597	1384536992	/nfs/dbraw/zinc/53/69/92/1384536992.db2.gz	SZFOKBWWDMKLOZ-OEAKJJBVSA-N	0	3	333.395	3.142	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1c(F)cccc1Cl	ZINC001171831094	1384654142	/nfs/dbraw/zinc/65/41/42/1384654142.db2.gz	YHLFLZDVLFDCAS-UHFFFAOYSA-N	0	3	345.805	3.260	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1CCCN(C(=O)c2ccccc2)CC1	ZINC001171870771	1384666431	/nfs/dbraw/zinc/66/64/31/1384666431.db2.gz	USZXGICRQIUQBA-FQEVSTJZSA-N	0	3	333.435	3.343	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1cc(Br)ccc1OC	ZINC001335855972	1388952723	/nfs/dbraw/zinc/95/27/23/1388952723.db2.gz	HHPDKICFFZBQPD-LLVKDONJSA-N	0	3	327.222	3.080	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1cc(Br)ccc1OC	ZINC001335855974	1388952566	/nfs/dbraw/zinc/95/25/66/1388952566.db2.gz	HHPDKICFFZBQPD-NSHDSACASA-N	0	3	327.222	3.080	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H](C)CCCCNCc2cc(C)no2)cc1	ZINC001174634599	1385128087	/nfs/dbraw/zinc/12/80/87/1385128087.db2.gz	CABPUYSPPHMQPU-OAHLLOKOSA-N	0	3	339.439	3.043	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H](C)CCCCNCc1ccn(CC)n1	ZINC001174694648	1385135435	/nfs/dbraw/zinc/13/54/35/1385135435.db2.gz	UWSGYOPZBLUBQL-GOSISDBHSA-N	0	3	346.519	3.251	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)N[C@H](C)CCCCNCc1ccccc1C#N	ZINC001174781324	1385148013	/nfs/dbraw/zinc/14/80/13/1385148013.db2.gz	AWDKPSOPAQAYFR-CRAIPNDOSA-N	0	3	333.451	3.317	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@H](C)CCCCNCc1cn(C(C)C)nn1	ZINC001174850109	1385160155	/nfs/dbraw/zinc/16/01/55/1385160155.db2.gz	UCTOOMKELOTMOQ-IAGOWNOFSA-N	0	3	349.523	3.226	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H](C)CCCCNCc1cc(C)n(C)n1	ZINC001174850399	1385160244	/nfs/dbraw/zinc/16/02/44/1385160244.db2.gz	XZUPOSHTEOABMR-HOTGVXAUSA-N	0	3	334.508	3.095	20	30		EGEDHN
C[C@H](C(=O)NC[C@H]1CCN(Cc2ccc(C#N)cc2)C1)c1ccccc1	ZINC001317532288	1385259236	/nfs/dbraw/zinc/25/92/36/1385259236.db2.gz	IQPDYAZTTWGSCQ-FXAWDEMLSA-N	0	3	347.462	3.300	20	30		EGEDHN
CCCCC(=O)NCC[C@@H]1CCN(Cc2cc(C#N)ccc2OC)C1	ZINC001317775085	1385468348	/nfs/dbraw/zinc/46/83/48/1385468348.db2.gz	NUGSDERMYMDRAB-MRXNPFEDSA-N	0	3	343.471	3.085	20	30		EGEDHN
CCc1ccsc1C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001176838880	1385719885	/nfs/dbraw/zinc/71/98/85/1385719885.db2.gz	GHTCJTVBNLFOGN-UHFFFAOYSA-N	0	3	345.443	3.231	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@@H](CCCC)C(C)C	ZINC001177083893	1385799991	/nfs/dbraw/zinc/79/99/91/1385799991.db2.gz	LWSDSLFAGWGKQX-AWEZNQCLSA-N	0	3	333.314	3.453	20	30		EGEDHN
CCC(=O)N(CCCNCc1ccccc1C#N)CC1CCCC1	ZINC001177166840	1385841603	/nfs/dbraw/zinc/84/16/03/1385841603.db2.gz	GMXHNYBUCVQIGR-UHFFFAOYSA-N	0	3	327.472	3.467	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@@H]1CO[C@H](C)C1	ZINC001177353380	1385926552	/nfs/dbraw/zinc/92/65/52/1385926552.db2.gz	ZQTGRTNZHVRQRL-WBVHZDCISA-N	0	3	342.911	3.162	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)[C@@H](C)Cc1cccc(Cl)c1	ZINC001177535707	1385988801	/nfs/dbraw/zinc/98/88/01/1385988801.db2.gz	QTTUFVGFLURSRQ-LBPRGKRZSA-N	0	3	329.271	3.367	20	30		EGEDHN
COc1cccc2ncnc(NC(=O)C(C#N)Cc3cccs3)c21	ZINC001177909370	1386080180	/nfs/dbraw/zinc/08/01/80/1386080180.db2.gz	UNIZQJPDRMOEIU-NSHDSACASA-N	0	3	338.392	3.021	20	30		EGEDHN
COc1cccc2ncnc(NC(=O)C(C#N)Cc3cccs3)c21	ZINC001177909369	1386080205	/nfs/dbraw/zinc/08/02/05/1386080205.db2.gz	UNIZQJPDRMOEIU-LLVKDONJSA-N	0	3	338.392	3.021	20	30		EGEDHN
N#Cc1ccccc1CNCCCCCCNC(=O)CC(F)(F)F	ZINC001177970855	1386099405	/nfs/dbraw/zinc/09/94/05/1386099405.db2.gz	YHZSVXKZMVDFGS-UHFFFAOYSA-N	0	3	341.377	3.277	20	30		EGEDHN
Cc1[nH]ccc1C(=O)NCCCCCCNCc1ccccc1C#N	ZINC001178149090	1386143263	/nfs/dbraw/zinc/14/32/63/1386143263.db2.gz	DHOQINXBLUNJJP-UHFFFAOYSA-N	0	3	338.455	3.275	20	30		EGEDHN
N#Cc1ccccc1CNCCCCCCNC(=O)C1CC(F)(F)C1	ZINC001178157621	1386145111	/nfs/dbraw/zinc/14/51/11/1386145111.db2.gz	AAKJRTUPVWEKML-UHFFFAOYSA-N	0	3	349.425	3.370	20	30		EGEDHN
CCC1(C(=O)N(C)[C@@H](C)CNCc2cc(C#N)ccc2OC)CCC1	ZINC001319513933	1386155415	/nfs/dbraw/zinc/15/54/15/1386155415.db2.gz	FGSDUKSXBDXBOB-HNNXBMFYSA-N	0	3	343.471	3.084	20	30		EGEDHN
C[C@H]1[C@@H](NCc2ccc(C#N)c(F)c2)CCN1C(=O)/C=C\C(C)(C)C	ZINC001178379328	1386202455	/nfs/dbraw/zinc/20/24/55/1386202455.db2.gz	RFPZXQFCFPXDCL-GRFQLEOOSA-N	0	3	343.446	3.379	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCCCCCN[C@H](C)c1nnc(C)[nH]1	ZINC001178580317	1386254998	/nfs/dbraw/zinc/25/49/98/1386254998.db2.gz	WOGAAHJYQVFZDT-CQSZACIVSA-N	0	3	335.496	3.043	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCCCCCNCc1cc(OC)no1	ZINC001178579760	1386255088	/nfs/dbraw/zinc/25/50/88/1386255088.db2.gz	GAGGOTGAOOSOGL-UHFFFAOYSA-N	0	3	337.464	3.052	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)[C@@H]1C[C@@H]2C=C[C@H]1CC2	ZINC001178735790	1386292822	/nfs/dbraw/zinc/29/28/22/1386292822.db2.gz	DOMWMPCBPRHUQP-NDYOWHOSSA-N	0	3	348.490	3.219	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCCCCCCNCc1nnc(C(C)C)[nH]1	ZINC001179339499	1386455564	/nfs/dbraw/zinc/45/55/64/1386455564.db2.gz	FWOOQBNXRJLTEW-INIZCTEOSA-N	0	3	349.523	3.297	20	30		EGEDHN
C=C1CCC(C(=O)NCCCCCCNCc2cnns2)CC1	ZINC001179482679	1386495217	/nfs/dbraw/zinc/49/52/17/1386495217.db2.gz	ZRIAKISQWRYPFZ-UHFFFAOYSA-N	0	3	336.505	3.051	20	30		EGEDHN
CC(=O)N1CC[C@@H](NCc2cccc(OCC#N)c2)c2ccccc2C1	ZINC001320161841	1386542242	/nfs/dbraw/zinc/54/22/42/1386542242.db2.gz	RCOSITHYDUZGBL-OAQYLSRUSA-N	0	3	349.434	3.172	20	30		EGEDHN
C=CCCOCC(=O)NCCCCCCNC/C(Cl)=C/Cl	ZINC001180427329	1386793576	/nfs/dbraw/zinc/79/35/76/1386793576.db2.gz	DIRWZZIKULBSED-KAMYIIQDSA-N	0	3	337.291	3.164	20	30		EGEDHN
CC/C=C(\C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2ccccc2C#N)C1	ZINC001180779671	1386874624	/nfs/dbraw/zinc/87/46/24/1386874624.db2.gz	WPJQPPFNJKATLZ-PJVYPPMZSA-N	0	3	339.483	3.489	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](C)CN(C)Cc2cccc(C#N)c2)c(C)s1	ZINC001322195833	1387098642	/nfs/dbraw/zinc/09/86/42/1387098642.db2.gz	KDDUGVZSGRIMCG-CYBMUJFWSA-N	0	3	341.480	3.487	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2csc(C)n2)C1	ZINC001182465180	1387171043	/nfs/dbraw/zinc/17/10/43/1387171043.db2.gz	MOOXMZUIKCNCII-RDTXWAMCSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H](C)[C@](C)(CNCc2nccs2)C1	ZINC001182516608	1387181441	/nfs/dbraw/zinc/18/14/41/1387181441.db2.gz	KTYPKMZIFQRRLK-FHLIZLRMSA-N	0	3	335.517	3.320	20	30		EGEDHN
CC(C)(C)N1CCN(c2c(C#N)cnc3c(F)c(F)c(F)cc32)CC1	ZINC001322677919	1387223503	/nfs/dbraw/zinc/22/35/03/1387223503.db2.gz	MEAGYHZUBDEZCC-UHFFFAOYSA-N	0	3	348.372	3.444	20	30		EGEDHN
C[C@H](CNC(=O)C1(C)CCCCC1)N(C)Cc1ccc(C#N)cc1	ZINC001329532883	1389145353	/nfs/dbraw/zinc/14/53/53/1389145353.db2.gz	RXGKIKBQSGDYQY-MRXNPFEDSA-N	0	3	327.472	3.465	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccc(C#N)cc2F)C1	ZINC001338804846	1389772318	/nfs/dbraw/zinc/77/23/18/1389772318.db2.gz	MBAGLLMKLRYZSI-WMLDXEAASA-N	0	3	337.398	3.263	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N(Cc1ccco1)C(C)C	ZINC001338851293	1389790477	/nfs/dbraw/zinc/79/04/77/1389790477.db2.gz	KTWIVODTWWKHEP-INIZCTEOSA-N	0	3	343.475	3.281	20	30		EGEDHN
C=CCn1c([C@H](C)OC(C)(C)C)nnc1N1CCN(CC(C)C)CC1	ZINC001339775406	1390139602	/nfs/dbraw/zinc/13/96/02/1390139602.db2.gz	WECZXCORZDCPGQ-INIZCTEOSA-N	0	3	349.523	3.118	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccc(-n2nc(C)cc2C)c(F)c1	ZINC001339839001	1390168203	/nfs/dbraw/zinc/16/82/03/1390168203.db2.gz	PIZRYHCEVYNSAI-MRXNPFEDSA-N	0	3	330.407	3.250	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N1CCC(c2nc3ccccc3o2)CC1	ZINC001340138791	1390234733	/nfs/dbraw/zinc/23/47/33/1390234733.db2.gz	GUUGCHRKEUXLAW-HNNXBMFYSA-N	0	3	327.428	3.217	20	30		EGEDHN
C=C(Cl)C[C@@H](N)C(=O)Nc1ccc(N2CCCCC2)c(F)c1	ZINC001333733366	1390387124	/nfs/dbraw/zinc/38/71/24/1390387124.db2.gz	UOEOAXDRISDLTI-CQSZACIVSA-N	0	3	325.815	3.224	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)Nc1cn(C)nc1Br	ZINC001341401584	1390482783	/nfs/dbraw/zinc/48/27/83/1390482783.db2.gz	TYTVJEBDCWICQK-LLVKDONJSA-N	0	3	345.285	3.199	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1cccc(C[S@@](=O)C(C)(C)C)c1	ZINC001341568129	1390503821	/nfs/dbraw/zinc/50/38/21/1390503821.db2.gz	WUMLJPLNFLCEGF-QMHKHESXSA-N	0	3	336.501	3.356	20	30		EGEDHN
CC(C)[C@@H]1C[C@H](C(=O)C(C#N)C(=O)Nc2ccccc2Cl)CCO1	ZINC001341948487	1390553336	/nfs/dbraw/zinc/55/33/36/1390553336.db2.gz	VENMFYYCVAJYBW-WWGRRREGSA-N	0	3	348.830	3.439	20	30		EGEDHN
Cc1oc(C(C)(C)C)cc1C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC001342918115	1390672494	/nfs/dbraw/zinc/67/24/94/1390672494.db2.gz	GNQJFZXHMGIXDR-ZDUSSCGKSA-N	0	3	325.368	3.242	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N1CCC[C@@H]1c1nc2ccccc2n1CC	ZINC001343410393	1390712140	/nfs/dbraw/zinc/71/21/40/1390712140.db2.gz	YMUMKZKJESAELO-CRAIPNDOSA-N	0	3	340.471	3.403	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1Cl)C(=O)c1ccc(Cl)nc1	ZINC001343469790	1390716188	/nfs/dbraw/zinc/71/61/88/1390716188.db2.gz	IPABZJNIJNZGQH-JTQLQIEISA-N	0	3	334.162	3.350	20	30		EGEDHN
C=C(C)Cn1c(CCCCC#N)nnc1N1CCN([C@@H](C)CC)CC1	ZINC001343490144	1390717340	/nfs/dbraw/zinc/71/73/40/1390717340.db2.gz	MFYMSYXKGOXOAY-KRWDZBQOSA-N	0	3	344.507	3.011	20	30		EGEDHN
C=C(C)Cn1c([C@H](CC)OCC)nnc1N1C[C@H](C)N(CC)C[C@H]1C	ZINC001343690927	1390731247	/nfs/dbraw/zinc/73/12/47/1390731247.db2.gz	FMDMVVPKJYXWRC-BBWFWOEESA-N	0	3	349.523	3.261	20	30		EGEDHN
Cc1cnc2ccccc2c1N1CC[C@@H](Oc2ccc(C#N)cn2)C1	ZINC001343741769	1390734346	/nfs/dbraw/zinc/73/43/46/1390734346.db2.gz	DMQWHMMYDXLAJH-MRXNPFEDSA-N	0	3	330.391	3.468	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N1CCC(c2nc3c(s2)CCC3)CC1	ZINC001344946337	1390826961	/nfs/dbraw/zinc/82/69/61/1390826961.db2.gz	INIOPCBUZJXMFJ-CQSZACIVSA-N	0	3	333.501	3.021	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCCOc1ccc2c(c1)CCC2	ZINC001345647291	1390871881	/nfs/dbraw/zinc/87/18/81/1390871881.db2.gz	VMRIMCMELOKRFN-SFHVURJKSA-N	0	3	337.423	3.427	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCCOCc1ccc(OC)cc1	ZINC001345647300	1390871991	/nfs/dbraw/zinc/87/19/91/1390871991.db2.gz	VTFSWOLYAVYEPC-KRWDZBQOSA-N	0	3	341.411	3.085	20	30		EGEDHN
N#CC(C(=O)C=Cc1nccs1)C(=O)Nc1ccccc1Cl	ZINC001347091963	1390999918	/nfs/dbraw/zinc/99/99/18/1390999918.db2.gz	LASDIHHRGADIHZ-WWQCOOJYSA-N	0	3	331.784	3.157	20	30		EGEDHN
CC(=O)Nc1c[nH]nc1[C@@H]1CCCN(CCC2(C#N)CCCCC2)C1	ZINC001348448443	1391220833	/nfs/dbraw/zinc/22/08/33/1391220833.db2.gz	BDIIXJXHGXSEDG-MRXNPFEDSA-N	0	3	343.475	3.412	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cccc3c(Cl)nccc23)CC1	ZINC001350190939	1391426974	/nfs/dbraw/zinc/42/69/74/1391426974.db2.gz	UKXIYZQYWDUOLW-UHFFFAOYSA-N	0	3	327.815	3.172	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)N1CC(C)(C)[C@H]1c1nccn1C	ZINC001354355509	1392139745	/nfs/dbraw/zinc/13/97/45/1392139745.db2.gz	AEKWNAJXRYSZIM-JKSUJKDBSA-N	0	3	334.508	3.408	20	30		EGEDHN
Cc1cccc(C(=O)NCC[C@H](C)NCc2ccccc2C#N)c1C	ZINC001480811068	1392949342	/nfs/dbraw/zinc/94/93/42/1392949342.db2.gz	YDLUPBMXJCQVMQ-INIZCTEOSA-N	0	3	335.451	3.473	20	30		EGEDHN
CC(C)c1ccc([C@H](C)N(C)CCNC(=O)c2cc(C#N)c[nH]2)cc1	ZINC001480852992	1392983720	/nfs/dbraw/zinc/98/37/20/1392983720.db2.gz	QPEMUPYDBKLEGA-HNNXBMFYSA-N	0	3	338.455	3.433	20	30		EGEDHN
CC1(C(=O)NC[C@H]2CCN(Cc3cccc(C#N)c3)C2)CCCC1	ZINC001481102599	1393120222	/nfs/dbraw/zinc/12/02/22/1393120222.db2.gz	MNPPZAARGXHLIK-GOSISDBHSA-N	0	3	325.456	3.077	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2cnc3ccccc3n2)CCCC1	ZINC001481898048	1394585845	/nfs/dbraw/zinc/58/58/45/1394585845.db2.gz	PZLXZNIELPTGIH-UHFFFAOYSA-N	0	3	344.846	3.015	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2scnc2C)CCCC[C@@H]1C	ZINC001481955727	1394616974	/nfs/dbraw/zinc/61/69/74/1394616974.db2.gz	UXOGYVOWRNEXSL-ZBEGNZNMSA-N	0	3	341.908	3.472	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)Cc2cccnc2)CCCC[C@H]1C	ZINC001481958222	1394619818	/nfs/dbraw/zinc/61/98/18/1394619818.db2.gz	UUZLFMSJBATGOG-RDTXWAMCSA-N	0	3	335.879	3.031	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)N(C)C(=O)C(C)(C)C1CCC1	ZINC001482314000	1394886466	/nfs/dbraw/zinc/88/64/66/1394886466.db2.gz	NYOJKPJEACQXAE-CYBMUJFWSA-N	0	3	333.501	3.383	20	30		EGEDHN
CCCc1occc1C(=O)N(C)[C@H](C)CNCc1ccc(C#N)s1	ZINC001482353853	1394916797	/nfs/dbraw/zinc/91/67/97/1394916797.db2.gz	LWVMBCZCAWFXCB-CYBMUJFWSA-N	0	3	345.468	3.416	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)CC(C)(C)C)NCc1cc(C#N)ccc1F	ZINC001482513535	1395065946	/nfs/dbraw/zinc/06/59/46/1395065946.db2.gz	JQNPTFGWEYAQCK-QGZVFWFLSA-N	0	3	333.451	3.364	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cnc(CC(C)C)s1)C(C)C	ZINC001482571600	1395093281	/nfs/dbraw/zinc/09/32/81/1395093281.db2.gz	MWFYDFABCWGORP-CYBMUJFWSA-N	0	3	343.924	3.438	20	30		EGEDHN
C[C@@]1(CNC(=O)CCC2CC2)CCCN(Cc2ccc(C#N)cc2)C1	ZINC001484154541	1395289673	/nfs/dbraw/zinc/28/96/73/1395289673.db2.gz	KVHAPTGNERWKTM-NRFANRHFSA-N	0	3	339.483	3.467	20	30		EGEDHN
C[C@@H](CCNC(=O)CCC1CCC1)NCc1cc(C#N)ccc1F	ZINC001492000808	1396302118	/nfs/dbraw/zinc/30/21/18/1396302118.db2.gz	NKDFHXAUFHWMKB-AWEZNQCLSA-N	0	3	331.435	3.262	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)Cc1ccc(F)cc1Cl	ZINC001492079009	1396302888	/nfs/dbraw/zinc/30/28/88/1396302888.db2.gz	ZDBSCJCPLYKXRE-LLVKDONJSA-N	0	3	333.234	3.259	20	30		EGEDHN
C=C(Br)CNCC1(NC(=O)c2ccccc2)CCCC1	ZINC001495124710	1396518116	/nfs/dbraw/zinc/51/81/16/1396518116.db2.gz	FVANEXFOVWCAJO-UHFFFAOYSA-N	0	3	337.261	3.227	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2ncccc2F)CCCC[C@@H]1C	ZINC001495325062	1396533206	/nfs/dbraw/zinc/53/32/06/1396533206.db2.gz	LDZQONURXLKHOL-YVEFUNNKSA-N	0	3	339.842	3.242	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)[C@H](C)C(C)C)CCCC1	ZINC001495950163	1396575187	/nfs/dbraw/zinc/57/51/87/1396575187.db2.gz	WUMPFXPGZIHCJV-CYBMUJFWSA-N	0	3	331.298	3.206	20	30		EGEDHN
C[C@@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)C(C)(C)C1CCC1	ZINC001496131989	1396608996	/nfs/dbraw/zinc/60/89/96/1396608996.db2.gz	YLLGAGCWLRBISV-AWEZNQCLSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)CCc1cncc(C)c1	ZINC001689905684	1404199207	/nfs/dbraw/zinc/19/92/07/1404199207.db2.gz	OYPDMOKZTYNRQR-AEFFLSMTSA-N	0	3	349.906	3.434	20	30		EGEDHN
C[C@H](CNC(=O)c1sccc1Cl)NCc1ccc(C#N)s1	ZINC001690577838	1404638302	/nfs/dbraw/zinc/63/83/02/1404638302.db2.gz	VHHVQDRSAKHMSJ-SECBINFHSA-N	0	3	339.873	3.243	20	30		EGEDHN
Cc1cc(C(=O)NC[C@H](C)NCc2ccc(C#N)s2)c(F)cc1F	ZINC001690591310	1404642504	/nfs/dbraw/zinc/64/25/04/1404642504.db2.gz	LBSTYEYLLXPTTF-NSHDSACASA-N	0	3	349.406	3.115	20	30		EGEDHN
CC(C)c1occc1C(=O)NC[C@@H](C)NCc1ccc(C#N)s1	ZINC001690651685	1404683506	/nfs/dbraw/zinc/68/35/06/1404683506.db2.gz	DSILSPJPWZUJCD-GFCCVEGCSA-N	0	3	331.441	3.244	20	30		EGEDHN
CCc1ccccc1C(=O)NC[C@H](C)N(C)Cc1cccc(C#N)c1	ZINC001725176108	1425692748	/nfs/dbraw/zinc/69/27/48/1425692748.db2.gz	IZSHYVLGAZITDB-INIZCTEOSA-N	0	3	335.451	3.371	20	30		EGEDHN
Cc1cc(C(=O)NCC[C@H](C)NCc2ccccc2C#N)c(C)o1	ZINC001690831376	1404767227	/nfs/dbraw/zinc/76/72/27/1404767227.db2.gz	DUEMBGPLLVZGLR-ZDUSSCGKSA-N	0	3	325.412	3.066	20	30		EGEDHN
CC(C)(C)CC(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1	ZINC001692332244	1405951301	/nfs/dbraw/zinc/95/13/01/1405951301.db2.gz	MUMHXAWIKQQAMF-UHFFFAOYSA-N	0	3	331.435	3.118	20	30		EGEDHN
Cc1ccc(CCCN2CCC[C@H](NC(=O)C#CC(C)C)C2)cc1	ZINC001732091495	1428357860	/nfs/dbraw/zinc/35/78/60/1428357860.db2.gz	FFJGNQKSFDLMPN-FQEVSTJZSA-N	0	3	326.484	3.168	20	30		EGEDHN
C=C(Br)CNCC1(NC(=O)[C@@H](C)C2CCC2)CCCC1	ZINC001732231984	1428478660	/nfs/dbraw/zinc/47/86/60/1428478660.db2.gz	XDGPHOZXNUOFDR-ZDUSSCGKSA-N	0	3	343.309	3.350	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)C(CC)CC)CCCC1	ZINC001732390355	1428559997	/nfs/dbraw/zinc/55/99/97/1428559997.db2.gz	OTCSAEPYKYAPPZ-UHFFFAOYSA-N	0	3	331.298	3.350	20	30		EGEDHN
CCC1(C(=O)N[C@H](C)CN(C)Cc2ccc(C#N)cc2)CCCC1	ZINC001699471604	1412852717	/nfs/dbraw/zinc/85/27/17/1412852717.db2.gz	JXGHMIHMXZAICY-MRXNPFEDSA-N	0	3	327.472	3.465	20	30		EGEDHN
CC(C)(F)C(=O)N[C@@H](CNCc1ccc(C#N)cc1F)C1CCCC1	ZINC001699787576	1413192264	/nfs/dbraw/zinc/19/22/64/1413192264.db2.gz	LAPJQWUDNOEJHR-KRWDZBQOSA-N	0	3	349.425	3.210	20	30		EGEDHN
CC(C)CC(=O)N[C@H](CNCc1ccc(C#N)s1)C1CCCC1	ZINC001699787541	1413192636	/nfs/dbraw/zinc/19/26/36/1413192636.db2.gz	KDNOMAGVWGPHST-QGZVFWFLSA-N	0	3	333.501	3.430	20	30		EGEDHN
C=CCCC(=O)N1CCCC[C@]2(CCN(Cc3conc3CC)C2)C1	ZINC001699804989	1413218252	/nfs/dbraw/zinc/21/82/52/1413218252.db2.gz	JIUUXVXCGVARSF-HXUWFJFHSA-N	0	3	345.487	3.408	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1c(F)ccc(F)c1OC)C(C)C	ZINC001732564142	1428755345	/nfs/dbraw/zinc/75/53/45/1428755345.db2.gz	GOXQOVANDHMFDG-CYBMUJFWSA-N	0	3	346.805	3.070	20	30		EGEDHN
CCc1ccccc1C(=O)N[C@H](C)CN(C)Cc1ccc(C#N)cc1	ZINC001733048184	1429182054	/nfs/dbraw/zinc/18/20/54/1429182054.db2.gz	AFYXOFPULDEUMJ-MRXNPFEDSA-N	0	3	335.451	3.371	20	30		EGEDHN
CCN(CCNC(=O)c1cc(C#N)c[nH]1)[C@@H](C)c1ccc(Cl)cc1	ZINC001713482327	1418170725	/nfs/dbraw/zinc/17/07/25/1418170725.db2.gz	KVFVTLGGWCVTGJ-ZDUSSCGKSA-N	0	3	344.846	3.353	20	30		EGEDHN
Cc1ccccc1CC(=O)NC[C@H]1CCN(Cc2ccc(C#N)cc2)C1	ZINC001713540689	1418301501	/nfs/dbraw/zinc/30/15/01/1418301501.db2.gz	BHKRAJUUZJUYHV-HXUWFJFHSA-N	0	3	347.462	3.048	20	30		EGEDHN
CCCN(CCNC(=O)c1ccoc1CC)Cc1ccc(C#N)cc1	ZINC001713545305	1418313516	/nfs/dbraw/zinc/31/35/16/1418313516.db2.gz	VRVMPDXSWMDLSW-UHFFFAOYSA-N	0	3	339.439	3.356	20	30		EGEDHN
CC[C@H](CC(=O)N1CC[C@H](NCc2ccc(C#N)s2)C1)C(C)C	ZINC001713933985	1418723042	/nfs/dbraw/zinc/72/30/42/1418723042.db2.gz	IOGTVUDPCZEDMB-CABCVRRESA-N	0	3	333.501	3.383	20	30		EGEDHN
CCc1occc1C(=O)NC[C@H](CC)NCc1ccc(C#N)s1	ZINC001714073842	1418868675	/nfs/dbraw/zinc/86/86/75/1418868675.db2.gz	PERGUMSOIYFGAN-LBPRGKRZSA-N	0	3	331.441	3.073	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1ccc2ncccc2c1)C1CC1	ZINC001714171106	1418979044	/nfs/dbraw/zinc/97/90/44/1418979044.db2.gz	AHFZEVZDXHADCO-LJQANCHMSA-N	0	3	343.858	3.475	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2cnccc2C)CCCC[C@@H]1C	ZINC001714180821	1418988951	/nfs/dbraw/zinc/98/89/51/1418988951.db2.gz	UBQWJQKDQPSRFD-KBXCAEBGSA-N	0	3	335.879	3.411	20	30		EGEDHN
C[C@H](CNC(=O)c1cccc(Cl)c1)NCc1ccc(C#N)s1	ZINC001714293640	1419071931	/nfs/dbraw/zinc/07/19/31/1419071931.db2.gz	BPZMVVCETRMGJX-LLVKDONJSA-N	0	3	333.844	3.181	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)Cc2ccc(F)c(F)c2)CCCC1	ZINC001714502581	1419228781	/nfs/dbraw/zinc/22/87/81/1419228781.db2.gz	SVXIHRGBJWROKH-UHFFFAOYSA-N	0	3	342.817	3.278	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccc3c(c2)C[C@H](C)O3)CCCC1	ZINC001714507091	1419233877	/nfs/dbraw/zinc/23/38/77/1419233877.db2.gz	PHEGCNDOBJXIEZ-AWEZNQCLSA-N	0	3	348.874	3.395	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)C2=COCCC2)CCCC[C@@H]1C	ZINC001715131846	1419881567	/nfs/dbraw/zinc/88/15/67/1419881567.db2.gz	SVPJAULOUXZNCB-SUMWQHHRSA-N	0	3	326.868	3.088	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCC1CCN([C@H](C)c2ccc(F)c(F)c2)CC1	ZINC001715200117	1419932084	/nfs/dbraw/zinc/93/20/84/1419932084.db2.gz	IQNPVMUZTRCSML-ZIAGYGMSSA-N	0	3	349.425	3.404	20	30		EGEDHN
Cc1ccc(C(=O)N(C)[C@H](C)CNCc2ccc(C#N)s2)cc1F	ZINC001715345920	1420047698	/nfs/dbraw/zinc/04/76/98/1420047698.db2.gz	NOTMWXLSINAPPV-CYBMUJFWSA-N	0	3	345.443	3.318	20	30		EGEDHN
COc1ccc(C#N)cc1CN[C@H](CNC(=O)CC(C)(C)C)C(C)C	ZINC001715487421	1420168440	/nfs/dbraw/zinc/16/84/40/1420168440.db2.gz	BJINWSQZYGPLIQ-QGZVFWFLSA-N	0	3	345.487	3.233	20	30		EGEDHN
CCC(CC)C(=O)N[C@H]1CCC[C@H]1CNCc1ccccc1C#N	ZINC001715544907	1420242280	/nfs/dbraw/zinc/24/22/80/1420242280.db2.gz	GWHNLSALDZHZIW-OALUTQOASA-N	0	3	327.472	3.369	20	30		EGEDHN
CCC1(C(=O)NC[C@H](NCc2cc(C#N)ccc2F)C(C)C)CC1	ZINC001715645561	1420277345	/nfs/dbraw/zinc/27/73/45/1420277345.db2.gz	OSTSYGCBZDLVJB-KRWDZBQOSA-N	0	3	331.435	3.118	20	30		EGEDHN
C[C@@H](CN(C)Cc1cccc(C#N)c1)NC(=O)c1ccc(CF)cc1	ZINC001716508995	1420741386	/nfs/dbraw/zinc/74/13/86/1420741386.db2.gz	URWDWFKLKMXHMA-HNNXBMFYSA-N	0	3	339.414	3.278	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N[C@@H](CNCc1ccc(C#N)s1)C1CCCC1	ZINC001716817422	1420943629	/nfs/dbraw/zinc/94/36/29/1420943629.db2.gz	YVIZBIGYUVRWGQ-SJORKVTESA-N	0	3	345.512	3.430	20	30		EGEDHN
CCC1(C(=O)NC[C@@]2(C)CCCN(Cc3ccc(C#N)cc3)C2)CC1	ZINC001716899626	1421029322	/nfs/dbraw/zinc/02/93/22/1421029322.db2.gz	OKNKDWUQPPCLSM-HXUWFJFHSA-N	0	3	339.483	3.467	20	30		EGEDHN
Cc1ccoc1C(=O)N1CCCC[C@@H]1CNCC#Cc1ccccc1	ZINC001717143947	1421137428	/nfs/dbraw/zinc/13/74/28/1421137428.db2.gz	NJNRMYVGQHORCX-LJQANCHMSA-N	0	3	336.435	3.224	20	30		EGEDHN
C[C@H](CN(C)Cc1cccc(C#N)c1)NC(=O)c1ccc(F)cc1F	ZINC001722915393	1424250386	/nfs/dbraw/zinc/25/03/86/1424250386.db2.gz	XFMLZRNNNJFXSP-CYBMUJFWSA-N	0	3	343.377	3.087	20	30		EGEDHN
Cc1cscc1C(=O)N[C@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001723291014	1424336235	/nfs/dbraw/zinc/33/62/35/1424336235.db2.gz	YFTFQIQRBZYXHH-MRXNPFEDSA-N	0	3	345.493	3.288	20	30		EGEDHN
CC(C)(C(=O)N[C@@H](CNCc1ccc(C#N)s1)C1CC1)C1CC1	ZINC001723322281	1424349288	/nfs/dbraw/zinc/34/92/88/1424349288.db2.gz	FFQOKDRGDLSFBW-INIZCTEOSA-N	0	3	331.485	3.040	20	30		EGEDHN
CC(C)SCC(=O)N1CC[C@H]([C@@H](C)NCc2ccccc2C#N)C1	ZINC001733523308	1429731455	/nfs/dbraw/zinc/73/14/55/1429731455.db2.gz	BASJTOVNKMNVIJ-QAPCUYQASA-N	0	3	345.512	3.026	20	30		EGEDHN
CCC[C@H](C)C(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001723998052	1424620661	/nfs/dbraw/zinc/62/06/61/1424620661.db2.gz	LWZVGNBZWPIPFK-INIZCTEOSA-N	0	3	327.472	3.465	20	30		EGEDHN
CC1(C)CC(C(=O)NCC2(NCc3ccc(F)c(C#N)c3)CCC2)C1	ZINC001724782726	1425147650	/nfs/dbraw/zinc/14/76/50/1425147650.db2.gz	JAYWHWXLAHPQQL-UHFFFAOYSA-N	0	3	343.446	3.262	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)C(C)(C)C(F)F)CCN1Cc1cccc(C#N)c1	ZINC001724994499	1425398690	/nfs/dbraw/zinc/39/86/90/1425398690.db2.gz	IACPLZRSDRRSLR-CJNGLKHVSA-N	0	3	349.425	3.319	20	30		EGEDHN
CCN(CCNC(=O)c1sccc1C)Cc1cccc(C#N)c1	ZINC001731798701	1427957695	/nfs/dbraw/zinc/95/76/95/1427957695.db2.gz	KLDGINSONIJGIR-UHFFFAOYSA-N	0	3	327.453	3.180	20	30		EGEDHN
C=C(Cl)CNCC1(O)CCN(C(=O)CCC2CCCCC2)CC1	ZINC001733890464	1437708931	/nfs/dbraw/zinc/70/89/31/1437708931.db2.gz	NGKCMJGENSTLKD-UHFFFAOYSA-N	0	3	342.911	3.043	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)c2cc(C)sn2)CC1	ZINC001733917589	1437731057	/nfs/dbraw/zinc/73/10/57/1437731057.db2.gz	BTGDCGHZPVMEJB-UHFFFAOYSA-N	0	3	341.908	3.378	20	30		EGEDHN
COc1ccc(CN[C@H]2C[C@@H](C)N(C(=O)CCC(C)C)C2)cc1C#N	ZINC001734407131	1438085060	/nfs/dbraw/zinc/08/50/60/1438085060.db2.gz	SZFLERHMFCBMQP-QAPCUYQASA-N	0	3	343.471	3.082	20	30		EGEDHN
CN(CCCNC(=O)[C@@H]1CCC[C@H](F)C1)Cc1ccc(F)c(C#N)c1	ZINC001751976151	1440129971	/nfs/dbraw/zinc/12/99/71/1440129971.db2.gz	ZLVXTTNJPVKKJZ-WBVHZDCISA-N	0	3	349.425	3.164	20	30		EGEDHN
Cc1c[nH]cc1C(=O)N1CCCC[C@H]1[C@@H](C)NCC#Cc1ccccc1	ZINC001752154640	1440146628	/nfs/dbraw/zinc/14/66/28/1440146628.db2.gz	DBZDUDZYOKFYFI-NQIIRXRSSA-N	0	3	349.478	3.348	20	30		EGEDHN
CCN(CC#Cc1ccccc1)CCCNC(=O)[C@@H]1CC[C@H]2C[C@H]2C1	ZINC001752193822	1440152735	/nfs/dbraw/zinc/15/27/35/1440152735.db2.gz	ZDJVBXTWYLJBRO-HBMCJLEFSA-N	0	3	338.495	3.303	20	30		EGEDHN
CC(C)CC(=O)NC[C@@H](NCC#Cc1cccc(Cl)c1)C1CC1	ZINC001752445941	1440181918	/nfs/dbraw/zinc/18/19/18/1440181918.db2.gz	SZASKCPFBNUYQZ-GOSISDBHSA-N	0	3	332.875	3.222	20	30		EGEDHN
Cc1ccc(CN[C@H](CNC(=O)C#CC2CC2)C2CC2)c(Cl)c1	ZINC001752462282	1440183885	/nfs/dbraw/zinc/18/38/85/1440183885.db2.gz	CAWYJOMQDJORDW-GOSISDBHSA-N	0	3	330.859	3.046	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1Cc2ccccc2O1	ZINC001752538038	1440194253	/nfs/dbraw/zinc/19/42/53/1440194253.db2.gz	BOWHQUFBZOQTGN-BOLBYERCSA-N	0	3	340.467	3.020	20	30		EGEDHN
C=CCCCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@]1(C)CCCOC1	ZINC001752542884	1440194798	/nfs/dbraw/zinc/19/47/98/1440194798.db2.gz	GMPVRXUAPMBMHI-NSHGMRRFSA-N	0	3	334.504	3.225	20	30		EGEDHN
CCCC[C@H](C)C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001752651136	1440197995	/nfs/dbraw/zinc/19/79/95/1440197995.db2.gz	IEASBNFETWFUDC-JQFCIGGWSA-N	0	3	331.435	3.260	20	30		EGEDHN
CC[C@H](C)[C@H](C)C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001752672941	1440199147	/nfs/dbraw/zinc/19/91/47/1440199147.db2.gz	ITOYGKJCXVMPTF-PYTWLRIVSA-N	0	3	331.435	3.116	20	30		EGEDHN
CC[C@H](C)[C@H](C)C(=O)N[C@H]1C[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001752674564	1440199237	/nfs/dbraw/zinc/19/92/37/1440199237.db2.gz	XGWCXHVVUZXALE-LNMJFAINSA-N	0	3	330.447	3.096	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@@H](NCc3cncc(F)c3)C2)CCCC1	ZINC001752776042	1440206871	/nfs/dbraw/zinc/20/68/71/1440206871.db2.gz	GEOGUPZIRKHXCE-CALCHBBNSA-N	0	3	331.435	3.094	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@H]1CCCN(Cc2c(C)nsc2C)C1	ZINC001752785520	1440211107	/nfs/dbraw/zinc/21/11/07/1440211107.db2.gz	WUOOTLXZBFPJIS-OAHLLOKOSA-N	0	3	335.517	3.300	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@@H]1CCCN(Cc2c(C)onc2CC)C1	ZINC001752786063	1440211271	/nfs/dbraw/zinc/21/12/71/1440211271.db2.gz	JZFGZAUHUMHHSL-IRXDYDNUSA-N	0	3	347.503	3.476	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@H]1CCCCN1C[C@@H](O)c1ccccc1	ZINC001752821216	1440220635	/nfs/dbraw/zinc/22/06/35/1440220635.db2.gz	LANOIPZFRIKVSI-RTBURBONSA-N	0	3	344.499	3.293	20	30		EGEDHN
C=CCN1CCCC[C@H]1CNC(=O)CCn1ccc2ccccc21	ZINC001752824690	1440223113	/nfs/dbraw/zinc/22/31/13/1440223113.db2.gz	CDPIPNOGQZIPMQ-SFHVURJKSA-N	0	3	325.456	3.188	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@@H](C)c1cccc(OC)c1	ZINC001752825124	1440223239	/nfs/dbraw/zinc/22/32/39/1440223239.db2.gz	LWMNALBVCGUFEB-FUHWJXTLSA-N	0	3	330.472	3.346	20	30		EGEDHN
CC1(C(=O)N2CCCC[C@H]2CNCC#Cc2cccc(Cl)c2)CC1	ZINC001752827362	1440224224	/nfs/dbraw/zinc/22/42/24/1440224224.db2.gz	AGRQYJDIFVJMIW-SFHVURJKSA-N	0	3	344.886	3.462	20	30		EGEDHN
COCC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)CCCC(C)C	ZINC001752833403	1440226513	/nfs/dbraw/zinc/22/65/13/1440226513.db2.gz	FSHVTGJODNQTDC-VQTJNVASSA-N	0	3	348.531	3.308	20	30		EGEDHN
C[C@H](C#N)C(=O)NC[C@H](C)NCc1sc2ccccc2c1Cl	ZINC001752863545	1440236092	/nfs/dbraw/zinc/23/60/92/1440236092.db2.gz	AMDRNFXXLRMNIO-MNOVXSKESA-N	0	3	335.860	3.309	20	30		EGEDHN
CC(C)c1[nH]ccc1C(=O)NC[C@@H](C)NCc1ccc(F)c(C#N)c1	ZINC001752894151	1440241453	/nfs/dbraw/zinc/24/14/53/1440241453.db2.gz	HQHNVCGVMCWHIZ-CYBMUJFWSA-N	0	3	342.418	3.057	20	30		EGEDHN
Cc1cc(C)cc(C(=O)NC[C@H](C)NCc2ccc(F)c(C#N)c2)c1	ZINC001752913894	1440246345	/nfs/dbraw/zinc/24/63/45/1440246345.db2.gz	MUWPDZHFIHBDBM-HNNXBMFYSA-N	0	3	339.414	3.222	20	30		EGEDHN
C=CCC1(C(=O)NC[C@H](C)NCc2ccc(OC)nc2)CCCCC1	ZINC001752920778	1440248506	/nfs/dbraw/zinc/24/85/06/1440248506.db2.gz	GMRBIXHAZNGWNF-INIZCTEOSA-N	0	3	345.487	3.211	20	30		EGEDHN
CC[C@H](C)CC(=O)N1CC[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001752936774	1440250464	/nfs/dbraw/zinc/25/04/64/1440250464.db2.gz	VVZVGBCAQGFETL-LSDHHAIUSA-N	0	3	331.435	3.072	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCN(C)Cc1ccc([C@@H](C)C(F)(F)F)cc1	ZINC001753043657	1440277117	/nfs/dbraw/zinc/27/71/17/1440277117.db2.gz	HVJZKZHLFNOFEL-CHWSQXEVSA-N	0	3	341.377	3.060	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCN(C)Cc1ccc([C@H](C)C(F)(F)F)cc1	ZINC001753043660	1440277276	/nfs/dbraw/zinc/27/72/76/1440277276.db2.gz	HVJZKZHLFNOFEL-STQMWFEESA-N	0	3	341.377	3.060	20	30		EGEDHN
C=CCOCCN1CCC[C@H]1CNC(=O)c1cscc1C(F)F	ZINC001753103218	1440305242	/nfs/dbraw/zinc/30/52/42/1440305242.db2.gz	QVTCNZVNPIMOCS-LBPRGKRZSA-N	0	3	344.427	3.083	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)CCCc2ccccc2Cl)C1	ZINC001753127530	1440315193	/nfs/dbraw/zinc/31/51/93/1440315193.db2.gz	QFVYBMPVQVWZBL-INIZCTEOSA-N	0	3	332.875	3.124	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)CCCc2cc(C)sc2C)C1	ZINC001753140618	1440320837	/nfs/dbraw/zinc/32/08/37/1440320837.db2.gz	OYCPJKCOSVHXKQ-KRWDZBQOSA-N	0	3	332.513	3.149	20	30		EGEDHN
CCCN(CCNC(=O)Cc1occc1C)Cc1ccc(C#N)cc1	ZINC001753148519	1440325911	/nfs/dbraw/zinc/32/59/11/1440325911.db2.gz	YWGLZSJDVZQZMH-UHFFFAOYSA-N	0	3	339.439	3.031	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NCCN(Cc1ccc(C)cc1)C1CC1	ZINC001753162611	1440334899	/nfs/dbraw/zinc/33/48/99/1440334899.db2.gz	MZRFSNCZEWGMEP-UHFFFAOYSA-N	0	3	346.474	3.300	20	30		EGEDHN
CCc1nc(C)c(CN(CCCNC(=O)C#CC(C)(C)C)C(C)C)o1	ZINC001753285813	1440348849	/nfs/dbraw/zinc/34/88/49/1440348849.db2.gz	ZTNCXTPVODCMSG-UHFFFAOYSA-N	0	3	347.503	3.312	20	30		EGEDHN
C=C(C)CN[C@@H](CNC(=O)[C@@]1(F)CCOC1)c1ccc(C(C)C)cc1	ZINC001753294540	1440351828	/nfs/dbraw/zinc/35/18/28/1440351828.db2.gz	PBNZSJLMXMFZQL-AZUAARDMSA-N	0	3	348.462	3.262	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@H]2CC[C@@H](C1)N2CC[C@@H]1CCCCO1	ZINC001753310149	1440356381	/nfs/dbraw/zinc/35/63/81/1440356381.db2.gz	MTASIKKDZSIADA-KSZLIROESA-N	0	3	334.504	3.223	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1C[C@H]2CC[C@@H](C1)N2CCCCCF	ZINC001753310884	1440356491	/nfs/dbraw/zinc/35/64/91/1440356491.db2.gz	ZHHCNURAJDBOGM-BGYRXZFFSA-N	0	3	342.458	3.025	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CCC)C(=O)c2ccc3c(c2)CCOC3)C1	ZINC001753318265	1440361196	/nfs/dbraw/zinc/36/11/96/1440361196.db2.gz	GKRWGUHXNFVQIL-HXUWFJFHSA-N	0	3	342.483	3.262	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CCC)C(=O)C[C@H](C)n2nc(C)cc2C)C1	ZINC001753321757	1440364034	/nfs/dbraw/zinc/36/40/34/1440364034.db2.gz	DLOVBLXLRUSHGI-OALUTQOASA-N	0	3	346.519	3.340	20	30		EGEDHN
Cc1ccc(C(=O)NCC[C@@H]2CCN(Cc3ccc(C#N)s3)C2)o1	ZINC001753322156	1440364111	/nfs/dbraw/zinc/36/41/11/1440364111.db2.gz	SUWFJCNTQZDZPY-CQSZACIVSA-N	0	3	343.452	3.163	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCC[C@H]1CCN(Cc2ccccc2C#N)C1	ZINC001753336636	1440372855	/nfs/dbraw/zinc/37/28/55/1440372855.db2.gz	XKRSYDUTSUAFRU-MSOLQXFVSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@H](CN(C)Cc2c(C)noc2C)C1	ZINC001753355296	1440379726	/nfs/dbraw/zinc/37/97/26/1440379726.db2.gz	PEDSNMDWXRDOJY-DLBZAZTESA-N	0	3	333.476	3.174	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H]2C[C@H]1CN2C(=O)c1coc(C(C)(C)C)n1	ZINC001753420581	1440395338	/nfs/dbraw/zinc/39/53/38/1440395338.db2.gz	CJKYKMCVOWEPLH-ILXRZTDVSA-N	0	3	331.460	3.226	20	30		EGEDHN
C=CCCCN1C[C@@H]2C[C@H]1CN2C(=O)c1cnoc1-c1ccccc1	ZINC001753426047	1440396771	/nfs/dbraw/zinc/39/67/71/1440396771.db2.gz	KJLPWNOPULBOJE-IRXDYDNUSA-N	0	3	337.423	3.207	20	30		EGEDHN
C=CCOCCCC(=O)N(C)[C@@H]1CCN(Cc2ccc(C)c(C)c2)C1	ZINC001753432895	1440398829	/nfs/dbraw/zinc/39/88/29/1440398829.db2.gz	XYCNKTVZSZERGE-HXUWFJFHSA-N	0	3	344.499	3.319	20	30		EGEDHN
C=CCOCCN1CC[C@@H](N(C)C(=O)[C@@H](CC)c2ccc(F)cc2)C1	ZINC001753450120	1440405617	/nfs/dbraw/zinc/40/56/17/1440405617.db2.gz	MYUWVOMJVPTXFB-MOPGFXCFSA-N	0	3	348.462	3.055	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H](CC)N[C@@H](C)C(=O)Nc1ccccc1	ZINC001753481564	1440416708	/nfs/dbraw/zinc/41/67/08/1440416708.db2.gz	SRJXVKMVKGKNBK-JKSUJKDBSA-N	0	3	345.487	3.100	20	30		EGEDHN
C[C@@H](NCC1(NC(=O)CSCC#N)CCCC1)c1ccccc1F	ZINC001753499651	1440422973	/nfs/dbraw/zinc/42/29/73/1440422973.db2.gz	DPIMEHQBJIYKQK-CQSZACIVSA-N	0	3	349.475	3.162	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@](C)(CN[C@@H](C)c1cnc(C)cn1)C1CC1	ZINC001753518807	1440428052	/nfs/dbraw/zinc/42/80/52/1440428052.db2.gz	QEEZDWDOYJDXSV-KXBFYZLASA-N	0	3	330.476	3.077	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1CC[C@H](N[C@@H](C)c2cnccn2)CC1	ZINC001753585241	1440441212	/nfs/dbraw/zinc/44/12/12/1440441212.db2.gz	ZCSVZOCGVLKXAJ-JYJNAYRXSA-N	0	3	330.476	3.157	20	30		EGEDHN
C=CCCC(=O)NCCC1CCN(Cc2cnn(C(C)(C)C)c2)CC1	ZINC001753594058	1440443981	/nfs/dbraw/zinc/44/39/81/1440443981.db2.gz	VENRQZIOHFBINK-UHFFFAOYSA-N	0	3	346.519	3.323	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CCc2ccsc2)CCCC1	ZINC001753663994	1440459635	/nfs/dbraw/zinc/45/96/35/1440459635.db2.gz	MHCDVFHEQKMFPQ-UHFFFAOYSA-N	0	3	326.893	3.452	20	30		EGEDHN
O=C(NCC1(NCC#Cc2ccccc2)CCCC1)[C@H]1CC[C@@H](F)C1	ZINC001753667665	1440460775	/nfs/dbraw/zinc/46/07/75/1440460775.db2.gz	FGBRKYRDNMAZNX-RBUKOAKNSA-N	0	3	342.458	3.195	20	30		EGEDHN
C[C@H](CNCC#Cc1ccc(F)cc1)N(C)C(=O)c1ccc(F)cc1	ZINC001753676564	1440463457	/nfs/dbraw/zinc/46/34/57/1440463457.db2.gz	DROHNJWEGJEAJY-OAHLLOKOSA-N	0	3	342.389	3.067	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)CN(CC)c1ccccc1)CC2	ZINC001753676797	1440463501	/nfs/dbraw/zinc/46/35/01/1440463501.db2.gz	FEZZQUUGYMHYJB-UHFFFAOYSA-N	0	3	341.499	3.013	20	30		EGEDHN
C[C@@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)c1ccccc1F	ZINC001753678003	1440463926	/nfs/dbraw/zinc/46/39/26/1440463926.db2.gz	UPYRWEKMFCEHLW-ZDUSSCGKSA-N	0	3	343.377	3.087	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)N(C)C(=O)C[C@H]1CC=CCC1	ZINC001753706402	1440469719	/nfs/dbraw/zinc/46/97/19/1440469719.db2.gz	NEQOGAXNCSLDFR-CABCVRRESA-N	0	3	331.485	3.303	20	30		EGEDHN
Cc1cocc1C(=O)N(C)[C@@H](C)CNCC#Cc1ccc(Cl)cc1	ZINC001753707499	1440469827	/nfs/dbraw/zinc/46/98/27/1440469827.db2.gz	YBAXRRUHCDMDRY-HNNXBMFYSA-N	0	3	344.842	3.343	20	30		EGEDHN
Cc1cccc(CC(=O)N(C)[C@H](C)CNCc2ccc(C#N)s2)c1	ZINC001753710434	1440470411	/nfs/dbraw/zinc/47/04/11/1440470411.db2.gz	OYKUMJLVJTVJCW-OAHLLOKOSA-N	0	3	341.480	3.107	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H](CNCC#Cc2ccccc2)CC(C)C)cn1	ZINC001753731841	1440476231	/nfs/dbraw/zinc/47/62/31/1440476231.db2.gz	BKUBTFJATRBFSJ-OAQYLSRUSA-N	0	3	349.478	3.176	20	30		EGEDHN
CC(C)C[C@@H](CNCc1ccc(C#N)c(F)c1)NC(=O)c1ccoc1	ZINC001753732976	1440476703	/nfs/dbraw/zinc/47/67/03/1440476703.db2.gz	LPLNGVJMLRQUOY-KRWDZBQOSA-N	0	3	343.402	3.225	20	30		EGEDHN
Cc1occc1C(=O)N[C@@H](CNCc1ccc(C#N)s1)CC(C)C	ZINC001753734377	1440477117	/nfs/dbraw/zinc/47/71/17/1440477117.db2.gz	ZURDVRVVCVAXHA-CQSZACIVSA-N	0	3	345.468	3.456	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)C1(CF)CCC1)NCc1cc(C#N)ccc1F	ZINC001753841222	1440502658	/nfs/dbraw/zinc/50/26/58/1440502658.db2.gz	VQDJQNABYGVXKO-QGZVFWFLSA-N	0	3	349.425	3.068	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H]2[C@@H](CCN2Cc2cc(C)ns2)C1	ZINC001753873751	1440518338	/nfs/dbraw/zinc/51/83/38/1440518338.db2.gz	UUKLYYHYOHZIGI-FUHWJXTLSA-N	0	3	345.512	3.068	20	30		EGEDHN
CCCCCCCCC(=O)N1CC[C@H]2[C@H](CCN2CC#CCOC)C1	ZINC001753875827	1440519354	/nfs/dbraw/zinc/51/93/54/1440519354.db2.gz	NMTDTJKFQHPYMA-UXHICEINSA-N	0	3	348.531	3.310	20	30		EGEDHN
CC(C)(C(=O)NC/C=C/CNCc1cccc(C#N)c1)C1CCC1	ZINC001754154285	1440545401	/nfs/dbraw/zinc/54/54/01/1440545401.db2.gz	VJUDTVFWPFJVKV-ONEGZZNKSA-N	0	3	325.456	3.147	20	30		EGEDHN
Cc1nc(C2CC2)ccc1C(=O)N[C@H](C)CNCC#Cc1ccccc1	ZINC001754242895	1440556095	/nfs/dbraw/zinc/55/60/95/1440556095.db2.gz	WGXWONKZVZXBLH-MRXNPFEDSA-N	0	3	347.462	3.027	20	30		EGEDHN
C=C[C@H](C(=O)N[C@H](C)CNCc1scnc1C)c1ccccc1	ZINC001754254519	1440558664	/nfs/dbraw/zinc/55/86/64/1440558664.db2.gz	FLQOAPUUPSALMB-CJNGLKHVSA-N	0	3	329.469	3.016	20	30		EGEDHN
CCCCC1(C(=O)N[C@@H](C)CNCc2ccc(F)c(C#N)c2)CC1	ZINC001754282410	1440563313	/nfs/dbraw/zinc/56/33/13/1440563313.db2.gz	YFNMYPXZTSTGAA-AWEZNQCLSA-N	0	3	331.435	3.262	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H](C)CN(C)Cc1cccc(C(F)(F)F)c1	ZINC001754311755	1440573240	/nfs/dbraw/zinc/57/32/40/1440573240.db2.gz	RXJBDJRGCNDYAN-CQSZACIVSA-N	0	3	340.389	3.301	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](C)CN(C)CCOc2ccc(F)cc2)CC1	ZINC001754322556	1440578729	/nfs/dbraw/zinc/57/87/29/1440578729.db2.gz	FYZFJLCNINCKMQ-MRXNPFEDSA-N	0	3	348.462	3.387	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)[C@@H](C)c1cccs1	ZINC001754324557	1440579682	/nfs/dbraw/zinc/57/96/82/1440579682.db2.gz	ACTSXBLSSUIXGJ-CABCVRRESA-N	0	3	341.480	3.360	20	30		EGEDHN
C[C@H](CN(C)Cc1cccc(C#N)c1)NC(=O)[C@H](F)c1ccccc1	ZINC001754326822	1440581326	/nfs/dbraw/zinc/58/13/26/1440581326.db2.gz	RSFLUOFMYOLZJG-DNVCBOLYSA-N	0	3	339.414	3.206	20	30		EGEDHN
C=C(Cl)CNCCCN(C)C(=O)[C@@H](C)Cc1ccccc1F	ZINC001754395396	1440594569	/nfs/dbraw/zinc/59/45/69/1440594569.db2.gz	BULXMPJJLRVWFM-ZDUSSCGKSA-N	0	3	326.843	3.195	20	30		EGEDHN
C[C@H](C(=O)N[C@@H](CNCC#Cc1cccc(Cl)c1)C1CC1)C1CC1	ZINC001754437218	1440598284	/nfs/dbraw/zinc/59/82/84/1440598284.db2.gz	IKHQEACJYFPJCX-LIRRHRJNSA-N	0	3	344.886	3.222	20	30		EGEDHN
Cc1cccc(C(=O)N[C@H](CNCc2ccc(C#N)s2)C2CC2)c1	ZINC001754437273	1440598508	/nfs/dbraw/zinc/59/85/08/1440598508.db2.gz	UJUZUSAAJRQKPF-GOSISDBHSA-N	0	3	339.464	3.226	20	30		EGEDHN
C=CCC1(C(=O)NC[C@H]2CCN2CCC2CCCC2)CCOCC1	ZINC001754500495	1440614031	/nfs/dbraw/zinc/61/40/31/1440614031.db2.gz	KMGIEMBHNNYZNG-GOSISDBHSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@H]2CCC[C@@H](C1)N2CCC[C@H]1CCOC1	ZINC001754553067	1440630430	/nfs/dbraw/zinc/63/04/30/1440630430.db2.gz	STWAYKYTUOMYJZ-LWYYNNOASA-N	0	3	348.531	3.471	20	30		EGEDHN
CC(C)CCC(=O)N1CCC[C@H]1CNCC#Cc1ccc(F)cc1	ZINC001754605401	1440643147	/nfs/dbraw/zinc/64/31/47/1440643147.db2.gz	DXQSTTWXQCMWFE-IBGZPJMESA-N	0	3	330.447	3.194	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)Cc2ccc(CC(C)C)cc2)CC1	ZINC001754626881	1440646490	/nfs/dbraw/zinc/64/64/90/1440646490.db2.gz	AYFPYZZEVSXRRP-UHFFFAOYSA-N	0	3	340.511	3.422	20	30		EGEDHN
C#CCN1CCC2(CO[C@@H](CNC(=O)C[C@@H](C)CC(C)(C)C)C2)CC1	ZINC001754631818	1440648119	/nfs/dbraw/zinc/64/81/19/1440648119.db2.gz	CINLONDDTBOTOZ-QZTJIDSGSA-N	0	3	348.531	3.069	20	30		EGEDHN
C#CCN(C(=O)[C@H]1C[C@]1(C)C(C)C)C1CCN(CCOC(C)C)CC1	ZINC001754641483	1440649102	/nfs/dbraw/zinc/64/91/02/1440649102.db2.gz	CRUANZUVDCUDQU-TZIWHRDSSA-N	0	3	348.531	3.020	20	30		EGEDHN
C#CCNC[C@@H](NC(=O)[C@@H]1CC12CCC2)c1ccc2ccccc2c1	ZINC001754644846	1440649905	/nfs/dbraw/zinc/64/99/05/1440649905.db2.gz	YFLNKXQUICHLHK-VQTJNVASSA-N	0	3	332.447	3.410	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@](C)(CNCc2ocnc2C)C1	ZINC001754694485	1440666802	/nfs/dbraw/zinc/66/68/02/1440666802.db2.gz	CBTKRTUXZJBFKZ-IBGZPJMESA-N	0	3	331.460	3.080	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@]1(C)CCCN(CCc2ccns2)C1	ZINC001754735800	1440682302	/nfs/dbraw/zinc/68/23/02/1440682302.db2.gz	LAIZKHLBMIWLFR-GOSISDBHSA-N	0	3	335.517	3.116	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@@H]1CN(CC[C@@H](C)F)CCC1(F)F	ZINC001754743498	1440683766	/nfs/dbraw/zinc/68/37/66/1440683766.db2.gz	MJYJDWXEBDSSIN-ZIAGYGMSSA-N	0	3	334.426	3.410	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@H]1CN(CC[C@@H](C)F)CCC1(F)F	ZINC001754743496	1440683870	/nfs/dbraw/zinc/68/38/70/1440683870.db2.gz	MJYJDWXEBDSSIN-KGLIPLIRSA-N	0	3	334.426	3.410	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(Cc1oc(CC)nc1C)C2	ZINC001754784288	1440687116	/nfs/dbraw/zinc/68/71/16/1440687116.db2.gz	BUPOFVUTNNHQOA-BBWFWOEESA-N	0	3	345.487	3.371	20	30		EGEDHN
C=C(C)CN[C@H](CNC(=O)[C@H]1CCCOCC1)c1ccccc1CC	ZINC001754786298	1440687867	/nfs/dbraw/zinc/68/78/67/1440687867.db2.gz	WTJITXQFKQZRMU-AZUAARDMSA-N	0	3	344.499	3.389	20	30		EGEDHN
C#CCNCCN(Cc1ccccc1)C(=O)[C@H](c1cccnc1)C(C)C	ZINC001754838104	1440697313	/nfs/dbraw/zinc/69/73/13/1440697313.db2.gz	ZCGUBVBPKHOCOW-NRFANRHFSA-N	0	3	349.478	3.073	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC[C@H]2CN(Cc3cccnc3C)C[C@H]21	ZINC001754873268	1440705806	/nfs/dbraw/zinc/70/58/06/1440705806.db2.gz	CHFRYWWCVWNVQL-YSIASYRMSA-N	0	3	341.499	3.415	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CC[C@H](CCNCc2ccc(F)cc2F)C1	ZINC001754914456	1440708508	/nfs/dbraw/zinc/70/85/08/1440708508.db2.gz	GFBPTYKVXDDCEM-HNNXBMFYSA-N	0	3	348.437	3.343	20	30		EGEDHN
C=C1CCC(C(=O)NCC2(NCc3cccnc3C)CCC2)CC1	ZINC001754986122	1440722789	/nfs/dbraw/zinc/72/27/89/1440722789.db2.gz	SHNMEJAJYWZMKV-UHFFFAOYSA-N	0	3	327.472	3.265	20	30		EGEDHN
C[C@H](CC(=O)N[C@H]1CCCN(Cc2cccc(C#N)c2)CC1)C1CC1	ZINC001755034807	1440733665	/nfs/dbraw/zinc/73/36/65/1440733665.db2.gz	ZKUNEFUALLNLAS-UZLBHIALSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@@]2(CCN(Cc3oc(C)nc3C)C2)C1	ZINC001755079181	1440750247	/nfs/dbraw/zinc/75/02/47/1440750247.db2.gz	HHGHWLSROWFOPJ-FQEVSTJZSA-N	0	3	345.487	3.462	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@H](C)[C@H](NCc2ccccc2OC(C)C)C1	ZINC001755109005	1440754035	/nfs/dbraw/zinc/75/40/35/1440754035.db2.gz	ORSNYJXLGMNTMV-PKOBYXMFSA-N	0	3	342.483	3.070	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@H](C)[C@H](NCc3ncccc3C)C2)CCCC1	ZINC001755124692	1440756071	/nfs/dbraw/zinc/75/60/71/1440756071.db2.gz	GGSCDCFPLYQNQI-PKOBYXMFSA-N	0	3	341.499	3.463	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](C)[C@@H](NCc3ncccc3C)C2)CCCC1	ZINC001755124691	1440756085	/nfs/dbraw/zinc/75/60/85/1440756085.db2.gz	GGSCDCFPLYQNQI-MJGOQNOKSA-N	0	3	341.499	3.463	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)CCCOc2ccc(F)cc2)C(C)(C)C1	ZINC001755140678	1440759961	/nfs/dbraw/zinc/75/99/61/1440759961.db2.gz	CBFUEVWZCXOCAA-SFHVURJKSA-N	0	3	348.462	3.387	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)[C@@H](CC)c2c(C)noc2C)C(C)(C)C1	ZINC001755142295	1440761247	/nfs/dbraw/zinc/76/12/47/1440761247.db2.gz	PYYYBBFJIRAWPK-DLBZAZTESA-N	0	3	345.487	3.025	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)[C@@H](CC)c2c(C)noc2C)C(C)(C)C1	ZINC001755142297	1440761367	/nfs/dbraw/zinc/76/13/67/1440761367.db2.gz	PYYYBBFJIRAWPK-IRXDYDNUSA-N	0	3	345.487	3.025	20	30		EGEDHN
CC(C)CCC(=O)N[C@H]1CCN(Cc2cccc(C#N)c2)[C@@H](C)C1	ZINC001755157406	1440763411	/nfs/dbraw/zinc/76/34/11/1440763411.db2.gz	IDDFFDPIMPHJHZ-LPHOPBHVSA-N	0	3	327.472	3.464	20	30		EGEDHN
C=CCCCN1CCc2ccccc2[C@H]1CNC(=O)c1[nH]cnc1C	ZINC001755170884	1440768859	/nfs/dbraw/zinc/76/88/59/1440768859.db2.gz	CXXBHAHRLJSXRP-GOSISDBHSA-N	0	3	338.455	3.014	20	30		EGEDHN
C=CCCCN1CCc2ccccc2[C@H]1CNC(=O)C1=CCOCC1	ZINC001755171873	1440769366	/nfs/dbraw/zinc/76/93/66/1440769366.db2.gz	FOJQAQZMYXVKRR-HXUWFJFHSA-N	0	3	340.467	3.015	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)c2c(C)ccn2C)CC1	ZINC001755182350	1440771377	/nfs/dbraw/zinc/77/13/77/1440771377.db2.gz	LLAKDZNKCWSIJG-UHFFFAOYSA-N	0	3	337.895	3.260	20	30		EGEDHN
C#CCCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc(C)n(CC)c1C	ZINC001755186196	1440773220	/nfs/dbraw/zinc/77/32/20/1440773220.db2.gz	KELWDPUNHHWEJZ-NHCUHLMSSA-N	0	3	349.478	3.134	20	30		EGEDHN
CN(Cc1ccc(F)cc1)C[C@@H]1CCCN1C(=O)C#CC(C)(C)C	ZINC001755193343	1440775567	/nfs/dbraw/zinc/77/55/67/1440775567.db2.gz	WKHLSNFMZMRLPX-SFHVURJKSA-N	0	3	330.447	3.298	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@H]1CN(C)Cc1cccc(OC)c1	ZINC001755197560	1440777763	/nfs/dbraw/zinc/77/77/63/1440777763.db2.gz	KPZMFFAUKKEVLK-IBGZPJMESA-N	0	3	342.483	3.312	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC1CC(CNCc2cc(C#N)ccc2F)C1	ZINC001755216212	1440784001	/nfs/dbraw/zinc/78/40/01/1440784001.db2.gz	QOTVUPPFBLNELB-NXVRBGIVSA-N	0	3	343.446	3.284	20	30		EGEDHN
CCCc1[nH]ccc1C(=O)N[C@H](C)[C@H](C)NCC#Cc1ccccc1	ZINC001755251120	1440791923	/nfs/dbraw/zinc/79/19/23/1440791923.db2.gz	WFTKJYIITVMTSM-DLBZAZTESA-N	0	3	337.467	3.115	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)Cc1noc2ccccc12	ZINC001755283779	1440801210	/nfs/dbraw/zinc/80/12/10/1440801210.db2.gz	UZOJCZSXBZIRQP-UHFFFAOYSA-N	0	3	349.862	3.197	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)C[C@@H]1CC(C)(C)CO1	ZINC001755283816	1440801440	/nfs/dbraw/zinc/80/14/40/1440801440.db2.gz	WSVIKPPMKLPGPR-CQSZACIVSA-N	0	3	330.900	3.018	20	30		EGEDHN
C[C@H](CNC(=O)C#CC1CC1)N(C)Cc1cc2ccccc2s1	ZINC001755298308	1440807492	/nfs/dbraw/zinc/80/74/92/1440807492.db2.gz	IMQYUGXHCQWGLU-CQSZACIVSA-N	0	3	326.465	3.251	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@H](C)N(C)Cc1cccc(OC(C)C)c1	ZINC001755299457	1440807798	/nfs/dbraw/zinc/80/77/98/1440807798.db2.gz	VCTKYDQMNQVRHR-KRWDZBQOSA-N	0	3	330.472	3.070	20	30		EGEDHN
CC(C(=O)NC[C@H](C)N(C)Cc1ccc(OCC#N)cc1)=C1CCC1	ZINC001755299731	1440807803	/nfs/dbraw/zinc/80/78/03/1440807803.db2.gz	VTNXBXFPTCECIV-HNNXBMFYSA-N	0	3	341.455	3.026	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@]2(CCN(C(=O)c3sccc3C)C2)C1	ZINC001755399828	1440842733	/nfs/dbraw/zinc/84/27/33/1440842733.db2.gz	RLILLVVZXGSNPW-APWZRJJASA-N	0	3	348.512	3.328	20	30		EGEDHN
CCCCCCCN1C[C@H](NC(=O)c2c[nH]c(C)cc2=O)C(C)(C)C1	ZINC001755414655	1440848193	/nfs/dbraw/zinc/84/81/93/1440848193.db2.gz	AECSXKLKTKFKSY-SFHVURJKSA-N	0	3	347.503	3.094	20	30		EGEDHN
C=C(Cl)CNC[C@H]1CC2(CO1)CCN(C(=O)CCCCC)CC2	ZINC001755464207	1440858049	/nfs/dbraw/zinc/85/80/49/1440858049.db2.gz	JULFRUKCUJJJEN-MRXNPFEDSA-N	0	3	342.911	3.307	20	30		EGEDHN
CCC[C@@H](C)CC(=O)N[C@H]1C[C@H](CNCc2ccccc2C#N)C1	ZINC001755467241	1440858478	/nfs/dbraw/zinc/85/84/78/1440858478.db2.gz	QDYTUTCCBDJVMK-GPMSIDNRSA-N	0	3	327.472	3.369	20	30		EGEDHN
CCCCCC(=O)N[C@H]1C[C@H](CNCc2cc(C#N)ccc2F)C1	ZINC001755467859	1440858489	/nfs/dbraw/zinc/85/84/89/1440858489.db2.gz	DEYBLVNICDPOTE-JCNLHEQBSA-N	0	3	331.435	3.262	20	30		EGEDHN
C[C@H](CCCNCC#Cc1ccccc1Cl)NC(=O)C(C)(F)F	ZINC001755487361	1440860997	/nfs/dbraw/zinc/86/09/97/1440860997.db2.gz	FEWGPDDOWCKYQV-CYBMUJFWSA-N	0	3	342.817	3.221	20	30		EGEDHN
C=C(Cl)CNCCCN(Cc1ccccc1)C(=O)c1ccon1	ZINC001755536743	1440869849	/nfs/dbraw/zinc/86/98/49/1440869849.db2.gz	GIOLEYARHFXYFA-UHFFFAOYSA-N	0	3	333.819	3.049	20	30		EGEDHN
CCCSCC(=O)N(C)[C@H](CNCC#Cc1ccccc1)C1CC1	ZINC001755558425	1440873942	/nfs/dbraw/zinc/87/39/42/1440873942.db2.gz	YEGQNOVHEHTUQV-LJQANCHMSA-N	0	3	344.524	3.008	20	30		EGEDHN
CN(C(=O)C#CC(C)(C)C)[C@@H](CNCc1cc(F)cc(F)c1)C1CC1	ZINC001755572230	1440877219	/nfs/dbraw/zinc/87/72/19/1440877219.db2.gz	ROGZKSNBRDSFIC-SFHVURJKSA-N	0	3	348.437	3.341	20	30		EGEDHN
C[C@H](CN(C)C(=O)[C@@H]1C[C@H]1C(C)(C)C)NCc1ccc(C#N)c(F)c1	ZINC001755594402	1440882322	/nfs/dbraw/zinc/88/23/22/1440882322.db2.gz	BCPDCIRVODFIPZ-KBRIMQKVSA-N	0	3	345.462	3.316	20	30		EGEDHN
C[C@@H]1[C@@H](NCC#Cc2ccc(F)cc2)CCN1C(=O)CC1CCCC1	ZINC001755649333	1440891198	/nfs/dbraw/zinc/89/11/98/1440891198.db2.gz	SCADOBWNEOLDTQ-UZLBHIALSA-N	0	3	342.458	3.337	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@H](NCc2cn(C(C)C)nc2C)C[C@H]1C	ZINC001755673799	1440894358	/nfs/dbraw/zinc/89/43/58/1440894358.db2.gz	BQRCQPSYODLKGG-CRAIPNDOSA-N	0	3	332.492	3.208	20	30		EGEDHN
C[C@@H]1C[C@H](NCC#Cc2ccccc2)CN1C(=O)[C@@H]1CC[C@@H](C)CC1	ZINC001755689109	1440896495	/nfs/dbraw/zinc/89/64/95/1440896495.db2.gz	MSEOVJKDMCAQMX-UKAVVXHISA-N	0	3	338.495	3.443	20	30		EGEDHN
C#CCCCC(=O)N[C@]12CCC[C@@H]1N(Cc1c(C)nsc1C)CC2	ZINC001755697687	1440898590	/nfs/dbraw/zinc/89/85/90/1440898590.db2.gz	ARNNDFMYXBEAIR-HKUYNNGSSA-N	0	3	345.512	3.177	20	30		EGEDHN
C=CCCCC(=O)N[C@@]12CCC[C@H]1N(CCc1ccns1)CC2	ZINC001755702643	1440900874	/nfs/dbraw/zinc/90/08/74/1440900874.db2.gz	WZQPYAQWFWRCAT-SJLPKXTDSA-N	0	3	333.501	3.155	20	30		EGEDHN
C=CCN1CC[C@]2(NC(=O)[C@@H](OCC)c3ccccc3)CCC[C@H]12	ZINC001755705039	1440902350	/nfs/dbraw/zinc/90/23/50/1440902350.db2.gz	TZLDMFVAIDXAFJ-CMKODMSKSA-N	0	3	328.456	3.063	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H]2CCC[C@@H](NCc3nc(C)sc3C)[C@@H]2C1	ZINC001755708388	1440903118	/nfs/dbraw/zinc/90/31/18/1440903118.db2.gz	BNNFJLBFQXFSTJ-GVDBMIGSSA-N	0	3	347.528	3.443	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H]2CCC[C@H](NCc3nc(C)sc3C)[C@H]2C1	ZINC001755708390	1440903160	/nfs/dbraw/zinc/90/31/60/1440903160.db2.gz	BNNFJLBFQXFSTJ-ULQDDVLXSA-N	0	3	347.528	3.443	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CCCN(CCOc2ccc(OC)cc2)[C@@H]1C	ZINC001755713783	1440904422	/nfs/dbraw/zinc/90/44/22/1440904422.db2.gz	DCTNCXOSFPLNOA-APWZRJJASA-N	0	3	346.471	3.009	20	30		EGEDHN
C=CCN1CCC[C@H](NC(=O)CCCOc2cccc(C)c2)[C@@H]1C	ZINC001755720643	1440907385	/nfs/dbraw/zinc/90/73/85/1440907385.db2.gz	IOMOZRSDCUPUDO-HKUYNNGSSA-N	0	3	330.472	3.309	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@@H](CNCc2cc(O)ccc2Cl)C1	ZINC001755730861	1440910141	/nfs/dbraw/zinc/91/01/41/1440910141.db2.gz	NYXMCOFKFWFOEL-UKRRQHHQSA-N	0	3	336.863	3.386	20	30		EGEDHN
CC#CCCCC(=O)N[C@H]1CC[C@H](CNCc2nc(C)c(C)s2)C1	ZINC001755743557	1440912101	/nfs/dbraw/zinc/91/21/01/1440912101.db2.gz	KADROCVPPMUYNH-IRXDYDNUSA-N	0	3	347.528	3.328	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1C[C@@H](NCc2ccccc2F)C(C)(C)C1	ZINC001755752259	1440913390	/nfs/dbraw/zinc/91/33/90/1440913390.db2.gz	GAVNJCIRDMGYGN-CRAIPNDOSA-N	0	3	348.462	3.134	20	30		EGEDHN
C/C=C(/C)C(=O)N1C[C@@H](NCC#Cc2ccc(Cl)cc2)C(C)(C)C1	ZINC001755754530	1440913757	/nfs/dbraw/zinc/91/37/57/1440913757.db2.gz	WZGRLSOAVALFOE-ZPZLLIBOSA-N	0	3	344.886	3.484	20	30		EGEDHN
C=CCN(C)CCN(C(=O)[C@@H]1CCc2ccc(OC)cc21)C(C)C	ZINC001755813183	1440921720	/nfs/dbraw/zinc/92/17/20/1440921720.db2.gz	HZNYDMIGSURQJF-GOSISDBHSA-N	0	3	330.472	3.080	20	30		EGEDHN
COCCN(CCNC(=O)C#CC(C)(C)C)[C@@H](C)c1cccc(C)c1	ZINC001755838123	1440930963	/nfs/dbraw/zinc/93/09/63/1440930963.db2.gz	KQPYHPAJMMARQI-SFHVURJKSA-N	0	3	344.499	3.170	20	30		EGEDHN
CC#CCN1CCC([C@H](C)NC(=O)CC(C)(C)CC(F)F)CC1	ZINC001755847476	1440933890	/nfs/dbraw/zinc/93/38/90/1440933890.db2.gz	AQWKWBNPCOPURO-AWEZNQCLSA-N	0	3	328.447	3.298	20	30		EGEDHN
CC#CCN1CCC([C@H](C)NC(=O)CCCOc2ccccc2)CC1	ZINC001755851666	1440935268	/nfs/dbraw/zinc/93/52/68/1440935268.db2.gz	ZJRALNUGEJDPFI-SFHVURJKSA-N	0	3	342.483	3.086	20	30		EGEDHN
C=CCCC(=O)NCC1=CCN(Cc2cccc3cccnc32)CC1	ZINC001755883043	1440939926	/nfs/dbraw/zinc/93/99/26/1440939926.db2.gz	ZTCKTFPHUUUBNN-UHFFFAOYSA-N	0	3	335.451	3.449	20	30		EGEDHN
COc1ccc(C[C@@](C)(CO)NCc2ccc(C#N)cc2Cl)cc1	ZINC000933433239	1126139791	/nfs/dbraw/zinc/13/97/91/1126139791.db2.gz	TWIGZFZVYJGULH-IBGZPJMESA-N	0	3	344.842	3.304	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)c1cccc2cc[nH]c21	ZINC000079609410	282095737	/nfs/dbraw/zinc/09/57/37/282095737.db2.gz	KCECJELGWNGULV-UHFFFAOYSA-N	0	3	346.434	3.244	20	30		EGEDHN
Cc1ccc([C@H](O)CN2CCCN(Cc3ccc(C#N)cc3)CC2)cc1	ZINC000174710190	231285557	/nfs/dbraw/zinc/28/55/57/231285557.db2.gz	IMVCUGGTPCBGLN-JOCHJYFZSA-N	0	3	349.478	3.108	20	30		EGEDHN
CN(C)Cc1cccc(CNC(=O)CSc2ccc(C#N)cc2)c1	ZINC000103068725	219252185	/nfs/dbraw/zinc/25/21/85/219252185.db2.gz	FATNVPYMJZDNAH-UHFFFAOYSA-N	0	3	339.464	3.028	20	30		EGEDHN
N#Cc1cccc(NC(=O)CN[C@@H](C[C@H]2CCOC2)c2ccccc2)c1	ZINC000181183268	234109436	/nfs/dbraw/zinc/10/94/36/234109436.db2.gz	FPLVQWHYQMDLJF-XLIONFOSSA-N	0	3	349.434	3.254	20	30		EGEDHN
N#Cc1ccc(C(F)(F)F)c(N2CCN(c3ccncc3)CC2)c1	ZINC000120794804	283135292	/nfs/dbraw/zinc/13/52/92/283135292.db2.gz	RPFBGCKOTUGXSK-UHFFFAOYSA-N	0	3	332.329	3.299	20	30		EGEDHN
C=CCOc1cccc(NC(=O)NC2CCN(CC(=C)C)CC2)c1	ZINC000264337844	246370788	/nfs/dbraw/zinc/37/07/88/246370788.db2.gz	BCYIRWYIUUBFPI-UHFFFAOYSA-N	0	3	329.444	3.413	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)o1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000266195120	248164625	/nfs/dbraw/zinc/16/46/25/248164625.db2.gz	JMCINUNKDZCRJL-ZIAGYGMSSA-N	0	3	333.432	3.276	20	30		EGEDHN
CN(CCCOc1cccc(C#N)c1)CCc1ccccc1[N+](=O)[O-]	ZINC000511092751	269687222	/nfs/dbraw/zinc/68/72/22/269687222.db2.gz	UQLKNGKPFAKFGP-UHFFFAOYSA-N	0	3	339.395	3.410	20	30		EGEDHN
Cc1nnc(N[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)c(C#N)c1C	ZINC000267538683	251137152	/nfs/dbraw/zinc/13/71/52/251137152.db2.gz	ZXJKOQPIYLCZMP-KSSFIOAISA-N	0	3	335.455	3.430	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1	ZINC000338137851	141100684	/nfs/dbraw/zinc/10/06/84/141100684.db2.gz	UCISUJMXYVQXDR-KXBFYZLASA-N	0	3	333.435	3.260	20	30		EGEDHN
COc1ccc([C@H](C)NCCC(=O)Nc2sccc2C#N)cc1	ZINC000341185480	141134393	/nfs/dbraw/zinc/13/43/93/141134393.db2.gz	AUDPOJPMVBVNOW-LBPRGKRZSA-N	0	3	329.425	3.308	20	30		EGEDHN
N#Cc1cccc(COc2cccc(CNCCc3cnccn3)c2)c1	ZINC000341259104	141145721	/nfs/dbraw/zinc/14/57/21/141145721.db2.gz	AVKZCHCQANYSLI-UHFFFAOYSA-N	0	3	344.418	3.260	20	30		EGEDHN
N#Cc1ccc(OCCCN2CCC(O)(c3ccccc3)CC2)cc1	ZINC000185472158	144113347	/nfs/dbraw/zinc/11/33/47/144113347.db2.gz	TYAMEFSVPCTYRJ-UHFFFAOYSA-N	0	3	336.435	3.311	20	30		EGEDHN
COc1cc(C#N)ccc1CN(Cc1ccccc1)[C@@H](CO)C1CC1	ZINC000121587516	152359693	/nfs/dbraw/zinc/35/96/93/152359693.db2.gz	PYASIKAZFGFFKC-FQEVSTJZSA-N	0	3	336.435	3.340	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H](O)COc1ccccc1Cl	ZINC000192706727	153254080	/nfs/dbraw/zinc/25/40/80/153254080.db2.gz	JHVMVTAFGXNSQO-INIZCTEOSA-N	0	3	330.815	3.083	20	30		EGEDHN
C[C@@H](NCCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(C#N)cc1	ZINC000336964657	154248087	/nfs/dbraw/zinc/24/80/87/154248087.db2.gz	IHHLOVKKSNHEAK-CYBMUJFWSA-N	0	3	338.367	3.146	20	30		EGEDHN
CN(C)CCN(c1nc(C(F)(F)F)ccc1C#N)C1CCCC1	ZINC000339968248	155055390	/nfs/dbraw/zinc/05/53/90/155055390.db2.gz	WGEGQJPKEVBMPE-UHFFFAOYSA-N	0	3	326.366	3.283	20	30		EGEDHN
C[C@H]1CCN(C)CCN1C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1	ZINC000345441416	156106391	/nfs/dbraw/zinc/10/63/91/156106391.db2.gz	OXABVZOAMJAGMT-NSHDSACASA-N	0	3	340.349	3.135	20	30		EGEDHN
CCN1C[C@@H](C)N(Cc2ccc(Br)cc2C#N)C[C@@H]1C	ZINC000346979491	156228841	/nfs/dbraw/zinc/22/88/41/156228841.db2.gz	LQXVCACWOAVJSU-QWHCGFSZSA-N	0	3	336.277	3.235	20	30		EGEDHN
CC(C)n1nccc1CN[C@H]1CCCN(c2ccc(C#N)cc2F)C1	ZINC000365434624	157123028	/nfs/dbraw/zinc/12/30/28/157123028.db2.gz	ZLKBTZJMADDGKI-INIZCTEOSA-N	0	3	341.434	3.233	20	30		EGEDHN
Cc1ccc2c(c1)[C@H]1CN(C)CC[C@@H]1N2C(=O)c1cccc(C#N)c1	ZINC000072673026	292369582	/nfs/dbraw/zinc/36/95/82/292369582.db2.gz	IHDKNOVCDDJDNJ-QUCCMNQESA-N	0	3	331.419	3.315	20	30		EGEDHN
C[C@@H](NCCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccc(C#N)cc1	ZINC000338347000	163218197	/nfs/dbraw/zinc/21/81/97/163218197.db2.gz	DIWZCYWMKRFLOP-CYBMUJFWSA-N	0	3	338.367	3.146	20	30		EGEDHN
CN(C)Cc1cccc(NC(=O)c2cnc(C(F)(F)F)c(C#N)c2)c1	ZINC000338862107	163366746	/nfs/dbraw/zinc/36/67/46/163366746.db2.gz	CJGVQGOFHFLNQS-UHFFFAOYSA-N	0	3	348.328	3.286	20	30		EGEDHN
CN(CC1CCN(c2ccncc2)CC1)C(=O)c1cscc1C#N	ZINC000344572977	164190060	/nfs/dbraw/zinc/19/00/60/164190060.db2.gz	NSTSJPJOGSISIF-UHFFFAOYSA-N	0	3	340.452	3.003	20	30		EGEDHN
N#Cc1cc(F)cc(OC[C@@H]2CN(Cc3ccccc3)CCCO2)c1	ZINC000352043065	165207053	/nfs/dbraw/zinc/20/70/53/165207053.db2.gz	ZMRNKUMYROEQFZ-FQEVSTJZSA-N	0	3	340.398	3.367	20	30		EGEDHN
C[C@H](CN1CCC[C@H](C)C1)NC(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000352283033	165325086	/nfs/dbraw/zinc/32/50/86/165325086.db2.gz	ZPGMAIHBCXUBKE-QWHCGFSZSA-N	0	3	334.851	3.454	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)NC[C@@H](C)N1CCCC[C@H]1C	ZINC000352400086	165381263	/nfs/dbraw/zinc/38/12/63/165381263.db2.gz	BJGQLRBIVCJSDE-HUUCEWRRSA-N	0	3	344.459	3.341	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)[C@@H]1CCC(C)(C)C1	ZINC000358996406	167031823	/nfs/dbraw/zinc/03/18/23/167031823.db2.gz	WZVZJQQZKWQKLT-GOSISDBHSA-N	0	3	327.472	3.275	20	30		EGEDHN
C[C@H]1COc2ccccc2CN1CCC(=O)Nc1cccc(C#N)c1	ZINC000359862989	167252634	/nfs/dbraw/zinc/25/26/34/167252634.db2.gz	SNACJJMXWYSWFB-HNNXBMFYSA-N	0	3	335.407	3.170	20	30		EGEDHN
N#Cc1ccc(Br)c(CN2CC[C@H]([C@H]3CCOC3)C2)c1	ZINC000365192972	168033281	/nfs/dbraw/zinc/03/32/81/168033281.db2.gz	YTEVJGPJBRIWOZ-KBPBESRZSA-N	0	3	335.245	3.179	20	30		EGEDHN
COc1ccc(CN(C)C)cc1NC(=O)/C=C\c1cccc(C#N)c1	ZINC000490983434	269778113	/nfs/dbraw/zinc/77/81/13/269778113.db2.gz	WYVHVXRHQGOSPV-NTMALXAHSA-N	0	3	335.407	3.280	20	30		EGEDHN
C[C@@H](N[C@@H]1CCc2ccc(C#N)cc21)[C@H](C)NC(=O)OC(C)(C)C	ZINC000496559855	269845319	/nfs/dbraw/zinc/84/53/19/269845319.db2.gz	TYQBHBUZKMHIKD-IIYDPXPESA-N	0	3	329.444	3.437	20	30		EGEDHN
N#Cc1ccc(CN[C@H]([C@@H](CO)C2CC2)C2CC2)c(OC(F)F)c1	ZINC000451604175	269962283	/nfs/dbraw/zinc/96/22/83/269962283.db2.gz	KDHMCWBVJRNDIY-RDJZCZTQSA-N	0	3	336.382	3.046	20	30		EGEDHN
N#Cc1ccccc1CSCC[NH2+]Cc1cc2c(cc1[O-])OCO2	ZINC000171128804	269974872	/nfs/dbraw/zinc/97/48/72/269974872.db2.gz	WFCDVCVAYVPNRG-UHFFFAOYSA-N	0	3	342.420	3.016	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N(CCC(F)(F)F)CC2CC2)cc1	ZINC000280207353	270039793	/nfs/dbraw/zinc/03/97/93/270039793.db2.gz	UXKIISWKLMFPHE-INIZCTEOSA-N	0	3	349.356	3.432	20	30		EGEDHN
Cc1cccc(O[C@H](C)CNC(=O)C(C#N)Cc2ccc(C#N)cc2)c1	ZINC000280441115	270039870	/nfs/dbraw/zinc/03/98/70/270039870.db2.gz	NAYWMJBLJBZSAJ-APWZRJJASA-N	0	3	347.418	3.133	20	30		EGEDHN
Cc1cccc(OC[C@@H](C)NC(=O)C(C#N)Cc2ccc(C#N)cc2)c1	ZINC000279291181	270039892	/nfs/dbraw/zinc/03/98/92/270039892.db2.gz	LCENJIJILCAXBC-VQIMIIECSA-N	0	3	347.418	3.133	20	30		EGEDHN
COc1ccc([C@H](CNc2cccc(F)c2C#N)N(C)C)cc1OC	ZINC000301055432	270043416	/nfs/dbraw/zinc/04/34/16/270043416.db2.gz	BDMYIRZJOLNCQK-KRWDZBQOSA-N	0	3	343.402	3.429	20	30		EGEDHN
CSc1ccc(OC[C@H](O)CN(C)Cc2cccc(C#N)c2)cc1	ZINC000411132074	270046860	/nfs/dbraw/zinc/04/68/60/270046860.db2.gz	KQACDFVWNCDCAZ-QGZVFWFLSA-N	0	3	342.464	3.152	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)c1F	ZINC000425499094	270049354	/nfs/dbraw/zinc/04/93/54/270049354.db2.gz	IEQXDVSVKFZEAH-AZUAARDMSA-N	0	3	335.426	3.404	20	30		EGEDHN
N#Cc1ccccc1COc1cccc(CN[C@@H](CO)CC(F)F)c1	ZINC000428642350	270049990	/nfs/dbraw/zinc/04/99/90/270049990.db2.gz	HIEGDTBMDGRFJQ-QGZVFWFLSA-N	0	3	346.377	3.243	20	30		EGEDHN
CCc1cccc(OCCN2CC[C@@H](Oc3ccc(C#N)cn3)C2)c1	ZINC000428802673	270050300	/nfs/dbraw/zinc/05/03/00/270050300.db2.gz	DKOZBLVUPNVWLU-LJQANCHMSA-N	0	3	337.423	3.048	20	30		EGEDHN
N#Cc1ccc(Br)c(CN2CCC[C@@H]2[C@@H]2CCC[C@H]2O)c1	ZINC000451419407	270053628	/nfs/dbraw/zinc/05/36/28/270053628.db2.gz	LGLLKRMLMQEFHY-USXIJHARSA-N	0	3	349.272	3.446	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CN1CCC=C(c2ccccc2)C1	ZINC000528496884	270060103	/nfs/dbraw/zinc/06/01/03/270060103.db2.gz	KMTKTDJFFCXLCF-FQEVSTJZSA-N	0	3	334.419	3.087	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CN1CCC[C@@H]1c1ccsc1	ZINC000528350213	270060146	/nfs/dbraw/zinc/06/01/46/270060146.db2.gz	LSKKFLOWSKMREV-DLBZAZTESA-N	0	3	328.437	3.197	20	30		EGEDHN
CCCN(C)[C@@H](CNC(=O)c1c[nH]c(C#N)c1)c1ccc(Cl)cc1	ZINC000286597466	266045058	/nfs/dbraw/zinc/04/50/58/266045058.db2.gz	WGFIHRPGLKGAEL-KRWDZBQOSA-N	0	3	344.846	3.353	20	30		EGEDHN
CCOc1cc(C)ccc1CNC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000348350346	266308183	/nfs/dbraw/zinc/30/81/83/266308183.db2.gz	NRWRUKYVHODSHG-IBGZPJMESA-N	0	3	347.418	3.264	20	30		EGEDHN
C[C@H](Cc1ccccc1F)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000279378176	267167745	/nfs/dbraw/zinc/16/77/45/267167745.db2.gz	SMMWNTDGARUGJF-RDTXWAMCSA-N	0	3	335.382	3.127	20	30		EGEDHN
CC[C@@H](NCc1cccc(NS(C)(=O)=O)c1)c1ccc(C#N)cc1	ZINC000447535775	267195223	/nfs/dbraw/zinc/19/52/23/267195223.db2.gz	IIDJKBFUPIROMX-GOSISDBHSA-N	0	3	343.452	3.171	20	30		EGEDHN
CC[C@@H]1CCC[C@@H]1C(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000448816191	267201661	/nfs/dbraw/zinc/20/16/61/267201661.db2.gz	NDONCXHRVBYVKL-MOPGFXCFSA-N	0	3	327.472	3.275	20	30		EGEDHN
CN(C[C@H]1CCCN1C)c1c(C#N)cnc2c(F)c(F)c(F)cc21	ZINC000420636353	267310379	/nfs/dbraw/zinc/31/03/79/267310379.db2.gz	NDEYPTSIIKHMHV-LLVKDONJSA-N	0	3	334.345	3.054	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@]12C[C@H]1CN(C(=O)OC(C)(C)C)C2	ZINC000497128994	267319225	/nfs/dbraw/zinc/31/92/25/267319225.db2.gz	KSRQCHNCCMJXCH-PXNSSMCTSA-N	0	3	341.455	3.247	20	30		EGEDHN
CN1CCC(Oc2ccc(CNc3ncc(C#N)cc3F)cc2)CC1	ZINC000413297831	267333482	/nfs/dbraw/zinc/33/34/82/267333482.db2.gz	RTEUNCVBSJBFNM-UHFFFAOYSA-N	0	3	340.402	3.177	20	30		EGEDHN
Cc1cc(N2CCN(C)CC2)ccc1NCc1ccc(C#N)cc1F	ZINC000269396668	267338169	/nfs/dbraw/zinc/33/81/69/267338169.db2.gz	FDAMRUXUUKMXFN-UHFFFAOYSA-N	0	3	338.430	3.370	20	30		EGEDHN
Cc1ccc(C#N)cc1NC(=O)N1CCN(C2CCC2)C[C@H](C)C1	ZINC000292623968	267383947	/nfs/dbraw/zinc/38/39/47/267383947.db2.gz	NCPKALAUVUZOKG-AWEZNQCLSA-N	0	3	326.444	3.205	20	30		EGEDHN
C[C@H](CCCc1cccnc1)N[C@H](C)C(=O)Nc1ccccc1C#N	ZINC000459631083	267819389	/nfs/dbraw/zinc/81/93/89/267819389.db2.gz	BCBGIFRRWRFKAB-HZPDHXFCSA-N	0	3	336.439	3.281	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)C[C@@H](O)COc1cccc2[nH]ccc21	ZINC000425541254	267864009	/nfs/dbraw/zinc/86/40/09/267864009.db2.gz	WIMOLLBFAPTQEW-CRAIPNDOSA-N	0	3	349.434	3.472	20	30		EGEDHN
Cc1ccc(NC(=O)CCN(Cc2ccc(C#N)cc2)C2CC2)nc1	ZINC000447175544	268038476	/nfs/dbraw/zinc/03/84/76/268038476.db2.gz	GSOYQYNMVKKQFE-UHFFFAOYSA-N	0	3	334.423	3.255	20	30		EGEDHN
Cc1cccc([C@H](C)CNCCS(=O)(=O)c2ccc(C#N)cc2)c1	ZINC000515347848	268057414	/nfs/dbraw/zinc/05/74/14/268057414.db2.gz	OVXADVGGPORKRO-MRXNPFEDSA-N	0	3	342.464	3.034	20	30		EGEDHN
Cc1cccc([C@H]2CCCN2C[C@@H](O)COc2ccc(C#N)cc2)c1	ZINC000515508725	268057442	/nfs/dbraw/zinc/05/74/42/268057442.db2.gz	JMIPHTZZUUBNHQ-TZIWHRDSSA-N	0	3	336.435	3.444	20	30		EGEDHN
N#Cc1ccc(CNC(=O)CN[C@@H]2CCC[C@H]2c2ccccc2)cc1	ZINC000275674564	268068654	/nfs/dbraw/zinc/06/86/54/268068654.db2.gz	XUICREGDSVWLNM-VQTJNVASSA-N	0	3	333.435	3.100	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@@H]2CCOc3ccc(F)cc32)cc1	ZINC000280597114	268086840	/nfs/dbraw/zinc/08/68/40/268086840.db2.gz	WYLVKYLUFROSNH-MAUKXSAKSA-N	0	3	349.365	3.020	20	30		EGEDHN
Cn1cc(CN2CCC[C@@H](CCC(=O)OC(C)(C)C)C2)cc1C#N	ZINC000414553539	268126629	/nfs/dbraw/zinc/12/66/29/268126629.db2.gz	FZPOHXROMIDYMX-HNNXBMFYSA-N	0	3	331.460	3.231	20	30		EGEDHN
Cn1cc(CN2CCC[C@H](CCC(=O)OC(C)(C)C)C2)cc1C#N	ZINC000414553544	268127529	/nfs/dbraw/zinc/12/75/29/268127529.db2.gz	FZPOHXROMIDYMX-OAHLLOKOSA-N	0	3	331.460	3.231	20	30		EGEDHN
N#Cc1ccc(N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)nn1	ZINC000302001923	268163748	/nfs/dbraw/zinc/16/37/48/268163748.db2.gz	QTSSRDVEGATODV-HNNXBMFYSA-N	0	3	347.344	3.053	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(C/C=C/c3ccncc3)CC2)cc1	ZINC000495055654	268217112	/nfs/dbraw/zinc/21/71/12/268217112.db2.gz	ATKZWUDEXPOIED-HNQUOIGGSA-N	0	3	332.451	3.174	20	30		EGEDHN
N#Cc1ccc(CN2CCN(C[C@H]3C[C@H]3c3ccccc3)CC2)cc1	ZINC000506086561	268220678	/nfs/dbraw/zinc/22/06/78/268220678.db2.gz	PZHDEOGZPATHBU-YADHBBJMSA-N	0	3	331.463	3.480	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN2CCC[C@@]3(CCc4ccccc4O3)C2)cc1	ZINC000528737723	268263323	/nfs/dbraw/zinc/26/33/23/268263323.db2.gz	WSLQQNBGARFBSG-RBBKRZOGSA-N	0	3	348.446	3.451	20	30		EGEDHN
N#Cc1cccc(OC2CC[NH+](Cc3cc(F)ccc3[O-])CC2)c1	ZINC000179943660	268271275	/nfs/dbraw/zinc/27/12/75/268271275.db2.gz	QHHVBEPLQWOSIP-UHFFFAOYSA-N	0	3	326.371	3.446	20	30		EGEDHN
N#Cc1ccsc1N1CC[C@@H](N[C@@H](c2ccccc2)C2CC2)C1=O	ZINC000298974671	268304790	/nfs/dbraw/zinc/30/47/90/268304790.db2.gz	PGAZLLNQEGXVNI-SJORKVTESA-N	0	3	337.448	3.466	20	30		EGEDHN
N#Cc1ncc(NC(=O)NC[C@@H]2CCN2C2CCCCC2)cc1Cl	ZINC000529107320	268322522	/nfs/dbraw/zinc/32/25/22/268322522.db2.gz	AUKWEXNBEBPPRK-AWEZNQCLSA-N	0	3	347.850	3.135	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)C(=O)NCCN1CCC[C@@H](C)C1	ZINC000046378978	275136910	/nfs/dbraw/zinc/13/69/10/275136910.db2.gz	NNPJMLDAVNRSOF-QGZVFWFLSA-N	0	3	342.487	3.212	20	30		EGEDHN
CN(C)CCN(Cc1cccc(F)c1)C(=O)Nc1cccc(C#N)c1	ZINC000065984220	307360779	/nfs/dbraw/zinc/36/07/79/307360779.db2.gz	CXHBKKVBTRYAHP-UHFFFAOYSA-N	0	3	340.402	3.293	20	30		EGEDHN
CC(C)(C)OC1CCN(CCC(=O)Nc2cccc(C#N)c2)CC1	ZINC000164930868	307928640	/nfs/dbraw/zinc/92/86/40/307928640.db2.gz	OQDKDIHEKBGKJY-UHFFFAOYSA-N	0	3	329.444	3.166	20	30		EGEDHN
CN1CCC(N(Cc2ccco2)C(=O)/C=C\c2cccc(C#N)c2)CC1	ZINC000255556485	308053877	/nfs/dbraw/zinc/05/38/77/308053877.db2.gz	WAXBAHRLIJIMPY-FPLPWBNLSA-N	0	3	349.434	3.287	20	30		EGEDHN
CC(C)(C(=O)NCCN1CCCC(C)(C)C1)c1cc(F)cc(C#N)c1	ZINC000552550778	315224601	/nfs/dbraw/zinc/22/46/01/315224601.db2.gz	MYYOWXIVTDJNCT-UHFFFAOYSA-N	0	3	345.462	3.213	20	30		EGEDHN
N#Cc1cc(NC[C@@H](c2ccccc2Cl)N2CCCC2)ccn1	ZINC000552909494	315237241	/nfs/dbraw/zinc/23/72/41/315237241.db2.gz	DKTDOCRLPXGTLL-SFHVURJKSA-N	0	3	326.831	3.278	20	30		EGEDHN
N#Cc1cnn2cc(CNCCc3csc4ccccc34)cnc12	ZINC000559879713	315648220	/nfs/dbraw/zinc/64/82/20/315648220.db2.gz	ZNQHSPRXDLIVPD-UHFFFAOYSA-N	0	3	333.420	3.148	20	30		EGEDHN
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NCc1ccc(F)c(C#N)c1	ZINC000560182618	315666126	/nfs/dbraw/zinc/66/61/26/315666126.db2.gz	NFCUZOOXMIYFTE-KDOFPFPSSA-N	0	3	340.398	3.207	20	30		EGEDHN
C[C@@H]1C[C@H](C(C)(C)C)CCN1CC(=O)NCc1ccc(C#N)cc1	ZINC000570072173	317004437	/nfs/dbraw/zinc/00/44/37/317004437.db2.gz	QHICJOSIMVUYLK-CRAIPNDOSA-N	0	3	327.472	3.321	20	30		EGEDHN
C#CCCCCN[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl	ZINC000280113522	455895498	/nfs/dbraw/zinc/89/54/98/455895498.db2.gz	NTSRDWSQUXTFRX-JTQLQIEISA-N	0	3	349.283	3.095	20	30		EGEDHN
C=CCN1CC[C@@H](NC(C)(C)c2ccc(Br)cc2)C1=O	ZINC000337130523	456330145	/nfs/dbraw/zinc/33/01/45/456330145.db2.gz	BYWVMOZGSOHVMP-CQSZACIVSA-N	0	3	337.261	3.061	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@@H]1Nc1c(C#N)nnc2ccccc21	ZINC000389877178	324281002	/nfs/dbraw/zinc/28/10/02/324281002.db2.gz	VJHLABKIDQQKTD-YWZLYKJASA-N	0	3	343.434	3.434	20	30		EGEDHN
Cc1csc(NC(=O)N2CCN(C3CCCCC3)CC2)c1C#N	ZINC000575861491	324494519	/nfs/dbraw/zinc/49/45/19/324494519.db2.gz	RCJHYZSCSCKYLK-UHFFFAOYSA-N	0	3	332.473	3.410	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@@H](NCCc1nnc(-c3ccccc3)o1)CC2	ZINC000579043071	325053808	/nfs/dbraw/zinc/05/38/08/325053808.db2.gz	AMTGIQKYTNQMII-SFHVURJKSA-N	0	3	330.391	3.428	20	30		EGEDHN
N#Cc1ccc(S(=O)(=O)CCN[C@@H]2CC[C@@H]3CCCC[C@H]3C2)cc1	ZINC000579303504	325089544	/nfs/dbraw/zinc/08/95/44/325089544.db2.gz	KVFNRXIYWLPAQA-OKZBNKHCSA-N	0	3	346.496	3.280	20	30		EGEDHN
CC(C#N)C(=O)NCC1(c2ccc(Br)cc2Cl)CC1	ZINC000356712796	457129125	/nfs/dbraw/zinc/12/91/25/457129125.db2.gz	DKXOSOSYFDNUHI-VIFPVBQESA-N	0	3	341.636	3.410	20	30		EGEDHN
COc1cc(CNCC(C)(C)CC#N)cc(OC)c1OCC(F)F	ZINC000459730378	458461138	/nfs/dbraw/zinc/46/11/38/458461138.db2.gz	LUIUPSJLZNKREU-UHFFFAOYSA-N	0	3	342.386	3.377	20	30		EGEDHN
Cc1ccccc1[C@H](CC(C)C)NCC(=O)N[C@](C)(C#N)C1CC1	ZINC000183238819	455257909	/nfs/dbraw/zinc/25/79/09/455257909.db2.gz	QXPLUKAIJGGMJO-AZUAARDMSA-N	0	3	327.472	3.480	20	30		EGEDHN
C=CC[C@H](C)N[C@@H](C)c1ccc(S(=O)(=O)C(F)F)c(OC)c1	ZINC000180949482	455268464	/nfs/dbraw/zinc/26/84/64/455268464.db2.gz	UMRYHDDVIMWELX-QWRGUYRKSA-N	0	3	333.400	3.307	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@H](CO)C/C=C\C)cc1OC	ZINC000623495116	460580704	/nfs/dbraw/zinc/58/07/04/460580704.db2.gz	RDCOBMYQDHNKRG-SDQPKGBYSA-N	0	3	325.836	3.330	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/[C@@H](C)c2nnc3ccccn32)c([O-])c1	ZINC000015149780	453560282	/nfs/dbraw/zinc/56/02/82/453560282.db2.gz	XXWFHHRMCHBUGV-ZXOFLVKFSA-N	0	3	337.427	3.461	20	30		EGEDHN
C[C@H](C1CC1)N(CC(=O)N[C@@](C)(C#N)C1CC1)Cc1ccccc1	ZINC000029842514	453831967	/nfs/dbraw/zinc/83/19/67/453831967.db2.gz	FQVAZZISMSYGFQ-QRWLVFNGSA-N	0	3	325.456	3.096	20	30		EGEDHN
C[C@H](C#N)CN(C)C(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1	ZINC000052582234	453838103	/nfs/dbraw/zinc/83/81/03/453838103.db2.gz	AOGPFJFDBSQPMP-IEBWSBKVSA-N	0	3	342.487	3.261	20	30		EGEDHN
C=CCN(CCC(=O)Nc1cc(N)ccc1F)Cc1ccccc1	ZINC000081648881	453900276	/nfs/dbraw/zinc/90/02/76/453900276.db2.gz	YRMZEFOFDYLEFF-UHFFFAOYSA-N	0	3	327.403	3.425	20	30		EGEDHN
Cc1nc(CNC2CCN(Cc3ccc(C#N)cc3)CC2)sc1C	ZINC000181842285	455388600	/nfs/dbraw/zinc/38/86/00/455388600.db2.gz	ICCZYDFFLOSQAI-UHFFFAOYSA-N	0	3	340.496	3.386	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)C1(C#N)CCCC1)c1cccc(OC)c1	ZINC000042002630	453988494	/nfs/dbraw/zinc/98/84/94/453988494.db2.gz	JMWMFPIPZDVETF-GOSISDBHSA-N	0	3	343.471	3.278	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000068216916	454008454	/nfs/dbraw/zinc/00/84/54/454008454.db2.gz	PCPQKRWWVQJADB-DOTOQJQBSA-N	0	3	331.435	3.046	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)C=C1CCCCC1	ZINC000056016075	454033485	/nfs/dbraw/zinc/03/34/85/454033485.db2.gz	OAWDSNWVIHSSFU-UHFFFAOYSA-N	0	3	325.456	3.339	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N(C)[C@@H](C)c1ccccn1)C(C)C	ZINC000068583901	454039907	/nfs/dbraw/zinc/03/99/07/454039907.db2.gz	CWDPCGYENCMTDM-PKOBYXMFSA-N	0	3	344.503	3.483	20	30		EGEDHN
N#Cc1ccccc1-c1ccc(CN2CCC(CC(N)=O)CC2)cc1	ZINC000077168577	454070023	/nfs/dbraw/zinc/07/00/23/454070023.db2.gz	HUOSRWSYNRZWAW-UHFFFAOYSA-N	0	3	333.435	3.313	20	30		EGEDHN
N#Cc1nnc2ccccc2c1N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000077486153	454112003	/nfs/dbraw/zinc/11/20/03/454112003.db2.gz	SLINKWHJLIDRFA-MRXNPFEDSA-N	0	3	329.407	3.188	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Nc1ccc2c(c1)OCO2)C(C)C	ZINC000045030088	454134190	/nfs/dbraw/zinc/13/41/90/454134190.db2.gz	AJRINBXMZHLFKL-INIZCTEOSA-N	0	3	345.443	3.235	20	30		EGEDHN
N#Cc1ccc(CNC(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1	ZINC000077789945	454157304	/nfs/dbraw/zinc/15/73/04/454157304.db2.gz	XOZOISWYGGYYRI-HXUWFJFHSA-N	0	3	348.450	3.195	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCC2(C)Cc3ccccc3C2)CC1	ZINC000094033652	454183290	/nfs/dbraw/zinc/18/32/90/454183290.db2.gz	MVAIQGFNSROYNO-UHFFFAOYSA-N	0	3	341.499	3.131	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H](c2ccc(F)cc2F)C(C)C)CC1	ZINC000119289691	454184531	/nfs/dbraw/zinc/18/45/31/454184531.db2.gz	UIYWSMOZWUECKA-GOSISDBHSA-N	0	3	334.410	3.123	20	30		EGEDHN
Cc1ccc(N2CC[C@H](N[C@H](C)c3ccc(OCC#N)cc3)C2=O)cc1	ZINC000095404408	454204163	/nfs/dbraw/zinc/20/41/63/454204163.db2.gz	BSPIDVVDIRSPGK-UZLBHIALSA-N	0	3	349.434	3.354	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)[C@H]2C[C@H](OCC)C23CCC3)CC1	ZINC000119567871	454204643	/nfs/dbraw/zinc/20/46/43/454204643.db2.gz	HUQARQCGKAWJMW-ROUUACIJSA-N	0	3	349.519	3.016	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cnn([C@@H](C)CC)c2C2CC2)CC1	ZINC000089819960	454208065	/nfs/dbraw/zinc/20/80/65/454208065.db2.gz	ITLYYDVSQALSQX-AWEZNQCLSA-N	0	3	330.476	3.112	20	30		EGEDHN
C#CCCOc1ccc(CN2CCC(N(C)C(=O)OCC)CC2)cc1	ZINC000130859596	454222571	/nfs/dbraw/zinc/22/25/71/454222571.db2.gz	LYMKSFIEWPDRRY-UHFFFAOYSA-N	0	3	344.455	3.141	20	30		EGEDHN
N#CC(C(=O)[C@@H]1CCCN(C(=O)C2CC2)C1)c1ccc2ccccc2n1	ZINC000089873126	454222936	/nfs/dbraw/zinc/22/29/36/454222936.db2.gz	RGTXGXKAEROICO-IAGOWNOFSA-N	0	3	347.418	3.060	20	30		EGEDHN
CCn1cc([C@@H](C)N[C@H]2CCCN(c3ccc(C#N)cc3F)C2)cn1	ZINC000160170005	455434419	/nfs/dbraw/zinc/43/44/19/455434419.db2.gz	UZFHKKQXDGEUBR-PBHICJAKSA-N	0	3	341.434	3.233	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)Nc1ccc(CCN2CCSCC2)cc1	ZINC000061287010	454334955	/nfs/dbraw/zinc/33/49/55/454334955.db2.gz	JRBWDHAHWJBDIO-INIZCTEOSA-N	0	3	348.512	3.198	20	30		EGEDHN
C=CCOc1cccc(NC(=O)N(CCN(C)C)Cc2ccco2)c1	ZINC000132467545	454341632	/nfs/dbraw/zinc/34/16/32/454341632.db2.gz	BDVFNVRBIHXPFT-UHFFFAOYSA-N	0	3	343.427	3.440	20	30		EGEDHN
N#Cc1ccc(CNC(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1	ZINC000047949039	454423544	/nfs/dbraw/zinc/42/35/44/454423544.db2.gz	RTOQLXYZZBQMFZ-HXUWFJFHSA-N	0	3	348.450	3.195	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CN[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000133754829	454464267	/nfs/dbraw/zinc/46/42/67/454464267.db2.gz	GKLCUJXTSNARDN-HZPDHXFCSA-N	0	3	325.437	3.484	20	30		EGEDHN
C=CCNC(=O)Nc1ccc(NC(=O)[C@H](C)N2[C@H](C)CC[C@H]2C)cc1	ZINC000101635364	454477848	/nfs/dbraw/zinc/47/78/48/454477848.db2.gz	WUGJMSCMQGNJHU-KFWWJZLASA-N	0	3	344.459	3.194	20	30		EGEDHN
CCCCn1ncc(C(=O)C(C#N)c2nc3ccccc3n2C)c1C	ZINC000121867955	454487258	/nfs/dbraw/zinc/48/72/58/454487258.db2.gz	LRGFNIPPXBQNBM-CQSZACIVSA-N	0	3	335.411	3.368	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN(CCCO)Cc2cccc(Cl)c2)cc1	ZINC000134293121	454524161	/nfs/dbraw/zinc/52/41/61/454524161.db2.gz	MOAIARRZPVJJFN-LJQANCHMSA-N	0	3	344.842	3.130	20	30		EGEDHN
Cc1nnc(N[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)c(C#N)c1C	ZINC000080230633	454552847	/nfs/dbraw/zinc/55/28/47/454552847.db2.gz	ZXJKOQPIYLCZMP-RDTXWAMCSA-N	0	3	335.455	3.430	20	30		EGEDHN
COc1ccc(CN(C)C[C@H]2CCCCO2)cc1OCCCC#N	ZINC000092428672	454565293	/nfs/dbraw/zinc/56/52/93/454565293.db2.gz	YNQSGLFFPXHXHG-QGZVFWFLSA-N	0	3	332.444	3.379	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)CN[C@@H](c1ccc(F)cc1)C1CCC1	ZINC000104706115	454596427	/nfs/dbraw/zinc/59/64/27/454596427.db2.gz	NCAREDPPXXZWNF-MOPGFXCFSA-N	0	3	331.435	3.311	20	30		EGEDHN
COc1ccc(C#N)cc1CN1CC[C@H]2[C@H](CCCN2C2CC2)C1	ZINC000134937627	454612511	/nfs/dbraw/zinc/61/25/11/454612511.db2.gz	RZBFHINETHNWIM-APWZRJJASA-N	0	3	325.456	3.016	20	30		EGEDHN
C[C@H]1CN(CCCCNc2ccc3cc(C#N)ccc3n2)C[C@H](C)O1	ZINC000092920675	454654391	/nfs/dbraw/zinc/65/43/91/454654391.db2.gz	HPLLXXXJZZERNB-HOTGVXAUSA-N	0	3	338.455	3.408	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(NC(=O)C(C)C)cc2)CC1	ZINC000106036726	454674765	/nfs/dbraw/zinc/67/47/65/454674765.db2.gz	IOTZUNTWHKGUGJ-UHFFFAOYSA-N	0	3	343.471	3.051	20	30		EGEDHN
CC(C)c1nccc(N2CCCN(Cc3ccc(C#N)cc3)CC2)n1	ZINC000106463370	454695381	/nfs/dbraw/zinc/69/53/81/454695381.db2.gz	NYTHVEHUQHBSAQ-UHFFFAOYSA-N	0	3	335.455	3.184	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)CC1=CCCCC1	ZINC000106619845	454706478	/nfs/dbraw/zinc/70/64/78/454706478.db2.gz	QZCKRDONHQKJKD-UHFFFAOYSA-N	0	3	325.456	3.339	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)CC1=CCCCC1	ZINC000106756617	454717412	/nfs/dbraw/zinc/71/74/12/454717412.db2.gz	JMHSEIWFHSUIIR-UHFFFAOYSA-N	0	3	325.456	3.339	20	30		EGEDHN
C=C(C)COCCNCc1ccc(-c2ccccc2C(=O)OC)o1	ZINC000152768303	454723755	/nfs/dbraw/zinc/72/37/55/454723755.db2.gz	NBOZDXTYHIGEMQ-UHFFFAOYSA-N	0	3	329.396	3.416	20	30		EGEDHN
Cc1cc(C)cc(N(CCC#N)C(=O)CN2C[C@H]3CCC[C@@H]3C2)c1	ZINC000152811986	454729390	/nfs/dbraw/zinc/72/93/90/454729390.db2.gz	TUWDMTVILMIZIS-QZTJIDSGSA-N	0	3	325.456	3.282	20	30		EGEDHN
C=C(C)COc1cc(CN2CC[C@](C)(C(=O)OC)C2)ccc1OC	ZINC000093814097	454736104	/nfs/dbraw/zinc/73/61/04/454736104.db2.gz	CPVKAMJPTCTZNS-IBGZPJMESA-N	0	3	333.428	3.035	20	30		EGEDHN
N#CCCn1cc(CN2CC[C@]3(CCOC3)C2)c(-c2ccccc2)n1	ZINC000093820026	454738285	/nfs/dbraw/zinc/73/82/85/454738285.db2.gz	DDZXQEJFYRVUMR-FQEVSTJZSA-N	0	3	336.439	3.076	20	30		EGEDHN
CN1CCCN(c2ccc(NC(=O)c3cc(C#N)cs3)cc2)CC1	ZINC000176960155	454804379	/nfs/dbraw/zinc/80/43/79/454804379.db2.gz	DSWFCWCFWUDASB-UHFFFAOYSA-N	0	3	340.452	3.014	20	30		EGEDHN
C[C@@H](c1ccc(-n2cncn2)cc1)N(C)Cc1ccc(F)c(C#N)c1	ZINC000160565722	455474558	/nfs/dbraw/zinc/47/45/58/455474558.db2.gz	HDMSCVJCVSWSKJ-AWEZNQCLSA-N	0	3	335.386	3.471	20	30		EGEDHN
CC[C@H](NCCS(=O)(=O)c1ccc(C#N)cc1)c1cccs1	ZINC000163149578	454825527	/nfs/dbraw/zinc/82/55/27/454825527.db2.gz	PADDKKIOMJCYDN-HNNXBMFYSA-N	0	3	334.466	3.134	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN1CCS[C@H]2CCCC[C@@H]21	ZINC000177185681	454833471	/nfs/dbraw/zinc/83/34/71/454833471.db2.gz	GSEHKYFOVYOAPM-KBPBESRZSA-N	0	3	335.498	3.308	20	30		EGEDHN
CC(C)CCO[C@@H]1CCN(CCC(=O)Nc2sccc2C#N)C1	ZINC000177377551	454858613	/nfs/dbraw/zinc/85/86/13/454858613.db2.gz	RQSGQEHRYJUSMH-OAHLLOKOSA-N	0	3	335.473	3.085	20	30		EGEDHN
CCN1CCCC[C@@H]1C(=O)NCC#Cc1ccc(C(F)(F)F)cc1	ZINC000175717654	455486592	/nfs/dbraw/zinc/48/65/92/455486592.db2.gz	KYJBMECVIRBOSN-MRXNPFEDSA-N	0	3	338.373	3.048	20	30		EGEDHN
C#CCCOc1ccc(CNCc2ccc(-n3ccnc3C)nc2)cc1	ZINC000113325176	454923107	/nfs/dbraw/zinc/92/31/07/454923107.db2.gz	BKSJQBATPBBTGF-UHFFFAOYSA-N	0	3	346.434	3.268	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)[C@@H]2CCc3ccccc3C2)CC1	ZINC000114596600	454963964	/nfs/dbraw/zinc/96/39/64/454963964.db2.gz	IBIGEPYFAAJMTA-HXUWFJFHSA-N	0	3	341.499	3.226	20	30		EGEDHN
N#CC1(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)CCCCC1	ZINC000114642413	454965598	/nfs/dbraw/zinc/96/55/98/454965598.db2.gz	MBMWIYIJQXIWFC-SFHVURJKSA-N	0	3	325.456	3.241	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H]2C[C@H]2c2c(F)cccc2F)CC1	ZINC000116194022	455047274	/nfs/dbraw/zinc/04/72/74/455047274.db2.gz	YDWQZSRUZKLCMA-HUUCEWRRSA-N	0	3	334.410	3.225	20	30		EGEDHN
C[C@H]1CCC[C@@](C#N)(NC(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000116798504	455068739	/nfs/dbraw/zinc/06/87/39/455068739.db2.gz	COSULTPVVSZWDY-OXJNMPFZSA-N	0	3	325.456	3.485	20	30		EGEDHN
C#CCCOc1ccc(CN[C@@H](CCO)c2ccc(OC)cc2)cc1	ZINC000128785610	455083683	/nfs/dbraw/zinc/08/36/83/455083683.db2.gz	LGSDMYRZARQHGE-NRFANRHFSA-N	0	3	339.435	3.311	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC(c3ccccc3)CC2)CC1	ZINC000171736683	455090376	/nfs/dbraw/zinc/09/03/76/455090376.db2.gz	VWRISQFKQYIIIE-UHFFFAOYSA-N	0	3	327.472	3.226	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@@H]2CCc2ccccc2)CC1	ZINC000171740417	455091061	/nfs/dbraw/zinc/09/10/61/455091061.db2.gz	JTEQJMASZPOWOK-HXUWFJFHSA-N	0	3	341.499	3.444	20	30		EGEDHN
COc1ccc(F)cc1[C@H](C)NCCC(=O)Nc1ccc(C#N)cc1	ZINC000179938135	455102365	/nfs/dbraw/zinc/10/23/65/455102365.db2.gz	YYKFATLNCHQEIR-ZDUSSCGKSA-N	0	3	341.386	3.385	20	30		EGEDHN
CC1CC[NH+](C2CCC(/N=C/c3ccc(O)c([O-])c3O)CC2)CC1	ZINC000129631647	455119430	/nfs/dbraw/zinc/11/94/30/455119430.db2.gz	RSEHGCBIMIHTMU-UDWIEESQSA-N	0	3	332.444	3.265	20	30		EGEDHN
N#CCCn1cc(CNCc2cccc(CO)c2)c(-c2ccccc2)n1	ZINC000172119695	455124913	/nfs/dbraw/zinc/12/49/13/455124913.db2.gz	AKASORIABDEPGU-UHFFFAOYSA-N	0	3	346.434	3.246	20	30		EGEDHN
C=C(C)CN(C)C(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1	ZINC000180434606	455168984	/nfs/dbraw/zinc/16/89/84/455168984.db2.gz	SGWGEOCOFLGVAY-KRWDZBQOSA-N	0	3	340.389	3.476	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCc2ccc3[nH]ccc3c2)CC1	ZINC000180480091	455177717	/nfs/dbraw/zinc/17/77/17/455177717.db2.gz	MLJDUNOPWRDMSW-UHFFFAOYSA-N	0	3	325.456	3.257	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2CNCc2ccc(C#N)o2)C[C@@H](C)O1	ZINC000237411773	455182959	/nfs/dbraw/zinc/18/29/59/455182959.db2.gz	ZCUYLSSYPBLUHD-HZPDHXFCSA-N	0	3	339.439	3.050	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](CC(C)(C)C)C(F)(F)F)CC1	ZINC000181160480	455296992	/nfs/dbraw/zinc/29/69/92/455296992.db2.gz	BBYMUMORNZCZQV-ZDUSSCGKSA-N	0	3	335.414	3.303	20	30		EGEDHN
CN(C)[C@H]1CCCN(C(=O)c2cccc(Nc3ccc(C#N)cc3)c2)C1	ZINC000158443372	455303680	/nfs/dbraw/zinc/30/36/80/455303680.db2.gz	NJFGBMRLHDDMMF-FQEVSTJZSA-N	0	3	348.450	3.468	20	30		EGEDHN
C[C@@H](NCc1ccccc1CN1CCOCC1)c1cccc(C#N)c1	ZINC000181415772	455331898	/nfs/dbraw/zinc/33/18/98/455331898.db2.gz	VDHBDFGCAIPDGX-QGZVFWFLSA-N	0	3	335.451	3.241	20	30		EGEDHN
C[C@@H](NCCC(=O)N(C)CCC#N)c1ccc(Cl)c(Cl)c1	ZINC000181531957	455350880	/nfs/dbraw/zinc/35/08/80/455350880.db2.gz	JPLYOVFVPZYHMB-LLVKDONJSA-N	0	3	328.243	3.406	20	30		EGEDHN
C=CCc1cc(CNC[C@@](C)(O)c2cccs2)cc(OC)c1O	ZINC000265780723	455379869	/nfs/dbraw/zinc/37/98/69/455379869.db2.gz	OENXZGFFBBCLCY-GOSISDBHSA-N	0	3	333.453	3.188	20	30		EGEDHN
CC(C)(C#N)CCCN1CC[C@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000174841315	455415615	/nfs/dbraw/zinc/41/56/15/455415615.db2.gz	PBWYETSGDQVDMJ-INIZCTEOSA-N	0	3	332.423	3.351	20	30		EGEDHN
CN1CCC(NC(=O)Nc2ccccc2C#Cc2ccccc2)CC1	ZINC000175046671	455421675	/nfs/dbraw/zinc/42/16/75/455421675.db2.gz	DKQGJCLJERTTBC-UHFFFAOYSA-N	0	3	333.435	3.302	20	30		EGEDHN
Cc1cc(F)ccc1N1CCC[C@@H](NCc2cc(C#N)n(C)c2)C1	ZINC000191107647	455444491	/nfs/dbraw/zinc/44/44/91/455444491.db2.gz	BRLLSKMDVCFWSP-QGZVFWFLSA-N	0	3	326.419	3.103	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N[C@@H](CC)[C@@H]1CCCO1	ZINC000182300180	455482997	/nfs/dbraw/zinc/48/29/97/455482997.db2.gz	VDVAVZIEQBBOJH-XIRDDKMYSA-N	0	3	336.501	3.198	20	30		EGEDHN
CCCCNC(=O)[C@@H]1CC[C@H](C)N(Cc2ccc(F)c(C#N)c2)C1	ZINC000161003929	455523221	/nfs/dbraw/zinc/52/32/21/455523221.db2.gz	ZNRCLZVYFJTLDK-GOEBONIOSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H](C)c2cn(C)c3ccccc23)CC1	ZINC000185330980	455540965	/nfs/dbraw/zinc/54/09/65/455540965.db2.gz	NQVYQKZSFCSPKD-MRXNPFEDSA-N	0	3	339.483	3.439	20	30		EGEDHN
C[C@H]1CC/C(=C\C(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)C1	ZINC000267852825	455557078	/nfs/dbraw/zinc/55/70/78/455557078.db2.gz	LQAVDLCRDSODFM-HUCUOGIVSA-N	0	3	325.456	3.195	20	30		EGEDHN
CC#CCCCC(=O)Nc1ccc(N(C)C2CCN(C)CC2)cc1	ZINC000185436130	455558083	/nfs/dbraw/zinc/55/80/83/455558083.db2.gz	FAMDJHHCVKVSHX-UHFFFAOYSA-N	0	3	327.472	3.349	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N(CC)Cc1ccccn1)C(C)C	ZINC000267904646	455562452	/nfs/dbraw/zinc/56/24/52/455562452.db2.gz	WUGGUZVCSLLVIV-LJQANCHMSA-N	0	3	344.503	3.312	20	30		EGEDHN
CC[C@@H](Cc1ccccc1)N(CC)CC(=O)N[C@](C)(C#N)C1CC1	ZINC000247380739	455593372	/nfs/dbraw/zinc/59/33/72/455593372.db2.gz	IARZCMDPLDDGHO-AZUAARDMSA-N	0	3	327.472	3.138	20	30		EGEDHN
N#Cc1ccc(OCCN2CCC[C@@H]2C[C@H](O)c2ccco2)cc1	ZINC000268292121	455642177	/nfs/dbraw/zinc/64/21/77/455642177.db2.gz	RYOIKJCBPOGMAA-AEFFLSMTSA-N	0	3	326.396	3.118	20	30		EGEDHN
C[C@H]1CCC[C@H]1CC(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000185908245	455649388	/nfs/dbraw/zinc/64/93/88/455649388.db2.gz	ITKGGIBGHPMLQY-LPHOPBHVSA-N	0	3	327.472	3.275	20	30		EGEDHN
C=CCSCCN[C@@H](CC)c1ccccc1OCC(=O)N(C)C	ZINC000271545093	455679687	/nfs/dbraw/zinc/67/96/87/455679687.db2.gz	ZAJXXSMVFIAUAC-INIZCTEOSA-N	0	3	336.501	3.114	20	30		EGEDHN
N#C[C@H]1CCC[C@H](N[C@H]2CCCN(Cc3ccc(F)cc3F)C2=O)C1	ZINC000193343615	455754597	/nfs/dbraw/zinc/75/45/97/455754597.db2.gz	KPYVOGGMXRAVQD-OWQGQXMQSA-N	0	3	347.409	3.128	20	30		EGEDHN
Cn1cc(CN[C@H]2CCN(C)[C@H]2c2ccc(Cl)c(F)c2)cc1C#N	ZINC000249517989	455760448	/nfs/dbraw/zinc/76/04/48/455760448.db2.gz	KMZMHCLXSFZJQK-ROUUACIJSA-N	0	3	346.837	3.224	20	30		EGEDHN
CC[C@@H](NCc1ccc(OCCO)c(OC)c1)c1ccc(C#N)cc1	ZINC000278235742	455793260	/nfs/dbraw/zinc/79/32/60/455793260.db2.gz	KPLPXZMOVFONDI-GOSISDBHSA-N	0	3	340.423	3.179	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1occc1CSc1ccccc1	ZINC000293975534	455802141	/nfs/dbraw/zinc/80/21/41/455802141.db2.gz	MNNLWWPZMCYLIB-UHFFFAOYSA-N	0	3	342.464	3.257	20	30		EGEDHN
CCOC1CC(CON=C(N)c2cccc(CN3CCCCC3)c2)C1	ZINC000285215053	455806560	/nfs/dbraw/zinc/80/65/60/455806560.db2.gz	PTYCRQMUXYQEHU-UHFFFAOYSA-N	0	3	345.487	3.125	20	30		EGEDHN
C=CCOCCCC(=O)NC[C@H](c1ccc(SC)cc1)N(C)C	ZINC000294708487	455824794	/nfs/dbraw/zinc/82/47/94/455824794.db2.gz	GXBRKJWUMLLRQJ-QGZVFWFLSA-N	0	3	336.501	3.110	20	30		EGEDHN
CC[C@H](NCCCS(=O)(=O)c1ccccc1)c1ccc(C#N)cc1	ZINC000278363437	455829307	/nfs/dbraw/zinc/82/93/07/455829307.db2.gz	BOGAGEXPRILMAW-IBGZPJMESA-N	0	3	342.464	3.463	20	30		EGEDHN
N#C[C@H]1CCC[C@H](NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000295027596	455835709	/nfs/dbraw/zinc/83/57/09/455835709.db2.gz	OEZXVADJJAGPNP-ZFWWWQNUSA-N	0	3	340.876	3.176	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1C(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000278874253	455851004	/nfs/dbraw/zinc/85/10/04/455851004.db2.gz	VPFLBHNVVMBLFP-WOJBJXKFSA-N	0	3	342.483	3.057	20	30		EGEDHN
Cc1cc(C)nc(NCc2cn(CCC#N)nc2-c2ccncc2)c1	ZINC000278897602	455852533	/nfs/dbraw/zinc/85/25/33/455852533.db2.gz	YCOODZWUAYEAEY-UHFFFAOYSA-N	0	3	332.411	3.483	20	30		EGEDHN
CC[C@H](NCc1cccc(OCC(=O)OC)c1)c1ccc(C#N)cc1	ZINC000278895048	455853153	/nfs/dbraw/zinc/85/31/53/455853153.db2.gz	YWGJJHYISCTCJT-IBGZPJMESA-N	0	3	338.407	3.351	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000278918190	455853234	/nfs/dbraw/zinc/85/32/34/455853234.db2.gz	CRTNOXCTCKYZRH-VBSBHUPXSA-N	0	3	342.483	3.137	20	30		EGEDHN
CC[C@@H](NC[C@@H](O)c1ccc(C#N)cc1)c1ccc(OC)c(OC)c1	ZINC000285476968	455854256	/nfs/dbraw/zinc/85/42/56/455854256.db2.gz	OFLCTQARVFBPKL-QZTJIDSGSA-N	0	3	340.423	3.350	20	30		EGEDHN
CC(C)[C@H]1CN(c2c(C#N)cnc3c(F)ccc(F)c32)CCN1C	ZINC000617000664	460697517	/nfs/dbraw/zinc/69/75/17/460697517.db2.gz	GXQHHZBEFXYFPC-OAHLLOKOSA-N	0	3	330.382	3.161	20	30		EGEDHN
Cc1ccc(NC(=O)c2ccc(F)c(C#N)c2)c(OCCN(C)C)c1	ZINC000279369678	455863774	/nfs/dbraw/zinc/86/37/74/455863774.db2.gz	GVAXDOCHILSMLL-UHFFFAOYSA-N	0	3	341.386	3.199	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC[C@H](c3ccc(C)cc3C)C2)CC1	ZINC000279513708	455867257	/nfs/dbraw/zinc/86/72/57/455867257.db2.gz	LESZDKIUWRTBRI-SFHVURJKSA-N	0	3	341.499	3.453	20	30		EGEDHN
COc1ccc([C@@H](C)N[C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)cc1	ZINC000272188332	455870900	/nfs/dbraw/zinc/87/09/00/455870900.db2.gz	JRVMIFUYOWZANR-FOIQADDNSA-N	0	3	349.434	3.413	20	30		EGEDHN
COc1ccc(CN2CCC[C@](C)(O)CC2)cc1OCCCC#N	ZINC000279752904	455871992	/nfs/dbraw/zinc/87/19/92/455871992.db2.gz	YWUKPRUHVVBYCB-IBGZPJMESA-N	0	3	332.444	3.115	20	30		EGEDHN
CC(C)Oc1ccc(CNC(=O)C(C#N)Cc2ccc(C#N)cc2)cc1	ZINC000279837520	455874704	/nfs/dbraw/zinc/87/47/04/455874704.db2.gz	ZMTBOBQZEILUHV-IBGZPJMESA-N	0	3	347.418	3.344	20	30		EGEDHN
CC[C@H](NCc1ccc(C#N)o1)[C@@H](c1ccc(C)cc1)n1cncn1	ZINC000270097931	455876925	/nfs/dbraw/zinc/87/69/25/455876925.db2.gz	LLINSNRMKPQGRB-RBUKOAKNSA-N	0	3	335.411	3.209	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)c1ccc(CC#N)cc1	ZINC000270381755	455943712	/nfs/dbraw/zinc/94/37/12/455943712.db2.gz	PUCXIGOWDJKCQA-UWJYYQICSA-N	0	3	347.462	3.393	20	30		EGEDHN
N#CCCN(CCC#N)C(=O)CN[C@H](CC1CCC1)c1ccccc1	ZINC000272441265	455952049	/nfs/dbraw/zinc/95/20/49/455952049.db2.gz	BCVLRCBZFGMPRO-LJQANCHMSA-N	0	3	338.455	3.163	20	30		EGEDHN
CN1CCC[C@@]2(CCN(C(=O)Nc3ccc(C#N)c(Cl)c3)C2)C1	ZINC000296526095	455963537	/nfs/dbraw/zinc/96/35/37/455963537.db2.gz	HXANRKJIEWUXNQ-QGZVFWFLSA-N	0	3	332.835	3.161	20	30		EGEDHN
C[C@H](OC[C@H](O)CN1CCC(C)(C#N)CC1)c1ccc(Cl)cc1	ZINC000272505109	455973895	/nfs/dbraw/zinc/97/38/95/455973895.db2.gz	FEKJGWJUMJHZOD-WMLDXEAASA-N	0	3	336.863	3.404	20	30		EGEDHN
COC(=O)[C@H]1CCN(Cc2cccc(OCCCC#N)c2)C[C@H]1C	ZINC000188115719	456000799	/nfs/dbraw/zinc/00/07/99/456000799.db2.gz	BSEDVFSKDMNKTD-QAPCUYQASA-N	0	3	330.428	3.000	20	30		EGEDHN
COc1cc(CN(Cc2ccc(OCC#N)cc2)C2CC2)ccc1O	ZINC000270644091	456003479	/nfs/dbraw/zinc/00/34/79/456003479.db2.gz	QAADSTCQRARGMF-UHFFFAOYSA-N	0	3	338.407	3.468	20	30		EGEDHN
C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)N1CC(=O)N[C@](C)(C#N)C1CC1	ZINC000296660046	456004321	/nfs/dbraw/zinc/00/43/21/456004321.db2.gz	JVQTUTDWHPSLMD-DZJHOTPTSA-N	0	3	325.456	3.061	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000188215333	456023015	/nfs/dbraw/zinc/02/30/15/456023015.db2.gz	MJICULJIBWMTGW-NRFANRHFSA-N	0	3	344.499	3.039	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1CNCc1cc(OC)ccc1OC(F)F	ZINC000280666806	456026821	/nfs/dbraw/zinc/02/68/21/456026821.db2.gz	PLXMWLXKLOMIBQ-LRDDRELGSA-N	0	3	327.371	3.367	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@@H]1CNCc1cc(OC)ccc1OC(F)F	ZINC000280666809	456027313	/nfs/dbraw/zinc/02/73/13/456027313.db2.gz	PLXMWLXKLOMIBQ-MLGOLLRUSA-N	0	3	327.371	3.367	20	30		EGEDHN
CC(C)Cc1cccc([C@H](C)NCCNC(=O)C2N=CC=CC2=O)c1	ZINC000286345379	456028738	/nfs/dbraw/zinc/02/87/38/456028738.db2.gz	ZAWYGXWENPTYFH-DNTCVELPSA-N	0	3	341.455	3.062	20	30		EGEDHN
CC(C)Cc1cccc([C@@H](C)NCCNC(=O)C2N=CC=CC2=O)c1	ZINC000286345384	456029016	/nfs/dbraw/zinc/02/90/16/456029016.db2.gz	ZAWYGXWENPTYFH-MVZUJROASA-N	0	3	341.455	3.062	20	30		EGEDHN
C[C@H](C#N)Oc1ccccc1NC(=O)N1CC[C@@H](N2CCCCC2)C1	ZINC000272703309	456045478	/nfs/dbraw/zinc/04/54/78/456045478.db2.gz	VDPAVYOPTPSENF-HZPDHXFCSA-N	0	3	342.443	3.070	20	30		EGEDHN
CC[C@](C)(C#N)C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000286507650	456048239	/nfs/dbraw/zinc/04/82/39/456048239.db2.gz	QBTPDARSFKKBDZ-ILZDJORESA-N	0	3	327.472	3.438	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)N1CCC(N2CCc3ccccc3C2)CC1	ZINC000280870198	456069267	/nfs/dbraw/zinc/06/92/67/456069267.db2.gz	ZWWJOAHCQNFGGT-UHFFFAOYSA-N	0	3	349.434	3.123	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1CN[C@H](C)c1nnn(-c2ccc(F)cc2)c1C	ZINC000280928454	456086077	/nfs/dbraw/zinc/08/60/77/456086077.db2.gz	UWKNGJIVCLRUEC-MUKKUYKPSA-N	0	3	344.434	3.347	20	30		EGEDHN
C=CCS(=O)(=O)CCN[C@H]1CCCc2c3ccccc3sc21	ZINC000272887837	456102907	/nfs/dbraw/zinc/10/29/07/456102907.db2.gz	RYNLSUDDIZGCJC-HNNXBMFYSA-N	0	3	335.494	3.469	20	30		EGEDHN
C=C[C@@](C)(CC)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1	ZINC000289022224	456111806	/nfs/dbraw/zinc/11/18/06/456111806.db2.gz	VSRVTYWAOOSQHU-IBGZPJMESA-N	0	3	341.459	3.127	20	30		EGEDHN
C=C[C@H](CO)N[C@H](C)c1cccc(OCc2cn3ccccc3n2)c1	ZINC000289703127	456137632	/nfs/dbraw/zinc/13/76/32/456137632.db2.gz	ISESDPCHQVZTOE-NVXWUHKLSA-N	0	3	337.423	3.111	20	30		EGEDHN
C#Cc1ccc(CN2CCC(Oc3cncc(Cl)n3)CC2)cc1	ZINC000289746290	456139420	/nfs/dbraw/zinc/13/94/20/456139420.db2.gz	PPQWQYCVHYKZDM-UHFFFAOYSA-N	0	3	327.815	3.155	20	30		EGEDHN
CN(CCNc1ccc(C#N)cc1[N+](=O)[O-])Cc1ccc(F)cc1	ZINC000301579104	456151375	/nfs/dbraw/zinc/15/13/75/456151375.db2.gz	ZUGSDWUAWRHRRM-UHFFFAOYSA-N	0	3	328.347	3.149	20	30		EGEDHN
C=CCN1CC[C@@H](N[C@@H](C)c2ccc(OCC(F)(F)F)cc2)C1=O	ZINC000281219569	456169605	/nfs/dbraw/zinc/16/96/05/456169605.db2.gz	OJEJCDJFTZOKBG-SWLSCSKDSA-N	0	3	342.361	3.065	20	30		EGEDHN
C=CCc1cc(CN[C@H](CO)Cc2ccccc2C)cc(OC)c1O	ZINC000188940016	456177437	/nfs/dbraw/zinc/17/74/37/456177437.db2.gz	XCQUJRDZMFODRQ-IBGZPJMESA-N	0	3	341.451	3.131	20	30		EGEDHN
N#CCCCNCc1cc(Br)cc(Br)c1N	ZINC000274480802	456260391	/nfs/dbraw/zinc/26/03/91/456260391.db2.gz	ZZKPLVATCLQFEF-UHFFFAOYSA-N	0	3	347.054	3.187	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H]2C[C@@H](OCC)[C@]23CCCO3)cc1OC	ZINC000273544188	456237226	/nfs/dbraw/zinc/23/72/26/456237226.db2.gz	BOHHEYLHZKKWHI-AQNXPRMDSA-N	0	3	347.455	3.076	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000189192886	456251353	/nfs/dbraw/zinc/25/13/53/456251353.db2.gz	SQHPZXMLNOWXBP-TZIWHRDSSA-N	0	3	344.499	3.338	20	30		EGEDHN
C[C@@H](Oc1ccc(C#N)cc1)C(=O)Nc1ccccc1CCN(C)C	ZINC000275707575	456291834	/nfs/dbraw/zinc/29/18/34/456291834.db2.gz	UGHPIEIJKQSRBF-OAHLLOKOSA-N	0	3	337.423	3.068	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)NCc1c(C)onc1CC)C(C)C	ZINC000297851446	456309619	/nfs/dbraw/zinc/30/96/19/456309619.db2.gz	SUNNMKURANPELG-SFHVURJKSA-N	0	3	348.491	3.043	20	30		EGEDHN
C=CCN1CC[C@@H](N(Cc2ccc(OC)cc2)[C@@H](C)C2CC2)C1=O	ZINC000337143869	456329622	/nfs/dbraw/zinc/32/96/22/456329622.db2.gz	VVLPOOQBHNVWNZ-HNAYVOBHSA-N	0	3	328.456	3.083	20	30		EGEDHN
N#CC1(CCCN(Cc2ccco2)C[C@@H]2CCCO2)CCOCC1	ZINC000282084237	456409216	/nfs/dbraw/zinc/40/92/16/456409216.db2.gz	USLHTYMMNATOQS-SFHVURJKSA-N	0	3	332.444	3.361	20	30		EGEDHN
C=CCN1CC[C@H](N2CCCCC[C@H]2C[C@@H](O)c2cccs2)C1=O	ZINC000282134144	456422177	/nfs/dbraw/zinc/42/21/77/456422177.db2.gz	YYRMEZUIXKOFGO-YESZJQIVSA-N	0	3	348.512	3.203	20	30		EGEDHN
Oc1cc(CNCCOCC(F)(F)C(F)F)cc(C(F)(F)F)c1	ZINC000352945753	456422343	/nfs/dbraw/zinc/42/23/43/456422343.db2.gz	PRVRAHBQHABRBM-UHFFFAOYSA-N	0	3	349.246	3.418	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)nc(C)n1	ZINC000347972635	456433899	/nfs/dbraw/zinc/43/38/99/456433899.db2.gz	YICLHQPTTWQAPC-CYBMUJFWSA-N	0	3	330.731	3.145	20	30		EGEDHN
COC(=O)[C@H](C)Oc1ccc(CN[C@@H](C)c2ccc(C#N)cc2)cc1	ZINC000343156053	456439752	/nfs/dbraw/zinc/43/97/52/456439752.db2.gz	XBIFUTZLGZWIPX-GJZGRUSLSA-N	0	3	338.407	3.349	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)NC[C@@H](C)N1CCC[C@@H](C)C1	ZINC000303474410	456462411	/nfs/dbraw/zinc/46/24/11/456462411.db2.gz	OKXCDMZKOOXBMA-IAGOWNOFSA-N	0	3	345.487	3.171	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(Cc2ccccc2Cl)OC)CC1	ZINC000290959871	456478669	/nfs/dbraw/zinc/47/86/69/456478669.db2.gz	HOYIENSFQULISO-UHFFFAOYSA-N	0	3	337.851	3.063	20	30		EGEDHN
C=CCc1ccc(OC[C@@H](O)CN2CCCC3(CCC3)C2)c(OC)c1	ZINC000348166637	456514199	/nfs/dbraw/zinc/51/41/99/456514199.db2.gz	HOYKUHASZQKXLX-SFHVURJKSA-N	0	3	345.483	3.430	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000348223309	456545239	/nfs/dbraw/zinc/54/52/39/456545239.db2.gz	FDRXOOSPBQTUFX-IBGZPJMESA-N	0	3	345.402	3.122	20	30		EGEDHN
C[C@@H](NCc1cc(C#N)n(C)c1)[C@@H](O)c1c(Cl)cccc1Cl	ZINC000276676533	456549032	/nfs/dbraw/zinc/54/90/32/456549032.db2.gz	ZRVGYZIDEXPNBR-QLJPJBMISA-N	0	3	338.238	3.415	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N1CCN(C2CCC(C)CC2)CC1	ZINC000337804500	456556819	/nfs/dbraw/zinc/55/68/19/456556819.db2.gz	JYGKKADOFXQXFP-UHFFFAOYSA-N	0	3	325.456	3.203	20	30		EGEDHN
C=C[C@@H](C)NCc1cc(Br)cc(Br)c1N	ZINC000308842128	456573382	/nfs/dbraw/zinc/57/33/82/456573382.db2.gz	NSPUUANIAGGMKB-SSDOTTSWSA-N	0	3	334.055	3.458	20	30		EGEDHN
CO[C@H]1CCCC[C@H]1NCC(=O)N(CCC#N)c1cccc(C)c1C	ZINC000276892240	456612468	/nfs/dbraw/zinc/61/24/68/456612468.db2.gz	CDHQSYZNBBBLNN-MJGOQNOKSA-N	0	3	343.471	3.097	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccccc2N2CCCCCC2)CC1	ZINC000299341318	456660770	/nfs/dbraw/zinc/66/07/70/456660770.db2.gz	KHYQICHGJHGCOT-UHFFFAOYSA-N	0	3	339.483	3.351	20	30		EGEDHN
CO[C@H]1CCCC[C@@H]1NCC(=O)N(CCC#N)c1cccc(Cl)c1	ZINC000277065372	456668616	/nfs/dbraw/zinc/66/86/16/456668616.db2.gz	WLSXAYOFRWPIDP-IRXDYDNUSA-N	0	3	349.862	3.134	20	30		EGEDHN
N#Cc1cccc(CCN[C@H](Cc2ccccn2)c2cccnc2)c1	ZINC000343534631	456690167	/nfs/dbraw/zinc/69/01/67/456690167.db2.gz	NFFSTDCOVCGGOE-OAQYLSRUSA-N	0	3	328.419	3.464	20	30		EGEDHN
C=CCN(Cc1ccc(C#N)cc1)[C@@H](C)c1cccc(-n2cnnn2)c1	ZINC000353495240	456716005	/nfs/dbraw/zinc/71/60/05/456716005.db2.gz	HNDOAUWHOVEEEV-INIZCTEOSA-N	0	3	344.422	3.283	20	30		EGEDHN
Cc1ccn(CC(=O)NCCN2CCC3(CCCCC3)CC2)c(=O)c1	ZINC000328651270	456728774	/nfs/dbraw/zinc/72/87/74/456728774.db2.gz	BLDWOXDWUXGTOS-UHFFFAOYSA-N	0	3	345.487	3.160	20	30		EGEDHN
CC(C)(CC[NH+]1CCCCCC1)NC(=O)c1cc(F)cc2nn[n-]c21	ZINC000328661037	456731119	/nfs/dbraw/zinc/73/11/19/456731119.db2.gz	WKLLWQWVGRWWFX-UHFFFAOYSA-N	0	3	347.438	3.446	20	30		EGEDHN
CC(C)(CC[NH+]1CCCCCC1)NC(=O)c1cc(F)cc2[n-]nnc21	ZINC000328661037	456731125	/nfs/dbraw/zinc/73/11/25/456731125.db2.gz	WKLLWQWVGRWWFX-UHFFFAOYSA-N	0	3	347.438	3.446	20	30		EGEDHN
CC(C)(CC[NH+]1CCCCCC1)NC(=O)c1cc(F)cc2n[n-]nc21	ZINC000328661037	456731128	/nfs/dbraw/zinc/73/11/28/456731128.db2.gz	WKLLWQWVGRWWFX-UHFFFAOYSA-N	0	3	347.438	3.446	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2cn3c(n2)CCCC3)CN1Cc1ccccc1	ZINC000328714689	456744224	/nfs/dbraw/zinc/74/42/24/456744224.db2.gz	OEWYATMQUJCHCN-NVXWUHKLSA-N	0	3	338.455	3.187	20	30		EGEDHN
Cc1ccc([C@@H](CNC(=O)Nc2ccc(C#N)c(F)c2)N(C)C)cc1	ZINC000353557700	456759723	/nfs/dbraw/zinc/75/97/23/456759723.db2.gz	IBEQGKWMDNKAKE-GOSISDBHSA-N	0	3	340.402	3.430	20	30		EGEDHN
COc1cccc(CNC(=O)[C@H](C)N2CC[C@@H](C3CCOCC3)C2)c1	ZINC000328872856	456781232	/nfs/dbraw/zinc/78/12/32/456781232.db2.gz	YSFUHYXDQVFRDV-MAUKXSAKSA-N	0	3	346.471	3.289	20	30		EGEDHN
COc1cccc(OC)c1OCCCCN1CCC(F)(C#N)CC1	ZINC000343933395	456783731	/nfs/dbraw/zinc/78/37/31/456783731.db2.gz	GWOMTIDCPJAOML-UHFFFAOYSA-N	0	3	336.407	3.190	20	30		EGEDHN
CC(C)(C)c1cc(NC(=O)CN[C@@H]2CCC(=O)N[C@@H]2C2CC2)on1	ZINC000328913074	456788976	/nfs/dbraw/zinc/78/89/76/456788976.db2.gz	PHZBBVOSHWSSFP-BDJLRTHQSA-N	0	3	334.420	3.047	20	30		EGEDHN
Cc1cccc(C)c1NC(=O)CN1CCC[C@@H]1[C@H]1COCC[C@@]1(C)O	ZINC000328968287	456803321	/nfs/dbraw/zinc/80/33/21/456803321.db2.gz	NTAWRRWGSXOMMK-MBOZVWFJSA-N	0	3	346.471	3.143	20	30		EGEDHN
COc1cc(C)c(NC(=O)N2CCCC23CCN(C)CC3)cc1OC	ZINC000328998442	456809759	/nfs/dbraw/zinc/80/97/59/456809759.db2.gz	KMOCBCSIEVXUHJ-UHFFFAOYSA-N	0	3	347.459	3.118	20	30		EGEDHN
CC1(C)CC[C@@H](NC(=O)NCC2CCN(c3ccncc3)CC2)C1	ZINC000329149104	456844383	/nfs/dbraw/zinc/84/43/83/456844383.db2.gz	QHKMVDUPYCISOK-MRXNPFEDSA-N	0	3	330.476	3.380	20	30		EGEDHN
CCC1CCC(N(C)CC(=O)N[C@H](C)C(=O)N2CCCCC2)CC1	ZINC000329190358	456851576	/nfs/dbraw/zinc/85/15/76/456851576.db2.gz	RAQBRLWNMXQFGS-KLAILNCOSA-N	0	3	337.508	3.245	20	30		EGEDHN
CC(C)n1nccc1[C@H]1OCC[C@@H]1NC(=O)CN1[C@H](C)CC[C@@H]1C	ZINC000329205948	456853716	/nfs/dbraw/zinc/85/37/16/456853716.db2.gz	XGVRCIOWMUYQSD-KRXQYRFLSA-N	0	3	334.464	3.123	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@@H](C#N)CCc2ccccc2)CCN(C2CCC2)C1	ZINC000344770957	456856958	/nfs/dbraw/zinc/85/69/58/456856958.db2.gz	JIBRQVZFBRKSEF-PKOBYXMFSA-N	0	3	339.483	3.092	20	30		EGEDHN
C=CCNC(=O)CN[C@@H]1CCCCc2cc(Br)ccc21	ZINC000338777453	456857377	/nfs/dbraw/zinc/85/73/77/456857377.db2.gz	MVHKOKCJBMVYMB-OAHLLOKOSA-N	0	3	337.261	3.108	20	30		EGEDHN
C[C@H](NC(=O)[C@@H]1CCCN1C(=O)CC(C)(C)C)C1=CCN(C)CC1	ZINC000329337751	456874732	/nfs/dbraw/zinc/87/47/32/456874732.db2.gz	MQCRTUYINSKJMQ-HOCLYGCPSA-N	0	3	335.492	3.021	20	30		EGEDHN
CC[C@H](C)n1ncc(NC(=O)N2CC[C@H]3CCN(C)C[C@@H]32)c1C1CC1	ZINC000329408475	456886042	/nfs/dbraw/zinc/88/60/42/456886042.db2.gz	CMDGSXQVRSAWMO-VBQJREDUSA-N	0	3	345.491	3.303	20	30		EGEDHN
O=C(Nc1cnc2c(c1)CCCC2)[C@H]1CCCN1C1CCOCC1	ZINC000329441324	456890435	/nfs/dbraw/zinc/89/04/35/456890435.db2.gz	KAIVJXWLXYEZDU-GOSISDBHSA-N	0	3	329.444	3.192	20	30		EGEDHN
COc1ccc(Cl)cc1NC(=O)CCN1CCOCC2(CC2)C1	ZINC000329489883	456899966	/nfs/dbraw/zinc/89/99/66/456899966.db2.gz	YPWCPWPXXFRLEY-UHFFFAOYSA-N	0	3	338.835	3.439	20	30		EGEDHN
CSC[C@](C)(C#N)NC(=O)c1ccc(CN2CCCCC2)cc1	ZINC000345084677	456919537	/nfs/dbraw/zinc/91/95/37/456919537.db2.gz	JYLSUUJYGPURAG-SFHVURJKSA-N	0	3	331.485	3.048	20	30		EGEDHN
C[C@H](C(=O)NC12CC3CC(CC(C3)C1)C2)N1C[C@@H]2CC[C@H](O)[C@H]2C1	ZINC000329655599	456922346	/nfs/dbraw/zinc/92/23/46/456922346.db2.gz	MHBZUHIOJMIPHO-BBEAPWNCSA-N	0	3	332.488	3.003	20	30		EGEDHN
COc1ccc(CCCN(C)[C@H](C)C(=O)N[C@](C)(C#N)C(C)C)cc1	ZINC000345093064	456923015	/nfs/dbraw/zinc/92/30/15/456923015.db2.gz	RTVLHVUWDLAKOA-OXQOHEQNSA-N	0	3	345.487	3.003	20	30		EGEDHN
CCO[C@@H]1C[C@H](NC(=O)N[C@H](C)C2=CCN(C)CC2)C12CCCCC2	ZINC000329712750	456930908	/nfs/dbraw/zinc/93/09/08/456930908.db2.gz	QMDIDKQCDQVCIM-BPQIPLTHSA-N	0	3	349.519	3.268	20	30		EGEDHN
Cc1ccc2nccc(N3CCC([C@H](O)C(=O)NC4CC4)CC3)c2c1	ZINC000329738496	456933436	/nfs/dbraw/zinc/93/34/36/456933436.db2.gz	UIWVDHZCYCHTRB-IBGZPJMESA-N	0	3	339.439	3.239	20	30		EGEDHN
N#CC[C@@H](CC(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1	ZINC000353875783	456945314	/nfs/dbraw/zinc/94/53/14/456945314.db2.gz	IJWWYRFNLRGIDM-LEWJYISDSA-N	0	3	347.462	3.465	20	30		EGEDHN
[O-]C(NCC1C2CC3CC(C2)CC1C3)=[NH+]C[C@@H]1CCc2nccn2C1	ZINC000329894621	456957880	/nfs/dbraw/zinc/95/78/80/456957880.db2.gz	KBKMSMHVGFVLKN-CXTNYUCXSA-N	0	3	342.487	3.021	20	30		EGEDHN
CN(CCNc1nc2cc(Cl)ccn2c1C#N)Cc1ccccc1	ZINC000341825746	456960846	/nfs/dbraw/zinc/96/08/46/456960846.db2.gz	QYPFJDZKYZFQPK-UHFFFAOYSA-N	0	3	339.830	3.403	20	30		EGEDHN
CC(C)c1nnc(CCNC(=O)C(C#N)CCc2ccccc2)s1	ZINC000345664953	456987065	/nfs/dbraw/zinc/98/70/65/456987065.db2.gz	QMQVZUDBLHFLNZ-OAHLLOKOSA-N	0	3	342.468	3.093	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NC[C@@H]1CCCN(Cc2cccs2)C1	ZINC000345749164	456990951	/nfs/dbraw/zinc/99/09/51/456990951.db2.gz	AADCHIGHVDEHGN-SZMVWBNQSA-N	0	3	348.512	3.058	20	30		EGEDHN
CC[C@@H](NCCC(C)(C)C#N)c1ccccc1OCC(=O)N(C)C	ZINC000345940824	457008551	/nfs/dbraw/zinc/00/85/51/457008551.db2.gz	UHCPQORABMBHDF-MRXNPFEDSA-N	0	3	331.460	3.134	20	30		EGEDHN
Cc1ccc(NC(=O)NCC(C)(C)CCC#N)c(OCCN(C)C)c1	ZINC000349669183	457012004	/nfs/dbraw/zinc/01/20/04/457012004.db2.gz	QBEGWDKTVQXXIP-UHFFFAOYSA-N	0	3	346.475	3.387	20	30		EGEDHN
CCN(C)CCNC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1	ZINC000354020139	457014695	/nfs/dbraw/zinc/01/46/95/457014695.db2.gz	NZYTUPNXIWASGX-UHFFFAOYSA-N	0	3	337.423	3.226	20	30		EGEDHN
N#CCCCOc1cccc(CN2CCC(O[C@H]3CCOC3)CC2)c1	ZINC000354025629	457017566	/nfs/dbraw/zinc/01/75/66/457017566.db2.gz	HDORJNKEUSKJBZ-FQEVSTJZSA-N	0	3	344.455	3.139	20	30		EGEDHN
CCCCOc1cc(OC)ccc1C(=O)C(C#N)c1ccncn1	ZINC000346365790	457036936	/nfs/dbraw/zinc/03/69/36/457036936.db2.gz	DBBUVIPYKYLIFO-HNNXBMFYSA-N	0	3	325.368	3.154	20	30		EGEDHN
C=CCn1cccc1-c1nc(-c2cccc(OCCN(C)C)c2)no1	ZINC000346544293	457049538	/nfs/dbraw/zinc/04/95/38/457049538.db2.gz	QNEGRIFWXRVIKA-UHFFFAOYSA-N	0	3	338.411	3.332	20	30		EGEDHN
COc1cc(OC)cc(Oc2cccc(CNC(=O)C(C)C#N)c2)c1	ZINC000359093017	457053715	/nfs/dbraw/zinc/05/37/15/457053715.db2.gz	BECNEXYXUSAIAY-ZDUSSCGKSA-N	0	3	340.379	3.272	20	30		EGEDHN
CC(C)(C)OCCN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000330663857	457067382	/nfs/dbraw/zinc/06/73/82/457067382.db2.gz	FIZDUIAAHBKRRA-UHFFFAOYSA-N	0	3	325.497	3.102	20	30		EGEDHN
N#CCSCc1nc(-c2ccccc2CN2CCCCC2)no1	ZINC000349823648	457067745	/nfs/dbraw/zinc/06/77/45/457067745.db2.gz	FTNISLVXZMSPEV-UHFFFAOYSA-N	0	3	328.441	3.479	20	30		EGEDHN
CC#CCCCc1nc(-c2ccc3c(c2)C(SC)C(=O)N3)no1	ZINC000346634187	457082545	/nfs/dbraw/zinc/08/25/45/457082545.db2.gz	OZRMTVMIYWBRBC-HNNXBMFYSA-N	0	3	327.409	3.439	20	30		EGEDHN
C=CC[C@H](C)N[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21	ZINC000359648910	457103571	/nfs/dbraw/zinc/10/35/71/457103571.db2.gz	XAJAQOSZMDNOIA-GXFFZTMASA-N	0	3	344.274	3.222	20	30		EGEDHN
CC[C@@H](C)N[C@H](CNC(=O)c1cccc(CC#N)c1)c1ccco1	ZINC000359553391	457095778	/nfs/dbraw/zinc/09/57/78/457095778.db2.gz	HOCPCABFWCTGKF-RHSMWYFYSA-N	0	3	325.412	3.205	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1)OCC	ZINC000339452045	457124301	/nfs/dbraw/zinc/12/43/01/457124301.db2.gz	UEHRFQCFCQGSDI-RTBURBONSA-N	0	3	330.472	3.091	20	30		EGEDHN
CC[C@@H](C)n1ncc(NC(=O)N(C)[C@H](C)C2CCN(C)CC2)c1C	ZINC000331166154	457141084	/nfs/dbraw/zinc/14/10/84/457141084.db2.gz	YFAISHPFRSFJOG-ZIAGYGMSSA-N	0	3	335.496	3.370	20	30		EGEDHN
Cn1cc(CNCCc2cnc(SC3CCCC3)nc2)cc1C#N	ZINC000339570053	457148300	/nfs/dbraw/zinc/14/83/00/457148300.db2.gz	ZUOQSABMLAURLU-UHFFFAOYSA-N	0	3	341.484	3.054	20	30		EGEDHN
N#CCCN(CCC#N)C(=O)CN1CCC[C@@H]1CCC1CCCCC1	ZINC000362949482	457169864	/nfs/dbraw/zinc/16/98/64/457169864.db2.gz	PEBBOHQAJXLOHA-LJQANCHMSA-N	0	3	344.503	3.467	20	30		EGEDHN
CCCCN1CCCC[C@H]1CNC(=O)c1cc(C#N)cc(N(C)C)c1	ZINC000339607681	457170979	/nfs/dbraw/zinc/17/09/79/457170979.db2.gz	CAVPPESNHAYRIO-SFHVURJKSA-N	0	3	342.487	3.009	20	30		EGEDHN
N#CCCCOc1cccc(CN[C@@H](CO)Cc2ccc(F)cc2)c1	ZINC000346808413	457178540	/nfs/dbraw/zinc/17/85/40/457178540.db2.gz	ZHXUFYIQGUBDPO-LJQANCHMSA-N	0	3	342.414	3.201	20	30		EGEDHN
Cc1nn(C)c(OCC(F)(F)F)c1CNCC(C)(C)CCC#N	ZINC000342287954	457213853	/nfs/dbraw/zinc/21/38/53/457213853.db2.gz	VNKIIALXBPOZDQ-UHFFFAOYSA-N	0	3	332.370	3.089	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2cccc3cc[nH]c32)CC1	ZINC000342295040	457218599	/nfs/dbraw/zinc/21/85/99/457218599.db2.gz	TWVNGCHICUABMX-UHFFFAOYSA-N	0	3	326.444	3.008	20	30		EGEDHN
CC1(C#N)CCC([NH2+]C2CCN(C(=O)c3ccccc3[O-])CC2)CC1	ZINC000332114036	457307785	/nfs/dbraw/zinc/30/77/85/457307785.db2.gz	JOORNSMXZFVWKC-UHFFFAOYSA-N	0	3	341.455	3.059	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccc(CC#N)cc2)C1	ZINC000340102121	457333977	/nfs/dbraw/zinc/33/39/77/457333977.db2.gz	LVUGHIWJNOPTAS-JXFKEZNVSA-N	0	3	333.435	3.318	20	30		EGEDHN
C=C(C)COc1cc(CNCCc2ncc(C)cn2)ccc1OC	ZINC000340110008	457336016	/nfs/dbraw/zinc/33/60/16/457336016.db2.gz	VWMPUVXTZQBKPV-UHFFFAOYSA-N	0	3	327.428	3.081	20	30		EGEDHN
C[C@@H](CNC(=O)C[C@H](CC#N)c1ccccc1)N1CCC(C)CC1	ZINC000355272326	457352563	/nfs/dbraw/zinc/35/25/63/457352563.db2.gz	HGWCLWJJVOALDP-HKUYNNGSSA-N	0	3	327.472	3.311	20	30		EGEDHN
C=CCCC1(C(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)CC1	ZINC000357162453	457353613	/nfs/dbraw/zinc/35/36/13/457353613.db2.gz	VCFHDFFIGXGRJV-IBGZPJMESA-N	0	3	342.483	3.140	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CCC[C@H](N2CCCCC2=O)C1	ZINC000363537597	457359898	/nfs/dbraw/zinc/35/98/98/457359898.db2.gz	ARRTVJLCJAQKCY-SFHVURJKSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@@H](CNc1ccc(C#N)c([N+](=O)[O-])c1)N1CCc2ccccc2C1	ZINC000357188051	457365877	/nfs/dbraw/zinc/36/58/77/457365877.db2.gz	JBNBVZOEBRTDFL-AWEZNQCLSA-N	0	3	336.395	3.325	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc3nn(C(C)C)cc3c2)CC1	ZINC000355375244	457366738	/nfs/dbraw/zinc/36/67/38/457366738.db2.gz	KQJODZHXTTWDNP-UHFFFAOYSA-N	0	3	341.459	3.389	20	30		EGEDHN
C[C@H]1C[C@H](Nc2nccc(C#N)c2Cl)CCN1Cc1ccccc1	ZINC000342566803	457368558	/nfs/dbraw/zinc/36/85/58/457368558.db2.gz	LTVLNQWVJRTJNC-WMLDXEAASA-N	0	3	340.858	3.494	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H]2C[C@H](c3cccc(Cl)c3)C2)CC1	ZINC000373867888	457376554	/nfs/dbraw/zinc/37/65/54/457376554.db2.gz	CDRLVHOYMAUSLU-SAABIXHNSA-N	0	3	330.859	3.047	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N(C)CC[C@@H]1CCCO1	ZINC000342596299	457389930	/nfs/dbraw/zinc/38/99/30/457389930.db2.gz	QMPDIUDNHAEIFK-HOTGVXAUSA-N	0	3	336.501	3.152	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN[C@H](c1ccccc1)C1CCOCC1	ZINC000378467531	457400751	/nfs/dbraw/zinc/40/07/51/457400751.db2.gz	UEDIRIWJMSHNGB-HXUWFJFHSA-N	0	3	330.472	3.169	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1F)c1nccc(C#N)c1Cl	ZINC000342686103	457456378	/nfs/dbraw/zinc/45/63/78/457456378.db2.gz	XVXJCJRFGWHAOD-UHFFFAOYSA-N	0	3	332.810	3.314	20	30		EGEDHN
CC(C#N)C(=O)N[C@@H](c1cc(F)cc(Br)c1)C1CC1	ZINC000360970377	457476350	/nfs/dbraw/zinc/47/63/50/457476350.db2.gz	KJXFFFSQOVFWOU-AMIZOPFISA-N	0	3	325.181	3.315	20	30		EGEDHN
CN(CCc1cccc(Br)c1)Cc1cc(C#N)n(C)c1	ZINC000361008543	457508243	/nfs/dbraw/zinc/50/82/43/457508243.db2.gz	FNNIQFZZIDABCW-UHFFFAOYSA-N	0	3	332.245	3.334	20	30		EGEDHN
N#CC1(CCCN2CCC[C@H](Oc3ncccc3F)C2)CCOCC1	ZINC000374178788	457511791	/nfs/dbraw/zinc/51/17/91/457511791.db2.gz	PYSCKCMRZSORGN-INIZCTEOSA-N	0	3	347.434	3.164	20	30		EGEDHN
C=CC[C@H](CC)NC(=O)N1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1	ZINC000425526586	457585556	/nfs/dbraw/zinc/58/55/56/457585556.db2.gz	KIUIHGUJIZVRIR-GBESFXJTSA-N	0	3	327.472	3.257	20	30		EGEDHN
C=CC[C@@H](CC)NC(=O)N1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1	ZINC000425526587	457586392	/nfs/dbraw/zinc/58/63/92/457586392.db2.gz	KIUIHGUJIZVRIR-IPMKNSEASA-N	0	3	327.472	3.257	20	30		EGEDHN
COc1cc(C#N)ccc1CN1CC2(CCC2)[C@@H]1C1CCOCC1	ZINC000425551544	457595962	/nfs/dbraw/zinc/59/59/62/457595962.db2.gz	JTRSHCGTGIGEAT-IBGZPJMESA-N	0	3	326.440	3.348	20	30		EGEDHN
C=CCN1CC[C@@H](N(CCc2ccccc2F)C2CCCC2)C1=O	ZINC000410337960	457637970	/nfs/dbraw/zinc/63/79/70/457637970.db2.gz	LQSXRSSBZFAUDE-LJQANCHMSA-N	0	3	330.447	3.400	20	30		EGEDHN
N#Cc1csc(CN2CCC[C@@](CO)(Cc3ccccc3)C2)c1	ZINC000361250288	457667176	/nfs/dbraw/zinc/66/71/76/457667176.db2.gz	KCMMQPQEMMEYEQ-LJQANCHMSA-N	0	3	326.465	3.437	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NC[C@]1(C)CCN(Cc2ccccc2)C1	ZINC000370590356	457678498	/nfs/dbraw/zinc/67/84/98/457678498.db2.gz	WAAXADLTGBVUIH-SFTDATJTSA-N	0	3	344.499	3.244	20	30		EGEDHN
Cc1nn(C)cc1[C@H](C)N[C@@H]1CCCN(c2ccc(C#N)cc2F)C1	ZINC000361346106	457701216	/nfs/dbraw/zinc/70/12/16/457701216.db2.gz	MMBIHIZJNSESDN-XJKSGUPXSA-N	0	3	341.434	3.059	20	30		EGEDHN
COc1ccc(C(=O)C(C#N)c2ccncn2)c(OCCC(C)C)c1	ZINC000361354059	457703753	/nfs/dbraw/zinc/70/37/53/457703753.db2.gz	CMYZBDAAJANARL-INIZCTEOSA-N	0	3	339.395	3.400	20	30		EGEDHN
N#Cc1ccccc1OCCN(CCO)[C@@H]1CCCc2ccccc21	ZINC000357885163	457723630	/nfs/dbraw/zinc/72/36/30/457723630.db2.gz	FPIXERUKNLDOBI-HXUWFJFHSA-N	0	3	336.435	3.309	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@H]1CCO[C@@H]1C1CC1	ZINC000365340327	457744294	/nfs/dbraw/zinc/74/42/94/457744294.db2.gz	ARKIBPMBYABKFX-MAUKXSAKSA-N	0	3	332.469	3.060	20	30		EGEDHN
C[C@H](CNC(=O)C(C#N)CCc1ccccc1)N(C)c1ccccc1	ZINC000433225747	457784067	/nfs/dbraw/zinc/78/40/67/457784067.db2.gz	JWBWMUMBBJNKJQ-MJGOQNOKSA-N	0	3	335.451	3.400	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NC[C@@H]1CCN(c2ccccc2)C1	ZINC000433231840	457786362	/nfs/dbraw/zinc/78/63/62/457786362.db2.gz	YUNPNQLEYAUJKR-VQTJNVASSA-N	0	3	347.462	3.402	20	30		EGEDHN
CN(CCCNC(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1)Cc1ccccc1	ZINC000411196726	457826479	/nfs/dbraw/zinc/82/64/79/457826479.db2.gz	XUINUXOJKISCOI-LEWJYISDSA-N	0	3	347.462	3.300	20	30		EGEDHN
C[C@H](CCC#N)N(C)C[C@@H](O)COc1ccc(C(F)(F)F)cc1	ZINC000411265737	457844890	/nfs/dbraw/zinc/84/48/90/457844890.db2.gz	PBLFNMTVYXWIPW-TZMCWYRMSA-N	0	3	330.350	3.069	20	30		EGEDHN
C=CCN(CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CCc1ccco1	ZINC000411492166	457902578	/nfs/dbraw/zinc/90/25/78/457902578.db2.gz	WHLHGYDRUKSCKC-UHFFFAOYSA-N	0	3	343.383	3.247	20	30		EGEDHN
C=CCOc1cccc(CN[C@H]2CCCO[C@@H]2c2cnn(CC)c2)c1	ZINC000433947321	457918912	/nfs/dbraw/zinc/91/89/12/457918912.db2.gz	CJQCJUXIZYWJRQ-VQTJNVASSA-N	0	3	341.455	3.478	20	30		EGEDHN
Cc1cc(CN(C)CCC(=O)Nc2ccccc2C#N)ccc1F	ZINC000444743101	457962385	/nfs/dbraw/zinc/96/23/85/457962385.db2.gz	HIHDTZQQQBHOAE-UHFFFAOYSA-N	0	3	325.387	3.466	20	30		EGEDHN
N#CC1(CCN2C[C@H]3C[C@@H](C2)Cn2c(=O)cccc23)CCCCC1	ZINC000411770440	457974476	/nfs/dbraw/zinc/97/44/76/457974476.db2.gz	CNDGWGKOESRODZ-DLBZAZTESA-N	0	3	325.456	3.132	20	30		EGEDHN
C=CC[C@@H]1N(CC(=O)NCc2ccc(C#N)cc2)CCCC1(C)C	ZINC000444788070	457979663	/nfs/dbraw/zinc/97/96/63/457979663.db2.gz	ZZUSBKBBYVJSRQ-SFHVURJKSA-N	0	3	325.456	3.241	20	30		EGEDHN
CCN(CCC#N)C(=O)CN[C@H]1CCCC[C@@H]1Oc1ccccc1C	ZINC000362017201	458006489	/nfs/dbraw/zinc/00/64/89/458006489.db2.gz	BSDDVZLIOUWGAQ-HKUYNNGSSA-N	0	3	343.471	3.037	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cnc([C@@H](C)CC)nc2)CC1	ZINC000434535090	458014264	/nfs/dbraw/zinc/01/42/64/458014264.db2.gz	YPBGCEDZOAHXOY-AWEZNQCLSA-N	0	3	331.464	3.152	20	30		EGEDHN
C=CC[C@H]1N(C(=O)NC[C@]2(N(C)C)CCSC2)CCCC1(C)C	ZINC000445122490	458017885	/nfs/dbraw/zinc/01/78/85/458017885.db2.gz	YHUAHEMNAQBQJW-CRAIPNDOSA-N	0	3	339.549	3.200	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@@]2(CCN2CCCSCC#N)C1	ZINC000375726686	458039875	/nfs/dbraw/zinc/03/98/75/458039875.db2.gz	JVKDEEZTRFQDSP-QGZVFWFLSA-N	0	3	339.505	3.109	20	30		EGEDHN
N#CC(=C([O-])c1cccc([N+](=O)[O-])c1)c1cc(C(F)(F)F)ccn1	ZINC000362192461	458041079	/nfs/dbraw/zinc/04/10/79/458041079.db2.gz	SPQPNALZQXIDJQ-GFCCVEGCSA-N	0	3	335.241	3.499	20	30		EGEDHN
N#CC(C(=O)c1cccc([N+](=O)[O-])c1)c1cc(C(F)(F)F)ccn1	ZINC000362192461	458041085	/nfs/dbraw/zinc/04/10/85/458041085.db2.gz	SPQPNALZQXIDJQ-GFCCVEGCSA-N	0	3	335.241	3.499	20	30		EGEDHN
COC1([C@H](C)NCC(=O)N(CCC#N)c2cc(C)cc(C)c2)CCC1	ZINC000412020040	458048707	/nfs/dbraw/zinc/04/87/07/458048707.db2.gz	JUPRXDVPPAJIHE-KRWDZBQOSA-N	0	3	343.471	3.097	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(OC)cc(Cl)c2F)CC1	ZINC000412034843	458056734	/nfs/dbraw/zinc/05/67/34/458056734.db2.gz	GTGBCMDFKHAVFE-UHFFFAOYSA-N	0	3	340.826	3.258	20	30		EGEDHN
C=CCC[C@@H](NC(=O)NC[C@]1(N(C)C)CCSC1)c1ccccc1	ZINC000435111932	458095746	/nfs/dbraw/zinc/09/57/46/458095746.db2.gz	UDGIDAKYPNOTOA-IEBWSBKVSA-N	0	3	347.528	3.430	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCc2ccc(C)cc2OC(C)C)CC1	ZINC000445869582	458107717	/nfs/dbraw/zinc/10/77/17/458107717.db2.gz	RNOCEGIIBUDYSK-UHFFFAOYSA-N	0	3	345.487	3.232	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1CNc1cc(C)nc2ccc([N+](=O)[O-])cc21	ZINC000435596040	458169371	/nfs/dbraw/zinc/16/93/71/458169371.db2.gz	GBRMUEWQOJHBST-ACJLOTCBSA-N	0	3	327.384	3.266	20	30		EGEDHN
COC(=O)[C@@]1(c2ccccc2)CCN(Cc2ccc(C#N)cc2F)C1	ZINC000428782809	458210917	/nfs/dbraw/zinc/21/09/17/458210917.db2.gz	LXEVLHACEJBMLQ-FQEVSTJZSA-N	0	3	338.382	3.014	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1CN[C@H](c1cnn(C)c1)c1cccc(F)c1	ZINC000436310581	458286800	/nfs/dbraw/zinc/28/68/00/458286800.db2.gz	QLNGWMXJMGJUFY-MNEFBYGVSA-N	0	3	329.419	3.219	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N(C)C[C@@H]1CCCN(CC)[C@H]1c1cnn(C)c1	ZINC000372537264	458305511	/nfs/dbraw/zinc/30/55/11/458305511.db2.gz	BLFXAMPNLJMYAU-ZIFCJYIRSA-N	0	3	346.519	3.254	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)NC(=O)N(C)C[C@@H]1CCCN(C)C1	ZINC000413828484	458308017	/nfs/dbraw/zinc/30/80/17/458308017.db2.gz	UXXGLVTXBXLRFY-MOPGFXCFSA-N	0	3	329.488	3.157	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN(C)[C@@H]2CC[C@H](C)C2)cc1	ZINC000429584973	458349770	/nfs/dbraw/zinc/34/97/70/458349770.db2.gz	PEADYEBDJQEECM-FUHWJXTLSA-N	0	3	343.471	3.452	20	30		EGEDHN
COc1cc(CN[C@@H]2CCCc3cc(C#N)ccc32)cc2c1OCO2	ZINC000418148969	458372266	/nfs/dbraw/zinc/37/22/66/458372266.db2.gz	UQIHEAYJDXPBAM-QGZVFWFLSA-N	0	3	336.391	3.463	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCc1ccc(CN2CCN(CC)CC2)cc1	ZINC000429861707	458377782	/nfs/dbraw/zinc/37/77/82/458377782.db2.gz	PMUNLEUXEMWHIU-UHFFFAOYSA-N	0	3	343.515	3.043	20	30		EGEDHN
C=CCOc1ccc(CC(=O)NCc2ccc(CN(C)C)cc2)cc1	ZINC000448595722	458401744	/nfs/dbraw/zinc/40/17/44/458401744.db2.gz	RODNOTHSXTUMGS-UHFFFAOYSA-N	0	3	338.451	3.172	20	30		EGEDHN
N#CCCN(C(=O)CN1CC[C@@H](C2CCCC2)C1)c1ccccc1	ZINC000420966482	458405363	/nfs/dbraw/zinc/40/53/63/458405363.db2.gz	VHROLEURDOVLJI-GOSISDBHSA-N	0	3	325.456	3.445	20	30		EGEDHN
CC(=O)N[C@H]1CCN(CCC(C#N)(c2ccccc2)c2ccccc2)C1	ZINC000420960113	458406502	/nfs/dbraw/zinc/40/65/02/458406502.db2.gz	RCMQYNTVQZAZTE-NRFANRHFSA-N	0	3	347.462	3.097	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)NC[C@H]1CCC(F)(F)C1)C(C)C	ZINC000430175871	458415496	/nfs/dbraw/zinc/41/54/96/458415496.db2.gz	DNLYIOUXRHAEQW-HOTGVXAUSA-N	0	3	343.462	3.420	20	30		EGEDHN
C=CCOc1ccc(CNC2(C(=O)N(C)C)CCCCC2)cc1OC	ZINC000449463154	458424965	/nfs/dbraw/zinc/42/49/65/458424965.db2.gz	WFTJWCYQSOQBHK-UHFFFAOYSA-N	0	3	346.471	3.141	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCc1ccc(OCC(F)(F)F)c(OCC)c1	ZINC000449517259	458426569	/nfs/dbraw/zinc/42/65/69/458426569.db2.gz	FAPCNQUKJUQPFB-KGLIPLIRSA-N	0	3	345.361	3.460	20	30		EGEDHN
C=CCC[C@H](NC1CCN(Cc2ccccc2)CC1)C(=O)OCC	ZINC000449661461	458428376	/nfs/dbraw/zinc/42/83/76/458428376.db2.gz	ZYFFENDTBRWTPY-IBGZPJMESA-N	0	3	330.472	3.139	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(N3CCN(C(C)C)CC3)CC2)CCCC1	ZINC000450288184	458444703	/nfs/dbraw/zinc/44/47/03/458444703.db2.gz	PKURMPNOZGMTIJ-UHFFFAOYSA-N	0	3	347.547	3.140	20	30		EGEDHN
C[C@@H]1[C@H](NC(=O)NCC(C)(C)CCC#N)CCN1Cc1ccccc1	ZINC000377040337	458447359	/nfs/dbraw/zinc/44/73/59/458447359.db2.gz	BUZFLQKXKHESDV-SJLPKXTDSA-N	0	3	342.487	3.279	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC[C@@H]2CCC[C@@H](C(F)(F)F)C2)CC1	ZINC000437495860	458457503	/nfs/dbraw/zinc/45/75/03/458457503.db2.gz	XTCHPMQVNOFBCR-ZIAGYGMSSA-N	0	3	347.425	3.305	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CCN(c2c(C#N)cccc2C#N)C1	ZINC000450806844	458457628	/nfs/dbraw/zinc/45/76/28/458457628.db2.gz	GAOBFTDZKXOQEX-QGZVFWFLSA-N	0	3	330.435	3.388	20	30		EGEDHN
C=CCC1(CNS(=O)(=O)c2ccc(CN(C)C)cc2)CCCC1	ZINC000451954383	458491739	/nfs/dbraw/zinc/49/17/39/458491739.db2.gz	ARTNVVHTIHGFAS-UHFFFAOYSA-N	0	3	336.501	3.163	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1CCC[C@@]2(CCSC2)C1	ZINC000451960506	458491808	/nfs/dbraw/zinc/49/18/08/458491808.db2.gz	BWNJTGBYSMUQLG-GOSISDBHSA-N	0	3	332.469	3.165	20	30		EGEDHN
CC[C@@H](COCC(F)(F)F)NC(=O)C(C#N)CCc1ccccc1	ZINC000452746160	458508804	/nfs/dbraw/zinc/50/88/04/458508804.db2.gz	PAMJOIZOPFBJTL-CABCVRRESA-N	0	3	342.361	3.233	20	30		EGEDHN
C=C(CC)CN[C@@H](C)c1ccc(S(=O)(=O)N2CCCCC2)cc1	ZINC000453377016	458526530	/nfs/dbraw/zinc/52/65/30/458526530.db2.gz	VADHWSFZUVVBIC-INIZCTEOSA-N	0	3	336.501	3.478	20	30		EGEDHN
C=CCN1CC[C@H](NCC2(Sc3ccccc3)CCCC2)C1=O	ZINC000493695359	458538085	/nfs/dbraw/zinc/53/80/85/458538085.db2.gz	ZWWVHEQVWQRUOG-KRWDZBQOSA-N	0	3	330.497	3.468	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1C(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1	ZINC000468822135	458538412	/nfs/dbraw/zinc/53/84/12/458538412.db2.gz	DBDDHZDDUBNQFE-HSALFYBXSA-N	0	3	342.483	3.229	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NC(=O)NC[C@@H](c1ccccc1)N(CC)CC	ZINC000454199725	458554782	/nfs/dbraw/zinc/55/47/82/458554782.db2.gz	VVJDGXGMIBRCNY-QYZOEREBSA-N	0	3	345.487	3.102	20	30		EGEDHN
Cc1nc(NC(=O)[C@H](N)CCCC#N)sc1Cc1ccc(F)cc1	ZINC000424094358	458557055	/nfs/dbraw/zinc/55/70/55/458557055.db2.gz	UEKSIWLGTSBGAP-CQSZACIVSA-N	0	3	346.431	3.141	20	30		EGEDHN
C=CC(C)(C)CNC(=O)NCC1CCN(Cc2cccs2)CC1	ZINC000454403939	458560799	/nfs/dbraw/zinc/56/07/99/458560799.db2.gz	AWWWBTVRTZQJOR-UHFFFAOYSA-N	0	3	335.517	3.472	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N(Cc1ccccc1)Cc1ccc(F)cc1	ZINC000424189315	458580511	/nfs/dbraw/zinc/58/05/11/458580511.db2.gz	KLJQWZDRHGKQNR-LJQANCHMSA-N	0	3	339.414	3.376	20	30		EGEDHN
Cc1cc(Br)cn2c(CN[C@@H]3CC[C@H](C#N)C3)cnc12	ZINC000424190110	458581623	/nfs/dbraw/zinc/58/16/23/458581623.db2.gz	FLPBYHMBSSCLMT-WCQYABFASA-N	0	3	333.233	3.187	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Nc1cc(C(C)C)on1)C(C)C	ZINC000438531467	458592547	/nfs/dbraw/zinc/59/25/47/458592547.db2.gz	UUKSYWRQXBLBTR-OAHLLOKOSA-N	0	3	334.464	3.040	20	30		EGEDHN
C[C@H](C(=O)NC[C@@H]1CCCN1Cc1ccccc1)c1cccc(C#N)c1	ZINC000462081605	458592906	/nfs/dbraw/zinc/59/29/06/458592906.db2.gz	CZETZYXFTVLIBM-UWJYYQICSA-N	0	3	347.462	3.443	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)Nc2ccc(OC(C)(C)C)c(C#N)c2)CCN1C	ZINC000455806683	458616124	/nfs/dbraw/zinc/61/61/24/458616124.db2.gz	YUAXCPXUWGBTBT-BBRMVZONSA-N	0	3	344.459	3.340	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1CC[C@](C)(CCc2ccccc2)C1	ZINC000470366434	458632098	/nfs/dbraw/zinc/63/20/98/458632098.db2.gz	DYMWECBAERKYGZ-NQIIRXRSSA-N	0	3	341.499	3.339	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN1CC[C@@](C)(CCc2ccccc2)C1	ZINC000470366433	458632114	/nfs/dbraw/zinc/63/21/14/458632114.db2.gz	DYMWECBAERKYGZ-GHTZIAJQSA-N	0	3	341.499	3.339	20	30		EGEDHN
Cc1cc(C)cc(N(CCC#N)C(=O)[C@H](C)N[C@@]2(C)CCO[C@H]2C)c1	ZINC000494277160	458653021	/nfs/dbraw/zinc/65/30/21/458653021.db2.gz	OQRVZFNSKRXAFN-ZWOKBUDYSA-N	0	3	343.471	3.096	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)NC[C@@H](C)N1CCC[C@H](C)C1	ZINC000463506294	458708265	/nfs/dbraw/zinc/70/82/65/458708265.db2.gz	JAUNNPGEWKLEBM-JKSUJKDBSA-N	0	3	346.471	3.110	20	30		EGEDHN
CCC(CC)(CN[C@H](C(N)=O)c1ccc(C#N)cc1)c1ccccc1	ZINC000439649621	458737030	/nfs/dbraw/zinc/73/70/30/458737030.db2.gz	SISNITPIWYOQEB-IBGZPJMESA-N	0	3	335.451	3.432	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)C/C(C)=C/c2ccccc2)CC1	ZINC000494814649	458750289	/nfs/dbraw/zinc/75/02/89/458750289.db2.gz	XJQKTDFFZLCDLR-BMRADRMJSA-N	0	3	327.472	3.382	20	30		EGEDHN
C=CCn1c(-c2ccccc2F)nnc1N1CCN(C)[C@H](C(C)C)C1	ZINC000508901157	458767221	/nfs/dbraw/zinc/76/72/21/458767221.db2.gz	DXHCIQJYCRENMT-KRWDZBQOSA-N	0	3	343.450	3.047	20	30		EGEDHN
C[C@@H]1C[C@@H](c2ccccc2)N(CC(=O)NCc2ccc(C#N)cc2)C1	ZINC000513227086	458792496	/nfs/dbraw/zinc/79/24/96/458792496.db2.gz	AKXQUXHKAINKCW-UZLBHIALSA-N	0	3	333.435	3.258	20	30		EGEDHN
C[C@@H]1C[C@@H](c2ccccc2)N(CC(=O)NCc2cccc(C#N)c2)C1	ZINC000513271459	458793889	/nfs/dbraw/zinc/79/38/89/458793889.db2.gz	KRDRCXYGEWUQGN-UZLBHIALSA-N	0	3	333.435	3.258	20	30		EGEDHN
C[C@H](C(=O)N(C)CCC#N)N1CCC[C@@]2(CCCc3ccccc32)C1	ZINC000440314698	458802999	/nfs/dbraw/zinc/80/29/99/458802999.db2.gz	LAHCFVOLRHTKRS-UTKZUKDTSA-N	0	3	339.483	3.117	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN[C@@H]1CC[C@@H](c2ccccc2)C[C@H]1OC	ZINC000515443352	458809650	/nfs/dbraw/zinc/80/96/50/458809650.db2.gz	HWYIECIIUBWJJF-VAMGGRTRSA-N	0	3	344.499	3.352	20	30		EGEDHN
CC#CCN(C)C[C@@H](O)CO[C@H](c1ccccc1)c1ccccc1C	ZINC000516096883	458813986	/nfs/dbraw/zinc/81/39/86/458813986.db2.gz	LZRKMYOSIWZCEA-IFMALSPDSA-N	0	3	337.463	3.417	20	30		EGEDHN
COc1cc(CNCc2ccccc2Cn2cccn2)ccc1C#N	ZINC000440816023	458857008	/nfs/dbraw/zinc/85/70/08/458857008.db2.gz	XFTVYVRFMQWEIQ-UHFFFAOYSA-N	0	3	332.407	3.101	20	30		EGEDHN
COc1cc(CN[C@H]2CCCN(c3cccc(F)c3)C2)ccc1C#N	ZINC000440824751	458859057	/nfs/dbraw/zinc/85/90/57/458859057.db2.gz	PNYNJRACQNWTDI-SFHVURJKSA-N	0	3	339.414	3.465	20	30		EGEDHN
C=CCN1CCC(NC(=O)CO[C@@H]2C[C@H](C)CC[C@@H]2C(C)C)CC1	ZINC000518501462	458872320	/nfs/dbraw/zinc/87/23/20/458872320.db2.gz	AZWXSCIFLGDBET-BHIYHBOVSA-N	0	3	336.520	3.230	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1c[nH]c(C(F)(F)F)c1)C(C)C	ZINC000551095831	458887929	/nfs/dbraw/zinc/88/79/29/458887929.db2.gz	SMPVZUBMVAUFMI-CQSZACIVSA-N	0	3	343.393	3.462	20	30		EGEDHN
C[C@H](C(=O)N(C)CCC#N)N1CCC[C@H](CCCc2ccccc2)C1	ZINC000441215020	458901037	/nfs/dbraw/zinc/90/10/37/458901037.db2.gz	ZGXZGMBOYCSJMC-QUCCMNQESA-N	0	3	341.499	3.482	20	30		EGEDHN
CC[C@@](C)(C#N)c1nc(-c2ccc3c(c2)C(SC)C(=O)N3)no1	ZINC000554808079	458901577	/nfs/dbraw/zinc/90/15/77/458901577.db2.gz	KKJFIMLEYBXHST-LRDDRELGSA-N	0	3	328.397	3.284	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@]1(C)CCN(Cc2ccc(CC#N)cc2)C1	ZINC000495658088	458911763	/nfs/dbraw/zinc/91/17/63/458911763.db2.gz	NOAONVDMPZDUOD-HXUWFJFHSA-N	0	3	343.471	3.489	20	30		EGEDHN
CC(C)[C@H](NC(=O)C(C#N)CCc1ccccc1)C1(CO)CCCC1	ZINC000566465384	458941808	/nfs/dbraw/zinc/94/18/08/458941808.db2.gz	UWZBTHUMQBUHMQ-OALUTQOASA-N	0	3	342.483	3.452	20	30		EGEDHN
C[C@@]1(Cc2ccccc2)CCCN1CC(=O)NCc1cccc(C#N)c1	ZINC000467240054	458960958	/nfs/dbraw/zinc/96/09/58/458960958.db2.gz	YQZVSMGNDZODBL-QFIPXVFZSA-N	0	3	347.462	3.272	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2sc(C)cc2Br)CC1	ZINC000457537373	458993776	/nfs/dbraw/zinc/99/37/76/458993776.db2.gz	FCBUVCLIOFBXOK-UHFFFAOYSA-N	0	3	343.290	3.199	20	30		EGEDHN
C[C@@H](C1CC1)N(CC(=O)NCc1ccc(C#N)cc1)Cc1ccccc1	ZINC000519907565	459020417	/nfs/dbraw/zinc/02/04/17/459020417.db2.gz	KLFMMOGDWFOAID-KRWDZBQOSA-N	0	3	347.462	3.475	20	30		EGEDHN
COC(=O)c1csc(-c2cccc(CN[C@@H]3CC[C@@H](C#N)C3)c2)n1	ZINC000442859211	459047730	/nfs/dbraw/zinc/04/77/30/459047730.db2.gz	QHFMTWRPTCHVJI-IUODEOHRSA-N	0	3	341.436	3.379	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@H]1NC[C@H](C#N)CCC#N	ZINC000496043330	459047963	/nfs/dbraw/zinc/04/79/63/459047963.db2.gz	JPGMNXBECFQBLE-HRCADAONSA-N	0	3	334.464	3.103	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCCc2ccc(C)cc2C)CC1	ZINC000520693719	459084094	/nfs/dbraw/zinc/08/40/94/459084094.db2.gz	NJWGLRJLKLQGNE-UHFFFAOYSA-N	0	3	329.488	3.186	20	30		EGEDHN
COCCN(C(=O)OC(C)(C)C)C1CCN(CCCCC#N)CC1	ZINC000496168825	459095718	/nfs/dbraw/zinc/09/57/18/459095718.db2.gz	MVDAIQWYLBNDNG-UHFFFAOYSA-N	0	3	339.480	3.028	20	30		EGEDHN
C=CCN(CCc1ccccc1)Cc1cc(=O)n2cccc(C)c2n1	ZINC000532503452	459102517	/nfs/dbraw/zinc/10/25/17/459102517.db2.gz	OWKRZMHJCMISIM-UHFFFAOYSA-N	0	3	333.435	3.234	20	30		EGEDHN
C=CCN(CC=C)[C@H](CN1C(=O)N2CCC[C@]2(CCC)C1=O)C(C)C	ZINC000479008054	459117572	/nfs/dbraw/zinc/11/75/72/459117572.db2.gz	VOVIBINRKHJPCV-YLJYHZDGSA-N	0	3	347.503	3.282	20	30		EGEDHN
CC(C)CN(CC(=O)NCc1ccc(C#N)cc1)Cc1ccccc1	ZINC000521192901	459128383	/nfs/dbraw/zinc/12/83/83/459128383.db2.gz	SLJZBVRDBRSKSY-UHFFFAOYSA-N	0	3	335.451	3.333	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@H]1CCC[C@H](CNCc2ccc(C#N)o2)C1	ZINC000496388182	459175095	/nfs/dbraw/zinc/17/50/95/459175095.db2.gz	RMWMVMFLXCJPDJ-UONOGXRCSA-N	0	3	333.432	3.324	20	30		EGEDHN
CO[C@@](C)(CNCc1ccc(C#N)c(F)c1)COCc1ccccc1	ZINC000594975934	459202835	/nfs/dbraw/zinc/20/28/35/459202835.db2.gz	XMINABKDMHKFLF-FQEVSTJZSA-N	0	3	342.414	3.409	20	30		EGEDHN
CC(C#N)C(=O)N1CCC([C@H]2N(C(=O)OC(C)(C)C)CC2(C)C)CC1	ZINC000496507128	459220365	/nfs/dbraw/zinc/22/03/65/459220365.db2.gz	ILAVVJVWNNPGSD-DZGCQCFKSA-N	0	3	349.475	3.030	20	30		EGEDHN
C=C(C)Cn1c(CC(C)C)nnc1N1CC[C@@H](N2CCCCC2)C1	ZINC000559029903	459232205	/nfs/dbraw/zinc/23/22/05/459232205.db2.gz	SIZHSQUJSWXFMM-QGZVFWFLSA-N	0	3	331.508	3.117	20	30		EGEDHN
C=C(C)CN(C)CC(=O)NC[C@H](c1ccccc1Cl)N1CCCC1	ZINC000481215149	459240152	/nfs/dbraw/zinc/24/01/52/459240152.db2.gz	XDPDQMWGJLAJCB-GOSISDBHSA-N	0	3	349.906	3.101	20	30		EGEDHN
C[C@H](NC(=O)[C@]1(C#N)CC12CCCC2)[C@@H](c1ccccc1)N(C)C	ZINC000579076088	459242482	/nfs/dbraw/zinc/24/24/82/459242482.db2.gz	UGDVUWKSHZICPL-RIFZZMRRSA-N	0	3	325.456	3.268	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CCO[C@@H](c2ccccc2)C1	ZINC000559271594	459247024	/nfs/dbraw/zinc/24/70/24/459247024.db2.gz	LETLSZXRFRIRPB-VQTJNVASSA-N	0	3	334.419	3.359	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)N1CC[C@H](Cc2ccc(F)cc2)C1	ZINC000523011143	459277077	/nfs/dbraw/zinc/27/70/77/459277077.db2.gz	FFRDLRKMKGIZGX-FUHWJXTLSA-N	0	3	330.447	3.279	20	30		EGEDHN
Cc1ccc(CN(C)CCC(=O)Nc2ccc(C#N)c(Cl)c2)nc1	ZINC000591039593	459299460	/nfs/dbraw/zinc/29/94/60/459299460.db2.gz	NVSBIXFAZMLXSQ-UHFFFAOYSA-N	0	3	342.830	3.376	20	30		EGEDHN
N#C[C@@H]1CC[C@@H](N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2=O)C1	ZINC000582097039	459306961	/nfs/dbraw/zinc/30/69/61/459306961.db2.gz	SQUMQVROSPYTPR-XJKCOSOUSA-N	0	3	349.381	3.065	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NC[C@@H](CC)N1CCc2ccccc2C1)OCC	ZINC000534401108	459324724	/nfs/dbraw/zinc/32/47/24/459324724.db2.gz	FBEPYVOBCUSOAW-WOJBJXKFSA-N	0	3	344.499	3.311	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2N[C@H]1CCN(c2ccc(F)cc2)C1=O	ZINC000591255926	459342254	/nfs/dbraw/zinc/34/22/54/459342254.db2.gz	HTDPYDXUMRAABQ-PMACEKPBSA-N	0	3	349.409	3.470	20	30		EGEDHN
C[C@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1cccc(-n2cnnn2)c1	ZINC000591348827	459358142	/nfs/dbraw/zinc/35/81/42/459358142.db2.gz	FLINLJVMVUPYEF-VBKZILBWSA-N	0	3	344.422	3.262	20	30		EGEDHN
CC(C)c1ccc([C@@H](N)CNC(=O)N2CCC[C@@](C)(C#N)C2)cc1	ZINC000591359230	459361898	/nfs/dbraw/zinc/36/18/98/459361898.db2.gz	GROIYVQYPKTFRE-HKUYNNGSSA-N	0	3	328.460	3.145	20	30		EGEDHN
CC#CCCNC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000483419131	459368328	/nfs/dbraw/zinc/36/83/28/459368328.db2.gz	HGBJPICPJMWPET-PKOBYXMFSA-N	0	3	327.472	3.094	20	30		EGEDHN
COC[C@@H](NCCCC1(C#N)CCOCC1)c1cccc(OC)c1	ZINC000595684545	459396142	/nfs/dbraw/zinc/39/61/42/459396142.db2.gz	OIXHHBKWFJGNHQ-GOSISDBHSA-N	0	3	332.444	3.073	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)C(=O)N[C@H]1CCN(C(C)(C)C)C1	ZINC000595704358	459405962	/nfs/dbraw/zinc/40/59/62/459405962.db2.gz	PXKAVNLCHBSDEB-PBHICJAKSA-N	0	3	328.460	3.133	20	30		EGEDHN
Cc1nc(NC(=O)[C@@H](N)CCCC#N)sc1Cc1ccccc1	ZINC000591599676	459410108	/nfs/dbraw/zinc/41/01/08/459410108.db2.gz	NXWJYTLVLDACCI-AWEZNQCLSA-N	0	3	328.441	3.002	20	30		EGEDHN
C=CCNC(=O)CN[C@@H]1CCCC[C@@H]1Oc1ccc(OCCC)cc1	ZINC000484634992	459422776	/nfs/dbraw/zinc/42/27/76/459422776.db2.gz	RTOFVCBANMIAKJ-MOPGFXCFSA-N	0	3	346.471	3.057	20	30		EGEDHN
Cc1cc(C)cc(OC[C@@H](O)CN[C@H]2CCc3cc(C#N)ccc32)c1	ZINC000591764163	459431236	/nfs/dbraw/zinc/43/12/36/459431236.db2.gz	UWELXUWIHNITFU-RXVVDRJESA-N	0	3	336.435	3.192	20	30		EGEDHN
N#Cc1ccc2c(c1)CC[C@@H]2NC[C@H](O)COc1ccc(Cl)cc1	ZINC000591763955	459431738	/nfs/dbraw/zinc/43/17/38/459431738.db2.gz	SSOROTVOYHQJLT-LPHOPBHVSA-N	0	3	342.826	3.228	20	30		EGEDHN
Cc1ccc2c(c1)CN(C(=O)C(C#N)CCc1ccccc1)CCO2	ZINC000561281830	459438701	/nfs/dbraw/zinc/43/87/01/459438701.db2.gz	PGBZHWWAUYOQIG-SFHVURJKSA-N	0	3	334.419	3.489	20	30		EGEDHN
C[C@@H](CN[C@H]1CCCN(c2ccc(C#N)cc2)C1=O)c1ccccc1	ZINC000485270911	459446584	/nfs/dbraw/zinc/44/65/84/459446584.db2.gz	JGADGJLFNMBKHG-JXFKEZNVSA-N	0	3	333.435	3.447	20	30		EGEDHN
N#Cc1cnc2c(Cl)cccc2c1NC[C@@H](O)CN1CCCCC1	ZINC000591896752	459471116	/nfs/dbraw/zinc/47/11/16/459471116.db2.gz	QVSXEWLNMPMARC-CQSZACIVSA-N	0	3	344.846	3.019	20	30		EGEDHN
CN1CC[C@@H](NC(=O)N2CCC(CCC#N)CC2)[C@@H]1c1ccccc1	ZINC000591959957	459497984	/nfs/dbraw/zinc/49/79/84/459497984.db2.gz	KYNLPFSCLLYJCU-MOPGFXCFSA-N	0	3	340.471	3.157	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@@H](Nc2nc(C#N)c(Cl)s2)C1	ZINC000596088600	459516569	/nfs/dbraw/zinc/51/65/69/459516569.db2.gz	LNBQHCCUJURTQA-WCQYABFASA-N	0	3	332.860	3.337	20	30		EGEDHN
CC[C@H](CNCCS(=O)(=O)c1ccc(C#N)cc1)c1ccccc1	ZINC000562312700	459537047	/nfs/dbraw/zinc/53/70/47/459537047.db2.gz	FPQDUMOQVCHUBD-QGZVFWFLSA-N	0	3	342.464	3.115	20	30		EGEDHN
C=CCN(CCc1ccco1)C(=O)NCCN1CCCC[C@@H]1CC	ZINC000497676182	459551093	/nfs/dbraw/zinc/55/10/93/459551093.db2.gz	GTNDRPCJTIFJLT-KRWDZBQOSA-N	0	3	333.476	3.284	20	30		EGEDHN
C[C@H](NCC(=O)NC1(C#N)CCC1)C(c1ccccc1)c1ccccc1	ZINC000526135869	459554899	/nfs/dbraw/zinc/55/48/99/459554899.db2.gz	MGKPYPKSPTWRED-KRWDZBQOSA-N	0	3	347.462	3.359	20	30		EGEDHN
C=CCn1cccc1C(=O)NCC1CCN(Cc2cccs2)CC1	ZINC000488981771	459557540	/nfs/dbraw/zinc/55/75/40/459557540.db2.gz	MZZDXPFTFKIIEO-UHFFFAOYSA-N	0	3	343.496	3.378	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1CN[C@@H](C)c1ccc(Br)cn1	ZINC000562439552	459561538	/nfs/dbraw/zinc/56/15/38/459561538.db2.gz	UDDQKMUZCCGMMG-ZOWXZIJZSA-N	0	3	325.250	3.476	20	30		EGEDHN
C=C[C@@H]1CCCCN1CCC(=O)Nc1cc(OC)c(OC)c(OC)c1	ZINC000489397176	459563138	/nfs/dbraw/zinc/56/31/38/459563138.db2.gz	GSWLNJSRSKLHAZ-OAHLLOKOSA-N	0	3	348.443	3.082	20	30		EGEDHN
COC[C@H](NCC(=O)Nc1sc2c(c1C#N)CCCCC2)C(C)C	ZINC000542525240	459566664	/nfs/dbraw/zinc/56/66/64/459566664.db2.gz	IBIWPWPMXDYMDZ-HNNXBMFYSA-N	0	3	349.500	3.088	20	30		EGEDHN
CCc1nc(C#N)cc(N2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)n1	ZINC000596232828	459569601	/nfs/dbraw/zinc/56/96/01/459569601.db2.gz	SVULIKFVHGAANY-OAQYLSRUSA-N	0	3	347.466	3.013	20	30		EGEDHN
C[C@@H](NCC#Cc1ccc(OC(F)(F)F)cc1)[C@@H]1CCCOC1	ZINC000542578726	459572443	/nfs/dbraw/zinc/57/24/43/459572443.db2.gz	VSBUKPDXXYCJTM-UKRRQHHQSA-N	0	3	327.346	3.341	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)NC1CCN(CC(=C)C)CC1	ZINC000592301979	459573425	/nfs/dbraw/zinc/57/34/25/459573425.db2.gz	MKLCCUPWVPKNJO-UHFFFAOYSA-N	0	3	333.501	3.486	20	30		EGEDHN
CC1(C#N)CCC(NCc2ccncc2OC[C@@H]2CCOC2)CC1	ZINC000572106854	459576247	/nfs/dbraw/zinc/57/62/47/459576247.db2.gz	NGPIEYJWLINXQO-LSJNQWAISA-N	0	3	329.444	3.059	20	30		EGEDHN
Cc1cccc(OC[C@@H](O)CN[C@@H]2CCCc3cc(C#N)ccc32)c1	ZINC000572865822	459587832	/nfs/dbraw/zinc/58/78/32/459587832.db2.gz	FCJJLWWMVVGOQA-GHTZIAJQSA-N	0	3	336.435	3.274	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H](c2cccc(C)c2)C(F)(F)F)CC1	ZINC000490933627	459591725	/nfs/dbraw/zinc/59/17/25/459591725.db2.gz	FJXCCPZYPXAOMR-INIZCTEOSA-N	0	3	338.373	3.060	20	30		EGEDHN
CC[C@H](c1ccccc1)[C@H]1CCCN1CC(=O)NC1(C#N)CCC1	ZINC000527127685	459596500	/nfs/dbraw/zinc/59/65/00/459596500.db2.gz	OZUHWPXKSRLFEZ-QZTJIDSGSA-N	0	3	325.456	3.207	20	30		EGEDHN
C#CCNC(=O)C1CCN(Cc2ccc(-c3ccccc3F)o2)CC1	ZINC000491122268	459599761	/nfs/dbraw/zinc/59/97/61/459599761.db2.gz	UZXZDXOHCGTYPH-UHFFFAOYSA-N	0	3	340.398	3.047	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cc(Cl)cc3cccnc32)CC1	ZINC000491127503	459600550	/nfs/dbraw/zinc/60/05/50/459600550.db2.gz	XAUUQGXUFGHFKJ-UHFFFAOYSA-N	0	3	327.815	3.172	20	30		EGEDHN
C#CCN(C(=O)[C@@H]1CCCN(Cc2cccnc2)C1)C1CCCCC1	ZINC000491230229	459606775	/nfs/dbraw/zinc/60/67/75/459606775.db2.gz	LHOIMNAKONCFOP-LJQANCHMSA-N	0	3	339.483	3.088	20	30		EGEDHN
C=C(C)C(C)(C)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1	ZINC000583928945	459619988	/nfs/dbraw/zinc/61/99/88/459619988.db2.gz	GWAGJVMFYLDZNS-UHFFFAOYSA-N	0	3	341.459	3.127	20	30		EGEDHN
C#C[C@H](NC[C@@H](C)c1ccc(S(C)(=O)=O)cc1)c1ccc(F)cc1	ZINC000491371557	459620953	/nfs/dbraw/zinc/62/09/53/459620953.db2.gz	FNEJUHTVXBVFTB-KUHUBIRLSA-N	0	3	345.439	3.297	20	30		EGEDHN
N#CC[C@@]1(O)CCN(CCCCc2cccc(C(F)(F)F)c2)C1	ZINC000592522284	459624153	/nfs/dbraw/zinc/62/41/53/459624153.db2.gz	KONZQNPRLKCGSS-MRXNPFEDSA-N	0	3	326.362	3.379	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(C)c(NC(C)=O)c2C)CC1	ZINC000592526812	459626994	/nfs/dbraw/zinc/62/69/94/459626994.db2.gz	CAUDCELCNSVPKK-UHFFFAOYSA-N	0	3	344.459	3.034	20	30		EGEDHN
N#CC1(NC(=O)CN[C@H](c2cccc(F)c2)C2CCCC2)CCC1	ZINC000527377914	459638311	/nfs/dbraw/zinc/63/83/11/459638311.db2.gz	FXZHNMLKUKKRSX-SFHVURJKSA-N	0	3	329.419	3.209	20	30		EGEDHN
C#CCN(C)CCCN[C@H](c1cc2ccccc2o1)c1cccnc1	ZINC000491751952	459666899	/nfs/dbraw/zinc/66/68/99/459666899.db2.gz	VGPNTKYRIAFADQ-NRFANRHFSA-N	0	3	333.435	3.462	20	30		EGEDHN
CCCN(C(=O)CCCCOc1cccc(C#N)c1)[C@H]1CCN(C)C1	ZINC000592833359	459701284	/nfs/dbraw/zinc/70/12/84/459701284.db2.gz	YXWWFPFRDHEBCB-SFHVURJKSA-N	0	3	343.471	3.050	20	30		EGEDHN
C[C@H]1CC2(CN1C(=O)C(C#N)CCc1ccccc1)CCOCC2	ZINC000592894630	459714907	/nfs/dbraw/zinc/71/49/07/459714907.db2.gz	NCSFWSMXAVDZQZ-FUHWJXTLSA-N	0	3	326.440	3.177	20	30		EGEDHN
N#C[C@@H]1CC[C@H](N[C@H]2CC(=O)N(c3cccc(C(F)(F)F)c3)C2)C1	ZINC000584389687	459723992	/nfs/dbraw/zinc/72/39/92/459723992.db2.gz	RHJWJGMWCFMUJS-XBFCOCLRSA-N	0	3	337.345	3.093	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@H]1CCN(C(C)(C)C)C1	ZINC000596677288	459724782	/nfs/dbraw/zinc/72/47/82/459724782.db2.gz	UZMJEDSVWHYOGJ-SFHVURJKSA-N	0	3	342.487	3.351	20	30		EGEDHN
CC[C@](C)(C#N)C(=O)N(C)C[C@@H]1CCN(Cc2ccc(C)s2)C1	ZINC000563266342	459750573	/nfs/dbraw/zinc/75/05/73/459750573.db2.gz	NCLFEWRLNXAPOR-MAUKXSAKSA-N	0	3	333.501	3.277	20	30		EGEDHN
CC[C@@](C)(C#N)C(=O)N(C)C[C@H]1CCN(Cc2ccc(C)s2)C1	ZINC000563266343	459750734	/nfs/dbraw/zinc/75/07/34/459750734.db2.gz	NCLFEWRLNXAPOR-QAPCUYQASA-N	0	3	333.501	3.277	20	30		EGEDHN
CCc1oc2ccccc2c1CC(=O)C(C#N)C(=O)NC1CCCC1	ZINC000528923234	459817395	/nfs/dbraw/zinc/81/73/95/459817395.db2.gz	FHPVDTWLAARXEW-MRXNPFEDSA-N	0	3	338.407	3.305	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)CN1C[C@H](c2ccccc2)[C@H]2CCC[C@H]21	ZINC000586776479	459870138	/nfs/dbraw/zinc/87/01/38/459870138.db2.gz	FNFMURZHKNLRLZ-XCJLJZCSSA-N	0	3	339.483	3.309	20	30		EGEDHN
CN(CCN1CCCCC1)C(=O)N[C@H](CCC#N)c1ccccc1	ZINC000593381965	459873434	/nfs/dbraw/zinc/87/34/34/459873434.db2.gz	FLLCOLCQQQMKBG-GOSISDBHSA-N	0	3	328.460	3.159	20	30		EGEDHN
COc1cc(CN2CC[C@H](c3ccccc3)[C@H](CO)C2)ccc1C#N	ZINC000597205433	459876612	/nfs/dbraw/zinc/87/66/12/459876612.db2.gz	FJVCCROQJSLQDO-VQTJNVASSA-N	0	3	336.435	3.165	20	30		EGEDHN
CCC(C#N)C(=O)N[C@H](CC(=O)OC)c1ccc(C(C)(C)C)cc1	ZINC000593481997	459902393	/nfs/dbraw/zinc/90/23/93/459902393.db2.gz	UXDUVOWTTPRPRF-XJKSGUPXSA-N	0	3	330.428	3.254	20	30		EGEDHN
Cc1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(CC#N)cc3)C2)cc1	ZINC000602405501	459918708	/nfs/dbraw/zinc/91/87/08/459918708.db2.gz	MTGNRYFOPGEVNJ-HXUWFJFHSA-N	0	3	348.450	3.457	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN2CCCO[C@@H](c3ccccc3)C2)c1	ZINC000609233354	459929435	/nfs/dbraw/zinc/92/94/35/459929435.db2.gz	DJQAZTVYRDWJPI-HXUWFJFHSA-N	0	3	349.434	3.350	20	30		EGEDHN
C[C@@H](CCC#N)CN1CCN(Cc2csc(C(C)(C)C)n2)CC1	ZINC000602444642	459940595	/nfs/dbraw/zinc/94/05/95/459940595.db2.gz	JYQZMBCMJQCXMD-HNNXBMFYSA-N	0	3	334.533	3.498	20	30		EGEDHN
CC(C)c1ccc(C(C)(C)NCC(=O)N[C@](C)(C#N)C2CC2)cc1	ZINC000609358183	459950182	/nfs/dbraw/zinc/95/01/82/459950182.db2.gz	PAAGWGGMCYARIE-HXUWFJFHSA-N	0	3	327.472	3.443	20	30		EGEDHN
CCCN(C[C@H](O)CC(C)(C)C#N)[C@@H](C)C(=O)Nc1ccccc1	ZINC000598594911	459956934	/nfs/dbraw/zinc/95/69/34/459956934.db2.gz	NVWGLVXFXKBCQY-DOTOQJQBSA-N	0	3	331.460	3.026	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN1CCC(Oc2ccccc2Cl)CC1	ZINC000598596551	459957381	/nfs/dbraw/zinc/95/73/81/459957381.db2.gz	LAJMZFZLPVACQB-CQSZACIVSA-N	0	3	336.863	3.484	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN[C@H](CN1CCCCC1)c1ccccc1	ZINC000598604017	459961339	/nfs/dbraw/zinc/96/13/39/459961339.db2.gz	NNRGZTRPVSNLMI-RTBURBONSA-N	0	3	329.488	3.104	20	30		EGEDHN
CN(Cc1ccc(Br)c(F)c1)C[C@@H](O)CC(C)(C)C#N	ZINC000598609826	459962391	/nfs/dbraw/zinc/96/23/91/459962391.db2.gz	KLEVNBAMGXIZDV-LBPRGKRZSA-N	0	3	343.240	3.321	20	30		EGEDHN
CC(C)N(CCC#N)C(=O)[C@H](C)N1CCC(Cc2ccccc2)CC1	ZINC000609516722	459973249	/nfs/dbraw/zinc/97/32/49/459973249.db2.gz	HRWMBSOGGLASGM-SFHVURJKSA-N	0	3	341.499	3.480	20	30		EGEDHN
COc1cc2c(cc1CN[C@H](C)CC1(C#N)CCOCC1)O[C@@H](C)C2	ZINC000602512282	459977003	/nfs/dbraw/zinc/97/70/03/459977003.db2.gz	SHPQFHOXUGCJOU-CABCVRRESA-N	0	3	344.455	3.207	20	30		EGEDHN
CCN(CC)c1ccc(CN[C@@H](C)CC2(C#N)CCOCC2)cn1	ZINC000602513791	459978392	/nfs/dbraw/zinc/97/83/92/459978392.db2.gz	CZPBQUXCNPOMGI-INIZCTEOSA-N	0	3	330.476	3.116	20	30		EGEDHN
CC(C)CN(Cc1ccc(C#N)cc1)C(=O)[C@H]1CNCc2ccccc21	ZINC000602530105	459984864	/nfs/dbraw/zinc/98/48/64/459984864.db2.gz	ORHJFUZMGMEDJE-NRFANRHFSA-N	0	3	347.462	3.430	20	30		EGEDHN
C[C@@H](CCC#N)CNCc1csc(CNC(=O)c2ccccc2)n1	ZINC000602572040	460002629	/nfs/dbraw/zinc/00/26/29/460002629.db2.gz	JKVRVTIXFVGDSP-AWEZNQCLSA-N	0	3	342.468	3.103	20	30		EGEDHN
N#Cc1cccc(CN[C@@]2(Cc3ccc(Cl)cc3)CCOC2)n1	ZINC000602659835	460048724	/nfs/dbraw/zinc/04/87/24/460048724.db2.gz	XROBSVIWOIYQEJ-GOSISDBHSA-N	0	3	327.815	3.098	20	30		EGEDHN
C[C@H](CC1(C#N)CCOCC1)NCc1ccnc(C(F)(F)F)c1	ZINC000602678133	460062068	/nfs/dbraw/zinc/06/20/68/460062068.db2.gz	CMLGBPPCKZRKOS-GFCCVEGCSA-N	0	3	327.350	3.289	20	30		EGEDHN
CCN(Cc1cccc(C(=O)OC)c1C#N)[C@H]1CCOC(C)(C)C1	ZINC000589274640	460066086	/nfs/dbraw/zinc/06/60/86/460066086.db2.gz	DTDFDEZSEUVMEI-HNNXBMFYSA-N	0	3	330.428	3.124	20	30		EGEDHN
COc1cc(CNC[C@@H](C)CCC#N)c(Br)cc1O	ZINC000602702387	460075016	/nfs/dbraw/zinc/07/50/16/460075016.db2.gz	KRYOSOPQGKURMZ-JTQLQIEISA-N	0	3	327.222	3.193	20	30		EGEDHN
COC(=O)[C@@]1(C)CN(Cc2cccc(OCCCC#N)c2)C[C@@H]1C	ZINC000602729058	460090860	/nfs/dbraw/zinc/09/08/60/460090860.db2.gz	IAAXSFTWRWJRKD-KXBFYZLASA-N	0	3	330.428	3.000	20	30		EGEDHN
C[C@@H](NC(=O)NC[C@H](C)N1CCC[C@@H](C)C1)c1cccc(C#N)c1	ZINC000610351891	460130898	/nfs/dbraw/zinc/13/08/98/460130898.db2.gz	OBLCHDLJNKWPTC-OWCLPIDISA-N	0	3	328.460	3.039	20	30		EGEDHN
C[C@@H](NC(=O)NC[C@@H](c1ccccc1)N(C)C)c1cccc(C#N)c1	ZINC000610356019	460132381	/nfs/dbraw/zinc/13/23/81/460132381.db2.gz	HLSBBTVEULCVIK-BEFAXECRSA-N	0	3	336.439	3.221	20	30		EGEDHN
C[C@@H](NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1)c1cccc(C#N)c1	ZINC000610363357	460135226	/nfs/dbraw/zinc/13/52/26/460135226.db2.gz	FSEVASMCAZIIMC-OXQOHEQNSA-N	0	3	348.450	3.043	20	30		EGEDHN
CCc1ccc([C@@H](C#N)N(C)C(=O)C2CCN(C3CC3)CC2)cc1	ZINC000589829234	460142732	/nfs/dbraw/zinc/14/27/32/460142732.db2.gz	AZJNXTRMUQJBNS-LJQANCHMSA-N	0	3	325.456	3.146	20	30		EGEDHN
CC(C)OC(=O)C[C@@H](NC(=O)C(C#N)CCc1ccccc1)C(C)C	ZINC000594407502	460208536	/nfs/dbraw/zinc/20/85/36/460208536.db2.gz	KJALXDNUNSQSOW-ZWKOTPCHSA-N	0	3	344.455	3.241	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)C[C@@H](O)COc1ccccc1C#N	ZINC000599264294	460209911	/nfs/dbraw/zinc/20/99/11/460209911.db2.gz	RXJIYAMWEMGDSO-HXUWFJFHSA-N	0	3	349.434	3.082	20	30		EGEDHN
COc1ccc2c(c1)CCN(C(=O)C(C#N)CCc1ccccc1)C2	ZINC000598224145	460212577	/nfs/dbraw/zinc/21/25/77/460212577.db2.gz	BWKRUVIINMCEIO-SFHVURJKSA-N	0	3	334.419	3.352	20	30		EGEDHN
N#CCCCC[C@@H](N)C(=O)N1CC2(CCCC2)c2c1cccc2F	ZINC000594438538	460219606	/nfs/dbraw/zinc/21/96/06/460219606.db2.gz	OHTKMEFGEYJQON-OAHLLOKOSA-N	0	3	329.419	3.395	20	30		EGEDHN
N#CCCCC[C@H](N)C(=O)N[C@@H]1CCCC[C@H]1Cc1ccccc1	ZINC000594436421	460219690	/nfs/dbraw/zinc/21/96/90/460219690.db2.gz	IZMXBWFBMXGWIX-GBESFXJTSA-N	0	3	327.472	3.315	20	30		EGEDHN
CC(C)(NC[C@@H](O)COc1ccccc1C#N)c1ccc(F)c(F)c1	ZINC000599357789	460237829	/nfs/dbraw/zinc/23/78/29/460237829.db2.gz	YUVXMYXEHXMYQW-OAHLLOKOSA-N	0	3	346.377	3.101	20	30		EGEDHN
CSc1ccccc1[C@H](C)NC[C@H](O)COc1ccccc1C#N	ZINC000599398053	460247265	/nfs/dbraw/zinc/24/72/65/460247265.db2.gz	SBOHIHDHOFVNQU-HOCLYGCPSA-N	0	3	342.464	3.371	20	30		EGEDHN
Cc1cc(Cl)c2c(c1)[C@H](NC1CCN(CC#N)CC1)CCCO2	ZINC000610863836	460250530	/nfs/dbraw/zinc/25/05/30/460250530.db2.gz	WNWIGCNXADXLSG-QGZVFWFLSA-N	0	3	333.863	3.440	20	30		EGEDHN
N#CCc1ccc(CN[C@@H](Cc2ccccc2)[C@@H](O)C(F)(F)F)cc1	ZINC000603146474	460253850	/nfs/dbraw/zinc/25/38/50/460253850.db2.gz	SGJDDOFSRMZWFJ-ZWKOTPCHSA-N	0	3	348.368	3.377	20	30		EGEDHN
CC[C@@H](CN1CCCC1)NC(=O)N[C@H](CCC#N)c1ccccc1	ZINC000610986446	460272231	/nfs/dbraw/zinc/27/22/31/460272231.db2.gz	RIPPXTOPLKDZOB-ZWKOTPCHSA-N	0	3	328.460	3.205	20	30		EGEDHN
CCCc1cc(N(C)CCCc2[nH]nc(N)c2C#N)c2ccccc2n1	ZINC000611030217	460279424	/nfs/dbraw/zinc/27/94/24/460279424.db2.gz	LSSWXAJHVUEZHU-UHFFFAOYSA-N	0	3	348.454	3.264	20	30		EGEDHN
COCc1cc(C#N)ccc1NCCCCN1C[C@@H](C)O[C@H](C)C1	ZINC000603308760	460281850	/nfs/dbraw/zinc/28/18/50/460281850.db2.gz	ITYQCHMPYUIQIF-HZPDHXFCSA-N	0	3	331.460	3.006	20	30		EGEDHN
N#Cc1cc(Cl)c(C(=O)NCCN2CCCCC2)c(Cl)c1	ZINC000611096103	460289554	/nfs/dbraw/zinc/28/95/54/460289554.db2.gz	MFFCFIRXWMUFNQ-UHFFFAOYSA-N	0	3	326.227	3.081	20	30		EGEDHN
C[C@]1(c2ccccc2)C[C@@H]1NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000619292041	460322328	/nfs/dbraw/zinc/32/23/28/460322328.db2.gz	PVNTXHLMEXSDSJ-SLYNCCJLSA-N	0	3	329.403	3.087	20	30		EGEDHN
N#Cc1ccccc1COc1cccc(CN(CCCO)C2CC2)c1	ZINC000611271612	460324810	/nfs/dbraw/zinc/32/48/10/460324810.db2.gz	QVNNRLYXWAGTQY-UHFFFAOYSA-N	0	3	336.435	3.484	20	30		EGEDHN
C[C@H](NC[C@@H](O)COCc1ccc(Cl)cc1)c1cccc(C#N)c1	ZINC000611388013	460351035	/nfs/dbraw/zinc/35/10/35/460351035.db2.gz	WCGMJPRBQIUDBW-IFXJQAMLSA-N	0	3	344.842	3.440	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2NCc1cccnc1-n1cccn1	ZINC000611390660	460352569	/nfs/dbraw/zinc/35/25/69/460352569.db2.gz	NCAUYXMNCGGZPB-IBGZPJMESA-N	0	3	329.407	3.306	20	30		EGEDHN
N#Cc1ccc2c(c1)CCCC[C@@H]2NC[C@H](O)COc1ccccc1	ZINC000619508174	460371440	/nfs/dbraw/zinc/37/14/40/460371440.db2.gz	FOSQGBVUCCSYDQ-RXVVDRJESA-N	0	3	336.435	3.355	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)NC[C@H]1Cc2ccccc21)C(C)C	ZINC000615681539	460373098	/nfs/dbraw/zinc/37/30/98/460373098.db2.gz	ALCPQEOOAHMQST-UYAOXDASSA-N	0	3	341.499	3.324	20	30		EGEDHN
CCC(C)(C)N(C)C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000619591121	460393030	/nfs/dbraw/zinc/39/30/30/460393030.db2.gz	QTCJTOLPLZWFJY-UHFFFAOYSA-N	0	3	330.476	3.162	20	30		EGEDHN
CC(C)CN(CCc1ccc(F)cc1)CC(=O)N[C@@](C)(C#N)C1CC1	ZINC000604493658	460434472	/nfs/dbraw/zinc/43/44/72/460434472.db2.gz	VQTICQOXEKDXBA-FQEVSTJZSA-N	0	3	345.462	3.135	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CNC2(c3ccc(F)cc3)CCC2)cc1	ZINC000604564426	460448602	/nfs/dbraw/zinc/44/86/02/460448602.db2.gz	HEVMZMZTNBRULD-GOSISDBHSA-N	0	3	340.398	3.106	20	30		EGEDHN
C=CCOc1c(Cl)cc(CNCC2(O)CCCC2)cc1OC	ZINC000623412642	460534970	/nfs/dbraw/zinc/53/49/70/460534970.db2.gz	UMEMOGCFDNJVKU-UHFFFAOYSA-N	0	3	325.836	3.308	20	30		EGEDHN
C[C@@H](NCc1ccnc(N2CCSCC2)c1)c1cccc(C#N)c1	ZINC000601302171	460781249	/nfs/dbraw/zinc/78/12/49/460781249.db2.gz	ITHACDXRQFDGQV-OAHLLOKOSA-N	0	3	338.480	3.357	20	30		EGEDHN
C=CCCC(C)(C)NC(=O)c1ccc(CN2CCC(CO)CC2)cc1	ZINC000620861134	460811764	/nfs/dbraw/zinc/81/17/64/460811764.db2.gz	CBGUPDNUPWGZFP-UHFFFAOYSA-N	0	3	344.499	3.366	20	30		EGEDHN
C[C@@H]1[C@@H](NC(=O)c2ccccc2CC#N)CCN1Cc1ccccc1	ZINC000601580546	460837988	/nfs/dbraw/zinc/83/79/88/460837988.db2.gz	NTDLROQXYGKPHY-UZLBHIALSA-N	0	3	333.435	3.145	20	30		EGEDHN
N#Cc1cc(F)cc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)c1	ZINC000601714188	460881173	/nfs/dbraw/zinc/88/11/73/460881173.db2.gz	SVYMEAIEYIAQGN-STQMWFEESA-N	0	3	330.281	3.383	20	30		EGEDHN
CC(C)[C@H](C#N)NC(=O)c1ccccc1OCCN1CCCC[C@@H]1C	ZINC000613370891	460924187	/nfs/dbraw/zinc/92/41/87/460924187.db2.gz	OLNCELSPRVBHTC-WMZOPIPTSA-N	0	3	343.471	3.218	20	30		EGEDHN
N#CCC1(CNC[C@@H](O)COc2cc(Cl)cc(Cl)c2)CC1	ZINC000601965415	460964128	/nfs/dbraw/zinc/96/41/28/460964128.db2.gz	NHUBWQSEKGODIE-CYBMUJFWSA-N	0	3	329.227	3.017	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@H](CO)C(C)(C)C)cc1OC	ZINC000628237812	461058716	/nfs/dbraw/zinc/05/87/16/461058716.db2.gz	ADVMVBJDZYUVJZ-OAHLLOKOSA-N	0	3	327.852	3.410	20	30		EGEDHN
C=CC[C@H](C)NC(=O)[C@@H](N)Cc1ccc(OCc2ccccc2)cc1	ZINC000662465358	461255398	/nfs/dbraw/zinc/25/53/98/461255398.db2.gz	PEYJTMHSGXZRIK-JXFKEZNVSA-N	0	3	338.451	3.216	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(C)sc2-n2cccc2)CC1	ZINC000668369365	461259519	/nfs/dbraw/zinc/25/95/19/461259519.db2.gz	VVGZWMAFOKTFDA-UHFFFAOYSA-N	0	3	329.469	3.227	20	30		EGEDHN
N#CC(C(=O)c1ccnn1CC1CCC1)c1cnc2ccccc2n1	ZINC000633980299	461368705	/nfs/dbraw/zinc/36/87/05/461368705.db2.gz	PRAAOTSEQLLIOL-CQSZACIVSA-N	0	3	331.379	3.116	20	30		EGEDHN
C=CCCn1cc(CN[C@H](Cc2ccccc2OC)C(C)C)nn1	ZINC000653614386	461760609	/nfs/dbraw/zinc/76/06/09/461760609.db2.gz	ZYHZJWUPHLCMRP-GOSISDBHSA-N	0	3	328.460	3.220	20	30		EGEDHN
C=CCCn1cc(CNCC2(c3ccccc3C)CCOCC2)nn1	ZINC000657328347	462049408	/nfs/dbraw/zinc/04/94/08/462049408.db2.gz	YJFDPNJRFXAVAB-UHFFFAOYSA-N	0	3	340.471	3.001	20	30		EGEDHN
C=CCCn1cc(CNC[C@H]2CCCO[C@H]2c2ccccc2)nn1	ZINC000657329575	462050512	/nfs/dbraw/zinc/05/05/12/462050512.db2.gz	RYHKAGMDXDCRTE-MJGOQNOKSA-N	0	3	326.444	3.112	20	30		EGEDHN
C=CCN(C[C@@H](O)COc1cccc2ccccc21)[C@@H](C)COC	ZINC000661248173	462169906	/nfs/dbraw/zinc/16/99/06/462169906.db2.gz	SVZZDSYKKPJAIC-FUHWJXTLSA-N	0	3	329.440	3.102	20	30		EGEDHN
C=CCN(C[C@H](O)COc1ccc2ccccc2c1)[C@H](C)COC	ZINC000661248125	462170205	/nfs/dbraw/zinc/17/02/05/462170205.db2.gz	SBUMSPACTYFGDU-APWZRJJASA-N	0	3	329.440	3.102	20	30		EGEDHN
C=CCN(CC(=O)NCC1(c2ccccc2)CCOCC1)C(C)(C)C	ZINC000661754915	462399165	/nfs/dbraw/zinc/39/91/65/462399165.db2.gz	HBIAYBGVELBIPH-UHFFFAOYSA-N	0	3	344.499	3.138	20	30		EGEDHN
Cc1cc(NC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)ncc1C#N	ZINC000603113543	469269033	/nfs/dbraw/zinc/26/90/33/469269033.db2.gz	PNYHEEFHPJMCLT-KSSFIOAISA-N	0	3	337.427	3.075	20	30		EGEDHN
C[C@@H](CN(C)CCC(=O)Nc1ccc(C#N)cc1)c1nccs1	ZINC000183974288	533739401	/nfs/dbraw/zinc/73/94/01/533739401.db2.gz	VVMKAWVRQUOTJZ-ZDUSSCGKSA-N	0	3	328.441	3.079	20	30		EGEDHN
C=CCN1CCC(NC(=O)CCc2c[nH]c3c2cccc3C)CC1	ZINC000172908549	526422138	/nfs/dbraw/zinc/42/21/38/526422138.db2.gz	ZDAZKRGYCDPYGT-UHFFFAOYSA-N	0	3	325.456	3.176	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(C)c(OC(F)F)c(C)c2)CC1	ZINC000171605924	526446839	/nfs/dbraw/zinc/44/68/39/526446839.db2.gz	HQEVCTHZOZLMAZ-UHFFFAOYSA-N	0	3	338.398	3.285	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2cccc3cccnc32)CC1	ZINC000171557660	526592116	/nfs/dbraw/zinc/59/21/16/526592116.db2.gz	RRJJEJBRFVLHIP-UHFFFAOYSA-N	0	3	338.455	3.075	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cnc(-c3ccco3)s2)CC1	ZINC000171728376	526603237	/nfs/dbraw/zinc/60/32/37/526603237.db2.gz	QAGOVAINEYABNR-UHFFFAOYSA-N	0	3	331.441	3.173	20	30		EGEDHN
C#CCCCCNC(=O)N(C)C1CCN(Cc2ccccc2)CC1	ZINC000154910657	526695871	/nfs/dbraw/zinc/69/58/71/526695871.db2.gz	AUROUNNFSLDVBW-UHFFFAOYSA-N	0	3	327.472	3.096	20	30		EGEDHN
C=CCC1(C(=O)NC2CCN([C@H](C)c3ccncc3)CC2)CCC1	ZINC000189687316	527051799	/nfs/dbraw/zinc/05/17/99/527051799.db2.gz	WATREDZBVDFIKF-MRXNPFEDSA-N	0	3	327.472	3.470	20	30		EGEDHN
C=CCN(CC=C)CCC(=O)Nc1cc(OC)c(Cl)cc1OC	ZINC000174647806	527642588	/nfs/dbraw/zinc/64/25/88/527642588.db2.gz	OZHWBBHQFDVEHM-UHFFFAOYSA-N	0	3	338.835	3.360	20	30		EGEDHN
CCCCN(CCO)Cc1cn(CCC#N)nc1-c1ccccc1	ZINC000159085864	528428226	/nfs/dbraw/zinc/42/82/26/528428226.db2.gz	SQCWMAZUIZXOJG-UHFFFAOYSA-N	0	3	326.444	3.058	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@H]1C[C@H](C)N(C2CC2)C1	ZINC000129972867	528937748	/nfs/dbraw/zinc/93/77/48/528937748.db2.gz	JNNWLHWKYSNGMY-YJBOKZPZSA-N	0	3	340.471	3.103	20	30		EGEDHN
CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C[C@@H](O)c1ccc(C#N)cc1	ZINC000177997741	528941896	/nfs/dbraw/zinc/94/18/96/528941896.db2.gz	LRVRHQDUXMHABS-LJQANCHMSA-N	0	3	339.395	3.410	20	30		EGEDHN
CC(C)N(Cc1cccc(F)c1)C[C@H](O)COc1ccc(C#N)cc1	ZINC000353334244	535096843	/nfs/dbraw/zinc/09/68/43/535096843.db2.gz	TYBJTMHINMDOMM-IBGZPJMESA-N	0	3	342.414	3.348	20	30		EGEDHN
Cc1cc2c(o1)CC(C)(C)C[C@@H]2[NH+]=C([O-])N[C@H]1CCc2nc[nH]c2C1	ZINC000329503132	547499621	/nfs/dbraw/zinc/49/96/21/547499621.db2.gz	ANHMHJSINJDSAS-LRDDRELGSA-N	0	3	342.443	3.386	20	30		EGEDHN
Cc1cc2c(o1)CC(C)(C)C[C@@H]2[NH+]=C([O-])N[C@H]1CCc2[nH]cnc2C1	ZINC000329503132	547499624	/nfs/dbraw/zinc/49/96/24/547499624.db2.gz	ANHMHJSINJDSAS-LRDDRELGSA-N	0	3	342.443	3.386	20	30		EGEDHN
C[C@@H]1CCCN(C(C)(C)CNC(=O)[C@@H]2CCC(=O)c3cccn32)C1	ZINC000329834203	547509072	/nfs/dbraw/zinc/50/90/72/547509072.db2.gz	GVLOPELPIJXEOP-ZBFHGGJFSA-N	0	3	331.460	3.473	20	30		EGEDHN
Cc1c(C(=O)NCCN2CCCC(C)(C)C2)nnn1CC1CCCC1	ZINC000329880844	547510000	/nfs/dbraw/zinc/51/00/00/547510000.db2.gz	NWYMJAVTVVQOKR-UHFFFAOYSA-N	0	3	347.507	3.203	20	30		EGEDHN
N#CC(C(=O)c1ccc(-n2cnc3ccccc32)cc1)c1ccncn1	ZINC000354467121	547707335	/nfs/dbraw/zinc/70/73/35/547707335.db2.gz	NSRJOYXXZLVWON-INIZCTEOSA-N	0	3	339.358	3.306	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)C(=O)N[C@H](CC)CN1CCCC1	ZINC000675193332	548869546	/nfs/dbraw/zinc/86/95/46/548869546.db2.gz	BTLXTMHJYKWVNX-GOSISDBHSA-N	0	3	345.487	3.267	20	30		EGEDHN
C=CCCOCCNC(=O)N[C@@H](CN1CCCCC1)c1ccccc1	ZINC000677477170	549277410	/nfs/dbraw/zinc/27/74/10/549277410.db2.gz	TWIGGSSCGTWVNR-IBGZPJMESA-N	0	3	345.487	3.106	20	30		EGEDHN
C=C[C@@H](CC(=O)N1CCCN(C[C@H]2CCCO2)CC1)c1ccccc1	ZINC000677528384	549286602	/nfs/dbraw/zinc/28/66/02/549286602.db2.gz	VTIBOMAABJWSBQ-AZUAARDMSA-N	0	3	342.483	3.060	20	30		EGEDHN
CC#CCCNC(=O)c1ccccc1OCCN1CCCC[C@H]1C	ZINC000680457238	549867367	/nfs/dbraw/zinc/86/73/67/549867367.db2.gz	QVTTTWONJNDIDU-QGZVFWFLSA-N	0	3	328.456	3.083	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)NC[C@H](C)N1CCCCC1	ZINC000727225474	574655002	/nfs/dbraw/zinc/65/50/02/574655002.db2.gz	AFPAIGYFKSYCNT-KRWDZBQOSA-N	0	3	342.487	3.353	20	30		EGEDHN
COc1ccccc1OCCNCc1ccc(O[C@@H](C)C#N)cc1	ZINC000728713054	574767750	/nfs/dbraw/zinc/76/77/50/574767750.db2.gz	IUPUMEVKDNYOAX-HNNXBMFYSA-N	0	3	326.396	3.155	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]\CCCN2CCCCC2=O)c([O-])c1	ZINC000730146866	574925326	/nfs/dbraw/zinc/92/53/26/574925326.db2.gz	HMTSPOAKELYYCS-HKWRFOASSA-N	0	3	331.460	3.060	20	30		EGEDHN
C[C@@H](NC(=O)C(C)(C)C)C(=O)C(C#N)c1nc2cc(F)ccc2s1	ZINC000730416493	574984413	/nfs/dbraw/zinc/98/44/13/574984413.db2.gz	DPWOQGGRVJNXMY-MWLCHTKSSA-N	0	3	347.415	3.162	20	30		EGEDHN
Cc1cc(C#N)ccc1Oc1ccc(C(=O)N2CCN3CC[C@H]2C3)cc1	ZINC000597709438	574985903	/nfs/dbraw/zinc/98/59/03/574985903.db2.gz	XSIUWVQCMPJQMC-SFHVURJKSA-N	0	3	347.418	3.189	20	30		EGEDHN
C#CCOc1ccc(NC(=O)NC[C@H](C)N2CCCC[C@@H]2C)cc1	ZINC000731114605	575055473	/nfs/dbraw/zinc/05/54/73/575055473.db2.gz	IYTDXNPXMAMHKI-HOTGVXAUSA-N	0	3	329.444	3.083	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)c2cc(F)cc([N+](=O)[O-])c2)c1	ZINC000731545802	575080171	/nfs/dbraw/zinc/08/01/71/575080171.db2.gz	FFOMKWNBDOUFAG-OAHLLOKOSA-N	0	3	341.298	3.004	20	30		EGEDHN
C=CCN(C(=O)CCCN1CCN(c2ccccc2)CC1)C(C)C	ZINC000731969510	575227695	/nfs/dbraw/zinc/22/76/95/575227695.db2.gz	LZDFXJOJPMCSLX-UHFFFAOYSA-N	0	3	329.488	3.012	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)/C=C/c1cnc(C)s1)C(C)C	ZINC000733161808	575312434	/nfs/dbraw/zinc/31/24/34/575312434.db2.gz	QDBUNLCCFHGIAM-KBOKABMXSA-N	0	3	333.501	3.280	20	30		EGEDHN
C#CCCOc1ccc(C[NH2+]Cc2nnc(-c3ccccc3)[n-]2)cc1	ZINC000733900970	575407531	/nfs/dbraw/zinc/40/75/31/575407531.db2.gz	UFUCSYHILLVVAU-UHFFFAOYSA-N	0	3	332.407	3.164	20	30		EGEDHN
C=CC[C@H](NC(=O)NC[C@@H](C)N1CCC[C@H](C)C1)c1ccncc1	ZINC000734658555	575532780	/nfs/dbraw/zinc/53/27/80/575532780.db2.gz	JJNWOMABWVLMHW-JZXOWHBKSA-N	0	3	330.476	3.118	20	30		EGEDHN
C[C@@H](CNC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1)C(C)(C)C	ZINC000734674408	575540201	/nfs/dbraw/zinc/54/02/01/575540201.db2.gz	VEWGARFJXOJLIM-INIZCTEOSA-N	0	3	344.503	3.314	20	30		EGEDHN
CC(N=Nc1cccnn1)c1ccc([O-])c(C[NH+]2CCCCC2)c1	ZINC000735973351	575745471	/nfs/dbraw/zinc/74/54/71/575745471.db2.gz	GRCOCUVCUDNLGX-UHFFFAOYSA-N	0	3	325.416	3.004	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2ccc(OC3CCCC3)cc2)CC1	ZINC000740737677	576621983	/nfs/dbraw/zinc/62/19/83/576621983.db2.gz	IJVUHAFPOIVMPA-UHFFFAOYSA-N	0	3	340.467	3.226	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)C(C#N)C(=O)Nc1c(CC)cccc1CC	ZINC000743450167	576809435	/nfs/dbraw/zinc/80/94/35/576809435.db2.gz	XTWGQDMRMPYJGL-YOEHRIQHSA-N	0	3	342.439	3.440	20	30		EGEDHN
C#CCCN1CCC(NC(=O)C(C)(C)Oc2cccc(Cl)c2)CC1	ZINC000743489588	576810226	/nfs/dbraw/zinc/81/02/26/576810226.db2.gz	HVTVLRLXJNJPDC-UHFFFAOYSA-N	0	3	348.874	3.101	20	30		EGEDHN
C#CCCN1CCC(NC(=O)C[C@@H](c2ccccc2)C(C)C)CC1	ZINC000743491825	576810330	/nfs/dbraw/zinc/81/03/30/576810330.db2.gz	MLIGYRIQXKWOPX-HXUWFJFHSA-N	0	3	326.484	3.420	20	30		EGEDHN
CC(N=Nc1nncc2ccccc21)c1cccc(OCCN(C)C)c1	ZINC000743525809	576811050	/nfs/dbraw/zinc/81/10/50/576811050.db2.gz	KRWCFHIOYJNXBH-UHFFFAOYSA-N	0	3	349.438	3.406	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)[C@H](C)c1ccccc1C(F)(F)F	ZINC000744032091	576819300	/nfs/dbraw/zinc/81/93/00/576819300.db2.gz	BZIUEEBZLSNDEK-PWSUYJOCSA-N	0	3	326.318	3.042	20	30		EGEDHN
C[C@H]1CCCN(Cc2cc(=O)n3c4ccccc4[nH]c3c2C#N)CC1	ZINC000745170919	576842867	/nfs/dbraw/zinc/84/28/67/576842867.db2.gz	VAGPJTGWUKZCKH-HOCLYGCPSA-N	0	3	334.423	3.346	20	30		EGEDHN
N#Cc1cccc([C@@H](NCc2ccc(C[NH+]3CCCC3)cc2)C(=O)[O-])c1	ZINC000833076160	601298724	/nfs/dbraw/zinc/29/87/24/601298724.db2.gz	RBTLECQMQOPABH-HXUWFJFHSA-N	0	3	349.434	3.070	20	30		EGEDHN
Cc1cc(Br)cc(C)c1NC(=O)[C@@H](N)CCCCC#N	ZINC000691554137	1298135936	/nfs/dbraw/zinc/13/59/36/1298135936.db2.gz	MSBOPEYSNSSMHP-ZDUSSCGKSA-N	0	3	338.249	3.416	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)c1nc2ccccc2o1)NC(=O)c1ccccc1	ZINC000041542779	1291419194	/nfs/dbraw/zinc/41/91/94/1291419194.db2.gz	OTBNVGKFKGQANB-ZFWWWQNUSA-N	0	3	347.374	3.213	20	30		EGEDHN
N#CCOc1ccc(CNCc2cc(Cl)c3c(c2)OCCO3)cc1	ZINC000078878011	1292530881	/nfs/dbraw/zinc/53/08/81/1292530881.db2.gz	UQKCILWRRKDWJF-UHFFFAOYSA-N	0	3	344.798	3.303	20	30		EGEDHN
Cc1nc(C)c(C(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)s1	ZINC000100949169	1292966254	/nfs/dbraw/zinc/96/62/54/1292966254.db2.gz	ZRUBJGCOCRKYMB-LBPRGKRZSA-N	0	3	333.800	3.375	20	30		EGEDHN
CS[C@@H](C)C(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000103330230	1293002755	/nfs/dbraw/zinc/00/27/55/1293002755.db2.gz	AAILXGGFDCQSPQ-CBAPKCEASA-N	0	3	331.224	3.392	20	30		EGEDHN
C=CC1CCN(Cc2cc(=O)oc3cc(NC(C)=O)ccc23)CC1	ZINC000111256803	1293102091	/nfs/dbraw/zinc/10/20/91/1293102091.db2.gz	KXAWORGMCROVHO-UHFFFAOYSA-N	0	3	326.396	3.149	20	30		EGEDHN
CC1(C)CCCN(Cc2cc(=O)n3c4ccccc4[nH]c3c2C#N)C1	ZINC000112702050	1293131667	/nfs/dbraw/zinc/13/16/67/1293131667.db2.gz	CSLDLVJSMBLVMH-HNNXBMFYSA-N	0	3	334.423	3.346	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@@H]1C[C@@H]1c1c(F)cccc1F	ZINC000116592001	1293208089	/nfs/dbraw/zinc/20/80/89/1293208089.db2.gz	WEEQKJBKNLICKD-YNEHKIRRSA-N	0	3	334.366	3.084	20	30		EGEDHN
C[C@H](CC(=O)C(C#N)C(=O)Nc1ccccn1)c1cccc(F)c1	ZINC000116593553	1293208277	/nfs/dbraw/zinc/20/82/77/1293208277.db2.gz	IQQUANVPLNOURU-IUODEOHRSA-N	0	3	325.343	3.062	20	30		EGEDHN
C=C(C)COc1cc(CNCC[S@](=O)C(C)(C)C)ccc1OC	ZINC000116921887	1293210999	/nfs/dbraw/zinc/21/09/99/1293210999.db2.gz	PYRHOZVNIQMRJJ-HSZRJFAPSA-N	0	3	339.501	3.287	20	30		EGEDHN
N#CC(C(=O)CCSc1ccc2c(c1)OCCO2)c1ccccn1	ZINC000121644882	1293382364	/nfs/dbraw/zinc/38/23/64/1293382364.db2.gz	VGNDREWYGFPPAM-AWEZNQCLSA-N	0	3	340.404	3.211	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000836191899	1293457932	/nfs/dbraw/zinc/45/79/32/1293457932.db2.gz	AHKMJGMKRCFTTK-ZDUSSCGKSA-N	0	3	341.377	3.021	20	30		EGEDHN
N#CC(C(=O)CSc1ccccc1Cl)C(=O)Nc1ccccn1	ZINC000125119348	1293496971	/nfs/dbraw/zinc/49/69/71/1293496971.db2.gz	SAQPOYMBMLHTTI-LLVKDONJSA-N	0	3	345.811	3.175	20	30		EGEDHN
C[C@H](Oc1ccc(F)c(F)c1)C(=O)C(C#N)C(=O)Nc1ccccc1	ZINC000129858566	1293637315	/nfs/dbraw/zinc/63/73/15/1293637315.db2.gz	WEBOTVMKJMFSID-FZMZJTMJSA-N	0	3	344.317	3.080	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)CC(c1ccccc1)c1ccccc1	ZINC000130548929	1293661448	/nfs/dbraw/zinc/66/14/48/1293661448.db2.gz	XRAXSBKZKSGNBY-IBGZPJMESA-N	0	3	334.419	3.442	20	30		EGEDHN
Cc1ccc(N(CCC#N)C(=O)[C@H](C)N2C[C@@H]3CCC[C@@H]3C2)cc1	ZINC000152848981	1293987331	/nfs/dbraw/zinc/98/73/31/1293987331.db2.gz	QLTNPLTTZKBZSE-OKZBNKHCSA-N	0	3	325.456	3.362	20	30		EGEDHN
CC(C)(C)SCCCC(=O)C(C#N)C(=O)NCc1ccccc1	ZINC000155107873	1294084646	/nfs/dbraw/zinc/08/46/46/1294084646.db2.gz	ZOYLKOFFALZMLQ-OAHLLOKOSA-N	0	3	332.469	3.324	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)C[C@@H](C)SC)cc1Cl	ZINC000156353810	1294140498	/nfs/dbraw/zinc/14/04/98/1294140498.db2.gz	MSFUIMHQGUJPEQ-KOLCDFICSA-N	0	3	340.832	3.138	20	30		EGEDHN
CC[C@H](SC)C(=O)C(C#N)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000156512597	1294147377	/nfs/dbraw/zinc/14/73/77/1294147377.db2.gz	RJXLGYXZWXUOKA-CABZTGNLSA-N	0	3	328.796	3.268	20	30		EGEDHN
N#CC(C(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)[C@@H]1CCCOC1	ZINC000171037118	1294391488	/nfs/dbraw/zinc/39/14/88/1294391488.db2.gz	ZDJOHBUIQFYFES-RNCFNFMXSA-N	0	3	341.194	3.067	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(Cl)cc1Cl)C(=O)[C@@H]1CCCOC1	ZINC000171036684	1294392057	/nfs/dbraw/zinc/39/20/57/1294392057.db2.gz	RQAKUCCKIHXMHH-KOLCDFICSA-N	0	3	341.194	3.067	20	30		EGEDHN
C[C@@H](CNC(=O)/C=C/c1ccccc1C#N)N(C)Cc1ccccc1	ZINC000171880691	1294421373	/nfs/dbraw/zinc/42/13/73/1294421373.db2.gz	HKTMYVYMTBFSPV-UJGDBWEASA-N	0	3	333.435	3.208	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)CCC2CCOCC2)cc1	ZINC000173968725	1294475483	/nfs/dbraw/zinc/47/54/83/1294475483.db2.gz	ISOXOKPSMAYPNS-KRWDZBQOSA-N	0	3	328.412	3.103	20	30		EGEDHN
N#CC(C(=O)CC[C@@H]1CCOC1)c1nc2ccccc2n1C(F)F	ZINC000176100153	1294591062	/nfs/dbraw/zinc/59/10/62/1294591062.db2.gz	QGABUFOTFUMPAO-NEPJUHHUSA-N	0	3	333.338	3.424	20	30		EGEDHN
CC[C@@H](NC(C)=O)C(=O)C(C#N)c1nc(-c2ccc(C)cc2)cs1	ZINC000870150027	1295707761	/nfs/dbraw/zinc/70/77/61/1295707761.db2.gz	POUMCPNDFOWWBP-LSDHHAIUSA-N	0	3	341.436	3.210	20	30		EGEDHN
CC[C@H](C)c1ccc(NC(=O)C(C#N)C(=O)COCC2CC2)cc1	ZINC000193492964	1295876426	/nfs/dbraw/zinc/87/64/26/1295876426.db2.gz	QVHBUXDRKMNCHD-GUYCJALGSA-N	0	3	328.412	3.274	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CNCc2ccc(N3CCCC3=O)cc2)cc1	ZINC000237598981	1296252233	/nfs/dbraw/zinc/25/22/33/1296252233.db2.gz	PWLKRGRMCFLTGE-MRXNPFEDSA-N	0	3	349.434	3.394	20	30		EGEDHN
C=C(C)CNCc1cc(Br)cc(Br)c1N	ZINC000308803232	1297070880	/nfs/dbraw/zinc/07/08/80/1297070880.db2.gz	ACAVLLSFKFNTHC-UHFFFAOYSA-N	0	3	334.055	3.460	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2Cc3ccccc3[C@@H](C)C2)CC1	ZINC000872882037	1297153941	/nfs/dbraw/zinc/15/39/41/1297153941.db2.gz	SBACENSANOQXGC-INIZCTEOSA-N	0	3	327.472	3.356	20	30		EGEDHN
COc1ccccc1OCCN(C)Cc1ccc(C#N)c(OC)c1	ZINC000442808799	1297855071	/nfs/dbraw/zinc/85/50/71/1297855071.db2.gz	ILXLDQPLCBJNQR-UHFFFAOYSA-N	0	3	326.396	3.086	20	30		EGEDHN
C[C@@H](C(=O)C(C#N)C(=O)NC1CC1)c1ccc(Cl)c(Cl)c1	ZINC000747107691	1298728396	/nfs/dbraw/zinc/72/83/96/1298728396.db2.gz	AJGYKPMXVKTGSY-LDYMZIIASA-N	0	3	325.195	3.084	20	30		EGEDHN
Cc1ccc2c(c1)[C@H]1CN(C)CC[C@@H]1N2C(=O)c1ccc(C#N)s1	ZINC000749315244	1299191908	/nfs/dbraw/zinc/19/19/08/1299191908.db2.gz	COWNTHUYMZLENM-WBVHZDCISA-N	0	3	337.448	3.376	20	30		EGEDHN
Cc1ccc(C[NH2+]C2CCN(Cc3cccc(C#N)c3)CC2)c([O-])c1	ZINC000877614449	1299433634	/nfs/dbraw/zinc/43/36/34/1299433634.db2.gz	DHTVNIOSVVKOOK-UHFFFAOYSA-N	0	3	335.451	3.327	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN2CC[C@H](OCc3ccccn3)C2)cc1	ZINC000877645747	1299452599	/nfs/dbraw/zinc/45/25/99/1299452599.db2.gz	VGFGZIQCSIDOJA-UZLBHIALSA-N	0	3	337.423	3.164	20	30		EGEDHN
COc1ccc(N2CCN(CC(C)(C)CCC#N)CC2)c(OC)c1	ZINC000877708229	1299498237	/nfs/dbraw/zinc/49/82/37/1299498237.db2.gz	FPDSDOBSNNHGKC-UHFFFAOYSA-N	0	3	331.460	3.156	20	30		EGEDHN
Cc1nc2sc3c(c2c(N=NC2CN(C)C[C@@H]2C)n1)CCCC3	ZINC000752157767	1299704240	/nfs/dbraw/zinc/70/42/40/1299704240.db2.gz	CHQFSILDTRFOCD-JTQLQIEISA-N	0	3	329.473	3.228	20	30		EGEDHN
CC(=O)[C@](C#N)(CCN1CCCC[C@@H]1C[C@H](C)O)c1ccccc1	ZINC000878532613	1300055602	/nfs/dbraw/zinc/05/56/02/1300055602.db2.gz	UQZLTWHFPQHOGH-PWIZWCRZSA-N	0	3	328.456	3.052	20	30		EGEDHN
CCC1(C(=O)C(C#N)c2nc(-c3ccc(OC)cc3)cs2)COC1	ZINC000756243748	1300456677	/nfs/dbraw/zinc/45/66/77/1300456677.db2.gz	MSUOVRPXYCGBDZ-CQSZACIVSA-N	0	3	342.420	3.422	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN[C@@H]2CC(=O)N(C3CCCCC3)C2)cc1	ZINC000757925003	1300757942	/nfs/dbraw/zinc/75/79/42/1300757942.db2.gz	QHPDQDXFNRMFHY-NVXWUHKLSA-N	0	3	341.455	3.001	20	30		EGEDHN
Cc1cc(C(=O)C(C#N)c2ccncn2)c(C)n1Cc1ccccc1	ZINC000760333646	1301255269	/nfs/dbraw/zinc/25/52/69/1301255269.db2.gz	LZFPHVATQZGCQK-SFHVURJKSA-N	0	3	330.391	3.433	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)Cc3ccccc3CC#N)nc21	ZINC000761106570	1301404841	/nfs/dbraw/zinc/40/48/41/1301404841.db2.gz	JHDNTLOQTWUOSP-MRXNPFEDSA-N	0	3	328.375	3.356	20	30		EGEDHN
Cc1ccc(N(CCC#N)C(=O)[C@H](C)N2CC[C@@H](C3CC3)C2)cc1	ZINC000764482899	1302070324	/nfs/dbraw/zinc/07/03/24/1302070324.db2.gz	COUZGFDOPXDTQT-FUHWJXTLSA-N	0	3	325.456	3.362	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)cc1)c1ccc(N2CCOCC2)c(F)c1	ZINC000765013265	1302184356	/nfs/dbraw/zinc/18/43/56/1302184356.db2.gz	RXQPWZQLMMSQJW-OAHLLOKOSA-N	0	3	339.414	3.385	20	30		EGEDHN
C=CCOc1cccc(NC(=O)NC[C@@H]2CCCCN2C2CC2)c1	ZINC000765665956	1302298693	/nfs/dbraw/zinc/29/86/93/1302298693.db2.gz	FGYASVSKNMXQRK-KRWDZBQOSA-N	0	3	329.444	3.390	20	30		EGEDHN
COc1cccc(CN2CCC(Nc3nc(C)ccc3C#N)CC2)c1	ZINC000766402705	1302445222	/nfs/dbraw/zinc/44/52/22/1302445222.db2.gz	PCOMXLXJXIPUDL-UHFFFAOYSA-N	0	3	336.439	3.347	20	30		EGEDHN
N#C[C@H]1CNCC12CC(C(=O)Nc1ccc(SC(F)F)cc1)C2	ZINC000884042782	1302707694	/nfs/dbraw/zinc/70/76/94/1302707694.db2.gz	HZLAVBNCNWYFNS-CSJGVYOVSA-N	0	3	337.395	3.079	20	30		EGEDHN
Cc1cccc([C@@H](NC(=O)C2CC3(C2)CNC[C@@H]3C#N)C(C)(C)C)c1	ZINC000884159692	1302758270	/nfs/dbraw/zinc/75/82/70/1302758270.db2.gz	KLWRLUQBPPSMIJ-UISNHOIMSA-N	0	3	339.483	3.338	20	30		EGEDHN
C=CCC1(O)CCN(Cc2ccc(OC[C@@H]3CCCO3)cc2)CC1	ZINC000886776281	1303594815	/nfs/dbraw/zinc/59/48/15/1303594815.db2.gz	BIMVVNJJGLEXNU-IBGZPJMESA-N	0	3	331.456	3.147	20	30		EGEDHN
CC(C)[C@H](CNCc1ccc(C#N)cc1F)NC(=O)OC(C)(C)C	ZINC000772920692	1303595700	/nfs/dbraw/zinc/59/57/00/1303595700.db2.gz	IPOAKAASSNVSOK-INIZCTEOSA-N	0	3	335.423	3.336	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](C)c2ccc(N(C)C)cc2)CC1	ZINC000773287546	1303655808	/nfs/dbraw/zinc/65/58/08/1303655808.db2.gz	UUQISFFZYAFIDN-MRXNPFEDSA-N	0	3	344.503	3.153	20	30		EGEDHN
C#C[C@H](N[C@H](C)CC(=O)Nc1ccc(C)c(Cl)c1)[C@H]1CCCO1	ZINC000775573688	1303987425	/nfs/dbraw/zinc/98/74/25/1303987425.db2.gz	JBNLBDPHCWHTEK-XOKHGSTOSA-N	0	3	334.847	3.136	20	30		EGEDHN
CCN(C(=O)Nc1ccc(C#N)cn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000889233146	1304421223	/nfs/dbraw/zinc/42/12/23/1304421223.db2.gz	RRWCWLGMSBTXIG-SFHVURJKSA-N	0	3	349.438	3.082	20	30		EGEDHN
CC(C)Cn1ccc(C([O-])=C(C#N)C(=O)Nc2ccccc2Cl)n1	ZINC000892488987	1305401586	/nfs/dbraw/zinc/40/15/86/1305401586.db2.gz	BPBUWNAMFGWUIW-GFCCVEGCSA-N	0	3	344.802	3.154	20	30		EGEDHN
CC(C)Cn1ccc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)n1	ZINC000892488987	1305401591	/nfs/dbraw/zinc/40/15/91/1305401591.db2.gz	BPBUWNAMFGWUIW-GFCCVEGCSA-N	0	3	344.802	3.154	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(Cl)cc1)C(=O)[C@H]1CCOC2(CCC2)C1	ZINC000892493779	1305405203	/nfs/dbraw/zinc/40/52/03/1305405203.db2.gz	RWWRDHQROPDMJE-SWLSCSKDSA-N	0	3	346.814	3.337	20	30		EGEDHN
C=C1CCC(C(=O)C(C#N)C(=O)Nc2ccccc2OCC)CC1	ZINC000892497796	1305408336	/nfs/dbraw/zinc/40/83/36/1305408336.db2.gz	XWLPWJMUBPHOKZ-HNNXBMFYSA-N	0	3	326.396	3.479	20	30		EGEDHN
N#CC(C(=O)Nc1ccccn1)C(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1	ZINC000786331310	1305557900	/nfs/dbraw/zinc/55/79/00/1305557900.db2.gz	ZUQAKMMGUFSHHU-MXWKQRLJSA-N	0	3	345.811	3.248	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)NC[C@@H]1Cc2ccccc2CN1	ZINC000892814750	1305564143	/nfs/dbraw/zinc/56/41/43/1305564143.db2.gz	USVJHZSIFZXARQ-KRWDZBQOSA-N	0	3	341.480	3.160	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)NC[C@H]1Cc2ccccc2CN1	ZINC000892814751	1305564299	/nfs/dbraw/zinc/56/42/99/1305564299.db2.gz	USVJHZSIFZXARQ-QGZVFWFLSA-N	0	3	341.480	3.160	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)[C@@H]3CC(=O)c4ccccc43)nc21	ZINC000789376511	1306149619	/nfs/dbraw/zinc/14/96/19/1306149619.db2.gz	AAEULFWGKQQGBI-CABCVRRESA-N	0	3	329.359	3.418	20	30		EGEDHN
Cc1cccc2nc(C(C#N)C(=O)[C@@H]3CC(=O)c4ccccc43)[nH]c21	ZINC000789376511	1306149622	/nfs/dbraw/zinc/14/96/22/1306149622.db2.gz	AAEULFWGKQQGBI-CABCVRRESA-N	0	3	329.359	3.418	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)c(F)c1)c1ccc(N2CCOCC2)cc1	ZINC000792275879	1309154624	/nfs/dbraw/zinc/15/46/24/1309154624.db2.gz	FDRZAWDXPFTZHF-OAHLLOKOSA-N	0	3	339.414	3.385	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/CC2CCN(C(=O)OC)CC2)c([O-])c1	ZINC000794675406	1309569685	/nfs/dbraw/zinc/56/96/85/1309569685.db2.gz	AJCOOQNSQUCTAX-XSFVSMFZSA-N	0	3	347.459	3.136	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@@H](C)[C@@H]1OCCc2sccc21	ZINC000796739803	1310077347	/nfs/dbraw/zinc/07/73/47/1310077347.db2.gz	GDRVHFHBTHPGHH-MRRJBJDNSA-N	0	3	348.468	3.013	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(Cl)cc1)C(=O)c1occ2c1CCC2	ZINC000796781402	1310087060	/nfs/dbraw/zinc/08/70/60/1310087060.db2.gz	XYXXPBINAIYZGU-CQSZACIVSA-N	0	3	328.755	3.383	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)CCCOC(C)(C)C	ZINC000796796483	1310089134	/nfs/dbraw/zinc/08/91/34/1310089134.db2.gz	FCEIUFMUJUCWRI-CQSZACIVSA-N	0	3	346.427	3.328	20	30		EGEDHN
C[C@H](NCC1(CC#N)CC1)c1ccc(S(=O)(=O)C(F)F)cc1	ZINC000797586734	1310213372	/nfs/dbraw/zinc/21/33/72/1310213372.db2.gz	LMBQSLLPINUARM-NSHDSACASA-N	0	3	328.384	3.027	20	30		EGEDHN
[NH3+]CC[C@@H]([N-]C(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1)C(F)(F)F	ZINC000817995035	1319488466	/nfs/dbraw/zinc/48/84/66/1319488466.db2.gz	SPSCIYAHFTWHPX-ZJUUUORDSA-N	0	3	346.246	3.112	20	30		EGEDHN
C=CCN1CC[C@H](N(C)Cc2cc(-c3ccccc3)ccc2O)C1=O	ZINC000798956723	1310463646	/nfs/dbraw/zinc/46/36/46/1310463646.db2.gz	LGLARFNENKRNQO-IBGZPJMESA-N	0	3	336.435	3.278	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N(CCC)[C@H]1CCc2ccccc21	ZINC000836489068	1320493722	/nfs/dbraw/zinc/49/37/22/1320493722.db2.gz	UNRNFJAEAABTMK-IBGZPJMESA-N	0	3	327.472	3.051	20	30		EGEDHN
N#Cc1cc(CN[C@H]2CCN(C(=O)C[C@@H]3C=CCCC3)C2)ccc1F	ZINC001019029377	1317013335	/nfs/dbraw/zinc/01/33/35/1317013335.db2.gz	UXMSAIBGYXXEQH-QAPCUYQASA-N	0	3	341.430	3.134	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)C1)C(C)(C)C	ZINC001019042166	1317019360	/nfs/dbraw/zinc/01/93/60/1317019360.db2.gz	ACPHQKFEVHOAQY-BBRMVZONSA-N	0	3	331.435	3.070	20	30		EGEDHN
CCCN(CCN1CCCCC1)C(=O)c1ccc(C=NOC)cc1	ZINC000804567858	1317261367	/nfs/dbraw/zinc/26/13/67/1317261367.db2.gz	YWDOFSPXOYUNQI-UHFFFAOYSA-N	0	3	331.460	3.005	20	30		EGEDHN
CCCc1occc1C(=O)N1CC[C@H](NCc2ccc(C#N)s2)C1	ZINC001019650898	1317318207	/nfs/dbraw/zinc/31/82/07/1317318207.db2.gz	TVBXJDXNGBSVQS-ZDUSSCGKSA-N	0	3	343.452	3.170	20	30		EGEDHN
CCC(=O)N1CCC2(CCN(Cc3ccccc3C#N)CC2)CC1	ZINC000957481505	1317390111	/nfs/dbraw/zinc/39/01/11/1317390111.db2.gz	HEYVDFIYAFCQAR-UHFFFAOYSA-N	0	3	325.456	3.173	20	30		EGEDHN
N#Cc1cc(CN[C@H]2CCN(C(=O)C3CCC=CCC3)C2)ccc1F	ZINC001019787672	1317421171	/nfs/dbraw/zinc/42/11/71/1317421171.db2.gz	YIIQNCIBAOXSQF-SFHVURJKSA-N	0	3	341.430	3.134	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1)=C([O-])c1ccc(C[NH+]2CCCC2)cc1	ZINC000805852990	1317432093	/nfs/dbraw/zinc/43/20/93/1317432093.db2.gz	DLGCNCPUCUSPIR-LJQANCHMSA-N	0	3	347.418	3.244	20	30		EGEDHN
N#C[C@@H](C(=O)Nc1ccccc1)C(=O)c1ccc(CN2CCCC2)cc1	ZINC000805852990	1317432100	/nfs/dbraw/zinc/43/21/00/1317432100.db2.gz	DLGCNCPUCUSPIR-LJQANCHMSA-N	0	3	347.418	3.244	20	30		EGEDHN
CC[C@@H](C)N[C@@H](CNC(=O)Cc1ccccc1CC#N)c1ccco1	ZINC000807679230	1317576115	/nfs/dbraw/zinc/57/61/15/1317576115.db2.gz	GIJQJSYCWOEDGJ-QAPCUYQASA-N	0	3	339.439	3.134	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)cc1C#N	ZINC000807738789	1317581673	/nfs/dbraw/zinc/58/16/73/1317581673.db2.gz	GVKPKQQCVMBSSN-OXJNMPFZSA-N	0	3	333.435	3.260	20	30		EGEDHN
CC[C@H](N[C@H]1CCN(Cc2ccccc2)C1=O)c1cccc(C#N)c1	ZINC000902853077	1317624265	/nfs/dbraw/zinc/62/42/65/1317624265.db2.gz	JBXCYARCSREIIV-PMACEKPBSA-N	0	3	333.435	3.400	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc(C3CC3)[nH]c2C2CC2)C1	ZINC001020291274	1317628896	/nfs/dbraw/zinc/62/88/96/1317628896.db2.gz	BKWUUVHPKKPPSM-HDJSIYSDSA-N	0	3	333.863	3.372	20	30		EGEDHN
C#CCOc1ccc(CN[C@H](CN(C)C)c2ccc(F)cc2)cc1	ZINC000808426943	1317675263	/nfs/dbraw/zinc/67/52/63/1317675263.db2.gz	ZNCLEISIQWWQCG-HXUWFJFHSA-N	0	3	326.415	3.230	20	30		EGEDHN
CC1(C)CCC[C@@H]1C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001020478158	1317713505	/nfs/dbraw/zinc/71/35/05/1317713505.db2.gz	BZPVBJTXAZUURD-BRWVUGGUSA-N	0	3	343.446	3.260	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)c2ccnc(C(F)(F)F)c2)c1	ZINC000808979472	1317756156	/nfs/dbraw/zinc/75/61/56/1317756156.db2.gz	IYQWBGDHFUUQQM-ZDUSSCGKSA-N	0	3	347.296	3.370	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@H](NCc3cc(F)ccc3F)C2)CC1	ZINC001020544173	1317758782	/nfs/dbraw/zinc/75/87/82/1317758782.db2.gz	LFEGSCQXOBUSAH-QAQDUYKDSA-N	0	3	334.410	3.448	20	30		EGEDHN
CCCOc1ccc(/C=C2/C(=O)c3ncnn3C2C)cc1OCC	ZINC000905080932	1317920117	/nfs/dbraw/zinc/92/01/17/1317920117.db2.gz	OKNUWRBUGFMBFP-ZMTLZGASSA-N	0	3	327.384	3.307	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)[C@@H]2C[C@]2(CC)C(C)C)C1	ZINC001020853564	1317956914	/nfs/dbraw/zinc/95/69/14/1317956914.db2.gz	RUXOXTHUCJWINC-RZLSGREXSA-N	0	3	343.309	3.204	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2[nH]ccc2-c2ccccc2)C1	ZINC001020918008	1317997840	/nfs/dbraw/zinc/99/78/40/1317997840.db2.gz	UETNQJDVRGFQGS-SHTZXODSSA-N	0	3	329.831	3.285	20	30		EGEDHN
C[C@@H](N[C@@H](C)COCC1CCCCC1)C(=O)Nc1ccccc1C#N	ZINC000905857841	1318009853	/nfs/dbraw/zinc/00/98/53/1318009853.db2.gz	IEVVGXIBLITEJH-JKSUJKDBSA-N	0	3	343.471	3.460	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1	ZINC000810456048	1318011370	/nfs/dbraw/zinc/01/13/70/1318011370.db2.gz	GSJRIJAUTPUMSU-LJQANCHMSA-N	0	3	346.474	3.333	20	30		EGEDHN
N#CC(C(=O)Cc1cccc(Cl)c1F)C(=O)NC1CCCCC1	ZINC000810529933	1318018543	/nfs/dbraw/zinc/01/85/43/1318018543.db2.gz	RLRILOWWUOKGKK-ZDUSSCGKSA-N	0	3	336.794	3.179	20	30		EGEDHN
C#CC[C@@H](CCOC)NCc1ccc(-c2ccccc2[N+](=O)[O-])o1	ZINC000858333244	1328739472	/nfs/dbraw/zinc/73/94/72/1328739472.db2.gz	ACFFWWQNPMUGCK-AWEZNQCLSA-N	0	3	328.368	3.373	20	30		EGEDHN
C=CCn1cccc1C(=O)NC1C[C@H]2CC[C@@H](C1)N2C/C=C\Cl	ZINC001021281601	1318170288	/nfs/dbraw/zinc/17/02/88/1318170288.db2.gz	KRIKRCYYARGBBW-AOKQLNRQSA-N	0	3	333.863	3.152	20	30		EGEDHN
C=C1CC(C)(C(=O)NC2C[C@H]3CC[C@@H](C2)N3Cc2cnc(C)s2)C1	ZINC001021371531	1318216674	/nfs/dbraw/zinc/21/66/74/1318216674.db2.gz	VUEQZPXXXIJJFV-MQVJKMGUSA-N	0	3	345.512	3.419	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)CCC2CC2)c(F)c1	ZINC000959929215	1318270868	/nfs/dbraw/zinc/27/08/68/1318270868.db2.gz	OBIRTCLVUOXICQ-SFHVURJKSA-N	0	3	343.446	3.358	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)C1(F)CCCCC1	ZINC000811878985	1318283522	/nfs/dbraw/zinc/28/35/22/1318283522.db2.gz	RQQOEJQWQRETBH-UHFFFAOYSA-N	0	3	331.435	3.121	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCCC[C@H]1CNCc1cc(C#N)ccc1OC	ZINC000959957323	1318289079	/nfs/dbraw/zinc/28/90/79/1318289079.db2.gz	XZBBRSYKLQRSOI-XTQXNGTCSA-N	0	3	341.455	3.004	20	30		EGEDHN
C[C@@H](NC[C@@H]1CCCCN1C(=O)C#CC1CC1)c1ccc(F)cc1F	ZINC000960005793	1318309384	/nfs/dbraw/zinc/30/93/84/1318309384.db2.gz	BTCXNMCOUOZFGF-PBHICJAKSA-N	0	3	346.421	3.410	20	30		EGEDHN
CC(F)(F)C(=O)N1CCC[C@H]2CN(Cc3cccc(C#N)c3)CC[C@@H]21	ZINC001021500597	1318312406	/nfs/dbraw/zinc/31/24/06/1318312406.db2.gz	ZMHYVQOQQOGSAD-IRXDYDNUSA-N	0	3	347.409	3.026	20	30		EGEDHN
CC(F)(F)C(=O)N1CCC[C@@H]2CN(Cc3ccc(C#N)cc3)CC[C@H]21	ZINC001021502687	1318313610	/nfs/dbraw/zinc/31/36/10/1318313610.db2.gz	OOBUYNUBEDFKIS-IAGOWNOFSA-N	0	3	347.409	3.026	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@@H]2CN(Cc3cccc(C#N)c3)CC[C@H]21	ZINC001021512099	1318334457	/nfs/dbraw/zinc/33/44/57/1318334457.db2.gz	USIHKMYCUJFRGN-WOJBJXKFSA-N	0	3	337.467	3.337	20	30		EGEDHN
CN(CCCCC1(C#N)CCC1)[C@H]1CCCC[C@@H]1S(C)(=O)=O	ZINC000930000033	1328760893	/nfs/dbraw/zinc/76/08/93/1328760893.db2.gz	LUQCARNVQMIMEG-HOTGVXAUSA-N	0	3	326.506	3.138	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)[C@@H]2C[C@H]2C2CC2)s1	ZINC000960161269	1318391581	/nfs/dbraw/zinc/39/15/81/1318391581.db2.gz	YOOBAVKCQYIGTR-JCGIZDLHSA-N	0	3	343.496	3.137	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2c(C)oc3ccccc32)C1	ZINC001021590377	1318434887	/nfs/dbraw/zinc/43/48/87/1318434887.db2.gz	FHHLJBUHLLMABC-SJLPKXTDSA-N	0	3	336.435	3.301	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc(F)c(C)cc1F	ZINC000960275705	1318438962	/nfs/dbraw/zinc/43/89/62/1318438962.db2.gz	GLEKULDHKKFVEN-RTBURBONSA-N	0	3	342.389	3.445	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1[nH]nc2ccc(C)cc21	ZINC000960279896	1318442393	/nfs/dbraw/zinc/44/23/93/1318442393.db2.gz	BGGRRTHHRAQURQ-RTBURBONSA-N	0	3	346.434	3.043	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cccnc1C(F)F	ZINC000960281554	1318443208	/nfs/dbraw/zinc/44/32/08/1318443208.db2.gz	RWRWEQZBOYZONA-HZPDHXFCSA-N	0	3	343.377	3.191	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc2ccccc2n1C	ZINC000960298388	1318449744	/nfs/dbraw/zinc/44/97/44/1318449744.db2.gz	ASQSSSTVKZVTPJ-WIYYLYMNSA-N	0	3	345.446	3.350	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)C1CCC(OC)CC1	ZINC000960299019	1318450438	/nfs/dbraw/zinc/45/04/38/1318450438.db2.gz	JWGQYIUMGAEAGO-LYBGUNNDSA-N	0	3	342.483	3.140	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc(C)c(F)c1F	ZINC000960309481	1318453258	/nfs/dbraw/zinc/45/32/58/1318453258.db2.gz	TYHAHSAWDOVLND-VQIMIIECSA-N	0	3	342.389	3.445	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2nc(C(C)(C)C)cs2)C1	ZINC001021606070	1318453400	/nfs/dbraw/zinc/45/34/00/1318453400.db2.gz	GPWYELWCBZZSTA-GJZGRUSLSA-N	0	3	345.512	3.000	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)Cc2cccc(CC)c2)C1	ZINC001021617600	1318466911	/nfs/dbraw/zinc/46/69/11/1318466911.db2.gz	WCRJBGAXLFUREJ-SFTDATJTSA-N	0	3	338.495	3.128	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2ccc(C)cc2Cl)C1	ZINC001021617648	1318467105	/nfs/dbraw/zinc/46/71/05/1318467105.db2.gz	WXOJPBGXPWCWHR-PKOBYXMFSA-N	0	3	344.886	3.137	20	30		EGEDHN
CO[C@@](C)(C(=O)C(C#N)c1nc2ccccc2n1C(F)F)C1CC1	ZINC000813061198	1318493090	/nfs/dbraw/zinc/49/30/90/1318493090.db2.gz	UFMDADGPFUIPFA-PIGZYNQJSA-N	0	3	333.338	3.423	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(F)c(Cl)c2)C1	ZINC001021658619	1318520109	/nfs/dbraw/zinc/52/01/09/1318520109.db2.gz	OLULOYLPFAVIDG-PBHICJAKSA-N	0	3	334.822	3.039	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc3ncccc3c2)C1	ZINC001021666365	1318528157	/nfs/dbraw/zinc/52/81/57/1318528157.db2.gz	SOHNPQQXGFAAOL-TZIWHRDSSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(C)cc2Cl)C1	ZINC001021673888	1318537732	/nfs/dbraw/zinc/53/77/32/1318537732.db2.gz	NDCSKTCPJIFGSK-QAPCUYQASA-N	0	3	330.859	3.208	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC[C@@H]1CN(C)Cc1ccc(OC)c(C#N)c1	ZINC000960452245	1318572664	/nfs/dbraw/zinc/57/26/64/1318572664.db2.gz	SBZFYMCZXFVRPG-CRAIPNDOSA-N	0	3	343.471	3.036	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc3ccn(C)c3c2)C1	ZINC001021710912	1318585755	/nfs/dbraw/zinc/58/57/55/1318585755.db2.gz	RACULBLXHIMAIU-VQTJNVASSA-N	0	3	349.478	3.128	20	30		EGEDHN
CCN1CCCN(C(=O)c2c(Cl)cc(C#N)cc2Cl)[C@H](C)C1	ZINC000910279844	1318593712	/nfs/dbraw/zinc/59/37/12/1318593712.db2.gz	CZCVKTRIXNROBP-LLVKDONJSA-N	0	3	340.254	3.421	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@@H]1CN(C)Cc1cc2ccccc2o1	ZINC000960498039	1318607347	/nfs/dbraw/zinc/60/73/47/1318607347.db2.gz	CGGRGMGRCDVVRK-GDBMZVCRSA-N	0	3	325.412	3.015	20	30		EGEDHN
CC(C)Oc1cccc(CN(C)C[C@@H]2CCCN2C(=O)[C@H](C)C#N)c1	ZINC000960496871	1318607479	/nfs/dbraw/zinc/60/74/79/1318607479.db2.gz	UNJXLCOGGWDECU-AEFFLSMTSA-N	0	3	343.471	3.056	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2coc3ccc(F)cc32)C1	ZINC001021725316	1318616069	/nfs/dbraw/zinc/61/60/69/1318616069.db2.gz	RLZTZDGPLBBNHT-KSSFIOAISA-N	0	3	340.398	3.132	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cccc3ccccc32)C1	ZINC001021726910	1318622172	/nfs/dbraw/zinc/62/21/72/1318622172.db2.gz	HPBJXABFCXIONW-RXVVDRJESA-N	0	3	332.447	3.400	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc3c(cccc3C)o2)C1	ZINC001021746994	1318662762	/nfs/dbraw/zinc/66/27/62/1318662762.db2.gz	RUROEXGFXHDCES-WMZOPIPTSA-N	0	3	336.435	3.301	20	30		EGEDHN
CC[C@H](SC)C(=O)N1CCC[C@H]1CN(C)Cc1ccc(C#N)cc1	ZINC000960557109	1318687314	/nfs/dbraw/zinc/68/73/14/1318687314.db2.gz	OVXNNQITWLVZMZ-ROUUACIJSA-N	0	3	345.512	3.123	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)C(C)=C2CCCC2)C1	ZINC001021957506	1318749593	/nfs/dbraw/zinc/74/95/93/1318749593.db2.gz	UCYYOZYHIKFKGX-OKILXGFUSA-N	0	3	327.266	3.022	20	30		EGEDHN
CC(C(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1)=C1CCCC1	ZINC001021956347	1318747924	/nfs/dbraw/zinc/74/79/24/1318747924.db2.gz	DIHNOJVQJDTLHR-HDICACEKSA-N	0	3	341.430	3.325	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1ccc(-c2nc(C)cs2)cc1	ZINC000930101697	1328785946	/nfs/dbraw/zinc/78/59/46/1328785946.db2.gz	MOIBAVKEGLWKIT-UHFFFAOYSA-N	0	3	342.468	3.195	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1C[C@@H](NCc2sccc2Cl)C1	ZINC001022202769	1318840648	/nfs/dbraw/zinc/84/06/48/1318840648.db2.gz	KDFWQOPJPDWBJT-BETUJISGSA-N	0	3	349.887	3.440	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)Nc1cccc(C(=O)N(C)C)c1	ZINC000912196126	1318846708	/nfs/dbraw/zinc/84/67/08/1318846708.db2.gz	RMJVIBPFRMYDJF-KRWDZBQOSA-N	0	3	333.476	3.405	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)CC1(C)CC1	ZINC000960747284	1318848483	/nfs/dbraw/zinc/84/84/83/1318848483.db2.gz	GSGUYBHCVJVCFY-GOSISDBHSA-N	0	3	325.456	3.171	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]1CN(C)Cc1ccc(OC)cc1	ZINC000960786316	1318888553	/nfs/dbraw/zinc/88/85/53/1318888553.db2.gz	DGDFOBKYDKNQLI-QGZVFWFLSA-N	0	3	330.472	3.330	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N1CCC[C@@H]1CN(C)Cc1cccc(C#N)c1	ZINC000960852130	1318992922	/nfs/dbraw/zinc/99/29/22/1318992922.db2.gz	MADIUVLLKGMQCF-VAMGGRTRSA-N	0	3	339.483	3.417	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@@H]1CN(C)Cc1cccc(C#N)c1)C(C)(F)F	ZINC000960869622	1319013941	/nfs/dbraw/zinc/01/39/41/1319013941.db2.gz	OWFZGJMNCWSDMW-WMLDXEAASA-N	0	3	349.425	3.272	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)Cc2ccccc2OC(C)C)C1	ZINC001022850578	1319136277	/nfs/dbraw/zinc/13/62/77/1319136277.db2.gz	QELJEPIGZZYBMT-IYBDPMFKSA-N	0	3	336.863	3.006	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cnn(C(CC)CC)c2C)C1	ZINC001022950558	1319184883	/nfs/dbraw/zinc/18/48/83/1319184883.db2.gz	GHJAQWYFCLDUDA-OKILXGFUSA-N	0	3	338.883	3.156	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@H]([C@@H]2CCCN(C(=O)C3CC3)C2)C1	ZINC000961082269	1319194389	/nfs/dbraw/zinc/19/43/89/1319194389.db2.gz	RKLNIZNGFGBJKH-UXHICEINSA-N	0	3	337.467	3.029	20	30		EGEDHN
N#Cc1ccncc1N1CC[NH+](Cc2ccc3ccccc3c2[O-])CC1	ZINC000816616744	1319195522	/nfs/dbraw/zinc/19/55/22/1319195522.db2.gz	FLKWAYVCRLMOFZ-UHFFFAOYSA-N	0	3	344.418	3.134	20	30		EGEDHN
C=C(C)C[N@@H+]1CC[C@H]([C@H]2CCCN(C(=O)c3ccccc3[O-])C2)C1	ZINC000961099832	1319211395	/nfs/dbraw/zinc/21/13/95/1319211395.db2.gz	ZRIYCWZSMLRAMN-IRXDYDNUSA-N	0	3	328.456	3.142	20	30		EGEDHN
C=C(C)C[N@H+]1CC[C@H]([C@H]2CCCN(C(=O)c3ccccc3[O-])C2)C1	ZINC000961099832	1319211403	/nfs/dbraw/zinc/21/14/03/1319211403.db2.gz	ZRIYCWZSMLRAMN-IRXDYDNUSA-N	0	3	328.456	3.142	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)Cc2cccc3ccccc32)C1	ZINC001023010229	1319215883	/nfs/dbraw/zinc/21/58/83/1319215883.db2.gz	MCIOGKVJLZUXRJ-CALCHBBNSA-N	0	3	328.843	3.372	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)Cc2c(F)cccc2Cl)C1	ZINC001023016284	1319222251	/nfs/dbraw/zinc/22/22/51/1319222251.db2.gz	VXUHCLZBSNZTDC-PHIMTYICSA-N	0	3	331.218	3.011	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@H](CNC(=O)[C@H]3CC=CCC3)C2)c1	ZINC001023230342	1319370816	/nfs/dbraw/zinc/37/08/16/1319370816.db2.gz	TVBZUPYZXBYCJA-UXHICEINSA-N	0	3	337.467	3.243	20	30		EGEDHN
N#Cc1ccccc1/C=C/C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000915264543	1319456946	/nfs/dbraw/zinc/45/69/46/1319456946.db2.gz	QLJVGUWBOQNCTQ-JNCYCUAHSA-N	0	3	345.446	3.352	20	30		EGEDHN
N#Cc1ccccc1/C=C/C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000915264542	1319457087	/nfs/dbraw/zinc/45/70/87/1319457087.db2.gz	QLJVGUWBOQNCTQ-IWGBCORSSA-N	0	3	345.446	3.352	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](C2CCN(C(=O)c3ccccn3)CC2)C1	ZINC000961311800	1319473002	/nfs/dbraw/zinc/47/30/02/1319473002.db2.gz	FURPBBBOWXGIIH-QGZVFWFLSA-N	0	3	347.890	3.398	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc(C(F)F)ccc2F)C1	ZINC001023372537	1319483753	/nfs/dbraw/zinc/48/37/53/1319483753.db2.gz	UGIMJLVSOPLFKC-ZDUSSCGKSA-N	0	3	338.373	3.228	20	30		EGEDHN
[NH3+]CC[C@H]([N-]C(=O)[C@@H](F)c1ccc(C(F)(F)F)cc1)C(F)(F)F	ZINC000817995033	1319486983	/nfs/dbraw/zinc/48/69/83/1319486983.db2.gz	SPSCIYAHFTWHPX-UWVGGRQHSA-N	0	3	346.246	3.112	20	30		EGEDHN
C#CCN(C)CCCNC(=O)CCCSc1ccc(Cl)cc1	ZINC000818609040	1319567871	/nfs/dbraw/zinc/56/78/71/1319567871.db2.gz	IIDAHHUUKMPTLQ-UHFFFAOYSA-N	0	3	338.904	3.284	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2c(C)occ2C(F)(F)F)C1	ZINC001023492711	1319596971	/nfs/dbraw/zinc/59/69/71/1319596971.db2.gz	BVQRKMUSXLUJJL-CYBMUJFWSA-N	0	3	342.361	3.072	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2c(C)occ2C(F)(F)F)C1	ZINC001023492712	1319597720	/nfs/dbraw/zinc/59/77/20/1319597720.db2.gz	BVQRKMUSXLUJJL-ZDUSSCGKSA-N	0	3	342.361	3.072	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2[C@H]3CN(Cc4cc5ccccc5o4)C[C@H]32)C1	ZINC000961690192	1319700323	/nfs/dbraw/zinc/70/03/23/1319700323.db2.gz	KVUMIQZFBNHBQD-DZFIZOCASA-N	0	3	336.435	3.336	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2[C@H]3CN([C@@H](C)c4cccc(F)c4)C[C@H]32)C1	ZINC000961690488	1319701233	/nfs/dbraw/zinc/70/12/33/1319701233.db2.gz	WGMGVURSVPKSRJ-VIBAHUMZSA-N	0	3	328.431	3.289	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@H](CNC(=O)C3CC4(CC4)C3)C2)c1	ZINC001023579507	1319701366	/nfs/dbraw/zinc/70/13/66/1319701366.db2.gz	HVYKXAXVNWCFCO-SFHVURJKSA-N	0	3	337.467	3.077	20	30		EGEDHN
C=CCNC(=O)C(C#N)C(=O)CCCc1ccc(Cl)c(Cl)c1	ZINC000916920226	1319725353	/nfs/dbraw/zinc/72/53/53/1319725353.db2.gz	BISMQCODKWBBAB-GFCCVEGCSA-N	0	3	339.222	3.327	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)COc2cccc(Cl)c2)c1	ZINC000916897270	1319721807	/nfs/dbraw/zinc/72/18/07/1319721807.db2.gz	FQNYCEYVWAKVHV-MRXNPFEDSA-N	0	3	342.782	3.375	20	30		EGEDHN
CCCCSCC(=O)C(C#N)C(=O)Nc1ccccc1OCC	ZINC000916924903	1319726495	/nfs/dbraw/zinc/72/64/95/1319726495.db2.gz	GMERLPVRAHLEIJ-CYBMUJFWSA-N	0	3	334.441	3.266	20	30		EGEDHN
C=CCN1CCC[C@H](CNC(=O)c2cc(C)oc2C(F)(F)F)C1	ZINC001023626481	1319747704	/nfs/dbraw/zinc/74/77/04/1319747704.db2.gz	ZYHFOQBJAMITEI-GFCCVEGCSA-N	0	3	330.350	3.235	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cccc(C(C)(C)C)c2)C1	ZINC001023661577	1319779118	/nfs/dbraw/zinc/77/91/18/1319779118.db2.gz	AKAJZVWTORYWEU-KRWDZBQOSA-N	0	3	326.484	3.449	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc(C(F)(F)F)cc2)C1	ZINC001023716992	1319848824	/nfs/dbraw/zinc/84/88/24/1319848824.db2.gz	ZDPZZRMBKMUXKW-CQSZACIVSA-N	0	3	338.373	3.171	20	30		EGEDHN
C#CCN1CCC[C@H](CNC(=O)c2cc(CC)c(CCC)s2)C1	ZINC001023742099	1319885688	/nfs/dbraw/zinc/88/56/88/1319885688.db2.gz	CKYMGIHBQPXSEN-OAHLLOKOSA-N	0	3	332.513	3.338	20	30		EGEDHN
C#C[C@H](NC(=O)N1CCN(C2CC2)C[C@H](C)C1)c1ccc(Cl)cc1	ZINC000820560740	1319910969	/nfs/dbraw/zinc/91/09/69/1319910969.db2.gz	YSEGDHLPEVAFMF-KSSFIOAISA-N	0	3	345.874	3.140	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCN(C(=O)C2CCCCC2)C1	ZINC001023811322	1319954949	/nfs/dbraw/zinc/95/49/49/1319954949.db2.gz	NENDDBXSQRNRHA-KRWDZBQOSA-N	0	3	339.483	3.467	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1OC(F)F)C[C@](C)(O)c1ccccc1	ZINC000823591420	1320189473	/nfs/dbraw/zinc/18/94/73/1320189473.db2.gz	LDADLQODLNVQOB-IBGZPJMESA-N	0	3	346.377	3.499	20	30		EGEDHN
C#Cc1cccc(CNCc2cc(C)c(OCC(=O)OC)c(C)c2)c1	ZINC000825227032	1320319681	/nfs/dbraw/zinc/31/96/81/1320319681.db2.gz	PNKMIPSVCAMPAM-UHFFFAOYSA-N	0	3	337.419	3.126	20	30		EGEDHN
C#Cc1cccc(CNC(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)c1	ZINC000838586060	1320793153	/nfs/dbraw/zinc/79/31/53/1320793153.db2.gz	BKXUKWUMKFFIGF-JXFKEZNVSA-N	0	3	335.451	3.159	20	30		EGEDHN
C#Cc1cccc(CNC(=O)N(CCN(C)C)Cc2ccsc2)c1	ZINC000838719299	1320807871	/nfs/dbraw/zinc/80/78/71/1320807871.db2.gz	FZIXFBNTVRUYLJ-UHFFFAOYSA-N	0	3	341.480	3.003	20	30		EGEDHN
C#Cc1cccc(CNC(=O)N(CCN(C)C)Cc2cccc(C)c2)c1	ZINC000838724734	1320808429	/nfs/dbraw/zinc/80/84/29/1320808429.db2.gz	UKRAUJCEEPMIQA-UHFFFAOYSA-N	0	3	349.478	3.250	20	30		EGEDHN
Cc1ccc2c(c1)[C@H]1CN(C)CC[C@@H]1N2C(=O)c1ncc(C#N)cc1C	ZINC000839232811	1320896967	/nfs/dbraw/zinc/89/69/67/1320896967.db2.gz	OPFDODALNKKZOB-MJGOQNOKSA-N	0	3	346.434	3.018	20	30		EGEDHN
C=CCC[C@H](NCCS(C)(=O)=O)c1ccc(C(F)(F)F)cc1	ZINC000839542886	1320934651	/nfs/dbraw/zinc/93/46/51/1320934651.db2.gz	GREWSUJMOTWVTJ-AWEZNQCLSA-N	0	3	335.391	3.347	20	30		EGEDHN
COC1(C(F)(F)F)CCN(CCCOc2ccc(C#N)cc2)CC1	ZINC000842159868	1321355701	/nfs/dbraw/zinc/35/57/01/1321355701.db2.gz	BQFJMGHBHGPDTG-UHFFFAOYSA-N	0	3	342.361	3.370	20	30		EGEDHN
CO[C@@H](CC(C)C)C(=O)C(C#N)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000842288474	1321367316	/nfs/dbraw/zinc/36/73/16/1321367316.db2.gz	IPKWNJSQUCNRHD-FZMZJTMJSA-N	0	3	340.782	3.188	20	30		EGEDHN
CO[C@@H](CC(C)C)C(=O)C(C#N)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000842288475	1321367387	/nfs/dbraw/zinc/36/73/87/1321367387.db2.gz	IPKWNJSQUCNRHD-RISCZKNCSA-N	0	3	340.782	3.188	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C(C)C)[C@@H]2CCN(Cc3ccccc3)C2)cn1	ZINC000843696206	1321537127	/nfs/dbraw/zinc/53/71/27/1321537127.db2.gz	RNYCPNJCNUWNEK-OAQYLSRUSA-N	0	3	347.462	3.188	20	30		EGEDHN
C=C(C)CONC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1	ZINC000844284350	1321585088	/nfs/dbraw/zinc/58/50/88/1321585088.db2.gz	SSTSLFQUECXXKH-HNNXBMFYSA-N	0	3	337.489	3.328	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCCC[C@H]2CC2(Cl)Cl)CC1	ZINC000844955013	1321661467	/nfs/dbraw/zinc/66/14/67/1321661467.db2.gz	GURMUISNJNICGF-ZDUSSCGKSA-N	0	3	348.318	3.300	20	30		EGEDHN
CC[C@@H](CC#N)NCCCCCCN1C(=O)c2ccccc2C1=O	ZINC000846989244	1321830795	/nfs/dbraw/zinc/83/07/95/1321830795.db2.gz	ZEFCBEPBOOJNDB-HNNXBMFYSA-N	0	3	327.428	3.125	20	30		EGEDHN
COCC(C)(C)C(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847749246	1321900544	/nfs/dbraw/zinc/90/05/44/1321900544.db2.gz	PRLUCSSIUSHLNF-UHFFFAOYSA-N	0	3	344.455	3.008	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H](CNCc2cc(C3CC3)no2)C1	ZINC001024090424	1323122475	/nfs/dbraw/zinc/12/24/75/1323122475.db2.gz	HYAUAPZPMMPUTK-OAHLLOKOSA-N	0	3	345.487	3.483	20	30		EGEDHN
CC1(C(=O)N2CCC[C@H](CNCc3ccccc3C#N)C2)CCC1	ZINC001024098119	1323129479	/nfs/dbraw/zinc/12/94/79/1323129479.db2.gz	ZQUIJMPMSIBALT-MRXNPFEDSA-N	0	3	325.456	3.077	20	30		EGEDHN
CC1(C)CC[C@@H]1C(=O)N1CCC[C@@H](CNCc2ccccc2C#N)C1	ZINC001024111227	1323144696	/nfs/dbraw/zinc/14/46/96/1323144696.db2.gz	IVMKWWKKFZHWQW-QFBILLFUSA-N	0	3	339.483	3.323	20	30		EGEDHN
CC(C)(C(=O)N1CCC[C@H](CNCc2ccccc2C#N)C1)C(F)F	ZINC001024147910	1323173748	/nfs/dbraw/zinc/17/37/48/1323173748.db2.gz	OPOQTORVWUNRNE-CQSZACIVSA-N	0	3	349.425	3.178	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H](CNCc3csc(C)n3)C2)C1	ZINC001024147703	1323173786	/nfs/dbraw/zinc/17/37/86/1323173786.db2.gz	MDNGFYJOPAKAQU-HNNXBMFYSA-N	0	3	333.501	3.136	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H](CNCc3csc(C)n3)C2)C1	ZINC001024147704	1323174031	/nfs/dbraw/zinc/17/40/31/1323174031.db2.gz	MDNGFYJOPAKAQU-OAHLLOKOSA-N	0	3	333.501	3.136	20	30		EGEDHN
CN(C(=O)CC1CC1)C1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC000962995607	1323182243	/nfs/dbraw/zinc/18/22/43/1323182243.db2.gz	VNQMQYGOALRBNE-UHFFFAOYSA-N	0	3	343.446	3.357	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CCC[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001024186097	1323197954	/nfs/dbraw/zinc/19/79/54/1323197954.db2.gz	LAFRBTBXEJQIIG-HZPDHXFCSA-N	0	3	345.462	3.318	20	30		EGEDHN
CC(=O)N1CCC[C@@H]([C@H]2CCCN2CC#Cc2cccc(Cl)c2)C1	ZINC000963209278	1323235295	/nfs/dbraw/zinc/23/52/95/1323235295.db2.gz	PMAKTKUUVCMQGB-UYAOXDASSA-N	0	3	344.886	3.414	20	30		EGEDHN
C[C@@H](CC(=O)N1CCC[C@@H](CNCc2ccccc2C#N)C1)C1CC1	ZINC001024280606	1323257930	/nfs/dbraw/zinc/25/79/30/1323257930.db2.gz	DKLIBWFJRMEOBR-IRXDYDNUSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)c2ncoc2C)C1	ZINC000963269149	1323283835	/nfs/dbraw/zinc/28/38/35/1323283835.db2.gz	BFPJHRYZXVNQNO-HUUCEWRRSA-N	0	3	337.851	3.052	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1oc2c(cccc2F)c1C	ZINC001024481382	1323436005	/nfs/dbraw/zinc/43/60/05/1323436005.db2.gz	YCBIAGOOGCGIQV-OAHLLOKOSA-N	0	3	342.414	3.488	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cc2c(cn1)CCCC2	ZINC001024542667	1323485352	/nfs/dbraw/zinc/48/53/52/1323485352.db2.gz	ZRXUWQFTYOJHBQ-GOSISDBHSA-N	0	3	327.472	3.121	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@@H]1CCCc2cccnc21	ZINC001024615460	1323542602	/nfs/dbraw/zinc/54/26/02/1323542602.db2.gz	SUEYFDHQYDSSGO-QZTJIDSGSA-N	0	3	327.472	3.048	20	30		EGEDHN
C=C(C)CCN1CCCC[C@@H]1CNC(=O)c1nc(Cl)cs1	ZINC001024617632	1323545502	/nfs/dbraw/zinc/54/55/02/1323545502.db2.gz	KXRAILJVOKJTIE-GFCCVEGCSA-N	0	3	327.881	3.347	20	30		EGEDHN
C=CCCN1CCCC[C@@H]1CNC(=O)c1c(F)ccc(F)c1F	ZINC001024628896	1323555655	/nfs/dbraw/zinc/55/56/55/1323555655.db2.gz	VZNHOBOIFIOHIY-GFCCVEGCSA-N	0	3	326.362	3.264	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CCN(CCc2ccncc2)CC1	ZINC000931344211	1329098472	/nfs/dbraw/zinc/09/84/72/1329098472.db2.gz	FDJRNSOYRHCKRD-UHFFFAOYSA-N	0	3	348.494	3.243	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@H]1CCc2ccccc2C1	ZINC001024681987	1323596765	/nfs/dbraw/zinc/59/67/65/1323596765.db2.gz	UZNMQJPZRAGYJB-VQTJNVASSA-N	0	3	326.484	3.338	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cn(CCCC)nc1C	ZINC001024749832	1323653759	/nfs/dbraw/zinc/65/37/59/1323653759.db2.gz	HISJGJOAWHKEJL-KRWDZBQOSA-N	0	3	332.492	3.152	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001024918746	1323782991	/nfs/dbraw/zinc/78/29/91/1323782991.db2.gz	OCYPAMJCNMECPI-UEHGYGDOSA-N	0	3	329.419	3.134	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)C=C2CCC2)s1	ZINC001024923098	1323785643	/nfs/dbraw/zinc/78/56/43/1323785643.db2.gz	LCDJWCDMRAFCOW-OAHLLOKOSA-N	0	3	329.469	3.201	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCCC[C@H]1CN[C@H](C)c1n[nH]c(CC)n1	ZINC001025039686	1323842366	/nfs/dbraw/zinc/84/23/66/1323842366.db2.gz	UYRNZTRDQKYHIX-CABCVRRESA-N	0	3	347.507	3.001	20	30		EGEDHN
C=C(C)C[N@@H+]1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccccc1[O-]	ZINC001025200630	1323985195	/nfs/dbraw/zinc/98/51/95/1323985195.db2.gz	FOYKYIPEVURVCK-ZWKOTPCHSA-N	0	3	328.456	3.427	20	30		EGEDHN
C=C(C)C[N@H+]1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccccc1[O-]	ZINC001025200630	1323985199	/nfs/dbraw/zinc/98/51/99/1323985199.db2.gz	FOYKYIPEVURVCK-ZWKOTPCHSA-N	0	3	328.456	3.427	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccn(C(C)(C)C)n1	ZINC001025234842	1324022659	/nfs/dbraw/zinc/02/26/59/1324022659.db2.gz	LJVKZTUKXDFAPE-QZTJIDSGSA-N	0	3	344.503	3.283	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cccc(F)c1C	ZINC001025235038	1324023130	/nfs/dbraw/zinc/02/31/30/1324023130.db2.gz	MRQWOKUVGHCDNO-RBUKOAKNSA-N	0	3	328.431	3.226	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1c(F)cncc1F	ZINC001025238587	1324030049	/nfs/dbraw/zinc/03/00/49/1324030049.db2.gz	SSOBPCCXEMZPDO-JKSUJKDBSA-N	0	3	335.398	3.005	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc(C(C)C)nc1	ZINC001025239723	1324032058	/nfs/dbraw/zinc/03/20/58/1324032058.db2.gz	IPLVNUUAGVDZBJ-PMACEKPBSA-N	0	3	339.483	3.297	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc(OC)cc1F	ZINC001025248255	1324049192	/nfs/dbraw/zinc/04/91/92/1324049192.db2.gz	XMODBMISOSKREG-MOPGFXCFSA-N	0	3	346.446	3.479	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1nc2c(s1)CCC2	ZINC001025251609	1324056049	/nfs/dbraw/zinc/05/60/49/1324056049.db2.gz	JYQCTYXVZJFIFK-HOTGVXAUSA-N	0	3	345.512	3.277	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1c(C)cncc1C	ZINC001025252624	1324057604	/nfs/dbraw/zinc/05/76/04/1324057604.db2.gz	YTOKNUXBVHYANZ-RTBURBONSA-N	0	3	339.483	3.181	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)C1(C2CC2)CCC1	ZINC001025254156	1324060142	/nfs/dbraw/zinc/06/01/42/1324060142.db2.gz	DZTHJDKMHFENPP-RTBURBONSA-N	0	3	328.500	3.436	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(C(C)C)on1	ZINC001025255478	1324062786	/nfs/dbraw/zinc/06/27/86/1324062786.db2.gz	QTDCKNIFKNAADG-SJORKVTESA-N	0	3	331.460	3.443	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCCC[C@@H]2[C@H]2CCCN2CC#CC)cc1	ZINC001025257919	1324065452	/nfs/dbraw/zinc/06/54/52/1324065452.db2.gz	GXAMKOIPXDYHMC-NHCUHLMSSA-N	0	3	334.463	3.150	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)Cc1cccc(Cl)c1	ZINC001025263240	1324073130	/nfs/dbraw/zinc/07/31/30/1324073130.db2.gz	JROYBMYCNOISMW-OALUTQOASA-N	0	3	344.886	3.361	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)CCc1ccccc1C	ZINC001025273183	1324088463	/nfs/dbraw/zinc/08/84/63/1324088463.db2.gz	OFXKATIXQDZXFV-SFTDATJTSA-N	0	3	338.495	3.406	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1nc(C)ncc1Cl	ZINC001025274749	1324094280	/nfs/dbraw/zinc/09/42/80/1324094280.db2.gz	NBYIJSROUUCIRO-JKSUJKDBSA-N	0	3	348.878	3.084	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ncoc1C1CC1	ZINC001025288159	1324111321	/nfs/dbraw/zinc/11/13/21/1324111321.db2.gz	SLHZXJSHXUXZHE-JKSUJKDBSA-N	0	3	329.444	3.197	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)CCc1cccs1	ZINC001025293558	1324120114	/nfs/dbraw/zinc/12/01/14/1324120114.db2.gz	DOMASLRPNOLPOC-MSOLQXFVSA-N	0	3	330.497	3.159	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(F)cc(F)c1	ZINC001025294446	1324124079	/nfs/dbraw/zinc/12/40/79/1324124079.db2.gz	BGCSCFIKZXREJU-RBUKOAKNSA-N	0	3	346.421	3.447	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1nc(C)c(C)s1	ZINC001025295033	1324125051	/nfs/dbraw/zinc/12/50/51/1324125051.db2.gz	NQTJUCZLCQRGLS-HOTGVXAUSA-N	0	3	333.501	3.405	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)Cc1cccc(F)c1	ZINC001025297087	1324129281	/nfs/dbraw/zinc/12/92/81/1324129281.db2.gz	OBWLYWOKPZNYRH-VQTJNVASSA-N	0	3	342.458	3.237	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)Cc1ccc(C)c(C)c1	ZINC001025298250	1324131338	/nfs/dbraw/zinc/13/13/38/1324131338.db2.gz	VNGPJXKXPHOIMC-SFTDATJTSA-N	0	3	338.495	3.325	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cncc2ccccc21	ZINC001025301873	1324135575	/nfs/dbraw/zinc/13/55/75/1324135575.db2.gz	QHZLZCQNZWZOQP-NHCUHLMSSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cscc2C(F)F)C1	ZINC001025424562	1324258186	/nfs/dbraw/zinc/25/81/86/1324258186.db2.gz	FMBURRXROIXCKZ-VXGBXAGGSA-N	0	3	326.412	3.149	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)C2C3CC4CC(C3)CC2C4)C1	ZINC001025442708	1324283296	/nfs/dbraw/zinc/28/32/96/1324283296.db2.gz	NDCPXEWDEVFCDP-QCFMGMEWSA-N	0	3	342.527	3.299	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(F)c(C)cc2F)C1	ZINC001025449986	1324292377	/nfs/dbraw/zinc/29/23/77/1324292377.db2.gz	AXUKFOSLGIXBBK-LSDHHAIUSA-N	0	3	334.410	3.127	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(F)ccc2CC)C1	ZINC001025471977	1324316944	/nfs/dbraw/zinc/31/69/44/1324316944.db2.gz	LNVHFPIGRCVBBA-RDJZCZTQSA-N	0	3	330.447	3.242	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(C)c(Cl)c2F)C1	ZINC001025489030	1324340442	/nfs/dbraw/zinc/34/04/42/1324340442.db2.gz	NKAGDRIRBUSMQV-ZIAGYGMSSA-N	0	3	336.838	3.251	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc3cc(C)ccc3[nH]2)C1	ZINC001025501357	1324350004	/nfs/dbraw/zinc/35/00/04/1324350004.db2.gz	DCKUQGQIUQWVJJ-DLBZAZTESA-N	0	3	337.467	3.330	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc3cc(C)ccc3[nH]2)C1	ZINC001025501360	1324350949	/nfs/dbraw/zinc/35/09/49/1324350949.db2.gz	DCKUQGQIUQWVJJ-SJORKVTESA-N	0	3	337.467	3.330	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2c(C)cc(F)cc2C)C1	ZINC001025505541	1324353869	/nfs/dbraw/zinc/35/38/69/1324353869.db2.gz	IAJFGGAHKNWQOI-DLBZAZTESA-N	0	3	330.447	3.296	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccn(C(CC)CC)n2)C1	ZINC001025545701	1324393708	/nfs/dbraw/zinc/39/37/08/1324393708.db2.gz	LBBOVIVEHSDSNC-DLBZAZTESA-N	0	3	344.503	3.098	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(OCC)c(C)c2)C1	ZINC001025549215	1324397844	/nfs/dbraw/zinc/39/78/44/1324397844.db2.gz	MLTBUXIRPFNUFZ-HKUYNNGSSA-N	0	3	342.483	3.247	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(OC)cc2Cl)C1	ZINC001025565010	1324410924	/nfs/dbraw/zinc/41/09/24/1324410924.db2.gz	OPICYJCLNAUMJO-HUUCEWRRSA-N	0	3	348.874	3.202	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC001025603404	1324453341	/nfs/dbraw/zinc/45/33/41/1324453341.db2.gz	VTAUKOYOMUEQSW-HIFRSBDPSA-N	0	3	338.373	3.169	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(C)c(CC)s2)C1	ZINC001025613976	1324467042	/nfs/dbraw/zinc/46/70/42/1324467042.db2.gz	DQVJSJSBBLQWPX-CVEARBPZSA-N	0	3	332.513	3.473	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc3ccccc3n2CC)C1	ZINC001025629702	1324480911	/nfs/dbraw/zinc/48/09/11/1324480911.db2.gz	JBEZNBSEGQOIDU-AEFFLSMTSA-N	0	3	337.467	3.125	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2c(CC)oc3ccccc32)C1	ZINC001025630162	1324482333	/nfs/dbraw/zinc/48/23/33/1324482333.db2.gz	PXRJLISFSALQKD-JKSUJKDBSA-N	0	3	338.451	3.459	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(CC)c(CC)c2)C1	ZINC001025637545	1324489555	/nfs/dbraw/zinc/48/95/55/1324489555.db2.gz	WRUCOSIXRCCVHN-JXFKEZNVSA-N	0	3	326.484	3.275	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)c2ccccc2)CC1	ZINC001026445097	1324808677	/nfs/dbraw/zinc/80/86/77/1324808677.db2.gz	VJIGWIVGDAPHOH-UHFFFAOYSA-N	0	3	337.261	3.226	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)NC1CCC(NCc2ccccc2C#N)CC1	ZINC001026475618	1324834225	/nfs/dbraw/zinc/83/42/25/1324834225.db2.gz	QUEXRITYYZTXHN-DAWZGUTISA-N	0	3	325.456	3.121	20	30		EGEDHN
CC1(C(=O)NC2CCC(NCc3ccccc3C#N)CC2)CC=CC1	ZINC001026553663	1324889640	/nfs/dbraw/zinc/88/96/40/1324889640.db2.gz	MZMMWZBJGVTSFR-UHFFFAOYSA-N	0	3	337.467	3.432	20	30		EGEDHN
C=C1CC(C)(C(=O)NC2CCC(N[C@H](C)c3cnc(C)cn3)CC2)C1	ZINC001026555891	1324893210	/nfs/dbraw/zinc/89/32/10/1324893210.db2.gz	QMBCTDZLDNKOTA-KLAILNCOSA-N	0	3	342.487	3.219	20	30		EGEDHN
Cc1cc(C)c(C(=O)N2CC[C@@H](CNCc3ccccc3C#N)C2)o1	ZINC001026763822	1325010024	/nfs/dbraw/zinc/01/00/24/1325010024.db2.gz	YACJBHTVSMGTID-INIZCTEOSA-N	0	3	337.423	3.020	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H](CNCc2ncc(C)s2)C1	ZINC001026866412	1325054151	/nfs/dbraw/zinc/05/41/51/1325054151.db2.gz	WSFDNVYUVIYGRC-ZDUSSCGKSA-N	0	3	341.908	3.168	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)c2ccn(C)c2)C1	ZINC000963285369	1325068352	/nfs/dbraw/zinc/06/83/52/1325068352.db2.gz	GGNARZDURCVKGT-DOTOQJQBSA-N	0	3	335.879	3.094	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCN(C(=O)C[C@H]2C=CCCC2)C1	ZINC001026914117	1325077061	/nfs/dbraw/zinc/07/70/61/1325077061.db2.gz	RVIQRFCNZWPULN-ZWKOTPCHSA-N	0	3	337.467	3.243	20	30		EGEDHN
CC(C)N1CCCC[C@H]1CN1C(=O)CS/C1=C\C(=O)C(C)(C)C	ZINC000853641226	1325138312	/nfs/dbraw/zinc/13/83/12/1325138312.db2.gz	HYUPEAUXIZQRHT-XGHPXPSOSA-N	0	3	338.517	3.281	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)c2conc2C)C1	ZINC000963356809	1325152497	/nfs/dbraw/zinc/15/24/97/1325152497.db2.gz	GWRSCOCBURIBLI-ZBFHGGJFSA-N	0	3	337.851	3.052	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)C2(CF)CC2)C1	ZINC000963365834	1325168561	/nfs/dbraw/zinc/16/85/61/1325168561.db2.gz	QYUWGVPXIQSLSC-LSDHHAIUSA-N	0	3	328.859	3.192	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](CNCc3csc(C4CC4)n3)C2)C1	ZINC001027051097	1325190284	/nfs/dbraw/zinc/19/02/84/1325190284.db2.gz	QZIDTJTTZJGKCF-CQSZACIVSA-N	0	3	345.512	3.315	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)/C=C/c2ccco2)C1	ZINC001027275550	1325387497	/nfs/dbraw/zinc/38/74/97/1325387497.db2.gz	SJUARMYOQRKENC-GNISGLHKSA-N	0	3	349.434	3.287	20	30		EGEDHN
CCCOc1cccc(CN(C)[C@@H]2CCCN(C(=O)[C@H](C)C#N)C2)c1	ZINC001027335067	1325493592	/nfs/dbraw/zinc/49/35/92/1325493592.db2.gz	BKWOSMLKLXZQKC-SJLPKXTDSA-N	0	3	343.471	3.058	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1ccc(C)c(C)n1)C2	ZINC000964372934	1325496259	/nfs/dbraw/zinc/49/62/59/1325496259.db2.gz	YZDKRPVUTSLJRN-UHFFFAOYSA-N	0	3	333.863	3.082	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1cc(C(C)C)on1)C2	ZINC000964545685	1325564680	/nfs/dbraw/zinc/56/46/80/1325564680.db2.gz	BFVOWEDMINXENI-UHFFFAOYSA-N	0	3	337.851	3.181	20	30		EGEDHN
CC[C@H](SC)C(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001027371382	1325565177	/nfs/dbraw/zinc/56/51/77/1325565177.db2.gz	ADNZZRYLHYGYRX-ROUUACIJSA-N	0	3	345.512	3.123	20	30		EGEDHN
CN(Cc1ccc(F)c(C#N)c1)[C@@H]1CCCN(C(=O)[C@@H]2CC2(C)C)C1	ZINC001027374539	1325570924	/nfs/dbraw/zinc/57/09/24/1325570924.db2.gz	FHHSCRZWFVURED-SJORKVTESA-N	0	3	343.446	3.166	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)C2CC(C)(C)C2)C1	ZINC001027396271	1327613751	/nfs/dbraw/zinc/61/37/51/1327613751.db2.gz	VLLKPPYGVGJVRS-LJQANCHMSA-N	0	3	339.483	3.417	20	30		EGEDHN
CC1(C(=O)NC2CC3(CC(NCc4ccccc4C#N)C3)C2)CC=CC1	ZINC000964900898	1327758695	/nfs/dbraw/zinc/75/86/95/1327758695.db2.gz	MISMWNKPZBWZKH-UHFFFAOYSA-N	0	3	349.478	3.432	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)c2cc(C3CC3)oc2C2CC2)C1	ZINC001027501018	1327765453	/nfs/dbraw/zinc/76/54/53/1327765453.db2.gz	PQWYPULZDXXTOH-INIZCTEOSA-N	0	3	326.440	3.204	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)CCc2ccc(C)c(Cl)c2)C1	ZINC001027510773	1327777945	/nfs/dbraw/zinc/77/79/45/1327777945.db2.gz	GBVBGKMQWNIVEH-QGZVFWFLSA-N	0	3	332.875	3.137	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)[C@H]2CCC2(C)C)C1	ZINC001027535527	1327825979	/nfs/dbraw/zinc/82/59/79/1327825979.db2.gz	HZSYEDYLQGYPEQ-RBUKOAKNSA-N	0	3	339.483	3.417	20	30		EGEDHN
N#Cc1ccc(NCCN[C@@H]2CCCOc3ccc(F)cc32)nc1	ZINC000927165766	1327903594	/nfs/dbraw/zinc/90/35/94/1327903594.db2.gz	UGSLEGQHGFJKNM-MRXNPFEDSA-N	0	3	326.375	3.008	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)C[C@H](C)c2ccc(CC)cc2)C1	ZINC001027573043	1327909471	/nfs/dbraw/zinc/90/94/71/1327909471.db2.gz	YFMWGNJFKDJVNV-PXNSSMCTSA-N	0	3	326.484	3.299	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)[C@H](CC)Cc2cccc(C)c2)C1	ZINC001027604943	1327960580	/nfs/dbraw/zinc/96/05/80/1327960580.db2.gz	TXUOULYRUACLHZ-UXHICEINSA-N	0	3	326.484	3.120	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2cccc3ccccc32)C1	ZINC001027618043	1327982821	/nfs/dbraw/zinc/98/28/21/1327982821.db2.gz	CXIZESHXIKVVGF-BVYCBKJFSA-N	0	3	346.474	3.499	20	30		EGEDHN
CC(C)(C)C(=O)NC1CC2(CC(NCc3ccccc3C#N)C2)C1	ZINC000965875108	1328067687	/nfs/dbraw/zinc/06/76/87/1328067687.db2.gz	HHMXTDOZUVOYPC-UHFFFAOYSA-N	0	3	325.456	3.121	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1sc(C)nc1C)C2	ZINC000965907442	1328096111	/nfs/dbraw/zinc/09/61/11/1328096111.db2.gz	HTLFZSBFLIUOHS-UHFFFAOYSA-N	0	3	339.892	3.143	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2cc(F)c3ccccc3c2)C1	ZINC000966600762	1328351383	/nfs/dbraw/zinc/35/13/83/1328351383.db2.gz	PLMWVPPGLPSSAY-YWZLYKJASA-N	0	3	338.426	3.442	20	30		EGEDHN
C=C(C)CCN1CCC[C@H]1CNC(=O)c1cnc([C@H](C)OC)s1	ZINC001027886223	1328354716	/nfs/dbraw/zinc/35/47/16/1328354716.db2.gz	PJWHDPGYNKRKEE-KBPBESRZSA-N	0	3	337.489	3.011	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2cccc3ccc(C)nc32)C1	ZINC000966899318	1328460658	/nfs/dbraw/zinc/46/06/58/1328460658.db2.gz	GGXOTWSAMWTXOL-KXBFYZLASA-N	0	3	335.451	3.007	20	30		EGEDHN
CC(C)[C@H](NCc1ccc(N(C)CCC#N)cc1)[C@H](O)C(F)(F)F	ZINC000865711369	1329731446	/nfs/dbraw/zinc/73/14/46/1329731446.db2.gz	MCMSCKCTTXWMDB-HOTGVXAUSA-N	0	3	343.393	3.074	20	30		EGEDHN
CN(Cc1ccc(OCC#N)cc1)C[C@@H]1CCN1C(=O)OC(C)(C)C	ZINC000933469202	1329891815	/nfs/dbraw/zinc/89/18/15/1329891815.db2.gz	MGLSBQQGQFOUDO-INIZCTEOSA-N	0	3	345.443	3.030	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1ccc(-c2ccccc2OC)s1	ZINC000868581733	1330296386	/nfs/dbraw/zinc/29/63/86/1330296386.db2.gz	LXAJGJYJMBKBHE-UHFFFAOYSA-N	0	3	342.464	3.109	20	30		EGEDHN
CCC(C)(CC)C(=O)N1C[C@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC000939797882	1330985926	/nfs/dbraw/zinc/98/59/26/1330985926.db2.gz	WWDFHTRZQFUVAM-XJKSGUPXSA-N	0	3	333.501	3.383	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccccc2CC(C)(C)C)[C@@H](C)C1	ZINC000942163537	1331856157	/nfs/dbraw/zinc/85/61/57/1331856157.db2.gz	MRHOJYFZQPRJFY-QFBILLFUSA-N	0	3	326.484	3.349	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C3CC3)[nH]c2C2CC2)[C@H](C)C1	ZINC000942172296	1331859370	/nfs/dbraw/zinc/85/93/70/1331859370.db2.gz	BYMMODSANSUFOJ-KDOFPFPSSA-N	0	3	339.483	3.233	20	30		EGEDHN
C[C@H]1CN(Cc2ccc(C#N)cc2)CC[C@@H]1NC(=O)Cc1ccccc1	ZINC000942189661	1331870408	/nfs/dbraw/zinc/87/04/08/1331870408.db2.gz	UVUNWCOAKJKYQI-UWJYYQICSA-N	0	3	347.462	3.128	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(-c3cccs3)on2)[C@@H](C)C1	ZINC000942538197	1331963329	/nfs/dbraw/zinc/96/33/29/1331963329.db2.gz	MBLPHNGMEUPJDJ-STQMWFEESA-N	0	3	331.441	3.029	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(Cc3ncccc3C)C[C@@H]2C)cc1	ZINC000942552730	1331970760	/nfs/dbraw/zinc/97/07/60/1331970760.db2.gz	IKBCSJANHCECDX-FXAWDEMLSA-N	0	3	347.462	3.012	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2nc(Cl)sc2Cl)[C@H](C)C1	ZINC000942561009	1331975588	/nfs/dbraw/zinc/97/55/88/1331975588.db2.gz	ZYTRFELHGBZDKV-RKDXNWHRSA-N	0	3	334.272	3.076	20	30		EGEDHN
Cc1coc(C(=O)N[C@@H]2CCN(Cc3ccc(C#N)cc3)C[C@H]2C)c1	ZINC000942565350	1331978563	/nfs/dbraw/zinc/97/85/63/1331978563.db2.gz	KNNKLQOOBNVRQZ-CRAIPNDOSA-N	0	3	337.423	3.100	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C(C)(C)c2ccc(Cl)cc2)[C@H](C)C1	ZINC000942595379	1331995236	/nfs/dbraw/zinc/99/52/36/1331995236.db2.gz	YNGALNGEEVTWFP-RHSMWYFYSA-N	0	3	332.875	3.077	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCN(Cc3ncccc3C)C[C@H]2C)CC1	ZINC000942600864	1331998247	/nfs/dbraw/zinc/99/82/47/1331998247.db2.gz	WDQGRLZQRIZKAG-IEBWSBKVSA-N	0	3	341.499	3.463	20	30		EGEDHN
C[C@H]1CN(Cc2ccc(C#N)cc2)CC[C@H]1NC(=O)C1CC2(CC2)C1	ZINC000942701594	1332023174	/nfs/dbraw/zinc/02/31/74/1332023174.db2.gz	SMZUVHSIKSGOCK-HNAYVOBHSA-N	0	3	337.467	3.075	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2c(F)ccc(F)c2Cl)[C@@H](C)C1	ZINC000942959754	1332067052	/nfs/dbraw/zinc/06/70/52/1332067052.db2.gz	NPHHCLYYXAMMMP-GXFFZTMASA-N	0	3	328.790	3.244	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C(C)(C)C)oc2C)[C@@H](C)C1	ZINC000943029855	1332084635	/nfs/dbraw/zinc/08/46/35/1332084635.db2.gz	UKSABSCGRJNLBK-WMLDXEAASA-N	0	3	330.472	3.349	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ncc(Cl)cc2Cl)[C@H](C)C1	ZINC000943767066	1332259111	/nfs/dbraw/zinc/25/91/11/1332259111.db2.gz	QLCNUVVVULZETE-ZWNOBZJWSA-N	0	3	328.243	3.015	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc(-c3ccoc3)c2)[C@H](C)C1	ZINC000944045264	1332314908	/nfs/dbraw/zinc/31/49/08/1332314908.db2.gz	CQMJQGMWILAYMN-UZLBHIALSA-N	0	3	336.435	3.410	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2c[nH]nc2C2CCCCC2)[C@H](C)C1	ZINC000944081214	1332323324	/nfs/dbraw/zinc/32/33/24/1332323324.db2.gz	RAHLGVHMBKSBAU-RHSMWYFYSA-N	0	3	330.476	3.084	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3ccccc3F)CCC2)[C@@H](C)C1	ZINC000944099226	1332325989	/nfs/dbraw/zinc/32/59/89/1332325989.db2.gz	QHTYPKLJMHABJP-QFBILLFUSA-N	0	3	342.458	3.097	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2cccc3ccccc32)[C@H](C)C1	ZINC000944262783	1332356385	/nfs/dbraw/zinc/35/63/85/1332356385.db2.gz	CVKGRTZEBWJKCU-DYESRHJHSA-N	0	3	334.463	3.232	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C(C)(C)C)cc2)[C@@H](C)C1	ZINC000944306202	1332368481	/nfs/dbraw/zinc/36/84/81/1332368481.db2.gz	RBVVNSYHRICNSX-LPHOPBHVSA-N	0	3	326.484	3.448	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccsc2C(F)(F)F)[C@H](C)C1	ZINC000944344534	1332379324	/nfs/dbraw/zinc/37/93/24/1332379324.db2.gz	ARMYHDDTFALKKF-ZYHUDNBSSA-N	0	3	332.391	3.393	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(F)c(F)cc2Cl)[C@H](C)C1	ZINC000944619668	1332419598	/nfs/dbraw/zinc/41/95/98/1332419598.db2.gz	OIUFFYHMYXMAMH-BZNIZROVSA-N	0	3	340.801	3.082	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc(C(F)(F)F)s2)[C@H](C)C1	ZINC000945365319	1332567775	/nfs/dbraw/zinc/56/77/75/1332567775.db2.gz	JSBULHQHIYGETF-MNOVXSKESA-N	0	3	332.391	3.393	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(CC)c(CC)c2)[C@H](C)C1	ZINC000946309619	1332783600	/nfs/dbraw/zinc/78/36/00/1332783600.db2.gz	CFKSOHTZEYQIOT-OXQOHEQNSA-N	0	3	326.484	3.275	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3ccncc3CC)CC[C@@H]2C1	ZINC000946654144	1332871512	/nfs/dbraw/zinc/87/15/12/1332871512.db2.gz	ZMWVOUUQKIQTPF-CALCHBBNSA-N	0	3	347.890	3.181	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CN(Cc3nc(C)cs3)C[C@H]2CC1	ZINC000946714447	1332882774	/nfs/dbraw/zinc/88/27/74/1332882774.db2.gz	VVPAWSMIHNTWPM-IYBDPMFKSA-N	0	3	347.528	3.334	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3ccn(C)c3CC)CC[C@@H]2C1	ZINC000946779240	1332897905	/nfs/dbraw/zinc/89/79/05/1332897905.db2.gz	LDAODLAIHPSTRA-IYBDPMFKSA-N	0	3	349.906	3.124	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3cc(C)[nH]c3C)CC[C@@H]2C1	ZINC000946798171	1332901875	/nfs/dbraw/zinc/90/18/75/1332901875.db2.gz	QNUGJBXULFEMKU-IYBDPMFKSA-N	0	3	335.879	3.168	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)c2ccccc2O)CCN1Cc1cccc(C#N)c1	ZINC000947046082	1332988219	/nfs/dbraw/zinc/98/82/19/1332988219.db2.gz	VZDWRVFOBNIWRP-YJBOKZPZSA-N	0	3	349.434	3.047	20	30		EGEDHN
Cc1cc(CN2CC[C@@H](NC(=O)c3ccc(C#N)[nH]3)C[C@H]2C)cs1	ZINC000947217217	1333054441	/nfs/dbraw/zinc/05/44/41/1333054441.db2.gz	LEOIASROIMIPLR-IUODEOHRSA-N	0	3	342.468	3.039	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cn(C)c3ccc(F)cc23)C[C@@H]1C	ZINC000947399578	1333115302	/nfs/dbraw/zinc/11/53/02/1333115302.db2.gz	HGZPRVAYUGVGDA-ZFWWWQNUSA-N	0	3	329.419	3.086	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2csc(C(F)(F)F)c2)C[C@H]1C	ZINC000947497545	1333147156	/nfs/dbraw/zinc/14/71/56/1333147156.db2.gz	JHBXCDNZHGLQLU-YPMHNXCESA-N	0	3	344.402	3.373	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2nc3ccccc3cc2C)C[C@H]1C	ZINC000947559118	1333172395	/nfs/dbraw/zinc/17/23/95/1333172395.db2.gz	GPIRRHQBFHJNET-AEFFLSMTSA-N	0	3	335.451	3.149	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccccc2OC2CCC2)C[C@@H]1C	ZINC000947710384	1333236168	/nfs/dbraw/zinc/23/61/68/1333236168.db2.gz	MPBBRRGBEIWMEX-JKSUJKDBSA-N	0	3	328.456	3.387	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3cc(F)ccc3o2)C[C@H]1C	ZINC000947771738	1333256572	/nfs/dbraw/zinc/25/65/72/1333256572.db2.gz	QOXABXXGSIQOKM-CZUORRHYSA-N	0	3	328.387	3.178	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(-c3ccccc3)ccn2)C[C@H]1C	ZINC000947857785	1333283136	/nfs/dbraw/zinc/28/31/36/1333283136.db2.gz	RQMWLLWHNSGXKX-XLIONFOSSA-N	0	3	347.462	3.355	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnn(C3CCCCC3)c2)C[C@@H]1C	ZINC000947899036	1333296993	/nfs/dbraw/zinc/29/69/93/1333296993.db2.gz	DERGNCQINKYKPJ-RDJZCZTQSA-N	0	3	330.476	3.157	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnn(CCC(C)C)c2C)C[C@H]1C	ZINC000947903676	1333300098	/nfs/dbraw/zinc/30/00/98/1333300098.db2.gz	LYSRDBSRVJIIIL-NVXWUHKLSA-N	0	3	332.492	3.006	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnn(CCCC)c2CC)C[C@H]1C	ZINC000947908218	1333302066	/nfs/dbraw/zinc/30/20/66/1333302066.db2.gz	QCTARMSTLOASEP-HZPDHXFCSA-N	0	3	332.492	3.014	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cnc(-c3ccco3)s2)C[C@H]1C	ZINC000947944123	1333314359	/nfs/dbraw/zinc/31/43/59/1333314359.db2.gz	RBVKIUNGUIOCMH-KGLIPLIRSA-N	0	3	343.452	3.009	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2sc(CCC)nc2C)C[C@@H]1C	ZINC000948036079	1333348828	/nfs/dbraw/zinc/34/88/28/1333348828.db2.gz	NMWLSFAHWHXRPB-ZFWWWQNUSA-N	0	3	333.501	3.010	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2sc(CCC)nc2C)C[C@H]1C	ZINC000948036078	1333349200	/nfs/dbraw/zinc/34/92/00/1333349200.db2.gz	NMWLSFAHWHXRPB-UKRRQHHQSA-N	0	3	333.501	3.010	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2c[nH]c3c2cccc3CC)C[C@@H]1C	ZINC000948069185	1333364199	/nfs/dbraw/zinc/36/41/99/1333364199.db2.gz	DBDRJNVGMYOHCR-DOTOQJQBSA-N	0	3	337.467	3.336	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)[C@@H]2C[C@H]2c2sccc2C)CC1	ZINC000948373740	1333500175	/nfs/dbraw/zinc/50/01/75/1333500175.db2.gz	NYKFFNPCUMYFJR-KZNAEPCWSA-N	0	3	344.524	3.496	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2sc(Cl)nc2C)CC1	ZINC000948408419	1333514444	/nfs/dbraw/zinc/51/44/44/1333514444.db2.gz	PLXYTDNTVYFDAB-ZDUSSCGKSA-N	0	3	339.892	3.055	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cc3c(o2)CCCC3)CC1	ZINC000948432476	1333522221	/nfs/dbraw/zinc/52/22/21/1333522221.db2.gz	HGHZYOBGCXNUKI-QGZVFWFLSA-N	0	3	328.456	3.108	20	30		EGEDHN
C=CCn1cccc1C(=O)N(C)[C@@H]1CCCN(C/C=C\Cl)CC1	ZINC000948439587	1333526246	/nfs/dbraw/zinc/52/62/46/1333526246.db2.gz	SFUFYJWJDHBADL-CXSQMQJXSA-N	0	3	335.879	3.353	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cn(C)c3ccccc23)CC1	ZINC000948595493	1333590027	/nfs/dbraw/zinc/59/00/27/1333590027.db2.gz	ZWUJHNTVIMJJFL-QGZVFWFLSA-N	0	3	337.467	3.128	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)C2([C@H]3CCCCO3)CCC2)CC1	ZINC000948612352	1333596517	/nfs/dbraw/zinc/59/65/17/1333596517.db2.gz	NLTIIIPMYRZXQH-RBUKOAKNSA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2cc3c(cc(C)cc3C)[nH]2)CC1	ZINC000948655899	1333615446	/nfs/dbraw/zinc/61/54/46/1333615446.db2.gz	OUSWJTZEVXLJMT-QGZVFWFLSA-N	0	3	337.467	3.344	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cnc3ccsc3c2)CC1	ZINC000948669157	1333622269	/nfs/dbraw/zinc/62/22/69/1333622269.db2.gz	AQAUUGLOFJJAGN-INIZCTEOSA-N	0	3	341.480	3.246	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2c(C)cc(F)cc2C)CC1	ZINC000948673761	1333623413	/nfs/dbraw/zinc/62/34/13/1333623413.db2.gz	IBRVHWXNUCJOHM-SFHVURJKSA-N	0	3	330.447	3.392	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cncc3sccc32)CC1	ZINC000948711844	1333643544	/nfs/dbraw/zinc/64/35/44/1333643544.db2.gz	UXEJJUJZJJLAQG-OAHLLOKOSA-N	0	3	341.480	3.246	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)Cc2cc(C)ccc2C)CC1	ZINC000948742701	1333654724	/nfs/dbraw/zinc/65/47/24/1333654724.db2.gz	LHOJFBRBJMSBFG-FQEVSTJZSA-N	0	3	326.484	3.182	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N(C)[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948796484	1333682519	/nfs/dbraw/zinc/68/25/19/1333682519.db2.gz	IMVLXWSVCXVZFQ-VAMGGRTRSA-N	0	3	339.483	3.417	20	30		EGEDHN
CN(C(=O)[C@H]1CC12CC2)[C@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948809083	1333690504	/nfs/dbraw/zinc/69/05/04/1333690504.db2.gz	LTHAZYYIMYJFRN-RBUKOAKNSA-N	0	3	337.467	3.171	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)[C@@H](C)c2cccc(C)c2)CC1	ZINC000948816904	1333696221	/nfs/dbraw/zinc/69/62/21/1333696221.db2.gz	PKPAJDWCCBTCON-AZUAARDMSA-N	0	3	326.484	3.435	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccccc2C)CC1	ZINC000948850258	1333709096	/nfs/dbraw/zinc/70/90/96/1333709096.db2.gz	YSNZLXATLPNCHG-SESVDKBCSA-N	0	3	338.495	3.435	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@@H]1CNC(=O)[C@H]1CCCOC1	ZINC000948899233	1333724584	/nfs/dbraw/zinc/72/45/84/1333724584.db2.gz	RMYNIDAFJUFSDX-ICSRJNTNSA-N	0	3	342.483	3.095	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@H]1CNC(=O)c1cc(F)c[nH]1	ZINC000948936387	1333740836	/nfs/dbraw/zinc/74/08/36/1333740836.db2.gz	PIRNLIIWYWXIPK-LJQANCHMSA-N	0	3	341.430	3.449	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2c3ccccc3CCN2CCC)cc1	ZINC000948945646	1333743242	/nfs/dbraw/zinc/74/32/42/1333743242.db2.gz	AFPBMWDKBYKQKA-NRFANRHFSA-N	0	3	332.447	3.407	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@]1(C)CCC[C@H]1CC)CCO2	ZINC000949124153	1333781391	/nfs/dbraw/zinc/78/13/91/1333781391.db2.gz	RRUNNPOKPVUBMX-IEBWSBKVSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1CCCC[C@@H]1CC)CCO2	ZINC000949221206	1333797706	/nfs/dbraw/zinc/79/77/06/1333797706.db2.gz	UZFKEQZCKXLBSG-ROUUACIJSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1CC[C@H](CC)CC1)CCO2	ZINC000949233073	1333799801	/nfs/dbraw/zinc/79/98/01/1333799801.db2.gz	BTBRVDFWYZMLTK-IYARVYRRSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@]1(C)CCC(C)=C(C)C1)CCO2	ZINC000949251231	1333804250	/nfs/dbraw/zinc/80/42/50/1333804250.db2.gz	ISETYTHTIIRYMQ-HXUWFJFHSA-N	0	3	346.515	3.392	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C[C@H]3CC=CCC3)CC2)C1	ZINC000949437061	1333847295	/nfs/dbraw/zinc/84/72/95/1333847295.db2.gz	RGWKVGMHOYWBPS-SFHVURJKSA-N	0	3	332.488	3.002	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@H]3C[C@H]3C3CCCC3)CC2)C1	ZINC000949503258	1333862185	/nfs/dbraw/zinc/86/21/85/1333862185.db2.gz	AXSHFIGIXHDASN-OALUTQOASA-N	0	3	346.515	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C(C3CC3)C3CC3)CC2)C1	ZINC000949509705	1333863393	/nfs/dbraw/zinc/86/33/93/1333863393.db2.gz	XICSVOOATBPKQZ-UHFFFAOYSA-N	0	3	346.515	3.082	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2cn(C)c3ccccc23)C1	ZINC000967272354	1335682069	/nfs/dbraw/zinc/68/20/69/1335682069.db2.gz	BBSYRLISYYKICY-MAUKXSAKSA-N	0	3	325.456	3.195	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2cnc(CC3CC3)s2)C1	ZINC000967402222	1335726903	/nfs/dbraw/zinc/72/69/03/1335726903.db2.gz	ONOVCNNFTIIUIY-ZFWWWQNUSA-N	0	3	333.501	3.112	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2cc(C(C)(C)C)oc2C)C1	ZINC000968357548	1335902075	/nfs/dbraw/zinc/90/20/75/1335902075.db2.gz	OULSMOWXJOBJAW-WMLDXEAASA-N	0	3	330.472	3.349	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(-c3cn[nH]c3)cc2)C1	ZINC000968406253	1335922026	/nfs/dbraw/zinc/92/20/26/1335922026.db2.gz	ZESTUPAUTCHHMX-BEFAXECRSA-N	0	3	338.455	3.093	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)Cc2csc(C(C)(C)C)n2)C1	ZINC000968412805	1335923758	/nfs/dbraw/zinc/92/37/58/1335923758.db2.gz	DNQFOSMLIUUCST-ZBFHGGJFSA-N	0	3	349.544	3.386	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccc(C(F)F)cc2F)C1	ZINC000968459083	1335931360	/nfs/dbraw/zinc/93/13/60/1335931360.db2.gz	IZALJTDSPDCDRI-MLGOLLRUSA-N	0	3	338.373	3.227	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000968584708	1335974617	/nfs/dbraw/zinc/97/46/17/1335974617.db2.gz	ZWDWRYDUDVTKDW-APWZRJJASA-N	0	3	326.484	3.448	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2coc3ccc(F)cc23)C1	ZINC000968597205	1335978276	/nfs/dbraw/zinc/97/82/76/1335978276.db2.gz	UGKKLMDVFRVQEN-CXAGYDPISA-N	0	3	328.387	3.035	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(OC(C)C)cc2)C1	ZINC000968611513	1335983872	/nfs/dbraw/zinc/98/38/72/1335983872.db2.gz	XCMDCXPQZBJOQP-APWZRJJASA-N	0	3	330.472	3.490	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)Cc2ccc(OC(C)C)cc2)C1	ZINC000968669563	1336004125	/nfs/dbraw/zinc/00/41/25/1336004125.db2.gz	OYAODTOVXYNZTG-FXAWDEMLSA-N	0	3	344.499	3.419	20	30		EGEDHN
N#Cc1ccc(CN2CCCCC[C@H]2CNC(=O)c2ccc[nH]2)cc1	ZINC000968754205	1336039204	/nfs/dbraw/zinc/03/92/04/1336039204.db2.gz	YKBMHHLHRXTMQE-SFHVURJKSA-N	0	3	336.439	3.061	20	30		EGEDHN
CC1=C(C)C[C@H](C(=O)N2CC[C@@H](NCc3ccc(C#N)s3)C2)CC1	ZINC000968777125	1336047320	/nfs/dbraw/zinc/04/73/20/1336047320.db2.gz	VYQCDGWZBXUAFV-HZPDHXFCSA-N	0	3	343.496	3.447	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cc(C)n([C@H](C)C2CC2)n1	ZINC000968923594	1336091529	/nfs/dbraw/zinc/09/15/29/1336091529.db2.gz	XYFNCWMWBLGTRA-AEFFLSMTSA-N	0	3	344.503	3.323	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccn(-c2ccccc2)n1	ZINC000968925800	1336092391	/nfs/dbraw/zinc/09/23/91/1336092391.db2.gz	NHGWVDYEWVKMOW-SFHVURJKSA-N	0	3	338.455	3.033	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1cccc(-n2cccc2)c1	ZINC000968938986	1336097308	/nfs/dbraw/zinc/09/73/08/1336097308.db2.gz	YWWJDXCDKJKLDD-NRFANRHFSA-N	0	3	349.478	3.475	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1cccc2c1ccn2C	ZINC000969072950	1336137932	/nfs/dbraw/zinc/13/79/32/1336137932.db2.gz	UZHSVQMVIOWRDM-KRWDZBQOSA-N	0	3	337.467	3.176	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1ccc2ccncc2c1	ZINC000969105455	1336145557	/nfs/dbraw/zinc/14/55/57/1336145557.db2.gz	HUJQTPRNLXBCNJ-HXUWFJFHSA-N	0	3	335.451	3.233	20	30		EGEDHN
C#CCCN1CC([C@H](C)NC(=O)c2ccccc2CC(C)(C)C)C1	ZINC000969925638	1336261918	/nfs/dbraw/zinc/26/19/18/1336261918.db2.gz	CWRCZQJQUQHMLF-INIZCTEOSA-N	0	3	326.484	3.349	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)C2CCc3ccccc3CC2)C1	ZINC000970012443	1336271863	/nfs/dbraw/zinc/27/18/63/1336271863.db2.gz	MRKJCHMIWJKSGK-MRXNPFEDSA-N	0	3	326.484	3.194	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccc(C)c(NC(C)=O)c2)CC1	ZINC001005440288	1336349452	/nfs/dbraw/zinc/34/94/52/1336349452.db2.gz	NDSOQJQCSWCAST-UHFFFAOYSA-N	0	3	343.471	3.066	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2nccc3ccsc32)CC1	ZINC001005534347	1336369083	/nfs/dbraw/zinc/36/90/83/1336369083.db2.gz	XDUNKDGPSUKXDT-UHFFFAOYSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cc(Br)co2)CC1	ZINC001006083581	1336449393	/nfs/dbraw/zinc/44/93/93/1336449393.db2.gz	JJNIMYJTBIMXMS-UHFFFAOYSA-N	0	3	341.249	3.155	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)C(C)(C)c2ccccc2OC)CC1	ZINC001006480705	1336514649	/nfs/dbraw/zinc/51/46/49/1336514649.db2.gz	LIHJPZHJTYPNJM-UHFFFAOYSA-N	0	3	330.472	3.082	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CCCN(Cc2ccccc2C)C1	ZINC001007503341	1336659354	/nfs/dbraw/zinc/65/93/54/1336659354.db2.gz	QKRPLTILNNHDOL-IBGZPJMESA-N	0	3	337.467	3.377	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H](NC(=O)c2cc3ccncc3s2)C1	ZINC001007501616	1336659387	/nfs/dbraw/zinc/65/93/87/1336659387.db2.gz	ZSWQQTDVAXFECH-OAHLLOKOSA-N	0	3	329.469	3.457	20	30		EGEDHN
C=C(C)CCN1CCC[C@H](NC(=O)c2cc3c(C)nn(C)c3s2)C1	ZINC001008111035	1336771792	/nfs/dbraw/zinc/77/17/92/1336771792.db2.gz	AFXTYGPNHOKZJZ-AWEZNQCLSA-N	0	3	346.500	3.104	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCN([C@@H](C)c3ccccc3)C2)nc1	ZINC001009270130	1336994371	/nfs/dbraw/zinc/99/43/71/1336994371.db2.gz	QYAGEDAWQDDKNZ-LPHOPBHVSA-N	0	3	333.435	3.018	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)C[C@H]2CCc3ccccc3C2)C1	ZINC001009325088	1337006710	/nfs/dbraw/zinc/00/67/10/1337006710.db2.gz	HTKABRHAKVGMSC-PXNSSMCTSA-N	0	3	326.484	3.338	20	30		EGEDHN
CC(C)c1ccccc1CN1CC[C@H](NC(=O)c2cc(C#N)c[nH]2)C1	ZINC001010482050	1337204877	/nfs/dbraw/zinc/20/48/77/1337204877.db2.gz	WNNWCPJSMLTYTD-KRWDZBQOSA-N	0	3	336.439	3.014	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3ccccc3CC)C2)cc1	ZINC001015481224	1338154513	/nfs/dbraw/zinc/15/45/13/1338154513.db2.gz	DKUGXUQSGKCPCL-NRFANRHFSA-N	0	3	332.447	3.235	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2coc3ccc(CC)cc32)CC1	ZINC001016621377	1338667364	/nfs/dbraw/zinc/66/73/64/1338667364.db2.gz	PZKUPFCXJTYKNJ-IBGZPJMESA-N	0	3	336.435	3.213	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cccc3c2CCCC3)CC1	ZINC001016639968	1338673744	/nfs/dbraw/zinc/67/37/44/1338673744.db2.gz	DVSIVSQJDKZHIL-HXUWFJFHSA-N	0	3	336.479	3.173	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)Cc2cccc(C(C)C)c2)CC1	ZINC001016707665	1338697737	/nfs/dbraw/zinc/69/77/37/1338697737.db2.gz	ZETRNCHPNXUDPF-FQEVSTJZSA-N	0	3	338.495	3.347	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@@H]3NC(=O)[C@]34C[C@H]3CCC4)CC2)c1	ZINC001016739130	1338707929	/nfs/dbraw/zinc/70/79/29/1338707929.db2.gz	ZRYCGFZNEPHMHS-XQBPLPMBSA-N	0	3	349.478	3.219	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2ccccc2O[C@H](C)CC)CC1	ZINC001016854037	1338747652	/nfs/dbraw/zinc/74/76/52/1338747652.db2.gz	SRZAEERRFBZJDN-VQIMIIECSA-N	0	3	340.467	3.081	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccsc2C(F)F)CC1	ZINC001016951693	1338781661	/nfs/dbraw/zinc/78/16/61/1338781661.db2.gz	SBPTWAGUZIUZFX-CYBMUJFWSA-N	0	3	338.423	3.293	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCCN(C(=O)CC2CC2)C1	ZINC001017014144	1338806916	/nfs/dbraw/zinc/80/69/16/1338806916.db2.gz	LHQYBCWQBJWZOU-HNNXBMFYSA-N	0	3	331.485	3.090	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](CN(C)Cc2c(C)noc2CC)C1	ZINC001017180084	1338923521	/nfs/dbraw/zinc/92/35/21/1338923521.db2.gz	RKMGBJJSUAWTQX-MRXNPFEDSA-N	0	3	347.503	3.428	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H](CN(C)Cc3cnoc3C)C2)C1	ZINC001017208572	1338954868	/nfs/dbraw/zinc/95/48/68/1338954868.db2.gz	TUBAZSFTVFWLKE-INIZCTEOSA-N	0	3	331.460	3.010	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccccc1CC	ZINC001017655817	1339384863	/nfs/dbraw/zinc/38/48/63/1339384863.db2.gz	KWHSSBSIQLXUOP-BGYRXZFFSA-N	0	3	326.484	3.433	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccc2cnccc21	ZINC001017662825	1339386712	/nfs/dbraw/zinc/38/67/12/1339386712.db2.gz	MUDGOVIEVYIQHF-KDURUIRLSA-N	0	3	335.451	3.029	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H](C)c1c(C)noc1C	ZINC001017670450	1339388272	/nfs/dbraw/zinc/38/82/72/1339388272.db2.gz	DFTVYTSECTUMPK-OLMNPRSZSA-N	0	3	345.487	3.426	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H]1CCCC1(F)F	ZINC001017851376	1339430842	/nfs/dbraw/zinc/43/08/42/1339430842.db2.gz	TZSYVBSSLACCGI-HRCADAONSA-N	0	3	326.431	3.453	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc(F)cc1Cl	ZINC001017882126	1339438923	/nfs/dbraw/zinc/43/89/23/1339438923.db2.gz	HEVMDTIUZGARMY-IYBDPMFKSA-N	0	3	336.838	3.273	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@H](C)c1cccnc1	ZINC001018020725	1339482887	/nfs/dbraw/zinc/48/28/87/1339482887.db2.gz	ATXNQMLBEJYWMT-YTQUADARSA-N	0	3	327.472	3.217	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1c[nH]nc1-c1ccsc1	ZINC001018111321	1339503469	/nfs/dbraw/zinc/50/34/69/1339503469.db2.gz	CGCGERSRWPDEMX-GASCZTMLSA-N	0	3	342.468	3.003	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CC[C@H]1CC(C)(C)CO1	ZINC001018213947	1339535490	/nfs/dbraw/zinc/53/54/90/1339535490.db2.gz	NBVLBPSOUYYBMW-KSZLIROESA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CCc1ccccc1OC	ZINC001018245196	1339547813	/nfs/dbraw/zinc/54/78/13/1339547813.db2.gz	GXUDXFNEDRQOQR-KDURUIRLSA-N	0	3	342.483	3.269	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)C3CCCCCC3)C2)cc1F	ZINC001018610117	1339681337	/nfs/dbraw/zinc/68/13/37/1339681337.db2.gz	KEKKOQBGOKXRTR-SFHVURJKSA-N	0	3	343.446	3.358	20	30		EGEDHN
Cc1cscc1C(=O)N1CC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001018679193	1339699767	/nfs/dbraw/zinc/69/97/67/1339699767.db2.gz	KGWKBXJYAZBFRD-HNNXBMFYSA-N	0	3	343.427	3.072	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1csc(-c2ccco2)n1	ZINC001028101731	1340426653	/nfs/dbraw/zinc/42/66/53/1340426653.db2.gz	SGCJGRUVJNHVTG-CYBMUJFWSA-N	0	3	331.441	3.173	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@@H]2CCCN2Cc2ccc(C)cc2C)c1	ZINC001028128227	1340446495	/nfs/dbraw/zinc/44/64/95/1340446495.db2.gz	BYIXTSFUOWWBDV-NRFANRHFSA-N	0	3	347.462	3.074	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1ccccc1OC1CCC1	ZINC001028129534	1340447105	/nfs/dbraw/zinc/44/71/05/1340447105.db2.gz	QPVZKVQHERERHS-MRXNPFEDSA-N	0	3	328.456	3.388	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCCN2Cc2ccc(C)cc2C)nc1	ZINC001028271964	1340524781	/nfs/dbraw/zinc/52/47/81/1340524781.db2.gz	QQULBEUDSJVQBC-FQEVSTJZSA-N	0	3	347.462	3.074	20	30		EGEDHN
C#CCCN1CCC[C@@H]1CNC(=O)c1cc2c(s1)CCCCC2	ZINC001028300785	1340549712	/nfs/dbraw/zinc/54/97/12/1340549712.db2.gz	HHOZJHLGMNUJBJ-MRXNPFEDSA-N	0	3	330.497	3.235	20	30		EGEDHN
C#CCCN1CCC[C@@H]1CNC(=O)c1csc2c1CC[C@@H](C)C2	ZINC001028300920	1340549727	/nfs/dbraw/zinc/54/97/27/1340549727.db2.gz	KBFKJLNYBCAZBY-HUUCEWRRSA-N	0	3	330.497	3.090	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](CNC(=O)c3occc3Cl)C2)cc1	ZINC001028784378	1340815824	/nfs/dbraw/zinc/81/58/24/1340815824.db2.gz	MSCIPENBDDIHMM-OAHLLOKOSA-N	0	3	343.814	3.057	20	30		EGEDHN
Cc1ccc(C)c(C(=O)NC[C@H]2CCN(Cc3cccc(C#N)c3)C2)c1	ZINC001028952444	1340892937	/nfs/dbraw/zinc/89/29/37/1340892937.db2.gz	REBVWCVPSRLOEM-HXUWFJFHSA-N	0	3	347.462	3.427	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H](CNC(=O)C3CCC=CCC3)C2)c1	ZINC001028986756	1340901369	/nfs/dbraw/zinc/90/13/69/1340901369.db2.gz	QFKHZHIKOVMDPN-IBGZPJMESA-N	0	3	337.467	3.243	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)C1CCN(C(=O)c2ccoc2)CC1	ZINC001029051812	1340919510	/nfs/dbraw/zinc/91/95/10/1340919510.db2.gz	YYFWCJLEQPCICU-HNNXBMFYSA-N	0	3	337.423	3.182	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC([C@H](C)NCc2cc(F)ccc2C#N)CC1	ZINC001029076905	1340924566	/nfs/dbraw/zinc/92/45/66/1340924566.db2.gz	BWFBTNWLPQSDQY-XCROGBHMSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC([C@H](C)NCc2cnc(C)cn2)CC1	ZINC001029139225	1340940518	/nfs/dbraw/zinc/94/05/18/1340940518.db2.gz	ATLGPVSPKZEKRW-OXJNMPFZSA-N	0	3	344.503	3.104	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1C[C@H]2CC[C@@H](C1)N2CCCc1ccc(Cl)cc1	ZINC001029242949	1340960472	/nfs/dbraw/zinc/96/04/72/1340960472.db2.gz	PFMQPUSKRSXOAI-JCGIZDLHSA-N	0	3	345.874	3.107	20	30		EGEDHN
C[C@H](c1ccc(F)cc1F)N(C)C[C@H]1CCN(C(=O)C#CC2CC2)C1	ZINC001029733134	1341057431	/nfs/dbraw/zinc/05/74/31/1341057431.db2.gz	GDHAGVSCWPJZAU-GDBMZVCRSA-N	0	3	346.421	3.220	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc3c(cc(C)cc3C)[nH]2)CC[C@@H]1C	ZINC001071712979	1354871363	/nfs/dbraw/zinc/87/13/63/1354871363.db2.gz	WZTWYAOSOQMRFF-DLBZAZTESA-N	0	3	337.467	3.391	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(-n3ccnc3)cc2)CC[C@@H]1C	ZINC001071712510	1354871568	/nfs/dbraw/zinc/87/15/68/1354871568.db2.gz	PGOIKRMYSCARBP-WMZOPIPTSA-N	0	3	338.455	3.031	20	30		EGEDHN
C[C@@H](CC(=O)N1CC[C@@H](CN(C)Cc2ccc(C#N)s2)C1)C1CC1	ZINC001029911877	1341114575	/nfs/dbraw/zinc/11/45/75/1341114575.db2.gz	SOIYLZSUZXCPHJ-GJZGRUSLSA-N	0	3	345.512	3.336	20	30		EGEDHN
CCN1CCC[C@H](N(Cc2ccccc2)C(=O)c2cc(C#N)c[nH]2)C1	ZINC001029918133	1341118335	/nfs/dbraw/zinc/11/83/35/1341118335.db2.gz	XYTOOOWFUDANFW-SFHVURJKSA-N	0	3	336.439	3.013	20	30		EGEDHN
C=CCCN1CCC[C@@H](N(Cc2ccccc2)C(=O)c2cnco2)C1	ZINC001029921741	1341120496	/nfs/dbraw/zinc/12/04/96/1341120496.db2.gz	QMIOYIBBBAPKFG-GOSISDBHSA-N	0	3	339.439	3.358	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1F)CC1CCN(C(=O)C2CCC2)CC1	ZINC001029923472	1341121014	/nfs/dbraw/zinc/12/10/14/1341121014.db2.gz	IOBKRHKXWVAOPT-UHFFFAOYSA-N	0	3	343.446	3.168	20	30		EGEDHN
CC(C)CC(=O)N1CCC(CN(C)Cc2cc(C#N)ccc2F)CC1	ZINC001029928703	1341123960	/nfs/dbraw/zinc/12/39/60/1341123960.db2.gz	UENGRTYSMMIYBF-UHFFFAOYSA-N	0	3	345.462	3.414	20	30		EGEDHN
Cc1cccc(Cl)c1CN(C)CC1CCN(C(=O)[C@@H](C)C#N)CC1	ZINC001029946134	1341130637	/nfs/dbraw/zinc/13/06/37/1341130637.db2.gz	HNWVRPLDJSTVPO-HNNXBMFYSA-N	0	3	347.890	3.479	20	30		EGEDHN
CC[C@H](F)C(=O)N1CCC(CN(C)Cc2cc(C#N)ccc2F)CC1	ZINC001029985379	1341144508	/nfs/dbraw/zinc/14/45/08/1341144508.db2.gz	WWXHLJNICDHGFH-KRWDZBQOSA-N	0	3	349.425	3.116	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC(CN(C)Cc2ccc(F)cn2)CC1	ZINC001029990429	1341148431	/nfs/dbraw/zinc/14/84/31/1341148431.db2.gz	MBCRPHBXLWEHMB-FQEVSTJZSA-N	0	3	347.478	3.493	20	30		EGEDHN
C#Cc1ccc(C(=O)NCC2CN(Cc3ccccc3C3CC3)C2)cc1	ZINC001031892172	1341417610	/nfs/dbraw/zinc/41/76/10/1341417610.db2.gz	PIGPRAZVRIPIAE-UHFFFAOYSA-N	0	3	344.458	3.407	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3coc4ccc(Cl)cc34)C2)C1	ZINC001073155114	1355630400	/nfs/dbraw/zinc/63/04/00/1355630400.db2.gz	RHIRQJPQHPPBBT-UHFFFAOYSA-N	0	3	330.815	3.420	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C[C@H]1CCc2ccccc2C1	ZINC001032751992	1341602942	/nfs/dbraw/zinc/60/29/42/1341602942.db2.gz	WMVBXFRUBJARIU-YYWHXJBOSA-N	0	3	338.495	3.433	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(OCC(C)C)cc1	ZINC001032766837	1341607881	/nfs/dbraw/zinc/60/78/81/1341607881.db2.gz	SFKQCTOZHKZPLK-ROUUACIJSA-N	0	3	328.456	3.196	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)C[C@@H](C)c1ccc(OC)cc1	ZINC001032793331	1341614917	/nfs/dbraw/zinc/61/49/17/1341614917.db2.gz	ABRFNKIEGNFJSA-NJAFHUGGSA-N	0	3	328.456	3.050	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccccc1OCC1CC1	ZINC001032799187	1341618031	/nfs/dbraw/zinc/61/80/31/1341618031.db2.gz	YVKQWJAJAKLKHS-ROUUACIJSA-N	0	3	340.467	3.340	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1c[nH]c2ccc(F)cc21	ZINC001032819556	1341626475	/nfs/dbraw/zinc/62/64/75/1341626475.db2.gz	IJWBOELPHVLUBY-GJZGRUSLSA-N	0	3	327.403	3.172	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)Cc2coc3ccc(C)cc23)C1	ZINC001033117642	1341730708	/nfs/dbraw/zinc/73/07/08/1341730708.db2.gz	JLGFRMRQGVZQPO-QGZVFWFLSA-N	0	3	326.440	3.393	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2ccnc(-c3ccco3)c2)C1	ZINC001033177532	1341746502	/nfs/dbraw/zinc/74/65/02/1341746502.db2.gz	RIJUEOWGANWPKP-INIZCTEOSA-N	0	3	325.412	3.064	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)C[C@@H]2C[C@H]2Cc2ccccc2)C1	ZINC001033287400	1341768228	/nfs/dbraw/zinc/76/82/28/1341768228.db2.gz	NQMVZBYUIXWTIW-HSALFYBXSA-N	0	3	326.484	3.364	20	30		EGEDHN
C=CCCN1CC[C@@H](N(C)C(=O)c2cnc(CC(C)(C)C)s2)C1	ZINC001033558814	1341871885	/nfs/dbraw/zinc/87/18/85/1341871885.db2.gz	VFIADXGEQCOSJG-CQSZACIVSA-N	0	3	335.517	3.454	20	30		EGEDHN
C#CCCN1CC[C@@H](N(C)C(=O)C(C)(C)c2ccccc2Cl)C1	ZINC001033603857	1341894567	/nfs/dbraw/zinc/89/45/67/1341894567.db2.gz	PGQLDNNGHHCYCJ-OAHLLOKOSA-N	0	3	332.875	3.174	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)C[C@H]2CCc3ccccc3C2)C1	ZINC001033611353	1341901525	/nfs/dbraw/zinc/90/15/25/1341901525.db2.gz	RNUUDYIYZYYUJI-PXNSSMCTSA-N	0	3	326.484	3.290	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N(C)[C@@H]1CCN(Cc2cccc(C)c2)C1	ZINC001033617582	1341905226	/nfs/dbraw/zinc/90/52/26/1341905226.db2.gz	WBKYIIAAUVDULS-JOCHJYFZSA-N	0	3	346.474	3.252	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2cccc(OCC(C)C)c2)C1	ZINC001033648780	1341927817	/nfs/dbraw/zinc/92/78/17/1341927817.db2.gz	OXBYXRQHAHZPQO-SFHVURJKSA-N	0	3	330.472	3.444	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2nsc3ccccc32)C1	ZINC001033841669	1342037944	/nfs/dbraw/zinc/03/79/44/1342037944.db2.gz	YCYABZGGPGVCSH-AWEZNQCLSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccnn2C2CCCC2)C1	ZINC001033844547	1342040331	/nfs/dbraw/zinc/04/03/31/1342040331.db2.gz	WAHRNNRULRMPLV-KRWDZBQOSA-N	0	3	330.476	3.111	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@@H]2CCc3cc(C)ccc3O2)C1	ZINC001033900951	1342073599	/nfs/dbraw/zinc/07/35/99/1342073599.db2.gz	NMHYNQOUHZKUPK-ICSRJNTNSA-N	0	3	342.483	3.188	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2cnc3ccccc3c2C)C1	ZINC001033905579	1342077885	/nfs/dbraw/zinc/07/78/85/1342077885.db2.gz	MHTRCZZPXHPBNT-QGZVFWFLSA-N	0	3	335.451	3.103	20	30		EGEDHN
C#CCOc1ccc(C(=O)N(CC)[C@@H]2CCN(CC=C(C)C)C2)cc1	ZINC001033976667	1342126145	/nfs/dbraw/zinc/12/61/45/1342126145.db2.gz	IFZOWAKATMGTEC-LJQANCHMSA-N	0	3	340.467	3.201	20	30		EGEDHN
C=CCCN1CC[C@@H](N(CC)C(=O)c2cnc([C@@H]3CCCO3)s2)C1	ZINC001033980536	1342128091	/nfs/dbraw/zinc/12/80/91/1342128091.db2.gz	UXFKRQXGLOUXPU-CABCVRRESA-N	0	3	349.500	3.107	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccc3c(c2)C[C@@H](C)O3)C1	ZINC001033991752	1342134132	/nfs/dbraw/zinc/13/41/32/1342134132.db2.gz	LNEFPGRYICKACG-CRAIPNDOSA-N	0	3	328.456	3.123	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2ccc(C(F)F)cc2F)C1	ZINC001034000553	1342139991	/nfs/dbraw/zinc/13/99/91/1342139991.db2.gz	QMJHFJMMGCQMQT-CQSZACIVSA-N	0	3	338.373	3.323	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2cc(C)c(F)cc2Cl)C1	ZINC001034030728	1342169477	/nfs/dbraw/zinc/16/94/77/1342169477.db2.gz	YZQHWCYVXRWMEV-CQSZACIVSA-N	0	3	336.838	3.347	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc(OC(C)C)nc2)C1	ZINC001034230346	1342334984	/nfs/dbraw/zinc/33/49/84/1342334984.db2.gz	DBVBZMOPJHPRJK-QGZVFWFLSA-N	0	3	331.460	3.029	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc(OC)c(OC)c2C)C1	ZINC001034262779	1342354149	/nfs/dbraw/zinc/35/41/49/1342354149.db2.gz	QVEXMGDYTQYPOD-INIZCTEOSA-N	0	3	346.471	3.173	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cc(C)cc(OC)c2C)C1	ZINC001034293671	1342377252	/nfs/dbraw/zinc/37/72/52/1342377252.db2.gz	ZOBHHVYOSXOMBQ-QGZVFWFLSA-N	0	3	330.472	3.472	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc(C(F)(F)F)cn2)C1	ZINC001034334823	1342409616	/nfs/dbraw/zinc/40/96/16/1342409616.db2.gz	MZELRUJPVBHREA-AWEZNQCLSA-N	0	3	341.377	3.261	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cncc(OC(C)C)c2)C1	ZINC001034347057	1342417020	/nfs/dbraw/zinc/41/70/20/1342417020.db2.gz	VYEVJDDXRGTQBG-KRWDZBQOSA-N	0	3	331.460	3.029	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cnc(-c3ccccc3)[nH]2)C1	ZINC001034421864	1342483525	/nfs/dbraw/zinc/48/35/25/1342483525.db2.gz	QXUVSOMVDTYSDL-QGZVFWFLSA-N	0	3	338.455	3.237	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccoc2Br)C1	ZINC001034474838	1342529400	/nfs/dbraw/zinc/52/94/00/1342529400.db2.gz	SEOOQELHAHWRAC-GFCCVEGCSA-N	0	3	341.249	3.203	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccnc(O[C@H](C)CC)c2)C1	ZINC001034478759	1342534719	/nfs/dbraw/zinc/53/47/19/1342534719.db2.gz	OAFYILJTRBJQJP-AEFFLSMTSA-N	0	3	345.487	3.419	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cc3c(cccc3OC)[nH]2)C1	ZINC001034528176	1342584583	/nfs/dbraw/zinc/58/45/83/1342584583.db2.gz	PHFUPSYIDXCLTA-OAHLLOKOSA-N	0	3	341.455	3.337	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@@]2(C)CCc3ccccc32)C1	ZINC001034543879	1342605075	/nfs/dbraw/zinc/60/50/75/1342605075.db2.gz	BPZISZGSECFIIY-RXVVDRJESA-N	0	3	326.484	3.437	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)C(C)(C)c2ccccc2OC)C1	ZINC001034552092	1342614657	/nfs/dbraw/zinc/61/46/57/1342614657.db2.gz	XRYXYBXDBWNNKX-MRXNPFEDSA-N	0	3	330.472	3.130	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc(OC(C)C)cn2)C1	ZINC001034560093	1342619258	/nfs/dbraw/zinc/61/92/58/1342619258.db2.gz	UJNHQIVFAIGNAE-INIZCTEOSA-N	0	3	331.460	3.029	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1CC[C@H](NC(=O)[C@@H]2CC23CCC3)CC1	ZINC001034748320	1342736160	/nfs/dbraw/zinc/73/61/60/1342736160.db2.gz	ZQDCUVVFVNJBSO-FHWLQOOXSA-N	0	3	337.467	3.265	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC[C@@H]1CNCc1cc(Cl)ccc1Cl	ZINC001034887188	1342821675	/nfs/dbraw/zinc/82/16/75/1342821675.db2.gz	UDQYHKAPBWUXQQ-SMDDNHRTSA-N	0	3	340.254	3.234	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc(F)cc2F)C12CCC2	ZINC001078799364	1357090885	/nfs/dbraw/zinc/09/08/85/1357090885.db2.gz	ZYDQIZDRFHMCAC-LSDHHAIUSA-N	0	3	340.801	3.348	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]1CNCc1cn(C(C)C)nc1C	ZINC001035010939	1342875349	/nfs/dbraw/zinc/87/53/49/1342875349.db2.gz	NASWABCASPRAPR-GOSISDBHSA-N	0	3	346.519	3.455	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]2CNCc2cnc(Cl)s2)C1	ZINC001035041939	1342893545	/nfs/dbraw/zinc/89/35/45/1342893545.db2.gz	SYMHMGPSBAQOFH-GFCCVEGCSA-N	0	3	339.892	3.233	20	30		EGEDHN
C[C@@H](CC(=O)N1CCC[C@@H]1CNCc1ccc(C#N)s1)C1CC1	ZINC001035135913	1342951227	/nfs/dbraw/zinc/95/12/27/1342951227.db2.gz	PGTAPKJDHBEWNS-DZGCQCFKSA-N	0	3	331.485	3.137	20	30		EGEDHN
C[C@H](CC(=O)N1CCC[C@@H]1CNCc1ccc(C#N)s1)C1CC1	ZINC001035135914	1342951384	/nfs/dbraw/zinc/95/13/84/1342951384.db2.gz	PGTAPKJDHBEWNS-UKRRQHHQSA-N	0	3	331.485	3.137	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)N1CCC2(CCN(Cc3ccccc3C#N)C2)CC1	ZINC001035154760	1342969365	/nfs/dbraw/zinc/96/93/65/1342969365.db2.gz	YTCQNPMYBXGBTE-VQIMIIECSA-N	0	3	337.467	3.029	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC2(CCN(Cc3ccccc3C#N)C2)CC1	ZINC001035159261	1342975977	/nfs/dbraw/zinc/97/59/77/1342975977.db2.gz	CUJJTJORIGQNDS-KRWDZBQOSA-N	0	3	339.483	3.419	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccsc1COC)CC2	ZINC001035733920	1343159990	/nfs/dbraw/zinc/15/99/90/1343159990.db2.gz	KXJRIMRLFQKRNN-UHFFFAOYSA-N	0	3	334.485	3.009	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc(C)n([C@H](C)CC)n1)CC2	ZINC001035738458	1343162585	/nfs/dbraw/zinc/16/25/85/1343162585.db2.gz	BMKLEDBIGIITIN-MRXNPFEDSA-N	0	3	344.503	3.277	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccn(C(C)C)c1C)CC2	ZINC001035774951	1343185894	/nfs/dbraw/zinc/18/58/94/1343185894.db2.gz	VLIXWUUGOUZNDZ-UHFFFAOYSA-N	0	3	329.488	3.492	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ncsc1C1CC1)CC2	ZINC001035793397	1343202798	/nfs/dbraw/zinc/20/27/98/1343202798.db2.gz	UGCAPMKNZHBHSS-UHFFFAOYSA-N	0	3	331.485	3.135	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@@H]1C[C@H]1c1ccccc1C)CC2	ZINC001035816453	1343213645	/nfs/dbraw/zinc/21/36/45/1343213645.db2.gz	UUUPSHNBGPWITJ-VQTJNVASSA-N	0	3	336.479	3.046	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)COc1cc(C)ccc1C)CC2	ZINC001035849594	1343229223	/nfs/dbraw/zinc/22/92/23/1343229223.db2.gz	FTJODYLLCVLRKE-UHFFFAOYSA-N	0	3	342.483	3.183	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cncc3ccccc31)CC2	ZINC001035855887	1343232265	/nfs/dbraw/zinc/23/22/65/1343232265.db2.gz	BLXAEACNQQZWRZ-UHFFFAOYSA-N	0	3	335.451	3.349	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@H](C)c1cccc(OC)c1)CC2	ZINC001035858554	1343234628	/nfs/dbraw/zinc/23/46/28/1343234628.db2.gz	VHSFRJCZYNPZRE-QGZVFWFLSA-N	0	3	342.483	3.299	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccccc1CC(C)C)CC2	ZINC001035860385	1343236495	/nfs/dbraw/zinc/23/64/95/1343236495.db2.gz	LXGPZYUJHOIBKX-UHFFFAOYSA-N	0	3	338.495	3.446	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccc(-c3ccccc3)[nH]1)CC2	ZINC001035860218	1343236516	/nfs/dbraw/zinc/23/65/16/1343236516.db2.gz	UDPNSXZEOWABOZ-UHFFFAOYSA-N	0	3	347.462	3.243	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](NCc2cc(C3CC3)no2)[C@H](C)C1	ZINC001036137699	1343323294	/nfs/dbraw/zinc/32/32/94/1343323294.db2.gz	OTKSAJRHCOMDPQ-PBHICJAKSA-N	0	3	345.487	3.481	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](NCc2nc3ccccc3o2)[C@@H](C)C1	ZINC001036145256	1343327582	/nfs/dbraw/zinc/32/75/82/1343327582.db2.gz	XZOPMAHJBNICQV-LSDHHAIUSA-N	0	3	341.455	3.367	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](NCc3nc(C)sc3C)[C@H](C)C2)C1	ZINC001036171830	1343344090	/nfs/dbraw/zinc/34/40/90/1343344090.db2.gz	ZRDMFWNAQCYISP-CZUORRHYSA-N	0	3	347.528	3.443	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@@H]([C@H](C)NCc3cc(C)no3)C2)CC1	ZINC001036429120	1343481959	/nfs/dbraw/zinc/48/19/59/1343481959.db2.gz	FFYCZTKKPAHLRG-FUHWJXTLSA-N	0	3	345.487	3.446	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]([C@@H](C)NCc2cnc(C)o2)C1	ZINC001036440533	1343488960	/nfs/dbraw/zinc/48/89/60/1343488960.db2.gz	OBQSGKFHOMRHCT-GDBMZVCRSA-N	0	3	333.476	3.302	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]([C@@H](C)NCc3nc(C)oc3C)C2)C1	ZINC001036443533	1343491501	/nfs/dbraw/zinc/49/15/01/1343491501.db2.gz	HYPBOTKIENEXFR-RHSMWYFYSA-N	0	3	345.487	3.364	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC[C@H](C)[C@H]1CNCc1cc(C#N)ccc1F	ZINC001036533543	1343540836	/nfs/dbraw/zinc/54/08/36/1343540836.db2.gz	SVZMZOVLKDSEQY-GANJRWFKSA-N	0	3	343.446	3.380	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@@H]2CN(C(=O)CCC3CC3)CC[C@@H]21	ZINC001036670752	1343613678	/nfs/dbraw/zinc/61/36/78/1343613678.db2.gz	ZKZGJTQAKDHHFD-UXHICEINSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]3[C@@H](CCN3CC#Cc3ccccc3)C2)C1	ZINC001036815247	1343752562	/nfs/dbraw/zinc/75/25/62/1343752562.db2.gz	BGMCQBBQLCNBIO-LEWJYISDSA-N	0	3	348.490	3.317	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]3[C@H](CCN3Cc3conc3CC)C2)C1	ZINC001036816085	1343753978	/nfs/dbraw/zinc/75/39/78/1343753978.db2.gz	PSEIKKFJGVVMEJ-QAPCUYQASA-N	0	3	343.471	3.016	20	30		EGEDHN
CC1(C(=O)N[C@@H]2CCCC[C@H]2CNCc2cc(F)ccc2C#N)CC1	ZINC001037189780	1344029078	/nfs/dbraw/zinc/02/90/78/1344029078.db2.gz	FAICPIJEDGXJNN-MAUKXSAKSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCC[C@H]2CNCc2cnc(C)o2)C1	ZINC001037244537	1344064936	/nfs/dbraw/zinc/06/49/36/1344064936.db2.gz	ZPNVRFJKOLWFEO-DOTOQJQBSA-N	0	3	331.460	3.104	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](NCc3nocc3C)[C@H](CC)C2)C1	ZINC001037915772	1344176065	/nfs/dbraw/zinc/17/60/65/1344176065.db2.gz	RVAIQPGGIPIKMC-HZPDHXFCSA-N	0	3	331.460	3.056	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](NCc3cc(C)no3)[C@@H](CC)C2)C1	ZINC001037915775	1344176072	/nfs/dbraw/zinc/17/60/72/1344176072.db2.gz	RVHGXNNEJZAORH-DOTOQJQBSA-N	0	3	331.460	3.056	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3nocc3C)[C@@H](CC)C2)CC1	ZINC001037917143	1344177609	/nfs/dbraw/zinc/17/76/09/1344177609.db2.gz	ATZWDLMKSNFZIU-FUHWJXTLSA-N	0	3	345.487	3.446	20	30		EGEDHN
N#Cc1c[nH]c(C(=O)NC[C@@H]2CCN2CCC2CCCCCC2)c1	ZINC001038141895	1344296361	/nfs/dbraw/zinc/29/63/61/1344296361.db2.gz	YYCWXFCGMLFJHV-KRWDZBQOSA-N	0	3	328.460	3.051	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1ccc(F)c(Cl)c1F	ZINC001038660247	1344526258	/nfs/dbraw/zinc/52/62/58/1344526258.db2.gz	BEONYMMUMPFQRW-LLVKDONJSA-N	0	3	328.790	3.389	20	30		EGEDHN
C#CCOc1ccc(C(=O)NC[C@@H]2CCN2CCC2CCCC2)cc1	ZINC001038785372	1344583753	/nfs/dbraw/zinc/58/37/53/1344583753.db2.gz	ZVFSXGGTZHCNGB-IBGZPJMESA-N	0	3	340.467	3.083	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1cnn(CCC(C)C)c1C	ZINC001038898359	1344638771	/nfs/dbraw/zinc/63/87/71/1344638771.db2.gz	ZBXXPQLKRDTFGW-QGZVFWFLSA-N	0	3	332.492	3.008	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1c[nH]nc1C1CCCCC1	ZINC001038900706	1344640725	/nfs/dbraw/zinc/64/07/25/1344640725.db2.gz	IORIAUBDTOMTEX-INIZCTEOSA-N	0	3	330.476	3.228	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1cccc(C(F)(F)F)c1	ZINC001038961408	1344684227	/nfs/dbraw/zinc/68/42/27/1344684227.db2.gz	VSIHGUVOBQWEJR-HNNXBMFYSA-N	0	3	326.362	3.476	20	30		EGEDHN
CCC(=O)N1CCC([C@H]2CCN(Cc3cc(C#N)ccc3F)C2)CC1	ZINC001039105287	1344776690	/nfs/dbraw/zinc/77/66/90/1344776690.db2.gz	XPRPNYQGKZTOIA-KRWDZBQOSA-N	0	3	343.446	3.168	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)[C@H](C)n3cccc3)CC2)C1	ZINC001039125106	1344801616	/nfs/dbraw/zinc/80/16/16/1344801616.db2.gz	PELFCKLCAPYSRR-FUHWJXTLSA-N	0	3	349.906	3.362	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)C2C(C)(C)C2(C)C)C1	ZINC001039201538	1344911274	/nfs/dbraw/zinc/91/12/74/1344911274.db2.gz	ALTUQGZTPMINCK-IRXDYDNUSA-N	0	3	330.516	3.395	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2csc(C)c2C)C1	ZINC001039204309	1344915003	/nfs/dbraw/zinc/91/50/03/1344915003.db2.gz	ZIYXYZKKNAUXIG-AEFFLSMTSA-N	0	3	330.497	3.315	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)Cc2ccsc2)C1	ZINC001039206198	1344917338	/nfs/dbraw/zinc/91/73/38/1344917338.db2.gz	GMIOOIOQKGWSRF-ZWKOTPCHSA-N	0	3	330.497	3.017	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cccc3cccnc32)C1	ZINC001039217249	1344934343	/nfs/dbraw/zinc/93/43/43/1344934343.db2.gz	GOHZKFNXWVVPDC-QUCCMNQESA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)CCc2ccc(C)cc2)C1	ZINC001039218421	1344936101	/nfs/dbraw/zinc/93/61/01/1344936101.db2.gz	LQTXDUPOPSRHSV-SFTDATJTSA-N	0	3	338.495	3.264	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)Cc2cc(C)ccc2C)C1	ZINC001039228956	1344948841	/nfs/dbraw/zinc/94/88/41/1344948841.db2.gz	KKBMNJLDDCGZTE-PZJWPPBQSA-N	0	3	338.495	3.182	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2csc(Cl)c2)C1	ZINC001039229482	1344949263	/nfs/dbraw/zinc/94/92/63/1344949263.db2.gz	DTISLQWEUTZKQB-HIFRSBDPSA-N	0	3	336.888	3.351	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(C(C)C)cn2)C1	ZINC001039235350	1344956313	/nfs/dbraw/zinc/95/63/13/1344956313.db2.gz	WRTPEKVNAYOCEQ-UYAOXDASSA-N	0	3	339.483	3.155	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2oc(C(C)C)nc2C)C1	ZINC001039236212	1344957913	/nfs/dbraw/zinc/95/79/13/1344957913.db2.gz	XNGMMMBTSJQJFZ-DLBZAZTESA-N	0	3	343.471	3.056	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)Cc2ccccc2F)C1	ZINC001039241332	1344966269	/nfs/dbraw/zinc/96/62/69/1344966269.db2.gz	ZMWIIUQAGPZWSI-QUCCMNQESA-N	0	3	342.458	3.095	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc[nH]c2C(C)C)C1	ZINC001039242141	1344968044	/nfs/dbraw/zinc/96/80/44/1344968044.db2.gz	ANCDADNFMCGGDJ-SJLPKXTDSA-N	0	3	327.472	3.088	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)Cc2cc(C)ccc2F)C1	ZINC001039256057	1344986244	/nfs/dbraw/zinc/98/62/44/1344986244.db2.gz	HPGHGHWHMVKKNQ-XLIONFOSSA-N	0	3	342.458	3.013	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ncoc1-c1ccccc1	ZINC001039382175	1345037088	/nfs/dbraw/zinc/03/70/88/1345037088.db2.gz	DVLDWRHWICPRCH-MSOLQXFVSA-N	0	3	349.434	3.044	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1coc2c1cccc2C	ZINC001039385666	1345038389	/nfs/dbraw/zinc/03/83/89/1345038389.db2.gz	GNXSMKVDEYYFQH-SJORKVTESA-N	0	3	336.435	3.443	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2[nH]nc(C)c2c1	ZINC001039404181	1345050161	/nfs/dbraw/zinc/05/01/61/1345050161.db2.gz	LFJTUCOBKCHLNY-SJORKVTESA-N	0	3	338.455	3.126	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)Cc1ccccc1F	ZINC001039434171	1345066101	/nfs/dbraw/zinc/06/61/01/1345066101.db2.gz	BVUKWSKBYYOQHK-QRQLOZEOSA-N	0	3	342.458	3.093	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CCCC(F)(F)C1	ZINC001039434417	1345066360	/nfs/dbraw/zinc/06/63/60/1345066360.db2.gz	GCJIBXBUUVLWJF-OAGGEKHMSA-N	0	3	326.431	3.453	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccc(C)c1Cl	ZINC001039453988	1345076549	/nfs/dbraw/zinc/07/65/49/1345076549.db2.gz	CRECARFWRYIWLC-CVEARBPZSA-N	0	3	330.859	3.351	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)Oc1ccccc1	ZINC001039466389	1345084435	/nfs/dbraw/zinc/08/44/35/1345084435.db2.gz	HTYARMOZIRRQPV-KSZLIROESA-N	0	3	328.456	3.095	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)CCn1ccc2ccccc21	ZINC001039468006	1345085785	/nfs/dbraw/zinc/08/57/85/1345085785.db2.gz	OXBOXMWGJBZANT-MOPGFXCFSA-N	0	3	337.467	3.283	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(C)c(F)c(C)c1	ZINC001039472978	1345087928	/nfs/dbraw/zinc/08/79/28/1345087928.db2.gz	OTBZSRGLGRGMQE-MSOLQXFVSA-N	0	3	328.431	3.145	20	30		EGEDHN
N#Cc1c[nH]c(C(=O)N2C[C@H]3CCC[C@@H](C2)N3CCCC2CCC2)c1	ZINC001039539891	1345135080	/nfs/dbraw/zinc/13/50/80/1345135080.db2.gz	KHHLBHRVXNSXNP-HDICACEKSA-N	0	3	340.471	3.146	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC1CC(OCC)C1	ZINC001039823301	1345200198	/nfs/dbraw/zinc/20/01/98/1345200198.db2.gz	PGYPHPBQZWICEX-FXSDRFNOSA-N	0	3	348.531	3.469	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1C[C@H]2CCC[C@@H](C1)N2CCC(C)C	ZINC001039983854	1345279722	/nfs/dbraw/zinc/27/97/22/1345279722.db2.gz	OLRJAWBXDWCEQJ-OYRHEFFESA-N	0	3	338.495	3.322	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3ccoc3C(F)(F)F)C2)C1	ZINC001040223833	1345383040	/nfs/dbraw/zinc/38/30/40/1345383040.db2.gz	AEHPEECACVBVDH-MRXNPFEDSA-N	0	3	342.361	3.413	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3ccc(C(F)F)nc3)C2)C1	ZINC001040230592	1345385964	/nfs/dbraw/zinc/38/59/64/1345385964.db2.gz	DTSUFOIBEFGYAL-SFHVURJKSA-N	0	3	335.398	3.133	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3c(Cl)n[nH]c3C3CC3)C2)C1	ZINC001040235978	1345389156	/nfs/dbraw/zinc/38/91/56/1345389156.db2.gz	IVFCOCITJFULJX-GOSISDBHSA-N	0	3	348.878	3.055	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)Cc3cccc(CC)c3)C2)C1	ZINC001040268589	1345404699	/nfs/dbraw/zinc/40/46/99/1345404699.db2.gz	YZWWDZWFBQJETP-QFIPXVFZSA-N	0	3	338.495	3.129	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3cccc(-n4cccc4)c3)C2)C1	ZINC001040281903	1345409376	/nfs/dbraw/zinc/40/93/76/1345409376.db2.gz	GCJGJMKDUCMRJE-JOCHJYFZSA-N	0	3	347.462	3.039	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ccnc4ccccc43)C2)C1	ZINC001040284819	1345412258	/nfs/dbraw/zinc/41/22/58/1345412258.db2.gz	XXLGHJRVEXYADW-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3cc(C)cc(Cl)c3)C2)C1	ZINC001040293014	1345416716	/nfs/dbraw/zinc/41/67/16/1345416716.db2.gz	OTWSFNWLKXEYAZ-LJQANCHMSA-N	0	3	330.859	3.210	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cccc4c3O[C@@H](C)C4)C2)C1	ZINC001040301441	1345421975	/nfs/dbraw/zinc/42/19/75/1345421975.db2.gz	YJANBRIZANRKGZ-KKSFZXQISA-N	0	3	340.467	3.124	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@H]3CCCCC3(F)F)C2)C1	ZINC001040313966	1345425809	/nfs/dbraw/zinc/42/58/09/1345425809.db2.gz	PXHQMJKENLCVCL-AEFFLSMTSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cc(F)ccc3C)C2)C1	ZINC001040319239	1345429084	/nfs/dbraw/zinc/42/90/84/1345429084.db2.gz	DIMSXHCTJKWFOP-FQEVSTJZSA-N	0	3	328.431	3.086	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cc4cc(C)ccc4[nH]3)C2)C1	ZINC001040322216	1345430639	/nfs/dbraw/zinc/43/06/39/1345430639.db2.gz	IBRUSSZDDOJVLG-JOCHJYFZSA-N	0	3	349.478	3.428	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@]2(C1)CCCN(Cc1cccnc1)C2	ZINC001040323739	1345432436	/nfs/dbraw/zinc/43/24/36/1345432436.db2.gz	SUFFFUWAQPXGDA-OAQYLSRUSA-N	0	3	341.499	3.498	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@]2(C1)CCCN(Cc1ncccc1C)C2	ZINC001040329708	1345434998	/nfs/dbraw/zinc/43/49/98/1345434998.db2.gz	XABHQGAOMRNVOE-OAQYLSRUSA-N	0	3	341.499	3.417	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@H]3[C@@H]4CCCCCC[C@@H]43)C2)C1	ZINC001040418172	1345486652	/nfs/dbraw/zinc/48/66/52/1345486652.db2.gz	MJJINWXHTNAFJC-XODKDNOYSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@@H](C)c3ccccc3F)C2)C1	ZINC001040457553	1345509337	/nfs/dbraw/zinc/50/93/37/1345509337.db2.gz	XGDUVXLEASOKSD-UWJYYQICSA-N	0	3	342.458	3.267	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3coc(C4CCC4)n3)C2)C1	ZINC001040485176	1345516214	/nfs/dbraw/zinc/51/62/14/1345516214.db2.gz	XLBVDPNZNLTTAG-IBGZPJMESA-N	0	3	329.444	3.056	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3[nH]ccc3-c3ccccc3)C2)C1	ZINC001040490558	1345516530	/nfs/dbraw/zinc/51/65/30/1345516530.db2.gz	BTXVMGHTIQUGCG-JOCHJYFZSA-N	0	3	347.462	3.243	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@H](F)CC3CCCCC3)C2)C1	ZINC001040494241	1345519374	/nfs/dbraw/zinc/51/93/74/1345519374.db2.gz	UZCFDPVIDKLVBX-QUCCMNQESA-N	0	3	334.479	3.243	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3cc(C)n(C(C)C)c3C)C2)C1	ZINC001040522089	1345531620	/nfs/dbraw/zinc/53/16/20/1345531620.db2.gz	IKMIRMMKGBPPRO-NRFANRHFSA-N	0	3	341.499	3.247	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)CCc3ccccc3Cl)C2)C1	ZINC001040521587	1345531737	/nfs/dbraw/zinc/53/17/37/1345531737.db2.gz	AQETZRDVOZRZKL-HXUWFJFHSA-N	0	3	344.886	3.220	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3cc(C)c(F)c(C)c3)C2)C1	ZINC001040535195	1345535700	/nfs/dbraw/zinc/53/57/00/1345535700.db2.gz	PJZGGMGNEPWIMH-FQEVSTJZSA-N	0	3	328.431	3.004	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cc4ccc(C)cc4[nH]3)C2)CC1	ZINC001040792233	1345578397	/nfs/dbraw/zinc/57/83/97/1345578397.db2.gz	ZZDVPMRXFLAFNC-UHFFFAOYSA-N	0	3	335.451	3.038	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cc4ccccc4n3C)C2)CC1	ZINC001040819817	1345582585	/nfs/dbraw/zinc/58/25/85/1345582585.db2.gz	JVZZITPESJTSCC-UHFFFAOYSA-N	0	3	349.478	3.130	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccc(C)c(Cl)c3)C2)CC1	ZINC001040828348	1345583897	/nfs/dbraw/zinc/58/38/97/1345583897.db2.gz	JVFKMXATROIOMZ-UHFFFAOYSA-N	0	3	330.859	3.210	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)C[C@@H](C)c3cccc(F)c3)C2)CC1	ZINC001040841912	1345587146	/nfs/dbraw/zinc/58/71/46/1345587146.db2.gz	OLAXQJDVLCGSOR-QGZVFWFLSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cc(F)ccc3Cl)C2)CC1	ZINC001040861053	1345589181	/nfs/dbraw/zinc/58/91/81/1345589181.db2.gz	DPGKTJRDVSFWLK-UHFFFAOYSA-N	0	3	334.822	3.040	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@@H](C)c3ccc(CC)cc3)C2)CC1	ZINC001040882392	1345593770	/nfs/dbraw/zinc/59/37/70/1345593770.db2.gz	AZGCQZAWIWOKEM-SFHVURJKSA-N	0	3	338.495	3.300	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@@H]3C[C@@H]3C3CCCC3)C2)CC1	ZINC001040900176	1345595796	/nfs/dbraw/zinc/59/57/96/1345595796.db2.gz	SIEMYKKAKMCFJR-RTBURBONSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC[C@H](C)C(=O)N1CC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001041088941	1345650390	/nfs/dbraw/zinc/65/03/90/1345650390.db2.gz	SOXUONNPANTXOW-JXFKEZNVSA-N	0	3	325.456	3.029	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3cc4ccc(F)cc4s3)C2)C1	ZINC001041441675	1345727773	/nfs/dbraw/zinc/72/77/73/1345727773.db2.gz	CXBJRVUGYIHHPQ-LJQANCHMSA-N	0	3	342.439	3.212	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3ccc4c5c(cccc53)CC4)C2)C1	ZINC001041459408	1345734079	/nfs/dbraw/zinc/73/40/79/1345734079.db2.gz	YTGDMLQOVXFGOP-HSZRJFAPSA-N	0	3	344.458	3.110	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3cc4cscc4s3)C2)C1	ZINC001041483737	1345741767	/nfs/dbraw/zinc/74/17/67/1345741767.db2.gz	SYLRREBOFBHIPT-QGZVFWFLSA-N	0	3	330.478	3.134	20	30		EGEDHN
CC1(CC(=O)N2CC[C@@]3(CCN(Cc4ccc(C#N)cc4)C3)C2)CC1	ZINC001041488970	1345743715	/nfs/dbraw/zinc/74/37/15/1345743715.db2.gz	ZWBRIVAQQAYNCT-OAQYLSRUSA-N	0	3	337.467	3.173	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3c(C)cc(F)cc3C)C2)C1	ZINC001041532397	1345754631	/nfs/dbraw/zinc/75/46/31/1345754631.db2.gz	QXIOFOLSYXOFOB-FQEVSTJZSA-N	0	3	328.431	3.004	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)C3[C@@H]4CCCCCC[C@@H]34)C2)C1	ZINC001041708373	1345825265	/nfs/dbraw/zinc/82/52/65/1345825265.db2.gz	HQCNXCDZCVACHX-OPYAIIAOSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001041719306	1345830013	/nfs/dbraw/zinc/83/00/13/1345830013.db2.gz	AMLXCABWPCOMDM-LAUBAEHRSA-N	0	3	339.483	3.275	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3scnc3C(C)(C)C)C2)C1	ZINC001041729417	1345834119	/nfs/dbraw/zinc/83/41/19/1345834119.db2.gz	STYUHEIVENYYFP-LJQANCHMSA-N	0	3	345.512	3.002	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccc4sccc4c3)C2)C1	ZINC001041766893	1345843063	/nfs/dbraw/zinc/84/30/63/1345843063.db2.gz	CNCXETGYVBQZPX-HXUWFJFHSA-N	0	3	338.476	3.463	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)[C@H](C)c3cc4ccccc4o3)C2)C1	ZINC001041780628	1345847083	/nfs/dbraw/zinc/84/70/83/1345847083.db2.gz	CGZQJTKTPOQTNJ-IERDGZPVSA-N	0	3	336.435	3.094	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)[C@H](C)c3cc4ccccc4o3)C2)C1	ZINC001041780629	1345847315	/nfs/dbraw/zinc/84/73/15/1345847315.db2.gz	CGZQJTKTPOQTNJ-IIBYNOLFSA-N	0	3	336.435	3.094	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3c(F)cccc3Cl)C2)C1	ZINC001041798033	1345854158	/nfs/dbraw/zinc/85/41/58/1345854158.db2.gz	VTLSLWZPLBVNDD-GOSISDBHSA-N	0	3	334.822	3.040	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)C[C@@H]3CCCc4ccccc43)C2)C1	ZINC001041798519	1345854487	/nfs/dbraw/zinc/85/44/87/1345854487.db2.gz	YHHSMFCLECSMPX-SIKLNZKXSA-N	0	3	336.479	3.054	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3c(C)csc3Cl)C2)C1	ZINC001041805743	1345857501	/nfs/dbraw/zinc/85/75/01/1345857501.db2.gz	PCVLUXQJYPKXNT-KRWDZBQOSA-N	0	3	336.888	3.271	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccsc3C(F)F)C2)C1	ZINC001041809056	1345857853	/nfs/dbraw/zinc/85/78/53/1345857853.db2.gz	FHEJCKKFXXTVKW-QGZVFWFLSA-N	0	3	338.423	3.247	20	30		EGEDHN
C=CCN1CC[C@@]2(CCN(C(=O)c3sc(Cl)nc3Cl)C2)C1	ZINC001041833675	1345866914	/nfs/dbraw/zinc/86/69/14/1345866914.db2.gz	SOLYVBQNWHDSFI-CQSZACIVSA-N	0	3	346.283	3.174	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3CCN(C(=O)CCC4CC4)C[C@@H]32)c1	ZINC001041984971	1345914038	/nfs/dbraw/zinc/91/40/38/1345914038.db2.gz	LNUVEAXRHPMICN-PMACEKPBSA-N	0	3	337.467	3.171	20	30		EGEDHN
CC(C(=O)N1CC[C@H]2CCN(Cc3ccc(C#N)cc3)[C@@H]2C1)=C1CCC1	ZINC001042054756	1345932364	/nfs/dbraw/zinc/93/23/64/1345932364.db2.gz	LXQOVRRBUONLOE-NHCUHLMSSA-N	0	3	349.478	3.481	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(C(F)F)ccc3F)C[C@H]21	ZINC001042065543	1345934691	/nfs/dbraw/zinc/93/46/91/1345934691.db2.gz	VXGSCIHDLYLSLW-MLGOLLRUSA-N	0	3	338.373	3.486	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3c(F)ccc4ccncc43)C[C@H]21	ZINC001042067605	1345935050	/nfs/dbraw/zinc/93/50/50/1345935050.db2.gz	RDNBVHZPOUUJDE-MAUKXSAKSA-N	0	3	339.414	3.096	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)COc3cccc(C(C)C)c3)C[C@@H]21	ZINC001042074857	1345938256	/nfs/dbraw/zinc/93/82/56/1345938256.db2.gz	ZKJDWFQFCUSRNN-XLIONFOSSA-N	0	3	342.483	3.298	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cccc4c3CCCC4)C[C@H]21	ZINC001042077616	1345939049	/nfs/dbraw/zinc/93/90/49/1345939049.db2.gz	MLIDANYDPPDACD-WIYYLYMNSA-N	0	3	336.479	3.125	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cccc4ccc(C)nc43)C[C@H]21	ZINC001042111663	1345947198	/nfs/dbraw/zinc/94/71/98/1345947198.db2.gz	MJLXYSYVTZUWSR-FXAWDEMLSA-N	0	3	347.462	3.103	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)CCc3ccc4[nH]ccc4c3)C[C@@H]21	ZINC001042152027	1345957410	/nfs/dbraw/zinc/95/74/10/1345957410.db2.gz	DBBFWGDEZZZHAO-RXVVDRJESA-N	0	3	349.478	3.047	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cc4c(cc(C)cc4C)[nH]3)C[C@H]21	ZINC001042168259	1345963851	/nfs/dbraw/zinc/96/38/51/1345963851.db2.gz	UKHRSSKCTZMKTF-DYESRHJHSA-N	0	3	349.478	3.344	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cc4cc(C)ccc4[nH]3)C[C@@H]21	ZINC001042183984	1345971710	/nfs/dbraw/zinc/97/17/10/1345971710.db2.gz	SDFCZLYXTYGEOX-JXFKEZNVSA-N	0	3	335.451	3.036	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cc4c(ccc(C)c4C)[nH]3)C[C@@H]21	ZINC001042188722	1345975570	/nfs/dbraw/zinc/97/55/70/1345975570.db2.gz	WKTIMIDXHSKAOF-UWJYYQICSA-N	0	3	349.478	3.344	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3cc(F)c(F)cc3F)C[C@H]21	ZINC001042207565	1345985757	/nfs/dbraw/zinc/98/57/57/1345985757.db2.gz	RNJIZQFKOQHFEA-YVEFUNNKSA-N	0	3	338.373	3.216	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3c(F)ccc(C)c3F)C[C@H]21	ZINC001042219765	1345991442	/nfs/dbraw/zinc/99/14/42/1345991442.db2.gz	ZLRKTLBPOKRISR-GDBMZVCRSA-N	0	3	334.410	3.386	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CCN(C(=O)C4CC5(CC5)C4)C[C@H]32)cc1	ZINC001042232068	1345997840	/nfs/dbraw/zinc/99/78/40/1345997840.db2.gz	IQYIMNZVCUVOSW-UYAOXDASSA-N	0	3	349.478	3.171	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)CC(C3CCC3)C3CCC3)C[C@@H]21	ZINC001042237065	1345999350	/nfs/dbraw/zinc/99/93/50/1345999350.db2.gz	FQFSNBQGDJVTOF-QUCCMNQESA-N	0	3	328.500	3.149	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(C)oc3C(F)(F)F)C[C@@H]21	ZINC001042249742	1346005856	/nfs/dbraw/zinc/00/58/56/1346005856.db2.gz	PLTLEMCWXCKCEM-OCCSQVGLSA-N	0	3	342.361	3.329	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(C)oc3C(F)(F)F)C[C@@H]21	ZINC001042249741	1346006067	/nfs/dbraw/zinc/00/60/67/1346006067.db2.gz	PLTLEMCWXCKCEM-JSGCOSHPSA-N	0	3	342.361	3.329	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3cc4cc(F)ccc4o3)C[C@H]21	ZINC001042251927	1346006697	/nfs/dbraw/zinc/00/66/97/1346006697.db2.gz	GPLSDUOHCZXJEJ-WMLDXEAASA-N	0	3	340.398	3.132	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3sc(C)cc3OC)C[C@@H]21	ZINC001042260214	1346009144	/nfs/dbraw/zinc/00/91/44/1346009144.db2.gz	UJEDALCJOUCVAV-CABCVRRESA-N	0	3	334.485	3.178	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3csc(C(C)(C)C)n3)C[C@H]21	ZINC001042267335	1346012700	/nfs/dbraw/zinc/01/27/00/1346012700.db2.gz	SZMLBGOUIYUZKE-UKRRQHHQSA-N	0	3	333.501	3.163	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cc(Cl)ccc3C)C[C@H]21	ZINC001042275152	1346014949	/nfs/dbraw/zinc/01/49/49/1346014949.db2.gz	RHAWJGVUVYTNHI-MAUKXSAKSA-N	0	3	330.859	3.208	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C34CC5CC(CC(C5)C3)C4)C[C@H]21	ZINC001042325597	1346034552	/nfs/dbraw/zinc/03/45/52/1346034552.db2.gz	DQDBEJYYPSJWBE-MXDZQPNWSA-N	0	3	328.500	3.312	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3sccc3C3CC3)C[C@H]21	ZINC001042344145	1346047555	/nfs/dbraw/zinc/04/75/55/1346047555.db2.gz	TZVNMWIIXMOYSZ-DOTOQJQBSA-N	0	3	328.481	3.185	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3cc(CC)c(C)s3)C[C@H]21	ZINC001042346160	1346048302	/nfs/dbraw/zinc/04/83/02/1346048302.db2.gz	PBVQCIQBAYQGSF-DLBZAZTESA-N	0	3	330.497	3.179	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(C)n(C(C)C)c3C)C[C@H]21	ZINC001042346593	1346048699	/nfs/dbraw/zinc/04/86/99/1346048699.db2.gz	UZWTZPUPWRKIEY-PKOBYXMFSA-N	0	3	329.488	3.408	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(COC(C)C)cc3)C[C@@H]21	ZINC001042347934	1346049171	/nfs/dbraw/zinc/04/91/71/1346049171.db2.gz	FLCWWTXRCCQXDE-QUCCMNQESA-N	0	3	342.483	3.334	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(F)c4occc43)C[C@@H]21	ZINC001042363751	1346057487	/nfs/dbraw/zinc/05/74/87/1346057487.db2.gz	XMVVTORZNZRAOB-DYVFJYSZSA-N	0	3	328.387	3.294	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3csc(CC(C)C)n3)C[C@@H]21	ZINC001042372746	1346062310	/nfs/dbraw/zinc/06/23/10/1346062310.db2.gz	ATXWDNNHINEYNO-ZBFHGGJFSA-N	0	3	333.501	3.064	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C3(C(F)(F)F)CCCC3)C[C@@H]21	ZINC001042379279	1346064718	/nfs/dbraw/zinc/06/47/18/1346064718.db2.gz	JFOQBUGIHGRRTE-KBPBESRZSA-N	0	3	330.394	3.218	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)C(C)(C)c3ccccc3C)C[C@@H]21	ZINC001042382292	1346066079	/nfs/dbraw/zinc/06/60/79/1346066079.db2.gz	GJCKTPDYQWAABN-ICSRJNTNSA-N	0	3	338.495	3.219	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)CC1CCC1	ZINC001044533946	1346360451	/nfs/dbraw/zinc/36/04/51/1346360451.db2.gz	YBHLNAPECHOFKI-DNVCBOLYSA-N	0	3	325.456	3.218	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@@H](NCc2cc(F)ccc2C#N)C[C@@H]1C	ZINC001044541657	1346364531	/nfs/dbraw/zinc/36/45/31/1346364531.db2.gz	DLWLAEWRESPVCM-SUMWQHHRSA-N	0	3	347.409	3.430	20	30		EGEDHN
C[C@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)CC(C)(F)F	ZINC001044732641	1346415758	/nfs/dbraw/zinc/41/57/58/1346415758.db2.gz	DSVIOCWBCGGSAC-BBRMVZONSA-N	0	3	335.398	3.073	20	30		EGEDHN
CC1(C)C(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)s2)C1(C)C	ZINC001044977471	1346472658	/nfs/dbraw/zinc/47/26/58/1346472658.db2.gz	MYOPYWODWGNKAH-ZDUSSCGKSA-N	0	3	345.512	3.383	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC[C@H]1CNCc1cncc(F)c1	ZINC001045053965	1346487418	/nfs/dbraw/zinc/48/74/18/1346487418.db2.gz	QHNYSMBMPSSQAA-HNNXBMFYSA-N	0	3	339.842	3.080	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H]1CNCc1ccc(C#N)s1)C1CCC1	ZINC001045087420	1346491878	/nfs/dbraw/zinc/49/18/78/1346491878.db2.gz	GFLGONFSUMMOJR-HIFRSBDPSA-N	0	3	331.485	3.137	20	30		EGEDHN
CC1(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)c(F)c2)CCCC1	ZINC001045139712	1346502396	/nfs/dbraw/zinc/50/23/96/1346502396.db2.gz	GGJOJJGOWFNCCU-KRWDZBQOSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)s2)C1	ZINC001045191241	1346525203	/nfs/dbraw/zinc/52/52/03/1346525203.db2.gz	SQDGCELSWNHLEU-AWEZNQCLSA-N	0	3	329.469	3.057	20	30		EGEDHN
CC1(NC(=O)c2ccc(C#N)[nH]2)CCN(C/C=C\c2ccccc2)CC1	ZINC001045410255	1346587062	/nfs/dbraw/zinc/58/70/62/1346587062.db2.gz	LRSPPDRMYVFALQ-YVMONPNESA-N	0	3	348.450	3.184	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)[C@@H]2C[C@H]2c2c(F)cccc2F)CC1	ZINC001045548599	1346626966	/nfs/dbraw/zinc/62/69/66/1346626966.db2.gz	KSTJUUCZJBFLLV-HUUCEWRRSA-N	0	3	346.421	3.062	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2ncoc2-c2cccs2)CC1	ZINC001045590872	1346639332	/nfs/dbraw/zinc/63/93/32/1346639332.db2.gz	YTSRZDMWHFQTBE-UHFFFAOYSA-N	0	3	331.441	3.173	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@]3(C2)CCCCN(C(=O)C2CC2)C3)s1	ZINC001045905744	1346741791	/nfs/dbraw/zinc/74/17/91/1346741791.db2.gz	KYLRJUOGTKLPGN-IBGZPJMESA-N	0	3	343.496	3.234	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cscc1C)C2	ZINC001045926797	1346763000	/nfs/dbraw/zinc/76/30/00/1346763000.db2.gz	KLDLTCQIWYMHNJ-LJQANCHMSA-N	0	3	330.497	3.398	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccoc1Cl)C2	ZINC001045932557	1346770534	/nfs/dbraw/zinc/77/05/34/1346770534.db2.gz	LHLQIZBYOJDOSH-GOSISDBHSA-N	0	3	334.847	3.275	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1sccc1Cl)C2	ZINC001045940315	1346776631	/nfs/dbraw/zinc/77/66/31/1346776631.db2.gz	VZJMSSHZQBLCKF-QGZVFWFLSA-N	0	3	336.888	3.353	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1scnc1CC)C2	ZINC001045945128	1346780701	/nfs/dbraw/zinc/78/07/01/1346780701.db2.gz	UKTGMEKYALYHCY-IBGZPJMESA-N	0	3	345.512	3.047	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccnc3ccccc31)C2	ZINC001045951279	1346786363	/nfs/dbraw/zinc/78/63/63/1346786363.db2.gz	WDCFVBTZJSXWRX-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@@]2(CCN(Cc3ccccn3)C2)C1	ZINC001045956657	1346791327	/nfs/dbraw/zinc/79/13/27/1346791327.db2.gz	RUZZJSCYZFWNEI-NRFANRHFSA-N	0	3	341.499	3.498	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc(F)ccc1C)C2	ZINC001045957970	1346792577	/nfs/dbraw/zinc/79/25/77/1346792577.db2.gz	IIRSXUAERQCAJU-HXUWFJFHSA-N	0	3	328.431	3.086	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cccc3ncccc31)C2	ZINC001045958649	1346793672	/nfs/dbraw/zinc/79/36/72/1346793672.db2.gz	VEVQYSUYHOFWQF-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@H]1Cc3ccccc31)C2	ZINC001045962913	1346798153	/nfs/dbraw/zinc/79/81/53/1346798153.db2.gz	SCXVHERTMPDEEE-RBBKRZOGSA-N	0	3	336.479	3.054	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H]1C[C@H]1c1ccco1)C2	ZINC001045970385	1346805666	/nfs/dbraw/zinc/80/56/66/1346805666.db2.gz	GPNUKRWQVYUXQX-DBXWQHBBSA-N	0	3	340.467	3.111	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc(Cl)cs1)C2	ZINC001045971023	1346807116	/nfs/dbraw/zinc/80/71/16/1346807116.db2.gz	LFKAVGNKWYHPJJ-QGZVFWFLSA-N	0	3	336.888	3.353	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1scnc1C(C)C)C2	ZINC001045973504	1346809157	/nfs/dbraw/zinc/80/91/57/1346809157.db2.gz	RZBXEQMWLAKDDI-LJQANCHMSA-N	0	3	345.512	3.218	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc(F)cc(F)c1)C2	ZINC001045981396	1346819708	/nfs/dbraw/zinc/81/97/08/1346819708.db2.gz	CJQZVTKEHHLQBM-HXUWFJFHSA-N	0	3	346.421	3.306	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)C[C@@H](C)n1cccc1)C2	ZINC001045981623	1346820503	/nfs/dbraw/zinc/82/05/03/1346820503.db2.gz	WBEYMYOSZDMQAK-CTNGQTDRSA-N	0	3	341.499	3.167	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1nc(C)c(C)s1)C2	ZINC001045982562	1346821844	/nfs/dbraw/zinc/82/18/44/1346821844.db2.gz	CTYJMVBUBWTYJS-LJQANCHMSA-N	0	3	345.512	3.101	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)CCc1ccccc1F)C2	ZINC001045983390	1346823256	/nfs/dbraw/zinc/82/32/56/1346823256.db2.gz	LYXWZEPTDGFPPE-OAQYLSRUSA-N	0	3	342.458	3.096	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N[C@]1(C)CCN(Cc2cc(C)sc2C)C1	ZINC001046635007	1347043272	/nfs/dbraw/zinc/04/32/72/1347043272.db2.gz	OFGYXWKJFMHRNM-ZIFCJYIRSA-N	0	3	348.512	3.037	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2cc(F)cc3cccnc32)C1	ZINC001046669838	1347056972	/nfs/dbraw/zinc/05/69/72/1347056972.db2.gz	XMYQCBSMRUFICA-LJQANCHMSA-N	0	3	327.403	3.144	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@@H](CNC(=O)[C@H]2CCC(C)=C(C)C2)C1	ZINC001046941720	1347158400	/nfs/dbraw/zinc/15/84/00/1347158400.db2.gz	PLAFWLFTMQSEPL-IRXDYDNUSA-N	0	3	338.442	3.220	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2ccn3ccccc23)C1	ZINC001046955334	1347163308	/nfs/dbraw/zinc/16/33/08/1347163308.db2.gz	AHRWTJBHEYKWBH-HNNXBMFYSA-N	0	3	347.409	3.202	20	30		EGEDHN
O=C(N[C@@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1ccccc1)C2)c1ccccc1	ZINC001047016464	1347188066	/nfs/dbraw/zinc/18/80/66/1347188066.db2.gz	WCUCHJZRHMYFEN-NNWRFLSQSA-N	0	3	344.458	3.321	20	30		EGEDHN
O=C(N[C@@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1ccccc1)C2)C1CC2(CC2)C1	ZINC001047141912	1347218524	/nfs/dbraw/zinc/21/85/24/1347218524.db2.gz	AGGSPRDFBOEFIH-TYPHKJRUSA-N	0	3	348.490	3.197	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3cccc(F)c3)C2)CC1	ZINC001047220581	1347252848	/nfs/dbraw/zinc/25/28/48/1347252848.db2.gz	BXLVTBPUEDHOAG-SFHVURJKSA-N	0	3	328.431	3.023	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)CC3=CCCCC3)C2)CC1	ZINC001047230319	1347259577	/nfs/dbraw/zinc/25/95/77/1347259577.db2.gz	YOWZSKMJYMSJAC-HXUWFJFHSA-N	0	3	328.500	3.461	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)c3oc(C)cc3C)C2)CC1	ZINC001047232096	1347261142	/nfs/dbraw/zinc/26/11/42/1347261142.db2.gz	JDGHWZRMPPYNSJ-IBGZPJMESA-N	0	3	342.483	3.484	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)c3sccc3F)C2)CC1	ZINC001047236122	1347263911	/nfs/dbraw/zinc/26/39/11/1347263911.db2.gz	FZXCNRWZTZYCRQ-MRXNPFEDSA-N	0	3	348.487	3.475	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3[nH]ccc3C3CC3)C2)CC1	ZINC001047242551	1347268864	/nfs/dbraw/zinc/26/88/64/1347268864.db2.gz	VAZJHPLGWRAUAM-SFHVURJKSA-N	0	3	339.483	3.090	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)Cc3ccccc3)C2)CC1	ZINC001047246291	1347271193	/nfs/dbraw/zinc/27/11/93/1347271193.db2.gz	KJNYMBXDEKZVER-OAQYLSRUSA-N	0	3	338.495	3.203	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)C(C)(C)C3CCC3)C2)CC1	ZINC001047246906	1347272186	/nfs/dbraw/zinc/27/21/86/1347272186.db2.gz	BEOJZTAQXIJFNT-GOSISDBHSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)Cc3ccc(C)cc3)C2)CC1	ZINC001047250238	1347274659	/nfs/dbraw/zinc/27/46/59/1347274659.db2.gz	FVPNMJZWKSTSSM-OAQYLSRUSA-N	0	3	338.495	3.121	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)CC3CC(C)(C)C3)C2)CC1	ZINC001047250028	1347274861	/nfs/dbraw/zinc/27/48/61/1347274861.db2.gz	ZMMROCCTUWWPFW-LJQANCHMSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3ccc(C)c(F)c3)C2)CC1	ZINC001047251136	1347275878	/nfs/dbraw/zinc/27/58/78/1347275878.db2.gz	OXKIMDARHXSBAV-IBGZPJMESA-N	0	3	342.458	3.332	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@H](C)c3cccs3)C2)CC1	ZINC001047254734	1347278827	/nfs/dbraw/zinc/27/88/27/1347278827.db2.gz	RPSXOWPNVWBNIX-AEFFLSMTSA-N	0	3	344.524	3.435	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)c3cccn3CC)C2)CC1	ZINC001047265833	1347287043	/nfs/dbraw/zinc/28/70/43/1347287043.db2.gz	XKCWZPRXAJUMAG-IBGZPJMESA-N	0	3	341.499	3.096	20	30		EGEDHN
Cc1occc1C(=O)N1CC[C@H]([C@H](C)NCc2ccccc2C#N)C1	ZINC001047706279	1347342424	/nfs/dbraw/zinc/34/24/24/1347342424.db2.gz	TXAAIAIUTITLBH-KSSFIOAISA-N	0	3	337.423	3.100	20	30		EGEDHN
C/C(=C/C(=O)N1CC[C@H]([C@@H](C)NCc2ccccc2C#N)C1)C1CC1	ZINC001047736167	1347355955	/nfs/dbraw/zinc/35/59/55/1347355955.db2.gz	OBDAIVJAPIXUON-OUAFYBQWSA-N	0	3	337.467	3.241	20	30		EGEDHN
C[C@@H](NCc1cc(F)ccc1C#N)[C@@H]1CCN(C(=O)C2=CCCC2)C1	ZINC001047800153	1347376458	/nfs/dbraw/zinc/37/64/58/1347376458.db2.gz	OVVNXHZVTIBVFH-RHSMWYFYSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]([C@@H](C)NCc2ccccc2C#N)C1	ZINC001047924434	1347411126	/nfs/dbraw/zinc/41/11/26/1347411126.db2.gz	NOXFIFCPDKKVBO-QAPCUYQASA-N	0	3	325.456	3.097	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]([C@H](C)NCc2csc(C)n2)C1	ZINC001047924339	1347411212	/nfs/dbraw/zinc/41/12/12/1347411212.db2.gz	NFSBBCJARNZXDW-ZFWWWQNUSA-N	0	3	335.517	3.380	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)C(C)(C)C2CC2)C1	ZINC001047942409	1347419192	/nfs/dbraw/zinc/41/91/92/1347419192.db2.gz	XKMYTKQQMGHQPN-YJBOKZPZSA-N	0	3	339.483	3.321	20	30		EGEDHN
C[C@@H]1CN(C(=O)/C=C/c2ccco2)C[C@@H]1CNCc1ccccc1C#N	ZINC001048108959	1347469299	/nfs/dbraw/zinc/46/92/99/1347469299.db2.gz	QAPQCRXAMDJCND-ZCLAENRFSA-N	0	3	349.434	3.049	20	30		EGEDHN
C[C@H]1CN(C(=O)CCC2CCC2)C[C@@H]1CNCc1ccccc1C#N	ZINC001048199487	1347491712	/nfs/dbraw/zinc/49/17/12/1347491712.db2.gz	YHHAXMHMANSVLD-JXFKEZNVSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](CNCc2nc(C)cs2)[C@H](C)C1	ZINC001048337594	1347522368	/nfs/dbraw/zinc/52/23/68/1347522368.db2.gz	DYQWKCGTCHNNQK-UKRRQHHQSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H](C)[C@H](CNCc3csc(CC)n3)C2)C1	ZINC001048373981	1347534548	/nfs/dbraw/zinc/53/45/48/1347534548.db2.gz	LXYWIKXAFNTIJK-LSDHHAIUSA-N	0	3	347.528	3.246	20	30		EGEDHN
C=C(C)CN1CCC(N(Cc2ccccn2)C(=O)c2ccoc2)CC1	ZINC001048625354	1347623817	/nfs/dbraw/zinc/62/38/17/1347623817.db2.gz	YATJLVFNXWCWBC-UHFFFAOYSA-N	0	3	339.439	3.358	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)[C@H]2CC[C@@H](C)C2)CC1	ZINC001048626522	1347624271	/nfs/dbraw/zinc/62/42/71/1347624271.db2.gz	RRIKZJWFSDQVBF-MSOLQXFVSA-N	0	3	341.499	3.497	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc(C(C)(C)CC)cc3)C[C@@H]2C1	ZINC001048882600	1347675507	/nfs/dbraw/zinc/67/55/07/1347675507.db2.gz	QTFKINXUOLNPJV-KDURUIRLSA-N	0	3	338.495	3.401	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CN([C@@H](C)c3ccccc3F)C[C@H]2C1	ZINC001048977688	1347696733	/nfs/dbraw/zinc/69/67/33/1347696733.db2.gz	IQVCGXPFBLCIQL-HRCADAONSA-N	0	3	330.447	3.489	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CN(C(=O)[C@@H]4CC45CCCC5)C[C@@H]3C2)c1	ZINC001049155340	1347736103	/nfs/dbraw/zinc/73/61/03/1347736103.db2.gz	BDCXXDWXZUEBPP-ZCNNSNEGSA-N	0	3	349.478	3.029	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)CC3CCC(C(C)(C)C)CC3)C[C@@H]2C1	ZINC001049238586	1347754061	/nfs/dbraw/zinc/75/40/61/1347754061.db2.gz	FPVGBKJGHIXVPK-FXSDRFNOSA-N	0	3	330.516	3.252	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)C2CCCC2)c1	ZINC001049282180	1347768782	/nfs/dbraw/zinc/76/87/82/1347768782.db2.gz	WLLZOMXGSLOVHY-VQTJNVASSA-N	0	3	337.467	3.314	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@@H]2[C@@H]1CCN2CCc1ccccc1Cl	ZINC001049370969	1347808390	/nfs/dbraw/zinc/80/83/90/1347808390.db2.gz	DHSRFVYKJOQSAO-OLMNPRSZSA-N	0	3	345.874	3.107	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@@H]2CCCN3C(=O)C2=CCCC2)c1	ZINC001049414171	1347837085	/nfs/dbraw/zinc/83/70/85/1347837085.db2.gz	BTRHNBNXDTXANM-PMACEKPBSA-N	0	3	335.451	3.234	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1c(F)cccc1OC	ZINC001049492055	1347875324	/nfs/dbraw/zinc/87/53/24/1347875324.db2.gz	WNSNMHKONBFYBH-CVEARBPZSA-N	0	3	332.419	3.089	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1c(C)nn(C(C)(C)C)c1C	ZINC001049507502	1347884084	/nfs/dbraw/zinc/88/40/84/1347884084.db2.gz	JNOZKUMCAHGKOR-IAGOWNOFSA-N	0	3	344.503	3.120	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)C1C2CC3CC(C2)CC1C3	ZINC001049522063	1347890274	/nfs/dbraw/zinc/89/02/74/1347890274.db2.gz	OJUNXZXSBMJKTP-BAQDPJJQSA-N	0	3	328.500	3.310	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1snnc1C1CC1	ZINC001049532309	1347895367	/nfs/dbraw/zinc/89/53/67/1347895367.db2.gz	OKYYYFNOZZTSLG-HUUCEWRRSA-N	0	3	346.500	3.061	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1c(C)cccc1Cl	ZINC001049566241	1347913372	/nfs/dbraw/zinc/91/33/72/1347913372.db2.gz	ASIUXKDYANSNFP-ZWKOTPCHSA-N	0	3	332.875	3.442	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H]1COc2ccc(Cl)cc21	ZINC001049589013	1347924958	/nfs/dbraw/zinc/92/49/58/1347924958.db2.gz	JSOURJXMVAJJCM-GVDBMIGSSA-N	0	3	346.858	3.067	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(C)c2cccnc12	ZINC001049598283	1347930025	/nfs/dbraw/zinc/93/00/25/1347930025.db2.gz	MIJOXJBEQJDGOK-VQTJNVASSA-N	0	3	347.462	3.245	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1c(C)ccnc1OCC	ZINC001049616645	1347936340	/nfs/dbraw/zinc/93/63/40/1347936340.db2.gz	YOYFHXGJWHLBTA-IAGOWNOFSA-N	0	3	343.471	3.044	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(C)nc1C(C)C	ZINC001049621799	1347939375	/nfs/dbraw/zinc/93/93/75/1347939375.db2.gz	OSMWUCTWEPOUCX-QZTJIDSGSA-N	0	3	327.472	3.378	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)CC(C1CCC1)C1CCC1	ZINC001049717943	1347989729	/nfs/dbraw/zinc/98/97/29/1347989729.db2.gz	HRDAMHGIRZQLQB-VQTJNVASSA-N	0	3	328.500	3.291	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1cccc(C#N)c1	ZINC001049734069	1347993673	/nfs/dbraw/zinc/99/36/73/1347993673.db2.gz	CWFAGCLMQVSIPS-WTGUMLROSA-N	0	3	337.467	3.170	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1cn(CC)nc1C(C)C	ZINC001049757982	1348004394	/nfs/dbraw/zinc/00/43/94/1348004394.db2.gz	FHUIPRGROHZQSU-MSOLQXFVSA-N	0	3	344.503	3.281	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](C)Cc1cccs1	ZINC001049761451	1348006850	/nfs/dbraw/zinc/00/68/50/1348006850.db2.gz	KIBSBBISLCPBIZ-BPQIPLTHSA-N	0	3	330.497	3.015	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1ccccc1OC(C)C	ZINC001049783084	1348019929	/nfs/dbraw/zinc/01/99/29/1348019929.db2.gz	NWYABICUFAYWGF-OALUTQOASA-N	0	3	342.483	3.268	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccccc1F	ZINC001049785829	1348021226	/nfs/dbraw/zinc/02/12/26/1348021226.db2.gz	ZJNGBFBAXGCBNJ-OGWHTMIXSA-N	0	3	328.431	3.181	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cccc(N2CCCC2)c1	ZINC001049805646	1348028730	/nfs/dbraw/zinc/02/87/30/1348028730.db2.gz	KRHJXPQALJLKAK-PMACEKPBSA-N	0	3	339.483	3.152	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1coc(C2CCC2)n1	ZINC001049842104	1348053600	/nfs/dbraw/zinc/05/36/00/1348053600.db2.gz	KBTMQKBDHQZJIW-IRXDYDNUSA-N	0	3	329.444	3.197	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1cccc2ccccc21	ZINC001049852969	1348059772	/nfs/dbraw/zinc/05/97/72/1348059772.db2.gz	BQHPVGUDTVQLBY-RTWAWAEBSA-N	0	3	332.447	3.081	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(F)c(F)c(F)c1F	ZINC001049853885	1348060342	/nfs/dbraw/zinc/06/03/42/1348060342.db2.gz	HSOPJKJYAVPWIS-QWHCGFSZSA-N	0	3	342.336	3.108	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(C)nc2ccccc21	ZINC001049871550	1348077501	/nfs/dbraw/zinc/07/75/01/1348077501.db2.gz	MLLLMXVKJLCLPW-PMACEKPBSA-N	0	3	335.451	3.408	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)[C@@]1(c2ccccc2)C[C@H](F)C1	ZINC001049874941	1348079851	/nfs/dbraw/zinc/07/98/51/1348079851.db2.gz	IGOZCJLYBZILQP-IWFBPKFRSA-N	0	3	342.458	3.308	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(C)c(CC)s1	ZINC001049881905	1348087464	/nfs/dbraw/zinc/08/74/64/1348087464.db2.gz	SVVSXYHYWPJFDX-HZPDHXFCSA-N	0	3	330.497	3.321	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(C)c(F)c(C)c1	ZINC001049901725	1348101434	/nfs/dbraw/zinc/10/14/34/1348101434.db2.gz	AUIFOJJNRDZHTK-MSOLQXFVSA-N	0	3	328.431	3.145	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(OC2CCC2)cc1	ZINC001049909703	1348106579	/nfs/dbraw/zinc/10/65/79/1348106579.db2.gz	RWJAOZBVSIWKMI-WOJBJXKFSA-N	0	3	340.467	3.483	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1c[nH]c2c1cccc2CC	ZINC001049915970	1348110560	/nfs/dbraw/zinc/11/05/60/1348110560.db2.gz	DIZUVDZRXYLUDU-RTBURBONSA-N	0	3	335.451	3.042	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H]1Cc2c1cccc2Cl	ZINC001049924105	1348115807	/nfs/dbraw/zinc/11/58/07/1348115807.db2.gz	PRZNHNSDDXTBIS-BPQIPLTHSA-N	0	3	330.859	3.231	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cccc2c1OCC2(C)C	ZINC001049933614	1348121198	/nfs/dbraw/zinc/12/11/98/1348121198.db2.gz	MDYHJVCALVHVJR-MSOLQXFVSA-N	0	3	340.467	3.222	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(OC(C)C)cn1	ZINC001049938693	1348123652	/nfs/dbraw/zinc/12/36/52/1348123652.db2.gz	ADJQWYAIGHXPSK-MOPGFXCFSA-N	0	3	343.471	3.124	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CCCN(C(=O)[C@@H]4CC=CCC4)[C@@H]3C2)c1	ZINC001049971617	1348139158	/nfs/dbraw/zinc/13/91/58/1348139158.db2.gz	SKMJYQVVEORVKI-QHAWAJNXSA-N	0	3	349.478	3.337	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3ccc4c(c3)C(C)(C)CO4)[C@@H]2C1	ZINC001050092516	1348180684	/nfs/dbraw/zinc/18/06/84/1348180684.db2.gz	UFOOWUUGOXCZSE-FUHWJXTLSA-N	0	3	340.467	3.079	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)Cc3cccc(C)c3Cl)[C@@H]2C1	ZINC001050093064	1348180777	/nfs/dbraw/zinc/18/07/77/1348180777.db2.gz	CRCHZHHMPZUSBL-DLBZAZTESA-N	0	3	332.875	3.300	20	30		EGEDHN
CC1(CC(=O)N2CCC[C@H]3CN(Cc4cccc(C#N)c4)C[C@H]32)CC1	ZINC001050098594	1348182826	/nfs/dbraw/zinc/18/28/26/1348182826.db2.gz	UAPCTUQIKYDLPZ-RBUKOAKNSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC[C@H](CNCc3nccn3CC)CC2)C1	ZINC001050362443	1348238771	/nfs/dbraw/zinc/23/87/71/1348238771.db2.gz	CFQKPIUVMGSBND-QAQDUYKDSA-N	0	3	344.503	3.024	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3occc3-c3ccccc3)C2)CC1	ZINC001050585028	1348293981	/nfs/dbraw/zinc/29/39/81/1348293981.db2.gz	BTLDZAXWQVNQOU-UHFFFAOYSA-N	0	3	334.419	3.118	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC2(C1)CCN(Cc1cncc(C)c1)CC2	ZINC001050614050	1348303153	/nfs/dbraw/zinc/30/31/53/1348303153.db2.gz	LDASUPWGILBXCQ-UHFFFAOYSA-N	0	3	341.499	3.417	20	30		EGEDHN
C[C@@]1(C(=O)N2CC3(C2)CCN(Cc2cccc(C#N)c2)CC3)C=CCC1	ZINC001050622595	1348305901	/nfs/dbraw/zinc/30/59/01/1348305901.db2.gz	FJBXBKRSWRJMES-OAQYLSRUSA-N	0	3	349.478	3.339	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3ccc(-c4ccccc4)o3)C2)CC1	ZINC001050672949	1348322537	/nfs/dbraw/zinc/32/25/37/1348322537.db2.gz	UBGOPVHATRRLKF-UHFFFAOYSA-N	0	3	334.419	3.118	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cc(F)cc(Cl)c3)C2)CC1	ZINC001050676837	1348323263	/nfs/dbraw/zinc/32/32/63/1348323263.db2.gz	GWKIDSVESIHRAC-UHFFFAOYSA-N	0	3	334.822	3.040	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cccc(F)c3Cl)C2)CC1	ZINC001050677826	1348323991	/nfs/dbraw/zinc/32/39/91/1348323991.db2.gz	GDQLHJHSNYIVNQ-UHFFFAOYSA-N	0	3	334.822	3.040	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3c(F)cccc3Cl)C2)CC1	ZINC001050737895	1348342995	/nfs/dbraw/zinc/34/29/95/1348342995.db2.gz	OJTWYOCNDCBEBA-UHFFFAOYSA-N	0	3	334.822	3.040	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)CCc3ccc(CC)cc3)C2)CC1	ZINC001050750237	1348348265	/nfs/dbraw/zinc/34/82/65/1348348265.db2.gz	DLOZJEOIZLJIKX-UHFFFAOYSA-N	0	3	338.495	3.129	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H](C)c3ccc(F)cc3F)C2)CC1	ZINC001050759482	1348350607	/nfs/dbraw/zinc/35/06/07/1348350607.db2.gz	LPLDFOPLQFRRJV-OAHLLOKOSA-N	0	3	346.421	3.016	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cc4ccccc4n3CC)C2)CC1	ZINC001050766844	1348352439	/nfs/dbraw/zinc/35/24/39/1348352439.db2.gz	ZPLSFZHYKGWTOK-UHFFFAOYSA-N	0	3	349.478	3.223	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3ccc(C)n3C)cccc2C1	ZINC001051278875	1348414967	/nfs/dbraw/zinc/41/49/67/1348414967.db2.gz	HROAZUGMYRLOJS-UHFFFAOYSA-N	0	3	337.467	3.198	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)[C@@H]3CCC[C@H]4C[C@H]43)cccc2C1	ZINC001051292336	1348421646	/nfs/dbraw/zinc/42/16/46/1348421646.db2.gz	URGJLMGIMJMXSW-ZLGUVYLKSA-N	0	3	336.479	3.120	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3cc(F)c[nH]3)cccc2C1	ZINC001051293046	1348422345	/nfs/dbraw/zinc/42/23/45/1348422345.db2.gz	JXEJAIREJCRVEY-UHFFFAOYSA-N	0	3	327.403	3.018	20	30		EGEDHN
C=C(C)CCN1CCN([C@H]2CCN(C(=O)C3CCCCCC3)C2)CC1	ZINC001051991172	1348494889	/nfs/dbraw/zinc/49/48/89/1348494889.db2.gz	FCWZQUCDOFNDCW-FQEVSTJZSA-N	0	3	347.547	3.142	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N[C@H]1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC001052317450	1348520569	/nfs/dbraw/zinc/52/05/69/1348520569.db2.gz	JVYBWQPAUJAQTN-ROUUACIJSA-N	0	3	325.456	3.075	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H]2CCCN(Cc3cccc(C#N)c3)CC2)co1	ZINC001052338489	1348528008	/nfs/dbraw/zinc/52/80/08/1348528008.db2.gz	ULJSTCDYOFGNGL-LJQANCHMSA-N	0	3	337.423	3.244	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2oc3ccc(F)cc3c2C)CC1	ZINC001052446663	1348543043	/nfs/dbraw/zinc/54/30/43/1348543043.db2.gz	NESFVZAKWXVQCD-HNNXBMFYSA-N	0	3	328.387	3.098	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2ccccc2CC(C)(C)C)CC1	ZINC001052475405	1348549734	/nfs/dbraw/zinc/54/97/34/1348549734.db2.gz	KZEKGEAQMWUFRB-GOSISDBHSA-N	0	3	326.484	3.493	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@H](NC(=O)[C@H]3CCC3(F)F)CC2)c1	ZINC001052481582	1348551710	/nfs/dbraw/zinc/55/17/10/1348551710.db2.gz	PUOSIJNQWBWASJ-IAGOWNOFSA-N	0	3	347.409	3.074	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2ccc(OC)c(C(C)C)c2)CC1	ZINC001052531581	1348567461	/nfs/dbraw/zinc/56/74/61/1348567461.db2.gz	KIHKZXIVFSVYPQ-QGZVFWFLSA-N	0	3	328.456	3.036	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)Cc2cc3ccccc3s2)CC1	ZINC001052553434	1348577282	/nfs/dbraw/zinc/57/72/82/1348577282.db2.gz	FDYWBCTUGWJVRR-MRXNPFEDSA-N	0	3	326.465	3.048	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2sccc2-n2cccc2)CC1	ZINC001052607138	1348595237	/nfs/dbraw/zinc/59/52/37/1348595237.db2.gz	DWZZRYDKEWLVRD-MRXNPFEDSA-N	0	3	341.480	3.146	20	30		EGEDHN
CC1(C)CC[C@H]1C(=O)N[C@H]1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC001052636811	1348605720	/nfs/dbraw/zinc/60/57/20/1348605720.db2.gz	YJYMQOAZWWISKU-OALUTQOASA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)Cc2ccc(F)c(Cl)c2)CC1	ZINC001052742333	1348656652	/nfs/dbraw/zinc/65/66/52/1348656652.db2.gz	IPSHZOXBRGOPBI-HNNXBMFYSA-N	0	3	336.838	3.016	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)C(C)(C)c2cccc(Cl)c2)CC1	ZINC001052752504	1348662523	/nfs/dbraw/zinc/66/25/23/1348662523.db2.gz	UHJLAWKMYQRWIV-QGZVFWFLSA-N	0	3	332.875	3.222	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2ccccc2O[C@@H](C)CC)CC1	ZINC001052754623	1348664341	/nfs/dbraw/zinc/66/43/41/1348664341.db2.gz	OFPPBQRJSHCNRC-IRXDYDNUSA-N	0	3	328.456	3.081	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2sc(CC3CC3)nc2C)CC1	ZINC001052823357	1348690718	/nfs/dbraw/zinc/69/07/18/1348690718.db2.gz	FPXIXYYWVOUERK-MRXNPFEDSA-N	0	3	345.512	3.012	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc(COC(C)C)cc2)CC1	ZINC001052923870	1348750403	/nfs/dbraw/zinc/75/04/03/1348750403.db2.gz	OQXQSIDQBXFFKF-HXUWFJFHSA-N	0	3	342.483	3.219	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cc(Cl)c[nH]2)C1	ZINC001053066569	1348878608	/nfs/dbraw/zinc/87/86/08/1348878608.db2.gz	AZPYKXYGLDYPHK-YJBOKZPZSA-N	0	3	347.890	3.398	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)COC2CCCC2)C1	ZINC001053070220	1348884403	/nfs/dbraw/zinc/88/44/03/1348884403.db2.gz	UPTQPADWAAERDX-ICSRJNTNSA-N	0	3	346.515	3.062	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cnc(C)s2)C1	ZINC001053070927	1348887767	/nfs/dbraw/zinc/88/77/67/1348887767.db2.gz	GQHBFLLLNGYIRM-SJORKVTESA-N	0	3	345.512	3.182	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)C2CC(F)(F)C2)C1	ZINC001053075694	1348893759	/nfs/dbraw/zinc/89/37/59/1348893759.db2.gz	IZZUNTYOPUBYGV-DOTOQJQBSA-N	0	3	338.442	3.148	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cncc(C)c2)C1	ZINC001053078187	1348897129	/nfs/dbraw/zinc/89/71/29/1348897129.db2.gz	OPIDKLDLAQEPFB-UYAOXDASSA-N	0	3	339.483	3.120	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)Cc2ccc(C)o2)C1	ZINC001053080834	1348902496	/nfs/dbraw/zinc/90/24/96/1348902496.db2.gz	SZLLXSYJCDIOFS-AZUAARDMSA-N	0	3	342.483	3.247	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cc(C(C)C)on2)C1	ZINC001053094589	1348924506	/nfs/dbraw/zinc/92/45/06/1348924506.db2.gz	WVLOHWTXHQXDJU-FUHWJXTLSA-N	0	3	343.471	3.138	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccn(C)c2C)C1	ZINC001053096810	1348926788	/nfs/dbraw/zinc/92/67/88/1348926788.db2.gz	ZUIYNLWJMCETNG-QUCCMNQESA-N	0	3	341.499	3.064	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2nc(C)c(C)s2)C1	ZINC001053104061	1348938167	/nfs/dbraw/zinc/93/81/67/1348938167.db2.gz	BPPRVIMZUFZQOS-DLBZAZTESA-N	0	3	345.512	3.100	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cn(C)c3ccccc13)C2	ZINC001054160973	1349163038	/nfs/dbraw/zinc/16/30/38/1349163038.db2.gz	UJQNNSFVRVEICE-QFIPXVFZSA-N	0	3	349.478	3.130	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cn(CC)c3ccccc13)C2	ZINC001054161707	1349164407	/nfs/dbraw/zinc/16/44/07/1349164407.db2.gz	NEIIQWQXYSUUSN-JOCHJYFZSA-N	0	3	349.478	3.223	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc3ccc(C)cc3[nH]1)C2	ZINC001054172627	1349173648	/nfs/dbraw/zinc/17/36/48/1349173648.db2.gz	TXHIQBZBPQHERG-NRFANRHFSA-N	0	3	335.451	3.038	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC[C@@]3(CCN(C/C=C\Cl)C3)C2)cc1	ZINC001054174026	1349175533	/nfs/dbraw/zinc/17/55/33/1349175533.db2.gz	JKIFWRWTJBBANA-VHLMXJOBSA-N	0	3	342.870	3.349	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@H](C)c1cccc(C)c1)C2	ZINC001054206466	1349208937	/nfs/dbraw/zinc/20/89/37/1349208937.db2.gz	JCUJUCJQYLHYHX-KNQAVFIVSA-N	0	3	338.495	3.436	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc(Cl)cs1)C2	ZINC001054207674	1349209621	/nfs/dbraw/zinc/20/96/21/1349209621.db2.gz	FDFRJELZWYNOCF-QGZVFWFLSA-N	0	3	336.888	3.353	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)C(C)(C)c1ccccc1F)C2	ZINC001054214036	1349212983	/nfs/dbraw/zinc/21/29/83/1349212983.db2.gz	PLGWALHGQPUYKS-OAQYLSRUSA-N	0	3	342.458	3.051	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)Cc1ccc(C)c(C)c1)C2	ZINC001054236345	1349229538	/nfs/dbraw/zinc/22/95/38/1349229538.db2.gz	ILARQXMSGYKKTI-JOCHJYFZSA-N	0	3	338.495	3.184	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc(Cl)cn1CC)C2	ZINC001054241213	1349235168	/nfs/dbraw/zinc/23/51/68/1349235168.db2.gz	NBEIZWPDQFUORH-LJQANCHMSA-N	0	3	347.890	3.113	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3snnc3C)cc2C1	ZINC001054254931	1349250689	/nfs/dbraw/zinc/25/06/89/1349250689.db2.gz	PEUGTOSZWRYCEX-UHFFFAOYSA-N	0	3	342.468	3.058	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cc4c[nH]ccc-4n3)cc2C1	ZINC001054269430	1349268284	/nfs/dbraw/zinc/26/82/84/1349268284.db2.gz	AHGSCWPVKAXPNX-UHFFFAOYSA-N	0	3	346.434	3.385	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@@H]3CCO[C@H]3CC)cc2C1	ZINC001054275278	1349276161	/nfs/dbraw/zinc/27/61/61/1349276161.db2.gz	NIFIUIMEHZEHTL-UXHICEINSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@H]3CCc4cccnc43)cc2C1	ZINC001054278572	1349278676	/nfs/dbraw/zinc/27/86/76/1349278676.db2.gz	HKCNLVQXRJRGRA-FQEVSTJZSA-N	0	3	347.462	3.320	20	30		EGEDHN
C#CCOc1ccc(C(=O)NCc2ccc3c(c2)CN(C(C)C)C3)cc1	ZINC001054285052	1349287184	/nfs/dbraw/zinc/28/71/84/1349287184.db2.gz	QLBHJWOLSMHJHB-UHFFFAOYSA-N	0	3	348.446	3.353	20	30		EGEDHN
Cc1ccccc1C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001054348913	1349328709	/nfs/dbraw/zinc/32/87/09/1349328709.db2.gz	PHTSLGAKLTXZSS-RDTXWAMCSA-N	0	3	339.464	3.179	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)Cc2cc3ccccc3s2)C1	ZINC001080117584	1357491706	/nfs/dbraw/zinc/49/17/06/1357491706.db2.gz	KUJMLBMAOXIFBY-RHSMWYFYSA-N	0	3	328.481	3.456	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)CC1CCCCC1)C[C@H](C)O2	ZINC001071131879	1354469621	/nfs/dbraw/zinc/46/96/21/1354469621.db2.gz	NXTMAERFMNQBAI-FXAWDEMLSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1sc(C)cc1C)C[C@@H](C)O2	ZINC001071174087	1354487970	/nfs/dbraw/zinc/48/79/70/1354487970.db2.gz	SOOGKBMSACYHNX-BEFAXECRSA-N	0	3	348.512	3.246	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C(C)(C)C1CCC1)C[C@@H](C)O2	ZINC001071195084	1354497065	/nfs/dbraw/zinc/49/70/65/1354497065.db2.gz	RTFVOPNBABMHGN-UZLBHIALSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C1(C)C(C)(C)C1(C)C)C[C@H](C)O2	ZINC001071248792	1354527424	/nfs/dbraw/zinc/52/74/24/1354527424.db2.gz	SYBBDIZFTFYPML-HRAATJIYSA-N	0	3	348.531	3.327	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cccc(C(F)F)c2F)CC[C@@H]1C	ZINC001071513644	1354737746	/nfs/dbraw/zinc/73/77/46/1354737746.db2.gz	GYOMJMAQVWJIKF-QWHCGFSZSA-N	0	3	338.373	3.369	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ncn3cc(Cl)ccc23)CC[C@H]1C	ZINC001071516793	1354738780	/nfs/dbraw/zinc/73/87/80/1354738780.db2.gz	BQKSHXBJMFBGFZ-UKRRQHHQSA-N	0	3	346.862	3.147	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C2(c3ccc(F)cc3)CC2)CC[C@H]1C	ZINC001071543985	1354756720	/nfs/dbraw/zinc/75/67/20/1354756720.db2.gz	QXVGTMXGUBCCDO-QAPCUYQASA-N	0	3	330.447	3.403	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc3ccccc3nc2C)CC[C@@H]1C	ZINC001071546952	1354758641	/nfs/dbraw/zinc/75/86/41/1354758641.db2.gz	PCYZVNJQJJRBGP-YJBOKZPZSA-N	0	3	335.451	3.149	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2c(Cl)n[nH]c2C2CC2)CC[C@@H]1C	ZINC001071561165	1354765377	/nfs/dbraw/zinc/76/53/77/1354765377.db2.gz	JZENTZPXWMHOIT-WCQYABFASA-N	0	3	336.867	3.099	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(-n3cccn3)cc2)CC[C@H]1C	ZINC001071561887	1354765806	/nfs/dbraw/zinc/76/58/06/1354765806.db2.gz	WYBUXLVYDUDBQI-AEFFLSMTSA-N	0	3	338.455	3.031	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc(C3CCCCC3)n[nH]2)CC[C@H]1C	ZINC001071576440	1354773568	/nfs/dbraw/zinc/77/35/68/1354773568.db2.gz	GOCZRRNZCUOPDK-NVXWUHKLSA-N	0	3	342.487	3.063	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cnoc2-c2ccco2)CC[C@H]1C	ZINC001071623196	1354805519	/nfs/dbraw/zinc/80/55/19/1354805519.db2.gz	SKWABQOUUYDMFH-KGLIPLIRSA-N	0	3	329.400	3.093	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2nc3cnccc3s2)CC[C@@H]1C	ZINC001071672255	1354841984	/nfs/dbraw/zinc/84/19/84/1354841984.db2.gz	ADZPOHNHSSFJJP-KBPBESRZSA-N	0	3	344.484	3.240	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc3[nH]nc(C)c3c2)CC[C@@H]1C	ZINC001071676970	1354843592	/nfs/dbraw/zinc/84/35/92/1354843592.db2.gz	QDEGJFFIAPELBA-XJKSGUPXSA-N	0	3	326.444	3.030	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2cnc(CC3CC3)s2)CC[C@@H]1C	ZINC001071692023	1354853535	/nfs/dbraw/zinc/85/35/35/1354853535.db2.gz	DXHQLTFFAAMEDZ-DZGCQCFKSA-N	0	3	333.501	3.254	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cncc3sccc32)CC[C@@H]1C	ZINC001071765717	1354912880	/nfs/dbraw/zinc/91/28/80/1354912880.db2.gz	JWOQANZCQJIDBN-UONOGXRCSA-N	0	3	329.469	3.455	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC[C@@H](C)N(CCc3scnc3C)C2)C1	ZINC001071808248	1354952236	/nfs/dbraw/zinc/95/22/36/1354952236.db2.gz	YIDWMHNBFIDJMX-ZBFHGGJFSA-N	0	3	347.528	3.319	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc(C)oc2C(F)(F)F)CC[C@H]1C	ZINC001071859034	1354987503	/nfs/dbraw/zinc/98/75/03/1354987503.db2.gz	XMGXMGXXKFEPHM-YPMHNXCESA-N	0	3	342.361	3.213	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2csc(-c3ccoc3)n2)CC[C@@H]1C	ZINC001071908595	1355018842	/nfs/dbraw/zinc/01/88/42/1355018842.db2.gz	YYMSKDQHLOEUNZ-DZGCQCFKSA-N	0	3	343.452	3.009	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cncc(C(F)(F)F)c2)CC[C@@H]1C	ZINC001071957525	1355043223	/nfs/dbraw/zinc/04/32/23/1355043223.db2.gz	JSFYOUMVZJSABW-SWLSCSKDSA-N	0	3	341.377	3.259	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CC[C@@H](C)N(Cc3cccc(C)c3)C2)nc1	ZINC001071999026	1355066762	/nfs/dbraw/zinc/06/67/62/1355066762.db2.gz	LYAGXPFRGIDHBE-YLJYHZDGSA-N	0	3	347.462	3.154	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(C(F)(F)F)cc2)CC[C@@H]1C	ZINC001072015242	1355077815	/nfs/dbraw/zinc/07/78/15/1355077815.db2.gz	ADPWIWAJZUOTJT-XJKSGUPXSA-N	0	3	338.373	3.311	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)Cc2coc3cc(C)ccc23)CC[C@@H]1C	ZINC001072050275	1355104118	/nfs/dbraw/zinc/10/41/18/1355104118.db2.gz	UQKZNYLZMUFNOF-DOTOQJQBSA-N	0	3	326.440	3.439	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2(c3ccccc3)CCCC2)CC[C@@H]1C	ZINC001072053920	1355105232	/nfs/dbraw/zinc/10/52/32/1355105232.db2.gz	WKNVHYLUKISFQX-ICSRJNTNSA-N	0	3	338.495	3.491	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2csc3c2CCCC3)CC[C@@H]1C	ZINC001072055390	1355106192	/nfs/dbraw/zinc/10/61/92/1355106192.db2.gz	UGCONPUBMDTOIW-LSDHHAIUSA-N	0	3	330.497	3.233	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)c2c[nH]c3c2cccc3CC)CC[C@H]1C	ZINC001072098826	1355128326	/nfs/dbraw/zinc/12/83/26/1355128326.db2.gz	GXUOGDWYHSRFOC-ZBFHGGJFSA-N	0	3	325.456	3.499	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(OC(C)C)cn2)CC[C@@H]1C	ZINC001072125915	1355142826	/nfs/dbraw/zinc/14/28/26/1355142826.db2.gz	HMRPMTBQVKDQBI-JKSUJKDBSA-N	0	3	331.460	3.028	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cscc2C(F)(F)F)CC[C@@H]1C	ZINC001072127180	1355143950	/nfs/dbraw/zinc/14/39/50/1355143950.db2.gz	PZMUSRIIYGPBDM-NWDGAFQWSA-N	0	3	344.402	3.373	20	30		EGEDHN
C[C@H]1CCN(C(=O)C2CCCC2)C[C@H]1CNCc1ccccc1C#N	ZINC001072155947	1355157297	/nfs/dbraw/zinc/15/72/97/1355157297.db2.gz	JOMZITXZPKYDGX-OXJNMPFZSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](C)[C@@H](CNCc2cscn2)C1	ZINC001072334521	1355244025	/nfs/dbraw/zinc/24/40/25/1355244025.db2.gz	CPIFVNRXSFISKT-CABCVRRESA-N	0	3	335.517	3.320	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](C)[C@@H](CNCc2ncc(C)s2)C1	ZINC001072334986	1355244379	/nfs/dbraw/zinc/24/43/79/1355244379.db2.gz	KMZYXIQBNBAMRO-HIFRSBDPSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](C)[C@H](CNCc3cscn3)C2)C1	ZINC001072364172	1355258594	/nfs/dbraw/zinc/25/85/94/1355258594.db2.gz	POLOKWOPIWNNQL-LSDHHAIUSA-N	0	3	333.501	3.074	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CN(C(=O)c4cccc(F)c4)C3)C2)cc1	ZINC001072418961	1355280692	/nfs/dbraw/zinc/28/06/92/1355280692.db2.gz	IWYVNEHYXKZGBX-UHFFFAOYSA-N	0	3	349.409	3.045	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC2(C1)CCN([C@H](C)c1ccccc1Cl)C2	ZINC001072544223	1355326880	/nfs/dbraw/zinc/32/68/80/1355326880.db2.gz	FMEUBGHNWXKVNJ-ZIAGYGMSSA-N	0	3	331.847	3.095	20	30		EGEDHN
C[C@@H](C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2)C1CCC1	ZINC001072844483	1355461626	/nfs/dbraw/zinc/46/16/26/1355461626.db2.gz	BCMIHBIOOKFOAL-MRXNPFEDSA-N	0	3	337.467	3.029	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CN(C(=O)C[C@@H]4CC[C@@H]5C[C@@H]54)C3)C2)cc1	ZINC001072875133	1355478348	/nfs/dbraw/zinc/47/83/48/1355478348.db2.gz	LOHRJPODSAWNGK-AABGKKOBSA-N	0	3	349.478	3.029	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001072933163	1355505715	/nfs/dbraw/zinc/50/57/15/1355505715.db2.gz	LTWLCGYPYOMFJT-UHFFFAOYSA-N	0	3	325.456	3.029	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)C3(c4ccc(Cl)cc4)CC3)C2)C1	ZINC001073408337	1355762577	/nfs/dbraw/zinc/76/25/77/1355762577.db2.gz	NNDZLRGHCYNEIC-UHFFFAOYSA-N	0	3	330.859	3.092	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2cc3ccccc3s2)C1	ZINC001073680955	1355864270	/nfs/dbraw/zinc/86/42/70/1355864270.db2.gz	AEMAKKPSDMKBNX-INIZCTEOSA-N	0	3	344.480	3.298	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2cc(Cl)ccc2C)C1	ZINC001073824892	1355908695	/nfs/dbraw/zinc/90/86/95/1355908695.db2.gz	YMPZINSRDYKTLQ-MRXNPFEDSA-N	0	3	336.863	3.045	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2ccc3c(c2)CCC=C3)C1	ZINC001073859347	1355921865	/nfs/dbraw/zinc/92/18/65/1355921865.db2.gz	HZZIDFWJVDMCKT-HXUWFJFHSA-N	0	3	340.467	3.043	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(C#N)cc1	ZINC001074046995	1356051598	/nfs/dbraw/zinc/05/15/98/1356051598.db2.gz	QFFKJHNSRFUVPQ-ATZDWAIDSA-N	0	3	325.456	3.027	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)[C@H]3CCc4c3cccc4Cl)[C@@H]2C1	ZINC001076053311	1356475821	/nfs/dbraw/zinc/47/58/21/1356475821.db2.gz	ZSTMWYMPMDNUCY-QANKJYHBSA-N	0	3	330.859	3.089	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3ccc(C)c(C)c3Cl)[C@@H]2C1	ZINC001076460963	1356583169	/nfs/dbraw/zinc/58/31/69/1356583169.db2.gz	KTVNSPXCMBUGRW-DOTOQJQBSA-N	0	3	330.859	3.126	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)C[C@H](NC(=O)C(C)(C)C)c1ccccc1O2	ZINC001098545869	1363368344	/nfs/dbraw/zinc/36/83/44/1363368344.db2.gz	ZNZOYKDFYOKNAU-UWJYYQICSA-N	0	3	340.467	3.140	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3cc4c(s3)CC[C@H](C)C4)[C@@H]2C1	ZINC001076556307	1356616623	/nfs/dbraw/zinc/61/66/23/1356616623.db2.gz	BUIWGEYNFVQMGW-YQQAZPJKSA-N	0	3	342.508	3.043	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cccc(-n3cccc3)c2)C1	ZINC001098928134	1363525503	/nfs/dbraw/zinc/52/55/03/1363525503.db2.gz	CZTDTIGMSOWBDH-RXVVDRJESA-N	0	3	335.451	3.248	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H](C)C1CCC1	ZINC001099126238	1363638774	/nfs/dbraw/zinc/63/87/74/1363638774.db2.gz	PWHREPUHVZRRCF-FUHWJXTLSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@H](C)c2cccs2)C[C@H]1C(F)(F)F	ZINC001099306210	1363741079	/nfs/dbraw/zinc/74/10/79/1363741079.db2.gz	RSQNFSQANAUYGJ-JHJVBQTASA-N	0	3	346.418	3.407	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCCO[C@@H](CNCc2ccccc2F)C1	ZINC001078460679	1356977764	/nfs/dbraw/zinc/97/77/64/1356977764.db2.gz	YPAZIFWWMLXZIU-PXNSSMCTSA-N	0	3	348.462	3.135	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCCO[C@@H](CNCc2cccc(F)c2)C1	ZINC001078460392	1356977999	/nfs/dbraw/zinc/97/79/99/1356977999.db2.gz	RUHVVVIPHFXOOO-AZUAARDMSA-N	0	3	348.462	3.135	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2cc3occc3[nH]2)C12CCC2	ZINC001078639945	1357047657	/nfs/dbraw/zinc/04/76/57/1357047657.db2.gz	PXWMWEKQYPDPDO-CABCVRRESA-N	0	3	333.819	3.144	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2ccn3ccccc23)C12CCC2	ZINC001078677710	1357051334	/nfs/dbraw/zinc/05/13/34/1357051334.db2.gz	IXMMJGJLKZRDFF-IAGOWNOFSA-N	0	3	343.858	3.322	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2oc(C3CC3)nc2C)C12CCC2	ZINC001078744395	1357069011	/nfs/dbraw/zinc/06/90/11/1357069011.db2.gz	TUJZFYQTXMAXLL-KBPBESRZSA-N	0	3	349.862	3.244	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ncccc2Cl)C12CCC2	ZINC001078785287	1357081034	/nfs/dbraw/zinc/08/10/34/1357081034.db2.gz	AXPYFJVZNSOTLX-QWHCGFSZSA-N	0	3	340.254	3.118	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2ccoc2CCC)C[C@H]1c1ccccc1	ZINC001081213703	1357849761	/nfs/dbraw/zinc/84/97/61/1357849761.db2.gz	LJSKRDFUDOHHSO-RBUKOAKNSA-N	0	3	336.435	3.063	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2coc3c2cccc3C)[C@H](OC)C1	ZINC001081803007	1357864441	/nfs/dbraw/zinc/86/44/41/1357864441.db2.gz	OXDCTQRHBLVSCQ-QZTJIDSGSA-N	0	3	342.439	3.136	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2sccc2C2CC2)[C@H](OC)C1	ZINC001082357156	1358022360	/nfs/dbraw/zinc/02/23/60/1358022360.db2.gz	KMYBFUIIHXXZBK-HZPDHXFCSA-N	0	3	334.485	3.021	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1C[C@H]2CCN(Cc3ccc4ccccc4c3)C[C@H]21	ZINC001084233048	1358168326	/nfs/dbraw/zinc/16/83/26/1358168326.db2.gz	RADPORPSSMRJPM-CWFSZBLJSA-N	0	3	333.435	3.032	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@@H]3CCCC[C@H]3C(F)(F)F)[C@@H]2C1	ZINC001084422437	1358211167	/nfs/dbraw/zinc/21/11/67/1358211167.db2.gz	YZKADUWSLJBBAB-KLHDSHLOSA-N	0	3	344.421	3.464	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)c3cccc4c3CCCCC4)[C@@H]2C1	ZINC001084433203	1358212137	/nfs/dbraw/zinc/21/21/37/1358212137.db2.gz	QAJLYUPHRPZBFX-WIYYLYMNSA-N	0	3	336.479	3.125	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CCN(C[C@H](OC)c3ccccc3)C[C@H]21	ZINC001084578002	1358242433	/nfs/dbraw/zinc/24/24/33/1358242433.db2.gz	DGVVSLDBTYAJSB-QRVBRYPASA-N	0	3	342.483	3.119	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CCN(CCc3ccc(C)cc3)C[C@H]21	ZINC001084578102	1358242588	/nfs/dbraw/zinc/24/25/88/1358242588.db2.gz	KEVDNIRRQFSHPX-RTBURBONSA-N	0	3	326.484	3.282	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)[C@@H]3C[C@H]3c3ccc(Cl)s3)[C@@H]2C1	ZINC001084608023	1358254412	/nfs/dbraw/zinc/25/44/12/1358254412.db2.gz	SLGUTNLLXBYIIR-KBUPBQIOSA-N	0	3	348.899	3.061	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3c(F)cc(F)cc3F)[C@@H]2C1	ZINC001084621265	1358258257	/nfs/dbraw/zinc/25/82/57/1358258257.db2.gz	GPCFXGLXHZOWQI-MLGOLLRUSA-N	0	3	338.373	3.216	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CCN(CCc3scnc3C)C[C@H]21	ZINC001084634986	1358262922	/nfs/dbraw/zinc/26/29/22/1358262922.db2.gz	MENUIGDAZLMZPG-GPMSIDNRSA-N	0	3	347.528	3.129	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@H](C)c3ccc(CC)cc3)[C@@H]2C1	ZINC001084724007	1358292553	/nfs/dbraw/zinc/29/25/53/1358292553.db2.gz	IVKONINCYSLZKV-NSISKUIASA-N	0	3	326.484	3.461	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CCN(C(=O)C[C@H]4C=CCC4)C[C@@H]32)cc1	ZINC001084886894	1358339601	/nfs/dbraw/zinc/33/96/01/1358339601.db2.gz	IWAZDIJNVWQFFZ-WMQCIHAUSA-N	0	3	349.478	3.337	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@H](C)OC3CCCCCC3)C[C@@H]21	ZINC001085028102	1358371449	/nfs/dbraw/zinc/37/14/49/1358371449.db2.gz	MMAPAJBIMURCKU-LMMKCTJWSA-N	0	3	334.504	3.223	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@@H](CC)Cc3ccccc3)C[C@@H]21	ZINC001085047424	1358377143	/nfs/dbraw/zinc/37/71/43/1358377143.db2.gz	PNLXYXUCSFCGDX-HBMCJLEFSA-N	0	3	338.495	3.201	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@H](C)c3ccc(F)cc3F)C[C@@H]21	ZINC001085097625	1358389303	/nfs/dbraw/zinc/38/93/03/1358389303.db2.gz	QAQQRZZCAQHURO-IYOUNJFTSA-N	0	3	334.410	3.177	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)[C@H](F)Cc3ccccc3)C[C@@H]21	ZINC001085099470	1358390940	/nfs/dbraw/zinc/39/09/40/1358390940.db2.gz	VFNZRJIRAKBFSP-QRVBRYPASA-N	0	3	330.447	3.066	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H]1CCCc2cccnc21	ZINC001085306334	1358461111	/nfs/dbraw/zinc/46/11/11/1358461111.db2.gz	UXUYAWURNMLQCT-GVDBMIGSSA-N	0	3	347.890	3.271	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H]1Cc2c(cccc2C)O1	ZINC001085396544	1358488390	/nfs/dbraw/zinc/48/83/90/1358488390.db2.gz	RQAKVKVBEDRFMX-JFIYKMOQSA-N	0	3	348.874	3.068	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1scnc1Cl	ZINC001085424926	1358495560	/nfs/dbraw/zinc/49/55/60/1358495560.db2.gz	PTNXNHVBXAUBMS-NXEZZACHSA-N	0	3	334.272	3.180	20	30		EGEDHN
CN(C[C@H]1CCN1CCCC1CCCC1)C(=O)c1c[nH]c(C#N)c1	ZINC001085556506	1358592591	/nfs/dbraw/zinc/59/25/91/1358592591.db2.gz	RXTHMBLLICWTNO-GOSISDBHSA-N	0	3	328.460	3.003	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccnn1C1CCCC1	ZINC001085623160	1358642297	/nfs/dbraw/zinc/64/22/97/1358642297.db2.gz	MJCUSAPGHIFSQC-KRWDZBQOSA-N	0	3	330.476	3.111	20	30		EGEDHN
C#Cc1cncc(C(=O)N(C)C[C@H]2CCN2[C@H](CC)c2ccccc2)c1	ZINC001085809591	1358787096	/nfs/dbraw/zinc/78/70/96/1358787096.db2.gz	IVCCOUDNYUYHDI-NHCUHLMSSA-N	0	3	347.462	3.361	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cnccc1C(F)(F)F	ZINC001085844277	1358813051	/nfs/dbraw/zinc/81/30/51/1358813051.db2.gz	ISWZYFCZXOAEBP-ZDUSSCGKSA-N	0	3	341.377	3.213	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C[C@H]2CCN2CCCC2CCCC2)nc1	ZINC001085933521	1358887861	/nfs/dbraw/zinc/88/78/61/1358887861.db2.gz	DJSUCCTVNGQKAQ-LJQANCHMSA-N	0	3	339.483	3.180	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C[C@H]2CCN2CCCC2CCCC2)cn1	ZINC001085932593	1358888213	/nfs/dbraw/zinc/88/82/13/1358888213.db2.gz	CPUYUSPWMFRUNE-HXUWFJFHSA-N	0	3	339.483	3.180	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ncoc2-c2ccccc2)C1	ZINC001086102267	1358997691	/nfs/dbraw/zinc/99/76/91/1358997691.db2.gz	PODSYVQQLJCONQ-OTVXOJSOSA-N	0	3	345.830	3.192	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)[C@@H]2C[C@H]2C(C)(C)C)C1	ZINC001086146113	1359008536	/nfs/dbraw/zinc/00/85/36/1359008536.db2.gz	TYHLVWVAKHHHJQ-XJFOESAGSA-N	0	3	343.309	3.062	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc(F)ccc2Cl)C1	ZINC001086208185	1359026596	/nfs/dbraw/zinc/02/65/96/1359026596.db2.gz	DLLIFTYKAUVUIA-KLPPZKSPSA-N	0	3	331.218	3.330	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)C1	ZINC001086220714	1359031691	/nfs/dbraw/zinc/03/16/91/1359031691.db2.gz	MZRJTGOUZRUBRH-UNQWWWNPSA-N	0	3	348.874	3.036	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2[nH]c3ccccc3c2OC)C1	ZINC001086281197	1359053943	/nfs/dbraw/zinc/05/39/43/1359053943.db2.gz	CZWMMFKYGVPJTD-BETUJISGSA-N	0	3	347.846	3.027	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cnc(-c3ccccc3)o2)C1	ZINC001086395067	1359085278	/nfs/dbraw/zinc/08/52/78/1359085278.db2.gz	MVJKPMMFROVDNI-CTYIDZIISA-N	0	3	345.830	3.192	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cccc3ccc(C)nc32)C1	ZINC001086396806	1359085829	/nfs/dbraw/zinc/08/58/29/1359085829.db2.gz	BZYVGFQXOSQRMW-KOMQPUFPSA-N	0	3	343.858	3.394	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc(-c3ccccc3)on2)C1	ZINC001086421489	1359092582	/nfs/dbraw/zinc/09/25/82/1359092582.db2.gz	QNZPIYQVSFTHOT-CTYIDZIISA-N	0	3	345.830	3.192	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)[C@@H]2C[C@@]2(C)C(C)C)C1	ZINC001086522396	1359130653	/nfs/dbraw/zinc/13/06/53/1359130653.db2.gz	UFHGYAJFNZMZEP-YXWQFLTLSA-N	0	3	343.309	3.062	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(OC)c(Cl)c2)C1	ZINC001086548748	1359141971	/nfs/dbraw/zinc/14/19/71/1359141971.db2.gz	AYOJNUSTINUBMZ-AULYBMBSSA-N	0	3	343.254	3.199	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2c(Cl)cccc2OC)C1	ZINC001086557702	1359144629	/nfs/dbraw/zinc/14/46/29/1359144629.db2.gz	BRVMSTRDQMCIOI-HAQNSBGRSA-N	0	3	343.254	3.199	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](CNCc2cc(F)ccc2C#N)[C@H](C)C1	ZINC001184019603	1387382587	/nfs/dbraw/zinc/38/25/87/1387382587.db2.gz	LLCRZLAKDIAYKC-WBVHZDCISA-N	0	3	343.446	3.238	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)[C@@H]2CCc3ccccc3O2)C1	ZINC001086831986	1359210465	/nfs/dbraw/zinc/21/04/65/1359210465.db2.gz	XVBDXFPNYQTNEC-LESCRADOSA-N	0	3	348.874	3.007	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3cc(Cl)c[nH]3)C2)CC1	ZINC001086901053	1359231426	/nfs/dbraw/zinc/23/14/26/1359231426.db2.gz	XUFNMHRNHUMOGO-AWEZNQCLSA-N	0	3	333.863	3.008	20	30		EGEDHN
C=CCC[NH+]1CCC2(C[C@@H](C)N(C(=O)c3ccccc3[O-])C2)CC1	ZINC001086904681	1359234377	/nfs/dbraw/zinc/23/43/77/1359234377.db2.gz	KMYVGHLTGRMYNA-MRXNPFEDSA-N	0	3	328.456	3.285	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)CCc3ccsc3)C2)CC1	ZINC001086927009	1359251793	/nfs/dbraw/zinc/25/17/93/1359251793.db2.gz	PUCGQVWDWRNOIQ-MRXNPFEDSA-N	0	3	330.497	3.017	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cscc3Cl)C2)CC1	ZINC001086927610	1359252883	/nfs/dbraw/zinc/25/28/83/1359252883.db2.gz	GTODATDLGHUTFV-ZDUSSCGKSA-N	0	3	336.888	3.351	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)Cc3cccc(CC)c3)C2)CC1	ZINC001086929706	1359254144	/nfs/dbraw/zinc/25/41/44/1359254144.db2.gz	PEYDJAAHGNUILV-GOSISDBHSA-N	0	3	338.495	3.128	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc4ccsc4[nH]3)C2)CC1	ZINC001086935041	1359258440	/nfs/dbraw/zinc/25/84/40/1359258440.db2.gz	HRLJELCRDQKHST-CQSZACIVSA-N	0	3	341.480	3.179	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cc4occc4s3)C2)CC1	ZINC001086942156	1359263753	/nfs/dbraw/zinc/26/37/53/1359263753.db2.gz	KHXSKMNEBKZEIS-AWEZNQCLSA-N	0	3	342.464	3.444	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc(F)cc(Cl)c3)C2)CC1	ZINC001086945132	1359266077	/nfs/dbraw/zinc/26/60/77/1359266077.db2.gz	RZCGDMBGXJONFO-CQSZACIVSA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@H](C)Cc3cccs3)C2)CC1	ZINC001086945648	1359266851	/nfs/dbraw/zinc/26/68/51/1359266851.db2.gz	GFHYOKHXWNQWBU-SJORKVTESA-N	0	3	344.524	3.263	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@H](C)c3ccc(C)o3)C2)CC1	ZINC001086946983	1359268039	/nfs/dbraw/zinc/26/80/39/1359268039.db2.gz	NLBIEVUGCWRAOA-NVXWUHKLSA-N	0	3	328.456	3.028	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cccc4ccncc43)C2)CC1	ZINC001086952078	1359272246	/nfs/dbraw/zinc/27/22/46/1359272246.db2.gz	ZPMDNAXQGHJZHE-KRWDZBQOSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc(Cl)s3)C2)CC1	ZINC001086955160	1359275784	/nfs/dbraw/zinc/27/57/84/1359275784.db2.gz	FPDZLWKKPJKBBS-ZDUSSCGKSA-N	0	3	336.888	3.351	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)Cc3cccc(F)c3)C2)CC1	ZINC001086955864	1359276496	/nfs/dbraw/zinc/27/64/96/1359276496.db2.gz	YCTMRMMRVJKTEN-QGZVFWFLSA-N	0	3	342.458	3.095	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H](C)c3cccc(F)c3)C2)CC1	ZINC001086957286	1359278050	/nfs/dbraw/zinc/27/80/50/1359278050.db2.gz	JJWYWONSHXBTPN-IRXDYDNUSA-N	0	3	342.458	3.265	20	30		EGEDHN
CC(C)c1cccc(CNC[C@@H]2C[C@H](C)CCN2C(=O)[C@H](C)C#N)n1	ZINC001087135900	1359301848	/nfs/dbraw/zinc/30/18/48/1359301848.db2.gz	DEBYPSQVPZRGNT-NUJGCVRESA-N	0	3	342.487	3.081	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](CNCc2nc(C)sc2C)[C@H](C)C1	ZINC001184077198	1387388827	/nfs/dbraw/zinc/38/88/27/1387388827.db2.gz	HQMZROWJSBPTSB-CZUORRHYSA-N	0	3	335.517	3.300	20	30		EGEDHN
C[C@@H]1CCN(C(=O)[C@@H]2CC2(C)C)[C@H](CNCc2ccc(C#N)s2)C1	ZINC001087151075	1359308372	/nfs/dbraw/zinc/30/83/72/1359308372.db2.gz	WBEWWYXSUHIBQN-KEYYUXOJSA-N	0	3	345.512	3.383	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](CNCc2oc(CC)nc2C)[C@@H](C)C1	ZINC001184079501	1387389330	/nfs/dbraw/zinc/38/93/30/1387389330.db2.gz	WQDAQCRCQWKRHJ-HOCLYGCPSA-N	0	3	333.476	3.086	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3oc(C)cc3C)C(C)(C)[C@@H]21	ZINC001087278313	1359353946	/nfs/dbraw/zinc/35/39/46/1359353946.db2.gz	FGDFUPDXASXNHU-KBAYOESNSA-N	0	3	328.456	3.139	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(Cl)cc3F)C(C)(C)[C@H]21	ZINC001087294066	1359374084	/nfs/dbraw/zinc/37/40/84/1359374084.db2.gz	NRIMGZAEUOCFDB-OIISXLGYSA-N	0	3	348.849	3.331	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc4cc(C)ccc4[nH]3)C(C)(C)[C@@H]21	ZINC001087299666	1359381504	/nfs/dbraw/zinc/38/15/04/1359381504.db2.gz	ZVZOVPXLVFNGBI-NSISKUIASA-N	0	3	349.478	3.328	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc(F)c3F)C(C)(C)[C@@H]21	ZINC001087301073	1359384163	/nfs/dbraw/zinc/38/41/63/1359384163.db2.gz	VTAYMJHGZCWKEM-ZTFGCOKTSA-N	0	3	346.421	3.207	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc4cc[nH]c4c3)C(C)(C)[C@H]21	ZINC001087305990	1359392094	/nfs/dbraw/zinc/39/20/94/1359392094.db2.gz	BOURPVQSZBZNNW-RLLQIKCJSA-N	0	3	349.478	3.410	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)[C@H]3CC[C@H](C)CC3)C(C)(C)[C@H]21	ZINC001087314156	1359403187	/nfs/dbraw/zinc/40/31/87/1359403187.db2.gz	GKKUSPITSYENAW-NNIGNNQHSA-N	0	3	330.516	3.441	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc4ccccc4o3)C(C)(C)[C@@H]21	ZINC001087315745	1359406087	/nfs/dbraw/zinc/40/60/87/1359406087.db2.gz	HPGSVXMSSNRKNQ-ATZDWAIDSA-N	0	3	336.435	3.285	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)Cc3ccc(C)c(C)c3)C(C)(C)[C@H]21	ZINC001087316421	1359406526	/nfs/dbraw/zinc/40/65/26/1359406526.db2.gz	RHBFRJIOHJXOEW-GIVPXCGWSA-N	0	3	338.495	3.084	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc(C2CC2)cc1	ZINC001087317864	1359409405	/nfs/dbraw/zinc/40/94/05/1359409405.db2.gz	NZOXNWMOXFIRNY-HSALFYBXSA-N	0	3	336.479	3.416	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)C1CCC=CCC1	ZINC001087319982	1359412096	/nfs/dbraw/zinc/41/20/96/1359412096.db2.gz	XEKWFNYVNHWLSI-CEXWTWQISA-N	0	3	328.500	3.361	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3[C@@H](C2)[C@@H]2CC[C@H]3CN2C/C=C/Cl)C1	ZINC001087390117	1359444844	/nfs/dbraw/zinc/44/48/44/1359444844.db2.gz	VTODLRMSVGJZMX-RXLUMKSTSA-N	0	3	334.891	3.264	20	30		EGEDHN
CCCc1occc1C(=O)NCC1(NCc2cccc(C#N)c2)CC1	ZINC001323591168	1387397847	/nfs/dbraw/zinc/39/78/47/1387397847.db2.gz	GLENIGYGBYQBBG-UHFFFAOYSA-N	0	3	337.423	3.156	20	30		EGEDHN
C=CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)c2nocc2C)C1	ZINC001087441798	1359466900	/nfs/dbraw/zinc/46/69/00/1359466900.db2.gz	ZGROOJDQQQXHDI-QZTJIDSGSA-N	0	3	339.439	3.147	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(CC(C)C)cc2)[C@H]1CC	ZINC001087647531	1359569842	/nfs/dbraw/zinc/56/98/42/1359569842.db2.gz	YFEKKKIWJOUXKA-LEWJYISDSA-N	0	3	340.511	3.420	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccc(F)c(F)c2F)[C@H]1CC	ZINC001087706790	1359601875	/nfs/dbraw/zinc/60/18/75/1359601875.db2.gz	LTFWJTWKDOIMPS-UONOGXRCSA-N	0	3	326.362	3.263	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)Cc2c[nH]c3c2cccc3C)[C@H]1CC	ZINC001087749211	1359626425	/nfs/dbraw/zinc/62/64/25/1359626425.db2.gz	ZHMMSTZVTBQNQX-ZWKOTPCHSA-N	0	3	325.456	3.174	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cnc(C(C)C)nc2C)[C@H]1CC	ZINC001087750952	1359627218	/nfs/dbraw/zinc/62/72/18/1359627218.db2.gz	OBTKYJGMWSETMI-DLBZAZTESA-N	0	3	330.476	3.067	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CN(C(=O)[C@H]4CC=CCC4)C[C@@H]3C2)cc1	ZINC001087881580	1359694968	/nfs/dbraw/zinc/69/49/68/1359694968.db2.gz	JPKHAOQEILLYFQ-HBMCJLEFSA-N	0	3	349.478	3.195	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)CCc3ccc(C(C)C)cc3)C[C@@H]2C1	ZINC001088038217	1359731463	/nfs/dbraw/zinc/73/14/63/1359731463.db2.gz	BEHUXGZJMYWDTG-RTWAWAEBSA-N	0	3	338.495	3.156	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CCN(Cc3cccnc3C)C[C@H]2C1	ZINC001088064542	1359740302	/nfs/dbraw/zinc/74/03/02/1359740302.db2.gz	JXTFZGHIJQVACZ-MOPGFXCFSA-N	0	3	341.499	3.273	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3ccc(-c4ccccc4)cc3)C[C@@H]2C1	ZINC001088186986	1359786960	/nfs/dbraw/zinc/78/69/60/1359786960.db2.gz	ABKFTSINXWFLFR-YADHBBJMSA-N	0	3	344.458	3.381	20	30		EGEDHN
C=CCN1CC[C@H](OCC2CCN(C(=O)c3ccc(C)cc3)CC2)C1	ZINC001088239879	1359810979	/nfs/dbraw/zinc/81/09/79/1359810979.db2.gz	JNPJZDXZQCWBGQ-FQEVSTJZSA-N	0	3	342.483	3.124	20	30		EGEDHN
C=CCN1CC[C@H](OCC2CCN(C(=O)[C@H](C)C3CCCC3)CC2)C1	ZINC001088240427	1359812329	/nfs/dbraw/zinc/81/23/29/1359812329.db2.gz	YQUZXXWSHYVYMU-XLIONFOSSA-N	0	3	348.531	3.328	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCCCN(C(=O)C2CC(C)C2)C1	ZINC001088293887	1359828077	/nfs/dbraw/zinc/82/80/77/1359828077.db2.gz	JFMMZSJQYFKDDO-PESDSKBTSA-N	0	3	343.309	3.302	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2cc3occc3[nH]2)C1	ZINC001088323549	1359831040	/nfs/dbraw/zinc/83/10/40/1359831040.db2.gz	RVBWDOPJGPYMRI-CYBMUJFWSA-N	0	3	335.835	3.488	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2cccc3cn[nH]c32)C1	ZINC001088356949	1359841074	/nfs/dbraw/zinc/84/10/74/1359841074.db2.gz	OJIHUIFUTAIVQF-HNNXBMFYSA-N	0	3	346.862	3.290	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2cccc3c[nH]nc32)C1	ZINC001088356949	1359841075	/nfs/dbraw/zinc/84/10/75/1359841075.db2.gz	OJIHUIFUTAIVQF-HNNXBMFYSA-N	0	3	346.862	3.290	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2ccc(Cl)[nH]2)C1	ZINC001088377423	1359860374	/nfs/dbraw/zinc/86/03/74/1359860374.db2.gz	ITIPDEDXSNSMIQ-GFCCVEGCSA-N	0	3	330.259	3.395	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2cc(C)n(C)c2C)C1	ZINC001088423219	1359892679	/nfs/dbraw/zinc/89/26/79/1359892679.db2.gz	MYEYUBWGAFXRRI-INIZCTEOSA-N	0	3	337.895	3.369	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2cc3cc(Cl)ccc3o2)[C@H]1C	ZINC001088717950	1360019667	/nfs/dbraw/zinc/01/96/67/1360019667.db2.gz	IRPLBAYKMWDEEP-DOMZBBRYSA-N	0	3	330.815	3.302	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CCN(Cc3cc(C)cc(C)c3)[C@@H]2C)c1	ZINC001088846377	1360080234	/nfs/dbraw/zinc/08/02/34/1360080234.db2.gz	KULRADIIUQWYGS-UTKZUKDTSA-N	0	3	347.462	3.073	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3ccc(CC)cc3)[C@@H]2C)cn1	ZINC001088990373	1360126176	/nfs/dbraw/zinc/12/61/76/1360126176.db2.gz	RWYPJUICHCHVIZ-IERDGZPVSA-N	0	3	347.462	3.018	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCCN1C(=O)CC1CC1	ZINC001089101617	1360167478	/nfs/dbraw/zinc/16/74/78/1360167478.db2.gz	CDQJIMDTDDNSMC-IBGZPJMESA-N	0	3	325.456	3.171	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCCN1C(=O)c1cccnc1	ZINC001089105984	1360170266	/nfs/dbraw/zinc/17/02/66/1360170266.db2.gz	PJRVXRDHQWEATD-FQEVSTJZSA-N	0	3	348.450	3.080	20	30		EGEDHN
CN(Cc1ccccc1)C[C@@H]1CCCCN1C(=O)c1cc(C#N)c[nH]1	ZINC001089150612	1360206352	/nfs/dbraw/zinc/20/63/52/1360206352.db2.gz	LPLTYSPJPIZCAW-SFHVURJKSA-N	0	3	336.439	3.013	20	30		EGEDHN
CC1CC(C(=O)N2CCCC[C@H]2CN(C)Cc2ccc(C#N)cc2)C1	ZINC001089154252	1360209438	/nfs/dbraw/zinc/20/94/38/1360209438.db2.gz	ACGANFQDRVNKRE-GQOXECLESA-N	0	3	339.483	3.417	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCCC[C@H]2CN(C)Cc2ccccc2)nc1	ZINC001089253800	1360284770	/nfs/dbraw/zinc/28/47/70/1360284770.db2.gz	QSBYTWDOJDCHAJ-FQEVSTJZSA-N	0	3	347.462	3.190	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc3ccsc3[nH]2)CC(C)(C)C1	ZINC001089454453	1360441093	/nfs/dbraw/zinc/44/10/93/1360441093.db2.gz	XFNQQRCKIROENH-CQSZACIVSA-N	0	3	329.469	3.083	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@H](C)c2cccc(C)c2)CC(C)(C)C1	ZINC001089505374	1360477939	/nfs/dbraw/zinc/47/79/39/1360477939.db2.gz	FWIDFVXHVLKLSR-MJGOQNOKSA-N	0	3	326.484	3.339	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C(C)C)no2)CC(C)(C)C1	ZINC001089511182	1360482907	/nfs/dbraw/zinc/48/29/07/1360482907.db2.gz	NJQPTYJPDJXUOK-OAHLLOKOSA-N	0	3	331.460	3.042	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(C)c3c2CCC3)CC(C)(C)C1	ZINC001089565614	1360512524	/nfs/dbraw/zinc/51/25/24/1360512524.db2.gz	UOKXDZQTTUDSHG-KRWDZBQOSA-N	0	3	338.495	3.337	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(C(C)C)n(C)n1	ZINC001089638227	1360552105	/nfs/dbraw/zinc/55/21/05/1360552105.db2.gz	WGRZOVBUFLHIJN-MRXNPFEDSA-N	0	3	346.519	3.340	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccn2c(C)cnc2c1	ZINC001089641646	1360554517	/nfs/dbraw/zinc/55/45/17/1360554517.db2.gz	PXGZFXSCMAQYFZ-QGZVFWFLSA-N	0	3	340.471	3.049	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1c(F)cccc1OC	ZINC001089642547	1360555246	/nfs/dbraw/zinc/55/52/46/1360555246.db2.gz	MYWKKMFNCHGCCS-HNNXBMFYSA-N	0	3	346.446	3.078	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cn(C)nc1C1CC1	ZINC001089646490	1360558736	/nfs/dbraw/zinc/55/87/36/1360558736.db2.gz	OFAVWDJEQOUTSC-MRXNPFEDSA-N	0	3	344.503	3.094	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cccnc1C(F)F	ZINC001089667078	1360577329	/nfs/dbraw/zinc/57/73/29/1360577329.db2.gz	AMLWZBGJOYQWSE-CQSZACIVSA-N	0	3	349.425	3.263	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(C)c(OC)c1	ZINC001089668166	1360577737	/nfs/dbraw/zinc/57/77/37/1360577737.db2.gz	RKQBHAIDABHTGN-QGZVFWFLSA-N	0	3	330.472	3.410	20	30		EGEDHN
C=CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1nc2c(s1)CCC2	ZINC001089669611	1360579120	/nfs/dbraw/zinc/57/91/20/1360579120.db2.gz	PIUOQQWQXALYLB-AWEZNQCLSA-N	0	3	347.528	3.428	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cncc(CC)c1	ZINC001089670224	1360580020	/nfs/dbraw/zinc/58/00/20/1360580020.db2.gz	BHHQRIKYLZIVME-GOSISDBHSA-N	0	3	329.488	3.441	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1c(C)noc1C1CC1	ZINC001089671860	1360581962	/nfs/dbraw/zinc/58/19/62/1360581962.db2.gz	XIDYERKUSGTBPL-MRXNPFEDSA-N	0	3	343.471	3.104	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cn(C(C)C)cn1	ZINC001089674837	1360583536	/nfs/dbraw/zinc/58/35/36/1360583536.db2.gz	DZANEMGCYDELDQ-MRXNPFEDSA-N	0	3	332.492	3.261	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(OC)cc1C	ZINC001089687441	1360593511	/nfs/dbraw/zinc/59/35/11/1360593511.db2.gz	JXBZNDKJYHLREG-MRXNPFEDSA-N	0	3	330.472	3.410	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(C(F)F)n[nH]1	ZINC001089692714	1360598107	/nfs/dbraw/zinc/59/81/07/1360598107.db2.gz	AXZDTBGCLKSZDZ-LBPRGKRZSA-N	0	3	340.418	3.144	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cn(CC)nc1C	ZINC001089703657	1360606360	/nfs/dbraw/zinc/60/63/60/1360606360.db2.gz	NMBGBSITFPXGQF-MRXNPFEDSA-N	0	3	332.492	3.008	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccccc1OCC	ZINC001089728789	1360632056	/nfs/dbraw/zinc/63/20/56/1360632056.db2.gz	CVTQITWJGZHVKA-KRWDZBQOSA-N	0	3	342.483	3.329	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ncc2n1CCCC2	ZINC001089735488	1360640601	/nfs/dbraw/zinc/64/06/01/1360640601.db2.gz	MCCQNBRSOOPZIP-INIZCTEOSA-N	0	3	344.503	3.016	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)CC1CCCC1	ZINC001089762111	1360653667	/nfs/dbraw/zinc/65/36/67/1360653667.db2.gz	CNCCJMFSXLUYDA-MHORFTMASA-N	0	3	336.907	3.488	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1occc1C	ZINC001089774063	1360658606	/nfs/dbraw/zinc/65/86/06/1360658606.db2.gz	SSUKSJNDXYYDSW-JONQDZQNSA-N	0	3	334.847	3.123	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C(F)=C(C)C	ZINC001089789842	1360664493	/nfs/dbraw/zinc/66/44/93/1360664493.db2.gz	OSWXMPYAHKPYAY-XQLPTFJDSA-N	0	3	326.843	3.171	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)C23CCC(CC2)C3)C1	ZINC001089826029	1360682324	/nfs/dbraw/zinc/68/23/24/1360682324.db2.gz	FOWBOGONNSBYPL-RBTBIYCJSA-N	0	3	348.918	3.488	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](CNCc2ccn(CC)n2)[C@H](C)C1	ZINC001184473846	1387468292	/nfs/dbraw/zinc/46/82/92/1387468292.db2.gz	RXCRATOYNJSELP-IAGOWNOFSA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)C2(CC)CCC2)C1	ZINC001089852296	1360697964	/nfs/dbraw/zinc/69/79/64/1360697964.db2.gz	ZZVPUZHJJHRUQY-QAETUUGQSA-N	0	3	336.907	3.488	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](CNCc2cc(C)no2)[C@H](C)C1	ZINC001184484874	1387469184	/nfs/dbraw/zinc/46/91/84/1387469184.db2.gz	DJKXDAYCPXDOMQ-GDBMZVCRSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C2C(C)(C)C2(C)C)CC2(CCOCC2)C1	ZINC001089932692	1360750753	/nfs/dbraw/zinc/75/07/53/1360750753.db2.gz	SKBLWZBGNBVTQS-INIZCTEOSA-N	0	3	348.531	3.232	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)[C@H]2CCCC2(C)C)CC2(CCOCC2)C1	ZINC001089952031	1360761365	/nfs/dbraw/zinc/76/13/65/1360761365.db2.gz	ROFBCPQTOVVIII-ZWKOTPCHSA-N	0	3	348.531	3.376	20	30		EGEDHN
N#Cc1ccc(F)c(CNC2CC(CNC(=O)c3cccs3)C2)c1	ZINC001090910067	1360951971	/nfs/dbraw/zinc/95/19/71/1360951971.db2.gz	WPTPLYOACXRGIV-UHFFFAOYSA-N	0	3	343.427	3.057	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2c(F)cc(C)cc2F)C1	ZINC001091135203	1360996245	/nfs/dbraw/zinc/99/62/45/1360996245.db2.gz	LBFWNDKHILXEGK-UHFFFAOYSA-N	0	3	328.790	3.124	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)[C@@H]2C[C@H]2C(C)(C)C)C1	ZINC001091138978	1360997134	/nfs/dbraw/zinc/99/71/34/1360997134.db2.gz	TYHLVWVAKHHHJQ-NWINJMCUSA-N	0	3	343.309	3.062	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cccc3c2OCC3(C)C)C1	ZINC001091395127	1361079350	/nfs/dbraw/zinc/07/93/50/1361079350.db2.gz	FKJQDLJUTLETCU-UHFFFAOYSA-N	0	3	348.874	3.207	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3cc(Cl)sc3Cl)C[C@]2(C)C1	ZINC001091738449	1361202286	/nfs/dbraw/zinc/20/22/86/1361202286.db2.gz	YJUWNWAPKOKQPK-BMIGLBTASA-N	0	3	343.279	3.082	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)CCc3ccc(Cl)cc3)C[C@]2(C)C1	ZINC001091890329	1361240833	/nfs/dbraw/zinc/24/08/33/1361240833.db2.gz	QNCYFLJXDOCDGB-XLIONFOSSA-N	0	3	344.886	3.076	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CN(Cc3ncccc3C)C[C@@]2(C)C1	ZINC001091977954	1361265387	/nfs/dbraw/zinc/26/53/87/1361265387.db2.gz	CFRFCBSCLYQJCI-QMMLZNLJSA-N	0	3	341.499	3.273	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3ccc(C)c4ccccc34)C[C@]2(C)C1	ZINC001092051702	1361283312	/nfs/dbraw/zinc/28/33/12/1361283312.db2.gz	JXYADYJIAMVNND-VGSWGCGISA-N	0	3	332.447	3.175	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc(C(F)F)cc3)C[C@]2(C)C1	ZINC001092100880	1361300212	/nfs/dbraw/zinc/30/02/12/1361300212.db2.gz	CCWNOIMIDBGCGX-APWZRJJASA-N	0	3	332.394	3.041	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)NC[C@@H]1CN(CC#Cc2cccc(Cl)c2)C[C@H]1C	ZINC001092890543	1361479131	/nfs/dbraw/zinc/47/91/31/1361479131.db2.gz	ZKMVZIWWSGFELC-FXRXJOCMSA-N	0	3	344.886	3.032	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@@H](C)C2CCC2)CC1	ZINC001093373506	1361583048	/nfs/dbraw/zinc/58/30/48/1361583048.db2.gz	NTZCENCNVUZSIZ-LPHOPBHVSA-N	0	3	328.500	3.149	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3ccc4cc(C)ccc4n3)CCC[C@@H]12	ZINC001094465378	1361814454	/nfs/dbraw/zinc/81/44/54/1361814454.db2.gz	IUCSLDKMBHKLCG-IFMALSPDSA-N	0	3	347.462	3.151	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cc4c(s3)CCCC4)CCC[C@@H]12	ZINC001094571265	1361864969	/nfs/dbraw/zinc/86/49/69/1361864969.db2.gz	BLIMCKZPUJDIJX-UYAOXDASSA-N	0	3	342.508	3.235	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1C[C@H]2C[C@@H](C1)N(C(=O)C=C1CCC1)C2	ZINC001094895030	1361936670	/nfs/dbraw/zinc/93/66/70/1361936670.db2.gz	WPWZZNXRWBJSSN-VDGAXYAQSA-N	0	3	335.451	3.138	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cccc(OCCC)c1)C2	ZINC001095495402	1362156741	/nfs/dbraw/zinc/15/67/41/1362156741.db2.gz	OOCSDOSBOWSEIY-NEWSRXKRSA-N	0	3	328.456	3.387	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccc(F)cc1F)C2	ZINC001095803677	1362236044	/nfs/dbraw/zinc/23/60/44/1362236044.db2.gz	ZXVWPRCQTVTABU-AYTJEOJGSA-N	0	3	346.421	3.366	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H]1C[C@H]1c1c(F)cccc1F)C2	ZINC001095986650	1362323949	/nfs/dbraw/zinc/32/39/49/1362323949.db2.gz	SXYJYZHFSMELNQ-QVXTZCDOSA-N	0	3	346.421	3.366	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](CNCc2nccs2)[C@H](C)C1	ZINC001184943915	1387566903	/nfs/dbraw/zinc/56/69/03/1387566903.db2.gz	BIGIHYURFAMFCZ-SJORKVTESA-N	0	3	347.528	3.301	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C1(c3ccc(Cl)cc3)CC1)C2	ZINC001096491019	1362535278	/nfs/dbraw/zinc/53/52/78/1362535278.db2.gz	WVZBIBDRPBPYAA-SQNIBIBYSA-N	0	3	342.870	3.116	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](CNCc2cc(C3CC3)no2)[C@H](C)C1	ZINC001185062053	1387605333	/nfs/dbraw/zinc/60/53/33/1387605333.db2.gz	QHXNQGYUSDKMPH-WBVHZDCISA-N	0	3	345.487	3.483	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1cccc3ncccc13)C2	ZINC001097522255	1363037182	/nfs/dbraw/zinc/03/71/82/1363037182.db2.gz	LYYIEPDRTSLIIP-AHRSYUTCSA-N	0	3	335.451	3.075	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1cccc(C(F)F)c1)C2	ZINC001097521924	1363037208	/nfs/dbraw/zinc/03/72/08/1363037208.db2.gz	FEPHAAQMCUIDFH-ZACQAIPSSA-N	0	3	334.410	3.464	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(Cl)c(OC)c1)C2	ZINC001097979496	1363187395	/nfs/dbraw/zinc/18/73/95/1363187395.db2.gz	ZJQRIFMPTILXKT-BMFZPTHFSA-N	0	3	334.847	3.260	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(OCC(C)C)cc1)C2	ZINC001098329038	1363300188	/nfs/dbraw/zinc/30/01/88/1363300188.db2.gz	NDJZIRHNGFYSBX-RLLQIKCJSA-N	0	3	340.467	3.080	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(OC)c(Cl)c1)C2	ZINC001098350467	1363305720	/nfs/dbraw/zinc/30/57/20/1363305720.db2.gz	GIMUBCQZMBAPMQ-BMFZPTHFSA-N	0	3	334.847	3.260	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@H]1C=CCCC1)C[C@@H](C)O2	ZINC001098604814	1363395787	/nfs/dbraw/zinc/39/57/87/1363395787.db2.gz	BOMBBANZOWZJSI-MSOLQXFVSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccc(C)c(F)c1)C[C@H](C)O2	ZINC001098615842	1363399939	/nfs/dbraw/zinc/39/99/39/1363399939.db2.gz	CMTBHGZYZFXKDI-INIZCTEOSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1cc(C)cc(C)c1)C[C@H](C)O2	ZINC001098659643	1363423002	/nfs/dbraw/zinc/42/30/02/1363423002.db2.gz	LNEAPUTVICUQDN-SFHVURJKSA-N	0	3	342.483	3.185	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1CC(C(C)(C)C)C1)C[C@@H](C)O2	ZINC001098662806	1363425031	/nfs/dbraw/zinc/42/50/31/1363425031.db2.gz	MJJYLAAKCNUQDV-WWDZGPRUSA-N	0	3	348.531	3.327	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3CCC[C@]3(NC(=O)[C@H]3CC=CCC3)C2)cc1	ZINC001098725737	1363451015	/nfs/dbraw/zinc/45/10/15/1363451015.db2.gz	MRKUUROQOOCGNE-ONTIZHBOSA-N	0	3	349.478	3.385	20	30		EGEDHN
C[C@@H](C(=O)N[C@]12CCC[C@H]1CN(Cc1cccc(C#N)c1)C2)C1CC1	ZINC001098775909	1363464317	/nfs/dbraw/zinc/46/43/17/1363464317.db2.gz	GXCRDVHTYYXTGM-JJXUHFIVSA-N	0	3	337.467	3.075	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)C1CCCCC1	ZINC001098854874	1363493075	/nfs/dbraw/zinc/49/30/75/1363493075.db2.gz	CLRLRXDTVDPDCO-GOSISDBHSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cccc(OCCC)c2)C1	ZINC001098860853	1363495217	/nfs/dbraw/zinc/49/52/17/1363495217.db2.gz	FJZYMNAFJOSHEV-PXNSSMCTSA-N	0	3	328.456	3.246	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2coc3ccc(OC)cc32)C1	ZINC001098936447	1363528956	/nfs/dbraw/zinc/52/89/56/1363528956.db2.gz	HCTPHYZDHGCYQJ-XOBRGWDASA-N	0	3	340.423	3.212	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc3c(ccc(C)c3C)[nH]2)C1	ZINC001098975221	1363548863	/nfs/dbraw/zinc/54/88/63/1363548863.db2.gz	OYGPQCJTLZUPTC-JTSKRJEESA-N	0	3	349.478	3.392	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H](C)c2ccc(C)s2)C1	ZINC001099120103	1363633802	/nfs/dbraw/zinc/63/38/02/1363633802.db2.gz	ZRTHMOIGEOHKGA-BXWFABGCSA-N	0	3	330.497	3.154	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H]1CCCC12CC2	ZINC001099121712	1363635521	/nfs/dbraw/zinc/63/55/21/1363635521.db2.gz	NMPRVQSARGDVFN-ROUUACIJSA-N	0	3	348.531	3.376	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)Cc2ccc3ccccc3c2)C1	ZINC001099154209	1363660254	/nfs/dbraw/zinc/66/02/54/1363660254.db2.gz	WEWVESBIEVPUQM-GMAHTHKFSA-N	0	3	346.474	3.376	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(C)c(F)c(C)c2)C1	ZINC001099166857	1363666687	/nfs/dbraw/zinc/66/66/87/1363666687.db2.gz	ODXXGBAMPYBCIA-PXNSSMCTSA-N	0	3	328.431	3.050	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)C/C=C(/C)C=C	ZINC001099182548	1363678380	/nfs/dbraw/zinc/67/83/80/1363678380.db2.gz	MDRSFGJLYARXPT-ZKLMEHKCSA-N	0	3	334.504	3.318	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2ccc(C)s2)C[C@H]1C(F)(F)F	ZINC001099203972	1363691206	/nfs/dbraw/zinc/69/12/06/1363691206.db2.gz	QFVDANAMZSMKBJ-VXGBXAGGSA-N	0	3	332.391	3.225	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)COCc1ccccc1C	ZINC001099263693	1363721464	/nfs/dbraw/zinc/72/14/64/1363721464.db2.gz	IKAJCWFYZHNMLD-LJQANCHMSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2ccn(C(C)C)c2C)C[C@H]1C(F)(F)F	ZINC001099294961	1363736745	/nfs/dbraw/zinc/73/67/45/1363736745.db2.gz	IUCNMXVASSMXJI-HUUCEWRRSA-N	0	3	343.393	3.156	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)Cc1cc(C)ccc1F	ZINC001099309903	1363742223	/nfs/dbraw/zinc/74/22/23/1363742223.db2.gz	GVCMAYSAMRUMBR-KRWDZBQOSA-N	0	3	332.463	3.469	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2cc(C)cc(C)c2)C[C@H]1C(F)(F)F	ZINC001099337393	1363757757	/nfs/dbraw/zinc/75/77/57/1363757757.db2.gz	UHLHGKBTFPPUTH-HUUCEWRRSA-N	0	3	326.362	3.082	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2cc(C)ccc2C)C[C@H]1C(F)(F)F	ZINC001099336986	1363757911	/nfs/dbraw/zinc/75/79/11/1363757911.db2.gz	CFBLFDFIPJLCJH-HZPDHXFCSA-N	0	3	340.389	3.472	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2ccoc2C(C)C)C[C@H]1C(F)(F)F	ZINC001099347314	1363763553	/nfs/dbraw/zinc/76/35/53/1363763553.db2.gz	CAYPPCOFRKJDEX-CHWSQXEVSA-N	0	3	330.350	3.182	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2ccc(CF)cc2)C[C@H]1C(F)(F)F	ZINC001099347425	1363764126	/nfs/dbraw/zinc/76/41/26/1363764126.db2.gz	JOJONKQNTILJDP-HUUCEWRRSA-N	0	3	344.352	3.325	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2cc(C)no2)C1	ZINC001099488720	1363817273	/nfs/dbraw/zinc/81/72/73/1363817273.db2.gz	PYAMICUMKLENME-DBVUQKKJSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)CCC(C)(F)F	ZINC001099496177	1363821129	/nfs/dbraw/zinc/82/11/29/1363821129.db2.gz	INNIFWQQILUIGP-XGUBFFRZSA-N	0	3	346.849	3.343	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1(CCC)CC1	ZINC001099529695	1363834411	/nfs/dbraw/zinc/83/44/11/1363834411.db2.gz	UYYCZLPDKDPJDV-HZMVEIRTSA-N	0	3	336.907	3.488	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C[C@H](C)CCC)CC2(CCOCC2)C1	ZINC001099572307	1363856882	/nfs/dbraw/zinc/85/68/82/1363856882.db2.gz	VCRPIVNTNDKZDK-MSOLQXFVSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1CN(CC(=C)C)CC2(CCOCC2)C1	ZINC001099582862	1363864337	/nfs/dbraw/zinc/86/43/37/1363864337.db2.gz	CWBAIJYSZQXSAZ-QGZVFWFLSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)[C@@H](C)C(C)(C)C)CC2(CCOCC2)C1	ZINC001099583320	1363864473	/nfs/dbraw/zinc/86/44/73/1363864473.db2.gz	NZFCBVVLYYZVAE-SJORKVTESA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)[C@H](C)C(CC)CC)CC2(CCOCC2)C1	ZINC001099583581	1363865794	/nfs/dbraw/zinc/86/57/94/1363865794.db2.gz	VLTFNLOJBWVCAP-AEFFLSMTSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H]2CN(CC(=C)C)CC3(CCOCC3)C2)CC1	ZINC001099590431	1363871909	/nfs/dbraw/zinc/87/19/09/1363871909.db2.gz	AJMFJPDAUOPPNB-GOSISDBHSA-N	0	3	346.515	3.296	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)[C@](C)(CC)CCC)CC2(CCOCC2)C1	ZINC001099594651	1363877054	/nfs/dbraw/zinc/87/70/54/1363877054.db2.gz	IIEWVTBAJYGPSS-AZUAARDMSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)[C@H](CC)CCC)CC2(CCOCC2)C1	ZINC001099594934	1363877142	/nfs/dbraw/zinc/87/71/42/1363877142.db2.gz	OGQLDDHHYLGVFN-QZTJIDSGSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)[C@H](C)CC(C)C)CC2(CCOCC2)C1	ZINC001099594728	1363877375	/nfs/dbraw/zinc/87/73/75/1363877375.db2.gz	JRMBVZAXWWSPDM-QZTJIDSGSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCCC(=O)NCC1CC(N[C@@H]2CCc3c2c(F)ccc3F)C1	ZINC001100176968	1364036438	/nfs/dbraw/zinc/03/64/38/1364036438.db2.gz	OPFOCHLAHOQJBE-QWQCLYJRSA-N	0	3	334.410	3.403	20	30		EGEDHN
CC(C)[C@H](C)CC(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1	ZINC001100178498	1364036723	/nfs/dbraw/zinc/03/67/23/1364036723.db2.gz	OBSKMOYOUYNALQ-MXWWQKGMSA-N	0	3	345.462	3.364	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](CNCc2ccn(CC)n2)[C@@H](C)C1	ZINC001185223987	1387656339	/nfs/dbraw/zinc/65/63/39/1387656339.db2.gz	CEIWVWVRRZMMNT-IRXDYDNUSA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NCC1CC(NCc2ccccc2F)C1)OCC	ZINC001100376779	1364096324	/nfs/dbraw/zinc/09/63/24/1364096324.db2.gz	YVIGXXLNLHVPNI-KVWWFHCMSA-N	0	3	348.462	3.181	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C/C=C\c2ccc(F)cc2)C1	ZINC001100441161	1364115974	/nfs/dbraw/zinc/11/59/74/1364115974.db2.gz	GHCMTXNRSDAMIL-IHWYPQMZSA-N	0	3	336.838	3.466	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC1CC(NCc2cc(F)ccc2OC)C1	ZINC001100568270	1364165793	/nfs/dbraw/zinc/16/57/93/1364165793.db2.gz	ZDMSSLIMVCPXSW-UHFFFAOYSA-N	0	3	348.462	3.421	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCC1CC(NCc2c(C)onc2CC)C1	ZINC001100596633	1364180790	/nfs/dbraw/zinc/18/07/90/1364180790.db2.gz	XCWIYDONKHCDRC-QQFBHYJXSA-N	0	3	333.476	3.132	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCC1CC(NCc2c(C)onc2CC)C1	ZINC001100596632	1364180884	/nfs/dbraw/zinc/18/08/84/1364180884.db2.gz	XCWIYDONKHCDRC-FHERZECASA-N	0	3	333.476	3.132	20	30		EGEDHN
C=CCCC1(C(=O)NCC2CC(NCc3c(C)noc3C)C2)CC1	ZINC001100642639	1364201079	/nfs/dbraw/zinc/20/10/79/1364201079.db2.gz	IGOFQXBKSWMJKT-UHFFFAOYSA-N	0	3	331.460	3.022	20	30		EGEDHN
C=CCCC1(C(=O)NCC2CC(NCc3c(C)noc3CC)C2)CC1	ZINC001100643737	1364201606	/nfs/dbraw/zinc/20/16/06/1364201606.db2.gz	MGQBZUQSHXJDNV-UHFFFAOYSA-N	0	3	345.487	3.276	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC1CC(NCc2oc(CC)nc2C)C1	ZINC001100644777	1364202292	/nfs/dbraw/zinc/20/22/92/1364202292.db2.gz	HOPJMJYEUSDARL-ZOJXTTQQSA-N	0	3	333.476	3.132	20	30		EGEDHN
C=CCC1(C(=O)NCC2CC(NCc3c(C)onc3CC)C2)CCC1	ZINC001100648771	1364204422	/nfs/dbraw/zinc/20/44/22/1364204422.db2.gz	YQYZSLLLQXWGOW-UHFFFAOYSA-N	0	3	345.487	3.276	20	30		EGEDHN
C=CC1(CC(=O)NCC2CC(NCc3conc3C)C2)CCCCC1	ZINC001100749483	1364246076	/nfs/dbraw/zinc/24/60/76/1364246076.db2.gz	AQNGQDOZODNHLA-UHFFFAOYSA-N	0	3	345.487	3.494	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)[C@@H](CC)CCC)C1	ZINC001100798189	1364266404	/nfs/dbraw/zinc/26/64/04/1364266404.db2.gz	UMXAJZNLVQITCJ-MOKVOYLWSA-N	0	3	331.298	3.206	20	30		EGEDHN
CCC[C@H](CC)C(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100797974	1364266553	/nfs/dbraw/zinc/26/65/53/1364266553.db2.gz	NDBNPTYWURITKY-FDYSRKEFSA-N	0	3	344.474	3.488	20	30		EGEDHN
C#CCC1(C(=O)NCC2CC(NCc3ccccn3)C2)CCCCC1	ZINC001101055190	1364393916	/nfs/dbraw/zinc/39/39/16/1364393916.db2.gz	MOVRIWZTWJCDIM-UHFFFAOYSA-N	0	3	339.483	3.040	20	30		EGEDHN
C=C(C)CCC(=O)NCc1cc(O[C@H]2CCN(CC(=C)C)C2)ccn1	ZINC001101093578	1364410354	/nfs/dbraw/zinc/41/03/54/1364410354.db2.gz	DZNXZJSMYLGTLC-IBGZPJMESA-N	0	3	343.471	3.083	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1C[C@H]2CN(Cc3ccsc3)C[C@@]2(C)C1	ZINC001101162011	1364439934	/nfs/dbraw/zinc/43/99/34/1364439934.db2.gz	ZXPUAZYDFNNGLJ-WDYCEAGBSA-N	0	3	348.512	3.010	20	30		EGEDHN
Cc1cc(F)ccc1CN1C[C@@H]2CN(C(=O)C#CC(C)C)C[C@]2(C)C1	ZINC001101229856	1364475947	/nfs/dbraw/zinc/47/59/47/1364475947.db2.gz	NMZDRJOHZOCKNT-NQIIRXRSSA-N	0	3	342.458	3.074	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@H]2CN([C@H](C)c3ccccc3F)C[C@@]2(C)C1	ZINC001101231327	1364477155	/nfs/dbraw/zinc/47/71/55/1364477155.db2.gz	XZGYIGBXEPNJBF-LZJOCLMNSA-N	0	3	342.458	3.326	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@H]2CN(Cc3oc(CC)nc3C)C[C@@]2(C)C1	ZINC001101254492	1364487832	/nfs/dbraw/zinc/48/78/32/1364487832.db2.gz	UORCSDJIMQAYCB-UZLBHIALSA-N	0	3	345.487	3.182	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C3(CC(C)C)CCCC3)C[C@]2(C)C1	ZINC001101395940	1364544560	/nfs/dbraw/zinc/54/45/60/1364544560.db2.gz	YTUXIFAUXWUNFO-QUCCMNQESA-N	0	3	330.516	3.397	20	30		EGEDHN
C=CCC[C@@H](C)N1CC2(C1)C[C@H](NC(=O)C(C)(C)CC)c1nccn12	ZINC001101642938	1364667103	/nfs/dbraw/zinc/66/71/03/1364667103.db2.gz	QFMNPJBCQKEQIZ-CVEARBPZSA-N	0	3	344.503	3.246	20	30		EGEDHN
CC[C@@H](C)C(=O)NC[C@@H]1CN(CC#Cc2ccc(Cl)cc2)C[C@H]1C	ZINC001101730075	1364706317	/nfs/dbraw/zinc/70/63/17/1364706317.db2.gz	NXUMURLULCRENB-JFIYKMOQSA-N	0	3	346.902	3.422	20	30		EGEDHN
CC/C=C(\C)C(=O)NC[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1C	ZINC001101777850	1364722858	/nfs/dbraw/zinc/72/28/58/1364722858.db2.gz	QYFKEUZWBJQFBD-ISXDEVHMSA-N	0	3	343.446	3.238	20	30		EGEDHN
CC[C@H](C)CC(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001101918389	1364774246	/nfs/dbraw/zinc/77/42/46/1364774246.db2.gz	RMPJKMVUHWKEIE-RRFJBIMHSA-N	0	3	333.501	3.240	20	30		EGEDHN
CC/C(C)=C/C(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001101943458	1364784323	/nfs/dbraw/zinc/78/43/23/1364784323.db2.gz	VNCRFSABMPGJQQ-PHIGAYBXSA-N	0	3	331.485	3.160	20	30		EGEDHN
Cc1ccc(CN2C[C@@H](CNC(=O)C#CC(C)C)[C@H](C)C2)c(Cl)c1	ZINC001101947822	1364786663	/nfs/dbraw/zinc/78/66/63/1364786663.db2.gz	JKBHJPOYMOQOCE-SJLPKXTDSA-N	0	3	346.902	3.492	20	30		EGEDHN
C=C/C(C)=C/CC(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C	ZINC001102244734	1364959684	/nfs/dbraw/zinc/95/96/84/1364959684.db2.gz	PLNHDLYYVQSYKO-PABPUJONSA-N	0	3	336.479	3.245	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@@H]1CN(Cc2oc(C)nc2C)C[C@H]1C	ZINC001102260771	1364973505	/nfs/dbraw/zinc/97/35/05/1364973505.db2.gz	CQUFFHLFIWKEIE-JJRVBVJISA-N	0	3	333.476	3.078	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1CCNC(=O)C1CCCC1	ZINC001102633313	1365145152	/nfs/dbraw/zinc/14/51/52/1365145152.db2.gz	LLLWQBSSMWRORZ-VQIMIIECSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](NCc3ccccc3N(C)C)C2)CCC1	ZINC001185463512	1387722007	/nfs/dbraw/zinc/72/20/07/1387722007.db2.gz	UUGCIPPQQSELAQ-GOSISDBHSA-N	0	3	341.499	3.190	20	30		EGEDHN
C=CCCC(=O)NCC[C@@H]1CN(Cc2nc3ccccc3o2)C[C@H]1C	ZINC001102760319	1365205821	/nfs/dbraw/zinc/20/58/21/1365205821.db2.gz	PHKVNLMXZUBPIF-HZPDHXFCSA-N	0	3	341.455	3.368	20	30		EGEDHN
C#CCCCCCC(=O)NCC[C@@H]1CN(Cc2cnc(C)o2)C[C@H]1C	ZINC001103312025	1365487587	/nfs/dbraw/zinc/48/75/87/1365487587.db2.gz	XKYSWFGGPDZVMY-SJLPKXTDSA-N	0	3	345.487	3.141	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCC[C@@H]1CN(Cc2cnc(C)o2)C[C@H]1C	ZINC001103346144	1365511191	/nfs/dbraw/zinc/51/11/91/1365511191.db2.gz	FSDZYHWYFZVFEP-DJIMGWMZSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)Cc2ccc(F)cc2)C1	ZINC001103689286	1365728976	/nfs/dbraw/zinc/72/89/76/1365728976.db2.gz	ZXUBBTSSESKGKI-CZUORRHYSA-N	0	3	338.854	3.195	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)Cc2ccsc2)C[C@H]1C	ZINC001103841169	1365808874	/nfs/dbraw/zinc/80/88/74/1365808874.db2.gz	SAIQROQKVUDJTE-IUODEOHRSA-N	0	3	326.893	3.117	20	30		EGEDHN
C#CCCCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2ocnc2C)C1	ZINC001104495286	1366048355	/nfs/dbraw/zinc/04/83/55/1366048355.db2.gz	BCCYPAKBAIGNIO-SJLPKXTDSA-N	0	3	345.487	3.141	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](C)[C@H](CCN[C@@H](C)c2cnc(C)cn2)C1	ZINC001104606704	1366098488	/nfs/dbraw/zinc/09/84/88/1366098488.db2.gz	BJLKHCROZJVHFG-BPQIPLTHSA-N	0	3	344.503	3.277	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H](C)[C@H](CCNCc2ccn(CC)n2)C1	ZINC001104631505	1366109998	/nfs/dbraw/zinc/10/99/98/1366109998.db2.gz	PWGHNDQJSKAOCK-MBOZVWFJSA-N	0	3	346.519	3.080	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](C)[C@H](CCNCc3cnc(C)o3)C2)CCC1	ZINC001104639581	1366114757	/nfs/dbraw/zinc/11/47/57/1366114757.db2.gz	SNQGJSJKHLIEHD-NVXWUHKLSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)C2(C(C)(F)F)CC2)C[C@H]1C	ZINC001104688786	1366131369	/nfs/dbraw/zinc/13/13/69/1366131369.db2.gz	AFDSXTSJWHKSNC-DGCLKSJQSA-N	0	3	334.838	3.249	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)CC[C@H]2CCCOC2)C[C@H]1C	ZINC001104850759	1366199368	/nfs/dbraw/zinc/19/93/68/1366199368.db2.gz	LZIJBOWDRPHLJE-DJIMGWMZSA-N	0	3	342.911	3.020	20	30		EGEDHN
CCN1CCN(c2cc(C)c(C#N)c3nc4ccccc4n32)C[C@H]1C	ZINC001185818694	1387808045	/nfs/dbraw/zinc/80/80/45/1387808045.db2.gz	BDZJPWJDSSKOHN-OAHLLOKOSA-N	0	3	333.439	3.198	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@H](C)CC(=C)C)CC1	ZINC001105394039	1366442491	/nfs/dbraw/zinc/44/24/91/1366442491.db2.gz	NFUWPIINAIFISH-MJGOQNOKSA-N	0	3	328.500	3.315	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H](CNCc2csc(CC)n2)[C@H](C)C1	ZINC001106710318	1366777796	/nfs/dbraw/zinc/77/77/96/1366777796.db2.gz	GGIMPPGHZOIMKS-HUUCEWRRSA-N	0	3	349.544	3.492	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC[C@]12CCC[C@H]1N(C/C=C\Cl)CC2	ZINC001107318622	1366925404	/nfs/dbraw/zinc/92/54/04/1366925404.db2.gz	SFIFLZHNLUCGFA-CCZRXCACSA-N	0	3	340.895	3.081	20	30		EGEDHN
CC(C)[C@H](C)CC(=O)N1CC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001189326035	1366992309	/nfs/dbraw/zinc/99/23/09/1366992309.db2.gz	CJQCRUUIAQWCDS-APWZRJJASA-N	0	3	327.472	3.273	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@]12CCC[C@H]1N(Cc1ocnc1C)CC2	ZINC001107514541	1367012370	/nfs/dbraw/zinc/01/23/70/1367012370.db2.gz	LDPTXTLIHRJONP-XFQXTVEOSA-N	0	3	345.487	3.446	20	30		EGEDHN
CCCC(CCC)C(=O)NC[C@]12CCC[C@H]1N(CC#CCOC)CC2	ZINC001107522541	1367016848	/nfs/dbraw/zinc/01/68/48/1367016848.db2.gz	HFGTXPQALQSFSX-TZIWHRDSSA-N	0	3	348.531	3.213	20	30		EGEDHN
CCC[C@](C)(CC)C(=O)NC[C@]12CCC[C@H]1N(CC#CCOC)CC2	ZINC001107591074	1367061587	/nfs/dbraw/zinc/06/15/87/1367061587.db2.gz	RGZJQXFQYGMBDR-HLAWJBBLSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CC1CC(F)(F)C1	ZINC001109343057	1367070601	/nfs/dbraw/zinc/07/06/01/1367070601.db2.gz	IFTUCVGRLAUGRR-ILXRZTDVSA-N	0	3	326.431	3.356	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](N(C)CCc2ccccc2F)C1	ZINC001189744558	1367100536	/nfs/dbraw/zinc/10/05/36/1367100536.db2.gz	VIFNNLMVHOENEU-GOSISDBHSA-N	0	3	330.447	3.095	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2ccccc2C)C1	ZINC001107706740	1367113340	/nfs/dbraw/zinc/11/33/40/1367113340.db2.gz	XKRKFQMAKQSWGR-FXAWDEMLSA-N	0	3	330.472	3.170	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C1(CC)CCC(F)(F)CC1)C2	ZINC001109462973	1367136331	/nfs/dbraw/zinc/13/63/31/1367136331.db2.gz	UNPDTVBSDQOQQW-PMPSAXMXSA-N	0	3	338.442	3.337	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@H](N(C)[C@@H]2CCc3c2cc(F)cc3F)C1	ZINC001190045682	1367159303	/nfs/dbraw/zinc/15/93/03/1367159303.db2.gz	AQWJYUZQBIMQNV-HNAYVOBHSA-N	0	3	346.421	3.144	20	30		EGEDHN
Cc1ccc(F)cc1CN(C)[C@H]1CCN(C(=O)C#CC(C)(C)C)C1	ZINC001190075728	1367165844	/nfs/dbraw/zinc/16/58/44/1367165844.db2.gz	DGGISOXEHSMVAG-SFHVURJKSA-N	0	3	330.447	3.216	20	30		EGEDHN
CN(Cc1cccc(Cl)c1)[C@H]1CCN(C(=O)C#CC(C)(C)C)C1	ZINC001190076299	1367167143	/nfs/dbraw/zinc/16/71/43/1367167143.db2.gz	OLWAEYGBEHTGJB-KRWDZBQOSA-N	0	3	332.875	3.422	20	30		EGEDHN
CN(CCOC1CCCCCC1)[C@H]1CCN(C(=O)C#CC(C)(C)C)C1	ZINC001190084952	1367169493	/nfs/dbraw/zinc/16/94/93/1367169493.db2.gz	UTPDEUVORURZTH-SFHVURJKSA-N	0	3	348.531	3.308	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2ccsc2C)C1	ZINC001107930039	1367207317	/nfs/dbraw/zinc/20/73/17/1367207317.db2.gz	CKPDXVDWYVZSBJ-KBXCAEBGSA-N	0	3	336.501	3.232	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)[C@@H](CC)CCCCC)[C@@H]2C1	ZINC001190290622	1367219837	/nfs/dbraw/zinc/21/98/37/1367219837.db2.gz	OJJFMAZTXITVPV-GBESFXJTSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)CCCC3CCCC3)[C@@H]2C1	ZINC001190394485	1367251933	/nfs/dbraw/zinc/25/19/33/1367251933.db2.gz	PVMQDUJBMBGTGW-RBUKOAKNSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](N(C)Cc2ccc3c(c2)COC3)C1	ZINC001190397731	1367252717	/nfs/dbraw/zinc/25/27/17/1367252717.db2.gz	OARJOMCJEJTPOC-LJQANCHMSA-N	0	3	342.483	3.352	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)CCCCc3ccc(C)cc3)[C@@H]2C1	ZINC001190449902	1367268523	/nfs/dbraw/zinc/26/85/23/1367268523.db2.gz	IWJPBHKFNAJXCS-VQTJNVASSA-N	0	3	326.484	3.427	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCc1scnc1C	ZINC001109683258	1367280986	/nfs/dbraw/zinc/28/09/86/1367280986.db2.gz	DQZWVOAFBSSLFW-DRMAHVMPSA-N	0	3	347.528	3.318	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@@]1(C)CN(CC(CC)CC)CCO1	ZINC001108121935	1367292435	/nfs/dbraw/zinc/29/24/35/1367292435.db2.gz	JKSIPTUPZSIUHS-FQEVSTJZSA-N	0	3	336.520	3.213	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@H](N(C)Cc3ccc(C)c(F)c3)C2)CCC1	ZINC001190605768	1367305883	/nfs/dbraw/zinc/30/58/83/1367305883.db2.gz	ZRZGARYQWCHNPV-SFHVURJKSA-N	0	3	342.458	3.360	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CC1CCCCCC1)C2	ZINC001109762900	1367308567	/nfs/dbraw/zinc/30/85/67/1367308567.db2.gz	GOSOUUJZKAEGAM-QYZOEREBSA-N	0	3	334.504	3.271	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@]2(C)CN(CC3CC(C)(C)C3)CCO2)CC1	ZINC001108185801	1367329209	/nfs/dbraw/zinc/32/92/09/1367329209.db2.gz	FLADXMGUIWKOEE-OAQYLSRUSA-N	0	3	348.531	3.376	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](CC)Cc1cccc(C)c1)C2	ZINC001109806548	1367333266	/nfs/dbraw/zinc/33/32/66/1367333266.db2.gz	HJGLFLZCMZHZRV-WOZUAGRISA-N	0	3	338.495	3.309	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CC1(C=C)CCCCC1)C2	ZINC001109829962	1367344958	/nfs/dbraw/zinc/34/49/58/1367344958.db2.gz	FIPGCHQZDKFMMN-QYZOEREBSA-N	0	3	346.515	3.437	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCN(C(=O)CCC(C)(F)F)C1	ZINC001190973247	1367392709	/nfs/dbraw/zinc/39/27/09/1367392709.db2.gz	LKJFSFCYPADHAJ-INIZCTEOSA-N	0	3	335.398	3.026	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2cccc(C)c2C)C1	ZINC001108374379	1367422402	/nfs/dbraw/zinc/42/24/02/1367422402.db2.gz	KQYGPXIIGYWOOR-LAUBAEHRSA-N	0	3	344.499	3.479	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)Cc2ccccc2C)C1	ZINC001108390072	1367431611	/nfs/dbraw/zinc/43/16/11/1367431611.db2.gz	SJMGJSGNFUYCQU-GHTZIAJQSA-N	0	3	344.499	3.099	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N1CC[C@H](N(C)Cc2cccc(F)c2)C1	ZINC001191577042	1367532364	/nfs/dbraw/zinc/53/23/64/1367532364.db2.gz	OZNCSGUKQYPPBZ-AZUAARDMSA-N	0	3	348.462	3.087	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](C)CCCc1ccccc1)C2	ZINC001110172515	1367543608	/nfs/dbraw/zinc/54/36/08/1367543608.db2.gz	AIALQLOBUFJOHK-PBASOCQRSA-N	0	3	338.495	3.390	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001191727354	1367572020	/nfs/dbraw/zinc/57/20/20/1367572020.db2.gz	JPXYVARVCYCWIM-HXUWFJFHSA-N	0	3	337.467	3.175	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](N(C)Cc2cccc(OC)c2)C1	ZINC001191754795	1367578406	/nfs/dbraw/zinc/57/84/06/1367578406.db2.gz	TWOGQOMLUITMII-LJQANCHMSA-N	0	3	342.483	3.312	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](N(C)Cc2ccc(CF)cc2)C1	ZINC001191837823	1367608708	/nfs/dbraw/zinc/60/87/08/1367608708.db2.gz	FDLREZOCLKZAGA-LJQANCHMSA-N	0	3	330.447	3.382	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](N(C)CCOc2ccc(C)cc2)C1	ZINC001191867790	1367620478	/nfs/dbraw/zinc/62/04/78/1367620478.db2.gz	IQQCIINRHMFVPH-IBGZPJMESA-N	0	3	342.483	3.100	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](N(C)CCOC2CCCCCC2)C1	ZINC001191868636	1367622069	/nfs/dbraw/zinc/62/20/69/1367622069.db2.gz	XIDXWDWFPQCJGL-IBGZPJMESA-N	0	3	348.531	3.452	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](N(C)CCc2c(F)cccc2F)C1	ZINC001192094023	1367686346	/nfs/dbraw/zinc/68/63/46/1367686346.db2.gz	PAWAUEHYPWERHS-HNNXBMFYSA-N	0	3	336.426	3.396	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](N(C)CCOCCC(C)C)C2)CC1	ZINC001192181612	1367710029	/nfs/dbraw/zinc/71/00/29/1367710029.db2.gz	WSPQJLTWHQNWJJ-IBGZPJMESA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](N(C)C[C@@H]3CC(C)(C)CO3)C2)CCC1	ZINC001192227557	1367724698	/nfs/dbraw/zinc/72/46/98/1367724698.db2.gz	SBQVXLDFJIGXCT-IRXDYDNUSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](N(C)CCOc3cccc(C)c3)C2)C1	ZINC001192257315	1367732842	/nfs/dbraw/zinc/73/28/42/1367732842.db2.gz	MKZDPJBBIBADJY-SFHVURJKSA-N	0	3	342.483	3.263	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)C[C@H](C)c2cccc(F)c2)C1	ZINC001192282482	1367738522	/nfs/dbraw/zinc/73/85/22/1367738522.db2.gz	AFYRNRSHIDXKLR-QFBILLFUSA-N	0	3	348.462	3.055	20	30		EGEDHN
O=C(C#CC1CC1)N[C@@H]1C[C@H]2CC[C@@H]1N2CC/C=C\c1ccccc1	ZINC001110540310	1367819449	/nfs/dbraw/zinc/81/94/49/1367819449.db2.gz	MSZNRUUYBHACQM-NQVRPCMVSA-N	0	3	334.463	3.225	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)[C@@H](C)c2ccc(CC)cc2)C1	ZINC001192875745	1367893741	/nfs/dbraw/zinc/89/37/41/1367893741.db2.gz	DXLKPPBNSAHGQL-PXNSSMCTSA-N	0	3	344.499	3.088	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)C[C@@H](CC)c2ccccc2)C1	ZINC001193434244	1368030754	/nfs/dbraw/zinc/03/07/54/1368030754.db2.gz	XUOCZPPLLSROCS-UYAOXDASSA-N	0	3	344.499	3.306	20	30		EGEDHN
C=CCC[C@@H](C)N1[C@@H]2CC[C@H]1[C@H](NC(=O)c1nc(Cl)cs1)C2	ZINC001110940853	1368109404	/nfs/dbraw/zinc/10/94/04/1368109404.db2.gz	DSHGPNCGVCLXAP-LPWJVIDDSA-N	0	3	339.892	3.486	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCc1scnc1C	ZINC001110984343	1368132390	/nfs/dbraw/zinc/13/23/90/1368132390.db2.gz	DQZWVOAFBSSLFW-OAFZBRQQSA-N	0	3	347.528	3.318	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2cc(C)n(C(C)C)c2C)C1	ZINC001193913306	1368145607	/nfs/dbraw/zinc/14/56/07/1368145607.db2.gz	BOSKWXSYWZVXHU-SFHVURJKSA-N	0	3	347.503	3.035	20	30		EGEDHN
C=CCCCN1C[C@@H](O)[C@H](NC(=O)c2ccccc2CC(C)(C)C)C1	ZINC001193989275	1368162161	/nfs/dbraw/zinc/16/21/61/1368162161.db2.gz	VHWPSSUFTGSMGA-RTBURBONSA-N	0	3	344.499	3.016	20	30		EGEDHN
C=CC1(CC(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3[C@@H](C)COC)CCCCC1	ZINC001111135593	1368162910	/nfs/dbraw/zinc/16/29/10/1368162910.db2.gz	XQJODXJXOOCHJH-MLHJIOFPSA-N	0	3	334.504	3.269	20	30		EGEDHN
C=CC1(CC(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3C[C@H](C)OC)CCCCC1	ZINC001111135294	1368163817	/nfs/dbraw/zinc/16/38/17/1368163817.db2.gz	KGGOVBPNCCPIFZ-MLHJIOFPSA-N	0	3	334.504	3.269	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](c1cccnc1)C(C)C)C2	ZINC001111184982	1368181609	/nfs/dbraw/zinc/18/16/09/1368181609.db2.gz	NGKLHRNLAWZYNL-AKHDSKFASA-N	0	3	327.472	3.119	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2ccccc2CC(C)C)C1	ZINC001194360000	1368242880	/nfs/dbraw/zinc/24/28/80/1368242880.db2.gz	VCENXVSFYDPUDM-LJQANCHMSA-N	0	3	344.499	3.234	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)C[C@H](NC(=O)CCCF)c1ccccc1O2	ZINC001111531643	1368331037	/nfs/dbraw/zinc/33/10/37/1368331037.db2.gz	GHOJZCNGKADYER-PXNSSMCTSA-N	0	3	346.446	3.397	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@H](C)OC2(CCN(CC=C)CC2)C1	ZINC001111544325	1368337787	/nfs/dbraw/zinc/33/77/87/1368337787.db2.gz	QENOJBSSVPAEFZ-KRWDZBQOSA-N	0	3	332.488	3.023	20	30		EGEDHN
CCCCCCCCCCOC(=O)NC1CCN(CCO)CC1	ZINC001194928709	1368349405	/nfs/dbraw/zinc/34/94/05/1368349405.db2.gz	CGELLPIQSLJPHJ-UHFFFAOYSA-N	0	3	328.497	3.310	20	30		EGEDHN
C=CCC[C@@H](C)[N@@H+]1C[C@@H]2CCC[C@]2(NC(=O)c2ccccc2[O-])C1	ZINC001111595215	1368360110	/nfs/dbraw/zinc/36/01/10/1368360110.db2.gz	RVTONSOHNBMLDS-GUXCAODWSA-N	0	3	328.456	3.331	20	30		EGEDHN
C=CCC[C@@H](C)[N@H+]1C[C@@H]2CCC[C@]2(NC(=O)c2ccccc2[O-])C1	ZINC001111595215	1368360115	/nfs/dbraw/zinc/36/01/15/1368360115.db2.gz	RVTONSOHNBMLDS-GUXCAODWSA-N	0	3	328.456	3.331	20	30		EGEDHN
C=CCC[C@H](C)[N@@H+]1C[C@@H]2CCC[C@]2(NC(=O)c2ccccc2[O-])C1	ZINC001111595214	1368360314	/nfs/dbraw/zinc/36/03/14/1368360314.db2.gz	RVTONSOHNBMLDS-FTRWYGJKSA-N	0	3	328.456	3.331	20	30		EGEDHN
C=CCC[C@H](C)[N@H+]1C[C@@H]2CCC[C@]2(NC(=O)c2ccccc2[O-])C1	ZINC001111595214	1368360319	/nfs/dbraw/zinc/36/03/19/1368360319.db2.gz	RVTONSOHNBMLDS-FTRWYGJKSA-N	0	3	328.456	3.331	20	30		EGEDHN
C[C@@H](C#N)C(=O)N[C@]12CCC[C@H]1CN(Cc1cc3ccccc3o1)C2	ZINC001111666486	1368415796	/nfs/dbraw/zinc/41/57/96/1368415796.db2.gz	DBJLRKCDRLGFNE-UVFQYZLESA-N	0	3	337.423	3.063	20	30		EGEDHN
Cc1cccc(Cl)c1CN1C[C@@H]2CCC[C@]2(NC(=O)[C@H](C)C#N)C1	ZINC001111667036	1368417055	/nfs/dbraw/zinc/41/70/55/1368417055.db2.gz	RRNSXSXIARKSHJ-VCBZYWHSSA-N	0	3	345.874	3.279	20	30		EGEDHN
Cc1ccc(F)cc1CN1C[C@@H]2CCC[C@]2(NC(=O)C#CC(C)C)C1	ZINC001111736776	1368435103	/nfs/dbraw/zinc/43/51/03/1368435103.db2.gz	VIONVPCKPOKYMC-RXVVDRJESA-N	0	3	342.458	3.264	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@]12CCC[C@H]1CN(Cc1ncccc1C)C2	ZINC001111761810	1368448771	/nfs/dbraw/zinc/44/87/71/1368448771.db2.gz	MWPFNZVZWZRIAA-UWJYYQICSA-N	0	3	341.499	3.463	20	30		EGEDHN
O=C(N[C@@H]1CCCc2ccccc21)N1CCC2SC(=O)C=C2C1	ZINC001186430302	1387940948	/nfs/dbraw/zinc/94/09/48/1387940948.db2.gz	BQXTZUWJJFFHEJ-HZPDHXFCSA-N	0	3	328.437	3.048	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H](C)Cc2ccccc2F)C1	ZINC001111871057	1368518352	/nfs/dbraw/zinc/51/83/52/1368518352.db2.gz	YAZIHLQIXQLAOV-SYNHAJSKSA-N	0	3	330.447	3.161	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)CCCc2ccc(F)cc2)C1	ZINC001111881450	1368525252	/nfs/dbraw/zinc/52/52/52/1368525252.db2.gz	WNZJOTIWJITPDR-RXVVDRJESA-N	0	3	342.458	3.142	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cnc3ccccn23)CC1	ZINC001196366578	1368598239	/nfs/dbraw/zinc/59/82/39/1368598239.db2.gz	MXNGSFJFTDDNQP-UHFFFAOYSA-N	0	3	342.487	3.453	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@H](CC)CC(F)F)C[C@H]1C(F)(F)F	ZINC001112114473	1368663835	/nfs/dbraw/zinc/66/38/35/1368663835.db2.gz	RXQXJNNBZNCVJW-IJLUTSLNSA-N	0	3	342.352	3.223	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cc(OC)ccn2)CC1	ZINC001196711691	1368668120	/nfs/dbraw/zinc/66/81/20/1368668120.db2.gz	ZKIIRPUQNGMWPF-UHFFFAOYSA-N	0	3	333.476	3.209	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)c2occc2C(C)C)C[C@H]1C(F)(F)F	ZINC001112152089	1368683973	/nfs/dbraw/zinc/68/39/73/1368683973.db2.gz	ITDUMZYSZICUGH-ZIAGYGMSSA-N	0	3	342.361	3.019	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)C[C@H](C)C(F)(F)F)C[C@H]1C(F)(F)F	ZINC001112157789	1368689043	/nfs/dbraw/zinc/68/90/43/1368689043.db2.gz	CKJYTJOGGWCSGE-HBNTYKKESA-N	0	3	346.315	3.130	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H]2CCC[C@]2(CNCc2cnc(C)o2)C1	ZINC001112377220	1368804376	/nfs/dbraw/zinc/80/43/76/1368804376.db2.gz	AROSDBWIHNTMEO-LPHOPBHVSA-N	0	3	331.460	3.058	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2ccnc(C3CCCC3)n2)CC1	ZINC001197639966	1368861363	/nfs/dbraw/zinc/86/13/63/1368861363.db2.gz	GVOFXXJIULDFTB-UHFFFAOYSA-N	0	3	342.487	3.248	20	30		EGEDHN
CCCCCCCCCCC(=O)N1CCCN(C[C@H](C)O)CC1	ZINC001197928391	1368926037	/nfs/dbraw/zinc/92/60/37/1368926037.db2.gz	HGFLOBBVNSPYNO-SFHVURJKSA-N	0	3	326.525	3.432	20	30		EGEDHN
C=CCC1(C(=O)N2CCCN(CC/C=C/CC)CC2)CCOCC1	ZINC001197995984	1368938088	/nfs/dbraw/zinc/93/80/88/1368938088.db2.gz	XFFLLXGBRZAPQA-AATRIKPKSA-N	0	3	334.504	3.250	20	30		EGEDHN
C#CCCN1CCCN(C(=O)[C@H](c2ccccc2)[C@H](C)CC)CC1	ZINC001198078385	1368955801	/nfs/dbraw/zinc/95/58/01/1368955801.db2.gz	VFTIUFXYFIZHCG-QUCCMNQESA-N	0	3	326.484	3.374	20	30		EGEDHN
CCCCCCCC[C@H](C)C(=O)N1CCCN(C[C@H](C)O)CC1	ZINC001198197572	1368978309	/nfs/dbraw/zinc/97/83/09/1368978309.db2.gz	PZLPRRJYENZNDZ-ROUUACIJSA-N	0	3	326.525	3.288	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N1CCCN(CC/C=C\c2ccccc2)CC1	ZINC001198342774	1369012216	/nfs/dbraw/zinc/01/22/16/1369012216.db2.gz	AICAVNDWOHAIAX-XCJXAGMVSA-N	0	3	342.483	3.215	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)CCc1ccco1)c1ccccc1OC	ZINC001198521951	1369051607	/nfs/dbraw/zinc/05/16/07/1369051607.db2.gz	FZZMKCIVSGRXBP-SFHVURJKSA-N	0	3	342.439	3.244	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)CCCOCC)c1ccccc1OC	ZINC001198566396	1369062085	/nfs/dbraw/zinc/06/20/85/1369062085.db2.gz	IZAVRFMAHWASEE-SFHVURJKSA-N	0	3	348.487	3.225	20	30		EGEDHN
C=CCOCC(=O)NC[C@@H](NCCCCCC)c1ccccc1OC	ZINC001198607339	1369071795	/nfs/dbraw/zinc/07/17/95/1369071795.db2.gz	ZDKIJLVMBVEVQS-GOSISDBHSA-N	0	3	348.487	3.225	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)c1coc(C)n1)c1ccccc1OC	ZINC001198685996	1369090812	/nfs/dbraw/zinc/09/08/12/1369090812.db2.gz	JEBCUPLNUUNZGI-INIZCTEOSA-N	0	3	343.427	3.019	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)CCOc2cccc(F)c2)CC1	ZINC001112926669	1369093173	/nfs/dbraw/zinc/09/31/73/1369093173.db2.gz	KOYCUHAEYNASHT-INIZCTEOSA-N	0	3	334.435	3.094	20	30		EGEDHN
COc1ccccc1[C@@H](CNC(=O)C#CC(C)C)NCCC(C)C	ZINC001198713086	1369097026	/nfs/dbraw/zinc/09/70/26/1369097026.db2.gz	LZAJKAJKVKMDQE-GOSISDBHSA-N	0	3	330.472	3.148	20	30		EGEDHN
COc1ccccc1[C@H](CNC(=O)C#CC(C)(C)C)NCC[C@H](C)F	ZINC001198723743	1369099254	/nfs/dbraw/zinc/09/92/54/1369099254.db2.gz	JUEHIIJHFJCTIE-RDJZCZTQSA-N	0	3	348.462	3.240	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)Cc1ccccc1)c1ccccc1OC	ZINC001198777342	1369111917	/nfs/dbraw/zinc/11/19/17/1369111917.db2.gz	YOLKQFSDYMPBQI-LJQANCHMSA-N	0	3	338.451	3.261	20	30		EGEDHN
C=CCC[C@@H](C)N[C@H](CNC(=O)c1cnco1)c1ccccc1OC	ZINC001198819525	1369121940	/nfs/dbraw/zinc/12/19/40/1369121940.db2.gz	UJWYQWNOXHUOGR-GDBMZVCRSA-N	0	3	343.427	3.099	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)[C@@H](OC)C(C)C)c1ccccc1OC	ZINC001198876362	1369137024	/nfs/dbraw/zinc/13/70/24/1369137024.db2.gz	RXJBYGDOLWXLJR-MJGOQNOKSA-N	0	3	348.487	3.079	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)[C@@H](OC)C(C)C)c1ccccc1OC	ZINC001198876290	1369137250	/nfs/dbraw/zinc/13/72/50/1369137250.db2.gz	QHQDZVUYODVTSV-HKUYNNGSSA-N	0	3	348.487	3.079	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)C1(C)CC(=C)C1)c1ccccc1OC	ZINC001198895179	1369142499	/nfs/dbraw/zinc/14/24/99/1369142499.db2.gz	OUZKSCYNMSRPPO-KRWDZBQOSA-N	0	3	328.456	3.375	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)C[C@H](C)COC)c1ccccc1OC	ZINC001198945727	1369155058	/nfs/dbraw/zinc/15/50/58/1369155058.db2.gz	PRKRBDVZYFNMPG-WMZOPIPTSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)c1oncc1C)c1ccccc1OC	ZINC001198952966	1369156893	/nfs/dbraw/zinc/15/68/93/1369156893.db2.gz	FMUMJLMOGZDEQE-MRXNPFEDSA-N	0	3	343.427	3.019	20	30		EGEDHN
C=C[C@@H](C(=O)NC[C@H](NCC)c1ccccc1OC)c1ccccc1	ZINC001198992773	1369167108	/nfs/dbraw/zinc/16/71/08/1369167108.db2.gz	FRNDWUBMHQAJEO-MJGOQNOKSA-N	0	3	338.451	3.432	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)[C@H](C)CCOC)c1ccccc1OC	ZINC001198994122	1369167755	/nfs/dbraw/zinc/16/77/55/1369167755.db2.gz	UNKJZHWADCEXQB-AEFFLSMTSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CCCCCCN1CCN(C(=O)c2ccc3cncn3c2C)CC1	ZINC001113053630	1369168531	/nfs/dbraw/zinc/16/85/31/1369168531.db2.gz	LEPPWHQLMNUESC-UHFFFAOYSA-N	0	3	340.471	3.147	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CCC3=CCCCC3)C[C@H]2O)CCCC1	ZINC001199566462	1369237907	/nfs/dbraw/zinc/23/79/07/1369237907.db2.gz	AVLRANILPDBXSI-RTBURBONSA-N	0	3	346.515	3.175	20	30		EGEDHN
C=CCNC(=S)N(C)C[C@@H]1CCCCN1Cc1ccc(OC)cc1	ZINC001200289901	1369342131	/nfs/dbraw/zinc/34/21/31/1369342131.db2.gz	PWYGAXWBBAHBGP-KRWDZBQOSA-N	0	3	347.528	3.042	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)Cc2ccc(Cl)s2)CC1	ZINC001113411131	1369408377	/nfs/dbraw/zinc/40/83/77/1369408377.db2.gz	HCHNSMODIAUZKZ-CYBMUJFWSA-N	0	3	326.893	3.443	20	30		EGEDHN
C=CCCCCCN1CCN(C(=O)c2cc(-c3ccoc3)[nH]n2)CC1	ZINC001113633264	1369533571	/nfs/dbraw/zinc/53/35/71/1369533571.db2.gz	QOLQUQHVBVNFRN-UHFFFAOYSA-N	0	3	342.443	3.174	20	30		EGEDHN
CC(C)C[C@H](C)CN1CCN(C(=O)CC#Cc2ccccc2)CC1	ZINC001113668646	1369556097	/nfs/dbraw/zinc/55/60/97/1369556097.db2.gz	SHWKGSZDOABYSW-IBGZPJMESA-N	0	3	326.484	3.255	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCCO[C@H](CNCc2ccsc2)C1	ZINC001201525421	1369565514	/nfs/dbraw/zinc/56/55/14/1369565514.db2.gz	RQRPNZBPAHHXPU-MRXNPFEDSA-N	0	3	336.501	3.058	20	30		EGEDHN
CC#CCNC[C@H]1CN(C(=O)[C@@H](CC2CCCC2)C(C)C)CCCO1	ZINC001201548454	1369572403	/nfs/dbraw/zinc/57/24/03/1369572403.db2.gz	XKNSPEPYOFHLOY-PMACEKPBSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)N1CCC(NCc2nc(C)c(C)s2)CC1	ZINC001202085025	1369684127	/nfs/dbraw/zinc/68/41/27/1369684127.db2.gz	OEYGAQYHGMXKKX-QWHCGFSZSA-N	0	3	335.517	3.299	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1[C@H]2CN(CCCc3ccccc3Cl)C[C@H]21	ZINC001114025192	1369689786	/nfs/dbraw/zinc/68/97/86/1369689786.db2.gz	IUVGLKQJURTQNG-MNZLEMJZSA-N	0	3	332.875	3.285	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001202130220	1369695710	/nfs/dbraw/zinc/69/57/10/1369695710.db2.gz	JOKUJXJKXGDQLG-MRXNPFEDSA-N	0	3	325.456	3.241	20	30		EGEDHN
O=C(N[C@@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2)c1ccccc1	ZINC001202337790	1369742290	/nfs/dbraw/zinc/74/22/90/1369742290.db2.gz	WNUPFVMUXBQAOC-LEWJYISDSA-N	0	3	344.458	3.369	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@@H](NC(=O)CCCC)C12CCC2	ZINC001202489473	1369788481	/nfs/dbraw/zinc/78/84/81/1369788481.db2.gz	LBMDSBPPDRVJAC-CHWSQXEVSA-N	0	3	329.282	3.102	20	30		EGEDHN
CCCC[C@H](CNc1cccc(F)c1C#N)NC(=O)CN(C)C(C)C	ZINC001114266117	1369838701	/nfs/dbraw/zinc/83/87/01/1369838701.db2.gz	YZMRPGBZXLPWMO-OAHLLOKOSA-N	0	3	348.466	3.124	20	30		EGEDHN
Cc1[nH]ccc1C(=O)N[C@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202694755	1369854189	/nfs/dbraw/zinc/85/41/89/1369854189.db2.gz	JSSLHZDUYBVIER-UXHICEINSA-N	0	3	347.462	3.005	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H]2C[C@H](NCC#Cc3ccccc3)C23CCC3)co1	ZINC001202785867	1369891457	/nfs/dbraw/zinc/89/14/57/1369891457.db2.gz	RNIUCVYVHNQPHT-VQTJNVASSA-N	0	3	348.446	3.270	20	30		EGEDHN
C[C@H]1CN(C(=O)Nc2cccc(C#N)c2)CCN1C1CCCCC1	ZINC001202786492	1369891693	/nfs/dbraw/zinc/89/16/93/1369891693.db2.gz	NWVLPDGGCLWWIY-HNNXBMFYSA-N	0	3	326.444	3.429	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1[C@H]2CN(CCOc3cc(C)ccc3C)C[C@H]21	ZINC001114353806	1369908510	/nfs/dbraw/zinc/90/85/10/1369908510.db2.gz	ZOWLXGCHLRGWGN-WGMWDUQUSA-N	0	3	342.483	3.085	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1C[C@H](NCc2ccns2)C12CCC2	ZINC001202959446	1369936229	/nfs/dbraw/zinc/93/62/29/1369936229.db2.gz	DZAHDVSOUFKNKF-DLBZAZTESA-N	0	3	345.512	3.429	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1C[C@H](NCc2oc(C)nc2C)C12CCC2	ZINC001202987808	1369946894	/nfs/dbraw/zinc/94/68/94/1369946894.db2.gz	OUOVYFCEMUCNMC-DLBZAZTESA-N	0	3	331.460	3.165	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1C[C@H](NCc2cc(OC)ns2)C12CCC2	ZINC001202988109	1369947082	/nfs/dbraw/zinc/94/70/82/1369947082.db2.gz	QRGPPTQEOKHKDV-GJZGRUSLSA-N	0	3	349.500	3.025	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1C[C@@H](NCc2ccc(F)cn2)C12CCC2	ZINC001202988232	1369947435	/nfs/dbraw/zinc/94/74/35/1369947435.db2.gz	RKKKEBMWMGWPQT-SJORKVTESA-N	0	3	331.435	3.094	20	30		EGEDHN
CCCC[C@@](C)(F)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001114493407	1369974305	/nfs/dbraw/zinc/97/43/05/1369974305.db2.gz	HJEZCKBOHJOEMH-DOADOZAASA-N	0	3	343.446	3.023	20	30		EGEDHN
CC[C@H](C)[C@H](C)C(=O)N1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001203093858	1369981038	/nfs/dbraw/zinc/98/10/38/1369981038.db2.gz	ZLVZAQGIARBPEW-GJZGRUSLSA-N	0	3	345.462	3.460	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1C[C@H](NCc2ccns2)C12CCC2	ZINC001203295570	1370066784	/nfs/dbraw/zinc/06/67/84/1370066784.db2.gz	LXBITSOWULXZNM-DLBZAZTESA-N	0	3	345.512	3.244	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1C[C@H](NCc2oc(CC)nc2C)C12CCC2	ZINC001203338620	1370089383	/nfs/dbraw/zinc/08/93/83/1370089383.db2.gz	CKXXZPJFTZEYLF-DLBZAZTESA-N	0	3	345.487	3.419	20	30		EGEDHN
CC1(C(=O)N[C@H]2C[C@H](NCC#Cc3ccccc3)C23CCC3)CC=CC1	ZINC001203341516	1370090105	/nfs/dbraw/zinc/09/01/05/1370090105.db2.gz	RMRUZPOONWACAW-PMACEKPBSA-N	0	3	348.490	3.411	20	30		EGEDHN
CC(F)(F)CC(=O)N[C@@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001203372095	1370102857	/nfs/dbraw/zinc/10/28/57/1370102857.db2.gz	CJQJVGRIKQZWHQ-IAGOWNOFSA-N	0	3	346.421	3.100	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H]2C[C@H](NCc3ccccn3)C23CCC3)CC1	ZINC001203375911	1370104766	/nfs/dbraw/zinc/10/47/66/1370104766.db2.gz	SCOFJXAAONFHRH-ROUUACIJSA-N	0	3	339.483	3.345	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1C[C@H](NCc2c(C)noc2C)C12CCC2	ZINC001203451111	1370131589	/nfs/dbraw/zinc/13/15/89/1370131589.db2.gz	IGGRFJSUZFZBQA-DLBZAZTESA-N	0	3	345.487	3.411	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(C[C@@H](Oc4cccnc4)CO3)CC2)cc1	ZINC001203902854	1370307522	/nfs/dbraw/zinc/30/75/22/1370307522.db2.gz	MLJZQAWJELKAOL-HXUWFJFHSA-N	0	3	349.434	3.156	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CC2)C(=O)N[C@@H]3c2ccccc2)cc1	ZINC001203903681	1370307781	/nfs/dbraw/zinc/30/77/81/1370307781.db2.gz	LJIRLOATXDLIAZ-LJQANCHMSA-N	0	3	331.419	3.012	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(C[C@H](Oc4cccnc4)CO3)CC2)cc1	ZINC001203902853	1370308020	/nfs/dbraw/zinc/30/80/20/1370308020.db2.gz	MLJZQAWJELKAOL-FQEVSTJZSA-N	0	3	349.434	3.156	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(NCc3snnc3C)CC2)CCCC1	ZINC001204157136	1370392988	/nfs/dbraw/zinc/39/29/88/1370392988.db2.gz	NKRJQOOROVESRG-UHFFFAOYSA-N	0	3	348.516	3.064	20	30		EGEDHN
C=CCOc1ccc(CN2CC[C@@]3(CCCN3C(=O)C(C)C)C2)cc1	ZINC001204300180	1370436310	/nfs/dbraw/zinc/43/63/10/1370436310.db2.gz	MKCYTZPDIZLZTE-NRFANRHFSA-N	0	3	342.483	3.474	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)[C@@H](C)CC)CCCCC1	ZINC001115414127	1370442426	/nfs/dbraw/zinc/44/24/26/1370442426.db2.gz	KWNOQJKJTBEBEO-LBPRGKRZSA-N	0	3	331.298	3.350	20	30		EGEDHN
CC[C@H](CC(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1)C(C)C	ZINC001187208583	1388072310	/nfs/dbraw/zinc/07/23/10/1388072310.db2.gz	QBGLJJTWIOSWCQ-SJLPKXTDSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC1(C)N(Cc2ccccc2C#N)CC[C@@]12c1ccccc1OC2=O	ZINC001204373448	1370458021	/nfs/dbraw/zinc/45/80/21/1370458021.db2.gz	SVSZQXMDUYNMST-NRFANRHFSA-N	0	3	332.403	3.400	20	30		EGEDHN
COc1ccc(Nc2cccc(CN3CCN(C)CC3)c2)c(C#N)c1	ZINC001204537231	1370508680	/nfs/dbraw/zinc/50/86/80/1370508680.db2.gz	GXBXCSTXFIDJFA-UHFFFAOYSA-N	0	3	336.439	3.058	20	30		EGEDHN
CN1CCN(Cc2cccc(Nc3cc(F)c(C#N)cc3F)c2)CC1	ZINC001204538277	1370508985	/nfs/dbraw/zinc/50/89/85/1370508985.db2.gz	ZASBNDUBMIUOFP-UHFFFAOYSA-N	0	3	342.393	3.327	20	30		EGEDHN
C=CCCC(=O)N1CCC(CNCc2cc(-c3ccco3)on2)CC1	ZINC001204747905	1370564413	/nfs/dbraw/zinc/56/44/13/1370564413.db2.gz	DATFYBLVOAPZOE-UHFFFAOYSA-N	0	3	343.427	3.229	20	30		EGEDHN
N[C@H]1CN(Cc2cc(C(F)(F)F)ccc2C(F)(F)F)C[C@@H]1F	ZINC001204892278	1370598293	/nfs/dbraw/zinc/59/82/93/1370598293.db2.gz	WAUMSOKJJRTJLV-QWRGUYRKSA-N	0	3	330.247	3.205	20	30		EGEDHN
C=CC(C)(C)C(=O)NCC1(NCc2c(C)noc2C)CCCCC1	ZINC001115665122	1370647348	/nfs/dbraw/zinc/64/73/48/1370647348.db2.gz	IVBQCGAWRSNBNM-UHFFFAOYSA-N	0	3	333.476	3.412	20	30		EGEDHN
C#Cc1cccnc1Nc1ccc(C2(N3CCN(C)CC3)CC2)cc1	ZINC001205091901	1370647683	/nfs/dbraw/zinc/64/76/83/1370647683.db2.gz	IFZRAVLVYUPHNR-UHFFFAOYSA-N	0	3	332.451	3.043	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC1(NCc2cnc(C)cn2)CCCCC1	ZINC001115712276	1370691620	/nfs/dbraw/zinc/69/16/20/1370691620.db2.gz	DEBAQCAIOMUQLQ-LJQANCHMSA-N	0	3	344.503	3.296	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@H](C)C2CC2)CC[C@H]1c1ccc(F)cc1	ZINC001205269726	1370701440	/nfs/dbraw/zinc/70/14/40/1370701440.db2.gz	BLDBCACVICNMRW-UIAACRFSSA-N	0	3	342.458	3.169	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C/C=C(\C)C=C)CC[C@H]1c1ccc(F)cc1	ZINC001205300789	1370713263	/nfs/dbraw/zinc/71/32/63/1370713263.db2.gz	XHQNLEKXILJTTD-BCVZPTCWSA-N	0	3	340.442	3.255	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)[C@@H]2CC23CC3)CCCCC1	ZINC001115747669	1370728533	/nfs/dbraw/zinc/72/85/33/1370728533.db2.gz	UTXGNFBNBRJMOH-ZDUSSCGKSA-N	0	3	341.293	3.104	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2ccsc2)C[C@H]1c1cccc(F)c1	ZINC001205350367	1370729480	/nfs/dbraw/zinc/72/94/80/1370729480.db2.gz	MIHVOHSBQHUTID-ZWKOTPCHSA-N	0	3	342.439	3.108	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC1(NCc2conc2C)CCCCC1	ZINC001115750481	1370731421	/nfs/dbraw/zinc/73/14/21/1370731421.db2.gz	SDSCHHNANACECK-UHFFFAOYSA-N	0	3	333.476	3.494	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CCC2CCOCC2)CCCCC1	ZINC001115759119	1370742883	/nfs/dbraw/zinc/74/28/83/1370742883.db2.gz	YENZDVJQBCWXIV-UHFFFAOYSA-N	0	3	342.911	3.354	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@@H](c2cccc(F)c2)[C@H](NC/C=C\Cl)C1	ZINC001205407884	1370746775	/nfs/dbraw/zinc/74/67/75/1370746775.db2.gz	JJTZXDSEVWBARV-AFQHASOGSA-N	0	3	348.849	3.122	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccc3cccnn32)CCCCC1	ZINC001115763089	1370747465	/nfs/dbraw/zinc/74/74/65/1370747465.db2.gz	VCXDBLIMEFBALQ-UHFFFAOYSA-N	0	3	346.862	3.109	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@]2(C)C=CCC2)C[C@H]1c1cccc(F)c1	ZINC001205427318	1370751607	/nfs/dbraw/zinc/75/16/07/1370751607.db2.gz	XDEBWJMBUONEPS-QKNQBKEWSA-N	0	3	340.442	3.089	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C2(CC=C)CCC2)C[C@H]1c1cccc(F)c1	ZINC001205432575	1370753212	/nfs/dbraw/zinc/75/32/12/1370753212.db2.gz	NFNGDRUZFJRGBF-RBUKOAKNSA-N	0	3	340.442	3.089	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)N1CCC(CNCc2ccn(C(C)C)n2)CC1	ZINC001205955298	1370922497	/nfs/dbraw/zinc/92/24/97/1370922497.db2.gz	OXMFOMICQXABKE-DLBZAZTESA-N	0	3	346.519	3.250	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)N1CCC(CNCc2csc(CC)n2)CC1	ZINC001205961087	1370924023	/nfs/dbraw/zinc/92/40/23/1370924023.db2.gz	LMNGLKKPZGOIGD-LSDHHAIUSA-N	0	3	349.544	3.492	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC(CNCc2ccccc2C#N)CC1	ZINC001205989230	1370931244	/nfs/dbraw/zinc/93/12/44/1370931244.db2.gz	RSKZFPYGPWPNHK-QGZVFWFLSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=CCOCC(=O)N[C@@H]1CN(Cc2ccc(CC(C)C)cc2)C[C@H]1C	ZINC001206614237	1371109019	/nfs/dbraw/zinc/10/90/19/1371109019.db2.gz	SCXDGUHWBMWGCG-YLJYHZDGSA-N	0	3	344.499	3.024	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1S[C@@H]1CCSC1	ZINC001118412861	1371177062	/nfs/dbraw/zinc/17/70/62/1371177062.db2.gz	NQEOUZIMIFYRAX-CQSZACIVSA-N	0	3	338.546	3.090	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CCN(Cc3cc(C)ccn3)C2)C1	ZINC001206846777	1371188780	/nfs/dbraw/zinc/18/87/80/1371188780.db2.gz	BKUGHLWEUXYHGB-LJQANCHMSA-N	0	3	329.444	3.001	20	30		EGEDHN
CC(C)[C@H](C)CC(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001207645979	1371463199	/nfs/dbraw/zinc/46/31/99/1371463199.db2.gz	QIVPGZCZIHSYLO-UYAOXDASSA-N	0	3	326.484	3.301	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207653118	1371464461	/nfs/dbraw/zinc/46/44/61/1371464461.db2.gz	DGCRGKUOPNOQCH-SFHVURJKSA-N	0	3	330.859	3.238	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H](NCC#Cc2ccccc2Cl)C1	ZINC001207654635	1371465718	/nfs/dbraw/zinc/46/57/18/1371465718.db2.gz	SQZZFTJDURLWTN-QGZVFWFLSA-N	0	3	330.859	3.238	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H](NCC#Cc2ccc(Cl)cc2)C1)C1CC1	ZINC001207753958	1371495122	/nfs/dbraw/zinc/49/51/22/1371495122.db2.gz	GVMLUAKRHKECJK-HNAYVOBHSA-N	0	3	344.886	3.318	20	30		EGEDHN
C=CCOCCCC(=O)N1CCC[C@H](NCc2cc(C)ccc2F)C1	ZINC001207758589	1371495873	/nfs/dbraw/zinc/49/58/73/1371495873.db2.gz	BZEVDNSNNMBBRQ-SFHVURJKSA-N	0	3	348.462	3.198	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H](NCc2ccccc2OC2CC2)C1	ZINC001207934240	1371542342	/nfs/dbraw/zinc/54/23/42/1371542342.db2.gz	AFABTSNEWHQZPE-GOSISDBHSA-N	0	3	340.467	3.112	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC[C@H](N[C@H](C)c2ccc(F)cc2F)C1	ZINC001207991975	1371561457	/nfs/dbraw/zinc/56/14/57/1371561457.db2.gz	CCWCYBJGEBIFLB-ZBFHGGJFSA-N	0	3	334.410	3.266	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC[C@H](NCc2cccc(Cl)c2F)C1	ZINC001207995978	1371562657	/nfs/dbraw/zinc/56/26/57/1371562657.db2.gz	VSKWJQDLSYKETR-HNNXBMFYSA-N	0	3	336.838	3.219	20	30		EGEDHN
CC/C(C)=C/C(=O)N1CCC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001208001821	1371563864	/nfs/dbraw/zinc/56/38/64/1371563864.db2.gz	JOZRLABEVFFPGQ-RKCSUWQLSA-N	0	3	329.419	3.134	20	30		EGEDHN
CCCCCCC/C=C/CN1CCC2(CC1)C(=O)N(C)CCN2C	ZINC001208120184	1371602490	/nfs/dbraw/zinc/60/24/90/1371602490.db2.gz	MUIJAJJXUDKHKA-ZHACJKMWSA-N	0	3	335.536	3.142	20	30		EGEDHN
N#Cc1ccc(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)c(F)c1	ZINC001120555389	1371609798	/nfs/dbraw/zinc/60/97/98/1371609798.db2.gz	XXYWEFRHBRKHBH-IBGZPJMESA-N	0	3	337.398	3.264	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001208212624	1371652745	/nfs/dbraw/zinc/65/27/45/1371652745.db2.gz	KPUWIKXPESADHO-LJQANCHMSA-N	0	3	326.484	3.301	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN(CCCOc2ccccc2)C[C@H]1C	ZINC001208317926	1371714983	/nfs/dbraw/zinc/71/49/83/1371714983.db2.gz	BKGIAVQGOIQZFL-SJLPKXTDSA-N	0	3	330.472	3.104	20	30		EGEDHN
C#CCC1(C(=O)N2CCC[C@H](NCc3ccc(Cl)nc3)C2)CCC1	ZINC001208318704	1371715238	/nfs/dbraw/zinc/71/52/38/1371715238.db2.gz	GAJNQKVKCPSTBQ-INIZCTEOSA-N	0	3	345.874	3.009	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CN([C@H](C)c2cccc(OC)c2)C[C@H]1C	ZINC001208374568	1371741743	/nfs/dbraw/zinc/74/17/43/1371741743.db2.gz	NFPPKDAQJKETJE-MBOZVWFJSA-N	0	3	342.483	3.386	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CN(Cc2ccccc2N(C)C)C[C@H]1C	ZINC001208388934	1371747750	/nfs/dbraw/zinc/74/77/50/1371747750.db2.gz	TZFOAKMJFOQDJQ-YQVWRLOYSA-N	0	3	343.515	3.291	20	30		EGEDHN
O=C(N1CCC[C@@H](NCC#Cc2ccccc2)C1)C12CCC(CC1)C2	ZINC001208423772	1371762899	/nfs/dbraw/zinc/76/28/99/1371762899.db2.gz	PEFTVAVFRWZFHS-SNCIUUNGSA-N	0	3	336.479	3.199	20	30		EGEDHN
COc1ccccc1CCCN1CCN(c2ccc(C#N)cc2)CC1	ZINC001208839527	1371911904	/nfs/dbraw/zinc/91/19/04/1371911904.db2.gz	PEMQJVPLNXCSML-UHFFFAOYSA-N	0	3	335.451	3.322	20	30		EGEDHN
COC(=O)c1cccc2c1CCN(CCCc1cccc(C#N)c1)C2	ZINC001208854804	1371919213	/nfs/dbraw/zinc/91/92/13/1371919213.db2.gz	VBYKEQAUQGHLIK-UHFFFAOYSA-N	0	3	334.419	3.336	20	30		EGEDHN
CN(CCc1ccc(C#N)cc1)Cc1cncc(Br)c1	ZINC001208925914	1371947216	/nfs/dbraw/zinc/94/72/16/1371947216.db2.gz	YGCMAINDPOEZCU-UHFFFAOYSA-N	0	3	330.229	3.390	20	30		EGEDHN
COc1ccc(OC2CCN(CCc3ccc(C#N)cc3)CC2)nc1	ZINC001208928387	1371948089	/nfs/dbraw/zinc/94/80/89/1371948089.db2.gz	GWZAMGIHDAUGJX-UHFFFAOYSA-N	0	3	337.423	3.048	20	30		EGEDHN
C=CCN(CCN1CC[C@H](c2ccccc2OC)C1)C(=O)OCC	ZINC001209017238	1371974744	/nfs/dbraw/zinc/97/47/44/1371974744.db2.gz	MOKGEDYLQGPNDI-INIZCTEOSA-N	0	3	332.444	3.129	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC[C@H](NCC=C(Cl)Cl)C1	ZINC001209017010	1371974976	/nfs/dbraw/zinc/97/49/76/1371974976.db2.gz	JSIRSVVXFQVYHO-AWEZNQCLSA-N	0	3	331.287	3.470	20	30		EGEDHN
C=CCN(CCN1CC[C@@H](c2ccccc2OC)C1)C(=O)OCC	ZINC001209017239	1371975545	/nfs/dbraw/zinc/97/55/45/1371975545.db2.gz	MOKGEDYLQGPNDI-MRXNPFEDSA-N	0	3	332.444	3.129	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@H](NCc2ccc(Cl)nc2)C1	ZINC001209146481	1372014462	/nfs/dbraw/zinc/01/44/62/1372014462.db2.gz	ORHVWNIOQQIMOG-ZBFHGGJFSA-N	0	3	335.879	3.418	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NC1CC2(CC(NCc3nc(C)cs3)C2)C1	ZINC001121611711	1372024581	/nfs/dbraw/zinc/02/45/81/1372024581.db2.gz	XNUYZCZGZGPLSE-YQBUTTRJSA-N	0	3	347.528	3.427	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC1CC2(C1)CC(N[C@H](C)c1cnccn1)C2	ZINC001121616614	1372026902	/nfs/dbraw/zinc/02/69/02/1372026902.db2.gz	MUWBGOMOZFGTAM-USWDQHPYSA-N	0	3	342.487	3.157	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC1CC2(CC(NCc3ccn(CC)n3)C2)C1	ZINC001121617232	1372027313	/nfs/dbraw/zinc/02/73/13/1372027313.db2.gz	UNXCVJXTQBRHIL-WIOLVWRCSA-N	0	3	344.503	3.022	20	30		EGEDHN
C#CC[C@@H](CC)c1nnc(N2CCN(C(C)(C)CC)CC2)n1CC	ZINC001121647688	1372035950	/nfs/dbraw/zinc/03/59/50/1372035950.db2.gz	BQIFLFPFJBJTFH-MRXNPFEDSA-N	0	3	331.508	3.126	20	30		EGEDHN
C=CCCCCN1Cc2cn(CC3CCOCC3)nc2[C@@H](COC)C1	ZINC001209200965	1372036464	/nfs/dbraw/zinc/03/64/64/1372036464.db2.gz	QYMDQJYEYOIUDH-LJQANCHMSA-N	0	3	347.503	3.212	20	30		EGEDHN
C=CCCCCN1CCN(Cc2ccccc2)C[C@@H]1CC(=O)OC	ZINC001209207313	1372038993	/nfs/dbraw/zinc/03/89/93/1372038993.db2.gz	SBYIZHQXBYZZDV-IBGZPJMESA-N	0	3	330.472	3.092	20	30		EGEDHN
C#CCCCN1Cc2cn(CC3CCCC3)nc2[C@H](COCC)C1	ZINC001209264200	1372054181	/nfs/dbraw/zinc/05/41/81/1372054181.db2.gz	XCOJWFBIQXAVSQ-IBGZPJMESA-N	0	3	329.488	3.422	20	30		EGEDHN
C[C@@H]1C[C@@H](CN2CCN(c3ccc(C#N)cc3F)CC2)C[C@H](C)O1	ZINC001209400104	1372092084	/nfs/dbraw/zinc/09/20/84/1372092084.db2.gz	XFZOKJTZLPYNOQ-SCAQPMJSSA-N	0	3	331.435	3.023	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N(C)Cc1cc(Br)cs1	ZINC001121924733	1372124226	/nfs/dbraw/zinc/12/42/26/1372124226.db2.gz	HVVVHNPSBRFKKI-GFCCVEGCSA-N	0	3	331.279	3.153	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N[C@@H](C)c1nc(-c2ccc(Cl)cc2)no1	ZINC001122111629	1372177171	/nfs/dbraw/zinc/17/71/71/1372177171.db2.gz	CHWWBSRFWJARJT-SMDDNHRTSA-N	0	3	348.834	3.251	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N1CCC(OCc2ccccc2F)CC1	ZINC001122120731	1372180382	/nfs/dbraw/zinc/18/03/82/1372180382.db2.gz	PAYRNXJYYBZARE-SFHVURJKSA-N	0	3	334.435	3.017	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001209911301	1372230062	/nfs/dbraw/zinc/23/00/62/1372230062.db2.gz	VJAYISNYUKVQOA-QFBILLFUSA-N	0	3	330.447	3.050	20	30		EGEDHN
CSc1ccc(CCC(=O)C(C#N)C(=O)NC2CCCC2)cc1	ZINC001122561566	1372276026	/nfs/dbraw/zinc/27/60/26/1372276026.db2.gz	IVXWRSOKHCKSKJ-INIZCTEOSA-N	0	3	330.453	3.109	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@@H]1OCC(=O)c1cccc(C#N)c1	ZINC001210380602	1372338339	/nfs/dbraw/zinc/33/83/39/1372338339.db2.gz	DGWHUZIQLFFCLM-KKSFZXQISA-N	0	3	334.419	3.278	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@H](C)CCc2cccc(F)c2)C1	ZINC001211191890	1372496962	/nfs/dbraw/zinc/49/69/62/1372496962.db2.gz	VGNPGEJZJYOUQY-GPMSIDNRSA-N	0	3	332.463	3.407	20	30		EGEDHN
C=CCC[C@@H](C(=O)N[C@@H]1CN(CCOCC)C[C@H]1C)c1ccccc1	ZINC001211495489	1372568574	/nfs/dbraw/zinc/56/85/74/1372568574.db2.gz	NVQFEMBIAOMBKC-MISYRCLQSA-N	0	3	344.499	3.209	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2ccc(Cl)o2)[C@H](OC)C1	ZINC001211845573	1372620539	/nfs/dbraw/zinc/62/05/39/1372620539.db2.gz	ZTDHCEUDLBFJLO-UKRRQHHQSA-N	0	3	340.851	3.108	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](NCc2cccnc2)C1	ZINC001188010385	1388213644	/nfs/dbraw/zinc/21/36/44/1388213644.db2.gz	RWHVZLSBKUUZLS-NHCUHLMSSA-N	0	3	349.478	3.207	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CN([C@H](CC)c2ccccc2)C[C@H]1OC	ZINC001212148521	1372664857	/nfs/dbraw/zinc/66/48/57/1372664857.db2.gz	LAXKFWOPVNPWHJ-VAMGGRTRSA-N	0	3	342.483	3.147	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CN(CCCc2ccccc2)C[C@H]1OC	ZINC001212332597	1372688914	/nfs/dbraw/zinc/68/89/14/1372688914.db2.gz	HNPVMDWUBWTJBW-RTBURBONSA-N	0	3	344.499	3.037	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@@H](CC)CC(F)F)[C@H](OC)C1	ZINC001212401498	1372700442	/nfs/dbraw/zinc/70/04/42/1372700442.db2.gz	SNGAPHJQNYTHGT-ARFHVFGLSA-N	0	3	346.462	3.230	20	30		EGEDHN
C=C[C@H](CC(=O)N1CC[C@@H](NCc2ncccc2C)C1)c1ccccc1	ZINC001188040223	1388224766	/nfs/dbraw/zinc/22/47/66/1388224766.db2.gz	PPHVLIRIQVAMMV-UYAOXDASSA-N	0	3	349.478	3.440	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN([C@H](C)c2ccccc2C)C[C@H]1OC	ZINC001213267962	1372871581	/nfs/dbraw/zinc/87/15/81/1372871581.db2.gz	CTWFXLYSZIFWNO-KBAYOESNSA-N	0	3	330.472	3.084	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CC/C=C/CCC)C[C@H]2OC)CCC1	ZINC001213385425	1372898142	/nfs/dbraw/zinc/89/81/42/1372898142.db2.gz	MWGZMDYLJJXCCM-HNGSOEQISA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@H]2CCC(C)(C)C2)[C@H](OC)C1	ZINC001213404086	1372901781	/nfs/dbraw/zinc/90/17/81/1372901781.db2.gz	YNDUNALQKBYQIM-RCCFBDPRSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2cc(C)ccc2F)[C@H](OC)C1	ZINC001213488122	1372912207	/nfs/dbraw/zinc/91/22/07/1372912207.db2.gz	RHVHYIYGXMKSRJ-RTBURBONSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)[C@@H](CC)Cc2ccccc2)[C@H](OC)C1	ZINC001213506505	1372915750	/nfs/dbraw/zinc/91/57/50/1372915750.db2.gz	LJMVAWKWNRTKAW-XUVXKRRUSA-N	0	3	344.499	3.037	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2ccc(C(C)(C)C)cc2)[C@H](OC)C1	ZINC001213766972	1372958415	/nfs/dbraw/zinc/95/84/15/1372958415.db2.gz	AVZAZTKTAKCUIR-RTBURBONSA-N	0	3	344.499	3.379	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccc(Cl)o2)C[C@H]1NCC#Cc1ccccc1	ZINC001214137660	1373014471	/nfs/dbraw/zinc/01/44/71/1373014471.db2.gz	OFLVKWLILUJWCU-GDBMZVCRSA-N	0	3	342.826	3.035	20	30		EGEDHN
CC/C=C(/C)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001214262454	1373032928	/nfs/dbraw/zinc/03/29/28/1373032928.db2.gz	YXMJHVSHOWJRFH-SWLWXLBRSA-N	0	3	344.886	3.484	20	30		EGEDHN
CC1CC(C(=O)N2C[C@@H](C)[C@H](NCC#Cc3ccccc3Cl)C2)C1	ZINC001214421998	1373058599	/nfs/dbraw/zinc/05/85/99/1373058599.db2.gz	FIANAECRXXTDKJ-ZSVMCUKPSA-N	0	3	344.886	3.174	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](C)[C@H](NCc2cn(C(C)C)nc2C)C1	ZINC001214727837	1373110342	/nfs/dbraw/zinc/11/03/42/1373110342.db2.gz	URCUFIZDMJNRNU-CRAIPNDOSA-N	0	3	346.519	3.311	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cscc2C(F)F)cc1	ZINC001127490824	1373131694	/nfs/dbraw/zinc/13/16/94/1373131694.db2.gz	FAALDOXCYDSJCT-UHFFFAOYSA-N	0	3	335.379	3.077	20	30		EGEDHN
CCCc1ccc(C(=O)NCCNCc2cccc(C#N)c2)s1	ZINC001128327117	1373252505	/nfs/dbraw/zinc/25/25/05/1373252505.db2.gz	CFWHDEBVEQUURF-UHFFFAOYSA-N	0	3	327.453	3.092	20	30		EGEDHN
CC(C)C[C@@H](C)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001216099633	1373263446	/nfs/dbraw/zinc/26/34/46/1373263446.db2.gz	WDOGMKCHKONGDC-MBOZVWFJSA-N	0	3	344.474	3.296	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)CCCCC)[C@@H](n2ccnn2)C1	ZINC001128716675	1373304642	/nfs/dbraw/zinc/30/46/42/1373304642.db2.gz	XLURYYLXENMRGI-MSOLQXFVSA-N	0	3	349.523	3.170	20	30		EGEDHN
C=CC[C@H](C(=O)N1C[C@@H](C)[C@H](NCc2cccnc2)C1)c1ccccc1	ZINC001216806524	1373345150	/nfs/dbraw/zinc/34/51/50/1373345150.db2.gz	RSSPBWRDOYNXKL-JRGCBEDISA-N	0	3	349.478	3.378	20	30		EGEDHN
CC(C)(C#N)c1cccc(-c2nc(-c3ccc4c(n3)CCNC4)no2)c1	ZINC001216845437	1373351138	/nfs/dbraw/zinc/35/11/38/1373351138.db2.gz	OAZQEOOXTCQCBP-UHFFFAOYSA-N	0	3	345.406	3.245	20	30		EGEDHN
C#CCC1(C(=O)N2C[C@@H](C)[C@H](NCc3cncs3)C2)CCCCC1	ZINC001216894716	1373359806	/nfs/dbraw/zinc/35/98/06/1373359806.db2.gz	WJWWACDEHLMETB-NVXWUHKLSA-N	0	3	345.512	3.053	20	30		EGEDHN
CCCCCCCCOCC(=O)NCCNCc1scnc1C	ZINC001129523056	1373393757	/nfs/dbraw/zinc/39/37/57/1373393757.db2.gz	SCLIOMHVXTZUPF-UHFFFAOYSA-N	0	3	341.521	3.034	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)[C@@H]3CC=CCC3)[C@H]2C1	ZINC001217265066	1373414477	/nfs/dbraw/zinc/41/44/77/1373414477.db2.gz	KIYZIZQKRIEOIA-CEXWTWQISA-N	0	3	334.504	3.225	20	30		EGEDHN
Cc1[nH]c2c(cccc2C(=O)NCCNCc2cccc(C#N)c2)c1C	ZINC001130385058	1373513480	/nfs/dbraw/zinc/51/34/80/1373513480.db2.gz	XRJZFVWJRMRPIC-UHFFFAOYSA-N	0	3	346.434	3.176	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)C2(CC(C)C)CCC2)C1	ZINC001130402103	1373521748	/nfs/dbraw/zinc/52/17/48/1373521748.db2.gz	WAFLLBLFENKAFY-INIZCTEOSA-N	0	3	344.503	3.218	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCO[C@@H]2CN(CC/C=C\CC)C[C@@H]21	ZINC001217986534	1373527274	/nfs/dbraw/zinc/52/72/74/1373527274.db2.gz	JBXFXUSTKLNBPO-AWTIPJNISA-N	0	3	332.488	3.023	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)[C@@]2(C)CC=C(C)CC2)C1	ZINC001130450596	1373545114	/nfs/dbraw/zinc/54/51/14/1373545114.db2.gz	PQYBTNMWJVMVPL-UZLBHIALSA-N	0	3	342.487	3.138	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)[C@H]3CCC=CCCC3)[C@H]2C1	ZINC001218161627	1373571454	/nfs/dbraw/zinc/57/14/54/1373571454.db2.gz	HRALIKDMKPQDSK-GBESFXJTSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)[C@H](CC)CCCCCC)[C@H]2C1	ZINC001218429569	1373611614	/nfs/dbraw/zinc/61/16/14/1373611614.db2.gz	MZQYXRANFPICFP-CEXWTWQISA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)C[C@@H](C=C)CC)[C@H]2C1	ZINC001218517827	1373628800	/nfs/dbraw/zinc/62/88/00/1373628800.db2.gz	QAFIRNAEHMXOEZ-GBESFXJTSA-N	0	3	334.504	3.247	20	30		EGEDHN
N#Cc1sc(-c2ccc(F)cc2)cc1NC(=O)[C@@H](N)CC(F)F	ZINC001218541168	1373632200	/nfs/dbraw/zinc/63/22/00/1373632200.db2.gz	IBBWKYIGWVOPAH-JTQLQIEISA-N	0	3	339.342	3.347	20	30		EGEDHN
CC(C)=C[C@@H]1[C@@H](C(=O)NCCNCc2cccc(C#N)c2)C1(C)C	ZINC001131070748	1373636820	/nfs/dbraw/zinc/63/68/20/1373636820.db2.gz	HDZJJZJTBYHUEO-MSOLQXFVSA-N	0	3	325.456	3.002	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)C[C@@H](C)CCC=C(C)C)[C@H]2C1	ZINC001218672810	1373643274	/nfs/dbraw/zinc/64/32/74/1373643274.db2.gz	PPOCEMHZIYIHMY-GBESFXJTSA-N	0	3	334.504	3.247	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)C[C@@H]3CCCCC3(C)C)[C@H]2C1	ZINC001219073274	1373685370	/nfs/dbraw/zinc/68/53/70/1373685370.db2.gz	FYLRZQOAAZAQGW-GBESFXJTSA-N	0	3	348.531	3.471	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@@H](NCc3cccc(F)c3)C2)CCCCC1	ZINC001188257973	1388276592	/nfs/dbraw/zinc/27/65/92/1388276592.db2.gz	RLHLBPGTTUOWOQ-LJQANCHMSA-N	0	3	342.458	3.490	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2ccc3occc3c2)[C@@H](O)C1	ZINC001219667517	1373723146	/nfs/dbraw/zinc/72/31/46/1373723146.db2.gz	AMQOQCODNFELMK-MSOLQXFVSA-N	0	3	344.455	3.178	20	30		EGEDHN
C#CCCCCCC(=O)N1C[C@H](C)O[C@]2(CCN(CC=C(C)C)C2)C1	ZINC001131672893	1373755224	/nfs/dbraw/zinc/75/52/24/1373755224.db2.gz	CJIZTWBALWBRNF-FPOVZHCZSA-N	0	3	346.515	3.228	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC[C@H](C)N(Cc2ccc(OC)c(C)c2)C1	ZINC001131894658	1375032500	/nfs/dbraw/zinc/03/25/00/1375032500.db2.gz	BALRJZMLWXJTCY-WMZOPIPTSA-N	0	3	330.472	3.439	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC[C@@H](C)N(CCc2ccc3c(c2)CCO3)C1	ZINC001131896927	1375034053	/nfs/dbraw/zinc/03/40/53/1375034053.db2.gz	XLWISOBUPMCPHW-APWZRJJASA-N	0	3	342.483	3.099	20	30		EGEDHN
C=CCOCCCC(=O)N[C@@H]1CC[C@@H](C)N(Cc2ccc(C)cc2)C1	ZINC001131940186	1375058174	/nfs/dbraw/zinc/05/81/74/1375058174.db2.gz	ZTEPEHZVYBGNRC-UYAOXDASSA-N	0	3	344.499	3.447	20	30		EGEDHN
CCCCCCCN1C[C@H](NC(=O)c2cc(OC)no2)CC[C@H]1C	ZINC001131981428	1375080504	/nfs/dbraw/zinc/08/05/04/1375080504.db2.gz	WGZOJAHZKYGAJC-HUUCEWRRSA-N	0	3	337.464	3.236	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CC[C@H](C)N(CCCc2ccsc2)C1	ZINC001132002314	1375092690	/nfs/dbraw/zinc/09/26/90/1375092690.db2.gz	IKVBBRDRXRYBTD-WMZOPIPTSA-N	0	3	332.513	3.453	20	30		EGEDHN
CCc1ccc(CN2C[C@H](NC(=O)C#CC(C)C)CC[C@H]2C)cc1	ZINC001132022124	1375103534	/nfs/dbraw/zinc/10/35/34/1375103534.db2.gz	VGWSXIQMFXEFMS-YLJYHZDGSA-N	0	3	326.484	3.378	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N[C@H]2CC[C@@H](C)N(CCCF)C2)cc1	ZINC001132041759	1375113146	/nfs/dbraw/zinc/11/31/46/1375113146.db2.gz	KIEIXUFKNPODMZ-AEFFLSMTSA-N	0	3	346.446	3.031	20	30		EGEDHN
C/C=C(/C)C(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccc(F)cc1	ZINC001225592759	1375128881	/nfs/dbraw/zinc/12/88/81/1375128881.db2.gz	OWUCVFFMNBBVMB-IURQVSMNSA-N	0	3	328.431	3.160	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@H](CC)c2ccc(F)cc2)CC1	ZINC001225610807	1375132016	/nfs/dbraw/zinc/13/20/16/1375132016.db2.gz	DBUCPBQLYGOJAG-LJQANCHMSA-N	0	3	330.447	3.171	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NCC1CCN(Cc2ccc(F)cc2C)CC1	ZINC001225630742	1375135312	/nfs/dbraw/zinc/13/53/12/1375135312.db2.gz	GCLDQCJAMPQVOA-MRXNPFEDSA-N	0	3	348.462	3.053	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCOc2ccc(C)c(C)c2)CC[C@H]1C	ZINC001132097607	1375146298	/nfs/dbraw/zinc/14/62/98/1375146298.db2.gz	MBYSOIWJFGOPJK-QZTJIDSGSA-N	0	3	330.472	3.227	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CCCC[C@H]1NCc1cccc(Cl)n1	ZINC001225752459	1375152384	/nfs/dbraw/zinc/15/23/84/1375152384.db2.gz	ITTXXEOQUNXJTK-IAGOWNOFSA-N	0	3	347.890	3.446	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCc2ncc(C(C)(C)C)o2)CC[C@@H]1C	ZINC001132114287	1375154949	/nfs/dbraw/zinc/15/49/49/1375154949.db2.gz	GRZLRRIBEIEIGN-JKSUJKDBSA-N	0	3	347.503	3.450	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)C2(C3CCC3)CCC2)CC[C@H]1C	ZINC001132201130	1375205641	/nfs/dbraw/zinc/20/56/41/1375205641.db2.gz	XEMZFHNIBVPOMP-SJLPKXTDSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)C2(C3CCC3)CCC2)CC[C@H]1C	ZINC001132201128	1375206244	/nfs/dbraw/zinc/20/62/44/1375206244.db2.gz	XEMZFHNIBVPOMP-AEFFLSMTSA-N	0	3	334.504	3.129	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCNCc2ccc(C(C)C)nc2C)cc1	ZINC001132215840	1375215008	/nfs/dbraw/zinc/21/50/08/1375215008.db2.gz	ODHKAKHTMBSIAH-UHFFFAOYSA-N	0	3	335.451	3.014	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1CC[C@@H](C)N(CCOC2CCC2)C1	ZINC001132240220	1375235410	/nfs/dbraw/zinc/23/54/10/1375235410.db2.gz	CYBKRDJQCLYGLX-MSOLQXFVSA-N	0	3	334.504	3.108	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1CC[C@H](C)N(CCOCCCC)C1	ZINC001132241101	1375235700	/nfs/dbraw/zinc/23/57/00/1375235700.db2.gz	QRDMOCIWVVGMMU-OALUTQOASA-N	0	3	336.520	3.356	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1CC[C@@H](C)N(CCOCC2CCC2)C1	ZINC001132330175	1375308510	/nfs/dbraw/zinc/30/85/10/1375308510.db2.gz	CCQXUDOOVZAYDT-AEFFLSMTSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COCc2ccccc2C)CC[C@H]1C	ZINC001132340158	1375319427	/nfs/dbraw/zinc/31/94/27/1375319427.db2.gz	NPQBBGJAMLKDLP-MJGOQNOKSA-N	0	3	330.472	3.057	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2(Cc3ccccc3F)CC2)CC[C@@H]1C	ZINC001132346197	1375323264	/nfs/dbraw/zinc/32/32/64/1375323264.db2.gz	VXAXVICVFBQLTM-WMZOPIPTSA-N	0	3	342.458	3.141	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCc2ccccc2OC)CC[C@H]1C	ZINC001132469965	1375412307	/nfs/dbraw/zinc/41/23/07/1375412307.db2.gz	ZIAICZKXBRVDGG-AEFFLSMTSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COc2ccccc2CC)CC[C@@H]1C	ZINC001132472732	1375412955	/nfs/dbraw/zinc/41/29/55/1375412955.db2.gz	LIAPKJSBWMMSHE-FUHWJXTLSA-N	0	3	330.472	3.173	20	30		EGEDHN
CC(C)(C)C#CC(=O)NC1CCN([C@@H]2CCc3ccc(F)cc32)CC1	ZINC001227290301	1375416642	/nfs/dbraw/zinc/41/66/42/1375416642.db2.gz	UAANWKCHHDPHHU-LJQANCHMSA-N	0	3	342.458	3.443	20	30		EGEDHN
C=C(C)CCC(=O)NC1CCN(C[C@H](OC)c2ccccc2)CC1	ZINC001227596957	1375449679	/nfs/dbraw/zinc/44/96/79/1375449679.db2.gz	ORRQUSPWRPXZFV-IBGZPJMESA-N	0	3	330.472	3.311	20	30		EGEDHN
C#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)CCC(C)C)CC1	ZINC001132551247	1375456724	/nfs/dbraw/zinc/45/67/24/1375456724.db2.gz	COTQEKFMFRJNAH-HXUWFJFHSA-N	0	3	341.499	3.334	20	30		EGEDHN
C#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)/C(C)=C\CC)CC1	ZINC001132551934	1375457813	/nfs/dbraw/zinc/45/78/13/1375457813.db2.gz	OVPSETZVYLTLDO-FUJWGRRUSA-N	0	3	339.483	3.254	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2N(Cc2ccsc2)C(=O)C(C)C)CC1	ZINC001132563987	1375469121	/nfs/dbraw/zinc/46/91/21/1375469121.db2.gz	ZZPKVGRUYDTZDA-KRWDZBQOSA-N	0	3	330.497	3.220	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CCCC[C@H]1NCc1conc1CC	ZINC001228111748	1375519246	/nfs/dbraw/zinc/51/92/46/1375519246.db2.gz	DYVICFUVBANSQJ-ZTFGCOKTSA-N	0	3	333.476	3.356	20	30		EGEDHN
COc1ccc(CN(C)[C@@H]2CCN(C(=O)CCC(C)C)C2)cc1C#N	ZINC001188821664	1388384375	/nfs/dbraw/zinc/38/43/75/1388384375.db2.gz	SQKQWOCRAZNUJI-GOSISDBHSA-N	0	3	343.471	3.036	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](C)[C@H](CNCc2cc(C)no2)C1	ZINC001132843241	1375595746	/nfs/dbraw/zinc/59/57/46/1375595746.db2.gz	KDXYCGMVOSLVOZ-MAUKXSAKSA-N	0	3	345.487	3.326	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](C)[C@@H](CNCc2ccn(CC)n2)C1	ZINC001132847069	1375599959	/nfs/dbraw/zinc/59/99/59/1375599959.db2.gz	RMIMTTCKGYGTMM-IRXDYDNUSA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](C)[C@H](CNCc2ccccc2C#N)C1	ZINC001132865819	1375610791	/nfs/dbraw/zinc/61/07/91/1375610791.db2.gz	SKVIWUGIUAZDCT-YLJYHZDGSA-N	0	3	339.483	3.489	20	30		EGEDHN
CC#CCCCC(=O)NC1CCN(CCO[C@H]2CCCC[C@H]2C)CC1	ZINC001228712676	1375648387	/nfs/dbraw/zinc/64/83/87/1375648387.db2.gz	YMKCNMCXXGXWFA-QUCCMNQESA-N	0	3	348.531	3.356	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NC1CCN(Cc2ccc(COC)cc2)CC1	ZINC001228748932	1375662014	/nfs/dbraw/zinc/66/20/14/1375662014.db2.gz	OMTXUABMOMSMCS-SJORKVTESA-N	0	3	344.499	3.372	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NC1CCN(Cc2cccc(COC)c2)CC1	ZINC001228750425	1375663635	/nfs/dbraw/zinc/66/36/35/1375663635.db2.gz	YPUOWMXGMFCODH-IAGOWNOFSA-N	0	3	344.499	3.372	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)CCCC(F)(F)F	ZINC001228754661	1375665155	/nfs/dbraw/zinc/66/51/55/1375665155.db2.gz	ZHSCYXKKXZMDOF-VXGBXAGGSA-N	0	3	326.790	3.489	20	30		EGEDHN
CCc1ccccc1[C@@H]1C[C@H]1C(=O)NCCNCc1ccc(C#N)cc1	ZINC001132989155	1375697538	/nfs/dbraw/zinc/69/75/38/1375697538.db2.gz	CJVIRUNMSMEXFI-LEWJYISDSA-N	0	3	347.462	3.130	20	30		EGEDHN
C=CCCCC(=O)NC1CCN(Cc2ccc(OCC#N)cc2)CC1	ZINC001228920068	1375715175	/nfs/dbraw/zinc/71/51/75/1375715175.db2.gz	MNYQAAHSWLZFEG-UHFFFAOYSA-N	0	3	341.455	3.026	20	30		EGEDHN
C[C@@H]1CCN(C(=O)CCCF)C[C@H]1CNCc1cc(F)ccc1C#N	ZINC001133059295	1375750272	/nfs/dbraw/zinc/75/02/72/1375750272.db2.gz	OFLMIVFGXMUWQF-RHSMWYFYSA-N	0	3	349.425	3.021	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](C)[C@H](CNCc3cc(C)no3)C2)CCC1	ZINC001133105496	1375778808	/nfs/dbraw/zinc/77/88/08/1375778808.db2.gz	UMUQBJREKPJCJF-DOTOQJQBSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@H]2CN(Cc3ccc(OC)cc3)C[C@H]21	ZINC001188886828	1388400249	/nfs/dbraw/zinc/40/02/49/1388400249.db2.gz	ZYTRTFUWGNKZMQ-XKGZKEIXSA-N	0	3	342.483	3.330	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)CCCCc2ccccc2)cc1	ZINC001133208876	1375842365	/nfs/dbraw/zinc/84/23/65/1375842365.db2.gz	QUGSUCURNTWKPN-UHFFFAOYSA-N	0	3	335.451	3.177	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1cccc(F)c1	ZINC001133376921	1375956061	/nfs/dbraw/zinc/95/60/61/1375956061.db2.gz	GZFTTYXWGMLKMB-UHFFFAOYSA-N	0	3	344.817	3.344	20	30		EGEDHN
C=CCCOCC(=O)NC1CCN(Cc2ccc(C3CC3)cc2)CC1	ZINC001230411689	1376022957	/nfs/dbraw/zinc/02/29/57/1376022957.db2.gz	QGALKWAUZGEJLG-UHFFFAOYSA-N	0	3	342.483	3.237	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)c1ccsc1)NCc1ccccc1C#N	ZINC001133632344	1376127505	/nfs/dbraw/zinc/12/75/05/1376127505.db2.gz	FSDBAEMRIALKHF-ZIAGYGMSSA-N	0	3	327.453	3.306	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)c1sccc1F)Cc1cccnc1	ZINC001230751445	1376139372	/nfs/dbraw/zinc/13/93/72/1376139372.db2.gz	FOEIBFRWZCSJIN-UHFFFAOYSA-N	0	3	347.459	3.480	20	30		EGEDHN
C=CCCOCCCCC(=O)NCCCN(CC)Cc1cccnc1	ZINC001230762962	1376142886	/nfs/dbraw/zinc/14/28/86/1376142886.db2.gz	NZSQSWMBSWVITL-UHFFFAOYSA-N	0	3	347.503	3.173	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)c1ccc(Cl)o1)NCc1ccccc1C#N	ZINC001133689057	1376156622	/nfs/dbraw/zinc/15/66/22/1376156622.db2.gz	UQIOYUGFBIPPBN-CHWSQXEVSA-N	0	3	345.830	3.491	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)c1ccc(Cl)o1)NCc1ccccc1C#N	ZINC001133689060	1376156644	/nfs/dbraw/zinc/15/66/44/1376156644.db2.gz	UQIOYUGFBIPPBN-STQMWFEESA-N	0	3	345.830	3.491	20	30		EGEDHN
C#CCCN(CCCNC(=O)[C@H](C)CC(C)C)Cc1cccnc1	ZINC001230882044	1376176455	/nfs/dbraw/zinc/17/64/55/1376176455.db2.gz	MCMPNQWODULPAR-GOSISDBHSA-N	0	3	329.488	3.095	20	30		EGEDHN
C=CCCC(=O)N(C)C[C@@H]1CCN1CC[C@H](C)OCc1ccccc1	ZINC001231168871	1376211603	/nfs/dbraw/zinc/21/16/03/1376211603.db2.gz	BXLZFYKUJURRTD-ICSRJNTNSA-N	0	3	344.499	3.481	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3nc4c(s3)CCCC4)C2)C1=O	ZINC001231580938	1376269877	/nfs/dbraw/zinc/26/98/77/1376269877.db2.gz	VPKXAIGRYFTSQO-LJQANCHMSA-N	0	3	345.512	3.022	20	30		EGEDHN
C=CCOC[C@@H]1CCC[C@@]12CN(Cc1cccc(C)c1O)CCO2	ZINC001231592560	1376274323	/nfs/dbraw/zinc/27/43/23/1376274323.db2.gz	IVMYTRWQHLJMBK-AZUAARDMSA-N	0	3	331.456	3.274	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)CC(C2CCC2)C2CCC2)s1	ZINC001133946678	1376277046	/nfs/dbraw/zinc/27/70/46/1376277046.db2.gz	BYTPOQFBXGTCBI-UHFFFAOYSA-N	0	3	345.512	3.432	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)CCc1ccoc1)NCc1ccccc1C#N	ZINC001134057218	1376337196	/nfs/dbraw/zinc/33/71/96/1376337196.db2.gz	WOYCXBSHIIMYAD-CVEARBPZSA-N	0	3	339.439	3.157	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)c1cc(C)c(C)o1	ZINC001134110422	1376372795	/nfs/dbraw/zinc/37/27/95/1376372795.db2.gz	VZELJYOBPHQHGI-VXGBXAGGSA-N	0	3	343.265	3.292	20	30		EGEDHN
C#CCCCCC(=O)N[C@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001134119146	1376377359	/nfs/dbraw/zinc/37/73/59/1376377359.db2.gz	MGPOJSGKVORBCG-DLBZAZTESA-N	0	3	325.456	3.125	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@]3(C2)C(=O)Nc2ccccc23)cc1Cl	ZINC001232114924	1376401566	/nfs/dbraw/zinc/40/15/66/1376401566.db2.gz	ZPURMIYJXQFEGO-LJQANCHMSA-N	0	3	337.810	3.307	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3cc(F)c(C)c(F)c3)C2)C1=O	ZINC001232421905	1376458881	/nfs/dbraw/zinc/45/88/81/1376458881.db2.gz	ROIGLBUAWGSNFY-LJQANCHMSA-N	0	3	334.410	3.274	20	30		EGEDHN
Cc1nc(C(C)C)oc1CN[C@@H](C)C[C@H](C)NC(=O)C#CC(C)C	ZINC001134341137	1376484813	/nfs/dbraw/zinc/48/48/13/1376484813.db2.gz	KIVJAEWWTPKDHW-GJZGRUSLSA-N	0	3	333.476	3.139	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)C[C@H](C)NCc2ccncc2Cl)CCC1	ZINC001134589127	1376612647	/nfs/dbraw/zinc/61/26/47/1376612647.db2.gz	PBABELJRHFRHID-LSDHHAIUSA-N	0	3	347.890	3.302	20	30		EGEDHN
C[N@H+](Cc1ccccc1)C1CCN(Cc2ccc(C#N)cc2[O-])CC1	ZINC001233386275	1376634056	/nfs/dbraw/zinc/63/40/56/1376634056.db2.gz	NAMYIXVVHUOPQA-UHFFFAOYSA-N	0	3	335.451	3.360	20	30		EGEDHN
C[N@@H+](Cc1ccccc1)C1CCN(Cc2ccc(C#N)cc2[O-])CC1	ZINC001233386275	1376634059	/nfs/dbraw/zinc/63/40/59/1376634059.db2.gz	NAMYIXVVHUOPQA-UHFFFAOYSA-N	0	3	335.451	3.360	20	30		EGEDHN
CC(C)C#CC(=O)N(C)C[C@H]1CCN1CC[C@H]1CCc2ccccc21	ZINC001234159996	1376780325	/nfs/dbraw/zinc/78/03/25/1376780325.db2.gz	FIYLJPUCFCGKCO-WOJBJXKFSA-N	0	3	338.495	3.299	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)C1(CCF)CC1)NCc1cc(F)ccc1C#N	ZINC001135065977	1376877403	/nfs/dbraw/zinc/87/74/03/1376877403.db2.gz	MUXHSULVCWSRMI-KGLIPLIRSA-N	0	3	349.425	3.210	20	30		EGEDHN
Cc1nc(C#N)c(C#N)nc1-c1cccc(CN2CCCCC2)c1F	ZINC001236006171	1376926245	/nfs/dbraw/zinc/92/62/45/1376926245.db2.gz	RFCUFMVOBUMIST-UHFFFAOYSA-N	0	3	335.386	3.320	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](C)C[C@H](C)NCc1nccn1C(F)F	ZINC001135185507	1376959446	/nfs/dbraw/zinc/95/94/46/1376959446.db2.gz	YYXSLMUPHCKOAX-STQMWFEESA-N	0	3	342.434	3.253	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)C1CC2(CCC2)C1	ZINC001135225202	1376986904	/nfs/dbraw/zinc/98/69/04/1376986904.db2.gz	OHHBEZRPSXUQMB-QWHCGFSZSA-N	0	3	343.309	3.348	20	30		EGEDHN
CC#CCCCC(=O)N[C@H](C)C[C@H](C)NCc1ccncc1Cl	ZINC001135234512	1376991100	/nfs/dbraw/zinc/99/11/00/1376991100.db2.gz	AUBIPRUUAUWZBA-LSDHHAIUSA-N	0	3	335.879	3.302	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](O)[C@@H]2Cc2ccccc2)c(Cl)c1	ZINC001238081479	1376993204	/nfs/dbraw/zinc/99/32/04/1376993204.db2.gz	AHTIEERELCSHDG-RBUKOAKNSA-N	0	3	326.827	3.390	20	30		EGEDHN
CCc1cc(CN2CCC(C(=O)N3CCCCC3)CC2)ccc1C#N	ZINC001238778499	1377001281	/nfs/dbraw/zinc/00/12/81/1377001281.db2.gz	NSGZBOITBZVZAV-UHFFFAOYSA-N	0	3	339.483	3.345	20	30		EGEDHN
COc1ccc(-c2ccc(N3CCN(C(C)C)CC3)nc2)cc1C#N	ZINC001244708651	1377039961	/nfs/dbraw/zinc/03/99/61/1377039961.db2.gz	AKWDZTBWERVVMG-UHFFFAOYSA-N	0	3	336.439	3.159	20	30		EGEDHN
C[C@]1(C(=O)NCCNCc2ccc(C#N)cc2)CCCc2ccccc21	ZINC001135356914	1377050091	/nfs/dbraw/zinc/05/00/91/1377050091.db2.gz	NCHGCWIPBWNIPF-QFIPXVFZSA-N	0	3	347.462	3.058	20	30		EGEDHN
CCc1ccc([C@@H](C)C(=O)NCCNCc2cccc(C#N)c2)cc1	ZINC001135364173	1377054826	/nfs/dbraw/zinc/05/48/26/1377054826.db2.gz	ULUGSARIIQZTRH-MRXNPFEDSA-N	0	3	335.451	3.130	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2oc(C)nc2C)CCC1	ZINC001135394350	1377070974	/nfs/dbraw/zinc/07/09/74/1377070974.db2.gz	GJLNCCZAENYAKQ-KGLIPLIRSA-N	0	3	333.476	3.411	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](C)C[C@H](C)NCc2oc(C)nc2C)CC1	ZINC001135416189	1377083179	/nfs/dbraw/zinc/08/31/79/1377083179.db2.gz	RGMBUFSNWIYTJK-KBPBESRZSA-N	0	3	333.476	3.411	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H](C)C[C@H](C)NCc2ccncc2Cl)C1	ZINC001135417979	1377084682	/nfs/dbraw/zinc/08/46/82/1377084682.db2.gz	ASWKYBYBAGMFOM-UONOGXRCSA-N	0	3	335.879	3.464	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)C1(C(C)C)CC1	ZINC001135434460	1377095396	/nfs/dbraw/zinc/09/53/96/1377095396.db2.gz	JITARHYXXFZUTK-STQMWFEESA-N	0	3	331.298	3.204	20	30		EGEDHN
Cc1ccoc1CC(=O)N[C@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001135447352	1377100872	/nfs/dbraw/zinc/10/08/72/1377100872.db2.gz	VKMUAHXWDVYCPG-JKSUJKDBSA-N	0	3	339.439	3.075	20	30		EGEDHN
COc1cc(C#N)ccc1C(=O)N[C@@H](CN1CCCC1)c1ccccc1	ZINC001135613149	1377161773	/nfs/dbraw/zinc/16/17/73/1377161773.db2.gz	PGUOLASBYBNCJO-IBGZPJMESA-N	0	3	349.434	3.134	20	30		EGEDHN
CCC1(C(=O)N[C@H]2CCC[C@H](NCc3ccccc3C#N)C2)CC1	ZINC001266066680	1377180848	/nfs/dbraw/zinc/18/08/48/1377180848.db2.gz	FAZHGOOIDLJYMI-ROUUACIJSA-N	0	3	325.456	3.265	20	30		EGEDHN
N#CC[C@@H](C(=O)N[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1	ZINC001135797680	1377213174	/nfs/dbraw/zinc/21/31/74/1377213174.db2.gz	PQOJOZIIKZCAGW-VQTJNVASSA-N	0	3	333.435	3.075	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)C[C@H](C)NC(=O)c1cc(=O)c2ccccc2o1	ZINC001136071585	1377327197	/nfs/dbraw/zinc/32/71/97/1377327197.db2.gz	PJPFDZMBJUFOJN-STQMWFEESA-N	0	3	348.830	3.032	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@H](NC(=O)CCCC3CC3)C2)c1	ZINC001266615079	1377344705	/nfs/dbraw/zinc/34/47/05/1377344705.db2.gz	YVNRBBQRVSRMKD-QAQDUYKDSA-N	0	3	329.419	3.014	20	30		EGEDHN
N#Cc1ccccc1O[C@H]1CCCN(Cc2ccc3[nH]cnc3c2)C1	ZINC001137047727	1377465861	/nfs/dbraw/zinc/46/58/61/1377465861.db2.gz	IMRKFCBZJJPQPU-KRWDZBQOSA-N	0	3	332.407	3.478	20	30		EGEDHN
N#Cc1ccccc1O[C@H]1CCCN(Cc2ccc3nc[nH]c3c2)C1	ZINC001137047727	1377465862	/nfs/dbraw/zinc/46/58/62/1377465862.db2.gz	IMRKFCBZJJPQPU-KRWDZBQOSA-N	0	3	332.407	3.478	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cnn(C(C)C)c1)[C@@H]2CC	ZINC001137076980	1377474065	/nfs/dbraw/zinc/47/40/65/1377474065.db2.gz	ZBECYVVEICABGR-QUCCMNQESA-N	0	3	344.503	3.386	20	30		EGEDHN
CC(C)(C)OC(=O)C[C@@H]1CCN(Cc2ccc(OCC#N)cc2)C1	ZINC001137121419	1377482234	/nfs/dbraw/zinc/48/22/34/1377482234.db2.gz	KMXSDDANAMIBPG-INIZCTEOSA-N	0	3	330.428	3.143	20	30		EGEDHN
C=CCN1C(=O)CCC[C@]12CCCN(Cc1[nH]nc3ccccc31)C2	ZINC001137346022	1377527249	/nfs/dbraw/zinc/52/72/49/1377527249.db2.gz	HYGHMZBUBJCRQK-HXUWFJFHSA-N	0	3	338.455	3.096	20	30		EGEDHN
C#CCOc1ccc(CN2CCC3(CCC(=O)CC3)CC2)cc1OC	ZINC001138347464	1377707552	/nfs/dbraw/zinc/70/75/52/1377707552.db2.gz	XSKIGEOEQXVDFN-UHFFFAOYSA-N	0	3	341.451	3.433	20	30		EGEDHN
C=CCN1C(=O)CC[C@@]12CCCN(Cc1cc(F)ccc1OC)CC2	ZINC001138372376	1377711905	/nfs/dbraw/zinc/71/19/05/1377711905.db2.gz	OMFYYXYRAYGONG-HXUWFJFHSA-N	0	3	346.446	3.367	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CCN(c3ccc(C#N)cc3)CC2)c1[O-]	ZINC001138628860	1377756800	/nfs/dbraw/zinc/75/68/00/1377756800.db2.gz	HTOFMRBPDZMOHH-UHFFFAOYSA-N	0	3	333.435	3.315	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCCN(c3ccc(C#N)cn3)CC2)c1[O-]	ZINC001138628107	1377756804	/nfs/dbraw/zinc/75/68/04/1377756804.db2.gz	NXSOHBVRZHONPG-UHFFFAOYSA-N	0	3	348.450	3.100	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCCN(c3ccc(C#N)cn3)CC2)c1[O-]	ZINC001138628107	1377756805	/nfs/dbraw/zinc/75/68/05/1377756805.db2.gz	NXSOHBVRZHONPG-UHFFFAOYSA-N	0	3	348.450	3.100	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@@H](Oc3cc(OC)ccn3)C2)c1[O-]	ZINC001138631370	1377757401	/nfs/dbraw/zinc/75/74/01/1377757401.db2.gz	QTXJCEKFKUWGAJ-GOSISDBHSA-N	0	3	340.423	3.178	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@@H](Oc3cc(OC)ccn3)C2)c1[O-]	ZINC001138631370	1377757406	/nfs/dbraw/zinc/75/74/06/1377757406.db2.gz	QTXJCEKFKUWGAJ-GOSISDBHSA-N	0	3	340.423	3.178	20	30		EGEDHN
C=CCOc1ccccc1CN1CCC[C@]2(CCN(CC)C2=O)C1	ZINC001139032256	1377820272	/nfs/dbraw/zinc/82/02/72/1377820272.db2.gz	IFTOTFAAVGXGFY-FQEVSTJZSA-N	0	3	328.456	3.086	20	30		EGEDHN
C=CCOc1ccccc1CN1CC[C@@H]2[C@H](CCN2C(=O)C(C)C)C1	ZINC001139032586	1377820380	/nfs/dbraw/zinc/82/03/80/1377820380.db2.gz	PWYDKMSEZVDITA-IEBWSBKVSA-N	0	3	342.483	3.330	20	30		EGEDHN
CCOC(=O)C1CCN(Cc2ccc(-c3cc(C#N)ccn3)cc2)CC1	ZINC001139401951	1377879165	/nfs/dbraw/zinc/87/91/65/1377879165.db2.gz	ISXRVJOBTOYFRB-UHFFFAOYSA-N	0	3	349.434	3.395	20	30		EGEDHN
COc1ccnc(O[C@H]2CCN(Cc3c[nH]c4c3cccc4C#N)C2)c1	ZINC001139707952	1377939271	/nfs/dbraw/zinc/93/92/71/1377939271.db2.gz	ZROGGHWPFSMMAB-KRWDZBQOSA-N	0	3	348.406	3.096	20	30		EGEDHN
C=CCO[C@@H]1CO[C@@]2(C1)CCCN(Cc1ccc(C)c(C#N)c1)C2	ZINC001139723762	1377941248	/nfs/dbraw/zinc/94/12/48/1377941248.db2.gz	FUIQBWFFVFNCEL-VQTJNVASSA-N	0	3	326.440	3.193	20	30		EGEDHN
C=CCO[C@H]1CO[C@]2(C1)CCCN(Cc1ccc(C)c(C#N)c1)C2	ZINC001139723760	1377941720	/nfs/dbraw/zinc/94/17/20/1377941720.db2.gz	FUIQBWFFVFNCEL-UXHICEINSA-N	0	3	326.440	3.193	20	30		EGEDHN
C=CCn1cc(CN2CCC(c3cccc(C(=O)OC)c3)CC2)cn1	ZINC001139770864	1377948532	/nfs/dbraw/zinc/94/85/32/1377948532.db2.gz	DUTXTIMTCCHEHV-UHFFFAOYSA-N	0	3	339.439	3.235	20	30		EGEDHN
C#CC1CCN(Cc2ccc3n2CCN(C(=O)OC(C)(C)C)C3)CC1	ZINC001139927540	1377977720	/nfs/dbraw/zinc/97/77/20/1377977720.db2.gz	IUFIBUPCXPTAQP-UHFFFAOYSA-N	0	3	343.471	3.084	20	30		EGEDHN
Cn1ncc2cc(CN3CCC[C@@H](Oc4ccccc4C#N)C3)ccc21	ZINC001139952268	1377982552	/nfs/dbraw/zinc/98/25/52/1377982552.db2.gz	FQALMFDDEWCPDD-LJQANCHMSA-N	0	3	346.434	3.488	20	30		EGEDHN
Cn1ncc2cc(CN3CCC[C@H](Oc4ccccc4C#N)C3)ccc21	ZINC001139952267	1377982739	/nfs/dbraw/zinc/98/27/39/1377982739.db2.gz	FQALMFDDEWCPDD-IBGZPJMESA-N	0	3	346.434	3.488	20	30		EGEDHN
CCN(CCNC(=O)OC(C)(C)C)Cc1c[nH]c2ccc(C#N)cc12	ZINC001140116063	1378011777	/nfs/dbraw/zinc/01/17/77/1378011777.db2.gz	PYCVWUUYZZWGHF-UHFFFAOYSA-N	0	3	342.443	3.386	20	30		EGEDHN
N#Cc1ccc2[nH]cc(CN3CCC[C@H](Oc4ccncc4)C3)c2c1	ZINC001140116951	1378011926	/nfs/dbraw/zinc/01/19/26/1378011926.db2.gz	ISSSDUUAKFWUOH-SFHVURJKSA-N	0	3	332.407	3.478	20	30		EGEDHN
C=CCOC(=O)N[C@@H]1CCCN(Cc2cccc3cnccc32)C1	ZINC001140146687	1378020964	/nfs/dbraw/zinc/02/09/64/1378020964.db2.gz	PDWWRRAVRAMXTQ-QGZVFWFLSA-N	0	3	325.412	3.111	20	30		EGEDHN
C=CCO[C@@H]1CO[C@@]2(C1)CCCN(Cc1ccc(C)c(OC)c1)C2	ZINC001140157979	1378022974	/nfs/dbraw/zinc/02/29/74/1378022974.db2.gz	ANUSHJVBGVCASG-AZUAARDMSA-N	0	3	331.456	3.330	20	30		EGEDHN
C#CCN1CC[C@]2(CCCN(Cc3cccc(F)c3Cl)CC2)C1=O	ZINC001272608334	1378075826	/nfs/dbraw/zinc/07/58/26/1378075826.db2.gz	OYFNZJCDELRDFJ-LJQANCHMSA-N	0	3	348.849	3.317	20	30		EGEDHN
C=CCN1c2ccccc2[C@@]2(CC[N@@H+](Cc3ccccc3[O-])C2)C1=O	ZINC001272619072	1378076405	/nfs/dbraw/zinc/07/64/05/1378076405.db2.gz	RFJGDSUXEZBHHE-NRFANRHFSA-N	0	3	334.419	3.069	20	30		EGEDHN
C=CCN1c2ccccc2[C@@]2(CC[N@H+](Cc3ccccc3[O-])C2)C1=O	ZINC001272619072	1378076409	/nfs/dbraw/zinc/07/64/09/1378076409.db2.gz	RFJGDSUXEZBHHE-NRFANRHFSA-N	0	3	334.419	3.069	20	30		EGEDHN
C=CCN1CCC2(CCN(Cc3ccc4cccnc4c3)CC2)C1=O	ZINC001273008450	1378084904	/nfs/dbraw/zinc/08/49/04/1378084904.db2.gz	KWLXVOWRYYTQIV-UHFFFAOYSA-N	0	3	335.451	3.235	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(CCCN2Cc2cc(C)c(OC)c(C)c2)C1=O	ZINC001273326778	1378098135	/nfs/dbraw/zinc/09/81/35/1378098135.db2.gz	KCFZWORZYNVUOV-NRFANRHFSA-N	0	3	342.483	3.455	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@@]23CCN(CC(=C)C)C3=O)c1[O-]	ZINC001273360515	1378099110	/nfs/dbraw/zinc/09/91/10/1378099110.db2.gz	POVDLOUMOGGKLA-NRFANRHFSA-N	0	3	340.467	3.264	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@@]23CCN(CC(=C)C)C3=O)c1[O-]	ZINC001273360515	1378099114	/nfs/dbraw/zinc/09/91/14/1378099114.db2.gz	POVDLOUMOGGKLA-NRFANRHFSA-N	0	3	340.467	3.264	20	30		EGEDHN
C=CCN1CC[C@@]2(CCN(Cc3ccc(Cl)c(C)c3F)C2)C1=O	ZINC001274473303	1378125962	/nfs/dbraw/zinc/12/59/62/1378125962.db2.gz	PFFCXMYSOCHXRG-GOSISDBHSA-N	0	3	336.838	3.398	20	30		EGEDHN
Cc1ccsc1C(=O)NCC[C@H](C)NCc1cc(C#N)ccc1F	ZINC001274670666	1378133373	/nfs/dbraw/zinc/13/33/73/1378133373.db2.gz	UVQJXWUUDCJVQD-ZDUSSCGKSA-N	0	3	345.443	3.366	20	30		EGEDHN
C#CCN1CC[C@@]2(CCCN(Cc3cccc4cccnc43)CC2)C1=O	ZINC001275532358	1378141139	/nfs/dbraw/zinc/14/11/39/1378141139.db2.gz	JWOQVVSGVBHNDX-QFIPXVFZSA-N	0	3	347.462	3.073	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@]3(CC[N@@H+](C4CCCC4)C3)C2)c([O-])c1	ZINC001276494227	1378175606	/nfs/dbraw/zinc/17/56/06/1378175606.db2.gz	QREIVUAZOLRKDZ-NRFANRHFSA-N	0	3	339.483	3.494	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@]3(CC[N@H+](C4CCCC4)C3)C2)c([O-])c1	ZINC001276494227	1378175608	/nfs/dbraw/zinc/17/56/08/1378175608.db2.gz	QREIVUAZOLRKDZ-NRFANRHFSA-N	0	3	339.483	3.494	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@@H]1CC[N@@H+](Cc1ccc(C)cc1[O-])C2	ZINC001140952054	1378190280	/nfs/dbraw/zinc/19/02/80/1378190280.db2.gz	CRRRTHZQRAKIKM-UXHICEINSA-N	0	3	331.456	3.274	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@@H]1CC[N@H+](Cc1ccc(C)cc1[O-])C2	ZINC001140952054	1378190286	/nfs/dbraw/zinc/19/02/86/1378190286.db2.gz	CRRRTHZQRAKIKM-UXHICEINSA-N	0	3	331.456	3.274	20	30		EGEDHN
COC(=O)CCN(Cc1sc(N)c(C#N)c1Cl)C1CCCC1	ZINC001141112363	1378242533	/nfs/dbraw/zinc/24/25/33/1378242533.db2.gz	ZYYZSDWCVDWWBP-UHFFFAOYSA-N	0	3	341.864	3.163	20	30		EGEDHN
CCOC[C@@]12CCC[C@@H]1CN(Cc1sc(N)c(C#N)c1Cl)C2	ZINC001141109826	1378242711	/nfs/dbraw/zinc/24/27/11/1378242711.db2.gz	VFFIAVLHFQBJKE-BZNIZROVSA-N	0	3	339.892	3.494	20	30		EGEDHN
Cc1ccc(C#N)c(NC(=O)[C@@]23C[C@@H]2CN(Cc2ccccc2F)C3)c1	ZINC001279945282	1378325236	/nfs/dbraw/zinc/32/52/36/1378325236.db2.gz	YDAZBRRWMSYMLX-DYESRHJHSA-N	0	3	349.409	3.466	20	30		EGEDHN
N#Cc1ccc(Br)c(CN2CCC3SC(=O)C=C3C2)c1	ZINC001141655848	1378359850	/nfs/dbraw/zinc/35/98/50/1378359850.db2.gz	LKUMJOYASOYSHZ-CQSZACIVSA-N	0	3	349.253	3.095	20	30		EGEDHN
C[C@@H]1CN(Cc2c[nH]c3cc(C#N)ccc23)CC[C@@]1(O)C(F)(F)F	ZINC001142911741	1378508066	/nfs/dbraw/zinc/50/80/66/1378508066.db2.gz	HTCKJRCZHVKWBY-BZNIZROVSA-N	0	3	337.345	3.175	20	30		EGEDHN
CC(=O)N(C(C)C)C1CCN(Cc2c[nH]c3cc(C#N)ccc23)CC1	ZINC001142926332	1378510000	/nfs/dbraw/zinc/51/00/00/1378510000.db2.gz	ONDKTKVJASRWPX-UHFFFAOYSA-N	0	3	338.455	3.261	20	30		EGEDHN
COc1ccnc(O[C@H]2CCN(Cc3c[nH]c4cc(C#N)ccc34)C2)c1	ZINC001142930309	1378511310	/nfs/dbraw/zinc/51/13/10/1378511310.db2.gz	IUUKHWSXTODPGN-KRWDZBQOSA-N	0	3	348.406	3.096	20	30		EGEDHN
Cc1nccnc1O[C@H]1CCCN(Cc2c[nH]c3cc(C#N)ccc23)C1	ZINC001142931393	1378511324	/nfs/dbraw/zinc/51/13/24/1378511324.db2.gz	PVERZXGQXCSBGH-KRWDZBQOSA-N	0	3	347.422	3.181	20	30		EGEDHN
N#Cc1ccc(F)c(CN2CC[C@@H](N3CCCCC3)[C@@H](F)C2)c1F	ZINC001143178902	1378554880	/nfs/dbraw/zinc/55/48/80/1378554880.db2.gz	PYKSLQFVIYNLPM-DLBZAZTESA-N	0	3	337.389	3.235	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@@H]1CCN(Cc1cc3cccnc3[nH]1)C2	ZINC001143214361	1378562097	/nfs/dbraw/zinc/56/20/97/1378562097.db2.gz	OCJMAPFNICPJOX-QUCCMNQESA-N	0	3	341.455	3.137	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cccc(F)c1OC)CC2	ZINC001143528885	1378609613	/nfs/dbraw/zinc/60/96/13/1378609613.db2.gz	KSXXDEFPGGNURE-FQEVSTJZSA-N	0	3	346.446	3.367	20	30		EGEDHN
C#Cc1ccc(CN2CC[C@H](N3Cc4ccccc4NC3=O)C2)cc1	ZINC001144581698	1378747840	/nfs/dbraw/zinc/74/78/40/1378747840.db2.gz	YNXQQYKJCPFOMF-IBGZPJMESA-N	0	3	331.419	3.290	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)C[C@H](C)NCc2ocnc2C)CCCCC1	ZINC001146702705	1378902662	/nfs/dbraw/zinc/90/26/62/1378902662.db2.gz	ZQBMZPKPAHCELB-JKSUJKDBSA-N	0	3	345.487	3.330	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2conc2C)CCCCC1	ZINC001146702624	1378903172	/nfs/dbraw/zinc/90/31/72/1378903172.db2.gz	YHDOUAZPGIBKTP-HZPDHXFCSA-N	0	3	345.487	3.330	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)c1ccc(F)s1	ZINC001146712448	1378905300	/nfs/dbraw/zinc/90/53/00/1378905300.db2.gz	BMDWMNOMZZUVPB-VHSXEESVSA-N	0	3	349.269	3.282	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2cc(OC)no2)CCCC1	ZINC001146823100	1378929160	/nfs/dbraw/zinc/92/91/60/1378929160.db2.gz	XZJIMCZWRWMRKQ-HUUCEWRRSA-N	0	3	349.475	3.193	20	30		EGEDHN
C=CCCC(=O)N1CC2(C1)CCN(CCO[C@H]1CCCC[C@H]1C)C2	ZINC001147186818	1378983904	/nfs/dbraw/zinc/98/39/04/1378983904.db2.gz	CVMRDADNIKFUMD-MSOLQXFVSA-N	0	3	334.504	3.082	20	30		EGEDHN
Cc1cocc1C(=O)N(C)[C@@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001283530620	1379003103	/nfs/dbraw/zinc/00/31/03/1379003103.db2.gz	PJTZZKJQULERBH-KRWDZBQOSA-N	0	3	343.452	3.162	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)c2ccc3c(c2)CCC=C3)ccc1F	ZINC001148058218	1379110663	/nfs/dbraw/zinc/11/06/63/1379110663.db2.gz	TUCJHWYGWQGTFF-UHFFFAOYSA-N	0	3	349.409	3.176	20	30		EGEDHN
C#CCCCCCC(=O)N1CC2(C1)CCN(Cc1cnccc1C)C2	ZINC001148059894	1379110895	/nfs/dbraw/zinc/11/08/95/1379110895.db2.gz	PRESTOVFOHTIEC-UHFFFAOYSA-N	0	3	339.483	3.008	20	30		EGEDHN
C[C@H](CN(C)C(=O)C1(F)CCCCC1)NCc1ccc(C#N)s1	ZINC001283691725	1379120749	/nfs/dbraw/zinc/12/07/49/1379120749.db2.gz	DRVJXTICPKIEFY-CYBMUJFWSA-N	0	3	337.464	3.229	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC2(C1)CCN(CCc1csc(C)n1)C2	ZINC001148130368	1379122780	/nfs/dbraw/zinc/12/27/80/1379122780.db2.gz	MPPNDPWBGKCLTG-MRXNPFEDSA-N	0	3	347.528	3.131	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC2(C1)CCN(Cc1ccc(C)nc1C)C2	ZINC001148147539	1379125704	/nfs/dbraw/zinc/12/57/04/1379125704.db2.gz	WCGRNLZHFYTDIH-MRXNPFEDSA-N	0	3	341.499	3.335	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC2(C1)CCN(Cc1ccc(C)nc1C)C2	ZINC001148357355	1379156074	/nfs/dbraw/zinc/15/60/74/1379156074.db2.gz	KNEZKCDCKROCRS-UHFFFAOYSA-N	0	3	341.499	3.335	20	30		EGEDHN
CC(C)C[C@H](C)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001148496996	1379190402	/nfs/dbraw/zinc/19/04/02/1379190402.db2.gz	UBMYOSMKBJSCLD-KRWDZBQOSA-N	0	3	339.483	3.275	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2cccc(C(F)F)c2)c1	ZINC001148564409	1379212311	/nfs/dbraw/zinc/21/23/11/1379212311.db2.gz	VXJHEIXAEXJDIU-UHFFFAOYSA-N	0	3	329.350	3.015	20	30		EGEDHN
CCCCCCCCCCC(=O)NCCNCC(=O)N[C@@H](C)CC	ZINC001148764822	1379264194	/nfs/dbraw/zinc/26/41/94/1379264194.db2.gz	YSBMIFNNJYOOAH-KRWDZBQOSA-N	0	3	341.540	3.138	20	30		EGEDHN
CCCCCCCCCC(=O)NCCN[C@H](C)C(=O)N(C)C(C)C	ZINC001148827041	1379277565	/nfs/dbraw/zinc/27/75/65/1379277565.db2.gz	TXXWGKWASLPODM-QGZVFWFLSA-N	0	3	341.540	3.088	20	30		EGEDHN
C#CCCCC(=O)NC[C@@H]1CN([C@@H](C)c2cccc(C)c2)CCCO1	ZINC001149646470	1379419360	/nfs/dbraw/zinc/41/93/60/1379419360.db2.gz	NIFBUCACYOMUHJ-AZUAARDMSA-N	0	3	342.483	3.067	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)CCc2ccc(C)cc2C)C1	ZINC001150048061	1379489855	/nfs/dbraw/zinc/48/98/55/1379489855.db2.gz	UJEDQJVAIBMFBP-HXUWFJFHSA-N	0	3	344.499	3.019	20	30		EGEDHN
CCC[C@H](C(=O)NCCNCc1cccc(C#N)c1)c1ccccc1	ZINC001150058709	1379490278	/nfs/dbraw/zinc/49/02/78/1379490278.db2.gz	UWUYIALAEUDBBU-FQEVSTJZSA-N	0	3	335.451	3.348	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H]1CN(Cc2ccc(C)c(C)c2)CCCO1	ZINC001150084517	1379492095	/nfs/dbraw/zinc/49/20/95/1379492095.db2.gz	FALNXIFAPFWDOK-LJQANCHMSA-N	0	3	344.499	3.223	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@H]1CN(Cc2ccccc2C)CCCO1	ZINC001150245973	1379521625	/nfs/dbraw/zinc/52/16/25/1379521625.db2.gz	BMCYOBMPMBMPRC-FPOVZHCZSA-N	0	3	344.499	3.304	20	30		EGEDHN
Cc1ccc(C(C)(C)CC(=O)NCCNCc2cccc(C#N)c2)cc1	ZINC001150376389	1379541257	/nfs/dbraw/zinc/54/12/57/1379541257.db2.gz	BLRYDWUJDLASIZ-UHFFFAOYSA-N	0	3	349.478	3.440	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)CC[C@H](C)c2ccccc2)C1	ZINC001150395962	1379546884	/nfs/dbraw/zinc/54/68/84/1379546884.db2.gz	XWCBWKWGFHQZCL-ICSRJNTNSA-N	0	3	344.499	3.354	20	30		EGEDHN
C#CCCN1CCCO[C@H](CNC(=O)[C@@](C)(CC)CCCCC)C1	ZINC001150796855	1379616959	/nfs/dbraw/zinc/61/69/59/1379616959.db2.gz	XVIAGOSZWKAHLY-QUCCMNQESA-N	0	3	336.520	3.213	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2ccc([C@@H]3C[C@@H]3C)o2)CC1	ZINC001151128611	1379665184	/nfs/dbraw/zinc/66/51/84/1379665184.db2.gz	QGKMTBUEGSOXDE-JKSUJKDBSA-N	0	3	346.471	3.190	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@@H]2CCCC[C@@H]2C)CC1	ZINC001151281339	1379691937	/nfs/dbraw/zinc/69/19/37/1379691937.db2.gz	JGRLDTMDCBITFD-ZWKOTPCHSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)C2CCC(F)CC2)CC1	ZINC001151294667	1379694843	/nfs/dbraw/zinc/69/48/43/1379694843.db2.gz	PEHIMOKSPDNIEI-UHFFFAOYSA-N	0	3	340.483	3.078	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@H](C)C2CCCC2)CC1	ZINC001151387619	1379709428	/nfs/dbraw/zinc/70/94/28/1379709428.db2.gz	OKOMGHNJJURGCE-QGZVFWFLSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@@H]2CCCC[C@@H]2CC)CC1	ZINC001151382134	1379709561	/nfs/dbraw/zinc/70/95/61/1379709561.db2.gz	YJJRBZMSZQOFKT-ZWKOTPCHSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@@H](C)c2ccccc2)CC1	ZINC001151398974	1379711017	/nfs/dbraw/zinc/71/10/17/1379711017.db2.gz	KRAIGCQICGHCLE-SFHVURJKSA-N	0	3	344.499	3.354	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)c1ccsc1	ZINC001151778378	1379778478	/nfs/dbraw/zinc/77/84/78/1379778478.db2.gz	QYLZNYGYXVBTKS-CQSZACIVSA-N	0	3	327.453	3.260	20	30		EGEDHN
C=C[C@H](CC(=O)NCCNCc1sc(C)nc1C)c1ccccc1	ZINC001151942397	1379821335	/nfs/dbraw/zinc/82/13/35/1379821335.db2.gz	HRBFMMRMQSLWTD-MRXNPFEDSA-N	0	3	343.496	3.326	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)[C@@H]2CCCCc3ccccc32)c1	ZINC001152754548	1379978555	/nfs/dbraw/zinc/97/85/55/1379978555.db2.gz	QOSHQGNNYROFEV-OAQYLSRUSA-N	0	3	347.462	3.274	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)[C@@H]2CCCCc3ccccc32)cc1	ZINC001152754067	1379978574	/nfs/dbraw/zinc/97/85/74/1379978574.db2.gz	NBKOAQDPGXUVHF-OAQYLSRUSA-N	0	3	347.462	3.274	20	30		EGEDHN
CC[C@@H](C(=O)NCCNCc1ccc(C#N)s1)c1ccc(F)cc1	ZINC001152797416	1379981813	/nfs/dbraw/zinc/98/18/13/1379981813.db2.gz	ZXDRFXLUVFSRQY-QGZVFWFLSA-N	0	3	345.443	3.158	20	30		EGEDHN
CC[C@H](C(=O)NCCNCc1ccc(C#N)s1)c1ccc(F)cc1	ZINC001152797415	1379981960	/nfs/dbraw/zinc/98/19/60/1379981960.db2.gz	ZXDRFXLUVFSRQY-KRWDZBQOSA-N	0	3	345.443	3.158	20	30		EGEDHN
CC[C@@H](C(=O)NCCNCc1ccc(C#N)cc1)c1ccc(F)cc1	ZINC001152797182	1379981965	/nfs/dbraw/zinc/98/19/65/1379981965.db2.gz	VSJLXRBUFZRRKF-LJQANCHMSA-N	0	3	339.414	3.097	20	30		EGEDHN
CC[C@H](C(=O)NCCNCc1cccc(C#N)c1)c1ccc(F)cc1	ZINC001152795945	1379981983	/nfs/dbraw/zinc/98/19/83/1379981983.db2.gz	FJHHBYWRQRPJGS-IBGZPJMESA-N	0	3	339.414	3.097	20	30		EGEDHN
Cc1ccccc1C[C@H](C)C(=O)NCCNCc1ccc(C#N)s1	ZINC001152832235	1379985364	/nfs/dbraw/zinc/98/53/64/1379985364.db2.gz	XRBZNOWXWOWBJJ-HNNXBMFYSA-N	0	3	341.480	3.013	20	30		EGEDHN
CC(C)Cc1ccccc1C(=O)NCCNCc1cccc(C#N)c1	ZINC001152941350	1379997162	/nfs/dbraw/zinc/99/71/62/1379997162.db2.gz	CSGVKXLXPJHSCD-UHFFFAOYSA-N	0	3	335.451	3.276	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NCCN[C@H](C)c1ccc(Cl)c(Cl)c1	ZINC001153148524	1380027613	/nfs/dbraw/zinc/02/76/13/1380027613.db2.gz	FTPVTYBDYMRPJL-NEPJUHHUSA-N	0	3	345.270	3.351	20	30		EGEDHN
CCN(Cc1cc2ccccc2o1)[C@H](C)CNC(=O)C#CC(C)C	ZINC001153207794	1380035603	/nfs/dbraw/zinc/03/56/03/1380035603.db2.gz	VERSDAUOQPJQHT-MRXNPFEDSA-N	0	3	326.440	3.419	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)cc1	ZINC001153594277	1380099912	/nfs/dbraw/zinc/09/99/12/1380099912.db2.gz	NEYRXBVJUMCHLJ-MRXNPFEDSA-N	0	3	327.472	3.487	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)C[C@@H]1C[C@H]1C1CC1	ZINC001154385466	1380268570	/nfs/dbraw/zinc/26/85/70/1380268570.db2.gz	KUKIQMWBAHYHRI-XPGWFJOJSA-N	0	3	339.483	3.321	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)[C@]12C[C@H]1CCC2	ZINC001154396892	1380269282	/nfs/dbraw/zinc/26/92/82/1380269282.db2.gz	WMPVJSVZDALUJR-WIBUTAKZSA-N	0	3	343.446	3.214	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)[C@]1(C)C[C@H]2C[C@H]2C1	ZINC001154443721	1380278818	/nfs/dbraw/zinc/27/88/18/1380278818.db2.gz	AKNJIBFIEOHQSM-KBMWQNTOSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H](C)N(CC)Cc1cccc(C#N)c1	ZINC001154584783	1380310811	/nfs/dbraw/zinc/31/08/11/1380310811.db2.gz	XRSODNQYKQXBLL-MRXNPFEDSA-N	0	3	327.472	3.487	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)NC[C@@H](C)N(CC)Cc1ccc(C)c(F)c1	ZINC001155325928	1380437942	/nfs/dbraw/zinc/43/79/42/1380437942.db2.gz	LYJYDUISOCIJNV-SUMDDJOVSA-N	0	3	348.462	3.052	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)c(F)c1	ZINC001155360519	1380442168	/nfs/dbraw/zinc/44/21/68/1380442168.db2.gz	SFAPYYQEPRQRFD-FRFSOERESA-N	0	3	331.435	3.070	20	30		EGEDHN
CCN(CC#CCOC)[C@H](C)CNC(=O)C[C@H](C)C1CCCCC1	ZINC001155782109	1380491816	/nfs/dbraw/zinc/49/18/16/1380491816.db2.gz	BBDSOTARNUIWBR-ZWKOTPCHSA-N	0	3	336.520	3.069	20	30		EGEDHN
C=CCOCCCC(=O)NCCCNCc1cccc(F)c1Cl	ZINC001156159600	1380533324	/nfs/dbraw/zinc/53/33/24/1380533324.db2.gz	AVKDFMQHVCCGFT-UHFFFAOYSA-N	0	3	342.842	3.058	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)[C@@H]1CC12CCCC2	ZINC001156201121	1380541275	/nfs/dbraw/zinc/54/12/75/1380541275.db2.gz	VUJTUQBQEYPFKI-APWZRJJASA-N	0	3	339.483	3.465	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NC[C@@H](C)N(CC)Cc1cc(C)sc1C	ZINC001157217014	1380813250	/nfs/dbraw/zinc/81/32/50/1380813250.db2.gz	GDJIPRKFAJUGLS-HIFRSBDPSA-N	0	3	338.517	3.283	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)CCCOC(C)C	ZINC001157274543	1380830450	/nfs/dbraw/zinc/83/04/50/1380830450.db2.gz	XVABMLGPQYQJBS-QGZVFWFLSA-N	0	3	345.487	3.090	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)N1CC[C@@H](c2ccccc2OC)C1	ZINC001157569513	1380967995	/nfs/dbraw/zinc/96/79/95/1380967995.db2.gz	ZXOVMAHUGRRORB-AEFFLSMTSA-N	0	3	330.472	3.475	20	30		EGEDHN
N#Cc1cnc(Cl)cc1C(F)(F)N1CCN[C@H](c2ccccc2)C1	ZINC001157764634	1381026446	/nfs/dbraw/zinc/02/64/46/1381026446.db2.gz	CLRZJIQXBQDAAH-HNNXBMFYSA-N	0	3	348.784	3.302	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1c(C)coc1C	ZINC001157919694	1381071817	/nfs/dbraw/zinc/07/18/17/1381071817.db2.gz	LAKKLWGYAPCISN-QGZVFWFLSA-N	0	3	334.460	3.026	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)Cc1cccc2ncccc12	ZINC001158217265	1381162875	/nfs/dbraw/zinc/16/28/75/1381162875.db2.gz	KSDAIMBJVQGECU-GOSISDBHSA-N	0	3	337.467	3.276	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1coc(C2CCCC2)n1	ZINC001158660415	1381340888	/nfs/dbraw/zinc/34/08/88/1381340888.db2.gz	JUBJDBQUFUCLJP-MRXNPFEDSA-N	0	3	331.460	3.445	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1c[nH]c2ccc(F)cc12	ZINC001158976804	1381493547	/nfs/dbraw/zinc/49/35/47/1381493547.db2.gz	MPZWKYLXTRBYDT-OAHLLOKOSA-N	0	3	329.419	3.420	20	30		EGEDHN
CC[C@H](C)C(=O)NCCC1=CCN(Cc2ccc(C#N)cc2)CC1	ZINC001159325458	1381762949	/nfs/dbraw/zinc/76/29/49/1381762949.db2.gz	KVPXWCKHPYIWSV-INIZCTEOSA-N	0	3	325.456	3.243	20	30		EGEDHN
C[C@H](NC[C@H](O)CC(C)(C)C#N)c1ccc(F)cc1OC(F)F	ZINC001328483001	1388760366	/nfs/dbraw/zinc/76/03/66/1388760366.db2.gz	VRTCJJYEAJGEKT-CMPLNLGQSA-N	0	3	330.350	3.378	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCC1=CCN(CCOCC(C)C)CC1	ZINC001160941772	1382244288	/nfs/dbraw/zinc/24/42/88/1382244288.db2.gz	PKLSHZPEYOQTGQ-QZTJIDSGSA-N	0	3	336.520	3.256	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc(Cl)cc2OC)CC1	ZINC001161020669	1382275905	/nfs/dbraw/zinc/27/59/05/1382275905.db2.gz	HMBHDCLWMQHPNY-UHFFFAOYSA-N	0	3	346.858	3.124	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H](C)OC2CCCCCC2)CC1	ZINC001161177577	1382326552	/nfs/dbraw/zinc/32/65/52/1382326552.db2.gz	BBPIHIKZYXOAER-QGZVFWFLSA-N	0	3	334.504	3.439	20	30		EGEDHN
Cc1c[nH]cc1C(=O)NCCC1=CCN(Cc2ccc(C#N)cc2)CC1	ZINC001161862413	1382533577	/nfs/dbraw/zinc/53/35/77/1382533577.db2.gz	CWKSNEIZNXXAHB-UHFFFAOYSA-N	0	3	348.450	3.147	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H](C)Cc2ccccc2C)CC1	ZINC001161968334	1382577093	/nfs/dbraw/zinc/57/70/93/1382577093.db2.gz	OTFNOHDSWGEXFB-SFHVURJKSA-N	0	3	326.484	3.498	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H](C)Cc2ccc(F)cc2)CC1	ZINC001161983293	1382587625	/nfs/dbraw/zinc/58/76/25/1382587625.db2.gz	ZOJDTJKHSDJLIO-INIZCTEOSA-N	0	3	330.447	3.329	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@@H]2CCC[C@H]2CCC)(COC)CC1	ZINC001162335273	1382732420	/nfs/dbraw/zinc/73/24/20/1382732420.db2.gz	HPVPEBKQXUGHAX-RTBURBONSA-N	0	3	348.531	3.071	20	30		EGEDHN
C#CCN1CCC(CNC(=O)C[C@@H](C)CCC=C(C)C)(COC)CC1	ZINC001162507513	1382776004	/nfs/dbraw/zinc/77/60/04/1382776004.db2.gz	ZBMMYHXTTNPEQQ-IBGZPJMESA-N	0	3	348.531	3.237	20	30		EGEDHN
C#CCN1CCC(CNC(=O)[C@H](C)CCCCCC)(COC)CC1	ZINC001162539108	1382784038	/nfs/dbraw/zinc/78/40/38/1382784038.db2.gz	GRFYJRUPZCGLFU-GOSISDBHSA-N	0	3	336.520	3.071	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C1C(C)(C)C1(C)C	ZINC001162756516	1382860465	/nfs/dbraw/zinc/86/04/65/1382860465.db2.gz	ISUHMTBQAXTZBS-UHFFFAOYSA-N	0	3	340.511	3.353	20	30		EGEDHN
C=CC(C)(C)CC(=O)N(CCNCC#CC)CCc1ccccc1	ZINC001162822404	1382887244	/nfs/dbraw/zinc/88/72/44/1382887244.db2.gz	ODAKDROTGOEOOV-UHFFFAOYSA-N	0	3	326.484	3.273	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CC[C@H](C)C1	ZINC001162952493	1382925896	/nfs/dbraw/zinc/92/58/96/1382925896.db2.gz	RBBRAOOJRJOPAN-AZUAARDMSA-N	0	3	326.484	3.107	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1C[C@H]1C1CCCC1	ZINC001162970775	1382931891	/nfs/dbraw/zinc/93/18/91/1382931891.db2.gz	KVZQMCJCKHQFNY-LEWJYISDSA-N	0	3	338.495	3.107	20	30		EGEDHN
N#Cc1ccc(CNCC2(CCNC(=O)C3CCCC3)CC2)c(F)c1	ZINC001163128060	1382971392	/nfs/dbraw/zinc/97/13/92/1382971392.db2.gz	LLVUFZNSCKGMJX-UHFFFAOYSA-N	0	3	343.446	3.264	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@@H]1CCCC[C@H]1C1CC1	ZINC001163173261	1382984432	/nfs/dbraw/zinc/98/44/32/1382984432.db2.gz	WTIMTWNYXDLKOA-LSDHHAIUSA-N	0	3	343.309	3.207	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCCN[C@@H](C)c2cc(F)ccc2F)cc1	ZINC001163756002	1383118307	/nfs/dbraw/zinc/11/83/07/1383118307.db2.gz	CFRRSJXTWWZXHD-AWEZNQCLSA-N	0	3	342.389	3.417	20	30		EGEDHN
N#Cc1ccccc1CNCC1(CCNC(=O)CCC2CC2)CC1	ZINC001163899977	1383134085	/nfs/dbraw/zinc/13/40/85/1383134085.db2.gz	WLRZJFWZBOOIQO-UHFFFAOYSA-N	0	3	325.456	3.125	20	30		EGEDHN
N#Cc1ccc(CNCC2(CCNC(=O)/C=C\C3CC3)CC2)c(F)c1	ZINC001163940530	1383137856	/nfs/dbraw/zinc/13/78/56/1383137856.db2.gz	NSXPZCMPZQDAMK-XQRVVYSFSA-N	0	3	341.430	3.040	20	30		EGEDHN
N#Cc1ccc(F)c(CNCC2(CCNC(=O)CC3CCC3)CC2)c1	ZINC001163960448	1383140027	/nfs/dbraw/zinc/14/00/27/1383140027.db2.gz	ZTQRVEGGIWHECG-UHFFFAOYSA-N	0	3	343.446	3.264	20	30		EGEDHN
N#Cc1ccc(CNCC2(CCNC(=O)C=C3CCC3)CC2)c(F)c1	ZINC001164036170	1383148921	/nfs/dbraw/zinc/14/89/21/1383148921.db2.gz	KDRDAYUGCWKBMO-UHFFFAOYSA-N	0	3	341.430	3.184	20	30		EGEDHN
CCCC1(C(=O)NCCCNCc2cc(C#N)ccc2F)CCC1	ZINC001164233368	1383169282	/nfs/dbraw/zinc/16/92/82/1383169282.db2.gz	FBVDJAOZCJPTQQ-UHFFFAOYSA-N	0	3	331.435	3.264	20	30		EGEDHN
C#CCCCC(=O)NCCC1(CNCc2ccc(F)cc2F)CC1	ZINC001164291890	1383174899	/nfs/dbraw/zinc/17/48/99/1383174899.db2.gz	XPGAWJOOTRTAOM-UHFFFAOYSA-N	0	3	334.410	3.144	20	30		EGEDHN
CCN1CCC(N(C)C(F)(F)c2cc(Cl)nc(C#N)c2)CC1	ZINC001165067629	1383221083	/nfs/dbraw/zinc/22/10/83/1383221083.db2.gz	GGFSGHSFBZEXIQ-UHFFFAOYSA-N	0	3	328.794	3.072	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCC1(CNCc2cccc(OC)n2)CC1	ZINC001165215311	1383251168	/nfs/dbraw/zinc/25/11/68/1383251168.db2.gz	QUYITROGZVUDSY-UHFFFAOYSA-N	0	3	345.487	3.069	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cc(F)ccc2F)CC1	ZINC001165509283	1383305322	/nfs/dbraw/zinc/30/53/22/1383305322.db2.gz	UDZBTPMNCFCORD-UHFFFAOYSA-N	0	3	328.790	3.207	20	30		EGEDHN
N#Cc1ccccc1CNCC1(CCNC(=O)C2(C3CC3)CC2)CC1	ZINC001165669355	1383322364	/nfs/dbraw/zinc/32/23/64/1383322364.db2.gz	IWPFYUJFKALINU-UHFFFAOYSA-N	0	3	337.467	3.125	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)CCCc1ccccc1	ZINC001165676562	1383323976	/nfs/dbraw/zinc/32/39/76/1383323976.db2.gz	CXGFXFSJIZQIBE-UHFFFAOYSA-N	0	3	335.451	3.177	20	30		EGEDHN
C=CCCC1(C(=O)NCCCNCc2oc(CCC)nc2C)CC1	ZINC001165913851	1383364157	/nfs/dbraw/zinc/36/41/57/1383364157.db2.gz	KVWHCBIBWAUTDV-UHFFFAOYSA-N	0	3	333.476	3.278	20	30		EGEDHN
C[C@H](C(=O)NCCCNCc1ccccc1C#N)c1ccsc1	ZINC001166497038	1383429494	/nfs/dbraw/zinc/42/94/94/1383429494.db2.gz	DZCOELDRWBEHEZ-AWEZNQCLSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCCC1(CNCC(=C)Br)CC1	ZINC001166747244	1383470324	/nfs/dbraw/zinc/47/03/24/1383470324.db2.gz	LLXVMFIIRBCUNH-ZDUSSCGKSA-N	0	3	343.309	3.373	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCCC1(CNCc2oc(C)nc2C)CC1	ZINC001166755784	1383472416	/nfs/dbraw/zinc/47/24/16/1383472416.db2.gz	MQFKUGVPKPWSBI-AWEZNQCLSA-N	0	3	333.476	3.270	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCCC1(CNCc2cc(OC)ccn2)CC1	ZINC001166755171	1383472444	/nfs/dbraw/zinc/47/24/44/1383472444.db2.gz	FVHFRDHDNCMXMQ-MRXNPFEDSA-N	0	3	345.487	3.069	20	30		EGEDHN
C[C@@H]1C[C@@H]1CC(=O)NCCC1(CNCc2ccc(C#N)cc2F)CC1	ZINC001167013774	1383518729	/nfs/dbraw/zinc/51/87/29/1383518729.db2.gz	WXDACOLNBGGYRI-RHSMWYFYSA-N	0	3	343.446	3.120	20	30		EGEDHN
C=CCCC1(C(=O)NCCC2(CN[C@@H](C)c3cnccn3)CC2)CC1	ZINC001167025132	1383521453	/nfs/dbraw/zinc/52/14/53/1383521453.db2.gz	BAVADLZIJQAKQN-INIZCTEOSA-N	0	3	342.487	3.160	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)[C@@H](F)c2ccccc2)c1	ZINC001167373132	1383613598	/nfs/dbraw/zinc/61/35/98/1383613598.db2.gz	WBYUGZZZQYNXKY-SFHVURJKSA-N	0	3	343.377	3.004	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc3c(c2)C[C@@H](C)O3)CC1	ZINC001167460793	1383639116	/nfs/dbraw/zinc/63/91/16/1383639116.db2.gz	OTLQKBHOLKBHRF-CQSZACIVSA-N	0	3	348.874	3.252	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@H]2CCc3ccccc3O2)CC1	ZINC001167486794	1383648451	/nfs/dbraw/zinc/64/84/51/1383648451.db2.gz	RCUBPYROFMECQE-QGZVFWFLSA-N	0	3	348.874	3.009	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)c1ccccn1	ZINC001168767718	1383997123	/nfs/dbraw/zinc/99/71/23/1383997123.db2.gz	AXJBKAHLHQVPCT-INIZCTEOSA-N	0	3	336.439	3.032	20	30		EGEDHN
C/C(=N\[S@](=O)C(C)(C)C)c1ccc(-n2ccc([C@@H](C)N)n2)cc1	ZINC001169236621	1384125800	/nfs/dbraw/zinc/12/58/00/1384125800.db2.gz	FMCYIAXZBUNYCP-SXGFUQMISA-N	0	3	332.473	3.163	20	30		EGEDHN
Cc1ccc(C(=NO)Nc2ccc([C@@H]3CCCCN3C)cn2)nc1	ZINC001169405754	1384144669	/nfs/dbraw/zinc/14/46/69/1384144669.db2.gz	XLDUIFYZTRCEKK-INIZCTEOSA-N	0	3	325.416	3.190	20	30		EGEDHN
C/C=C(/C)C(=O)N[C@@H](C)CCCCNCc1cc(F)ccc1C#N	ZINC001170067241	1384228601	/nfs/dbraw/zinc/22/86/01/1384228601.db2.gz	JLEHEQNXTWMVLE-XCROGBHMSA-N	0	3	331.435	3.428	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H](C)CCCCNCc1ncc(C)s1	ZINC001170281738	1384281413	/nfs/dbraw/zinc/28/14/13/1384281413.db2.gz	BGKXRRYZRVDCIA-HNNXBMFYSA-N	0	3	335.517	3.410	20	30		EGEDHN
C[C@H](CCCCNCc1cc(C2CC2)no1)NC(=O)C#CC(C)(C)C	ZINC001170694553	1384367395	/nfs/dbraw/zinc/36/73/95/1384367395.db2.gz	YQRBZABRLPZBHO-OAHLLOKOSA-N	0	3	345.487	3.366	20	30		EGEDHN
C=CCOC(=O)N[C@@H]1CCCN([C@@H]2CCc3cccc(F)c3C2)C1	ZINC001171014290	1384429894	/nfs/dbraw/zinc/42/98/94/1384429894.db2.gz	XRQWBTJSCTVJTJ-HZPDHXFCSA-N	0	3	332.419	3.060	20	30		EGEDHN
C[C@@H](Cc1cccc(C#N)c1)n1nc(C(F)(F)F)c2c1CCNC2	ZINC001171227815	1384474146	/nfs/dbraw/zinc/47/41/46/1384474146.db2.gz	ARDADXJWBYGMCK-NSHDSACASA-N	0	3	334.345	3.223	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1scnc1CC	ZINC001316872321	1384657209	/nfs/dbraw/zinc/65/72/09/1384657209.db2.gz	BKCHQZGSYWZROM-OCCSQVGLSA-N	0	3	341.908	3.431	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1cnn(C(C)C)c1	ZINC001316878616	1384663179	/nfs/dbraw/zinc/66/31/79/1384663179.db2.gz	HXOKIHWKLYJUCN-HOCLYGCPSA-N	0	3	338.883	3.189	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)NCc1cc(OCC2CCC2)ncn1	ZINC001172300160	1384762998	/nfs/dbraw/zinc/76/29/98/1384762998.db2.gz	RQZHIASDSCUIPD-OAHLLOKOSA-N	0	3	336.439	3.248	20	30		EGEDHN
C[C@@H](CC#N)N[C@@H]1CC[C@H]2CN(C(=O)c3ccccc3)CC[C@H]2C1	ZINC001172520450	1384808531	/nfs/dbraw/zinc/80/85/31/1384808531.db2.gz	NJCSCFVZKTZSPM-DSLXNQLJSA-N	0	3	325.456	3.209	20	30		EGEDHN
CC(C)C[C@H](N[C@@H](C)CSc1ccc(Cl)cc1)C(=O)NO	ZINC001172875276	1384870811	/nfs/dbraw/zinc/87/08/11/1384870811.db2.gz	KBYYIGFMYMLODE-FZMZJTMJSA-N	0	3	330.881	3.330	20	30		EGEDHN
CC[C@@H](N[C@H]1CCN(C(=O)OC(C)(C)C)[C@H](C#N)C1)c1cccnc1	ZINC001172973694	1384893275	/nfs/dbraw/zinc/89/32/75/1384893275.db2.gz	GVBXYIZNGPMTTI-YESZJQIVSA-N	0	3	344.459	3.414	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H](N2CCC(C)(F)CC2)C[C@H]1C#N	ZINC001172980695	1384894591	/nfs/dbraw/zinc/89/45/91/1384894591.db2.gz	OWCIMESGCLZBMC-KBPBESRZSA-N	0	3	325.428	3.102	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H](N2CCC(C(F)F)CC2)C[C@H]1C#N	ZINC001172992472	1384896358	/nfs/dbraw/zinc/89/63/58/1384896358.db2.gz	YRSRIHWQYFREID-KBPBESRZSA-N	0	3	343.418	3.255	20	30		EGEDHN
C[C@@H]1CC[C@@H](NCc2csc(C#N)c2)CN1C(=O)OC(C)(C)C	ZINC001173062379	1384905170	/nfs/dbraw/zinc/90/51/70/1384905170.db2.gz	UKAIPEAWFUITLV-TZMCWYRMSA-N	0	3	335.473	3.497	20	30		EGEDHN
C[C@H](Cc1ccc(OC(F)(F)F)cc1)NC(=N)c1ccc(F)cn1	ZINC001173084642	1384911043	/nfs/dbraw/zinc/91/10/43/1384911043.db2.gz	BVFMBKPDDMTNNH-SNVBAGLBSA-N	0	3	341.308	3.456	20	30		EGEDHN
N#CC1(CNC2CCN(C(=O)c3ccc(Cl)cc3)CC2)CCC1	ZINC001173412174	1384967804	/nfs/dbraw/zinc/96/78/04/1384967804.db2.gz	BQKYXZNTDCLUAK-UHFFFAOYSA-N	0	3	331.847	3.228	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccccc1Cl)NCc1ccc(C#N)s1	ZINC001317280583	1385051295	/nfs/dbraw/zinc/05/12/95/1385051295.db2.gz	SPQOUCNFLYRGLK-NSHDSACASA-N	0	3	333.844	3.181	20	30		EGEDHN
C[C@H](CC(=O)NCCCNCc1cc(C#N)ccc1F)C(C)(C)C	ZINC001174571122	1385120981	/nfs/dbraw/zinc/12/09/81/1385120981.db2.gz	LVJQNOMGKWBDFH-CQSZACIVSA-N	0	3	333.451	3.366	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H](C)CCCCNCc1nccs1	ZINC001174694909	1385135723	/nfs/dbraw/zinc/13/57/23/1385135723.db2.gz	ZKQZLQAGUYOFBE-MRXNPFEDSA-N	0	3	335.517	3.491	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@H](C)CCCCNCc1cc2n(n1)CCC2	ZINC001174834042	1385157260	/nfs/dbraw/zinc/15/72/60/1385157260.db2.gz	VDKMWTMUQVJLFP-IAGOWNOFSA-N	0	3	346.519	3.196	20	30		EGEDHN
CCN(CCNC(=O)[C@H](C)C#N)CCc1cccc(Cl)c1Cl	ZINC001317477866	1385174111	/nfs/dbraw/zinc/17/41/11/1385174111.db2.gz	RNCNMNWBWIQTDD-GFCCVEGCSA-N	0	3	342.270	3.134	20	30		EGEDHN
CCN(CCNC(=O)[C@H](C)C(C)(C)C)Cc1ccc(OCC#N)cc1	ZINC001317482099	1385178369	/nfs/dbraw/zinc/17/83/69/1385178369.db2.gz	PMYSEGTTZBHOLZ-INIZCTEOSA-N	0	3	345.487	3.209	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@H](C)CCCCNCc1nccn1CC	ZINC001175083137	1385191998	/nfs/dbraw/zinc/19/19/98/1385191998.db2.gz	WFEMVYYVWAVKLT-VQIMIIECSA-N	0	3	334.508	3.270	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H](C)CCCCNCc1cc(OC)no1	ZINC001175082684	1385192117	/nfs/dbraw/zinc/19/21/17/1385192117.db2.gz	RFFRQPDWRAZYDR-KBXCAEBGSA-N	0	3	337.464	3.050	20	30		EGEDHN
CCCC(C)(C)C(=O)NC[C@@H]1CCN(Cc2ccc(C#N)cc2)C1	ZINC001317538186	1385270576	/nfs/dbraw/zinc/27/05/76/1385270576.db2.gz	UPLLEYQENHPQKR-SFHVURJKSA-N	0	3	327.472	3.323	20	30		EGEDHN
CCN1CCN(c2ccc(Nc3cccc(OC)c3C#N)cc2)CC1	ZINC001175781192	1385402871	/nfs/dbraw/zinc/40/28/71/1385402871.db2.gz	FJJNWPMZTLZSQQ-UHFFFAOYSA-N	0	3	336.439	3.452	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@H](CCCC)C(C)C	ZINC001177083894	1385800447	/nfs/dbraw/zinc/80/04/47/1385800447.db2.gz	LWSDSLFAGWGKQX-CQSZACIVSA-N	0	3	333.314	3.453	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)c1c[nH]c(C)n1	ZINC001177256303	1385887339	/nfs/dbraw/zinc/88/73/39/1385887339.db2.gz	BDGYUZXPGQSILO-UHFFFAOYSA-N	0	3	338.883	3.083	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@H]1CO[C@@H](C)C1	ZINC001177353376	1385926280	/nfs/dbraw/zinc/92/62/80/1385926280.db2.gz	ZQTGRTNZHVRQRL-DOTOQJQBSA-N	0	3	342.911	3.162	20	30		EGEDHN
CCCCC(=O)N1CCC[C@@H]1CNCC#Cc1cccc(Cl)c1	ZINC001319049128	1385946427	/nfs/dbraw/zinc/94/64/27/1385946427.db2.gz	OKMBTRBGSPKYDT-GOSISDBHSA-N	0	3	332.875	3.462	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@H]1CCO[C@@H]1C	ZINC001177448656	1385959613	/nfs/dbraw/zinc/95/96/13/1385959613.db2.gz	QJLREXZNJKCHFG-WBVHZDCISA-N	0	3	342.911	3.162	20	30		EGEDHN
Cc1cc(C(=O)NC[C@H](C)CNCc2ccccc2C#N)ccc1F	ZINC001319230908	1386015583	/nfs/dbraw/zinc/01/55/83/1386015583.db2.gz	CXBFUHFPKAQZNH-CQSZACIVSA-N	0	3	339.414	3.162	20	30		EGEDHN
Cc1cc2c(ncnc2NC(=O)C(C#N)Cc2cccs2)s1	ZINC001177904909	1386079067	/nfs/dbraw/zinc/07/90/67/1386079067.db2.gz	QBJKJKDMDBGKOS-SNVBAGLBSA-N	0	3	328.422	3.382	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1CC[C@H](NCc2cc(C#N)ccc2OC)[C@@H]1C	ZINC001178376179	1386200550	/nfs/dbraw/zinc/20/05/50/1386200550.db2.gz	YHHHCVROLDVQFM-VKJFTORMSA-N	0	3	343.471	3.082	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCCCCCNCc1ccn(CC)n1	ZINC001178566758	1386249820	/nfs/dbraw/zinc/24/98/20/1386249820.db2.gz	GNFZPWBOHRYVNJ-UHFFFAOYSA-N	0	3	346.519	3.438	20	30		EGEDHN
C[C@H]1[C@@H](NCc2cc(F)cc(F)c2)CCN1C(=O)C#CC(C)(C)C	ZINC001178671780	1386273644	/nfs/dbraw/zinc/27/36/44/1386273644.db2.gz	PZGZMALGEFCBRV-GUYCJALGSA-N	0	3	334.410	3.093	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](NCc2ncccc2C)[C@@H]1C	ZINC001179313994	1386448013	/nfs/dbraw/zinc/44/80/13/1386448013.db2.gz	NBDWKLLDMXCKEB-ROUUACIJSA-N	0	3	327.472	3.053	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@@H]1C	ZINC001179351828	1386460254	/nfs/dbraw/zinc/46/02/54/1386460254.db2.gz	VHCWFGYPPWDHHC-IKMZNHIXSA-N	0	3	340.442	3.279	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)[C@@H]1C	ZINC001179351641	1386460530	/nfs/dbraw/zinc/46/05/30/1386460530.db2.gz	RPHBQVQPGDMXEF-PBEOQSSNSA-N	0	3	341.430	3.299	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](NCc2cn(C(C)C)nc2C)[C@@H]1C	ZINC001179463487	1386487843	/nfs/dbraw/zinc/48/78/43/1386487843.db2.gz	ICWGSRKVWKUUIQ-WMZOPIPTSA-N	0	3	332.492	3.208	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1cccc2cc[nH]c21)C1CC1	ZINC001698650606	1406300816	/nfs/dbraw/zinc/30/08/16/1406300816.db2.gz	ZGRIYKANWYLKSK-SFHVURJKSA-N	0	3	331.847	3.409	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccc(Cl)cc2)CCN1C(=O)[C@H]1CC12CC2	ZINC001179598414	1386528229	/nfs/dbraw/zinc/52/82/29/1386528229.db2.gz	GHQVYTBRNDUFNK-QGTPRVQTSA-N	0	3	342.870	3.071	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCCCCCNCc1cc2n(n1)CCC2	ZINC001179693292	1386556910	/nfs/dbraw/zinc/55/69/10/1386556910.db2.gz	VYDDSWYAUFCIFA-UHFFFAOYSA-N	0	3	346.519	3.198	20	30		EGEDHN
CC(C)C[C@H](C)C(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)[C@@H]1C	ZINC001179793267	1386588828	/nfs/dbraw/zinc/58/88/28/1386588828.db2.gz	CWGMDGVLQQWVEY-DOXZYTNZSA-N	0	3	345.462	3.459	20	30		EGEDHN
C[C@@H]1CN(C(=O)/C=C\C2CC2)C[C@@]1(C)CNCc1ccccc1C#N	ZINC001180998395	1386914397	/nfs/dbraw/zinc/91/43/97/1386914397.db2.gz	DHSSIEWFPRHSAT-BEBAURNISA-N	0	3	337.467	3.099	20	30		EGEDHN
Cc1scc(C(=O)N[C@H](C)CNCc2ccc(F)c(C#N)c2)c1C	ZINC001321523466	1386923006	/nfs/dbraw/zinc/92/30/06/1386923006.db2.gz	OVEDORXGDQLPPD-LLVKDONJSA-N	0	3	345.443	3.284	20	30		EGEDHN
CCC(=CC(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1)CC	ZINC001181989566	1387088244	/nfs/dbraw/zinc/08/82/44/1387088244.db2.gz	SUXKKEPQTJOCAX-QGZVFWFLSA-N	0	3	329.419	3.134	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](NCc2ccc(C(C)C)nc2C)C1	ZINC001182109003	1387106311	/nfs/dbraw/zinc/10/63/11/1387106311.db2.gz	WUIBWWPQNICBGL-LJQANCHMSA-N	0	3	341.499	3.398	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](NCc2ccc(Cl)cc2OC)C1	ZINC001182113184	1387107839	/nfs/dbraw/zinc/10/78/39/1387107839.db2.gz	NJMSNEAOEWFLAB-QGZVFWFLSA-N	0	3	348.874	3.233	20	30		EGEDHN
CC#CCCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2csc(C)n2)C1	ZINC001182300465	1387141716	/nfs/dbraw/zinc/14/17/16/1387141716.db2.gz	KFPVEWODQAQJIW-DNVCBOLYSA-N	0	3	347.528	3.219	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2oc(C)nc2C)C1	ZINC001182306005	1387143701	/nfs/dbraw/zinc/14/37/01/1387143701.db2.gz	SKVPWVYSQBZSRU-STXHMFSFSA-N	0	3	347.503	3.468	20	30		EGEDHN
COc1cc(Cl)ccc1CN[C@@H]1CCN(C(=O)C#CC(C)(C)C)C1	ZINC001182450133	1387168443	/nfs/dbraw/zinc/16/84/43/1387168443.db2.gz	NGSGULXUBPDUMI-MRXNPFEDSA-N	0	3	348.874	3.089	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H](C)[C@](C)(CNCc2oc(C)nc2C)C1	ZINC001182524186	1387181790	/nfs/dbraw/zinc/18/17/90/1387181790.db2.gz	CHHVPDPQNKQEDL-JSNMRZPZSA-N	0	3	347.503	3.468	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](C)[C@](C)(CNCc3nc(C)cs3)C2)C1	ZINC001182572393	1387189227	/nfs/dbraw/zinc/18/92/27/1387189227.db2.gz	COHXJXMGVCUZTO-AUUYWEPGSA-N	0	3	347.528	3.382	20	30		EGEDHN
N#Cc1ccc(OCCCN2CCc3ccc([N+](=O)[O-])cc3C2)cc1	ZINC001322474078	1387193002	/nfs/dbraw/zinc/19/30/02/1387193002.db2.gz	CJRKIVCSFPXPNZ-UHFFFAOYSA-N	0	3	337.379	3.294	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CC[C@@H](NCc2cc(C)ccc2F)C1)OCC	ZINC001182973816	1387252152	/nfs/dbraw/zinc/25/21/52/1387252152.db2.gz	SSEQFJQMIXVFQE-MJGOQNOKSA-N	0	3	348.462	3.196	20	30		EGEDHN
C#Cc1ccc(NC2CCN(Cc3ccc(NC(C)=O)cc3)CC2)nc1	ZINC001337892606	1389473889	/nfs/dbraw/zinc/47/38/89/1389473889.db2.gz	KVBPROBGFJWFFI-UHFFFAOYSA-N	0	3	348.450	3.098	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC(CCNC[C@@H](C#N)CCC#N)CC1	ZINC001338417297	1389679680	/nfs/dbraw/zinc/67/96/80/1389679680.db2.gz	CVKCAWMEFDSBEG-MRXNPFEDSA-N	0	3	334.464	3.057	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccc(C#N)cc2F)C1	ZINC001338804844	1389772270	/nfs/dbraw/zinc/77/22/70/1389772270.db2.gz	MBAGLLMKLRYZSI-PBHICJAKSA-N	0	3	337.398	3.263	20	30		EGEDHN
N#Cc1cccnc1NCCNCc1ccc(C(F)(F)F)s1	ZINC001339028718	1389866044	/nfs/dbraw/zinc/86/60/44/1389866044.db2.gz	LYCPYHTVAQWERJ-UHFFFAOYSA-N	0	3	326.347	3.235	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)Nc1cccc2c1N(C)C(=O)CO2	ZINC001340868720	1390389588	/nfs/dbraw/zinc/38/95/88/1390389588.db2.gz	RTYNSUXOHBANNU-AWEZNQCLSA-N	0	3	347.459	3.058	20	30		EGEDHN
C[C@@H](NC(=O)[C@@H](N)CCCC#N)c1cc(Cl)cc(Cl)c1F	ZINC001341162330	1390450423	/nfs/dbraw/zinc/45/04/23/1390450423.db2.gz	PHWBRTBSIMYUQB-PELKAZGASA-N	0	3	332.206	3.331	20	30		EGEDHN
CCS[C@H](C(=O)C(C#N)c1nc(N)c2ccccc2n1)C(C)C	ZINC001342547751	1390624812	/nfs/dbraw/zinc/62/48/12/1390624812.db2.gz	DFLDJYHWKAVRNO-WFASDCNBSA-N	0	3	328.441	3.166	20	30		EGEDHN
CSc1ccc(CCC(=O)C(C#N)C(=O)NC2CCCCC2)cc1	ZINC001343581676	1390724161	/nfs/dbraw/zinc/72/41/61/1390724161.db2.gz	CSXMHUUVSVKWMJ-KRWDZBQOSA-N	0	3	344.480	3.499	20	30		EGEDHN
N#CC(C(=O)Cc1ccc(F)cc1)c1nccn1Cc1ccccc1	ZINC001343982108	1390748106	/nfs/dbraw/zinc/74/81/06/1390748106.db2.gz	DQHNDLDAMRGBHF-SFHVURJKSA-N	0	3	333.366	3.489	20	30		EGEDHN
CC[C@H](C)N1CCN(c2nnc(C(C)(C)CC#N)n2CC(C)C)CC1	ZINC001344927224	1390825264	/nfs/dbraw/zinc/82/52/64/1390825264.db2.gz	XYAIXRRDCWHVQQ-INIZCTEOSA-N	0	3	346.523	3.046	20	30		EGEDHN
CCc1c(C(=O)C(C#N)c2nccn2CC)cnn1CCC(C)C	ZINC001345646091	1390871989	/nfs/dbraw/zinc/87/19/89/1390871989.db2.gz	FHMRYEFSCDINRT-AWEZNQCLSA-N	0	3	327.432	3.198	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)C[C@H](C)Cc1ccccc1OC	ZINC001346096514	1390907220	/nfs/dbraw/zinc/90/72/20/1390907220.db2.gz	QVLQYHNRGNNKAZ-GDBMZVCRSA-N	0	3	325.412	3.357	20	30		EGEDHN
N#Cc1cc(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)cs1	ZINC001347770272	1391122385	/nfs/dbraw/zinc/12/23/85/1391122385.db2.gz	DATPRTUCERLRLB-KRWDZBQOSA-N	0	3	325.437	3.187	20	30		EGEDHN
Cc1ccc([C@@H](CNc2ccc(C#N)cc2CO)N2CCCC2)o1	ZINC001351961423	1391725365	/nfs/dbraw/zinc/72/53/65/1391725365.db2.gz	FHHGVROUBKDXMF-GOSISDBHSA-N	0	3	325.412	3.201	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)Nc1nnc([C@H]2CCCO2)s1	ZINC001354536588	1392151141	/nfs/dbraw/zinc/15/11/41/1392151141.db2.gz	OMTSNRSAYJTLAE-QWHCGFSZSA-N	0	3	340.493	3.406	20	30		EGEDHN
C[C@H](C(=O)NC[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1)C1CCC1	ZINC001479303487	1392208320	/nfs/dbraw/zinc/20/83/20/1392208320.db2.gz	YOPXBLPDDXGAAV-DHSIGJKJSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)CCc2ccc(C)cc2C)C1	ZINC001479310829	1392209880	/nfs/dbraw/zinc/20/98/80/1392209880.db2.gz	DWYDKQOSHXVOGJ-MAEOIBBWSA-N	0	3	334.891	3.473	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1ccn(C(F)F)n1	ZINC001479820739	1392411223	/nfs/dbraw/zinc/41/12/23/1392411223.db2.gz	CRIYCGKXBHMRCM-YPMHNXCESA-N	0	3	346.809	3.004	20	30		EGEDHN
CC(C)(CC(=O)NC[C@@H](NCc1ccc(C#N)s1)C1CC1)C1CC1	ZINC001480017673	1392537302	/nfs/dbraw/zinc/53/73/02/1392537302.db2.gz	MLMJIHRHOVQJLM-QGZVFWFLSA-N	0	3	345.512	3.430	20	30		EGEDHN
CC(C)c1scnc1C(=O)NC[C@H](C)NCc1ccc(C#N)s1	ZINC001480568849	1392795215	/nfs/dbraw/zinc/79/52/15/1392795215.db2.gz	BUBLMHBFPFAYDR-NSHDSACASA-N	0	3	348.497	3.108	20	30		EGEDHN
C[C@H](C#N)C(=O)N(C)C1CCN(C/C=C/c2ccc(Cl)cc2)CC1	ZINC001490401492	1394215277	/nfs/dbraw/zinc/21/52/77/1394215277.db2.gz	AQWBTVRSQTYFOI-NHZBNJEXSA-N	0	3	345.874	3.436	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)CCOc2c(C)cccc2C)C1	ZINC001490896725	1394369634	/nfs/dbraw/zinc/36/96/34/1394369634.db2.gz	SLXQNEVSADRAJC-WKILWMFISA-N	0	3	336.863	3.062	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)N1CCCC[C@@H]1CNCC#Cc1ccccc1Cl	ZINC001491259588	1394494769	/nfs/dbraw/zinc/49/47/69/1394494769.db2.gz	XZFCIBGDFSRTPG-KBAYOESNSA-N	0	3	344.886	3.318	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2ncc(Cl)s2)CCCC1	ZINC001481901828	1394587616	/nfs/dbraw/zinc/58/76/16/1394587616.db2.gz	VNRMYIGANPKOGI-UHFFFAOYSA-N	0	3	334.272	3.181	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2scnc2C)CCCC[C@H]1C	ZINC001481955724	1394616997	/nfs/dbraw/zinc/61/69/97/1394616997.db2.gz	UXOGYVOWRNEXSL-BDJLRTHQSA-N	0	3	341.908	3.472	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2ccc(F)cn2)CCCC[C@H]1C	ZINC001481955293	1394617313	/nfs/dbraw/zinc/61/73/13/1394617313.db2.gz	DWWJKLZGVNGVOV-SJKOYZFVSA-N	0	3	339.842	3.242	20	30		EGEDHN
C[C@H](C#N)C(=O)NCC1(N[C@@H](C)c2ccc(F)cc2F)CCCC1	ZINC001482213656	1394806974	/nfs/dbraw/zinc/80/69/74/1394806974.db2.gz	UTTOUGAKRJCUBQ-OLZOCXBDSA-N	0	3	335.398	3.204	20	30		EGEDHN
C=C(Cl)CNC[C@@H](CC(C)C)NC(=O)c1cc(C)cc2c[nH]nc21	ZINC001482396466	1394958225	/nfs/dbraw/zinc/95/82/25/1394958225.db2.gz	UDXDWAZJEOBYHX-OAHLLOKOSA-N	0	3	348.878	3.358	20	30		EGEDHN
CC(C)[C@H](CNC(=O)C1=CCCC1)NCc1ccc(C#N)cc1F	ZINC001482524304	1395071368	/nfs/dbraw/zinc/07/13/68/1395071368.db2.gz	BDBAAHDBKLHBKE-SFHVURJKSA-N	0	3	329.419	3.038	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)CCc1ccccc1F)C(C)C	ZINC001698977717	1406749471	/nfs/dbraw/zinc/74/94/71/1406749471.db2.gz	TUMFAZMPIUZZST-INIZCTEOSA-N	0	3	326.843	3.241	20	30		EGEDHN
CC1(C(=O)NC[C@]2(C)CCCN(Cc3ccc(C#N)cc3)C2)CC1	ZINC001484161632	1395295902	/nfs/dbraw/zinc/29/59/02/1395295902.db2.gz	SNHKOXWJBMXUGQ-IBGZPJMESA-N	0	3	325.456	3.077	20	30		EGEDHN
CN(CCCN(C)C(=O)c1ccsc1)Cc1ccc(F)c(C#N)c1	ZINC001484732389	1395494240	/nfs/dbraw/zinc/49/42/40/1395494240.db2.gz	QMHHYAXIWUNGQM-UHFFFAOYSA-N	0	3	345.443	3.353	20	30		EGEDHN
C[C@@H](CN(C)C(=O)CCc1ccccc1)NCc1ccc(C#N)s1	ZINC001485948851	1396172428	/nfs/dbraw/zinc/17/24/28/1396172428.db2.gz	VOWGDFHGYUJECE-HNNXBMFYSA-N	0	3	341.480	3.189	20	30		EGEDHN
CCC1(C(=O)N[C@H]2CC[C@@H](CNCc3ccccc3C#N)C2)CC1	ZINC001486211742	1396183446	/nfs/dbraw/zinc/18/34/46/1396183446.db2.gz	DNGCQVUESOWXOQ-QAPCUYQASA-N	0	3	325.456	3.123	20	30		EGEDHN
Cc1ccc(C)c(CC(=O)NCC[C@H](C)NCc2ccccc2C#N)c1	ZINC001492077849	1396302718	/nfs/dbraw/zinc/30/27/18/1396302718.db2.gz	KGGHWIKBLUBXSN-SFHVURJKSA-N	0	3	349.478	3.402	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H](C)CN(C)Cc2cccc(C#N)c2)sc1C	ZINC001498442286	1396996332	/nfs/dbraw/zinc/99/63/32/1396996332.db2.gz	APRFLHGHIYLWDC-AWEZNQCLSA-N	0	3	341.480	3.487	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@H]1CCN(CCc2ccc(OC)cc2)C1	ZINC001690101896	1404299955	/nfs/dbraw/zinc/29/99/55/1404299955.db2.gz	VVZDBZACWSUCIB-PXNSSMCTSA-N	0	3	330.472	3.031	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)CCCc2ccc(OC)cc2)C1	ZINC001690288503	1404448993	/nfs/dbraw/zinc/44/89/93/1404448993.db2.gz	AYAOFAZTUMCZDM-WKILWMFISA-N	0	3	336.863	3.007	20	30		EGEDHN
C[C@H](CNC(=O)[C@H](C)c1ccccc1)N(C)Cc1cccc(C#N)c1	ZINC001725186938	1425720944	/nfs/dbraw/zinc/72/09/44/1425720944.db2.gz	FIRJCMAQUZPJBT-IAGOWNOFSA-N	0	3	335.451	3.298	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)CCC2CCCC2)C1	ZINC001691423388	1405258697	/nfs/dbraw/zinc/25/86/97/1405258697.db2.gz	YUEITLBKJIMFMM-GASCZTMLSA-N	0	3	343.309	3.350	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)CCCc2ccsc2)C1	ZINC001691790946	1405501520	/nfs/dbraw/zinc/50/15/20/1405501520.db2.gz	ZGZALDUAGRPVMR-SHTZXODSSA-N	0	3	326.893	3.308	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](CCNC(=O)CC3CCC3)C2)s1	ZINC001691880925	1405604900	/nfs/dbraw/zinc/60/49/00/1405604900.db2.gz	YJXBCQQXPHMEHY-HNNXBMFYSA-N	0	3	331.485	3.138	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cc3ccccn3c2)CCCC1	ZINC001732397570	1428564653	/nfs/dbraw/zinc/56/46/53/1428564653.db2.gz	YMWSHJFTEQBCLE-UHFFFAOYSA-N	0	3	331.847	3.324	20	30		EGEDHN
C[C@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)C1(C)CCCC1	ZINC001732431576	1428577948	/nfs/dbraw/zinc/57/79/48/1428577948.db2.gz	OGVGDANZKSWUPO-CQSZACIVSA-N	0	3	331.435	3.214	20	30		EGEDHN
CC(C)CCC(=O)N[C@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001699568495	1412924636	/nfs/dbraw/zinc/92/46/36/1412924636.db2.gz	CICDMVLEZYNFOD-GOSISDBHSA-N	0	3	331.435	3.118	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)c3ccc4c(c3)CCC4)CC2)cc1	ZINC001699671766	1413061784	/nfs/dbraw/zinc/06/17/84/1413061784.db2.gz	IEURZLQLVKAXFL-UHFFFAOYSA-N	0	3	345.446	3.099	20	30		EGEDHN
C[C@]1(CNCc2ccccc2C#N)CCN(C(=O)C2C=CC=CC=C2)C1	ZINC001699834327	1413263279	/nfs/dbraw/zinc/26/32/79/1413263279.db2.gz	FPIRGGHONPOQES-JOCHJYFZSA-N	0	3	347.462	3.185	20	30		EGEDHN
C[C@@H](CCNC(=O)C1CC(C)(C)C1)NCc1cc(C#N)ccc1F	ZINC001700323146	1413790873	/nfs/dbraw/zinc/79/08/73/1413790873.db2.gz	RNBVGICUOVPOGL-ZDUSSCGKSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cccnc1C(F)(F)F)C(C)C	ZINC001732570531	1428765063	/nfs/dbraw/zinc/76/50/63/1428765063.db2.gz	WQCFPEUXWYQVFJ-GFCCVEGCSA-N	0	3	349.784	3.197	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccc(Cl)o1)N(C)Cc1ccc(C#N)cc1	ZINC001700473044	1414093190	/nfs/dbraw/zinc/09/31/90/1414093190.db2.gz	HGUCROWYJBTCGZ-LBPRGKRZSA-N	0	3	331.803	3.055	20	30		EGEDHN
CCC[C@H](C)C(=O)N1CC2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001700616708	1414283353	/nfs/dbraw/zinc/28/33/53/1414283353.db2.gz	AZGUUXPTHWGUCL-KRWDZBQOSA-N	0	3	339.483	3.419	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1cn(C(C)C)cn1	ZINC001707444703	1417348729	/nfs/dbraw/zinc/34/87/29/1417348729.db2.gz	ROCDMDNYRHJYLU-GDBMZVCRSA-N	0	3	338.883	3.189	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)c1ccc(C)c(F)c1	ZINC001713411864	1418034941	/nfs/dbraw/zinc/03/49/41/1418034941.db2.gz	USJLTCAQDMYSKI-GFCCVEGCSA-N	0	3	343.240	3.141	20	30		EGEDHN
N#Cc1ccc(CN[C@H](CNC(=O)C2CCCCC2)C2CC2)s1	ZINC001713859638	1418656801	/nfs/dbraw/zinc/65/68/01/1418656801.db2.gz	IQHWQFBTHBGQGP-QGZVFWFLSA-N	0	3	331.485	3.184	20	30		EGEDHN
Cc1ccc(F)cc1C(=O)NC[C@H](C)CNCc1ccccc1C#N	ZINC001714420102	1419156260	/nfs/dbraw/zinc/15/62/60/1419156260.db2.gz	POFXKVNQZBGRBT-CQSZACIVSA-N	0	3	339.414	3.162	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cc(C(C)(C)C)n[nH]2)CCCC1	ZINC001714496488	1419220544	/nfs/dbraw/zinc/22/05/44/1419220544.db2.gz	RNBIKLNLQIUBES-UHFFFAOYSA-N	0	3	338.883	3.092	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cc3c([nH]2)CCCC3)CCCC1	ZINC001714510209	1419237721	/nfs/dbraw/zinc/23/77/21/1419237721.db2.gz	VMTRPWGMQOITIO-UHFFFAOYSA-N	0	3	335.879	3.278	20	30		EGEDHN
CCN(CCNC(=O)[C@H](C)c1cccs1)Cc1cccc(C#N)c1	ZINC001714592767	1419341700	/nfs/dbraw/zinc/34/17/00/1419341700.db2.gz	OZAQPOVELHOBRQ-OAHLLOKOSA-N	0	3	341.480	3.362	20	30		EGEDHN
CC1(CC(=O)NCC[C@@H]2CCN(Cc3ccc(F)c(C#N)c3)C2)CC1	ZINC001714873749	1419606607	/nfs/dbraw/zinc/60/66/07/1419606607.db2.gz	LCVMLUNYAFOHEL-OAHLLOKOSA-N	0	3	343.446	3.216	20	30		EGEDHN
CCc1ccsc1C(=O)N(C)[C@@H](C)CNCc1ccc(C#N)s1	ZINC001714878144	1419613544	/nfs/dbraw/zinc/61/35/44/1419613544.db2.gz	GJGKCIADEBVODP-LBPRGKRZSA-N	0	3	347.509	3.494	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cnc(C3CC3)s2)CCCC1	ZINC001715307732	1420016894	/nfs/dbraw/zinc/01/68/94/1420016894.db2.gz	MSZNYHBJLPEJEA-UHFFFAOYSA-N	0	3	339.892	3.405	20	30		EGEDHN
C[C@H]1CCCN(C(=O)CCCF)[C@H]1CNCc1ccc(C#N)cc1F	ZINC001715475170	1420154445	/nfs/dbraw/zinc/15/44/45/1420154445.db2.gz	OEGAOMIUQMZKBR-KSSFIOAISA-N	0	3	349.425	3.164	20	30		EGEDHN
CCCCC(=O)N1CC[C@H]2[C@H](CCN2Cc2ccccc2C#N)C1	ZINC001715554499	1420249464	/nfs/dbraw/zinc/24/94/64/1420249464.db2.gz	SPFVNRYPAWFIQA-MOPGFXCFSA-N	0	3	325.456	3.171	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)C(C)(C)C1CC1)NCc1cc(C#N)ccc1F	ZINC001715623556	1420269798	/nfs/dbraw/zinc/26/97/98/1420269798.db2.gz	SYTIYAATWUAYLF-GOSISDBHSA-N	0	3	345.462	3.364	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)[C@@H]3CCCC(F)(F)C3)CC2)cc1	ZINC001733255888	1429406120	/nfs/dbraw/zinc/40/61/20/1429406120.db2.gz	UGTQFORQGCIUAD-MRXNPFEDSA-N	0	3	347.409	3.122	20	30		EGEDHN
C[C@H](CN(C)Cc1cccc(C#N)c1)NC(=O)C1(C)CCCCC1	ZINC001716037044	1420497189	/nfs/dbraw/zinc/49/71/89/1420497189.db2.gz	ASIAPNZOWYOKGY-MRXNPFEDSA-N	0	3	327.472	3.465	20	30		EGEDHN
C=C(Br)CN1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)C1(C)CC1)C2	ZINC001716998447	1421067574	/nfs/dbraw/zinc/06/75/74/1421067574.db2.gz	TTWPQTAGQPIYRD-BTTYYORXSA-N	0	3	341.293	3.054	20	30		EGEDHN
CC(C)CC(=O)N[C@@H]1CCN(Cc2ccc(OCC#N)cc2)[C@H](C)C1	ZINC001717325921	1421260878	/nfs/dbraw/zinc/26/08/78/1421260878.db2.gz	ITXGKHIMWQUCKH-SJLPKXTDSA-N	0	3	343.471	3.104	20	30		EGEDHN
CC(C)CC(=O)N[C@H]1CCN(Cc2ccc(OCC#N)cc2)[C@@H](C)C1	ZINC001717325922	1421261544	/nfs/dbraw/zinc/26/15/44/1421261544.db2.gz	ITXGKHIMWQUCKH-WMZOPIPTSA-N	0	3	343.471	3.104	20	30		EGEDHN
C=C(Br)CNCC(C)(C)CN(C)C(=O)[C@H](C)C1CC1	ZINC001717451847	1421381760	/nfs/dbraw/zinc/38/17/60/1421381760.db2.gz	JKUDUOKQKVXFPE-GFCCVEGCSA-N	0	3	331.298	3.015	20	30		EGEDHN
C[C@@H](CNC(=O)[C@@H]1CC[C@@H](C)CC1)N(C)Cc1cccc(C#N)c1	ZINC001717496019	1421437053	/nfs/dbraw/zinc/43/70/53/1421437053.db2.gz	ZVOIHRAUSOLBRJ-BXWFABGCSA-N	0	3	327.472	3.321	20	30		EGEDHN
CN(C(=O)CC1(C)CC1)[C@H](CNCc1cc(C#N)ccc1F)C1CC1	ZINC001717733489	1421598397	/nfs/dbraw/zinc/59/83/97/1421598397.db2.gz	ICCYJEPSXKLNTD-GOSISDBHSA-N	0	3	343.446	3.214	20	30		EGEDHN
CC1(CC(=O)NC[C@]2(C)CCCN(Cc3cccc(C#N)c3)C2)CC1	ZINC001733464012	1429694042	/nfs/dbraw/zinc/69/40/42/1429694042.db2.gz	SFQAQIKOGQFWQI-NRFANRHFSA-N	0	3	339.483	3.467	20	30		EGEDHN
Cc1scc(C(=O)NCC2(NCc3cccc(C#N)c3)CC2)c1C	ZINC001723520417	1424449450	/nfs/dbraw/zinc/44/94/50/1424449450.db2.gz	FXQNPWGEFVWJKO-UHFFFAOYSA-N	0	3	339.464	3.289	20	30		EGEDHN
CCC(CC)[C@@H](C)C(=O)NCC1(NCc2ccc(C#N)cc2)CC1	ZINC001723531508	1424454247	/nfs/dbraw/zinc/45/42/47/1424454247.db2.gz	FIVXHTOOOQYDKZ-OAHLLOKOSA-N	0	3	327.472	3.369	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)C3(c4ccccc4)CC3)CC2)cc1	ZINC001723588332	1424477843	/nfs/dbraw/zinc/47/78/43/1424477843.db2.gz	PKFDUILTAVEDBY-UHFFFAOYSA-N	0	3	345.446	3.028	20	30		EGEDHN
N#Cc1ccc(CN2CCCCC[C@H]2CNC(=O)CC2CC2)cc1	ZINC001725242879	1425853253	/nfs/dbraw/zinc/85/32/53/1425853253.db2.gz	MVAOMEQHIUUCRQ-IBGZPJMESA-N	0	3	325.456	3.219	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)COc1ccsc1	ZINC001731290535	1427232876	/nfs/dbraw/zinc/23/28/76/1427232876.db2.gz	AAPRPKNZFMZBGS-HIFRSBDPSA-N	0	3	342.892	3.239	20	30		EGEDHN
CCCC[C@@H](C)C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001731442041	1427421304	/nfs/dbraw/zinc/42/13/04/1427421304.db2.gz	LMKAQTGMVRNSLW-KBRIMQKVSA-N	0	3	331.435	3.260	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H](CNC(=O)C3(F)CCCC3)C2)cc1	ZINC001731502822	1427484481	/nfs/dbraw/zinc/48/44/81/1427484481.db2.gz	OBYVKTWBGUQFAR-GOSISDBHSA-N	0	3	343.446	3.169	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCCN(CC)CC#Cc1ccccc1	ZINC001752210785	1440155284	/nfs/dbraw/zinc/15/52/84/1440155284.db2.gz	ZGSUTSJHNDYLCP-NRFANRHFSA-N	0	3	326.484	3.469	20	30		EGEDHN
C#CCCCC(=O)N(C)C1CCN(Cc2ccc(COC)cc2)CC1	ZINC001752299668	1440167263	/nfs/dbraw/zinc/16/72/63/1440167263.db2.gz	KWSWOWLKWAZIAV-UHFFFAOYSA-N	0	3	342.483	3.059	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N(C)C1CCN(CCc2ccns2)CC1	ZINC001752307689	1440168707	/nfs/dbraw/zinc/16/87/07/1440168707.db2.gz	DBEFRCCFZKQYQC-OAHLLOKOSA-N	0	3	335.517	3.211	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N(C)C1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC001752308665	1440169174	/nfs/dbraw/zinc/16/91/74/1440169174.db2.gz	RBXQORMXNFLBAT-YLJYHZDGSA-N	0	3	344.499	3.245	20	30		EGEDHN
Cc1ccccc1CCCN1CCC[C@H](NC(=O)C#CC(C)C)C1	ZINC001752320438	1440170541	/nfs/dbraw/zinc/17/05/41/1440170541.db2.gz	WJLMXNOFZQLBIO-FQEVSTJZSA-N	0	3	326.484	3.168	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@H]1CC12CCN(Cc1cccc(C(F)F)c1)CC2	ZINC001752424185	1440176523	/nfs/dbraw/zinc/17/65/23/1440176523.db2.gz	SSQIBNXNKWKQGX-CJNGLKHVSA-N	0	3	347.409	3.255	20	30		EGEDHN
C=CCN1CCC(N(CCC)C(=O)c2cnn(C(C)(C)C)c2)CC1	ZINC001752440462	1440181189	/nfs/dbraw/zinc/18/11/89/1440181189.db2.gz	XWFXJPCZFMOLIG-UHFFFAOYSA-N	0	3	332.492	3.141	20	30		EGEDHN
C=C(C)CN1CCC(N(CCC)C(=O)c2cn3ccccc3n2)CC1	ZINC001752441378	1440181337	/nfs/dbraw/zinc/18/13/37/1440181337.db2.gz	HFKWSFYVZIEUND-UHFFFAOYSA-N	0	3	340.471	3.227	20	30		EGEDHN
N#Cc1ccc(CN[C@H](CNC(=O)c2ccccc2F)C2CC2)s1	ZINC001752444078	1440181898	/nfs/dbraw/zinc/18/18/98/1440181898.db2.gz	DEEKJMMRULTVKP-QGZVFWFLSA-N	0	3	343.427	3.057	20	30		EGEDHN
O=C(NC[C@@H](NCC#Cc1ccc(Cl)cc1)C1CC1)c1ccco1	ZINC001752446844	1440182137	/nfs/dbraw/zinc/18/21/37/1440182137.db2.gz	ZUQITZYQOLDDLL-QGZVFWFLSA-N	0	3	342.826	3.083	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@@H](CN(C)Cc2ncccc2C)C1	ZINC001752519039	1440192180	/nfs/dbraw/zinc/19/21/80/1440192180.db2.gz	RCDNJOGJIGBQDA-IBGZPJMESA-N	0	3	341.499	3.254	20	30		EGEDHN
O=C(CCC1CCCC1)N[C@H]1C[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001752612531	1440196283	/nfs/dbraw/zinc/19/62/83/1440196283.db2.gz	IFYYRYFMVDCQJK-MXVIHJGJSA-N	0	3	342.458	3.384	20	30		EGEDHN
O=C(N[C@H]1C[C@H](NCC#Cc2cccc(Cl)c2)C1)C1(CCF)CC1	ZINC001752647086	1440197887	/nfs/dbraw/zinc/19/78/87/1440197887.db2.gz	JBRANEGZLMZVEK-QAQDUYKDSA-N	0	3	348.849	3.068	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)CCc2cccc(Cl)c2)C1	ZINC001752652281	1440197992	/nfs/dbraw/zinc/19/79/92/1440197992.db2.gz	IRYVFZODVHAOFR-SHTZXODSSA-N	0	3	327.255	3.262	20	30		EGEDHN
CCC[C@@H](C(=O)N[C@H]1C[C@@H](NCC#Cc2ccccc2)C1)C(C)C	ZINC001752768916	1440205867	/nfs/dbraw/zinc/20/58/67/1440205867.db2.gz	LCFNAXBTRNLLKV-HSALFYBXSA-N	0	3	326.484	3.347	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H]1CCCN(Cc2c(C)noc2CC)C1	ZINC001752781263	1440208884	/nfs/dbraw/zinc/20/88/84/1440208884.db2.gz	OHACTTUMLAUFLB-KRWDZBQOSA-N	0	3	345.487	3.067	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)[C@H](C)CCc2ccc(F)cc2)C1	ZINC001752783823	1440210015	/nfs/dbraw/zinc/21/00/15/1440210015.db2.gz	PVKKKWXNCCFTBO-MJGOQNOKSA-N	0	3	344.474	3.246	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC[C@H](CNCc2ncc(C)s2)C1	ZINC001752804373	1440215551	/nfs/dbraw/zinc/21/55/51/1440215551.db2.gz	GBUGTATVPLGDOX-QGZVFWFLSA-N	0	3	347.528	3.363	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)[C@]1(C)CCCc2ccccc21	ZINC001752823477	1440222144	/nfs/dbraw/zinc/22/21/44/1440222144.db2.gz	CMBDDJXSGINQBB-DENIHFKCSA-N	0	3	338.495	3.275	20	30		EGEDHN
C[C@@H](NC(=O)CC1CCC1)[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001752838360	1440228881	/nfs/dbraw/zinc/22/88/81/1440228881.db2.gz	QRXHQBJKOYODPK-UZLBHIALSA-N	0	3	339.483	3.465	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)C(C)(C)c2ccccc2Cl)C1	ZINC001752840100	1440229990	/nfs/dbraw/zinc/22/99/90/1440229990.db2.gz	GONKCWCPKHOTRV-JKSUJKDBSA-N	0	3	346.902	3.468	20	30		EGEDHN
C=C(C)CCC(=O)NC1CCC(N[C@@H](C)c2cnc(C)cn2)CC1	ZINC001752850239	1440233336	/nfs/dbraw/zinc/23/33/36/1440233336.db2.gz	PKDSNJVTPAUOTI-GTPINHCMSA-N	0	3	330.476	3.219	20	30		EGEDHN
C[C@@H](CNC(=O)CC1CCCCC1)NCc1ccc(C#N)c(F)c1	ZINC001752858922	1440235261	/nfs/dbraw/zinc/23/52/61/1440235261.db2.gz	SEDUDNZHRHNVAN-AWEZNQCLSA-N	0	3	331.435	3.262	20	30		EGEDHN
C[C@H](CNC(=O)[C@@H]1CCC=CCCC1)NCc1ccc(C#N)s1	ZINC001752883919	1440239565	/nfs/dbraw/zinc/23/95/65/1440239565.db2.gz	NAETYMFKCTYOCQ-HUUCEWRRSA-N	0	3	331.485	3.351	20	30		EGEDHN
Cc1cc(F)ccc1C(=O)NC[C@@H](C)NCc1ccc(F)c(C#N)c1	ZINC001752914638	1440246614	/nfs/dbraw/zinc/24/66/14/1440246614.db2.gz	RWJLVOGNTVGYJD-CYBMUJFWSA-N	0	3	343.377	3.053	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](CNCc2csc(CCC)n2)C1	ZINC001752937274	1440250590	/nfs/dbraw/zinc/25/05/90/1440250590.db2.gz	BGJGUXYVRKDMMI-OAHLLOKOSA-N	0	3	335.517	3.390	20	30		EGEDHN
CC#CCN(C)[C@H]1CCCN(C(=O)C[C@@H](C)c2cccc(OC)c2)C1	ZINC001752999812	1440263927	/nfs/dbraw/zinc/26/39/27/1440263927.db2.gz	ICKVBFDSEQDQRS-MJGOQNOKSA-N	0	3	342.483	3.135	20	30		EGEDHN
C[C@H](CCNC(=O)[C@@]12C[C@@H]1CCCC2)NCc1ccccc1C#N	ZINC001753013579	1440267602	/nfs/dbraw/zinc/26/76/02/1440267602.db2.gz	PPZYPMUCWBHOLX-BPAFIMBUSA-N	0	3	325.456	3.123	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC[C@@H](C)NCc2cc(O)ccc2Cl)C1	ZINC001753013646	1440267777	/nfs/dbraw/zinc/26/77/77/1440267777.db2.gz	RPRUWCHKIIRZNY-CYBMUJFWSA-N	0	3	336.863	3.386	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1CCCNC(=O)c1sccc1OC	ZINC001753038045	1440275254	/nfs/dbraw/zinc/27/52/54/1440275254.db2.gz	NRVMXGIJNWJRFX-CYBMUJFWSA-N	0	3	342.892	3.484	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NCCN(C)Cc1ccc(C2CC2)cc1	ZINC001753071758	1440288807	/nfs/dbraw/zinc/28/88/07/1440288807.db2.gz	BTPWGVIRCDXNRJ-UHFFFAOYSA-N	0	3	346.474	3.336	20	30		EGEDHN
C=C[C@@](C)(O)CC(=O)NCCN(CC)Cc1cc2ccccc2s1	ZINC001753080905	1440293593	/nfs/dbraw/zinc/29/35/93/1440293593.db2.gz	MOJYYFNFSVLEQH-LJQANCHMSA-N	0	3	346.496	3.167	20	30		EGEDHN
C=CCOCC(=O)NC[C@H]1CCCN1Cc1cc2ccccc2s1	ZINC001753097590	1440303021	/nfs/dbraw/zinc/30/30/21/1440303021.db2.gz	QFEIPBTUSZLZOA-MRXNPFEDSA-N	0	3	344.480	3.185	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC001753136056	1440318943	/nfs/dbraw/zinc/31/89/43/1440318943.db2.gz	SEUYUMYXFLXGCS-GOSISDBHSA-N	0	3	325.456	3.099	20	30		EGEDHN
CC(C)N(CC#Cc1ccccc1Cl)CCCNC(=O)C1CC1	ZINC001753281649	1440347530	/nfs/dbraw/zinc/34/75/30/1440347530.db2.gz	KJMNXOIAZHOZAR-UHFFFAOYSA-N	0	3	332.875	3.318	20	30		EGEDHN
C=CCN[C@H](CNC(=O)C[C@H]1CCCO1)c1ccc(C(C)C)cc1	ZINC001753294777	1440351841	/nfs/dbraw/zinc/35/18/41/1440351841.db2.gz	UYMLRPIJTNLXTO-RTBURBONSA-N	0	3	330.472	3.312	20	30		EGEDHN
C#CCCN[C@H](CNC(=O)C1(c2ccccc2C)CC1)c1ccccc1	ZINC001753302872	1440354702	/nfs/dbraw/zinc/35/47/02/1440354702.db2.gz	LLWWLKLENCQIMV-OAQYLSRUSA-N	0	3	346.474	3.497	20	30		EGEDHN
C#CCCN[C@H](CNC(=O)c1scnc1C(C)C)c1ccccc1	ZINC001753310345	1440356331	/nfs/dbraw/zinc/35/63/31/1440356331.db2.gz	CAQICEQNCDLFPK-MRXNPFEDSA-N	0	3	341.480	3.351	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CCC)C(=O)CCc2cncc(C)c2)C1	ZINC001753318460	1440361265	/nfs/dbraw/zinc/36/12/65/1440361265.db2.gz	JMEDNRALVLGMDQ-IBGZPJMESA-N	0	3	329.488	3.212	20	30		EGEDHN
CCC(CC)C(=O)NCC[C@H]1CCN(Cc2ccc(C#N)s2)C1	ZINC001753322792	1440364611	/nfs/dbraw/zinc/36/46/11/1440364611.db2.gz	QXQHVSUBWUZSAT-AWEZNQCLSA-N	0	3	333.501	3.384	20	30		EGEDHN
CCC[C@@H](C)C(=O)NCC[C@@H]1CCN(CC#Cc2ccc(F)cc2)C1	ZINC001753325059	1440366013	/nfs/dbraw/zinc/36/60/13/1440366013.db2.gz	OUHLOOSKLROCCV-IEBWSBKVSA-N	0	3	344.474	3.442	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](CN(C)Cc2oc(C)nc2C)C1	ZINC001753349029	1440376984	/nfs/dbraw/zinc/37/69/84/1440376984.db2.gz	HJKWWMBNBQMHAC-KRWDZBQOSA-N	0	3	345.487	3.340	20	30		EGEDHN
C=CCC1(C(=O)NCC2CN(C[C@H]3CC[C@@H](C)O3)C2)CCCCC1	ZINC001753417381	1440394573	/nfs/dbraw/zinc/39/45/73/1440394573.db2.gz	OJZMXBXSODQATA-SJLPKXTDSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(N(C)C)cc1	ZINC001753426471	1440396935	/nfs/dbraw/zinc/39/69/35/1440396935.db2.gz	BLLHAPUMLRQNJI-SNRMKQJTSA-N	0	3	327.472	3.006	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H]2C[C@H]1CN2C(=O)c1ncccc1OC(C)C	ZINC001753426545	1440397086	/nfs/dbraw/zinc/39/70/86/1440397086.db2.gz	FJNNOXIDYZGBBM-ULQDDVLXSA-N	0	3	343.471	3.122	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N(C)[C@H]1CCN(Cc2cccc(N(C)C)c2)C1	ZINC001753441667	1440401879	/nfs/dbraw/zinc/40/18/79/1440401879.db2.gz	NNXXWGJCPZIYLE-PXNSSMCTSA-N	0	3	343.515	3.388	20	30		EGEDHN
C#CCCN1CC[C@@H](N(C)C(=O)C[C@H](C)c2ccc(CC)cc2)C1	ZINC001753444450	1440402931	/nfs/dbraw/zinc/40/29/31/1440402931.db2.gz	RCVLXKSCJSZUQV-FXAWDEMLSA-N	0	3	326.484	3.299	20	30		EGEDHN
C=CCC1(C(=O)N(C)[C@H]2CCN(C[C@H]3CCCCO3)C2)CCCC1	ZINC001753451169	1440405823	/nfs/dbraw/zinc/40/58/23/1440405823.db2.gz	YMQPDQWXRPRIDQ-ZWKOTPCHSA-N	0	3	334.504	3.225	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)CCc2ccc(C)cc2C)C1	ZINC001753462360	1440411537	/nfs/dbraw/zinc/41/15/37/1440411537.db2.gz	TXOXUNXGQHGBOQ-FQEVSTJZSA-N	0	3	326.484	3.182	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)CCc2ccc(OC)c(F)c2)C1	ZINC001753462915	1440411711	/nfs/dbraw/zinc/41/17/11/1440411711.db2.gz	ZTEBXOFJIMTYSI-QGZVFWFLSA-N	0	3	348.462	3.266	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N(CC)[C@H]2CCN(CC(=C)C)C2)cc1	ZINC001753463436	1440411970	/nfs/dbraw/zinc/41/19/70/1440411970.db2.gz	HACDLCZXPYWUBF-IBGZPJMESA-N	0	3	342.483	3.293	20	30		EGEDHN
CC[C@@H](CNC(=O)[C@H](C)C1CC1)NCC#Cc1ccccc1Cl	ZINC001753469100	1440413426	/nfs/dbraw/zinc/41/34/26/1440413426.db2.gz	TZBUXQLKTKAYJC-PBHICJAKSA-N	0	3	332.875	3.222	20	30		EGEDHN
CC[C@@H](CNC(=O)C#CC(C)C)NCc1cc(C(C)C)ccc1OC	ZINC001753472042	1440414200	/nfs/dbraw/zinc/41/42/00/1440414200.db2.gz	YVCFCTRLVBQGEI-IBGZPJMESA-N	0	3	344.499	3.462	20	30		EGEDHN
CC[C@@H](CNC(=O)c1cc[nH]c1C(C)C)NCC#Cc1ccccc1	ZINC001753483110	1440417003	/nfs/dbraw/zinc/41/70/03/1440417003.db2.gz	IHKUKEVRUDXPOB-SFHVURJKSA-N	0	3	337.467	3.288	20	30		EGEDHN
C=CCCCC(=O)NC1(CN[C@H](C)c2cnc(C)cn2)CCCC1	ZINC001753507172	1440424730	/nfs/dbraw/zinc/42/47/30/1440424730.db2.gz	OXQYGGRYGWYUNI-MRXNPFEDSA-N	0	3	330.476	3.221	20	30		EGEDHN
C=C(Br)CNC[C@@](C)(NC(=O)/C=C(\C)C1CC1)C1CC1	ZINC001753514461	1440427151	/nfs/dbraw/zinc/42/71/51/1440427151.db2.gz	ITNVFGDJEVDXME-YCABEKBOSA-N	0	3	341.293	3.126	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2cscn2)CCCC[C@H]1C	ZINC001753531690	1440431210	/nfs/dbraw/zinc/43/12/10/1440431210.db2.gz	LMTXYSPBLJWWIA-ABAIWWIYSA-N	0	3	327.881	3.164	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2ccns2)CCCC[C@@H]1C	ZINC001753534385	1440431992	/nfs/dbraw/zinc/43/19/92/1440431992.db2.gz	SNQHMTBSKWKAMZ-XHDPSFHLSA-N	0	3	327.881	3.164	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2ccc(OC)o2)CCCC[C@@H]1C	ZINC001753536249	1440432789	/nfs/dbraw/zinc/43/27/89/1440432789.db2.gz	RMEZCVMFPAJZLR-YVEFUNNKSA-N	0	3	340.851	3.309	20	30		EGEDHN
CC#CCNCc1ccc(CNC(=O)c2ccnc3ccccc32)cc1	ZINC001753589731	1440442494	/nfs/dbraw/zinc/44/24/94/1440442494.db2.gz	LIBKNAXRLRFTOS-UHFFFAOYSA-N	0	3	343.430	3.278	20	30		EGEDHN
C#CCNCc1ccc(CNC(=O)[C@H](CC)Cc2ccccc2)cc1	ZINC001753590554	1440442719	/nfs/dbraw/zinc/44/27/19/1440442719.db2.gz	KAFPHRHEYBEUFM-OAQYLSRUSA-N	0	3	334.463	3.295	20	30		EGEDHN
C[C@H](CNCc1cc(F)ccc1C#N)CNC(=O)C[C@H]1C=CCCC1	ZINC001753620880	1440450376	/nfs/dbraw/zinc/45/03/76/1440450376.db2.gz	DGDIHXDDJLKMPC-CVEARBPZSA-N	0	3	343.446	3.286	20	30		EGEDHN
O=C(NCC1(NCC#Cc2ccccc2)CCCC1)[C@H]1CC[C@H](F)C1	ZINC001753667664	1440460803	/nfs/dbraw/zinc/46/08/03/1440460803.db2.gz	FGBRKYRDNMAZNX-OALUTQOASA-N	0	3	342.458	3.195	20	30		EGEDHN
C[C@H](CNCC#Cc1ccc(Cl)cc1)N(C)C(=O)C1=CCCC1	ZINC001753687066	1440465877	/nfs/dbraw/zinc/46/58/77/1440465877.db2.gz	ZGVVYGLJZGCYMF-OAHLLOKOSA-N	0	3	330.859	3.238	20	30		EGEDHN
C[C@H](CNCC=C(Cl)Cl)N(C)C(=O)CC#Cc1ccccc1	ZINC001753730259	1440475673	/nfs/dbraw/zinc/47/56/73/1440475673.db2.gz	XTRALEWIAJDWBV-CQSZACIVSA-N	0	3	339.266	3.184	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCCC[C@H]1CCNCc1cc(C)n(C)n1	ZINC001753776847	1440486633	/nfs/dbraw/zinc/48/66/33/1440486633.db2.gz	LBXUFDFXKLXLRW-SFHVURJKSA-N	0	3	346.519	3.192	20	30		EGEDHN
Cc1nc(C)c(CNCC[C@H]2CCCCN2C(=O)C#CC(C)(C)C)o1	ZINC001753777501	1440486759	/nfs/dbraw/zinc/48/67/59/1440486759.db2.gz	RORCLJOVQVXUSB-QGZVFWFLSA-N	0	3	345.487	3.202	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCCCN1C(=O)c1cccn2nccc12	ZINC001753781829	1440487352	/nfs/dbraw/zinc/48/73/52/1440487352.db2.gz	SUQWWPOLAAEPDU-OAHLLOKOSA-N	0	3	346.862	3.061	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H]([C@@H](C)NCc2nc(C)sc2C)C1	ZINC001753793256	1440489189	/nfs/dbraw/zinc/48/91/89/1440489189.db2.gz	WDKDNYQZIKOHRE-CZUORRHYSA-N	0	3	335.517	3.443	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@@H](NCC#Cc1ccc(Cl)cc1)C(C)C	ZINC001753829324	1440499145	/nfs/dbraw/zinc/49/91/45/1440499145.db2.gz	OWPRZCXQYDXSPJ-LJQANCHMSA-N	0	3	344.886	3.081	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H]1C(=O)NC[C@H](NCC#Cc1ccccc1)C(C)C	ZINC001753841360	1440502828	/nfs/dbraw/zinc/50/28/28/1440502828.db2.gz	XVLWZDDBNDRZQX-NJYVYQBISA-N	0	3	340.511	3.451	20	30		EGEDHN
CC[C@@H](c1ccc(F)cc1)N(C)CCN(C)C(=O)c1c[nH]c(C#N)c1	ZINC001753851184	1440506801	/nfs/dbraw/zinc/50/68/01/1440506801.db2.gz	VPDNHIDQUHDIQD-SFHVURJKSA-N	0	3	342.418	3.181	20	30		EGEDHN
C[C@H](CCNCc1cc(C#N)ccc1F)NC(=O)C[C@@H]1C[C@H]1C1CC1	ZINC001753985632	1440528468	/nfs/dbraw/zinc/52/84/68/1440528468.db2.gz	YFGCGYOTGGKJAP-SKDZVZGDSA-N	0	3	343.446	3.118	20	30		EGEDHN
CCN(CCNCc1cccc(C#N)c1)C(=O)c1ccc(C)s1	ZINC001754030492	1440533590	/nfs/dbraw/zinc/53/35/90/1440533590.db2.gz	RPBVMPIREAABGZ-UHFFFAOYSA-N	0	3	327.453	3.180	20	30		EGEDHN
CCN(CCNCc1ccc(C#N)s1)C(=O)c1ccc(F)cc1	ZINC001754030662	1440533682	/nfs/dbraw/zinc/53/36/82/1440533682.db2.gz	YYHRHTRJUCOWOG-UHFFFAOYSA-N	0	3	331.416	3.011	20	30		EGEDHN
CCN(CCNCc1ccc(C#N)cc1)C(=O)c1cccnc1C1CC1	ZINC001754055429	1440536216	/nfs/dbraw/zinc/53/62/16/1440536216.db2.gz	QLFAZMWMWQKUDF-UHFFFAOYSA-N	0	3	348.450	3.083	20	30		EGEDHN
CCN(CCNCc1ccc(C#N)c(F)c1)C(=O)[C@@H]1CCC(C)(C)C1	ZINC001754065577	1440537509	/nfs/dbraw/zinc/53/75/09/1440537509.db2.gz	KBTSLQBSTZXBRR-MRXNPFEDSA-N	0	3	345.462	3.462	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NC/C=C\CNCc1cccc(Cl)c1	ZINC001754182248	1440548264	/nfs/dbraw/zinc/54/82/64/1440548264.db2.gz	PWLUKYCLKMRLOZ-OOUWWJCLSA-N	0	3	348.874	3.083	20	30		EGEDHN
N#Cc1cccc(CNC/C=C/CNC(=O)[C@@H]2C[C@H]2c2ccccc2)c1	ZINC001754196848	1440549456	/nfs/dbraw/zinc/54/94/56/1440549456.db2.gz	KQIXUJAXJYZFGI-ARMKIQIJSA-N	0	3	345.446	3.124	20	30		EGEDHN
Cc1ccc(C(=O)NC/C=C\CNCc2ccc(C#N)c(F)c2)cc1	ZINC001754200408	1440549986	/nfs/dbraw/zinc/54/99/86/1440549986.db2.gz	GMZXLWSNRCTMNE-IHWYPQMZSA-N	0	3	337.398	3.082	20	30		EGEDHN
Cc1oc(C)c(C(=O)N[C@@H](C)CNCc2ccc(C#N)s2)c1C	ZINC001754275242	1440562094	/nfs/dbraw/zinc/56/20/94/1440562094.db2.gz	RQLPDFRCVLYZOW-JTQLQIEISA-N	0	3	331.441	3.046	20	30		EGEDHN
CCC1(C(=O)N[C@@H](C)CNCC#Cc2ccccc2)CCCCC1	ZINC001754295058	1440566176	/nfs/dbraw/zinc/56/61/76/1440566176.db2.gz	KXADESPXEAQWRL-SFHVURJKSA-N	0	3	326.484	3.493	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccccc1)NC(=O)C1(C)C(C)(C)C1(C)C	ZINC001754297758	1440566771	/nfs/dbraw/zinc/56/67/71/1440566771.db2.gz	YPLUWTOZIPTCMQ-INIZCTEOSA-N	0	3	326.484	3.205	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)c1ccoc1Cl	ZINC001754307431	1440571541	/nfs/dbraw/zinc/57/15/41/1440571541.db2.gz	BNCKOLKELCTOJM-LBPRGKRZSA-N	0	3	331.803	3.055	20	30		EGEDHN
C=CCOCCN(C)C[C@H](C)NC(=O)c1cc2sccc2s1	ZINC001754314467	1440574589	/nfs/dbraw/zinc/57/45/89/1440574589.db2.gz	CQKAZMVEWYIZKQ-LBPRGKRZSA-N	0	3	338.498	3.216	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N(C)CCCNCc1cc(C#N)ccc1F	ZINC001754390457	1440594198	/nfs/dbraw/zinc/59/41/98/1440594198.db2.gz	TZTKLHDUNXNIMB-UUASQNMZSA-N	0	3	329.419	3.158	20	30		EGEDHN
CC1(C(=O)N[C@@H](CNCC#Cc2ccc(F)cc2)C2CC2)CC=CC1	ZINC001754450833	1440601100	/nfs/dbraw/zinc/60/11/00/1440601100.db2.gz	VFZWFLVRYINOIE-IBGZPJMESA-N	0	3	340.442	3.018	20	30		EGEDHN
C=C[C@@H](C(=O)N[C@H](CNCc1ccns1)C1CC1)c1ccccc1	ZINC001754461298	1440603503	/nfs/dbraw/zinc/60/35/03/1440603503.db2.gz	KKYNUMOCFUXELW-QZTJIDSGSA-N	0	3	341.480	3.097	20	30		EGEDHN
C=CCCCCCN1CC[C@H]1CNC(=O)[C@@H]1CCc2cccnc21	ZINC001754492176	1440610537	/nfs/dbraw/zinc/61/05/37/1440610537.db2.gz	XFQYBLPSNRXWPZ-ZWKOTPCHSA-N	0	3	327.472	3.048	20	30		EGEDHN
C=CCCCCCN1CC[C@H]1CNC(=O)c1[nH]nc2ccccc21	ZINC001754499656	1440613378	/nfs/dbraw/zinc/61/33/78/1440613378.db2.gz	CGSZGFZPKYNIMO-HNNXBMFYSA-N	0	3	326.444	3.113	20	30		EGEDHN
CC(C)(C(=O)NCC1(NCc2ccc(F)c(C#N)c2)CC1)C1CCC1	ZINC001754526551	1440621317	/nfs/dbraw/zinc/62/13/17/1440621317.db2.gz	OGTQVBIKQKFSTJ-UHFFFAOYSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@H]2CCC[C@@H](C1)N2C[C@H](OCC)C1CC1	ZINC001754553140	1440630597	/nfs/dbraw/zinc/63/05/97/1440630597.db2.gz	WJXJBFKFSZBNMA-FFGOWVMKSA-N	0	3	348.531	3.469	20	30		EGEDHN
CC/C(C)=C/C(=O)N1CC[C@H](NCc2ccccc2C#N)C[C@@H]1C	ZINC001754593838	1440641085	/nfs/dbraw/zinc/64/10/85/1440641085.db2.gz	UJCMUJFBFYGONK-KLTGIMADSA-N	0	3	325.456	3.384	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1CCC[C@H]1CNCC#Cc1ccc(F)cc1	ZINC001754610476	1440643754	/nfs/dbraw/zinc/64/37/54/1440643754.db2.gz	FKYANVKUHWDWPB-IBGZPJMESA-N	0	3	344.474	3.440	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC[C@H]2CNCC=C(Cl)Cl)cc1	ZINC001754613937	1440644201	/nfs/dbraw/zinc/64/42/01/1440644201.db2.gz	DDACKRHQVJXOOI-HNNXBMFYSA-N	0	3	337.250	3.181	20	30		EGEDHN
O=C(CC1CC(F)(F)C1)N1CCC[C@H]1CNCC#Cc1ccccc1	ZINC001754613636	1440644245	/nfs/dbraw/zinc/64/42/45/1440644245.db2.gz	RNXBKZNGPIUBHG-SFHVURJKSA-N	0	3	346.421	3.054	20	30		EGEDHN
C[C@H](C(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1)C1CCC1	ZINC001754627418	1440646644	/nfs/dbraw/zinc/64/66/44/1440646644.db2.gz	LBMVVEUAHHFDRQ-INIZCTEOSA-N	0	3	339.483	3.465	20	30		EGEDHN
C#CCN1CCC2(CO[C@H](CNC(=O)C[C@H](C)CC(C)(C)C)C2)CC1	ZINC001754631819	1440648138	/nfs/dbraw/zinc/64/81/38/1440648138.db2.gz	CINLONDDTBOTOZ-ROUUACIJSA-N	0	3	348.531	3.069	20	30		EGEDHN
C#CCN(C(=O)CSC(C)C)C1CCN(Cc2ccccc2)CC1	ZINC001754633193	1440648200	/nfs/dbraw/zinc/64/82/00/1440648200.db2.gz	QQYLJYDQDHTVSH-UHFFFAOYSA-N	0	3	344.524	3.254	20	30		EGEDHN
C#CCN(C(=O)[C@H]1CC[C@H](F)C1)C1CCN(Cc2ccccc2)CC1	ZINC001754640179	1440649027	/nfs/dbraw/zinc/64/90/27/1440649027.db2.gz	JRKRDRVYBYWUOW-OALUTQOASA-N	0	3	342.458	3.251	20	30		EGEDHN
C#CCN(C(=O)[C@@H](C)Cc1ccccc1C)C1CCN(CC=C)CC1	ZINC001754643331	1440649367	/nfs/dbraw/zinc/64/93/67/1440649367.db2.gz	TUSQSGPPLSWCNK-IBGZPJMESA-N	0	3	338.495	3.286	20	30		EGEDHN
O=C(N[C@@H](CNCC#Cc1ccc(Cl)cc1)C1CCCC1)C1CC1	ZINC001754643744	1440649525	/nfs/dbraw/zinc/64/95/25/1440649525.db2.gz	GXNUIVGROOJWFR-IBGZPJMESA-N	0	3	344.886	3.366	20	30		EGEDHN
CC[C@@H](C)CC(=O)N1CC[C@@](C)(CNCc2ccccc2C#N)C1	ZINC001754691760	1440666260	/nfs/dbraw/zinc/66/62/60/1440666260.db2.gz	CTBNXJUTMRUKNM-UZLBHIALSA-N	0	3	327.472	3.323	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@](C)(CNCc2ccccc2C#N)C1	ZINC001754703328	1440668368	/nfs/dbraw/zinc/66/83/68/1440668368.db2.gz	MYXSNXQNWINLPO-OAQYLSRUSA-N	0	3	337.467	3.080	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@](C)(CNCc3oc(C)nc3C)C2)CCC1	ZINC001754705165	1440668894	/nfs/dbraw/zinc/66/88/94/1440668894.db2.gz	XEMHRXCZGQYDMD-IBGZPJMESA-N	0	3	345.487	3.366	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCC1(C)CCN(Cc2cnoc2C)CC1	ZINC001754719119	1440672549	/nfs/dbraw/zinc/67/25/49/1440672549.db2.gz	VCLUFSXABPNJAZ-INIZCTEOSA-N	0	3	333.476	3.304	20	30		EGEDHN
C/C=C(/C)C(=O)NC[C@]1(C)CCCN(Cc2cccc(C#N)c2)C1	ZINC001754725257	1440675515	/nfs/dbraw/zinc/67/55/15/1440675515.db2.gz	KINJFQTZKVQKHH-OWSKGGOUSA-N	0	3	325.456	3.243	20	30		EGEDHN
C=CCN1CCC[C@@](C)(CNC(=O)C2(CCOCC)CCCC2)C1	ZINC001754731215	1440679452	/nfs/dbraw/zinc/67/94/52/1440679452.db2.gz	DGYFXGYZWCLGSA-IBGZPJMESA-N	0	3	336.520	3.378	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)CCC(F)(F)F)C2)CC1	ZINC001754783131	1440686881	/nfs/dbraw/zinc/68/68/81/1440686881.db2.gz	IZWQPJFOEQSKLZ-MRXNPFEDSA-N	0	3	344.421	3.303	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)CCC(F)(F)F)C2)CC1	ZINC001754783130	1440686917	/nfs/dbraw/zinc/68/69/17/1440686917.db2.gz	IZWQPJFOEQSKLZ-INIZCTEOSA-N	0	3	344.421	3.303	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@H]2CCCN3C(=O)CCC(F)F)c1	ZINC001754869404	1440704422	/nfs/dbraw/zinc/70/44/22/1440704422.db2.gz	WUUOHEZPPSWCTJ-SJORKVTESA-N	0	3	347.409	3.169	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)CCCCc3ccccc3)[C@@H]2C1	ZINC001754873216	1440705833	/nfs/dbraw/zinc/70/58/33/1440705833.db2.gz	AIFKVGMSRRNWOK-LEWJYISDSA-N	0	3	338.495	3.346	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)CCOc3ccc(C)c(C)c3)[C@@H]2C1	ZINC001754874264	1440706240	/nfs/dbraw/zinc/70/62/40/1440706240.db2.gz	QOWHQGPSAKCNKM-AZUAARDMSA-N	0	3	342.483	3.181	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CCN(C(=O)CCCCC)C1	ZINC001754902663	1440707248	/nfs/dbraw/zinc/70/72/48/1440707248.db2.gz	MJYSVBNNUGJCCP-CQSZACIVSA-N	0	3	331.298	3.304	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)C[C@@H]3CC=CCC3)cccc2C1	ZINC001754975783	1440719971	/nfs/dbraw/zinc/71/99/71/1440719971.db2.gz	NOFJDUCLTJDNTC-GOSISDBHSA-N	0	3	336.479	3.431	20	30		EGEDHN
C/C(=C/C(=O)N[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1)C1CC1	ZINC001755022081	1440727226	/nfs/dbraw/zinc/72/72/26/1440727226.db2.gz	YNZOVSRGEMXNON-VMTBQTDASA-N	0	3	337.467	3.385	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)C2(Cc3ccccc3)CCC2)CC1	ZINC001755024754	1440728065	/nfs/dbraw/zinc/72/80/65/1440728065.db2.gz	HTHZDXXKLVJRDD-FQEVSTJZSA-N	0	3	338.495	3.393	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CCCN(Cc2ncccc2C)CC1	ZINC001755025131	1440728514	/nfs/dbraw/zinc/72/85/14/1440728514.db2.gz	OYVZNGAUALDHBT-QGZVFWFLSA-N	0	3	329.488	3.463	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)CCCOC(C)C)C1	ZINC001755047438	1440742064	/nfs/dbraw/zinc/74/20/64/1440742064.db2.gz	NTKUOOJNFRVOFB-VQTJNVASSA-N	0	3	348.531	3.308	20	30		EGEDHN
COCC#CCN1CCC(CCCCCNC(=O)C2CCCC2)CC1	ZINC001755074738	1440748018	/nfs/dbraw/zinc/74/80/18/1440748018.db2.gz	KWJGRZGVMDKAME-UHFFFAOYSA-N	0	3	348.531	3.215	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)COC3CCCC3)cc2C1	ZINC001755101241	1440752646	/nfs/dbraw/zinc/75/26/46/1440752646.db2.gz	WVTVQSGWSSPUSB-UHFFFAOYSA-N	0	3	328.456	3.154	20	30		EGEDHN
C[C@H]1CN(C(=O)C2CC=CC2)C[C@H]1NCC#Cc1ccccc1Cl	ZINC001755107061	1440753811	/nfs/dbraw/zinc/75/38/11/1440753811.db2.gz	HLZAMTAKZZHYQI-HNAYVOBHSA-N	0	3	342.870	3.094	20	30		EGEDHN
C[C@@H]1CN(C(=O)/C=C\C(C)(C)C)C[C@@H]1NCc1ccc(C#N)c(F)c1	ZINC001755107301	1440753927	/nfs/dbraw/zinc/75/39/27/1440753927.db2.gz	LXFZXSUKJIDGEH-OANZSSJVSA-N	0	3	343.446	3.236	20	30		EGEDHN
CC1(C)CN(Cc2cccc(C#N)c2)CC[C@@H]1NC(=O)CCC1CC1	ZINC001755138631	1440759397	/nfs/dbraw/zinc/75/93/97/1440759397.db2.gz	BSRPLJMXTCZERN-IBGZPJMESA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC(O)(CN[C@@H](C)c2ccccc2F)CC1	ZINC001755154499	1440763229	/nfs/dbraw/zinc/76/32/29/1440763229.db2.gz	QUZLDBMEMQSBQV-INIZCTEOSA-N	0	3	348.462	3.186	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CCN(Cc2scnc2C)[C@@H](C)C1	ZINC001755164503	1440766444	/nfs/dbraw/zinc/76/64/44/1440766444.db2.gz	WOMFEONFZNJNTN-GOEBONIOSA-N	0	3	333.501	3.114	20	30		EGEDHN
C=CCC[C@@H](C)N1CCc2ccccc2[C@H]1CNC(=O)C#CC1CC1	ZINC001755172532	1440769727	/nfs/dbraw/zinc/76/97/27/1440769727.db2.gz	TXFSAUQUSVPXTQ-DYESRHJHSA-N	0	3	336.479	3.470	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)c2cccc(C)n2)CC1	ZINC001755182130	1440771399	/nfs/dbraw/zinc/77/13/99/1440771399.db2.gz	JABXWHWATQWEFF-UHFFFAOYSA-N	0	3	335.879	3.317	20	30		EGEDHN
C=CCOCCN[C@@H]1c2ccccc2C[C@H]1NC(=O)C(C)(C)C(=C)C	ZINC001755187186	1440773422	/nfs/dbraw/zinc/77/34/22/1440773422.db2.gz	ZCQNRIGYWHQGJI-RTBURBONSA-N	0	3	342.483	3.163	20	30		EGEDHN
C=CCOCCN[C@@H]1c2ccccc2C[C@H]1NC(=O)CC(C)=C(C)C	ZINC001755187150	1440773478	/nfs/dbraw/zinc/77/34/78/1440773478.db2.gz	XCCKTPFNYSXZNS-TZIWHRDSSA-N	0	3	342.483	3.307	20	30		EGEDHN
CC/C(C)=C\C(=O)N1CCC[C@@H]1CN(C)Cc1ccc(C#N)cc1	ZINC001755192406	1440775236	/nfs/dbraw/zinc/77/52/36/1440775236.db2.gz	FCLMVOLFUWLYJJ-KVVHSQDJSA-N	0	3	325.456	3.337	20	30		EGEDHN
C=C(Cl)CNCC1CC(NC(=O)c2cnc3c(F)cccc3c2)C1	ZINC001755214197	1440783834	/nfs/dbraw/zinc/78/38/34/1440783834.db2.gz	MALKZBOPEYSZHY-UHFFFAOYSA-N	0	3	347.821	3.224	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC1CC(CNCc2cc(C#N)ccc2F)C1	ZINC001755217286	1440784131	/nfs/dbraw/zinc/78/41/31/1440784131.db2.gz	BUULEJSTVWLZGI-UHFFFAOYSA-N	0	3	343.446	3.284	20	30		EGEDHN
C=C(Cl)CNCC1CC(NC(=O)Cc2ccccc2Cl)C1	ZINC001755220499	1440784565	/nfs/dbraw/zinc/78/45/65/1440784565.db2.gz	ORNJORDDPKCRFU-UHFFFAOYSA-N	0	3	327.255	3.119	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H](C)[C@H](C)NCC(=O)Nc1cccc(C)c1C	ZINC001755235438	1440788220	/nfs/dbraw/zinc/78/82/20/1440788220.db2.gz	CIQGWOXDHHWPRM-IRXDYDNUSA-N	0	3	345.487	3.081	20	30		EGEDHN
C[C@H](NCC#Cc1ccccc1)[C@H](C)NC(=O)C(C)(C)C1CCC1	ZINC001755247134	1440790824	/nfs/dbraw/zinc/79/08/24/1440790824.db2.gz	ZAEVMSMUMMSXTJ-IRXDYDNUSA-N	0	3	326.484	3.347	20	30		EGEDHN
Cc1coc(C(=O)N[C@@H](C)[C@H](C)NCC#Cc2ccccc2Cl)c1	ZINC001755248797	1440791427	/nfs/dbraw/zinc/79/14/27/1440791427.db2.gz	LHJIFMCYAUYQFN-GJZGRUSLSA-N	0	3	344.842	3.390	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](C)[C@@H](C)NCc2cccc(Cl)n2)CC1	ZINC001755253805	1440792731	/nfs/dbraw/zinc/79/27/31/1440792731.db2.gz	WPZGLZLMJMUSNJ-KGLIPLIRSA-N	0	3	335.879	3.464	20	30		EGEDHN
C[C@@H](CNC(=O)C#CC(C)(C)C)N(C)CCOC1CCCCCC1	ZINC001755300211	1440808091	/nfs/dbraw/zinc/80/80/91/1440808091.db2.gz	LXTPPAMRHPZQBY-KRWDZBQOSA-N	0	3	336.520	3.212	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@H](C)N(C)Cc2ccc(C)c(OC)c2)C1	ZINC001755315600	1440815547	/nfs/dbraw/zinc/81/55/47/1440815547.db2.gz	SNXDNWDFWOOLER-MRXNPFEDSA-N	0	3	330.472	3.296	20	30		EGEDHN
CC(C)[C@H](CCN(C)C(=O)C#CC1CC1)NCc1c(F)cccc1F	ZINC001755340629	1440825005	/nfs/dbraw/zinc/82/50/05/1440825005.db2.gz	ZOWPMHSFWJQYFK-IBGZPJMESA-N	0	3	348.437	3.341	20	30		EGEDHN
C=C(Cl)CNCCCOC1CCN(C(=O)/C=C(/C)CC)CC1	ZINC001755345296	1440826426	/nfs/dbraw/zinc/82/64/26/1440826426.db2.gz	LPQPGUYIOAGSAC-OWBHPGMISA-N	0	3	328.884	3.083	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@H]1CCCCCN1Cc1cncc(C)c1	ZINC001755365180	1440834131	/nfs/dbraw/zinc/83/41/31/1440834131.db2.gz	BWIFHBCNUMXSCZ-FQEVSTJZSA-N	0	3	341.499	3.444	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@]2(CCN(C(=O)CC(C)(C)CC)C2)C1	ZINC001755401620	1440843138	/nfs/dbraw/zinc/84/31/38/1440843138.db2.gz	JLRSOKQASQZVPJ-YLJYHZDGSA-N	0	3	336.520	3.471	20	30		EGEDHN
C[C@H](CCCNCc1ccccc1C#N)NC(=O)[C@@H]1CC=CCC1	ZINC001755487698	1440861054	/nfs/dbraw/zinc/86/10/54/1440861054.db2.gz	BCKOIZCLNBFILP-IAGOWNOFSA-N	0	3	325.456	3.289	20	30		EGEDHN
Cc1ccoc1C(=O)N[C@H](C)CCCNCc1ccc(C#N)cc1F	ZINC001755488673	1440861199	/nfs/dbraw/zinc/86/11/99/1440861199.db2.gz	PVGKBHAMQAQQMZ-CQSZACIVSA-N	0	3	343.402	3.287	20	30		EGEDHN
C[C@H](CCCNCc1cccc(Cl)n1)NC(=O)C#CC(C)(C)C	ZINC001755497654	1440862296	/nfs/dbraw/zinc/86/22/96/1440862296.db2.gz	BSFOLCQJYVEGMT-CQSZACIVSA-N	0	3	335.879	3.159	20	30		EGEDHN
C=C(Cl)CNCCC[C@H](C)NC(=O)c1ccc2ncccc2c1	ZINC001755513149	1440863714	/nfs/dbraw/zinc/86/37/14/1440863714.db2.gz	YLQUMNJZMWQXDJ-AWEZNQCLSA-N	0	3	331.847	3.475	20	30		EGEDHN
CN(C(=O)CC(C)(C)C)[C@@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001755555702	1440873052	/nfs/dbraw/zinc/87/30/52/1440873052.db2.gz	CNZNTRYALDVFDX-SFHVURJKSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N(C)C[C@H](C)NCc1ccc(C#N)c(F)c1	ZINC001755589695	1440881356	/nfs/dbraw/zinc/88/13/56/1440881356.db2.gz	ZGUWUZKQJINGNC-AWEZNQCLSA-N	0	3	333.451	3.316	20	30		EGEDHN
C[C@@H]1[C@@H](NCC#Cc2cccc(Cl)c2)CCN1C(=O)CC1CC1	ZINC001755649259	1440891142	/nfs/dbraw/zinc/89/11/42/1440891142.db2.gz	QRCGYJOJQZWSBG-KDOFPFPSSA-N	0	3	330.859	3.071	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)[C@H]1C	ZINC001755655378	1440891881	/nfs/dbraw/zinc/89/18/81/1440891881.db2.gz	VWCNCVKJYKMEQY-KDOFPFPSSA-N	0	3	329.419	3.133	20	30		EGEDHN
CC(C)n1cccc1C(=O)N1CC[C@@H](NCC#Cc2ccccc2)[C@@H]1C	ZINC001755666372	1440893419	/nfs/dbraw/zinc/89/34/19/1440893419.db2.gz	CGWRRQRUCRDKRX-AZUAARDMSA-N	0	3	349.478	3.313	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](NCc2ccc(C)nc2C)C[C@H]1C	ZINC001755674817	1440894466	/nfs/dbraw/zinc/89/44/66/1440894466.db2.gz	HNBGAMDSVGIIEP-QAPCUYQASA-N	0	3	329.488	3.380	20	30		EGEDHN
CC#CCN[C@H]1C[C@@H](C)N(C(=O)c2ccc(Cl)c3occc32)C1	ZINC001755691596	1440896829	/nfs/dbraw/zinc/89/68/29/1440896829.db2.gz	ZMYQZQRZKYWZAH-OLZOCXBDSA-N	0	3	330.815	3.302	20	30		EGEDHN
C#CCCCCC(=O)N[C@@]12CCC[C@H]1N(Cc1cnccc1C)CC2	ZINC001755697906	1440898548	/nfs/dbraw/zinc/89/85/48/1440898548.db2.gz	CUSZTKZVVVJPIX-TZIWHRDSSA-N	0	3	339.483	3.197	20	30		EGEDHN
Cc1cc(F)ccc1CN1CC[C@@]2(NC(=O)C#CC3CC3)CCC[C@H]12	ZINC001755700164	1440899630	/nfs/dbraw/zinc/89/96/30/1440899630.db2.gz	ZIWIBPNOUMWAEG-FPOVZHCZSA-N	0	3	340.442	3.161	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H]2CCC[C@@H](NCc3nccs3)[C@@H]2C1	ZINC001755708217	1440903086	/nfs/dbraw/zinc/90/30/86/1440903086.db2.gz	WHRHONRQNBTRPJ-ARFHVFGLSA-N	0	3	333.501	3.216	20	30		EGEDHN
C=C(Cl)CN[C@H](CCNC(=O)C#CC(C)(C)C)Cc1ccccc1	ZINC001755721975	1440907783	/nfs/dbraw/zinc/90/77/83/1440907783.db2.gz	DJODPSGXGKJMHC-GOSISDBHSA-N	0	3	346.902	3.496	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)COc2c(C)cccc2C)[C@H]1C	ZINC001755722143	1440907974	/nfs/dbraw/zinc/90/79/74/1440907974.db2.gz	QUDWKSJYQSOSIH-MSOLQXFVSA-N	0	3	330.472	3.227	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2CC[C@H](CNCc3nccs3)C2)CCC1	ZINC001755742264	1440911960	/nfs/dbraw/zinc/91/19/60/1440911960.db2.gz	CJNQXVIVLJHKEY-GJZGRUSLSA-N	0	3	333.501	3.264	20	30		EGEDHN
C[C@H](C(=O)N[C@@H](CNCC#Cc1ccccc1)C(C)(C)C)C1CC1	ZINC001755820954	1440925635	/nfs/dbraw/zinc/92/56/35/1440925635.db2.gz	VYRRSFGWCFNPCZ-LPHOPBHVSA-N	0	3	326.484	3.205	20	30		EGEDHN
CC(C)(C)[C@@H](CNCC#Cc1ccc(F)cc1)NC(=O)CCCF	ZINC001755829542	1440928205	/nfs/dbraw/zinc/92/82/05/1440928205.db2.gz	DSACBIJPACXIBC-QGZVFWFLSA-N	0	3	336.426	3.047	20	30		EGEDHN
C=C(Br)CNC[C@H](NC(=O)[C@@H]1C[C@H]1CCC)C(C)(C)C	ZINC001755832223	1440929032	/nfs/dbraw/zinc/92/90/32/1440929032.db2.gz	ITODVGCUTKVAOP-MCIONIFRSA-N	0	3	345.325	3.452	20	30		EGEDHN
CC#CCN1CCC([C@@H](C)NC(=O)[C@H](C)Oc2ccc(C)cc2)CC1	ZINC001755846350	1440933494	/nfs/dbraw/zinc/93/34/94/1440933494.db2.gz	WFTRNQULOTZOOQ-MSOLQXFVSA-N	0	3	342.483	3.002	20	30		EGEDHN
C/C(=C\C(=O)N(C)C1CC(NCC#Cc2ccc(F)cc2)C1)C1CC1	ZINC001755854291	1440935612	/nfs/dbraw/zinc/93/56/12/1440935612.db2.gz	GHFJMUIAAZKJGN-NTCAYCPXSA-N	0	3	340.442	3.113	20	30		EGEDHN
C=C(Br)CNC1CC(N(C)C(=O)CC(CC)CC)C1	ZINC001755862991	1440937128	/nfs/dbraw/zinc/93/71/28/1440937128.db2.gz	FYKXXHKTUWOYHL-UHFFFAOYSA-N	0	3	331.298	3.300	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCC1=CCN(C[C@H]2CCCCO2)CC1	ZINC001755888232	1440940825	/nfs/dbraw/zinc/94/08/25/1440940825.db2.gz	REUUYWPQWYHYIP-LJQANCHMSA-N	0	3	332.488	3.072	20	30		EGEDHN
C[C@@H]([NH2+][C@@H](C)c1ccc(OCC#N)cc1)c1cccc(-c2nnn[n-]2)c1	ZINC000824529977	946766256	/nfs/dbraw/zinc/76/62/56/946766256.db2.gz	INQXFAZMKOLQBJ-UONOGXRCSA-N	0	3	348.410	3.181	20	30		EGEDHN
Cn1cc(CN[C@@H]2CCO[C@@H]2c2ccc(Cl)c(F)c2)cc1C#N	ZINC000191550470	239180644	/nfs/dbraw/zinc/18/06/44/239180644.db2.gz	NUOVRCSUXBHUGY-IAGOWNOFSA-N	0	3	333.794	3.309	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCc3sccc3[C@@H]2CC)CC1	ZINC000264352765	246391473	/nfs/dbraw/zinc/39/14/73/246391473.db2.gz	MPDCHTFSBOWJQH-INIZCTEOSA-N	0	3	333.501	3.417	20	30		EGEDHN
CCOCCCN1CC[C@H](Nc2snc(Cl)c2C#N)[C@@H](C)C1	ZINC000265177027	247271942	/nfs/dbraw/zinc/27/19/42/247271942.db2.gz	CYOLZSMRWSQJEE-AAEUAGOBSA-N	0	3	342.896	3.217	20	30		EGEDHN
CC(=O)Nc1ccc(CN2CCCN(c3ccccc3C#N)CC2)cc1	ZINC000091792389	218066882	/nfs/dbraw/zinc/06/68/82/218066882.db2.gz	WKZYZKKTYQYRSH-UHFFFAOYSA-N	0	3	348.450	3.229	20	30		EGEDHN
C[C@H]1C[C@@H](N(C)C(=O)c2ccc(C#N)[nH]2)CCN1Cc1ccccc1	ZINC000153532239	224118812	/nfs/dbraw/zinc/11/88/12/224118812.db2.gz	IALCATHTUBGMSH-YJBOKZPZSA-N	0	3	336.439	3.011	20	30		EGEDHN
C[C@@H](N[C@H]1CC(C)(C)OC1(C)C)C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000132628518	533539118	/nfs/dbraw/zinc/53/91/18/533539118.db2.gz	HIOUBSXVICJKLE-ABAIWWIYSA-N	0	3	349.862	3.474	20	30		EGEDHN
C=CCOCCCC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C	ZINC000079316328	135624557	/nfs/dbraw/zinc/62/45/57/135624557.db2.gz	JCKZEXHZQBYZGR-UHFFFAOYSA-N	0	3	345.487	3.058	20	30		EGEDHN
C[C@@H](NC(=O)c1ncc(C#N)cc1Cl)[C@@H](c1ccccc1)N(C)C	ZINC000356236013	141325421	/nfs/dbraw/zinc/32/54/21/141325421.db2.gz	UWFHRNXANAHXQU-PXAZEXFGSA-N	0	3	342.830	3.028	20	30		EGEDHN
CCO[C@H]1C[C@@H](NCc2cc(C#N)cs2)[C@@H]1Oc1ccccc1	ZINC000187637636	144162368	/nfs/dbraw/zinc/16/23/68/144162368.db2.gz	HTKBSLHUTGZMHC-SQNIBIBYSA-N	0	3	328.437	3.334	20	30		EGEDHN
N#Cc1cc(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)ccc1F	ZINC000341117400	155169772	/nfs/dbraw/zinc/16/97/72/155169772.db2.gz	CNOSKNKMCIGVON-SFHVURJKSA-N	0	3	337.398	3.092	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CCc1ccc(C#N)cc1	ZINC000119563957	152214381	/nfs/dbraw/zinc/21/43/81/152214381.db2.gz	VSOXAOSCPYCJSV-UTKZUKDTSA-N	0	3	347.462	3.128	20	30		EGEDHN
CC[C@H](Cc1ccccc1)N[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000190619699	153151470	/nfs/dbraw/zinc/15/14/70/153151470.db2.gz	JPWGSWIUZPYGNI-NHCUHLMSSA-N	0	3	347.462	3.270	20	30		EGEDHN
Cn1cc(CNc2cccc(CN3CCSCC3)c2)cc1C#N	ZINC000191417594	153194541	/nfs/dbraw/zinc/19/45/41/153194541.db2.gz	NQZYYSMATSTHKQ-UHFFFAOYSA-N	0	3	326.469	3.058	20	30		EGEDHN
COc1ccc(CNc2cccc(OCCN(C)C)c2)cc1C#N	ZINC000336877524	154227914	/nfs/dbraw/zinc/22/79/14/154227914.db2.gz	PLPTXHAGTNEZEJ-UHFFFAOYSA-N	0	3	325.412	3.119	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)NCC1=CCN(C)CC1	ZINC000345440465	156107083	/nfs/dbraw/zinc/10/70/83/156107083.db2.gz	GQNPLLSNHZLXFZ-UHFFFAOYSA-N	0	3	325.437	3.073	20	30		EGEDHN
C[C@H]1CN(CCC2CCN(Cc3cc(C#N)cs3)CC2)C[C@H](C)O1	ZINC000093844437	162029812	/nfs/dbraw/zinc/02/98/12/162029812.db2.gz	OMXDVKPLLJNVLF-HOTGVXAUSA-N	0	3	347.528	3.331	20	30		EGEDHN
C[C@H](NCCNC(=O)c1ccc(Cl)cc1)c1cccc(C#N)c1	ZINC000344021057	164084296	/nfs/dbraw/zinc/08/42/96/164084296.db2.gz	NFUSVIMZOJMDSD-ZDUSSCGKSA-N	0	3	327.815	3.292	20	30		EGEDHN
C[C@H](NCc1ccc(CN2CCOCC2)cc1)c1ccc(C#N)cc1	ZINC000344102871	164103572	/nfs/dbraw/zinc/10/35/72/164103572.db2.gz	UPLQIMJDABZABU-KRWDZBQOSA-N	0	3	335.451	3.241	20	30		EGEDHN
CN(C)c1ccccc1CN(C)CCC(=O)Nc1ccc(C#N)cc1	ZINC000344114618	164106601	/nfs/dbraw/zinc/10/66/01/164106601.db2.gz	MRJSQLPZWIWVJY-UHFFFAOYSA-N	0	3	336.439	3.085	20	30		EGEDHN
COc1cccc(OCCN(C)CCOCc2ccc(C#N)cc2)c1	ZINC000344134738	164111798	/nfs/dbraw/zinc/11/17/98/164111798.db2.gz	ZGJGBSFQZVTYAV-UHFFFAOYSA-N	0	3	340.423	3.094	20	30		EGEDHN
COCCN(C)CC[C@@H](NCc1cc(C#N)cs1)c1ccccc1	ZINC000344274874	164144267	/nfs/dbraw/zinc/14/42/67/164144267.db2.gz	VCMWAQCQGWALEF-LJQANCHMSA-N	0	3	343.496	3.419	20	30		EGEDHN
CC[C@H](C(=O)NCCSCc1ccccc1C#N)N(CC)CC	ZINC000345952763	164302540	/nfs/dbraw/zinc/30/25/40/164302540.db2.gz	ICFWJBHVAHTJQE-QGZVFWFLSA-N	0	3	333.501	3.028	20	30		EGEDHN
N#Cc1cc(F)cc(OC[C@H]2CN(Cc3ccccc3)CCCO2)c1	ZINC000352043066	165206895	/nfs/dbraw/zinc/20/68/95/165206895.db2.gz	ZMRNKUMYROEQFZ-HXUWFJFHSA-N	0	3	340.398	3.367	20	30		EGEDHN
N#Cc1cccc(CNC(=O)CN[C@@H](c2ccccc2)C2CCC2)c1	ZINC000355396640	166184186	/nfs/dbraw/zinc/18/41/86/166184186.db2.gz	WUBXUJOQUFBKKA-NRFANRHFSA-N	0	3	333.435	3.305	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)[C@@H]1CCC(C)(C)C1	ZINC000358886480	166994659	/nfs/dbraw/zinc/99/46/59/166994659.db2.gz	LXKSLAOWBVTZOT-GOSISDBHSA-N	0	3	327.472	3.275	20	30		EGEDHN
CN(C)[C@]1(CNc2c(C#N)cnc3ccc(Cl)cc32)CCSC1	ZINC000359013523	167037471	/nfs/dbraw/zinc/03/74/71/167037471.db2.gz	IRUIVAPDURDXKN-KRWDZBQOSA-N	0	3	346.887	3.031	20	30		EGEDHN
Cc1ccc(F)c(C(=O)N(CCN(C)C)Cc2cccc(C#N)c2)c1	ZINC000171402048	227062520	/nfs/dbraw/zinc/06/25/20/227062520.db2.gz	KALLTBJEDJIBDI-UHFFFAOYSA-N	0	3	339.414	3.210	20	30		EGEDHN
COc1ccc([C@@H](C)NC[C@@H](O)c2ccc(C#N)cc2)c(C)c1OC	ZINC000287103816	269788981	/nfs/dbraw/zinc/78/89/81/269788981.db2.gz	XZHAHALXQIMXAV-RDTXWAMCSA-N	0	3	340.423	3.268	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)N(CCN(C)C)CC(C)C	ZINC000085576586	264936737	/nfs/dbraw/zinc/93/67/37/264936737.db2.gz	MKIQLFVDLRVGNF-UHFFFAOYSA-N	0	3	332.448	3.008	20	30		EGEDHN
CC[C@@H](Cc1ccccc1)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000279436959	270039776	/nfs/dbraw/zinc/03/97/76/270039776.db2.gz	YGPMGGMDFSYSTH-UXHICEINSA-N	0	3	331.419	3.378	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)cc1F	ZINC000453383826	270053420	/nfs/dbraw/zinc/05/34/20/270053420.db2.gz	MUCMLJLDMXKLBC-HZPDHXFCSA-N	0	3	343.362	3.076	20	30		EGEDHN
CC[C@H](C)N(CC(=O)NCc1cccc(C#N)c1)Cc1ccccc1	ZINC000507703410	270059057	/nfs/dbraw/zinc/05/90/57/270059057.db2.gz	BVCAABQGJUZPGG-KRWDZBQOSA-N	0	3	335.451	3.475	20	30		EGEDHN
N#Cc1ccccc1COc1cccc(CNCC23CC(C2)CO3)c1	ZINC000527786571	270059590	/nfs/dbraw/zinc/05/95/90/270059590.db2.gz	DOLQFKOSFFRXOY-UHFFFAOYSA-N	0	3	334.419	3.406	20	30		EGEDHN
Cc1ccc(C#N)cc1NC(=O)NC[C@@H]1CCN1C1CCCCC1	ZINC000528949177	270059874	/nfs/dbraw/zinc/05/98/74/270059874.db2.gz	RXDKXMGSMJQAHA-KRWDZBQOSA-N	0	3	326.444	3.395	20	30		EGEDHN
COc1ccc2c(c1)CCCN(CCC(=O)Nc1ccccc1C#N)C2	ZINC000533408376	270060674	/nfs/dbraw/zinc/06/06/74/270060674.db2.gz	NOIXETRAXGMVER-UHFFFAOYSA-N	0	3	349.434	3.344	20	30		EGEDHN
CC(C)CN(C(=O)c1c(F)cc(C#N)cc1F)C1CCN(C)CC1	ZINC000291707162	265794555	/nfs/dbraw/zinc/79/45/55/265794555.db2.gz	UVLCQWHEYBJUTB-UHFFFAOYSA-N	0	3	335.398	3.029	20	30		EGEDHN
CC(C)CN(CCN(C)C)C(=O)Nc1ccc(OC(C)C)c(C#N)c1	ZINC000157767859	265796746	/nfs/dbraw/zinc/79/67/46/265796746.db2.gz	IFRPSISMTZTLHS-UHFFFAOYSA-N	0	3	346.475	3.397	20	30		EGEDHN
COc1ccc([C@@H](CN2CCCC2)NC(=O)c2ccc(C#N)cc2)cc1	ZINC000271241689	266627518	/nfs/dbraw/zinc/62/75/18/266627518.db2.gz	BMQHQHQDQLSSLP-HXUWFJFHSA-N	0	3	349.434	3.134	20	30		EGEDHN
CC(C)(Cc1ccc(C#N)cc1)C(=O)N1CC[C@H](N2CCCCC2)C1	ZINC000455554857	266884203	/nfs/dbraw/zinc/88/42/03/266884203.db2.gz	OKNDQKZEZCXTDA-IBGZPJMESA-N	0	3	339.483	3.214	20	30		EGEDHN
COc1cccc([C@H](C)NC(=O)C(C#N)Cc2ccc(C#N)cc2)c1	ZINC000279748728	266892262	/nfs/dbraw/zinc/89/22/62/266892262.db2.gz	QBQXNHVZKIVGCC-KSSFIOAISA-N	0	3	333.391	3.127	20	30		EGEDHN
CCCCNC(=O)[C@H]1CC[C@H](C)N(Cc2ccc(C#N)c(OC)c2)C1	ZINC000442800406	267009314	/nfs/dbraw/zinc/00/93/14/267009314.db2.gz	JVLHUWQIOBISMO-YJBOKZPZSA-N	0	3	343.471	3.084	20	30		EGEDHN
C[C@H](CC(=O)c1ccccc1)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000350360666	267147244	/nfs/dbraw/zinc/14/72/44/267147244.db2.gz	BRLZMAYKAYNUTO-BEFAXECRSA-N	0	3	345.402	3.018	20	30		EGEDHN
C[C@H](NCC(=O)NCc1ccc(C#N)cc1)c1cccc(C2CC2)c1	ZINC000295296427	267181950	/nfs/dbraw/zinc/18/19/50/267181950.db2.gz	FASGUFXLWFYKQX-HNNXBMFYSA-N	0	3	333.435	3.403	20	30		EGEDHN
C[C@H]1[C@H](NC(=O)NCc2cccc(C#N)c2)CCN1Cc1ccccc1	ZINC000287142299	267252257	/nfs/dbraw/zinc/25/22/57/267252257.db2.gz	PVUHYYQCEIPGEW-OXJNMPFZSA-N	0	3	348.450	3.020	20	30		EGEDHN
C[C@](CO)(NCC(=O)Nc1ccc(C#N)c(Cl)c1)C1CCCCC1	ZINC000174792130	267255947	/nfs/dbraw/zinc/25/59/47/267255947.db2.gz	CCDPEFBITZBBLM-GOSISDBHSA-N	0	3	349.862	3.071	20	30		EGEDHN
CN(C)Cc1ccc(NC(=O)CCc2ccc(C#N)cc2)c(F)c1	ZINC000412557252	267283891	/nfs/dbraw/zinc/28/38/91/267283891.db2.gz	IHOQCJBXKXHKOE-UHFFFAOYSA-N	0	3	325.387	3.330	20	30		EGEDHN
Cc1c(C#N)cccc1NC(=O)N(CCN(C)C)Cc1ccccc1	ZINC000178563901	267285468	/nfs/dbraw/zinc/28/54/68/267285468.db2.gz	LYTOWLPJSQUGDC-UHFFFAOYSA-N	0	3	336.439	3.462	20	30		EGEDHN
Cc1c(C#N)cccc1NC(=O)NCCCN1CCc2ccccc2C1	ZINC000178547776	267286914	/nfs/dbraw/zinc/28/69/14/267286914.db2.gz	IMJSAGJAGXBQCV-UHFFFAOYSA-N	0	3	348.450	3.437	20	30		EGEDHN
CN(C)[C@H](CC(=O)NCc1cc(C#N)ccc1F)c1ccccc1	ZINC000416158604	267288287	/nfs/dbraw/zinc/28/82/87/267288287.db2.gz	TWQDDCGKMZMYDM-GOSISDBHSA-N	0	3	325.387	3.007	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCC(=O)NC23CCC3)c(OC(F)F)c1	ZINC000328720051	268075215	/nfs/dbraw/zinc/07/52/15/268075215.db2.gz	VWRHAMDLHMCCRM-CQSZACIVSA-N	0	3	335.354	3.291	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CC[C@@H](c3ccccc3)C2)cc1	ZINC000279421024	268089928	/nfs/dbraw/zinc/08/99/28/268089928.db2.gz	WXBOWNUENVBRSV-WOJBJXKFSA-N	0	3	329.403	3.257	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCN2CCC=C(c3cccnc3)C2)cc1	ZINC000289380270	268137927	/nfs/dbraw/zinc/13/79/27/268137927.db2.gz	PXVWHGFBVVMYGO-UHFFFAOYSA-N	0	3	332.407	3.071	20	30		EGEDHN
N#Cc1ccc(CNCc2ccc(CN3CCCC3=O)cc2)cc1F	ZINC000421323685	268233120	/nfs/dbraw/zinc/23/31/20/268233120.db2.gz	GTFJCIAZFHPSRL-UHFFFAOYSA-N	0	3	337.398	3.110	20	30		EGEDHN
N#Cc1ccc(CNC[C@@]2(O)CCC[C@H](C(F)(F)F)C2)c(F)c1	ZINC000436398780	268233368	/nfs/dbraw/zinc/23/33/68/268233368.db2.gz	BALJGQHSNDXNBM-DZGCQCFKSA-N	0	3	330.325	3.271	20	30		EGEDHN
N#Cc1ccc(CNC[C@@]2(CO)C[C@@H]2c2ccc(F)cc2)cc1F	ZINC000421391176	268233569	/nfs/dbraw/zinc/23/35/69/268233569.db2.gz	NBTBQRQLINRZJX-IEBWSBKVSA-N	0	3	328.362	3.092	20	30		EGEDHN
CS[C@H]1CN(c2ccc(C#N)c(C(F)(F)F)c2)C[C@@H]1N(C)C	ZINC000340740913	274186419	/nfs/dbraw/zinc/18/64/19/274186419.db2.gz	IOUHHUREMPFTSX-KBPBESRZSA-N	0	3	329.391	3.059	20	30		EGEDHN
CN(C)C[C@H](NC(=O)Nc1ccc(F)cc1C#N)c1ccc(F)cc1	ZINC000338362522	276801448	/nfs/dbraw/zinc/80/14/48/276801448.db2.gz	YLJWOWMQPPIZTE-KRWDZBQOSA-N	0	3	344.365	3.261	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccccc1F	ZINC000065987108	307361017	/nfs/dbraw/zinc/36/10/17/307361017.db2.gz	CPJNOHZQDTZPES-UHFFFAOYSA-N	0	3	340.402	3.293	20	30		EGEDHN
CC[C@@H]1CCC[C@@H]1NC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000132122568	307654175	/nfs/dbraw/zinc/65/41/75/307654175.db2.gz	QXFPFOVMGVFAAI-MOPGFXCFSA-N	0	3	342.487	3.210	20	30		EGEDHN
CCC[C@H]1CCCC[C@@H]1NCCS(=O)(=O)c1ccc(C#N)cc1	ZINC000548487628	315016038	/nfs/dbraw/zinc/01/60/38/315016038.db2.gz	ADIGYPGBSYWGES-WMZOPIPTSA-N	0	3	334.485	3.280	20	30		EGEDHN
Cc1cc(C#N)cnc1C(=O)NC1CCN([C@H](C)c2ccccc2)CC1	ZINC000551210301	315145323	/nfs/dbraw/zinc/14/53/23/315145323.db2.gz	CGYOIFVTSIDDCP-MRXNPFEDSA-N	0	3	348.450	3.217	20	30		EGEDHN
Cc1cccc([C@H]2CCCN2CCC(=O)Nc2cccc(C#N)c2)n1	ZINC000564271078	316130020	/nfs/dbraw/zinc/13/00/20/316130020.db2.gz	UYQRQCBWXNBMSX-LJQANCHMSA-N	0	3	334.423	3.427	20	30		EGEDHN
CC(C)c1ccccc1OC[C@H](O)CNCc1ccc(C#N)s1	ZINC000564855895	316218898	/nfs/dbraw/zinc/21/88/98/316218898.db2.gz	FSBSVAIEJDSVOD-CQSZACIVSA-N	0	3	330.453	3.273	20	30		EGEDHN
CN1CCC[C@H](NCCC(=O)Nc2cccc(C#N)c2)c2ccccc21	ZINC000569436740	316914619	/nfs/dbraw/zinc/91/46/19/316914619.db2.gz	MUXVTXIWYLBVEW-IBGZPJMESA-N	0	3	348.450	3.448	20	30		EGEDHN
C[C@@H](O)CN(Cc1ccc(C#N)cn1)[C@H](C)Cc1ccc(Cl)cc1	ZINC000570104131	317008104	/nfs/dbraw/zinc/00/81/04/317008104.db2.gz	GFMSIGKPFWEMEM-HUUCEWRRSA-N	0	3	343.858	3.421	20	30		EGEDHN
N#Cc1ccc(CNCCCC(=O)N2CCc3ccccc32)s1	ZINC000176968381	323334987	/nfs/dbraw/zinc/33/49/87/323334987.db2.gz	PYKMCMQQJYWZQQ-UHFFFAOYSA-N	0	3	325.437	3.079	20	30		EGEDHN
CCS[C@@H]1CCCC[C@@H]1N[C@@H](C)C(=O)N[C@@](C)(C#N)C(C)C	ZINC000346601720	457070349	/nfs/dbraw/zinc/07/03/49/457070349.db2.gz	HNXSBLRMVFVCJA-MPTYRVRUSA-N	0	3	325.522	3.083	20	30		EGEDHN
N#CCCCOc1cccc(CNCc2cccnc2-n2cccn2)c1	ZINC000237823712	455223527	/nfs/dbraw/zinc/22/35/27/455223527.db2.gz	QHFZHJFCMYUIMB-UHFFFAOYSA-N	0	3	347.422	3.240	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C(C)(C)c2ccccc2OC)CC1	ZINC000264514211	455227419	/nfs/dbraw/zinc/22/74/19/455227419.db2.gz	UWBQSBVPRVYYRZ-UHFFFAOYSA-N	0	3	330.472	3.130	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H]2CCC[C@@H]2c2ccccc2)CC1	ZINC000264733404	455272400	/nfs/dbraw/zinc/27/24/00/455272400.db2.gz	HGEKDXZHGDULOC-RTBURBONSA-N	0	3	327.472	3.272	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC[C@]2(C)CCCc3ccccc32)CC1	ZINC000180983146	455272954	/nfs/dbraw/zinc/27/29/54/455272954.db2.gz	YKEQWGSBLOQUHI-NRFANRHFSA-N	0	3	341.499	3.230	20	30		EGEDHN
CSc1cc(C)ccc1CNC[C@H](O)COc1ccccc1C#N	ZINC000600728793	460582104	/nfs/dbraw/zinc/58/21/04/460582104.db2.gz	BQFKWVUPKUUSFY-KRWDZBQOSA-N	0	3	342.464	3.118	20	30		EGEDHN
CC(F)(F)c1ccc(CNC[C@H](O)COc2ccccc2C#N)cc1	ZINC000600738022	460585881	/nfs/dbraw/zinc/58/58/81/460585881.db2.gz	GUONRXASDGVPDO-KRWDZBQOSA-N	0	3	346.377	3.199	20	30		EGEDHN
C=CCNC(=O)[C@H](C)N[C@H](C)[C@@H](C)c1ccccc1C(F)(F)F	ZINC000159110490	455353029	/nfs/dbraw/zinc/35/30/29/455353029.db2.gz	WGDODHQVFIVZQT-UPJWGTAASA-N	0	3	328.378	3.478	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](CN(C)Cc3scnc3C)C2)CCC1	ZINC000190640925	455357784	/nfs/dbraw/zinc/35/77/84/455357784.db2.gz	NXPCZDZGTGCLHM-INIZCTEOSA-N	0	3	347.528	3.478	20	30		EGEDHN
Cc1cccc([C@@H](CNCc2cccc(C#N)c2)N2CCOCC2)c1	ZINC000030915605	453841832	/nfs/dbraw/zinc/84/18/32/453841832.db2.gz	FGIOYTKADGINMG-OAQYLSRUSA-N	0	3	335.451	3.030	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)CN(Cc1ccccc1)[C@@H](C)C1CC1	ZINC000052795412	453844933	/nfs/dbraw/zinc/84/49/33/453844933.db2.gz	DLMHUGRNBRPALI-OXJNMPFZSA-N	0	3	327.472	3.342	20	30		EGEDHN
C[C@@H](CN(C)[C@@H](C)C(=O)NC1(C#N)CCCCC1)c1ccccc1	ZINC000066853977	453881336	/nfs/dbraw/zinc/88/13/36/453881336.db2.gz	USGFCVCMJBTRGO-IRXDYDNUSA-N	0	3	327.472	3.453	20	30		EGEDHN
C[C@@H](CC#N)Sc1ccccc1NC(=O)NC1CCN(C)CC1	ZINC000066955824	453890238	/nfs/dbraw/zinc/89/02/38/453890238.db2.gz	MDCZEVJGYUPXRA-ZDUSSCGKSA-N	0	3	332.473	3.297	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H](c2ccc(F)cc2)C(C)(C)C)CC1	ZINC000067166540	453908407	/nfs/dbraw/zinc/90/84/07/453908407.db2.gz	QEFCQLNSSIGGCP-GOSISDBHSA-N	0	3	330.447	3.374	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2cccc(CC#N)c2)C1	ZINC000054223006	453916695	/nfs/dbraw/zinc/91/66/95/453916695.db2.gz	YNXDGMHAYZHPGI-UZLBHIALSA-N	0	3	333.435	3.318	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(F)c(C(F)(F)F)c2)CC1	ZINC000067332012	453922588	/nfs/dbraw/zinc/92/25/88/453922588.db2.gz	YPXYUOGJMOVMPT-UHFFFAOYSA-N	0	3	328.309	3.128	20	30		EGEDHN
N#Cc1ccccc1NC(=O)CCN1CC=C(c2ccc(O)cc2)CC1	ZINC000054429209	453930358	/nfs/dbraw/zinc/93/03/58/453930358.db2.gz	PDLCWBRRRSTHHI-UHFFFAOYSA-N	0	3	347.418	3.382	20	30		EGEDHN
CC(C)Oc1ccc(C#N)cc1NC(=O)NC1CCN(C2CC2)CC1	ZINC000054537515	453934245	/nfs/dbraw/zinc/93/42/45/453934245.db2.gz	KFYHVVBINRFMAK-UHFFFAOYSA-N	0	3	342.443	3.094	20	30		EGEDHN
CC[C@H](Cc1ccc(C)cc1)N(C)CC(=O)N[C@@](C)(C#N)C(C)C	ZINC000075886099	453935346	/nfs/dbraw/zinc/93/53/46/453935346.db2.gz	OTTLRTVMQSWVLQ-QUCCMNQESA-N	0	3	329.488	3.302	20	30		EGEDHN
CN1CCC(N(Cc2ccccc2)C(=O)C#Cc2ccccc2)CC1	ZINC000084365265	453985603	/nfs/dbraw/zinc/98/56/03/453985603.db2.gz	MAVQAVBUMJBOTG-UHFFFAOYSA-N	0	3	332.447	3.161	20	30		EGEDHN
CN(Cc1cccc(Cl)c1)C[C@@H](O)COc1ccc(C#N)cc1	ZINC000068845425	454059914	/nfs/dbraw/zinc/05/99/14/454059914.db2.gz	OBYMEHYDDNGEIE-QGZVFWFLSA-N	0	3	330.815	3.083	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)Nc1ccc(N(C)C2CCN(C)CC2)cc1	ZINC000069357299	454097950	/nfs/dbraw/zinc/09/79/50/454097950.db2.gz	NGNRGIVPAHXJQG-MRXNPFEDSA-N	0	3	345.487	3.137	20	30		EGEDHN
N#CC1(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)CCCCC1	ZINC000057383325	454123826	/nfs/dbraw/zinc/12/38/26/454123826.db2.gz	JREAFFDDODORNZ-SFHVURJKSA-N	0	3	325.456	3.414	20	30		EGEDHN
CC(C)(C)CC(=O)N1CCC(NCc2ccc(C#N)cc2F)CC1	ZINC000089152208	454124732	/nfs/dbraw/zinc/12/47/32/454124732.db2.gz	ODYYDNWKQOCPNN-UHFFFAOYSA-N	0	3	331.435	3.214	20	30		EGEDHN
Cc1ccc(C#N)cc1NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000069614940	454124878	/nfs/dbraw/zinc/12/48/78/454124878.db2.gz	OSYKUJNUZBUFMF-SFHVURJKSA-N	0	3	334.423	3.263	20	30		EGEDHN
CC(C)(NC[C@H](O)COc1ccc(C#N)cc1)c1ccc(Cl)cc1	ZINC000057846675	454152153	/nfs/dbraw/zinc/15/21/53/454152153.db2.gz	OYRHPZDRMVESGQ-KRWDZBQOSA-N	0	3	344.842	3.476	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Nc1c(C)nn(CC)c1C)C(C)C	ZINC000089480270	454155031	/nfs/dbraw/zinc/15/50/31/454155031.db2.gz	FOSLJIXXIWSMPZ-KRWDZBQOSA-N	0	3	347.507	3.340	20	30		EGEDHN
COc1cc(F)cc(CNCc2ccc(N(C)CCC#N)cc2)c1	ZINC000093970523	454182289	/nfs/dbraw/zinc/18/22/89/454182289.db2.gz	ZTQKLLIWUWYDPB-UHFFFAOYSA-N	0	3	327.403	3.474	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)C(=O)N[C@@H]1C[C@@H](C)N(C2CC2)C1	ZINC000130563911	454206145	/nfs/dbraw/zinc/20/61/45/454206145.db2.gz	ZEDPBLZKUDJYOA-NVXWUHKLSA-N	0	3	343.471	3.018	20	30		EGEDHN
Cc1n[nH]c(C)c1[C@@H]1CCCN1CCC(=O)Nc1ccc(C#N)cc1	ZINC000130663148	454211891	/nfs/dbraw/zinc/21/18/91/454211891.db2.gz	DFVJOMYVRXOZMW-KRWDZBQOSA-N	0	3	337.427	3.064	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN2CCC[C@@H]2c2ccsc2)cc1	ZINC000071850382	454231469	/nfs/dbraw/zinc/23/14/69/454231469.db2.gz	IIFXTTHDPMJCMI-SJLPKXTDSA-N	0	3	328.437	3.197	20	30		EGEDHN
CCc1ccc([C@@H](C)NC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000120230078	454274309	/nfs/dbraw/zinc/27/43/09/454274309.db2.gz	NTPUKCAYVDYHGL-OXQOHEQNSA-N	0	3	338.451	3.406	20	30		EGEDHN
C[C@@H](NCCOc1ccc(C#N)cc1)c1cccc(N2CCCC2=O)c1	ZINC000090107197	454279418	/nfs/dbraw/zinc/27/94/18/454279418.db2.gz	BQGLIIHBVUYJRI-MRXNPFEDSA-N	0	3	349.434	3.415	20	30		EGEDHN
CN(C)[C@@H](CNCc1ccc(N(C)CCC#N)cc1)c1ccco1	ZINC000072670311	454326045	/nfs/dbraw/zinc/32/60/45/454326045.db2.gz	CKIBAJCNPOBGJN-SFHVURJKSA-N	0	3	326.444	3.022	20	30		EGEDHN
C[C@@H](N[C@@H]1CC(C)(C)OC1(C)C)C(=O)N(CCC#N)c1ccccc1	ZINC000132491963	454343709	/nfs/dbraw/zinc/34/37/09/454343709.db2.gz	ZRSGEANPVOLRPU-NVXWUHKLSA-N	0	3	343.471	3.257	20	30		EGEDHN
C[C@@H](O)[C@@H](C)SCC(=O)C(C#N)c1nc(-c2ccccc2)cs1	ZINC000079064856	454362494	/nfs/dbraw/zinc/36/24/94/454362494.db2.gz	CBPPLTXCWJGWJC-YRGRVCCFSA-N	0	3	346.477	3.489	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN2CCC(OC3CCCC3)CC2)c1	ZINC000121128080	454395477	/nfs/dbraw/zinc/39/54/77/454395477.db2.gz	TZWPHAFRFDQRBF-UHFFFAOYSA-N	0	3	341.455	3.310	20	30		EGEDHN
C#CCCOc1ccc(CN(C)Cc2ccc(C(=O)NC)cc2)cc1	ZINC000121167165	454401168	/nfs/dbraw/zinc/40/11/68/454401168.db2.gz	XGBFZNVBIXAOGP-UHFFFAOYSA-N	0	3	336.435	3.080	20	30		EGEDHN
CC(C)C[C@@H](C)NC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000133612747	454445561	/nfs/dbraw/zinc/44/55/61/454445561.db2.gz	GDVBYMIRNRATEB-MRXNPFEDSA-N	0	3	330.476	3.066	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)[C@@H]2C[C@H]2c2cccc(C)c2)c1	ZINC000100684170	454466916	/nfs/dbraw/zinc/46/69/16/454466916.db2.gz	IFSXFELKEARCCO-IPMKNSEASA-N	0	3	348.402	3.455	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@H](C)N1CCC(c2ccc(O)cc2)CC1	ZINC000073713591	454470415	/nfs/dbraw/zinc/47/04/15/454470415.db2.gz	WDZNETGAVJYQIC-INIZCTEOSA-N	0	3	330.472	3.385	20	30		EGEDHN
Cc1noc([C@H]2CCCN(Cc3cccc(OCCCC#N)c3)C2)n1	ZINC000091832551	454478541	/nfs/dbraw/zinc/47/85/41/454478541.db2.gz	HHALAPIWOYJYMM-KRWDZBQOSA-N	0	3	340.427	3.440	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN(CCC)[C@@H]1CCc2ccccc2C1	ZINC000064632627	454495592	/nfs/dbraw/zinc/49/55/92/454495592.db2.gz	XWZHLHMLFJGEDS-HXUWFJFHSA-N	0	3	326.484	3.457	20	30		EGEDHN
C#CCCCCNC(=O)NCC1CCN(Cc2cccs2)CC1	ZINC000122520479	454542301	/nfs/dbraw/zinc/54/23/01/454542301.db2.gz	BFWGXJRAEOVGQQ-UHFFFAOYSA-N	0	3	333.501	3.063	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(OC3CCCC3)cc2)CC1	ZINC000050028866	454569087	/nfs/dbraw/zinc/56/90/87/454569087.db2.gz	FLQXKLXRCJWOCW-UHFFFAOYSA-N	0	3	326.440	3.292	20	30		EGEDHN
CCOc1ccc(O)c(CN(CCOC)Cc2ccc(C#N)cc2)c1	ZINC000092567935	454587970	/nfs/dbraw/zinc/58/79/70/454587970.db2.gz	PITJUBMNWBBJGM-UHFFFAOYSA-N	0	3	340.423	3.311	20	30		EGEDHN
CCN(CCOc1cccc(C#N)c1)Cc1ccc(OC)c(OC)c1	ZINC000051377128	454621299	/nfs/dbraw/zinc/62/12/99/454621299.db2.gz	FTSZZSUFIKSDLT-UHFFFAOYSA-N	0	3	340.423	3.476	20	30		EGEDHN
COC(=O)CCN(Cc1ccccc1C(C)(C)C#N)C[C@H]1CCCO1	ZINC000135232234	454650145	/nfs/dbraw/zinc/65/01/45/454650145.db2.gz	JUGWXNDJHVQSLM-QGZVFWFLSA-N	0	3	344.455	3.032	20	30		EGEDHN
C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCCCN1CCCSCC#N	ZINC000074989993	454671397	/nfs/dbraw/zinc/67/13/97/454671397.db2.gz	RMIJXGGILBYUDF-CABCVRRESA-N	0	3	341.521	3.401	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2sccc2Br)CC1	ZINC000106036052	454675030	/nfs/dbraw/zinc/67/50/30/454675030.db2.gz	GSVWTRNODQFQSW-UHFFFAOYSA-N	0	3	343.290	3.281	20	30		EGEDHN
CN(CCN1CCN(CC(C)(C)CCC#N)CC1)Cc1ccccc1	ZINC000093105043	454683173	/nfs/dbraw/zinc/68/31/73/454683173.db2.gz	TTYYYUZQYAZDBM-UHFFFAOYSA-N	0	3	342.531	3.066	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(N(CC)CC)cc2)CC1	ZINC000106291178	454689896	/nfs/dbraw/zinc/68/98/96/454689896.db2.gz	BFZGNCXWCOKGOC-UHFFFAOYSA-N	0	3	329.488	3.303	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC[C@H](CC)Oc2cccc(C)c2)CC1	ZINC000176158663	454705457	/nfs/dbraw/zinc/70/54/57/454705457.db2.gz	HSSVNPXALGHFTP-SFHVURJKSA-N	0	3	345.487	3.102	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(Cl)ccc2OC(F)F)CC1	ZINC000176321792	454728584	/nfs/dbraw/zinc/72/85/84/454728584.db2.gz	DPFUKTHOTPYIEM-UHFFFAOYSA-N	0	3	344.789	3.322	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](c2nc(C)cs2)C2CC2)CC1	ZINC000176498218	454752640	/nfs/dbraw/zinc/75/26/40/454752640.db2.gz	AMUSPOYHOHOOOG-INIZCTEOSA-N	0	3	348.516	3.242	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2cccc(CC#N)c2)CN1Cc1ccccc1	ZINC000176802638	454785134	/nfs/dbraw/zinc/78/51/34/454785134.db2.gz	FHWZVIGJSVUPEH-UZLBHIALSA-N	0	3	333.435	3.145	20	30		EGEDHN
C[C@@H]1CN(C[C@@H]2CCCN2CC#Cc2ccc(Cl)cc2)C[C@@H](C)O1	ZINC000177046761	454816270	/nfs/dbraw/zinc/81/62/70/454816270.db2.gz	HVEZUBNFGUHDLB-HLIPFELVSA-N	0	3	346.902	3.265	20	30		EGEDHN
CC(C)(C#N)CCCN1CCCN(C(=O)CCc2ccccc2)CC1	ZINC000177288499	454847027	/nfs/dbraw/zinc/84/70/27/454847027.db2.gz	NKBWQQCNDFNYCO-UHFFFAOYSA-N	0	3	341.499	3.483	20	30		EGEDHN
C=CC1CCN(C(=O)NC2CCN(Cc3ccccc3)CC2)CC1	ZINC000111419283	454863673	/nfs/dbraw/zinc/86/36/73/454863673.db2.gz	XTIOJRVTLCMCAP-UHFFFAOYSA-N	0	3	327.472	3.259	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CNCCN2CCc3sccc3C2)cc1	ZINC000112372603	454885662	/nfs/dbraw/zinc/88/56/62/454885662.db2.gz	OWIFKTYARKIRFS-HNNXBMFYSA-N	0	3	341.480	3.187	20	30		EGEDHN
C[C@@H](N[C@H](C)c1ccc(C(F)(F)F)cc1)C(=O)N(C)CCC#N	ZINC000112523201	454889100	/nfs/dbraw/zinc/88/91/00/454889100.db2.gz	JBAVKFMAXCHWJX-VXGBXAGGSA-N	0	3	327.350	3.117	20	30		EGEDHN
CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000177704071	454894329	/nfs/dbraw/zinc/89/43/29/454894329.db2.gz	YSCIVEHPEBAMDC-CABCVRRESA-N	0	3	332.835	3.302	20	30		EGEDHN
C[C@@H](CNc1ccc([N+](=O)[O-])c(C#N)c1)N1CCc2ccccc2C1	ZINC000165571495	454901779	/nfs/dbraw/zinc/90/17/79/454901779.db2.gz	UDUNWHLTMDALJS-AWEZNQCLSA-N	0	3	336.395	3.325	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN(C)CCOCc1ccccc1	ZINC000154551492	454906936	/nfs/dbraw/zinc/90/69/36/454906936.db2.gz	CZQQCINODPNDSK-UHFFFAOYSA-N	0	3	340.423	3.094	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@H](c1cccc(OC)c1)N1CCCC1	ZINC000185036132	455489881	/nfs/dbraw/zinc/48/98/81/455489881.db2.gz	XFIFZADRYRGJPV-IBGZPJMESA-N	0	3	328.456	3.142	20	30		EGEDHN
N#Cc1ccccc1CSCCNCc1ccc([N+](=O)[O-])cc1	ZINC000170670628	454952298	/nfs/dbraw/zinc/95/22/98/454952298.db2.gz	JCPAENMMJWIXKP-UHFFFAOYSA-N	0	3	327.409	3.489	20	30		EGEDHN
N#CC1(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)CCC1	ZINC000155403438	454997832	/nfs/dbraw/zinc/99/78/32/454997832.db2.gz	AWKKCGCAFSIUFD-UHFFFAOYSA-N	0	3	327.428	3.184	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)Cc2cccc(OC(C)C)c2)CC1	ZINC000179138799	455012570	/nfs/dbraw/zinc/01/25/70/455012570.db2.gz	OKORBOOCHFTJET-UHFFFAOYSA-N	0	3	345.487	3.266	20	30		EGEDHN
COc1ccc(CN2CCC[C@@H](C(=O)Nc3ccccc3)C2)cc1C#N	ZINC000179189384	455018206	/nfs/dbraw/zinc/01/82/06/455018206.db2.gz	BDXISWQLKLRKAT-QGZVFWFLSA-N	0	3	349.434	3.418	20	30		EGEDHN
C[C@@H](c1ccncc1)N1CCC(NC(=O)C2(C#N)CCCCC2)CC1	ZINC000155663183	455028613	/nfs/dbraw/zinc/02/86/13/455028613.db2.gz	HECMHHMEWJCEDX-INIZCTEOSA-N	0	3	340.471	3.197	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cnc3ccc(F)cc3c2)CC1	ZINC000179344700	455035786	/nfs/dbraw/zinc/03/57/86/455035786.db2.gz	IZCJUJIVSYNTPD-UHFFFAOYSA-N	0	3	327.403	3.144	20	30		EGEDHN
COc1cc(O)c(CN(Cc2ccc(C#N)cc2)C2CC2)cc1OC	ZINC000179441302	455048682	/nfs/dbraw/zinc/04/86/82/455048682.db2.gz	OVPDBKBUKUVXFY-UHFFFAOYSA-N	0	3	338.407	3.446	20	30		EGEDHN
N#CC(C(=O)c1cccc(C(F)F)c1)c1nnc2n1CCCCC2	ZINC000171567545	455078135	/nfs/dbraw/zinc/07/81/35/455078135.db2.gz	GYQZEZYLIHKYRN-ZDUSSCGKSA-N	0	3	330.338	3.432	20	30		EGEDHN
C=CCN1CCC(NC(=O)Cc2ccc(C(F)(F)F)cc2)CC1	ZINC000171722209	455089627	/nfs/dbraw/zinc/08/96/27/455089627.db2.gz	XIUSNJURHRBZGL-UHFFFAOYSA-N	0	3	326.362	3.015	20	30		EGEDHN
C#CCCCCC(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000179881536	455093500	/nfs/dbraw/zinc/09/35/00/455093500.db2.gz	SQHCDXUYSJOVPC-UHFFFAOYSA-N	0	3	342.483	3.217	20	30		EGEDHN
N#Cc1ccccc1N1CCC[N@@H+](Cc2cc(F)ccc2[O-])CC1	ZINC000179940090	455102338	/nfs/dbraw/zinc/10/23/38/455102338.db2.gz	PXJJALVLOJHSSQ-UHFFFAOYSA-N	0	3	325.387	3.115	20	30		EGEDHN
N#Cc1ccccc1N1CCC[N@H+](Cc2cc(F)ccc2[O-])CC1	ZINC000179940090	455102341	/nfs/dbraw/zinc/10/23/41/455102341.db2.gz	PXJJALVLOJHSSQ-UHFFFAOYSA-N	0	3	325.387	3.115	20	30		EGEDHN
C[C@H]1C[C@@H]1[C@H](NCC(=O)N[C@@](C)(C#N)C1CC1)c1ccc(Cl)cc1	ZINC000180025240	455118445	/nfs/dbraw/zinc/11/84/45/455118445.db2.gz	JZURBRWCTHFZNH-MNXTYGCHSA-N	0	3	345.874	3.435	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(CCc2cccc(F)c2)C2CC2)CC1	ZINC000172227265	455136667	/nfs/dbraw/zinc/13/66/67/455136667.db2.gz	XNDFKGRBCZLGNZ-UHFFFAOYSA-N	0	3	345.462	3.193	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccc(CC#N)cc1	ZINC000182842224	455176489	/nfs/dbraw/zinc/17/64/89/455176489.db2.gz	LJMFAHSSNOBHTC-INIZCTEOSA-N	0	3	336.439	3.395	20	30		EGEDHN
COc1cccc2c1OC[C@@H](NCc1ccc(O[C@@H](C)C#N)cc1)C2	ZINC000237364341	455178445	/nfs/dbraw/zinc/17/84/45/455178445.db2.gz	VAULZXJJZCUXGM-YOEHRIQHSA-N	0	3	338.407	3.079	20	30		EGEDHN
CCN(CC(C)(C)O)[C@H](C)C(=O)N(CCC#N)c1cc(C)cc(C)c1	ZINC000158181801	455277895	/nfs/dbraw/zinc/27/78/95/455277895.db2.gz	ZZUSLMVFQSIVOS-QGZVFWFLSA-N	0	3	345.487	3.031	20	30		EGEDHN
N#Cc1cccc(OC2CCN(C[C@@H](O)CC3CCCC3)CC2)c1	ZINC000190517615	455336736	/nfs/dbraw/zinc/33/67/36/455336736.db2.gz	GIGXFHLSMMDHKQ-SFHVURJKSA-N	0	3	328.456	3.343	20	30		EGEDHN
COc1ccc([C@H](C)N[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)cc1	ZINC000190606048	455352285	/nfs/dbraw/zinc/35/22/85/455352285.db2.gz	PAHFNPOCGIXNCI-MGPUTAFESA-N	0	3	349.434	3.019	20	30		EGEDHN
C#CCC(C)(C)C(=O)N[C@H]1CC2(CCN(C)CC2)Oc2ccccc21	ZINC000184352631	455372931	/nfs/dbraw/zinc/37/29/31/455372931.db2.gz	AKGRZLGYBOUTEE-KRWDZBQOSA-N	0	3	340.467	3.140	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN(C)[C@@H](C)CNC(=O)OC(C)(C)C)cc1	ZINC000245751228	455373145	/nfs/dbraw/zinc/37/31/45/455373145.db2.gz	NVMWOKUSFOTIJF-LSDHHAIUSA-N	0	3	347.459	3.322	20	30		EGEDHN
CC(C)(C#N)CCCN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000174841327	455416164	/nfs/dbraw/zinc/41/61/64/455416164.db2.gz	PBWYETSGDQVDMJ-MRXNPFEDSA-N	0	3	332.423	3.351	20	30		EGEDHN
N#CC(C(=O)c1ccc2c(c1)OCCCO2)c1cnc2ccccc2n1	ZINC000190985718	455419859	/nfs/dbraw/zinc/41/98/59/455419859.db2.gz	YSCOLRPNSVTIJB-CQSZACIVSA-N	0	3	345.358	3.281	20	30		EGEDHN
C=CCN(CCOC)CCC(=O)Nc1ccccc1C(F)(F)F	ZINC000191112443	455445799	/nfs/dbraw/zinc/44/57/99/455445799.db2.gz	QEQVMQDXFYHBLX-UHFFFAOYSA-N	0	3	330.350	3.168	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H](C(=C)C)c2ccc(F)c(F)c2)CC1	ZINC000184840878	455458170	/nfs/dbraw/zinc/45/81/70/455458170.db2.gz	QSLCMACPMBRQOP-GOSISDBHSA-N	0	3	332.394	3.043	20	30		EGEDHN
C=C(C)CN(CC)C(=O)Nc1cccc(N2CCN(CC)CC2)c1	ZINC000184885445	455467151	/nfs/dbraw/zinc/46/71/51/455467151.db2.gz	CDLYCMCMHMNNJL-UHFFFAOYSA-N	0	3	330.476	3.258	20	30		EGEDHN
CN(C)c1ccncc1CNCCSCc1ccccc1C#N	ZINC000185128577	455507066	/nfs/dbraw/zinc/50/70/66/455507066.db2.gz	FRVPEVGIMBGFKK-UHFFFAOYSA-N	0	3	326.469	3.042	20	30		EGEDHN
COc1ccccc1N(CCC#N)C(=O)[C@H](C)N[C@@H]1CCCC1(C)C	ZINC000191853950	455525887	/nfs/dbraw/zinc/52/58/87/455525887.db2.gz	OESFYHUOCQANMJ-MAUKXSAKSA-N	0	3	343.471	3.499	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN[C@@H]1CCO[C@H]1c1ccccc1	ZINC000191955284	455534362	/nfs/dbraw/zinc/53/43/62/455534362.db2.gz	RCVQVBURCJWDDK-WBVHZDCISA-N	0	3	341.436	3.068	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1C[C@@H](c2ccccc2C)C[C@@H]1C	ZINC000246932546	455536209	/nfs/dbraw/zinc/53/62/09/455536209.db2.gz	DRODYVIUKLUADB-NJAFHUGGSA-N	0	3	327.472	3.181	20	30		EGEDHN
C=CCN(Cc1ccccc1F)C(=O)N[C@@H]1CN(C2CC2)C[C@@H]1C	ZINC000268116762	455594277	/nfs/dbraw/zinc/59/42/77/455594277.db2.gz	DWYNJFAQBSCTQA-KBXCAEBGSA-N	0	3	331.435	3.006	20	30		EGEDHN
C=CCN(Cc1ccccc1F)C(=O)N[C@H]1CN(C2CC2)C[C@H]1C	ZINC000268116766	455594419	/nfs/dbraw/zinc/59/44/19/455594419.db2.gz	DWYNJFAQBSCTQA-KDOFPFPSSA-N	0	3	331.435	3.006	20	30		EGEDHN
CCc1cc[n+](C(C(=O)c2nccs2)C(=S)[N-]C2(C)CC2)cc1	ZINC000284039347	455626744	/nfs/dbraw/zinc/62/67/44/455626744.db2.gz	IWPWMCGLSGPSMJ-UHFFFAOYSA-O	0	3	346.501	3.074	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)[C@H]1CCCc2cccnc21)C(C)C	ZINC000192554805	455641812	/nfs/dbraw/zinc/64/18/12/455641812.db2.gz	FQPKLQZVFVRYFD-OALUTQOASA-N	0	3	341.499	3.316	20	30		EGEDHN
C=CCCOCCN[C@H](C)c1ccc(OC)c(Cn2cccn2)c1	ZINC000271534142	455674912	/nfs/dbraw/zinc/67/49/12/455674912.db2.gz	PZTMWBLMGDZWOL-MRXNPFEDSA-N	0	3	329.444	3.183	20	30		EGEDHN
N#Cc1ccnc(NC[C@H](c2cccs2)N2CCCC2)c1[N+](=O)[O-]	ZINC000268457029	455687973	/nfs/dbraw/zinc/68/79/73/455687973.db2.gz	GYFQXDCPQJJFLG-CYBMUJFWSA-N	0	3	343.412	3.172	20	30		EGEDHN
O=C1NC(CC(F)(F)F)C(=O)N1c1ccc(F)c(C(F)(F)F)c1	ZINC000277893522	455699582	/nfs/dbraw/zinc/69/95/82/455699582.db2.gz	BDTMVHZILYDCMV-MRVPVSSYSA-N	0	3	344.186	3.222	20	30		EGEDHN
C[C@@H]1CN(CC(=O)N(CCC#N)c2ccccc2)[C@H]2CCCC[C@@H]12	ZINC000248432230	455714434	/nfs/dbraw/zinc/71/44/34/455714434.db2.gz	QGNFIPSTDRKGFB-NEWSRXKRSA-N	0	3	325.456	3.444	20	30		EGEDHN
CCC[C@H](N[C@H]1CCC[C@@H](C#N)C1)C(=O)N1CCc2sccc2C1	ZINC000248745060	455728695	/nfs/dbraw/zinc/72/86/95/455728695.db2.gz	FKWLEUNNHXKCFP-PVAVHDDUSA-N	0	3	345.512	3.473	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCC(CN2CCCCC2=O)CC1	ZINC000186294934	455736340	/nfs/dbraw/zinc/73/63/40/455736340.db2.gz	ZPEPOJGWQKAQQB-UHFFFAOYSA-N	0	3	325.456	3.091	20	30		EGEDHN
N#C[C@H]1CCC[C@@H](N[C@@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)C1	ZINC000193059951	455740431	/nfs/dbraw/zinc/74/04/31/455740431.db2.gz	XNTFRIFVHFPBKE-HWWQOWPSSA-N	0	3	335.810	3.256	20	30		EGEDHN
C=C(C)Cn1c(C)nnc1N1CC[C@H](C)N(Cc2ccccc2)CC1	ZINC000292858204	455764217	/nfs/dbraw/zinc/76/42/17/455764217.db2.gz	GQTWXZSZYXMCJX-KRWDZBQOSA-N	0	3	339.487	3.263	20	30		EGEDHN
COc1cc(CNCCc2cc(C(F)(F)F)ccn2)ccc1C#N	ZINC000292952347	455768018	/nfs/dbraw/zinc/76/80/18/455768018.db2.gz	KSSDQOXNYBCINR-UHFFFAOYSA-N	0	3	335.329	3.313	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2nsc3ccc(C)cc32)CC1	ZINC000293002171	455770015	/nfs/dbraw/zinc/77/00/15/455770015.db2.gz	GEXLMFBAVUUQNJ-UHFFFAOYSA-N	0	3	329.469	3.375	20	30		EGEDHN
COc1cc(C)c([C@@H](C)NC[C@@H](O)c2ccc(C#N)cc2)cc1OC	ZINC000271817025	455772812	/nfs/dbraw/zinc/77/28/12/455772812.db2.gz	VDGYMPQPZHFIHV-RDTXWAMCSA-N	0	3	340.423	3.268	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)N[C@@H](CC)c1ccc(OC)c(OC)c1	ZINC000285036753	455780222	/nfs/dbraw/zinc/78/02/22/455780222.db2.gz	HZWGSBMNPBHRIJ-RDJZCZTQSA-N	0	3	346.471	3.334	20	30		EGEDHN
CC[C@@H](NCc1ccc(N2CCOCC2)nc1)c1ccc(C#N)cc1	ZINC000278199373	455784800	/nfs/dbraw/zinc/78/48/00/455784800.db2.gz	GDMLLYRFJNIMGG-LJQANCHMSA-N	0	3	336.439	3.031	20	30		EGEDHN
C#CC[C@@H](NCc1ccc(O[C@@H](C)C(=O)OC)cc1)c1ccccc1	ZINC000271867216	455793546	/nfs/dbraw/zinc/79/35/46/455793546.db2.gz	WQCXUHHHWZVABG-OXJNMPFZSA-N	0	3	337.419	3.481	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2ccc(Cl)cc2F)CC1	ZINC000186584676	455799173	/nfs/dbraw/zinc/79/91/73/455799173.db2.gz	VDRVLAWSYRCOKB-UHFFFAOYSA-N	0	3	339.842	3.319	20	30		EGEDHN
COc1ccc(OC)c([C@@H](O)CN[C@H](C)c2ccc(C#N)c(F)c2)c1	ZINC000271939610	455799661	/nfs/dbraw/zinc/79/96/61/455799661.db2.gz	OKWQQAPOJDRVNC-XIKOKIGWSA-N	0	3	344.386	3.099	20	30		EGEDHN
CCC(C)(C)[N-]C(=S)C(C(=O)c1nccs1)[n+]1ccccc1	ZINC000278280757	455805207	/nfs/dbraw/zinc/80/52/07/455805207.db2.gz	PVYRHUKILQXJSB-UHFFFAOYSA-O	0	3	334.490	3.148	20	30		EGEDHN
N#Cc1cc(Br)cnc1N1CCC[C@@H]1CN1CCCCC1	ZINC000294931319	455832314	/nfs/dbraw/zinc/83/23/14/455832314.db2.gz	JBNPBUHNJBQLGR-OAHLLOKOSA-N	0	3	349.276	3.170	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCCCCCc2ccc(F)cc2)CC1	ZINC000186768185	455835033	/nfs/dbraw/zinc/83/50/33/455835033.db2.gz	KKUFJIUXTMDJRW-UHFFFAOYSA-N	0	3	347.478	3.488	20	30		EGEDHN
C=CCOc1ccc(CN[C@H](COC)[C@H]2CCCO2)cc1Cl	ZINC000278706538	455845951	/nfs/dbraw/zinc/84/59/51/455845951.db2.gz	RJSAKFRGIBNXCY-NVXWUHKLSA-N	0	3	325.836	3.188	20	30		EGEDHN
CC(C)CCOCCNCc1cn(CCC#N)nc1-c1ccncc1	ZINC000278729098	455846202	/nfs/dbraw/zinc/84/62/02/455846202.db2.gz	UHRQAPLBJGACLO-UHFFFAOYSA-N	0	3	341.459	3.011	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccc(C(C)(C)C#N)cc2)CCN(C2CC2)C1	ZINC000295464526	455849694	/nfs/dbraw/zinc/84/96/94/455849694.db2.gz	XTTNDYYXEKFVBX-HNNXBMFYSA-N	0	3	325.456	3.044	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN(C)CC1(N(C)C)CCC1	ZINC000186966372	455857202	/nfs/dbraw/zinc/85/72/02/455857202.db2.gz	ALTZJRDJIPEQMG-UHFFFAOYSA-N	0	3	347.528	3.319	20	30		EGEDHN
CN(CCCN(C)Cc1ccc(OCC#N)cc1)Cc1ccco1	ZINC000285503210	455859138	/nfs/dbraw/zinc/85/91/38/455859138.db2.gz	CUQGBHQMYDOJRY-UHFFFAOYSA-N	0	3	327.428	3.136	20	30		EGEDHN
C#CCN(Cc1ccccc1)C[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000285510169	455860560	/nfs/dbraw/zinc/86/05/60/455860560.db2.gz	DICZPAQJJVHJGS-FQEVSTJZSA-N	0	3	332.447	3.284	20	30		EGEDHN
Cc1ccc(CN[C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)s1	ZINC000272175063	455867254	/nfs/dbraw/zinc/86/72/54/455867254.db2.gz	HBZMIOHRXPCNHR-QGZVFWFLSA-N	0	3	325.437	3.213	20	30		EGEDHN
C=CCN1CCC(NC(=O)/C=C\c2cccc(C(F)(F)F)c2)CC1	ZINC000255840285	455874423	/nfs/dbraw/zinc/87/44/23/455874423.db2.gz	FINIDXDYHBANAW-SREVYHEPSA-N	0	3	338.373	3.485	20	30		EGEDHN
C=CC[C@@H](C)N[C@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl	ZINC000280018555	455880666	/nfs/dbraw/zinc/88/06/66/455880666.db2.gz	HFOZZSSYMNPASY-RKDXNWHRSA-N	0	3	337.272	3.256	20	30		EGEDHN
C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000285656786	455890718	/nfs/dbraw/zinc/89/07/18/455890718.db2.gz	FAPPQISBODCULP-QAPCUYQASA-N	0	3	325.456	3.187	20	30		EGEDHN
C=CCCCCNC(=O)NCc1ccc(OC2CCN(C)CC2)cc1	ZINC000285655366	455891164	/nfs/dbraw/zinc/89/11/64/455891164.db2.gz	ZXLJSKAMWUNYKW-UHFFFAOYSA-N	0	3	345.487	3.315	20	30		EGEDHN
COCCOc1ccc(C(=O)C(C#N)c2ccccn2)c(Cl)c1	ZINC000187475397	455915322	/nfs/dbraw/zinc/91/53/22/455915322.db2.gz	RPDGJUXLQRRWCY-CQSZACIVSA-N	0	3	330.771	3.250	20	30		EGEDHN
Cc1ccccc1O[C@H](C)CNC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000280212207	455917896	/nfs/dbraw/zinc/91/78/96/455917896.db2.gz	AENLCMKDFVEROW-APWZRJJASA-N	0	3	347.418	3.133	20	30		EGEDHN
CC1(C)[C@H](NCC#Cc2ccc(OC(F)(F)F)cc2)[C@H]2CCO[C@@H]21	ZINC000296470492	455947138	/nfs/dbraw/zinc/94/71/38/455947138.db2.gz	XUJLEJIQOHNRCX-OAGGEKHMSA-N	0	3	339.357	3.340	20	30		EGEDHN
COc1ccc(CN2CCC[C@](C)(OC)C2)cc1OCCCC#N	ZINC000280531191	455991010	/nfs/dbraw/zinc/99/10/10/455991010.db2.gz	IKZHIBDJHUZDLH-IBGZPJMESA-N	0	3	332.444	3.379	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2c(CC)onc2-c2ccccc2)CC1	ZINC000280617349	456014504	/nfs/dbraw/zinc/01/45/04/456014504.db2.gz	VYBQNHLNXMVOMP-UHFFFAOYSA-N	0	3	339.439	3.284	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1CN[C@H](C(=O)N(CC)CC)c1ccccc1	ZINC000280715438	456037647	/nfs/dbraw/zinc/03/76/47/456037647.db2.gz	UKODVGIWKQBFJB-FHWLQOOXSA-N	0	3	330.472	3.167	20	30		EGEDHN
C=CCSCCNCc1cc(Br)c2c(c1)OCCO2	ZINC000222056144	456044895	/nfs/dbraw/zinc/04/48/95/456044895.db2.gz	ZXNWGEFCNIEQSC-UHFFFAOYSA-N	0	3	344.274	3.229	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)N(C)C1CCN(Cc2ccccc2)CC1	ZINC000280749518	456044924	/nfs/dbraw/zinc/04/49/24/456044924.db2.gz	XSQIBCXJRZQDTH-UHFFFAOYSA-N	0	3	337.423	3.196	20	30		EGEDHN
N#CCN1CCC(NCc2cccc(Br)c2Cl)CC1	ZINC000601106103	460711596	/nfs/dbraw/zinc/71/15/96/460711596.db2.gz	NAKWWTZSJHIRTF-UHFFFAOYSA-N	0	3	342.668	3.180	20	30		EGEDHN
CC[C@](C)(C#N)C(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000286702976	456051771	/nfs/dbraw/zinc/05/17/71/456051771.db2.gz	HVMJLGLYLAKHON-LJQANCHMSA-N	0	3	329.444	3.430	20	30		EGEDHN
COc1cc(C#N)ccc1CN1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O	ZINC000280897899	456076413	/nfs/dbraw/zinc/07/64/13/456076413.db2.gz	DQNCCIZPPXMCJL-OTWHNJEPSA-N	0	3	328.456	3.472	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N2CCC[C@@H](C)[C@H]2C)cc1	ZINC000287744406	456077206	/nfs/dbraw/zinc/07/72/06/456077206.db2.gz	UPEYPLGDWJTCRJ-HZSPNIEDSA-N	0	3	349.456	3.025	20	30		EGEDHN
C=C(C)CN(CC)C(=O)NCc1ccc(OC2CCN(C)CC2)cc1	ZINC000287747111	456078270	/nfs/dbraw/zinc/07/82/70/456078270.db2.gz	IFQDSACMSYVXLE-UHFFFAOYSA-N	0	3	345.487	3.267	20	30		EGEDHN
C=CCCCCCCNC(=O)C(=O)Nc1cc(CN(C)C)ccc1C	ZINC000287908011	456082086	/nfs/dbraw/zinc/08/20/86/456082086.db2.gz	BSAHANCIYSGFTN-UHFFFAOYSA-N	0	3	345.487	3.248	20	30		EGEDHN
C=CCOCCCC(=O)N1CC[C@]2(CCN(Cc3ccccc3)C2)C1	ZINC000288233320	456090578	/nfs/dbraw/zinc/09/05/78/456090578.db2.gz	FHPJRZAXMHXION-NRFANRHFSA-N	0	3	342.483	3.094	20	30		EGEDHN
C=C[C@@](C)(CCOC)c1nc(-c2ccccc2OCCN(C)C)no1	ZINC000289013514	456111875	/nfs/dbraw/zinc/11/18/75/456111875.db2.gz	KMDBOOQZJIRGSO-IBGZPJMESA-N	0	3	345.443	3.157	20	30		EGEDHN
CC(C)(C)OC(=O)N1C[C@@H]2CCN(Cc3cccc(C#N)c3)C[C@@H]2C1	ZINC000289509197	456128659	/nfs/dbraw/zinc/12/86/59/456128659.db2.gz	KQPDSCRWXILZIH-ZWKOTPCHSA-N	0	3	341.455	3.247	20	30		EGEDHN
O=C(Nc1cccc(C#Cc2ccccn2)c1)C12CCCN1CCC2	ZINC000289757519	456140798	/nfs/dbraw/zinc/14/07/98/456140798.db2.gz	KMOTUIGNDWADGL-UHFFFAOYSA-N	0	3	331.419	3.048	20	30		EGEDHN
CN(C)CCN(Cc1cnn(C(C)(C)C)c1)Cc1ccc(C#N)cc1	ZINC000289754020	456140815	/nfs/dbraw/zinc/14/08/15/456140815.db2.gz	JJGAUUKMZDEPRZ-UHFFFAOYSA-N	0	3	339.487	3.074	20	30		EGEDHN
CN(CCC(=O)Nc1ccccc1C#N)C[C@@H]1OCCc2ccccc21	ZINC000263695031	456194164	/nfs/dbraw/zinc/19/41/64/456194164.db2.gz	KMJOMBUKUPCJNV-FQEVSTJZSA-N	0	3	349.434	3.133	20	30		EGEDHN
C=CCC[C@H](C(=O)NC1CCN(CCCOC)CC1)c1ccccc1	ZINC000189009467	456198993	/nfs/dbraw/zinc/19/89/93/456198993.db2.gz	MQLNYEMXUXCJTA-FQEVSTJZSA-N	0	3	344.499	3.354	20	30		EGEDHN
Cc1ccc([C@H](C)[NH2+][C@H]2CCCN(c3ccc(C#N)cc3)C2=O)c([O-])c1	ZINC000273475500	456233643	/nfs/dbraw/zinc/23/36/43/456233643.db2.gz	SSWURHJMYXCYTA-KXBFYZLASA-N	0	3	349.434	3.419	20	30		EGEDHN
CN(C)CCOc1ccccc1-c1noc(C2(C#N)CCCC2)n1	ZINC000273799327	456244761	/nfs/dbraw/zinc/24/47/61/456244761.db2.gz	HLGKFFUANYRMJQ-UHFFFAOYSA-N	0	3	326.400	3.012	20	30		EGEDHN
C[C@H](CC#N)Sc1ccccc1NC(=O)CN[C@H](C)[C@H]1CCOC1	ZINC000274614496	456261668	/nfs/dbraw/zinc/26/16/68/456261668.db2.gz	PNXSBMVFNGMXFD-KFWWJZLASA-N	0	3	347.484	3.034	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N1CC[C@@H]2CCN(C)C[C@H]21)c1ccc(F)c(F)c1	ZINC000274846647	456265924	/nfs/dbraw/zinc/26/59/24/456265924.db2.gz	AAWCAXFLBHASHF-VHSSKADRSA-N	0	3	349.425	3.318	20	30		EGEDHN
COc1cc(CNC[C@H](c2ccc(F)cc2)N(C)C)ccc1C#N	ZINC000281642082	456280202	/nfs/dbraw/zinc/28/02/02/456280202.db2.gz	JANSSVCKYDUYKC-GOSISDBHSA-N	0	3	327.403	3.098	20	30		EGEDHN
C=CCCOCCCCC(=O)N1CCN(C2CCC(C)CC2)CC1	ZINC000342866189	456282795	/nfs/dbraw/zinc/28/27/95/456282795.db2.gz	IHPBADLNUKRVIL-UHFFFAOYSA-N	0	3	336.520	3.472	20	30		EGEDHN
C#CCCCCNC(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C	ZINC000297743649	456284221	/nfs/dbraw/zinc/28/42/21/456284221.db2.gz	BUGXSIQDWZZXEO-KRWDZBQOSA-N	0	3	333.501	3.114	20	30		EGEDHN
CN(C)[C@@H](CNc1ccnc(C#N)c1)c1cccc(C(F)(F)F)c1	ZINC000342887372	456295104	/nfs/dbraw/zinc/29/51/04/456295104.db2.gz	BDCFVFIVEURYIS-INIZCTEOSA-N	0	3	334.345	3.109	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000290356752	456304201	/nfs/dbraw/zinc/30/42/01/456304201.db2.gz	LCJSHSMIMQWPKD-GCJKJVERSA-N	0	3	346.474	3.237	20	30		EGEDHN
C[C@@H](CCc1ccc(I)cc1)NCCC#N	ZINC000336730351	456309084	/nfs/dbraw/zinc/30/90/84/456309084.db2.gz	DPDSZPQIWQFRPY-NSHDSACASA-N	0	3	328.197	3.116	20	30		EGEDHN
C[C@H](CC#N)Sc1ccccc1NC(=O)CN[C@@H]1CSC[C@H]1C	ZINC000352814290	456331633	/nfs/dbraw/zinc/33/16/33/456331633.db2.gz	FYHANKUZZGRCMY-UMVBOHGHSA-N	0	3	349.525	3.360	20	30		EGEDHN
C=CCNC(=O)[C@@H](C)N[C@H](Cc1ccccc1)c1ccc(OC)cc1	ZINC000290535743	456356235	/nfs/dbraw/zinc/35/62/35/456356235.db2.gz	LENHZLJDCCUALJ-OXQOHEQNSA-N	0	3	338.451	3.259	20	30		EGEDHN
CC(C#N)C(=O)N1CCN(c2ccc(C(F)(F)F)cc2Cl)CC1	ZINC000343042301	456368222	/nfs/dbraw/zinc/36/82/22/456368222.db2.gz	MBZUWGMZBNDMGD-SNVBAGLBSA-N	0	3	345.752	3.167	20	30		EGEDHN
C=C(C)CN(CCc1ccc2c(c1)OCCO2)Cc1ccc(CO)o1	ZINC000352899810	456399722	/nfs/dbraw/zinc/39/97/22/456399722.db2.gz	RUJKSXIFDMPMHJ-UHFFFAOYSA-N	0	3	343.423	3.164	20	30		EGEDHN
C=CCOCCCN1C[C@@H](O)C[C@H]1c1ccc(C(F)(F)F)cc1	ZINC000348047308	456444068	/nfs/dbraw/zinc/44/40/68/456444068.db2.gz	JWFOVHZVKWXAAN-HOTGVXAUSA-N	0	3	329.362	3.406	20	30		EGEDHN
C=CCOCCCN1CCCC[C@H]1CNC(=O)Nc1ccccc1	ZINC000348051073	456445907	/nfs/dbraw/zinc/44/59/07/456445907.db2.gz	QLFRBHCUAINFHL-SFHVURJKSA-N	0	3	331.460	3.255	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)[C@H]1CCCC(F)(F)C1	ZINC000282230902	456449956	/nfs/dbraw/zinc/44/99/56/456449956.db2.gz	RXSDENMODMUYBQ-KRWDZBQOSA-N	0	3	349.425	3.274	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1C[C@@H](F)CN1Cc1nccs1	ZINC000348080279	456461178	/nfs/dbraw/zinc/46/11/78/456461178.db2.gz	HWHMFKAUUFCKTD-SJORKVTESA-N	0	3	344.459	3.059	20	30		EGEDHN
C=CCc1cc(CNC[C@H](O)[C@@H](C)c2ccccc2)cc(OC)c1O	ZINC000657797020	462272679	/nfs/dbraw/zinc/27/26/79/462272679.db2.gz	YNXJDWILFVWZLP-KXBFYZLASA-N	0	3	341.451	3.384	20	30		EGEDHN
C[C@@H](C#N)CSc1ccccc1NC(=O)NCC1=CCN(C)CC1	ZINC000343322158	456530889	/nfs/dbraw/zinc/53/08/89/456530889.db2.gz	ZLKQGBQTWAUBHO-AWEZNQCLSA-N	0	3	344.484	3.322	20	30		EGEDHN
COc1cc(CN2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)ccc1C#N	ZINC000282518485	456539253	/nfs/dbraw/zinc/53/92/53/456539253.db2.gz	ZLITXYRXSZLPOF-PKOBYXMFSA-N	0	3	325.456	3.016	20	30		EGEDHN
C[C@H](NCCC(=O)Nc1ccc(C#N)cc1)c1ccc2n[nH]cc2c1	ZINC000353198541	456553860	/nfs/dbraw/zinc/55/38/60/456553860.db2.gz	ZMYLBNFOETVHHD-ZDUSSCGKSA-N	0	3	333.395	3.114	20	30		EGEDHN
C[C@H](O)[C@@](C)(CNCc1ccc(C#N)cc1F)Cc1ccccc1	ZINC000276699620	456555320	/nfs/dbraw/zinc/55/53/20/456555320.db2.gz	MWUDNGDPEROUTL-MGPUTAFESA-N	0	3	326.415	3.417	20	30		EGEDHN
C[C@@H](N[C@H]1CCN(C(=O)Cc2ccccc2)C1)c1cccc(C#N)c1	ZINC000340622026	456578417	/nfs/dbraw/zinc/57/84/17/456578417.db2.gz	UAHIOBSXZNPMGP-UZLBHIALSA-N	0	3	333.435	3.052	20	30		EGEDHN
C[C@@H](CN1C[C@H](C)C[C@H](C)C1)NC(=O)CSc1ccc(C#N)cc1	ZINC000343384705	456579491	/nfs/dbraw/zinc/57/94/91/456579491.db2.gz	ARSHERLBQJCADD-XHSDSOJGSA-N	0	3	345.512	3.133	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)CSCc1ccccn1)C(C)C	ZINC000299088645	456601800	/nfs/dbraw/zinc/60/18/00/456601800.db2.gz	GNXBROOCHLVDSX-SFHVURJKSA-N	0	3	347.528	3.130	20	30		EGEDHN
CC(=O)Nc1cccc(OCCN[C@H]2CCc3ccc(C#N)cc32)c1	ZINC000353272850	456601905	/nfs/dbraw/zinc/60/19/05/456601905.db2.gz	MBGUFRQTCVSCPJ-FQEVSTJZSA-N	0	3	335.407	3.173	20	30		EGEDHN
C[C@@H](NC(=O)N[C@@H](C)CN1CCC[C@@H](C)C1)c1ccc(C#N)cc1	ZINC000299155658	456622032	/nfs/dbraw/zinc/62/20/32/456622032.db2.gz	BZMOXYUCTLPWKW-OWCLPIDISA-N	0	3	328.460	3.039	20	30		EGEDHN
CS[C@@H](CNC(=O)C(C#N)Cc1ccc(C#N)cc1)C(C)(C)C	ZINC000348428136	456684274	/nfs/dbraw/zinc/68/42/74/456684274.db2.gz	ZYAAYPNTFMVCAO-HOTGVXAUSA-N	0	3	329.469	3.134	20	30		EGEDHN
CN(CCN1CCN(c2ccccc2)CC1)Cc1ccc(CC#N)cc1	ZINC000343530260	456687079	/nfs/dbraw/zinc/68/70/79/456687079.db2.gz	NDRYYNWEIBWEJB-UHFFFAOYSA-N	0	3	348.494	3.007	20	30		EGEDHN
C=CCN(CCOC(C)(C)C)[C@@H](C)c1cccc(-n2cnnn2)c1	ZINC000343571573	456714837	/nfs/dbraw/zinc/71/48/37/456714837.db2.gz	BKJHMXCRMBYMHQ-HNNXBMFYSA-N	0	3	329.448	3.026	20	30		EGEDHN
O=C(CN[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2)N[C@H]1CCOc2ccccc21	ZINC000328657593	456731006	/nfs/dbraw/zinc/73/10/06/456731006.db2.gz	PIYSSYURPXACJO-SAKMYQHLSA-N	0	3	342.439	3.014	20	30		EGEDHN
COc1ccc(CN[C@@H]2CCN(c3ccccc3F)C2)cc1C#N	ZINC000291722762	456734565	/nfs/dbraw/zinc/73/45/65/456734565.db2.gz	MUPRNULMGZVSIK-MRXNPFEDSA-N	0	3	325.387	3.074	20	30		EGEDHN
CCc1ccc(CNC(=O)CN[C@H]2CCC(=O)NC23CCC3)s1	ZINC000328699312	456739352	/nfs/dbraw/zinc/73/93/52/456739352.db2.gz	MFHKWXJKIYKQIO-AWEZNQCLSA-N	0	3	335.473	3.398	20	30		EGEDHN
CC(=O)N1CCC(C(=O)NCCN2CCC3(CCCCC3)CC2)CC1	ZINC000328717600	456743641	/nfs/dbraw/zinc/74/36/41/456743641.db2.gz	PLUOGRNPZBAECD-UHFFFAOYSA-N	0	3	349.519	3.248	20	30		EGEDHN
CCOC(=O)c1csc(C(C#N)C(=O)c2cccn2C(C)C)n1	ZINC000343913231	456781560	/nfs/dbraw/zinc/78/15/60/456781560.db2.gz	FRVOFEFNFVNCKU-NSHDSACASA-N	0	3	331.397	3.192	20	30		EGEDHN
COc1ccc([C@@H](CN(C)C)N[C@@H]2CCc3ccc(C#N)cc32)cc1	ZINC000353592661	456789883	/nfs/dbraw/zinc/78/98/83/456789883.db2.gz	AXJUWVPMBNQBGU-NHCUHLMSSA-N	0	3	335.451	3.447	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C(F)(F)F)c1)C(=O)CCCC#N	ZINC000291962061	456811770	/nfs/dbraw/zinc/81/17/70/456811770.db2.gz	RMOLDXZXPCRZQB-UHFFFAOYSA-N	0	3	341.377	3.289	20	30		EGEDHN
O=C(NCCOc1cncc(Cl)c1)[C@H]1CCCN1C1CCCC1	ZINC000329035337	456820023	/nfs/dbraw/zinc/82/00/23/456820023.db2.gz	CCGBYMQKOOBLDI-MRXNPFEDSA-N	0	3	337.851	3.477	20	30		EGEDHN
Cc1ccc([C@H](C)[C@H](O)C(=O)N[C@H]2CCN(C3CCCC3)C2)cc1	ZINC000329047087	456821015	/nfs/dbraw/zinc/82/10/15/456821015.db2.gz	VHHMTTNSPFZLES-IEZWGBDMSA-N	0	3	330.472	3.433	20	30		EGEDHN
C=CCSCCNC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1	ZINC000338466510	456830076	/nfs/dbraw/zinc/83/00/76/456830076.db2.gz	SZIBXMXVSJRRDH-RDJZCZTQSA-N	0	3	333.501	3.040	20	30		EGEDHN
C[C@H](c1ccccc1)[C@H](NCc1ccccc1C(C)(C)C#N)C(N)=O	ZINC000292075805	456847861	/nfs/dbraw/zinc/84/78/61/456847861.db2.gz	DBPVJYBSOUUVHJ-BEFAXECRSA-N	0	3	335.451	3.235	20	30		EGEDHN
C=CC[C@H](CO)CNCc1c(C)nn(-c2ccc(Cl)cc2)c1C	ZINC000341326872	456848918	/nfs/dbraw/zinc/84/89/18/456848918.db2.gz	YKGZKCDEUAYNTD-HNNXBMFYSA-N	0	3	333.863	3.417	20	30		EGEDHN
C[C@H](C(=O)NC1(C#N)CCCCC1)N1CC[C@@H](N2CCCCC2)C1	ZINC000329265824	456863993	/nfs/dbraw/zinc/86/39/93/456863993.db2.gz	FWCGILFDBFVNIQ-IAGOWNOFSA-N	0	3	332.492	3.118	20	30		EGEDHN
C=CCOc1cccc(NC(=O)N2CC[C@H](N3CCCCC3)C2)c1	ZINC000341473088	456867642	/nfs/dbraw/zinc/86/76/42/456867642.db2.gz	YSZNORQGTPBEQX-KRWDZBQOSA-N	0	3	329.444	3.344	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H](c2cccc(Cl)c2)N(C)C)CC1	ZINC000348817053	456869411	/nfs/dbraw/zinc/86/94/11/456869411.db2.gz	KBDMMGURWVKBKH-GOSISDBHSA-N	0	3	349.906	3.099	20	30		EGEDHN
CC(C)(C)CCN1CCN(C(=O)Nc2cccc3c2OCO3)CC1	ZINC000329311566	456870831	/nfs/dbraw/zinc/87/08/31/456870831.db2.gz	CQMAFCIQGSQFJV-UHFFFAOYSA-N	0	3	333.432	3.015	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2sc([C@@H]3CCCO3)nc2C)CC1	ZINC000341586799	456878608	/nfs/dbraw/zinc/87/86/08/456878608.db2.gz	CPTWMIHUUCNBOK-HNNXBMFYSA-N	0	3	349.500	3.073	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)c2ccc(F)c(C#N)c2)CN1Cc1ccccc1	ZINC000353766335	456897898	/nfs/dbraw/zinc/89/78/98/456897898.db2.gz	GPIYRUNIYJOZDC-KBXCAEBGSA-N	0	3	337.398	3.090	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cnn(C3CCCC3)c2CCC)CC1	ZINC000345016720	456898131	/nfs/dbraw/zinc/89/81/31/456898131.db2.gz	ITTGREDHOGDSOI-UHFFFAOYSA-N	0	3	344.503	3.331	20	30		EGEDHN
C[C@@H]1Oc2ccccc2OC1C(=O)Nc1cc(C#N)c2ccccc2n1	ZINC000345015091	456898329	/nfs/dbraw/zinc/89/83/29/456898329.db2.gz	HAZLREJMLRHSNT-HXPMCKFVSA-N	0	3	345.358	3.273	20	30		EGEDHN
N#Cc1ccnc(NCCCN2CCc3ccccc3C2)c1Cl	ZINC000341746134	456925433	/nfs/dbraw/zinc/92/54/33/456925433.db2.gz	XQAKNVFSHCZBHC-UHFFFAOYSA-N	0	3	326.831	3.467	20	30		EGEDHN
CCc1nccn1[C@@H]1CCCN(C([O-])=[NH+]CC[C@@H]2CCO[C@H](C)C2)C1	ZINC000329754357	456935653	/nfs/dbraw/zinc/93/56/53/456935653.db2.gz	KSMZPZFRNUKWQB-BRWVUGGUSA-N	0	3	348.491	3.202	20	30		EGEDHN
C=CCOc1cccc(CN(CCN(C)C)Cc2ccccn2)c1	ZINC000349325491	456943388	/nfs/dbraw/zinc/94/33/88/456943388.db2.gz	CSBNDDLQKIBKBI-UHFFFAOYSA-N	0	3	325.456	3.210	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2NCc1cnn(CC(F)(F)F)c1	ZINC000341845214	456968770	/nfs/dbraw/zinc/96/87/70/456968770.db2.gz	YYZPKDOWKFWGPJ-MRXNPFEDSA-N	0	3	334.345	3.484	20	30		EGEDHN
CC(C#N)C(=O)NCC1(c2ccc(Cl)cc2Cl)CCOCC1	ZINC000345755014	456991541	/nfs/dbraw/zinc/99/15/41/456991541.db2.gz	FCUCGPHMFRCOLZ-LLVKDONJSA-N	0	3	341.238	3.317	20	30		EGEDHN
C=C(C)COc1cc(CN[C@@H](CC)[C@@H](O)C(F)(F)F)ccc1OC	ZINC000345859336	457002392	/nfs/dbraw/zinc/00/23/92/457002392.db2.gz	SGUAHLLOLBPUQZ-XJKSGUPXSA-N	0	3	347.377	3.442	20	30		EGEDHN
O=C(CC1(N2CCOCC2)CCCC1)N[C@@H]1CCOC2(CCC2)C1	ZINC000330229728	457007286	/nfs/dbraw/zinc/00/72/86/457007286.db2.gz	QFQAJIIYIYTHKC-MRXNPFEDSA-N	0	3	336.476	3.080	20	30		EGEDHN
N#CC(C(=O)c1cncc(F)c1)c1nc2ccccc2n1C(F)F	ZINC000346185600	457023105	/nfs/dbraw/zinc/02/31/05/457023105.db2.gz	HWBUGZUGZZAHGD-LLVKDONJSA-N	0	3	330.269	3.456	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN1C[C@@H](C)N(CC)C[C@@H]1C	ZINC000346220224	457024708	/nfs/dbraw/zinc/02/47/08/457024708.db2.gz	WGVOERXGGDQHOX-CVEARBPZSA-N	0	3	347.528	3.318	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1)OCC	ZINC000339378648	457078084	/nfs/dbraw/zinc/07/80/84/457078084.db2.gz	OBKRYBWQIKHXPT-AZUAARDMSA-N	0	3	344.499	3.481	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)[C@@H](C)N1C[C@@H](c2ccccc2)C[C@H]1C	ZINC000330793961	457087060	/nfs/dbraw/zinc/08/70/60/457087060.db2.gz	CZSDEQBTRJTRQM-HBXLWWENSA-N	0	3	327.472	3.307	20	30		EGEDHN
C=CCOc1cccnc1C(=O)NC[C@@H](N[C@H](C)CC)c1ccco1	ZINC000359569473	457097253	/nfs/dbraw/zinc/09/72/53/457097253.db2.gz	YSDBLWIXXFWWCT-HUUCEWRRSA-N	0	3	343.427	3.099	20	30		EGEDHN
COc1cc([N+](=O)[O-])ccc1C(=O)NCC(C)(C)N1CCC[C@H](C)C1	ZINC000331178120	457142670	/nfs/dbraw/zinc/14/26/70/457142670.db2.gz	XXJRLLRQXOHVRI-ZDUSSCGKSA-N	0	3	349.431	3.419	20	30		EGEDHN
C[C@H]1CCCN(C(C)(C)CNC(=O)c2cc(C#N)ccc2Cl)C1	ZINC000350072857	457162709	/nfs/dbraw/zinc/16/27/09/457162709.db2.gz	HGNYCIMPNOWSQS-ZDUSSCGKSA-N	0	3	333.863	3.452	20	30		EGEDHN
CC[C@H](C)N[C@H](CNC(=O)NCC#Cc1ccccc1)c1ccco1	ZINC000350125733	457165939	/nfs/dbraw/zinc/16/59/39/457165939.db2.gz	NDNLQNSWEFPFHA-FUHWJXTLSA-N	0	3	339.439	3.060	20	30		EGEDHN
O=C(NC[C@@H]1CCCCN1CCO)c1ccc(Cl)c(Cl)c1	ZINC000331331621	457168499	/nfs/dbraw/zinc/16/84/99/457168499.db2.gz	OVKFVQQFIVXWOX-LBPRGKRZSA-N	0	3	331.243	3.145	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CCC(O[C@@H]2CCOC2)CC1	ZINC000362950659	457171173	/nfs/dbraw/zinc/17/11/73/457171173.db2.gz	GHZUXVQPSQXUSZ-GOSISDBHSA-N	0	3	328.456	3.258	20	30		EGEDHN
C[C@@H](CC(=O)c1ccccc1)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000350360669	457176102	/nfs/dbraw/zinc/17/61/02/457176102.db2.gz	BRLZMAYKAYNUTO-HNAYVOBHSA-N	0	3	345.402	3.018	20	30		EGEDHN
N#CC1(NC(=O)CN2CCC[C@@H]2CCCc2ccccc2)CCC1	ZINC000347062207	457210922	/nfs/dbraw/zinc/21/09/22/457210922.db2.gz	WXOGVROFYJMPMK-SFHVURJKSA-N	0	3	325.456	3.036	20	30		EGEDHN
C=CCn1c(-c2sccc2C)nnc1N(C)[C@H]1CCN(C2CC2)C1	ZINC000351077160	457219895	/nfs/dbraw/zinc/21/98/95/457219895.db2.gz	VBFOCZOFJLVYFO-HNNXBMFYSA-N	0	3	343.500	3.174	20	30		EGEDHN
CC(C)n1cc(CN[C@@H]2CCCN(c3ccc(C#N)cc3F)C2)cn1	ZINC000363399609	457312142	/nfs/dbraw/zinc/31/21/42/457312142.db2.gz	AOWIQBIQBSELHN-QGZVFWFLSA-N	0	3	341.434	3.233	20	30		EGEDHN
CC(C)(C)N1C[C@H](C(=O)NCC(C)(C)CCC#N)[C@@H](C(F)(F)F)C1	ZINC000354974970	457331769	/nfs/dbraw/zinc/33/17/69/457331769.db2.gz	KGINJZPZRKTSGG-STQMWFEESA-N	0	3	347.425	3.341	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)NC2CCCCCC2)cc1	ZINC000332311035	457347329	/nfs/dbraw/zinc/34/73/29/457347329.db2.gz	MRCUDYGQDVTWCM-CYBMUJFWSA-N	0	3	349.456	3.217	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)NC2CCCCCC2)cc1	ZINC000332311061	457347540	/nfs/dbraw/zinc/34/75/40/457347540.db2.gz	MRCUDYGQDVTWCM-ZDUSSCGKSA-N	0	3	349.456	3.217	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CCC[C@@H](N2CCCCC2=O)C1	ZINC000363537596	457359794	/nfs/dbraw/zinc/35/97/94/457359794.db2.gz	ARRTVJLCJAQKCY-GOSISDBHSA-N	0	3	339.483	3.465	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)N1CCC[C@H]2CN(C)C[C@H]21	ZINC000425071612	457429258	/nfs/dbraw/zinc/42/92/58/457429258.db2.gz	ZJSQUMGCDWLFKE-GOEBONIOSA-N	0	3	339.464	3.248	20	30		EGEDHN
CC[C@@H]1CN(C(C)=O)[C@H](CC)CN1CCCOc1cccc(C#N)c1	ZINC000357319469	457444290	/nfs/dbraw/zinc/44/42/90/457444290.db2.gz	VNLXGBXDUVEQJR-RTBURBONSA-N	0	3	343.471	3.048	20	30		EGEDHN
CCO[C@H]1C[C@H](NCC(=O)Nc2cccc(C#N)c2)C1(CC)CC	ZINC000360946530	457454545	/nfs/dbraw/zinc/45/45/45/457454545.db2.gz	KBQKILIIXMUYRD-IRXDYDNUSA-N	0	3	329.444	3.070	20	30		EGEDHN
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@H](NCc3ccc(C#N)o3)C[C@H]2C1	ZINC000401121709	457523919	/nfs/dbraw/zinc/52/39/19/457523919.db2.gz	OOAPMHJYJPMWIF-SOUVJXGZSA-N	0	3	345.443	3.276	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC000404688448	457546208	/nfs/dbraw/zinc/54/62/08/457546208.db2.gz	QCUZAVHQFKRXKF-OAHLLOKOSA-N	0	3	333.407	3.186	20	30		EGEDHN
COc1ccc(CN2CCC(CCCn3ccnc3)CC2)cc1C#N	ZINC000361072346	457564522	/nfs/dbraw/zinc/56/45/22/457564522.db2.gz	DGWSDODITPCKNA-UHFFFAOYSA-N	0	3	338.455	3.456	20	30		EGEDHN
C[C@H](CN1CCC[C@@H](C)C1)NC(=O)N(C)[C@@H](C)c1cccc(C#N)c1	ZINC000425474614	457569955	/nfs/dbraw/zinc/56/99/55/457569955.db2.gz	LHBVPRQIXCQWPL-ZACQAIPSSA-N	0	3	342.487	3.381	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N(C)C(=O)NC[C@H]1N(C)CCCC1(C)C	ZINC000425510886	457581776	/nfs/dbraw/zinc/58/17/76/457581776.db2.gz	AAEMHXSTBVWZPP-MAUKXSAKSA-N	0	3	342.487	3.381	20	30		EGEDHN
CCOC(=O)C[C@H](C)N(C)Cc1ccc(C#N)cc1C(F)(F)F	ZINC000356414987	457615258	/nfs/dbraw/zinc/61/52/58/457615258.db2.gz	ONQPGGOYUFUKFD-NSHDSACASA-N	0	3	328.334	3.351	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C(=O)[C@@H]1CCCCN1C1CCCC1	ZINC000370490310	457660570	/nfs/dbraw/zinc/66/05/70/457660570.db2.gz	GFROYUWIWSOGTI-IBGZPJMESA-N	0	3	325.456	3.314	20	30		EGEDHN
Cn1nc2ccccc2c1C(=O)C(C#N)c1ccc(C(F)(F)F)cn1	ZINC000357777170	457686217	/nfs/dbraw/zinc/68/62/17/457686217.db2.gz	DEIALQOPVIQIFE-GFCCVEGCSA-N	0	3	344.296	3.477	20	30		EGEDHN
Cc1ccc([C@H](CN2CCOCC2)N[C@H]2CCC[C@H](C#N)C2)cc1	ZINC000361464611	457739918	/nfs/dbraw/zinc/73/99/18/457739918.db2.gz	RCPHDVAEZPCIMK-IHPCNDPISA-N	0	3	327.472	3.040	20	30		EGEDHN
CCN(CC1CCC1)[C@H](C)C(=O)N(CCC#N)c1ccccc1OC	ZINC000361481613	457745743	/nfs/dbraw/zinc/74/57/43/457745743.db2.gz	OXNLUDRXXMVBAJ-MRXNPFEDSA-N	0	3	343.471	3.452	20	30		EGEDHN
CN(C)[C@H](CNC(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1)c1ccccc1	ZINC000411150200	457813822	/nfs/dbraw/zinc/81/38/22/457813822.db2.gz	YYRIZJGDRNJELD-XUVXKRRUSA-N	0	3	333.435	3.081	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N1CCC(CF)CC1)C(C)C	ZINC000457763620	457819330	/nfs/dbraw/zinc/81/93/30/457819330.db2.gz	ZMHGSDQSEIRLDZ-KRWDZBQOSA-N	0	3	325.472	3.076	20	30		EGEDHN
CC(C)CCO[C@@H]1CCN(C(=O)C(C#N)CCc2ccccc2)C1	ZINC000433363838	457821525	/nfs/dbraw/zinc/82/15/25/457821525.db2.gz	MDYUXIMSFMCWGF-RTBURBONSA-N	0	3	328.456	3.423	20	30		EGEDHN
N#CCCN(C(=O)CN1CC[C@H]2CCC[C@H]21)c1cccc(Cl)c1	ZINC000426474830	457837792	/nfs/dbraw/zinc/83/77/92/457837792.db2.gz	VWZAOGKROBSKHK-RHSMWYFYSA-N	0	3	331.847	3.461	20	30		EGEDHN
C=CCN(CCC(=O)N1CCc2ccccc2C1)CCc1ccco1	ZINC000444614582	457919092	/nfs/dbraw/zinc/91/90/92/457919092.db2.gz	ZJXCPTQUMBVCLD-UHFFFAOYSA-N	0	3	338.451	3.285	20	30		EGEDHN
CCCN(CCN1CCCCC1)[C@H](C)C(=O)Nc1ccccc1C#N	ZINC000411730216	457965048	/nfs/dbraw/zinc/96/50/48/457965048.db2.gz	ZJTAQGUHNLXSBP-QGZVFWFLSA-N	0	3	342.487	3.083	20	30		EGEDHN
CC(C)N(Cc1ccc(F)c(C#N)c1)C[C@H](O)COc1ccccc1	ZINC000444817498	457985150	/nfs/dbraw/zinc/98/51/50/457985150.db2.gz	VCIYZHXNYACFBY-SFHVURJKSA-N	0	3	342.414	3.348	20	30		EGEDHN
Cc1noc(C2(C)CCN(CCCOc3cccc(C#N)c3)CC2)n1	ZINC000371573667	457995157	/nfs/dbraw/zinc/99/51/57/457995157.db2.gz	UNTXAJCGKCBQDT-UHFFFAOYSA-N	0	3	340.427	3.072	20	30		EGEDHN
CCN(CCC#N)C(=O)CN[C@H]1CCCC[C@H]1Oc1ccccc1C	ZINC000362017208	458005979	/nfs/dbraw/zinc/00/59/79/458005979.db2.gz	BSDDVZLIOUWGAQ-PKOBYXMFSA-N	0	3	343.471	3.037	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN2CCC[C@@](O)(C(F)(F)F)CC2)cc1	ZINC000368051455	458008470	/nfs/dbraw/zinc/00/84/70/458008470.db2.gz	MVFWKWHQFBUOJJ-CJNGLKHVSA-N	0	3	342.361	3.257	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CC=C(c3ccccc3)C2)CC1	ZINC000368286114	458023471	/nfs/dbraw/zinc/02/34/71/458023471.db2.gz	YNVBBGGVYDYTDE-UHFFFAOYSA-N	0	3	325.456	3.136	20	30		EGEDHN
C=CC[C@H](C(=O)N1C[C@@H](SC)[C@H](N2CCCC2)C1)c1ccccc1	ZINC000427925740	458052629	/nfs/dbraw/zinc/05/26/29/458052629.db2.gz	VANWBBCBFHAIQA-IPMKNSEASA-N	0	3	344.524	3.385	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H]2CC(C)(C)Oc3ccccc32)CC1	ZINC000412043755	458062545	/nfs/dbraw/zinc/06/25/45/458062545.db2.gz	QFEJCERUWJUVNP-SFHVURJKSA-N	0	3	342.483	3.488	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CCC[C@@H](N2CCCC2=O)CC1	ZINC000412055156	458070593	/nfs/dbraw/zinc/07/05/93/458070593.db2.gz	KOCCBAQPIBDSGO-GOSISDBHSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)N(C)CC(C)(C)C#N)CCN1Cc1ccccc1	ZINC000458498066	458071865	/nfs/dbraw/zinc/07/18/65/458071865.db2.gz	OHIYPTPCOHJCSW-FUHWJXTLSA-N	0	3	342.487	3.231	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)NCC(C)(C)CC#N	ZINC000458520935	458079308	/nfs/dbraw/zinc/07/93/08/458079308.db2.gz	WYEXZYADAZVMER-WMZOPIPTSA-N	0	3	342.487	3.136	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)[C@H](C)N[C@@H]1C[C@H](OC(C)(C)C)C1(C)C	ZINC000412067476	458079650	/nfs/dbraw/zinc/07/96/50/458079650.db2.gz	HFUOCLLHQUPYCK-QCUYGVNKSA-N	0	3	337.508	3.001	20	30		EGEDHN
N#Cc1cccc(C2(C(=O)N3CCCN(C4CCCC4)CC3)CC2)c1	ZINC000435074873	458090438	/nfs/dbraw/zinc/09/04/38/458090438.db2.gz	MODLHDQZJWKYKP-UHFFFAOYSA-N	0	3	337.467	3.067	20	30		EGEDHN
N#CCc1ccc(Oc2ccc(C(=O)NCCN3CCCC3)cc2)cc1	ZINC000358701906	458159118	/nfs/dbraw/zinc/15/91/18/458159118.db2.gz	DMLQPZZIVCPZKI-UHFFFAOYSA-N	0	3	349.434	3.371	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CC[C@@H](n2cc(Cl)cn2)C1	ZINC000428508202	458160547	/nfs/dbraw/zinc/16/05/47/458160547.db2.gz	UDSSYCBYSKKEOF-NVXWUHKLSA-N	0	3	342.830	3.082	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN1CC[C@@H](C)N(Cc2ccccc2)CC1	ZINC000362430416	458171051	/nfs/dbraw/zinc/17/10/51/458171051.db2.gz	NQHIIBSKEFBTEV-LJQANCHMSA-N	0	3	343.515	3.007	20	30		EGEDHN
Cn1ccnc1[C@H]1CCCN(Cc2cccc(OCCCC#N)c2)C1	ZINC000376042203	458174213	/nfs/dbraw/zinc/17/42/13/458174213.db2.gz	CKPWOTSTCXRSTH-SFHVURJKSA-N	0	3	338.455	3.482	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@@H]1CNCc1cc(O)ccc1Br	ZINC000435742306	458194201	/nfs/dbraw/zinc/19/42/01/458194201.db2.gz	NCFIKUUSAIWQSW-IAQYHMDHSA-N	0	3	326.234	3.226	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCN(CCc3ccccc3Cl)C2)nc1	ZINC000428781539	458210192	/nfs/dbraw/zinc/21/01/92/458210192.db2.gz	GYHAEYVWRJLDQN-INIZCTEOSA-N	0	3	327.815	3.302	20	30		EGEDHN
Cc1cc(C#N)ccc1Oc1ccc(C(=O)NCCN(C)C2CC2)cc1	ZINC000362499111	458220105	/nfs/dbraw/zinc/22/01/05/458220105.db2.gz	OHZIIPVQGDJFFJ-UHFFFAOYSA-N	0	3	349.434	3.483	20	30		EGEDHN
CCOC(=O)[C@@](C)(CNCc1ccc(C#N)c(C)c1)c1ccccc1	ZINC000446803472	458228853	/nfs/dbraw/zinc/22/88/53/458228853.db2.gz	LKBRGGYLNDSVRP-NRFANRHFSA-N	0	3	336.435	3.477	20	30		EGEDHN
CC(C)CCO[C@@H]1CCCC[C@H]1NCC(=O)N[C@@](C)(C#N)C(C)C	ZINC000436265643	458280025	/nfs/dbraw/zinc/28/00/25/458280025.db2.gz	ZXDRWEVXLOKDEV-LMMKCTJWSA-N	0	3	337.508	3.004	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2Cc3cccc(O)c3C2)c(OC(F)F)c1	ZINC000429228354	458293422	/nfs/dbraw/zinc/29/34/22/458293422.db2.gz	REXMVSAJAZOUQD-AWEZNQCLSA-N	0	3	330.334	3.122	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC[C@@H](CC)CC(F)(F)F)CC1	ZINC000413232141	458296647	/nfs/dbraw/zinc/29/66/47/458296647.db2.gz	GLAUHNVJHILDGD-ZDUSSCGKSA-N	0	3	335.414	3.305	20	30		EGEDHN
CCO[C@@H]1C[C@H](N[C@@H](C)C(=O)N[C@@](C)(C#N)C(C)C)C1(CC)CC	ZINC000429342820	458318503	/nfs/dbraw/zinc/31/85/03/458318503.db2.gz	COVFWPWTLMMSCA-CUSZFKRNSA-N	0	3	337.508	3.003	20	30		EGEDHN
COc1ccc(CN[C@H](C)C2(OC)CCC2)cc1OCCCC#N	ZINC000414520451	458320746	/nfs/dbraw/zinc/32/07/46/458320746.db2.gz	CYMZJKVSFCRKKE-OAHLLOKOSA-N	0	3	332.444	3.425	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN(C)[C@@H]2CC[C@@H](C)C2)cc1	ZINC000429584975	458349303	/nfs/dbraw/zinc/34/93/03/458349303.db2.gz	PEADYEBDJQEECM-SJLPKXTDSA-N	0	3	343.471	3.452	20	30		EGEDHN
CC(C)(CCC#N)CNC(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000376610402	458353335	/nfs/dbraw/zinc/35/33/35/458353335.db2.gz	FBPPJBHKIGXXFF-SFHVURJKSA-N	0	3	342.487	3.280	20	30		EGEDHN
C=CCN(C)CCN(CC)Cc1ccc(C#N)cc1Br	ZINC000429720705	458362691	/nfs/dbraw/zinc/36/26/91/458362691.db2.gz	FWIIQORLICOPSR-UHFFFAOYSA-N	0	3	336.277	3.260	20	30		EGEDHN
C=C[C@@H]1CCCCN1C(=O)Nc1ccc(OCCN(C)C)c(OC)c1	ZINC000417691520	458367684	/nfs/dbraw/zinc/36/76/84/458367684.db2.gz	XCXPEALCJVHIAL-MRXNPFEDSA-N	0	3	347.459	3.208	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2NCc1ccc2c(c1)NC(=O)CO2	ZINC000418143358	458372141	/nfs/dbraw/zinc/37/21/41/458372141.db2.gz	IMHZJMNORBJEEY-KRWDZBQOSA-N	0	3	333.391	3.056	20	30		EGEDHN
COC(=O)c1cc2c(o1)c(OC)ccc2CNCC1(CC#N)CC1	ZINC000430041086	458392953	/nfs/dbraw/zinc/39/29/53/458392953.db2.gz	UEFSTKMKVIVBOU-UHFFFAOYSA-N	0	3	328.368	3.011	20	30		EGEDHN
Cc1cc(Br)cn2c(CNCC3(CC#N)CC3)cnc12	ZINC000430040267	458392978	/nfs/dbraw/zinc/39/29/78/458392978.db2.gz	PBAFESZEEQMCMU-UHFFFAOYSA-N	0	3	333.233	3.189	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1	ZINC000448583145	458402196	/nfs/dbraw/zinc/40/21/96/458402196.db2.gz	RBMXAYHHVQMPQV-IKGGRYGDSA-N	0	3	348.512	3.228	20	30		EGEDHN
COc1ccccc1NC(=O)C[C@H](C)NCc1ccc(C#N)s1	ZINC000421347866	458411300	/nfs/dbraw/zinc/41/13/00/458411300.db2.gz	DNVMPADWNYSAKX-LBPRGKRZSA-N	0	3	329.425	3.135	20	30		EGEDHN
C[C@@H](CN1CC[C@@H](Oc2ccc(C#N)cn2)C1)c1ccc(F)cc1	ZINC000430183903	458416169	/nfs/dbraw/zinc/41/61/69/458416169.db2.gz	BRYBJLKBCLHQSW-KBXCAEBGSA-N	0	3	325.387	3.349	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)NCC1(CC#N)CC1)c1ccsc1	ZINC000430202543	458421317	/nfs/dbraw/zinc/42/13/17/458421317.db2.gz	YJSSTFWICYGZJM-OAHLLOKOSA-N	0	3	334.489	3.124	20	30		EGEDHN
C=CCc1cc(CN[C@H]2CCCC[C@H]2C(=O)OCC)cc(OC)c1O	ZINC000449506260	458425705	/nfs/dbraw/zinc/42/57/05/458425705.db2.gz	CDIIXMOLPPLDDD-SJORKVTESA-N	0	3	347.455	3.341	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCc1cccc(I)c1	ZINC000449546416	458426735	/nfs/dbraw/zinc/42/67/35/458426735.db2.gz	BRWIEPREGFQMCM-KGLIPLIRSA-N	0	3	343.208	3.114	20	30		EGEDHN
C=CCc1cc(CN2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)cc(OC)c1O	ZINC000449558235	458426990	/nfs/dbraw/zinc/42/69/90/458426990.db2.gz	WCYXIMZQXAVZNF-KBAYOESNSA-N	0	3	331.456	3.112	20	30		EGEDHN
C=CCC[C@@H](CO)NCc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1	ZINC000449698845	458429682	/nfs/dbraw/zinc/42/96/82/458429682.db2.gz	PGSPPSCBPWWMHW-ZDUSSCGKSA-N	0	3	346.383	3.280	20	30		EGEDHN
C[C@@H]1C[C@@]1(C#N)C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000449951971	458436225	/nfs/dbraw/zinc/43/62/25/458436225.db2.gz	JBAIYTNOOFUATG-CIWUYKSXSA-N	0	3	325.456	3.048	20	30		EGEDHN
COCCN(Cc1ccc(C#N)cc1)C[C@H](O)[C@H](C)c1ccccc1	ZINC000450312848	458445307	/nfs/dbraw/zinc/44/53/07/458445307.db2.gz	JFULNAAISGXNKG-UTKZUKDTSA-N	0	3	338.451	3.171	20	30		EGEDHN
C[C@@H]1C[C@@H](c2ccccc2)[C@@H](C)N1CC(=O)NCc1ccc(C#N)cc1	ZINC000451182224	458468621	/nfs/dbraw/zinc/46/86/21/458468621.db2.gz	INKWDJDUVUDFLM-CBGDNZLLSA-N	0	3	347.462	3.441	20	30		EGEDHN
CC(C)(C)c1cnc(C(C#N)C(=O)c2ccc(NC(N)=O)cc2)s1	ZINC000430622034	458473334	/nfs/dbraw/zinc/47/33/34/458473334.db2.gz	FCLLNMGIOHNMSE-GFCCVEGCSA-N	0	3	342.424	3.421	20	30		EGEDHN
CC(C)O[C@H]1C[C@@H](NCC(=O)Nc2cc(Cl)ccc2C#N)C1(C)C	ZINC000451496880	458478376	/nfs/dbraw/zinc/47/83/76/458478376.db2.gz	KUMIIKNFUKJVOQ-CVEARBPZSA-N	0	3	349.862	3.332	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1N[C@@H](C)C(=O)Nc1cccc(Cl)c1Cl	ZINC000451607735	458483499	/nfs/dbraw/zinc/48/34/99/458483499.db2.gz	QILBSRDBGCVAMO-NDMJEZRESA-N	0	3	329.227	3.254	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC(=O)N[C@H](c1ccccc1)C1CCCC1	ZINC000451675410	458485288	/nfs/dbraw/zinc/48/52/88/458485288.db2.gz	PWKBVBLALNFIKV-SVFBPWRDSA-N	0	3	342.483	3.357	20	30		EGEDHN
C=CCN1CC[C@@H](N2CCC(Cc3cc(F)ccc3F)CC2)C1=O	ZINC000451970005	458491883	/nfs/dbraw/zinc/49/18/83/458491883.db2.gz	XEEFNONGIORTTK-GOSISDBHSA-N	0	3	334.410	3.006	20	30		EGEDHN
C=C(C)CCN[C@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl	ZINC000453307717	458524987	/nfs/dbraw/zinc/52/49/87/458524987.db2.gz	BZSDRWJFRFCWNC-SECBINFHSA-N	0	3	337.272	3.258	20	30		EGEDHN
C[C@@]1(CO)CCC[C@H]1NCC#Cc1ccc(OC(F)(F)F)cc1	ZINC000493711164	458542100	/nfs/dbraw/zinc/54/21/00/458542100.db2.gz	UANVLBWCQWLBNB-CVEARBPZSA-N	0	3	327.346	3.077	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1ccc(OC)cc1C)C(C)C	ZINC000460993219	458545398	/nfs/dbraw/zinc/54/53/98/458545398.db2.gz	LZCDNMDVCYFPHK-LJQANCHMSA-N	0	3	330.472	3.432	20	30		EGEDHN
COc1ccc(N(Cc2ccccc2)C(=O)[C@@H](N)CCCC#N)cc1	ZINC000424070324	458550808	/nfs/dbraw/zinc/55/08/08/458550808.db2.gz	XHJGWODIUOFDCK-IBGZPJMESA-N	0	3	337.423	3.250	20	30		EGEDHN
CCc1cccc(Cc2cnc(NC(=O)[C@@H](N)CCCC#N)s2)c1	ZINC000424083262	458554086	/nfs/dbraw/zinc/55/40/86/458554086.db2.gz	AUFHSJDPKXUOHZ-INIZCTEOSA-N	0	3	342.468	3.256	20	30		EGEDHN
Cc1nc(NC(=O)[C@@H](N)CCCC#N)sc1Cc1cccc(F)c1	ZINC000424086967	458555822	/nfs/dbraw/zinc/55/58/22/458555822.db2.gz	CRLMOYMXYWGOGO-AWEZNQCLSA-N	0	3	346.431	3.141	20	30		EGEDHN
Cc1nc(NC(=O)[C@H](N)CCCC#N)sc1Cc1ccc(C)cc1	ZINC000424088710	458555983	/nfs/dbraw/zinc/55/59/83/458555983.db2.gz	HIBDMOIBKTZARF-OAHLLOKOSA-N	0	3	342.468	3.310	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)NCC1(c2ccccc2)CCCCCC1	ZINC000424117478	458562155	/nfs/dbraw/zinc/56/21/55/458562155.db2.gz	YXYDCZGYMYERMC-GOSISDBHSA-N	0	3	327.472	3.416	20	30		EGEDHN
Cc1cccc(Oc2ncccc2NC(=O)[C@H](N)CCCC#N)c1C	ZINC000424141795	458569297	/nfs/dbraw/zinc/56/92/97/458569297.db2.gz	XKILOJWAVFZXGQ-OAHLLOKOSA-N	0	3	338.411	3.450	20	30		EGEDHN
C=CCC1(C(=O)Nc2cc(CN)cc(C(F)(F)F)c2)CCOCC1	ZINC000424165431	458575348	/nfs/dbraw/zinc/57/53/48/458575348.db2.gz	YOETVSMXHWCKDX-UHFFFAOYSA-N	0	3	342.361	3.476	20	30		EGEDHN
C[C@H]1CC=C(C(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)CC1	ZINC000454816710	458576068	/nfs/dbraw/zinc/57/60/68/458576068.db2.gz	YTUFSLCIKITDHA-INIZCTEOSA-N	0	3	325.456	3.195	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N1CC[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000424177061	458577771	/nfs/dbraw/zinc/57/77/71/458577771.db2.gz	TYIPJFZIWDPSLF-DZGCQCFKSA-N	0	3	339.361	3.042	20	30		EGEDHN
C[C@H]1CCN(C)CCN1C(=O)Nc1ccc(OC(C)(C)C)c(C#N)c1	ZINC000455761864	458612457	/nfs/dbraw/zinc/61/24/57/458612457.db2.gz	ADODNKJHLIBRSZ-AWEZNQCLSA-N	0	3	344.459	3.293	20	30		EGEDHN
C[C@H]1C[C@@H](N2CCCC2)CN1C(=O)C(C)(C)Cc1ccc(C#N)cc1	ZINC000456065984	458630723	/nfs/dbraw/zinc/63/07/23/458630723.db2.gz	VEDRYKORHZVHKV-QFBILLFUSA-N	0	3	339.483	3.212	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N(C)C1CCN(Cc2ccccc2)CC1	ZINC000424502094	458650552	/nfs/dbraw/zinc/65/05/52/458650552.db2.gz	PIKPIGRAGFUCLF-UXHICEINSA-N	0	3	342.483	3.091	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000424504886	458651943	/nfs/dbraw/zinc/65/19/43/458651943.db2.gz	ZUBNJFAQZYGUOT-ZCNNSNEGSA-N	0	3	342.483	3.139	20	30		EGEDHN
N#Cc1cc(F)ccc1NCCCN1CCN(c2ccccc2)CC1	ZINC000462922189	458666197	/nfs/dbraw/zinc/66/61/97/458666197.db2.gz	LPHOLOXJBRLUIB-UHFFFAOYSA-N	0	3	338.430	3.322	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)N[C@H](C)CN1CCC[C@H](C)C1	ZINC000463518809	458707389	/nfs/dbraw/zinc/70/73/89/458707389.db2.gz	RPIQHNZUKDKPPE-JKSUJKDBSA-N	0	3	346.471	3.110	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1	ZINC000424704366	458713562	/nfs/dbraw/zinc/71/35/62/458713562.db2.gz	IFYPVUIMZRWJGJ-IRXDYDNUSA-N	0	3	336.520	3.327	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@@H](C)N(C)CCCSC	ZINC000439487625	458715232	/nfs/dbraw/zinc/71/52/32/458715232.db2.gz	SEMSBVCQTCWLAF-CQSZACIVSA-N	0	3	326.531	3.336	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@H](NC/C=C\c3ccc(F)cc3)C2=O)cc1	ZINC000503915397	458729816	/nfs/dbraw/zinc/72/98/16/458729816.db2.gz	WCZYIOPKQLMVQN-WWNMRYTNSA-N	0	3	349.409	3.496	20	30		EGEDHN
Cc1cc(C)cc(CN[C@H]2CCCN(c3ccc(C#N)cc3)C2=O)c1	ZINC000503928333	458730267	/nfs/dbraw/zinc/73/02/67/458730267.db2.gz	NWBCCKJYYLQFBY-FQEVSTJZSA-N	0	3	333.435	3.460	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCCc2c(C)cc(C)cc2C)CC1	ZINC000506461623	458751545	/nfs/dbraw/zinc/75/15/45/458751545.db2.gz	CFICWSLLEFQWTM-UHFFFAOYSA-N	0	3	343.515	3.494	20	30		EGEDHN
C[C@]1(CO)CCCN1Cc1cccc(OCc2cccc(C#N)c2)c1	ZINC000530390380	458758526	/nfs/dbraw/zinc/75/85/26/458758526.db2.gz	OAZJVMMCFOMRCY-OAQYLSRUSA-N	0	3	336.435	3.484	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N[C@@H](C)[C@H](c1ccccc1C)N(C)C)OCC	ZINC000510551137	458775298	/nfs/dbraw/zinc/77/52/98/458775298.db2.gz	OHNFWHZAZCXANA-XKGZKEIXSA-N	0	3	332.488	3.474	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N[C@H](C)[C@H](c1ccccc1C)N(C)C)OCC	ZINC000510551120	458775423	/nfs/dbraw/zinc/77/54/23/458775423.db2.gz	OHNFWHZAZCXANA-IMFGXOCKSA-N	0	3	332.488	3.474	20	30		EGEDHN
C[C@H]1C[C@H](N(C)C(=O)NCC(C)(C)C#N)CCN1Cc1ccccc1	ZINC000512797234	458788265	/nfs/dbraw/zinc/78/82/65/458788265.db2.gz	JUCFUQOEHFCFJW-FUHWJXTLSA-N	0	3	342.487	3.231	20	30		EGEDHN
CCN(C[C@@H]1CCCN1CC)C(=O)CSCc1ccc(C#N)cc1	ZINC000547798486	458795772	/nfs/dbraw/zinc/79/57/72/458795772.db2.gz	NPZFGRMKRUPXME-SFHVURJKSA-N	0	3	345.512	3.124	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN2CCC(c3ccccc3)CC2)cc1	ZINC000514368520	458797608	/nfs/dbraw/zinc/79/76/08/458797608.db2.gz	PTJBRRFSTJUNCP-HXUWFJFHSA-N	0	3	336.435	3.178	20	30		EGEDHN
C=CCc1ccc(OC[C@@H](O)CN2CC(C)(C)[C@@H]2C2CC2)c(OC)c1	ZINC000515100584	458805787	/nfs/dbraw/zinc/80/57/87/458805787.db2.gz	FNJCFHGACUITAO-PXNSSMCTSA-N	0	3	345.483	3.284	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@H](NCc1ccc(CC#N)cc1)C1CC1	ZINC000495302771	458831054	/nfs/dbraw/zinc/83/10/54/458831054.db2.gz	VKEVQHGOOGBPKE-QGZVFWFLSA-N	0	3	329.444	3.146	20	30		EGEDHN
C[C@](O)(C1CCN(CCCC2(C#N)CCOCC2)CC1)C(F)(F)F	ZINC000531444848	458918710	/nfs/dbraw/zinc/91/87/10/458918710.db2.gz	FNYYTYCDCDWRGH-HNNXBMFYSA-N	0	3	348.409	3.112	20	30		EGEDHN
C=CCOCCCN1CCN(Cc2ccccc2OCC)C[C@H]1C	ZINC000441325789	458919650	/nfs/dbraw/zinc/91/96/50/458919650.db2.gz	CLPVSLGZTJAJJN-GOSISDBHSA-N	0	3	332.488	3.184	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CCC(C2CCOCC2)CC1	ZINC000519160902	458921098	/nfs/dbraw/zinc/92/10/98/458921098.db2.gz	YBHBPEKBUZCJRY-FQEVSTJZSA-N	0	3	340.467	3.424	20	30		EGEDHN
C=CCCN(C)C(=O)NC[C@@H](c1cccc(OC)c1)N(CC)CC	ZINC000466975773	458939893	/nfs/dbraw/zinc/93/98/93/458939893.db2.gz	QGIAXAIUJYVTBP-SFHVURJKSA-N	0	3	333.476	3.296	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)cn1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000495777050	458949665	/nfs/dbraw/zinc/94/96/65/458949665.db2.gz	YHDSFINPWAJCIT-GOEBONIOSA-N	0	3	344.459	3.078	20	30		EGEDHN
CC#CCN(C)C(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1	ZINC000457491803	458976513	/nfs/dbraw/zinc/97/65/13/458976513.db2.gz	VTEJFRUGAPKNQX-INIZCTEOSA-N	0	3	333.501	3.186	20	30		EGEDHN
N#C[C@@H]1CC[C@@H](NC[C@@H](O)COc2cccc(Cl)c2Cl)C1	ZINC000442778839	459033856	/nfs/dbraw/zinc/03/38/56/459033856.db2.gz	KXEXMOOOYMVREU-IJLUTSLNSA-N	0	3	329.227	3.015	20	30		EGEDHN
CCC[C@H](N[C@@H]1CC[C@@H](C#N)C1)C(=O)N1CCc2sccc2C1	ZINC000442785680	459035659	/nfs/dbraw/zinc/03/56/59/459035659.db2.gz	SHIZWUAIFHCSPL-BMFZPTHFSA-N	0	3	331.485	3.083	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1ccc(C)c(OC)c1)C(C)C	ZINC000496012881	459036229	/nfs/dbraw/zinc/03/62/29/459036229.db2.gz	FXKFKGWABPRJJI-SFHVURJKSA-N	0	3	330.472	3.432	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N(C)C[C@@H]1CCCN(CC)[C@H]1c1cnn(C)c1	ZINC000442805917	459041417	/nfs/dbraw/zinc/04/14/17/459041417.db2.gz	AXNLYULAXPCANG-HQRMLTQVSA-N	0	3	346.519	3.254	20	30		EGEDHN
C=C(C)CS(=O)(=O)NC[C@@H](CC(C)C)N[C@@H](C)c1ccccc1	ZINC000477600480	459050429	/nfs/dbraw/zinc/05/04/29/459050429.db2.gz	IFYVKKKKRLYAPA-FUHWJXTLSA-N	0	3	338.517	3.247	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@@H]2CN(C)C[C@@H]2c2ccccc2)cc1	ZINC000478405032	459089348	/nfs/dbraw/zinc/08/93/48/459089348.db2.gz	ZKAJUBICFKIWOP-WOJBJXKFSA-N	0	3	336.435	3.079	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2cnc3onc(C(C)(C)C)c3c2)nc(C)n1	ZINC000590388867	459122288	/nfs/dbraw/zinc/12/22/88/459122288.db2.gz	ZQHOSCULSSZUAZ-CQSZACIVSA-N	0	3	349.394	3.417	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N(C)C(=O)NC[C@H]1CCCCN1C1CC1	ZINC000567728456	459155758	/nfs/dbraw/zinc/15/57/58/459155758.db2.gz	AJPPFYYGMIGDSP-HNAYVOBHSA-N	0	3	340.471	3.278	20	30		EGEDHN
Cc1[nH]c(C#N)cc1C(=O)N[C@@H](CN1CCCCC1)c1ccccc1	ZINC000590629110	459166727	/nfs/dbraw/zinc/16/67/27/459166727.db2.gz	NMVBCPQOYMYRSR-IBGZPJMESA-N	0	3	336.439	3.152	20	30		EGEDHN
C=CCN(CCc1ccccc1)C[C@@H](O)COc1ccc(F)cc1	ZINC000521685626	459172435	/nfs/dbraw/zinc/17/24/35/459172435.db2.gz	AIUBSLBNUMVLMP-LJQANCHMSA-N	0	3	329.415	3.296	20	30		EGEDHN
CCN(CCC#N)C(=O)CS[C@H]1CCCN(Cc2ccccc2)C1	ZINC000567859541	459179404	/nfs/dbraw/zinc/17/94/04/459179404.db2.gz	GNGAGPKQNBOCEV-SFHVURJKSA-N	0	3	345.512	3.146	20	30		EGEDHN
CC(C)n1ccnc1CNC1CCC(Oc2ccc(C#N)cn2)CC1	ZINC000594934524	459182698	/nfs/dbraw/zinc/18/26/98/459182698.db2.gz	HXUPFRGRABISNF-UHFFFAOYSA-N	0	3	339.443	3.210	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)NC1CC(C(F)(F)F)C1)C(C)C	ZINC000480518095	459202616	/nfs/dbraw/zinc/20/26/16/459202616.db2.gz	JFWISAMSCGVLQC-NRXISQOPSA-N	0	3	347.425	3.325	20	30		EGEDHN
C[C@@]1(NC(=O)Nc2cccc(C#N)c2)CCN(Cc2ccccc2)C1	ZINC000567996102	459205655	/nfs/dbraw/zinc/20/56/55/459205655.db2.gz	BDDGQLJAOZCIOO-HXUWFJFHSA-N	0	3	334.423	3.344	20	30		EGEDHN
CS(=O)(=O)C1(CN[C@@H]2CCCc3cc(C#N)ccc32)CCCCC1	ZINC000595077057	459238561	/nfs/dbraw/zinc/23/85/61/459238561.db2.gz	LFESNWKESJYADM-GOSISDBHSA-N	0	3	346.496	3.273	20	30		EGEDHN
C=CC[C@H](C)NC(=O)NCC1(N2CCOC(C)(C)C2)CCCCC1	ZINC000522663123	459254807	/nfs/dbraw/zinc/25/48/07/459254807.db2.gz	XHNVHPPKPVTJDW-INIZCTEOSA-N	0	3	337.508	3.064	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1ccc(NCCc2ccccc2)cc1	ZINC000580642984	459262653	/nfs/dbraw/zinc/26/26/53/459262653.db2.gz	PSGIWUFBXDTDIX-LJQANCHMSA-N	0	3	336.439	3.301	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@@H]2C[C@H]2c2ccccc2F)cc1	ZINC000590917397	459267792	/nfs/dbraw/zinc/26/77/92/459267792.db2.gz	VVWVOWHNWXIRBU-VDZJLULYSA-N	0	3	333.366	3.052	20	30		EGEDHN
COc1ccc([C@@H](Cc2ccc(F)cc2)NC(=O)C(C)C#N)cc1	ZINC000522980257	459274877	/nfs/dbraw/zinc/27/48/77/459274877.db2.gz	UGSBCWMXWRSAQV-FZKQIMNGSA-N	0	3	326.371	3.394	20	30		EGEDHN
N#Cc1cnn2cc(CN3CCCC[C@@H]3Cc3ccc(F)cc3)cnc12	ZINC000568395049	459280544	/nfs/dbraw/zinc/28/05/44/459280544.db2.gz	MUHAJMGDFNNQBT-LJQANCHMSA-N	0	3	349.413	3.337	20	30		EGEDHN
N#CC[C@H]1CCCN(C(=O)N[C@H](CN2CCCC2)c2ccccc2)C1	ZINC000595438760	459302409	/nfs/dbraw/zinc/30/24/09/459302409.db2.gz	ARBUMBRVVWOVAV-IEBWSBKVSA-N	0	3	340.471	3.159	20	30		EGEDHN
N#Cc1ccc(CCN2CCC[C@H](Oc3ncccc3F)C2)cc1	ZINC000595460699	459309139	/nfs/dbraw/zinc/30/91/39/459309139.db2.gz	GCKCXIPDNVLYNH-KRWDZBQOSA-N	0	3	325.387	3.178	20	30		EGEDHN
C[C@H](CN1CCC(C)CC1)NC(=O)N[C@@H](C)c1ccc(C#N)cc1	ZINC000595460956	459309995	/nfs/dbraw/zinc/30/99/95/459309995.db2.gz	IPDLDNOTOLRPID-CVEARBPZSA-N	0	3	328.460	3.039	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cc(F)cc([N+](=O)[O-])c1)C(C)C	ZINC000523655476	459319823	/nfs/dbraw/zinc/31/98/23/459319823.db2.gz	HGSVFTICKZPEED-KRWDZBQOSA-N	0	3	349.406	3.162	20	30		EGEDHN
N#CCCCCN1CCN(CCCCC#N)c2ccc(O)cc2C1	ZINC000595584541	459355329	/nfs/dbraw/zinc/35/53/29/459355329.db2.gz	IVMBIQGNWIMFSC-UHFFFAOYSA-N	0	3	326.444	3.402	20	30		EGEDHN
C=CCN1CC[C@@H](S[C@@H]2CCCN(Cc3ccccc3)C2)C1=O	ZINC000568882797	459361667	/nfs/dbraw/zinc/36/16/67/459361667.db2.gz	DJPDNOLYXKKIDD-QZTJIDSGSA-N	0	3	330.497	3.171	20	30		EGEDHN
COCCC1(CNC(=O)C(C#N)CCc2ccccc2)CCCC1	ZINC000537285943	459364909	/nfs/dbraw/zinc/36/49/09/459364909.db2.gz	ZTYPCWPZIKSZNZ-SFHVURJKSA-N	0	3	328.456	3.472	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)[C@H](C)N[C@@H](C)C(C)(C)c1ccccc1	ZINC000538153501	459368914	/nfs/dbraw/zinc/36/89/14/459368914.db2.gz	SKQGPGTZIMYITC-TWOQFEAHSA-N	0	3	329.488	3.385	20	30		EGEDHN
C=CC[C@H](CO)CN[C@H](C)c1ccccc1I	ZINC000540393424	459380318	/nfs/dbraw/zinc/38/03/18/459380318.db2.gz	JANBWICTQLENEQ-NEPJUHHUSA-N	0	3	345.224	3.126	20	30		EGEDHN
C=CC[C@H](CC)NC(=O)NC[C@H](c1ccc(OC)cc1)N1CCCC1	ZINC000540699512	459383550	/nfs/dbraw/zinc/38/35/50/459383550.db2.gz	CBFXWUPLGIANSV-PKOBYXMFSA-N	0	3	345.487	3.486	20	30		EGEDHN
CN(C[C@@H]1CCCN1C)C(=O)c1c(Cl)cc(C#N)cc1Cl	ZINC000591540949	459398747	/nfs/dbraw/zinc/39/87/47/459398747.db2.gz	QLXIYFSFNIXESV-NSHDSACASA-N	0	3	326.227	3.031	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](O)COCc2ccccc2Cl)c(F)c1	ZINC000591733767	459427176	/nfs/dbraw/zinc/42/71/76/459427176.db2.gz	HXBUGJKTDODMLA-INIZCTEOSA-N	0	3	348.805	3.018	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@@H](Nc2nc3ccccn3c2C#N)C1	ZINC000541114439	459428619	/nfs/dbraw/zinc/42/86/19/459428619.db2.gz	WIVUTZCHYVQDLA-NVXWUHKLSA-N	0	3	331.423	3.453	20	30		EGEDHN
COc1ccccc1N(CCC#N)C(=O)[C@@H](C)N(C)C[C@H]1CC1(C)C	ZINC000595912918	459483991	/nfs/dbraw/zinc/48/39/91/459483991.db2.gz	PHPZENMFPHYSIL-HZPDHXFCSA-N	0	3	343.471	3.308	20	30		EGEDHN
N#CC[C@@H]1CCCN(C(=O)NC[C@H](c2ccccc2)N2CCCC2)C1	ZINC000596089399	459516289	/nfs/dbraw/zinc/51/62/89/459516289.db2.gz	ZOYLKAJQAUBFIM-PKOBYXMFSA-N	0	3	340.471	3.159	20	30		EGEDHN
C=CCN1CCC(Nc2c(Br)cccc2[N+](=O)[O-])CC1	ZINC000596115562	459526617	/nfs/dbraw/zinc/52/66/17/459526617.db2.gz	BRBIWXYYYUSXQH-UHFFFAOYSA-N	0	3	340.221	3.420	20	30		EGEDHN
C[C@H](C(=O)N(C)Cc1cccc(F)c1)N1CCC(CCC#N)CC1	ZINC000592135777	459532486	/nfs/dbraw/zinc/53/24/86/459532486.db2.gz	LLAGLVDCBQISHG-OAHLLOKOSA-N	0	3	331.435	3.188	20	30		EGEDHN
N#CC[C@@]1(O)CCN(CCCCOc2cccc(C(F)(F)F)c2)C1	ZINC000592145915	459535355	/nfs/dbraw/zinc/53/53/55/459535355.db2.gz	BGFZIXRTBYKUDV-MRXNPFEDSA-N	0	3	342.361	3.215	20	30		EGEDHN
C[C@@H](c1ccc(C#N)cc1)N1CC[C@@H](C(=O)NCc2ccccc2)C1	ZINC000592153981	459537360	/nfs/dbraw/zinc/53/73/60/459537360.db2.gz	FJJPGBJAXGLDND-OXJNMPFZSA-N	0	3	333.435	3.258	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2cccc(F)c2C#N)C1	ZINC000488699576	459547920	/nfs/dbraw/zinc/54/79/20/459547920.db2.gz	DDLDIIKPIFHYOB-ZBFHGGJFSA-N	0	3	337.398	3.263	20	30		EGEDHN
CCCN(C(=O)Nc1cc(C#N)ccc1OC(C)C)[C@H]1CCN(C)C1	ZINC000592224592	459553398	/nfs/dbraw/zinc/55/33/98/459553398.db2.gz	TXNCGTYYGLRTQA-INIZCTEOSA-N	0	3	344.459	3.293	20	30		EGEDHN
CCN(CC(=O)NC1(C#N)CCC1)[C@H](Cc1ccc(F)cc1)C(C)C	ZINC000526291160	459555388	/nfs/dbraw/zinc/55/53/88/459555388.db2.gz	PVACPWFTEHJFNT-GOSISDBHSA-N	0	3	345.462	3.277	20	30		EGEDHN
C=C(CNC(=O)CCN1CCN(c2ccccc2)CC1)c1ccccc1	ZINC000488902642	459556005	/nfs/dbraw/zinc/55/60/05/459556005.db2.gz	WHIXFLXTDPREPK-UHFFFAOYSA-N	0	3	349.478	3.028	20	30		EGEDHN
C=C[C@H]1CCCCN1C[C@H](O)COc1ccccc1C(F)(F)F	ZINC000489506455	459567163	/nfs/dbraw/zinc/56/71/63/459567163.db2.gz	HCZKHDZNCBAVQJ-KBPBESRZSA-N	0	3	329.362	3.486	20	30		EGEDHN
C[C@@H]1[C@H](Nc2nc(C#N)c(Cl)s2)CCN1Cc1ccccc1	ZINC000596236479	459570046	/nfs/dbraw/zinc/57/00/46/459570046.db2.gz	XKDJPUQIBPKOFN-DGCLKSJQSA-N	0	3	332.860	3.165	20	30		EGEDHN
CC(C)Cc1ccc([C@H](CNc2c(C#N)cnn2C)N(C)C)cc1	ZINC000596236100	459570656	/nfs/dbraw/zinc/57/06/56/459570656.db2.gz	PMLHPMYMVOKJNA-SFHVURJKSA-N	0	3	325.460	3.205	20	30		EGEDHN
C=CCN(CCc1ccco1)C(=O)NC[C@@H](C)N1CCC[C@@H](C)C1	ZINC000498155012	459571072	/nfs/dbraw/zinc/57/10/72/459571072.db2.gz	HJUXSPFUVASXRF-IAGOWNOFSA-N	0	3	333.476	3.140	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN2CCC=C(c3cccnc3)C2)c1	ZINC000562540988	459582501	/nfs/dbraw/zinc/58/25/01/459582501.db2.gz	QQAYVRQLBQDWMA-UHFFFAOYSA-N	0	3	332.407	3.071	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(C(=O)C(C)(C)C)cc2)CC1	ZINC000490740436	459586598	/nfs/dbraw/zinc/58/65/98/459586598.db2.gz	LOGTXFIXLAOUFB-UHFFFAOYSA-N	0	3	326.440	3.199	20	30		EGEDHN
C#CCNC(=O)CCN[C@H](C)c1sc(-c2ccc(F)cc2)nc1C	ZINC000491167143	459601371	/nfs/dbraw/zinc/60/13/71/459601371.db2.gz	WMLFWQZPZZEGIM-GFCCVEGCSA-N	0	3	345.443	3.048	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(CCC)Cc2ccc(OC)cc2)CC1	ZINC000592526908	459626772	/nfs/dbraw/zinc/62/67/72/459626772.db2.gz	XETWOJDDEQGGOU-UHFFFAOYSA-N	0	3	345.487	3.267	20	30		EGEDHN
CCCCOc1ccc(CCNCc2cnc3c(C#N)cnn3c2)cc1	ZINC000562768220	459642871	/nfs/dbraw/zinc/64/28/71/459642871.db2.gz	ICQVSVLZFXDIOH-UHFFFAOYSA-N	0	3	349.438	3.112	20	30		EGEDHN
C#CCn1ccc(CN(CCOC)c2cc(C)nc3ccccc32)n1	ZINC000491783245	459673435	/nfs/dbraw/zinc/67/34/35/459673435.db2.gz	NLNCITVRRMZQLY-UHFFFAOYSA-N	0	3	334.423	3.026	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N(C)[C@@H](C)c1cc2ccccc2o1	ZINC000491794895	459675440	/nfs/dbraw/zinc/67/54/40/459675440.db2.gz	TUQJOWCUUXIULT-HNNXBMFYSA-N	0	3	327.428	3.090	20	30		EGEDHN
C#CCCN1CCC(NC(=O)/C=C\c2ccc([C@@H]3C[C@@H]3C)o2)CC1	ZINC000491924560	459685191	/nfs/dbraw/zinc/68/51/91/459685191.db2.gz	JSFKOJPEXFQNPK-QXXHJNCHSA-N	0	3	326.440	3.020	20	30		EGEDHN
CC(C)Cn1nccc1C([O-])=C(C#N)c1ccc(C(F)(F)F)cn1	ZINC000563119314	459718003	/nfs/dbraw/zinc/71/80/03/459718003.db2.gz	QDAYXWMWQVLGBF-GFCCVEGCSA-N	0	3	336.317	3.443	20	30		EGEDHN
CC(C)Cn1nccc1C(=O)C(C#N)c1ccc(C(F)(F)F)cn1	ZINC000563119314	459718008	/nfs/dbraw/zinc/71/80/08/459718008.db2.gz	QDAYXWMWQVLGBF-GFCCVEGCSA-N	0	3	336.317	3.443	20	30		EGEDHN
CN(C)Cc1ccccc1NC(=O)/C=C/c1ccc(OCC#N)cc1	ZINC000492769585	459720919	/nfs/dbraw/zinc/72/09/19/459720919.db2.gz	FMEJRWIWQZSHOW-FMIVXFBMSA-N	0	3	335.407	3.302	20	30		EGEDHN
CN(C)CCN(Cc1ccsc1)C(=O)/C=C\c1cccc(C#N)c1	ZINC000493151734	459734991	/nfs/dbraw/zinc/73/49/91/459734991.db2.gz	JUFGKVPQVKNOIY-SREVYHEPSA-N	0	3	339.464	3.223	20	30		EGEDHN
CN(C(=O)C(C[C@@H]1CCCO1)C(F)(F)F)c1ccc(C#N)cc1F	ZINC000593051828	459755574	/nfs/dbraw/zinc/75/55/74/459755574.db2.gz	ONKSRSCYBOXOKG-RYUDHWBXSA-N	0	3	344.308	3.408	20	30		EGEDHN
C=CCOc1ccccc1CNC[C@H](O)COc1ccccc1C	ZINC000564857739	459777164	/nfs/dbraw/zinc/77/71/64/459777164.db2.gz	XUYHHEMXLJYVHF-SFHVURJKSA-N	0	3	327.424	3.089	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CC[C@@H](c2ccncc2)C1	ZINC000574098570	459778475	/nfs/dbraw/zinc/77/84/75/459778475.db2.gz	QQRRADLCCMRAGY-WOJBJXKFSA-N	0	3	338.451	3.039	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CC[C@@H](c2ccncc2)C1	ZINC000574098568	459778500	/nfs/dbraw/zinc/77/85/00/459778500.db2.gz	QQRRADLCCMRAGY-UXHICEINSA-N	0	3	338.451	3.039	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)C(=O)[C@H]1CNCc2ccccc21	ZINC000574273799	459799584	/nfs/dbraw/zinc/79/95/84/459799584.db2.gz	SWKVOFIXCFNUNV-FQEVSTJZSA-N	0	3	336.435	3.097	20	30		EGEDHN
Cc1ccccc1[C@H]1CCN(C[C@@H](O)COc2ccccc2C#N)C1	ZINC000528366302	459804218	/nfs/dbraw/zinc/80/42/18/459804218.db2.gz	SXYWXJIWMNJWEJ-RBUKOAKNSA-N	0	3	336.435	3.096	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]2c2ccc(Cl)cc2)cc1	ZINC000566123584	459810506	/nfs/dbraw/zinc/81/05/06/459810506.db2.gz	CBWVPUWSEJAFOK-YTQUADARSA-N	0	3	342.826	3.097	20	30		EGEDHN
Cc1c2ccccc2oc1[C@@H](NC[C@H](O)CN(C)CCC#N)C(C)C	ZINC000584834296	459810677	/nfs/dbraw/zinc/81/06/77/459810677.db2.gz	ICBCESWMQNKSPZ-LPHOPBHVSA-N	0	3	343.471	3.234	20	30		EGEDHN
N#CC(C(=O)c1cnn(C2CC2)c1)c1nc2ccccc2n1C(F)F	ZINC000528924455	459817965	/nfs/dbraw/zinc/81/79/65/459817965.db2.gz	NRORIYVMIPRZEP-GFCCVEGCSA-N	0	3	341.321	3.453	20	30		EGEDHN
CN(Cc1ccccc1)C[C@@H](O)COc1cc(Cl)cc(C#N)c1	ZINC000588316025	459946484	/nfs/dbraw/zinc/94/64/84/459946484.db2.gz	ZDKFTYSRAZGDCP-QGZVFWFLSA-N	0	3	330.815	3.083	20	30		EGEDHN
N#Cc1cccc(CN2CCC(NCc3ccc4c(n3)CCC4)CC2)c1	ZINC000593695385	459955998	/nfs/dbraw/zinc/95/59/98/459955998.db2.gz	NBSHHKJMEOWVPU-UHFFFAOYSA-N	0	3	346.478	3.196	20	30		EGEDHN
COc1cc([C@H](C)NC[C@H](O)CC(C)(C)C#N)ccc1OC(C)C	ZINC000598599514	459958753	/nfs/dbraw/zinc/95/87/53/459958753.db2.gz	BVMVTBDPDDBFDC-GOEBONIOSA-N	0	3	334.460	3.434	20	30		EGEDHN
CCOc1ccc([C@H](C)NC[C@H](O)CC(C)(C)C#N)cc1OCC	ZINC000598599282	459959215	/nfs/dbraw/zinc/95/92/15/459959215.db2.gz	IYPQLASIJGSTQT-GOEBONIOSA-N	0	3	334.460	3.435	20	30		EGEDHN
Cc1c([C@@H](C)NC[C@H](O)CC(C)(C)C#N)cnn1-c1ccc(F)cc1	ZINC000598602066	459961526	/nfs/dbraw/zinc/96/15/26/459961526.db2.gz	KWDHRECJGYEKSN-CXAGYDPISA-N	0	3	344.434	3.271	20	30		EGEDHN
CC(C)CN(Cc1ccc(C#N)cc1)C(=O)[C@@H]1CNCc2ccccc21	ZINC000602530106	459985197	/nfs/dbraw/zinc/98/51/97/459985197.db2.gz	ORHJFUZMGMEDJE-OAQYLSRUSA-N	0	3	347.462	3.430	20	30		EGEDHN
COc1ccccc1SC[C@@H](C)CNCc1cccc(C#N)n1	ZINC000602540420	459990911	/nfs/dbraw/zinc/99/09/11/459990911.db2.gz	PFGDGSBNZNLJRJ-AWEZNQCLSA-N	0	3	327.453	3.480	20	30		EGEDHN
CC(C#N)C(=O)N1CC2(CCCC2)c2cc3c(cc2[C@H]1C)OCCO3	ZINC000609620024	459995914	/nfs/dbraw/zinc/99/59/14/459995914.db2.gz	ASPRQUVZRDQIKP-ZIAGYGMSSA-N	0	3	340.423	3.332	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CNCc1cc(Cl)cc(Br)c1	ZINC000598727513	460008743	/nfs/dbraw/zinc/00/87/43/460008743.db2.gz	JBNGVSASKYDZFO-ZDUSSCGKSA-N	0	3	345.668	3.493	20	30		EGEDHN
N#Cc1ccc(CN[C@@H](Cc2ccccc2)[C@@H](O)C(F)(F)F)cc1	ZINC000609707682	460009116	/nfs/dbraw/zinc/00/91/16/460009116.db2.gz	RXMXNHWOWWDVBC-DLBZAZTESA-N	0	3	334.341	3.182	20	30		EGEDHN
Cc1cc(N2CCN(C)C[C@H]2C(C)C)n2c3ccccc3nc2c1C#N	ZINC000609965715	460042062	/nfs/dbraw/zinc/04/20/62/460042062.db2.gz	QSGSJDOQQUSCKA-IBGZPJMESA-N	0	3	347.466	3.444	20	30		EGEDHN
Cc1cc(N2CCN(C)C[C@@H]2C(C)C)n2c3ccccc3nc2c1C#N	ZINC000609965720	460042949	/nfs/dbraw/zinc/04/29/49/460042949.db2.gz	QSGSJDOQQUSCKA-LJQANCHMSA-N	0	3	347.466	3.444	20	30		EGEDHN
N#Cc1cccc(CN[C@]2(Cc3ccc(Cl)cc3)CCOC2)n1	ZINC000602659838	460048605	/nfs/dbraw/zinc/04/86/05/460048605.db2.gz	XROBSVIWOIYQEJ-SFHVURJKSA-N	0	3	327.815	3.098	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@@H](C)[C@H](CO)SC)cc1OC	ZINC000598963222	460105830	/nfs/dbraw/zinc/10/58/30/460105830.db2.gz	AWEYSGVFPOBVBU-NHYWBVRUSA-N	0	3	345.892	3.115	20	30		EGEDHN
CCO[C@@H]1C[C@H](N[C@@H](C)C(=O)Nc2cccc(C#N)c2)C12CCCC2	ZINC000610345024	460126601	/nfs/dbraw/zinc/12/66/01/460126601.db2.gz	USLAIQHDNLGSHN-JCGIZDLHSA-N	0	3	341.455	3.213	20	30		EGEDHN
N#CCC1(CN2CCC[C@@H](C(=O)Nc3ccc(Cl)cn3)C2)CC1	ZINC000602790377	460127087	/nfs/dbraw/zinc/12/70/87/460127087.db2.gz	DQBCMZWPIWXPMU-CYBMUJFWSA-N	0	3	332.835	3.079	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCC(C(=O)Nc2ccc(O)cc2)CC1	ZINC000614403025	460130136	/nfs/dbraw/zinc/13/01/36/460130136.db2.gz	YPAKBPIECWOGGZ-UHFFFAOYSA-N	0	3	349.434	3.423	20	30		EGEDHN
C[C@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccc(S(C)(=O)=O)cc1	ZINC000618807901	460184325	/nfs/dbraw/zinc/18/43/25/460184325.db2.gz	XXTLDDQCUPLHBC-ORAYPTAESA-N	0	3	340.448	3.300	20	30		EGEDHN
C[C@H](CCC#N)N(C)C[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000602924558	460188130	/nfs/dbraw/zinc/18/81/30/460188130.db2.gz	FNTUXBYVQSOZAC-RISCZKNCSA-N	0	3	331.243	3.357	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)C(=O)N1CCN(C2CCC2)C[C@@H](C)C1	ZINC000594363256	460196615	/nfs/dbraw/zinc/19/66/15/460196615.db2.gz	OXXAHBJXKYOSRZ-IAGOWNOFSA-N	0	3	339.483	3.070	20	30		EGEDHN
CN(C)CCN(C(=O)N[C@H]1CCc2cc(C#N)ccc21)C1CCCC1	ZINC000618853377	460197965	/nfs/dbraw/zinc/19/79/65/460197965.db2.gz	JVTLLGVZBOPXHI-IBGZPJMESA-N	0	3	340.471	3.061	20	30		EGEDHN
N#Cc1ccc(SCC(=O)N[C@H]2CCN(C3CCCCC3)C2)cc1	ZINC000598220460	460209996	/nfs/dbraw/zinc/20/99/96/460209996.db2.gz	PMKQPBLHPDEXJM-INIZCTEOSA-N	0	3	343.496	3.174	20	30		EGEDHN
N#CCCCC[C@H](N)C(=O)Nc1ccccc1NCC(F)(F)F	ZINC000594440242	460221754	/nfs/dbraw/zinc/22/17/54/460221754.db2.gz	ARLVWMBFJUFNNH-NSHDSACASA-N	0	3	328.338	3.011	20	30		EGEDHN
CC(C)[C@H](NC[C@@H](O)COc1ccccc1C#N)c1ccc(F)cc1	ZINC000599312484	460226931	/nfs/dbraw/zinc/22/69/31/460226931.db2.gz	UTNVBZZOPKKFNA-QUCCMNQESA-N	0	3	342.414	3.424	20	30		EGEDHN
C[C@@H](NC1CCN(CC#N)CC1)c1nc(-c2ccccc2)cs1	ZINC000610814010	460242250	/nfs/dbraw/zinc/24/22/50/460242250.db2.gz	YRHMOMHQQTYICG-CQSZACIVSA-N	0	3	326.469	3.449	20	30		EGEDHN
CCN(Cc1c[nH]c2ccccc12)C[C@H](O)COc1ccccc1C#N	ZINC000599382900	460243604	/nfs/dbraw/zinc/24/36/04/460243604.db2.gz	VCLMXQIKADEIQR-SFHVURJKSA-N	0	3	349.434	3.301	20	30		EGEDHN
C/C(=C/c1ccccc1)CN(C)C[C@H](O)COc1ccccc1C#N	ZINC000599388290	460244244	/nfs/dbraw/zinc/24/42/44/460244244.db2.gz	GFDLQWALKWISRZ-PGNDWZGLSA-N	0	3	336.435	3.333	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)Nc2ccnc(C#N)c2)CCN1Cc1ccccc1	ZINC000603132907	460250337	/nfs/dbraw/zinc/25/03/37/460250337.db2.gz	ZVMKHNXDTBUWJZ-YJBOKZPZSA-N	0	3	349.438	3.128	20	30		EGEDHN
CC#CC[C@H](CO)NCc1cccc(OCc2ccccc2C#N)c1	ZINC000603434095	460304220	/nfs/dbraw/zinc/30/42/20/460304220.db2.gz	ZRTNCLDTGSIYKN-HXUWFJFHSA-N	0	3	334.419	3.001	20	30		EGEDHN
C[C@H](NCCC(=O)Nc1ccccc1[N+](=O)[O-])c1cccc(C#N)c1	ZINC000611388896	460351238	/nfs/dbraw/zinc/35/12/38/460351238.db2.gz	UHCJXKYPUCOWRA-ZDUSSCGKSA-N	0	3	338.367	3.146	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2NCCC(=O)NCc1ccccc1	ZINC000611392369	460354022	/nfs/dbraw/zinc/35/40/22/460354022.db2.gz	NUMHOJIOETWEPE-HXUWFJFHSA-N	0	3	333.435	3.232	20	30		EGEDHN
Cc1cccc(C(C)(C)NC[C@H](O)COc2ccc(CC#N)cc2)c1	ZINC000611396299	460355138	/nfs/dbraw/zinc/35/51/38/460355138.db2.gz	IESYJYQHTXQCJA-IBGZPJMESA-N	0	3	338.451	3.326	20	30		EGEDHN
N#Cc1ccccc1OCCN1C[C@@H]2CN(c3ccccc3)C[C@H]2C1	ZINC000604271979	460398983	/nfs/dbraw/zinc/39/89/83/460398983.db2.gz	ZYEKNOKXPBWYOE-RTBURBONSA-N	0	3	333.435	3.005	20	30		EGEDHN
C[C@H](CN1CCC[C@@H](C)C1)NC(=O)NCc1ccc(C#N)c(Cl)c1	ZINC000619759483	460434366	/nfs/dbraw/zinc/43/43/66/460434366.db2.gz	NKGCIOSNXDDZNV-ZIAGYGMSSA-N	0	3	348.878	3.131	20	30		EGEDHN
C[C@H](CN1CCC[C@H](C)C1)NC(=O)NCc1ccc(C#N)c(Cl)c1	ZINC000619759481	460434574	/nfs/dbraw/zinc/43/45/74/460434574.db2.gz	NKGCIOSNXDDZNV-UONOGXRCSA-N	0	3	348.878	3.131	20	30		EGEDHN
N#Cc1ccc(CNC(=O)NC[C@H]2CCCCN2C2CC2)cc1Cl	ZINC000619761198	460434815	/nfs/dbraw/zinc/43/48/15/460434815.db2.gz	VSYBQIYTHRZUCE-MRXNPFEDSA-N	0	3	346.862	3.028	20	30		EGEDHN
C=CC[C@@H]1CCN(C(=O)[C@@H]2CN(C(C)(C)C)C[C@H]2C(F)(F)F)C1	ZINC000628491528	460440097	/nfs/dbraw/zinc/44/00/97/460440097.db2.gz	AFJCYSJKXDITOG-MGPQQGTHSA-N	0	3	332.410	3.320	20	30		EGEDHN
N#CCc1ccccc1C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000601540815	460827739	/nfs/dbraw/zinc/82/77/39/460827739.db2.gz	KSOVLTIZMFADGX-GOSISDBHSA-N	0	3	333.435	3.005	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CC[C@H]2c2cccc(F)c2)CC1	ZINC000608426156	461059864	/nfs/dbraw/zinc/05/98/64/461059864.db2.gz	FPRYZLUDLLZKDB-SFHVURJKSA-N	0	3	331.435	3.323	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1S[C@@H](C)C#CCC	ZINC000665685892	461206883	/nfs/dbraw/zinc/20/68/83/461206883.db2.gz	YINDEPHPDCCGPY-INIZCTEOSA-N	0	3	332.517	3.387	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cccc(N3CCCC3)c2)CC1	ZINC000668370010	461259764	/nfs/dbraw/zinc/25/97/64/461259764.db2.gz	KUHYISUUUXZMOB-UHFFFAOYSA-N	0	3	327.472	3.057	20	30		EGEDHN
CC#CC[C@H](CO)NCc1c(C)nn(Cc2ccc(Cl)cc2)c1C	ZINC000641768516	461361472	/nfs/dbraw/zinc/36/14/72/461361472.db2.gz	BCJPDJHHCPXCIP-GOSISDBHSA-N	0	3	345.874	3.066	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc3ccc(OC)cc3s2)CC1	ZINC000630942472	461427134	/nfs/dbraw/zinc/42/71/34/461427134.db2.gz	JTYYIZJMLFJOGU-UHFFFAOYSA-N	0	3	330.453	3.290	20	30		EGEDHN
C[C@H](CNC(=O)Nc1cccc(C#Cc2cccs2)c1)N(C)C	ZINC000642480197	461516903	/nfs/dbraw/zinc/51/69/03/461516903.db2.gz	ATQLIWZNDPTXSW-CQSZACIVSA-N	0	3	327.453	3.220	20	30		EGEDHN
C=C(C)COc1cc(CNCc2ccc(CO)cc2)ccc1OC	ZINC000647229407	461575198	/nfs/dbraw/zinc/57/51/98/461575198.db2.gz	HXMMXPGNJFJCDM-UHFFFAOYSA-N	0	3	327.424	3.432	20	30		EGEDHN
C=CC[C@H]1CCCN(C(=O)NCc2ccccc2OCCN(C)C)C1	ZINC000660513619	461825159	/nfs/dbraw/zinc/82/51/59/461825159.db2.gz	UVOUASMYFFIHPD-KRWDZBQOSA-N	0	3	345.487	3.125	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC[C@@]2(c3ccccc3)CC2(C)C)CC1	ZINC000660703818	461930375	/nfs/dbraw/zinc/93/03/75/461930375.db2.gz	HTFFWCSTELYTLU-OAQYLSRUSA-N	0	3	341.499	3.304	20	30		EGEDHN
C=CCN(CCc1ccco1)C(=O)N[C@@H]1CCCN2CCCC[C@H]12	ZINC000654731986	462359343	/nfs/dbraw/zinc/35/93/43/462359343.db2.gz	QIVJFMKVYUGFFZ-QZTJIDSGSA-N	0	3	331.460	3.037	20	30		EGEDHN
C=CCN(CC(=O)N[C@H](C)c1cc(OC)ccc1OC)C(C)(C)C	ZINC000661755199	462399648	/nfs/dbraw/zinc/39/96/48/462399648.db2.gz	IWHCJOHGMBHAHS-CQSZACIVSA-N	0	3	334.460	3.168	20	30		EGEDHN
Cc1cccc(C(=O)N(CCN(C)C)Cc2cccc(C#N)c2)c1F	ZINC000178053071	534586996	/nfs/dbraw/zinc/58/69/96/534586996.db2.gz	WAQOAKDOBXYYPR-UHFFFAOYSA-N	0	3	339.414	3.210	20	30		EGEDHN
C=CCN1CCC(NC(=O)CCCOc2ccc(C)cc2C)CC1	ZINC000178114775	526419814	/nfs/dbraw/zinc/41/98/14/526419814.db2.gz	NBJCDQRNIMWUNN-UHFFFAOYSA-N	0	3	330.472	3.229	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCC(C)(C)c2ccccc2F)CC1	ZINC000171730625	526433034	/nfs/dbraw/zinc/43/30/34/526433034.db2.gz	ZAXDPRVZAQLABD-UHFFFAOYSA-N	0	3	333.451	3.053	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(C)cc2Br)CC1	ZINC000179054556	526448225	/nfs/dbraw/zinc/44/82/25/526448225.db2.gz	RPFSCBINKHULPP-UHFFFAOYSA-N	0	3	337.261	3.138	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@H]1NCc1ccc(C#N)o1	ZINC000174565567	526469922	/nfs/dbraw/zinc/46/99/22/526469922.db2.gz	DKMBMXQZQCMMBS-XJKSGUPXSA-N	0	3	333.432	3.324	20	30		EGEDHN
C#CCCCCNC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000154948161	526696334	/nfs/dbraw/zinc/69/63/34/526696334.db2.gz	QELNHKCYRMQJFR-LJQANCHMSA-N	0	3	327.472	3.096	20	30		EGEDHN
C/C=C(\C=C\C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1)CC	ZINC000153650822	527566248	/nfs/dbraw/zinc/56/62/48/527566248.db2.gz	ZCNNOKHHTPSWBW-HMFOTLHISA-N	0	3	325.456	3.361	20	30		EGEDHN
CCOc1ccc(CNCc2ccc(OC)c(C#N)c2)cc1OC	ZINC000174266956	528457912	/nfs/dbraw/zinc/45/79/12/528457912.db2.gz	FBTPRRLSGNMGBI-UHFFFAOYSA-N	0	3	326.396	3.264	20	30		EGEDHN
CC[C@@H](c1ccncc1)N(C)CCOc1ccc(C#N)cc1OC	ZINC000130274676	529259937	/nfs/dbraw/zinc/25/99/37/529259937.db2.gz	JRFRPOPOXOEZMZ-KRWDZBQOSA-N	0	3	325.412	3.424	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)c1cccc2c1CCC2	ZINC000171945060	535861986	/nfs/dbraw/zinc/86/19/86/535861986.db2.gz	FPLDATWEXDJJHA-UHFFFAOYSA-N	0	3	347.462	3.251	20	30		EGEDHN
CN(C)CCOC1CCN(c2ccc(C(F)(F)F)c(C#N)c2)CC1	ZINC000361704219	535893370	/nfs/dbraw/zinc/89/33/70/535893370.db2.gz	FXKRTBZVABLZHM-UHFFFAOYSA-N	0	3	341.377	3.124	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H]2C[C@@H](OCC)C23CCCCC3)CC1	ZINC000078959141	546591356	/nfs/dbraw/zinc/59/13/56/546591356.db2.gz	HWINUEQVEXJQBV-QZTJIDSGSA-N	0	3	349.519	3.064	20	30		EGEDHN
CCN1CCCC[C@H]1CNC(=O)Nc1ccc(N2CCCC2=O)cc1	ZINC000329451457	547498443	/nfs/dbraw/zinc/49/84/43/547498443.db2.gz	NCDWSJHIWXNDTJ-KRWDZBQOSA-N	0	3	344.459	3.014	20	30		EGEDHN
N#C[C@@H]1CCC[C@H](N[C@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)C1	ZINC000329574606	547502036	/nfs/dbraw/zinc/50/20/36/547502036.db2.gz	ASLSDXNCHDDJFD-AGIUHOORSA-N	0	3	335.810	3.256	20	30		EGEDHN
N#C[C@@H]1CCC[C@@H]1NC(=O)NCCN1CCC2(CCCCC2)CC1	ZINC000333029002	547527593	/nfs/dbraw/zinc/52/75/93/547527593.db2.gz	BTUZRPUREJOJDA-IRXDYDNUSA-N	0	3	332.492	3.024	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@@H](C)N1CCC2(CCOC2)CC1	ZINC000677719149	549317349	/nfs/dbraw/zinc/31/73/49/549317349.db2.gz	BSHBISGLSZIDNO-MRXNPFEDSA-N	0	3	348.512	3.154	20	30		EGEDHN
C#Cc1cccc(NC(=S)NCCCN(C)Cc2ccccc2)c1	ZINC000726447006	574554185	/nfs/dbraw/zinc/55/41/85/574554185.db2.gz	OYXCWMUGNQXBKE-UHFFFAOYSA-N	0	3	337.492	3.476	20	30		EGEDHN
CC1CCN(CCNC(=S)Nc2ccc(C#N)c(Cl)c2)CC1	ZINC000726460585	574557134	/nfs/dbraw/zinc/55/71/34/574557134.db2.gz	KJGVIMZURYEFST-UHFFFAOYSA-N	0	3	336.892	3.230	20	30		EGEDHN
C[C@H](CN1CCCCC1)NC(=S)Nc1ccc(C#N)c(Cl)c1	ZINC000726463274	574557328	/nfs/dbraw/zinc/55/73/28/574557328.db2.gz	SNYTXDSKMKEESG-GFCCVEGCSA-N	0	3	336.892	3.372	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)NC[C@@H](C)N1CCCCC1	ZINC000727225475	574654971	/nfs/dbraw/zinc/65/49/71/574654971.db2.gz	AFPAIGYFKSYCNT-QGZVFWFLSA-N	0	3	342.487	3.353	20	30		EGEDHN
C=C(CNCc1ccc(N2CCOCC2)c(F)c1)c1ccccc1	ZINC000727468758	574669856	/nfs/dbraw/zinc/66/98/56/574669856.db2.gz	QKYGFCOMKWPPSR-UHFFFAOYSA-N	0	3	326.415	3.465	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(Cl)nc3ccccc32)CC1	ZINC000729977497	574900764	/nfs/dbraw/zinc/90/07/64/574900764.db2.gz	QNXPSQISQASKNU-UHFFFAOYSA-N	0	3	329.831	3.268	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)CO[C@H]2CCC[C@@H](C)C2)c1	ZINC000733053060	575303752	/nfs/dbraw/zinc/30/37/52/575303752.db2.gz	INSSIBAEPIYPRB-HYVNUMGLSA-N	0	3	328.412	3.238	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(F)c(Cl)c1)C(=O)C1CCSCC1	ZINC000733053646	575303806	/nfs/dbraw/zinc/30/38/06/575303806.db2.gz	PYQADKQDSMFBCN-LLVKDONJSA-N	0	3	340.807	3.270	20	30		EGEDHN
Cc1nc(CCC(=O)C(C#N)C(=O)Nc2ccccc2Cl)cs1	ZINC000733678839	575381368	/nfs/dbraw/zinc/38/13/68/575381368.db2.gz	KZJRHZVWVOZJMY-GFCCVEGCSA-N	0	3	347.827	3.385	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)Cc3ccc([N+](=O)[O-])cc3)nc21	ZINC000735788011	575713070	/nfs/dbraw/zinc/71/30/70/575713070.db2.gz	BCMPNRIWENNURG-CQSZACIVSA-N	0	3	334.335	3.199	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)[C@H]3COc4ccccc4C3)nc21	ZINC000735792355	575714950	/nfs/dbraw/zinc/71/49/50/575714950.db2.gz	KVZYWBBNHUPUPK-HUUCEWRRSA-N	0	3	331.375	3.299	20	30		EGEDHN
C=C(C)CNC(=S)Nc1ccc(OCCN2CCCC2)c(C)c1	ZINC000735982527	575743676	/nfs/dbraw/zinc/74/36/76/575743676.db2.gz	CYLXMWUMHLZMQH-UHFFFAOYSA-N	0	3	333.501	3.332	20	30		EGEDHN
COCC#CCN[C@@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000678756308	576170499	/nfs/dbraw/zinc/17/04/99/576170499.db2.gz	BRAGWXLLULZKGI-HNNXBMFYSA-N	0	3	340.398	3.378	20	30		EGEDHN
C#CCOc1ccccc1CNCCc1ccc(NC(=O)OC)cc1	ZINC000738436819	576325955	/nfs/dbraw/zinc/32/59/55/576325955.db2.gz	ZQVWWIZHCPYLIW-UHFFFAOYSA-N	0	3	338.407	3.209	20	30		EGEDHN
C#CCCN1CCC(NC(=O)COc2cc(C)ccc2C(C)C)CC1	ZINC000740735326	576621346	/nfs/dbraw/zinc/62/13/46/576621346.db2.gz	ABDFQHFDHQZYIV-UHFFFAOYSA-N	0	3	342.483	3.101	20	30		EGEDHN
C#CCCN1CCC(NC(=O)Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000740737471	576621698	/nfs/dbraw/zinc/62/16/98/576621698.db2.gz	OJKKXMSXEVRJQX-UHFFFAOYSA-N	0	3	339.266	3.140	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/C[C@H](CC(C)C)C(=O)OC)c([O-])c1	ZINC000741463197	576687936	/nfs/dbraw/zinc/68/79/36/576687936.db2.gz	ASGRXPRBCVYOTQ-DORSJAEJSA-N	0	3	334.460	3.493	20	30		EGEDHN
C#CCCN1CCC(NC(=O)Cc2cc(Cl)ccc2Cl)CC1	ZINC000743493389	576810393	/nfs/dbraw/zinc/81/03/93/576810393.db2.gz	QMFICCHPYRUIPC-UHFFFAOYSA-N	0	3	339.266	3.140	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCC(CC)(CC)SC)CC1	ZINC000743597545	576812869	/nfs/dbraw/zinc/81/28/69/576812869.db2.gz	IGHOVBVXVHRTPF-UHFFFAOYSA-N	0	3	327.538	3.248	20	30		EGEDHN
C=CC[N@H+](Cc1cccc(-c2nnn[n-]2)c1)C[C@@H]1CCO[C@H](CC)C1	ZINC000823914729	609170790	/nfs/dbraw/zinc/17/07/90/609170790.db2.gz	MREIXNOJFDXNQH-SJLPKXTDSA-N	0	3	341.459	3.060	20	30		EGEDHN
C=CC[N@@H+](Cc1cccc(-c2nnn[n-]2)c1)C[C@@H]1CCO[C@H](CC)C1	ZINC000823914729	609170791	/nfs/dbraw/zinc/17/07/91/609170791.db2.gz	MREIXNOJFDXNQH-SJLPKXTDSA-N	0	3	341.459	3.060	20	30		EGEDHN
C=CC[N@H+](Cc1cccc(-c2nn[n-]n2)c1)C[C@@H]1CCO[C@H](CC)C1	ZINC000823914729	609170793	/nfs/dbraw/zinc/17/07/93/609170793.db2.gz	MREIXNOJFDXNQH-SJLPKXTDSA-N	0	3	341.459	3.060	20	30		EGEDHN
C=CC[N@@H+](Cc1cccc(-c2nn[n-]n2)c1)C[C@@H]1CCO[C@H](CC)C1	ZINC000823914729	609170794	/nfs/dbraw/zinc/17/07/94/609170794.db2.gz	MREIXNOJFDXNQH-SJLPKXTDSA-N	0	3	341.459	3.060	20	30		EGEDHN
N#CC(C(=O)CCCc1nnc(-c2ccccc2)o1)c1ccccn1	ZINC000049458665	1291628842	/nfs/dbraw/zinc/62/88/42/1291628842.db2.gz	FAYMJURGNYNUBB-HNNXBMFYSA-N	0	3	332.363	3.331	20	30		EGEDHN
Cc1ccc(CCC(=O)C(C#N)C(=O)NC2CCCCC2)c(C)c1	ZINC000050680255	1291655208	/nfs/dbraw/zinc/65/52/08/1291655208.db2.gz	CACSRLWKTMMJBE-SFHVURJKSA-N	0	3	326.440	3.394	20	30		EGEDHN
CCCC(=O)N1CCC[C@@H]1C(=O)C(C#N)c1nc(C(C)C)cs1	ZINC000080451724	1292603844	/nfs/dbraw/zinc/60/38/44/1292603844.db2.gz	KPMFLKMDHIPINZ-GXTWGEPZSA-N	0	3	333.457	3.234	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC(=O)Nc1ccc(N(CC)C(C)C)cc1	ZINC000831822835	1292922829	/nfs/dbraw/zinc/92/28/29/1292922829.db2.gz	JLXPFZMYNLFYJB-MOPGFXCFSA-N	0	3	345.487	3.183	20	30		EGEDHN
CS[C@H](C)C(=O)C(C#N)C(=O)Nc1ccc(SC(F)F)cc1	ZINC000103329900	1293002366	/nfs/dbraw/zinc/00/23/66/1293002366.db2.gz	XBTJZMNPMUOPII-LDYMZIIASA-N	0	3	344.408	3.400	20	30		EGEDHN
N#Cc1ccc(CN[C@H](Cc2ccccc2Cl)[C@@H]2CCCO2)nc1	ZINC000834773928	1293145345	/nfs/dbraw/zinc/14/53/45/1293145345.db2.gz	LSCGLALTUKGHCH-MOPGFXCFSA-N	0	3	341.842	3.487	20	30		EGEDHN
C[C@@H](COc1cccc(C#N)c1)OC(=O)c1cccc(CN(C)C)c1	ZINC000835161454	1293223109	/nfs/dbraw/zinc/22/31/09/1293223109.db2.gz	QLBRVJKEYQBQNJ-HNNXBMFYSA-N	0	3	338.407	3.244	20	30		EGEDHN
C[C@H](Oc1ccccn1)C(=O)C(C#N)c1cc(C(F)(F)F)ccn1	ZINC000835454243	1293294425	/nfs/dbraw/zinc/29/44/25/1293294425.db2.gz	GGWVOIRRVLXVAF-JQWIXIFHSA-N	0	3	335.285	3.139	20	30		EGEDHN
C#CCCOc1ccc(CNC(C)(C)C(=O)NCC(C)(C)C)cc1	ZINC000121094108	1293355585	/nfs/dbraw/zinc/35/55/85/1293355585.db2.gz	IIAGQHKBGQDEGY-UHFFFAOYSA-N	0	3	330.472	3.119	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN1CCCCC[C@H]1C[C@H](O)c1ccco1	ZINC000121790482	1293390309	/nfs/dbraw/zinc/39/03/09/1293390309.db2.gz	ZLUJTQNWBGNBCH-ROUUACIJSA-N	0	3	346.471	3.148	20	30		EGEDHN
Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)C(C#N)C(=O)N2CCCC2)c1	ZINC000124815136	1293486170	/nfs/dbraw/zinc/48/61/70/1293486170.db2.gz	XBFJAJVLDVUBTC-DOTOQJQBSA-N	0	3	342.439	3.217	20	30		EGEDHN
N#CC(C(=O)CCc1ccc(Cl)s1)C(=O)Nc1ccccn1	ZINC000125260229	1293502386	/nfs/dbraw/zinc/50/23/86/1293502386.db2.gz	CAVXLCXMONAWIU-LLVKDONJSA-N	0	3	333.800	3.077	20	30		EGEDHN
N#CC(C(=O)CCCc1cccs1)C(=O)NCc1ccccc1	ZINC000126685650	1293541862	/nfs/dbraw/zinc/54/18/62/1293541862.db2.gz	FXLVCGGNVYRRQA-INIZCTEOSA-N	0	3	326.421	3.096	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)c1ccc(C)s1	ZINC000128900241	1293607532	/nfs/dbraw/zinc/60/75/32/1293607532.db2.gz	XXJMKPIMKTZDTQ-GFCCVEGCSA-N	0	3	328.393	3.416	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(Cl)cc1Cl)C(=O)C1CCOCC1	ZINC000129670004	1293629887	/nfs/dbraw/zinc/62/98/87/1293629887.db2.gz	UZXQOFPBAGOXOH-NSHDSACASA-N	0	3	341.194	3.067	20	30		EGEDHN
CC(C)c1cc(C(=O)C(C#N)C(=O)Nc2ccc(F)c(Cl)c2)n[nH]1	ZINC000130232995	1293649639	/nfs/dbraw/zinc/64/96/39/1293649639.db2.gz	QIBWQPCYOXGWBV-JTQLQIEISA-N	0	3	348.765	3.287	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1)C(=O)c1cc(Cl)cc([N+](=O)[O-])c1	ZINC000131006143	1293675846	/nfs/dbraw/zinc/67/58/46/1293675846.db2.gz	LBXNZFQZNIEWRM-AWEZNQCLSA-N	0	3	343.726	3.209	20	30		EGEDHN
Cc1ccc(N(CCC#N)C(=O)[C@@H](C)N2C[C@@H]3CCC[C@@H]3C2)cc1	ZINC000152848864	1293987262	/nfs/dbraw/zinc/98/72/62/1293987262.db2.gz	QLTNPLTTZKBZSE-KURKYZTESA-N	0	3	325.456	3.362	20	30		EGEDHN
CC(C)N1CCN(c2ccc(C(=O)O[C@@H](C#N)C(C)(C)C)cc2)CC1	ZINC000154472653	1294057069	/nfs/dbraw/zinc/05/70/69/1294057069.db2.gz	ZBVKZJXVPOTGRZ-SFHVURJKSA-N	0	3	343.471	3.312	20	30		EGEDHN
[NH2+]=C(NCc1ccc([O-])c(F)c1)Nc1ccccc1OC(F)(F)F	ZINC000160738539	1294276632	/nfs/dbraw/zinc/27/66/32/1294276632.db2.gz	LPYYAHMZNRDMOG-UHFFFAOYSA-N	0	3	343.280	3.357	20	30		EGEDHN
C[C@@H](CCOc1ccccc1)C(=O)C(C#N)C(=O)Nc1ccccc1	ZINC000173968253	1294474826	/nfs/dbraw/zinc/47/48/26/1294474826.db2.gz	YUBYLPYMXQYZDJ-YJBOKZPZSA-N	0	3	336.391	3.439	20	30		EGEDHN
C#CCN(C[C@@H](O)COCc1cccs1)[C@@H]1CCc2ccccc21	ZINC000175121048	1294540537	/nfs/dbraw/zinc/54/05/37/1294540537.db2.gz	JFILJHRSDMAIJM-YLJYHZDGSA-N	0	3	341.476	3.248	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cccc(C(F)(F)F)n2)CC1	ZINC000181880552	1295001714	/nfs/dbraw/zinc/00/17/14/1295001714.db2.gz	FXKNACHBGIIHDF-UHFFFAOYSA-N	0	3	342.365	3.262	20	30		EGEDHN
C[C@H](Oc1ccccc1)C(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1	ZINC000193392380	1295863203	/nfs/dbraw/zinc/86/32/03/1295863203.db2.gz	JVRSDKKOIOVWCL-BLLLJJGKSA-N	0	3	342.782	3.455	20	30		EGEDHN
N#CC(C(=O)COCC1CC1)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000193481929	1295875327	/nfs/dbraw/zinc/87/53/27/1295875327.db2.gz	KBXIOXQVTRJMSM-CYBMUJFWSA-N	0	3	341.194	3.067	20	30		EGEDHN
CC[C@H](C)c1ccc(NC(=O)C(C#N)C(=O)[C@H]2CCCOC2)cc1	ZINC000246098266	1296336605	/nfs/dbraw/zinc/33/66/05/1296336605.db2.gz	IZUBECNOLRJXNN-JLJPHGGASA-N	0	3	328.412	3.274	20	30		EGEDHN
CC[C@H](C)c1ccc(NC(=O)C(C#N)C(=O)C[C@H]2CCCO2)cc1	ZINC000249727675	1296450831	/nfs/dbraw/zinc/45/08/31/1296450831.db2.gz	QZONXRVNYMZEGY-XKQJLSEDSA-N	0	3	328.412	3.417	20	30		EGEDHN
N#CCc1ccnc(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)c1	ZINC000871720640	1296500183	/nfs/dbraw/zinc/50/01/83/1296500183.db2.gz	KVVAZUZOBKMUKO-SFHVURJKSA-N	0	3	349.438	3.106	20	30		EGEDHN
N#CC(C(=O)C=CSCc1ccco1)c1nnc2n1CCCCC2	ZINC000255139140	1296502893	/nfs/dbraw/zinc/50/28/93/1296502893.db2.gz	PIOBBMMCOVPJLS-YHAOYDPOSA-N	0	3	342.424	3.221	20	30		EGEDHN
C#CCOc1ccccc1CNC[C@@H](NC(=O)OC(C)(C)C)C1CC1	ZINC000310637196	1297098494	/nfs/dbraw/zinc/09/84/94/1297098494.db2.gz	FFZYMWKYXFBQFW-QGZVFWFLSA-N	0	3	344.455	3.092	20	30		EGEDHN
C#CCOc1ccc(Br)cc1CNC[C@H]1CCC=CO1	ZINC000380014985	1297542568	/nfs/dbraw/zinc/54/25/68/1297542568.db2.gz	KLYKBGNFQSHLLU-OAHLLOKOSA-N	0	3	336.229	3.243	20	30		EGEDHN
C=C[C@@H](COC)N[C@H](C)c1ccc(I)cc1	ZINC000390507295	1297626128	/nfs/dbraw/zinc/62/61/28/1297626128.db2.gz	XTASAPYJYRNCSB-MFKMUULPSA-N	0	3	331.197	3.143	20	30		EGEDHN
C[C@H](NC(=O)/C=C\c1ccccc1C#N)[C@H](c1ccccc1)N(C)C	ZINC000588490416	1298073419	/nfs/dbraw/zinc/07/34/19/1298073419.db2.gz	WZOMXOPPZBSBBU-QUQBCWQSSA-N	0	3	333.435	3.379	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)C#Cc2ccccc2)N2CCCC2)cc1	ZINC000747371592	1298771436	/nfs/dbraw/zinc/77/14/36/1298771436.db2.gz	SZDCLJMMRNAIII-NRFANRHFSA-N	0	3	332.447	3.300	20	30		EGEDHN
C=C(Cl)C[C@@H](N)C(=O)N1CCCC[C@H]1Cc1ccc(OC)cc1	ZINC000876949576	1299083508	/nfs/dbraw/zinc/08/35/08/1299083508.db2.gz	ZBPOEOZRQIRUEC-DOTOQJQBSA-N	0	3	336.863	3.089	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](O)c2ccc(OC(F)(F)F)cc2)s1	ZINC000749110904	1299144905	/nfs/dbraw/zinc/14/49/05/1299144905.db2.gz	SURZKVPAGJQKRG-CQSZACIVSA-N	0	3	342.342	3.342	20	30		EGEDHN
CO[C@@H]1C[C@@H](N[C@@H](C)C(=O)N(CCC#N)c2ccc(C)cc2)C1(C)C	ZINC000753159063	1299885263	/nfs/dbraw/zinc/88/52/63/1299885263.db2.gz	WUBDAANOQIZNCN-CGTJXYLNSA-N	0	3	343.471	3.033	20	30		EGEDHN
CC(=O)[C@@](C#N)(CCN(C)CC1(O)CCCCCC1)c1ccccc1	ZINC000878465786	1300021058	/nfs/dbraw/zinc/02/10/58/1300021058.db2.gz	GJPGSYJYSLOYMT-NRFANRHFSA-N	0	3	342.483	3.444	20	30		EGEDHN
CC(=O)[C@](C#N)(CCN1CCCC[C@H]1C[C@H](C)O)c1ccccc1	ZINC000878532610	1300055714	/nfs/dbraw/zinc/05/57/14/1300055714.db2.gz	UQZLTWHFPQHOGH-FFZOFVMBSA-N	0	3	328.456	3.052	20	30		EGEDHN
C[C@H]1CN(C2CC2)CC1N=Nc1ncnc2sc3c(c21)CCC3	ZINC000755879509	1300407638	/nfs/dbraw/zinc/40/76/38/1300407638.db2.gz	HVRHTIYFWGZDQK-JTQLQIEISA-N	0	3	327.457	3.062	20	30		EGEDHN
C#CCOc1ccc(CN[C@H](C)c2ccc([S@@](C)=O)cc2)cc1	ZINC000756033356	1300430006	/nfs/dbraw/zinc/43/00/06/1300430006.db2.gz	LJEXJJJRTREEEL-IQMFZBJNSA-N	0	3	327.449	3.287	20	30		EGEDHN
Cc1cnn(CCCCCN2CCN(c3ccc(C#N)cc3)CC2)c1	ZINC000879586103	1300616027	/nfs/dbraw/zinc/61/60/27/1300616027.db2.gz	YRIHEXMWOPIYQY-UHFFFAOYSA-N	0	3	337.471	3.056	20	30		EGEDHN
C#CC[C@@H](NC(=O)NC[C@@H](Cc1ccccc1)N(C)C)c1ccccc1	ZINC000757605419	1300692869	/nfs/dbraw/zinc/69/28/69/1300692869.db2.gz	KXFNETXCGFXVAL-NHCUHLMSSA-N	0	3	349.478	3.223	20	30		EGEDHN
C#CC[C@H](NC(=O)N(CCN(C)C)C1CCCC1)c1ccccc1	ZINC000757765056	1300725947	/nfs/dbraw/zinc/72/59/47/1300725947.db2.gz	ZTQSHJMUJDZUDT-IBGZPJMESA-N	0	3	327.472	3.267	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CCN(Cc2ccc(OCC#N)cc2)CC1	ZINC000880247883	1301001938	/nfs/dbraw/zinc/00/19/38/1301001938.db2.gz	NBPUEHMJGIDOIS-SFHVURJKSA-N	0	3	335.451	3.468	20	30		EGEDHN
Cc1cc(C(=O)C(C#N)c2ccncn2)c(C)n1Cc1ccccc1	ZINC000760333645	1301254893	/nfs/dbraw/zinc/25/48/93/1301254893.db2.gz	LZFPHVATQZGCQK-GOSISDBHSA-N	0	3	330.391	3.433	20	30		EGEDHN
CCO[C@H](CC(=O)C(C#N)C(=O)Nc1ccccc1Cl)C(C)C	ZINC000761038026	1301386855	/nfs/dbraw/zinc/38/68/55/1301386855.db2.gz	PXNIFHWBAWDKDB-MLGOLLRUSA-N	0	3	336.819	3.439	20	30		EGEDHN
C#Cc1cccc(NC(=S)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)c1	ZINC000764933779	1302170393	/nfs/dbraw/zinc/17/03/93/1302170393.db2.gz	VJZCYRDUQKHOHT-OXQOHEQNSA-N	0	3	349.503	3.475	20	30		EGEDHN
C=CC[C@@H](N[C@H](C)c1ccc(NS(C)(=O)=O)cc1)c1ccncc1	ZINC000766019533	1302370795	/nfs/dbraw/zinc/37/07/95/1302370795.db2.gz	MGVPPCWXQMBKCX-RDTXWAMCSA-N	0	3	345.468	3.421	20	30		EGEDHN
C#CCCCN[C@H](C)c1nnn(-c2cccc(Br)c2)c1C	ZINC000766223528	1302412651	/nfs/dbraw/zinc/41/26/51/1302412651.db2.gz	QJBKCZMRRSKUKR-GFCCVEGCSA-N	0	3	347.260	3.402	20	30		EGEDHN
N#C[C@@H]1CNCC12CC(C(=O)N[C@H](c1ccccc1)C1CCCC1)C2	ZINC000884095751	1302730734	/nfs/dbraw/zinc/73/07/34/1302730734.db2.gz	YEWQTIFZYDLGNR-XTBIFASLSA-N	0	3	337.467	3.173	20	30		EGEDHN
CCCCOc1ccc(NC(=O)C2CC3(C2)CNC[C@@H]3C#N)c(C)c1	ZINC000884097125	1302733250	/nfs/dbraw/zinc/73/32/50/1302733250.db2.gz	UZXXVZQUCHSFFM-NGEICVOHSA-N	0	3	341.455	3.252	20	30		EGEDHN
C=C(C)CNC(=S)Nc1cccc(N2CCN(C(C)C)CC2)c1	ZINC000767917286	1302784244	/nfs/dbraw/zinc/78/42/44/1302784244.db2.gz	VVOCPQPXNLKEJU-UHFFFAOYSA-N	0	3	332.517	3.080	20	30		EGEDHN
C=CC[N@@H+](CCc1ccccc1)Cc1cc2c(cc1[O-])OC[C@H]2O	ZINC000768439987	1302900811	/nfs/dbraw/zinc/90/08/11/1302900811.db2.gz	MSDATGVZVTZVCW-LJQANCHMSA-N	0	3	325.408	3.049	20	30		EGEDHN
C=CC[N@H+](CCc1ccccc1)Cc1cc2c(cc1[O-])OC[C@H]2O	ZINC000768439987	1302900820	/nfs/dbraw/zinc/90/08/20/1302900820.db2.gz	MSDATGVZVTZVCW-LJQANCHMSA-N	0	3	325.408	3.049	20	30		EGEDHN
CCCCCCN(CCN1CCOCC1)Cc1ccc(C#N)s1	ZINC000769105815	1303048428	/nfs/dbraw/zinc/04/84/28/1303048428.db2.gz	FCLQFUBRYSZNRG-UHFFFAOYSA-N	0	3	335.517	3.334	20	30		EGEDHN
N#CC(CCNC1(C(N)=O)CCCC1)(c1ccccc1)c1ccccc1	ZINC000769751149	1303170004	/nfs/dbraw/zinc/17/00/04/1303170004.db2.gz	FNZJAQBJSGHZGN-UHFFFAOYSA-N	0	3	347.462	3.274	20	30		EGEDHN
C[C@H](NC(=O)Cc1ccccc1CC#N)[C@H](c1ccccc1)N(C)C	ZINC000770046596	1303211809	/nfs/dbraw/zinc/21/18/09/1303211809.db2.gz	HPVFXTYSZLKCKI-HRAATJIYSA-N	0	3	335.451	3.103	20	30		EGEDHN
CCCCCCN(C)CC(=O)N[C@@]1(C#N)CCc2ccccc2C1	ZINC000771593228	1303423807	/nfs/dbraw/zinc/42/38/07/1303423807.db2.gz	YFBDLAUCZXDQPF-FQEVSTJZSA-N	0	3	327.472	3.066	20	30		EGEDHN
C=CCC1(O)CCN(C[C@H](O)COc2ccc(C(C)(C)C)cc2)CC1	ZINC000886757494	1303587121	/nfs/dbraw/zinc/58/71/21/1303587121.db2.gz	ISWYHTVRXWPOIW-SFHVURJKSA-N	0	3	347.499	3.127	20	30		EGEDHN
COc1cc2c(cc1O)CCN(CCCOc1cccc(C#N)c1)C2	ZINC000887105200	1303677806	/nfs/dbraw/zinc/67/78/06/1303677806.db2.gz	KPALHBQYPHPPHH-UHFFFAOYSA-N	0	3	338.407	3.100	20	30		EGEDHN
C=CC[C@H](CO)CNCc1c(C)nn(-c2ccc(F)cc2)c1Cl	ZINC000774827269	1303864378	/nfs/dbraw/zinc/86/43/78/1303864378.db2.gz	OBGLXOURQYZHBA-ZDUSSCGKSA-N	0	3	337.826	3.247	20	30		EGEDHN
C#CCN[C@H](C(=O)N1CCC(Cc2ccccc2)CC1)[C@H](C)CC	ZINC000775384142	1303952435	/nfs/dbraw/zinc/95/24/35/1303952435.db2.gz	CSTINESBQGQSEJ-XLIONFOSSA-N	0	3	326.484	3.105	20	30		EGEDHN
C#CC[C@H](NC[C@H](O)COc1cccc2[nH]ccc21)c1ccccc1	ZINC000775405075	1303958627	/nfs/dbraw/zinc/95/86/27/1303958627.db2.gz	VDEJPTAQCUXQNP-HKUYNNGSSA-N	0	3	334.419	3.262	20	30		EGEDHN
C#C[C@@H](NCc1c(-c2ccccc2)nc2ccccn21)[C@@H]1CCCO1	ZINC000775791619	1304037758	/nfs/dbraw/zinc/03/77/58/1304037758.db2.gz	WGMXGYXEOUUMDS-MJGOQNOKSA-N	0	3	331.419	3.272	20	30		EGEDHN
Clc1ccnc(NN=Cc2c(-n3ccnc3)nc3ccccn23)c1	ZINC000777907084	1304364351	/nfs/dbraw/zinc/36/43/51/1304364351.db2.gz	QYJYOJSYFNIYCL-UHFFFAOYSA-N	0	3	337.774	3.014	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CNCCCC(=O)N(CC)CC	ZINC000778157861	1304406194	/nfs/dbraw/zinc/40/61/94/1304406194.db2.gz	DZZBONHEOXWCGN-UHFFFAOYSA-N	0	3	336.863	3.090	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1Cl)C(=O)c1cccc(Cl)n1	ZINC000780306176	1304675005	/nfs/dbraw/zinc/67/50/05/1304675005.db2.gz	RJFWUABLDUITPA-VIFPVBQESA-N	0	3	334.162	3.350	20	30		EGEDHN
C#Cc1ccc(NC(=O)c2ccc(CN3CCC(CO)CC3)cc2)cc1	ZINC000891314643	1305014203	/nfs/dbraw/zinc/01/42/03/1305014203.db2.gz	WOEOXRMTLWDRDU-UHFFFAOYSA-N	0	3	348.446	3.125	20	30		EGEDHN
N#Cc1ccc(F)c(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)c1	ZINC000891454930	1305055079	/nfs/dbraw/zinc/05/50/79/1305055079.db2.gz	SVYZAYIQDWONHS-MNOVXSKESA-N	0	3	330.281	3.383	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)CCCc2ccsc2)c1	ZINC000783351158	1305083115	/nfs/dbraw/zinc/08/31/15/1305083115.db2.gz	UUVXROUEMXFLCQ-MRXNPFEDSA-N	0	3	342.420	3.427	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)[C@H](C)OCC(C)C)c1ccccc1	ZINC000787048050	1305684708	/nfs/dbraw/zinc/68/47/08/1305684708.db2.gz	YTLXJGGEAYLXEW-UAGQMJEPSA-N	0	3	330.428	3.024	20	30		EGEDHN
Cc1c(CC(=O)C(C#N)c2nc3ccccc3o2)cccc1[N+](=O)[O-]	ZINC000788080549	1305861533	/nfs/dbraw/zinc/86/15/33/1305861533.db2.gz	DNIAKYITPTTYAV-ZDUSSCGKSA-N	0	3	335.319	3.463	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C2(C)CCC(C)CC2)C1	ZINC001021111307	1318094278	/nfs/dbraw/zinc/09/42/78/1318094278.db2.gz	AGKHFXDHQHZBKJ-QJMLVPPDSA-N	0	3	343.309	3.348	20	30		EGEDHN
N#Cc1cccc(CN2CCC([NH2+]Cc3ccc([O-])c(F)c3)CC2)c1	ZINC000895189254	1309230534	/nfs/dbraw/zinc/23/05/34/1309230534.db2.gz	XSKUXHKYMHGZFC-UHFFFAOYSA-N	0	3	339.414	3.157	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1C#N	ZINC000799366799	1310537397	/nfs/dbraw/zinc/53/73/97/1310537397.db2.gz	SXZADLFLERUMGV-OXJNMPFZSA-N	0	3	333.435	3.117	20	30		EGEDHN
CCCCCCCS(=O)(=O)N1CCCC2(CCN(C)CC2)C1	ZINC000799821085	1310625456	/nfs/dbraw/zinc/62/54/56/1310625456.db2.gz	BGIPLHFIRUGYAG-UHFFFAOYSA-N	0	3	330.538	3.094	20	30		EGEDHN
N#CC1(CCCOC(=O)[C@@H]2CCCN2C2CCCC2)CCOCC1	ZINC000800219836	1310705228	/nfs/dbraw/zinc/70/52/28/1310705228.db2.gz	AJHYQMJDSDKFJZ-KRWDZBQOSA-N	0	3	334.460	3.037	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)[C@@H]2O[C@@H](C)C[C@H]2C)cc1	ZINC000800384769	1310747770	/nfs/dbraw/zinc/74/77/70/1310747770.db2.gz	JUXVBKNAIXGHSZ-QOIYZWAUSA-N	0	3	342.439	3.490	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N2C[C@@H](N(C)C)Cc3ccccc32)cc1	ZINC000823222487	1320162781	/nfs/dbraw/zinc/16/27/81/1320162781.db2.gz	LNFVJCFCKBFGRF-IBGZPJMESA-N	0	3	348.446	3.222	20	30		EGEDHN
C#C[C@H](NCCC(=O)Nc1ccccc1-c1ccccc1)[C@@H]1CCCO1	ZINC000839563274	1320938899	/nfs/dbraw/zinc/93/88/99/1320938899.db2.gz	GQLIQZMEHUUJCU-FPOVZHCZSA-N	0	3	348.446	3.453	20	30		EGEDHN
Cc1cc(C)nc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)c1	ZINC000802043271	1316975700	/nfs/dbraw/zinc/97/57/00/1316975700.db2.gz	VNRWZCMWPYQRAA-LBPRGKRZSA-N	0	3	327.771	3.313	20	30		EGEDHN
CCc1ccccc1[C@@H]1C[C@H]1C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000802047332	1316976266	/nfs/dbraw/zinc/97/62/66/1316976266.db2.gz	BHHGWSMHLWLLKL-BBWFWOEESA-N	0	3	333.391	3.095	20	30		EGEDHN
C=CCNc1ncc(C(=O)N(CCN(C)C)C2CCCCC2)s1	ZINC000900659015	1317320782	/nfs/dbraw/zinc/32/07/82/1317320782.db2.gz	LJKSMSWVMKIGDQ-UHFFFAOYSA-N	0	3	336.505	3.078	20	30		EGEDHN
C=C[C@H](C(=O)N1CC[C@H](NCc2cccnc2C)C1)c1ccccc1	ZINC001019804599	1317431695	/nfs/dbraw/zinc/43/16/95/1317431695.db2.gz	BXKAVTXCTQFPSN-PMACEKPBSA-N	0	3	335.451	3.050	20	30		EGEDHN
C#Cc1cccc(NC(=S)N[C@@H](CN(C)C)c2ccc(F)cc2)c1	ZINC000806595259	1317508489	/nfs/dbraw/zinc/50/84/89/1317508489.db2.gz	SUGGHWOVVHHAFL-SFHVURJKSA-N	0	3	341.455	3.396	20	30		EGEDHN
Cc1cscc1C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001020057839	1317523728	/nfs/dbraw/zinc/52/37/28/1317523728.db2.gz	MMWNDVADWZJILC-SHTZXODSSA-N	0	3	343.427	3.118	20	30		EGEDHN
CCN(Cc1ccccc1C#N)CC1CCN(C(=O)C2CC2)CC1	ZINC000957661466	1317531758	/nfs/dbraw/zinc/53/17/58/1317531758.db2.gz	WLTQGHWNWZDHJQ-UHFFFAOYSA-N	0	3	325.456	3.029	20	30		EGEDHN
CCN(Cc1ccc(F)cc1F)CC1CCN(C(=O)[C@H](C)C#N)CC1	ZINC000957690483	1317558729	/nfs/dbraw/zinc/55/87/29/1317558729.db2.gz	LVQRVYIYAQRPLR-CQSZACIVSA-N	0	3	349.425	3.185	20	30		EGEDHN
CC[C@@H](C)N[C@@H](CNC(=O)c1ccccc1OCC#N)c1ccco1	ZINC000807681016	1317577123	/nfs/dbraw/zinc/57/71/23/1317577123.db2.gz	YEVFRAHNTULEJE-ZBFHGGJFSA-N	0	3	341.411	3.041	20	30		EGEDHN
CN(C)C[C@@H](NC(=O)/C=C\c1ccccc1C#N)c1ccc(F)cc1	ZINC000807703517	1317578872	/nfs/dbraw/zinc/57/88/72/1317578872.db2.gz	IWZXOTQCJZYQST-UZRURVBFSA-N	0	3	337.398	3.130	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H]2CCCC[C@H]2C(F)(F)F)C1	ZINC001020256228	1317612088	/nfs/dbraw/zinc/61/20/88/1317612088.db2.gz	SCBOLYGCNSBUBA-FDYHWXHSSA-N	0	3	338.801	3.344	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2nc3ccccc3cc2C)C1	ZINC001020406346	1317682914	/nfs/dbraw/zinc/68/29/14/1317682914.db2.gz	RPWAZUVCWCTVGV-SHTZXODSSA-N	0	3	329.831	3.146	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ncoc2-c2cccs2)C1	ZINC001020767618	1317914753	/nfs/dbraw/zinc/91/47/53/1317914753.db2.gz	OFHZMIJNVXTQRX-XYPYZODXSA-N	0	3	337.832	3.006	20	30		EGEDHN
C=C(C)COc1cc(/C=C2\C(=O)c3ncnn3C2C)ccc1OC	ZINC000905080478	1317920357	/nfs/dbraw/zinc/92/03/57/1317920357.db2.gz	LFBINHWQHZGSTK-OBTCNRAFSA-N	0	3	325.368	3.083	20	30		EGEDHN
CC1/C(=C\c2ccc(N(C)C)cc2C(F)(F)F)C(=O)c2ncnn21	ZINC000905087390	1317922203	/nfs/dbraw/zinc/92/22/03/1317922203.db2.gz	XUDDYZRPNKKQLS-TZZQWBKVSA-N	0	3	336.317	3.204	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(F)c(Cl)c1)C(=O)[C@@H]1CCCSC1	ZINC000810531207	1318018095	/nfs/dbraw/zinc/01/80/95/1318018095.db2.gz	KDFAQAJPKHGKPM-KOLCDFICSA-N	0	3	340.807	3.270	20	30		EGEDHN
N#Cc1cccc(C(=O)OC[C@@H]2CCCCN2Cc2ccccc2)n1	ZINC000810835069	1318062720	/nfs/dbraw/zinc/06/27/20/1318062720.db2.gz	SZYJMASHEBDBFY-SFHVURJKSA-N	0	3	335.407	3.165	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C2(C)C(C)(C)C2(C)C)C1	ZINC001021143077	1318110478	/nfs/dbraw/zinc/11/04/78/1318110478.db2.gz	IOKLWTDDVYRXHH-HAQNSBGRSA-N	0	3	343.309	3.204	20	30		EGEDHN
CC(C)=CC(=O)N1CCCC[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC000959855990	1318229653	/nfs/dbraw/zinc/22/96/53/1318229653.db2.gz	LQMLMQXUXBRSCB-KRWDZBQOSA-N	0	3	329.419	3.134	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)c2ccoc2)cc1F	ZINC000959876102	1318245789	/nfs/dbraw/zinc/24/57/89/1318245789.db2.gz	KLLNRTPJWNQKOP-KRWDZBQOSA-N	0	3	341.386	3.075	20	30		EGEDHN
CCCC(=O)N1CCC[C@H]2CN(Cc3cccc(C#N)c3)CC[C@H]21	ZINC001021495342	1318299609	/nfs/dbraw/zinc/29/96/09/1318299609.db2.gz	CGHHBJIEOFBJFV-RBUKOAKNSA-N	0	3	325.456	3.171	20	30		EGEDHN
CCCC(=O)N1CCC[C@H]2CN(Cc3cccc(C#N)c3)CC[C@@H]21	ZINC001021495341	1318299919	/nfs/dbraw/zinc/29/99/19/1318299919.db2.gz	CGHHBJIEOFBJFV-OALUTQOASA-N	0	3	325.456	3.171	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@@H]2CN(Cc3ccc(C#N)cc3)CC[C@H]21	ZINC001021528613	1318364199	/nfs/dbraw/zinc/36/41/99/1318364199.db2.gz	ZISQIJFEEQMZQT-RTBURBONSA-N	0	3	325.456	3.027	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@H](CCCN3C(=O)C3CC=CC3)C2)c1	ZINC001021548809	1318387421	/nfs/dbraw/zinc/38/74/21/1318387421.db2.gz	SBPCFMYGRRVBCG-NHCUHLMSSA-N	0	3	349.478	3.337	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cscc2C(F)F)C1	ZINC001021592701	1318438254	/nfs/dbraw/zinc/43/82/54/1318438254.db2.gz	SPCRQDLBYGGJRM-SWLSCSKDSA-N	0	3	338.423	3.245	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccn(CC)c1C	ZINC000960294660	1318448181	/nfs/dbraw/zinc/44/81/81/1318448181.db2.gz	FKPSXBAAYDKECF-WOJBJXKFSA-N	0	3	337.467	3.378	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc(F)c(F)c(F)c1	ZINC000960305635	1318453044	/nfs/dbraw/zinc/45/30/44/1318453044.db2.gz	CZEHOXBOEYCYPV-SJLPKXTDSA-N	0	3	346.352	3.275	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cccc(OCC)c1	ZINC000960312068	1318455495	/nfs/dbraw/zinc/45/54/95/1318455495.db2.gz	FPGGSJZRPNXKFA-WOJBJXKFSA-N	0	3	336.435	3.257	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@H]1CCc2ccccc2C1	ZINC000960314170	1318456821	/nfs/dbraw/zinc/45/68/21/1318456821.db2.gz	WKRXSYZTHVCDDK-KSEOMHKRSA-N	0	3	346.474	3.349	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@@H](C)c1ccccc1F	ZINC000960314165	1318456947	/nfs/dbraw/zinc/45/69/47/1318456947.db2.gz	KAUURVCGXFDGQB-VHKYSDTDSA-N	0	3	338.426	3.487	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)C[C@@H]1OCc2ccccc21	ZINC000960331548	1318464623	/nfs/dbraw/zinc/46/46/23/1318464623.db2.gz	VIMDHIYFVUNWMH-RZUBCFFCSA-N	0	3	348.446	3.206	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc2ncsc2c1	ZINC000960333963	1318467220	/nfs/dbraw/zinc/46/72/20/1318467220.db2.gz	GDBFNBPCWHPKCK-IEBWSBKVSA-N	0	3	349.459	3.468	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)Cc1ccc(C)s1	ZINC000960335296	1318468981	/nfs/dbraw/zinc/46/89/81/1318468981.db2.gz	WXVDMBYIDQHYAG-IEBWSBKVSA-N	0	3	326.465	3.157	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(C)cc(Cl)c2)C1	ZINC001021631883	1318485673	/nfs/dbraw/zinc/48/56/73/1318485673.db2.gz	BYSSAFJBFFGYBR-YJBOKZPZSA-N	0	3	330.859	3.208	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2cccc(C3CC3)c2)C1	ZINC001021635293	1318489980	/nfs/dbraw/zinc/48/99/80/1318489980.db2.gz	JMWRXDNBGPHQRS-LEWJYISDSA-N	0	3	336.479	3.053	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)C2CCC3(CC3)CC2)C1	ZINC001021636325	1318490301	/nfs/dbraw/zinc/49/03/01/1318490301.db2.gz	PIGNYLNCBRVOHL-RBUKOAKNSA-N	0	3	328.500	3.293	20	30		EGEDHN
CC(COC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)[N+](=O)[O-]	ZINC000813101709	1318498603	/nfs/dbraw/zinc/49/86/03/1318498603.db2.gz	HKQZPLXYXHVTGI-LLVKDONJSA-N	0	3	344.298	3.312	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)CCc2cccc(Cl)c2)C1	ZINC001021642405	1318499477	/nfs/dbraw/zinc/49/94/77/1318499477.db2.gz	QDVCRHGHWVWIIE-MJGOQNOKSA-N	0	3	344.886	3.219	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)Cc2c(C)cc(C)cc2C)C1	ZINC001021663807	1318526053	/nfs/dbraw/zinc/52/60/53/1318526053.db2.gz	DYKRLJHPWPEKAW-TZIWHRDSSA-N	0	3	338.495	3.100	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc3ncccc3c2)C1	ZINC001021666363	1318527455	/nfs/dbraw/zinc/52/74/55/1318527455.db2.gz	SOHNPQQXGFAAOL-FPOVZHCZSA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2ccc(CC)cc2)C1	ZINC001021674285	1318539036	/nfs/dbraw/zinc/53/90/36/1318539036.db2.gz	AKMKCSSGVVAVJW-LEWJYISDSA-N	0	3	338.495	3.128	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)C2CCC(F)(F)CC2)C1	ZINC001021679074	1318548885	/nfs/dbraw/zinc/54/88/85/1318548885.db2.gz	LXUNQGVSAYCVMR-DLBZAZTESA-N	0	3	338.442	3.148	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cccc(OCC)c2)C1	ZINC001021679382	1318549829	/nfs/dbraw/zinc/54/98/29/1318549829.db2.gz	NQVBQJBAMYDXPV-UYAOXDASSA-N	0	3	340.467	3.035	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cnc3ccccc3c2)C1	ZINC001021679313	1318549872	/nfs/dbraw/zinc/54/98/72/1318549872.db2.gz	NJPKDZPVZDVPIF-WIYYLYMNSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc3c(c2)C=CCC3)C1	ZINC001021685272	1318559189	/nfs/dbraw/zinc/55/91/89/1318559189.db2.gz	PQUHLWCYUJMCEE-NHCUHLMSSA-N	0	3	334.463	3.206	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cccc(C)c2Cl)C1	ZINC001021693477	1318567823	/nfs/dbraw/zinc/56/78/23/1318567823.db2.gz	OSXCNMBUHAYDKU-RDJZCZTQSA-N	0	3	330.859	3.208	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@H]1CN(C)Cc1cc2ccccc2o1	ZINC000960498075	1318606590	/nfs/dbraw/zinc/60/65/90/1318606590.db2.gz	CGGRGMGRCDVVRK-ZBFHGGJFSA-N	0	3	325.412	3.015	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2coc3ccc(F)cc32)C1	ZINC001021725315	1318616681	/nfs/dbraw/zinc/61/66/81/1318616681.db2.gz	RLZTZDGPLBBNHT-KDOFPFPSSA-N	0	3	340.398	3.132	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)CCc2ccccc2F)C1	ZINC001021732728	1318637659	/nfs/dbraw/zinc/63/76/59/1318637659.db2.gz	HCQWMDXGIQUQEQ-UYAOXDASSA-N	0	3	342.458	3.095	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(C)c(F)c(C)c2)C1	ZINC001021737968	1318646366	/nfs/dbraw/zinc/64/63/66/1318646366.db2.gz	XTDAEYBLAXETTF-HKUYNNGSSA-N	0	3	342.458	3.392	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cncc3ccccc32)C1	ZINC001021741127	1318652205	/nfs/dbraw/zinc/65/22/05/1318652205.db2.gz	ZCWLUFAYGGIIAD-GHTZIAJQSA-N	0	3	347.462	3.185	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H]2C[C@@H](NCc3cc(C#N)ccc3F)C2)s1	ZINC001021783138	1318681272	/nfs/dbraw/zinc/68/12/72/1318681272.db2.gz	DJCWLZZIJWOCRH-GASCZTMLSA-N	0	3	343.427	3.118	20	30		EGEDHN
CC[C@H](SC)C(=O)N1CCC[C@H]1CN(C)Cc1cccc(C#N)c1	ZINC000960558341	1318689969	/nfs/dbraw/zinc/68/99/69/1318689969.db2.gz	SRCZAQHALSDYAL-ROUUACIJSA-N	0	3	345.512	3.123	20	30		EGEDHN
C[C@H]1CCC[C@H]1CC(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001022121269	1318801631	/nfs/dbraw/zinc/80/16/31/1318801631.db2.gz	BLEWJTKJDVNSMS-QXRTWZOPSA-N	0	3	343.446	3.260	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)Cc1ccccc1	ZINC000960703053	1318804980	/nfs/dbraw/zinc/80/49/80/1318804980.db2.gz	MNBMKJRGTZCDTD-OAQYLSRUSA-N	0	3	347.462	3.224	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)[C@@]2(C)CCC[C@@H]2CC)C1	ZINC001022285824	1318878223	/nfs/dbraw/zinc/87/82/23/1318878223.db2.gz	MGHKBNKEZKVXTB-AYDFFVQHSA-N	0	3	343.309	3.348	20	30		EGEDHN
Cc1cocc1C(=O)N1CCC[C@H]1CN(C)Cc1cccc(C#N)c1	ZINC000960810472	1318926805	/nfs/dbraw/zinc/92/68/05/1318926805.db2.gz	OARAVONLCMVYDZ-SFHVURJKSA-N	0	3	337.423	3.196	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@H]2CC[C@@H]2c2ccc(F)cc2)C1	ZINC001022486027	1318960356	/nfs/dbraw/zinc/96/03/56/1318960356.db2.gz	DQJXHUPMIYOJOF-TWMKSMIVSA-N	0	3	336.838	3.309	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]2CN(C)Cc2ccc(C#N)cc2)C1	ZINC000960848332	1318986823	/nfs/dbraw/zinc/98/68/23/1318986823.db2.gz	UYIHKKUAYSGQEE-LJQANCHMSA-N	0	3	337.467	3.337	20	30		EGEDHN
C[C@@H]1CC[C@H](CC(=O)N[C@H]2C[C@@H](NCc3cc(C#N)ccc3F)C2)C1	ZINC001022563181	1318992265	/nfs/dbraw/zinc/99/22/65/1318992265.db2.gz	FQXYWGZZLSOJTI-NONVJHHQSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)s2)C1	ZINC001022594068	1319007450	/nfs/dbraw/zinc/00/74/50/1319007450.db2.gz	UBCAICKTZROKSL-WRWGMCAJSA-N	0	3	345.295	3.494	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@@H](NCc3cnc(Cl)s3)C2)CC1	ZINC001022648641	1319040083	/nfs/dbraw/zinc/04/00/83/1319040083.db2.gz	LTULECQRPZFRGU-BETUJISGSA-N	0	3	339.892	3.280	20	30		EGEDHN
N#CC(C(=O)C1CCC(OC[C@@H]2CCCO2)CC1)c1ccccn1	ZINC000815907237	1319071083	/nfs/dbraw/zinc/07/10/83/1319071083.db2.gz	WHZMRKDOKCLYJA-SJJHQCBESA-N	0	3	328.412	3.012	20	30		EGEDHN
CCC(=O)N1CCC[C@H]([C@@H]2CCN(Cc3ccc(C#N)cc3F)C2)C1	ZINC000961068351	1319182471	/nfs/dbraw/zinc/18/24/71/1319182471.db2.gz	PJHWQVRQYTUCOQ-DLBZAZTESA-N	0	3	343.446	3.168	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)N[C@H]2C[C@@H](NCc3cc(C#N)ccc3F)C2)CC1	ZINC001022999371	1319209319	/nfs/dbraw/zinc/20/93/19/1319209319.db2.gz	ZBSSIJOCKCFKNZ-BLUWJVNFSA-N	0	3	343.446	3.260	20	30		EGEDHN
COc1ccc(CN(C)C)cc1NC(=O)/C=C\c1ccccc1C#N	ZINC000914845633	1319387942	/nfs/dbraw/zinc/38/79/42/1319387942.db2.gz	FAYXLJHVCVQIGO-LUAWRHEFSA-N	0	3	335.407	3.280	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NC[C@H]1CCCN(Cc2ccsc2)C1	ZINC001023375162	1319486297	/nfs/dbraw/zinc/48/62/97/1319486297.db2.gz	HZKJJCQDRFJAKL-NXHRZFHOSA-N	0	3	348.512	3.058	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](C2CCN(C(=O)[C@@H](CC)OC)CC2)C1	ZINC000961342937	1319498184	/nfs/dbraw/zinc/49/81/84/1319498184.db2.gz	RVWXGYMEWOYBEF-IAGOWNOFSA-N	0	3	342.911	3.115	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)[C@H]2CC[C@H](C3CCC3)CC2)C1	ZINC001023424374	1319524417	/nfs/dbraw/zinc/52/44/17/1319524417.db2.gz	WJSYQIBOYNYJAV-MISYRCLQSA-N	0	3	330.516	3.444	20	30		EGEDHN
C#CCN(C)CCCNC(=O)CCCc1cc(Cl)sc1Cl	ZINC000818612264	1319569309	/nfs/dbraw/zinc/56/93/09/1319569309.db2.gz	RCJQWHHTDZJVRG-UHFFFAOYSA-N	0	3	347.311	3.449	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Cc1cc2c(ccc3ccccc23)o1	ZINC000818612442	1319569589	/nfs/dbraw/zinc/56/95/89/1319569589.db2.gz	ZQXIIHKUYNMARX-UHFFFAOYSA-N	0	3	334.419	3.200	20	30		EGEDHN
C#CCN(C)CCCNC(=O)/C=C(\C)c1ccccc1C(F)(F)F	ZINC000818612067	1319570512	/nfs/dbraw/zinc/57/05/12/1319570512.db2.gz	MYQYAOZWJIOZPL-BUHFOSPRSA-N	0	3	338.373	3.180	20	30		EGEDHN
C(=NNCc1cccc2cccnc21)c1ccc(N2CCOCC2)cc1	ZINC000915959028	1319570801	/nfs/dbraw/zinc/57/08/01/1319570801.db2.gz	DUMLYPBJGYIQTG-UHFFFAOYSA-N	0	3	346.434	3.195	20	30		EGEDHN
C=CCN1CCC[C@H](CNC(=O)c2c(C)occ2C(F)(F)F)C1	ZINC001023493403	1319598749	/nfs/dbraw/zinc/59/87/49/1319598749.db2.gz	WJOHEPRHQGRUKD-GFCCVEGCSA-N	0	3	330.350	3.235	20	30		EGEDHN
CCc1cccc(CC)c1NC(=O)C(C#N)C(=O)CC[C@H]1CCCO1	ZINC000916910284	1319722622	/nfs/dbraw/zinc/72/26/22/1319722622.db2.gz	WLRITMSZELVNCX-IAGOWNOFSA-N	0	3	342.439	3.418	20	30		EGEDHN
CC(C)SCC(=O)C(C#N)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000916937301	1319725943	/nfs/dbraw/zinc/72/59/43/1319725943.db2.gz	CFGXWKWPIGRBFO-JTQLQIEISA-N	0	3	328.796	3.268	20	30		EGEDHN
N#CC(C(=O)Cc1coc2ccc3ccccc3c12)C(=O)NC1CC1	ZINC000916926822	1319726459	/nfs/dbraw/zinc/72/64/59/1319726459.db2.gz	YSMPJVQFWVLYDZ-INIZCTEOSA-N	0	3	332.359	3.116	20	30		EGEDHN
Cc1ccc(C(=O)N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)cc1C#N	ZINC000819642092	1319766750	/nfs/dbraw/zinc/76/67/50/1319766750.db2.gz	KFSNFWDNGBEWSP-PZJWPPBQSA-N	0	3	345.446	3.213	20	30		EGEDHN
CC[C@H](Cc1ccccc1C)C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000819952694	1319810658	/nfs/dbraw/zinc/81/06/58/1319810658.db2.gz	VASICXGZEOJJIQ-NVXWUHKLSA-N	0	3	335.407	3.306	20	30		EGEDHN
C=CCN1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1	ZINC000962079379	1319819892	/nfs/dbraw/zinc/81/98/92/1319819892.db2.gz	BQTPSUJTGRDJIE-QGLKVJOYSA-N	0	3	332.447	3.176	20	30		EGEDHN
CC[NH+](CC)Cc1cc(C(C)N=Nc2oc(C)nc2C#N)ccc1[O-]	ZINC000917554494	1319835687	/nfs/dbraw/zinc/83/56/87/1319835687.db2.gz	AKCARNOGHIDABJ-UHFFFAOYSA-N	0	3	341.415	3.238	20	30		EGEDHN
C=C1CCC(C(=O)NC2CC(CNCc3ncc(C)s3)C2)CC1	ZINC000962264592	1319890280	/nfs/dbraw/zinc/89/02/80/1319890280.db2.gz	FNQIIPSWXUFSDF-UHFFFAOYSA-N	0	3	333.501	3.182	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCN(C(=O)/C=C/c2ccco2)C1	ZINC001023811762	1319955797	/nfs/dbraw/zinc/95/57/97/1319955797.db2.gz	RWNIPBJWONSPME-OAGJVSPASA-N	0	3	349.434	3.193	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCN(C(=O)[C@@H]2CC=CCC2)C1	ZINC001023837431	1319979398	/nfs/dbraw/zinc/97/93/98/1319979398.db2.gz	WQVMULNQQZKBRW-QZTJIDSGSA-N	0	3	337.467	3.243	20	30		EGEDHN
C=CCOc1ccc(/C=C\C(=O)OCCN2CCCCC2)cc1OC	ZINC000858971092	1328901711	/nfs/dbraw/zinc/90/17/11/1328901711.db2.gz	YGZAEMAXIAFMKO-NTMALXAHSA-N	0	3	345.439	3.302	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N(CC=C)Cc1ccc(Cl)s1	ZINC000838624311	1320796402	/nfs/dbraw/zinc/79/64/02/1320796402.db2.gz	RCXOCQPQUOHWLB-UHFFFAOYSA-N	0	3	339.892	3.054	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)[C@@H](CC(C)C)OC)c1ccccc1	ZINC000842341809	1321374737	/nfs/dbraw/zinc/37/47/37/1321374737.db2.gz	ABLLVQAFCMNAQG-YESZJQIVSA-N	0	3	330.428	3.024	20	30		EGEDHN
C[C@@H](NC(=O)OC(C)(C)C)C(=O)C(C#N)c1nc(C2CC2)cs1	ZINC000842939124	1321451404	/nfs/dbraw/zinc/45/14/04/1321451404.db2.gz	ONSGKMYDMVURNR-MWLCHTKSSA-N	0	3	335.429	3.110	20	30		EGEDHN
C#CCOc1ccc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)cc1	ZINC000844377653	1321595645	/nfs/dbraw/zinc/59/56/45/1321595645.db2.gz	HYCSMMKOZURWTH-LSDHHAIUSA-N	0	3	341.329	3.385	20	30		EGEDHN
C[C@H](COCC(=O)C(C#N)C(=O)Nc1ccccc1)c1ccccc1	ZINC000845442170	1321708234	/nfs/dbraw/zinc/70/82/34/1321708234.db2.gz	KKGKWWMJXNDULH-QAPCUYQASA-N	0	3	336.391	3.154	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-]	ZINC000845880053	1321750671	/nfs/dbraw/zinc/75/06/71/1321750671.db2.gz	KJHGLYJLJDRXRS-VFZGTOFNSA-N	0	3	332.287	3.162	20	30		EGEDHN
C#CCOc1ccccc1NC(=O)C(C[C@@H]1CCCO1)C(F)(F)F	ZINC000845956832	1321758543	/nfs/dbraw/zinc/75/85/43/1321758543.db2.gz	JMTPDHBTNSHOGI-STQMWFEESA-N	0	3	341.329	3.385	20	30		EGEDHN
COc1ccc(O)c(/C=N/CC2CCN(Cc3ccncc3)CC2)c1	ZINC000849170184	1322093984	/nfs/dbraw/zinc/09/39/84/1322093984.db2.gz	MJIXHZXULONCQE-HYARGMPZSA-N	0	3	339.439	3.127	20	30		EGEDHN
CC[C@@H](C(=O)C(C#N)c1nc(C)cs1)N(C)C(=O)OC(C)(C)C	ZINC000850736855	1322281156	/nfs/dbraw/zinc/28/11/56/1322281156.db2.gz	NVCRGRFSXHJJFO-RYUDHWBXSA-N	0	3	337.445	3.273	20	30		EGEDHN
COc1cc(Cl)c(C)cc1NC(=O)C(C#N)C(=O)CCCF	ZINC000850759818	1322285614	/nfs/dbraw/zinc/28/56/14/1322285614.db2.gz	OGIXWNDLYCOPLE-SNVBAGLBSA-N	0	3	326.755	3.054	20	30		EGEDHN
CC(C)C[C@H](CCO)CNCc1cc(C#N)ccc1Br	ZINC000921807942	1322401467	/nfs/dbraw/zinc/40/14/67/1322401467.db2.gz	VQVWLEGAGUYOES-AWEZNQCLSA-N	0	3	339.277	3.455	20	30		EGEDHN
CC[C@@H](C[C@@H](C)CO)NCc1cc(C#N)ccc1Br	ZINC000921807402	1322401620	/nfs/dbraw/zinc/40/16/20/1322401620.db2.gz	QAXJCNWENNVVOY-RISCZKNCSA-N	0	3	325.250	3.207	20	30		EGEDHN
CCOC(CCNCc1cc(C#N)ccc1Br)OCC	ZINC000922042250	1322443686	/nfs/dbraw/zinc/44/36/86/1322443686.db2.gz	NOVMWAFFYJNZMB-UHFFFAOYSA-N	0	3	341.249	3.200	20	30		EGEDHN
N#Cc1ccc(Br)c(CNCC[C@H](O)C2CCCC2)c1	ZINC000922319908	1322500488	/nfs/dbraw/zinc/50/04/88/1322500488.db2.gz	KTBFYLIMAQLMFS-INIZCTEOSA-N	0	3	337.261	3.352	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H](CNCc2oc(C)nc2C)C1	ZINC001024089986	1323123205	/nfs/dbraw/zinc/12/32/05/1323123205.db2.gz	BAHHIRAUFVBUOW-MRXNPFEDSA-N	0	3	333.476	3.222	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](CNCc2nc(C)sc2C)C1	ZINC001024094970	1323126589	/nfs/dbraw/zinc/12/65/89/1323126589.db2.gz	OHLBPZPTANHPQT-OAHLLOKOSA-N	0	3	335.517	3.300	20	30		EGEDHN
CCN(C)C(=O)OC[C@@H]1CCCCN1CCc1ccc(C#N)cc1	ZINC000852047834	1323138861	/nfs/dbraw/zinc/13/88/61/1323138861.db2.gz	IUHGVTHTMICSMK-SFHVURJKSA-N	0	3	329.444	3.044	20	30		EGEDHN
C#C[C@@](C)(CC)NCC(=O)N1CCC[C@H]1c1ccc(OCC)cc1	ZINC000852099867	1323146321	/nfs/dbraw/zinc/14/63/21/1323146321.db2.gz	CFBYJSMKKVWVTE-ICSRJNTNSA-N	0	3	328.456	3.140	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@@H](CNCc3cnc(C)o3)C2)CC1	ZINC001024134137	1323159082	/nfs/dbraw/zinc/15/90/82/1323159082.db2.gz	XKDXSEXRYAHMOI-INIZCTEOSA-N	0	3	331.460	3.058	20	30		EGEDHN
CN(Cc1ccc(C#N)c(F)c1)CC(C)(C)NC(=O)OC(C)(C)C	ZINC000852307045	1323175800	/nfs/dbraw/zinc/17/58/00/1323175800.db2.gz	POADKWGIORWHDM-UHFFFAOYSA-N	0	3	335.423	3.432	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CCC[C@H](CNCc2ccccc2C#N)C1	ZINC001024186258	1323197751	/nfs/dbraw/zinc/19/77/51/1323197751.db2.gz	OCYXAJMFWPGGOT-IAGOWNOFSA-N	0	3	327.472	3.179	20	30		EGEDHN
N#Cc1ccc(CNC2CCN(OCc3ccccc3)CC2)c(F)c1	ZINC000924979428	1323235064	/nfs/dbraw/zinc/23/50/64/1323235064.db2.gz	KVBODQVGRCWVQV-UHFFFAOYSA-N	0	3	339.414	3.383	20	30		EGEDHN
CCc1ccc([C@@H](NC2CCN(CC#N)CC2)c2cccnc2)cc1	ZINC000925003710	1323242390	/nfs/dbraw/zinc/24/23/90/1323242390.db2.gz	PNIAKFJBBCIMQO-OAQYLSRUSA-N	0	3	334.467	3.311	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccc2oc(C)nc2c1	ZINC001024501633	1323449078	/nfs/dbraw/zinc/44/90/78/1323449078.db2.gz	GNSXHNOFNHMWAC-MRXNPFEDSA-N	0	3	327.428	3.297	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1coc2cc(F)ccc12	ZINC001024517947	1323467361	/nfs/dbraw/zinc/46/73/61/1323467361.db2.gz	DLGVAJAQIROMMD-HNNXBMFYSA-N	0	3	328.387	3.180	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@@H]1CCOc2c(F)cccc21	ZINC001024546240	1323487940	/nfs/dbraw/zinc/48/79/40/1323487940.db2.gz	WBKADODFINDBMV-DOTOQJQBSA-N	0	3	346.446	3.239	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1coc2ccc(OC)cc21	ZINC001024547525	1323488795	/nfs/dbraw/zinc/48/87/95/1323488795.db2.gz	MJDMVDJEEIMRJI-HNNXBMFYSA-N	0	3	340.423	3.049	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccc(C(F)(F)F)nc1	ZINC001024586967	1323520608	/nfs/dbraw/zinc/52/06/08/1323520608.db2.gz	WTVOQYMEFFHJJK-AWEZNQCLSA-N	0	3	341.377	3.261	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1nsc2ccc(C)cc21	ZINC001024593296	1323526494	/nfs/dbraw/zinc/52/64/94/1323526494.db2.gz	JRHHOHIEWJKBCS-OAHLLOKOSA-N	0	3	341.480	3.212	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccccc1O[C@@H](C)CC	ZINC001024685828	1323602631	/nfs/dbraw/zinc/60/26/31/1323602631.db2.gz	NYWBVIUCVVYHTJ-ROUUACIJSA-N	0	3	342.483	3.472	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1csc(-c2ccoc2)n1	ZINC001024713417	1323620319	/nfs/dbraw/zinc/62/03/19/1323620319.db2.gz	JDOXFZNDLMYYGN-OAHLLOKOSA-N	0	3	343.452	3.011	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cccc(C(F)(F)F)n1	ZINC001024722541	1323624736	/nfs/dbraw/zinc/62/47/36/1323624736.db2.gz	VVMIECXVTRANPQ-CYBMUJFWSA-N	0	3	341.377	3.261	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1coc2ccc(F)cc12	ZINC001024777263	1323678620	/nfs/dbraw/zinc/67/86/20/1323678620.db2.gz	IKKMFFOPIUVGRO-HNNXBMFYSA-N	0	3	328.387	3.180	20	30		EGEDHN
C=C(Cl)CN1CCCC[C@@H]1CNC(=O)c1cccc(CN(C)C)c1	ZINC001024811562	1323714391	/nfs/dbraw/zinc/71/43/91/1323714391.db2.gz	UXVAVTQJSJFATO-GOSISDBHSA-N	0	3	349.906	3.085	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)C2CC=CC2)s1	ZINC001024909988	1323775159	/nfs/dbraw/zinc/77/51/59/1323775159.db2.gz	ZYDQPQKDUUUYJX-OAHLLOKOSA-N	0	3	329.469	3.057	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCCC[C@@H]1CNCc1cc(C#N)ccc1OC	ZINC001024919359	1323782750	/nfs/dbraw/zinc/78/27/50/1323782750.db2.gz	XZBBRSYKLQRSOI-BXENKHIRSA-N	0	3	341.455	3.004	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@H]2[C@@H]2CCCCN2C(=O)C(F)F)c1	ZINC001025182797	1323949701	/nfs/dbraw/zinc/94/97/01/1323949701.db2.gz	GXBADXOEMJTJGW-IRXDYDNUSA-N	0	3	347.409	3.169	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1c(F)cccc1OC	ZINC001025233299	1324020968	/nfs/dbraw/zinc/02/09/68/1324020968.db2.gz	WWUJMVCLCIGEGB-IAGOWNOFSA-N	0	3	346.446	3.479	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cccc(CC)n1	ZINC001025239660	1324032450	/nfs/dbraw/zinc/03/24/50/1324032450.db2.gz	HPISSQURVPMAPW-PMACEKPBSA-N	0	3	339.483	3.126	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCCC[C@H]1[C@@H]1CCCN1CC#CC	ZINC001025240255	1324034609	/nfs/dbraw/zinc/03/46/09/1324034609.db2.gz	MRAZUEWADYRUFA-OALUTQOASA-N	0	3	339.483	3.157	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)Cc1cccc(CC)c1	ZINC001025243387	1324039343	/nfs/dbraw/zinc/03/93/43/1324039343.db2.gz	NXLNCGDLHNXIHB-LEWJYISDSA-N	0	3	338.495	3.270	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1nc(C)sc1C	ZINC001025245052	1324042799	/nfs/dbraw/zinc/04/27/99/1324042799.db2.gz	ZEQYNOLTZMLEGP-SJORKVTESA-N	0	3	345.512	3.242	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1oc(CC)nc1C	ZINC001025287544	1324109437	/nfs/dbraw/zinc/10/94/37/1324109437.db2.gz	OOTFDHFXTLCXHO-HZPDHXFCSA-N	0	3	331.460	3.191	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1sccc1OC	ZINC001025289954	1324114658	/nfs/dbraw/zinc/11/46/58/1324114658.db2.gz	VWNFDIYPTWUMEB-CABCVRRESA-N	0	3	334.485	3.402	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccccc1OCC	ZINC001025298477	1324133212	/nfs/dbraw/zinc/13/32/12/1324133212.db2.gz	XEKXLZVHOVTONR-RBUKOAKNSA-N	0	3	340.467	3.178	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cccc2c1CCC2	ZINC001025301632	1324135443	/nfs/dbraw/zinc/13/54/43/1324135443.db2.gz	NJKKLEGLAUQLAK-LEWJYISDSA-N	0	3	336.479	3.268	20	30		EGEDHN
C#CCCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc(F)s1	ZINC001025303559	1324137217	/nfs/dbraw/zinc/13/72/17/1324137217.db2.gz	IJRIYTJBSVRFCT-GJZGRUSLSA-N	0	3	334.460	3.370	20	30		EGEDHN
C[C@@H](NC(=O)c1ccoc1)[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001025346528	1324193317	/nfs/dbraw/zinc/19/33/17/1324193317.db2.gz	URUAATOFCNJKLV-CRAIPNDOSA-N	0	3	337.423	3.182	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cccc3scnc32)C1	ZINC001025419614	1324251251	/nfs/dbraw/zinc/25/12/51/1324251251.db2.gz	NIYXFGXIHWNYBL-GJZGRUSLSA-N	0	3	341.480	3.150	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2nsc3ccccc32)C1	ZINC001025429087	1324263691	/nfs/dbraw/zinc/26/36/91/1324263691.db2.gz	RMYBTPHPJCMKNK-CABCVRRESA-N	0	3	341.480	3.150	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cccc(OCCC)c2)C1	ZINC001025430493	1324265637	/nfs/dbraw/zinc/26/56/37/1324265637.db2.gz	FKDPJENHLJCQID-PKOBYXMFSA-N	0	3	342.483	3.329	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)[C@H]2CC[C@H](C3CCC3)CC2)C1	ZINC001025446201	1324287735	/nfs/dbraw/zinc/28/77/35/1324287735.db2.gz	YOZKXIXGHQCHAM-LEAZDLGRSA-N	0	3	330.516	3.443	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2nccc3ccsc32)C1	ZINC001025447767	1324291124	/nfs/dbraw/zinc/29/11/24/1324291124.db2.gz	LTGMTMTWTGLSKN-HOCLYGCPSA-N	0	3	341.480	3.150	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccccc2-c2ccncc2)C1	ZINC001025455366	1324295883	/nfs/dbraw/zinc/29/58/83/1324295883.db2.gz	CHEOGUNGOQZBML-HKUYNNGSSA-N	0	3	347.462	3.212	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(C3CC3)[nH]c2C2CC2)C1	ZINC001025456916	1324298544	/nfs/dbraw/zinc/29/85/44/1324298544.db2.gz	SWGBIWVNHAKHFW-YOEHRIQHSA-N	0	3	339.483	3.233	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc3sccc3s2)C1	ZINC001025458874	1324301218	/nfs/dbraw/zinc/30/12/18/1324301218.db2.gz	JUTXDCFTMVMVTA-CHWSQXEVSA-N	0	3	332.494	3.426	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(-c3ccco3)o2)C1	ZINC001025482125	1324330015	/nfs/dbraw/zinc/33/00/15/1324330015.db2.gz	MELNZBLKZIQYAI-GJZGRUSLSA-N	0	3	326.396	3.003	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2c(C)occ2C(F)(F)F)C1	ZINC001025484209	1324332198	/nfs/dbraw/zinc/33/21/98/1324332198.db2.gz	APORYUJCKFCHGS-WCQYABFASA-N	0	3	342.361	3.070	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2csc3ccccc23)C1	ZINC001025495926	1324347359	/nfs/dbraw/zinc/34/73/59/1324347359.db2.gz	LIMRGWDEHJVJFO-GJZGRUSLSA-N	0	3	326.465	3.365	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(-c3ccccc3)ccn2)C1	ZINC001025579885	1324419128	/nfs/dbraw/zinc/41/91/28/1324419128.db2.gz	PPZDNJYJJTVTMK-FXAWDEMLSA-N	0	3	347.462	3.212	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc3nc(C)sc3c2)C1	ZINC001025587425	1324431298	/nfs/dbraw/zinc/43/12/98/1324431298.db2.gz	MMSQVNKNEXVYCC-CJNGLKHVSA-N	0	3	341.480	3.068	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC001025603403	1324452559	/nfs/dbraw/zinc/45/25/59/1324452559.db2.gz	VTAUKOYOMUEQSW-DZGCQCFKSA-N	0	3	338.373	3.169	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC001025605775	1324453656	/nfs/dbraw/zinc/45/36/56/1324453656.db2.gz	CFSGORHNLDXNBQ-FUHWJXTLSA-N	0	3	326.484	3.448	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(Cl)c(Cl)c2)C1	ZINC001025607915	1324458587	/nfs/dbraw/zinc/45/85/87/1324458587.db2.gz	JFDAWZUQDOWGCG-TZMCWYRMSA-N	0	3	339.266	3.457	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(OCC(C)C)cc2)C1	ZINC001025611598	1324463186	/nfs/dbraw/zinc/46/31/86/1324463186.db2.gz	MTRAWGUDRDHZBV-IEBWSBKVSA-N	0	3	342.483	3.185	20	30		EGEDHN
CC(C)CC(=O)N1C[C@@H]2CC[C@H](NCc3cc(F)ccc3C#N)[C@H]2C1	ZINC001026179614	1324647284	/nfs/dbraw/zinc/64/72/84/1324647284.db2.gz	ZCQUYVREDBPAAB-SNRMKQJTSA-N	0	3	343.446	3.070	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CC[C@H]2CN(C(=O)CCC3CC3)C[C@H]21	ZINC001026222156	1324670675	/nfs/dbraw/zinc/67/06/75/1324670675.db2.gz	ZGVGCGKRCNRTIZ-XUVXKRRUSA-N	0	3	337.467	3.075	20	30		EGEDHN
Cc1cc(C(=O)N2C[C@@H]3CC[C@H](NCc4ccccc4C#N)[C@H]3C2)co1	ZINC001026249812	1324685749	/nfs/dbraw/zinc/68/57/49/1324685749.db2.gz	HFODHAHBHNMGET-IHPCNDPISA-N	0	3	349.434	3.100	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H]2CC[C@@H](NCc3nc(C)oc3C)[C@H]2C1	ZINC001026330425	1324731363	/nfs/dbraw/zinc/73/13/63/1324731363.db2.gz	ISWJHNRFUGAPOJ-YESZJQIVSA-N	0	3	345.487	3.220	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H]3CC[C@H](NCc4nc(C)cs4)[C@H]3C2)C1	ZINC001026354642	1324747721	/nfs/dbraw/zinc/74/77/21/1324747721.db2.gz	BJXDIWYQEWHKHU-JYJNAYRXSA-N	0	3	345.512	3.134	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC1CCC(NC(=O)C2CCC2)CC1	ZINC001026440020	1324802594	/nfs/dbraw/zinc/80/25/94/1324802594.db2.gz	KURUXAZLHVIFKF-UHFFFAOYSA-N	0	3	329.419	3.014	20	30		EGEDHN
CC(C)(C)CC(=O)N1CC[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001026687533	1324976451	/nfs/dbraw/zinc/97/64/51/1324976451.db2.gz	VFMHFMTVCIIBNQ-AWEZNQCLSA-N	0	3	331.435	3.072	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)Cc2ccoc2)C1	ZINC000963290356	1325076214	/nfs/dbraw/zinc/07/62/14/1325076214.db2.gz	OSXACXXDLIBMQJ-IRXDYDNUSA-N	0	3	336.863	3.278	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](CNCc2oc(C(C)C)nc2C)C1	ZINC001026993809	1325132533	/nfs/dbraw/zinc/13/25/33/1325132533.db2.gz	JJCLUOXINNSFAR-HNNXBMFYSA-N	0	3	333.476	3.257	20	30		EGEDHN
CC1(C)CC(CC(=O)N2CC[C@@H](CNCc3ccccc3C#N)C2)C1	ZINC001027017607	1325158112	/nfs/dbraw/zinc/15/81/12/1325158112.db2.gz	XGHGUAMSTPZTOK-INIZCTEOSA-N	0	3	339.483	3.323	20	30		EGEDHN
C#Cc1cccc(NC(=O)NCC2CCN(Cc3ccncc3)CC2)c1	ZINC000854263002	1325236568	/nfs/dbraw/zinc/23/65/68/1325236568.db2.gz	QZCGTTDRKBOGCY-UHFFFAOYSA-N	0	3	348.450	3.097	20	30		EGEDHN
C[C@H]1[C@H](NC(=O)c2cc(C#N)ccc2F)CCN1Cc1ccccc1	ZINC000854483805	1325265204	/nfs/dbraw/zinc/26/52/04/1325265204.db2.gz	JCFLIHQYFBFTPP-IFXJQAMLSA-N	0	3	337.398	3.090	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)CCc2ccccc2)C1	ZINC001027187266	1325287963	/nfs/dbraw/zinc/28/79/63/1325287963.db2.gz	YAPUQXHGQPEDCH-IBGZPJMESA-N	0	3	347.462	3.129	20	30		EGEDHN
Cc1ccccc1CC(=O)N1CC[C@H](CNCc2ccccc2C#N)C1	ZINC001027208469	1325309286	/nfs/dbraw/zinc/30/92/86/1325309286.db2.gz	DMKWGSAQYXAQAV-GOSISDBHSA-N	0	3	347.462	3.048	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)c2ccc(F)s2)C1	ZINC001027244887	1325344454	/nfs/dbraw/zinc/34/44/54/1325344454.db2.gz	YSPRMMIAWFZIPN-ZDUSSCGKSA-N	0	3	343.427	3.011	20	30		EGEDHN
C[C@H](NC1(c2cccc(C#N)c2)CC1)c1cccc(-n2cnnc2)c1	ZINC000925926990	1325360521	/nfs/dbraw/zinc/36/05/21/1325360521.db2.gz	VYEDCXDPGAOTDW-HNNXBMFYSA-N	0	3	329.407	3.479	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC[C@@H](N(C)Cc2ccc(OC)c(C#N)c2)C1	ZINC001027305175	1325449558	/nfs/dbraw/zinc/44/95/58/1325449558.db2.gz	JARPQSXDJHVVBC-MAUKXSAKSA-N	0	3	343.471	3.036	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC[C@H](N(C)Cc2ccc(F)c(C#N)c2)C1	ZINC001027305992	1325452132	/nfs/dbraw/zinc/45/21/32/1325452132.db2.gz	WWMATXJMIGLFQJ-YOEHRIQHSA-N	0	3	331.435	3.166	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC[C@H](N(C)Cc2cc3ccccc3o2)C1	ZINC001027335258	1325494583	/nfs/dbraw/zinc/49/45/83/1325494583.db2.gz	FBEYLKALMCZRCR-HOCLYGCPSA-N	0	3	325.412	3.015	20	30		EGEDHN
Cc1nc(C(C)C)ccc1CN(C)[C@@H]1CCCN(C(=O)[C@@H](C)C#N)C1	ZINC001027336217	1325495340	/nfs/dbraw/zinc/49/53/40/1325495340.db2.gz	NZHFOBTXDAHRGJ-MAUKXSAKSA-N	0	3	342.487	3.096	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)c(F)c2)C1)C1CC1	ZINC001027352542	1325522538	/nfs/dbraw/zinc/52/25/38/1325522538.db2.gz	XCGKOVFUNPJDSE-KBXCAEBGSA-N	0	3	343.446	3.166	20	30		EGEDHN
CN(Cc1ccc(F)c(C#N)c1)[C@@H]1CCCN(C(=O)C2=CCCC2)C1	ZINC001027365940	1325558374	/nfs/dbraw/zinc/55/83/74/1325558374.db2.gz	ZRZIYJFRULXJBR-GOSISDBHSA-N	0	3	341.430	3.230	20	30		EGEDHN
C#Cc1ccc(C(=O)NC2CC3(CC(NCC(=C)Cl)C3)C2)cc1	ZINC000964605677	1325570620	/nfs/dbraw/zinc/57/06/20/1325570620.db2.gz	OSZACLBRASWNSV-UHFFFAOYSA-N	0	3	328.843	3.051	20	30		EGEDHN
CCC[C@H](OCC)C(=O)C(C#N)C(=O)N[C@H](CC)c1ccccc1	ZINC000860696105	1329345315	/nfs/dbraw/zinc/34/53/15/1329345315.db2.gz	YHKVPLIQJWDMFP-BBWFWOEESA-N	0	3	330.428	3.168	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCC[C@@H](N(C)Cc2ccsc2)C1	ZINC001027441594	1327680851	/nfs/dbraw/zinc/68/08/51/1327680851.db2.gz	GWYGQGQEFHRXLR-QGZVFWFLSA-N	0	3	343.496	3.472	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1ccc(Cl)[nH]1)C2	ZINC000964932295	1327778109	/nfs/dbraw/zinc/77/81/09/1327778109.db2.gz	AVIMNOZOHWBKDY-UHFFFAOYSA-N	0	3	328.243	3.051	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)[C@]2(C)C=CCC2)C1	ZINC001027531259	1327813594	/nfs/dbraw/zinc/81/35/94/1327813594.db2.gz	HLCOAAILQCDELV-PZJWPPBQSA-N	0	3	337.467	3.337	20	30		EGEDHN
COc1ccc(Cl)cc1[C@@H](C)NCCNc1ccc(C#N)cn1	ZINC000927166715	1327903108	/nfs/dbraw/zinc/90/31/08/1327903108.db2.gz	YGQRDMPQAGDAAX-GFCCVEGCSA-N	0	3	330.819	3.378	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)c2coc3ccc(Cl)cc23)C1	ZINC001027664490	1328054429	/nfs/dbraw/zinc/05/44/29/1328054429.db2.gz	CEIPJLCCMKNHKK-CQSZACIVSA-N	0	3	330.815	3.256	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)c2cc3c(cccc3F)s2)C1	ZINC001027674258	1328070479	/nfs/dbraw/zinc/07/04/79/1328070479.db2.gz	SXRSQMQAGBANIB-ZDUSSCGKSA-N	0	3	330.428	3.210	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)c2cc3c(s2)CC[C@H](C)C3)C1	ZINC001027679012	1328078310	/nfs/dbraw/zinc/07/83/10/1328078310.db2.gz	SESQDHNMYYWGKX-HOCLYGCPSA-N	0	3	330.497	3.043	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2cc(F)cc3ccncc32)C1	ZINC000966171035	1328214497	/nfs/dbraw/zinc/21/44/97/1328214497.db2.gz	ZKTUPDXUAPCXTD-KUHUBIRLSA-N	0	3	341.430	3.390	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccoc2C(F)(F)F)C1	ZINC000966389911	1328288453	/nfs/dbraw/zinc/28/84/53/1328288453.db2.gz	SYLXTDMTMNRUPI-DGCLKSJQSA-N	0	3	330.350	3.315	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2cc3ccccc3nc2C)C1	ZINC000966494440	1328323599	/nfs/dbraw/zinc/32/35/99/1328323599.db2.gz	XFEWLCHVNXLWNF-FOIQADDNSA-N	0	3	335.451	3.007	20	30		EGEDHN
C#CCCN1CCC[C@@H]1CNC(=O)c1csc2cc(C)ccc12	ZINC001027907683	1328380711	/nfs/dbraw/zinc/38/07/11/1328380711.db2.gz	BBIAJTCWOOSFKS-OAHLLOKOSA-N	0	3	326.465	3.427	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CN(Cc2ccccc2)CC[C@@H]1C	ZINC000966691137	1328382862	/nfs/dbraw/zinc/38/28/62/1328382862.db2.gz	DJIAPNSHAAHVDY-PKOBYXMFSA-N	0	3	337.467	3.315	20	30		EGEDHN
C=C(C)CCN1CC[C@H](C)[C@H](NC(=O)c2c(C)noc2C(F)F)C1	ZINC000966887833	1328453341	/nfs/dbraw/zinc/45/33/41/1328453341.db2.gz	JCSIMXJNMFJCIX-WCQYABFASA-N	0	3	341.402	3.327	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1cnc2c(F)cccc2c1	ZINC001028028797	1328492761	/nfs/dbraw/zinc/49/27/61/1328492761.db2.gz	JKBFJWGMMONLBY-INIZCTEOSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1c(C)occ1C(F)(F)F	ZINC001028030954	1328494209	/nfs/dbraw/zinc/49/42/09/1328494209.db2.gz	NAEXIUREIATHGO-LBPRGKRZSA-N	0	3	330.350	3.377	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3cc4cscc4s3)C2)CC1	ZINC001050593748	1348296325	/nfs/dbraw/zinc/29/63/25/1348296325.db2.gz	ZKMDMPWJTXUCFT-UHFFFAOYSA-N	0	3	330.478	3.134	20	30		EGEDHN
C=CCOCCN1CCC(Oc2ccc(C(F)(F)F)cn2)CC1	ZINC000932226583	1329798014	/nfs/dbraw/zinc/79/80/14/1329798014.db2.gz	SMPJYXFGVAMZHR-UHFFFAOYSA-N	0	3	330.350	3.146	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1cccc(COC(C)(C)C)c1	ZINC000933194225	1329871302	/nfs/dbraw/zinc/87/13/02/1329871302.db2.gz	DAWTUKZHJVSQKO-UHFFFAOYSA-N	0	3	331.460	3.078	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(OC)c(C(C)C)c2)[C@H](C)C1	ZINC000942301307	1331897864	/nfs/dbraw/zinc/89/78/64/1331897864.db2.gz	FEPOBMPHCVIHLG-APWZRJJASA-N	0	3	342.483	3.282	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)c(Cl)cc2C)[C@@H](C)C1	ZINC000942556274	1331971131	/nfs/dbraw/zinc/97/11/31/1331971131.db2.gz	YPTMJLAVKBKLOO-YJBOKZPZSA-N	0	3	332.875	3.420	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2nsc3ccc(C)cc32)[C@H](C)C1	ZINC000942561928	1331976027	/nfs/dbraw/zinc/97/60/27/1331976027.db2.gz	DYFUJDMUBQIMJO-GDBMZVCRSA-N	0	3	341.480	3.068	20	30		EGEDHN
Cc1coc(C(=O)N[C@@H]2CCN(Cc3ccc(C#N)cc3)C[C@@H]2C)c1	ZINC000942565351	1331978896	/nfs/dbraw/zinc/97/88/96/1331978896.db2.gz	KNNKLQOOBNVRQZ-MAUKXSAKSA-N	0	3	337.423	3.100	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccc(F)c3ccncc23)[C@H](C)C1	ZINC000942574896	1331983529	/nfs/dbraw/zinc/98/35/29/1331983529.db2.gz	OGJYPLHXSCUEBD-FZKQIMNGSA-N	0	3	327.403	3.000	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCN(Cc3ncccc3C)C[C@@H]2C)CC1	ZINC000942600863	1331998004	/nfs/dbraw/zinc/99/80/04/1331998004.db2.gz	WDQGRLZQRIZKAG-HKUYNNGSSA-N	0	3	341.499	3.463	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2c(F)ccc(F)c2Cl)[C@H](C)C1	ZINC000942959264	1332066967	/nfs/dbraw/zinc/06/69/67/1332066967.db2.gz	KPVUIMCWGLYNKB-BXUZGUMPSA-N	0	3	340.801	3.082	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ncc(Cl)cc2Cl)[C@@H](C)C1	ZINC000943767063	1332259028	/nfs/dbraw/zinc/25/90/28/1332259028.db2.gz	QLCNUVVVULZETE-GWCFXTLKSA-N	0	3	328.243	3.015	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccccc2C(F)(F)F)[C@@H](C)C1	ZINC000944263777	1332356978	/nfs/dbraw/zinc/35/69/78/1332356978.db2.gz	LECARGHEWAAVTN-SWLSCSKDSA-N	0	3	326.362	3.332	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3c(s2)CCCCC3)[C@@H](C)C1	ZINC000944618203	1332417647	/nfs/dbraw/zinc/41/76/47/1332417647.db2.gz	BYCPLYLYOHZVLJ-DOTOQJQBSA-N	0	3	344.524	3.481	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2coc3cc(C)ccc23)[C@@H](C)C1	ZINC000944651122	1332421107	/nfs/dbraw/zinc/42/11/07/1332421107.db2.gz	DIPWIRFULAETIY-LPHOPBHVSA-N	0	3	338.451	3.134	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3cc(C)cc(C)c3)CC2)[C@H](C)C1	ZINC000944980944	1332468716	/nfs/dbraw/zinc/46/87/16/1332468716.db2.gz	YBZBTQZKDNVXBU-QUCCMNQESA-N	0	3	338.495	3.185	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2coc(C3CCCCC3)n2)[C@H](C)C1	ZINC000945219706	1332533815	/nfs/dbraw/zinc/53/38/15/1332533815.db2.gz	DLTIXOBRHAEAAY-NVXWUHKLSA-N	0	3	343.471	3.186	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3ncc(C)cc3C)CC[C@@H]2C1	ZINC000946690778	1332878266	/nfs/dbraw/zinc/87/82/66/1332878266.db2.gz	SMAAIRMRQNFWSP-CALCHBBNSA-N	0	3	347.890	3.235	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)C[C@@H](C)n3cccc3)CC[C@@H]2C1	ZINC000946866457	1332919123	/nfs/dbraw/zinc/91/91/23/1332919123.db2.gz	HBTZUGUPUYJQQJ-KURKYZTESA-N	0	3	349.906	3.362	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2c(F)c(F)cc(F)c2F)C[C@@H]1C	ZINC000947327503	1333090153	/nfs/dbraw/zinc/09/01/53/1333090153.db2.gz	DQSYZYZVRYYTSE-VHSXEESVSA-N	0	3	330.325	3.012	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccc(OCCC)c2)C[C@@H]1C	ZINC000947365841	1333105263	/nfs/dbraw/zinc/10/52/63/1333105263.db2.gz	UYBDDVJXLMYZBG-FUHWJXTLSA-N	0	3	328.456	3.081	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)C2(C3CC3)CC2)CCN1Cc1cccc(C#N)c1	ZINC000947426227	1333123156	/nfs/dbraw/zinc/12/31/56/1333123156.db2.gz	OIWJMSCFNRCHKT-BEFAXECRSA-N	0	3	337.467	3.218	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2coc3cc(F)ccc23)C[C@@H]1C	ZINC000947473920	1333142042	/nfs/dbraw/zinc/14/20/42/1333142042.db2.gz	PLTIRPLHTUPVAW-ZFWWWQNUSA-N	0	3	328.387	3.178	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C)nc2C(C)C)C[C@@H]1C	ZINC000947584259	1333182392	/nfs/dbraw/zinc/18/23/92/1333182392.db2.gz	HFAKBSHOGUTKDG-DLBZAZTESA-N	0	3	327.472	3.119	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3ccc(F)cc3)CCC2)C[C@@H]1C	ZINC000947597465	1333187949	/nfs/dbraw/zinc/18/79/49/1333187949.db2.gz	HHLKWCFIDGMMDH-QFBILLFUSA-N	0	3	342.458	3.240	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)C(C)(C)C2CC2)CCN1Cc1ccc(C#N)cc1	ZINC000947635576	1333202680	/nfs/dbraw/zinc/20/26/80/1333202680.db2.gz	VWVRLHBNBZFYFX-KXBFYZLASA-N	0	3	339.483	3.464	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(F)c(Cl)cc2F)C[C@@H]1C	ZINC000947676484	1333219623	/nfs/dbraw/zinc/21/96/23/1333219623.db2.gz	XIVLXJKWWCCJAS-RYUDHWBXSA-N	0	3	340.801	3.224	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2c(Cl)cncc2Cl)C[C@@H]1C	ZINC000947689903	1333225315	/nfs/dbraw/zinc/22/53/15/1333225315.db2.gz	NMXVFCFTBGAJSP-WDEREUQCSA-N	0	3	328.243	3.157	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3ccc(C#N)cc3)[C@H](C)C2)C1	ZINC000947701458	1333231768	/nfs/dbraw/zinc/23/17/68/1333231768.db2.gz	CCPASHKBXWULGG-APWZRJJASA-N	0	3	337.467	3.384	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3scnc3C)[C@@H](C)C2)C1	ZINC000947702892	1333233656	/nfs/dbraw/zinc/23/36/56/1333233656.db2.gz	UJNBSZHTJWPQKV-ZFWWWQNUSA-N	0	3	333.501	3.277	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccccc2OCC(C)C)C[C@H]1C	ZINC000947821226	1333271126	/nfs/dbraw/zinc/27/11/26/1333271126.db2.gz	RPJPXXUGJOMLCJ-MSOLQXFVSA-N	0	3	342.483	3.327	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cccc(-c3cnco3)c2)C[C@@H]1C	ZINC000947882803	1333290605	/nfs/dbraw/zinc/29/06/05/1333290605.db2.gz	XHNFEXZOKXVIFT-WMLDXEAASA-N	0	3	325.412	3.110	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnn(C(C)C)c2C2CC2)C[C@H]1C	ZINC000947913075	1333305011	/nfs/dbraw/zinc/30/50/11/1333305011.db2.gz	VCERIDWANDFEKW-ZBFHGGJFSA-N	0	3	330.476	3.110	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2c[nH]c3c2cccc3CC)C[C@H]1C	ZINC000948069186	1333363876	/nfs/dbraw/zinc/36/38/76/1333363876.db2.gz	DBDRJNVGMYOHCR-NVXWUHKLSA-N	0	3	337.467	3.336	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C(C)(C)c2ccccc2C)C[C@H]1C	ZINC000948089300	1333371521	/nfs/dbraw/zinc/37/15/21/1333371521.db2.gz	BVWPTJKZKACDDD-QZTJIDSGSA-N	0	3	326.484	3.265	20	30		EGEDHN
CN(C(=O)c1ccncc1)[C@@H]1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC000948146095	1333392562	/nfs/dbraw/zinc/39/25/62/1333392562.db2.gz	PDHVDQIDPUUDKE-HXUWFJFHSA-N	0	3	348.450	3.080	20	30		EGEDHN
CN(C(=O)c1ccco1)[C@H]1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC000948149573	1333395360	/nfs/dbraw/zinc/39/53/60/1333395360.db2.gz	XSCIGICCXPLTKR-SFHVURJKSA-N	0	3	337.423	3.278	20	30		EGEDHN
CN(C(=O)c1c[nH]c(C#N)c1)[C@@H]1CCCN(Cc2ccsc2)CC1	ZINC000948316603	1333477291	/nfs/dbraw/zinc/47/72/91/1333477291.db2.gz	RIUMWKUKKLYUGW-QGZVFWFLSA-N	0	3	342.468	3.075	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cccc(C(C)C)n2)CC1	ZINC000948590255	1333587269	/nfs/dbraw/zinc/58/72/69/1333587269.db2.gz	KTPWUPMODDLPRM-QGZVFWFLSA-N	0	3	327.472	3.155	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cc3cc(C)ccc3[nH]2)CC1	ZINC000948665909	1333621178	/nfs/dbraw/zinc/62/11/78/1333621178.db2.gz	VRCVFASTJXAXDR-GOSISDBHSA-N	0	3	337.467	3.426	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cc3ccccc3n2C)CC1	ZINC000948722252	1333646841	/nfs/dbraw/zinc/64/68/41/1333646841.db2.gz	KEXRXNVEYUYDTB-GOSISDBHSA-N	0	3	337.467	3.128	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)Cc2c(C)cc(C)cc2C)CC1	ZINC000948742175	1333655008	/nfs/dbraw/zinc/65/50/08/1333655008.db2.gz	HUZKBBMRANFCFC-FQEVSTJZSA-N	0	3	340.511	3.491	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2c(F)ccc(C)c2F)CC1	ZINC000948746751	1333656956	/nfs/dbraw/zinc/65/69/56/1333656956.db2.gz	JBYDVIIKTXEATQ-OAHLLOKOSA-N	0	3	334.410	3.223	20	30		EGEDHN
CN(C(=O)[C@@H]1CC12CC2)[C@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948809082	1333690241	/nfs/dbraw/zinc/69/02/41/1333690241.db2.gz	LTHAZYYIMYJFRN-OALUTQOASA-N	0	3	337.467	3.171	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@@H]1CNC(=O)c1cc(C#N)c[nH]1	ZINC000948902811	1333727385	/nfs/dbraw/zinc/72/73/85/1333727385.db2.gz	VMPZICVSZQEERP-FQEVSTJZSA-N	0	3	348.450	3.182	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@@H]1CNC(=O)c1cccnc1C	ZINC000948955182	1333747222	/nfs/dbraw/zinc/74/72/22/1333747222.db2.gz	UBKMZNWEUVZZMR-FQEVSTJZSA-N	0	3	335.451	3.295	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@@]34C[C@@H]3CCCC4)CC2)C1	ZINC000949469141	1333856915	/nfs/dbraw/zinc/85/69/15/1333856915.db2.gz	SXDUHLPSFQGGPN-RXVVDRJESA-N	0	3	346.515	3.226	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)Cc2ccc(CCCC)cc2)C1	ZINC000967252447	1335678953	/nfs/dbraw/zinc/67/89/53/1335678953.db2.gz	DPRPIAFNTPQVRT-NQIIRXRSSA-N	0	3	340.511	3.422	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccc3cc(C)ccc3n2)C1	ZINC000967293640	1335692554	/nfs/dbraw/zinc/69/25/54/1335692554.db2.gz	WICYNOXWLHSJQG-JXFKEZNVSA-N	0	3	335.451	3.007	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2cc3ccccc3cc2F)C1	ZINC000967307631	1335695301	/nfs/dbraw/zinc/69/53/01/1335695301.db2.gz	AIFJITVHPDZZIE-MGPUTAFESA-N	0	3	338.426	3.442	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cc3c(cc(C)cc3C)[nH]2)C1	ZINC000967463467	1335748399	/nfs/dbraw/zinc/74/83/99/1335748399.db2.gz	IDWVDQPCXANOAI-QRWLVFNGSA-N	0	3	337.467	3.248	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2cc3ccc(OC)cc3[nH]2)C1	ZINC000967655001	1335800971	/nfs/dbraw/zinc/80/09/71/1335800971.db2.gz	GYESVGQFSDXJCZ-AUUYWEPGSA-N	0	3	341.455	3.193	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CN(CCOC3CCC3)CC[C@@H]2C)CC1	ZINC000968193975	1335869538	/nfs/dbraw/zinc/86/95/38/1335869538.db2.gz	XGMWRDNQKHKEFF-QFBILLFUSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CN(CC3CC(F)(F)C3)CC[C@H]2C)C1	ZINC000968273660	1335882370	/nfs/dbraw/zinc/88/23/70/1335882370.db2.gz	IJVBFDMVZCUTSM-UKRRQHHQSA-N	0	3	326.431	3.215	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccc(C(F)F)c(F)c2)C1	ZINC000968327977	1335890971	/nfs/dbraw/zinc/89/09/71/1335890971.db2.gz	VPSRUQXRMYLEPQ-MLGOLLRUSA-N	0	3	338.373	3.227	20	30		EGEDHN
CC1(C)C(C(=O)N2CC[C@@H](NCc3ccc(C#N)c(F)c3)C2)C1(C)C	ZINC000968337720	1335894021	/nfs/dbraw/zinc/89/40/21/1335894021.db2.gz	DWSGHWBTRJSLDW-OAHLLOKOSA-N	0	3	343.446	3.070	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(C3CC3)nc2C)C1	ZINC000968341709	1335894687	/nfs/dbraw/zinc/89/46/87/1335894687.db2.gz	YINAOZNHFYJZPQ-KUHUBIRLSA-N	0	3	327.472	3.284	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)Cc2ccc(F)c(Cl)c2)C1	ZINC000968354388	1335899339	/nfs/dbraw/zinc/89/93/39/1335899339.db2.gz	RYNVLXBYNNIRHI-GUYCJALGSA-N	0	3	338.854	3.424	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2ccc(OC)c(C3CC3)c2)C1	ZINC000968484716	1335937535	/nfs/dbraw/zinc/93/75/35/1335937535.db2.gz	TXHFPMJBKQOPJB-HNAYVOBHSA-N	0	3	340.467	3.036	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)C2(c3ccccc3F)CC2)C1	ZINC000968498051	1335942323	/nfs/dbraw/zinc/94/23/23/1335942323.db2.gz	VVTDDRGHAWLROR-CRAIPNDOSA-N	0	3	330.447	3.260	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2ccc(-c3c[nH]cn3)cc2)C1	ZINC000968500833	1335943730	/nfs/dbraw/zinc/94/37/30/1335943730.db2.gz	KGVZMZIFDUHKST-HNAYVOBHSA-N	0	3	338.455	3.093	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)C23CC4CC(CC(C4)C2)C3)C1	ZINC000968575384	1335968081	/nfs/dbraw/zinc/96/80/81/1335968081.db2.gz	VWRFPPRVCGVJBS-VJRVKHOTSA-N	0	3	328.500	3.053	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2cccc(OCC(C)C)c2)C1	ZINC000968628331	1335990287	/nfs/dbraw/zinc/99/02/87/1335990287.db2.gz	WNMHPXJYVGJCGO-YLJYHZDGSA-N	0	3	342.483	3.185	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2ccc(OCC)c(OC)c2)C1	ZINC000968635116	1335991175	/nfs/dbraw/zinc/99/11/75/1335991175.db2.gz	FUBXQYCZQDPFIA-DOTOQJQBSA-N	0	3	346.471	3.110	20	30		EGEDHN
N#Cc1ccc(CN2CCCCC[C@@H]2CNC(=O)c2ccncc2)cc1	ZINC000968735594	1336031748	/nfs/dbraw/zinc/03/17/48/1336031748.db2.gz	LHIIWIHOLHMYRB-HXUWFJFHSA-N	0	3	348.450	3.128	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)NC[C@@H]1CCCCCN1Cc1ccc(C#N)cc1	ZINC000968816363	1336059588	/nfs/dbraw/zinc/05/95/88/1336059588.db2.gz	ULSUSJUJWIZFQY-RBUKOAKNSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1cccc(OCCC)c1	ZINC000968876940	1336075844	/nfs/dbraw/zinc/07/58/44/1336075844.db2.gz	LNUUZBPKVXEZER-IBGZPJMESA-N	0	3	342.483	3.473	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccc(-n2cccn2)cc1	ZINC000968890316	1336081212	/nfs/dbraw/zinc/08/12/12/1336081212.db2.gz	GNAGBHCYQMGOHY-IBGZPJMESA-N	0	3	338.455	3.033	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)[C@@H]1CCc2ccc(OC)cc21	ZINC000968890601	1336081707	/nfs/dbraw/zinc/08/17/07/1336081707.db2.gz	LQKMQISQKOGVLX-IEBWSBKVSA-N	0	3	342.483	3.272	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1n[nH]c(C2CC2)c1Cl	ZINC000968933915	1336095169	/nfs/dbraw/zinc/09/51/69/1336095169.db2.gz	GYPAWEBJGNDVLZ-ZDUSSCGKSA-N	0	3	336.867	3.101	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1n[nH]c(C2CC2)c1Cl	ZINC000968933914	1336095250	/nfs/dbraw/zinc/09/52/50/1336095250.db2.gz	GYPAWEBJGNDVLZ-CYBMUJFWSA-N	0	3	336.867	3.101	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1c[nH]c(=O)c2ccccc12	ZINC000969060263	1336133941	/nfs/dbraw/zinc/13/39/41/1336133941.db2.gz	XZVZAEVKVYTVSX-OAHLLOKOSA-N	0	3	339.439	3.101	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1coc(CC2CC2)n1	ZINC000969097565	1336141872	/nfs/dbraw/zinc/14/18/72/1336141872.db2.gz	NIVFKFWWYNMWDT-MRXNPFEDSA-N	0	3	331.460	3.178	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(C(=O)[C@H]3CC[C@@H]4C[C@@H]4CC3)C2)s1	ZINC000969429924	1336209145	/nfs/dbraw/zinc/20/91/45/1336209145.db2.gz	YFLMLEZANSVXKF-QKPAOTATSA-N	0	3	343.496	3.137	20	30		EGEDHN
CC(C)(C(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1)C1CCC1	ZINC000969482384	1336216874	/nfs/dbraw/zinc/21/68/74/1336216874.db2.gz	PLRZVXKBOVFGKK-QGZVFWFLSA-N	0	3	343.446	3.214	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CC[C@@H](N[C@H](C)c3ccccc3F)C2)cc1	ZINC000969548050	1336221573	/nfs/dbraw/zinc/22/15/73/1336221573.db2.gz	FBGGHEZSURWMBX-CRAIPNDOSA-N	0	3	336.410	3.372	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)c2ccc(F)c(Cl)c2F)C1	ZINC000970374520	1336299630	/nfs/dbraw/zinc/29/96/30/1336299630.db2.gz	PRBOQVZDKBJFCM-JTQLQIEISA-N	0	3	328.790	3.244	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C1)c1ccccc1	ZINC000970526902	1336317436	/nfs/dbraw/zinc/31/74/36/1336317436.db2.gz	KKFUUVZYXJQTHU-GDBMZVCRSA-N	0	3	339.464	3.114	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)c2cc(F)c3ncccc3c2)C1	ZINC000970593053	1336325294	/nfs/dbraw/zinc/32/52/94/1336325294.db2.gz	FRMQPFDFCUNEBM-CYBMUJFWSA-N	0	3	327.403	3.000	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cnccc2C(F)(F)F)CC1	ZINC001006058977	1336444654	/nfs/dbraw/zinc/44/46/54/1336444654.db2.gz	WTDGKILLMHNZBF-UHFFFAOYSA-N	0	3	341.377	3.213	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)Cc2ccccc2OC(C)C)CC1	ZINC001006137625	1336457362	/nfs/dbraw/zinc/45/73/62/1336457362.db2.gz	YIVYPYBERLPMSH-UHFFFAOYSA-N	0	3	330.472	3.125	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cccc(C(F)(F)F)n2)CC1	ZINC001006184973	1336463888	/nfs/dbraw/zinc/46/38/88/1336463888.db2.gz	VIOPFQVSKQINSC-UHFFFAOYSA-N	0	3	341.377	3.213	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)C[C@H]2CCc3ccccc3C2)CC1	ZINC001006337057	1336491323	/nfs/dbraw/zinc/49/13/23/1336491323.db2.gz	HYJYPIYQMOAPOZ-KRWDZBQOSA-N	0	3	326.484	3.290	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)[C@@H]2C[C@H]2c2cccc(F)c2F)CC1	ZINC001006428761	1336504265	/nfs/dbraw/zinc/50/42/65/1336504265.db2.gz	MGECOSNOXWWQLB-JKSUJKDBSA-N	0	3	334.410	3.177	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)C2CC(c3ccc(F)cc3)C2)CC1	ZINC001006481487	1336515014	/nfs/dbraw/zinc/51/50/14/1336515014.db2.gz	SGVSWRQWBGARBM-UHFFFAOYSA-N	0	3	330.447	3.428	20	30		EGEDHN
N#Cc1c[nH]c(C(=O)N[C@H]2CCCN(Cc3ccccc3C3CC3)C2)c1	ZINC001007028367	1336627958	/nfs/dbraw/zinc/62/79/58/1336627958.db2.gz	HPZUTVQUSYJMRK-SFHVURJKSA-N	0	3	348.450	3.158	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2ccnc(-c3ccco3)c2)C1	ZINC001007571832	1336669876	/nfs/dbraw/zinc/66/98/76/1336669876.db2.gz	TWNXDFXWEDQZCU-MRXNPFEDSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N[C@@H]1CCCN(CC[C@H](C)F)C1	ZINC001007676225	1336687846	/nfs/dbraw/zinc/68/78/46/1336687846.db2.gz	WJUBRHDTFRLJBR-JKSUJKDBSA-N	0	3	334.435	3.194	20	30		EGEDHN
C#CCCN1CCC[C@H](NC(=O)Cc2ccc(CCCC)cc2)C1	ZINC001007817531	1336706793	/nfs/dbraw/zinc/70/67/93/1336706793.db2.gz	NLDDVAXRBHTFPE-FQEVSTJZSA-N	0	3	326.484	3.176	20	30		EGEDHN
C#CCCN1CCC[C@H](NC(=O)C(C)(C)c2ccc(Cl)cc2)C1	ZINC001008370092	1336836713	/nfs/dbraw/zinc/83/67/13/1336836713.db2.gz	HSPLHPALUMDLFI-KRWDZBQOSA-N	0	3	332.875	3.222	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CCCN([C@@H](CC)c3ccccc3)C2)c1	ZINC001008465699	1336863605	/nfs/dbraw/zinc/86/36/05/1336863605.db2.gz	ACJSKWKKVDQHLX-SFTDATJTSA-N	0	3	347.462	3.408	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@@H]1CCCN(Cc2ccc(C)cc2)C1	ZINC001009351290	1337010084	/nfs/dbraw/zinc/01/00/84/1337010084.db2.gz	HZBCNDXHUKHCNW-JOCHJYFZSA-N	0	3	346.474	3.300	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N[C@@H]1CCN(Cc2cc(C)sc2C)C1	ZINC001014472948	1337790794	/nfs/dbraw/zinc/79/07/94/1337790794.db2.gz	XREIBAPFWMDJGJ-KURKYZTESA-N	0	3	348.512	3.037	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CCN(Cc2cc(C)cc(C)c2)C1	ZINC001014726026	1337887029	/nfs/dbraw/zinc/88/70/29/1337887029.db2.gz	VPPBJZXNGJWIPC-IBGZPJMESA-N	0	3	337.467	3.295	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCN(C[C@H](OC)c3ccccc3)C2)CC1	ZINC001015660295	1338239583	/nfs/dbraw/zinc/23/95/83/1338239583.db2.gz	XBRYONAWEUKWFO-PMACEKPBSA-N	0	3	342.483	3.311	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](NC(=O)c2coc(-c3ccccc3)n2)C1	ZINC001016010468	1338405122	/nfs/dbraw/zinc/40/51/22/1338405122.db2.gz	UMDGOLLEPWPCHU-MRXNPFEDSA-N	0	3	325.412	3.112	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2ccc(CC(C)C)s2)CC1	ZINC001016662808	1338683280	/nfs/dbraw/zinc/68/32/80/1338683280.db2.gz	DMCZXHUVYHJFOD-QGZVFWFLSA-N	0	3	330.497	3.164	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(C)c3cccnc23)CC1	ZINC001016734863	1338706449	/nfs/dbraw/zinc/70/64/49/1338706449.db2.gz	YSIFFBWHPJRKNV-IBGZPJMESA-N	0	3	347.462	3.151	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)[C@@H](C)c2c(F)cccc2F)CC1	ZINC001016738959	1338707991	/nfs/dbraw/zinc/70/79/91/1338707991.db2.gz	UVSWDZOADWLWQC-YOEHRIQHSA-N	0	3	346.421	3.062	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CC23CCN(C/C=C\Cl)CC3)cc1	ZINC001016761760	1338715908	/nfs/dbraw/zinc/71/59/08/1338715908.db2.gz	PBAUNRVXZCJJBL-ZZBREXMISA-N	0	3	328.843	3.005	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)[C@H]2CC[C@H](C(C)C)CC2)CC1	ZINC001016903022	1338764465	/nfs/dbraw/zinc/76/44/65/1338764465.db2.gz	UTLGSAACAUPBHS-GUDVDZBRSA-N	0	3	330.516	3.443	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2cc3cc(C)ccc3s2)CC1	ZINC001016910667	1338766876	/nfs/dbraw/zinc/76/68/76/1338766876.db2.gz	YJVVXXABOVBLNN-GOSISDBHSA-N	0	3	338.476	3.427	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cc3c(s2)CCCC3)CC1	ZINC001016959381	1338784989	/nfs/dbraw/zinc/78/49/89/1338784989.db2.gz	SAKFTBLMOWSPKA-GOSISDBHSA-N	0	3	342.508	3.235	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccc(CC(C)C)cc2)CC1	ZINC001016968808	1338786797	/nfs/dbraw/zinc/78/67/97/1338786797.db2.gz	PPRNXOUYSUBBOH-HXUWFJFHSA-N	0	3	338.495	3.493	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cc(C)c(F)c(C)c2)CC1	ZINC001016979734	1338790949	/nfs/dbraw/zinc/79/09/49/1338790949.db2.gz	SACTUQSUCVWFLU-QGZVFWFLSA-N	0	3	328.431	3.050	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2cc3cccc(Cl)c3o2)CC1	ZINC001017008158	1338802992	/nfs/dbraw/zinc/80/29/92/1338802992.db2.gz	LDPKCYPFZSULEH-INIZCTEOSA-N	0	3	342.826	3.304	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCCN(C(=O)[C@H]2CC23CC3)C1	ZINC001017217358	1338959207	/nfs/dbraw/zinc/95/92/07/1338959207.db2.gz	HXKZJUOGJOJSHN-WMLDXEAASA-N	0	3	343.496	3.090	20	30		EGEDHN
CC1CCC(CN2C[C@H]3CC[C@@H](C2)N3C(=O)c2ccc(C#N)[nH]2)CC1	ZINC001017484215	1339356464	/nfs/dbraw/zinc/35/64/64/1339356464.db2.gz	ZXGFLLVZRIETQN-SAJCDORXSA-N	0	3	340.471	3.001	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1coc2cc(F)ccc12	ZINC001017547714	1339365209	/nfs/dbraw/zinc/36/52/09/1339365209.db2.gz	JEZLHTRWNDCSPP-CALCHBBNSA-N	0	3	342.414	3.366	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cccc2c1COCC2	ZINC001017609216	1339376956	/nfs/dbraw/zinc/37/69/56/1339376956.db2.gz	OXZPSGAUTKAJNW-HDICACEKSA-N	0	3	340.467	3.014	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccn2c1CCCC2	ZINC001017623807	1339378427	/nfs/dbraw/zinc/37/84/27/1339378427.db2.gz	BBWXUEBFGVAIQW-CALCHBBNSA-N	0	3	327.472	3.079	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2ncccc2c1	ZINC001017881345	1339438619	/nfs/dbraw/zinc/43/86/19/1339438619.db2.gz	MQQRUZPDDIZLMO-KDURUIRLSA-N	0	3	335.451	3.490	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)Cc1c(C)noc1C	ZINC001018037228	1339488105	/nfs/dbraw/zinc/48/81/05/1339488105.db2.gz	LXRQQBYAATWQDW-JCGIZDLHSA-N	0	3	345.487	3.111	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2c(c1)C[C@@H](C)O2	ZINC001018064593	1339493648	/nfs/dbraw/zinc/49/36/48/1339493648.db2.gz	GFOHGEUANBKLFH-LZQZEXGQSA-N	0	3	340.467	3.265	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1CCO[C@H](CCC)C1	ZINC001018106541	1339502463	/nfs/dbraw/zinc/50/24/63/1339502463.db2.gz	CFHSBMOPGFVZNE-INDMIFKZSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H](C)c1ccc(OC)cc1	ZINC001018293250	1339565412	/nfs/dbraw/zinc/56/54/12/1339565412.db2.gz	SUROVDJIPCSJRL-QRQLOZEOSA-N	0	3	342.483	3.440	20	30		EGEDHN
CC1(C)C(C(=O)N2CC[C@H](NCc3ccc(F)c(C#N)c3)C2)C1(C)C	ZINC001018676794	1339698922	/nfs/dbraw/zinc/69/89/22/1339698922.db2.gz	GLAJNNLVHJOGCH-HNNXBMFYSA-N	0	3	343.446	3.070	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1cc(C)oc1C(F)(F)F	ZINC001028172754	1340466894	/nfs/dbraw/zinc/46/68/94/1340466894.db2.gz	KVWTWUVSQAVEPP-GFCCVEGCSA-N	0	3	330.350	3.377	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1cccc(-c2cnco2)c1	ZINC001028235569	1340497616	/nfs/dbraw/zinc/49/76/16/1340497616.db2.gz	AHEJTQLHFQJXCT-KRWDZBQOSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1ccc(COC(C)C)cc1	ZINC001028308956	1340557585	/nfs/dbraw/zinc/55/75/85/1340557585.db2.gz	OAUNICUXSZTGDO-IBGZPJMESA-N	0	3	330.472	3.382	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1cc(Cl)cc2c1OCC2	ZINC001028337042	1340573692	/nfs/dbraw/zinc/57/36/92/1340573692.db2.gz	GMEWDBJUOHYOOJ-HNNXBMFYSA-N	0	3	334.847	3.045	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](CNC(=O)C3CCCCCC3)C2)cc1	ZINC001028443229	1340644416	/nfs/dbraw/zinc/64/44/16/1340644416.db2.gz	OIEFWVSXYVWJLA-IBGZPJMESA-N	0	3	339.483	3.467	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](CNC(=O)c3ccoc3C3CC3)C2)cc1	ZINC001028762291	1340798097	/nfs/dbraw/zinc/79/80/97/1340798097.db2.gz	IVJDNJLGUTYFBZ-QGZVFWFLSA-N	0	3	349.434	3.281	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CCN(Cc3cnc(C)s3)C2)CC1	ZINC001028779023	1340809816	/nfs/dbraw/zinc/80/98/16/1340809816.db2.gz	SGHVSAOMYBMKMS-HNNXBMFYSA-N	0	3	333.501	3.136	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CCN(Cc3oc(CC)nc3C)C2)CC1	ZINC001028780537	1340812909	/nfs/dbraw/zinc/81/29/09/1340812909.db2.gz	KUPSXMICDMHSKK-MRXNPFEDSA-N	0	3	345.487	3.230	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H](CNC(=O)[C@@H]3CC34CCCC4)C2)c1	ZINC001028908431	1340881051	/nfs/dbraw/zinc/88/10/51/1340881051.db2.gz	MCCKQVNPQPCILK-MOPGFXCFSA-N	0	3	337.467	3.077	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)c2ccc(Cl)c(Cl)c2)C1	ZINC001028950270	1340892049	/nfs/dbraw/zinc/89/20/49/1340892049.db2.gz	ZQOCJRUGZSJQGM-LBPRGKRZSA-N	0	3	325.239	3.068	20	30		EGEDHN
CCCC(=O)N1CCC([C@@H](C)NCc2cc(F)ccc2C#N)CC1	ZINC001029037352	1340914159	/nfs/dbraw/zinc/91/41/59/1340914159.db2.gz	DHRHYZDUKJDFLI-CQSZACIVSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC([C@H](C)NCc2cnc(C)o2)CC1	ZINC001029139744	1340940766	/nfs/dbraw/zinc/94/07/66/1340940766.db2.gz	IDSZEIRAVSTGFK-IFXJQAMLSA-N	0	3	333.476	3.302	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)C1CCN(C(=O)CC(C)(F)F)CC1	ZINC001029140510	1340940863	/nfs/dbraw/zinc/94/08/63/1340940863.db2.gz	XKKJBJOMPDHJRW-CQSZACIVSA-N	0	3	349.425	3.320	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCN(C(=O)CCC2CCC2)C1	ZINC001029691166	1341044921	/nfs/dbraw/zinc/04/49/21/1341044921.db2.gz	BRBOGWXJCWGJJM-MRXNPFEDSA-N	0	3	345.512	3.480	20	30		EGEDHN
C[C@H](c1cc(F)ccc1F)N(C)C[C@@H]1CCN(C(=O)C#CC2CC2)C1	ZINC001029734407	1341058128	/nfs/dbraw/zinc/05/81/28/1341058128.db2.gz	WXJMTPQMVYQRPZ-ZBFHGGJFSA-N	0	3	346.421	3.220	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](CN(C)[C@@H](C)c2cnc(C)cn2)C1	ZINC001029799753	1341076628	/nfs/dbraw/zinc/07/66/28/1341076628.db2.gz	CWMIWOFKUJFWEJ-IRXDYDNUSA-N	0	3	344.503	3.229	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](CN(C)Cc3ccc(F)cn3)C2)CC1	ZINC001029826048	1341087475	/nfs/dbraw/zinc/08/74/75/1341087475.db2.gz	LMTZCOPJYIYKOJ-INIZCTEOSA-N	0	3	345.462	3.247	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](CN(C)Cc3cnc(C)s3)C2)C1	ZINC001029836499	1341092130	/nfs/dbraw/zinc/09/21/30/1341092130.db2.gz	QLTNGVKGGDAMSO-HNNXBMFYSA-N	0	3	333.501	3.088	20	30		EGEDHN
Cc1cccc(Cl)c1CN(C)CC1CCN(C(=O)[C@H](C)C#N)CC1	ZINC001029946135	1341130928	/nfs/dbraw/zinc/13/09/28/1341130928.db2.gz	HNWVRPLDJSTVPO-OAHLLOKOSA-N	0	3	347.890	3.479	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC(CN(C)Cc2cc(C)no2)CC1	ZINC001029989793	1341147813	/nfs/dbraw/zinc/14/78/13/1341147813.db2.gz	BWIDDQKQDUXTTD-LJQANCHMSA-N	0	3	333.476	3.256	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC(CN(C)Cc2cnc(C)nc2)CC1	ZINC001029990384	1341148387	/nfs/dbraw/zinc/14/83/87/1341148387.db2.gz	KXWUTTNXBBXJRP-FQEVSTJZSA-N	0	3	344.503	3.058	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC(CN(C)Cc3conc3CC)CC2)C1	ZINC001029994118	1341150618	/nfs/dbraw/zinc/15/06/18/1341150618.db2.gz	WIARKQVWIFZCEV-UHFFFAOYSA-N	0	3	345.487	3.264	20	30		EGEDHN
CC(C)(C)C(=O)N[C@@H]1C[C@@H](NCc2cc(C#N)ccc2F)C12CCC2	ZINC001078788278	1357083925	/nfs/dbraw/zinc/08/39/25/1357083925.db2.gz	FFHVLAHYLVKFLG-IAGOWNOFSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NCC1CN([C@@H](C)c2cccc(C)c2)C1	ZINC001031680605	1341387296	/nfs/dbraw/zinc/38/72/96/1341387296.db2.gz	JRCRJNBSQZRVGQ-DBVUQKKJSA-N	0	3	342.483	3.085	20	30		EGEDHN
C#Cc1ccc(C(=O)NCC2CN([C@H]3CCc4ccccc43)C2)cc1	ZINC001031892082	1341417579	/nfs/dbraw/zinc/41/75/79/1341417579.db2.gz	LTOYRBHRCJKAOF-NRFANRHFSA-N	0	3	330.431	3.017	20	30		EGEDHN
C#Cc1ccc(C(=O)NCC2CN(CCc3ccccc3CC)C2)cc1	ZINC001031891940	1341417646	/nfs/dbraw/zinc/41/76/46/1341417646.db2.gz	FSNHFNYRHSLJMP-UHFFFAOYSA-N	0	3	346.474	3.135	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cc(F)cc2ccoc21	ZINC001032488637	1341521728	/nfs/dbraw/zinc/52/17/28/1341521728.db2.gz	MPSZQQPSZIYGKH-HOTGVXAUSA-N	0	3	328.387	3.437	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H]2C[C@H]1CN2C[C@H]1CCc2ccccc2C1	ZINC001032562230	1341540943	/nfs/dbraw/zinc/54/09/43/1341540943.db2.gz	NRNMZNLXMATEHQ-VDGAXYAQSA-N	0	3	338.495	3.289	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(F)c2ccncc12	ZINC001032580248	1341547982	/nfs/dbraw/zinc/54/79/82/1341547982.db2.gz	IEUSTRZPEDHREF-GJZGRUSLSA-N	0	3	339.414	3.239	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C(C)(C)c1cccc(F)c1	ZINC001032622713	1341563208	/nfs/dbraw/zinc/56/32/08/1341563208.db2.gz	VLSPZHDCDPCAFO-ROUUACIJSA-N	0	3	330.447	3.355	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C[C@@H]1OCCc2ccsc21	ZINC001032740938	1341597606	/nfs/dbraw/zinc/59/76/06/1341597606.db2.gz	OSZWXVMARHHKRQ-ULQDDVLXSA-N	0	3	346.496	3.003	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H](C)Cc1cccc(Cl)c1	ZINC001032819347	1341626440	/nfs/dbraw/zinc/62/64/40/1341626440.db2.gz	VQSIFRBLFMIXPP-JLSDUUJJSA-N	0	3	332.875	3.380	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2coc3c2cccc3OC)C1	ZINC001033080879	1341718150	/nfs/dbraw/zinc/71/81/50/1341718150.db2.gz	DUFNSYFEHKSKNJ-AWEZNQCLSA-N	0	3	328.412	3.164	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N(C)[C@H]1CCN(Cc2ccc(C)cc2)C1	ZINC001033093669	1341720885	/nfs/dbraw/zinc/72/08/85/1341720885.db2.gz	VRBQSQHQFXVOGS-ZCNNSNEGSA-N	0	3	342.483	3.009	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2cc3c([nH]2)c(F)ccc3C)C1	ZINC001033203027	1341751811	/nfs/dbraw/zinc/75/18/11/1341751811.db2.gz	AYYXXRKQYQKGOG-CQSZACIVSA-N	0	3	329.419	3.338	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)Cc2c(C)[nH]c3ccccc32)C1	ZINC001033386877	1341806874	/nfs/dbraw/zinc/80/68/74/1341806874.db2.gz	FKIGEULDOVBJOX-MRXNPFEDSA-N	0	3	325.456	3.128	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2cnc3ccc(F)cc3c2)C1	ZINC001033556006	1341870462	/nfs/dbraw/zinc/87/04/62/1341870462.db2.gz	WBWKUCZUZSAHPE-KRWDZBQOSA-N	0	3	327.403	3.096	20	30		EGEDHN
C#CCCN1CC[C@@H](N(C)C(=O)c2ccc(O[C@H](C)CC)cc2)C1	ZINC001033566915	1341876380	/nfs/dbraw/zinc/87/63/80/1341876380.db2.gz	MAIAKZCBNLCMOA-SJLPKXTDSA-N	0	3	328.456	3.034	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@H]2CCN(Cc3cc(C)cc(C)c3)C2)nc1	ZINC001033592798	1341888510	/nfs/dbraw/zinc/88/85/10/1341888510.db2.gz	JFVLMGDXVYDLFK-FQEVSTJZSA-N	0	3	347.462	3.026	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2cccc(C(F)(F)F)c2)C1	ZINC001033604912	1341895065	/nfs/dbraw/zinc/89/50/65/1341895065.db2.gz	AFCIISYYYLISGO-OAHLLOKOSA-N	0	3	326.362	3.428	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)[C@@]2(C)CCc3ccccc3C2)C1	ZINC001033713799	1341972751	/nfs/dbraw/zinc/97/27/51/1341972751.db2.gz	IOFRADLYAQUPJT-CTNGQTDRSA-N	0	3	326.484	3.290	20	30		EGEDHN
C=CCCN1CC[C@H](N(CC)C(=O)c2sc(C3CC3)nc2C)C1	ZINC001033828658	1342029165	/nfs/dbraw/zinc/02/91/65/1342029165.db2.gz	QZHLMHRHYGPIBY-HNNXBMFYSA-N	0	3	333.501	3.441	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2cccc(C(F)F)c2F)C1	ZINC001033830935	1342030874	/nfs/dbraw/zinc/03/08/74/1342030874.db2.gz	PZBLYIPEYCVVQS-CYBMUJFWSA-N	0	3	338.373	3.323	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cc(F)cc3ccncc32)C1	ZINC001033834145	1342033904	/nfs/dbraw/zinc/03/39/04/1342033904.db2.gz	TVOXJYUNOMBRDZ-KRWDZBQOSA-N	0	3	341.430	3.486	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccc3cc(C)cn3c2)C1	ZINC001033852937	1342044572	/nfs/dbraw/zinc/04/45/72/1342044572.db2.gz	OYXXWJOKFXFQTC-IBGZPJMESA-N	0	3	325.456	3.360	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cc(-c3ccccc3)n[nH]2)C1	ZINC001033890496	1342064111	/nfs/dbraw/zinc/06/41/11/1342064111.db2.gz	PSXAZPWVEUYZQG-QGZVFWFLSA-N	0	3	338.455	3.189	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2coc3ccc(OC)cc23)C1	ZINC001033894764	1342067640	/nfs/dbraw/zinc/06/76/40/1342067640.db2.gz	KDONPKUDSMTNBC-OAHLLOKOSA-N	0	3	340.423	3.001	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@H]2COc3ccc(Cl)cc32)C1	ZINC001033902085	1342074704	/nfs/dbraw/zinc/07/47/04/1342074704.db2.gz	XPOIEJCUTXLIFN-WBVHZDCISA-N	0	3	348.874	3.315	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2ccc3nc(C)ccc3c2)C1	ZINC001033995011	1342135922	/nfs/dbraw/zinc/13/59/22/1342135922.db2.gz	UQKAMGDLBPKIRR-IBGZPJMESA-N	0	3	335.451	3.103	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cccc3c2ccn3C)C1	ZINC001033992671	1342135979	/nfs/dbraw/zinc/13/59/79/1342135979.db2.gz	WEFUMOAJBKJQSN-INIZCTEOSA-N	0	3	325.456	3.291	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2ccc3nc(C)sc3c2)C1	ZINC001034006942	1342144659	/nfs/dbraw/zinc/14/46/59/1342144659.db2.gz	GYPYQGHWVDJYFH-MRXNPFEDSA-N	0	3	341.480	3.164	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2c[nH]c3ccc(F)cc32)C1	ZINC001034054846	1342195587	/nfs/dbraw/zinc/19/55/87/1342195587.db2.gz	RPOZLYBEYBVGNM-OAHLLOKOSA-N	0	3	329.419	3.420	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2ccc(-c3ccccc3)[nH]2)C1	ZINC001034056527	1342198198	/nfs/dbraw/zinc/19/81/98/1342198198.db2.gz	LBULKGCUYKHOMW-SFHVURJKSA-N	0	3	335.451	3.241	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2cncc(-c3ccccc3)c2)C1	ZINC001034239760	1342339953	/nfs/dbraw/zinc/33/99/53/1342339953.db2.gz	MILLIGYTHGLWJZ-NRFANRHFSA-N	0	3	347.462	3.356	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2cc(C3CCCCC3)n[nH]2)C1	ZINC001034243638	1342343496	/nfs/dbraw/zinc/34/34/96/1342343496.db2.gz	HLGBOKRBWVOQCE-QGZVFWFLSA-N	0	3	342.487	3.065	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CCCCN(Cc2ccccc2)C1	ZINC001034246437	1342343874	/nfs/dbraw/zinc/34/38/74/1342343874.db2.gz	DJLPPXNKJYNZAF-IBGZPJMESA-N	0	3	337.467	3.459	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@@H]2Cc3cc(Cl)ccc3O2)C1	ZINC001034296378	1342379516	/nfs/dbraw/zinc/37/95/16/1342379516.db2.gz	IXHPFMLVENEEGK-WMZOPIPTSA-N	0	3	348.874	3.190	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@H]2CCc3cc(F)ccc32)C1	ZINC001034312642	1342393680	/nfs/dbraw/zinc/39/36/80/1342393680.db2.gz	RAJMNNBBMVFCGG-MJGOQNOKSA-N	0	3	330.447	3.402	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2sccc2-n2cccc2)C1	ZINC001034333981	1342408326	/nfs/dbraw/zinc/40/83/26/1342408326.db2.gz	CGPZCEVSOVZSNG-MRXNPFEDSA-N	0	3	341.480	3.146	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCCN(Cc3ccccc3)C2)cc1	ZINC001034341769	1342414358	/nfs/dbraw/zinc/41/43/58/1342414358.db2.gz	ZCEZPGDFAWQTQY-NRFANRHFSA-N	0	3	332.447	3.452	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)C2(c3cccnc3)CCCC2)C1	ZINC001034363714	1342434143	/nfs/dbraw/zinc/43/41/43/1342434143.db2.gz	FLKMFPQIVKXBSK-SFHVURJKSA-N	0	3	327.472	3.050	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2c(F)ccc(F)c2F)C1	ZINC001034372513	1342441191	/nfs/dbraw/zinc/44/11/91/1342441191.db2.gz	NALAENHUUUSBAR-GFCCVEGCSA-N	0	3	326.362	3.264	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@@H]2CCO[C@H]2c2ccccc2)C1	ZINC001034437732	1342500272	/nfs/dbraw/zinc/50/02/72/1342500272.db2.gz	BXMMZMTVKGOAQU-AQNXPRMDSA-N	0	3	342.483	3.311	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2c(F)cccc2F)C12CCC2	ZINC001078791320	1357085492	/nfs/dbraw/zinc/08/54/92/1357085492.db2.gz	HTDIHJLUPDZBHZ-ZIAGYGMSSA-N	0	3	340.801	3.348	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cnn([C@@H](C)CC)c2C)C1	ZINC001034482559	1342540076	/nfs/dbraw/zinc/54/00/76/1342540076.db2.gz	CVSGUKMLWFPHOQ-RDJZCZTQSA-N	0	3	332.492	3.323	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)Cc2c[nH]c3cccc(C)c23)C1	ZINC001034492343	1342547931	/nfs/dbraw/zinc/54/79/31/1342547931.db2.gz	CHGOMFMFADGOCC-KRWDZBQOSA-N	0	3	325.456	3.176	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)Cc2ccc(OC(C)C)cc2)C1	ZINC001034534728	1342591311	/nfs/dbraw/zinc/59/13/11/1342591311.db2.gz	AMXSNJSFQWNHGM-GOSISDBHSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cc(C)n(C(C)(C)C)n2)C1	ZINC001034537711	1342595224	/nfs/dbraw/zinc/59/52/24/1342595224.db2.gz	KFLJQTBJIXYFBV-INIZCTEOSA-N	0	3	332.492	3.107	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc(N(CC)CC)nc2)C1	ZINC001034546724	1342608939	/nfs/dbraw/zinc/60/89/39/1342608939.db2.gz	DTJLMNAGJSXHRW-SFHVURJKSA-N	0	3	344.503	3.088	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2cc(F)cc(F)c2)C12CCC2	ZINC001078800133	1357091295	/nfs/dbraw/zinc/09/12/95/1357091295.db2.gz	JBVBGNOHELGJGT-CABCVRRESA-N	0	3	340.801	3.348	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)c(F)c1	ZINC001035012380	1342874738	/nfs/dbraw/zinc/87/47/38/1342874738.db2.gz	YUPVHVYAXPZJEP-QGZVFWFLSA-N	0	3	343.446	3.380	20	30		EGEDHN
C[C@]1(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)s2)C=CCC1	ZINC001035017583	1342877947	/nfs/dbraw/zinc/87/79/47/1342877947.db2.gz	WXCAKLVOZXWEQK-KDOFPFPSSA-N	0	3	329.469	3.057	20	30		EGEDHN
C[C@@]1(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)s2)C=CCC1	ZINC001035017584	1342878098	/nfs/dbraw/zinc/87/80/98/1342878098.db2.gz	WXCAKLVOZXWEQK-RDTXWAMCSA-N	0	3	329.469	3.057	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@@H]2CNCc2cncc(F)c2)CC1	ZINC001035039711	1342892732	/nfs/dbraw/zinc/89/27/32/1342892732.db2.gz	OITBMFUKNHTDCB-GOSISDBHSA-N	0	3	331.435	3.048	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2cccn2C(C)C)C12CCC2	ZINC001078816169	1357096553	/nfs/dbraw/zinc/09/65/53/1357096553.db2.gz	IRAPUKZWWCFFKV-HZPDHXFCSA-N	0	3	335.879	3.452	20	30		EGEDHN
C=C[C@@H](C(=O)N1CCC[C@@H]1CNCc1cncc(C)c1)c1ccccc1	ZINC001035131917	1342948698	/nfs/dbraw/zinc/94/86/98/1342948698.db2.gz	YRUZMZXHGGCXQI-NHCUHLMSSA-N	0	3	349.478	3.440	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC2(CCN(Cc3conc3C)C2)CC1	ZINC001035222316	1343043920	/nfs/dbraw/zinc/04/39/20/1343043920.db2.gz	FAOCOVXMTIJXCE-IBGZPJMESA-N	0	3	345.487	3.400	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@@H](CC)OC1CCCCC1)CC2	ZINC001035706966	1343144440	/nfs/dbraw/zinc/14/44/40/1343144440.db2.gz	QMIPDUHZOBCCKK-LJQANCHMSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc(C)c(OC)c(C)c1)CC2	ZINC001035710485	1343145634	/nfs/dbraw/zinc/14/56/34/1343145634.db2.gz	USHLZMIONOALDL-UHFFFAOYSA-N	0	3	342.483	3.426	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc3ccncc3s1)CC2	ZINC001035723952	1343153363	/nfs/dbraw/zinc/15/33/63/1343153363.db2.gz	NWXOVGWJAUPRHC-UHFFFAOYSA-N	0	3	341.480	3.410	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C[C@H]1CCC(C)(C)CO1)CC2	ZINC001035752306	1343170895	/nfs/dbraw/zinc/17/08/95/1343170895.db2.gz	FYCNQOMXGZUEMH-QGZVFWFLSA-N	0	3	334.504	3.082	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@H]1CCCC[C@@H]1C1CC1)CC2	ZINC001035757242	1343173010	/nfs/dbraw/zinc/17/30/10/1343173010.db2.gz	IBMWJLOAEOCKRP-MOPGFXCFSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cc3ccc(C)cc3[nH]1)CC2	ZINC001035763646	1343176405	/nfs/dbraw/zinc/17/64/05/1343176405.db2.gz	LKDPYMQLOUFWKM-UHFFFAOYSA-N	0	3	335.451	3.038	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H]1CCCc3cccnc31)CC2	ZINC001035772514	1343184426	/nfs/dbraw/zinc/18/44/26/1343184426.db2.gz	DPFWHWAVLQDFOF-GOSISDBHSA-N	0	3	339.483	3.002	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C1(C(F)F)CCCC1)CC2	ZINC001035775424	1343185887	/nfs/dbraw/zinc/18/58/87/1343185887.db2.gz	WWJBLRRFPZPUNI-UHFFFAOYSA-N	0	3	326.431	3.312	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccc(C(C)C)nc1C)CC2	ZINC001035797375	1343203724	/nfs/dbraw/zinc/20/37/24/1343203724.db2.gz	ZUJBCESUHUDVIH-UHFFFAOYSA-N	0	3	339.483	3.075	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cn(CC)nc1C(C)C)CC2	ZINC001035803955	1343206466	/nfs/dbraw/zinc/20/64/66/1343206466.db2.gz	DCHWSOYSQGTCBW-UHFFFAOYSA-N	0	3	344.503	3.141	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1oc(CC(C)C)nc1C)CC2	ZINC001035813121	1343211683	/nfs/dbraw/zinc/21/16/83/1343211683.db2.gz	ZNKFXXPXAHJASQ-UHFFFAOYSA-N	0	3	345.487	3.296	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H](CC)c1c(C)noc1C)CC2	ZINC001035820050	1343214556	/nfs/dbraw/zinc/21/45/56/1343214556.db2.gz	RVYUXVXWBQQEFI-KRWDZBQOSA-N	0	3	345.487	3.286	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@](C)(OC)c1ccccc1)CC2	ZINC001035838671	1343221153	/nfs/dbraw/zinc/22/11/53/1343221153.db2.gz	YWRVSVXWWVSDRY-HXUWFJFHSA-N	0	3	342.483	3.049	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@H](C)c1ccc(F)cc1F)CC2	ZINC001035855751	1343232560	/nfs/dbraw/zinc/23/25/60/1343232560.db2.gz	VKLMXRRJJQCWRO-OAHLLOKOSA-N	0	3	346.421	3.016	20	30		EGEDHN
C[C@H]1CN(C(=O)C#CC2CC2)CC[C@@H]1NCc1c(F)cccc1Cl	ZINC001036020241	1343308687	/nfs/dbraw/zinc/30/86/87/1343308687.db2.gz	CBJPMZJRCKAMGY-UGSOOPFHSA-N	0	3	348.849	3.219	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](NCc2csc(CC)n2)[C@H](C)C1	ZINC001036148717	1343330591	/nfs/dbraw/zinc/33/05/91/1343330591.db2.gz	FTCCTYNWPYLDRW-UKRRQHHQSA-N	0	3	335.517	3.244	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](NCc3nc(C)sc3C)[C@H](C)C2)C1	ZINC001036171828	1343344392	/nfs/dbraw/zinc/34/43/92/1343344392.db2.gz	ZRDMFWNAQCYISP-CJNGLKHVSA-N	0	3	347.528	3.443	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3cnc(C)o3)[C@H](C)C2)CC1	ZINC001036174606	1343346681	/nfs/dbraw/zinc/34/66/81/1343346681.db2.gz	PUNGFIBEEJXEQW-RDTXWAMCSA-N	0	3	331.460	3.056	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCCN(C(=O)/C=C\C2CC2)C1	ZINC001036389443	1343459563	/nfs/dbraw/zinc/45/95/63/1343459563.db2.gz	ROKJPGLAGINHIQ-PLWNRMESSA-N	0	3	337.467	3.241	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC[C@H]([C@@H](C)NCc2ccccc2C#N)C1	ZINC001036394991	1343463216	/nfs/dbraw/zinc/46/32/16/1343463216.db2.gz	SIVYTQPIUQUZIE-XJLXGCDSSA-N	0	3	325.456	3.241	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@H]([C@H](C)NCc3cnns3)C2)CC1	ZINC001036431674	1343483277	/nfs/dbraw/zinc/48/32/77/1343483277.db2.gz	UQRNISMIKOKZJG-HOCLYGCPSA-N	0	3	348.516	3.001	20	30		EGEDHN
C[C@H]1CCCN(C(=O)CC2CC2)[C@@H]1CNCc1ccc(C#N)s1	ZINC001036492112	1343515014	/nfs/dbraw/zinc/51/50/14/1343515014.db2.gz	BPZUFUVVXWRUCO-SUMWQHHRSA-N	0	3	331.485	3.137	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@H](C)[C@@H]1CNCc1ccc(C#N)s1	ZINC001036503598	1343521639	/nfs/dbraw/zinc/52/16/39/1343521639.db2.gz	ODUGIDZWYIJLSY-YOEHRIQHSA-N	0	3	331.485	3.303	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CN(C(=O)/C=C\C4CC4)CC[C@@H]32)s1	ZINC001036677559	1343618377	/nfs/dbraw/zinc/61/83/77/1343618377.db2.gz	DJXCGCGVMGMLCI-MXGRSMPHSA-N	0	3	341.480	3.009	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001036687246	1343630724	/nfs/dbraw/zinc/63/07/24/1343630724.db2.gz	ZOPBZDUNYKWLPE-XJKSGUPXSA-N	0	3	347.459	3.306	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H]2[C@H](CCN2C/C=C\Cl)C1	ZINC001036726491	1343658195	/nfs/dbraw/zinc/65/81/95/1343658195.db2.gz	NDKCUBKEOBVACS-ALCJFRFOSA-N	0	3	331.287	3.440	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@@H]2[C@H](CCN2CC#Cc2ccccc2)C1	ZINC001036804042	1343738533	/nfs/dbraw/zinc/73/85/33/1343738533.db2.gz	DAFJXDOUIQLNIU-WOJBJXKFSA-N	0	3	338.495	3.397	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@@H]2[C@@H](CCN2CC#Cc2ccc(F)cc2)C1	ZINC001036876182	1343815498	/nfs/dbraw/zinc/81/54/98/1343815498.db2.gz	LTHUXBZVTGRLQR-PKOBYXMFSA-N	0	3	342.458	3.146	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCC[C@H]1NC(=O)c1ccsc1	ZINC001036939112	1343882837	/nfs/dbraw/zinc/88/28/37/1343882837.db2.gz	FRGZQAKQUIJJMN-FUHWJXTLSA-N	0	3	339.464	3.308	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCC[C@@H]1NC(=O)Cc1ccccc1	ZINC001037031657	1343939647	/nfs/dbraw/zinc/93/96/47/1343939647.db2.gz	NFXUFJVFUOPGKW-RTWAWAEBSA-N	0	3	347.462	3.175	20	30		EGEDHN
CC(C)(C(=O)N[C@H]1CCC[C@H]1CNCc1ccccc1C#N)C1CC1	ZINC001037059971	1343955428	/nfs/dbraw/zinc/95/54/28/1343955428.db2.gz	HFUANKQCJFDCQE-HKUYNNGSSA-N	0	3	339.483	3.369	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](NCc3cscn3)[C@H](CC)C2)C1	ZINC001037913961	1344175111	/nfs/dbraw/zinc/17/51/11/1344175111.db2.gz	IQBFEIZJNNHSMU-ZBFHGGJFSA-N	0	3	333.501	3.216	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1sccc1-n1cccc1	ZINC001038577130	1344490700	/nfs/dbraw/zinc/49/07/00/1344490700.db2.gz	YDMAJKKNNALHBE-HNNXBMFYSA-N	0	3	329.469	3.309	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCN2CCCc2cccc(C)c2)cc1	ZINC001038588483	1344496592	/nfs/dbraw/zinc/49/65/92/1344496592.db2.gz	IXBRVQYERWGKBN-JOCHJYFZSA-N	0	3	346.474	3.413	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1cc(F)c(Cl)cc1F	ZINC001038641565	1344517767	/nfs/dbraw/zinc/51/77/67/1344517767.db2.gz	OSCCTGFKNURVAJ-LLVKDONJSA-N	0	3	328.790	3.389	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1ccc2nc(C)sc2c1	ZINC001038880577	1344627198	/nfs/dbraw/zinc/62/71/98/1344627198.db2.gz	HXNWKWMCHNPPRY-OAHLLOKOSA-N	0	3	329.469	3.375	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)[C@@H](CC)SC)CC2)C1	ZINC001039119076	1344792789	/nfs/dbraw/zinc/79/27/89/1344792789.db2.gz	VMFOILYRGCRSCJ-HZPDHXFCSA-N	0	3	344.952	3.441	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)[C@H]3C[C@@H]3C(F)F)CC2)C1	ZINC001039123676	1344798702	/nfs/dbraw/zinc/79/87/02/1344798702.db2.gz	FJQDELLEYHOJIT-ILXRZTDVSA-N	0	3	346.849	3.201	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC([C@H]2CCN(CC=C(Cl)Cl)C2)CC1	ZINC001039127675	1344804776	/nfs/dbraw/zinc/80/47/76/1344804776.db2.gz	SDPMUDWMIDHKAO-JSGCOSHPSA-N	0	3	344.286	3.026	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)[C@H]3CCC3(F)F)CC2)C1	ZINC001039142852	1344824361	/nfs/dbraw/zinc/82/43/61/1344824361.db2.gz	OXOMTTYMSGGYPN-HUUCEWRRSA-N	0	3	346.849	3.345	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)[C@@H]3CCC3(F)F)CC2)C1	ZINC001039142850	1344824796	/nfs/dbraw/zinc/82/47/96/1344824796.db2.gz	OXOMTTYMSGGYPN-CABCVRRESA-N	0	3	346.849	3.345	20	30		EGEDHN
CCC(=O)N1CCCC[C@H]1[C@@H]1CCN(Cc2ccc(C#N)s2)C1	ZINC001039181650	1344878509	/nfs/dbraw/zinc/87/85/09/1344878509.db2.gz	YWGBZMZCYSYLMH-PBHICJAKSA-N	0	3	331.485	3.233	20	30		EGEDHN
O=C(C(F)F)N1CCCC[C@@H]1[C@H]1CCN(CC#Cc2ccccc2)C1	ZINC001039183501	1344882771	/nfs/dbraw/zinc/88/27/71/1344882771.db2.gz	KSHUXVRRELKQDF-ZWKOTPCHSA-N	0	3	346.421	3.006	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cccc(F)c2C)C1	ZINC001039211761	1344926574	/nfs/dbraw/zinc/92/65/74/1344926574.db2.gz	VBHQEJREDMSDRB-QFBILLFUSA-N	0	3	328.431	3.084	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cccc(F)c2C)C1	ZINC001039211760	1344926924	/nfs/dbraw/zinc/92/69/24/1344926924.db2.gz	VBHQEJREDMSDRB-LPHOPBHVSA-N	0	3	328.431	3.084	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2nc(C)sc2C)C1	ZINC001039219995	1344938255	/nfs/dbraw/zinc/93/82/55/1344938255.db2.gz	WKMCWVSYVSPASH-SJORKVTESA-N	0	3	345.512	3.100	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc(C(C)C)no2)C1	ZINC001039234415	1344955148	/nfs/dbraw/zinc/95/51/48/1344955148.db2.gz	JJMLLCYTIWHMGB-FUHWJXTLSA-N	0	3	343.471	3.138	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)C2CCC(F)(F)CC2)C1	ZINC001039238340	1344962198	/nfs/dbraw/zinc/96/21/98/1344962198.db2.gz	NDSXKMOZXOURJF-DLBZAZTESA-N	0	3	338.442	3.148	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc3ccccc3[nH]2)C1	ZINC001039238855	1344962970	/nfs/dbraw/zinc/96/29/70/1344962970.db2.gz	KVZQRCLQLTVEKJ-FXAWDEMLSA-N	0	3	335.451	3.118	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ncccc2Cl)C1	ZINC001039249987	1344980416	/nfs/dbraw/zinc/98/04/16/1344980416.db2.gz	LFKGSILYMCUTRF-DOTOQJQBSA-N	0	3	345.874	3.075	20	30		EGEDHN
Cc1ccc(CN2CC[C@H]3CC[C@@H](C2)N3C(=O)[C@H](C)C#N)cc1C	ZINC001039348807	1345023525	/nfs/dbraw/zinc/02/35/25/1345023525.db2.gz	DUONASVHCYONCG-QRQLOZEOSA-N	0	3	325.456	3.028	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1C[C@H]1c1sccc1C	ZINC001039374635	1345033010	/nfs/dbraw/zinc/03/30/10/1345033010.db2.gz	CZTLBEBNCLYRDU-XMTFNYHQSA-N	0	3	342.508	3.249	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(C)c(OC)c(C)c1	ZINC001039378930	1345035012	/nfs/dbraw/zinc/03/50/12/1345035012.db2.gz	OAXZBFIRYOMFOY-MOPGFXCFSA-N	0	3	340.467	3.014	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccc2cnccc21	ZINC001039394848	1345044193	/nfs/dbraw/zinc/04/41/93/1345044193.db2.gz	KWFYKSSYHOANCD-MOPGFXCFSA-N	0	3	335.451	3.029	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(C)n([C@H](C)CC)n1	ZINC001039398401	1345045720	/nfs/dbraw/zinc/04/57/20/1345045720.db2.gz	WHBCRVIWQQJFSW-NXHRZFHOSA-N	0	3	344.503	3.418	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C(C)(C)C1CCOCC1	ZINC001039402774	1345049069	/nfs/dbraw/zinc/04/90/69/1345049069.db2.gz	QFUDJYVRLWIGNX-MSOLQXFVSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1Cc2ccc(F)cc21	ZINC001039425831	1345062618	/nfs/dbraw/zinc/06/26/18/1345062618.db2.gz	YZWCPVUDEHUGBZ-ZIFCJYIRSA-N	0	3	328.431	3.107	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(F)cc(Cl)c1	ZINC001039441923	1345068257	/nfs/dbraw/zinc/06/82/57/1345068257.db2.gz	FUBNFWJEAHEUSL-SJORKVTESA-N	0	3	334.822	3.181	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](CC)OC1CCCC1	ZINC001039446182	1345071113	/nfs/dbraw/zinc/07/11/13/1345071113.db2.gz	WQGJDMMYKBCNBF-ZIFCJYIRSA-N	0	3	334.504	3.366	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](CC)OC1CCCC1	ZINC001039446181	1345071271	/nfs/dbraw/zinc/07/12/71/1345071271.db2.gz	WQGJDMMYKBCNBF-AOIWGVFYSA-N	0	3	334.504	3.366	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1C[C@H]1c1ccc(C)s1	ZINC001039449303	1345073646	/nfs/dbraw/zinc/07/36/46/1345073646.db2.gz	MVUNLNRYXIZGBT-XMTFNYHQSA-N	0	3	342.508	3.249	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccccc1OC(C)C	ZINC001039461526	1345080146	/nfs/dbraw/zinc/08/01/46/1345080146.db2.gz	WEJYGIMXKRTBND-MSOLQXFVSA-N	0	3	340.467	3.176	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1c(F)cccc1Cl	ZINC001039461966	1345080665	/nfs/dbraw/zinc/08/06/65/1345080665.db2.gz	SNXHKTATKUQXLA-KGLIPLIRSA-N	0	3	336.838	3.273	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc2c(c1)CCCC2	ZINC001039468505	1345086152	/nfs/dbraw/zinc/08/61/52/1345086152.db2.gz	QTVHPMOWNZYDDI-RTWAWAEBSA-N	0	3	338.495	3.359	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccc(OCC)c1	ZINC001039475020	1345089677	/nfs/dbraw/zinc/08/96/77/1345089677.db2.gz	ZJPVDRYDYYAZFW-MOPGFXCFSA-N	0	3	342.483	3.269	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC1CC(OCC)C1	ZINC001039820717	1345199127	/nfs/dbraw/zinc/19/91/27/1345199127.db2.gz	LUAHOBQWJGWVNX-ZTOOSOLZSA-N	0	3	334.504	3.079	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CCC[C@@H](C1)N2CCC1CCOCC1	ZINC001039896818	1345239628	/nfs/dbraw/zinc/23/96/28/1345239628.db2.gz	QOZQVEZPWOGCBR-ZVDOUQERSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC[C@@H]1CCCO1	ZINC001039897114	1345239658	/nfs/dbraw/zinc/23/96/58/1345239658.db2.gz	USZCSRYAGWBDGU-DMUMMCEESA-N	0	3	334.504	3.223	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1C[C@H]2CCC[C@@H](C1)N2CCC1CC1	ZINC001039984167	1345279754	/nfs/dbraw/zinc/27/97/54/1345279754.db2.gz	TZMJEDPOZFMNJB-OYRHEFFESA-N	0	3	336.479	3.076	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@]3(CCN(C(=O)c4ccoc4)C3)C2)c1	ZINC001040069003	1345319957	/nfs/dbraw/zinc/31/99/57/1345319957.db2.gz	ADMCMIPQUOFNPR-OAQYLSRUSA-N	0	3	349.434	3.280	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@]3(CCN(C(=O)c4ccoc4)C3)C2)cc1	ZINC001040069324	1345320413	/nfs/dbraw/zinc/32/04/13/1345320413.db2.gz	DBTOCPWSNGFXJC-OAQYLSRUSA-N	0	3	349.434	3.280	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cc(F)c(C)cc3F)C2)C1	ZINC001040250059	1345395285	/nfs/dbraw/zinc/39/52/85/1345395285.db2.gz	IXNIGXIXWPNAOO-HXUWFJFHSA-N	0	3	346.421	3.225	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3cc4ccc(C)cc4[nH]3)C2)C1	ZINC001040314143	1345426734	/nfs/dbraw/zinc/42/67/34/1345426734.db2.gz	ABNFWBDWWDXZEI-OAQYLSRUSA-N	0	3	335.451	3.038	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3csc4ccccc34)C2)C1	ZINC001040319723	1345429554	/nfs/dbraw/zinc/42/95/54/1345429554.db2.gz	JOPZRYRERYMJFC-HXUWFJFHSA-N	0	3	338.476	3.463	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)N1CC[C@@]2(C1)CCCN(Cc1cccc(C#N)c1)C2	ZINC001040330140	1345436029	/nfs/dbraw/zinc/43/60/29/1345436029.db2.gz	CTXLAFVGILUADC-BSIFCXSSSA-N	0	3	337.467	3.029	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(Cl)cc3C)C2)C1	ZINC001040371620	1345460032	/nfs/dbraw/zinc/46/00/32/1345460032.db2.gz	KDLJOCAWDUXLFW-LJQANCHMSA-N	0	3	330.859	3.210	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@H](C)c3cccs3)C2)C1	ZINC001040390190	1345471855	/nfs/dbraw/zinc/47/18/55/1345471855.db2.gz	HMBGPQFMWCYYQW-APWZRJJASA-N	0	3	330.497	3.189	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cc(F)c(F)c(F)c3)C2)C1	ZINC001040412998	1345483301	/nfs/dbraw/zinc/48/33/01/1345483301.db2.gz	XCYCNWCRULUKHQ-GOSISDBHSA-N	0	3	338.373	3.218	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@@H](C)c3cccc(C)c3)C2)C1	ZINC001040422402	1345489305	/nfs/dbraw/zinc/48/93/05/1345489305.db2.gz	MLHAQCAAJLJGAJ-UGKGYDQZSA-N	0	3	338.495	3.436	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@H]3C[C@@H]3c3ccccc3)C2)C1	ZINC001040433723	1345497032	/nfs/dbraw/zinc/49/70/32/1345497032.db2.gz	YTRYBCFOVKQRIZ-URVUXULASA-N	0	3	336.479	3.128	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@H]3CC[C@H](C(C)C)CC3)C2)C1	ZINC001040471976	1345511030	/nfs/dbraw/zinc/51/10/30/1345511030.db2.gz	VEGAZGWJRGKGHT-SFHLNBCPSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ccc4ccncc4c3)C2)C1	ZINC001040482867	1345515313	/nfs/dbraw/zinc/51/53/13/1345515313.db2.gz	ACXPWTZMDFHQCZ-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@@H](C)c3ccc(C)s3)C2)C1	ZINC001040491161	1345517610	/nfs/dbraw/zinc/51/76/10/1345517610.db2.gz	FSQDDPAJVQDFBH-FXAWDEMLSA-N	0	3	344.524	3.498	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cc4c(C)cccn4c3)C2)C1	ZINC001040492660	1345518421	/nfs/dbraw/zinc/51/84/21/1345518421.db2.gz	UENQKMSDEGOBBS-QFIPXVFZSA-N	0	3	349.478	3.199	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@@H]3C[C@H]3c3ccccc3)C2)C1	ZINC001040501432	1345521697	/nfs/dbraw/zinc/52/16/97/1345521697.db2.gz	YTRYBCFOVKQRIZ-TUNNFDKTSA-N	0	3	336.479	3.128	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)Cc3cc(C)ccc3F)C2)C1	ZINC001040503843	1345523727	/nfs/dbraw/zinc/52/37/27/1345523727.db2.gz	VHQGBSKEWYHTQP-NRFANRHFSA-N	0	3	342.458	3.014	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)Cc3cccc4ccccc43)C2)C1	ZINC001040503847	1345524371	/nfs/dbraw/zinc/52/43/71/1345524371.db2.gz	VLWVWTXXGUKYRJ-HSZRJFAPSA-N	0	3	346.474	3.330	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3c[nH]cc3-c3ccccc3)C2)C1	ZINC001040530552	1345534876	/nfs/dbraw/zinc/53/48/76/1345534876.db2.gz	CBWHOGDMVNTYLS-QFIPXVFZSA-N	0	3	347.462	3.243	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)CC(C3CC3)C3CC3)C2)C1	ZINC001040543131	1345538422	/nfs/dbraw/zinc/53/84/22/1345538422.db2.gz	HLDGEYCTRURINW-OAQYLSRUSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3c[nH]c4ccc(C)cc34)C2)C1	ZINC001040546441	1345541020	/nfs/dbraw/zinc/54/10/20/1345541020.db2.gz	DIRYYFPEAMBFAU-QFIPXVFZSA-N	0	3	349.478	3.428	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3csc(CC(C)C)n3)C2)C1	ZINC001040552270	1345544423	/nfs/dbraw/zinc/54/44/23/1345544423.db2.gz	ZVLVQNTWFZOZQN-LJQANCHMSA-N	0	3	347.528	3.456	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@@H]3CCCC4(CC4)C3)C2)CC1	ZINC001040704508	1345567955	/nfs/dbraw/zinc/56/79/55/1345567955.db2.gz	YJPOUVAYHSLCDQ-GOSISDBHSA-N	0	3	328.500	3.295	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC2(C1)CCN(Cc1cncc(C)c1)CC2	ZINC001040803009	1345579798	/nfs/dbraw/zinc/57/97/98/1345579798.db2.gz	XFGFQIAHJYYCLT-UHFFFAOYSA-N	0	3	341.499	3.417	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@@H](C)c3ccccc3F)C2)CC1	ZINC001040889389	1345594631	/nfs/dbraw/zinc/59/46/31/1345594631.db2.gz	BBOXTYYXGXEHJY-KRWDZBQOSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3sccc3C3CC3)C2)CC1	ZINC001040931777	1345604628	/nfs/dbraw/zinc/60/46/28/1345604628.db2.gz	WBSXPSSQSDPHFA-UHFFFAOYSA-N	0	3	328.481	3.187	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@@H]3CC4CCC3CC4)C2)CC1	ZINC001040952978	1345608921	/nfs/dbraw/zinc/60/89/21/1345608921.db2.gz	HPSAPZUPLNDNBJ-CTWPCTMYSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC(C)(C)CC(=O)N1CC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001041051314	1345636835	/nfs/dbraw/zinc/63/68/35/1345636835.db2.gz	IBXQGTJVRUXEPT-NRFANRHFSA-N	0	3	339.483	3.419	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@]3(CCN(C(=O)[C@@H]4CC=CCC4)C3)C2)cc1	ZINC001041064242	1345640898	/nfs/dbraw/zinc/64/08/98/1345640898.db2.gz	QBDUAWGASLJTQO-IFMALSPDSA-N	0	3	349.478	3.339	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@]3(CCN(C(=O)CC4CCC4)C3)C2)cc1	ZINC001041169104	1345664854	/nfs/dbraw/zinc/66/48/54/1345664854.db2.gz	HMMFRZCVHDZONG-OAQYLSRUSA-N	0	3	337.467	3.173	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001041196713	1345674202	/nfs/dbraw/zinc/67/42/02/1345674202.db2.gz	TZUUAXVUTAAVEY-HXUWFJFHSA-N	0	3	341.430	3.246	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)[C@@H]3CC[C@@H](c4ccccc4)C3)C2)C1	ZINC001041401755	1345719494	/nfs/dbraw/zinc/71/94/94/1345719494.db2.gz	DSLIXKQJNHKNIH-SJBKTWHCSA-N	0	3	336.479	3.128	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@]3(CCN(C(=O)[C@]45C[C@H]4CCC5)C3)C2)c1	ZINC001041491423	1345743878	/nfs/dbraw/zinc/74/38/78/1345743878.db2.gz	INGZJVNQXADTEQ-CEMLEFRQSA-N	0	3	349.478	3.173	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@]2(CCN(Cc3cnc(C)s3)C2)C1	ZINC001041625931	1345800017	/nfs/dbraw/zinc/80/00/17/1345800017.db2.gz	MPUQHBTYBVKDCV-MOPGFXCFSA-N	0	3	347.528	3.478	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3ccc(O[C@@H](C)CC)cc3)C2)C1	ZINC001041774108	1345845418	/nfs/dbraw/zinc/84/54/18/1345845418.db2.gz	RLLNLCSUVUQCAZ-UWJYYQICSA-N	0	3	340.467	3.035	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)C(C)(C)c3ccc(CC)cc3)C2)C1	ZINC001041782030	1345847801	/nfs/dbraw/zinc/84/78/01/1345847801.db2.gz	OYRNFUKUOWQZTA-JOCHJYFZSA-N	0	3	338.495	3.084	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3cc4cccc(Cl)c4o3)C2)C1	ZINC001041868156	1345877551	/nfs/dbraw/zinc/87/75/51/1345877551.db2.gz	FYXKADJSMLCUPF-LJQANCHMSA-N	0	3	342.826	3.257	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3csc(C(F)(F)F)c3)C[C@H]21	ZINC001042132661	1345952480	/nfs/dbraw/zinc/95/24/80/1345952480.db2.gz	HEYXBRFUNPXNSZ-WCQYABFASA-N	0	3	344.402	3.489	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)Cc3cccc(C(C)C)c3)C[C@@H]21	ZINC001042136291	1345953378	/nfs/dbraw/zinc/95/33/78/1345953378.db2.gz	UDXUDUGUGFNQPH-CTNGQTDRSA-N	0	3	338.495	3.299	20	30		EGEDHN
C#CCN1CC[C@H]2CCN(C(=O)CCc3ccc(C)c(Cl)c3)C[C@@H]21	ZINC001042168356	1345963911	/nfs/dbraw/zinc/96/39/11/1345963911.db2.gz	USJIMOKJJJIGHH-HKUYNNGSSA-N	0	3	344.886	3.137	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(-c4cccs4)on3)C[C@@H]21	ZINC001042171013	1345965917	/nfs/dbraw/zinc/96/59/17/1345965917.db2.gz	BUVGIRNAVCIAMK-ZFWWWQNUSA-N	0	3	343.452	3.126	20	30		EGEDHN
CC1(C(=O)N2CC[C@@H]3CCN(Cc4cccc(C#N)c4)[C@H]3C2)CCC1	ZINC001042182990	1345971078	/nfs/dbraw/zinc/97/10/78/1345971078.db2.gz	HQYDDRCQOXPNLA-OALUTQOASA-N	0	3	337.467	3.171	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3cccc(F)c3)[C@@H]2C1	ZINC001042183684	1345971140	/nfs/dbraw/zinc/97/11/40/1345971140.db2.gz	PZFWVFJAWGDMGJ-FUHWJXTLSA-N	0	3	330.447	3.461	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cc4cc(C)ccc4[nH]3)C[C@H]21	ZINC001042183985	1345972242	/nfs/dbraw/zinc/97/22/42/1345972242.db2.gz	SDFCZLYXTYGEOX-OXJNMPFZSA-N	0	3	335.451	3.036	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3cccnc3C)[C@H]2C1	ZINC001042186642	1345974452	/nfs/dbraw/zinc/97/44/52/1345974452.db2.gz	IWUWPMFLJBYNTH-AEFFLSMTSA-N	0	3	327.472	3.025	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cnc4ccsc4c3)C[C@H]21	ZINC001042189048	1345975715	/nfs/dbraw/zinc/97/57/15/1345975715.db2.gz	ZSCFSSQTRNKREM-XJKSGUPXSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3ccc(F)c(F)c3F)C[C@@H]21	ZINC001042207753	1345986059	/nfs/dbraw/zinc/98/60/59/1345986059.db2.gz	SYFGWZBGPWZSKO-WFASDCNBSA-N	0	3	338.373	3.216	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]3CCN(Cc4ccc(C#N)cc4)[C@@H]3C2)C1	ZINC001042224313	1345994387	/nfs/dbraw/zinc/99/43/87/1345994387.db2.gz	LKEMDJRSLCFCNI-WOJBJXKFSA-N	0	3	349.478	3.337	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]3CCN(Cc4ncccc4C)[C@@H]3C2)C1	ZINC001042228075	1345996747	/nfs/dbraw/zinc/99/67/47/1345996747.db2.gz	PLZYHDCDZAKNAP-PKOBYXMFSA-N	0	3	339.483	3.169	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3cnc(C)nc3C(C)C)C[C@@H]21	ZINC001042254296	1346007230	/nfs/dbraw/zinc/00/72/30/1346007230.db2.gz	KGCBZWMKTKUNAB-AEFFLSMTSA-N	0	3	342.487	3.021	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc4nc(C)ccc4c3)C[C@H]21	ZINC001042278958	1346015970	/nfs/dbraw/zinc/01/59/70/1346015970.db2.gz	CIHXVUJDFDHYCZ-OXJNMPFZSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccsc3C(F)(F)F)C[C@@H]21	ZINC001042326001	1346035121	/nfs/dbraw/zinc/03/51/21/1346035121.db2.gz	KWFIZZHRRMCDMS-YPMHNXCESA-N	0	3	344.402	3.489	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3cc4[nH]ccc4s3)C[C@@H]21	ZINC001042327340	1346036362	/nfs/dbraw/zinc/03/63/62/1346036362.db2.gz	WGWFWRPOCJDZAZ-ZFWWWQNUSA-N	0	3	329.469	3.342	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(OC(C)C)cc3)C[C@H]21	ZINC001042331240	1346038907	/nfs/dbraw/zinc/03/89/07/1346038907.db2.gz	ADPBUHHRNOVYRO-QFBILLFUSA-N	0	3	328.456	3.196	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C3(c4ccc(Cl)cc4)CC3)C[C@H]21	ZINC001042340949	1346046081	/nfs/dbraw/zinc/04/60/81/1346046081.db2.gz	JOUARSBABQGTRN-MAUKXSAKSA-N	0	3	344.886	3.480	20	30		EGEDHN
C#CCN1CC[C@H]2CCN(C(=O)CC(C)(C)c3ccc(C)cc3)C[C@@H]21	ZINC001042345273	1346047861	/nfs/dbraw/zinc/04/78/61/1346047861.db2.gz	KNWHDKHTXCIHMD-ICSRJNTNSA-N	0	3	338.495	3.219	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C3(c4cc(C)cc(C)c4)CC3)C[C@@H]21	ZINC001042360140	1346054168	/nfs/dbraw/zinc/05/41/68/1346054168.db2.gz	NUUVQZIXMVCABX-QUCCMNQESA-N	0	3	338.495	3.444	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3cc(C)n(C(C)(C)C)n3)C[C@H]21	ZINC001042360985	1346055726	/nfs/dbraw/zinc/05/57/26/1346055726.db2.gz	ZKZRGCITLLDOII-SJLPKXTDSA-N	0	3	344.503	3.059	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3cc(C)n(C(C)(C)C)n3)C[C@@H]21	ZINC001042360983	1346056100	/nfs/dbraw/zinc/05/61/00/1346056100.db2.gz	ZKZRGCITLLDOII-AEFFLSMTSA-N	0	3	344.503	3.059	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3c[nH]c4ccc(C)cc34)C[C@H]21	ZINC001042371052	1346060703	/nfs/dbraw/zinc/06/07/03/1346060703.db2.gz	KOIVSDRZRJBGMI-OXJNMPFZSA-N	0	3	335.451	3.036	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3c[nH]c4ccc(C)cc34)C[C@H]21	ZINC001042371053	1346060955	/nfs/dbraw/zinc/06/09/55/1346060955.db2.gz	KOIVSDRZRJBGMI-OXQOHEQNSA-N	0	3	335.451	3.036	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc(-c4ccccc4)[nH]3)C[C@H]21	ZINC001042373486	1346062205	/nfs/dbraw/zinc/06/22/05/1346062205.db2.gz	GPHFLTOHTHFTPL-WIYYLYMNSA-N	0	3	347.462	3.241	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccccc3CC(C)C)C[C@H]21	ZINC001042373933	1346062433	/nfs/dbraw/zinc/06/24/33/1346062433.db2.gz	FILYRBIKRIYSPN-WIYYLYMNSA-N	0	3	338.495	3.445	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@H](NCc2cc(F)ccc2C#N)C[C@@H]1C	ZINC001044423472	1346325157	/nfs/dbraw/zinc/32/51/57/1346325157.db2.gz	WNYINTDXSJPGHR-KSSFIOAISA-N	0	3	331.435	3.213	20	30		EGEDHN
C[C@H]1C[C@H](NCc2cc(F)ccc2C#N)CCN1C(=O)c1ccoc1	ZINC001044457219	1346337652	/nfs/dbraw/zinc/33/76/52/1346337652.db2.gz	FSGFDTGRVAXAQP-SCLBCKFNSA-N	0	3	341.386	3.073	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@H](NCc2cc(F)ccc2C#N)C[C@H]1C	ZINC001044541653	1346364499	/nfs/dbraw/zinc/36/44/99/1346364499.db2.gz	DLWLAEWRESPVCM-DYVFJYSZSA-N	0	3	347.409	3.430	20	30		EGEDHN
Cc1coc(C(=O)N2CC[C@@H](NCc3ccccc3C#N)C[C@@H]2C)c1	ZINC001044717025	1346409976	/nfs/dbraw/zinc/40/99/76/1346409976.db2.gz	QFPZYEKEYZHSKE-MAUKXSAKSA-N	0	3	337.423	3.243	20	30		EGEDHN
C[C@H](NC[C@@H]1CCCN1C(=O)C#CC1CC1)c1ccccc1Cl	ZINC001045028214	1346483020	/nfs/dbraw/zinc/48/30/20/1346483020.db2.gz	DCJOECVDBFCFKQ-HOCLYGCPSA-N	0	3	330.859	3.395	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]1CNCc1cc(C)ccc1OC	ZINC001045147522	1346505912	/nfs/dbraw/zinc/50/59/12/1346505912.db2.gz	JWNHFUMWYBHWQR-KRWDZBQOSA-N	0	3	330.472	3.296	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H]1CNCc1ccc(C#N)cc1F	ZINC001045149205	1346506572	/nfs/dbraw/zinc/50/65/72/1346506572.db2.gz	VHKUVQZBHGMKKN-KRWDZBQOSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H]1CNCc1cccc(Cl)n1	ZINC001045182197	1346517686	/nfs/dbraw/zinc/51/76/86/1346517686.db2.gz	NZVONWFBJHCNEJ-MAUKXSAKSA-N	0	3	335.879	3.418	20	30		EGEDHN
CC1(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)s2)CC=CC1	ZINC001045183794	1346518558	/nfs/dbraw/zinc/51/85/58/1346518558.db2.gz	XDOXJYUYTYBKJK-AWEZNQCLSA-N	0	3	329.469	3.057	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC001045440808	1346594427	/nfs/dbraw/zinc/59/44/27/1346594427.db2.gz	PXNIDDRMLXUWSL-UHFFFAOYSA-N	0	3	338.373	3.371	20	30		EGEDHN
CC[C@@]1(C)C[C@H]1C(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1	ZINC001045604849	1346642585	/nfs/dbraw/zinc/64/25/85/1346642585.db2.gz	AYOHLIHYSCSFHD-ICSRJNTNSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC(C)[C@@H]1C[C@@H]1C(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1	ZINC001045604632	1346642923	/nfs/dbraw/zinc/64/29/23/1346642923.db2.gz	TTWGPSSXUPBJSU-OALUTQOASA-N	0	3	339.483	3.321	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@H]2CC[C@@H](C1)N2Cc1ccc(CF)cc1	ZINC001045775879	1346695177	/nfs/dbraw/zinc/69/51/77/1346695177.db2.gz	VOPIUNFIUNDYEZ-UXHICEINSA-N	0	3	340.442	3.135	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc(F)cc1)C2	ZINC001045909087	1346746484	/nfs/dbraw/zinc/74/64/84/1346746484.db2.gz	MUOXOOSUNAFGFI-HXUWFJFHSA-N	0	3	328.431	3.167	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCCC[C@@]2(CCN(Cc3cccc(F)c3)C2)C1	ZINC001045920860	1346758074	/nfs/dbraw/zinc/75/80/74/1346758074.db2.gz	BVVIZYZPZCMBHM-JXFKEZNVSA-N	0	3	343.446	3.190	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cscc1C)C2	ZINC001045926796	1346762700	/nfs/dbraw/zinc/76/27/00/1346762700.db2.gz	KLDLTCQIWYMHNJ-IBGZPJMESA-N	0	3	330.497	3.398	20	30		EGEDHN
O=C(C#CC1CC1)N1CCCC[C@]2(CCN(Cc3ccsc3)C2)C1	ZINC001045937081	1346773379	/nfs/dbraw/zinc/77/33/79/1346773379.db2.gz	SXLSINVAGPCWKY-HXUWFJFHSA-N	0	3	342.508	3.366	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1nc(C(C)C)oc1C)C2	ZINC001045942331	1346777784	/nfs/dbraw/zinc/77/77/84/1346777784.db2.gz	QOWRFAFUUXHEQJ-FQEVSTJZSA-N	0	3	343.471	3.058	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc(F)c(F)c1)C2	ZINC001045942840	1346778755	/nfs/dbraw/zinc/77/87/55/1346778755.db2.gz	BBHZIWLBUUKVDJ-HXUWFJFHSA-N	0	3	346.421	3.306	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1conc1C(C)C)C2	ZINC001045943669	1346779138	/nfs/dbraw/zinc/77/91/38/1346779138.db2.gz	LMYZABHTDYESEJ-HXUWFJFHSA-N	0	3	343.471	3.140	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)CCc1ccsc1)C2	ZINC001045944066	1346779918	/nfs/dbraw/zinc/77/99/18/1346779918.db2.gz	WCLCHNHUOIJNSZ-FQEVSTJZSA-N	0	3	344.524	3.409	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H]1CC[C@@H]3C[C@@H]3CC1)C2	ZINC001045954761	1346789946	/nfs/dbraw/zinc/78/99/46/1346789946.db2.gz	INZWEQFGBGUJGV-WERVVEIQSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc3ccccc3n1C)C2	ZINC001045960416	1346795698	/nfs/dbraw/zinc/79/56/98/1346795698.db2.gz	JFXSXUXVQUQJBZ-QFIPXVFZSA-N	0	3	349.478	3.130	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)C[C@H]1CCCC1(F)F)C2	ZINC001045961914	1346797287	/nfs/dbraw/zinc/79/72/87/1346797287.db2.gz	VDCIQWDEWAZRMZ-SJLPKXTDSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc(C)ccc1F)C2	ZINC001045968796	1346803734	/nfs/dbraw/zinc/80/37/34/1346803734.db2.gz	HJJAUAUECYQGBL-FQEVSTJZSA-N	0	3	328.431	3.086	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc(C)ccc1F)C2	ZINC001045969242	1346805037	/nfs/dbraw/zinc/80/50/37/1346805037.db2.gz	MWAXOQNXEUPCCC-OAQYLSRUSA-N	0	3	342.458	3.476	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc(C)cc1F)C2	ZINC001045969761	1346805146	/nfs/dbraw/zinc/80/51/46/1346805146.db2.gz	YQEJKWNKOVVJML-OAQYLSRUSA-N	0	3	342.458	3.476	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@H](CC)OC1CCCC1)C2	ZINC001045971068	1346807186	/nfs/dbraw/zinc/80/71/86/1346807186.db2.gz	MHHCBVJSXQHZRM-PZJWPPBQSA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc([C@H](C)CC)no1)C2	ZINC001045972449	1346808704	/nfs/dbraw/zinc/80/87/04/1346808704.db2.gz	AXWGKBZFNUTFQX-UZLBHIALSA-N	0	3	343.471	3.140	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1csc(C(C)C)n1)C2	ZINC001045974276	1346811073	/nfs/dbraw/zinc/81/10/73/1346811073.db2.gz	XNZNZXXOZDHEFV-IBGZPJMESA-N	0	3	345.512	3.218	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H](C)c1ccccc1F)C2	ZINC001045974941	1346811962	/nfs/dbraw/zinc/81/19/62/1346811962.db2.gz	QPWNATXDOARULL-LAUBAEHRSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)C[C@H](C)c1ccco1)C2	ZINC001045979844	1346817642	/nfs/dbraw/zinc/81/76/42/1346817642.db2.gz	KLWWTLIBHFBJEP-PXNSSMCTSA-N	0	3	328.456	3.111	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)Cc1ccccc1Cl)C2	ZINC001045982752	1346822016	/nfs/dbraw/zinc/82/20/16/1346822016.db2.gz	FKSQUMKKSWBPNS-FQEVSTJZSA-N	0	3	344.886	3.220	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)Cc1ccc(F)cc1)C2	ZINC001045982991	1346822300	/nfs/dbraw/zinc/82/23/00/1346822300.db2.gz	HODNONRPXCLJGF-OAQYLSRUSA-N	0	3	342.458	3.096	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@H](C)n1c(C)ccc1C)C2	ZINC001045986639	1346828670	/nfs/dbraw/zinc/82/86/70/1346828670.db2.gz	WSEXHZKXQWMOKP-PZJWPPBQSA-N	0	3	341.499	3.004	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N[C@]1(C)CCN(Cc2ccc(C)cc2)C1	ZINC001046318840	1346933488	/nfs/dbraw/zinc/93/34/88/1346933488.db2.gz	GXMWCNYHMRIMBW-SVFBPWRDSA-N	0	3	342.483	3.057	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2ccc(-c3cnco3)cc2)C1	ZINC001046426381	1346973003	/nfs/dbraw/zinc/97/30/03/1346973003.db2.gz	UDXRTXGXDVYBMA-LJQANCHMSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2ccc(F)c(Cl)c2F)C1	ZINC001046590380	1347029016	/nfs/dbraw/zinc/02/90/16/1347029016.db2.gz	IZYRWMLWBAMUBJ-INIZCTEOSA-N	0	3	328.790	3.389	20	30		EGEDHN
C=C(C)CCN1CC[C@](C)(NC(=O)c2ccc(P(C)(C)=O)cc2)C1	ZINC001046850752	1347129473	/nfs/dbraw/zinc/12/94/73/1347129473.db2.gz	XCQAPXMXQZVCJC-IBGZPJMESA-N	0	3	348.427	3.095	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)C2CC(c3ccc(F)cc3)C2)C1	ZINC001046872860	1347140944	/nfs/dbraw/zinc/14/09/44/1347140944.db2.gz	LQVYJBUGARDUCL-LBXVMSDZSA-N	0	3	330.447	3.476	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@@H](CNC(=O)C2CCCCCCC2)C1	ZINC001046957985	1347164994	/nfs/dbraw/zinc/16/49/94/1347164994.db2.gz	VCDPYGOOYDKHOR-KRWDZBQOSA-N	0	3	340.458	3.444	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2ccc3[nH]ccc3c2)C1	ZINC001046969893	1347171481	/nfs/dbraw/zinc/17/14/81/1347171481.db2.gz	GAUPEWNYXFLLLA-INIZCTEOSA-N	0	3	347.409	3.431	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@@H](CNC(=O)c2ccc(C)cc2C)C1	ZINC001046994438	1347177234	/nfs/dbraw/zinc/17/72/34/1347177234.db2.gz	GAEARRJJJQJPPU-INIZCTEOSA-N	0	3	334.410	3.014	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@H]3C[C@@H](C2)N(Cc2conc2CC)C3)C1	ZINC001047143455	1347219237	/nfs/dbraw/zinc/21/92/37/1347219237.db2.gz	OAMFQMPRCPBIKO-XIRDDKMYSA-N	0	3	343.471	3.062	20	30		EGEDHN
CC(=O)N1CCC[C@H](C2CCN(Cc3ccc(C#N)s3)CC2)C1	ZINC001047218191	1347249120	/nfs/dbraw/zinc/24/91/20/1347249120.db2.gz	DAQMDXGHOSAHPG-INIZCTEOSA-N	0	3	331.485	3.090	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)/C=C(/C)C3CC3)C2)CC1	ZINC001047229587	1347259336	/nfs/dbraw/zinc/25/93/36/1347259336.db2.gz	QBUKMJQVVLZRPN-HQSFBDMMSA-N	0	3	328.500	3.317	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)[C@@H](C)C3CCC3)C2)CC1	ZINC001047243284	1347269129	/nfs/dbraw/zinc/26/91/29/1347269129.db2.gz	JSMAZUXHAYGVQC-PXNSSMCTSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)C3C=CC=CC=C3)C2)CC1	ZINC001047243570	1347269376	/nfs/dbraw/zinc/26/93/76/1347269376.db2.gz	ZMCRBFKOVNJIKM-NRFANRHFSA-N	0	3	338.495	3.259	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)CC3CC(F)(F)C3)C2)CC1	ZINC001047245577	1347271125	/nfs/dbraw/zinc/27/11/25/1347271125.db2.gz	ZAHDGWXIHNJWIT-QGZVFWFLSA-N	0	3	338.442	3.006	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3ccn(CC)c3C)C2)CC1	ZINC001047249199	1347273992	/nfs/dbraw/zinc/27/39/92/1347273992.db2.gz	SMPOWMCMUBDBFD-LJQANCHMSA-N	0	3	341.499	3.014	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@@H]3C[C@@H]4CCCC[C@H]34)C2)CC1	ZINC001047250982	1347275866	/nfs/dbraw/zinc/27/58/66/1347275866.db2.gz	MTEZZAIXLIOWQQ-JSXRDJHFSA-N	0	3	342.527	3.397	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)c3occc3CC)C2)CC1	ZINC001047253624	1347277701	/nfs/dbraw/zinc/27/77/01/1347277701.db2.gz	DYIDSGTXZKKLHC-LJQANCHMSA-N	0	3	342.483	3.430	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@@H](C)c3cccs3)C2)CC1	ZINC001047254737	1347278802	/nfs/dbraw/zinc/27/88/02/1347278802.db2.gz	RPSXOWPNVWBNIX-FUHWJXTLSA-N	0	3	344.524	3.435	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@H](F)c3ccccc3)C2)CC1	ZINC001047259205	1347281709	/nfs/dbraw/zinc/28/17/09/1347281709.db2.gz	MGNBLMJTEGGABH-WOJBJXKFSA-N	0	3	342.458	3.281	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3cc(C)cc(F)c3)C2)CC1	ZINC001047260452	1347282744	/nfs/dbraw/zinc/28/27/44/1347282744.db2.gz	ZWIMZFVXCCUGEY-SFHVURJKSA-N	0	3	342.458	3.332	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)C(C3CC3)C3CC3)C2)CC1	ZINC001047262625	1347284118	/nfs/dbraw/zinc/28/41/18/1347284118.db2.gz	SLJCKNQPKCMVRM-HXUWFJFHSA-N	0	3	342.527	3.397	20	30		EGEDHN
C[C@@H](NCc1cc(F)ccc1C#N)[C@H]1CCN(C(=O)CC2CCC2)C1	ZINC001047774718	1347367063	/nfs/dbraw/zinc/36/70/63/1347367063.db2.gz	OZVHQYUGLNQQOK-PBHICJAKSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)Cc2ccccc2)C1	ZINC001047883470	1347398644	/nfs/dbraw/zinc/39/86/44/1347398644.db2.gz	AMMJKNNFYZMQSM-LAUBAEHRSA-N	0	3	347.462	3.128	20	30		EGEDHN
Cc1cocc1C(=O)N1CC[C@@H]([C@H](C)NCc2ccccc2C#N)C1	ZINC001047922712	1347410619	/nfs/dbraw/zinc/41/06/19/1347410619.db2.gz	AWDDYOCZZMXRBS-MAUKXSAKSA-N	0	3	337.423	3.100	20	30		EGEDHN
CC(C)C1(C(=O)N2CC[C@@H]([C@H](C)NCc3ccccc3C#N)C2)CC1	ZINC001047969282	1347428431	/nfs/dbraw/zinc/42/84/31/1347428431.db2.gz	GONYANYGTNWFSE-QFBILLFUSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=CCN1C[C@@H](C)[C@H](NC(=O)[C@H]2C3CCC(CC3)[C@@H]2C(F)(F)F)C1	ZINC001079715155	1357354242	/nfs/dbraw/zinc/35/42/42/1357354242.db2.gz	UBXVBJYTYWEPSK-FEKMBSQHSA-N	0	3	344.421	3.224	20	30		EGEDHN
C/C(=C\C(=O)N1C[C@H](C)[C@H](CNCc2ccccc2C#N)C1)C1CC1	ZINC001048166668	1347485081	/nfs/dbraw/zinc/48/50/81/1347485081.db2.gz	UQJXLACOOBYYMQ-FWWSWWNRSA-N	0	3	337.467	3.099	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](CNCc2nc3ccccc3o2)[C@H](C)C1	ZINC001048346511	1347525715	/nfs/dbraw/zinc/52/57/15/1347525715.db2.gz	YSZQNDJQDLIXBG-HUUCEWRRSA-N	0	3	341.455	3.224	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H](C)[C@H](CNCc3ccn(C(C)C)n3)C2)C1	ZINC001048373694	1347534299	/nfs/dbraw/zinc/53/42/99/1347534299.db2.gz	IWVMUCGBYPLKRZ-DLBZAZTESA-N	0	3	344.503	3.004	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CN(CCc3c(F)cccc3F)C[C@H]2C1	ZINC001048982262	1347697966	/nfs/dbraw/zinc/69/79/66/1347697966.db2.gz	QIFQUCGLDOBUIZ-GASCZTMLSA-N	0	3	348.437	3.110	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CN(C(=O)C4CC5(CCC5)C4)C[C@@H]3C2)c1	ZINC001048992541	1347701602	/nfs/dbraw/zinc/70/16/02/1347701602.db2.gz	KHTXEPLGQMXJKV-BGYRXZFFSA-N	0	3	349.478	3.029	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H]3CN(Cc4ccc(F)cc4)C[C@H]3C2)CC1	ZINC001049026632	1347709977	/nfs/dbraw/zinc/70/99/77/1347709977.db2.gz	UDCLLEXOEXBKGC-KDURUIRLSA-N	0	3	342.458	3.462	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)/C=C\C2CC2)c1	ZINC001049399256	1347821560	/nfs/dbraw/zinc/82/15/60/1347821560.db2.gz	WSYAEJQHOAAVRA-PXNYIJGASA-N	0	3	335.451	3.090	20	30		EGEDHN
Cc1cc[nH]c1C(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049460903	1347859448	/nfs/dbraw/zinc/85/94/48/1347859448.db2.gz	ZJGJQVIMRHIORJ-OALUTQOASA-N	0	3	348.450	3.074	20	30		EGEDHN
Cc1cc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)C#CC2CC2)cs1	ZINC001049468766	1347863770	/nfs/dbraw/zinc/86/37/70/1347863770.db2.gz	XXWBSSHNZPJSJD-QZTJIDSGSA-N	0	3	328.481	3.035	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1sc(C2CC2)nc1C	ZINC001049475115	1347867205	/nfs/dbraw/zinc/86/72/05/1347867205.db2.gz	NFBPCZHSSFOVFL-CVEARBPZSA-N	0	3	343.496	3.031	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1coc2c1cccc2OC	ZINC001049475731	1347868244	/nfs/dbraw/zinc/86/82/44/1347868244.db2.gz	VPVNWJCQXLNGQC-DLBZAZTESA-N	0	3	340.423	3.306	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1scc(C)c1Cl	ZINC001049495182	1347877008	/nfs/dbraw/zinc/87/70/08/1347877008.db2.gz	OGQDRMCDBNJRCT-ZIAGYGMSSA-N	0	3	336.888	3.412	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cn(CC)nc1C1CC1	ZINC001049501893	1347880960	/nfs/dbraw/zinc/88/09/60/1347880960.db2.gz	LSDKWGCWISJYDF-ROUUACIJSA-N	0	3	342.487	3.035	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1c(Cl)n[nH]c1C1CC1	ZINC001049514466	1347886525	/nfs/dbraw/zinc/88/65/25/1347886525.db2.gz	FSAFONIJUKBCAG-KGLIPLIRSA-N	0	3	348.878	3.196	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C1CCc2ccccc2CC1	ZINC001049562295	1347910755	/nfs/dbraw/zinc/91/07/55/1347910755.db2.gz	VOLDZMGTBPOMBI-LEWJYISDSA-N	0	3	338.495	3.433	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(C(C)(C)C)on1	ZINC001049590010	1347925329	/nfs/dbraw/zinc/92/53/29/1347925329.db2.gz	WLHUSOIUOALCGP-HZPDHXFCSA-N	0	3	331.460	3.227	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)CCc1ccc(C(C)C)cc1	ZINC001049594748	1347927502	/nfs/dbraw/zinc/92/75/02/1347927502.db2.gz	RWBUMOXGJGXPEJ-NHCUHLMSSA-N	0	3	338.495	3.441	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cnc2ccccc2c1C	ZINC001049598471	1347929744	/nfs/dbraw/zinc/92/97/44/1347929744.db2.gz	NUVAIGIHKDIFQX-VQTJNVASSA-N	0	3	335.451	3.408	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1cc(F)c(C)cc1F	ZINC001049612301	1347935508	/nfs/dbraw/zinc/93/55/08/1347935508.db2.gz	LZNWPJUCPGXKDP-ZWKOTPCHSA-N	0	3	334.410	3.067	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)CCc1ccc(Cl)cc1	ZINC001049620555	1347938644	/nfs/dbraw/zinc/93/86/44/1347938644.db2.gz	FTXFEKYOVFQGDW-RTBURBONSA-N	0	3	344.886	3.361	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)CCc1ccc(C)cc1C	ZINC001049620655	1347938795	/nfs/dbraw/zinc/93/87/95/1347938795.db2.gz	LKLLGWJIFMHAEH-SFTDATJTSA-N	0	3	338.495	3.325	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(C)nc1C1CC1	ZINC001049627158	1347941509	/nfs/dbraw/zinc/94/15/09/1347941509.db2.gz	PXMVQGWUARNTED-MSOLQXFVSA-N	0	3	325.456	3.132	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1cncc(OC(C)C)c1	ZINC001049635933	1347946555	/nfs/dbraw/zinc/94/65/55/1347946555.db2.gz	WWBUVLSTOPKOOL-MOPGFXCFSA-N	0	3	343.471	3.124	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1c(Cl)cncc1Cl	ZINC001049688259	1347972012	/nfs/dbraw/zinc/97/20/12/1347972012.db2.gz	TZKPVCRACUFFQY-KGLIPLIRSA-N	0	3	340.254	3.253	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1c(C)cc(C)cc1C	ZINC001049691861	1347974166	/nfs/dbraw/zinc/97/41/66/1347974166.db2.gz	CDKSQXHJOQVURY-LEWJYISDSA-N	0	3	338.495	3.243	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1c(F)cccc1F	ZINC001049706484	1347983319	/nfs/dbraw/zinc/98/33/19/1347983319.db2.gz	IYSQMYAPIIWTES-KNCCTNLNSA-N	0	3	346.421	3.320	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc2cc(F)ccc2o1	ZINC001049761197	1348006293	/nfs/dbraw/zinc/00/62/93/1348006293.db2.gz	HZUYZMLMFFGQJT-DLBZAZTESA-N	0	3	340.398	3.274	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049768953	1348011970	/nfs/dbraw/zinc/01/19/70/1348011970.db2.gz	MABIHXRWGWXRMO-VDGAXYAQSA-N	0	3	339.483	3.416	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cn1cc(C)c2ccccc21	ZINC001049775432	1348015705	/nfs/dbraw/zinc/01/57/05/1348015705.db2.gz	DFTKUDFGXAPCNH-NHCUHLMSSA-N	0	3	349.478	3.038	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccccc1F	ZINC001049782201	1348019059	/nfs/dbraw/zinc/01/90/59/1348019059.db2.gz	OOBYVRBFOLXSMX-ONCXSQPRSA-N	0	3	340.442	3.018	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1ccccc1OC(C)C	ZINC001049783086	1348019998	/nfs/dbraw/zinc/01/99/98/1348019998.db2.gz	NWYABICUFAYWGF-RTBURBONSA-N	0	3	342.483	3.268	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cccn1C1CCCC1	ZINC001049812732	1348032746	/nfs/dbraw/zinc/03/27/46/1348032746.db2.gz	XNKJAPBTDQYZGE-MSOLQXFVSA-N	0	3	327.472	3.468	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H](CC)SC	ZINC001133396181	1375979200	/nfs/dbraw/zinc/97/92/00/1375979200.db2.gz	UXPQGQIWSUUAPH-MRXNPFEDSA-N	0	3	338.904	3.033	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1csc(C(F)(F)F)n1	ZINC001049830433	1348044560	/nfs/dbraw/zinc/04/45/60/1348044560.db2.gz	FRXCIPXEWUDJGN-NWDGAFQWSA-N	0	3	345.390	3.027	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(CC)c(CC)o1	ZINC001049850674	1348058402	/nfs/dbraw/zinc/05/84/02/1348058402.db2.gz	UCJAVVLLBYUZFL-SJORKVTESA-N	0	3	328.456	3.107	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](CC)Oc1ccccc1F	ZINC001049850144	1348058717	/nfs/dbraw/zinc/05/87/17/1348058717.db2.gz	SDHYTYMCRUQLRC-KSZLIROESA-N	0	3	346.446	3.234	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc2ccccc2n1	ZINC001049865402	1348072167	/nfs/dbraw/zinc/07/21/67/1348072167.db2.gz	VKXGKDOXYHUBDQ-PMACEKPBSA-N	0	3	335.451	3.490	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C1CCC(C(F)F)CC1	ZINC001049869439	1348074396	/nfs/dbraw/zinc/07/43/96/1348074396.db2.gz	GXUODFVDQYKJMU-QDIHITRGSA-N	0	3	326.431	3.309	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H]1Cc2ccc(Cl)cc21	ZINC001049869096	1348074856	/nfs/dbraw/zinc/07/48/56/1348074856.db2.gz	CEQIFLDTIPFQFI-RCCFBDPRSA-N	0	3	330.859	3.231	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)CCc1c[nH]c2ccccc12	ZINC001049876717	1348082139	/nfs/dbraw/zinc/08/21/39/1348082139.db2.gz	LRENFHBXPXIKEH-LEWJYISDSA-N	0	3	349.478	3.189	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)COc1c(C)cc(C)cc1C	ZINC001049877586	1348082459	/nfs/dbraw/zinc/08/24/59/1348082459.db2.gz	QVEGYEZICBQVDZ-RBUKOAKNSA-N	0	3	342.483	3.242	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1sc(C(C)C)nc1C	ZINC001049891501	1348095967	/nfs/dbraw/zinc/09/59/67/1348095967.db2.gz	UNAXRYUZVMPDSX-JKSUJKDBSA-N	0	3	345.512	3.277	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc2c(cccc2OC)[nH]1	ZINC001049892055	1348096115	/nfs/dbraw/zinc/09/61/15/1348096115.db2.gz	YZGXHGUPEVPVJD-QZTJIDSGSA-N	0	3	339.439	3.041	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C[C@H](C)c1ccc(F)cc1	ZINC001049913347	1348108459	/nfs/dbraw/zinc/10/84/59/1348108459.db2.gz	WFQQUZXLLNDMKM-FFZOFVMBSA-N	0	3	342.458	3.408	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](C)Cc1ccc(C)cc1	ZINC001049916908	1348111025	/nfs/dbraw/zinc/11/10/25/1348111025.db2.gz	JMGDJXYLKABOOS-CEWLAPEOSA-N	0	3	338.495	3.262	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](CC)c1ccc(F)cc1	ZINC001049917661	1348111763	/nfs/dbraw/zinc/11/17/63/1348111763.db2.gz	NPCJWDILNHFHGY-VAMGGRTRSA-N	0	3	342.458	3.408	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(Cl)cc2c1OCC2	ZINC001049919894	1348113019	/nfs/dbraw/zinc/11/30/19/1348113019.db2.gz	YNMYIZZLPLRDBB-DLBZAZTESA-N	0	3	346.858	3.140	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H]1Cc2c1cccc2Cl	ZINC001049924106	1348115575	/nfs/dbraw/zinc/11/55/75/1348115575.db2.gz	PRZNHNSDDXTBIS-CGTJXYLNSA-N	0	3	330.859	3.231	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(N(C)CCC)cc1	ZINC001049924210	1348115783	/nfs/dbraw/zinc/11/57/83/1348115783.db2.gz	CBSRLFLWHYWWTN-UXHICEINSA-N	0	3	341.499	3.398	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cccc2oc(C)nc21	ZINC001049924135	1348116027	/nfs/dbraw/zinc/11/60/27/1348116027.db2.gz	QFVCSJXBBBMVRA-HZPDHXFCSA-N	0	3	325.412	3.001	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(N(C)CC)cc1	ZINC001049928929	1348119203	/nfs/dbraw/zinc/11/92/03/1348119203.db2.gz	WLPVKLQRPAYWFG-RTBURBONSA-N	0	3	327.472	3.008	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C(C)(C)c1ccccc1OC	ZINC001049933747	1348121036	/nfs/dbraw/zinc/12/10/36/1348121036.db2.gz	SAIWJJPQVHRNOQ-ZWKOTPCHSA-N	0	3	342.483	3.224	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3ccnc(-c4ccco4)c3)[C@@H]2C1	ZINC001050072025	1348172333	/nfs/dbraw/zinc/17/23/33/1348172333.db2.gz	BZJACZOGMSPZKU-FUHWJXTLSA-N	0	3	337.423	3.064	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3cc(C)n([C@@H](C)CC)n3)[C@@H]2C1	ZINC001050081436	1348176386	/nfs/dbraw/zinc/17/63/86/1348176386.db2.gz	XJDBAUXPLLVJMT-VDZJLULYSA-N	0	3	344.503	3.275	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CCCN(C(=O)C4CC5(CC5)C4)[C@@H]3C2)c1	ZINC001050137399	1348193491	/nfs/dbraw/zinc/19/34/91/1348193491.db2.gz	WAKBZSQPYPTBMK-AZUAARDMSA-N	0	3	349.478	3.171	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3csc(C(C)C)n3)[C@@H]2C1	ZINC001050164497	1348201360	/nfs/dbraw/zinc/20/13/60/1348201360.db2.gz	GSJZXPJSCBCXCR-GOEBONIOSA-N	0	3	333.501	3.379	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)Cc3c[nH]c4cccc(C)c34)[C@@H]2C1	ZINC001050183579	1348205099	/nfs/dbraw/zinc/20/50/99/1348205099.db2.gz	HRVOYNXXJHDHGL-QFBILLFUSA-N	0	3	337.467	3.128	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)c3c[nH]c4c3cccc4CC)[C@@H]2C1	ZINC001050209122	1348211520	/nfs/dbraw/zinc/21/15/20/1348211520.db2.gz	ZWAORECWAYSACJ-FXAWDEMLSA-N	0	3	349.478	3.290	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001050438144	1348266570	/nfs/dbraw/zinc/26/65/70/1348266570.db2.gz	OHLYWAITRLSAPR-MRXNPFEDSA-N	0	3	325.456	3.029	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3cc4sccc4s3)C2)CC1	ZINC001050563163	1348290701	/nfs/dbraw/zinc/29/07/01/1348290701.db2.gz	HKVUDQVEGCNYEH-UHFFFAOYSA-N	0	3	330.478	3.134	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)C(C)(C)c3ccc(Cl)cc3)C2)CC1	ZINC001050644427	1348313234	/nfs/dbraw/zinc/31/32/34/1348313234.db2.gz	KKHJUUVQEXJYAS-UHFFFAOYSA-N	0	3	344.886	3.175	20	30		EGEDHN
C=C1CCC(C(=O)N2CC3(C2)CCN(Cc2ocnc2C)CC3)CC1	ZINC001050644254	1348313432	/nfs/dbraw/zinc/31/34/32/1348313432.db2.gz	CNOVEVPOSYCOHY-UHFFFAOYSA-N	0	3	343.471	3.154	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1cccnc1C)CC2	ZINC001050645408	1348314062	/nfs/dbraw/zinc/31/40/62/1348314062.db2.gz	LOORUMXOAZEAFV-HXUWFJFHSA-N	0	3	341.499	3.417	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001050669752	1348322303	/nfs/dbraw/zinc/32/23/03/1348322303.db2.gz	NQXRAUFPJZINNQ-RTBURBONSA-N	0	3	337.467	3.029	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@H](C)Cc3ccccc3Cl)C2)CC1	ZINC001050684436	1348326152	/nfs/dbraw/zinc/32/61/52/1348326152.db2.gz	LHNOVWMIAWBYSK-MRXNPFEDSA-N	0	3	344.886	3.076	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@@H]3C[C@H]3c3ccc(Cl)cc3)C2)CC1	ZINC001050695234	1348329923	/nfs/dbraw/zinc/32/99/23/1348329923.db2.gz	BQRGMEJRLAOPFT-ZWKOTPCHSA-N	0	3	342.870	3.001	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)C[C@@H]3CCCc4ccccc43)C2)CC1	ZINC001050734758	1348341635	/nfs/dbraw/zinc/34/16/35/1348341635.db2.gz	VUSPPOQAXZCZTD-IBGZPJMESA-N	0	3	336.479	3.054	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)[C@@H]3CCC[C@@H]4C[C@@H]43)cccc2C1	ZINC001051292334	1348421726	/nfs/dbraw/zinc/42/17/26/1348421726.db2.gz	URGJLMGIMJMXSW-HBGVWJBISA-N	0	3	336.479	3.120	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)[C@@H]3CC[C@H](F)C3)cccc2C1	ZINC001051298374	1348423723	/nfs/dbraw/zinc/42/37/23/1348423723.db2.gz	NYDUJYCIMWQRBD-QAPCUYQASA-N	0	3	330.447	3.375	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cc(C3CC3)[nH]c2C2CC2)CC1	ZINC001052491645	1348556340	/nfs/dbraw/zinc/55/63/40/1348556340.db2.gz	IKCYNWOQZMPTNC-QGZVFWFLSA-N	0	3	339.483	3.377	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2scnc2C2CCCC2)CC1	ZINC001052532747	1348568124	/nfs/dbraw/zinc/56/81/24/1348568124.db2.gz	LLRVUWSNVKEPID-INIZCTEOSA-N	0	3	345.512	3.408	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN(Cc3cncc(C)c3)CC2)cc1	ZINC001052613392	1348596922	/nfs/dbraw/zinc/59/69/22/1348596922.db2.gz	DGQHRDDTIWRTNE-OAQYLSRUSA-N	0	3	347.462	3.156	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2oc3ccccc3c2OC)CC1	ZINC001052620181	1348597876	/nfs/dbraw/zinc/59/78/76/1348597876.db2.gz	NKEHGTRAURDDQF-OAHLLOKOSA-N	0	3	340.423	3.049	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2ccccc2O[C@H](C)CC)CC1	ZINC001052754622	1348664046	/nfs/dbraw/zinc/66/40/46/1348664046.db2.gz	OFPPBQRJSHCNRC-IAGOWNOFSA-N	0	3	328.456	3.081	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2ccc(Cl)c3occc32)CC1	ZINC001052862782	1348707317	/nfs/dbraw/zinc/70/73/17/1348707317.db2.gz	ZBWCEUZBUCOLNP-CYBMUJFWSA-N	0	3	330.815	3.304	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc(OCC3CC3)cc2)CC1	ZINC001052945431	1348762450	/nfs/dbraw/zinc/76/24/50/1348762450.db2.gz	JEQZRBAIOOZMKN-IBGZPJMESA-N	0	3	340.467	3.083	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)C(C)(C)c2ccccc2C)CC1	ZINC001052974997	1348782330	/nfs/dbraw/zinc/78/23/30/1348782330.db2.gz	SFWMODVRBIZVQA-GOSISDBHSA-N	0	3	326.484	3.267	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(C)s2)C1	ZINC001053061847	1348871737	/nfs/dbraw/zinc/87/17/37/1348871737.db2.gz	VFFMUNOWOFMTFB-SJORKVTESA-N	0	3	330.497	3.396	20	30		EGEDHN
CC#CC[N@@H+]1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001053065531	1348879067	/nfs/dbraw/zinc/87/90/67/1348879067.db2.gz	HGLAPQQXZUKDEW-HKUYNNGSSA-N	0	3	340.467	3.122	20	30		EGEDHN
CC#CC[N@H+]1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001053065531	1348879071	/nfs/dbraw/zinc/87/90/71/1348879071.db2.gz	HGLAPQQXZUKDEW-HKUYNNGSSA-N	0	3	340.467	3.122	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)CCc2ccco2)C1	ZINC001053067782	1348881576	/nfs/dbraw/zinc/88/15/76/1348881576.db2.gz	JEHTVOWXDBGZIF-ICSRJNTNSA-N	0	3	342.483	3.329	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2scnc2C)C1	ZINC001053070002	1348883791	/nfs/dbraw/zinc/88/37/91/1348883791.db2.gz	RQUVAZUZUMUUEB-DLBZAZTESA-N	0	3	345.512	3.182	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cnccc2C)C1	ZINC001053074555	1348892424	/nfs/dbraw/zinc/89/24/24/1348892424.db2.gz	CHGSMXDKTPMQPZ-QUCCMNQESA-N	0	3	339.483	3.120	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2oc(C)cc2C)C1	ZINC001053075977	1348894603	/nfs/dbraw/zinc/89/46/03/1348894603.db2.gz	KNDGWEGWVZHBBC-QZTJIDSGSA-N	0	3	328.456	3.236	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cc[nH]c2C)C1	ZINC001053076790	1348895244	/nfs/dbraw/zinc/89/52/44/1348895244.db2.gz	UBSBQVXOWBRLBU-MJGOQNOKSA-N	0	3	327.472	3.053	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccoc2CC)C1	ZINC001053085355	1348907166	/nfs/dbraw/zinc/90/71/66/1348907166.db2.gz	FMNNIOKLNYLXNE-SJLPKXTDSA-N	0	3	328.456	3.182	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)C2(F)CCCC2)C1	ZINC001053087532	1348911450	/nfs/dbraw/zinc/91/14/50/1348911450.db2.gz	LVCDIPKXUTYWOZ-ROUUACIJSA-N	0	3	334.479	3.385	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cccn2CC=C)C1	ZINC001053088372	1348912936	/nfs/dbraw/zinc/91/29/36/1348912936.db2.gz	UIEKADDJXTZWRY-MOPGFXCFSA-N	0	3	339.483	3.014	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2occ3c2CCC3)C1	ZINC001053093059	1348920366	/nfs/dbraw/zinc/92/03/66/1348920366.db2.gz	UVWJAQOMFBPPEA-LPHOPBHVSA-N	0	3	340.467	3.108	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccoc2C2CC2)C1	ZINC001053095207	1348924780	/nfs/dbraw/zinc/92/47/80/1348924780.db2.gz	IHYUARXPCXBWMO-IEBWSBKVSA-N	0	3	340.467	3.497	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2sc(C)nc2C)C1	ZINC001053104192	1348939395	/nfs/dbraw/zinc/93/93/95/1348939395.db2.gz	CSNHHSOXQZCXDZ-SJORKVTESA-N	0	3	345.512	3.100	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@H]1CC[C@@H]3C[C@@H]3CC1)C2	ZINC001054168848	1349170692	/nfs/dbraw/zinc/17/06/92/1349170692.db2.gz	JGRLTPGKDRVAEX-RCLSDMTESA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)C1(C3CCC3)CCC1)C2	ZINC001054169687	1349171358	/nfs/dbraw/zinc/17/13/58/1349171358.db2.gz	DBIYLUOAGBQXJE-HXUWFJFHSA-N	0	3	328.500	3.295	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@H](C)c1ccsc1)C2	ZINC001054195728	1349198550	/nfs/dbraw/zinc/19/85/50/1349198550.db2.gz	CAHVRNZAZQXWSX-VQIMIIECSA-N	0	3	330.497	3.189	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)C1[C@H]3CCCCCC[C@H]13)C2	ZINC001054203964	1349205126	/nfs/dbraw/zinc/20/51/26/1349205126.db2.gz	MNFKENKMRREHTD-BBTUJRGHSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H](F)CC1CCCCC1)C2	ZINC001054227285	1349221741	/nfs/dbraw/zinc/22/17/41/1349221741.db2.gz	GJYVOXXIOSOVIG-AZUAARDMSA-N	0	3	334.479	3.243	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H](C)c1ccc(C)cc1)C2	ZINC001054227532	1349221934	/nfs/dbraw/zinc/22/19/34/1349221934.db2.gz	IUXIDHOIDPKWTF-SIKLNZKXSA-N	0	3	338.495	3.436	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(F)cc1C)C2	ZINC001054231741	1349224855	/nfs/dbraw/zinc/22/48/55/1349224855.db2.gz	ZCXNHAADTVXJFL-FQEVSTJZSA-N	0	3	328.431	3.086	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(F)cc1C)C2	ZINC001054231742	1349225124	/nfs/dbraw/zinc/22/51/24/1349225124.db2.gz	ZCXNHAADTVXJFL-HXUWFJFHSA-N	0	3	328.431	3.086	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc(C)c(F)cc1Cl)C2	ZINC001054234060	1349225950	/nfs/dbraw/zinc/22/59/50/1349225950.db2.gz	WINWDWWNHJVURA-LJQANCHMSA-N	0	3	348.849	3.349	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@]1(C)CC=C(C)CC1)C2	ZINC001054244137	1349237516	/nfs/dbraw/zinc/23/75/16/1349237516.db2.gz	SNHQEJVIEGJBRU-RTWAWAEBSA-N	0	3	328.500	3.461	20	30		EGEDHN
C=C[C@@H](C(=O)N1CCC[C@]2(CCN(CC#CC)C2)C1)c1ccccc1	ZINC001054244643	1349238604	/nfs/dbraw/zinc/23/86/04/1349238604.db2.gz	XGQWJJYVYKODCA-IFMALSPDSA-N	0	3	336.479	3.294	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)[C@H](CC)c1ccc(F)cc1)C2	ZINC001054245853	1349239772	/nfs/dbraw/zinc/23/97/72/1349239772.db2.gz	FUOFWWVAOHKMRM-CTNGQTDRSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1c[nH]c3ccc(C)cc13)C2	ZINC001054246028	1349239964	/nfs/dbraw/zinc/23/99/64/1349239964.db2.gz	KSHQSCLEWGTZIH-OAQYLSRUSA-N	0	3	335.451	3.038	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3ncoc3CC)cc2C1	ZINC001054259008	1349254752	/nfs/dbraw/zinc/25/47/52/1349254752.db2.gz	JOLPDWAAEPYWTM-UHFFFAOYSA-N	0	3	339.439	3.449	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3ccnn3C(C)C)cc2C1	ZINC001054267405	1349264675	/nfs/dbraw/zinc/26/46/75/1349264675.db2.gz	SATIGEZETFIVTA-UHFFFAOYSA-N	0	3	338.455	3.286	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3c(C)[nH]nc3Cl)cc2C1	ZINC001054268334	1349266742	/nfs/dbraw/zinc/26/67/42/1349266742.db2.gz	LPJJOXHUQIALHQ-UHFFFAOYSA-N	0	3	344.846	3.193	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@@H]3CC34CCOCC4)cc2C1	ZINC001054293532	1349300093	/nfs/dbraw/zinc/30/00/93/1349300093.db2.gz	RRLFITFLLLOSDC-IBGZPJMESA-N	0	3	340.467	3.011	20	30		EGEDHN
C[C@H]1CN(C(=O)c2ccc(F)cc2)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054329312	1349311057	/nfs/dbraw/zinc/31/10/57/1349311057.db2.gz	QIWFSQLUUBYEQQ-SJCJKPOMSA-N	0	3	343.427	3.009	20	30		EGEDHN
C[C@H]1CN(C(=O)C2CCCCC2)C[C@H]1NCc1ccc(C#N)s1	ZINC001054345194	1349324290	/nfs/dbraw/zinc/32/42/90/1349324290.db2.gz	MBIAWDXTFULVII-SUMWQHHRSA-N	0	3	331.485	3.137	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2cccs2)C[C@@H]1NCc1ccc(C#N)c(F)c1	ZINC001054350293	1349330235	/nfs/dbraw/zinc/33/02/35/1349330235.db2.gz	JNNCDINWAKCDSS-WBMJQRKESA-N	0	3	343.427	3.009	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2=CCCCC2)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054476991	1349370057	/nfs/dbraw/zinc/37/00/57/1349370057.db2.gz	AUTDWKUJYYOEFW-KDOFPFPSSA-N	0	3	343.496	3.447	20	30		EGEDHN
Cc1cc(C)c(C(=O)N2C[C@@H](C)[C@@H](NCc3ccc(C#N)s3)C2)o1	ZINC001054524963	1349384148	/nfs/dbraw/zinc/38/41/48/1349384148.db2.gz	MHBKYDZLRJUDAJ-WBMJQRKESA-N	0	3	343.452	3.080	20	30		EGEDHN
C[C@H]1CN(C(=O)c2ccoc2Cl)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054614990	1349415192	/nfs/dbraw/zinc/41/51/92/1349415192.db2.gz	WNDLKZJBBAAGGO-HZMBPMFUSA-N	0	3	349.843	3.116	20	30		EGEDHN
CCC1(C(=O)N2C[C@H](NCc3ccc(C#N)s3)[C@@H](C)C2)CCC1	ZINC001054987396	1349539733	/nfs/dbraw/zinc/53/97/33/1349539733.db2.gz	WPGBLYOSPVCYIG-BBRMVZONSA-N	0	3	331.485	3.137	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CN(Cc3ccc(CF)cc3)C[C@H]2C)C1	ZINC001080404387	1357608888	/nfs/dbraw/zinc/60/88/88/1357608888.db2.gz	FVOXEDQQEGHMMK-CRAIPNDOSA-N	0	3	330.447	3.449	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cnn(C(C)(C)C)c1C	ZINC001085628765	1358645260	/nfs/dbraw/zinc/64/52/60/1358645260.db2.gz	FKCSHVYAIRNTRN-INIZCTEOSA-N	0	3	332.492	3.059	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)[C@@H]2C[C@H]2CC(C)(C)C)C1	ZINC001070411627	1354341118	/nfs/dbraw/zinc/34/11/18/1354341118.db2.gz	UIUJXSNVQZHRDT-HLLBOEOZSA-N	0	3	344.503	3.074	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)C2CCCCCCC2)C1	ZINC001070417172	1354341982	/nfs/dbraw/zinc/34/19/82/1354341982.db2.gz	VUUKMEHDQIVNFA-QGZVFWFLSA-N	0	3	344.503	3.362	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1cccc(C)c1F)C[C@H](C)O2	ZINC001071172096	1354486909	/nfs/dbraw/zinc/48/69/09/1354486909.db2.gz	XIRMZBRLODHNGN-JXFKEZNVSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1cccc(F)c1C)C[C@@H](C)O2	ZINC001071171416	1354487191	/nfs/dbraw/zinc/48/71/91/1354487191.db2.gz	MWYHBUGOMIPQRA-FOIQADDNSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1ccc(C)cc1F)C[C@@H](C)O2	ZINC001071213936	1354508924	/nfs/dbraw/zinc/50/89/24/1354508924.db2.gz	MMFWXZKTKBMGEK-UZLBHIALSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C1(CC)CCCC1)C[C@@H](C)O2	ZINC001071225817	1354513328	/nfs/dbraw/zinc/51/33/28/1354513328.db2.gz	QGMJUXHLRRTXDC-XLIONFOSSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C1(CC)CCCC1)C[C@@H](C)O2	ZINC001071225818	1354513437	/nfs/dbraw/zinc/51/34/37/1354513437.db2.gz	QGMJUXHLRRTXDC-YLJYHZDGSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1ccc(Cl)cc1)C[C@@H](C)O2	ZINC001071234404	1354517883	/nfs/dbraw/zinc/51/78/83/1354517883.db2.gz	YRZFMFFJSRCNHD-BEFAXECRSA-N	0	3	348.874	3.222	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1sccc1CC)C[C@@H](C)O2	ZINC001071244494	1354524998	/nfs/dbraw/zinc/52/49/98/1354524998.db2.gz	WGRNAWCHKSNQRZ-BEFAXECRSA-N	0	3	348.512	3.192	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2ccc(OC)cc2C)CC[C@H]1C	ZINC001071530873	1354749425	/nfs/dbraw/zinc/74/94/25/1354749425.db2.gz	BWJXRZJVIQLXEO-SJLPKXTDSA-N	0	3	330.472	3.091	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(OC(C)C)nc2)CC[C@H]1C	ZINC001071547296	1354759205	/nfs/dbraw/zinc/75/92/05/1354759205.db2.gz	SOONUSSSFXGWBZ-NVXWUHKLSA-N	0	3	331.460	3.028	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CC[C@H](C)N(Cc2ccccc2)C1	ZINC001071571727	1354771314	/nfs/dbraw/zinc/77/13/14/1354771314.db2.gz	KZYGFTFRELCRAX-HKUYNNGSSA-N	0	3	337.467	3.457	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C(C)(C)c2cc(C)ccn2)CC[C@@H]1C	ZINC001071606317	1354791859	/nfs/dbraw/zinc/79/18/59/1354791859.db2.gz	HNHNQMYUKZOKEV-IRXDYDNUSA-N	0	3	329.488	3.213	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C(C)(C)c2cc(C)ccn2)CC[C@@H]1C	ZINC001071606315	1354792005	/nfs/dbraw/zinc/79/20/05/1354792005.db2.gz	HNHNQMYUKZOKEV-DLBZAZTESA-N	0	3	329.488	3.213	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2coc3ccc(OC)cc32)CC[C@@H]1C	ZINC001071676028	1354843578	/nfs/dbraw/zinc/84/35/78/1354843578.db2.gz	JHCJCIXFEPGEMW-GJZGRUSLSA-N	0	3	340.423	3.047	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(C)c(Cl)c2F)CC[C@H]1C	ZINC001071701262	1354860878	/nfs/dbraw/zinc/86/08/78/1354860878.db2.gz	FRONDASDVWMKOI-ZIAGYGMSSA-N	0	3	336.838	3.394	20	30		EGEDHN
C=C(C)CCN1C[C@H](NC(=O)c2ocnc2C(F)(F)F)CC[C@@H]1C	ZINC001071705316	1354863945	/nfs/dbraw/zinc/86/39/45/1354863945.db2.gz	NNMLGRREXQZLDL-NWDGAFQWSA-N	0	3	345.365	3.242	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CC[C@H](C)N(Cc3ccccc3)C2)cc1	ZINC001071731852	1354886084	/nfs/dbraw/zinc/88/60/84/1354886084.db2.gz	LAXRTGLCSUSHLS-LAUBAEHRSA-N	0	3	332.447	3.451	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cncc3sccc32)CC[C@@H]1C	ZINC001071765715	1354913030	/nfs/dbraw/zinc/91/30/30/1354913030.db2.gz	JWOQANZCQJIDBN-KBPBESRZSA-N	0	3	329.469	3.455	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(C(F)F)c(F)c2)CC[C@H]1C	ZINC001071822613	1354962462	/nfs/dbraw/zinc/96/24/62/1354962462.db2.gz	ZELARKXMEOWXHU-OCCSQVGLSA-N	0	3	338.373	3.369	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2cc(F)c(F)cc2F)CC[C@@H]1C	ZINC001071850046	1354978524	/nfs/dbraw/zinc/97/85/24/1354978524.db2.gz	AMIZJGJKKPCYBG-GXTWGEPZSA-N	0	3	340.389	3.192	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2cc(F)c(F)cc2F)CC[C@@H]1C	ZINC001071850052	1354978811	/nfs/dbraw/zinc/97/88/11/1354978811.db2.gz	AMIZJGJKKPCYBG-JSGCOSHPSA-N	0	3	340.389	3.192	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2csc(C(C)(C)C)n2)CC[C@@H]1C	ZINC001071892730	1355010603	/nfs/dbraw/zinc/01/06/03/1355010603.db2.gz	HYWHMJFLXWXSJW-UONOGXRCSA-N	0	3	333.501	3.047	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(-c3c[nH]cn3)cc2)CC[C@H]1C	ZINC001071957051	1355042199	/nfs/dbraw/zinc/04/21/99/1355042199.db2.gz	BHSNCLCARVQQQC-CRAIPNDOSA-N	0	3	338.455	3.236	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cnn(CCC)c2C2CC2)CC[C@@H]1C	ZINC001071976579	1355055793	/nfs/dbraw/zinc/05/57/93/1355055793.db2.gz	FGVAVHOFVHMNBO-DOTOQJQBSA-N	0	3	344.503	3.329	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(OC)c(OCC)c2)CC[C@H]1C	ZINC001072049644	1355103418	/nfs/dbraw/zinc/10/34/18/1355103418.db2.gz	QKERLQCKDDADAY-NVXWUHKLSA-N	0	3	346.471	3.253	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc(OC)c(C)c(OC)c2)CC[C@@H]1C	ZINC001072050502	1355104185	/nfs/dbraw/zinc/10/41/85/1355104185.db2.gz	YNSKBYYBUGDZOR-YOEHRIQHSA-N	0	3	346.471	3.171	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(N=NC(N)=O)cc2)CC[C@H]1C	ZINC001072102154	1355131262	/nfs/dbraw/zinc/13/12/62/1355131262.db2.gz	NKHZSHDEOOTEAA-CZUORRHYSA-N	0	3	343.431	3.008	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc(Cl)cc3c2OCC3)CC[C@H]1C	ZINC001072109913	1355136530	/nfs/dbraw/zinc/13/65/30/1355136530.db2.gz	PDTUYNIMUYIEKS-CZUORRHYSA-N	0	3	348.874	3.434	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1sc(C)nc1C)C2	ZINC001072945225	1355513530	/nfs/dbraw/zinc/51/35/30/1355513530.db2.gz	XAHIJVKVTUYLFD-SFHVURJKSA-N	0	3	347.528	3.397	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@@H](N[C@@H](C)c3ccccc3F)C2)CCC1	ZINC001183200541	1387277238	/nfs/dbraw/zinc/27/72/38/1387277238.db2.gz	ROFYWFNYJAGDDE-JKSUJKDBSA-N	0	3	328.431	3.271	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2ccc(C(F)F)cc2)C1	ZINC001073816059	1355907008	/nfs/dbraw/zinc/90/70/08/1355907008.db2.gz	SZYHKUGXLPWSRP-INIZCTEOSA-N	0	3	338.398	3.021	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC001073869952	1355928585	/nfs/dbraw/zinc/92/85/85/1355928585.db2.gz	LUHDZPHDONYXHF-IBGZPJMESA-N	0	3	344.499	3.381	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2ccccc2C2CCC2)C1	ZINC001073872524	1355929973	/nfs/dbraw/zinc/92/99/73/1355929973.db2.gz	SEUKKRAJBYBGOC-GOSISDBHSA-N	0	3	342.483	3.351	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2csc3c2CCCC3)C1	ZINC001073880424	1355937968	/nfs/dbraw/zinc/93/79/68/1355937968.db2.gz	IVMHAONRLORGDQ-HNNXBMFYSA-N	0	3	348.512	3.024	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2ccc(CC(C)C)cc2)C1	ZINC001073880820	1355938091	/nfs/dbraw/zinc/93/80/91/1355938091.db2.gz	UOMCNGNZHPPWEB-FQEVSTJZSA-N	0	3	344.499	3.282	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2cc3cc(C)ccc3o2)C1	ZINC001073899328	1355946759	/nfs/dbraw/zinc/94/67/59/1355946759.db2.gz	QPMLYKFUBLFNGJ-KRWDZBQOSA-N	0	3	342.439	3.138	20	30		EGEDHN
C#CCCN1CCCO[C@H](CNC(=O)c2ccc([C@@H](C)CC)cc2)C1	ZINC001073899376	1355946787	/nfs/dbraw/zinc/94/67/87/1355946787.db2.gz	RIYRHUOULCMQQL-FXAWDEMLSA-N	0	3	342.483	3.044	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCCC[C@@H]1CN(C)Cc1cccc(C#N)c1	ZINC001073983864	1356012958	/nfs/dbraw/zinc/01/29/58/1356012958.db2.gz	AXFLBBZBTLRCFE-HPMVAKFTSA-N	0	3	325.456	3.337	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(C#N)cc1	ZINC001074051065	1356056149	/nfs/dbraw/zinc/05/61/49/1356056149.db2.gz	ZUBNWYLRRBJKHF-QZTJIDSGSA-N	0	3	331.435	3.119	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)N1CCCC[C@@H]1CN(C)Cc1cccc(C#N)c1	ZINC001074053564	1356057435	/nfs/dbraw/zinc/05/74/35/1356057435.db2.gz	XZVFPMTZMRSHEF-RTBURBONSA-N	0	3	345.462	3.365	20	30		EGEDHN
C[C@H]1[C@@H](NCc2ccc(C#N)c(F)c2)CCN1C(=O)[C@H]1CCC1(C)C	ZINC001074815591	1356251904	/nfs/dbraw/zinc/25/19/04/1356251904.db2.gz	FNFULGXKTFKOQR-XCRHUMRWSA-N	0	3	343.446	3.213	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCO[C@H]1C1CCN(C(=O)C=C(C)C)CC1	ZINC001075400504	1356357525	/nfs/dbraw/zinc/35/75/25/1356357525.db2.gz	YMHUWNYLZNIIKY-AEFFLSMTSA-N	0	3	340.895	3.081	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCO[C@H]1C1CCN(C(=O)C(C)(C)C)CC1	ZINC001075416086	1356362716	/nfs/dbraw/zinc/36/27/16/1356362716.db2.gz	TWOOTQFSAVLUPM-HOTGVXAUSA-N	0	3	342.911	3.161	20	30		EGEDHN
CC#CCN1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)[C@@H]2C[C@H]2C)C1	ZINC001075422008	1356364681	/nfs/dbraw/zinc/36/46/81/1356364681.db2.gz	FYETUVOIJKAQLT-RARDXLECSA-N	0	3	342.458	3.027	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](C2CCN(C(=O)[C@@H](C)OC)CC2)CC1	ZINC001075448093	1356381142	/nfs/dbraw/zinc/38/11/42/1356381142.db2.gz	NOWHVDXYAQHEOK-CVEARBPZSA-N	0	3	342.911	3.115	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cc4ccccc4nc3C)[C@@H]2C1	ZINC001075852350	1356434084	/nfs/dbraw/zinc/43/40/84/1356434084.db2.gz	RYVIMHJTEQEAGH-FXAWDEMLSA-N	0	3	335.451	3.266	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)C1(C(F)(F)F)CCC1	ZINC001099120769	1363635256	/nfs/dbraw/zinc/63/52/56/1363635256.db2.gz	DZDHXNTXWLYIIJ-CQSZACIVSA-N	0	3	344.421	3.349	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)C[C@@H](C)c1c(C)n[nH]c1C	ZINC001099126659	1363639596	/nfs/dbraw/zinc/63/95/96/1363639596.db2.gz	YBCBKXODMPUNED-PBHICJAKSA-N	0	3	346.519	3.313	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)C(C)(C)C(C)(F)F	ZINC001099325512	1363751557	/nfs/dbraw/zinc/75/15/57/1363751557.db2.gz	WGBSZUXFWJDKIN-AWEZNQCLSA-N	0	3	328.447	3.298	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)COC1CCC(C)CC1	ZINC001099359920	1363772576	/nfs/dbraw/zinc/77/25/76/1363772576.db2.gz	UEILDXFPHAVATH-ADKAHSJRSA-N	0	3	336.520	3.375	20	30		EGEDHN
CCCCCCCCC(=O)NCC[C@H](C)NC(=O)CN(CC)CC	ZINC001078328340	1356953856	/nfs/dbraw/zinc/95/38/56/1356953856.db2.gz	SGGZCRAHJDZHMC-KRWDZBQOSA-N	0	3	341.540	3.090	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2csc(Cl)n2)C12CCC2	ZINC001078773174	1357077995	/nfs/dbraw/zinc/07/79/95/1357077995.db2.gz	CBAHHCFWRRYFFI-MNOVXSKESA-N	0	3	346.283	3.180	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2ccc(OCC3CC3)cc2)C1	ZINC001080962297	1357769685	/nfs/dbraw/zinc/76/96/85/1357769685.db2.gz	XSADOHQVKVUHJO-DNVCBOLYSA-N	0	3	328.456	3.102	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2sccc2Cl)C[C@H]1c1ccccc1	ZINC001081119753	1357838707	/nfs/dbraw/zinc/83/87/07/1357838707.db2.gz	LWQLEWFVWCUDCW-GOEBONIOSA-N	0	3	344.867	3.233	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2coc(C(F)F)c2)C[C@H]1c1ccccc1	ZINC001081168295	1357847084	/nfs/dbraw/zinc/84/70/84/1357847084.db2.gz	QQGJOHBUPJKAAK-JKSUJKDBSA-N	0	3	344.361	3.048	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2cc(C)cc(C)c2)C[C@H]1c1ccccc1	ZINC001081219347	1357850744	/nfs/dbraw/zinc/85/07/44/1357850744.db2.gz	XXRTYZHNHKKHAA-LEWJYISDSA-N	0	3	332.447	3.134	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2ccc(C(C)(C)CC)cc2)[C@H](OC)C1	ZINC001081833835	1357869521	/nfs/dbraw/zinc/86/95/21/1357869521.db2.gz	FIKXQVQEEOSMGZ-RTBURBONSA-N	0	3	344.499	3.379	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)C(C)(C)C2CCCCC2)[C@H](OC)C1	ZINC001082214998	1357978690	/nfs/dbraw/zinc/97/86/90/1357978690.db2.gz	FKOLGWFRLRKBAV-QZTJIDSGSA-N	0	3	336.520	3.375	20	30		EGEDHN
C[C@H](C#N)C(=O)N1C[C@@H](C)[C@H](NCc2cc(Cl)ccc2Cl)C1	ZINC001082451298	1358039938	/nfs/dbraw/zinc/03/99/38/1358039938.db2.gz	WCYRNFPYNSNAOD-UEKVPHQBSA-N	0	3	340.254	3.090	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@]2(C)CC=CCC2)C[C@H]1NCc1ccc(C#N)s1	ZINC001082530812	1358054965	/nfs/dbraw/zinc/05/49/65/1358054965.db2.gz	MFFDGNBXZGEMCJ-LSBZLQRGSA-N	0	3	343.496	3.303	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H](C)[C@H](NCc2c(C)nsc2C)C1	ZINC001082721708	1358079880	/nfs/dbraw/zinc/07/98/80/1358079880.db2.gz	GHOLEODSBVYPPK-NJAPINKUSA-N	0	3	335.517	3.299	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@@]23C[C@@H]2CCCC3)C[C@H]1NCc1ccc(C#N)s1	ZINC001082727557	1358082588	/nfs/dbraw/zinc/08/25/88/1358082588.db2.gz	FCMRITRLOUNZOZ-AHMDFLBRSA-N	0	3	343.496	3.137	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3cc(F)c(Cl)cc3F)[C@@H]2C1	ZINC001084620841	1358257609	/nfs/dbraw/zinc/25/76/09/1358257609.db2.gz	XPUIPZSHZLVARO-BDJLRTHQSA-N	0	3	340.801	3.341	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3sc(C)cc3OC)[C@@H]2C1	ZINC001084701201	1358286552	/nfs/dbraw/zinc/28/65/52/1358286552.db2.gz	SRPVINNNCNQAIJ-HUUCEWRRSA-N	0	3	334.485	3.178	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)Cc3cccc(OCCC)c3)[C@@H]2C1	ZINC001084764547	1358304245	/nfs/dbraw/zinc/30/42/45/1358304245.db2.gz	MOFKXHVRRGXMAQ-UYAOXDASSA-N	0	3	342.483	3.127	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)[C@H](CC)Cc3ccccc3C)[C@@H]2C1	ZINC001084775680	1358307298	/nfs/dbraw/zinc/30/72/98/1358307298.db2.gz	QADSTNNXSUZQDG-HMXCVIKNSA-N	0	3	338.495	3.120	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)[C@H]3CCCCc4ccccc43)[C@@H]2C1	ZINC001084857912	1358331717	/nfs/dbraw/zinc/33/17/17/1358331717.db2.gz	ALQFOOWEHUGPQX-HLAWJBBLSA-N	0	3	336.479	3.053	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H]2CCN(Cc3ncccc3C)[C@H]2C1	ZINC001085023973	1358369568	/nfs/dbraw/zinc/36/95/68/1358369568.db2.gz	JJUGMDAVEUNJAS-LMNJBCLMSA-N	0	3	341.499	3.415	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cc(-c2ccco2)on1	ZINC001085289916	1358454268	/nfs/dbraw/zinc/45/42/68/1358454268.db2.gz	GCZKXQMGFFQDNS-CHWSQXEVSA-N	0	3	349.818	3.318	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)Cc1cc(F)ccc1F	ZINC001085314213	1358463116	/nfs/dbraw/zinc/46/31/16/1358463116.db2.gz	KQOPDBORZGVWAD-HZPDHXFCSA-N	0	3	342.817	3.277	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1CC12CCC2	ZINC001085347139	1358474211	/nfs/dbraw/zinc/47/42/11/1358474211.db2.gz	DZVSKHVOJNMWKU-BFHYXJOUSA-N	0	3	341.293	3.102	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H](C)c1c(C)noc1C	ZINC001085362887	1358478711	/nfs/dbraw/zinc/47/87/11/1358478711.db2.gz	ARZXLQXAOMCLLC-KCPJHIHWSA-N	0	3	339.867	3.164	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccnc(-c2ccco2)c1	ZINC001085661979	1358664773	/nfs/dbraw/zinc/66/47/73/1358664773.db2.gz	NFCWTDSIAFXHBH-QGZVFWFLSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc(-c2cnco2)cc1	ZINC001085675883	1358680871	/nfs/dbraw/zinc/68/08/71/1358680871.db2.gz	BXEUHRROWORTPF-SFHVURJKSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1coc2ccc(OC)cc12	ZINC001085715476	1358707167	/nfs/dbraw/zinc/70/71/67/1358707167.db2.gz	LQFRGZSZZGYGSQ-CQSZACIVSA-N	0	3	328.412	3.164	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@H]1COc2cc(C)c(C)cc21	ZINC001085742945	1358725721	/nfs/dbraw/zinc/72/57/21/1358725721.db2.gz	CFJGPWVUBOYEEP-HKUYNNGSSA-N	0	3	342.483	3.278	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cncc2sccc21	ZINC001085782857	1358758360	/nfs/dbraw/zinc/75/83/60/1358758360.db2.gz	GMMQLJAZHPXYFC-CQSZACIVSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc(Cl)cc1OC	ZINC001085786591	1358761485	/nfs/dbraw/zinc/76/14/85/1358761485.db2.gz	RHGGNZWTBMSSRE-OAHLLOKOSA-N	0	3	336.863	3.461	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc(Cl)c(OC)c1	ZINC001085855193	1358823136	/nfs/dbraw/zinc/82/31/36/1358823136.db2.gz	SAEAOAZZSCCYHX-OAHLLOKOSA-N	0	3	336.863	3.461	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1cnoc1-c1ccccc1	ZINC001085901733	1358860323	/nfs/dbraw/zinc/86/03/23/1358860323.db2.gz	LLENGNXYIQBFSX-INIZCTEOSA-N	0	3	325.412	3.064	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cnn(C(C)C)c1C1CC1	ZINC001085915614	1358874764	/nfs/dbraw/zinc/87/47/64/1358874764.db2.gz	FQCBTRXTKPQXMV-QGZVFWFLSA-N	0	3	344.503	3.454	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1cc(C)n(CC2CC2)c1C	ZINC001085927429	1358885464	/nfs/dbraw/zinc/88/54/64/1358885464.db2.gz	YBNMNXCTBONDEX-GOSISDBHSA-N	0	3	329.488	3.237	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc(Br)o1	ZINC001085940446	1358898359	/nfs/dbraw/zinc/89/83/59/1358898359.db2.gz	HSDHNXOOMUWLBX-GFCCVEGCSA-N	0	3	341.249	3.155	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1	ZINC001085995853	1358951790	/nfs/dbraw/zinc/95/17/90/1358951790.db2.gz	WRZYHLZDXNFOMR-GBESFXJTSA-N	0	3	330.447	3.428	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2coc3cc(F)ccc23)C1	ZINC001086131119	1359005080	/nfs/dbraw/zinc/00/50/80/1359005080.db2.gz	HOWNRVVJHUXPDR-BJHJDKERSA-N	0	3	336.794	3.422	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@H]2CC[C@H](C(F)(F)F)C2)C1	ZINC001086178181	1359016455	/nfs/dbraw/zinc/01/64/55/1359016455.db2.gz	WGKKABZBUKYCCI-ZDEQEGDKSA-N	0	3	338.801	3.202	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(C)c(Cl)c2)C1	ZINC001086186670	1359020374	/nfs/dbraw/zinc/02/03/74/1359020374.db2.gz	JWMJHYMRGDVNJD-XBXGTLAGSA-N	0	3	327.255	3.499	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(Cl)c(F)c2)C1	ZINC001086207976	1359026582	/nfs/dbraw/zinc/02/65/82/1359026582.db2.gz	TUXAZPRKIGKKSZ-KLPPZKSPSA-N	0	3	331.218	3.330	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2oc(CC(C)C)nc2C)C1	ZINC001086220071	1359031737	/nfs/dbraw/zinc/03/17/37/1359031737.db2.gz	HQCXSHFLPUQJOZ-OKILXGFUSA-N	0	3	339.867	3.032	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc(Cl)cc(OC)c2)C1	ZINC001086230758	1359034089	/nfs/dbraw/zinc/03/40/89/1359034089.db2.gz	AKCVGJJZEIOWTI-VDISTLRHSA-N	0	3	343.254	3.199	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cnoc2-c2ccccc2)C1	ZINC001086242559	1359039688	/nfs/dbraw/zinc/03/96/88/1359039688.db2.gz	SFWSYDJUXYOGLE-OTVXOJSOSA-N	0	3	345.830	3.192	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(N(CC)CC)cc2)C1	ZINC001086260557	1359046147	/nfs/dbraw/zinc/04/61/47/1359046147.db2.gz	HNSJMUSNPHLXMF-WOVMCDHWSA-N	0	3	349.906	3.383	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)C2C3CC4CC(C3)CC2C4)C1	ZINC001086388251	1359084566	/nfs/dbraw/zinc/08/45/66/1359084566.db2.gz	USPIUKCXXXCUNR-MVFKYCOMSA-N	0	3	336.907	3.296	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(C)nc2C2CC2)C1	ZINC001086440485	1359097854	/nfs/dbraw/zinc/09/78/54/1359097854.db2.gz	ATGVOIVBGFAHKX-CTYIDZIISA-N	0	3	333.863	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc3ncccc3c2)C1	ZINC001086465481	1359107753	/nfs/dbraw/zinc/10/77/53/1359107753.db2.gz	GGZIBAAIGFRWPK-SAZUREKKSA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@@H]2C[C@H]2c2ccc(OC)cc2)C1	ZINC001086500418	1359121683	/nfs/dbraw/zinc/12/16/83/1359121683.db2.gz	BANUTHRXIKYXKI-QXRTWZOPSA-N	0	3	348.874	3.036	20	30		EGEDHN
C=C(C)CN1C[C@@H](c2ccccc2)[C@H](NC(=O)Cc2cccs2)C1	ZINC001086571578	1359151422	/nfs/dbraw/zinc/15/14/22/1359151422.db2.gz	DJKQNAVMRWMPER-RBUKOAKNSA-N	0	3	340.492	3.451	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)[C@@H]2CCC(C)(C)C2)C1	ZINC001086608576	1359163132	/nfs/dbraw/zinc/16/31/32/1359163132.db2.gz	PBZGRPNUBOLKMC-HSALFYBXSA-N	0	3	338.495	3.420	20	30		EGEDHN
CC/C=C(/C)C(=O)N1CC[C@H](CNCc2ccccc2C#N)[C@@H](C)C1	ZINC001184030500	1387383156	/nfs/dbraw/zinc/38/31/56/1387383156.db2.gz	DMQDYBSYLBOFAK-MVGNEYNHSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=C(C)CN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2cc3c([nH]2)CCC3)C1	ZINC001086619633	1359166252	/nfs/dbraw/zinc/16/62/52/1359166252.db2.gz	ZZVGZFMCWHXHAE-GHTZIAJQSA-N	0	3	349.478	3.277	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)C2Cc3ccccc3C2)C1	ZINC001086811733	1359206362	/nfs/dbraw/zinc/20/63/62/1359206362.db2.gz	GLUQJQXRBXRXEY-KBXCAEBGSA-N	0	3	332.875	3.028	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CC[C@H](CNC(=O)[C@@H]2CC23CCC3)C1	ZINC001086815850	1359207650	/nfs/dbraw/zinc/20/76/50/1359207650.db2.gz	LHHPISBFJVUHMR-IPELMVKDSA-N	0	3	337.467	3.123	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)[C@H]3CCC(F)(F)C3)C2)CC1	ZINC001086926915	1359251818	/nfs/dbraw/zinc/25/18/18/1359251818.db2.gz	NPDOCGPTZFPCPW-HOTGVXAUSA-N	0	3	338.442	3.148	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H]3CCC(F)(F)C3)C2)CC1	ZINC001086926916	1359252078	/nfs/dbraw/zinc/25/20/78/1359252078.db2.gz	NPDOCGPTZFPCPW-HZPDHXFCSA-N	0	3	338.442	3.148	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H]3CC[C@@H]4C[C@@H]4CC3)C2)CC1	ZINC001086934245	1359257902	/nfs/dbraw/zinc/25/79/02/1359257902.db2.gz	KPIZMZCBTXOINC-CADBVGFASA-N	0	3	328.500	3.149	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)Cc3cc(C)ccc3C)C2)CC1	ZINC001086940972	1359262799	/nfs/dbraw/zinc/26/27/99/1359262799.db2.gz	FWZFUCOAFYMVIY-LJQANCHMSA-N	0	3	338.495	3.182	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)C3CCC(F)CC3)C2)CC1	ZINC001086941161	1359263341	/nfs/dbraw/zinc/26/33/41/1359263341.db2.gz	LCWYFVOWLPSGAT-AOCRQIFASA-N	0	3	334.479	3.241	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cccc4[nH]ccc43)C2)CC1	ZINC001086944474	1359265489	/nfs/dbraw/zinc/26/54/89/1359265489.db2.gz	ZZRFMFDPEYSVMA-MRXNPFEDSA-N	0	3	335.451	3.118	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cc([C@@H](C)CC)no3)C2)CC1	ZINC001086947013	1359268212	/nfs/dbraw/zinc/26/82/12/1359268212.db2.gz	OCKIMFCPGDTJCA-HOTGVXAUSA-N	0	3	343.471	3.138	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3csc(Cl)c3)C2)CC1	ZINC001086947101	1359268617	/nfs/dbraw/zinc/26/86/17/1359268617.db2.gz	PNLVAZHLEHZEMP-ZDUSSCGKSA-N	0	3	336.888	3.351	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cc(Cl)cs3)C2)CC1	ZINC001086947215	1359268676	/nfs/dbraw/zinc/26/86/76/1359268676.db2.gz	RYPVMDBZNMGTLD-ZDUSSCGKSA-N	0	3	336.888	3.351	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cccc4c3ccn4C)C2)CC1	ZINC001086947847	1359269217	/nfs/dbraw/zinc/26/92/17/1359269217.db2.gz	IQSGAIWLWNIHOC-QGZVFWFLSA-N	0	3	349.478	3.128	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@H](C)c3cc(C)oc3C)C2)CC1	ZINC001086949023	1359270172	/nfs/dbraw/zinc/27/01/72/1359270172.db2.gz	PIWRFUBYBWPPRL-DOTOQJQBSA-N	0	3	342.483	3.336	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)CCc3cccs3)C2)CC1	ZINC001086956061	1359276957	/nfs/dbraw/zinc/27/69/57/1359276957.db2.gz	CXPKRMCNNMOEDV-INIZCTEOSA-N	0	3	330.497	3.017	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc4c(c3)CCC4)C2)CC1	ZINC001086956595	1359277884	/nfs/dbraw/zinc/27/78/84/1359277884.db2.gz	QYHHEBCVYKKYLF-KRWDZBQOSA-N	0	3	336.479	3.125	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3c[nH]c4ccc(C)cc34)C2)CC1	ZINC001086958381	1359279186	/nfs/dbraw/zinc/27/91/86/1359279186.db2.gz	OOYJWCCQQOIIPA-KRWDZBQOSA-N	0	3	349.478	3.426	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3cnc(CC)s3)C2)CC1	ZINC001086958163	1359279374	/nfs/dbraw/zinc/27/93/74/1359279374.db2.gz	FZSRSXNVRYLUEH-HNNXBMFYSA-N	0	3	345.512	3.045	20	30		EGEDHN
C[C@@H]1CCN(C(=O)C2CCC2)[C@H](CNCc2ccc(C#N)s2)C1	ZINC001087107412	1359287690	/nfs/dbraw/zinc/28/76/90/1359287690.db2.gz	UXRRSETUOOEIBQ-HIFRSBDPSA-N	0	3	331.485	3.137	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc(C)c(C)o3)C(C)(C)[C@H]21	ZINC001087282805	1359362125	/nfs/dbraw/zinc/36/21/25/1359362125.db2.gz	DZRHJVTVKWKQOM-NJAFHUGGSA-N	0	3	328.456	3.139	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc4c(o3)CCCC4)C(C)(C)[C@@H]21	ZINC001087289679	1359368322	/nfs/dbraw/zinc/36/83/22/1359368322.db2.gz	QMHVXKFRUSOQSE-ATZDWAIDSA-N	0	3	340.467	3.010	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)Cc3cccc(C)c3)C(C)(C)[C@H]21	ZINC001087299846	1359382303	/nfs/dbraw/zinc/38/23/03/1359382303.db2.gz	CIIVPUOTOGXEND-GIVPXCGWSA-N	0	3	338.495	3.166	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc2ccccc2n1C	ZINC001087302167	1359384976	/nfs/dbraw/zinc/38/49/76/1359384976.db2.gz	OPPDGMSRRHJLSG-LSTHTHJFSA-N	0	3	349.478	3.030	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc4ccccc4n3C)C(C)(C)[C@H]21	ZINC001087302166	1359385031	/nfs/dbraw/zinc/38/50/31/1359385031.db2.gz	OPPDGMSRRHJLSG-AHRSYUTCSA-N	0	3	349.478	3.030	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3occc3Cl)C(C)(C)[C@H]21	ZINC001087303323	1359386650	/nfs/dbraw/zinc/38/66/50/1359386650.db2.gz	JWFQVJXCHIZVML-WQVCFCJDSA-N	0	3	334.847	3.175	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc4ccncc43)C(C)(C)[C@@H]21	ZINC001087311150	1359399212	/nfs/dbraw/zinc/39/92/12/1359399212.db2.gz	JRYOLOZFBZBZFL-MISYRCLQSA-N	0	3	347.462	3.087	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc(Cl)c3)C(C)(C)[C@@H]21	ZINC001087313938	1359402905	/nfs/dbraw/zinc/40/29/05/1359402905.db2.gz	CFVBOFKAXJYYHD-BRWVUGGUSA-N	0	3	330.859	3.192	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(F)cc(F)c3)C(C)(C)[C@H]21	ZINC001087316046	1359406631	/nfs/dbraw/zinc/40/66/31/1359406631.db2.gz	MAQKIDYYJGQFJA-KURKYZTESA-N	0	3	346.421	3.207	20	30		EGEDHN
C[C@H](C(=O)NCC1(NCc2cccc(C#N)c2)CC1)C1CCCC1	ZINC001323591176	1387398102	/nfs/dbraw/zinc/39/81/02/1387398102.db2.gz	GVGYMPGHEDYLHR-HNNXBMFYSA-N	0	3	325.456	3.123	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)[C@H]2CC2(C)C)CCN1Cc1ccc(C#N)cc1	ZINC001087544559	1359524515	/nfs/dbraw/zinc/52/45/15/1359524515.db2.gz	OWSADWYARNWSAP-FGTMMUONSA-N	0	3	325.456	3.073	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccccc2-c2ccncc2)[C@H]1CC	ZINC001087623412	1359560527	/nfs/dbraw/zinc/56/05/27/1359560527.db2.gz	DHUKEMUQUUHMDV-LEWJYISDSA-N	0	3	347.462	3.355	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CCN(Cc3ccc(C)cc3)[C@@H]2CC)c1	ZINC001087718704	1359611042	/nfs/dbraw/zinc/61/10/42/1359611042.db2.gz	DBRGIJSOQOFGKG-LEWJYISDSA-N	0	3	347.462	3.154	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(F)c(Cl)c2)[C@H]1CC	ZINC001087738674	1359619697	/nfs/dbraw/zinc/61/96/97/1359619697.db2.gz	NCRLGTDLXXPQMF-DLBZAZTESA-N	0	3	336.838	3.014	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cccc(-c3cnco3)c2)[C@H]1CC	ZINC001087781580	1359641107	/nfs/dbraw/zinc/64/11/07/1359641107.db2.gz	SBTAUBMMDNHCQZ-DLBZAZTESA-N	0	3	325.412	3.110	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C[C@H]2CCCc3ccccc32)[C@H]1CC	ZINC001087805673	1359655704	/nfs/dbraw/zinc/65/57/04/1359655704.db2.gz	QTRIDJYANGTCDM-HLAWJBBLSA-N	0	3	338.495	3.489	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)C[C@@H]2CCc3ccccc3C2)[C@H]1CC	ZINC001087808878	1359658722	/nfs/dbraw/zinc/65/87/22/1359658722.db2.gz	NPRXONBMIBBPAQ-LSTHTHJFSA-N	0	3	326.484	3.337	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2[nH]c3ccccc3c2OC)[C@H]1CC	ZINC001087843614	1359677174	/nfs/dbraw/zinc/67/71/74/1359677174.db2.gz	HRDIBOQNKUZJGS-DLBZAZTESA-N	0	3	341.455	3.335	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)[C@@H](c3ccccc3)C(C)C)C[C@@H]2C1	ZINC001088122229	1359764094	/nfs/dbraw/zinc/76/40/94/1359764094.db2.gz	SOYVJZBKOGOJNE-QHAWAJNXSA-N	0	3	338.495	3.230	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)C(CC)(CC)c3ccccc3)C[C@@H]2C1	ZINC001088209174	1359795238	/nfs/dbraw/zinc/79/52/38/1359795238.db2.gz	KDOMGGAXZDVJJW-MOPGFXCFSA-N	0	3	338.495	3.158	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2ncc3ccccn32)C1	ZINC001088347575	1359834105	/nfs/dbraw/zinc/83/41/05/1359834105.db2.gz	VKPOEIRDHWVSAT-HNNXBMFYSA-N	0	3	346.862	3.061	20	30		EGEDHN
CC[C@H](F)C(=O)N1CCCCC[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001088360534	1359844826	/nfs/dbraw/zinc/84/48/26/1359844826.db2.gz	APSKMOJPDDDPBN-SJORKVTESA-N	0	3	349.425	3.306	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N1CCCCC[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001088363237	1359846294	/nfs/dbraw/zinc/84/62/94/1359846294.db2.gz	KVVFRKDFWMBEKW-QGTPRVQTSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2ocnc2C(F)F)C1	ZINC001088382756	1359864796	/nfs/dbraw/zinc/86/47/96/1359864796.db2.gz	LJYZVOATRZUQKJ-NSHDSACASA-N	0	3	347.793	3.339	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)C2(CC)CCOCC2)C1	ZINC001088406562	1359878534	/nfs/dbraw/zinc/87/85/34/1359878534.db2.gz	YZVKIXDQRSHPPL-MRXNPFEDSA-N	0	3	342.911	3.307	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2c[nH]c3cccnc23)C1	ZINC001088413913	1359884532	/nfs/dbraw/zinc/88/45/32/1359884532.db2.gz	RWKQRGMQKOMMDC-AWEZNQCLSA-N	0	3	346.862	3.290	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2ccc(C)nc2C)C1	ZINC001088430614	1359898408	/nfs/dbraw/zinc/89/84/08/1359898408.db2.gz	UEOOGWMPJMWYPL-MRXNPFEDSA-N	0	3	335.879	3.425	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)[C@H](C)C2CCOCC2)C1	ZINC001088435739	1359903373	/nfs/dbraw/zinc/90/33/73/1359903373.db2.gz	NVILOBSZZZQUSX-NVXWUHKLSA-N	0	3	342.911	3.162	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2oc3c(cccc3F)c2C)[C@H]1C	ZINC001088622641	1359994214	/nfs/dbraw/zinc/99/42/14/1359994214.db2.gz	HQJSCLAMQQGCQO-CJNGLKHVSA-N	0	3	328.387	3.096	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cc3c([nH]2)c(F)ccc3C)[C@H]1C	ZINC001088683364	1360011851	/nfs/dbraw/zinc/01/18/51/1360011851.db2.gz	RTUNWBCTAHDUBZ-CJNGLKHVSA-N	0	3	329.419	3.384	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)Cc2c[nH]c3cc(C)ccc23)[C@H]1C	ZINC001088914683	1360102218	/nfs/dbraw/zinc/10/22/18/1360102218.db2.gz	NMCFBQVTIWQOLF-QAPCUYQASA-N	0	3	325.456	3.174	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccc(C(F)(F)F)cc2)[C@H]1C	ZINC001088998236	1360130776	/nfs/dbraw/zinc/13/07/76/1360130776.db2.gz	JKWOZZONTXLRNH-DOMZBBRYSA-N	0	3	326.362	3.474	20	30		EGEDHN
Cc1cc(CN(C)C[C@@H]2CCCCN2C(=O)C#CC2CC2)cs1	ZINC001089174966	1360228087	/nfs/dbraw/zinc/22/80/87/1360228087.db2.gz	MQSMXRKUWGOYOQ-SFHVURJKSA-N	0	3	330.497	3.283	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccnc2C(F)F)CC(C)(C)C1	ZINC001089435199	1360426223	/nfs/dbraw/zinc/42/62/23/1360426223.db2.gz	FNFLMKDQPACIRL-CQSZACIVSA-N	0	3	349.425	3.263	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2c(C)[nH]c3ccccc32)CC(C)(C)C1	ZINC001089435427	1360426998	/nfs/dbraw/zinc/42/69/98/1360426998.db2.gz	JCWGFKRSYFJMKO-MRXNPFEDSA-N	0	3	337.467	3.330	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@H]2[C@@H]3CCCCCC[C@@H]32)CC(C)(C)C1	ZINC001089502044	1360475668	/nfs/dbraw/zinc/47/56/68/1360475668.db2.gz	LDVABRCIJGSXHV-INDMIFKZSA-N	0	3	330.516	3.443	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc3c(C)cccn3c2)CC(C)(C)C1	ZINC001089542528	1360498932	/nfs/dbraw/zinc/49/89/32/1360498932.db2.gz	UTWMIVULEMJJBY-GOSISDBHSA-N	0	3	337.467	3.101	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C3CC3)cn2)CC(C)(C)C1	ZINC001089551923	1360503552	/nfs/dbraw/zinc/50/35/52/1360503552.db2.gz	LJJXBDYKOANESO-SFHVURJKSA-N	0	3	339.483	3.203	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@H](C)c2cccc(OC)c2)CC(C)(C)C1	ZINC001089567132	1360513606	/nfs/dbraw/zinc/51/36/06/1360513606.db2.gz	WKWWQKHTSZTWRZ-SJLPKXTDSA-N	0	3	342.483	3.039	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)n(C(C)C)n2)CC(C)(C)C1	ZINC001089570804	1360515958	/nfs/dbraw/zinc/51/59/58/1360515958.db2.gz	UMWUPLVQXJVQTR-QGZVFWFLSA-N	0	3	344.503	3.016	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cccc(C)c1F	ZINC001089642306	1360555501	/nfs/dbraw/zinc/55/55/01/1360555501.db2.gz	IMCYFZCMAJOFRA-INIZCTEOSA-N	0	3	330.447	3.378	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cccc(C)c1F	ZINC001089642307	1360555572	/nfs/dbraw/zinc/55/55/72/1360555572.db2.gz	IMCYFZCMAJOFRA-MRXNPFEDSA-N	0	3	330.447	3.378	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H]1C[C@H]1c1ccncc1	ZINC001089642923	1360556206	/nfs/dbraw/zinc/55/62/06/1360556206.db2.gz	PZXDWVOLGQGCAF-GBESFXJTSA-N	0	3	341.499	3.368	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(C2CC2)n(C)n1	ZINC001089648877	1360561784	/nfs/dbraw/zinc/56/17/84/1360561784.db2.gz	UJMXLAVYXZPSAC-MRXNPFEDSA-N	0	3	344.503	3.094	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@@H]1CCC(C)(C)CN1CC(=C)C	ZINC001089651796	1360564408	/nfs/dbraw/zinc/56/44/08/1360564408.db2.gz	NZNVVHRYLXKEGW-KRWDZBQOSA-N	0	3	329.488	3.471	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ncccc1CC	ZINC001089661168	1360572124	/nfs/dbraw/zinc/57/21/24/1360572124.db2.gz	SZPXVKUYKGPBJB-KRWDZBQOSA-N	0	3	329.488	3.441	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(C)ccc1OC	ZINC001089666804	1360576704	/nfs/dbraw/zinc/57/67/04/1360576704.db2.gz	XFFOPLHLYXSSEI-KRWDZBQOSA-N	0	3	342.483	3.247	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(Cl)cn1C	ZINC001089667364	1360577375	/nfs/dbraw/zinc/57/73/75/1360577375.db2.gz	DWSSKKAVGKNDCC-HNNXBMFYSA-N	0	3	337.895	3.475	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1coc(C(F)F)c1	ZINC001089687299	1360593771	/nfs/dbraw/zinc/59/37/71/1360593771.db2.gz	HXOIRXQCYSXKCQ-CQSZACIVSA-N	0	3	338.398	3.461	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(C)nc1OC	ZINC001089705413	1360608363	/nfs/dbraw/zinc/60/83/63/1360608363.db2.gz	FGOCQORDLFRJPO-MRXNPFEDSA-N	0	3	345.487	3.195	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H]1[C@@H]2c3ccccc3C[C@H]12	ZINC001089707559	1360611072	/nfs/dbraw/zinc/61/10/72/1360611072.db2.gz	NEKABMNDQMBBFW-GSEOLPGOSA-N	0	3	338.495	3.365	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1c(C)[nH]nc1C(C)C	ZINC001089720951	1360623158	/nfs/dbraw/zinc/62/31/58/1360623158.db2.gz	AINFVOBXRGEQOY-HNNXBMFYSA-N	0	3	332.492	3.248	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1c(C)n[nH]c1C(C)C	ZINC001089720951	1360623159	/nfs/dbraw/zinc/62/31/59/1360623159.db2.gz	AINFVOBXRGEQOY-HNNXBMFYSA-N	0	3	332.492	3.248	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1cccc(F)c1	ZINC001089764831	1360655483	/nfs/dbraw/zinc/65/54/83/1360655483.db2.gz	UTHPZSODXLPKFJ-OWLYRPNTSA-N	0	3	348.849	3.361	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1coc(C)c1	ZINC001089798929	1360668571	/nfs/dbraw/zinc/66/85/71/1360668571.db2.gz	BDCQASHXKZAWOJ-LLLHUVSDSA-N	0	3	334.847	3.123	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)C(C)(C)C2CC2)C1	ZINC001089849467	1360696635	/nfs/dbraw/zinc/69/66/35/1360696635.db2.gz	FJBQGDANJCVKTM-HJWJTTGWSA-N	0	3	336.907	3.344	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1(C)CC=CC1	ZINC001089860435	1360705028	/nfs/dbraw/zinc/70/50/28/1360705028.db2.gz	WTHJKBHLTAKUGG-YVSFHVDLSA-N	0	3	334.891	3.264	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](CNCc2nccn2CC)[C@@H](C)C1	ZINC001184487588	1387470633	/nfs/dbraw/zinc/47/06/33/1387470633.db2.gz	RLKMRCZTKIIRCU-DLBZAZTESA-N	0	3	346.519	3.080	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CC2=CCCCC2)CC2(CCOCC2)C1	ZINC001089928507	1360748740	/nfs/dbraw/zinc/74/87/40/1360748740.db2.gz	GTPWMPFNGFOCCY-GOSISDBHSA-N	0	3	332.488	3.050	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)[C@H]2CCCCC2(C)C)CC2(CCOCC2)C1	ZINC001089969312	1360772584	/nfs/dbraw/zinc/77/25/84/1360772584.db2.gz	IDLXICLVGTTXMB-ZWKOTPCHSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cccc(F)c2Cl)C1	ZINC001091256025	1361023855	/nfs/dbraw/zinc/02/38/55/1361023855.db2.gz	PHZLDRXJFKOHRT-UHFFFAOYSA-N	0	3	331.218	3.330	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cccc3ccncc32)C1	ZINC001091306078	1361037418	/nfs/dbraw/zinc/03/74/18/1361037418.db2.gz	AFGUDRJCKZCPFW-UHFFFAOYSA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc3scnc3c2)C1	ZINC001091307854	1361038102	/nfs/dbraw/zinc/03/81/02/1361038102.db2.gz	GIWAAPLPJPKUFL-UHFFFAOYSA-N	0	3	335.860	3.147	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@@]2(C)C1	ZINC001092065041	1361286006	/nfs/dbraw/zinc/28/60/06/1361286006.db2.gz	IBHLIPLCDMKMLO-BSIFCXSSSA-N	0	3	339.483	3.131	20	30		EGEDHN
CC(=O)N1CCC([C@@H]2N(CC#Cc3ccccc3)CC23CCC3)CC1	ZINC001093349885	1361564147	/nfs/dbraw/zinc/56/41/47/1361564147.db2.gz	YKVNIADEDKGGMO-NRFANRHFSA-N	0	3	336.479	3.151	20	30		EGEDHN
C=CC[N@@H+]1CC2(CCC2)[C@@H]1C1CCN(C(=O)c2ccccc2[O-])CC1	ZINC001093353895	1361568191	/nfs/dbraw/zinc/56/81/91/1361568191.db2.gz	DEQKBWSQRSXULH-IBGZPJMESA-N	0	3	340.467	3.285	20	30		EGEDHN
C=CC[N@H+]1CC2(CCC2)[C@@H]1C1CCN(C(=O)c2ccccc2[O-])CC1	ZINC001093353895	1361568192	/nfs/dbraw/zinc/56/81/92/1361568192.db2.gz	DEQKBWSQRSXULH-IBGZPJMESA-N	0	3	340.467	3.285	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccoc1C(F)(F)F)C2	ZINC001095470611	1362152518	/nfs/dbraw/zinc/15/25/18/1362152518.db2.gz	PJYYTILSTKAEHQ-WXHSDQCUSA-N	0	3	328.334	3.210	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cncc(-c3ccccc3)c1)C2	ZINC001095498690	1362157254	/nfs/dbraw/zinc/15/72/54/1362157254.db2.gz	ARUJCMLYQRCDGP-HKBOAZHASA-N	0	3	345.446	3.107	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C1([C@@H]3CCCCO3)CCC1)C2	ZINC001095748342	1362220457	/nfs/dbraw/zinc/22/04/57/1362220457.db2.gz	ASCNAJVLSBGYKF-OWSLCNJRSA-N	0	3	332.488	3.023	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ncc(Cl)s1)C2	ZINC001095757257	1362222228	/nfs/dbraw/zinc/22/22/28/1362222228.db2.gz	YKTPKIKIGHIMRC-WOPDTQHZSA-N	0	3	325.865	3.098	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc3ncccc3o1)C2	ZINC001095775299	1362225647	/nfs/dbraw/zinc/22/56/47/1362225647.db2.gz	WILZHEKEJWKXLR-YCPHGPKFSA-N	0	3	325.412	3.129	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3CC2CC(F)(F)C2)cc1	ZINC001095853973	1362256836	/nfs/dbraw/zinc/25/68/36/1362256836.db2.gz	FSBWPDWBYGHTER-SQNIBIBYSA-N	0	3	344.405	3.048	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc3c(c1)[C@H](C)CO3)C2	ZINC001095896340	1362276976	/nfs/dbraw/zinc/27/69/76/1362276976.db2.gz	LSGRWWYPBVCROG-WCZJQEMASA-N	0	3	326.440	3.094	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc3cc(OC)ccc3[nH]1)C2	ZINC001095945713	1362299156	/nfs/dbraw/zinc/29/91/56/1362299156.db2.gz	CYZDGZFKHZLUNX-LJHODMEESA-N	0	3	339.439	3.088	20	30		EGEDHN
C[C@H]1CN(C(=O)CCCF)CC[C@@H]1CNCc1cc(F)ccc1C#N	ZINC001184955292	1387572113	/nfs/dbraw/zinc/57/21/13/1387572113.db2.gz	CYSXORLQQGFGMT-GOEBONIOSA-N	0	3	349.425	3.021	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc(C3CCCC3)no1)C2	ZINC001096571962	1362583810	/nfs/dbraw/zinc/58/38/10/1362583810.db2.gz	FGXJGMAOYDKGDU-PVAVHDDUSA-N	0	3	329.444	3.243	20	30		EGEDHN
Cc1cccc(Cl)c1CN1CCC(C)(NC(=O)[C@H](C)C#N)CC1	ZINC001324301911	1387588429	/nfs/dbraw/zinc/58/84/29/1387588429.db2.gz	QIIXZGDUMTYVCZ-CQSZACIVSA-N	0	3	333.863	3.279	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](N[C@@H]2CCc3c2cc(F)cc3F)C1	ZINC001185035115	1387593331	/nfs/dbraw/zinc/59/33/31/1387593331.db2.gz	LESXSVLLAWGMTG-DNVCBOLYSA-N	0	3	346.421	3.336	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1conc1C1CCCC1)C2	ZINC001097204355	1362885493	/nfs/dbraw/zinc/88/54/93/1362885493.db2.gz	UMXGZRBLPLWEAV-OIISXLGYSA-N	0	3	329.444	3.243	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cccc(-n3cccc3)c1)C2	ZINC001097467709	1363007960	/nfs/dbraw/zinc/00/79/60/1363007960.db2.gz	ZHCBPGRKDHWVOQ-AQNXPRMDSA-N	0	3	335.451	3.389	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc(-c3ccccc3)on1)C2	ZINC001097487243	1363016388	/nfs/dbraw/zinc/01/63/88/1363016388.db2.gz	FUTVMXDVPBXVJR-NUJGCVRESA-N	0	3	337.423	3.253	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](CNCc2ccn(C(C)C)n2)[C@H](C)C1	ZINC001185062246	1387605226	/nfs/dbraw/zinc/60/52/26/1387605226.db2.gz	RSEZUFHRTHHEOE-QZTJIDSGSA-N	0	3	346.519	3.395	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](CNCc3cnc(C)o3)[C@@H](C)C2)CC1	ZINC001185096095	1387617978	/nfs/dbraw/zinc/61/79/78/1387617978.db2.gz	YGSQUEASPLWYGU-RDJZCZTQSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H](C)c1cccs1)C[C@@H](C)O2	ZINC001098635198	1363409360	/nfs/dbraw/zinc/40/93/60/1363409360.db2.gz	DWJDHVOZNRIJGA-CVEARBPZSA-N	0	3	348.512	3.120	20	30		EGEDHN
CCCCCCCNCc1cn([C@H]2CCN(C(=O)C(C)(C)C)C2)nn1	ZINC001098773537	1363463055	/nfs/dbraw/zinc/46/30/55/1363463055.db2.gz	DZCNGDHBIZGARJ-KRWDZBQOSA-N	0	3	349.523	3.158	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccn(C3CCCCC3)n2)C1	ZINC001098837152	1363487158	/nfs/dbraw/zinc/48/71/58/1363487158.db2.gz	LQPFFZRFXBORRN-JXFKEZNVSA-N	0	3	342.487	3.159	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2ccn(C3CCCC3)n2)C1	ZINC001098860694	1363494880	/nfs/dbraw/zinc/49/48/80/1363494880.db2.gz	STCYILYPBYQWMF-JXFKEZNVSA-N	0	3	342.487	3.159	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H]1CC=CCC1	ZINC001098881341	1363504087	/nfs/dbraw/zinc/50/40/87/1363504087.db2.gz	ZJRNBTAATHRASK-ZWKOTPCHSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(C)c3cccnc23)C1	ZINC001098950663	1363537132	/nfs/dbraw/zinc/53/71/32/1363537132.db2.gz	LRQCGCZFBCDJEW-KKSFZXQISA-N	0	3	335.451	3.314	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)CCC1CCC1	ZINC001099012670	1363573845	/nfs/dbraw/zinc/57/38/45/1363573845.db2.gz	MIUOZMSFGLDVKF-SFHVURJKSA-N	0	3	336.520	3.376	20	30		EGEDHN
C#CCCCC(=O)NC[C@H]1CCC(C)(C)CN1CCOCC(C)C	ZINC001099042828	1363589664	/nfs/dbraw/zinc/58/96/64/1363589664.db2.gz	CJZYJFMZIKEOSD-GOSISDBHSA-N	0	3	336.520	3.069	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CCC[C@]3(NC(=O)[C@@H]3CC34CCC4)C2)c1	ZINC001099055771	1363597869	/nfs/dbraw/zinc/59/78/69/1363597869.db2.gz	RGFZLXPRHGSPSG-IPJJNNNSSA-N	0	3	349.478	3.219	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@H](C)C1CCC1	ZINC001099126237	1363638540	/nfs/dbraw/zinc/63/85/40/1363638540.db2.gz	PWHREPUHVZRRCF-AEFFLSMTSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)C1(C2CC2)CCC1	ZINC001099158225	1363661451	/nfs/dbraw/zinc/66/14/51/1363661451.db2.gz	DGGXFUKKMKUTDJ-SFHVURJKSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)CCCC1CC1	ZINC001099188907	1363681401	/nfs/dbraw/zinc/68/14/01/1363681401.db2.gz	LPAATAMFUHQGDT-GOSISDBHSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CCC(C)(C)CN2CCOCC)CC1	ZINC001099213698	1363694819	/nfs/dbraw/zinc/69/48/19/1363694819.db2.gz	GDMULQKGICUBCX-SFHVURJKSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H](C)CC(C)C	ZINC001099291305	1363734876	/nfs/dbraw/zinc/73/48/76/1363734876.db2.gz	GUYXUDPRPMSIHW-QZTJIDSGSA-N	0	3	338.536	3.478	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)COc1ccsc1	ZINC001099310319	1363743380	/nfs/dbraw/zinc/74/33/80/1363743380.db2.gz	JQXGRIAQJQAOSF-OAHLLOKOSA-N	0	3	336.501	3.310	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)[C@H](C)Oc1ccccn1	ZINC001099316604	1363746376	/nfs/dbraw/zinc/74/63/76/1363746376.db2.gz	WTSMZJWMQKMCAI-IRXDYDNUSA-N	0	3	345.487	3.032	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)COc1ccccc1	ZINC001099319534	1363747055	/nfs/dbraw/zinc/74/70/55/1363747055.db2.gz	AVARPNLXAVLBLA-QGZVFWFLSA-N	0	3	330.472	3.248	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)COCc1ccccc1	ZINC001099334262	1363755840	/nfs/dbraw/zinc/75/58/40/1363755840.db2.gz	GHPLILCWRACJFL-IBGZPJMESA-N	0	3	344.499	3.386	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)C1(c2ccccc2)CC1	ZINC001099334257	1363755929	/nfs/dbraw/zinc/75/59/29/1363755929.db2.gz	GCYGYVRYBKOVPD-LJQANCHMSA-N	0	3	338.495	3.348	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)[C@@](C)(CC)CCC)CC2(CCOCC2)C1	ZINC001099594652	1363877412	/nfs/dbraw/zinc/87/74/12/1363877412.db2.gz	IIEWVTBAJYGPSS-ICSRJNTNSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C(C)(CC)CC)CC2(CCOCC2)C1	ZINC001099596605	1363878891	/nfs/dbraw/zinc/87/88/91/1363878891.db2.gz	HMQHMBYSKGNEPA-KRWDZBQOSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1CCN(Cc2ccc(CCC)cc2)C[C@H]1O	ZINC001099858376	1363966138	/nfs/dbraw/zinc/96/61/38/1363966138.db2.gz	KXJPJSNUALWVQC-VQTJNVASSA-N	0	3	344.499	3.047	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1CCN(Cc2ccccc2C(C)C)C[C@@H]1O	ZINC001099959101	1363991686	/nfs/dbraw/zinc/99/16/86/1363991686.db2.gz	CGSOSHPJKVPHJQ-OALUTQOASA-N	0	3	344.499	3.074	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2CCN(CC3=CCCCC3)C[C@H]2O)CCCC1	ZINC001100145529	1364025778	/nfs/dbraw/zinc/02/57/78/1364025778.db2.gz	MGYKCDRYCVPJEL-RBUKOAKNSA-N	0	3	346.515	3.175	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](c2ccc(OC)cc2)[C@H](NC/C=C/Cl)C1	ZINC001100154948	1364029165	/nfs/dbraw/zinc/02/91/65/1364029165.db2.gz	MXEUOESSWKUSBR-XMTSCWHASA-N	0	3	348.874	3.298	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](CNCc2ccn(CC)n2)[C@H](C)C1	ZINC001185223985	1387656420	/nfs/dbraw/zinc/65/64/20/1387656420.db2.gz	CEIWVWVRRZMMNT-IAGOWNOFSA-N	0	3	346.519	3.080	20	30		EGEDHN
C#CCCCCC(=O)NCC1CC(NCc2cccc(C(C)C)n2)C1	ZINC001100259404	1364060862	/nfs/dbraw/zinc/06/08/62/1364060862.db2.gz	KALUNVGYPCBNMC-UHFFFAOYSA-N	0	3	341.499	3.383	20	30		EGEDHN
Cc1csc(C(=O)NCC2CC(NCC#Cc3ccccc3)C2)c1	ZINC001100301388	1364072250	/nfs/dbraw/zinc/07/22/50/1364072250.db2.gz	IZAFVSWHQHCQFE-UHFFFAOYSA-N	0	3	338.476	3.206	20	30		EGEDHN
C#CCCCCCC(=O)NCC1CC(NCC=C(Cl)Cl)C1	ZINC001100570510	1364167269	/nfs/dbraw/zinc/16/72/69/1364167269.db2.gz	XMZMKOFLLRILGB-UHFFFAOYSA-N	0	3	331.287	3.374	20	30		EGEDHN
C=C/C(C)=C\CC(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1	ZINC001100583093	1364174037	/nfs/dbraw/zinc/17/40/37/1364174037.db2.gz	KQGJXAVXKQDUPE-CPSFFCFKSA-N	0	3	341.430	3.204	20	30		EGEDHN
Cc1cccc(C)c1C(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100699104	1364223920	/nfs/dbraw/zinc/22/39/20/1364223920.db2.gz	BTHQRPDIFNNIQA-UHFFFAOYSA-N	0	3	346.474	3.453	20	30		EGEDHN
CC(C)(C)C(=O)NCC1CC(NCC#Cc2cccc(Cl)c2)C1	ZINC001100902703	1364323479	/nfs/dbraw/zinc/32/34/79/1364323479.db2.gz	FBUXLKUOEPVWBP-UHFFFAOYSA-N	0	3	332.875	3.222	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@H](C)c2ccc(F)c(F)c2)C1	ZINC001101006381	1364367839	/nfs/dbraw/zinc/36/78/39/1364367839.db2.gz	HTJJSBOOFRMCEK-LKSINWNRSA-N	0	3	342.817	3.305	20	30		EGEDHN
C#CCC1(C(=O)NCC2CC(NCc3cncs3)C2)CCCCC1	ZINC001101055162	1364393903	/nfs/dbraw/zinc/39/39/03/1364393903.db2.gz	LKIIEHUBJNDPQL-UHFFFAOYSA-N	0	3	345.512	3.101	20	30		EGEDHN
C=CCC1(C(=O)NCC2CC(NCc3conc3C)C2)CCCC1	ZINC001101080420	1364403935	/nfs/dbraw/zinc/40/39/35/1364403935.db2.gz	OSGOCPZDNSEDHD-UHFFFAOYSA-N	0	3	331.460	3.104	20	30		EGEDHN
C=CCN1CC[C@H](Oc2ccnc(CNC(=O)[C@H](C)C(C)(C)C)c2)C1	ZINC001101095422	1364411636	/nfs/dbraw/zinc/41/16/36/1364411636.db2.gz	IIDOBRQDVCAWSR-YJBOKZPZSA-N	0	3	345.487	3.019	20	30		EGEDHN
CCCCC(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@@]2(C)C1	ZINC001101128685	1364422235	/nfs/dbraw/zinc/42/22/35/1364422235.db2.gz	NEOIJLQOGONBBS-QUCCMNQESA-N	0	3	325.456	3.029	20	30		EGEDHN
C=CCC[C@@H](C)[N@@H+]1C[C@@H]2CN(C(=O)c3ccccc3[O-])C[C@]2(C)C1	ZINC001101129025	1364422962	/nfs/dbraw/zinc/42/29/62/1364422962.db2.gz	XCRUBDDDEASJQI-QINHECLXSA-N	0	3	328.456	3.141	20	30		EGEDHN
C=CCC[C@@H](C)[N@H+]1C[C@@H]2CN(C(=O)c3ccccc3[O-])C[C@]2(C)C1	ZINC001101129025	1364422965	/nfs/dbraw/zinc/42/29/65/1364422965.db2.gz	XCRUBDDDEASJQI-QINHECLXSA-N	0	3	328.456	3.141	20	30		EGEDHN
C#CCCCC(=O)N1C[C@H]2CN([C@@H](C)c3cccc(F)c3)C[C@@]2(C)C1	ZINC001101212995	1364464497	/nfs/dbraw/zinc/46/44/97/1364464497.db2.gz	MYUHIFGRBYKBKF-CDXJDZJCSA-N	0	3	342.458	3.471	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@H]2CN(Cc3ncccc3C)C[C@@]2(C)C1	ZINC001101251782	1364486321	/nfs/dbraw/zinc/48/63/21/1364486321.db2.gz	KMJBGJVLECRFEP-UTKZUKDTSA-N	0	3	341.499	3.273	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@H]2CN(Cc3cccnc3C)C[C@@]2(C)C1	ZINC001101253710	1364487455	/nfs/dbraw/zinc/48/74/55/1364487455.db2.gz	TZMFIYWMYQKCFD-QUCCMNQESA-N	0	3	327.472	3.027	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@H]2CN(Cc3oc(C)nc3C)C[C@@]2(C)C1	ZINC001101337017	1364515886	/nfs/dbraw/zinc/51/58/86/1364515886.db2.gz	ZZBVFRPJIFMUEB-NQYLQCIDSA-N	0	3	345.487	3.174	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)CC/C=C\c3ccccc3)C[C@]2(C)C1	ZINC001101363926	1364528595	/nfs/dbraw/zinc/52/85/95/1364528595.db2.gz	GPWIRLLVCUUTRX-JEQVTAEKSA-N	0	3	336.479	3.284	20	30		EGEDHN
C=CCC[C@@H](C)N1CC2(C1)C[C@H](NC(=O)CCCCC)c1nccn12	ZINC001101609104	1364653977	/nfs/dbraw/zinc/65/39/77/1364653977.db2.gz	UBSSIYSRVLZNIX-SJORKVTESA-N	0	3	344.503	3.390	20	30		EGEDHN
CCCCCCN(C)CC(=O)N(C)CCNc1cccc(F)c1C#N	ZINC001101719940	1364702934	/nfs/dbraw/zinc/70/29/34/1364702934.db2.gz	NESNARPKLYWAFN-UHFFFAOYSA-N	0	3	348.466	3.080	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CNC(=O)CC(C)(C)C	ZINC001101726212	1364705178	/nfs/dbraw/zinc/70/51/78/1364705178.db2.gz	LHTRJTIPZPADPT-ZIAGYGMSSA-N	0	3	333.501	3.240	20	30		EGEDHN
C/C(=C/C(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C)C1CC1	ZINC001101772319	1364721587	/nfs/dbraw/zinc/72/15/87/1364721587.db2.gz	BVOIWIVATKUMEB-DCAYXJQRSA-N	0	3	343.496	3.160	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1CNC(=O)CCC1CC1	ZINC001101831181	1364743364	/nfs/dbraw/zinc/74/33/64/1364743364.db2.gz	UDFDBRAIGLNRBF-RDTXWAMCSA-N	0	3	343.446	3.072	20	30		EGEDHN
CCC(=CC(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C)CC	ZINC001101873544	1364760020	/nfs/dbraw/zinc/76/00/20/1364760020.db2.gz	NCFUPGPASUEETF-WIYYLYMNSA-N	0	3	338.495	3.469	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@@H]1CN([C@@H](C)c2ccc(F)c(F)c2)C[C@H]1C	ZINC001101943231	1364784259	/nfs/dbraw/zinc/78/42/59/1364784259.db2.gz	NCJSHDJWVCDXNT-HLLBOEOZSA-N	0	3	348.437	3.369	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H]1CN(Cc2c(C)onc2CC)C[C@H]1C	ZINC001102219408	1364940899	/nfs/dbraw/zinc/94/08/99/1364940899.db2.gz	GAZBCDNLHRTCSZ-GDBMZVCRSA-N	0	3	347.503	3.332	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](NCc3ccnc(Cl)c3)C2)CCC1	ZINC001185463298	1387722304	/nfs/dbraw/zinc/72/23/04/1387722304.db2.gz	OIGFKEABTNQTTE-OAHLLOKOSA-N	0	3	333.863	3.172	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](NCc3cc(C)ccc3OC)C2)CC1	ZINC001185487101	1387728967	/nfs/dbraw/zinc/72/89/67/1387728967.db2.gz	SXOFISJUXALONP-GOSISDBHSA-N	0	3	342.483	3.441	20	30		EGEDHN
C#CCCCC(=O)NCC[C@@H]1CN(Cc2ccc(F)c(F)c2)C[C@H]1C	ZINC001102916969	1365290708	/nfs/dbraw/zinc/29/07/08/1365290708.db2.gz	GUQUDJNETUVGQC-NVXWUHKLSA-N	0	3	348.437	3.343	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cc3ncccc3o2)C1	ZINC001103240068	1365450444	/nfs/dbraw/zinc/45/04/44/1365450444.db2.gz	JTCIRMZPASLANT-TZMCWYRMSA-N	0	3	347.846	3.268	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1CCNC(=O)CC1(C)CC1	ZINC001103244127	1365452871	/nfs/dbraw/zinc/45/28/71/1365452871.db2.gz	NXWLUWATJZTTFG-SJLPKXTDSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2nc(Cl)cs2)C1	ZINC001103366686	1365520308	/nfs/dbraw/zinc/52/03/08/1365520308.db2.gz	PRPGBOZNAIQOSM-MWLCHTKSSA-N	0	3	348.299	3.237	20	30		EGEDHN
C=CCCC1(C(=O)NCC[C@@H]2CN(Cc3cnc(C)o3)C[C@H]2C)CC1	ZINC001103403937	1365539377	/nfs/dbraw/zinc/53/93/77/1365539377.db2.gz	YUNWFUAKFFBMCR-NVXWUHKLSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2occc2Cl)C1	ZINC001103408627	1365542954	/nfs/dbraw/zinc/54/29/54/1365542954.db2.gz	LDLWHGUZCDHWGH-ZYHUDNBSSA-N	0	3	331.243	3.373	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2nccc3[nH]ccc32)C1	ZINC001103446898	1365564938	/nfs/dbraw/zinc/56/49/38/1365564938.db2.gz	BGSKLBRSZQVKBX-TZMCWYRMSA-N	0	3	346.862	3.003	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC[C@@H]1CN(Cc2cnc(C)o2)C[C@H]1C	ZINC001103474635	1365583890	/nfs/dbraw/zinc/58/38/90/1365583890.db2.gz	GJXSLZRRQWOMKS-GDBMZVCRSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cc3c([nH]2)CCCC3)C1	ZINC001103619826	1365682631	/nfs/dbraw/zinc/68/26/31/1365682631.db2.gz	QAXBIYNXUCLJQO-CZUORRHYSA-N	0	3	349.906	3.334	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2scnc2Cl)C1	ZINC001103726578	1365750924	/nfs/dbraw/zinc/75/09/24/1365750924.db2.gz	GPQNYOXEKPWUGF-MWLCHTKSSA-N	0	3	348.299	3.237	20	30		EGEDHN
C=C[C@@H](CC(=O)NCC[C@@H]1CN(CCF)C[C@H]1C)c1ccccc1	ZINC001103744591	1365760400	/nfs/dbraw/zinc/76/04/00/1365760400.db2.gz	ITTWIRJUYNHZPH-ZIFCJYIRSA-N	0	3	332.463	3.390	20	30		EGEDHN
CC/C=C(/C)C(=O)N1C[C@@H](C)[C@H](CCNCc2ccccc2C#N)C1	ZINC001103948404	1365844260	/nfs/dbraw/zinc/84/42/60/1365844260.db2.gz	PQBIJKHHXKWBRY-ZEEKJCGCSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)[C@@H]2C[C@H]2C(C)(C)C)C[C@H]1C	ZINC001104409810	1366011013	/nfs/dbraw/zinc/01/10/13/1366011013.db2.gz	BBNPQMJLXKOMCL-DTZQCDIJSA-N	0	3	326.912	3.495	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)[C@H](CCNCc2cc(C3CC3)no2)C1	ZINC001104492131	1366046805	/nfs/dbraw/zinc/04/68/05/1366046805.db2.gz	PYMTWJMPPQDXHY-GDBMZVCRSA-N	0	3	345.487	3.338	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)[C@H](CCNCc2c(C)noc2C)C1	ZINC001104492132	1366046976	/nfs/dbraw/zinc/04/69/76/1366046976.db2.gz	PZAIIZVWKRTUQG-CZUORRHYSA-N	0	3	333.476	3.078	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2ccc3n[nH]cc3c2)C[C@H]1C	ZINC001104594633	1366093976	/nfs/dbraw/zinc/09/39/76/1366093976.db2.gz	MKUDJAHYVCYXCQ-IUODEOHRSA-N	0	3	346.862	3.003	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H](C)[C@H](CCNCc2nccn2CC)C1	ZINC001104631228	1366110200	/nfs/dbraw/zinc/11/02/00/1366110200.db2.gz	FSUPZBSQWMSUKC-HLIPFELVSA-N	0	3	346.519	3.080	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H](C)[C@H](CCNCc2conc2CC)C1	ZINC001104731763	1366149273	/nfs/dbraw/zinc/14/92/73/1366149273.db2.gz	WIEIORMVCNFUJI-HZPDHXFCSA-N	0	3	347.503	3.414	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)CC#Cc2ccccc2)C[C@H]1C	ZINC001105044943	1366290371	/nfs/dbraw/zinc/29/03/71/1366290371.db2.gz	JRTYRNLYPZWVJZ-VQIMIIECSA-N	0	3	344.886	3.255	20	30		EGEDHN
CCCCCCCNCc1cn(C2CN(C(=O)CCCCC)C2)nn1	ZINC001105157375	1366349360	/nfs/dbraw/zinc/34/93/60/1366349360.db2.gz	IXWNFOJCZJGULB-UHFFFAOYSA-N	0	3	349.523	3.302	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)CCCC2CC2)CC1	ZINC001105394377	1366443652	/nfs/dbraw/zinc/44/36/52/1366443652.db2.gz	VUXAWMZCGQAGHN-FQEVSTJZSA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C2(CC=C)CCC2)CC1	ZINC001105396460	1366445346	/nfs/dbraw/zinc/44/53/46/1366445346.db2.gz	MBNQOTNNVZFWNM-IBGZPJMESA-N	0	3	340.511	3.459	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](CNCc2cc(-c3ccco3)on2)[C@H](C)C1	ZINC001105926740	1366599397	/nfs/dbraw/zinc/59/93/97/1366599397.db2.gz	FDDCGPSMSXYCJG-HUUCEWRRSA-N	0	3	343.427	3.085	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001106183870	1366617472	/nfs/dbraw/zinc/61/74/72/1366617472.db2.gz	RWOQVZGAVVXJCB-VQIMIIECSA-N	0	3	339.483	3.345	20	30		EGEDHN
C=CCCC1(C(=O)N2C[C@@H](CNCc3ncc(C)s3)[C@H](C)C2)CC1	ZINC001106633815	1366761494	/nfs/dbraw/zinc/76/14/94/1366761494.db2.gz	VXZYRIOBPWXEKA-GDBMZVCRSA-N	0	3	347.528	3.382	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC[C@]12CCC[C@H]1N(Cc1cccc(Cl)c1)CC2	ZINC001107336257	1366931888	/nfs/dbraw/zinc/93/18/88/1366931888.db2.gz	JLARBQGCUYJMMW-POZUXBRTSA-N	0	3	345.874	3.360	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@]12CCC[C@H]1N(Cc1cccc(F)c1)CC2	ZINC001107394016	1366950741	/nfs/dbraw/zinc/95/07/41/1366950741.db2.gz	SUSCNBALKCWQKJ-TZIWHRDSSA-N	0	3	342.458	3.346	20	30		EGEDHN
CC(C)(C)C#CC(=O)NC[C@]12CCC[C@H]1N(CCC(F)(F)F)CC2	ZINC001107399851	1366952916	/nfs/dbraw/zinc/95/29/16/1366952916.db2.gz	MURIJCXKVYHRIV-RHSMWYFYSA-N	0	3	344.421	3.349	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)[C@H](CC)CC3CCCC3)[C@@H]2C1	ZINC001189302551	1366982668	/nfs/dbraw/zinc/98/26/68/1366982668.db2.gz	FOPXGAWNFXTXRS-HSALFYBXSA-N	0	3	348.531	3.328	20	30		EGEDHN
C=CCOCC(=O)N1CC[C@H](N(C)C/C=C\c2ccc(Cl)cc2)C1	ZINC001189379633	1367007648	/nfs/dbraw/zinc/00/76/48/1367007648.db2.gz	LECDGLQBOMANJC-XDXAGZTOSA-N	0	3	348.874	3.089	20	30		EGEDHN
CCC[C@H](C(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1)C(C)C	ZINC001186019142	1387847604	/nfs/dbraw/zinc/84/76/04/1387847604.db2.gz	LXCUZCIFZNSJMZ-MSOLQXFVSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccccc1)OCC	ZINC001109357734	1367086220	/nfs/dbraw/zinc/08/62/20/1367086220.db2.gz	WMCYHWHOBZFFCK-FYQPLNBISA-N	0	3	342.483	3.279	20	30		EGEDHN
C=CCC[C@@H](C)N1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1scnc1CC)C2	ZINC001109377076	1367094076	/nfs/dbraw/zinc/09/40/76/1367094076.db2.gz	JKECTECFRDBFNF-VDERGJSUSA-N	0	3	333.501	3.395	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)[C@@H](C)CCC(C)(C)C)[C@@H]2C1	ZINC001189810830	1367112750	/nfs/dbraw/zinc/11/27/50/1367112750.db2.gz	JDUNLPKWBJYFNZ-OKZBNKHCSA-N	0	3	336.520	3.184	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](N(C)[C@@H](C)c2ccc(F)c(F)c2)C1	ZINC001189925985	1367131942	/nfs/dbraw/zinc/13/19/42/1367131942.db2.gz	JLJQFYDBUASGRQ-HOCLYGCPSA-N	0	3	334.410	3.362	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)C=C2CCCCC2)C1	ZINC001107786436	1367145930	/nfs/dbraw/zinc/14/59/30/1367145930.db2.gz	XYKAELVBEDFREJ-XLIONFOSSA-N	0	3	334.504	3.439	20	30		EGEDHN
COc1ccc(CN(C)[C@H]2CCN(C(=O)C#CC(C)C)C2)cc1Cl	ZINC001190054610	1367162064	/nfs/dbraw/zinc/16/20/64/1367162064.db2.gz	SIMCVNOTNSMHKO-INIZCTEOSA-N	0	3	348.874	3.041	20	30		EGEDHN
COc1cc(CN(C)[C@@H]2CCN(C(=O)C#CC(C)C)C2)ccc1Cl	ZINC001190054017	1367162954	/nfs/dbraw/zinc/16/29/54/1367162954.db2.gz	NURXLKAUDWDJLO-MRXNPFEDSA-N	0	3	348.874	3.041	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cnc(CC3CC3)s1)C2	ZINC001109548083	1367191402	/nfs/dbraw/zinc/19/14/02/1367191402.db2.gz	MAPPGTZJCJILRP-PMPSAXMXSA-N	0	3	345.512	3.397	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2ccoc2CC)C1	ZINC001107910696	1367197707	/nfs/dbraw/zinc/19/77/07/1367197707.db2.gz	MKSDVBDVVDFFFW-BEFAXECRSA-N	0	3	334.460	3.017	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)C(CC=C)CC=C)C1	ZINC001107965342	1367221061	/nfs/dbraw/zinc/22/10/61/1367221061.db2.gz	VUWWPUSXPPVNED-YLJYHZDGSA-N	0	3	334.504	3.317	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@]1(C)CN(C[C@H](C)CC(C)C)CCO1	ZINC001107970896	1367224880	/nfs/dbraw/zinc/22/48/80/1367224880.db2.gz	KWIOQVBVSXYYLL-YLJYHZDGSA-N	0	3	338.536	3.478	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2c(C)oc3ccccc32)C1	ZINC001190319057	1367225659	/nfs/dbraw/zinc/22/56/59/1367225659.db2.gz	NLPSPLOIXQRORB-INIZCTEOSA-N	0	3	342.439	3.090	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2[nH]ccc2C2CC2)C1	ZINC001107990143	1367232610	/nfs/dbraw/zinc/23/26/10/1367232610.db2.gz	AWFDFKBTXYGNLW-FOIQADDNSA-N	0	3	345.487	3.068	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)Cc2ccc(C)cc2)C1	ZINC001108058689	1367261137	/nfs/dbraw/zinc/26/11/37/1367261137.db2.gz	FIBBADRSJMDVQH-RXVVDRJESA-N	0	3	344.499	3.099	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](N(C)Cc2cccc(OC)c2C)C1	ZINC001190436037	1367265172	/nfs/dbraw/zinc/26/51/72/1367265172.db2.gz	OUUGVPOFELRWSK-SFHVURJKSA-N	0	3	330.472	3.393	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@]1(C)CN(CCC(C)(C)C)CCO1	ZINC001108122536	1367292486	/nfs/dbraw/zinc/29/24/86/1367292486.db2.gz	UHSYNBKWYNXAGK-HXUWFJFHSA-N	0	3	336.520	3.213	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@]1(C)CN(CC2CCCCC2)CCO1	ZINC001108129862	1367296669	/nfs/dbraw/zinc/29/66/69/1367296669.db2.gz	PFKMNQDMSIZCOG-OAQYLSRUSA-N	0	3	348.531	3.358	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2cc[nH]c2C(C)C)C1	ZINC001108153532	1367313402	/nfs/dbraw/zinc/31/34/02/1367313402.db2.gz	QLMMXFGPZKQFQO-OXJNMPFZSA-N	0	3	347.503	3.314	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)C2(CCC=C)CC2)C1	ZINC001108185862	1367329027	/nfs/dbraw/zinc/32/90/27/1367329027.db2.gz	GPPFKJJAEXTTFI-HKUYNNGSSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)[C@H]2CC[C@H](C3CCC3)CC2)C1	ZINC001190745166	1367340478	/nfs/dbraw/zinc/34/04/78/1367340478.db2.gz	VANGKIXYLUJZLS-UFYCRDLUSA-N	0	3	348.531	3.328	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1sc(CC)nc1C)C2	ZINC001109829834	1367344354	/nfs/dbraw/zinc/34/43/54/1367344354.db2.gz	YPJAUSOAZQMIIA-ILXRZTDVSA-N	0	3	333.501	3.315	20	30		EGEDHN
C#CCC1(C(=O)NC[C@@]2(C)CN(C[C@H](C)CC)CCO2)CCCCC1	ZINC001108429701	1367452681	/nfs/dbraw/zinc/45/26/81/1367452681.db2.gz	MODQUJMCNZXNDT-QUCCMNQESA-N	0	3	348.531	3.213	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1scnc1Cl)C2	ZINC001110105681	1367505146	/nfs/dbraw/zinc/50/51/46/1367505146.db2.gz	YHUXQCZGNKDRLF-WOPDTQHZSA-N	0	3	325.865	3.098	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCCOc1cccc(F)c1)C2	ZINC001110117868	1367509429	/nfs/dbraw/zinc/50/94/29/1367509429.db2.gz	QQKZHXYVCJOSNA-NEWSRXKRSA-N	0	3	346.446	3.282	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N1CC[C@@H](N(C)Cc2cccc(F)c2)C1	ZINC001191577045	1367531773	/nfs/dbraw/zinc/53/17/73/1367531773.db2.gz	OZNCSGUKQYPPBZ-UYAOXDASSA-N	0	3	348.462	3.087	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N1CC[C@@H](N(C)Cc2cccc(F)c2)C1	ZINC001191577044	1367532815	/nfs/dbraw/zinc/53/28/15/1367532815.db2.gz	OZNCSGUKQYPPBZ-QUCCMNQESA-N	0	3	348.462	3.087	20	30		EGEDHN
C#CC[C@H](CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CC(=C)C)c1ccccc1	ZINC001110201299	1367561013	/nfs/dbraw/zinc/56/10/13/1367561013.db2.gz	AHFDVKNQOMHVJT-CGXNFDGLSA-N	0	3	336.479	3.481	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](N(C)C[C@@H](OC)c2ccccc2)C1	ZINC001191718878	1367569495	/nfs/dbraw/zinc/56/94/95/1367569495.db2.gz	HTECOHKECDDMMQ-QZTJIDSGSA-N	0	3	330.472	3.119	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](N(C)C[C@H](OC)c2ccccc2)C1	ZINC001191718877	1367569875	/nfs/dbraw/zinc/56/98/75/1367569875.db2.gz	HTECOHKECDDMMQ-MSOLQXFVSA-N	0	3	330.472	3.119	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H](N(C)CCOc2ccccc2)C1	ZINC001191911450	1367635501	/nfs/dbraw/zinc/63/55/01/1367635501.db2.gz	GDQZONZGQPXAAB-MSOLQXFVSA-N	0	3	330.472	3.200	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H](N(C)CCOc2ccccc2)C1	ZINC001191911455	1367635816	/nfs/dbraw/zinc/63/58/16/1367635816.db2.gz	GDQZONZGQPXAAB-ZWKOTPCHSA-N	0	3	330.472	3.200	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@H](N(C)CCOCCC(C)C)C2)CC1	ZINC001192218324	1367722012	/nfs/dbraw/zinc/72/20/12/1367722012.db2.gz	NYXLYKRPOTUYGN-SFHVURJKSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccccc1C	ZINC001109038185	1367734857	/nfs/dbraw/zinc/73/48/57/1367734857.db2.gz	MYFJLTUMXIAYOC-RNQOJCNYSA-N	0	3	342.483	3.198	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1cccc(C)c1	ZINC001109038597	1367735131	/nfs/dbraw/zinc/73/51/31/1367735131.db2.gz	ULZLRNJREPWTTG-LMCOJAPRSA-N	0	3	342.483	3.198	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1oc(CC3CC3)nc1C)C2	ZINC001110566889	1367837278	/nfs/dbraw/zinc/83/72/78/1367837278.db2.gz	OSURJRMREKXOBZ-ZACQAIPSSA-N	0	3	343.471	3.237	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCCc1csc(C)n1)C2	ZINC001110566980	1367837611	/nfs/dbraw/zinc/83/76/11/1367837611.db2.gz	SOKZIWBLGKGPHU-ZACQAIPSSA-N	0	3	333.501	3.072	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)C[C@H](CC)c2ccccc2)C1	ZINC001193434241	1368030467	/nfs/dbraw/zinc/03/04/67/1368030467.db2.gz	XUOCZPPLLSROCS-AZUAARDMSA-N	0	3	344.499	3.306	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)C2(C)CCCCCC2)C1	ZINC001193835085	1368125312	/nfs/dbraw/zinc/12/53/12/1368125312.db2.gz	NMQWONSHVBLICD-QZTJIDSGSA-N	0	3	336.520	3.255	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](C)CCc1ccccc1F)C2	ZINC001111018217	1368144107	/nfs/dbraw/zinc/14/41/07/1368144107.db2.gz	NGGWIOAPNHQGJK-QOJCHSLYSA-N	0	3	342.458	3.139	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2ccc(C(C)C)s2)C1	ZINC001194324941	1368231643	/nfs/dbraw/zinc/23/16/43/1368231643.db2.gz	GMYNSQLQGRFGRK-OAHLLOKOSA-N	0	3	336.501	3.220	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)CC2CCC(C)(C)CC2)C1	ZINC001194547798	1368283972	/nfs/dbraw/zinc/28/39/72/1368283972.db2.gz	YXEBDBVMNOBBEV-SFHVURJKSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CC[C@H](C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCOCC)c1ccccc1	ZINC001111434631	1368306763	/nfs/dbraw/zinc/30/67/63/1368306763.db2.gz	XANNZRJAMGPTAW-WCIQWLHISA-N	0	3	342.483	3.104	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](C)Cc1cccc(F)c1)C2	ZINC001111495217	1368320652	/nfs/dbraw/zinc/32/06/52/1368320652.db2.gz	PFXZPTZYECTOMC-PIKADFDJSA-N	0	3	330.447	3.302	20	30		EGEDHN
C=CCCC1(C(=O)N2C[C@H](C)OC3(CCN(CC=C)CC3)C2)CC1	ZINC001111549594	1368341880	/nfs/dbraw/zinc/34/18/80/1368341880.db2.gz	SSIMPEHGUOSGJK-KRWDZBQOSA-N	0	3	332.488	3.001	20	30		EGEDHN
CC[C@@H](C)C(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(C#N)cc1)C2	ZINC001111592739	1368357110	/nfs/dbraw/zinc/35/71/10/1368357110.db2.gz	WHRHRUJONDTNCJ-BPAFIMBUSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC/C=C(/C)C(=O)N[C@]12CCC[C@H]1CN(Cc1cccc(C#N)c1)C2	ZINC001111632728	1368394958	/nfs/dbraw/zinc/39/49/58/1368394958.db2.gz	XOPRQZKGKGXUTO-DSZDENPHSA-N	0	3	337.467	3.385	20	30		EGEDHN
C[C@@H](c1ccc(F)cc1)N1C[C@@H]2CCC[C@]2(NC(=O)C#CC2CC2)C1	ZINC001111741762	1368439260	/nfs/dbraw/zinc/43/92/60/1368439260.db2.gz	NQIPWAFUXUNRCS-XERREHJYSA-N	0	3	340.442	3.271	20	30		EGEDHN
C=C(C)CCC(=O)N[C@]12CCC[C@H]1CN(Cc1cnccc1C)C2	ZINC001111764034	1368450622	/nfs/dbraw/zinc/45/06/22/1368450622.db2.gz	VOGUAKBOCUIQFA-ICSRJNTNSA-N	0	3	327.472	3.217	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)CCCc2ccsc2)C1	ZINC001111782741	1368460320	/nfs/dbraw/zinc/46/03/20/1368460320.db2.gz	WIWLFICDASCSOF-HKUYNNGSSA-N	0	3	330.497	3.065	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2CN([C@@H](CC)c3ccccc3)C[C@H]2O)CC1	ZINC001195932388	1368518756	/nfs/dbraw/zinc/51/87/56/1368518756.db2.gz	ORMKWHYCSAKXIZ-CEXWTWQISA-N	0	3	342.483	3.045	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N[C@]12CCC[C@H]1CN(Cc1csc(C)c1)C2	ZINC001112018678	1368621387	/nfs/dbraw/zinc/62/13/87/1368621387.db2.gz	KCEJPZFOXNASNE-IEZWGBDMSA-N	0	3	348.512	3.118	20	30		EGEDHN
C=CCC[C@H](C)N1CCCN(C(=O)c2ncc(Cl)s2)CC1	ZINC001196493054	1368627148	/nfs/dbraw/zinc/62/71/48/1368627148.db2.gz	NYAJWEOESAHJFX-LBPRGKRZSA-N	0	3	327.881	3.299	20	30		EGEDHN
C=C(C)CN1CCCN(C(=O)CCCOc2ccc(F)cc2)CC1	ZINC001196704431	1368667285	/nfs/dbraw/zinc/66/72/85/1368667285.db2.gz	FWBSARORIJSXEY-UHFFFAOYSA-N	0	3	334.435	3.095	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)C23CCC(CC2)C3(C)C)C1	ZINC001196740200	1368673612	/nfs/dbraw/zinc/67/36/12/1368673612.db2.gz	XGTKTFADIBNQAM-BKVYSMKUSA-N	0	3	348.531	3.111	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)C(C)(C)CC(C)C)C[C@H]1C(F)(F)F	ZINC001112191289	1368706945	/nfs/dbraw/zinc/70/69/45/1368706945.db2.gz	ROCMMTSYRUSJPQ-ZIAGYGMSSA-N	0	3	332.410	3.061	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)C2(c3cc(C)no3)CC2)CC1	ZINC001196910355	1368711563	/nfs/dbraw/zinc/71/15/63/1368711563.db2.gz	NBQACHXVODJUHR-UHFFFAOYSA-N	0	3	345.487	3.295	20	30		EGEDHN
C=CCCCC(=O)N1CCCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC001197000720	1368728795	/nfs/dbraw/zinc/72/87/95/1368728795.db2.gz	YFGFZNLNIIVKNV-ICSRJNTNSA-N	0	3	344.499	3.042	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N1CCCN(CC/C=C/CC)CC1	ZINC001197396707	1368805165	/nfs/dbraw/zinc/80/51/65/1368805165.db2.gz	KTNJYSPXDDYRFX-WLMAVBAVSA-N	0	3	334.504	3.248	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@@H]2CCC[C@]2(CNCc2cnc(C)o2)C1	ZINC001112515227	1368909733	/nfs/dbraw/zinc/90/97/33/1368909733.db2.gz	ZABZHFBRURGEPI-UWVAXJGDSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@@H]2CCC[C@]2(CNCc2ocnc2C)C1	ZINC001112515041	1368910023	/nfs/dbraw/zinc/91/00/23/1368910023.db2.gz	SWYPFKIAZOTNJQ-UWVAXJGDSA-N	0	3	345.487	3.304	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)[C@H](C)Oc2ccccn2)CC1	ZINC001197843120	1368911417	/nfs/dbraw/zinc/91/14/17/1368911417.db2.gz	PQLAFGLEVCLUIB-SFHVURJKSA-N	0	3	347.503	3.354	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2cc(C)n(C(C)(C)C)n2)CC1	ZINC001198121785	1368964147	/nfs/dbraw/zinc/96/41/47/1368964147.db2.gz	ONJWVVWLHGSANQ-UHFFFAOYSA-N	0	3	332.492	3.061	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2ccc(N(C)C)cn2)CC1	ZINC001198296318	1368999511	/nfs/dbraw/zinc/99/95/11/1368999511.db2.gz	GQWZOQVADXPPBL-UHFFFAOYSA-N	0	3	346.519	3.266	20	30		EGEDHN
C=CCC1(C(=O)N2CCCN(C[C@H](OCC)C3CC3)CC2)CCCC1	ZINC001198423364	1369029787	/nfs/dbraw/zinc/02/97/87/1369029787.db2.gz	NZSAXRHXPUWAFE-IBGZPJMESA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)/C=C/c1ccco1)c1ccccc1OC	ZINC001198498927	1369045980	/nfs/dbraw/zinc/04/59/80/1369045980.db2.gz	FOLVUORTAQANOF-DXRVJIQQSA-N	0	3	340.423	3.325	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)C[C@H](OCC)C2=CCCC2)CC1	ZINC001112856469	1369050141	/nfs/dbraw/zinc/05/01/41/1369050141.db2.gz	MBLIKCGLJJKRKX-MJGOQNOKSA-N	0	3	334.504	3.391	20	30		EGEDHN
C#CCCCCC(=O)N1CCC([C@@H]2CCCN(CCF)CC2)CC1	ZINC001186591159	1387977998	/nfs/dbraw/zinc/97/79/98/1387977998.db2.gz	XKSTYSKHLXWQCJ-GOSISDBHSA-N	0	3	336.495	3.490	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)c1cc[nH]c1C)c1ccccc1OC	ZINC001198648164	1369081587	/nfs/dbraw/zinc/08/15/87/1369081587.db2.gz	SMOSIJXWIUYXCG-GOSISDBHSA-N	0	3	341.455	3.359	20	30		EGEDHN
C#CCCCC(=O)NC[C@H](NCCC(=C)C)c1ccccc1OC	ZINC001198695072	1369093025	/nfs/dbraw/zinc/09/30/25/1369093025.db2.gz	NTVHULVJXWIKMS-SFHVURJKSA-N	0	3	328.456	3.212	20	30		EGEDHN
CCCCCN[C@@H](CNC(=O)C#CC(C)C)c1ccccc1OC	ZINC001198713883	1369097814	/nfs/dbraw/zinc/09/78/14/1369097814.db2.gz	UGCJMDRFCQMRBW-SFHVURJKSA-N	0	3	330.472	3.292	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)c1cc[nH]c1)c1ccccc1OC	ZINC001198743372	1369103686	/nfs/dbraw/zinc/10/36/86/1369103686.db2.gz	XTAMUWZXSVPMHZ-QGZVFWFLSA-N	0	3	327.428	3.050	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)c1[nH]c(C)cc1C)c1ccccc1OC	ZINC001198776011	1369111521	/nfs/dbraw/zinc/11/15/21/1369111521.db2.gz	LSQPTDWCFROROX-KRWDZBQOSA-N	0	3	341.455	3.277	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@@H](C)C1CCC1)c1ccccc1OC	ZINC001198777281	1369112238	/nfs/dbraw/zinc/11/22/38/1369112238.db2.gz	XTJOHBXWGAERBB-YJBOKZPZSA-N	0	3	330.472	3.454	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@@H](NCCCF)c1ccccc1OC	ZINC001198836009	1369126906	/nfs/dbraw/zinc/12/69/06/1369126906.db2.gz	XEIFHBMRJFAFBJ-GOSISDBHSA-N	0	3	348.462	3.385	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@H](NCC(C)C)c1ccccc1OC	ZINC001198855518	1369130946	/nfs/dbraw/zinc/13/09/46/1369130946.db2.gz	CTWATRZXPDBEPH-GOSISDBHSA-N	0	3	330.472	3.292	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)[C@H]1CC12CC2)c1ccccc1OC	ZINC001198916737	1369148608	/nfs/dbraw/zinc/14/86/08/1369148608.db2.gz	SJGBXOMYKNIIRZ-SJORKVTESA-N	0	3	328.456	3.208	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@H](C)CCCOC)c1ccccc1OC	ZINC001198961330	1369159398	/nfs/dbraw/zinc/15/93/98/1369159398.db2.gz	VMJRDHJZCIZNNP-SJLPKXTDSA-N	0	3	348.487	3.081	20	30		EGEDHN
CC#CCCCC(=O)N1CCC([C@H]2CCCN(CCF)CC2)CC1	ZINC001186597095	1387979487	/nfs/dbraw/zinc/97/94/87/1387979487.db2.gz	FMLFHVKGSAHZAT-SFHVURJKSA-N	0	3	336.495	3.490	20	30		EGEDHN
CCCCCCCN1CCN(C(=O)c2ccc3cncn3c2C)CC1	ZINC001113055286	1369170089	/nfs/dbraw/zinc/17/00/89/1369170089.db2.gz	RZHURWFSAXMFKH-UHFFFAOYSA-N	0	3	342.487	3.371	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)CCOc2ccc(F)cc2)CC1	ZINC001113290103	1369322188	/nfs/dbraw/zinc/32/21/88/1369322188.db2.gz	WBAWTQHPLXZFBJ-INIZCTEOSA-N	0	3	334.435	3.094	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)C[C@H]2OCCc3ccsc32)CC1	ZINC001113559523	1369492825	/nfs/dbraw/zinc/49/28/25/1369492825.db2.gz	XLUKDFNBDKCHHC-NVXWUHKLSA-N	0	3	348.512	3.251	20	30		EGEDHN
C=CCCCC(=O)N1CCCO[C@H](CN[C@@H](C)c2ccccc2F)C1	ZINC001201284498	1369510314	/nfs/dbraw/zinc/51/03/14/1369510314.db2.gz	UZBWMPOITGZGDE-DLBZAZTESA-N	0	3	348.462	3.450	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)CCCOc2cccc(F)c2)CC1	ZINC001113649852	1369542796	/nfs/dbraw/zinc/54/27/96/1369542796.db2.gz	SRYPGHKCVAMFHD-KRWDZBQOSA-N	0	3	348.462	3.484	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)CN(CC)c2ccccc2)CC1	ZINC001113674631	1369560197	/nfs/dbraw/zinc/56/01/97/1369560197.db2.gz	CHASLAVJMWMIDK-SFHVURJKSA-N	0	3	329.488	3.012	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)CCc2c(C)noc2Cl)CC1	ZINC001113707833	1369579362	/nfs/dbraw/zinc/57/93/62/1369579362.db2.gz	CITWVXPXYOBSTF-ZDUSSCGKSA-N	0	3	339.867	3.068	20	30		EGEDHN
CC#CCNC[C@H]1CN(C(=O)C[C@H](C)CCCCCC)CCCO1	ZINC001201842475	1369632938	/nfs/dbraw/zinc/63/29/38/1369632938.db2.gz	WHLIXGKZCXSWGW-MOPGFXCFSA-N	0	3	336.520	3.213	20	30		EGEDHN
CC#CCNC[C@H]1CN(C(=O)C2CCC(C(C)(C)C)CC2)CCCO1	ZINC001201982440	1369658346	/nfs/dbraw/zinc/65/83/46/1369658346.db2.gz	GJSPXBJICJFEQN-ACBHZAAOSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC(N[C@@H](C)c2cnc(C)cn2)CC1	ZINC001202122733	1369692786	/nfs/dbraw/zinc/69/27/86/1369692786.db2.gz	GGIOMFYPAXKBIN-HOCLYGCPSA-N	0	3	330.476	3.029	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(NCc3nc(C)cs3)CC2)CCC1	ZINC001202364932	1369750894	/nfs/dbraw/zinc/75/08/94/1369750894.db2.gz	AFGJSYQGDWPRDZ-UHFFFAOYSA-N	0	3	333.501	3.279	20	30		EGEDHN
CC/C=C(\C)C(=O)N[C@@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202582108	1369812736	/nfs/dbraw/zinc/81/27/36/1369812736.db2.gz	LMOFMMNCTCAJSM-BGBRNYFRSA-N	0	3	336.479	3.411	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@H](NCc2cccc(Cl)n2)C12CCC2	ZINC001202592683	1369816983	/nfs/dbraw/zinc/81/69/83/1369816983.db2.gz	VTTKZTQGNXKIDN-GJZGRUSLSA-N	0	3	333.863	3.218	20	30		EGEDHN
CCCC[C@@H](CNc1cccc(F)c1C#N)NC(=O)CN(C)CCC	ZINC001114269860	1369840769	/nfs/dbraw/zinc/84/07/69/1369840769.db2.gz	RDGLFKWTQRGMBT-HNNXBMFYSA-N	0	3	348.466	3.126	20	30		EGEDHN
Cc1[nH]ccc1C(=O)N[C@@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202694756	1369854233	/nfs/dbraw/zinc/85/42/33/1369854233.db2.gz	JSSLHZDUYBVIER-VQTJNVASSA-N	0	3	347.462	3.005	20	30		EGEDHN
Cc1[nH]ccc1C(=O)N[C@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202694748	1369854547	/nfs/dbraw/zinc/85/45/47/1369854547.db2.gz	JSSLHZDUYBVIER-PMACEKPBSA-N	0	3	347.462	3.005	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1C[C@H](NCc2ccncc2Cl)C12CCC2	ZINC001202844868	1369906085	/nfs/dbraw/zinc/90/60/85/1369906085.db2.gz	AEGGUSBXCJINGD-DLBZAZTESA-N	0	3	345.874	3.056	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1C[C@@H](NCC=C(Cl)Cl)C12CCC2	ZINC001202846373	1369906778	/nfs/dbraw/zinc/90/67/78/1369906778.db2.gz	KALYOYKTGYQJAT-OLZOCXBDSA-N	0	3	329.271	3.126	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1C[C@H](NCc2conc2CC)C12CCC2	ZINC001202959350	1369936834	/nfs/dbraw/zinc/93/68/34/1369936834.db2.gz	CLLANLUNPWUMKT-DLBZAZTESA-N	0	3	345.487	3.356	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(CF)cc3)C[C@H]21	ZINC001114722150	1370044802	/nfs/dbraw/zinc/04/48/02/1370044802.db2.gz	CIJORPNQSGSKRQ-WQANXHIZSA-N	0	3	330.447	3.305	20	30		EGEDHN
CC#CCCCC(=O)N[C@H]1C[C@H](NCc2c(C)noc2C)C12CCC2	ZINC001203274308	1370054728	/nfs/dbraw/zinc/05/47/28/1370054728.db2.gz	MYPUSRSMHPHMLL-ROUUACIJSA-N	0	3	343.471	3.002	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1C[C@H](NCc2oc(C)nc2C)C12CCC2	ZINC001203280789	1370059587	/nfs/dbraw/zinc/05/95/87/1370059587.db2.gz	JWLTVAAJYLGCAD-ZWKOTPCHSA-N	0	3	343.471	3.002	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1[C@H]2CN(Cc3cccc(OC(C)C)c3)C[C@H]21	ZINC001114752885	1370062348	/nfs/dbraw/zinc/06/23/48/1370062348.db2.gz	MLRYYKUWYXIGTQ-KXTWHKPSSA-N	0	3	342.483	3.377	20	30		EGEDHN
CN1CCN(Cc2cccc(NC=Cc3ccc(C#N)cc3)c2)CC1	ZINC001203306880	1370074658	/nfs/dbraw/zinc/07/46/58/1370074658.db2.gz	SEKDCXPYQAOVLG-MDZDMXLPSA-N	0	3	332.451	3.388	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1[C@H]2CN(Cc3cc(C)ccc3OC)C[C@H]21	ZINC001114781512	1370077368	/nfs/dbraw/zinc/07/73/68/1370077368.db2.gz	SFZHFWQHXOMQKH-QRKMNUTDSA-N	0	3	342.483	3.152	20	30		EGEDHN
C=CCC1(C(=O)NC2[C@H]3CN(C/C=C/c4ccccc4)C[C@@H]23)CCC1	ZINC001114785619	1370079473	/nfs/dbraw/zinc/07/94/73/1370079473.db2.gz	RJCXXURLSVWUCZ-NBCHOCGGSA-N	0	3	336.479	3.493	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1C[C@@H](NCc2ccc(F)cn2)C12CCC2	ZINC001203339679	1370089065	/nfs/dbraw/zinc/08/90/65/1370089065.db2.gz	IWZBTFOHAXFNOH-IAGOWNOFSA-N	0	3	331.435	3.094	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1C[C@@H](NCC(=C)Br)C12CCC2	ZINC001203339180	1370089294	/nfs/dbraw/zinc/08/92/94/1370089294.db2.gz	FYUKZHZGBANYOS-KGLIPLIRSA-N	0	3	341.293	3.268	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2C[C@@H](NCc3conc3C)C23CCC3)CC1	ZINC001203372127	1370102726	/nfs/dbraw/zinc/10/27/26/1370102726.db2.gz	COQSQUINZQIJJE-IAGOWNOFSA-N	0	3	343.471	3.246	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CCN(Cc3ccccc3OC)C2)C1	ZINC001203425598	1370119999	/nfs/dbraw/zinc/11/99/99/1370119999.db2.gz	NTPOFTOOOBOJBN-HXUWFJFHSA-N	0	3	344.455	3.306	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@]3(CC(=O)N(c4ccc(F)cc4)C3)C2)c1	ZINC001203758444	1370252073	/nfs/dbraw/zinc/25/20/73/1370252073.db2.gz	YJTVUXUYQFIBIZ-NRFANRHFSA-N	0	3	349.409	3.326	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(C[C@H](OCC4CC4)CO3)CC2)cc1	ZINC001203903569	1370308044	/nfs/dbraw/zinc/30/80/44/1370308044.db2.gz	XIKMSGWYRKNYJK-IBGZPJMESA-N	0	3	326.440	3.108	20	30		EGEDHN
C=CCOC(=O)N1CCCC2(CCN(Cc3cccc(C)n3)CC2)C1	ZINC001204065315	1370365808	/nfs/dbraw/zinc/36/58/08/1370365808.db2.gz	DNCIUKHSCWXSIK-UHFFFAOYSA-N	0	3	343.471	3.391	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H]2CN(CCOc3cccc(CC)c3)C[C@H]21	ZINC001187200600	1388070191	/nfs/dbraw/zinc/07/01/91/1388070191.db2.gz	YGKDKZFHTIJKMU-AZUAARDMSA-N	0	3	342.483	3.127	20	30		EGEDHN
C=CCOc1ccc(CN2CCC(NC(=O)C3CCC3)CC2)cc1	ZINC001204300299	1370436726	/nfs/dbraw/zinc/43/67/26/1370436726.db2.gz	OODNTDHPEFAPEZ-UHFFFAOYSA-N	0	3	328.456	3.132	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3cn(C)c4ccccc34)C2)C1=O	ZINC001204316619	1370441776	/nfs/dbraw/zinc/44/17/76/1370441776.db2.gz	NWBITXMZEJJBHY-OAQYLSRUSA-N	0	3	337.467	3.179	20	30		EGEDHN
CC1(C)N(Cc2ccccc2C#N)CC[C@]12c1ccccc1OC2=O	ZINC001204373454	1370458112	/nfs/dbraw/zinc/45/81/12/1370458112.db2.gz	SVSZQXMDUYNMST-OAQYLSRUSA-N	0	3	332.403	3.400	20	30		EGEDHN
O=C(NCC1(NCC#Cc2ccccc2)CCCCC1)C1CC=CC1	ZINC001115461385	1370465751	/nfs/dbraw/zinc/46/57/51/1370465751.db2.gz	NJGQXAYCHWIJGG-UHFFFAOYSA-N	0	3	336.479	3.413	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3ccc(F)cc3Cl)C2)C1=O	ZINC001204436852	1370476815	/nfs/dbraw/zinc/47/68/15/1370476815.db2.gz	JBPACOGVIYYEPP-GOSISDBHSA-N	0	3	336.838	3.480	20	30		EGEDHN
C#CCCCCC(=O)NCC1(NCc2conc2C)CCCCC1	ZINC001115490825	1370494513	/nfs/dbraw/zinc/49/45/13/1370494513.db2.gz	VNQYKIMVVRBQOW-UHFFFAOYSA-N	0	3	331.460	3.085	20	30		EGEDHN
C#CCCCC(=O)NCC1(NCc2ccncc2Cl)CCCCC1	ZINC001115507842	1370508121	/nfs/dbraw/zinc/50/81/21/1370508121.db2.gz	STEZVFMAFANHJP-UHFFFAOYSA-N	0	3	347.890	3.447	20	30		EGEDHN
CCc1nc(C)c(CNC2(CNC(=O)C#CC(C)C)CCCCC2)o1	ZINC001115521753	1370520912	/nfs/dbraw/zinc/52/09/12/1370520912.db2.gz	AWSQZLVJNGUOQJ-UHFFFAOYSA-N	0	3	345.487	3.114	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NCC1(NCC(=C)Cl)CCCCC1	ZINC001115541944	1370538422	/nfs/dbraw/zinc/53/84/22/1370538422.db2.gz	DTUITIZCLDRMOA-CVEARBPZSA-N	0	3	340.895	3.129	20	30		EGEDHN
CC/C=C(/C)C(=O)N1CCC(CNCc2ccccc2C#N)CC1	ZINC001204662022	1370539241	/nfs/dbraw/zinc/53/92/41/1370539241.db2.gz	JZUIFCLPKJUHPE-SOFYXZRVSA-N	0	3	325.456	3.243	20	30		EGEDHN
COc1cc(Nc2ccc(CN3CCN(C)CC3)cc2)ccc1C#N	ZINC001204751266	1370565736	/nfs/dbraw/zinc/56/57/36/1370565736.db2.gz	OWSQRXOOOBDGOR-UHFFFAOYSA-N	0	3	336.439	3.058	20	30		EGEDHN
CN1CCN(Cc2ccc(Nc3c(C#N)ccc(F)c3F)cc2)CC1	ZINC001204765738	1370571516	/nfs/dbraw/zinc/57/15/16/1370571516.db2.gz	LOFKATIAYAMIKB-UHFFFAOYSA-N	0	3	342.393	3.327	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccc(C)c(C)n2)CCCCC1	ZINC001115630684	1370624099	/nfs/dbraw/zinc/62/40/99/1370624099.db2.gz	VDJLUTXFXHIIGF-UHFFFAOYSA-N	0	3	335.879	3.473	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCC1(NCc2conc2C)CCCCC1	ZINC001115679539	1370662081	/nfs/dbraw/zinc/66/20/81/1370662081.db2.gz	HRPSTCGCJNLGNA-CABCVRRESA-N	0	3	333.476	3.350	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N(Cc1ccccc1)[C@@H]1CN(CCC)C[C@H]1O	ZINC001205175100	1370669778	/nfs/dbraw/zinc/66/97/78/1370669778.db2.gz	KQAAMSXOUILCMV-DFQSSKMNSA-N	0	3	344.499	3.073	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)C[C@@H]2CC[C@H](C)O2)CCCCC1	ZINC001115709926	1370689078	/nfs/dbraw/zinc/68/90/78/1370689078.db2.gz	WALDWGDIBWOWKD-GJZGRUSLSA-N	0	3	328.884	3.105	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)CC2CCC2)CC[C@H]1c1ccc(F)cc1	ZINC001205269752	1370701021	/nfs/dbraw/zinc/70/10/21/1370701021.db2.gz	DJVRWJCFVDXNJO-VQTJNVASSA-N	0	3	342.458	3.313	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)/C(C)=C/C)CC[C@H]1c1ccc(F)cc1	ZINC001205269741	1370701290	/nfs/dbraw/zinc/70/12/90/1370701290.db2.gz	CFUJWBJNNUSFQP-OBABYMFPSA-N	0	3	328.431	3.089	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cc(C(F)F)n[nH]2)CCCCC1	ZINC001115725003	1370705480	/nfs/dbraw/zinc/70/54/80/1370705480.db2.gz	FKYLKCCQGUYFCJ-UHFFFAOYSA-N	0	3	346.809	3.122	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](c2ccc(F)cc2)[C@H](NCC#CC)C1	ZINC001205307194	1370716137	/nfs/dbraw/zinc/71/61/37/1370716137.db2.gz	UDKALOTUWCRXFB-VQTJNVASSA-N	0	3	342.458	3.479	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cc(C(C)C)n[nH]2)CCCCC1	ZINC001115743105	1370723358	/nfs/dbraw/zinc/72/33/58/1370723358.db2.gz	IIUDRKPGLXKWIX-UHFFFAOYSA-N	0	3	338.883	3.308	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C[C@H](C)CC)C[C@H]1c1cccc(F)c1	ZINC001205404335	1370744976	/nfs/dbraw/zinc/74/49/76/1370744976.db2.gz	QCWWOBDSBWXJLQ-AYOQOUSVSA-N	0	3	330.447	3.169	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C2(CCC)CC2)C[C@H]1c1cccc(F)c1	ZINC001205434925	1370753997	/nfs/dbraw/zinc/75/39/97/1370753997.db2.gz	VQTJHWYWRFXTLW-RBUKOAKNSA-N	0	3	342.458	3.313	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)C[C@@H](C)C(C)(C)C)[C@@H]3COC[C@@H]32)CC1	ZINC001205516382	1370778098	/nfs/dbraw/zinc/77/80/98/1370778098.db2.gz	BOFHNUTYAOERJB-FGTMMUONSA-N	0	3	348.531	3.184	20	30		EGEDHN
C[NH+](C)[C@@H]1CCCC[C@@H]1/N=C\c1cc(Br)ccc1[O-]	ZINC001116024307	1370821825	/nfs/dbraw/zinc/82/18/25/1370821825.db2.gz	PWKCGVCBTBQLEP-OPABCWLPSA-N	0	3	325.250	3.446	20	30		EGEDHN
C#CCN(CC1CC1)C(=O)NC[C@@H](c1ccsc1)N(CC)CC	ZINC001116369929	1370897011	/nfs/dbraw/zinc/89/70/11/1370897011.db2.gz	IBFSMAMAJQBWCP-KRWDZBQOSA-N	0	3	333.501	3.186	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](C)c2ccc(Cl)c(F)c2)CC1	ZINC001116427019	1370908999	/nfs/dbraw/zinc/90/89/99/1370908999.db2.gz	CHQNFEKFLVAFIW-GFCCVEGCSA-N	0	3	339.842	3.490	20	30		EGEDHN
C[C@@H](NCc1cccc(OCC#N)c1)c1ccc2c(c1)CCC(=O)N2	ZINC001116467033	1370918612	/nfs/dbraw/zinc/91/86/12/1370918612.db2.gz	QFZRHGCISOFZGC-CQSZACIVSA-N	0	3	335.407	3.324	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC(CNCc2ncc(C)s2)CC1	ZINC001205988308	1370930484	/nfs/dbraw/zinc/93/04/84/1370930484.db2.gz	DSQUZQSDMWSWJV-OAHLLOKOSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC(CN[C@H](C)c2cnc(C)cn2)CC1	ZINC001205989858	1370931689	/nfs/dbraw/zinc/93/16/89/1370931689.db2.gz	XUUJGGHODJYXME-DOTOQJQBSA-N	0	3	344.503	3.277	20	30		EGEDHN
CC(C)(C)OC(=O)NCc1ccccc1CN[C@@H]1CC[C@H](C#N)C1	ZINC001116910363	1370999671	/nfs/dbraw/zinc/99/96/71/1370999671.db2.gz	FTOQOPCJIJROHF-WMLDXEAASA-N	0	3	329.444	3.493	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2csc(C#N)c2)C1	ZINC001117780750	1371082715	/nfs/dbraw/zinc/08/27/15/1371082715.db2.gz	YUPUSJUFTYJIQR-CJNGLKHVSA-N	0	3	325.437	3.185	20	30		EGEDHN
O=C1C=C2CN(Cc3cc(-c4ccc(F)cc4)on3)CCC2S1	ZINC001206831273	1371182652	/nfs/dbraw/zinc/18/26/52/1371182652.db2.gz	HBULMDFQWBOVSN-MRXNPFEDSA-N	0	3	330.384	3.255	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CN(CCOc2ccc(C)cc2)C[C@H]1C	ZINC001206886810	1371207887	/nfs/dbraw/zinc/20/78/87/1371207887.db2.gz	ISUGTFZZCGFLEF-UYAOXDASSA-N	0	3	342.483	3.004	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001207091606	1371290941	/nfs/dbraw/zinc/29/09/41/1371290941.db2.gz	RRHYZKRGEMUNBX-KRWDZBQOSA-N	0	3	332.875	3.318	20	30		EGEDHN
C=CCN(CC=C)CCN1CCN(Cc2cccc(C(F)F)c2)CC1	ZINC001207133601	1371305198	/nfs/dbraw/zinc/30/51/98/1371305198.db2.gz	YDIJOOCSBQUYAF-UHFFFAOYSA-N	0	3	349.469	3.416	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H]2CN(CCCCC(F)(F)F)C[C@H]21	ZINC001187591159	1388128907	/nfs/dbraw/zinc/12/89/07/1388128907.db2.gz	DFQLKUVCYNAZSX-JKSUJKDBSA-N	0	3	344.421	3.445	20	30		EGEDHN
O=C(/C=C/C1CC1)N1CCC[C@@H](NCC#Cc2ccccc2Cl)C1	ZINC001207742621	1371491067	/nfs/dbraw/zinc/49/10/67/1371491067.db2.gz	VZIOJUQKVXMJQP-IENJSVCTSA-N	0	3	342.870	3.238	20	30		EGEDHN
Cc1cc(C(=O)N2CCC[C@H](NCC#Cc3ccccc3)C2)oc1C	ZINC001207796048	1371506114	/nfs/dbraw/zinc/50/61/14/1371506114.db2.gz	OBDXJWWEWNTSIY-IBGZPJMESA-N	0	3	336.435	3.142	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC[C@@H]([C@H]2CCCN2Cc2cncs2)C1	ZINC001120382552	1371555606	/nfs/dbraw/zinc/55/56/06/1371555606.db2.gz	PTCHSDUFWGXROG-SJLPKXTDSA-N	0	3	345.512	3.006	20	30		EGEDHN
CC(C)(CC(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1)C1CC1	ZINC001207983304	1371559861	/nfs/dbraw/zinc/55/98/61/1371559861.db2.gz	NZXPIFNNXOYZEB-FQEVSTJZSA-N	0	3	338.495	3.445	20	30		EGEDHN
CC/C(C)=C\C(=O)N1CCC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001208002203	1371564032	/nfs/dbraw/zinc/56/40/32/1371564032.db2.gz	PUVRAELGJPDWBD-CRPZLVSXSA-N	0	3	329.419	3.134	20	30		EGEDHN
CC/C(C)=C/C(=O)N1CCC[C@@H](NCc2cc(C#N)ccc2OC)C1	ZINC001208002652	1371565145	/nfs/dbraw/zinc/56/51/45/1371565145.db2.gz	XCWIDKNWEDPQGT-SPQRHKFCSA-N	0	3	341.455	3.004	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CN(CCOc2cccc(C)c2)C[C@H]1C	ZINC001208391405	1371749906	/nfs/dbraw/zinc/74/99/06/1371749906.db2.gz	MKSSLCLIVOMVCR-NLWGTHIKSA-N	0	3	344.499	3.413	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1)C1CCC1	ZINC001208400365	1371754116	/nfs/dbraw/zinc/75/41/16/1371754116.db2.gz	KJCHGQROZADCKR-OXJNMPFZSA-N	0	3	342.458	3.194	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2CCC[C@@H](NC[C@H](F)CC)C2)cc1	ZINC001208433224	1371765375	/nfs/dbraw/zinc/76/53/75/1371765375.db2.gz	VNZHCTYXCYXDME-IAGOWNOFSA-N	0	3	334.435	3.194	20	30		EGEDHN
C=C(Br)CNC1CC2(C1)CC(NC(=O)C[C@@H](C)CC)C2	ZINC001121015275	1371835765	/nfs/dbraw/zinc/83/57/65/1371835765.db2.gz	ZNBQTWNAQHWWLS-VBTSJIPESA-N	0	3	343.309	3.348	20	30		EGEDHN
COC(=O)c1cccc2c1CCN(CCCc1ccc(C#N)cc1)C2	ZINC001208864740	1371924961	/nfs/dbraw/zinc/92/49/61/1371924961.db2.gz	RGCKWWIGVRFFIG-UHFFFAOYSA-N	0	3	334.419	3.336	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)OC(C)(C)C)CN(CCc2ccc(C#N)cc2)C1	ZINC001208927424	1371948499	/nfs/dbraw/zinc/94/84/99/1371948499.db2.gz	HSTZDQNHKDJMII-MAUKXSAKSA-N	0	3	343.471	3.336	20	30		EGEDHN
C=CCN(CCN1CCC[C@@H](OCc2ccccc2)C1)C(=O)OCC	ZINC001209022599	1371976846	/nfs/dbraw/zinc/97/68/46/1371976846.db2.gz	NOFVRQDECKHLQL-LJQANCHMSA-N	0	3	346.471	3.312	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC1CC2(CC(NCc3nccs3)C2)C1	ZINC001121522366	1371998163	/nfs/dbraw/zinc/99/81/63/1371998163.db2.gz	JYSGPWSZJQXXBO-UHFFFAOYSA-N	0	3	333.501	3.262	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC1CC2(C1)CC(N[C@H](C)c1cnccn1)C2	ZINC001121527220	1372000555	/nfs/dbraw/zinc/00/05/55/1372000555.db2.gz	CGNHJBKBJDOARM-NUVKBMONSA-N	0	3	342.487	3.157	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@H](NCc2ccc(Cl)nc2)C1	ZINC001209146478	1372013793	/nfs/dbraw/zinc/01/37/93/1372013793.db2.gz	ORHVWNIOQQIMOG-GOEBONIOSA-N	0	3	335.879	3.418	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001209147461	1372014659	/nfs/dbraw/zinc/01/46/59/1372014659.db2.gz	XEMZGIFBOCPWBL-YLJYHZDGSA-N	0	3	342.458	3.360	20	30		EGEDHN
C=CCCCN1CCC[C@]2(CC(C(=O)Nc3ccccc3)=NO2)C1	ZINC001209162162	1372020028	/nfs/dbraw/zinc/02/00/28/1372020028.db2.gz	SWOJSSIQWXKHMW-IBGZPJMESA-N	0	3	327.428	3.202	20	30		EGEDHN
CCc1cccc(CN2C[C@@H]3CCN(C(=O)C#CC(C)(C)C)[C@@H]3C2)c1	ZINC001187833388	1388174074	/nfs/dbraw/zinc/17/40/74/1388174074.db2.gz	NEIXFNYITYGPJX-VQTJNVASSA-N	0	3	338.495	3.331	20	30		EGEDHN
C=CCO[C@H]1CO[C@]2(C1)CCCN(CCc1ccc(F)c(F)c1)C2	ZINC001209243496	1372047746	/nfs/dbraw/zinc/04/77/46/1372047746.db2.gz	HRZBKTWGXWWFIL-APWZRJJASA-N	0	3	337.410	3.333	20	30		EGEDHN
CCC1(C(=O)NC2CC3(CC(NCc4ccccc4C#N)C3)C2)CC1	ZINC001121718493	1372058349	/nfs/dbraw/zinc/05/83/49/1372058349.db2.gz	SIXDHWNKADJXNJ-UHFFFAOYSA-N	0	3	337.467	3.265	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@H](NCc2cc(C)ccc2OC)C1	ZINC001209346928	1372073600	/nfs/dbraw/zinc/07/36/00/1372073600.db2.gz	XBQQUWUOOWBJPL-SFHVURJKSA-N	0	3	330.472	3.441	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC[C@H](NCc3ncccc3C)C2)CC1	ZINC001209466035	1372112855	/nfs/dbraw/zinc/11/28/55/1372112855.db2.gz	YRIOYUMTVGUBBQ-KRWDZBQOSA-N	0	3	327.472	3.217	20	30		EGEDHN
Cn1nc2ccccc2c1CN1CCC[C@@H](Oc2cccc(C#N)c2)C1	ZINC001209539063	1372131938	/nfs/dbraw/zinc/13/19/38/1372131938.db2.gz	FVKOKVKUGVXAOC-GOSISDBHSA-N	0	3	346.434	3.488	20	30		EGEDHN
Cn1nc2ccccc2c1CN1CCC[C@H](Oc2cccc(C#N)c2)C1	ZINC001209539064	1372132247	/nfs/dbraw/zinc/13/22/47/1372132247.db2.gz	FVKOKVKUGVXAOC-SFHVURJKSA-N	0	3	346.434	3.488	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc(Oc2nccc(C)n2)cc1	ZINC001121967650	1372136792	/nfs/dbraw/zinc/13/67/92/1372136792.db2.gz	KZAPKTVMVDPAKJ-INIZCTEOSA-N	0	3	326.400	3.199	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)C2(CC(C)C)CCCC2)C1	ZINC001209562641	1372138036	/nfs/dbraw/zinc/13/80/36/1372138036.db2.gz	TXKHEENUTGILOF-QZTJIDSGSA-N	0	3	336.520	3.232	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001209911299	1372229652	/nfs/dbraw/zinc/22/96/52/1372229652.db2.gz	VJAYISNYUKVQOA-LPHOPBHVSA-N	0	3	330.447	3.050	20	30		EGEDHN
C=C(C)Cn1c([C@H](C)CCC#N)nnc1N1CCN([C@@H](C)CC)CC1	ZINC001122530221	1372267949	/nfs/dbraw/zinc/26/79/49/1372267949.db2.gz	CNAXBJCLMAZFKB-SJORKVTESA-N	0	3	344.507	3.182	20	30		EGEDHN
C[C@H](Sc1ccc(F)cc1)C(=O)C(C#N)C(=O)NC1CCCCC1	ZINC001122541157	1372270480	/nfs/dbraw/zinc/27/04/80/1372270480.db2.gz	LNWBMMLZYUHCIC-LRDDRELGSA-N	0	3	348.443	3.464	20	30		EGEDHN
CN1CCC(Oc2ccc(NC3=CC(=O)CC(C)(C)C3)nc2)CC1	ZINC001210151096	1372282050	/nfs/dbraw/zinc/28/20/50/1372282050.db2.gz	XKFBWJVLMIIKME-UHFFFAOYSA-N	0	3	329.444	3.240	20	30		EGEDHN
N#CC(C(=O)c1c[nH]nc1-c1c(F)cccc1F)c1cccc(F)n1	ZINC001122721126	1372306396	/nfs/dbraw/zinc/30/63/96/1372306396.db2.gz	RCDWPFCTOVDYIM-VIFPVBQESA-N	0	3	342.280	3.379	20	30		EGEDHN
F[C@@H]1CNCCN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1	ZINC001210580964	1372384071	/nfs/dbraw/zinc/38/40/71/1372384071.db2.gz	NMJSIWPOQZHLAA-GFCCVEGCSA-N	0	3	344.274	3.468	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)Cc1cccc(C)c1Br	ZINC001123233104	1372403209	/nfs/dbraw/zinc/40/32/09/1372403209.db2.gz	FZEUPOYEXRNPKF-CYBMUJFWSA-N	0	3	346.228	3.393	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)C2(CC=C)CCCCC2)C1	ZINC001211235071	1372509005	/nfs/dbraw/zinc/50/90/05/1372509005.db2.gz	HINOYTJYFXYFSZ-QZTJIDSGSA-N	0	3	334.504	3.152	20	30		EGEDHN
C#CC[C@@H](CC)c1nnc(N2CCN(C(C)(C)C)CC2)n1CC1CC1	ZINC001123614915	1372526219	/nfs/dbraw/zinc/52/62/19/1372526219.db2.gz	QGRHRQJHQRCVTL-QGZVFWFLSA-N	0	3	343.519	3.126	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(C[C@@H]3CC(C)(C)CO3)C[C@H]2C)CCCC1	ZINC001211495328	1372568670	/nfs/dbraw/zinc/56/86/70/1372568670.db2.gz	JDFFCCAMXQNHGS-FGTMMUONSA-N	0	3	348.531	3.375	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)CC2=CCCCC2)C[C@H]1c1ccccc1	ZINC001211555356	1372579841	/nfs/dbraw/zinc/57/98/41/1372579841.db2.gz	QUHMDIZJDRXXCO-LEWJYISDSA-N	0	3	336.479	3.484	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)CC(C)(C)CC)C[C@H]1c1ccccc1	ZINC001211609490	1372590171	/nfs/dbraw/zinc/59/01/71/1372590171.db2.gz	ULJJPXDDQNCCOF-RBUKOAKNSA-N	0	3	326.484	3.420	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@@H](C)C(C)(C)C)C[C@H]1c1ccccc1	ZINC001211623909	1372592612	/nfs/dbraw/zinc/59/26/12/1372592612.db2.gz	WZRWSQKEMOHGIH-NZSAHSFTSA-N	0	3	326.484	3.276	20	30		EGEDHN
CC[C@H](c1ccccc1)N1C[C@@H](NC(=O)C#CC(C)(C)C)[C@H](OC)C1	ZINC001212248410	1372678791	/nfs/dbraw/zinc/67/87/91/1372678791.db2.gz	CRTPLPRRUDPMMF-GUDVDZBRSA-N	0	3	342.483	3.003	20	30		EGEDHN
CCN1CCN(c2ccc(Nc3ccccc3OCC#N)cc2)CC1	ZINC001212600234	1372735810	/nfs/dbraw/zinc/73/58/10/1372735810.db2.gz	KDABIYYDUGZEFB-UHFFFAOYSA-N	0	3	336.439	3.474	20	30		EGEDHN
C#CCCCCC(=O)NCCNCc1cccc(C(F)(F)F)c1	ZINC001125950993	1372898170	/nfs/dbraw/zinc/89/81/70/1372898170.db2.gz	GZMDTWNELPEBNZ-UHFFFAOYSA-N	0	3	326.362	3.105	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2ccc(C)cc2Cl)[C@H](OC)C1	ZINC001213472833	1372910587	/nfs/dbraw/zinc/91/05/87/1372910587.db2.gz	ZWMWNLQJMJJCFQ-IAGOWNOFSA-N	0	3	336.863	3.044	20	30		EGEDHN
C#CCCCC(=O)NCCNCc1ccc(Cl)c(C(F)(F)F)c1	ZINC001126344171	1372959501	/nfs/dbraw/zinc/95/95/01/1372959501.db2.gz	OPRDKJXEBWPIRB-UHFFFAOYSA-N	0	3	346.780	3.368	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H](NC(=O)c2sccc2C2CC2)[C@H](OC)C1	ZINC001213815672	1372965914	/nfs/dbraw/zinc/96/59/14/1372965914.db2.gz	JXSNQFHUOQTXKW-IAOVAPTHSA-N	0	3	348.512	3.409	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H]2CN(Cc3ccc(OC)cc3)C[C@H]21	ZINC001188081010	1388237507	/nfs/dbraw/zinc/23/75/07/1388237507.db2.gz	UGXMVDDMRKXWKC-PKOBYXMFSA-N	0	3	328.456	3.084	20	30		EGEDHN
CC(C)[C@@H](C)CC(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001214307327	1373041534	/nfs/dbraw/zinc/04/15/34/1373041534.db2.gz	AWYFSJZHIVYKPW-SQGPQFPESA-N	0	3	344.474	3.296	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2=CCCCCC2)C[C@H]1NCC#Cc1ccccc1	ZINC001214499527	1373070505	/nfs/dbraw/zinc/07/05/05/1373070505.db2.gz	LUDGQEJMOMVPJC-WIYYLYMNSA-N	0	3	336.479	3.365	20	30		EGEDHN
CCCC[C@H](C)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2)C1	ZINC001214550415	1373079126	/nfs/dbraw/zinc/07/91/26/1373079126.db2.gz	FSIRZBRBFKUYLD-NLWGTHIKSA-N	0	3	326.484	3.301	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@@H](C)[C@H](N[C@H]2CCc3c2c(F)ccc3F)C1	ZINC001214584068	1373085084	/nfs/dbraw/zinc/08/50/84/1373085084.db2.gz	MBYJWHBLJDZXSG-JEBQAFNWSA-N	0	3	346.421	3.048	20	30		EGEDHN
C=C(C)CNCc1ccncc1O[C@H]1CCN(C(=O)/C=C(\C)CC)C1	ZINC001127883859	1373195288	/nfs/dbraw/zinc/19/52/88/1373195288.db2.gz	VEVZWADICSUJDC-BXBHGGAKSA-N	0	3	343.471	3.083	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NCCNCc1ccc(C(C)C)nc1C)OCC	ZINC001128528304	1373283504	/nfs/dbraw/zinc/28/35/04/1373283504.db2.gz	LMIPPERUGUKIHB-IBGZPJMESA-N	0	3	347.503	3.091	20	30		EGEDHN
C=C[C@@H](CC(=O)N1C[C@@H](C)[C@H](NCc2cccnc2)C1)c1ccccc1	ZINC001216812075	1373346671	/nfs/dbraw/zinc/34/66/71/1373346671.db2.gz	ZSHRJCFYGRDZFF-SLYNCCJLSA-N	0	3	349.478	3.378	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)CC3CCCC3)[C@H]2C1	ZINC001217206843	1373405540	/nfs/dbraw/zinc/40/55/40/1373405540.db2.gz	SWYNPPPZDJAUML-RBUKOAKNSA-N	0	3	336.520	3.449	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)c3cccc(F)c3)[C@H]2C1	ZINC001217206825	1373406148	/nfs/dbraw/zinc/40/61/48/1373406148.db2.gz	SOFUGCOPXVGIGC-RBUKOAKNSA-N	0	3	348.462	3.321	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)[C@H]3CC=CCC3)[C@H]2C1	ZINC001217261064	1373412985	/nfs/dbraw/zinc/41/29/85/1373412985.db2.gz	PIRUSYZKNBBPJR-GBESFXJTSA-N	0	3	332.488	3.001	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)C/C=C/c2cccc(F)c2)c1	ZINC001129731928	1373417893	/nfs/dbraw/zinc/41/78/93/1373417893.db2.gz	PQGDXJLMXCWMMK-HWKANZROSA-N	0	3	337.398	3.007	20	30		EGEDHN
CC(C)(C)c1ccccc1C(=O)NCCNCc1ccc(C#N)cc1	ZINC001130053672	1373449359	/nfs/dbraw/zinc/44/93/59/1373449359.db2.gz	BSEZVBXZBTVFLJ-UHFFFAOYSA-N	0	3	335.451	3.375	20	30		EGEDHN
CC[C@H]1CCC[C@]1(C)C(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001130258931	1373479959	/nfs/dbraw/zinc/47/99/59/1373479959.db2.gz	SKQWCQZAEBCFKC-LPHOPBHVSA-N	0	3	331.435	3.120	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cc3sccc3s2)cc1	ZINC001130284058	1373485646	/nfs/dbraw/zinc/48/56/46/1373485646.db2.gz	PDQDSENYQQITRC-UHFFFAOYSA-N	0	3	341.461	3.354	20	30		EGEDHN
C#CCCCCC(=O)N1CCO[C@@H]2CN(CCC3CCCCC3)C[C@@H]21	ZINC001217669628	1373485716	/nfs/dbraw/zinc/48/57/16/1373485716.db2.gz	MOBWYFHYMACOSH-VQTJNVASSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)[C@@](C)(CC)CCC)C1	ZINC001130438624	1373539383	/nfs/dbraw/zinc/53/93/83/1373539383.db2.gz	NARKWCYMCMITBS-KXBFYZLASA-N	0	3	332.492	3.218	20	30		EGEDHN
O=C(/C=C\c1ccccc1)c1ccc(O[C@@H]2CC[C@@H]3NCCO[C@@H]23)cc1	ZINC001218126828	1373565567	/nfs/dbraw/zinc/56/55/67/1373565567.db2.gz	IRVPCPKTKWWDIM-FDVKCPKOSA-N	0	3	349.430	3.481	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2OCCN(C(=O)c3c(C)oc(C)c3C)[C@H]2C1	ZINC001218260545	1373585469	/nfs/dbraw/zinc/58/54/69/1373585469.db2.gz	NRRDXJYPGOJBGE-DOPJRALCSA-N	0	3	346.471	3.085	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCO[C@@H]2CN(CCC3=CCCCC3)C[C@@H]21	ZINC001218523271	1373629734	/nfs/dbraw/zinc/62/97/34/1373629734.db2.gz	JERUMZSWRWPZNS-YZGWKJHDSA-N	0	3	346.515	3.391	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCO[C@@H]2CN(CCCC(C)(C)C)C[C@@H]21	ZINC001218522528	1373630265	/nfs/dbraw/zinc/63/02/65/1373630265.db2.gz	BERFUAOEYSTFBW-OKZBNKHCSA-N	0	3	336.520	3.327	20	30		EGEDHN
C=C1CCC(C(=O)N2CCO[C@@H]3CN(CCCC(C)(C)C)C[C@@H]32)CC1	ZINC001218590503	1373634829	/nfs/dbraw/zinc/63/48/29/1373634829.db2.gz	FZBSWCSQFZHRBV-RBUKOAKNSA-N	0	3	348.531	3.471	20	30		EGEDHN
Cc1ncc(C#N)cc1NC(=O)C[C@@H](N)c1ccc(C(F)(F)F)cc1	ZINC001218658836	1373641333	/nfs/dbraw/zinc/64/13/33/1373641333.db2.gz	KNVNYCWGUJVUGT-CQSZACIVSA-N	0	3	348.328	3.309	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)Nc1ccnc(OC(F)(F)F)c1	ZINC001218755530	1373651946	/nfs/dbraw/zinc/65/19/46/1373651946.db2.gz	ZLTYTIMRXWBONR-LBPRGKRZSA-N	0	3	331.338	3.383	20	30		EGEDHN
C[C@@H](C#N)c1ccc(NC(=O)[C@@](C)(N)Cc2ccc(F)cc2)cc1	ZINC001218871301	1373663847	/nfs/dbraw/zinc/66/38/47/1373663847.db2.gz	KRXQFWPFQOIRLG-DJJJIMSYSA-N	0	3	325.387	3.351	20	30		EGEDHN
N#Cc1cc(F)c(NC(=O)[C@@H](N)C2Cc3ccccc3C2)c(Cl)c1	ZINC001218996226	1373675955	/nfs/dbraw/zinc/67/59/55/1373675955.db2.gz	WHZOQZZZCFFWLF-INIZCTEOSA-N	0	3	343.789	3.032	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2OCCN(C(=O)c3ccc(Cl)cc3)[C@H]2C1	ZINC001219004449	1373678923	/nfs/dbraw/zinc/67/89/23/1373678923.db2.gz	KIRKFCLJJDIMJP-JCGIZDLHSA-N	0	3	348.874	3.220	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)CC3CCC(C)(C)CC3)[C@H]2C1	ZINC001219075488	1373686040	/nfs/dbraw/zinc/68/60/40/1373686040.db2.gz	ZIIXUKHBSOSTHH-RBUKOAKNSA-N	0	3	348.531	3.471	20	30		EGEDHN
CCCC[C@@H](CC)CC(=O)NCCNCc1ccc(OC)c(C#N)c1	ZINC001131484917	1373708549	/nfs/dbraw/zinc/70/85/49/1373708549.db2.gz	QCJZHHLCAOBPBF-MRXNPFEDSA-N	0	3	345.487	3.379	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@@H]2CCC=CCCC2)[C@@H](O)C1	ZINC001219863807	1373737286	/nfs/dbraw/zinc/73/72/86/1373737286.db2.gz	AUADUDYLTYSXOH-QRVBRYPASA-N	0	3	336.520	3.255	20	30		EGEDHN
C=CCCCCCN1CC[C@@H]2CN(C(=O)c3cc(C4CC4)no3)[C@@H]2C1	ZINC001221839808	1373796448	/nfs/dbraw/zinc/79/64/48/1373796448.db2.gz	LCZIHCQIOQSURR-SJLPKXTDSA-N	0	3	343.471	3.445	20	30		EGEDHN
CCCCCCCN1CC[C@@H]2CN(C(=O)c3cc(CC)on3)[C@@H]2C1	ZINC001221954278	1373807596	/nfs/dbraw/zinc/80/75/96/1373807596.db2.gz	HRNDEWUSDYIBOF-CRAIPNDOSA-N	0	3	333.476	3.354	20	30		EGEDHN
N#Cc1cccc(CN2CCC(CNC(=O)CC3CCCC3)CC2)c1	ZINC001222293856	1373825900	/nfs/dbraw/zinc/82/59/00/1373825900.db2.gz	QAAMAINDNCNTKJ-UHFFFAOYSA-N	0	3	339.483	3.467	20	30		EGEDHN
C#CCCCCC(=O)NCC1CCN(Cc2ccc(F)cc2)CC1	ZINC001222872943	1373905008	/nfs/dbraw/zinc/90/50/08/1373905008.db2.gz	SKXDGHMAOXOPTA-UHFFFAOYSA-N	0	3	330.447	3.348	20	30		EGEDHN
Cc1cc(C(=O)NCC2(NCc3ccc(C#N)s3)CCC2)oc1C	ZINC001326809899	1388318257	/nfs/dbraw/zinc/31/82/57/1388318257.db2.gz	OKTJLQMQXUCBED-UHFFFAOYSA-N	0	3	343.452	3.272	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@@H](C)N(CCOc2ccccc2C)C1	ZINC001131894648	1375032002	/nfs/dbraw/zinc/03/20/02/1375032002.db2.gz	AXDLRUZSEDIQNG-QZTJIDSGSA-N	0	3	330.472	3.309	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@H](C)N(Cc2cccc(OC)c2C)C1	ZINC001131894916	1375032030	/nfs/dbraw/zinc/03/20/30/1375032030.db2.gz	DAAXRXDEDBSUNL-MAUKXSAKSA-N	0	3	330.472	3.439	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@H](C)N(Cc2ccc(OC)c(C)c2)C1	ZINC001131894656	1375032145	/nfs/dbraw/zinc/03/21/45/1375032145.db2.gz	BALRJZMLWXJTCY-FUHWJXTLSA-N	0	3	330.472	3.439	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@@H](C)N(CCOCc2ccccc2)C1	ZINC001131896544	1375032590	/nfs/dbraw/zinc/03/25/90/1375032590.db2.gz	TVGVXYRZXNTINV-IEBWSBKVSA-N	0	3	330.472	3.139	20	30		EGEDHN
CC#CCCCC(=O)NCC1CCN(Cc2cccc(C#N)c2)CC1	ZINC001224158716	1375058292	/nfs/dbraw/zinc/05/82/92/1375058292.db2.gz	YZTDKXDGTUPEPC-UHFFFAOYSA-N	0	3	337.467	3.080	20	30		EGEDHN
Cc1ccoc1C(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1	ZINC001224780823	1375076286	/nfs/dbraw/zinc/07/62/86/1375076286.db2.gz	QNTVGBPWYIFTQL-RTBURBONSA-N	0	3	336.435	3.270	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CC[C@H](C)N(CCc2ccccc2F)C1	ZINC001132002017	1375092412	/nfs/dbraw/zinc/09/24/12/1375092412.db2.gz	GILLUQDDXSXOGJ-WMZOPIPTSA-N	0	3	330.447	3.141	20	30		EGEDHN
Cc1ccc(CCC(=O)NCCNCc2ccc(C#N)cc2)c(C)c1	ZINC001132026881	1375106315	/nfs/dbraw/zinc/10/63/15/1375106315.db2.gz	TZUMAMLRFSJIIW-UHFFFAOYSA-N	0	3	335.451	3.014	20	30		EGEDHN
Cc1ccc(CCC(=O)NCCNCc2ccc(C#N)s2)c(C)c1	ZINC001132026837	1375106370	/nfs/dbraw/zinc/10/63/70/1375106370.db2.gz	QJEZLMSQFIEIMQ-UHFFFAOYSA-N	0	3	341.480	3.075	20	30		EGEDHN
Cc1ncsc1CCN1C[C@@H](NC(=O)C#CC(C)(C)C)CC[C@@H]1C	ZINC001132037509	1375110657	/nfs/dbraw/zinc/11/06/57/1375110657.db2.gz	DBNXOVVWPUJXKA-HOCLYGCPSA-N	0	3	347.528	3.013	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCCc2csc(C)n2)CC[C@@H]1C	ZINC001132050674	1375117877	/nfs/dbraw/zinc/11/78/77/1375117877.db2.gz	QULQKMMQRHHHLI-HOCLYGCPSA-N	0	3	335.517	3.319	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1CC[C@H](C)N(CCOCC2CC2)C1	ZINC001132056663	1375121951	/nfs/dbraw/zinc/12/19/51/1375121951.db2.gz	BDXXFLCKLAUXBO-QFBILLFUSA-N	0	3	334.504	3.151	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CC[C@@H](C)N(Cc2ccc(CO)cc2)C1	ZINC001132060785	1375125961	/nfs/dbraw/zinc/12/59/61/1375125961.db2.gz	LAGLGTOLQMCYIJ-VQIMIIECSA-N	0	3	344.499	3.250	20	30		EGEDHN
C[C@@H](CC(=O)NCC1CCN(Cc2ccc(C#N)cc2)CC1)C1CC1	ZINC001225596133	1375129873	/nfs/dbraw/zinc/12/98/73/1375129873.db2.gz	AEZRNSQICHDWTI-INIZCTEOSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCOc2cc(C)cc(C)c2)CC[C@H]1C	ZINC001132097263	1375144726	/nfs/dbraw/zinc/14/47/26/1375144726.db2.gz	HRXAUGUMXCTAJH-QZTJIDSGSA-N	0	3	330.472	3.227	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)C2(CC(C)C)CCC2)CC[C@@H]1C	ZINC001132169645	1375184940	/nfs/dbraw/zinc/18/49/40/1375184940.db2.gz	RTVQVRZXBURJHX-ROUUACIJSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCc2ccc3[nH]ccc3c2)CC[C@H]1C	ZINC001132177585	1375190136	/nfs/dbraw/zinc/19/01/36/1375190136.db2.gz	BXWTWEYDSBNLIW-QAPCUYQASA-N	0	3	325.456	3.256	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2c(C)cc(F)cc2C)CC[C@H]1C	ZINC001132215561	1375214528	/nfs/dbraw/zinc/21/45/28/1375214528.db2.gz	ZSSKKGQGUPSBOY-SJLPKXTDSA-N	0	3	348.462	3.228	20	30		EGEDHN
CN(C)C1(C)CN(C(=O)c2ccc(-c3ccc(C#N)c(F)c3)cc2)C1	ZINC001188700786	1388363899	/nfs/dbraw/zinc/36/38/99/1388363899.db2.gz	NXWYFIGZLNCANP-UHFFFAOYSA-N	0	3	337.398	3.140	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1CC[C@@H](C)N(CCn2nc(C)cc2C)C1	ZINC001132218541	1375217098	/nfs/dbraw/zinc/21/70/98/1375217098.db2.gz	RMVKSEIQOZZPDT-AEFFLSMTSA-N	0	3	346.519	3.071	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1CC[C@@H](C)N(CCOCC2CCC2)C1	ZINC001132241579	1375237157	/nfs/dbraw/zinc/23/71/57/1375237157.db2.gz	VZPFQLASSVVVNU-QUCCMNQESA-N	0	3	348.531	3.356	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2CC[C@H](C)N(CCOCC(C)C)C2)CC1	ZINC001132279066	1375263135	/nfs/dbraw/zinc/26/31/35/1375263135.db2.gz	UQOWZCGXNUTPNI-ZWKOTPCHSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCCC(=O)NC1CCN(CCOc2cc(C)cc(C)c2)CC1	ZINC001226519255	1375273193	/nfs/dbraw/zinc/27/31/93/1375273193.db2.gz	SJIXKABKZPMJOH-UHFFFAOYSA-N	0	3	330.472	3.229	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2cc[nH]c2C2CCC2)CC[C@@H]1C	ZINC001132306228	1375285124	/nfs/dbraw/zinc/28/51/24/1375285124.db2.gz	TYRBITDPMVTEGG-RDJZCZTQSA-N	0	3	345.487	3.068	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)CCc2ccccc2C)CC[C@@H]1C	ZINC001132326379	1375304663	/nfs/dbraw/zinc/30/46/63/1375304663.db2.gz	DLRXSAAENGVPFD-AZUAARDMSA-N	0	3	344.499	3.099	20	30		EGEDHN
N#Cc1nc2ccc(O[C@H]3CC[C@H](N4CCOCC4)CC3)cc2s1	ZINC001226672682	1375305626	/nfs/dbraw/zinc/30/56/26/1375305626.db2.gz	VICDTVHXRSNYMA-HDJSIYSDSA-N	0	3	343.452	3.190	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2ccccc2Cl)CC[C@@H]1C	ZINC001132434380	1375378888	/nfs/dbraw/zinc/37/88/88/1375378888.db2.gz	WJBWYCHRMUJWAL-GJZGRUSLSA-N	0	3	336.863	3.125	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2c(C)cc(C)cc2C)CC[C@H]1C	ZINC001132464889	1375406998	/nfs/dbraw/zinc/40/69/98/1375406998.db2.gz	ZFSKSLXFDUVQQU-RTBURBONSA-N	0	3	344.499	3.397	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2c(C)cc(C)cc2C)CC[C@H]1C	ZINC001132464886	1375407188	/nfs/dbraw/zinc/40/71/88/1375407188.db2.gz	ZFSKSLXFDUVQQU-MOPGFXCFSA-N	0	3	344.499	3.397	20	30		EGEDHN
CC(C)(C)C#CC(=O)NC1CCN([C@H]2CCc3ccc(F)cc32)CC1	ZINC001227290299	1375416488	/nfs/dbraw/zinc/41/64/88/1375416488.db2.gz	UAANWKCHHDPHHU-IBGZPJMESA-N	0	3	342.458	3.443	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCOc2cccc(C)c2)CC[C@H]1C	ZINC001132500503	1375427054	/nfs/dbraw/zinc/42/70/54/1375427054.db2.gz	PCJNTTROUBLEKK-MSOLQXFVSA-N	0	3	330.472	3.309	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1CC[C@@H](C)N(Cc2ccc(C)cc2)C1	ZINC001132528298	1375442654	/nfs/dbraw/zinc/44/26/54/1375442654.db2.gz	BHKURXGVVJCGKQ-MJGOQNOKSA-N	0	3	330.472	3.057	20	30		EGEDHN
C#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)[C@H](C)CCC)CC1	ZINC001132554203	1375459684	/nfs/dbraw/zinc/45/96/84/1375459684.db2.gz	DAGJZLMIKFKAFZ-QUCCMNQESA-N	0	3	341.499	3.334	20	30		EGEDHN
C#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)C2(C)CCC2)CC1	ZINC001132554105	1375459823	/nfs/dbraw/zinc/45/98/23/1375459823.db2.gz	CCNWXIBLFMPMMM-IBGZPJMESA-N	0	3	339.483	3.088	20	30		EGEDHN
C#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)C2(CC)CC2)CC1	ZINC001132554010	1375460067	/nfs/dbraw/zinc/46/00/67/1375460067.db2.gz	AHSWBJRUZXPTEH-LJQANCHMSA-N	0	3	339.483	3.088	20	30		EGEDHN
C#CCN1CC[C@H](CN(Cc2scnc2C)C(=O)C(CC)CC)C1	ZINC001132558619	1375465105	/nfs/dbraw/zinc/46/51/05/1375465105.db2.gz	NKCJEAOIDLWZGA-INIZCTEOSA-N	0	3	347.528	3.171	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CCCC[C@H]1NCc1ccc(F)cn1	ZINC001227916798	1375490561	/nfs/dbraw/zinc/49/05/61/1375490561.db2.gz	JBCMBPWHWZFNSC-IAGOWNOFSA-N	0	3	333.451	3.340	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](C)[C@H](CNCc2nc(C)sc2C)C1	ZINC001132697562	1375519359	/nfs/dbraw/zinc/51/93/59/1375519359.db2.gz	RXWDXJRBSRFTSH-CZUORRHYSA-N	0	3	335.517	3.300	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](C)[C@H](CNCc2csc(CC)n2)C1	ZINC001132701548	1375523018	/nfs/dbraw/zinc/52/30/18/1375523018.db2.gz	TZELHRJRVVTIQP-HUUCEWRRSA-N	0	3	335.517	3.246	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](C)[C@H](CNCc2c(F)cccc2F)C1	ZINC001132786741	1375564848	/nfs/dbraw/zinc/56/48/48/1375564848.db2.gz	ZURTYMVJZKIVQO-JKSUJKDBSA-N	0	3	348.437	3.343	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@H](C)[C@H](CNC/C(Cl)=C/Cl)C1	ZINC001132809266	1375575254	/nfs/dbraw/zinc/57/52/54/1375575254.db2.gz	NKNZEHKAGDHJNA-PEEVIANCSA-N	0	3	331.287	3.039	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@H](C)[C@H](CNCc2c(F)cccc2F)C1	ZINC001132810582	1375576894	/nfs/dbraw/zinc/57/68/94/1375576894.db2.gz	YGLCPJAGFZJQKZ-JKSUJKDBSA-N	0	3	348.437	3.198	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](C)[C@H](CNCc2cscn2)C1	ZINC001132851583	1375601951	/nfs/dbraw/zinc/60/19/51/1375601951.db2.gz	WHVBIZKZASAZFR-NVXWUHKLSA-N	0	3	347.528	3.486	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NC1CCN(CCc2ccccc2F)CC1	ZINC001228750413	1375663198	/nfs/dbraw/zinc/66/31/98/1375663198.db2.gz	YEKSBBWBIPLPKN-HOTGVXAUSA-N	0	3	332.463	3.407	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NC1CCN(Cc2ccc3c(c2)COC3)CC1	ZINC001228750180	1375663339	/nfs/dbraw/zinc/66/33/39/1375663339.db2.gz	XAYLTBRGYXKFIZ-JKSUJKDBSA-N	0	3	342.483	3.256	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NC1CCN(Cc2cccc(N(C)C)c2)CC1	ZINC001228760351	1375667487	/nfs/dbraw/zinc/66/74/87/1375667487.db2.gz	LCNSFZKAQSNHHF-IRXDYDNUSA-N	0	3	343.515	3.291	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NC1CCN(Cc2ccccc2N(C)C)CC1	ZINC001228760583	1375668290	/nfs/dbraw/zinc/66/82/90/1375668290.db2.gz	MTTWLSMWMRJEBE-IRXDYDNUSA-N	0	3	343.515	3.291	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC1CCN(CCOc2cccc(F)c2)CC1	ZINC001228794770	1375678688	/nfs/dbraw/zinc/67/86/88/1375678688.db2.gz	LXRKVRFWMWAQKZ-INIZCTEOSA-N	0	3	348.462	3.387	20	30		EGEDHN
C=CCCCC(=O)NC1CCN(Cc2ccc(COC)cc2)CC1	ZINC001228927852	1375717874	/nfs/dbraw/zinc/71/78/74/1375717874.db2.gz	MZKQAGGJJUQWTA-UHFFFAOYSA-N	0	3	330.472	3.270	20	30		EGEDHN
C=C1CCC(C(=O)NC2CCN(CCOCC3CCC3)CC2)CC1	ZINC001228998931	1375731821	/nfs/dbraw/zinc/73/18/21/1375731821.db2.gz	MACGFOXVWVJTOP-UHFFFAOYSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC1CCN(CCOc2cccc(F)c2)CC1	ZINC001229016940	1375738964	/nfs/dbraw/zinc/73/89/64/1375738964.db2.gz	ODRUAEUIEHEHDC-HXUWFJFHSA-N	0	3	348.462	3.387	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](C)[C@@H](CNCc2ccn(CC)n2)C1	ZINC001133141327	1375802630	/nfs/dbraw/zinc/80/26/30/1375802630.db2.gz	BZWIHJHBUCUAOT-IRXDYDNUSA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)CCC1(C)CC1	ZINC001229478745	1375842449	/nfs/dbraw/zinc/84/24/49/1375842449.db2.gz	HIVKACCVAHTMOU-ZIAGYGMSSA-N	0	3	343.309	3.492	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H]2CN(C/C=C\c3ccccc3)C[C@H]21	ZINC001188903061	1388405373	/nfs/dbraw/zinc/40/53/73/1388405373.db2.gz	FNMJZQUOUKNIIE-VDXCVWLFSA-N	0	3	336.479	3.426	20	30		EGEDHN
Cc1cc(C(=O)NCCNCc2cccc(C#N)c2)ccc1Cl	ZINC001133244901	1375866368	/nfs/dbraw/zinc/86/63/68/1375866368.db2.gz	RQSBWQDSJWAYLF-UHFFFAOYSA-N	0	3	327.815	3.040	20	30		EGEDHN
Cc1cc(C(=O)NCCNCc2ccc(C#N)cc2)ccc1Cl	ZINC001133248756	1375868358	/nfs/dbraw/zinc/86/83/58/1375868358.db2.gz	MRUVWXPNCAGBQV-UHFFFAOYSA-N	0	3	327.815	3.040	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2cc(C)c(CC)s2)CC1	ZINC001230194007	1375963188	/nfs/dbraw/zinc/96/31/88/1375963188.db2.gz	GVQSHVFLZWFEQK-UHFFFAOYSA-N	0	3	336.501	3.016	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)C1CC(C)C1	ZINC001133390817	1375976202	/nfs/dbraw/zinc/97/62/02/1375976202.db2.gz	KTTMIAZOCFAMJZ-UHFFFAOYSA-N	0	3	332.875	3.328	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1cc(C)c(C)o1	ZINC001133392698	1375978295	/nfs/dbraw/zinc/97/82/95/1375978295.db2.gz	JOMXHGQQWYLVAO-UHFFFAOYSA-N	0	3	344.842	3.415	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)Cc1ccccc1	ZINC001133399433	1375983705	/nfs/dbraw/zinc/98/37/05/1375983705.db2.gz	NMUMVHHSWAUXMI-UHFFFAOYSA-N	0	3	340.854	3.134	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1cc(C)co1	ZINC001133401831	1375986960	/nfs/dbraw/zinc/98/69/60/1375986960.db2.gz	PJEHEDUFJPLHKV-UHFFFAOYSA-N	0	3	330.815	3.107	20	30		EGEDHN
C=CCCOCC(=O)NC1CCN(Cc2ccc(C(C)C)cc2)CC1	ZINC001230411330	1376022645	/nfs/dbraw/zinc/02/26/45/1376022645.db2.gz	FOSUDRKQLPXQSL-UHFFFAOYSA-N	0	3	344.499	3.483	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NC1CCN([C@H](C)c2cccc(F)c2)CC1	ZINC001230415760	1376023893	/nfs/dbraw/zinc/02/38/93/1376023893.db2.gz	YHJIUGZTKUAWNC-CABCVRRESA-N	0	3	334.435	3.058	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)c1cccs1)NCc1ccccc1C#N	ZINC001133576500	1376102016	/nfs/dbraw/zinc/10/20/16/1376102016.db2.gz	HWIHDLXJQYRUKI-KGLIPLIRSA-N	0	3	327.453	3.306	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N1CCC([C@H]2CCCN2CC(=C)Cl)CC1	ZINC001230630889	1376108860	/nfs/dbraw/zinc/10/88/60/1376108860.db2.gz	WMFBWNKEMZGWCB-NVXWUHKLSA-N	0	3	340.895	3.033	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)CSC(C)C)Cc1cccnc1	ZINC001230674808	1376123261	/nfs/dbraw/zinc/12/32/61/1376123261.db2.gz	FJYPSRZNFKDWPK-UHFFFAOYSA-N	0	3	335.517	3.108	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCCN(CC[C@@H](C)F)Cc1cccnc1	ZINC001230812100	1376155192	/nfs/dbraw/zinc/15/51/92/1376155192.db2.gz	VJTFWHHLFNJDPM-MRXNPFEDSA-N	0	3	335.467	3.350	20	30		EGEDHN
C#CCCN(CCCNC(=O)[C@H]1C[C@@]1(C)C(C)C)Cc1cccnc1	ZINC001230882322	1376176639	/nfs/dbraw/zinc/17/66/39/1376176639.db2.gz	OTRFHGZUULXFIF-CTNGQTDRSA-N	0	3	341.499	3.095	20	30		EGEDHN
C=CCOCC(=O)N[C@@H](C)C[C@H](C)NCc1cc(F)ccc1Cl	ZINC001133909045	1376260126	/nfs/dbraw/zinc/26/01/26/1376260126.db2.gz	GJESWFHDUFSDJA-STQMWFEESA-N	0	3	342.842	3.055	20	30		EGEDHN
C=CCOCC(=O)N[C@H](C)C[C@@H](C)NCc1c(F)cccc1Cl	ZINC001133908810	1376260146	/nfs/dbraw/zinc/26/01/46/1376260146.db2.gz	CGJCGJDEUALWDC-CHWSQXEVSA-N	0	3	342.842	3.055	20	30		EGEDHN
C#Cc1cccc(CN2C[C@H]3CCCN(C(=O)OC(C)(C)C)[C@H]3C2)c1	ZINC001231656278	1376295897	/nfs/dbraw/zinc/29/58/97/1376295897.db2.gz	HGLRFCDSVOIMDH-MOPGFXCFSA-N	0	3	340.467	3.499	20	30		EGEDHN
Cc1cc(C)c(C(=O)N[C@@H](C)C[C@H](C)NCc2ccccc2C#N)o1	ZINC001134041810	1376327774	/nfs/dbraw/zinc/32/77/74/1376327774.db2.gz	JHDIFMIVAZMWGT-GJZGRUSLSA-N	0	3	339.439	3.455	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H](C)C[C@H](C)NCc2ccccc2C#N)oc1C	ZINC001134089308	1376362063	/nfs/dbraw/zinc/36/20/63/1376362063.db2.gz	DGTWILREOGSIQZ-GJZGRUSLSA-N	0	3	339.439	3.455	20	30		EGEDHN
C#CCCCC(=O)N[C@@H](C)C[C@@H](C)NCc1oc(CCC)nc1C	ZINC001134201268	1376415022	/nfs/dbraw/zinc/41/50/22/1376415022.db2.gz	NCQFUUNWZNPJPR-CABCVRRESA-N	0	3	333.476	3.112	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)C1CC(C)(C)C1)NCc1ccccc1C#N	ZINC001134252853	1376437832	/nfs/dbraw/zinc/43/78/32/1376437832.db2.gz	WAEJHOFYHIRODC-CABCVRRESA-N	0	3	327.472	3.367	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)C#CC1CC1)NCc1nsc2ccccc21	ZINC001134321429	1376475669	/nfs/dbraw/zinc/47/56/69/1376475669.db2.gz	HEHNNELVKKKLTP-KGLIPLIRSA-N	0	3	341.480	3.083	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)C#CC1CC1)NCc1nsc2ccccc21	ZINC001134321428	1376475709	/nfs/dbraw/zinc/47/57/09/1376475709.db2.gz	HEHNNELVKKKLTP-KBPBESRZSA-N	0	3	341.480	3.083	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cccc(CF)n1)[C@@H]2CC	ZINC001232534256	1376477647	/nfs/dbraw/zinc/47/76/47/1376477647.db2.gz	NGQXBRQQQWWVFN-QUCCMNQESA-N	0	3	345.462	3.473	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)C#CC(C)(C)C)NCc1nc2ccccc2o1	ZINC001134329111	1376479370	/nfs/dbraw/zinc/47/93/70/1376479370.db2.gz	JRHZZMOSJSCNQH-CABCVRRESA-N	0	3	341.455	3.250	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1nc2ccccc2o1)NC(=O)C#CC(C)(C)C	ZINC001134329114	1376479476	/nfs/dbraw/zinc/47/94/76/1376479476.db2.gz	JRHZZMOSJSCNQH-LSDHHAIUSA-N	0	3	341.455	3.250	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@H](C)C[C@@H](C)NCc1ccn(CC)n1	ZINC001134447412	1376542448	/nfs/dbraw/zinc/54/24/48/1376542448.db2.gz	HUOCNZNBTYDVHQ-CHWSQXEVSA-N	0	3	340.899	3.055	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H](C)C[C@@H](C)NCc1nccn1CC	ZINC001134456801	1376547419	/nfs/dbraw/zinc/54/74/19/1376547419.db2.gz	DOBDUFYQSCYOAS-OLZOCXBDSA-N	0	3	340.899	3.055	20	30		EGEDHN
C[C@@H](CC1CCCC1)C(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001134683545	1376655784	/nfs/dbraw/zinc/65/57/84/1376655784.db2.gz	RGMXZJOZSRDARI-AWEZNQCLSA-N	0	3	331.435	3.120	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)CC1CC(F)(F)C1)NCc1ccccc1C#N	ZINC001134779522	1376716695	/nfs/dbraw/zinc/71/66/95/1376716695.db2.gz	WOIRYIOHCPLERE-KGLIPLIRSA-N	0	3	349.425	3.367	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1ccccc1C#N)NC(=O)CC1CC(F)(F)C1	ZINC001134779524	1376716916	/nfs/dbraw/zinc/71/69/16/1376716916.db2.gz	WOIRYIOHCPLERE-UONOGXRCSA-N	0	3	349.425	3.367	20	30		EGEDHN
C[C@@H](CCC(=O)NCCNCc1ccc(C#N)s1)c1ccccc1	ZINC001134806511	1376735748	/nfs/dbraw/zinc/73/57/48/1376735748.db2.gz	LPNUJCKHXJXLJC-HNNXBMFYSA-N	0	3	341.480	3.409	20	30		EGEDHN
CCCCCCCN1CC[C@@H]1CN(C)C(=O)[C@@H]1CCCc2n[nH]cc21	ZINC001234323553	1376809125	/nfs/dbraw/zinc/80/91/25/1376809125.db2.gz	QWXWNVDNSQLJCW-IAGOWNOFSA-N	0	3	346.519	3.333	20	30		EGEDHN
C=CCCCCCN1CC[C@H]1CN(C)C(=O)[C@H]1CCCc2n[nH]cc21	ZINC001234322861	1376810447	/nfs/dbraw/zinc/81/04/47/1376810447.db2.gz	LWVMPLCINKHYKH-IRXDYDNUSA-N	0	3	344.503	3.109	20	30		EGEDHN
C=CCCCCCN1CC[C@@H]1CN(C)C(=O)c1ccc2cc[nH]c2n1	ZINC001235589269	1376876859	/nfs/dbraw/zinc/87/68/59/1376876859.db2.gz	POSZKYQBYFLCCH-QGZVFWFLSA-N	0	3	340.471	3.456	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3C(=O)Nc4ccccc4[C@H]3C2)c(Cl)c1	ZINC001238083996	1376994574	/nfs/dbraw/zinc/99/45/74/1376994574.db2.gz	XWIVQZOATWRSHB-CVEARBPZSA-N	0	3	337.810	3.379	20	30		EGEDHN
CC#CCCCC(=O)N[C@H](C)C[C@@H](C)NCc1nc(C)sc1C	ZINC001135238922	1376995831	/nfs/dbraw/zinc/99/58/31/1376995831.db2.gz	SDPQCAWIWOTMCK-ZIAGYGMSSA-N	0	3	335.517	3.326	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](C)C[C@H](C)NCc2ccn(CC)n2)CC1	ZINC001135414599	1377081655	/nfs/dbraw/zinc/08/16/55/1377081655.db2.gz	BFXDIVMXJJIQTL-HOTGVXAUSA-N	0	3	332.492	3.022	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)c1ccc(Cl)[nH]1	ZINC001135420037	1377085394	/nfs/dbraw/zinc/08/53/94/1377085394.db2.gz	SKHZVMLJPRCMOJ-VHSXEESVSA-N	0	3	348.672	3.063	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1ccccc1C#N)NC(=O)C1(C(C)(F)F)CC1	ZINC001135493271	1377117228	/nfs/dbraw/zinc/11/72/28/1377117228.db2.gz	SGWPVHMNGJUVPY-UONOGXRCSA-N	0	3	349.425	3.367	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)C1(CF)CCC1)NCc1ccccc1C#N	ZINC001135502102	1377121029	/nfs/dbraw/zinc/12/10/29/1377121029.db2.gz	WUCXDUADDFOQDK-HUUCEWRRSA-N	0	3	331.435	3.071	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H](C)C[C@@H](C)NCc1ncc(Cl)n1C	ZINC001135560970	1377144820	/nfs/dbraw/zinc/14/48/20/1377144820.db2.gz	NTRWNQFZVYUDIB-OLZOCXBDSA-N	0	3	340.899	3.049	20	30		EGEDHN
CC(C)(C)c1cccc(C(=O)NCCNCc2ccc(C#N)cc2)c1	ZINC001135620262	1377165802	/nfs/dbraw/zinc/16/58/02/1377165802.db2.gz	PNGYQOSFXOZGRC-UHFFFAOYSA-N	0	3	335.451	3.375	20	30		EGEDHN
C=CCN1C(=O)CCC12CCN(Cc1[nH]nc3c1cccc3C)CC2	ZINC001137145242	1377485305	/nfs/dbraw/zinc/48/53/05/1377485305.db2.gz	XNVOLWNJEDGXMG-UHFFFAOYSA-N	0	3	338.455	3.014	20	30		EGEDHN
C#CCOc1ccc(CN2CC[C@@H](Oc3ccccc3)C2)cc1OC	ZINC001138346227	1377706277	/nfs/dbraw/zinc/70/62/77/1377706277.db2.gz	YURBQQZAOWRHII-LJQANCHMSA-N	0	3	337.419	3.361	20	30		EGEDHN
C#CCOc1ccc(CN2CCC(CC)(C(=O)OCC)CC2)cc1	ZINC001138560558	1377742111	/nfs/dbraw/zinc/74/21/11/1377742111.db2.gz	ZTHNPXCOABQTHE-UHFFFAOYSA-N	0	3	329.440	3.254	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@@H]3[C@H](CCN3C(=O)C(C)C)C2)c1[O-]	ZINC001138627242	1377756793	/nfs/dbraw/zinc/75/67/93/1377756793.db2.gz	AJZPDRDBDYJZSI-IEBWSBKVSA-N	0	3	342.483	3.200	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@@H]3[C@H](CCN3C(=O)C(C)C)C2)c1[O-]	ZINC001138627242	1377756794	/nfs/dbraw/zinc/75/67/94/1377756794.db2.gz	AJZPDRDBDYJZSI-IEBWSBKVSA-N	0	3	342.483	3.200	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@H](C(=O)N3CCCCC3)C2)c1[O-]	ZINC001138628836	1377756797	/nfs/dbraw/zinc/75/67/97/1377756797.db2.gz	GWDSYJTXJBAFPY-IBGZPJMESA-N	0	3	342.483	3.345	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@H](C(=O)N3CCCCC3)C2)c1[O-]	ZINC001138628836	1377756798	/nfs/dbraw/zinc/75/67/98/1377756798.db2.gz	GWDSYJTXJBAFPY-IBGZPJMESA-N	0	3	342.483	3.345	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CCC(NC(=O)C3CCCC3)CC2)c1[O-]	ZINC001138628642	1377756837	/nfs/dbraw/zinc/75/68/37/1377756837.db2.gz	AOLNNVOOKYTKBE-UHFFFAOYSA-N	0	3	342.483	3.392	20	30		EGEDHN
C=CCc1cccc(CN2CCc3ccc(C(=O)OC)cc3C2)c1O	ZINC001138627555	1377756848	/nfs/dbraw/zinc/75/68/48/1377756848.db2.gz	ADAJKLDGVUWQON-UHFFFAOYSA-N	0	3	337.419	3.466	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@@H](Oc3nccc(C)n3)C2)c1[O-]	ZINC001138631719	1377757627	/nfs/dbraw/zinc/75/76/27/1377757627.db2.gz	ZTVVHVSSKRMKNE-GOSISDBHSA-N	0	3	339.439	3.263	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@@H](Oc3nccc(C)n3)C2)c1[O-]	ZINC001138631719	1377757633	/nfs/dbraw/zinc/75/76/33/1377757633.db2.gz	ZTVVHVSSKRMKNE-GOSISDBHSA-N	0	3	339.439	3.263	20	30		EGEDHN
C=C(C)COc1ccccc1CN1CCC2(CC(=O)N(CC)C2)CC1	ZINC001138666571	1377765186	/nfs/dbraw/zinc/76/51/86/1377765186.db2.gz	XTSNMPJEFNQPMH-UHFFFAOYSA-N	0	3	342.483	3.476	20	30		EGEDHN
N#Cc1ccc(Oc2ccc(CN3CC[C@H]4OCC[C@@H]4C3)cn2)cc1	ZINC001139427686	1377882361	/nfs/dbraw/zinc/88/23/61/1377882361.db2.gz	NQFUBEOSIAXBBC-IEBWSBKVSA-N	0	3	335.407	3.356	20	30		EGEDHN
Cc1cc(CN2CCN(c3ccc(C#N)cc3)CC2)ccc1N(C)C	ZINC001139670959	1377930887	/nfs/dbraw/zinc/93/08/87/1377930887.db2.gz	IFSISBIYZJBMMV-UHFFFAOYSA-N	0	3	334.467	3.255	20	30		EGEDHN
COc1cccc(O[C@H]2CCN(Cc3c[nH]c4c3cccc4C#N)C2)n1	ZINC001139706664	1377938202	/nfs/dbraw/zinc/93/82/02/1377938202.db2.gz	DLCCGRKSCPQFKS-INIZCTEOSA-N	0	3	348.406	3.096	20	30		EGEDHN
C=CCO[C@@H]1CO[C@]2(C1)CCCN(Cc1ccc(C)c(OC)c1)C2	ZINC001140157981	1378022895	/nfs/dbraw/zinc/02/28/95/1378022895.db2.gz	ANUSHJVBGVCASG-ICSRJNTNSA-N	0	3	331.456	3.330	20	30		EGEDHN
N#CCCCN1CC[C@@]2(CCN(Cc3cccc(F)c3Cl)C2)C1=O	ZINC001272608403	1378075909	/nfs/dbraw/zinc/07/59/09/1378075909.db2.gz	PQGXQJWZPBLVCJ-GOSISDBHSA-N	0	3	349.837	3.207	20	30		EGEDHN
Cn1cnc2cc(CN3CCC[C@H](Oc4ccccc4C#N)C3)ccc21	ZINC001140508526	1378075960	/nfs/dbraw/zinc/07/59/60/1378075960.db2.gz	CUSFMZRKGKDAAC-SFHVURJKSA-N	0	3	346.434	3.488	20	30		EGEDHN
CCCN(CCN1CCCCC1)C(=O)[C@H](CC#N)c1ccccc1	ZINC001140514934	1378076869	/nfs/dbraw/zinc/07/68/69/1378076869.db2.gz	SQWRDSYQXSLGDE-LJQANCHMSA-N	0	3	327.472	3.408	20	30		EGEDHN
Cc1cc(CN2CCC3(CCN(CCCC#N)C3=O)CC2)ccc1F	ZINC001272686449	1378078969	/nfs/dbraw/zinc/07/89/69/1378078969.db2.gz	KLTKGKXEWMVZJH-UHFFFAOYSA-N	0	3	343.446	3.252	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@]23CCN(CCCC)C3=O)c1[O-]	ZINC001273360190	1378098930	/nfs/dbraw/zinc/09/89/30/1378098930.db2.gz	HZBGVVWZSOZMAN-OAQYLSRUSA-N	0	3	342.483	3.488	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@]23CCN(CCCC)C3=O)c1[O-]	ZINC001273360190	1378098932	/nfs/dbraw/zinc/09/89/32/1378098932.db2.gz	HZBGVVWZSOZMAN-OAQYLSRUSA-N	0	3	342.483	3.488	20	30		EGEDHN
C=C(C)CN1C[C@@]2(CCN(Cc3ccc(CCC)cc3)C2)OCC1=O	ZINC001273363814	1378099928	/nfs/dbraw/zinc/09/99/28/1378099928.db2.gz	PRRRVSNKNJIRRV-NRFANRHFSA-N	0	3	342.483	3.019	20	30		EGEDHN
N#CCCCN1CC[C@@]2(CCCN2Cc2cccc3cccnc32)C1=O	ZINC001275532664	1378141288	/nfs/dbraw/zinc/14/12/88/1378141288.db2.gz	PUEVJMZIVSFNLQ-NRFANRHFSA-N	0	3	348.450	3.105	20	30		EGEDHN
Cc1ccc(C#N)c(NC(=O)[C@H]2CC23CN(CCc2ccccc2)C3)c1	ZINC001280261211	1378337840	/nfs/dbraw/zinc/33/78/40/1378337840.db2.gz	VDCSNAYRMBIFCR-LJQANCHMSA-N	0	3	345.446	3.370	20	30		EGEDHN
N#Cc1cccc(O[C@@H]2CCCN(Cc3cccn4ccnc34)C2)c1	ZINC001142962281	1378518097	/nfs/dbraw/zinc/51/80/97/1378518097.db2.gz	WJUDYLZDHLPSDK-LJQANCHMSA-N	0	3	332.407	3.249	20	30		EGEDHN
O=C1C=C2CN(Cc3ccc(OC(F)(F)F)cc3F)CCC2S1	ZINC001143788286	1378646047	/nfs/dbraw/zinc/64/60/47/1378646047.db2.gz	BDYXQASCRRGDNC-ZDUSSCGKSA-N	0	3	347.333	3.498	20	30		EGEDHN
CCOc1ccc(F)c(CN2CCC3SC(=O)C=C3C2)c1F	ZINC001143934822	1378662300	/nfs/dbraw/zinc/66/23/00/1378662300.db2.gz	OHAMJHDFZWUQEE-CQSZACIVSA-N	0	3	325.380	3.138	20	30		EGEDHN
C#Cc1ccc(CN2CCC3(CC2)C(=O)N(C)[C@H]3c2ccccc2)cc1	ZINC001144572022	1378747108	/nfs/dbraw/zinc/74/71/08/1378747108.db2.gz	NBHHPUNOIGAFPN-NRFANRHFSA-N	0	3	344.458	3.463	20	30		EGEDHN
C#Cc1ccc(CN2C[C@H](C)C[C@@H](NC(=O)OC(C)(C)C)C2)cc1	ZINC001144578809	1378747541	/nfs/dbraw/zinc/74/75/41/1378747541.db2.gz	QLKVOIQYMWWZPA-CRAIPNDOSA-N	0	3	328.456	3.403	20	30		EGEDHN
Cc1oc(C(C)C)cc1C(=O)NCCNCc1ccc(C#N)s1	ZINC001146339655	1378821096	/nfs/dbraw/zinc/82/10/96/1378821096.db2.gz	YLZYUTIZXKARNM-UHFFFAOYSA-N	0	3	331.441	3.164	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2nccn2C)CCCCC1	ZINC001146506257	1378855895	/nfs/dbraw/zinc/85/58/95/1378855895.db2.gz	YZDSIDIFMTYUPT-SJORKVTESA-N	0	3	346.519	3.320	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)c1ccc(F)s1	ZINC001146712447	1378905464	/nfs/dbraw/zinc/90/54/64/1378905464.db2.gz	BMDWMNOMZZUVPB-UWVGGRQHSA-N	0	3	349.269	3.282	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2cc(C)no2)CCCC1	ZINC001146830964	1378931675	/nfs/dbraw/zinc/93/16/75/1378931675.db2.gz	PHBOBKMJJOEZGN-HUUCEWRRSA-N	0	3	333.476	3.492	20	30		EGEDHN
Cc1cc(C(=O)N(C)[C@@H](CNCc2ccc(C#N)s2)C2CC2)co1	ZINC001283493602	1378985851	/nfs/dbraw/zinc/98/58/51/1378985851.db2.gz	LLWMAAFFIYGBSL-KRWDZBQOSA-N	0	3	343.452	3.162	20	30		EGEDHN
CC(C)C#CC(=O)N1CC2(C1)CCN([C@@H](C)c1cccc(F)c1)C2	ZINC001147483512	1379031450	/nfs/dbraw/zinc/03/14/50/1379031450.db2.gz	QSSIKHJMFREDFW-INIZCTEOSA-N	0	3	328.431	3.080	20	30		EGEDHN
Cc1ccc([C@H](C)C(=O)NCCNCc2ccc(F)c(C#N)c2)s1	ZINC001147778730	1379077319	/nfs/dbraw/zinc/07/73/19/1379077319.db2.gz	RHKJVNPISUFGAJ-ZDUSSCGKSA-N	0	3	345.443	3.077	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cccc(C3CCC3)c2)cc1	ZINC001147833783	1379087645	/nfs/dbraw/zinc/08/76/45/1379087645.db2.gz	BSAWDJWMFHNKLP-UHFFFAOYSA-N	0	3	333.435	3.345	20	30		EGEDHN
CC#CCCCC(=O)N1CC2(C1)CCN(Cc1csc(C)c1)C2	ZINC001148111362	1379120594	/nfs/dbraw/zinc/12/05/94/1379120594.db2.gz	WJPABQXCCUGFKO-UHFFFAOYSA-N	0	3	330.497	3.284	20	30		EGEDHN
CC#CCCCC(=O)N1CC2(C1)CCN(CCc1ccccc1F)C2	ZINC001148111218	1379120606	/nfs/dbraw/zinc/12/06/06/1379120606.db2.gz	RKIMFWQTPUSIBQ-UHFFFAOYSA-N	0	3	342.458	3.096	20	30		EGEDHN
C[C@@H](CN(C)C(=O)C1(F)CCCCC1)NCc1ccc(C#N)s1	ZINC001283691730	1379120926	/nfs/dbraw/zinc/12/09/26/1379120926.db2.gz	DRVJXTICPKIEFY-ZDUSSCGKSA-N	0	3	337.464	3.229	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)CCCCc3ccc(F)cc3)C2)C1	ZINC001148342556	1379154301	/nfs/dbraw/zinc/15/43/01/1379154301.db2.gz	JYUMKVXOPGJICW-UHFFFAOYSA-N	0	3	342.458	3.096	20	30		EGEDHN
CCCCCCCCC(=O)NCCNCc1cccc(C(=O)NC)c1	ZINC001148721626	1379252041	/nfs/dbraw/zinc/25/20/41/1379252041.db2.gz	HULHSKYADRMOSS-UHFFFAOYSA-N	0	3	347.503	3.003	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc(OCCCC)cc3)C2)C1	ZINC001148733887	1379256309	/nfs/dbraw/zinc/25/63/09/1379256309.db2.gz	OWACTZSVMVLSNK-UHFFFAOYSA-N	0	3	340.467	3.037	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2ccccc2C(F)(F)F)c1	ZINC001148752044	1379260425	/nfs/dbraw/zinc/26/04/25/1379260425.db2.gz	YYPNMSHLOWMLMU-UHFFFAOYSA-N	0	3	347.340	3.097	20	30		EGEDHN
CCCCCCCCCC(=O)NCCNCC(=O)N[C@H](C)CCC	ZINC001148826682	1379278132	/nfs/dbraw/zinc/27/81/32/1379278132.db2.gz	SFMFOBIACVIQQG-QGZVFWFLSA-N	0	3	341.540	3.138	20	30		EGEDHN
C=CCCC(=O)NC[C@@H]1CN(Cc2ccccc2C2CC2)CCCO1	ZINC001149361691	1379368962	/nfs/dbraw/zinc/36/89/62/1379368962.db2.gz	JUCYUCMJBJWQPH-LJQANCHMSA-N	0	3	342.483	3.237	20	30		EGEDHN
C=CCCC(=O)NC[C@H]1CN(Cc2ccccc2C2CC2)CCCO1	ZINC001149361690	1379369138	/nfs/dbraw/zinc/36/91/38/1379369138.db2.gz	JUCYUCMJBJWQPH-IBGZPJMESA-N	0	3	342.483	3.237	20	30		EGEDHN
C=CCCC(=O)NC[C@@H]1CN([C@@H](C)c2cccc(C)c2)CCCO1	ZINC001149376124	1379372735	/nfs/dbraw/zinc/37/27/35/1379372735.db2.gz	VPOXHGYKNVUZDH-PKOBYXMFSA-N	0	3	330.472	3.229	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cccc3ccccc32)cc1F	ZINC001149711924	1379434908	/nfs/dbraw/zinc/43/49/08/1379434908.db2.gz	ODAOUUQCINUZOU-UHFFFAOYSA-N	0	3	347.393	3.370	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@@H]1CN(Cc2ccc(C)cc2)CCCO1	ZINC001149780050	1379444129	/nfs/dbraw/zinc/44/41/29/1379444129.db2.gz	CKLYAFGGNGCFAW-LJQANCHMSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@H]1CN(CC2=CCCCC2)CCCO1	ZINC001149780401	1379445148	/nfs/dbraw/zinc/44/51/48/1379445148.db2.gz	GBTFDJRHKQFZRS-SFHVURJKSA-N	0	3	334.504	3.296	20	30		EGEDHN
COc1ccc(CNCCNC(=O)CCC2CCCCC2)cc1C#N	ZINC001149786408	1379446026	/nfs/dbraw/zinc/44/60/26/1379446026.db2.gz	UGYAQJNJITYGHT-UHFFFAOYSA-N	0	3	343.471	3.133	20	30		EGEDHN
C[C@H](CC(=O)NCCNCc1ccc(C#N)s1)c1ccccc1	ZINC001149980873	1379477779	/nfs/dbraw/zinc/47/77/79/1379477779.db2.gz	YYUBQGJQVVKZGA-CQSZACIVSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H]1CN(Cc2cccc(CC)c2)CCCO1	ZINC001150085962	1379493048	/nfs/dbraw/zinc/49/30/48/1379493048.db2.gz	WDGJBTAXPFBZLC-LJQANCHMSA-N	0	3	344.499	3.168	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)CCCc2ccc(C)cc2)C1	ZINC001150201801	1379514224	/nfs/dbraw/zinc/51/42/24/1379514224.db2.gz	CDJREZOCFCMGCA-FQEVSTJZSA-N	0	3	344.499	3.101	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@H]2CN(Cc3ccccc3C)CCCO2)C1	ZINC001150283255	1379528786	/nfs/dbraw/zinc/52/87/86/1379528786.db2.gz	SLBAJFRNSMBXBP-LJQANCHMSA-N	0	3	342.483	3.058	20	30		EGEDHN
C#CCCN1CCCO[C@@H](CNC(=O)[C@H](CC)CC2CCCCC2)C1	ZINC001150404221	1379549923	/nfs/dbraw/zinc/54/99/23/1379549923.db2.gz	WDIUKMOCSIAIIZ-UXHICEINSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)C[C@@H]2CCCC(C)(C)C2)C1	ZINC001150590112	1379574768	/nfs/dbraw/zinc/57/47/68/1379574768.db2.gz	YVJIFFANIUGDCY-ROUUACIJSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)[C@@H](CCC)c2ccccc2)C1	ZINC001150686226	1379595452	/nfs/dbraw/zinc/59/54/52/1379595452.db2.gz	XVRLBSYWKSXRTM-UXHICEINSA-N	0	3	344.499	3.354	20	30		EGEDHN
C=C[C@H](CC(=O)NC[C@H]1CN(CC(=C)C)CCCO1)c1ccccc1	ZINC001150770377	1379611379	/nfs/dbraw/zinc/61/13/79/1379611379.db2.gz	FHHIYPGTDFYRNJ-QUCCMNQESA-N	0	3	342.483	3.130	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)C(C)(C)c2ccccc2C)C1	ZINC001150830101	1379620119	/nfs/dbraw/zinc/62/01/19/1379620119.db2.gz	CNRJUUHIZSMYOL-SFHVURJKSA-N	0	3	344.499	3.056	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@@H]2C[C@@H]3C=C[C@H]2CC3)CC1	ZINC001151138278	1379667064	/nfs/dbraw/zinc/66/70/64/1379667064.db2.gz	YIYYVNUCQALOGU-CEXWTWQISA-N	0	3	346.515	3.152	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)C[C@@H]2CC[C@H](C)C2)CC1	ZINC001151248162	1379687422	/nfs/dbraw/zinc/68/74/22/1379687422.db2.gz	JFVPFGMCKAXCPX-ZWKOTPCHSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2cc(C)c(C)s2)CC1	ZINC001151406073	1379712245	/nfs/dbraw/zinc/71/22/45/1379712245.db2.gz	WYGCWBRLWLZNPM-UHFFFAOYSA-N	0	3	336.501	3.152	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2cc3ccccc3o2)CC1	ZINC001151406634	1379712361	/nfs/dbraw/zinc/71/23/61/1379712361.db2.gz	SYTTUDKPUSLLLV-UHFFFAOYSA-N	0	3	342.439	3.220	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)C(=O)NCCNCc1cnccc1C	ZINC001151923238	1379816118	/nfs/dbraw/zinc/81/61/18/1379816118.db2.gz	SLLBTHQFAOCDGJ-IBGZPJMESA-N	0	3	337.467	3.031	20	30		EGEDHN
C=C[C@@H](CC(=O)NCCNCc1scnc1C)c1ccccc1	ZINC001151943070	1379821453	/nfs/dbraw/zinc/82/14/53/1379821453.db2.gz	PTKHOJALSQBEEB-HNNXBMFYSA-N	0	3	329.469	3.017	20	30		EGEDHN
C=C[C@@H](C(=O)NCCNCc1cc(F)ccc1C)c1ccccc1	ZINC001151989953	1379832000	/nfs/dbraw/zinc/83/20/00/1379832000.db2.gz	BXQMRGJHAAKYSG-LJQANCHMSA-N	0	3	326.415	3.310	20	30		EGEDHN
C=CCC1(C(=O)NCCNCc2ccc(C)nc2C)CCCCC1	ZINC001152010404	1379837712	/nfs/dbraw/zinc/83/77/12/1379837712.db2.gz	HIXLKJGZSJHMOR-UHFFFAOYSA-N	0	3	329.488	3.431	20	30		EGEDHN
C=CCC1(C(=O)NCCNCc2sc(C)nc2C)CCCCC1	ZINC001152011120	1379838728	/nfs/dbraw/zinc/83/87/28/1379838728.db2.gz	XQBMKJOFSFBVFZ-UHFFFAOYSA-N	0	3	335.517	3.492	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC[C@@H](C)N(CC)Cc1ccc(C)nc1C	ZINC001152234804	1379892086	/nfs/dbraw/zinc/89/20/86/1379892086.db2.gz	PENMXPSLSQNLLE-AEFFLSMTSA-N	0	3	347.503	3.006	20	30		EGEDHN
CCC[C@H](C)C(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)c(F)c1	ZINC001152459993	1379937240	/nfs/dbraw/zinc/93/72/40/1379937240.db2.gz	MLIQMROSNORVGI-LSDHHAIUSA-N	0	3	333.451	3.460	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)C=C1CCC1	ZINC001152706884	1379973469	/nfs/dbraw/zinc/97/34/69/1379973469.db2.gz	SWRWBVOCSNWBAZ-CQSZACIVSA-N	0	3	329.419	3.134	20	30		EGEDHN
CCN(C/C=C\c1ccccc1)[C@H](C)CNC(=O)c1c[nH]c(C#N)c1	ZINC001152854698	1379987163	/nfs/dbraw/zinc/98/71/63/1379987163.db2.gz	BDMYVNSSOBBIBB-BSDKJSHOSA-N	0	3	336.439	3.040	20	30		EGEDHN
Cc1cccc2oc(C(=O)NCCNCc3ccc(C#N)s3)cc21	ZINC001152893482	1379991344	/nfs/dbraw/zinc/99/13/44/1379991344.db2.gz	YJZBGSMUSCQQJZ-UHFFFAOYSA-N	0	3	339.420	3.194	20	30		EGEDHN
CC(C)(C)[C@H](CNCc1cc(C#N)ccc1F)NC(=O)C1(C)CC1	ZINC001284591548	1379992694	/nfs/dbraw/zinc/99/26/94/1379992694.db2.gz	UHBPBFBWBNGJFI-INIZCTEOSA-N	0	3	331.435	3.118	20	30		EGEDHN
CC1CCC(C)(C(=O)NCCNCc2ccc(F)c(C#N)c2)CC1	ZINC001152918960	1379994326	/nfs/dbraw/zinc/99/43/26/1379994326.db2.gz	WIUQQMFUJOXKQI-UHFFFAOYSA-N	0	3	331.435	3.120	20	30		EGEDHN
C#CCCCC(=O)NC[C@@H](C)N(CC)CCc1c(F)cccc1F	ZINC001153025392	1380010390	/nfs/dbraw/zinc/01/03/90/1380010390.db2.gz	URIVCZDHVLEBEN-OAHLLOKOSA-N	0	3	336.426	3.137	20	30		EGEDHN
CCN(Cc1ccc(C(C)C)nc1C)[C@H](C)CNC(=O)C#CC(C)C	ZINC001153207268	1380035623	/nfs/dbraw/zinc/03/56/23/1380035623.db2.gz	DMUDKJZCJUIMMR-QGZVFWFLSA-N	0	3	343.515	3.499	20	30		EGEDHN
CCN(Cc1ccc(F)c(Cl)c1)[C@H](C)CNC(=O)C#CC1CC1	ZINC001153232916	1380040957	/nfs/dbraw/zinc/04/09/57/1380040957.db2.gz	QBOLADXKRIXKOO-CYBMUJFWSA-N	0	3	336.838	3.219	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C[C@@H]1C[C@H]1c1ccc(OC)cc1	ZINC001153867682	1380147066	/nfs/dbraw/zinc/14/70/66/1380147066.db2.gz	CYGQOQVCCXLYRH-KPFFTGBYSA-N	0	3	342.483	3.039	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@@H]1CN(CC[C@H](C)F)CCC1(F)F	ZINC001754743497	1440683772	/nfs/dbraw/zinc/68/37/72/1440683772.db2.gz	MJYJDWXEBDSSIN-UONOGXRCSA-N	0	3	334.426	3.410	20	30		EGEDHN
CCN(CC#CCOC)[C@H](C)CNC(=O)CCC1CCCCCC1	ZINC001154355672	1380263111	/nfs/dbraw/zinc/26/31/11/1380263111.db2.gz	GGTDSMAIVIRBNX-GOSISDBHSA-N	0	3	336.520	3.213	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)CCCOc1ccccc1C	ZINC001154540222	1380301874	/nfs/dbraw/zinc/30/18/74/1380301874.db2.gz	GXAKGYFKVYCLEU-GOSISDBHSA-N	0	3	330.472	3.004	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)[C@H](F)C(C)C	ZINC001154706194	1380335710	/nfs/dbraw/zinc/33/57/10/1380335710.db2.gz	SZSSWHRIDAFBLY-CXAGYDPISA-N	0	3	337.414	3.018	20	30		EGEDHN
CCC[C@@H](OCC)C(=O)NC[C@@H](C)N(CC)Cc1cccc(C#N)c1	ZINC001154756533	1380346793	/nfs/dbraw/zinc/34/67/93/1380346793.db2.gz	BWXOVORYCOZDLP-VQIMIIECSA-N	0	3	345.487	3.090	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@H](Cc1ccccc1)C(C)C	ZINC001155210489	1380425458	/nfs/dbraw/zinc/42/54/58/1380425458.db2.gz	IIHHGFZYACZFSH-UYAOXDASSA-N	0	3	328.500	3.351	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NCCCNCc1cc(Cl)ccc1F	ZINC001155426583	1380450989	/nfs/dbraw/zinc/45/09/89/1380450989.db2.gz	GIUICXYYZOWPCR-CYBMUJFWSA-N	0	3	342.842	3.056	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)C(C1CC1)C1CC1	ZINC001156277769	1380552133	/nfs/dbraw/zinc/55/21/33/1380552133.db2.gz	ZFHLYQYUNPDEDG-OAHLLOKOSA-N	0	3	339.483	3.321	20	30		EGEDHN
CCCCCC[C@H](C)CC(=O)NC[C@@H](C)N(CC)CC#CCOC	ZINC001156310858	1380556213	/nfs/dbraw/zinc/55/62/13/1380556213.db2.gz	JXHSVNPADHYXNB-RBUKOAKNSA-N	0	3	338.536	3.459	20	30		EGEDHN
CC(C)P(CCNC(=O)c1[nH]nc2cc(C#N)ccc21)C(C)C	ZINC001156889555	1380718405	/nfs/dbraw/zinc/71/84/05/1380718405.db2.gz	DFEUZPNMDFTQEG-UHFFFAOYSA-N	0	3	330.372	3.463	20	30		EGEDHN
CCN(CC#CCOC)[C@H](C)CNC(=O)C(CC(C)C)CC(C)C	ZINC001157159381	1380791065	/nfs/dbraw/zinc/79/10/65/1380791065.db2.gz	ZMHJTXLIDYZURI-GOSISDBHSA-N	0	3	338.536	3.171	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)CCC1CCCC1	ZINC001157476949	1380931496	/nfs/dbraw/zinc/93/14/96/1380931496.db2.gz	MANJDSLUNBLIGF-LJQANCHMSA-N	0	3	336.520	3.472	20	30		EGEDHN
CC(C)C#CC(=O)NCCCNCc1ccc(Cl)cc1Cl	ZINC001157638702	1380988697	/nfs/dbraw/zinc/98/86/97/1380988697.db2.gz	KVEFOKPSYUHBOM-UHFFFAOYSA-N	0	3	327.255	3.249	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)C1CCCCCC1	ZINC001157656550	1380991290	/nfs/dbraw/zinc/99/12/90/1380991290.db2.gz	PTQLLOCOFNKKFG-LJQANCHMSA-N	0	3	336.520	3.472	20	30		EGEDHN
C#CCCCCC(=O)N1CCCC[C@@H]1CN(C)C[C@H]1CC(C)(C)CO1	ZINC001157857140	1381052176	/nfs/dbraw/zinc/05/21/76/1381052176.db2.gz	RNEAYCBLFKUTHX-RTBURBONSA-N	0	3	348.531	3.308	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)[C@H](CC)CC(F)F	ZINC001158065568	1381117765	/nfs/dbraw/zinc/11/77/65/1381117765.db2.gz	JTTDVGXNXQXDPI-HZPDHXFCSA-N	0	3	346.462	3.183	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cccc([C@@H]2CCOC2)c1	ZINC001158165383	1381146300	/nfs/dbraw/zinc/14/63/00/1381146300.db2.gz	VUORCUCFUOFFAA-WOJBJXKFSA-N	0	3	342.483	3.303	20	30		EGEDHN
C[C@H](N)c1ccn(-c2nc3cc(F)c(F)cc3c(Cl)c2C#N)n1	ZINC001158356682	1381213940	/nfs/dbraw/zinc/21/39/40/1381213940.db2.gz	YUJIHBBNFMEBGI-ZETCQYMHSA-N	0	3	333.729	3.243	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCCC[C@@H]1CN(C)CCOCC(F)F	ZINC001158370319	1381221200	/nfs/dbraw/zinc/22/12/00/1381221200.db2.gz	UUHLMUTYCRVPNL-HZPDHXFCSA-N	0	3	346.462	3.183	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)CC1CC(C)(C)C1	ZINC001158398302	1381230460	/nfs/dbraw/zinc/23/04/60/1381230460.db2.gz	UIWFUGRESQHJPO-GOSISDBHSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc(Cl)cc(OC)c1	ZINC001158639784	1381333399	/nfs/dbraw/zinc/33/33/99/1381333399.db2.gz	NHQVOZDJOPQJFZ-MRXNPFEDSA-N	0	3	336.863	3.461	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cnc2ccc(F)cc2c1	ZINC001158696905	1381357138	/nfs/dbraw/zinc/35/71/38/1381357138.db2.gz	BSQXZUZFGZBHFZ-GOSISDBHSA-N	0	3	341.430	3.486	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1ccc(F)cc1C	ZINC001158768151	1381389030	/nfs/dbraw/zinc/38/90/30/1381389030.db2.gz	LEAPSRGTPFCURR-GOSISDBHSA-N	0	3	348.462	3.263	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NCCCNCc1csc([N+](=O)[O-])c1	ZINC001158857831	1381437805	/nfs/dbraw/zinc/43/78/05/1381437805.db2.gz	VSZLMQYTVKTQPG-UHFFFAOYSA-N	0	3	345.852	3.031	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)CC(C1CC1)C1CC1	ZINC001158922855	1381465944	/nfs/dbraw/zinc/46/59/44/1381465944.db2.gz	KFABSHJFAAYITB-LJQANCHMSA-N	0	3	348.531	3.328	20	30		EGEDHN
Cc1cc(C)c(C(=O)NCC[C@H](C)NCc2cc(C#N)ccc2F)o1	ZINC001328321959	1388722277	/nfs/dbraw/zinc/72/22/77/1388722277.db2.gz	ASFAFKZTGBQUKJ-ZDUSSCGKSA-N	0	3	343.402	3.205	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1[nH]c2ccccc2c1OC	ZINC001158942451	1381474970	/nfs/dbraw/zinc/47/49/70/1381474970.db2.gz	IBCZPJKNHKKTRL-OAHLLOKOSA-N	0	3	341.455	3.289	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)COc1c(C)cc(C)cc1C	ZINC001328446761	1388747925	/nfs/dbraw/zinc/74/79/25/1388747925.db2.gz	ARCZGSBZQGEYJQ-INIZCTEOSA-N	0	3	338.879	3.228	20	30		EGEDHN
CC(C)=C(F)C(=O)NCCC1=CCN(Cc2ccc(C#N)cc2)CC1	ZINC001159774435	1381895693	/nfs/dbraw/zinc/89/56/93/1381895693.db2.gz	WLOBDCGPEWSSCJ-UHFFFAOYSA-N	0	3	341.430	3.460	20	30		EGEDHN
C#CCCCC(=O)NCCC1=CCN(CCOc2ccccc2)CC1	ZINC001159944989	1381944571	/nfs/dbraw/zinc/94/45/71/1381944571.db2.gz	FMOPGJIAUCNJQN-UHFFFAOYSA-N	0	3	340.467	3.007	20	30		EGEDHN
C=CCn1cccc1C(=O)NCCCN[C@@H](C)c1c(F)cccc1F	ZINC001159988177	1381960605	/nfs/dbraw/zinc/96/06/05/1381960605.db2.gz	RSQKGDGAXLGIME-AWEZNQCLSA-N	0	3	347.409	3.423	20	30		EGEDHN
O=C(C#CC1CC1)NCCC1=CCN(C/C=C/c2ccccc2)CC1	ZINC001160081184	1381991272	/nfs/dbraw/zinc/99/12/72/1381991272.db2.gz	IINFYHZTKWIUDW-QPJJXVBHSA-N	0	3	334.463	3.252	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCC1=CCN(CCc2ccns2)CC1	ZINC001160242553	1382046754	/nfs/dbraw/zinc/04/67/54/1382046754.db2.gz	WNUBATFVBXNMPF-UHFFFAOYSA-N	0	3	347.528	3.426	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C/C=C/c2cccc(F)c2)CC1	ZINC001160385950	1382089810	/nfs/dbraw/zinc/08/98/10/1382089810.db2.gz	DRBSJFVXTHAROS-FNORWQNLSA-N	0	3	340.442	3.391	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc3cc(C)ccc3n2)CC1	ZINC001160645763	1382159494	/nfs/dbraw/zinc/15/94/94/1382159494.db2.gz	IXHQTXUYOQCORI-UHFFFAOYSA-N	0	3	335.451	3.481	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H](C)c2c(F)cccc2F)CC1	ZINC001160699310	1382173698	/nfs/dbraw/zinc/17/36/98/1382173698.db2.gz	FTTRBNYSXCXBHE-AWEZNQCLSA-N	0	3	334.410	3.393	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)N1CCC2(Cc3ccccc3O2)CC1	ZINC001160826577	1382209955	/nfs/dbraw/zinc/20/99/55/1382209955.db2.gz	BFLCBBPNPYPLCO-SFHVURJKSA-N	0	3	342.483	3.447	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C[C@@H]2CCOc3ccccc32)CC1	ZINC001160860212	1382218328	/nfs/dbraw/zinc/21/83/28/1382218328.db2.gz	FQUJLSYQMTWTCY-SFHVURJKSA-N	0	3	340.467	3.267	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCC1=CCN(CCc2ccns2)CC1	ZINC001160888323	1382226092	/nfs/dbraw/zinc/22/60/92/1382226092.db2.gz	OAPTZOXFHVPJMZ-UHFFFAOYSA-N	0	3	333.501	3.036	20	30		EGEDHN
C=CCN1CCC[C@H]1CNc1nc(C)cc(OCc2ccccc2)n1	ZINC001160957766	1382251193	/nfs/dbraw/zinc/25/11/93/1382251193.db2.gz	SDKGQOVAIJGEND-SFHVURJKSA-N	0	3	338.455	3.426	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H](c2ccncc2)C(C)C)CC1	ZINC001161008967	1382269749	/nfs/dbraw/zinc/26/97/49/1382269749.db2.gz	YWUNVJPHDNKRIS-IBGZPJMESA-N	0	3	327.472	3.146	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H](CCC)c2ccccn2)CC1	ZINC001161013645	1382271647	/nfs/dbraw/zinc/27/16/47/1382271647.db2.gz	HEZLCRFUMLNUDL-SFHVURJKSA-N	0	3	327.472	3.290	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc3cccc(OC)c3o2)CC1	ZINC001161043456	1382281087	/nfs/dbraw/zinc/28/10/87/1382281087.db2.gz	DJLTZIKSIWFRIS-UHFFFAOYSA-N	0	3	340.423	3.379	20	30		EGEDHN
CC(F)(F)CC(=O)NCCC1=CCN(Cc2ccc(C#N)cc2)CC1	ZINC001161166509	1382322014	/nfs/dbraw/zinc/32/20/14/1382322014.db2.gz	CWYKVZVEVCRRQP-UHFFFAOYSA-N	0	3	347.409	3.242	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc(C(C)C)nc2C)CC1	ZINC001161244241	1382353743	/nfs/dbraw/zinc/35/37/43/1382353743.db2.gz	YVCSSMJZYYUQNV-UHFFFAOYSA-N	0	3	327.472	3.451	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H]2C[C@H]2c2ccccc2C)CC1	ZINC001161457564	1382415521	/nfs/dbraw/zinc/41/55/21/1382415521.db2.gz	JILNRIMYBJEIFT-LEWJYISDSA-N	0	3	336.479	3.260	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H](CC)c2c(C)noc2C)CC1	ZINC001161472360	1382417805	/nfs/dbraw/zinc/41/78/05/1382417805.db2.gz	PPHQWOYXLGYLTN-QGZVFWFLSA-N	0	3	331.460	3.109	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H]2C[C@]23CCc2ccccc23)CC1	ZINC001161616231	1382460236	/nfs/dbraw/zinc/46/02/36/1382460236.db2.gz	GSPSTBCRQXVBFS-UNMCSNQZSA-N	0	3	336.479	3.215	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cnn(CCCC)c2CC)CC1	ZINC001161674469	1382476591	/nfs/dbraw/zinc/47/65/91/1382476591.db2.gz	JMNUKEQPGYVMFA-UHFFFAOYSA-N	0	3	344.503	3.184	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)c1[nH]c2ccccc2c1Cl	ZINC001161781699	1382505103	/nfs/dbraw/zinc/50/51/03/1382505103.db2.gz	UPRXMYPUYGVVJT-UHFFFAOYSA-N	0	3	326.227	3.283	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)CCc2cc(F)ccc2F)CC1	ZINC001161938417	1382561148	/nfs/dbraw/zinc/56/11/48/1382561148.db2.gz	LNKDNWYNVJKMTF-UHFFFAOYSA-N	0	3	346.421	3.059	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2c(Cl)cccc2OC)CC1	ZINC001161938712	1382562593	/nfs/dbraw/zinc/56/25/93/1382562593.db2.gz	UQOBZIGPFLYQGU-UHFFFAOYSA-N	0	3	346.858	3.124	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C23CC(C(F)(F)F)(C2)C3)CC1	ZINC001161951983	1382567745	/nfs/dbraw/zinc/56/77/45/1382567745.db2.gz	AABRDHCHUMSAJK-UHFFFAOYSA-N	0	3	328.378	3.043	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C(C)(C)c2ccccc2OC)CC1	ZINC001162006686	1382597433	/nfs/dbraw/zinc/59/74/33/1382597433.db2.gz	HXLLVKCGKYGOGV-UHFFFAOYSA-N	0	3	342.483	3.297	20	30		EGEDHN
C=CCCC(=O)NCC1(COC)CCN(Cc2ccc(F)cc2)CC1	ZINC001162150931	1382640761	/nfs/dbraw/zinc/64/07/61/1382640761.db2.gz	IYYDLXSWDIONFW-UHFFFAOYSA-N	0	3	348.462	3.137	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@@H]2CCC[C@@H]2CCC)(COC)CC1	ZINC001162335272	1382732590	/nfs/dbraw/zinc/73/25/90/1382732590.db2.gz	HPVPEBKQXUGHAX-RBUKOAKNSA-N	0	3	348.531	3.071	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@@H]2CCCCC2(C)C)(COC)CC1	ZINC001162623306	1382814085	/nfs/dbraw/zinc/81/40/85/1382814085.db2.gz	QEJZVVASIPSPQM-SFHVURJKSA-N	0	3	348.531	3.071	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@]1(C)CCC[C@@H]1CC	ZINC001162840904	1382890965	/nfs/dbraw/zinc/89/09/65/1382890965.db2.gz	HOMKOCKBOTYOBY-RBBKRZOGSA-N	0	3	340.511	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CCC[C@H]1CC	ZINC001162918885	1382916340	/nfs/dbraw/zinc/91/63/40/1382916340.db2.gz	IGGFAMWXRCTQGJ-UXHICEINSA-N	0	3	326.484	3.107	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C(CC)(CC)CC	ZINC001162963777	1382928921	/nfs/dbraw/zinc/92/89/21/1382928921.db2.gz	NHVNWPZACLHBTJ-UHFFFAOYSA-N	0	3	328.500	3.497	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@H](C)C1CCCC1	ZINC001162982788	1382936627	/nfs/dbraw/zinc/93/66/27/1382936627.db2.gz	OVJFVPOBQUKBJJ-LJQANCHMSA-N	0	3	340.511	3.497	20	30		EGEDHN
O=C(CC1CC1)NCCC1(CNCC#Cc2cccc(Cl)c2)CC1	ZINC001163138242	1382974571	/nfs/dbraw/zinc/97/45/71/1382974571.db2.gz	NIKDYXZQPAVWBT-UHFFFAOYSA-N	0	3	344.886	3.368	20	30		EGEDHN
C[C@@H]1CCC[C@H](C)N1c1nccnc1C(C#N)C(=O)OC(C)(C)C	ZINC001163549865	1383076275	/nfs/dbraw/zinc/07/62/75/1383076275.db2.gz	GWJWWCKUVINBCG-HZSPNIEDSA-N	0	3	330.432	3.193	20	30		EGEDHN
N#CCc1cc2ccccc2nc1N[C@H]1CCCC[C@@]12CNCCO2	ZINC001163645516	1383094923	/nfs/dbraw/zinc/09/49/23/1383094923.db2.gz	XFQKQRPVRDAXEP-AZUAARDMSA-N	0	3	336.439	3.014	20	30		EGEDHN
N=C(Nc1cccc(CCC(N)=O)c1)c1ccc(C(F)(F)F)cc1	ZINC001163684180	1383105476	/nfs/dbraw/zinc/10/54/76/1383105476.db2.gz	PQCKIZKYEVINJV-UHFFFAOYSA-N	0	3	335.329	3.160	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCCN[C@H](C)c2c(F)cccc2F)cc1	ZINC001163757777	1383118546	/nfs/dbraw/zinc/11/85/46/1383118546.db2.gz	ISPBETFXGMQTTH-CQSZACIVSA-N	0	3	342.389	3.417	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCCNCc1ccn(C(CC)CC)n1	ZINC001164223917	1383167973	/nfs/dbraw/zinc/16/79/73/1383167973.db2.gz	XVHCKQOIGGVORS-HZPDHXFCSA-N	0	3	334.508	3.298	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2c(F)cccc2OC)CC1	ZINC001164623071	1383210539	/nfs/dbraw/zinc/21/05/39/1383210539.db2.gz	UPVOWSJCEYACML-UHFFFAOYSA-N	0	3	340.826	3.077	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCC1(CNCc2ccccn2)CC1	ZINC001164648859	1383213519	/nfs/dbraw/zinc/21/35/19/1383213519.db2.gz	PUVLGPGZYXDMRB-UHFFFAOYSA-N	0	3	327.472	3.226	20	30		EGEDHN
C[C@H]1CCN(Cc2ccccc2)C[C@H]1N(C)c1nccc(F)c1C#N	ZINC001165184269	1383243625	/nfs/dbraw/zinc/24/36/25/1383243625.db2.gz	VTPOLLAYMGPITO-HNAYVOBHSA-N	0	3	338.430	3.439	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCC1(CN[C@@H](C)c2cnc(C)cn2)CC1	ZINC001165220767	1383251583	/nfs/dbraw/zinc/25/15/83/1383251583.db2.gz	AYPWIPWTTCZKDG-INIZCTEOSA-N	0	3	344.503	3.324	20	30		EGEDHN
C=CCOc1ccc(NCC2CN(Cc3ccccc3)C2)nc1C#N	ZINC001165441818	1383296776	/nfs/dbraw/zinc/29/67/76/1383296776.db2.gz	DXDLROODNAAIHP-UHFFFAOYSA-N	0	3	334.423	3.062	20	30		EGEDHN
C=CCC1(C(=O)NCCCNCc2cc(O)ccc2Cl)CCC1	ZINC001165978012	1383372541	/nfs/dbraw/zinc/37/25/41/1383372541.db2.gz	MZXNBUJBEHOQFB-UHFFFAOYSA-N	0	3	336.863	3.388	20	30		EGEDHN
CC[C@@H]1CCC[C@H]1C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001166035893	1383379919	/nfs/dbraw/zinc/37/99/19/1383379919.db2.gz	HLDGYQZTRAEKCJ-NVXWUHKLSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cccc3ncccc32)CC1	ZINC001166453239	1383424145	/nfs/dbraw/zinc/42/41/45/1383424145.db2.gz	MCJWUSNHSRIJRD-UHFFFAOYSA-N	0	3	343.858	3.477	20	30		EGEDHN
C=CCCCC(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001166909901	1383498243	/nfs/dbraw/zinc/49/82/43/1383498243.db2.gz	DUJGZZCRVGHGCW-UHFFFAOYSA-N	0	3	325.456	3.291	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCC1(CNCc2c(C)noc2C)CC1	ZINC001167018461	1383519895	/nfs/dbraw/zinc/51/98/95/1383519895.db2.gz	JXSZEJRQDWKAPD-GOSISDBHSA-N	0	3	333.476	3.270	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@H]1[C@@H]2CCCCCC[C@@H]21	ZINC001167296043	1383588243	/nfs/dbraw/zinc/58/82/43/1383588243.db2.gz	KAYFDJPTBKMVCA-FICVDOATSA-N	0	3	343.309	3.207	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1cccc(F)c1Cl	ZINC001167305740	1383591296	/nfs/dbraw/zinc/59/12/96/1383591296.db2.gz	KBPHYXLTXYWVRY-UHFFFAOYSA-N	0	3	345.805	3.260	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001167366921	1383611539	/nfs/dbraw/zinc/61/15/39/1383611539.db2.gz	VOVTXUNROQBSKQ-MRXNPFEDSA-N	0	3	327.472	3.226	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)NCCC1(CNCc2cc(C#N)ccc2F)CC1	ZINC001167366706	1383611992	/nfs/dbraw/zinc/61/19/92/1383611992.db2.gz	PGCCHSMQPKEMEJ-OAHLLOKOSA-N	0	3	345.462	3.366	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)[C@H]2CC[C@@H](C)C2)CC1	ZINC001167376674	1383614985	/nfs/dbraw/zinc/61/49/85/1383614985.db2.gz	DSTYMNCVKPCJGZ-OCCSQVGLSA-N	0	3	343.309	3.207	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)NCCC2(CNCc3ccccc3C#N)CC2)C1	ZINC001167382407	1383617661	/nfs/dbraw/zinc/61/76/61/1383617661.db2.gz	UUIPZHGZQCJPBC-IRXDYDNUSA-N	0	3	339.483	3.371	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2scnc2C2CC2)CC1	ZINC001167414634	1383626908	/nfs/dbraw/zinc/62/69/08/1383626908.db2.gz	PBZMLUPSQHQLOH-UHFFFAOYSA-N	0	3	339.892	3.263	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1cc(Cl)cs1	ZINC001167641498	1383696499	/nfs/dbraw/zinc/69/64/99/1383696499.db2.gz	RPOJQFOXJXZZQQ-UHFFFAOYSA-N	0	3	333.844	3.183	20	30		EGEDHN
CC(C)c1ncsc1C(=O)NCCCNCc1ccccc1C#N	ZINC001167854698	1383760014	/nfs/dbraw/zinc/76/00/14/1383760014.db2.gz	UTUSEYYONNCCMP-UHFFFAOYSA-N	0	3	342.468	3.048	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)CC[C@@H]2CC(C)(C)CO2)CC1	ZINC001167874489	1383763217	/nfs/dbraw/zinc/76/32/17/1383763217.db2.gz	DOKJOOCVXGAXRH-OAHLLOKOSA-N	0	3	342.911	3.210	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)COc2cccc(C)c2)CC1	ZINC001168096816	1383815465	/nfs/dbraw/zinc/81/54/65/1383815465.db2.gz	RCDRMURXBBMSKO-UHFFFAOYSA-N	0	3	336.863	3.002	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)CC#Cc2ccccc2)CC1	ZINC001168276551	1383859386	/nfs/dbraw/zinc/85/93/86/1383859386.db2.gz	AAQRINOKQJZABD-UHFFFAOYSA-N	0	3	330.859	3.057	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@H](C)c1cc(C)oc1C	ZINC001168458617	1383911639	/nfs/dbraw/zinc/91/16/39/1383911639.db2.gz	UNDYUAMACSCKJJ-GFCCVEGCSA-N	0	3	343.265	3.004	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1cc(Cl)ccc1C	ZINC001168723127	1383980637	/nfs/dbraw/zinc/98/06/37/1383980637.db2.gz	DXVBTZINXOAICO-UHFFFAOYSA-N	0	3	345.668	3.267	20	30		EGEDHN
CS[C@@H](C)C(=O)N[C@H](C)CCCCNCc1ccccc1C#N	ZINC001169343978	1384138543	/nfs/dbraw/zinc/13/85/43/1384138543.db2.gz	VNVZNPPAAQMIOO-CABCVRRESA-N	0	3	333.501	3.074	20	30		EGEDHN
CCSCCC(=O)N[C@H](C)CCCCNCc1ccccc1C#N	ZINC001169440281	1384148628	/nfs/dbraw/zinc/14/86/28/1384148628.db2.gz	UHSDAGUDLXXQEQ-MRXNPFEDSA-N	0	3	347.528	3.466	20	30		EGEDHN
CCSCCC(=O)N[C@@H](C)CCCCNCc1ccccc1C#N	ZINC001169440279	1384148686	/nfs/dbraw/zinc/14/86/86/1384148686.db2.gz	UHSDAGUDLXXQEQ-INIZCTEOSA-N	0	3	347.528	3.466	20	30		EGEDHN
CCCc1nc(CNCCCC[C@H](C)NC(=O)[C@H](C)C#N)cs1	ZINC001169849061	1384191201	/nfs/dbraw/zinc/19/12/01/1384191201.db2.gz	UBMFNRXGZMBTIO-KGLIPLIRSA-N	0	3	336.505	3.020	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H](C)CCCCNCc1nc2ccccc2o1	ZINC001170639035	1384355773	/nfs/dbraw/zinc/35/57/73/1384355773.db2.gz	QWKHBFMDHXPPJT-MRXNPFEDSA-N	0	3	341.455	3.252	20	30		EGEDHN
C=CCC[C@@H](C)[NH2+]CCCC[C@H](C)NC(=O)c1cccc2n[n-]nc21	ZINC001170963734	1384419229	/nfs/dbraw/zinc/41/92/29/1384419229.db2.gz	SRKCUKJTBPTFBH-CABCVRRESA-N	0	3	343.475	3.191	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@@H](C)c1ccc(C)s1	ZINC001171115303	1384448821	/nfs/dbraw/zinc/44/88/21/1384448821.db2.gz	IVLSHBLBFVXYHM-LBPRGKRZSA-N	0	3	345.306	3.165	20	30		EGEDHN
CCCCCC[C@@H](F)C(=O)NCCCNCc1ccccc1C#N	ZINC001171146969	1384454451	/nfs/dbraw/zinc/45/44/51/1384454451.db2.gz	XVPWZJUHAKUKIV-GOSISDBHSA-N	0	3	333.451	3.463	20	30		EGEDHN
C[C@H]1Oc2ccc(NC(=N)c3ccc4cc(O)ccc4c3)cc2NC1=O	ZINC001171185367	1384463193	/nfs/dbraw/zinc/46/31/93/1384463193.db2.gz	WCLIZDXZDURSNW-LLVKDONJSA-N	0	3	347.374	3.302	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1CC(CCNC(=O)OC(C)(C)C)C1	ZINC001171222924	1384472613	/nfs/dbraw/zinc/47/26/13/1384472613.db2.gz	JNYUHLXVHOGABA-OAHLLOKOSA-N	0	3	343.471	3.336	20	30		EGEDHN
CCc1cc(C)c(C(=O)NCCCNCc2ccc(C#N)cc2F)o1	ZINC001171278820	1384483619	/nfs/dbraw/zinc/48/36/19/1384483619.db2.gz	LNLHHBDXFAFTTQ-UHFFFAOYSA-N	0	3	343.402	3.071	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1CCC[C@]1(C)Cc1ccc(F)cc1	ZINC001171307083	1384490631	/nfs/dbraw/zinc/49/06/31/1384490631.db2.gz	KPVHSVJEHILQKS-OXQOHEQNSA-N	0	3	345.462	3.231	20	30		EGEDHN
C=CCOC(=O)N[C@@H]1CCCN([C@H]2CCc3c(F)cccc3C2)C1	ZINC001171445446	1384525450	/nfs/dbraw/zinc/52/54/50/1384525450.db2.gz	LCMLAOVVPHMPQQ-CVEARBPZSA-N	0	3	332.419	3.060	20	30		EGEDHN
CC[C@@H](CC(=O)NCCCNCc1cc(C#N)ccc1F)C(C)C	ZINC001171561447	1384562678	/nfs/dbraw/zinc/56/26/78/1384562678.db2.gz	OEWOLCUBHYJENY-INIZCTEOSA-N	0	3	333.451	3.366	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1cc(CCC)on1	ZINC001316879239	1384664287	/nfs/dbraw/zinc/66/42/87/1384664287.db2.gz	JVUAFFLHWMTBGB-CZUORRHYSA-N	0	3	339.867	3.352	20	30		EGEDHN
C[C@H](CCCC#N)N1CCN(c2ccc(C(F)(F)F)cn2)CC1	ZINC001172507546	1384807679	/nfs/dbraw/zinc/80/76/79/1384807679.db2.gz	WMHATYUZEIJNMJ-CYBMUJFWSA-N	0	3	326.366	3.305	20	30		EGEDHN
COc1cccc(CN[C@H]2CCN(C(=O)OC(C)(C)C)[C@H](C#N)C2)c1	ZINC001172968726	1384892648	/nfs/dbraw/zinc/89/26/48/1384892648.db2.gz	SKKIRXBCUZEUCI-HOTGVXAUSA-N	0	3	345.443	3.076	20	30		EGEDHN
C=CCOC1CCC(N2CCN(C(=O)OC(C)(C)C)[C@H](C)C2)CC1	ZINC001173320399	1384957963	/nfs/dbraw/zinc/95/79/63/1384957963.db2.gz	HPLRSOBIYQNQMT-KLAILNCOSA-N	0	3	338.492	3.441	20	30		EGEDHN
CC(C)C[C@H]([NH2+]C1CCC2(CCc3ccccc32)CC1)C(=O)N[O-]	ZINC001173686584	1385004605	/nfs/dbraw/zinc/00/46/05/1385004605.db2.gz	SAQFMCPKIMZTEP-IPCDKGFNSA-N	0	3	330.472	3.323	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](C)CCCCNCc1cc(OC)no1	ZINC001174673496	1385132490	/nfs/dbraw/zinc/13/24/90/1385132490.db2.gz	XTENDVHHKNWDAE-AWEZNQCLSA-N	0	3	337.464	3.050	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)[C@H]1C[C@H]2C[C@H]2C1	ZINC001174840658	1385157965	/nfs/dbraw/zinc/15/79/65/1385157965.db2.gz	DTPGQGIULZWESS-XCLNPWKQSA-N	0	3	339.483	3.369	20	30		EGEDHN
C=CCCCC(=O)N[C@H](C)CCCCNCc1nnc(C)n1C1CC1	ZINC001174987912	1385179765	/nfs/dbraw/zinc/17/97/65/1385179765.db2.gz	SFRMUYJLGYQHHM-OAHLLOKOSA-N	0	3	347.507	3.042	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](C)CCCCNCc2nccn2CC)CC1	ZINC001175073117	1385189999	/nfs/dbraw/zinc/18/99/99/1385189999.db2.gz	FUDDXPWJELVWMG-QGZVFWFLSA-N	0	3	346.519	3.414	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H](C)CCCCNCc1nnc(C(C)C)[nH]1	ZINC001175082500	1385192078	/nfs/dbraw/zinc/19/20/78/1385192078.db2.gz	ORFOJBPEPDJKBA-KXBFYZLASA-N	0	3	349.523	3.295	20	30		EGEDHN
C[C@@H](CCCCNCc1cc(F)ccc1C#N)NC(=O)[C@@H]1CC12CC2	ZINC001175442304	1385290687	/nfs/dbraw/zinc/29/06/87/1385290687.db2.gz	KJAGSRTVHAUTPF-KSSFIOAISA-N	0	3	343.446	3.262	20	30		EGEDHN
CCN1CCN(c2ccc(Nc3ccc(C#N)c(C#N)c3)cc2)CC1	ZINC001175781087	1385402666	/nfs/dbraw/zinc/40/26/66/1385402666.db2.gz	BMLRNNHDJWKVGB-UHFFFAOYSA-N	0	3	331.423	3.315	20	30		EGEDHN
C=C[C@H](CC(=O)NCCCNCc1c(C)noc1C)c1ccccc1	ZINC001176762494	1385687452	/nfs/dbraw/zinc/68/74/52/1385687452.db2.gz	DFJVLLCKPUUNPI-QGZVFWFLSA-N	0	3	341.455	3.247	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N[C@H](C)CCCCNC/C(Cl)=C/Cl	ZINC001176802030	1385706147	/nfs/dbraw/zinc/70/61/47/1385706147.db2.gz	WPTTYWSHDLOFKP-OFLZDLGMSA-N	0	3	337.291	3.161	20	30		EGEDHN
C=C(Br)CNCC1(NC(=O)CSC(C)C)CCCC1	ZINC001318617514	1385799236	/nfs/dbraw/zinc/79/92/36/1385799236.db2.gz	RMMPADFZLMAGBN-UHFFFAOYSA-N	0	3	349.338	3.055	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2ccn3cc(C)nc3c2)CCCC1	ZINC001318655108	1385818591	/nfs/dbraw/zinc/81/85/91/1385818591.db2.gz	VJKUQCFZDFJTRH-UHFFFAOYSA-N	0	3	346.862	3.027	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2ccsn2)CCCC[C@@H]1C	ZINC001318743322	1385850265	/nfs/dbraw/zinc/85/02/65/1385850265.db2.gz	HNOIOQLUZWXYHV-XHDPSFHLSA-N	0	3	327.881	3.164	20	30		EGEDHN
Cc1ccc(C(=O)N2CCC[C@@H]2CNCC#Cc2ccccc2)s1	ZINC001319049165	1385945853	/nfs/dbraw/zinc/94/58/53/1385945853.db2.gz	PQEWSQVGCXUJKJ-GOSISDBHSA-N	0	3	338.476	3.302	20	30		EGEDHN
C=CCC[C@@H](C(=O)NCCCNCc1cnc(C)o1)c1ccccc1	ZINC001177552909	1385994906	/nfs/dbraw/zinc/99/49/06/1385994906.db2.gz	RHUFGYVDXDJPFM-LJQANCHMSA-N	0	3	341.455	3.329	20	30		EGEDHN
N#Cc1ccc(F)cc1CNCCCCCCNC(=O)CC1CC1	ZINC001177742226	1386031773	/nfs/dbraw/zinc/03/17/73/1386031773.db2.gz	FWHHNGCCNGSHLH-UHFFFAOYSA-N	0	3	331.435	3.264	20	30		EGEDHN
CC(C)SCC(=O)NCCCCCCNCc1ccccc1C#N	ZINC001177906871	1386079294	/nfs/dbraw/zinc/07/92/94/1386079294.db2.gz	NMXGITOGHQSQDB-UHFFFAOYSA-N	0	3	347.528	3.466	20	30		EGEDHN
CC(C)OCCC(=O)NCCCCCCNCc1ccccc1C#N	ZINC001177916091	1386083889	/nfs/dbraw/zinc/08/38/89/1386083889.db2.gz	ZCNQKSOLRRHOQG-UHFFFAOYSA-N	0	3	345.487	3.140	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccc3c(c2)CCO3)CCCC1	ZINC001319377710	1386091536	/nfs/dbraw/zinc/09/15/36/1386091536.db2.gz	PNOYFMACDXQZFD-UHFFFAOYSA-N	0	3	334.847	3.006	20	30		EGEDHN
Cc1cccc(C(=O)N(C)[C@@H](C)CNCc2ccc(F)c(C#N)c2)c1	ZINC001319416971	1386111983	/nfs/dbraw/zinc/11/19/83/1386111983.db2.gz	BXUOJNASAFPSHQ-HNNXBMFYSA-N	0	3	339.414	3.256	20	30		EGEDHN
CCC(CC)n1ccc(CNCCCCCCNC(=O)[C@H](C)C#N)n1	ZINC001178053963	1386118079	/nfs/dbraw/zinc/11/80/79/1386118079.db2.gz	XVKRBSHNVMWROV-MRXNPFEDSA-N	0	3	347.507	3.170	20	30		EGEDHN
CC/C=C(\C)C(=O)N1CC[C@H](NCc2cc(C#N)ccc2OC)[C@@H]1C	ZINC001178245458	1386170824	/nfs/dbraw/zinc/17/08/24/1386170824.db2.gz	IZMYYUGNNFCJBX-BFVFONADSA-N	0	3	341.455	3.002	20	30		EGEDHN
C[C@@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)C1(F)CCCCC1	ZINC001319558490	1386177752	/nfs/dbraw/zinc/17/77/52/1386177752.db2.gz	NSPLKBKVSHBXBN-AWEZNQCLSA-N	0	3	349.425	3.306	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](NCc2cc(Cl)cc3c2OCC3)[C@@H]1C	ZINC001178324481	1386189189	/nfs/dbraw/zinc/18/91/89/1386189189.db2.gz	QGWDMSSTFSZQRZ-GUYCJALGSA-N	0	3	348.874	3.320	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccc(Cl)cc2)CCN1C(=O)/C=C/C1CC1	ZINC001178431971	1386215371	/nfs/dbraw/zinc/21/53/71/1386215371.db2.gz	QQLJJYJJKOMNHL-TXUNIPKSSA-N	0	3	342.870	3.237	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](NCc2ccccc2OC2CC2)[C@@H]1C	ZINC001178581923	1386255814	/nfs/dbraw/zinc/25/58/14/1386255814.db2.gz	GJADJPRAHFLICD-LPHOPBHVSA-N	0	3	340.467	3.110	20	30		EGEDHN
C=C(C)CCC(=O)NCCCCCCNCc1nccn1C(F)F	ZINC001178595990	1386258035	/nfs/dbraw/zinc/25/80/35/1386258035.db2.gz	BCPNVCRDCSCJQP-UHFFFAOYSA-N	0	3	342.434	3.401	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CC[C@H](NCC=C(Cl)Cl)[C@@H]1C)OCC	ZINC001178817847	1386316053	/nfs/dbraw/zinc/31/60/53/1386316053.db2.gz	KKQAOKCJPFXWOD-IHRRRGAJSA-N	0	3	349.302	3.256	20	30		EGEDHN
C=C(Br)CNC[C@@H]1[C@@H](C)CCCN1C(=O)c1ccco1	ZINC001319830866	1386324264	/nfs/dbraw/zinc/32/42/64/1386324264.db2.gz	GWUMSUAIEVUZEM-WCQYABFASA-N	0	3	341.249	3.019	20	30		EGEDHN
C=C(Br)CN[C@H](CNC(=O)c1cc(C)cs1)C(C)C	ZINC001319910311	1386383886	/nfs/dbraw/zinc/38/38/86/1386383886.db2.gz	IAJJZCSPBOTAQG-GFCCVEGCSA-N	0	3	345.306	3.309	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)C1(C)CCC1)NCc1cc(C#N)ccc1F	ZINC001319936593	1386403381	/nfs/dbraw/zinc/40/33/81/1386403381.db2.gz	QMGBNLUIMPTSTA-QGZVFWFLSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCCCCCN[C@@H](C)c1nnc(C)[nH]1	ZINC001179212380	1386424394	/nfs/dbraw/zinc/42/43/94/1386424394.db2.gz	LEUADDQJJIWATG-AWEZNQCLSA-N	0	3	335.496	3.043	20	30		EGEDHN
C[C@H](C#N)C(=O)N(C)CCN(C)CCc1cc(Cl)cc(Cl)c1	ZINC001319981766	1386434332	/nfs/dbraw/zinc/43/43/32/1386434332.db2.gz	UCIYAMPVAYIUFT-GFCCVEGCSA-N	0	3	342.270	3.086	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCCCCCCN[C@H](C)c1nnc(CC)[nH]1	ZINC001179339505	1386455767	/nfs/dbraw/zinc/45/57/67/1386455767.db2.gz	FYXNRUKUVILKIX-HZPDHXFCSA-N	0	3	349.523	3.297	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](NCc2ccc(Cl)nc2)[C@@H]1C	ZINC001179356828	1386461688	/nfs/dbraw/zinc/46/16/88/1386461688.db2.gz	WRCLQODIKSZFPJ-HOCLYGCPSA-N	0	3	333.863	3.008	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](NCc2ccnc(Cl)c2)[C@@H]1C	ZINC001179359966	1386462831	/nfs/dbraw/zinc/46/28/31/1386462831.db2.gz	JODGODGGCMHGBA-HOCLYGCPSA-N	0	3	333.863	3.008	20	30		EGEDHN
C=CCCCC(=O)NCCCCCCN[C@H](C)c1nnc(CC)[nH]1	ZINC001179425871	1386481261	/nfs/dbraw/zinc/48/12/61/1386481261.db2.gz	JDSINPNHOXNFEB-OAHLLOKOSA-N	0	3	335.496	3.051	20	30		EGEDHN
C=C1CCC(C(=O)NCCCCCCNCc2ocnc2C)CC1	ZINC001179481777	1386494184	/nfs/dbraw/zinc/49/41/84/1386494184.db2.gz	LGRVEDOMKGTDBY-UHFFFAOYSA-N	0	3	333.476	3.496	20	30		EGEDHN
C=CCC1(C(=O)NCCCCCCN[C@H](C)c2nnc(C)[nH]2)CCC1	ZINC001179492699	1386497046	/nfs/dbraw/zinc/49/70/46/1386497046.db2.gz	NFNYGRLNWPFIAY-OAHLLOKOSA-N	0	3	347.507	3.187	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)[C@H]1CCC(C)(C)C1	ZINC001179513333	1386502959	/nfs/dbraw/zinc/50/29/59/1386502959.db2.gz	WGFZHFMXRPCCAU-IHPCNDPISA-N	0	3	338.495	3.443	20	30		EGEDHN
C[C@H](CC(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C)n1cccc1	ZINC001179958799	1386649072	/nfs/dbraw/zinc/64/90/72/1386649072.db2.gz	NOGXHSUHXUEPIB-DYXWJJEUSA-N	0	3	349.478	3.070	20	30		EGEDHN
Cc1ccccc1CC(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C	ZINC001180096542	1386696605	/nfs/dbraw/zinc/69/66/05/1386696605.db2.gz	SRCYIRHZDVGYEQ-UGKGYDQZSA-N	0	3	346.474	3.168	20	30		EGEDHN
C[C@@H]1CN(C(=O)/C=C/C2CC2)C[C@@]1(C)CNCc1ccccc1C#N	ZINC001180998397	1386914832	/nfs/dbraw/zinc/91/48/32/1386914832.db2.gz	DHSSIEWFPRHSAT-MJJPEQRRSA-N	0	3	337.467	3.099	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](C)[C@](C)(CNCc2ocnc2C)C1	ZINC001181593923	1387021591	/nfs/dbraw/zinc/02/15/91/1387021591.db2.gz	BYRWUGJMVHVBEP-AUUYWEPGSA-N	0	3	333.476	3.160	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H](C)CN(C)Cc2cccc(C#N)c2)c(C)s1	ZINC001322195836	1387098569	/nfs/dbraw/zinc/09/85/69/1387098569.db2.gz	KDDUGVZSGRIMCG-ZDUSSCGKSA-N	0	3	341.480	3.487	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](C)CN(C)Cc2ccc(C#N)cc2)c(C)s1	ZINC001322196872	1387099183	/nfs/dbraw/zinc/09/91/83/1387099183.db2.gz	QAYSAWJGUPWVAY-CYBMUJFWSA-N	0	3	341.480	3.487	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](NCc2ccc(Cl)c(OC)c2)C1	ZINC001182112732	1387107122	/nfs/dbraw/zinc/10/71/22/1387107122.db2.gz	BZNWWLGQPAIIQL-MRXNPFEDSA-N	0	3	348.874	3.233	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H](C)CN(C)Cc2ccc(C#N)cc2)c(C)c1	ZINC001322285835	1387140841	/nfs/dbraw/zinc/14/08/41/1387140841.db2.gz	PSPJFYWBVZMYJT-QGZVFWFLSA-N	0	3	335.451	3.425	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CC[C@@H](N[C@@H]2CCc3c2cc(F)cc3F)C1	ZINC001182450147	1387168633	/nfs/dbraw/zinc/16/86/33/1387168633.db2.gz	NOGLGIKCHUBOKW-RDTXWAMCSA-N	0	3	346.421	3.192	20	30		EGEDHN
CN(C(=O)C1CCCC1)[C@H](CNCc1cc(C#N)ccc1F)C1CC1	ZINC001331238898	1389664385	/nfs/dbraw/zinc/66/43/85/1389664385.db2.gz	BFITUNDAJFERQV-LJQANCHMSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2ccc(C#N)cc2F)CN1Cc1ccccc1	ZINC001338902845	1389813471	/nfs/dbraw/zinc/81/34/71/1389813471.db2.gz	QAKBFLAJVOBILS-RHSMWYFYSA-N	0	3	337.398	3.090	20	30		EGEDHN
Cc1cccc(C)c1C(=O)NC[C@H](C)CNCc1ccccc1C#N	ZINC001698763180	1406417984	/nfs/dbraw/zinc/41/79/84/1406417984.db2.gz	PBGGCLGNSLRROC-OAHLLOKOSA-N	0	3	335.451	3.331	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc(N2CCSCC2)c(C)c1	ZINC001340075978	1390221519	/nfs/dbraw/zinc/22/15/19/1390221519.db2.gz	RTJVAGMNOUJDOX-INIZCTEOSA-N	0	3	333.501	3.170	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N1CCC[C@@H]2CCC[C@H]21	ZINC001340207167	1390250353	/nfs/dbraw/zinc/25/03/53/1390250353.db2.gz	LVFFSYYSECIRLE-YESZJQIVSA-N	0	3	329.492	3.042	20	30		EGEDHN
C=CCC[C@@H](NCCN1C(=O)COc2ccccc21)c1ccco1	ZINC001340993018	1390421148	/nfs/dbraw/zinc/42/11/48/1390421148.db2.gz	UUTDSZUUYHUXHN-OAHLLOKOSA-N	0	3	326.396	3.302	20	30		EGEDHN
CCSc1ccccc1CC(=O)C(C#N)C(=O)NC1CCCCC1	ZINC001341940566	1390552374	/nfs/dbraw/zinc/55/23/74/1390552374.db2.gz	MPYFHZLPWBVRMQ-INIZCTEOSA-N	0	3	344.480	3.499	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1cccc(OCc2cccnc2)c1	ZINC001343379513	1390710255	/nfs/dbraw/zinc/71/02/55/1390710255.db2.gz	WCOVGSPUWKVGRN-GOSISDBHSA-N	0	3	325.412	3.283	20	30		EGEDHN
Cc1cc(CCC(=O)C(C#N)C(=O)Nc2ccc(F)c(Cl)c2)no1	ZINC001343599163	1390725597	/nfs/dbraw/zinc/72/55/97/1390725597.db2.gz	KMNNWVOKOHVZPL-LBPRGKRZSA-N	0	3	349.749	3.056	20	30		EGEDHN
N#CC(C(=O)Cc1ccc(F)cc1)c1nccn1Cc1ccccc1	ZINC001343982107	1390748051	/nfs/dbraw/zinc/74/80/51/1390748051.db2.gz	DQHNDLDAMRGBHF-GOSISDBHSA-N	0	3	333.366	3.489	20	30		EGEDHN
CCn1ccnc1[C@H](C#N)C(=O)c1ccc(CN2CCCCC2)cc1	ZINC001345646672	1390871784	/nfs/dbraw/zinc/87/17/84/1390871784.db2.gz	MNTOWPXKCJHLNY-GOSISDBHSA-N	0	3	336.439	3.379	20	30		EGEDHN
CCn1ccnc1C(C#N)=C([O-])c1ccc(C[NH+]2CCCCC2)cc1	ZINC001345646672	1390871785	/nfs/dbraw/zinc/87/17/85/1390871785.db2.gz	MNTOWPXKCJHLNY-GOSISDBHSA-N	0	3	336.439	3.379	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCCOCc1ccc(OC)cc1	ZINC001345647302	1390872013	/nfs/dbraw/zinc/87/20/13/1390872013.db2.gz	VTFSWOLYAVYEPC-QGZVFWFLSA-N	0	3	341.411	3.085	20	30		EGEDHN
N#CC(C(=O)CCCC(=O)C1CC1)c1nccn1Cc1ccccc1	ZINC001346536925	1390950841	/nfs/dbraw/zinc/95/08/41/1390950841.db2.gz	DJSXXVQHBORNMI-KRWDZBQOSA-N	0	3	335.407	3.257	20	30		EGEDHN
N#CCOc1cccc(CNCc2ccc(O[C@@H]3CCOC3)cc2)c1	ZINC001346834795	1390981283	/nfs/dbraw/zinc/98/12/83/1390981283.db2.gz	NIZAIEYBWFDFLM-HXUWFJFHSA-N	0	3	338.407	3.046	20	30		EGEDHN
C[C@@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)c1ccsc1	ZINC001698813363	1406501158	/nfs/dbraw/zinc/50/11/58/1406501158.db2.gz	CSOOJPMCKUPYET-LBPRGKRZSA-N	0	3	331.416	3.009	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N(C)C[C@@H]1CC=CCC1	ZINC001351544366	1391650668	/nfs/dbraw/zinc/65/06/68/1391650668.db2.gz	OSJDXIWXTBPGSW-SJORKVTESA-N	0	3	329.492	3.066	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1cnc2cc[nH]c2c1	ZINC001479824368	1392413606	/nfs/dbraw/zinc/41/36/06/1392413606.db2.gz	MHXSPDQWYUAHOM-GUYCJALGSA-N	0	3	346.862	3.288	20	30		EGEDHN
CC(C)C[C@@H](CNCc1ccc(C#N)s1)NC(=O)C1CC2(CC2)C1	ZINC001698874244	1406596332	/nfs/dbraw/zinc/59/63/32/1406596332.db2.gz	SOKYMJYZCGZWNT-HNNXBMFYSA-N	0	3	345.512	3.430	20	30		EGEDHN
C[C@H](CCNC(=O)c1cc2ccccn2c1)NCc1ccccc1C#N	ZINC001480793974	1392937593	/nfs/dbraw/zinc/93/75/93/1392937593.db2.gz	SCPBIWFKDPYZDR-MRXNPFEDSA-N	0	3	346.434	3.109	20	30		EGEDHN
C[C@H](CCNC(=O)c1ccc2cc[nH]c2c1)NCc1ccccc1C#N	ZINC001480795355	1392939058	/nfs/dbraw/zinc/93/90/58/1392939058.db2.gz	RGASYCVNNPNTGC-OAHLLOKOSA-N	0	3	346.434	3.338	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1cc(C)nc2ccccc21	ZINC001480809912	1392947736	/nfs/dbraw/zinc/94/77/36/1392947736.db2.gz	MAPFGUJXTJOADB-ZDUSSCGKSA-N	0	3	331.847	3.394	20	30		EGEDHN
CCN(CCNC(=O)c1cc(C#N)c[nH]1)Cc1cccc(C(F)F)c1	ZINC001480968054	1393054676	/nfs/dbraw/zinc/05/46/76/1393054676.db2.gz	UWXIDQLHPCJFAR-UHFFFAOYSA-N	0	3	346.381	3.076	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCN(Cc1ccc(C(C)(C)C)cc1)C1CC1	ZINC001481162236	1393138844	/nfs/dbraw/zinc/13/88/44/1393138844.db2.gz	GRQOCPZNNMVPKE-HNNXBMFYSA-N	0	3	327.472	3.224	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@@H](CCNC(=O)c2ccsc2)C1	ZINC001481417180	1394277025	/nfs/dbraw/zinc/27/70/25/1394277025.db2.gz	MKZJFUXNTWIUPP-OAHLLOKOSA-N	0	3	339.464	3.262	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2cc(OC)cs2)CCCC1	ZINC001481901575	1394587625	/nfs/dbraw/zinc/58/76/25/1394587625.db2.gz	GOQWWVCLVWSEND-UHFFFAOYSA-N	0	3	328.865	3.141	20	30		EGEDHN
C[C@](CNCc1cc(C#N)ccc1F)(NC(=O)CCC1CC1)C1CC1	ZINC001481921757	1394596144	/nfs/dbraw/zinc/59/61/44/1394596144.db2.gz	IYKYRPNFHKMHEF-HXUWFJFHSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1cc(F)ccc1OC)C1CC1	ZINC001481938517	1394606018	/nfs/dbraw/zinc/60/60/18/1394606018.db2.gz	HWCNHBRPYSEKRJ-KRWDZBQOSA-N	0	3	340.826	3.075	20	30		EGEDHN
Cc1coc(C)c1C(=O)N(C)[C@H](C)CNCc1ccc(F)c(C#N)c1	ZINC001482279137	1394862765	/nfs/dbraw/zinc/86/27/65/1394862765.db2.gz	JHOSNXYCSXJPBK-CYBMUJFWSA-N	0	3	343.402	3.158	20	30		EGEDHN
N#Cc1ccc(CN2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)CCCF)C3)s1	ZINC001484389354	1395356332	/nfs/dbraw/zinc/35/63/32/1395356332.db2.gz	FZCSCPNEZBDGJP-QDMKHBRRSA-N	0	3	349.475	3.229	20	30		EGEDHN
CCc1ccccc1CC(=O)N[C@@H](C)CN(C)Cc1cccc(C#N)c1	ZINC001498316961	1396964720	/nfs/dbraw/zinc/96/47/20/1396964720.db2.gz	OZHHGKVGUQQBIJ-KRWDZBQOSA-N	0	3	349.478	3.300	20	30		EGEDHN
CC(F)(F)CC(=O)N[C@H]1CC12CCN(Cc1cccc(C#N)c1)CC2	ZINC001690126634	1404319761	/nfs/dbraw/zinc/31/97/61/1404319761.db2.gz	SIAUDBPNPMDHGC-INIZCTEOSA-N	0	3	347.409	3.074	20	30		EGEDHN
N#Cc1ccc(CN[C@@H](CNC(=O)C2CCCCC2)C2CC2)c(F)c1	ZINC001690140931	1404338301	/nfs/dbraw/zinc/33/83/01/1404338301.db2.gz	KBLDKKGEQOTOIG-IBGZPJMESA-N	0	3	343.446	3.262	20	30		EGEDHN
CCCC(C)(C)C(=O)NC[C@H](NCc1ccc(C#N)s1)C1CC1	ZINC001690167565	1404366405	/nfs/dbraw/zinc/36/64/05/1404366405.db2.gz	WAFVDDQWNANYGE-INIZCTEOSA-N	0	3	333.501	3.430	20	30		EGEDHN
O=C([C@H]1CC12CCC2)N1CCCC[C@@H]1CNCC#Cc1ccccc1	ZINC001690480046	1404599976	/nfs/dbraw/zinc/59/99/76/1404599976.db2.gz	FHDDHQFVNAVLIS-WOJBJXKFSA-N	0	3	336.479	3.199	20	30		EGEDHN
Cc1cc(C(=O)NC[C@H](C)NCc2ccc(F)c(C#N)c2)sc1C	ZINC001690645124	1404676833	/nfs/dbraw/zinc/67/68/33/1404676833.db2.gz	DWCDMXCDQPQYFK-LBPRGKRZSA-N	0	3	345.443	3.284	20	30		EGEDHN
CCC(C)(C)CC(=O)N(C)[C@@H](C)CNCc1ccc(F)c(C#N)c1	ZINC001732419677	1428573872	/nfs/dbraw/zinc/57/38/72/1428573872.db2.gz	NTWHDKLITVVKMM-AWEZNQCLSA-N	0	3	333.451	3.460	20	30		EGEDHN
CC[C@H](NC[C@H](C)NC(=O)c1cc(C#N)c[nH]1)c1ccc(F)cc1F	ZINC001699398583	1412712476	/nfs/dbraw/zinc/71/24/76/1412712476.db2.gz	CTCQWNBYTDVMJY-ZBEGNZNMSA-N	0	3	346.381	3.024	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)NC(=O)c1ccc2cc[nH]c2c1	ZINC001699420111	1412734392	/nfs/dbraw/zinc/73/43/92/1412734392.db2.gz	FETADFMVVIGTPD-LBPRGKRZSA-N	0	3	338.436	3.009	20	30		EGEDHN
C[C@H](CN(C)Cc1cccc(C#N)c1)NC(=O)C1CCC(F)(F)CC1	ZINC001699464590	1412827306	/nfs/dbraw/zinc/82/73/06/1412827306.db2.gz	SKXNVYGBSPLZPR-CQSZACIVSA-N	0	3	349.425	3.320	20	30		EGEDHN
C[C@H](C(=O)N1CCCC[C@@H]1CNCC#Cc1ccccc1)C1CCC1	ZINC001700124943	1413540937	/nfs/dbraw/zinc/54/09/37/1413540937.db2.gz	FIOBBKOEHMJHLJ-GHTZIAJQSA-N	0	3	338.495	3.445	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)Cc1cccc2cccnc21	ZINC001700325759	1413795312	/nfs/dbraw/zinc/79/53/12/1413795312.db2.gz	XMOTXXHSNYPHJT-AWEZNQCLSA-N	0	3	331.847	3.014	20	30		EGEDHN
C#CCCCC(=O)N1CCCC[C@H]1CNCc1cccc(Cl)n1	ZINC001700343937	1413830364	/nfs/dbraw/zinc/83/03/64/1413830364.db2.gz	KYCSHVDYLYWGPS-INIZCTEOSA-N	0	3	333.863	3.009	20	30		EGEDHN
C[C@H](C#N)C(=O)N(C)CCN(C)[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC001732575974	1428775689	/nfs/dbraw/zinc/77/56/89/1428775689.db2.gz	LCVNGMNYWLHEGT-CHWSQXEVSA-N	0	3	341.377	3.316	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCC[C@@H]1NC(=O)CCC1CC1	ZINC001732615082	1428878668	/nfs/dbraw/zinc/87/86/68/1428878668.db2.gz	IRMKQYUBJWVGSN-OALUTQOASA-N	0	3	325.456	3.123	20	30		EGEDHN
CC1(C(=O)NC[C@H]2C[C@@H](NCc3ccc(C#N)cc3F)C2)CCCC1	ZINC001707066959	1417181288	/nfs/dbraw/zinc/18/12/88/1417181288.db2.gz	BTLGFDBVSPGGRJ-WOVMCDHWSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@H](C)OC2CCCCCC2)C1	ZINC001707071173	1417183144	/nfs/dbraw/zinc/18/31/44/1417183144.db2.gz	IMJHTJDSMXLFSK-HRCADAONSA-N	0	3	342.911	3.351	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1cccc2[nH]ncc21	ZINC001707443981	1417347888	/nfs/dbraw/zinc/34/78/88/1417347888.db2.gz	QJSAVGIKSDXTOK-DYVFJYSZSA-N	0	3	346.862	3.288	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1cncc(CC)c1	ZINC001707447748	1417351219	/nfs/dbraw/zinc/35/12/19/1417351219.db2.gz	YEJSFVZZAHZAGN-PBHICJAKSA-N	0	3	335.879	3.369	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1ccc(COC)o1	ZINC001712998006	1417549611	/nfs/dbraw/zinc/54/96/11/1417549611.db2.gz	DCNYLNZSXRAWNX-HIFRSBDPSA-N	0	3	340.851	3.151	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1ccc2c(c1)CCO2	ZINC001712998961	1417550850	/nfs/dbraw/zinc/55/08/50/1417550850.db2.gz	ISCYMPNQHZXXGR-WMLDXEAASA-N	0	3	348.874	3.347	20	30		EGEDHN
CCC[C@@H](C)CC(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2OC)C1	ZINC001713155507	1417733608	/nfs/dbraw/zinc/73/36/08/1417733608.db2.gz	OYVWBLKOKIRXHA-ZTFGCOKTSA-N	0	3	343.471	3.130	20	30		EGEDHN
CC(C)n1cccc1C(=O)N[C@@H](C)CN(C)Cc1ccc(C#N)cc1	ZINC001733067695	1429222730	/nfs/dbraw/zinc/22/27/30/1429222730.db2.gz	NTJCNVPTFBENSJ-INIZCTEOSA-N	0	3	338.455	3.191	20	30		EGEDHN
CCN(CCNC(=O)C[C@H](C)c1ccco1)Cc1cccc(C#N)c1	ZINC001713496308	1418205703	/nfs/dbraw/zinc/20/57/03/1418205703.db2.gz	QMJQETWPFBXPAW-INIZCTEOSA-N	0	3	339.439	3.283	20	30		EGEDHN
CCCN(CCNC(=O)[C@@H](C)C1CCC1)Cc1cccc(C#N)c1	ZINC001713547187	1418320054	/nfs/dbraw/zinc/32/00/54/1418320054.db2.gz	NTTFOTSMMHGVLZ-INIZCTEOSA-N	0	3	327.472	3.323	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCN(C1CC1)[C@H]1CCc2c1cccc2Cl	ZINC001713555066	1418345795	/nfs/dbraw/zinc/34/57/95/1418345795.db2.gz	LSDXSTOESBPURM-PXAZEXFGSA-N	0	3	331.847	3.068	20	30		EGEDHN
CCC(CC)C(=O)N[C@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001733163080	1429265559	/nfs/dbraw/zinc/26/55/59/1429265559.db2.gz	CFLWUEOFSLQICK-GOSISDBHSA-N	0	3	331.435	3.118	20	30		EGEDHN
N#Cc1ccc(CN[C@H](CNC(=O)CC2CCCC2)C2CC2)c(F)c1	ZINC001713860174	1418657226	/nfs/dbraw/zinc/65/72/26/1418657226.db2.gz	QTEYXPUFJDPCNG-LJQANCHMSA-N	0	3	343.446	3.262	20	30		EGEDHN
CC(C)CC(=O)N[C@](C)(CNCc1ccc(C#N)cc1F)C1CC1	ZINC001714157465	1418968608	/nfs/dbraw/zinc/96/86/08/1418968608.db2.gz	SEJLITLYPNGJSU-LJQANCHMSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2cc(C)no2)CCCC[C@@H]1C	ZINC001714177194	1418984781	/nfs/dbraw/zinc/98/47/81/1418984781.db2.gz	DHOOYQBXWDGJGH-ZBEGNZNMSA-N	0	3	325.840	3.004	20	30		EGEDHN
CC(C)C[C@@H](CNCc1ccc(C#N)s1)NC(=O)c1cncs1	ZINC001714905810	1419648551	/nfs/dbraw/zinc/64/85/51/1419648551.db2.gz	LPHJQKLKBQXYBT-LBPRGKRZSA-N	0	3	348.497	3.011	20	30		EGEDHN
CCCC1(C(=O)N2CC[C@H](NCc3ccccc3C#N)[C@@H](C)C2)CC1	ZINC001715064219	1419801865	/nfs/dbraw/zinc/80/18/65/1419801865.db2.gz	XBWMFENYJIJDSI-LPHOPBHVSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2oc(C)nc2C)CCCC[C@H]1C	ZINC001715126635	1419873135	/nfs/dbraw/zinc/87/31/35/1419873135.db2.gz	CHLNFRPLWDMDTG-DIFFPNOSSA-N	0	3	339.867	3.312	20	30		EGEDHN
CC(C)SCC(=O)N[C@H]1CC[C@H](NCc2ccccc2C#N)CC1	ZINC001715181854	1419916120	/nfs/dbraw/zinc/91/61/20/1419916120.db2.gz	IXZOUCTXIRQEGS-IYARVYRRSA-N	0	3	345.512	3.217	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)C2Cc3ccccc3C2)CCCC1	ZINC001715305646	1420014371	/nfs/dbraw/zinc/01/43/71/1420014371.db2.gz	DTTSLKMTULWWCH-UHFFFAOYSA-N	0	3	332.875	3.173	20	30		EGEDHN
C=C(Br)CNC[C@H]1[C@@H](C)CCCN1C(=O)CC1CCC1	ZINC001715354187	1420054161	/nfs/dbraw/zinc/05/41/61/1420054161.db2.gz	HOYQXCGYVPSLNX-WFASDCNBSA-N	0	3	343.309	3.302	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)N(C)C(=O)C1(F)CCCCC1	ZINC001715366998	1420063942	/nfs/dbraw/zinc/06/39/42/1420063942.db2.gz	QGMRLMXCCMAFFI-CYBMUJFWSA-N	0	3	337.464	3.229	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)N(C)C(=O)C1(F)CCCCC1	ZINC001715366999	1420064047	/nfs/dbraw/zinc/06/40/47/1420064047.db2.gz	QGMRLMXCCMAFFI-ZDUSSCGKSA-N	0	3	337.464	3.229	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H](CNCc2ccc(C#N)s2)CC(C)C)co1	ZINC001715381898	1420078623	/nfs/dbraw/zinc/07/86/23/1420078623.db2.gz	JANQPBFSSSXMOP-OAHLLOKOSA-N	0	3	345.468	3.456	20	30		EGEDHN
COc1ccc(C#N)cc1CNC[C@@H](CC(C)C)NC(=O)C(C)(C)C	ZINC001715389468	1420086501	/nfs/dbraw/zinc/08/65/01/1420086501.db2.gz	DSAJECYQLKJTBN-QGZVFWFLSA-N	0	3	345.487	3.233	20	30		EGEDHN
CC(C)[C@H](CNC(=O)C(C)(C)C1CC1)NCc1cc(C#N)ccc1F	ZINC001715623557	1420269541	/nfs/dbraw/zinc/26/95/41/1420269541.db2.gz	SYTIYAATWUAYLF-SFHVURJKSA-N	0	3	345.462	3.364	20	30		EGEDHN
CCC1(C(=O)NCC2(NCc3ccc(F)c(C#N)c3)CC2)CCCC1	ZINC001733258397	1429410613	/nfs/dbraw/zinc/41/06/13/1429410613.db2.gz	SHUPGRASYYVXJK-UHFFFAOYSA-N	0	3	343.446	3.406	20	30		EGEDHN
CC(C)CC1(C(=O)N[C@H](C)CNCc2ccc(C#N)s2)CCC1	ZINC001715939410	1420409789	/nfs/dbraw/zinc/40/97/89/1420409789.db2.gz	RFUIFZCRGPQUDV-CQSZACIVSA-N	0	3	333.501	3.430	20	30		EGEDHN
CC(C)(C)CC(=O)N[C@H]1CCC[C@@H]1CNCc1ccccc1C#N	ZINC001716056932	1420520281	/nfs/dbraw/zinc/52/02/81/1420520281.db2.gz	YMSSZVONULMNIU-MSOLQXFVSA-N	0	3	327.472	3.369	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H](CNCc2ccc(C#N)s2)C2CC2)c(C)o1	ZINC001716605245	1420772897	/nfs/dbraw/zinc/77/28/97/1420772897.db2.gz	SSLHZFGRNAMGDH-KRWDZBQOSA-N	0	3	343.452	3.128	20	30		EGEDHN
CCCC1(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)s2)CC1	ZINC001716784177	1420920537	/nfs/dbraw/zinc/92/05/37/1420920537.db2.gz	MMDOYKBZQMIJEK-AWEZNQCLSA-N	0	3	331.485	3.281	20	30		EGEDHN
CCC(C)(C)C(=O)N(C)[C@H](CNCc1cc(C#N)ccc1F)C1CC1	ZINC001717736581	1421601195	/nfs/dbraw/zinc/60/11/95/1421601195.db2.gz	UJGVWSSIMXTQMX-GOSISDBHSA-N	0	3	345.462	3.460	20	30		EGEDHN
CCc1ccc(C(=O)NCC2(NCc3ccc(C#N)cc3)CC2)cc1	ZINC001723588404	1424477448	/nfs/dbraw/zinc/47/74/48/1424477448.db2.gz	QOWAOLLPRUMQML-UHFFFAOYSA-N	0	3	333.435	3.173	20	30		EGEDHN
C[C@@]1(CNCc2ccccc2C#N)CCN(C(=O)c2cccs2)C1	ZINC001724194136	1424725111	/nfs/dbraw/zinc/72/51/11/1424725111.db2.gz	FLJGLPIRFQTJGT-IBGZPJMESA-N	0	3	339.464	3.262	20	30		EGEDHN
CCC[C@H](CC)C(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@H]2C1	ZINC001724626043	1424978199	/nfs/dbraw/zinc/97/81/99/1424978199.db2.gz	OVRYBMABTJDYNH-SLFFLAALSA-N	0	3	339.483	3.275	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N(C)C1CC(NCc2cc(C#N)ccc2F)C1	ZINC001725778827	1426462279	/nfs/dbraw/zinc/46/22/79/1426462279.db2.gz	SCFDCCFAQBBKNJ-UHFFFAOYSA-N	0	3	345.462	3.459	20	30		EGEDHN
CCC(CC)CC(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001731454518	1427430809	/nfs/dbraw/zinc/43/08/09/1427430809.db2.gz	DTMIORKITJXVSA-QAQDUYKDSA-N	0	3	331.435	3.260	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H](CNC(=O)C3(F)CCCC3)C2)cc1	ZINC001731502824	1427484640	/nfs/dbraw/zinc/48/46/40/1427484640.db2.gz	OBYVKTWBGUQFAR-SFHVURJKSA-N	0	3	343.446	3.169	20	30		EGEDHN
C[C@H](CN(C)C(=O)c1ccoc1Cl)NCc1ccc(F)c(C#N)c1	ZINC001734321217	1438048434	/nfs/dbraw/zinc/04/84/34/1438048434.db2.gz	SMCMFSCDFDXOSN-LLVKDONJSA-N	0	3	349.793	3.194	20	30		EGEDHN
CC(C)(C)[C@@H](CNCc1ccc(C#N)s1)NC(=O)CC(C)(F)F	ZINC001734570791	1438165051	/nfs/dbraw/zinc/16/50/51/1438165051.db2.gz	NPYLIKLHAMYTJC-CYBMUJFWSA-N	0	3	343.443	3.286	20	30		EGEDHN
CCN(CCCNC(=O)[C@@H]1CC[C@H](F)C1)Cc1ccc(C#N)s1	ZINC001752208364	1440154416	/nfs/dbraw/zinc/15/44/16/1440154416.db2.gz	VVYJFSLTTUVDCY-KGLIPLIRSA-N	0	3	337.464	3.086	20	30		EGEDHN
O=C(NC[C@H](NCC#Cc1ccccc1)C1CC1)c1c[nH]cc1C1CC1	ZINC001752490012	1440186534	/nfs/dbraw/zinc/18/65/34/1440186534.db2.gz	JAZGUGJFQFJPCK-NRFANRHFSA-N	0	3	347.462	3.042	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@H](CN(C)CCC(F)(F)F)C1	ZINC001752517652	1440191639	/nfs/dbraw/zinc/19/16/39/1440191639.db2.gz	JRTPQWABOPWPTP-OAHLLOKOSA-N	0	3	332.410	3.303	20	30		EGEDHN
C=CCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)CO[C@H]1CCCC[C@H]1C	ZINC001752565198	1440195491	/nfs/dbraw/zinc/19/54/91/1440195491.db2.gz	LLBMYALRPQEZTD-YRXWBPOGSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H](NCc3conc3CC)C2)CCCC1	ZINC001752690772	1440200475	/nfs/dbraw/zinc/20/04/75/1440200475.db2.gz	FOAUTLNOGSGDQZ-WKILWMFISA-N	0	3	331.460	3.110	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1oc(CC)nc1C	ZINC001752697825	1440201218	/nfs/dbraw/zinc/20/12/18/1440201218.db2.gz	SBISGAZNLPTFAZ-MQVJKMGUSA-N	0	3	345.487	3.369	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@@H]2CN(Cc3ccccn3)CC[C@H]21	ZINC001752704253	1440202053	/nfs/dbraw/zinc/20/20/53/1440202053.db2.gz	CPCPZZKMPJWOHP-IEBWSBKVSA-N	0	3	341.499	3.497	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H]2CN(Cc3ccsc3)CC[C@@H]21	ZINC001752706790	1440202891	/nfs/dbraw/zinc/20/28/91/1440202891.db2.gz	ROPCUGFASPYPLM-ROUUACIJSA-N	0	3	330.497	3.365	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H]2C[C@@H](NCC#Cc3ccccc3Cl)C2)o1	ZINC001752711458	1440203267	/nfs/dbraw/zinc/20/32/67/1440203267.db2.gz	AIHAKAMZXRSSOI-IYBDPMFKSA-N	0	3	342.826	3.144	20	30		EGEDHN
O=C(N[C@H]1C[C@@H](NCC#Cc2cccc(Cl)c2)C1)[C@]12C[C@H]1CCC2	ZINC001752746697	1440204809	/nfs/dbraw/zinc/20/48/09/1440204809.db2.gz	WDJIGHXDGQUFGL-PHXBYCTMSA-N	0	3	342.870	3.119	20	30		EGEDHN
C=CC1(CC(=O)N[C@H]2C[C@@H](NCc3cnoc3C)C2)CCCCC1	ZINC001752766994	1440205825	/nfs/dbraw/zinc/20/58/25/1440205825.db2.gz	QNTKTWFVOLKSAE-CALCHBBNSA-N	0	3	331.460	3.246	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@H]2CCCN(Cc3cccnc3C)C2)C1	ZINC001752785993	1440211387	/nfs/dbraw/zinc/21/13/87/1440211387.db2.gz	IDQQWBYNLYLTKM-KRWDZBQOSA-N	0	3	327.472	3.075	20	30		EGEDHN
C[C@H](CNC(=O)C#CC1CC1)NCc1ccc(Cl)c(Cl)c1	ZINC001752869743	1440237003	/nfs/dbraw/zinc/23/70/03/1440237003.db2.gz	NQYGYUYXDCWQTL-LLVKDONJSA-N	0	3	325.239	3.001	20	30		EGEDHN
Cc1cc(C(=O)NC[C@H](C)NCc2ccc(F)c(C#N)c2)ccc1F	ZINC001752897416	1440241977	/nfs/dbraw/zinc/24/19/77/1440241977.db2.gz	ZLKOJSLKAKKQFS-ZDUSSCGKSA-N	0	3	343.377	3.053	20	30		EGEDHN
C[C@H](CNC(=O)c1cc(Cl)cs1)NCc1ccc(C#N)s1	ZINC001752903562	1440243547	/nfs/dbraw/zinc/24/35/47/1440243547.db2.gz	QTYBVLDVRRBRCF-SECBINFHSA-N	0	3	339.873	3.243	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](CNCc2nc(C(C)(C)C)cs2)C1	ZINC001752934042	1440250195	/nfs/dbraw/zinc/25/01/95/1440250195.db2.gz	CXYMRKNEHADYER-OAHLLOKOSA-N	0	3	347.528	3.182	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CCC[C@@H](NCc2ccn(C(C)C)n2)C1	ZINC001752975716	1440255995	/nfs/dbraw/zinc/25/59/95/1440255995.db2.gz	FGDQJAHVYZGRBO-QZTJIDSGSA-N	0	3	344.503	3.175	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CCC[C@@H](NCc2ccn(C(C)C)n2)C1	ZINC001752976026	1440256131	/nfs/dbraw/zinc/25/61/31/1440256131.db2.gz	IHTICQXYJNNWEU-IAGOWNOFSA-N	0	3	332.492	3.337	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)C2(CCF)CC2)C1	ZINC001752994133	1440261004	/nfs/dbraw/zinc/26/10/04/1440261004.db2.gz	VORMUYWUHZCSFQ-SFHVURJKSA-N	0	3	343.446	3.121	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)c1ccc(C)cc1	ZINC001753017512	1440268925	/nfs/dbraw/zinc/26/89/25/1440268925.db2.gz	ZWKYHRKRRBMCSP-CYBMUJFWSA-N	0	3	325.250	3.002	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1CCCNC(=O)c1cc2occc2[nH]1	ZINC001753027333	1440271744	/nfs/dbraw/zinc/27/17/44/1440271744.db2.gz	IRHANSQEILMGHP-CYBMUJFWSA-N	0	3	335.835	3.488	20	30		EGEDHN
CC1(C(=O)NCCC[C@@H]2CCCN2Cc2ccccc2C#N)CC1	ZINC001753027853	1440272125	/nfs/dbraw/zinc/27/21/25/1440272125.db2.gz	SMSDQQQRNYANEW-GOSISDBHSA-N	0	3	325.456	3.219	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCC[C@@H]1CCCN1Cc1conc1C	ZINC001753036252	1440274906	/nfs/dbraw/zinc/27/49/06/1440274906.db2.gz	USCICWRXEBPFQQ-QGZVFWFLSA-N	0	3	333.476	3.446	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H]1CCCN1Cc1ccc2c(c1)CCC2	ZINC001753101166	1440304447	/nfs/dbraw/zinc/30/44/47/1440304447.db2.gz	LSIQHKCELQIRBL-NRFANRHFSA-N	0	3	338.495	3.450	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@H]1CCCN1Cc1ccc(OC)cc1	ZINC001753110719	1440308222	/nfs/dbraw/zinc/30/82/22/1440308222.db2.gz	SUBLZQFCOVKWOL-SJLPKXTDSA-N	0	3	330.472	3.378	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)CCCc2ccccc2Cl)C1	ZINC001753127531	1440315272	/nfs/dbraw/zinc/31/52/72/1440315272.db2.gz	QFVYBMPVQVWZBL-MRXNPFEDSA-N	0	3	332.875	3.124	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)NCCCN(Cc1ccc(C#N)s1)C(C)C	ZINC001753291214	1440350278	/nfs/dbraw/zinc/35/02/78/1440350278.db2.gz	ZLQZMRPKSSHTBB-MRXNPFEDSA-N	0	3	339.480	3.331	20	30		EGEDHN
C=CCN[C@H](CNC(=O)c1cnc(C)n1C)c1ccc(C(C)C)cc1	ZINC001753294596	1440351796	/nfs/dbraw/zinc/35/17/96/1440351796.db2.gz	QVBWVQOPJRXEAZ-GOSISDBHSA-N	0	3	340.471	3.099	20	30		EGEDHN
C=C(C)CN[C@H](CNC(=O)[C@H]1Cc2ccccc2O1)c1ccccc1	ZINC001753300408	1440353682	/nfs/dbraw/zinc/35/36/82/1440353682.db2.gz	RXKXZNHUXFDKNB-UYAOXDASSA-N	0	3	336.435	3.013	20	30		EGEDHN
C=C(C)CN[C@@H](CNC(=O)[C@@H]1Cc2ccccc2O1)c1ccccc1	ZINC001753300406	1440353799	/nfs/dbraw/zinc/35/37/99/1440353799.db2.gz	RXKXZNHUXFDKNB-ICSRJNTNSA-N	0	3	336.435	3.013	20	30		EGEDHN
C=C(C)CN[C@H](CNC(=O)Cc1ccc(F)cc1)c1ccccc1	ZINC001753302764	1440354567	/nfs/dbraw/zinc/35/45/67/1440354567.db2.gz	JBJINEQSVCEECA-LJQANCHMSA-N	0	3	326.415	3.391	20	30		EGEDHN
C#CCCN[C@@H](CNC(=O)c1cc(CC(C)C)c[nH]1)c1ccccc1	ZINC001753303099	1440354899	/nfs/dbraw/zinc/35/48/99/1440354899.db2.gz	QBZOMRXTBMCTRG-FQEVSTJZSA-N	0	3	337.467	3.297	20	30		EGEDHN
C=CCCC(=O)N1C[C@H]2CC[C@@H](C1)N2CCCCC1CCOCC1	ZINC001753303518	1440354977	/nfs/dbraw/zinc/35/49/77/1440354977.db2.gz	AJGTXIZWTNQOQY-KDURUIRLSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@H]2CC[C@@H](C1)N2C[C@H](OC)C1CCCC1	ZINC001753306629	1440355561	/nfs/dbraw/zinc/35/55/61/1440355561.db2.gz	DIQXLBBXYNVEFK-OTWHNJEPSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=CCOCCN1CCC[C@@H](N(Cc2ccccc2)C(=O)C(C)C)C1	ZINC001753362060	1440383477	/nfs/dbraw/zinc/38/34/77/1440383477.db2.gz	UGQPQZGCRAUMCO-HXUWFJFHSA-N	0	3	344.499	3.338	20	30		EGEDHN
C=CC1(CC(=O)NCC2CN(C[C@@H]3CC[C@H](C)O3)C2)CCCCC1	ZINC001753412980	1440393609	/nfs/dbraw/zinc/39/36/09/1440393609.db2.gz	WGLDHBZCNLUJLC-WMZOPIPTSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H]2C[C@H]1CN2C(=O)c1cccc(C(C)C)n1	ZINC001753423708	1440396041	/nfs/dbraw/zinc/39/60/41/1440396041.db2.gz	VVALCSZWXMPFGF-IKGGRYGDSA-N	0	3	327.472	3.458	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H]2C[C@H]1CN2C(=O)c1ccc2[nH]nc(C)c2c1	ZINC001753423507	1440396185	/nfs/dbraw/zinc/39/61/85/1440396185.db2.gz	MYIZVPMHENLYLF-JQFCIGGWSA-N	0	3	338.455	3.125	20	30		EGEDHN
CCCCCCCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc2nccn2c1	ZINC001753426297	1440396834	/nfs/dbraw/zinc/39/68/34/1440396834.db2.gz	UPPWLAUYEHRUGI-ROUUACIJSA-N	0	3	340.471	3.203	20	30		EGEDHN
C=CCCCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1ccc(OCC=C)cc1	ZINC001753427559	1440397316	/nfs/dbraw/zinc/39/73/16/1440397316.db2.gz	LIQKSMQPJHZCQQ-OALUTQOASA-N	0	3	340.467	3.045	20	30		EGEDHN
C#CCCCCCC(=O)N(C)[C@H]1CCN(CCc2ccccc2F)C1	ZINC001753442706	1440402348	/nfs/dbraw/zinc/40/23/48/1440402348.db2.gz	ITAFZWKJJJYTBH-IBGZPJMESA-N	0	3	344.474	3.485	20	30		EGEDHN
C=CCCC(=O)N(CC)[C@H]1CCN(C[C@@H](OC)c2ccccc2)C1	ZINC001753452860	1440406964	/nfs/dbraw/zinc/40/69/64/1440406964.db2.gz	GSEUIICEDKQOKA-RBUKOAKNSA-N	0	3	330.472	3.263	20	30		EGEDHN
C=CCCOCC(=O)N(CC)[C@H]1CCN(Cc2ccc(C)c(C)c2)C1	ZINC001753463954	1440412175	/nfs/dbraw/zinc/41/21/75/1440412175.db2.gz	LAEJZEPVQQBRLM-FQEVSTJZSA-N	0	3	344.499	3.319	20	30		EGEDHN
CC[C@H](CNC(=O)CCC1CC1)NCC#Cc1cccc(Cl)c1	ZINC001753468248	1440413298	/nfs/dbraw/zinc/41/32/98/1440413298.db2.gz	CWXDZQTWEHSLSA-GOSISDBHSA-N	0	3	332.875	3.366	20	30		EGEDHN
CC[C@H](CNC(=O)c1c(C)cccc1C)NCC#Cc1ccccc1	ZINC001753486835	1440418027	/nfs/dbraw/zinc/41/80/27/1440418027.db2.gz	AVRCGZPBHFNMOB-HXUWFJFHSA-N	0	3	334.463	3.453	20	30		EGEDHN
CCCc1occc1C(=O)NC[C@@H](CC)NCC#Cc1ccccc1	ZINC001753495662	1440421322	/nfs/dbraw/zinc/42/13/22/1440421322.db2.gz	JSUMINVJQKHQJX-GOSISDBHSA-N	0	3	338.451	3.382	20	30		EGEDHN
C=C/C(C)=C/CC(=O)NC1(CNCC(=C)Br)CCCC1	ZINC001753507177	1440424766	/nfs/dbraw/zinc/42/47/66/1440424766.db2.gz	OZYMANCFIGLBCQ-NTUHNPAUSA-N	0	3	341.293	3.436	20	30		EGEDHN
C[C@@H]1CCCC[C@@]1(CNCC#Cc1ccccc1)NC(=O)C(C)(C)F	ZINC001753530030	1440430648	/nfs/dbraw/zinc/43/06/48/1440430648.db2.gz	NKIWBCPNMNIHCF-UTKZUKDTSA-N	0	3	344.474	3.441	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@H](CCNCc2cnc(C)o2)C1	ZINC001753548459	1440434682	/nfs/dbraw/zinc/43/46/82/1440434682.db2.gz	MATOBLSZWOYUGE-MRXNPFEDSA-N	0	3	333.476	3.304	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCCN(C(=O)CC#Cc2ccccc2)C1	ZINC001753562793	1440437119	/nfs/dbraw/zinc/43/71/19/1440437119.db2.gz	XOKWDFYTJZFYSB-IBGZPJMESA-N	0	3	344.886	3.399	20	30		EGEDHN
CC(C)C#CC(=O)NCCC1CCN(Cc2ccccc2F)CC1	ZINC001753595258	1440444268	/nfs/dbraw/zinc/44/42/68/1440444268.db2.gz	UZRNRVGIJZZFTA-UHFFFAOYSA-N	0	3	330.447	3.203	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cnoc2-c2ccco2)CCCC1	ZINC001753665200	1440460078	/nfs/dbraw/zinc/46/00/78/1440460078.db2.gz	SWINNWSINGVEMO-UHFFFAOYSA-N	0	3	349.818	3.319	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)C(C)(C)c2cccnc2)CCCC1	ZINC001753665818	1440460114	/nfs/dbraw/zinc/46/01/14/1440460114.db2.gz	OTBIJWJFERQWMI-UHFFFAOYSA-N	0	3	335.879	3.130	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C1(CCOCC)CCC1)CC2	ZINC001753674197	1440462862	/nfs/dbraw/zinc/46/28/62/1440462862.db2.gz	ZNKIMCLWCMXDMQ-UHFFFAOYSA-N	0	3	334.504	3.084	20	30		EGEDHN
C[C@H](CNCC#Cc1cccc(Cl)c1)N(C)C(=O)[C@@H]1CC1(C)C	ZINC001753685652	1440465505	/nfs/dbraw/zinc/46/55/05/1440465505.db2.gz	NYNAFPNBJDCQBE-PBHICJAKSA-N	0	3	332.875	3.174	20	30		EGEDHN
C=CC(C)(C)C(=O)N(C)[C@@H](C)CNCC#Cc1cccc(Cl)c1	ZINC001753707092	1440469784	/nfs/dbraw/zinc/46/97/84/1440469784.db2.gz	VMFIKLJOSZRCBE-HNNXBMFYSA-N	0	3	332.875	3.340	20	30		EGEDHN
C=CCC1(C(=O)N(C)[C@H](C)CNCc2cc(CO)ccc2F)CCC1	ZINC001753710382	1440470509	/nfs/dbraw/zinc/47/05/09/1440470509.db2.gz	CVPCIVMHDIGYEH-OAHLLOKOSA-N	0	3	348.462	3.001	20	30		EGEDHN
CC(C)C[C@@H](CNCc1ccc(C#N)s1)NC(=O)C=C1CCC1	ZINC001753732466	1440476631	/nfs/dbraw/zinc/47/66/31/1440476631.db2.gz	GXHAYOYFYBKNLU-HNNXBMFYSA-N	0	3	331.485	3.351	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H](CN[C@@H](C)c1n[nH]c(C)n1)C1CCCCC1	ZINC001753747449	1440481462	/nfs/dbraw/zinc/48/14/62/1440481462.db2.gz	QWZFNXJBYVFBJQ-XJKSGUPXSA-N	0	3	347.507	3.041	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](NCc2nc(C)oc2C)[C@@H](C)C1	ZINC001753755222	1440482913	/nfs/dbraw/zinc/48/29/13/1440482913.db2.gz	OONGVFICQBWYIA-KSSFIOAISA-N	0	3	345.487	3.386	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](NCc2nc(C)oc2C)[C@@H](C)C1	ZINC001753755220	1440482949	/nfs/dbraw/zinc/48/29/49/1440482949.db2.gz	OONGVFICQBWYIA-KBXCAEBGSA-N	0	3	345.487	3.386	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](NCc2csc(C)n2)[C@@H](C)C1	ZINC001753755723	1440483104	/nfs/dbraw/zinc/48/31/04/1440483104.db2.gz	VUYDOGHLDVAWNC-XJKSGUPXSA-N	0	3	335.517	3.380	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCCC[C@H]1CCNCc1cnc(C)cn1	ZINC001753777985	1440486881	/nfs/dbraw/zinc/48/68/81/1440486881.db2.gz	XUDZJFFNOPZOKF-SFHVURJKSA-N	0	3	344.503	3.248	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)C2=CCCC2)[C@@H]1CNCC#Cc1ccccc1	ZINC001753804129	1440491442	/nfs/dbraw/zinc/49/14/42/1440491442.db2.gz	FBZRRPMNMMJOEX-WIYYLYMNSA-N	0	3	336.479	3.365	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H](C)[C@@H]1CNCc1cn(C(C)C)nc1C	ZINC001753805818	1440491720	/nfs/dbraw/zinc/49/17/20/1440491720.db2.gz	RZSAEVFADXFODJ-APWZRJJASA-N	0	3	346.519	3.455	20	30		EGEDHN
Cc1[nH]ccc1C(=O)N1CCC[C@@H](C)[C@@H]1CNCC#Cc1ccccc1	ZINC001753805904	1440491822	/nfs/dbraw/zinc/49/18/22/1440491822.db2.gz	SVZNNFBMEOHGAK-UTKZUKDTSA-N	0	3	349.478	3.205	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@H]([C@@H](C)NCc2nnc(C(C)C)[nH]2)C1	ZINC001753815330	1440493686	/nfs/dbraw/zinc/49/36/86/1440493686.db2.gz	LMDLGQOVIVWEAD-CVEARBPZSA-N	0	3	347.507	3.001	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC(CCN(C)Cc2cnc(C)nc2)CC1	ZINC001753819752	1440495215	/nfs/dbraw/zinc/49/52/15/1440495215.db2.gz	CELSHUCTDHLTPN-UHFFFAOYSA-N	0	3	344.503	3.202	20	30		EGEDHN
C=C(Br)CN[C@@H](CNC(=O)C1CC(C)(C)C1)C(C)C	ZINC001753828264	1440498928	/nfs/dbraw/zinc/49/89/28/1440498928.db2.gz	GGOSYRCSWJKPNX-ZDUSSCGKSA-N	0	3	331.298	3.062	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)C1(C)CC1)NCC#Cc1ccccc1Cl	ZINC001753829671	1440499404	/nfs/dbraw/zinc/49/94/04/1440499404.db2.gz	QAFZVIFBGSJXMN-QGZVFWFLSA-N	0	3	332.875	3.222	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@H](NCc2cnn(C(C)(C)C)c2)C(C)C)C1	ZINC001753838141	1440501631	/nfs/dbraw/zinc/50/16/31/1440501631.db2.gz	NYVKWPKZEUNIBU-KRWDZBQOSA-N	0	3	346.519	3.225	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)Cc1c[nH]c2ccccc12)C(C)C	ZINC001753844474	1440503849	/nfs/dbraw/zinc/50/38/49/1440503849.db2.gz	NYVCCVIOXIZUFW-QGZVFWFLSA-N	0	3	333.863	3.193	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CCC[C@H]1CNCc1ncc(C)s1	ZINC001753895380	1440522744	/nfs/dbraw/zinc/52/27/44/1440522744.db2.gz	MXDPLRUXVKQDQU-LSDHHAIUSA-N	0	3	335.517	3.428	20	30		EGEDHN
C[C@H](CCNCc1cc(C#N)ccc1F)NC(=O)CCC1(C)CC1	ZINC001754009960	1440531106	/nfs/dbraw/zinc/53/11/06/1440531106.db2.gz	PLUJOKUHUGYEHX-CQSZACIVSA-N	0	3	331.435	3.262	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H](C)CN[C@@H](C)C(=O)Nc1ccc(C)cc1C	ZINC001754228053	1440553544	/nfs/dbraw/zinc/55/35/44/1440553544.db2.gz	ZZWPCIFLTILCOP-SJORKVTESA-N	0	3	345.487	3.081	20	30		EGEDHN
CCC[C@@H](C(=O)N[C@H](C)CNCc1ccc(C#N)c(F)c1)C(C)C	ZINC001754243178	1440556191	/nfs/dbraw/zinc/55/61/91/1440556191.db2.gz	CIHGPXUYHVIUHR-RHSMWYFYSA-N	0	3	333.451	3.364	20	30		EGEDHN
CCC1(C(=O)N[C@H](C)CNCC#Cc2ccccc2)CCCCC1	ZINC001754254671	1440558891	/nfs/dbraw/zinc/55/88/91/1440558891.db2.gz	KXADESPXEAQWRL-GOSISDBHSA-N	0	3	326.484	3.493	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccc(F)cc1)NC(=O)CCCC(F)(F)F	ZINC001754285254	1440564076	/nfs/dbraw/zinc/56/40/76/1440564076.db2.gz	OOKZTHGAJNGUGG-ZDUSSCGKSA-N	0	3	344.352	3.004	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)c1cccc(F)c1F	ZINC001754324238	1440579872	/nfs/dbraw/zinc/57/98/72/1440579872.db2.gz	QVCRRMRSVHTYIW-ZDUSSCGKSA-N	0	3	343.377	3.087	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H](C)CN(C)Cc2cc3ccccc3o2)cn1	ZINC001754330512	1440583399	/nfs/dbraw/zinc/58/33/99/1440583399.db2.gz	IJYHHHVYLZVWAM-HNNXBMFYSA-N	0	3	347.418	3.059	20	30		EGEDHN
CC1(C)CC[C@@H]1C(=O)N[C@@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001754448717	1440600507	/nfs/dbraw/zinc/60/05/07/1440600507.db2.gz	DPWAADWOIPBTHY-CVEARBPZSA-N	0	3	331.485	3.040	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H](CNCc1c(C)nsc1C)C1CC1	ZINC001754450136	1440600918	/nfs/dbraw/zinc/60/09/18/1440600918.db2.gz	HJIHPEODRFREDU-FUHWJXTLSA-N	0	3	335.517	3.347	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H]1CCN1C[C@H]1CCCC(F)(F)C1	ZINC001754480842	1440607298	/nfs/dbraw/zinc/60/72/98/1440607298.db2.gz	MZNJJQJMAKMZDT-HOTGVXAUSA-N	0	3	326.431	3.196	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC1(NCc2ccc(C#N)c(F)c2)CC1	ZINC001754524179	1440620514	/nfs/dbraw/zinc/62/05/14/1440620514.db2.gz	WIVLDKZURQWNEK-SFHVURJKSA-N	0	3	329.419	3.038	20	30		EGEDHN
C=CCOCC(=O)N1C[C@H]2CCC[C@@H](C1)N2CC[C@@H]1CCC[C@@H](C)C1	ZINC001754549960	1440629636	/nfs/dbraw/zinc/62/96/36/1440629636.db2.gz	AZNZOFMVBAEXCS-WCIQWLHISA-N	0	3	348.531	3.471	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@H]2CCC[C@@H](C1)N2CCC[C@@H]1CCOC1	ZINC001754552943	1440630399	/nfs/dbraw/zinc/63/03/99/1440630399.db2.gz	QHWQRJHFAFGOIU-QRVBRYPASA-N	0	3	348.531	3.471	20	30		EGEDHN
CC#CCCCC(=O)N1C[C@H]2CCC[C@@H](C1)N2C[C@H](OCC)C1CC1	ZINC001754553061	1440630440	/nfs/dbraw/zinc/63/04/40/1440630440.db2.gz	SLLLBYDVYMQZQU-ZCNNSNEGSA-N	0	3	346.515	3.060	20	30		EGEDHN
C=CCC[C@@H](C)[N@@H+]1CC[C@]2(CCN(C(=O)c3ccccc3[O-])C2)C1	ZINC001754561845	1440634087	/nfs/dbraw/zinc/63/40/87/1440634087.db2.gz	FDQKNLSMRAAUKO-UZLBHIALSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=CCC[C@@H](C)[N@H+]1CC[C@]2(CCN(C(=O)c3ccccc3[O-])C2)C1	ZINC001754561845	1440634088	/nfs/dbraw/zinc/63/40/88/1440634088.db2.gz	FDQKNLSMRAAUKO-UZLBHIALSA-N	0	3	328.456	3.285	20	30		EGEDHN
CC/C(C)=C\C(=O)N1CC[C@H](NCc2ccccc2C#N)C[C@@H]1C	ZINC001754593837	1440641136	/nfs/dbraw/zinc/64/11/36/1440641136.db2.gz	UJCMUJFBFYGONK-IZVVPPCGSA-N	0	3	325.456	3.384	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@H]1CNCC#Cc1cccc(Cl)c1	ZINC001754605615	1440643259	/nfs/dbraw/zinc/64/32/59/1440643259.db2.gz	JBJLKMUCPLXHBV-SFHVURJKSA-N	0	3	330.859	3.238	20	30		EGEDHN
O=C(C1=CCCC1)N1CCC[C@H]1CNCC#Cc1ccccc1Cl	ZINC001754607931	1440643522	/nfs/dbraw/zinc/64/35/22/1440643522.db2.gz	MZHOIJGATDZKHK-SFHVURJKSA-N	0	3	342.870	3.382	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)Cc2c[nH]c3cc(C)ccc23)CC1	ZINC001754630600	1440647693	/nfs/dbraw/zinc/64/76/93/1440647693.db2.gz	IWVQXQXVCCEYBN-UHFFFAOYSA-N	0	3	325.456	3.176	20	30		EGEDHN
C#CCN(C(C)=O)C1CCN([C@H]2CCc3ccc(Cl)cc32)CC1	ZINC001754634139	1440648293	/nfs/dbraw/zinc/64/82/93/1440648293.db2.gz	PDVNIKIBTXBFTQ-IBGZPJMESA-N	0	3	330.859	3.273	20	30		EGEDHN
C#CCN(C(=O)Cc1cccc(Cl)c1)C1CCN(CC(=C)C)CC1	ZINC001754640036	1440648953	/nfs/dbraw/zinc/64/89/53/1440648953.db2.gz	FKBSIYJDFNCUFL-UHFFFAOYSA-N	0	3	344.886	3.385	20	30		EGEDHN
C=CCCC(=O)N[C@@H](CNCC#Cc1ccc(F)cc1)C1CCCC1	ZINC001754645383	1440650147	/nfs/dbraw/zinc/65/01/47/1440650147.db2.gz	LEWZEJVVRPPHMI-FQEVSTJZSA-N	0	3	342.458	3.408	20	30		EGEDHN
C=CCOCC(=O)N[C@@]1(C)CCN([C@H](CC)c2ccc(F)cc2)C1	ZINC001754668540	1440657333	/nfs/dbraw/zinc/65/73/33/1440657333.db2.gz	NJBQBNCOQLTWRE-MJGOQNOKSA-N	0	3	334.435	3.060	20	30		EGEDHN
C[C@@]1(NC(=O)C#CC2CC2)CCN(Cc2ccc3ccccc3c2)C1	ZINC001754670230	1440657922	/nfs/dbraw/zinc/65/79/22/1440657922.db2.gz	LPDMNVLWPUKQAX-JOCHJYFZSA-N	0	3	332.447	3.334	20	30		EGEDHN
CC#CCCCC(=O)N[C@@]1(C)CCN(CCCCC(F)(F)F)C1	ZINC001754677713	1440660742	/nfs/dbraw/zinc/66/07/42/1440660742.db2.gz	MBCBJNZEFICYFH-INIZCTEOSA-N	0	3	332.410	3.493	20	30		EGEDHN
C=CCN1CCC[C@](C)(CNC(=O)[C@@H]2Cc3c2cccc3Cl)C1	ZINC001754735257	1440681980	/nfs/dbraw/zinc/68/19/80/1440681980.db2.gz	XJNRMJLDLOUOGU-VQIMIIECSA-N	0	3	332.875	3.384	20	30		EGEDHN
C#CCCN[C@@H](CNC(=O)c1ccccc1F)c1ccccc1CC	ZINC001754785862	1440687711	/nfs/dbraw/zinc/68/77/11/1440687711.db2.gz	QYFWSHPBVWCDQI-FQEVSTJZSA-N	0	3	338.426	3.472	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2Cc1cnc(C)o1	ZINC001754832164	1440695837	/nfs/dbraw/zinc/69/58/37/1440695837.db2.gz	ZHTDJQZRYLIECD-FJIDUMEYSA-N	0	3	345.487	3.445	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@H](c3ccccc3)[C@H](C)CC)C[C@@H]2C1	ZINC001754847543	1440699615	/nfs/dbraw/zinc/69/96/15/1440699615.db2.gz	FIJPQIPCAIAUJA-PBASOCQRSA-N	0	3	338.495	3.230	20	30		EGEDHN
CC1(C(=O)N2CC[C@@H](CCNCc3cc(C#N)ccc3F)C2)CCC1	ZINC001754925613	1440709821	/nfs/dbraw/zinc/70/98/21/1440709821.db2.gz	IXLNOEOKMYSJRT-OAHLLOKOSA-N	0	3	343.446	3.216	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CC[C@H](CCNCc2ccccc2C#N)C1	ZINC001754934809	1440711094	/nfs/dbraw/zinc/71/10/94/1440711094.db2.gz	SINCEGULKYLDDM-SJORKVTESA-N	0	3	327.472	3.179	20	30		EGEDHN
C=CCC1(C(=O)NCc2ccccc2CN(C)CCO)CCCCC1	ZINC001754955174	1440716164	/nfs/dbraw/zinc/71/61/64/1440716164.db2.gz	WLVYVNYCOXGBSB-UHFFFAOYSA-N	0	3	344.499	3.254	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1CCCN(Cc2cn(C(C)C)nc2C)CC1	ZINC001755027453	1440729621	/nfs/dbraw/zinc/72/96/21/1440729621.db2.gz	AJZPJYBQPYXLPM-SFHVURJKSA-N	0	3	346.519	3.455	20	30		EGEDHN
CC#CCN(C)CCCN(C)C(=O)c1cc2cc(C)c(C)cc2o1	ZINC001755043940	1440739392	/nfs/dbraw/zinc/73/93/92/1440739392.db2.gz	JFJWRDZOZKAXCU-UHFFFAOYSA-N	0	3	326.440	3.467	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H]([C@@H]2CCCN(C/C=C/Cl)C2)C1	ZINC001755048298	1440742584	/nfs/dbraw/zinc/74/25/84/1440742584.db2.gz	VQPIULDBWXJHSM-UVWGOUGDSA-N	0	3	336.907	3.493	20	30		EGEDHN
CCC1(NCc2ncoc2C(C)C)CCN(C(=O)C#CC2CC2)CC1	ZINC001755068534	1440745813	/nfs/dbraw/zinc/74/58/13/1440745813.db2.gz	HYVVNTFKZROLPX-UHFFFAOYSA-N	0	3	343.471	3.072	20	30		EGEDHN
C=CCC[C@H](C)N1Cc2ccccc2C[C@@H]1CNC(=O)c1ccon1	ZINC001755073732	1440747678	/nfs/dbraw/zinc/74/76/78/1440747678.db2.gz	DQNSEPAJYFEFBP-MAUKXSAKSA-N	0	3	339.439	3.186	20	30		EGEDHN
C=C(C)CCN1Cc2ccccc2C[C@@H]1CNC(=O)C(C)(C)COC	ZINC001755075870	1440748742	/nfs/dbraw/zinc/74/87/42/1440748742.db2.gz	OHTUEPODQKVKGY-LJQANCHMSA-N	0	3	344.499	3.168	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@H](NCc3ncccc3C)[C@@H](C)C2)CCCC1	ZINC001755124690	1440756020	/nfs/dbraw/zinc/75/60/20/1440756020.db2.gz	GGSCDCFPLYQNQI-HKUYNNGSSA-N	0	3	341.499	3.463	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CCN(Cc2cnccc2C)CC1(C)C	ZINC001755137705	1440759209	/nfs/dbraw/zinc/75/92/09/1440759209.db2.gz	CLVPLRXWPPBOLP-GOSISDBHSA-N	0	3	329.488	3.463	20	30		EGEDHN
CC#CCCCC(=O)N[C@H]1CCN(Cc2scnc2C)[C@@H](C)C1	ZINC001755164504	1440766382	/nfs/dbraw/zinc/76/63/82/1440766382.db2.gz	WOMFEONFZNJNTN-HOCLYGCPSA-N	0	3	333.501	3.114	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@@H]1CN(C)C[C@@H](O)c1ccccc1	ZINC001755195813	1440776975	/nfs/dbraw/zinc/77/69/75/1440776975.db2.gz	YQLVCOQCJVYLOU-RTBURBONSA-N	0	3	344.499	3.245	20	30		EGEDHN
CC(C)C(=O)N[C@H](C)[C@H](C)NCC#Cc1ccc(C(F)(F)F)cc1	ZINC001755226878	1440786192	/nfs/dbraw/zinc/78/61/92/1440786192.db2.gz	QRXPHOMXTTZZRY-UONOGXRCSA-N	0	3	340.389	3.196	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H](C)[C@H](C)NCc2sccc2Cl)c1	ZINC001755253014	1440792346	/nfs/dbraw/zinc/79/23/46/1440792346.db2.gz	NYXASIRTVJRKFE-RYUDHWBXSA-N	0	3	347.871	3.074	20	30		EGEDHN
C[C@@H](NCC#Cc1ccc(F)cc1)[C@@H](C)NC(=O)C(C1CC1)C1CC1	ZINC001755264374	1440795670	/nfs/dbraw/zinc/79/56/70/1440795670.db2.gz	WCXNBQDVUFQUHX-HUUCEWRRSA-N	0	3	342.458	3.096	20	30		EGEDHN
C[C@H](C#N)C(=O)N(C)CC(C)(C)CN[C@@H](C)c1nc2ccccc2o1	ZINC001755279409	1440800132	/nfs/dbraw/zinc/80/01/32/1440800132.db2.gz	NONWRTVHIZWMPO-KGLIPLIRSA-N	0	3	342.443	3.123	20	30		EGEDHN
C[C@H](CNC(=O)c1c[nH]cc1C1CC1)N(C)Cc1ccc(C#N)cc1	ZINC001755321894	1440818880	/nfs/dbraw/zinc/81/88/80/1440818880.db2.gz	WEMGIKAKDHWNOJ-CQSZACIVSA-N	0	3	336.439	3.014	20	30		EGEDHN
C#CCCCC(=O)NC[C@@H]1CCCCCN1Cc1cccc(F)c1	ZINC001755363170	1440832858	/nfs/dbraw/zinc/83/28/58/1440832858.db2.gz	CYLNYXJETNGILW-IBGZPJMESA-N	0	3	330.447	3.490	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@]2(CCN(C(=O)CC(C)(C)CC)C2)C1	ZINC001755401618	1440843159	/nfs/dbraw/zinc/84/31/59/1440843159.db2.gz	JLRSOKQASQZVPJ-PXNSSMCTSA-N	0	3	336.520	3.471	20	30		EGEDHN
CCc1cccc(CN2C[C@@H](NC(=O)C#CC(C)C)C(C)(C)C2)c1	ZINC001755405917	1440844219	/nfs/dbraw/zinc/84/42/19/1440844219.db2.gz	ANLDQHQIRBAQMA-LJQANCHMSA-N	0	3	326.484	3.235	20	30		EGEDHN
CC[C@@H](C)CCC(=O)NC[C@@H]1[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001755429138	1440850834	/nfs/dbraw/zinc/85/08/34/1440850834.db2.gz	BDFHBHHSOCRHCD-XLNTUCKNSA-N	0	3	339.483	3.179	20	30		EGEDHN
CCC[C@H](CC)C(=O)NC[C@@H]1[C@H]2CN(Cc3cccc(C#N)c3)C[C@H]21	ZINC001755430217	1440851021	/nfs/dbraw/zinc/85/10/21/1440851021.db2.gz	OVRGSPRNXIQQCC-LWYYNNOASA-N	0	3	339.483	3.179	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC(N(C)Cc2cncc(F)c2)CC1	ZINC001755529992	1440866783	/nfs/dbraw/zinc/86/67/83/1440866783.db2.gz	OPYCYMZJLKINKS-UHFFFAOYSA-N	0	3	333.451	3.246	20	30		EGEDHN
C=C(Cl)CNCCCN(Cc1ccccc1)C(=O)C1=COCCC1	ZINC001755537227	1440870038	/nfs/dbraw/zinc/87/00/38/1440870038.db2.gz	MPOZJXLFYNNAKK-UHFFFAOYSA-N	0	3	348.874	3.442	20	30		EGEDHN
CN(C(=O)C1(C)CCCC1)[C@@H](CNCC#Cc1ccccc1)C1CC1	ZINC001755563460	1440875020	/nfs/dbraw/zinc/87/50/20/1440875020.db2.gz	LKERAYJFDWRZDJ-FQEVSTJZSA-N	0	3	338.495	3.445	20	30		EGEDHN
CC[C@@H](C)CC(=O)N(C)[C@H](CNCc1cc(C#N)ccc1F)C1CC1	ZINC001755570567	1440876807	/nfs/dbraw/zinc/87/68/07/1440876807.db2.gz	DMQCQRVXRRPZSC-AUUYWEPGSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC/C(C)=C\C(=O)N(C)[C@@H](CNCc1cc(C#N)ccc1F)C1CC1	ZINC001755571638	1440877031	/nfs/dbraw/zinc/87/70/31/1440877031.db2.gz	PRXGVZNDKHRBML-SZJVNEJHSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=C(Br)CNC[C@H](C1CC1)N(C)C(=O)C[C@@H](C)CC	ZINC001755572224	1440877181	/nfs/dbraw/zinc/87/71/81/1440877181.db2.gz	RMDINYVUZPPYLM-SMDDNHRTSA-N	0	3	331.298	3.158	20	30		EGEDHN
Cc1cccc(C(=O)N(C)C[C@H](C)NCc2ccc(C#N)s2)c1	ZINC001755575821	1440878038	/nfs/dbraw/zinc/87/80/38/1440878038.db2.gz	LYEXLAUJQHOZQF-AWEZNQCLSA-N	0	3	327.453	3.179	20	30		EGEDHN
C[C@@H](CN(C)C(=O)c1coc(C(F)F)c1)NCC#Cc1ccccc1	ZINC001755603051	1440884569	/nfs/dbraw/zinc/88/45/69/1440884569.db2.gz	VDDJDIANCNHTPL-AWEZNQCLSA-N	0	3	346.377	3.319	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](NCc2cc(Cl)ccc2OC)[C@H]1C	ZINC001755651551	1440891418	/nfs/dbraw/zinc/89/14/18/1440891418.db2.gz	GWIOEXDDEYGZDE-CZUORRHYSA-N	0	3	336.863	3.394	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](NCc2ccc(OC)c(C#N)c2)C[C@@H]1C	ZINC001755675126	1440894457	/nfs/dbraw/zinc/89/44/57/1440894457.db2.gz	INOZHAKLSXVANG-YJBOKZPZSA-N	0	3	341.455	3.002	20	30		EGEDHN
C[C@@H]1C[C@@H](NCC#Cc2ccccc2)CN1C(=O)C1CCC=CCC1	ZINC001755692434	1440897006	/nfs/dbraw/zinc/89/70/06/1440897006.db2.gz	KYDWKLNOOBXQET-WIYYLYMNSA-N	0	3	336.479	3.364	20	30		EGEDHN
C=CCN1CC[C@]2(NC(=O)[C@@H](C)Cc3ccc(C)cc3)CCC[C@@H]12	ZINC001755704887	1440902027	/nfs/dbraw/zinc/90/20/27/1440902027.db2.gz	RMLOWZRIGXFMTQ-FBBABVLZSA-N	0	3	326.484	3.473	20	30		EGEDHN
CCC[C@H](C)C(=O)N1C[C@@H](NCc2ccc(C#N)s2)C(C)(C)C1	ZINC001755754156	1440913625	/nfs/dbraw/zinc/91/36/25/1440913625.db2.gz	SAUVHLBLPMOTNL-XJKSGUPXSA-N	0	3	333.501	3.383	20	30		EGEDHN
CS[C@@H](C)CC(=O)N1C[C@H](NCC#Cc2ccccc2)C(C)(C)C1	ZINC001755755836	1440913959	/nfs/dbraw/zinc/91/39/59/1440913959.db2.gz	VXDDIPUDUCESRT-WMZOPIPTSA-N	0	3	344.524	3.006	20	30		EGEDHN
C#CCCN(C)CCN(C(=O)[C@@H](C)Cc1cccc(F)c1)C(C)C	ZINC001755815272	1440923270	/nfs/dbraw/zinc/92/32/70/1440923270.db2.gz	GDUOBKRBSSFAGW-KRWDZBQOSA-N	0	3	332.463	3.196	20	30		EGEDHN
C=C(C)CN(C)CCN(C(=O)CCc1c(C)noc1Cl)C(C)C	ZINC001755815916	1440923650	/nfs/dbraw/zinc/92/36/50/1440923650.db2.gz	ZRYDFTRADLFIPO-UHFFFAOYSA-N	0	3	341.883	3.314	20	30		EGEDHN
COc1ccc(C#N)cc1CNC[C@@H](NC(=O)C=C(C)C)C(C)(C)C	ZINC001755816707	1440923904	/nfs/dbraw/zinc/92/39/04/1440923904.db2.gz	PNLRHGJZFGZCQO-GOSISDBHSA-N	0	3	343.471	3.154	20	30		EGEDHN
CC(C)(C)[C@H](CNCc1cc(C#N)ccc1F)NC(=O)[C@@H]1CC1(C)C	ZINC001755820202	1440925444	/nfs/dbraw/zinc/92/54/44/1440925444.db2.gz	NULUZSDPMJKUNS-RDJZCZTQSA-N	0	3	345.462	3.364	20	30		EGEDHN
C=C(Cl)CNC[C@H](NC(=O)c1c(Cl)n[nH]c1CC)C(C)(C)C	ZINC001755824728	1440926828	/nfs/dbraw/zinc/92/68/28/1440926828.db2.gz	GWYDEZKVNMQNJQ-NSHDSACASA-N	0	3	347.290	3.112	20	30		EGEDHN
C=CCCCC(=O)N[C@H](CNCc1n[nH]c(C(C)(C)C)n1)C(C)(C)C	ZINC001755829956	1440928476	/nfs/dbraw/zinc/92/84/76/1440928476.db2.gz	GYTFQTVBXQZVAK-CQSZACIVSA-N	0	3	349.523	3.079	20	30		EGEDHN
C#CCCCC(=O)N(C)C1CC(NCc2ccc(F)cc2Cl)C1	ZINC001755856002	1440935893	/nfs/dbraw/zinc/93/58/93/1440935893.db2.gz	KATPXNHCUNPMCR-UHFFFAOYSA-N	0	3	336.838	3.362	20	30		EGEDHN
C#CCOCCC(=O)N(C)C1CC(N[C@@H](C)c2ccccc2Cl)C1	ZINC001755856676	1440935900	/nfs/dbraw/zinc/93/59/00/1440935900.db2.gz	IKYNASCOSOKJQL-FHERZECASA-N	0	3	348.874	3.020	20	30		EGEDHN
C=CC(C)(C)CC(=O)N(C)C1CC(NCc2cc(C#N)ccc2F)C1	ZINC001755858087	1440936146	/nfs/dbraw/zinc/93/61/46/1440936146.db2.gz	OCFDSZOBBONTKK-UHFFFAOYSA-N	0	3	343.446	3.379	20	30		EGEDHN
CN(C(=O)[C@@H]1CCCC1(C)C)C1CC(NCC#Cc2ccccc2)C1	ZINC001755859759	1440936548	/nfs/dbraw/zinc/93/65/48/1440936548.db2.gz	FTDFRJWONYXKAC-MHJFOBGBSA-N	0	3	338.495	3.443	20	30		EGEDHN
C#CCCCC(=O)NCC1=CCN([C@@H](C)c2cccc(OC)c2)CC1	ZINC001755883358	1440939912	/nfs/dbraw/zinc/93/99/12/1440939912.db2.gz	JPCNJSZFABQGOP-KRWDZBQOSA-N	0	3	340.467	3.308	20	30		EGEDHN
C=C(Cl)Cn1c(N2C[C@H](C)N(CC)C[C@H]2C)nnc1C(C)(C)C	ZINC001760386497	1441368193	/nfs/dbraw/zinc/36/81/93/1441368193.db2.gz	AOISMKXXZOMBOU-UONOGXRCSA-N	0	3	339.915	3.247	20	30		EGEDHN
C=C(C)C[N@@H+](C)Cc1cccc(OCc2ccccc2-c2nn[n-]n2)c1	ZINC000823878424	946498114	/nfs/dbraw/zinc/49/81/14/946498114.db2.gz	YMCSRNFZDCIGDA-UHFFFAOYSA-N	0	3	349.438	3.454	20	30		EGEDHN
C=C(C)C[N@H+](C)Cc1cccc(OCc2ccccc2-c2nn[n-]n2)c1	ZINC000823878424	946498122	/nfs/dbraw/zinc/49/81/22/946498122.db2.gz	YMCSRNFZDCIGDA-UHFFFAOYSA-N	0	3	349.438	3.454	20	30		EGEDHN
N#Cc1cc(F)ccc1NC(=O)N1CCCN(C2CCCC2)CC1	ZINC000177921662	232033772	/nfs/dbraw/zinc/03/37/72/232033772.db2.gz	YQULTLOISMHSEV-UHFFFAOYSA-N	0	3	330.407	3.180	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccccc2S[C@H](C)CC#N)CC1	ZINC000066800577	215080417	/nfs/dbraw/zinc/08/04/17/215080417.db2.gz	HRGLTGIRBJCPEG-OAHLLOKOSA-N	0	3	341.480	3.365	20	30		EGEDHN
C=CCOCCCC(=O)N[C@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000079552056	217240899	/nfs/dbraw/zinc/24/08/99/217240899.db2.gz	MORZGJVFZXGDAQ-MJGOQNOKSA-N	0	3	330.472	3.139	20	30		EGEDHN
Cc1cc(F)cc(C(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)c1	ZINC000079609415	217244425	/nfs/dbraw/zinc/24/44/25/217244425.db2.gz	OCYPPTSYKJAHSP-UHFFFAOYSA-N	0	3	339.414	3.210	20	30		EGEDHN
CCS(=O)(=O)Nc1ccc([C@H](C)NCc2cccc(C#N)c2)cc1	ZINC000151385084	223815729	/nfs/dbraw/zinc/81/57/29/223815729.db2.gz	DZRNAWJQHHRLSO-AWEZNQCLSA-N	0	3	343.452	3.171	20	30		EGEDHN
C[C@@H](NC(=O)N1CCC[C@H]1CN1CCCCC1)c1ccc(C#N)cc1	ZINC000264280879	246285860	/nfs/dbraw/zinc/28/58/60/246285860.db2.gz	ROEVFXLLDHATJC-APWZRJJASA-N	0	3	340.471	3.279	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@H]2Cc2ccccc2)CC1	ZINC000264338642	246372597	/nfs/dbraw/zinc/37/25/97/246372597.db2.gz	HSXTWDSYMRHJOJ-IBGZPJMESA-N	0	3	327.472	3.054	20	30		EGEDHN
Cn1cc(CN2CCC[C@@H](c3nc(-c4ccccc4)n[nH]3)C2)cc1C#N	ZINC000377679458	169058990	/nfs/dbraw/zinc/05/89/90/169058990.db2.gz	LUNPMWNEAQSLRN-QGZVFWFLSA-N	0	3	346.438	3.061	20	30		EGEDHN
N#Cc1cc(F)ccc1NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000095403212	218338566	/nfs/dbraw/zinc/33/85/66/218338566.db2.gz	DGSOSCRSMFSUDB-UHFFFAOYSA-N	0	3	339.414	3.266	20	30		EGEDHN
C[C@H](c1ccc([S@@](C)=O)cc1)N(C)C[C@@H](O)c1ccc(C#N)cc1	ZINC000268729313	252178675	/nfs/dbraw/zinc/17/86/75/252178675.db2.gz	XAXHDLFYAKTBBS-USPKDDAKSA-N	0	3	342.464	3.022	20	30		EGEDHN
COc1cc(CN(C)CCOc2cccc(C#N)c2)cc(OC)c1	ZINC000353329973	141289084	/nfs/dbraw/zinc/28/90/84/141289084.db2.gz	ODOGPOXBKUNDCG-UHFFFAOYSA-N	0	3	326.396	3.086	20	30		EGEDHN
CC[C@@H](C)N[C@H](CNC(=O)Nc1cccc(C#N)c1)c1ccco1	ZINC000353353379	141292971	/nfs/dbraw/zinc/29/29/71/141292971.db2.gz	MUKZSDJWTUEXLS-CZUORRHYSA-N	0	3	326.400	3.402	20	30		EGEDHN
CN(C)CCNC(=O)c1cccc(Oc2ccc(Cl)cc2C#N)c1	ZINC000116988611	152083718	/nfs/dbraw/zinc/08/37/18/152083718.db2.gz	PHKXPGMKOYMXTR-UHFFFAOYSA-N	0	3	343.814	3.295	20	30		EGEDHN
COc1cc([C@H](C)N[C@H](C)c2ccc(C#N)cc2)ccc1OCCO	ZINC000341590170	155371240	/nfs/dbraw/zinc/37/12/40/155371240.db2.gz	UJBQKEVFIHCHHC-CABCVRRESA-N	0	3	340.423	3.350	20	30		EGEDHN
C[C@@H](N[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O)c1cccs1	ZINC000190629067	153152546	/nfs/dbraw/zinc/15/25/46/153152546.db2.gz	ROZWMFOJAJWZQX-CJNGLKHVSA-N	0	3	325.437	3.071	20	30		EGEDHN
N#Cc1ccc(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)cc1	ZINC000311172206	154147163	/nfs/dbraw/zinc/14/71/63/154147163.db2.gz	UEXJHAVDQDVERO-LJQANCHMSA-N	0	3	333.435	3.200	20	30		EGEDHN
N#Cc1ccc(C(=O)N2C[C@@H]3CCN(Cc4ccccc4)C[C@H]3C2)cc1	ZINC000312071678	154150496	/nfs/dbraw/zinc/15/04/96/154150496.db2.gz	OAHJUZNURAGQPO-SFTDATJTSA-N	0	3	345.446	3.152	20	30		EGEDHN
N#Cc1cc(N2CCN(Cc3cccc4ccccc43)CC2)ccn1	ZINC000339969651	155055679	/nfs/dbraw/zinc/05/56/79/155055679.db2.gz	SQYYOADXIMFMAO-UHFFFAOYSA-N	0	3	328.419	3.429	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CCc1ccc(C#N)cc1	ZINC000248913763	163045243	/nfs/dbraw/zinc/04/52/43/163045243.db2.gz	VSOXAOSCPYCJSV-DYESRHJHSA-N	0	3	347.462	3.128	20	30		EGEDHN
CN(C)C[C@H](NC(=O)c1ccc(C#N)s1)c1ccc(Cl)cc1	ZINC000338754865	163338571	/nfs/dbraw/zinc/33/85/71/163338571.db2.gz	PGMFDJJXZVSSCS-AWEZNQCLSA-N	0	3	333.844	3.306	20	30		EGEDHN
CNC(=O)[C@@H](Cc1c[nH]c2ccccc12)N[C@H](C)c1cccc(C#N)c1	ZINC000344144092	164114201	/nfs/dbraw/zinc/11/42/01/164114201.db2.gz	SSMWNRXTKNYURA-JLTOFOAXSA-N	0	3	346.434	3.047	20	30		EGEDHN
CC[C@@H](C)N[C@H](CNC(=O)c1cccc(C#N)c1C)c1ccco1	ZINC000359539461	167184773	/nfs/dbraw/zinc/18/47/73/167184773.db2.gz	IQKXNTNZKDOORA-CXAGYDPISA-N	0	3	325.412	3.319	20	30		EGEDHN
CC[C@H](C)N[C@@H](CNC(=O)Cc1c(F)cccc1C#N)c1ccco1	ZINC000359540108	167185966	/nfs/dbraw/zinc/18/59/66/167185966.db2.gz	JCMSNSBUUBMQJK-GUYCJALGSA-N	0	3	343.402	3.078	20	30		EGEDHN
N#Cc1cccc(CCNC(=O)C2CCN(Cc3ccccc3)CC2)c1	ZINC000366972431	168164075	/nfs/dbraw/zinc/16/40/75/168164075.db2.gz	FLWSQSSQXPGLOG-UHFFFAOYSA-N	0	3	347.462	3.129	20	30		EGEDHN
N#Cc1cc(NCC2CCN(c3ccncc3)CC2)ccc1[N+](=O)[O-]	ZINC000167424008	226191110	/nfs/dbraw/zinc/19/11/10/226191110.db2.gz	QLWCDHJMKFCGCI-UHFFFAOYSA-N	0	3	337.383	3.190	20	30		EGEDHN
Cc1ccccc1OCCCN1CC[C@H](Oc2ccc(C#N)cn2)C1	ZINC000428823708	269920897	/nfs/dbraw/zinc/92/08/97/269920897.db2.gz	XJSYWWPJPVHPCM-SFHVURJKSA-N	0	3	337.423	3.184	20	30		EGEDHN
N#Cc1ccc(CNc2ccccc2CN2CCC(O)CC2)cc1F	ZINC000421339792	270048882	/nfs/dbraw/zinc/04/88/82/270048882.db2.gz	STFLOGKTPAZWGV-UHFFFAOYSA-N	0	3	339.414	3.266	20	30		EGEDHN
CCC(F)(F)C(C)(C)CN[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000527699064	270059629	/nfs/dbraw/zinc/05/96/29/270059629.db2.gz	GESSTOBRRWISTJ-MRXNPFEDSA-N	0	3	349.425	3.320	20	30		EGEDHN
CCN1CCN(Cc2ccc(CNc3ccc(C#N)cc3)cc2)CC1	ZINC000301071649	266149693	/nfs/dbraw/zinc/14/96/93/266149693.db2.gz	FBBSSHCHLMXVJP-UHFFFAOYSA-N	0	3	334.467	3.308	20	30		EGEDHN
CCS[C@H]1CCC[C@@H]1NCC(=O)Nc1sc(C)c(C)c1C#N	ZINC000286205113	266347701	/nfs/dbraw/zinc/34/77/01/266347701.db2.gz	QFTLRTDIHLNHSK-KBPBESRZSA-N	0	3	337.514	3.439	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@H](NCc1ccc(C#N)cn1)C1CCCC1	ZINC000496440658	266864605	/nfs/dbraw/zinc/86/46/05/266864605.db2.gz	CLWAMRFCFZXNBP-QGZVFWFLSA-N	0	3	344.459	3.126	20	30		EGEDHN
CCO[C@@H]1C[C@H](NCC(=O)Nc2ccc(C#N)cc2)C1(CC)CC	ZINC000429338317	267152650	/nfs/dbraw/zinc/15/26/50/267152650.db2.gz	MGENFQKHEKDLDF-DLBZAZTESA-N	0	3	329.444	3.070	20	30		EGEDHN
C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC000272496863	267175818	/nfs/dbraw/zinc/17/58/18/267175818.db2.gz	NKWIIYZPTFRSIV-YOEHRIQHSA-N	0	3	329.444	3.293	20	30		EGEDHN
CC[C@H](CNc1ccccc1)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000452459427	267212331	/nfs/dbraw/zinc/21/23/31/267212331.db2.gz	IWIZEXHBIKGHBI-RTBURBONSA-N	0	3	346.434	3.247	20	30		EGEDHN
CC[C@H]1c2ccsc2CCN1C[C@@H](O)COc1ccccc1C#N	ZINC000528353530	267236791	/nfs/dbraw/zinc/23/67/91/267236791.db2.gz	UDRJTZRWYCPXSF-WBVHZDCISA-N	0	3	342.464	3.369	20	30		EGEDHN
CN(C)CCc1ccccc1NC(=O)NCc1ccc(C#N)s1	ZINC000421094175	267280567	/nfs/dbraw/zinc/28/05/67/267280567.db2.gz	HKHXUOHPGYMDLM-UHFFFAOYSA-N	0	3	328.441	3.046	20	30		EGEDHN
CN(Cc1cccc(C#N)c1F)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000434733523	267319757	/nfs/dbraw/zinc/31/97/57/267319757.db2.gz	BFDMKRGUHRMDSB-ICSRJNTNSA-N	0	3	338.430	3.217	20	30		EGEDHN
Cc1cc(N2CCN(c3ccc(C#N)cn3)CC2)c2ccccc2n1	ZINC000193714508	267339783	/nfs/dbraw/zinc/33/97/83/267339783.db2.gz	KHYPNKLMMJVUEU-UHFFFAOYSA-N	0	3	329.407	3.137	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N1CCC(c2nnc3n2CCCC3)CC1	ZINC000275725799	267413356	/nfs/dbraw/zinc/41/33/56/267413356.db2.gz	SZDWXCFOASBEHI-HNNXBMFYSA-N	0	3	335.455	3.427	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)N1c2ccc(C)cc2[C@@H]2CN(C)CC[C@H]21	ZINC000280821334	267721716	/nfs/dbraw/zinc/72/17/16/267721716.db2.gz	DXNYIEKPUQWIBQ-PKOBYXMFSA-N	0	3	335.407	3.216	20	30		EGEDHN
Cc1ccc(CCNC(=O)C(C#N)Cc2ccc(C#N)cc2)c(C)c1	ZINC000470831855	268035779	/nfs/dbraw/zinc/03/57/79/268035779.db2.gz	NLZAFDIYRJOAJT-FQEVSTJZSA-N	0	3	331.419	3.216	20	30		EGEDHN
Cn1cc(CN2CCC[C@@H](c3nc(C(F)(F)F)c[nH]3)C2)cc1C#N	ZINC000278560971	268039868	/nfs/dbraw/zinc/03/98/68/268039868.db2.gz	AWULEPUUVXKAPO-GFCCVEGCSA-N	0	3	337.349	3.018	20	30		EGEDHN
Cc1ccc([C@@H]2CCN(Cc3cnc4c(C#N)cnn4c3)C2)c(C)c1	ZINC000519651934	268044067	/nfs/dbraw/zinc/04/40/67/268044067.db2.gz	HQDHNSQLSUZYON-QGZVFWFLSA-N	0	3	331.423	3.207	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CC[C@@H](Cc3ccccc3)C2)cc1	ZINC000280517787	268083951	/nfs/dbraw/zinc/08/39/51/268083951.db2.gz	RPRQFOMJWFGDRZ-SFTDATJTSA-N	0	3	343.430	3.332	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NC[C@@H]2CCCCC2(F)F)cc1	ZINC000295335588	268085357	/nfs/dbraw/zinc/08/53/57/268085357.db2.gz	FJXWMIFSVMIJKC-HOTGVXAUSA-N	0	3	331.366	3.182	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCc2ccc3ncccc3c2)cc1	ZINC000349240690	268086813	/nfs/dbraw/zinc/08/68/13/268086813.db2.gz	IMBLGRWBLXLHQB-IBGZPJMESA-N	0	3	340.386	3.105	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@H]2CCCOc3ccccc32)cc1	ZINC000279306104	268087074	/nfs/dbraw/zinc/08/70/74/268087074.db2.gz	MPURXELTTDOTAD-HKUYNNGSSA-N	0	3	345.402	3.271	20	30		EGEDHN
Cc1oc(NC(=O)CN[C@@H]2C[C@H](OC(C)(C)C)C2(C)C)c(C#N)c1C	ZINC000412084170	268104647	/nfs/dbraw/zinc/10/46/47/268104647.db2.gz	UKMCVSKVISVWDY-CABCVRRESA-N	0	3	347.459	3.278	20	30		EGEDHN
N#Cc1ccc(CNC(=O)CN2CCC[C@@H]2CCc2ccccc2)cc1	ZINC000520168868	268226159	/nfs/dbraw/zinc/22/61/59/268226159.db2.gz	CLVKKGWEXDKTKK-OAQYLSRUSA-N	0	3	347.462	3.272	20	30		EGEDHN
N#Cc1ccccc1NC(=O)CCN1CCC[C@@H](c2ccncc2)C1	ZINC000298437094	268277914	/nfs/dbraw/zinc/27/79/14/268277914.db2.gz	GSKCZPVBFHFHPM-GOSISDBHSA-N	0	3	334.423	3.161	20	30		EGEDHN
N#Cc1ccccc1-c1ccc(CN2C[C@@H]3CCC[C@H]3[C@@H]2C(N)=O)cc1	ZINC000527056170	268294982	/nfs/dbraw/zinc/29/49/82/268294982.db2.gz	SQDDHLOHOULSTF-CEWLAPEOSA-N	0	3	345.446	3.311	20	30		EGEDHN
COc1ccc([C@H](C)NC[C@H](O)c2ccc(C#N)cc2)c(C)c1OC	ZINC000287103813	276084400	/nfs/dbraw/zinc/08/44/00/276084400.db2.gz	XZHAHALXQIMXAV-KSSFIOAISA-N	0	3	340.423	3.268	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CN(C2CC2)[C@@H]2CCc3ccccc32)cc1	ZINC000068333628	307369552	/nfs/dbraw/zinc/36/95/52/307369552.db2.gz	NMVDQJGVZGHGCU-SIKLNZKXSA-N	0	3	348.446	3.450	20	30		EGEDHN
CN(C)[C@H](CNC(=O)CSc1ccc(C#N)cc1)c1ccccc1	ZINC000068653416	307371706	/nfs/dbraw/zinc/37/17/06/307371706.db2.gz	GDEGBJNIFOILTR-GOSISDBHSA-N	0	3	339.464	3.069	20	30		EGEDHN
COC(=O)[C@@H](C)[C@@H](NCCOc1ccc(C#N)cc1)c1ccccc1	ZINC000079922275	307430137	/nfs/dbraw/zinc/43/01/37/307430137.db2.gz	HNMQYQPBWFUYJV-HNAYVOBHSA-N	0	3	338.407	3.077	20	30		EGEDHN
CN1CC[C@H](NC(=O)C2(c3cccc(C#N)c3)CC2)[C@H]1c1ccccc1	ZINC000536262653	314103717	/nfs/dbraw/zinc/10/37/17/314103717.db2.gz	IRCMXQICQDRXLK-VQTJNVASSA-N	0	3	345.446	3.151	20	30		EGEDHN
CC[C@H](CN1CCN(c2nccnc2C#N)C[C@@H]1C)c1ccccc1	ZINC000537704737	314203835	/nfs/dbraw/zinc/20/38/35/314203835.db2.gz	CDYAGAUDIXTRFK-DLBZAZTESA-N	0	3	335.455	3.053	20	30		EGEDHN
N#Cc1cccc(OCCCNC2(c3ccc4c(c3)OCO4)CC2)c1	ZINC000538229697	314233823	/nfs/dbraw/zinc/23/38/23/314233823.db2.gz	QKSMKEKKPJCQEG-UHFFFAOYSA-N	0	3	336.391	3.335	20	30		EGEDHN
C[C@H](CCc1ccccc1)CN1CCN(c2cc(C#N)ccn2)CC1	ZINC000538307156	314239319	/nfs/dbraw/zinc/23/93/19/314239319.db2.gz	ACVGPHUNQQILLS-GOSISDBHSA-N	0	3	334.467	3.344	20	30		EGEDHN
C[C@H](N[C@@H](C)[C@@H]1CN(Cc2ccccc2)CCO1)c1ccc(C#N)cc1	ZINC000538396244	314244587	/nfs/dbraw/zinc/24/45/87/314244587.db2.gz	XLMVQZHIBNPHSB-SPEDKVCISA-N	0	3	349.478	3.498	20	30		EGEDHN
C[C@H]1CN(c2nccnc2C#N)CCN1C[C@@H]1CCCC(C)(C)C1	ZINC000538808966	314277360	/nfs/dbraw/zinc/27/73/60/314277360.db2.gz	DIBGWTPKVBXMOE-JKSUJKDBSA-N	0	3	327.476	3.075	20	30		EGEDHN
C[C@]1(NCC(=O)Nc2sccc2C#N)CCCc2ccccc21	ZINC000539807618	314340308	/nfs/dbraw/zinc/34/03/08/314340308.db2.gz	MOWBPJQYXZWSMN-SFHVURJKSA-N	0	3	325.437	3.400	20	30		EGEDHN
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCc1ccc(C#N)c(C)c1	ZINC000556522406	315440505	/nfs/dbraw/zinc/44/05/05/315440505.db2.gz	GIEJKFOLACNSDF-OXJNMPFZSA-N	0	3	336.435	3.377	20	30		EGEDHN
N#Cc1ccc(CN2CCC(Nc3cccc4c3OCO4)CC2)cc1	ZINC000564038760	316104586	/nfs/dbraw/zinc/10/45/86/316104586.db2.gz	SVINHLOERPBUQQ-UHFFFAOYSA-N	0	3	335.407	3.363	20	30		EGEDHN
N#Cc1ccc([C@H](N[C@H]2CCC[C@@H](c3ccccc3)C2)C(N)=O)cc1	ZINC000574738975	317630800	/nfs/dbraw/zinc/63/08/00/317630800.db2.gz	GUVDXMXROXRJNH-AABGKKOBSA-N	0	3	333.435	3.401	20	30		EGEDHN
CC[C@H](N[C@@H](C)C(=O)Nc1ccc(C#N)c(Cl)c1)[C@H]1CCCO1	ZINC000182280826	323539313	/nfs/dbraw/zinc/53/93/13/323539313.db2.gz	ZUIAHMFWCSABCL-KNXALSJPSA-N	0	3	335.835	3.086	20	30		EGEDHN
C[C@@H]1C[C@@H](Nc2cc(Br)c(C#N)cc2F)CCN1C	ZINC000388242094	324273016	/nfs/dbraw/zinc/27/30/16/324273016.db2.gz	VPPWFSWDDQNDOE-KOLCDFICSA-N	0	3	326.213	3.354	20	30		EGEDHN
N#C[C@H]1CC[C@@H](NCc2cccc(I)c2)C1	ZINC000309556462	456575931	/nfs/dbraw/zinc/57/59/31/456575931.db2.gz	HUEWNWSMHWDDQJ-GXFFZTMASA-N	0	3	326.181	3.073	20	30		EGEDHN
N#Cc1cnc2c(Cl)cccc2c1N1CCN(CC2CC2)CC1	ZINC000583378097	325518553	/nfs/dbraw/zinc/51/85/53/325518553.db2.gz	HFJLEZQPYSYKNC-UHFFFAOYSA-N	0	3	326.831	3.292	20	30		EGEDHN
CC(C)[C@@H]1CCCC[C@@H]1NC(=O)C(C)S(=O)(=O)C1CCOCC1	ZINC000330046269	456978643	/nfs/dbraw/zinc/97/86/43/456978643.db2.gz	IPBWPQKMKKFVCF-BPUTZDHNSA-N	0	3	345.505	3.140	20	30		EGEDHN
CCS[C@@H]1CCCCN(CC(=O)N(C)C2(C#N)CCCCC2)C1	ZINC000350950328	457212651	/nfs/dbraw/zinc/21/26/51/457212651.db2.gz	MNQYJMUAFSBPIK-MRXNPFEDSA-N	0	3	337.533	3.279	20	30		EGEDHN
C=CCN1CCC(NC(=O)C[C@H](C)Cc2ccccc2OC)CC1	ZINC000264470717	455220276	/nfs/dbraw/zinc/22/02/76/455220276.db2.gz	SSJXTOKYZZTZOM-MRXNPFEDSA-N	0	3	330.472	3.031	20	30		EGEDHN
N#CCCCOc1cccc(CNCc2ccnc(-n3cccn3)c2)c1	ZINC000237824874	455223290	/nfs/dbraw/zinc/22/32/90/455223290.db2.gz	QGJGJKWZEFUICQ-UHFFFAOYSA-N	0	3	347.422	3.240	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cn(C)nc2C2CCCCC2)CC1	ZINC000264504885	455225764	/nfs/dbraw/zinc/22/57/64/455225764.db2.gz	RFGQLMPPKNAXNX-UHFFFAOYSA-N	0	3	344.503	3.238	20	30		EGEDHN
CCC[C@@H](C)NC(=O)[C@H]1CCCN(Cc2ccc(OCC#N)cc2)C1	ZINC000264520528	455229200	/nfs/dbraw/zinc/22/92/00/455229200.db2.gz	ABKHCONBMJBJMM-AEFFLSMTSA-N	0	3	343.471	3.106	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N1CCS[C@@H](C)CC1)C(C)C	ZINC000495050374	458788555	/nfs/dbraw/zinc/78/85/55/458788555.db2.gz	URVISIKADVCXOB-IRXDYDNUSA-N	0	3	339.549	3.222	20	30		EGEDHN
C=CCOCCN[C@@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1	ZINC000559248243	459245244	/nfs/dbraw/zinc/24/52/44/459245244.db2.gz	PIRPTMUQEDIAQC-MRXNPFEDSA-N	0	3	329.362	3.199	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CCS[C@H](C)[C@@H]1C)C(C)C	ZINC000605349498	460568971	/nfs/dbraw/zinc/56/89/71/460568971.db2.gz	YOZXRKJXHFGGTN-GVDBMIGSSA-N	0	3	339.549	3.220	20	30		EGEDHN
C=CCOCCNCc1c[nH]nc1-c1ccc(Br)s1	ZINC000623487908	460575798	/nfs/dbraw/zinc/57/57/98/460575798.db2.gz	ZHVBCYDUHGCIPH-UHFFFAOYSA-N	0	3	342.262	3.193	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1CNCc1cc(C)c(Br)cn1	ZINC000623512621	460590762	/nfs/dbraw/zinc/59/07/62/460590762.db2.gz	OVRWJOXUTCGARQ-DOMZBBRYSA-N	0	3	325.250	3.223	20	30		EGEDHN
COCCNc1ccc(-c2cccc(OCCN(C)C)c2)cc1C#N	ZINC000600779266	460600984	/nfs/dbraw/zinc/60/09/84/460600984.db2.gz	SMUXJJDRXJWAKH-UHFFFAOYSA-N	0	3	339.439	3.224	20	30		EGEDHN
C=CCCOCC(=O)Nc1ccc(OCCN2CCCC2)c(C)c1	ZINC000605560813	460604293	/nfs/dbraw/zinc/60/42/93/460604293.db2.gz	WYXWWFGAFSPWBU-UHFFFAOYSA-N	0	3	332.444	3.001	20	30		EGEDHN
CC(C)[C@H](NC[C@H](O)COc1ccc(C#N)cc1)c1ccc(F)cc1	ZINC000023678042	453715048	/nfs/dbraw/zinc/71/50/48/453715048.db2.gz	CZATWODAYBBWGI-ICSRJNTNSA-N	0	3	342.414	3.424	20	30		EGEDHN
O=C(CN1CCCCCC1)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000025407496	453769506	/nfs/dbraw/zinc/76/95/06/453769506.db2.gz	QVMZGQKFDIEIIN-UHFFFAOYSA-N	0	3	338.373	3.049	20	30		EGEDHN
C[C@@H](NCCN(C)C(=O)OC(C)(C)C)c1ccc(OCC#N)cc1	ZINC000181659640	455368342	/nfs/dbraw/zinc/36/83/42/455368342.db2.gz	JZWDFHLYHCAGOZ-CQSZACIVSA-N	0	3	333.432	3.106	20	30		EGEDHN
N#Cc1ccc(CCC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)cc1	ZINC000031564907	453849602	/nfs/dbraw/zinc/84/96/02/453849602.db2.gz	ALPLHYOUTLZZGI-NRFANRHFSA-N	0	3	347.462	3.272	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCCN(c3ccc(C#N)cc3F)C2)cc1	ZINC000068991310	454070899	/nfs/dbraw/zinc/07/08/99/454070899.db2.gz	CQTVMGMFUPJICS-GOSISDBHSA-N	0	3	334.398	3.328	20	30		EGEDHN
C#CCN1CCC(C(=O)NCC(C)(C)c2cccc(Cl)c2)CC1	ZINC000069047192	454075471	/nfs/dbraw/zinc/07/54/71/454075471.db2.gz	OPVMGSBALIQLKR-UHFFFAOYSA-N	0	3	332.875	3.079	20	30		EGEDHN
COc1ccc(CN(C[C@@H]2CCCO2)[C@H]2CCSC2)cc1C#N	ZINC000245912002	455397440	/nfs/dbraw/zinc/39/74/40/455397440.db2.gz	RIIXKMGOBHHTLB-IRXDYDNUSA-N	0	3	332.469	3.053	20	30		EGEDHN
C#CCN(CCc1nc2ccccc2c(=O)[nH]1)[C@@H]1CCc2ccccc21	ZINC000077328634	454091989	/nfs/dbraw/zinc/09/19/89/454091989.db2.gz	MNSWZOLZHSPMFQ-HXUWFJFHSA-N	0	3	343.430	3.088	20	30		EGEDHN
N#Cc1ccc(Nc2cccc(N3CCN(CC4CC4)CC3)c2)nc1	ZINC000057150904	454106576	/nfs/dbraw/zinc/10/65/76/454106576.db2.gz	ZQKZROSWIJCQFE-UHFFFAOYSA-N	0	3	333.439	3.229	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H]2CC(C)(C)Cc3oc(C)cc32)CC1	ZINC000057172765	454108654	/nfs/dbraw/zinc/10/86/54/454108654.db2.gz	UNLUMLHOTQGSML-KRWDZBQOSA-N	0	3	328.456	3.063	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)C2(C#N)CCCCC2)N(C)C)cc1	ZINC000057383303	454124184	/nfs/dbraw/zinc/12/41/84/454124184.db2.gz	WBYTVAZLIFXRDK-SFHVURJKSA-N	0	3	327.472	3.442	20	30		EGEDHN
CC(C)(C)[C@H](NCC(=O)NCC#N)c1cccc(C(F)(F)F)c1	ZINC000181972643	455406945	/nfs/dbraw/zinc/40/69/45/455406945.db2.gz	ZXXXYLADKWIARW-CQSZACIVSA-N	0	3	327.350	3.022	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NC[C@@H](Cc1ccccc1)N(C)C	ZINC000045053478	454135682	/nfs/dbraw/zinc/13/56/82/454135682.db2.gz	AZOCDGAFQBKUDN-GOSISDBHSA-N	0	3	338.451	3.154	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1ccc([N+](=O)[O-])s1)C(C)C	ZINC000078397479	454247014	/nfs/dbraw/zinc/24/70/14/454247014.db2.gz	XXTKBQQJKCUULC-CYBMUJFWSA-N	0	3	337.445	3.085	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(Oc3ccc(C)cn3)cc2)CC1	ZINC000072282029	454281881	/nfs/dbraw/zinc/28/18/81/454281881.db2.gz	CCUKMCLRFJXYQD-UHFFFAOYSA-N	0	3	349.434	3.466	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)c1cc2ccccc2[nH]1	ZINC000047011633	454318554	/nfs/dbraw/zinc/31/85/54/454318554.db2.gz	ZLGQFGRJGHTFSE-UHFFFAOYSA-N	0	3	346.434	3.244	20	30		EGEDHN
C[C@H](C(=O)N(CCC#N)c1ccccc1)N(C)CCC1CCOCC1	ZINC000120571747	454320710	/nfs/dbraw/zinc/32/07/10/454320710.db2.gz	KPTUBEYOWGKXNP-QGZVFWFLSA-N	0	3	343.471	3.070	20	30		EGEDHN
C[C@H]1C[C@@H](N(C)C(=O)C2(C#N)CCC2)CCN1Cc1ccccc1	ZINC000132304177	454328211	/nfs/dbraw/zinc/32/82/11/454328211.db2.gz	OOROTCVQSLKIAV-WMZOPIPTSA-N	0	3	325.456	3.192	20	30		EGEDHN
CCN(Cc1ccccc1C)C[C@H](O)COc1ccc(CC#N)cc1	ZINC000078875947	454331337	/nfs/dbraw/zinc/33/13/37/454331337.db2.gz	MRIVRZFPVUTJLH-FQEVSTJZSA-N	0	3	338.451	3.323	20	30		EGEDHN
N#Cc1ccc(NC(=O)N2CCN(CC3CCCCC3)CC2)cc1	ZINC000064130755	454468119	/nfs/dbraw/zinc/46/81/19/454468119.db2.gz	WXGYTINJUYSKPO-UHFFFAOYSA-N	0	3	326.444	3.288	20	30		EGEDHN
Cc1noc([C@@H]2CCCN(Cc3cccc(OCCCC#N)c3)C2)n1	ZINC000091832550	454478618	/nfs/dbraw/zinc/47/86/18/454478618.db2.gz	HHALAPIWOYJYMM-QGZVFWFLSA-N	0	3	340.427	3.440	20	30		EGEDHN
COc1ccc(C#N)cc1NC(=O)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000064534687	454489419	/nfs/dbraw/zinc/48/94/19/454489419.db2.gz	GETGRSCMLJWTHY-GOSISDBHSA-N	0	3	349.434	3.418	20	30		EGEDHN
N#CC(C(=O)Nc1ccccn1)C(=O)c1cc2c(s1)CCCCC2	ZINC000102387416	454503002	/nfs/dbraw/zinc/50/30/02/454503002.db2.gz	ZDCWSVUHPFVZRL-ZDUSSCGKSA-N	0	3	339.420	3.373	20	30		EGEDHN
CC(C)N1CCN(c2ccc(C(=O)Nc3ccccc3C#N)cc2)CC1	ZINC000102830862	454522269	/nfs/dbraw/zinc/52/22/69/454522269.db2.gz	FENGUGWAMZSYLB-UHFFFAOYSA-N	0	3	348.450	3.341	20	30		EGEDHN
C=CCSCCNC(=O)N[C@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000080104209	454533456	/nfs/dbraw/zinc/53/34/56/454533456.db2.gz	VOFHXMKRYDEZLE-AEFFLSMTSA-N	0	3	347.528	3.258	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)NCCCCC#N)CCN1Cc1ccccc1	ZINC000080115870	454536345	/nfs/dbraw/zinc/53/63/45/454536345.db2.gz	XQPSVMIZNWRMRY-SJLPKXTDSA-N	0	3	328.460	3.033	20	30		EGEDHN
CN(C)Cc1ccc(CNC(=O)CSc2ccc(C#N)cc2)cc1	ZINC000103185996	454542216	/nfs/dbraw/zinc/54/22/16/454542216.db2.gz	LKNMKJMWQTYIPV-UHFFFAOYSA-N	0	3	339.464	3.028	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cnn(C(C)C)c1C)C(C)C	ZINC000092457537	454569408	/nfs/dbraw/zinc/56/94/08/454569408.db2.gz	XIRAQKNWOHHSDF-SFHVURJKSA-N	0	3	332.492	3.201	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(OC(F)F)c(Cl)c2)CC1	ZINC000050026613	454569501	/nfs/dbraw/zinc/56/95/01/454569501.db2.gz	IBYRBRIOYCCKRK-UHFFFAOYSA-N	0	3	342.773	3.225	20	30		EGEDHN
CC1CCN([C@@H](CNC(=O)C2(C#N)CCC2)c2ccccc2)CC1	ZINC000134661609	454574682	/nfs/dbraw/zinc/57/46/82/454574682.db2.gz	BTTQHKSUWLTAPS-SFHVURJKSA-N	0	3	325.456	3.270	20	30		EGEDHN
C=CCOCCCC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000074448196	454583185	/nfs/dbraw/zinc/58/31/85/454583185.db2.gz	XXDOOAWKNFNJGF-LJQANCHMSA-N	0	3	330.472	3.092	20	30		EGEDHN
CN(C(=O)c1cccc(C#N)c1)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000074447498	454583358	/nfs/dbraw/zinc/58/33/58/454583358.db2.gz	OJLHTDKHINHEIK-HXUWFJFHSA-N	0	3	333.435	3.295	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1	ZINC000135170360	454640713	/nfs/dbraw/zinc/64/07/13/454640713.db2.gz	OVAXUODHOCJQIF-FQEVSTJZSA-N	0	3	330.472	3.432	20	30		EGEDHN
CC(C)C(=O)NC[C@H]1CCCN(Cc2ccccc2C(C)(C)C#N)C1	ZINC000135174982	454641920	/nfs/dbraw/zinc/64/19/20/454641920.db2.gz	MZGIPGUAVDPOKV-QGZVFWFLSA-N	0	3	341.499	3.472	20	30		EGEDHN
N#Cc1ccsc1C(=O)NC[C@H]1CCCN(Cc2cccs2)C1	ZINC000052050678	454652116	/nfs/dbraw/zinc/65/21/16/454652116.db2.gz	ZULGTZZCAOJILB-CYBMUJFWSA-N	0	3	345.493	3.323	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)COc2cccc(C(C)C)c2)CC1	ZINC000106037640	454674681	/nfs/dbraw/zinc/67/46/81/454674681.db2.gz	ZDLDARLYOLIZAK-UHFFFAOYSA-N	0	3	330.472	3.346	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(N3CCC(C)=N3)cc2)CC1	ZINC000106036423	454674756	/nfs/dbraw/zinc/67/47/56/454674756.db2.gz	YHBPFYHLECISJV-UHFFFAOYSA-N	0	3	340.471	3.043	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(F)c(F)c(F)c2F)CC1	ZINC000106037244	454674940	/nfs/dbraw/zinc/67/49/40/454674940.db2.gz	BJSIADADMGCWAM-UHFFFAOYSA-N	0	3	330.325	3.013	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccn(-c3ccccc3)n2)CC1	ZINC000106317780	454690638	/nfs/dbraw/zinc/69/06/38/454690638.db2.gz	SBJNKEXIIAZDFP-UHFFFAOYSA-N	0	3	339.443	3.034	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC[C@@H](CC)Oc2ccccc2C)CC1	ZINC000176159242	454706457	/nfs/dbraw/zinc/70/64/57/454706457.db2.gz	DJZQQZXCMMNXDS-GOSISDBHSA-N	0	3	345.487	3.102	20	30		EGEDHN
CN(C)CCN(C)C(=O)c1ccc(Sc2ccccc2C#N)cc1	ZINC000176378861	454736993	/nfs/dbraw/zinc/73/69/93/454736993.db2.gz	QTAVBRCNVXIZEN-UHFFFAOYSA-N	0	3	339.464	3.343	20	30		EGEDHN
C=CCOc1ccc(CN2CC[C@H](Cc3cnn(C)c3)C2)cc1OC	ZINC000093870299	454743472	/nfs/dbraw/zinc/74/34/72/454743472.db2.gz	QOHGUOMBJHPIRL-QGZVFWFLSA-N	0	3	341.455	3.058	20	30		EGEDHN
N#CCOc1ccc(CNCc2c[nH]nc2-c2ccccc2F)cc1	ZINC000176495523	454752080	/nfs/dbraw/zinc/75/20/80/454752080.db2.gz	RVUNANAZGBNJCB-UHFFFAOYSA-N	0	3	336.370	3.408	20	30		EGEDHN
C=C(C)COc1cccc(NC(=O)N[C@@H]2CCN(CC3CC3)C2)c1	ZINC000108514063	454801248	/nfs/dbraw/zinc/80/12/48/454801248.db2.gz	WVEYTTIKKNGGJB-QGZVFWFLSA-N	0	3	329.444	3.247	20	30		EGEDHN
C[C@H](C#N)CSc1ccccc1NC(=O)NC[C@@H]1CCCN(C)C1	ZINC000108528526	454801840	/nfs/dbraw/zinc/80/18/40/454801840.db2.gz	KPJAWWGLSFXISM-CABCVRRESA-N	0	3	346.500	3.402	20	30		EGEDHN
N#CC(=C([O-])c1cnn2c1CCCC2)c1ccc(C(F)(F)F)cn1	ZINC000125580740	454833153	/nfs/dbraw/zinc/83/31/53/454833153.db2.gz	QNECCTQXPORKCD-LLVKDONJSA-N	0	3	334.301	3.123	20	30		EGEDHN
N#CC(C(=O)c1cnn2c1CCCC2)c1ccc(C(F)(F)F)cn1	ZINC000125580740	454833158	/nfs/dbraw/zinc/83/31/58/454833158.db2.gz	QNECCTQXPORKCD-LLVKDONJSA-N	0	3	334.301	3.123	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)c2ccc(C#N)cc2)N2CCCC2)cc1	ZINC000143266123	454841858	/nfs/dbraw/zinc/84/18/58/454841858.db2.gz	IZSUICXCVZKKIN-FQEVSTJZSA-N	0	3	333.435	3.434	20	30		EGEDHN
C=CC1CCN(CC(=O)N(Cc2ccc(OC)cc2)C2CC2)CC1	ZINC000111257753	454858675	/nfs/dbraw/zinc/85/86/75/454858675.db2.gz	ZANIOPCIYMFKQS-UHFFFAOYSA-N	0	3	328.456	3.084	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)COc2ccc3c(c2)CCCC3)CC1	ZINC000164417414	454882189	/nfs/dbraw/zinc/88/21/89/454882189.db2.gz	PTXQGPZXTPZFRG-UHFFFAOYSA-N	0	3	342.483	3.101	20	30		EGEDHN
C[C@@H](N[C@H]1CCN(C(=O)C2CCCCC2)C1)c1ccc(C#N)cc1	ZINC000151058685	454931492	/nfs/dbraw/zinc/93/14/92/454931492.db2.gz	NKXSRGFJAVZTJX-BEFAXECRSA-N	0	3	325.456	3.390	20	30		EGEDHN
C[C@H](c1ccncc1)N1CCC(NC(=O)C2(C#N)CCCCC2)CC1	ZINC000155663302	455028681	/nfs/dbraw/zinc/02/86/81/455028681.db2.gz	HECMHHMEWJCEDX-MRXNPFEDSA-N	0	3	340.471	3.197	20	30		EGEDHN
C[C@H](NCC1(c2cccs2)CCCCC1)C(=O)N(C)CCC#N	ZINC000151841408	455038717	/nfs/dbraw/zinc/03/87/17/455038717.db2.gz	YJSILEIJHBSJNX-HNNXBMFYSA-N	0	3	333.501	3.300	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCc3ccc(Cl)cc32)CC1	ZINC000171607237	455079990	/nfs/dbraw/zinc/07/99/90/455079990.db2.gz	FHFKDPJCEDSFHV-UHFFFAOYSA-N	0	3	333.863	3.453	20	30		EGEDHN
C=CCN(CCc1ccccc1)CCn1cnc2ccccc2c1=O	ZINC000117336936	455083861	/nfs/dbraw/zinc/08/38/61/455083861.db2.gz	PFOIWBUBKGSGRD-UHFFFAOYSA-N	0	3	333.435	3.127	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@H](C)Oc2ccc(Cl)c(C)c2)CC1	ZINC000171717737	455088649	/nfs/dbraw/zinc/08/86/49/455088649.db2.gz	JKOSTEYZSUPNGW-AWEZNQCLSA-N	0	3	336.863	3.182	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCc2ccc(C(C)(C)C)cc2)CC1	ZINC000171728140	455089766	/nfs/dbraw/zinc/08/97/66/455089766.db2.gz	OGWTUXFKRLWLNL-UHFFFAOYSA-N	0	3	329.488	3.434	20	30		EGEDHN
CC(C)(CCC#N)CN1CCCN(C(=O)c2ccc(F)cc2)CC1	ZINC000128924684	455092423	/nfs/dbraw/zinc/09/24/23/455092423.db2.gz	DBLODRZRLQICKU-UHFFFAOYSA-N	0	3	331.435	3.304	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C[C@@H]2CCOc3ccccc32)CC1	ZINC000117793466	455094092	/nfs/dbraw/zinc/09/40/92/455094092.db2.gz	BAEGEUHBXMSZRX-INIZCTEOSA-N	0	3	328.456	3.100	20	30		EGEDHN
CCCCNC(=O)[C@H]1CC[C@H](C)N(Cc2cc(C#N)ccc2OC)C1	ZINC000156359767	455108934	/nfs/dbraw/zinc/10/89/34/455108934.db2.gz	ZODFPCYJFKEHLP-RDJZCZTQSA-N	0	3	343.471	3.084	20	30		EGEDHN
C#CCOc1ccc([C@H](C)NCc2ccc(C(=O)NCC)cc2)cc1	ZINC000156499245	455125427	/nfs/dbraw/zinc/12/54/27/455125427.db2.gz	GGDIMJJACNCMEK-INIZCTEOSA-N	0	3	336.435	3.299	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)Nc2cccc(C#N)c2)CN1Cc1ccccc1	ZINC000152595188	455140756	/nfs/dbraw/zinc/14/07/56/455140756.db2.gz	MMIGBXKMGNAEFF-KXBFYZLASA-N	0	3	334.423	3.343	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCC(C)(C)c2cccc(F)c2)CC1	ZINC000172476758	455156249	/nfs/dbraw/zinc/15/62/49/455156249.db2.gz	ULSGWBUDLHXVIL-UHFFFAOYSA-N	0	3	333.451	3.053	20	30		EGEDHN
CN(C)CCN(CC1CCCCC1)C(=O)c1cccc(CC#N)c1	ZINC000264229779	455195045	/nfs/dbraw/zinc/19/50/45/455195045.db2.gz	JMVIAHGCJGTZFY-UHFFFAOYSA-N	0	3	327.472	3.337	20	30		EGEDHN
COCCc1nc(C)c([C@H](C)NCc2ccc(OCC#N)cc2)s1	ZINC000180560457	455197189	/nfs/dbraw/zinc/19/71/89/455197189.db2.gz	PUYWRXXDZDGAJV-ZDUSSCGKSA-N	0	3	345.468	3.394	20	30		EGEDHN
C=CCOCCCC(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1	ZINC000172918458	455209869	/nfs/dbraw/zinc/20/98/69/455209869.db2.gz	ILEOTYJONBSMPU-LJQANCHMSA-N	0	3	330.472	3.231	20	30		EGEDHN
C=CCOCCCC(=O)NC[C@H]1CCCN(Cc2cccs2)C1	ZINC000172924023	455210754	/nfs/dbraw/zinc/21/07/54/455210754.db2.gz	RZCAIIJGTUKYKS-MRXNPFEDSA-N	0	3	336.501	3.059	20	30		EGEDHN
C=CCC1(C(=O)NCc2ccccc2CN2CCC[C@@H]2CO)CCC1	ZINC000190111941	455280390	/nfs/dbraw/zinc/28/03/90/455280390.db2.gz	CKEMPWSMECHRAB-LJQANCHMSA-N	0	3	342.483	3.006	20	30		EGEDHN
CC(C)(C)[C@H](NCC(=O)N(CCC#N)CCC#N)c1cccc(F)c1	ZINC000181073321	455283611	/nfs/dbraw/zinc/28/36/11/455283611.db2.gz	RIHBTIOEEFNBQO-GOSISDBHSA-N	0	3	344.434	3.158	20	30		EGEDHN
C[C@H]1CSCCN(Cc2cn(C)nc2-c2ccc(C#N)cc2)C1	ZINC000190461545	455323221	/nfs/dbraw/zinc/32/32/21/455323221.db2.gz	OPWZTBVLORZBGQ-CQSZACIVSA-N	0	3	326.469	3.144	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cc(C)ccc1[N+](=O)[O-])C(C)C	ZINC000173715145	455329030	/nfs/dbraw/zinc/32/90/30/455329030.db2.gz	AXOJCDXCBJFVMP-SFHVURJKSA-N	0	3	345.443	3.332	20	30		EGEDHN
Cc1nccn1-c1ccc(CN[C@@H](C)c2ccc(OCC#N)cc2)cn1	ZINC000181540226	455352355	/nfs/dbraw/zinc/35/23/55/455352355.db2.gz	ACTHNURBSGMIJN-HNNXBMFYSA-N	0	3	347.422	3.329	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](N[C@H]3CCCc4ccccc43)C2=O)cc1	ZINC000190616166	455354488	/nfs/dbraw/zinc/35/44/88/455354488.db2.gz	PLAAQQFNPGDTKN-SFTDATJTSA-N	0	3	345.446	3.326	20	30		EGEDHN
N#CCc1ccccc1C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000600995276	460669137	/nfs/dbraw/zinc/66/91/37/460669137.db2.gz	GGYZVGBHQLZTMA-UHFFFAOYSA-N	0	3	347.462	3.190	20	30		EGEDHN
N#CCSCCCN1CCCC[C@H]1CNC(=O)Nc1ccccc1	ZINC000174114995	455360733	/nfs/dbraw/zinc/36/07/33/455360733.db2.gz	FZYDGHQIRFVRIM-KRWDZBQOSA-N	0	3	346.500	3.309	20	30		EGEDHN
CCN(CC)[C@@H](CNCc1cc(C#N)n(C)c1)c1cccc(OC)c1	ZINC000190712025	455371764	/nfs/dbraw/zinc/37/17/64/455371764.db2.gz	GERDXKDMFWDNDZ-FQEVSTJZSA-N	0	3	340.471	3.078	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN(C)[C@H](C)CNC(=O)OC(C)(C)C)cc1	ZINC000245751225	455372651	/nfs/dbraw/zinc/37/26/51/455372651.db2.gz	NVMWOKUSFOTIJF-HUUCEWRRSA-N	0	3	347.459	3.322	20	30		EGEDHN
C[C@H](N[C@H]1CCN(C(=O)C2CCCCC2)C1)c1cccc(C#N)c1	ZINC000181900117	455397118	/nfs/dbraw/zinc/39/71/18/455397118.db2.gz	YEQNRYMMURMNOC-KXBFYZLASA-N	0	3	325.456	3.390	20	30		EGEDHN
COc1cc(C(=O)C(C#N)c2cnc3ccccc3n2)cc(OC)c1C	ZINC000190923218	455406446	/nfs/dbraw/zinc/40/64/46/455406446.db2.gz	FLCIOKMWTOGEIE-AWEZNQCLSA-N	0	3	347.374	3.446	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)N1CC[C@H](COCc2ccccc2)C1	ZINC000266524087	455430855	/nfs/dbraw/zinc/43/08/55/455430855.db2.gz	APZMZVZPVQWWJC-ICSRJNTNSA-N	0	3	342.483	3.114	20	30		EGEDHN
COC1CCC(N(C)CC(=O)Nc2ccccc2SCC#N)CC1	ZINC000266641237	455431718	/nfs/dbraw/zinc/43/17/18/455431718.db2.gz	AUHLTNHKLRGVBJ-UHFFFAOYSA-N	0	3	347.484	3.130	20	30		EGEDHN
C=CCN(CCOC)CCC(=O)Nc1cc(Cl)ccc1Cl	ZINC000191110387	455444277	/nfs/dbraw/zinc/44/42/77/455444277.db2.gz	AKBXQECLPVNUAK-UHFFFAOYSA-N	0	3	331.243	3.456	20	30		EGEDHN
CC[C@H](N[C@@H](C)C(=O)N(CCC#N)c1ccc(F)cc1)[C@@H]1CCCO1	ZINC000182275684	455478266	/nfs/dbraw/zinc/47/82/66/455478266.db2.gz	OYRHHNGWHKURHQ-WBAXXEDZSA-N	0	3	347.434	3.008	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@H](C)c2cn(C)c3ccccc23)CC1	ZINC000185330770	455541437	/nfs/dbraw/zinc/54/14/37/455541437.db2.gz	OBNDTVQYAQKPSR-OAHLLOKOSA-N	0	3	325.456	3.048	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N(CC)Cc1ccccn1)C(C)C	ZINC000267904645	455562166	/nfs/dbraw/zinc/56/21/66/455562166.db2.gz	WUGGUZVCSLLVIV-IBGZPJMESA-N	0	3	344.503	3.312	20	30		EGEDHN
CN(Cc1cn(CCC#N)nc1-c1ccccc1)C[C@H]1CCC[C@H]1O	ZINC000271316729	455594598	/nfs/dbraw/zinc/59/45/98/455594598.db2.gz	XXTUKINBFPHLIS-IEBWSBKVSA-N	0	3	338.455	3.057	20	30		EGEDHN
CC(C)(NC[C@@H](O)c1ccc(C#N)cc1)c1ccccc1[N+](=O)[O-]	ZINC000292272452	455614417	/nfs/dbraw/zinc/61/44/17/455614417.db2.gz	ZRQXLGYCAOSOJI-QGZVFWFLSA-N	0	3	325.368	3.025	20	30		EGEDHN
N#C[C@@H]1CCC[C@@H](NCc2ccc(N3CCC(CO)CC3)cc2)C1	ZINC000185795795	455623052	/nfs/dbraw/zinc/62/30/52/455623052.db2.gz	WWWXSZSMAYYHSC-RTBURBONSA-N	0	3	327.472	3.067	20	30		EGEDHN
CCN(CCC#N)C(=O)CN[C@@H](C)C1(c2ccccc2)CCCC1	ZINC000185949307	455660346	/nfs/dbraw/zinc/66/03/46/455660346.db2.gz	DKJWRQCUIPVEDI-KRWDZBQOSA-N	0	3	327.472	3.239	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCC(C(=O)Nc2ccccc2O)CC1	ZINC000186262283	455728480	/nfs/dbraw/zinc/72/84/80/455728480.db2.gz	ZTARULAMQWLIAO-UHFFFAOYSA-N	0	3	349.434	3.423	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N1CCC[C@@H](CNC(=O)C(C)(C)C)C1	ZINC000249390477	455752790	/nfs/dbraw/zinc/75/27/90/455752790.db2.gz	RIZUFLNELOWTNA-WBVHZDCISA-N	0	3	327.472	3.494	20	30		EGEDHN
CC(C)(C)C[C@@H](NCC(=O)N(CCC#N)CCC#N)c1ccccc1	ZINC000271774776	455754627	/nfs/dbraw/zinc/75/46/27/455754627.db2.gz	OHRMZQPLTFGMAA-GOSISDBHSA-N	0	3	340.471	3.409	20	30		EGEDHN
C[C@@H](NC[C@H]1CN(Cc2ccccc2)CCO1)c1cccc(C#N)c1	ZINC000271785798	455759351	/nfs/dbraw/zinc/75/93/51/455759351.db2.gz	GZPPLVKJQIEDHW-UTKZUKDTSA-N	0	3	335.451	3.110	20	30		EGEDHN
C=C(C)[C@@H](NC[C@@H](O)COCC(F)(F)F)c1ccc(F)c(F)c1	ZINC000292849597	455763793	/nfs/dbraw/zinc/76/37/93/455763793.db2.gz	FXFNUAKHLRODCT-BXUZGUMPSA-N	0	3	339.304	3.111	20	30		EGEDHN
Cc1ccc(OC[C@@H](O)CNC2(c3cccc(C#N)c3)CC2)c(C)c1	ZINC000271814314	455770786	/nfs/dbraw/zinc/77/07/86/455770786.db2.gz	RHYUXLCFBHUFRW-IBGZPJMESA-N	0	3	336.435	3.194	20	30		EGEDHN
CC[C@@H](C)[N-]C(=S)C(C(=O)c1nccs1)[n+]1cccc(C)c1	ZINC000278161055	455774745	/nfs/dbraw/zinc/77/47/45/455774745.db2.gz	CEPOUQIKFJXJAT-GFCCVEGCSA-O	0	3	334.490	3.066	20	30		EGEDHN
C=CCOc1ccc(CN2CCCC[C@@H]2CC(=O)NCC)cc1OC	ZINC000285079606	455786337	/nfs/dbraw/zinc/78/63/37/455786337.db2.gz	MFVNDLKPXJANSM-QGZVFWFLSA-N	0	3	346.471	3.141	20	30		EGEDHN
CCCN(CC(=O)N[C@](C)(C#N)C1CC1)[C@H]1CCc2ccccc2C1	ZINC000250227346	455786597	/nfs/dbraw/zinc/78/65/97/455786597.db2.gz	HHOVNPNFZKHZHV-PZJWPPBQSA-N	0	3	339.483	3.064	20	30		EGEDHN
Cc1ccc(C(=O)NCCN[C@H](C)c2ccc(C#N)c(F)c2)cc1F	ZINC000271912763	455799720	/nfs/dbraw/zinc/79/97/20/455799720.db2.gz	FDVTZHQAAZTDPL-CYBMUJFWSA-N	0	3	343.377	3.226	20	30		EGEDHN
Cc1ccc[n+](C(C(=O)c2nccs2)C(=S)[N-]C(C)(C)C)c1	ZINC000278317437	455815889	/nfs/dbraw/zinc/81/58/89/455815889.db2.gz	TUFKRFFBZUIHHS-UHFFFAOYSA-O	0	3	334.490	3.066	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cccc(OCC(F)(F)F)c2)CC1	ZINC000269263167	455823822	/nfs/dbraw/zinc/82/38/22/455823822.db2.gz	ISMMNIVEAKDRIX-UHFFFAOYSA-N	0	3	342.361	3.008	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](NCc3ccccc3C3CC3)C2=O)cc1	ZINC000616996491	460695010	/nfs/dbraw/zinc/69/50/10/460695010.db2.gz	VGEMKVYYIXJJGF-OAQYLSRUSA-N	0	3	345.446	3.326	20	30		EGEDHN
N#CCCn1cc(CN2CCC(CF)CC2)c(-c2ccncc2)n1	ZINC000294964741	455833419	/nfs/dbraw/zinc/83/34/19/455833419.db2.gz	FDPUWIQUMRDLRY-UHFFFAOYSA-N	0	3	327.407	3.040	20	30		EGEDHN
CC1(C)CC[C@H](CN2CCC(Oc3ccc(C#N)cc3F)CC2)O1	ZINC000285420581	455840901	/nfs/dbraw/zinc/84/09/01/455840901.db2.gz	GMPLNALKYAQQAU-MRXNPFEDSA-N	0	3	332.419	3.498	20	30		EGEDHN
CC[C@@H](C)N1CCN(Cc2ccc(OC)c(OCCCC#N)c2)CC1	ZINC000295325717	455846652	/nfs/dbraw/zinc/84/66/52/455846652.db2.gz	XFGMHRYXLCTIGB-QGZVFWFLSA-N	0	3	345.487	3.294	20	30		EGEDHN
C=CCSCCNC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000194474912	455847710	/nfs/dbraw/zinc/84/77/10/455847710.db2.gz	FLTZNYQYFGBMAB-INIZCTEOSA-N	0	3	336.476	3.073	20	30		EGEDHN
CC[C@@H](NCCNC(=O)c1cccc(OC)c1)c1ccc(C#N)cc1	ZINC000278862874	455850762	/nfs/dbraw/zinc/85/07/62/455850762.db2.gz	WKAPXHBHFLYSOE-LJQANCHMSA-N	0	3	337.423	3.038	20	30		EGEDHN
CC[C@@H](NC[C@H](O)c1ccc(C#N)cc1)c1ccc(OC)c(OC)c1	ZINC000285476965	455853432	/nfs/dbraw/zinc/85/34/32/455853432.db2.gz	OFLCTQARVFBPKL-MSOLQXFVSA-N	0	3	340.423	3.350	20	30		EGEDHN
N#Cc1cc(C(=O)N2CCCN(CC3CCCCC3)CC2)ccc1F	ZINC000278983313	455855305	/nfs/dbraw/zinc/85/53/05/455855305.db2.gz	YRSORADBCWJHBW-UHFFFAOYSA-N	0	3	343.446	3.426	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N(Cc1ccco1)C1CCN(C)CC1)OCC	ZINC000270014887	455857795	/nfs/dbraw/zinc/85/77/95/455857795.db2.gz	BXLPONUAIZOUSA-GOSISDBHSA-N	0	3	334.460	3.074	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C	ZINC000296059540	455868617	/nfs/dbraw/zinc/86/86/17/455868617.db2.gz	GDPVPELOYCFLAL-VHSSKADRSA-N	0	3	346.496	3.306	20	30		EGEDHN
Cc1ccccc1OC[C@@H](O)CN(Cc1ccc(C#N)cc1)C1CC1	ZINC000194956992	455905260	/nfs/dbraw/zinc/90/52/60/455905260.db2.gz	MQIXSRJKMHKFCZ-FQEVSTJZSA-N	0	3	336.435	3.271	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CCc3cc(Cl)ccc3C2)cc1	ZINC000280193079	455912901	/nfs/dbraw/zinc/91/29/01/455912901.db2.gz	YZAZGIUALWEHNT-GOSISDBHSA-N	0	3	349.821	3.479	20	30		EGEDHN
CN(C)CCN(Cc1cccc(F)c1)C(=O)c1ccc(CC#N)cc1	ZINC000270337099	455932031	/nfs/dbraw/zinc/93/20/31/455932031.db2.gz	JPTXOCXUQIDOCL-UHFFFAOYSA-N	0	3	339.414	3.096	20	30		EGEDHN
C#CCCN1CCC(C(=O)Nc2ccccc2Br)CC1	ZINC000270551983	455980937	/nfs/dbraw/zinc/98/09/37/455980937.db2.gz	UTERUEIZUMDXRL-UHFFFAOYSA-N	0	3	335.245	3.123	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)Cc2c(F)cccc2F)CC1	ZINC000296636865	455997552	/nfs/dbraw/zinc/99/75/52/455997552.db2.gz	MGHARHBPMJBRNY-UHFFFAOYSA-N	0	3	337.414	3.147	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N1CC[C@@](C)(COC)C1	ZINC000296834456	456048831	/nfs/dbraw/zinc/04/88/31/456048831.db2.gz	SKKINRMZNWSCJN-MAUKXSAKSA-N	0	3	336.501	3.010	20	30		EGEDHN
CC(C)(C(=O)NC[C@@H]1CCCCN1C1CC1)c1cc(F)cc(C#N)c1	ZINC000287115173	456061820	/nfs/dbraw/zinc/06/18/20/456061820.db2.gz	PIEZFJDMUCVRGM-SFHVURJKSA-N	0	3	343.446	3.108	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)[C@@H](CC)c2cccc(OC)c2)CC1	ZINC000287649038	456075379	/nfs/dbraw/zinc/07/53/79/456075379.db2.gz	KEXYSKOIINJWDO-IBGZPJMESA-N	0	3	345.487	3.438	20	30		EGEDHN
C[C@@H](NC1(c2cccc(C#N)c2)CC1)c1cccc(-n2ccnn2)c1	ZINC000287729759	456076157	/nfs/dbraw/zinc/07/61/57/456076157.db2.gz	PBIDGHPJWJNBBE-OAHLLOKOSA-N	0	3	329.407	3.479	20	30		EGEDHN
CC[C@](C)(C#N)C(=O)N1CC[C@]2(CCN(Cc3ccccc3)C2)C1	ZINC000287982241	456083261	/nfs/dbraw/zinc/08/32/61/456083261.db2.gz	AOCXUPSGWABCJC-UXHICEINSA-N	0	3	325.456	3.051	20	30		EGEDHN
Cc1nccn1CCCN(C)Cc1ccc(Br)cc1C#N	ZINC000287978346	456083448	/nfs/dbraw/zinc/08/34/48/456083448.db2.gz	ZTBIBGIWYVNFMF-UHFFFAOYSA-N	0	3	347.260	3.348	20	30		EGEDHN
C=CC[C@H](CC)NC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000280925338	456084181	/nfs/dbraw/zinc/08/41/81/456084181.db2.gz	FLLNYCJBNCXYBF-SFHVURJKSA-N	0	3	329.488	3.347	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cc3n[nH]cc3c(C)c2)CC1	ZINC000332571970	456092125	/nfs/dbraw/zinc/09/21/25/456092125.db2.gz	DDESZVAVHRYFRX-UHFFFAOYSA-N	0	3	327.432	3.033	20	30		EGEDHN
CC(C)Oc1ccc([C@@H](CNCc2ccc(C#N)o2)N(C)C)cc1	ZINC000288510853	456098526	/nfs/dbraw/zinc/09/85/26/456098526.db2.gz	SYYGJJOFNXZZQI-LJQANCHMSA-N	0	3	327.428	3.331	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCc3cc(Cl)ccc3C2)CC1	ZINC000188682149	456111571	/nfs/dbraw/zinc/11/15/71/456111571.db2.gz	RMJUBFOCEMBITK-UHFFFAOYSA-N	0	3	347.890	3.448	20	30		EGEDHN
Cc1oc(C#N)cc1-c1nc(-c2cccc(OCCN(C)C)c2)no1	ZINC000289041851	456113278	/nfs/dbraw/zinc/11/32/78/456113278.db2.gz	DYBBLCWSTKQTTC-UHFFFAOYSA-N	0	3	338.367	3.117	20	30		EGEDHN
Cc1ccncc1CCCN1CCCN(c2ccccc2C#N)CC1	ZINC000289121197	456116258	/nfs/dbraw/zinc/11/62/58/456116258.db2.gz	NTDMFAWLHNHNAS-UHFFFAOYSA-N	0	3	334.467	3.407	20	30		EGEDHN
C=CCc1cc(CN2CCCC[C@H]2CCC(=O)NC)cc(OC)c1O	ZINC000289618110	456134141	/nfs/dbraw/zinc/13/41/41/456134141.db2.gz	LMFXJMADQWCWHY-KRWDZBQOSA-N	0	3	346.471	3.010	20	30		EGEDHN
C#CCOc1ccc(CNCc2cc(C)nc(N3CCCC3)c2)cc1	ZINC000289684500	456136843	/nfs/dbraw/zinc/13/68/43/456136843.db2.gz	CSSRUEXYEDIJQT-UHFFFAOYSA-N	0	3	335.451	3.292	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N(CC)Cc1ccc(CN(C)C)cc1	ZINC000289813662	456144054	/nfs/dbraw/zinc/14/40/54/456144054.db2.gz	ARXOZOWVZDYFDE-UHFFFAOYSA-N	0	3	334.463	3.321	20	30		EGEDHN
COc1ccc(CN(C)CCOCC2CC2)cc1OCCCC#N	ZINC000271193857	456165528	/nfs/dbraw/zinc/16/55/28/456165528.db2.gz	RDJUVDJOLXCGCK-UHFFFAOYSA-N	0	3	332.444	3.236	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)NC(C)(C)CN(C)Cc1ccccc1	ZINC000281287389	456190192	/nfs/dbraw/zinc/19/01/92/456190192.db2.gz	MLONYEBCPFSYQO-UHFFFAOYSA-N	0	3	325.412	3.100	20	30		EGEDHN
C=CCc1cc(CN[C@@H](CO)Cc2ccc(C)cc2)cc(OC)c1O	ZINC000188989006	456190944	/nfs/dbraw/zinc/19/09/44/456190944.db2.gz	KDSZZBXQXFEEBI-LJQANCHMSA-N	0	3	341.451	3.131	20	30		EGEDHN
COc1ccc(CN2CC[C@@H](C(=O)N(C)c3ccccc3)C2)cc1C#N	ZINC000281342688	456206391	/nfs/dbraw/zinc/20/63/91/456206391.db2.gz	ZJFNXDATJUKGDZ-QGZVFWFLSA-N	0	3	349.434	3.052	20	30		EGEDHN
CN(C)CCOc1ccccc1-c1noc(-c2ccc(CC#N)cc2)n1	ZINC000273745025	456243970	/nfs/dbraw/zinc/24/39/70/456243970.db2.gz	BQEYVTLUKDJMLB-UHFFFAOYSA-N	0	3	348.406	3.410	20	30		EGEDHN
C=C(C)[C@@H](Cc1nc(-c2ccccc2OCCN(C)C)no1)OCC	ZINC000273873506	456247814	/nfs/dbraw/zinc/24/78/14/456247814.db2.gz	NGFKOCPXLVYDFR-QGZVFWFLSA-N	0	3	345.443	3.201	20	30		EGEDHN
C=CCC(C)(C)CNC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000297548514	456247913	/nfs/dbraw/zinc/24/79/13/456247913.db2.gz	ZMHFFSYGKDJNEO-UHFFFAOYSA-N	0	3	342.487	3.234	20	30		EGEDHN
CC(C)(C)[C@](C)(C#N)NC(=O)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000274387989	456257607	/nfs/dbraw/zinc/25/76/07/456257607.db2.gz	ZVLDYPPHQXTQIW-XLIONFOSSA-N	0	3	327.472	3.343	20	30		EGEDHN
COc1ccccc1O[C@@H](C)CNCc1ccc(C#N)c(OC)c1	ZINC000281652201	456284036	/nfs/dbraw/zinc/28/40/36/456284036.db2.gz	KBXZUCUDUKZNEX-AWEZNQCLSA-N	0	3	326.396	3.133	20	30		EGEDHN
C=C[C@H](CO)NCc1cc(Br)c(C)c(Br)c1	ZINC000336695501	456307589	/nfs/dbraw/zinc/30/75/89/456307589.db2.gz	LRMCGLVBUZYTHU-SNVBAGLBSA-N	0	3	349.066	3.157	20	30		EGEDHN
COc1cc(CN[C@@H]2CCO[C@H]2c2ccc(F)c(F)c2)ccc1C#N	ZINC000281797180	456322611	/nfs/dbraw/zinc/32/26/11/456322611.db2.gz	VAKYVFMOXMISIL-MJGOQNOKSA-N	0	3	344.361	3.465	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1nc2cccnc2s1)C(C)C	ZINC000337159278	456332156	/nfs/dbraw/zinc/33/21/56/456332156.db2.gz	ROJCOZYLRGNDIO-HNNXBMFYSA-N	0	3	344.484	3.120	20	30		EGEDHN
COC[C@@]1(CNCc2ccc(C#N)c(C)c2)OCCc2ccccc21	ZINC000352862168	456371458	/nfs/dbraw/zinc/37/14/58/456371458.db2.gz	MOJUWUFQMQCDTP-OAQYLSRUSA-N	0	3	336.435	3.071	20	30		EGEDHN
C=CCOc1cccc(CNCCc2nc(C(=O)OCC)cs2)c1	ZINC000276077214	456384138	/nfs/dbraw/zinc/38/41/38/456384138.db2.gz	FLVXVXNQUZARAV-UHFFFAOYSA-N	0	3	346.452	3.217	20	30		EGEDHN
C[C@H]1CN(CC2CCN(Cc3cccc(C#N)c3F)CC2)C[C@H](C)O1	ZINC000352886256	456389587	/nfs/dbraw/zinc/38/95/87/456389587.db2.gz	GIAPMXPKSBKXMR-HOTGVXAUSA-N	0	3	345.462	3.019	20	30		EGEDHN
C=CCn1c(COc2ccccc2)nnc1SC[C@@H]1CCN(C)C1	ZINC000352929616	456421029	/nfs/dbraw/zinc/42/10/29/456421029.db2.gz	IKFOUTZHDUEFIU-OAHLLOKOSA-N	0	3	344.484	3.087	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)N(C)C[C@@H]1CCCN(C)C1	ZINC000340384655	456429339	/nfs/dbraw/zinc/42/93/39/456429339.db2.gz	BNUFLVIEAARDSM-OAHLLOKOSA-N	0	3	341.480	3.495	20	30		EGEDHN
Cc1sc(NC(=O)C(C#N)Cc2ccc(C#N)cc2)c(C#N)c1C	ZINC000347976761	456433630	/nfs/dbraw/zinc/43/36/30/456433630.db2.gz	ZIBLOHUDJRAMTK-OAHLLOKOSA-N	0	3	334.404	3.429	20	30		EGEDHN
C=CCOCCCN1CCC[C@@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000348039286	456443313	/nfs/dbraw/zinc/44/33/13/456443313.db2.gz	CPWLLSDDXBECSW-QGZVFWFLSA-N	0	3	342.439	3.220	20	30		EGEDHN
C[C@H](CCC#N)[NH+]1CCC(C(=O)Nc2cc(Cl)ccc2[O-])CC1	ZINC000298723353	456526310	/nfs/dbraw/zinc/52/63/10/456526310.db2.gz	USZKRLUXCOKWOY-GFCCVEGCSA-N	0	3	335.835	3.388	20	30		EGEDHN
C[C@H](C(=O)N(C)CCC#N)N1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2	ZINC000282569440	456555844	/nfs/dbraw/zinc/55/58/44/456555844.db2.gz	ZIUHHMJKUBQFDY-OQIJWPOYSA-N	0	3	325.456	3.158	20	30		EGEDHN
COCC[C@@H](N[C@@H](C)C(=O)N(CCC#N)c1ccccc1)C(C)(C)C	ZINC000337857507	456573041	/nfs/dbraw/zinc/57/30/41/456573041.db2.gz	LZDWYQPYATYMEW-FUHWJXTLSA-N	0	3	345.487	3.363	20	30		EGEDHN
COc1cccc(NC(=O)CCNC2(c3cccc(C#N)c3)CC2)c1	ZINC000298971605	456578286	/nfs/dbraw/zinc/57/82/86/456578286.db2.gz	PFWOKXMNMPKSCR-UHFFFAOYSA-N	0	3	335.407	3.174	20	30		EGEDHN
COC(=O)c1ccc(CN[C@H]2CCc3ccc(C#N)cc32)cc1OC	ZINC000353261216	456594863	/nfs/dbraw/zinc/59/48/63/456594863.db2.gz	CNIJKBTWDPCUJE-SFHVURJKSA-N	0	3	336.391	3.131	20	30		EGEDHN
C=CCn1c(-c2cc(C)oc2C)nnc1N1CCN(C)[C@H](C(C)C)C1	ZINC000337916166	456597183	/nfs/dbraw/zinc/59/71/83/456597183.db2.gz	UQCGXOJINBKZTG-KRWDZBQOSA-N	0	3	343.475	3.117	20	30		EGEDHN
CC[C@H](C)N[C@H](CNC(=O)Nc1ccc(C#N)cc1)c1ccco1	ZINC000353328396	456642130	/nfs/dbraw/zinc/64/21/30/456642130.db2.gz	HYAZPRDLHOLYOD-XJKSGUPXSA-N	0	3	326.400	3.402	20	30		EGEDHN
CO[C@@H]1CCCC[C@H]1N[C@@H](C)C(=O)N(CCC#N)c1ccc(F)cc1	ZINC000277083327	456675494	/nfs/dbraw/zinc/67/54/94/456675494.db2.gz	YFEQNQPQIWLINT-BMGDILEWSA-N	0	3	347.434	3.008	20	30		EGEDHN
C=C(C)COc1cccc(NC(=O)N2C[C@H](SC)[C@@H](N(C)C)C2)c1	ZINC000353409999	456683688	/nfs/dbraw/zinc/68/36/88/456683688.db2.gz	WWXUMVKWPXSRFG-IRXDYDNUSA-N	0	3	349.500	3.151	20	30		EGEDHN
COc1ccc(C#N)cc1CN(C)CCCN(C)Cc1ccco1	ZINC000353551671	456752861	/nfs/dbraw/zinc/75/28/61/456752861.db2.gz	VCOUDIMWKGLMBF-UHFFFAOYSA-N	0	3	327.428	3.114	20	30		EGEDHN
Cc1cccc(NC(=O)[C@H](C)N2CCC[C@@H]2[C@H]2COCC[C@H]2O)c1C	ZINC000328829727	456769789	/nfs/dbraw/zinc/76/97/89/456769789.db2.gz	QXZKSEPNWHCEMY-QFHJOOASSA-N	0	3	346.471	3.142	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)NC[C@H](C)N1CCCC[C@@H]1C	ZINC000348571929	456772371	/nfs/dbraw/zinc/77/23/71/456772371.db2.gz	UNQCEXBIVAKVAT-IRXDYDNUSA-N	0	3	345.487	3.314	20	30		EGEDHN
Cc1cccc(NC(=O)[C@H](C)N2CCC[C@@H]2[C@@H]2COCC[C@@]2(C)O)c1	ZINC000328995432	456808714	/nfs/dbraw/zinc/80/87/14/456808714.db2.gz	WIAZCQMRODIAIE-WOGUSJMUSA-N	0	3	346.471	3.223	20	30		EGEDHN
CC(C)n1ncc2cc(C(=O)N[C@H]3CCN(C4CCCC4)C3)cnc21	ZINC000329189981	456851029	/nfs/dbraw/zinc/85/10/29/456851029.db2.gz	RQPQBYBGNNFRBP-INIZCTEOSA-N	0	3	341.459	3.334	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)CCc2cc3ccccc3[nH]c2=O)CCN1C	ZINC000329201017	456852447	/nfs/dbraw/zinc/85/24/47/456852447.db2.gz	VNIVLEATDZPNBR-CZUORRHYSA-N	0	3	327.428	3.312	20	30		EGEDHN
O=C(CC1CCCCC1)NCC(=O)N1CC[C@@H](N2CCCCC2)C1	ZINC000329207689	456853559	/nfs/dbraw/zinc/85/35/59/456853559.db2.gz	BLKMMJKYZYMPJQ-QGZVFWFLSA-N	0	3	335.492	3.000	20	30		EGEDHN
O=C(CCC1CCCC1)NCC(=O)N1CC[C@H](N2CCCCC2)C1	ZINC000329338283	456875651	/nfs/dbraw/zinc/87/56/51/456875651.db2.gz	YPCUFSBVTNBZHP-KRWDZBQOSA-N	0	3	335.492	3.000	20	30		EGEDHN
C[C@H](NC(=O)CC1CCCCC1)C(=O)N1C[C@H](N2CCCC2)C[C@H]1C	ZINC000329405719	456885778	/nfs/dbraw/zinc/88/57/78/456885778.db2.gz	XDEOZVKYGWVTGT-SOLBZPMBSA-N	0	3	349.519	3.387	20	30		EGEDHN
CC[C@H](C)n1ncc(NC(=O)N2CC[C@H]3CCN(C)C[C@H]32)c1C1CC1	ZINC000329408474	456886218	/nfs/dbraw/zinc/88/62/18/456886218.db2.gz	CMDGSXQVRSAWMO-JJRVBVJISA-N	0	3	345.491	3.303	20	30		EGEDHN
CC[C@@H]1C[C@H](C(=O)N[C@@H]2CN(C)C[C@@H]2c2ccccc2)CC(=O)N1	ZINC000329469321	456894692	/nfs/dbraw/zinc/89/46/92/456894692.db2.gz	XKJZQAIAAKVUKL-YLFCFFPRSA-N	0	3	329.444	3.186	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cc(C)n(C(F)F)n1)C(C)C	ZINC000341681940	456897601	/nfs/dbraw/zinc/89/76/01/456897601.db2.gz	GWYBNIRGKHVCJQ-HNNXBMFYSA-N	0	3	340.418	3.015	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2ccc(F)c(C#N)c2)CN1Cc1ccccc1	ZINC000353766336	456898091	/nfs/dbraw/zinc/89/80/91/456898091.db2.gz	GPIYRUNIYJOZDC-KDOFPFPSSA-N	0	3	337.398	3.090	20	30		EGEDHN
CC[C@@H]1CCc2nc(NC(=O)N[C@@H]3CCc4[nH]cnc4C3)sc2C1	ZINC000329522057	456904039	/nfs/dbraw/zinc/90/40/39/456904039.db2.gz	PFRBVWCZCNNRRV-GHMZBOCLSA-N	0	3	345.472	3.265	20	30		EGEDHN
CC[C@@H]1CCc2nc(NC(=O)N[C@@H]3CCc4nc[nH]c4C3)sc2C1	ZINC000329522057	456904042	/nfs/dbraw/zinc/90/40/42/456904042.db2.gz	PFRBVWCZCNNRRV-GHMZBOCLSA-N	0	3	345.472	3.265	20	30		EGEDHN
CCc1c(C)nc2ccccc2c1N1CC[C@H](NC(=O)NC2CC2)C1	ZINC000329542167	456906584	/nfs/dbraw/zinc/90/65/84/456906584.db2.gz	XQSZOHLVMLZPKS-HNNXBMFYSA-N	0	3	338.455	3.350	20	30		EGEDHN
O=C(NCC1(N2CCCCC2)CCOCC1)c1cccnc1C1CC1	ZINC000329571104	456911001	/nfs/dbraw/zinc/91/10/01/456911001.db2.gz	QNXYDKALMQYORF-UHFFFAOYSA-N	0	3	343.471	3.299	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)N[C@@H](C)CN2CCC[C@H](C)C2)cc1	ZINC000345070860	456915935	/nfs/dbraw/zinc/91/59/35/456915935.db2.gz	DCVJRZGZDVVTGG-IRXDYDNUSA-N	0	3	345.487	3.171	20	30		EGEDHN
CN(C)[C@@H](CNC(=O)C[C@H](CC#N)c1ccccc1)Cc1ccccc1	ZINC000353820335	456922716	/nfs/dbraw/zinc/92/27/16/456922716.db2.gz	YEOWPWUSTWWRNN-LEWJYISDSA-N	0	3	349.478	3.363	20	30		EGEDHN
CC(C)N1CCC[C@H](NC(=O)[C@@H]2CCCC[C@@H]2C(=O)N2CCCC2)C1	ZINC000329943767	456964880	/nfs/dbraw/zinc/96/48/80/456964880.db2.gz	HYJPXBRIBRLZOL-KSZLIROESA-N	0	3	349.519	3.245	20	30		EGEDHN
Cn1cc(C(F)(F)F)nc1[C@@H]1CCCN([C@@H]2CC[C@H](C#N)C2)C1	ZINC000339174048	456977426	/nfs/dbraw/zinc/97/74/26/456977426.db2.gz	ISJKWAZUODYJMS-YNEHKIRRSA-N	0	3	326.366	3.311	20	30		EGEDHN
C[C@H](NC(=O)NC[C@@H]1CCC2(CCCCC2)O1)C1=CCN(C)CC1	ZINC000330082014	456982240	/nfs/dbraw/zinc/98/22/40/456982240.db2.gz	GYGHILZEKYRBEF-RDJZCZTQSA-N	0	3	335.492	3.022	20	30		EGEDHN
Cc1cccc(O[C@@H]2CCCC[C@@H]2NCC(=O)NC2CCOCC2)c1	ZINC000330103974	456985742	/nfs/dbraw/zinc/98/57/42/456985742.db2.gz	HGFMQNZREVWGCY-RBUKOAKNSA-N	0	3	346.471	3.410	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@H]([NH2+]Cc3cc([O-])cc(F)c3)C2)c(F)c1	ZINC000349651180	457007050	/nfs/dbraw/zinc/00/70/50/457007050.db2.gz	BVTKJYACLSINJD-INIZCTEOSA-N	0	3	343.377	3.301	20	30		EGEDHN
Cc1nc([C@@H]2CCCOC2)sc1C(=O)N[C@@H]1CCN2CCCC[C@H]12	ZINC000330241517	457009854	/nfs/dbraw/zinc/00/98/54/457009854.db2.gz	IZIQKLONLXPTSW-RBSFLKMASA-N	0	3	349.500	3.277	20	30		EGEDHN
CCCc1nc(C)c(CNC(=O)C(C#N)CCc2ccccc2)o1	ZINC000346501163	457047370	/nfs/dbraw/zinc/04/73/70/457047370.db2.gz	NOZJCMHLHMLJSC-INIZCTEOSA-N	0	3	325.412	3.324	20	30		EGEDHN
C[C@@H](C#N)CN(C)C(=O)NC1CCN([C@@H](C)c2ccccc2)CC1	ZINC000342001574	457053601	/nfs/dbraw/zinc/05/36/01/457053601.db2.gz	IXUZQBGMSXEVLB-HOTGVXAUSA-N	0	3	328.460	3.013	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C)OCC	ZINC000339359254	457066758	/nfs/dbraw/zinc/06/67/58/457066758.db2.gz	OFTHJUBLJISMHO-QUCCMNQESA-N	0	3	344.499	3.481	20	30		EGEDHN
CN(C)C1(CNC(=O)c2cn(CCCC#N)c3ccccc23)CCC1	ZINC000346612769	457079254	/nfs/dbraw/zinc/07/92/54/457079254.db2.gz	LVBJSOYPHOILIG-UHFFFAOYSA-N	0	3	338.455	3.159	20	30		EGEDHN
C=CCOc1cccnc1C(=O)NC[C@H](N[C@@H](C)CC)c1ccco1	ZINC000359569472	457096749	/nfs/dbraw/zinc/09/67/49/457096749.db2.gz	YSDBLWIXXFWWCT-GJZGRUSLSA-N	0	3	343.427	3.099	20	30		EGEDHN
COc1c(C(=O)NCC(C)(C)N2CCC[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000331052469	457125743	/nfs/dbraw/zinc/12/57/43/457125743.db2.gz	JCQLRUYEXLNSDN-CYBMUJFWSA-N	0	3	349.431	3.419	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(F)c(Cl)c1)c1ccc([N+](=O)[O-])cn1	ZINC000359915615	457145442	/nfs/dbraw/zinc/14/54/42/457145442.db2.gz	XOELLQTXEPIQED-SNVBAGLBSA-N	0	3	334.694	3.028	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)c1ccc(C#N)s1)c1ccccc1	ZINC000362899831	457146845	/nfs/dbraw/zinc/14/68/45/457146845.db2.gz	DOWCJDJTVQMBNA-MRXNPFEDSA-N	0	3	327.453	3.433	20	30		EGEDHN
CC(=O)Nc1cc(C(=O)NCCN2CCCC(C)(C)C2)ccc1F	ZINC000331282471	457158685	/nfs/dbraw/zinc/15/86/85/457158685.db2.gz	DDCAXVVJHJHZFP-UHFFFAOYSA-N	0	3	335.423	3.211	20	30		EGEDHN
N#CCCN(CCC#N)C(=O)CN1CCC[C@H]1CCC1CCCCC1	ZINC000362949481	457170044	/nfs/dbraw/zinc/17/00/44/457170044.db2.gz	PEBBOHQAJXLOHA-IBGZPJMESA-N	0	3	344.503	3.467	20	30		EGEDHN
C=CCc1cc(CNC[C@@](C)(CO)c2ccccc2)cc(OC)c1O	ZINC000342212172	457171177	/nfs/dbraw/zinc/17/11/77/457171177.db2.gz	NFQDNQOPDJUJIR-NRFANRHFSA-N	0	3	341.451	3.169	20	30		EGEDHN
C[C@H](C(=O)NCCCN1CCc2ccccc2C1)c1cccc(C#N)c1	ZINC000359980864	457183743	/nfs/dbraw/zinc/18/37/43/457183743.db2.gz	HTGGNZLJZBRJQL-KRWDZBQOSA-N	0	3	347.462	3.226	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@@H]2c2ccc(C)cc2)CC1	ZINC000363009074	457193481	/nfs/dbraw/zinc/19/34/81/457193481.db2.gz	LOTQQJMXLVOQJS-LJQANCHMSA-N	0	3	327.472	3.492	20	30		EGEDHN
Cc1cc(CN(C)C(=O)C(C)C#N)cc(C)c1OCC(F)(F)F	ZINC000347066509	457212895	/nfs/dbraw/zinc/21/28/95/457212895.db2.gz	JXRWKTDIWWWRDC-GFCCVEGCSA-N	0	3	328.334	3.363	20	30		EGEDHN
N#CC(C(=O)c1cc(Cl)cc(Br)c1)c1ccncn1	ZINC000354471652	457244785	/nfs/dbraw/zinc/24/47/85/457244785.db2.gz	OKTSPXMFJMJVHY-LLVKDONJSA-N	0	3	336.576	3.383	20	30		EGEDHN
CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)CCCC#N	ZINC000360348353	457305960	/nfs/dbraw/zinc/30/59/60/457305960.db2.gz	VWFYOXZTVYKHFJ-SFHVURJKSA-N	0	3	327.472	3.269	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2nc3c(s2)C[C@@H](C)CC3)CC1	ZINC000332358877	457355801	/nfs/dbraw/zinc/35/58/01/457355801.db2.gz	WKKIQOPULZWOOM-ZDUSSCGKSA-N	0	3	348.516	3.430	20	30		EGEDHN
CC[C@H](C(=O)N(Cc1cccc(C(F)(F)F)c1)[C@H](C)C#N)N(C)C	ZINC000425091060	457435921	/nfs/dbraw/zinc/43/59/21/457435921.db2.gz	WJSHEZPQMBCDFW-IUODEOHRSA-N	0	3	341.377	3.286	20	30		EGEDHN
Cn1cc([C@H](NCCCOc2ccc(C#N)cc2)c2ccccc2)cn1	ZINC000369906925	457455506	/nfs/dbraw/zinc/45/55/06/457455506.db2.gz	CIHSJTVSSQWSLH-OAQYLSRUSA-N	0	3	346.434	3.440	20	30		EGEDHN
C=CCN1CCC(Nc2c(C#N)cnc3c(F)cc(F)cc32)CC1	ZINC000361017054	457514898	/nfs/dbraw/zinc/51/48/98/457514898.db2.gz	LFAKFXNGWATAFJ-UHFFFAOYSA-N	0	3	328.366	3.447	20	30		EGEDHN
C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)NCCN(CC)C1CC1	ZINC000352695697	457538172	/nfs/dbraw/zinc/53/81/72/457538172.db2.gz	ZVDDJJGAIKLOPW-UHFFFAOYSA-N	0	3	347.507	3.036	20	30		EGEDHN
C=CC[C@@H](CO)CNCc1cnn(-c2ccc(C(F)(F)F)cc2)c1	ZINC000352735635	457569024	/nfs/dbraw/zinc/56/90/24/457569024.db2.gz	DAIBSHQBDMYZEK-CYBMUJFWSA-N	0	3	339.361	3.165	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)CCC(=O)Nc1cc(N)ccc1F	ZINC000425537634	457589892	/nfs/dbraw/zinc/58/98/92/457589892.db2.gz	QMRWWYITKMNDCZ-CYBMUJFWSA-N	0	3	340.402	3.301	20	30		EGEDHN
C=CCC[C@H](NC(=O)N1CCC[C@H]2CN(C)C[C@H]21)c1ccccc1	ZINC000425721917	457635594	/nfs/dbraw/zinc/63/55/94/457635594.db2.gz	AVEAIVYXAUXYGC-GBESFXJTSA-N	0	3	327.472	3.430	20	30		EGEDHN
CN(C)c1cccc(CNCc2cn(C)nc2-c2ccc(C#N)cc2)c1	ZINC000364873549	457710287	/nfs/dbraw/zinc/71/02/87/457710287.db2.gz	QMHVVZMEXYAEHK-UHFFFAOYSA-N	0	3	345.450	3.315	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)c1ccc(C#N)cc1	ZINC000361390500	457715637	/nfs/dbraw/zinc/71/56/37/457715637.db2.gz	GDZWEKUFFWHJKO-OXQOHEQNSA-N	0	3	333.435	3.199	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCCOc1cccc(F)c1	ZINC000433220065	457782460	/nfs/dbraw/zinc/78/24/60/457782460.db2.gz	JRTROTSYTGSJQR-INIZCTEOSA-N	0	3	326.371	3.093	20	30		EGEDHN
COc1cccc(CNC(=O)C(C#N)CCc2ccccc2)c1OC	ZINC000433227397	457784932	/nfs/dbraw/zinc/78/49/32/457784932.db2.gz	RLBHLERWYNEPOA-MRXNPFEDSA-N	0	3	338.407	3.093	20	30		EGEDHN
CN1CCC(CC(=O)N2CCC[C@H]2[C@H](C#N)c2ccccc2)CC1	ZINC000365958899	457785122	/nfs/dbraw/zinc/78/51/22/457785122.db2.gz	AYWQWMMZPQLZSU-MOPGFXCFSA-N	0	3	325.456	3.017	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCCc1cc(F)cc(F)c1	ZINC000433342218	457815732	/nfs/dbraw/zinc/81/57/32/457815732.db2.gz	KDAYQFSPJKBSCB-MRXNPFEDSA-N	0	3	328.362	3.396	20	30		EGEDHN
Cc1cccc2nc(CNC(=O)C(C#N)CCc3ccccc3)cn21	ZINC000433346087	457817228	/nfs/dbraw/zinc/81/72/28/457817228.db2.gz	BNQQOUDUWMZZON-QGZVFWFLSA-N	0	3	332.407	3.032	20	30		EGEDHN
Cc1nc(C)c(CCNC(=O)C(C#N)CCc2ccccc2)s1	ZINC000433356891	457819510	/nfs/dbraw/zinc/81/95/10/457819510.db2.gz	TXIBBKBFZFLNPH-INIZCTEOSA-N	0	3	327.453	3.191	20	30		EGEDHN
C[C@@H]1CN(C[C@H]2CCCN2CCC2(C#N)CCCCC2)C[C@@H](C)O1	ZINC000411193184	457825539	/nfs/dbraw/zinc/82/55/39/457825539.db2.gz	DWGLMIKXVVRMRP-GUDVDZBRSA-N	0	3	333.520	3.424	20	30		EGEDHN
C[C@H](NC(=O)C(C#N)CCc1ccccc1)[C@@H]1COc2ccccc21	ZINC000433389414	457828648	/nfs/dbraw/zinc/82/86/48/457828648.db2.gz	XCTMRYQITQDPQO-WDYCEAGBSA-N	0	3	334.419	3.440	20	30		EGEDHN
Cc1cc(CNCc2cccc(CN3CCO[C@@H](C)C3)c2)ccc1C#N	ZINC000443985849	457834601	/nfs/dbraw/zinc/83/46/01/457834601.db2.gz	ZYUBCEXRUOEYQQ-SFHVURJKSA-N	0	3	349.478	3.377	20	30		EGEDHN
C=CCC[C@H](NCCNS(=O)(=O)c1ccccc1)c1ccccc1	ZINC000358220753	457868515	/nfs/dbraw/zinc/86/85/15/457868515.db2.gz	KUCLAEGUBZTXHG-IBGZPJMESA-N	0	3	344.480	3.262	20	30		EGEDHN
Cc1nn(C)c(C)c1[C@H]1OCC[C@@H]1NCCC1(C#N)CCCCC1	ZINC000411581922	457922456	/nfs/dbraw/zinc/92/24/56/457922456.db2.gz	ZMHSLMZAEJBPHI-WMZOPIPTSA-N	0	3	330.476	3.321	20	30		EGEDHN
CC[C@@H]([NH2+]C1CCN(c2ccc(C#N)cn2)CC1)c1ccccc1[O-]	ZINC000375654991	458007228	/nfs/dbraw/zinc/00/72/28/458007228.db2.gz	KYBZSUUDDKIWBT-GOSISDBHSA-N	0	3	336.439	3.369	20	30		EGEDHN
N#Cc1ccc(NC(=O)CN[C@H](c2ccccc2)C2CCOCC2)cc1	ZINC000362254388	458056195	/nfs/dbraw/zinc/05/61/95/458056195.db2.gz	IGZCHIDUWGLZOT-OAQYLSRUSA-N	0	3	349.434	3.254	20	30		EGEDHN
C=CCC[C@H](NC(=O)NC[C@@]1(N(C)C)CCSC1)c1ccccc1	ZINC000435111931	458094943	/nfs/dbraw/zinc/09/49/43/458094943.db2.gz	UDGIDAKYPNOTOA-HKUYNNGSSA-N	0	3	347.528	3.430	20	30		EGEDHN
N#Cc1ccccc1N1CCCN(CCN2CCc3ccccc32)CC1	ZINC000428226610	458100804	/nfs/dbraw/zinc/10/08/04/458100804.db2.gz	HUNBJKWMIKQTSV-UHFFFAOYSA-N	0	3	346.478	3.133	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@H](NCc3cccc4nccn43)C2)c(F)c1	ZINC000362336993	458113173	/nfs/dbraw/zinc/11/31/73/458113173.db2.gz	RXSPTHXKUJHXOQ-INIZCTEOSA-N	0	3	349.413	3.104	20	30		EGEDHN
C[C@H]1CN(Cc2cccc(OCc3ccccc3C#N)c2)CC[C@H]1O	ZINC000428461745	458150278	/nfs/dbraw/zinc/15/02/78/458150278.db2.gz	JCYYKOAEDRVMJF-HRAATJIYSA-N	0	3	336.435	3.340	20	30		EGEDHN
C[S@@](=O)Cc1ccc(CNC2CC(C#N)(c3ccccc3)C2)cc1	ZINC000376110283	458198241	/nfs/dbraw/zinc/19/82/41/458198241.db2.gz	DBASWOAVBLWOBE-ZSHKSDETSA-N	0	3	338.476	3.279	20	30		EGEDHN
N#CCCCOc1cccc(CN2CCOC3(CCOCC3)CC2)c1	ZINC000372128171	458202046	/nfs/dbraw/zinc/20/20/46/458202046.db2.gz	JQOKTEUMLBKVCY-UHFFFAOYSA-N	0	3	344.455	3.141	20	30		EGEDHN
COc1cccc(CCCN2CC[C@@H](Oc3ccc(C#N)cn3)C2)c1	ZINC000428810134	458216170	/nfs/dbraw/zinc/21/61/70/458216170.db2.gz	XOMFXQHPVMEBEF-LJQANCHMSA-N	0	3	337.423	3.048	20	30		EGEDHN
C=C(C)Cn1c(C)nnc1N(C)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000358800390	458225397	/nfs/dbraw/zinc/22/53/97/458225397.db2.gz	BFPFLFNZUMRLBI-IBGZPJMESA-N	0	3	339.487	3.263	20	30		EGEDHN
C=CC(C)(C)CNC(=O)N1C[C@@H]2CCN(Cc3ccccc3)C[C@H]2C1	ZINC000458993737	458238642	/nfs/dbraw/zinc/23/86/42/458238642.db2.gz	XVYTVBRGSIPPQN-OALUTQOASA-N	0	3	341.499	3.362	20	30		EGEDHN
C=C(CC)CNC(=O)N(Cc1ccncc1)C[C@H]1CCCN1CC	ZINC000459087054	458262509	/nfs/dbraw/zinc/26/25/09/458262509.db2.gz	WKVCJDNCZGIWAQ-GOSISDBHSA-N	0	3	330.476	3.044	20	30		EGEDHN
C=CCC1(C(=O)Nc2ccc(OCCN(C)C)cc2OC)CCC1	ZINC000413939929	458312184	/nfs/dbraw/zinc/31/21/84/458312184.db2.gz	QSZABBFXJDJKMR-UHFFFAOYSA-N	0	3	332.444	3.321	20	30		EGEDHN
COc1ccc([C@@H](CO)CN[C@H](C)c2ccc(C#N)c(F)c2)cc1	ZINC000414177062	458315845	/nfs/dbraw/zinc/31/58/45/458315845.db2.gz	JLCDCFNLSRPQPD-CXAGYDPISA-N	0	3	328.387	3.133	20	30		EGEDHN
C=C(C)CN(Cc1ccc(CO)o1)C(=O)Nc1ccccc1CNC	ZINC000415899887	458335381	/nfs/dbraw/zinc/33/53/81/458335381.db2.gz	KTRRETXHGAYIDU-UHFFFAOYSA-N	0	3	343.427	3.102	20	30		EGEDHN
C=CCN(CCC#N)C(=O)Nc1cc(CN)cc(C(F)(F)F)c1	ZINC000415973447	458335610	/nfs/dbraw/zinc/33/56/10/458335610.db2.gz	QFIYAGRPQGNDDB-UHFFFAOYSA-N	0	3	326.322	3.098	20	30		EGEDHN
CN(C)[C@@H](CC(=O)N[C@@H](C#N)c1ccccc1F)c1ccccc1	ZINC000416152095	458340583	/nfs/dbraw/zinc/34/05/83/458340583.db2.gz	UVAOTMXNJVLWEV-ROUUACIJSA-N	0	3	325.387	3.200	20	30		EGEDHN
C=CCN(C)CCN(CC)CC(=O)Nc1ccccc1C(F)(F)F	ZINC000429696180	458360848	/nfs/dbraw/zinc/36/08/48/458360848.db2.gz	ASFUPWMTDGHWKR-UHFFFAOYSA-N	0	3	343.393	3.084	20	30		EGEDHN
C=C(C)COc1cc(CN[C@@H]2CCN(CC(F)F)C2)ccc1OC	ZINC000418141989	458372531	/nfs/dbraw/zinc/37/25/31/458372531.db2.gz	XMZYKFSNKNJBIA-OAHLLOKOSA-N	0	3	340.414	3.079	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CCC(OC2CCC2)CC1	ZINC000419279717	458380151	/nfs/dbraw/zinc/38/01/51/458380151.db2.gz	DAZZYMBTSZCPTP-SFHVURJKSA-N	0	3	345.483	3.188	20	30		EGEDHN
CC(C)(C)[C@H](CN1CCc2ccccc2C1)Nc1cncc(C#N)n1	ZINC000420604735	458399602	/nfs/dbraw/zinc/39/96/02/458399602.db2.gz	SWKOURJNFLIYTC-SFHVURJKSA-N	0	3	335.455	3.233	20	30		EGEDHN
COc1ccc([C@@H](CN(C)C)NCc2ccc(C#N)c(F)c2)cc1	ZINC000421352626	458412161	/nfs/dbraw/zinc/41/21/61/458412161.db2.gz	DKPNKSYMNIHQAT-LJQANCHMSA-N	0	3	327.403	3.098	20	30		EGEDHN
C=CCC[C@@H](CO)NCC1=Cc2cc(Br)ccc2OC1	ZINC000449702591	458429726	/nfs/dbraw/zinc/42/97/26/458429726.db2.gz	ZFIVBLKFKMRMOV-HNNXBMFYSA-N	0	3	338.245	3.142	20	30		EGEDHN
C=CCS(=O)(=O)CCN[C@@H]1CCC[C@@H]1c1ccc(Cl)cc1	ZINC000373265992	458447282	/nfs/dbraw/zinc/44/72/82/458447282.db2.gz	DFCKTZLXMGDPKH-HZPDHXFCSA-N	0	3	327.877	3.167	20	30		EGEDHN
C[C@@H]1C[C@@H](c2ccccc2)[C@H](C)N1CC(=O)NCc1ccc(C#N)cc1	ZINC000451182225	458468638	/nfs/dbraw/zinc/46/86/38/458468638.db2.gz	INKWDJDUVUDFLM-LLGFUMIMSA-N	0	3	347.462	3.441	20	30		EGEDHN
CC[C@@H]1OCC[C@H]1N[C@@H](C)C(=O)N(CCC#N)c1cc(C)cc(C)c1	ZINC000459780631	458478041	/nfs/dbraw/zinc/47/80/41/458478041.db2.gz	RFUKQTSPLWWFON-UHOSZYNNSA-N	0	3	343.471	3.096	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC000451605920	458482382	/nfs/dbraw/zinc/48/23/82/458482382.db2.gz	LIMREQZWUORYGE-MOPGFXCFSA-N	0	3	338.407	3.351	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC(=O)N(C)[C@@H](C)c1ccc(Cl)cc1	ZINC000451675102	458485278	/nfs/dbraw/zinc/48/52/78/458485278.db2.gz	OSXHQACYAMSPMO-XKQJLSEDSA-N	0	3	336.863	3.183	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1C[C@@H](C)C[C@@H]1c1cccnc1	ZINC000373411845	458485381	/nfs/dbraw/zinc/48/53/81/458485381.db2.gz	HPRZGUQWMJWZQC-MAUKXSAKSA-N	0	3	337.423	3.424	20	30		EGEDHN
CC(C)(C[C@@H]1CCCN([C@@H]2CCc3ccc(C#N)cc32)C1)C(N)=O	ZINC000453271992	458522465	/nfs/dbraw/zinc/52/24/65/458522465.db2.gz	DODPQMHXFGQYOS-MAUKXSAKSA-N	0	3	325.456	3.159	20	30		EGEDHN
CN1C[C@H](NC(=O)c2ccc(C(C)(C)C#N)cc2)[C@@H](c2ccccc2)C1	ZINC000373538338	458523338	/nfs/dbraw/zinc/52/33/38/458523338.db2.gz	UYGZIVOFBHXSMQ-UXHICEINSA-N	0	3	347.462	3.315	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)cc1F	ZINC000453383827	458526374	/nfs/dbraw/zinc/52/63/74/458526374.db2.gz	MUCMLJLDMXKLBC-JKSUJKDBSA-N	0	3	343.362	3.076	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1cccc(OCc2cccc(F)c2)c1	ZINC000424092996	458556907	/nfs/dbraw/zinc/55/69/07/458556907.db2.gz	QENDFOPAMCENMP-GOSISDBHSA-N	0	3	341.386	3.364	20	30		EGEDHN
Cc1ccc(Cc2cnc(NC(=O)[C@@H](N)CCCC#N)s2)cc1F	ZINC000424102830	458558701	/nfs/dbraw/zinc/55/87/01/458558701.db2.gz	RGXAIRPZWPHVFY-HNNXBMFYSA-N	0	3	346.431	3.141	20	30		EGEDHN
CC(C)(C)Cc1nc2cc(NC(=O)[C@@H](N)CCCC#N)ccc2o1	ZINC000424111275	458560851	/nfs/dbraw/zinc/56/08/51/458560851.db2.gz	ACXYPNMCSZIAPG-ZDUSSCGKSA-N	0	3	328.416	3.376	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1cc(F)ccc1SCC(F)F	ZINC000424120367	458563487	/nfs/dbraw/zinc/56/34/87/458563487.db2.gz	GWFATXYPVGRXSH-JTQLQIEISA-N	0	3	331.363	3.143	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC[C@H]2CCCCC2(F)F)CC1	ZINC000454471413	458563765	/nfs/dbraw/zinc/56/37/65/458563765.db2.gz	YLGAEHMRSOTGRS-CQSZACIVSA-N	0	3	329.435	3.152	20	30		EGEDHN
CCOc1ccccc1[C@H](CC(C)C)NC(=O)[C@@H](N)CCCC#N	ZINC000424126460	458565210	/nfs/dbraw/zinc/56/52/10/458565210.db2.gz	PAGCASOBMJWLBX-IRXDYDNUSA-N	0	3	331.460	3.310	20	30		EGEDHN
C[C@@H](NC(=O)[C@@H](N)CCCC#N)c1nc(-c2ccccc2)cs1	ZINC000424137484	458568289	/nfs/dbraw/zinc/56/82/89/458568289.db2.gz	LVZCXKVQQYOZCX-OCCSQVGLSA-N	0	3	328.441	3.008	20	30		EGEDHN
Cc1ccnc(Oc2cc(NC(=O)[C@H](N)CCCC#N)ccc2C)c1	ZINC000424142438	458568898	/nfs/dbraw/zinc/56/88/98/458568898.db2.gz	IFZDUGZZOVMACA-MRXNPFEDSA-N	0	3	338.411	3.450	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1ccc(Cn2cnc3ccccc32)cc1	ZINC000424162419	458575525	/nfs/dbraw/zinc/57/55/25/458575525.db2.gz	WTPXOJORZZBQCS-QGZVFWFLSA-N	0	3	347.422	3.044	20	30		EGEDHN
C[C@@H](C(=O)N1CCN(CC2CCCCC2)CC1)c1cccc(C#N)c1	ZINC000461925456	458579519	/nfs/dbraw/zinc/57/95/19/458579519.db2.gz	HBTZWYRJCVRYLN-QGZVFWFLSA-N	0	3	339.483	3.386	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C(C)(C)Cc2ccc(C#N)cc2)CC1	ZINC000455490009	458602605	/nfs/dbraw/zinc/60/26/05/458602605.db2.gz	PNNPKNXLCVIBGH-UHFFFAOYSA-N	0	3	339.483	3.284	20	30		EGEDHN
C[C@@H](NC(=O)Nc1ccc(CC#N)cc1Cl)C1=CCN(C)CC1	ZINC000455702312	458607403	/nfs/dbraw/zinc/60/74/03/458607403.db2.gz	KYUFOKDGUZSILS-GFCCVEGCSA-N	0	3	332.835	3.178	20	30		EGEDHN
CC(C)N1C[C@H](C)[C@H](NC(=O)Nc2ccc(CC#N)cc2Cl)C1	ZINC000455706716	458607712	/nfs/dbraw/zinc/60/77/12/458607712.db2.gz	QPTSDOQLEZUHRJ-BLLLJJGKSA-N	0	3	334.851	3.256	20	30		EGEDHN
C[C@@H]1C[C@@H](N(C)C(=O)C(C)(C)Cc2ccc(C#N)cc2)CCN1C	ZINC000455734134	458609725	/nfs/dbraw/zinc/60/97/25/458609725.db2.gz	GMLHQKVGYSDCSK-QAPCUYQASA-N	0	3	327.472	3.068	20	30		EGEDHN
CCN1CCCN(C(=O)Nc2ccc(OC(C)(C)C)c(C#N)c2)CC1	ZINC000455789096	458616026	/nfs/dbraw/zinc/61/60/26/458616026.db2.gz	HJSNRQQXYWMLFA-UHFFFAOYSA-N	0	3	344.459	3.295	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc(COCC)cc2)CC1	ZINC000438850458	458622256	/nfs/dbraw/zinc/62/22/56/458622256.db2.gz	HRBRBABDTKFYSM-UHFFFAOYSA-N	0	3	331.460	3.385	20	30		EGEDHN
CN(CCCNC(=O)Nc1cccc(CC#N)c1)Cc1ccccc1	ZINC000455952506	458624115	/nfs/dbraw/zinc/62/41/15/458624115.db2.gz	UAHPWJIUQUHOJW-UHFFFAOYSA-N	0	3	336.439	3.396	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)C1Cc2ccccc2C1)C(C)C	ZINC000431836317	458632183	/nfs/dbraw/zinc/63/21/83/458632183.db2.gz	ZBFZWYHDGULFOM-FQEVSTJZSA-N	0	3	326.484	3.216	20	30		EGEDHN
Cc1cc(N(CCC#N)C(=O)CN[C@@]2(C)CCO[C@H]2C)ccc1Cl	ZINC000494257521	458649830	/nfs/dbraw/zinc/64/98/30/458649830.db2.gz	RPVIICOIZUIDLT-KSSFIOAISA-N	0	3	349.862	3.052	20	30		EGEDHN
CC(C)(CNC(=O)C(C#N)Cc1ccc(C#N)cc1)c1ccccc1	ZINC000470782917	458650814	/nfs/dbraw/zinc/65/08/14/458650814.db2.gz	FKNZHOZTEMJAPT-GOSISDBHSA-N	0	3	331.419	3.335	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)CCOCC1	ZINC000424604539	458677968	/nfs/dbraw/zinc/67/79/68/458677968.db2.gz	HHQXAKNGYQCGTR-IEBWSBKVSA-N	0	3	342.483	3.311	20	30		EGEDHN
Cc1c(C#N)cccc1NC(=O)NC[C@H](Cc1ccccc1)N(C)C	ZINC000432260500	458707456	/nfs/dbraw/zinc/70/74/56/458707456.db2.gz	XVOPVTFRXXPOMH-SFHVURJKSA-N	0	3	336.439	3.161	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)NC[C@H](C)N1CCC[C@H](C)C1	ZINC000463506292	458708240	/nfs/dbraw/zinc/70/82/40/458708240.db2.gz	JAUNNPGEWKLEBM-HOTGVXAUSA-N	0	3	346.471	3.110	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCc1ccc(OC2CCN(C)CC2)cc1	ZINC000424819189	458739595	/nfs/dbraw/zinc/73/95/95/458739595.db2.gz	JHEKOMNITBHHPI-UHFFFAOYSA-N	0	3	330.472	3.378	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](C)CCCC(F)(F)F)CC1	ZINC000494804712	458747294	/nfs/dbraw/zinc/74/72/94/458747294.db2.gz	NBAWJIRXSWADOI-ZDUSSCGKSA-N	0	3	335.414	3.447	20	30		EGEDHN
C=C(C)CN(Cc1ccccc1)C(=O)NC[C@]1(N(C)C)CCSC1	ZINC000471965077	458756737	/nfs/dbraw/zinc/75/67/37/458756737.db2.gz	CDALGEOXZAXIQE-LJQANCHMSA-N	0	3	347.528	3.212	20	30		EGEDHN
C=CCSCCNC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C	ZINC000509172227	458770119	/nfs/dbraw/zinc/77/01/19/458770119.db2.gz	OXWSJMUFVNFYTN-KRWDZBQOSA-N	0	3	347.528	3.212	20	30		EGEDHN
C=CCOc1cccc(NC(=O)N[C@@H](C)CN2CCC[C@@H](C)C2)c1	ZINC000510954711	458777633	/nfs/dbraw/zinc/77/76/33/458777633.db2.gz	YETYTFBMZBMINA-CVEARBPZSA-N	0	3	331.460	3.493	20	30		EGEDHN
C=CCN(Cc1ccccc1F)C(=O)NC[C@@H]1CCCN1CCC	ZINC000511919119	458780652	/nfs/dbraw/zinc/78/06/52/458780652.db2.gz	KMBHCBKYONWUEF-KRWDZBQOSA-N	0	3	333.451	3.398	20	30		EGEDHN
C=CCOc1cccc(CN2CCC(CCN3CCOCC3)CC2)c1	ZINC000512449042	458784474	/nfs/dbraw/zinc/78/44/74/458784474.db2.gz	AVOAFOAKMHTFIW-UHFFFAOYSA-N	0	3	344.499	3.186	20	30		EGEDHN
CN(C(=O)OC(C)(C)C)[C@@H]1CCN(Cc2ccc(CC#N)cc2)C1	ZINC000495032221	458785969	/nfs/dbraw/zinc/78/59/69/458785969.db2.gz	QNAMWPANWODINP-QGZVFWFLSA-N	0	3	329.444	3.194	20	30		EGEDHN
C=CCOCCCN1C[C@@H](C(=O)OC(C)(C)C)[C@H](C(F)(F)F)C1	ZINC000513145397	458790097	/nfs/dbraw/zinc/79/00/97/458790097.db2.gz	SJPWBWQXPLPTEV-CHWSQXEVSA-N	0	3	337.382	3.031	20	30		EGEDHN
C=C[C@@H]1CCCCN1C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000472380358	458792566	/nfs/dbraw/zinc/79/25/66/458792566.db2.gz	HAJOCQVTZQNZIR-RTBURBONSA-N	0	3	327.472	3.259	20	30		EGEDHN
COC(=O)c1ccc(N2CCN(CCCC(C)(C)C#N)[C@@H](C)C2)cc1	ZINC000472435392	458796022	/nfs/dbraw/zinc/79/60/22/458796022.db2.gz	GKZLTPYYQGCHHC-INIZCTEOSA-N	0	3	343.471	3.314	20	30		EGEDHN
C=CCc1cc(CN[C@@H]2COc3cc(F)ccc3C2)cc(OC)c1O	ZINC000514950079	458803755	/nfs/dbraw/zinc/80/37/55/458803755.db2.gz	MCIWUOQXUMHEOF-KRWDZBQOSA-N	0	3	343.398	3.362	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)Cc2ccc(F)c(Cl)c2)CC1	ZINC000432883705	458806314	/nfs/dbraw/zinc/80/63/14/458806314.db2.gz	CNFBQMASGFDOIP-UHFFFAOYSA-N	0	3	339.842	3.271	20	30		EGEDHN
CC#CCN(C)C[C@@H](O)CO[C@@H](c1ccccc1)c1ccccc1C	ZINC000516096884	458814652	/nfs/dbraw/zinc/81/46/52/458814652.db2.gz	LZRKMYOSIWZCEA-IRLDBZIGSA-N	0	3	337.463	3.417	20	30		EGEDHN
COc1cccc(OCCCNCc2ccc(C#N)c(OC)c2)c1	ZINC000440828274	458859071	/nfs/dbraw/zinc/85/90/71/458859071.db2.gz	SKYRSBJYXNKJPY-UHFFFAOYSA-N	0	3	326.396	3.134	20	30		EGEDHN
C=C(C)Cn1c(C(C)C)nnc1N1CCN(C2CCCCC2)CC1	ZINC000549685166	458882680	/nfs/dbraw/zinc/88/26/80/458882680.db2.gz	DTEPBKLFTLIAAX-UHFFFAOYSA-N	0	3	331.508	3.432	20	30		EGEDHN
C[C@@H](NCCOCCC#N)c1ccc(OCc2cccnc2)cc1	ZINC000549925363	458884746	/nfs/dbraw/zinc/88/47/46/458884746.db2.gz	SXLKGBYRVWHXST-MRXNPFEDSA-N	0	3	325.412	3.241	20	30		EGEDHN
CC(C)(C)N1C[C@@H](C(=O)N(CC#N)C2CCCC2)[C@H](C(F)(F)F)C1	ZINC000551342335	458888227	/nfs/dbraw/zinc/88/82/27/458888227.db2.gz	CXNJMFVWVUZWIQ-ZIAGYGMSSA-N	0	3	345.409	3.190	20	30		EGEDHN
N#CCCC1CCN(C[C@@H]2CN(Cc3ccccc3)CCCO2)CC1	ZINC000518765345	458890725	/nfs/dbraw/zinc/89/07/25/458890725.db2.gz	WNWTVQHOKVVRPF-OAQYLSRUSA-N	0	3	341.499	3.293	20	30		EGEDHN
Cc1ccc2c(c1)CC[C@@H]2NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000552226882	458890689	/nfs/dbraw/zinc/89/06/89/458890689.db2.gz	RMSDZFASQXLUJK-RXVVDRJESA-N	0	3	336.435	3.078	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N(C)Cc1ccoc1C)C(C)C	ZINC000519015224	458907879	/nfs/dbraw/zinc/90/78/79/458907879.db2.gz	APFRQXKRVQDHIP-GOSISDBHSA-N	0	3	333.476	3.428	20	30		EGEDHN
CC1CC(C#N)(C(=O)Nc2ccc(OCCN(C)C)c(Cl)c2)C1	ZINC000531555280	458935340	/nfs/dbraw/zinc/93/53/40/458935340.db2.gz	VWESDZQAKFFMHC-UHFFFAOYSA-N	0	3	335.835	3.159	20	30		EGEDHN
CC(C)Sc1ccc([C@H](C)NC[C@H](O)CN(C)CCC#N)cc1	ZINC000577097635	458979484	/nfs/dbraw/zinc/97/94/84/458979484.db2.gz	GHXNLRVJKUTZIS-RDJZCZTQSA-N	0	3	335.517	3.044	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NCc2ccc(C#N)cc2F)C1	ZINC000495916293	459005605	/nfs/dbraw/zinc/00/56/05/459005605.db2.gz	VAEJZGYJNOCJGH-ZBFHGGJFSA-N	0	3	347.434	3.480	20	30		EGEDHN
CCOC(=O)c1csc(C(C#N)C(=O)c2ccc(OC)cc2C)n1	ZINC000442811030	459040814	/nfs/dbraw/zinc/04/08/14/459040814.db2.gz	BMRVYNUPAHUTPV-ZDUSSCGKSA-N	0	3	344.392	3.127	20	30		EGEDHN
C=CCNC(=O)CN[C@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1	ZINC000442829276	459043288	/nfs/dbraw/zinc/04/32/88/459043288.db2.gz	UMPFCNHOOQROOO-ZFWWWQNUSA-N	0	3	326.362	3.233	20	30		EGEDHN
CN1CCC[C@H](CNC(=O)NCC2(C#N)CCC2)[C@@H]1c1cccs1	ZINC000567097455	459047298	/nfs/dbraw/zinc/04/72/98/459047298.db2.gz	ILXGOIZBMRMIHZ-GDBMZVCRSA-N	0	3	346.500	3.124	20	30		EGEDHN
COc1cc(CNC[C@H](C(=O)OC(C)(C)C)C(C)C)ccc1C#N	ZINC000594518738	459076069	/nfs/dbraw/zinc/07/60/69/459076069.db2.gz	KROYSUZVYMZKTO-INIZCTEOSA-N	0	3	332.444	3.270	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2c3c(nc4ccccc42)CCC3)CC1	ZINC000520682571	459083949	/nfs/dbraw/zinc/08/39/49/459083949.db2.gz	BQYZMSDDOGZZIO-UHFFFAOYSA-N	0	3	349.478	3.494	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N1CCSCC[C@@H]1C)C(C)C	ZINC000478763358	459107583	/nfs/dbraw/zinc/10/75/83/459107583.db2.gz	QEQXYDOFYWNKSO-IRXDYDNUSA-N	0	3	339.549	3.222	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CN1C(=O)N2CCC[C@@]2(CCC)C1=O)C(C)C	ZINC000479008052	459117231	/nfs/dbraw/zinc/11/72/31/459117231.db2.gz	VOVIBINRKHJPCV-PXNSSMCTSA-N	0	3	347.503	3.282	20	30		EGEDHN
CC(C#N)C(=O)N[C@H](Cc1cccc(Br)c1)CC1CC1	ZINC000479266834	459130263	/nfs/dbraw/zinc/13/02/63/459130263.db2.gz	OQXUKKVHTMBNAF-NHYWBVRUSA-N	0	3	335.245	3.436	20	30		EGEDHN
O=C(N[C@H]1CCN(C2CC2)C1)c1ccc(C#Cc2ccccc2)cc1	ZINC000521225538	459133316	/nfs/dbraw/zinc/13/33/16/459133316.db2.gz	RQOUKHKJVRURBU-FQEVSTJZSA-N	0	3	330.431	3.053	20	30		EGEDHN
C[C@H](C(=O)Nc1cccc(C#N)c1)N1CC[C@H](Cc2ccccc2)C1	ZINC000532971124	459168762	/nfs/dbraw/zinc/16/87/62/459168762.db2.gz	ACLOUUKIVKVZIK-VQIMIIECSA-N	0	3	333.435	3.450	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@H](N[C@@H]1CC(=O)N(c3ccccc3F)C1)CC2	ZINC000521712187	459172978	/nfs/dbraw/zinc/17/29/78/459172978.db2.gz	RWFGFKSWDWIFHO-CRAIPNDOSA-N	0	3	335.382	3.080	20	30		EGEDHN
C=CCCSCCNCc1cn(C)nc1-c1ccc(C#N)cc1	ZINC000594960180	459194137	/nfs/dbraw/zinc/19/41/37/459194137.db2.gz	MJKZISGIMGQJIR-UHFFFAOYSA-N	0	3	326.469	3.358	20	30		EGEDHN
CO[C@](C)(CNCc1cc(C#N)cs1)COCc1ccccc1	ZINC000594974193	459201547	/nfs/dbraw/zinc/20/15/47/459201547.db2.gz	HVEURHJEJWUPBL-GOSISDBHSA-N	0	3	330.453	3.331	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCC(C)(C)c2ncccc2C)CC1	ZINC000522046551	459207793	/nfs/dbraw/zinc/20/77/93/459207793.db2.gz	AMBCYJDXLDWTJZ-UHFFFAOYSA-N	0	3	344.503	3.007	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)NC[C@@H](CN(C)C)c1ccc(Cl)cc1	ZINC000568040137	459213265	/nfs/dbraw/zinc/21/32/65/459213265.db2.gz	BTOLYUSGHWPDAE-AWEZNQCLSA-N	0	3	345.830	3.188	20	30		EGEDHN
CC[C@H]1CCCN1CC(=O)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000533285617	459213453	/nfs/dbraw/zinc/21/34/53/459213453.db2.gz	HHFZOYZCMLUHCI-INIZCTEOSA-N	0	3	338.373	3.048	20	30		EGEDHN
C[C@H](N[C@H]1CCCc2cc(C#N)ccc21)C(=O)NCCc1ccccc1	ZINC000590779933	459215847	/nfs/dbraw/zinc/21/58/47/459215847.db2.gz	DKDNJUPOHKNHEA-KKSFZXQISA-N	0	3	347.462	3.273	20	30		EGEDHN
N#CC(C(=O)c1ccnn1C1CCCC1)c1cnc2ccccc2n1	ZINC000579785054	459252095	/nfs/dbraw/zinc/25/20/95/459252095.db2.gz	VWZMZJJKLPUCET-CQSZACIVSA-N	0	3	331.379	3.431	20	30		EGEDHN
C[C@H](N[C@H](COC(N)=O)Cc1ccccc1)c1ccc(C#N)c(F)c1	ZINC000496597114	459253555	/nfs/dbraw/zinc/25/35/55/459253555.db2.gz	UAKKYYXROCIYGF-GUYCJALGSA-N	0	3	341.386	3.469	20	30		EGEDHN
CC(C)(CC#N)CNC(=O)N[C@H](CN1CCCCC1)c1ccccc1	ZINC000590925571	459270017	/nfs/dbraw/zinc/27/00/17/459270017.db2.gz	HAODDQPTTOKUEJ-GOSISDBHSA-N	0	3	342.487	3.453	20	30		EGEDHN
CC1CC(C#N)(C(=O)NC[C@@H](CN(C)C)c2ccc(Cl)cc2)C1	ZINC000581552823	459273445	/nfs/dbraw/zinc/27/34/45/459273445.db2.gz	PVBNFYUURWXGFT-DBQDNQAGSA-N	0	3	333.863	3.041	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)N(CCC)CCN1CCCC1	ZINC000496653860	459274228	/nfs/dbraw/zinc/27/42/28/459274228.db2.gz	XWEBGSTTWNRCAM-UHFFFAOYSA-N	0	3	345.487	3.269	20	30		EGEDHN
Cc1ccccc1[C@H]1C[C@@H](C)N(CC(=O)NCc2ccc(C#N)cc2)C1	ZINC000523441470	459303827	/nfs/dbraw/zinc/30/38/27/459303827.db2.gz	UWYBSIGVOVZMQV-XLIONFOSSA-N	0	3	347.462	3.361	20	30		EGEDHN
C/C=C\c1ccc(OC[C@H](O)CN2CCC[C@@H](CC#N)C2)c(OC)c1	ZINC000595609772	459365713	/nfs/dbraw/zinc/36/57/13/459365713.db2.gz	OWSFFRGPPHXKEP-LOTMPPQKSA-N	0	3	344.455	3.094	20	30		EGEDHN
N#CC[C@@H]1CCCN(CCC(=O)N[C@H]2CCCc3ccccc32)C1	ZINC000595612434	459367716	/nfs/dbraw/zinc/36/77/16/459367716.db2.gz	WQKSDEVHJCPIFO-LPHOPBHVSA-N	0	3	325.456	3.196	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1)OCC	ZINC000569090623	459393333	/nfs/dbraw/zinc/39/33/33/459393333.db2.gz	HQTURXGSZXBYJC-SJORKVTESA-N	0	3	338.879	3.430	20	30		EGEDHN
N#Cc1cccc(OCCN2CC[C@H](c3ccccc3)[C@H](CO)C2)c1	ZINC000595747048	459422947	/nfs/dbraw/zinc/42/29/47/459422947.db2.gz	FJWBLKIICHSSBL-PZJWPPBQSA-N	0	3	336.435	3.035	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC(=O)Nc1ccc(Cl)cc1Cl	ZINC000582766907	459423742	/nfs/dbraw/zinc/42/37/42/459423742.db2.gz	ZYVRLKSHEKZKRG-KGLIPLIRSA-N	0	3	329.227	3.255	20	30		EGEDHN
CCc1cccc(OC[C@H](O)CN[C@H]2CCc3cc(C#N)ccc32)c1	ZINC000591763701	459430253	/nfs/dbraw/zinc/43/02/53/459430253.db2.gz	CWAVXYOHYHFTDE-NQIIRXRSSA-N	0	3	336.435	3.137	20	30		EGEDHN
N#Cc1ccc2c(c1)CC[C@H]2NC[C@H](O)COc1ccc(Cl)cc1	ZINC000591763956	459431284	/nfs/dbraw/zinc/43/12/84/459431284.db2.gz	SSOROTVOYHQJLT-QFBILLFUSA-N	0	3	342.826	3.228	20	30		EGEDHN
C[C@H](CCCC(F)(F)F)NCCS(=O)(=O)c1ccc(C#N)cc1	ZINC000591764060	459431547	/nfs/dbraw/zinc/43/15/47/459431547.db2.gz	AIPKNQHOGBYDRW-GFCCVEGCSA-N	0	3	348.390	3.043	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN1CCC([C@@H]2CCCCO2)CC1	ZINC000595790510	459442654	/nfs/dbraw/zinc/44/26/54/459442654.db2.gz	WIEKFRZHIRQXEM-INIZCTEOSA-N	0	3	347.484	3.229	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@@H](NC/C=C\c3ccccc3)C2=O)cc1	ZINC000485257671	459447411	/nfs/dbraw/zinc/44/74/11/459447411.db2.gz	GJDXJUYQRAAGCT-HOKKKISVSA-N	0	3	331.419	3.357	20	30		EGEDHN
COc1ccccc1N(CCC#N)C(=O)[C@H](C)N(C)C[C@@H]1CC1(C)C	ZINC000595912917	459485006	/nfs/dbraw/zinc/48/50/06/459485006.db2.gz	PHPZENMFPHYSIL-HOTGVXAUSA-N	0	3	343.471	3.308	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](Nc2nc(C#N)c(Cl)s2)C1	ZINC000596088601	459516058	/nfs/dbraw/zinc/51/60/58/459516058.db2.gz	LNBQHCCUJURTQA-YPMHNXCESA-N	0	3	332.860	3.337	20	30		EGEDHN
N#CCC1CCN(C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)CC1	ZINC000541976769	459516754	/nfs/dbraw/zinc/51/67/54/459516754.db2.gz	YIXSUCOUFWSMFQ-SFHVURJKSA-N	0	3	343.446	3.190	20	30		EGEDHN
C=CCN(CCc1ccco1)C(=O)N[C@H](C)CN1CCC[C@@H](C)C1	ZINC000497368335	459528738	/nfs/dbraw/zinc/52/87/38/459528738.db2.gz	LDUAKRPAWSFRRE-IAGOWNOFSA-N	0	3	333.476	3.140	20	30		EGEDHN
C[C@@H](c1ccccc1)[C@@H](O)CN1CCC(C#N)(c2ccccn2)CC1	ZINC000569918239	459530293	/nfs/dbraw/zinc/53/02/93/459530293.db2.gz	YMSWLXGGYCFBHL-HKUYNNGSSA-N	0	3	335.451	3.103	20	30		EGEDHN
C=CCCCCCN1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000488180815	459540727	/nfs/dbraw/zinc/54/07/27/459540727.db2.gz	JWBAIFFRHQMLJM-UHFFFAOYSA-N	0	3	336.501	3.176	20	30		EGEDHN
C[C@H](Nc1nc(C#N)c(Cl)s1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000596185937	459553106	/nfs/dbraw/zinc/55/31/06/459553106.db2.gz	HLRWLTDIFOPOAQ-GXTWGEPZSA-N	0	3	346.887	3.413	20	30		EGEDHN
C=C[C@H]1CCCCN1CCC(=O)Nc1cc(OC)c(OC)c(OC)c1	ZINC000489397175	459562913	/nfs/dbraw/zinc/56/29/13/459562913.db2.gz	GSWLNJSRSKLHAZ-HNNXBMFYSA-N	0	3	348.443	3.082	20	30		EGEDHN
CC(C)Cc1ccc([C@@H](CNc2c(C#N)cnn2C)N(C)C)cc1	ZINC000596236099	459570610	/nfs/dbraw/zinc/57/06/10/459570610.db2.gz	PMLHPMYMVOKJNA-GOSISDBHSA-N	0	3	325.460	3.205	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1C[C@H](c2ccc(C)cc2)C[C@H]1C	ZINC000490041022	459576167	/nfs/dbraw/zinc/57/61/67/459576167.db2.gz	YKPHOAUGARKRDV-ZHALLVOQSA-N	0	3	327.472	3.181	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H](C)c2cc3cccc(F)c3o2)CC1	ZINC000490741486	459586240	/nfs/dbraw/zinc/58/62/40/459586240.db2.gz	SBEYPNATWMWHCP-CYBMUJFWSA-N	0	3	328.387	3.094	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@@H](C)N1CCC(c2cccc(OC)c2)CC1	ZINC000498655644	459600390	/nfs/dbraw/zinc/60/03/90/459600390.db2.gz	JSICDXFSUUYGHJ-QGZVFWFLSA-N	0	3	342.483	3.464	20	30		EGEDHN
C[C@H]1C[C@H](c2ccc(F)cc2)CN1Cc1cnc2c(C#N)cnn2c1	ZINC000572961599	459602760	/nfs/dbraw/zinc/60/27/60/459602760.db2.gz	MJHSYVRFJJDCFE-BBRMVZONSA-N	0	3	335.386	3.118	20	30		EGEDHN
CCCN(C(=O)NC[C@H](C)C#N)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000542875472	459605740	/nfs/dbraw/zinc/60/57/40/459605740.db2.gz	JYYHODUMPCPVIV-IEBWSBKVSA-N	0	3	342.487	3.232	20	30		EGEDHN
CCN(Cc1cnc2c(C#N)cnn2c1)[C@H](C)Cc1ccsc1	ZINC000592509062	459617806	/nfs/dbraw/zinc/61/78/06/459617806.db2.gz	HKDCVBLBZHJHHL-CYBMUJFWSA-N	0	3	325.441	3.116	20	30		EGEDHN
C[C@]1(CCc2ccccc2)CCN(Cc2cnc3c(C#N)cnn3c2)C1	ZINC000573121442	459629290	/nfs/dbraw/zinc/62/92/90/459629290.db2.gz	CWRCIFHFKVIABD-NRFANRHFSA-N	0	3	345.450	3.446	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2c3c(ccc2Cl)CC(C)(C)O3)CC1	ZINC000491621530	459640331	/nfs/dbraw/zinc/64/03/31/459640331.db2.gz	OFDOUMDCKGDCJV-UHFFFAOYSA-N	0	3	346.858	3.337	20	30		EGEDHN
C#CCN1CCC(C(=O)NC[C@H]2CCCC[C@H]2c2ccccc2)CC1	ZINC000491622599	459641189	/nfs/dbraw/zinc/64/11/89/459641189.db2.gz	GODNAQLSSNZGBG-RTWAWAEBSA-N	0	3	338.495	3.422	20	30		EGEDHN
Cc1ccc(C[C@@H]2CCCN2CC(=O)NCc2ccc(C#N)cc2)cc1	ZINC000500208718	459670852	/nfs/dbraw/zinc/67/08/52/459670852.db2.gz	FIWQFHVKRJWPAT-NRFANRHFSA-N	0	3	347.462	3.190	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Cc1ccc2c(c1)COC2)C(C)C	ZINC000543586889	459672636	/nfs/dbraw/zinc/67/26/36/459672636.db2.gz	CIMOCMCDMIVTHM-HXUWFJFHSA-N	0	3	342.483	3.074	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NC(=O)N[C@@H](C)[C@@H](c1ccccc1C)N(C)C	ZINC000563064667	459707845	/nfs/dbraw/zinc/70/78/45/459707845.db2.gz	UDVOAHBFQZLXPH-NQYYFHDYSA-N	0	3	345.487	3.019	20	30		EGEDHN
CC(C)N(C(=O)c1cc(C#N)c[nH]1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000592874041	459708433	/nfs/dbraw/zinc/70/84/33/459708433.db2.gz	QSGGXMNZLPCPDS-GOSISDBHSA-N	0	3	336.439	3.011	20	30		EGEDHN
CN(C)[C@@H](CNC(=O)CC1(C#N)CCCCC1)Cc1ccccc1	ZINC000596674591	459723123	/nfs/dbraw/zinc/72/31/23/459723123.db2.gz	JLXJAQXCCQMKJS-GOSISDBHSA-N	0	3	327.472	3.140	20	30		EGEDHN
C[C@H](CCC1CCCCC1)NCCS(=O)(=O)c1ccc(C#N)cn1	ZINC000584464996	459745596	/nfs/dbraw/zinc/74/55/96/459745596.db2.gz	OWOSUHYNJYZFPH-OAHLLOKOSA-N	0	3	349.500	3.066	20	30		EGEDHN
CCC[C@H]1CN(Cc2ccccc2C(C)(C)C#N)CCN1CCOC	ZINC000501797300	459746547	/nfs/dbraw/zinc/74/65/47/459746547.db2.gz	XFXULFDGZAFAPG-IBGZPJMESA-N	0	3	343.515	3.420	20	30		EGEDHN
C[C@H](NC1(C2CCC2)CC1)C(=O)N(CCC#N)c1ccc(F)cc1	ZINC000593080371	459766625	/nfs/dbraw/zinc/76/66/25/459766625.db2.gz	MJMMMFKCJICEED-AWEZNQCLSA-N	0	3	329.419	3.383	20	30		EGEDHN
COc1ccccc1N(CCC#N)C(=O)[C@H](C)NC1(C2CCC2)CC1	ZINC000593083149	459767659	/nfs/dbraw/zinc/76/76/59/459767659.db2.gz	ZOCNGIIIXWCRNL-HNNXBMFYSA-N	0	3	341.455	3.253	20	30		EGEDHN
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCc1ccc(C#N)s1	ZINC000584581637	459772303	/nfs/dbraw/zinc/77/23/03/459772303.db2.gz	NUGZYNRXGRFZMU-CXAGYDPISA-N	0	3	328.437	3.130	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)N2CCCN(C(C)(C)C)CC2)cc1	ZINC000574230586	459793983	/nfs/dbraw/zinc/79/39/83/459793983.db2.gz	ASPCHEOCHAQBEP-UHFFFAOYSA-N	0	3	345.487	3.267	20	30		EGEDHN
CCC(C#N)(CC)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1	ZINC000528807621	459814681	/nfs/dbraw/zinc/81/46/81/459814681.db2.gz	MBHZHIIJEKAVCH-UHFFFAOYSA-N	0	3	343.471	3.159	20	30		EGEDHN
C[C@@H](NCCC(=O)N1CCOc2ccccc21)c1cccc(C#N)c1	ZINC000585816053	459855113	/nfs/dbraw/zinc/85/51/13/459855113.db2.gz	PZHJLIYMTKQQOI-OAHLLOKOSA-N	0	3	335.407	3.025	20	30		EGEDHN
C[C@@H](CNC(=O)CC1(C#N)CCCCC1)N(C)Cc1ccccc1	ZINC000597206194	459877046	/nfs/dbraw/zinc/87/70/46/459877046.db2.gz	MKLAMDBKEVTKDL-KRWDZBQOSA-N	0	3	327.472	3.487	20	30		EGEDHN
COc1ccc(CN(C)CC2=CCCOC2)cc1OCCCC#N	ZINC000597206357	459877101	/nfs/dbraw/zinc/87/71/01/459877101.db2.gz	ODTOSBAMTRXSHP-UHFFFAOYSA-N	0	3	330.428	3.156	20	30		EGEDHN
Cn1nc(CNC2CCN(c3ccc(C#N)cc3)CC2)c2ccccc21	ZINC000608982629	459898587	/nfs/dbraw/zinc/89/85/87/459898587.db2.gz	YFSLULQCKLMJER-UHFFFAOYSA-N	0	3	345.450	3.204	20	30		EGEDHN
N#CC(C(=O)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1)c1ccncn1	ZINC000546153764	459900800	/nfs/dbraw/zinc/90/08/00/459900800.db2.gz	WXMAFVIWGDNCPL-AWEZNQCLSA-N	0	3	347.378	3.137	20	30		EGEDHN
COc1ccc2nc(C3CC3)cc(C(=O)C(C#N)c3ccncn3)c2c1	ZINC000546153547	459901199	/nfs/dbraw/zinc/90/11/99/459901199.db2.gz	NSPKGMFPXSSULR-MRXNPFEDSA-N	0	3	344.374	3.401	20	30		EGEDHN
N#Cc1cnn2cc(CN[C@H](c3ccc(F)cc3)C3CCC3)cnc12	ZINC000609222871	459927061	/nfs/dbraw/zinc/92/70/61/459927061.db2.gz	MFSWPYSINZOAMN-SFHVURJKSA-N	0	3	335.386	3.371	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN(CCO)Cc1ccc(Cl)c(Cl)c1	ZINC000598601238	459959712	/nfs/dbraw/zinc/95/97/12/459959712.db2.gz	RVFDWPDGGAZZAK-CYBMUJFWSA-N	0	3	345.270	3.088	20	30		EGEDHN
C[C@@H](NC1CCN(Cc2cccc(C#N)c2)CC1)c1cscn1	ZINC000593720500	459962800	/nfs/dbraw/zinc/96/28/00/459962800.db2.gz	GFWSJUBVVIJURK-CQSZACIVSA-N	0	3	326.469	3.330	20	30		EGEDHN
Cc1c(Cl)cccc1N1CCCN(C[C@@H](O)CC(C)(C)C#N)CC1	ZINC000598612862	459963239	/nfs/dbraw/zinc/96/32/39/459963239.db2.gz	CGVVUNALNWGORP-INIZCTEOSA-N	0	3	349.906	3.461	20	30		EGEDHN
C[C@@H](CC1(C#N)CCOCC1)NCc1cccc(N2CCCC2=O)c1	ZINC000602510747	459975919	/nfs/dbraw/zinc/97/59/19/459975919.db2.gz	MTJMQGBZJFYRAF-INIZCTEOSA-N	0	3	341.455	3.002	20	30		EGEDHN
CCN(CC)[C@@H](CN[C@@H](C)CC1(C#N)CCOCC1)c1ccco1	ZINC000602525942	459983586	/nfs/dbraw/zinc/98/35/86/459983586.db2.gz	UFCRTTDPGYBENB-IRXDYDNUSA-N	0	3	333.476	3.351	20	30		EGEDHN
Cc1ccc(CNC[C@@H](O)CC(C)(C)C#N)c(OCC(F)(F)F)c1	ZINC000598726646	460007650	/nfs/dbraw/zinc/00/76/50/460007650.db2.gz	UDVTVTXDMMHBCR-AWEZNQCLSA-N	0	3	344.377	3.327	20	30		EGEDHN
N#C[C@@H](NC(=O)[C@H]1CCN(Cc2ccccc2)C1)C1CCCCC1	ZINC000575812605	460009544	/nfs/dbraw/zinc/00/95/44/460009544.db2.gz	NGDGKHYIKLOBEM-RBUKOAKNSA-N	0	3	325.456	3.097	20	30		EGEDHN
C[C@H](CC1(C#N)CCOCC1)NCc1cn(C)nc1-c1ccccc1	ZINC000602602517	460019833	/nfs/dbraw/zinc/01/98/33/460019833.db2.gz	UNUYANQWLCNEDL-MRXNPFEDSA-N	0	3	338.455	3.276	20	30		EGEDHN
CN(Cc1cccc(C#N)n1)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1	ZINC000602615206	460023651	/nfs/dbraw/zinc/02/36/51/460023651.db2.gz	WLFUHBFPWNIYBV-RBUKOAKNSA-N	0	3	325.387	3.444	20	30		EGEDHN
CCCN(CC(=O)Nc1ccc(C#N)cc1)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C	ZINC000610133511	460068419	/nfs/dbraw/zinc/06/84/19/460068419.db2.gz	XZDLXNKJISYGKI-QRQLOZEOSA-N	0	3	341.455	3.022	20	30		EGEDHN
CC(C)(C)c1cnc(C(C#N)C(=O)c2cnc3n2CCCC3)s1	ZINC000576110813	460073275	/nfs/dbraw/zinc/07/32/75/460073275.db2.gz	NTIPZVOPGUWWAF-LLVKDONJSA-N	0	3	328.441	3.463	20	30		EGEDHN
CCOC(=O)c1ccc(C#N)c(SCCN2C[C@H](C)C[C@@H](C)C2)n1	ZINC000576122517	460076199	/nfs/dbraw/zinc/07/61/99/460076199.db2.gz	DQCYQYJRXQAQOL-ZIAGYGMSSA-N	0	3	347.484	3.200	20	30		EGEDHN
CCOC(=O)c1ccc(C#N)c(SCCN2C[C@H](C)C[C@H](C)C2)n1	ZINC000576122516	460076227	/nfs/dbraw/zinc/07/62/27/460076227.db2.gz	DQCYQYJRXQAQOL-OKILXGFUSA-N	0	3	347.484	3.200	20	30		EGEDHN
CC[C@]1(O)CCCN(Cc2ccc(OC)c(OCCCC#N)c2)C1	ZINC000602740939	460101200	/nfs/dbraw/zinc/10/12/00/460101200.db2.gz	RTPOKFPSHSSAJE-IBGZPJMESA-N	0	3	332.444	3.115	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2N[C@@H]1CC(=O)N(c2ccccc2F)C1	ZINC000589729663	460133776	/nfs/dbraw/zinc/13/37/76/460133776.db2.gz	LUXNAYRIUZUILF-VQIMIIECSA-N	0	3	349.409	3.470	20	30		EGEDHN
Cc1cc(CN[C@H]2CCc3cc(C#N)ccc32)ccc1-n1cncn1	ZINC000618741569	460152210	/nfs/dbraw/zinc/15/22/10/460152210.db2.gz	GJINBKOAKRZAQW-IBGZPJMESA-N	0	3	329.407	3.225	20	30		EGEDHN
Cc1ccc2ncc(C#N)c(N3CCN(c4ccncc4)CC3)c2c1	ZINC000589859029	460152827	/nfs/dbraw/zinc/15/28/27/460152827.db2.gz	ANYOFZNNRAFKMB-UHFFFAOYSA-N	0	3	329.407	3.137	20	30		EGEDHN
CC(C)c1ccc(C[C@@H](C)NCc2cnc3c(C#N)cnn3c2)cc1	ZINC000576517505	460158421	/nfs/dbraw/zinc/15/84/21/460158421.db2.gz	NPNSAZXZXSVLQH-OAHLLOKOSA-N	0	3	333.439	3.445	20	30		EGEDHN
CCC(C)(C)N1CCN(C(=O)N[C@H]2CCc3cc(C#N)ccc32)CC1	ZINC000594240935	460167626	/nfs/dbraw/zinc/16/76/26/460167626.db2.gz	KEMKNECJGNNROF-SFHVURJKSA-N	0	3	340.471	3.061	20	30		EGEDHN
C[C@@H](CNC(=O)N[C@H]1CCc2cc(C#N)ccc21)N1CCCC[C@H]1C	ZINC000618797757	460179447	/nfs/dbraw/zinc/17/94/47/460179447.db2.gz	TXNYEMFMFHEZCI-VCBZYWHSSA-N	0	3	340.471	3.108	20	30		EGEDHN
Cc1ccc(C(=O)NC2CCN(CCc3ccc(C#N)cc3)CC2)cc1	ZINC000602931624	460192559	/nfs/dbraw/zinc/19/25/59/460192559.db2.gz	IGAZASQBUCMQIZ-UHFFFAOYSA-N	0	3	347.462	3.304	20	30		EGEDHN
N#Cc1ccc(CN(CCO)CCc2ccccc2)c(OC(F)F)c1	ZINC000610613966	460197825	/nfs/dbraw/zinc/19/78/25/460197825.db2.gz	YYIFQGUEGXXOHQ-UHFFFAOYSA-N	0	3	346.377	3.197	20	30		EGEDHN
CN(CCc1ccccc1)[C@H]1CCN(C(=O)CCCCCC#N)C1	ZINC000598195807	460200681	/nfs/dbraw/zinc/20/06/81/460200681.db2.gz	SWKNSPPYEMUVCD-IBGZPJMESA-N	0	3	327.472	3.236	20	30		EGEDHN
CN(CCc1ccccc1)[C@@H]1CCN(C(=O)c2cccc(CC#N)c2)C1	ZINC000598195896	460200870	/nfs/dbraw/zinc/20/08/70/460200870.db2.gz	VWZNVSOYMPULDD-OAQYLSRUSA-N	0	3	347.462	3.142	20	30		EGEDHN
C[C@H](CCC#N)CN(C)Cc1cc2c(cc1OC(F)F)OCO2	ZINC000618888418	460208161	/nfs/dbraw/zinc/20/81/61/460208161.db2.gz	SKBQFQHROQQOIL-LLVKDONJSA-N	0	3	326.343	3.388	20	30		EGEDHN
N#CCCCC[C@H](N)C(=O)Nc1nc(-c2cccc(F)c2)cs1	ZINC000594424847	460213885	/nfs/dbraw/zinc/21/38/85/460213885.db2.gz	CWOTVMOKSDJJGR-ZDUSSCGKSA-N	0	3	332.404	3.299	20	30		EGEDHN
Cc1nc(NC(=O)[C@@H](N)CCCCC#N)sc1Cc1ccccc1	ZINC000594429625	460216005	/nfs/dbraw/zinc/21/60/05/460216005.db2.gz	VACKIFATAHYOGR-HNNXBMFYSA-N	0	3	342.468	3.392	20	30		EGEDHN
COc1ccc2c(c1)C[C@H](C(C)C)CN2C(=O)[C@@H](N)CCCCC#N	ZINC000594449812	460224650	/nfs/dbraw/zinc/22/46/50/460224650.db2.gz	OMSAVJSAZXAXEK-WMZOPIPTSA-N	0	3	343.471	3.268	20	30		EGEDHN
Cc1ccccc1[C@@H]([C@H](C)NC(=O)Nc1ccnc(C#N)c1)N(C)C	ZINC000603125812	460247908	/nfs/dbraw/zinc/24/79/08/460247908.db2.gz	LWOBGWVIHKKARU-KBXCAEBGSA-N	0	3	337.427	3.075	20	30		EGEDHN
C[C@H]1CN(c2c(C#N)cnn2-c2ccccc2)CCN(C2CCC2)C1	ZINC000603389469	460295340	/nfs/dbraw/zinc/29/53/40/460295340.db2.gz	WJQZJAQLCVTKTG-MRXNPFEDSA-N	0	3	335.455	3.055	20	30		EGEDHN
Cc1ccc(CN2CC[C@H](CN(C)c3ncccc3C#N)C2)s1	ZINC000603402429	460297615	/nfs/dbraw/zinc/29/76/15/460297615.db2.gz	RSWCRVSGPWSTKK-OAHLLOKOSA-N	0	3	326.469	3.282	20	30		EGEDHN
CCC(C)(C)N1CCN(C(=O)Nc2cc(OC)c(C#N)cc2F)CC1	ZINC000599808192	460338080	/nfs/dbraw/zinc/33/80/80/460338080.db2.gz	IWLUTNCHONOSRM-UHFFFAOYSA-N	0	3	348.422	3.044	20	30		EGEDHN
CC(C)(NC[C@H](O)COc1ccc(CC#N)cc1)c1cccc(F)c1	ZINC000611396319	460354989	/nfs/dbraw/zinc/35/49/89/460354989.db2.gz	RXOIPDYJSCKIHY-SFHVURJKSA-N	0	3	342.414	3.156	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN(C)CC2(C)COC2)cc1OC	ZINC000628423589	460409954	/nfs/dbraw/zinc/40/99/54/460409954.db2.gz	AOVYFRWZTFVLOO-UHFFFAOYSA-N	0	3	325.836	3.382	20	30		EGEDHN
N#Cc1ccc(CNC(=O)[C@H]2CCCN2C2CCCC2)cc1Cl	ZINC000619780321	460443305	/nfs/dbraw/zinc/44/33/05/460443305.db2.gz	JCVQEQLAKBUNAY-QGZVFWFLSA-N	0	3	331.847	3.235	20	30		EGEDHN
C[C@H](C1CCN(C)CC1)N(C)C(=O)NCc1ccc(C#N)c(Cl)c1	ZINC000619826091	460451035	/nfs/dbraw/zinc/45/10/35/460451035.db2.gz	GYKFXWMDFISJHZ-CYBMUJFWSA-N	0	3	348.878	3.083	20	30		EGEDHN
C[C@@]1(C#N)CCCN(C(=O)N[C@H](CN2CCCC2)c2ccccc2)C1	ZINC000612099462	460539458	/nfs/dbraw/zinc/53/94/58/460539458.db2.gz	XAGOUZHWKOITHC-QUCCMNQESA-N	0	3	340.471	3.159	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2ccccc2CC#N)CN1Cc1ccccc1	ZINC000601308912	460784289	/nfs/dbraw/zinc/78/42/89/460784289.db2.gz	GXAXSSBBMGCZSL-VQIMIIECSA-N	0	3	333.435	3.145	20	30		EGEDHN
Cc1ccc(CNC[C@@H](O)CC(C)(C)C#N)cc1Br	ZINC000601969279	460965557	/nfs/dbraw/zinc/96/55/57/460965557.db2.gz	BGJGMXRPPZUCBW-ZDUSSCGKSA-N	0	3	325.250	3.148	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)[C@@H](C)c1nc(C)cs1)C(C)C	ZINC000668683424	461379656	/nfs/dbraw/zinc/37/96/56/461379656.db2.gz	VZSUDGGKWVTCIO-CVEARBPZSA-N	0	3	335.517	3.370	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN(C)Cc1ccc(OC)cc1	ZINC000641938778	461414867	/nfs/dbraw/zinc/41/48/67/461414867.db2.gz	FLPAQNQTCDNTQS-LJQANCHMSA-N	0	3	341.451	3.295	20	30		EGEDHN
C=CCCC(C)(C)NC(=O)NCc1ccccc1OCCN(C)C	ZINC000663866487	461848010	/nfs/dbraw/zinc/84/80/10/461848010.db2.gz	FFBGZCQHNNNEFX-UHFFFAOYSA-N	0	3	333.476	3.171	20	30		EGEDHN
C=CC[C@H]1N(C(=O)NC2CCN([C@H]3CCOC3)CC2)CCCC1(C)C	ZINC000666977160	461894992	/nfs/dbraw/zinc/89/49/92/461894992.db2.gz	XJMIWFQTZUCOBG-ZWKOTPCHSA-N	0	3	349.519	3.016	20	30		EGEDHN
C=CCC1(NC(=O)NCC(C)(C)N2CCC(OC)CC2)CCCC1	ZINC000664035364	461921505	/nfs/dbraw/zinc/92/15/05/461921505.db2.gz	PXIMAGBJNJMPGS-UHFFFAOYSA-N	0	3	337.508	3.064	20	30		EGEDHN
C=CCCn1cc(CNC[C@@H]2CCCc3cc(OC)ccc32)nn1	ZINC000657437413	462122857	/nfs/dbraw/zinc/12/28/57/462122857.db2.gz	RJKBJKBDSJYJBK-INIZCTEOSA-N	0	3	326.444	3.073	20	30		EGEDHN
CC(=O)c1ccccc1NC(=O)CCCN1CCC[C@@H](CC#N)C1	ZINC000661151467	462126825	/nfs/dbraw/zinc/12/68/25/462126825.db2.gz	CGULMFUWPJDQQT-INIZCTEOSA-N	0	3	327.428	3.234	20	30		EGEDHN
C=CC[C@H]1CCCN([C@H]2CCN(Cc3ccc(OC)cc3)C2=O)C1	ZINC000661384673	462224906	/nfs/dbraw/zinc/22/49/06/462224906.db2.gz	KGPAVJAHGGTSFE-LPHOPBHVSA-N	0	3	328.456	3.084	20	30		EGEDHN
C=CC[C@H]1CCCN([C@H](C)C(=O)Nc2cccc(NC(C)=O)c2)C1	ZINC000661381748	462225222	/nfs/dbraw/zinc/22/52/22/462225222.db2.gz	PBYGEESAKOMZOQ-ZBFHGGJFSA-N	0	3	329.444	3.260	20	30		EGEDHN
C=CC[C@@H]1CCCN([C@H](C)C(=O)N[C@H]2CCOc3ccccc32)C1	ZINC000661378772	462225773	/nfs/dbraw/zinc/22/57/73/462225773.db2.gz	LVVSAHFARSMAND-NUJGCVRESA-N	0	3	328.456	3.303	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)NC(=O)N(CCC)[C@@H]1CCN(C)C1	ZINC000645550709	462370067	/nfs/dbraw/zinc/37/00/67/462370067.db2.gz	VIVKBQSXZZGWNG-RBUKOAKNSA-N	0	3	329.488	3.300	20	30		EGEDHN
C=C[C@@H](CC(=O)N1C[C@@H](c2cccc(F)c2)[C@H](N)C1)c1ccccc1	ZINC000649368169	462489239	/nfs/dbraw/zinc/48/92/39/462489239.db2.gz	MGCMRVOLUTZJIE-RYGJVYDSSA-N	0	3	338.426	3.439	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(C(=O)OCCC)cc2)CC1	ZINC000171740085	526441785	/nfs/dbraw/zinc/44/17/85/526441785.db2.gz	NOCRUUDYGPMFIJ-UHFFFAOYSA-N	0	3	345.443	3.025	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(NC(=O)OCC)cc2)CC1	ZINC000171738972	526442015	/nfs/dbraw/zinc/44/20/15/526442015.db2.gz	FXLQCVVMROAMOC-UHFFFAOYSA-N	0	3	346.431	3.027	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(Cl)cc3cccnc32)CC1	ZINC000171715919	526445795	/nfs/dbraw/zinc/44/57/95/526445795.db2.gz	ZFWIWSVVDGJJQZ-UHFFFAOYSA-N	0	3	329.831	3.268	20	30		EGEDHN
CC1CCN([C@@H](CNC(=O)c2c[nH]c(C#N)c2)c2cccs2)CC1	ZINC000181154669	528259796	/nfs/dbraw/zinc/25/97/96/528259796.db2.gz	CIXUMAHFHXRUTG-INIZCTEOSA-N	0	3	342.468	3.151	20	30		EGEDHN
COCCN(CCC(=O)Nc1sccc1C#N)Cc1cccs1	ZINC000354592151	536833038	/nfs/dbraw/zinc/83/30/38/536833038.db2.gz	CJEYSVIJBHFBKW-UHFFFAOYSA-N	0	3	349.481	3.158	20	30		EGEDHN
C[C@H](NC(=O)N[C@@H]1CCN(C2CC2)C1)c1nc(C(C)(C)C)cs1	ZINC000329483531	547498142	/nfs/dbraw/zinc/49/81/42/547498142.db2.gz	WMEBRNHVOKBHLH-NWDGAFQWSA-N	0	3	336.505	3.242	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2c3c(cc4c2CCC4)CCC3)CC1	ZINC000353915598	547698892	/nfs/dbraw/zinc/69/88/92/547698892.db2.gz	SSKHSVLEBVZPSZ-UHFFFAOYSA-N	0	3	339.483	3.436	20	30		EGEDHN
C=CCCOCCNC(=O)N[C@H](CN1CCCCC1)c1ccccc1	ZINC000677477171	549277371	/nfs/dbraw/zinc/27/73/71/549277371.db2.gz	TWIGGSSCGTWVNR-LJQANCHMSA-N	0	3	345.487	3.106	20	30		EGEDHN
COC(=O)[C@@H]1C[C@@H]1C(=O)C(C#N)c1nc(-c2ccc(C)cc2)cs1	ZINC000727628271	574678372	/nfs/dbraw/zinc/67/83/72/574678372.db2.gz	TYGWFKVIORFFCP-BFHYXJOUSA-N	0	3	340.404	3.104	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CNCc2ccnc(N3CCCC3)c2)cc1	ZINC000728711692	574768217	/nfs/dbraw/zinc/76/82/17/574768217.db2.gz	NWBHRLOSKCXIET-INIZCTEOSA-N	0	3	336.439	3.262	20	30		EGEDHN
CCC(=O)N[C@@H](C)C(=O)C(C#N)c1nc(-c2ccc(C)cc2)cs1	ZINC000729069960	574810553	/nfs/dbraw/zinc/81/05/53/574810553.db2.gz	JKRDZPOFOIAWFU-JSGCOSHPSA-N	0	3	341.436	3.210	20	30		EGEDHN
CCCCCCC[C@H](C)CNC(=O)NC[C@H]1CN2CCC[C@H]2CO1	ZINC000729496528	574866109	/nfs/dbraw/zinc/86/61/09/574866109.db2.gz	BUIIVQJKIODGKG-BZSNNMDCSA-N	0	3	339.524	3.145	20	30		EGEDHN
COc1cccc([O-])c1/C=N/CC1([NH+]2CCC(OC)CC2)CCCC1	ZINC000730733341	575013680	/nfs/dbraw/zinc/01/36/80/575013680.db2.gz	XVHGXCYIBKCDAB-KGENOOAVSA-N	0	3	346.471	3.243	20	30		EGEDHN
N#CC(C(=O)CC[C@@H]1CCCCO1)C(=O)Nc1ccccc1Cl	ZINC000732494445	575272275	/nfs/dbraw/zinc/27/22/75/575272275.db2.gz	HGPNCCLGBRLWPH-QWHCGFSZSA-N	0	3	334.803	3.337	20	30		EGEDHN
N#Cc1ccc(CC(=O)C(C#N)c2nc(-c3ccncc3)cs2)cc1	ZINC000734082126	575433325	/nfs/dbraw/zinc/43/33/25/575433325.db2.gz	XUOPXHJMPLNQLI-INIZCTEOSA-N	0	3	344.399	3.496	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2csc3c2CC[C@H](C)C3)CC1	ZINC000740748798	576623101	/nfs/dbraw/zinc/62/31/01/576623101.db2.gz	YZPHSVCGUUWBBH-AWEZNQCLSA-N	0	3	330.497	3.090	20	30		EGEDHN
C#CCOc1ccc(C(=O)NC[C@H](c2ccc(C)cc2)N(C)C)cc1	ZINC000741677824	576710506	/nfs/dbraw/zinc/71/05/06/576710506.db2.gz	CCGOLDHCWYRXTD-HXUWFJFHSA-N	0	3	336.435	3.040	20	30		EGEDHN
C=CCn1c2ccccc2n(CN2CC[C@@H](N3CC=CC3)C2)c1=S	ZINC000742162754	576753715	/nfs/dbraw/zinc/75/37/15/576753715.db2.gz	IWFJSNORPOAXDP-MRXNPFEDSA-N	0	3	340.496	3.262	20	30		EGEDHN
Cc1ccc([C@@H](C)C(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)o1	ZINC000742550469	576789446	/nfs/dbraw/zinc/78/94/46/576789446.db2.gz	SSYFSNDGJBBGIP-MRXNPFEDSA-N	0	3	339.439	3.154	20	30		EGEDHN
C#CCCN1CCC(NC(=O)[C@H](CC(C)C)c2ccccc2)CC1	ZINC000743489930	576810228	/nfs/dbraw/zinc/81/02/28/576810228.db2.gz	MRMJQHHMVBPAGQ-HXUWFJFHSA-N	0	3	326.484	3.420	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2ccc(C)c(-n3cccc3)c2)CC1	ZINC000743490694	576810285	/nfs/dbraw/zinc/81/02/85/576810285.db2.gz	UPZGWIQUMNTKBH-UHFFFAOYSA-N	0	3	335.451	3.003	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2cccc(OC3CCCC3)c2)CC1	ZINC000743492899	576810295	/nfs/dbraw/zinc/81/02/95/576810295.db2.gz	BKIYVYMSPJBNDM-UHFFFAOYSA-N	0	3	340.467	3.226	20	30		EGEDHN
CN(Cn1ccc(-c2ccc(C#N)cc2)n1)C1Cc2ccccc2C1	ZINC000744146639	576821473	/nfs/dbraw/zinc/82/14/73/576821473.db2.gz	IKMKLVZVMWMFLS-UHFFFAOYSA-N	0	3	328.419	3.478	20	30		EGEDHN
C[C@@H](C(=O)N(C)CCC#N)N1CCC(c2cc3ccccc3[nH]2)CC1	ZINC000744233074	576823654	/nfs/dbraw/zinc/82/36/54/576823654.db2.gz	ZOAPUEMANBPTCI-HNNXBMFYSA-N	0	3	338.455	3.108	20	30		EGEDHN
N#Cc1c2[nH]c3ccccc3n2c(=O)cc1CN1CCC2(CCCC2)C1	ZINC000744421837	576827737	/nfs/dbraw/zinc/82/77/37/576827737.db2.gz	IVOFJLDAXGZAPQ-INIZCTEOSA-N	0	3	346.434	3.490	20	30		EGEDHN
C#CCOc1ccc([C@H](C)[NH2+][C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1	ZINC000819709824	607085388	/nfs/dbraw/zinc/08/53/88/607085388.db2.gz	QOKIBDFVRVRIMX-LSDHHAIUSA-N	0	3	347.422	3.291	20	30		EGEDHN
N#CCCNC(=O)CN[C@H](CCCc1ccccc1)c1ccccc1	ZINC000027374402	1291287392	/nfs/dbraw/zinc/28/73/92/1291287392.db2.gz	AMGYQLYDUNBDBX-HXUWFJFHSA-N	0	3	335.451	3.370	20	30		EGEDHN
N#Cc1ccc([C@H](O)CNCc2cc(Br)ccc2F)cc1	ZINC000041069388	1291412053	/nfs/dbraw/zinc/41/20/53/1291412053.db2.gz	LZQWPUQIIJUPAF-MRXNPFEDSA-N	0	3	349.203	3.283	20	30		EGEDHN
COc1cccc([C@@H](C/N=C/c2cccc(OC)c2O)N(C)C)c1	ZINC000072658369	1292285454	/nfs/dbraw/zinc/28/54/54/1292285454.db2.gz	RYJJDMYRBGVPMC-XNHPLOEXSA-N	0	3	328.412	3.131	20	30		EGEDHN
CC(C)COc1ccc(CC(=O)C(C#N)C(=O)NC2CCCC2)cc1	ZINC000106985475	1293055777	/nfs/dbraw/zinc/05/57/77/1293055777.db2.gz	KGSLVHZWMORWRL-SFHVURJKSA-N	0	3	342.439	3.032	20	30		EGEDHN
N#CC(C(=O)CSC1CC1)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000835066531	1293199040	/nfs/dbraw/zinc/19/90/40/1293199040.db2.gz	XWQFABBKAROSBB-JTQLQIEISA-N	0	3	326.780	3.022	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)C[C@@H]3COc4ccccc4O3)nc21	ZINC000835174663	1293225611	/nfs/dbraw/zinc/22/56/11/1293225611.db2.gz	VXPWGZWGRWKELO-ZIAGYGMSSA-N	0	3	347.374	3.278	20	30		EGEDHN
Cc1cccc(CNC(=O)C(C#N)C(=O)CCCC(=O)C(C)(C)C)c1	ZINC000835338694	1293267432	/nfs/dbraw/zinc/26/74/32/1293267432.db2.gz	BOXFSSJVHKCPFH-INIZCTEOSA-N	0	3	342.439	3.106	20	30		EGEDHN
CCc1ccc([C@@H](C)CC(=O)C(C#N)C(=O)Nc2ccccn2)cc1	ZINC000121866678	1293393471	/nfs/dbraw/zinc/39/34/71/1293393471.db2.gz	NSAWQELJFDIYLU-YOEHRIQHSA-N	0	3	335.407	3.485	20	30		EGEDHN
N#CC(C(=O)CCCc1nc(C2CC2)no1)c1nc2ccccc2[nH]1	ZINC000123810771	1293456293	/nfs/dbraw/zinc/45/62/93/1293456293.db2.gz	UQNHHKMSSBHKSG-GFCCVEGCSA-N	0	3	335.367	3.022	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)Cc1ccccc1F	ZINC000128915808	1293608455	/nfs/dbraw/zinc/60/84/55/1293608455.db2.gz	CDIKJQUFEZEZIM-AWEZNQCLSA-N	0	3	340.354	3.114	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1)C(=O)c1cc(Cl)cc([N+](=O)[O-])c1	ZINC000131006345	1293675783	/nfs/dbraw/zinc/67/57/83/1293675783.db2.gz	LBXNZFQZNIEWRM-CQSZACIVSA-N	0	3	343.726	3.209	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H](O)c1ccccc1Br	ZINC000152764102	1293984133	/nfs/dbraw/zinc/98/41/33/1293984133.db2.gz	BGPLUKSEWBNGKZ-QGZVFWFLSA-N	0	3	345.240	3.486	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)CC[C@@H]2CC[C@H](C)O2)cc1	ZINC000173968383	1294474522	/nfs/dbraw/zinc/47/45/22/1294474522.db2.gz	ASPOIJXVXLYAFR-RRQGHBQHSA-N	0	3	328.412	3.244	20	30		EGEDHN
COc1ccc(CNC(=O)C(C#N)C(=O)CCCC2CCCC2)cc1	ZINC000173996116	1294476019	/nfs/dbraw/zinc/47/60/19/1294476019.db2.gz	ZOPBCJIJAUQSLN-SFHVURJKSA-N	0	3	342.439	3.381	20	30		EGEDHN
N#CCOc1ccc(CNCc2ccc(Oc3cnccn3)cc2)cc1	ZINC000174421369	1294499956	/nfs/dbraw/zinc/49/99/56/1294499956.db2.gz	CDUBOYOEMZQNMQ-UHFFFAOYSA-N	0	3	346.390	3.461	20	30		EGEDHN
Cc1ccc(CCCC(=O)C(C#N)C(=O)NCc2ccccc2)s1	ZINC000176017851	1294585215	/nfs/dbraw/zinc/58/52/15/1294585215.db2.gz	GTBOBGFUJIWIDQ-KRWDZBQOSA-N	0	3	340.448	3.405	20	30		EGEDHN
CCOCCC(=O)C(C#N)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000176095973	1294589994	/nfs/dbraw/zinc/58/99/94/1294589994.db2.gz	YYDULPASHDJFAE-GFCCVEGCSA-N	0	3	329.183	3.067	20	30		EGEDHN
C[C@H](CC(=O)C(C#N)C(=O)N1CCCC1)Cc1ccc(Cl)cc1	ZINC000179787890	1294828408	/nfs/dbraw/zinc/82/84/08/1294828408.db2.gz	NHLLIZXKHNIZQP-XJKSGUPXSA-N	0	3	332.831	3.240	20	30		EGEDHN
CCN1CCN(c2cccc(NC(=O)c3cccc(CC#N)c3)c2)CC1	ZINC000184282176	1295186274	/nfs/dbraw/zinc/18/62/74/1295186274.db2.gz	UOFWSDUPFICUHW-UHFFFAOYSA-N	0	3	348.450	3.147	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)CCn1ccc2ccccc21	ZINC000193371673	1295857558	/nfs/dbraw/zinc/85/75/58/1295857558.db2.gz	OZHIJUZXUVETAV-MRXNPFEDSA-N	0	3	325.412	3.047	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)CCOc1cc(C)cc(C)c1	ZINC000193380469	1295861016	/nfs/dbraw/zinc/86/10/16/1295861016.db2.gz	VYUUGGXNLJVZPX-KRWDZBQOSA-N	0	3	330.428	3.088	20	30		EGEDHN
N#CC(C(=O)CSc1ccncc1)C(=O)Nc1ccc(Cl)cc1	ZINC000193392366	1295862614	/nfs/dbraw/zinc/86/26/14/1295862614.db2.gz	WUWDZXAPHTXLDL-CQSZACIVSA-N	0	3	345.811	3.175	20	30		EGEDHN
CCCc1nc(C)c(C(=O)C(C#N)C(=O)Nc2ccccc2)s1	ZINC000193446160	1295871139	/nfs/dbraw/zinc/87/11/39/1295871139.db2.gz	LYLHZIBVULPKMW-ZDUSSCGKSA-N	0	3	327.409	3.365	20	30		EGEDHN
N#CC(C(=O)C[C@H]1CCCO1)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000193467784	1295872028	/nfs/dbraw/zinc/87/20/28/1295872028.db2.gz	KFUSBVHQZPEOIL-GHMZBOCLSA-N	0	3	341.194	3.210	20	30		EGEDHN
N#CC(C(=O)COCC1CC1)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000193481917	1295874424	/nfs/dbraw/zinc/87/44/24/1295874424.db2.gz	KBXIOXQVTRJMSM-ZDUSSCGKSA-N	0	3	341.194	3.067	20	30		EGEDHN
CC[C@@H](C)c1ccc(NC(=O)C(C#N)C(=O)COCC2CC2)cc1	ZINC000193492950	1295877774	/nfs/dbraw/zinc/87/77/74/1295877774.db2.gz	QVHBUXDRKMNCHD-DYVFJYSZSA-N	0	3	328.412	3.274	20	30		EGEDHN
N#CC(C(=O)C=CSc1ccccc1)c1nnc2n1CCCCC2	ZINC000195287557	1296053534	/nfs/dbraw/zinc/05/35/34/1296053534.db2.gz	MEDRCCPUHAPZJZ-PABFRNLHSA-N	0	3	338.436	3.487	20	30		EGEDHN
CO[C@@H](C)CC(=O)C(C#N)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000195492368	1296072776	/nfs/dbraw/zinc/07/27/76/1296072776.db2.gz	ZFBOOURVDAZXRY-QPUJVOFHSA-N	0	3	329.183	3.066	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CNCc2ccc(-n3ccnc3)cc2)cc1	ZINC000237495677	1296246382	/nfs/dbraw/zinc/24/63/82/1296246382.db2.gz	AAZSCMOQZRZHQF-INIZCTEOSA-N	0	3	332.407	3.453	20	30		EGEDHN
N#CC(C(=O)NC1CC1)C(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000246146593	1296338822	/nfs/dbraw/zinc/33/88/22/1296338822.db2.gz	SGKRIONIIVRXKQ-TUAOUCFPSA-N	0	3	337.206	3.084	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN1CCCCC[C@@H]1C[C@@H](O)c1ccco1	ZINC000247794413	1296400283	/nfs/dbraw/zinc/40/02/83/1296400283.db2.gz	ZLUJTQNWBGNBCH-QZTJIDSGSA-N	0	3	346.471	3.148	20	30		EGEDHN
N#CC(C(=O)C=CSc1ccccc1)c1nnc2n1CCCCC2	ZINC000255544077	1296544909	/nfs/dbraw/zinc/54/49/09/1296544909.db2.gz	MEDRCCPUHAPZJZ-KUGGDMIFSA-N	0	3	338.436	3.487	20	30		EGEDHN
C[C@@H]1CC[C@@H](NCc2ccc(C#N)s2)CN1C(=O)OC(C)(C)C	ZINC000690966930	1298132427	/nfs/dbraw/zinc/13/24/27/1298132427.db2.gz	NGEPXZACOQOISR-CHWSQXEVSA-N	0	3	335.473	3.497	20	30		EGEDHN
C[C@H]1CCN(Cc2ccccc2)C[C@H]1NC(=O)Cc1ccc(C#N)cc1	ZINC000716273161	1298295396	/nfs/dbraw/zinc/29/53/96/1298295396.db2.gz	UJKVPJBNGCEHLS-LAUBAEHRSA-N	0	3	347.462	3.128	20	30		EGEDHN
CN1CC[C@@H]2CC[C@H](C1)N2c1ccc(C#N)c(Br)c1F	ZINC000718905110	1298311655	/nfs/dbraw/zinc/31/16/55/1298311655.db2.gz	HCRGUUNHVMLUFJ-NWDGAFQWSA-N	0	3	338.224	3.133	20	30		EGEDHN
CC(C)C(=O)N1CCCC[C@@H]1C(=O)C(C#N)c1nc(C(C)C)cs1	ZINC000747196991	1298740920	/nfs/dbraw/zinc/74/09/20/1298740920.db2.gz	STQJBJBVJLPFLQ-UKRRQHHQSA-N	0	3	347.484	3.480	20	30		EGEDHN
C=C(Cl)C[C@H](N)C(=O)NCc1c(C)cc(Br)cc1C	ZINC000876629720	1298881268	/nfs/dbraw/zinc/88/12/68/1298881268.db2.gz	MIKLPEBITFRDNJ-ZDUSSCGKSA-N	0	3	345.668	3.152	20	30		EGEDHN
C=C(Cl)C[C@H](N)C(=O)Nc1ccc(-c2ncc3n2CCCC3)cc1	ZINC000876730953	1298945114	/nfs/dbraw/zinc/94/51/14/1298945114.db2.gz	MOBQWCVEICGVIQ-INIZCTEOSA-N	0	3	344.846	3.295	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@H](NCc1cccc(C#N)n1)C1CCCC1	ZINC000877480001	1299332663	/nfs/dbraw/zinc/33/26/63/1299332663.db2.gz	IIAZQDVDWCIGFI-QGZVFWFLSA-N	0	3	344.459	3.126	20	30		EGEDHN
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C)[C@@H]1NCc1cccc(C#N)n1	ZINC000877522815	1299367168	/nfs/dbraw/zinc/36/71/68/1299367168.db2.gz	GTQBAAQYODQZNH-CKEIUWERSA-N	0	3	344.459	3.077	20	30		EGEDHN
C=CCNC(=S)N(CCC)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000751022785	1299500074	/nfs/dbraw/zinc/50/00/74/1299500074.db2.gz	AQZHETFUQDCZCP-GOSISDBHSA-N	0	3	331.529	3.424	20	30		EGEDHN
C#CCOCCNC(c1ccc(OC)cc1)c1ccc(OC)cc1	ZINC000879345010	1300493622	/nfs/dbraw/zinc/49/36/22/1300493622.db2.gz	JLESUABCLMHLGQ-UHFFFAOYSA-N	0	3	325.408	3.033	20	30		EGEDHN
CC[C@@H]1CC[C@H](C(=O)C(C#N)C(=O)Nc2ccc(F)c(Cl)c2)O1	ZINC000757304693	1300662789	/nfs/dbraw/zinc/66/27/89/1300662789.db2.gz	MKPSIPZWLNCVGC-UHIISALHSA-N	0	3	338.766	3.084	20	30		EGEDHN
CC(N=Nc1ncc(F)cn1)c1ccc([O-])c(C[NH+]2CCCCC2)c1	ZINC000760248440	1301240259	/nfs/dbraw/zinc/24/02/59/1301240259.db2.gz	ZIXOOUNILYLNMH-UHFFFAOYSA-N	0	3	343.406	3.143	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN(Cc2ccc(C(N)=O)cc2)C2CC2)cc1	ZINC000768440366	1302903246	/nfs/dbraw/zinc/90/32/46/1302903246.db2.gz	QPZPDKVNKGTKJL-HNNXBMFYSA-N	0	3	349.434	3.241	20	30		EGEDHN
C[C@@H](NC(=O)Cc1ccccc1CC#N)[C@@H](c1ccccc1)N(C)C	ZINC000770046602	1303211747	/nfs/dbraw/zinc/21/17/47/1303211747.db2.gz	HPVFXTYSZLKCKI-IERDGZPVSA-N	0	3	335.451	3.103	20	30		EGEDHN
CN1CCN(c2ccc(C=NNCc3ccc(Cl)cc3)cc2)CC1	ZINC000771558185	1303419996	/nfs/dbraw/zinc/41/99/96/1303419996.db2.gz	VMUGWYQIWYMDGG-UHFFFAOYSA-N	0	3	342.874	3.216	20	30		EGEDHN
N#Cc1ccc(CC(=O)OCC2CCN(Cc3ccco3)CC2)cc1	ZINC000772690920	1303564919	/nfs/dbraw/zinc/56/49/19/1303564919.db2.gz	QWRKTDAWFHJRIY-UHFFFAOYSA-N	0	3	338.407	3.149	20	30		EGEDHN
C[C@@H](N[C@H](C)c1ccc(N(C)C)cc1)C(=O)Nc1cccc(C#N)c1	ZINC000774478537	1303815078	/nfs/dbraw/zinc/81/50/78/1303815078.db2.gz	GXLZZLKIHOEEDP-HUUCEWRRSA-N	0	3	336.439	3.302	20	30		EGEDHN
C#CCNC(=O)CN[C@@H](C)c1ccccc1-c1ccc(Cl)cc1	ZINC000775453028	1303966236	/nfs/dbraw/zinc/96/62/36/1303966236.db2.gz	AIPQPRNHWLNMSS-AWEZNQCLSA-N	0	3	326.827	3.407	20	30		EGEDHN
C#C[C@H](N[C@H](CC)CSc1ccccc1[N+](=O)[O-])[C@@H]1CCCO1	ZINC000775571756	1303986596	/nfs/dbraw/zinc/98/65/96/1303986596.db2.gz	KYOXFTZKFGFKJG-YCPHGPKFSA-N	0	3	334.441	3.236	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1)C(=O)Nc1cc(C#N)ccc1F	ZINC000888354380	1304128661	/nfs/dbraw/zinc/12/86/61/1304128661.db2.gz	XQEJXMAWUFLBMK-UHFFFAOYSA-N	0	3	340.402	3.293	20	30		EGEDHN
N#Cc1ccc(CN(C[C@H](O)c2ccc([N+](=O)[O-])cc2)C2CC2)cc1	ZINC000776580684	1304174543	/nfs/dbraw/zinc/17/45/43/1304174543.db2.gz	YXJXRSQCARXDCV-IBGZPJMESA-N	0	3	337.379	3.164	20	30		EGEDHN
N#Cc1cccc(OCCCN2CC[C@@](O)(c3ccc(F)cc3)C2)c1	ZINC000777728422	1304340273	/nfs/dbraw/zinc/34/02/73/1304340273.db2.gz	AEUQKOMWGBSMRG-FQEVSTJZSA-N	0	3	340.398	3.060	20	30		EGEDHN
C=CC[C@@H](CO)C[NH2+][C@@H](C)c1cc(Br)cc(C)c1[O-]	ZINC000779040724	1304521937	/nfs/dbraw/zinc/52/19/37/1304521937.db2.gz	KNRPOGGGOMLAKF-NWDGAFQWSA-N	0	3	328.250	3.298	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CN1CCC[C@H](C2(C)OCCO2)C1	ZINC000779166208	1304538448	/nfs/dbraw/zinc/53/84/48/1304538448.db2.gz	UTRBGQNEPPWFSN-HNNXBMFYSA-N	0	3	349.858	3.327	20	30		EGEDHN
C=C(C)CN1CCC(NC(=S)NCCCCCCSC)CC1	ZINC000782202344	1304930179	/nfs/dbraw/zinc/93/01/79/1304930179.db2.gz	JPXZPEZWXJFPME-UHFFFAOYSA-N	0	3	343.606	3.414	20	30		EGEDHN
C=CCCN(OCc1ccccc1)C(=O)N[C@H](C)C1=CCN(C)CC1	ZINC000782998339	1305035099	/nfs/dbraw/zinc/03/50/99/1305035099.db2.gz	SMDVMTFJDSXMNN-QGZVFWFLSA-N	0	3	343.471	3.356	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)cn1)[C@@H]1CCCCN1C(=O)OC(C)(C)C	ZINC000783300636	1305078730	/nfs/dbraw/zinc/07/87/30/1305078730.db2.gz	OPCHJIYEGYZCFP-YOEHRIQHSA-N	0	3	344.459	3.221	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)cn1)[C@H]1CCCCN1C(=O)OC(C)(C)C	ZINC000783300635	1305079053	/nfs/dbraw/zinc/07/90/53/1305079053.db2.gz	OPCHJIYEGYZCFP-WMLDXEAASA-N	0	3	344.459	3.221	20	30		EGEDHN
C[C@@]1(C#N)CCCN(CC(=O)C(C#N)c2nc3ccccc3s2)C1	ZINC000784453136	1305245869	/nfs/dbraw/zinc/24/58/69/1305245869.db2.gz	HJXFYAIGEPBSPS-UGSOOPFHSA-N	0	3	338.436	3.098	20	30		EGEDHN
C[C@@H]1C[C@@H](C(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2Cl)CO1	ZINC000784491518	1305251328	/nfs/dbraw/zinc/25/13/28/1305251328.db2.gz	UFWCEQPIRBESRB-KKZNHRDASA-N	0	3	341.194	3.066	20	30		EGEDHN
C=C[C@@H]1CCCCN1C(=O)Nc1ccc(N2CCN(CC)CC2)cc1	ZINC000785642132	1305400955	/nfs/dbraw/zinc/40/09/55/1305400955.db2.gz	NWBUEVGPBGSDRD-GOSISDBHSA-N	0	3	342.487	3.401	20	30		EGEDHN
C[C@@H](C(=O)C(C#N)C(=O)NCc1cccc(Cl)c1)c1ccco1	ZINC000786536444	1305592683	/nfs/dbraw/zinc/59/26/83/1305592683.db2.gz	BTDFFSARSPHFLV-BXUZGUMPSA-N	0	3	330.771	3.062	20	30		EGEDHN
CCCCSCC(=O)C(C#N)C(=O)N[C@@H](CC)c1ccccc1	ZINC000787044569	1305682772	/nfs/dbraw/zinc/68/27/72/1305682772.db2.gz	GHHPVKBRMQVMPF-CVEARBPZSA-N	0	3	332.469	3.496	20	30		EGEDHN
CN(C)c1ccc(NC(=O)CCNC2(c3cccc(C#N)c3)CC2)cc1	ZINC000792270827	1309152496	/nfs/dbraw/zinc/15/24/96/1309152496.db2.gz	HQUGRILEGQKFBI-UHFFFAOYSA-N	0	3	348.450	3.232	20	30		EGEDHN
C=C1CCN(C(=O)NC[C@@H](c2ccc(SC)cc2)N(C)C)CC1	ZINC000895059742	1309172698	/nfs/dbraw/zinc/17/26/98/1309172698.db2.gz	WVFMZQLFUXKBOW-KRWDZBQOSA-N	0	3	333.501	3.373	20	30		EGEDHN
C#CC[C@@H](CCOC)NCc1nc(-c2cccc(OC)c2)cs1	ZINC000895667880	1309456166	/nfs/dbraw/zinc/45/61/66/1309456166.db2.gz	AZCSVMRWBKTAOA-HNNXBMFYSA-N	0	3	330.453	3.337	20	30		EGEDHN
COc1ccc(CN2CC(C)(C)CC[C@@H]2CO)cc1OCCCC#N	ZINC000895926089	1309593915	/nfs/dbraw/zinc/59/39/15/1309593915.db2.gz	VOHFJVZQCUZXQI-QGZVFWFLSA-N	0	3	346.471	3.361	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN2CCC(Nc3ccccn3)CC2)cc1	ZINC000896197320	1309738637	/nfs/dbraw/zinc/73/86/37/1309738637.db2.gz	AOJAVWWJDLNMJF-MRXNPFEDSA-N	0	3	336.439	3.449	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@@H](C)[C@H]1OCCc2sccc21	ZINC000796739807	1310076646	/nfs/dbraw/zinc/07/66/46/1310076646.db2.gz	GDRVHFHBTHPGHH-SUYBPPKGSA-N	0	3	348.468	3.013	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@H](C)[C@@H]1OCCc2sccc21	ZINC000796739805	1310076786	/nfs/dbraw/zinc/07/67/86/1310076786.db2.gz	GDRVHFHBTHPGHH-QEORTHHSSA-N	0	3	348.468	3.013	20	30		EGEDHN
CN(CCC(=O)C(C#N)c1nc2ccccc2o1)C(=O)OC(C)(C)C	ZINC000796819807	1310093433	/nfs/dbraw/zinc/09/34/33/1310093433.db2.gz	SRQFLZJBBQWTJM-LBPRGKRZSA-N	0	3	343.383	3.261	20	30		EGEDHN
C#Cc1ccc(C(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)cc1	ZINC000897158276	1310203019	/nfs/dbraw/zinc/20/30/19/1310203019.db2.gz	YEDIAJOXSIDARD-INIZCTEOSA-N	0	3	333.435	3.018	20	30		EGEDHN
C[C@@H](NC(=O)c1ccoc1)C(=O)C(C#N)c1ncc(C(C)(C)C)s1	ZINC000797570949	1310213386	/nfs/dbraw/zinc/21/33/86/1310213386.db2.gz	MDKMNPRHSBCXPD-PWSUYJOCSA-N	0	3	345.424	3.028	20	30		EGEDHN
Cn1c2ccc(CN3CCC(c4ccc(C#N)cc4)CC3)cc2oc1=O	ZINC000897588557	1310397485	/nfs/dbraw/zinc/39/74/85/1310397485.db2.gz	GHSOFGVLIRLTIP-UHFFFAOYSA-N	0	3	347.418	3.383	20	30		EGEDHN
C=CCN1CC[C@H](N2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)C1=O	ZINC000799164514	1310496505	/nfs/dbraw/zinc/49/65/05/1310496505.db2.gz	KSRMSOYSXZRIET-HOCLYGCPSA-N	0	3	338.373	3.282	20	30		EGEDHN
COc1cc(CNCCN(C(=O)OC(C)(C)C)C2CC2)ccc1C#N	ZINC000799337353	1310527313	/nfs/dbraw/zinc/52/73/13/1310527313.db2.gz	GNPBAJPTEXOCTD-UHFFFAOYSA-N	0	3	345.443	3.056	20	30		EGEDHN
CC[C@@H](C)N[C@@H](CNC(=O)c1cc(C#N)ccc1C)c1ccco1	ZINC000899078621	1310926506	/nfs/dbraw/zinc/92/65/06/1310926506.db2.gz	IQDPKIZTVFIFBF-PBHICJAKSA-N	0	3	325.412	3.319	20	30		EGEDHN
CC[C@@H](C)N[C@H](CNC(=O)c1ccc(C#N)cc1OC)c1ccco1	ZINC000899080359	1310928148	/nfs/dbraw/zinc/92/81/48/1310928148.db2.gz	UHQBUEDLLDJRBZ-CZUORRHYSA-N	0	3	341.411	3.019	20	30		EGEDHN
CCC(C)(C)OCC(=O)C(C#N)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000838786924	1320816263	/nfs/dbraw/zinc/81/62/63/1320816263.db2.gz	LHYFPNHLYMYUIS-LLVKDONJSA-N	0	3	340.782	3.332	20	30		EGEDHN
C#C[C@@H](NCCC(=O)Nc1c(Cl)cccc1Cl)[C@@H]1CCCO1	ZINC000839562588	1320938296	/nfs/dbraw/zinc/93/82/96/1320938296.db2.gz	APTULKCJFIJVIB-KGLIPLIRSA-N	0	3	341.238	3.092	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@H](NCc2ccc(F)c(C#N)c2)C1)C(C)(C)C	ZINC001019042187	1317018772	/nfs/dbraw/zinc/01/87/72/1317018772.db2.gz	ASKBKQSELNTZFY-CJNGLKHVSA-N	0	3	331.435	3.070	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)CC1	ZINC001019331386	1317171875	/nfs/dbraw/zinc/17/18/75/1317171875.db2.gz	WTKUQSAJBUQTPS-HNNXBMFYSA-N	0	3	329.469	3.057	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H](NCc2cn(C(C)C)nc2C)C1	ZINC001019331679	1317173085	/nfs/dbraw/zinc/17/30/85/1317173085.db2.gz	BHOGVCFPHNOPOK-HKUYNNGSSA-N	0	3	332.492	3.065	20	30		EGEDHN
C=Cc1ccc(C(=O)N2CC[C@H](NCc3ccc(C#N)c(F)c3)C2)cc1	ZINC001019421071	1317230199	/nfs/dbraw/zinc/23/01/99/1317230199.db2.gz	ZLHAECILCHGLPI-IBGZPJMESA-N	0	3	349.409	3.345	20	30		EGEDHN
Cc1ccc(F)c(C(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)c1	ZINC001019433066	1317241823	/nfs/dbraw/zinc/24/18/23/1317241823.db2.gz	OURDMTGEXNUSKI-ZDUSSCGKSA-N	0	3	343.427	3.072	20	30		EGEDHN
CCC1(C(=O)N2CC[C@H](NCc3ccc(C#N)c(F)c3)C2)CCCC1	ZINC001019587447	1317296795	/nfs/dbraw/zinc/29/67/95/1317296795.db2.gz	OSMOKHAQTJESJO-KRWDZBQOSA-N	0	3	343.446	3.358	20	30		EGEDHN
CC(C)(O)CN1CCc2c(cccc2NC(=O)CCCCCC#N)C1	ZINC000805198083	1317326138	/nfs/dbraw/zinc/32/61/38/1317326138.db2.gz	LRPUBMWXFZVWPO-UHFFFAOYSA-N	0	3	343.471	3.228	20	30		EGEDHN
C#CCCCNC(=O)NC[C@@H](c1ccc(CC(C)C)cc1)N(C)C	ZINC000806877581	1317533453	/nfs/dbraw/zinc/53/34/53/1317533453.db2.gz	BBHIQGLADWOMQM-IBGZPJMESA-N	0	3	329.488	3.200	20	30		EGEDHN
CCN(Cc1cc(F)ccc1F)CC1CCN(C(=O)[C@@H](C)C#N)CC1	ZINC000957691059	1317559243	/nfs/dbraw/zinc/55/92/43/1317559243.db2.gz	ZXIWXBPPGPSUNK-AWEZNQCLSA-N	0	3	349.425	3.185	20	30		EGEDHN
C#Cc1cccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)c1	ZINC000807621255	1317574492	/nfs/dbraw/zinc/57/44/92/1317574492.db2.gz	XMENUWCKZYZEMC-OXQOHEQNSA-N	0	3	333.435	3.452	20	30		EGEDHN
C[C@@H]1CCC[C@@H]1CC(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001020186388	1317581808	/nfs/dbraw/zinc/58/18/08/1317581808.db2.gz	OPYRCVDDEAQRDA-MOIQIXESSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cccc3ccc(C)nc32)C1	ZINC001020275886	1317618940	/nfs/dbraw/zinc/61/89/40/1317618940.db2.gz	WNLXTGXBTIDAMT-SHTZXODSSA-N	0	3	329.831	3.146	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@H](NC(=O)C34CCC(CC3)C4)C2)c1	ZINC001020298649	1317633715	/nfs/dbraw/zinc/63/37/15/1317633715.db2.gz	PCUMPUPYFYUPMV-IAVKICJISA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc(C)c3cccnc23)C1	ZINC001020404275	1317682783	/nfs/dbraw/zinc/68/27/83/1317682783.db2.gz	PXUMYDXBGKWXBB-HDJSIYSDSA-N	0	3	329.831	3.146	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc3c(ccc(C)c3C)[nH]2)C1	ZINC001020469594	1317709668	/nfs/dbraw/zinc/70/96/68/1317709668.db2.gz	ZTSJVJNGIDGGIL-HDJSIYSDSA-N	0	3	331.847	3.388	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@H](NC(=O)C[C@@H]3CC=CCC3)C2)c1	ZINC001020473292	1317710109	/nfs/dbraw/zinc/71/01/09/1317710109.db2.gz	VEFCHHWHLOTRSE-ZTFGCOKTSA-N	0	3	341.430	3.181	20	30		EGEDHN
CC1(C)CC(CC(=O)N[C@H]2C[C@H](NCc3ccc(C#N)cc3F)C2)C1	ZINC001020503855	1317733187	/nfs/dbraw/zinc/73/31/87/1317733187.db2.gz	VRHFQNZXPKAUNU-QAQDUYKDSA-N	0	3	343.446	3.260	20	30		EGEDHN
C[C@H]1CCC[C@]1(C)C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001020555981	1317769565	/nfs/dbraw/zinc/76/95/65/1317769565.db2.gz	XGFQJNNEQUEYSD-FDRFZEDHSA-N	0	3	343.446	3.260	20	30		EGEDHN
C#C[C@@H](CC)NCc1cc(Br)c(OC)c(OCC)c1	ZINC000809686334	1317862655	/nfs/dbraw/zinc/86/26/55/1317862655.db2.gz	LTQVNMIRHZKJGQ-LBPRGKRZSA-N	0	3	326.234	3.358	20	30		EGEDHN
Cc1nn(-c2ccccc2C)c(C)c1/C=C1/C(=O)c2ncnn2C1C	ZINC000905083791	1317921461	/nfs/dbraw/zinc/92/14/61/1317921461.db2.gz	FGXRELJHWGREMQ-FSEGOYHTSA-N	0	3	333.395	3.230	20	30		EGEDHN
C[C@@H](COCC1CCCCC1)N[C@@H](C)C(=O)Nc1ccccc1C#N	ZINC000905857838	1318009629	/nfs/dbraw/zinc/00/96/29/1318009629.db2.gz	IEVVGXIBLITEJH-HOTGVXAUSA-N	0	3	343.471	3.460	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)c2cccc(C#N)n2)cc1	ZINC000810532632	1318019662	/nfs/dbraw/zinc/01/96/62/1318019662.db2.gz	VJXSWCHEYQFQOP-KRWDZBQOSA-N	0	3	346.390	3.257	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc3c(s2)CC[C@@H](C)C3)C1	ZINC001021036319	1318057530	/nfs/dbraw/zinc/05/75/30/1318057530.db2.gz	VZVIAMQYCYHFSL-LERXQTSPSA-N	0	3	338.904	3.476	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H](C)c2ccc(F)c(F)c2)C1	ZINC001021072006	1318067459	/nfs/dbraw/zinc/06/74/59/1318067459.db2.gz	UZSZHNQFBHLQDD-DRZSPHRISA-N	0	3	328.790	3.058	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc(N(C)CCC)cc2)C1	ZINC001021135502	1318108834	/nfs/dbraw/zinc/10/88/34/1318108834.db2.gz	HKFCRISWZKVWNT-WKILWMFISA-N	0	3	335.879	3.136	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cscc2C(F)(F)F)C1	ZINC001021144318	1318111654	/nfs/dbraw/zinc/11/16/54/1318111654.db2.gz	DKRWVHOHVBGORY-KYZUINATSA-N	0	3	338.782	3.370	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC000959891120	1318253926	/nfs/dbraw/zinc/25/39/26/1318253926.db2.gz	ZATBIBJJWJMNPT-YOEHRIQHSA-N	0	3	331.435	3.214	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC000959958447	1318290359	/nfs/dbraw/zinc/29/03/59/1318290359.db2.gz	QRBOPNCCOZFNNV-INIZCTEOSA-N	0	3	347.409	3.431	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC000959961072	1318291688	/nfs/dbraw/zinc/29/16/88/1318291688.db2.gz	JXXCFHVJOAHMRO-DLBZAZTESA-N	0	3	343.446	3.214	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cccc3c2CCCC3)C1	ZINC001021593284	1318438506	/nfs/dbraw/zinc/43/85/06/1318438506.db2.gz	VLTUKRLQEBHUGP-WIYYLYMNSA-N	0	3	336.479	3.125	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cccc(Cl)c2C)C1	ZINC001021594922	1318439481	/nfs/dbraw/zinc/43/94/81/1318439481.db2.gz	RPLMZRABXYATFM-MAUKXSAKSA-N	0	3	330.859	3.208	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc3ccccc3nc2C)C1	ZINC001021599575	1318442529	/nfs/dbraw/zinc/44/25/29/1318442529.db2.gz	HVHSUOMSQRGLRD-RXVVDRJESA-N	0	3	347.462	3.103	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccnc2ccccc21	ZINC000960282298	1318444016	/nfs/dbraw/zinc/44/40/16/1318444016.db2.gz	ZSMBZFMPQGMTRN-NHCUHLMSSA-N	0	3	343.430	3.406	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1c(C)onc1C1CC1	ZINC000960289319	1318445999	/nfs/dbraw/zinc/44/59/99/1318445999.db2.gz	WNHXVMKNHXIKBI-VQIMIIECSA-N	0	3	337.423	3.032	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc(C2CC2)on1	ZINC000960293876	1318448251	/nfs/dbraw/zinc/44/82/51/1318448251.db2.gz	WCWWFAYDHIOVAH-VQIMIIECSA-N	0	3	337.423	3.114	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)C1CCC(F)CC1	ZINC000960302921	1318451770	/nfs/dbraw/zinc/45/17/70/1318451770.db2.gz	NSPHVQYGGCLNDH-IZVXFFJCSA-N	0	3	330.447	3.463	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1c2ccc(C)cc2[C@@H]2CN(C)CC[C@@H]21	ZINC000812845770	1318470560	/nfs/dbraw/zinc/47/05/60/1318470560.db2.gz	MQUGMCIRSNBQRY-UNMCSNQZSA-N	0	3	344.458	3.353	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)Cc2cccc(C(C)C)c2)C1	ZINC001021623710	1318473913	/nfs/dbraw/zinc/47/39/13/1318473913.db2.gz	KXSAMDSORUBSND-SFTDATJTSA-N	0	3	338.495	3.299	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(C)n(CC)c2C)C1	ZINC001021623950	1318474350	/nfs/dbraw/zinc/47/43/50/1318474350.db2.gz	QLPBXUCYPABYAU-AZUAARDMSA-N	0	3	341.499	3.075	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cn(C)c3ccccc23)C1	ZINC001021628484	1318481592	/nfs/dbraw/zinc/48/15/92/1318481592.db2.gz	WLVOPCMCVWTRCB-XLIONFOSSA-N	0	3	349.478	3.128	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc3cc(C)ccc3[nH]2)C1	ZINC001021647856	1318505402	/nfs/dbraw/zinc/50/54/02/1318505402.db2.gz	GYONPDGHYSVMDQ-UTKZUKDTSA-N	0	3	349.478	3.426	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)Cc2ccc(CC)cc2)C1	ZINC001021674286	1318537571	/nfs/dbraw/zinc/53/75/71/1318537571.db2.gz	AKMKCSSGVVAVJW-NHCUHLMSSA-N	0	3	338.495	3.128	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)CCc2ccccc2C)C1	ZINC001021678406	1318547598	/nfs/dbraw/zinc/54/75/98/1318547598.db2.gz	YCUBOUSNIKARNP-NHCUHLMSSA-N	0	3	338.495	3.264	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(Cl)c(F)c2)C1	ZINC001021677847	1318547914	/nfs/dbraw/zinc/54/79/14/1318547914.db2.gz	SSZLLHJKKXRNBA-WMLDXEAASA-N	0	3	334.822	3.039	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccsc2Cl)C1	ZINC001021681891	1318553251	/nfs/dbraw/zinc/55/32/51/1318553251.db2.gz	JTRHUMGXUSASIM-UKRRQHHQSA-N	0	3	336.888	3.351	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cccc3ccsc32)C1	ZINC001021708328	1318583866	/nfs/dbraw/zinc/58/38/66/1318583866.db2.gz	CRSMMLAKGDVOFU-AEFFLSMTSA-N	0	3	338.476	3.461	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(C(F)F)o2)C1	ZINC001021723985	1318614419	/nfs/dbraw/zinc/61/44/19/1318614419.db2.gz	HRAMJJKIBZQCTG-KBPBESRZSA-N	0	3	336.382	3.167	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)Cc2sc(C)cc2C)C1	ZINC001021725761	1318615991	/nfs/dbraw/zinc/61/59/91/1318615991.db2.gz	VZDZNPDSTFIQPS-QZTJIDSGSA-N	0	3	344.524	3.244	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc3c(s2)CCCC3)C1	ZINC001021729505	1318629279	/nfs/dbraw/zinc/62/92/79/1318629279.db2.gz	ZYPBTPDRUYTRHZ-SJORKVTESA-N	0	3	342.508	3.187	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cncc3ccccc32)C1	ZINC001021741128	1318651964	/nfs/dbraw/zinc/65/19/64/1318651964.db2.gz	ZCWLUFAYGGIIAD-NQIIRXRSSA-N	0	3	347.462	3.185	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC000814106278	1318676564	/nfs/dbraw/zinc/67/65/64/1318676564.db2.gz	RKRHRWAIZUDSLQ-UHFFFAOYSA-N	0	3	330.472	3.378	20	30		EGEDHN
C=CCNC(=O)Nc1ccc(NC(=O)[C@H](N)C2CCCCCC2)cc1	ZINC000912209766	1318849407	/nfs/dbraw/zinc/84/94/07/1318849407.db2.gz	YQINSQSBELMKIL-QGZVFWFLSA-N	0	3	344.459	3.230	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)Cc2ccc(C)cc2Cl)C1	ZINC001022303099	1318885662	/nfs/dbraw/zinc/88/56/62/1318885662.db2.gz	UQNKYZWIHPUXJP-OKILXGFUSA-N	0	3	327.255	3.180	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]1CN(C)Cc1ccc(CO)cc1	ZINC000960787148	1318889361	/nfs/dbraw/zinc/88/93/61/1318889361.db2.gz	MSFXWFQZHCXOSN-LJQANCHMSA-N	0	3	344.499	3.204	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]1CN(C)Cc1ccc(C#N)cc1	ZINC000960787168	1318891050	/nfs/dbraw/zinc/89/10/50/1318891050.db2.gz	HRSHKKPWJLYSIA-SFHVURJKSA-N	0	3	325.456	3.193	20	30		EGEDHN
CC(N=Nc1cnccn1)c1ccc([O-])c(C[NH+]2CCCCC2)c1	ZINC000912961307	1318955153	/nfs/dbraw/zinc/95/51/53/1318955153.db2.gz	GLCXIRHVPWOJOY-UHFFFAOYSA-N	0	3	325.416	3.004	20	30		EGEDHN
CC[C@@H]1CCC[C@@H]1C(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001022661181	1319049717	/nfs/dbraw/zinc/04/97/17/1319049717.db2.gz	KTTKABXABKQFDC-BGTYHANMSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@@H](NCc3cccc(C(C)C)n3)C2)C1	ZINC001022675120	1319061790	/nfs/dbraw/zinc/06/17/90/1319061790.db2.gz	OQLPGJVVPZMGDO-CALCHBBNSA-N	0	3	327.472	3.298	20	30		EGEDHN
N#CC(C(=O)COc1ccc(Cl)c(F)c1)C(=O)Nc1ccccc1	ZINC000815907459	1319071414	/nfs/dbraw/zinc/07/14/14/1319071414.db2.gz	BAENNJLRXXUQSJ-CYBMUJFWSA-N	0	3	346.745	3.205	20	30		EGEDHN
Cc1cc(C#N)cnc1C(=O)OC[C@H]1CCCCN1Cc1ccccc1	ZINC000816073982	1319096697	/nfs/dbraw/zinc/09/66/97/1319096697.db2.gz	MGJHAFDKUMWGGP-LJQANCHMSA-N	0	3	349.434	3.473	20	30		EGEDHN
C[C@H](NC[C@H](O)CC#N)c1ccc(OCc2ccc(F)cc2)cc1	ZINC000930212442	1328813108	/nfs/dbraw/zinc/81/31/08/1328813108.db2.gz	FRAZPJZFTHWXHX-KBXCAEBGSA-N	0	3	328.387	3.330	20	30		EGEDHN
CCCC(=O)N1CCC[C@H]([C@@H]2CCN(Cc3ccccc3C#N)C2)C1	ZINC000961100708	1319210951	/nfs/dbraw/zinc/21/09/51/1319210951.db2.gz	RAEGVIUYIMMFLD-VQTJNVASSA-N	0	3	339.483	3.419	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)c2coc3ccccc23)C1	ZINC001023165455	1319301965	/nfs/dbraw/zinc/30/19/65/1319301965.db2.gz	DKZQJWSSUXWCPQ-TXEJJXNPSA-N	0	3	349.228	3.192	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc(N(C)CCC)cc2)C1	ZINC001023168022	1319302206	/nfs/dbraw/zinc/30/22/06/1319302206.db2.gz	HKFCRISWZKVWNT-IYBDPMFKSA-N	0	3	335.879	3.136	20	30		EGEDHN
N#Cc1cc(C(=O)NC[C@H]2CCCN(C/C=C\c3ccccc3)C2)c[nH]1	ZINC001023314396	1319438784	/nfs/dbraw/zinc/43/87/84/1319438784.db2.gz	LKFPAAFFRAKTQU-MPYGFJLXSA-N	0	3	348.450	3.042	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](C2CCN(C(=O)c3ccncc3)CC2)C1	ZINC000961324644	1319481221	/nfs/dbraw/zinc/48/12/21/1319481221.db2.gz	YFOSSXNGAWWMAX-SFHVURJKSA-N	0	3	347.890	3.398	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc(C(F)F)ccc2F)C1	ZINC001023372536	1319484331	/nfs/dbraw/zinc/48/43/31/1319484331.db2.gz	UGIMJLVSOPLFKC-CYBMUJFWSA-N	0	3	338.373	3.228	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NC[C@H]1CCCN(C[C@@H](F)CC)C1	ZINC001023448002	1319549248	/nfs/dbraw/zinc/54/92/48/1319549248.db2.gz	BYTYJBGQYIKSAS-SJORKVTESA-N	0	3	348.462	3.441	20	30		EGEDHN
C#CCN1CCC[C@H](CNC(=O)c2cc3cccc(C)c3s2)C1	ZINC001023449102	1319552802	/nfs/dbraw/zinc/55/28/02/1319552802.db2.gz	HLQQFMGVDCRZFV-OAHLLOKOSA-N	0	3	326.465	3.285	20	30		EGEDHN
C#CCN(C)CCCNC(=O)/C=C(/C)c1cccc(C(F)(F)F)c1	ZINC000818611880	1319569552	/nfs/dbraw/zinc/56/95/52/1319569552.db2.gz	GUFJHLOMQBXXLT-OWBHPGMISA-N	0	3	338.373	3.180	20	30		EGEDHN
C#CCN(C)CCCNC(=O)/C=C(\C)c1cccc(C(F)(F)F)c1	ZINC000818611881	1319569613	/nfs/dbraw/zinc/56/96/13/1319569613.db2.gz	GUFJHLOMQBXXLT-WYMLVPIESA-N	0	3	338.373	3.180	20	30		EGEDHN
COC(=O)[C@@H]1C[C@@H]2[C@H](CC[C@@H](C)N2CCCCC2(C#N)CCC2)O1	ZINC000930350379	1328839409	/nfs/dbraw/zinc/83/94/09/1328839409.db2.gz	GYFWBYQELYQHDS-NCOADZHNSA-N	0	3	334.460	3.034	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2)C1	ZINC001023637147	1319757889	/nfs/dbraw/zinc/75/78/89/1319757889.db2.gz	FGXSVXQFNGHVIR-AYOQOUSVSA-N	0	3	344.886	3.295	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc(-c3ccccc3)ccn2)C1	ZINC001023670300	1319784499	/nfs/dbraw/zinc/78/44/99/1319784499.db2.gz	PPLCBEMDBSQPPC-GOSISDBHSA-N	0	3	347.462	3.214	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1Cl)C(=O)c1cccc2c1OCO2	ZINC000917426736	1319806628	/nfs/dbraw/zinc/80/66/28/1319806628.db2.gz	OJHGQGCPLLIFHM-NSHDSACASA-N	0	3	342.738	3.030	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cnc(CC(C)(C)C)s2)C1	ZINC001023689951	1319810637	/nfs/dbraw/zinc/81/06/37/1319810637.db2.gz	VELPGEAVWSKVPW-OAHLLOKOSA-N	0	3	347.528	3.197	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2csc3c2CC[C@@H](C)C3)C1	ZINC001023734191	1319876642	/nfs/dbraw/zinc/87/66/42/1319876642.db2.gz	XOZMAOAXXDNJQT-HZPDHXFCSA-N	0	3	344.524	3.338	20	30		EGEDHN
N#Cc1ccccc1CNCC1CC(NC(=O)[C@@]23C[C@@H]2CCCC3)C1	ZINC000962283551	1319900447	/nfs/dbraw/zinc/90/04/47/1319900447.db2.gz	UICYWZYASOECAY-UHUBEZDKSA-N	0	3	337.467	3.123	20	30		EGEDHN
C#C[C@H](NC(=O)N(CCC)[C@@H]1CCN(C)C1)c1ccc(Cl)cc1	ZINC000820552386	1319908665	/nfs/dbraw/zinc/90/86/65/1319908665.db2.gz	IXQSWBPODLRSIO-SJORKVTESA-N	0	3	333.863	3.140	20	30		EGEDHN
Cc1cc(C(=O)NC2CC(CNCc3ccccc3C#N)C2)cs1	ZINC000962424077	1319956918	/nfs/dbraw/zinc/95/69/18/1319956918.db2.gz	SWRJUKUKCRAKHB-UHFFFAOYSA-N	0	3	339.464	3.226	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)=C([O-])c2cccc(C[NH+](C)C)c2)cc1	ZINC000821620095	1320023078	/nfs/dbraw/zinc/02/30/78/1320023078.db2.gz	XXJQWCQVVDJYFF-IBGZPJMESA-N	0	3	349.434	3.272	20	30		EGEDHN
Cc1ccc(C(=O)N(CCN(C)C)Cc2ccsc2)cc1C#N	ZINC000838185063	1320742456	/nfs/dbraw/zinc/74/24/56/1320742456.db2.gz	DCEQBWKFBLDEKB-UHFFFAOYSA-N	0	3	327.453	3.132	20	30		EGEDHN
CC(C)(C)OC(=O)[C@]1(C)CCN(Cc2ccc(OCC#N)cc2)C1	ZINC000839102870	1320869976	/nfs/dbraw/zinc/86/99/76/1320869976.db2.gz	SZTVGFCDMWSBMB-LJQANCHMSA-N	0	3	330.428	3.143	20	30		EGEDHN
C[C@@H]1CC(C)(C)CN1Cc1cc(=O)n2c3ccccc3[nH]c2c1C#N	ZINC000839658406	1320954458	/nfs/dbraw/zinc/95/44/58/1320954458.db2.gz	MSOSFXMIMSPGQP-HIFRSBDPSA-N	0	3	334.423	3.344	20	30		EGEDHN
CCCCCCCOc1cccc(CN2CC[C@H](O)[C@H](CO)C2)c1	ZINC000840975301	1321192054	/nfs/dbraw/zinc/19/20/54/1321192054.db2.gz	MZQQZRWAQWYPIM-ICSRJNTNSA-N	0	3	335.488	3.211	20	30		EGEDHN
C[C@@H]1[C@H](C)CN(CC(=O)C(C#N)c2nc3ccccc3s2)[C@H]1C	ZINC000842166250	1321356715	/nfs/dbraw/zinc/35/67/15/1321356715.db2.gz	JVWBDPYOHFJDFU-MQYQWHSLSA-N	0	3	327.453	3.449	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(C[C@H]3CC3(Cl)Cl)CC2)cc1	ZINC000842212400	1321362631	/nfs/dbraw/zinc/36/26/31/1321362631.db2.gz	AWPKRWZKXWUMPJ-MRXNPFEDSA-N	0	3	338.282	3.260	20	30		EGEDHN
C[C@@H](C#N)Oc1ccccc1NC(=O)NC[C@@H]1CCCCN1C1CC1	ZINC000930760838	1328960186	/nfs/dbraw/zinc/96/01/86/1328960186.db2.gz	LFZUFVXELRGPGF-HOCLYGCPSA-N	0	3	342.443	3.116	20	30		EGEDHN
N#CC[C@@]1(O)CCN(Cc2ccc3c(c2)CCN3Cc2ccccc2)C1	ZINC000843425145	1321516054	/nfs/dbraw/zinc/51/60/54/1321516054.db2.gz	FTHAVRPIQLMHGG-JOCHJYFZSA-N	0	3	347.462	3.100	20	30		EGEDHN
C[C@H](C(=O)NC1CC(CNCc2ccccc2C#N)C1)C1CCCC1	ZINC000962518588	1321982993	/nfs/dbraw/zinc/98/29/93/1321982993.db2.gz	IKRZUDNDLGVRLH-SHPPYHEDSA-N	0	3	339.483	3.369	20	30		EGEDHN
N#CC(C(=O)[C@@H]1CC(=O)N[C@H]2CCCC[C@@H]12)c1ccc2ccccc2n1	ZINC000850740909	1322281666	/nfs/dbraw/zinc/28/16/66/1322281666.db2.gz	ATKHFZRWHGHGOP-DFGXFYAUSA-N	0	3	347.418	3.106	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)CC2(C#N)CCCCC2)cc1	ZINC000850761400	1322285763	/nfs/dbraw/zinc/28/57/63/1322285763.db2.gz	LZFKSTHTNLLUCQ-MRXNPFEDSA-N	0	3	339.395	3.207	20	30		EGEDHN
CC(=O)N[C@H](CCC(C)C)C(=O)C(C#N)c1nc(C(C)C)cs1	ZINC000850872821	1322304690	/nfs/dbraw/zinc/30/46/90/1322304690.db2.gz	GNFQOHNIIXXZQF-UONOGXRCSA-N	0	3	335.473	3.384	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCN(C(=O)[C@]23C[C@H]2CCC3)C1	ZINC001024071787	1323109407	/nfs/dbraw/zinc/10/94/07/1323109407.db2.gz	HVHZTPLENSPFOH-LDQXTDLNSA-N	0	3	337.467	3.077	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H](CNCc3csc(CC)n3)C2)C1	ZINC001024148641	1323173413	/nfs/dbraw/zinc/17/34/13/1323173413.db2.gz	ZHZRVOADBKEIFG-OAHLLOKOSA-N	0	3	347.528	3.390	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCN(C(=O)C2CC3(CC3)C2)C1	ZINC001024149205	1323175257	/nfs/dbraw/zinc/17/52/57/1323175257.db2.gz	HFFWYOHPFPTTIX-INIZCTEOSA-N	0	3	337.467	3.077	20	30		EGEDHN
COc1ccc(CN(C)CC(C)(C)NC(=O)OC(C)(C)C)cc1C#N	ZINC000852307398	1323177209	/nfs/dbraw/zinc/17/72/09/1323177209.db2.gz	VXSDJDQHMHSXCQ-UHFFFAOYSA-N	0	3	347.459	3.302	20	30		EGEDHN
CCC(=O)N1CCC[C@H]([C@H]2CCCN2Cc2cc(C#N)ccc2F)C1	ZINC000963213466	1323238984	/nfs/dbraw/zinc/23/89/84/1323238984.db2.gz	AALRSMZBDUJWSJ-QFBILLFUSA-N	0	3	343.446	3.310	20	30		EGEDHN
C=CCCN1CCCC[C@H]1CNC(=O)c1c(F)c(F)cc(F)c1F	ZINC001024446890	1323405820	/nfs/dbraw/zinc/40/58/20/1323405820.db2.gz	KIAAJBADUWYZBN-NSHDSACASA-N	0	3	344.352	3.403	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1cccc2c(C)c(C)[nH]c21	ZINC001024513048	1323463352	/nfs/dbraw/zinc/46/33/52/1323463352.db2.gz	MKGXQLGTXVHGGJ-KRWDZBQOSA-N	0	3	337.467	3.392	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1c(C)c(F)ccc1Cl	ZINC001024515621	1323465303	/nfs/dbraw/zinc/46/53/03/1323465303.db2.gz	XIVZUUXOSOQEII-AWEZNQCLSA-N	0	3	336.838	3.395	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cnc2ccsc2c1	ZINC001024593942	1323527145	/nfs/dbraw/zinc/52/71/45/1323527145.db2.gz	UFUYXAXIMWSDOI-OAHLLOKOSA-N	0	3	329.469	3.457	20	30		EGEDHN
C=CCCN1CCCC[C@H]1CNC(=O)c1cnc([C@@H]2CCCO2)s1	ZINC001024695521	1323612052	/nfs/dbraw/zinc/61/20/52/1323612052.db2.gz	AIXIMSYJRXITTB-GJZGRUSLSA-N	0	3	349.500	3.155	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cccc(N2CCCC2)c1	ZINC001024728137	1323630821	/nfs/dbraw/zinc/63/08/21/1323630821.db2.gz	RXNLWNPAGGKAEX-HXUWFJFHSA-N	0	3	341.499	3.447	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccc2ccn(C)c2c1	ZINC001024738600	1323638555	/nfs/dbraw/zinc/63/85/55/1323638555.db2.gz	AXCHVBXLBJIPRD-SFHVURJKSA-N	0	3	325.456	3.339	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccccc1OC(C)C	ZINC001024767765	1323666995	/nfs/dbraw/zinc/66/69/95/1323666995.db2.gz	IGBZOBNHQOEBTO-KRWDZBQOSA-N	0	3	328.456	3.081	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCCCN2Cc2cccc(C)c2)cn1	ZINC001024770602	1323668932	/nfs/dbraw/zinc/66/89/32/1323668932.db2.gz	VLQKYGMDZANMDN-NRFANRHFSA-N	0	3	347.462	3.156	20	30		EGEDHN
C=CCCN1CCCC[C@H]1CNC(=O)c1ccc(Br)o1	ZINC001024776320	1323677548	/nfs/dbraw/zinc/67/75/48/1323677548.db2.gz	XJLJWLOANZTRIU-LBPRGKRZSA-N	0	3	341.249	3.203	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccsc1C(F)(F)F	ZINC001024778474	1323681813	/nfs/dbraw/zinc/68/18/13/1323681813.db2.gz	ZHIRTZNKKBYRQB-GFCCVEGCSA-N	0	3	344.402	3.375	20	30		EGEDHN
CC(C)c1cccc(CNC[C@H]2CCCCN2C(=O)C#CC2CC2)n1	ZINC001024959784	1323802361	/nfs/dbraw/zinc/80/23/61/1323802361.db2.gz	IZEJCGRBFVBQSI-LJQANCHMSA-N	0	3	339.483	3.089	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@H]1CNCc1ccc(Cl)nc1	ZINC001025041087	1323842980	/nfs/dbraw/zinc/84/29/80/1323842980.db2.gz	SPLOLYDSDCZXKB-HNNXBMFYSA-N	0	3	335.879	3.418	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCCC[C@H]1CNCc1ccnc(OC)c1	ZINC001025069756	1323870200	/nfs/dbraw/zinc/87/02/00/1323870200.db2.gz	ODCTZNRNPOLTLD-PXNSSMCTSA-N	0	3	345.487	3.163	20	30		EGEDHN
CCC1(C(=O)N2CCCC[C@@H]2CNCc2ccc(C#N)cc2F)CC1	ZINC001025072508	1323873461	/nfs/dbraw/zinc/87/34/61/1323873461.db2.gz	XKJZBBXNLSKORQ-QGZVFWFLSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCCC[C@@H]2CNCc2ccc(C#N)s2)C1	ZINC001025074531	1323876380	/nfs/dbraw/zinc/87/63/80/1323876380.db2.gz	NUFDPEODEXLRPS-OAHLLOKOSA-N	0	3	343.496	3.447	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1scnc1C	ZINC001025197013	1323981810	/nfs/dbraw/zinc/98/18/10/1323981810.db2.gz	FEZUKQKGSHGZJX-CVEARBPZSA-N	0	3	333.501	3.487	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(CC)ccn1	ZINC001025231590	1324018094	/nfs/dbraw/zinc/01/80/94/1324018094.db2.gz	IBKZHTUCCVLLBT-UXHICEINSA-N	0	3	339.483	3.126	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)Cc1c(C)cccc1C	ZINC001025236132	1324024406	/nfs/dbraw/zinc/02/44/06/1324024406.db2.gz	DIIGEUQKBQXOND-SFTDATJTSA-N	0	3	338.495	3.325	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)CC1CC(F)(F)C1	ZINC001025243184	1324038779	/nfs/dbraw/zinc/03/87/79/1324038779.db2.gz	AOUDWOVAGUCYIT-DLBZAZTESA-N	0	3	338.442	3.291	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)C12CCC(CC1)C2	ZINC001025243989	1324040757	/nfs/dbraw/zinc/04/07/57/1324040757.db2.gz	GGWJFZLSKWYBON-JMDAGXMHSA-N	0	3	328.500	3.436	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc(CC)o1	ZINC001025243722	1324040808	/nfs/dbraw/zinc/04/08/08/1324040808.db2.gz	DXGMMAAPTQRLGQ-ZWKOTPCHSA-N	0	3	328.456	3.324	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ncc(F)cc1F	ZINC001025246343	1324046209	/nfs/dbraw/zinc/04/62/09/1324046209.db2.gz	WCXGHJNYIAIBLB-CVEARBPZSA-N	0	3	335.398	3.005	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)C1(C2CCC2)CCC1	ZINC001025256505	1324063094	/nfs/dbraw/zinc/06/30/94/1324063094.db2.gz	YCFUAVPJINRJQA-MOPGFXCFSA-N	0	3	328.500	3.436	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1conc1C1CC1	ZINC001025269956	1324084735	/nfs/dbraw/zinc/08/47/35/1324084735.db2.gz	YWUDVEKEAHKVES-IAGOWNOFSA-N	0	3	329.444	3.197	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)C1(C(C)(F)F)CC1	ZINC001025273543	1324089288	/nfs/dbraw/zinc/08/92/88/1324089288.db2.gz	QBICDDQHBAZIKN-CVEARBPZSA-N	0	3	338.442	3.291	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1nc(CC)oc1C	ZINC001025277065	1324098114	/nfs/dbraw/zinc/09/81/14/1324098114.db2.gz	NAFYDSCNWYTDCL-CVEARBPZSA-N	0	3	331.460	3.191	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cccc2c1ccn2C	ZINC001025276233	1324098754	/nfs/dbraw/zinc/09/87/54/1324098754.db2.gz	HLUIMWLLMYXKAW-RTWAWAEBSA-N	0	3	349.478	3.271	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ncoc1C(C)C	ZINC001025286885	1324108463	/nfs/dbraw/zinc/10/84/63/1324108463.db2.gz	LYAXBCPREBJVQB-DLBZAZTESA-N	0	3	343.471	3.280	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc2ccccc2n1	ZINC001025292657	1324117763	/nfs/dbraw/zinc/11/77/63/1324117763.db2.gz	LCXWYURYMYLLDD-SFTDATJTSA-N	0	3	347.462	3.327	20	30		EGEDHN
C[C@H](NC(=O)C1CCCC1)[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001025318518	1324154839	/nfs/dbraw/zinc/15/48/39/1324154839.db2.gz	BDZUOBCUHHEXQZ-OXJNMPFZSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cccc(OCCC)c2)C1	ZINC001025430490	1324266150	/nfs/dbraw/zinc/26/61/50/1324266150.db2.gz	FKDPJENHLJCQID-IEBWSBKVSA-N	0	3	342.483	3.329	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2conc2C2CCCC2)C1	ZINC001025437769	1324276735	/nfs/dbraw/zinc/27/67/35/1324276735.db2.gz	AKXORYNDEDIQPE-RDJZCZTQSA-N	0	3	343.471	3.186	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(C)nn2C(CC)CC)C1	ZINC001025462061	1324307371	/nfs/dbraw/zinc/30/73/71/1324307371.db2.gz	AHZLMWJRJPBGHS-IAGOWNOFSA-N	0	3	344.503	3.016	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2c(F)ccc(C)c2F)C1	ZINC001025524002	1324369913	/nfs/dbraw/zinc/36/99/13/1324369913.db2.gz	RLMNRLRETIVLFW-CABCVRRESA-N	0	3	334.410	3.127	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc3nc(C)ccc3c2)C1	ZINC001025564051	1324409585	/nfs/dbraw/zinc/40/95/85/1324409585.db2.gz	GZQLKIOHVOBKGP-XLIONFOSSA-N	0	3	349.478	3.397	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc3cccnc3s2)C1	ZINC001025586791	1324428803	/nfs/dbraw/zinc/42/88/03/1324428803.db2.gz	FLMBOOQQSXEBOR-HOCLYGCPSA-N	0	3	341.480	3.150	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc3cnccc3c2)C1	ZINC001025587760	1324431883	/nfs/dbraw/zinc/43/18/83/1324431883.db2.gz	PNIYCJNDVVTYNU-UZLBHIALSA-N	0	3	335.451	3.088	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2[nH]ccc2-c2ccccc2)C1	ZINC001025591486	1324437978	/nfs/dbraw/zinc/43/79/78/1324437978.db2.gz	CIWZLYVHQPBOGH-SJLPKXTDSA-N	0	3	335.451	3.145	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(C)c3c2CCC3)C1	ZINC001025629766	1324481060	/nfs/dbraw/zinc/48/10/60/1324481060.db2.gz	KJYIYAFXFDWSCN-MSOLQXFVSA-N	0	3	338.495	3.337	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2csc(CC(C)C)n2)C1	ZINC001025631667	1324483172	/nfs/dbraw/zinc/48/31/72/1324483172.db2.gz	CTBQIWFZLWRUMQ-CVEARBPZSA-N	0	3	347.528	3.195	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2oc3ccccc3c2CC)C1	ZINC001025633582	1324485316	/nfs/dbraw/zinc/48/53/16/1324485316.db2.gz	WNBQNTKTRVDBSB-HZPDHXFCSA-N	0	3	338.451	3.459	20	30		EGEDHN
Cc1ccc(C(=O)N2C[C@@H]3CC[C@@H](NCc4ccccc4C#N)[C@@H]3C2)o1	ZINC001026188720	1324653788	/nfs/dbraw/zinc/65/37/88/1324653788.db2.gz	KHSFZVZTGCZIEW-IPMKNSEASA-N	0	3	349.434	3.100	20	30		EGEDHN
CC(C)=C(F)C(=O)N1C[C@@H]2CC[C@H](NCc3ccccc3C#N)[C@H]2C1	ZINC001026240673	1324684198	/nfs/dbraw/zinc/68/41/98/1324684198.db2.gz	MRDROSNRZZXCCR-BZSNNMDCSA-N	0	3	341.430	3.148	20	30		EGEDHN
CC(C(=O)N1C[C@@H]2CC[C@H](NCc3ccccc3C#N)[C@@H]2C1)=C1CCC1	ZINC001026264092	1324691302	/nfs/dbraw/zinc/69/13/02/1324691302.db2.gz	QXKZSOKFQOWIQY-HBMCJLEFSA-N	0	3	349.478	3.385	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H]2CC[C@H](NCc3nccs3)[C@H]2C1	ZINC001026327154	1324728267	/nfs/dbraw/zinc/72/82/67/1324728267.db2.gz	XYGHBMBDFGLUSV-KKUMJFAQSA-N	0	3	333.501	3.072	20	30		EGEDHN
Cc1cocc1C(=O)N1C[C@@H]2CC[C@H](NCc3ccccc3C#N)[C@@H]2C1	ZINC001026331168	1324731676	/nfs/dbraw/zinc/73/16/76/1324731676.db2.gz	QAYNXIUYHMUCNY-NSHGMRRFSA-N	0	3	349.434	3.100	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC1CCC(NC(=O)C=C2CCC2)CC1	ZINC001026474363	1324833026	/nfs/dbraw/zinc/83/30/26/1324833026.db2.gz	XTXAIBQMSIPODK-UHFFFAOYSA-N	0	3	341.430	3.325	20	30		EGEDHN
C[C@@]1(C(=O)NC2CCC(NCc3ccccc3C#N)CC2)C=CCC1	ZINC001026542648	1324879955	/nfs/dbraw/zinc/87/99/55/1324879955.db2.gz	VGRBDTJLJADMCR-GZNCHQMQSA-N	0	3	337.467	3.432	20	30		EGEDHN
C[C@@]1(C(=O)N2CC[C@H](CNCc3ccccc3C#N)C2)CC=CCC1	ZINC001026863786	1325051942	/nfs/dbraw/zinc/05/19/42/1325051942.db2.gz	RLFVYIREWSDPGD-DYESRHJHSA-N	0	3	337.467	3.243	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)Cc2cccnc2)C1	ZINC000963289172	1325074352	/nfs/dbraw/zinc/07/43/52/1325074352.db2.gz	GVTICFTVJJXZKH-MSOLQXFVSA-N	0	3	347.890	3.080	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](CNCc2oc(CCC)nc2C)C1	ZINC001026994919	1325132140	/nfs/dbraw/zinc/13/21/40/1325132140.db2.gz	ZYAXTSIYJPOWPD-OAHLLOKOSA-N	0	3	333.476	3.086	20	30		EGEDHN
C(=NOCCOCc1ccccc1)c1ccc(N2CCOCC2)cc1	ZINC000853643275	1325140051	/nfs/dbraw/zinc/14/00/51/1325140051.db2.gz	RWMDSOHVMNIXQV-UHFFFAOYSA-N	0	3	340.423	3.091	20	30		EGEDHN
CN(C(=O)c1cc[nH]c1)C1CCC(NCc2ccccc2C#N)CC1	ZINC000963348883	1325141089	/nfs/dbraw/zinc/14/10/89/1325141089.db2.gz	JACTYFAUDORGSM-UHFFFAOYSA-N	0	3	336.439	3.059	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)c2nccs2)C1	ZINC000963374674	1325180954	/nfs/dbraw/zinc/18/09/54/1325180954.db2.gz	RRJQUWHDQJVDOU-KBPBESRZSA-N	0	3	339.892	3.212	20	30		EGEDHN
CO[C@@H](C#N)c1ccc(-c2ccccc2CN2CCN(C)CC2)cc1	ZINC000854194782	1325226581	/nfs/dbraw/zinc/22/65/81/1325226581.db2.gz	PDDMCGGLTOBUFC-NRFANRHFSA-N	0	3	335.451	3.312	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)Cc2ccc[nH]2)C1	ZINC000963427132	1325236089	/nfs/dbraw/zinc/23/60/89/1325236089.db2.gz	DPGQDPSBRDRISL-RDJZCZTQSA-N	0	3	335.879	3.013	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@H](CNCc2ccccc2C#N)C1)c1ccccc1	ZINC001027176799	1325275293	/nfs/dbraw/zinc/27/52/93/1325275293.db2.gz	RBXSYIJLAODAJV-ZWKOTPCHSA-N	0	3	347.462	3.300	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)c2ccsc2)C1	ZINC001027288622	1325419402	/nfs/dbraw/zinc/41/94/02/1325419402.db2.gz	GEQMPZVUCKOFHY-SFHVURJKSA-N	0	3	339.464	3.356	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1scnc1CC)C2	ZINC000963932757	1325449147	/nfs/dbraw/zinc/44/91/47/1325449147.db2.gz	AYYPGRMVRPLFLD-UHFFFAOYSA-N	0	3	339.892	3.089	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC[C@H](N(C)Cc2ccc(OC)c(C#N)c2)C1	ZINC001027305177	1325449538	/nfs/dbraw/zinc/44/95/38/1325449538.db2.gz	JARPQSXDJHVVBC-YJBOKZPZSA-N	0	3	343.471	3.036	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1ccnc(C3CC3)c1)C2	ZINC000964225541	1325489776	/nfs/dbraw/zinc/48/97/76/1325489776.db2.gz	HNPXRAYGYXQLIM-UHFFFAOYSA-N	0	3	345.874	3.342	20	30		EGEDHN
CC1CC(C(=O)N2CCC[C@H](N(C)Cc3ccc(F)c(C#N)c3)C2)C1	ZINC001027362115	1325548171	/nfs/dbraw/zinc/54/81/71/1325548171.db2.gz	SOVXPCPMKYGXBY-PVARCSIZSA-N	0	3	343.446	3.166	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CCC[C@H](N(C)Cc2ccc(F)c(C#N)c2)C1	ZINC001027365447	1325555924	/nfs/dbraw/zinc/55/59/24/1325555924.db2.gz	UCZGIDJSADIEIF-INIZCTEOSA-N	0	3	347.409	3.384	20	30		EGEDHN
CC[C@H](SC)C(=O)N1CCC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001027371779	1325564931	/nfs/dbraw/zinc/56/49/31/1325564931.db2.gz	IZQZDAHLHSSPQG-MSOLQXFVSA-N	0	3	345.512	3.123	20	30		EGEDHN
CC(=O)N[C@H](c1ccccc1F)[C@H](C)NCc1ccc(C#N)c(F)c1	ZINC000926549755	1327611723	/nfs/dbraw/zinc/61/17/23/1327611723.db2.gz	IIIPODXLNHLWQX-BUXKBTBVSA-N	0	3	343.377	3.192	20	30		EGEDHN
CC(=O)N[C@H](c1ccccc1F)[C@@H](C)NCc1ccc(C#N)c(F)c1	ZINC000926549754	1327612191	/nfs/dbraw/zinc/61/21/91/1327612191.db2.gz	IIIPODXLNHLWQX-BLVKFPJESA-N	0	3	343.377	3.192	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)Cc2ccc(CCCC)cc2)C1	ZINC001027482654	1327737622	/nfs/dbraw/zinc/73/76/22/1327737622.db2.gz	FJWYIBBMVCALQD-HXUWFJFHSA-N	0	3	326.484	3.128	20	30		EGEDHN
C[C@H](NC[C@@H]1CCN1C(=O)OC(C)(C)C)c1ccc(C#N)c(F)c1	ZINC000927000935	1327813901	/nfs/dbraw/zinc/81/39/01/1327813901.db2.gz	NJJWLEGRMBTJLI-WFASDCNBSA-N	0	3	333.407	3.357	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@@H](N(C)Cc3ccc(C#N)cc3)C2)CC1	ZINC001027562884	1327882612	/nfs/dbraw/zinc/88/26/12/1327882612.db2.gz	YHBSNWJXXSXOQR-GOSISDBHSA-N	0	3	325.456	3.171	20	30		EGEDHN
N#Cc1ccc(NCCN[C@H]2CCCOc3cc(F)ccc32)nc1	ZINC000927166519	1327903168	/nfs/dbraw/zinc/90/31/68/1327903168.db2.gz	ZDBNFAJKCJYNTQ-INIZCTEOSA-N	0	3	326.375	3.008	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)c(F)c2)C1	ZINC001027585949	1327923592	/nfs/dbraw/zinc/92/35/92/1327923592.db2.gz	SWNFFACXMQXEJZ-KBAYOESNSA-N	0	3	343.446	3.166	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)[C@@H](CC)Cc2cccc(C)c2)C1	ZINC001027604944	1327961564	/nfs/dbraw/zinc/96/15/64/1327961564.db2.gz	TXUOULYRUACLHZ-VQTJNVASSA-N	0	3	326.484	3.120	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001027605914	1327964264	/nfs/dbraw/zinc/96/42/64/1327964264.db2.gz	YYAVDWDEGNQMHF-LPHOPBHVSA-N	0	3	327.472	3.273	20	30		EGEDHN
C=C(Cl)CN(C)[C@@H]1CCCN(C(=O)c2cccc3[nH]c(C)nc32)C1	ZINC001027642242	1328015570	/nfs/dbraw/zinc/01/55/70/1328015570.db2.gz	UPWXTALATVWYNE-CQSZACIVSA-N	0	3	346.862	3.160	20	30		EGEDHN
C[C@H](CC(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)cc2)C1)C1CC1	ZINC001027696868	1328106279	/nfs/dbraw/zinc/10/62/79/1328106279.db2.gz	RGYWFVIMSZGPFJ-OXQOHEQNSA-N	0	3	339.483	3.417	20	30		EGEDHN
N#Cc1ccc(C(=O)NC[C@@H]2CCCN2Cc2ccc(C3CC3)cc2)[nH]1	ZINC001027830720	1328286204	/nfs/dbraw/zinc/28/62/04/1328286204.db2.gz	HJUDZWZUZJSOSI-IBGZPJMESA-N	0	3	348.450	3.158	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cc(F)c3ccccc3c2)C1	ZINC000966600761	1328350787	/nfs/dbraw/zinc/35/07/87/1328350787.db2.gz	PLMWVPPGLPSSAY-QRWLVFNGSA-N	0	3	338.426	3.442	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1ocnc1-c1ccccc1	ZINC001027925971	1328403930	/nfs/dbraw/zinc/40/39/30/1328403930.db2.gz	HLYALZKUGMUDNF-MRXNPFEDSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H]1CNC(=O)c1cnc(CC2CC2)s1	ZINC001028047796	1328513568	/nfs/dbraw/zinc/51/35/68/1328513568.db2.gz	IPDZWFABXGXSPR-OAHLLOKOSA-N	0	3	333.501	3.256	20	30		EGEDHN
C#CC[C@@H](CCOC)[NH2+]Cc1ccc(OCc2ccccc2)cc1[O-]	ZINC000862548131	1329495821	/nfs/dbraw/zinc/49/58/21/1329495821.db2.gz	YKXHEYZVYZRNHY-IBGZPJMESA-N	0	3	339.435	3.489	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H](c3ccccc3)C3CC3)C2)CC1	ZINC001050591006	1348295427	/nfs/dbraw/zinc/29/54/27/1348295427.db2.gz	RJOGJUDGJDDYGK-FQEVSTJZSA-N	0	3	336.479	3.128	20	30		EGEDHN
C[Si](C)(CCN1CCC[C@@H](C#N)C1)CCN1CCC[C@H](C#N)C1	ZINC000932150330	1329789145	/nfs/dbraw/zinc/78/91/45/1329789145.db2.gz	BNGLUHCYPOWKCD-HDICACEKSA-N	0	3	332.568	3.166	20	30		EGEDHN
CC(C)(C)OC(=O)NCC[C@@H]1CCN(Cc2ccc(C#N)s2)C1	ZINC000932699602	1329835192	/nfs/dbraw/zinc/83/51/92/1329835192.db2.gz	KWXHZWPLPLNWFQ-CYBMUJFWSA-N	0	3	335.473	3.356	20	30		EGEDHN
C[C@@H](C(=O)N1CCCCC1)N1CCC(c2ccc(C#N)cc2)CC1	ZINC000933613648	1329906075	/nfs/dbraw/zinc/90/60/75/1329906075.db2.gz	DNFPXUYDOJRRLZ-INIZCTEOSA-N	0	3	325.456	3.139	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)Nc1cccc2c1CCN(CC(C)(C)O)C2	ZINC000935348038	1330046640	/nfs/dbraw/zinc/04/66/40/1330046640.db2.gz	FIPGJKLMQGQHNL-HNNXBMFYSA-N	0	3	330.472	3.356	20	30		EGEDHN
COc1cc(CN(C)C)ccc1NC(=O)Cc1ccccc1CC#N	ZINC000868816046	1330351670	/nfs/dbraw/zinc/35/16/70/1330351670.db2.gz	XXQOYIUQKLFSJJ-UHFFFAOYSA-N	0	3	337.423	3.004	20	30		EGEDHN
CC1(C(=O)N[C@H]2CCN(Cc3cccc(C#N)c3)CC2(C)C)CC1	ZINC000940767437	1331183975	/nfs/dbraw/zinc/18/39/75/1331183975.db2.gz	IDJBZSXUNYWFEB-KRWDZBQOSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cn(CC)c3ccccc23)[C@@H](C)C1	ZINC000942394628	1331924036	/nfs/dbraw/zinc/92/40/36/1331924036.db2.gz	SWBUQRVZQUHIPC-MAUKXSAKSA-N	0	3	325.456	3.287	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc3cc(C)ccc3n2)[C@@H](C)C1	ZINC000942430005	1331932150	/nfs/dbraw/zinc/93/21/50/1331932150.db2.gz	FOLLNRYMOWWVCD-FUHWJXTLSA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(-c3ccco3)o2)[C@H](C)C1	ZINC000942442948	1331934614	/nfs/dbraw/zinc/93/46/14/1331934614.db2.gz	BNSDFPGSIQHBJC-CABCVRRESA-N	0	3	326.396	3.003	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(Cc3cncc(C)c3)C[C@@H]2C)cc1	ZINC000942552483	1331970616	/nfs/dbraw/zinc/97/06/16/1331970616.db2.gz	FWIJCWXDXCPESK-LAUBAEHRSA-N	0	3	347.462	3.012	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2c(Cl)cncc2Cl)[C@@H](C)C1	ZINC000942593992	1331994984	/nfs/dbraw/zinc/99/49/84/1331994984.db2.gz	BGVLUDCXYJYBBQ-GWCFXTLKSA-N	0	3	328.243	3.015	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3ccc(C#N)cc3)C[C@@H]2C)C1	ZINC000942602840	1332000796	/nfs/dbraw/zinc/00/07/96/1332000796.db2.gz	OEWRYDJQQQHVKL-LPHOPBHVSA-N	0	3	337.467	3.241	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(CCc3csc(C)n3)C[C@H]2C)C1	ZINC000942608631	1332004338	/nfs/dbraw/zinc/00/43/38/1332004338.db2.gz	XWSNDVQVKQYQNC-PBHICJAKSA-N	0	3	347.528	3.177	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnc(CC(C)(C)C)s2)[C@@H](C)C1	ZINC000944033766	1332312801	/nfs/dbraw/zinc/31/28/01/1332312801.db2.gz	PLGABFMMFCRJFG-KBPBESRZSA-N	0	3	335.517	3.358	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc(Cl)cc(Cl)c2)[C@@H](C)C1	ZINC000944303330	1332367075	/nfs/dbraw/zinc/36/70/75/1332367075.db2.gz	CAEJWRAISJOKQU-XHDPSFHLSA-N	0	3	325.239	3.067	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc(Cl)c2Cl)[C@H](C)C1	ZINC000944303072	1332367332	/nfs/dbraw/zinc/36/73/32/1332367332.db2.gz	AETIIHMUDNLOTR-DOMZBBRYSA-N	0	3	339.266	3.457	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccccc2-c2ccccc2)[C@H](C)C1	ZINC000944698359	1332422588	/nfs/dbraw/zinc/42/25/88/1332422588.db2.gz	FRKMMEBKNOMERQ-UTKZUKDTSA-N	0	3	332.447	3.427	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3ccccc3n2CC)[C@H](C)C1	ZINC000945088046	1332496607	/nfs/dbraw/zinc/49/66/07/1332496607.db2.gz	ADROQLKDTVEQCJ-SJLPKXTDSA-N	0	3	337.467	3.125	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccccc2OCC2CC2)[C@H](C)C1	ZINC000945094380	1332499176	/nfs/dbraw/zinc/49/91/76/1332499176.db2.gz	WTDUKYZMIZRXTO-CRAIPNDOSA-N	0	3	328.456	3.102	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2coc(C3CCCCC3)n2)[C@@H](C)C1	ZINC000945334225	1332559418	/nfs/dbraw/zinc/55/94/18/1332559418.db2.gz	MHSKMWMCRDPPCO-HOCLYGCPSA-N	0	3	331.460	3.349	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2sc(C(C)(C)C)nc2C)[C@H](C)C1	ZINC000945808993	1332679038	/nfs/dbraw/zinc/67/90/38/1332679038.db2.gz	QLVUMHVDTMHQTJ-TZMCWYRMSA-N	0	3	335.517	3.375	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cscc2C(F)(F)F)[C@H](C)C1	ZINC000946315479	1332786582	/nfs/dbraw/zinc/78/65/82/1332786582.db2.gz	XCYJZKQOWYLSIG-ZWNOBZJWSA-N	0	3	332.391	3.393	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3cc(C)oc3C)CC[C@@H]2C1	ZINC000946474737	1332839648	/nfs/dbraw/zinc/83/96/48/1332839648.db2.gz	WRKASURGBUFIIJ-IYBDPMFKSA-N	0	3	336.863	3.433	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)C[C@@H]3CC[C@@H]4C[C@@H]43)CC[C@@H]2C1	ZINC000946651870	1332870878	/nfs/dbraw/zinc/87/08/78/1332870878.db2.gz	GZUCUMAKWQVNTE-WKULXVSPSA-N	0	3	336.907	3.346	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@@H]3CC[C@@H](F)C3)CC[C@@H]2C1	ZINC000946740116	1332888415	/nfs/dbraw/zinc/88/84/15/1332888415.db2.gz	PYKQYWINCMKJJF-LVQVYYBASA-N	0	3	328.859	3.048	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@H]3CC[C@H](F)C3)CC[C@@H]2C1	ZINC000946740115	1332888528	/nfs/dbraw/zinc/88/85/28/1332888528.db2.gz	PYKQYWINCMKJJF-JONQDZQNSA-N	0	3	328.859	3.048	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)C3(CF)CCC3)CC[C@@H]2C1	ZINC000946787070	1332899134	/nfs/dbraw/zinc/89/91/34/1332899134.db2.gz	ZCUFIICDKQCOSB-GASCZTMLSA-N	0	3	328.859	3.049	20	30		EGEDHN
Cc1cncc(C(=O)N[C@@H]2CCN(Cc3cccc(C#N)c3)[C@H](C)C2)c1	ZINC000947161391	1333029787	/nfs/dbraw/zinc/02/97/87/1333029787.db2.gz	FFNMNHOANYGTTH-OXQOHEQNSA-N	0	3	348.450	3.045	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C3CCCCC3)n[nH]2)C[C@@H]1C	ZINC000947403856	1333117063	/nfs/dbraw/zinc/11/70/63/1333117063.db2.gz	HVCQXZPDPSZIQH-DOTOQJQBSA-N	0	3	342.487	3.063	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccnc(-c3ccco3)c2)C[C@@H]1C	ZINC000947429285	1333124622	/nfs/dbraw/zinc/12/46/22/1333124622.db2.gz	GXOUWHAOZSLUIS-GOEBONIOSA-N	0	3	325.412	3.110	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C3CC3)[nH]c2C2CC2)C[C@H]1C	ZINC000947440551	1333128168	/nfs/dbraw/zinc/12/81/68/1333128168.db2.gz	BOTINAIWIAXAGO-RHSMWYFYSA-N	0	3	339.483	3.376	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)C2(F)CCCC2)CCN1Cc1cccc(C#N)c1	ZINC000947464143	1333138784	/nfs/dbraw/zinc/13/87/84/1333138784.db2.gz	RPOAHLBDVJRTBT-MAUKXSAKSA-N	0	3	343.446	3.310	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(C)n(C(CC)CC)n2)C[C@H]1C	ZINC000947472586	1333141458	/nfs/dbraw/zinc/14/14/58/1333141458.db2.gz	HQMDYULWBMSGKA-ZBFHGGJFSA-N	0	3	332.492	3.321	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3cnccc3C)[C@H](C)C2)cc1	ZINC000947610773	1333191343	/nfs/dbraw/zinc/19/13/43/1333191343.db2.gz	CLLAVIWFVFHRQE-UTKZUKDTSA-N	0	3	347.462	3.154	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3ncccc3C)[C@@H](C)C2)cc1	ZINC000947611143	1333191981	/nfs/dbraw/zinc/19/19/81/1333191981.db2.gz	HONOCXYKDBFOKZ-PXNSSMCTSA-N	0	3	347.462	3.154	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2csc(-c3ccco3)n2)C[C@H]1C	ZINC000947661837	1333212504	/nfs/dbraw/zinc/21/25/04/1333212504.db2.gz	AWOSTZKXZFVPHO-ZIAGYGMSSA-N	0	3	343.452	3.009	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(F)c(Cl)cc2F)C[C@@H]1C	ZINC000947676483	1333219583	/nfs/dbraw/zinc/21/95/83/1333219583.db2.gz	XIVLXJKWWCCJAS-NWDGAFQWSA-N	0	3	340.801	3.224	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccc(F)c(Cl)c2F)C[C@H]1C	ZINC000947692742	1333226095	/nfs/dbraw/zinc/22/60/95/1333226095.db2.gz	AJKJGIQAIXEWKH-GHMZBOCLSA-N	0	3	328.790	3.387	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3cncc(C)c3)[C@H](C)C2)C1	ZINC000947702605	1333233181	/nfs/dbraw/zinc/23/31/81/1333233181.db2.gz	QFZVPOBMHPOVTC-AEFFLSMTSA-N	0	3	327.472	3.215	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C(C)(C)c2ccccc2F)C[C@@H]1C	ZINC000947811366	1333268418	/nfs/dbraw/zinc/26/84/18/1333268418.db2.gz	ZHPHERABDJBABC-HOTGVXAUSA-N	0	3	330.447	3.096	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnc(-c3ccco3)s2)C[C@@H]1C	ZINC000947943530	1333314106	/nfs/dbraw/zinc/31/41/06/1333314106.db2.gz	MBXSEOCIJHGSPU-STQMWFEESA-N	0	3	331.441	3.172	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc(C(F)(F)F)c2)C[C@@H]1C	ZINC000947961778	1333321884	/nfs/dbraw/zinc/32/18/84/1333321884.db2.gz	FMKVQQIWZLGCMF-BBRMVZONSA-N	0	3	338.373	3.311	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cccc(C(F)(F)F)c2)C[C@H]1C	ZINC000947963258	1333322585	/nfs/dbraw/zinc/32/25/85/1333322585.db2.gz	SJJPGMHEEOIQHN-DOMZBBRYSA-N	0	3	326.362	3.474	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2coc3ccc(F)cc23)C[C@@H]1C	ZINC000947975428	1333329694	/nfs/dbraw/zinc/32/96/94/1333329694.db2.gz	NJUKOYCLHGAEQX-ZFWWWQNUSA-N	0	3	328.387	3.178	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3c(s2)CCCC3)C[C@H]1C	ZINC000948001734	1333338896	/nfs/dbraw/zinc/33/88/96/1333338896.db2.gz	FAAXAILKVLAOPJ-GDBMZVCRSA-N	0	3	330.497	3.233	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2c[nH]cc2-c2ccccc2)C[C@H]1C	ZINC000948035137	1333348142	/nfs/dbraw/zinc/34/81/42/1333348142.db2.gz	CSCWSYABKOTCJJ-AEFFLSMTSA-N	0	3	335.451	3.288	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](NC(=O)c2cccc(CN(C)C)c2)C[C@@H]1C	ZINC000948057685	1333358319	/nfs/dbraw/zinc/35/83/19/1333358319.db2.gz	XSUUSPKRQIOMKX-MAUKXSAKSA-N	0	3	349.906	3.083	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2c[nH]c3c2cccc3CC)C[C@H]1C	ZINC000948071414	1333364307	/nfs/dbraw/zinc/36/43/07/1333364307.db2.gz	XXNLDVKDBJTVMR-ZBFHGGJFSA-N	0	3	325.456	3.499	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2coc(C3CCCCC3)n2)C[C@H]1C	ZINC000948072879	1333365929	/nfs/dbraw/zinc/36/59/29/1333365929.db2.gz	FYCAZSDCTYZZAW-NVXWUHKLSA-N	0	3	343.471	3.328	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)Cc2coc3cc(F)ccc23)CC1	ZINC000948354491	1333490522	/nfs/dbraw/zinc/49/05/22/1333490522.db2.gz	SNHQITLPTJPXLB-QGZVFWFLSA-N	0	3	342.414	3.061	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2snc(Cl)c2Cl)CC1	ZINC000948408875	1333515251	/nfs/dbraw/zinc/51/52/51/1333515251.db2.gz	UKHUWXLANQVYOM-SNVBAGLBSA-N	0	3	346.283	3.010	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2ccc(Cl)cc2F)CC1	ZINC000948598575	1333590381	/nfs/dbraw/zinc/59/03/81/1333590381.db2.gz	JIUYUYRYKHHFCS-OAHLLOKOSA-N	0	3	336.838	3.429	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cc(Cl)c(Cl)[nH]2)CC1	ZINC000948652443	1333613152	/nfs/dbraw/zinc/61/31/52/1333613152.db2.gz	SSLOGLOMOKFJDI-GFCCVEGCSA-N	0	3	342.270	3.271	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2ccc(C)c(Cl)c2F)CC1	ZINC000948648668	1333611923	/nfs/dbraw/zinc/61/19/23/1333611923.db2.gz	TXMVTZPRVIPRIY-AWEZNQCLSA-N	0	3	336.838	3.347	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cc3ccc(C)cc3[nH]2)CC1	ZINC000948656071	1333616008	/nfs/dbraw/zinc/61/60/08/1333616008.db2.gz	SWWMAZOQKHCNTP-SFHVURJKSA-N	0	3	337.467	3.426	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cnc3ccccc3c2)CC1	ZINC000948812932	1333693392	/nfs/dbraw/zinc/69/33/92/1333693392.db2.gz	OUHRFOLMEPMPPG-IBGZPJMESA-N	0	3	335.451	3.185	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2scnc2C(C)(C)C)CC1	ZINC000948840681	1333705575	/nfs/dbraw/zinc/70/55/75/1333705575.db2.gz	LUEIAYPNTHPPEP-HNNXBMFYSA-N	0	3	347.528	3.390	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@H]1CNC(=O)c1ccncc1C	ZINC000948912558	1333731186	/nfs/dbraw/zinc/73/11/86/1333731186.db2.gz	HGSFLXIBJADHJO-HXUWFJFHSA-N	0	3	335.451	3.295	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@@H]1CNC(=O)C1CC(OC)C1	ZINC000948928777	1333736825	/nfs/dbraw/zinc/73/68/25/1333736825.db2.gz	LRVRCKYTSYDQJF-QLOJAFMTSA-N	0	3	342.483	3.093	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@]1(C)CC=C(C)CC1)CCO2	ZINC000949247758	1333802816	/nfs/dbraw/zinc/80/28/16/1333802816.db2.gz	DGRLPUKPDVSRGG-IBGZPJMESA-N	0	3	332.488	3.002	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1CCCCC1(C)C)CCO2	ZINC000949251656	1333804332	/nfs/dbraw/zinc/80/43/32/1333804332.db2.gz	RCYVGNXJMNSTSZ-QGZVFWFLSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@H]1CCCC[C@H]1C)CCO2	ZINC000949253866	1333804717	/nfs/dbraw/zinc/80/47/17/1333804717.db2.gz	OYORILXLNNNYOD-QZTJIDSGSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@@H]3CC=CCC3)CC2)C1	ZINC000949295340	1333817337	/nfs/dbraw/zinc/81/73/37/1333817337.db2.gz	DVJQQCRWLRPBJE-GOSISDBHSA-N	0	3	332.488	3.002	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C(C)(C)C(C)(C)C)CC2)C1	ZINC000949433464	1333845826	/nfs/dbraw/zinc/84/58/26/1333845826.db2.gz	VHFFFAHBVBZZMV-UHFFFAOYSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C[C@H]3CC[C@H](C)C3)CC2)C1	ZINC000949444696	1333848277	/nfs/dbraw/zinc/84/82/77/1333848277.db2.gz	KZVXZPFJEHJPTF-ROUUACIJSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C3(CC)CCC3)CC2)C1	ZINC000949443979	1333848341	/nfs/dbraw/zinc/84/83/41/1333848341.db2.gz	FARGZAMUWJGEQN-UHFFFAOYSA-N	0	3	334.504	3.226	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@@H]3CCC3(C)C)CC2)C1	ZINC000949445349	1333848963	/nfs/dbraw/zinc/84/89/63/1333848963.db2.gz	XMFWYQGMGYOALA-KRWDZBQOSA-N	0	3	334.504	3.082	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)C2CCc3ccccc3CC2)C1	ZINC000967054796	1335650594	/nfs/dbraw/zinc/65/05/94/1335650594.db2.gz	CIKHGPHKUHZKTM-UTKZUKDTSA-N	0	3	338.495	3.032	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2cccc(-n3cccc3)c2)C1	ZINC000967268211	1335681233	/nfs/dbraw/zinc/68/12/33/1335681233.db2.gz	CVZQAXAIDOAIQC-FXAWDEMLSA-N	0	3	337.467	3.494	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2occc2-c2ccccc2)C1	ZINC000967284818	1335688354	/nfs/dbraw/zinc/68/83/54/1335688354.db2.gz	OKXAGABBGFLFJU-APWZRJJASA-N	0	3	336.435	3.410	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2cc3ccccc3cc2F)C1	ZINC000967307630	1335695216	/nfs/dbraw/zinc/69/52/16/1335695216.db2.gz	AIFJITVHPDZZIE-FOIQADDNSA-N	0	3	338.426	3.442	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2cnc3ccccc3c2C)C1	ZINC000967410018	1335729894	/nfs/dbraw/zinc/72/98/94/1335729894.db2.gz	XHCIUCMCWRWFKU-FOIQADDNSA-N	0	3	335.451	3.007	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2cc(-c3cccs3)on2)C1	ZINC000967524018	1335767311	/nfs/dbraw/zinc/76/73/11/1335767311.db2.gz	KIZHOIMTWWGTND-DZGCQCFKSA-N	0	3	345.468	3.419	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2csc(-c3ccoc3)n2)C1	ZINC000968430850	1335927782	/nfs/dbraw/zinc/92/77/82/1335927782.db2.gz	GHNMEPZAYDSXTN-ZFWWWQNUSA-N	0	3	345.468	3.419	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2cc(Cl)cc(OC)c2)C1	ZINC000968456473	1335930559	/nfs/dbraw/zinc/93/05/59/1335930559.db2.gz	YWNGCQKDJLQZQA-DYVFJYSZSA-N	0	3	336.863	3.365	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2cccc(-c3ccoc3)c2)C1	ZINC000968517907	1335950986	/nfs/dbraw/zinc/95/09/86/1335950986.db2.gz	VAYNADQNRCCUAQ-OXJNMPFZSA-N	0	3	336.435	3.410	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(COC(C)C)cc2)C1	ZINC000968628534	1335990139	/nfs/dbraw/zinc/99/01/39/1335990139.db2.gz	ZZOHYSKNZXZMRA-XLIONFOSSA-N	0	3	342.483	3.075	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)C(C)(C)c2ccccc2OC)C1	ZINC000968697775	1336016479	/nfs/dbraw/zinc/01/64/79/1336016479.db2.gz	IVWGTZFROCAHII-FUHWJXTLSA-N	0	3	344.499	3.376	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccc(CC)c(CC)c2)C1	ZINC000968710447	1336019838	/nfs/dbraw/zinc/01/98/38/1336019838.db2.gz	QRFPHCLHMZDZAI-JXFKEZNVSA-N	0	3	326.484	3.275	20	30		EGEDHN
N#Cc1cccc(CN2CCCCC[C@H]2CNC(=O)C2CC=CC2)c1	ZINC000968790432	1336051433	/nfs/dbraw/zinc/05/14/33/1336051433.db2.gz	FNEOGNNDJYEJJU-FQEVSTJZSA-N	0	3	337.467	3.385	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1ccc2cc(C)cn2c1	ZINC000968882505	1336078917	/nfs/dbraw/zinc/07/89/17/1336078917.db2.gz	PDEDHEWTXRYVDH-HXUWFJFHSA-N	0	3	337.467	3.245	20	30		EGEDHN
C#CCCN1CCCCC[C@H]1CNC(=O)c1c(C)noc1C(C)C	ZINC000968895878	1336083867	/nfs/dbraw/zinc/08/38/67/1336083867.db2.gz	HBQNZMJOGVDZHN-INIZCTEOSA-N	0	3	331.460	3.104	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1cc(C)cc(OC)c1C	ZINC000968936515	1336095958	/nfs/dbraw/zinc/09/59/58/1336095958.db2.gz	KFCKNFQHUPTKOH-GOSISDBHSA-N	0	3	342.483	3.310	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(C(=O)C[C@H]3C=CCCC3)C2)s1	ZINC000969063452	1336135859	/nfs/dbraw/zinc/13/58/59/1336135859.db2.gz	NDLYUSUZYZFCMD-LSDHHAIUSA-N	0	3	329.469	3.057	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cccc(NC(C)=O)c1C	ZINC000969115940	1336150445	/nfs/dbraw/zinc/15/04/45/1336150445.db2.gz	YPWCFQZUFMNNJZ-KRWDZBQOSA-N	0	3	343.471	3.114	20	30		EGEDHN
C[C@H](NC(=O)c1cc(C#N)c[nH]1)C1CN(Cc2ccccc2C2CC2)C1	ZINC000969463067	1336214345	/nfs/dbraw/zinc/21/43/45/1336214345.db2.gz	JEMBGRNCDXPJQQ-AWEZNQCLSA-N	0	3	348.450	3.014	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2ccccc2-c2ccncc2)CC1	ZINC001005576948	1336374273	/nfs/dbraw/zinc/37/42/73/1336374273.db2.gz	XHLOKSHFELYJGS-UHFFFAOYSA-N	0	3	335.451	3.471	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)[C@@H]2C[C@H]2c2ccc(F)cc2F)CC1	ZINC001005767640	1336399969	/nfs/dbraw/zinc/39/99/69/1336399969.db2.gz	HKJXIRHLNNLXRS-DLBZAZTESA-N	0	3	334.410	3.177	20	30		EGEDHN
C=C(Cl)CN1CCC(N(C)C(=O)c2cccc3[nH]c(C)nc32)CC1	ZINC001006254255	1336477749	/nfs/dbraw/zinc/47/77/49/1336477749.db2.gz	IUFSKHCVLSSVLE-UHFFFAOYSA-N	0	3	346.862	3.160	20	30		EGEDHN
C#CCCN1CCC[C@H](NC(=O)c2ccccc2CC(C)(C)C)C1	ZINC001007569568	1336670059	/nfs/dbraw/zinc/67/00/59/1336670059.db2.gz	MAOJJGSQQFVVEC-SFHVURJKSA-N	0	3	326.484	3.493	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2cc(-c3cccs3)on2)C1	ZINC001008110402	1336771529	/nfs/dbraw/zinc/77/15/29/1336771529.db2.gz	UTAGHORLVIQPII-ZDUSSCGKSA-N	0	3	331.441	3.173	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN(CCc3ccc(C)cc3)C2)cc1	ZINC001008147332	1336779860	/nfs/dbraw/zinc/77/98/60/1336779860.db2.gz	KBVNKHUNMOKDAZ-JOCHJYFZSA-N	0	3	346.474	3.413	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H](NC(=O)c2c(F)cc(F)cc2F)C1	ZINC001008385375	1336839235	/nfs/dbraw/zinc/83/92/35/1336839235.db2.gz	PXGAIMSXTHMFJX-CYBMUJFWSA-N	0	3	326.362	3.264	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCCN(C[C@H]3CC(C)(C)CO3)C2)CC1	ZINC001008418669	1336847464	/nfs/dbraw/zinc/84/74/64/1336847464.db2.gz	PIOYQSBITVODLN-ZWKOTPCHSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCN(CCc3ccc(OC)cc3)C2)C1	ZINC001008436305	1336852988	/nfs/dbraw/zinc/85/29/88/1336852988.db2.gz	FANTYXOLBDNZMC-GOSISDBHSA-N	0	3	342.483	3.175	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N[C@@H]1CCCN(CC2=CCCCC2)C1	ZINC001008838474	1336933146	/nfs/dbraw/zinc/93/31/46/1336933146.db2.gz	GRHDXVFPPTZBED-QYZOEREBSA-N	0	3	332.488	3.049	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H](NC(=O)c2cc3cccnc3s2)C1	ZINC001009088879	1336966585	/nfs/dbraw/zinc/96/65/85/1336966585.db2.gz	SUMSASUVKCDZIO-OAHLLOKOSA-N	0	3	329.469	3.457	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(CCCc3cccc(OC)c3)C2)C1	ZINC001015671944	1338249311	/nfs/dbraw/zinc/24/93/11/1338249311.db2.gz	IQOYUEVZHDJZIN-GOSISDBHSA-N	0	3	342.483	3.175	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N[C@H]1CCN(Cc2cc(C)sc2C)C1	ZINC001015828942	1338329135	/nfs/dbraw/zinc/32/91/35/1338329135.db2.gz	NAVLTAFBJBDLEA-BZSNNMDCSA-N	0	3	348.512	3.037	20	30		EGEDHN
C=C(C)CCN1CC[C@H](NC(=O)c2coc(-c3ccccc3)n2)C1	ZINC001016010467	1338404484	/nfs/dbraw/zinc/40/44/84/1338404484.db2.gz	UMDGOLLEPWPCHU-INIZCTEOSA-N	0	3	325.412	3.112	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@H]1CCN(Cc2ccc(C)c(C)c2)C1	ZINC001016114948	1338467363	/nfs/dbraw/zinc/46/73/63/1338467363.db2.gz	UYJDQQFZRACHJS-QFIPXVFZSA-N	0	3	346.474	3.218	20	30		EGEDHN
CC1CC(C(=O)N[C@H]2CC23CCN(Cc2cccc(C#N)c2)CC3)C1	ZINC001016563603	1338646959	/nfs/dbraw/zinc/64/69/59/1338646959.db2.gz	ADHKPHXQVWKSEG-PPSBMQLTSA-N	0	3	337.467	3.075	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cccc(Cl)c2C)CC1	ZINC001016634439	1338671078	/nfs/dbraw/zinc/67/10/78/1338671078.db2.gz	RYKBLLJKAFVURK-KRWDZBQOSA-N	0	3	330.859	3.256	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2cc(Cl)sc2Cl)CC1	ZINC001016656141	1338680865	/nfs/dbraw/zinc/68/08/65/1338680865.db2.gz	ZXBBPNFCTMXGIT-LLVKDONJSA-N	0	3	343.279	3.272	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccc(-n3cccc3)cc2)CC1	ZINC001016713962	1338700003	/nfs/dbraw/zinc/70/00/03/1338700003.db2.gz	CXCSBFBFWJGOHG-HXUWFJFHSA-N	0	3	347.462	3.085	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2occc2-c2ccccc2)CC1	ZINC001016719862	1338701999	/nfs/dbraw/zinc/70/19/99/1338701999.db2.gz	SUCWPSNBFSTCQD-SFHVURJKSA-N	0	3	334.419	3.164	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cc(C)ccc2C2CC2)CC1	ZINC001016748675	1338711105	/nfs/dbraw/zinc/71/11/05/1338711105.db2.gz	LLQKQOFVYMBELL-FQEVSTJZSA-N	0	3	336.479	3.480	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CC23CCN(C[C@@H](F)CC)CC3)cc1	ZINC001016760721	1338715417	/nfs/dbraw/zinc/71/54/17/1338715417.db2.gz	CIRQOJOIVGLKHI-ZWKOTPCHSA-N	0	3	328.431	3.000	20	30		EGEDHN
Cc1coc(C(=O)N[C@@H]2CC23CCN(Cc2cccc(C#N)c2)CC3)c1	ZINC001016784194	1338726458	/nfs/dbraw/zinc/72/64/58/1338726458.db2.gz	UUXSNKGCZZYVED-LJQANCHMSA-N	0	3	349.434	3.244	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)Cc2ccc(F)c(Cl)c2)CC1	ZINC001016847659	1338746244	/nfs/dbraw/zinc/74/62/44/1338746244.db2.gz	NGRLXDZCPJHEGH-QGZVFWFLSA-N	0	3	348.849	3.016	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(C)c3ccccc23)CC1	ZINC001016856092	1338748992	/nfs/dbraw/zinc/74/89/92/1338748992.db2.gz	UWPZBSZDLOOFAJ-FQEVSTJZSA-N	0	3	332.447	3.366	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccc3c(c2)C=CCC3)CC1	ZINC001016870080	1338753653	/nfs/dbraw/zinc/75/36/53/1338753653.db2.gz	LBXKVNOCQQSHPW-HXUWFJFHSA-N	0	3	334.463	3.254	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2[nH]c3ccc(C)cc3c2C)CC1	ZINC001016906501	1338765359	/nfs/dbraw/zinc/76/53/59/1338765359.db2.gz	LAFDUQMNJIWJHD-IBGZPJMESA-N	0	3	349.478	3.392	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2ccc(-c3cccs3)o2)CC1	ZINC001016955170	1338783297	/nfs/dbraw/zinc/78/32/97/1338783297.db2.gz	LBYINJZAOPWVSP-QGZVFWFLSA-N	0	3	340.448	3.226	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H](CN(C)Cc2ccccn2)C1	ZINC001017177333	1338921147	/nfs/dbraw/zinc/92/11/47/1338921147.db2.gz	RECKOLYHXPMJBK-KRWDZBQOSA-N	0	3	329.488	3.354	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H](CN(C)Cc2ocnc2C)C1	ZINC001017201552	1338947139	/nfs/dbraw/zinc/94/71/39/1338947139.db2.gz	KLTJDPTWLRGWAK-VQIMIIECSA-N	0	3	333.476	3.256	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H]1Cc2ccccc2O1	ZINC001017582751	1339372386	/nfs/dbraw/zinc/37/23/86/1339372386.db2.gz	PSKVSBKWOMJLBU-OTWHNJEPSA-N	0	3	340.467	3.022	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cccc2cccnc21	ZINC001017710881	1339398160	/nfs/dbraw/zinc/39/81/60/1339398160.db2.gz	CSGAXELFRDUVJZ-HDICACEKSA-N	0	3	335.451	3.490	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccccc1COC	ZINC001018056153	1339491750	/nfs/dbraw/zinc/49/17/50/1339491750.db2.gz	ZIAMINFVCTTXTM-BGYRXZFFSA-N	0	3	342.483	3.017	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1c[nH]c2cc(C)ccc12	ZINC001018067217	1339494597	/nfs/dbraw/zinc/49/45/97/1339494597.db2.gz	SOTGOJJUGDHPRC-HDICACEKSA-N	0	3	337.467	3.270	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2[nH]c(C)nc2c1	ZINC001018110345	1339502949	/nfs/dbraw/zinc/50/29/49/1339502949.db2.gz	INAIVDBFCHLPOL-CALCHBBNSA-N	0	3	338.455	3.126	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1C[C@]12CCc1ccccc12	ZINC001018122081	1339506091	/nfs/dbraw/zinc/50/60/91/1339506091.db2.gz	FEHYQVMWNRFEKU-TWWGPRNNSA-N	0	3	336.479	3.142	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@H]1CCO[C@H](CC)C1	ZINC001018155987	1339517526	/nfs/dbraw/zinc/51/75/26/1339517526.db2.gz	IESPFPSAXCKJNG-INDMIFKZSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccccc1OCC	ZINC001018226569	1339539925	/nfs/dbraw/zinc/53/99/25/1339539925.db2.gz	LTFRSUXCUMGMKA-CALCHBBNSA-N	0	3	328.456	3.340	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)COc1ccccc1C	ZINC001018234113	1339543254	/nfs/dbraw/zinc/54/32/54/1339543254.db2.gz	PZFXTRBQPRIUTH-HDICACEKSA-N	0	3	328.456	3.015	20	30		EGEDHN
Cc1c(F)cccc1C(=O)N1CC[C@H](NCc2ccc(C#N)s2)C1	ZINC001018888200	1339742993	/nfs/dbraw/zinc/74/29/93/1339742993.db2.gz	MFNDZFVXMUMBCT-ZDUSSCGKSA-N	0	3	343.427	3.072	20	30		EGEDHN
C#CCCN1CCC[C@H]1CNC(=O)c1oc2ccccc2c1Cl	ZINC001028255290	1340514780	/nfs/dbraw/zinc/51/47/80/1340514780.db2.gz	KKKHIHKPNKUNAL-ZDUSSCGKSA-N	0	3	330.815	3.304	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCCN2Cc2ccc(CC)cc2)cn1	ZINC001028270787	1340525176	/nfs/dbraw/zinc/52/51/76/1340525176.db2.gz	SGQRUKCFXDISMP-NRFANRHFSA-N	0	3	347.462	3.020	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](CNC(=O)c3[nH]ccc3C3CC3)C2)cc1	ZINC001028588913	1340716692	/nfs/dbraw/zinc/71/66/92/1340716692.db2.gz	IUIPSXCWLWRPAM-KRWDZBQOSA-N	0	3	348.450	3.016	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NC[C@@H]1CCN(C[C@H](F)CC)C1	ZINC001028637614	1340738701	/nfs/dbraw/zinc/73/87/01/1340738701.db2.gz	SSULUPOAAWVXJU-JKSUJKDBSA-N	0	3	334.435	3.051	20	30		EGEDHN
CC1(C)CC[C@@H](C(=O)NC[C@H]2CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001028788115	1340820174	/nfs/dbraw/zinc/82/01/74/1340820174.db2.gz	JBVZWQWREXQUKU-RTBURBONSA-N	0	3	339.483	3.323	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)C1CCN(C(=O)C2CC(C)C2)CC1	ZINC001029078689	1340925456	/nfs/dbraw/zinc/92/54/56/1340925456.db2.gz	DHUSINKWHSMEQF-NGEICVOHSA-N	0	3	339.483	3.321	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)C1CCN(C(=O)C=C2CCC2)CC1	ZINC001029080483	1340926004	/nfs/dbraw/zinc/92/60/04/1340926004.db2.gz	QGNLJONXIKXKMF-MRXNPFEDSA-N	0	3	337.467	3.385	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CC[C@@H](C1)N2C[C@@H](OC)C1CCC1	ZINC001029420313	1340986232	/nfs/dbraw/zinc/98/62/32/1340986232.db2.gz	XAAWVWUIRCGXJI-FGTMMUONSA-N	0	3	334.504	3.079	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CC[C@@H](C1)N2CCCC1CCOCC1	ZINC001029422616	1340986574	/nfs/dbraw/zinc/98/65/74/1340986574.db2.gz	QZDPUUQTLDJTIT-HDICACEKSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CC[C@@H](C1)N2C[C@@H]1CCC(F)(F)C1	ZINC001029422161	1340986637	/nfs/dbraw/zinc/98/66/37/1340986637.db2.gz	XBCODBJWIBKWQY-KFWWJZLASA-N	0	3	326.431	3.309	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](CN(C)Cc2c(C)noc2C)C1	ZINC001029797871	1341076096	/nfs/dbraw/zinc/07/60/96/1341076096.db2.gz	CNNQPRKLFNIPQO-MRXNPFEDSA-N	0	3	333.476	3.174	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](CN(C)Cc2ncccc2C)C1	ZINC001029798992	1341076631	/nfs/dbraw/zinc/07/66/31/1341076631.db2.gz	POYAYKIDLMAIFX-KRWDZBQOSA-N	0	3	329.488	3.273	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H](CN(C)Cc2cncc(C)c2)C1	ZINC001029825378	1341087317	/nfs/dbraw/zinc/08/73/17/1341087317.db2.gz	CJDLKGSMXYBYFU-XLIONFOSSA-N	0	3	329.488	3.273	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](CN(C)Cc3cnc(C)s3)C2)C1	ZINC001029836500	1341092218	/nfs/dbraw/zinc/09/22/18/1341092218.db2.gz	QLTNGVKGGDAMSO-OAHLLOKOSA-N	0	3	333.501	3.088	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CC[C@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001029859211	1341098480	/nfs/dbraw/zinc/09/84/80/1341098480.db2.gz	PRQYEMPJNYAOEM-HUUCEWRRSA-N	0	3	333.501	3.192	20	30		EGEDHN
C#Cc1ccc(C(=O)N(Cc2ccccc2)[C@@H]2CCCN(CC)C2)cn1	ZINC001029920978	1341120270	/nfs/dbraw/zinc/12/02/70/1341120270.db2.gz	OESUSYVBXFGQRD-OAQYLSRUSA-N	0	3	347.462	3.190	20	30		EGEDHN
C[C@H]1C[C@@H]1CC(=O)N1CCC(CN(C)Cc2ccc(C#N)s2)CC1	ZINC001029991236	1341148466	/nfs/dbraw/zinc/14/84/66/1341148466.db2.gz	VTESKZVERHRDJM-GOEBONIOSA-N	0	3	345.512	3.336	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC(CN(C)Cc2cnc(C)o2)CC1	ZINC001029992341	1341149325	/nfs/dbraw/zinc/14/93/25/1341149325.db2.gz	UNRVAJKDIIDMHM-LJQANCHMSA-N	0	3	333.476	3.256	20	30		EGEDHN
C#Cc1ccc(C(=O)NCC2CN([C@@H]3CCc4ccccc43)C2)cc1	ZINC001031892083	1341417575	/nfs/dbraw/zinc/41/75/75/1341417575.db2.gz	LTOYRBHRCJKAOF-OAQYLSRUSA-N	0	3	330.431	3.017	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)c1cc(C2CC2)[nH]c1C1CC1	ZINC001032475796	1341518681	/nfs/dbraw/zinc/51/86/81/1341518681.db2.gz	JPXFAWRYFVFBDO-HOTGVXAUSA-N	0	3	325.456	3.244	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(OC)c(C2CC2)c1	ZINC001032709146	1341587067	/nfs/dbraw/zinc/58/70/67/1341587067.db2.gz	QYIPGBFBCSBYMG-ROUUACIJSA-N	0	3	340.467	3.438	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H](CC)c1ccc(OC)cc1	ZINC001032795942	1341616031	/nfs/dbraw/zinc/61/60/31/1341616031.db2.gz	RRMVUOWXJFPYBX-BJLQDIEVSA-N	0	3	342.483	3.440	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H](CC)c1ccc(OC)cc1	ZINC001032795855	1341616180	/nfs/dbraw/zinc/61/61/80/1341616180.db2.gz	PRSIYUKVQIIRJU-JENIJYKNSA-N	0	3	328.456	3.050	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H](C)Cc1cccc(F)c1	ZINC001032811095	1341623543	/nfs/dbraw/zinc/62/35/43/1341623543.db2.gz	SABMOTRLAWSVKG-MNEFBYGVSA-N	0	3	330.447	3.256	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](N(C)C(=O)c2cc3ccncc3s2)C1	ZINC001033149066	1341740005	/nfs/dbraw/zinc/74/00/05/1341740005.db2.gz	HMBXUTDWBYKZSI-OAHLLOKOSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)C[C@H]2CCOc3ccccc32)C1	ZINC001033335017	1341786250	/nfs/dbraw/zinc/78/62/50/1341786250.db2.gz	ZAMUZOSPZXVMCG-SJORKVTESA-N	0	3	328.456	3.052	20	30		EGEDHN
C#Cc1cncc(C(=O)N(C)[C@@H]2CCN(Cc3cc(C)ccc3C)C2)c1	ZINC001033405730	1341816864	/nfs/dbraw/zinc/81/68/64/1341816864.db2.gz	OUQUDNUQIHABPO-OAQYLSRUSA-N	0	3	347.462	3.026	20	30		EGEDHN
C=CCCN1CC[C@H](N(C)C(=O)c2cnc(-c3ccoc3)s2)C1	ZINC001033479609	1341841009	/nfs/dbraw/zinc/84/10/09/1341841009.db2.gz	LWSQCDBZTMIPBE-AWEZNQCLSA-N	0	3	331.441	3.126	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)Cc2cccc(OCCC)c2)C1	ZINC001033562576	1341873888	/nfs/dbraw/zinc/87/38/88/1341873888.db2.gz	OMENLBAFOOTNLT-GOSISDBHSA-N	0	3	330.472	3.127	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2cccc(C(F)(F)F)c2)C1	ZINC001033604905	1341895235	/nfs/dbraw/zinc/89/52/35/1341895235.db2.gz	AFCIISYYYLISGO-HNNXBMFYSA-N	0	3	326.362	3.428	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2ccc(N(C)C(C)C)cc2)C1	ZINC001033700837	1341966911	/nfs/dbraw/zinc/96/69/11/1341966911.db2.gz	BPJJTVTUFSLNQL-IBGZPJMESA-N	0	3	329.488	3.254	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cccc3scnc32)C1	ZINC001033839172	1342036830	/nfs/dbraw/zinc/03/68/30/1342036830.db2.gz	ZMUBSLNFVSYTAS-CQSZACIVSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=CCCN1CC[C@H](N(CC)C(=O)c2cnc(CC3CC3)s2)C1	ZINC001033905683	1342077857	/nfs/dbraw/zinc/07/78/57/1342077857.db2.gz	CEDWLNWPZMSQAN-HNNXBMFYSA-N	0	3	333.501	3.208	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccc(C(F)(F)F)cn2)C1	ZINC001033917194	1342086303	/nfs/dbraw/zinc/08/63/03/1342086303.db2.gz	WXIZKPWIFQADJE-CQSZACIVSA-N	0	3	341.377	3.213	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)C1	ZINC001033985329	1342130901	/nfs/dbraw/zinc/13/09/01/1342130901.db2.gz	NCISLOIOLJPEGX-YSIASYRMSA-N	0	3	342.483	3.298	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2ccc(O[C@H](C)CC)cc2)C1	ZINC001034014162	1342150480	/nfs/dbraw/zinc/15/04/80/1342150480.db2.gz	YMIDFAGLAZXRAC-MJGOQNOKSA-N	0	3	342.483	3.424	20	30		EGEDHN
C#Cc1ccc(C(=O)N(CC)[C@@H]2CCN(Cc3ccccc3C)C2)cn1	ZINC001034023011	1342160117	/nfs/dbraw/zinc/16/01/17/1342160117.db2.gz	MQAVZCFTJHHKJI-OAQYLSRUSA-N	0	3	347.462	3.108	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cc(OC)c(C)c(OC)c2)C1	ZINC001034036082	1342175328	/nfs/dbraw/zinc/17/53/28/1342175328.db2.gz	OHLUBDPXEIXXQR-QGZVFWFLSA-N	0	3	346.471	3.125	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cccc3c2OCC3(C)C)C1	ZINC001034056942	1342197519	/nfs/dbraw/zinc/19/75/19/1342197519.db2.gz	PALAQIDGHOUPMZ-MRXNPFEDSA-N	0	3	342.483	3.469	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)C[C@@H]2C[C@H]2c2ccc(OC)cc2)C1	ZINC001034249705	1342346857	/nfs/dbraw/zinc/34/68/57/1342346857.db2.gz	MBVIEBHGYRJCJZ-NSHGMRRFSA-N	0	3	342.483	3.346	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2[nH]c3ccccc3c2Cl)C1	ZINC001034293205	1342377261	/nfs/dbraw/zinc/37/72/61/1342377261.db2.gz	MFFGXBSMWKXRCZ-CQSZACIVSA-N	0	3	343.858	3.429	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc3[nH]nc(C)c3c2)C1	ZINC001034304131	1342386317	/nfs/dbraw/zinc/38/63/17/1342386317.db2.gz	PDJZZKPSQZTCFW-MRXNPFEDSA-N	0	3	326.444	3.032	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCCCN(CCc3ccns3)C2)CC1	ZINC001034380514	1342450290	/nfs/dbraw/zinc/45/02/90/1342450290.db2.gz	JTOPSPXSSJISRO-KRWDZBQOSA-N	0	3	347.528	3.403	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2cc(C(C)(C)C)oc2C)C1	ZINC001034415615	1342477517	/nfs/dbraw/zinc/47/75/17/1342477517.db2.gz	ILEMNNVBXDGQCM-INIZCTEOSA-N	0	3	330.472	3.493	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2cc3cc(F)ccc3o2)C1	ZINC001034424400	1342486560	/nfs/dbraw/zinc/48/65/60/1342486560.db2.gz	RNELBFGEUZEPQA-MRXNPFEDSA-N	0	3	328.387	3.180	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2oc(CC(C)C)nc2C)C1	ZINC001034432815	1342495054	/nfs/dbraw/zinc/49/50/54/1342495054.db2.gz	LEEBNIIAVNMLSV-INIZCTEOSA-N	0	3	333.476	3.342	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)Cn2cc(C)c3ccccc32)C1	ZINC001034435600	1342497768	/nfs/dbraw/zinc/49/77/68/1342497768.db2.gz	KNVKFCBYAXKKHX-QGZVFWFLSA-N	0	3	325.456	3.106	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)Cc2c[nH]c3c2cccc3C)C1	ZINC001034437058	1342499057	/nfs/dbraw/zinc/49/90/57/1342499057.db2.gz	DFSXRJAVVNIBNC-QGZVFWFLSA-N	0	3	325.456	3.176	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)Cc2csc(C(C)(C)C)n2)C1	ZINC001034445391	1342506177	/nfs/dbraw/zinc/50/61/77/1342506177.db2.gz	RWGGIACBXYGXJD-CQSZACIVSA-N	0	3	335.517	3.140	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cnn(CCCC)c2CC)C1	ZINC001034482392	1342540289	/nfs/dbraw/zinc/54/02/89/1342540289.db2.gz	BSMCANQWAOWNIR-KRWDZBQOSA-N	0	3	346.519	3.406	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCCN(Cc3ccc(C)cc3)C2)cn1	ZINC001034498540	1342555889	/nfs/dbraw/zinc/55/58/89/1342555889.db2.gz	MKVNGJCDQSLUAU-OAQYLSRUSA-N	0	3	347.462	3.156	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cc(OC)c(C)c(OC)c2)C1	ZINC001034514641	1342572925	/nfs/dbraw/zinc/57/29/25/1342572925.db2.gz	MFLGQPFTUMDQQA-QGZVFWFLSA-N	0	3	346.471	3.173	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2coc(C3CCCCC3)n2)C1	ZINC001034549222	1342611752	/nfs/dbraw/zinc/61/17/52/1342611752.db2.gz	XGMFXYVWMOGLAS-QGZVFWFLSA-N	0	3	343.471	3.330	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)C2CCCCC2)CC1	ZINC001034581990	1342628228	/nfs/dbraw/zinc/62/82/28/1342628228.db2.gz	WEYFIYGHUXONMJ-SHTZXODSSA-N	0	3	343.309	3.492	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)[C@H]2CCC2(C)C)CC1	ZINC001034709459	1342705313	/nfs/dbraw/zinc/70/53/13/1342705313.db2.gz	HDHNMOKPJCEOKI-MGPQQGTHSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)[C@H]2CC[C@@H](F)C2)CC1	ZINC001034719761	1342713489	/nfs/dbraw/zinc/71/34/89/1342713489.db2.gz	XOKBNNCAJZWJIP-CRWXNKLISA-N	0	3	347.272	3.050	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CC[C@H](NCc3cnc(C)o3)CC2)CC1	ZINC001034729915	1342724394	/nfs/dbraw/zinc/72/43/94/1342724394.db2.gz	XSIBGJQTXGVTJI-QAQDUYKDSA-N	0	3	331.460	3.246	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N[C@H]1CC[C@H](NCc2ccccc2C#N)CC1	ZINC001034740459	1342730845	/nfs/dbraw/zinc/73/08/45/1342730845.db2.gz	LJUJWPQQJSUOPU-UTRMSSBJSA-N	0	3	325.456	3.121	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)NCc1ccc(CNCc2cccc(C#N)c2)cc1	ZINC001034806434	1342771712	/nfs/dbraw/zinc/77/17/12/1342771712.db2.gz	GFGAHORSIYLNSQ-YWZLYKJASA-N	0	3	333.435	3.120	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)Cc2ccc(OC)cc2)C12CCC2	ZINC001078793668	1357088138	/nfs/dbraw/zinc/08/81/38/1357088138.db2.gz	ZTJICJHARCUCEQ-IAGOWNOFSA-N	0	3	348.874	3.007	20	30		EGEDHN
C/C(=C\C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)s1)C1CC1	ZINC001034873784	1342816209	/nfs/dbraw/zinc/81/62/09/1342816209.db2.gz	NVHMKCCJLJZAKX-BMQCOBNYSA-N	0	3	329.469	3.057	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)C(F)=C2CCCC2)s1	ZINC001034904500	1342830932	/nfs/dbraw/zinc/83/09/32/1342830932.db2.gz	BLZMEMYUKVHTRG-CQSZACIVSA-N	0	3	347.459	3.498	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)s1)c1ccco1	ZINC001035048695	1342898838	/nfs/dbraw/zinc/89/88/38/1342898838.db2.gz	KJVFGUUXUXVUTQ-ZIAGYGMSSA-N	0	3	343.452	3.097	20	30		EGEDHN
CC(C)C(=O)N1CCC2(CCN(Cc3ccc(F)c(C#N)c3)C2)CC1	ZINC001035158436	1342976160	/nfs/dbraw/zinc/97/61/60/1342976160.db2.gz	NGRMGMVZHIIDLH-UHFFFAOYSA-N	0	3	343.446	3.168	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2CCC3(CCN(CCF)C3)CC2)cc1	ZINC001035199462	1343012594	/nfs/dbraw/zinc/01/25/94/1343012594.db2.gz	MKSITZNDWYFFDO-UHFFFAOYSA-N	0	3	346.446	3.149	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc(F)c(C)cc1F)CC2	ZINC001035726729	1343154948	/nfs/dbraw/zinc/15/49/48/1343154948.db2.gz	YOINKEPKDJEPSK-UHFFFAOYSA-N	0	3	334.410	3.387	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@H]1CCCc3ccccc31)CC2	ZINC001035732413	1343158289	/nfs/dbraw/zinc/15/82/89/1343158289.db2.gz	CAPASGDRYZRORD-FQEVSTJZSA-N	0	3	336.479	3.054	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)Cc1cccc(C(F)F)c1)CC2	ZINC001035746310	1343166483	/nfs/dbraw/zinc/16/64/83/1343166483.db2.gz	QWKLSBLDVGEQHI-UHFFFAOYSA-N	0	3	346.421	3.114	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@H]1[C@@H](C=C(C)C)C1(C)C)CC2	ZINC001035747083	1343167035	/nfs/dbraw/zinc/16/70/35/1343167035.db2.gz	JHYXIKZOSYLABO-QZTJIDSGSA-N	0	3	328.500	3.173	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cc(C)cc(Cl)c1)CC2	ZINC001035749888	1343168451	/nfs/dbraw/zinc/16/84/51/1343168451.db2.gz	HBDSRZJTESVNDR-UHFFFAOYSA-N	0	3	330.859	3.210	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC3(CN(C[C@@H]4CCCCO4)C3)CC2)CC1	ZINC001035786747	1343198337	/nfs/dbraw/zinc/19/83/37/1343198337.db2.gz	IENNNOZPCIHFKZ-IBGZPJMESA-N	0	3	346.515	3.226	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)C(C)(C)c1cccc(F)c1)CC2	ZINC001035793908	1343202675	/nfs/dbraw/zinc/20/26/75/1343202675.db2.gz	GMFRPRHPBCBVMV-UHFFFAOYSA-N	0	3	342.458	3.051	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccc(C)cc1Cl)CC2	ZINC001035803087	1343205582	/nfs/dbraw/zinc/20/55/82/1343205582.db2.gz	IHLWROBMYFFHKE-UHFFFAOYSA-N	0	3	330.859	3.210	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cc(Cl)ccc1C)CC2	ZINC001035818388	1343213843	/nfs/dbraw/zinc/21/38/43/1343213843.db2.gz	VDCBBNCIXCKALJ-UHFFFAOYSA-N	0	3	330.859	3.210	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1occ3c1CCCC3)CC2	ZINC001035844710	1343226086	/nfs/dbraw/zinc/22/60/86/1343226086.db2.gz	VEUIOLYMYMYXKO-UHFFFAOYSA-N	0	3	328.456	3.273	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccc(F)cc1Cl)CC2	ZINC001035846491	1343226860	/nfs/dbraw/zinc/22/68/60/1343226860.db2.gz	BUAWGNCWVQZYKO-UHFFFAOYSA-N	0	3	334.822	3.040	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)CCc1cc(C)sc1C)CC2	ZINC001035861031	1343236890	/nfs/dbraw/zinc/23/68/90/1343236890.db2.gz	ZUSNRRJLNQPDKN-UHFFFAOYSA-N	0	3	344.524	3.245	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@H](NCc2cc(F)ccc2C#N)[C@@H](C)C1	ZINC001035990056	1343303242	/nfs/dbraw/zinc/30/32/42/1343303242.db2.gz	FAPJIUODXKHMOV-GUYCJALGSA-N	0	3	347.409	3.287	20	30		EGEDHN
C[C@H](NCc1cc(F)ccc1C#N)[C@@H]1CCCN(C(=O)CC2CC2)C1	ZINC001036344131	1343430681	/nfs/dbraw/zinc/43/06/81/1343430681.db2.gz	LXFCOAKMDZVXDO-WMLDXEAASA-N	0	3	343.446	3.214	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC[C@H]([C@@H](C)NCc2ccccc2C#N)C1	ZINC001036394989	1343463064	/nfs/dbraw/zinc/46/30/64/1343463064.db2.gz	SIVYTQPIUQUZIE-SUSZBXMKSA-N	0	3	325.456	3.241	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]([C@@H](C)NCc2cc(OC)no2)C1	ZINC001036435671	1343485500	/nfs/dbraw/zinc/48/55/00/1343485500.db2.gz	AWMWPIHOCMWCPI-HUUCEWRRSA-N	0	3	349.475	3.002	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]([C@H](C)NCc2nccn2CC)C1	ZINC001036444319	1343491895	/nfs/dbraw/zinc/49/18/95/1343491895.db2.gz	YPEZCFWAWXFETO-DLBZAZTESA-N	0	3	346.519	3.222	20	30		EGEDHN
CCCC(=O)N1CCC[C@H](C)[C@H]1CNCc1cc(C#N)ccc1F	ZINC001036492092	1343515018	/nfs/dbraw/zinc/51/50/18/1343515018.db2.gz	BOENTANHGGZODK-KBXCAEBGSA-N	0	3	331.435	3.214	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)C2CC=CC2)[C@H]1CNCc1ccc(C#N)s1	ZINC001036526964	1343535801	/nfs/dbraw/zinc/53/58/01/1343535801.db2.gz	XHUHCGMJGWMCGR-KDOFPFPSSA-N	0	3	343.496	3.303	20	30		EGEDHN
O=C(C1CC1)N1CC[C@H]2[C@@H](CCN2CC#Cc2ccc(Cl)cc2)C1	ZINC001036613499	1343574575	/nfs/dbraw/zinc/57/45/75/1343574575.db2.gz	IIEZCODMZYCWKP-HKUYNNGSSA-N	0	3	342.870	3.024	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccc(C#N)c(F)c2)C1	ZINC001036628182	1343585609	/nfs/dbraw/zinc/58/56/09/1343585609.db2.gz	WYPPHQZXXHFTNP-PKOBYXMFSA-N	0	3	343.446	3.166	20	30		EGEDHN
Cc1ccoc1C(=O)N1CC[C@@H]2[C@@H](CCN2CC#Cc2ccccc2)C1	ZINC001036648201	1343598462	/nfs/dbraw/zinc/59/84/62/1343598462.db2.gz	DJTLTGBKPUXHDY-VQTJNVASSA-N	0	3	348.446	3.176	20	30		EGEDHN
CC(C(=O)N1CC[C@@H]2[C@@H](CCN2CC#Cc2ccccc2)C1)=C1CCC1	ZINC001036714267	1343646471	/nfs/dbraw/zinc/64/64/71/1343646471.db2.gz	VKGZOMVCINKOAZ-FCHUYYIVSA-N	0	3	348.490	3.461	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@H]2[C@@H](CCN2Cc2ccccc2Cl)C1	ZINC001036714091	1343646659	/nfs/dbraw/zinc/64/66/59/1343646659.db2.gz	SIASPDXQFAVIAT-HKUYNNGSSA-N	0	3	342.870	3.176	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@H]2CN(C(=O)C3(C4CC4)CC3)CC[C@@H]21	ZINC001036745020	1343670018	/nfs/dbraw/zinc/67/00/18/1343670018.db2.gz	RYKOTNNGSGQYKO-ICSRJNTNSA-N	0	3	349.478	3.171	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2cncs2)C1	ZINC001036794332	1343726457	/nfs/dbraw/zinc/72/64/57/1343726457.db2.gz	SSUNSDYTJTXDFE-GOEBONIOSA-N	0	3	333.501	3.168	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ocnc2C)C1	ZINC001036794506	1343727254	/nfs/dbraw/zinc/72/72/54/1343727254.db2.gz	WFZTTXYVNSOCPN-JKSUJKDBSA-N	0	3	331.460	3.008	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@@H]2CN(C(=O)C3CC4(CC4)C3)CC[C@@H]21	ZINC001036818973	1343757619	/nfs/dbraw/zinc/75/76/19/1343757619.db2.gz	LMXIDOAISRZKQU-QUCCMNQESA-N	0	3	349.478	3.171	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCC[C@@H]2CNCc2ccn(CC)n2)CC1	ZINC001037070429	1343964245	/nfs/dbraw/zinc/96/42/45/1343964245.db2.gz	RBPCIAFDSLHBSV-MJGOQNOKSA-N	0	3	344.503	3.024	20	30		EGEDHN
CCCC(=O)N1CC[C@H](NCc2cc(F)ccc2C#N)[C@H](CC)C1	ZINC001037762516	1344076596	/nfs/dbraw/zinc/07/65/96/1344076596.db2.gz	ACNLRTWTYZAKEF-KDOFPFPSSA-N	0	3	331.435	3.214	20	30		EGEDHN
CC[C@H]1CN(C(=O)C(C)C)CC[C@H]1NCc1cc(F)ccc1C#N	ZINC001037781910	1344093153	/nfs/dbraw/zinc/09/31/53/1344093153.db2.gz	AYJQRXSWCKTICA-KBXCAEBGSA-N	0	3	331.435	3.070	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC001038416263	1344419156	/nfs/dbraw/zinc/41/91/56/1344419156.db2.gz	MIEKGBQRQDNBFF-RRFJBIMHSA-N	0	3	330.394	3.288	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1cc2c([nH]1)c(F)ccc2C	ZINC001038425737	1344423512	/nfs/dbraw/zinc/42/35/12/1344423512.db2.gz	OEOZYLNEQZUGQH-AWEZNQCLSA-N	0	3	329.419	3.386	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1ccccc1OCC(C)C	ZINC001038818080	1344595447	/nfs/dbraw/zinc/59/54/47/1344595447.db2.gz	LVTFAMPHRULDQS-QGZVFWFLSA-N	0	3	330.472	3.492	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCN2CCC2CCCCCC2)cn1	ZINC001038934545	1344660305	/nfs/dbraw/zinc/66/03/05/1344660305.db2.gz	ZAMMPNZEYVJQBE-FQEVSTJZSA-N	0	3	339.483	3.228	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)C3(C(F)F)CC3)CC2)C1	ZINC001039129680	1344808726	/nfs/dbraw/zinc/80/87/26/1344808726.db2.gz	CNWLWVLGXDPWEH-CQSZACIVSA-N	0	3	346.849	3.345	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)[C@@H]3CC34CCC4)CC2)C1	ZINC001039162310	1344847796	/nfs/dbraw/zinc/84/77/96/1344847796.db2.gz	UQYMCINNFJCCJS-SJORKVTESA-N	0	3	336.907	3.490	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)c3cccn3CC)CC2)C1	ZINC001039173174	1344863172	/nfs/dbraw/zinc/86/31/72/1344863172.db2.gz	PSKJPBYAGOGAHW-KRWDZBQOSA-N	0	3	349.906	3.435	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc(C)c(C)o2)C1	ZINC001039197455	1344906161	/nfs/dbraw/zinc/90/61/61/1344906161.db2.gz	OKBMEIWOBRHIRY-ZWKOTPCHSA-N	0	3	328.456	3.236	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccsc2C)C1	ZINC001039199680	1344909583	/nfs/dbraw/zinc/90/95/83/1344909583.db2.gz	BYGPILMVBYTGJM-AEFFLSMTSA-N	0	3	330.497	3.396	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc(C)nc(C)c2)C1	ZINC001039211380	1344925753	/nfs/dbraw/zinc/92/57/53/1344925753.db2.gz	TWOGTTMZKUZUBW-ICSRJNTNSA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc(Cl)ccc2F)C1	ZINC001039213870	1344929216	/nfs/dbraw/zinc/92/92/16/1344929216.db2.gz	BQLOVNHBBHTATD-KSSFIOAISA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cscc2Cl)C1	ZINC001039216530	1344933488	/nfs/dbraw/zinc/93/34/88/1344933488.db2.gz	BAFLCUZCDGLZDO-XJKSGUPXSA-N	0	3	336.888	3.351	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)Cc2cccc(C)c2)C1	ZINC001039225702	1344944766	/nfs/dbraw/zinc/94/47/66/1344944766.db2.gz	QMQCPQWMTZBXLI-NHCUHLMSSA-N	0	3	338.495	3.264	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc(F)ccc2Cl)C1	ZINC001039236430	1344958278	/nfs/dbraw/zinc/95/82/78/1344958278.db2.gz	BXPREALPDDGSPG-KSSFIOAISA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(C)c(F)c2F)C1	ZINC001039237509	1344960462	/nfs/dbraw/zinc/96/04/62/1344960462.db2.gz	IUFDPUMTHJMPML-WBVHZDCISA-N	0	3	346.421	3.223	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cnc3ccccc3c2)C1	ZINC001039238267	1344961374	/nfs/dbraw/zinc/96/13/74/1344961374.db2.gz	NAYZFGPEOHPLRX-RXVVDRJESA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(OC)cc2)C1	ZINC001039242379	1344969010	/nfs/dbraw/zinc/96/90/10/1344969010.db2.gz	BIRSTQQQLGONJN-ICSRJNTNSA-N	0	3	340.467	3.035	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc3ccccc3n2)C1	ZINC001039242614	1344969019	/nfs/dbraw/zinc/96/90/19/1344969019.db2.gz	BYOAVOVMKUUZEL-NQIIRXRSSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccoc2CCC)C1	ZINC001039242961	1344969467	/nfs/dbraw/zinc/96/94/67/1344969467.db2.gz	DUGXQRWQXNUUQB-AEFFLSMTSA-N	0	3	328.456	3.182	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc(Cl)cn2CC)C1	ZINC001039243769	1344970949	/nfs/dbraw/zinc/97/09/49/1344970949.db2.gz	WBWXSVQXMQWZPC-RDJZCZTQSA-N	0	3	347.890	3.111	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccc3cccnc3c2)C1	ZINC001039248134	1344977833	/nfs/dbraw/zinc/97/78/33/1344977833.db2.gz	RFZXSVCDSOEGSX-PZJWPPBQSA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(F)s2)C1	ZINC001039250452	1344981044	/nfs/dbraw/zinc/98/10/44/1344981044.db2.gz	KWJLNKWOBXTNNN-CABCVRRESA-N	0	3	334.460	3.227	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(F)s2)C1	ZINC001039250453	1344981414	/nfs/dbraw/zinc/98/14/14/1344981414.db2.gz	KWJLNKWOBXTNNN-GJZGRUSLSA-N	0	3	334.460	3.227	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)CCc2ccc(C)o2)C1	ZINC001039250425	1344981536	/nfs/dbraw/zinc/98/15/36/1344981536.db2.gz	KJCOJQSNWRTXEV-QUCCMNQESA-N	0	3	342.483	3.247	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)CCc2ccc(C)o2)C1	ZINC001039250423	1344981580	/nfs/dbraw/zinc/98/15/80/1344981580.db2.gz	KJCOJQSNWRTXEV-ICSRJNTNSA-N	0	3	342.483	3.247	20	30		EGEDHN
Cc1cc(C)cc(CN2CC[C@H]3CC[C@@H](C2)N3C(=O)[C@@H](C)C#N)c1	ZINC001039342966	1345021781	/nfs/dbraw/zinc/02/17/81/1345021781.db2.gz	BDWZXWFQPJCEAZ-UHOSZYNNSA-N	0	3	325.456	3.028	20	30		EGEDHN
C=CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1c(C)noc1CCC	ZINC001039373039	1345032060	/nfs/dbraw/zinc/03/20/60/1345032060.db2.gz	BCSORPOKDQJAIH-CVEARBPZSA-N	0	3	331.460	3.191	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccnn1[C@@H](C)CC	ZINC001039381934	1345036604	/nfs/dbraw/zinc/03/66/04/1345036604.db2.gz	NXLJBKJWJOSNFM-BBWFWOEESA-N	0	3	330.476	3.109	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccc2cccnc21	ZINC001039414454	1345056056	/nfs/dbraw/zinc/05/60/56/1345056056.db2.gz	AWHZRLNYUVSEKS-UXHICEINSA-N	0	3	349.478	3.419	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cnn(C(C)C)c1C	ZINC001039458300	1345077932	/nfs/dbraw/zinc/07/79/32/1345077932.db2.gz	PAJQRPLCWSGYEP-SJORKVTESA-N	0	3	330.476	3.027	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N1C[C@H]2CCC[C@@H](C1)N2CCC(C)C	ZINC001039593152	1345147346	/nfs/dbraw/zinc/14/73/46/1345147346.db2.gz	IOSPLYBDVCRXIP-HCXYKTFWSA-N	0	3	334.504	3.079	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3cccc4c(C)c(C)[nH]c43)C2)C1	ZINC001040261392	1345400384	/nfs/dbraw/zinc/40/03/84/1345400384.db2.gz	NVLAPSDMIDBLGN-JOCHJYFZSA-N	0	3	349.478	3.346	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cccc(C(C)C)n3)C2)C1	ZINC001040282248	1345410939	/nfs/dbraw/zinc/41/09/39/1345410939.db2.gz	HOAFJVAAQBCAMU-FQEVSTJZSA-N	0	3	327.472	3.319	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)Cc3cccc(C)c3Cl)C2)C1	ZINC001040290801	1345414601	/nfs/dbraw/zinc/41/46/01/1345414601.db2.gz	HBUDGYZGZVFSEZ-FQEVSTJZSA-N	0	3	344.886	3.139	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@]2(C1)CCCN(CCc1ccns1)C2	ZINC001040323380	1345432555	/nfs/dbraw/zinc/43/25/55/1345432555.db2.gz	QVBLYCRFYGVTEF-IBGZPJMESA-N	0	3	347.528	3.212	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cc[nH]c3C(C)C)C2)C1	ZINC001040346262	1345445163	/nfs/dbraw/zinc/44/51/63/1345445163.db2.gz	AFHHNULUKAOWMD-HXUWFJFHSA-N	0	3	327.472	3.090	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3occc3C(C)C)C2)C1	ZINC001040351553	1345448844	/nfs/dbraw/zinc/44/88/44/1345448844.db2.gz	UHTLEUKYUKAWSK-FQEVSTJZSA-N	0	3	328.456	3.354	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)C[C@@H]3CCCC3(F)F)C2)C1	ZINC001040353304	1345449652	/nfs/dbraw/zinc/44/96/52/1345449652.db2.gz	HTBLIGCRVXBESE-FUHWJXTLSA-N	0	3	338.442	3.150	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3nccc4ccccc43)C2)C1	ZINC001040361190	1345454714	/nfs/dbraw/zinc/45/47/14/1345454714.db2.gz	QGHKZPLKSCBRFW-OAQYLSRUSA-N	0	3	335.451	3.349	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cc(F)cc(Cl)c3)C2)C1	ZINC001040417567	1345485923	/nfs/dbraw/zinc/48/59/23/1345485923.db2.gz	GMUVZVZQRMHNQL-IBGZPJMESA-N	0	3	348.849	3.431	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@H](F)c3ccccc3)C2)C1	ZINC001040425017	1345490863	/nfs/dbraw/zinc/49/08/63/1345490863.db2.gz	PGVIMOLJSDYEQO-UYAOXDASSA-N	0	3	328.431	3.035	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@@H](C)Cc3cccs3)C2)C1	ZINC001040424247	1345491067	/nfs/dbraw/zinc/49/10/67/1345491067.db2.gz	YHLRCEYJZXKJDI-PXNSSMCTSA-N	0	3	344.524	3.265	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cc(Cl)cs3)C2)C1	ZINC001040431772	1345494801	/nfs/dbraw/zinc/49/48/01/1345494801.db2.gz	KSWQTVBNIWKYDL-QGZVFWFLSA-N	0	3	336.888	3.353	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cc([C@H](C)CC)no3)C2)C1	ZINC001040434715	1345497916	/nfs/dbraw/zinc/49/79/16/1345497916.db2.gz	KGZQJXCROTUXNM-UZLBHIALSA-N	0	3	343.471	3.140	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cccc4ccncc43)C2)C1	ZINC001040477825	1345513303	/nfs/dbraw/zinc/51/33/03/1345513303.db2.gz	IKVILIWLGJPLBK-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@H](C)c3ccc(C)s3)C2)C1	ZINC001040491164	1345517242	/nfs/dbraw/zinc/51/72/42/1345517242.db2.gz	FSQDDPAJVQDFBH-YLJYHZDGSA-N	0	3	344.524	3.498	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@@H](C)c3ccc(C)s3)C2)C1	ZINC001040492001	1345517652	/nfs/dbraw/zinc/51/76/52/1345517652.db2.gz	KTDJPZSWUXLXBC-QFBILLFUSA-N	0	3	330.497	3.108	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ccc(Cl)cc3)C2)C1	ZINC001040501628	1345522602	/nfs/dbraw/zinc/52/26/02/1345522602.db2.gz	FKFSJZATKOKBOR-IBGZPJMESA-N	0	3	330.859	3.291	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3c(F)cccc3Cl)C2)C1	ZINC001040504292	1345524131	/nfs/dbraw/zinc/52/41/31/1345524131.db2.gz	YARQJPRBXGNEPM-LJQANCHMSA-N	0	3	348.849	3.431	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cc(C)c(C)s3)C2)C1	ZINC001040523508	1345532224	/nfs/dbraw/zinc/53/22/24/1345532224.db2.gz	XTWPGDQHOVHWRG-IBGZPJMESA-N	0	3	330.497	3.316	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@@H](CC)OC3CCCCC3)C2)CC1	ZINC001040704527	1345568023	/nfs/dbraw/zinc/56/80/23/1345568023.db2.gz	ZMFKEFSOIZLWSX-LJQANCHMSA-N	0	3	346.515	3.062	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)Cc3ccccc3CC)C2)CC1	ZINC001040745477	1345573452	/nfs/dbraw/zinc/57/34/52/1345573452.db2.gz	MARMPANDBGPBKK-UHFFFAOYSA-N	0	3	338.495	3.129	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccnc4ccccc43)C2)CC1	ZINC001040765470	1345576512	/nfs/dbraw/zinc/57/65/12/1345576512.db2.gz	KNRWDVNEMBIHLG-UHFFFAOYSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccc(F)c(Cl)c3)C2)CC1	ZINC001040826594	1345583618	/nfs/dbraw/zinc/58/36/18/1345583618.db2.gz	RSWKXGLPYTZHEM-UHFFFAOYSA-N	0	3	334.822	3.040	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@@H]3C[C@@]3(CC)C(C)C)C2)CC1	ZINC001040902565	1345597019	/nfs/dbraw/zinc/59/70/19/1345597019.db2.gz	WFSPOFMNGLCKAE-RXVVDRJESA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccc4ccccc4c3)C2)CC1	ZINC001040926636	1345603015	/nfs/dbraw/zinc/60/30/15/1345603015.db2.gz	MMNJDWBTXUCULH-UHFFFAOYSA-N	0	3	332.447	3.401	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@@H](C)c3ccc(F)cc3F)C2)CC1	ZINC001040944240	1345606344	/nfs/dbraw/zinc/60/63/44/1345606344.db2.gz	FFBUYFXVANFCKL-HNNXBMFYSA-N	0	3	346.421	3.016	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3c[nH]c4c3cccc4CC)C2)CC1	ZINC001040948663	1345607477	/nfs/dbraw/zinc/60/74/77/1345607477.db2.gz	WRKGGMZLNBQJLN-UHFFFAOYSA-N	0	3	349.478	3.292	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)C(C)(C)c3ccccc3C)C2)CC1	ZINC001040957829	1345610055	/nfs/dbraw/zinc/61/00/55/1345610055.db2.gz	YCTJMQNVWKPCNX-UHFFFAOYSA-N	0	3	338.495	3.220	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@@]3(CCN(Cc4ccc(C#N)cc4)C3)C2)co1	ZINC001041235910	1345682779	/nfs/dbraw/zinc/68/27/79/1345682779.db2.gz	FTOQGQCRTHOCBE-OAQYLSRUSA-N	0	3	349.434	3.198	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3cc(F)c4ccccc4c3)C2)C1	ZINC001041342291	1345706289	/nfs/dbraw/zinc/70/62/89/1345706289.db2.gz	DIOKZWBIZPBORM-NRFANRHFSA-N	0	3	336.410	3.150	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@]2(CCN(Cc3cccnc3C)C2)C1	ZINC001041536509	1345755158	/nfs/dbraw/zinc/75/51/58/1345755158.db2.gz	OHQBYVFYGOXQBY-OAQYLSRUSA-N	0	3	341.499	3.417	20	30		EGEDHN
Cc1coc(C(=O)N2CC[C@@]3(CCN(Cc4cccc(C#N)c4)C3)C2)c1	ZINC001041582149	1345781296	/nfs/dbraw/zinc/78/12/96/1345781296.db2.gz	ORSZCTMSXOXKAS-OAQYLSRUSA-N	0	3	349.434	3.198	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@]2(CCN(Cc3cccnc3C)C2)C1	ZINC001041624610	1345799419	/nfs/dbraw/zinc/79/94/19/1345799419.db2.gz	BWHMHKZFFYGZEX-LEWJYISDSA-N	0	3	341.499	3.417	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3c(C)cccc3Cl)C2)C1	ZINC001041632556	1345802800	/nfs/dbraw/zinc/80/28/00/1345802800.db2.gz	KGWJSTRLUYLCTR-LJQANCHMSA-N	0	3	330.859	3.210	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3cc(C(C)(C)C)oc3C)C2)C1	ZINC001041707880	1345825133	/nfs/dbraw/zinc/82/51/33/1345825133.db2.gz	TUXIUTCZUKCGFW-HXUWFJFHSA-N	0	3	328.456	3.057	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)C[C@H]3CCc4ccccc43)C2)C1	ZINC001041750287	1345839983	/nfs/dbraw/zinc/83/99/83/1345839983.db2.gz	TVRVFZSRQJWROW-DENIHFKCSA-N	0	3	336.479	3.054	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3ccc(C)c(C)c3Cl)C2)C1	ZINC001041784937	1345849339	/nfs/dbraw/zinc/84/93/39/1345849339.db2.gz	WGFGJFWHIWVDFG-IBGZPJMESA-N	0	3	330.859	3.128	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001041799959	1345854351	/nfs/dbraw/zinc/85/43/51/1345854351.db2.gz	GLHUGNSDWOOYGS-HXUWFJFHSA-N	0	3	325.456	3.029	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccc4ccccc4c3)C2)C1	ZINC001041803310	1345856619	/nfs/dbraw/zinc/85/66/19/1345856619.db2.gz	COJMDJOCLQUWNN-QFIPXVFZSA-N	0	3	332.447	3.401	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)[C@@H](C)c3ccc(F)cc3F)C2)C1	ZINC001041838768	1345868226	/nfs/dbraw/zinc/86/82/26/1345868226.db2.gz	BPALEKNAAUHDIX-YWZLYKJASA-N	0	3	346.421	3.016	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)[C@@H]3CCCCc4ccccc43)C2)C1	ZINC001041847236	1345871851	/nfs/dbraw/zinc/87/18/51/1345871851.db2.gz	LWHJHNLLXQYUMU-IFMALSPDSA-N	0	3	336.479	3.054	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3CCN(C(=O)C4CCCC4)C[C@H]32)c1	ZINC001041885668	1345882765	/nfs/dbraw/zinc/88/27/65/1345882765.db2.gz	PLMJYHXFELAEIK-AZUAARDMSA-N	0	3	337.467	3.171	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@H]2CCN(Cc3ccc(C#N)cc3)[C@H]2C1	ZINC001041950845	1345907121	/nfs/dbraw/zinc/90/71/21/1345907121.db2.gz	WBLIAPJMWCUZCM-UXHICEINSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3coc4c3cccc4OC)C[C@H]21	ZINC001042064781	1345933651	/nfs/dbraw/zinc/93/36/51/1345933651.db2.gz	JLVXFQUOZRJGKP-RHSMWYFYSA-N	0	3	340.423	3.164	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc4nccc(C)c4c3)C[C@H]21	ZINC001042077891	1345939006	/nfs/dbraw/zinc/93/90/06/1345939006.db2.gz	QWUGILWPRQJYIP-DYESRHJHSA-N	0	3	347.462	3.103	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cccc(OCCC)c3)C[C@@H]21	ZINC001042080863	1345939546	/nfs/dbraw/zinc/93/95/46/1345939546.db2.gz	PEEGCDODNKSDRV-PXNSSMCTSA-N	0	3	340.467	3.035	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc(-n4cccc4)cc3)C[C@H]21	ZINC001042140524	1345954173	/nfs/dbraw/zinc/95/41/73/1345954173.db2.gz	ATNKULHRMZJTPJ-WIYYLYMNSA-N	0	3	347.462	3.037	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3cc4ccccc4s3)C[C@@H]21	ZINC001042142888	1345955347	/nfs/dbraw/zinc/95/53/47/1345955347.db2.gz	PFIORFWOYNGLKI-RDJZCZTQSA-N	0	3	338.476	3.461	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2CCN(Cc3scnc3C)[C@@H]2C1	ZINC001042183333	1345971458	/nfs/dbraw/zinc/97/14/58/1345971458.db2.gz	JGLFMJZMFDZFAH-HZPDHXFCSA-N	0	3	347.528	3.477	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cc4c(ccc(C)c4C)[nH]3)C[C@H]21	ZINC001042188720	1345975679	/nfs/dbraw/zinc/97/56/79/1345975679.db2.gz	WKTIMIDXHSKAOF-LAUBAEHRSA-N	0	3	349.478	3.344	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(F)c(Cl)cc3F)C[C@H]21	ZINC001042207774	1345986471	/nfs/dbraw/zinc/98/64/71/1345986471.db2.gz	UCOHLNZKOIFMRM-BDJLRTHQSA-N	0	3	340.801	3.341	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)Cc3c(C)cc(C)cc3C)C[C@H]21	ZINC001042212299	1345987746	/nfs/dbraw/zinc/98/77/46/1345987746.db2.gz	BBFVQQDJWLADBK-TZIWHRDSSA-N	0	3	338.495	3.100	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3c(F)ccc(C)c3F)C[C@@H]21	ZINC001042219768	1345991119	/nfs/dbraw/zinc/99/11/19/1345991119.db2.gz	ZLRKTLBPOKRISR-ZBFHGGJFSA-N	0	3	334.410	3.386	20	30		EGEDHN
C#CCN1CC[C@H]2CCN(C(=O)c3ccc(F)c4ccccc34)C[C@H]21	ZINC001042238879	1346000084	/nfs/dbraw/zinc/00/00/84/1346000084.db2.gz	AEHVOLFILSTDGV-MGPUTAFESA-N	0	3	336.410	3.149	20	30		EGEDHN
C#CCN1CC[C@H]2CCN(C(=O)c3ccc(C)c4ccccc34)C[C@H]21	ZINC001042246187	1346003533	/nfs/dbraw/zinc/00/35/33/1346003533.db2.gz	CGJFRPWBHGCNMO-LAUBAEHRSA-N	0	3	332.447	3.318	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)c3ccc(C)c4ccccc34)C[C@@H]21	ZINC001042246188	1346003998	/nfs/dbraw/zinc/00/39/98/1346003998.db2.gz	CGJFRPWBHGCNMO-UTKZUKDTSA-N	0	3	332.447	3.318	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(C)c(OCC)c3)C[C@H]21	ZINC001042256815	1346007798	/nfs/dbraw/zinc/00/77/98/1346007798.db2.gz	ZZUSYTUQRXFHLP-FUHWJXTLSA-N	0	3	328.456	3.116	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3sc(C)cc3OC)C[C@H]21	ZINC001042260216	1346008756	/nfs/dbraw/zinc/00/87/56/1346008756.db2.gz	UJEDALCJOUCVAV-HUUCEWRRSA-N	0	3	334.485	3.178	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc4c(c3)C=CCC4)C[C@@H]21	ZINC001042263783	1346011265	/nfs/dbraw/zinc/01/12/65/1346011265.db2.gz	YSJABZYIWHXACW-RXVVDRJESA-N	0	3	334.463	3.206	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc4nc(C)sc4c3)C[C@@H]21	ZINC001042297131	1346021485	/nfs/dbraw/zinc/02/14/85/1346021485.db2.gz	AISDQHMIINZHBT-YOEHRIQHSA-N	0	3	341.480	3.327	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3[nH]ccc3-c3ccccc3)C[C@H]21	ZINC001042308071	1346027065	/nfs/dbraw/zinc/02/70/65/1346027065.db2.gz	DJBYEQNTGPXDMQ-AZUAARDMSA-N	0	3	347.462	3.241	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3coc(C4CCCCC4)n3)C[C@H]21	ZINC001042371279	1346061409	/nfs/dbraw/zinc/06/14/09/1346061409.db2.gz	NZWSTTXOGQCSFQ-CRAIPNDOSA-N	0	3	343.471	3.445	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)CCc3cc(C)sc3C)C[C@H]21	ZINC001042374521	1346062583	/nfs/dbraw/zinc/06/25/83/1346062583.db2.gz	IQTFVYVHAFHNRM-IEBWSBKVSA-N	0	3	344.524	3.244	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(N(C)C(C)C)cc3)C[C@@H]21	ZINC001042379268	1346064535	/nfs/dbraw/zinc/06/45/35/1346064535.db2.gz	IWKCMXWVVQYGRV-PXNSSMCTSA-N	0	3	341.499	3.254	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2cc(F)ccc2C#N)CCN1C(=O)/C=C/C1CC1	ZINC001044523458	1346355992	/nfs/dbraw/zinc/35/59/92/1346355992.db2.gz	ORQPVZSOVLPYLU-VDFZGSSXSA-N	0	3	341.430	3.133	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3nccn3CC)C[C@H]2C)CC1	ZINC001044729885	1346414540	/nfs/dbraw/zinc/41/45/40/1346414540.db2.gz	LFMCDUMTTCFPFA-AEFFLSMTSA-N	0	3	344.503	3.119	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3ccn(CC)n3)C[C@H]2C)CC1	ZINC001044729867	1346414550	/nfs/dbraw/zinc/41/45/50/1346414550.db2.gz	KZOVKLFAXWEDCE-SJLPKXTDSA-N	0	3	344.503	3.119	20	30		EGEDHN
C[C@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)CC(C)(F)F	ZINC001044732644	1346415576	/nfs/dbraw/zinc/41/55/76/1346415576.db2.gz	DSVIOCWBCGGSAC-XJKSGUPXSA-N	0	3	335.398	3.073	20	30		EGEDHN
COc1ccc(C(C)C)cc1CNC[C@@H]1CCCN1C(=O)[C@H](C)C#N	ZINC001044960753	1346469894	/nfs/dbraw/zinc/46/98/94/1346469894.db2.gz	HSAIBJFNSOOBNA-QAPCUYQASA-N	0	3	343.471	3.059	20	30		EGEDHN
Cc1ccc(CNC[C@@H]2CCCN2C(=O)C#CC2CC2)c(Cl)c1	ZINC001045033630	1346483679	/nfs/dbraw/zinc/48/36/79/1346483679.db2.gz	HHPATRSGKUHXLA-KRWDZBQOSA-N	0	3	330.859	3.142	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)C[C@@H]2CC=CCC2)s1	ZINC001045155370	1346508403	/nfs/dbraw/zinc/50/84/03/1346508403.db2.gz	RSJQLCFACZQALX-CVEARBPZSA-N	0	3	343.496	3.447	20	30		EGEDHN
C[C@@]1(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)cc2F)C=CCC1	ZINC001045156392	1346508999	/nfs/dbraw/zinc/50/89/99/1346508999.db2.gz	YRGJKVOQEDZCKP-FXAWDEMLSA-N	0	3	341.430	3.134	20	30		EGEDHN
CC1(C)CC[C@@H]1C(=O)N1CCC[C@H]1CNCc1ccc(C#N)cc1F	ZINC001045161064	1346510442	/nfs/dbraw/zinc/51/04/42/1346510442.db2.gz	YNGKOWOJFGXEIG-DLBZAZTESA-N	0	3	343.446	3.214	20	30		EGEDHN
CC1(NC(=O)c2c[nH]c(C#N)c2)CCN(C/C=C\c2ccccc2)CC1	ZINC001045407221	1346586305	/nfs/dbraw/zinc/58/63/05/1346586305.db2.gz	TWSDBDOXOVJVJW-YVMONPNESA-N	0	3	348.450	3.184	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2ccc(-c3ccncc3)o2)CC1	ZINC001045461402	1346599643	/nfs/dbraw/zinc/59/96/43/1346599643.db2.gz	XXHQUWORUUAYKG-UHFFFAOYSA-N	0	3	325.412	3.112	20	30		EGEDHN
CC(C)[C@@H]1C[C@@H]1C(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045607510	1346644880	/nfs/dbraw/zinc/64/48/80/1346644880.db2.gz	XIUUXBSXBYJESD-OALUTQOASA-N	0	3	339.483	3.321	20	30		EGEDHN
CC(C)[C@@H]1C[C@H]1C(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045607511	1346645268	/nfs/dbraw/zinc/64/52/68/1346645268.db2.gz	XIUUXBSXBYJESD-RBUKOAKNSA-N	0	3	339.483	3.321	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)[C@@H]2C[C@H]2c2cc(F)ccc2F)CC1	ZINC001045644499	1346656760	/nfs/dbraw/zinc/65/67/60/1346656760.db2.gz	KKBMOQHIRKYOAH-DOTOQJQBSA-N	0	3	346.421	3.062	20	30		EGEDHN
C[C@]1(C(=O)N2CC[C@H]3CC[C@@H](C2)N3Cc2ccc(C#N)cc2)C=CCC1	ZINC001045830122	1346712692	/nfs/dbraw/zinc/71/26/92/1346712692.db2.gz	VRAJOYYFLSCXSW-URVUXULASA-N	0	3	349.478	3.480	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)Cc1cccs1)C2	ZINC001045907640	1346743977	/nfs/dbraw/zinc/74/39/77/1346743977.db2.gz	BDKIFPAOOZMXTG-LJQANCHMSA-N	0	3	330.497	3.019	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCCC[C@@]2(CCN(Cc3ccc(F)cc3)C2)C1	ZINC001045925924	1346762117	/nfs/dbraw/zinc/76/21/17/1346762117.db2.gz	XNGKFDWXIWPJNO-UZLBHIALSA-N	0	3	343.446	3.190	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)C[C@H]1CCC(F)(F)C1)C2	ZINC001045944282	1346780145	/nfs/dbraw/zinc/78/01/45/1346780145.db2.gz	JGUPVRQIGZUMIO-AEFFLSMTSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1occ3c1CCC3)C2	ZINC001045954577	1346789140	/nfs/dbraw/zinc/78/91/40/1346789140.db2.gz	DEHCSHYJZKPEPX-NRFANRHFSA-N	0	3	340.467	3.110	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)Cc1ccsc1C)C2	ZINC001045972865	1346809412	/nfs/dbraw/zinc/80/94/12/1346809412.db2.gz	JMELJINVQZLKGH-FQEVSTJZSA-N	0	3	344.524	3.327	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1oc(C(C)C)nc1C)C2	ZINC001045972880	1346809667	/nfs/dbraw/zinc/80/96/67/1346809667.db2.gz	JQKPNSGCQOGXOI-HXUWFJFHSA-N	0	3	343.471	3.058	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1sc(C)cc1OC)C2	ZINC001045973812	1346810017	/nfs/dbraw/zinc/81/00/17/1346810017.db2.gz	VFNYPKLIDCSXGI-LJQANCHMSA-N	0	3	346.496	3.017	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cccc3c1ccn3C)C2	ZINC001045973891	1346810057	/nfs/dbraw/zinc/81/00/57/1346810057.db2.gz	REIJVPCSNJLSKP-QFIPXVFZSA-N	0	3	349.478	3.130	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccccc1OC)C2	ZINC001045980592	1346817924	/nfs/dbraw/zinc/81/79/24/1346817924.db2.gz	CUXXEAHRYYOSIS-OAQYLSRUSA-N	0	3	340.467	3.037	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1c(F)cccc1F)C2	ZINC001045981056	1346818844	/nfs/dbraw/zinc/81/88/44/1346818844.db2.gz	BZMOSOFHFSYHLA-HXUWFJFHSA-N	0	3	346.421	3.306	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)CCc1ccccc1F)C2	ZINC001045983389	1346823081	/nfs/dbraw/zinc/82/30/81/1346823081.db2.gz	LYXWZEPTDGFPPE-NRFANRHFSA-N	0	3	342.458	3.096	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)CCc1ccc(C)o1)C2	ZINC001045984568	1346825340	/nfs/dbraw/zinc/82/53/40/1346825340.db2.gz	DHVLQUNJOIDTPE-NRFANRHFSA-N	0	3	342.483	3.249	20	30		EGEDHN
C#CCCN1CC[C@](C)(NC(=O)c2oc3ccc(F)cc3c2C)C1	ZINC001046374827	1346954146	/nfs/dbraw/zinc/95/41/46/1346954146.db2.gz	SGWORSSLNMCQBO-IBGZPJMESA-N	0	3	328.387	3.098	20	30		EGEDHN
C=C1CCC(C(=O)N[C@]2(C)CCN(C[C@@H](O)c3ccccc3)C2)CC1	ZINC001046594723	1347030902	/nfs/dbraw/zinc/03/09/02/1347030902.db2.gz	NUVRQUVNADLNQH-TZIWHRDSSA-N	0	3	342.483	3.047	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@]2(C)CCN(Cc3cccc(CC)c3)C2)cn1	ZINC001046782996	1347098407	/nfs/dbraw/zinc/09/84/07/1347098407.db2.gz	IEKPYJYNPBHWOK-QFIPXVFZSA-N	0	3	347.462	3.020	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2nc(C)sc2C)C1	ZINC001046947392	1347160260	/nfs/dbraw/zinc/16/02/60/1347160260.db2.gz	QNPFTUGCJTXLEK-ZDUSSCGKSA-N	0	3	343.443	3.023	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2cc[nH]c2CCC)C1	ZINC001046967876	1347170550	/nfs/dbraw/zinc/17/05/50/1347170550.db2.gz	ZHMQMLIITWWMAR-AWEZNQCLSA-N	0	3	339.430	3.230	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2sc(C)nc2C)C1	ZINC001046995780	1347178616	/nfs/dbraw/zinc/17/86/16/1347178616.db2.gz	LKMJOHZOCKNNMJ-CYBMUJFWSA-N	0	3	343.443	3.023	20	30		EGEDHN
Cc1cc(C(=O)N[C@H]2C[C@H]3C[C@@H](C2)N(CC#Cc2ccccc2)C3)co1	ZINC001047060701	1347199124	/nfs/dbraw/zinc/19/91/24/1347199124.db2.gz	RKIUNNGNQUUNFO-JBACZVJFSA-N	0	3	348.446	3.222	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)N(C/C=C\Cl)C3)cc1	ZINC001047122702	1347213012	/nfs/dbraw/zinc/21/30/12/1347213012.db2.gz	BEVLUNBTNJUYMC-UABSHYJWSA-N	0	3	328.843	3.003	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)C3C(C)(C)C3(C)C)C2)CC1	ZINC001047231114	1347260017	/nfs/dbraw/zinc/26/00/17/1347260017.db2.gz	ACMFBFDZRZWKPP-KRWDZBQOSA-N	0	3	330.516	3.252	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)CCc3ccoc3)C2)CC1	ZINC001047235162	1347263121	/nfs/dbraw/zinc/26/31/21/1347263121.db2.gz	VQGPTUGOEMWVKW-HXUWFJFHSA-N	0	3	342.483	3.186	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3cc(C)ccc3F)C2)CC1	ZINC001047258585	1347281296	/nfs/dbraw/zinc/28/12/96/1347281296.db2.gz	COSMISZLNARCJF-SFHVURJKSA-N	0	3	342.458	3.332	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@@H]([C@H](C)NCc3ccccc3C#N)C2)o1	ZINC001047697409	1347337687	/nfs/dbraw/zinc/33/76/87/1347337687.db2.gz	GSUCPGHSHPVNRR-MAUKXSAKSA-N	0	3	337.423	3.100	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@@H]([C@H](C)NCc2ccccc2C#N)C1	ZINC001047788298	1347371627	/nfs/dbraw/zinc/37/16/27/1347371627.db2.gz	DFMIWFPTTSVMSG-WMLDXEAASA-N	0	3	329.419	3.148	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]([C@@H](C)NCc2cc(C3CC3)no2)C1	ZINC001047933851	1347415178	/nfs/dbraw/zinc/41/51/78/1347415178.db2.gz	ZPVZSYFLEIGLJP-UKRRQHHQSA-N	0	3	331.460	3.091	20	30		EGEDHN
C[C@H](NCc1cc(F)ccc1C#N)[C@H]1CCN(C(=O)C2(C)CCC2)C1	ZINC001047934712	1347415454	/nfs/dbraw/zinc/41/54/54/1347415454.db2.gz	CSRYJXILXBDEFE-HOCLYGCPSA-N	0	3	343.446	3.214	20	30		EGEDHN
CCC(CC)C(=O)N1C[C@H](C)[C@@H](CNCc2ccccc2C#N)C1	ZINC001048150606	1347482204	/nfs/dbraw/zinc/48/22/04/1347482204.db2.gz	DEPAAYIBDOTZIB-KXBFYZLASA-N	0	3	327.472	3.179	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H](C)[C@H](CNCc3nccs3)C2)CC1	ZINC001048370337	1347533048	/nfs/dbraw/zinc/53/30/48/1347533048.db2.gz	ROOGLNAZDBKYAR-GOEBONIOSA-N	0	3	333.501	3.074	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H](C)[C@@H](CNCc3nc(C)cs3)C2)CC1	ZINC001048370636	1347533063	/nfs/dbraw/zinc/53/30/63/1347533063.db2.gz	SVUQPCRQEILSQD-YOEHRIQHSA-N	0	3	347.528	3.382	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H](C)[C@@H](CNCc3ccccc3C#N)C2)C1	ZINC001048372569	1347533934	/nfs/dbraw/zinc/53/39/34/1347533934.db2.gz	ABOPUPXAGIJWQD-LPHOPBHVSA-N	0	3	337.467	3.099	20	30		EGEDHN
CCC1(C(=O)N2C[C@H](C)[C@H](CNCc3cc(F)ccc3C#N)C2)CC1	ZINC001048379471	1347536971	/nfs/dbraw/zinc/53/69/71/1347536971.db2.gz	PJORIBOFKILXKU-WMLDXEAASA-N	0	3	343.446	3.072	20	30		EGEDHN
C[C@@H]1C[C@@H]1C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1C#N	ZINC001048500060	1347569572	/nfs/dbraw/zinc/56/95/72/1347569572.db2.gz	WYAYLEBVNCALMF-MNRMEVMPSA-N	0	3	337.467	3.073	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3coc4ccc(CC)cc34)C[C@@H]2C1	ZINC001048823048	1347665344	/nfs/dbraw/zinc/66/53/44/1347665344.db2.gz	WNGPURGJRREWKN-CALCHBBNSA-N	0	3	336.435	3.022	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc4cccc(C)c4s3)C[C@@H]2C1	ZINC001048905889	1347681713	/nfs/dbraw/zinc/68/17/13/1347681713.db2.gz	FPINTTFDVMUKQC-CALCHBBNSA-N	0	3	338.476	3.237	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CN(Cc3cccc(C(C)C)n3)C[C@H]2C1	ZINC001048978530	1347696576	/nfs/dbraw/zinc/69/65/76/1347696576.db2.gz	GWFWAMBHXIWXKR-CALCHBBNSA-N	0	3	341.499	3.307	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C[C@H]3C[C@H](C)CC(C)(C)C3)C[C@@H]2C1	ZINC001049117823	1347729013	/nfs/dbraw/zinc/72/90/13/1347729013.db2.gz	KHTBQVPQCMSLFA-ZSYWTGECSA-N	0	3	330.516	3.252	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@@H]2CCCN3C(=O)C2CC=CC2)cc1	ZINC001049390697	1347816347	/nfs/dbraw/zinc/81/63/47/1347816347.db2.gz	BOZIEEIWFWMWGK-PMACEKPBSA-N	0	3	335.451	3.090	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1cccc(C#N)c1)C1CC1	ZINC001049404417	1347827604	/nfs/dbraw/zinc/82/76/04/1347827604.db2.gz	RKVHUHVHRXBWJF-BEVDRBHNSA-N	0	3	337.467	3.170	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1cccc(C#N)c1	ZINC001049414737	1347837061	/nfs/dbraw/zinc/83/70/61/1347837061.db2.gz	FXNCQHKDNPFOEL-QYZOEREBSA-N	0	3	337.467	3.170	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)C2=CCCC2)cc1	ZINC001049417087	1347839776	/nfs/dbraw/zinc/83/97/76/1347839776.db2.gz	ZUYMLKHZNDWFBV-WOJBJXKFSA-N	0	3	335.451	3.234	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1coc(C(C)(C)C)n1	ZINC001049469942	1347864592	/nfs/dbraw/zinc/86/45/92/1347864592.db2.gz	PAMZKDVLYVKJGE-HOTGVXAUSA-N	0	3	331.460	3.227	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccnn1C(CC)CC	ZINC001049519398	1347889100	/nfs/dbraw/zinc/88/91/00/1347889100.db2.gz	YPLXZIZGYQIYGF-SJORKVTESA-N	0	3	330.476	3.109	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC001049551438	1347904464	/nfs/dbraw/zinc/90/44/64/1347904464.db2.gz	FZZAPEZSLKQWMU-LVQVYYBASA-N	0	3	342.405	3.382	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1ccc(C)cc1Cl	ZINC001049554927	1347907196	/nfs/dbraw/zinc/90/71/96/1347907196.db2.gz	IPNWNSAOECLGLJ-RBUKOAKNSA-N	0	3	344.886	3.280	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)CCc1cc2ccccc2o1	ZINC001049584455	1347922722	/nfs/dbraw/zinc/92/27/22/1347922722.db2.gz	RWFBBXICOBMMGS-RTBURBONSA-N	0	3	336.435	3.064	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(-c2ccco2)o1	ZINC001049587528	1347923853	/nfs/dbraw/zinc/92/38/53/1347923853.db2.gz	HCJVFWLHVBLCIB-HOTGVXAUSA-N	0	3	338.407	3.242	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1nc(Cl)sc1C	ZINC001049588838	1347924344	/nfs/dbraw/zinc/92/43/44/1347924344.db2.gz	OGIGSUQDGQSYCC-QWHCGFSZSA-N	0	3	339.892	3.360	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1nc(Cl)sc1C	ZINC001049588836	1347924381	/nfs/dbraw/zinc/92/43/81/1347924381.db2.gz	OGIGSUQDGQSYCC-CHWSQXEVSA-N	0	3	339.892	3.360	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1cccc(C)c1Cl	ZINC001049591320	1347926046	/nfs/dbraw/zinc/92/60/46/1347926046.db2.gz	FWYVAORVHQJLLJ-IRXDYDNUSA-N	0	3	332.875	3.442	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1cccc(C)c1Cl	ZINC001049591321	1347926126	/nfs/dbraw/zinc/92/61/26/1347926126.db2.gz	FWYVAORVHQJLLJ-SJORKVTESA-N	0	3	332.875	3.442	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H]1CCc2cc(F)ccc21	ZINC001049596647	1347928837	/nfs/dbraw/zinc/92/88/37/1347928837.db2.gz	VKJWPBLNPJXING-GBESFXJTSA-N	0	3	328.431	3.107	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(C)c2cccnc12	ZINC001049598284	1347930153	/nfs/dbraw/zinc/93/01/53/1347930153.db2.gz	MIJOXJBEQJDGOK-WOJBJXKFSA-N	0	3	347.462	3.245	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1cccc(C2CC2)c1	ZINC001049612097	1347935966	/nfs/dbraw/zinc/93/59/66/1347935966.db2.gz	LZHZELRITAZTKB-NHCUHLMSSA-N	0	3	336.479	3.195	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1noc2c1CC(C)(C)CC2	ZINC001049614176	1347936319	/nfs/dbraw/zinc/93/63/19/1347936319.db2.gz	WDIBDYMIMFIQDC-HOTGVXAUSA-N	0	3	343.471	3.054	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1cc2ccccc2o1	ZINC001049631572	1347943804	/nfs/dbraw/zinc/94/38/04/1347943804.db2.gz	WRBQAEKXJJGVRL-OALUTQOASA-N	0	3	336.435	3.064	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1nsc2ccc(C)cc21	ZINC001049640539	1347948785	/nfs/dbraw/zinc/94/87/85/1347948785.db2.gz	VZYOYNZYUQNKIG-JKSUJKDBSA-N	0	3	341.480	3.470	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccn(C(C)C)c1C	ZINC001049658922	1347959255	/nfs/dbraw/zinc/95/92/55/1347959255.db2.gz	GVVPLZRQVAQMBG-RBUKOAKNSA-N	0	3	327.472	3.080	20	30		EGEDHN
CC(F)(F)CC(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1cccc(C#N)c1	ZINC001049698115	1347978069	/nfs/dbraw/zinc/97/80/69/1347978069.db2.gz	NBJSGJXCVGOKPV-IAGOWNOFSA-N	0	3	347.409	3.169	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccccc1OC1CCC1	ZINC001049705096	1347982247	/nfs/dbraw/zinc/98/22/47/1347982247.db2.gz	CUPXSBQZSCVXLQ-OALUTQOASA-N	0	3	340.467	3.483	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(C)c(OCC)c1	ZINC001049763569	1348008712	/nfs/dbraw/zinc/00/87/12/1348008712.db2.gz	WUVZLUNUOJUIOU-ROUUACIJSA-N	0	3	328.456	3.259	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cnc(C)nc1C(C)C	ZINC001049768692	1348011158	/nfs/dbraw/zinc/01/11/58/1348011158.db2.gz	YQDKEIGRYAKGIW-ZWKOTPCHSA-N	0	3	342.487	3.163	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cnc(C(C)C)nc1C	ZINC001049768766	1348012082	/nfs/dbraw/zinc/01/20/82/1348012082.db2.gz	DPBRJXAMQNMVTR-QZTJIDSGSA-N	0	3	342.487	3.163	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1csc(C(C)(C)C)n1	ZINC001049777470	1348016364	/nfs/dbraw/zinc/01/63/64/1348016364.db2.gz	IDLWVBJVRMTZMO-HOTGVXAUSA-N	0	3	347.528	3.234	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)COc1ccsc1Cl	ZINC001049784050	1348020754	/nfs/dbraw/zinc/02/07/54/1348020754.db2.gz	WSPDQJIUQDWELJ-STQMWFEESA-N	0	3	340.876	3.032	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1csc(C(C)(C)C)n1	ZINC001049784781	1348020999	/nfs/dbraw/zinc/02/09/99/1348020999.db2.gz	WRYXRQIHKCMOKB-HUUCEWRRSA-N	0	3	333.501	3.306	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H]1CCO[C@H]1c1ccccc1	ZINC001049785268	1348021509	/nfs/dbraw/zinc/02/15/09/1348021509.db2.gz	YINQTPDIUPLVRI-WCIQWLHISA-N	0	3	340.467	3.016	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](c1cccnc1)C(C)C	ZINC001049806238	1348029034	/nfs/dbraw/zinc/02/90/34/1348029034.db2.gz	NDPSEWJMJVLNJZ-GUDVDZBRSA-N	0	3	327.472	3.073	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(C)nc1OCCC	ZINC001049810633	1348031480	/nfs/dbraw/zinc/03/14/80/1348031480.db2.gz	BYVQUXLXLJMSHB-MSOLQXFVSA-N	0	3	343.471	3.044	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1csc(C(F)(F)F)n1	ZINC001049830438	1348044286	/nfs/dbraw/zinc/04/42/86/1348044286.db2.gz	FRXCIPXEWUDJGN-VXGBXAGGSA-N	0	3	345.390	3.027	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(F)c(F)cc1Cl	ZINC001049869857	1348075521	/nfs/dbraw/zinc/07/55/21/1348075521.db2.gz	FTRAJOOMSPIRQO-CVEARBPZSA-N	0	3	340.801	3.483	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(C)nc2ccccc21	ZINC001049871551	1348077436	/nfs/dbraw/zinc/07/74/36/1348077436.db2.gz	MLLLMXVKJLCLPW-UXHICEINSA-N	0	3	335.451	3.408	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)C(C)(C)c1ccc(OC)cc1	ZINC001049902980	1348102666	/nfs/dbraw/zinc/10/26/66/1348102666.db2.gz	DBKVIILYVYNKOX-OALUTQOASA-N	0	3	342.483	3.224	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1c(Cl)cccc1OC	ZINC001049914843	1348109369	/nfs/dbraw/zinc/10/93/69/1348109369.db2.gz	RHLNPFZDJFXCRI-HUUCEWRRSA-N	0	3	334.847	3.214	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1c[nH]c2c1cccc2CC	ZINC001049915964	1348110404	/nfs/dbraw/zinc/11/04/04/1348110404.db2.gz	DIZUVDZRXYLUDU-OALUTQOASA-N	0	3	335.451	3.042	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H]1Cc2c1cccc2Cl	ZINC001049924107	1348116035	/nfs/dbraw/zinc/11/60/35/1348116035.db2.gz	PRZNHNSDDXTBIS-KBAYOESNSA-N	0	3	330.859	3.231	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](C)Cc1ccc(F)cc1	ZINC001049926300	1348116815	/nfs/dbraw/zinc/11/68/15/1348116815.db2.gz	NGZIXSFKVXKQMR-ATZDWAIDSA-N	0	3	330.447	3.256	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1c[nH]c2ccc(F)cc12	ZINC001049938201	1348123168	/nfs/dbraw/zinc/12/31/68/1348123168.db2.gz	YJOGKCRZNZHQKU-ROUUACIJSA-N	0	3	327.403	3.172	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cccc(C(F)(F)F)c3)[C@@H]2C1	ZINC001050190925	1348206415	/nfs/dbraw/zinc/20/64/15/1348206415.db2.gz	WOTAFIOOXGKYPK-GOEBONIOSA-N	0	3	338.373	3.428	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3ccsc3C(F)F)[C@@H]2C1	ZINC001050191100	1348206886	/nfs/dbraw/zinc/20/68/86/1348206886.db2.gz	FYRGEBRHPWWDIE-WCQYABFASA-N	0	3	326.412	3.408	20	30		EGEDHN
C[C@H](c1ccccc1Cl)N1CCC2(CN(C(=O)[C@@H](C)C#N)C2)CC1	ZINC001050460298	1348271248	/nfs/dbraw/zinc/27/12/48/1348271248.db2.gz	UROCCFKFCKCLBS-LSDHHAIUSA-N	0	3	345.874	3.485	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC2(C1)CCN(C/C=C\Cl)CC2	ZINC001050532535	1348284979	/nfs/dbraw/zinc/28/49/79/1348284979.db2.gz	WAOCTGLZNHCRRU-DAXSKMNVSA-N	0	3	331.287	3.442	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc(C)c(Cl)c3F)C2)CC1	ZINC001050602415	1348298317	/nfs/dbraw/zinc/29/83/17/1348298317.db2.gz	PSQQBERLLVAVAE-UHFFFAOYSA-N	0	3	348.849	3.349	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)C[C@@H](C)c3ccc(CC)cc3)C2)CC1	ZINC001050663540	1348321471	/nfs/dbraw/zinc/32/14/71/1348321471.db2.gz	SDCJJLBTZBBBDT-GOSISDBHSA-N	0	3	338.495	3.300	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3ccc(C)c(C)c3Cl)C2)CC1	ZINC001050726703	1348339103	/nfs/dbraw/zinc/33/91/03/1348339103.db2.gz	ULSHRHMDZZGIRH-UHFFFAOYSA-N	0	3	330.859	3.128	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C3CCC(C4CC4)CC3)C2)CC1	ZINC001050743391	1348345654	/nfs/dbraw/zinc/34/56/54/1348345654.db2.gz	KXIGSOAVCBNXFA-UHFFFAOYSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3c[nH]cc3-c3ccccc3)C2)CC1	ZINC001050753710	1348349252	/nfs/dbraw/zinc/34/92/52/1348349252.db2.gz	ZKDBBFASIHNZHB-UHFFFAOYSA-N	0	3	347.462	3.243	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3cc(-c4ccccc4)co3)C2)CC1	ZINC001050782983	1348356851	/nfs/dbraw/zinc/35/68/51/1348356851.db2.gz	WEISODNLUUYFJO-UHFFFAOYSA-N	0	3	334.419	3.118	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3ncccc3C)cccc2C1	ZINC001051283552	1348417446	/nfs/dbraw/zinc/41/74/46/1348417446.db2.gz	DMQLUAMKRQMPLU-UHFFFAOYSA-N	0	3	335.451	3.254	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)C3CC4(CCC4)C3)cccc2C1	ZINC001051297216	1348423375	/nfs/dbraw/zinc/42/33/75/1348423375.db2.gz	HVFPJGRHBITRIT-UHFFFAOYSA-N	0	3	336.479	3.265	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)C3CCC(=C)CC3)cccc2C1	ZINC001051298120	1348423794	/nfs/dbraw/zinc/42/37/94/1348423794.db2.gz	CTOZBQSMEXSQBA-UHFFFAOYSA-N	0	3	336.479	3.431	20	30		EGEDHN
C=C(C)CCN1CCN([C@H]2CCN(C(=O)C(C)=C3CCCC3)C2)CC1	ZINC001052011780	1348496655	/nfs/dbraw/zinc/49/66/55/1348496655.db2.gz	YVETUSFEOYFNBJ-FQEVSTJZSA-N	0	3	345.531	3.062	20	30		EGEDHN
C=C(C)CCN1CCN([C@@H]2CCN(C(=O)C(CC)(CC)CC)C2)CC1	ZINC001052100314	1348502391	/nfs/dbraw/zinc/50/23/91/1348502391.db2.gz	CZTJZLCDHVJHFT-LJQANCHMSA-N	0	3	349.563	3.388	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC001052313719	1348519122	/nfs/dbraw/zinc/51/91/22/1348519122.db2.gz	CAQJWJWFCKHFQX-QZTJIDSGSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)Cc2c(C)cccc2Cl)CC1	ZINC001052527475	1348566454	/nfs/dbraw/zinc/56/64/54/1348566454.db2.gz	BBYFZMGYLPKUIS-INIZCTEOSA-N	0	3	332.875	3.185	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)Cc2ccc(C(F)F)cc2)CC1	ZINC001052554548	1348577503	/nfs/dbraw/zinc/57/75/03/1348577503.db2.gz	LNUUKXYVIJBEET-QGZVFWFLSA-N	0	3	334.410	3.161	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCCN(Cc3cccc(C#N)c3)CC2)C1	ZINC001052691080	1348634547	/nfs/dbraw/zinc/63/45/47/1348634547.db2.gz	RFUXHWGKKSWGIF-IBGZPJMESA-N	0	3	337.467	3.385	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@@]2(C)CCCc3ccccc32)CC1	ZINC001052795814	1348683629	/nfs/dbraw/zinc/68/36/29/1348683629.db2.gz	NLEHDSHUGXEDHQ-UGKGYDQZSA-N	0	3	338.495	3.275	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cc(C)n(CC3CC3)c2C)CC1	ZINC001052874254	1348714148	/nfs/dbraw/zinc/71/41/48/1348714148.db2.gz	YMSSZPPYCYOKJO-LJQANCHMSA-N	0	3	341.499	3.123	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2c[nH]c3c2cccc3CC)CC1	ZINC001052957785	1348770343	/nfs/dbraw/zinc/77/03/43/1348770343.db2.gz	JAILVQFTGFZPGL-KRWDZBQOSA-N	0	3	337.467	3.338	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc(N(C)C(C)C)cc2)CC1	ZINC001052971649	1348781844	/nfs/dbraw/zinc/78/18/44/1348781844.db2.gz	LTXKZPXDZBELKZ-LJQANCHMSA-N	0	3	341.499	3.139	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc(CC)c(CC)c2)CC1	ZINC001052983623	1348788892	/nfs/dbraw/zinc/78/88/92/1348788892.db2.gz	QBSSGYFVOHZQHD-FQEVSTJZSA-N	0	3	326.484	3.419	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)Cc2ccsc2)C1	ZINC001053061697	1348871563	/nfs/dbraw/zinc/87/15/63/1348871563.db2.gz	UNLMTLSKBPIDAG-RBUKOAKNSA-N	0	3	344.524	3.407	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)CC(F)(F)F)C1	ZINC001053069796	1348883742	/nfs/dbraw/zinc/88/37/42/1348883742.db2.gz	PZFPKSFKKBTSEV-LSDHHAIUSA-N	0	3	330.394	3.055	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cccc(C)n2)C1	ZINC001053072025	1348888421	/nfs/dbraw/zinc/88/84/21/1348888421.db2.gz	OSTXXTKFALUWKB-QUCCMNQESA-N	0	3	339.483	3.120	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2oc(C)cc2C)C1	ZINC001053075979	1348894069	/nfs/dbraw/zinc/89/40/69/1348894069.db2.gz	KNDGWEGWVZHBBC-ROUUACIJSA-N	0	3	328.456	3.236	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cc(C)sn2)C1	ZINC001053080110	1348900953	/nfs/dbraw/zinc/90/09/53/1348900953.db2.gz	AKMIIKAPAMZZLU-WMZOPIPTSA-N	0	3	345.512	3.182	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cccc(C)c2F)C1	ZINC001053086797	1348909981	/nfs/dbraw/zinc/90/99/81/1348909981.db2.gz	OVBMCQZRWZHKTH-MJGOQNOKSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccn3ccccc23)C1	ZINC001053090886	1348915945	/nfs/dbraw/zinc/91/59/45/1348915945.db2.gz	JKHNPNYJQDFQFG-UYAOXDASSA-N	0	3	349.478	3.279	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2[nH]c(C)cc2C)C1	ZINC001053090304	1348916158	/nfs/dbraw/zinc/91/61/58/1348916158.db2.gz	GNQHCMLMKOTSNC-MOPGFXCFSA-N	0	3	341.499	3.362	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(C)[nH]c2C)C1	ZINC001053098091	1348929063	/nfs/dbraw/zinc/92/90/63/1348929063.db2.gz	KBMMSRDGAYWHHX-QUCCMNQESA-N	0	3	341.499	3.362	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cc3ccccn3c2)C1	ZINC001053100008	1348932593	/nfs/dbraw/zinc/93/25/93/1348932593.db2.gz	CJWUZGGRAHCQCV-RXVVDRJESA-N	0	3	349.478	3.279	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2nc(C)oc2C)C1	ZINC001053101317	1348934605	/nfs/dbraw/zinc/93/46/05/1348934605.db2.gz	NCKMVZMJHYTSLU-MSOLQXFVSA-N	0	3	343.471	3.021	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cccn2C(C)C)C1	ZINC001053103958	1348938111	/nfs/dbraw/zinc/93/81/11/1348938111.db2.gz	BDMHMIMRSNYEQY-RTBURBONSA-N	0	3	341.499	3.409	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cccn2CC)C1	ZINC001053104806	1348941080	/nfs/dbraw/zinc/94/10/80/1348941080.db2.gz	JOEBHMZNHCMFFS-RTBURBONSA-N	0	3	341.499	3.238	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)Cc2ccccc2F)C1	ZINC001053107084	1348945479	/nfs/dbraw/zinc/94/54/79/1348945479.db2.gz	YZMXGFWFMQUPHV-ICSRJNTNSA-N	0	3	342.458	3.095	20	30		EGEDHN
C=C(C)CCN1Cc2ccccc2C[C@H]1CNC(=O)[C@H]1CCCCO1	ZINC001054037331	1349133530	/nfs/dbraw/zinc/13/35/30/1349133530.db2.gz	BWQVOCJFQKWZNL-VQTJNVASSA-N	0	3	342.483	3.065	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@H](C)c1c(F)cccc1F)C2	ZINC001054164345	1349167125	/nfs/dbraw/zinc/16/71/25/1349167125.db2.gz	HLJKGGJNSVHMQN-FOIQADDNSA-N	0	3	346.421	3.016	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H]1CCCCC1(F)F)C2	ZINC001054170442	1349172100	/nfs/dbraw/zinc/17/21/00/1349172100.db2.gz	PGFDAICRRTZGMP-FUHWJXTLSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cccc3ncccc31)C2	ZINC001054173348	1349174176	/nfs/dbraw/zinc/17/41/76/1349174176.db2.gz	NTPZZMJCKNETFF-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)C(C1CCC1)C1CCC1)C2	ZINC001054186396	1349189110	/nfs/dbraw/zinc/18/91/10/1349189110.db2.gz	RJCGVLYXPPLGOB-NRFANRHFSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(Cl)c(C)c1)C2	ZINC001054188210	1349191859	/nfs/dbraw/zinc/19/18/59/1349191859.db2.gz	JEMCHYAWPMKLOX-LJQANCHMSA-N	0	3	330.859	3.210	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc([C@@H](C)CC)no1)C2	ZINC001054209367	1349210506	/nfs/dbraw/zinc/21/05/06/1349210506.db2.gz	PPDGAEKFTMGTLJ-OXJNMPFZSA-N	0	3	343.471	3.140	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)C(C)(C)c1ccc(C)cc1)C2	ZINC001054229290	1349222986	/nfs/dbraw/zinc/22/29/86/1349222986.db2.gz	QEVHMQSJXDODDG-JOCHJYFZSA-N	0	3	338.495	3.220	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)CCc1ccccc1Cl)C2	ZINC001054237252	1349230214	/nfs/dbraw/zinc/23/02/14/1349230214.db2.gz	VZCPOWHKXHXAGK-HXUWFJFHSA-N	0	3	344.886	3.220	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc(C)c(F)c(C)c1)C2	ZINC001054241939	1349234905	/nfs/dbraw/zinc/23/49/05/1349234905.db2.gz	BEIVUUPMOFZJDE-OAQYLSRUSA-N	0	3	342.458	3.394	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)C13CCC(CC1)CC3)C2	ZINC001054243705	1349237702	/nfs/dbraw/zinc/23/77/02/1349237702.db2.gz	MLRMONKCNVRGNN-CKHPTIKVSA-N	0	3	328.500	3.295	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cccc3c1CCC3)C2	ZINC001054247229	1349242287	/nfs/dbraw/zinc/24/22/87/1349242287.db2.gz	RIWSLYSHELIIBF-JOCHJYFZSA-N	0	3	336.479	3.127	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@H]3CCO[C@H](CC)C3)cc2C1	ZINC001054289070	1349293580	/nfs/dbraw/zinc/29/35/80/1349293580.db2.gz	SYZPJDKSWUWZOW-FXAWDEMLSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@H]3CCCC[C@H]3OC)cc2C1	ZINC001054293279	1349299983	/nfs/dbraw/zinc/29/99/83/1349299983.db2.gz	ZCBSREZVNVURRB-VQTJNVASSA-N	0	3	342.483	3.400	20	30		EGEDHN
Cc1cc(C(=O)N2C[C@H](C)[C@H](NCc3ccc(C#N)s3)C2)oc1C	ZINC001054570783	1349403152	/nfs/dbraw/zinc/40/31/52/1349403152.db2.gz	WVMLNNSQIZFWPU-BLLLJJGKSA-N	0	3	343.452	3.080	20	30		EGEDHN
Cc1coc(C)c1C(=O)N1C[C@@H](C)[C@@H](NCc2ccc(C#N)s2)C1	ZINC001054616395	1349416026	/nfs/dbraw/zinc/41/60/26/1349416026.db2.gz	AXSOVNDUOKYFPT-BZNIZROVSA-N	0	3	343.452	3.080	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2(C3CC3)CCC2)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054933588	1349517449	/nfs/dbraw/zinc/51/74/49/1349517449.db2.gz	BQQNWXHAABFCSV-DYVFJYSZSA-N	0	3	343.496	3.137	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2(C)CCCC2)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054944769	1349524348	/nfs/dbraw/zinc/52/43/48/1349524348.db2.gz	SWCOUVLEERDENC-CJNGLKHVSA-N	0	3	331.485	3.137	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](NCc2ccc(C#N)s2)[C@@H](C)C1	ZINC001054970823	1349531543	/nfs/dbraw/zinc/53/15/43/1349531543.db2.gz	JAIJNEJEZWNPEE-BBRMVZONSA-N	0	3	331.485	3.159	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H](C)C[C@H](C)NCc1conc1C	ZINC001134450073	1376544054	/nfs/dbraw/zinc/54/40/54/1376544054.db2.gz	ZMNJULRTCHFBJX-QWRGUYRKSA-N	0	3	327.856	3.135	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2F)C1	ZINC001080180640	1357513168	/nfs/dbraw/zinc/51/31/68/1357513168.db2.gz	UQQLTXKHGKHITF-BUIXCFAXSA-N	0	3	334.410	3.081	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CN(Cc3ccc(C)cc3)C[C@H]2C)cc1	ZINC001080244675	1357535925	/nfs/dbraw/zinc/53/59/25/1357535925.db2.gz	GEOFSGBFHSIECY-DYESRHJHSA-N	0	3	332.447	3.227	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H](CNCc2ccc(C#N)s2)C2CC2)s1	ZINC001322957407	1387256048	/nfs/dbraw/zinc/25/60/48/1387256048.db2.gz	ZTXFRAPWOJUSKA-HNNXBMFYSA-N	0	3	345.493	3.288	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CN(CC[C@H]3CC3(Cl)Cl)C[C@H]2C)C1	ZINC001080406775	1357610386	/nfs/dbraw/zinc/61/03/86/1357610386.db2.gz	ZYJGDXZBPCPJEK-HZSPNIEDSA-N	0	3	345.314	3.363	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1cccc(C)c1F)C[C@@H](C)O2	ZINC001071172098	1354487386	/nfs/dbraw/zinc/48/73/86/1354487386.db2.gz	XIRMZBRLODHNGN-OXQOHEQNSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C(C)(C)C(C)(C)C)C[C@@H](C)O2	ZINC001071197205	1354499565	/nfs/dbraw/zinc/49/95/65/1354499565.db2.gz	OOZLEEUDPYUXGW-UZLBHIALSA-N	0	3	336.520	3.327	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc3nccc(C)c3c2)CC[C@H]1C	ZINC001071533638	1354750760	/nfs/dbraw/zinc/75/07/60/1354750760.db2.gz	IZBDURDSLZYXAU-SJLPKXTDSA-N	0	3	335.451	3.149	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)[C@@H](C)C(F)(F)F)C1	ZINC001088359193	1359843359	/nfs/dbraw/zinc/84/33/59/1359843359.db2.gz	TXRLLCYGEXOPMJ-NEPJUHHUSA-N	0	3	326.790	3.298	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2cc3ccncc3s2)CC[C@H]1C	ZINC001071568545	1354768525	/nfs/dbraw/zinc/76/85/25/1354768525.db2.gz	OSQXCOYMZWCOCI-UKRRQHHQSA-N	0	3	329.469	3.455	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2ccc3c(c2)CCCO3)CC[C@@H]1C	ZINC001071589477	1354781592	/nfs/dbraw/zinc/78/15/92/1354781592.db2.gz	VGLHDKPQSPEWSY-QFBILLFUSA-N	0	3	342.483	3.099	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2[nH]c3ccccc3c2Cl)CC[C@H]1C	ZINC001071646178	1354823693	/nfs/dbraw/zinc/82/36/93/1354823693.db2.gz	SXIRSDOWQRYYSU-ZIAGYGMSSA-N	0	3	343.858	3.427	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2nc3cnccc3s2)CC[C@H]1C	ZINC001071672256	1354841482	/nfs/dbraw/zinc/84/14/82/1354841482.db2.gz	ADZPOHNHSSFJJP-KGLIPLIRSA-N	0	3	344.484	3.240	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2nc3c(s2)CCC3)CC[C@@H]1C	ZINC001071683159	1354849628	/nfs/dbraw/zinc/84/96/28/1354849628.db2.gz	YDWVWAHXOCWKPX-KBPBESRZSA-N	0	3	333.501	3.181	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2ocnc2C(F)(F)F)CC[C@@H]1C	ZINC001071705317	1354864110	/nfs/dbraw/zinc/86/41/10/1354864110.db2.gz	NNMLGRREXQZLDL-RYUDHWBXSA-N	0	3	345.365	3.242	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(C(F)(F)F)cn2)CC[C@@H]1C	ZINC001071721172	1354878303	/nfs/dbraw/zinc/87/83/03/1354878303.db2.gz	MZKHHUVNVRJXFW-JSGCOSHPSA-N	0	3	341.377	3.259	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc3cc(Cl)ccc3[nH]2)CC[C@@H]1C	ZINC001071728879	1354883437	/nfs/dbraw/zinc/88/34/37/1354883437.db2.gz	UYYNAKRCVGUPFE-BBRMVZONSA-N	0	3	343.858	3.427	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(C3CC3)nc2C)CC[C@H]1C	ZINC001071831548	1354967257	/nfs/dbraw/zinc/96/72/57/1354967257.db2.gz	IQSSXZBOXXLDQZ-RHSMWYFYSA-N	0	3	327.472	3.426	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2csc(C(C)(C)C)n2)CC[C@H]1C	ZINC001071892729	1355010040	/nfs/dbraw/zinc/01/00/40/1355010040.db2.gz	HYWHMJFLXWXSJW-KGLIPLIRSA-N	0	3	333.501	3.047	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2csc(-c3ccoc3)n2)CC[C@@H]1C	ZINC001071908598	1355018863	/nfs/dbraw/zinc/01/88/63/1355018863.db2.gz	YYMSKDQHLOEUNZ-ZFWWWQNUSA-N	0	3	343.452	3.009	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cccc(OC(C)C)n2)CC[C@H]1C	ZINC001071942458	1355036263	/nfs/dbraw/zinc/03/62/63/1355036263.db2.gz	PTJZPAGRNXDBJR-HZPDHXFCSA-N	0	3	331.460	3.028	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(-c3c[nH]cn3)cc2)CC[C@H]1C	ZINC001071957053	1355042285	/nfs/dbraw/zinc/04/22/85/1355042285.db2.gz	BHSNCLCARVQQQC-QAPCUYQASA-N	0	3	338.455	3.236	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cnn(C(CC)CC)c2C)CC[C@@H]1C	ZINC001071976677	1355055169	/nfs/dbraw/zinc/05/51/69/1355055169.db2.gz	GUGCQVXEZDXANV-RDJZCZTQSA-N	0	3	344.503	3.159	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccnc(OC(C)C)c2)CC[C@@H]1C	ZINC001071986319	1355060241	/nfs/dbraw/zinc/06/02/41/1355060241.db2.gz	SGHLJVXEHWLPRL-DOTOQJQBSA-N	0	3	331.460	3.028	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C(C)(C)c2ccc(C)cc2)CC[C@@H]1C	ZINC001072003174	1355068053	/nfs/dbraw/zinc/06/80/53/1355068053.db2.gz	SETZHTFTQYYHNY-PKOBYXMFSA-N	0	3	326.484	3.265	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc3ncsc3c2)CC[C@@H]1C	ZINC001072043867	1355100297	/nfs/dbraw/zinc/10/02/97/1355100297.db2.gz	FWSSBEWAKWPFCV-DZGCQCFKSA-N	0	3	329.469	3.455	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(OCC(C)C)cc2)CC[C@@H]1C	ZINC001072049034	1355103591	/nfs/dbraw/zinc/10/35/91/1355103591.db2.gz	NNKYKULGABFQEY-PKOBYXMFSA-N	0	3	342.483	3.327	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccccc2OCC2CC2)CC[C@H]1C	ZINC001072099079	1355129037	/nfs/dbraw/zinc/12/90/37/1355129037.db2.gz	LGSVTUSEBUODCG-AEFFLSMTSA-N	0	3	340.467	3.081	20	30		EGEDHN
C=C(Cl)CN1C[C@H](NC(=O)c2ccccc2CN(C)C)CC[C@H]1C	ZINC001072099708	1355129640	/nfs/dbraw/zinc/12/96/40/1355129640.db2.gz	WIXSKLZMMYRNRS-NVXWUHKLSA-N	0	3	349.906	3.083	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2cccc(OCC)c2)CC[C@H]1C	ZINC001072101462	1355130906	/nfs/dbraw/zinc/13/09/06/1355130906.db2.gz	HBHGQCDRPFRERQ-SJLPKXTDSA-N	0	3	330.472	3.173	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2N(Cc2ccsc2)C(=O)C2CC2)CC1	ZINC001072134032	1355147370	/nfs/dbraw/zinc/14/73/70/1355147370.db2.gz	BCUPUVUAOJRQSH-SFHVURJKSA-N	0	3	342.508	3.365	20	30		EGEDHN
C[C@H]1CCN(C(=O)C2=CCCC2)C[C@H]1CNCc1ccccc1C#N	ZINC001072248406	1355206180	/nfs/dbraw/zinc/20/61/80/1355206180.db2.gz	QBDKTLIDKFKKNT-OXJNMPFZSA-N	0	3	337.467	3.243	20	30		EGEDHN
C=Cc1ccc(C(=O)NCC2CC(NCC(=C)Br)C2)cc1	ZINC001091249480	1361021011	/nfs/dbraw/zinc/02/10/11/1361021011.db2.gz	QSMVAEMQIVLLFF-UHFFFAOYSA-N	0	3	349.272	3.336	20	30		EGEDHN
CC(C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2)=C1CCCC1	ZINC001072608287	1355356674	/nfs/dbraw/zinc/35/66/74/1355356674.db2.gz	XKYGCPNQOZBXQD-UHFFFAOYSA-N	0	3	349.478	3.483	20	30		EGEDHN
CC[C@@]1(C)C[C@@H]1C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001073091450	1355589682	/nfs/dbraw/zinc/58/96/82/1355589682.db2.gz	KEXSKLQLHSWKQN-QUCCMNQESA-N	0	3	337.467	3.029	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C(C)(C)c3ccc(CC)cc3)C2)C1	ZINC001073116520	1355605709	/nfs/dbraw/zinc/60/57/09/1355605709.db2.gz	RCFTUIYYLIXKIR-UHFFFAOYSA-N	0	3	338.495	3.084	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C3(c4ccccc4)CCCC3)C2)C1	ZINC001073406863	1355761624	/nfs/dbraw/zinc/76/16/24/1355761624.db2.gz	WBRAQTFLQZMYRG-UHFFFAOYSA-N	0	3	336.479	3.056	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@H](c3ccc(F)cc3)C(C)C)C2)C1	ZINC001073469923	1355803763	/nfs/dbraw/zinc/80/37/63/1355803763.db2.gz	PUCFTXLIGOJZFU-SFHVURJKSA-N	0	3	330.447	3.286	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2scc(C)c2Cl)C1	ZINC001073617936	1355846330	/nfs/dbraw/zinc/84/63/30/1355846330.db2.gz	PWCHPQUFOASLIV-ZDUSSCGKSA-N	0	3	342.892	3.107	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2ccccc2C(C)C)C1	ZINC001073629773	1355848330	/nfs/dbraw/zinc/84/83/30/1355848330.db2.gz	FQAIEHFNDVKXRO-KRWDZBQOSA-N	0	3	330.472	3.207	20	30		EGEDHN
CN(Cc1ccccc1)C[C@H]1CCCCN1C(=O)c1ccc(C#N)[nH]1	ZINC001073995235	1356023873	/nfs/dbraw/zinc/02/38/73/1356023873.db2.gz	HJXFNDAGJCAFIA-GOSISDBHSA-N	0	3	336.439	3.013	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccoc2)CC[C@@H]1CNCc1ccccc1C#N	ZINC001075224668	1356350508	/nfs/dbraw/zinc/35/05/08/1356350508.db2.gz	XNWRAOUWDDMZNN-NVXWUHKLSA-N	0	3	337.423	3.039	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCO[C@@H]1C1CCN(C(=O)C=C(C)C)CC1	ZINC001075400505	1356357520	/nfs/dbraw/zinc/35/75/20/1356357520.db2.gz	YMHUWNYLZNIIKY-FUHWJXTLSA-N	0	3	340.895	3.081	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@@H](CC)Cc3ccccc3)[C@@H]2C1	ZINC001076312223	1356545566	/nfs/dbraw/zinc/54/55/66/1356545566.db2.gz	OULAUNDDNBAPBH-SLFFLAALSA-N	0	3	326.484	3.364	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@@H](C)Cc3ccc(C)cc3)[C@@H]2C1	ZINC001076614696	1356633048	/nfs/dbraw/zinc/63/30/48/1356633048.db2.gz	YGFGYCDMARGAME-YSIASYRMSA-N	0	3	326.484	3.282	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3ccc(C4=CCCC4)cc3)[C@@H]2C1	ZINC001076657501	1356642232	/nfs/dbraw/zinc/64/22/32/1356642232.db2.gz	FWKYQUHNHVHUTP-LEWJYISDSA-N	0	3	334.463	3.424	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccn3ccccc23)C12CCC2	ZINC001078677709	1357051111	/nfs/dbraw/zinc/05/11/11/1357051111.db2.gz	IXMMJGJLKZRDFF-DLBZAZTESA-N	0	3	343.858	3.322	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc(C(C)C)on2)C12CCC2	ZINC001078688985	1357054179	/nfs/dbraw/zinc/05/41/79/1357054179.db2.gz	ZDINQHQYQDDSEI-LSDHHAIUSA-N	0	3	337.851	3.181	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)C2(C)CCC2)C12CCC2	ZINC001078701260	1357061932	/nfs/dbraw/zinc/06/19/32/1357061932.db2.gz	YVCOFCGSUDXOGK-QWHCGFSZSA-N	0	3	341.293	3.102	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@@H](NCc3cnc(C)o3)C23CCC3)CC1	ZINC001078716833	1357063156	/nfs/dbraw/zinc/06/31/56/1357063156.db2.gz	ZHNKXKUNDRUEIF-MSOLQXFVSA-N	0	3	343.471	3.246	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2cc(C)sc2C)C[C@H]1c1ccccc1	ZINC001081141360	1357844857	/nfs/dbraw/zinc/84/48/57/1357844857.db2.gz	OWHXTZUTMNRJQO-RBUKOAKNSA-N	0	3	338.476	3.196	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](c2ccccc2)[C@H](NCc2cccnc2)C1	ZINC001081159755	1357846015	/nfs/dbraw/zinc/84/60/15/1357846015.db2.gz	BKPXIIKUCJVQSK-VQTJNVASSA-N	0	3	349.478	3.378	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2ccc(C=C)cc2)C[C@H]1c1ccccc1	ZINC001081185305	1357848478	/nfs/dbraw/zinc/84/84/78/1357848478.db2.gz	YWCPKMBLVVLXCA-LEWJYISDSA-N	0	3	330.431	3.161	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2cc(C)ccc2C2CC2)[C@H](OC)C1	ZINC001081981176	1357908699	/nfs/dbraw/zinc/90/86/99/1357908699.db2.gz	WZSLBLGSHUSQMD-WOJBJXKFSA-N	0	3	342.483	3.268	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)C(C)(C)c2ccc(C)cc2)[C@H](OC)C1	ZINC001082333133	1358018957	/nfs/dbraw/zinc/01/89/57/1358018957.db2.gz	QANKNYGZRUTOEY-RTBURBONSA-N	0	3	344.499	3.054	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2sccc2C(C)C)[C@H](OC)C1	ZINC001082382004	1358024991	/nfs/dbraw/zinc/02/49/91/1358024991.db2.gz	JYZUHQKALRMDQT-HZPDHXFCSA-N	0	3	336.501	3.267	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)[C@@H]3CC[C@@H](c4ccccc4)C3)[C@@H]2C1	ZINC001084446807	1358215948	/nfs/dbraw/zinc/21/59/48/1358215948.db2.gz	PQEXHLYBFKYRAT-XRXFAXGQSA-N	0	3	336.479	3.126	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@@H]3CCCC[C@@H]3C(F)(F)F)[C@@H]2C1	ZINC001084452826	1358217225	/nfs/dbraw/zinc/21/72/25/1358217225.db2.gz	YZKADUWSLJBBAB-LVQVYYBASA-N	0	3	344.421	3.464	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CCN(CCc3ccccc3)C[C@H]21	ZINC001084635048	1358263681	/nfs/dbraw/zinc/26/36/81/1358263681.db2.gz	NZIZXWXFMAFKAJ-SBHAEUEKSA-N	0	3	326.484	3.364	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3oc(C(C)C)nc3C)[C@@H]2C1	ZINC001084709984	1358289424	/nfs/dbraw/zinc/28/94/24/1358289424.db2.gz	FFHDZIUHYQTKSH-HZPDHXFCSA-N	0	3	331.460	3.219	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N1C[C@H]2CCN(CC3=CCCCC3)C[C@H]21	ZINC001084715535	1358290451	/nfs/dbraw/zinc/29/04/51/1358290451.db2.gz	KGRPLWBHOPGFMD-WCIQWLHISA-N	0	3	344.499	3.001	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)C[C@H](C)c3ccccc3F)[C@@H]2C1	ZINC001084724763	1358293548	/nfs/dbraw/zinc/29/35/48/1358293548.db2.gz	SPKRVLUFBYBDFM-FRQCXROJSA-N	0	3	330.447	3.428	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)[C@H](CC)c3ccc(Cl)cc3)[C@@H]2C1	ZINC001084846398	1358327402	/nfs/dbraw/zinc/32/74/02/1358327402.db2.gz	GFXJMJCOPQKYNT-BHIYHBOVSA-N	0	3	344.886	3.390	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C3CC(c4ccccc4)C3)C[C@@H]21	ZINC001085105330	1358393430	/nfs/dbraw/zinc/39/34/30/1358393430.db2.gz	XLQQSHZWHWNLIZ-UEKLYDJUSA-N	0	3	336.479	3.126	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCCC[C@H]2NC(=O)c2ccoc2)c(F)c1	ZINC001085133818	1358408117	/nfs/dbraw/zinc/40/81/17/1358408117.db2.gz	TUHOUQDFRRVRER-QZTJIDSGSA-N	0	3	341.386	3.121	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cc2ccccc2nn1	ZINC001085292083	1358455393	/nfs/dbraw/zinc/45/53/93/1358455393.db2.gz	RWGWHYZQLYEIQS-HZPDHXFCSA-N	0	3	344.846	3.013	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1CCCc2cccnc21	ZINC001085306333	1358461064	/nfs/dbraw/zinc/46/10/64/1358461064.db2.gz	UXUYAWURNMLQCT-BRWVUGGUSA-N	0	3	347.890	3.271	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccn2cc(C)nc2c1	ZINC001085331988	1358470140	/nfs/dbraw/zinc/47/01/40/1358470140.db2.gz	HGXJPAHWNIEBEY-HZPDHXFCSA-N	0	3	346.862	3.026	20	30		EGEDHN
C=CCn1cccc1C(=O)N(C)C[C@H]1CCN1CCCC1CCC1	ZINC001085641549	1358655404	/nfs/dbraw/zinc/65/54/04/1358655404.db2.gz	PLSXPRQERVJBEW-GOSISDBHSA-N	0	3	329.488	3.401	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC001085672612	1358677572	/nfs/dbraw/zinc/67/75/72/1358677572.db2.gz	CAXHTMRHNMBUKJ-RBSFLKMASA-N	0	3	330.394	3.240	20	30		EGEDHN
C=CCOc1ccc(C(=O)N(C)C[C@H]2CCN2CCC(=C)C)cc1	ZINC001085678977	1358683149	/nfs/dbraw/zinc/68/31/49/1358683149.db2.gz	XDFUQWIXSYSDTD-GOSISDBHSA-N	0	3	328.456	3.364	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1nc(Cl)sc1C	ZINC001085715500	1358707180	/nfs/dbraw/zinc/70/71/80/1358707180.db2.gz	MEDWDVLRLQTLTB-LBPRGKRZSA-N	0	3	327.881	3.217	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cccc(N2CC=CC2)c1	ZINC001085846759	1358815128	/nfs/dbraw/zinc/81/51/28/1358815128.db2.gz	QOEGHKJKBKAJPU-HXUWFJFHSA-N	0	3	339.483	3.175	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc(OC)cc1Cl	ZINC001085876708	1358841908	/nfs/dbraw/zinc/84/19/08/1358841908.db2.gz	IJQAQGHEECFQGR-AWEZNQCLSA-N	0	3	336.863	3.461	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1occc1Br	ZINC001085878776	1358842603	/nfs/dbraw/zinc/84/26/03/1358842603.db2.gz	MQOWAHAVSDEKQO-GFCCVEGCSA-N	0	3	341.249	3.155	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1cc(C)n(CC2CC2)c1C	ZINC001085927430	1358885322	/nfs/dbraw/zinc/88/53/22/1358885322.db2.gz	YBNMNXCTBONDEX-SFHVURJKSA-N	0	3	329.488	3.237	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C[C@@H]2CCN2CCCC2CCCC2)nc1	ZINC001085933520	1358887784	/nfs/dbraw/zinc/88/77/84/1358887784.db2.gz	DJSUCCTVNGQKAQ-IBGZPJMESA-N	0	3	339.483	3.180	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc2nc(C)ccc2o1	ZINC001085937911	1358894234	/nfs/dbraw/zinc/89/42/34/1358894234.db2.gz	RWVZAQYMZIAALH-OAHLLOKOSA-N	0	3	327.428	3.249	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc(OC)c(OC)cc1C	ZINC001085982939	1358935342	/nfs/dbraw/zinc/93/53/42/1358935342.db2.gz	VEEOQZRHKIQZCW-INIZCTEOSA-N	0	3	346.471	3.125	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1cccc2c1OCC2(C)C	ZINC001086005303	1358957906	/nfs/dbraw/zinc/95/79/06/1358957906.db2.gz	CAUJEGHPBZXULM-HNNXBMFYSA-N	0	3	328.456	3.079	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cn(C)c3ccccc23)C1	ZINC001086140038	1359006235	/nfs/dbraw/zinc/00/62/35/1359006235.db2.gz	PPNIYYLSZUJONW-OKILXGFUSA-N	0	3	331.847	3.029	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)[C@@H]2CCCC[C@H]2C)C1	ZINC001086182241	1359018643	/nfs/dbraw/zinc/01/86/43/1359018643.db2.gz	WECFHFYUOAPDIL-REBRKWNGSA-N	0	3	343.309	3.206	20	30		EGEDHN
C[C@@H]1CC[C@@H](C(=O)NC[C@H]2C[C@@H](NCc3cc(C#N)ccc3F)C2)C1	ZINC001086216231	1359030202	/nfs/dbraw/zinc/03/02/02/1359030202.db2.gz	NAYYXABQHCGBCF-IIVZCXTMSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@@H]2C[C@H]2c2ccc(OC)cc2)C1	ZINC001086220982	1359031558	/nfs/dbraw/zinc/03/15/58/1359031558.db2.gz	BANUTHRXIKYXKI-UNQWWWNPSA-N	0	3	348.874	3.036	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2csc(C(C)(C)C)n2)C1	ZINC001086225682	1359032574	/nfs/dbraw/zinc/03/25/74/1359032574.db2.gz	FRAPEMQNTBYHHT-TXEJJXNPSA-N	0	3	341.908	3.291	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cccn2C2CCCC2)C1	ZINC001086234995	1359034833	/nfs/dbraw/zinc/03/48/33/1359034833.db2.gz	SSNFDUGWQVLXQR-GASCZTMLSA-N	0	3	335.879	3.454	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)[C@H]2CC[C@H](C)CC2)C1	ZINC001086257625	1359043867	/nfs/dbraw/zinc/04/38/67/1359043867.db2.gz	LXQIIGUXJHRJSX-GBLIKLQTSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cccc(Cl)c2C)C1	ZINC001086373473	1359080189	/nfs/dbraw/zinc/08/01/89/1359080189.db2.gz	YVHGUMQWEVUDKO-JOCQHMNTSA-N	0	3	327.255	3.499	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccnn2C(CC)CC)C1	ZINC001086386833	1359084676	/nfs/dbraw/zinc/08/46/76/1359084676.db2.gz	ITHCIBGYWMTGFU-HDJSIYSDSA-N	0	3	338.883	3.095	20	30		EGEDHN
C=Cc1ccc(C(=O)NC[C@H]2C[C@H](NCC(=C)Br)C2)cc1	ZINC001086486804	1359115474	/nfs/dbraw/zinc/11/54/74/1359115474.db2.gz	QSMVAEMQIVLLFF-KOMQPUFPSA-N	0	3	349.272	3.336	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)c2csc(C)c2)C1	ZINC001086505693	1359122539	/nfs/dbraw/zinc/12/25/39/1359122539.db2.gz	KKEJUFUFTDVTQE-AULYBMBSSA-N	0	3	343.290	3.063	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(C(F)F)cc2)C1	ZINC001086505514	1359122823	/nfs/dbraw/zinc/12/28/23/1359122823.db2.gz	BTQVCABPXJASSQ-YEORSEQZSA-N	0	3	328.790	3.475	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cnc3ccc(F)cc3c2)C1	ZINC001086525040	1359131688	/nfs/dbraw/zinc/13/16/88/1359131688.db2.gz	AGJBVDPWUYDAPQ-YGUOUDRMSA-N	0	3	347.821	3.224	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)C2CCC=CCC2)C1	ZINC001086553161	1359143001	/nfs/dbraw/zinc/14/30/01/1359143001.db2.gz	ZPLMKTVGHDVHCZ-CTYIDZIISA-N	0	3	341.293	3.126	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cnc(C(C)C)s2)C1	ZINC001086567708	1359149725	/nfs/dbraw/zinc/14/97/25/1359149725.db2.gz	SUKBYFMLAUHYOF-HAQNSBGRSA-N	0	3	327.881	3.117	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)[C@@H]2[C@@H]3Cc4ccccc4[C@@H]32)C1	ZINC001086821946	1359208736	/nfs/dbraw/zinc/20/87/36/1359208736.db2.gz	JCYVTAHSLJAQSC-NQRYUEEHSA-N	0	3	344.886	3.199	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)/C=C\c3ccco3)C2)CC1	ZINC001086898136	1359227462	/nfs/dbraw/zinc/22/74/62/1359227462.db2.gz	BEKUIVOBWBNCJM-ZPUOCTKUSA-N	0	3	326.440	3.019	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)C[C@H]3CCC(F)(F)C3)C2)CC1	ZINC001086925715	1359250947	/nfs/dbraw/zinc/25/09/47/1359250947.db2.gz	FMZXFYCDSRMLPY-JKSUJKDBSA-N	0	3	338.442	3.148	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3[nH]ccc3C3CC3)C2)CC1	ZINC001086925648	1359250969	/nfs/dbraw/zinc/25/09/69/1359250969.db2.gz	CNMOWFYVKJXJBA-INIZCTEOSA-N	0	3	339.483	3.232	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CC2(C[C@H]1C)CCN(CC#CC)CC2	ZINC001086927224	1359252622	/nfs/dbraw/zinc/25/26/22/1359252622.db2.gz	WEUBGBRHGKLADI-GOSISDBHSA-N	0	3	339.483	3.014	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cc(F)c(C)cc3F)C2)CC1	ZINC001086927647	1359252753	/nfs/dbraw/zinc/25/27/53/1359252753.db2.gz	HZPHCMBMKLUFKW-HNNXBMFYSA-N	0	3	346.421	3.223	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@H]3CCCCC3(F)F)C2)CC1	ZINC001086934154	1359257747	/nfs/dbraw/zinc/25/77/47/1359257747.db2.gz	INQDMXLYZRRTMG-HZPDHXFCSA-N	0	3	338.442	3.148	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc(C)cc(F)c3)C2)CC1	ZINC001086943845	1359264879	/nfs/dbraw/zinc/26/48/79/1359264879.db2.gz	GVVZJQYSZJZZBK-MRXNPFEDSA-N	0	3	328.431	3.084	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc(C)cc(F)c3)C2)CC1	ZINC001086944008	1359265237	/nfs/dbraw/zinc/26/52/37/1359265237.db2.gz	LEAHTLGXSGIKJK-QGZVFWFLSA-N	0	3	342.458	3.474	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3cc(F)cc(F)c3)C2)CC1	ZINC001086955739	1359276534	/nfs/dbraw/zinc/27/65/34/1359276534.db2.gz	VKRZEPISABVNKH-HNNXBMFYSA-N	0	3	346.421	3.305	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)C3CC(C(C)(C)C)C3)C2)CC1	ZINC001086958290	1359279133	/nfs/dbraw/zinc/27/91/33/1359279133.db2.gz	LTOIZIFNYUXGDC-WWDZGPRUSA-N	0	3	330.516	3.395	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC001087111920	1359290176	/nfs/dbraw/zinc/29/01/76/1359290176.db2.gz	FGIRICCIZDJOCS-QAPCUYQASA-N	0	3	345.462	3.460	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(C)s3)C(C)(C)[C@H]21	ZINC001087266585	1359337909	/nfs/dbraw/zinc/33/79/09/1359337909.db2.gz	NUIBVOGRXPLBJC-OIISXLGYSA-N	0	3	330.497	3.299	20	30		EGEDHN
CC1(C)[C@H](NC(=O)C2CC2)[C@H]2CCCN(Cc3ccc(C#N)cc3)[C@H]21	ZINC001087266787	1359338135	/nfs/dbraw/zinc/33/81/35/1359338135.db2.gz	QIZGVZJXOOMWEN-GUDVDZBRSA-N	0	3	337.467	3.073	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccoc3Cl)C(C)(C)[C@H]21	ZINC001087282123	1359361762	/nfs/dbraw/zinc/36/17/62/1359361762.db2.gz	RWUYJNPNYPLYTC-SNPRPXQTSA-N	0	3	334.847	3.175	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc(CC)o3)C(C)(C)[C@H]21	ZINC001087291922	1359372550	/nfs/dbraw/zinc/37/25/50/1359372550.db2.gz	CJAVDOABBFGDGR-NJAFHUGGSA-N	0	3	328.456	3.084	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc4ccsc4[nH]3)C(C)(C)[C@@H]21	ZINC001087296785	1359377629	/nfs/dbraw/zinc/37/76/29/1359377629.db2.gz	FWQHEYPXLBWXKP-FVQBIDKESA-N	0	3	341.480	3.081	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc4ccccc4n3C)C(C)(C)[C@@H]21	ZINC001087302168	1359384911	/nfs/dbraw/zinc/38/49/11/1359384911.db2.gz	OPPDGMSRRHJLSG-NSISKUIASA-N	0	3	349.478	3.030	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc4ncccc4c3)C(C)(C)[C@H]21	ZINC001087302270	1359384965	/nfs/dbraw/zinc/38/49/65/1359384965.db2.gz	QBBYWXRZTYXTQO-HOJAQTOUSA-N	0	3	347.462	3.087	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(F)cc(Cl)c3)C(C)(C)[C@H]21	ZINC001087305467	1359390227	/nfs/dbraw/zinc/39/02/27/1359390227.db2.gz	SUDDTYMQDYFOAM-ZACQAIPSSA-N	0	3	348.849	3.331	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccoc3CCC)C(C)(C)[C@H]21	ZINC001087312759	1359401325	/nfs/dbraw/zinc/40/13/25/1359401325.db2.gz	JWZBTKBXRMTLKP-NEWSRXKRSA-N	0	3	342.483	3.474	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc4ccccc4n3)C(C)(C)[C@H]21	ZINC001087315187	1359404892	/nfs/dbraw/zinc/40/48/92/1359404892.db2.gz	XORRESLZFXQNCL-AHRSYUTCSA-N	0	3	347.462	3.087	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cnc(C(C)C)s3)C(C)(C)[C@@H]21	ZINC001087320435	1359413090	/nfs/dbraw/zinc/41/30/90/1359413090.db2.gz	DUURQMCQAYFHAL-FVQBIDKESA-N	0	3	345.512	3.119	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1Cc1cncs1	ZINC001087378215	1359438838	/nfs/dbraw/zinc/43/88/38/1359438838.db2.gz	KNLADLZAAOGYKB-ORQFMDKSSA-N	0	3	345.512	3.024	20	30		EGEDHN
C=CCCN1CC[C@H](c2ccc(F)cc2)[C@H](NC(=O)[C@@H]2CC23CC3)C1	ZINC001087468405	1359480182	/nfs/dbraw/zinc/48/01/82/1359480182.db2.gz	XETGRCVQNZFYOL-CEXWTWQISA-N	0	3	342.458	3.476	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)c2ccc(C#N)[nH]2)CCN1Cc1csc(C)c1	ZINC001087545340	1359525433	/nfs/dbraw/zinc/52/54/33/1359525433.db2.gz	DRINLMWNJVVBSL-DOTOQJQBSA-N	0	3	342.468	3.039	20	30		EGEDHN
C=CCCN1CC[C@H](NC(=O)c2cnc([C@H](C)OC)s2)[C@H]1CC	ZINC001087573192	1359537901	/nfs/dbraw/zinc/53/79/01/1359537901.db2.gz	XLRDXGAHGKJMLJ-MELADBBJSA-N	0	3	337.489	3.009	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2coc(Br)c2)[C@H]1CC	ZINC001087592882	1359546953	/nfs/dbraw/zinc/54/69/53/1359546953.db2.gz	BXSYAWGRPJBORD-QWHCGFSZSA-N	0	3	341.249	3.201	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)[C@]2(C)CCCc3ccccc32)[C@H]1CC	ZINC001087763733	1359633161	/nfs/dbraw/zinc/63/31/61/1359633161.db2.gz	IOXCNFZZBDWDQG-QKNQBKEWSA-N	0	3	326.484	3.436	20	30		EGEDHN
Cc1ccc(C(=O)N2C[C@H]3CCN(Cc4ccc(C#N)cc4)C[C@H]3C2)o1	ZINC001087875230	1359692333	/nfs/dbraw/zinc/69/23/33/1359692333.db2.gz	LIOIYDQWKZHRHT-MOPGFXCFSA-N	0	3	349.434	3.054	20	30		EGEDHN
Cc1cc(C(=O)N2C[C@H]3CCN(Cc4cccc(C#N)c4)C[C@H]3C2)co1	ZINC001087945487	1359717747	/nfs/dbraw/zinc/71/77/47/1359717747.db2.gz	ZTNYACWHITWYRN-QUCCMNQESA-N	0	3	349.434	3.054	20	30		EGEDHN
C[C@H](c1cccc(F)c1)N1CC[C@@H]2CN(C(=O)C#CC3CC3)C[C@@H]2C1	ZINC001087959315	1359719565	/nfs/dbraw/zinc/71/95/65/1359719565.db2.gz	VCECWYMQZRPBHW-LZQZEXGQSA-N	0	3	340.442	3.080	20	30		EGEDHN
CC1(CC(=O)N2C[C@H]3CCN(Cc4cccc(C#N)c4)C[C@H]3C2)CC1	ZINC001088045293	1359733955	/nfs/dbraw/zinc/73/39/55/1359733955.db2.gz	KYXVDUUTPLAXHW-MOPGFXCFSA-N	0	3	337.467	3.029	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CCN(Cc3oc(C)nc3C)C[C@H]2C1	ZINC001088064801	1359740140	/nfs/dbraw/zinc/74/01/40/1359740140.db2.gz	VZEVUVFWMHSASD-SJORKVTESA-N	0	3	345.487	3.174	20	30		EGEDHN
C[C@]1(C(=O)N2C[C@H]3CCN(Cc4cccc(C#N)c4)C[C@H]3C2)C=CCC1	ZINC001088070801	1359744490	/nfs/dbraw/zinc/74/44/90/1359744490.db2.gz	BEHPYXLSGSSULC-URVUXULASA-N	0	3	349.478	3.195	20	30		EGEDHN
C[C@@]1(C(=O)N2C[C@H]3CCN(Cc4cccc(C#N)c4)C[C@H]3C2)C=CCC1	ZINC001088070800	1359744553	/nfs/dbraw/zinc/74/45/53/1359744553.db2.gz	BEHPYXLSGSSULC-RZUBCFFCSA-N	0	3	349.478	3.195	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CN(C(=O)[C@@H]4CC45CCC5)C[C@@H]3C2)cc1	ZINC001088123312	1359763673	/nfs/dbraw/zinc/76/36/73/1359763673.db2.gz	MKAQUQRBZUYRKG-AABGKKOBSA-N	0	3	349.478	3.029	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)[C@@H](CC)CC3CCCCC3)C[C@@H]2C1	ZINC001088127233	1359765774	/nfs/dbraw/zinc/76/57/74/1359765774.db2.gz	STGLIWNFENUNSU-ZCNNSNEGSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3c(C)csc3Cl)C[C@@H]2C1	ZINC001088182726	1359784699	/nfs/dbraw/zinc/78/46/99/1359784699.db2.gz	ZLVUIPIMELLEOC-KGLIPLIRSA-N	0	3	336.888	3.127	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](CNCc2nc(C)cs2)[C@@H](C)C1	ZINC001184209712	1387415394	/nfs/dbraw/zinc/41/53/94/1387415394.db2.gz	PWOCAWKLNXCFTI-DOTOQJQBSA-N	0	3	347.528	3.219	20	30		EGEDHN
C=CCN1CC[C@H](OCC2CCN(C(=O)CC3CCCCC3)CC2)C1	ZINC001088227172	1359805768	/nfs/dbraw/zinc/80/57/68/1359805768.db2.gz	HTVJDDNZUFSCRY-FQEVSTJZSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCCCN(C(=O)[C@@H](C)SC)C1	ZINC001088267483	1359822447	/nfs/dbraw/zinc/82/24/47/1359822447.db2.gz	VWJMHCPKPFEGLI-CHWSQXEVSA-N	0	3	349.338	3.007	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2c(C)noc2CC)C1	ZINC001088423501	1359892847	/nfs/dbraw/zinc/89/28/47/1359892847.db2.gz	UPZIXBIBGNBHAA-AWEZNQCLSA-N	0	3	339.867	3.272	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](CNCc2nc(C)c(C)s2)[C@@H](C)C1	ZINC001184302779	1387424819	/nfs/dbraw/zinc/42/48/19/1387424819.db2.gz	WIYNKFKJKYDZIN-YOEHRIQHSA-N	0	3	347.528	3.138	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](CNCc2csc(CC)n2)[C@@H](C)C1	ZINC001184313165	1387427634	/nfs/dbraw/zinc/42/76/34/1387427634.db2.gz	XGQMQNVBRRKZJA-JKSUJKDBSA-N	0	3	347.528	3.083	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CCN(Cc3ccc(CC)cc3)[C@@H]2C)c1	ZINC001088846833	1360080376	/nfs/dbraw/zinc/08/03/76/1360080376.db2.gz	JOOBOSOGPDBHFB-IERDGZPVSA-N	0	3	347.462	3.018	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccnc(O[C@H](C)CC)c2)[C@H]1C	ZINC001088967477	1360119115	/nfs/dbraw/zinc/11/91/15/1360119115.db2.gz	JUPVFNZPFDZRGJ-INMHGKMJSA-N	0	3	331.460	3.028	20	30		EGEDHN
C[C@@H](C(=O)N1CCCC[C@H]1CN(C)Cc1cccc(C#N)c1)C1CC1	ZINC001089148109	1360203345	/nfs/dbraw/zinc/20/33/45/1360203345.db2.gz	LMQRFYVBVKVXHC-UZLBHIALSA-N	0	3	339.483	3.417	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCCN1C(=O)[C@H]1CC12CC2	ZINC001089234028	1360273202	/nfs/dbraw/zinc/27/32/02/1360273202.db2.gz	SOKSWARVVGIQGM-RBUKOAKNSA-N	0	3	337.467	3.171	20	30		EGEDHN
CC1(C)C[C@H](NC(=O)c2cc[nH]c2)CCN(CC#Cc2ccccc2)C1	ZINC001089391828	1360392292	/nfs/dbraw/zinc/39/22/92/1360392292.db2.gz	PQEMAUHXNBPAFB-HXUWFJFHSA-N	0	3	349.478	3.287	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2c(C)cccc2C)CC(C)(C)C1	ZINC001089398971	1360398834	/nfs/dbraw/zinc/39/88/34/1360398834.db2.gz	QRPLIWFIZAGVIT-GOSISDBHSA-N	0	3	326.484	3.086	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(F)ccc2F)CC(C)(C)C1	ZINC001089406662	1360404985	/nfs/dbraw/zinc/40/49/85/1360404985.db2.gz	PLCVLAAIKVOKLO-OAHLLOKOSA-N	0	3	334.410	3.209	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2cccc(CC)c2)CC(C)(C)C1	ZINC001089424760	1360417750	/nfs/dbraw/zinc/41/77/50/1360417750.db2.gz	YOTBUNMZXSMOGO-IBGZPJMESA-N	0	3	326.484	3.032	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(-n3cccc3)cc2)CC(C)(C)C1	ZINC001089434540	1360425523	/nfs/dbraw/zinc/42/55/23/1360425523.db2.gz	UNNJUZWZTFRWBL-IBGZPJMESA-N	0	3	349.478	3.331	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2cccc3ncccc23)CC(C)(C)C1	ZINC001089439073	1360429498	/nfs/dbraw/zinc/42/94/98/1360429498.db2.gz	QLUIGDABGWSHDL-SFHVURJKSA-N	0	3	349.478	3.017	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2nc(Cl)cs2)CC(C)(C)C1	ZINC001089477077	1360459693	/nfs/dbraw/zinc/45/96/93/1360459693.db2.gz	LAVFXLCRSLPSPP-GFCCVEGCSA-N	0	3	339.892	3.040	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2cc(C)cc(C)c2)CC(C)(C)C1	ZINC001089483832	1360464398	/nfs/dbraw/zinc/46/43/98/1360464398.db2.gz	NWEBDYNKFZNLPH-LJQANCHMSA-N	0	3	326.484	3.086	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc([C@@H](C)CC)no2)CC(C)(C)C1	ZINC001089509403	1360481040	/nfs/dbraw/zinc/48/10/40/1360481040.db2.gz	BOXOQVUPUKUAPE-JKSUJKDBSA-N	0	3	345.487	3.432	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C2(c3ccccc3F)CC2)CC(C)(C)C1	ZINC001089533729	1360493831	/nfs/dbraw/zinc/49/38/31/1360493831.db2.gz	IAAHEYMFTYTMJB-MRXNPFEDSA-N	0	3	342.458	3.097	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc3cccc(F)c3o2)CC(C)(C)C1	ZINC001089561541	1360509385	/nfs/dbraw/zinc/50/93/85/1360509385.db2.gz	QXDOHQSLJFPKJD-OAHLLOKOSA-N	0	3	342.414	3.426	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2c[nH]c3ccc(F)cc23)CC(C)(C)C1	ZINC001089568458	1360513995	/nfs/dbraw/zinc/51/39/95/1360513995.db2.gz	LGOUAJLAZCFSQC-HNNXBMFYSA-N	0	3	341.430	3.161	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1ncnc2sccc21	ZINC001089642094	1360555583	/nfs/dbraw/zinc/55/55/83/1360555583.db2.gz	BCFHEDZTJLSQMF-ZDUSSCGKSA-N	0	3	344.484	3.098	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](CNCc2cnc(C)o2)[C@H](C)C1	ZINC001184447621	1387462735	/nfs/dbraw/zinc/46/27/35/1387462735.db2.gz	JVLSKONVGJNQGZ-CRAIPNDOSA-N	0	3	345.487	3.326	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(F)ccc1F	ZINC001089651918	1360563976	/nfs/dbraw/zinc/56/39/76/1360563976.db2.gz	QXWQWMKSLTXNDY-HNNXBMFYSA-N	0	3	334.410	3.209	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(F)c(F)c1	ZINC001089651752	1360564494	/nfs/dbraw/zinc/56/44/94/1360564494.db2.gz	MIEQPLWHSWFGPP-HNNXBMFYSA-N	0	3	334.410	3.209	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@H]1CCC(C)(C)CN1CC(=C)C	ZINC001089651797	1360564646	/nfs/dbraw/zinc/56/46/46/1360564646.db2.gz	NZNVVHRYLXKEGW-QGZVFWFLSA-N	0	3	329.488	3.471	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1c[nH]nc1C(C)C	ZINC001089664258	1360574202	/nfs/dbraw/zinc/57/42/02/1360574202.db2.gz	GMCFVBGQDHICDJ-HNNXBMFYSA-N	0	3	332.492	3.330	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(CCC)n[nH]1	ZINC001089677724	1360585530	/nfs/dbraw/zinc/58/55/30/1360585530.db2.gz	BJVCAHWSACJULT-MRXNPFEDSA-N	0	3	332.492	3.159	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(F)ccc1C	ZINC001089677572	1360586006	/nfs/dbraw/zinc/58/60/06/1360586006.db2.gz	ZSQAZLSHVNNRAN-KRWDZBQOSA-N	0	3	330.447	3.378	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cccc2c[nH]nc21	ZINC001089681130	1360587520	/nfs/dbraw/zinc/58/75/20/1360587520.db2.gz	ZSDCKRDTKDOBHE-MRXNPFEDSA-N	0	3	340.471	3.359	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1cccnc1	ZINC001089699902	1360602929	/nfs/dbraw/zinc/60/29/29/1360602929.db2.gz	RZOMKOHCNVHENF-CEXWTWQISA-N	0	3	341.499	3.368	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc2ccccc2[nH]1	ZINC001089731283	1360635483	/nfs/dbraw/zinc/63/54/83/1360635483.db2.gz	OXJFZIXIXLMQNJ-KRWDZBQOSA-N	0	3	337.467	3.412	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)CCc1ccco1	ZINC001089769285	1360657184	/nfs/dbraw/zinc/65/71/84/1360657184.db2.gz	KAMOFQHBNQWZJO-OWLYRPNTSA-N	0	3	348.874	3.134	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1ccoc1C	ZINC001089771304	1360657898	/nfs/dbraw/zinc/65/78/98/1360657898.db2.gz	YKJVAHSFYSRKLR-SVGFKBNWSA-N	0	3	334.847	3.123	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](CNCc2nccs2)[C@H](C)C1	ZINC001184461774	1387466626	/nfs/dbraw/zinc/46/66/26/1387466626.db2.gz	VOOBJSAYQGRGLZ-NVXWUHKLSA-N	0	3	347.528	3.486	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1cc(C)c(C)o1	ZINC001089797166	1360667897	/nfs/dbraw/zinc/66/78/97/1360667897.db2.gz	JXUFMBUBFGVLLH-YVSFHVDLSA-N	0	3	348.874	3.431	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1C=CC=CC=C1	ZINC001089812836	1360674553	/nfs/dbraw/zinc/67/45/53/1360674553.db2.gz	PDFPUAIGOFYPPR-RDGPPVDQSA-N	0	3	344.886	3.206	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CC2CCCC2)CC2(CCOCC2)C1	ZINC001089920364	1360745007	/nfs/dbraw/zinc/74/50/07/1360745007.db2.gz	QTADMGMKRLHRQF-SFHVURJKSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C(C)=C2CCCC2)CC2(CCOCC2)C1	ZINC001089937242	1360753282	/nfs/dbraw/zinc/75/32/82/1360753282.db2.gz	VCVXFSFXUCCYHD-LJQANCHMSA-N	0	3	346.515	3.440	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)[C@]2(C)CC=CCC2)CC2(CCOCC2)C1	ZINC001089938760	1360754419	/nfs/dbraw/zinc/75/44/19/1360754419.db2.gz	HPPCUJOGWIFNEG-AZUAARDMSA-N	0	3	346.515	3.296	20	30		EGEDHN
N#Cc1ccc(F)c(CNC2CC(CNC(=O)c3ccsc3)C2)c1	ZINC001090914231	1360952697	/nfs/dbraw/zinc/95/26/97/1360952697.db2.gz	QJYXXNNGKVRKJE-UHFFFAOYSA-N	0	3	343.427	3.057	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(Cl)c(C)c2)C1	ZINC001091214332	1361009972	/nfs/dbraw/zinc/00/99/72/1361009972.db2.gz	IAKQUOOSLRUKIO-UHFFFAOYSA-N	0	3	327.255	3.499	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)[C@@H]2CCC(C)(C)C2)C1	ZINC001091217572	1361011311	/nfs/dbraw/zinc/01/13/11/1361011311.db2.gz	BKEUKWSCFRBGHN-ROKHWSDSSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C23CC(c4ccccc4)(C2)C3)C1	ZINC001091380885	1361070424	/nfs/dbraw/zinc/07/04/24/1361070424.db2.gz	PRKUTGZOLUMCMD-UHFFFAOYSA-N	0	3	344.886	3.345	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cccc(Cl)c3C)C[C@]2(C)C1	ZINC001091692751	1361182050	/nfs/dbraw/zinc/18/20/50/1361182050.db2.gz	QAMMWMXZZJTNAA-BEFAXECRSA-N	0	3	330.859	3.066	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CN(Cc3c(C)noc3C)C[C@@]2(C)C1	ZINC001091975747	1361264366	/nfs/dbraw/zinc/26/43/66/1361264366.db2.gz	WLGNVXKFAYCTCJ-AHRSYUTCSA-N	0	3	345.487	3.174	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CN(Cc3ncccc3C)C[C@@]2(C)C1	ZINC001091977955	1361265365	/nfs/dbraw/zinc/26/53/65/1361265365.db2.gz	CFRFCBSCLYQJCI-UIFIKXQLSA-N	0	3	341.499	3.273	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@]3(C)CC[C@H](C)C3(C)C)C[C@]2(C)C1	ZINC001092072542	1361289141	/nfs/dbraw/zinc/28/91/41/1361289141.db2.gz	ZZICHRPNCGVDEC-JWWGGVBKSA-N	0	3	330.516	3.252	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc(CCC)c(C)s3)C[C@]2(C)C1	ZINC001092260295	1361346532	/nfs/dbraw/zinc/34/65/32/1361346532.db2.gz	SOASSKLAFFLXBL-XLIONFOSSA-N	0	3	344.524	3.426	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc(-c4ccccc4)co3)C[C@]2(C)C1	ZINC001092327923	1361366475	/nfs/dbraw/zinc/36/64/75/1361366475.db2.gz	KZUZAEHLMVEOGC-KNQAVFIVSA-N	0	3	348.446	3.364	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@@H]2CN(C/C=C/Cl)C[C@H]2C)cc1	ZINC001092739816	1361450712	/nfs/dbraw/zinc/45/07/12/1361450712.db2.gz	DRPUCMUIGBUAKK-IUZRFUNMSA-N	0	3	348.874	3.302	20	30		EGEDHN
C#CCN1C[C@@H](CNC(=O)c2cc3cc(C)ccc3s2)[C@H](C)C1	ZINC001093095883	1361526135	/nfs/dbraw/zinc/52/61/35/1361526135.db2.gz	ZGKVUWUITWBBBR-GDBMZVCRSA-N	0	3	326.465	3.141	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)[C@H]2CC=CCC2)CC1	ZINC001093354695	1361568180	/nfs/dbraw/zinc/56/81/80/1361568180.db2.gz	IDCDJEREPVNUKT-RBUKOAKNSA-N	0	3	326.484	3.069	20	30		EGEDHN
CC[C@H](F)CN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C#CC2CC2)CC1	ZINC001093370755	1361580001	/nfs/dbraw/zinc/58/00/01/1361580001.db2.gz	YWWKKUZNUNUMBO-ICSRJNTNSA-N	0	3	346.490	3.241	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@@H]2C[C@H]2CCC)CC1	ZINC001093377168	1361587880	/nfs/dbraw/zinc/58/78/80/1361587880.db2.gz	GSJVWTWCWXLJBT-QRVBRYPASA-N	0	3	328.500	3.149	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)[C@@H]2CC23CCCC3)CC1	ZINC001093381102	1361592530	/nfs/dbraw/zinc/59/25/30/1361592530.db2.gz	GRDISHHYJBPRSQ-RBUKOAKNSA-N	0	3	340.511	3.293	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@]3(CNC(=O)C4CCC4)CCC[C@@H]23)s1	ZINC001094346632	1361770663	/nfs/dbraw/zinc/77/06/63/1361770663.db2.gz	AIFUHSHERGDXGP-IEBWSBKVSA-N	0	3	343.496	3.281	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1coc3cc(F)ccc13)C2	ZINC001095405009	1362129963	/nfs/dbraw/zinc/12/99/63/1362129963.db2.gz	JWXGRNZAVQJFAO-NJAFHUGGSA-N	0	3	342.414	3.412	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1coc3ccc(C)cc13)C2	ZINC001095481880	1362155194	/nfs/dbraw/zinc/15/51/94/1362155194.db2.gz	ASCSWZUFBYFMKU-NEWSRXKRSA-N	0	3	336.435	3.029	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc3ccncc3s1)C2	ZINC001095538115	1362164078	/nfs/dbraw/zinc/16/40/78/1362164078.db2.gz	ZNZLMSYVTGCVNL-ILXRZTDVSA-N	0	3	327.453	3.208	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc3cccc(OC)c3o1)C2	ZINC001095941128	1362295970	/nfs/dbraw/zinc/29/59/70/1362295970.db2.gz	JSJNZFJTEOMYIX-PMPSAXMXSA-N	0	3	340.423	3.353	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1coc(-c3ccccc3)n1)C2	ZINC001096366199	1362474851	/nfs/dbraw/zinc/47/48/51/1362474851.db2.gz	ABBNVMYOBOJINO-RYRKJORJSA-N	0	3	337.423	3.253	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3[C@H](C)c2ccccc2)cn1	ZINC001096379675	1362478569	/nfs/dbraw/zinc/47/85/69/1362478569.db2.gz	XOPXWWNELOMEBR-IDCXYZFESA-N	0	3	345.446	3.159	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1c(F)cccc1Cl)C2	ZINC001096415479	1362500132	/nfs/dbraw/zinc/50/01/32/1362500132.db2.gz	GDJCXISIYJBMKT-DQYPLSBCSA-N	0	3	336.838	3.319	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)CC1(c2ccccc2OC)CCC1	ZINC001184995658	1387584299	/nfs/dbraw/zinc/58/42/99/1387584299.db2.gz	ZLDOWCDGWXQABP-KRWDZBQOSA-N	0	3	342.483	3.274	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc3ccncc3s1)C2	ZINC001097226873	1362893088	/nfs/dbraw/zinc/89/30/88/1362893088.db2.gz	ZNZLMSYVTGCVNL-KFWWJZLASA-N	0	3	327.453	3.208	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@@H](NCc2cn(C(C)C)nc2C)C1	ZINC001185057200	1387602278	/nfs/dbraw/zinc/60/22/78/1387602278.db2.gz	ZYFNGRSARRBIKY-CRAIPNDOSA-N	0	3	332.492	3.065	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@@H](NCc2ccccc2N(C)C)C1	ZINC001185063707	1387605923	/nfs/dbraw/zinc/60/59/23/1387605923.db2.gz	GVOCCLHYTGOXCK-SJLPKXTDSA-N	0	3	329.488	3.045	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1CC)C2	ZINC001097734513	1363110785	/nfs/dbraw/zinc/11/07/85/1363110785.db2.gz	NWMUEMKVGIXETI-PPQDBTBKSA-N	0	3	336.479	3.097	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1cn(C)c3ccccc13)C2	ZINC001097755026	1363114996	/nfs/dbraw/zinc/11/49/96/1363114996.db2.gz	BJVXFDLIJKCNBR-POAQFYNOSA-N	0	3	337.467	3.018	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1scnc1C(C)(C)C)C2	ZINC001098001147	1363193690	/nfs/dbraw/zinc/19/36/90/1363193690.db2.gz	LFHBLOKBCWTVQH-MCIONIFRSA-N	0	3	333.501	3.352	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CC=C(C)C	ZINC001098006205	1363194967	/nfs/dbraw/zinc/19/49/67/1363194967.db2.gz	QYCSDLDXWDARDC-LFDJNIOPSA-N	0	3	332.488	3.045	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](C)c1ccc(F)c(F)c1)C2	ZINC001098441333	1363326610	/nfs/dbraw/zinc/32/66/10/1363326610.db2.gz	KHYKEEBZSDGFJM-GGBBIFEXSA-N	0	3	334.410	3.366	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C13CC(C(F)(F)F)(C1)C3)C2	ZINC001098468073	1363334727	/nfs/dbraw/zinc/33/47/27/1363334727.db2.gz	JZDINDQWPBWILW-XEUBVLPRSA-N	0	3	328.378	3.017	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cccc3oc(C)nc31)C2	ZINC001098474693	1363337396	/nfs/dbraw/zinc/33/73/96/1363337396.db2.gz	HPAYRFVHCHVZHH-BMFZPTHFSA-N	0	3	325.412	3.047	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C(C)(C)C1CCC1)C[C@H](C)O2	ZINC001098616610	1363400481	/nfs/dbraw/zinc/40/04/81/1363400481.db2.gz	OCIUXKUNMVJWIW-INIZCTEOSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H]1CCC(C)(C)C1)C[C@H](C)O2	ZINC001098635913	1363409546	/nfs/dbraw/zinc/40/95/46/1363409546.db2.gz	UZKFGLIYPLESID-DLBZAZTESA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H]2C[C@H]2c2sccc2C)C1	ZINC001098835432	1363487687	/nfs/dbraw/zinc/48/76/87/1363487687.db2.gz	SWEXFLGSBROGJI-MKSNKDDYSA-N	0	3	330.497	3.317	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H]2CCc3cc(F)ccc32)C1	ZINC001098946073	1363534109	/nfs/dbraw/zinc/53/41/09/1363534109.db2.gz	XQNWDXWDZLBJNB-QSFXBCCZSA-N	0	3	328.431	3.012	20	30		EGEDHN
C#CCCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc3occc3s2)C1	ZINC001099026968	1363582152	/nfs/dbraw/zinc/58/21/52/1363582152.db2.gz	MPMTZPUMTJTFDZ-UGSOOPFHSA-N	0	3	328.437	3.102	20	30		EGEDHN
CCCCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)C#CC(C)C	ZINC001099065118	1363604309	/nfs/dbraw/zinc/60/43/09/1363604309.db2.gz	MVDPALMDHSGGSE-GOSISDBHSA-N	0	3	336.520	3.069	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)C1(CCOCC)CCC1	ZINC001099075187	1363609858	/nfs/dbraw/zinc/60/98/58/1363609858.db2.gz	VZLWNMUWSOMJHH-SFHVURJKSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2csc(C(C)(C)C)n2)C1	ZINC001099079374	1363611205	/nfs/dbraw/zinc/61/12/05/1363611205.db2.gz	ROEMABPTRXULRQ-UGSOOPFHSA-N	0	3	333.501	3.211	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NC[C@@H]1CCC(C)(C)CN1CCOC	ZINC001099092664	1363618289	/nfs/dbraw/zinc/61/82/89/1363618289.db2.gz	ICFAIIXRFFUFST-AWEZNQCLSA-N	0	3	330.900	3.018	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H](C)c2ccc(C)s2)C1	ZINC001099120104	1363634148	/nfs/dbraw/zinc/63/41/48/1363634148.db2.gz	ZRTHMOIGEOHKGA-GJYPPUQNSA-N	0	3	330.497	3.154	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(F)c(F)c(F)c2F)C1	ZINC001099133817	1363645319	/nfs/dbraw/zinc/64/53/19/1363645319.db2.gz	SXIJSBYFSBIXDW-BTDLBPIBSA-N	0	3	342.336	3.013	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)CCc1nc(C)cs1	ZINC001099139583	1363649149	/nfs/dbraw/zinc/64/91/49/1363649149.db2.gz	CIUNBERDGDIZNP-HNNXBMFYSA-N	0	3	335.517	3.177	20	30		EGEDHN
C#CCCN1C[C@@H]2CCC[C@]2(NC(=O)c2oc3ccccc3c2C)C1	ZINC001099149854	1363656986	/nfs/dbraw/zinc/65/69/86/1363656986.db2.gz	JNHZSEWSHWYEAT-KKSFZXQISA-N	0	3	336.435	3.349	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(Cl)cc3c2OCC3)C1	ZINC001099178768	1363675234	/nfs/dbraw/zinc/67/52/34/1363675234.db2.gz	WXCXUICPDHSNNB-LIRRHRJNSA-N	0	3	346.858	3.045	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@]1(C)C=CCC1	ZINC001099183273	1363679354	/nfs/dbraw/zinc/67/93/54/1363679354.db2.gz	TVBVLKJINHPRRJ-FXAWDEMLSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@@H]1CCC(C)(C)CN1CCn1cccn1	ZINC001099215656	1363696602	/nfs/dbraw/zinc/69/66/02/1363696602.db2.gz	YGZLGYTZGGMZSF-PXNSSMCTSA-N	0	3	346.519	3.092	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2cc(C)cc(F)c2)C[C@H]1C(F)(F)F	ZINC001099312399	1363744519	/nfs/dbraw/zinc/74/45/19/1363744519.db2.gz	UAYUCRMNKLDSFY-HUUCEWRRSA-N	0	3	344.352	3.303	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@@H](C)Cc2ccco2)C[C@H]1C(F)(F)F	ZINC001099318770	1363746863	/nfs/dbraw/zinc/74/68/63/1363746863.db2.gz	IQZHUPUDDJUFDV-NWANDNLSSA-N	0	3	344.377	3.013	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@H]2CC[C@H](CC)CC2)C[C@H]1C(F)(F)F	ZINC001099333955	1363755684	/nfs/dbraw/zinc/75/56/84/1363755684.db2.gz	DLVFPWFLVGGRKT-KBUPBQIOSA-N	0	3	332.410	3.368	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)C[C@H](C)n1nc(C)cc1C	ZINC001099338908	1363758788	/nfs/dbraw/zinc/75/87/88/1363758788.db2.gz	BWXXBQRQIMQRPN-ZWKOTPCHSA-N	0	3	346.519	3.244	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)C2CCC=CCC2)C[C@H]1C(F)(F)F	ZINC001099342832	1363761419	/nfs/dbraw/zinc/76/14/19/1363761419.db2.gz	VMAVWADYJRODAE-HUUCEWRRSA-N	0	3	330.394	3.288	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H](C)n1nc(C)cc1C	ZINC001099372202	1363777806	/nfs/dbraw/zinc/77/78/06/1363777806.db2.gz	LVDCVECYQBDUIO-MSOLQXFVSA-N	0	3	346.519	3.244	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2nccs2)C1	ZINC001099487141	1363815955	/nfs/dbraw/zinc/81/59/55/1363815955.db2.gz	BUZQNQBTDYXZIY-SNRMKQJTSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)CCC(C)(F)F	ZINC001099496180	1363820880	/nfs/dbraw/zinc/82/08/80/1363820880.db2.gz	INNIFWQQILUIGP-YJNKXOJESA-N	0	3	346.849	3.343	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1CN(CC(=C)C)CC2(CCOCC2)C1	ZINC001099588889	1363870776	/nfs/dbraw/zinc/87/07/76/1363870776.db2.gz	LKCLOSPDMXJDGO-MSOLQXFVSA-N	0	3	334.504	3.152	20	30		EGEDHN
CC(C)[C@@H](C)CC(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1	ZINC001100178499	1364036756	/nfs/dbraw/zinc/03/67/56/1364036756.db2.gz	OBSKMOYOUYNALQ-NXVRBGIVSA-N	0	3	345.462	3.364	20	30		EGEDHN
O=C(/C=C/C1CC1)NCC1CC(NCC#Cc2ccc(Cl)cc2)C1	ZINC001100217541	1364046357	/nfs/dbraw/zinc/04/63/57/1364046357.db2.gz	SXQLTNQVRGBZOX-JXMROGBWSA-N	0	3	342.870	3.142	20	30		EGEDHN
CC(C)C#CC(=O)NCC1CC(N[C@@H](C)c2ccc(F)cc2F)C1	ZINC001100305167	1364073360	/nfs/dbraw/zinc/07/33/60/1364073360.db2.gz	XOBCIOIFOXKIJU-HLIUYOAVSA-N	0	3	334.410	3.170	20	30		EGEDHN
Cc1cccc(Cl)c1CNC1CC(CNC(=O)C#CC(C)C)C1	ZINC001100310586	1364076409	/nfs/dbraw/zinc/07/64/09/1364076409.db2.gz	ZOOHTIREFWONEH-UHFFFAOYSA-N	0	3	332.875	3.292	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCC1CC(NCc2oc(CC)nc2C)C1	ZINC001100359780	1364090436	/nfs/dbraw/zinc/09/04/36/1364090436.db2.gz	LUQWUGBBODESPW-UHFFFAOYSA-N	0	3	345.487	3.298	20	30		EGEDHN
C=C(C)CCC(=O)NCC1CC(NCc2cnc(Cl)s2)C1	ZINC001100371126	1364094901	/nfs/dbraw/zinc/09/49/01/1364094901.db2.gz	RFALMUNPMGBAOF-UHFFFAOYSA-N	0	3	327.881	3.137	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCC1CC(NCc2cccc(Cl)n2)C1	ZINC001100595766	1364180877	/nfs/dbraw/zinc/18/08/77/1364180877.db2.gz	FYQYSOLJWDXPNL-HLIUYOAVSA-N	0	3	335.879	3.322	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC1CC(NCc2c(C)nsc2C)C1	ZINC001100645147	1364202877	/nfs/dbraw/zinc/20/28/77/1364202877.db2.gz	VYZKSVDHIAGEJU-JTTJXQCZSA-N	0	3	335.517	3.347	20	30		EGEDHN
C=CCC1(C(=O)NCC2CC(NCc3c(C)noc3CC)C2)CCC1	ZINC001100647487	1364203722	/nfs/dbraw/zinc/20/37/22/1364203722.db2.gz	YAKKYPJEEVFICY-UHFFFAOYSA-N	0	3	345.487	3.276	20	30		EGEDHN
CCC1(C(=O)NCC2CC(NCC#Cc3ccc(Cl)cc3)C2)CC1	ZINC001100648661	1364204463	/nfs/dbraw/zinc/20/44/63/1364204463.db2.gz	QNHCZRCBIAPBSV-UHFFFAOYSA-N	0	3	344.886	3.366	20	30		EGEDHN
CC(C)C1(C(=O)NCC2CC(NCC#Cc3ccc(F)cc3)C2)CC1	ZINC001100657815	1364207386	/nfs/dbraw/zinc/20/73/86/1364207386.db2.gz	JEAUXQRADLDFIZ-UHFFFAOYSA-N	0	3	342.458	3.098	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC2CC(NCc3ccncc3Cl)C2)C1	ZINC001100661304	1364208352	/nfs/dbraw/zinc/20/83/52/1364208352.db2.gz	MQQPPLGULGVYNA-UHFFFAOYSA-N	0	3	333.863	3.076	20	30		EGEDHN
CC1(CCC(=O)NCC2CC(NCc3cc(C#N)ccc3F)C2)CC1	ZINC001100824225	1364279338	/nfs/dbraw/zinc/27/93/38/1364279338.db2.gz	CFKLGQJIOVXNGF-UHFFFAOYSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)C[C@H](C)C(C)(C)C)C1	ZINC001100915973	1364329652	/nfs/dbraw/zinc/32/96/52/1364329652.db2.gz	OQLRNPFUTDEERZ-XGNXJENSSA-N	0	3	345.325	3.452	20	30		EGEDHN
C#CC[C@@H](CC(=O)NCC1CC(NCC(=C)Cl)C1)c1ccccc1	ZINC001101075400	1364401177	/nfs/dbraw/zinc/40/11/77/1364401177.db2.gz	FRHXEQJOZXAVFR-AVAKVYKDSA-N	0	3	344.886	3.421	20	30		EGEDHN
C=CCC1(C(=O)NCC2CC(NCc3ccccn3)C2)CCCC1	ZINC001101080409	1364403951	/nfs/dbraw/zinc/40/39/51/1364403951.db2.gz	OBGZFCXAYLHMOD-UHFFFAOYSA-N	0	3	327.472	3.203	20	30		EGEDHN
C=CCCCC(=O)NCc1cc(O[C@H]2CCN(CC(=C)C)C2)ccn1	ZINC001101095515	1364411788	/nfs/dbraw/zinc/41/17/88/1364411788.db2.gz	KCNPEPUTPYJLSV-IBGZPJMESA-N	0	3	343.471	3.083	20	30		EGEDHN
CC/C=C(/C)C(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@@]2(C)C1	ZINC001101152929	1364434419	/nfs/dbraw/zinc/43/44/19/1364434419.db2.gz	UMGANICFZWPTEM-ITICTWJCSA-N	0	3	337.467	3.195	20	30		EGEDHN
C#CCCCC(=O)N1C[C@H]2CN(Cc3cccc(Cl)c3)C[C@@]2(C)C1	ZINC001101216710	1364467951	/nfs/dbraw/zinc/46/79/51/1364467951.db2.gz	JVKBQYBYEZDCFE-XLIONFOSSA-N	0	3	344.886	3.424	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@H]2CN(Cc3cncc(C)c3)C[C@@]2(C)C1	ZINC001101251695	1364486345	/nfs/dbraw/zinc/48/63/45/1364486345.db2.gz	GJMCAOXPNFUUAC-NQIIRXRSSA-N	0	3	341.499	3.273	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@@]2(C)C1	ZINC001101253170	1364487366	/nfs/dbraw/zinc/48/73/66/1364487366.db2.gz	HXDDMXDTXKJQIT-CTNGQTDRSA-N	0	3	337.467	3.195	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@H]3CN(Cc4cccnc4)C[C@@]3(C)C2)CCC1	ZINC001101354024	1364524390	/nfs/dbraw/zinc/52/43/90/1364524390.db2.gz	LWSFHMWYRFUURQ-QUCCMNQESA-N	0	3	339.483	3.108	20	30		EGEDHN
C=CCC[C@@H](C)N1CC2(C1)C[C@@H](NC(=O)CCC(C)C)c1nccn12	ZINC001101607666	1364652921	/nfs/dbraw/zinc/65/29/21/1364652921.db2.gz	UVDDHAYIVHMOGL-IAGOWNOFSA-N	0	3	344.503	3.246	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CC2(CN(CCC(C)C)C2)n2ccnc21	ZINC001101639721	1364666481	/nfs/dbraw/zinc/66/64/81/1364666481.db2.gz	MCAMAKZVHITFAS-DLBZAZTESA-N	0	3	344.503	3.103	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1CC2(CN(CC(CC)CC)C2)n2ccnc21	ZINC001101640001	1364666769	/nfs/dbraw/zinc/66/67/69/1364666769.db2.gz	STWBZDCUTYEJOP-INIZCTEOSA-N	0	3	344.503	3.103	20	30		EGEDHN
C=CC[C@H]1NC(=O)N(C[C@H](c2cccs2)N2CCC(C)CC2)C1=O	ZINC001324607271	1387695390	/nfs/dbraw/zinc/69/53/90/1387695390.db2.gz	HAKJOAJRFTZQTO-HUUCEWRRSA-N	0	3	347.484	3.018	20	30		EGEDHN
Cc1ccc(CN2C[C@@H](CNC(=O)C#CC(C)(C)C)[C@H](C)C2)cc1F	ZINC001101955009	1364789546	/nfs/dbraw/zinc/78/95/46/1364789546.db2.gz	OAVJDOALSVSPOZ-SJLPKXTDSA-N	0	3	344.474	3.368	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC[C@@H]1CN(Cc2cccnc2)C[C@H]1C	ZINC001101997007	1364804493	/nfs/dbraw/zinc/80/44/93/1364804493.db2.gz	SVOFFGGOVRBONW-VQIMIIECSA-N	0	3	327.472	3.034	20	30		EGEDHN
C=CCCC1(C(=O)NC[C@@H]2CN(Cc3cccnc3)C[C@H]2C)CC1	ZINC001102325479	1365001560	/nfs/dbraw/zinc/00/15/60/1365001560.db2.gz	RJUZTAFLXKWNOV-SJLPKXTDSA-N	0	3	327.472	3.012	20	30		EGEDHN
CCCC1(C(=O)NC[C@@H]2CN(Cc3ccc(C#N)s3)C[C@H]2C)CC1	ZINC001102340781	1365010981	/nfs/dbraw/zinc/01/09/81/1365010981.db2.gz	NVHTXPONBWSQMM-HUUCEWRRSA-N	0	3	345.512	3.384	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@H]2CN(Cc3c(C)onc3CC)C[C@H]2C)C1	ZINC001102352743	1365017946	/nfs/dbraw/zinc/01/79/46/1365017946.db2.gz	STNZYRNNIDGCCA-GDBMZVCRSA-N	0	3	345.487	3.086	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H]2CN(Cc3cccnc3)C[C@H]2C)CCCC1	ZINC001102620560	1365139277	/nfs/dbraw/zinc/13/92/77/1365139277.db2.gz	KGGRLILXTLYTDY-IEBWSBKVSA-N	0	3	341.499	3.402	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](NCc3cn(C(C)C)nc3C)C2)CCC1	ZINC001185468879	1387723359	/nfs/dbraw/zinc/72/33/59/1387723359.db2.gz	NUVVQQKOMCUAOH-GOSISDBHSA-N	0	3	344.503	3.209	20	30		EGEDHN
C#CCCCC(=O)NCC[C@@H]1CN(Cc2nc(C)sc2C)C[C@H]1C	ZINC001102916858	1365290913	/nfs/dbraw/zinc/29/09/13/1365290913.db2.gz	AFCIJNLQHKXPTR-RHSMWYFYSA-N	0	3	347.528	3.138	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCC[C@@H]1CN(Cc2cnc(C)o2)C[C@H]1C	ZINC001103033387	1365348053	/nfs/dbraw/zinc/34/80/53/1365348053.db2.gz	JXQIPJANALCEQH-GDBMZVCRSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)COC2CCCCC2)C1	ZINC001103172972	1365420794	/nfs/dbraw/zinc/42/07/94/1365420794.db2.gz	NBYNXJWCFWCRCT-GDBMZVCRSA-N	0	3	342.911	3.162	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cc(C)c(C)cn2)C1	ZINC001103255662	1365458959	/nfs/dbraw/zinc/45/89/59/1365458959.db2.gz	MFCNIUCVISJUTQ-GDBMZVCRSA-N	0	3	335.879	3.139	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCC[C@@H]1CN(Cc2cc(C)no2)C[C@H]1C	ZINC001103344876	1365510825	/nfs/dbraw/zinc/51/08/25/1365510825.db2.gz	UKKPZEVMOMUIHU-ZMSDIMECSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)Cc2ccc(CC)cn2)C1	ZINC001103454122	1365570216	/nfs/dbraw/zinc/57/02/16/1365570216.db2.gz	IKXOHJBEDAYJLV-RHSMWYFYSA-N	0	3	349.906	3.013	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cnc(CC)s2)C1	ZINC001103771994	1365776565	/nfs/dbraw/zinc/77/65/65/1365776565.db2.gz	TUTYMSUHJRNWDW-DGCLKSJQSA-N	0	3	341.908	3.146	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CN(C(=O)/C(C)=C\CC)C[C@H]1C	ZINC001103946019	1365843024	/nfs/dbraw/zinc/84/30/24/1365843024.db2.gz	IJISIIVCAWPKTF-OLWKXOERSA-N	0	3	343.309	3.326	20	30		EGEDHN
C[C@H](C(=O)N1C[C@@H](C)[C@H](CCNCc2ccccc2C#N)C1)C1CC1	ZINC001104043268	1365886945	/nfs/dbraw/zinc/88/69/45/1365886945.db2.gz	NEQPUJWTJSYONL-GQIGUUNPSA-N	0	3	339.483	3.179	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)COC2CCCCC2)C[C@H]1C	ZINC001104374648	1365993797	/nfs/dbraw/zinc/99/37/97/1365993797.db2.gz	YZVOILIFEJUQOR-GDBMZVCRSA-N	0	3	342.911	3.162	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cncc3[nH]ccc32)C[C@H]1C	ZINC001104387452	1365998013	/nfs/dbraw/zinc/99/80/13/1365998013.db2.gz	YYJYBSVGOQAREQ-TZMCWYRMSA-N	0	3	346.862	3.003	20	30		EGEDHN
C#Cc1ccc(C(=O)N2C[C@@H](C)[C@H](CCNCC(=C)Cl)C2)cc1	ZINC001104476364	1366042849	/nfs/dbraw/zinc/04/28/49/1366042849.db2.gz	RVBSOIHRVVTJEC-RDTXWAMCSA-N	0	3	330.859	3.108	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@@H](C)[C@H](CCNCc2ccn(CC)n2)C1	ZINC001104564411	1366078648	/nfs/dbraw/zinc/07/86/48/1366078648.db2.gz	LCGKPMUKQDDQRK-KZNAEPCWSA-N	0	3	346.519	3.080	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC(C)(F)F)C[C@H]1CCNCc1ccccc1C#N	ZINC001104641278	1366115449	/nfs/dbraw/zinc/11/54/49/1366115449.db2.gz	JBDNVFWXAFWXMF-RHSMWYFYSA-N	0	3	349.425	3.178	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H](C)[C@H](CCNCc2ccn(CC)n2)C1	ZINC001104731459	1366149236	/nfs/dbraw/zinc/14/92/36/1366149236.db2.gz	JOCBZQWKLPRYGF-IAGOWNOFSA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)COCCCCCC)C[C@H]1C	ZINC001104951883	1366239682	/nfs/dbraw/zinc/23/96/82/1366239682.db2.gz	RXBYEMZCHNATBV-NVXWUHKLSA-N	0	3	344.927	3.410	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C2(CCC)CC2)CC1	ZINC001105396511	1366445248	/nfs/dbraw/zinc/44/52/48/1366445248.db2.gz	NTSKEPOCYKCTIX-SFHVURJKSA-N	0	3	328.500	3.293	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H](CNCc2cscn2)[C@H](C)C1	ZINC001106173788	1366615889	/nfs/dbraw/zinc/61/58/89/1366615889.db2.gz	GWTWNDLTJKNCSI-GDBMZVCRSA-N	0	3	333.501	3.096	20	30		EGEDHN
C[C@@H](CC(F)F)C(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001106444144	1366697143	/nfs/dbraw/zinc/69/71/43/1366697143.db2.gz	SOEPOFQGICRIFQ-JJRVBVJISA-N	0	3	349.425	3.034	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](N(C)CCOc2ccccc2Cl)C1	ZINC001189319333	1366988285	/nfs/dbraw/zinc/98/82/85/1366988285.db2.gz	XGQWIFVZOBIYHG-OAHLLOKOSA-N	0	3	336.863	3.218	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@]12CCC[C@H]1N(Cc1cnc(C)o1)CC2	ZINC001107496962	1366995675	/nfs/dbraw/zinc/99/56/75/1366995675.db2.gz	OLHQKLOHACDIPE-YLJYHZDGSA-N	0	3	345.487	3.446	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@]23CCC[C@H]2N(Cc2cncs2)CC3)C1	ZINC001107543466	1367035744	/nfs/dbraw/zinc/03/57/44/1367035744.db2.gz	JAUYURARZCMLFD-VQIMIIECSA-N	0	3	345.512	3.360	20	30		EGEDHN
C=CCOCCCC(=O)N1CC[C@H](N(C)C/C=C/c2ccccc2)C1	ZINC001189564636	1367055785	/nfs/dbraw/zinc/05/57/85/1367055785.db2.gz	FOPKGLSSFIKFFC-OEMHODTASA-N	0	3	342.483	3.215	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2cc(C)cs2)C1	ZINC001107921971	1367203276	/nfs/dbraw/zinc/20/32/76/1367203276.db2.gz	JMOPDDPXZKWFRU-QAPCUYQASA-N	0	3	336.501	3.232	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)[C@H](C)CCc3cccc(F)c3)[C@@H]2C1	ZINC001190281860	1367216924	/nfs/dbraw/zinc/21/69/24/1367216924.db2.gz	MAZIBUKGSIOPJS-HHXXYDBFSA-N	0	3	330.447	3.113	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2cccc(C)c2F)C1	ZINC001107961122	1367218736	/nfs/dbraw/zinc/21/87/36/1367218736.db2.gz	SOCIYVRDUWCQLJ-JXFKEZNVSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2[nH]ccc2C2CC2)C1	ZINC001107990146	1367232190	/nfs/dbraw/zinc/23/21/90/1367232190.db2.gz	AWFDFKBTXYGNLW-YWZLYKJASA-N	0	3	345.487	3.068	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C1(CCOCC)CCCC1)C2	ZINC001109888758	1367384593	/nfs/dbraw/zinc/38/45/93/1367384593.db2.gz	VZZKQMREJAQNEE-SQNIBIBYSA-N	0	3	334.504	3.271	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)[C@H]2CC[C@H](C)CC2)C1	ZINC001108353913	1367406481	/nfs/dbraw/zinc/40/64/81/1367406481.db2.gz	RWBNQJMLFMSIPL-MLYOOKFZSA-N	0	3	336.520	3.375	20	30		EGEDHN
CCCCCCCNC(=O)N1C[C@H]2CN(Cc3ccccn3)C[C@H]2C1	ZINC001191091813	1367422198	/nfs/dbraw/zinc/42/21/98/1367422198.db2.gz	VCULJDQLQSKICN-HDICACEKSA-N	0	3	344.503	3.125	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)CCc2ccc(C)o2)C1	ZINC001108417430	1367444706	/nfs/dbraw/zinc/44/47/06/1367444706.db2.gz	AQGKFVHTBJYLAF-OXQOHEQNSA-N	0	3	348.487	3.082	20	30		EGEDHN
C=CCCCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc(CC)on1)C2	ZINC001109998402	1367452066	/nfs/dbraw/zinc/45/20/66/1367452066.db2.gz	WZRODXPDCUSOCB-HFTRVMKXSA-N	0	3	331.460	3.319	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](CC)c1ccc(OC)cc1)C2	ZINC001110137051	1367519883	/nfs/dbraw/zinc/51/98/83/1367519883.db2.gz	YTJQCQIVURILAJ-LMCOJAPRSA-N	0	3	342.483	3.486	20	30		EGEDHN
C#CCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3CCCOCC)CCCCC1	ZINC001110177730	1367546932	/nfs/dbraw/zinc/54/69/32/1367546932.db2.gz	FJYLGWMACAEOAE-QYZOEREBSA-N	0	3	346.515	3.108	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CN([C@@H](C)c2cccc3ccccc32)C[C@H]1O	ZINC001191651882	1367554229	/nfs/dbraw/zinc/55/42/29/1367554229.db2.gz	LMMFTVNOERWZQQ-CWFSZBLJSA-N	0	3	338.451	3.028	20	30		EGEDHN
C=CCCCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1c(C)noc1C)C2	ZINC001110272309	1367602344	/nfs/dbraw/zinc/60/23/44/1367602344.db2.gz	SUHSJLZVNOEUMQ-ZACQAIPSSA-N	0	3	331.460	3.373	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](N(C)CCc2c(F)cccc2F)C1	ZINC001191858869	1367615184	/nfs/dbraw/zinc/61/51/84/1367615184.db2.gz	CYKZCZZSIBFQEA-INIZCTEOSA-N	0	3	348.437	3.234	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H](N(C)CCc2csc(C)n2)C1	ZINC001191868102	1367621001	/nfs/dbraw/zinc/62/10/01/1367621001.db2.gz	NZOVHPJYZQFNEF-WMLDXEAASA-N	0	3	335.517	3.129	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@H](N(C)Cc2ccccc2N(C)C)C1	ZINC001191913308	1367636390	/nfs/dbraw/zinc/63/63/90/1367636390.db2.gz	WPNBGLCFQGBIMF-HKUYNNGSSA-N	0	3	343.515	3.388	20	30		EGEDHN
Cc1ccccc1[C@H](C)N1[C@@H]2CC[C@H]1[C@@H](NC(=O)CSCC#N)C2	ZINC001108947044	1367675805	/nfs/dbraw/zinc/67/58/05/1367675805.db2.gz	AZAPPSMVCDFOEA-MVJTYMMSSA-N	0	3	343.496	3.034	20	30		EGEDHN
C[C@@H](C#N)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCc1ccc2ccccc2c1	ZINC001110402139	1367692405	/nfs/dbraw/zinc/69/24/05/1367692405.db2.gz	YGIPADHRGBDDRS-NOOVBMIQSA-N	0	3	347.462	3.263	20	30		EGEDHN
C#CCN(C)CCCNC(=O)/C=C/c1cc(Cl)cc(Cl)c1	ZINC001325062432	1387893631	/nfs/dbraw/zinc/89/36/31/1387893631.db2.gz	CIPIYNOLVDNLOA-AATRIKPKSA-N	0	3	325.239	3.078	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](N(C)Cc2ccc(COC)cc2)C1	ZINC001192585910	1367825123	/nfs/dbraw/zinc/82/51/23/1367825123.db2.gz	DRSOYKZYQSSBQD-LJQANCHMSA-N	0	3	344.499	3.468	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@@H](C)Cc1cccc(F)c1)C2	ZINC001110564770	1367836076	/nfs/dbraw/zinc/83/60/76/1367836076.db2.gz	SCLHAIJRGJNKKH-OBZTUIKSSA-N	0	3	342.458	3.139	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)C[C@@H](C)c2ccccc2C)C1	ZINC001192640684	1367839190	/nfs/dbraw/zinc/83/91/90/1367839190.db2.gz	FEUCNWSRSJHQEJ-MOPGFXCFSA-N	0	3	344.499	3.224	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCCCCF	ZINC001110666559	1367905612	/nfs/dbraw/zinc/90/56/12/1367905612.db2.gz	QGLKCPZLJQPLMJ-ZACQAIPSSA-N	0	3	333.451	3.149	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2cccc(C(C)C)c2)C1	ZINC001193244204	1367978400	/nfs/dbraw/zinc/97/84/00/1367978400.db2.gz	NXHYGGXFHXJREJ-IBGZPJMESA-N	0	3	330.472	3.159	20	30		EGEDHN
C=CCC[C@H](C)N1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ncc(Cl)s1)C2	ZINC001110803496	1368001262	/nfs/dbraw/zinc/00/12/62/1368001262.db2.gz	YRQRPUWSLXFOCA-LOWDOPEQSA-N	0	3	339.892	3.486	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](CC)Cc1cccc(C)c1)C2	ZINC001111109119	1368160694	/nfs/dbraw/zinc/16/06/94/1368160694.db2.gz	HJGLFLZCMZHZRV-BQJUDKOJSA-N	0	3	338.495	3.309	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2cc3cc(C)ccc3o2)C1	ZINC001194247300	1368217320	/nfs/dbraw/zinc/21/73/20/1368217320.db2.gz	WCEFCQRYOVUWKE-QGZVFWFLSA-N	0	3	342.439	3.090	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](CC)Cc1ccccc1C)C2	ZINC001111279169	1368246981	/nfs/dbraw/zinc/24/69/81/1368246981.db2.gz	URTIKCCIWFWQKX-KCLUMXDGSA-N	0	3	338.495	3.309	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc3nc(C)ccc3o1)C2	ZINC001111303218	1368260857	/nfs/dbraw/zinc/26/08/57/1368260857.db2.gz	ZVLPLTBPIZZGGM-INMHGKMJSA-N	0	3	339.439	3.438	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)C2(CC(C)C)CCC2)C1	ZINC001194583787	1368291459	/nfs/dbraw/zinc/29/14/59/1368291459.db2.gz	FOGCHBZSINTMLB-QZTJIDSGSA-N	0	3	338.536	3.335	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCCOc1ccccc1F)C2	ZINC001111448348	1368309533	/nfs/dbraw/zinc/30/95/33/1368309533.db2.gz	GCJKMAILDCBQTP-NXHRZFHOSA-N	0	3	346.446	3.282	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H](CC)CCCC)C[C@H](C)O2	ZINC001111535887	1368334502	/nfs/dbraw/zinc/33/45/02/1368334502.db2.gz	SSCFFLVKGRSYRU-ZWKOTPCHSA-N	0	3	336.520	3.471	20	30		EGEDHN
CCCCCCCCCOC(=O)NCCN1CCN(C(C)C)CC1	ZINC001194919439	1368347437	/nfs/dbraw/zinc/34/74/37/1368347437.db2.gz	DHCGZIUMMNUALU-UHFFFAOYSA-N	0	3	341.540	3.489	20	30		EGEDHN
CCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(C#N)cc1)C2	ZINC001111596870	1368361532	/nfs/dbraw/zinc/36/15/32/1368361532.db2.gz	BFKHPGYFPDAIGL-ICSRJNTNSA-N	0	3	325.456	3.219	20	30		EGEDHN
C=CCCC(=O)N1CCCN(CCCc2ccccc2OC)CC1	ZINC001195225465	1368404116	/nfs/dbraw/zinc/40/41/16/1368404116.db2.gz	DISHZDHLZSEUIJ-UHFFFAOYSA-N	0	3	330.472	3.128	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCC[C@]2(NC(=O)c2sc(C)cc2C)C1	ZINC001111760009	1368447420	/nfs/dbraw/zinc/44/74/20/1368447420.db2.gz	UFSFENOXCONOSR-LPHOPBHVSA-N	0	3	348.512	3.152	20	30		EGEDHN
C=C(C)CCC(=O)N[C@]12CCC[C@H]1CN(Cc1scnc1C)C2	ZINC001111763861	1368450680	/nfs/dbraw/zinc/45/06/80/1368450680.db2.gz	MHPNXGPVLYDKAP-YJBOKZPZSA-N	0	3	333.501	3.279	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cnc(C3CC3)o2)CC1	ZINC001196185132	1368564657	/nfs/dbraw/zinc/56/46/57/1368564657.db2.gz	OAMXIDUVJHZNSE-UHFFFAOYSA-N	0	3	331.460	3.446	20	30		EGEDHN
C#CCN1C[C@@H]2CCC[C@]2(NC(=O)CC[C@H]2CCc3ccccc32)C1	ZINC001112001083	1368604847	/nfs/dbraw/zinc/60/48/47/1368604847.db2.gz	GRONARNVQKVKNI-DXIQSLLYSA-N	0	3	336.479	3.101	20	30		EGEDHN
CC1(C)C[C@@]1(NC[C@@H](O)COc1ccccc1C#N)c1ccccc1	ZINC001196460470	1368619975	/nfs/dbraw/zinc/61/99/75/1368619975.db2.gz	ZMESSLMTIWRIFR-WIYYLYMNSA-N	0	3	336.435	3.213	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N1CCCN(CC2=CCCCC2)CC1	ZINC001196665393	1368658444	/nfs/dbraw/zinc/65/84/44/1368658444.db2.gz	BZDXTRGUZQLBHB-FQEVSTJZSA-N	0	3	334.504	3.250	20	30		EGEDHN
C=CC1(CC(=O)N[C@@H]2CN(CCCCCC)C[C@H]2O)CCCCC1	ZINC001196859930	1368701522	/nfs/dbraw/zinc/70/15/22/1368701522.db2.gz	CFCDHOZILOLFMS-QZTJIDSGSA-N	0	3	336.520	3.255	20	30		EGEDHN
C=CCC1(C(=O)N2CCCN(CC3CC(F)(F)C3)CC2)CCC1	ZINC001197076211	1368741191	/nfs/dbraw/zinc/74/11/91/1368741191.db2.gz	DBGDKXZIZRWMGV-UHFFFAOYSA-N	0	3	326.431	3.312	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cc(C3CC3)n[nH]2)CC1	ZINC001197245488	1368770905	/nfs/dbraw/zinc/77/09/05/1368770905.db2.gz	XMQISSBFORLLID-UHFFFAOYSA-N	0	3	332.492	3.405	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@H]2CC[C@H](CC)CC2)C1	ZINC001197961193	1368933299	/nfs/dbraw/zinc/93/32/99/1368933299.db2.gz	VCZOGTUYDLGKHJ-NCXUSEDFSA-N	0	3	338.536	3.335	20	30		EGEDHN
C=C(C)CN1CCCN(C(=O)CCCOc2cccc(C)c2)CC1	ZINC001198021824	1368943900	/nfs/dbraw/zinc/94/39/00/1368943900.db2.gz	JBAWAIXEOQFTFG-UHFFFAOYSA-N	0	3	330.472	3.264	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)c2ccc(C(C)C)cc2)C1	ZINC001198075017	1368954877	/nfs/dbraw/zinc/95/48/77/1368954877.db2.gz	BIWZXEYIIPBROP-WOJBJXKFSA-N	0	3	344.499	3.331	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2cc(C3CCCC3)no2)CC1	ZINC001198167112	1368971821	/nfs/dbraw/zinc/97/18/21/1368971821.db2.gz	VNCPXYNNSFUTPZ-UHFFFAOYSA-N	0	3	331.460	3.446	20	30		EGEDHN
C=CCCCCCN1CCN(C(=O)C[C@H](C)n2ccnc2CC)CC1	ZINC001112865038	1369056286	/nfs/dbraw/zinc/05/62/86/1369056286.db2.gz	PTBCLPIFSFBCLM-SFHVURJKSA-N	0	3	346.519	3.287	20	30		EGEDHN
C=CCCCCCN[C@H](CNC(=O)[C@H](C)OC)c1ccccc1OC	ZINC001198577751	1369064411	/nfs/dbraw/zinc/06/44/11/1369064411.db2.gz	LQPZYUDZYTYMDV-FUHWJXTLSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCC[C@H](C)N[C@@H](CNC(=O)c1cocn1)c1ccccc1OC	ZINC001198605057	1369070749	/nfs/dbraw/zinc/07/07/49/1369070749.db2.gz	DMTLSLGKXZFFMS-HOCLYGCPSA-N	0	3	343.427	3.099	20	30		EGEDHN
C=CCOCCCC(=O)NC[C@@H](NCC(C)C)c1ccccc1OC	ZINC001198638456	1369080103	/nfs/dbraw/zinc/08/01/03/1369080103.db2.gz	XEWFQNMHPJDYIN-GOSISDBHSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)Cc1ccc(C)o1)c1ccccc1OC	ZINC001198669065	1369087198	/nfs/dbraw/zinc/08/71/98/1369087198.db2.gz	XFENRSKQSWOIDK-SFHVURJKSA-N	0	3	342.439	3.162	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)CC[C@@H](C)OC)c1ccccc1OC	ZINC001198676790	1369088537	/nfs/dbraw/zinc/08/85/37/1369088537.db2.gz	CYYSBEUEGYTVOO-SJLPKXTDSA-N	0	3	348.487	3.223	20	30		EGEDHN
C#CCCCC(=O)NC[C@H](NCCCCCF)c1ccccc1OC	ZINC001198694855	1369092434	/nfs/dbraw/zinc/09/24/34/1369092434.db2.gz	LXGNZRAQTXDUCZ-SFHVURJKSA-N	0	3	348.462	3.385	20	30		EGEDHN
COc1ccccc1[C@H](CNC(=O)C#CC(C)C)NCCC(C)C	ZINC001198713087	1369097252	/nfs/dbraw/zinc/09/72/52/1369097252.db2.gz	LZAJKAJKVKMDQE-SFHVURJKSA-N	0	3	330.472	3.148	20	30		EGEDHN
C=CCC[C@@H](C)N[C@@H](CNC(=O)C#CC(C)C)c1ccccc1OC	ZINC001198714332	1369098148	/nfs/dbraw/zinc/09/81/48/1369098148.db2.gz	XIFLTEYGDPWPHH-MJGOQNOKSA-N	0	3	342.483	3.456	20	30		EGEDHN
C#CCC1(C(=O)NC[C@@H](NCCCC)c2ccccc2OC)CCC1	ZINC001198753114	1369106042	/nfs/dbraw/zinc/10/60/42/1369106042.db2.gz	YCAPBPBGABRWEX-GOSISDBHSA-N	0	3	342.483	3.436	20	30		EGEDHN
C#CCC1(C(=O)NC[C@H](NCCCC)c2ccccc2OC)CCC1	ZINC001198753115	1369106474	/nfs/dbraw/zinc/10/64/74/1369106474.db2.gz	YCAPBPBGABRWEX-SFHVURJKSA-N	0	3	342.483	3.436	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@H](NCCC1CC1)c1ccccc1OC	ZINC001198835599	1369126549	/nfs/dbraw/zinc/12/65/49/1369126549.db2.gz	UNTWWBCLFSPALE-KRWDZBQOSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)[C@H](F)C(C)C)c1ccccc1OC	ZINC001198842267	1369127278	/nfs/dbraw/zinc/12/72/78/1369127278.db2.gz	FXGOVEDWAWGCSC-SJLPKXTDSA-N	0	3	336.451	3.402	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)C[C@@H](C)c2c(C)noc2C)CC1	ZINC001113030083	1369150757	/nfs/dbraw/zinc/15/07/57/1369150757.db2.gz	JQMHEAZYLFXJMS-HUUCEWRRSA-N	0	3	333.476	3.284	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@@H]1CC12CCC2)c1ccccc1OC	ZINC001198925848	1369150929	/nfs/dbraw/zinc/15/09/29/1369150929.db2.gz	YQIYSYNTTQSZNZ-DLBZAZTESA-N	0	3	328.456	3.208	20	30		EGEDHN
C=CCCC(=O)N1CCC(NCc2coc(-c3cccs3)n2)CC1	ZINC001199706616	1369257884	/nfs/dbraw/zinc/25/78/84/1369257884.db2.gz	MVOSRQMRFCRZAH-UHFFFAOYSA-N	0	3	345.468	3.450	20	30		EGEDHN
C=CCCC(=O)N1CCC(NCc2nsc3ccccc32)CC1	ZINC001199726367	1369262350	/nfs/dbraw/zinc/26/23/50/1369262350.db2.gz	YGJXOMIHOQBZHO-UHFFFAOYSA-N	0	3	329.469	3.343	20	30		EGEDHN
C#CCCCCC(=O)N1CCC(NCc2cc(O)ccc2Cl)CC1	ZINC001200155217	1369321633	/nfs/dbraw/zinc/32/16/33/1369321633.db2.gz	BMGLOLNTPOFRHR-UHFFFAOYSA-N	0	3	348.874	3.320	20	30		EGEDHN
C=C(Br)CNC1CCN(C(=O)[C@@H](C)CCCC)CC1	ZINC001200380882	1369357276	/nfs/dbraw/zinc/35/72/76/1369357276.db2.gz	BKTZPGGFDMQKCK-LBPRGKRZSA-N	0	3	331.298	3.302	20	30		EGEDHN
Cc1cc(C#N)cc(Cl)c1NC(=S)NCCN1CCCCC1	ZINC001200430692	1369365209	/nfs/dbraw/zinc/36/52/09/1369365209.db2.gz	XAFRFBGKCLAVJK-UHFFFAOYSA-N	0	3	336.892	3.292	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC(NCc2nc3ccccc3o2)CC1	ZINC001200816404	1369433535	/nfs/dbraw/zinc/43/35/35/1369433535.db2.gz	VWJYZZXGNJFZGA-UHFFFAOYSA-N	0	3	327.428	3.265	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCCO[C@@H](CNCc2ccccc2F)C1	ZINC001201233393	1369501377	/nfs/dbraw/zinc/50/13/77/1369501377.db2.gz	PABRKXZBYWXBHQ-WMZOPIPTSA-N	0	3	348.462	3.135	20	30		EGEDHN
CCCCCCCN1CCN(C(=O)CN(C)Cc2ccccc2)CC1	ZINC001113725814	1369587638	/nfs/dbraw/zinc/58/76/38/1369587638.db2.gz	HCIRSQJLCLFKGQ-UHFFFAOYSA-N	0	3	345.531	3.233	20	30		EGEDHN
CCCCCCCCCCS(=O)(=O)N1CC[C@@]2(CCN(C)C2)C1	ZINC001201836781	1369631763	/nfs/dbraw/zinc/63/17/63/1369631763.db2.gz	PPPDWSIJKJROQD-GOSISDBHSA-N	0	3	344.565	3.485	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC(NCc2ccn(C(C)C)n2)CC1	ZINC001202138772	1369698922	/nfs/dbraw/zinc/69/89/22/1369698922.db2.gz	PPCQNRLILHQHCX-MRXNPFEDSA-N	0	3	332.492	3.147	20	30		EGEDHN
CCC(=O)N[C@@H]1C[C@@H](NCC#Cc2ccc(Cl)cc2)C12CCC2	ZINC001202259477	1369724155	/nfs/dbraw/zinc/72/41/55/1369724155.db2.gz	NMKOISVIQPQCOL-IAGOWNOFSA-N	0	3	330.859	3.119	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(F)cc3C)C[C@H]21	ZINC001114325576	1369885805	/nfs/dbraw/zinc/88/58/05/1369885805.db2.gz	BOZDLSWVNMFWTH-PMOLBWCYSA-N	0	3	342.458	3.449	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1C[C@H](NCc2cc(F)ccc2F)C12CCC2	ZINC001202847298	1369907004	/nfs/dbraw/zinc/90/70/04/1369907004.db2.gz	RVHQOKXCHJZLRO-ROUUACIJSA-N	0	3	346.421	3.285	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1C[C@H](NCc2ccccn2)C12CCC2	ZINC001202952288	1369934662	/nfs/dbraw/zinc/93/46/62/1369934662.db2.gz	VMQQSHGYDBGOJR-RBUKOAKNSA-N	0	3	339.483	3.367	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1C[C@@H](NCC(=C)Br)C12CCC2	ZINC001202977668	1369943704	/nfs/dbraw/zinc/94/37/04/1369943704.db2.gz	FJJDNAZIQNVVFU-ZIAGYGMSSA-N	0	3	341.293	3.268	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1C[C@@H](NCc2ccc(F)cn2)C12CCC2	ZINC001203255693	1370043092	/nfs/dbraw/zinc/04/30/92/1370043092.db2.gz	DNDAOAXKDUKQBH-SJORKVTESA-N	0	3	345.462	3.340	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1C[C@@H](NCc2conc2C)C12CCC2	ZINC001203258973	1370045645	/nfs/dbraw/zinc/04/56/45/1370045645.db2.gz	UFIKLYJPCVYRFU-CVEARBPZSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1C[C@@H](NCc2conc2C)C12CCC2	ZINC001203258976	1370046175	/nfs/dbraw/zinc/04/61/75/1370046175.db2.gz	UFIKLYJPCVYRFU-HZPDHXFCSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1[C@H]2CN(CCOc3ccccc3C)C[C@H]21	ZINC001114728185	1370050253	/nfs/dbraw/zinc/05/02/53/1370050253.db2.gz	CIVBVNXPAOXACF-WIRSXHRWSA-N	0	3	342.483	3.023	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1C[C@H](NCc2nc(C)c(C)s2)C12CCC2	ZINC001203274484	1370054838	/nfs/dbraw/zinc/05/48/38/1370054838.db2.gz	NWQDONFIGSAJGH-LSDHHAIUSA-N	0	3	347.528	3.489	20	30		EGEDHN
Cc1coc(C(=O)N[C@@H]2C[C@@H](NCC#Cc3ccccc3)C23CCC3)c1	ZINC001203282248	1370061153	/nfs/dbraw/zinc/06/11/53/1370061153.db2.gz	WMIXVNZDDPHRTN-WOJBJXKFSA-N	0	3	348.446	3.270	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1C[C@H](NCc2cnc(C)o2)C12CCC2	ZINC001203295505	1370067375	/nfs/dbraw/zinc/06/73/75/1370067375.db2.gz	LKZHYTTTXUVYGX-ZWKOTPCHSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2[C@H]3CN(Cc4cc(F)ccc4C)C[C@H]32)CC1	ZINC001114794806	1370085024	/nfs/dbraw/zinc/08/50/24/1370085024.db2.gz	QHKRSXDESXPHAF-BWTSREIZSA-N	0	3	342.458	3.427	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2C[C@H](NCc3cnc(C)o3)C23CCC3)CCC1	ZINC001203368111	1370102041	/nfs/dbraw/zinc/10/20/41/1370102041.db2.gz	YQKQLQWAPXURTH-DLBZAZTESA-N	0	3	343.471	3.246	20	30		EGEDHN
COc1ccc(C[N@@H+]2CCC[C@H](Oc3ccccc3C#N)C2)c([O-])c1	ZINC001203629322	1370192748	/nfs/dbraw/zinc/19/27/48/1370192748.db2.gz	WCAKRMZMFQIFQG-SFHVURJKSA-N	0	3	338.407	3.316	20	30		EGEDHN
COc1ccc(C[N@H+]2CCC[C@H](Oc3ccccc3C#N)C2)c([O-])c1	ZINC001203629322	1370192751	/nfs/dbraw/zinc/19/27/51/1370192751.db2.gz	WCAKRMZMFQIFQG-SFHVURJKSA-N	0	3	338.407	3.316	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)CCc2ccccc2)C12CCC2	ZINC001203650558	1370201590	/nfs/dbraw/zinc/20/15/90/1370201590.db2.gz	IIPGGXLKDBAJRL-DLBZAZTESA-N	0	3	332.875	3.389	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@@H]1CCN(Cc1ccc(OC)c(F)c1)C2	ZINC001203793106	1370267772	/nfs/dbraw/zinc/26/77/72/1370267772.db2.gz	PTILCZAGXGNVGN-UXHICEINSA-N	0	3	349.446	3.408	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@]3(C[C@H](Oc4cccnc4)CO3)C2)cc1	ZINC001203901761	1370306985	/nfs/dbraw/zinc/30/69/85/1370306985.db2.gz	RGDMIZCRXNPFBX-LEWJYISDSA-N	0	3	349.434	3.156	20	30		EGEDHN
C[C@@H]1C[C@@H]1C(=O)NCC1(NCC#Cc2ccc(F)cc2)CCCCC1	ZINC001115388835	1370425512	/nfs/dbraw/zinc/42/55/12/1370425512.db2.gz	BVBIMCRZGCEBRT-APWZRJJASA-N	0	3	342.458	3.242	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1ccccc1C#N)[C@@H]2CC	ZINC001204367354	1370455504	/nfs/dbraw/zinc/45/55/04/1370455504.db2.gz	IDOBKMNQRBZGHM-CTNGQTDRSA-N	0	3	337.467	3.480	20	30		EGEDHN
C[C@H](C#N)C(=O)NCC1(NCc2ccc(F)cc2F)CCCCC1	ZINC001115451619	1370458981	/nfs/dbraw/zinc/45/89/81/1370458981.db2.gz	AJELCZVNQRZSJZ-CYBMUJFWSA-N	0	3	335.398	3.033	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)CC2CCC2)CCCCC1	ZINC001115465056	1370469782	/nfs/dbraw/zinc/46/97/82/1370469782.db2.gz	VBANFSWWRXMMIQ-UHFFFAOYSA-N	0	3	343.309	3.494	20	30		EGEDHN
C#CCCCCC(=O)NCC1(NCc2cncs2)CCCCC1	ZINC001115490775	1370494539	/nfs/dbraw/zinc/49/45/39/1370494539.db2.gz	QBADWIMSWXFNHJ-UHFFFAOYSA-N	0	3	333.501	3.245	20	30		EGEDHN
C#CCCCC(=O)NCC1(NCC#Cc2ccccc2)CCCCC1	ZINC001115507208	1370507424	/nfs/dbraw/zinc/50/74/24/1370507424.db2.gz	HLUWVYBSMLILTJ-UHFFFAOYSA-N	0	3	336.479	3.250	20	30		EGEDHN
CC(C)C#CC(=O)NCC1(NCc2cccc(Cl)n2)CCCCC1	ZINC001115522424	1370521648	/nfs/dbraw/zinc/52/16/48/1370521648.db2.gz	QIRAVOYEFSZGPB-UHFFFAOYSA-N	0	3	347.890	3.303	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cc(C)nc(C)c2)CCCCC1	ZINC001115555663	1370553566	/nfs/dbraw/zinc/55/35/66/1370553566.db2.gz	NUYSQBVJKXXDHW-UHFFFAOYSA-N	0	3	335.879	3.473	20	30		EGEDHN
C=C(C)CCC(=O)NCC1(NCc2n[nH]c(C(C)C)n2)CCCCC1	ZINC001115556862	1370554983	/nfs/dbraw/zinc/55/49/83/1370554983.db2.gz	GIFFDNXLQVPCTK-UHFFFAOYSA-N	0	3	347.507	3.193	20	30		EGEDHN
C=C(C)CCC(=O)NCC1(NCc2cnc(C)cn2)CCCCC1	ZINC001115556781	1370555179	/nfs/dbraw/zinc/55/51/79/1370555179.db2.gz	BHBFVZHMJSMEGJ-UHFFFAOYSA-N	0	3	330.476	3.050	20	30		EGEDHN
Cc1csc(Nc2ccc(CN3CCN(C)CC3)cc2)c1C#N	ZINC001204725093	1370555974	/nfs/dbraw/zinc/55/59/74/1370555974.db2.gz	RHGIXPXUTZUWPO-UHFFFAOYSA-N	0	3	326.469	3.419	20	30		EGEDHN
C=CCCC(=O)N1CCC(CNCc2csc(CCC)n2)CC1	ZINC001204748353	1370564642	/nfs/dbraw/zinc/56/46/42/1370564642.db2.gz	LNOJMWIDPHEQPM-UHFFFAOYSA-N	0	3	335.517	3.390	20	30		EGEDHN
CNc1ccc(C#N)cc1Nc1ccc(CN2CCN(C)CC2)cc1	ZINC001204758878	1370568528	/nfs/dbraw/zinc/56/85/28/1370568528.db2.gz	NJNSBAYQSSIPHQ-UHFFFAOYSA-N	0	3	335.455	3.091	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@]23CCC[C@H]2OCC3)CCCCC1	ZINC001115626239	1370619681	/nfs/dbraw/zinc/61/96/81/1370619681.db2.gz	NWBOLSCIYYJJBC-QAPCUYQASA-N	0	3	340.895	3.107	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCC1(NCc2nccnc2C)CCCCC1	ZINC001115685151	1370668489	/nfs/dbraw/zinc/66/84/89/1370668489.db2.gz	VZPZHRZTCHSEPG-KRWDZBQOSA-N	0	3	344.503	3.296	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)C[C@H]2C[C@@H]2C)CCCCC1	ZINC001115710285	1370689145	/nfs/dbraw/zinc/68/91/45/1370689145.db2.gz	HLHBXJBMGLVMBP-GXTWGEPZSA-N	0	3	343.309	3.350	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC1(NCc2conc2C)CCCCC1	ZINC001115712464	1370691633	/nfs/dbraw/zinc/69/16/33/1370691633.db2.gz	MUJWMLYLYRODLB-SFHVURJKSA-N	0	3	333.476	3.494	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cnc(C3CC3)nc2)CCCCC1	ZINC001115762699	1370746762	/nfs/dbraw/zinc/74/67/62/1370746762.db2.gz	BJIMBJFMGVMOIV-UHFFFAOYSA-N	0	3	348.878	3.129	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H](C)CC(C)C)C[C@H]1c1cccc(F)c1	ZINC001205448166	1370759273	/nfs/dbraw/zinc/75/92/73/1370759273.db2.gz	BFTZDEQLYVBPPD-ZYSHUDEJSA-N	0	3	330.447	3.025	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cc(CCC)on2)CCCCC1	ZINC001115801888	1370784888	/nfs/dbraw/zinc/78/48/88/1370784888.db2.gz	CPTFXCWZEPJADV-UHFFFAOYSA-N	0	3	339.867	3.402	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)N1CCC(CNCc2nc(C)cs2)CC1	ZINC001205956086	1370923032	/nfs/dbraw/zinc/92/30/32/1370923032.db2.gz	ZUCAMZNQGZESED-DZGCQCFKSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)N1CCC(CNCc2csc(C)n2)CC1	ZINC001205961505	1370924039	/nfs/dbraw/zinc/92/40/39/1370924039.db2.gz	YRSJSSQJJWYJDJ-KGLIPLIRSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=CCN1C(=O)CCC[C@@]12CCCN(Cc1sc(C)nc1C)C2	ZINC001206151018	1370973809	/nfs/dbraw/zinc/97/38/09/1370973809.db2.gz	INBBBCQJJOPLPA-SFHVURJKSA-N	0	3	333.501	3.293	20	30		EGEDHN
Cc1ccccc1CN1CCCN(c2c(C#N)cccc2C#N)CC1	ZINC001116797645	1370976884	/nfs/dbraw/zinc/97/68/84/1370976884.db2.gz	HUKUPJLVVDWVOR-UHFFFAOYSA-N	0	3	330.435	3.451	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1ccncc1OC)[C@H]2CC	ZINC001206457438	1371060606	/nfs/dbraw/zinc/06/06/06/1371060606.db2.gz	ASIPGIFPYHJQEL-ICSRJNTNSA-N	0	3	343.471	3.012	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N[C@@H]1CN(Cc2ccc(C)c(C)c2)C[C@H]1C	ZINC001206485925	1371068991	/nfs/dbraw/zinc/06/89/91/1371068991.db2.gz	PBZVZFBYRQTFMP-QWFCFKBJSA-N	0	3	344.499	3.221	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2csc(C#N)c2)C1	ZINC001117780752	1371082462	/nfs/dbraw/zinc/08/24/62/1371082462.db2.gz	YUPUSJUFTYJIQR-XJKSGUPXSA-N	0	3	325.437	3.185	20	30		EGEDHN
C=CCOCC(=O)N[C@@H]1CN(Cc2ccc(C3CCC3)cc2)C[C@H]1C	ZINC001206613821	1371109372	/nfs/dbraw/zinc/10/93/72/1371109372.db2.gz	FIJULLTXRZABSV-OXQOHEQNSA-N	0	3	342.483	3.093	20	30		EGEDHN
C=C[C@H](COC)NC[C@@](C)(O)c1ccc(Br)cc1Cl	ZINC001326157146	1388120688	/nfs/dbraw/zinc/12/06/88/1388120688.db2.gz	VPSJWGBNJRSGMX-BXUZGUMPSA-N	0	3	348.668	3.101	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CN([C@@H]2CCc3ccc(F)cc32)C[C@H]1C	ZINC001206886652	1371207704	/nfs/dbraw/zinc/20/77/04/1371207704.db2.gz	BIBNFYUFQPCEJB-CDHQVMDDSA-N	0	3	342.458	3.443	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CN([C@@H](C)c2cccc(OC)c2)C[C@H]1C	ZINC001206886940	1371208008	/nfs/dbraw/zinc/20/80/08/1371208008.db2.gz	OIZPVRZMOIUVJZ-FUHIMQAGSA-N	0	3	342.483	3.386	20	30		EGEDHN
C[C@H]1[C@@H](CNC(=O)OC(C)(C)C)CCCN1Cc1cc(C#N)n(C)c1	ZINC001207103051	1371294397	/nfs/dbraw/zinc/29/43/97/1371294397.db2.gz	KTJXQXAFISAMTI-GOEBONIOSA-N	0	3	346.475	3.022	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CCCN(Cc3c(C)noc3C)C2)CC1	ZINC001207133032	1371304881	/nfs/dbraw/zinc/30/48/81/1371304881.db2.gz	FFCLGAVNEDJLEE-UHFFFAOYSA-N	0	3	347.459	3.292	20	30		EGEDHN
C=CCN(CCN1CCC(COCC)CC1)C(=O)OC(C)(C)C	ZINC001207203474	1371328530	/nfs/dbraw/zinc/32/85/30/1371328530.db2.gz	DYSGMTDBIFQYSN-UHFFFAOYSA-N	0	3	326.481	3.158	20	30		EGEDHN
C=CCN(CCN1CCc2cccc(O)c2C1)C(=O)OC(C)(C)C	ZINC001207204037	1371328566	/nfs/dbraw/zinc/32/85/66/1371328566.db2.gz	ZNCMQTVXEOAWCA-UHFFFAOYSA-N	0	3	332.444	3.173	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN(Cc2cccc3c2CCOC3)C[C@H]1C	ZINC001207215408	1371332048	/nfs/dbraw/zinc/33/20/48/1371332048.db2.gz	IOIIEYZVPVMPQS-OXQOHEQNSA-N	0	3	342.483	3.052	20	30		EGEDHN
CCCCC(=O)N1CCC[C@@H](NCC#Cc2ccccc2Cl)C1	ZINC001207372136	1371378018	/nfs/dbraw/zinc/37/80/18/1371378018.db2.gz	BFUCTEKAFWIOEX-QGZVFWFLSA-N	0	3	332.875	3.462	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2CN(Cc3cccc(CC)c3)C[C@H]2C)CCC1	ZINC001207510221	1371420348	/nfs/dbraw/zinc/42/03/48/1371420348.db2.gz	MKHZTXNIJPETAA-YLJYHZDGSA-N	0	3	338.495	3.379	20	30		EGEDHN
CC/C=C(/C)C(=O)N1CCC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001207565110	1371436451	/nfs/dbraw/zinc/43/64/51/1371436451.db2.gz	GIDYCUPUGYZWDL-OTMHGDBASA-N	0	3	329.419	3.134	20	30		EGEDHN
CC(C)[C@@H](C)CC(=O)N1CCC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001207644772	1371462347	/nfs/dbraw/zinc/46/23/47/1371462347.db2.gz	HKHUJPFPMNXACM-YJBOKZPZSA-N	0	3	345.462	3.460	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC[C@@H](NCC#Cc2ccccc2Cl)C1	ZINC001207764421	1371497567	/nfs/dbraw/zinc/49/75/67/1371497567.db2.gz	OUKDDPARBCHOJO-RBNJDYBGSA-N	0	3	330.859	3.238	20	30		EGEDHN
CCC(=CC(=O)N1CCC[C@H](NCc2ccc(C#N)s2)C1)CC	ZINC001207785736	1371502912	/nfs/dbraw/zinc/50/29/12/1371502912.db2.gz	IAONRVZAQRDTDA-HNNXBMFYSA-N	0	3	331.485	3.447	20	30		EGEDHN
Cc1cccc(Cl)c1CN[C@H]1CCCN(C(=O)C#CC(C)C)C1	ZINC001208005787	1371565674	/nfs/dbraw/zinc/56/56/74/1371565674.db2.gz	OCOWKRFRLHGCMO-INIZCTEOSA-N	0	3	332.875	3.388	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN(Cc2cccc3cccnc32)C[C@H]1C	ZINC001208309488	1371709731	/nfs/dbraw/zinc/70/97/31/1371709731.db2.gz	NOCWVQKOZBVOBW-CRAIPNDOSA-N	0	3	337.467	3.384	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CN([C@H]2CCc3c2cccc3F)C[C@H]1C	ZINC001208374560	1371741272	/nfs/dbraw/zinc/74/12/72/1371741272.db2.gz	MSADJPDOYUPBOR-YSGRDPCXSA-N	0	3	342.458	3.443	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1)C(C)(C)C	ZINC001208423308	1371762589	/nfs/dbraw/zinc/76/25/89/1371762589.db2.gz	HFBZREAETLBWGU-APWZRJJASA-N	0	3	344.474	3.440	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CCc3scnc3C)C[C@H]2C)CCC1	ZINC001208517848	1371797549	/nfs/dbraw/zinc/79/75/49/1371797549.db2.gz	YUQXSDSLXNXXLL-GDBMZVCRSA-N	0	3	347.528	3.177	20	30		EGEDHN
C[C@H]1CN(CCc2ccc(C#N)cc2)CCCN1C(=O)OC(C)(C)C	ZINC001208929312	1371948280	/nfs/dbraw/zinc/94/82/80/1371948280.db2.gz	OYXIPSAJKSCYFW-INIZCTEOSA-N	0	3	343.471	3.432	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC[C@H](NCc2ccnc(Cl)c2)C1	ZINC001209002841	1371972123	/nfs/dbraw/zinc/97/21/23/1371972123.db2.gz	CZISRASWGDBDMQ-KRWDZBQOSA-N	0	3	347.890	3.399	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N1CCC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001209051425	1371983897	/nfs/dbraw/zinc/98/38/97/1371983897.db2.gz	JCDZTAROGDIDEG-PRWGNSRSSA-N	0	3	341.430	3.300	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N1CCC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001209054139	1371984569	/nfs/dbraw/zinc/98/45/69/1371984569.db2.gz	YGVWWGBRVDUSER-HUJBZGQLSA-N	0	3	341.430	3.300	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@@H](NCc2ccc(F)c(F)c2)C1	ZINC001209111926	1372000927	/nfs/dbraw/zinc/00/09/27/1372000927.db2.gz	RAZTXZQNMCSUIT-MRXNPFEDSA-N	0	3	334.410	3.239	20	30		EGEDHN
O=C(CCCC1CC1)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001209144962	1372012896	/nfs/dbraw/zinc/01/28/96/1372012896.db2.gz	BBKNWXXNKVWUKM-HXUWFJFHSA-N	0	3	342.458	3.338	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)C[C@@H](C)c2ccccc2C)C1	ZINC001209157013	1372018150	/nfs/dbraw/zinc/01/81/50/1372018150.db2.gz	GXOHSSDTZSYVPA-QWFCFKBJSA-N	0	3	344.499	3.128	20	30		EGEDHN
C#CCCN1C[C@@H](C)[C@H](NC(=O)[C@@H](CC)Cc2cccc(C)c2)C1	ZINC001209226230	1372044772	/nfs/dbraw/zinc/04/47/72/1372044772.db2.gz	SDFJILIGAZTWCP-YZGWKJHDSA-N	0	3	326.484	3.024	20	30		EGEDHN
CCc1ccccc1C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001209295424	1372060802	/nfs/dbraw/zinc/06/08/02/1372060802.db2.gz	UQFLZEAPFIKXTM-NRFANRHFSA-N	0	3	346.474	3.495	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N1CCC(C(=O)c2ccc(C)cc2C)CC1	ZINC001121843981	1372099824	/nfs/dbraw/zinc/09/98/24/1372099824.db2.gz	ARZSHZNLIRALNE-IBGZPJMESA-N	0	3	342.483	3.408	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N[C@H](CC)c1nc(-c2ccccc2)c[nH]1	ZINC001121856818	1372104694	/nfs/dbraw/zinc/10/46/94/1372104694.db2.gz	CENOJYHWGMBAJE-JKSUJKDBSA-N	0	3	326.444	3.328	20	30		EGEDHN
C=CCCCCCCN1CC[C@]2(CC(C(=O)N(C)C(C)C)=NO2)C1	ZINC001209436234	1372105434	/nfs/dbraw/zinc/10/54/34/1372105434.db2.gz	SHTAHNIFPAIIJS-IBGZPJMESA-N	0	3	335.492	3.211	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@H](NCC#Cc3ccccc3Cl)C2)CC1	ZINC001209473661	1372115744	/nfs/dbraw/zinc/11/57/44/1372115744.db2.gz	BHBXQYVELODFJM-KRWDZBQOSA-N	0	3	344.886	3.462	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC[C@@H](NCc3cncc(C)c3)C2)CC1	ZINC001209493031	1372120043	/nfs/dbraw/zinc/12/00/43/1372120043.db2.gz	IDENXRZUBFAGMM-GOSISDBHSA-N	0	3	327.472	3.217	20	30		EGEDHN
C=CCOC(=O)N[C@H]1CCCN(Cc2c[nH]c3ccc(C)cc23)C1	ZINC001209500811	1372121471	/nfs/dbraw/zinc/12/14/71/1372121471.db2.gz	WNSOIPOFGBVGCF-INIZCTEOSA-N	0	3	327.428	3.353	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H](NCC#Cc3ccc(F)cc3)C2)C1	ZINC001209542919	1372133118	/nfs/dbraw/zinc/13/31/18/1372133118.db2.gz	FLZDPOKLZNJZMI-LJQANCHMSA-N	0	3	340.442	3.114	20	30		EGEDHN
O=C(N1CCC[C@H](NCC#Cc2ccccc2Cl)C1)C1(CF)CC1	ZINC001209579041	1372141990	/nfs/dbraw/zinc/14/19/90/1372141990.db2.gz	QJOIZVLPCZXWHB-INIZCTEOSA-N	0	3	348.849	3.022	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1ccnc(OC)c1)[C@@H]2CC	ZINC001209639503	1372158611	/nfs/dbraw/zinc/15/86/11/1372158611.db2.gz	QVTSAXLHOOWPIJ-XLIONFOSSA-N	0	3	343.471	3.012	20	30		EGEDHN
Cn1cc(CN2CCC[C@@H](Oc3ccccc3C#N)C2)c2cccnc21	ZINC001209750109	1372183567	/nfs/dbraw/zinc/18/35/67/1372183567.db2.gz	LVGJRDVYXQJKSI-GOSISDBHSA-N	0	3	346.434	3.488	20	30		EGEDHN
CC[C@@H](C)CCC(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001210263540	1372308771	/nfs/dbraw/zinc/30/87/71/1372308771.db2.gz	DNNCNFYXKUZHQB-UYAOXDASSA-N	0	3	326.484	3.445	20	30		EGEDHN
CCC(CC)CC(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001210358423	1372331853	/nfs/dbraw/zinc/33/18/53/1372331853.db2.gz	KTCYQWPBHSVXJB-HXUWFJFHSA-N	0	3	326.484	3.445	20	30		EGEDHN
F[C@@H]1CNCCN(Cc2cc(C(F)(F)F)ccc2C(F)(F)F)C1	ZINC001210580483	1372384540	/nfs/dbraw/zinc/38/45/40/1372384540.db2.gz	JJDGFDOAYHRCAJ-LLVKDONJSA-N	0	3	344.274	3.468	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1)C1CCCC1	ZINC001210584983	1372384969	/nfs/dbraw/zinc/38/49/69/1372384969.db2.gz	NUBAMFRGTWMEIX-GHTZIAJQSA-N	0	3	338.495	3.445	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)Cc1ccc(Br)cc1C	ZINC001123337179	1372431556	/nfs/dbraw/zinc/43/15/56/1372431556.db2.gz	OHINCEQEENURKG-AWEZNQCLSA-N	0	3	346.228	3.393	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)C[C@H](C)c2ccc(OC)cc2)C1	ZINC001211218535	1372505386	/nfs/dbraw/zinc/50/53/86/1372505386.db2.gz	YHQRTDRCPHMEGL-FRQCXROJSA-N	0	3	330.472	3.201	20	30		EGEDHN
N#Cc1cc(C(=O)NC[C@H]2CCCN2Cc2ccccc2)cs1	ZINC001326473570	1388206115	/nfs/dbraw/zinc/20/61/15/1388206115.db2.gz	UYCXRXVZSPICHS-MRXNPFEDSA-N	0	3	325.437	3.014	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1CN(Cc2ccc(C(C)C)cc2)C[C@H]1C	ZINC001211420344	1372555357	/nfs/dbraw/zinc/55/53/57/1372555357.db2.gz	DUYCPPLBQPRNKS-YLJYHZDGSA-N	0	3	344.499	3.339	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C2(C(C)(F)F)CC2)C[C@H]1c1ccccc1	ZINC001211674746	1372601357	/nfs/dbraw/zinc/60/13/57/1372601357.db2.gz	IJEAPSUIAPJEAV-DLBZAZTESA-N	0	3	346.421	3.029	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H](CC)CC(C)C)C[C@H]1c1ccccc1	ZINC001211705341	1372606124	/nfs/dbraw/zinc/60/61/24/1372606124.db2.gz	FUWOTZGSKWRTCE-YZGWKJHDSA-N	0	3	326.484	3.276	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C(C)(CC)CC)C[C@H]1c1ccccc1	ZINC001211724260	1372607912	/nfs/dbraw/zinc/60/79/12/1372607912.db2.gz	XYPICUCAYDVTBO-RBUKOAKNSA-N	0	3	326.484	3.420	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)C2C(C)(C)C2(C)C)[C@H](OC)C1	ZINC001212079026	1372654220	/nfs/dbraw/zinc/65/42/20/1372654220.db2.gz	WREGUTBFOFYWLP-HZPDHXFCSA-N	0	3	338.536	3.454	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CN([C@H](C)c2ccccc2C)C[C@H]1OC	ZINC001212146161	1372664271	/nfs/dbraw/zinc/66/42/71/1372664271.db2.gz	KGHPOMKWIJWVME-MISYRCLQSA-N	0	3	342.483	3.065	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1CN(CCCC2CCC2)C[C@H]1OC	ZINC001212321010	1372685731	/nfs/dbraw/zinc/68/57/31/1372685731.db2.gz	NKDOGSFBPQFJLS-RTBURBONSA-N	0	3	334.504	3.151	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)C[C@H]2C=CCCC2)[C@H](OC)C1	ZINC001212451141	1372709170	/nfs/dbraw/zinc/70/91/70/1372709170.db2.gz	PCXLCDZGMHJQNW-IPMKNSEASA-N	0	3	334.504	3.295	20	30		EGEDHN
CCCCCCCCS(=O)(=O)NC1CCN(C2CCC2)CC1	ZINC001188029464	1388221859	/nfs/dbraw/zinc/22/18/59/1388221859.db2.gz	RNPZXTRZNHDPEH-UHFFFAOYSA-N	0	3	330.538	3.283	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)C[C@H]2CC=CCC2)[C@H](OC)C1	ZINC001213266801	1372871016	/nfs/dbraw/zinc/87/10/16/1372871016.db2.gz	KLEYMQUNSNETKN-IPMKNSEASA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H](NC(=O)c2occc2C(C)C)[C@H](OC)C1	ZINC001213324144	1372884057	/nfs/dbraw/zinc/88/40/57/1372884057.db2.gz	RJBZJRAQYIEXAD-USXIJHARSA-N	0	3	334.460	3.187	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1CN(CCCC2CCCC2)C[C@H]1OC	ZINC001213390221	1372898519	/nfs/dbraw/zinc/89/85/19/1372898519.db2.gz	UOQICBPIVACDFY-QWFCFKBJSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)[C@@H](F)CC2CCCCC2)[C@H](OC)C1	ZINC001213728672	1372952664	/nfs/dbraw/zinc/95/26/64/1372952664.db2.gz	PJEATGCDEHNTCX-RCCFBDPRSA-N	0	3	340.483	3.077	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)CCc2ccccc2)[C@H](OC)C1	ZINC001213774914	1372960374	/nfs/dbraw/zinc/96/03/74/1372960374.db2.gz	QDICYLXGUPTSAM-WOJBJXKFSA-N	0	3	344.499	3.181	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)[C@@H](CCC)c2ccccc2)[C@H](OC)C1	ZINC001213819316	1372966488	/nfs/dbraw/zinc/96/64/88/1372966488.db2.gz	QPQXTPZBWZTYCN-XUVXKRRUSA-N	0	3	344.499	3.352	20	30		EGEDHN
C=CC[C@H](C(=O)N[C@@H]1CN(CCC(=C)C)C[C@H]1OC)c1ccccc1	ZINC001213896099	1372976538	/nfs/dbraw/zinc/97/65/38/1372976538.db2.gz	USLOOPQTMWGVFL-XUVXKRRUSA-N	0	3	342.483	3.128	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2CN(CC/C=C\CC)C[C@H]2OC)CCCCC1	ZINC001213957483	1372986633	/nfs/dbraw/zinc/98/66/33/1372986633.db2.gz	GFXJIIUHZPYPGA-PWBPZBFBSA-N	0	3	346.515	3.132	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CCCC2)C[C@H]1NCC#Cc1cccc(Cl)c1	ZINC001214026298	1372995531	/nfs/dbraw/zinc/99/55/31/1372995531.db2.gz	RGHVGCWVVZPMOT-DNVCBOLYSA-N	0	3	344.886	3.318	20	30		EGEDHN
C[C@@H]1CN(C(=O)C=C2CCC2)C[C@H]1NCC#Cc1ccccc1Cl	ZINC001214426566	1373058984	/nfs/dbraw/zinc/05/89/84/1373058984.db2.gz	DKIGRMMRYUYKRL-DNVCBOLYSA-N	0	3	342.870	3.238	20	30		EGEDHN
CC(C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(F)cc2)C1)=C1CCC1	ZINC001214582228	1373084999	/nfs/dbraw/zinc/08/49/99/1373084999.db2.gz	KTXOBBMIFJNLJY-FOIQADDNSA-N	0	3	340.442	3.114	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H](C)[C@H](NCc2ccc(Cl)nc2)C1	ZINC001214703695	1373105155	/nfs/dbraw/zinc/10/51/55/1373105155.db2.gz	VSGIRRMCALDOJK-RHSMWYFYSA-N	0	3	347.890	3.440	20	30		EGEDHN
C[C@H](C#N)c1cccc(-c2nc(-c3ccc4c(n3)CCNC4)no2)c1	ZINC001215353295	1373201830	/nfs/dbraw/zinc/20/18/30/1373201830.db2.gz	MWLCIIOYLNRKSG-GFCCVEGCSA-N	0	3	331.379	3.071	20	30		EGEDHN
CC1=C(C)C[C@H](C(=O)NCCNCc2ccc(F)c(C#N)c2)CC1	ZINC001128031220	1373210448	/nfs/dbraw/zinc/21/04/48/1373210448.db2.gz	RSWMCVYKRLJIBJ-MRXNPFEDSA-N	0	3	329.419	3.040	20	30		EGEDHN
CCC1(C(=O)N2C[C@@H](C)[C@H](NCC#Cc3ccccc3)C2)CCCC1	ZINC001216139698	1373270201	/nfs/dbraw/zinc/27/02/01/1373270201.db2.gz	CGRVJSJNMFNZCU-UYAOXDASSA-N	0	3	338.495	3.445	20	30		EGEDHN
C[C@H](C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2)C1)C1CCCC1	ZINC001216319608	1373299354	/nfs/dbraw/zinc/29/93/54/1373299354.db2.gz	DEFYDPKIAZOCGN-LVCYWYKZSA-N	0	3	338.495	3.301	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)CCC(C)C)[C@@H](n2ccnn2)C1	ZINC001128688671	1373302875	/nfs/dbraw/zinc/30/28/75/1373302875.db2.gz	ULCKAQMTJJQPQD-MSOLQXFVSA-N	0	3	349.523	3.026	20	30		EGEDHN
C#CCC1(C(=O)NCCNCc2cc(Cl)cc(Cl)c2)CCC1	ZINC001129125023	1373348988	/nfs/dbraw/zinc/34/89/88/1373348988.db2.gz	JNKGCKHSSBQZKP-UHFFFAOYSA-N	0	3	339.266	3.393	20	30		EGEDHN
CC(C)Cc1ccc(C(=O)NCCNCc2ccc(C#N)cc2)s1	ZINC001129625144	1373404398	/nfs/dbraw/zinc/40/43/98/1373404398.db2.gz	WMHFABSUWKHICZ-UHFFFAOYSA-N	0	3	341.480	3.338	20	30		EGEDHN
N#Cc1ccc(-c2noc(-c3noc4c3CNCC4)n2)c2ccccc12	ZINC001217213032	1373407913	/nfs/dbraw/zinc/40/79/13/1373407913.db2.gz	KEGYHPBXYFTBSN-UHFFFAOYSA-N	0	3	343.346	3.062	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)C[C@@H]3C=CCC3)[C@H]2C1	ZINC001217249346	1373411080	/nfs/dbraw/zinc/41/10/80/1373411080.db2.gz	UYUMCKMIFAQQDX-CEXWTWQISA-N	0	3	332.488	3.001	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2cccc3c2CCCCC3)c1	ZINC001129997762	1373443982	/nfs/dbraw/zinc/44/39/82/1373443982.db2.gz	AMOQBTBGJCTVJA-UHFFFAOYSA-N	0	3	347.462	3.347	20	30		EGEDHN
C=C(C)CN1CC[C@H](Oc2cnccc2CNC(=O)CCCCC)C1	ZINC001130313063	1373489615	/nfs/dbraw/zinc/48/96/15/1373489615.db2.gz	KHKWKIIGFTWVOW-SFHVURJKSA-N	0	3	345.487	3.307	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)CCCC(C)(C)C)C1	ZINC001130368583	1373506574	/nfs/dbraw/zinc/50/65/74/1373506574.db2.gz	OWLHOUFNFBKJFX-HNNXBMFYSA-N	0	3	332.492	3.218	20	30		EGEDHN
C=CCOc1ccc(C(=O)NCCNCc2ccc(C)c(F)c2)cc1	ZINC001130371443	1373508447	/nfs/dbraw/zinc/50/84/47/1373508447.db2.gz	SZHDINUPZUZQEV-UHFFFAOYSA-N	0	3	342.414	3.219	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)C[C@H](CC)C(C)C)C1	ZINC001130443197	1373543346	/nfs/dbraw/zinc/54/33/46/1373543346.db2.gz	RJOZEZBRNIWYKJ-HOTGVXAUSA-N	0	3	332.492	3.074	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)CCC[C@H](C)CCC)C[C@H]1c1cn(C)cn1	ZINC001130603034	1373568723	/nfs/dbraw/zinc/56/87/23/1373568723.db2.gz	VYFZVNGOPMQPPV-ZIFCJYIRSA-N	0	3	346.519	3.097	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)C3CCCCCCC3)[C@H]2C1	ZINC001218282329	1373587754	/nfs/dbraw/zinc/58/77/54/1373587754.db2.gz	QYDHTBLIPBJKBH-RBUKOAKNSA-N	0	3	334.504	3.225	20	30		EGEDHN
COc1cc([O-])cc(O[C@@H]2C[NH2+][C@@H]2C)c1C(=O)/C=C/c1ccccc1	ZINC001218385926	1373604513	/nfs/dbraw/zinc/60/45/13/1373604513.db2.gz	MLNUDYWXZZYUBW-QUEUSCEUSA-N	0	3	339.391	3.036	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc(Cl)cc2F)cc1F	ZINC001131010794	1373624191	/nfs/dbraw/zinc/62/41/91/1373624191.db2.gz	CRIHJJYIFVKTIN-UHFFFAOYSA-N	0	3	349.768	3.009	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)[C@H](C)CC(=C)C)[C@H]2C1	ZINC001218523928	1373630300	/nfs/dbraw/zinc/63/03/00/1373630300.db2.gz	RCJQNYQPSCSSLK-CEXWTWQISA-N	0	3	334.504	3.247	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2OCCN(C(=O)c3ccccc3Cl)[C@H]2C1	ZINC001219004184	1373677429	/nfs/dbraw/zinc/67/74/29/1373677429.db2.gz	AIKTYHAQLYIVTJ-JCGIZDLHSA-N	0	3	348.874	3.220	20	30		EGEDHN
N#Cc1ccc(-c2ccccc2NC(=O)[C@@H](N)C2CCC(O)CC2)cc1	ZINC001219270240	1373697948	/nfs/dbraw/zinc/69/79/48/1373697948.db2.gz	ARNRDCMJYUIWCG-UHYCVJNDSA-N	0	3	349.434	3.042	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@H]2CCC(C)=C(C)C2)[C@@H](O)C1	ZINC001219684150	1373725917	/nfs/dbraw/zinc/72/59/17/1373725917.db2.gz	JVKHBOAKGIPOKM-OTWHNJEPSA-N	0	3	336.520	3.255	20	30		EGEDHN
CCCCCCCCCCC(=O)N1C[C@H]2CCN(C[C@@H](C)O)C[C@H]21	ZINC001221973784	1373810837	/nfs/dbraw/zinc/81/08/37/1373810837.db2.gz	MWRHVYHSMOUOOW-GUDVDZBRSA-N	0	3	338.536	3.431	20	30		EGEDHN
C#CC[C@H](CC(=O)N1CC[C@@H](NC/C=C/Cl)C1)c1ccccc1	ZINC001188438622	1388309061	/nfs/dbraw/zinc/30/90/61/1388309061.db2.gz	QDFURKZMIAIIOJ-OEQDPHDDSA-N	0	3	330.859	3.127	20	30		EGEDHN
C#CC[C@H](CC(=O)N1CC[C@@H](NC/C=C\Cl)C1)c1ccccc1	ZINC001188438619	1388309273	/nfs/dbraw/zinc/30/92/73/1388309273.db2.gz	QDFURKZMIAIIOJ-FNYRBRLGSA-N	0	3	330.859	3.127	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCC1CCN(Cc2ncccc2C)CC1	ZINC001224187411	1375060691	/nfs/dbraw/zinc/06/06/91/1375060691.db2.gz	PKZYKJUKQBBCFN-QGZVFWFLSA-N	0	3	329.488	3.321	20	30		EGEDHN
O=C(N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1Cl)C1CC1	ZINC001224394598	1375066334	/nfs/dbraw/zinc/06/63/34/1375066334.db2.gz	HFDBPGRUNJCIIW-QZTJIDSGSA-N	0	3	330.859	3.119	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)C[C@H](C)c2ccccc2C)CC1	ZINC001224746047	1375074131	/nfs/dbraw/zinc/07/41/31/1375074131.db2.gz	MDPRGPNZVQOWFR-SFHVURJKSA-N	0	3	326.484	3.340	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H]1CC[C@H](C)N(CCCOc2ccccc2)C1	ZINC001132025378	1375104205	/nfs/dbraw/zinc/10/42/05/1375104205.db2.gz	PFCBEQQRPNVKRF-OALUTQOASA-N	0	3	342.483	3.084	20	30		EGEDHN
CC1CC(C(=O)N[C@@H]2CCCC[C@H]2NCC#Cc2ccc(F)cc2)C1	ZINC001225586602	1375127518	/nfs/dbraw/zinc/12/75/18/1375127518.db2.gz	WMVVNOXCWOKMQJ-LYBGUNNDSA-N	0	3	342.458	3.240	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1CC[C@H](C)N(CCc2scnc2C)C1	ZINC001132071423	1375132859	/nfs/dbraw/zinc/13/28/59/1375132859.db2.gz	ANUOHMDPFJGHJV-HOCLYGCPSA-N	0	3	335.517	3.319	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2nc3cccnc3s2)CC[C@@H]1C	ZINC001132110844	1375152867	/nfs/dbraw/zinc/15/28/67/1375152867.db2.gz	MFVUAZXASQSSDI-KBPBESRZSA-N	0	3	344.484	3.240	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CCCC[C@H]1N[C@@H](C)c1cnc(C)cn1	ZINC001225771573	1375153749	/nfs/dbraw/zinc/15/37/49/1375153749.db2.gz	PMAKNESZHLYNBO-RCCFBDPRSA-N	0	3	342.487	3.057	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)COc2ccc(C(C)C)cc2)CC[C@@H]1C	ZINC001132160016	1375178041	/nfs/dbraw/zinc/17/80/41/1375178041.db2.gz	HSGKLCRUQAKRGS-HKUYNNGSSA-N	0	3	342.483	3.181	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2ccccc2CCC)CC[C@@H]1C	ZINC001132165464	1375181964	/nfs/dbraw/zinc/18/19/64/1375181964.db2.gz	VMDSGGQGBYDIIY-HKUYNNGSSA-N	0	3	344.499	3.424	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@@H](C)OCc3ccc(C)cc3)[C@@H]2C1	ZINC001188697926	1388362281	/nfs/dbraw/zinc/36/22/81/1388362281.db2.gz	IKAQGRFUXFNUIJ-YZGWKJHDSA-N	0	3	342.483	3.009	20	30		EGEDHN
C=CCCCCCN1C[C@H](NC(=O)c2cc(OCC)no2)CC[C@H]1C	ZINC001132174400	1375188907	/nfs/dbraw/zinc/18/89/07/1375188907.db2.gz	UWBRVTNSUCJPQG-HZPDHXFCSA-N	0	3	349.475	3.402	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2nc3c(s2)CCC3)CC[C@@H]1C	ZINC001132187007	1375195610	/nfs/dbraw/zinc/19/56/10/1375195610.db2.gz	GYPKHRDEMSSKNN-KBPBESRZSA-N	0	3	333.501	3.181	20	30		EGEDHN
O=C(C#CC1CC1)N[C@@H]1CCCC[C@H]1NCc1ccc(F)cc1Cl	ZINC001226112192	1375205165	/nfs/dbraw/zinc/20/51/65/1375205165.db2.gz	XQTPAFJIECPOSR-QZTJIDSGSA-N	0	3	348.849	3.410	20	30		EGEDHN
Cc1cc(CN[C@@H]2CCCC[C@H]2NC(=O)C#CC(C)(C)C)sn1	ZINC001226143944	1375210365	/nfs/dbraw/zinc/21/03/65/1375210365.db2.gz	VNUFHOWGQMAIMH-HZPDHXFCSA-N	0	3	333.501	3.018	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCCOc2ccccc2C)CC[C@@H]1C	ZINC001132212448	1375212889	/nfs/dbraw/zinc/21/28/89/1375212889.db2.gz	YOCZFDUIBOEFCS-ROUUACIJSA-N	0	3	330.472	3.309	20	30		EGEDHN
CCC(CC)C(=O)NC1CCN(Cc2ccc(OCC#N)cc2)CC1	ZINC001226169611	1375213677	/nfs/dbraw/zinc/21/36/77/1375213677.db2.gz	LKQVJQLTFYKKDY-UHFFFAOYSA-N	0	3	343.471	3.106	20	30		EGEDHN
Cc1nc(O[C@H]2CCN(C(C)C)C2)c(C#N)c(C)c1Br	ZINC001226203841	1375220092	/nfs/dbraw/zinc/22/00/92/1375220092.db2.gz	KAJIZHIQTJMCKP-LBPRGKRZSA-N	0	3	338.249	3.194	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCNCc2cc(Cl)cc(Cl)c2)cc1	ZINC001132223487	1375220610	/nfs/dbraw/zinc/22/06/10/1375220610.db2.gz	XNEXJPXMMHTJTP-UHFFFAOYSA-N	0	3	347.245	3.494	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2CC[C@H](C)N(CCOCC3CC3)C2)CCC1	ZINC001132281816	1375264119	/nfs/dbraw/zinc/26/41/19/1375264119.db2.gz	FUCPBBBRYAWLRE-WMZOPIPTSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CC[C@@H](C)N(CCOCC(C)C)C2)CC1	ZINC001132292940	1375274159	/nfs/dbraw/zinc/27/41/59/1375274159.db2.gz	WODAJPXKLJXIOJ-IEBWSBKVSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)CCc2ccccc2C)CC[C@@H]1C	ZINC001132326380	1375305087	/nfs/dbraw/zinc/30/50/87/1375305087.db2.gz	DLRXSAAENGVPFD-ICSRJNTNSA-N	0	3	344.499	3.099	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CC[C@H](C)N(CCn2nc(C)cc2C)C1	ZINC001132332534	1375313107	/nfs/dbraw/zinc/31/31/07/1375313107.db2.gz	VJNQRAIILDPHDN-FUHWJXTLSA-N	0	3	346.519	3.071	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc(CCCCC)n[nH]2)CC[C@@H]1C	ZINC001132348728	1375325447	/nfs/dbraw/zinc/32/54/47/1375325447.db2.gz	RESHSLKYQHVOAS-RDJZCZTQSA-N	0	3	332.492	3.301	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCn2ccc3ccccc32)CC[C@@H]1C	ZINC001132469960	1375412387	/nfs/dbraw/zinc/41/23/87/1375412387.db2.gz	ZGHUMKDGPCBZEO-WMZOPIPTSA-N	0	3	325.456	3.187	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCOc2cc(C)ccc2C)CC[C@H]1C	ZINC001132472463	1375413387	/nfs/dbraw/zinc/41/33/87/1375413387.db2.gz	HIVOBQPKCYPPAQ-MSOLQXFVSA-N	0	3	330.472	3.227	20	30		EGEDHN
CC(C)C#CC(=O)NC1CCN([C@H]2CCc3ccc(F)cc32)CC1	ZINC001227265015	1375414011	/nfs/dbraw/zinc/41/40/11/1375414011.db2.gz	BWZRPZPWIFSFJV-IBGZPJMESA-N	0	3	328.431	3.053	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCc2ccc(Cl)s2)CC[C@H]1C	ZINC001132482849	1375418526	/nfs/dbraw/zinc/41/85/26/1375418526.db2.gz	ZTUGXPSBVVOATM-CHWSQXEVSA-N	0	3	326.893	3.489	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2cc(C)c(F)c(C)c2)CC[C@H]1C	ZINC001132490670	1375422847	/nfs/dbraw/zinc/42/28/47/1375422847.db2.gz	XBWGRXGROZTHTR-AEFFLSMTSA-N	0	3	348.462	3.228	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCCOc2ccccc2F)CC[C@H]1C	ZINC001132504477	1375429118	/nfs/dbraw/zinc/42/91/18/1375429118.db2.gz	JKCXVLCEMLJYCG-HZPDHXFCSA-N	0	3	334.435	3.140	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CN(CC)c2ccccc2)CC[C@@H]1C	ZINC001132509550	1375432729	/nfs/dbraw/zinc/43/27/29/1375432729.db2.gz	WRLSXGCBYCUCKQ-ZWKOTPCHSA-N	0	3	329.488	3.058	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1CC[C@H](C)N(Cc2cccc(C)c2)C1	ZINC001132529820	1375443610	/nfs/dbraw/zinc/44/36/10/1375443610.db2.gz	RPIGDHPPMRUDLE-PKOBYXMFSA-N	0	3	330.472	3.057	20	30		EGEDHN
C#CCC1(C(=O)N[C@H]2CC[C@@H](C)N(CCOC(C)C)C2)CCCCC1	ZINC001132530373	1375444858	/nfs/dbraw/zinc/44/48/58/1375444858.db2.gz	XLVOUFSJTQHJPJ-MOPGFXCFSA-N	0	3	348.531	3.354	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CC(F)(F)C(F)(F)F)CC[C@H]1C	ZINC001132541122	1375448489	/nfs/dbraw/zinc/44/84/89/1375448489.db2.gz	ADPBVSXSHBDQCY-MNOVXSKESA-N	0	3	328.325	3.119	20	30		EGEDHN
C=C(C)CCC(=O)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC001227607633	1375452935	/nfs/dbraw/zinc/45/29/35/1375452935.db2.gz	WUKRMUCOVCOURB-UHFFFAOYSA-N	0	3	334.435	3.141	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)/C(C)=C\C)CC1	ZINC001132554056	1375459603	/nfs/dbraw/zinc/45/96/03/1375459603.db2.gz	BTFOSQNOEKKNLU-ZYCWUHPBSA-N	0	3	339.483	3.254	20	30		EGEDHN
CC#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)/C(C)=C/C)CC1	ZINC001132554055	1375459829	/nfs/dbraw/zinc/45/98/29/1375459829.db2.gz	BTFOSQNOEKKNLU-PUQBOAQESA-N	0	3	339.483	3.254	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2N(Cc2ccsc2)C(=O)C(C)(C)F)CC1	ZINC001132563516	1375469592	/nfs/dbraw/zinc/46/95/92/1375469592.db2.gz	SFPBQKKZHARIBB-MRXNPFEDSA-N	0	3	348.487	3.313	20	30		EGEDHN
C#CCN1CC[C@H](CN(Cc2scnc2C)C(=O)C(C)(C)CC)C1	ZINC001132562958	1375469619	/nfs/dbraw/zinc/46/96/19/1375469619.db2.gz	NSQSVRVEXISKRW-INIZCTEOSA-N	0	3	347.528	3.171	20	30		EGEDHN
C#CCC1(C(=O)NC2CCN(Cc3ccc(F)cc3C)CC2)CCC1	ZINC001227753750	1375472174	/nfs/dbraw/zinc/47/21/74/1375472174.db2.gz	BWKZGNSVAPXKJD-UHFFFAOYSA-N	0	3	342.458	3.408	20	30		EGEDHN
CC/C=C(/C)C(=O)N1CC[C@H](C)[C@H](CNCc2ccccc2C#N)C1	ZINC001132697955	1375520411	/nfs/dbraw/zinc/52/04/11/1375520411.db2.gz	UKEJGCXIZAXALD-LSVRKXKUSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](C)[C@H](CNCc2cc(C)no2)C1	ZINC001132847465	1375600157	/nfs/dbraw/zinc/60/01/57/1375600157.db2.gz	YJZAQDPONDMJSX-GOEBONIOSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](C)[C@@H](CNCc2nc(C)cs2)C1	ZINC001132864867	1375607391	/nfs/dbraw/zinc/60/73/91/1375607391.db2.gz	DGWHIVLRSQVQMV-ZBFHGGJFSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)C[C@H](C)c1cccnc1	ZINC001228948037	1375724024	/nfs/dbraw/zinc/72/40/24/1375724024.db2.gz	BFZAFQADSPTSBS-IAOVAPTHSA-N	0	3	335.879	3.345	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](C)[C@H](CNCc2cscn2)C1	ZINC001133039132	1375729889	/nfs/dbraw/zinc/72/98/89/1375729889.db2.gz	LNXAXQLADUSGKK-IAGOWNOFSA-N	0	3	347.528	3.301	20	30		EGEDHN
C=CCC1(C(=O)NC2CCN(CCOCC3CCC3)CC2)CCC1	ZINC001229029569	1375743881	/nfs/dbraw/zinc/74/38/81/1375743881.db2.gz	GAYIUXDDLUTYDD-UHFFFAOYSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](C)[C@@H](CNCc2cc(C3CC3)no2)C1	ZINC001133072887	1375759496	/nfs/dbraw/zinc/75/94/96/1375759496.db2.gz	MEITYQXBWCSONP-WBVHZDCISA-N	0	3	345.487	3.483	20	30		EGEDHN
CCCCCC(=O)N1CC[C@@H](N(C)Cc2ccc(OC)c(C#N)c2)C1	ZINC001188907496	1388406930	/nfs/dbraw/zinc/40/69/30/1388406930.db2.gz	ZIYBGUYQYQBFIF-GOSISDBHSA-N	0	3	343.471	3.180	20	30		EGEDHN
C=C1CCC(C(=O)NCCNCc2ccccc2OC(C)C)CC1	ZINC001133368656	1375950622	/nfs/dbraw/zinc/95/06/22/1375950622.db2.gz	CRXXSEDNZCTBKX-UHFFFAOYSA-N	0	3	330.472	3.426	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H]1CC1(C)C	ZINC001133396073	1375979435	/nfs/dbraw/zinc/97/94/35/1375979435.db2.gz	PRHIGNFORDPULI-KRWDZBQOSA-N	0	3	332.875	3.328	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H]1CCC[C@H]2C[C@H]21	ZINC001133399872	1375984633	/nfs/dbraw/zinc/98/46/33/1375984633.db2.gz	XSHLAHUVDPYZFL-QXAKKESOSA-N	0	3	344.886	3.328	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@H]1C[C@H]2C[C@H]2C1	ZINC001133405861	1375991326	/nfs/dbraw/zinc/99/13/26/1375991326.db2.gz	UOCVWQVUBNBFPP-PIIMJCKOSA-N	0	3	344.886	3.328	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@H]1C[C@@]1(C)CC	ZINC001133407530	1375992881	/nfs/dbraw/zinc/99/28/81/1375992881.db2.gz	IXHVZKYBQOPGEU-IEBWSBKVSA-N	0	3	332.875	3.328	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NC1CCN(Cc2ccc(CCC)cc2)CC1	ZINC001230406794	1376020722	/nfs/dbraw/zinc/02/07/22/1376020722.db2.gz	DDJKCCMGAFVRDF-QGZVFWFLSA-N	0	3	344.499	3.311	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1C1CCN(C(=O)[C@H](CC)OCC)CC1	ZINC001230522175	1376053899	/nfs/dbraw/zinc/05/38/99/1376053899.db2.gz	INIBCXASILMJID-SJORKVTESA-N	0	3	342.911	3.257	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)c1ccccc1)NCc1cc(F)ccc1C#N	ZINC001133526657	1376061788	/nfs/dbraw/zinc/06/17/88/1376061788.db2.gz	WZOAMQYDECNJSO-GJZGRUSLSA-N	0	3	339.414	3.384	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1C1CCN(C(=O)CC[C@@H](C)OC)CC1	ZINC001230552054	1376073498	/nfs/dbraw/zinc/07/34/98/1376073498.db2.gz	HKBNWZLXVVAZCP-WBVHZDCISA-N	0	3	342.911	3.257	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC([C@@H]2CCCN2Cc2ccon2)CC1	ZINC001230569781	1376080811	/nfs/dbraw/zinc/08/08/11/1376080811.db2.gz	VHDNBOYBXDAJHJ-SFHVURJKSA-N	0	3	345.487	3.480	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC([C@@H]2CCCN2Cc2ccon2)CC1	ZINC001230586687	1376088474	/nfs/dbraw/zinc/08/84/74/1376088474.db2.gz	DYRNAHYBQKHJTI-APWZRJJASA-N	0	3	345.487	3.480	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)c1cc(C)sn1)Cc1cccnc1	ZINC001230746187	1376138024	/nfs/dbraw/zinc/13/80/24/1376138024.db2.gz	VHHTWKWAGYWLJI-UHFFFAOYSA-N	0	3	344.484	3.045	20	30		EGEDHN
C#CCCN(CCCNC(=O)[C@@H]1CCC[C@H](C)C1)Cc1cccnc1	ZINC001230829954	1376162518	/nfs/dbraw/zinc/16/25/18/1376162518.db2.gz	SJHNHENJMFFVSD-AZUAARDMSA-N	0	3	341.499	3.240	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCCN(Cc1cccnc1)C[C@@H](C)OC	ZINC001230859697	1376166508	/nfs/dbraw/zinc/16/65/08/1376166508.db2.gz	LQNVXVWKWXRPQZ-QGZVFWFLSA-N	0	3	347.503	3.027	20	30		EGEDHN
C=CCCC(=O)N(C)C[C@H]1CCN1CC[C@H](C)OCc1ccccc1	ZINC001231168870	1376212022	/nfs/dbraw/zinc/21/20/22/1376212022.db2.gz	BXLZFYKUJURRTD-AZUAARDMSA-N	0	3	344.499	3.481	20	30		EGEDHN
CC/C=C(/C)C(=O)N[C@H](C)C[C@H](C)NCc1cc(F)ccc1C#N	ZINC001133839339	1376226442	/nfs/dbraw/zinc/22/64/42/1376226442.db2.gz	FHKHEUHOEKGSKT-TUJBUDNFSA-N	0	3	331.435	3.427	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)C1CC=CC1)NCc1cc(F)ccc1C#N	ZINC001133980153	1376295350	/nfs/dbraw/zinc/29/53/50/1376295350.db2.gz	UDEJAHKHEZNMJA-KBPBESRZSA-N	0	3	329.419	3.036	20	30		EGEDHN
C#Cc1cccc(CN2CCC3(CC2)Cc2ccccc2CNC3=O)c1	ZINC001231657609	1376296308	/nfs/dbraw/zinc/29/63/08/1376296308.db2.gz	RVYDQXFOXDEGLD-UHFFFAOYSA-N	0	3	344.458	3.123	20	30		EGEDHN
COc1cc(Cl)c(CN2CCC3SC(=O)C=C3C2)c(OC)c1	ZINC001231698126	1376301857	/nfs/dbraw/zinc/30/18/57/1376301857.db2.gz	ORJAEHXSBSRCTI-HNNXBMFYSA-N	0	3	339.844	3.131	20	30		EGEDHN
C#CCCCCC(=O)N[C@H](C)C[C@H](C)NCc1cc(F)ccc1C#N	ZINC001134113770	1376374208	/nfs/dbraw/zinc/37/42/08/1376374208.db2.gz	FNFRSKCJEWBONK-JKSUJKDBSA-N	0	3	343.446	3.264	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H](C)C[C@@H](C)NCc2ccccc2C#N)co1	ZINC001134179354	1376402607	/nfs/dbraw/zinc/40/26/07/1376402607.db2.gz	UEETUOUZRVYEIU-KGLIPLIRSA-N	0	3	325.412	3.146	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H](C)C[C@@H](C)NCc2ccccc2C#N)ns1	ZINC001134214377	1376421443	/nfs/dbraw/zinc/42/14/43/1376421443.db2.gz	OSBGRUZLWPQDAQ-OLZOCXBDSA-N	0	3	342.468	3.010	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cccc(F)c2Cl)cc1F	ZINC001134327802	1376478705	/nfs/dbraw/zinc/47/87/05/1376478705.db2.gz	MWMVBRQBRGTVGU-UHFFFAOYSA-N	0	3	349.768	3.009	20	30		EGEDHN
CC(C)(C)c1ccc(CC(=O)NCCNCc2ccc(C#N)cc2)cc1	ZINC001134417513	1376521935	/nfs/dbraw/zinc/52/19/35/1376521935.db2.gz	WFOJGPBZYFOVKF-UHFFFAOYSA-N	0	3	349.478	3.304	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H](C)C[C@@H](C)NCc1conc1CC	ZINC001134418276	1376523228	/nfs/dbraw/zinc/52/32/28/1376523228.db2.gz	IADJRAULESJTEE-CABCVRRESA-N	0	3	333.476	3.378	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H](C)C[C@@H](C)NCc1cc2n(n1)CCCC2	ZINC001134456656	1376547811	/nfs/dbraw/zinc/54/78/11/1376547811.db2.gz	BJAFMLLWJNELIL-CVEARBPZSA-N	0	3	346.519	3.195	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H](C)C[C@H](C)NCc1c(C)nn(C)c1Cl	ZINC001134471080	1376555749	/nfs/dbraw/zinc/55/57/49/1376555749.db2.gz	UFYGFZAVUBZJGL-STQMWFEESA-N	0	3	340.899	3.111	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H](C)C[C@@H](C)NCc1c(C)nn(C)c1Cl	ZINC001134471078	1376555783	/nfs/dbraw/zinc/55/57/83/1376555783.db2.gz	UFYGFZAVUBZJGL-OLZOCXBDSA-N	0	3	340.899	3.111	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H](C)C[C@H](C)NC/C(Cl)=C\Cl	ZINC001134638736	1376636955	/nfs/dbraw/zinc/63/69/55/1376636955.db2.gz	UETFTRKLKVVDIP-NNQLKGDCSA-N	0	3	344.286	3.480	20	30		EGEDHN
Cc1ccccc1[C@H](C)CC(=O)NCCNCc1cccc(C#N)c1	ZINC001134726530	1376679969	/nfs/dbraw/zinc/67/99/69/1376679969.db2.gz	XZUDHTWPSBXMHI-QGZVFWFLSA-N	0	3	335.451	3.266	20	30		EGEDHN
N#Cc1cc2ccc(O[C@H]3CC[C@H](N4CCOCC4)CC3)cc2[nH]1	ZINC001233995469	1376749707	/nfs/dbraw/zinc/74/97/07/1376749707.db2.gz	CXJDRGAETRNBTG-QAQDUYKDSA-N	0	3	325.412	3.062	20	30		EGEDHN
C=CCCCCCN1CC[C@H]1CN(C)C(=O)C1(c2ccccn2)CC1	ZINC001234314171	1376804962	/nfs/dbraw/zinc/80/49/62/1376804962.db2.gz	SIYAULNBGSCYJO-SFHVURJKSA-N	0	3	341.499	3.392	20	30		EGEDHN
CC1(C)C2CCC1(C(=O)NCCNCc1ccc(F)c(C#N)c1)CC2	ZINC001134986955	1376829313	/nfs/dbraw/zinc/82/93/13/1376829313.db2.gz	AQLIIDPHGGJBMK-UHFFFAOYSA-N	0	3	343.446	3.120	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)CC1(C)CC1)NCc1cc(F)ccc1C#N	ZINC001135061754	1376874165	/nfs/dbraw/zinc/87/41/65/1376874165.db2.gz	DTKSTIZCBAQNLB-ZIAGYGMSSA-N	0	3	331.435	3.260	20	30		EGEDHN
C=CCCCCCN1CC[C@H]1CN(C)C(=O)c1cc2n(n1)CCCC2	ZINC001235633482	1376880554	/nfs/dbraw/zinc/88/05/54/1376880554.db2.gz	PTWWKZDNXPZPER-SFHVURJKSA-N	0	3	344.503	3.112	20	30		EGEDHN
C=CCCCN1CC[C@@H]1CN(C)C(=O)c1ccc2oc(C)nc2c1	ZINC001235665559	1376882347	/nfs/dbraw/zinc/88/23/47/1376882347.db2.gz	LWRRLAXKULRDPV-MRXNPFEDSA-N	0	3	327.428	3.249	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H](C)C[C@H](C)NCc2nc(C)cs2)cc1	ZINC001135185362	1376958668	/nfs/dbraw/zinc/95/86/68/1376958668.db2.gz	YJFWPWWXQCRZTC-UONOGXRCSA-N	0	3	341.480	3.120	20	30		EGEDHN
CC#CCCCC(=O)N[C@H](C)C[C@@H](C)NCc1oc(CC)nc1C	ZINC001135224638	1376985935	/nfs/dbraw/zinc/98/59/35/1376985935.db2.gz	GSZNVBYGHADOKS-HUUCEWRRSA-N	0	3	333.476	3.112	20	30		EGEDHN
C[C@@]1(C(=O)NCCNCc2ccc(C#N)cc2)CCCc2ccccc21	ZINC001135356913	1377050105	/nfs/dbraw/zinc/05/01/05/1377050105.db2.gz	NCHGCWIPBWNIPF-JOCHJYFZSA-N	0	3	347.462	3.058	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2nccn2CC)CCC1	ZINC001135390885	1377069894	/nfs/dbraw/zinc/06/98/94/1377069894.db2.gz	NXFYGRCCFRREHS-CVEARBPZSA-N	0	3	332.492	3.022	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)CC(C)(F)F)NCc1cc(F)ccc1C#N	ZINC001135402559	1377076346	/nfs/dbraw/zinc/07/63/46/1377076346.db2.gz	OELNFMJXSAYKPT-NEPJUHHUSA-N	0	3	341.377	3.116	20	30		EGEDHN
Cc1cccc(C(=O)NCCNCc2ccc(C#N)s2)c1Cl	ZINC001135532490	1377132414	/nfs/dbraw/zinc/13/24/14/1377132414.db2.gz	UFQCETNPPPDSEZ-UHFFFAOYSA-N	0	3	333.844	3.101	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H](C)C[C@@H](C)NCc1ccn(C(C)C)n1	ZINC001135565358	1377147911	/nfs/dbraw/zinc/14/79/11/1377147911.db2.gz	UEWQKCQMRVPCLC-CVEARBPZSA-N	0	3	334.508	3.439	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CC[C@@H](N(C)Cc2cc(F)ccc2C)C1	ZINC001189241953	1388493631	/nfs/dbraw/zinc/49/36/31/1388493631.db2.gz	BLAGVBSYEXILSE-QFBILLFUSA-N	0	3	348.462	3.148	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@@]2(C1)CN(C1CCCC1)CCO2	ZINC001268985070	1377535390	/nfs/dbraw/zinc/53/53/90/1377535390.db2.gz	FVGIGYPICNLJPA-FQEVSTJZSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@@]2(CCN(Cc3ccc[nH]3)C2)C1	ZINC001268985575	1377535412	/nfs/dbraw/zinc/53/54/12/1377535412.db2.gz	SUMCVSYYJDCIEZ-FQEVSTJZSA-N	0	3	329.488	3.432	20	30		EGEDHN
CCC[C@H](C)CC(=O)N1CC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001189270503	1388503592	/nfs/dbraw/zinc/50/35/92/1388503592.db2.gz	SPTAZMQOXNQQOE-QFBILLFUSA-N	0	3	327.472	3.417	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3ccc(Cl)c(F)c3)C2)C1=O	ZINC001137650270	1377581358	/nfs/dbraw/zinc/58/13/58/1377581358.db2.gz	FWMWZDRJAXIKCF-SFHVURJKSA-N	0	3	336.838	3.480	20	30		EGEDHN
C(#Cc1ccc(CN2CCc3nccn3CC2)cc1)c1ccccc1	ZINC001138335999	1377704670	/nfs/dbraw/zinc/70/46/70/1377704670.db2.gz	GWARYZQNHVRROV-UHFFFAOYSA-N	0	3	327.431	3.341	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1c(F)cccc1OC)CC2	ZINC001138382525	1377712715	/nfs/dbraw/zinc/71/27/15/1377712715.db2.gz	BKJBBZLWSRBWJV-FQEVSTJZSA-N	0	3	346.446	3.367	20	30		EGEDHN
C=CCO[C@@H]1CO[C@]2(C1)CCCN(Cc1cc(C)ccc1OC)C2	ZINC001138486785	1377731485	/nfs/dbraw/zinc/73/14/85/1377731485.db2.gz	XRCOYMDTHRZRSU-ICSRJNTNSA-N	0	3	331.456	3.330	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2C[C@@H]3C[C@]3(NC(=O)OC(C)(C)C)C2)c1[O-]	ZINC001138625658	1377756192	/nfs/dbraw/zinc/75/61/92/1377756192.db2.gz	RTMNSRIKNJIXCV-JXFKEZNVSA-N	0	3	344.455	3.220	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2C[C@@H]3C[C@]3(NC(=O)OC(C)(C)C)C2)c1[O-]	ZINC001138625658	1377756193	/nfs/dbraw/zinc/75/61/93/1377756193.db2.gz	RTMNSRIKNJIXCV-JXFKEZNVSA-N	0	3	344.455	3.220	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CCC(C(=O)N3CCCCC3)CC2)c1[O-]	ZINC001138629086	1377756929	/nfs/dbraw/zinc/75/69/29/1377756929.db2.gz	NJMHTXKXBBRNAG-UHFFFAOYSA-N	0	3	342.483	3.345	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3ccccc3OCCC)C2)C1=O	ZINC001138997285	1377815592	/nfs/dbraw/zinc/81/55/92/1377815592.db2.gz	YNFHIJCSNFBJIN-NRFANRHFSA-N	0	3	342.483	3.476	20	30		EGEDHN
N#Cc1ccnc(-c2ccc(CN3CCC(F)(F)[C@@H](CO)C3)cc2)c1	ZINC001139400499	1377879065	/nfs/dbraw/zinc/87/90/65/1377879065.db2.gz	ULRHXZBXZJYYDM-QGZVFWFLSA-N	0	3	343.377	3.070	20	30		EGEDHN
Cc1ccc(CN2C[C@@H]3C(=O)N(c4ccsc4)C[C@@H]3C2)cc1C#N	ZINC001139723910	1377941610	/nfs/dbraw/zinc/94/16/10/1377941610.db2.gz	JBKGLFBDDAWIPO-WMZOPIPTSA-N	0	3	337.448	3.023	20	30		EGEDHN
Cc1ccc(CN2CCC[C@@](O)(C(F)(F)F)[C@H](C)C2)cc1C#N	ZINC001139723184	1377941641	/nfs/dbraw/zinc/94/16/41/1377941641.db2.gz	URUFXAXBEXTZBY-CJNGLKHVSA-N	0	3	326.362	3.392	20	30		EGEDHN
Cn1ncc2ccc(CN3CCC(Oc4ccccc4C#N)CC3)cc21	ZINC001139907364	1377975822	/nfs/dbraw/zinc/97/58/22/1377975822.db2.gz	HILIEJGUXYFICN-UHFFFAOYSA-N	0	3	346.434	3.488	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCC[N@@H+](Cc1cc(F)ccc1[O-])[C@H]2CC	ZINC001140062854	1377998880	/nfs/dbraw/zinc/99/88/80/1377998880.db2.gz	GTMXJBFNLUJGDM-ICSRJNTNSA-N	0	3	346.446	3.453	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCC[N@H+](Cc1cc(F)ccc1[O-])[C@H]2CC	ZINC001140062854	1377998883	/nfs/dbraw/zinc/99/88/83/1377998883.db2.gz	GTMXJBFNLUJGDM-ICSRJNTNSA-N	0	3	346.446	3.453	20	30		EGEDHN
CCOC(=O)C1(C)CCN(Cc2c[nH]c3ccc(C#N)cc23)CC1	ZINC001140115144	1378012186	/nfs/dbraw/zinc/01/21/86/1378012186.db2.gz	OBYKVHXPJJMDQH-UHFFFAOYSA-N	0	3	325.412	3.205	20	30		EGEDHN
C#CCN1CC[C@@]2(CCCN(Cc3cc(C)ccc3Cl)CC2)C1=O	ZINC001274492247	1378128304	/nfs/dbraw/zinc/12/83/04/1378128304.db2.gz	JFNHBFBPGXMWAZ-FQEVSTJZSA-N	0	3	344.886	3.486	20	30		EGEDHN
COc1ccc(CN2CCC[C@H](Oc3cccc(C#N)c3)C2)cc1N	ZINC001140898407	1378174387	/nfs/dbraw/zinc/17/43/87/1378174387.db2.gz	LWMXSVTVEDCHLI-SFHVURJKSA-N	0	3	337.423	3.192	20	30		EGEDHN
CCCCN1CCc2c(n[nH]c2C(=O)Nc2cc(C)ccc2C#N)C1	ZINC001278218115	1378264247	/nfs/dbraw/zinc/26/42/47/1378264247.db2.gz	UHWUUUDMJZVDRI-UHFFFAOYSA-N	0	3	337.427	3.000	20	30		EGEDHN
CC(C)N1CCN(Cc2ccc(Br)cc2C#N)C[C@@H]1C	ZINC001141818774	1378382168	/nfs/dbraw/zinc/38/21/68/1378382168.db2.gz	VCQDLUXTKMNYAG-ZDUSSCGKSA-N	0	3	336.277	3.235	20	30		EGEDHN
CSc1nc(CN2CC[C@H](N3CCCCC3)[C@@H](F)C2)ccc1C#N	ZINC001141948350	1378397109	/nfs/dbraw/zinc/39/71/09/1378397109.db2.gz	VBEUESCNWPUVSN-IRXDYDNUSA-N	0	3	348.491	3.073	20	30		EGEDHN
O=C(C#Cc1ccccc1)N1CCC[C@@H]2CN(Cc3ccccc3)C[C@@H]21	ZINC001142857547	1378497083	/nfs/dbraw/zinc/49/70/83/1378497083.db2.gz	CXHDKAKQKGMXBX-YADHBBJMSA-N	0	3	344.458	3.161	20	30		EGEDHN
N#Cc1ccc2c(CN3CCC[C@H](Oc4cccnc4)C3)c[nH]c2c1	ZINC001142921691	1378509020	/nfs/dbraw/zinc/50/90/20/1378509020.db2.gz	SQOGJMYYJOLVOW-SFHVURJKSA-N	0	3	332.407	3.478	20	30		EGEDHN
N#Cc1ccc(CN2CCN([C@@H]3CCCc4ccccc43)CC2)nc1	ZINC001144163632	1378689638	/nfs/dbraw/zinc/68/96/38/1378689638.db2.gz	OCDRMZOPUAYHMH-OAQYLSRUSA-N	0	3	332.451	3.148	20	30		EGEDHN
COC(=O)[C@H](c1ccccc1)[C@@H]1CCCCN1Cc1ccc(C#N)cn1	ZINC001144163576	1378690177	/nfs/dbraw/zinc/69/01/77/1378690177.db2.gz	LDQULJYBMGDXRA-VQTJNVASSA-N	0	3	349.434	3.265	20	30		EGEDHN
Cc1c[nH]cc1C(=O)N[C@H](C)C[C@@H](C)NCc1cc(F)ccc1C#N	ZINC001146374870	1378829918	/nfs/dbraw/zinc/82/99/18/1378829918.db2.gz	RTHFFTLRZLPOJH-ZIAGYGMSSA-N	0	3	342.418	3.021	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2conc2C)CCCCC1	ZINC001146702623	1378903267	/nfs/dbraw/zinc/90/32/67/1378903267.db2.gz	YHDOUAZPGIBKTP-HOTGVXAUSA-N	0	3	345.487	3.330	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2cc(C)ncn2)CCCC1	ZINC001146820461	1378927260	/nfs/dbraw/zinc/92/72/60/1378927260.db2.gz	GATMIRHVDAQXKH-RDJZCZTQSA-N	0	3	344.503	3.294	20	30		EGEDHN
CCC1(C(=O)N(C)[C@@H](CNCc2cc(C#N)ccc2F)C2CC2)CC1	ZINC001283533996	1379004955	/nfs/dbraw/zinc/00/49/55/1379004955.db2.gz	VLJBXPAFSVAOJG-SFHVURJKSA-N	0	3	343.446	3.214	20	30		EGEDHN
C#CCCCC(=O)N1CC2(C1)CCN([C@H](C)c1cccc(F)c1)C2	ZINC001147462058	1379025143	/nfs/dbraw/zinc/02/51/43/1379025143.db2.gz	MRCKISQTEJVNLS-MRXNPFEDSA-N	0	3	328.431	3.225	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CC2(C1)CCN(Cc1ccsc1)C2)OCC	ZINC001147652190	1379055720	/nfs/dbraw/zinc/05/57/20/1379055720.db2.gz	DBSGYVRWNRSNDZ-KRWDZBQOSA-N	0	3	348.512	3.154	20	30		EGEDHN
C=C(C)CCC(=O)N1CC2(C1)CCN(CCO[C@H]1CCCC[C@H]1C)C2	ZINC001147657890	1379056628	/nfs/dbraw/zinc/05/66/28/1379056628.db2.gz	GRUYMIBMYNSETR-MOPGFXCFSA-N	0	3	348.531	3.472	20	30		EGEDHN
C[C@@H](CN(C)C(=O)c1cc(F)ccc1F)NCc1ccc(C#N)s1	ZINC001283620953	1379059682	/nfs/dbraw/zinc/05/96/82/1379059682.db2.gz	GSRXQMXJQBCZPG-NSHDSACASA-N	0	3	349.406	3.148	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001148080387	1379113724	/nfs/dbraw/zinc/11/37/24/1379113724.db2.gz	XINUGTYLRVTGKB-REZTVBANSA-N	0	3	335.451	3.115	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)N1CC2(C1)CCN(Cc1ccc(C)nc1C)C2	ZINC001148086932	1379114549	/nfs/dbraw/zinc/11/45/49/1379114549.db2.gz	AZTJNXSANSSDPV-RDJZCZTQSA-N	0	3	341.499	3.191	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)N1CC2(C1)CCN(CCOc1ccccc1)C2	ZINC001148095204	1379116887	/nfs/dbraw/zinc/11/68/87/1379116887.db2.gz	DVEAAICZDWIFOL-ROUUACIJSA-N	0	3	342.483	3.058	20	30		EGEDHN
C=CCCCC(=O)N1CC2(C1)CCN(Cc1ccc(OC)cc1)C2	ZINC001148194033	1379131435	/nfs/dbraw/zinc/13/14/35/1379131435.db2.gz	PNCOXSOCSBOLJC-UHFFFAOYSA-N	0	3	328.456	3.086	20	30		EGEDHN
CCC(C)(CC)C(=O)N(C)C[C@H](C)NCc1ccc(OC)c(C#N)c1	ZINC001283714803	1379138209	/nfs/dbraw/zinc/13/82/09/1379138209.db2.gz	PNMWNCSWZGMFOU-HNNXBMFYSA-N	0	3	345.487	3.330	20	30		EGEDHN
CCCCCCCCC(=O)NCCNCc1ccnc(N(C)C)c1	ZINC001148727586	1379253814	/nfs/dbraw/zinc/25/38/14/1379253814.db2.gz	CUKJCGBZEXFOFE-UHFFFAOYSA-N	0	3	334.508	3.104	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C[C@@H](C)CCc3ccccc3)C2)C1	ZINC001148873901	1379288586	/nfs/dbraw/zinc/28/85/86/1379288586.db2.gz	AOCQLLUCXFAQHA-IBGZPJMESA-N	0	3	338.495	3.203	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@H]1CN(Cc2ccc(CC)cc2)CCCO1	ZINC001149797367	1379448830	/nfs/dbraw/zinc/44/88/30/1379448830.db2.gz	URJBJTHFBLKCDO-FQEVSTJZSA-N	0	3	344.499	3.312	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H]1CN([C@@H](C)c2ccccc2)CCCO1	ZINC001149797036	1379449479	/nfs/dbraw/zinc/44/94/79/1379449479.db2.gz	QFEHBVWKZYYBNH-PKOBYXMFSA-N	0	3	330.472	3.311	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@H]1CN(CC2=CCCCC2)CCCO1	ZINC001150079048	1379491581	/nfs/dbraw/zinc/49/15/81/1379491581.db2.gz	PACJHKKAQYOQJW-SFHVURJKSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H]1CN(Cc2ccc(CC)cc2)CCCO1	ZINC001150084758	1379492056	/nfs/dbraw/zinc/49/20/56/1379492056.db2.gz	GUZVSBNUUGVIMA-LJQANCHMSA-N	0	3	344.499	3.168	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)C[C@@H](C)c2cccc(F)c2)C1	ZINC001150282674	1379528710	/nfs/dbraw/zinc/52/87/10/1379528710.db2.gz	PHXGUXHKBHPZBR-APWZRJJASA-N	0	3	348.462	3.103	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@H]1CN(Cc2ccccc2C)CCCO1	ZINC001150372794	1379541200	/nfs/dbraw/zinc/54/12/00/1379541200.db2.gz	SKQIGHVLIOZLIL-IBGZPJMESA-N	0	3	344.499	3.304	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)C[C@H](C)c2ccc(F)cc2)C1	ZINC001150754398	1379608092	/nfs/dbraw/zinc/60/80/92/1379608092.db2.gz	ZOOUEOUQFDIGOQ-QFBILLFUSA-N	0	3	348.462	3.103	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2c[nH]cc2-c2ccccc2)cc1	ZINC001151073896	1379657942	/nfs/dbraw/zinc/65/79/42/1379657942.db2.gz	RUHWVTRBHLYMLY-UHFFFAOYSA-N	0	3	344.418	3.073	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2ccc(C)c(F)c2)CC1	ZINC001151198577	1379675532	/nfs/dbraw/zinc/67/55/32/1379675532.db2.gz	GWQNWXMPNZGLRG-UHFFFAOYSA-N	0	3	348.462	3.311	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)CC(C2CC2)C2CC2)CC1	ZINC001151412491	1379714357	/nfs/dbraw/zinc/71/43/57/1379714357.db2.gz	GLCKEEPOZUUBPM-UHFFFAOYSA-N	0	3	348.531	3.376	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)/C=C\c1ccco1	ZINC001151597679	1379743984	/nfs/dbraw/zinc/74/39/84/1379743984.db2.gz	QOHZKJXVSBIFIX-BLIJAFNYSA-N	0	3	337.423	3.191	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)c1ccccc1F	ZINC001151606267	1379746037	/nfs/dbraw/zinc/74/60/37/1379746037.db2.gz	XVNRBHBAVVVIHK-OAHLLOKOSA-N	0	3	339.414	3.338	20	30		EGEDHN
C=C[C@H](CC(=O)NCCNCc1cccc(C#N)c1)c1ccccc1	ZINC001151942331	1379820054	/nfs/dbraw/zinc/82/00/54/1379820054.db2.gz	FIRWMFMQIPRSJK-LJQANCHMSA-N	0	3	333.435	3.124	20	30		EGEDHN
Cc1ccc(CN2CC[C@@H](NC(=O)[C@H](CC#N)c3ccccc3)C2)cc1	ZINC001152420584	1379931718	/nfs/dbraw/zinc/93/17/18/1379931718.db2.gz	ZLRHJYKYQHCUED-NHCUHLMSSA-N	0	3	347.462	3.383	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)[C@@H](C)C1CC1	ZINC001152636330	1379960061	/nfs/dbraw/zinc/96/00/61/1379960061.db2.gz	IWDFCEKVQNJNCI-KGLIPLIRSA-N	0	3	331.435	3.070	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)[C@@H]1CC1(C)C	ZINC001152801720	1379982178	/nfs/dbraw/zinc/98/21/78/1379982178.db2.gz	BYOSNUGQBYAZIB-CJNGLKHVSA-N	0	3	331.435	3.070	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)c1coc(C)c1	ZINC001152954987	1379998914	/nfs/dbraw/zinc/99/89/14/1379998914.db2.gz	BUURTIKMTHGKDX-CYBMUJFWSA-N	0	3	343.402	3.239	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NCCNC1c2ccccc2-c2ccccc21	ZINC001153135495	1380027197	/nfs/dbraw/zinc/02/71/97/1380027197.db2.gz	VFRAQHZULIBEPC-OAHLLOKOSA-N	0	3	336.435	3.053	20	30		EGEDHN
CC/C(C)=C\C(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)c(F)c1	ZINC001153188718	1380032271	/nfs/dbraw/zinc/03/22/71/1380032271.db2.gz	UTZJRJKXKIGNSE-KQGZCTBQSA-N	0	3	331.435	3.380	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H](C)N(CC)CCOc1ccccc1F	ZINC001153625665	1380106537	/nfs/dbraw/zinc/10/65/37/1380106537.db2.gz	CKITWEZPMBQLIM-MRXNPFEDSA-N	0	3	336.451	3.387	20	30		EGEDHN
C=CCC[C@H](C(=O)NCCNCc1cccnc1C)c1ccccc1	ZINC001153816270	1380135619	/nfs/dbraw/zinc/13/56/19/1380135619.db2.gz	BIVLKIZVFQDKMP-FQEVSTJZSA-N	0	3	337.467	3.346	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@@H](C)N(CC)Cc1cccc(F)c1	ZINC001153830834	1380139941	/nfs/dbraw/zinc/13/99/41/1380139941.db2.gz	LOKLEJDMAHOEAT-MRXNPFEDSA-N	0	3	343.446	3.454	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1cccc2c1CCCCC2	ZINC001153922504	1380155304	/nfs/dbraw/zinc/15/53/04/1380155304.db2.gz	AYDAIVSCMAOPSW-QGZVFWFLSA-N	0	3	326.484	3.419	20	30		EGEDHN
CCc1ccc(C(=O)NCCNCc2ccc(C#N)s2)cc1CC	ZINC001154012451	1380178691	/nfs/dbraw/zinc/17/86/91/1380178691.db2.gz	ALJZTUPKMNVLCE-UHFFFAOYSA-N	0	3	341.480	3.264	20	30		EGEDHN
C=C/C(C)=C/CC(=O)NC[C@@H](C)N(CC)Cc1cccc(C#N)c1	ZINC001154699841	1380334640	/nfs/dbraw/zinc/33/46/40/1380334640.db2.gz	SFFQIPIDDJUFSG-BRVCPTFNSA-N	0	3	325.456	3.407	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)NC[C@@H](C)N(CC)Cc1cccc(C#N)c1	ZINC001155149233	1380416359	/nfs/dbraw/zinc/41/63/59/1380416359.db2.gz	GDGDZWMEOKXNAR-ATZDWAIDSA-N	0	3	327.472	3.321	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)cc1	ZINC001155489754	1380459891	/nfs/dbraw/zinc/45/98/91/1380459891.db2.gz	LGJXUXKENUKQPH-MRXNPFEDSA-N	0	3	327.472	3.487	20	30		EGEDHN
CCN(Cc1ccc(OC)c(C#N)c1)[C@H](C)CNC(=O)[C@H](C)C(C)C	ZINC001155581528	1380470326	/nfs/dbraw/zinc/47/03/26/1380470326.db2.gz	TYQQTXSFCZGIOJ-HZPDHXFCSA-N	0	3	345.487	3.186	20	30		EGEDHN
C=CCCC(=O)NCCCNCc1ccc(-c2ncco2)cc1F	ZINC001155587124	1380470870	/nfs/dbraw/zinc/47/08/70/1380470870.db2.gz	YGVYMRNHOCTYEL-UHFFFAOYSA-N	0	3	331.391	3.043	20	30		EGEDHN
C=CCCC(=O)NCCCNCc1cc(-c2ccc(F)cc2)no1	ZINC001155593333	1380471114	/nfs/dbraw/zinc/47/11/14/1380471114.db2.gz	IFZIGXCTGYBHHN-UHFFFAOYSA-N	0	3	331.391	3.043	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NC[C@@H](C)N(CC)Cc1ccc(F)cc1	ZINC001155757267	1380489378	/nfs/dbraw/zinc/48/93/78/1380489378.db2.gz	DSKAXLUUOWGDPF-MNEFBYGVSA-N	0	3	348.462	3.134	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)CCC1(C)CC1	ZINC001156177291	1380536564	/nfs/dbraw/zinc/53/65/64/1380536564.db2.gz	SGLSXTUNYQWODC-MRXNPFEDSA-N	0	3	327.472	3.465	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1ccc(O[C@H](C)CC)cc1	ZINC001156218565	1380544381	/nfs/dbraw/zinc/54/43/81/1380544381.db2.gz	SIKLZUWJEJAJNL-IAGOWNOFSA-N	0	3	330.472	3.327	20	30		EGEDHN
N#CCc1cnc(-n2cncc2CNCc2ccccc2)c(Cl)c1	ZINC001156509662	1380586250	/nfs/dbraw/zinc/58/62/50/1380586250.db2.gz	YHYOALASBFCNIO-UHFFFAOYSA-N	0	3	337.814	3.277	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1ccc(Cl)cc1Cl	ZINC001156561176	1380594885	/nfs/dbraw/zinc/59/48/85/1380594885.db2.gz	SUPHJZSCUXDYKG-GFCCVEGCSA-N	0	3	327.255	3.457	20	30		EGEDHN
CCN(CC#CCOC)[C@H](C)CNC(=O)C[C@H]1CCCCC1(C)C	ZINC001157347994	1380848821	/nfs/dbraw/zinc/84/88/21/1380848821.db2.gz	ZUDOFQUJGKSRHF-QZTJIDSGSA-N	0	3	336.520	3.069	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C1(CCc2ccccc2)CC1	ZINC001157395251	1380866657	/nfs/dbraw/zinc/86/66/57/1380866657.db2.gz	OXWIKLQAVAESSZ-GOSISDBHSA-N	0	3	326.484	3.249	20	30		EGEDHN
CC(C)C#CC(=O)NCCCNCc1cc(Cl)sc1Cl	ZINC001157639043	1380987971	/nfs/dbraw/zinc/98/79/71/1380987971.db2.gz	WEUZSSBKQIWGQK-UHFFFAOYSA-N	0	3	333.284	3.310	20	30		EGEDHN
Cc1nc(CNCCCNC(=O)C#CC(C)C)sc1C(C)(C)C	ZINC001157638392	1380988348	/nfs/dbraw/zinc/98/83/48/1380988348.db2.gz	ALTLADZHRFIDIT-UHFFFAOYSA-N	0	3	335.517	3.004	20	30		EGEDHN
O=C(C#CC1CC1)NCCCNCc1cc(Cl)sc1Cl	ZINC001157683033	1381000690	/nfs/dbraw/zinc/00/06/90/1381000690.db2.gz	XCDPMCFPRFGUOH-UHFFFAOYSA-N	0	3	331.268	3.064	20	30		EGEDHN
C=CCOCC(=O)N1CCCC[C@@H]1CN(C)[C@@H](C)c1ccc(F)cc1	ZINC001157687372	1381002328	/nfs/dbraw/zinc/00/23/28/1381002328.db2.gz	ZOWASQPGPIVREN-QFBILLFUSA-N	0	3	348.462	3.402	20	30		EGEDHN
C#CCCCC(=O)N1CCCC[C@@H]1CN(C)Cc1cccc(OC)c1	ZINC001157884550	1381059471	/nfs/dbraw/zinc/05/94/71/1381059471.db2.gz	AJBUAZWWYKZVSH-LJQANCHMSA-N	0	3	342.483	3.312	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1sc(C2CC2)nc1C	ZINC001157950923	1381079731	/nfs/dbraw/zinc/07/97/31/1381079731.db2.gz	KUJMUVMPEYGADH-OAHLLOKOSA-N	0	3	333.501	3.441	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)C[C@@H](OCC)C1=CCCC1	ZINC001157965128	1381083832	/nfs/dbraw/zinc/08/38/32/1381083832.db2.gz	OXBPHNXTYQFDCN-RTBURBONSA-N	0	3	334.504	3.391	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1nsc2ccccc21	ZINC001157994839	1381096298	/nfs/dbraw/zinc/09/62/98/1381096298.db2.gz	WGEXWPPQCGHQRJ-CQSZACIVSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)CCc1cccc(OC)c1F	ZINC001158029116	1381107444	/nfs/dbraw/zinc/10/74/44/1381107444.db2.gz	FLNAOMYADYGIPY-QGZVFWFLSA-N	0	3	348.462	3.266	20	30		EGEDHN
C=C(Cl)Cn1c(C(C)C)nnc1N1C[C@H](C)N(CC)C[C@H]1C	ZINC001286620522	1381122048	/nfs/dbraw/zinc/12/20/48/1381122048.db2.gz	NOCVJAHTRSWYNI-UONOGXRCSA-N	0	3	325.888	3.073	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H]1COc2ccc(Cl)cc21	ZINC001158221174	1381163754	/nfs/dbraw/zinc/16/37/54/1381163754.db2.gz	LJDFICDALLQQKS-WBVHZDCISA-N	0	3	348.874	3.315	20	30		EGEDHN
Cc1c(F)ccc2nc(Cl)c(C#N)c(-n3ccc([C@H](C)N)n3)c12	ZINC001158355595	1381214457	/nfs/dbraw/zinc/21/44/57/1381214457.db2.gz	BGPRCEMMMQKALK-VIFPVBQESA-N	0	3	329.766	3.413	20	30		EGEDHN
C[C@@H]1CCC[C@@H]1CC(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001158620018	1381324881	/nfs/dbraw/zinc/32/48/81/1381324881.db2.gz	ZGPVYPKGENWIOR-GDBMZVCRSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H](CC)Oc1ccccc1F	ZINC001158758432	1381385608	/nfs/dbraw/zinc/38/56/08/1381385608.db2.gz	OCODRMCKLXGNEB-AEFFLSMTSA-N	0	3	348.462	3.482	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1Cc2ccc(Cl)cc21	ZINC001158811954	1381412571	/nfs/dbraw/zinc/41/25/71/1381412571.db2.gz	VOHXBVKCADKNOK-SJLPKXTDSA-N	0	3	332.875	3.479	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NCCCNCc1nc(C)c(C)s1	ZINC001158844406	1381428988	/nfs/dbraw/zinc/42/89/88/1381428988.db2.gz	HQKWOEVVDIOAAZ-UHFFFAOYSA-N	0	3	329.897	3.135	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NCCCNCc1ccc(F)cc1F	ZINC001158857900	1381437803	/nfs/dbraw/zinc/43/78/03/1381437803.db2.gz	XOXYCTRSXDPAHS-UHFFFAOYSA-N	0	3	330.806	3.339	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)Cc1nsc2ccccc12	ZINC001158914968	1381462403	/nfs/dbraw/zinc/46/24/03/1381462403.db2.gz	XGZRWDRCOXHODL-OAHLLOKOSA-N	0	3	343.496	3.338	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1	ZINC001158942277	1381475539	/nfs/dbraw/zinc/47/55/39/1381475539.db2.gz	GBJSLKUOTNALCT-CEXWTWQISA-N	0	3	330.447	3.428	20	30		EGEDHN
N#Cc1cc(Nc2c([O-])cccc2Br)cc(C2C[NH2+]C2)c1	ZINC001159548364	1381825086	/nfs/dbraw/zinc/82/50/86/1381825086.db2.gz	JCDVKEPVPUZTGM-UHFFFAOYSA-N	0	3	344.212	3.457	20	30		EGEDHN
Cc1cc(CN2CC=C(CCNC(=O)C#CC(C)C)CC2)cs1	ZINC001160054682	1381983306	/nfs/dbraw/zinc/98/33/06/1381983306.db2.gz	GZIFVDUTUXHEKW-UHFFFAOYSA-N	0	3	330.497	3.354	20	30		EGEDHN
Cc1ccncc1CN1CC=C(CCNC(=O)C#CC(C)(C)C)CC1	ZINC001160084026	1381992678	/nfs/dbraw/zinc/99/26/78/1381992678.db2.gz	FDALWHDKKUZQJD-UHFFFAOYSA-N	0	3	339.483	3.078	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C[C@@H](OCC)C2=CCCC2)CC1	ZINC001160131474	1382008341	/nfs/dbraw/zinc/00/83/41/1382008341.db2.gz	NBGQBKRFJYNFRH-HXUWFJFHSA-N	0	3	344.499	3.054	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cn(C)c3ccc(F)cc23)CC1	ZINC001160367430	1382084463	/nfs/dbraw/zinc/08/44/63/1382084463.db2.gz	LCZUYMNGWLVCPG-UHFFFAOYSA-N	0	3	341.430	3.255	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C[C@@H](C)c2c(C)noc2C)CC1	ZINC001160518180	1382129839	/nfs/dbraw/zinc/12/98/39/1382129839.db2.gz	ILGJQFXBDKRGRK-CQSZACIVSA-N	0	3	331.460	3.109	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cccc([C@@H]3CCOC3)c2)CC1	ZINC001160551269	1382139522	/nfs/dbraw/zinc/13/95/22/1382139522.db2.gz	IALOBRPHYGXMAR-HXUWFJFHSA-N	0	3	340.467	3.129	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc(F)cc3ccoc32)CC1	ZINC001160552703	1382140258	/nfs/dbraw/zinc/14/02/58/1382140258.db2.gz	XRJDLDNPCOBKBP-UHFFFAOYSA-N	0	3	340.398	3.347	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)Cn2c(C)cc3ccccc32)CC1	ZINC001160629019	1382156448	/nfs/dbraw/zinc/15/64/48/1382156448.db2.gz	XLLUOXRULFVOSI-UHFFFAOYSA-N	0	3	349.478	3.111	20	30		EGEDHN
N#C[C@H]1CCCN(C(=O)C[C@@H](N)c2ccc(Cl)cc2Cl)C1	ZINC001160642452	1382159223	/nfs/dbraw/zinc/15/92/23/1382159223.db2.gz	IROBAYDJSFRJCA-QMTHXVAHSA-N	0	3	326.227	3.145	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@H]2[C@H](C=C(C)C)C2(C)C)CC1	ZINC001160646610	1382160574	/nfs/dbraw/zinc/16/05/74/1382160574.db2.gz	STRNGYSGJHQBKU-RBUKOAKNSA-N	0	3	328.500	3.387	20	30		EGEDHN
N#CCN(Cc1ccccc1)C(=O)[C@H]1CCC[C@@H](c2ccccc2)N1	ZINC001160670019	1382166342	/nfs/dbraw/zinc/16/63/42/1382166342.db2.gz	PWZMBQOXNVTWEA-VQTJNVASSA-N	0	3	333.435	3.422	20	30		EGEDHN
C=CCN1CCC[C@H]1CNc1nc(Cl)cc(-c2ccncc2)n1	ZINC001160957153	1382251280	/nfs/dbraw/zinc/25/12/80/1382251280.db2.gz	GOCQTBJJTFXHFS-AWEZNQCLSA-N	0	3	329.835	3.254	20	30		EGEDHN
C=CCN1CCC[C@H]1CNc1nc(-c2cccnc2)nc2c1CCC2	ZINC001160957579	1382251407	/nfs/dbraw/zinc/25/14/07/1382251407.db2.gz	NSQQSIDUPQIPJD-INIZCTEOSA-N	0	3	335.455	3.090	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCCC1=CCN(CCOCC2CC2)CC1	ZINC001160991543	1382264923	/nfs/dbraw/zinc/26/49/23/1382264923.db2.gz	PQLPUSWIOFUDSW-QGZVFWFLSA-N	0	3	334.504	3.154	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)Cc2c(C)cc(C)cc2C)CC1	ZINC001161084499	1382293948	/nfs/dbraw/zinc/29/39/48/1382293948.db2.gz	NKMJKNXPGUWSNS-UHFFFAOYSA-N	0	3	326.484	3.479	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H](C)Cc2ccccc2F)CC1	ZINC001161200922	1382339770	/nfs/dbraw/zinc/33/97/70/1382339770.db2.gz	YDQKBVNYMDQMPJ-INIZCTEOSA-N	0	3	330.447	3.329	20	30		EGEDHN
CCCC[C@](C)(F)C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001161290507	1382362109	/nfs/dbraw/zinc/36/21/09/1382362109.db2.gz	YCVIURYOXFBUSU-SFHVURJKSA-N	0	3	337.414	3.212	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@]2(C)C[C@@H]2c2ccccc2)CC1	ZINC001161446445	1382413914	/nfs/dbraw/zinc/41/39/14/1382413914.db2.gz	YSQRAMCLDIMIPJ-IRLDBZIGSA-N	0	3	336.479	3.342	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2sc(CC3CC3)nc2C)CC1	ZINC001161566286	1382441528	/nfs/dbraw/zinc/44/15/28/1382441528.db2.gz	IWZMUYVCGJVVMR-UHFFFAOYSA-N	0	3	345.512	3.342	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2c[nH]nc2C2CCCCC2)CC1	ZINC001161674231	1382476582	/nfs/dbraw/zinc/47/65/82/1382476582.db2.gz	HYFGFTJHPYZMRJ-UHFFFAOYSA-N	0	3	342.487	3.395	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H](CC)Oc2ccccc2F)CC1	ZINC001161699572	1382484342	/nfs/dbraw/zinc/48/43/42/1382484342.db2.gz	VFBGFKZQURCCBG-SFHVURJKSA-N	0	3	346.446	3.308	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C2(c3cccc(C)c3)CC2)CC1	ZINC001161946832	1382566114	/nfs/dbraw/zinc/56/61/14/1382566114.db2.gz	HCQUWHXECMSLMH-UHFFFAOYSA-N	0	3	336.479	3.188	20	30		EGEDHN
Cc1[nH]c2ccccc2c1C(=O)NCCCNCc1ccccc1C#N	ZINC001162103749	1382630145	/nfs/dbraw/zinc/63/01/45/1382630145.db2.gz	MKUNWYZZQMTKPG-UHFFFAOYSA-N	0	3	346.434	3.258	20	30		EGEDHN
C#CCN1CCC(CNC(=O)CCCC[C@@H](C)CC)(COC)CC1	ZINC001162282947	1382720661	/nfs/dbraw/zinc/72/06/61/1382720661.db2.gz	BGBXTHSZAQBAIB-SFHVURJKSA-N	0	3	336.520	3.071	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)CCCCC(C)C)(COC)CC1	ZINC001162539260	1382783929	/nfs/dbraw/zinc/78/39/29/1382783929.db2.gz	PBYNDPUPSJJLLQ-UHFFFAOYSA-N	0	3	336.520	3.071	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)c1sccc1C	ZINC001162666575	1382827130	/nfs/dbraw/zinc/82/71/30/1382827130.db2.gz	QTOAUZSPKPMUOL-UHFFFAOYSA-N	0	3	340.492	3.354	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)c1cccc(C)c1	ZINC001162678032	1382830546	/nfs/dbraw/zinc/83/05/46/1382830546.db2.gz	FWOBPQLKZCOPLV-UHFFFAOYSA-N	0	3	334.463	3.293	20	30		EGEDHN
C[C@@H](N)c1nc2ccccc2n1-c1cc(C#N)cc(C(F)(F)F)n1	ZINC001162758699	1382860948	/nfs/dbraw/zinc/86/09/48/1382860948.db2.gz	KROMXMGTEFKSQB-SECBINFHSA-N	0	3	331.301	3.331	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)CCC1CCC1	ZINC001162764191	1382863575	/nfs/dbraw/zinc/86/35/75/1382863575.db2.gz	PTOYDCVCCFGENX-UHFFFAOYSA-N	0	3	326.484	3.251	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CCC[C@H](F)C1	ZINC001162807164	1382879412	/nfs/dbraw/zinc/87/94/12/1382879412.db2.gz	ZCJMQDBCJREFTO-PMACEKPBSA-N	0	3	344.474	3.199	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CCC=CCCC1	ZINC001162840924	1382891093	/nfs/dbraw/zinc/89/10/93/1382891093.db2.gz	IOAMZVROHRTHHG-NRFANRHFSA-N	0	3	338.495	3.417	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1cc(C)sc1C	ZINC001162856641	1382896274	/nfs/dbraw/zinc/89/62/74/1382896274.db2.gz	KUEVXCYGYBLTAS-UHFFFAOYSA-N	0	3	340.492	3.273	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CCCCC1(F)F	ZINC001162876791	1382902051	/nfs/dbraw/zinc/90/20/51/1382902051.db2.gz	LNQSZQWCARGVJO-SFHVURJKSA-N	0	3	348.437	3.106	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C(C)(C)CCC	ZINC001162911424	1382914187	/nfs/dbraw/zinc/91/41/87/1382914187.db2.gz	MRUGSMHOHUHJEU-UHFFFAOYSA-N	0	3	328.500	3.497	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CC[C@@H](C)C1	ZINC001162952496	1382925597	/nfs/dbraw/zinc/92/55/97/1382925597.db2.gz	RBBRAOOJRJOPAN-UYAOXDASSA-N	0	3	326.484	3.107	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@H](C)CC(C)C	ZINC001162970725	1382932078	/nfs/dbraw/zinc/93/20/78/1382932078.db2.gz	IUBUFDAPWYUBFV-LJQANCHMSA-N	0	3	328.500	3.353	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCc1ccc(CN2CCN(CC)CC2)cc1	ZINC001163024231	1382950309	/nfs/dbraw/zinc/95/03/09/1382950309.db2.gz	FQUAJAGLKDZZCU-GOSISDBHSA-N	0	3	343.515	3.043	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCc1ccc(CN2CCN(CC)CC2)cc1	ZINC001163024287	1382950416	/nfs/dbraw/zinc/95/04/16/1382950416.db2.gz	IUESLUBGDTUOHU-UHFFFAOYSA-N	0	3	343.515	3.043	20	30		EGEDHN
CC(=O)C=C(C)Nc1ccc(CN2CCN(C(C)C)CC2)cc1F	ZINC001163742791	1383116985	/nfs/dbraw/zinc/11/69/85/1383116985.db2.gz	SPKMTPJLTSDVLG-PTNGSMBKSA-N	0	3	333.451	3.256	20	30		EGEDHN
N#Cc1cc(N2CCCN(Cc3ccncc3)CC2)nc2ccccc12	ZINC001163828411	1383126444	/nfs/dbraw/zinc/12/64/44/1383126444.db2.gz	JPNMOHVLIFRYTF-UHFFFAOYSA-N	0	3	343.434	3.214	20	30		EGEDHN
CC(C)(C)C(C)(C)C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001163977867	1383142754	/nfs/dbraw/zinc/14/27/54/1383142754.db2.gz	VNJOCJVXTGLDDA-UHFFFAOYSA-N	0	3	333.451	3.366	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCCNCc1cccc(OC)c1Cl	ZINC001164221948	1383167645	/nfs/dbraw/zinc/16/76/45/1383167645.db2.gz	GXMMTVYTUOEEMT-UONOGXRCSA-N	0	3	338.879	3.403	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C(C)(C)[C@@H]2CCCCO2)CC1	ZINC001164561590	1383199268	/nfs/dbraw/zinc/19/92/68/1383199268.db2.gz	RPHUAUKVOXUJMI-HNNXBMFYSA-N	0	3	342.911	3.210	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C[C@H]2Cc3ccccc3O2)CC1	ZINC001164669064	1383216269	/nfs/dbraw/zinc/21/62/69/1383216269.db2.gz	GEOAATPHGHDSRS-MRXNPFEDSA-N	0	3	348.874	3.009	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NCCC1(CNCc2conc2C)CC1	ZINC001164691814	1383218119	/nfs/dbraw/zinc/21/81/19/1383218119.db2.gz	ASOOELNARFYICU-UHFFFAOYSA-N	0	3	339.867	3.138	20	30		EGEDHN
CCN1CCC(N(C)C(F)(F)c2cc(C#N)cc(Cl)n2)CC1	ZINC001165068682	1383221611	/nfs/dbraw/zinc/22/16/11/1383221611.db2.gz	UYKQWJQYUPCDSK-UHFFFAOYSA-N	0	3	328.794	3.072	20	30		EGEDHN
N#Cc1cc(Cl)nc(C(F)(F)N2CCN[C@@H](c3ccccc3)C2)c1	ZINC001165195641	1383245048	/nfs/dbraw/zinc/24/50/48/1383245048.db2.gz	UKZMJCKYOQTCEX-CQSZACIVSA-N	0	3	348.784	3.302	20	30		EGEDHN
C=C(C)CCC(=O)NCCC1(CNCc2c(C)onc2CC)CC1	ZINC001165258559	1383259025	/nfs/dbraw/zinc/25/90/25/1383259025.db2.gz	FIQVIIMDCXSXSM-UHFFFAOYSA-N	0	3	333.476	3.278	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1ccc(F)c(Cl)c1	ZINC001165461817	1383299027	/nfs/dbraw/zinc/29/90/27/1383299027.db2.gz	VWRYKCOHXGKNDN-UHFFFAOYSA-N	0	3	345.805	3.260	20	30		EGEDHN
Cc1ccc(C(=O)NCCCNCc2ccccc2C#N)cc1Cl	ZINC001165755774	1383339397	/nfs/dbraw/zinc/33/93/97/1383339397.db2.gz	VLHBZDBEHGCTKP-UHFFFAOYSA-N	0	3	341.842	3.430	20	30		EGEDHN
C=C1CCC(C(=O)NCCCNCc2oc(C(C)C)nc2C)CC1	ZINC001165907195	1383363527	/nfs/dbraw/zinc/36/35/27/1383363527.db2.gz	VHOAHYROLIBWHA-UHFFFAOYSA-N	0	3	333.476	3.449	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCCNCc1ccn(C2CCCC2)n1	ZINC001165921795	1383365316	/nfs/dbraw/zinc/36/53/16/1383365316.db2.gz	SDBFPLNTIBCXFG-LJQANCHMSA-N	0	3	332.492	3.196	20	30		EGEDHN
C[C@@H](C(=O)NCCCNCc1cc(C#N)ccc1F)c1ccsc1	ZINC001166497779	1383429831	/nfs/dbraw/zinc/42/98/31/1383429831.db2.gz	RMBSCVYZNIOXMX-CYBMUJFWSA-N	0	3	345.443	3.158	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCC1(CNCc2oc(C)nc2C)CC1	ZINC001166694299	1383462097	/nfs/dbraw/zinc/46/20/97/1383462097.db2.gz	MYOCCOVDCOXDCN-ZIAGYGMSSA-N	0	3	333.476	3.126	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCCC1(CNCc2oc(C)nc2C)CC1	ZINC001166764998	1383473989	/nfs/dbraw/zinc/47/39/89/1383473989.db2.gz	DUJSNOVDMJPUHR-INIZCTEOSA-N	0	3	333.476	3.270	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc(OC)cc2C)CC1	ZINC001166945499	1383503346	/nfs/dbraw/zinc/50/33/46/1383503346.db2.gz	AULFCLUDLSYSHJ-UHFFFAOYSA-N	0	3	336.863	3.246	20	30		EGEDHN
CC1(C(=O)NCCC2(CNCc3ccccc3C#N)CC2)CC=CC1	ZINC001166995483	1383512996	/nfs/dbraw/zinc/51/29/96/1383512996.db2.gz	XOTHOCIDZGQPPR-UHFFFAOYSA-N	0	3	337.467	3.291	20	30		EGEDHN
N#Cc1ccccc1CNCC1(CCNC(=O)C2CC3(CC3)C2)CC1	ZINC001167158140	1383555003	/nfs/dbraw/zinc/55/50/03/1383555003.db2.gz	CGSDHBYSKUWRHT-UHFFFAOYSA-N	0	3	337.467	3.125	20	30		EGEDHN
Cc1cc(F)cc(C(=O)NCCCNCc2ccc(C#N)cc2F)c1	ZINC001167260518	1383577988	/nfs/dbraw/zinc/57/79/88/1383577988.db2.gz	WHMWQHDJBGKFOC-UHFFFAOYSA-N	0	3	343.377	3.055	20	30		EGEDHN
CN(C)/C=N/c1ccc(NCC2(c3ccccc3)COC2)cc1C#N	ZINC001167297683	1383588888	/nfs/dbraw/zinc/58/88/88/1383588888.db2.gz	KRZGMOJMVIRXSY-HZHRSRAPSA-N	0	3	334.423	3.160	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)[C@@H](C)C(C)C)CC1	ZINC001167374194	1383614351	/nfs/dbraw/zinc/61/43/51/1383614351.db2.gz	TXRQNYHZKOAXMD-ZDUSSCGKSA-N	0	3	331.298	3.063	20	30		EGEDHN
CCC[C@@H](C(=O)NCCCNCc1cc(C#N)ccc1F)C(C)C	ZINC001167471557	1383643473	/nfs/dbraw/zinc/64/34/73/1383643473.db2.gz	JSRKNHTXICFURG-QGZVFWFLSA-N	0	3	333.451	3.366	20	30		EGEDHN
C=CC1(CC(=O)NCCCNCc2ccc(F)cn2)CCCCC1	ZINC001168182314	1383836463	/nfs/dbraw/zinc/83/64/63/1383836463.db2.gz	BORYRHJYKPEYEK-UHFFFAOYSA-N	0	3	333.451	3.343	20	30		EGEDHN
C=CCC1(C(=O)NCCC2(CNCc3conc3C)CC2)CCCC1	ZINC001168590628	1383943622	/nfs/dbraw/zinc/94/36/22/1383943622.db2.gz	WTJHXLUEYDDTEB-UHFFFAOYSA-N	0	3	345.487	3.496	20	30		EGEDHN
C[C@H]1C[C@H](NCc2ccc(C#N)c(F)c2)CN1C(=O)OC(C)(C)C	ZINC001168821599	1384019106	/nfs/dbraw/zinc/01/91/06/1384019106.db2.gz	FBBJXRGWECBKLM-WFASDCNBSA-N	0	3	333.407	3.185	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)c1ccco1	ZINC001168830026	1384023441	/nfs/dbraw/zinc/02/34/41/1384023441.db2.gz	BZCMAHTXHCUIPZ-HNNXBMFYSA-N	0	3	325.412	3.230	20	30		EGEDHN
C[C@@H]1C[C@@H](N(C)Cc2cccc(C#N)c2)CN1C(=O)OC(C)(C)C	ZINC001168886474	1384047055	/nfs/dbraw/zinc/04/70/55/1384047055.db2.gz	YODCNYLPSXKABY-RHSMWYFYSA-N	0	3	329.444	3.388	20	30		EGEDHN
CCOCCCC(=O)N[C@H](C)CCCCNCc1ccccc1C#N	ZINC001169331066	1384137069	/nfs/dbraw/zinc/13/70/69/1384137069.db2.gz	CKQUHAJSFGWDNU-QGZVFWFLSA-N	0	3	345.487	3.140	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)[C@H](C)C1CC1	ZINC001170018291	1384219319	/nfs/dbraw/zinc/21/93/19/1384219319.db2.gz	IQVINCHPEPBLTG-HZPDHXFCSA-N	0	3	327.472	3.369	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)[C@@H]1CC1(C)C	ZINC001170221302	1384268900	/nfs/dbraw/zinc/26/89/00/1384268900.db2.gz	IZVHNWQUBGLFTF-YJBOKZPZSA-N	0	3	327.472	3.369	20	30		EGEDHN
C[C@@H](CCCCNC/C(Cl)=C\Cl)NC(=O)c1c[nH]c(C#N)c1	ZINC001170283744	1384282515	/nfs/dbraw/zinc/28/25/15/1384282515.db2.gz	YDNJQVXZQCTOTN-DELQEKLWSA-N	0	3	343.258	3.084	20	30		EGEDHN
CC[C@@H](Cc1ccc2c(c1)OCO2)NC(=N)c1ccc(Cl)cn1	ZINC001170409088	1384310163	/nfs/dbraw/zinc/31/01/63/1384310163.db2.gz	XTHPDBUJGMXMSA-ZDUSSCGKSA-N	0	3	331.803	3.190	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)[C@H]1C[C@@H]1C(F)F	ZINC001170531825	1384336635	/nfs/dbraw/zinc/33/66/35/1384336635.db2.gz	RNBYEMOHLOYODU-COXVUDFISA-N	0	3	349.425	3.224	20	30		EGEDHN
CN(C)/C=N/c1ccc(N[C@H]2CCc3ccc(O)cc3C2)cc1C#N	ZINC001171033414	1384433663	/nfs/dbraw/zinc/43/36/63/1384433663.db2.gz	STRCWVTZMOXGGM-KOWBDXASSA-N	0	3	334.423	3.455	20	30		EGEDHN
C=CCOC(=O)[C@@H](N)CCCCNc1ncc(C)c2ccccc12	ZINC001171067573	1384440674	/nfs/dbraw/zinc/44/06/74/1384440674.db2.gz	KOVQCEUPXOXBJM-KRWDZBQOSA-N	0	3	327.428	3.182	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)Cc2cccc(C)c2Cl)C1	ZINC001316619036	1384484844	/nfs/dbraw/zinc/48/48/44/1384484844.db2.gz	YJFXBGKCHYIETM-OTVXOJSOSA-N	0	3	341.282	3.428	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1cnc(C)s1	ZINC001316874817	1384659889	/nfs/dbraw/zinc/65/98/89/1384659889.db2.gz	UJSOYQFVUQAOFY-WCQYABFASA-N	0	3	327.881	3.177	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1cccc(CC)n1	ZINC001316878731	1384663172	/nfs/dbraw/zinc/66/31/72/1384663172.db2.gz	WFONRLYBAQXUTF-WMLDXEAASA-N	0	3	335.879	3.369	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)N1CC2(CN(Cc3ccccc3)C2)C1	ZINC001172318709	1384768752	/nfs/dbraw/zinc/76/87/52/1384768752.db2.gz	HXCNCSCLHKCASY-GOSISDBHSA-N	0	3	331.463	3.307	20	30		EGEDHN
C[C@@H](CCCC#N)N1CCO[C@@]2(CCCN(c3ccccc3)C2)C1	ZINC001172494655	1384803778	/nfs/dbraw/zinc/80/37/78/1384803778.db2.gz	IKQHBRYYZPNCGV-ICSRJNTNSA-N	0	3	327.472	3.440	20	30		EGEDHN
C[C@H](CCCC#N)N1CCO[C@@H]2C[C@H](COc3ccccn3)C[C@@H]21	ZINC001172500441	1384806372	/nfs/dbraw/zinc/80/63/72/1384806372.db2.gz	ZKZGSWAKVFLBHR-ZJPYXAASSA-N	0	3	329.444	3.022	20	30		EGEDHN
CC[C@H](C)CCC(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001317090691	1384852524	/nfs/dbraw/zinc/85/25/24/1384852524.db2.gz	TWHUUGOHRMEBQY-JQFCIGGWSA-N	0	3	331.435	3.260	20	30		EGEDHN
N=C(N[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccc(Cl)cn1	ZINC001172900848	1384874129	/nfs/dbraw/zinc/87/41/29/1384874129.db2.gz	GPWVSIYGSYHKHB-AWEZNQCLSA-N	0	3	344.802	3.296	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H](N2CCC[C@@H](C(F)F)C2)C[C@H]1C#N	ZINC001172983844	1384895518	/nfs/dbraw/zinc/89/55/18/1384895518.db2.gz	HOOOVVXQNHYJOL-MCIONIFRSA-N	0	3	343.418	3.255	20	30		EGEDHN
C=CCOC[C@@H]1CCC[C@@]12CN([C@H]1CCc3ncsc3C1)CCO2	ZINC001173137148	1384921615	/nfs/dbraw/zinc/92/16/15/1384921615.db2.gz	JDCSHBCLGILLJK-TXPKVOOTSA-N	0	3	348.512	3.074	20	30		EGEDHN
C=CCOC1CCC(NCc2cccnc2Br)CC1	ZINC001173316335	1384956869	/nfs/dbraw/zinc/95/68/69/1384956869.db2.gz	GSXQMAWNVKULTA-UHFFFAOYSA-N	0	3	325.250	3.448	20	30		EGEDHN
C=CCCCC(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)s1	ZINC001317193918	1384968631	/nfs/dbraw/zinc/96/86/31/1384968631.db2.gz	CXLZJXTVGRTTOY-OAHLLOKOSA-N	0	3	331.485	3.447	20	30		EGEDHN
C[C@H]([NH2+]C1CCN(C(=O)c2ccc(C#N)cc2)CC1)c1ccccc1[O-]	ZINC001173425947	1384969264	/nfs/dbraw/zinc/96/92/64/1384969264.db2.gz	LJQPKGUOZHAAOT-HNNXBMFYSA-N	0	3	349.434	3.219	20	30		EGEDHN
CC1(C#N)CCC(N2CCN(Cc3ccc4c(c3)OCO4)CC2)CC1	ZINC001173592178	1384983152	/nfs/dbraw/zinc/98/31/52/1384983152.db2.gz	JFSCLWPLBQWQLH-UHFFFAOYSA-N	0	3	341.455	3.005	20	30		EGEDHN
C[C@H](NC(=O)C1(C)CCC1)[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001317211301	1384991216	/nfs/dbraw/zinc/99/12/16/1384991216.db2.gz	XYUIZVMQHRRAFX-QFBILLFUSA-N	0	3	339.483	3.465	20	30		EGEDHN
Cc1ccccc1CCC(=O)NC[C@H](C)NCc1ccc(C#N)s1	ZINC001317271027	1385041208	/nfs/dbraw/zinc/04/12/08/1385041208.db2.gz	LLEKYQICZWMCDU-HNNXBMFYSA-N	0	3	341.480	3.155	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1c(C)nn(C(C)(C)C)c1C	ZINC001317394105	1385112285	/nfs/dbraw/zinc/11/22/85/1385112285.db2.gz	FWNMGHBFWGQCKF-LBPRGKRZSA-N	0	3	340.899	3.105	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1ccc2c(c1)C(C)(C)CO2	ZINC001317401901	1385116367	/nfs/dbraw/zinc/11/63/67/1385116367.db2.gz	YTXPADPCQZRPMM-ZDUSSCGKSA-N	0	3	336.863	3.207	20	30		EGEDHN
Cc1cc(C)cc(C(=O)NCCCNCc2ccc(C#N)cc2F)c1	ZINC001174561439	1385119813	/nfs/dbraw/zinc/11/98/13/1385119813.db2.gz	CXWZMYVQVLPGEQ-UHFFFAOYSA-N	0	3	339.414	3.224	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H](C)CCCCNCc1cc2n(n1)CCC2	ZINC001174849727	1385159596	/nfs/dbraw/zinc/15/95/96/1385159596.db2.gz	PNDKAKKQWXNWJN-SJORKVTESA-N	0	3	346.519	3.196	20	30		EGEDHN
CN1CCN(c2ccc(Nc3c(F)cc(O)cc3F)cc2C#N)CC1	ZINC001175100339	1385194739	/nfs/dbraw/zinc/19/47/39/1385194739.db2.gz	PXKVTEZITVKMQR-UHFFFAOYSA-N	0	3	344.365	3.037	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N[C@@H](C)CCCCNCc1ccccc1C#N	ZINC001175351222	1385263056	/nfs/dbraw/zinc/26/30/56/1385263056.db2.gz	UTSKKWXEPYKFFM-FRQCXROJSA-N	0	3	327.472	3.369	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](C)CCCCNC/C(Cl)=C\Cl	ZINC001175365326	1385266770	/nfs/dbraw/zinc/26/67/70/1385266770.db2.gz	JHWIRCDJKBCARP-ZUOGSNBYSA-N	0	3	349.302	3.161	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N[C@H](C)CCCCNC/C(Cl)=C/Cl	ZINC001175365322	1385266889	/nfs/dbraw/zinc/26/68/89/1385266889.db2.gz	JHWIRCDJKBCARP-UAPILWALSA-N	0	3	349.302	3.161	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1cccc(COC(C)(C)C)c1C	ZINC001335957520	1388976139	/nfs/dbraw/zinc/97/61/39/1388976139.db2.gz	DGLOIXOPEUGDMW-UHFFFAOYSA-N	0	3	345.487	3.387	20	30		EGEDHN
Cc1occc1C(=O)NCC[C@@H]1CCN(Cc2ccc(C#N)s2)C1	ZINC001317775798	1385469450	/nfs/dbraw/zinc/46/94/50/1385469450.db2.gz	UYPMKDJKOIFCBZ-CQSZACIVSA-N	0	3	343.452	3.163	20	30		EGEDHN
N#Cc1cccc([C@H](O)CN2CCC[C@H]2COc2ccc(F)cc2)c1	ZINC001176531954	1385617681	/nfs/dbraw/zinc/61/76/81/1385617681.db2.gz	GDKAHZHZGZWLGE-AZUAARDMSA-N	0	3	340.398	3.274	20	30		EGEDHN
CC1=CC[C@](C)(C(=O)NCCCNCc2ccccc2C#N)CC1	ZINC001176751783	1385682418	/nfs/dbraw/zinc/68/24/18/1385682418.db2.gz	FYZTYDOQOWKKKW-FQEVSTJZSA-N	0	3	325.456	3.291	20	30		EGEDHN
C=C[C@H](CC(=O)NCCCNCc1ncc(C)s1)c1ccccc1	ZINC001176763120	1385688492	/nfs/dbraw/zinc/68/84/92/1385688492.db2.gz	RILFKMNRKIXKLB-MRXNPFEDSA-N	0	3	343.496	3.407	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)c1cocn1	ZINC001177249623	1385884016	/nfs/dbraw/zinc/88/40/16/1385884016.db2.gz	GCZDSPONTXIRNY-UHFFFAOYSA-N	0	3	325.840	3.039	20	30		EGEDHN
CCC[C@H](C)C(=O)N1CCC[C@@H]1CNCc1cc(C#N)ccc1OC	ZINC001319057519	1385948819	/nfs/dbraw/zinc/94/88/19/1385948819.db2.gz	KEQCUAOKBMJSDJ-MAUKXSAKSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N(CCCNCC(=C)Cl)CC1CCCC1	ZINC001177495791	1385979382	/nfs/dbraw/zinc/97/93/82/1385979382.db2.gz	GLGQAIXJQVQZLS-INIZCTEOSA-N	0	3	342.911	3.329	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC1(CNCc2ccc(Cl)cc2F)CCCC1	ZINC001698628068	1406270277	/nfs/dbraw/zinc/27/02/77/1406270277.db2.gz	PRFKAEYWKXZXMG-LBPRGKRZSA-N	0	3	337.826	3.157	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)NCCCCCCNCc1ccccc1C#N	ZINC001178222325	1386162880	/nfs/dbraw/zinc/16/28/80/1386162880.db2.gz	KVTZYJHWFJNJRW-GOSISDBHSA-N	0	3	327.472	3.371	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@H](N[C@H]2CCc3c2c(F)ccc3F)[C@@H]1C	ZINC001178649100	1386268684	/nfs/dbraw/zinc/26/86/84/1386268684.db2.gz	VPUDFXRDMVNNEW-KKXDTOCCSA-N	0	3	346.421	3.191	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](NCc2cccc(NC(C)=O)c2)[C@@H]1C	ZINC001178802649	1386309765	/nfs/dbraw/zinc/30/97/65/1386309765.db2.gz	RRKFAARKTVCVNE-KXBFYZLASA-N	0	3	343.471	3.080	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCCCCCNCc1cc2n(n1)CCC2	ZINC001179306813	1386445767	/nfs/dbraw/zinc/44/57/67/1386445767.db2.gz	MSIDTKDYICHZQS-IAGOWNOFSA-N	0	3	346.519	3.054	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H](NCc2cccc(Cl)n2)[C@@H]1C	ZINC001179364646	1386464299	/nfs/dbraw/zinc/46/42/99/1386464299.db2.gz	OMRWNWGIHPTYEL-YCPHGPKFSA-N	0	3	335.879	3.416	20	30		EGEDHN
CCCc1[nH]ccc1C(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C	ZINC001179374286	1386466643	/nfs/dbraw/zinc/46/66/43/1386466643.db2.gz	PVCUHQYSVDBALD-PXNSSMCTSA-N	0	3	349.478	3.212	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@H](NCc2ccc(C#N)s2)[C@@H]1C	ZINC001179384737	1386470229	/nfs/dbraw/zinc/47/02/29/1386470229.db2.gz	VMBCJWSADVYQPZ-VBQJREDUSA-N	0	3	331.485	3.301	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@H](NCc2cn(C(C)C)nc2C)[C@@H]1C	ZINC001179388939	1386472195	/nfs/dbraw/zinc/47/21/95/1386472195.db2.gz	UCXHFLOZIWCBLU-LNLFQRSKSA-N	0	3	346.519	3.454	20	30		EGEDHN
C=CCCCC(=O)NCCCCCCNCc1ncc(Cl)n1C	ZINC001179420805	1386480187	/nfs/dbraw/zinc/48/01/87/1386480187.db2.gz	DSEFAMMEPCAIKQ-UHFFFAOYSA-N	0	3	340.899	3.196	20	30		EGEDHN
C=CCCC1(C(=O)NCCCCCCNCc2cc(C)no2)CC1	ZINC001179482210	1386495154	/nfs/dbraw/zinc/49/51/54/1386495154.db2.gz	RNRGDDFGCOAQMH-UHFFFAOYSA-N	0	3	333.476	3.496	20	30		EGEDHN
Cc1nc(CON=Cc2ccc(N3CCOCC3)cc2)c(C)s1	ZINC001320120845	1386525984	/nfs/dbraw/zinc/52/59/84/1386525984.db2.gz	CJSVNYIBQRXLAF-UHFFFAOYSA-N	0	3	331.441	3.147	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCCCCCN[C@@H](C)c1nnc(CC)[nH]1	ZINC001179692582	1386555526	/nfs/dbraw/zinc/55/55/26/1386555526.db2.gz	LGZHHZBUWAWCJY-HNNXBMFYSA-N	0	3	349.523	3.297	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)[C@@H]1CC[C@@H](C)CC1	ZINC001179972647	1386654474	/nfs/dbraw/zinc/65/44/74/1386654474.db2.gz	VUBSHUHOJNEKPT-QIJZPMMNSA-N	0	3	338.495	3.443	20	30		EGEDHN
CCCC1(C(=O)N[C@H](C)CNCc2ccc(F)c(C#N)c2)CCC1	ZINC001321616571	1386941654	/nfs/dbraw/zinc/94/16/54/1386941654.db2.gz	AOGMSKCOAAHKMZ-CQSZACIVSA-N	0	3	331.435	3.262	20	30		EGEDHN
CC/C(C)=C\C(=O)N1C[C@@H](C)[C@](C)(CNCc2ccccc2C#N)C1	ZINC001181395399	1386987150	/nfs/dbraw/zinc/98/71/50/1386987150.db2.gz	NCVQSIRHFZLYOA-WXFYLKKQSA-N	0	3	339.483	3.489	20	30		EGEDHN
CCC[C@@H](C)CC(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001181501194	1387006334	/nfs/dbraw/zinc/00/63/34/1387006334.db2.gz	ITVJPMLHFWFNKA-RHSMWYFYSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2ocnc2C)C1	ZINC001181572896	1387018546	/nfs/dbraw/zinc/01/85/46/1387018546.db2.gz	FSBZKVUIQSAJLQ-FOIQADDNSA-N	0	3	345.487	3.326	20	30		EGEDHN
CCCc1ccc(CN(C)C[C@@H](C)NC(=O)c2cc(C#N)c[nH]2)cc1	ZINC001322137031	1387070820	/nfs/dbraw/zinc/07/08/20/1387070820.db2.gz	VUWBXGSLHHHWNO-OAHLLOKOSA-N	0	3	338.455	3.089	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)c1ccc(CF)cc1	ZINC001322307994	1387153418	/nfs/dbraw/zinc/15/34/18/1387153418.db2.gz	VBLUCZTUWMMIJE-OAHLLOKOSA-N	0	3	339.414	3.278	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2ncc(C)s2)C1	ZINC001182464855	1387170722	/nfs/dbraw/zinc/17/07/22/1387170722.db2.gz	BCOWIHJZFSXXLP-RDTXWAMCSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H](C)[C@](C)(CNCc2nccn2CC)C1	ZINC001182517715	1387181108	/nfs/dbraw/zinc/18/11/08/1387181108.db2.gz	VWQXMZYXBZMQIR-NSISKUIASA-N	0	3	346.519	3.080	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2oc(C)nc2C)C1	ZINC001182750074	1387218568	/nfs/dbraw/zinc/21/85/68/1387218568.db2.gz	JCJNCYIHHMHADR-JLTOFOAXSA-N	0	3	347.503	3.468	20	30		EGEDHN
C[C@H](CNC(=O)CCc1ccccc1)N(C)Cc1cccc(C#N)c1	ZINC001329599454	1389175018	/nfs/dbraw/zinc/17/50/18/1389175018.db2.gz	BZGVBPBOMJYCTD-QGZVFWFLSA-N	0	3	335.451	3.128	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CCC[C@@H]1CNCc1cc(C)ccc1F	ZINC001698727779	1406378705	/nfs/dbraw/zinc/37/87/05/1406378705.db2.gz	RGRPNRUFEKGELJ-FUHWJXTLSA-N	0	3	348.462	3.196	20	30		EGEDHN
Cc1ccc(C(=O)N(C)C[C@H](C)NCc2ccc(C#N)s2)cc1C	ZINC001331627699	1389834783	/nfs/dbraw/zinc/83/47/83/1389834783.db2.gz	KUNRZLKSSHVMQR-HNNXBMFYSA-N	0	3	341.480	3.487	20	30		EGEDHN
C#CC[C@H](CCOC)NCc1nc2cc(C(F)(F)F)ccc2n1C	ZINC001331676717	1389853349	/nfs/dbraw/zinc/85/33/49/1389853349.db2.gz	QZNSODYRBLCGQS-CYBMUJFWSA-N	0	3	339.361	3.110	20	30		EGEDHN
N#Cc1cc(Cl)ncc1NC(=O)C(C[C@H]1CCCO1)C(F)(F)F	ZINC001339028580	1389866152	/nfs/dbraw/zinc/86/61/52/1389866152.db2.gz	PXCPZZQKZWZORS-ZJUUUORDSA-N	0	3	347.724	3.293	20	30		EGEDHN
C=CCN(CC=C)C(=O)c1ccc(NC(=O)[C@H](N)C[C@@H](C)CC)cc1	ZINC001339858877	1390177119	/nfs/dbraw/zinc/17/71/19/1390177119.db2.gz	VIVHRDOQBDKUMN-MAUKXSAKSA-N	0	3	343.471	3.203	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N[C@H](c1c(F)cccc1F)C(F)(F)F	ZINC001340428014	1390287305	/nfs/dbraw/zinc/28/73/05/1390287305.db2.gz	FCZBKDNONZRHAW-DGCLKSJQSA-N	0	3	336.304	3.368	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccc(C(=O)N2CCC(C)CC2)cc1	ZINC001340619579	1390329934	/nfs/dbraw/zinc/32/99/34/1390329934.db2.gz	AMDKJOXKDADFNS-GOSISDBHSA-N	0	3	343.471	3.181	20	30		EGEDHN
CCCc1c(C(=O)C(C#N)c2nccn2C)cnn1-c1cccc(C)c1	ZINC001342268739	1390593860	/nfs/dbraw/zinc/59/38/60/1390593860.db2.gz	QGIAFFYIMLOLCQ-MRXNPFEDSA-N	0	3	347.422	3.357	20	30		EGEDHN
CCN1C[C@H](C)N(c2nnc([C@@H](C)CCC#N)n2CC(C)C)C[C@@H]1C	ZINC001344342996	1390784841	/nfs/dbraw/zinc/78/48/41/1390784841.db2.gz	OKHWINPOAQQFJV-ULQDDVLXSA-N	0	3	346.523	3.260	20	30		EGEDHN
CCc1c(C(=O)C(C#N)c2nccn2CC)cnn1CCC(C)C	ZINC001345646100	1390871821	/nfs/dbraw/zinc/87/18/21/1390871821.db2.gz	FHMRYEFSCDINRT-CQSZACIVSA-N	0	3	327.432	3.198	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCCOc1cccc(C(C)=O)c1	ZINC001347337013	1391056961	/nfs/dbraw/zinc/05/69/61/1391056961.db2.gz	BJIMOSBIRLKFFT-KRWDZBQOSA-N	0	3	339.395	3.141	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@H](OCC)c2ccccc2)C1	ZINC001479346194	1392221462	/nfs/dbraw/zinc/22/14/62/1392221462.db2.gz	MADZPXLSJDTEJO-HYVNUMGLSA-N	0	3	336.863	3.001	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)COC1CCCCC1	ZINC001479825073	1392413515	/nfs/dbraw/zinc/41/35/15/1392413515.db2.gz	JIQWKJAUZRLSHE-NVXWUHKLSA-N	0	3	342.911	3.447	20	30		EGEDHN
CCCC1(C(=O)NC[C@H]2CCCN(Cc3ccc(C#N)cc3)C2)CC1	ZINC001480263533	1392647878	/nfs/dbraw/zinc/64/78/78/1392647878.db2.gz	UDZRRFJVJNPYIR-LJQANCHMSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)c1ccoc1C1CC1	ZINC001480788897	1392933953	/nfs/dbraw/zinc/93/39/53/1392933953.db2.gz	XDVWNTCQQBQREF-LLVKDONJSA-N	0	3	341.249	3.164	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)COc2ccc(C(C)C)cc2)C1	ZINC001490910340	1394371496	/nfs/dbraw/zinc/37/14/96/1394371496.db2.gz	SYQSCXJXFFKGGY-WKILWMFISA-N	0	3	336.863	3.178	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2ncccc2C)CCCC[C@H]1C	ZINC001481957838	1394619478	/nfs/dbraw/zinc/61/94/78/1394619478.db2.gz	SFYYBTGJEUCAHX-KDOFPFPSSA-N	0	3	335.879	3.411	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)Cc2cccnc2)CCCC[C@H]1C	ZINC001481958219	1394619832	/nfs/dbraw/zinc/61/98/32/1394619832.db2.gz	UUZLFMSJBATGOG-KDOFPFPSSA-N	0	3	335.879	3.031	20	30		EGEDHN
CC(C)n1cccc1C(=O)NC[C@@H](C)CNCc1ccccc1C#N	ZINC001482170738	1394784737	/nfs/dbraw/zinc/78/47/37/1394784737.db2.gz	OAYMKJMIUHLKSL-INIZCTEOSA-N	0	3	338.455	3.096	20	30		EGEDHN
C=C(Cl)CNC[C@@H]1CCCN1C(=O)COc1cc(C)cc(C)c1	ZINC001483955549	1395161484	/nfs/dbraw/zinc/16/14/84/1395161484.db2.gz	KZIWQACNIMEHCG-INIZCTEOSA-N	0	3	336.863	3.015	20	30		EGEDHN
C[C@@]1(CNCc2ccccc2C#N)CCN(C(=O)C2CCCCC2)C1	ZINC001484076206	1395237234	/nfs/dbraw/zinc/23/72/34/1395237234.db2.gz	FUZZKAQCFXGTEY-NRFANRHFSA-N	0	3	339.483	3.467	20	30		EGEDHN
C[C@H](C#N)C(=O)N(C)CCN(C)Cc1ccc(-c2ccccc2)cc1	ZINC001698983131	1406762532	/nfs/dbraw/zinc/76/25/32/1406762532.db2.gz	GCUVKEZIVWXXPU-QGZVFWFLSA-N	0	3	335.451	3.403	20	30		EGEDHN
C[C@@H](C#N)C(=O)N(C)CCN(C)Cc1ccc(-c2ccccc2)cc1	ZINC001698983125	1406762753	/nfs/dbraw/zinc/76/27/53/1406762753.db2.gz	GCUVKEZIVWXXPU-KRWDZBQOSA-N	0	3	335.451	3.403	20	30		EGEDHN
Cc1ccoc1C(=O)N(C)CCCN(C)Cc1ccc(F)c(C#N)c1	ZINC001484733267	1395495890	/nfs/dbraw/zinc/49/58/90/1395495890.db2.gz	ZVQHBMQWWOEWAO-UHFFFAOYSA-N	0	3	343.402	3.193	20	30		EGEDHN
CCCC[C@H](CNCc1ccc(C#N)s1)NC(=O)CC(F)(F)F	ZINC001485461819	1395936772	/nfs/dbraw/zinc/93/67/72/1395936772.db2.gz	QZKASJAHJYCNOF-LLVKDONJSA-N	0	3	347.406	3.337	20	30		EGEDHN
COc1ccc(CN[C@H](C)CNC(=O)CCC2CCCC2)cc1C#N	ZINC001690549517	1404629955	/nfs/dbraw/zinc/62/99/55/1404629955.db2.gz	HBBICWNMNMWGRJ-OAHLLOKOSA-N	0	3	343.471	3.132	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)[C@H]1CC[C@H](C)CC1	ZINC001690874048	1404788716	/nfs/dbraw/zinc/78/87/16/1404788716.db2.gz	ANCHBMLKUVOCPH-MRVWCRGKSA-N	0	3	331.298	3.206	20	30		EGEDHN
CC[C@@H](C)CC(=O)NC[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001691494746	1405302286	/nfs/dbraw/zinc/30/22/86/1405302286.db2.gz	KHZWDUVNRHAWGD-FRFSOERESA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)Cc2ccc(C)cc2Cl)C1	ZINC001691713431	1405439837	/nfs/dbraw/zinc/43/98/37/1405439837.db2.gz	QEGCWOWHZKRVHP-OTVXOJSOSA-N	0	3	341.282	3.428	20	30		EGEDHN
CCC(C)(C)C(=O)NCC[C@@H]1CCN(Cc2ccc(F)c(C#N)c2)C1	ZINC001691905700	1405631040	/nfs/dbraw/zinc/63/10/40/1405631040.db2.gz	ZLWHNFINOYWQMC-OAHLLOKOSA-N	0	3	345.462	3.462	20	30		EGEDHN
Cc1cccc(C(=O)N[C@H](C)CNCc2ccc(C#N)s2)c1Cl	ZINC001699382418	1412692271	/nfs/dbraw/zinc/69/22/71/1412692271.db2.gz	SGVPYGHDLWIFPJ-GFCCVEGCSA-N	0	3	347.871	3.490	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)NC(=O)c1cc(Cl)cs1	ZINC001699397501	1412711876	/nfs/dbraw/zinc/71/18/76/1412711876.db2.gz	SCIIWSGYJDVWJT-SECBINFHSA-N	0	3	339.873	3.243	20	30		EGEDHN
Cc1ccc(CC(=O)N[C@@H](C)CNCc2ccc(C#N)s2)cc1C	ZINC001699430715	1412748538	/nfs/dbraw/zinc/74/85/38/1412748538.db2.gz	ZTWZQYUXEXGMNV-HNNXBMFYSA-N	0	3	341.480	3.074	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)NC(=O)c1ccc(C2CC2)cc1	ZINC001699432414	1412750179	/nfs/dbraw/zinc/75/01/79/1412750179.db2.gz	HKHOXPXWSIAKGA-ZDUSSCGKSA-N	0	3	339.464	3.405	20	30		EGEDHN
CCC(CC)C(=O)N[C@H]1CCN(Cc2cccc(C#N)c2)[C@H](C)C1	ZINC001700312598	1413768129	/nfs/dbraw/zinc/76/81/29/1413768129.db2.gz	VHFBZAYVYITSRG-BEFAXECRSA-N	0	3	327.472	3.464	20	30		EGEDHN
Cc1c(C(=O)N[C@@H](C)CNCc2ccc(C#N)s2)ccn1C(C)C	ZINC001733009269	1429129197	/nfs/dbraw/zinc/12/91/97/1429129197.db2.gz	HEDKNUOOIBIMHP-ZDUSSCGKSA-N	0	3	344.484	3.219	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@@H](C)Cc2ccccc2F)C1	ZINC001707090399	1417196734	/nfs/dbraw/zinc/19/67/34/1417196734.db2.gz	MKZBTXOVANHBOY-NOLJZWGESA-N	0	3	338.854	3.241	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1cncc(CC)c1	ZINC001707447751	1417351345	/nfs/dbraw/zinc/35/13/45/1417351345.db2.gz	YEJSFVZZAHZAGN-YOEHRIQHSA-N	0	3	335.879	3.369	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1cc(C)sn1	ZINC001712996159	1417547416	/nfs/dbraw/zinc/54/74/16/1417547416.db2.gz	GRKUFRKRPWCXTK-OCCSQVGLSA-N	0	3	327.881	3.177	20	30		EGEDHN
COc1ccc(CN[C@H](C)CNC(=O)C2=CCCCCC2)cc1C#N	ZINC001713306672	1417931824	/nfs/dbraw/zinc/93/18/24/1417931824.db2.gz	BFOKZCUEANUJTR-OAHLLOKOSA-N	0	3	341.455	3.052	20	30		EGEDHN
CCN(CCNC(=O)c1ccc(F)c(F)c1)Cc1ccc(C#N)cc1	ZINC001713485863	1418179142	/nfs/dbraw/zinc/17/91/42/1418179142.db2.gz	LGBWOBQMWLZLCB-UHFFFAOYSA-N	0	3	343.377	3.088	20	30		EGEDHN
CCN(CCNC(=O)[C@H](F)c1ccccc1)Cc1cccc(C#N)c1	ZINC001713493463	1418195414	/nfs/dbraw/zinc/19/54/14/1418195414.db2.gz	KQQSSCKIAQZUMO-LJQANCHMSA-N	0	3	339.414	3.207	20	30		EGEDHN
CCN(CCNC(=O)C1CCC(F)(F)CC1)Cc1ccc(C#N)cc1	ZINC001713493487	1418195883	/nfs/dbraw/zinc/19/58/83/1418195883.db2.gz	LEQZOHBDVCSUBN-UHFFFAOYSA-N	0	3	349.425	3.322	20	30		EGEDHN
C=CCN[C@H](CNC(=O)C[C@H]1CCOC1)c1ccc(C(C)C)cc1	ZINC001713697854	1418453588	/nfs/dbraw/zinc/45/35/88/1418453588.db2.gz	JFFCMYKBKPRCHE-VQIMIIECSA-N	0	3	330.472	3.170	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CCCN(CCc2ccc3c(c2)CCO3)C1	ZINC001713784671	1418601080	/nfs/dbraw/zinc/60/10/80/1418601080.db2.gz	NAZVGSIXDXGHJE-LJQANCHMSA-N	0	3	342.483	3.101	20	30		EGEDHN
N#Cc1ccc(CN[C@H](CNC(=O)C2CC3(CCC3)C2)C2CC2)s1	ZINC001713874433	1418670775	/nfs/dbraw/zinc/67/07/75/1418670775.db2.gz	JSCWBQUOGCZKFF-QGZVFWFLSA-N	0	3	343.496	3.184	20	30		EGEDHN
CCC[C@H](C)CC(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001713943495	1418731954	/nfs/dbraw/zinc/73/19/54/1418731954.db2.gz	CQRILYUMSMWIKI-JQFCIGGWSA-N	0	3	331.435	3.260	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1nc(C(C)C)oc1C)C1CC1	ZINC001714162342	1418972769	/nfs/dbraw/zinc/97/27/69/1418972769.db2.gz	FEXAQFBAGAFAML-KRWDZBQOSA-N	0	3	339.867	3.347	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2ocnc2C)CCCC[C@@H]1C	ZINC001714179724	1418987835	/nfs/dbraw/zinc/98/78/35/1418987835.db2.gz	FUERZZUCOZZKJS-ZBEGNZNMSA-N	0	3	325.840	3.004	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H]2CCCc3cccnc32)CCCC1	ZINC001714501593	1419227695	/nfs/dbraw/zinc/22/76/95/1419227695.db2.gz	KXSIJPVMSHSCJG-INIZCTEOSA-N	0	3	347.890	3.273	20	30		EGEDHN
CCCN(CCNC(=O)[C@@H](C)C(F)(F)F)Cc1ccc(C#N)cc1	ZINC001714655532	1419437184	/nfs/dbraw/zinc/43/71/84/1419437184.db2.gz	FIMKGQIAFHUBRA-CYBMUJFWSA-N	0	3	341.377	3.085	20	30		EGEDHN
CCCN(CCNC(=O)Cc1cccc(C)c1)Cc1cccc(C#N)c1	ZINC001714656896	1419438775	/nfs/dbraw/zinc/43/87/75/1419438775.db2.gz	QKTQMEHSNJCWBH-UHFFFAOYSA-N	0	3	349.478	3.438	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)[C@H]1CCCC1(C)C	ZINC001715243693	1419971670	/nfs/dbraw/zinc/97/16/70/1419971670.db2.gz	CDNJNCFBGVCNDH-CRAIPNDOSA-N	0	3	327.472	3.226	20	30		EGEDHN
C[C@H](CNCc1ccc(F)c(C#N)c1)NC(=O)c1ccccc1Cl	ZINC001715960445	1420426995	/nfs/dbraw/zinc/42/69/95/1420426995.db2.gz	UPZINXZNHIAKNZ-GFCCVEGCSA-N	0	3	345.805	3.259	20	30		EGEDHN
CCc1ccccc1CC(=O)N[C@@H](C)CNCc1ccc(C#N)s1	ZINC001715980411	1420439490	/nfs/dbraw/zinc/43/94/90/1420439490.db2.gz	GXKWKBSZGJSXME-AWEZNQCLSA-N	0	3	341.480	3.019	20	30		EGEDHN
Cc1scc(C(=O)N[C@H](C)CN(C)Cc2ccc(C#N)cc2)c1C	ZINC001716021469	1420476646	/nfs/dbraw/zinc/47/66/46/1420476646.db2.gz	HQKNUENBPCVKPT-CYBMUJFWSA-N	0	3	341.480	3.487	20	30		EGEDHN
Cc1ccc(F)c(C(=O)N[C@H](C)CN(C)Cc2cccc(C#N)c2)c1	ZINC001716042028	1420504799	/nfs/dbraw/zinc/50/47/99/1420504799.db2.gz	BGFFALFDABCFLZ-OAHLLOKOSA-N	0	3	339.414	3.256	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)CCCC(C)=O)CC2)C1	ZINC001716703216	1420856346	/nfs/dbraw/zinc/85/63/46/1420856346.db2.gz	TUSSCCWAZSWARI-KRWDZBQOSA-N	0	3	340.895	3.059	20	30		EGEDHN
CC(C)C(=O)N[C@@H](CNCc1ccc(C#N)cc1F)C1CCCC1	ZINC001716813229	1420939127	/nfs/dbraw/zinc/93/91/27/1420939127.db2.gz	CRTYRIWRNJEBFX-SFHVURJKSA-N	0	3	331.435	3.118	20	30		EGEDHN
Cc1csc(C(=O)NC[C@@H](C)N(C)Cc2ccc(C#N)cc2)c1	ZINC001717471992	1421404963	/nfs/dbraw/zinc/40/49/63/1421404963.db2.gz	HXUGHSTXPRIKFW-CQSZACIVSA-N	0	3	327.453	3.179	20	30		EGEDHN
CCCC1(C(=O)NC[C@@H](C)N(C)Cc2ccc(C#N)cc2)CCC1	ZINC001717482564	1421418862	/nfs/dbraw/zinc/41/88/62/1421418862.db2.gz	CQUFNHSRGXYKHS-MRXNPFEDSA-N	0	3	327.472	3.465	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC(N(CC=C(Cl)Cl)CC2CC2)CC1	ZINC001723640537	1424506468	/nfs/dbraw/zinc/50/64/68/1424506468.db2.gz	PIISWGNNKBMYBH-LBPRGKRZSA-N	0	3	344.286	3.168	20	30		EGEDHN
C=C(Cl)CN(CC1CC1)C1CCN(C(=O)[C@H](F)C(C)C)CC1	ZINC001723648995	1424513165	/nfs/dbraw/zinc/51/31/65/1424513165.db2.gz	BZVGRGZOALXSPT-MRXNPFEDSA-N	0	3	330.875	3.436	20	30		EGEDHN
N#Cc1cc(CNC2(CNC(=O)C3CC4(CC4)C3)CCC2)ccc1F	ZINC001724793955	1425160525	/nfs/dbraw/zinc/16/05/25/1425160525.db2.gz	RAMZEBXLZMFTMD-UHFFFAOYSA-N	0	3	341.430	3.016	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)CO[C@H](C)CC)CC1	ZINC001725023361	1425439620	/nfs/dbraw/zinc/43/96/20/1425439620.db2.gz	LSNCPPAPQCPSPE-OAHLLOKOSA-N	0	3	330.900	3.115	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@@H](C)N(C)Cc2cccc(C#N)c2)s1	ZINC001725158505	1425653897	/nfs/dbraw/zinc/65/38/97/1425653897.db2.gz	UHSFLZHGFKFHEO-CYBMUJFWSA-N	0	3	327.453	3.179	20	30		EGEDHN
CC(C)(C)CC(=O)N[C@H]1CC[C@H](CNCc2ccccc2C#N)C1	ZINC001725622775	1426287835	/nfs/dbraw/zinc/28/78/35/1426287835.db2.gz	IHTGIPSGCHLDQJ-YJBOKZPZSA-N	0	3	327.472	3.369	20	30		EGEDHN
C=C(Cl)CNC1CC(N(C)C(=O)CCc2ccc3[nH]ccc3c2)C1	ZINC001725779671	1426463225	/nfs/dbraw/zinc/46/32/25/1426463225.db2.gz	GFJVMEAMZLRCKZ-UHFFFAOYSA-N	0	3	345.874	3.432	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H](CC)Oc2cccc(C)c2)C1	ZINC001731455159	1427431526	/nfs/dbraw/zinc/43/15/26/1427431526.db2.gz	BODCZEVLPMRMQX-BFYDXBDKSA-N	0	3	336.863	3.142	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)C2(CCC)CC2)CC1	ZINC001731573562	1427616369	/nfs/dbraw/zinc/61/63/69/1427616369.db2.gz	GBHUOSAQRNCHQF-UHFFFAOYSA-N	0	3	343.309	3.492	20	30		EGEDHN
CC(C)c1ncsc1C(=O)NC[C@@H](C)NCc1ccc(C#N)s1	ZINC001731625530	1427676624	/nfs/dbraw/zinc/67/66/24/1427676624.db2.gz	WDCMQGOEXHQMPB-LLVKDONJSA-N	0	3	348.497	3.108	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1csc(-c2ccco2)n1	ZINC001733906192	1437724366	/nfs/dbraw/zinc/72/43/66/1437724366.db2.gz	BCWFBJRQBNBDSR-NSHDSACASA-N	0	3	339.848	3.254	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)CC2CCOCC2)CC1	ZINC001733919592	1437733291	/nfs/dbraw/zinc/73/32/91/1437733291.db2.gz	ZFEKSMINBZQVFT-UHFFFAOYSA-N	0	3	342.911	3.116	20	30		EGEDHN
C=C(Br)CNC[C@@H](C1CC1)N(C)C(=O)C1(CCC)CC1	ZINC001734305516	1438036926	/nfs/dbraw/zinc/03/69/26/1438036926.db2.gz	SQDMCBNZNQRMNQ-AWEZNQCLSA-N	0	3	343.309	3.302	20	30		EGEDHN
CN(CCCNC(=O)[C@H]1CCC[C@H](F)C1)Cc1ccc(F)c(C#N)c1	ZINC001751976150	1440129928	/nfs/dbraw/zinc/12/99/28/1440129928.db2.gz	ZLVXTTNJPVKKJZ-RDJZCZTQSA-N	0	3	349.425	3.164	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCCC[C@@H]1[C@H](C)NCc1cn(C)nc1C	ZINC001752146574	1440145994	/nfs/dbraw/zinc/14/59/94/1440145994.db2.gz	NDMLZSLUPAUFEC-FUHWJXTLSA-N	0	3	346.519	3.190	20	30		EGEDHN
Cc1c[nH]cc1C(=O)N1CCCC[C@@H]1[C@@H](C)NCC#Cc1ccccc1	ZINC001752154642	1440146718	/nfs/dbraw/zinc/14/67/18/1440146718.db2.gz	DBZDUDZYOKFYFI-WIYYLYMNSA-N	0	3	349.478	3.348	20	30		EGEDHN
CC#CCN(CCCNC(=O)Cc1cccc(C(F)F)c1)C1CC1	ZINC001752265648	1440162342	/nfs/dbraw/zinc/16/23/42/1440162342.db2.gz	CYYSQNPVBHNNAF-UHFFFAOYSA-N	0	3	334.410	3.161	20	30		EGEDHN
C=C(C)CN1CCN(CCCNC(=O)C2(CC)CCCCC2)CC1	ZINC001752356832	1440172087	/nfs/dbraw/zinc/17/20/87/1440172087.db2.gz	HAXKMBHXARUVCF-UHFFFAOYSA-N	0	3	335.536	3.047	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)CCc2ccc3[nH]ccc3c2)CC1	ZINC001752426200	1440177020	/nfs/dbraw/zinc/17/70/20/1440177020.db2.gz	GZOBDFJBFJDQKA-FQEVSTJZSA-N	0	3	349.478	3.095	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)NC[C@H](NCC#Cc2ccccc2)C2CC2)CC1	ZINC001752489955	1440186498	/nfs/dbraw/zinc/18/64/98/1440186498.db2.gz	CDJYECKXMXAUDS-YYWHXJBOSA-N	0	3	338.495	3.349	20	30		EGEDHN
C=CCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@H](C)c1ccncc1	ZINC001752536579	1440194342	/nfs/dbraw/zinc/19/43/42/1440194342.db2.gz	ZOPXOTRWXFAOBA-YTQUADARSA-N	0	3	327.472	3.217	20	30		EGEDHN
COc1ccc(CN[C@H]2CCN(C(=O)CC(C)=C(C)C)C2)cc1C#N	ZINC001752587251	1440195830	/nfs/dbraw/zinc/19/58/30/1440195830.db2.gz	AIHHILFTNFCPPZ-SFHVURJKSA-N	0	3	341.455	3.004	20	30		EGEDHN
O=C(N[C@H]1C[C@H](NCC#Cc2cccc(Cl)c2)C1)[C@]12C[C@H]1CCC2	ZINC001752648053	1440197826	/nfs/dbraw/zinc/19/78/26/1440197826.db2.gz	WDJIGHXDGQUFGL-DLVXIWMQSA-N	0	3	342.870	3.119	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)[C@@H](C)C(CC)CC)C1	ZINC001752737128	1440204398	/nfs/dbraw/zinc/20/43/98/1440204398.db2.gz	IQYHCLPHSIDIAB-FPMFFAJLSA-N	0	3	331.298	3.204	20	30		EGEDHN
C=CCCOCC(=O)NC[C@@H]1CCCN([C@H](C)c2cccc(F)c2)C1	ZINC001752789993	1440213221	/nfs/dbraw/zinc/21/32/21/1440213221.db2.gz	PENJGHOSHCXWTE-SJORKVTESA-N	0	3	348.462	3.308	20	30		EGEDHN
C=CCOCCN1CCCC[C@@H]1CNC(=O)[C@@H]1CCC(C)=C(C)C1	ZINC001752820353	1440220146	/nfs/dbraw/zinc/22/01/46/1440220146.db2.gz	DHQYSXFLKGEPCW-RTBURBONSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=CCOCCN1CCCC[C@H]1CNC(=O)c1cccc(C2CC2)c1	ZINC001752824761	1440222918	/nfs/dbraw/zinc/22/29/18/1440222918.db2.gz	CZZXWWWEYUFTAK-FQEVSTJZSA-N	0	3	342.483	3.351	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)COCCCCCC	ZINC001752834557	1440227127	/nfs/dbraw/zinc/22/71/27/1440227127.db2.gz	UKTFKIHTNUXXPJ-MOPGFXCFSA-N	0	3	334.504	3.062	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)C(C)(C)c2ccccc2Cl)C1	ZINC001752840099	1440229926	/nfs/dbraw/zinc/22/99/26/1440229926.db2.gz	GONKCWCPKHOTRV-HZPDHXFCSA-N	0	3	346.902	3.468	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)CCc2ccc(C)s2)C1	ZINC001752841970	1440231289	/nfs/dbraw/zinc/23/12/89/1440231289.db2.gz	VWLOKCCSUAXLSS-SJORKVTESA-N	0	3	332.513	3.229	20	30		EGEDHN
C[C@H](C#N)C(=O)NC1CCC(NCc2c(F)cccc2Cl)CC1	ZINC001752849169	1440233144	/nfs/dbraw/zinc/23/31/44/1440233144.db2.gz	ZTBCARAYYYUWOY-PNESKVBLSA-N	0	3	337.826	3.156	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC1CCC(N[C@@H](C)c2cnccn2)CC1	ZINC001752852974	1440234104	/nfs/dbraw/zinc/23/41/04/1440234104.db2.gz	ZCSVZOCGVLKXAJ-FHERZECASA-N	0	3	330.476	3.157	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CCC[C@@H](NCc2oc(CCC)nc2C)C1	ZINC001752964689	1440253908	/nfs/dbraw/zinc/25/39/08/1440253908.db2.gz	GVCQKFYJXSOUEI-HZPDHXFCSA-N	0	3	333.476	3.419	20	30		EGEDHN
CC#CCN(C)[C@H]1CCCN(C(=O)[C@H](CC)c2ccc(OC)cc2)C1	ZINC001752999616	1440264024	/nfs/dbraw/zinc/26/40/24/1440264024.db2.gz	DSGXNCKMXUWCFS-AZUAARDMSA-N	0	3	342.483	3.135	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1ccccc1OC1CCC1	ZINC001753013620	1440267606	/nfs/dbraw/zinc/26/76/06/1440267606.db2.gz	RAAFTALWRDXFNN-CQSZACIVSA-N	0	3	336.863	3.468	20	30		EGEDHN
CC(C)(C)C(=O)NCCC[C@H]1CCCN1CC#Cc1ccccc1	ZINC001753038057	1440275358	/nfs/dbraw/zinc/27/53/58/1440275358.db2.gz	OEZTYEFNJPZDJC-IBGZPJMESA-N	0	3	326.484	3.445	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NCCN(CC)[C@H](C)c1ccc(F)cc1	ZINC001753091113	1440298952	/nfs/dbraw/zinc/29/89/52/1440298952.db2.gz	JCFRPHBSOYWSIY-MNEFBYGVSA-N	0	3	348.462	3.306	20	30		EGEDHN
O=C(C#CC1CC1)NC[C@H]1CCN([C@@H]2CCc3c2cccc3Cl)C1	ZINC001753123590	1440314601	/nfs/dbraw/zinc/31/46/01/1440314601.db2.gz	FDYNRZHLMIOUPP-DNVCBOLYSA-N	0	3	342.870	3.179	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)CCC(C)(C)c2ccccc2)C1	ZINC001753140144	1440320735	/nfs/dbraw/zinc/32/07/35/1440320735.db2.gz	ICZLQJQRFXJQCP-GOSISDBHSA-N	0	3	326.484	3.206	20	30		EGEDHN
CC[C@@H]1CCC[C@@]1(C)C(=O)N(C)CCNCc1ccc(C#N)s1	ZINC001753202465	1440338405	/nfs/dbraw/zinc/33/84/05/1440338405.db2.gz	SKZRURFNNJHBAU-RDTXWAMCSA-N	0	3	333.501	3.384	20	30		EGEDHN
CC[C@H]1CCC[C@@]1(C)C(=O)N(C)CCNCc1ccc(C#N)s1	ZINC001753202462	1440338423	/nfs/dbraw/zinc/33/84/23/1440338423.db2.gz	SKZRURFNNJHBAU-KBXCAEBGSA-N	0	3	333.501	3.384	20	30		EGEDHN
CC(C)Cc1c[nH]c(C(=O)N(C)CCNCc2ccc(C#N)s2)c1	ZINC001753252169	1440343100	/nfs/dbraw/zinc/34/31/00/1440343100.db2.gz	NNMVLZXMVDWIBG-UHFFFAOYSA-N	0	3	344.484	3.008	20	30		EGEDHN
C=CC[C@@H](C(=O)N(C)CCNCc1ccc(C#N)cc1)c1ccccc1	ZINC001753272048	1440345623	/nfs/dbraw/zinc/34/56/23/1440345623.db2.gz	IVHIUFIRTAEBBO-OAQYLSRUSA-N	0	3	347.462	3.466	20	30		EGEDHN
C#CCCN[C@H](CNC(=O)C1CC(OC)C1)c1ccc(C(C)C)cc1	ZINC001753294095	1440351388	/nfs/dbraw/zinc/35/13/88/1440351388.db2.gz	DLTBLZXOHOJQNZ-SOAGJPPSSA-N	0	3	342.483	3.005	20	30		EGEDHN
C=CCN[C@H](CNC(=O)C(C)(C)C1CCOCC1)c1ccccc1	ZINC001753300621	1440353870	/nfs/dbraw/zinc/35/38/70/1440353870.db2.gz	XHEYBBBOISCEPO-GOSISDBHSA-N	0	3	330.472	3.072	20	30		EGEDHN
C=C(C)CN[C@H](CNC(=O)C[C@H]1CC(C)(C)CO1)c1ccccc1	ZINC001753300490	1440353915	/nfs/dbraw/zinc/35/39/15/1440353915.db2.gz	UJXRXURJHQGKFF-ZWKOTPCHSA-N	0	3	330.472	3.215	20	30		EGEDHN
C=C(C)CN[C@@H](CNC(=O)CC#Cc1ccccc1)c1ccccc1	ZINC001753302412	1440354431	/nfs/dbraw/zinc/35/44/31/1440354431.db2.gz	AZJYRUXGCDTVQX-NRFANRHFSA-N	0	3	332.447	3.451	20	30		EGEDHN
CC#CCCCC(=O)N1C[C@H]2CC[C@@H](C1)N2CCCc1ccccc1	ZINC001753307678	1440355645	/nfs/dbraw/zinc/35/56/45/1440355645.db2.gz	JUVMNHJPRHFOLU-OYRHEFFESA-N	0	3	338.495	3.488	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CCC)C(=O)[C@@H](CC(C)C)n2ccnc2)C1	ZINC001753317758	1440360904	/nfs/dbraw/zinc/36/09/04/1440360904.db2.gz	VLWFJCPLZHVIHO-RBUKOAKNSA-N	0	3	346.519	3.359	20	30		EGEDHN
C#CCCN1CC[C@H](N(CCC)C(=O)CCOc2ccccc2C)C1	ZINC001753321706	1440363984	/nfs/dbraw/zinc/36/39/84/1440363984.db2.gz	CJBKQKDWVZQIEE-IBGZPJMESA-N	0	3	342.483	3.100	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N(CCC)[C@@H]1CCN(CC=C(C)C)C1	ZINC001753323141	1440364794	/nfs/dbraw/zinc/36/47/94/1440364794.db2.gz	LYHPCEGRLWJMHK-OAQYLSRUSA-N	0	3	338.495	3.490	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CCC)C(=O)[C@@H](C)Oc2ccc(C)cc2)C1	ZINC001753323883	1440365292	/nfs/dbraw/zinc/36/52/92/1440365292.db2.gz	SGGCPKLUZDGBGO-RTBURBONSA-N	0	3	342.483	3.099	20	30		EGEDHN
C=CCCC(=O)NCC[C@H]1CCN(CCc2c(F)cccc2F)C1	ZINC001753324706	1440365902	/nfs/dbraw/zinc/36/59/02/1440365902.db2.gz	ITOFWRJIJKNBBU-HNNXBMFYSA-N	0	3	336.426	3.302	20	30		EGEDHN
CC(C(=O)NCC[C@@H]1CCN(Cc2ccc(C#N)s2)C1)=C1CCC1	ZINC001753328285	1440367829	/nfs/dbraw/zinc/36/78/29/1440367829.db2.gz	PLUILUAGZGETNF-OAHLLOKOSA-N	0	3	343.496	3.448	20	30		EGEDHN
C=CC(C)(C)C(=O)NCC[C@H]1CCN(Cc2ccc(C#N)c(F)c2)C1	ZINC001753335692	1440371935	/nfs/dbraw/zinc/37/19/35/1440371935.db2.gz	XTQHCGYTDKATSY-HNNXBMFYSA-N	0	3	343.446	3.238	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC[C@H]1CCN(Cc2cnc(C)s2)C1	ZINC001753335640	1440372056	/nfs/dbraw/zinc/37/20/56/1440372056.db2.gz	WSACRQLVJAQHKK-HNNXBMFYSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=CC(C)(C)C(=O)N(C)CCN1CCN([C@@H](C)c2ccccc2)CC1	ZINC001753342122	1440375684	/nfs/dbraw/zinc/37/56/84/1440375684.db2.gz	LHRSCSIWBAXCJF-SFHVURJKSA-N	0	3	343.515	3.036	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)CCCOc1ccccc1C	ZINC001753423169	1440395804	/nfs/dbraw/zinc/39/58/04/1440395804.db2.gz	YOBAGERIVRUTLY-ROUUACIJSA-N	0	3	328.456	3.015	20	30		EGEDHN
C=CCCCCCN1C[C@@H]2C[C@H]1CN2C(=O)COc1ccccc1	ZINC001753426631	1440397115	/nfs/dbraw/zinc/39/71/15/1440397115.db2.gz	JICSILKXYMKPKW-ROUUACIJSA-N	0	3	328.456	3.097	20	30		EGEDHN
C=CC(C)(C)C(=O)N(C)[C@@H]1CCN(Cc2cccc3c2CCOC3)C1	ZINC001753443550	1440402722	/nfs/dbraw/zinc/40/27/22/1440402722.db2.gz	YPEDBQGMTXHRPB-GOSISDBHSA-N	0	3	342.483	3.004	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N(CC)[C@@H]2CCN(CC(=C)C)C2)cc1	ZINC001753463437	1440411834	/nfs/dbraw/zinc/41/18/34/1440411834.db2.gz	HACDLCZXPYWUBF-LJQANCHMSA-N	0	3	342.483	3.293	20	30		EGEDHN
CC[C@H](CNC(=O)c1cccc2c1CCC2)NCC#Cc1ccccc1	ZINC001753498688	1440422541	/nfs/dbraw/zinc/42/25/41/1440422541.db2.gz	XKGMQDHFRVBZQY-HXUWFJFHSA-N	0	3	346.474	3.325	20	30		EGEDHN
Cc1cc(C(=O)NC2(CNCC#Cc3ccccc3)CCCC2)c(C)[nH]1	ZINC001753509350	1440425450	/nfs/dbraw/zinc/42/54/50/1440425450.db2.gz	QPILHJSTFQWTJF-UHFFFAOYSA-N	0	3	349.478	3.315	20	30		EGEDHN
C=C(Br)CNC[C@](C)(NC(=O)CC(C)(C)C)C1CC1	ZINC001753513006	1440426483	/nfs/dbraw/zinc/42/64/83/1440426483.db2.gz	HLRZXKCFKAZCPR-HNNXBMFYSA-N	0	3	331.298	3.206	20	30		EGEDHN
CC/C(C)=C/C(=O)N[C@](C)(CNCc1ccc(C#N)cc1F)C1CC1	ZINC001753515726	1440427408	/nfs/dbraw/zinc/42/74/08/1440427408.db2.gz	GIESNQKHDDGGML-CBHXRGPZSA-N	0	3	343.446	3.428	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)Cc1ccc2c(c1)CCC2)C1CC1	ZINC001753526725	1440429731	/nfs/dbraw/zinc/42/97/31/1440429731.db2.gz	BLCRBCITTHUKRN-HXUWFJFHSA-N	0	3	346.902	3.345	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2cscn2)CCCC[C@@H]1C	ZINC001753531692	1440431213	/nfs/dbraw/zinc/43/12/13/1440431213.db2.gz	LMTXYSPBLJWWIA-NHYWBVRUSA-N	0	3	327.881	3.164	20	30		EGEDHN
N#Cc1ccccc1CNCC[C@@H]1CCCN(C(=O)c2ccco2)C1	ZINC001753539032	1440433187	/nfs/dbraw/zinc/43/31/87/1440433187.db2.gz	NJWLSMVFUGAXLX-INIZCTEOSA-N	0	3	337.423	3.183	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC[C@@H](CCNCc2cc(C#N)ccc2F)C1	ZINC001753541981	1440433652	/nfs/dbraw/zinc/43/36/52/1440433652.db2.gz	YOWZWIQECMGCRY-CVEARBPZSA-N	0	3	345.462	3.462	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCCN(C(=O)C2CCC(F)CC2)C1	ZINC001753555342	1440435930	/nfs/dbraw/zinc/43/59/30/1440435930.db2.gz	SOWCKSQQNJKJOY-FHERZECASA-N	0	3	330.875	3.486	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCCN(C(=O)COc2ccsc2)C1	ZINC001753559670	1440436624	/nfs/dbraw/zinc/43/66/24/1440436624.db2.gz	UIZGNNIHCMUQOD-AWEZNQCLSA-N	0	3	342.892	3.098	20	30		EGEDHN
O=C(NCc1ccc(CNCC#Cc2ccccc2)cc1)C1CCC1	ZINC001753588486	1440442213	/nfs/dbraw/zinc/44/22/13/1440442213.db2.gz	PHGGOWYPLQSTJN-UHFFFAOYSA-N	0	3	332.447	3.244	20	30		EGEDHN
Cc1nsc(C)c1CN1CCC(CCNC(=O)C#CC(C)C)CC1	ZINC001753595256	1440444291	/nfs/dbraw/zinc/44/42/91/1440444291.db2.gz	UYRJHFGFNFFBJH-UHFFFAOYSA-N	0	3	347.528	3.138	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCCC1CCN(Cc2cnc(C)o2)CC1	ZINC001753597508	1440445195	/nfs/dbraw/zinc/44/51/95/1440445195.db2.gz	WKGVUFYETZXWDU-MRXNPFEDSA-N	0	3	333.476	3.304	20	30		EGEDHN
C=CCCC(=O)N1CCC2(CCN(CC#Cc3ccccc3)C2)CC1	ZINC001753602225	1440446800	/nfs/dbraw/zinc/44/68/00/1440446800.db2.gz	FLEHJZKYIYSNRQ-UHFFFAOYSA-N	0	3	336.479	3.319	20	30		EGEDHN
C[C@@H](CNCc1cc(F)ccc1C#N)CNC(=O)C[C@H]1C=CCCC1	ZINC001753620881	1440450423	/nfs/dbraw/zinc/45/04/23/1440450423.db2.gz	DGDIHXDDJLKMPC-HOTGVXAUSA-N	0	3	343.446	3.286	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)[C@H](C)c1ccsc1	ZINC001753630864	1440452263	/nfs/dbraw/zinc/45/22/63/1440452263.db2.gz	PUVGPSREBLIYBH-HUUCEWRRSA-N	0	3	341.480	3.265	20	30		EGEDHN
C/C(=C\C(=O)NCC1(NCC#Cc2ccccc2)CCCC1)C1CC1	ZINC001753660998	1440458689	/nfs/dbraw/zinc/45/86/89/1440458689.db2.gz	WHRDNMVYKLPCTR-FBMGVBCBSA-N	0	3	336.479	3.413	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccc(OC)c(C)c2)CCCC1	ZINC001753669935	1440461665	/nfs/dbraw/zinc/46/16/65/1440461665.db2.gz	LUSVUMSBAZJZQZ-UHFFFAOYSA-N	0	3	336.863	3.388	20	30		EGEDHN
C=CCOCCN1CC2(C1)CCN(C(=O)[C@H](CCC)C(C)C)CC2	ZINC001753675152	1440463235	/nfs/dbraw/zinc/46/32/35/1440463235.db2.gz	UAXYLODNHKCBJJ-GOSISDBHSA-N	0	3	336.520	3.186	20	30		EGEDHN
CCC[C@@H](C)CC(=O)N(C)[C@H](C)CNCc1ccc(F)c(C#N)c1	ZINC001753682502	1440464809	/nfs/dbraw/zinc/46/48/09/1440464809.db2.gz	RGGNRZUROOFLOI-HUUCEWRRSA-N	0	3	333.451	3.460	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)c(F)c1)N(C)C(=O)[C@H]1[C@@H]2CCCC[C@@H]21	ZINC001753687365	1440465855	/nfs/dbraw/zinc/46/58/55/1440465855.db2.gz	MIZIQWQNCUAMCH-WKCGWZECSA-N	0	3	343.446	3.070	20	30		EGEDHN
C=CC1(CC(=O)N(C)[C@@H](C)CN[C@H](C)c2n[nH]c(C)n2)CCCCC1	ZINC001753716626	1440472098	/nfs/dbraw/zinc/47/20/98/1440472098.db2.gz	YBZHZTLHBFDYGU-LSDHHAIUSA-N	0	3	347.507	3.137	20	30		EGEDHN
CC(C)C[C@H](CNCC#Cc1ccccc1)NC(=O)CCC1CC1	ZINC001753733647	1440476832	/nfs/dbraw/zinc/47/68/32/1440476832.db2.gz	TZPBLOAIEFNASV-HXUWFJFHSA-N	0	3	326.484	3.349	20	30		EGEDHN
COCC#CCNC[C@@H](CC(C)C)NC(=O)C1(C)CCCCCC1	ZINC001753736138	1440477714	/nfs/dbraw/zinc/47/77/14/1440477714.db2.gz	IOQZZGPYJTUURO-GOSISDBHSA-N	0	3	336.520	3.117	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](NCc2nc(C)oc2C)[C@H](C)C1	ZINC001753755221	1440482982	/nfs/dbraw/zinc/48/29/82/1440482982.db2.gz	OONGVFICQBWYIA-KDOFPFPSSA-N	0	3	345.487	3.386	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)C=C1CCC1)NCc1cc(C#N)ccc1F	ZINC001753827455	1440498817	/nfs/dbraw/zinc/49/88/17/1440498817.db2.gz	QETXKTZAYRCEBR-GOSISDBHSA-N	0	3	329.419	3.038	20	30		EGEDHN
CC(C)[C@H](CNC(=O)C1(C)CC1)NCC#Cc1ccccc1Cl	ZINC001753829670	1440499344	/nfs/dbraw/zinc/49/93/44/1440499344.db2.gz	QAFZVIFBGSJXMN-KRWDZBQOSA-N	0	3	332.875	3.222	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)C(C)(C)c1c(C)noc1C)C(C)C	ZINC001753838005	1440501674	/nfs/dbraw/zinc/50/16/74/1440501674.db2.gz	QKKYOXJXWOGQIE-AWEZNQCLSA-N	0	3	341.883	3.052	20	30		EGEDHN
Cc1cccnc1CN[C@H](CNC(=O)CC#Cc1ccccc1)C(C)C	ZINC001753845326	1440504152	/nfs/dbraw/zinc/50/41/52/1440504152.db2.gz	JJDUQJIZBLEEPV-HXUWFJFHSA-N	0	3	349.478	3.062	20	30		EGEDHN
C=C[C@@H](CC(=O)N(C)CCN(C)C[C@@H]1CCCCO1)c1ccccc1	ZINC001753869290	1440516436	/nfs/dbraw/zinc/51/64/36/1440516436.db2.gz	NWKBLUFMWSRCFA-ICSRJNTNSA-N	0	3	344.499	3.306	20	30		EGEDHN
C=C[C@H](CC(=O)N(C)CCN(C)C[C@@H]1CCCCO1)c1ccccc1	ZINC001753869291	1440516505	/nfs/dbraw/zinc/51/65/05/1440516505.db2.gz	NWKBLUFMWSRCFA-QUCCMNQESA-N	0	3	344.499	3.306	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CCC[C@@H]2CNCc2ccn(CC)n2)CCC1	ZINC001753893695	1440522300	/nfs/dbraw/zinc/52/23/00/1440522300.db2.gz	LBALYNMKRUOBRI-SJLPKXTDSA-N	0	3	344.503	3.024	20	30		EGEDHN
C=C(Cl)CNCC[C@@H](C)NC(=O)c1ccc(C)c2cccnc12	ZINC001753985092	1440528361	/nfs/dbraw/zinc/52/83/61/1440528361.db2.gz	NFJOIJRPRARFQV-CQSZACIVSA-N	0	3	331.847	3.394	20	30		EGEDHN
CCN(CCNCc1cccc(C#N)c1)C(=O)c1cc(F)ccc1C	ZINC001754059137	1440536693	/nfs/dbraw/zinc/53/66/93/1440536693.db2.gz	LOTFQYHKRKWGKR-UHFFFAOYSA-N	0	3	339.414	3.258	20	30		EGEDHN
CCN(CCNCc1ccc(F)c(C#N)c1)C(=O)C[C@H](C)C1CC1	ZINC001754085306	1440540124	/nfs/dbraw/zinc/54/01/24/1440540124.db2.gz	XNOUOURDSXWXJV-AWEZNQCLSA-N	0	3	331.435	3.072	20	30		EGEDHN
CC(C)(C(=O)NC/C=C\CNCc1cccc(C#N)c1)C1CCC1	ZINC001754154284	1440545438	/nfs/dbraw/zinc/54/54/38/1440545438.db2.gz	VJUDTVFWPFJVKV-ARJAWSKDSA-N	0	3	325.456	3.147	20	30		EGEDHN
C[C@@H]1CC[C@H](CC(=O)NC/C=C/CNCc2cccc(C#N)c2)C1	ZINC001754159030	1440545698	/nfs/dbraw/zinc/54/56/98/1440545698.db2.gz	LEQFUTADLUMENZ-JQBWTISXSA-N	0	3	325.456	3.147	20	30		EGEDHN
Cc1cc(F)cc(C(=O)NC/C=C/CNCc2cccc(C#N)c2)c1	ZINC001754171335	1440547004	/nfs/dbraw/zinc/54/70/04/1440547004.db2.gz	CIDWCURQXVCXQJ-NSCUHMNNSA-N	0	3	337.398	3.082	20	30		EGEDHN
C=C[C@H](C(=O)NC/C=C\CNCc1cccc(C#N)c1)c1ccccc1	ZINC001754209119	1440550993	/nfs/dbraw/zinc/55/09/93/1440550993.db2.gz	DWKSCLGWVJZDQH-NGXITPROSA-N	0	3	345.446	3.290	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)NC(=O)c1sccc1Cl	ZINC001754227014	1440553378	/nfs/dbraw/zinc/55/33/78/1440553378.db2.gz	KPXXANRMXRQNBS-SECBINFHSA-N	0	3	339.873	3.243	20	30		EGEDHN
Cc1oc(C)c(C(=O)N[C@H](C)CNCc2ccc(C#N)s2)c1C	ZINC001754234743	1440554710	/nfs/dbraw/zinc/55/47/10/1440554710.db2.gz	RQLPDFRCVLYZOW-SNVBAGLBSA-N	0	3	331.441	3.046	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](C)CNCC#Cc2ccc(F)cc2)sc1C	ZINC001754251892	1440558253	/nfs/dbraw/zinc/55/82/53/1440558253.db2.gz	PJVGMHNQNMOMCA-CQSZACIVSA-N	0	3	344.455	3.264	20	30		EGEDHN
C=CC1(CC(=O)N[C@@H](C)CNCc2cncc(F)c2)CCCCC1	ZINC001754287211	1440564436	/nfs/dbraw/zinc/56/44/36/1440564436.db2.gz	RRYZVXMLPLUYSJ-HNNXBMFYSA-N	0	3	333.451	3.342	20	30		EGEDHN
CC[C@@H](CC(=O)N[C@@H](C)CNCc1ccc(F)c(C#N)c1)C(C)C	ZINC001754292472	1440565615	/nfs/dbraw/zinc/56/56/15/1440565615.db2.gz	YSNYYNOKVWJYRM-HOCLYGCPSA-N	0	3	333.451	3.364	20	30		EGEDHN
Cc1coc(C)c1C(=O)N(C)CCCNCc1cc(C#N)ccc1F	ZINC001754368775	1440592430	/nfs/dbraw/zinc/59/24/30/1440592430.db2.gz	SDZKNWGHROHIPF-UHFFFAOYSA-N	0	3	343.402	3.159	20	30		EGEDHN
C=C(Br)CNCCCN(C)C(=O)[C@@H]1CCC(C)=C(C)C1	ZINC001754372634	1440592665	/nfs/dbraw/zinc/59/26/65/1440592665.db2.gz	CSDGMBWZSMYFCL-OAHLLOKOSA-N	0	3	343.309	3.470	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@@H](CNCc1ccccc1Cl)C1CC1	ZINC001754438737	1440598741	/nfs/dbraw/zinc/59/87/41/1440598741.db2.gz	FIEIRNZZAUDWIY-KRWDZBQOSA-N	0	3	332.875	3.374	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001754447310	1440600208	/nfs/dbraw/zinc/60/02/08/1440600208.db2.gz	BCZAMAKFMOSUJB-MRXNPFEDSA-N	0	3	331.485	3.206	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)N[C@@H](CNCc2ccc(C#N)s2)C2CC2)CC1	ZINC001754456868	1440602428	/nfs/dbraw/zinc/60/24/28/1440602428.db2.gz	DHFBDROOKFRZMG-YEWWUXTCSA-N	0	3	345.512	3.430	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)CCCC#CC)CC2)C1	ZINC001754536303	1440624595	/nfs/dbraw/zinc/62/45/95/1440624595.db2.gz	UCTADEYUEFWNGQ-SFHVURJKSA-N	0	3	336.907	3.493	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@@]2(C1)CCCN(Cc1ccsc1)C2	ZINC001754557387	1440632338	/nfs/dbraw/zinc/63/23/38/1440632338.db2.gz	OEUAKZSIRIFVLE-IBGZPJMESA-N	0	3	330.497	3.222	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC[C@H]1CNCC#Cc1ccccc1Cl	ZINC001754606421	1440643279	/nfs/dbraw/zinc/64/32/79/1440643279.db2.gz	PTRGVHBCPZVBQY-WBVHZDCISA-N	0	3	332.875	3.318	20	30		EGEDHN
CC(C)(C)/C=C/C(=O)N1CCC[C@H]1CNCc1ccc(C#N)s1	ZINC001754607247	1440643325	/nfs/dbraw/zinc/64/33/25/1440643325.db2.gz	VYLQBYDHABURKA-VFNNOXKTSA-N	0	3	331.485	3.303	20	30		EGEDHN
C[C@H](CC(=O)N1CCC[C@H]1CNCC#Cc1ccccc1)n1cccc1	ZINC001754620529	1440645277	/nfs/dbraw/zinc/64/52/77/1440645277.db2.gz	VSDGRCXIHVREDL-CTNGQTDRSA-N	0	3	349.478	3.072	20	30		EGEDHN
CC/C=C(/C)C(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1	ZINC001754623394	1440645789	/nfs/dbraw/zinc/64/57/89/1440645789.db2.gz	COHYFDUWARODAB-SOFYXZRVSA-N	0	3	325.456	3.385	20	30		EGEDHN
C#CCN(C(=O)c1ccsc1COC)C1CCN(CC(=C)C)CC1	ZINC001754639088	1440648846	/nfs/dbraw/zinc/64/88/46/1440648846.db2.gz	VKTBZXMKWZUDRC-UHFFFAOYSA-N	0	3	346.496	3.010	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H](CNCc1ccccc1F)C1CCCC1	ZINC001754647987	1440651045	/nfs/dbraw/zinc/65/10/45/1440651045.db2.gz	UNCBUWKLDGRGFF-IBGZPJMESA-N	0	3	330.447	3.250	20	30		EGEDHN
C=C[C@H](CC(=O)N1CC[C@H]2CC[C@@H](C1)N2CC#CC)c1ccccc1	ZINC001754660749	1440654753	/nfs/dbraw/zinc/65/47/53/1440654753.db2.gz	NCMRQMDNHWPXIW-NRSPTQNISA-N	0	3	336.479	3.435	20	30		EGEDHN
C=CCOCC(=O)N[C@]1(C)CCN([C@H](CC)c2ccc(F)cc2)C1	ZINC001754668539	1440657351	/nfs/dbraw/zinc/65/73/51/1440657351.db2.gz	NJBQBNCOQLTWRE-IEBWSBKVSA-N	0	3	334.435	3.060	20	30		EGEDHN
C=C(C)CCC(=O)NCC1(C)CCN(Cc2c(C)noc2C)CC1	ZINC001754716625	1440671826	/nfs/dbraw/zinc/67/18/26/1440671826.db2.gz	SZCJNHVXMBCMDS-UHFFFAOYSA-N	0	3	333.476	3.366	20	30		EGEDHN
CC#CCN1CCC[C@@](C)(CNC(=O)c2cncc3sccc32)C1	ZINC001754730443	1440678922	/nfs/dbraw/zinc/67/89/22/1440678922.db2.gz	VYKHGQDQULAWED-IBGZPJMESA-N	0	3	341.480	3.152	20	30		EGEDHN
CC#CCN1CCC[C@](C)(CNC(=O)[C@@H](C)c2ccc(F)c(F)c2)C1	ZINC001754734414	1440681543	/nfs/dbraw/zinc/68/15/43/1440681543.db2.gz	VKSRCHGFSQJFIA-MGPUTAFESA-N	0	3	348.437	3.310	20	30		EGEDHN
CC#CCN1CCC[C@](C)(CNC(=O)[C@H](C)c2ccc(F)c(F)c2)C1	ZINC001754734413	1440681578	/nfs/dbraw/zinc/68/15/78/1440681578.db2.gz	VKSRCHGFSQJFIA-FOIQADDNSA-N	0	3	348.437	3.310	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@]1(O)CCN([C@H](C)c2ccc(F)cc2)C1	ZINC001754756381	1440685270	/nfs/dbraw/zinc/68/52/70/1440685270.db2.gz	MHOZYCJRXAMJDN-FOIQADDNSA-N	0	3	348.462	3.042	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)[C@@H](C)OCCCC)C2)CC1	ZINC001754782991	1440686821	/nfs/dbraw/zinc/68/68/21/1440686821.db2.gz	IHDJZAMWYJBCSS-UYAOXDASSA-N	0	3	348.531	3.166	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)[C@H](C)OCCCC)C2)CC1	ZINC001754782988	1440686885	/nfs/dbraw/zinc/68/68/85/1440686885.db2.gz	IHDJZAMWYJBCSS-AZUAARDMSA-N	0	3	348.531	3.166	20	30		EGEDHN
C#CCCN[C@@H](CNC(=O)c1[nH]c(C)cc1C)c1ccccc1CC	ZINC001754784181	1440687157	/nfs/dbraw/zinc/68/71/57/1440687157.db2.gz	BFRUSKYHTIBKHA-IBGZPJMESA-N	0	3	337.467	3.278	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H]([C@@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001754798951	1440690143	/nfs/dbraw/zinc/69/01/43/1440690143.db2.gz	JBXWWRNICJEULM-NVXWUHKLSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@]1(CO)CCCN([C@H](C)c2ccccc2)C1	ZINC001754856610	1440700458	/nfs/dbraw/zinc/70/04/58/1440700458.db2.gz	NWYGZCANBXVJPI-DYESRHJHSA-N	0	3	344.499	3.293	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](CCN[C@H](C)c2cnc(C)cn2)C1	ZINC001754917409	1440708889	/nfs/dbraw/zinc/70/88/89/1440708889.db2.gz	OVRMVHNFKLATSO-SJORKVTESA-N	0	3	330.476	3.031	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCN(C(=O)c2cccc3[nH]ccc32)C1	ZINC001754932966	1440710832	/nfs/dbraw/zinc/71/08/32/1440710832.db2.gz	KCSGWQZJRMLAMU-AWEZNQCLSA-N	0	3	331.847	3.362	20	30		EGEDHN
C=C(C)CN(C)Cc1ccccc1CNC(=O)c1cc(OC)ccn1	ZINC001754946270	1440713171	/nfs/dbraw/zinc/71/31/71/1440713171.db2.gz	CFBJOOVFLNDYAZ-UHFFFAOYSA-N	0	3	339.439	3.028	20	30		EGEDHN
C=CCN(C)Cc1ccccc1CNC(=O)Cc1ccc2n[nH]cc2c1	ZINC001754946836	1440713490	/nfs/dbraw/zinc/71/34/90/1440713490.db2.gz	ZDVCTYFWMRZMGK-UHFFFAOYSA-N	0	3	348.450	3.040	20	30		EGEDHN
CC#CCN[C@@H](C)c1ccc(CNC(=O)c2ccncc2Cl)cc1	ZINC001754948656	1440714233	/nfs/dbraw/zinc/71/42/33/1440714233.db2.gz	MLEDGHCICJCCSC-AWEZNQCLSA-N	0	3	341.842	3.339	20	30		EGEDHN
C[C@]1(C(=O)NCC2(NCc3ccc(C#N)s3)CCC2)CC=CCC1	ZINC001754983573	1440721990	/nfs/dbraw/zinc/72/19/90/1440721990.db2.gz	YRMYGAMXVPWVJQ-SFHVURJKSA-N	0	3	343.496	3.495	20	30		EGEDHN
CC(C)[C@H](C)C(=O)NCC1(NCc2ccc(C#N)c(F)c2)CCC1	ZINC001754988320	1440723569	/nfs/dbraw/zinc/72/35/69/1440723569.db2.gz	ZKZWBAONYFEPFO-AWEZNQCLSA-N	0	3	331.435	3.118	20	30		EGEDHN
CC(F)(F)CCC(=O)N[C@H]1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC001755026538	1440729161	/nfs/dbraw/zinc/72/91/61/1440729161.db2.gz	RHRLLQHVLSCZAC-KRWDZBQOSA-N	0	3	349.425	3.464	20	30		EGEDHN
C[C@@H](CC(=O)N[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1)C1CC1	ZINC001755034805	1440733553	/nfs/dbraw/zinc/73/35/53/1440733553.db2.gz	ZKUNEFUALLNLAS-OXJNMPFZSA-N	0	3	339.483	3.465	20	30		EGEDHN
CN(CCCN(C)C(=O)[C@@H]1C[C@H]1C1CC1)Cc1ccc(F)c(C#N)c1	ZINC001755046218	1440741171	/nfs/dbraw/zinc/74/11/71/1440741171.db2.gz	YZBOFHXVJOBKDJ-ZWKOTPCHSA-N	0	3	343.446	3.024	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)CCC(F)(F)F)C1	ZINC001755047830	1440742263	/nfs/dbraw/zinc/74/22/63/1440742263.db2.gz	RBVQGOSSBCKOGC-LSDHHAIUSA-N	0	3	330.394	3.055	20	30		EGEDHN
C=CCC[C@@H](C)N1Cc2ccccc2C[C@@H]1CNC(=O)c1ccon1	ZINC001755073731	1440747583	/nfs/dbraw/zinc/74/75/83/1440747583.db2.gz	DQNSEPAJYFEFBP-CRAIPNDOSA-N	0	3	339.439	3.186	20	30		EGEDHN
C=CCC[C@@H](C)N1Cc2ccccc2C[C@H]1CNC(=O)c1ccon1	ZINC001755073733	1440747654	/nfs/dbraw/zinc/74/76/54/1440747654.db2.gz	DQNSEPAJYFEFBP-QAPCUYQASA-N	0	3	339.439	3.186	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)C3(COCC)CC3)cc2C1	ZINC001755102367	1440753429	/nfs/dbraw/zinc/75/34/29/1440753429.db2.gz	RKTVYXCMUQXPAM-UHFFFAOYSA-N	0	3	328.456	3.011	20	30		EGEDHN
C=CCCCN1Cc2ccc(CNC(=O)C3(F)CCOCC3)cc2C1	ZINC001755102548	1440753447	/nfs/dbraw/zinc/75/34/47/1440753447.db2.gz	XSVKZVDPVGPXGN-UHFFFAOYSA-N	0	3	346.446	3.103	20	30		EGEDHN
C=CCCC(=O)N1CCC(C)(NCc2csc([N+](=O)[O-])c2)CC1	ZINC001755128920	1440756717	/nfs/dbraw/zinc/75/67/17/1440756717.db2.gz	WEXLINPRGIHXRF-UHFFFAOYSA-N	0	3	337.445	3.093	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCN(C2CN(C[C@@H](C)CC(C)C)C2)CC1	ZINC001755145677	1440762817	/nfs/dbraw/zinc/76/28/17/1440762817.db2.gz	XFWHAEXDFWAAHD-SFHVURJKSA-N	0	3	349.563	3.099	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)/C=C\c2ccc[nH]2)CC1	ZINC001755181987	1440771213	/nfs/dbraw/zinc/77/12/13/1440771213.db2.gz	GBIYLLKAJKARCX-SREVYHEPSA-N	0	3	335.879	3.341	20	30		EGEDHN
C#CCCN[C@@H]1c2ccccc2C[C@H]1NC(=O)CCc1ccccc1	ZINC001755187414	1440773476	/nfs/dbraw/zinc/77/34/76/1440773476.db2.gz	GGYOWDBWQKOFOD-IFMALSPDSA-N	0	3	332.447	3.014	20	30		EGEDHN
CC/C(C)=C/C(=O)N1CCC[C@H]1CN(C)Cc1ccc(C#N)cc1	ZINC001755192405	1440775233	/nfs/dbraw/zinc/77/52/33/1440775233.db2.gz	FCLMVOLFUWLYJJ-BAILOTOSSA-N	0	3	325.456	3.337	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCN1C(=O)C1(C2CCC2)CCC1	ZINC001755196172	1440777116	/nfs/dbraw/zinc/77/71/16/1440777116.db2.gz	HHPHOBKYZBUNKU-GOSISDBHSA-N	0	3	334.504	3.082	20	30		EGEDHN
C[C@H](NCC#Cc1ccc(F)cc1)[C@H](C)NC(=O)c1sccc1F	ZINC001755234907	1440787922	/nfs/dbraw/zinc/78/79/22/1440787922.db2.gz	VWKNMPJDGJURKY-STQMWFEESA-N	0	3	348.418	3.174	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)[C@H](C)NCc2ccc(C#N)s2)CCC1	ZINC001755253078	1440792323	/nfs/dbraw/zinc/79/23/23/1440792323.db2.gz	OTGNLHZQFKNDOQ-UONOGXRCSA-N	0	3	331.485	3.349	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)c(F)c1)[C@@H](C)NC(=O)C(C1CC1)C1CC1	ZINC001755262552	1440794892	/nfs/dbraw/zinc/79/48/92/1440794892.db2.gz	LFVYDHKVCBXEHX-CHWSQXEVSA-N	0	3	343.446	3.116	20	30		EGEDHN
C[C@@H](NCC#Cc1ccccc1)[C@@H](C)NC(=O)C(C)(C)C(F)(F)F	ZINC001755262703	1440795137	/nfs/dbraw/zinc/79/51/37/1440795137.db2.gz	HOFNAGBHNNLZKA-ZIAGYGMSSA-N	0	3	340.389	3.109	20	30		EGEDHN
C[C@@H](NC(=O)C(C1CC1)C1CC1)[C@H](C)NCC#Cc1ccc(F)cc1	ZINC001755264375	1440795632	/nfs/dbraw/zinc/79/56/32/1440795632.db2.gz	WCXNBQDVUFQUHX-LSDHHAIUSA-N	0	3	342.458	3.096	20	30		EGEDHN
C=CCC1(C(=O)N(C)CC(C)(C)CNCc2nccnc2C)CCC1	ZINC001755285772	1440802100	/nfs/dbraw/zinc/80/21/00/1440802100.db2.gz	OTZDCXDQRJXYTQ-UHFFFAOYSA-N	0	3	344.503	3.106	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@H](C)N(C)Cc2cccc(C#N)c2)cc1C	ZINC001755324777	1440820951	/nfs/dbraw/zinc/82/09/51/1440820951.db2.gz	PURRKOAZHFRXRV-KRWDZBQOSA-N	0	3	335.451	3.425	20	30		EGEDHN
C=C(C)CCC(=O)NC1(CNCc2cc(OC)ccn2)CCCCC1	ZINC001755350815	1440827899	/nfs/dbraw/zinc/82/78/99/1440827899.db2.gz	HWCKSCXZJYCVQE-UHFFFAOYSA-N	0	3	345.487	3.355	20	30		EGEDHN
CC[C@@H](F)C(=O)NC1(CNCc2ccc(C#N)cc2F)CCCCC1	ZINC001755353216	1440828449	/nfs/dbraw/zinc/82/84/49/1440828449.db2.gz	DAHPETGDGQCLBA-MRXNPFEDSA-N	0	3	349.425	3.354	20	30		EGEDHN
C[C@@H](C#N)C(=O)N[C@H]1CN(Cc2cc3ccccc3s2)CC1(C)C	ZINC001755407364	1440844754	/nfs/dbraw/zinc/84/47/54/1440844754.db2.gz	OGBNNASBZMJXQE-GUYCJALGSA-N	0	3	341.480	3.388	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)[C@H](C)c2cccc(C)c2)C(C)(C)C1	ZINC001755411416	1440846674	/nfs/dbraw/zinc/84/66/74/1440846674.db2.gz	KQORRAWZZOFENB-MJGOQNOKSA-N	0	3	344.499	3.128	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)[C@@H](CC)Cc2cccc(C)c2)C(C)(C)C1	ZINC001755412762	1440847053	/nfs/dbraw/zinc/84/70/53/1440847053.db2.gz	XMUUKQLDCMEVTL-PMACEKPBSA-N	0	3	340.511	3.414	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@]2(C)CN(Cc3cncc(C)c3)C[C@@]2(C)C1	ZINC001755460953	1440857444	/nfs/dbraw/zinc/85/74/44/1440857444.db2.gz	QUQCZLVTDKEHPM-OYRHEFFESA-N	0	3	341.499	3.417	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC(N(C)Cc2c(C)noc2C)CC1	ZINC001755532486	1440867928	/nfs/dbraw/zinc/86/79/28/1440867928.db2.gz	PENXYFKGNUSIFU-MRXNPFEDSA-N	0	3	333.476	3.317	20	30		EGEDHN
C[C@@H]1CC[C@@H](C(=O)N2CCC(N(C)CC#Cc3ccccc3)CC2)C1	ZINC001755534414	1440868582	/nfs/dbraw/zinc/86/85/82/1440868582.db2.gz	LYYDDMWIBLPQCJ-UYAOXDASSA-N	0	3	338.495	3.397	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC(N(C)[C@H](C)c2cnccn2)CC1	ZINC001755534111	1440868644	/nfs/dbraw/zinc/86/86/44/1440868644.db2.gz	BOOVEEKWFAJTRV-OAHLLOKOSA-N	0	3	330.476	3.063	20	30		EGEDHN
C[C@H](CN(C)C(=O)CCC(F)F)NCC#Cc1ccc(Cl)cc1	ZINC001755595541	1440882619	/nfs/dbraw/zinc/88/26/19/1440882619.db2.gz	RAZCTGYFFAGVJW-CYBMUJFWSA-N	0	3	342.817	3.173	20	30		EGEDHN
C[C@@H](CN(C)C(=O)[C@H]1CCCC1(C)C)NCc1ccc(F)c(C#N)c1	ZINC001755601365	1440884208	/nfs/dbraw/zinc/88/42/08/1440884208.db2.gz	LKGRHNOKJBCSDZ-WMLDXEAASA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@H](CN(C)C(=O)C1CCC(F)CC1)NCc1ccc(F)c(C#N)c1	ZINC001755605179	1440885281	/nfs/dbraw/zinc/88/52/81/1440885281.db2.gz	HIAVRCJESYLPAO-BZOOQXSSSA-N	0	3	349.425	3.162	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@@H](CO)NCc1ccc2ccccc2c1	ZINC001755637550	1440890708	/nfs/dbraw/zinc/89/07/08/1440890708.db2.gz	BOVAHSBVNJHGME-FPOVZHCZSA-N	0	3	340.467	3.009	20	30		EGEDHN
Cc1ccccc1C(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@H]1C	ZINC001755649324	1440891189	/nfs/dbraw/zinc/89/11/89/1440891189.db2.gz	RXFNRTLZXMXARG-NQIIRXRSSA-N	0	3	332.447	3.239	20	30		EGEDHN
C[C@@H]1[C@@H](NCc2ccc(C#N)s2)CCN1C(=O)/C=C/C(C)(C)C	ZINC001755651636	1440891388	/nfs/dbraw/zinc/89/13/88/1440891388.db2.gz	HZVKWKOAMMITKI-BZXHDYIJSA-N	0	3	331.485	3.301	20	30		EGEDHN
CC#CCN1CC[C@]2(NC(=O)C/C=C\c3ccc(F)cc3)CCC[C@H]12	ZINC001755700012	1440899558	/nfs/dbraw/zinc/89/95/58/1440899558.db2.gz	BPUXJHKCGGKVSH-MCWJNKHQSA-N	0	3	340.442	3.366	20	30		EGEDHN
C#CCN1CC[C@@]2(NC(=O)CC(C3CCC3)C3CCC3)CCC[C@H]12	ZINC001755700811	1440899888	/nfs/dbraw/zinc/89/98/88/1440899888.db2.gz	LACZUMPKMCECLM-FPOVZHCZSA-N	0	3	328.500	3.339	20	30		EGEDHN
C#CCN1CC[C@]2(NC(=O)C[C@@H](C)c3ccc(F)cc3)CCC[C@@H]12	ZINC001755705313	1440902622	/nfs/dbraw/zinc/90/26/22/1440902622.db2.gz	WZFQRISWTXCFOC-XFQXTVEOSA-N	0	3	328.431	3.066	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H]3CCC[C@@H](NCc4ccon4)[C@@H]3C2)CCC1	ZINC001755709915	1440903489	/nfs/dbraw/zinc/90/34/89/1440903489.db2.gz	XBPITDMURSEGKI-CGTJXYLNSA-N	0	3	343.471	3.138	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)CCc2ccc(F)cc2F)[C@@H]1C	ZINC001755721355	1440907554	/nfs/dbraw/zinc/90/75/54/1440907554.db2.gz	NJWRSZSCDRTMPZ-KBXCAEBGSA-N	0	3	336.426	3.443	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](NCc2ccc(OC)c(F)c2)C(C)(C)C1	ZINC001755752238	1440913463	/nfs/dbraw/zinc/91/34/63/1440913463.db2.gz	FPXGJMCUAJDOSL-QGZVFWFLSA-N	0	3	334.435	3.127	20	30		EGEDHN
CCC[C@H](C)C(=O)N1C[C@@H](NCc2ccc(C#N)c(F)c2)C(C)(C)C1	ZINC001755753639	1440913544	/nfs/dbraw/zinc/91/35/44/1440913544.db2.gz	NXGCOXUSNWJKKE-KBXCAEBGSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@H](NCc2ccnc(OC)c2)C(C)(C)C1	ZINC001755763715	1440915633	/nfs/dbraw/zinc/91/56/33/1440915633.db2.gz	ITVCVGRGFACRCR-INIZCTEOSA-N	0	3	345.487	3.019	20	30		EGEDHN
CC(C)N(CCN(C)[C@H](C)c1ccc(F)cc1)C(=O)C#CC1CC1	ZINC001755810846	1440920116	/nfs/dbraw/zinc/92/01/16/1440920116.db2.gz	PFXNOKSEUXCJQK-MRXNPFEDSA-N	0	3	330.447	3.469	20	30		EGEDHN
CC(C)N(CCN(C)CCOC1CCCCCC1)C(=O)[C@@H](C)C#N	ZINC001755811512	1440920603	/nfs/dbraw/zinc/92/06/03/1440920603.db2.gz	XHXBXVLOVKOFEA-KRWDZBQOSA-N	0	3	337.508	3.054	20	30		EGEDHN
CC(C)(C)[C@@H](CNCc1cc(C#N)ccc1F)NC(=O)[C@@H]1CC1(C)C	ZINC001755820201	1440925390	/nfs/dbraw/zinc/92/53/90/1440925390.db2.gz	NULUZSDPMJKUNS-DOTOQJQBSA-N	0	3	345.462	3.364	20	30		EGEDHN
Cc1nsc(C)c1CNC[C@@H](NC(=O)C#CC(C)(C)C)C(C)(C)C	ZINC001755821812	1440925935	/nfs/dbraw/zinc/92/59/35/1440925935.db2.gz	JREBNICWWLDIBU-MRXNPFEDSA-N	0	3	349.544	3.430	20	30		EGEDHN
C=C(Br)CNC[C@@H](NC(=O)C1(CCF)CC1)C(C)(C)C	ZINC001755828531	1440927957	/nfs/dbraw/zinc/92/79/57/1440927957.db2.gz	KEEMFCQHKZQXFM-GFCCVEGCSA-N	0	3	349.288	3.155	20	30		EGEDHN
C#CCN1CCC([C@H](C)NC(=O)[C@H](C)c2cccc(Cl)c2)CC1	ZINC001755850680	1440934748	/nfs/dbraw/zinc/93/47/48/1440934748.db2.gz	MBGWVKANDSQKJG-CABCVRRESA-N	0	3	332.875	3.293	20	30		EGEDHN
C#CCN1CCC([C@H](C)NC(=O)[C@@H](C)Cc2ccccc2C)CC1	ZINC001755851198	1440934988	/nfs/dbraw/zinc/93/49/88/1440934988.db2.gz	QWIVWUAQOHZFPV-ROUUACIJSA-N	0	3	326.484	3.024	20	30		EGEDHN
C=CC(C)(C)C(=O)NCC1=CCN(Cc2cccc(COC)c2)CC1	ZINC001755890829	1440941299	/nfs/dbraw/zinc/94/12/99/1440941299.db2.gz	NOZNVZMJRMUAJF-UHFFFAOYSA-N	0	3	342.483	3.294	20	30		EGEDHN
CN(C)CCN(CCCc1ccccc1)C(=O)c1cc(C#N)cs1	ZINC000177442139	282093061	/nfs/dbraw/zinc/09/30/61/282093061.db2.gz	ZVZAQZBZWQHSKA-UHFFFAOYSA-N	0	3	341.480	3.256	20	30		EGEDHN
CN(C)CCOC1CCN(c2cc(C#N)ccc2C(F)(F)F)CC1	ZINC000355418985	282106959	/nfs/dbraw/zinc/10/69/59/282106959.db2.gz	LSWZTEUFKFWTIG-UHFFFAOYSA-N	0	3	341.377	3.124	20	30		EGEDHN
COc1ccc(CN[C@H](CN2CCCC2)c2ccccc2)cc1C#N	ZINC000174254108	231161107	/nfs/dbraw/zinc/16/11/07/231161107.db2.gz	FTNNCVGPHJGRTL-HXUWFJFHSA-N	0	3	335.451	3.494	20	30		EGEDHN
C[C@H](N[C@@H]1CC(=O)N(c2c(F)cccc2F)C1)c1cccc(C#N)c1	ZINC000181916066	234377882	/nfs/dbraw/zinc/37/78/82/234377882.db2.gz	IIIDWVNGUJXGDI-SWLSCSKDSA-N	0	3	341.361	3.293	20	30		EGEDHN
CCOc1ccc(CN(C)C(=O)C(C#N)Cc2ccc(C#N)cc2)cc1	ZINC000348023809	269673546	/nfs/dbraw/zinc/67/35/46/269673546.db2.gz	YKSMCZUILCDUKH-IBGZPJMESA-N	0	3	347.418	3.298	20	30		EGEDHN
N#Cc1cccc(COc2cccc(CN[C@@H]3C=C[C@H](CO)C3)c2)c1	ZINC000129809960	223094317	/nfs/dbraw/zinc/09/43/17/223094317.db2.gz	UHZOIVPUBOBOSK-AZUAARDMSA-N	0	3	334.419	3.164	20	30		EGEDHN
C[C@H](CNCc1cc(C#N)n(C)c1)Oc1ccccc1Br	ZINC000191285178	239014901	/nfs/dbraw/zinc/01/49/01/239014901.db2.gz	UXXLJEJRQPGJKA-GFCCVEGCSA-N	0	3	348.244	3.216	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNc1ncc(Br)cn1)C(C)C	ZINC000078582929	217080568	/nfs/dbraw/zinc/08/05/68/217080568.db2.gz	HLAJTQOAZNRLRS-CQSZACIVSA-N	0	3	339.281	3.350	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc(C#N)c(Cl)c2)CC1	ZINC000264345408	246381263	/nfs/dbraw/zinc/38/12/63/246381263.db2.gz	DCOQADLUGLEMQO-UHFFFAOYSA-N	0	3	332.835	3.374	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(N(C)CCCC)cc2)CC1	ZINC000264354816	246394550	/nfs/dbraw/zinc/39/45/50/246394550.db2.gz	DOBPJLVAZVUJGQ-UHFFFAOYSA-N	0	3	327.472	3.207	20	30		EGEDHN
C#CCCOc1ccc(CN[C@H](C)[C@H](O)c2ccc(F)cc2)cc1	ZINC000265243701	247333049	/nfs/dbraw/zinc/33/30/49/247333049.db2.gz	MGKFESJMVRJTMS-QRWLVFNGSA-N	0	3	327.399	3.440	20	30		EGEDHN
C[C@H](c1ccc(C#N)cc1)N1CCC[C@@H](C(=O)Nc2ccccn2)C1	ZINC000377719544	169067375	/nfs/dbraw/zinc/06/73/75/169067375.db2.gz	LQYJTKUHLFVECX-CRAIPNDOSA-N	0	3	334.423	3.365	20	30		EGEDHN
CN(C)C/C=C/C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1	ZINC000491883626	269684551	/nfs/dbraw/zinc/68/45/51/269684551.db2.gz	LCWABAYYFQHSER-QPJJXVBHSA-N	0	3	335.407	3.194	20	30		EGEDHN
C#CCOc1ccc([C@H](C)NC[C@@H](O)c2ccc(OC)cc2)cc1	ZINC000268761616	252211919	/nfs/dbraw/zinc/21/19/19/252211919.db2.gz	OBVJTVHVKFGFBB-MGPUTAFESA-N	0	3	325.408	3.091	20	30		EGEDHN
C[C@@H](NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1cccc(C#N)c1	ZINC000191831370	533422630	/nfs/dbraw/zinc/42/26/30/533422630.db2.gz	CNBWTRPQTZUAQT-XMSQKQJNSA-N	0	3	349.478	3.500	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)Nc1cccc(N2CCN(CC)CC2)c1)OCC	ZINC000274507763	135633323	/nfs/dbraw/zinc/63/33/23/135633323.db2.gz	WRCKGPGGFAZGBR-LJQANCHMSA-N	0	3	345.487	3.138	20	30		EGEDHN
CCCN(CCN1CCCCC1)C(=O)[C@H](C)Oc1ccc(C#N)cc1	ZINC000342794954	141149161	/nfs/dbraw/zinc/14/91/61/141149161.db2.gz	MRQBZWBBYPTPDF-KRWDZBQOSA-N	0	3	343.471	3.050	20	30		EGEDHN
CCO[C@H]1C[C@H](NCC(=O)Nc2oc(C)c(C)c2C#N)C1(CC)CC	ZINC000187051742	144151004	/nfs/dbraw/zinc/15/10/04/144151004.db2.gz	RYEFEKLWECVRAR-HOTGVXAUSA-N	0	3	347.459	3.280	20	30		EGEDHN
CN1CCCC(C)(C)[C@@H]1CNC(=O)CSCc1ccc(C#N)cc1	ZINC000344695847	144211092	/nfs/dbraw/zinc/21/10/92/144211092.db2.gz	GWDGUCUPJSGWSA-KRWDZBQOSA-N	0	3	345.512	3.028	20	30		EGEDHN
CCN1CCC[C@@H]1CNc1c(C#N)cnc2c(OC)cc(OC)cc21	ZINC000341281415	155227338	/nfs/dbraw/zinc/22/73/38/155227338.db2.gz	UMOCHGZKMXYVIG-CQSZACIVSA-N	0	3	340.427	3.020	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN1CCC(OC2CCCC2)CC1	ZINC000121114303	152325806	/nfs/dbraw/zinc/32/58/06/152325806.db2.gz	KJCUCEWGYJUKRS-UHFFFAOYSA-N	0	3	347.484	3.372	20	30		EGEDHN
Cc1ccccc1[C@H]([C@H](C)NC(=O)c1ccc(F)c(C#N)c1)N(C)C	ZINC000341566771	155360363	/nfs/dbraw/zinc/36/03/63/155360363.db2.gz	PJEWBLURQHTZGA-LIRRHRJNSA-N	0	3	339.414	3.427	20	30		EGEDHN
Cn1cc(CNCc2ccc(NC(=O)c3ccco3)cc2)cc1C#N	ZINC000190715337	153155347	/nfs/dbraw/zinc/15/53/47/153155347.db2.gz	KFGMNVDZXUGCCJ-UHFFFAOYSA-N	0	3	334.379	3.032	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](NC/C=C/c3ccc(F)cc3)C2=O)cc1	ZINC000192244597	153247402	/nfs/dbraw/zinc/24/74/02/153247402.db2.gz	SENJQGZAVHKDFF-IUINOXSKSA-N	0	3	349.409	3.101	20	30		EGEDHN
CC(C)N(Cc1cccs1)C[C@H](O)COc1ccc(C#N)cc1	ZINC000336865173	154221018	/nfs/dbraw/zinc/22/10/18/154221018.db2.gz	UXJPVUOXQUFSGX-INIZCTEOSA-N	0	3	330.453	3.270	20	30		EGEDHN
Cc1ccc2c(c1)[C@H]1CN(C)CC[C@H]1N2C(=O)c1cc(C#N)cs1	ZINC000267652822	292370360	/nfs/dbraw/zinc/37/03/60/292370360.db2.gz	VBESFAKUVBVCNP-NVXWUHKLSA-N	0	3	337.448	3.376	20	30		EGEDHN
COC[C@H]1CCCCN([C@H](C)C(=O)Nc2ccc(C#N)c(Cl)c2)C1	ZINC000342743652	163954725	/nfs/dbraw/zinc/95/47/25/163954725.db2.gz	QHZNUPLLHUEEHL-KGLIPLIRSA-N	0	3	349.862	3.287	20	30		EGEDHN
C[C@@H](N[C@@H](CN1CCOCC1)c1ccccc1)c1ccc(C#N)cc1	ZINC000181421288	287054168	/nfs/dbraw/zinc/05/41/68/287054168.db2.gz	KVNRIJWPCOMZLG-UTKZUKDTSA-N	0	3	335.451	3.282	20	30		EGEDHN
CN(C)c1ccccc1CNCc1cn(C)nc1-c1ccc(C#N)cc1	ZINC000350250462	165021615	/nfs/dbraw/zinc/02/16/15/165021615.db2.gz	NNRSSSLLHBERKC-UHFFFAOYSA-N	0	3	345.450	3.315	20	30		EGEDHN
C[C@@H]1CC[C@H](N(CCO)Cc2ccc(Br)cc2C#N)C1	ZINC000351652870	165116677	/nfs/dbraw/zinc/11/66/77/165116677.db2.gz	TVJZBDYPSYLFNX-WBMJQRKESA-N	0	3	337.261	3.304	20	30		EGEDHN
Cc1ccc(NC(=O)Cc2c(F)cccc2C#N)c(CN(C)C)c1	ZINC000353055992	165601572	/nfs/dbraw/zinc/60/15/72/165601572.db2.gz	TZYDHHGEFOQGOF-UHFFFAOYSA-N	0	3	325.387	3.249	20	30		EGEDHN
Cc1c2ccccc2n(C)c1CNCc1cnc2ccc(C#N)cn12	ZINC000355131602	166114289	/nfs/dbraw/zinc/11/42/89/166114289.db2.gz	ZSTLGMIHTDCSMH-UHFFFAOYSA-N	0	3	329.407	3.296	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)[C@H]1CCCC1(C)C	ZINC000355368798	166176516	/nfs/dbraw/zinc/17/65/16/166176516.db2.gz	LRPBDYKVKBKPDP-GOSISDBHSA-N	0	3	327.472	3.275	20	30		EGEDHN
CC[C@H]1CN(C(C)=O)[C@@H](CC)CN1CCCOc1cccc(C#N)c1	ZINC000357319467	166646613	/nfs/dbraw/zinc/64/66/13/166646613.db2.gz	VNLXGBXDUVEQJR-OALUTQOASA-N	0	3	343.471	3.048	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1CCC[C@@H](C[C@H]2CCOC2)C1	ZINC000367403347	168221065	/nfs/dbraw/zinc/22/10/65/168221065.db2.gz	OSTHAHCKFMHKFG-ZWKOTPCHSA-N	0	3	344.455	3.084	20	30		EGEDHN
CCN1CCN(c2cccc(Nc3ncc(C#N)cc3Cl)c2)CC1	ZINC000302247370	270044752	/nfs/dbraw/zinc/04/47/52/270044752.db2.gz	LGLVRZMLSNNWEN-UHFFFAOYSA-N	0	3	341.846	3.492	20	30		EGEDHN
COc1ccc([C@H](CNc2ccc(C#N)cc2F)N(C)C)cc1OC	ZINC000302544305	270044755	/nfs/dbraw/zinc/04/47/55/270044755.db2.gz	IGXQBANIWNHBEU-KRWDZBQOSA-N	0	3	343.402	3.429	20	30		EGEDHN
C[C@H](N[C@@H]1C[C@H](OC(C)(C)C)C1(C)C)C(=O)Nc1ccccc1C#N	ZINC000412090077	270046503	/nfs/dbraw/zinc/04/65/03/270046503.db2.gz	YOFOEXJAKWRALA-XKQJLSEDSA-N	0	3	343.471	3.457	20	30		EGEDHN
CSc1ccc(OC[C@H](O)CN(C)Cc2ccc(C#N)cc2)cc1	ZINC000411129503	270046669	/nfs/dbraw/zinc/04/66/69/270046669.db2.gz	GOWHVOGNIISVFK-QGZVFWFLSA-N	0	3	342.464	3.152	20	30		EGEDHN
COc1ccc(CN(CCN(C)C)Cc2ccsc2)cc1C#N	ZINC000459751622	270054822	/nfs/dbraw/zinc/05/48/22/270054822.db2.gz	QFIKQMFCYWGBNM-UHFFFAOYSA-N	0	3	329.469	3.192	20	30		EGEDHN
C/C(=C\c1ccccc1)CN(C)C[C@H](O)COc1ccc(C#N)cc1	ZINC000494272641	270058735	/nfs/dbraw/zinc/05/87/35/270058735.db2.gz	APXPARDMOBBJJT-KZFLWGQDSA-N	0	3	336.435	3.333	20	30		EGEDHN
Cc1ccc2c(c1)[C@@H](NC[C@@H](O)COc1ccccc1C#N)CCC2	ZINC000530235065	270060280	/nfs/dbraw/zinc/06/02/80/270060280.db2.gz	UOZVOOHVCSYDHS-QUCCMNQESA-N	0	3	336.435	3.274	20	30		EGEDHN
CC[C@@H](NC(=O)C(C#N)Cc1ccc(C#N)cc1)c1c(C)noc1C	ZINC000348316216	266369639	/nfs/dbraw/zinc/36/96/39/266369639.db2.gz	DVXZZPGBNQPOBH-DLBZAZTESA-N	0	3	336.395	3.113	20	30		EGEDHN
CCc1nc([C@@H](C)NC(=O)C(C#N)Cc2ccc(C#N)cc2)cs1	ZINC000280219566	266450206	/nfs/dbraw/zinc/45/02/06/266450206.db2.gz	AMFOUDZXLHVOCG-DOMZBBRYSA-N	0	3	338.436	3.137	20	30		EGEDHN
C[C@@H]1CCC[C@H]1CC(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000185908227	267018639	/nfs/dbraw/zinc/01/86/39/267018639.db2.gz	ITKGGIBGHPMLQY-APWZRJJASA-N	0	3	327.472	3.275	20	30		EGEDHN
C[C@@H]1CN(C(=O)C(C#N)Cc2ccc(C#N)cc2)Cc2ccccc2O1	ZINC000293962351	267041533	/nfs/dbraw/zinc/04/15/33/267041533.db2.gz	TYFSWVZBVOKFPO-DNVCBOLYSA-N	0	3	345.402	3.050	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CCN(C(=O)c2cccc(C#N)c2)C1	ZINC000324218893	267056068	/nfs/dbraw/zinc/05/60/68/267056068.db2.gz	YNQHYXGGKFCUJX-QGZVFWFLSA-N	0	3	333.435	3.152	20	30		EGEDHN
C[C@@H]1C[C@@H](c2cccnc2)N(CCC(=O)Nc2ccc(C#N)cc2)C1	ZINC000359867952	267083681	/nfs/dbraw/zinc/08/36/81/267083681.db2.gz	HDIVNIRRQIYZCU-BEFAXECRSA-N	0	3	334.423	3.365	20	30		EGEDHN
CCOC(=O)N1CCC([C@H](C)NCc2cccc(F)c2C#N)CC1	ZINC000497189338	267122358	/nfs/dbraw/zinc/12/23/58/267122358.db2.gz	GBBZKSSZOYSSEX-ZDUSSCGKSA-N	0	3	333.407	3.044	20	30		EGEDHN
C[C@H](CNc1c(C#N)cnc2ccccc21)N(C)Cc1ccccc1	ZINC000390632095	267157707	/nfs/dbraw/zinc/15/77/07/267157707.db2.gz	BBTGLSFGYLVPRO-MRXNPFEDSA-N	0	3	330.435	3.461	20	30		EGEDHN
C[C@H](NC1CCN(c2ccc(C#N)cc2)CC1)C(=O)Nc1ccccc1	ZINC000299353857	267180189	/nfs/dbraw/zinc/18/01/89/267180189.db2.gz	KUDIXRFBYAPEBY-INIZCTEOSA-N	0	3	348.450	3.144	20	30		EGEDHN
CC[C@H](N[C@@H](C)C(=O)NCCc1ccccc1)c1ccc(C#N)cc1	ZINC000453347513	267222775	/nfs/dbraw/zinc/22/27/75/267222775.db2.gz	NYTVAFZMBOJMNW-JXFKEZNVSA-N	0	3	335.451	3.346	20	30		EGEDHN
C[C@H]1CN(c2ccccc2CN(C)Cc2ccc(C#N)cc2)CCO1	ZINC000297763346	267238783	/nfs/dbraw/zinc/23/87/83/267238783.db2.gz	LSWGKFLMZYAGSK-KRWDZBQOSA-N	0	3	335.451	3.415	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1OC(F)F)[C@H](CO)CC(C)(C)C	ZINC000451781847	267314966	/nfs/dbraw/zinc/31/49/66/267314966.db2.gz	PSICSHPWFDMVHJ-AWEZNQCLSA-N	0	3	326.387	3.389	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@]12C[C@H]1CN(C(=O)OC(C)(C)C)C2	ZINC000496148535	267315387	/nfs/dbraw/zinc/31/53/87/267315387.db2.gz	DINIPSARUWEXQU-PXNSSMCTSA-N	0	3	341.455	3.247	20	30		EGEDHN
COC(=O)[C@H]1CN(Cc2ccc(C#N)c(C)c2)C[C@H]1c1ccccc1	ZINC000449752059	267386360	/nfs/dbraw/zinc/38/63/60/267386360.db2.gz	AXHNZFYHCTUYOH-PMACEKPBSA-N	0	3	334.419	3.255	20	30		EGEDHN
COC(=O)[C@]1(c2ccccc2)CCN([C@H](C)c2cccc(C#N)c2)C1	ZINC000428802733	267396988	/nfs/dbraw/zinc/39/69/88/267396988.db2.gz	HQWPIPJHKXFPCH-IIBYNOLFSA-N	0	3	334.419	3.436	20	30		EGEDHN
C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NCc1ccc(C#N)cc1F	ZINC000277740870	267857716	/nfs/dbraw/zinc/85/77/16/267857716.db2.gz	KDDUURGTFRYALG-GUYCJALGSA-N	0	3	347.434	3.432	20	30		EGEDHN
Cc1ccc([C@@H](CNC(=O)C2(c3cccc(C#N)c3)CC2)N(C)C)cc1	ZINC000435013427	268043781	/nfs/dbraw/zinc/04/37/81/268043781.db2.gz	YBMGYWFFTWMCKJ-HXUWFJFHSA-N	0	3	347.462	3.317	20	30		EGEDHN
Cc1cccc2c1CN(CCC(=O)Nc1sccc1C#N)CC2	ZINC000429556606	268058442	/nfs/dbraw/zinc/05/84/42/268058442.db2.gz	ALUZLELQSFEZHI-UHFFFAOYSA-N	0	3	325.437	3.315	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CCC(C(F)(F)F)CC2)cc1	ZINC000280643890	268088800	/nfs/dbraw/zinc/08/88/00/268088800.db2.gz	ZRZDURNRQWPZRG-CQSZACIVSA-N	0	3	335.329	3.041	20	30		EGEDHN
N#Cc1ccc(OCCN[C@H](CCO)c2ccc(Cl)cc2)cc1	ZINC000287114628	268176225	/nfs/dbraw/zinc/17/62/25/268176225.db2.gz	YRGUUUZKJRCKBC-GOSISDBHSA-N	0	3	330.815	3.304	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)cc1F	ZINC000425344289	268224131	/nfs/dbraw/zinc/22/41/31/268224131.db2.gz	CICCHFQYXDKSIN-PZJWPPBQSA-N	0	3	335.426	3.404	20	30		EGEDHN
N#Cc1cccc(OCCCN2CC[C@H](OCc3ccncc3)C2)c1	ZINC000280951387	268273436	/nfs/dbraw/zinc/27/34/36/268273436.db2.gz	ISZZMPUAKRXLPI-FQEVSTJZSA-N	0	3	337.423	3.013	20	30		EGEDHN
N#Cc1cccc(OCCN[C@@H](CCO)c2ccc(Cl)cc2)c1	ZINC000287019829	268274891	/nfs/dbraw/zinc/27/48/91/268274891.db2.gz	RGUKHFKKEIWMGG-SFHVURJKSA-N	0	3	330.815	3.304	20	30		EGEDHN
N#Cc1ccccc1-c1ccc(CN2CCC3(COC(=O)N3)CC2)cc1	ZINC000495293128	268294838	/nfs/dbraw/zinc/29/48/38/268294838.db2.gz	YXJHDELFOMUCAX-UHFFFAOYSA-N	0	3	347.418	3.300	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CN1CCC[C@H](c2ccccc2)C1	ZINC000528513459	268295862	/nfs/dbraw/zinc/29/58/62/268295862.db2.gz	UCLRACDKOGSRIA-PMACEKPBSA-N	0	3	336.435	3.178	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CN1CCC(c2ccsc2)CC1	ZINC000528457689	268299114	/nfs/dbraw/zinc/29/91/14/268299114.db2.gz	GDUGOWIJXCBJJV-GOSISDBHSA-N	0	3	342.464	3.239	20	30		EGEDHN
Cc1c(C)n(C2CCCC2)c(NC(=O)CSCCN(C)C)c1C#N	ZINC000339740800	280223642	/nfs/dbraw/zinc/22/36/42/280223642.db2.gz	LVDXZLKJVMLRFA-UHFFFAOYSA-N	0	3	348.516	3.325	20	30		EGEDHN
CC1CCN([C@@H](CNc2ccnc(C#N)c2)c2cccs2)CC1	ZINC000341344448	281833863	/nfs/dbraw/zinc/83/38/63/281833863.db2.gz	NQRHEDNSTZOAFA-KRWDZBQOSA-N	0	3	326.469	3.322	20	30		EGEDHN
CCc1ccccc1C(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000127073208	307578612	/nfs/dbraw/zinc/57/86/12/307578612.db2.gz	FEQFXBCMJJNZAN-UHFFFAOYSA-N	0	3	335.451	3.325	20	30		EGEDHN
N#Cc1cc(Br)ccc1N1CC[C@H](N2CCCCC2)C1	ZINC000130450049	307628709	/nfs/dbraw/zinc/62/87/09/307628709.db2.gz	HVXLESPRUYZGOR-HNNXBMFYSA-N	0	3	334.261	3.385	20	30		EGEDHN
CN(C)Cc1ccccc1NC(=O)c1cnc(C(F)(F)F)c(C#N)c1	ZINC000549721338	315101723	/nfs/dbraw/zinc/10/17/23/315101723.db2.gz	TYZBULFQQZOAAW-UHFFFAOYSA-N	0	3	348.328	3.286	20	30		EGEDHN
C[C@@H](CC(=O)NCCc1ccccc1)NC1(c2cccc(C#N)c2)CC1	ZINC000551818997	315170630	/nfs/dbraw/zinc/17/06/30/315170630.db2.gz	VVPGHESZKPRTQE-KRWDZBQOSA-N	0	3	347.462	3.274	20	30		EGEDHN
N#Cc1cnn2cc(CNCCc3cccc4ccccc43)cnc12	ZINC000555552213	315390028	/nfs/dbraw/zinc/39/00/28/315390028.db2.gz	LBRINYKILXFRSU-UHFFFAOYSA-N	0	3	327.391	3.086	20	30		EGEDHN
Cc1cc(N2CCN(c3ccnc4ccccc43)CC2)c(C#N)cn1	ZINC000563241937	315984012	/nfs/dbraw/zinc/98/40/12/315984012.db2.gz	LCEXTIXUICAGBB-UHFFFAOYSA-N	0	3	329.407	3.137	20	30		EGEDHN
CC1(C)C[C@@H](NC[C@H](O)COc2ccc(C#N)cc2)c2ccccc21	ZINC000564854044	316218996	/nfs/dbraw/zinc/21/89/96/316218996.db2.gz	KJSAYLRUFYNWSK-OXJNMPFZSA-N	0	3	336.435	3.310	20	30		EGEDHN
CN(Cc1cnc2c(C#N)cnn2c1)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000565775158	316368429	/nfs/dbraw/zinc/36/84/29/316368429.db2.gz	IJYSKCPZCOBBNJ-MOPGFXCFSA-N	0	3	331.423	3.369	20	30		EGEDHN
N#Cc1cccc([C@@H]2C[C@H]2C(=O)N[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000570779428	317106218	/nfs/dbraw/zinc/10/62/18/317106218.db2.gz	CLWSJRVVRYCKHX-PCCBWWKXSA-N	0	3	345.446	3.052	20	30		EGEDHN
CN(CCc1ccc(Cl)cc1)C[C@H](O)COc1ccc(C#N)cc1	ZINC000172079695	323268878	/nfs/dbraw/zinc/26/88/78/323268878.db2.gz	LNADYHMBFKBNDN-SFHVURJKSA-N	0	3	344.842	3.126	20	30		EGEDHN
CC[C@@H](NCCS(=O)(=O)c1ccc(C#N)cc1)c1ccc(C)cc1	ZINC000176880729	323334228	/nfs/dbraw/zinc/33/42/28/323334228.db2.gz	PNRBAXLWANCYMJ-LJQANCHMSA-N	0	3	342.464	3.381	20	30		EGEDHN
CN(C[C@@H](O)CNc1cccc(Oc2ccc(C#N)cc2)c1)C1CC1	ZINC000580770320	325294117	/nfs/dbraw/zinc/29/41/17/325294117.db2.gz	YAMQJBGFLXKLBI-SFHVURJKSA-N	0	3	337.423	3.218	20	30		EGEDHN
N#Cc1ccc([C@H](N[C@@H]2CC[C@@H](c3ccc(F)cc3)C2)C(N)=O)cc1	ZINC000580987021	325317199	/nfs/dbraw/zinc/31/71/99/325317199.db2.gz	BQSBMUIDSKDECO-QRQLOZEOSA-N	0	3	337.398	3.150	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](NCc3cccc(C4CC4)c3)C2=O)cc1	ZINC000581878091	325395804	/nfs/dbraw/zinc/39/58/04/325395804.db2.gz	PZPDRKVSJWQBFB-NRFANRHFSA-N	0	3	345.446	3.326	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@H](NCCNc1ccc3ccccc3n1)CC2	ZINC000581913587	325398166	/nfs/dbraw/zinc/39/81/66/325398166.db2.gz	PYRMSVQMRDCQGC-HXUWFJFHSA-N	0	3	328.419	3.217	20	30		EGEDHN
CC[C@H](CC#N)NC(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000157729837	455225943	/nfs/dbraw/zinc/22/59/43/455225943.db2.gz	AKLJGKKOBWLUQQ-MRXNPFEDSA-N	0	3	344.459	3.365	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1C[C@H](C)S[C@@H](C)C1)C(C)C	ZINC000525295179	459444554	/nfs/dbraw/zinc/44/45/54/459444554.db2.gz	XXCPYYLFLKNMKO-YESZJQIVSA-N	0	3	339.549	3.220	20	30		EGEDHN
CCCCc1ccc([C@H](C)NCCNC(=O)C2N=CC=CC2=O)cc1	ZINC000180865830	455258456	/nfs/dbraw/zinc/25/84/56/455258456.db2.gz	XRPSJQYKAHOJJI-DNTCVELPSA-N	0	3	341.455	3.206	20	30		EGEDHN
C=CC[C@@H](C)N[C@H](C)c1ccc(S(=O)(=O)C(F)F)c(OC)c1	ZINC000180949533	455268047	/nfs/dbraw/zinc/26/80/47/455268047.db2.gz	UMRYHDDVIMWELX-GHMZBOCLSA-N	0	3	333.400	3.307	20	30		EGEDHN
C#CCCCC(=O)Nc1ccnn1[C@@H]1CCN(Cc2ccccc2)C1	ZINC000190446718	455319959	/nfs/dbraw/zinc/31/99/59/455319959.db2.gz	SENPIWYLIOXRSI-GOSISDBHSA-N	0	3	336.439	3.072	20	30		EGEDHN
C=CCCOCC(=O)NC[C@@H](c1ccccc1)N1CCC(C)CC1	ZINC000620206321	460572472	/nfs/dbraw/zinc/57/24/72/460572472.db2.gz	XTPHLSDUUUFFLM-IBGZPJMESA-N	0	3	330.472	3.169	20	30		EGEDHN
CN(C)CCNC(=S)Nc1ccc(-c2nc3ccccc3[nH]2)cc1	ZINC000006314103	452933230	/nfs/dbraw/zinc/93/32/30/452933230.db2.gz	HHJKGHLPDBGQBK-UHFFFAOYSA-N	0	3	339.468	3.489	20	30		EGEDHN
CC[C@H]1CN(CCC(=O)Nc2ccc(C#N)c(Cl)c2)CCS1	ZINC000173925775	455341575	/nfs/dbraw/zinc/34/15/75/455341575.db2.gz	OLRVEVGKBKZQIU-AWEZNQCLSA-N	0	3	337.876	3.368	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1CNCc1cc(C)c(Br)cn1	ZINC000623512623	460590504	/nfs/dbraw/zinc/59/05/04/460590504.db2.gz	OVRWJOXUTCGARQ-SWLSCSKDSA-N	0	3	325.250	3.223	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN(C)Cc1cccc(C#N)c1	ZINC000027207946	453812817	/nfs/dbraw/zinc/81/28/17/453812817.db2.gz	KTQZLIWIWLABIJ-FQEVSTJZSA-N	0	3	336.435	3.158	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](C)c2c(F)cccc2Cl)CC1	ZINC000081493742	453877465	/nfs/dbraw/zinc/87/74/65/453877465.db2.gz	JJJYUIHGUSZLPT-LBPRGKRZSA-N	0	3	339.842	3.490	20	30		EGEDHN
N#Cc1ccc(/C=C/C(=O)N2CCCN(Cc3ccccc3)CC2)cc1	ZINC000053721313	453894631	/nfs/dbraw/zinc/89/46/31/453894631.db2.gz	BZNISHLCONTKTN-VAWYXSNFSA-N	0	3	345.446	3.306	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN(C)C2CCCC2)cc1	ZINC000053844187	453898403	/nfs/dbraw/zinc/89/84/03/453898403.db2.gz	PDSJLXBSXMRPNB-UHFFFAOYSA-N	0	3	329.444	3.206	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H](c2ccc(Cl)cc2)C(C)C)CC1	ZINC000067707217	453959324	/nfs/dbraw/zinc/95/93/24/453959324.db2.gz	CSQJEZZFDOTFOG-GOSISDBHSA-N	0	3	332.875	3.499	20	30		EGEDHN
C#CCN1CCC(C(=O)NCC(C)(C)c2ccccc2Cl)CC1	ZINC000076194760	453977925	/nfs/dbraw/zinc/97/79/25/453977925.db2.gz	HBOOVKKBXVQHDL-UHFFFAOYSA-N	0	3	332.875	3.079	20	30		EGEDHN
Cc1cc([C@H](NC2CCN(CC#N)CC2)c2cccnc2)ccc1F	ZINC000612409836	460623569	/nfs/dbraw/zinc/62/35/69/460623569.db2.gz	UBDQBRTXFDXBBG-FQEVSTJZSA-N	0	3	338.430	3.196	20	30		EGEDHN
CC(C)N1CCCN(C(=O)Nc2cc(C#N)cn2C(C)(C)C)CC1	ZINC000069224720	454088329	/nfs/dbraw/zinc/08/83/29/454088329.db2.gz	CWAFIHTUYJHKPV-UHFFFAOYSA-N	0	3	331.464	3.063	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Nc1c(C)noc1CC)C(C)C	ZINC000089416194	454146244	/nfs/dbraw/zinc/14/62/44/454146244.db2.gz	ZWPACOOOUJRDCS-OAHLLOKOSA-N	0	3	334.464	3.366	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)C(=O)NC1CCN(C2CC2)CC1	ZINC000045409894	454158270	/nfs/dbraw/zinc/15/82/70/454158270.db2.gz	DGOXZLPPGYZGEC-UHFFFAOYSA-N	0	3	340.471	3.107	20	30		EGEDHN
C[C@H](c1ccc(F)c(F)c1)N(C)C[C@H](O)COc1ccc(C#N)cc1	ZINC000045492586	454163539	/nfs/dbraw/zinc/16/35/39/454163539.db2.gz	RDYCDNRIMOXPPU-CJNGLKHVSA-N	0	3	346.377	3.269	20	30		EGEDHN
FC(F)(F)c1ccc(C#CCN2CCC[C@@H](Cn3ccnn3)C2)cc1	ZINC000119625523	454208656	/nfs/dbraw/zinc/20/86/56/454208656.db2.gz	SJPDYSFQYFREAD-MRXNPFEDSA-N	0	3	348.372	3.061	20	30		EGEDHN
COC(=O)c1ccc(CN2CCCN(c3ccccc3C#N)CC2)cc1	ZINC000046086402	454215826	/nfs/dbraw/zinc/21/58/26/454215826.db2.gz	OIZFWNQFUUGJDO-UHFFFAOYSA-N	0	3	349.434	3.057	20	30		EGEDHN
C=CCc1ccc(OC[C@H](O)CN(C)Cc2ccccc2)c(OC)c1	ZINC000046344824	454243268	/nfs/dbraw/zinc/24/32/68/454243268.db2.gz	WLXFMHZDDFZCDR-LJQANCHMSA-N	0	3	341.451	3.295	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)c1cc(F)ccc1F	ZINC000047011044	454318801	/nfs/dbraw/zinc/31/88/01/454318801.db2.gz	RCVLFLLHQMVFMU-UHFFFAOYSA-N	0	3	343.377	3.040	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000079097699	454368527	/nfs/dbraw/zinc/36/85/27/454368527.db2.gz	TUFVOULELLVNSB-LJQANCHMSA-N	0	3	336.435	3.256	20	30		EGEDHN
C[C@H](CO)SCC(=O)C(C#N)c1nc(-c2ccccc2)cs1	ZINC000079099157	454368562	/nfs/dbraw/zinc/36/85/62/454368562.db2.gz	PVAFUALCZPMCLA-DGCLKSJQSA-N	0	3	332.450	3.100	20	30		EGEDHN
CC[C@H](N[C@@H]1CCCN(c2ccc(C#N)cc2F)C1)c1cnn(C)c1	ZINC000097016861	454387337	/nfs/dbraw/zinc/38/73/37/454387337.db2.gz	PRNBPWOIAQJXHT-AEFFLSMTSA-N	0	3	341.434	3.141	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(F)cc1	ZINC000047671739	454397695	/nfs/dbraw/zinc/39/76/95/454397695.db2.gz	GUZZKIJKCJFQSY-UHFFFAOYSA-N	0	3	340.402	3.293	20	30		EGEDHN
C=CCc1cc(CN2CCC[C@@H](c3cc[nH]n3)C2)cc(OC)c1O	ZINC000121208749	454405843	/nfs/dbraw/zinc/40/58/43/454405843.db2.gz	JUASPTDWPBUSDR-MRXNPFEDSA-N	0	3	327.428	3.232	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cccc(SCC#N)c2)CC1	ZINC000079542197	454434849	/nfs/dbraw/zinc/43/48/49/454434849.db2.gz	YAMFNKRUWKIMBU-UHFFFAOYSA-N	0	3	329.469	3.073	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CN[C@H]1CCC[C@@H]1c1ccccc1	ZINC000133754383	454464369	/nfs/dbraw/zinc/46/43/69/454464369.db2.gz	GKLCUJXTSNARDN-CVEARBPZSA-N	0	3	325.437	3.484	20	30		EGEDHN
CC(C)N(CCC(=O)Nc1sccc1C#N)Cc1ccccn1	ZINC000048272863	454465859	/nfs/dbraw/zinc/46/58/59/454465859.db2.gz	KLGPYDRJRFBHBO-UHFFFAOYSA-N	0	3	328.441	3.254	20	30		EGEDHN
C[C@@H]1CCc2c(C(=O)C(C#N)C(=O)Nc3ccccn3)csc2C1	ZINC000102387398	454502926	/nfs/dbraw/zinc/50/29/26/454502926.db2.gz	VCPROIRKSMYFKZ-DGCLKSJQSA-N	0	3	339.420	3.229	20	30		EGEDHN
N#CC(C(=O)c1cnn(-c2ccccc2)c1)c1nc2ccccc2[nH]1	ZINC000073972437	454509499	/nfs/dbraw/zinc/50/94/99/454509499.db2.gz	XHEFODPXZUBCBW-OAHLLOKOSA-N	0	3	327.347	3.239	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@]2(C)CCc3ccccc3C2)CC1	ZINC000080079884	454529225	/nfs/dbraw/zinc/52/92/25/454529225.db2.gz	FWLVXCSDCHXBLQ-OAQYLSRUSA-N	0	3	326.484	3.338	20	30		EGEDHN
C[C@H]1CCCN(C(C)(C)CNC(=O)CSc2ccc(C#N)cc2)C1	ZINC000103073879	454534835	/nfs/dbraw/zinc/53/48/35/454534835.db2.gz	JRIBFNHGPNAMIQ-HNNXBMFYSA-N	0	3	345.512	3.277	20	30		EGEDHN
Cc1cccc(CN(CCN(C)C)C(=O)CCc2ccc(C#N)cc2)c1	ZINC000103113828	454537320	/nfs/dbraw/zinc/53/73/20/454537320.db2.gz	CYVNFNAWQYBKQI-UHFFFAOYSA-N	0	3	349.478	3.390	20	30		EGEDHN
C=CCOCCCC(=O)N1c2ccc(C)cc2[C@@H]2CN(C)CC[C@@H]21	ZINC000074238917	454549397	/nfs/dbraw/zinc/54/93/97/454549397.db2.gz	LSBMJZFVGQDXIY-HKUYNNGSSA-N	0	3	328.456	3.112	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)OC(C)(C)C)CCN1Cc1ccc(C#N)cc1	ZINC000134641597	454572568	/nfs/dbraw/zinc/57/25/68/454572568.db2.gz	JBFHLCWEXSORQD-YOEHRIQHSA-N	0	3	329.444	3.436	20	30		EGEDHN
CCOCCN(CC)Cc1cn(CCC#N)nc1-c1ccccc1	ZINC000092537614	454582565	/nfs/dbraw/zinc/58/25/65/454582565.db2.gz	IBSPJKFGBQDFEJ-UHFFFAOYSA-N	0	3	326.444	3.322	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)CN[C@@H](c1ccc(F)cc1)C1CCC1	ZINC000104706110	454596319	/nfs/dbraw/zinc/59/63/19/454596319.db2.gz	NCAREDPPXXZWNF-RTBURBONSA-N	0	3	331.435	3.311	20	30		EGEDHN
COc1cccc(CN(CCCSCC#N)C[C@@H]2CCCO2)c1	ZINC000080632795	454610137	/nfs/dbraw/zinc/61/01/37/454610137.db2.gz	MBOUETJLLALRDE-SFHVURJKSA-N	0	3	334.485	3.323	20	30		EGEDHN
CCCNC(=O)[C@@H]1CCCN(Cc2cccc(OCCCC#N)c2)C1	ZINC000092733980	454619331	/nfs/dbraw/zinc/61/93/31/454619331.db2.gz	WCETXFYLOMPLCV-GOSISDBHSA-N	0	3	343.471	3.107	20	30		EGEDHN
Cc1cccc(CCC(=O)N(CCN(C)C)Cc2cccc(C#N)c2)c1	ZINC000065930834	454640737	/nfs/dbraw/zinc/64/07/37/454640737.db2.gz	NQNGLIFGWSBCIR-UHFFFAOYSA-N	0	3	349.478	3.390	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)c1cccc(Cl)c1	ZINC000065931221	454640841	/nfs/dbraw/zinc/64/08/41/454640841.db2.gz	WCNLMXOCSWDYAL-UHFFFAOYSA-N	0	3	341.842	3.416	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccnc(OC3CCCCC3)c2)CC1	ZINC000092897222	454651269	/nfs/dbraw/zinc/65/12/69/454651269.db2.gz	JKXDMGFSQXNZGY-UHFFFAOYSA-N	0	3	343.471	3.173	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Cc2cn(CC)c3ccccc23)CC1	ZINC000106035572	454674324	/nfs/dbraw/zinc/67/43/24/454674324.db2.gz	RQVZSEOJNYYSSN-UHFFFAOYSA-N	0	3	339.483	3.360	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Cc2csc(C(C)(C)C)n2)CC1	ZINC000106035246	454674347	/nfs/dbraw/zinc/67/43/47/454674347.db2.gz	UJDWQORCXPMZRT-UHFFFAOYSA-N	0	3	335.517	3.140	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCc2ccccc2OCC)CC1	ZINC000106039004	454676052	/nfs/dbraw/zinc/67/60/52/454676052.db2.gz	PTXHAJUZFATUNH-UHFFFAOYSA-N	0	3	330.472	3.175	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000066317722	454684281	/nfs/dbraw/zinc/68/42/81/454684281.db2.gz	HCBBLLRRXWZKHG-QGZVFWFLSA-N	0	3	330.472	3.057	20	30		EGEDHN
CN(CCC#N)c1ccc(CN2CCc3ccccc3[C@@H]2CO)cc1	ZINC000093455544	454716461	/nfs/dbraw/zinc/71/64/61/454716461.db2.gz	NOZYLNFGYPFRKD-NRFANRHFSA-N	0	3	335.451	3.128	20	30		EGEDHN
Cc1cscc1C(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000176245898	454716789	/nfs/dbraw/zinc/71/67/89/454716789.db2.gz	ULCFNBRINLZAKA-UHFFFAOYSA-N	0	3	327.453	3.132	20	30		EGEDHN
COc1ccc(CN2CC[C@H]3OCCC[C@@H]3C2)cc1OCCCC#N	ZINC000093507161	454719506	/nfs/dbraw/zinc/71/95/06/454719506.db2.gz	GVINYLXQBXITAT-QZTJIDSGSA-N	0	3	344.455	3.379	20	30		EGEDHN
COc1ccccc1N(CCC#N)C(=O)[C@@H](C)N1C[C@@H]2CCC[C@@H]2C1	ZINC000152764383	454722513	/nfs/dbraw/zinc/72/25/13/454722513.db2.gz	XDQVNLQTRNJQKX-ZACQAIPSSA-N	0	3	341.455	3.062	20	30		EGEDHN
C=CCNc1ncc(C(=O)NC[C@H](c2ccc(C)cc2)N(C)C)s1	ZINC000136222426	454730259	/nfs/dbraw/zinc/73/02/59/454730259.db2.gz	URTIKYXGDNGZIW-OAHLLOKOSA-N	0	3	344.484	3.082	20	30		EGEDHN
N#CC1CCN(CCC(=O)Nc2ccccc2C(F)(F)F)CC1	ZINC000136901748	454760353	/nfs/dbraw/zinc/76/03/53/454760353.db2.gz	YWBYUXWUBSGMSY-UHFFFAOYSA-N	0	3	325.334	3.270	20	30		EGEDHN
Cc1cccc(N(CCC#N)C(=O)CN2C[C@H]3CCC[C@@H]3C2)c1C	ZINC000153199910	454769708	/nfs/dbraw/zinc/76/97/08/454769708.db2.gz	SGBLDBORVKANJS-QZTJIDSGSA-N	0	3	325.456	3.282	20	30		EGEDHN
C[C@H]1CCCN(C(C)(C)CNC(=O)c2c(F)cc(C#N)cc2F)C1	ZINC000125822122	454849978	/nfs/dbraw/zinc/84/99/78/454849978.db2.gz	KGJWDDSWWCOWFY-LBPRGKRZSA-N	0	3	335.398	3.077	20	30		EGEDHN
C[C@H](C(=O)N1CCC(C#N)CC1)N1CCC(Cc2ccccc2)CC1	ZINC000110673066	454851373	/nfs/dbraw/zinc/85/13/73/454851373.db2.gz	HFEVUCPOZPPRLT-QGZVFWFLSA-N	0	3	339.483	3.092	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC[C@@H]2CCc3ccccc32)CC1	ZINC000111859401	454876709	/nfs/dbraw/zinc/87/67/09/454876709.db2.gz	BLXVNGJCPXJHIT-KRWDZBQOSA-N	0	3	327.472	3.056	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ncoc2-c2ccccc2)CC1	ZINC000112047333	454880340	/nfs/dbraw/zinc/88/03/40/454880340.db2.gz	DFENIPNBUHLDBN-UHFFFAOYSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN2CCC[C@H]2CN2CCCC2)c1C	ZINC000177598621	454881405	/nfs/dbraw/zinc/88/14/05/454881405.db2.gz	ULYBEAPQTQRTCA-SFHVURJKSA-N	0	3	329.488	3.034	20	30		EGEDHN
CCC1(CC)[C@H](OC)C[C@@H]1NCC(=O)N(CCC#N)c1ccccc1	ZINC000191380998	455482103	/nfs/dbraw/zinc/48/21/03/455482103.db2.gz	NPSQTSQYDZPNEQ-ZWKOTPCHSA-N	0	3	343.471	3.117	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)OC(C)(C)C)CC1	ZINC000166048342	454907363	/nfs/dbraw/zinc/90/73/63/454907363.db2.gz	YIAYSHQCNLIGOM-UHFFFAOYSA-N	0	3	333.270	3.321	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N(C)C1CCN(Cc2ccccc2)CC1	ZINC000113094489	454913292	/nfs/dbraw/zinc/91/32/92/454913292.db2.gz	OYVIDCZIXUNREK-QGZVFWFLSA-N	0	3	330.472	3.091	20	30		EGEDHN
C=CCc1cc(CN2CCN(C3CCCC3)CC2)cc(OC)c1O	ZINC000126966033	454929199	/nfs/dbraw/zinc/92/91/99/454929199.db2.gz	QIZXPCIJFVMZBC-UHFFFAOYSA-N	0	3	330.472	3.190	20	30		EGEDHN
CO/N=C/c1ccc(C(=O)Nc2ccc(C)cc2CN(C)C)cc1	ZINC000113911907	454938125	/nfs/dbraw/zinc/93/81/25/454938125.db2.gz	UOAOCPCQBKXYNZ-UDWIEESQSA-N	0	3	325.412	3.289	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H]2CCC[C@@H](SCC)C2)CC1	ZINC000175739704	455490478	/nfs/dbraw/zinc/49/04/78/455490478.db2.gz	URWUKNBVIDDCNX-DLBZAZTESA-N	0	3	339.549	3.390	20	30		EGEDHN
CCOc1cccc(/C=N/C2CCN(CCOC(C)C)CC2)c1O	ZINC000178298571	454946485	/nfs/dbraw/zinc/94/64/85/454946485.db2.gz	HGCCXXVKIYHKLR-XSFVSMFZSA-N	0	3	334.460	3.099	20	30		EGEDHN
C=CCC[C@@H](NCCS(=O)(=O)c1ccc(Cl)cc1)C1CC1	ZINC000178683337	454966954	/nfs/dbraw/zinc/96/69/54/454966954.db2.gz	CTNIOENANNSTCG-MRXNPFEDSA-N	0	3	327.877	3.448	20	30		EGEDHN
N#Cc1ccc(CNC(=O)NC[C@@H]2CCCN2Cc2ccccc2)cc1	ZINC000114784045	454978052	/nfs/dbraw/zinc/97/80/52/454978052.db2.gz	HZZKMNHQWJZVFO-FQEVSTJZSA-N	0	3	348.450	3.022	20	30		EGEDHN
C=CCN(CCc1ccccc1)C(=O)N[C@@H]1C[C@@H](C)N(C2CC2)C1	ZINC000127619145	454982888	/nfs/dbraw/zinc/98/28/88/454982888.db2.gz	BUUFVPZWGZBHHT-SJLPKXTDSA-N	0	3	327.472	3.052	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H]2[C@@H]3CCc4ccccc4[C@@H]32)CC1	ZINC000127943666	455011916	/nfs/dbraw/zinc/01/19/16/455011916.db2.gz	IFVMKPGFVGRNTR-AABGKKOBSA-N	0	3	339.483	3.055	20	30		EGEDHN
Cc1cc(C(=O)C(C#N)c2nnc3n2CCCCC3)ccc1Cl	ZINC000151755192	455026104	/nfs/dbraw/zinc/02/61/04/455026104.db2.gz	VILDYVAUEJAMMV-ZDUSSCGKSA-N	0	3	328.803	3.456	20	30		EGEDHN
C#CCCCCC(=O)Nc1cccc(N2CCN(CC3CC3)CC2)c1	ZINC000179850746	455088868	/nfs/dbraw/zinc/08/88/68/455088868.db2.gz	DYTIFIDMRQMECX-UHFFFAOYSA-N	0	3	339.483	3.351	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCC(C)(C)c2ccc(C)cc2)CC1	ZINC000171733946	455090285	/nfs/dbraw/zinc/09/02/85/455090285.db2.gz	ZAPMJWGWEVSDMW-UHFFFAOYSA-N	0	3	329.488	3.222	20	30		EGEDHN
COc1ccc(F)cc1[C@@H](C)NCCOc1ccc(C#N)cc1OC	ZINC000179958260	455105549	/nfs/dbraw/zinc/10/55/49/455105549.db2.gz	WHOLSXQFPLHBTB-CYBMUJFWSA-N	0	3	344.386	3.444	20	30		EGEDHN
N#CC(C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ccccn1	ZINC000156473082	455122576	/nfs/dbraw/zinc/12/25/76/455122576.db2.gz	ZAERPXJQQFGIIU-GFCCVEGCSA-N	0	3	335.241	3.499	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@@](C)(c3ccccc3)C2)CC1	ZINC000172265123	455141344	/nfs/dbraw/zinc/14/13/44/455141344.db2.gz	BQJIQVCUWXPDIR-OAQYLSRUSA-N	0	3	341.499	3.400	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Cc1ccc(C#N)cc1	ZINC000172580020	455162916	/nfs/dbraw/zinc/16/29/16/455162916.db2.gz	DFPBTYTYTWVPDP-GOSISDBHSA-N	0	3	347.462	3.224	20	30		EGEDHN
N#Cc1cnc2c(F)ccc(Cl)c2c1N1CC[C@@H](N2CC=CC2)C1	ZINC000172773179	455185866	/nfs/dbraw/zinc/18/58/66/455185866.db2.gz	GDZNJHBCHBOKRN-CYBMUJFWSA-N	0	3	342.805	3.349	20	30		EGEDHN
Cc1cc2c(ncnc2N2CCN(CCCC(C)(C)C#N)CC2)s1	ZINC000189531032	455215126	/nfs/dbraw/zinc/21/51/26/455215126.db2.gz	VMBBWOSJSPEQLD-UHFFFAOYSA-N	0	3	343.500	3.452	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2C[C@@H](C)C[C@@H]2c2cccnc2)CC1	ZINC000183344449	455280298	/nfs/dbraw/zinc/28/02/98/455280298.db2.gz	VMWIZHGZCJTYHO-QFBILLFUSA-N	0	3	342.487	3.215	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CCC[C@H]1c1ccncc1	ZINC000245565152	455331884	/nfs/dbraw/zinc/33/18/84/455331884.db2.gz	DPMFLFMOAOEKRO-UXHICEINSA-N	0	3	338.451	3.387	20	30		EGEDHN
CN(CCC#N)C(=O)CCN[C@@H](c1ccccc1F)C1CCCC1	ZINC000181499958	455345827	/nfs/dbraw/zinc/34/58/27/455345827.db2.gz	VZRNVOBNFOUQRB-LJQANCHMSA-N	0	3	331.435	3.409	20	30		EGEDHN
C[C@H](N[C@@H]1CN(Cc2ccccc2)CC[C@H]1CO)c1ccc(C#N)cc1	ZINC000245851871	455386053	/nfs/dbraw/zinc/38/60/53/455386053.db2.gz	GLFDUJFRQLJVEU-BULFRSBZSA-N	0	3	349.478	3.092	20	30		EGEDHN
CC(C)(C#N)CCCN1CCCN(C(=O)c2ccccc2F)CC1	ZINC000174816726	455415050	/nfs/dbraw/zinc/41/50/50/455415050.db2.gz	AXEKCVSTRYWSLC-UHFFFAOYSA-N	0	3	331.435	3.304	20	30		EGEDHN
N#Cc1ccccc1NC(=O)CCN1CCS[C@H]2CCCC[C@H]21	ZINC000246072048	455421641	/nfs/dbraw/zinc/42/16/41/455421641.db2.gz	CQHXGDAFPNLCOT-SJORKVTESA-N	0	3	329.469	3.247	20	30		EGEDHN
COc1cc(NCCN[C@@H](C)c2ccc(C#N)cc2)cc(OC)c1	ZINC000182056596	455425102	/nfs/dbraw/zinc/42/51/02/455425102.db2.gz	SQRYLAKMWVCULM-AWEZNQCLSA-N	0	3	325.412	3.338	20	30		EGEDHN
C=CCOCCCC(=O)N1c2ccc(C)cc2[C@H]2CN(C)CC[C@H]21	ZINC000266660795	455432834	/nfs/dbraw/zinc/43/28/34/455432834.db2.gz	LSBMJZFVGQDXIY-IEBWSBKVSA-N	0	3	328.456	3.112	20	30		EGEDHN
C=CCN(CC=C)C(=O)Nc1cccc(N2CCN(CC)CC2)c1	ZINC000184889208	455466991	/nfs/dbraw/zinc/46/69/91/455466991.db2.gz	SREOQDLJODFULG-UHFFFAOYSA-N	0	3	328.460	3.034	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N[C@H](CC)[C@@H]1CCCO1	ZINC000182300199	455483129	/nfs/dbraw/zinc/48/31/29/455483129.db2.gz	VDVAVZIEQBBOJH-UAGQMJEPSA-N	0	3	336.501	3.198	20	30		EGEDHN
CC[C@@H](NCCOc1ccc(C#N)cc1OC)c1c(C)noc1C	ZINC000182420687	455509920	/nfs/dbraw/zinc/50/99/20/455509920.db2.gz	CTYMTUAANHNYAO-OAHLLOKOSA-N	0	3	329.400	3.291	20	30		EGEDHN
N#Cc1c(CN2CC[C@H]3[C@@H](CCCN3C3CC3)C2)cn2ccccc12	ZINC000246948553	455538556	/nfs/dbraw/zinc/53/85/56/455538556.db2.gz	UMCHJBSJFCPOMG-JXFKEZNVSA-N	0	3	334.467	3.260	20	30		EGEDHN
N#CCc1ccccc1C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000601020513	460678312	/nfs/dbraw/zinc/67/83/12/460678312.db2.gz	RRMZVKOKSVHWIB-LJQANCHMSA-N	0	3	347.462	3.395	20	30		EGEDHN
Cc1ccc(C)c(CN[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)c1	ZINC000192244738	455580801	/nfs/dbraw/zinc/58/08/01/455580801.db2.gz	SRNHZYZJEPBZJM-HXUWFJFHSA-N	0	3	333.435	3.066	20	30		EGEDHN
CC(C)CCOCCN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000268026014	455582245	/nfs/dbraw/zinc/58/22/45/455582245.db2.gz	XIQYGZVKNPJYAY-UHFFFAOYSA-N	0	3	343.471	3.271	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H]2CN(Cc3ccc(C#N)cc3)CC[C@H]21	ZINC000292259538	455610973	/nfs/dbraw/zinc/61/09/73/455610973.db2.gz	PJDQCJRGBBSXGO-ZWKOTPCHSA-N	0	3	341.455	3.390	20	30		EGEDHN
C[C@H](NCc1ccc(OCC#N)cc1)[C@H]1OCCc2sccc21	ZINC000292562157	455697951	/nfs/dbraw/zinc/69/79/51/455697951.db2.gz	ZIDYNVQASALXQR-SCLBCKFNSA-N	0	3	328.437	3.443	20	30		EGEDHN
Cc1nc(NCC2(N3CCCCC3)CCOCC2)c(Cl)cc1C#N	ZINC000292664492	455726084	/nfs/dbraw/zinc/72/60/84/455726084.db2.gz	QBVOVKCFYNQFRN-UHFFFAOYSA-N	0	3	348.878	3.362	20	30		EGEDHN
CCO[C@@H]1C[C@H](O)C12CCN(Cc1ccccc1C(C)(C)C#N)CC2	ZINC000268986686	455754592	/nfs/dbraw/zinc/75/45/92/455754592.db2.gz	QXWHWASUERVYCZ-RBUKOAKNSA-N	0	3	342.483	3.240	20	30		EGEDHN
C[C@H](N[C@H]1CCN(Cc2ccccc2)C1=O)c1ccc(OCC#N)cc1	ZINC000271788628	455760241	/nfs/dbraw/zinc/76/02/41/455760241.db2.gz	IONPASOVYWLLSG-JXFKEZNVSA-N	0	3	349.434	3.041	20	30		EGEDHN
C=C(C)[C@H](NC[C@@H](O)COCC(F)(F)F)c1ccc(F)c(F)c1	ZINC000292849605	455763747	/nfs/dbraw/zinc/76/37/47/455763747.db2.gz	FXFNUAKHLRODCT-RISCZKNCSA-N	0	3	339.304	3.111	20	30		EGEDHN
CC[C@](C)(C#N)C(=O)Nc1ccc(CCN2CCSCC2)cc1	ZINC000285032828	455780555	/nfs/dbraw/zinc/78/05/55/455780555.db2.gz	BOMPKZZUNOUBRH-GOSISDBHSA-N	0	3	331.485	3.156	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN2CCSC3(CCOCC3)C2)cc1	ZINC000186499875	455782093	/nfs/dbraw/zinc/78/20/93/455782093.db2.gz	HSHHPEQVYRXNLS-HNNXBMFYSA-N	0	3	332.469	3.075	20	30		EGEDHN
CCOc1cc(CN(C)CCOCCC#N)ccc1OC(F)F	ZINC000293672907	455794546	/nfs/dbraw/zinc/79/45/46/455794546.db2.gz	ZOFAXPVLPTZRDU-UHFFFAOYSA-N	0	3	328.359	3.049	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C	ZINC000294237554	455808517	/nfs/dbraw/zinc/80/85/17/455808517.db2.gz	AYXZHXBFPNRWGW-KZNAEPCWSA-N	0	3	348.512	3.109	20	30		EGEDHN
C=CC1CCN(C(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000194453691	455844140	/nfs/dbraw/zinc/84/41/40/455844140.db2.gz	NHNDLQQMKJBDLL-IBGZPJMESA-N	0	3	327.472	3.116	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Cc2ccc(SCC)cc2)CC1	ZINC000269740716	455852770	/nfs/dbraw/zinc/85/27/70/455852770.db2.gz	JZAPSAYSQJCFRF-UHFFFAOYSA-N	0	3	332.513	3.498	20	30		EGEDHN
C=CCN1CCC(NC(=O)/C=C\c2ccccc2OC(F)F)CC1	ZINC000255289299	455863551	/nfs/dbraw/zinc/86/35/51/455863551.db2.gz	AVHPQWZPISZOSS-FPLPWBNLSA-N	0	3	336.382	3.068	20	30		EGEDHN
COc1ccc([C@@H](C)N[C@H]2CCCN(c3ccc(C#N)cc3)C2=O)cc1	ZINC000272188336	455870972	/nfs/dbraw/zinc/87/09/72/455870972.db2.gz	JRVMIFUYOWZANR-QRWLVFNGSA-N	0	3	349.434	3.413	20	30		EGEDHN
Cc1ccc(SCCNC(=O)C(C#N)Cc2ccc(C#N)cc2)cc1	ZINC000279718819	455871569	/nfs/dbraw/zinc/87/15/69/455871569.db2.gz	MDPMVSCAWCIODJ-GOSISDBHSA-N	0	3	349.459	3.457	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1c(C)cccc1[N+](=O)[O-])C(C)C	ZINC000194703337	455874682	/nfs/dbraw/zinc/87/46/82/455874682.db2.gz	DODGPNHYZPVMLN-KRWDZBQOSA-N	0	3	345.443	3.332	20	30		EGEDHN
CC[C@@H](NCc1ccc(C#N)o1)[C@H](c1ccc(C)cc1)n1cncn1	ZINC000270097923	455876566	/nfs/dbraw/zinc/87/65/66/455876566.db2.gz	LLINSNRMKPQGRB-MOPGFXCFSA-N	0	3	335.411	3.209	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccc(C(C)(C)C#N)cc1)N1CCC[C@@H](C)C1	ZINC000280124749	455898647	/nfs/dbraw/zinc/89/86/47/455898647.db2.gz	CTCVOIOCOFTMIB-CVEARBPZSA-N	0	3	327.472	3.338	20	30		EGEDHN
CC[C@](C)(C#N)C(=O)N1CCCN(CCCc2ccccc2)CC1	ZINC000285709415	455902123	/nfs/dbraw/zinc/90/21/23/455902123.db2.gz	SFXBYBVSSQWPSY-HXUWFJFHSA-N	0	3	327.472	3.093	20	30		EGEDHN
CC[C@@H]1c2ccccc2CCN1C[C@@H](O)COc1ccc(C#N)cc1	ZINC000261480637	455906650	/nfs/dbraw/zinc/90/66/50/455906650.db2.gz	MGEXGWRRAWQXFH-WIYYLYMNSA-N	0	3	336.435	3.307	20	30		EGEDHN
N#CCc1ccc(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1	ZINC000270232685	455907869	/nfs/dbraw/zinc/90/78/69/455907869.db2.gz	OYWNYDHWMWJKNN-FQEVSTJZSA-N	0	3	333.435	3.320	20	30		EGEDHN
C=CCOc1cccc(NC(=O)N(C)[C@H](C)C2CCN(C)CC2)c1	ZINC000272306816	455908331	/nfs/dbraw/zinc/90/83/31/455908331.db2.gz	FDOTZGXACOYEEK-OAHLLOKOSA-N	0	3	331.460	3.445	20	30		EGEDHN
COCCOc1ccc(C(=O)C(C#N)c2ccccn2)c(Cl)c1	ZINC000187475384	455915273	/nfs/dbraw/zinc/91/52/73/455915273.db2.gz	RPDGJUXLQRRWCY-AWEZNQCLSA-N	0	3	330.771	3.250	20	30		EGEDHN
CCc1ccc(CCNC(=O)C(C#N)Cc2ccc(C#N)cc2)cc1	ZINC000280275355	455933478	/nfs/dbraw/zinc/93/34/78/455933478.db2.gz	DFTVFXHPUJJUKR-HXUWFJFHSA-N	0	3	331.419	3.162	20	30		EGEDHN
N#Cc1c(F)cccc1C(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000188018661	455981319	/nfs/dbraw/zinc/98/13/19/455981319.db2.gz	QSUXKENCEKIYLN-MRXNPFEDSA-N	0	3	337.398	3.092	20	30		EGEDHN
C[C@@H](CNC(=O)C(C#N)Cc1ccc(C#N)cc1)Cc1cccs1	ZINC000280528532	455989448	/nfs/dbraw/zinc/98/94/48/455989448.db2.gz	SFYSCESPQRLLBR-RHSMWYFYSA-N	0	3	337.448	3.297	20	30		EGEDHN
C#CCOc1ccccc1NC(=O)NCc1cccc(CN(C)C)c1	ZINC000188127743	456003926	/nfs/dbraw/zinc/00/39/26/456003926.db2.gz	UWQQCRAWJVWZGY-UHFFFAOYSA-N	0	3	337.423	3.082	20	30		EGEDHN
C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)N1CC(=O)N[C@@](C)(C#N)C1CC1	ZINC000296660053	456004289	/nfs/dbraw/zinc/00/42/89/456004289.db2.gz	JVQTUTDWHPSLMD-OHRYMORCSA-N	0	3	325.456	3.061	20	30		EGEDHN
OCC[C@@H]1CCC[C@@H]1NCC#Cc1ccc(OC(F)(F)F)cc1	ZINC000286305883	456020067	/nfs/dbraw/zinc/02/00/67/456020067.db2.gz	VVLKBPHPQAGECM-HOCLYGCPSA-N	0	3	327.346	3.077	20	30		EGEDHN
C=C(C)CN(CC)[C@@H](C)C(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000216482821	456029549	/nfs/dbraw/zinc/02/95/49/456029549.db2.gz	NABNWYGMKXGFJP-KMYSJOAASA-N	0	3	347.503	3.068	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2ccc3[nH]c(C)cc3c2)CC1	ZINC000287235120	456064695	/nfs/dbraw/zinc/06/46/95/456064695.db2.gz	GOJSKHHAYIHODC-UHFFFAOYSA-N	0	3	340.471	3.316	20	30		EGEDHN
CN(CCCSCC#N)[C@@H](CO)c1cccc(Br)c1	ZINC000270995461	456091186	/nfs/dbraw/zinc/09/11/86/456091186.db2.gz	UVBNLWWHTALYLQ-AWEZNQCLSA-N	0	3	343.290	3.061	20	30		EGEDHN
CC(C)c1nc2n(n1)C[C@H](N[C@@H](C)c1ccc(C#N)cc1F)CC2	ZINC000332690508	456112496	/nfs/dbraw/zinc/11/24/96/456112496.db2.gz	WHOLFOKRMUBUBF-GXTWGEPZSA-N	0	3	327.407	3.078	20	30		EGEDHN
C=CCOc1ccc(CNCC[C@@H](O)c2ccccc2)cc1OC	ZINC000289411863	456124173	/nfs/dbraw/zinc/12/41/73/456124173.db2.gz	HXQGPDOZJBVPIQ-GOSISDBHSA-N	0	3	327.424	3.473	20	30		EGEDHN
Cc1cccc(N2CCN(CCCCNc3ccc(C#N)nc3)CC2)c1	ZINC000301495971	456130504	/nfs/dbraw/zinc/13/05/04/456130504.db2.gz	BSWJUWJIHUYMSY-UHFFFAOYSA-N	0	3	349.482	3.276	20	30		EGEDHN
C[C@H]1CN(C(=O)N[C@H](CCC#N)c2ccccc2)CCN(C2CC2)C1	ZINC000297176535	456141183	/nfs/dbraw/zinc/14/11/83/456141183.db2.gz	FJAVXGKTZXCYGG-VQIMIIECSA-N	0	3	340.471	3.157	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](C)c2ccc(SC)cc2)CC1	ZINC000281168475	456151543	/nfs/dbraw/zinc/15/15/43/456151543.db2.gz	BWVWRYTXUSCYJR-CQSZACIVSA-N	0	3	333.501	3.419	20	30		EGEDHN
C=CCN(CCOC)C(=O)NC1CCN([C@@H](C)c2ccccc2)CC1	ZINC000189027092	456203313	/nfs/dbraw/zinc/20/33/13/456203313.db2.gz	WSEPAQXBSJLZOK-KRWDZBQOSA-N	0	3	345.487	3.056	20	30		EGEDHN
C[C@]12CN(C(=O)C(C#N)Cc3ccc(C#N)cc3)C[C@H]1[C@@H]1CC[C@H]2C1	ZINC000333546760	456232246	/nfs/dbraw/zinc/23/22/46/456232246.db2.gz	TUFDMFJJAVYTTG-QFCZJPRCSA-N	0	3	333.435	3.135	20	30		EGEDHN
C[C@]12CN(C(=O)C(C#N)Cc3ccc(C#N)cc3)C[C@@H]1[C@@H]1CC[C@H]2C1	ZINC000333546759	456232290	/nfs/dbraw/zinc/23/22/90/456232290.db2.gz	TUFDMFJJAVYTTG-GQUPQBGVSA-N	0	3	333.435	3.135	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H]2C[C@H](OCC)[C@]23CCCO3)cc1OC	ZINC000273544185	456237791	/nfs/dbraw/zinc/23/77/91/456237791.db2.gz	BOHHEYLHZKKWHI-AABGKKOBSA-N	0	3	347.455	3.076	20	30		EGEDHN
CN(C)CCOc1ccccc1-c1noc(C2(C#N)CCCCC2)n1	ZINC000273747081	456244694	/nfs/dbraw/zinc/24/46/94/456244694.db2.gz	BUBKCMXHTKZBOY-UHFFFAOYSA-N	0	3	340.427	3.402	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN1[C@H](C)CN(CC)C[C@H]1C	ZINC000347690180	456308092	/nfs/dbraw/zinc/30/80/92/456308092.db2.gz	MSPAUKWUYPHBDO-HZPDHXFCSA-N	0	3	347.528	3.318	20	30		EGEDHN
C=CCN(C)CCN(CC)Cc1ccn(-c2ccc(F)cc2F)n1	ZINC000340208106	456316234	/nfs/dbraw/zinc/31/62/34/456316234.db2.gz	BKEVJBHDIVRQJM-UHFFFAOYSA-N	0	3	334.414	3.090	20	30		EGEDHN
C=CCNC(=O)[C@H](C)N[C@H](Cc1ccccc1)c1ccc(OC)cc1	ZINC000290535742	456356460	/nfs/dbraw/zinc/35/64/60/456356460.db2.gz	LENHZLJDCCUALJ-OXJNMPFZSA-N	0	3	338.451	3.259	20	30		EGEDHN
C=CCn1c(-c2ccc(C)s2)nnc1N1CCCN(CC)CC1	ZINC000290552544	456362768	/nfs/dbraw/zinc/36/27/68/456362768.db2.gz	YMEJTJYKKIPSAD-UHFFFAOYSA-N	0	3	331.489	3.033	20	30		EGEDHN
C=CCN1CC[C@@H](NC(C)(C)c2cccc(C(F)(F)F)c2)C1=O	ZINC000282021936	456392220	/nfs/dbraw/zinc/39/22/20/456392220.db2.gz	PGTFJWXDURRTQP-CQSZACIVSA-N	0	3	326.362	3.317	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CCC2(CC(OCC)C2)C1	ZINC000353032022	456450552	/nfs/dbraw/zinc/45/05/52/456450552.db2.gz	WCPOGYBPRCLATM-JSOIOWGOSA-N	0	3	345.483	3.046	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000348223311	456545254	/nfs/dbraw/zinc/54/52/54/456545254.db2.gz	FDRXOOSPBQTUFX-LJQANCHMSA-N	0	3	345.402	3.122	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)N(C)CC(C)(C)C	ZINC000337814136	456563800	/nfs/dbraw/zinc/56/38/00/456563800.db2.gz	MRNKMORWVRCFAA-UHFFFAOYSA-N	0	3	330.476	3.020	20	30		EGEDHN
CC1CC(C#N)(C(=O)N(C)C2CCN(Cc3ccccc3)CC2)C1	ZINC000310538410	456583271	/nfs/dbraw/zinc/58/32/71/456583271.db2.gz	RWICEAAIOJNINU-UHFFFAOYSA-N	0	3	325.456	3.049	20	30		EGEDHN
N#Cc1ccc(SC[C@@H]2CN(Cc3ccccc3)CCCO2)nc1	ZINC000340677932	456617474	/nfs/dbraw/zinc/61/74/74/456617474.db2.gz	UKXXSUJRTYETKO-SFHVURJKSA-N	0	3	339.464	3.336	20	30		EGEDHN
CO[C@@H]1CCCC[C@H]1NCC(=O)N(CCC#N)c1ccc(C)c(C)c1	ZINC000276957128	456632022	/nfs/dbraw/zinc/63/20/22/456632022.db2.gz	LTFKLGIPRDHMHU-RTBURBONSA-N	0	3	343.471	3.097	20	30		EGEDHN
CS[C@H]1CN(c2ccc(C#N)cc2C(F)(F)F)C[C@H]1N(C)C	ZINC000340735512	456657360	/nfs/dbraw/zinc/65/73/60/456657360.db2.gz	ATYWPQIFUCSCEF-KGLIPLIRSA-N	0	3	329.391	3.059	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CCN(C(=O)C2(C#N)CCCC2)C1	ZINC000324188936	456662058	/nfs/dbraw/zinc/66/20/58/456662058.db2.gz	UHBZNIZGUMDSOP-QGZVFWFLSA-N	0	3	325.456	3.051	20	30		EGEDHN
CO[C@@H]1CCCC[C@H]1NCC(=O)N(CCC#N)c1cccc(Cl)c1	ZINC000277065366	456668610	/nfs/dbraw/zinc/66/86/10/456668610.db2.gz	WLSXAYOFRWPIDP-IAGOWNOFSA-N	0	3	349.862	3.134	20	30		EGEDHN
Cc1ccnc(NCC2(N3CCSCC3)CCCCC2)c1C#N	ZINC000343520522	456678740	/nfs/dbraw/zinc/67/87/40/456678740.db2.gz	DLVNXTSCEAAMOK-UHFFFAOYSA-N	0	3	330.501	3.425	20	30		EGEDHN
C#CCOc1ccc(CN[C@@H]2CCN(C(=O)Nc3ccccc3)C2)cc1	ZINC000283073636	456704747	/nfs/dbraw/zinc/70/47/47/456704747.db2.gz	UZOQYEDKAWGADN-LJQANCHMSA-N	0	3	349.434	3.095	20	30		EGEDHN
O=C(NCc1cccc(N2CCC2=O)c1)[C@@H]1CCCN1C1CCCC1	ZINC000328616483	456719849	/nfs/dbraw/zinc/71/98/49/456719849.db2.gz	SNKKJPJAHOQTFG-SFHVURJKSA-N	0	3	341.455	3.287	20	30		EGEDHN
Cc1nc2c(cccc2C(=O)N[C@@H]2CN(C)C[C@H]2c2ccccc2)[nH]1	ZINC000328678108	456735741	/nfs/dbraw/zinc/73/57/41/456735741.db2.gz	AYVNWVYDKTWDDB-FUHWJXTLSA-N	0	3	334.423	3.274	20	30		EGEDHN
C[C@@H](CNC(=O)Nc1ccc(C#N)c(F)c1)N(C)Cc1ccccc1	ZINC000353534551	456740666	/nfs/dbraw/zinc/74/06/66/456740666.db2.gz	VUISMOQNFILPPL-AWEZNQCLSA-N	0	3	340.402	3.339	20	30		EGEDHN
C=CCC(CC=C)C(=O)Nc1cccc(CN2CCC(O)CC2)c1	ZINC000343612075	456742998	/nfs/dbraw/zinc/74/29/98/456742998.db2.gz	FNLMEUQLDSKRAW-UHFFFAOYSA-N	0	3	328.456	3.350	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cn3c(n2)CCCC3)C1	ZINC000328730257	456746974	/nfs/dbraw/zinc/74/69/74/456746974.db2.gz	WJHNLZJEZXOGBN-NVXWUHKLSA-N	0	3	338.455	3.360	20	30		EGEDHN
CC(C)c1nc(C2CCN(CCOc3cccc(C#N)c3)CC2)no1	ZINC000299668255	456759771	/nfs/dbraw/zinc/75/97/71/456759771.db2.gz	OKJXFGBFRQWUFU-UHFFFAOYSA-N	0	3	340.427	3.323	20	30		EGEDHN
C=CCOCCCN1C[C@H](O)C[C@H]1c1ccccc1C(F)(F)F	ZINC000343690390	456768354	/nfs/dbraw/zinc/76/83/54/456768354.db2.gz	QSOVEWHKPIHNQH-CJNGLKHVSA-N	0	3	329.362	3.406	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN[C@@H]1CC[C@@H](c2ccccc2)C[C@@H]1OC	ZINC000353575566	456775846	/nfs/dbraw/zinc/77/58/46/456775846.db2.gz	OZTHLKOEZSNUDA-AQNXPRMDSA-N	0	3	342.483	3.128	20	30		EGEDHN
CN1CCC(Oc2ccc(CNC(=O)[C@@H]3C[C@@]34CCOC4)cc2)CC1	ZINC000328857777	456777881	/nfs/dbraw/zinc/77/78/81/456777881.db2.gz	DIVBWTVVJBTIRH-AZUAARDMSA-N	0	3	344.455	3.043	20	30		EGEDHN
Cc1noc(C)c1C(C)(C)NC(=O)C(C#N)CCc1ccccc1	ZINC000344038082	456790353	/nfs/dbraw/zinc/79/03/53/456790353.db2.gz	ZNWYNDLREDPWDD-INIZCTEOSA-N	0	3	325.412	3.415	20	30		EGEDHN
CC(C)n1nccc1[C@@H]1OCCC[C@H]1C(=O)N[C@H]1CCN(C2CC2)C1	ZINC000328931611	456794080	/nfs/dbraw/zinc/79/40/80/456794080.db2.gz	HZFIVPDOYCHTLO-YXJHDRRASA-N	0	3	346.475	3.125	20	30		EGEDHN
C[C@H](NC(=O)[C@@H]1CCCN1C1CCCC1)c1nnc2n1CCCC2	ZINC000328936449	456794624	/nfs/dbraw/zinc/79/46/24/456794624.db2.gz	QVEUZBILYYJMPK-ZFWWWQNUSA-N	0	3	331.464	3.039	20	30		EGEDHN
COCCn1cc(C(=O)C(C#N)c2cc(C)nc(C)n2)c2ccccc21	ZINC000353636205	456818269	/nfs/dbraw/zinc/81/82/69/456818269.db2.gz	FNIPVKKZGPMRQU-INIZCTEOSA-N	0	3	348.406	3.185	20	30		EGEDHN
C[C@@H](NC(=O)N1CCCC12CCN(C)CC2)c1ccc(C#N)cc1	ZINC000329095331	456833791	/nfs/dbraw/zinc/83/37/91/456833791.db2.gz	XXDYAMOYGNLEEH-OAHLLOKOSA-N	0	3	326.444	3.093	20	30		EGEDHN
Fc1cc(CNCCOCC(F)(F)C(F)F)ccc1OC(F)F	ZINC000277500257	456845274	/nfs/dbraw/zinc/84/52/74/456845274.db2.gz	PBWIXQXAGYOBSG-UHFFFAOYSA-N	0	3	349.246	3.434	20	30		EGEDHN
CCCN1CCC[C@H]1CNC(=O)c1cnc2c(cnn2C(C)C)c1	ZINC000329172168	456847567	/nfs/dbraw/zinc/84/75/67/456847567.db2.gz	AAQHTIDUWGNDIZ-INIZCTEOSA-N	0	3	329.448	3.191	20	30		EGEDHN
C[C@H]1CN(C(=O)[C@H](C#N)CCc2ccccc2)CCN(C2CCC2)C1	ZINC000344770956	456856894	/nfs/dbraw/zinc/85/68/94/456856894.db2.gz	JIBRQVZFBRKSEF-MJGOQNOKSA-N	0	3	339.483	3.092	20	30		EGEDHN
CC[C@H](C(=O)N1CC=C(c2ccc(C#N)cc2)CC1)N(CC)CC	ZINC000348788759	456858323	/nfs/dbraw/zinc/85/83/23/456858323.db2.gz	YZIMTENFAHMGJA-LJQANCHMSA-N	0	3	325.456	3.294	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C	ZINC000341463405	456865419	/nfs/dbraw/zinc/86/54/19/456865419.db2.gz	AYXZHXBFPNRWGW-BZSNNMDCSA-N	0	3	348.512	3.109	20	30		EGEDHN
C[C@H](C(=O)N[C@H](c1nnc[n-]1)c1ccccc1)[NH+]1CCCCCC1	ZINC000329304189	456869410	/nfs/dbraw/zinc/86/94/10/456869410.db2.gz	XTNRYSJEGASMHQ-ZBFHGGJFSA-N	0	3	327.432	3.115	20	30		EGEDHN
C[C@H](CN1C[C@H](C)C[C@H](C)C1)NC(=O)c1cc2nc[nH]c2cc1F	ZINC000329377017	456881449	/nfs/dbraw/zinc/88/14/49/456881449.db2.gz	MARMNOBIEFIROS-FRRDWIJNSA-N	0	3	332.423	3.373	20	30		EGEDHN
CC(C#N)C(=O)NCc1nc2c(s1)C[C@@H](c1ccccc1)CC2	ZINC000344986100	456887832	/nfs/dbraw/zinc/88/78/32/456887832.db2.gz	LFTMPEMOXAXEQT-JSGCOSHPSA-N	0	3	325.437	3.191	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cnc3c(c2)CCCC3)CC1	ZINC000329442581	456891217	/nfs/dbraw/zinc/89/12/17/456891217.db2.gz	KGZKCCCXYMWSFS-UHFFFAOYSA-N	0	3	328.460	3.327	20	30		EGEDHN
Cc1nnc([C@@H]2CCCN([C@@H](C)C(=O)NC3CCC(C)CC3)C2)[nH]1	ZINC000329473507	456895797	/nfs/dbraw/zinc/89/57/97/456895797.db2.gz	OPGNEILSRPZIBU-GOPBEWJXSA-N	0	3	333.480	3.216	20	30		EGEDHN
C=CCOc1ccc(CN(C)C[C@@H](O)Cc2ccccc2)cc1OC	ZINC000353767029	456898106	/nfs/dbraw/zinc/89/81/06/456898106.db2.gz	KJXPAEOGSRHGCB-IBGZPJMESA-N	0	3	341.451	3.295	20	30		EGEDHN
O=C(CN1CCC[C@@H](c2nc(C3CCCCC3)n[nH]2)C1)NC1CC1	ZINC000329505249	456901669	/nfs/dbraw/zinc/90/16/69/456901669.db2.gz	ZIWNSYBMSCYCOK-CQSZACIVSA-N	0	3	331.464	3.151	20	30		EGEDHN
O=C(CN1CCC[C@@H](c2n[nH]c(C3CCCCC3)n2)C1)NC1CC1	ZINC000329505249	456901672	/nfs/dbraw/zinc/90/16/72/456901672.db2.gz	ZIWNSYBMSCYCOK-CQSZACIVSA-N	0	3	331.464	3.151	20	30		EGEDHN
O=C(CN1CCC[C@H](c2nc(C3CCCCC3)n[nH]2)C1)NC1CC1	ZINC000329505247	456901777	/nfs/dbraw/zinc/90/17/77/456901777.db2.gz	ZIWNSYBMSCYCOK-AWEZNQCLSA-N	0	3	331.464	3.151	20	30		EGEDHN
O=C(CN1CCC[C@H](c2n[nH]c(C3CCCCC3)n2)C1)NC1CC1	ZINC000329505247	456901779	/nfs/dbraw/zinc/90/17/79/456901779.db2.gz	ZIWNSYBMSCYCOK-AWEZNQCLSA-N	0	3	331.464	3.151	20	30		EGEDHN
CCN1CCC(NC(=O)N2CCCCC[C@@H]2c2c(C)n[nH]c2C)CC1	ZINC000329529577	456904840	/nfs/dbraw/zinc/90/48/40/456904840.db2.gz	VGNLXKCGZVQAJE-QGZVFWFLSA-N	0	3	347.507	3.342	20	30		EGEDHN
O=C(N[C@@H]1CCc2nc[nH]c2C1)N1CCCCC[C@@H]1c1ccncc1	ZINC000329757006	456936734	/nfs/dbraw/zinc/93/67/34/456936734.db2.gz	ZAZPDDKVCPYRSL-CRAIPNDOSA-N	0	3	339.443	3.193	20	30		EGEDHN
O=C(N[C@@H]1CCc2[nH]cnc2C1)N1CCCCC[C@@H]1c1ccncc1	ZINC000329757006	456936737	/nfs/dbraw/zinc/93/67/37/456936737.db2.gz	ZAZPDDKVCPYRSL-CRAIPNDOSA-N	0	3	339.443	3.193	20	30		EGEDHN
C=CCOc1ccc(CN[C@H](C)c2ccc3c(c2)OCC(=O)N3)cc1	ZINC000353861484	456939775	/nfs/dbraw/zinc/93/97/75/456939775.db2.gz	ASTLTIOTHBVKMI-CQSZACIVSA-N	0	3	338.407	3.433	20	30		EGEDHN
C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)c1cn(C)nc1C1CCCCC1	ZINC000329824003	456946826	/nfs/dbraw/zinc/94/68/26/456946826.db2.gz	ZTCKMMAXSKOSDJ-CXAGYDPISA-N	0	3	330.476	3.255	20	30		EGEDHN
CC(C)(CCC#N)CNC(=O)NC[C@H](c1ccccc1)N1CCCC1	ZINC000349381571	456958692	/nfs/dbraw/zinc/95/86/92/456958692.db2.gz	IVOVIJBAUXLVRV-GOSISDBHSA-N	0	3	342.487	3.453	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccn(C3CCCCC3)n2)CC1	ZINC000329980048	456970265	/nfs/dbraw/zinc/97/02/65/456970265.db2.gz	KOTTVGIBGUDPFH-UHFFFAOYSA-N	0	3	330.476	3.159	20	30		EGEDHN
O=C(NC[C@@H]1COc2ccccc2O1)[C@@H]1CCCN1C1CCCC1	ZINC000330000994	456972609	/nfs/dbraw/zinc/97/26/09/456972609.db2.gz	XKJDPHWRNGOYCQ-CVEARBPZSA-N	0	3	330.428	3.190	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC2(c3ccc(OC)cc3)CC2)CC1	ZINC000345430007	456978379	/nfs/dbraw/zinc/97/83/79/456978379.db2.gz	KVFKJMCMZBNUJM-UHFFFAOYSA-N	0	3	343.471	3.024	20	30		EGEDHN
N#C[C@@H]1CC[C@@H](N2CCC[C@@H](NC(=O)CCCc3ccccc3)C2)C1	ZINC000339183414	456981417	/nfs/dbraw/zinc/98/14/17/456981417.db2.gz	GBIGNUWGHCICPI-VAMGGRTRSA-N	0	3	339.483	3.282	20	30		EGEDHN
CC(C)C1CCC(NC(=O)C(C)S(=O)(=O)C2CCOCC2)CC1	ZINC000330088789	456983097	/nfs/dbraw/zinc/98/30/97/456983097.db2.gz	VBMNFZOIUASWFA-WLYUNCDWSA-N	0	3	345.505	3.140	20	30		EGEDHN
CC(C#N)C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1	ZINC000345652255	456986004	/nfs/dbraw/zinc/98/60/04/456986004.db2.gz	BNUKDKCCRLGPIS-QGZVFWFLSA-N	0	3	333.435	3.080	20	30		EGEDHN
COc1cc2c(c(OC)c1OC)CCN(CCC(C)(C)C#N)CC2	ZINC000345713495	456988626	/nfs/dbraw/zinc/98/86/26/456988626.db2.gz	PHMUZQKDRKETNV-UHFFFAOYSA-N	0	3	332.444	3.053	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)[C@@H]2CCCN2C(=O)Nc2ccccc2)CCN1C	ZINC000330128332	456989232	/nfs/dbraw/zinc/98/92/32/456989232.db2.gz	JKHYBMNXOMGAFN-PVAVHDDUSA-N	0	3	344.459	3.136	20	30		EGEDHN
C=CC[C@@H](CO)CN[C@@H]1CCCOc2c(Br)cccc21	ZINC000341891584	456989532	/nfs/dbraw/zinc/98/95/32/456989532.db2.gz	VGJUGVGJAPNXMG-IUODEOHRSA-N	0	3	340.261	3.437	20	30		EGEDHN
CO[C@H](C)c1nc(C)c(C(=O)N[C@@H]2CCN(C3CCCC3)C2)s1	ZINC000330191501	457000123	/nfs/dbraw/zinc/00/01/23/457000123.db2.gz	XBLZTCXAGUTZQD-CHWSQXEVSA-N	0	3	337.489	3.480	20	30		EGEDHN
CC(C)Cc1ccc(C(=O)C2CCN(C(=O)C(C)C#N)CC2)cc1	ZINC000345848628	457001962	/nfs/dbraw/zinc/00/19/62/457001962.db2.gz	PSZZDEDOUAFMOD-OAHLLOKOSA-N	0	3	326.440	3.466	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H]2CCCc3sc(C)nc32)CC1	ZINC000345897899	457005923	/nfs/dbraw/zinc/00/59/23/457005923.db2.gz	AWSVQKDQQWPDTA-OAHLLOKOSA-N	0	3	333.501	3.028	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)NC[C@H]2CCCCN2C2CC2)cc1	ZINC000346008259	457011203	/nfs/dbraw/zinc/01/12/03/457011203.db2.gz	WUTFOJNQBUMUGO-GOSISDBHSA-N	0	3	343.471	3.068	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1C(=O)Nc1cccc(CN2CCC(O)CC2)c1	ZINC000330245791	457011817	/nfs/dbraw/zinc/01/18/17/457011817.db2.gz	XWEGUZYQNIARMB-RTBURBONSA-N	0	3	344.455	3.213	20	30		EGEDHN
Cc1nc(C2(NC(=O)C3CCN(C4CC4)CC3)CCCCC2)no1	ZINC000330256395	457014536	/nfs/dbraw/zinc/01/45/36/457014536.db2.gz	KONWDIHEWSTNJP-UHFFFAOYSA-N	0	3	332.448	3.368	20	30		EGEDHN
C=CCC[C@H](O)CN[C@H](c1cncc(Br)c1)C1CC1	ZINC000342093304	457105102	/nfs/dbraw/zinc/10/51/02/457105102.db2.gz	QUPMCXHWBXGAND-GJZGRUSLSA-N	0	3	325.250	3.212	20	30		EGEDHN
C=CCOc1cccnc1C(=O)Nc1cc(C)cc(CN(C)C)c1	ZINC000342140309	457130945	/nfs/dbraw/zinc/13/09/45/457130945.db2.gz	UXNBLWWWYCZXCG-UHFFFAOYSA-N	0	3	325.412	3.269	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)[C@@H](C)N1CC[C@H](c2ccccc2)[C@H]1C	ZINC000331236428	457151028	/nfs/dbraw/zinc/15/10/28/457151028.db2.gz	KRRRTPQWPHEJAD-ZTRFORPCSA-N	0	3	327.472	3.307	20	30		EGEDHN
COc1ccc(CNCCOc2ccc(C#N)cc2)c(C)c1OC	ZINC000342178118	457151691	/nfs/dbraw/zinc/15/16/91/457151691.db2.gz	YHDGYSQWDDWYDZ-UHFFFAOYSA-N	0	3	326.396	3.053	20	30		EGEDHN
COc1ccc(CNCCc2nc(C)oc2C)cc1OCCCC#N	ZINC000346838218	457181828	/nfs/dbraw/zinc/18/18/28/457181828.db2.gz	XZMLLTJXBSHIIY-UHFFFAOYSA-N	0	3	343.427	3.315	20	30		EGEDHN
CC1(C#N)CCN(C[C@@H](O)CO[C@@H]2CCCc3ccccc32)CC1	ZINC000331668378	457227849	/nfs/dbraw/zinc/22/78/49/457227849.db2.gz	NZWWCBXKVAELCD-IEBWSBKVSA-N	0	3	328.456	3.067	20	30		EGEDHN
N#Cc1ccc([C@@H](NCCC23CC4CC(CC(C4)C2)C3)C(N)=O)cc1	ZINC000360060714	457232792	/nfs/dbraw/zinc/23/27/92/457232792.db2.gz	OKFMGYBUXHSHFW-WRUMOOJNSA-N	0	3	337.467	3.281	20	30		EGEDHN
CC(C)(CO)[C@@H](NCc1ccc(C#N)cc1Br)C1CC1	ZINC000339731269	457238043	/nfs/dbraw/zinc/23/80/43/457238043.db2.gz	ZGUFJPPMPZWHOH-HNNXBMFYSA-N	0	3	337.261	3.207	20	30		EGEDHN
N#CC(C(=O)c1ccc(C(=O)Nc2ccccc2)cc1)c1ccncn1	ZINC000354479619	457248529	/nfs/dbraw/zinc/24/85/29/457248529.db2.gz	WHVNLELQMUMQTL-QGZVFWFLSA-N	0	3	342.358	3.219	20	30		EGEDHN
C=CCN(Cc1cc(Br)ccc1F)C(=O)C(C)C#N	ZINC000347134610	457249064	/nfs/dbraw/zinc/24/90/64/457249064.db2.gz	MJPRMJGRKPDTPJ-SNVBAGLBSA-N	0	3	325.181	3.262	20	30		EGEDHN
C=C(C)CN(Cc1ccc(CO)o1)C(=O)[C@@H](C(C)C)N1CCCCC1	ZINC000342394480	457277740	/nfs/dbraw/zinc/27/77/40/457277740.db2.gz	LBMDONPKKIJQPO-LJQANCHMSA-N	0	3	348.487	3.187	20	30		EGEDHN
CC(C)[C@@]1(CO)CCCN(C(=O)C(C#N)CCc2ccccc2)C1	ZINC000360170773	457286927	/nfs/dbraw/zinc/28/69/27/457286927.db2.gz	KRSUSDOAUTXNMI-ICSRJNTNSA-N	0	3	328.456	3.016	20	30		EGEDHN
CC(C)(C)N1C[C@@H](C(=O)N(CCC#N)CC2CC2)[C@H](C(F)(F)F)C1	ZINC000339931609	457315471	/nfs/dbraw/zinc/31/54/71/457315471.db2.gz	MXIYMMXIQWNICG-ZIAGYGMSSA-N	0	3	345.409	3.047	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccnn2[C@H](C)CC(C)C)CC1	ZINC000360501585	457316697	/nfs/dbraw/zinc/31/66/97/457316697.db2.gz	USMMKLLMGZOXND-OAHLLOKOSA-N	0	3	333.480	3.262	20	30		EGEDHN
CCN(CCC#N)C(=O)CN1CCC[C@](C)(c2ccccc2)CC1	ZINC000352188253	457346384	/nfs/dbraw/zinc/34/63/84/457346384.db2.gz	XQLMXPAELCXZNV-FQEVSTJZSA-N	0	3	327.472	3.192	20	30		EGEDHN
CO[C@@]1(C)CCCN([C@@H](C)C(=O)N(CCC#N)c2ccccc2)CC1	ZINC000332350506	457353646	/nfs/dbraw/zinc/35/36/46/457353646.db2.gz	URPXOTHSWFHZPC-PXNSSMCTSA-N	0	3	343.471	3.213	20	30		EGEDHN
N#Cc1cnc2c(F)cc(F)cc2c1N1CCN(C2CCCC2)CC1	ZINC000352314626	457355433	/nfs/dbraw/zinc/35/54/33/457355433.db2.gz	KUPJVMOVBLLGPZ-UHFFFAOYSA-N	0	3	342.393	3.449	20	30		EGEDHN
CN(Cc1ccccc1)[C@H]1CCN(C(=O)Nc2ccc(C#N)cc2)C1	ZINC000363570772	457368977	/nfs/dbraw/zinc/36/89/77/457368977.db2.gz	BGLUOWWNGQUEDX-IBGZPJMESA-N	0	3	334.423	3.296	20	30		EGEDHN
CN(CC#Cc1ccc(OC(F)(F)F)cc1)CC[C@H]1CCCO1	ZINC000342580626	457376684	/nfs/dbraw/zinc/37/66/84/457376684.db2.gz	FQHMYMYANAMTSQ-OAHLLOKOSA-N	0	3	327.346	3.438	20	30		EGEDHN
C=C[C@@H](CO)NCc1cn(-c2ccccc2)nc1-c1ccc(C)cc1	ZINC000352448070	457376374	/nfs/dbraw/zinc/37/63/74/457376374.db2.gz	PWPHVGGTNUTSMR-IBGZPJMESA-N	0	3	333.435	3.484	20	30		EGEDHN
CC1(C)CN(Cc2cn(CCC#N)nc2-c2ccccc2)CCCO1	ZINC000378344552	457392077	/nfs/dbraw/zinc/39/20/77/457392077.db2.gz	ALRBUERZBACVFJ-UHFFFAOYSA-N	0	3	338.455	3.465	20	30		EGEDHN
C[C@@H](C(=O)N[C@@H]1CC[C@H](C#N)C1)N1CCC(Cc2ccccc2)CC1	ZINC000424978914	457393943	/nfs/dbraw/zinc/39/39/43/457393943.db2.gz	QHURPWWTWQXBED-FFZOFVMBSA-N	0	3	339.483	3.138	20	30		EGEDHN
C[C@H](NC(=O)NCC(C)(C)CCC#N)[C@@H](c1ccccc1)N(C)C	ZINC000357278864	457417332	/nfs/dbraw/zinc/41/73/32/457417332.db2.gz	FFSXJGKJVOQUJV-RDJZCZTQSA-N	0	3	330.476	3.307	20	30		EGEDHN
Cc1ccccc1[C@@H]([C@@H](C)NC(=O)N1CCC(F)(C#N)CC1)N(C)C	ZINC000357280608	457418917	/nfs/dbraw/zinc/41/89/17/457418917.db2.gz	HVCBOJSYFOOGIX-NVXWUHKLSA-N	0	3	346.450	3.024	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@H](CN(C)Cc3scnc3C)C2)CC1	ZINC000356053098	457442781	/nfs/dbraw/zinc/44/27/81/457442781.db2.gz	BLQOQGSVRLCYHC-MRXNPFEDSA-N	0	3	347.528	3.478	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](CN(C)Cc3scnc3C)C2)CC1	ZINC000356053097	457443741	/nfs/dbraw/zinc/44/37/41/457443741.db2.gz	BLQOQGSVRLCYHC-INIZCTEOSA-N	0	3	347.528	3.478	20	30		EGEDHN
CN(C)CCN(Cc1cccs1)c1ncc2c(c1C#N)CCC2	ZINC000425245623	457471113	/nfs/dbraw/zinc/47/11/13/457471113.db2.gz	WYMRTNQYSBBDLP-UHFFFAOYSA-N	0	3	326.469	3.072	20	30		EGEDHN
CC(C)(C#N)C(=O)N1CC[C@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000374107689	457479493	/nfs/dbraw/zinc/47/94/93/457479493.db2.gz	LLJFLJPGPWMBQT-HXUWFJFHSA-N	0	3	325.456	3.051	20	30		EGEDHN
N#Cc1cnc2c(F)ccc(Cl)c2c1NCCN1CCCCC1	ZINC000342826237	457544038	/nfs/dbraw/zinc/54/40/38/457544038.db2.gz	PFJRCMQCJHFZQE-UHFFFAOYSA-N	0	3	332.810	3.219	20	30		EGEDHN
C=CCOc1cccnc1C(=O)N[C@@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000356260241	457553991	/nfs/dbraw/zinc/55/39/91/457553991.db2.gz	VAMZLBSDRFZHHX-KXBFYZLASA-N	0	3	339.439	3.068	20	30		EGEDHN
C=CCOc1ccc(CN2CCC(c3cn[nH]c3)CC2)cc1OC	ZINC000374300265	457575527	/nfs/dbraw/zinc/57/55/27/457575527.db2.gz	DZHWKIHVEIHWTL-UHFFFAOYSA-N	0	3	327.428	3.363	20	30		EGEDHN
C=CCN1CCC(NCc2ccc(OC)cc2Br)CC1	ZINC000352746217	457578347	/nfs/dbraw/zinc/57/83/47/457578347.db2.gz	BIBZBCYNWVQCMX-UHFFFAOYSA-N	0	3	339.277	3.198	20	30		EGEDHN
COc1cc(C#N)ccc1CN1CC2(CCC2)[C@H]1C1CCOCC1	ZINC000425551545	457595536	/nfs/dbraw/zinc/59/55/36/457595536.db2.gz	JTRSHCGTGIGEAT-LJQANCHMSA-N	0	3	326.440	3.348	20	30		EGEDHN
COC(=O)[C@H]1CC[C@H](NCc2ccc(C#N)cc2C(F)(F)F)C1	ZINC000356404050	457608766	/nfs/dbraw/zinc/60/87/66/457608766.db2.gz	IOQNCMPDBLYXQG-AAEUAGOBSA-N	0	3	326.318	3.008	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N1CC[C@H]([C@@H]2CCOC2)C1	ZINC000374407422	457616191	/nfs/dbraw/zinc/61/61/91/457616191.db2.gz	VSPAHJOEIIZXPP-YESZJQIVSA-N	0	3	348.512	3.010	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N1CCC[C@H]2CN(C)C[C@H]21)c1ccc(F)c(F)c1	ZINC000425733627	457638391	/nfs/dbraw/zinc/63/83/91/457638391.db2.gz	ARRDONANYFTPCK-QGTPRVQTSA-N	0	3	349.425	3.318	20	30		EGEDHN
CN(Cc1ccc2c(c1)OCO2)C(=O)C(C#N)CCc1ccccc1	ZINC000433113648	457759623	/nfs/dbraw/zinc/75/96/23/457759623.db2.gz	LPZPUFVICIMLFY-KRWDZBQOSA-N	0	3	336.391	3.146	20	30		EGEDHN
CCC[C@H](C#N)N(C)C(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F	ZINC000410836468	457761198	/nfs/dbraw/zinc/76/11/98/457761198.db2.gz	RTDGXVBRBMNOHG-SJORKVTESA-N	0	3	349.425	3.294	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)NCC(C)(C)CC#N)c1ccsc1	ZINC000457693275	457794189	/nfs/dbraw/zinc/79/41/89/457794189.db2.gz	RVCRHZABWNLNSL-OAHLLOKOSA-N	0	3	336.505	3.370	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1)C(=O)[C@H](C#N)CCc1ccccc1	ZINC000433320794	457809790	/nfs/dbraw/zinc/80/97/90/457809790.db2.gz	VTYKVJJDBCDSBQ-NRFANRHFSA-N	0	3	349.478	3.349	20	30		EGEDHN
Cc1cccn2cc(CNC(=O)C(C#N)CCc3ccccc3)nc12	ZINC000433344807	457817547	/nfs/dbraw/zinc/81/75/47/457817547.db2.gz	UREFLJMRKPWPAI-KRWDZBQOSA-N	0	3	332.407	3.032	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H]2CN(Cc3cccc(C#N)c3)CC[C@H]21	ZINC000366536861	457843139	/nfs/dbraw/zinc/84/31/39/457843139.db2.gz	ZNNDISRFMHLJPN-ZWKOTPCHSA-N	0	3	341.455	3.390	20	30		EGEDHN
COc1ccc(F)cc1[C@H](C)NCCC(=O)Nc1ccccc1C#N	ZINC000411444670	457890669	/nfs/dbraw/zinc/89/06/69/457890669.db2.gz	FGKCQBKYYXSRJI-ZDUSSCGKSA-N	0	3	341.386	3.385	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN[C@@]2(CO)CCCc3ccccc32)cc1	ZINC000366921354	457910707	/nfs/dbraw/zinc/91/07/07/457910707.db2.gz	KNCXDKQLXRUJLM-HRAATJIYSA-N	0	3	336.435	3.291	20	30		EGEDHN
C=CCN(C)CCN(CC)[C@H](C)C(=O)Nc1ccc(SC)cc1	ZINC000411634704	457935374	/nfs/dbraw/zinc/93/53/74/457935374.db2.gz	APEZINOTVWOJCF-OAHLLOKOSA-N	0	3	335.517	3.175	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cccc([N+](=O)[O-])c2C)CC1	ZINC000358354497	457952958	/nfs/dbraw/zinc/95/29/58/457952958.db2.gz	LPUCHONKZVDLPM-UHFFFAOYSA-N	0	3	332.404	3.065	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)c(F)c1)C[C@@H](O)COc1ccccc1	ZINC000444808707	457983499	/nfs/dbraw/zinc/98/34/99/457983499.db2.gz	VCFOKGUDSMMKCC-GOSISDBHSA-N	0	3	342.414	3.348	20	30		EGEDHN
C#CCOc1ccccc1CN1CCC(n2cc(Cl)cn2)CC1	ZINC000367876834	457991357	/nfs/dbraw/zinc/99/13/57/457991357.db2.gz	FAEQFUFUGXNPGV-UHFFFAOYSA-N	0	3	329.831	3.386	20	30		EGEDHN
C=CC[C@@H]1N(C(=O)NC[C@]2(N(C)C)CCSC2)CCCC1(C)C	ZINC000445122491	458018657	/nfs/dbraw/zinc/01/86/57/458018657.db2.gz	YHUAHEMNAQBQJW-MAUKXSAKSA-N	0	3	339.549	3.200	20	30		EGEDHN
CCN(CCC#N)C(=O)CN(C)[C@@H]1CCCC[C@H]1c1ccccc1	ZINC000412007429	458043181	/nfs/dbraw/zinc/04/31/81/458043181.db2.gz	JDFSLMCJQVKZKV-RBUKOAKNSA-N	0	3	327.472	3.407	20	30		EGEDHN
COC1([C@H](C)NCC#Cc2ccc(OC(F)(F)F)cc2)CCC1	ZINC000412029234	458052641	/nfs/dbraw/zinc/05/26/41/458052641.db2.gz	YACKFTYOJRVTCL-ZDUSSCGKSA-N	0	3	327.346	3.484	20	30		EGEDHN
C=CCOc1ccc(CN(C)[C@@H](C)CN2CCOCC2)cc1Cl	ZINC000435052452	458086742	/nfs/dbraw/zinc/08/67/42/458086742.db2.gz	VFASNDCIPCNCBV-HNNXBMFYSA-N	0	3	338.879	3.057	20	30		EGEDHN
C=CCSc1ccccc1C(=O)NC1CCN(CCCOC)CC1	ZINC000362388893	458146049	/nfs/dbraw/zinc/14/60/49/458146049.db2.gz	KHWVEVNILCPGNE-UHFFFAOYSA-N	0	3	348.512	3.195	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@@H]1CNC(=O)c1cccc(CN2CCCCC2)c1	ZINC000412306957	458161327	/nfs/dbraw/zinc/16/13/27/458161327.db2.gz	GGVWLFYSRAIQST-WOJBJXKFSA-N	0	3	342.483	3.384	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1F)C(=O)NCC(C)(C)CCC#N	ZINC000358705654	458161802	/nfs/dbraw/zinc/16/18/02/458161802.db2.gz	BCGCMNOBQPDZJG-UHFFFAOYSA-N	0	3	348.466	3.229	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)N(C)C[C@@H](C)C#N)N(CC)CC)cc1	ZINC000458790220	458171762	/nfs/dbraw/zinc/17/17/62/458171762.db2.gz	IBDSYNLNYIQQIW-QFBILLFUSA-N	0	3	344.503	3.433	20	30		EGEDHN
CN1CC[C@@H]2CCN(C(=O)N[C@H](CCCC#N)c3ccccc3)[C@H]2C1	ZINC000458805918	458177968	/nfs/dbraw/zinc/17/79/68/458177968.db2.gz	VQQZEXZPNLIBIG-QRVBRYPASA-N	0	3	340.471	3.157	20	30		EGEDHN
C=CCC(C)(C)CNC(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000458806710	458179358	/nfs/dbraw/zinc/17/93/58/458179358.db2.gz	CYNQXQYNRFDZQR-ROUUACIJSA-N	0	3	344.503	3.318	20	30		EGEDHN
COCC[C@@H](c1ccccc1)N1CC[C@H](Oc2ccc(C#N)cn2)C1	ZINC000428800208	458213650	/nfs/dbraw/zinc/21/36/50/458213650.db2.gz	FTQSACKALAOCAB-OALUTQOASA-N	0	3	337.423	3.184	20	30		EGEDHN
C[C@@H]1CN(CCC(=O)Nc2cccc(C#N)c2)Cc2ccccc2O1	ZINC000429147785	458281982	/nfs/dbraw/zinc/28/19/82/458281982.db2.gz	BKPGWLONRSOKLR-OAHLLOKOSA-N	0	3	335.407	3.170	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CCN(C(=O)NCC(C)(C)CC#N)C1	ZINC000459212087	458292358	/nfs/dbraw/zinc/29/23/58/458292358.db2.gz	AJPYFJZUSKSMJJ-KRWDZBQOSA-N	0	3	342.487	3.090	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)NC(=O)N[C@@H](C)C1=CCN(C)CC1	ZINC000413439487	458301503	/nfs/dbraw/zinc/30/15/03/458301503.db2.gz	KAPAINJVJYMAJW-LPHOPBHVSA-N	0	3	327.472	3.123	20	30		EGEDHN
C=CCc1cc(CN2CCC(c3cn[nH]c3)CC2)cc(OC)c1O	ZINC000372433689	458302167	/nfs/dbraw/zinc/30/21/67/458302167.db2.gz	NIFRPYRVRPNWBL-UHFFFAOYSA-N	0	3	327.428	3.232	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)NC(=O)N(C)CC1CCN(C)CC1	ZINC000413828464	458308587	/nfs/dbraw/zinc/30/85/87/458308587.db2.gz	UWXCQKRIUSVBGI-IBGZPJMESA-N	0	3	329.488	3.157	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc3c(c2)CCCN3)CC1	ZINC000415880739	458334302	/nfs/dbraw/zinc/33/43/02/458334302.db2.gz	SLTDOFGAZHTINX-UHFFFAOYSA-N	0	3	328.460	3.207	20	30		EGEDHN
N#CCC[C@@H](NC(=O)N1C[C@@H](c2ccccc2)[C@H](N)C1)c1ccccc1	ZINC000417917091	458368641	/nfs/dbraw/zinc/36/86/41/458368641.db2.gz	NWKRVVMISRUXGX-XUVXKRRUSA-N	0	3	348.450	3.168	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CCC(NC(=O)NCC2(C#N)CCC2)CC1	ZINC000419443008	458382379	/nfs/dbraw/zinc/38/23/79/458382379.db2.gz	ASQWNXBFQZRBEJ-INIZCTEOSA-N	0	3	340.471	3.205	20	30		EGEDHN
C[C@H]1C[C@]1(C#N)C(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1	ZINC000448768235	458408680	/nfs/dbraw/zinc/40/86/80/458408680.db2.gz	PQFRJJPXUSSANA-ILZDJORESA-N	0	3	325.456	3.126	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCN(Cc3ccc(OCC4CC4)cc3)C2)nc1	ZINC000430185585	458417231	/nfs/dbraw/zinc/41/72/31/458417231.db2.gz	JSVLQDQPIXUTIJ-HXUWFJFHSA-N	0	3	349.434	3.395	20	30		EGEDHN
N#CCCn1cc(CN2C[C@@H](C3CC3)[C@@H]2C2CC2)c(-c2ccncc2)n1	ZINC000449543138	458426134	/nfs/dbraw/zinc/42/61/34/458426134.db2.gz	SEPNDFOETNTRPW-FPOVZHCZSA-N	0	3	347.466	3.479	20	30		EGEDHN
C=CCS(=O)(=O)CCN[C@H]1CCC[C@@H]1c1ccc(Cl)cc1	ZINC000373265986	458446787	/nfs/dbraw/zinc/44/67/87/458446787.db2.gz	DFCKTZLXMGDPKH-CVEARBPZSA-N	0	3	327.877	3.167	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000373294945	458455365	/nfs/dbraw/zinc/45/53/65/458455365.db2.gz	TYSSPBPVNWYZCD-ZDUSSCGKSA-N	0	3	325.372	3.061	20	30		EGEDHN
C[C@H]1[C@@H](NC(=O)CCc2ccc(C#N)cc2)CCN1Cc1ccccc1	ZINC000377106470	458463249	/nfs/dbraw/zinc/46/32/49/458463249.db2.gz	SIOHFYPJBHICPW-UWJYYQICSA-N	0	3	347.462	3.270	20	30		EGEDHN
CC(C)(C)c1cnc(C(C#N)C(=O)c2cccc(NC(N)=O)c2)s1	ZINC000430612505	458471839	/nfs/dbraw/zinc/47/18/39/458471839.db2.gz	SHPVZPYFUJDRLT-GFCCVEGCSA-N	0	3	342.424	3.421	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCC(=O)N[C@H](c1ccc(F)cc1)C1CCCC1	ZINC000451604683	458482335	/nfs/dbraw/zinc/48/23/35/458482335.db2.gz	HXUGOKIAALFRAN-HBFSDRIKSA-N	0	3	346.446	3.106	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC(=O)N[C@H](c1cccs1)C(C)(C)C	ZINC000451675165	458485173	/nfs/dbraw/zinc/48/51/73/458485173.db2.gz	OXVLXCCUXXOIEJ-JKIFEVAISA-N	0	3	336.501	3.275	20	30		EGEDHN
C=CC(C)(C)CNC(=O)c1cnn(CCN(C)C)c1-c1ccccc1	ZINC000452777392	458510480	/nfs/dbraw/zinc/51/04/80/458510480.db2.gz	UQPWEVPQKHDTGX-UHFFFAOYSA-N	0	3	340.471	3.054	20	30		EGEDHN
C[C@H](c1ccc(C#N)cc1F)N1C[C@H]2C[C@H](Cn3c(=O)cccc32)C1	ZINC000453277482	458523329	/nfs/dbraw/zinc/52/33/29/458523329.db2.gz	JXYOYMBWOOVWNT-VNQPRFMTSA-N	0	3	337.398	3.039	20	30		EGEDHN
C=C(C)Cn1c([C@@H]2CC[C@H](C)O2)nnc1N(C)[C@@H]1CCN(C(C)C)C1	ZINC000453462172	458533247	/nfs/dbraw/zinc/53/32/47/458533247.db2.gz	PDRJOUYISDNDES-BBWFWOEESA-N	0	3	347.507	3.013	20	30		EGEDHN
C=C(C)Cn1c([C@@H]2CC[C@H](C)O2)nnc1N1CCN([C@H](C)CC)CC1	ZINC000453468760	458534565	/nfs/dbraw/zinc/53/45/65/458534565.db2.gz	YSNFSLDYKNQVHS-IKGGRYGDSA-N	0	3	347.507	3.015	20	30		EGEDHN
Cc1ccc(-c2csc(NC(=O)[C@H](N)CCCC#N)n2)c(C)c1	ZINC000424063748	458549126	/nfs/dbraw/zinc/54/91/26/458549126.db2.gz	IQBZIZOCBPKTFC-CQSZACIVSA-N	0	3	328.441	3.387	20	30		EGEDHN
COc1cccc(Oc2ccc(NC(=O)[C@@H](N)CCCC#N)cc2)c1	ZINC000424086534	458555792	/nfs/dbraw/zinc/55/57/92/458555792.db2.gz	CGJPZYDKOBXFRN-SFHVURJKSA-N	0	3	339.395	3.447	20	30		EGEDHN
CC(C)Cc1ccc([C@H](NC(=O)[C@@H](N)CCCC#N)C2CC2)cc1	ZINC000424109737	458560791	/nfs/dbraw/zinc/56/07/91/458560791.db2.gz	BDQPDOVJSMCJGG-OALUTQOASA-N	0	3	327.472	3.474	20	30		EGEDHN
Cc1ccccc1C1(CNC(=O)[C@H](N)CCCC#N)CCCCC1	ZINC000424109660	458560934	/nfs/dbraw/zinc/56/09/34/458560934.db2.gz	AURIRHFOLYPZEE-GOSISDBHSA-N	0	3	327.472	3.334	20	30		EGEDHN
CC(C)c1cnc(-c2ccc(NC(=O)[C@H](N)CCCC#N)cc2)o1	ZINC000424117603	458562370	/nfs/dbraw/zinc/56/23/70/458562370.db2.gz	CQUUVTMFMOZAHO-OAHLLOKOSA-N	0	3	326.400	3.425	20	30		EGEDHN
CCN(C(=O)[C@H](N)CCCC#N)[C@@H](Cc1ccc(F)cc1)C(C)C	ZINC000424122260	458563332	/nfs/dbraw/zinc/56/33/32/458563332.db2.gz	IRCFCHICOIWQEV-MSOLQXFVSA-N	0	3	333.451	3.262	20	30		EGEDHN
Cc1ccc(CNC(=O)[C@@H](N)CCCC#N)c(O[C@@H](C)CC(C)C)c1	ZINC000424124214	458564548	/nfs/dbraw/zinc/56/45/48/458564548.db2.gz	LRAQBSXLKJSJGF-WMZOPIPTSA-N	0	3	345.487	3.446	20	30		EGEDHN
Cc1ccc(CNC(=O)[C@H](N)CCCC#N)c(Oc2ccccc2)c1	ZINC000424125296	458564628	/nfs/dbraw/zinc/56/46/28/458564628.db2.gz	NRGKGWRFWRZCRB-GOSISDBHSA-N	0	3	337.423	3.425	20	30		EGEDHN
Cc1cccn2cc(-c3ccc(NC(=O)[C@@H](N)CCCC#N)cc3)nc12	ZINC000424128518	458565048	/nfs/dbraw/zinc/56/50/48/458565048.db2.gz	FOJOLGDPLMDUOA-KRWDZBQOSA-N	0	3	347.422	3.269	20	30		EGEDHN
CCCN(C(=O)[C@H](N)CCCC#N)[C@@H]1C[C@H](OCC)C12CCCCC2	ZINC000424134207	458566350	/nfs/dbraw/zinc/56/63/50/458566350.db2.gz	YBWRLDYFOVYFEP-KURKYZTESA-N	0	3	349.519	3.374	20	30		EGEDHN
C[C@@H](NCCNC(=O)CCCc1ccccc1)c1cccc(C#N)c1	ZINC000424134234	458566644	/nfs/dbraw/zinc/56/66/44/458566644.db2.gz	HPJWAZYFTOLIKX-QGZVFWFLSA-N	0	3	335.451	3.348	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H]1CCN(C(=O)Nc2cccc(C#N)c2)C1	ZINC000377919030	458572254	/nfs/dbraw/zinc/57/22/54/458572254.db2.gz	VEBVYSGUBWHBBL-LJQANCHMSA-N	0	3	334.423	3.296	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000424177065	458577981	/nfs/dbraw/zinc/57/79/81/458577981.db2.gz	TYIPJFZIWDPSLF-UKRRQHHQSA-N	0	3	339.361	3.042	20	30		EGEDHN
C[C@H](CNC(=O)[C@@H](C)c1cccc(C#N)c1)N(C)Cc1ccccc1	ZINC000462055989	458590232	/nfs/dbraw/zinc/59/02/32/458590232.db2.gz	JNFHBRHIQSVNQL-SJORKVTESA-N	0	3	335.451	3.298	20	30		EGEDHN
C[C@@H](C(=O)NC[C@H](C)N(C)Cc1ccccc1)c1cccc(C#N)c1	ZINC000462055983	458591207	/nfs/dbraw/zinc/59/12/07/458591207.db2.gz	JNFHBRHIQSVNQL-DLBZAZTESA-N	0	3	335.451	3.298	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NCC1(N(C)Cc2ccccc2)CCC1	ZINC000456122051	458632258	/nfs/dbraw/zinc/63/22/58/458632258.db2.gz	NCERNBSLOQLXSO-HXUWFJFHSA-N	0	3	344.499	3.386	20	30		EGEDHN
Cc1c([C@H]2OCC[C@@H]2NCc2ccccc2C(C)(C)C#N)cnn1C	ZINC000431961146	458653770	/nfs/dbraw/zinc/65/37/70/458653770.db2.gz	SNHSHQDLPPSIKT-RBUKOAKNSA-N	0	3	338.455	3.150	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCCc2ccccc2Cl)cc1	ZINC000470868099	458657578	/nfs/dbraw/zinc/65/75/78/458657578.db2.gz	HYWIIVUEKQCXII-QGZVFWFLSA-N	0	3	337.810	3.253	20	30		EGEDHN
C[C@H](NC(C)(C)CNC(=O)NCC#Cc1ccccc1)c1ccccc1	ZINC000502809273	458671027	/nfs/dbraw/zinc/67/10/27/458671027.db2.gz	BRBRWAPKSKHDRH-SFHVURJKSA-N	0	3	349.478	3.467	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccc(N3CCCCCC3)nc2)nc(C)n1	ZINC000546864134	458683248	/nfs/dbraw/zinc/68/32/48/458683248.db2.gz	XBWFYPBQBWYODM-KRWDZBQOSA-N	0	3	349.438	3.359	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Nc1cccc([N+](=O)[O-])c1)C(C)C	ZINC000503439904	458708672	/nfs/dbraw/zinc/70/86/72/458708672.db2.gz	STQFCKLFRCQSHE-KRWDZBQOSA-N	0	3	346.431	3.415	20	30		EGEDHN
CC1(C)C[C@H](NC[C@H](O)COc2ccccc2C#N)c2ccccc21	ZINC000530233643	458724497	/nfs/dbraw/zinc/72/44/97/458724497.db2.gz	ZMAAGKBSIJQGOK-LPHOPBHVSA-N	0	3	336.435	3.310	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1SCC[C@@H](C)F	ZINC000505455803	458744028	/nfs/dbraw/zinc/74/40/28/458744028.db2.gz	QPOLLHRTXYMNOJ-CQSZACIVSA-N	0	3	326.485	3.333	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN2CCC[C@@H]2/C=C\c2ccccc2)cc1	ZINC000505899772	458749367	/nfs/dbraw/zinc/74/93/67/458749367.db2.gz	AJULLHVYMLBXQT-HANSRSFRSA-N	0	3	348.446	3.476	20	30		EGEDHN
Cc1ccccc1[C@@H]1C[C@H](C)N([C@@H](C)C(=O)NC2(C#N)CCC2)C1	ZINC000530334477	458749430	/nfs/dbraw/zinc/74/94/30/458749430.db2.gz	CLBPGLNOXXNPNL-YESZJQIVSA-N	0	3	325.456	3.124	20	30		EGEDHN
C=C(C)CN(Cc1ccccc1)C(=O)N[C@H]1CN(C2CC2)C[C@@H]1C	ZINC000472046304	458763957	/nfs/dbraw/zinc/76/39/57/458763957.db2.gz	BTGUHXWKANDLIW-LPHOPBHVSA-N	0	3	327.472	3.257	20	30		EGEDHN
C[C@H]1CN(CCCNc2cc(C#N)ccc2C(F)(F)F)CCCO1	ZINC000432845139	458799229	/nfs/dbraw/zinc/79/92/29/458799229.db2.gz	BYICRDUZLSLMLS-ZDUSSCGKSA-N	0	3	341.377	3.490	20	30		EGEDHN
C[C@@H]1CN(CCCNc2ccc(C#N)c(C(F)(F)F)c2)CCCO1	ZINC000432854257	458800447	/nfs/dbraw/zinc/80/04/47/458800447.db2.gz	RFKZYNZOIDCNAQ-CYBMUJFWSA-N	0	3	341.377	3.490	20	30		EGEDHN
C=CCc1cc(CN[C@H]2COc3cc(F)ccc3C2)cc(OC)c1O	ZINC000514950081	458803199	/nfs/dbraw/zinc/80/31/99/458803199.db2.gz	MCIWUOQXUMHEOF-QGZVFWFLSA-N	0	3	343.398	3.362	20	30		EGEDHN
C=C[C@@H]1CCCCN1C(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000495198434	458810340	/nfs/dbraw/zinc/81/03/40/458810340.db2.gz	BQMZSYHFAAKYPE-RTBURBONSA-N	0	3	327.472	3.401	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)CN1CCC[C@H]1CCc1ccccc1	ZINC000515554317	458810855	/nfs/dbraw/zinc/81/08/55/458810855.db2.gz	WBNGMIYFYUUQTI-AZUAARDMSA-N	0	3	327.472	3.138	20	30		EGEDHN
C=CCn1c(SC[C@@H]2CCN(C)C2)nnc1-c1ccc(F)cc1	ZINC000473789273	458843794	/nfs/dbraw/zinc/84/37/94/458843794.db2.gz	MLYBCCFTGYVOHA-CYBMUJFWSA-N	0	3	332.448	3.314	20	30		EGEDHN
CN(C(=O)CN[C@H](c1cccs1)C1CC1)C1(C#N)CCCCC1	ZINC000553313757	458894420	/nfs/dbraw/zinc/89/44/20/458894420.db2.gz	ZKLOPCWPFCCTPX-KRWDZBQOSA-N	0	3	331.485	3.474	20	30		EGEDHN
C[C@H](CNC(=O)c1ccc(C(C)(C)C#N)cc1)N1CCCC[C@H]1C	ZINC000474890228	458905641	/nfs/dbraw/zinc/90/56/41/458905641.db2.gz	UGEPHKRMWGFUHI-HZPDHXFCSA-N	0	3	327.472	3.480	20	30		EGEDHN
CC#CCCCC(=O)NCC1(N2CCOC(C)(C)C2)CCCCC1	ZINC000466644982	458910518	/nfs/dbraw/zinc/91/05/18/458910518.db2.gz	ZGXBYYLRHADTJR-UHFFFAOYSA-N	0	3	334.504	3.110	20	30		EGEDHN
CC[C@H](Cc1ccc(C)cc1)N(CC)CC(=O)N[C@](C)(C#N)C1CC1	ZINC000441358828	458926897	/nfs/dbraw/zinc/92/68/97/458926897.db2.gz	OQTJONCVWJJMJS-TZIWHRDSSA-N	0	3	341.499	3.447	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(CC)Cc2cccc(F)c2)CC1	ZINC000519282750	458931036	/nfs/dbraw/zinc/93/10/36/458931036.db2.gz	NRRUBOHZCGFQQP-UHFFFAOYSA-N	0	3	333.451	3.398	20	30		EGEDHN
C=CCN(CCc1ccccc1)C(=O)NCCN1CCC[C@H](C)C1	ZINC000519505559	458953154	/nfs/dbraw/zinc/95/31/54/458953154.db2.gz	BKUBJFAKIHHABI-SFHVURJKSA-N	0	3	329.488	3.159	20	30		EGEDHN
C=CCn1c(CC)nnc1N1CCN(Cc2ccccc2)[C@@H](CC)C1	ZINC000566666177	458979142	/nfs/dbraw/zinc/97/91/42/458979142.db2.gz	QVEKGCGCPNNWSE-SFHVURJKSA-N	0	3	339.487	3.127	20	30		EGEDHN
CC(C)Sc1ccc([C@@H](C)NC[C@@H](O)CN(C)CCC#N)cc1	ZINC000577097634	458979298	/nfs/dbraw/zinc/97/92/98/458979298.db2.gz	GHXNLRVJKUTZIS-NVXWUHKLSA-N	0	3	335.517	3.044	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@H]1CC[C@H](NCc2ccc(C#N)cc2F)C1	ZINC000495916292	459005826	/nfs/dbraw/zinc/00/58/26/459005826.db2.gz	VAEJZGYJNOCJGH-HOCLYGCPSA-N	0	3	347.434	3.480	20	30		EGEDHN
CN(CCCOc1cccc(C#N)c1)Cc1cc(C(C)(C)C)[nH]n1	ZINC000519800775	459006916	/nfs/dbraw/zinc/00/69/16/459006916.db2.gz	NQUOAQJXNCDTPP-UHFFFAOYSA-N	0	3	326.444	3.480	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(CC#N)cc2)C[C@H]1NC(=O)OC(C)(C)C	ZINC000495960856	459019713	/nfs/dbraw/zinc/01/97/13/459019713.db2.gz	OPZQAYUJXYQQBO-RHSMWYFYSA-N	0	3	329.444	3.098	20	30		EGEDHN
CCCN(CC(=O)N[C@@](C)(C#N)C(C)C)[C@@H]1CCc2ccccc21	ZINC000519906550	459019938	/nfs/dbraw/zinc/01/99/38/459019938.db2.gz	JMBPAUWXIPZGLJ-QUCCMNQESA-N	0	3	327.472	3.440	20	30		EGEDHN
CCC[C@H](N[C@@H]1CC[C@H](C#N)C1)C(=O)N1CCc2sccc2C1	ZINC000442785682	459035293	/nfs/dbraw/zinc/03/52/93/459035293.db2.gz	SHIZWUAIFHCSPL-IMJJTQAJSA-N	0	3	331.485	3.083	20	30		EGEDHN
C[C@@H]1CC[C@H](C)N1CC(=O)NCC#Cc1ccc(C(F)(F)F)cc1	ZINC000477636588	459052413	/nfs/dbraw/zinc/05/24/13/459052413.db2.gz	FUGBLUNTYZBWBL-OKILXGFUSA-N	0	3	338.373	3.046	20	30		EGEDHN
C=C(C)CN(CC)C(=O)NCc1ccc(OCCN2CCCC2)cc1	ZINC000477661238	459052825	/nfs/dbraw/zinc/05/28/25/459052825.db2.gz	LLSZOXNNTQESQC-UHFFFAOYSA-N	0	3	345.487	3.269	20	30		EGEDHN
C=C(C)Cn1c(CC)nnc1N1CCN(C2CCC(C)CC2)CC1	ZINC000520369270	459053121	/nfs/dbraw/zinc/05/31/21/459053121.db2.gz	MMNOMUUCBMIKLB-UHFFFAOYSA-N	0	3	331.508	3.117	20	30		EGEDHN
C[C@H](NC(=O)NCC#Cc1ccccc1)[C@H](c1ccccc1)N(C)C	ZINC000477820117	459061119	/nfs/dbraw/zinc/06/11/19/459061119.db2.gz	PMLRHHPDBCNRFJ-FXAWDEMLSA-N	0	3	335.451	3.029	20	30		EGEDHN
N#CCCCOc1cccc(CN[C@@H]2CCc3ccccc3NC2=O)c1	ZINC000594509733	459067570	/nfs/dbraw/zinc/06/75/70/459067570.db2.gz	LUVCNEZLMQJKRU-HXUWFJFHSA-N	0	3	349.434	3.412	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@H]2CN(C)C[C@@H]2c2ccccc2)cc1	ZINC000478405030	459089865	/nfs/dbraw/zinc/08/98/65/459089865.db2.gz	ZKAJUBICFKIWOP-UXHICEINSA-N	0	3	336.435	3.079	20	30		EGEDHN
C[C@@H](CNC(=O)NC1(c2cccc(C#N)c2)CC1)N1CCCC[C@@H]1C	ZINC000479387242	459137218	/nfs/dbraw/zinc/13/72/18/459137218.db2.gz	NPGCHCALTIYMOO-HOTGVXAUSA-N	0	3	340.471	3.109	20	30		EGEDHN
COc1ccc(N2C[C@H](N[C@@H](C)c3cccc(C#N)c3)CC2=O)cc1	ZINC000594723194	459139742	/nfs/dbraw/zinc/13/97/42/459139742.db2.gz	YSQAJPPXVCRWGH-WMLDXEAASA-N	0	3	335.407	3.023	20	30		EGEDHN
Cc1cc(C#N)ccc1CN(CCC(N)=O)[C@H]1CCOc2ccccc21	ZINC000590759535	459208672	/nfs/dbraw/zinc/20/86/72/459208672.db2.gz	MILKFLAGAFTIPE-IBGZPJMESA-N	0	3	349.434	3.068	20	30		EGEDHN
CC[C@H](NCc1cccc(S(C)(=O)=O)c1)c1ccc(C#N)cc1	ZINC000590779401	459214448	/nfs/dbraw/zinc/21/44/48/459214448.db2.gz	MOOXTDOEMTWBHB-SFHVURJKSA-N	0	3	328.437	3.203	20	30		EGEDHN
C#CC[C@@H](CC(F)(F)F)NC1CC2(C1)CN(C(=O)OC(C)(C)C)C2	ZINC000496502213	459217442	/nfs/dbraw/zinc/21/74/42/459217442.db2.gz	VMIOKZNVOPCMMG-LBPRGKRZSA-N	0	3	346.393	3.320	20	30		EGEDHN
N#CCc1ccc(OC[C@H](O)CN[C@@H](c2cccs2)C2CC2)cc1	ZINC000578538097	459219207	/nfs/dbraw/zinc/21/92/07/459219207.db2.gz	LNYNYQRNAIOIOE-VQIMIIECSA-N	0	3	342.464	3.295	20	30		EGEDHN
CN(CCC#N)C[C@H](O)CNCc1ccc(C2CCCCC2)cc1	ZINC000578741495	459238471	/nfs/dbraw/zinc/23/84/71/459238471.db2.gz	ZFSBIMGTFLFVIO-HXUWFJFHSA-N	0	3	329.488	3.030	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN1CCC[C@@H](c2ccc(F)cc2)CC1	ZINC000481426103	459253649	/nfs/dbraw/zinc/25/36/49/459253649.db2.gz	MTUDJPZAXAHPBR-DLBZAZTESA-N	0	3	345.462	3.403	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CCC(CCC#N)CC1)C(C)C	ZINC000580643047	459262190	/nfs/dbraw/zinc/26/21/90/459262190.db2.gz	ROVOUCMPOKBXNK-LJQANCHMSA-N	0	3	346.519	3.410	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@@H]2C[C@H]2c2ccccc2F)cc1	ZINC000590917394	459267777	/nfs/dbraw/zinc/26/77/77/459267777.db2.gz	VVWVOWHNWXIRBU-HHXXYDBFSA-N	0	3	333.366	3.052	20	30		EGEDHN
C=CCCSCCNC(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000595426352	459296595	/nfs/dbraw/zinc/29/65/95/459296595.db2.gz	TYMHOIJZAYXZEI-UHFFFAOYSA-N	0	3	347.528	3.260	20	30		EGEDHN
N#Cc1ccc(CCN[C@H](CO)c2ccc(C(F)(F)F)cc2)cc1	ZINC000595428679	459298492	/nfs/dbraw/zinc/29/84/92/459298492.db2.gz	GKEDMWIHRPGHKZ-QGZVFWFLSA-N	0	3	334.341	3.443	20	30		EGEDHN
Cc1cccc(CC2(O)CCN(CCc3ccc(C#N)cc3)CC2)c1	ZINC000595465036	459312270	/nfs/dbraw/zinc/31/22/70/459312270.db2.gz	MOAOIGZKYNRYHP-UHFFFAOYSA-N	0	3	334.463	3.479	20	30		EGEDHN
CC#CCCNC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1	ZINC000482626234	459317250	/nfs/dbraw/zinc/31/72/50/459317250.db2.gz	DJTOURUULJHDOH-MRXNPFEDSA-N	0	3	333.501	3.234	20	30		EGEDHN
C[C@H](CN1CCC(C)CC1)NC(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000595568550	459350070	/nfs/dbraw/zinc/35/00/70/459350070.db2.gz	VLCWKBWAIQNRIU-MJGOQNOKSA-N	0	3	342.487	3.451	20	30		EGEDHN
C[C@H]1[C@H](Cc2ccccc2)CCN1Cc1cnc2c(C#N)cnn2c1	ZINC000582360838	459352804	/nfs/dbraw/zinc/35/28/04/459352804.db2.gz	UESYWFOCKXYBIX-YJBOKZPZSA-N	0	3	331.423	3.054	20	30		EGEDHN
C=CCN1CC[C@H](S[C@@H]2CCCN(Cc3ccccc3)C2)C1=O	ZINC000568882796	459361230	/nfs/dbraw/zinc/36/12/30/459361230.db2.gz	DJPDNOLYXKKIDD-MSOLQXFVSA-N	0	3	330.497	3.171	20	30		EGEDHN
CC(C)(C)c1ccc(OC[C@H](O)CN2CCC[C@H](CC#N)C2)cc1	ZINC000595608907	459364375	/nfs/dbraw/zinc/36/43/75/459364375.db2.gz	BPTKMJNOJNCKHA-SJLPKXTDSA-N	0	3	330.472	3.349	20	30		EGEDHN
C=CCN(C(=O)NC[C@H](c1cccc(OC)c1)N(CC)CC)C1CC1	ZINC000537856527	459367302	/nfs/dbraw/zinc/36/73/02/459367302.db2.gz	GAJAGSKJNSIHHS-LJQANCHMSA-N	0	3	345.487	3.438	20	30		EGEDHN
N#CC[C@H]1CCCN(C[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000595613782	459369063	/nfs/dbraw/zinc/36/90/63/459369063.db2.gz	HIZDXCLXTCTCNJ-UKRRQHHQSA-N	0	3	342.361	3.071	20	30		EGEDHN
N#CC[C@@H]1CCCN(CCC(=O)Nc2ccc(C#N)c(Cl)c2)C1	ZINC000595613933	459369263	/nfs/dbraw/zinc/36/92/63/459369263.db2.gz	FUVZGIVNSSVXGK-ZDUSSCGKSA-N	0	3	330.819	3.166	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@@H](N[C@H]1CCN(C(=O)Nc3ccccc3)C1)CC2	ZINC000582479427	459370691	/nfs/dbraw/zinc/37/06/91/459370691.db2.gz	WNPHQKRLSHDISB-ICSRJNTNSA-N	0	3	346.434	3.442	20	30		EGEDHN
COc1cccc(OC)c1OCCCCN1CCC[C@@H](CC#N)C1	ZINC000595623199	459373019	/nfs/dbraw/zinc/37/30/19/459373019.db2.gz	JQEVLRAMXAQPKO-INIZCTEOSA-N	0	3	332.444	3.488	20	30		EGEDHN
N#CC[C@@H]1CCCN(C[C@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000595621530	459373106	/nfs/dbraw/zinc/37/31/06/459373106.db2.gz	WBRGQNXUDMQVDL-GOEBONIOSA-N	0	3	326.362	3.234	20	30		EGEDHN
C=CCCC[C@@H](C)NC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000540573024	459382645	/nfs/dbraw/zinc/38/26/45/459382645.db2.gz	URJNDWZWLZAWAE-QGZVFWFLSA-N	0	3	342.487	3.376	20	30		EGEDHN
C[C@@H](CNC(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1)N1CCCC[C@H]1C	ZINC000560686604	459386866	/nfs/dbraw/zinc/38/68/66/459386866.db2.gz	WYMKRNJVIHOFIL-LVFSCSRESA-N	0	3	325.456	3.041	20	30		EGEDHN
Cc1ccccc1OC[C@H](O)CNCc1ccc(C#N)c(Cl)c1	ZINC000591765892	459431276	/nfs/dbraw/zinc/43/12/76/459431276.db2.gz	OUGAEOFTAHKYLF-MRXNPFEDSA-N	0	3	330.815	3.050	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1CCC[C@@H]([C@H]2CCCCO2)C1	ZINC000595790403	459442846	/nfs/dbraw/zinc/44/28/46/459442846.db2.gz	PSCOHGQINPUEIU-QZTJIDSGSA-N	0	3	344.455	3.227	20	30		EGEDHN
CC(C)[C@H]1N(C(=O)C(C#N)CCc2ccccc2)CC12CCOCC2	ZINC000569555109	459470210	/nfs/dbraw/zinc/47/02/10/459470210.db2.gz	YHGLEWDQQKJVRL-RTBURBONSA-N	0	3	340.467	3.423	20	30		EGEDHN
C=C(C)CN1CCC([C@H]2OCCC[C@@H]2NC(=O)OC(C)(C)C)CC1	ZINC000497210238	459487634	/nfs/dbraw/zinc/48/76/34/459487634.db2.gz	ADVFUYJVEUONOT-DLBZAZTESA-N	0	3	338.492	3.347	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@H](N[C@@H]3CCc4ccccc43)C2=O)cc1	ZINC000541881720	459504571	/nfs/dbraw/zinc/50/45/71/459504571.db2.gz	LYWFRIZKOYSQQN-UXHICEINSA-N	0	3	331.419	3.331	20	30		EGEDHN
C[C@H](N[C@@H]1CCCN(C)C1=O)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000542004676	459519255	/nfs/dbraw/zinc/51/92/55/459519255.db2.gz	LYWBLFQYAUMWAQ-MGPUTAFESA-N	0	3	333.435	3.497	20	30		EGEDHN
C=C(CN[C@H](CCCC)C(=O)Nc1cc(C)on1)c1ccccc1	ZINC000487901876	459535164	/nfs/dbraw/zinc/53/51/64/459535164.db2.gz	WRGIWEWUZRBFHN-QGZVFWFLSA-N	0	3	327.428	3.205	20	30		EGEDHN
C=CCn1cccc1C(=O)N(C)CC1CCN(c2ccncc2)CC1	ZINC000488810070	459551656	/nfs/dbraw/zinc/55/16/56/459551656.db2.gz	PKOPAWWRKQEECT-UHFFFAOYSA-N	0	3	338.455	3.058	20	30		EGEDHN
C[C@H](Nc1nc(C#N)c(Cl)s1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000596185938	459552915	/nfs/dbraw/zinc/55/29/15/459552915.db2.gz	HLRWLTDIFOPOAQ-JSGCOSHPSA-N	0	3	346.887	3.413	20	30		EGEDHN
C=C[C@@H]1CCCCN1C(=O)CCCN1CCN(c2ccccc2)CC1	ZINC000488863109	459553804	/nfs/dbraw/zinc/55/38/04/459553804.db2.gz	SFXYDCFHCSISJQ-LJQANCHMSA-N	0	3	341.499	3.156	20	30		EGEDHN
CCCN(C(=O)Nc1ccc(OC(C)C)c(C#N)c1)[C@@H]1CCN(C)C1	ZINC000592239303	459558230	/nfs/dbraw/zinc/55/82/30/459558230.db2.gz	KPVYDUJCRBTSFI-QGZVFWFLSA-N	0	3	344.459	3.293	20	30		EGEDHN
C=CCn1cccc1C(=O)N(CCN(C)C)Cc1cccc(F)c1	ZINC000489052984	459559704	/nfs/dbraw/zinc/55/97/04/459559704.db2.gz	QAOJUECSVFMYEL-UHFFFAOYSA-N	0	3	329.419	3.017	20	30		EGEDHN
C[C@H](C(=O)NC1(C#N)CCC1)N1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2	ZINC000571227923	459565692	/nfs/dbraw/zinc/56/56/92/459565692.db2.gz	IMUXSCRWUCXXCD-OQIJWPOYSA-N	0	3	337.467	3.348	20	30		EGEDHN
N#CCCn1cc(CN2CC(C3CCCC3)C2)c(-c2ccncc2)n1	ZINC000583610430	459567257	/nfs/dbraw/zinc/56/72/57/459567257.db2.gz	ANGVLZKNOOSMNC-UHFFFAOYSA-N	0	3	335.455	3.481	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H]2CC=C(c3ccc(F)cc3)CC2)CC1	ZINC000490915724	459590047	/nfs/dbraw/zinc/59/00/47/459590047.db2.gz	OMCXXYDJRUTNKF-FQEVSTJZSA-N	0	3	340.442	3.223	20	30		EGEDHN
Cc1ccc(NC(=O)N2CCC(CC#N)CC2)c(OCCN(C)C)c1	ZINC000542901713	459608132	/nfs/dbraw/zinc/60/81/32/459608132.db2.gz	JNNMRLMITMPENW-UHFFFAOYSA-N	0	3	344.459	3.093	20	30		EGEDHN
C=CCN(CCc1ccco1)C[C@H](O)COc1cc(C)cc(C)c1	ZINC000491344277	459618305	/nfs/dbraw/zinc/61/83/05/459618305.db2.gz	YLCMPKFQEVGWMN-SFHVURJKSA-N	0	3	329.440	3.367	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H]2C[C@H]2c2ccc3ccccc3c2)CC1	ZINC000491361383	459620083	/nfs/dbraw/zinc/62/00/83/459620083.db2.gz	LFIUVQXMQJUHNE-LEWJYISDSA-N	0	3	332.447	3.157	20	30		EGEDHN
N#Cc1ccnc(N(CCN2CCCC2)Cc2ccc(Cl)cc2)n1	ZINC000562689397	459622800	/nfs/dbraw/zinc/62/28/00/459622800.db2.gz	SOPLFZDLUVRHQL-UHFFFAOYSA-N	0	3	341.846	3.104	20	30		EGEDHN
C[C@H](NCC1(c2cccs2)CCCCC1)C(=O)NC1(C#N)CCC1	ZINC000527293954	459623478	/nfs/dbraw/zinc/62/34/78/459623478.db2.gz	XVLPEFCGFXMPKG-HNNXBMFYSA-N	0	3	345.512	3.491	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cnn(CCCC)c2C(C)C)CC1	ZINC000491496812	459631717	/nfs/dbraw/zinc/63/17/17/459631717.db2.gz	TWHIZLNCWFMALN-UHFFFAOYSA-N	0	3	330.476	3.090	20	30		EGEDHN
Cc1cc(C)c(C#N)c(NCC2CCN(Cc3ccncc3)CC2)n1	ZINC000596441166	459636963	/nfs/dbraw/zinc/63/69/63/459636963.db2.gz	PHBFDTUYGXAEOO-UHFFFAOYSA-N	0	3	335.455	3.289	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc3ccnc(Cl)c3c2)CC1	ZINC000491651375	459646403	/nfs/dbraw/zinc/64/64/03/459646403.db2.gz	GJWSEFJYEGXYBV-UHFFFAOYSA-N	0	3	327.815	3.172	20	30		EGEDHN
C=CCN1CC[C@@H](NC(C)(C)Cc2ccc(C(F)(F)F)cc2)C1=O	ZINC000499722619	459649509	/nfs/dbraw/zinc/64/95/09/459649509.db2.gz	YKYYAMWKFMFYLC-OAHLLOKOSA-N	0	3	340.389	3.403	20	30		EGEDHN
Cc1cc(CN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)ccn1	ZINC000527536328	459657632	/nfs/dbraw/zinc/65/76/32/459657632.db2.gz	WMLYWWSEXPBCHS-UHFFFAOYSA-N	0	3	334.423	3.112	20	30		EGEDHN
C#CCCN1CCC(NC(=O)/C=C\c2ccc(F)c(Cl)c2)CC1	ZINC000492080720	459691256	/nfs/dbraw/zinc/69/12/56/459691256.db2.gz	DIVMIJCFLIMGRC-ALCCZGGFSA-N	0	3	334.822	3.096	20	30		EGEDHN
CCCN(C(=O)CCCCOc1cccc(C#N)c1)[C@@H]1CCN(C)C1	ZINC000592833357	459701382	/nfs/dbraw/zinc/70/13/82/459701382.db2.gz	YXWWFPFRDHEBCB-GOSISDBHSA-N	0	3	343.471	3.050	20	30		EGEDHN
CC(C)N(C(=O)c1c[nH]c(C#N)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000592870040	459707135	/nfs/dbraw/zinc/70/71/35/459707135.db2.gz	CBQTXSKVTMNFQZ-LJQANCHMSA-N	0	3	336.439	3.011	20	30		EGEDHN
Cc1cc(NC[C@@H](C#N)CCC#N)cc(N2CCN(C(C)C)CC2)c1	ZINC000584444867	459738926	/nfs/dbraw/zinc/73/89/26/459738926.db2.gz	FUDZFCCRZKOGRF-GOSISDBHSA-N	0	3	339.487	3.381	20	30		EGEDHN
N#Cc1cc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)ccc1F	ZINC000593050728	459756235	/nfs/dbraw/zinc/75/62/35/459756235.db2.gz	VIZBGSWGDVNOFH-RYUDHWBXSA-N	0	3	330.281	3.383	20	30		EGEDHN
C=CCn1c(-c2ccccc2F)nnc1N1C[C@H](C)N(CC)C[C@H]1C	ZINC000564384508	459773715	/nfs/dbraw/zinc/77/37/15/459773715.db2.gz	OTXOWZDIRIUEPW-LSDHHAIUSA-N	0	3	343.450	3.189	20	30		EGEDHN
CC(C)(CC#N)CNC[C@@H](O)COc1ccc(Cl)cc1Cl	ZINC000564860549	459777309	/nfs/dbraw/zinc/77/73/09/459777309.db2.gz	RSQYOIFLVLCTSB-GFCCVEGCSA-N	0	3	331.243	3.263	20	30		EGEDHN
N#Cc1ccc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)cc1F	ZINC000593158156	459791325	/nfs/dbraw/zinc/79/13/25/459791325.db2.gz	SJLOWSYIDHSDOX-NWDGAFQWSA-N	0	3	330.281	3.383	20	30		EGEDHN
N#CC1(C[C@@H](O)CN2CCC[C@H](c3nc4ccc(F)cc4o3)C2)CC1	ZINC000528421499	459806499	/nfs/dbraw/zinc/80/64/99/459806499.db2.gz	QUQYLAANEBWDKB-DZGCQCFKSA-N	0	3	343.402	3.201	20	30		EGEDHN
C[C@@H](CCc1ccccc1)CN1CCN(c2cnccc2C#N)CC1	ZINC000584816275	459806530	/nfs/dbraw/zinc/80/65/30/459806530.db2.gz	CZDFHUWSZVHPMX-SFHVURJKSA-N	0	3	334.467	3.344	20	30		EGEDHN
Cc1cc(NC(=O)[C@@]2(C#N)C[C@@H]2C)cc(N2CCN(C(C)C)CC2)c1	ZINC000584821246	459807743	/nfs/dbraw/zinc/80/77/43/459807743.db2.gz	ZMTPIQPQJYNORG-OXJNMPFZSA-N	0	3	340.471	3.014	20	30		EGEDHN
CC(C)(C)c1ncc2c(n1)CCN(CCCC1(C#N)CCOCC1)C2	ZINC000528598626	459811238	/nfs/dbraw/zinc/81/12/38/459811238.db2.gz	SFYAMTGKPBTHII-UHFFFAOYSA-N	0	3	342.487	3.233	20	30		EGEDHN
COCCc1ccc(OC[C@H](C)NCc2ccc(C#N)c(F)c2)cc1	ZINC000597144412	459851313	/nfs/dbraw/zinc/85/13/13/459851313.db2.gz	QINXGZHQDXTZPS-HNNXBMFYSA-N	0	3	342.414	3.443	20	30		EGEDHN
Cc1csc(NC(=O)[C@@H]2CCN(Cc3ccccc3)C2)c1C#N	ZINC000602337278	459897972	/nfs/dbraw/zinc/89/79/72/459897972.db2.gz	VNTRWGOUMIMVFX-OAHLLOKOSA-N	0	3	325.437	3.389	20	30		EGEDHN
C[C@H](c1ccccc1)[C@@H](O)CNC(=O)C(C#N)CCc1ccccc1	ZINC000598480629	459910767	/nfs/dbraw/zinc/91/07/67/459910767.db2.gz	WKIKKQPJHCSFJO-AHRSYUTCSA-N	0	3	336.435	3.040	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)CCCCCC#N	ZINC000588160345	459921523	/nfs/dbraw/zinc/92/15/23/459921523.db2.gz	GWLNNBSWHUHNSS-IEBWSBKVSA-N	0	3	327.472	3.487	20	30		EGEDHN
CN(C)C[C@H]1CN(C(=O)CC2(C#N)CCCCC2)c2ccccc2O1	ZINC000597384076	459935383	/nfs/dbraw/zinc/93/53/83/459935383.db2.gz	BJOTVAOWSHMFTH-INIZCTEOSA-N	0	3	341.455	3.206	20	30		EGEDHN
CC(C)[C@H]1CN(C(=O)c2ccccc2-c2ccccc2C#N)CCN1	ZINC000598577782	459947422	/nfs/dbraw/zinc/94/74/22/459947422.db2.gz	XIXAANMFKWSRMX-HXUWFJFHSA-N	0	3	333.435	3.295	20	30		EGEDHN
C[C@H](CCC#N)CN1CCN(C(=O)Cc2cccc(Cl)c2)[C@@H](C)C1	ZINC000602475009	459957000	/nfs/dbraw/zinc/95/70/00/459957000.db2.gz	HCZRTKYIDOTZBJ-CVEARBPZSA-N	0	3	347.890	3.355	20	30		EGEDHN
CCn1cc([C@@H](C)NC2CCN(Cc3cccc(C#N)c3)CC2)cn1	ZINC000593719877	459961792	/nfs/dbraw/zinc/96/17/92/459961792.db2.gz	CXHYTUUHXGBRCA-MRXNPFEDSA-N	0	3	337.471	3.090	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN1CC2(CCOCC2)[C@@H]1c1ccccc1	ZINC000598623192	459966873	/nfs/dbraw/zinc/96/68/73/459966873.db2.gz	VMMYLELXCMVNMU-MSOLQXFVSA-N	0	3	328.456	3.141	20	30		EGEDHN
CC(C)N(CCC#N)C(=O)[C@@H](C)N1CCC(Cc2ccccc2)CC1	ZINC000609516721	459972808	/nfs/dbraw/zinc/97/28/08/459972808.db2.gz	HRWMBSOGGLASGM-GOSISDBHSA-N	0	3	341.499	3.480	20	30		EGEDHN
Cc1cc(Br)ccc1NC(=O)CNC[C@H](C)CCC#N	ZINC000602527933	459982758	/nfs/dbraw/zinc/98/27/58/459982758.db2.gz	KKRLDROLFQDQJL-LLVKDONJSA-N	0	3	338.249	3.226	20	30		EGEDHN
COc1ccc(C(C)(C)CNCc2cccc(C#N)n2)cc1OC	ZINC000602541778	459990491	/nfs/dbraw/zinc/99/04/91/459990491.db2.gz	ZRXFXKTUJLNSGR-UHFFFAOYSA-N	0	3	325.412	3.038	20	30		EGEDHN
C[C@@H](CNCc1cccc(C#N)n1)Oc1ccc(Br)cc1	ZINC000602569426	460001295	/nfs/dbraw/zinc/00/12/95/460001295.db2.gz	RRYQRXUFUQOOED-LBPRGKRZSA-N	0	3	346.228	3.273	20	30		EGEDHN
CCc1nc2cc(CNC[C@H](O)CC(C)(C)C#N)ccc2n1C1CC1	ZINC000598728949	460008339	/nfs/dbraw/zinc/00/83/39/460008339.db2.gz	XPQLBFCZILMBIB-MRXNPFEDSA-N	0	3	340.471	3.324	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CNCc1cc(F)c(C(F)(F)F)cc1F	ZINC000598728328	460008411	/nfs/dbraw/zinc/00/84/11/460008411.db2.gz	QLZJBKHCEPQFPK-SNVBAGLBSA-N	0	3	336.304	3.374	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000593949120	460023499	/nfs/dbraw/zinc/02/34/99/460023499.db2.gz	WCHQSTPDNWPRII-LAUBAEHRSA-N	0	3	347.462	3.128	20	30		EGEDHN
CN(C)[C@H](CNCc1cccc(C#N)n1)c1cccc(C(F)(F)F)c1	ZINC000602620325	460026012	/nfs/dbraw/zinc/02/60/12/460026012.db2.gz	VFJOIFXLFGTFBT-QGZVFWFLSA-N	0	3	348.372	3.365	20	30		EGEDHN
N#Cc1cccc(CN2CCC(NCc3nc4ccccc4o3)CC2)c1	ZINC000602707007	460075749	/nfs/dbraw/zinc/07/57/49/460075749.db2.gz	SDSHUCPBUXGJFT-UHFFFAOYSA-N	0	3	346.434	3.454	20	30		EGEDHN
COc1cccc(CCCN2CCN(Cc3ccc(C#N)cc3)CC2)c1	ZINC000610211986	460083448	/nfs/dbraw/zinc/08/34/48/460083448.db2.gz	BGQMQBHEHSKAEO-UHFFFAOYSA-N	0	3	349.478	3.317	20	30		EGEDHN
C[C@H]1C[C@@H](N(C)C(=O)c2cccc(C#N)n2)CCN1Cc1ccccc1	ZINC000589427935	460085236	/nfs/dbraw/zinc/08/52/36/460085236.db2.gz	QZJDZNDGPSRMDN-LPHOPBHVSA-N	0	3	348.450	3.078	20	30		EGEDHN
Cn1ccnc1[C@@H]1N(C(=O)C(C#N)CCc2ccccc2)CC1(C)C	ZINC000576198111	460088595	/nfs/dbraw/zinc/08/85/95/460088595.db2.gz	UCMDURZDKLARBF-IRXDYDNUSA-N	0	3	336.439	3.102	20	30		EGEDHN
Cc1cnccc1CCN1CCC(Oc2ccc(C#N)cc2F)CC1	ZINC000576395255	460132563	/nfs/dbraw/zinc/13/25/63/460132563.db2.gz	HQTFQYPMGQJLNV-UHFFFAOYSA-N	0	3	339.414	3.487	20	30		EGEDHN
COc1cc(CN[C@H]2CCc3cc(C#N)ccc32)cc(OC)c1OC	ZINC000618742656	460151746	/nfs/dbraw/zinc/15/17/46/460151746.db2.gz	OHKVTQPKSPJXSJ-KRWDZBQOSA-N	0	3	338.407	3.361	20	30		EGEDHN
CN(C)CCc1ccccc1NC(=O)N[C@H]1CCc2cc(C#N)ccc21	ZINC000618766924	460162317	/nfs/dbraw/zinc/16/23/17/460162317.db2.gz	QFVVFQNPFLIORU-FQEVSTJZSA-N	0	3	348.450	3.471	20	30		EGEDHN
C[C@@H](C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1)C1CCCC1	ZINC000610520156	460174561	/nfs/dbraw/zinc/17/45/61/460174561.db2.gz	ONSTYMAGXGBWDI-MRXNPFEDSA-N	0	3	327.472	3.275	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)C(=O)N1CCN(C2CCC2)C[C@@H](C)C1	ZINC000594363258	460195764	/nfs/dbraw/zinc/19/57/64/460195764.db2.gz	OXXAHBJXKYOSRZ-SJORKVTESA-N	0	3	339.483	3.070	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1nn(C)c2ccccc12)C(C)C	ZINC000625558045	460205123	/nfs/dbraw/zinc/20/51/23/460205123.db2.gz	SKPZCNUDXBPOTL-GOSISDBHSA-N	0	3	340.471	3.002	20	30		EGEDHN
CC(C)N(Cc1ccc(F)cc1)C[C@H](O)COc1ccccc1C#N	ZINC000599273436	460213493	/nfs/dbraw/zinc/21/34/93/460213493.db2.gz	DJHGCCSNBZXICR-IBGZPJMESA-N	0	3	342.414	3.348	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC(=O)Nc1cccc(Cl)c1Cl	ZINC000576791251	460213534	/nfs/dbraw/zinc/21/35/34/460213534.db2.gz	QHGVPFUWIRSQNH-YPMHNXCESA-N	0	3	329.227	3.255	20	30		EGEDHN
C[C@H]1CN(C(=O)[C@@H](N)CCCCC#N)CCc2ccc(Cl)cc21	ZINC000594452191	460224877	/nfs/dbraw/zinc/22/48/77/460224877.db2.gz	DVFZEAQCYXWNGQ-GUYCJALGSA-N	0	3	333.863	3.239	20	30		EGEDHN
CC(C)[C@H](NC[C@H](O)COc1ccccc1C#N)c1ccc(F)cc1	ZINC000599312483	460227053	/nfs/dbraw/zinc/22/70/53/460227053.db2.gz	UTNVBZZOPKKFNA-ICSRJNTNSA-N	0	3	342.414	3.424	20	30		EGEDHN
C/C(=C\c1ccccc1)CN(C)C[C@@H](O)COc1ccccc1C#N	ZINC000599388287	460244724	/nfs/dbraw/zinc/24/47/24/460244724.db2.gz	GFDLQWALKWISRZ-KEWOFRHOSA-N	0	3	336.435	3.333	20	30		EGEDHN
CC(C)[C@H]1CN(C[C@@H](O)CC(C)(C)C#N)CCN1Cc1ccccc1	ZINC000599549003	460271695	/nfs/dbraw/zinc/27/16/95/460271695.db2.gz	LWAABUGACXCQNP-VQTJNVASSA-N	0	3	343.515	3.130	20	30		EGEDHN
C[C@H]1CN(CCOc2cccc(C#N)c2)CC[C@H]1C(=O)OC(C)(C)C	ZINC000599586147	460280571	/nfs/dbraw/zinc/28/05/71/460280571.db2.gz	HBCCCKHAORSXOG-MAUKXSAKSA-N	0	3	344.455	3.237	20	30		EGEDHN
Cc1nnc2ccc(C(=O)C(C#N)c3ccc4ccccc4n3)cn12	ZINC000603627831	460328532	/nfs/dbraw/zinc/32/85/32/460328532.db2.gz	YKJGZFDDAIICEE-HNNXBMFYSA-N	0	3	327.347	3.076	20	30		EGEDHN
C[C@H](NC[C@H](O)COc1ccc(Cl)cc1)c1cccc(C#N)c1	ZINC000611387282	460351350	/nfs/dbraw/zinc/35/13/50/460351350.db2.gz	JFPMNWMHSMTUJN-GUYCJALGSA-N	0	3	330.815	3.302	20	30		EGEDHN
CN(CCOC(C)(C)C)Cc1cn(C)nc1-c1ccc(C#N)cc1	ZINC000611518954	460385824	/nfs/dbraw/zinc/38/58/24/460385824.db2.gz	VOFJZORNXMZIJD-UHFFFAOYSA-N	0	3	326.444	3.206	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN(C)C[C@H](C)C(=O)OC)cc1OC	ZINC000600112965	460388215	/nfs/dbraw/zinc/38/82/15/460388215.db2.gz	PDCWBBBPZLQJPG-LBPRGKRZSA-N	0	3	341.835	3.154	20	30		EGEDHN
C=CCOc1ccc(C(F)(F)F)cc1C(=O)NCCN(C)C1CC1	ZINC000606835987	460746190	/nfs/dbraw/zinc/74/61/90/460746190.db2.gz	BYJQGEIKNQWINE-UHFFFAOYSA-N	0	3	342.361	3.094	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H]2C[C@]2(C)c2ccccc2)CC1	ZINC000608426149	461060044	/nfs/dbraw/zinc/06/00/44/461060044.db2.gz	DSRAHQQOKQRVSP-AZUAARDMSA-N	0	3	327.472	3.056	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cccc(OC)c2OC(C)C)CC1	ZINC000668369887	461259595	/nfs/dbraw/zinc/25/95/95/461259595.db2.gz	HSWLUTHTEVLNNI-UHFFFAOYSA-N	0	3	346.471	3.253	20	30		EGEDHN
C=CCN1CCC(Nc2cc(-c3ccccc3)nc3ccnn32)CC1	ZINC000663569169	461708119	/nfs/dbraw/zinc/70/81/19/461708119.db2.gz	GRUSSPAUVDGRPI-UHFFFAOYSA-N	0	3	333.439	3.459	20	30		EGEDHN
C=CC[C@@H]1CCCN(CC(=O)NCCc2cccc3cccnc32)C1	ZINC000661379858	462225407	/nfs/dbraw/zinc/22/54/07/462225407.db2.gz	BLVHHIPAXSBGRM-QGZVFWFLSA-N	0	3	337.467	3.182	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@@H](CNCc2ccc(C#N)cc2F)C1	ZINC000236719357	534815560	/nfs/dbraw/zinc/81/55/60/534815560.db2.gz	CVWFOXOPBCTOPK-HNNXBMFYSA-N	0	3	347.434	3.434	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCC2(Sc3ccccc3)CC2)CC1	ZINC000171760875	526432756	/nfs/dbraw/zinc/43/27/56/526432756.db2.gz	XMSZBXBXKJBXLC-UHFFFAOYSA-N	0	3	345.512	3.261	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCCCc2cccc(Cl)c2)CC1	ZINC000171728282	526432877	/nfs/dbraw/zinc/43/28/77/526432877.db2.gz	JZMWHKMJCUHGAB-UHFFFAOYSA-N	0	3	335.879	3.222	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1	ZINC000171722734	526446504	/nfs/dbraw/zinc/44/65/04/526446504.db2.gz	INTVVDIRBNJMBK-UHFFFAOYSA-N	0	3	345.424	3.190	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc(C)c(OC)c2C)CC1	ZINC000171583122	526595379	/nfs/dbraw/zinc/59/53/79/526595379.db2.gz	PEOYBXWVIQYIRW-UHFFFAOYSA-N	0	3	331.460	3.474	20	30		EGEDHN
C=CCOc1ccc(CNC[C@](C)(O)c2cccs2)cc1OC	ZINC000152992655	526887264	/nfs/dbraw/zinc/88/72/64/526887264.db2.gz	UDDJAMZMEJADBF-SFHVURJKSA-N	0	3	333.453	3.319	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H](c2ccc(Cl)cc2)[C@@H]2C[C@H]2C)CC1	ZINC000174635117	526931890	/nfs/dbraw/zinc/93/18/90/526931890.db2.gz	XMSGKXJOYQIOBS-NIKGAXFTSA-N	0	3	344.886	3.499	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@H]1C[C@@H](C)N(C2CC2)C1	ZINC000129972677	528938321	/nfs/dbraw/zinc/93/83/21/528938321.db2.gz	JNNWLHWKYSNGMY-QAPCUYQASA-N	0	3	340.471	3.103	20	30		EGEDHN
CN(C)C[C@H](NC(=O)Nc1ccc(C#N)cc1)c1ccc(F)cc1	ZINC000338359047	535951577	/nfs/dbraw/zinc/95/15/77/535951577.db2.gz	NQSTXGGSMCFAPJ-KRWDZBQOSA-N	0	3	326.375	3.122	20	30		EGEDHN
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCc1cc(C#N)cs1	ZINC000342817889	536703764	/nfs/dbraw/zinc/70/37/64/536703764.db2.gz	HYCXDZKLBJZUIY-SUMWQHHRSA-N	0	3	328.437	3.130	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@@H](C)Oc2ccc(F)cc2Cl)CC1	ZINC000171976380	546996499	/nfs/dbraw/zinc/99/64/99/546996499.db2.gz	VYURFFNXAUQFEV-GFCCVEGCSA-N	0	3	340.826	3.013	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)[C@@]23CCC(=O)N2c2ccccc2S3)CCN1C	ZINC000329745510	547506535	/nfs/dbraw/zinc/50/65/35/547506535.db2.gz	YLCUJDHRZKCJNK-VFVRVIDISA-N	0	3	345.468	3.055	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N[C@@H]1CCC(F)(F)C1)C(C)C	ZINC000675662254	548955573	/nfs/dbraw/zinc/95/55/73/548955573.db2.gz	VPYCNVYBJXDYJA-CABCVRRESA-N	0	3	329.435	3.172	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N(C)Cc1ccc(C)cn1)C(C)C	ZINC000682701094	550132765	/nfs/dbraw/zinc/13/27/65/550132765.db2.gz	CNFLYIPNXLYRBK-IBGZPJMESA-N	0	3	344.503	3.230	20	30		EGEDHN
C=C(C)CN(Cc1ccccc1)C(=O)N[C@@H]1CCN(CC2CC2)C1	ZINC000684266705	550311475	/nfs/dbraw/zinc/31/14/75/550311475.db2.gz	CPIUIZNJIKMZAS-LJQANCHMSA-N	0	3	327.472	3.259	20	30		EGEDHN
CC1(C)CCN(Cc2cc(=O)n3c4ccccc4[nH]c3c2C#N)CC1	ZINC000726970814	574624896	/nfs/dbraw/zinc/62/48/96/574624896.db2.gz	ZMVBQSSETFHOBH-OAHLLOKOSA-N	0	3	334.423	3.346	20	30		EGEDHN
C#Cc1cccc(NC(=S)N2CCC[C@H]2CN2CCCCC2)c1	ZINC000727700141	574685717	/nfs/dbraw/zinc/68/57/17/574685717.db2.gz	HZPIOAMTGJROQP-SFHVURJKSA-N	0	3	327.497	3.315	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H](CN2CCCCC2)c2ccccc2)cn1	ZINC000728867407	574782224	/nfs/dbraw/zinc/78/22/24/574782224.db2.gz	KRUFPNPZNRFZCZ-HXUWFJFHSA-N	0	3	333.435	3.020	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](C)COc2ccc(C)cc2)CC1	ZINC000730023309	574906496	/nfs/dbraw/zinc/90/64/96/574906496.db2.gz	KSFYPXDPPZZJSL-KRWDZBQOSA-N	0	3	345.487	3.102	20	30		EGEDHN
Cc1cc(N=NC(C)c2ccc([O-])c(C[NH+]3CCCCC3)c2)ncn1	ZINC000731935580	575222603	/nfs/dbraw/zinc/22/26/03/575222603.db2.gz	HJBUJQVFFHJAEX-UHFFFAOYSA-N	0	3	339.443	3.313	20	30		EGEDHN
C[C@@H]1SCCN(CC(=O)C(C#N)c2nc3ccccc3s2)[C@H]1C	ZINC000735673408	575698194	/nfs/dbraw/zinc/69/81/94/575698194.db2.gz	BCALNQMXEOVZQN-RWMBFGLXSA-N	0	3	345.493	3.298	20	30		EGEDHN
CCN(CC)CC(=O)NCc1cccc(-c2ccc(C#N)s2)c1	ZINC000740128738	576552686	/nfs/dbraw/zinc/55/26/86/576552686.db2.gz	ULQDFZJBZJMSMA-UHFFFAOYSA-N	0	3	327.453	3.245	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)CCCc3nc(C4CC4)no3)nc21	ZINC000740562544	576599673	/nfs/dbraw/zinc/59/96/73/576599673.db2.gz	QZBAZXGBXZSRDN-ZDUSSCGKSA-N	0	3	349.394	3.331	20	30		EGEDHN
Cc1cccc2nc(C(C#N)C(=O)CCCc3nc(C4CC4)no3)[nH]c21	ZINC000740562544	576599676	/nfs/dbraw/zinc/59/96/76/576599676.db2.gz	QZBAZXGBXZSRDN-ZDUSSCGKSA-N	0	3	349.394	3.331	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2cc3cc(Cl)ccc3[nH]2)CC1	ZINC000740736116	576621453	/nfs/dbraw/zinc/62/14/53/576621453.db2.gz	FEZJDIWNUMOISL-UHFFFAOYSA-N	0	3	329.831	3.039	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2cnc(-c3ccccc3)s2)CC1	ZINC000740735453	576621486	/nfs/dbraw/zinc/62/14/86/576621486.db2.gz	GBYOQLNJHAJCPB-UHFFFAOYSA-N	0	3	339.464	3.028	20	30		EGEDHN
C#CCCN1CCC(NC(=O)COc2ccccc2[C@H](C)CC)CC1	ZINC000740737455	576621720	/nfs/dbraw/zinc/62/17/20/576621720.db2.gz	NOWDSGJLGNJELW-QGZVFWFLSA-N	0	3	342.483	3.183	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2ccc(-c3ccccc3)nc2C)CC1	ZINC000740737423	576621819	/nfs/dbraw/zinc/62/18/19/576621819.db2.gz	MSESXZPOSMYIAN-UHFFFAOYSA-N	0	3	347.462	3.275	20	30		EGEDHN
COc1ccc(CN[C@H]2CCN([C@@H](C)c3ccccc3)C2)cc1C#N	ZINC000742370379	576774893	/nfs/dbraw/zinc/77/48/93/576774893.db2.gz	PKKFNVNTDKQARQ-JXFKEZNVSA-N	0	3	335.451	3.492	20	30		EGEDHN
C#CCOc1cc(F)ccc1NC(=O)NCCN1CCCC[C@H]1CC	ZINC000743199846	576803213	/nfs/dbraw/zinc/80/32/13/576803213.db2.gz	PEFSUFNYHMDACO-MRXNPFEDSA-N	0	3	347.434	3.224	20	30		EGEDHN
C#CCCN1CCC(NC(=O)C(F)(F)c2cccc(Cl)c2)CC1	ZINC000743492626	576810342	/nfs/dbraw/zinc/81/03/42/576810342.db2.gz	XXEGPKOWFOFUHT-UHFFFAOYSA-N	0	3	340.801	3.036	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2cc(Cl)nc3ccccc32)CC1	ZINC000743492968	576810377	/nfs/dbraw/zinc/81/03/77/576810377.db2.gz	COHHDTHZKKQEJG-UHFFFAOYSA-N	0	3	341.842	3.106	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)[C@H](C)c1ccc(C)o1	ZINC000744031733	576819295	/nfs/dbraw/zinc/81/92/95/576819295.db2.gz	BTFVRNSCWGQQNF-CHWSQXEVSA-N	0	3	326.352	3.048	20	30		EGEDHN
CC(=CC(=O)C(C#N)C(=O)Nc1ccc2c(c1)OCCO2)C(C)(C)C	ZINC000744032639	576819310	/nfs/dbraw/zinc/81/93/10/576819310.db2.gz	UYGZZYFUPJFEGW-BRADTZPFSA-N	0	3	342.395	3.098	20	30		EGEDHN
CC[C@H]1CN(CC(=O)C(C#N)c2nc3ccccc3s2)CCS1	ZINC000744424802	576827818	/nfs/dbraw/zinc/82/78/18/576827818.db2.gz	VTDRNGNUXWIDOD-STQMWFEESA-N	0	3	345.493	3.300	20	30		EGEDHN
C#CCN(C(=O)N[C@@H]1CCN(Cc2ccccc2)C1)C1CCCCC1	ZINC000744817248	576835071	/nfs/dbraw/zinc/83/50/71/576835071.db2.gz	HJBJTIJAQNAWPP-LJQANCHMSA-N	0	3	339.483	3.238	20	30		EGEDHN
C#CCN1CCC(C(=O)NCc2ccc(Oc3ccccc3)cc2)CC1	ZINC000751153955	1299517358	/nfs/dbraw/zinc/51/73/58/1299517358.db2.gz	SIYHTSZOZQERQV-UHFFFAOYSA-N	0	3	348.446	3.440	20	30		EGEDHN
C=C(C)CNC(=S)NC[C@@H](c1cccc(OC)c1)N(CC)CC	ZINC000053584693	1291726810	/nfs/dbraw/zinc/72/68/10/1291726810.db2.gz	CAYXFWLKCFDYAX-KRWDZBQOSA-N	0	3	335.517	3.118	20	30		EGEDHN
C=CCN(CC=C)C(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000063142384	1292000481	/nfs/dbraw/zinc/00/04/81/1292000481.db2.gz	SADMGMYFBLPFHW-UHFFFAOYSA-N	0	3	329.513	3.200	20	30		EGEDHN
Cc1nn(C)c(C)c1C[C@@H](C)C(=O)C(C#N)c1nc2ccccc2o1	ZINC000076842609	1292445535	/nfs/dbraw/zinc/44/55/35/1292445535.db2.gz	HZKGFXPTFVZXJK-ABAIWWIYSA-N	0	3	336.395	3.233	20	30		EGEDHN
C[C@@H](CSc1ccccc1)C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000111945980	1293113488	/nfs/dbraw/zinc/11/34/88/1293113488.db2.gz	OMXAMSFTDCIQAW-DZGCQCFKSA-N	0	3	339.420	3.157	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN[C@@H](C)c2ccc(NC(N)=O)cc2)cc1	ZINC000113351169	1293147663	/nfs/dbraw/zinc/14/76/63/1293147663.db2.gz	RCQGOOMKIJZYPZ-KBPBESRZSA-N	0	3	338.411	3.319	20	30		EGEDHN
CC[C@@H](CC(F)(F)F)C(=O)C(C#N)C(=O)Nc1ccc(OC)cc1	ZINC000835066184	1293197889	/nfs/dbraw/zinc/19/78/89/1293197889.db2.gz	WMPQLTVTHJIUDW-GWCFXTLKSA-N	0	3	342.317	3.321	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)CCCC(=O)C1CC1)c1ccccc1	ZINC000835342207	1293268350	/nfs/dbraw/zinc/26/83/50/1293268350.db2.gz	ZPLKKEIURIYAGE-SJORKVTESA-N	0	3	340.423	3.112	20	30		EGEDHN
C#CCNC(=O)[C@@H](C)N1CCC(c2c[nH]c3c2cccc3CC)CC1	ZINC000125001525	1293491936	/nfs/dbraw/zinc/49/19/36/1293491936.db2.gz	UCGUNTDJWJLCDF-OAHLLOKOSA-N	0	3	337.467	3.048	20	30		EGEDHN
N#CC(C(=O)CCc1ccc(Cl)s1)C(=O)Nc1ccccn1	ZINC000125260028	1293501774	/nfs/dbraw/zinc/50/17/74/1293501774.db2.gz	CAVXLCXMONAWIU-NSHDSACASA-N	0	3	333.800	3.077	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@](C)(NCc1ccc(C#N)cc1F)C1CC1	ZINC000156293015	1294137045	/nfs/dbraw/zinc/13/70/45/1294137045.db2.gz	UAILZVVHDTVZGM-IBGZPJMESA-N	0	3	347.434	3.480	20	30		EGEDHN
C#CCOc1ccc(F)cc1NC(=O)c1ccc(CN(C)C)cc1	ZINC000156523164	1294147200	/nfs/dbraw/zinc/14/72/00/1294147200.db2.gz	USOVVBKBMYLAKL-UHFFFAOYSA-N	0	3	326.371	3.152	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)[C@@H](C)c2c(C)noc2C)cc1	ZINC000159769417	1294246354	/nfs/dbraw/zinc/24/63/54/1294246354.db2.gz	GBUMHHIAWKNUQH-ZBEGNZNMSA-N	0	3	339.395	3.305	20	30		EGEDHN
C#Cc1cccc(NC(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)c1	ZINC000160348475	1294265972	/nfs/dbraw/zinc/26/59/72/1294265972.db2.gz	GICTXTZJPKIALU-JXFKEZNVSA-N	0	3	333.435	3.452	20	30		EGEDHN
C#CCOc1ccc(F)cc1NC(=O)c1cccc(CN(C)C)c1	ZINC000173789801	1294470503	/nfs/dbraw/zinc/47/05/03/1294470503.db2.gz	RCKRTOKGIVSVDY-UHFFFAOYSA-N	0	3	326.371	3.152	20	30		EGEDHN
COc1ccc(CNCc2cc(N(C)C)nc3ccccc23)cc1C#N	ZINC000174438684	1294501382	/nfs/dbraw/zinc/50/13/82/1294501382.db2.gz	IXFUUHVNLKXWJJ-UHFFFAOYSA-N	0	3	346.434	3.471	20	30		EGEDHN
COc1ccc([C@H](C)CC(=O)C(C#N)C(=O)NC2CCCCC2)cc1	ZINC000175103633	1294538448	/nfs/dbraw/zinc/53/84/48/1294538448.db2.gz	PRYXCNZNFBKTSN-KDOFPFPSSA-N	0	3	342.439	3.347	20	30		EGEDHN
C=CCc1cc(C[N@@H+]2CCC[C@@H](C3(C)OCCO3)C2)c([O-])c(OC)c1	ZINC000182829034	1295077912	/nfs/dbraw/zinc/07/79/12/1295077912.db2.gz	DLKREOHJORGVAW-QGZVFWFLSA-N	0	3	347.455	3.104	20	30		EGEDHN
C=CCc1cc(C[N@H+]2CCC[C@@H](C3(C)OCCO3)C2)c([O-])c(OC)c1	ZINC000182829034	1295077925	/nfs/dbraw/zinc/07/79/25/1295077925.db2.gz	DLKREOHJORGVAW-QGZVFWFLSA-N	0	3	347.455	3.104	20	30		EGEDHN
C#CCOc1ccccc1NC(=O)N1CCN(C2CCCCC2)CC1	ZINC000188133904	1295439545	/nfs/dbraw/zinc/43/95/45/1295439545.db2.gz	QAXSZVBLOLOODP-UHFFFAOYSA-N	0	3	341.455	3.181	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@H](C)Sc1ccc(OC)cc1	ZINC000193382765	1295860295	/nfs/dbraw/zinc/86/02/95/1295860295.db2.gz	AIERGJONNIXDRP-BBRMVZONSA-N	0	3	348.468	3.191	20	30		EGEDHN
CCO[C@@H]1C[C@H]1C(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000249713658	1296450337	/nfs/dbraw/zinc/45/03/37/1296450337.db2.gz	GSKWTXAFTSZAAH-GBIKHYSHSA-N	0	3	341.194	3.066	20	30		EGEDHN
Cc1ccccc1OCCON=Cc1ccc(N2CCOCC2)cc1	ZINC000255167070	1296505670	/nfs/dbraw/zinc/50/56/70/1296505670.db2.gz	JXNBZTYJQNSSKR-UHFFFAOYSA-N	0	3	340.423	3.261	20	30		EGEDHN
C#CCOc1ccccc1CNC[C@@H](NC(=O)OC(C)(C)C)C(C)C	ZINC000301354803	1296787750	/nfs/dbraw/zinc/78/77/50/1296787750.db2.gz	LOUFXKZQPICVIN-QGZVFWFLSA-N	0	3	346.471	3.338	20	30		EGEDHN
C[C@H](NC[C@H](O)COc1ccccc1C#N)c1ccc(Cl)s1	ZINC000315440773	1297136774	/nfs/dbraw/zinc/13/67/74/1297136774.db2.gz	ZBZNEWKTOWLFQX-AAEUAGOBSA-N	0	3	336.844	3.364	20	30		EGEDHN
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)c1ccc(C#N)o1	ZINC000719963804	1298325334	/nfs/dbraw/zinc/32/53/34/1298325334.db2.gz	TZZOPNLNKAEVSO-QGZVFWFLSA-N	0	3	337.423	3.278	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H]1CNC1CC(C#N)(c2ccccc2)C1	ZINC000724970328	1298352707	/nfs/dbraw/zinc/35/27/07/1298352707.db2.gz	GXHWOBPBNYEAJO-OHTSDLOESA-N	0	3	341.455	3.209	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)C#Cc1ccccc1)c1ccsc1	ZINC000747208370	1298742622	/nfs/dbraw/zinc/74/26/22/1298742622.db2.gz	YDQTZVYTQKIVJV-SFHVURJKSA-N	0	3	326.465	3.299	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cc(Cl)cc(Cl)c2F)CC1	ZINC000876461373	1298776223	/nfs/dbraw/zinc/77/62/23/1298776223.db2.gz	SGKUOJKBXNSWPL-UHFFFAOYSA-N	0	3	329.202	3.416	20	30		EGEDHN
Cc1cccc(C(=O)NC2CCN(Cc3ccc(CC#N)cc3)CC2)c1	ZINC000879350365	1300495763	/nfs/dbraw/zinc/49/57/63/1300495763.db2.gz	DNAQEJYKKZHDBD-UHFFFAOYSA-N	0	3	347.462	3.456	20	30		EGEDHN
C#CC[C@@H](NC(=O)NC[C@@H](c1ccccc1)N(C)C)c1ccccc1	ZINC000757064706	1300627832	/nfs/dbraw/zinc/62/78/32/1300627832.db2.gz	MXNSJPPSQKJMBN-UXHICEINSA-N	0	3	335.451	3.353	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)c2cc(F)cc(Cl)c2)c1	ZINC000757304148	1300662964	/nfs/dbraw/zinc/66/29/64/1300662964.db2.gz	IYRSFQPFPMKYBG-OAHLLOKOSA-N	0	3	346.745	3.449	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN2C[C@@H]3CC[C@H]2c2ccccc23)cc1	ZINC000880540421	1301153233	/nfs/dbraw/zinc/15/32/33/1301153233.db2.gz	ZRVWVQLIRRRSLL-FVJLSDCUSA-N	0	3	334.419	3.232	20	30		EGEDHN
CN(C)CCN(C(=O)Nc1cc(C#N)c(F)cc1F)C1CCCC1	ZINC000880714420	1301238271	/nfs/dbraw/zinc/23/82/71/1301238271.db2.gz	PZGFRRSYNGHLKM-UHFFFAOYSA-N	0	3	336.386	3.175	20	30		EGEDHN
N#C[C@@H]1CNCC12CC(C(=O)Nc1ccc(SC(F)F)cc1)C2	ZINC000884042783	1302707284	/nfs/dbraw/zinc/70/72/84/1302707284.db2.gz	HZLAVBNCNWYFNS-NOEPWBJOSA-N	0	3	337.395	3.079	20	30		EGEDHN
C#CCCCCCC(=O)Nc1cccc(N2CCN(CC)CC2)c1	ZINC000770149046	1303229046	/nfs/dbraw/zinc/22/90/46/1303229046.db2.gz	VQDAUQYIFTUUJS-UHFFFAOYSA-N	0	3	327.472	3.351	20	30		EGEDHN
C=CCNC(=O)C(C#N)C(=O)CCCc1cccc(C(F)(F)F)c1	ZINC000770848123	1303321212	/nfs/dbraw/zinc/32/12/12/1303321212.db2.gz	RZMUCFAWURSNLU-AWEZNQCLSA-N	0	3	338.329	3.039	20	30		EGEDHN
[O-]c1ccc(Br)cc1/C=N/CC1CC[NH+](C2CC2)CC1	ZINC000772152599	1303496377	/nfs/dbraw/zinc/49/63/77/1303496377.db2.gz	CEGIFTXXDCQZEF-WOJGMQOQSA-N	0	3	337.261	3.448	20	30		EGEDHN
C#CC[C@H](NC[C@@H](O)COc1ccc(OCC)cc1)c1ccccc1	ZINC000775397737	1303956538	/nfs/dbraw/zinc/95/65/38/1303956538.db2.gz	ATRZHHRZUJMIRU-NQIIRXRSSA-N	0	3	339.435	3.179	20	30		EGEDHN
C#C[C@H](N[C@H](C)CC(=O)Nc1ccccc1C(C)C)[C@H]1CCCO1	ZINC000775572547	1303987676	/nfs/dbraw/zinc/98/76/76/1303987676.db2.gz	SEAHIYHYXGUTNN-HHXXYDBFSA-N	0	3	328.456	3.298	20	30		EGEDHN
CN(C)CCN(C(=O)Nc1nc(Cl)c(C#N)s1)C1CCCC1	ZINC000888413834	1304152992	/nfs/dbraw/zinc/15/29/92/1304152992.db2.gz	HYYWABFFGCABIA-UHFFFAOYSA-N	0	3	341.868	3.006	20	30		EGEDHN
N#Cc1cccn(CN2C[C@H](c3ccccc3)[C@@H]3CCCC[C@@H]32)c1=O	ZINC000776771239	1304197795	/nfs/dbraw/zinc/19/77/95/1304197795.db2.gz	GWRAXYKLUCKQNG-ZCNNSNEGSA-N	0	3	333.435	3.336	20	30		EGEDHN
CCOC(=O)N1CCC[C@H]([C@H](C)NCc2ccc(F)cc2C#N)C1	ZINC000776819821	1304205245	/nfs/dbraw/zinc/20/52/45/1304205245.db2.gz	CYFUYVRRALIVGB-ZFWWWQNUSA-N	0	3	333.407	3.044	20	30		EGEDHN
Cc1ccc(NC2CCN(Cc3ccc(C#N)cc3)CC2)c(N(C)C)n1	ZINC000777273624	1304278482	/nfs/dbraw/zinc/27/84/82/1304278482.db2.gz	DCRJZWQMAQOLJC-UHFFFAOYSA-N	0	3	349.482	3.404	20	30		EGEDHN
N#CCc1ccccc1CC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000777301468	1304280613	/nfs/dbraw/zinc/28/06/13/1304280613.db2.gz	DTTJEAJVHYRYSA-OAQYLSRUSA-N	0	3	347.462	3.076	20	30		EGEDHN
C=C1CCC(C(=O)N(CCN(C)C)Cc2cccc(C#N)c2)CC1	ZINC000888954974	1304343313	/nfs/dbraw/zinc/34/33/13/1304343313.db2.gz	XWHKSXJZLMNAKK-UHFFFAOYSA-N	0	3	325.456	3.195	20	30		EGEDHN
CC[C@@H](C#N)OC(=O)C1CCN(c2cc(Cl)ccc2Cl)C1=O	ZINC000781167727	1304782068	/nfs/dbraw/zinc/78/20/68/1304782068.db2.gz	RJSYDXQIEJNXFT-QWRGUYRKSA-N	0	3	341.194	3.192	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C	ZINC000891248318	1304999669	/nfs/dbraw/zinc/99/96/69/1304999669.db2.gz	KODTWBVLLOAQOP-IBGZPJMESA-N	0	3	329.488	3.055	20	30		EGEDHN
N#Cc1ccc(F)c(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)c1	ZINC000891454932	1305054534	/nfs/dbraw/zinc/05/45/34/1305054534.db2.gz	SVYZAYIQDWONHS-QWRGUYRKSA-N	0	3	330.281	3.383	20	30		EGEDHN
C=CCS(=O)(=O)CCN[C@@H]1CCCCc2ccc(Cl)cc21	ZINC000783532622	1305103832	/nfs/dbraw/zinc/10/38/32/1305103832.db2.gz	SMFGDRRSPFZJNF-MRXNPFEDSA-N	0	3	327.877	3.298	20	30		EGEDHN
C[C@@H]1C[C@H](C(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2Cl)CO1	ZINC000784491519	1305251182	/nfs/dbraw/zinc/25/11/82/1305251182.db2.gz	UFWCEQPIRBESRB-WCABBAIRSA-N	0	3	341.194	3.066	20	30		EGEDHN
Cc1cccc(CNC(=O)C(C#N)C(=O)CCCc2ccsc2)c1	ZINC000786539957	1305592852	/nfs/dbraw/zinc/59/28/52/1305592852.db2.gz	FZEKJTGTCBKTCF-KRWDZBQOSA-N	0	3	340.448	3.405	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=S)Nc1ccsc1	ZINC000790307834	1306296440	/nfs/dbraw/zinc/29/64/40/1306296440.db2.gz	FZBXPIHKECUIFV-UHFFFAOYSA-N	0	3	344.509	3.380	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N(C)[C@@H]1CCCN(C)C1)c1ccc(F)c(F)c1	ZINC000894265933	1306309820	/nfs/dbraw/zinc/30/98/20/1306309820.db2.gz	XOFSFDYSZLJKHM-PBHICJAKSA-N	0	3	337.414	3.318	20	30		EGEDHN
C[C@@H]1C(=O)CC[C@@H]1CC(=O)C(C#N)C(=O)Nc1cccc2ccccc21	ZINC000796633607	1310050983	/nfs/dbraw/zinc/05/09/83/1310050983.db2.gz	GAGUGQDAHAPBGC-YSVLISHTSA-N	0	3	348.402	3.492	20	30		EGEDHN
C#CCOc1ccc([C@H](C)NCc2ccc(C[S@](C)=O)cc2)cc1	ZINC000797133204	1310145024	/nfs/dbraw/zinc/14/50/24/1310145024.db2.gz	PWANMCKVTIEWLF-FYSMJZIKSA-N	0	3	341.476	3.428	20	30		EGEDHN
CCN1CCN(c2cccc(NC(=O)c3ccc(C)c(C#N)c3)c2)CC1	ZINC000799367808	1310537431	/nfs/dbraw/zinc/53/74/31/1310537431.db2.gz	OGVBDEKFYJQLLO-UHFFFAOYSA-N	0	3	348.450	3.261	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@H](F)c2ccc(C(F)(F)F)cc2)CC1	ZINC000801882434	1316961771	/nfs/dbraw/zinc/96/17/71/1316961771.db2.gz	KNWJNIFOHGAEOI-OAHLLOKOSA-N	0	3	344.352	3.483	20	30		EGEDHN
C[C@@H](C#N)OCCN(Cc1ccccc1)C[C@@H](O)c1cccs1	ZINC000801926893	1316966572	/nfs/dbraw/zinc/96/65/72/1316966572.db2.gz	YGGDFUJIZVDTKU-DOTOQJQBSA-N	0	3	330.453	3.212	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](NCc2ccccc2N(C)C)C1	ZINC001019232365	1317115668	/nfs/dbraw/zinc/11/56/68/1317115668.db2.gz	XHXLNWBKGMWSIW-KRWDZBQOSA-N	0	3	329.488	3.045	20	30		EGEDHN
CCOCc1nc(Cl)cc(N=NC2CCCN3CCCC[C@@H]23)n1	ZINC000901314431	1317403661	/nfs/dbraw/zinc/40/36/61/1317403661.db2.gz	SWRZMJUZGWHXLH-ZDUSSCGKSA-N	0	3	337.855	3.083	20	30		EGEDHN
CC(C)C(=O)N1CCC2(CCN(CC#Cc3ccccc3)CC2)CC1	ZINC000957501534	1317408821	/nfs/dbraw/zinc/40/88/21/1317408821.db2.gz	IZGLKHZBZRXZQU-UHFFFAOYSA-N	0	3	338.495	3.399	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC2(CCN(Cc3ocnc3C)CC2)CC1	ZINC000957586146	1317479440	/nfs/dbraw/zinc/47/94/40/1317479440.db2.gz	AMAGAURBLOSQBK-UHFFFAOYSA-N	0	3	345.487	3.400	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@H](NC(=O)C3CCCCCC3)C2)c1	ZINC001020022210	1317504851	/nfs/dbraw/zinc/50/48/51/1317504851.db2.gz	WWGXWDGHTRLIIS-IYARVYRRSA-N	0	3	343.446	3.405	20	30		EGEDHN
C[C@H]1CCC[C@H]1CC(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001020185759	1317580184	/nfs/dbraw/zinc/58/01/84/1317580184.db2.gz	BLEWJTKJDVNSMS-IKICRFKJSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1C[C@H](NCc2ccccc2Cl)C1	ZINC001020239872	1317605397	/nfs/dbraw/zinc/60/53/97/1317605397.db2.gz	KXQPRJSXEINQPY-WKILWMFISA-N	0	3	343.858	3.378	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@H](NC(=O)[C@@H]3CCCC34CC4)C2)c(F)c1	ZINC001020290168	1317629144	/nfs/dbraw/zinc/62/91/44/1317629144.db2.gz	KBIOROGPJAUUOF-ULQDDVLXSA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H]2CC=CC[C@H]2C(F)(F)F)C1	ZINC001020296490	1317632546	/nfs/dbraw/zinc/63/25/46/1317632546.db2.gz	SFARGXGTZZFWQQ-FDYHWXHSSA-N	0	3	336.785	3.120	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H]2COc3ccccc3[C@H]2O)cc1Cl	ZINC000808454249	1317680411	/nfs/dbraw/zinc/68/04/11/1317680411.db2.gz	NOKRIGIQANWNBL-VQIMIIECSA-N	0	3	345.826	3.489	20	30		EGEDHN
CC(C)(C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1)C1CCC1	ZINC001020438955	1317697256	/nfs/dbraw/zinc/69/72/56/1317697256.db2.gz	ILYCQLQCLQNCSK-QAQDUYKDSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@]2(C)CCCc3ccccc32)C1	ZINC001020755232	1317907174	/nfs/dbraw/zinc/90/71/74/1317907174.db2.gz	DAGGAMVEWXUUGC-BXWFABGCSA-N	0	3	332.875	3.270	20	30		EGEDHN
CC1/C(=C\c2ccc(N(C)C)cc2C(F)(F)F)C(=O)c2ncnn21	ZINC000905087387	1317922321	/nfs/dbraw/zinc/92/23/21/1317922321.db2.gz	XUDDYZRPNKKQLS-DAVUEJTQSA-N	0	3	336.317	3.204	20	30		EGEDHN
CC(C)[C@@]1(C)C[C@H]1C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001020860514	1317969147	/nfs/dbraw/zinc/96/91/47/1317969147.db2.gz	QXLFELFJVALJMN-OGNFBWPZSA-N	0	3	343.446	3.116	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)C[C@@H]2CCCc3ccccc32)C1	ZINC001020956206	1318013726	/nfs/dbraw/zinc/01/37/26/1318013726.db2.gz	DNCCMXVJKOGDFS-ULQDDVLXSA-N	0	3	332.875	3.486	20	30		EGEDHN
Cc1cc(=O)cc(C)n1CCCC(=O)C(C#N)c1nc2ccccc2o1	ZINC000810536834	1318019244	/nfs/dbraw/zinc/01/92/44/1318019244.db2.gz	UUSRTIAKPWRQJZ-INIZCTEOSA-N	0	3	349.390	3.263	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H]2C[C@@H]2c2cc(F)ccc2F)C1	ZINC001021069882	1318067477	/nfs/dbraw/zinc/06/74/77/1318067477.db2.gz	NRGNPJKVOCTPSC-RGCMKSIDSA-N	0	3	340.801	3.058	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)[C@@H]2CCCCC2(C)C)C1	ZINC001021109497	1318091476	/nfs/dbraw/zinc/09/14/76/1318091476.db2.gz	AFERQHVVSUBHJP-IHRRRGAJSA-N	0	3	343.309	3.348	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1	ZINC000811505414	1318187249	/nfs/dbraw/zinc/18/72/49/1318187249.db2.gz	KXXCMTOYKGDSAL-LJQANCHMSA-N	0	3	340.854	3.283	20	30		EGEDHN
N#Cc1ccc(C[NH2+]C[C@@H]2CCCCN2C(=O)c2ccccc2[O-])cc1	ZINC000959890110	1318253694	/nfs/dbraw/zinc/25/36/94/1318253694.db2.gz	USIFLHMDKYFWLZ-SFHVURJKSA-N	0	3	349.434	3.048	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)C=C2CCC2)s1	ZINC000959950348	1318284367	/nfs/dbraw/zinc/28/43/67/1318284367.db2.gz	LCDJWCDMRAFCOW-HNNXBMFYSA-N	0	3	329.469	3.201	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)cc1F	ZINC000960154579	1318387593	/nfs/dbraw/zinc/38/75/93/1318387593.db2.gz	UJDKQDPRZGLZST-QAPCUYQASA-N	0	3	345.462	3.460	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@H]2CN(Cc3ccccc3F)CC[C@H]21	ZINC001021581702	1318426064	/nfs/dbraw/zinc/42/60/64/1318426064.db2.gz	RBDGUOYTENKSBK-AZUAARDMSA-N	0	3	340.442	3.052	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2nc(C(C)C)oc2C)C1	ZINC001021587331	1318431007	/nfs/dbraw/zinc/43/10/07/1318431007.db2.gz	JNIDGKRVPRMKMC-SJORKVTESA-N	0	3	343.471	3.056	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)C[C@H]1CCC(F)(F)C1	ZINC000960270132	1318435706	/nfs/dbraw/zinc/43/57/06/1318435706.db2.gz	FKNIOQLIRYTJFS-MZMPZRCHSA-N	0	3	334.410	3.370	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cscc2C(F)F)C1	ZINC001021592698	1318438383	/nfs/dbraw/zinc/43/83/83/1318438383.db2.gz	SPCRQDLBYGGJRM-DOMZBBRYSA-N	0	3	338.423	3.245	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc3ccccc3nc2C)C1	ZINC001021599574	1318443423	/nfs/dbraw/zinc/44/34/23/1318443423.db2.gz	HVHSUOMSQRGLRD-NQIIRXRSSA-N	0	3	347.462	3.103	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1c(C)cc(C)nc1C	ZINC000960288107	1318445665	/nfs/dbraw/zinc/44/56/65/1318445665.db2.gz	LOCFVUPPHZQOHJ-UYAOXDASSA-N	0	3	335.451	3.178	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@H]1Cc2ccc(F)cc21	ZINC000960298912	1318450962	/nfs/dbraw/zinc/45/09/62/1318450962.db2.gz	GBMPVVHXEGKTKS-XUVXKRRUSA-N	0	3	336.410	3.023	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc(F)c(OC)c1	ZINC000960306361	1318453549	/nfs/dbraw/zinc/45/35/49/1318453549.db2.gz	HHNNFXDOXZNMPZ-IEBWSBKVSA-N	0	3	340.398	3.006	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc2c(s1)CCC2	ZINC000960329400	1318463666	/nfs/dbraw/zinc/46/36/66/1318463666.db2.gz	GOZCAVGYNUSXNR-VQIMIIECSA-N	0	3	338.476	3.408	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@@H]1COc2ccccc21	ZINC000960332359	1318466526	/nfs/dbraw/zinc/46/65/26/1318466526.db2.gz	HPJADYFWCWSNQK-SFHLNBCPSA-N	0	3	348.446	3.111	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1c(C)onc1CC	ZINC000960333945	1318467741	/nfs/dbraw/zinc/46/77/41/1318467741.db2.gz	FJLGNTNRHDRTTB-IEBWSBKVSA-N	0	3	339.439	3.107	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1c2ccc(C)cc2[C@H]2CN(C)CC[C@@H]21	ZINC000812845768	1318470180	/nfs/dbraw/zinc/47/01/80/1318470180.db2.gz	MQUGMCIRSNBQRY-IRLDBZIGSA-N	0	3	344.458	3.353	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)/C=C\c1ccco1	ZINC000960377604	1318500366	/nfs/dbraw/zinc/50/03/66/1318500366.db2.gz	LACMFOQGJALTLK-OEIFXAAASA-N	0	3	349.434	3.287	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2nccc3ccccc32)C1	ZINC001021661842	1318525607	/nfs/dbraw/zinc/52/56/07/1318525607.db2.gz	RYYHUISLLKQUIO-UYAOXDASSA-N	0	3	347.462	3.185	20	30		EGEDHN
Cc1ccc(C(=O)N2CCC[C@H]2CN(C)Cc2cccc(C#N)c2)o1	ZINC000960399937	1318528551	/nfs/dbraw/zinc/52/85/51/1318528551.db2.gz	LFIGXMLDXCXGRY-SFHVURJKSA-N	0	3	337.423	3.196	20	30		EGEDHN
Cc1ccoc1C(=O)N1CCC[C@H]1CN(C)Cc1ccc(C#N)cc1	ZINC000960419488	1318543462	/nfs/dbraw/zinc/54/34/62/1318543462.db2.gz	WWIKBUMNNQSSKB-SFHVURJKSA-N	0	3	337.423	3.196	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)[C@@H]1CC=CCC1	ZINC000960421295	1318545424	/nfs/dbraw/zinc/54/54/24/1318545424.db2.gz	VHYGJLYXTYXRTM-WOJBJXKFSA-N	0	3	337.467	3.337	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccsc2Cl)C1	ZINC001021681890	1318552966	/nfs/dbraw/zinc/55/29/66/1318552966.db2.gz	JTRHUMGXUSASIM-HIFRSBDPSA-N	0	3	336.888	3.351	20	30		EGEDHN
C[C@](C#N)(NC(=O)C1C[C@H](c2ccccc2)OC1=O)C1CCCCC1	ZINC000813453386	1318567622	/nfs/dbraw/zinc/56/76/22/1318567622.db2.gz	IVYDLTGICYJDKF-MBOZVWFJSA-N	0	3	340.423	3.270	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2oc(CC)cc2C)C1	ZINC001021717015	1318597207	/nfs/dbraw/zinc/59/72/07/1318597207.db2.gz	NPHIGLHIZQZTKE-SJLPKXTDSA-N	0	3	328.456	3.100	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cccc3ccccc32)C1	ZINC001021726909	1318621603	/nfs/dbraw/zinc/62/16/03/1318621603.db2.gz	HPBJXABFCXIONW-NQIIRXRSSA-N	0	3	332.447	3.400	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(C)c(F)c(C)c2)C1	ZINC001021737970	1318646527	/nfs/dbraw/zinc/64/65/27/1318646527.db2.gz	XTDAEYBLAXETTF-MJGOQNOKSA-N	0	3	342.458	3.392	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)CCc2cc(C)sc2C)C1	ZINC001021742574	1318655450	/nfs/dbraw/zinc/65/54/50/1318655450.db2.gz	GDFSSNHXSBLDFU-MOPGFXCFSA-N	0	3	344.524	3.244	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N1CCC[C@H]1CN(C)Cc1ccccc1	ZINC000960645022	1318762373	/nfs/dbraw/zinc/76/23/73/1318762373.db2.gz	DWUDOSBJLYGJRT-ZCNNSNEGSA-N	0	3	342.483	3.091	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@@H](NC(=O)C[C@@H]3C=CCCC3)C2)c1	ZINC001022270530	1318866388	/nfs/dbraw/zinc/86/63/88/1318866388.db2.gz	QSDIGSWXGLNMRW-OLMNPRSZSA-N	0	3	341.430	3.181	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)Nc1cc(C(=O)NC)ccc1OC	ZINC000912314706	1318866480	/nfs/dbraw/zinc/86/64/80/1318866480.db2.gz	UNGWCQVNUDTLSO-OAHLLOKOSA-N	0	3	349.475	3.071	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccc(OC)c(OCC(F)(F)F)c1	ZINC000912350346	1318876330	/nfs/dbraw/zinc/87/63/30/1318876330.db2.gz	JLHKKDCETIZJCB-GFCCVEGCSA-N	0	3	346.349	3.258	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N1CCC(C(=O)c2ccc(Cl)cc2)CC1	ZINC000912437493	1318886880	/nfs/dbraw/zinc/88/68/80/1318886880.db2.gz	YHQNWNGSSUWIBB-KRWDZBQOSA-N	0	3	348.874	3.445	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)C(C)(C)C1CC1	ZINC000960810332	1318927492	/nfs/dbraw/zinc/92/74/92/1318927492.db2.gz	RTFXFRJBHVIKCQ-IBGZPJMESA-N	0	3	339.483	3.417	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)CC(C)(F)F	ZINC000960862081	1319005267	/nfs/dbraw/zinc/00/52/67/1319005267.db2.gz	OGRRSWKUZWAMMG-INIZCTEOSA-N	0	3	335.398	3.026	20	30		EGEDHN
C[C@H]1CCC[C@H](C(=O)N[C@H]2C[C@@H](NCc3ccc(C#N)cc3F)C2)C1	ZINC001022623791	1319024361	/nfs/dbraw/zinc/02/43/61/1319024361.db2.gz	XTUJOHJKBMSYQP-QXRTWZOPSA-N	0	3	343.446	3.260	20	30		EGEDHN
CC1(C(=O)N[C@H]2C[C@@H](NCc3ccc(C#N)cc3F)C2)CCCCC1	ZINC001022646828	1319039548	/nfs/dbraw/zinc/03/95/48/1319039548.db2.gz	WORHJJQNBGXVAY-CALCHBBNSA-N	0	3	343.446	3.405	20	30		EGEDHN
CCN1CCN(c2ccc(NC(=O)Nc3ccc(C#N)cc3)cc2)CC1	ZINC000913459038	1319040243	/nfs/dbraw/zinc/04/02/43/1319040243.db2.gz	AKDXJVMQRQHSTJ-UHFFFAOYSA-N	0	3	349.438	3.344	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc(O[C@H](C)CC)cc2)C1	ZINC001022940029	1319182143	/nfs/dbraw/zinc/18/21/43/1319182143.db2.gz	KKNNWRCDBLVRCR-BMFZPTHFSA-N	0	3	336.863	3.467	20	30		EGEDHN
CCC(=O)N1CCC[C@H]([C@H]2CCN(Cc3ccc(C#N)cc3F)C2)C1	ZINC000961068364	1319182842	/nfs/dbraw/zinc/18/28/42/1319182842.db2.gz	PJHWQVRQYTUCOQ-IRXDYDNUSA-N	0	3	343.446	3.168	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cnc(-c3ccco3)s2)C1	ZINC001023000612	1319210709	/nfs/dbraw/zinc/21/07/09/1319210709.db2.gz	VCAZQZVBWAGGAI-PHIMTYICSA-N	0	3	337.832	3.006	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@@H]([C@H]2CCN(Cc3ccccc3C#N)C2)C1	ZINC000961132641	1319248205	/nfs/dbraw/zinc/24/82/05/1319248205.db2.gz	FEUJHMQVDRWYGQ-UXHICEINSA-N	0	3	339.483	3.275	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2sc(C(C)C)nc2C)C1	ZINC001023086288	1319256566	/nfs/dbraw/zinc/25/65/66/1319256566.db2.gz	HDAHCHQUKHPTCH-TXEJJXNPSA-N	0	3	327.881	3.178	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC[C@@H]([C@H]2CCN(CCF)C2)C1	ZINC000961165620	1319285960	/nfs/dbraw/zinc/28/59/60/1319285960.db2.gz	ICQBMNCQZWBTBN-CABCVRRESA-N	0	3	330.875	3.295	20	30		EGEDHN
CC(=O)Nc1ccc(CC(=O)C(C#N)c2nc3ccccc3o2)cc1	ZINC000915105016	1319423250	/nfs/dbraw/zinc/42/32/50/1319423250.db2.gz	ROHJVEPGOWVSRD-OAHLLOKOSA-N	0	3	333.347	3.205	20	30		EGEDHN
C=CCc1cc(CN[C@@H](C)c2cnccc2N)cc(OC)c1OC	ZINC000817908914	1319458535	/nfs/dbraw/zinc/45/85/35/1319458535.db2.gz	JGFINJDCGBPSAW-ZDUSSCGKSA-N	0	3	327.428	3.091	20	30		EGEDHN
C=CC[N@H+]1CCC[C@H](C2CCN(C(=O)c3ccccc3[O-])CC2)C1	ZINC000961331593	1319485902	/nfs/dbraw/zinc/48/59/02/1319485902.db2.gz	OOYJQKDSXPEZHP-KRWDZBQOSA-N	0	3	328.456	3.142	20	30		EGEDHN
C=CC[N@@H+]1CCC[C@H](C2CCN(C(=O)c3ccccc3[O-])CC2)C1	ZINC000961331593	1319485907	/nfs/dbraw/zinc/48/59/07/1319485907.db2.gz	OOYJQKDSXPEZHP-KRWDZBQOSA-N	0	3	328.456	3.142	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2c(C)c(F)ccc2Cl)C1	ZINC001023448646	1319549825	/nfs/dbraw/zinc/54/98/25/1319549825.db2.gz	UFTAAQAQTGKKOJ-CQSZACIVSA-N	0	3	336.838	3.253	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](C2CCN(C(=O)C3(CF)CC3)CC2)C1	ZINC000961407610	1319565230	/nfs/dbraw/zinc/56/52/30/1319565230.db2.gz	YBFVPAKWLMCZJU-INIZCTEOSA-N	0	3	342.886	3.439	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1ccccc1NC1CCCCC1	ZINC000818612417	1319570467	/nfs/dbraw/zinc/57/04/67/1319570467.db2.gz	YSFACGLVKUICGF-UHFFFAOYSA-N	0	3	327.472	3.116	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cnc3ccccc3c2C)C1	ZINC001023494390	1319601250	/nfs/dbraw/zinc/60/12/50/1319601250.db2.gz	HULYDSMLTYRQFY-KRWDZBQOSA-N	0	3	335.451	3.008	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCCN(Cc3cnccc3C)C2)cc1	ZINC001023527450	1319633968	/nfs/dbraw/zinc/63/39/68/1319633968.db2.gz	VBUHHBYKSQDZEB-IBGZPJMESA-N	0	3	347.462	3.013	20	30		EGEDHN
Cc1ccc(CNC[C@@H](O)c2ccc(C#N)cc2)c(OCC2CC2)c1	ZINC000819145187	1319648235	/nfs/dbraw/zinc/64/82/35/1319648235.db2.gz	JXDUMKBHLJTZMP-HXUWFJFHSA-N	0	3	336.435	3.479	20	30		EGEDHN
C=C1CCC(C(=O)NC2[C@H]3CN(C/C=C/c4ccccc4)C[C@@H]23)CC1	ZINC000961680060	1319694325	/nfs/dbraw/zinc/69/43/25/1319694325.db2.gz	WDJMBCPEAPWPTM-HNYZGRMPSA-N	0	3	336.479	3.493	20	30		EGEDHN
CC(C(=O)NC1CC(CNCc2ccccc2C#N)C1)=C1CCCC1	ZINC000961693313	1319704030	/nfs/dbraw/zinc/70/40/30/1319704030.db2.gz	OJPKRQLOUPWRDZ-UHFFFAOYSA-N	0	3	337.467	3.433	20	30		EGEDHN
Cc1ccccc1OCC(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1	ZINC000916881329	1319720509	/nfs/dbraw/zinc/72/05/09/1319720509.db2.gz	OCVZSFPLDBBXMT-HNNXBMFYSA-N	0	3	342.782	3.375	20	30		EGEDHN
Cc1ccccc1OCC(=O)C(C#N)C(=O)Nc1ccccc1Cl	ZINC000916906259	1319723391	/nfs/dbraw/zinc/72/33/91/1319723391.db2.gz	PEVVLVZAPJOIAM-CYBMUJFWSA-N	0	3	342.782	3.375	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cccc(C(C)(C)C)c2)C1	ZINC001023661578	1319779194	/nfs/dbraw/zinc/77/91/94/1319779194.db2.gz	AKAJZVWTORYWEU-QGZVFWFLSA-N	0	3	326.484	3.449	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2coc3ccc(F)cc23)C1	ZINC001023723222	1319862961	/nfs/dbraw/zinc/86/29/61/1319862961.db2.gz	ARGYDYZHBNZGRB-CQSZACIVSA-N	0	3	328.387	3.037	20	30		EGEDHN
C#CCN1CCC[C@@H](CNC(=O)c2cc(CC)c(CCC)s2)C1	ZINC001023742098	1319886103	/nfs/dbraw/zinc/88/61/03/1319886103.db2.gz	CKYMGIHBQPXSEN-HNNXBMFYSA-N	0	3	332.513	3.338	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)C(=O)NC1CCCCC1)c1ccc(F)cc1	ZINC000918486345	1319955605	/nfs/dbraw/zinc/95/56/05/1319955605.db2.gz	ABFYGFACVRGBEC-GUYCJALGSA-N	0	3	330.403	3.477	20	30		EGEDHN
C/C(=C\C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1)c1ccco1	ZINC000822475875	1320086280	/nfs/dbraw/zinc/08/62/80/1320086280.db2.gz	PPBQNWWKJRKYLL-DTQAZKPQSA-N	0	3	337.423	3.145	20	30		EGEDHN
CN1CCC(N(Cc2ccco2)C(=O)c2cc(C#N)ccc2F)CC1	ZINC000827489572	1320457220	/nfs/dbraw/zinc/45/72/20/1320457220.db2.gz	SJYTUWDCOBHFPU-UHFFFAOYSA-N	0	3	341.386	3.027	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(OCC#N)cc2)CCN1Cc1ccccc1	ZINC000839647229	1320950225	/nfs/dbraw/zinc/95/02/25/1320950225.db2.gz	WGIBIRMLMFDNFD-GOSISDBHSA-N	0	3	335.451	3.295	20	30		EGEDHN
CCCCCCC[C@@H](C)CNC(=O)C(=O)Nc1ccc2c(c1)CNC2	ZINC000841019103	1321201382	/nfs/dbraw/zinc/20/13/82/1321201382.db2.gz	CSUMPJLVHTXTMV-OAHLLOKOSA-N	0	3	345.487	3.341	20	30		EGEDHN
N#CCOc1cccc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)c1	ZINC000844339038	1321591702	/nfs/dbraw/zinc/59/17/02/1321591702.db2.gz	WILGKTKQFIGZGV-UONOGXRCSA-N	0	3	342.317	3.275	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCCC[C@@H]2CC2(Cl)Cl)CC1	ZINC000844955009	1321661450	/nfs/dbraw/zinc/66/14/50/1321661450.db2.gz	GURMUISNJNICGF-CYBMUJFWSA-N	0	3	348.318	3.300	20	30		EGEDHN
C=CCc1ccc(OCC(=O)OC[C@H]2CCN2C(C)(C)C)c(OC)c1	ZINC000845739421	1321740159	/nfs/dbraw/zinc/74/01/59/1321740159.db2.gz	FYRSWLTYEWYLEU-MRXNPFEDSA-N	0	3	347.455	3.219	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-]	ZINC000845876000	1321748516	/nfs/dbraw/zinc/74/85/16/1321748516.db2.gz	PEHZAZAJGWWCKX-JMSVASOKSA-N	0	3	325.336	3.056	20	30		EGEDHN
C#CC[C@H](NC(=O)N1CCN(C(C)(C)CC)CC1)c1ccccc1	ZINC000847343028	1321864803	/nfs/dbraw/zinc/86/48/03/1321864803.db2.gz	QBYKXPGVRZVEQU-SFHVURJKSA-N	0	3	327.472	3.267	20	30		EGEDHN
CSC[C@H](C)C(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847749596	1321900585	/nfs/dbraw/zinc/90/05/85/1321900585.db2.gz	WBPQBRDKEQHEPG-INIZCTEOSA-N	0	3	346.496	3.335	20	30		EGEDHN
C=C1CCN(C(=O)Nc2cccc(N3CCN(CC)CC3)c2)CC1	ZINC000930893863	1328998674	/nfs/dbraw/zinc/99/86/74/1328998674.db2.gz	PQKAUORGZXMXOZ-UHFFFAOYSA-N	0	3	328.460	3.012	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]\Cc2c(C3CC3)cnn2C)c([O-])c1	ZINC000849172734	1322093759	/nfs/dbraw/zinc/09/37/59/1322093759.db2.gz	YVFIXCRRWBBWFX-JAIQZWGSSA-N	0	3	326.444	3.468	20	30		EGEDHN
C#CCN(CC)C[C@@H](O)CO[C@H](c1ccccc1)c1ccc(C)cc1	ZINC000920096488	1322137007	/nfs/dbraw/zinc/13/70/07/1322137007.db2.gz	XVTXPPWWDLGKFT-FGZHOGPDSA-N	0	3	337.463	3.417	20	30		EGEDHN
CCO[C@@H](CC)C(=O)C(C#N)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000920111028	1322137880	/nfs/dbraw/zinc/13/78/80/1322137880.db2.gz	IERGFFCDGKGMOR-OLZOCXBDSA-N	0	3	343.210	3.456	20	30		EGEDHN
CCOC(=O)c1c[nH]nc1[C@H]1CCN([C@@H](C)c2cccc(C#N)c2)C1	ZINC000931009826	1329027994	/nfs/dbraw/zinc/02/79/94/1329027994.db2.gz	IWSPXMUURHVXKJ-BBRMVZONSA-N	0	3	338.411	3.009	20	30		EGEDHN
N#Cc1ccc(Br)c(CNC[C@H]2CSCCS2)c1	ZINC000921828042	1322406635	/nfs/dbraw/zinc/40/66/35/1322406635.db2.gz	RSXNKSPXGWKJRP-LBPRGKRZSA-N	0	3	343.315	3.259	20	30		EGEDHN
CC(C)(C)C[C@H](CO)NCc1cc(C#N)ccc1Br	ZINC000921915364	1322422144	/nfs/dbraw/zinc/42/21/44/1322422144.db2.gz	UMRRDKNRECTKDC-CYBMUJFWSA-N	0	3	325.250	3.207	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCN(C(=O)C2C=CC=CC=C2)C1	ZINC001024006528	1323077575	/nfs/dbraw/zinc/07/75/75/1323077575.db2.gz	DJXSWFXSXKTBKD-SFHVURJKSA-N	0	3	347.462	3.185	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC001024042207	1323093355	/nfs/dbraw/zinc/09/33/55/1323093355.db2.gz	KZLPJHOYWBSRCZ-LJQANCHMSA-N	0	3	347.462	3.129	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](CNCc2nc(C)c(C)s2)C1	ZINC001024093633	1323125009	/nfs/dbraw/zinc/12/50/09/1323125009.db2.gz	YHDOUYQQDOENCZ-OAHLLOKOSA-N	0	3	335.517	3.300	20	30		EGEDHN
C=CCC[C@H](c1ccccc1)N1C(=O)N[C@H](CN2CCCCC2)C1=O	ZINC000924711720	1323126519	/nfs/dbraw/zinc/12/65/19/1323126519.db2.gz	DEXIFAOGCZFHNP-QZTJIDSGSA-N	0	3	341.455	3.100	20	30		EGEDHN
C[C@H](C(=O)N(C)C1CCC(NCc2ccccc2C#N)CC1)C1CC1	ZINC000963201165	1323228492	/nfs/dbraw/zinc/22/84/92/1323228492.db2.gz	IHOBVJNQPTWZPN-VMEOHVCESA-N	0	3	339.483	3.464	20	30		EGEDHN
CCC(=O)N1CCC[C@H]([C@@H]2CCCN2Cc2cc(C#N)ccc2F)C1	ZINC000963213464	1323239331	/nfs/dbraw/zinc/23/93/31/1323239331.db2.gz	AALRSMZBDUJWSJ-LPHOPBHVSA-N	0	3	343.446	3.310	20	30		EGEDHN
CCC(=O)N1CCC[C@H]([C@H]2CCCN2Cc2ccc(C#N)cc2F)C1	ZINC000963213642	1323239786	/nfs/dbraw/zinc/23/97/86/1323239786.db2.gz	BYCGENKYJFSDEM-PKOBYXMFSA-N	0	3	343.446	3.310	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1cc2ccccc2nc1C	ZINC001024467412	1323423613	/nfs/dbraw/zinc/42/36/13/1323423613.db2.gz	FQKAHYGFZHOUBI-GOSISDBHSA-N	0	3	335.451	3.151	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NC[C@H]1CCCCN1CC(=C)C	ZINC001024515538	1323465444	/nfs/dbraw/zinc/46/54/44/1323465444.db2.gz	UWTFEIYSMFDPOR-QGZVFWFLSA-N	0	3	328.456	3.412	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1[nH]c2ccccc2c1Cl	ZINC001024529923	1323474850	/nfs/dbraw/zinc/47/48/50/1323474850.db2.gz	ABJRICWJVGCTBS-CQSZACIVSA-N	0	3	343.858	3.429	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccc(C)c(Cl)c1F	ZINC001024573267	1323511178	/nfs/dbraw/zinc/51/11/78/1323511178.db2.gz	ZMJPXUXEUOVLFO-CQSZACIVSA-N	0	3	336.838	3.395	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)[C@@H]1C[C@H]1c1ccc(F)cc1F	ZINC001024573574	1323511475	/nfs/dbraw/zinc/51/14/75/1323511475.db2.gz	QMTYGPABAISDBM-RYQLBKOJSA-N	0	3	346.421	3.062	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1c[nH]nc1-c1ccccc1	ZINC001024581376	1323518060	/nfs/dbraw/zinc/51/80/60/1323518060.db2.gz	HAORWDLUWAMVOY-QGZVFWFLSA-N	0	3	338.455	3.237	20	30		EGEDHN
C=CCCN1CCCC[C@@H]1CNC(=O)c1cc2cccnc2s1	ZINC001024744907	1323644687	/nfs/dbraw/zinc/64/46/87/1323644687.db2.gz	IREKDIMPMDAUSY-OAHLLOKOSA-N	0	3	329.469	3.457	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccc(OC(C)C)cc1	ZINC001024789140	1323694441	/nfs/dbraw/zinc/69/44/41/1323694441.db2.gz	SZQQEJFJHXHZNS-SFHVURJKSA-N	0	3	328.456	3.081	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccc(CC(C)C)cc1	ZINC001024793748	1323699321	/nfs/dbraw/zinc/69/93/21/1323699321.db2.gz	ASWYSTYZGQXIHE-FQEVSTJZSA-N	0	3	326.484	3.493	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccc(OCC)c(OC)c1	ZINC001024795448	1323700941	/nfs/dbraw/zinc/70/09/41/1323700941.db2.gz	ILJISSUGUVHGHW-QGZVFWFLSA-N	0	3	346.471	3.254	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cnn(C(C)(C)C)c1CC	ZINC001024804233	1323708023	/nfs/dbraw/zinc/70/80/23/1323708023.db2.gz	QSAXMSVCDITWJH-INIZCTEOSA-N	0	3	346.519	3.361	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cccc2oc(C)nc21	ZINC001024816168	1323717376	/nfs/dbraw/zinc/71/73/76/1323717376.db2.gz	DIQWQTMYOUQVCI-OAHLLOKOSA-N	0	3	327.428	3.297	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccc(-c2ccccc2)[nH]1	ZINC001024825164	1323729268	/nfs/dbraw/zinc/72/92/68/1323729268.db2.gz	VEVYYASEORAAQM-SFHVURJKSA-N	0	3	335.451	3.289	20	30		EGEDHN
Cc1cccc(Cl)c1CNC[C@H]1CCCCN1C(=O)[C@H](C)C#N	ZINC001024903137	1323773230	/nfs/dbraw/zinc/77/32/30/1323773230.db2.gz	RUOGLTYQSBSFCV-HUUCEWRRSA-N	0	3	333.863	3.279	20	30		EGEDHN
C[C@@H](C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)c(F)c1)C1CC1	ZINC001024913371	1323777440	/nfs/dbraw/zinc/77/74/40/1323777440.db2.gz	CDBUSUNYSSQRIG-RDTXWAMCSA-N	0	3	343.446	3.214	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)C2=CCCC2)s1	ZINC001024926192	1323786993	/nfs/dbraw/zinc/78/69/93/1323786993.db2.gz	TVYKZTMLABHGFI-OAHLLOKOSA-N	0	3	329.469	3.201	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCCC[C@@H]1CNCc1cncc(C)c1	ZINC001025037409	1323840457	/nfs/dbraw/zinc/84/04/57/1323840457.db2.gz	CIVGXDUOAULDBB-GOSISDBHSA-N	0	3	329.488	3.463	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCCC[C@H]1CNCc1cncc(F)c1	ZINC001025069360	1323870442	/nfs/dbraw/zinc/87/04/42/1323870442.db2.gz	IVDHHIQJIJCDHN-PKOBYXMFSA-N	0	3	333.451	3.294	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCCC[C@@H]1CNCc1ncccc1C	ZINC001025070282	1323872072	/nfs/dbraw/zinc/87/20/72/1323872072.db2.gz	WYGYHCWQHIKGDW-YLJYHZDGSA-N	0	3	329.488	3.463	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)CCc1ccoc1	ZINC001025217472	1324010076	/nfs/dbraw/zinc/01/00/76/1324010076.db2.gz	DCAJGNBYDAKGCK-OALUTQOASA-N	0	3	328.456	3.081	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(C)nc(C)c1	ZINC001025237095	1324028762	/nfs/dbraw/zinc/02/87/62/1324028762.db2.gz	XIVPIOZYFIELSE-PMACEKPBSA-N	0	3	339.483	3.181	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cn(C)c2ccccc12	ZINC001025247439	1324047246	/nfs/dbraw/zinc/04/72/46/1324047246.db2.gz	KYZLIMFHUWKWGT-NHCUHLMSSA-N	0	3	349.478	3.271	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc(OC)cc1F	ZINC001025248258	1324048955	/nfs/dbraw/zinc/04/89/55/1324048955.db2.gz	XMODBMISOSKREG-RTBURBONSA-N	0	3	346.446	3.479	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(Cl)cn1C	ZINC001025250225	1324050212	/nfs/dbraw/zinc/05/02/12/1324050212.db2.gz	IICFZPBOEURYEV-IAGOWNOFSA-N	0	3	347.890	3.161	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cncc(CC)c1	ZINC001025252201	1324057124	/nfs/dbraw/zinc/05/71/24/1324057124.db2.gz	NNZJUUQOURJRFU-PMACEKPBSA-N	0	3	339.483	3.126	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)C1CCC2(CC2)CC1	ZINC001025252686	1324058244	/nfs/dbraw/zinc/05/82/44/1324058244.db2.gz	PZHDPTVQFGXUMX-OALUTQOASA-N	0	3	328.500	3.436	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1nccc2ccccc21	ZINC001025261074	1324072335	/nfs/dbraw/zinc/07/23/35/1324072335.db2.gz	SXPUDKPNEIRCNK-UXHICEINSA-N	0	3	347.462	3.327	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccn(C)c1CC	ZINC001025269094	1324081901	/nfs/dbraw/zinc/08/19/01/1324081901.db2.gz	KVNKBWPGNRBUKA-PMACEKPBSA-N	0	3	341.499	3.070	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cccc2cc[nH]c21	ZINC001025271173	1324086191	/nfs/dbraw/zinc/08/61/91/1324086191.db2.gz	HFUZJSICZOXXJB-OALUTQOASA-N	0	3	335.451	3.260	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1csc(Cl)c1	ZINC001025273172	1324089514	/nfs/dbraw/zinc/08/95/14/1324089514.db2.gz	BGAHXIHZEWYLRL-GJZGRUSLSA-N	0	3	336.888	3.494	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1noc2c1CCCC2	ZINC001025274063	1324090427	/nfs/dbraw/zinc/09/04/27/1324090427.db2.gz	UAXOHYDSUQKHMG-IRXDYDNUSA-N	0	3	343.471	3.199	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(C)[nH]c1C	ZINC001025273823	1324090679	/nfs/dbraw/zinc/09/06/79/1324090679.db2.gz	HHUCRAXGKKXVLM-OALUTQOASA-N	0	3	327.472	3.114	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)CCC1CCOCC1	ZINC001025274861	1324093887	/nfs/dbraw/zinc/09/38/87/1324093887.db2.gz	PHLWHRUQPVMGRB-WOJBJXKFSA-N	0	3	346.515	3.062	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)Cc1ccsc1C	ZINC001025279073	1324101032	/nfs/dbraw/zinc/10/10/32/1324101032.db2.gz	YHGAPNRXCOEVTG-RTBURBONSA-N	0	3	344.524	3.468	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)C(C1CC1)C1CC1	ZINC001025287530	1324109875	/nfs/dbraw/zinc/10/98/75/1324109875.db2.gz	ONOKEVUPPUQJEG-RTBURBONSA-N	0	3	328.500	3.291	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1CCCC[C@H]1[C@@H]1CCCN1CC#CC	ZINC001025293232	1324119488	/nfs/dbraw/zinc/11/94/88/1324119488.db2.gz	QCELMIFMNKPOJH-VXKWHMMOSA-N	0	3	348.490	3.079	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1CCCC[C@@H]1[C@@H]1CCCN1CC#CC	ZINC001025293230	1324119781	/nfs/dbraw/zinc/11/97/81/1324119781.db2.gz	QCELMIFMNKPOJH-FCHUYYIVSA-N	0	3	348.490	3.079	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)CCc1ccccc1	ZINC001025293475	1324120331	/nfs/dbraw/zinc/12/03/31/1324120331.db2.gz	RZJXZWQLYJSBCB-NHCUHLMSSA-N	0	3	338.495	3.488	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(C)n(C)c1C	ZINC001025297119	1324128855	/nfs/dbraw/zinc/12/88/55/1324128855.db2.gz	OJJLJKXFJNDEPL-VQTJNVASSA-N	0	3	341.499	3.124	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)Cc1ccc(Cl)cc1	ZINC001025297009	1324129094	/nfs/dbraw/zinc/12/90/94/1324129094.db2.gz	NCWOUQLOVPEWOK-MOPGFXCFSA-N	0	3	344.886	3.361	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(Cl)cn1CC	ZINC001025297527	1324130056	/nfs/dbraw/zinc/13/00/56/1324130056.db2.gz	YFVAGOQJFXGRTF-SJORKVTESA-N	0	3	347.890	3.254	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1c(C)onc1CC	ZINC001025297548	1324130730	/nfs/dbraw/zinc/13/07/30/1324130730.db2.gz	YJRASTALPTVIFV-IAGOWNOFSA-N	0	3	331.460	3.191	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccccc1OCC	ZINC001025298476	1324133268	/nfs/dbraw/zinc/13/32/68/1324133268.db2.gz	XEKXLZVHOVTONR-OALUTQOASA-N	0	3	340.467	3.178	20	30		EGEDHN
C[C@H](NC(=O)c1ccco1)[C@@H]1CCCN(Cc2ccc(C#N)cc2)C1	ZINC001025320822	1324158301	/nfs/dbraw/zinc/15/83/01/1324158301.db2.gz	QTDGJZIVQYJXII-MAUKXSAKSA-N	0	3	337.423	3.182	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cccc3scnc32)C1	ZINC001025419616	1324251299	/nfs/dbraw/zinc/25/12/99/1324251299.db2.gz	NIYXFGXIHWNYBL-LSDHHAIUSA-N	0	3	341.480	3.150	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2sc(C)nc2CC(C)C)C1	ZINC001025472213	1324318081	/nfs/dbraw/zinc/31/80/81/1324318081.db2.gz	OKNMXYFSIFRORZ-GOEBONIOSA-N	0	3	347.528	3.114	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2sccc2-n2cccc2)C1	ZINC001025493544	1324344987	/nfs/dbraw/zinc/34/49/87/1324344987.db2.gz	PAKCIQPFUXBQNX-HZPDHXFCSA-N	0	3	341.480	3.002	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H](C)[C@H]2CCCN(C/C=C\Cl)C2)cc1	ZINC001025501653	1324350369	/nfs/dbraw/zinc/35/03/69/1324350369.db2.gz	IVUXWNGTWPFHES-KANQYOJMSA-N	0	3	330.859	3.251	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc3cc(F)ccc3o2)C1	ZINC001025550058	1324399436	/nfs/dbraw/zinc/39/94/36/1324399436.db2.gz	ZQHDGGQUMIPPIB-HUUCEWRRSA-N	0	3	342.414	3.426	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(C(CC)CC)no2)C1	ZINC001025555573	1324405361	/nfs/dbraw/zinc/40/53/61/1324405361.db2.gz	OVOAJFTURDQOMP-RDJZCZTQSA-N	0	3	345.487	3.432	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc3ncsc3c2)C1	ZINC001025609949	1324461107	/nfs/dbraw/zinc/46/11/07/1324461107.db2.gz	IOMNWAUNKCISFA-GDBMZVCRSA-N	0	3	341.480	3.150	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(OCC(C)C)cc2)C1	ZINC001025611600	1324464064	/nfs/dbraw/zinc/46/40/64/1324464064.db2.gz	MTRAWGUDRDHZBV-PKOBYXMFSA-N	0	3	342.483	3.185	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(CC)c(C)s2)C1	ZINC001025614074	1324467083	/nfs/dbraw/zinc/46/70/83/1324467083.db2.gz	FZMCKIKOYQUCIR-WMLDXEAASA-N	0	3	332.513	3.473	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2sc(CCC)nc2C)C1	ZINC001025618665	1324470555	/nfs/dbraw/zinc/47/05/55/1324470555.db2.gz	DOPHCWDCZREAGI-ZBFHGGJFSA-N	0	3	347.528	3.258	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cncc3ccccc32)C1	ZINC001025627420	1324478915	/nfs/dbraw/zinc/47/89/15/1324478915.db2.gz	JLVPDGCQZQUMHF-WMZOPIPTSA-N	0	3	335.451	3.088	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2c[nH]c3ccc(F)cc23)C1	ZINC001025635606	1324488349	/nfs/dbraw/zinc/48/83/49/1324488349.db2.gz	SSFXXNAINQPNQM-CABCVRRESA-N	0	3	341.430	3.161	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H]2CC[C@@H](NCc3nccs3)[C@H]2C1	ZINC001026327156	1324728841	/nfs/dbraw/zinc/72/88/41/1324728841.db2.gz	XYGHBMBDFGLUSV-SOUVJXGZSA-N	0	3	333.501	3.072	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H]2CC[C@@H](NCc3cc(C4CC4)no3)[C@@H]2C1	ZINC001026329053	1324729704	/nfs/dbraw/zinc/72/97/04/1324729704.db2.gz	UXMWBOJEAWGMNL-USXIJHARSA-N	0	3	343.471	3.091	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H]3CC[C@H](NCc4nccs4)[C@H]3C2)CC1	ZINC001026345741	1324742687	/nfs/dbraw/zinc/74/26/87/1324742687.db2.gz	BVNLYTCKDGDVMT-ULQDDVLXSA-N	0	3	345.512	3.216	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)NC1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001026479123	1324836606	/nfs/dbraw/zinc/83/66/06/1324836606.db2.gz	ANSBKWRUXFFQPU-ABHNRTSZSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)[C@H](C)C2CCC2)CC1	ZINC001026514143	1324860636	/nfs/dbraw/zinc/86/06/36/1324860636.db2.gz	SRQQCODFPPWMQA-LRVUVFPRSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)c2cocc2C)CC1	ZINC001026540722	1324877348	/nfs/dbraw/zinc/87/73/48/1324877348.db2.gz	WQVYEWKDPBZBHW-UHFFFAOYSA-N	0	3	341.249	3.127	20	30		EGEDHN
C=C1CC(C)(C(=O)NC2CCC(NCc3ccn(C(C)C)n3)CC2)C1	ZINC001026555529	1324893216	/nfs/dbraw/zinc/89/32/16/1324893216.db2.gz	AWVMPEXCDBUJHY-UHFFFAOYSA-N	0	3	344.503	3.337	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@H](CNCc3ccccc3C#N)C2)oc1C	ZINC001026782762	1325020166	/nfs/dbraw/zinc/02/01/66/1325020166.db2.gz	MABNKLLHADWZQO-MRXNPFEDSA-N	0	3	337.423	3.020	20	30		EGEDHN
Cc1sccc1C(=O)N1CC[C@H](CNCc2ccccc2C#N)C1	ZINC001026831118	1325039420	/nfs/dbraw/zinc/03/94/20/1325039420.db2.gz	RYXMYRAFHUGRKY-OAHLLOKOSA-N	0	3	339.464	3.180	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1CC[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001026864555	1325053498	/nfs/dbraw/zinc/05/34/98/1325053498.db2.gz	JSWQEMOVKZLCMN-OAHLLOKOSA-N	0	3	345.462	3.318	20	30		EGEDHN
N#Cc1ncc(Br)cc1N[C@@H]1CCCN2CCCC[C@H]12	ZINC000853717503	1325152301	/nfs/dbraw/zinc/15/23/01/1325152301.db2.gz	GCBRFBHFMUIGHO-IUODEOHRSA-N	0	3	335.249	3.145	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)Cc2ccco2)C1	ZINC000963374703	1325180935	/nfs/dbraw/zinc/18/09/35/1325180935.db2.gz	RXSBZRXMDYRYEX-DOTOQJQBSA-N	0	3	336.863	3.278	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](CNCc3csc(CCC)n3)C2)C1	ZINC001027051055	1325190295	/nfs/dbraw/zinc/19/02/95/1325190295.db2.gz	PRDATZUUUMGWGW-OAHLLOKOSA-N	0	3	347.528	3.390	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)c(F)c2)C1	ZINC001027276398	1325390910	/nfs/dbraw/zinc/39/09/10/1325390910.db2.gz	ITCAYEXPIHHYQG-QGZVFWFLSA-N	0	3	331.435	3.166	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@H](N(C)Cc2ccc(F)c(C#N)c2)C1	ZINC001027279705	1325403414	/nfs/dbraw/zinc/40/34/14/1325403414.db2.gz	DFWMFMJKNNRDKD-KRWDZBQOSA-N	0	3	329.419	3.086	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)C2CCC(NCc3nccnc3C)CC2)C1	ZINC000963891616	1325423907	/nfs/dbraw/zinc/42/39/07/1325423907.db2.gz	XCKMVABZCAMOBG-UHFFFAOYSA-N	0	3	342.487	3.001	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)[C@@H]2CC=CCC2)C1	ZINC001027294544	1325430089	/nfs/dbraw/zinc/43/00/89/1325430089.db2.gz	WMHPEAIQEXKWJL-WOJBJXKFSA-N	0	3	337.467	3.337	20	30		EGEDHN
N#CCCc1ccc(NC(=O)NC[C@H]2NCCc3ccccc32)cc1	ZINC000926192304	1325463706	/nfs/dbraw/zinc/46/37/06/1325463706.db2.gz	DVRMHMGQUNVWPF-LJQANCHMSA-N	0	3	334.423	3.151	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(Nc3ccccc3)cn2)CC1	ZINC000856253649	1325470763	/nfs/dbraw/zinc/47/07/63/1325470763.db2.gz	CXXHNBNBMUAANO-UHFFFAOYSA-N	0	3	334.423	3.109	20	30		EGEDHN
CC(C)Oc1cccc(CN(C)[C@@H]2CCCN(C(=O)[C@H](C)C#N)C2)c1	ZINC001027337181	1325497159	/nfs/dbraw/zinc/49/71/59/1325497159.db2.gz	ZMCXHVCSNZURSU-SJLPKXTDSA-N	0	3	343.471	3.056	20	30		EGEDHN
CN(Cc1ccc(F)c(C#N)c1)[C@H]1CCCN(C(=O)CCC2CC2)C1	ZINC001027337804	1325497282	/nfs/dbraw/zinc/49/72/82/1325497282.db2.gz	BUGBCEIPJSWLTF-SFHVURJKSA-N	0	3	343.446	3.310	20	30		EGEDHN
CC[C@@H](C)c1ccc(NC(=O)C(C#N)C(=O)C2CC(OC)C2)cc1	ZINC000860472222	1329321552	/nfs/dbraw/zinc/32/15/52/1329321552.db2.gz	FRKZEXBCKBVIRE-SGTUBPSTSA-N	0	3	328.412	3.272	20	30		EGEDHN
C[C@@H](CC(C)(C)C#N)NCc1cc(F)c(N2CCOCC2)c(F)c1	ZINC000926558316	1327616338	/nfs/dbraw/zinc/61/63/38/1327616338.db2.gz	DCNKQKOBBUIHQX-ZDUSSCGKSA-N	0	3	337.414	3.219	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)[C@@H]2CCC2(C)C)C1	ZINC001027535526	1327825784	/nfs/dbraw/zinc/82/57/84/1327825784.db2.gz	HZSYEDYLQGYPEQ-OALUTQOASA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H](N(C)CCc2ccns2)C1	ZINC001027559538	1327872932	/nfs/dbraw/zinc/87/29/32/1327872932.db2.gz	AMLZOGJRFGBBCC-CRAIPNDOSA-N	0	3	335.517	3.211	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)[C@H](c2ccc(F)cc2)C(C)C)C1	ZINC001027697021	1328105588	/nfs/dbraw/zinc/10/55/88/1328105588.db2.gz	QZTAFMYURDLLSA-OALUTQOASA-N	0	3	330.447	3.121	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2cc(C)c(OC)c(C)c2)C1	ZINC000966303001	1328263466	/nfs/dbraw/zinc/26/34/66/1328263466.db2.gz	XJWPZUFLMMEZDR-KSSFIOAISA-N	0	3	330.472	3.328	20	30		EGEDHN
C#CCNC(=O)[C@H](C)N[C@@H](CCCc1ccccc1)c1ccccc1	ZINC000863400202	1329551985	/nfs/dbraw/zinc/55/19/85/1329551985.db2.gz	JDWSZKPSGSQDKA-RXVVDRJESA-N	0	3	334.463	3.478	20	30		EGEDHN
CC(C)(C)OC(=O)NCC[C@@H]1CCN(CC#Cc2ccc(F)cc2)C1	ZINC000932697248	1329834632	/nfs/dbraw/zinc/83/46/32/1329834632.db2.gz	PBOSFLDYXJBSMI-QGZVFWFLSA-N	0	3	346.446	3.414	20	30		EGEDHN
Cc1ccc(C#N)cc1C(=O)NC1CCN([C@H](C)c2ccncc2)CC1	ZINC000935030846	1330024140	/nfs/dbraw/zinc/02/41/40/1330024140.db2.gz	ITRXLRLQAWFLCX-MRXNPFEDSA-N	0	3	348.450	3.217	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H](C)[C@H](NCc3ccnc(Cl)c3)C2)CC1	ZINC000939048894	1330364517	/nfs/dbraw/zinc/36/45/17/1330364517.db2.gz	GHLPSOXFDOOQBO-RHSMWYFYSA-N	0	3	347.890	3.418	20	30		EGEDHN
CC1(C)CN(Cc2ccc(C#N)cc2)CC[C@H]1NC(=O)CC1CCC1	ZINC000940634511	1331134716	/nfs/dbraw/zinc/13/47/16/1331134716.db2.gz	LJIGVZXQGJCJLR-LJQANCHMSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC1(C(=O)N[C@@H]2CCN(Cc3cccc(C#N)c3)CC2(C)C)CCC1	ZINC000940951188	1331269746	/nfs/dbraw/zinc/26/97/46/1331269746.db2.gz	ZKUSNDXAEOTXKB-GOSISDBHSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cncc(-c3ccccc3)c2)[C@H](C)C1	ZINC000942106237	1331831994	/nfs/dbraw/zinc/83/19/94/1331831994.db2.gz	MTOIDHIPNOMKOG-DYESRHJHSA-N	0	3	347.462	3.212	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3ccccc3nc2C)[C@H](C)C1	ZINC000942107173	1331833246	/nfs/dbraw/zinc/83/32/46/1331833246.db2.gz	UYCBGRPTBXBJFK-BEFAXECRSA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(CC(C)C)s2)[C@H](C)C1	ZINC000942138282	1331844163	/nfs/dbraw/zinc/84/41/63/1331844163.db2.gz	WMBZIBBXFUSBHY-WBVHZDCISA-N	0	3	332.513	3.410	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccc3c(C)c(C)[nH]c32)[C@H](C)C1	ZINC000942180420	1331862800	/nfs/dbraw/zinc/86/28/00/1331862800.db2.gz	GIEAMIOAXORYNA-AUUYWEPGSA-N	0	3	337.467	3.248	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(C)n(C(CC)CC)n2)[C@@H](C)C1	ZINC000942207300	1331880079	/nfs/dbraw/zinc/88/00/79/1331880079.db2.gz	KYTFBAUFNBXTCK-WMLDXEAASA-N	0	3	332.492	3.179	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2CCc3ccccc3CC2)[C@@H](C)C1	ZINC000942208495	1331880231	/nfs/dbraw/zinc/88/02/31/1331880231.db2.gz	POTYJZMKGFEOOV-LAUBAEHRSA-N	0	3	338.495	3.032	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(-c3cccs3)on2)[C@H](C)C1	ZINC000942538194	1331963197	/nfs/dbraw/zinc/96/31/97/1331963197.db2.gz	MBLPHNGMEUPJDJ-CHWSQXEVSA-N	0	3	331.441	3.029	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(F)c(Cl)cc2F)[C@@H](C)C1	ZINC000942585394	1331990778	/nfs/dbraw/zinc/99/07/78/1331990778.db2.gz	DSSRSIQRBTYLEY-ZUZCIYMTSA-N	0	3	328.790	3.244	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C(C)C)nc2CC)[C@H](C)C1	ZINC000942859898	1332049520	/nfs/dbraw/zinc/04/95/20/1332049520.db2.gz	OWOBHWKJVPOKEL-OXQOHEQNSA-N	0	3	341.499	3.231	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2c(F)ccc(F)c2Cl)[C@@H](C)C1	ZINC000942959267	1332067147	/nfs/dbraw/zinc/06/71/47/1332067147.db2.gz	KPVUIMCWGLYNKB-SMDDNHRTSA-N	0	3	340.801	3.082	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ncoc2-c2cccs2)[C@@H](C)C1	ZINC000943690743	1332239396	/nfs/dbraw/zinc/23/93/96/1332239396.db2.gz	VXFNOXUGESGAHC-QWHCGFSZSA-N	0	3	331.441	3.029	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ncoc2-c2cccs2)[C@H](C)C1	ZINC000943690742	1332239742	/nfs/dbraw/zinc/23/97/42/1332239742.db2.gz	VXFNOXUGESGAHC-OLZOCXBDSA-N	0	3	331.441	3.029	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2sc(CC3CC3)nc2C)[C@H](C)C1	ZINC000943771125	1332260605	/nfs/dbraw/zinc/26/06/05/1332260605.db2.gz	FDZJBYHVAQREHU-IUODEOHRSA-N	0	3	333.501	3.030	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(OC)c(C3CC3)c2)[C@H](C)C1	ZINC000943778893	1332264228	/nfs/dbraw/zinc/26/42/28/1332264228.db2.gz	XNLDMFCDKIXSQD-DNVCBOLYSA-N	0	3	340.467	3.036	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc3sccc3c2)[C@@H](C)C1	ZINC000943818053	1332273420	/nfs/dbraw/zinc/27/34/20/1332273420.db2.gz	VKFXPZAPFKOBQB-YOEHRIQHSA-N	0	3	326.465	3.365	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc(-c3ccoc3)c2)[C@@H](C)C1	ZINC000944045261	1332314629	/nfs/dbraw/zinc/31/46/29/1332314629.db2.gz	CQMJQGMWILAYMN-JXFKEZNVSA-N	0	3	336.435	3.410	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(Cl)c(CCC)c2)[C@@H](C)C1	ZINC000944082735	1332323070	/nfs/dbraw/zinc/32/30/70/1332323070.db2.gz	ZPVRXXRBUXQLRE-KBXCAEBGSA-N	0	3	332.875	3.366	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C(C)(C)c2ccccc2Cl)[C@H](C)C1	ZINC000944213814	1332346503	/nfs/dbraw/zinc/34/65/03/1332346503.db2.gz	GLOUXZRKUFEIOD-CRAIPNDOSA-N	0	3	346.902	3.468	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(CC(C)C)cc2)[C@@H](C)C1	ZINC000944789214	1332423820	/nfs/dbraw/zinc/42/38/20/1332423820.db2.gz	KJLPVHGFFLVTPQ-FXAWDEMLSA-N	0	3	326.484	3.349	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc3ccccc3c2)[C@@H](C)C1	ZINC000944814238	1332428108	/nfs/dbraw/zinc/42/81/08/1332428108.db2.gz	XQTPGJWMVNUYBZ-LAUBAEHRSA-N	0	3	334.463	3.232	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2sccc2OC)C12CCC2	ZINC001078786303	1357081874	/nfs/dbraw/zinc/08/18/74/1357081874.db2.gz	SLYWDASDMHZQKB-QWHCGFSZSA-N	0	3	340.876	3.140	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)C[C@@H]3C[C@H]3C3CC3)CC[C@@H]2C1	ZINC000946684965	1332877479	/nfs/dbraw/zinc/87/74/79/1332877479.db2.gz	XHXGWLGBZNBBSK-MHORFTMASA-N	0	3	336.907	3.346	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3ncoc3C3CC3)CC[C@@H]2C1	ZINC000946851164	1332915070	/nfs/dbraw/zinc/91/50/70/1332915070.db2.gz	GWOUREZRXLHQBA-GASCZTMLSA-N	0	3	349.862	3.089	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)C2CCCC2)CCN1Cc1ccc(C#N)cc1	ZINC000946972110	1332950092	/nfs/dbraw/zinc/95/00/92/1332950092.db2.gz	WKWJZJZNWWQOOB-HNAYVOBHSA-N	0	3	325.456	3.218	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)C2CCCC2)CCN1Cc1cccc(C#N)c1	ZINC000946976436	1332951931	/nfs/dbraw/zinc/95/19/31/1332951931.db2.gz	UYMRJVUEIWVPPU-KXBFYZLASA-N	0	3	325.456	3.218	20	30		EGEDHN
Cc1occc1C(=O)N[C@@H]1CCN(Cc2ccc(C#N)cc2)[C@H](C)C1	ZINC000947032548	1332982943	/nfs/dbraw/zinc/98/29/43/1332982943.db2.gz	PPEKEOZUKKKGKV-RDTXWAMCSA-N	0	3	337.423	3.243	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)CC2CCC2)CCN1Cc1ccc(C#N)cc1	ZINC000947166520	1333033065	/nfs/dbraw/zinc/03/30/65/1333033065.db2.gz	ORCRUBZPARNQAQ-BEFAXECRSA-N	0	3	325.456	3.218	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccn(C3CCCCC3)n2)C[C@H]1C	ZINC000947314138	1333085163	/nfs/dbraw/zinc/08/51/63/1333085163.db2.gz	FNHSTRMPZYLBAZ-CVEARBPZSA-N	0	3	330.476	3.157	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc3ccc(C)nc32)C[C@H]1C	ZINC000947432938	1333126027	/nfs/dbraw/zinc/12/60/27/1333126027.db2.gz	CUCMWMTWHPARLS-AEFFLSMTSA-N	0	3	335.451	3.149	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc(-c3cnco3)cc2)C[C@@H]1C	ZINC000947450767	1333133558	/nfs/dbraw/zinc/13/35/58/1333133558.db2.gz	YNXFBCRWWCFHDZ-YOEHRIQHSA-N	0	3	325.412	3.110	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(OC)c(C(C)C)c2)C[C@@H]1C	ZINC000947505822	1333149462	/nfs/dbraw/zinc/14/94/62/1333149462.db2.gz	FPVJLEJTVPVGAT-WMZOPIPTSA-N	0	3	342.483	3.425	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(OC)c(C(C)C)c2)C[C@H]1C	ZINC000947506168	1333149742	/nfs/dbraw/zinc/14/97/42/1333149742.db2.gz	KYGXVPWXCJFXKJ-NVXWUHKLSA-N	0	3	328.456	3.035	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2sc(C)nc2CC(C)C)C[C@H]1C	ZINC000947506610	1333150132	/nfs/dbraw/zinc/15/01/32/1333150132.db2.gz	SFMQTRDNPIKUAQ-HIFRSBDPSA-N	0	3	335.517	3.419	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2c(C)occ2C(F)(F)F)C[C@H]1C	ZINC000947547898	1333167860	/nfs/dbraw/zinc/16/78/60/1333167860.db2.gz	VGOCCFUUADVAFN-YPMHNXCESA-N	0	3	342.361	3.213	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc3cc(Cl)ccc3[nH]2)C[C@@H]1C	ZINC000947607083	1333190449	/nfs/dbraw/zinc/19/04/49/1333190449.db2.gz	JXWMPUPSVFMXME-SWLSCSKDSA-N	0	3	329.831	3.037	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(CCc3ccns3)[C@H](C)C2)C1	ZINC000947702765	1333233238	/nfs/dbraw/zinc/23/32/38/1333233238.db2.gz	SBNCZFDCWGFJDK-CABCVRRESA-N	0	3	333.501	3.011	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2c[nH]nc2C2CCCCC2)C[C@H]1C	ZINC000947917154	1333306346	/nfs/dbraw/zinc/30/63/46/1333306346.db2.gz	VMXUTVIXQNOELJ-ZBFHGGJFSA-N	0	3	330.476	3.226	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2coc(-c3ccccc3)n2)C[C@H]1C	ZINC000947940983	1333313900	/nfs/dbraw/zinc/31/39/00/1333313900.db2.gz	VTGGMGVKBLHTHH-ZBFHGGJFSA-N	0	3	325.412	3.110	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C23CC4CC(CC(C4)C2)C3)C[C@@H]1C	ZINC000947966437	1333323291	/nfs/dbraw/zinc/32/32/91/1333323291.db2.gz	ASNZERARSDUTPH-VJRVKHOTSA-N	0	3	328.500	3.195	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(Cl)c(Cl)c2)C[C@H]1C	ZINC000947967449	1333324758	/nfs/dbraw/zinc/32/47/58/1333324758.db2.gz	PAJUCLSFBSOZRV-YPMHNXCESA-N	0	3	325.239	3.209	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2sccc2C(F)F)C[C@H]1C	ZINC000947984210	1333331244	/nfs/dbraw/zinc/33/12/44/1333331244.db2.gz	GCORKOTUAWLEDA-VXGBXAGGSA-N	0	3	326.412	3.292	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(CC(C)C)cc2)C[C@@H]1C	ZINC000948020298	1333343840	/nfs/dbraw/zinc/34/38/40/1333343840.db2.gz	BAZQNUUEOFMTNX-FXAWDEMLSA-N	0	3	326.484	3.491	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C(F)(F)F)s2)C[C@@H]1C	ZINC000948083344	1333370331	/nfs/dbraw/zinc/37/03/31/1333370331.db2.gz	ROUNKKRSECNNHL-RYUDHWBXSA-N	0	3	344.402	3.373	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cc(C)c(OC)c(C)c2)CC1	ZINC000948397354	1333509187	/nfs/dbraw/zinc/50/91/87/1333509187.db2.gz	QFXPKHMOOCJZFC-IBGZPJMESA-N	0	3	342.483	3.262	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cc3ccccc3nc2C)CC1	ZINC000948416985	1333517328	/nfs/dbraw/zinc/51/73/28/1333517328.db2.gz	ULIBQVPHHTXQNL-LJQANCHMSA-N	0	3	349.478	3.493	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)C[C@@H]2CCC(F)(F)C2)CC1	ZINC000948424084	1333519796	/nfs/dbraw/zinc/51/97/96/1333519796.db2.gz	GFZWUSNUFMDZGO-JKSUJKDBSA-N	0	3	326.431	3.148	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)C2(c3cccc(Cl)c3)CC2)CC1	ZINC000948426068	1333520824	/nfs/dbraw/zinc/52/08/24/1333520824.db2.gz	UQPNXMMMIGHWEZ-SFHVURJKSA-N	0	3	344.886	3.318	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2nccc3ccsc32)CC1	ZINC000948457216	1333533688	/nfs/dbraw/zinc/53/36/88/1333533688.db2.gz	USEJIPYBOURNRY-MRXNPFEDSA-N	0	3	341.480	3.246	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccsc2)CC1	ZINC000948547196	1333567905	/nfs/dbraw/zinc/56/79/05/1333567905.db2.gz	SPQFAUAFGODQAQ-FGTMMUONSA-N	0	3	330.497	3.188	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2cc(C)nn2C(CC)CC)CC1	ZINC000948570400	1333581138	/nfs/dbraw/zinc/58/11/38/1333581138.db2.gz	KSKKKLGNPXRLMC-GOSISDBHSA-N	0	3	344.503	3.112	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2scnc2C2CCCC2)CC1	ZINC000948589585	1333586841	/nfs/dbraw/zinc/58/68/41/1333586841.db2.gz	CVHSQUHCMQROGO-INIZCTEOSA-N	0	3	345.512	3.360	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N(C)[C@@H]1CCCN(C/C=C\Cl)CC1	ZINC000948852976	1333709807	/nfs/dbraw/zinc/70/98/07/1333709807.db2.gz	ZGDLBNYHRLPNDN-GWNMFIOISA-N	0	3	340.895	3.033	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)[C@H](C)c2ccc(CC)cc2)CC1	ZINC000948861846	1333713121	/nfs/dbraw/zinc/71/31/21/1333713121.db2.gz	UWPAHMXUPFKKGI-YLJYHZDGSA-N	0	3	326.484	3.299	20	30		EGEDHN
N#Cc1cc(C(=O)NC[C@@H]2c3ccccc3CCN2CC2CCC2)c[nH]1	ZINC000948907030	1333728976	/nfs/dbraw/zinc/72/89/76/1333728976.db2.gz	VCYJSYPDRBXYJV-HXUWFJFHSA-N	0	3	348.450	3.016	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@H]1CNC(=O)C1=CCOCC1	ZINC000948909932	1333729861	/nfs/dbraw/zinc/72/98/61/1333729861.db2.gz	DTLSITPVNVGWCN-HXUWFJFHSA-N	0	3	340.467	3.015	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@@H]2c3ccccc3CCN2CCCC)c1	ZINC000948959180	1333748808	/nfs/dbraw/zinc/74/88/08/1333748808.db2.gz	URTJOJOKGZHFSE-OAQYLSRUSA-N	0	3	347.462	3.192	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2c3ccccc3CCN2CCCC)cn1	ZINC000948978410	1333755217	/nfs/dbraw/zinc/75/52/17/1333755217.db2.gz	LVDBTKGVCOWIBF-OAQYLSRUSA-N	0	3	347.462	3.192	20	30		EGEDHN
CC#CCN1CCC2(CC1)CN(C(=O)C1(C)CCCCCC1)CCO2	ZINC000949115265	1333779798	/nfs/dbraw/zinc/77/97/98/1333779798.db2.gz	XJWZMCREDOJTET-UHFFFAOYSA-N	0	3	346.515	3.064	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1(C)CCC(C)CC1)CCO2	ZINC000949250845	1333803980	/nfs/dbraw/zinc/80/39/80/1333803980.db2.gz	AQDRQNBZDLHCFK-UHFFFAOYSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@@H]1CCCC[C@H]1C)CCO2	ZINC000949253865	1333804556	/nfs/dbraw/zinc/80/45/56/1333804556.db2.gz	OYORILXLNNNYOD-MSOLQXFVSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@H]3CC[C@H](C)C3)CC2)C1	ZINC000949486820	1333859645	/nfs/dbraw/zinc/85/96/45/1333859645.db2.gz	IFCJOANKTJMKED-ROUUACIJSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N1CCN(CC2CCCCC2)CC1	ZINC000951595105	1334276479	/nfs/dbraw/zinc/27/64/79/1334276479.db2.gz	VPFCHOYESODQJU-OALUTQOASA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N(CC)C1CN(CC2CCCCCC2)C1	ZINC000953830647	1334860111	/nfs/dbraw/zinc/86/01/11/1334860111.db2.gz	FJRTXQHEHWVWGS-PMACEKPBSA-N	0	3	348.531	3.471	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)C2CCc3ccccc3CC2)C1	ZINC000967054797	1335650622	/nfs/dbraw/zinc/65/06/22/1335650622.db2.gz	CIKHGPHKUHZKTM-UWJYYQICSA-N	0	3	338.495	3.032	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)Cc2cccc(C(F)F)c2)C1	ZINC000967333215	1335703674	/nfs/dbraw/zinc/70/36/74/1335703674.db2.gz	GWOLQJHJHSJMGY-WMLDXEAASA-N	0	3	334.410	3.017	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2ncsc2C(F)(F)F)C1	ZINC000967358554	1335712807	/nfs/dbraw/zinc/71/28/07/1335712807.db2.gz	RYCCIZUWLJRNDN-GHMZBOCLSA-N	0	3	347.406	3.178	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2cnc(CC3CC3)s2)C1	ZINC000967402221	1335727373	/nfs/dbraw/zinc/72/73/73/1335727373.db2.gz	ONOVCNNFTIIUIY-UKRRQHHQSA-N	0	3	333.501	3.112	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2cc3ccc(C)cc3[nH]2)C1	ZINC000967467659	1335750621	/nfs/dbraw/zinc/75/06/21/1335750621.db2.gz	PMCGGYJVJNXBAC-HNAYVOBHSA-N	0	3	325.456	3.493	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2c[nH]nc2-c2ccccc2)C1	ZINC000967553460	1335776058	/nfs/dbraw/zinc/77/60/58/1335776058.db2.gz	APXNRLQHPXLLCO-QAPCUYQASA-N	0	3	338.455	3.093	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)Cc2cc3ccccc3o2)C1	ZINC000967620197	1335794125	/nfs/dbraw/zinc/79/41/25/1335794125.db2.gz	DLQKYHPUJUOPOB-CRAIPNDOSA-N	0	3	326.440	3.378	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2cncc3sccc32)C1	ZINC000967919659	1335830102	/nfs/dbraw/zinc/83/01/02/1335830102.db2.gz	MANJFTJHIPHUPW-CZUORRHYSA-N	0	3	329.469	3.313	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2cc3ccccc3n2C)C1	ZINC000968078253	1335854324	/nfs/dbraw/zinc/85/43/24/1335854324.db2.gz	KFKWFGXQHCOALO-DOTOQJQBSA-N	0	3	325.456	3.195	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccc(F)c(Cl)c2F)C1	ZINC000968216101	1335874103	/nfs/dbraw/zinc/87/41/03/1335874103.db2.gz	ZRRXBFKUNLLZKY-FZMZJTMJSA-N	0	3	340.801	3.082	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccccc2OCC(C)C)C1	ZINC000968430494	1335927576	/nfs/dbraw/zinc/92/75/76/1335927576.db2.gz	CWMCNSKLMSUPQU-MJGOQNOKSA-N	0	3	342.483	3.185	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2c[nH]nc2-c2ccsc2)C1	ZINC000968480542	1335936888	/nfs/dbraw/zinc/93/68/88/1335936888.db2.gz	NTGMZQBQTZGHAF-CZUORRHYSA-N	0	3	344.484	3.155	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2coc(C3CCCC3)n2)C1	ZINC000968486865	1335937775	/nfs/dbraw/zinc/93/77/75/1335937775.db2.gz	AOKHCYWEVKEYFM-GOEBONIOSA-N	0	3	331.460	3.349	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)Cc2c[nH]c3cccc(C)c23)C1	ZINC000968544880	1335958512	/nfs/dbraw/zinc/95/85/12/1335958512.db2.gz	VZIDRSSVZHIJRL-HNAYVOBHSA-N	0	3	339.483	3.422	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2cc(F)c(F)c(F)c2F)C1	ZINC000968568763	1335962749	/nfs/dbraw/zinc/96/27/49/1335962749.db2.gz	CJJKZEIYBNNIBU-GWCFXTLKSA-N	0	3	344.352	3.259	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2ccc(C(F)(F)F)cc2)C1	ZINC000968580539	1335970861	/nfs/dbraw/zinc/97/08/61/1335970861.db2.gz	WGWBPCZLWQEXAD-XJKSGUPXSA-N	0	3	338.373	3.169	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@@H]1CN(Cc2ccccc2)CC[C@H]1C	ZINC000968592094	1335976285	/nfs/dbraw/zinc/97/62/85/1335976285.db2.gz	KKFBPNFCWJSLCF-XMSQKQJNSA-N	0	3	346.474	3.237	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2csc3c2CCCC3)C1	ZINC000968620747	1335986111	/nfs/dbraw/zinc/98/61/11/1335986111.db2.gz	YVTIYASUWSZIIT-RHSMWYFYSA-N	0	3	330.497	3.090	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)C(C)(C)c2ccc(OC)cc2)C1	ZINC000968665021	1336001866	/nfs/dbraw/zinc/00/18/66/1336001866.db2.gz	LVUJJERDROTULE-APWZRJJASA-N	0	3	344.499	3.376	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)C23CC(C(F)(F)F)(C2)C3)C1	ZINC000968681412	1336008627	/nfs/dbraw/zinc/00/86/27/1336008627.db2.gz	JCKFQNXSOWOYES-SQHUISNBSA-N	0	3	330.394	3.122	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)C2(c3ccccc3OC)CC2)C1	ZINC000968706587	1336018781	/nfs/dbraw/zinc/01/87/81/1336018781.db2.gz	RNEQXDWUUZLNHA-SJLPKXTDSA-N	0	3	342.483	3.130	20	30		EGEDHN
C[C@@]1(C(=O)N2CC[C@@H](NCc3ccc(F)c(C#N)c3)C2)CC=CCC1	ZINC000968783407	1336049253	/nfs/dbraw/zinc/04/92/53/1336049253.db2.gz	XHZJIRXVEWGYSO-YLJYHZDGSA-N	0	3	341.430	3.134	20	30		EGEDHN
N#Cc1ccc(CN2CCCCC[C@H]2CNC(=O)[C@H]2CC2(F)F)cc1	ZINC000968853862	1336068184	/nfs/dbraw/zinc/06/81/84/1336068184.db2.gz	SICLHYXMRUAJGP-DLBZAZTESA-N	0	3	347.409	3.074	20	30		EGEDHN
C#CCCN1CCCCC[C@@H]1CNC(=O)c1sc(Cl)nc1C	ZINC000968876930	1336076086	/nfs/dbraw/zinc/07/60/86/1336076086.db2.gz	KRMQVXUVAFDTBH-CYBMUJFWSA-N	0	3	339.892	3.103	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1coc(Br)c1	ZINC000968882431	1336079324	/nfs/dbraw/zinc/07/93/24/1336079324.db2.gz	NQRQZKWVVXHQPN-ZDUSSCGKSA-N	0	3	341.249	3.203	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1nccc2ccccc21	ZINC000969008449	1336116509	/nfs/dbraw/zinc/11/65/09/1336116509.db2.gz	RUNJQQCJSZWAEQ-GOSISDBHSA-N	0	3	335.451	3.233	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1noc2c1CCCC2	ZINC000969044040	1336124985	/nfs/dbraw/zinc/12/49/85/1336124985.db2.gz	GCVSRZVRAPHTJE-OAHLLOKOSA-N	0	3	331.460	3.104	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1coc(C2CCC2)n1	ZINC000969106060	1336146243	/nfs/dbraw/zinc/14/62/43/1336146243.db2.gz	SETOKLXPZRUAOO-INIZCTEOSA-N	0	3	331.460	3.493	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cnn(CCCC)c1C	ZINC000969109211	1336147576	/nfs/dbraw/zinc/14/75/76/1336147576.db2.gz	XPYGUOVOESICOJ-QGZVFWFLSA-N	0	3	332.492	3.152	20	30		EGEDHN
C#CCN1CCCCC[C@@H]1CNC(=O)c1cc(C)nc2ccccc21	ZINC000969133784	1336155488	/nfs/dbraw/zinc/15/54/88/1336155488.db2.gz	SJRPPFNLRNAPMR-QGZVFWFLSA-N	0	3	335.451	3.151	20	30		EGEDHN
C#CCCN1CCCCC[C@H]1CNC(=O)c1sc(CCC)nc1C	ZINC000969144940	1336160960	/nfs/dbraw/zinc/16/09/60/1336160960.db2.gz	XFEOWLXZKGHABR-INIZCTEOSA-N	0	3	347.528	3.402	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cc(OC)c(OC)cc1C	ZINC000969151203	1336163603	/nfs/dbraw/zinc/16/36/03/1336163603.db2.gz	SOZMXTSGDGDPKD-MRXNPFEDSA-N	0	3	346.471	3.173	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1cccc2oc(C)nc21	ZINC000969158180	1336165887	/nfs/dbraw/zinc/16/58/87/1336165887.db2.gz	DJPNSPSXDBKMEA-INIZCTEOSA-N	0	3	339.439	3.134	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](NCc2cn(C(C)C)nc2C)C1	ZINC000969564545	1336224525	/nfs/dbraw/zinc/22/45/25/1336224525.db2.gz	VHHQCVGJCZNLTK-QGZVFWFLSA-N	0	3	332.492	3.065	20	30		EGEDHN
C#CCCN1CC([C@H](C)NC(=O)c2ccc(-c3ccco3)s2)C1	ZINC000970673504	1336331929	/nfs/dbraw/zinc/33/19/29/1336331929.db2.gz	RVTHPNVHVZVFBS-ZDUSSCGKSA-N	0	3	328.437	3.082	20	30		EGEDHN
C#CCCN1CC([C@@H](C)NC(=O)c2ccc(Cl)c3occc32)C1	ZINC000970727506	1336335926	/nfs/dbraw/zinc/33/59/26/1336335926.db2.gz	YXAUVQKVJTXWNU-GFCCVEGCSA-N	0	3	330.815	3.160	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCN(C(=O)C2=CCCCCC2)C1	ZINC000971403249	1336341809	/nfs/dbraw/zinc/34/18/09/1336341809.db2.gz	GYPXZZGBFMUVJW-FQEVSTJZSA-N	0	3	337.467	3.481	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)[C@H]2CCC[C@@H](C(F)(F)F)C2)CC1	ZINC001005637988	1336386602	/nfs/dbraw/zinc/38/66/02/1336386602.db2.gz	JSCXHBQFPKLHNK-UONOGXRCSA-N	0	3	332.410	3.464	20	30		EGEDHN
CN(C(=O)[C@H]1C[C@H]2C[C@H]2C1)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001005859194	1336411427	/nfs/dbraw/zinc/41/14/27/1336411427.db2.gz	CAIYQVZYGOAXFV-BWTSREIZSA-N	0	3	337.467	3.027	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2ccc(C(F)F)cc2F)CC1	ZINC001006184773	1336464017	/nfs/dbraw/zinc/46/40/17/1336464017.db2.gz	TYOXLCCEDXYXGT-UHFFFAOYSA-N	0	3	326.362	3.486	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2coc(-c3ccccc3)n2)CC1	ZINC001006304754	1336486957	/nfs/dbraw/zinc/48/69/57/1336486957.db2.gz	DOLBAOFWNDDCEG-UHFFFAOYSA-N	0	3	325.412	3.064	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2ccnc(-c3ccco3)c2)C1	ZINC001007571829	1336670119	/nfs/dbraw/zinc/67/01/19/1336670119.db2.gz	TWNXDFXWEDQZCU-INIZCTEOSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2cc(-c3ccccc3)no2)C1	ZINC001007751080	1336695072	/nfs/dbraw/zinc/69/50/72/1336695072.db2.gz	CKPGHGBXSHXUFQ-INIZCTEOSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N[C@@H]1CCCN(CC2=CCCCC2)C1	ZINC001008795752	1336926975	/nfs/dbraw/zinc/92/69/75/1336926975.db2.gz	RTEVYRWPHGAGIU-AABGKKOBSA-N	0	3	346.515	3.439	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2cnn(C3CCCC3)c2C)C1	ZINC001009140536	1336975255	/nfs/dbraw/zinc/97/52/55/1336975255.db2.gz	QHSXFORUZWLIBB-INIZCTEOSA-N	0	3	330.476	3.077	20	30		EGEDHN
C=C(C)CCN1CCC[C@H](NC(=O)c2cc3nc(C)ccc3o2)C1	ZINC001009294155	1336999322	/nfs/dbraw/zinc/99/93/22/1336999322.db2.gz	BMRZVAHCGLWWSY-HNNXBMFYSA-N	0	3	327.428	3.297	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CCN([C@@H](C)c3cc(C)ccc3C)C2)c1	ZINC001015680304	1338255297	/nfs/dbraw/zinc/25/52/97/1338255297.db2.gz	ZUHIUGSRJKSXMC-FXAWDEMLSA-N	0	3	347.462	3.245	20	30		EGEDHN
C#CCCN1CC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc3ccccc3c2)C1	ZINC001015873556	1338343517	/nfs/dbraw/zinc/34/35/17/1338343517.db2.gz	YUCRBAYIOVSIPD-QHAWAJNXSA-N	0	3	332.447	3.157	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H]2CC23CCN(Cc2cccc(C#N)c2)CC3)o1	ZINC001016492782	1338624408	/nfs/dbraw/zinc/62/44/08/1338624408.db2.gz	YBNVYRIDBPCMQJ-LJQANCHMSA-N	0	3	349.434	3.244	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)C[C@@H]2C[C@H]2c2ccccc2)CC1	ZINC001016627007	1338668387	/nfs/dbraw/zinc/66/83/87/1338668387.db2.gz	IDEBHXHIUHPUKN-SLFFLAALSA-N	0	3	336.479	3.174	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CC12CCN(C[C@@H](F)CC)CC2	ZINC001016660689	1338681488	/nfs/dbraw/zinc/68/14/88/1338681488.db2.gz	ALCXIEMKHDUSSN-RDJZCZTQSA-N	0	3	333.451	3.007	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2cc(C3CC3)oc2C2CC2)CC1	ZINC001016743848	1338709649	/nfs/dbraw/zinc/70/96/49/1338709649.db2.gz	SMZCHZACWHLAKN-SFHVURJKSA-N	0	3	338.451	3.252	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CC23CCN(C[C@@H](F)CC)CC3)cc1	ZINC001016760719	1338715257	/nfs/dbraw/zinc/71/52/57/1338715257.db2.gz	CIRQOJOIVGLKHI-ROUUACIJSA-N	0	3	328.431	3.000	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cc3cc(F)ccc3o2)CC1	ZINC001016860437	1338750324	/nfs/dbraw/zinc/75/03/24/1338750324.db2.gz	QRRNMDPXTOUSMA-GOSISDBHSA-N	0	3	340.398	3.180	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cccc(C(F)F)c2)CC1	ZINC001016941843	1338778061	/nfs/dbraw/zinc/77/80/61/1338778061.db2.gz	VANKRGNVLLKVST-MRXNPFEDSA-N	0	3	332.394	3.232	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(OC(C)C)cc2)CC1	ZINC001016957738	1338784409	/nfs/dbraw/zinc/78/44/09/1338784409.db2.gz	CQJDJVHCNWDKFJ-IBGZPJMESA-N	0	3	340.467	3.081	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)C2(c3ccccc3)CCCC2)CC1	ZINC001016962408	1338785470	/nfs/dbraw/zinc/78/54/70/1338785470.db2.gz	YRUNQCAEDFWGAM-IBGZPJMESA-N	0	3	336.479	3.102	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](CN(C)Cc2ncccc2C)C1	ZINC001017179809	1338923432	/nfs/dbraw/zinc/92/34/32/1338923432.db2.gz	PDMGYOIKNHDIDB-QGZVFWFLSA-N	0	3	329.488	3.273	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](CN(C)Cc2cncc(F)c2)C1	ZINC001017181208	1338925299	/nfs/dbraw/zinc/92/52/99/1338925299.db2.gz	YNIHERRVJWPFEP-OAHLLOKOSA-N	0	3	333.451	3.103	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cnc2n1[C@H](C)CCC2	ZINC001017573883	1339369311	/nfs/dbraw/zinc/36/93/11/1339369311.db2.gz	WHLFWHHMBCPZBW-ZACQAIPSSA-N	0	3	342.487	3.035	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1n[nH]c(C2CC2)c1Cl	ZINC001017704030	1339395339	/nfs/dbraw/zinc/39/53/39/1339395339.db2.gz	NBKJXUOWECVVBH-OKILXGFUSA-N	0	3	348.878	3.196	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CCCC(F)(F)C1	ZINC001017931842	1339457619	/nfs/dbraw/zinc/45/76/19/1339457619.db2.gz	WFZYFXFWWUZRMK-OAGGEKHMSA-N	0	3	326.431	3.453	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2cccnc2c1	ZINC001018076541	1339497305	/nfs/dbraw/zinc/49/73/05/1339497305.db2.gz	IZKREDVKHZXWSL-KDURUIRLSA-N	0	3	335.451	3.490	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2cnccc2c1	ZINC001018143127	1339512730	/nfs/dbraw/zinc/51/27/30/1339512730.db2.gz	BBYFLZZESAJEIN-BGYRXZFFSA-N	0	3	335.451	3.490	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H](C)c1ccccc1OC	ZINC001018186563	1339525156	/nfs/dbraw/zinc/52/51/56/1339525156.db2.gz	FGWACPONZSRVDF-KURKYZTESA-N	0	3	342.483	3.440	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)CCc1cccc(OCC)c1	ZINC001018325943	1339578084	/nfs/dbraw/zinc/57/80/84/1339578084.db2.gz	YILXNMXQZOPKKA-KDURUIRLSA-N	0	3	342.483	3.269	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)[C@@H]3CCCC4(CC4)C3)C2)s1	ZINC001018843106	1339736945	/nfs/dbraw/zinc/73/69/45/1339736945.db2.gz	IZDQDFJQDBVEIW-CABCVRRESA-N	0	3	343.496	3.281	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@H](NCc2ccnc(Cl)c2)C1	ZINC001018909814	1339750784	/nfs/dbraw/zinc/75/07/84/1339750784.db2.gz	FDORBBQEUITOGH-ZDUSSCGKSA-N	0	3	342.270	3.204	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1ccc(F)c2ccncc12	ZINC001028093998	1340422369	/nfs/dbraw/zinc/42/23/69/1340422369.db2.gz	LQOZFFTXTKBLTP-CQSZACIVSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1ccccc1OCC(C)C	ZINC001028204425	1340483045	/nfs/dbraw/zinc/48/30/45/1340483045.db2.gz	UOWJFKCXZJUOHK-QGZVFWFLSA-N	0	3	330.472	3.492	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCCN2Cc2cccc(CC)c2)nc1	ZINC001028269568	1340523769	/nfs/dbraw/zinc/52/37/69/1340523769.db2.gz	QSRDTKSFZMNIGF-FQEVSTJZSA-N	0	3	347.462	3.020	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCCN2[C@@H](C)c2ccccc2)nc1	ZINC001028271323	1340524720	/nfs/dbraw/zinc/52/47/20/1340524720.db2.gz	FBHPNDVVYASYSS-LPHOPBHVSA-N	0	3	333.435	3.018	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCCN2Cc2cc(C)cc(C)c2)cn1	ZINC001028270911	1340524911	/nfs/dbraw/zinc/52/49/11/1340524911.db2.gz	VVKLZUSGNDHKSO-OAQYLSRUSA-N	0	3	347.462	3.074	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCCN2Cc2ccc(CC)cc2)nc1	ZINC001028272313	1340526206	/nfs/dbraw/zinc/52/62/06/1340526206.db2.gz	SUVNJXAKWZIYIH-HXUWFJFHSA-N	0	3	347.462	3.020	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1ccc(OCC(C)C)cc1	ZINC001028302394	1340551466	/nfs/dbraw/zinc/55/14/66/1340551466.db2.gz	ATBLAESCLIGUPP-GOSISDBHSA-N	0	3	330.472	3.492	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1cccc(OCC(C)C)c1	ZINC001028305729	1340555169	/nfs/dbraw/zinc/55/51/69/1340555169.db2.gz	WTTQISMXDRDTEP-SFHVURJKSA-N	0	3	330.472	3.492	20	30		EGEDHN
Cc1cc(C(=O)NC[C@H]2CCN(Cc3cccc(C#N)c3)C2)oc1C	ZINC001028478928	1340665071	/nfs/dbraw/zinc/66/50/71/1340665071.db2.gz	WCYBJCNJKPEMNU-GOSISDBHSA-N	0	3	337.423	3.020	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCN(Cc3ccccc3F)C2)cc1	ZINC001028730730	1340779184	/nfs/dbraw/zinc/77/91/84/1340779184.db2.gz	PNHZWNLQLDPZDY-QGZVFWFLSA-N	0	3	336.410	3.059	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H](CNC(=O)c3ccoc3C3CC3)C2)c1	ZINC001028761903	1340797146	/nfs/dbraw/zinc/79/71/46/1340797146.db2.gz	BNKSXYLLDMBQJV-QGZVFWFLSA-N	0	3	349.434	3.281	20	30		EGEDHN
CCc1ccc(C(=O)NC[C@H]2CCN(Cc3ccc(C#N)cc3)C2)cc1	ZINC001028966053	1340895313	/nfs/dbraw/zinc/89/53/13/1340895313.db2.gz	RYGANHLJCPQOJX-HXUWFJFHSA-N	0	3	347.462	3.373	20	30		EGEDHN
CC(C)C(=O)N1CCC([C@@H](C)NCc2cc(F)ccc2C#N)CC1	ZINC001029053794	1340919924	/nfs/dbraw/zinc/91/99/24/1340919924.db2.gz	ZYPDQXMLGVDKGP-CQSZACIVSA-N	0	3	331.435	3.070	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC([C@H](C)NCc2cc(OC)no2)CC1	ZINC001029124625	1340935872	/nfs/dbraw/zinc/93/58/72/1340935872.db2.gz	AJFPBXDXUGOOJD-AWEZNQCLSA-N	0	3	349.475	3.002	20	30		EGEDHN
C[C@H](C#N)C(=O)N1C[C@H]2CC[C@@H](C1)N2[C@H]1CCc2ccc(Cl)cc21	ZINC001029244778	1340960725	/nfs/dbraw/zinc/96/07/25/1340960725.db2.gz	LPPQPAPCONZVEH-ANRZDRKOSA-N	0	3	343.858	3.162	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1C[C@H]2CC[C@@H](C1)N2CCCC	ZINC001029364541	1340978208	/nfs/dbraw/zinc/97/82/08/1340978208.db2.gz	CWMIVAPHUCAPGB-CALCHBBNSA-N	0	3	328.456	3.340	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1C[C@H]2CC[C@@H](C1)N2CC[C@H](C)F	ZINC001029364902	1340978249	/nfs/dbraw/zinc/97/82/49/1340978249.db2.gz	POSNNXMVCSWWKV-YESZJQIVSA-N	0	3	346.446	3.288	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CC[C@@H](C1)N2CCCC1CCOCC1	ZINC001029454300	1340993576	/nfs/dbraw/zinc/99/35/76/1340993576.db2.gz	YDLNVWAPLLTIOI-ZVDOUQERSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C[C@@H](C(=O)N1C[C@H]2CC[C@@H](C1)N2CC[C@H](C)F)c1ccccc1	ZINC001029594665	1341018234	/nfs/dbraw/zinc/01/82/34/1341018234.db2.gz	UCPRTJNWXCSSRV-GDAAHCPNSA-N	0	3	330.447	3.380	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCN(C(=O)C2(C)CCCC2)C1	ZINC001029794416	1341075228	/nfs/dbraw/zinc/07/52/28/1341075228.db2.gz	CNRDTJKTIVKOPZ-OAHLLOKOSA-N	0	3	345.512	3.480	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](CN(C)Cc2cnc(C)s2)C1	ZINC001029798005	1341076340	/nfs/dbraw/zinc/07/63/40/1341076340.db2.gz	FBTVFBCSGNFAMU-OAHLLOKOSA-N	0	3	335.517	3.334	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCN(C(=O)[C@]2(C)C=CCC2)C1	ZINC001029806463	1341080054	/nfs/dbraw/zinc/08/00/54/1341080054.db2.gz	LNRJATOXIQRHQR-HNAYVOBHSA-N	0	3	343.496	3.256	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC(CN(C)Cc2conc2C)CC1	ZINC001029991260	1341148787	/nfs/dbraw/zinc/14/87/87/1341148787.db2.gz	WJBABAFEYCUEPM-LJQANCHMSA-N	0	3	333.476	3.256	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC(CN(C)Cc2ocnc2C)CC1	ZINC001029992382	1341149350	/nfs/dbraw/zinc/14/93/50/1341149350.db2.gz	VZZYBIOSFQVAAO-IBGZPJMESA-N	0	3	333.476	3.256	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC(CN(C)Cc3c(C)noc3C)CC2)C1	ZINC001029993558	1341150102	/nfs/dbraw/zinc/15/01/02/1341150102.db2.gz	IXIBFCNRSXDSFX-UHFFFAOYSA-N	0	3	345.487	3.318	20	30		EGEDHN
Cc1coc(C)c1C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001072689641	1355389863	/nfs/dbraw/zinc/38/98/63/1355389863.db2.gz	HABZDWRWRCBYCL-UHFFFAOYSA-N	0	3	349.434	3.116	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cc2c([nH]1)c(F)ccc2C	ZINC001032486770	1341520943	/nfs/dbraw/zinc/52/09/43/1341520943.db2.gz	ZAMVVSPEQSNNSW-GJZGRUSLSA-N	0	3	341.430	3.480	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1C[C@@H]2C[C@H]1CN2CCC(=C)C	ZINC001032484695	1341521085	/nfs/dbraw/zinc/52/10/85/1341521085.db2.gz	WRWNDJUIQSWAJG-IRXDYDNUSA-N	0	3	326.440	3.116	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cc(C)nn1C(CC)CC	ZINC001032489290	1341522449	/nfs/dbraw/zinc/52/24/49/1341522449.db2.gz	ZGNPLOJSBNACHO-ROUUACIJSA-N	0	3	344.503	3.418	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H](c1ccncc1)C(C)C	ZINC001032587286	1341549686	/nfs/dbraw/zinc/54/96/86/1341549686.db2.gz	SUGZFUOVJKLXJC-FHWLQOOXSA-N	0	3	327.472	3.073	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(C2CC2)nc1C	ZINC001032632641	1341565156	/nfs/dbraw/zinc/56/51/56/1341565156.db2.gz	DDDSEGDTFVOCLV-IRXDYDNUSA-N	0	3	325.456	3.132	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1c[nH]c2c1cccc2C	ZINC001032662533	1341574596	/nfs/dbraw/zinc/57/45/96/1341574596.db2.gz	RIQGJECXMSUWTL-ROUUACIJSA-N	0	3	337.467	3.270	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC001032672202	1341577793	/nfs/dbraw/zinc/57/77/93/1341577793.db2.gz	PTGSMCDIYCIOJV-QGZVKYPTSA-N	0	3	340.467	3.050	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C1(Cc2ccccc2F)CC1	ZINC001032673005	1341578465	/nfs/dbraw/zinc/57/84/65/1341578465.db2.gz	VCIZMGCIMCAEKN-ROUUACIJSA-N	0	3	342.458	3.400	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1C[C@@H]2C[C@H]1CN2CC1CC2(CCC2)C1	ZINC001032753798	1341602874	/nfs/dbraw/zinc/60/28/74/1341602874.db2.gz	MUYAYRDRSGXXHP-SFTDATJTSA-N	0	3	348.490	3.076	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@]1(C)CCc2ccccc2C1	ZINC001032824156	1341627820	/nfs/dbraw/zinc/62/78/20/1341627820.db2.gz	SFANAFMSIVYCRS-ONTIZHBOSA-N	0	3	338.495	3.433	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)Cc2c(C)[nH]c3ccccc32)C1	ZINC001033386875	1341807232	/nfs/dbraw/zinc/80/72/32/1341807232.db2.gz	FKIGEULDOVBJOX-INIZCTEOSA-N	0	3	325.456	3.128	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@H]2CCN(CCOc3ccccc3C)C2)C1	ZINC001033394590	1341811313	/nfs/dbraw/zinc/81/13/13/1341811313.db2.gz	WYPJVDKVEWEORC-SFHVURJKSA-N	0	3	342.483	3.263	20	30		EGEDHN
C#Cc1cncc(C(=O)N(C)[C@@H]2CCN(Cc3ccc(C)c(C)c3)C2)c1	ZINC001033406350	1341816852	/nfs/dbraw/zinc/81/68/52/1341816852.db2.gz	VPRBMBQRAGMJJI-OAQYLSRUSA-N	0	3	347.462	3.026	20	30		EGEDHN
C=CCCN1CC[C@H](N(C)C(=O)c2cnc(-c3ccco3)s2)C1	ZINC001033600065	1341891555	/nfs/dbraw/zinc/89/15/55/1341891555.db2.gz	XQJIRMUODOPFOP-ZDUSSCGKSA-N	0	3	331.441	3.126	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cccc(NC(=O)CC)c2)C1	ZINC001033847860	1342042880	/nfs/dbraw/zinc/04/28/80/1342042880.db2.gz	ZDXJUPWBNOAWNP-SFHVURJKSA-N	0	3	343.471	3.148	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@@H]2CCOc3c(F)cccc32)C1	ZINC001033893026	1342066006	/nfs/dbraw/zinc/06/60/06/1342066006.db2.gz	QPFGQQAFJPYCSY-NVXWUHKLSA-N	0	3	346.446	3.191	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](N(CC)C(=O)c2ncc(Cl)s2)C1	ZINC001033896259	1342068111	/nfs/dbraw/zinc/06/81/11/1342068111.db2.gz	HCLOBSHJDCAFFA-GFCCVEGCSA-N	0	3	327.881	3.299	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cnc3c(F)cccc3c2)C1	ZINC001033896129	1342068478	/nfs/dbraw/zinc/06/84/78/1342068478.db2.gz	ATKXHDBDIWCOFO-KRWDZBQOSA-N	0	3	341.430	3.486	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@@H]2CCc3cc(C)ccc3O2)C1	ZINC001033900952	1342073589	/nfs/dbraw/zinc/07/35/89/1342073589.db2.gz	NMHYNQOUHZKUPK-QUCCMNQESA-N	0	3	342.483	3.188	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccc3c(c2)[C@@H](C)CO3)C1	ZINC001033931204	1342094562	/nfs/dbraw/zinc/09/45/62/1342094562.db2.gz	DEDKKRZKTWHOKX-RDJZCZTQSA-N	0	3	328.456	3.295	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cncc3sccc32)C1	ZINC001033932457	1342097184	/nfs/dbraw/zinc/09/71/84/1342097184.db2.gz	OBOCUUFFORZTDP-CQSZACIVSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccc(F)c(COC)c2)C1	ZINC001033946853	1342107489	/nfs/dbraw/zinc/10/74/89/1342107489.db2.gz	JXCPTRVZNQYMNW-QGZVFWFLSA-N	0	3	334.435	3.085	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@H]2CCCc3sc(C)nc32)C1	ZINC001034015196	1342151638	/nfs/dbraw/zinc/15/16/38/1342151638.db2.gz	MAEYDDXOKZYIKE-HOTGVXAUSA-N	0	3	347.528	3.370	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cccc(NC(C)=O)c2C)C1	ZINC001034018830	1342156174	/nfs/dbraw/zinc/15/61/74/1342156174.db2.gz	JQCNRZRTIIEXGC-QGZVFWFLSA-N	0	3	343.471	3.066	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2cc(F)c(F)cc2Cl)C1	ZINC001034031710	1342170654	/nfs/dbraw/zinc/17/06/54/1342170654.db2.gz	FNRYVVQYRFFOBT-LBPRGKRZSA-N	0	3	340.801	3.178	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2csc3c2CC[C@@H](C)C3)C1	ZINC001034032630	1342171348	/nfs/dbraw/zinc/17/13/48/1342171348.db2.gz	UKSCTMUSTQELGU-HZPDHXFCSA-N	0	3	344.524	3.433	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cc(-c3ccc(C)o3)n[nH]2)C1	ZINC001034043527	1342184760	/nfs/dbraw/zinc/18/47/60/1342184760.db2.gz	WHNONONPJUFWOO-OAHLLOKOSA-N	0	3	342.443	3.091	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cc(Cl)cc3c2OCC3)C1	ZINC001034047691	1342187556	/nfs/dbraw/zinc/18/75/56/1342187556.db2.gz	KJWUCAOWMKXCBU-INIZCTEOSA-N	0	3	348.874	3.387	20	30		EGEDHN
Cc1cc(CN2CCCC[C@@H](NC(=O)c3c[nH]c(C#N)c3)C2)cs1	ZINC001034171592	1342293647	/nfs/dbraw/zinc/29/36/47/1342293647.db2.gz	VBYAMFSJNKBYJH-MRXNPFEDSA-N	0	3	342.468	3.041	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc3cc(C)cn3c2)C1	ZINC001034236328	1342338307	/nfs/dbraw/zinc/33/83/07/1342338307.db2.gz	IWBLSTYMYUDUPF-GOSISDBHSA-N	0	3	325.456	3.408	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CCCCN(Cc2ccccc2)C1	ZINC001034246438	1342343779	/nfs/dbraw/zinc/34/37/79/1342343779.db2.gz	DJLPPXNKJYNZAF-LJQANCHMSA-N	0	3	337.467	3.459	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)C2([C@H]3CCCCO3)CCC2)C1	ZINC001034305537	1342388671	/nfs/dbraw/zinc/38/86/71/1342388671.db2.gz	ABFLCZUVLHBRSM-QZTJIDSGSA-N	0	3	334.504	3.273	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCCCN(CCOC3CCC3)C2)CC1	ZINC001034381595	1342450215	/nfs/dbraw/zinc/45/02/15/1342450215.db2.gz	OMTVEBHHVJYYFX-GOSISDBHSA-N	0	3	334.504	3.273	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2ccc(C(C)C)nc2C)C1	ZINC001034403704	1342468428	/nfs/dbraw/zinc/46/84/28/1342468428.db2.gz	AGSHPDXEWBKFFB-QGZVFWFLSA-N	0	3	327.472	3.121	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cc(-c3cccs3)n[nH]2)C1	ZINC001034407755	1342470182	/nfs/dbraw/zinc/47/01/82/1342470182.db2.gz	DYKYQHFPOTWEMF-AWEZNQCLSA-N	0	3	344.484	3.299	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cccnc2C(F)(F)F)C1	ZINC001034414357	1342475702	/nfs/dbraw/zinc/47/57/02/1342475702.db2.gz	YPWFDVBZJXUSLI-ZDUSSCGKSA-N	0	3	341.377	3.261	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc(OC)cc2)C1	ZINC001034435010	1342497264	/nfs/dbraw/zinc/49/72/64/1342497264.db2.gz	CYUPOPNRPBHKRI-YZGWKJHDSA-N	0	3	342.483	3.346	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cccc(C(F)(F)F)n2)C1	ZINC001034460793	1342517547	/nfs/dbraw/zinc/51/75/47/1342517547.db2.gz	KMPMOYCGNNPOQA-ZDUSSCGKSA-N	0	3	341.377	3.261	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)c2ccc3nc(C)sc3c2)C1	ZINC001034471159	1342525418	/nfs/dbraw/zinc/52/54/18/1342525418.db2.gz	FKDIMJOEPAZGBO-OAHLLOKOSA-N	0	3	329.469	3.375	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccoc2Br)C1	ZINC001034474840	1342529555	/nfs/dbraw/zinc/52/95/55/1342529555.db2.gz	SEOOQELHAHWRAC-LBPRGKRZSA-N	0	3	341.249	3.203	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2ccccc2OC(C)C)C1	ZINC001034496052	1342552183	/nfs/dbraw/zinc/55/21/83/1342552183.db2.gz	ALJDFFKZXGEIJS-QGZVFWFLSA-N	0	3	328.456	3.081	20	30		EGEDHN
CC(C)(C)C(=O)N[C@@H]1CCCCN(Cc2ccc(OCC#N)cc2)C1	ZINC001034496857	1342553799	/nfs/dbraw/zinc/55/37/99/1342553799.db2.gz	XZDSMAMCHRZLQY-QGZVFWFLSA-N	0	3	343.471	3.106	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc(N(C)C)c(F)c2)C1	ZINC001034542219	1342602647	/nfs/dbraw/zinc/60/26/47/1342602647.db2.gz	VLGXVFSXDPLLEF-INIZCTEOSA-N	0	3	333.451	3.052	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)[C@@]2(C)CCc3ccccc3C2)C1	ZINC001034556820	1342617861	/nfs/dbraw/zinc/61/78/61/1342617861.db2.gz	IREYSGOHGOEMAF-FPOVZHCZSA-N	0	3	326.484	3.338	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)Cc2c(C)oc3ccccc32)C1	ZINC001034566022	1342619968	/nfs/dbraw/zinc/61/99/68/1342619968.db2.gz	UIEIFFFSMLAEND-INIZCTEOSA-N	0	3	326.440	3.440	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1CC[C@H](NC(=O)C[C@@H]2C=CCC2)CC1	ZINC001034589625	1342634477	/nfs/dbraw/zinc/63/44/77/1342634477.db2.gz	MEGVISFHFBRKAE-NSISKUIASA-N	0	3	337.467	3.432	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CC[C@H](NCc3conc3C)CC2)CC1	ZINC001034724620	1342717818	/nfs/dbraw/zinc/71/78/18/1342717818.db2.gz	PMDKKWNFUPMTRB-IYARVYRRSA-N	0	3	331.460	3.246	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)NCc1ccc(CNCc2ccc(C#N)cc2)cc1	ZINC001034807291	1342772666	/nfs/dbraw/zinc/77/26/66/1342772666.db2.gz	ODLRDTFGDSJOTF-FOIQADDNSA-N	0	3	333.435	3.120	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)Cc2cccc(OC)c2)C12CCC2	ZINC001078797683	1357090061	/nfs/dbraw/zinc/09/00/61/1357090061.db2.gz	LCVHKOOTGSCOBN-DLBZAZTESA-N	0	3	348.874	3.007	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC[C@@H]1CNCc1ncccc1C	ZINC001034947672	1342849207	/nfs/dbraw/zinc/84/92/07/1342849207.db2.gz	UXTXGXSWAUVRPZ-OAHLLOKOSA-N	0	3	335.879	3.249	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)s1	ZINC001035012085	1342875393	/nfs/dbraw/zinc/87/53/93/1342875393.db2.gz	QUJPCVZAMODYTB-CQSZACIVSA-N	0	3	331.485	3.303	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H]1CNCc1cn(C(C)C)nc1C	ZINC001035036614	1342890548	/nfs/dbraw/zinc/89/05/48/1342890548.db2.gz	COBCNFBDDXHXIV-QUCCMNQESA-N	0	3	346.519	3.455	20	30		EGEDHN
CC(C)=CC(=O)N1CCC2(CCN(Cc3ccccc3C#N)C2)CC1	ZINC001035154643	1342968788	/nfs/dbraw/zinc/96/87/88/1342968788.db2.gz	WSCDUCONFXKGCI-UHFFFAOYSA-N	0	3	337.467	3.339	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC2(CN(Cc3ccc(C4CC4)cc3)C2)CC1	ZINC001035701460	1343143008	/nfs/dbraw/zinc/14/30/08/1343143008.db2.gz	ZLLYZEWEGJERGV-UHFFFAOYSA-N	0	3	348.490	3.402	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc(N(C)C)cc1F)CC2	ZINC001035721007	1343151819	/nfs/dbraw/zinc/15/18/19/1343151819.db2.gz	UDZYACPZKKOQOD-UHFFFAOYSA-N	0	3	345.462	3.006	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C[C@@H](C)c1c(C)n[nH]c1C)CC2	ZINC001035735535	1343161364	/nfs/dbraw/zinc/16/13/64/1343161364.db2.gz	HPDJENQUOODDKZ-OAHLLOKOSA-N	0	3	344.503	3.021	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc(C)n([C@@H](C)CC)n1)CC2	ZINC001035738455	1343162674	/nfs/dbraw/zinc/16/26/74/1343162674.db2.gz	BMKLEDBIGIITIN-INIZCTEOSA-N	0	3	344.503	3.277	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cccnc1C1CC1)CC2	ZINC001035745434	1343165696	/nfs/dbraw/zinc/16/56/96/1343165696.db2.gz	WOMWCRUYIQLARC-UHFFFAOYSA-N	0	3	325.456	3.073	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cncc3sccc31)CC2	ZINC001035775362	1343186180	/nfs/dbraw/zinc/18/61/80/1343186180.db2.gz	VBCDPRQNKRCUQR-UHFFFAOYSA-N	0	3	341.480	3.410	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cc1csc(C3CC3)n1)CC2	ZINC001035811676	1343211246	/nfs/dbraw/zinc/21/12/46/1343211246.db2.gz	LCHQFANYZCPSTD-UHFFFAOYSA-N	0	3	345.512	3.064	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cc(CC)c(C)s1)CC2	ZINC001035850344	1343230244	/nfs/dbraw/zinc/23/02/44/1343230244.db2.gz	YPVPREPEDAHMCM-UHFFFAOYSA-N	0	3	330.497	3.180	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)C(C)(C)c1ccccc1C)CC2	ZINC001035866538	1343239575	/nfs/dbraw/zinc/23/95/75/1343239575.db2.gz	QRYVQLRUVQEYFZ-UHFFFAOYSA-N	0	3	338.495	3.220	20	30		EGEDHN
C[C@H]1CN(C(=O)C2CCCC2)CC[C@H]1NCc1cc(F)ccc1C#N	ZINC001035872967	1343241614	/nfs/dbraw/zinc/24/16/14/1343241614.db2.gz	ABRPCRQQSHVORD-IFXJQAMLSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@H]1CN(C(=O)CC(C)(C)C)CC[C@@H]1NCc1cc(F)ccc1C#N	ZINC001035906175	1343262994	/nfs/dbraw/zinc/26/29/94/1343262994.db2.gz	APZIAUAGHZUAAA-KSSFIOAISA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@H]1CN(C(=O)C=C2CCC2)CC[C@@H]1NCc1cc(F)ccc1C#N	ZINC001035994860	1343306099	/nfs/dbraw/zinc/30/60/99/1343306099.db2.gz	ZNJUYGNVDHAFFB-LIRRHRJNSA-N	0	3	341.430	3.134	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2(C)CCCC2)CC[C@H]1NCc1ccccc1C#N	ZINC001036136763	1343322674	/nfs/dbraw/zinc/32/26/74/1343322674.db2.gz	SIOJJUPPKRHUJI-VQIMIIECSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](NCc2ncc(C)s2)[C@@H](C)C1	ZINC001036138145	1343323317	/nfs/dbraw/zinc/32/33/17/1343323317.db2.gz	REYORLYSHFZCAG-ZFWWWQNUSA-N	0	3	335.517	3.380	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](NCc2csc(C)n2)[C@H](C)C1	ZINC001036140146	1343325094	/nfs/dbraw/zinc/32/50/94/1343325094.db2.gz	BLQFVXJVEYGQET-CZUORRHYSA-N	0	3	335.517	3.380	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](NCc2cc(F)ccc2C#N)[C@@H](C)C1	ZINC001036140974	1343325781	/nfs/dbraw/zinc/32/57/81/1343325781.db2.gz	FJJXFEXHDLLHOZ-KBXCAEBGSA-N	0	3	343.446	3.236	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3nccs3)[C@H](C)C2)CC1	ZINC001036163296	1343337975	/nfs/dbraw/zinc/33/79/75/1343337975.db2.gz	CZBSMOOCZDWWGQ-ZBFHGGJFSA-N	0	3	333.501	3.216	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](NCc3ccn(C(C)C)n3)[C@@H](C)C2)C1	ZINC001036170752	1343343466	/nfs/dbraw/zinc/34/34/66/1343343466.db2.gz	UDEZBGHFKCKHGM-WMZOPIPTSA-N	0	3	344.503	3.147	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]([C@@H](C)NCc2ccn(C(C)C)n2)C1	ZINC001036425778	1343479295	/nfs/dbraw/zinc/47/92/95/1343479295.db2.gz	CGNRYQQVPTUMMR-IAGOWNOFSA-N	0	3	346.519	3.393	20	30		EGEDHN
C[C@H]1CCCN(C(=O)CC2CC2)[C@H]1CNCc1ccc(C#N)cc1F	ZINC001036492459	1343515080	/nfs/dbraw/zinc/51/50/80/1343515080.db2.gz	CXPMASHUUINJSK-LIRRHRJNSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)C(C)(C)F)[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001036503859	1343521996	/nfs/dbraw/zinc/52/19/96/1343521996.db2.gz	WQWWCLCQCXLLEI-CXAGYDPISA-N	0	3	349.425	3.162	20	30		EGEDHN
CCCC(=O)N1CC[C@H]2[C@H](CCN2CC#Cc2cccc(Cl)c2)C1	ZINC001036617693	1343577185	/nfs/dbraw/zinc/57/71/85/1343577185.db2.gz	PQZIYLPWMJCLOV-MJGOQNOKSA-N	0	3	344.886	3.414	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@H]2CN(C(=O)C3CCCC3)CC[C@@H]21	ZINC001036621143	1343579892	/nfs/dbraw/zinc/57/98/92/1343579892.db2.gz	PMDOKTJCESNIRW-PMACEKPBSA-N	0	3	337.467	3.171	20	30		EGEDHN
CCCC(=O)N1CC[C@H]2[C@@H](CCN2CC#Cc2ccc(Cl)cc2)C1	ZINC001036624611	1343582642	/nfs/dbraw/zinc/58/26/42/1343582642.db2.gz	TXJXJIFHTPURPK-HKUYNNGSSA-N	0	3	344.886	3.414	20	30		EGEDHN
Cc1occc1C(=O)N1CC[C@@H]2[C@H](CCN2CC#Cc2ccccc2)C1	ZINC001036639026	1343594476	/nfs/dbraw/zinc/59/44/76/1343594476.db2.gz	NKIMKXWQAAKHNP-TZIWHRDSSA-N	0	3	348.446	3.176	20	30		EGEDHN
CC(C)(C)CC(=O)N1CC[C@H]2[C@@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001036640338	1343594784	/nfs/dbraw/zinc/59/47/84/1343594784.db2.gz	IPLKBTVJBRJTQD-YOEHRIQHSA-N	0	3	345.512	3.479	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@@H]2CN(C(=O)CCC3CC3)CC[C@H]21	ZINC001036670754	1343613509	/nfs/dbraw/zinc/61/35/09/1343613509.db2.gz	ZKZGJTQAKDHHFD-WOJBJXKFSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2[C@H](CCN2Cc2cnc(C)o2)C1	ZINC001036793498	1343725925	/nfs/dbraw/zinc/72/59/25/1343725925.db2.gz	GIGMQDPOHZJTAV-WBVHZDCISA-N	0	3	331.460	3.008	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]3[C@H](CCN3Cc3cnc(C)s3)C2)C1	ZINC001036815336	1343752594	/nfs/dbraw/zinc/75/25/94/1343752594.db2.gz	CJRHUXWTPLZNQV-NVXWUHKLSA-N	0	3	345.512	3.231	20	30		EGEDHN
CC(C(=O)N[C@H]1CCC[C@H]1CNCc1ccccc1C#N)=C1CCC1	ZINC001037005979	1343925201	/nfs/dbraw/zinc/92/52/01/1343925201.db2.gz	KWVLBVFZYGOJOE-PMACEKPBSA-N	0	3	337.467	3.433	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCCC[C@H]2CNCc2cc(C)no2)CC1	ZINC001037228247	1344057148	/nfs/dbraw/zinc/05/71/48/1344057148.db2.gz	ARQQNQRVOOXHOR-PKOBYXMFSA-N	0	3	345.487	3.494	20	30		EGEDHN
CC[C@@H]1CN(C(=O)C2(C)CC2)CC[C@@H]1NCc1cc(F)ccc1C#N	ZINC001037854944	1344140728	/nfs/dbraw/zinc/14/07/28/1344140728.db2.gz	SEDHBDDMRLZPIM-KDOFPFPSSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](NCc2ccn(CC)n2)[C@H](CC)C1	ZINC001037889744	1344164228	/nfs/dbraw/zinc/16/42/28/1344164228.db2.gz	GBSZLKGMYPBJPC-SJLPKXTDSA-N	0	3	346.519	3.222	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](NCc2nccs2)[C@@H](CC)C1	ZINC001037906070	1344170571	/nfs/dbraw/zinc/17/05/71/1344170571.db2.gz	QDSSUNOBEIIHDX-LSDHHAIUSA-N	0	3	335.517	3.462	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)C1CCc2ccccc2CC1	ZINC001038437861	1344427465	/nfs/dbraw/zinc/42/74/65/1344427465.db2.gz	UFHAGVYFYQLCHL-FQEVSTJZSA-N	0	3	326.484	3.338	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1cnc2c(F)cccc2c1	ZINC001038523276	1344465710	/nfs/dbraw/zinc/46/57/10/1344465710.db2.gz	NVCPGIZURCFRLU-INIZCTEOSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)NC[C@H]1CCN1CCC1CCCCCC1	ZINC001038714266	1344550771	/nfs/dbraw/zinc/55/07/71/1344550771.db2.gz	LPDRBHUNEFHVIM-QRVBRYPASA-N	0	3	334.504	3.129	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NC[C@H]1CCN1CCC1CCCCC1	ZINC001038807704	1344592212	/nfs/dbraw/zinc/59/22/12/1344592212.db2.gz	LIRIVTZNKCASNJ-QYZOEREBSA-N	0	3	334.504	3.129	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCN2CCC2CCCCCC2)nc1	ZINC001038931087	1344659219	/nfs/dbraw/zinc/65/92/19/1344659219.db2.gz	KZAHSFUXOUSVQY-LJQANCHMSA-N	0	3	339.483	3.228	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1cccc(F)c1F	ZINC001039029912	1344723324	/nfs/dbraw/zinc/72/33/24/1344723324.db2.gz	QEWNAEDYGSFUKT-VNQPRFMTSA-N	0	3	334.410	3.225	20	30		EGEDHN
CCC(=O)N1CCCC[C@H]1[C@H]1CCN(Cc2ccc(C#N)c(F)c2)C1	ZINC001039179441	1344875517	/nfs/dbraw/zinc/87/55/17/1344875517.db2.gz	FVMWEQHMILDBEN-HKUYNNGSSA-N	0	3	343.446	3.310	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccsc2C)C1	ZINC001039199681	1344909217	/nfs/dbraw/zinc/90/92/17/1344909217.db2.gz	BYGPILMVBYTGJM-FUHWJXTLSA-N	0	3	330.497	3.396	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc3c(o2)CCCC3)C1	ZINC001039209733	1344922950	/nfs/dbraw/zinc/92/29/50/1344922950.db2.gz	LDXMKPKFBRUDKG-MSOLQXFVSA-N	0	3	340.467	3.108	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(F)c(F)c2)C1	ZINC001039215016	1344930460	/nfs/dbraw/zinc/93/04/60/1344930460.db2.gz	ROWMWZDZBHUKAK-VQIMIIECSA-N	0	3	346.421	3.305	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2scnc2CC)C1	ZINC001039216384	1344933451	/nfs/dbraw/zinc/93/34/51/1344933451.db2.gz	ZWWPVZBIYKRCLN-WBVHZDCISA-N	0	3	345.512	3.045	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)CCc2ccc(F)cc2)C1	ZINC001039218445	1344935424	/nfs/dbraw/zinc/93/54/24/1344935424.db2.gz	MFYDDBBLGJBVNF-QUCCMNQESA-N	0	3	342.458	3.095	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)CCc2ccc(C)cc2)C1	ZINC001039218419	1344935555	/nfs/dbraw/zinc/93/55/55/1344935555.db2.gz	LQTXDUPOPSRHSV-RTWAWAEBSA-N	0	3	338.495	3.264	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)Cc2ccccc2CC)C1	ZINC001039219729	1344937253	/nfs/dbraw/zinc/93/72/53/1344937253.db2.gz	UOYRKUNTMMTJIT-SFTDATJTSA-N	0	3	338.495	3.128	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(C)n(CC)c2C)C1	ZINC001039219760	1344937288	/nfs/dbraw/zinc/93/72/88/1344937288.db2.gz	VHROLZXOTLXFCO-QUCCMNQESA-N	0	3	341.499	3.075	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc(F)ccc2CC)C1	ZINC001039220345	1344937829	/nfs/dbraw/zinc/93/78/29/1344937829.db2.gz	YGPVAJOKCBLAIR-PXNSSMCTSA-N	0	3	342.458	3.338	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc3ccccc3n2C)C1	ZINC001039224527	1344941919	/nfs/dbraw/zinc/94/19/19/1344941919.db2.gz	HDMADCNZCLKHKO-AZUAARDMSA-N	0	3	349.478	3.128	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc(C)c(C)cn2)C1	ZINC001039227017	1344946467	/nfs/dbraw/zinc/94/64/67/1344946467.db2.gz	ANZCYWSMCXBBNU-ICSRJNTNSA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccoc2CCC)C1	ZINC001039242968	1344969642	/nfs/dbraw/zinc/96/96/42/1344969642.db2.gz	DUGXQRWQXNUUQB-SJLPKXTDSA-N	0	3	328.456	3.182	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)Cc2c[nH]c3ccccc23)C1	ZINC001039246111	1344975209	/nfs/dbraw/zinc/97/52/09/1344975209.db2.gz	PEALFLQYSOTWGJ-DYESRHJHSA-N	0	3	349.478	3.047	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2c(C)nsc2C)C1	ZINC001039251900	1344983999	/nfs/dbraw/zinc/98/39/99/1344983999.db2.gz	WQAONAHWRCLSKB-DLBZAZTESA-N	0	3	345.512	3.100	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(F)cc2C)C1	ZINC001039256240	1344986352	/nfs/dbraw/zinc/98/63/52/1344986352.db2.gz	ISRIBBPWLNTUFU-XLIONFOSSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccnc(-c2ccco2)c1	ZINC001039390662	1345041034	/nfs/dbraw/zinc/04/10/34/1345041034.db2.gz	AHRQMCDGPGLSLN-MSOLQXFVSA-N	0	3	349.434	3.044	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1n[nH]c2ccc(C)cc21	ZINC001039399501	1345046584	/nfs/dbraw/zinc/04/65/84/1345046584.db2.gz	CGTNNXSDFAMWEO-CVEARBPZSA-N	0	3	338.455	3.126	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccncc1OC(C)C	ZINC001039411315	1345054083	/nfs/dbraw/zinc/05/40/83/1345054083.db2.gz	PURGARPHKZTGDA-SJORKVTESA-N	0	3	343.471	3.124	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc(Cl)c(F)c1	ZINC001039443942	1345069515	/nfs/dbraw/zinc/06/95/15/1345069515.db2.gz	OCTAFXJGOAXJNI-CABCVRRESA-N	0	3	336.838	3.273	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccc(OC)c1C	ZINC001039443690	1345069633	/nfs/dbraw/zinc/06/96/33/1345069633.db2.gz	ZRAAQVYAPHJUEU-SJORKVTESA-N	0	3	328.456	3.259	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CCC[C@@H](C1)N2C[C@@H]1CCO[C@@H](C)C1	ZINC001039823402	1345200341	/nfs/dbraw/zinc/20/03/41/1345200341.db2.gz	RKVJVXYJXRTUMM-ZSYWTGECSA-N	0	3	348.531	3.469	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cc4c(o3)CCCC4)C2)C1	ZINC001040235681	1345388412	/nfs/dbraw/zinc/38/84/12/1345388412.db2.gz	FONDYXKJHDYYML-HXUWFJFHSA-N	0	3	328.456	3.273	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3c(C)cc(F)cc3C)C2)C1	ZINC001040333019	1345437728	/nfs/dbraw/zinc/43/77/28/1345437728.db2.gz	QRWDKLZMHWHPIG-HXUWFJFHSA-N	0	3	328.431	3.004	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N1CC[C@]2(C1)CCCN(Cc1cccc(C#N)c1)C2	ZINC001040335508	1345439073	/nfs/dbraw/zinc/43/90/73/1345439073.db2.gz	CTXLAFVGILUADC-NBHGPNQESA-N	0	3	337.467	3.029	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ccc4[nH]ccc4c3)C2)C1	ZINC001040361896	1345455131	/nfs/dbraw/zinc/45/51/31/1345455131.db2.gz	XQNILENOQJYOSF-OAQYLSRUSA-N	0	3	335.451	3.119	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)Cc3c(C)cc(C)cc3C)C2)C1	ZINC001040369919	1345459475	/nfs/dbraw/zinc/45/94/75/1345459475.db2.gz	WLLMJJHTHSHRFK-QFIPXVFZSA-N	0	3	338.495	3.102	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3ncsc3C3CC3)C2)C1	ZINC001040392857	1345472790	/nfs/dbraw/zinc/47/27/90/1345472790.db2.gz	XFTWGMYFXAZLKV-GOSISDBHSA-N	0	3	331.485	3.135	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3oc(C(C)C)nc3C)C2)C1	ZINC001040437277	1345500184	/nfs/dbraw/zinc/50/01/84/1345500184.db2.gz	YPPSJAWMUWPFQT-LJQANCHMSA-N	0	3	331.460	3.221	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)C[C@H]3CCc4ccccc43)C2)C1	ZINC001040461529	1345509767	/nfs/dbraw/zinc/50/97/67/1345509767.db2.gz	WFOQMVHFTHTFSE-KNQAVFIVSA-N	0	3	336.479	3.054	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3ccccc3OC(C)C)C2)C1	ZINC001040500425	1345520841	/nfs/dbraw/zinc/52/08/41/1345520841.db2.gz	MNLHGIVCBWIGAN-NRFANRHFSA-N	0	3	340.467	3.035	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cc4nc(C)ccc4o3)C2)C1	ZINC001040503275	1345523299	/nfs/dbraw/zinc/52/32/99/1345523299.db2.gz	RUWPKMKILJDTCQ-FQEVSTJZSA-N	0	3	339.439	3.250	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cc(C)c(F)c(C)c3)C2)C1	ZINC001040534793	1345535319	/nfs/dbraw/zinc/53/53/19/1345535319.db2.gz	MJBSOCWZTNZDPY-OAQYLSRUSA-N	0	3	342.458	3.394	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3ccc(F)c4occc43)C2)C1	ZINC001040539296	1345536755	/nfs/dbraw/zinc/53/67/55/1345536755.db2.gz	NZTRCKJFHGPWAH-FQEVSTJZSA-N	0	3	340.398	3.133	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@H](C)Cc3ccccc3)C2)C1	ZINC001040539085	1345537237	/nfs/dbraw/zinc/53/72/37/1345537237.db2.gz	MXZCAOCHGANKDU-KNQAVFIVSA-N	0	3	338.495	3.203	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3c[nH]c4ccc(C)cc34)C2)C1	ZINC001040546439	1345541222	/nfs/dbraw/zinc/54/12/22/1345541222.db2.gz	DIRYYFPEAMBFAU-JOCHJYFZSA-N	0	3	349.478	3.428	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CCN(C(=O)c4cc[nH]c4)C3)CC2)c1	ZINC001040711876	1345569316	/nfs/dbraw/zinc/56/93/16/1345569316.db2.gz	YSKPUMWOGAKAPT-UHFFFAOYSA-N	0	3	348.450	3.015	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@@H]3C[C@H]3c3ccsc3)C2)CC1	ZINC001040747340	1345573961	/nfs/dbraw/zinc/57/39/61/1345573961.db2.gz	OQGDWLYQVHJWPV-ZWKOTPCHSA-N	0	3	342.508	3.189	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC2(C1)CCN(Cc1ocnc1C)CC2	ZINC001040799722	1345579327	/nfs/dbraw/zinc/57/93/27/1345579327.db2.gz	CZUCWGOEWPNYFL-UHFFFAOYSA-N	0	3	331.460	3.010	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)CCc3ccccc3C)C2)CC1	ZINC001040864643	1345589753	/nfs/dbraw/zinc/58/97/53/1345589753.db2.gz	HOQFFZCGHOQIRC-UHFFFAOYSA-N	0	3	338.495	3.265	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)C[C@@H](C)c3ccccc3C)C2)CC1	ZINC001040875171	1345592651	/nfs/dbraw/zinc/59/26/51/1345592651.db2.gz	UQXNNPOZOZZSSB-LJQANCHMSA-N	0	3	338.495	3.436	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccc4c(c3)CCCC4)C2)CC1	ZINC001040931082	1345604070	/nfs/dbraw/zinc/60/40/70/1345604070.db2.gz	DVQUNWDIHLADLL-UHFFFAOYSA-N	0	3	336.479	3.127	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@]3(CCN(C(=O)C4CCCC4)C3)C2)c1	ZINC001040995117	1345617445	/nfs/dbraw/zinc/61/74/45/1345617445.db2.gz	SKOLULZRYYGKEX-OAQYLSRUSA-N	0	3	337.467	3.173	20	30		EGEDHN
Cc1occc1C(=O)N1CC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001041056453	1345638684	/nfs/dbraw/zinc/63/86/84/1345638684.db2.gz	GDQDTPLYIXCKDJ-OAQYLSRUSA-N	0	3	349.434	3.198	20	30		EGEDHN
C[C@@H](c1ccccc1F)N1CC[C@]2(CCN(C(=O)C#CC3CC3)C2)C1	ZINC001041265576	1345689694	/nfs/dbraw/zinc/68/96/94/1345689694.db2.gz	JTHVKBFINYLVBC-KKSFZXQISA-N	0	3	340.442	3.225	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccc(CCC)s3)C2)C1	ZINC001041327902	1345704051	/nfs/dbraw/zinc/70/40/51/1345704051.db2.gz	QMDQURVDJPPINZ-LJQANCHMSA-N	0	3	330.497	3.262	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)Cc3cccc(C4CC4)c3)C2)C1	ZINC001041503850	1345745361	/nfs/dbraw/zinc/74/53/61/1345745361.db2.gz	URBOWEQLKFAQFF-QFIPXVFZSA-N	0	3	336.479	3.054	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@]2(CCN(Cc3oc(C)nc3C)C2)C1	ZINC001041535237	1345754699	/nfs/dbraw/zinc/75/46/99/1345754699.db2.gz	DWHDRTHKWFLODS-HXUWFJFHSA-N	0	3	345.487	3.318	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@]2(CCN(CCC(F)(F)F)C2)C1	ZINC001041537275	1345755233	/nfs/dbraw/zinc/75/52/33/1345755233.db2.gz	VKFSSUSWQREOSX-INIZCTEOSA-N	0	3	332.410	3.466	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@]2(CCN(Cc3ncccc3C)C2)C1	ZINC001041542378	1345757374	/nfs/dbraw/zinc/75/73/74/1345757374.db2.gz	CEDONLNJGYWKOY-FQEVSTJZSA-N	0	3	327.472	3.027	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@]2(CCN(Cc3cccnc3C)C2)C1	ZINC001041624616	1345800134	/nfs/dbraw/zinc/80/01/34/1345800134.db2.gz	BWHMHKZFFYGZEX-SFTDATJTSA-N	0	3	341.499	3.417	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)[C@@H](C)c3ccc(Cl)cc3)C2)C1	ZINC001041629573	1345802084	/nfs/dbraw/zinc/80/20/84/1345802084.db2.gz	BMMCBQJVEZNWHO-JXFKEZNVSA-N	0	3	344.886	3.391	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@]2(CCN(CCC(F)(F)F)C2)C1	ZINC001041638121	1345805649	/nfs/dbraw/zinc/80/56/49/1345805649.db2.gz	IGWICBPGJOUWSJ-JKSUJKDBSA-N	0	3	332.410	3.466	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@]3(CCN(C(=O)C4CC5(CC5)C4)C3)C2)cc1	ZINC001041664495	1345815652	/nfs/dbraw/zinc/81/56/52/1345815652.db2.gz	NATVAPSTFAABQM-QFIPXVFZSA-N	0	3	349.478	3.173	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)C(C)(C)c3cccc(Cl)c3)C2)C1	ZINC001041717024	1345829884	/nfs/dbraw/zinc/82/98/84/1345829884.db2.gz	JIVZZKXTMAXNMN-FQEVSTJZSA-N	0	3	344.886	3.175	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)[C@]3(C)CC[C@H](C)C3(C)C)C2)C1	ZINC001041719421	1345830125	/nfs/dbraw/zinc/83/01/25/1345830125.db2.gz	CKFKBXUEXDJYOT-DZFGPLHGSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)C34CCC(CC3)C4(C)C)C2)C1	ZINC001041728420	1345833773	/nfs/dbraw/zinc/83/37/73/1345833773.db2.gz	HWWSUVWFCKIUEE-TWMPVWRBSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3csc(C(C)(C)C)n3)C2)C1	ZINC001041740299	1345837554	/nfs/dbraw/zinc/83/75/54/1345837554.db2.gz	QIVYYMWZZKMRFG-IBGZPJMESA-N	0	3	345.512	3.002	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3csc(C(C)(C)C)n3)C2)C1	ZINC001041740300	1345837725	/nfs/dbraw/zinc/83/77/25/1345837725.db2.gz	QIVYYMWZZKMRFG-LJQANCHMSA-N	0	3	345.512	3.002	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3cc4cc(C)c(C)cc4o3)C2)C1	ZINC001041788612	1345851229	/nfs/dbraw/zinc/85/12/29/1345851229.db2.gz	GTJSNXHEGGSUTE-OAQYLSRUSA-N	0	3	336.435	3.221	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)C[C@@H]3CCCc4ccccc43)C2)C1	ZINC001041798520	1345854496	/nfs/dbraw/zinc/85/44/96/1345854496.db2.gz	YHHSMFCLECSMPX-UGKGYDQZSA-N	0	3	336.479	3.054	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3cc(CCC)c(C)s3)C2)C1	ZINC001041820823	1345863617	/nfs/dbraw/zinc/86/36/17/1345863617.db2.gz	YLOKUJGHRMBLIX-LJQANCHMSA-N	0	3	330.497	3.180	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)[C@H](CC)c3ccc(Cl)cc3)C2)C1	ZINC001041842077	1345870065	/nfs/dbraw/zinc/87/00/65/1345870065.db2.gz	AKGFFWLFTODPRX-QUCCMNQESA-N	0	3	344.886	3.391	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3c(CC)oc4ccccc43)C2)C1	ZINC001041845667	1345871682	/nfs/dbraw/zinc/87/16/82/1345871682.db2.gz	MRCSAZRTTAFLII-OAQYLSRUSA-N	0	3	336.435	3.166	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)[C@@H]3CCCCc4ccccc43)C2)C1	ZINC001041847237	1345871896	/nfs/dbraw/zinc/87/18/96/1345871896.db2.gz	LWHJHNLLXQYUMU-IRLDBZIGSA-N	0	3	336.479	3.054	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)[C@@H](c3ccc(F)cc3)C(C)C)C2)C1	ZINC001041847623	1345872708	/nfs/dbraw/zinc/87/27/08/1345872708.db2.gz	SOALMWUVKWJLGU-TZIWHRDSSA-N	0	3	342.458	3.123	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)CCc3cc(C)sc3C)C2)C1	ZINC001041850767	1345872863	/nfs/dbraw/zinc/87/28/63/1345872863.db2.gz	NUVSASRKXQMKHD-HXUWFJFHSA-N	0	3	344.524	3.245	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@H]2CCN(Cc3ccc(C#N)cc3)[C@H]2C1	ZINC001041902566	1345888784	/nfs/dbraw/zinc/88/87/84/1345888784.db2.gz	AXWHPRKFBAVPLZ-MOPGFXCFSA-N	0	3	325.456	3.027	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CCN(C(=O)CC4CCC4)C[C@H]32)c1	ZINC001041997940	1345917769	/nfs/dbraw/zinc/91/77/69/1345917769.db2.gz	WDTYHOGWMPKIMM-WOJBJXKFSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3c(F)ccc4ccncc43)C[C@@H]21	ZINC001042067608	1345934858	/nfs/dbraw/zinc/93/48/58/1345934858.db2.gz	RDNBVHZPOUUJDE-QAPCUYQASA-N	0	3	339.414	3.096	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccoc3C(F)(F)F)C[C@H]21	ZINC001042075775	1345938271	/nfs/dbraw/zinc/93/82/71/1345938271.db2.gz	NRTSEHQZPXLHCS-DGCLKSJQSA-N	0	3	328.334	3.021	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3scc(C)c3Cl)C[C@@H]21	ZINC001042077774	1345939142	/nfs/dbraw/zinc/93/91/42/1345939142.db2.gz	PDXIUSPPXYTVTO-KBPBESRZSA-N	0	3	336.888	3.270	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ocnc3-c3ccccc3)C[C@@H]21	ZINC001042089232	1345941370	/nfs/dbraw/zinc/94/13/70/1345941370.db2.gz	WJCNUGQARDWXSC-WBVHZDCISA-N	0	3	337.423	3.064	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3oc(C(F)F)cc3C)C[C@H]21	ZINC001042100210	1345944121	/nfs/dbraw/zinc/94/41/21/1345944121.db2.gz	LLCCSAVFCRPWFZ-ZIAGYGMSSA-N	0	3	336.382	3.085	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3cc(F)c(C)cc3F)C[C@@H]21	ZINC001042104048	1345945270	/nfs/dbraw/zinc/94/52/70/1345945270.db2.gz	ZWSRZBBEUFBOGA-KSSFIOAISA-N	0	3	334.410	3.386	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(Cl)c(Cl)[nH]3)C[C@H]21	ZINC001042174873	1345966674	/nfs/dbraw/zinc/96/66/74/1345966674.db2.gz	YTTOADDEVTXVDP-ZWNOBZJWSA-N	0	3	328.243	3.044	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(Cl)c(Cl)[nH]3)C[C@@H]21	ZINC001042174872	1345966593	/nfs/dbraw/zinc/96/65/93/1345966593.db2.gz	YTTOADDEVTXVDP-MFKMUULPSA-N	0	3	328.243	3.044	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc4cc(F)ccc4[nH]3)C[C@H]21	ZINC001042175940	1345967035	/nfs/dbraw/zinc/96/70/35/1345967035.db2.gz	GXIXGVRZSSYOBX-FZKQIMNGSA-N	0	3	327.403	3.029	20	30		EGEDHN
CC1(C(=O)N2CC[C@@H]3CCN(Cc4ccc(C#N)cc4)[C@@H]3C2)CCC1	ZINC001042187184	1345974353	/nfs/dbraw/zinc/97/43/53/1345974353.db2.gz	MFTZFUHRVGLHOM-RBUKOAKNSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(F)c(Cl)c3F)C[C@H]21	ZINC001042218846	1345990840	/nfs/dbraw/zinc/99/08/40/1345990840.db2.gz	MICMVMQJAKUXOS-BXUZGUMPSA-N	0	3	340.801	3.341	20	30		EGEDHN
CC(F)(F)CC(=O)N1CC[C@H]2CCN(Cc3cccc(C#N)c3)[C@H]2C1	ZINC001042221858	1345992882	/nfs/dbraw/zinc/99/28/82/1345992882.db2.gz	NMNQUTWNMPBTMN-SJORKVTESA-N	0	3	347.409	3.026	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(C(C)C)nc3C)C[C@H]21	ZINC001042238319	1345999999	/nfs/dbraw/zinc/99/99/99/1345999999.db2.gz	RSEAYRFEBBRANY-VQIMIIECSA-N	0	3	327.472	3.236	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3cc4cc(F)ccc4o3)C[C@@H]21	ZINC001042251928	1346006334	/nfs/dbraw/zinc/00/63/34/1346006334.db2.gz	GPLSDUOHCZXJEJ-YOEHRIQHSA-N	0	3	340.398	3.132	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc4cc(F)ccc4o3)C[C@H]21	ZINC001042251754	1346006543	/nfs/dbraw/zinc/00/65/43/1346006543.db2.gz	GPGAADIUYPNTSZ-CZUORRHYSA-N	0	3	328.387	3.294	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C3(Cc4ccc(F)cc4)CC3)C[C@@H]21	ZINC001042262074	1346009726	/nfs/dbraw/zinc/00/97/26/1346009726.db2.gz	FKTGKIBZSZSWCD-HKUYNNGSSA-N	0	3	342.458	3.257	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3oc(C(C)C)nc3C)C[C@H]21	ZINC001042262690	1346010457	/nfs/dbraw/zinc/01/04/57/1346010457.db2.gz	OLTOIAXQARVJOM-HZPDHXFCSA-N	0	3	331.460	3.219	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc(C(F)F)cc3)C[C@@H]21	ZINC001042269195	1346013316	/nfs/dbraw/zinc/01/33/16/1346013316.db2.gz	IROSHRUXEIRNPH-YOEHRIQHSA-N	0	3	332.394	3.184	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C(C)(C)Cc3ccccc3)C[C@@H]21	ZINC001042305242	1346025321	/nfs/dbraw/zinc/02/53/21/1346025321.db2.gz	XPKVFMBXZJBUJG-MOPGFXCFSA-N	0	3	326.484	3.364	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cnn(C(C)C)c3C3CC3)C[C@H]21	ZINC001042308066	1346027021	/nfs/dbraw/zinc/02/70/21/1346027021.db2.gz	SJMCQRFTJXTQMG-CRAIPNDOSA-N	0	3	342.487	3.064	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(C(F)(F)F)cc3)C[C@@H]21	ZINC001042327811	1346036734	/nfs/dbraw/zinc/03/67/34/1346036734.db2.gz	PDOULZPDNBJQNF-BBRMVZONSA-N	0	3	338.373	3.428	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(Cl)ccc3OC)C[C@@H]21	ZINC001042336799	1346042622	/nfs/dbraw/zinc/04/26/22/1346042622.db2.gz	AFSNZWOQCFAEEB-CJNGLKHVSA-N	0	3	334.847	3.071	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc4ncsc4c3)C[C@H]21	ZINC001042338863	1346043383	/nfs/dbraw/zinc/04/33/83/1346043383.db2.gz	NBQQIGAXPIFTRF-CZUORRHYSA-N	0	3	327.453	3.019	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cccc4ccccc43)C[C@H]21	ZINC001042339804	1346044719	/nfs/dbraw/zinc/04/47/19/1346044719.db2.gz	BMKOEBGYVBOCOH-WIYYLYMNSA-N	0	3	332.447	3.400	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3cc(C)c(CC)s3)C[C@H]21	ZINC001042341016	1346046206	/nfs/dbraw/zinc/04/62/06/1346046206.db2.gz	JQFFTZBWBJQKDP-JKSUJKDBSA-N	0	3	330.497	3.179	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3sccc3C3CC3)C[C@@H]21	ZINC001042344147	1346047362	/nfs/dbraw/zinc/04/73/62/1346047362.db2.gz	TZVNMWIIXMOYSZ-RDJZCZTQSA-N	0	3	328.481	3.185	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C(C)(C)c3ccc(OC)cc3)C[C@H]21	ZINC001042362040	1346055792	/nfs/dbraw/zinc/05/57/92/1346055792.db2.gz	GXYXDAPYFDGMPE-QFBILLFUSA-N	0	3	342.483	3.082	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3cc4cccc(F)c4o3)C[C@H]21	ZINC001042362485	1346056628	/nfs/dbraw/zinc/05/66/28/1346056628.db2.gz	KNGNWFSCQCYKHN-WMLDXEAASA-N	0	3	340.398	3.132	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3c[nH]c4c3cccc4CC)C[C@H]21	ZINC001042367167	1346058477	/nfs/dbraw/zinc/05/84/77/1346058477.db2.gz	BVPGVBQMAMKKIH-FXAWDEMLSA-N	0	3	349.478	3.290	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3cc4c(cccc4C)o3)C[C@@H]21	ZINC001042373921	1346061879	/nfs/dbraw/zinc/06/18/79/1346061879.db2.gz	DZEMHWFFTSEELV-WMZOPIPTSA-N	0	3	336.435	3.301	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccccc3CC(C)C)C[C@H]21	ZINC001042373930	1346061906	/nfs/dbraw/zinc/06/19/06/1346061906.db2.gz	FILYRBIKRIYSPN-GHTZIAJQSA-N	0	3	338.495	3.445	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@@H](NCc2cc(F)ccc2C#N)C[C@@H]1C	ZINC001044433947	1346329633	/nfs/dbraw/zinc/32/96/33/1346329633.db2.gz	VPQJRPCYXFMZDR-KBXCAEBGSA-N	0	3	329.419	3.133	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)CC(C)(C)C	ZINC001044469601	1346341833	/nfs/dbraw/zinc/34/18/33/1346341833.db2.gz	YDKRQYOBCLRJDO-CRAIPNDOSA-N	0	3	327.472	3.464	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)/C=C\c1ccc[nH]1	ZINC001044570481	1346371710	/nfs/dbraw/zinc/37/17/10/1346371710.db2.gz	IQPPMZOVJZOPEV-JKUVKPIWSA-N	0	3	348.450	3.069	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2c(F)cccc2Cl)CCN1C(=O)C#CC1CC1	ZINC001044595066	1346378086	/nfs/dbraw/zinc/37/80/86/1346378086.db2.gz	XCZRTFFUTHEEMA-HIFRSBDPSA-N	0	3	348.849	3.362	20	30		EGEDHN
C[C@@H](NC[C@@H]1CCCN1C(=O)C#CC1CC1)c1cc(F)ccc1F	ZINC001045028731	1346483319	/nfs/dbraw/zinc/48/33/19/1346483319.db2.gz	KMEXHDBHTMJWAY-CJNGLKHVSA-N	0	3	332.394	3.020	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]1CNCc1cccc(C(C)C)n1	ZINC001045149807	1346506502	/nfs/dbraw/zinc/50/65/02/1346506502.db2.gz	TTWNSRSGXPHLCK-KRWDZBQOSA-N	0	3	329.488	3.498	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCC[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC001045227321	1346535698	/nfs/dbraw/zinc/53/56/98/1346535698.db2.gz	ITPYYDQLEJTQJK-YOEHRIQHSA-N	0	3	331.435	3.070	20	30		EGEDHN
Cc1cnccc1C(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1	ZINC001045427673	1346590868	/nfs/dbraw/zinc/59/08/68/1346590868.db2.gz	OEGVWFPGMADCNG-UHFFFAOYSA-N	0	3	348.450	3.046	20	30		EGEDHN
CC1(NC(=O)[C@@H]2CCC2(F)F)CCN(Cc2cccc(C#N)c2)CC1	ZINC001045475244	1346602651	/nfs/dbraw/zinc/60/26/51/1346602651.db2.gz	HHCDNXRWAVWAEW-INIZCTEOSA-N	0	3	347.409	3.074	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2cc(F)c(Cl)cc2F)CC1	ZINC001045540783	1346623554	/nfs/dbraw/zinc/62/35/54/1346623554.db2.gz	ZMWBNJSOHODDFX-UHFFFAOYSA-N	0	3	328.790	3.389	20	30		EGEDHN
CC1(NC(=O)C2CC3(CC3)C2)CCN(Cc2cccc(C#N)c2)CC1	ZINC001045550294	1346627700	/nfs/dbraw/zinc/62/77/00/1346627700.db2.gz	PDXIFXDRPNHSSY-UHFFFAOYSA-N	0	3	337.467	3.219	20	30		EGEDHN
CC1CC(C(=O)N2CC[C@H]3CC[C@@H](C2)N3Cc2ccc(C#N)cc2)C1	ZINC001045748541	1346687935	/nfs/dbraw/zinc/68/79/35/1346687935.db2.gz	CLFPZWOAAUMQCW-AVMZVFHNSA-N	0	3	337.467	3.170	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1ncccc1C	ZINC001045826570	1346709869	/nfs/dbraw/zinc/70/98/69/1346709869.db2.gz	APTFYCLICBHTRR-SJORKVTESA-N	0	3	327.472	3.168	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1CC[C@H]2CC[C@@H](C1)N2C[C@@H](F)CC	ZINC001045883739	1346732078	/nfs/dbraw/zinc/73/20/78/1346732078.db2.gz	WPJDSOUHIQLSCT-ZCNNSNEGSA-N	0	3	342.458	3.024	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@]3(C2)CCCCN(C(=O)C2CC2)C3)s1	ZINC001045905745	1346741637	/nfs/dbraw/zinc/74/16/37/1346741637.db2.gz	KYLRJUOGTKLPGN-LJQANCHMSA-N	0	3	343.496	3.234	20	30		EGEDHN
C=C(C)C[N@@H+]1CC[C@@]2(C1)CCCCN(C(=O)c1ccccc1[O-])C2	ZINC001045918530	1346755233	/nfs/dbraw/zinc/75/52/33/1346755233.db2.gz	LHCZNCDMFWCTQN-HXUWFJFHSA-N	0	3	328.456	3.287	20	30		EGEDHN
C=C(C)C[N@H+]1CC[C@@]2(C1)CCCCN(C(=O)c1ccccc1[O-])C2	ZINC001045918530	1346755236	/nfs/dbraw/zinc/75/52/36/1346755236.db2.gz	LHCZNCDMFWCTQN-HXUWFJFHSA-N	0	3	328.456	3.287	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H]1C[C@@H]3C=C[C@H]1CC3)C2	ZINC001045939166	1346775206	/nfs/dbraw/zinc/77/52/06/1346775206.db2.gz	WUISUWMPNHWAFT-DYQZNNLLSA-N	0	3	340.511	3.317	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1c(C)noc1C(C)C)C2	ZINC001045945033	1346780876	/nfs/dbraw/zinc/78/08/76/1346780876.db2.gz	NBTFAVJYDFWHRL-HXUWFJFHSA-N	0	3	343.471	3.058	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@]1(C)C[C@H]3C[C@H]3C1)C2	ZINC001045952756	1346788015	/nfs/dbraw/zinc/78/80/15/1346788015.db2.gz	SFHOOUNIRYPTDI-YHELAOLJSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc(C)c(C)n1)C2	ZINC001045953285	1346788434	/nfs/dbraw/zinc/78/84/34/1346788434.db2.gz	XDMMTNVSSACGSM-NRFANRHFSA-N	0	3	339.483	3.040	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)CCc1cccc(C)c1)C2	ZINC001045954998	1346789589	/nfs/dbraw/zinc/78/95/89/1346789589.db2.gz	MCHPASPUSZFHCZ-QFIPXVFZSA-N	0	3	338.495	3.265	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)Cc1cccc(C)c1)C2	ZINC001045960885	1346796126	/nfs/dbraw/zinc/79/61/26/1346796126.db2.gz	VFGAOSSZLXTHAB-QFIPXVFZSA-N	0	3	338.495	3.265	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc(F)cc(Cl)c1)C2	ZINC001045969922	1346805847	/nfs/dbraw/zinc/80/58/47/1346805847.db2.gz	CDIGUDWKYUPBMB-IBGZPJMESA-N	0	3	348.849	3.431	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cncc(Cl)c1)C2	ZINC001045973843	1346810150	/nfs/dbraw/zinc/81/01/50/1346810150.db2.gz	PXKMTUGFKQDIBF-LJQANCHMSA-N	0	3	345.874	3.077	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H](C)c1ccc(C)s1)C2	ZINC001045978962	1346815851	/nfs/dbraw/zinc/81/58/51/1346815851.db2.gz	LYCNDKXTEYAVPJ-FXAWDEMLSA-N	0	3	344.524	3.498	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc(CC(C)C)c[nH]1)C2	ZINC001045979428	1346816825	/nfs/dbraw/zinc/81/68/25/1346816825.db2.gz	DKMDHWGFMAAKJO-NRFANRHFSA-N	0	3	341.499	3.165	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc(F)cc1F)C2	ZINC001045982968	1346822391	/nfs/dbraw/zinc/82/23/91/1346822391.db2.gz	HIFWPOUXDUDGHQ-FQEVSTJZSA-N	0	3	346.421	3.306	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H]1CC3CCC1CC3)C2	ZINC001045986409	1346827531	/nfs/dbraw/zinc/82/75/31/1346827531.db2.gz	PTDZDVBDGUJKEV-SDVBZNEUSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCCN1CC[C@](C)(NC(=O)c2ccc(OC)c(C(C)C)c2)C1	ZINC001046452332	1346979266	/nfs/dbraw/zinc/97/92/66/1346979266.db2.gz	VOZOUBFLVCHHCI-FQEVSTJZSA-N	0	3	328.456	3.036	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@]2(C)CCN(Cc3ccc(C)cc3)C2)cc1	ZINC001046532635	1347006638	/nfs/dbraw/zinc/00/66/38/1347006638.db2.gz	YSTHKQSBNARNFD-QFIPXVFZSA-N	0	3	332.447	3.371	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)[C@@H]2CCCc3sc(C)nc32)C1	ZINC001046765575	1347090821	/nfs/dbraw/zinc/09/08/21/1347090821.db2.gz	ZEJLAXIUJCUCKS-KDOFPFPSSA-N	0	3	333.501	3.028	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2sccc2C)C1	ZINC001046910940	1347150106	/nfs/dbraw/zinc/15/01/06/1347150106.db2.gz	UUAQYZVBJKOFSG-ZDUSSCGKSA-N	0	3	328.428	3.320	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2sccc2F)C1	ZINC001046937691	1347157582	/nfs/dbraw/zinc/15/75/82/1347157582.db2.gz	KNHZGFWALUDSIO-LLVKDONJSA-N	0	3	332.391	3.150	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@@H](CNC(=O)[C@@H]2CCC=CCCC2)C1	ZINC001046951829	1347161401	/nfs/dbraw/zinc/16/14/01/1347161401.db2.gz	OLZZTLZDMULKJP-SJORKVTESA-N	0	3	338.442	3.220	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@H]3C[C@@H](C2)N(Cc2cnoc2C)C3)CC1	ZINC001047139553	1347218065	/nfs/dbraw/zinc/21/80/65/1347218065.db2.gz	XMMCHQBXRZXVMC-SNRMKQJTSA-N	0	3	343.471	3.199	20	30		EGEDHN
CC1(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2C#N)C3)CC=CC1	ZINC001047140154	1347218317	/nfs/dbraw/zinc/21/83/17/1347218317.db2.gz	HYEPYRFRIKZCMP-DBVUQKKJSA-N	0	3	349.478	3.384	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@H]3C[C@@H](C2)N(CC#Cc2ccccc2)C3)C1	ZINC001047143474	1347218907	/nfs/dbraw/zinc/21/89/07/1347218907.db2.gz	OMVMFAAQNQFGOQ-ACRUOGEOSA-N	0	3	348.490	3.364	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)[C@@H](C)C(F)(F)F)C2)CC1	ZINC001047248531	1347273582	/nfs/dbraw/zinc/27/35/82/1347273582.db2.gz	RPJFIKLBJONHRA-ZBFHGGJFSA-N	0	3	344.421	3.159	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@H](C)c3ccsc3)C2)CC1	ZINC001047253871	1347277820	/nfs/dbraw/zinc/27/78/20/1347277820.db2.gz	JRXGKLMXAWRHAM-AEFFLSMTSA-N	0	3	344.524	3.435	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)[C@@H](C)c3ccco3)C2)CC1	ZINC001047254704	1347278820	/nfs/dbraw/zinc/27/88/20/1347278820.db2.gz	QXUCPGWKWLQWAR-HKUYNNGSSA-N	0	3	342.483	3.357	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@H]3CCC(C)(C)C3)C2)CC1	ZINC001047255166	1347279147	/nfs/dbraw/zinc/27/91/47/1347279147.db2.gz	WIULENAZDMMXCC-RBUKOAKNSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)[C@@H]3C[C@H]3C3CCC3)C2)CC1	ZINC001047256899	1347280120	/nfs/dbraw/zinc/28/01/20/1347280120.db2.gz	FFSJJWCUSXCWHL-PCCBWWKXSA-N	0	3	342.527	3.397	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3cccc4cc[nH]c43)C2)CC1	ZINC001047257600	1347280441	/nfs/dbraw/zinc/28/04/41/1347280441.db2.gz	ROOXYQYJMLFAMH-LJQANCHMSA-N	0	3	349.478	3.365	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@@H]3C[C@H]3CC(C)C)C2)CC1	ZINC001047260203	1347282563	/nfs/dbraw/zinc/28/25/63/1347282563.db2.gz	YESVTUWHIZQRDR-VAMGGRTRSA-N	0	3	330.516	3.252	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@@H](C)c3ccccc3)C2)CC1	ZINC001047263262	1347284639	/nfs/dbraw/zinc/28/46/39/1347284639.db2.gz	DMRURIHNTPHCEV-RXVVDRJESA-N	0	3	338.495	3.374	20	30		EGEDHN
C[C@H](NCc1cc(F)ccc1C#N)[C@@H]1CCN(C(=O)C2CCCC2)C1	ZINC001047668971	1347322884	/nfs/dbraw/zinc/32/28/84/1347322884.db2.gz	YEELEUYXPSCJPT-WMLDXEAASA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)C(C)(C)C(F)F)C1	ZINC001047966687	1347427194	/nfs/dbraw/zinc/42/71/94/1347427194.db2.gz	SRUIPVFJBQFMRX-CJNGLKHVSA-N	0	3	349.425	3.176	20	30		EGEDHN
CC(C(=O)N1C[C@H](C)[C@@H](CNCc2ccccc2C#N)C1)=C1CCC1	ZINC001048246805	1347501766	/nfs/dbraw/zinc/50/17/66/1347501766.db2.gz	DDDMELLFYKNEBE-YWZLYKJASA-N	0	3	337.467	3.243	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2C=CC=CC=C2)C[C@H]1CNCc1ccccc1C#N	ZINC001048268710	1347506726	/nfs/dbraw/zinc/50/67/26/1347506726.db2.gz	ZPBDTFILGBWCNA-DYESRHJHSA-N	0	3	347.462	3.041	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](C)[C@H](CNCc2nc(C)cs2)C1	ZINC001048337590	1347522378	/nfs/dbraw/zinc/52/23/78/1347522378.db2.gz	DYQWKCGTCHNNQK-DZGCQCFKSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](CNCc2ccn(C(C)C)n2)[C@H](C)C1	ZINC001048340026	1347523147	/nfs/dbraw/zinc/52/31/47/1347523147.db2.gz	NWQMZUSVEKITPE-IAGOWNOFSA-N	0	3	346.519	3.250	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001048345465	1347525459	/nfs/dbraw/zinc/52/54/59/1347525459.db2.gz	UEGXMBFMHWHIIJ-PBHICJAKSA-N	0	3	343.446	3.094	20	30		EGEDHN
C[C@@H]1CN(C(=O)C(C)(C)C2CC2)C[C@@H]1CNCc1ccccc1C#N	ZINC001048347428	1347526345	/nfs/dbraw/zinc/52/63/45/1347526345.db2.gz	DDJLYIAPLMPSFF-QAPCUYQASA-N	0	3	339.483	3.179	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H](C)[C@H](CNCc3ncc(C)s3)C2)CC1	ZINC001048373028	1347533753	/nfs/dbraw/zinc/53/37/53/1347533753.db2.gz	JAFJMQMJZSEFCX-WMLDXEAASA-N	0	3	347.528	3.382	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H](C)[C@H](CNCc3ccccc3C#N)C2)C1	ZINC001048372570	1347533833	/nfs/dbraw/zinc/53/38/33/1347533833.db2.gz	ABOPUPXAGIJWQD-QFBILLFUSA-N	0	3	337.467	3.099	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H](C)[C@H](CNCc3nc(C)c(C)s3)C2)C1	ZINC001048375391	1347535662	/nfs/dbraw/zinc/53/56/62/1347535662.db2.gz	XOXSEFMFXFPUBE-XJKSGUPXSA-N	0	3	347.528	3.300	20	30		EGEDHN
O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)N2CC#Cc1ccccc1)C1CC=CC1	ZINC001048511334	1347572667	/nfs/dbraw/zinc/57/26/67/1347572667.db2.gz	AIVDOZXKOHZPJL-QQFNCUIESA-N	0	3	348.490	3.364	20	30		EGEDHN
C=C(Cl)CN1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)c1cc3occc3[nH]1)C2	ZINC001048531050	1347580455	/nfs/dbraw/zinc/58/04/55/1347580455.db2.gz	FDHKVMFNKUUFSS-BTTYYORXSA-N	0	3	347.846	3.486	20	30		EGEDHN
C=C(Cl)CN1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)c1ccc(C)nc1C)C2	ZINC001048589028	1347609414	/nfs/dbraw/zinc/60/94/14/1347609414.db2.gz	ZGUGDQPYPMFGCW-BJWYYQGGSA-N	0	3	347.890	3.424	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)C2CC3(CC3)C2)CC1	ZINC001048626467	1347624479	/nfs/dbraw/zinc/62/44/79/1347624479.db2.gz	PJWCBFBCSPSUGN-UHFFFAOYSA-N	0	3	339.483	3.251	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3c(Cl)oc4ccccc43)C[C@@H]2C1	ZINC001049001400	1347704327	/nfs/dbraw/zinc/70/43/27/1347704327.db2.gz	RZSBXLPHBZUXNM-OKILXGFUSA-N	0	3	342.826	3.113	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CN(Cc3oc(CC)nc3C)C[C@H]2C1	ZINC001049036074	1347712274	/nfs/dbraw/zinc/71/22/74/1347712274.db2.gz	SNZPBGJUEBUMFS-YRNRMSPPSA-N	0	3	345.487	3.038	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc(Cl)cc3Cl)C[C@@H]2C1	ZINC001049185859	1347741967	/nfs/dbraw/zinc/74/19/67/1347741967.db2.gz	AQEVYHRPTMCMHT-BETUJISGSA-N	0	3	337.250	3.021	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3coc4ccc(Cl)cc43)C[C@@H]2C1	ZINC001049192076	1347743366	/nfs/dbraw/zinc/74/33/66/1347743366.db2.gz	FVWJDWMVARWKHN-OKILXGFUSA-N	0	3	342.826	3.113	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)CC2CCC2)cc1	ZINC001049395419	1347818958	/nfs/dbraw/zinc/81/89/58/1347818958.db2.gz	GEKFVVIHNPRPNL-VQTJNVASSA-N	0	3	337.467	3.314	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)[C@H]2[C@@H]3CCC[C@@H]32)c1	ZINC001049399956	1347822747	/nfs/dbraw/zinc/82/27/47/1347822747.db2.gz	BAFGGSAPLLHDKW-QGLKVJOYSA-N	0	3	349.478	3.170	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H]2[C@H]1CCN2Cc1cccc(C#N)c1)C1CC1	ZINC001049404419	1347827136	/nfs/dbraw/zinc/82/71/36/1347827136.db2.gz	RKVHUHVHRXBWJF-RYGJVYDSSA-N	0	3	337.467	3.170	20	30		EGEDHN
CC1CC(C(=O)N2CCC[C@@H]3[C@@H]2CCN3Cc2cccc(C#N)c2)C1	ZINC001049408015	1347831016	/nfs/dbraw/zinc/83/10/16/1347831016.db2.gz	TZIFWURYVBUROP-AVMZVFHNSA-N	0	3	337.467	3.170	20	30		EGEDHN
CC1CC(C(=O)N2CCC[C@@H]3[C@@H]2CCN3Cc2ccc(C#N)cc2)C1	ZINC001049408030	1347831335	/nfs/dbraw/zinc/83/13/35/1347831335.db2.gz	TZXUUHRJFVNGER-AVMZVFHNSA-N	0	3	337.467	3.170	20	30		EGEDHN
Cc1ccc(F)cc1CN1CC[C@H]2[C@@H]1CCCN2C(=O)C#CC1CC1	ZINC001049466594	1347862312	/nfs/dbraw/zinc/86/23/12/1347862312.db2.gz	GYYFFKZDHMDXRS-PMACEKPBSA-N	0	3	340.442	3.113	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)C1(c2ccc(F)cc2)CC1	ZINC001049509765	1347884640	/nfs/dbraw/zinc/88/46/40/1347884640.db2.gz	YVBIWTKTAPVNAE-ROUUACIJSA-N	0	3	328.431	3.109	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1c(Cl)n[nH]c1C1CC1	ZINC001049514468	1347887064	/nfs/dbraw/zinc/88/70/64/1347887064.db2.gz	FSAFONIJUKBCAG-ZIAGYGMSSA-N	0	3	348.878	3.196	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1ccc(C)cc1Cl	ZINC001049554926	1347907102	/nfs/dbraw/zinc/90/71/02/1347907102.db2.gz	IPNWNSAOECLGLJ-OALUTQOASA-N	0	3	344.886	3.280	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(OC)cc1F	ZINC001049578214	1347918191	/nfs/dbraw/zinc/91/81/91/1347918191.db2.gz	UYHFUDRHBAGXJL-ZWKOTPCHSA-N	0	3	332.419	3.089	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cn1c(C)cc2ccccc21	ZINC001049579400	1347919327	/nfs/dbraw/zinc/91/93/27/1347919327.db2.gz	GMAZSZMZHRODEP-WOJBJXKFSA-N	0	3	337.467	3.201	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(C)c2cccnc12	ZINC001049597944	1347930128	/nfs/dbraw/zinc/93/01/28/1347930128.db2.gz	HPXJOROIVFCCNZ-RTBURBONSA-N	0	3	335.451	3.408	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1ccc(C2CCC2)cc1	ZINC001049622425	1347939739	/nfs/dbraw/zinc/93/97/39/1347939739.db2.gz	UTIZKAUCXTUFOH-RTWAWAEBSA-N	0	3	336.479	3.195	20	30		EGEDHN
C[C@]1(C(=O)N2CCC[C@@H]3[C@H]2CCN3Cc2cccc(C#N)c2)C=CCC1	ZINC001049659452	1347959375	/nfs/dbraw/zinc/95/93/75/1347959375.db2.gz	SMMDBAIITQTYAF-SJBKTWHCSA-N	0	3	349.478	3.480	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1c(F)cccc1F	ZINC001049706474	1347983429	/nfs/dbraw/zinc/98/34/29/1347983429.db2.gz	IYSQMYAPIIWTES-DTDBQYNISA-N	0	3	346.421	3.320	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1c(F)cccc1F	ZINC001049706480	1347983643	/nfs/dbraw/zinc/98/36/43/1347983643.db2.gz	IYSQMYAPIIWTES-KJWYOANISA-N	0	3	346.421	3.320	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]3[C@H]2CCN3Cc2cccnc2C)C1	ZINC001049707646	1347984434	/nfs/dbraw/zinc/98/44/34/1347984434.db2.gz	DSHIAWVPBHFSDH-RTBURBONSA-N	0	3	339.483	3.312	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)C2CC3(CC3)C2)cc1	ZINC001049711187	1347986064	/nfs/dbraw/zinc/98/60/64/1347986064.db2.gz	RQBIIPWCFUKDLT-WOJBJXKFSA-N	0	3	349.478	3.314	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@@H]2CCCN3C(=O)C2CC3(CC3)C2)c1	ZINC001049711820	1347986713	/nfs/dbraw/zinc/98/67/13/1347986713.db2.gz	VSKFYGORRAACDY-PMACEKPBSA-N	0	3	349.478	3.314	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](C)Cc1ccccc1F	ZINC001049714660	1347988632	/nfs/dbraw/zinc/98/86/32/1347988632.db2.gz	PLMOHSJVBUGXBI-PWIZWCRZSA-N	0	3	342.458	3.093	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C(C)(C)c1cccc(F)c1	ZINC001049716557	1347988849	/nfs/dbraw/zinc/98/88/49/1347988849.db2.gz	FLGKRPUQKDVNQR-QZTJIDSGSA-N	0	3	330.447	3.355	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1cccc(Cl)c1F	ZINC001049747846	1347998568	/nfs/dbraw/zinc/99/85/68/1347998568.db2.gz	KUQGBRGGEVDKIZ-HOTGVXAUSA-N	0	3	336.838	3.273	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(Cl)c(OC)c1	ZINC001049762681	1348007771	/nfs/dbraw/zinc/00/77/71/1348007771.db2.gz	RKSJKKZLLSRHRI-HOTGVXAUSA-N	0	3	334.847	3.214	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1sc(C)cc1OC	ZINC001049766584	1348009935	/nfs/dbraw/zinc/00/99/35/1348009935.db2.gz	LUISYKNEBNKQPE-HUUCEWRRSA-N	0	3	334.485	3.320	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1sc(C)cc1OC	ZINC001049766580	1348009989	/nfs/dbraw/zinc/00/99/89/1348009989.db2.gz	LUISYKNEBNKQPE-CABCVRRESA-N	0	3	334.485	3.320	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@@H]2CCCN3C(=O)[C@@H]2C[C@H]2C2CC2)c1	ZINC001049776931	1348015778	/nfs/dbraw/zinc/01/57/78/1348015778.db2.gz	MWMBRNHNCSFEDT-WOZUAGRISA-N	0	3	349.478	3.170	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(F)c2ncccc2c1	ZINC001049789858	1348023415	/nfs/dbraw/zinc/02/34/15/1348023415.db2.gz	IABGQGJTCKXPSC-QZTJIDSGSA-N	0	3	339.414	3.239	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(C)nc1OCC	ZINC001049810956	1348031363	/nfs/dbraw/zinc/03/13/63/1348031363.db2.gz	DPDRWMKISRVPOY-QZTJIDSGSA-N	0	3	343.471	3.044	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cnn(CCCC)c1CC	ZINC001049835233	1348048271	/nfs/dbraw/zinc/04/82/71/1348048271.db2.gz	HBAGEHILKNWUNZ-OALUTQOASA-N	0	3	344.503	3.111	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@](C)(OC)c1ccccc1	ZINC001049846606	1348055585	/nfs/dbraw/zinc/05/55/85/1348055585.db2.gz	KMPOFQOWGSULNP-SBHAEUEKSA-N	0	3	342.483	3.190	20	30		EGEDHN
CC(C)(C)C(=O)N1CCC[C@H]2[C@H]1CCN2Cc1cccc(C#N)c1	ZINC001049859914	1348066976	/nfs/dbraw/zinc/06/69/76/1348066976.db2.gz	XXSUUTRXXHCJLJ-ZWKOTPCHSA-N	0	3	325.456	3.170	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(Cl)ccc1OC	ZINC001049878392	1348083090	/nfs/dbraw/zinc/08/30/90/1348083090.db2.gz	TUTFQNCGKJDDQV-HOTGVXAUSA-N	0	3	334.847	3.214	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)CCc1ccc(CC)cc1	ZINC001049888304	1348092582	/nfs/dbraw/zinc/09/25/82/1348092582.db2.gz	GFWUKDSNCPMHDZ-LEWJYISDSA-N	0	3	338.495	3.270	20	30		EGEDHN
C=CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1scnc1Cl	ZINC001049899238	1348100143	/nfs/dbraw/zinc/10/01/43/1348100143.db2.gz	CUYHGBOCGVOALW-VXGBXAGGSA-N	0	3	325.865	3.052	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1c[nH]c2ccc(C)cc12	ZINC001049919145	1348111914	/nfs/dbraw/zinc/11/19/14/1348111914.db2.gz	ULNDHBUSYYZWLS-WOJBJXKFSA-N	0	3	335.451	3.179	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cnc(CC(C)C)s1	ZINC001049920468	1348113366	/nfs/dbraw/zinc/11/33/66/1348113366.db2.gz	BPXCXMJHHRZEMA-HOTGVXAUSA-N	0	3	345.512	3.044	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cnc(CC(C)C)s1	ZINC001049920474	1348113457	/nfs/dbraw/zinc/11/34/57/1348113457.db2.gz	BPXCXMJHHRZEMA-JKSUJKDBSA-N	0	3	345.512	3.044	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)CCc1ccc(C)s1	ZINC001049928530	1348119236	/nfs/dbraw/zinc/11/92/36/1348119236.db2.gz	UJVVOXWLKJXKPW-QZTJIDSGSA-N	0	3	330.497	3.078	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)Cc3ccc(C)c(Cl)c3)[C@@H]2C1	ZINC001050073919	1348172746	/nfs/dbraw/zinc/17/27/46/1348172746.db2.gz	BESLTZVOZLRNBU-FUHWJXTLSA-N	0	3	332.875	3.300	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)Cc3cccc(C(F)F)c3)[C@@H]2C1	ZINC001050093005	1348180643	/nfs/dbraw/zinc/18/06/43/1348180643.db2.gz	CBIXMQAYXYNKCB-DLBZAZTESA-N	0	3	334.410	3.276	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)C[C@H](C)c3cccc(F)c3)[C@@H]2C1	ZINC001050136839	1348193389	/nfs/dbraw/zinc/19/33/89/1348193389.db2.gz	LTAQXUMYROKRAM-VDZJLULYSA-N	0	3	330.447	3.428	20	30		EGEDHN
C#CCCN1C[C@@H]2CCCN(C(=O)c3cc4occc4s3)[C@@H]2C1	ZINC001050138274	1348193852	/nfs/dbraw/zinc/19/38/52/1348193852.db2.gz	WRMZUJDYWIPLCA-UONOGXRCSA-N	0	3	328.437	3.054	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)[C@H](CC)Cc3ccccc3)[C@@H]2C1	ZINC001050154279	1348198940	/nfs/dbraw/zinc/19/89/40/1348198940.db2.gz	NATQFDRVMHKMPA-QHAWAJNXSA-N	0	3	338.495	3.201	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)C[C@@H]3CCc4ccccc43)[C@@H]2C1	ZINC001050167074	1348201751	/nfs/dbraw/zinc/20/17/51/1348201751.db2.gz	LBHGZVCMZACNSF-IRFCIJBXSA-N	0	3	336.479	3.053	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)CCc3ccc(Cl)s3)[C@@H]2C1	ZINC001050199878	1348209782	/nfs/dbraw/zinc/20/97/82/1348209782.db2.gz	DOKHTTCBESLBGB-DZGCQCFKSA-N	0	3	338.904	3.443	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cc4ccccc4nc3C)C2)CC1	ZINC001050537768	1348285869	/nfs/dbraw/zinc/28/58/69/1348285869.db2.gz	YCKXDJIQZJVWFB-UHFFFAOYSA-N	0	3	347.462	3.105	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC2(C1)CCN(CCC(F)(F)F)CC2	ZINC001050614065	1348302978	/nfs/dbraw/zinc/30/29/78/1348302978.db2.gz	LVTHZHJBXYVMRV-UHFFFAOYSA-N	0	3	332.410	3.466	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@H](C)c3ccc(Cl)cc3)C2)CC1	ZINC001050643844	1348312816	/nfs/dbraw/zinc/31/28/16/1348312816.db2.gz	SJSNEWCSSFVKOA-OAHLLOKOSA-N	0	3	330.859	3.001	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@H]3CCCCc4ccccc43)C2)CC1	ZINC001050767425	1348353096	/nfs/dbraw/zinc/35/30/96/1348353096.db2.gz	CRPYIDGGFQSXLE-FQEVSTJZSA-N	0	3	336.479	3.054	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@]3(C)CCC(C)=C(C)C3)C2)CC1	ZINC001050768743	1348353918	/nfs/dbraw/zinc/35/39/18/1348353918.db2.gz	CJCVKMDANWNWOF-HXUWFJFHSA-N	0	3	328.500	3.461	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H](C)Cc3ccccc3C)C2)CC1	ZINC001050769572	1348354026	/nfs/dbraw/zinc/35/40/26/1348354026.db2.gz	XPFHYEIZNQLSEU-LJQANCHMSA-N	0	3	338.495	3.121	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)[C@H]3CCC[C@@H]3OC)cccc2C1	ZINC001051292489	1348421583	/nfs/dbraw/zinc/42/15/83/1348421583.db2.gz	ZEMRKGKLKUJHHW-PMACEKPBSA-N	0	3	342.483	3.052	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)[C@@H]3CCO[C@H]3CC)cccc2C1	ZINC001051294703	1348422981	/nfs/dbraw/zinc/42/29/81/1348422981.db2.gz	OQMCXNPJCQVWKG-UXHICEINSA-N	0	3	342.483	3.052	20	30		EGEDHN
Cc1cccc(C(=O)N[C@@H]2CCCN(Cc3cccc(C#N)c3)CC2)n1	ZINC001052207720	1348511553	/nfs/dbraw/zinc/51/15/53/1348511553.db2.gz	FLHHXBUHNSDIDI-LJQANCHMSA-N	0	3	348.450	3.046	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@@H]2[C@@H](c3ccccc3)C2(C)C)CC1	ZINC001052387950	1348538491	/nfs/dbraw/zinc/53/84/91/1348538491.db2.gz	XYUHZXJYLKLHCU-AQNXPRMDSA-N	0	3	338.495	3.420	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2cc3cccc(C)c3s2)CC1	ZINC001052501443	1348560885	/nfs/dbraw/zinc/56/08/85/1348560885.db2.gz	CUFLEVXNUSNFNH-INIZCTEOSA-N	0	3	326.465	3.427	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)Cc2ccc(C)cc2Cl)CC1	ZINC001052503994	1348561309	/nfs/dbraw/zinc/56/13/09/1348561309.db2.gz	XLNPWHPHJMXASS-QGZVFWFLSA-N	0	3	332.875	3.185	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@@H]2CCc3c2cccc3Cl)CC1	ZINC001052565932	1348580780	/nfs/dbraw/zinc/58/07/80/1348580780.db2.gz	IJVONEVASZYFLD-CRAIPNDOSA-N	0	3	344.886	3.364	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H](NC(=O)[C@H]3C[C@H]4C[C@H]4C3)CC2)cc1	ZINC001052643392	1348609728	/nfs/dbraw/zinc/60/97/28/1348609728.db2.gz	IGKGTANWAANXAP-FUMNGEBKSA-N	0	3	337.467	3.075	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)s2)CC1	ZINC001052653222	1348614972	/nfs/dbraw/zinc/61/49/72/1348614972.db2.gz	ISRYXLQQQWQNAI-MGPQQGTHSA-N	0	3	336.888	3.109	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2CC)CC1	ZINC001052663809	1348618671	/nfs/dbraw/zinc/61/86/71/1348618671.db2.gz	ZJPLCQYOYQUSNP-SESVDKBCSA-N	0	3	338.495	3.347	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2c(F)ccc(F)c2Cl)CC1	ZINC001052737289	1348653671	/nfs/dbraw/zinc/65/36/71/1348653671.db2.gz	KDFJZLLOTBWSDU-GFCCVEGCSA-N	0	3	340.801	3.226	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@@]2(C)CCCc3ccccc32)CC1	ZINC001052795809	1348683524	/nfs/dbraw/zinc/68/35/24/1348683524.db2.gz	NLEHDSHUGXEDHQ-KNQAVFIVSA-N	0	3	338.495	3.275	20	30		EGEDHN
CC(=O)N1CCC[C@@H]([C@@H]2CCCN(Cc3ccc(F)c(C#N)c3)C2)C1	ZINC001052998075	1348795351	/nfs/dbraw/zinc/79/53/51/1348795351.db2.gz	UVQUFIKRYYABBV-QZTJIDSGSA-N	0	3	343.446	3.168	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCC[C@@H]([C@@H]2CCCN(CCF)C2)C1	ZINC001053029169	1348828104	/nfs/dbraw/zinc/82/81/04/1348828104.db2.gz	QFTWTGSZYZJQAG-QZTJIDSGSA-N	0	3	347.478	3.208	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2c(C)coc2C)C1	ZINC001053082664	1348904036	/nfs/dbraw/zinc/90/40/36/1348904036.db2.gz	GKHHZZYEZXYLRV-ZWKOTPCHSA-N	0	3	328.456	3.236	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(C)nc(C)c2)C1	ZINC001053087203	1348910716	/nfs/dbraw/zinc/91/07/16/1348910716.db2.gz	RJMKQEXIUJUFHL-QUCCMNQESA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ncc(C)cc2C)C1	ZINC001053089556	1348915470	/nfs/dbraw/zinc/91/54/70/1348915470.db2.gz	CFUGKIAOTHKXCA-MOPGFXCFSA-N	0	3	339.483	3.038	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)[C@H]2C[C@H]3C[C@H]3C2)C1	ZINC001053094286	1348923377	/nfs/dbraw/zinc/92/33/77/1348923377.db2.gz	DBLALVSFRTVVJL-CENDIDJXSA-N	0	3	328.500	3.149	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cc(C)cc(F)c2)C1	ZINC001053098034	1348929621	/nfs/dbraw/zinc/92/96/21/1348929621.db2.gz	JHQVFYBUWQLLRC-PXNSSMCTSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)CCc2ccc(C)o2)C1	ZINC001053105418	1348942444	/nfs/dbraw/zinc/94/24/44/1348942444.db2.gz	OJBHQYJMJZYNBF-UYAOXDASSA-N	0	3	342.483	3.247	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cc(F)cc(F)c2)C1	ZINC001053106610	1348944589	/nfs/dbraw/zinc/94/45/89/1348944589.db2.gz	UWESKCJEYTUATR-DNVCBOLYSA-N	0	3	346.421	3.305	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc(Cl)ccc1F)C2	ZINC001054161261	1349163863	/nfs/dbraw/zinc/16/38/63/1349163863.db2.gz	AACMHEBTWOYMIF-IBGZPJMESA-N	0	3	348.849	3.431	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)CCc1ccc(Cl)cc1)C2	ZINC001054172767	1349173980	/nfs/dbraw/zinc/17/39/80/1349173980.db2.gz	WYMVSYYZLRPIQS-FQEVSTJZSA-N	0	3	344.886	3.220	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N1CCC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001054179938	1349182024	/nfs/dbraw/zinc/18/20/24/1349182024.db2.gz	KUHZOSADVMSAMU-LRQRDZAKSA-N	0	3	337.467	3.029	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc[nH]c1C(C)C)C2	ZINC001054182051	1349184318	/nfs/dbraw/zinc/18/43/18/1349184318.db2.gz	DCMPEYWMZBJHBY-FQEVSTJZSA-N	0	3	327.472	3.090	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1occc1C(C)C)C2	ZINC001054184044	1349186828	/nfs/dbraw/zinc/18/68/28/1349186828.db2.gz	WKVWQWSGHLLNLW-HXUWFJFHSA-N	0	3	328.456	3.354	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@H](F)c1ccccc1)C2	ZINC001054204901	1349207095	/nfs/dbraw/zinc/20/70/95/1349207095.db2.gz	FTNAGZOUJUDFCQ-QUCCMNQESA-N	0	3	328.431	3.035	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc(Cl)ccc1C)C2	ZINC001054216286	1349215242	/nfs/dbraw/zinc/21/52/42/1349215242.db2.gz	ROLXUUHJJZOLLO-LJQANCHMSA-N	0	3	330.859	3.210	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(Cl)s1)C2	ZINC001054235930	1349228611	/nfs/dbraw/zinc/22/86/11/1349228611.db2.gz	DTYGFWMSWZDJBU-QGZVFWFLSA-N	0	3	336.888	3.353	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1sccc1C1CC1)C2	ZINC001054236676	1349229137	/nfs/dbraw/zinc/22/91/37/1349229137.db2.gz	MNQWXGOAYRNZJK-IBGZPJMESA-N	0	3	328.481	3.187	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc(C)n(C(C)C)c1C)C2	ZINC001054238278	1349231793	/nfs/dbraw/zinc/23/17/93/1349231793.db2.gz	OVEMPYPVKRRWIA-NRFANRHFSA-N	0	3	341.499	3.247	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)CCc1cc(C)sc1C)C2	ZINC001054245826	1349239617	/nfs/dbraw/zinc/23/96/17/1349239617.db2.gz	FFOFTHUASDUFKX-HXUWFJFHSA-N	0	3	344.524	3.245	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)C1(C(F)(F)F)CCCC1)C2	ZINC001054249350	1349244655	/nfs/dbraw/zinc/24/46/55/1349244655.db2.gz	SVVKIQHJJSQMDP-MRXNPFEDSA-N	0	3	342.405	3.057	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3ccc(C#N)[nH]3)cc2C1	ZINC001054261465	1349258384	/nfs/dbraw/zinc/25/83/84/1349258384.db2.gz	FDIHYCGYGCZGGR-UHFFFAOYSA-N	0	3	334.423	3.098	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3ccc(COC)o3)cc2C1	ZINC001054273642	1349274058	/nfs/dbraw/zinc/27/40/58/1349274058.db2.gz	UXWWKDNFNFLKJR-UHFFFAOYSA-N	0	3	340.423	3.248	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@H]3C[C@@H](C)CO3)cc2C1	ZINC001054274636	1349274962	/nfs/dbraw/zinc/27/49/62/1349274962.db2.gz	NLCJVDVTAQSHQL-DNVCBOLYSA-N	0	3	328.456	3.010	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@@H]3CCO[C@@H]3C)cc2C1	ZINC001054286505	1349289183	/nfs/dbraw/zinc/28/91/83/1349289183.db2.gz	INNAMLUZRVWQRW-DNVCBOLYSA-N	0	3	328.456	3.010	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@@H]3CCCC[C@@H]3OC)cc2C1	ZINC001054293278	1349300655	/nfs/dbraw/zinc/30/06/55/1349300655.db2.gz	ZCBSREZVNVURRB-UXHICEINSA-N	0	3	342.483	3.400	20	30		EGEDHN
Cc1ccc(C(=O)N2C[C@@H](C)[C@H](NCc3ccc(C#N)s3)C2)s1	ZINC001054340673	1349319894	/nfs/dbraw/zinc/31/98/94/1349319894.db2.gz	WIHWNPIUFWZHSZ-IAQYHMDHSA-N	0	3	345.493	3.240	20	30		EGEDHN
Cc1ccc(C(=O)N2C[C@H](NCc3ccc(C#N)s3)[C@@H](C)C2)s1	ZINC001054340676	1349320220	/nfs/dbraw/zinc/32/02/20/1349320220.db2.gz	WIHWNPIUFWZHSZ-NHYWBVRUSA-N	0	3	345.493	3.240	20	30		EGEDHN
Cc1ccsc1C(=O)N1C[C@@H](C)[C@@H](NCc2ccc(C#N)s2)C1	ZINC001054341413	1349321359	/nfs/dbraw/zinc/32/13/59/1349321359.db2.gz	ZQJMNGMEJWLYLH-DOMZBBRYSA-N	0	3	345.493	3.240	20	30		EGEDHN
C[C@H]1CN(C(=O)CC2CCCC2)C[C@H]1NCc1ccc(C#N)c(F)c1	ZINC001054347021	1349326397	/nfs/dbraw/zinc/32/63/97/1349326397.db2.gz	MSDPYDWDCCKEPS-IFXJQAMLSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@@H](C)[C@@H](NCc2cnc(C)s2)C1	ZINC001054677206	1349434322	/nfs/dbraw/zinc/43/43/22/1349434322.db2.gz	DWHKPHJSDOPEGT-YGRLFVJLSA-N	0	3	341.908	3.167	20	30		EGEDHN
C[C@H]1CN(C(=O)C2(C3CC3)CCC2)C[C@H]1NCc1ccc(C#N)s1	ZINC001054933590	1349517404	/nfs/dbraw/zinc/51/74/04/1349517404.db2.gz	BQQNWXHAABFCSV-SUMWQHHRSA-N	0	3	343.496	3.137	20	30		EGEDHN
C=CCCN1C[C@@H](C)[C@H](NC(=O)c2cnc(-c3ccoc3)s2)C1	ZINC001080574285	1357682274	/nfs/dbraw/zinc/68/22/74/1357682274.db2.gz	UETRAPQXLKALBA-TZMCWYRMSA-N	0	3	331.441	3.029	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)CC1CCCCC1)C[C@H](C)O2	ZINC001071131880	1354469477	/nfs/dbraw/zinc/46/94/77/1354469477.db2.gz	NXTMAERFMNQBAI-PXNSSMCTSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C1CCCCCC1)C[C@@H](C)O2	ZINC001071142820	1354475178	/nfs/dbraw/zinc/47/51/78/1354475178.db2.gz	UZHHDHBTMSNXMO-XLIONFOSSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1ccccc1CC)C[C@@H](C)O2	ZINC001071201907	1354502953	/nfs/dbraw/zinc/50/29/53/1354502953.db2.gz	MPLKDGSVYFEDHK-DYESRHJHSA-N	0	3	342.483	3.131	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1c(C)cccc1C)C[C@@H](C)O2	ZINC001071211366	1354507614	/nfs/dbraw/zinc/50/76/14/1354507614.db2.gz	GRLSPYJGEUSWKJ-WIYYLYMNSA-N	0	3	342.483	3.185	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1cc(C)c(CC)o1)C[C@H](C)O2	ZINC001071227710	1354514691	/nfs/dbraw/zinc/51/46/91/1354514691.db2.gz	IWGPDIOTAYWMQM-JXFKEZNVSA-N	0	3	346.471	3.032	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1cc(C)ccc1C)C[C@H](C)O2	ZINC001071235839	1354519956	/nfs/dbraw/zinc/51/99/56/1354519956.db2.gz	LDQNKWILYQRWRG-RXVVDRJESA-N	0	3	342.483	3.185	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C13CCC(CC1)CC3)C[C@H](C)O2	ZINC001071244119	1354524254	/nfs/dbraw/zinc/52/42/54/1354524254.db2.gz	PSAWGUWKRFHQOG-CZOVOBHWSA-N	0	3	346.515	3.225	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3cccc(F)c3C)C2)CC1	ZINC001086923876	1359249880	/nfs/dbraw/zinc/24/98/80/1359249880.db2.gz	CULMNHOVHATVPH-MRXNPFEDSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)Cc2coc3ccc(C)cc23)CC[C@H]1C	ZINC001071541561	1354754974	/nfs/dbraw/zinc/75/49/74/1354754974.db2.gz	AOZGLLXRDCGOBQ-SJLPKXTDSA-N	0	3	338.451	3.276	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cnn(C(C)(C)C)c2C)CC[C@@H]1C	ZINC001071544305	1354758078	/nfs/dbraw/zinc/75/80/78/1354758078.db2.gz	WTXPDCKEHAARCS-HOCLYGCPSA-N	0	3	332.492	3.105	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc3cc(C)cn3c2)CC[C@@H]1C	ZINC001071558194	1354764476	/nfs/dbraw/zinc/76/44/76/1354764476.db2.gz	ZKCHNMLFDGSFOG-WMZOPIPTSA-N	0	3	325.456	3.407	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(N(C)C)cc2F)CC[C@H]1C	ZINC001071567663	1354766985	/nfs/dbraw/zinc/76/69/85/1354766985.db2.gz	AWOJPMWOZVXGQK-CABCVRRESA-N	0	3	333.451	3.051	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccnn2C(CC)CC)CC[C@@H]1C	ZINC001071568246	1354767699	/nfs/dbraw/zinc/76/76/99/1354767699.db2.gz	KZCJPOSNULQPPQ-JKSUJKDBSA-N	0	3	332.492	3.403	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2(C)CCC(F)(F)CC2)CC[C@@H]1C	ZINC001071612922	1354797060	/nfs/dbraw/zinc/79/70/60/1354797060.db2.gz	PCHARFOCWGSRCI-LSDHHAIUSA-N	0	3	326.431	3.194	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2c(C)c(F)ccc2Cl)CC[C@H]1C	ZINC001071624191	1354807219	/nfs/dbraw/zinc/80/72/19/1354807219.db2.gz	FMOSDIDPVXYZCG-TZMCWYRMSA-N	0	3	336.838	3.394	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc(C(C)C)nn2CC)CC[C@@H]1C	ZINC001071642602	1354821049	/nfs/dbraw/zinc/82/10/49/1354821049.db2.gz	SZIDGHDGMKUVOX-JKSUJKDBSA-N	0	3	332.492	3.185	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cnn(-c3ccccc3)c2)CC[C@@H]1C	ZINC001071662297	1354833903	/nfs/dbraw/zinc/83/39/03/1354833903.db2.gz	BSJREIMFJKJJOP-WMZOPIPTSA-N	0	3	338.455	3.031	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CC[C@H](C)N(Cc3ccccc3C)C2)c1	ZINC001071816016	1354957439	/nfs/dbraw/zinc/95/74/39/1354957439.db2.gz	SYZGEMNVLGJURH-LAUBAEHRSA-N	0	3	347.462	3.154	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(C3CC3)nc2C)CC[C@@H]1C	ZINC001071831549	1354967475	/nfs/dbraw/zinc/96/74/75/1354967475.db2.gz	IQSSXZBOXXLDQZ-WMLDXEAASA-N	0	3	327.472	3.426	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2oc(CC(C)C)nc2C)CC[C@H]1C	ZINC001071882850	1355003622	/nfs/dbraw/zinc/00/36/22/1355003622.db2.gz	BFRDYOYFUPUKEH-ZBFHGGJFSA-N	0	3	333.476	3.340	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cccc(C(F)(F)F)n2)CC[C@H]1C	ZINC001071931556	1355032354	/nfs/dbraw/zinc/03/23/54/1355032354.db2.gz	XGGKVFNDEMSZQV-OLZOCXBDSA-N	0	3	341.377	3.259	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C2(c3ccccc3F)CC2)CC[C@H]1C	ZINC001071957817	1355042972	/nfs/dbraw/zinc/04/29/72/1355042972.db2.gz	NZWSOPJTVSXNTQ-HZPDHXFCSA-N	0	3	330.447	3.403	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccccc2OC(C)C)CC[C@H]1C	ZINC001072008260	1355072353	/nfs/dbraw/zinc/07/23/53/1355072353.db2.gz	CVXDZYZHBRRAER-IAGOWNOFSA-N	0	3	328.456	3.080	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2(c3ccccc3)CCCC2)CC[C@@H]1C	ZINC001072053918	1355105280	/nfs/dbraw/zinc/10/52/80/1355105280.db2.gz	WKNVHYLUKISFQX-AZUAARDMSA-N	0	3	338.495	3.491	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H]1COc2ccccc21	ZINC001089735758	1360640887	/nfs/dbraw/zinc/64/08/87/1360640887.db2.gz	HSLDRYSTPFVAOX-AEFFLSMTSA-N	0	3	342.483	3.346	20	30		EGEDHN
C[C@H]1CCN(C(=O)C(C)(C)F)C[C@H]1CNCc1cc(F)ccc1C#N	ZINC001072156137	1355157169	/nfs/dbraw/zinc/15/71/69/1355157169.db2.gz	KUMVMOGMZOJIIB-XJKSGUPXSA-N	0	3	349.425	3.020	20	30		EGEDHN
C/C=C(/C)C(=O)N1CC[C@H](C)[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001072240890	1355201017	/nfs/dbraw/zinc/20/10/17/1355201017.db2.gz	ONVNKNYKAJGGKP-PIUYJEMPSA-N	0	3	343.446	3.238	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](C)[C@@H](CNCc2ocnc2C)C1	ZINC001072334732	1355243797	/nfs/dbraw/zinc/24/37/97/1355243797.db2.gz	GSPCVRVDAPOVMJ-ZBFHGGJFSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](C)[C@H](CNCc3nccs3)C2)C1	ZINC001072360511	1355257120	/nfs/dbraw/zinc/25/71/20/1355257120.db2.gz	RCHSEZRPVQCSCD-HUUCEWRRSA-N	0	3	333.501	3.074	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)CC4=CCCCC4)C3)C2)c1	ZINC001072550106	1355330306	/nfs/dbraw/zinc/33/03/06/1355330306.db2.gz	LIGGNWGJFDTQLS-UHFFFAOYSA-N	0	3	349.478	3.483	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)C3(c4cccc(Cl)c4)CC3)C2)C1	ZINC001072800124	1355444252	/nfs/dbraw/zinc/44/42/52/1355444252.db2.gz	CSXIQKUYAYXUMF-UHFFFAOYSA-N	0	3	330.859	3.092	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3cc4cccc(Cl)c4o3)C2)C1	ZINC001073497530	1355824680	/nfs/dbraw/zinc/82/46/80/1355824680.db2.gz	SHDCVUNADWNQNJ-UHFFFAOYSA-N	0	3	330.815	3.420	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2ccc(CCC)cc2)C1	ZINC001073752256	1355889285	/nfs/dbraw/zinc/88/92/85/1355889285.db2.gz	SPHBWOMCYBPQLL-IBGZPJMESA-N	0	3	330.472	3.036	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2sccc2C2CC2)C1	ZINC001073877977	1355934047	/nfs/dbraw/zinc/93/40/47/1355934047.db2.gz	FEDBUQQLJPIICP-OAHLLOKOSA-N	0	3	334.485	3.022	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2sccc2C(C)C)C1	ZINC001073899266	1355946626	/nfs/dbraw/zinc/94/66/26/1355946626.db2.gz	PCWKCRKFFIDRKD-HNNXBMFYSA-N	0	3	336.501	3.268	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2cc3c(cccc3C)o2)C1	ZINC001073904865	1355947694	/nfs/dbraw/zinc/94/76/94/1355947694.db2.gz	PDJCARDOJJHOKJ-MRXNPFEDSA-N	0	3	342.439	3.138	20	30		EGEDHN
C[C@H]1[C@@H](NCc2ccc(C#N)c(F)c2)CCN1C(=O)[C@@H]1CCC1(C)C	ZINC001074815590	1356252002	/nfs/dbraw/zinc/25/20/02/1356252002.db2.gz	FNFULGXKTFKOQR-OWQGQXMQSA-N	0	3	343.446	3.213	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@H](CNCc2cc(F)ccc2C#N)[C@@H](C)C1	ZINC001075209997	1356343907	/nfs/dbraw/zinc/34/39/07/1356343907.db2.gz	UIICGPZNXPBBDZ-DOTOQJQBSA-N	0	3	343.446	3.238	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cc(C)c(OC)c(C)c3)[C@@H]2C1	ZINC001075822423	1356428524	/nfs/dbraw/zinc/42/85/24/1356428524.db2.gz	QVCGSHHCVXWOAJ-FUHWJXTLSA-N	0	3	328.456	3.034	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cc(Cl)c(Cl)[nH]3)[C@@H]2C1	ZINC001076105635	1356491260	/nfs/dbraw/zinc/49/12/60/1356491260.db2.gz	LHZATLLEACVREU-GXFFZTMASA-N	0	3	328.243	3.044	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3c3ccccc3CC)[C@@H]2C1	ZINC001076186757	1356514574	/nfs/dbraw/zinc/51/45/74/1356514574.db2.gz	KOQISSOZUQNOIK-MJUUVYJYSA-N	0	3	338.495	3.461	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccc4nc(C)ccc4c3)[C@@H]2C1	ZINC001076386571	1356564681	/nfs/dbraw/zinc/56/46/81/1356564681.db2.gz	YRHLXUOTVRHNDC-AZUAARDMSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccc(C(F)F)cc3F)[C@@H]2C1	ZINC001076402395	1356571448	/nfs/dbraw/zinc/57/14/48/1356571448.db2.gz	SDSBKTJMXMRZEV-XJKSGUPXSA-N	0	3	338.373	3.486	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3coc(C4CCCC4)n3)[C@@H]2C1	ZINC001076411918	1356572271	/nfs/dbraw/zinc/57/22/71/1356572271.db2.gz	FKBAXHDHYQGVRF-DOTOQJQBSA-N	0	3	329.444	3.055	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccc(OC)c(Cl)c3)[C@@H]2C1	ZINC001076548638	1356615643	/nfs/dbraw/zinc/61/56/43/1356615643.db2.gz	AYNKNILWNDPPLQ-GOEBONIOSA-N	0	3	334.847	3.071	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)C(C)(C)C(C)(F)F	ZINC001099325513	1363751576	/nfs/dbraw/zinc/75/15/76/1363751576.db2.gz	WGBSZUXFWJDKIN-CQSZACIVSA-N	0	3	328.447	3.298	20	30		EGEDHN
CCCCCCCCOCC(=O)N1CC[C@@H](NC[C@@H](F)CC)C1	ZINC001183296210	1387293189	/nfs/dbraw/zinc/29/31/89/1387293189.db2.gz	WNZGZGPASQTENX-DLBZAZTESA-N	0	3	330.488	3.302	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)Cc2ccc(CC)cc2)C[C@H]1c1ccccc1	ZINC001081189451	1357848519	/nfs/dbraw/zinc/84/85/19/1357848519.db2.gz	WDYGGQHZGSJHSB-FCHUYYIVSA-N	0	3	346.474	3.009	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2cc3c(s2)CCCC3)[C@H](OC)C1	ZINC001082357172	1358021560	/nfs/dbraw/zinc/02/15/60/1358021560.db2.gz	LKLSOOWLVSMOMO-HZPDHXFCSA-N	0	3	348.512	3.022	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@H]2CCC(C)(C)C2)C[C@H]1NCc1ccc(C#N)s1	ZINC001082726526	1358081330	/nfs/dbraw/zinc/08/13/30/1358081330.db2.gz	JAXBETDKRDGHGJ-JKIFEVAISA-N	0	3	345.512	3.383	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)[C@H]3CC[C@H](C4CCC4)CC3)[C@H]2C1	ZINC001083111310	1358119064	/nfs/dbraw/zinc/11/90/64/1358119064.db2.gz	ZXQCWFHDQJUEAE-LWYYNNOASA-N	0	3	346.515	3.081	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)[C@@H](CC)CC3CCCC3)[C@H]2C1	ZINC001083212924	1358124205	/nfs/dbraw/zinc/12/42/05/1358124205.db2.gz	GZPISRBGBSHCMK-GBESFXJTSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)[C@H](CC)CC3CCCC3)[C@H]2C1	ZINC001083213254	1358124899	/nfs/dbraw/zinc/12/48/99/1358124899.db2.gz	STHZVDFVHXODEK-HSALFYBXSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)c3cccc(C(C)C)c3)[C@H]2C1	ZINC001083240253	1358125211	/nfs/dbraw/zinc/12/52/11/1358125211.db2.gz	XHYVPIHZHMTTJJ-VQTJNVASSA-N	0	3	342.483	3.301	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)c3cccc(C)c3Cl)[C@H]2C1	ZINC001083226412	1358125879	/nfs/dbraw/zinc/12/58/79/1358125879.db2.gz	DSORTDIVJRHKSY-DLBZAZTESA-N	0	3	348.874	3.140	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)c3ccc(C4CC4)cc3)[C@H]2C1	ZINC001083281600	1358128137	/nfs/dbraw/zinc/12/81/37/1358128137.db2.gz	UTDVETJNIJUNFL-VQTJNVASSA-N	0	3	340.467	3.055	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)[C@@H]3CCCCC3(C)C)[C@H]2C1	ZINC001083287497	1358129679	/nfs/dbraw/zinc/12/96/79/1358129679.db2.gz	LDVYMEZQRNUWJP-OKZBNKHCSA-N	0	3	334.504	3.081	20	30		EGEDHN
CC(C)c1ccccc1CN1CC[C@@H]2CN(C(=O)[C@H](C)C#N)[C@@H]2C1	ZINC001084231736	1358167961	/nfs/dbraw/zinc/16/79/61/1358167961.db2.gz	JVOPGELVTXEIGV-SZVBFZGTSA-N	0	3	325.456	3.002	20	30		EGEDHN
C=CCn1cccc1C(=O)N1C[C@H]2CCN(Cc3ccccc3C)C[C@H]21	ZINC001084409036	1358208826	/nfs/dbraw/zinc/20/88/26/1358208826.db2.gz	GTMIHBGEBOBXQE-TZIWHRDSSA-N	0	3	349.478	3.329	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)CCc3ncc(C(C)(C)C)o3)[C@@H]2C1	ZINC001084415275	1358210222	/nfs/dbraw/zinc/21/02/22/1358210222.db2.gz	NQIMLNASRZVMRZ-HZPDHXFCSA-N	0	3	345.487	3.014	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3cc(C)oc3C(F)(F)F)[C@@H]2C1	ZINC001084689764	1358281578	/nfs/dbraw/zinc/28/15/78/1358281578.db2.gz	RRWKQCMQHJWWHB-TZMCWYRMSA-N	0	3	342.361	3.329	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3cc(-c4ccccc4)ccn3)[C@@H]2C1	ZINC001084739848	1358297148	/nfs/dbraw/zinc/29/71/48/1358297148.db2.gz	FJRMZVHDKFFCTB-TZIWHRDSSA-N	0	3	347.462	3.471	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3ccsc3C(F)(F)F)[C@@H]2C1	ZINC001084798056	1358313844	/nfs/dbraw/zinc/31/38/44/1358313844.db2.gz	XTPMMVGJQGLHAB-DGCLKSJQSA-N	0	3	344.402	3.489	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3sc(CCC)nc3C)[C@@H]2C1	ZINC001084829114	1358323205	/nfs/dbraw/zinc/32/32/05/1358323205.db2.gz	QABCIDJKKHJFGT-HUUCEWRRSA-N	0	3	333.501	3.126	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@H]2CCN(Cc3cccc(C#N)c3)[C@H]2C1)C1CC1	ZINC001084913238	1358345609	/nfs/dbraw/zinc/34/56/09/1358345609.db2.gz	FYCHABQFWUEJNP-BEVDRBHNSA-N	0	3	337.467	3.027	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@H]3CCCc4ccccc43)C[C@@H]21	ZINC001084971968	1358357450	/nfs/dbraw/zinc/35/74/50/1358357450.db2.gz	JGQNUGRFIPYGQQ-GIVPXCGWSA-N	0	3	336.479	3.053	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)C[C@H]3CCCc4ccccc43)C[C@@H]21	ZINC001085079369	1358385114	/nfs/dbraw/zinc/38/51/14/1358385114.db2.gz	AKOOBXZVEOPRBS-SBHAEUEKSA-N	0	3	336.479	3.053	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@H](CC)c3ccc(OC)cc3)C[C@@H]21	ZINC001085099312	1358391152	/nfs/dbraw/zinc/39/11/52/1358391152.db2.gz	MQMIVMLNWOCXJO-RLLQIKCJSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)C(C)(C)[C@H]1CCCCO1	ZINC001085201187	1358432291	/nfs/dbraw/zinc/43/22/91/1358432291.db2.gz	TUVNMKKWQFEJMY-BZUAXINKSA-N	0	3	342.911	3.351	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)Cc1ccc(F)cc1F	ZINC001085206666	1358433322	/nfs/dbraw/zinc/43/33/22/1358433322.db2.gz	GWAZJPNJRRPPRC-HZPDHXFCSA-N	0	3	342.817	3.277	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cncc(Cl)c1C	ZINC001085232813	1358439353	/nfs/dbraw/zinc/43/93/53/1358439353.db2.gz	ZRZBCZSFMJZGDR-HUUCEWRRSA-N	0	3	342.270	3.427	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cn2ccc(C)cc2n1	ZINC001085263056	1358446969	/nfs/dbraw/zinc/44/69/69/1358446969.db2.gz	VTAHEENSNBAWEF-HUUCEWRRSA-N	0	3	346.862	3.026	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1nc(Cl)sc1C	ZINC001085269295	1358448304	/nfs/dbraw/zinc/44/83/04/1358448304.db2.gz	RZKUORQCKOFJQA-GHMZBOCLSA-N	0	3	348.299	3.488	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cccc2c1OCC2	ZINC001085341210	1358471567	/nfs/dbraw/zinc/47/15/67/1358471567.db2.gz	IMKKFAGVTFVYHF-HZPDHXFCSA-N	0	3	334.847	3.005	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cncc(Cl)c1	ZINC001085363670	1358479182	/nfs/dbraw/zinc/47/91/82/1358479182.db2.gz	QTIUHCOWYGRJJM-ZIAGYGMSSA-N	0	3	328.243	3.118	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1ccc(F)c(C(F)F)c1	ZINC001085598930	1358624831	/nfs/dbraw/zinc/62/48/31/1358624831.db2.gz	DGSMKYFLIKCKTF-CYBMUJFWSA-N	0	3	326.362	3.486	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc(C(C)(C)C)cn1	ZINC001085600138	1358625472	/nfs/dbraw/zinc/62/54/72/1358625472.db2.gz	LQKVEHXDXKDUBW-KRWDZBQOSA-N	0	3	329.488	3.492	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1c(F)ccc2ccncc21	ZINC001085610696	1358632691	/nfs/dbraw/zinc/63/26/91/1358632691.db2.gz	ZGLZJKCWVATAJS-INIZCTEOSA-N	0	3	341.430	3.486	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cnn2c1ccc(C)c2C	ZINC001085647875	1358659634	/nfs/dbraw/zinc/65/96/34/1358659634.db2.gz	XBPPGAJUMBGSTG-KRWDZBQOSA-N	0	3	340.471	3.064	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1nccc2ccsc21	ZINC001085651506	1358660604	/nfs/dbraw/zinc/66/06/04/1358660604.db2.gz	VXFNLJGYKUWGMC-OAHLLOKOSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc(C)n([C@@H](C)CC)n1	ZINC001085685213	1358686950	/nfs/dbraw/zinc/68/69/50/1358686950.db2.gz	LYIQRLNUOLJOJP-DOTOQJQBSA-N	0	3	332.492	3.275	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc(C(F)(F)F)cn1	ZINC001085753952	1358733620	/nfs/dbraw/zinc/73/36/20/1358733620.db2.gz	VFFCQSXWSXLMBB-AWEZNQCLSA-N	0	3	341.377	3.213	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc(C(F)(F)F)nc1	ZINC001085753929	1358733797	/nfs/dbraw/zinc/73/37/97/1358733797.db2.gz	UUWWUJWIHYHRIV-CQSZACIVSA-N	0	3	341.377	3.213	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1c(F)ccc(F)c1F	ZINC001085792288	1358767751	/nfs/dbraw/zinc/76/77/51/1358767751.db2.gz	GGLJLJQVIYZWNZ-GFCCVEGCSA-N	0	3	326.362	3.216	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc(-c2c[nH]cn2)cc1	ZINC001085906474	1358864810	/nfs/dbraw/zinc/86/48/10/1358864810.db2.gz	JKBUMLMGMIPKHG-SFHVURJKSA-N	0	3	338.455	3.189	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cncc(C(F)(F)F)c1	ZINC001085908093	1358866714	/nfs/dbraw/zinc/86/67/14/1358866714.db2.gz	XTMJEGGPHSERMB-HNNXBMFYSA-N	0	3	341.377	3.213	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cnn(CCCC)c1CC	ZINC001085917577	1358877132	/nfs/dbraw/zinc/87/71/32/1358877132.db2.gz	DGMJWIXFPXSRJQ-KRWDZBQOSA-N	0	3	346.519	3.358	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C[C@@H]2CCN2CCC2=CCCCC2)nc1	ZINC001085933698	1358888370	/nfs/dbraw/zinc/88/83/70/1358888370.db2.gz	IHRKKGORURBMKG-IBGZPJMESA-N	0	3	337.467	3.100	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1ccc(N(C)C(C)C)cc1	ZINC001085998579	1358953481	/nfs/dbraw/zinc/95/34/81/1358953481.db2.gz	FQWQGPCVCKIFHB-LJQANCHMSA-N	0	3	329.488	3.254	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc(N(C)CC)cc1	ZINC001085998972	1358954395	/nfs/dbraw/zinc/95/43/95/1358954395.db2.gz	VKWYMCMDHJBSRP-IBGZPJMESA-N	0	3	329.488	3.255	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@@H](CNC(=O)C3CCCCC3)C2)c1	ZINC001086017361	1358966302	/nfs/dbraw/zinc/96/63/02/1358966302.db2.gz	WPDVLYVVOYXBMS-RHNCMZPLSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@H]2C[C@@H](NCC(=C)Cl)C2)cc1	ZINC001086124244	1359003122	/nfs/dbraw/zinc/00/31/22/1359003122.db2.gz	LLGRRADMXYGUPN-FZNQNYSPSA-N	0	3	334.847	3.102	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc3cc(C)ccc3[nH]2)C1	ZINC001086164253	1359012460	/nfs/dbraw/zinc/01/24/60/1359012460.db2.gz	GLNSTJLCTUYFBJ-OTVXOJSOSA-N	0	3	331.847	3.327	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)[C@@H]2C[C@]2(C)C(C)C)C1	ZINC001086241794	1359039172	/nfs/dbraw/zinc/03/91/72/1359039172.db2.gz	UFHGYAJFNZMZEP-KNCOVGOOSA-N	0	3	343.309	3.062	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc([C@H](C)CC)no2)C1	ZINC001086219093	1359031082	/nfs/dbraw/zinc/03/10/82/1359031082.db2.gz	LEDGYMFPRJPSHP-RTXFEEFZSA-N	0	3	325.840	3.039	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@H](CNC(=O)C3CCCCC3)C2)c(F)c1	ZINC001086294479	1359058307	/nfs/dbraw/zinc/05/83/07/1359058307.db2.gz	APNADLCXBIYAMD-RZDIXWSQSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2oc(C(F)F)cc2C)C1	ZINC001086391233	1359085024	/nfs/dbraw/zinc/08/50/24/1359085024.db2.gz	GUUSQKQJNACMFB-XYPYZODXSA-N	0	3	332.778	3.376	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc3ccccc3n2C)C1	ZINC001086461320	1359104954	/nfs/dbraw/zinc/10/49/54/1359104954.db2.gz	KTVYUZCYHWNIOZ-CTYIDZIISA-N	0	3	331.847	3.029	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(F)c(Cl)c2)C1	ZINC001086463465	1359106895	/nfs/dbraw/zinc/10/68/95/1359106895.db2.gz	JQZYBQMRKGOZSU-UMSPYCQHSA-N	0	3	331.218	3.330	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc(F)ccc2Cl)C1	ZINC001086487536	1359115774	/nfs/dbraw/zinc/11/57/74/1359115774.db2.gz	DLLIFTYKAUVUIA-UMSPYCQHSA-N	0	3	331.218	3.330	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cccnc2C2CC2)C1	ZINC001086745113	1359193852	/nfs/dbraw/zinc/19/38/52/1359193852.db2.gz	CWGREZPGWLFTDU-DZGCQCFKSA-N	0	3	333.863	3.200	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CC[C@H](CNC(=O)[C@]23C[C@H]2CCC3)C1	ZINC001086762848	1359196843	/nfs/dbraw/zinc/19/68/43/1359196843.db2.gz	DDPFBURCWHTLPS-BQBKMSKFSA-N	0	3	337.467	3.123	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccc3c(c2)[C@@H](C)CO3)C1	ZINC001086783950	1359200660	/nfs/dbraw/zinc/20/06/60/1359200660.db2.gz	WOALADUZJCJNDG-DUVNUKRYSA-N	0	3	348.874	3.423	20	30		EGEDHN
Cc1coc(C(=O)NC[C@H]2CC[C@@H](NCc3ccccc3C#N)C2)c1	ZINC001086782710	1359200871	/nfs/dbraw/zinc/20/08/71/1359200871.db2.gz	OBMDKVSRJQTPKT-MAUKXSAKSA-N	0	3	337.423	3.148	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cnn(C(C)C)c2C)C1	ZINC001086849902	1359213673	/nfs/dbraw/zinc/21/36/73/1359213673.db2.gz	GNVPHURLAXHPNM-LSDHHAIUSA-N	0	3	338.883	3.013	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC2(C[C@H]1C)CCN(Cc1ccc(F)cc1)CC2	ZINC001086910245	1359237715	/nfs/dbraw/zinc/23/77/15/1359237715.db2.gz	PAQXGPVTWVVULU-HZPDHXFCSA-N	0	3	343.446	3.188	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)CCc3ccc(C)cc3)C2)CC1	ZINC001086931453	1359255294	/nfs/dbraw/zinc/25/52/94/1359255294.db2.gz	JGDAMLVJICJLIR-IBGZPJMESA-N	0	3	338.495	3.264	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc(C)c(C)cn3)C2)CC1	ZINC001086934184	1359257650	/nfs/dbraw/zinc/25/76/50/1359257650.db2.gz	JHVSKHJKYOAKJG-GOSISDBHSA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)Cc3cc(C)ccc3C)C2)CC1	ZINC001086940971	1359262704	/nfs/dbraw/zinc/26/27/04/1359262704.db2.gz	FWZFUCOAFYMVIY-IBGZPJMESA-N	0	3	338.495	3.182	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)[C@H](F)c3ccccc3)C2)CC1	ZINC001086945978	1359267024	/nfs/dbraw/zinc/26/70/24/1359267024.db2.gz	MTLTWYZKMPLDCG-IEBWSBKVSA-N	0	3	342.458	3.424	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3cc(C(C)C)no3)C2)CC1	ZINC001086947210	1359268718	/nfs/dbraw/zinc/26/87/18/1359268718.db2.gz	RWVYHBQQXNXRMA-INIZCTEOSA-N	0	3	343.471	3.138	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)C[C@H](C)c3ccco3)C2)CC1	ZINC001086953564	1359273658	/nfs/dbraw/zinc/27/36/58/1359273658.db2.gz	MAHVKIPVXQTMIV-DLBZAZTESA-N	0	3	328.456	3.109	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc(Cl)cc3)C2)CC1	ZINC001086953573	1359273948	/nfs/dbraw/zinc/27/39/48/1359273948.db2.gz	MBNIGFUZYAPWGV-OAHLLOKOSA-N	0	3	330.859	3.290	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@H]3CC4CCC3CC4)C2)CC1	ZINC001086958511	1359279424	/nfs/dbraw/zinc/27/94/24/1359279424.db2.gz	SXSCZABIBVLYPZ-RGVPCPSESA-N	0	3	328.500	3.149	20	30		EGEDHN
CCC(=O)N[C@@H]1[C@@H]2CCCN(Cc3cccc(C#N)c3)[C@@H]2C1(C)C	ZINC001087262418	1359332132	/nfs/dbraw/zinc/33/21/32/1359332132.db2.gz	BVYQVSGNLSLQCQ-UHOSZYNNSA-N	0	3	325.456	3.073	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc(F)cc3)C(C)(C)[C@H]21	ZINC001087267338	1359338741	/nfs/dbraw/zinc/33/87/41/1359338741.db2.gz	ZJXKFIXILFIVTK-SQNIBIBYSA-N	0	3	328.431	3.068	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)Cc3c(C)cccc3C)C(C)(C)[C@H]21	ZINC001087287350	1359366237	/nfs/dbraw/zinc/36/62/37/1359366237.db2.gz	GFIGRQBCWYRXRB-UIFIKXQLSA-N	0	3	338.495	3.084	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)Cc1cccc(C)c1	ZINC001087299847	1359382178	/nfs/dbraw/zinc/38/21/78/1359382178.db2.gz	CIIVPUOTOGXEND-HLAWJBBLSA-N	0	3	338.495	3.166	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cccc2cc[nH]c21	ZINC001087304702	1359388703	/nfs/dbraw/zinc/38/87/03/1359388703.db2.gz	GMCIKRSRQVBKNR-NZSAHSFTSA-N	0	3	335.451	3.020	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3oc(CC)cc3C)C(C)(C)[C@H]21	ZINC001087312232	1359399840	/nfs/dbraw/zinc/39/98/40/1359399840.db2.gz	AZHPGSPREUUTDE-NJAFHUGGSA-N	0	3	328.456	3.002	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc4[nH]ccc4s3)C(C)(C)[C@H]21	ZINC001087316906	1359408159	/nfs/dbraw/zinc/40/81/59/1359408159.db2.gz	ZEFRJCFBHGQHHC-DQYPLSBCSA-N	0	3	341.480	3.081	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(F)s3)C(C)(C)[C@@H]21	ZINC001087319634	1359412164	/nfs/dbraw/zinc/41/21/64/1359412164.db2.gz	RBJDVJUTEQVZDN-DAXOMENPSA-N	0	3	334.460	3.129	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc(C4CC4)c3)C(C)(C)[C@@H]21	ZINC001087319565	1359412237	/nfs/dbraw/zinc/41/22/37/1359412237.db2.gz	PSWIOQPISRJWOP-VAMGGRTRSA-N	0	3	336.479	3.416	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)[C@]23C[C@H]2CCC3)C1	ZINC001087433078	1359463752	/nfs/dbraw/zinc/46/37/52/1359463752.db2.gz	ZYYIMUVOTIBDRH-NXLVEIQXSA-N	0	3	336.479	3.174	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2c(F)c(F)cc(F)c2F)[C@H]1CC	ZINC001087581320	1359540943	/nfs/dbraw/zinc/54/09/43/1359540943.db2.gz	BJQGBXDWCPTNBK-QWHCGFSZSA-N	0	3	344.352	3.402	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2coc3ccc(C)cc23)[C@H]1CC	ZINC001087588110	1359544443	/nfs/dbraw/zinc/54/44/43/1359544443.db2.gz	APRFSARDWLRMPZ-RBUKOAKNSA-N	0	3	338.451	3.276	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)[C@@H]2CCC2(F)F)CCN1Cc1ccc(C#N)cc1	ZINC001087618650	1359556518	/nfs/dbraw/zinc/55/65/18/1359556518.db2.gz	FHSNYIKPNQZZNK-YESZJQIVSA-N	0	3	347.409	3.073	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc3c(C)c(C)[nH]c32)[C@H]1CC	ZINC001087626798	1359563276	/nfs/dbraw/zinc/56/32/76/1359563276.db2.gz	SUZBPPUTEYQEDO-RBUKOAKNSA-N	0	3	337.467	3.391	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(C)n(C(CC)CC)n2)[C@H]1CC	ZINC001087633970	1359565189	/nfs/dbraw/zinc/56/51/89/1359565189.db2.gz	GBWDURGDHDTKQL-FUHWJXTLSA-N	0	3	332.492	3.321	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cnc(C)nc2C(C)C)[C@H]1CC	ZINC001087748691	1359626125	/nfs/dbraw/zinc/62/61/25/1359626125.db2.gz	WPRXBCVGSRNKSR-DLBZAZTESA-N	0	3	330.476	3.067	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)[C@@H]2C[C@H]2c2cccc(F)c2F)[C@H]1CC	ZINC001087834023	1359670656	/nfs/dbraw/zinc/67/06/56/1359670656.db2.gz	HKNWYBIXLJXKCZ-HDEZJCGLSA-N	0	3	334.410	3.223	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](NC(=O)c2cccc(CN(C)C)c2)[C@H]1CC	ZINC001087839245	1359674093	/nfs/dbraw/zinc/67/40/93/1359674093.db2.gz	QYFICHWQFPFHDJ-ZWKOTPCHSA-N	0	3	349.906	3.083	20	30		EGEDHN
Cc1cocc1C(=O)N1C[C@H]2CCN(Cc3cccc(C#N)c3)C[C@H]2C1	ZINC001088070626	1359744974	/nfs/dbraw/zinc/74/49/74/1359744974.db2.gz	SVOWQMXJQMJDCG-MOPGFXCFSA-N	0	3	349.434	3.054	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CN(C(=O)C4CC5(CC5)C4)C[C@@H]3C2)cc1	ZINC001088101569	1359757144	/nfs/dbraw/zinc/75/71/44/1359757144.db2.gz	PJKAJANUCNLQFB-QUCCMNQESA-N	0	3	349.478	3.029	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3cccn3C3CCCC3)C[C@@H]2C1	ZINC001088153224	1359773718	/nfs/dbraw/zinc/77/37/18/1359773718.db2.gz	IGNAKWZCDZOFNC-MSOLQXFVSA-N	0	3	339.483	3.020	20	30		EGEDHN
C=CCN1CC[C@H](OCC2CCN(C(=O)[C@H]3CCC(C)(C)C3)CC2)C1	ZINC001088238280	1359809584	/nfs/dbraw/zinc/80/95/84/1359809584.db2.gz	QHCYSJPLKXWJJB-OALUTQOASA-N	0	3	348.531	3.328	20	30		EGEDHN
C=CCN1CC[C@@H](OCC2CCN(C(=O)[C@@H]3CC34CCCC4)CC2)C1	ZINC001088239685	1359810923	/nfs/dbraw/zinc/81/09/23/1359810923.db2.gz	CXJOFFYPKHUNHO-MOPGFXCFSA-N	0	3	346.515	3.082	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2cc3occc3[nH]2)C1	ZINC001088323550	1359831015	/nfs/dbraw/zinc/83/10/15/1359831015.db2.gz	RVBWDOPJGPYMRI-ZDUSSCGKSA-N	0	3	335.835	3.488	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)[C@]23CCC[C@H]2OCC3)C1	ZINC001088346621	1359833423	/nfs/dbraw/zinc/83/34/23/1359833423.db2.gz	UPDQPVQRLNBEDG-JZXOWHBKSA-N	0	3	340.895	3.059	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2ccc(OC)o2)C1	ZINC001088404565	1359877240	/nfs/dbraw/zinc/87/72/40/1359877240.db2.gz	ZNZCOSPOZYIHCI-CYBMUJFWSA-N	0	3	326.824	3.015	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2cnoc2C2CC2)C1	ZINC001088409025	1359880703	/nfs/dbraw/zinc/88/07/03/1359880703.db2.gz	VULKSLYMJCETJO-AWEZNQCLSA-N	0	3	337.851	3.279	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2coc(CCC)n2)C1	ZINC001088412214	1359883253	/nfs/dbraw/zinc/88/32/53/1359883253.db2.gz	BBJRBXIEWODFNP-CQSZACIVSA-N	0	3	339.867	3.354	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2ccc3nccn3c2)C1	ZINC001088412109	1359883462	/nfs/dbraw/zinc/88/34/62/1359883462.db2.gz	YHLMQYBTTQVLQE-INIZCTEOSA-N	0	3	346.862	3.061	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cc(Cl)c(Cl)n2C)[C@H]1C	ZINC001088606106	1359989390	/nfs/dbraw/zinc/98/93/90/1359989390.db2.gz	ZWLLNLREOCKNOC-PWSUYJOCSA-N	0	3	330.259	3.101	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ncc(Cl)cc2Cl)[C@H]1C	ZINC001088939944	1360109422	/nfs/dbraw/zinc/10/94/22/1360109422.db2.gz	RZSFYTSZXXBEKM-MFKMUULPSA-N	0	3	328.243	3.157	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)[C@@]2(c3ccccc3)C[C@H](F)C2)[C@H]1C	ZINC001089011537	1360135562	/nfs/dbraw/zinc/13/55/62/1360135562.db2.gz	IAMWKBPVMSREHY-PHXBYCTMSA-N	0	3	330.447	3.211	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccccc2OCC2CC2)[C@H]1C	ZINC001089057465	1360151516	/nfs/dbraw/zinc/15/15/16/1360151516.db2.gz	ZDQJSADSIKDDCQ-QAPCUYQASA-N	0	3	328.456	3.244	20	30		EGEDHN
Cc1ccc(F)cc1CN(C)C[C@@H]1CCCCN1C(=O)[C@@H](C)C#N	ZINC001089139550	1360196833	/nfs/dbraw/zinc/19/68/33/1360196833.db2.gz	DXAVLKQUNVXGJQ-YJBOKZPZSA-N	0	3	331.435	3.107	20	30		EGEDHN
CC(C)[C@H](F)C(=O)N1CCCC[C@H]1CN(C)Cc1ccc(C#N)cc1	ZINC001089213993	1360259781	/nfs/dbraw/zinc/25/97/81/1360259781.db2.gz	TZJNKZAQRNMYBZ-OALUTQOASA-N	0	3	345.462	3.365	20	30		EGEDHN
N#CC1(CNC(=O)[C@H]2CCCN(Cc3ccc(Cl)cc3)C2)CCC1	ZINC001184404572	1387450480	/nfs/dbraw/zinc/45/04/80/1387450480.db2.gz	PTOARUBOIRIILY-INIZCTEOSA-N	0	3	345.874	3.362	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C[C@H]2CCC(F)(F)C2)CC(C)(C)C1	ZINC001089403285	1360402402	/nfs/dbraw/zinc/40/24/02/1360402402.db2.gz	QGLGHXJBXPVBSS-HUUCEWRRSA-N	0	3	326.431	3.052	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc(C)c3ccccc3n2)CC(C)(C)C1	ZINC001089419095	1360412908	/nfs/dbraw/zinc/41/29/08/1360412908.db2.gz	BRDNREUDQZQHDI-KRWDZBQOSA-N	0	3	349.478	3.397	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(Cl)cc2F)CC(C)(C)C1	ZINC001089432795	1360424259	/nfs/dbraw/zinc/42/42/59/1360424259.db2.gz	DQLUYDZHDLPDHF-CQSZACIVSA-N	0	3	336.838	3.333	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(-c3ccco3)o2)CC(C)(C)C1	ZINC001089438863	1360428938	/nfs/dbraw/zinc/42/89/38/1360428938.db2.gz	MSXQDFQGRJWZJL-HNNXBMFYSA-N	0	3	340.423	3.393	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2c(C)onc2C2CC2)CC(C)(C)C1	ZINC001089441224	1360431526	/nfs/dbraw/zinc/43/15/26/1360431526.db2.gz	WKFRQAHGNMJSDF-MRXNPFEDSA-N	0	3	343.471	3.104	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ncc(Cl)s2)CC(C)(C)C1	ZINC001089441996	1360432241	/nfs/dbraw/zinc/43/22/41/1360432241.db2.gz	MHKBTXQLVSMXDN-LBPRGKRZSA-N	0	3	339.892	3.040	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cccc3ncccc32)CC(C)(C)C1	ZINC001089453778	1360440969	/nfs/dbraw/zinc/44/09/69/1360440969.db2.gz	PQJLZNJIWDJWNW-INIZCTEOSA-N	0	3	335.451	3.088	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N[C@H]1CCN(Cc2ccc(C#N)s2)CC(C)(C)C1	ZINC001089466539	1360450866	/nfs/dbraw/zinc/45/08/66/1360450866.db2.gz	KFTIGDGRABDRRZ-ZQIUZPCESA-N	0	3	345.512	3.383	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc3occc3s2)CC(C)(C)C1	ZINC001089488768	1360468397	/nfs/dbraw/zinc/46/83/97/1360468397.db2.gz	XRXWRCGRTCPTQJ-ZDUSSCGKSA-N	0	3	330.453	3.348	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc([C@H](C)CC)no2)CC(C)(C)C1	ZINC001089512050	1360483234	/nfs/dbraw/zinc/48/32/34/1360483234.db2.gz	YQWOLYBACSCGRL-CABCVRRESA-N	0	3	331.460	3.042	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc(CC)c(C)s2)CC(C)(C)C1	ZINC001089556314	1360506419	/nfs/dbraw/zinc/50/64/19/1360506419.db2.gz	PNYOLJCKQVJLGR-INIZCTEOSA-N	0	3	332.513	3.473	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@H]2Cc3c2cccc3Cl)CC(C)(C)C1	ZINC001089569292	1360514601	/nfs/dbraw/zinc/51/46/01/1360514601.db2.gz	VKWLOAYVJCAYCI-PBHICJAKSA-N	0	3	344.886	3.220	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C23CC(C(C)(C)C)(C2)C3)CC(C)(C)C1	ZINC001089568968	1360515005	/nfs/dbraw/zinc/51/50/05/1360515005.db2.gz	PNDQJVSCQUWGRI-ATIQYGATSA-N	0	3	330.516	3.443	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H]1CCCc2n[nH]cc21	ZINC001089641811	1360554502	/nfs/dbraw/zinc/55/45/02/1360554502.db2.gz	UEKYMTWTJGMTSQ-JKSUJKDBSA-N	0	3	344.503	3.013	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ccn(C(F)F)n1	ZINC001089647596	1360560713	/nfs/dbraw/zinc/56/07/13/1360560713.db2.gz	XJOLRURSNQOQII-ZDUSSCGKSA-N	0	3	340.418	3.075	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(C(C)(C)C)on1	ZINC001089668981	1360578929	/nfs/dbraw/zinc/57/89/29/1360578929.db2.gz	DBKTTYMQMDVQTC-OAHLLOKOSA-N	0	3	345.487	3.216	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccnc2ccncc21	ZINC001089676334	1360583990	/nfs/dbraw/zinc/58/39/90/1360583990.db2.gz	DVNOAYJODNQZAX-OAHLLOKOSA-N	0	3	338.455	3.036	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(CC)nnc1C	ZINC001089676068	1360584285	/nfs/dbraw/zinc/58/42/85/1360584285.db2.gz	YYZQMFLCYOZBKR-QGZVFWFLSA-N	0	3	344.503	3.144	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(C2CC2)n[nH]1	ZINC001089696204	1360601078	/nfs/dbraw/zinc/60/10/78/1360601078.db2.gz	UQPOLECBXJHENR-HNNXBMFYSA-N	0	3	330.476	3.084	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cccc(OC)c1C	ZINC001089702830	1360605988	/nfs/dbraw/zinc/60/59/88/1360605988.db2.gz	DQIRZJLIHBEHNM-QGZVFWFLSA-N	0	3	342.483	3.247	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)c2cccs2)C1	ZINC001089762022	1360653742	/nfs/dbraw/zinc/65/37/42/1360653742.db2.gz	CGRGONYHUCSMBB-AJNGGQMLSA-N	0	3	336.888	3.283	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)CCc1ccco1	ZINC001089769286	1360657238	/nfs/dbraw/zinc/65/72/38/1360657238.db2.gz	KAMOFQHBNQWZJO-RANZSIQMSA-N	0	3	348.874	3.134	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)/C=C(/C)C1CC1	ZINC001089775687	1360659276	/nfs/dbraw/zinc/65/92/76/1360659276.db2.gz	AALJEXFUVQBFPG-DBHHROOYSA-N	0	3	334.891	3.264	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1(CC)CCC1	ZINC001089852297	1360697881	/nfs/dbraw/zinc/69/78/81/1360697881.db2.gz	ZZVPUZHJJHRUQY-YVSFHVDLSA-N	0	3	336.907	3.488	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1(C)CC=CC1	ZINC001089860432	1360704997	/nfs/dbraw/zinc/70/49/97/1360704997.db2.gz	WTHJKBHLTAKUGG-HZMVEIRTSA-N	0	3	334.891	3.264	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C(C1CC1)C1CC1	ZINC001089885401	1360719031	/nfs/dbraw/zinc/71/90/31/1360719031.db2.gz	GBABMVOWMNVEMP-FJIDUMEYSA-N	0	3	348.918	3.344	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C2=CCCCCC2)CC2(CCOCC2)C1	ZINC001089935456	1360752073	/nfs/dbraw/zinc/75/20/73/1360752073.db2.gz	YMHGCJGBERXORZ-IBGZPJMESA-N	0	3	346.515	3.440	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)[C@H]2CCC(C)(C)C2)CC2(CCOCC2)C1	ZINC001089956963	1360765328	/nfs/dbraw/zinc/76/53/28/1360765328.db2.gz	PKYYCKKJFBCNLH-ZWKOTPCHSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C2CCC=CCC2)CC2(CCOCC2)C1	ZINC001089968909	1360771987	/nfs/dbraw/zinc/77/19/87/1360771987.db2.gz	PSPQVXPXTJMFDE-LJQANCHMSA-N	0	3	346.515	3.296	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)C2CC(C(C)(C)C)C2)CC2(CCOCC2)C1	ZINC001089969345	1360772988	/nfs/dbraw/zinc/77/29/88/1360772988.db2.gz	JEJLHTRNCQHLHH-DAWZGUTISA-N	0	3	348.531	3.232	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cccc3c2CCCC3)C1	ZINC001091044977	1360985749	/nfs/dbraw/zinc/98/57/49/1360985749.db2.gz	MLPRHSGNALLQBR-UHFFFAOYSA-N	0	3	332.875	3.416	20	30		EGEDHN
CC1(CC(=O)N2C[C@H]3CN(Cc4cccc(C#N)c4)C[C@@]3(C)C2)CC1	ZINC001091864108	1361238465	/nfs/dbraw/zinc/23/84/65/1361238465.db2.gz	YMHNQZMRHYEKDL-NQIIRXRSSA-N	0	3	337.467	3.029	20	30		EGEDHN
Cc1coc(C(=O)N2C[C@H]3CN(Cc4ccc(C#N)cc4)C[C@@]3(C)C2)c1	ZINC001091938878	1361255062	/nfs/dbraw/zinc/25/50/62/1361255062.db2.gz	SDCAVLMIXPEUBO-NQIIRXRSSA-N	0	3	349.434	3.054	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@@H](C)c3ccc(CC)cc3)C[C@]2(C)C1	ZINC001092101792	1361301505	/nfs/dbraw/zinc/30/15/05/1361301505.db2.gz	OEEQCEABJRFFBT-WEYGHZABSA-N	0	3	338.495	3.156	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1CNC(=O)[C@H]1CC=CCC1	ZINC001092459830	1361388857	/nfs/dbraw/zinc/38/88/57/1361388857.db2.gz	UREJBWRSYUUJIZ-HLAWJBBLSA-N	0	3	336.479	3.079	20	30		EGEDHN
Cc1ccoc1C(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001092466365	1361391714	/nfs/dbraw/zinc/39/17/14/1361391714.db2.gz	GKNZNAOYTUCKGE-ZIAGYGMSSA-N	0	3	343.452	3.019	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C2(C(C)C)CC2)CC1	ZINC001093378120	1361588946	/nfs/dbraw/zinc/58/89/46/1361588946.db2.gz	JWKYKUVJKNDBKW-GOSISDBHSA-N	0	3	328.500	3.149	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@]2(C)C=CCC2)C[C@H]1CNCc1ccccc1C#N	ZINC001093974834	1361723614	/nfs/dbraw/zinc/72/36/14/1361723614.db2.gz	CYMOXYPGOJLTMR-OZOXKJRCSA-N	0	3	337.467	3.099	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3c[nH]c4ccc(C)cc34)CCC[C@@H]12	ZINC001094584622	1361871496	/nfs/dbraw/zinc/87/14/96/1361871496.db2.gz	BRMSHVOQWQVCDZ-TZIWHRDSSA-N	0	3	335.451	3.084	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1C[C@H]2C[C@@H](C1)N(C(=O)C1CCCC1)C2	ZINC001094834843	1361920478	/nfs/dbraw/zinc/92/04/78/1361920478.db2.gz	XBYPIWRZJRRYOH-BEVDRBHNSA-N	0	3	337.467	3.218	20	30		EGEDHN
N#CCOc1cccc(CN[C@H](c2nnc[nH]2)C2CCCCC2)c1	ZINC001324130564	1387545983	/nfs/dbraw/zinc/54/59/83/1387545983.db2.gz	UXAADYCHOWRSEL-KRWDZBQOSA-N	0	3	325.416	3.118	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1ccc3cnccc3c1)C2	ZINC001095749371	1362220883	/nfs/dbraw/zinc/22/08/83/1362220883.db2.gz	GRZUKOCKDUNCFX-AABGKKOBSA-N	0	3	335.451	3.075	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ncsc1C(F)(F)F)C2	ZINC001095753066	1362221735	/nfs/dbraw/zinc/22/17/35/1362221735.db2.gz	ONUJENBFCMMVGO-VWYCJHECSA-N	0	3	345.390	3.073	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1ccc(F)cc1Cl)C2	ZINC001095964877	1362312910	/nfs/dbraw/zinc/31/29/10/1362312910.db2.gz	GVFXQMQSCFDKEO-PVAVHDDUSA-N	0	3	336.838	3.319	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccc(C)c(C)c1)C2	ZINC001096130271	1362398434	/nfs/dbraw/zinc/39/84/34/1362398434.db2.gz	RSNZFKHMFXILFL-TXVWBRJLSA-N	0	3	336.479	3.152	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc3nc(C)ccc3o1)C2	ZINC001096396557	1362488035	/nfs/dbraw/zinc/48/80/35/1362488035.db2.gz	YNYNFAWWKZYNIA-VYDXJSESSA-N	0	3	339.439	3.438	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1c(C)oc3ccccc31)C2	ZINC001096686011	1362636958	/nfs/dbraw/zinc/63/69/58/1362636958.db2.gz	FCRFLAOIKWPOOL-MNEFBYGVSA-N	0	3	336.435	3.029	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1sc(Cl)nc1C)C2	ZINC001097146706	1362866664	/nfs/dbraw/zinc/86/66/64/1362866664.db2.gz	RJBIEKYVWVPLHX-UPJWGTAASA-N	0	3	339.892	3.406	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1ccc(CC(C)C)cc1)C2	ZINC001097470957	1363008782	/nfs/dbraw/zinc/00/87/82/1363008782.db2.gz	OHTJZHUTZXMENV-NJYVYQBISA-N	0	3	338.495	3.172	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1ccc(C3CCC3)cc1)C2	ZINC001097589236	1363061793	/nfs/dbraw/zinc/06/17/93/1363061793.db2.gz	VTLULXWYZFDNKD-NJYVYQBISA-N	0	3	336.479	3.241	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(F)c3ccncc13)C2	ZINC001097691299	1363102114	/nfs/dbraw/zinc/10/21/14/1363102114.db2.gz	FDLPQISQQIUKOZ-ZNOIYHFQSA-N	0	3	339.414	3.285	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](CNCc3nccs3)[C@@H](C)C2)CC1	ZINC001185094460	1387617347	/nfs/dbraw/zinc/61/73/47/1387617347.db2.gz	IRRQUDXXOAZPAQ-HOTGVXAUSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1)C2	ZINC001098005636	1363194988	/nfs/dbraw/zinc/19/49/88/1363194988.db2.gz	YXQYGJRXFRWFIY-JUSBFGHESA-N	0	3	340.467	3.096	20	30		EGEDHN
O=C(C#Cc1cccs1)NC[C@H]1CCCN(Cc2cccs2)C1	ZINC001324379500	1387614901	/nfs/dbraw/zinc/61/49/01/1387614901.db2.gz	WDFNOZKFEPHJKF-OAHLLOKOSA-N	0	3	344.505	3.190	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(O[C@@H](C)CC)cc1)C2	ZINC001098167404	1363242057	/nfs/dbraw/zinc/24/20/57/1363242057.db2.gz	ZCLMPEFKVLHLFW-ZSXHRAQDSA-N	0	3	340.467	3.222	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1oc(CCC)nc1C)C2	ZINC001098216018	1363258193	/nfs/dbraw/zinc/25/81/93/1363258193.db2.gz	DFHKGOXCKXPMEE-OAGGEKHMSA-N	0	3	331.460	3.237	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(OCC)c(OC)c1)C2	ZINC001098369656	1363309123	/nfs/dbraw/zinc/30/91/23/1363309123.db2.gz	FSYAFONECLOABZ-ZACQAIPSSA-N	0	3	344.455	3.005	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)C[C@H](NC(=O)C1CCC1)c1ccccc1O2	ZINC001098541666	1363363559	/nfs/dbraw/zinc/36/35/59/1363363559.db2.gz	QDFPGHAMYRLQSV-GHTZIAJQSA-N	0	3	340.467	3.447	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccccc1	ZINC001098849283	1363491148	/nfs/dbraw/zinc/49/11/48/1363491148.db2.gz	KSVJMNRXVZHIIM-GOSISDBHSA-N	0	3	330.472	3.110	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc3nccc(C)c3c2)C1	ZINC001098851230	1363491952	/nfs/dbraw/zinc/49/19/52/1363491952.db2.gz	HZCJJBUUFNVODQ-AVRDEDQJSA-N	0	3	347.462	3.151	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(F)cc1	ZINC001098863758	1363496926	/nfs/dbraw/zinc/49/69/26/1363496926.db2.gz	VXPQQCQBSPHGPM-SFHVURJKSA-N	0	3	348.462	3.249	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc3cc(F)ccc3[nH]2)C1	ZINC001098966801	1363545540	/nfs/dbraw/zinc/54/55/40/1363545540.db2.gz	BYJVNWPLBALHGC-LIRRHRJNSA-N	0	3	327.403	3.077	20	30		EGEDHN
C=CCOCC(=O)NC[C@@H]1CCC(C)(C)CN1Cc1cccc(C)c1	ZINC001098971118	1363547133	/nfs/dbraw/zinc/54/71/33/1363547133.db2.gz	KESGVDLEWYGODG-IBGZPJMESA-N	0	3	344.499	3.304	20	30		EGEDHN
Cc1ccc(CN2CC(C)(C)CC[C@H]2CNC(=O)[C@H](C)C#N)cc1	ZINC001098975694	1363549839	/nfs/dbraw/zinc/54/98/39/1363549839.db2.gz	MCFJMCBJVZWRQP-AEFFLSMTSA-N	0	3	327.472	3.262	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc3c(c2)C=CCC3)C1	ZINC001099072569	1363608069	/nfs/dbraw/zinc/60/80/69/1363608069.db2.gz	VFMJGCKIUHCJPK-UNMCSNQZSA-N	0	3	334.463	3.254	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(F)c3ncccc3c2)C1	ZINC001099082746	1363613685	/nfs/dbraw/zinc/61/36/85/1363613685.db2.gz	CUVKCWXXMZCBMM-JXFKEZNVSA-N	0	3	339.414	3.144	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cnn(C3CCCCC3)c2)C1	ZINC001099109082	1363626870	/nfs/dbraw/zinc/62/68/70/1363626870.db2.gz	GYEMUMVIJKRKKP-PXNSSMCTSA-N	0	3	342.487	3.159	20	30		EGEDHN
C#CCCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc3cccc(F)c3o2)C1	ZINC001099172065	1363669729	/nfs/dbraw/zinc/66/97/29/1363669729.db2.gz	QMGVDZGIFQJBFV-YWZLYKJASA-N	0	3	340.398	3.180	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)C1(c2cc(C)no2)CC1	ZINC001099193437	1363684797	/nfs/dbraw/zinc/68/47/97/1363684797.db2.gz	BTGBYEGSNNKTIB-MRXNPFEDSA-N	0	3	345.487	3.198	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)CC2=CCCCC2)C[C@H]1C(F)(F)F	ZINC001099224763	1363700410	/nfs/dbraw/zinc/70/04/10/1363700410.db2.gz	ONTWMNMAXAOHFB-HUUCEWRRSA-N	0	3	330.394	3.432	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H](C)c1c(C)noc1C	ZINC001099271353	1363725151	/nfs/dbraw/zinc/72/51/51/1363725151.db2.gz	XCUHKNJFCOAVLA-BBRMVZONSA-N	0	3	333.476	3.188	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2ccc(C)c(F)c2)C[C@H]1C(F)(F)F	ZINC001099277106	1363728658	/nfs/dbraw/zinc/72/86/58/1363728658.db2.gz	PESNHQMGCKEJFM-UKRRQHHQSA-N	0	3	344.352	3.303	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2ccc3ncccc3c2)C[C@H]1C(F)(F)F	ZINC001099300361	1363738381	/nfs/dbraw/zinc/73/83/81/1363738381.db2.gz	BQDLDWMIFFNKSI-GDBMZVCRSA-N	0	3	349.356	3.013	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2c(F)ccc(C)c2F)C[C@H]1C(F)(F)F	ZINC001099301179	1363738586	/nfs/dbraw/zinc/73/85/86/1363738586.db2.gz	DHJFVZSXCIQLPT-ZYHUDNBSSA-N	0	3	348.315	3.052	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H](C)Oc1ccccc1	ZINC001099324021	1363750139	/nfs/dbraw/zinc/75/01/39/1363750139.db2.gz	FFMGGKWPOIDGIU-QZTJIDSGSA-N	0	3	342.483	3.084	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H](C)Oc1ccccc1	ZINC001099324019	1363750296	/nfs/dbraw/zinc/75/02/96/1363750296.db2.gz	FFMGGKWPOIDGIU-MSOLQXFVSA-N	0	3	342.483	3.084	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)Cc1ccccc1OC	ZINC001099329676	1363753496	/nfs/dbraw/zinc/75/34/96/1363753496.db2.gz	QKGLXIRLQYOBIU-KRWDZBQOSA-N	0	3	330.472	3.031	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2cccc(C(F)F)c2)C[C@H]1C(F)(F)F	ZINC001099334561	1363756204	/nfs/dbraw/zinc/75/62/04/1363756204.db2.gz	TWJRNXRFVWXLIK-CHWSQXEVSA-N	0	3	348.315	3.403	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)COc1cc(C)cc(C)c1	ZINC001099339129	1363758804	/nfs/dbraw/zinc/75/88/04/1363758804.db2.gz	DZSQRMUULYIHDJ-GOSISDBHSA-N	0	3	344.499	3.475	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2cscn2)C1	ZINC001099474402	1363810643	/nfs/dbraw/zinc/81/06/43/1363810643.db2.gz	RWRRXCGPCTUFCP-KXBFYZLASA-N	0	3	347.528	3.464	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C[C@H](C)C(C)C)CC2(CCOCC2)C1	ZINC001099569420	1363855207	/nfs/dbraw/zinc/85/52/07/1363855207.db2.gz	ANPILADMUSVQCQ-ZWKOTPCHSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@H]1CN(CC(=C)C)CC2(CCOCC2)C1	ZINC001099588908	1363870737	/nfs/dbraw/zinc/87/07/37/1363870737.db2.gz	LTQHQXVJSTVQJL-ZWKOTPCHSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CC[C@@H](C)CC)CC2(CCOCC2)C1	ZINC001099595173	1363878439	/nfs/dbraw/zinc/87/84/39/1363878439.db2.gz	UXENTWFOAAMFHO-ROUUACIJSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1CCN(Cc2ccc(CCC)cc2)C[C@@H]1O	ZINC001099858374	1363965891	/nfs/dbraw/zinc/96/58/91/1363965891.db2.gz	KXJPJSNUALWVQC-PMACEKPBSA-N	0	3	344.499	3.047	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C[C@@H](C)CCC)C[C@H]1c1ccc(OC)cc1	ZINC001100153789	1364029119	/nfs/dbraw/zinc/02/91/19/1364029119.db2.gz	FYSCSEDTQXEPSS-FFZOFVMBSA-N	0	3	342.483	3.039	20	30		EGEDHN
CC(C)(C)/C=C\C(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1	ZINC001100192645	1364040786	/nfs/dbraw/zinc/04/07/86/1364040786.db2.gz	JKOKFPRKQXDKDC-SREVYHEPSA-N	0	3	343.446	3.284	20	30		EGEDHN
CC(C)=C(F)C(=O)NCC1CC(NCC#Cc2ccccc2Cl)C1	ZINC001100243089	1364055546	/nfs/dbraw/zinc/05/55/46/1364055546.db2.gz	XNOOYIMBTMJZCY-UHFFFAOYSA-N	0	3	348.849	3.439	20	30		EGEDHN
C#CCCCCCC(=O)NCC1CC(NCc2oc(CC)nc2C)C1	ZINC001100570108	1364166972	/nfs/dbraw/zinc/16/69/72/1364166972.db2.gz	CZHBFOIHUCCBFX-UHFFFAOYSA-N	0	3	345.487	3.114	20	30		EGEDHN
C#CCCCCCC(=O)NCC1CC(NCc2c(C)onc2CC)C1	ZINC001100570370	1364167600	/nfs/dbraw/zinc/16/76/00/1364167600.db2.gz	PYMAXCPVHPGUDD-UHFFFAOYSA-N	0	3	345.487	3.114	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCC1CC(NCc2cnc(Cl)s2)C1	ZINC001100587796	1364176279	/nfs/dbraw/zinc/17/62/79/1364176279.db2.gz	XKWMYXLCYCPHHZ-PNESKVBLSA-N	0	3	341.908	3.383	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCC1CC(NCc2cccc(Cl)n2)C1	ZINC001100595768	1364180970	/nfs/dbraw/zinc/18/09/70/1364180970.db2.gz	FYQYSOLJWDXPNL-VQCLRJIVSA-N	0	3	335.879	3.322	20	30		EGEDHN
O=C(NCC1CC(NCC#Cc2ccccc2)C1)c1occc1Cl	ZINC001100648525	1364203995	/nfs/dbraw/zinc/20/39/95/1364203995.db2.gz	FVGGQYZQNBTLBO-UHFFFAOYSA-N	0	3	342.826	3.083	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)Cc2ccc(Cl)c(F)c2)C1	ZINC001100705350	1364228291	/nfs/dbraw/zinc/22/82/91/1364228291.db2.gz	ADJWTBQJOYATKJ-UHFFFAOYSA-N	0	3	345.245	3.259	20	30		EGEDHN
Cc1cc(C(=O)NCC2CC(NCC#Cc3ccccc3)C2)cs1	ZINC001100758042	1364248198	/nfs/dbraw/zinc/24/81/98/1364248198.db2.gz	UIXYXAYRWNOHFW-UHFFFAOYSA-N	0	3	338.476	3.206	20	30		EGEDHN
O=C(NCC1CC(NCC#Cc2ccccc2)C1)C1(F)CCCCC1	ZINC001100828838	1364281581	/nfs/dbraw/zinc/28/15/81/1364281581.db2.gz	AJXIROIHVVXQEG-UHFFFAOYSA-N	0	3	342.458	3.195	20	30		EGEDHN
CCc1ccc(C(=O)NCC2CC(NCC#Cc3ccccc3)C2)cc1	ZINC001100933205	1364337238	/nfs/dbraw/zinc/33/72/38/1364337238.db2.gz	XGAVKGXTFALAPY-UHFFFAOYSA-N	0	3	346.474	3.399	20	30		EGEDHN
CC/C(C)=C\C(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@@]2(C)C1	ZINC001101225639	1364473456	/nfs/dbraw/zinc/47/34/56/1364473456.db2.gz	QAKBIQZOBNWNTQ-VVTVFNNLSA-N	0	3	337.467	3.195	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@H]2CN(Cc3c(C)nsc3C)C[C@@]2(C)C1	ZINC001101253407	1364487174	/nfs/dbraw/zinc/48/71/74/1364487174.db2.gz	NSDFNHTZONXMKT-APWZRJJASA-N	0	3	347.528	3.397	20	30		EGEDHN
CCCC(C)(C)C(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001185327809	1387684702	/nfs/dbraw/zinc/68/47/02/1387684702.db2.gz	DUURSTBASOVFPS-MRXNPFEDSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@H]2CN(Cc3oc(C)nc3C)C[C@@]2(C)C1	ZINC001101337018	1364515201	/nfs/dbraw/zinc/51/52/01/1364515201.db2.gz	ZZBVFRPJIFMUEB-ZTQAJYAQSA-N	0	3	345.487	3.174	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)CC/C=C/c3ccccc3)C[C@]2(C)C1	ZINC001101363925	1364528721	/nfs/dbraw/zinc/52/87/21/1364528721.db2.gz	GPWIRLLVCUUTRX-BQVYUJLSSA-N	0	3	336.479	3.284	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CC2(CN(CCC(C)C)C2)n2ccnc21	ZINC001101630359	1364662368	/nfs/dbraw/zinc/66/23/68/1364662368.db2.gz	FOWXRIQHTLYTDS-MRXNPFEDSA-N	0	3	344.503	3.103	20	30		EGEDHN
CC[C@H](C)CC(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C	ZINC001101918200	1364773477	/nfs/dbraw/zinc/77/34/77/1364773477.db2.gz	LOURBEZFYJEPMR-NLWGTHIKSA-N	0	3	326.484	3.158	20	30		EGEDHN
CC(C(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C)=C1CCC1	ZINC001101944081	1364784802	/nfs/dbraw/zinc/78/48/02/1364784802.db2.gz	BLWCOYDXVSKYAQ-DYESRHJHSA-N	0	3	336.479	3.223	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2F)C[C@H]1CNC(=O)C#CC(C)(C)C	ZINC001101955155	1364789853	/nfs/dbraw/zinc/78/98/53/1364789853.db2.gz	VFGKMGUDKYVDMR-NVXWUHKLSA-N	0	3	330.447	3.059	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1C	ZINC001102010495	1364810552	/nfs/dbraw/zinc/81/05/52/1364810552.db2.gz	BDZKAIWWPCTFDZ-CRAIPNDOSA-N	0	3	343.446	3.238	20	30		EGEDHN
C[C@H](C(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C)C(C)(C)C	ZINC001102088976	1364849161	/nfs/dbraw/zinc/84/91/61/1364849161.db2.gz	BHDKFWGOHPSADM-QWFCFKBJSA-N	0	3	340.511	3.404	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001102261159	1364974057	/nfs/dbraw/zinc/97/40/57/1364974057.db2.gz	PPDQFKHWWBIRKP-BZUAXINKSA-N	0	3	345.512	3.406	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H]1CN(Cc2c(C)noc2CC)C[C@H]1C	ZINC001102297819	1364989730	/nfs/dbraw/zinc/98/97/30/1364989730.db2.gz	FJJIVUSBZHEZBM-GDBMZVCRSA-N	0	3	333.476	3.086	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@@H]1CN(Cc2oc(C)nc2C)C[C@H]1C	ZINC001102326175	1365002284	/nfs/dbraw/zinc/00/22/84/1365002284.db2.gz	LHFJGYUXWLSHAO-NRXGSXMXSA-N	0	3	333.476	3.078	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@@H]1CN(Cc2c(C)noc2CC)C[C@H]1C	ZINC001102327246	1365003245	/nfs/dbraw/zinc/00/32/45/1365003245.db2.gz	IZPNUALKPNHHBV-AKCHCHLHSA-N	0	3	347.503	3.332	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@H]2CN(CC#Cc3ccccc3)C[C@H]2C)C1	ZINC001102352773	1365017871	/nfs/dbraw/zinc/01/78/71/1365017871.db2.gz	VYVCFAHVMORSNV-UYAOXDASSA-N	0	3	336.479	3.079	20	30		EGEDHN
CC(C)[C@H](C)C(=O)NC[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1C	ZINC001102423361	1365048823	/nfs/dbraw/zinc/04/88/23/1365048823.db2.gz	UZETVWLHRINTAX-RVKKMQEKSA-N	0	3	345.462	3.174	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](NCc3ccc(OC)c(F)c3)C2)CC1	ZINC001185439501	1387717644	/nfs/dbraw/zinc/71/76/44/1387717644.db2.gz	TWZGNHVQWNPBEQ-MRXNPFEDSA-N	0	3	346.446	3.271	20	30		EGEDHN
C=CCCC(=O)NCC[C@@H]1CN(Cc2cc(C#N)ccc2F)C[C@H]1C	ZINC001102760192	1365205604	/nfs/dbraw/zinc/20/56/04/1365205604.db2.gz	IWMUHIJIEMZBLD-NVXWUHKLSA-N	0	3	343.446	3.238	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1CCNC(=O)/C=C/C1CC1	ZINC001102822212	1365236854	/nfs/dbraw/zinc/23/68/54/1365236854.db2.gz	HBLHJDFTSUXNEE-UHMOSQCASA-N	0	3	337.467	3.099	20	30		EGEDHN
CC[C@@H](F)C(=O)NCC[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1C	ZINC001103320144	1365491778	/nfs/dbraw/zinc/49/17/78/1365491778.db2.gz	OISJHZRQFCFCGB-FRFSOERESA-N	0	3	349.425	3.020	20	30		EGEDHN
C=CCCCC(=O)NCC[C@@H]1CN([C@H](C)c2ncc(C)o2)C[C@H]1C	ZINC001103382560	1365527263	/nfs/dbraw/zinc/52/72/63/1365527263.db2.gz	MSUUMXQHHWXCPA-DJIMGWMZSA-N	0	3	333.476	3.475	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)[C@@H]2C[C@H]2c2ccco2)C1	ZINC001103458107	1365573215	/nfs/dbraw/zinc/57/32/15/1365573215.db2.gz	LOYJWXQCBWSWGE-DTZQCDIJSA-N	0	3	336.863	3.210	20	30		EGEDHN
CC(C)CC(=O)N1C[C@@H](C)[C@H](CCNCc2ccc(C#N)cc2F)C1	ZINC001103831104	1365803852	/nfs/dbraw/zinc/80/38/52/1365803852.db2.gz	KZBUYEUQQPOOCT-CRAIPNDOSA-N	0	3	345.462	3.318	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCC2CC2)C[C@H]1CCNCc1ccccc1C#N	ZINC001104015589	1365874568	/nfs/dbraw/zinc/87/45/68/1365874568.db2.gz	XXVSQAMDVRLPGV-OXQOHEQNSA-N	0	3	339.483	3.323	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2cccc(F)c2F)C1	ZINC001104126223	1365918907	/nfs/dbraw/zinc/91/89/07/1365918907.db2.gz	ARQMCUINYNNONZ-NVXWUHKLSA-N	0	3	348.437	3.343	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@@H](C)[C@H](CCNCc2cccc(F)c2F)C1	ZINC001104163682	1365933380	/nfs/dbraw/zinc/93/33/80/1365933380.db2.gz	MKWVBBPSXOGKNV-NVXWUHKLSA-N	0	3	348.437	3.198	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)[C@@H]2CCC(F)(F)C2)C[C@H]1C	ZINC001104271720	1365973695	/nfs/dbraw/zinc/97/36/95/1365973695.db2.gz	DDVCPDNFESCWFU-MRVWCRGKSA-N	0	3	334.838	3.249	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2nc(C)sc2C)C[C@H]1C	ZINC001104342101	1365981016	/nfs/dbraw/zinc/98/10/16/1365981016.db2.gz	BUWFTYBSAKZYNL-QMTHXVAHSA-N	0	3	341.908	3.200	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@@H](C)[C@H](CCNCc2oc(C)nc2C)C1	ZINC001104563081	1366078081	/nfs/dbraw/zinc/07/80/81/1366078081.db2.gz	JAPRUUXOZUFWGM-ZTFGCOKTSA-N	0	3	347.503	3.468	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@@H](C)[C@H](CCNCc2cc(C)no2)C1	ZINC001104563632	1366078595	/nfs/dbraw/zinc/07/85/95/1366078595.db2.gz	PNOOSMMJVDMCKL-DJIMGWMZSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H](C)[C@H](CCNCc2conc2CC)C1	ZINC001104563760	1366078928	/nfs/dbraw/zinc/07/89/28/1366078928.db2.gz	UAEVJIBFYBBOKC-BRWVUGGUSA-N	0	3	347.503	3.414	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CN(C(=O)[C@@H]2C[C@H]2CC)C[C@H]1C	ZINC001104702895	1366137041	/nfs/dbraw/zinc/13/70/41/1366137041.db2.gz	IKXWNJAHYDFREE-NMFUWQPSSA-N	0	3	343.309	3.015	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)CCc2ccccc2)C[C@H]1C	ZINC001104943167	1366234240	/nfs/dbraw/zinc/23/42/40/1366234240.db2.gz	IOSLUNLRMFOARI-CRAIPNDOSA-N	0	3	334.891	3.446	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)[C@@H](C)CC(C)C)CC1	ZINC001105396018	1366444523	/nfs/dbraw/zinc/44/45/23/1366444523.db2.gz	GZOJRHRZSGNYQD-PKOBYXMFSA-N	0	3	330.516	3.395	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C2(CC=C)CCC2)CC1	ZINC001105396461	1366445262	/nfs/dbraw/zinc/44/52/62/1366445262.db2.gz	MBNQOTNNVZFWNM-LJQANCHMSA-N	0	3	340.511	3.459	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(c2ccccc2)C[C@H](NC(=O)[C@@H](F)CC)C1	ZINC001105433972	1366466181	/nfs/dbraw/zinc/46/61/81/1366466181.db2.gz	VGRRFWQSWQNHIU-XYJFISCASA-N	0	3	338.854	3.293	20	30		EGEDHN
CC/C(C)=C\C(=O)N1C[C@@H](CNCc2cc(F)ccc2C#N)[C@H](C)C1	ZINC001106093699	1366610738	/nfs/dbraw/zinc/61/07/38/1366610738.db2.gz	JHOAIWJXQGZPBQ-CYKNGCMHSA-N	0	3	343.446	3.238	20	30		EGEDHN
C=CCC[C@@H](C)NCc1cn([C@H]2CCCN(C(=O)CCCC)C2)nn1	ZINC001185871374	1387821921	/nfs/dbraw/zinc/82/19/21/1387821921.db2.gz	AUDYJDIPRQISDR-AEFFLSMTSA-N	0	3	347.507	3.076	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001106550041	1366730757	/nfs/dbraw/zinc/73/07/57/1366730757.db2.gz	JNMXWKZTYBGRRB-ZGPVROFDSA-N	0	3	337.467	3.265	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](CNCc2ccn(C(C)C)n2)[C@H](C)C1	ZINC001106611683	1366754884	/nfs/dbraw/zinc/75/48/84/1366754884.db2.gz	ALEDEULTZAURLT-IAGOWNOFSA-N	0	3	332.492	3.004	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@]12CCC[C@H]1N(Cc1cc(C)no1)CC2	ZINC001107421050	1366959648	/nfs/dbraw/zinc/95/96/48/1366959648.db2.gz	WHSPROKUYUQYJT-YLJYHZDGSA-N	0	3	345.487	3.446	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@]12CCC[C@H]1N(Cc1conc1CC)CC2	ZINC001107502606	1367001738	/nfs/dbraw/zinc/00/17/38/1367001738.db2.gz	LAMRROIVLISIJV-YLJYHZDGSA-N	0	3	345.487	3.310	20	30		EGEDHN
CC#CCCCC(=O)NC[C@]12CCC[C@H]1N(Cc1cccnc1)CC2	ZINC001107512497	1367011703	/nfs/dbraw/zinc/01/17/03/1367011703.db2.gz	FERUBLVIMALWHK-TZIWHRDSSA-N	0	3	339.483	3.136	20	30		EGEDHN
CCC[C@H](C)C(=O)N1CC[C@H](N(C)Cc2ccc(OC)c(C#N)c2)C1	ZINC001189462559	1367030163	/nfs/dbraw/zinc/03/01/63/1367030163.db2.gz	XJHUPBOZOOGCCK-YJBOKZPZSA-N	0	3	343.471	3.036	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](N(C)Cc2cccc(OC)c2C)C1	ZINC001189743962	1367100501	/nfs/dbraw/zinc/10/05/01/1367100501.db2.gz	KUQPYQLOXMDIAF-IBGZPJMESA-N	0	3	342.483	3.230	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2ccc(F)cc2)C1	ZINC001107691749	1367104931	/nfs/dbraw/zinc/10/49/31/1367104931.db2.gz	CXWGPVLGKFLVJS-DNVCBOLYSA-N	0	3	334.435	3.001	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCCCCF	ZINC001109404897	1367106217	/nfs/dbraw/zinc/10/62/17/1367106217.db2.gz	QGLKCPZLJQPLMJ-IKGGRYGDSA-N	0	3	333.451	3.149	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](N(C)Cc2ccc(Cl)c(OC)c2)C1	ZINC001189925630	1367132680	/nfs/dbraw/zinc/13/26/80/1367132680.db2.gz	DEMHNJAYKCFQNY-INIZCTEOSA-N	0	3	348.874	3.185	20	30		EGEDHN
CN(Cc1cccc(Cl)c1)[C@@H]1CCN(C(=O)C#CC(C)(C)C)C1	ZINC001190076300	1367167710	/nfs/dbraw/zinc/16/77/10/1367167710.db2.gz	OLWAEYGBEHTGJB-QGZVFWFLSA-N	0	3	332.875	3.422	20	30		EGEDHN
C#CCCCC(=O)NC[C@]1(C)CN(CC2CCC(C)(C)CC2)CCO1	ZINC001107901435	1367195793	/nfs/dbraw/zinc/19/57/93/1367195793.db2.gz	PLNARYRSWVMHDF-OAQYLSRUSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccccc1	ZINC001109563538	1367200340	/nfs/dbraw/zinc/20/03/40/1367200340.db2.gz	YASJEBDHEFZFGO-JKBKZWBZSA-N	0	3	342.483	3.137	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC[C@@]1(C)CN(CC2CC(C)(C)C2)CCO1	ZINC001107966193	1367221353	/nfs/dbraw/zinc/22/13/53/1367221353.db2.gz	BQNQQTKBPRHKAU-NRFANRHFSA-N	0	3	348.531	3.398	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NC[C@]1(C)CN(CC(CC)CC)CCO1	ZINC001107971270	1367224837	/nfs/dbraw/zinc/22/48/37/1367224837.db2.gz	QHCVMJXPAODAEK-GOSISDBHSA-N	0	3	344.927	3.408	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](N(C)CCOCC2CCC2)C1	ZINC001190353923	1367235291	/nfs/dbraw/zinc/23/52/91/1367235291.db2.gz	DPTAPARZRTYVFR-LJQANCHMSA-N	0	3	334.504	3.104	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](N(C)C[C@@H](O)c2ccccc2)C1	ZINC001190354816	1367236581	/nfs/dbraw/zinc/23/65/81/1367236581.db2.gz	QQFZXLGFIOKRNU-WOJBJXKFSA-N	0	3	342.483	3.021	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](N(C)CCOc2ccccc2F)C1	ZINC001190391508	1367250124	/nfs/dbraw/zinc/25/01/24/1367250124.db2.gz	ZJEKBKBDQGWFEH-MRXNPFEDSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](N(C)Cc2ccc(COC)cc2)C1	ZINC001190428665	1367262566	/nfs/dbraw/zinc/26/25/66/1367262566.db2.gz	NAKNKMZKXKDIBR-LJQANCHMSA-N	0	3	330.472	3.222	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](N(C)CCOc2ccc(F)cc2)C1	ZINC001190436024	1367264781	/nfs/dbraw/zinc/26/47/81/1367264781.db2.gz	OMHPEIGYTUNSOH-KRWDZBQOSA-N	0	3	334.435	3.094	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](N(C)CCOc2cccc(C)c2)C1	ZINC001190435890	1367265132	/nfs/dbraw/zinc/26/51/32/1367265132.db2.gz	LGKIEJBLZNDBFP-GOSISDBHSA-N	0	3	330.472	3.263	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@]1(C)CN(C[C@@H](C)CC(C)C)CCO1	ZINC001108144164	1367306524	/nfs/dbraw/zinc/30/65/24/1367306524.db2.gz	LLHABBZGWKXMEX-ICSRJNTNSA-N	0	3	336.520	3.069	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@]1(C)CN(CC2CC(C)(C)C2)CCO1	ZINC001108188511	1367330931	/nfs/dbraw/zinc/33/09/31/1367330931.db2.gz	UEUJDRHNEUUVBP-VQTJNVASSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCC1(C(=O)NC[C@]2(C)CN(CC3CCCC3)CCO2)CCC1	ZINC001108188784	1367332516	/nfs/dbraw/zinc/33/25/16/1367332516.db2.gz	YRFVBILHSZWPQV-LJQANCHMSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2ccccc2C(C)(C)C)C1	ZINC001190830360	1367362411	/nfs/dbraw/zinc/36/24/11/1367362411.db2.gz	WTQUNGGFZWYAST-KRWDZBQOSA-N	0	3	344.499	3.333	20	30		EGEDHN
C#Cc1ccccc1C(=O)Nc1ccc(CN2CCN(CC)CC2)cc1	ZINC001191119675	1367426820	/nfs/dbraw/zinc/42/68/20/1367426820.db2.gz	IPPUFVUXUCAYLU-UHFFFAOYSA-N	0	3	347.462	3.058	20	30		EGEDHN
C=CCCC(=O)N1CCC([C@@H]2OCCC[C@@H]2NCC(=C)Cl)CC1	ZINC001186122556	1387874104	/nfs/dbraw/zinc/87/41/04/1387874104.db2.gz	CAPUHFANAZMVLP-WMZOPIPTSA-N	0	3	340.895	3.081	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@H](C)CCc1ccccc1)C2	ZINC001110180218	1367549035	/nfs/dbraw/zinc/54/90/35/1367549035.db2.gz	YRYQINVGXWFMSN-PBASOCQRSA-N	0	3	338.495	3.390	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccccc1CC	ZINC001110183246	1367552353	/nfs/dbraw/zinc/55/23/53/1367552353.db2.gz	OHQMBULTFDMWMJ-XCLNPWKQSA-N	0	3	342.483	3.062	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](N(C)CCOc2ccc(F)cc2)C1	ZINC001191694151	1367561282	/nfs/dbraw/zinc/56/12/82/1367561282.db2.gz	BDGVKPGTRSGTNA-QGZVFWFLSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3CCCOCC)CCCC1	ZINC001110214236	1367568933	/nfs/dbraw/zinc/56/89/33/1367568933.db2.gz	ANDHZLIKSBOCBP-SQNIBIBYSA-N	0	3	334.504	3.271	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](N(C)Cc2ccc(F)cc2)C1	ZINC001191726801	1367571946	/nfs/dbraw/zinc/57/19/46/1367571946.db2.gz	CKLNGIZEFXQDTJ-IBGZPJMESA-N	0	3	330.447	3.442	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCN(C(=O)CCCC2CC2)C1	ZINC001191859678	1367616300	/nfs/dbraw/zinc/61/63/00/1367616300.db2.gz	PMMOGMSLEIZKRX-LJQANCHMSA-N	0	3	325.456	3.171	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@@H](N(C)Cc2ccccc2N(C)C)C1	ZINC001191913309	1367637503	/nfs/dbraw/zinc/63/75/03/1367637503.db2.gz	WPNBGLCFQGBIMF-IEBWSBKVSA-N	0	3	343.515	3.388	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@H](N(C)CCOc2ccccc2F)C1	ZINC001192160235	1367703663	/nfs/dbraw/zinc/70/36/63/1367703663.db2.gz	CBPHTVPMNVNSIL-UZLBHIALSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](N(C)Cc3cccc(C#N)c3)C2)CCC1	ZINC001192217039	1367721135	/nfs/dbraw/zinc/72/11/35/1367721135.db2.gz	BTNFTOPHDSJRMQ-LJQANCHMSA-N	0	3	337.467	3.337	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@@H]2C[C@H]2CC(C)(C)C)C1	ZINC001193095721	1367942751	/nfs/dbraw/zinc/94/27/51/1367942751.db2.gz	QDURLEBBIWUZDW-BSDSXHPESA-N	0	3	338.536	3.190	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)c2ccccc2C(C)C)C1	ZINC001193544408	1368057502	/nfs/dbraw/zinc/05/75/02/1368057502.db2.gz	LLVJJGLZEOKUDE-WOJBJXKFSA-N	0	3	344.499	3.331	20	30		EGEDHN
CCCCCCCCC(=O)N1CC[C@H](N(C)CCn2cccn2)C1	ZINC001193642447	1368082081	/nfs/dbraw/zinc/08/20/81/1368082081.db2.gz	OJNLYFWGVVYQQA-SFHVURJKSA-N	0	3	334.508	3.166	20	30		EGEDHN
C=CC1(CC(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3C[C@@H](C)OC)CCCCC1	ZINC001111135295	1368163826	/nfs/dbraw/zinc/16/38/26/1368163826.db2.gz	KGGOVBPNCCPIFZ-TVFCKZIOSA-N	0	3	334.504	3.269	20	30		EGEDHN
C=C[C@@H](C(=O)N1CC[C@@H](N(C)CCOC2CCC2)C1)c1ccccc1	ZINC001194183809	1368203265	/nfs/dbraw/zinc/20/32/65/1368203265.db2.gz	URZZIQPQQAKCBP-UYAOXDASSA-N	0	3	342.483	3.058	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)C[C@@H](C=C)c2ccccc2)C1	ZINC001194200934	1368207743	/nfs/dbraw/zinc/20/77/43/1368207743.db2.gz	QENUQARDKMZXMI-QUCCMNQESA-N	0	3	342.483	3.082	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)C[C@H]2CCCCC2(C)C)C1	ZINC001194532492	1368280219	/nfs/dbraw/zinc/28/02/19/1368280219.db2.gz	TVEGBDSYOOZNOG-MSOLQXFVSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](N(C)CCOCCCC)C2)CCCC1	ZINC001194568854	1368288716	/nfs/dbraw/zinc/28/87/16/1368288716.db2.gz	VUWOPKBOZCMPLH-GOSISDBHSA-N	0	3	336.520	3.472	20	30		EGEDHN
C#CC[C@@H](CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCCF)c1ccccc1	ZINC001111511354	1368323979	/nfs/dbraw/zinc/32/39/79/1368323979.db2.gz	JFECXSBORDOOQU-NMLBUPMWSA-N	0	3	342.458	3.265	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C(C)(C)CC(C)C)C[C@@H](C)O2	ZINC001111552625	1368343558	/nfs/dbraw/zinc/34/35/58/1368343558.db2.gz	JHJFHTQWRJXQJW-QGZVFWFLSA-N	0	3	336.520	3.327	20	30		EGEDHN
CCCCCCCN1C[C@@H]2CCC[C@]2(NC(=O)c2cnns2)C1	ZINC001111618875	1368378224	/nfs/dbraw/zinc/37/82/24/1368378224.db2.gz	WQAYAZIBGXRTDK-YOEHRIQHSA-N	0	3	336.505	3.093	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CCCN([C@H](C)c2ccccc2)CC1	ZINC001195125365	1368383849	/nfs/dbraw/zinc/38/38/49/1368383849.db2.gz	LATOBUFNMBLFSW-QZTJIDSGSA-N	0	3	330.472	3.263	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CCCN([C@@H]2CCc3ccccc32)CC1	ZINC001195174602	1368393078	/nfs/dbraw/zinc/39/30/78/1368393078.db2.gz	QIVRLJRZZZBABT-YLJYHZDGSA-N	0	3	342.483	3.189	20	30		EGEDHN
CC/C(C)=C/C(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(C#N)cc1)C2	ZINC001111736867	1368434962	/nfs/dbraw/zinc/43/49/62/1368434962.db2.gz	ZEHKXHGPMYGYOS-ULAQWOPESA-N	0	3	337.467	3.385	20	30		EGEDHN
CC1(CC(=O)N[C@]23CCC[C@H]2CN(Cc2ccc(C#N)cc2)C3)CC1	ZINC001111811654	1368475209	/nfs/dbraw/zinc/47/52/09/1368475209.db2.gz	KHIPDNQEKZKKOD-RXVVDRJESA-N	0	3	337.467	3.219	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@]12CCC[C@H]1CN(Cc1cncc(C)c1)C2	ZINC001111848286	1368502115	/nfs/dbraw/zinc/50/21/15/1368502115.db2.gz	AIRGTUCAGWEHOY-LMNJBCLMSA-N	0	3	341.499	3.463	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cc(C)nnc2C)CC1	ZINC001195966416	1368524307	/nfs/dbraw/zinc/52/43/07/1368524307.db2.gz	CSXMIZJHPKDADP-UHFFFAOYSA-N	0	3	332.492	3.212	20	30		EGEDHN
C#CCN1C[C@@H]2CCC[C@]2(NC(=O)CCCCc2ccc(F)cc2)C1	ZINC001111883338	1368527288	/nfs/dbraw/zinc/52/72/88/1368527288.db2.gz	FKDGYJCBSMDBCS-RXVVDRJESA-N	0	3	342.458	3.142	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cn(C)nc2CC)CC1	ZINC001196232154	1368572270	/nfs/dbraw/zinc/57/22/70/1368572270.db2.gz	QRECMLKTRKAEBR-UHFFFAOYSA-N	0	3	334.508	3.101	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H](C)Cc2ccccc2C)C1	ZINC001112014190	1368619166	/nfs/dbraw/zinc/61/91/66/1368619166.db2.gz	MBGZNVJAOUMMCN-CUWPLCDZSA-N	0	3	326.484	3.330	20	30		EGEDHN
C=CCCC1(C(=O)N2CCCN(C[C@H](OCC)C3CC3)CC2)CC1	ZINC001197062079	1368737540	/nfs/dbraw/zinc/73/75/40/1368737540.db2.gz	IFKOYJSAKSGMIH-SFHVURJKSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCC[C@H](C)N1CCCN(C(=O)c2ocnc2C(F)F)CC1	ZINC001197165179	1368757896	/nfs/dbraw/zinc/75/78/96/1368757896.db2.gz	AKUYMUFZGXCGTR-LBPRGKRZSA-N	0	3	327.375	3.115	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2csc(C(F)(F)F)n2)CC1	ZINC001197691004	1368873329	/nfs/dbraw/zinc/87/33/29/1368873329.db2.gz	BCSJMLFMAJSPRJ-UHFFFAOYSA-N	0	3	347.406	3.276	20	30		EGEDHN
CC#CCCCC(=O)N1C[C@@H]2CCC[C@]2(CNCc2nccs2)C1	ZINC001112512470	1368908090	/nfs/dbraw/zinc/90/80/90/1368908090.db2.gz	FCUDKAWIMJBESU-LPHOPBHVSA-N	0	3	345.512	3.055	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)c2ccccc2Cl)C1	ZINC001198047976	1368949826	/nfs/dbraw/zinc/94/98/26/1368949826.db2.gz	PZCXFVVSPPIXMF-IAGOWNOFSA-N	0	3	338.879	3.085	20	30		EGEDHN
C#CCCN1CCCN(C(=O)[C@@H](c2ccccc2)[C@@H](C)CC)CC1	ZINC001198078383	1368955529	/nfs/dbraw/zinc/95/55/29/1368955529.db2.gz	VFTIUFXYFIZHCG-AZUAARDMSA-N	0	3	326.484	3.374	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)C[C@@H](C)C(C)(C)C)C1	ZINC001198161880	1368970979	/nfs/dbraw/zinc/97/09/79/1368970979.db2.gz	RBAQRMVPBAWYPB-BRWVUGGUSA-N	0	3	326.525	3.190	20	30		EGEDHN
C#CCCN1CCCN(C(=O)C[C@@H](C)CCc2ccccc2)CC1	ZINC001198331033	1369010220	/nfs/dbraw/zinc/01/02/20/1369010220.db2.gz	VDJYUADYBBFDPW-IBGZPJMESA-N	0	3	326.484	3.203	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N1CCCN([C@H](C)c2cccc(C)c2)CC1	ZINC001198343970	1369013017	/nfs/dbraw/zinc/01/30/17/1369013017.db2.gz	POYAOHFFKLLUKK-QZTJIDSGSA-N	0	3	330.472	3.181	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N1CCCN(CCCc2cccc(C)c2)CC1	ZINC001198343710	1369013273	/nfs/dbraw/zinc/01/32/73/1369013273.db2.gz	MSCXHSWZBZDTRR-LJQANCHMSA-N	0	3	344.499	3.053	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N1CCCN([C@H]2CCCc3ccccc32)CC1	ZINC001198345068	1369013444	/nfs/dbraw/zinc/01/34/44/1369013444.db2.gz	ZOFASQJWOYXYIK-XLIONFOSSA-N	0	3	342.483	3.189	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cc(N(C)C)ccn2)CC1	ZINC001198357633	1369015129	/nfs/dbraw/zinc/01/51/29/1369015129.db2.gz	FHZFTVSLQIZWTO-UHFFFAOYSA-N	0	3	346.519	3.266	20	30		EGEDHN
C=CCC1(C(=O)N2CCCN(C[C@@H](OCC)C3CC3)CC2)CCCC1	ZINC001198423366	1369029585	/nfs/dbraw/zinc/02/95/85/1369029585.db2.gz	NZSAXRHXPUWAFE-LJQANCHMSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)/C=C\c1ccco1)c1ccccc1OC	ZINC001198498930	1369046844	/nfs/dbraw/zinc/04/68/44/1369046844.db2.gz	FOLVUORTAQANOF-YUIUBULTSA-N	0	3	340.423	3.325	20	30		EGEDHN
C=CCCCCCN[C@H](CNC(=O)COCC)c1ccccc1OC	ZINC001198507020	1369048350	/nfs/dbraw/zinc/04/83/50/1369048350.db2.gz	ICBYSBUQUSECKQ-GOSISDBHSA-N	0	3	348.487	3.225	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)c1scnc1C)c1ccccc1OC	ZINC001198567222	1369061892	/nfs/dbraw/zinc/06/18/92/1369061892.db2.gz	NTFLORJPYLLHOI-HNNXBMFYSA-N	0	3	345.468	3.097	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)/C=C(\C)C1CC1)c1ccccc1OC	ZINC001198578005	1369065441	/nfs/dbraw/zinc/06/54/41/1369065441.db2.gz	MOCQXQAVBXGKLS-FDPSAONLSA-N	0	3	328.456	3.375	20	30		EGEDHN
C=CCC[C@H](C)N[C@@H](CNC(=O)COC(C)C)c1ccccc1OC	ZINC001198584466	1369066348	/nfs/dbraw/zinc/06/63/48/1369066348.db2.gz	HRRFEKZMGBGGHM-WMZOPIPTSA-N	0	3	348.487	3.222	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)CC(F)(F)F)c1ccccc1OC	ZINC001198585717	1369066819	/nfs/dbraw/zinc/06/68/19/1369066819.db2.gz	YYAGBYNMHXHNKE-CQSZACIVSA-N	0	3	344.377	3.361	20	30		EGEDHN
CCC/C=C\CCN[C@H](CNC(=O)[C@@H](C)C#N)c1ccccc1OC	ZINC001198616543	1369073534	/nfs/dbraw/zinc/07/35/34/1369073534.db2.gz	IPLZEBXBDSMJAN-PRVDXRAFSA-N	0	3	343.471	3.348	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)c1cncc(C)c1)c1ccccc1OC	ZINC001198634892	1369078227	/nfs/dbraw/zinc/07/82/27/1369078227.db2.gz	ANPFQXVAOMYSSN-SFHVURJKSA-N	0	3	339.439	3.035	20	30		EGEDHN
C=CCOCCCC(=O)NC[C@H](NCC(C)C)c1ccccc1OC	ZINC001198638458	1369080077	/nfs/dbraw/zinc/08/00/77/1369080077.db2.gz	XEWFQNMHPJDYIN-SFHVURJKSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)C1CC(C)C1)c1ccccc1OC	ZINC001198655887	1369084032	/nfs/dbraw/zinc/08/40/32/1369084032.db2.gz	IAZQOJATGFECLI-HTWSVDAQSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)c1csnc1C)c1ccccc1OC	ZINC001198667738	1369085972	/nfs/dbraw/zinc/08/59/72/1369085972.db2.gz	LCIVNMRUUUKDIC-INIZCTEOSA-N	0	3	345.468	3.097	20	30		EGEDHN
C#CCCCC(=O)NC[C@H](NCC1CC(C)C1)c1ccccc1OC	ZINC001198694444	1369092781	/nfs/dbraw/zinc/09/27/81/1369092781.db2.gz	IPDBJKVFTFABCJ-TVPLGVNVSA-N	0	3	342.483	3.292	20	30		EGEDHN
CC/C=C/CCN[C@H](CNC(=O)C#CC1CC1)c1ccccc1OC	ZINC001198723410	1369099661	/nfs/dbraw/zinc/09/96/61/1369099661.db2.gz	GOZYFWUVIDMRSA-VZSQWMKGSA-N	0	3	340.467	3.212	20	30		EGEDHN
C=CCC[C@H](C)N[C@@H](CNC(=O)c1cc[nH]c1)c1ccccc1OC	ZINC001198743468	1369103595	/nfs/dbraw/zinc/10/35/95/1369103595.db2.gz	ZLZROPSTMNSCEN-YJBOKZPZSA-N	0	3	341.455	3.439	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@H](NCCC)c1ccccc1OC	ZINC001198759679	1369106890	/nfs/dbraw/zinc/10/68/90/1369106890.db2.gz	KEDUJPDCQXGBFT-KRWDZBQOSA-N	0	3	341.455	3.153	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)CC(C)(C)COC)c1ccccc1OC	ZINC001198805555	1369118608	/nfs/dbraw/zinc/11/86/08/1369118608.db2.gz	BMWRSTUZBNCLKA-KRWDZBQOSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@H](NCCCF)c1ccccc1OC	ZINC001198857505	1369131542	/nfs/dbraw/zinc/13/15/42/1369131542.db2.gz	QMICKAYOXIMFPM-RDJZCZTQSA-N	0	3	336.451	3.404	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)c1nccs1)c1ccccc1OC	ZINC001198944931	1369154742	/nfs/dbraw/zinc/15/47/42/1369154742.db2.gz	IPSMSPMWLQLDRM-HNNXBMFYSA-N	0	3	345.468	3.179	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)C[C@H](C)COC)c1ccccc1OC	ZINC001198952910	1369156696	/nfs/dbraw/zinc/15/66/96/1369156696.db2.gz	DJKRIRKIZJJKMU-WMZOPIPTSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NC[C@@H](NCCCCC)c1ccccc1OC	ZINC001199001896	1369169882	/nfs/dbraw/zinc/16/98/82/1369169882.db2.gz	MMSYUKFHBXPKPE-SJLPKXTDSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)[C@H]2CCc3cc(F)ccc32)CC1	ZINC001113111390	1369209945	/nfs/dbraw/zinc/20/99/45/1369209945.db2.gz	VRKPIQAQJSIYGW-KXBFYZLASA-N	0	3	330.447	3.354	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CCC3CCCCC3)C[C@H]2O)CCCC1	ZINC001199567611	1369238005	/nfs/dbraw/zinc/23/80/05/1369238005.db2.gz	WEWLSWZFCFHELG-RTBURBONSA-N	0	3	348.531	3.255	20	30		EGEDHN
CC(C)C[C@@H](C)C(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001186646299	1387992888	/nfs/dbraw/zinc/99/28/88/1387992888.db2.gz	HVLTXSYRBLQOKR-RHSMWYFYSA-N	0	3	331.435	3.070	20	30		EGEDHN
N#Cc1c(NC(=S)NCCN2CCCCC2)sc2c1CCCC2	ZINC001200420479	1369364818	/nfs/dbraw/zinc/36/48/18/1369364818.db2.gz	ZCCBOPGMFLLNKW-UHFFFAOYSA-N	0	3	348.541	3.271	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC(NCc2c(F)cccc2Cl)CC1	ZINC001200448904	1369370977	/nfs/dbraw/zinc/37/09/77/1369370977.db2.gz	TUFQAJRRNXSXJU-UHFFFAOYSA-N	0	3	336.838	3.219	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC(NCc2oc(C)nc2C)CC1	ZINC001200747155	1369422424	/nfs/dbraw/zinc/42/24/24/1369422424.db2.gz	ATKUJZKHLQMDPA-UHFFFAOYSA-N	0	3	331.460	3.140	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCC(NC/C(Cl)=C\Cl)CC1	ZINC001201060200	1369474131	/nfs/dbraw/zinc/47/41/31/1369474131.db2.gz	NGNRCXHVDFYDEW-ACCUITESSA-N	0	3	342.270	3.187	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)[C@H](c2ccccc2)N(C)CC)CC1	ZINC001113529058	1369479925	/nfs/dbraw/zinc/47/99/25/1369479925.db2.gz	BUOXKCLCXVFFOA-QUCCMNQESA-N	0	3	343.515	3.178	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCCO[C@@H](CNCc2cccc(F)c2)C1	ZINC001201233252	1369501998	/nfs/dbraw/zinc/50/19/98/1369501998.db2.gz	MWEYENWIUYNQJZ-LPHOPBHVSA-N	0	3	348.462	3.135	20	30		EGEDHN
Cc1sc(Nc2ccnc(N3CCN(C)CC3)c2)c(C#N)c1C	ZINC001201651046	1369596926	/nfs/dbraw/zinc/59/69/26/1369596926.db2.gz	KPFWSUGJBHUBTL-UHFFFAOYSA-N	0	3	327.457	3.127	20	30		EGEDHN
N#Cc1ccc(CN2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)CCC2CCCC2)cc1	ZINC001113805775	1369616003	/nfs/dbraw/zinc/61/60/03/1369616003.db2.gz	IJEAVYMVLALEGW-KXTWHKPSSA-N	0	3	337.467	3.075	20	30		EGEDHN
CC#CCNC[C@H]1CN(C(=O)[C@H](CCCCC)C(C)C)CCCO1	ZINC001201822441	1369629410	/nfs/dbraw/zinc/62/94/10/1369629410.db2.gz	AORSQBBMGRQZTL-RBUKOAKNSA-N	0	3	336.520	3.069	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC(N[C@@H](C)c2cnc(C)cn2)CC1	ZINC001202004868	1369664752	/nfs/dbraw/zinc/66/47/52/1369664752.db2.gz	QBELNYHRHXLPMN-KRWDZBQOSA-N	0	3	342.487	3.010	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)N1CCC(NCc2nc(C)c(C)s2)CC1	ZINC001202085026	1369684344	/nfs/dbraw/zinc/68/43/44/1369684344.db2.gz	OEYGAQYHGMXKKX-STQMWFEESA-N	0	3	335.517	3.299	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001202085777	1369684896	/nfs/dbraw/zinc/68/48/96/1369684896.db2.gz	ZMSRHEMMIIWVDL-HOTGVXAUSA-N	0	3	325.456	3.097	20	30		EGEDHN
C=CCCCC(=O)N1CCC(NCc2oc(CCC)nc2C)CC1	ZINC001202267027	1369725639	/nfs/dbraw/zinc/72/56/39/1369725639.db2.gz	RUGXCOBFHSTRBL-UHFFFAOYSA-N	0	3	333.476	3.372	20	30		EGEDHN
O=C(N[C@@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2)c1ccccc1	ZINC001202337791	1369742263	/nfs/dbraw/zinc/74/22/63/1369742263.db2.gz	WNUPFVMUXBQAOC-NHCUHLMSSA-N	0	3	344.458	3.369	20	30		EGEDHN
Cc1ccoc1C(=O)N[C@@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202446664	1369774421	/nfs/dbraw/zinc/77/44/21/1369774421.db2.gz	FRVYDYFEYCABCO-RBUKOAKNSA-N	0	3	348.446	3.270	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@@H](NCc2c(C)onc2CC)C12CCC2	ZINC001202589078	1369815088	/nfs/dbraw/zinc/81/50/88/1369815088.db2.gz	BBZJTPKIPPHICL-IAGOWNOFSA-N	0	3	331.460	3.029	20	30		EGEDHN
CC(C)CC(C)(C)C(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C1	ZINC001186933807	1388030847	/nfs/dbraw/zinc/03/08/47/1388030847.db2.gz	XQYUADPZVQTFKK-CQSZACIVSA-N	0	3	333.501	3.383	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)C(F)=C(C)C)C12CCC2	ZINC001202735283	1369872663	/nfs/dbraw/zinc/87/26/63/1369872663.db2.gz	LZFIVZIAVXEEMS-NWDGAFQWSA-N	0	3	345.256	3.175	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1C[C@@H](NCc2cccc(F)c2F)C12CCC2	ZINC001202844975	1369905862	/nfs/dbraw/zinc/90/58/62/1369905862.db2.gz	AULLEUBSUPBHQC-IAGOWNOFSA-N	0	3	346.421	3.285	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1[C@H]2CN(CCOC3CCCCCC3)C[C@H]21	ZINC001114352748	1369908044	/nfs/dbraw/zinc/90/80/44/1369908044.db2.gz	GTUYDDYFAQROON-RUYXUALKSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1C[C@H](NCc2cncs2)C12CCC2	ZINC001202959492	1369936289	/nfs/dbraw/zinc/93/62/89/1369936289.db2.gz	FTBVVEHEWDMBRO-IRXDYDNUSA-N	0	3	345.512	3.429	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1C[C@H](NCc2ccns2)C12CCC2	ZINC001202969412	1369940875	/nfs/dbraw/zinc/94/08/75/1369940875.db2.gz	PPWYZTWZGUOKKC-LSDHHAIUSA-N	0	3	333.501	3.262	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1C[C@H](NCc2conc2C)C12CCC2	ZINC001203258978	1370046140	/nfs/dbraw/zinc/04/61/40/1370046140.db2.gz	UFIKLYJPCVYRFU-JKSUJKDBSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1[C@H]2CN(Cc3ccc(CF)cc3)C[C@H]21	ZINC001114726471	1370048842	/nfs/dbraw/zinc/04/88/42/1370048842.db2.gz	MGYCRRHLEMAFAO-QKUWSGOFSA-N	0	3	330.447	3.305	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1C[C@H](NCc2ccccn2)C12CCC2	ZINC001203295313	1370067184	/nfs/dbraw/zinc/06/71/84/1370067184.db2.gz	JRFIQTBTXICLSK-RBUKOAKNSA-N	0	3	339.483	3.182	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1C[C@@H](NCc2cnc(C)o2)C12CCC2	ZINC001203295501	1370067484	/nfs/dbraw/zinc/06/74/84/1370067484.db2.gz	LKZHYTTTXUVYGX-MSOLQXFVSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1[C@H]2CN(Cc3cc(C)ccc3OC)C[C@H]21	ZINC001114781511	1370077222	/nfs/dbraw/zinc/07/72/22/1370077222.db2.gz	SFZHFWQHXOMQKH-DIJFTKHXSA-N	0	3	342.483	3.152	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1C[C@H](NCc2c(C)noc2C)C12CCC2	ZINC001203338950	1370088888	/nfs/dbraw/zinc/08/88/88/1370088888.db2.gz	DQXABRJOVBJDAB-DLBZAZTESA-N	0	3	331.460	3.165	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1C[C@@H](NCc2c(C)noc2C)C12CCC2	ZINC001203338957	1370089033	/nfs/dbraw/zinc/08/90/33/1370089033.db2.gz	DQXABRJOVBJDAB-SJORKVTESA-N	0	3	331.460	3.165	20	30		EGEDHN
CC(F)(F)CC(=O)N[C@@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001203372093	1370102450	/nfs/dbraw/zinc/10/24/50/1370102450.db2.gz	CJQJVGRIKQZWHQ-DLBZAZTESA-N	0	3	346.421	3.100	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2C[C@@H](NCc3ccns3)C23CCC3)CC1	ZINC001203372896	1370103336	/nfs/dbraw/zinc/10/33/36/1370103336.db2.gz	GFMAOUOZDULHSI-HZPDHXFCSA-N	0	3	345.512	3.407	20	30		EGEDHN
O=C(N[C@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2)C1CC2(CC2)C1	ZINC001203402613	1370113718	/nfs/dbraw/zinc/11/37/18/1370113718.db2.gz	IQRJSJSNWRWPPN-UXHICEINSA-N	0	3	348.490	3.245	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1C[C@@H](NCc2cncs2)C12CCC2	ZINC001203450891	1370130373	/nfs/dbraw/zinc/13/03/73/1370130373.db2.gz	GGMLJJRMUFSSLQ-CABCVRRESA-N	0	3	333.501	3.262	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1C[C@@H](NCc2ocnc2C)C12CCC2	ZINC001203451029	1370131337	/nfs/dbraw/zinc/13/13/37/1370131337.db2.gz	HQQUDMSJTBGUDM-CVEARBPZSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1[C@H]2CN(Cc3cccc(OC)c3C)C[C@H]21	ZINC001114896220	1370135414	/nfs/dbraw/zinc/13/54/14/1370135414.db2.gz	LEXCOUXQVXYRHP-DZFIZOCASA-N	0	3	342.483	3.152	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCC[N@@H+](Cc1ccccc1[O-])[C@H]2CC	ZINC001203551308	1370166763	/nfs/dbraw/zinc/16/67/63/1370166763.db2.gz	BRIKUSVPZQXQSJ-ICSRJNTNSA-N	0	3	328.456	3.314	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCC[N@H+](Cc1ccccc1[O-])[C@H]2CC	ZINC001203551308	1370166766	/nfs/dbraw/zinc/16/67/66/1370166766.db2.gz	BRIKUSVPZQXQSJ-ICSRJNTNSA-N	0	3	328.456	3.314	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)COCCCCCC)C12CCC2	ZINC001203659609	1370205627	/nfs/dbraw/zinc/20/56/27/1370205627.db2.gz	JWEKGZDKOINKBC-JKSUJKDBSA-N	0	3	342.911	3.353	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@@H](OCC4CC4)CO3)CC2)c1	ZINC001203758299	1370252004	/nfs/dbraw/zinc/25/20/04/1370252004.db2.gz	VTZZFBYSDLUKMD-LJQANCHMSA-N	0	3	326.440	3.108	20	30		EGEDHN
C=CCO[C@H]1CO[C@]2(C1)CCCN(Cc1ccc(OCC)cc1)C2	ZINC001203967031	1370334134	/nfs/dbraw/zinc/33/41/34/1370334134.db2.gz	AJBAPPOQERBLLX-UXHICEINSA-N	0	3	331.456	3.411	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCC[N@@H+](Cc1ccc(O)cc1[O-])[C@@H]2CC	ZINC001204273703	1370428286	/nfs/dbraw/zinc/42/82/86/1370428286.db2.gz	SHUXJKBTBDLTHJ-QUCCMNQESA-N	0	3	344.455	3.019	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCC[N@H+](Cc1ccc(O)cc1[O-])[C@@H]2CC	ZINC001204273703	1370428288	/nfs/dbraw/zinc/42/82/88/1370428288.db2.gz	SHUXJKBTBDLTHJ-QUCCMNQESA-N	0	3	344.455	3.019	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3c(C)[nH]c4ccccc43)C2)C1=O	ZINC001204290521	1370432537	/nfs/dbraw/zinc/43/25/37/1370432537.db2.gz	SKBINXKXKCKZBH-NRFANRHFSA-N	0	3	337.467	3.477	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)[C@@H]2CC2(C)C)CCCCC1	ZINC001115485857	1370490331	/nfs/dbraw/zinc/49/03/31/1370490331.db2.gz	HMCUOFZFUPJYRH-ZDUSSCGKSA-N	0	3	343.309	3.350	20	30		EGEDHN
Cn1cc(CN2CCN(c3cccc(C#N)c3)CC2)c2ccccc21	ZINC001204319329	1370442520	/nfs/dbraw/zinc/44/25/20/1370442520.db2.gz	PEKKLXQHPCMDTG-UHFFFAOYSA-N	0	3	330.435	3.372	20	30		EGEDHN
C#CCCCCC(=O)NCC1(NCc2conc2CC)CCCCC1	ZINC001115490678	1370493687	/nfs/dbraw/zinc/49/36/87/1370493687.db2.gz	GVFBSPHCJRPYSH-UHFFFAOYSA-N	0	3	345.487	3.339	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@@H]1CCN(Cc1ccc(F)c(OC)c1)C2	ZINC001204558329	1370514274	/nfs/dbraw/zinc/51/42/74/1370514274.db2.gz	XMMPDTKLPICQIZ-WOJBJXKFSA-N	0	3	349.446	3.408	20	30		EGEDHN
Cc1cc(C#N)cc(C#N)c1Nc1cccc(CN2CCN(C)CC2)c1	ZINC001204564089	1370517917	/nfs/dbraw/zinc/51/79/17/1370517917.db2.gz	IDZXFBRIIDHJDV-UHFFFAOYSA-N	0	3	345.450	3.229	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H]2OCC[C@H]2C(C)C)CCCCC1	ZINC001115541922	1370538639	/nfs/dbraw/zinc/53/86/39/1370538639.db2.gz	CGUILGBUBQEJMH-HOTGVXAUSA-N	0	3	342.911	3.209	20	30		EGEDHN
C=C(C)CCC(=O)NCC1(NCc2cccnc2OC)CCCCC1	ZINC001115557041	1370555562	/nfs/dbraw/zinc/55/55/62/1370555562.db2.gz	PTBLEHIJSPAFDV-UHFFFAOYSA-N	0	3	345.487	3.355	20	30		EGEDHN
CN1CCN(Cc2ccc(Nc3cc(F)c(F)c(C#N)c3)cc2)CC1	ZINC001204758899	1370569276	/nfs/dbraw/zinc/56/92/76/1370569276.db2.gz	OJEPLLJPNNXRPJ-UHFFFAOYSA-N	0	3	342.393	3.327	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cc3c[nH]ccc-3n2)CCCCC1	ZINC001115595201	1370596633	/nfs/dbraw/zinc/59/66/33/1370596633.db2.gz	SHHFMDZIFHMETN-UHFFFAOYSA-N	0	3	346.862	3.338	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ncccc2CC)CCCCC1	ZINC001115608656	1370607477	/nfs/dbraw/zinc/60/74/77/1370607477.db2.gz	YFOAACNTXNGCDA-UHFFFAOYSA-N	0	3	335.879	3.419	20	30		EGEDHN
C=CCCN1C[C@@H](O)[C@H](N(Cc2ccccc2)C(=O)C(C)(C)CC)C1	ZINC001205181851	1370672759	/nfs/dbraw/zinc/67/27/59/1370672759.db2.gz	NCXOYLSLVIVNIJ-RTBURBONSA-N	0	3	344.499	3.073	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H]2CCC[C@@H](OC)C2)CCCCC1	ZINC001115697506	1370678900	/nfs/dbraw/zinc/67/89/00/1370678900.db2.gz	FLZNURZNXAJWTN-JKSUJKDBSA-N	0	3	342.911	3.353	20	30		EGEDHN
C=CCCCC(=O)NCC1(NCc2cnc(C)nc2)CCCCC1	ZINC001115701612	1370683627	/nfs/dbraw/zinc/68/36/27/1370683627.db2.gz	XFLPMSLDCPDEOY-UHFFFAOYSA-N	0	3	330.476	3.050	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@@H](C)C(C)C)CC[C@H]1c1ccc(F)cc1	ZINC001205312966	1370718003	/nfs/dbraw/zinc/71/80/03/1370718003.db2.gz	KXYJEJNILQJCHV-FFZOFVMBSA-N	0	3	344.474	3.415	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H](C)CC(C)(C)C)C[C@H]1c1cccc(F)c1	ZINC001205439935	1370756015	/nfs/dbraw/zinc/75/60/15/1370756015.db2.gz	QYNYCOAYXLNTRT-ZYSHUDEJSA-N	0	3	344.474	3.415	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)N1CCC(CNCc2csc(CC)n2)CC1	ZINC001205961086	1370923887	/nfs/dbraw/zinc/92/38/87/1370923887.db2.gz	LMNGLKKPZGOIGD-HUUCEWRRSA-N	0	3	349.544	3.492	20	30		EGEDHN
C[C@@H](CC(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C1)C(C)(C)C	ZINC001187413468	1388104321	/nfs/dbraw/zinc/10/43/21/1388104321.db2.gz	YHSHNOBHDQBBTR-UONOGXRCSA-N	0	3	333.501	3.383	20	30		EGEDHN
C=CCOCC(=O)N[C@@H]1CN(Cc2ccc(C(C)(C)C)cc2)C[C@H]1C	ZINC001206606390	1371107459	/nfs/dbraw/zinc/10/74/59/1371107459.db2.gz	ANEZSSZQSFQNCE-VQIMIIECSA-N	0	3	344.499	3.123	20	30		EGEDHN
C[C@@H](C#N)C(=O)N[C@@H]1CN(Cc2ccc(C3CCCC3)cc2)C[C@H]1C	ZINC001206659907	1371124576	/nfs/dbraw/zinc/12/45/76/1371124576.db2.gz	TVQQSSPDJJKQAN-RZQQEMMASA-N	0	3	339.483	3.440	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)C[C@@H](C)Cc2cccc(F)c2)C1	ZINC001206973794	1371253386	/nfs/dbraw/zinc/25/33/86/1371253386.db2.gz	WHLNPUQPGDEJMR-FRQCXROJSA-N	0	3	332.463	3.407	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN(CCOc2cc(C)ccc2C)C[C@H]1C	ZINC001207190586	1371325677	/nfs/dbraw/zinc/32/56/77/1371325677.db2.gz	ROOOUTDFXRHANW-RTBURBONSA-N	0	3	344.499	3.475	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N[C@@H]1CN(Cc2ccc(C)cc2)C[C@H]1C)OCC	ZINC001207255638	1371342624	/nfs/dbraw/zinc/34/26/24/1371342624.db2.gz	MAWBMKJMRLMGTL-RLLQIKCJSA-N	0	3	344.499	3.303	20	30		EGEDHN
O=C([C@@H]1CC=CCC1)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207257999	1371342714	/nfs/dbraw/zinc/34/27/14/1371342714.db2.gz	CCIMFVHXCHCYSL-QUCCMNQESA-N	0	3	340.442	3.114	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cnn(C(C)C)c2)CCCCC1	ZINC001119999040	1371449239	/nfs/dbraw/zinc/44/92/39/1371449239.db2.gz	RKRBFIOPFVGOKX-UHFFFAOYSA-N	0	3	338.883	3.239	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H](NCc2cc(Cl)cc3c2OCC3)C1	ZINC001207653513	1371465603	/nfs/dbraw/zinc/46/56/03/1371465603.db2.gz	ICRMALXTZBLUMH-QGZVFWFLSA-N	0	3	348.874	3.322	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NCC1(NCC(=C)Cl)CCCCC1	ZINC001120062612	1371474474	/nfs/dbraw/zinc/47/44/74/1371474474.db2.gz	PUBOFFSLCUEQQI-UHFFFAOYSA-N	0	3	344.886	3.372	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)C[C@H](C)[C@@H]2CCCO2)CCCCC1	ZINC001120062464	1371474872	/nfs/dbraw/zinc/47/48/72/1371474872.db2.gz	NWKCEVFUEOCSCG-HOCLYGCPSA-N	0	3	342.911	3.353	20	30		EGEDHN
O=C(CC1CCC1)N1CCC[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001207737680	1371489438	/nfs/dbraw/zinc/48/94/38/1371489438.db2.gz	JFVZSTNJVTVSJO-SFHVURJKSA-N	0	3	344.886	3.462	20	30		EGEDHN
C#CCCCCC(=O)N1CCC[C@H](NCc2c(C)nsc2C)C1	ZINC001207860321	1371522614	/nfs/dbraw/zinc/52/26/14/1371522614.db2.gz	JJEIEMVYXCOVBY-INIZCTEOSA-N	0	3	333.501	3.034	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207944017	1371545381	/nfs/dbraw/zinc/54/53/81/1371545381.db2.gz	HTBMEHMWUHMZMO-IBGZPJMESA-N	0	3	342.870	3.076	20	30		EGEDHN
CC(C)CC(=O)NC1CC2(CC(NCc3cc(F)ccc3C#N)C2)C1	ZINC001120539657	1371603406	/nfs/dbraw/zinc/60/34/06/1371603406.db2.gz	IXOYGDUKXKTIFX-UHFFFAOYSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC[C@H](NCc2scnc2C)C1	ZINC001208194993	1371634953	/nfs/dbraw/zinc/63/49/53/1371634953.db2.gz	VYQGWRIGPMUCLJ-INIZCTEOSA-N	0	3	333.501	3.301	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001208239532	1371672837	/nfs/dbraw/zinc/67/28/37/1371672837.db2.gz	BZQFWADIEKVVIF-IBGZPJMESA-N	0	3	342.458	3.360	20	30		EGEDHN
CC(C)(CC(F)F)C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001208316278	1371714402	/nfs/dbraw/zinc/71/44/02/1371714402.db2.gz	REMLRLRGQZHIDW-KRWDZBQOSA-N	0	3	348.437	3.300	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CN(Cc2ccc(CF)cc2)C[C@H]1C	ZINC001208371479	1371740136	/nfs/dbraw/zinc/74/01/36/1371740136.db2.gz	XOWOYTXKDSBFGC-VQIMIIECSA-N	0	3	330.447	3.286	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CN(CCOc2cccc(C)c2)C[C@H]1C	ZINC001208374684	1371742037	/nfs/dbraw/zinc/74/20/37/1371742037.db2.gz	SOHCUXJASFBPDH-UYAOXDASSA-N	0	3	342.483	3.004	20	30		EGEDHN
C#CCCCC(=O)NC1CC2(CC(NCc3cccc(F)c3F)C2)C1	ZINC001121020740	1371837074	/nfs/dbraw/zinc/83/70/74/1371837074.db2.gz	VFBDUGMNIWBQGP-UHFFFAOYSA-N	0	3	346.421	3.285	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)C[C@H](OCC)C(C)C)C2	ZINC001121232705	1371902176	/nfs/dbraw/zinc/90/21/76/1371902176.db2.gz	IDYGBPACVWUBMT-HVEGKCCWSA-N	0	3	342.911	3.207	20	30		EGEDHN
N#Cc1cccc(CCCN2CCN(Cc3cccc(F)c3)CC2)c1	ZINC001208852597	1371918252	/nfs/dbraw/zinc/91/82/52/1371918252.db2.gz	NDKGNOLYFYTRBE-UHFFFAOYSA-N	0	3	337.442	3.448	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](NCC#Cc2ccccc2Cl)C1	ZINC001208960355	1371962603	/nfs/dbraw/zinc/96/26/03/1371962603.db2.gz	GAVOUDAUXOHFOU-QGZVFWFLSA-N	0	3	344.886	3.484	20	30		EGEDHN
C=CCN(CCN1CCC(c2ccc(O)cc2)CC1)C(=O)OCC	ZINC001209020661	1371975825	/nfs/dbraw/zinc/97/58/25/1371975825.db2.gz	NDTAJHQEKDGGOO-UHFFFAOYSA-N	0	3	332.444	3.216	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001209147334	1372014889	/nfs/dbraw/zinc/01/48/89/1372014889.db2.gz	VXRGVQFTYHHCTN-YJBOKZPZSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC1CC2(CC(NCc3conc3C)C2)C1	ZINC001121609943	1372023093	/nfs/dbraw/zinc/02/30/93/1372023093.db2.gz	HNGAWCSOTUNIMG-SZVPOOPASA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC1CC2(CC(NCc3conc3CC)C2)C1	ZINC001121617118	1372026817	/nfs/dbraw/zinc/02/68/17/1372026817.db2.gz	SAIRZHMDUWATND-IRRXANFSSA-N	0	3	345.487	3.356	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC[C@H](NCc2cnn(C(C)(C)C)c2)C1	ZINC001209183027	1372027769	/nfs/dbraw/zinc/02/77/69/1372027769.db2.gz	KVBPNHCQBPRITF-WMZOPIPTSA-N	0	3	346.519	3.321	20	30		EGEDHN
CCn1ccc(C(=O)N2CCC[C@@H](NCC#Cc3ccccc3)C2)c1C	ZINC001209205099	1372037787	/nfs/dbraw/zinc/03/77/87/1372037787.db2.gz	NFINZSYVLNYVCQ-HXUWFJFHSA-N	0	3	349.478	3.062	20	30		EGEDHN
C=CCCCC(=O)NC1CC2(CC(NCc3oc(C)nc3C)C2)C1	ZINC001121668148	1372040773	/nfs/dbraw/zinc/04/07/73/1372040773.db2.gz	OYUPILYRPMOXLP-UHFFFAOYSA-N	0	3	331.460	3.165	20	30		EGEDHN
C#CCCCN1Cc2ccccc2C[C@H]1CNC(=O)OC(C)(C)C	ZINC001209268153	1372054615	/nfs/dbraw/zinc/05/46/15/1372054615.db2.gz	AOKZTFJHGCTQIM-SFHVURJKSA-N	0	3	328.456	3.351	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC[C@@H](NCc3ncccc3C)C2)CC1	ZINC001209466036	1372112559	/nfs/dbraw/zinc/11/25/59/1372112559.db2.gz	YRIOYUMTVGUBBQ-QGZVFWFLSA-N	0	3	327.472	3.217	20	30		EGEDHN
C=CCC1(C(=O)N2CCC[C@H](NCc3ncccc3C)C2)CCC1	ZINC001209503330	1372122505	/nfs/dbraw/zinc/12/25/05/1372122505.db2.gz	IYQMYGMAJDOWNA-KRWDZBQOSA-N	0	3	327.472	3.217	20	30		EGEDHN
CC(C)C1(C(=O)N2CCC[C@@H](NCC#Cc3ccc(F)cc3)C2)CC1	ZINC001209534398	1372130144	/nfs/dbraw/zinc/13/01/44/1372130144.db2.gz	BVMRXUYBLRLMHF-LJQANCHMSA-N	0	3	342.458	3.194	20	30		EGEDHN
C=C(C)Cn1c([C@@H](C)SC)nnc1N1CCN(C2CCCC2)CC1	ZINC001122596814	1372280763	/nfs/dbraw/zinc/28/07/63/1372280763.db2.gz	XSNWRGVQODYITJ-OAHLLOKOSA-N	0	3	349.548	3.343	20	30		EGEDHN
O=C(N1CCC[C@H](NCC#Cc2ccccc2)C1)C1(F)CCCCC1	ZINC001210456934	1372358414	/nfs/dbraw/zinc/35/84/14/1372358414.db2.gz	PTPNNKKZALOUTC-IBGZPJMESA-N	0	3	342.458	3.291	20	30		EGEDHN
O=C(C(C1CC1)C1CC1)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001210552616	1372376962	/nfs/dbraw/zinc/37/69/62/1372376962.db2.gz	MFYMEMBMEGURCS-FQEVSTJZSA-N	0	3	336.479	3.055	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCN(C(=O)[C@@H](c2ccccc2)N(C)CC)C1	ZINC001210633574	1372396310	/nfs/dbraw/zinc/39/63/10/1372396310.db2.gz	FWRJIOWTQMPIIH-ZWKOTPCHSA-N	0	3	349.906	3.013	20	30		EGEDHN
C=CCCCCCN1C[C@@H]2CCN(C(=O)c3cc(OC)ns3)[C@@H]2C1	ZINC001187958298	1388198127	/nfs/dbraw/zinc/19/81/27/1388198127.db2.gz	PHHYTYKSOCJZOD-LSDHHAIUSA-N	0	3	349.500	3.044	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)N2CCC[C@@H](NCC#Cc3ccccc3)C2)CC1	ZINC001210757045	1372421084	/nfs/dbraw/zinc/42/10/84/1372421084.db2.gz	NOISJGSXUIZBMB-HMXCVIKNSA-N	0	3	338.495	3.445	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N2CCC[C@H](NC[C@@H](F)CC)C2)cc1	ZINC001211321199	1372530896	/nfs/dbraw/zinc/53/08/96/1372530896.db2.gz	MLUZQLNPCVDEFY-ROUUACIJSA-N	0	3	348.462	3.123	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C[C@H](C)C(C)C)C[C@H]1c1ccccc1	ZINC001211555473	1372579995	/nfs/dbraw/zinc/57/99/95/1372579995.db2.gz	SQSGMPGXGRGTQO-YSIASYRMSA-N	0	3	326.484	3.276	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)CC2CC(C)(C)C2)C[C@H]1c1ccccc1	ZINC001211657821	1372597410	/nfs/dbraw/zinc/59/74/10/1372597410.db2.gz	OADUPGQVVGSNDQ-VQTJNVASSA-N	0	3	338.495	3.420	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C2(C(F)F)CCC2)C[C@H]1c1ccccc1	ZINC001211657841	1372597484	/nfs/dbraw/zinc/59/74/84/1372597484.db2.gz	OWJKBNOYIUFKAT-DLBZAZTESA-N	0	3	346.421	3.029	20	30		EGEDHN
C=CC[C@H](C(=O)N1CC[C@@H](NCc2cccnc2C)C1)c1ccccc1	ZINC001188001644	1388209985	/nfs/dbraw/zinc/20/99/85/1388209985.db2.gz	FYGQQWRKQVYNNZ-RTWAWAEBSA-N	0	3	349.478	3.440	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)C2C=CC=CC=C2)[C@H](OC)C1	ZINC001212340180	1372690560	/nfs/dbraw/zinc/69/05/60/1372690560.db2.gz	FMTWDSYKOGDUAB-RTBURBONSA-N	0	3	332.488	3.071	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1CN([C@@H](C)c2ccccc2)C[C@H]1OC	ZINC001213271122	1372871669	/nfs/dbraw/zinc/87/16/69/1372871669.db2.gz	IRUDCBIRMPABER-DFQSSKMNSA-N	0	3	342.483	3.147	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN(CCCCc2ccccc2)C[C@H]1OC	ZINC001213357331	1372891926	/nfs/dbraw/zinc/89/19/26/1372891926.db2.gz	PQUNNXNMEHSBLS-WOJBJXKFSA-N	0	3	344.499	3.181	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CN([C@H]2CCc3ccccc32)C[C@H]1OC	ZINC001213497796	1372914969	/nfs/dbraw/zinc/91/49/69/1372914969.db2.gz	HEXURRNPESPZKZ-CEXWTWQISA-N	0	3	342.483	3.092	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2cccc(C)c2C)[C@H](OC)C1	ZINC001213799781	1372962814	/nfs/dbraw/zinc/96/28/14/1372962814.db2.gz	AHJKLXNHXZFPID-WOJBJXKFSA-N	0	3	344.499	3.479	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H](NC(=O)c2ccc(Cl)s2)[C@H](OC)C1	ZINC001213810943	1372965091	/nfs/dbraw/zinc/96/50/91/1372965091.db2.gz	FBYWHYUSHKYSRL-YNEHKIRRSA-N	0	3	342.892	3.185	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2CN(CCCC(C)C)C[C@H]2OC)CCCCC1	ZINC001213957443	1372986732	/nfs/dbraw/zinc/98/67/32/1372986732.db2.gz	FPORTDUHLFYMJM-RTBURBONSA-N	0	3	348.531	3.212	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCC2CCCC2)C[C@H]1NCC#Cc1ccccc1	ZINC001214072142	1373004129	/nfs/dbraw/zinc/00/41/29/1373004129.db2.gz	CEHLYRYVVANYSJ-WIYYLYMNSA-N	0	3	338.495	3.445	20	30		EGEDHN
CC[C@H](C)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001214158670	1373017066	/nfs/dbraw/zinc/01/70/66/1373017066.db2.gz	RIMAUVSNUHSTIG-HDMKZQKVSA-N	0	3	332.875	3.174	20	30		EGEDHN
C[C@@H]1CN(C(=O)/C=C/C2CC2)C[C@H]1NCC#Cc1cccc(Cl)c1	ZINC001214397488	1373054125	/nfs/dbraw/zinc/05/41/25/1373054125.db2.gz	WEQMIDFKFOBVHI-XLMAXXKQSA-N	0	3	342.870	3.094	20	30		EGEDHN
Cc1cccc(Cl)c1CN[C@@H]1CN(C(=O)C#CC(C)C)C[C@H]1C	ZINC001214583903	1373084983	/nfs/dbraw/zinc/08/49/83/1373084983.db2.gz	DPGQEGUJHFXWAO-CRAIPNDOSA-N	0	3	332.875	3.244	20	30		EGEDHN
Cc1ccc(CN[C@@H]2CN(C(=O)C#CC(C)C)C[C@H]2C)c(Cl)c1	ZINC001214584320	1373085054	/nfs/dbraw/zinc/08/50/54/1373085054.db2.gz	WSHUMCHZVUNJTR-CRAIPNDOSA-N	0	3	332.875	3.244	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H](C)[C@H](NCc2c(C)nsc2C)C1	ZINC001214707724	1373106138	/nfs/dbraw/zinc/10/61/38/1373106138.db2.gz	PRKATPCBXRVYIH-FZKQIMNGSA-N	0	3	347.528	3.465	20	30		EGEDHN
C#CCC1(C(=O)N2C[C@@H](C)[C@H](NCc3cc(C)ccc3F)C2)CCC1	ZINC001214829634	1373126743	/nfs/dbraw/zinc/12/67/43/1373126743.db2.gz	CBGSNYJSVHHLGZ-VQIMIIECSA-N	0	3	342.458	3.264	20	30		EGEDHN
C#CCC1(C(=O)N2C[C@@H](C)[C@H](NCc3ccc(F)c(F)c3)C2)CCC1	ZINC001214830038	1373126819	/nfs/dbraw/zinc/12/68/19/1373126819.db2.gz	PNVLCPSRALRHKR-RDTXWAMCSA-N	0	3	346.421	3.095	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)C[C@@H]2C[C@H]2c2ccccc2)s1	ZINC001127519753	1373134460	/nfs/dbraw/zinc/13/44/60/1373134460.db2.gz	OKHMQZJMFCQFIB-YJBOKZPZSA-N	0	3	339.464	3.019	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CC3(CCC3)C2)C[C@H]1NCC#Cc1ccccc1	ZINC001215350509	1373200632	/nfs/dbraw/zinc/20/06/32/1373200632.db2.gz	PXVBADXBUGTLCT-YLJYHZDGSA-N	0	3	336.479	3.055	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)C/C=C/c2ccccc2F)cc1	ZINC001130170204	1373469312	/nfs/dbraw/zinc/46/93/12/1373469312.db2.gz	RTOZDRHFSRORRE-HWKANZROSA-N	0	3	337.398	3.007	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)C3C(C)(C)C3(C)C)[C@H]2C1	ZINC001217601166	1373471356	/nfs/dbraw/zinc/47/13/56/1373471356.db2.gz	NLZNOTMNPRRTHY-DLBZAZTESA-N	0	3	348.531	3.327	20	30		EGEDHN
C=C(C)CN1CC[C@H](Oc2cnccc2CNC(=O)CC(C)(C)C)C1	ZINC001130312776	1373490157	/nfs/dbraw/zinc/49/01/57/1373490157.db2.gz	CHNQYYNWLLZBNH-KRWDZBQOSA-N	0	3	345.487	3.163	20	30		EGEDHN
O=C(/C=C/c1ccccc1)c1ccccc1O[C@H]1CC[C@@H]2NCCO[C@@H]21	ZINC001218117622	1373564376	/nfs/dbraw/zinc/56/43/76/1373564376.db2.gz	ZYGZZKJNPQLXTK-BMZHNJBWSA-N	0	3	349.430	3.481	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)CCC[C@@H](C)CCC)C[C@H]1c1cn(C)cn1	ZINC001130603033	1373568309	/nfs/dbraw/zinc/56/83/09/1373568309.db2.gz	VYFZVNGOPMQPPV-JENIJYKNSA-N	0	3	346.519	3.097	20	30		EGEDHN
O=C(/C=C\c1ccc(O[C@H]2CC[C@@H]3NCCO[C@H]32)cc1)c1ccccc1	ZINC001218149815	1373569821	/nfs/dbraw/zinc/56/98/21/1373569821.db2.gz	SKXTVYITAQPFAM-RLZUSABDSA-N	0	3	349.430	3.481	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)C(C)(C)CCCCC)C[C@H]1c1cn(C)cn1	ZINC001130731912	1373585503	/nfs/dbraw/zinc/58/55/03/1373585503.db2.gz	TVXXBTMJYDYNHY-FUHWJXTLSA-N	0	3	346.519	3.097	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)C[C@H](CC)CCCC)[C@H]2C1	ZINC001218333832	1373598616	/nfs/dbraw/zinc/59/86/16/1373598616.db2.gz	XKNCRUXKUHVCPL-CEXWTWQISA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2OCCN(C(=O)c3cc(C)ccc3F)[C@H]2C1	ZINC001218689189	1373643977	/nfs/dbraw/zinc/64/39/77/1373643977.db2.gz	VWLVBMDAFLOSMA-ZYSHUDEJSA-N	0	3	346.446	3.014	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)[C@@H](CC)CC3CCCC3)[C@H]2C1	ZINC001218715552	1373646667	/nfs/dbraw/zinc/64/66/67/1373646667.db2.gz	JKFOKHHDIFBQRD-SLFFLAALSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)C[C@H](CC)C(C)(C)C)[C@H]2C1	ZINC001218945861	1373669957	/nfs/dbraw/zinc/66/99/57/1373669957.db2.gz	GGQYLTDCLNBXFM-OKZBNKHCSA-N	0	3	336.520	3.327	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCO[C@H]1C1CCN(C(=O)CCCCC)CC1	ZINC001131427238	1373696263	/nfs/dbraw/zinc/69/62/63/1373696263.db2.gz	RSOCWROCMFDPQQ-AEFFLSMTSA-N	0	3	342.911	3.305	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2ccc(C3CCCC3)cc2)[C@@H](O)C1	ZINC001220016081	1373746466	/nfs/dbraw/zinc/74/64/66/1373746466.db2.gz	JIOBMVXPKGEVIE-UXHICEINSA-N	0	3	342.483	3.085	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@H](C)O[C@@]3(CCN(CC(=C)C)C3)C2)CCC1	ZINC001131681901	1373760267	/nfs/dbraw/zinc/76/02/67/1373760267.db2.gz	JYOICJJMOQFOLX-FXAWDEMLSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2CN(CCC3CCCCCC3)C[C@@H]2O)CC1	ZINC001220289883	1373763460	/nfs/dbraw/zinc/76/34/60/1373763460.db2.gz	GCSQCIBGZKJHMF-MOPGFXCFSA-N	0	3	348.531	3.255	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)[C@H]2CCCC[C@@H]2C2CC2)s1	ZINC001131742040	1373780605	/nfs/dbraw/zinc/78/06/05/1373780605.db2.gz	PTTWEYFFJRZLEI-SJORKVTESA-N	0	3	331.485	3.042	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2snnc2C)CC[C@@H]1C	ZINC001131779770	1373801911	/nfs/dbraw/zinc/80/19/11/1373801911.db2.gz	JZDKSIBUNYWNDL-ZFWWWQNUSA-N	0	3	336.505	3.176	20	30		EGEDHN
C=CCC[C@H](C)N1CC[C@@H]2CN(C(=O)c3snnc3C(C)C)[C@@H]2C1	ZINC001221886496	1373802085	/nfs/dbraw/zinc/80/20/85/1373802085.db2.gz	JASSEISHTJZKGH-RRFJBIMHSA-N	0	3	348.516	3.163	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)CCC(C)(C)c3ccccc3)[C@@H]2C1	ZINC001222094110	1373816694	/nfs/dbraw/zinc/81/66/94/1373816694.db2.gz	VHTGDTCPLWFCMF-UYAOXDASSA-N	0	3	338.495	3.300	20	30		EGEDHN
Cc1ccc(CN2C[C@H](NC(=O)CSCC#N)CC[C@H]2C)cc1C	ZINC001131829311	1373828028	/nfs/dbraw/zinc/82/80/28/1373828028.db2.gz	DLOGKYWZSKHZFI-SJLPKXTDSA-N	0	3	345.512	3.029	20	30		EGEDHN
CC/C=C(\C)C(=O)N1CC[C@H]2CCN(Cc3ccc(C#N)cc3)[C@H]2C1	ZINC001222378897	1373829604	/nfs/dbraw/zinc/82/96/04/1373829604.db2.gz	RWJRRDJTEQFTIL-WRAMDRQPSA-N	0	3	337.467	3.337	20	30		EGEDHN
C#CCCCCC(=O)NCC1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001222871978	1373904579	/nfs/dbraw/zinc/90/45/79/1373904579.db2.gz	GWARRJNSTMLHBG-UHFFFAOYSA-N	0	3	337.467	3.080	20	30		EGEDHN
Cc1cc(F)ccc1CN1CCC(CNC(=O)C#CC(C)C)CC1	ZINC001223114106	1375032860	/nfs/dbraw/zinc/03/28/60/1375032860.db2.gz	HJSREGKUKPXXGI-UHFFFAOYSA-N	0	3	330.447	3.122	20	30		EGEDHN
C#CCN1CCC(CNC(=O)[C@@H](CC(C)C)c2ccccc2)CC1	ZINC001224778594	1375076700	/nfs/dbraw/zinc/07/67/00/1375076700.db2.gz	LYKWTMVTDNLJSU-FQEVSTJZSA-N	0	3	326.484	3.278	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2cc(OC)no2)CC[C@H]1C	ZINC001131979774	1375080780	/nfs/dbraw/zinc/08/07/80/1375080780.db2.gz	AXHYOACSHXPAKP-CABCVRRESA-N	0	3	335.448	3.012	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H]1CC[C@@H](C)N(CCCc2cccc(F)c2)C1	ZINC001132022235	1375103833	/nfs/dbraw/zinc/10/38/33/1375103833.db2.gz	WZEFDUPVORGZDD-XLIONFOSSA-N	0	3	344.474	3.387	20	30		EGEDHN
Cc1cc(=O)c(C#N)c(O[C@H]2CCN(Cc3ccccc3)C[C@@H]2C)[nH]1	ZINC001225469042	1375114251	/nfs/dbraw/zinc/11/42/51/1375114251.db2.gz	GIGRBOWBWXVFFU-LIRRHRJNSA-N	0	3	337.423	3.257	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)CC[C@H]2CCc3ccccc32)CC1	ZINC001225542015	1375122409	/nfs/dbraw/zinc/12/24/09/1375122409.db2.gz	GCBMXDIRQQMZTK-HXUWFJFHSA-N	0	3	338.495	3.348	20	30		EGEDHN
C/C=C(/C)C(=O)N[C@@H]1CCCC[C@H]1NCc1cc(C#N)ccc1F	ZINC001225599576	1375130693	/nfs/dbraw/zinc/13/06/93/1375130693.db2.gz	CAFNKGRCAKUMDI-YYQAOVIASA-N	0	3	329.419	3.181	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1	ZINC001225752409	1375152476	/nfs/dbraw/zinc/15/24/76/1375152476.db2.gz	HMIMDTNAUIMCNB-NHCUHLMSSA-N	0	3	336.479	3.249	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2(Cc3ccccc3)CCC2)CC[C@@H]1C	ZINC001132111608	1375154318	/nfs/dbraw/zinc/15/43/18/1375154318.db2.gz	UHBWLFJJMYUUOE-ICSRJNTNSA-N	0	3	338.495	3.392	20	30		EGEDHN
CC[C@H](C)CC(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1	ZINC001225899621	1375171395	/nfs/dbraw/zinc/17/13/95/1375171395.db2.gz	XJILZHULTWSSAY-DFQSSKMNSA-N	0	3	326.484	3.491	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)CCc2ccc(C)cc2)CC[C@H]1C	ZINC001132168617	1375182817	/nfs/dbraw/zinc/18/28/17/1375182817.db2.gz	FENKXMCBLVDKBW-QUCCMNQESA-N	0	3	344.499	3.099	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@@H]1CCCC[C@H]1NCc1ccccc1F	ZINC001226134094	1375208442	/nfs/dbraw/zinc/20/84/42/1375208442.db2.gz	RSYYDIMWHHBWNQ-QZTJIDSGSA-N	0	3	330.447	3.392	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1CC[C@@H](C)N(Cc2cccc(N(C)C)c2)C1	ZINC001132218549	1375217501	/nfs/dbraw/zinc/21/75/01/1375217501.db2.gz	RSIJNKJTAYPAJS-AEFFLSMTSA-N	0	3	343.515	3.434	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)Cc2cc(C)cc(C)c2)CC[C@H]1C	ZINC001132262612	1375252820	/nfs/dbraw/zinc/25/28/20/1375252820.db2.gz	ZWQNPZGKQXAVPS-QUCCMNQESA-N	0	3	344.499	3.018	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC[C@H](C)N(CCOCC3CCC3)C2)C1	ZINC001132273785	1375259549	/nfs/dbraw/zinc/25/95/49/1375259549.db2.gz	JXKJYOXSKVCMIF-WMZOPIPTSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H]2CC[C@H](C)N(CCOCC(C)C)C2)CC1	ZINC001132279065	1375263359	/nfs/dbraw/zinc/26/33/59/1375263359.db2.gz	UQOWZCGXNUTPNI-ROUUACIJSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H]2CC[C@@H](C)N(CCOCC(C)C)C2)CC1	ZINC001132279063	1375263567	/nfs/dbraw/zinc/26/35/67/1375263567.db2.gz	UQOWZCGXNUTPNI-MSOLQXFVSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CC[C@@H](C)N(CCOCC(C)C)C2)CC1	ZINC001132292941	1375273661	/nfs/dbraw/zinc/27/36/61/1375273661.db2.gz	WODAJPXKLJXIOJ-MJGOQNOKSA-N	0	3	336.520	3.375	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2CCCC[C@H]2NCc2cnc(C)s2)CCC1	ZINC001226720469	1375317107	/nfs/dbraw/zinc/31/71/07/1375317107.db2.gz	PNSCDXFMAKNJLW-IAGOWNOFSA-N	0	3	345.512	3.162	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)CC1(C(F)(F)F)CC1	ZINC001226749292	1375325210	/nfs/dbraw/zinc/32/52/10/1375325210.db2.gz	WGMZDCLWUREKQT-VXGBXAGGSA-N	0	3	338.801	3.489	20	30		EGEDHN
Cc1ccc2[nH]c(C(=O)NCCNCc3ccc(C#N)cc3)cc2c1C	ZINC001132362766	1375328503	/nfs/dbraw/zinc/32/85/03/1375328503.db2.gz	MGXOYNWPAOAOOB-UHFFFAOYSA-N	0	3	346.434	3.176	20	30		EGEDHN
C=C[C@@](C)(O)CC(=O)NC1CCN([C@H](CC)c2ccc(F)cc2)CC1	ZINC001227124593	1375394004	/nfs/dbraw/zinc/39/40/04/1375394004.db2.gz	VONILTMKLSPIEV-UYAOXDASSA-N	0	3	348.462	3.185	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COc2ccc(Cl)cc2)CC[C@@H]1C	ZINC001132457925	1375400449	/nfs/dbraw/zinc/40/04/49/1375400449.db2.gz	NKLNZUBOFUOULZ-GOEBONIOSA-N	0	3	336.863	3.264	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2ccc(C)c(C)c2)CC[C@H]1C	ZINC001132458842	1375402279	/nfs/dbraw/zinc/40/22/79/1375402279.db2.gz	YBBRTKQAKIBYIL-MJGOQNOKSA-N	0	3	330.472	3.089	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COc2ccccc2OCC)CC[C@@H]1C	ZINC001132460821	1375403569	/nfs/dbraw/zinc/40/35/69/1375403569.db2.gz	LYBVIFWTAVGHBQ-DLBZAZTESA-N	0	3	346.471	3.009	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COc2cccc(CC)c2)CC[C@H]1C	ZINC001132469010	1375409860	/nfs/dbraw/zinc/40/98/60/1375409860.db2.gz	PVKHUHLRRDAWHD-SJLPKXTDSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCc2nc3ccccc3o2)CC[C@H]1C	ZINC001132477526	1375415191	/nfs/dbraw/zinc/41/51/91/1375415191.db2.gz	FGNGMZOWTUGAAN-HZPDHXFCSA-N	0	3	341.455	3.306	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COc2ccc(C)cc2C)CC[C@@H]1C	ZINC001132481578	1375417597	/nfs/dbraw/zinc/41/75/97/1375417597.db2.gz	HQCCYSKBOXKKDH-ZWKOTPCHSA-N	0	3	330.472	3.227	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)C23CCC(CC2)CC3)CC[C@@H]1C	ZINC001132501116	1375426842	/nfs/dbraw/zinc/42/68/42/1375426842.db2.gz	UWIZWIRLSOSNPB-SARBKMAYSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC1CCN(C[C@@H](O)c2ccc(F)cc2)CC1	ZINC001227570006	1375445950	/nfs/dbraw/zinc/44/59/50/1375445950.db2.gz	GBVOLCUPHRSCIT-GOSISDBHSA-N	0	3	348.462	3.042	20	30		EGEDHN
CC#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)C2(C)CC2)CC1	ZINC001132554885	1375461962	/nfs/dbraw/zinc/46/19/62/1375461962.db2.gz	NMMLGANVCXUWAG-IBGZPJMESA-N	0	3	339.483	3.088	20	30		EGEDHN
C#CCN1CC[C@H](CN(Cc2scnc2C)C(=O)/C(C)=C/CC)C1	ZINC001132558275	1375465649	/nfs/dbraw/zinc/46/56/49/1375465649.db2.gz	KDZJEPKDAWVNNY-QRMGNNRRSA-N	0	3	345.512	3.092	20	30		EGEDHN
CC#CCN1CC[C@@H](CN(Cc2scnc2C)C(=O)CCCC)C1	ZINC001132559239	1375466674	/nfs/dbraw/zinc/46/66/74/1375466674.db2.gz	VFLRLPJVNDBQBQ-QGZVFWFLSA-N	0	3	347.528	3.316	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2N(Cc2ccsc2)C(=O)C(C)(C)F)CC1	ZINC001132563513	1375469430	/nfs/dbraw/zinc/46/94/30/1375469430.db2.gz	SFPBQKKZHARIBB-INIZCTEOSA-N	0	3	348.487	3.313	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2N(Cc2nccs2)C(=O)CC(C)C)CC1	ZINC001132566652	1375469845	/nfs/dbraw/zinc/46/98/45/1375469845.db2.gz	QQFVQMMQZXRUNI-MRXNPFEDSA-N	0	3	345.512	3.006	20	30		EGEDHN
C#CCC1(C(=O)NC2CCN(Cc3sc(C)nc3C)CC2)CCC1	ZINC001227754230	1375471857	/nfs/dbraw/zinc/47/18/57/1375471857.db2.gz	JPVRCTFRUPPJEU-UHFFFAOYSA-N	0	3	345.512	3.034	20	30		EGEDHN
CCC1(C(=O)N[C@@H]2CCCC[C@H]2NCc2ccc(C#N)cc2F)CC1	ZINC001228418411	1375568965	/nfs/dbraw/zinc/56/89/65/1375568965.db2.gz	GFBUOUUFZKHPOK-QZTJIDSGSA-N	0	3	343.446	3.405	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](C)[C@H](CNCc2ccn(CC)n2)C1	ZINC001132847067	1375600534	/nfs/dbraw/zinc/60/05/34/1375600534.db2.gz	RMIMTTCKGYGTMM-DLBZAZTESA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](C)[C@@H](CNCc2ncc(C)s2)C1	ZINC001132865442	1375608761	/nfs/dbraw/zinc/60/87/61/1375608761.db2.gz	NAFJCPOSFGQVCK-HOCLYGCPSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC1CCN(CCOc2ccccc2)CC1	ZINC001228597590	1375610352	/nfs/dbraw/zinc/61/03/52/1375610352.db2.gz	UCYDKLKVMJYWGK-UHFFFAOYSA-N	0	3	330.472	3.248	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](C)[C@@H](CNCc2nc(C)cs2)C1	ZINC001133090738	1375768898	/nfs/dbraw/zinc/76/88/98/1375768898.db2.gz	KWCXHIMLCQWOLU-ZBFHGGJFSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=CCCCC(=O)NCCNCc1cc(F)cc(Br)c1	ZINC001133144854	1375804733	/nfs/dbraw/zinc/80/47/33/1375804733.db2.gz	DZVGMOLWDLZOFT-UHFFFAOYSA-N	0	3	343.240	3.150	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC1CCN(C[C@H](O)c2ccc(F)cc2)CC1	ZINC001229369319	1375821243	/nfs/dbraw/zinc/82/12/43/1375821243.db2.gz	KVJQSAZPZZMSGN-SFHVURJKSA-N	0	3	348.462	3.042	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC1CCN(Cc2ccc(OC)cc2)CC1	ZINC001229377438	1375823831	/nfs/dbraw/zinc/82/38/31/1375823831.db2.gz	UCAQRGSMSDMWQD-UHFFFAOYSA-N	0	3	330.472	3.378	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@H]2CN(Cc3sc(C)nc3C)C[C@H]21	ZINC001188909123	1388407347	/nfs/dbraw/zinc/40/73/47/1388407347.db2.gz	NNYQGQNVFXMCMD-YESZJQIVSA-N	0	3	347.528	3.395	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H]2CN(CCOc3ccccc3)C[C@H]21	ZINC001188908950	1388407425	/nfs/dbraw/zinc/40/74/25/1388407425.db2.gz	LSAHITKUHYKVQF-WSTZPKSXSA-N	0	3	342.483	3.200	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@H]2CN(Cc3ccc(OC)cc3)C[C@H]21	ZINC001188908449	1388406221	/nfs/dbraw/zinc/40/62/21/1388406221.db2.gz	DGTSJSOLUVZBKC-XKGZKEIXSA-N	0	3	342.483	3.330	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H](F)Cc1ccccc1	ZINC001230236454	1375975337	/nfs/dbraw/zinc/97/53/37/1375975337.db2.gz	PDZZYJXEXJJVAW-BRWVUGGUSA-N	0	3	338.854	3.337	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)C1(C2CC2)CC1	ZINC001133399848	1375984191	/nfs/dbraw/zinc/98/41/91/1375984191.db2.gz	WYYYOBHFBIALBM-UHFFFAOYSA-N	0	3	344.886	3.472	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)CC1(C)CC1	ZINC001133401398	1375985775	/nfs/dbraw/zinc/98/57/75/1375985775.db2.gz	DGHBGRGXVAWEIZ-UHFFFAOYSA-N	0	3	332.875	3.472	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H]1CC[C@@H](C)C1	ZINC001133408122	1375993103	/nfs/dbraw/zinc/99/31/03/1375993103.db2.gz	XNHGSPMCYNMIQW-NVXWUHKLSA-N	0	3	332.875	3.328	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NC1CCN([C@@H](CC)c2ccc(F)cc2)CC1	ZINC001230415150	1376023681	/nfs/dbraw/zinc/02/36/81/1376023681.db2.gz	LLVJSBLVBFWXNM-KXBFYZLASA-N	0	3	348.462	3.449	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)c1cccc(F)c1	ZINC001133563578	1376091517	/nfs/dbraw/zinc/09/15/17/1376091517.db2.gz	JWEWPYFXCSUKKB-NEPJUHHUSA-N	0	3	343.240	3.221	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H](C)C[C@@H](C)NCc2cc(F)ccc2C#N)o1	ZINC001133652386	1376137966	/nfs/dbraw/zinc/13/79/66/1376137966.db2.gz	ASCPETFPGKXUFG-CHWSQXEVSA-N	0	3	343.402	3.286	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)c1cc(Cl)c[nH]1)NCc1ccccc1C#N	ZINC001133670761	1376146946	/nfs/dbraw/zinc/14/69/46/1376146946.db2.gz	FCHKKIQUQDYZNF-OLZOCXBDSA-N	0	3	344.846	3.226	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)[C@H](C)C(F)(F)F)Cc1cccnc1	ZINC001230813741	1376157008	/nfs/dbraw/zinc/15/70/08/1376157008.db2.gz	FBSLFEZXUWPHBO-AWEZNQCLSA-N	0	3	343.393	3.164	20	30		EGEDHN
C=CCCCC(=O)NCCCN(CCCOCC)Cc1cccnc1	ZINC001230829413	1376161746	/nfs/dbraw/zinc/16/17/46/1376161746.db2.gz	HLYYGRZPBMYABE-UHFFFAOYSA-N	0	3	347.503	3.173	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)CC/C=C\c2ccccc2)s1	ZINC001133699982	1376163857	/nfs/dbraw/zinc/16/38/57/1376163857.db2.gz	CDLUDRCRMGTYCW-YWEYNIOJSA-N	0	3	339.464	3.319	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)[C@H]1CC[C@H](C)C1)Cc1cccnc1	ZINC001230861258	1376168295	/nfs/dbraw/zinc/16/82/95/1376168295.db2.gz	FRYKBSMUIKBDGB-HKUYNNGSSA-N	0	3	329.488	3.402	20	30		EGEDHN
CC(C)SCC(=O)N[C@@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001133726235	1376178852	/nfs/dbraw/zinc/17/88/52/1376178852.db2.gz	FZZZQNUTDGMROI-CABCVRRESA-N	0	3	333.501	3.073	20	30		EGEDHN
C[C@H](c1ccccn1)N1CC[C@@H](Oc2ncnc3c(C#N)cccc23)C1	ZINC001231039937	1376197505	/nfs/dbraw/zinc/19/75/05/1376197505.db2.gz	LUVKJFBKAAADDY-GDBMZVCRSA-N	0	3	345.406	3.111	20	30		EGEDHN
C=CCOc1cccc(CN2CC[C@@H](Oc3cc(OC)ccn3)C2)c1	ZINC001231624737	1376284962	/nfs/dbraw/zinc/28/49/62/1376284962.db2.gz	LHVSWNMDVUYLBJ-LJQANCHMSA-N	0	3	340.423	3.308	20	30		EGEDHN
C#CCCCCC(=O)N[C@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001134119147	1376377609	/nfs/dbraw/zinc/37/76/09/1376377609.db2.gz	MGPOJSGKVORBCG-IAGOWNOFSA-N	0	3	325.456	3.125	20	30		EGEDHN
COc1cc(CN2CCC3SC(=O)C=C3C2)c(OC)cc1Cl	ZINC001232371467	1376452574	/nfs/dbraw/zinc/45/25/74/1376452574.db2.gz	GMOYDKNMMXNJAO-HNNXBMFYSA-N	0	3	339.844	3.131	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)C#CC1CC1)NCc1cccc(F)c1Cl	ZINC001134321660	1376475555	/nfs/dbraw/zinc/47/55/55/1376475555.db2.gz	KPCBGDXWRSYXDM-CHWSQXEVSA-N	0	3	336.838	3.265	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)C#CC(C)(C)C)NCc1ccncc1Cl	ZINC001134330210	1376480483	/nfs/dbraw/zinc/48/04/83/1376480483.db2.gz	XJLUYVMAVUCJGV-ZIAGYGMSSA-N	0	3	335.879	3.157	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H](C)C[C@@H](C)NCc1cc2n(n1)CCCC2	ZINC001134456658	1376548045	/nfs/dbraw/zinc/54/80/45/1376548045.db2.gz	BJAFMLLWJNELIL-HZPDHXFCSA-N	0	3	346.519	3.195	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H](C)C[C@H](C)NCc1nc2ccccc2n1C	ZINC001134471224	1376555725	/nfs/dbraw/zinc/55/57/25/1376555725.db2.gz	VMKXFBAZHCZZIG-JKSUJKDBSA-N	0	3	342.487	3.303	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCC2(CN(C(=O)OC(C)(C)C)C2)C1	ZINC001233079256	1376564679	/nfs/dbraw/zinc/56/46/79/1376564679.db2.gz	AQCQGZSFTXVFAA-UHFFFAOYSA-N	0	3	341.455	3.310	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCC(Oc2ccc(F)cn2)CC1	ZINC001233083288	1376567568	/nfs/dbraw/zinc/56/75/68/1376567568.db2.gz	DVBUURKVMIEZAZ-UHFFFAOYSA-N	0	3	325.387	3.444	20	30		EGEDHN
Cc1cc(C#N)ccc1CN(C)C[C@H]1CN(Cc2ccccc2)CCO1	ZINC001233083355	1376567952	/nfs/dbraw/zinc/56/79/52/1376567952.db2.gz	HDFJTJAIHOKVMW-QFIPXVFZSA-N	0	3	349.478	3.200	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cc(C)ns1)[C@H]2CC	ZINC001233310415	1376609646	/nfs/dbraw/zinc/60/96/46/1376609646.db2.gz	GDBSTHIGASPUNW-WMZOPIPTSA-N	0	3	333.501	3.373	20	30		EGEDHN
C[C@@H](CC1CCCCC1)C(=O)NCCNCc1cccc(C#N)c1	ZINC001134677910	1376651228	/nfs/dbraw/zinc/65/12/28/1376651228.db2.gz	LUQDPONEGXRDKC-INIZCTEOSA-N	0	3	327.472	3.371	20	30		EGEDHN
C#CCCCC(=O)N(C)C[C@@H]1CCN1CCc1ccccc1CC	ZINC001233948525	1376742466	/nfs/dbraw/zinc/74/24/66/1376742466.db2.gz	XDRVBLZBYHJWKM-FQEVSTJZSA-N	0	3	326.484	3.128	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N(C)C[C@H]2CCN2CCC(=C)C)cc1	ZINC001234254968	1376793298	/nfs/dbraw/zinc/79/32/98/1376793298.db2.gz	GTMQFKBLOUCKEA-LJQANCHMSA-N	0	3	340.467	3.201	20	30		EGEDHN
CCCCCCCN1CC[C@@H]1CN(C)C(=O)[C@H]1CCCc2cn[nH]c21	ZINC001234322091	1376808328	/nfs/dbraw/zinc/80/83/28/1376808328.db2.gz	FSZDKGPZPMFTSC-MSOLQXFVSA-N	0	3	346.519	3.333	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1cc(F)ccc1C#N)NC(=O)CC1(C)CC1	ZINC001135061753	1376873935	/nfs/dbraw/zinc/87/39/35/1376873935.db2.gz	DTKSTIZCBAQNLB-UONOGXRCSA-N	0	3	331.435	3.260	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H](C)C[C@@H](C)NCc1conc1CC	ZINC001135188234	1376961023	/nfs/dbraw/zinc/96/10/23/1376961023.db2.gz	IGJYXHRADBLDMY-HZPDHXFCSA-N	0	3	333.476	3.194	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H](C)C[C@@H](C)NCc1ccn(C(C)C)n1	ZINC001135194367	1376966268	/nfs/dbraw/zinc/96/62/68/1376966268.db2.gz	UHOZTOZXHOWBRG-MSOLQXFVSA-N	0	3	346.519	3.421	20	30		EGEDHN
C[C@H](CC(=O)NCCNCc1ccc(C#N)cc1)C1CCCCC1	ZINC001135227564	1376987866	/nfs/dbraw/zinc/98/78/66/1376987866.db2.gz	GHJAHCVDWGUULB-MRXNPFEDSA-N	0	3	327.472	3.371	20	30		EGEDHN
CCN1CC[C@]2(CCCN(Cc3ccc(C#N)cc3Cl)C2)C1=O	ZINC001238084399	1376994337	/nfs/dbraw/zinc/99/43/37/1376994337.db2.gz	QLXMGNNEWJZEDH-SFHVURJKSA-N	0	3	331.847	3.046	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001135239629	1376996758	/nfs/dbraw/zinc/99/67/58/1376996758.db2.gz	ZTCAAGBHBZLLJH-IRXDYDNUSA-N	0	3	325.456	3.125	20	30		EGEDHN
C=CCO[C@H]1CO[C@@]2(C1)CCCN(Cc1ccc(C#N)c(CC)c1)C2	ZINC001238775812	1377001860	/nfs/dbraw/zinc/00/18/60/1377001860.db2.gz	PCKORSQGQHPTDE-NHCUHLMSSA-N	0	3	340.467	3.447	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)C1(CC)CCC1	ZINC001135256770	1377006728	/nfs/dbraw/zinc/00/67/28/1377006728.db2.gz	WPANUGADZSWIJF-OLZOCXBDSA-N	0	3	331.298	3.348	20	30		EGEDHN
CCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2cc(F)ccc2C#N)CC1	ZINC001135391071	1377069875	/nfs/dbraw/zinc/06/98/75/1377069875.db2.gz	QKJFDOQVYKKVHM-KBPBESRZSA-N	0	3	331.435	3.260	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C[C@H](C)NCc2oc(C)nc2C)CCC1	ZINC001135394351	1377071286	/nfs/dbraw/zinc/07/12/86/1377071286.db2.gz	GJLNCCZAENYAKQ-UONOGXRCSA-N	0	3	333.476	3.411	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H](C)C[C@@H](C)NCc2ccn(C(C)C)n2)C1	ZINC001135428056	1377092431	/nfs/dbraw/zinc/09/24/31/1377092431.db2.gz	YHKMBMPNEKOWHD-HZPDHXFCSA-N	0	3	332.492	3.193	20	30		EGEDHN
CC(C)C1(C(=O)N[C@H](C)C[C@@H](C)NCc2ccccc2C#N)CC1	ZINC001135439160	1377098585	/nfs/dbraw/zinc/09/85/85/1377098585.db2.gz	RXXNKWREPLFMQP-HZPDHXFCSA-N	0	3	327.472	3.367	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H](C)C[C@H](C)NCC(=C)Br	ZINC001135560139	1377144277	/nfs/dbraw/zinc/14/42/77/1377144277.db2.gz	BYLQXDGRLRJVII-QWHCGFSZSA-N	0	3	331.298	3.370	20	30		EGEDHN
CCCN(CCNC(=O)[C@H]1CC12CCCC2)Cc1cccc(C#N)c1	ZINC001266575653	1377336113	/nfs/dbraw/zinc/33/61/13/1377336113.db2.gz	YBLSHOKZJOKRDI-LJQANCHMSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CC[C@@H](N(C)Cc2ccc(C)c(F)c2)C1	ZINC001189251261	1388496599	/nfs/dbraw/zinc/49/65/99/1388496599.db2.gz	OUAYTDPYDBQKMS-FUHWJXTLSA-N	0	3	348.462	3.148	20	30		EGEDHN
C#CCOc1ccc(CN2CCC[C@H](c3nc(CCC)no3)C2)cc1	ZINC001138557925	1377741931	/nfs/dbraw/zinc/74/19/31/1377741931.db2.gz	WYKXCJHJLDYIOV-KRWDZBQOSA-N	0	3	339.439	3.414	20	30		EGEDHN
C#CCOc1ccc(CN2CCC[C@@]3(C[C@@H](CCOC)CO3)C2)cc1	ZINC001138559719	1377742212	/nfs/dbraw/zinc/74/22/12/1377742212.db2.gz	QLZLQDCCBZRGDM-TZIWHRDSSA-N	0	3	343.467	3.106	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CCC(N3CCCCC3=O)CC2)c1[O-]	ZINC001138630628	1377757771	/nfs/dbraw/zinc/75/77/71/1377757771.db2.gz	ZDOWZVJQMRHHNE-UHFFFAOYSA-N	0	3	328.456	3.098	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cccnc1NC)[C@H]2CC	ZINC001138690114	1377768757	/nfs/dbraw/zinc/76/87/57/1377768757.db2.gz	CUSNEPDMAAFFBU-PXNSSMCTSA-N	0	3	342.487	3.045	20	30		EGEDHN
C=CCO[C@H]1CO[C@]2(C1)CCCN(Cc1ccc3c(c1)CCCO3)C2	ZINC001138715652	1377772287	/nfs/dbraw/zinc/77/22/87/1377772287.db2.gz	QODLUKHCYBOZCE-CTNGQTDRSA-N	0	3	343.467	3.338	20	30		EGEDHN
N#Cc1cccc(O[C@@H]2CCCN(Cc3cnc4[nH]ccc4c3)C2)c1	ZINC001138737617	1377776248	/nfs/dbraw/zinc/77/62/48/1377776248.db2.gz	JKFSFNKRGUIGEU-LJQANCHMSA-N	0	3	332.407	3.478	20	30		EGEDHN
C=CCOc1ccccc1CN1CCC[C@@]2(CCN(CC)C2=O)C1	ZINC001139032258	1377820329	/nfs/dbraw/zinc/82/03/29/1377820329.db2.gz	IFTOTFAAVGXGFY-HXUWFJFHSA-N	0	3	328.456	3.086	20	30		EGEDHN
C=CCN(CC=C)CCN1CCN(Cc2cc3ccccc3o2)CC1	ZINC001139064038	1377823993	/nfs/dbraw/zinc/82/39/93/1377823993.db2.gz	KNCUCALNEKQJQX-UHFFFAOYSA-N	0	3	339.483	3.224	20	30		EGEDHN
COc1ccc(CN2CCC3SC(=O)C=C3C2)c(Cl)c1OC	ZINC001139113145	1377831395	/nfs/dbraw/zinc/83/13/95/1377831395.db2.gz	COOWMLBKICERBF-CYBMUJFWSA-N	0	3	339.844	3.131	20	30		EGEDHN
N#Cc1cccc2c(CN3CCC[C@@H](Oc4cccnc4)C3)c[nH]c21	ZINC001139702996	1377937787	/nfs/dbraw/zinc/93/77/87/1377937787.db2.gz	FZBZULMYUYPNGX-GOSISDBHSA-N	0	3	332.407	3.478	20	30		EGEDHN
Cc1ccc(O[C@@H]2CCN(Cc3c[nH]c4c3cccc4C#N)C2)nc1	ZINC001139706632	1377938163	/nfs/dbraw/zinc/93/81/63/1377938163.db2.gz	BZXNGQROOHCLJT-QGZVFWFLSA-N	0	3	332.407	3.396	20	30		EGEDHN
COc1cc(O[C@@H]2CCN(Cc3c[nH]c4c3cccc4C#N)C2)ccn1	ZINC001139707814	1377938814	/nfs/dbraw/zinc/93/88/14/1377938814.db2.gz	ULPICGCOLBYAHJ-QGZVFWFLSA-N	0	3	348.406	3.096	20	30		EGEDHN
Cc1ccc(CN2CCC3(CC(=O)N(CC4CC4)C3)CC2)cc1C#N	ZINC001139727590	1377942712	/nfs/dbraw/zinc/94/27/12/1377942712.db2.gz	WBEXETMCYMABMQ-UHFFFAOYSA-N	0	3	337.467	3.091	20	30		EGEDHN
C=CCn1cc(CN2CCC(N(C)Cc3ccccc3F)CC2)cn1	ZINC001139770957	1377948597	/nfs/dbraw/zinc/94/85/97/1377948597.db2.gz	ITKAORGJOBGYDK-UHFFFAOYSA-N	0	3	342.462	3.305	20	30		EGEDHN
N#Cc1ccc2[nH]cc(CN3CC[C@H](N4CCCCC4)[C@@H](F)C3)c2c1	ZINC001140118372	1378012413	/nfs/dbraw/zinc/01/24/13/1378012413.db2.gz	GDYTTZXALMCZPC-ICSRJNTNSA-N	0	3	340.446	3.438	20	30		EGEDHN
COc1cccc(O[C@@H]2CCN(Cc3c[nH]c4ccc(C#N)cc34)C2)n1	ZINC001140117854	1378012902	/nfs/dbraw/zinc/01/29/02/1378012902.db2.gz	ZXYZOKFQIYEREQ-MRXNPFEDSA-N	0	3	348.406	3.096	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@H]1CCN(Cc1cc(F)cc(OC)c1)C2	ZINC001140480613	1378070519	/nfs/dbraw/zinc/07/05/19/1378070519.db2.gz	OPSUHHIYQYNFRH-PMACEKPBSA-N	0	3	349.446	3.408	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(CCCN(Cc3cccc(C#N)c3)CC2)C1=O	ZINC001272651670	1378077177	/nfs/dbraw/zinc/07/71/77/1378077177.db2.gz	VPZVQAPQEPQEHT-NRFANRHFSA-N	0	3	337.467	3.339	20	30		EGEDHN
N#Cc1ccc(CN2CCN([C@@H]3CCCc4ccccc43)CC2)cn1	ZINC001140545771	1378082648	/nfs/dbraw/zinc/08/26/48/1378082648.db2.gz	KGPQRGVKFVXVLB-OAQYLSRUSA-N	0	3	332.451	3.148	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)nc1)[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC001140547584	1378083478	/nfs/dbraw/zinc/08/34/78/1378083478.db2.gz	VDXHBZKBCFQBPQ-KRWDZBQOSA-N	0	3	344.459	3.173	20	30		EGEDHN
CC(C)N1CCC2(CCN(Cc3cc(C#N)ccc3Cl)CC2)C1=O	ZINC001140603379	1378095969	/nfs/dbraw/zinc/09/59/69/1378095969.db2.gz	LTJJCORHVSNBOV-UHFFFAOYSA-N	0	3	345.874	3.435	20	30		EGEDHN
C=C(C)CN1CCC2(CCN(Cc3[nH]cnc3C(C)(C)C)CC2)C1=O	ZINC001273361473	1378098716	/nfs/dbraw/zinc/09/87/16/1378098716.db2.gz	ZYNNWJHJXQKZPK-UHFFFAOYSA-N	0	3	344.503	3.098	20	30		EGEDHN
C=CCN(CC=C)CCN1CCN(Cc2coc3ccccc23)CC1	ZINC001140784925	1378135508	/nfs/dbraw/zinc/13/55/08/1378135508.db2.gz	FXYATWNLAFARLF-UHFFFAOYSA-N	0	3	339.483	3.224	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CCN(Cc3cnccc3C)CC2)CC1	ZINC001141031714	1378214665	/nfs/dbraw/zinc/21/46/65/1378214665.db2.gz	ZGYINMVHQKVZFC-UHFFFAOYSA-N	0	3	343.471	3.391	20	30		EGEDHN
CC(C)CN1CCN(Cc2cc(Br)ccc2C#N)CC1	ZINC001141897415	1378391218	/nfs/dbraw/zinc/39/12/18/1378391218.db2.gz	QVZUXTNJTVMXDI-UHFFFAOYSA-N	0	3	336.277	3.094	20	30		EGEDHN
N#Cc1ccc2c(CN3CC[C@H](N4CCCCC4)[C@@H](F)C3)c[nH]c2c1	ZINC001142929778	1378512216	/nfs/dbraw/zinc/51/22/16/1378512216.db2.gz	FSMRZMKTUOXWKF-ICSRJNTNSA-N	0	3	340.446	3.438	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1nc(C(C)C)oc1C)C(C)C	ZINC001753829583	1440499318	/nfs/dbraw/zinc/49/93/18/1440499318.db2.gz	PDUXDHILWQNBCB-ZDUSSCGKSA-N	0	3	327.856	3.203	20	30		EGEDHN
N#Cc1cncc(CN2C[C@H]3CCC[C@@]3(COCc3ccncc3)C2)c1	ZINC001144080430	1378680759	/nfs/dbraw/zinc/68/07/59/1378680759.db2.gz	LPEXDXWHCIORLH-RTWAWAEBSA-N	0	3	348.450	3.167	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2cc(C)no2)CCCCC1	ZINC001146664760	1378893495	/nfs/dbraw/zinc/89/34/95/1378893495.db2.gz	SZTMFMTWYQHTNK-HZPDHXFCSA-N	0	3	345.487	3.330	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cccc(-c3ccoc3)c2)cc1	ZINC001146949528	1378946243	/nfs/dbraw/zinc/94/62/43/1378946243.db2.gz	NLUMQPVTQXXXGL-UHFFFAOYSA-N	0	3	345.402	3.338	20	30		EGEDHN
CCCCCC(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001147009955	1378955472	/nfs/dbraw/zinc/95/54/72/1378955472.db2.gz	UTUTWKUFDRHDMI-UHFFFAOYSA-N	0	3	325.456	3.173	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cccc(C3CCC3)c2)s1	ZINC001147835161	1379088513	/nfs/dbraw/zinc/08/85/13/1379088513.db2.gz	QIHYZRIMBNDPLF-UHFFFAOYSA-N	0	3	339.464	3.407	20	30		EGEDHN
Cc1cc2cc(C(=O)NCCNCc3ccc(C#N)cc3)oc2cc1C	ZINC001148033522	1379107126	/nfs/dbraw/zinc/10/71/26/1379107126.db2.gz	SGIGEFXKNHUPDB-UHFFFAOYSA-N	0	3	347.418	3.441	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC2(C1)CCN(CCOc1ccccc1)C2	ZINC001148129503	1379122044	/nfs/dbraw/zinc/12/20/44/1379122044.db2.gz	GCHZUQINQMKAKP-GOSISDBHSA-N	0	3	342.483	3.202	20	30		EGEDHN
CCCC1(C(=O)N2CC3(C2)CCN(Cc2cccc(C#N)c2)C3)CC1	ZINC001148241959	1379138792	/nfs/dbraw/zinc/13/87/92/1379138792.db2.gz	XANVSYHWQHIEPI-UHFFFAOYSA-N	0	3	337.467	3.173	20	30		EGEDHN
Cc1ccc([C@@H](C)C(=O)NCCNCc2ccc(F)c(C#N)c2)cc1	ZINC001148278788	1379143495	/nfs/dbraw/zinc/14/34/95/1379143495.db2.gz	AWOSOHMHUWFCJB-OAHLLOKOSA-N	0	3	339.414	3.015	20	30		EGEDHN
Cc1ccc([C@H](C)C(=O)NCCNCc2ccc(C#N)c(F)c2)cc1	ZINC001148279074	1379144459	/nfs/dbraw/zinc/14/44/59/1379144459.db2.gz	HHWARULHPAMPHX-HNNXBMFYSA-N	0	3	339.414	3.015	20	30		EGEDHN
CCC(CC)CC(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001148492300	1379187846	/nfs/dbraw/zinc/18/78/46/1379187846.db2.gz	IRMLCWRYRFZPDA-UHFFFAOYSA-N	0	3	339.483	3.419	20	30		EGEDHN
CC(C)C[C@H](C)C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001148496589	1379189120	/nfs/dbraw/zinc/18/91/20/1379189120.db2.gz	OTUBORFDRBMHMU-KRWDZBQOSA-N	0	3	339.483	3.275	20	30		EGEDHN
CC1(CCC(=O)N2CC3(C2)CCN(Cc2ccc(C#N)cc2)C3)CC1	ZINC001148542374	1379206057	/nfs/dbraw/zinc/20/60/57/1379206057.db2.gz	DLHZMZWLALSAGL-UHFFFAOYSA-N	0	3	337.467	3.173	20	30		EGEDHN
N#Cc1cccc(C(F)(F)F)c1NC(=O)c1ccc(NC(=N)N)cc1	ZINC001148650502	1379234088	/nfs/dbraw/zinc/23/40/88/1379234088.db2.gz	OTYRLQPEPMXUFP-UHFFFAOYSA-N	0	3	347.300	3.135	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N1CC2(C1)CCN([C@H](C)c1ccccc1F)C2	ZINC001148899877	1379293711	/nfs/dbraw/zinc/29/37/11/1379293711.db2.gz	IMISQXQAWVYZKE-HZPDHXFCSA-N	0	3	346.446	3.012	20	30		EGEDHN
Cc1ccc(CN(C)C)cc1NC(=O)c1ncc(C#N)cc1Cl	ZINC001149004139	1379309158	/nfs/dbraw/zinc/30/91/58/1379309158.db2.gz	MCUDAPPFOXJQCQ-UHFFFAOYSA-N	0	3	328.803	3.229	20	30		EGEDHN
CCCCCCC[N@@H+]1CCCO[C@H](CNC(=O)c2ccccc2[O-])C1	ZINC001149168147	1379339261	/nfs/dbraw/zinc/33/92/61/1379339261.db2.gz	OCILDFHNGUDYQA-QGZVFWFLSA-N	0	3	348.487	3.183	20	30		EGEDHN
CCCCCCC[N@H+]1CCCO[C@H](CNC(=O)c2ccccc2[O-])C1	ZINC001149168147	1379339264	/nfs/dbraw/zinc/33/92/64/1379339264.db2.gz	OCILDFHNGUDYQA-QGZVFWFLSA-N	0	3	348.487	3.183	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2cccc3ccccc32)c1	ZINC001149712182	1379434727	/nfs/dbraw/zinc/43/47/27/1379434727.db2.gz	SNNUWJLAJGIXRB-UHFFFAOYSA-N	0	3	329.403	3.231	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)C/C=C\c2ccccc2F)C1	ZINC001149881306	1379459372	/nfs/dbraw/zinc/45/93/72/1379459372.db2.gz	KMFHXYDSZMZRBU-MTIYJEKLSA-N	0	3	346.446	3.012	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)C/C=C/c2ccccc2F)C1	ZINC001149881304	1379459862	/nfs/dbraw/zinc/45/98/62/1379459862.db2.gz	KMFHXYDSZMZRBU-KRZKXXONSA-N	0	3	346.446	3.012	20	30		EGEDHN
C[C@H](CC(=O)NCCNCc1ccc(F)c(C#N)c1)c1ccccc1	ZINC001149980652	1379478155	/nfs/dbraw/zinc/47/81/55/1379478155.db2.gz	UYMPJNVEDUXEEP-OAHLLOKOSA-N	0	3	339.414	3.097	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@H]1CN(Cc2cccc(C)c2)CCCO1	ZINC001150077805	1379491558	/nfs/dbraw/zinc/49/15/58/1379491558.db2.gz	CAXWGAVFBAXEPH-IBGZPJMESA-N	0	3	344.499	3.304	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@@H]1CN(CC2=CCCCC2)CCCO1	ZINC001150091422	1379493552	/nfs/dbraw/zinc/49/35/52/1379493552.db2.gz	MJUDSNWVXKKREQ-HXUWFJFHSA-N	0	3	346.515	3.278	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)C(C)(C)C2CCCCC2)C1	ZINC001150425123	1379552175	/nfs/dbraw/zinc/55/21/75/1379552175.db2.gz	GOMVBLRBUCDMDV-GOSISDBHSA-N	0	3	336.520	3.376	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)Cc2ccc3ccccc3c2)s1	ZINC001150486035	1379557551	/nfs/dbraw/zinc/55/75/51/1379557551.db2.gz	VQLCOBUCKXCNCV-UHFFFAOYSA-N	0	3	349.459	3.221	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)CC2CCC(C)(C)CC2)C1	ZINC001150842278	1379621527	/nfs/dbraw/zinc/62/15/27/1379621527.db2.gz	RWMSDBDYYXRFSB-SFHVURJKSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2ccccc2Cl)CC1	ZINC001151403459	1379711481	/nfs/dbraw/zinc/71/14/81/1379711481.db2.gz	VQRUCPTZISADQU-UHFFFAOYSA-N	0	3	336.863	3.127	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2ccc(C)cc2C)CC1	ZINC001151406112	1379712255	/nfs/dbraw/zinc/71/22/55/1379712255.db2.gz	YVAWBVFPLKWKFD-UHFFFAOYSA-N	0	3	330.472	3.090	20	30		EGEDHN
CCCCCCCC[C@H](C)C(=O)NCCNCc1cn(C)nc1C	ZINC001151848505	1379798974	/nfs/dbraw/zinc/79/89/74/1379798974.db2.gz	NNMIDNKYEKSXBY-INIZCTEOSA-N	0	3	336.524	3.321	20	30		EGEDHN
CC1=CC[C@@](C)(C(=O)NCCNCc2ccc(F)c(C#N)c2)CC1	ZINC001151913107	1379814897	/nfs/dbraw/zinc/81/48/97/1379814897.db2.gz	DZMGGDKOUSEZHE-LJQANCHMSA-N	0	3	329.419	3.040	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)C(=O)NCCNCc1cccc(C#N)c1	ZINC001151923289	1379816189	/nfs/dbraw/zinc/81/61/89/1379816189.db2.gz	USXMQKOEVWCKSH-OAQYLSRUSA-N	0	3	347.462	3.199	20	30		EGEDHN
C[C@@H](NCCNC(=O)CC#Cc1ccccc1)c1ccc(F)c(F)c1	ZINC001151959001	1379825920	/nfs/dbraw/zinc/82/59/20/1379825920.db2.gz	WNKZLUNMEIAKEK-OAHLLOKOSA-N	0	3	342.389	3.173	20	30		EGEDHN
CCn1c(C(=O)NCCNCc2ccc(C#N)cc2)cc2ccccc21	ZINC001152169162	1379876676	/nfs/dbraw/zinc/87/66/76/1379876676.db2.gz	JSOGYXAGDSPTGJ-UHFFFAOYSA-N	0	3	346.434	3.052	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)[C@H](C)C1CC1	ZINC001152636039	1379960255	/nfs/dbraw/zinc/96/02/55/1379960255.db2.gz	CBWQJDKFULSNRH-ZIAGYGMSSA-N	0	3	331.435	3.070	20	30		EGEDHN
COc1ccc(CNCCNC(=O)CCCC2CCCC2)cc1C#N	ZINC001152684529	1379970317	/nfs/dbraw/zinc/97/03/17/1379970317.db2.gz	ORZNIUTWQJUKDO-UHFFFAOYSA-N	0	3	343.471	3.133	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)C(F)=C(C)C	ZINC001152723558	1379976098	/nfs/dbraw/zinc/97/60/98/1379976098.db2.gz	IRCXVWMXUCIWON-CYBMUJFWSA-N	0	3	335.398	3.287	20	30		EGEDHN
CCC[C@H](CC(C)C)C(=O)NCCNCc1ccc(C#N)c(F)c1	ZINC001152876203	1379989744	/nfs/dbraw/zinc/98/97/44/1379989744.db2.gz	IRSFMXFJCLJTLS-MRXNPFEDSA-N	0	3	333.451	3.366	20	30		EGEDHN
CCC[C@H](CC(C)C)C(=O)NCCNCc1ccc(OC)c(C#N)c1	ZINC001152876495	1379989837	/nfs/dbraw/zinc/98/98/37/1379989837.db2.gz	KKONSEKHYVNPFQ-QGZVFWFLSA-N	0	3	345.487	3.235	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H](C)N(CC)Cc1ccc(OC)c(C#N)c1	ZINC001153642283	1380109294	/nfs/dbraw/zinc/10/92/94/1380109294.db2.gz	VAVJXEVSPGOAKN-MRXNPFEDSA-N	0	3	343.471	3.250	20	30		EGEDHN
C=CCC[C@H](C(=O)NCCNCc1scnc1C)c1ccccc1	ZINC001153816646	1380135339	/nfs/dbraw/zinc/13/53/39/1380135339.db2.gz	GEZXHCUAFLCFSJ-KRWDZBQOSA-N	0	3	343.496	3.407	20	30		EGEDHN
Cc1ccc(CCCC(=O)NCCNCc2ccc(C#N)s2)s1	ZINC001153883224	1380148846	/nfs/dbraw/zinc/14/88/46/1380148846.db2.gz	ZPYGGQGKFSXLJR-UHFFFAOYSA-N	0	3	347.509	3.218	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H](C)N(CC)C[C@@H](O)c1ccccc1	ZINC001154584463	1380310732	/nfs/dbraw/zinc/31/07/32/1380310732.db2.gz	IDSMKPXTMWMECN-SJLPKXTDSA-N	0	3	332.488	3.149	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@H](CC)Cc1cccc(C)c1	ZINC001155661881	1380479931	/nfs/dbraw/zinc/47/99/31/1380479931.db2.gz	JBRVFGAZLYNJHR-UYAOXDASSA-N	0	3	328.500	3.414	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1ccc(OC)c(C2CC2)c1	ZINC001156111195	1380526578	/nfs/dbraw/zinc/52/65/78/1380526578.db2.gz	ZRRRHUBUZHDGQH-OAHLLOKOSA-N	0	3	328.456	3.036	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1cnn(C(CC)CC)c1C	ZINC001156288357	1380553042	/nfs/dbraw/zinc/55/30/42/1380553042.db2.gz	FJZJZSRVGBOODF-OAHLLOKOSA-N	0	3	332.492	3.016	20	30		EGEDHN
Cc1cnc(N(C)[C@H]2CN(Cc3ccccc3)CC[C@@H]2C)c(C#N)n1	ZINC001156341070	1380561608	/nfs/dbraw/zinc/56/16/08/1380561608.db2.gz	BDHBWYGGAAWTMB-KXBFYZLASA-N	0	3	335.455	3.004	20	30		EGEDHN
CN1CCN(c2cccc(NC(C)(C)c3ccc(C#N)cc3)n2)CC1	ZINC001156430592	1380575143	/nfs/dbraw/zinc/57/51/43/1380575143.db2.gz	GAIBPCRPYBOLJY-UHFFFAOYSA-N	0	3	335.455	3.052	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)C(F)=C2CCCC2)c(F)c1	ZINC001156541030	1380591075	/nfs/dbraw/zinc/59/10/75/1380591075.db2.gz	LSKQTNJDTQCRFC-UHFFFAOYSA-N	0	3	333.382	3.091	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1csc2c1CC[C@@H](C)C2	ZINC001156751368	1380626642	/nfs/dbraw/zinc/62/66/42/1380626642.db2.gz	SVYDBGDHYDNFJA-HUUCEWRRSA-N	0	3	332.513	3.336	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)Cc1coc2cc(C)ccc12	ZINC001156766888	1380629448	/nfs/dbraw/zinc/62/94/48/1380629448.db2.gz	ANARKOXGUHCLMX-MRXNPFEDSA-N	0	3	326.440	3.134	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C[C@H](C)c1ccc(OC)cc1	ZINC001157035590	1380756188	/nfs/dbraw/zinc/75/61/88/1380756188.db2.gz	VZLJFMVHUAFMII-DLBZAZTESA-N	0	3	330.472	3.039	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)C(=O)NC[C@@H](C)N(CC)CC#CC	ZINC001157063118	1380765813	/nfs/dbraw/zinc/76/58/13/1380765813.db2.gz	PWHLHWNBQMEYLS-UYAOXDASSA-N	0	3	326.484	3.271	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@@H](c1ccc(F)cc1)C(C)C	ZINC001157172875	1380795649	/nfs/dbraw/zinc/79/56/49/1380795649.db2.gz	ZPFRMQPOIBZLHT-VQIMIIECSA-N	0	3	332.463	3.415	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C[C@H](C)c1cccc(OC)c1	ZINC001157203546	1380808704	/nfs/dbraw/zinc/80/87/04/1380808704.db2.gz	UJXBKCFJZQVOKK-DLBZAZTESA-N	0	3	330.472	3.039	20	30		EGEDHN
CC(C)C#CC(=O)NCCCNCc1nc(-c2ccccc2)cs1	ZINC001157639126	1380987831	/nfs/dbraw/zinc/98/78/31/1380987831.db2.gz	ZKUDYASTOOWZJQ-UHFFFAOYSA-N	0	3	341.480	3.065	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)[C@H]2CCCC3(CC3)C2)c(F)c1	ZINC001158011380	1381102829	/nfs/dbraw/zinc/10/28/29/1381102829.db2.gz	VLHGMGDZNPLYFG-INIZCTEOSA-N	0	3	343.446	3.264	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)Cc1cc(C)ccc1OC	ZINC001158190618	1381153661	/nfs/dbraw/zinc/15/36/61/1381153661.db2.gz	JXTIVIHPJDOVNT-GOSISDBHSA-N	0	3	330.472	3.045	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H](C)OCc1cccc(C)c1	ZINC001158283629	1381184842	/nfs/dbraw/zinc/18/48/42/1381184842.db2.gz	OVRMCBDSYPOZPC-UYAOXDASSA-N	0	3	344.499	3.399	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc2c(c1)[C@H](C)CO2	ZINC001158363929	1381219168	/nfs/dbraw/zinc/21/91/68/1381219168.db2.gz	NFLVQFGZZQZLOW-NVXWUHKLSA-N	0	3	328.456	3.295	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)[C@@H](F)c1ccccc1	ZINC001158529894	1381283507	/nfs/dbraw/zinc/28/35/07/1381283507.db2.gz	RQDQSJSWENJXLH-MOPGFXCFSA-N	0	3	348.462	3.213	20	30		EGEDHN
N#Cc1cc(Cl)c(Cl)nc1N1CCCc2ccc(CN)nc21	ZINC001158652341	1381336791	/nfs/dbraw/zinc/33/67/91/1381336791.db2.gz	PBWIHHLOYAVKKU-UHFFFAOYSA-N	0	3	334.210	3.198	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1csc(C(F)(F)F)n1	ZINC001158704328	1381360854	/nfs/dbraw/zinc/36/08/54/1381360854.db2.gz	JPUBTAPXWGFDQY-LLVKDONJSA-N	0	3	347.406	3.274	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H](C)Oc1ccc(C)cc1	ZINC001158830041	1381422133	/nfs/dbraw/zinc/42/21/33/1381422133.db2.gz	OJOMUJKUXOGQMV-QZTJIDSGSA-N	0	3	330.472	3.261	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001158856834	1381437703	/nfs/dbraw/zinc/43/77/03/1381437703.db2.gz	GWELDAGVNHZDRM-UHFFFAOYSA-N	0	3	337.826	3.072	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)Cc1cccc(Cl)c1F	ZINC001328413429	1388740554	/nfs/dbraw/zinc/74/05/54/1388740554.db2.gz	FMVQKZWUDWMMBL-NSHDSACASA-N	0	3	333.234	3.259	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCC1=CCN(Cc2ccc(C(F)F)cc2)CC1	ZINC001159587291	1381836802	/nfs/dbraw/zinc/83/68/02/1381836802.db2.gz	MXTBLFBQCVXHPI-AWEZNQCLSA-N	0	3	347.409	3.422	20	30		EGEDHN
C[C@H](c1ccc(F)cc1)N1CC=C(CCNC(=O)C#CC2CC2)CC1	ZINC001160084029	1381992743	/nfs/dbraw/zinc/99/27/43/1381992743.db2.gz	FHSRYROGNWIWTI-MRXNPFEDSA-N	0	3	340.442	3.439	20	30		EGEDHN
CC(C)(C)C#CC(=O)NCCC1=CCN(Cc2ccsc2)CC1	ZINC001160084219	1381992776	/nfs/dbraw/zinc/99/27/76/1381992776.db2.gz	JXKHGTFVTKGZIS-UHFFFAOYSA-N	0	3	330.497	3.436	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cnn(CC(C)C)c2CC)CC1	ZINC001160121511	1382003988	/nfs/dbraw/zinc/00/39/88/1382003988.db2.gz	YGNQEPSPJTYUIP-UHFFFAOYSA-N	0	3	344.503	3.040	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2conc2C2CCCC2)CC1	ZINC001160337101	1382076153	/nfs/dbraw/zinc/07/61/53/1382076153.db2.gz	HFZMPELIKMPQFI-UHFFFAOYSA-N	0	3	329.444	3.270	20	30		EGEDHN
C[C@H](NC[C@@H](O)CC(C)(C)C#N)c1ccc(F)cc1OC(F)F	ZINC001328483002	1388760698	/nfs/dbraw/zinc/76/06/98/1388760698.db2.gz	VRTCJJYEAJGEKT-JQWIXIFHSA-N	0	3	330.350	3.378	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cccc3ccc(C)nc32)CC1	ZINC001160449494	1382106917	/nfs/dbraw/zinc/10/69/17/1382106917.db2.gz	HWQMPTDYNBBMBT-UHFFFAOYSA-N	0	3	347.462	3.319	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc(C)cc(Cl)c2)CC1	ZINC001160699189	1382173322	/nfs/dbraw/zinc/17/33/22/1382173322.db2.gz	DONFRYWLFNIDJU-UHFFFAOYSA-N	0	3	330.859	3.424	20	30		EGEDHN
C=CCN1CCC[C@H]1CNc1nc(Cl)nc2c(Cl)nccc12	ZINC001160953734	1382250254	/nfs/dbraw/zinc/25/02/54/1382250254.db2.gz	ILYHGDXPNREVOY-JTQLQIEISA-N	0	3	338.242	3.394	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCCC1=CCN(CCOCC(C)C)CC1	ZINC001160990510	1382263425	/nfs/dbraw/zinc/26/34/25/1382263425.db2.gz	BUWMDNKULFUGDD-GOSISDBHSA-N	0	3	336.520	3.400	20	30		EGEDHN
CC(C)(C)OC(=O)C(C#N)c1nccnc1N[C@H]1CCC(C)(C)C1	ZINC001161035224	1382279223	/nfs/dbraw/zinc/27/92/23/1382279223.db2.gz	GYCXYWPERVLCEK-STQMWFEESA-N	0	3	330.432	3.416	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cccc(Cl)c2F)CC1	ZINC001161083548	1382293316	/nfs/dbraw/zinc/29/33/16/1382293316.db2.gz	AEWNHSRENYEDGP-UHFFFAOYSA-N	0	3	334.822	3.254	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)Cc2c[nH]c3c2cccc3C)CC1	ZINC001161391856	1382397453	/nfs/dbraw/zinc/39/74/53/1382397453.db2.gz	XFEHHDVUJOZZIW-UHFFFAOYSA-N	0	3	337.467	3.343	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C23CCC(CC2)C3(C)C)CC1	ZINC001161417442	1382403813	/nfs/dbraw/zinc/40/38/13/1382403813.db2.gz	LJIQQANSGYKKSV-UHFFFAOYSA-N	0	3	328.500	3.365	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H]2C[C@]23CCc2ccccc23)CC1	ZINC001161616229	1382460047	/nfs/dbraw/zinc/46/00/47/1382460047.db2.gz	GSPSTBCRQXVBFS-IRLDBZIGSA-N	0	3	336.479	3.215	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@]2(C)CCOc3ccccc32)CC1	ZINC001161722771	1382489137	/nfs/dbraw/zinc/48/91/37/1382489137.db2.gz	FOFDCUKTHPDVLQ-OAQYLSRUSA-N	0	3	340.467	3.051	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc(N(CC)CC)cc2)CC1	ZINC001161766437	1382500407	/nfs/dbraw/zinc/50/04/07/1382500407.db2.gz	TYJCHMPRIPTUHG-UHFFFAOYSA-N	0	3	341.499	3.471	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)Cc2ccc(Cl)cc2)CC1	ZINC001161805742	1382512469	/nfs/dbraw/zinc/51/24/69/1382512469.db2.gz	PFQSRZLLJFIPLX-UHFFFAOYSA-N	0	3	330.859	3.044	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc3c(s2)CCCC3)CC1	ZINC001161818596	1382519534	/nfs/dbraw/zinc/51/95/34/1382519534.db2.gz	ZZMMXNMBCPFQAA-UHFFFAOYSA-N	0	3	342.508	3.402	20	30		EGEDHN
C[C@H](C(=O)N1CCCC[C@H]1CNCC#Cc1ccccc1)C1CCC1	ZINC001328621012	1388791446	/nfs/dbraw/zinc/79/14/46/1388791446.db2.gz	FIOBBKOEHMJHLJ-RXVVDRJESA-N	0	3	338.495	3.445	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C[C@@H](C)c2ccc(F)cc2)CC1	ZINC001161924931	1382554201	/nfs/dbraw/zinc/55/42/01/1382554201.db2.gz	QETOTPWQFGWQFG-QGZVFWFLSA-N	0	3	342.458	3.481	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H](C)Cc2ccc(C)cc2)CC1	ZINC001161963457	1382573871	/nfs/dbraw/zinc/57/38/71/1382573871.db2.gz	GWUULOCIKPRFAW-GOSISDBHSA-N	0	3	326.484	3.498	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@H](C)Cc2ccc(C)cc2)CC1	ZINC001161963827	1382574810	/nfs/dbraw/zinc/57/48/10/1382574810.db2.gz	TZBMWSODMNUGIS-LJQANCHMSA-N	0	3	338.495	3.335	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)CC1	ZINC001161983211	1382586624	/nfs/dbraw/zinc/58/66/24/1382586624.db2.gz	WEYVVURJEHWFAS-VQTJNVASSA-N	0	3	340.442	3.091	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCC1(COC)CCN(C[C@H](F)CC)CC1	ZINC001162428549	1382756302	/nfs/dbraw/zinc/75/63/02/1382756302.db2.gz	JCIRBNXFLGBYNF-IAGOWNOFSA-N	0	3	342.499	3.182	20	30		EGEDHN
COC(=O)CCCCCCNc1ccc(/N=C/N(C)C)c(C#N)c1	ZINC001162432238	1382757394	/nfs/dbraw/zinc/75/73/94/1382757394.db2.gz	ZHEAIORNFKHRFJ-KGENOOAVSA-N	0	3	330.432	3.315	20	30		EGEDHN
C#CCN1CCC(CNC(=O)[C@H](CC)CC2CCCC2)(COC)CC1	ZINC001162513825	1382778168	/nfs/dbraw/zinc/77/81/68/1382778168.db2.gz	VIEDQKYMCQMZPB-LJQANCHMSA-N	0	3	348.531	3.071	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@@H]2CCCC[C@H]2CC)(COC)CC1	ZINC001162558796	1382789587	/nfs/dbraw/zinc/78/95/87/1382789587.db2.gz	RSLKIULWJZBMNQ-RTBURBONSA-N	0	3	348.531	3.071	20	30		EGEDHN
C#CCN1CCC(CNC(=O)C[C@@H]2CCCCC2(C)C)(COC)CC1	ZINC001162633076	1382817398	/nfs/dbraw/zinc/81/73/98/1382817398.db2.gz	KYCDHSHRANHMEI-SFHVURJKSA-N	0	3	348.531	3.071	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)C2CCC3(CC3)CC2)c1	ZINC001162685313	1382833307	/nfs/dbraw/zinc/83/33/07/1382833307.db2.gz	ZYRYWIFRNALCIH-UHFFFAOYSA-N	0	3	343.446	3.264	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)Cc1ccccc1CC	ZINC001162841530	1382892324	/nfs/dbraw/zinc/89/23/24/1382892324.db2.gz	XKUXONMYFHTSOX-UHFFFAOYSA-N	0	3	348.490	3.086	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C[C@@H]1CC[C@@H](C)C1	ZINC001162892112	1382906863	/nfs/dbraw/zinc/90/68/63/1382906863.db2.gz	HYCFFTAFQOMHHW-UYAOXDASSA-N	0	3	326.484	3.107	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)CCCC1CC1	ZINC001162892371	1382907257	/nfs/dbraw/zinc/90/72/57/1382907257.db2.gz	KNGVSCPUFCKVBC-UHFFFAOYSA-N	0	3	326.484	3.251	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1occc1C(C)C	ZINC001162897857	1382909157	/nfs/dbraw/zinc/90/91/57/1382909157.db2.gz	MXFPAVJBDQDLAM-UHFFFAOYSA-N	0	3	338.451	3.311	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CCC[C@@H]1CC	ZINC001162918898	1382916975	/nfs/dbraw/zinc/91/69/75/1382916975.db2.gz	ILQGWWVOLGYQFX-LEWJYISDSA-N	0	3	340.511	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)Cc1cc(C)ccc1C	ZINC001162919315	1382917026	/nfs/dbraw/zinc/91/70/26/1382917026.db2.gz	PUFUUGKHILLTBX-UHFFFAOYSA-N	0	3	348.490	3.140	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H](C)c1cccs1	ZINC001162928348	1382919364	/nfs/dbraw/zinc/91/93/64/1382919364.db2.gz	HGOSCBJVLGVGHF-QGZVFWFLSA-N	0	3	340.492	3.146	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1cccc2[nH]ccc21	ZINC001162946407	1382923151	/nfs/dbraw/zinc/92/31/51/1382923151.db2.gz	HPNGFUDQBSMNJR-UHFFFAOYSA-N	0	3	345.446	3.076	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)CC(CC)CC	ZINC001162963260	1382929260	/nfs/dbraw/zinc/92/92/60/1382929260.db2.gz	HMSDKQCJMZLSQE-UHFFFAOYSA-N	0	3	328.500	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C12CCC(CC1)CC2	ZINC001163001523	1382943703	/nfs/dbraw/zinc/94/37/03/1382943703.db2.gz	IDOMCUMLCGLDQU-UHFFFAOYSA-N	0	3	338.495	3.251	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)CC(C1CC1)C1CC1	ZINC001163001911	1382944404	/nfs/dbraw/zinc/94/44/04/1382944404.db2.gz	QCGKWIXQIJITBI-UHFFFAOYSA-N	0	3	338.495	3.107	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CCCCC1(C)C	ZINC001163007742	1382947157	/nfs/dbraw/zinc/94/71/57/1382947157.db2.gz	YECYVLMPBFRHTC-HXUWFJFHSA-N	0	3	340.511	3.497	20	30		EGEDHN
Cc1ccoc1C(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001163435453	1383051176	/nfs/dbraw/zinc/05/11/76/1383051176.db2.gz	OEIQGMZZFFRCFP-UHFFFAOYSA-N	0	3	337.423	3.150	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)/C=C(\C)C2CC2)CC1	ZINC001163614972	1383089629	/nfs/dbraw/zinc/08/96/29/1383089629.db2.gz	NLCKXJWNWRFBEB-FMIVXFBMSA-N	0	3	341.293	3.127	20	30		EGEDHN
N#Cc1cc2ccc(N[C@H]3CCCC[C@@]34CNCCO4)cc2cc1C#N	ZINC001163649995	1383095664	/nfs/dbraw/zinc/09/56/64/1383095664.db2.gz	IGQCCBDLIOMKSR-LEWJYISDSA-N	0	3	346.434	3.296	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCCNCc1nc2ccc(OC)cc2s1	ZINC001163953266	1383139136	/nfs/dbraw/zinc/13/91/36/1383139136.db2.gz	NHECMPHMFSGAOZ-UHFFFAOYSA-N	0	3	347.484	3.113	20	30		EGEDHN
Cc1cc(CN)nn1-c1c(F)c(F)c(C(F)(F)F)c(F)c1F	ZINC001163985985	1383143191	/nfs/dbraw/zinc/14/31/91/1383143191.db2.gz	MVACZFMOMNAYSW-UHFFFAOYSA-N	0	3	327.203	3.215	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)CCC2CCC2)CC1	ZINC001164002469	1383145172	/nfs/dbraw/zinc/14/51/72/1383145172.db2.gz	CNBWACXIHOLAOU-UHFFFAOYSA-N	0	3	343.309	3.351	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)NCCC1(CNCc2ccc(C#N)cc2F)CC1	ZINC001164124803	1383158622	/nfs/dbraw/zinc/15/86/22/1383158622.db2.gz	DODIFBYAPAJEBL-INIZCTEOSA-N	0	3	343.446	3.120	20	30		EGEDHN
CC(C)C#CC(=O)NCCC1(CNCc2cccc(F)c2F)CC1	ZINC001164464282	1383189286	/nfs/dbraw/zinc/18/92/86/1383189286.db2.gz	QZATYIVEQQIOQD-UHFFFAOYSA-N	0	3	334.410	3.000	20	30		EGEDHN
CC(C)(C)C#CC(=O)NCCC1(CNCc2cccc(F)c2F)CC1	ZINC001164482880	1383191097	/nfs/dbraw/zinc/19/10/97/1383191097.db2.gz	PWLFLAIDAGJNHH-UHFFFAOYSA-N	0	3	348.437	3.390	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C(C)(C)[C@H]2CCCCO2)CC1	ZINC001164561591	1383199237	/nfs/dbraw/zinc/19/92/37/1383199237.db2.gz	RPHUAUKVOXUJMI-OAHLLOKOSA-N	0	3	342.911	3.210	20	30		EGEDHN
Cc1cnc(N2C[C@H](C)N(Cc3ccccc3)C[C@H]2C)c(C=NO)c1	ZINC001165203590	1383248849	/nfs/dbraw/zinc/24/88/49/1383248849.db2.gz	ZEBQGYXYZRWTKZ-DLBZAZTESA-N	0	3	338.455	3.297	20	30		EGEDHN
C[C@@H]1CCC[C@H](C(=O)NCCCNCc2ccc(C#N)cc2F)C1	ZINC001165424091	1383293066	/nfs/dbraw/zinc/29/30/66/1383293066.db2.gz	JCMWDAJKYHVDBU-ZBFHGGJFSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C[C@@H]2CCC[C@H](OC)C2)CC1	ZINC001165440521	1383296933	/nfs/dbraw/zinc/29/69/33/1383296933.db2.gz	ILXBUZVKSQTZLZ-CVEARBPZSA-N	0	3	342.911	3.210	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)C(C)(C)c1ccc(Cl)cc1	ZINC001165666468	1383321219	/nfs/dbraw/zinc/32/12/19/1383321219.db2.gz	GCWVXELWTKQRPB-UHFFFAOYSA-N	0	3	329.271	3.466	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cc(C)n(CC)c2C)CC1	ZINC001166033758	1383379839	/nfs/dbraw/zinc/37/98/39/1383379839.db2.gz	WXYDVSSYWNYKHA-UHFFFAOYSA-N	0	3	337.895	3.367	20	30		EGEDHN
CC(C)[C@H](F)C(=O)NCCC1(CNCc2ccc(C#N)cc2F)CC1	ZINC001166722290	1383467121	/nfs/dbraw/zinc/46/71/21/1383467121.db2.gz	CHDGOXDIBDPDJE-KRWDZBQOSA-N	0	3	349.425	3.068	20	30		EGEDHN
CC1(C)CC[C@@H]1C(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001166747804	1383471071	/nfs/dbraw/zinc/47/10/71/1383471071.db2.gz	SKLSBQZJHHWNLB-GOSISDBHSA-N	0	3	339.483	3.371	20	30		EGEDHN
C=CCCCC(=O)NCCC1(CNCc2ccc(C#N)cc2F)CC1	ZINC001166909877	1383497972	/nfs/dbraw/zinc/49/79/72/1383497972.db2.gz	CZCSFJTWOOXVJD-UHFFFAOYSA-N	0	3	343.446	3.430	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)C2(CCC)CC2)CC1	ZINC001167058176	1383529916	/nfs/dbraw/zinc/52/99/16/1383529916.db2.gz	YMGPJXVOQJXOPV-UHFFFAOYSA-N	0	3	343.309	3.351	20	30		EGEDHN
N#Cc1ccc(OC2CCN(c3cccc(N)n3)CC2)cc1Cl	ZINC001167150542	1383553045	/nfs/dbraw/zinc/55/30/45/1383553045.db2.gz	NLFZAKRDXXBGRM-UHFFFAOYSA-N	0	3	328.803	3.237	20	30		EGEDHN
Cc1cccc([C@H](C)C(=O)NCCCNCc2ccccc2C#N)c1	ZINC001167408199	1383625305	/nfs/dbraw/zinc/62/53/05/1383625305.db2.gz	COGSPMVNVYAWAX-KRWDZBQOSA-N	0	3	335.451	3.266	20	30		EGEDHN
CN(C)Cc1ccc(Br)c(NC(=N)c2nccs2)c1	ZINC001168284488	1383862940	/nfs/dbraw/zinc/86/29/40/1383862940.db2.gz	WYKCWHVOKPTNIE-UHFFFAOYSA-N	0	3	339.262	3.004	20	30		EGEDHN
Cc1cccc(C2(Nc3ccc(/N=C/N(C)C)c(C#N)c3)COC2)c1	ZINC001168474412	1383916999	/nfs/dbraw/zinc/91/69/99/1383916999.db2.gz	OUCNZOYPRMHJBR-HYARGMPZSA-N	0	3	334.423	3.426	20	30		EGEDHN
C[C@H]1C[C@@H](N(C)Cc2ccc(C#N)cc2)CN1C(=O)OC(C)(C)C	ZINC001168865455	1384039294	/nfs/dbraw/zinc/03/92/94/1384039294.db2.gz	MPAZRSVFBKCHGH-WMLDXEAASA-N	0	3	329.444	3.388	20	30		EGEDHN
N#Cc1cnc(CNC2CCC(OC(=O)c3ccccc3)CC2)s1	ZINC001169283230	1384132002	/nfs/dbraw/zinc/13/20/02/1384132002.db2.gz	IWZHKUPLHJWQSS-UHFFFAOYSA-N	0	3	341.436	3.273	20	30		EGEDHN
CC[C@]1(C(C)C)C[C@H]1C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001169730046	1384179762	/nfs/dbraw/zinc/17/97/62/1384179762.db2.gz	QXYUBYMTXROBFI-FXAWDEMLSA-N	0	3	345.462	3.366	20	30		EGEDHN
N#Cc1ccc(CNc2cccc3cc([C@H]4CNCCO4)cn32)s1	ZINC001170201458	1384262896	/nfs/dbraw/zinc/26/28/96/1384262896.db2.gz	FTLLATBKPUSWMR-QGZVFWFLSA-N	0	3	338.436	3.145	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H](C)CCCCNCc1csc(C)n1	ZINC001170283740	1384282365	/nfs/dbraw/zinc/28/23/65/1384282365.db2.gz	YDHZFWBZKZIHLB-HNNXBMFYSA-N	0	3	335.517	3.410	20	30		EGEDHN
C#CCCCCC(=O)N[C@H](C)CCCCNCc1nc(C)cs1	ZINC001170283771	1384282441	/nfs/dbraw/zinc/28/24/41/1384282441.db2.gz	YIDBXRKRPMPVCQ-OAHLLOKOSA-N	0	3	335.517	3.410	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)c1cnc(CC(C)(C)C)s1	ZINC001170385649	1384304768	/nfs/dbraw/zinc/30/47/68/1384304768.db2.gz	XBHFIQJTSBSVCI-UHFFFAOYSA-N	0	3	329.897	3.194	20	30		EGEDHN
C[C@H](Nc1c(F)c(F)c(C(F)(F)F)c(F)c1F)[C@H]1CNCCO1	ZINC001170568268	1384343970	/nfs/dbraw/zinc/34/39/70/1384343970.db2.gz	FXSIEUXQHAKLKT-NTSWFWBYSA-N	0	3	346.246	3.051	20	30		EGEDHN
C[C@H](N)c1ncc(-c2ccccc2)n1-c1nc2ncccc2cc1C#N	ZINC001170680900	1384363803	/nfs/dbraw/zinc/36/38/03/1384363803.db2.gz	GYNSUOSEVOLKNJ-ZDUSSCGKSA-N	0	3	340.390	3.374	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H](C)CCCCNCc1cc(OC)no1	ZINC001170997208	1384426882	/nfs/dbraw/zinc/42/68/82/1384426882.db2.gz	DQZRODFPHXTQMC-CQSZACIVSA-N	0	3	337.464	3.050	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H](C)CCCCNCc1cc(C)n(C)n1	ZINC001171007025	1384428323	/nfs/dbraw/zinc/42/83/23/1384428323.db2.gz	CYJAVFXIJJBMBU-OAHLLOKOSA-N	0	3	334.508	3.095	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H](C)CCCCNCc1cn(C(C)(C)C)nn1	ZINC001171043908	1384435652	/nfs/dbraw/zinc/43/56/52/1384435652.db2.gz	RDDAIFXHCZVHCX-MRXNPFEDSA-N	0	3	349.523	3.154	20	30		EGEDHN
Cc1ccc([C@H](C)C(=O)NCCCNCc2ccccc2C#N)s1	ZINC001171124549	1384450133	/nfs/dbraw/zinc/45/01/33/1384450133.db2.gz	FMSOOKAFNYTPGU-HNNXBMFYSA-N	0	3	341.480	3.328	20	30		EGEDHN
Cc1cncnc1O[C@@H]1CCCN([C@@H](C)Cc2cccc(C#N)c2)C1	ZINC001171232494	1384475482	/nfs/dbraw/zinc/47/54/82/1384475482.db2.gz	SUZRSCJZAOAMSF-QFBILLFUSA-N	0	3	336.439	3.131	20	30		EGEDHN
COC(=O)c1ccc(C2CN([C@H](C)Cc3cccc(C#N)c3)C2)cc1	ZINC001171232045	1384475528	/nfs/dbraw/zinc/47/55/28/1384475528.db2.gz	PDBUNOZSHBTKEH-OAHLLOKOSA-N	0	3	334.419	3.375	20	30		EGEDHN
Cc1cc(F)ccc1C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001171688586	1384602235	/nfs/dbraw/zinc/60/22/35/1384602235.db2.gz	DZXSINFIABLACH-UHFFFAOYSA-N	0	3	343.377	3.055	20	30		EGEDHN
C[C@@H]1C[C@@H](NC2(C#N)Cc3ccccc3C2)CN1Cc1ccccc1	ZINC001171742868	1384622935	/nfs/dbraw/zinc/62/29/35/1384622935.db2.gz	ZGPJWYSHJZQCCL-DYESRHJHSA-N	0	3	331.463	3.300	20	30		EGEDHN
CC(C)C[C@H]([NH2+][C@@H](C)Cc1ccc(C(F)(F)F)cc1)C(=O)N[O-]	ZINC001171970409	1384698510	/nfs/dbraw/zinc/69/85/10/1384698510.db2.gz	NYXZDEXWDMQJRR-FZMZJTMJSA-N	0	3	332.366	3.146	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)N1CCN(c2ccccc2C#N)CC1	ZINC001172309103	1384765104	/nfs/dbraw/zinc/76/51/04/1384765104.db2.gz	QTGCKSALACXPBE-QGZVFWFLSA-N	0	3	330.435	3.183	20	30		EGEDHN
C[C@H](CCCC#N)N1CCO[C@@H]2[C@H](COCc3nccs3)CC[C@@H]21	ZINC001172500238	1384806988	/nfs/dbraw/zinc/80/69/88/1384806988.db2.gz	YCEBHIDJVNEZSZ-MUQADHOPSA-N	0	3	349.500	3.221	20	30		EGEDHN
C[C@@H](C#N)C(=O)N[C@H]1C[C@H](N[C@@H](C)c2cc(Cl)ccc2Cl)C1	ZINC001317073724	1384841447	/nfs/dbraw/zinc/84/14/47/1384841447.db2.gz	UVCNNNRZTNIVLN-UKJIMTQDSA-N	0	3	340.254	3.451	20	30		EGEDHN
CC[C@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C#N)C1)c1cccnc1	ZINC001172973691	1384893494	/nfs/dbraw/zinc/89/34/94/1384893494.db2.gz	GVBXYIZNGPMTTI-IKGGRYGDSA-N	0	3	344.459	3.414	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H](N2CCC[C@@H](C(F)F)C2)C[C@H]1C#N	ZINC001172983846	1384895650	/nfs/dbraw/zinc/89/56/50/1384895650.db2.gz	HOOOVVXQNHYJOL-RDBSUJKOSA-N	0	3	343.418	3.255	20	30		EGEDHN
C[C@H]1CC[C@H](NCC#Cc2ccccc2)CN1C(=O)OC(C)(C)C	ZINC001173061929	1384905008	/nfs/dbraw/zinc/90/50/08/1384905008.db2.gz	GWPXPKUZCHSACI-WMZOPIPTSA-N	0	3	328.456	3.416	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1coc(-c2ccccc2)n1	ZINC001317413415	1385124182	/nfs/dbraw/zinc/12/41/82/1385124182.db2.gz	XSYAWVUYKHLALZ-CYBMUJFWSA-N	0	3	333.819	3.192	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](C)CCCCNCc1cn(C(C)C)nn1	ZINC001174649792	1385130027	/nfs/dbraw/zinc/13/00/27/1385130027.db2.gz	JUEFEELVUACOFM-INIZCTEOSA-N	0	3	349.523	3.226	20	30		EGEDHN
CCN(CCNC(=O)[C@@H](C)C(C)(C)C)Cc1ccc(OCC#N)cc1	ZINC001317482213	1385179195	/nfs/dbraw/zinc/17/91/95/1385179195.db2.gz	PMYSEGTTZBHOLZ-MRXNPFEDSA-N	0	3	345.487	3.209	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)CC(C)(F)F	ZINC001175115049	1385197605	/nfs/dbraw/zinc/19/76/05/1385197605.db2.gz	KHUULXWTQSSQNB-AWEZNQCLSA-N	0	3	337.414	3.368	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H](C)CCCCNCc2nnc(C(C)C)[nH]2)C1	ZINC001175149814	1385204495	/nfs/dbraw/zinc/20/44/95/1385204495.db2.gz	IBOXFRIDUZWJHL-HNNXBMFYSA-N	0	3	347.507	3.049	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H](C)CCCCNCc2nccn2CC)C1	ZINC001175151300	1385206002	/nfs/dbraw/zinc/20/60/02/1385206002.db2.gz	XUAUQOCELUVRDU-INIZCTEOSA-N	0	3	332.492	3.024	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)C1(CF)CC1	ZINC001175191745	1385216248	/nfs/dbraw/zinc/21/62/48/1385216248.db2.gz	XYWNKPUVFPXHBA-HNNXBMFYSA-N	0	3	331.435	3.073	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)C(C)(C)CC(C)(C)C	ZINC001176758891	1385685533	/nfs/dbraw/zinc/68/55/33/1385685533.db2.gz	RYLADKDDBOGAGI-UHFFFAOYSA-N	0	3	333.314	3.453	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@H](C)c1ccccc1C	ZINC001176790400	1385699778	/nfs/dbraw/zinc/69/97/78/1385699778.db2.gz	LWKZTKJXJNMLNY-CQSZACIVSA-N	0	3	339.277	3.103	20	30		EGEDHN
C=CCCOCC(=O)NCCCNCc1cccc(Cl)c1Cl	ZINC001177269900	1385890253	/nfs/dbraw/zinc/89/02/53/1385890253.db2.gz	YFYHUYPXFFNVEB-UHFFFAOYSA-N	0	3	345.270	3.182	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)C1CC(c2ccccc2)C1	ZINC001177366103	1385930950	/nfs/dbraw/zinc/93/09/50/1385930950.db2.gz	UCJBEKMRRGGFDR-UHFFFAOYSA-N	0	3	347.462	3.348	20	30		EGEDHN
C[C@H](C(=O)NCC1(NCc2cc(C#N)ccc2F)CCCC1)C1CC1	ZINC001319342791	1386069715	/nfs/dbraw/zinc/06/97/15/1386069715.db2.gz	QOVDRMNPTMFNCO-AWEZNQCLSA-N	0	3	343.446	3.262	20	30		EGEDHN
N#Cc1ccccc1CNCCCCCCNC(=O)Cc1ccoc1	ZINC001178294592	1386181556	/nfs/dbraw/zinc/18/15/56/1386181556.db2.gz	PHJSCTWTGJRUGS-UHFFFAOYSA-N	0	3	339.439	3.160	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccc(F)cc2)CCN1C(=O)/C=C\C(C)(C)C	ZINC001178378654	1386202666	/nfs/dbraw/zinc/20/26/66/1386202666.db2.gz	FTDJWFFKONDETL-CZEUXFATSA-N	0	3	342.458	3.359	20	30		EGEDHN
Cc1sccc1C(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C	ZINC001178641086	1386266521	/nfs/dbraw/zinc/26/65/21/1386266521.db2.gz	DWQIKIDXZLYQTC-KXBFYZLASA-N	0	3	338.476	3.301	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cc(Br)co1)C(C)C	ZINC001319948642	1386412085	/nfs/dbraw/zinc/41/20/85/1386412085.db2.gz	ZDJBWUBJBVPLTE-NSHDSACASA-N	0	3	349.656	3.139	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1ccc2cnccc2c1)C(C)C	ZINC001319956333	1386416555	/nfs/dbraw/zinc/41/65/55/1386416555.db2.gz	JDBKCJTWDQVJHE-KRWDZBQOSA-N	0	3	331.847	3.331	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCCCCCNCc2cc(C)no2)cc1	ZINC001179198493	1386423312	/nfs/dbraw/zinc/42/33/12/1386423312.db2.gz	NSWRDPZOFZBLEP-UHFFFAOYSA-N	0	3	339.439	3.044	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCCCCCCN[C@@H](C)c1nnc(C)[nH]1	ZINC001179335218	1386454017	/nfs/dbraw/zinc/45/40/17/1386454017.db2.gz	HNZBFTGDXRUVPP-CABCVRRESA-N	0	3	335.496	3.043	20	30		EGEDHN
CC(C)=C(C)CC(=O)N1CC[C@H](NCc2ccc(C#N)s2)[C@@H]1C	ZINC001179341975	1386457011	/nfs/dbraw/zinc/45/70/11/1386457011.db2.gz	QHBDWPHVDQMCIR-YOEHRIQHSA-N	0	3	331.485	3.445	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H](NCc2cnn(C(C)(C)C)c2)[C@@H]1C	ZINC001179384400	1386469310	/nfs/dbraw/zinc/46/93/10/1386469310.db2.gz	LIALIELQNLTRHB-RYRKJORJSA-N	0	3	346.519	3.319	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@H](NCc2cn(C(C)C)nc2C)[C@@H]1C	ZINC001179388940	1386472376	/nfs/dbraw/zinc/47/23/76/1386472376.db2.gz	UCXHFLOZIWCBLU-SCTDSRPQSA-N	0	3	346.519	3.454	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCCCCCNCc1cc(OC)no1	ZINC001179692084	1386555288	/nfs/dbraw/zinc/55/52/88/1386555288.db2.gz	ASTRCFKHMABMPN-UHFFFAOYSA-N	0	3	337.464	3.052	20	30		EGEDHN
COc1ccccc1[C@H](CNc1cccc(CC#N)n1)N1CCCC1	ZINC001320359773	1386586521	/nfs/dbraw/zinc/58/65/21/1386586521.db2.gz	YWRQAUYFRWYIHT-SFHVURJKSA-N	0	3	336.439	3.405	20	30		EGEDHN
C[C@@H](C#N)C(=O)N(Cc1ccccc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC001179895350	1386621201	/nfs/dbraw/zinc/62/12/01/1386621201.db2.gz	MPZXPABPBUUBAQ-GHTZIAJQSA-N	0	3	347.462	3.449	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C)c1ccccc1	ZINC001179990548	1386660936	/nfs/dbraw/zinc/66/09/36/1386660936.db2.gz	XGWUJUXGIMFIOZ-DXIQSLLYSA-N	0	3	346.474	3.421	20	30		EGEDHN
Cc1oc(C)c(C(=O)N[C@@H](C)CN(C)Cc2cccc(C#N)c2)c1C	ZINC001322197540	1387099324	/nfs/dbraw/zinc/09/93/24/1387099324.db2.gz	VRSJBHFEQIGAEU-ZDUSSCGKSA-N	0	3	339.439	3.327	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](C)CN(C)Cc2ccc(C#N)cc2)ccc1F	ZINC001322230770	1387111884	/nfs/dbraw/zinc/11/18/84/1387111884.db2.gz	NPQAVDNKHPOSEO-OAHLLOKOSA-N	0	3	339.414	3.256	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2cc(C)no2)C1	ZINC001182304970	1387142863	/nfs/dbraw/zinc/14/28/63/1387142863.db2.gz	BVSYBAGMBWPYNA-QMTMVMCOSA-N	0	3	333.476	3.160	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@@H](N[C@H](C)c2ccc(F)c(Cl)c2)C1	ZINC001182414173	1387163405	/nfs/dbraw/zinc/16/34/05/1387163405.db2.gz	FDLIEHDTDCUXTQ-UKRRQHHQSA-N	0	3	336.838	3.390	20	30		EGEDHN
CCCC(=O)NCc1ccc(CNCc2ccc(C#N)s2)cc1	ZINC001698718791	1406363221	/nfs/dbraw/zinc/36/32/21/1406363221.db2.gz	XTKXBJFJMYMRTR-UHFFFAOYSA-N	0	3	327.453	3.326	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)NCc1ccc(OC)cc1C(F)(F)F	ZINC001340665489	1390340040	/nfs/dbraw/zinc/34/00/40/1390340040.db2.gz	MXRLHVKWFCUYJY-CQSZACIVSA-N	0	3	330.350	3.014	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N[C@@H](C)c1ccc(OCC(F)(F)F)cc1	ZINC001341497909	1390494703	/nfs/dbraw/zinc/49/47/03/1390494703.db2.gz	ZODIZVFNYCMSMW-SWLSCSKDSA-N	0	3	344.377	3.489	20	30		EGEDHN
C[C@H]1CN(Cc2ccccn2)CC[C@H]1Nc1ccc(OCC#N)cc1	ZINC001341853813	1390537835	/nfs/dbraw/zinc/53/78/35/1390537835.db2.gz	ABBCBVBRSLHIJA-OXJNMPFZSA-N	0	3	336.439	3.306	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1cnn(-c2cccc(C)c2)c1CC	ZINC001341929035	1390551055	/nfs/dbraw/zinc/55/10/55/1390551055.db2.gz	OYZYRKFRJRYTBC-MRXNPFEDSA-N	0	3	326.444	3.365	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1cnn(-c2cccc(C)c2)c1CC	ZINC001341929034	1390551187	/nfs/dbraw/zinc/55/11/87/1390551187.db2.gz	OYZYRKFRJRYTBC-INIZCTEOSA-N	0	3	326.444	3.365	20	30		EGEDHN
C=C[C@H](CC)CC(=O)C(C#N)C(=O)Nc1ccc(C(=O)OCC)cc1	ZINC001341954935	1390554001	/nfs/dbraw/zinc/55/40/01/1390554001.db2.gz	IHNKWZWGNPUKQX-CJNGLKHVSA-N	0	3	342.395	3.113	20	30		EGEDHN
Cc1ccc(C#N)cc1C(=O)N(CCc1ccccc1)CCN(C)C	ZINC001334687150	1390565703	/nfs/dbraw/zinc/56/57/03/1390565703.db2.gz	VZQFZOYZXOWJDK-UHFFFAOYSA-N	0	3	335.451	3.113	20	30		EGEDHN
Cn1ccnc1C(C#N)C(=O)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC001342163324	1390580090	/nfs/dbraw/zinc/58/00/90/1390580090.db2.gz	CCYZONWEOJCZQK-HWIRSSMVSA-N	0	3	325.334	3.211	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)N1CCC[C@H](Cc2nccn2C)C1	ZINC001343556753	1390722382	/nfs/dbraw/zinc/72/23/82/1390722382.db2.gz	FYEXRVKTOPQNDH-MSOLQXFVSA-N	0	3	348.535	3.279	20	30		EGEDHN
C=C(C)Cn1c([C@@H](C)SC)nnc1N1CCN([C@@H](C)CC)CC1	ZINC001343669626	1390729819	/nfs/dbraw/zinc/72/98/19/1390729819.db2.gz	OXQZLQOJRDRCAR-LSDHHAIUSA-N	0	3	337.537	3.199	20	30		EGEDHN
Cn1ncc(C(=O)C(C#N)c2nccn2Cc2ccccc2)c1C1CC1	ZINC001343841585	1390739257	/nfs/dbraw/zinc/73/92/57/1390739257.db2.gz	FYKRSBVKKJSCJZ-MRXNPFEDSA-N	0	3	345.406	3.032	20	30		EGEDHN
N#CC(C(=O)C=Cc1nccs1)C(=O)Nc1ccccc1Cl	ZINC001347091962	1390999830	/nfs/dbraw/zinc/99/98/30/1390999830.db2.gz	LASDIHHRGADIHZ-PORFMDCZSA-N	0	3	331.784	3.157	20	30		EGEDHN
N#CC(C(=O)c1n[nH]c2c1CCCC2)c1nc2c(cccc2Cl)[nH]1	ZINC001349759816	1391362979	/nfs/dbraw/zinc/36/29/79/1391362979.db2.gz	CQQWDYHVOKQIME-JTQLQIEISA-N	0	3	339.786	3.308	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N1CCO[C@@H](c2c(F)cccc2Cl)C1	ZINC001354145794	1392122912	/nfs/dbraw/zinc/12/29/12/1392122912.db2.gz	QTZQTWIYMLXQQI-LSDHHAIUSA-N	0	3	340.826	3.063	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)NCc1cc(C(F)(F)F)cc(Cl)n1	ZINC001354569550	1392153225	/nfs/dbraw/zinc/15/32/25/1392153225.db2.gz	DMJBVTQRQIJYAZ-LLVKDONJSA-N	0	3	335.757	3.054	20	30		EGEDHN
CCN(CCNC(=O)c1cc(F)cc(F)c1)Cc1ccc(C#N)cc1	ZINC001481015877	1393092432	/nfs/dbraw/zinc/09/24/32/1393092432.db2.gz	RIKCWJGXHFJMJM-UHFFFAOYSA-N	0	3	343.377	3.088	20	30		EGEDHN
C[C@@H](C#N)C(=O)N(C)C1CCN(C/C=C\c2ccc(Cl)cc2)CC1	ZINC001490401488	1394215434	/nfs/dbraw/zinc/21/54/34/1394215434.db2.gz	AQWBTVRSQTYFOI-JZIMQPMSSA-N	0	3	345.874	3.436	20	30		EGEDHN
Cc1cc(C(C)(C)C)cc(C)c1CN1CC(CNC(=O)[C@@H](C)C#N)C1	ZINC001481617942	1394421863	/nfs/dbraw/zinc/42/18/63/1394421863.db2.gz	UTKFKSWLVNPJAB-INIZCTEOSA-N	0	3	341.499	3.309	20	30		EGEDHN
CC1(C(=O)NC[C@H]2CCCN(Cc3cccc(C#N)c3)C2)CCC1	ZINC001491117281	1394436259	/nfs/dbraw/zinc/43/62/59/1394436259.db2.gz	QYAXJCVGHLCYQJ-GOSISDBHSA-N	0	3	325.456	3.077	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CCCC2CCOCC2)CCCC1	ZINC001482220813	1394814199	/nfs/dbraw/zinc/81/41/99/1394814199.db2.gz	LDNXSRYUZNPALW-UHFFFAOYSA-N	0	3	342.911	3.354	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2sc(C)cc2OC)CCCC1	ZINC001482231857	1394826458	/nfs/dbraw/zinc/82/64/58/1394826458.db2.gz	YTYBBYBESDTYBW-UHFFFAOYSA-N	0	3	342.892	3.450	20	30		EGEDHN
Cc1sccc1C(=O)N(C)[C@@H](C)CNCc1ccc(C#N)s1	ZINC001482280586	1394863782	/nfs/dbraw/zinc/86/37/82/1394863782.db2.gz	HTGIXBUZGNKLFP-NSHDSACASA-N	0	3	333.482	3.240	20	30		EGEDHN
CC(C)CCC(=O)N1CCC[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001483920166	1395145510	/nfs/dbraw/zinc/14/55/10/1395145510.db2.gz	NZSXYVSRQVRSNY-QGZVFWFLSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=C(Br)CN1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)CCC)C2	ZINC001484386893	1395352629	/nfs/dbraw/zinc/35/26/29/1395352629.db2.gz	IMWHOZSUZYRUGV-BTTYYORXSA-N	0	3	329.282	3.054	20	30		EGEDHN
CC1(C(=O)NC[C@H]2C[C@H]3CC[C@@H](C2)N3Cc2ccccc2C#N)CC1	ZINC001484389055	1395355946	/nfs/dbraw/zinc/35/59/46/1395355946.db2.gz	VEXOPVYSUITBFM-IDHPPYADSA-N	0	3	337.467	3.218	20	30		EGEDHN
Cc1ccc(F)cc1C(=O)NC[C@@H](C)N(C)Cc1cccc(C#N)c1	ZINC001485334212	1395806771	/nfs/dbraw/zinc/80/67/71/1395806771.db2.gz	NGZLQXGPTIHDTC-OAHLLOKOSA-N	0	3	339.414	3.256	20	30		EGEDHN
Cc1cc(C)cc(C(=O)N[C@H](C)CN(C)Cc2cccc(C#N)c2)c1	ZINC001498443163	1396996322	/nfs/dbraw/zinc/99/63/22/1396996322.db2.gz	JMAZQJVFEHWLNC-QGZVFWFLSA-N	0	3	335.451	3.425	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1cnc(CC)s1	ZINC001689911262	1404204090	/nfs/dbraw/zinc/20/40/90/1404204090.db2.gz	DEFDHIYETWWSOB-QWHCGFSZSA-N	0	3	341.908	3.431	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)Cn1c(C)cc2ccccc21	ZINC001690851992	1404777698	/nfs/dbraw/zinc/77/76/98/1404777698.db2.gz	OUAIGPBMJROYCG-CQSZACIVSA-N	0	3	333.863	3.187	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)CCCc2ccsc2)C1	ZINC001691447350	1405275090	/nfs/dbraw/zinc/27/50/90/1405275090.db2.gz	ZGZALDUAGRPVMR-GASCZTMLSA-N	0	3	326.893	3.308	20	30		EGEDHN
CCC1(C(=O)NC[C@H]2C[C@@H](NCc3ccc(C#N)cc3F)C2)CCC1	ZINC001691458513	1405281351	/nfs/dbraw/zinc/28/13/51/1405281351.db2.gz	WRWSQNCDMOXZMY-WOVMCDHWSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)C[C@H]2CCc3ccccc3C2)C1	ZINC001691825792	1405542577	/nfs/dbraw/zinc/54/25/77/1405542577.db2.gz	XZMHVOIIWQAFQD-BXWFABGCSA-N	0	3	346.902	3.419	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2CCN(CCc3ccccc3)C2)CCCCC1	ZINC001698554492	1406152219	/nfs/dbraw/zinc/15/22/19/1406152219.db2.gz	RRFOHAHHPDVLJE-HXUWFJFHSA-N	0	3	338.495	3.393	20	30		EGEDHN
C[C@@H](CNCc1ccccc1C#N)CNC(=O)CCc1ccccc1	ZINC001732369040	1428551623	/nfs/dbraw/zinc/55/16/23/1428551623.db2.gz	GNGUFPDXAFTBMZ-KRWDZBQOSA-N	0	3	335.451	3.033	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCC1(NCc2ccc(Cl)cc2F)CCCC1	ZINC001732389190	1428559152	/nfs/dbraw/zinc/55/91/52/1428559152.db2.gz	REYCFOHJANFYNK-LBPRGKRZSA-N	0	3	337.826	3.157	20	30		EGEDHN
CC(C)[C@H](F)C(=O)NCC1(NCc2ccc(C#N)cc2F)CCCC1	ZINC001732396417	1428563906	/nfs/dbraw/zinc/56/39/06/1428563906.db2.gz	PGTKVCJFMGMSSN-KRWDZBQOSA-N	0	3	349.425	3.210	20	30		EGEDHN
C=C(Br)CN[C@@H](CNC(=O)c1ccccc1F)C(C)C	ZINC001732551111	1428734340	/nfs/dbraw/zinc/73/43/40/1428734340.db2.gz	AGQYUUVFRNFMRC-AWEZNQCLSA-N	0	3	343.240	3.078	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)CC2(C)CC2)CCN1Cc1ccc(C#N)cc1	ZINC001700315033	1413773029	/nfs/dbraw/zinc/77/30/29/1413773029.db2.gz	BRZIZDWLPJLEKL-YJBOKZPZSA-N	0	3	325.456	3.218	20	30		EGEDHN
Cc1coc(C)c1C(=O)NCC[C@H](C)NCc1cc(C#N)ccc1F	ZINC001700323142	1413790347	/nfs/dbraw/zinc/79/03/47/1413790347.db2.gz	RHNMJKOSSMAVDW-ZDUSSCGKSA-N	0	3	343.402	3.205	20	30		EGEDHN
C[C@H](c1ccc(C(F)(F)F)cc1)N(C)CCN(C)C(=O)[C@@H](C)C#N	ZINC001732575976	1428776226	/nfs/dbraw/zinc/77/62/26/1428776226.db2.gz	LCVNGMNYWLHEGT-QWHCGFSZSA-N	0	3	341.377	3.316	20	30		EGEDHN
CN(C(=O)CC1(C)CC1)[C@@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001700728293	1414389591	/nfs/dbraw/zinc/38/95/91/1414389591.db2.gz	VTWYXSBNVPIPKZ-SFHVURJKSA-N	0	3	343.446	3.214	20	30		EGEDHN
CC(F)(F)CCC(=O)N[C@@H]1CCC[C@H]1CNCc1ccccc1C#N	ZINC001732617247	1428880058	/nfs/dbraw/zinc/88/00/58/1428880058.db2.gz	CXRIWVNIKFYNDG-DLBZAZTESA-N	0	3	349.425	3.368	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)COC1CCCC1	ZINC001707432921	1417337498	/nfs/dbraw/zinc/33/74/98/1417337498.db2.gz	HBLCNANRBDNALK-GDBMZVCRSA-N	0	3	328.884	3.057	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1c[nH]c2ncccc12	ZINC001707434451	1417338950	/nfs/dbraw/zinc/33/89/50/1417338950.db2.gz	KOCADIIDOYNZLQ-CJNGLKHVSA-N	0	3	346.862	3.288	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1cn(C(C)C)cn1	ZINC001707444706	1417348722	/nfs/dbraw/zinc/34/87/22/1417348722.db2.gz	ROCDMDNYRHJYLU-ZBFHGGJFSA-N	0	3	338.883	3.189	20	30		EGEDHN
C=CCCC(=O)NCC[C@H](C)NCc1cscc1Br	ZINC001713403273	1418026778	/nfs/dbraw/zinc/02/67/78/1418026778.db2.gz	FNPBRDCUDTXPGG-NSHDSACASA-N	0	3	345.306	3.461	20	30		EGEDHN
CCN(CCNC(=O)c1ccnc(C2CC2)c1)Cc1ccc(C#N)cc1	ZINC001713488002	1418184410	/nfs/dbraw/zinc/18/44/10/1418184410.db2.gz	KZAMGHHFWXWNLQ-UHFFFAOYSA-N	0	3	348.450	3.083	20	30		EGEDHN
CCCN(CCNC(=O)[C@]12C[C@H]1CCC2)Cc1cccc(C#N)c1	ZINC001713548284	1418322521	/nfs/dbraw/zinc/32/25/21/1418322521.db2.gz	BITAGQXFDQRRIA-UYAOXDASSA-N	0	3	325.456	3.077	20	30		EGEDHN
Cc1ccoc1C(=O)NCC[C@H]1CCN(Cc2ccc(C#N)s2)C1	ZINC001713724600	1418502919	/nfs/dbraw/zinc/50/29/19/1418502919.db2.gz	SEWMDZUCBQFHAZ-AWEZNQCLSA-N	0	3	343.452	3.163	20	30		EGEDHN
N#Cc1ccc(CN[C@@H](CNC(=O)C2CC3(CCC3)C2)C2CC2)s1	ZINC001713874432	1418670771	/nfs/dbraw/zinc/67/07/71/1418670771.db2.gz	JSCWBQUOGCZKFF-KRWDZBQOSA-N	0	3	343.496	3.184	20	30		EGEDHN
CCCC(C)(C)C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001713958495	1418739868	/nfs/dbraw/zinc/73/98/68/1418739868.db2.gz	FNJSMPOTQAEBHM-WKILWMFISA-N	0	3	331.435	3.260	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)[C@@H]2CCOc3ccccc32)CCCC1	ZINC001714145640	1418949530	/nfs/dbraw/zinc/94/95/30/1418949530.db2.gz	ZYLVTFSKCUUWLO-MRXNPFEDSA-N	0	3	348.874	3.324	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2cncc(C)c2)CCCC[C@@H]1C	ZINC001714180551	1418988966	/nfs/dbraw/zinc/98/89/66/1418988966.db2.gz	QCPCWCRHLFOOTR-KSSFIOAISA-N	0	3	335.879	3.411	20	30		EGEDHN
C[C@@H](C#N)C(=O)N[C@H]1CC[C@H](NCc2c(F)cccc2Cl)CC1	ZINC001714297553	1419076615	/nfs/dbraw/zinc/07/66/15/1419076615.db2.gz	ZTBCARAYYYUWOY-AVGNSLFASA-N	0	3	337.826	3.156	20	30		EGEDHN
C[C@H](CCNC(=O)C1(F)CCCCC1)NCc1ccccc1C#N	ZINC001714494526	1419218513	/nfs/dbraw/zinc/21/85/13/1419218513.db2.gz	FTFGRKLYWIKLDP-OAHLLOKOSA-N	0	3	331.435	3.215	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CC[C@H]2CCCCO2)CCCC1	ZINC001714507472	1419234983	/nfs/dbraw/zinc/23/49/83/1419234983.db2.gz	CACRAIXFMQLXTO-OAHLLOKOSA-N	0	3	328.884	3.107	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)N(C)C(=O)c1ccc(Cl)o1	ZINC001714549867	1419276160	/nfs/dbraw/zinc/27/61/60/1419276160.db2.gz	RGIDRKOBYNRIEN-SNVBAGLBSA-N	0	3	337.832	3.116	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2cc(COC)cs2)CCCC1	ZINC001715097699	1419838341	/nfs/dbraw/zinc/83/83/41/1419838341.db2.gz	PKQCPNLVPHBTSI-UHFFFAOYSA-N	0	3	342.892	3.279	20	30		EGEDHN
Cc1ccc(C)c(C(=O)N[C@@H](C)CNCc2ccc(C#N)s2)c1	ZINC001716004756	1420458946	/nfs/dbraw/zinc/45/89/46/1420458946.db2.gz	OXTFWZNVFWKMDQ-AWEZNQCLSA-N	0	3	327.453	3.145	20	30		EGEDHN
C[C@]1(CNCc2ccccc2C#N)CCN(C(=O)CCC2CC2)C1	ZINC001716860396	1420991018	/nfs/dbraw/zinc/99/10/18/1420991018.db2.gz	KJQDJHKLPLBBEG-HXUWFJFHSA-N	0	3	325.456	3.077	20	30		EGEDHN
CC(C)(F)C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1C#N	ZINC001716997694	1421066722	/nfs/dbraw/zinc/06/67/22/1421066722.db2.gz	WOFBZTLUYFTNCH-GBEXYDAJSA-N	0	3	343.446	3.166	20	30		EGEDHN
Cc1cc(C(=O)N2CCCC[C@@H]2CNCC#Cc2ccccc2)co1	ZINC001717144525	1421137731	/nfs/dbraw/zinc/13/77/31/1421137731.db2.gz	BQXUJTPNNHPKIA-HXUWFJFHSA-N	0	3	336.435	3.224	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)c2cc(F)c[nH]2)CC1	ZINC001717356343	1421291073	/nfs/dbraw/zinc/29/10/73/1421291073.db2.gz	UZZAWPRSFVKUAE-UHFFFAOYSA-N	0	3	327.831	3.080	20	30		EGEDHN
C=C(Cl)CN1CCCCC[C@H]1CNC(=O)CN(C)CC(C)(C)C	ZINC001717539581	1421479504	/nfs/dbraw/zinc/47/95/04/1421479504.db2.gz	YLIHMESCWINYQC-INIZCTEOSA-N	0	3	343.943	3.078	20	30		EGEDHN
Cc1ccc(C)c(C(=O)N(C)C[C@H](C)NCc2ccc(C#N)s2)c1	ZINC001717752955	1421615784	/nfs/dbraw/zinc/61/57/84/1421615784.db2.gz	YYBXNHUOOKGTHR-HNNXBMFYSA-N	0	3	341.480	3.487	20	30		EGEDHN
CC(C)(C)[C@@H](CNCc1ccc(C#N)s1)NC(=O)[C@H]1CC1(C)C	ZINC001717958760	1421730502	/nfs/dbraw/zinc/73/05/02/1421730502.db2.gz	VXUJDJYKJHENRZ-HUUCEWRRSA-N	0	3	333.501	3.286	20	30		EGEDHN
N#Cc1cc(CNC2(CNC(=O)C3CC4(CCC4)C3)CC2)ccc1F	ZINC001723544469	1424458324	/nfs/dbraw/zinc/45/83/24/1424458324.db2.gz	BFHNGSKEZBKKNY-UHFFFAOYSA-N	0	3	341.430	3.016	20	30		EGEDHN
C[C@@H](CNC(=O)C1CCCCCC1)N(C)Cc1ccc(C#N)cc1	ZINC001725157240	1425648659	/nfs/dbraw/zinc/64/86/59/1425648659.db2.gz	SCHLMIIUYKFWLF-INIZCTEOSA-N	0	3	327.472	3.465	20	30		EGEDHN
C[C@@H](CNC(=O)C1(c2ccccc2)CC1)N(C)Cc1cccc(C#N)c1	ZINC001725194873	1425747984	/nfs/dbraw/zinc/74/79/84/1425747984.db2.gz	LSNJIVDIALVDRH-KRWDZBQOSA-N	0	3	347.462	3.227	20	30		EGEDHN
CC1(C(=O)NC[C@H]2CCCCCN2Cc2cccc(C#N)c2)CC1	ZINC001725235593	1425819006	/nfs/dbraw/zinc/81/90/06/1425819006.db2.gz	FUGYVZYVORPPLH-GOSISDBHSA-N	0	3	325.456	3.219	20	30		EGEDHN
CN(C(=O)CC1CCC1)[C@@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001725451985	1426117387	/nfs/dbraw/zinc/11/73/87/1426117387.db2.gz	DEXQVGKLMUPRLD-IBGZPJMESA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@@H](CN(C)C(=O)c1ccc(Cl)o1)NCc1ccc(C#N)s1	ZINC001725473399	1426145779	/nfs/dbraw/zinc/14/57/79/1426145779.db2.gz	FEQYJMIXJBUHQA-JTQLQIEISA-N	0	3	337.832	3.116	20	30		EGEDHN
Cc1cc(C(=O)N(C)C[C@H](C)NCc2ccc(C#N)s2)oc1C	ZINC001725483670	1426160330	/nfs/dbraw/zinc/16/03/30/1426160330.db2.gz	LMSKCKXVQMBLHA-LBPRGKRZSA-N	0	3	331.441	3.080	20	30		EGEDHN
CC(C)CCC(=O)N[C@@H]1CC[C@H](CNCc2ccccc2C#N)C1	ZINC001725644301	1426325043	/nfs/dbraw/zinc/32/50/43/1426325043.db2.gz	WDGPDNJPYYROOR-QFBILLFUSA-N	0	3	327.472	3.369	20	30		EGEDHN
CC(C)CCC(=O)N[C@H]1CC[C@H](CNCc2ccccc2C#N)C1	ZINC001725644298	1426325509	/nfs/dbraw/zinc/32/55/09/1426325509.db2.gz	WDGPDNJPYYROOR-LPHOPBHVSA-N	0	3	327.472	3.369	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCCC[C@H]1CNCC#Cc1ccc(F)cc1	ZINC001733921245	1437735260	/nfs/dbraw/zinc/73/52/60/1437735260.db2.gz	XRDYEISFYUEOIA-RPYYPOKISA-N	0	3	328.431	3.114	20	30		EGEDHN
Cc1coc(C(=O)N(C)[C@H](CNCc2ccc(C#N)s2)C2CC2)c1	ZINC001734305348	1438037252	/nfs/dbraw/zinc/03/72/52/1438037252.db2.gz	RBJWTLRQWLAQCM-MRXNPFEDSA-N	0	3	343.452	3.162	20	30		EGEDHN
CCN(CC#Cc1ccccc1)CCCNC(=O)[C@@H]1C[C@@H]1C(C)C	ZINC001752222415	1440156603	/nfs/dbraw/zinc/15/66/03/1440156603.db2.gz	GPBLIJCWSCOLDO-WOJBJXKFSA-N	0	3	326.484	3.158	20	30		EGEDHN
CCC(=CC(=O)NC[C@H](NCc1ccc(C#N)cc1F)C1CC1)CC	ZINC001752453804	1440182811	/nfs/dbraw/zinc/18/28/11/1440182811.db2.gz	DVHFGXMLBWHDFM-IBGZPJMESA-N	0	3	343.446	3.428	20	30		EGEDHN
O=C(NC[C@H](NCC#Cc1ccccc1)C1CC1)C1=CCCCCC1	ZINC001752460701	1440183699	/nfs/dbraw/zinc/18/36/99/1440183699.db2.gz	WAJAKDGLJJBQAG-NRFANRHFSA-N	0	3	336.479	3.413	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)NC[C@@H](NCC#Cc2ccccc2)C2CC2)CC1	ZINC001752489953	1440186548	/nfs/dbraw/zinc/18/65/48/1440186548.db2.gz	CDJYECKXMXAUDS-DUXKGJEZSA-N	0	3	338.495	3.349	20	30		EGEDHN
O=C(CCc1ccccc1)NC[C@@H](NCC#Cc1ccccc1)C1CC1	ZINC001752491601	1440186767	/nfs/dbraw/zinc/18/67/67/1440186767.db2.gz	VGHMXYWGGYLWAE-JOCHJYFZSA-N	0	3	346.474	3.155	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)c1cncc2[nH]ccc21	ZINC001752538252	1440194493	/nfs/dbraw/zinc/19/44/93/1440194493.db2.gz	HGXJOFRHDGFFAS-HRCADAONSA-N	0	3	338.455	3.206	20	30		EGEDHN
C=CCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)CO[C@@H]1CCCC[C@@H]1C	ZINC001752565196	1440195457	/nfs/dbraw/zinc/19/54/57/1440195457.db2.gz	LLBMYALRPQEZTD-INDMIFKZSA-N	0	3	334.504	3.223	20	30		EGEDHN
C[C@H]1CC[C@@H](C(=O)N[C@H]2C[C@H](NCC#Cc3cccc(Cl)c3)C2)C1	ZINC001752670489	1440198968	/nfs/dbraw/zinc/19/89/68/1440198968.db2.gz	YKFDAZIQCBMJSW-FXECBMLZSA-N	0	3	344.886	3.365	20	30		EGEDHN
O=C(CCC1CC1)N[C@H]1C[C@@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001752722345	1440203876	/nfs/dbraw/zinc/20/38/76/1440203876.db2.gz	PDJVRJRQWZMTGU-HDICACEKSA-N	0	3	330.859	3.119	20	30		EGEDHN
O=C(N[C@H]1C[C@@H](NCC#Cc2ccccc2)C1)c1cc2ccccc2o1	ZINC001752774739	1440206590	/nfs/dbraw/zinc/20/65/90/1440206590.db2.gz	JFSVVDRIOATGDH-KDURUIRLSA-N	0	3	344.414	3.335	20	30		EGEDHN
CC(F)(F)CCC(=O)N1CCC[C@@H](CNCc2ccccc2C#N)C1	ZINC001752801212	1440214985	/nfs/dbraw/zinc/21/49/85/1440214985.db2.gz	IMWJWZWQGUIIPN-HNNXBMFYSA-N	0	3	349.425	3.322	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)CCc1ccc(F)cc1F	ZINC001752823523	1440222135	/nfs/dbraw/zinc/22/21/35/1440222135.db2.gz	DIXNVGHJIJYNOY-KRWDZBQOSA-N	0	3	336.426	3.444	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)[C@H](OC(C)C)c1ccccc1	ZINC001752826279	1440223733	/nfs/dbraw/zinc/22/37/33/1440223733.db2.gz	ZCEALFDYYNXIST-VQTJNVASSA-N	0	3	342.483	3.147	20	30		EGEDHN
COCC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)CCCC(C)C	ZINC001752833402	1440226476	/nfs/dbraw/zinc/22/64/76/1440226476.db2.gz	FSHVTGJODNQTDC-UXHICEINSA-N	0	3	348.531	3.308	20	30		EGEDHN
C[C@H](CNC(=O)C(C)(C)c1ccccc1)NCc1ccc(C#N)s1	ZINC001752918604	1440247783	/nfs/dbraw/zinc/24/77/83/1440247783.db2.gz	KGGDQVNWZUXTQM-CQSZACIVSA-N	0	3	341.480	3.192	20	30		EGEDHN
C=C[C@@H](C(=O)NC[C@@H](C)NCc1c(C)nsc1C)c1ccccc1	ZINC001752920955	1440248599	/nfs/dbraw/zinc/24/85/99/1440248599.db2.gz	JFXKNWOTNPSEBA-CXAGYDPISA-N	0	3	343.496	3.324	20	30		EGEDHN
CC(C)(C)/C=C\C(=O)N1CC[C@@H](CNCc2ccccc2C#N)C1	ZINC001752934530	1440250254	/nfs/dbraw/zinc/25/02/54/1440250254.db2.gz	HYEQJDMCWGZQNR-YHWKNFMLSA-N	0	3	325.456	3.099	20	30		EGEDHN
CC#CCN(C)[C@@H]1CCCN(C(=O)C2C3CC4CC(C3)CC2C4)C1	ZINC001752992383	1440259949	/nfs/dbraw/zinc/25/99/49/1440259949.db2.gz	LBFLVZYONMDKMS-RDOIFFKNSA-N	0	3	328.500	3.005	20	30		EGEDHN
CC#CCN(C)[C@H]1CCCN(C(=O)[C@@H](CC)c2ccc(OC)cc2)C1	ZINC001752999617	1440263940	/nfs/dbraw/zinc/26/39/40/1440263940.db2.gz	DSGXNCKMXUWCFS-ICSRJNTNSA-N	0	3	342.483	3.135	20	30		EGEDHN
CC#CCN(C)[C@@H]1CCCN(C(=O)C[C@H](C)c2ccc(OC)cc2)C1	ZINC001753000013	1440264054	/nfs/dbraw/zinc/26/40/54/1440264054.db2.gz	LVCDECMMQJKLJJ-PKOBYXMFSA-N	0	3	342.483	3.135	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)c1ccccc1C	ZINC001753001465	1440264751	/nfs/dbraw/zinc/26/47/51/1440264751.db2.gz	AXYVSMDAEYIHFP-CYBMUJFWSA-N	0	3	325.250	3.002	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCC[C@H]1CCCN1Cc1sccc1Cl	ZINC001753025734	1440271389	/nfs/dbraw/zinc/27/13/89/1440271389.db2.gz	ZXZFOHIHEZFDOH-STQMWFEESA-N	0	3	339.892	3.422	20	30		EGEDHN
CCN(CCNC(=O)C#CC(C)(C)C)[C@@H](C)c1cccc(OC)c1	ZINC001753081750	1440294213	/nfs/dbraw/zinc/29/42/13/1440294213.db2.gz	QXOKINMSSNGYOT-INIZCTEOSA-N	0	3	330.472	3.244	20	30		EGEDHN
CCN(CCNC(=O)C#CC(C)C)Cc1ccc(CC(C)C)cc1	ZINC001753081603	1440294332	/nfs/dbraw/zinc/29/43/32/1440294332.db2.gz	LPYCRTRYJDXLPG-UHFFFAOYSA-N	0	3	328.500	3.483	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC[C@@H]1CCCN1Cc1ccc(C)cc1	ZINC001753099917	1440303932	/nfs/dbraw/zinc/30/39/32/1440303932.db2.gz	YZTUQTWZGOBDKG-MJGOQNOKSA-N	0	3	330.472	3.057	20	30		EGEDHN
O=C(C#CC1CC1)NC[C@@H]1CCN([C@@H]2CCc3c2cccc3Cl)C1	ZINC001753123591	1440314627	/nfs/dbraw/zinc/31/46/27/1440314627.db2.gz	FDYNRZHLMIOUPP-HNAYVOBHSA-N	0	3	342.870	3.179	20	30		EGEDHN
CC#CCN(CCC)CCNC(=O)Cc1c(C)oc2ccccc21	ZINC001753150489	1440327747	/nfs/dbraw/zinc/32/77/47/1440327747.db2.gz	KHTAAVDOJLUALW-UHFFFAOYSA-N	0	3	326.440	3.135	20	30		EGEDHN
C=CC[C@H](C(=O)N(C)CCNCc1ccc(C#N)cc1)c1ccccc1	ZINC001753272047	1440345517	/nfs/dbraw/zinc/34/55/17/1440345517.db2.gz	IVHIUFIRTAEBBO-NRFANRHFSA-N	0	3	347.462	3.466	20	30		EGEDHN
C=CCN[C@H](CNC(=O)[C@H](C)Oc1ccccc1F)c1ccccc1	ZINC001753298912	1440353227	/nfs/dbraw/zinc/35/32/27/1440353227.db2.gz	OZOWRAIDCVYHGD-MAUKXSAKSA-N	0	3	342.414	3.226	20	30		EGEDHN
C#CCCN[C@@H](CNC(=O)CC1CCC(OC)CC1)c1ccccc1	ZINC001753302657	1440354486	/nfs/dbraw/zinc/35/44/86/1440354486.db2.gz	HQGWGRKOXAPVQE-UUKMXZOPSA-N	0	3	342.483	3.052	20	30		EGEDHN
C=C(C)CN[C@H](CNC(=O)c1cc(C)n(C(C)C)n1)c1ccccc1	ZINC001753302555	1440354488	/nfs/dbraw/zinc/35/44/88/1440354488.db2.gz	FDMYYGUQMWPXKB-LJQANCHMSA-N	0	3	340.471	3.409	20	30		EGEDHN
C=C(C)CN[C@@H](CNC(=O)[C@H](C)Cc1ccco1)c1ccccc1	ZINC001753314424	1440358618	/nfs/dbraw/zinc/35/86/18/1440358618.db2.gz	ZOZGRMUNYNOBIY-APWZRJJASA-N	0	3	326.440	3.481	20	30		EGEDHN
C=C(C)CN[C@H](CNC(=O)[C@H](C)Cc1ccco1)c1ccccc1	ZINC001753314427	1440358635	/nfs/dbraw/zinc/35/86/35/1440358635.db2.gz	ZOZGRMUNYNOBIY-VQIMIIECSA-N	0	3	326.440	3.481	20	30		EGEDHN
C=CCCN1CC[C@H](N(CCC)C(=O)c2cc(C(F)(F)F)no2)C1	ZINC001753317847	1440360697	/nfs/dbraw/zinc/36/06/97/1440360697.db2.gz	XDICFKBINHHWFJ-LBPRGKRZSA-N	0	3	345.365	3.196	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CCC)C(=O)CCc2nc(C)cs2)C1	ZINC001753319027	1440361874	/nfs/dbraw/zinc/36/18/74/1440361874.db2.gz	WAYKTXBJOGAZAP-MRXNPFEDSA-N	0	3	335.517	3.273	20	30		EGEDHN
C=CCOCCN1CC[C@H](N(CCC)C(=O)c2ccc(C)cc2C)C1	ZINC001753322953	1440364805	/nfs/dbraw/zinc/36/48/05/1440364805.db2.gz	KWZYVDSNTZHARR-IBGZPJMESA-N	0	3	344.499	3.433	20	30		EGEDHN
C#CCCCCC(=O)NCC[C@@H]1CCN(CC#Cc2ccccc2)C1	ZINC001753326229	1440366882	/nfs/dbraw/zinc/36/68/82/1440366882.db2.gz	HKAPHQGVHFFIPA-OAQYLSRUSA-N	0	3	336.479	3.060	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](CN(C)Cc3oc(C)nc3C)C2)CCC1	ZINC001753355656	1440380027	/nfs/dbraw/zinc/38/00/27/1440380027.db2.gz	RQRCLGDDMMBHDI-KRWDZBQOSA-N	0	3	345.487	3.318	20	30		EGEDHN
C=CC1(CC(=O)NCC2CN(C[C@H]3CC[C@@H](C)O3)C2)CCCCC1	ZINC001753412979	1440393665	/nfs/dbraw/zinc/39/36/65/1440393665.db2.gz	WGLDHBZCNLUJLC-SJLPKXTDSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCC1(C(=O)N(C)[C@@H]2CCN(CCc3scnc3C)C2)CCC1	ZINC001753443631	1440402810	/nfs/dbraw/zinc/40/28/10/1440402810.db2.gz	AILHMGSMEANYFD-MRXNPFEDSA-N	0	3	347.528	3.273	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N(C)[C@@H]1CCN(CCOCc2ccccc2)C1	ZINC001753444389	1440403174	/nfs/dbraw/zinc/40/31/74/1440403174.db2.gz	QBSWUNBJNHYQJD-TZIWHRDSSA-N	0	3	344.499	3.338	20	30		EGEDHN
CC[C@H](CNC(=O)CC(C)(C)CC)NCC#Cc1ccc(F)cc1	ZINC001753474910	1440415053	/nfs/dbraw/zinc/41/50/53/1440415053.db2.gz	GFSMXIHTYGMCSE-GOSISDBHSA-N	0	3	332.463	3.488	20	30		EGEDHN
C=CCCCC(=O)NC1(CN[C@@H](C)c2cnc(C)cn2)CCCC1	ZINC001753507171	1440424734	/nfs/dbraw/zinc/42/47/34/1440424734.db2.gz	OXQYGGRYGWYUNI-INIZCTEOSA-N	0	3	330.476	3.221	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1cc(CC(C)C)c[nH]1)C1CC1	ZINC001753528688	1440430292	/nfs/dbraw/zinc/43/02/92/1440430292.db2.gz	RWHPETLNJIWRTD-GOSISDBHSA-N	0	3	337.895	3.454	20	30		EGEDHN
C#CCCCCC(=O)N[C@@]1(CNCc2conc2C)CCCC[C@H]1C	ZINC001753531952	1440431266	/nfs/dbraw/zinc/43/12/66/1440431266.db2.gz	PCKMECYORHCVGV-OXQOHEQNSA-N	0	3	345.487	3.331	20	30		EGEDHN
C#CCCCC(=O)N[C@@]1(CNCc2cncs2)CCCC[C@@H]1C	ZINC001753532663	1440431552	/nfs/dbraw/zinc/43/15/52/1440431552.db2.gz	UKGSSKXCRQGXAU-MAUKXSAKSA-N	0	3	333.501	3.101	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCCN(C(=O)c2ncccc2CC)C1	ZINC001753549919	1440434816	/nfs/dbraw/zinc/43/48/16/1440434816.db2.gz	GVRBFONBXZSMIH-OAHLLOKOSA-N	0	3	335.879	3.228	20	30		EGEDHN
CC1(CC(=O)NCCC2CCN(CC#Cc3ccccc3)CC2)CC1	ZINC001753595920	1440444530	/nfs/dbraw/zinc/44/45/30/1440444530.db2.gz	MYHCLTKAXCLKCJ-UHFFFAOYSA-N	0	3	338.495	3.447	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)c2cccs2)CCCC1	ZINC001753660130	1440458194	/nfs/dbraw/zinc/45/81/94/1440458194.db2.gz	QVMIBGBWRGPEHP-UHFFFAOYSA-N	0	3	343.290	3.289	20	30		EGEDHN
CC/C(C)=C\C(=O)NC[C@H](NCc1cc(C#N)ccc1F)C(C)C	ZINC001753828514	1440499059	/nfs/dbraw/zinc/49/90/59/1440499059.db2.gz	HYCREDZJFMFVNI-PIJNTSGSSA-N	0	3	331.435	3.284	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1sc(C)cc1OC)C(C)C	ZINC001753838925	1440501932	/nfs/dbraw/zinc/50/19/32/1440501932.db2.gz	HCOUJIYOIOLMBZ-GFCCVEGCSA-N	0	3	330.881	3.162	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)[C@H]1CCC1(C)C)NCC#Cc1ccccc1	ZINC001753839291	1440502121	/nfs/dbraw/zinc/50/21/21/1440502121.db2.gz	WDJNAAMONPPEAX-RTBURBONSA-N	0	3	326.484	3.205	20	30		EGEDHN
C#CCCCCC(=O)N(C)CCN(C)Cc1ccc2cc[nH]c2c1	ZINC001753850967	1440506758	/nfs/dbraw/zinc/50/67/58/1440506758.db2.gz	NPNOLIHCAADABO-UHFFFAOYSA-N	0	3	325.456	3.252	20	30		EGEDHN
C[C@@H](CCNCc1cc(C#N)ccc1F)NC(=O)[C@H]1CC=CCC1	ZINC001753944181	1440524716	/nfs/dbraw/zinc/52/47/16/1440524716.db2.gz	IDJQWNCKFLHYGB-HOCLYGCPSA-N	0	3	329.419	3.038	20	30		EGEDHN
C[C@@H](CCNCc1cc(C#N)ccc1F)NC(=O)/C=C\C(C)(C)C	ZINC001753953477	1440525553	/nfs/dbraw/zinc/52/55/53/1440525553.db2.gz	NWYOOUYRRILMMX-LEJCZOIISA-N	0	3	331.435	3.284	20	30		EGEDHN
CCN(CCNCc1ccc(C#N)s1)C(=O)c1ccc(F)c(F)c1	ZINC001754049331	1440535614	/nfs/dbraw/zinc/53/56/14/1440535614.db2.gz	PWDZVCLNEXCNTB-UHFFFAOYSA-N	0	3	349.406	3.150	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC/C=C/CNCc1cccc2nsnc21	ZINC001754157154	1440545702	/nfs/dbraw/zinc/54/57/02/1440545702.db2.gz	SEAMFPQKSFDEGJ-AATRIKPKSA-N	0	3	344.484	3.056	20	30		EGEDHN
CC(C)(C(=O)NC/C=C\CNCc1cccc(C#N)c1)c1ccccc1	ZINC001754204467	1440550575	/nfs/dbraw/zinc/55/05/75/1440550575.db2.gz	PLNVBKDVOWABSO-SREVYHEPSA-N	0	3	347.462	3.298	20	30		EGEDHN
C[C@H](CNCC#Cc1cccc(Cl)c1)NC(=O)C1C(C)(C)C1(C)C	ZINC001754221430	1440552741	/nfs/dbraw/zinc/55/27/41/1440552741.db2.gz	CPAVRUFZNRLCOP-CQSZACIVSA-N	0	3	346.902	3.468	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)NC(=O)C(C)(C)c1ccccc1	ZINC001754252083	1440558340	/nfs/dbraw/zinc/55/83/40/1440558340.db2.gz	YAJSDHPMIKDWKS-CQSZACIVSA-N	0	3	341.480	3.192	20	30		EGEDHN
C=CC[C@H](C(=O)N[C@@H](C)CNCc1cncs1)c1ccccc1	ZINC001754295189	1440566118	/nfs/dbraw/zinc/56/61/18/1440566118.db2.gz	PMCJNJUEKOIRQX-YOEHRIQHSA-N	0	3	329.469	3.097	20	30		EGEDHN
C[C@@H](CN(C)Cc1cccc(C#N)c1)NC(=O)[C@@H](F)c1ccccc1	ZINC001754326824	1440581288	/nfs/dbraw/zinc/58/12/88/1440581288.db2.gz	RSFLUOFMYOLZJG-KXBFYZLASA-N	0	3	339.414	3.206	20	30		EGEDHN
CN(CCCNCc1cc(C#N)ccc1F)C(=O)c1ccoc1Cl	ZINC001754368159	1440592298	/nfs/dbraw/zinc/59/22/98/1440592298.db2.gz	WJNSMPFXLFOYFW-UHFFFAOYSA-N	0	3	349.793	3.196	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](NC(=O)c2ccc(F)cc2)C2CC2)s1	ZINC001754432207	1440597220	/nfs/dbraw/zinc/59/72/20/1440597220.db2.gz	DYIYVJNDWMKIQH-KRWDZBQOSA-N	0	3	343.427	3.057	20	30		EGEDHN
C[C@@]1(C(=O)N[C@H](CNCc2ccc(C#N)c(F)c2)C2CC2)C=CCC1	ZINC001754449740	1440600818	/nfs/dbraw/zinc/60/08/18/1440600818.db2.gz	YCAGMRCTUQMXPL-UYAOXDASSA-N	0	3	341.430	3.038	20	30		EGEDHN
CCCC1(C(=O)N[C@H](CNCc2ccc(C#N)c(F)c2)C2CC2)CC1	ZINC001754450641	1440600983	/nfs/dbraw/zinc/60/09/83/1440600983.db2.gz	QTWYSMITMTWNMR-GOSISDBHSA-N	0	3	343.446	3.262	20	30		EGEDHN
CC[C@H](C)CCC(=O)N[C@H](CNCC#Cc1ccccc1)C1CC1	ZINC001754455181	1440602010	/nfs/dbraw/zinc/60/20/10/1440602010.db2.gz	NLJRBGKNLVBDIR-FXAWDEMLSA-N	0	3	326.484	3.349	20	30		EGEDHN
C=CCC[C@H](C)N1CC[C@@H]1CNC(=O)c1c(F)cc(OC)cc1F	ZINC001754493877	1440611105	/nfs/dbraw/zinc/61/11/05/1440611105.db2.gz	HIIVMLLCCGXNRF-QWHCGFSZSA-N	0	3	338.398	3.132	20	30		EGEDHN
C=CCCCCCN1CC[C@H]1CNC(=O)c1cc2ccccn2c1	ZINC001754496969	1440612532	/nfs/dbraw/zinc/61/25/32/1440612532.db2.gz	ZFZVEDAFSQWVDV-IBGZPJMESA-N	0	3	325.456	3.490	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)C[C@H](C)c1ccccc1OC	ZINC001754501665	1440614566	/nfs/dbraw/zinc/61/45/66/1440614566.db2.gz	ZTPQDCVRFHQZIR-DLBZAZTESA-N	0	3	330.472	3.346	20	30		EGEDHN
C=CCC1(C(=O)NCC2(NCc3csc(C)c3)CC2)CCOCC1	ZINC001754532919	1440623154	/nfs/dbraw/zinc/62/31/54/1440623154.db2.gz	QQCTZAFDIQZWQU-UHFFFAOYSA-N	0	3	348.512	3.168	20	30		EGEDHN
C=C(Cl)CN(CC1CC1)C1CCN(C(=O)c2cc(C)on2)CC1	ZINC001754547446	1440628079	/nfs/dbraw/zinc/62/80/79/1440628079.db2.gz	DFRFBPVOZNBIGA-UHFFFAOYSA-N	0	3	337.851	3.052	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001754565147	1440635078	/nfs/dbraw/zinc/63/50/78/1440635078.db2.gz	MHRYCIMDDCKYDC-OAQYLSRUSA-N	0	3	337.467	3.339	20	30		EGEDHN
Cc1nc(CN[C@H]2CCN(C(=O)C#CC(C)(C)C)[C@@H](C)C2)sc1C	ZINC001754596813	1440641627	/nfs/dbraw/zinc/64/16/27/1440641627.db2.gz	ZJSULNVLKCVCRP-BBRMVZONSA-N	0	3	347.528	3.279	20	30		EGEDHN
C#CCN(C(=O)Cc1ccc(F)cc1Cl)C1CCN(CC=C)CC1	ZINC001754640390	1440649035	/nfs/dbraw/zinc/64/90/35/1440649035.db2.gz	PXOHLVIJMIZIPO-UHFFFAOYSA-N	0	3	348.849	3.134	20	30		EGEDHN
C#CCNC[C@@H](NC(=O)c1coc(CC)n1)c1ccc2ccccc2c1	ZINC001754644652	1440649828	/nfs/dbraw/zinc/64/98/28/1440649828.db2.gz	WFQYHPIXTHKKBJ-GOSISDBHSA-N	0	3	347.418	3.084	20	30		EGEDHN
C=CCCC(=O)N[C@H](CNCC#Cc1ccc(F)cc1)C1CCCC1	ZINC001754645385	1440650232	/nfs/dbraw/zinc/65/02/32/1440650232.db2.gz	LEWZEJVVRPPHMI-HXUWFJFHSA-N	0	3	342.458	3.408	20	30		EGEDHN
C=CCCC(=O)N[C@H](CNCc1ccc(Cl)nc1)C1CCCC1	ZINC001754647270	1440650708	/nfs/dbraw/zinc/65/07/08/1440650708.db2.gz	YLDXHFFLDRHRKH-MRXNPFEDSA-N	0	3	335.879	3.466	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@](C)(CNCc3nccs3)C2)CC1	ZINC001754704629	1440668774	/nfs/dbraw/zinc/66/87/74/1440668774.db2.gz	MABIASUYUVGJOC-GOSISDBHSA-N	0	3	333.501	3.218	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)C[C@@H](OCC)C(C)C)C2)CC1	ZINC001754784340	1440687291	/nfs/dbraw/zinc/68/72/91/1440687291.db2.gz	UYECASLIVOBGBJ-VQTJNVASSA-N	0	3	348.531	3.021	20	30		EGEDHN
C=CCN[C@H](CNC(=O)c1cn(CC)nc1C)c1ccccc1CC	ZINC001754791281	1440688640	/nfs/dbraw/zinc/68/86/40/1440688640.db2.gz	VATBEDOACORYQH-LJQANCHMSA-N	0	3	340.471	3.021	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@H](C)[C@@H](CNCc3nccs3)C2)CCC1	ZINC001754821942	1440693023	/nfs/dbraw/zinc/69/30/23/1440693023.db2.gz	AXZDPDJKNOLRLV-GJZGRUSLSA-N	0	3	333.501	3.074	20	30		EGEDHN
C#CCNCCN(Cc1ccccc1)C(=O)[C@@H](c1cccnc1)C(C)C	ZINC001754838105	1440697339	/nfs/dbraw/zinc/69/73/39/1440697339.db2.gz	ZCGUBVBPKHOCOW-OAQYLSRUSA-N	0	3	349.478	3.073	20	30		EGEDHN
C#CCCCC(=O)N(Cc1ccccn1)C1CCN(CC(=C)C)CC1	ZINC001754839377	1440697441	/nfs/dbraw/zinc/69/74/41/1440697441.db2.gz	OEAFPOOCKKGFDC-UHFFFAOYSA-N	0	3	339.483	3.254	20	30		EGEDHN
C#CCCCC(=O)N1C[C@H]2CN(Cc3ccc(Cl)cc3C)C[C@H]2C1	ZINC001754841905	1440697966	/nfs/dbraw/zinc/69/79/66/1440697966.db2.gz	BEZJKFISNXDAMQ-HDICACEKSA-N	0	3	344.886	3.342	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1cccc(C#N)c1	ZINC001754867150	1440703307	/nfs/dbraw/zinc/70/33/07/1440703307.db2.gz	HCCXSWACKOLMRI-RTWAWAEBSA-N	0	3	349.478	3.317	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@@H]2CCCN3C(=O)CCC(F)F)c1	ZINC001754869403	1440704446	/nfs/dbraw/zinc/70/44/46/1440704446.db2.gz	WUUOHEZPPSWCTJ-IRXDYDNUSA-N	0	3	347.409	3.169	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCN(C(=O)c2cccc3[nH]ccc32)C1	ZINC001754932967	1440710869	/nfs/dbraw/zinc/71/08/69/1440710869.db2.gz	KCSGWQZJRMLAMU-CQSZACIVSA-N	0	3	331.847	3.362	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC2(C1)CCN(Cc1cnccc1C)CC2	ZINC001754961021	1440717683	/nfs/dbraw/zinc/71/76/83/1440717683.db2.gz	FOQQNPZZYWBSTM-UHFFFAOYSA-N	0	3	341.499	3.417	20	30		EGEDHN
C=CCCCN1CCc2c(CNC(=O)C(=O)C(C)(C)C)cccc2C1	ZINC001754973696	1440719279	/nfs/dbraw/zinc/71/92/79/1440719279.db2.gz	DIGHFPRSIZQBOI-UHFFFAOYSA-N	0	3	342.483	3.242	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CCCN(Cc2scnc2C)CC1	ZINC001755028548	1440730220	/nfs/dbraw/zinc/73/02/20/1440730220.db2.gz	NNRQVQRSJUYMNX-MRXNPFEDSA-N	0	3	333.501	3.116	20	30		EGEDHN
CC#CCN(C)CCCN(C)C(=O)c1oc2c(cccc2C)c1C	ZINC001755047090	1440741763	/nfs/dbraw/zinc/74/17/63/1440741763.db2.gz	DXFSEMMTBJURPP-UHFFFAOYSA-N	0	3	326.440	3.467	20	30		EGEDHN
C=CCCCN1Cc2ccc(CNC(=O)[C@H]3C[C@@H](C)CO3)cc2C1	ZINC001755102037	1440753225	/nfs/dbraw/zinc/75/32/25/1440753225.db2.gz	GCWSOKXBIYDTPK-DNVCBOLYSA-N	0	3	328.456	3.010	20	30		EGEDHN
CCc1ccc(C(=O)N2C[C@H](NCC#Cc3ccccc3)[C@@H](C)C2)cc1	ZINC001755123931	1440756009	/nfs/dbraw/zinc/75/60/09/1440756009.db2.gz	WDGMIKXAILHHQB-AVRDEDQJSA-N	0	3	346.474	3.351	20	30		EGEDHN
CC/C(C)=C\C(=O)N[C@@H]1CCN(Cc2cccc(C#N)c2)[C@H](C)C1	ZINC001755159169	1440764086	/nfs/dbraw/zinc/76/40/86/1440764086.db2.gz	DJRZBQGUSDWOOD-AEDISCFBSA-N	0	3	325.456	3.384	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)CCc2cccc(Cl)c2)C[C@H]1C	ZINC001755161897	1440765098	/nfs/dbraw/zinc/76/50/98/1440765098.db2.gz	NXAWUAIKLZSZBT-QAPCUYQASA-N	0	3	332.875	3.265	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@@H](C)CCCCC)CCO2	ZINC001755173735	1440770162	/nfs/dbraw/zinc/77/01/62/1440770162.db2.gz	HGMREVUGIVMTNR-SFHVURJKSA-N	0	3	336.520	3.472	20	30		EGEDHN
C=CCCCN1CCOC2(CCN(C(=O)[C@H]3CCCC[C@H]3C)CC2)C1	ZINC001755174316	1440770470	/nfs/dbraw/zinc/77/04/70/1440770470.db2.gz	NUJINPJBKNGXRO-MOPGFXCFSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H]([C@H]2CCN(Cc3cncs3)C2)C1	ZINC001755203185	1440781096	/nfs/dbraw/zinc/78/10/96/1440781096.db2.gz	SCUKXAOEFILDTN-HOTGVXAUSA-N	0	3	333.501	3.170	20	30		EGEDHN
Cc1coc(C(=O)N[C@H](C)[C@@H](C)NCC#Cc2ccccc2Cl)c1	ZINC001755248798	1440791303	/nfs/dbraw/zinc/79/13/03/1440791303.db2.gz	LHJIFMCYAUYQFN-HUUCEWRRSA-N	0	3	344.842	3.390	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H](C)[C@H](C)NCC(=O)Nc1ccc(C)cc1	ZINC001755257293	1440793587	/nfs/dbraw/zinc/79/35/87/1440793587.db2.gz	MOOCSCXXPBZVAG-HOTGVXAUSA-N	0	3	345.487	3.019	20	30		EGEDHN
C[C@@H](NCC#Cc1ccccc1)[C@H](C)NC(=O)C(C)(C)C(F)(F)F	ZINC001755262701	1440795125	/nfs/dbraw/zinc/79/51/25/1440795125.db2.gz	HOFNAGBHNNLZKA-KGLIPLIRSA-N	0	3	340.389	3.109	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)C[C@@H]1CC[C@H](C2CC2)O1	ZINC001755282710	1440801020	/nfs/dbraw/zinc/80/10/20/1440801020.db2.gz	CEIJQAMUOQVGRM-JKSUJKDBSA-N	0	3	342.911	3.161	20	30		EGEDHN
C=C(Br)CNCC(C)(C)CN(C)C(=O)c1cc(C)co1	ZINC001755284208	1440801474	/nfs/dbraw/zinc/80/14/74/1440801474.db2.gz	KOKHBZJHWDVSQE-UHFFFAOYSA-N	0	3	343.265	3.184	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)C1CC2(C1)CCOCC2	ZINC001755288802	1440802923	/nfs/dbraw/zinc/80/29/23/1440802923.db2.gz	DLJAGIIBOBIZCS-UHFFFAOYSA-N	0	3	342.911	3.020	20	30		EGEDHN
CCCC[C@@H](CNCc1ccc(C#N)c(F)c1)NC(=O)C=C(C)C	ZINC001755356000	1440829529	/nfs/dbraw/zinc/82/95/29/1440829529.db2.gz	CIRDCBOXFXVIJV-KRWDZBQOSA-N	0	3	331.435	3.428	20	30		EGEDHN
CCCC[C@H](CNCc1ccc(F)c(C#N)c1)NC(=O)c1cc[nH]c1	ZINC001755357723	1440830349	/nfs/dbraw/zinc/83/03/49/1440830349.db2.gz	HMTGAWJBKAIFST-QGZVFWFLSA-N	0	3	342.418	3.104	20	30		EGEDHN
C#CCCCC(=O)NC[C@@H]1CCCCCN1Cc1ccc(OC)cc1	ZINC001755363124	1440832808	/nfs/dbraw/zinc/83/28/08/1440832808.db2.gz	CHNLXDDTXXATBS-IBGZPJMESA-N	0	3	342.483	3.360	20	30		EGEDHN
COc1ccc(CN2CCCCC[C@H]2CNC(=O)C#CC(C)C)cc1	ZINC001755364344	1440833730	/nfs/dbraw/zinc/83/37/30/1440833730.db2.gz	SZCCLQARCOWZBA-IBGZPJMESA-N	0	3	342.483	3.215	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)COc1ccc(C)cc1C	ZINC001755368523	1440836045	/nfs/dbraw/zinc/83/60/45/1440836045.db2.gz	SJOWNNJQXLOSNA-SFHVURJKSA-N	0	3	330.472	3.229	20	30		EGEDHN
C#CCCN1CC([C@H](C)NC(=O)CCCc2ccc(Cl)cc2)C1	ZINC001755378730	1440838754	/nfs/dbraw/zinc/83/87/54/1440838754.db2.gz	OWFMTGABEMZUGZ-HNNXBMFYSA-N	0	3	332.875	3.123	20	30		EGEDHN
C#CCCN1CC([C@@H](C)NC(=O)C(C)(C)c2ccc(Cl)cc2)C1	ZINC001755381137	1440839297	/nfs/dbraw/zinc/83/92/97/1440839297.db2.gz	DBIGPGWXJCBZQD-CQSZACIVSA-N	0	3	332.875	3.077	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)[C@@H](C)c2cccc(C)c2)C(C)(C)C1	ZINC001755411417	1440846506	/nfs/dbraw/zinc/84/65/06/1440846506.db2.gz	KQORRAWZZOFENB-PKOBYXMFSA-N	0	3	344.499	3.128	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCOc2cc(C)cc(C)c2)C(C)(C)C1	ZINC001755413277	1440847331	/nfs/dbraw/zinc/84/73/31/1440847331.db2.gz	WQGCLGIQCAXJTQ-SFHVURJKSA-N	0	3	330.472	3.085	20	30		EGEDHN
CC#CCN1C[C@]2(C)CN(C(=O)[C@@H](C)OCCCCCC)C[C@]2(C)C1	ZINC001755461635	1440857664	/nfs/dbraw/zinc/85/76/64/1440857664.db2.gz	BIKSDKZNVIMVLI-NRSPTQNISA-N	0	3	348.531	3.166	20	30		EGEDHN
C[C@@H](CCCNCc1cc(C#N)ccc1F)NC(=O)C1(C2CC2)CC1	ZINC001755502041	1440862845	/nfs/dbraw/zinc/86/28/45/1440862845.db2.gz	QCKAMQJAGQBZID-AWEZNQCLSA-N	0	3	343.446	3.262	20	30		EGEDHN
C[C@@H](CCCNCC#Cc1ccccc1Cl)NC(=O)CCCF	ZINC001755510193	1440863420	/nfs/dbraw/zinc/86/34/20/1440863420.db2.gz	BMQIEKIMBCDMKY-HNNXBMFYSA-N	0	3	338.854	3.316	20	30		EGEDHN
C=C(Cl)CNCCC[C@@H](C)NC(=O)c1sc(C)cc1OC	ZINC001755517439	1440864425	/nfs/dbraw/zinc/86/44/25/1440864425.db2.gz	CILSRQVSSGXMHW-LLVKDONJSA-N	0	3	330.881	3.306	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC(N(C)CC#Cc3ccccc3)CC2)C1	ZINC001755533294	1440868157	/nfs/dbraw/zinc/86/81/57/1440868157.db2.gz	LZCAPSFWZBDXNP-UHFFFAOYSA-N	0	3	336.479	3.317	20	30		EGEDHN
CN(C(=O)CC1CCCC1)[C@H](CNCC#Cc1ccccc1)C1CC1	ZINC001755556211	1440873292	/nfs/dbraw/zinc/87/32/92/1440873292.db2.gz	WEOYHWSXTWXGSQ-OAQYLSRUSA-N	0	3	338.495	3.445	20	30		EGEDHN
Cc1ccccc1C(=O)N(C)C[C@@H](C)NCc1ccc(F)c(C#N)c1	ZINC001755575936	1440878086	/nfs/dbraw/zinc/87/80/86/1440878086.db2.gz	NZDRPOMUKXFDFZ-OAHLLOKOSA-N	0	3	339.414	3.256	20	30		EGEDHN
C[C@@H]1[C@H](NCC#Cc2ccccc2)CCN1C(=O)CC1CC(F)(F)C1	ZINC001755655908	1440891910	/nfs/dbraw/zinc/89/19/10/1440891910.db2.gz	DSNFQYQJJZBQGW-CRAIPNDOSA-N	0	3	346.421	3.053	20	30		EGEDHN
C#CCN1CC[C@]2(NC(=O)C[C@@H](C)c3ccc(F)cc3)CCC[C@H]12	ZINC001755705311	1440902604	/nfs/dbraw/zinc/90/26/04/1440902604.db2.gz	WZFQRISWTXCFOC-MOXGXCLJSA-N	0	3	328.431	3.066	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CCCN(CCOCC2CCC2)[C@@H]1C	ZINC001755718729	1440906320	/nfs/dbraw/zinc/90/63/20/1440906320.db2.gz	OZWRQAHLXOYNSF-SJLPKXTDSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@H](NCc2ccc(Cl)nc2)C(C)(C)C1	ZINC001755757587	1440914305	/nfs/dbraw/zinc/91/43/05/1440914305.db2.gz	NXZUDDBDRSSQFS-HNNXBMFYSA-N	0	3	335.879	3.418	20	30		EGEDHN
C=CCCCC(=O)N1C[C@H](NCc2cnn(C(C)(C)C)c2)C(C)(C)C1	ZINC001755762159	1440915210	/nfs/dbraw/zinc/91/52/10/1440915210.db2.gz	XEJUJLSGIIYNID-KRWDZBQOSA-N	0	3	346.519	3.321	20	30		EGEDHN
C=CCN(C)CCN(C(=O)c1sc(Cl)nc1Cl)C(C)C	ZINC001755815103	1440923053	/nfs/dbraw/zinc/92/30/53/1440923053.db2.gz	AXWWDJKEDPYRDN-UHFFFAOYSA-N	0	3	336.288	3.418	20	30		EGEDHN
C=C(Br)CNC[C@H](NC(=O)C1(CCF)CC1)C(C)(C)C	ZINC001755828532	1440928006	/nfs/dbraw/zinc/92/80/06/1440928006.db2.gz	KEEMFCQHKZQXFM-LBPRGKRZSA-N	0	3	349.288	3.155	20	30		EGEDHN
Cc1c[nH]cc1C(=O)N[C@@H](CNCC#Cc1ccccc1)C(C)(C)C	ZINC001755837665	1440930781	/nfs/dbraw/zinc/93/07/81/1440930781.db2.gz	WEPXTHUTBNVQQI-IBGZPJMESA-N	0	3	337.467	3.109	20	30		EGEDHN
C=CCCC(=O)N[C@H](C)C1CCN(Cc2c(C)onc2CC)CC1	ZINC001755842228	1440931985	/nfs/dbraw/zinc/93/19/85/1440931985.db2.gz	ODQAVLZNBGREHK-CQSZACIVSA-N	0	3	333.476	3.228	20	30		EGEDHN
C=C[C@H](C(=O)N(C)C1CC(NCc2ncccc2C)C1)c1ccccc1	ZINC001755865539	1440937609	/nfs/dbraw/zinc/93/76/09/1440937609.db2.gz	HUIBKANBPWTABO-MHJFOBGBSA-N	0	3	349.478	3.439	20	30		EGEDHN
C#CCCCC(=O)NCC1=CCN([C@H](C)c2cccc(OC)c2)CC1	ZINC001755883359	1440939825	/nfs/dbraw/zinc/93/98/25/1440939825.db2.gz	JPCNJSZFABQGOP-QGZVFWFLSA-N	0	3	340.467	3.308	20	30		EGEDHN
COc1cccc([C@@H](CNCc2cccc(C#N)c2)N2CCCC2)c1	ZINC000053096459	214163191	/nfs/dbraw/zinc/16/31/91/214163191.db2.gz	QKJQPDITRNHMPQ-OAQYLSRUSA-N	0	3	335.451	3.494	20	30		EGEDHN
CN1CCN(CCCSc2ccc(C#N)c(C(F)(F)F)c2)CC1	ZINC000131263954	529771450	/nfs/dbraw/zinc/77/14/50/529771450.db2.gz	XIUYGLZKLIYMNS-UHFFFAOYSA-N	0	3	343.418	3.307	20	30		EGEDHN
C[C@@H](CNCc1cc(C#N)n(C)c1)Oc1ccccc1Br	ZINC000191285168	239014328	/nfs/dbraw/zinc/01/43/28/239014328.db2.gz	UXXLJEJRQPGJKA-LBPRGKRZSA-N	0	3	348.244	3.216	20	30		EGEDHN
C[C@H](NC[C@H]1CN(Cc2ccccc2)CCCO1)c1ccc(C#N)cc1	ZINC000191835283	239325764	/nfs/dbraw/zinc/32/57/64/239325764.db2.gz	BOTCRRNDKUIODM-AVRDEDQJSA-N	0	3	349.478	3.500	20	30		EGEDHN
C[C@H](NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1ccc(C#N)cc1	ZINC000191835258	239327173	/nfs/dbraw/zinc/32/71/73/239327173.db2.gz	BOTCRRNDKUIODM-PGRDOPGGSA-N	0	3	349.478	3.500	20	30		EGEDHN
C=CCOCCCC(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000079552061	217240802	/nfs/dbraw/zinc/24/08/02/217240802.db2.gz	MORZGJVFZXGDAQ-HKUYNNGSSA-N	0	3	330.472	3.139	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)NC[C@@H](c1ccccc1)N1CCCC1	ZINC000338089851	141091810	/nfs/dbraw/zinc/09/18/10/141091810.db2.gz	SGBWNGGRRVNFDJ-FQEVSTJZSA-N	0	3	333.435	3.434	20	30		EGEDHN
CC(C)C[C@H](CN[C@H](C)c1ccc(C#N)c(F)c1)N1CCOCC1	ZINC000346195507	141177531	/nfs/dbraw/zinc/17/75/31/141177531.db2.gz	OXMMLEPUKCIVFF-CRAIPNDOSA-N	0	3	333.451	3.095	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2cc(C#N)ccc2Cl)CCN(C2CCC2)C1	ZINC000344782638	144224129	/nfs/dbraw/zinc/22/41/29/144224129.db2.gz	YBUZHZGFPFRZNJ-ZDUSSCGKSA-N	0	3	331.847	3.158	20	30		EGEDHN
CSc1cc2c(cc1CNCCc1cccc(C#N)c1)OCCO2	ZINC000341483635	155317632	/nfs/dbraw/zinc/31/76/32/155317632.db2.gz	LCUHPJHNAKWYDH-UHFFFAOYSA-N	0	3	340.448	3.384	20	30		EGEDHN
C[C@H](COc1ccccc1C(F)(F)F)NCc1cc(C#N)n(C)c1	ZINC000190861274	153163283	/nfs/dbraw/zinc/16/32/83/153163283.db2.gz	UQBYPMZAPKFHSR-GFCCVEGCSA-N	0	3	337.345	3.473	20	30		EGEDHN
CSc1ccc([C@H](CNC(=O)c2cccc(C#N)c2)N(C)C)cc1	ZINC000341608378	155380635	/nfs/dbraw/zinc/38/06/35/155380635.db2.gz	NSLRYTFEVBBKOK-SFHVURJKSA-N	0	3	339.464	3.313	20	30		EGEDHN
C[C@@H]1CCN(C)CCN1C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1	ZINC000345441398	156106525	/nfs/dbraw/zinc/10/65/25/156106525.db2.gz	OXABVZOAMJAGMT-LLVKDONJSA-N	0	3	340.349	3.135	20	30		EGEDHN
C[C@H](CNc1c(C#N)nnc2ccccc21)N(C)Cc1ccccc1	ZINC000354354479	166007985	/nfs/dbraw/zinc/00/79/85/166007985.db2.gz	PSLVSAAYUGLCGK-OAHLLOKOSA-N	0	3	331.423	3.434	20	30		EGEDHN
N#Cc1ccc(S(=O)(=O)CCN[C@H](c2cccs2)C2CC2)cc1	ZINC000342472766	163888927	/nfs/dbraw/zinc/88/89/27/163888927.db2.gz	RMQWSIPCIIQFHC-KRWDZBQOSA-N	0	3	346.477	3.134	20	30		EGEDHN
Cc1cc(C#N)ccc1Oc1ccc(C(=O)N[C@H](C)CN(C)C)cc1	ZINC000346164920	164354565	/nfs/dbraw/zinc/35/45/65/164354565.db2.gz	QKUMJQFUBXXDMH-OAHLLOKOSA-N	0	3	337.423	3.339	20	30		EGEDHN
C[C@H](CN(C)C)NC(=O)c1ccc(Sc2ccccc2C#N)cc1	ZINC000346235932	164361268	/nfs/dbraw/zinc/36/12/68/164361268.db2.gz	YLWUCGAXLPPYFW-CQSZACIVSA-N	0	3	339.464	3.389	20	30		EGEDHN
N#Cc1c(CN2CCCN3c4ccccc4C[C@@H]3C2)cn2ccccc12	ZINC000351998692	165186927	/nfs/dbraw/zinc/18/69/27/165186927.db2.gz	XRSCKVPTAHJFJV-LJQANCHMSA-N	0	3	342.446	3.448	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)CCCC(F)(F)F	ZINC000355967022	166362674	/nfs/dbraw/zinc/36/26/74/166362674.db2.gz	QGBJIAAZDQQXTF-UHFFFAOYSA-N	0	3	341.377	3.181	20	30		EGEDHN
Cc1nc(NC[C@@H](Cc2ccccc2)N(C)C)c(Cl)cc1C#N	ZINC000359847536	167247881	/nfs/dbraw/zinc/24/78/81/167247881.db2.gz	XAPWYEWAMXFHRE-MRXNPFEDSA-N	0	3	328.847	3.500	20	30		EGEDHN
N#Cc1cccc(NC(=O)CN[C@@H](c2ccccc2)C2CCOCC2)c1	ZINC000367723534	168262944	/nfs/dbraw/zinc/26/29/44/168262944.db2.gz	MJNLJTMXPSVDCQ-NRFANRHFSA-N	0	3	349.434	3.254	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)NCc2cccc(C#N)c2)CN1Cc1ccccc1	ZINC000123089981	222214562	/nfs/dbraw/zinc/21/45/62/222214562.db2.gz	XPHVBZGGZZMZFI-OXQOHEQNSA-N	0	3	348.450	3.020	20	30		EGEDHN
Cc1nc(C(=O)Nc2ccccc2NC2CCN(C)CC2)ccc1C#N	ZINC000171543326	227131362	/nfs/dbraw/zinc/13/13/62/227131362.db2.gz	GKMVQVTVKSOZLQ-UHFFFAOYSA-N	0	3	349.438	3.020	20	30		EGEDHN
Cc1ccc(C)c(OC[C@@H](O)CNCc2ccc(C#N)s2)c1C	ZINC000515347799	269917110	/nfs/dbraw/zinc/91/71/10/269917110.db2.gz	NNIGAQWKRMWPRC-HNNXBMFYSA-N	0	3	330.453	3.075	20	30		EGEDHN
Cc1ccccc1O[C@@H](C)CNC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000280212211	269920700	/nfs/dbraw/zinc/92/07/00/269920700.db2.gz	AENLCMKDFVEROW-LPHOPBHVSA-N	0	3	347.418	3.133	20	30		EGEDHN
N#Cc1ccc(Br)c(CN[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)c1	ZINC000296221301	269956620	/nfs/dbraw/zinc/95/66/20/269956620.db2.gz	WXDPQQKKJFRZBK-BMFZPTHFSA-N	0	3	347.256	3.368	20	30		EGEDHN
N#Cc1ccc(CN[C@H]([C@H](CO)C2CC2)C2CC2)c(Br)c1	ZINC000451611660	269962049	/nfs/dbraw/zinc/96/20/49/269962049.db2.gz	LQERDHGXPGZBDD-WBVHZDCISA-N	0	3	349.272	3.207	20	30		EGEDHN
Cc1cc(C)cc(OCCNC(=O)C(C#N)Cc2ccc(C#N)cc2)c1	ZINC000279446196	270040037	/nfs/dbraw/zinc/04/00/37/270040037.db2.gz	ZBRBYGMABPPSKR-LJQANCHMSA-N	0	3	347.418	3.053	20	30		EGEDHN
CN(C)CCOc1cc(CNc2cccc(Cl)c2C#N)ccn1	ZINC000297616429	270043032	/nfs/dbraw/zinc/04/30/32/270043032.db2.gz	WCWDCOYQZLQERW-UHFFFAOYSA-N	0	3	330.819	3.159	20	30		EGEDHN
CC#CCN(C)CCC(=O)Nc1sc2c(c1C#N)CC[C@@H](C)C2	ZINC000411775087	270046890	/nfs/dbraw/zinc/04/68/90/270046890.db2.gz	WVYPMLLHZAINRU-CYBMUJFWSA-N	0	3	329.469	3.028	20	30		EGEDHN
C#CCNC(=O)CCN[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000491164753	270057651	/nfs/dbraw/zinc/05/76/51/270057651.db2.gz	FKKSJUVXLVDNDU-INIZCTEOSA-N	0	3	331.419	3.015	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)c2ccc(F)c(C#N)c2)N(C)C)cc1	ZINC000468968303	270055247	/nfs/dbraw/zinc/05/52/47/270055247.db2.gz	MKABLYUJXYMNFG-IBGZPJMESA-N	0	3	339.414	3.292	20	30		EGEDHN
Cc1ccc(-c2ccc([C@H](C)N3CCN(CCO)CC3)cc2)c(C#N)c1	ZINC000527588173	270059498	/nfs/dbraw/zinc/05/94/98/270059498.db2.gz	OPTIQRPOYUVRCU-SFHVURJKSA-N	0	3	349.478	3.205	20	30		EGEDHN
Cc1cc(C#N)cc(NC(=O)NC[C@@H]2CCN2C2CCCCC2)c1	ZINC000529118285	270059853	/nfs/dbraw/zinc/05/98/53/270059853.db2.gz	ZCKKVNROSJRSDU-SFHVURJKSA-N	0	3	326.444	3.395	20	30		EGEDHN
CCC1(CC)[C@H](NCC(=O)Nc2oc(C)c(C)c2C#N)[C@@H](C)[C@@H]1OC	ZINC000191397539	266012669	/nfs/dbraw/zinc/01/26/69/266012669.db2.gz	OSZCQMWDCCXNPE-JLZZUVOBSA-N	0	3	347.459	3.136	20	30		EGEDHN
CCC1(CC)[C@H](NCC(=O)Nc2sc(C)c(C)c2C#N)C[C@H]1OC	ZINC000191374851	266013612	/nfs/dbraw/zinc/01/36/12/266013612.db2.gz	AYGDGLKRPGORLA-HUUCEWRRSA-N	0	3	349.500	3.358	20	30		EGEDHN
CCN(Cc1ccc2c(c1)NC(=O)CO2)[C@H](C)c1ccc(C#N)cc1	ZINC000295427593	266135628	/nfs/dbraw/zinc/13/56/28/266135628.db2.gz	SUPVCYHRNHAOAU-CQSZACIVSA-N	0	3	335.407	3.472	20	30		EGEDHN
CC(C)(CNC(=O)Cc1ccc(C#N)cc1)N1CCc2ccccc2C1	ZINC000194732998	266140611	/nfs/dbraw/zinc/14/06/11/266140611.db2.gz	UUFBBNWEFNRFHX-UHFFFAOYSA-N	0	3	347.462	3.054	20	30		EGEDHN
CCOC(=O)N1CCC([C@@H](C)NCc2ccc(C#N)cc2F)CC1	ZINC000189362235	266258579	/nfs/dbraw/zinc/25/85/79/266258579.db2.gz	RZWHMOFIGKFUEU-CYBMUJFWSA-N	0	3	333.407	3.044	20	30		EGEDHN
COc1ccc(COCCCNCc2ccc(C#N)cc2F)cc1	ZINC000269391948	266287222	/nfs/dbraw/zinc/28/72/22/266287222.db2.gz	DAFROLKSPUNFEG-UHFFFAOYSA-N	0	3	328.387	3.402	20	30		EGEDHN
CC(C)(C)O[C@@H]1C[C@@H](NCc2ccc(C#N)c(F)c2)[C@@H]1n1cccn1	ZINC000421374198	266873170	/nfs/dbraw/zinc/87/31/70/266873170.db2.gz	BHROPADFSHXWMR-KURKYZTESA-N	0	3	342.418	3.181	20	30		EGEDHN
C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)C(C)(C)c1cc(F)cc(C#N)c1	ZINC000288560618	267089669	/nfs/dbraw/zinc/08/96/69/267089669.db2.gz	WFDJFESZDCOZGH-KDOFPFPSSA-N	0	3	343.446	3.060	20	30		EGEDHN
CCO[C@@H]1CCCC[C@H]1NCC(=O)Nc1cc(Cl)ccc1C#N	ZINC000452033806	267146058	/nfs/dbraw/zinc/14/60/58/267146058.db2.gz	HXGFPTWJUXDTCT-GDBMZVCRSA-N	0	3	335.835	3.087	20	30		EGEDHN
C[C@H](CNC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)N(C)C	ZINC000299171300	267159464	/nfs/dbraw/zinc/15/94/64/267159464.db2.gz	JGQKLUVAVALWPK-CQSZACIVSA-N	0	3	338.411	3.422	20	30		EGEDHN
C[C@H](NCCn1cc(Br)cn1)c1ccc(C#N)c(F)c1	ZINC000285646368	267183934	/nfs/dbraw/zinc/18/39/34/267183934.db2.gz	LHZYFKFEHKWQDJ-JTQLQIEISA-N	0	3	337.196	3.007	20	30		EGEDHN
CC(C)O[C@@H]1C[C@H](N[C@H](C)C(=O)Nc2ccccc2C#N)C1(C)C	ZINC000274206608	267197926	/nfs/dbraw/zinc/19/79/26/267197926.db2.gz	OERIYPGPXJYGEH-XOKHGSTOSA-N	0	3	329.444	3.067	20	30		EGEDHN
CC[C@H](N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O)c1ccncc1	ZINC000453200733	267223343	/nfs/dbraw/zinc/22/33/43/267223343.db2.gz	VSNRGZNDVKIIOF-OALUTQOASA-N	0	3	334.423	3.190	20	30		EGEDHN
C[C@H]1CN(CCC2CCN(c3ccc(C#N)cc3F)CC2)C[C@H](C)O1	ZINC000301512263	267230427	/nfs/dbraw/zinc/23/04/27/267230427.db2.gz	BAXORMRITDAJHT-HOTGVXAUSA-N	0	3	345.462	3.413	20	30		EGEDHN
CC[C@](CNCc1ccc(C#N)c(F)c1)(C(=O)OC)c1ccccc1	ZINC000421389754	267240145	/nfs/dbraw/zinc/24/01/45/267240145.db2.gz	YIGPVSWCBCRERO-HXUWFJFHSA-N	0	3	340.398	3.308	20	30		EGEDHN
CN(CC(=O)NCc1ccc(C#N)cc1)[C@H]1CCC[C@@H]1C(C)(C)C	ZINC000419327228	267297806	/nfs/dbraw/zinc/29/78/06/267297806.db2.gz	NMSBQHQHDSEDDQ-ROUUACIJSA-N	0	3	327.472	3.321	20	30		EGEDHN
CN(CCC(=O)Nc1sccc1C#N)[C@@H](CCO)c1ccccc1	ZINC000441400648	267304195	/nfs/dbraw/zinc/30/41/95/267304195.db2.gz	AHRGSBBRJYUTQL-INIZCTEOSA-N	0	3	343.452	3.004	20	30		EGEDHN
CN(C[C@H]1CCCN1C)C(=O)Nc1ccc(OC(C)(C)C)c(C#N)c1	ZINC000421111472	267309506	/nfs/dbraw/zinc/30/95/06/267309506.db2.gz	KKAQZHHXQRTSAQ-MRXNPFEDSA-N	0	3	344.459	3.293	20	30		EGEDHN
Cc1cc(F)cc2c1ncc(C#N)c2N1CCN(c2ccncc2)CC1	ZINC000301355875	267329344	/nfs/dbraw/zinc/32/93/44/267329344.db2.gz	ONHHTYQWWMBZHI-UHFFFAOYSA-N	0	3	347.397	3.276	20	30		EGEDHN
CN1CCCC(C)(C)[C@H]1CNC(=O)Nc1cc(C#N)cn1C(C)(C)C	ZINC000447893669	267334657	/nfs/dbraw/zinc/33/46/57/267334657.db2.gz	PCKUBZWMBTUXBI-OAHLLOKOSA-N	0	3	345.491	3.357	20	30		EGEDHN
CNCc1cccc(NC(=O)N(Cc2ccc(C#N)cc2)C2CC2)c1	ZINC000415938074	267350014	/nfs/dbraw/zinc/35/00/14/267350014.db2.gz	YDALJPDYFKVYAN-UHFFFAOYSA-N	0	3	334.423	3.474	20	30		EGEDHN
COC(=O)[C@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1c1ccccc1	ZINC000452007332	267387791	/nfs/dbraw/zinc/38/77/91/267387791.db2.gz	QFXFYTNJKSUSHC-ROUUACIJSA-N	0	3	338.382	3.086	20	30		EGEDHN
C[C@H](NCC(=O)NCc1cccc(C#N)c1)c1ccc(C2CC2)cc1	ZINC000419335990	267852449	/nfs/dbraw/zinc/85/24/49/267852449.db2.gz	IELMOPMQKUZSGY-HNNXBMFYSA-N	0	3	333.435	3.403	20	30		EGEDHN
N#Cc1ccc(CC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1	ZINC000194728612	268058743	/nfs/dbraw/zinc/05/87/43/268058743.db2.gz	WKQFKJAKYUJTKX-FQEVSTJZSA-N	0	3	333.435	3.054	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@H]2CSc3ccccc32)cc1	ZINC000348294156	268086831	/nfs/dbraw/zinc/08/68/31/268086831.db2.gz	QJWWOHOPKHPPOH-RDJZCZTQSA-N	0	3	333.416	3.204	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCC2(c3ccc(F)cc3)CC2)cc1	ZINC000279244849	268090154	/nfs/dbraw/zinc/09/01/54/268090154.db2.gz	GKHIZLCOKSTNBT-QGZVFWFLSA-N	0	3	347.393	3.228	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NC[C@H]2CCCCC2(F)F)cc1	ZINC000295335593	268091333	/nfs/dbraw/zinc/09/13/33/268091333.db2.gz	FJXWMIFSVMIJKC-HZPDHXFCSA-N	0	3	331.366	3.182	20	30		EGEDHN
N#Cc1ccc(OC2CCN(CC3CCC(=O)CC3)CC2)c(F)c1	ZINC000295421470	268167179	/nfs/dbraw/zinc/16/71/79/268167179.db2.gz	YFKLSDBSKHZRQZ-UHFFFAOYSA-N	0	3	330.403	3.300	20	30		EGEDHN
N#Cc1ccc(CNC(=O)CN2CCC[C@H]2CCc2ccccc2)cc1	ZINC000520168867	268226096	/nfs/dbraw/zinc/22/60/96/268226096.db2.gz	CLVKKGWEXDKTKK-NRFANRHFSA-N	0	3	347.462	3.272	20	30		EGEDHN
N#Cc1ccc(CNC[C@@]2(CO)C[C@H]2c2ccc(F)cc2)cc1F	ZINC000421391178	268233533	/nfs/dbraw/zinc/23/35/33/268233533.db2.gz	NBTBQRQLINRZJX-PKOBYXMFSA-N	0	3	328.362	3.092	20	30		EGEDHN
N#Cc1ccc(N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)c([N+](=O)[O-])c1	ZINC000425278206	268237054	/nfs/dbraw/zinc/23/70/54/268237054.db2.gz	RXNVBLSJUVOBFT-FXAWDEMLSA-N	0	3	348.406	3.177	20	30		EGEDHN
N#Cc1cccc(NC(=O)C2CCN(Cc3cccs3)CC2)c1	ZINC000271155776	268264239	/nfs/dbraw/zinc/26/42/39/268264239.db2.gz	HCMMABZONGJIJY-UHFFFAOYSA-N	0	3	325.437	3.470	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN2CCS[C@H]3CCCC[C@@H]32)c1	ZINC000333205395	268264517	/nfs/dbraw/zinc/26/45/17/268264517.db2.gz	AKTFOSUTGWGGSD-IRXDYDNUSA-N	0	3	329.469	3.247	20	30		EGEDHN
CC(C)(C)[C@@H](NCC(=O)N[C@](C)(C#N)C1CC1)c1ccc(F)cc1	ZINC000053644251	277227385	/nfs/dbraw/zinc/22/73/85/277227385.db2.gz	XKJTVDUDSUGVND-PKOBYXMFSA-N	0	3	331.435	3.311	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)c2cccc(C#N)c2C)N(C)C)cc1	ZINC000512342372	312183818	/nfs/dbraw/zinc/18/38/18/312183818.db2.gz	KMOSIWYVTHXXQR-FQEVSTJZSA-N	0	3	335.451	3.462	20	30		EGEDHN
C[C@]1(NCC(=O)NCc2cccc(C#N)c2)CCCc2ccccc21	ZINC000540907090	314414712	/nfs/dbraw/zinc/41/47/12/314414712.db2.gz	BEJNAMPVFORJKA-NRFANRHFSA-N	0	3	333.435	3.016	20	30		EGEDHN
CS(=O)(=O)[C@@H]1CCC[C@H](N[C@@H]2CCCCc3cc(C#N)ccc32)C1	ZINC000574858194	317643406	/nfs/dbraw/zinc/64/34/06/317643406.db2.gz	NWLLVXIWGPOEJZ-YQVWRLOYSA-N	0	3	346.496	3.271	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1Nc1nc2c(cc1C#N)CCC2	ZINC000389796983	324280400	/nfs/dbraw/zinc/28/04/00/324280400.db2.gz	UTWGQGPKXXLYJE-QRWLVFNGSA-N	0	3	332.451	3.374	20	30		EGEDHN
C[C@H](CNCc1cc(C#N)n(C)c1)Oc1cccc(Br)c1	ZINC000276726854	456562421	/nfs/dbraw/zinc/56/24/21/456562421.db2.gz	CHJGKTIBXKLBGZ-GFCCVEGCSA-N	0	3	348.244	3.216	20	30		EGEDHN
CCN(C(=O)Nc1cccc(C#N)n1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000580443565	325251644	/nfs/dbraw/zinc/25/16/44/325251644.db2.gz	ZZPAXHCROCFOIW-SFHVURJKSA-N	0	3	349.438	3.082	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)COc2ccc(OCCC)cc2)CC1	ZINC000264514223	455227377	/nfs/dbraw/zinc/22/73/77/455227377.db2.gz	UWKAVLQVYPSPJP-UHFFFAOYSA-N	0	3	346.471	3.011	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H]2SCCc3ccccc32)CC1	ZINC000173102327	455231599	/nfs/dbraw/zinc/23/15/99/455231599.db2.gz	WMSANNPEULHDRZ-SFHVURJKSA-N	0	3	330.497	3.174	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)N[C@@H](C)c1cccc(-n2cccn2)c1	ZINC000173202760	455247135	/nfs/dbraw/zinc/24/71/35/455247135.db2.gz	SFBCQWGXJUEZOS-IRXDYDNUSA-N	0	3	338.455	3.112	20	30		EGEDHN
C=CCCSCCN[C@H](C)CS(=O)(=O)c1ccc(C)cc1	ZINC000595061057	459231364	/nfs/dbraw/zinc/23/13/64/459231364.db2.gz	XUXKNWHMZMHHSR-OAHLLOKOSA-N	0	3	327.515	3.056	20	30		EGEDHN
N#Cc1ccc(OCCN2CC[C@@H](Oc3cccc(F)c3)C2)cc1	ZINC000612174623	460561661	/nfs/dbraw/zinc/56/16/61/460561661.db2.gz	RAGQNKYHVJUWKL-LJQANCHMSA-N	0	3	326.371	3.229	20	30		EGEDHN
OCC[C@H]1CCCCN1CC#Cc1ccc(OC(F)(F)F)cc1	ZINC000158465940	455305989	/nfs/dbraw/zinc/30/59/89/455305989.db2.gz	BHSREENRCAKUAW-OAHLLOKOSA-N	0	3	327.346	3.174	20	30		EGEDHN
Cc1ccc(CCN(Cc2ccco2)C(=O)[C@H](N)CCCC#N)cc1	ZINC000600756684	460592422	/nfs/dbraw/zinc/59/24/22/460592422.db2.gz	NRUKXKAHYXWOFI-LJQANCHMSA-N	0	3	339.439	3.181	20	30		EGEDHN
COc1ccc([C@H](NC(=O)C(C#N)CCc2ccccc2)C2CC2)cn1	ZINC000600811165	460612239	/nfs/dbraw/zinc/61/22/39/460612239.db2.gz	CDDPYGIKISYVRF-YLJYHZDGSA-N	0	3	349.434	3.430	20	30		EGEDHN
C[C@@H](NC[C@@H](O)COc1ccc(C#N)cc1)c1ccc(Cl)cc1	ZINC000023410140	453710066	/nfs/dbraw/zinc/71/00/66/453710066.db2.gz	WZRTZXXLUFGPCL-CXAGYDPISA-N	0	3	330.815	3.302	20	30		EGEDHN
Cc1cc(N2CCN(C(C)C)CC2)n2c3ccccc3nc2c1C#N	ZINC000026712507	453804180	/nfs/dbraw/zinc/80/41/80/453804180.db2.gz	HDYMXFVCNIDMRK-UHFFFAOYSA-N	0	3	333.439	3.198	20	30		EGEDHN
COc1cccc2c1OCC(C(=O)C(C#N)c1nc3ccccc3o1)=C2	ZINC000075126773	453864188	/nfs/dbraw/zinc/86/41/88/453864188.db2.gz	AKDWJUVBTDCOFH-CQSZACIVSA-N	0	3	346.342	3.489	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccccc1Sc1ccccc1C#N)N(C)C	ZINC000032170527	453865556	/nfs/dbraw/zinc/86/55/56/453865556.db2.gz	NRGTXENKBHEHFC-AWEZNQCLSA-N	0	3	339.464	3.389	20	30		EGEDHN
COc1cccc([C@H](CNc2ccc(C#N)cc2[N+](=O)[O-])N(C)C)c1	ZINC000032534034	453877834	/nfs/dbraw/zinc/87/78/34/453877834.db2.gz	PQAFAIWCOCVSSF-SFHVURJKSA-N	0	3	340.383	3.190	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN1CCC[C@H]1c1cccc(N(C)C)c1	ZINC000075838509	453930786	/nfs/dbraw/zinc/93/07/86/453930786.db2.gz	VQXNAJXTNHCRMN-IBGZPJMESA-N	0	3	327.472	3.090	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)c2cccc(Nc3ncccn3)c2)n1	ZINC000041516058	453969976	/nfs/dbraw/zinc/96/99/76/453969976.db2.gz	GQHLYRVKOAKLJU-AWEZNQCLSA-N	0	3	335.392	3.475	20	30		EGEDHN
CN(C)CCN(Cc1cccs1)C(=O)CCc1ccc(C#N)cc1	ZINC000084250534	453979738	/nfs/dbraw/zinc/97/97/38/453979738.db2.gz	AGRUAIQXSCKHKR-UHFFFAOYSA-N	0	3	341.480	3.143	20	30		EGEDHN
C[C@H](N[C@@H]1CCN(c2ncccc2F)C1)c1ccc(OCC#N)cc1	ZINC000181884869	455393942	/nfs/dbraw/zinc/39/39/42/455393942.db2.gz	MYHMYHHWFPMNQC-GOEBONIOSA-N	0	3	340.402	3.053	20	30		EGEDHN
N#Cc1cccc(CNc2cccc(CN3CCC(CO)CC3)c2)c1	ZINC000084363865	453985734	/nfs/dbraw/zinc/98/57/34/453985734.db2.gz	NLXQNBWUWVXYHA-UHFFFAOYSA-N	0	3	335.451	3.375	20	30		EGEDHN
COc1cc(OC)cc(OCCCN(C)Cc2cccc(C#N)c2)c1	ZINC000084865767	454013488	/nfs/dbraw/zinc/01/34/88/454013488.db2.gz	GTOVASOEQHGWSZ-UHFFFAOYSA-N	0	3	340.423	3.476	20	30		EGEDHN
C[C@@H]1CCCC[C@H]1NC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000043045889	454037721	/nfs/dbraw/zinc/03/77/21/454037721.db2.gz	XHHISRMLLGNMGO-VQIMIIECSA-N	0	3	342.487	3.210	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N(C)[C@H](C)c1cccnc1)C(C)C	ZINC000068583899	454039659	/nfs/dbraw/zinc/03/96/59/454039659.db2.gz	HCKAVNZJPISEMP-MJGOQNOKSA-N	0	3	344.503	3.483	20	30		EGEDHN
C=C(C)COc1cc(CNCCC(=O)N[C@@H](C)CC)ccc1OC	ZINC000057965146	454158648	/nfs/dbraw/zinc/15/86/48/454158648.db2.gz	WASGNHAPZQMZER-HNNXBMFYSA-N	0	3	334.460	3.045	20	30		EGEDHN
C#CCCCCC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C	ZINC000119500675	454200606	/nfs/dbraw/zinc/20/06/06/454200606.db2.gz	SWIYWRNKWICEAD-UHFFFAOYSA-N	0	3	327.472	3.269	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H]1CCN(c2snc(Cl)c2C#N)C1	ZINC000078506328	454266142	/nfs/dbraw/zinc/26/61/42/454266142.db2.gz	RTGZSHZHDZZNND-CYBMUJFWSA-N	0	3	332.860	3.379	20	30		EGEDHN
CN1CCC[C@@H]1CNC(=O)c1cccc(Nc2ccc(C#N)cc2)c1	ZINC000160133038	455432099	/nfs/dbraw/zinc/43/20/99/455432099.db2.gz	XZKPBGJFGWFZBS-LJQANCHMSA-N	0	3	334.423	3.126	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2cc(C3CC3)nc3ccccc32)CC1	ZINC000072293045	454288174	/nfs/dbraw/zinc/28/81/74/454288174.db2.gz	IWIGSQUKWIMMER-UHFFFAOYSA-N	0	3	347.462	3.330	20	30		EGEDHN
C[C@H]1CCCN(CCNC(=O)N[C@@H](CCC#N)c2ccccc2)C1	ZINC000131977132	454303627	/nfs/dbraw/zinc/30/36/27/454303627.db2.gz	XTKBUHQRVLZEDE-WMZOPIPTSA-N	0	3	328.460	3.063	20	30		EGEDHN
C#CCCOc1ccc(CN2CCC[C@@H](Cc3nccn3C)C2)cc1	ZINC000184732452	455438342	/nfs/dbraw/zinc/43/83/42/455438342.db2.gz	VOYVJWKJNBYTBH-IBGZPJMESA-N	0	3	337.467	3.277	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000132387324	454334059	/nfs/dbraw/zinc/33/40/59/454334059.db2.gz	MOQZOMVPZGBMTG-QWFCFKBJSA-N	0	3	344.499	3.479	20	30		EGEDHN
C=CCC[C@@H](CC)[NH2+]CC[N-]S(=O)(=O)c1ccc(Cl)s1	ZINC000090724823	454338991	/nfs/dbraw/zinc/33/89/91/454338991.db2.gz	IOWRWLGAGAOMOU-LLVKDONJSA-N	0	3	336.910	3.014	20	30		EGEDHN
Cc1n[nH]c(C)c1[C@@H]1CCCN1CCC(=O)Nc1sccc1C#N	ZINC000091081625	454378528	/nfs/dbraw/zinc/37/85/28/454378528.db2.gz	QWAKRLVBLRICID-AWEZNQCLSA-N	0	3	343.456	3.125	20	30		EGEDHN
Cn1cnc2cc(C(=O)C(C#N)c3ccc(C(F)(F)F)cn3)ccc21	ZINC000097038917	454393913	/nfs/dbraw/zinc/39/39/13/454393913.db2.gz	UICMQNCATFESQT-LBPRGKRZSA-N	0	3	344.296	3.477	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)C[C@@H](O)COc1ccc(C#N)cc1	ZINC000047739993	454404366	/nfs/dbraw/zinc/40/43/66/454404366.db2.gz	ABYNUBJMUGFQDK-HXUWFJFHSA-N	0	3	349.434	3.082	20	30		EGEDHN
CN(C)Cc1cccc(C(=O)Nc2ncccc2OCCCC#N)c1	ZINC000073287763	454417094	/nfs/dbraw/zinc/41/70/94/454417094.db2.gz	OSAOXAGLAHRARE-UHFFFAOYSA-N	0	3	338.411	3.078	20	30		EGEDHN
C=CCOc1ccc(CNCCNc2cccc(C)n2)cc1OC	ZINC000133473896	454429587	/nfs/dbraw/zinc/42/95/87/454429587.db2.gz	BYJXIGJZVMQGJA-UHFFFAOYSA-N	0	3	327.428	3.165	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)CNC1(c2ccccc2)CCCCC1	ZINC000134032886	454496272	/nfs/dbraw/zinc/49/62/72/454496272.db2.gz	GMJMJQQYFSUOFW-IBGZPJMESA-N	0	3	327.472	3.490	20	30		EGEDHN
COCCSCC(=O)C(C#N)c1nc(-c2ccccc2)cs1	ZINC000073976757	454512040	/nfs/dbraw/zinc/51/20/40/454512040.db2.gz	ACOROKCYVSVESD-CYBMUJFWSA-N	0	3	332.450	3.366	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cc(C(C)(C)C)nn2C(C)(C)C)CC1	ZINC000122575050	454547887	/nfs/dbraw/zinc/54/78/87/454547887.db2.gz	GFHIKPOQHLDHPR-UHFFFAOYSA-N	0	3	344.503	3.219	20	30		EGEDHN
CCSCc1ccc(C(=O)C(C#N)C(=O)Nc2ccccn2)cc1	ZINC000104055597	454572316	/nfs/dbraw/zinc/57/23/16/454572316.db2.gz	VXWMYSIXRGURHM-HNNXBMFYSA-N	0	3	339.420	3.296	20	30		EGEDHN
C=CCOc1cccc(CN2CCC(OC[C@@H]3CCCO3)CC2)c1	ZINC000122970045	454588050	/nfs/dbraw/zinc/58/80/50/454588050.db2.gz	MYVIXRHJEQKIGG-FQEVSTJZSA-N	0	3	331.456	3.411	20	30		EGEDHN
N#Cc1cccc(OC2CCN(CCC(=O)Nc3ccccc3)CC2)c1	ZINC000104713556	454598436	/nfs/dbraw/zinc/59/84/36/454598436.db2.gz	SECVNQGPVDUAMZ-UHFFFAOYSA-N	0	3	349.434	3.430	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)N1CCC(COc2ccccc2)CC1	ZINC000065612979	454604656	/nfs/dbraw/zinc/60/46/56/454604656.db2.gz	QCUZUMKEIWZIMN-SFHVURJKSA-N	0	3	342.483	3.367	20	30		EGEDHN
N#CC(C(=O)c1cccc2c1OCCO2)c1ccc(C(F)(F)F)cn1	ZINC000065647953	454608533	/nfs/dbraw/zinc/60/85/33/454608533.db2.gz	BYQZBELDWSRIIT-LBPRGKRZSA-N	0	3	348.280	3.362	20	30		EGEDHN
N#CCSCCCN(Cc1ccc(C(=O)NC2CC2)cc1)C1CC1	ZINC000080632506	454609751	/nfs/dbraw/zinc/60/97/51/454609751.db2.gz	OWVODDVLNXRDLJ-UHFFFAOYSA-N	0	3	343.496	3.190	20	30		EGEDHN
CCC[C@@H](C)NC(=O)[C@@H]1CCCN(Cc2ccc(OC)c(C#N)c2)C1	ZINC000135013662	454624197	/nfs/dbraw/zinc/62/41/97/454624197.db2.gz	HSUANRCILBDRGB-NVXWUHKLSA-N	0	3	343.471	3.084	20	30		EGEDHN
C[C@@H](CO)CSCC(=O)C(C#N)c1nc(-c2ccccc2)cs1	ZINC000074787370	454635821	/nfs/dbraw/zinc/63/58/21/454635821.db2.gz	YOGQXTOJHIFKRB-JSGCOSHPSA-N	0	3	346.477	3.348	20	30		EGEDHN
CCCCS[C@@H](C)C(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000065930254	454640659	/nfs/dbraw/zinc/64/06/59/454640659.db2.gz	DYUAHBIWJQKGMY-INIZCTEOSA-N	0	3	347.528	3.370	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CSc2ccc(OCC)cc2)CC1	ZINC000106039173	454675570	/nfs/dbraw/zinc/67/55/70/454675570.db2.gz	AZPLTRQPJBANNF-UHFFFAOYSA-N	0	3	348.512	3.334	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])CC1	ZINC000106038707	454675704	/nfs/dbraw/zinc/67/57/04/454675704.db2.gz	SYAKZKYIJHWAJW-UHFFFAOYSA-N	0	3	337.807	3.019	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Cc2ccc3c(c2)CCCC3)CC1	ZINC000106040762	454676074	/nfs/dbraw/zinc/67/60/74/454676074.db2.gz	FBOMYFQBKXHHCX-UHFFFAOYSA-N	0	3	326.484	3.265	20	30		EGEDHN
COc1ccc(CN2CC[C@@H]3OCCC[C@@H]3C2)cc1OCCCC#N	ZINC000093507164	454719489	/nfs/dbraw/zinc/71/94/89/454719489.db2.gz	GVINYLXQBXITAT-MSOLQXFVSA-N	0	3	344.455	3.379	20	30		EGEDHN
Cn1cc(C[C@@H]2CCN(Cc3cccc(OCCCC#N)c3)C2)cn1	ZINC000093870136	454743639	/nfs/dbraw/zinc/74/36/39/454743639.db2.gz	GNHMRPURCSSWEZ-SFHVURJKSA-N	0	3	338.455	3.167	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](CC)CCc2ccccc2)CC1	ZINC000623635086	460651833	/nfs/dbraw/zinc/65/18/33/460651833.db2.gz	UHLHWYGDSAVTSD-SFHVURJKSA-N	0	3	329.488	3.347	20	30		EGEDHN
CC[C@H](NCc1ccc(C#N)cc1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000153655175	454818238	/nfs/dbraw/zinc/81/82/38/454818238.db2.gz	TUFFSOYYLYGQKU-FCHUYYIVSA-N	0	3	349.478	3.327	20	30		EGEDHN
Cc1cccc([C@@H]2CCCN2CCC(=O)Nc2ccc(C#N)cc2)n1	ZINC000140286239	454818448	/nfs/dbraw/zinc/81/84/48/454818448.db2.gz	ULEHCKRSFIEFOR-IBGZPJMESA-N	0	3	334.423	3.427	20	30		EGEDHN
CC[C@@H](NCCS(=O)(=O)c1cccc(C#N)c1)c1cccs1	ZINC000163149925	454826326	/nfs/dbraw/zinc/82/63/26/454826326.db2.gz	OZBMYWGZASWYDE-OAHLLOKOSA-N	0	3	334.466	3.134	20	30		EGEDHN
C=CCOc1ccc(-c2nnc(SC[C@H]3CCN(C)C3)o2)cc1	ZINC000191202599	455464028	/nfs/dbraw/zinc/46/40/28/455464028.db2.gz	CFDOHMSZZPFZLR-ZDUSSCGKSA-N	0	3	331.441	3.345	20	30		EGEDHN
N#CC(=C([O-])c1cnn2c1CCCC2)c1ccc(C(F)(F)F)cn1	ZINC000125580998	454832924	/nfs/dbraw/zinc/83/29/24/454832924.db2.gz	QNECCTQXPORKCD-NSHDSACASA-N	0	3	334.301	3.123	20	30		EGEDHN
N#CC(C(=O)c1cnn2c1CCCC2)c1ccc(C(F)(F)F)cn1	ZINC000125580998	454832927	/nfs/dbraw/zinc/83/29/27/454832927.db2.gz	QNECCTQXPORKCD-NSHDSACASA-N	0	3	334.301	3.123	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)c1cc(C#N)cs1)c1ccsc1	ZINC000177422880	454862698	/nfs/dbraw/zinc/86/26/98/454862698.db2.gz	WEZSQEWFTUTBKS-AWEZNQCLSA-N	0	3	333.482	3.494	20	30		EGEDHN
C#CCOc1ccccc1CNCCCC(=O)N1Cc2ccccc2C1	ZINC000111405893	454863818	/nfs/dbraw/zinc/86/38/18/454863818.db2.gz	HNPFWFPYACTKII-UHFFFAOYSA-N	0	3	348.446	3.111	20	30		EGEDHN
C[C@@H](N[C@@H](C)C(=O)NC1(C#N)CCCCC1)[C@@H](C)c1ccccc1	ZINC000177481711	454868891	/nfs/dbraw/zinc/86/88/91/454868891.db2.gz	VASGPOWVADEIQG-ZACQAIPSSA-N	0	3	327.472	3.499	20	30		EGEDHN
C#CCN1CCC(C(=O)NCc2ccc(C)cc2O[C@H](C)CC)CC1	ZINC000151022948	454926297	/nfs/dbraw/zinc/92/62/97/454926297.db2.gz	SRSCXPVDXLZYSO-QGZVFWFLSA-N	0	3	342.483	3.134	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cccc(Br)c2C)CC1	ZINC000170708979	454961765	/nfs/dbraw/zinc/96/17/65/454961765.db2.gz	YUGREEGQDICQJE-UHFFFAOYSA-N	0	3	335.245	3.041	20	30		EGEDHN
COCc1ccc(CN[C@@H]2CCCN(c3ccc(C#N)cc3F)C2)o1	ZINC000127614454	454981480	/nfs/dbraw/zinc/98/14/80/454981480.db2.gz	OSBBVUDVBSWAGY-OAHLLOKOSA-N	0	3	343.402	3.195	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](C2CCCC2)C(F)(F)F)CC1	ZINC000155272682	454982050	/nfs/dbraw/zinc/98/20/50/454982050.db2.gz	ZUNKCWCOECBTIT-OAHLLOKOSA-N	0	3	347.425	3.447	20	30		EGEDHN
CCO[C@@H]1CCCN(Cc2ccc(OC)c(OCCCC#N)c2)C1	ZINC000155458021	455003696	/nfs/dbraw/zinc/00/36/96/455003696.db2.gz	LWGHZYKXMOBBNR-QGZVFWFLSA-N	0	3	332.444	3.379	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cc(F)c(OC)cc2F)CC1	ZINC000156124582	455083429	/nfs/dbraw/zinc/08/34/29/455083429.db2.gz	SEXUTOSLSGUNDG-UHFFFAOYSA-N	0	3	339.386	3.135	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(-c3ccc(Cl)cc3)n[nH]2)CC1	ZINC000171721063	455088739	/nfs/dbraw/zinc/08/87/39/455088739.db2.gz	LCUHWQOUJDRYPF-UHFFFAOYSA-N	0	3	344.846	3.110	20	30		EGEDHN
Cc1ccccc1[C@@H](NCC(=O)N[C@@](C)(C#N)C1CC1)C(C)(C)C	ZINC000180084515	455129550	/nfs/dbraw/zinc/12/95/50/455129550.db2.gz	ZPTCFQFTLRIMOM-QUCCMNQESA-N	0	3	327.472	3.480	20	30		EGEDHN
CSC[C@H]1CCCN1Cc1cn(C)nc1-c1ccc(C#N)cc1	ZINC000180219685	455149267	/nfs/dbraw/zinc/14/92/67/455149267.db2.gz	WWQCGODUQKVKPA-QGZVFWFLSA-N	0	3	326.469	3.286	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](CC)c2ccc(F)cc2F)CC1	ZINC000172384070	455150234	/nfs/dbraw/zinc/15/02/34/455150234.db2.gz	HAKZNVLEHQTSPL-QGZVFWFLSA-N	0	3	337.414	3.366	20	30		EGEDHN
N#Cc1ccc(SCC(=O)N2CCCN(C3CCCC3)CC2)cc1	ZINC000172422670	455153333	/nfs/dbraw/zinc/15/33/33/455153333.db2.gz	WQABELDVQNEFMI-UHFFFAOYSA-N	0	3	343.496	3.127	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](C)c2c(F)cccc2F)CC1	ZINC000264375743	455200842	/nfs/dbraw/zinc/20/08/42/455200842.db2.gz	KECDKXHNLAFWMW-CYBMUJFWSA-N	0	3	337.414	3.366	20	30		EGEDHN
Cc1nc(C)c([C@@H](C)N(C)C[C@H](O)COc2ccc(C#N)cc2)s1	ZINC000264398462	455205747	/nfs/dbraw/zinc/20/57/47/455205747.db2.gz	HBQYMNVDGDUWNS-CJNGLKHVSA-N	0	3	345.468	3.064	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](C)COc2cccc(C)c2)CC1	ZINC000264416921	455209097	/nfs/dbraw/zinc/20/90/97/455209097.db2.gz	VJHZFJIYBAYDLC-KRWDZBQOSA-N	0	3	345.487	3.102	20	30		EGEDHN
CN(CCN1CCCC1)C(=O)c1cccc(Nc2ccc(C#N)cc2)c1	ZINC000158814027	455330460	/nfs/dbraw/zinc/33/04/60/455330460.db2.gz	UJUOQBZSRKXYQK-UHFFFAOYSA-N	0	3	348.450	3.470	20	30		EGEDHN
CC[C@H](N[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O)c1ccccc1	ZINC000190615859	455354728	/nfs/dbraw/zinc/35/47/28/455354728.db2.gz	GRICTZMHZMBZSX-VQTJNVASSA-N	0	3	333.435	3.400	20	30		EGEDHN
Cc1ccccc1C[C@H](C)N[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000190626064	455355704	/nfs/dbraw/zinc/35/57/04/455355704.db2.gz	BJANWHQEERHHGU-UWJYYQICSA-N	0	3	347.462	3.188	20	30		EGEDHN
C[C@H](NCCC(=O)N1CCCCCC1)c1ccc(OCC#N)cc1	ZINC000181634214	455366612	/nfs/dbraw/zinc/36/66/12/455366612.db2.gz	OZLPEBNVVLQATQ-INIZCTEOSA-N	0	3	329.444	3.032	20	30		EGEDHN
C[C@H](CN1CCC[C@H](C)C1)NC(=O)Nc1ccccc1O[C@@H](C)C#N	ZINC000184335886	455372322	/nfs/dbraw/zinc/37/23/22/455372322.db2.gz	URWDXJCSTBUDRK-XHSDSOJGSA-N	0	3	344.459	3.219	20	30		EGEDHN
COc1ccc([C@@H](CCO)N[C@H](C)c2ccc(OCC#N)cc2)cc1	ZINC000181911547	455398871	/nfs/dbraw/zinc/39/88/71/455398871.db2.gz	RELYYPIBWOGUJT-FOIQADDNSA-N	0	3	340.423	3.372	20	30		EGEDHN
CCN(CC)C(=O)C1(NCc2ccc(OCC#N)cc2)CCCCC1	ZINC000266017331	455421880	/nfs/dbraw/zinc/42/18/80/455421880.db2.gz	VDLJVAGTHNIYDA-UHFFFAOYSA-N	0	3	343.471	3.250	20	30		EGEDHN
CN(C)C[C@H](NC(=O)c1cccc(SCC#N)c1)c1ccccc1	ZINC000175546185	455461570	/nfs/dbraw/zinc/46/15/70/455461570.db2.gz	NXLXPFBYSTVHMZ-SFHVURJKSA-N	0	3	339.464	3.335	20	30		EGEDHN
CN(CCC#N)C(=O)CCN[C@@H](Cc1ccccc1)c1cccs1	ZINC000184987685	455482917	/nfs/dbraw/zinc/48/29/17/455482917.db2.gz	JOPOTBWXTUIERS-KRWDZBQOSA-N	0	3	341.480	3.384	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CN2CCSC3(CCCCC3)C2)cc1	ZINC000175968288	455521909	/nfs/dbraw/zinc/52/19/09/455521909.db2.gz	YCDXHMWWGKWSAS-KRWDZBQOSA-N	0	3	346.496	3.050	20	30		EGEDHN
C[C@H]1CN(CC(=O)N(CCC#N)c2ccccc2)[C@H]2CCCC[C@H]12	ZINC000182489822	455523748	/nfs/dbraw/zinc/52/37/48/455523748.db2.gz	QGNFIPSTDRKGFB-UHOSZYNNSA-N	0	3	325.456	3.444	20	30		EGEDHN
N#C[C@H](NC(=O)C1CCN(Cc2ccccc2)CC1)C1CCCCC1	ZINC000267277597	455529974	/nfs/dbraw/zinc/52/99/74/455529974.db2.gz	REGGSAWGJPLDHX-FQEVSTJZSA-N	0	3	339.483	3.487	20	30		EGEDHN
N#CCOc1ccc(CN2CCC(OC[C@H]3CCCCO3)CC2)cc1	ZINC000267344607	455543542	/nfs/dbraw/zinc/54/35/42/455543542.db2.gz	DIMXZBJAYWXYPL-HXUWFJFHSA-N	0	3	344.455	3.139	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@@H](C)N[C@H]1CCO[C@@H]1c1ccc(Cl)cc1	ZINC000192050946	455548145	/nfs/dbraw/zinc/54/81/45/455548145.db2.gz	QGZJWFAGESDVPQ-FHLIZLRMSA-N	0	3	348.874	3.349	20	30		EGEDHN
N#C[C@H]1CCC[C@@H](NCc2cc3c(c(Br)c2)OCO3)C1	ZINC000185882383	455642338	/nfs/dbraw/zinc/64/23/38/455642338.db2.gz	HGIBKJPYAGJJPJ-CMPLNLGQSA-N	0	3	337.217	3.350	20	30		EGEDHN
C#CCC(C)(C)C(=O)N(C)CCC1CCN(c2ccncc2)CC1	ZINC000185982787	455667568	/nfs/dbraw/zinc/66/75/68/455667568.db2.gz	PYAIINXLFLTQST-UHFFFAOYSA-N	0	3	327.472	3.196	20	30		EGEDHN
C[C@@H](NC[C@H](O)COc1cccc2[nH]ccc21)c1ccc(C#N)cc1	ZINC000268462245	455689594	/nfs/dbraw/zinc/68/95/94/455689594.db2.gz	UWWLGWDVDRVKJP-PBHICJAKSA-N	0	3	335.407	3.130	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCC(C(=O)N2CCC[C@@H](C)C2)CC1	ZINC000186170075	455708664	/nfs/dbraw/zinc/70/86/64/455708664.db2.gz	NQUQJSWUEISKMD-MRXNPFEDSA-N	0	3	339.483	3.337	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC[C@@H](c3ccc(CC)cc3)C2)CC1	ZINC000292604700	455709727	/nfs/dbraw/zinc/70/97/27/455709727.db2.gz	HOXKOLDXDFEUON-LJQANCHMSA-N	0	3	341.499	3.398	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCC[C@H](c2nnc3ccccn32)C1	ZINC000186236674	455723032	/nfs/dbraw/zinc/72/30/32/455723032.db2.gz	VAERVESMCGIMLY-SFHVURJKSA-N	0	3	331.423	3.289	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)CN1CCC[C@]1(C)Cc1ccccc1	ZINC000248623880	455723815	/nfs/dbraw/zinc/72/38/15/455723815.db2.gz	OFSWKEXLMWKOJD-UXHICEINSA-N	0	3	327.472	3.138	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(CN[C@@H]3CCC[C@@H](C#N)C3)cc2)C[C@H](C)O1	ZINC000248801463	455731610	/nfs/dbraw/zinc/73/16/10/455731610.db2.gz	JSNWOHOTYCJEJL-HRQSHJORSA-N	0	3	341.499	3.468	20	30		EGEDHN
CCN1CCO[C@@H](CN[C@@H]2CCC[C@H](C#N)C2)[C@@H]1c1ccccc1	ZINC000284751331	455736341	/nfs/dbraw/zinc/73/63/41/455736341.db2.gz	YVKPIZMJKYKVQM-RNQOJCNYSA-N	0	3	327.472	3.120	20	30		EGEDHN
N#C[C@@H]1CCC[C@H](Nc2cccc(CN3CCC(CO)CC3)c2)C1	ZINC000193101925	455741285	/nfs/dbraw/zinc/74/12/85/455741285.db2.gz	LKCLCDDWGOFMJX-MJGOQNOKSA-N	0	3	327.472	3.385	20	30		EGEDHN
CO/N=C/c1ccc(C(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)cc1	ZINC000186486342	455779634	/nfs/dbraw/zinc/77/96/34/455779634.db2.gz	HUQHYAUXSSXACS-KKFBNQRMSA-N	0	3	339.439	3.088	20	30		EGEDHN
C#CCCOc1ccc(CN2CC3(CCOCC3)[C@H]2C2CC2)cc1	ZINC000293543131	455789940	/nfs/dbraw/zinc/78/99/40/455789940.db2.gz	DAOWMRHJVWVXRP-HXUWFJFHSA-N	0	3	325.452	3.480	20	30		EGEDHN
COc1ccc(CN2CC[C@H](O)C23CCCC3)cc1OCCCC#N	ZINC000293783006	455797010	/nfs/dbraw/zinc/79/70/10/455797010.db2.gz	BYJFWZLQLPRYKV-IBGZPJMESA-N	0	3	344.455	3.257	20	30		EGEDHN
CC[C@H](NC[C@H](O)COc1ccc(F)cc1)c1ccc(C#N)cc1	ZINC000278253490	455799197	/nfs/dbraw/zinc/79/91/97/455799197.db2.gz	MTYBMCFKWORANA-HKUYNNGSSA-N	0	3	328.387	3.178	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1ccc(C(F)(F)F)cc1Cl	ZINC000294040139	455803719	/nfs/dbraw/zinc/80/37/19/455803719.db2.gz	SIPCXFYOBJGPPG-UHFFFAOYSA-N	0	3	332.753	3.044	20	30		EGEDHN
C=C[C@H](CC(=O)N1CCN(C2CCOCC2)C[C@@H]1C)c1ccccc1	ZINC000278342640	455823548	/nfs/dbraw/zinc/82/35/48/455823548.db2.gz	CHKQMNHUNZIUHV-ZWKOTPCHSA-N	0	3	342.483	3.058	20	30		EGEDHN
C=CCOCCCC(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C	ZINC000294708483	455825100	/nfs/dbraw/zinc/82/51/00/455825100.db2.gz	GXBRKJWUMLLRQJ-KRWDZBQOSA-N	0	3	336.501	3.110	20	30		EGEDHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@@]1(C#N)CC12CCCC2	ZINC000295122787	455839928	/nfs/dbraw/zinc/83/99/28/455839928.db2.gz	WYQVJLGKACSDNM-UZLBHIALSA-N	0	3	325.456	3.097	20	30		EGEDHN
O=C(Nc1cccc(C#Cc2ccccn2)c1)C1CCN(C2CC2)CC1	ZINC000278580429	455841833	/nfs/dbraw/zinc/84/18/33/455841833.db2.gz	RTTSHMHLLZGUPY-UHFFFAOYSA-N	0	3	345.446	3.294	20	30		EGEDHN
N#Cc1cccc(COc2cccc(CN3CCC[C@H](CO)C3)c2)c1	ZINC000269375730	455845793	/nfs/dbraw/zinc/84/57/93/455845793.db2.gz	VRWIUPOLSNNOKL-FQEVSTJZSA-N	0	3	336.435	3.342	20	30		EGEDHN
CC[C@H](C)[C@H](C)NC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000194474221	455847473	/nfs/dbraw/zinc/84/74/73/455847473.db2.gz	ASDYDPDGVZPOTR-HOTGVXAUSA-N	0	3	330.476	3.066	20	30		EGEDHN
CC[C@H](N[C@H]1CCN(Cc2ccccc2)C1=O)c1ccc(C#N)cc1	ZINC000278875535	455850951	/nfs/dbraw/zinc/85/09/51/455850951.db2.gz	XJSZXXWVSSOWPR-PMACEKPBSA-N	0	3	333.435	3.400	20	30		EGEDHN
N#CCOc1ccc(CN(Cc2ccccc2)[C@H](CO)C2CC2)cc1	ZINC000269940816	455854364	/nfs/dbraw/zinc/85/43/64/455854364.db2.gz	CPYMKRNRYGQEOT-OAQYLSRUSA-N	0	3	336.435	3.362	20	30		EGEDHN
C=CCN1CCC(NC(=O)C[C@H](C)c2c[nH]c3ccccc32)CC1	ZINC000279067577	455857280	/nfs/dbraw/zinc/85/72/80/455857280.db2.gz	QPYKLQYFXADRHK-HNNXBMFYSA-N	0	3	325.456	3.428	20	30		EGEDHN
C=CCN1CCC(NC(=O)/C=C\c2ccc(OC(C)C)cc2)CC1	ZINC000255121441	455861045	/nfs/dbraw/zinc/86/10/45/455861045.db2.gz	IDOCFPTVFJQYCQ-YFHOEESVSA-N	0	3	328.456	3.254	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN(C)C2C[C@H]3CC[C@@H](C2)N3C)c1C	ZINC000285513196	455861079	/nfs/dbraw/zinc/86/10/79/455861079.db2.gz	NPEKNEJQIAQVGE-JWTNVVGKSA-N	0	3	329.488	3.031	20	30		EGEDHN
N#CCCn1cc(CNC[C@H](O)c2ccccc2)c(-c2ccccc2)n1	ZINC000194665939	455871039	/nfs/dbraw/zinc/87/10/39/455871039.db2.gz	ITDZZIZTJNBNNP-FQEVSTJZSA-N	0	3	346.434	3.287	20	30		EGEDHN
C=CC[C@H](C)N[C@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl	ZINC000280018550	455880219	/nfs/dbraw/zinc/88/02/19/455880219.db2.gz	HFOZZSSYMNPASY-DTWKUNHWSA-N	0	3	337.272	3.256	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)c2ccc(CC#N)cc2)N(C)C)cc1	ZINC000270227974	455907277	/nfs/dbraw/zinc/90/72/77/455907277.db2.gz	NWFJAKKRSCPCNG-HXUWFJFHSA-N	0	3	335.451	3.348	20	30		EGEDHN
CCN(C[C@H]1CCN(Cc2ccccc2)C1)C(=O)[C@@](C)(C#N)CC	ZINC000285900080	455938178	/nfs/dbraw/zinc/93/81/78/455938178.db2.gz	BIDODMOCXIUOGH-AZUAARDMSA-N	0	3	327.472	3.297	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N1CCC[C@H](CNC(=O)C(C)(C)C)C1	ZINC000187687488	455939704	/nfs/dbraw/zinc/93/97/04/455939704.db2.gz	RIZUFLNELOWTNA-NVXWUHKLSA-N	0	3	327.472	3.494	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1ccc(CC#N)cc1)C(C)C	ZINC000270454876	455958932	/nfs/dbraw/zinc/95/89/32/455958932.db2.gz	VNASDBFNBDSQNN-LJQANCHMSA-N	0	3	325.456	3.181	20	30		EGEDHN
Cc1ccc(CN(C)C)cc1NC(=O)[C@H](C#N)Cc1ccc(C#N)cc1	ZINC000280506708	455985615	/nfs/dbraw/zinc/98/56/15/455985615.db2.gz	WUZYEUKWIKJABJ-IBGZPJMESA-N	0	3	346.434	3.249	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)C[C@@H](C)c1c(C)n[nH]c1C)C(C)C	ZINC000270648899	456004140	/nfs/dbraw/zinc/00/41/40/456004140.db2.gz	AXWIXHHRAXIPFI-CRAIPNDOSA-N	0	3	346.519	3.335	20	30		EGEDHN
CN(CCNC(=O)c1ccccc1Oc1ccccc1C#N)C1CC1	ZINC000272616103	456015569	/nfs/dbraw/zinc/01/55/69/456015569.db2.gz	XOTRBFMKMWXYNY-UHFFFAOYSA-N	0	3	335.407	3.175	20	30		EGEDHN
OCC[C@H]1CCC[C@H]1NCC#Cc1ccc(OC(F)(F)F)cc1	ZINC000286305874	456019958	/nfs/dbraw/zinc/01/99/58/456019958.db2.gz	VVLKBPHPQAGECM-GDBMZVCRSA-N	0	3	327.346	3.077	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N2CCCC(C)(C)C2)cc1	ZINC000286998350	456058702	/nfs/dbraw/zinc/05/87/02/456058702.db2.gz	CXZSGRBKQGOTDH-CYBMUJFWSA-N	0	3	349.456	3.026	20	30		EGEDHN
C=C(C)CN(CC)Cc1ccc(O[C@H](C)C(=O)N(C)C)c(OCC)c1	ZINC000270976422	456083897	/nfs/dbraw/zinc/08/38/97/456083897.db2.gz	BIOPKEAJKFCQPE-MRXNPFEDSA-N	0	3	348.487	3.339	20	30		EGEDHN
C[C@H]1C[C@H](N2CCCC2)CN1C(=O)C(C)(C)c1cc(F)cc(C#N)c1	ZINC000288560624	456099270	/nfs/dbraw/zinc/09/92/70/456099270.db2.gz	WFDJFESZDCOZGH-KSSFIOAISA-N	0	3	343.446	3.060	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CC[C@]2(CCN(Cc3ccccc3)C2)C1	ZINC000288617559	456100145	/nfs/dbraw/zinc/10/01/45/456100145.db2.gz	ZXVHNHVQKAXSCD-RXVVDRJESA-N	0	3	342.483	3.092	20	30		EGEDHN
COC[C@H](NC[C@H](O)c1ccc(C#N)cc1)c1cccc(Cl)c1	ZINC000288819422	456106184	/nfs/dbraw/zinc/10/61/84/456106184.db2.gz	MZSAAEHPXFCELY-ROUUACIJSA-N	0	3	330.815	3.222	20	30		EGEDHN
Cc1oc(C#N)cc1-c1nc(-c2ccccc2OCCN(C)C)no1	ZINC000289013495	456112177	/nfs/dbraw/zinc/11/21/77/456112177.db2.gz	KLRYCIGXNMQBLJ-UHFFFAOYSA-N	0	3	338.367	3.117	20	30		EGEDHN
C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NCC#Cc1ccccc1	ZINC000289438671	456125527	/nfs/dbraw/zinc/12/55/27/456125527.db2.gz	WISPTLRUQPPSEC-SJLPKXTDSA-N	0	3	328.456	3.273	20	30		EGEDHN
CCCCO[C@@H]1C[C@H](NCC(=O)Nc2sccc2C#N)C1(C)C	ZINC000289470869	456126978	/nfs/dbraw/zinc/12/69/78/456126978.db2.gz	ZAMASPXDZPAMJI-UONOGXRCSA-N	0	3	335.473	3.132	20	30		EGEDHN
CC(C)c1csc(C(C#N)C(=O)Nc2ccc3c(c2)OCCO3)n1	ZINC000271137624	456137645	/nfs/dbraw/zinc/13/76/45/456137645.db2.gz	NPBWZFMCXITCGA-LBPRGKRZSA-N	0	3	343.408	3.284	20	30		EGEDHN
Cc1nnc(N2CCN(C3CCC(C(C)C)CC3)CC2)c(C#N)c1C	ZINC000301594848	456156268	/nfs/dbraw/zinc/15/62/68/456156268.db2.gz	ZTTHLZOXHASEDU-UHFFFAOYSA-N	0	3	341.503	3.302	20	30		EGEDHN
C=CCOc1ccc(CN2CCCC[C@H]2CCC(=O)NC)cc1OC	ZINC000289863915	456159709	/nfs/dbraw/zinc/15/97/09/456159709.db2.gz	VNRHBIXNTCYLTM-KRWDZBQOSA-N	0	3	346.471	3.141	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@]1(C)CCO[C@H]1C1CC1	ZINC000273077417	456170558	/nfs/dbraw/zinc/17/05/58/456170558.db2.gz	PVRUTALQZWKRSC-RBUKOAKNSA-N	0	3	346.496	3.450	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)NC[C@@H](C1CC1)N(C)Cc1ccccc1	ZINC000281292184	456191148	/nfs/dbraw/zinc/19/11/48/456191148.db2.gz	MVWZJMISHJASTG-IBGZPJMESA-N	0	3	337.423	3.100	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cc(-c3ccncc3)ccc2C)CC1	ZINC000263823046	456234379	/nfs/dbraw/zinc/23/43/79/456234379.db2.gz	RBDPJWYPNHXTQP-UHFFFAOYSA-N	0	3	333.435	3.341	20	30		EGEDHN
CSc1ccc(CCNC(=O)C(C#N)Cc2ccc(C#N)cc2)cc1	ZINC000281447426	456237118	/nfs/dbraw/zinc/23/71/18/456237118.db2.gz	OKBYYEQDWSOSEV-SFHVURJKSA-N	0	3	349.459	3.321	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CCC([C@H]2CCCO2)CC1	ZINC000189151650	456241332	/nfs/dbraw/zinc/24/13/32/456241332.db2.gz	KLWJYEMMQINQQK-VQTJNVASSA-N	0	3	345.483	3.046	20	30		EGEDHN
COc1ccc([C@H](OC)[C@H](C)NCc2ccc(C#N)c(OC)c2)cc1	ZINC000281467643	456241950	/nfs/dbraw/zinc/24/19/50/456241950.db2.gz	BHJICEZOLVWNJW-VBKZILBWSA-N	0	3	340.423	3.441	20	30		EGEDHN
C=C(C)CN1CCC(Nc2nc(C)nc3ccc(OC)cc32)CC1	ZINC000301918200	456251355	/nfs/dbraw/zinc/25/13/55/456251355.db2.gz	DYYIMQSGEHIFBT-UHFFFAOYSA-N	0	3	326.444	3.399	20	30		EGEDHN
CC(C)(C)[C@](C)(C#N)NC(=O)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000274387982	456257903	/nfs/dbraw/zinc/25/79/03/456257903.db2.gz	ZVLDYPPHQXTQIW-PXNSSMCTSA-N	0	3	327.472	3.343	20	30		EGEDHN
CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@H]2CC[C@@H](C#N)C2)cc1	ZINC000274593871	456261650	/nfs/dbraw/zinc/26/16/50/456261650.db2.gz	FURHFENVGFQVOM-UXLLHSPISA-N	0	3	349.500	3.060	20	30		EGEDHN
C=CCN(Cc1cccc(OC)c1)[C@H](C)c1cccc(-n2cnnn2)c1	ZINC000340146113	456281961	/nfs/dbraw/zinc/28/19/61/456281961.db2.gz	LTKBHPIDOSQEBU-MRXNPFEDSA-N	0	3	349.438	3.420	20	30		EGEDHN
COc1cc(CN[C@@H](CN2CCCC2)c2ccccc2)ccc1C#N	ZINC000281655554	456283445	/nfs/dbraw/zinc/28/34/45/456283445.db2.gz	KJQVLGAEZPENNV-FQEVSTJZSA-N	0	3	335.451	3.494	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000290356757	456303868	/nfs/dbraw/zinc/30/38/68/456303868.db2.gz	LCJSHSMIMQWPKD-XMSQKQJNSA-N	0	3	346.474	3.237	20	30		EGEDHN
C=CCc1cc(CN(C)CCCn2ccnc2C)cc(OC)c1O	ZINC000290371968	456308270	/nfs/dbraw/zinc/30/82/70/456308270.db2.gz	HLVDPNKAUKUQHX-UHFFFAOYSA-N	0	3	329.444	3.156	20	30		EGEDHN
CC1CCC(N2CCN(c3cc(C#N)ccc3[N+](=O)[O-])CC2)CC1	ZINC000302221174	456321782	/nfs/dbraw/zinc/32/17/82/456321782.db2.gz	SEARMXHVSHFUAX-UHFFFAOYSA-N	0	3	328.416	3.167	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1C[C@@H](C)CC[C@@H]1c1ccccc1	ZINC000352801776	456322361	/nfs/dbraw/zinc/32/23/61/456322361.db2.gz	UFLNIHGTUYQVAH-YQVWRLOYSA-N	0	3	327.472	3.468	20	30		EGEDHN
CC(C)Oc1cc(C(=O)C(C#N)c2nc3ccccc3n2C)ccn1	ZINC000347846792	456402210	/nfs/dbraw/zinc/40/22/10/456402210.db2.gz	NCMCFSHBNWRVMB-AWEZNQCLSA-N	0	3	334.379	3.246	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2cccc(Oc3cnccn3)c2)nc(C)n1	ZINC000347969816	456432368	/nfs/dbraw/zinc/43/23/68/456432368.db2.gz	WGXDUTJCMWTJAH-INIZCTEOSA-N	0	3	345.362	3.166	20	30		EGEDHN
C[C@H](NCC#Cc1ccc(C(F)(F)F)cc1)C(C)(C)n1cncn1	ZINC000290826913	456439316	/nfs/dbraw/zinc/43/93/16/456439316.db2.gz	XJDXKJXDTCXSPO-ZDUSSCGKSA-N	0	3	336.361	3.062	20	30		EGEDHN
CN(CCC#N)c1ccc(CN[C@@]2(CO)CCCc3ccccc32)cc1	ZINC000282196155	456440121	/nfs/dbraw/zinc/44/01/21/456440121.db2.gz	CHNXLPBKIHXFCG-JOCHJYFZSA-N	0	3	349.478	3.350	20	30		EGEDHN
CC(C)CC[C@@H](O)CN1CCC(Oc2ccc(C#N)cc2F)CC1	ZINC000353033754	456451872	/nfs/dbraw/zinc/45/18/72/456451872.db2.gz	ZZZLCENZTPZADT-MRXNPFEDSA-N	0	3	334.435	3.338	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)N[C@@H](C)CN1CCC[C@H](C)C1	ZINC000303467156	456461574	/nfs/dbraw/zinc/46/15/74/456461574.db2.gz	MVQFDZFYTUBXHZ-IRXDYDNUSA-N	0	3	345.487	3.171	20	30		EGEDHN
COc1ccc(CN2CC[C@@H](OC)C[C@@H]2C)cc1OCCCC#N	ZINC000282307690	456472238	/nfs/dbraw/zinc/47/22/38/456472238.db2.gz	MTWNVMKZRRIFRN-DOTOQJQBSA-N	0	3	332.444	3.377	20	30		EGEDHN
CCc1nc(C#N)cc(N2CCCN(Cc3ccccc3)C[C@@H]2C)n1	ZINC000308168217	456572545	/nfs/dbraw/zinc/57/25/45/456572545.db2.gz	MBYBTNMWXPDABK-INIZCTEOSA-N	0	3	335.455	3.011	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)CC1(C)C	ZINC000282673413	456589664	/nfs/dbraw/zinc/58/96/64/456589664.db2.gz	HFMDMTWXCTXDQY-PKOBYXMFSA-N	0	3	344.499	3.385	20	30		EGEDHN
CO[C@@H]1CCCC[C@@H]1NCC(=O)N(CCC#N)c1cccc(C)c1C	ZINC000276892242	456612000	/nfs/dbraw/zinc/61/20/00/456612000.db2.gz	CDHQSYZNBBBLNN-PKOBYXMFSA-N	0	3	343.471	3.097	20	30		EGEDHN
CC(C)CSCCCNC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000348353935	456645055	/nfs/dbraw/zinc/64/50/55/456645055.db2.gz	XRBNUADYGDFTMJ-KRWDZBQOSA-N	0	3	329.469	3.136	20	30		EGEDHN
CS[C@@H](CNC(=O)C(C#N)Cc1ccc(C#N)cc1)C(C)(C)C	ZINC000348428134	456684542	/nfs/dbraw/zinc/68/45/42/456684542.db2.gz	ZYAAYPNTFMVCAO-CVEARBPZSA-N	0	3	329.469	3.134	20	30		EGEDHN
C=CCN(Cc1ccc(C#N)cc1)[C@H](C)c1cccc(-n2cnnn2)c1	ZINC000353495241	456714846	/nfs/dbraw/zinc/71/48/46/456714846.db2.gz	HNDOAUWHOVEEEV-MRXNPFEDSA-N	0	3	344.422	3.283	20	30		EGEDHN
CO[C@]1(C)C[C@H](N[C@H](C)C(=O)N(CCC#N)c2ccccc2)C1(C)C	ZINC000340849511	456716737	/nfs/dbraw/zinc/71/67/37/456716737.db2.gz	KVUFDUTWHZBQIM-OXFYSEKESA-N	0	3	343.471	3.115	20	30		EGEDHN
Cc1nc(NC(=O)[C@@H](C)N[C@@H]2CCC(=O)NC23CCC3)sc1C	ZINC000328703728	456741071	/nfs/dbraw/zinc/74/10/71/456741071.db2.gz	OIQNBUUMTWVJLC-ZYHUDNBSSA-N	0	3	336.461	3.368	20	30		EGEDHN
COCCn1cc(C(=O)C(C#N)c2cc(C)nc(C)n2)c2ccccc21	ZINC000353636206	456819704	/nfs/dbraw/zinc/81/97/04/456819704.db2.gz	FNIPVKKZGPMRQU-MRXNPFEDSA-N	0	3	348.406	3.185	20	30		EGEDHN
CC(C)N(Cc1nnc(-c2ccccc2Cl)o1)C(=O)C(C)C#N	ZINC000348700247	456820185	/nfs/dbraw/zinc/82/01/85/456820185.db2.gz	HWWJQGHITXESEJ-NSHDSACASA-N	0	3	332.791	3.287	20	30		EGEDHN
CC(C)[C@@H](C(=O)NCCC(=O)N1CCCCCC1)N1CCCCC1	ZINC000329083311	456831143	/nfs/dbraw/zinc/83/11/43/456831143.db2.gz	FEIVHNCXQCVAPU-SFHVURJKSA-N	0	3	337.508	3.246	20	30		EGEDHN
C[C@H](NC(=O)CC1CCCCC1)C(=O)N1CC[C@@H](N2CCCCC2)C1	ZINC000329294846	456868051	/nfs/dbraw/zinc/86/80/51/456868051.db2.gz	OJFGKOIJPXGLTF-FUHWJXTLSA-N	0	3	349.519	3.389	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)=C([O-])c1cncc(C(F)(F)F)c1	ZINC000344840020	456869072	/nfs/dbraw/zinc/86/90/72/456869072.db2.gz	FXJOLGNGZQDANZ-GFCCVEGCSA-N	0	3	344.296	3.477	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)c1cncc(C(F)(F)F)c1	ZINC000344840020	456869074	/nfs/dbraw/zinc/86/90/74/456869074.db2.gz	FXJOLGNGZQDANZ-GFCCVEGCSA-N	0	3	344.296	3.477	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN2CCC[C@@H]2C2CCOCC2)c1C	ZINC000348947191	456890041	/nfs/dbraw/zinc/89/00/41/456890041.db2.gz	IQYQPVASHBNHPG-LJQANCHMSA-N	0	3	330.472	3.365	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCC[C@H]2CCCCO2)C1	ZINC000329519808	456903755	/nfs/dbraw/zinc/90/37/55/456903755.db2.gz	QDTLEYSDWDJCHI-NZSAHSFTSA-N	0	3	345.487	3.285	20	30		EGEDHN
CC[C@@H]1C[C@H](C(=O)NCC2CCN(c3ccncc3)CC2)CC(=O)N1	ZINC000329623620	456917287	/nfs/dbraw/zinc/91/72/87/456917287.db2.gz	UWCUTXCVXNJINJ-JKSUJKDBSA-N	0	3	344.459	3.400	20	30		EGEDHN
CN(C(=O)N[C@@H]1CCn2ccnc2C1)[C@H]1CC[C@@H](C(F)(F)F)CC1	ZINC000329663617	456924325	/nfs/dbraw/zinc/92/43/25/456924325.db2.gz	PGPLYLUNILZLMK-UPJWGTAASA-N	0	3	344.381	3.165	20	30		EGEDHN
C[C@H](NC(=O)[C@@H]1CCCC[C@H]1C(=O)N1CCCC1)C1=CCN(C)CC1	ZINC000329714065	456930943	/nfs/dbraw/zinc/93/09/43/456930943.db2.gz	SLFBWXCEMSIVRH-CGTJXYLNSA-N	0	3	347.503	3.022	20	30		EGEDHN
CN1CCC(Nc2ccccc2NC(=O)[C@H]2CCNC(=O)C2)CC1	ZINC000329923330	456961522	/nfs/dbraw/zinc/96/15/22/456961522.db2.gz	GWWFSZDMODSXAN-ZDUSSCGKSA-N	0	3	330.432	3.147	20	30		EGEDHN
Cc1ccc(CNC(=O)C2CCN(CCC(C)(C)C#N)CC2)cc1	ZINC000345742826	456989745	/nfs/dbraw/zinc/98/97/45/456989745.db2.gz	MERAVWPTRUIAHI-UHFFFAOYSA-N	0	3	327.472	3.263	20	30		EGEDHN
CC(=O)N[C@H](C)C1CCN(Cc2cn(-c3ccncc3)nc2C)CC1	ZINC000330164818	456994271	/nfs/dbraw/zinc/99/42/71/456994271.db2.gz	WHWYBVOASWGXOH-CQSZACIVSA-N	0	3	341.459	3.153	20	30		EGEDHN
COc1cccc([C@@H](NC(=O)C(C)C#N)c2cc(F)ccc2OC)c1	ZINC000349612483	456995397	/nfs/dbraw/zinc/99/53/97/456995397.db2.gz	QXHNKUBTFJPWME-KZULUSFZSA-N	0	3	342.370	3.208	20	30		EGEDHN
Cc1nccn1C[C@H](C)CNC([O-])=[NH+][C@H]1CCOC2(CCCCC2)C1	ZINC000330234420	457009037	/nfs/dbraw/zinc/00/90/37/457009037.db2.gz	SQKMWMABGHCLIZ-WBVHZDCISA-N	0	3	348.491	3.213	20	30		EGEDHN
COc1cc(CN[C@@H]2CC[C@@H](C#N)C2)cc(Br)c1OC	ZINC000349803975	457058114	/nfs/dbraw/zinc/05/81/14/457058114.db2.gz	RYSCWGDRBXRMJM-ZYHUDNBSSA-N	0	3	339.233	3.248	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C)OCC	ZINC000339359246	457066495	/nfs/dbraw/zinc/06/64/95/457066495.db2.gz	OFTHJUBLJISMHO-AZUAARDMSA-N	0	3	344.499	3.481	20	30		EGEDHN
Cc1ccc([N+](=O)[O-])cc1NC(=O)N(C)[C@H](C)C1CCN(C)CC1	ZINC000330690154	457070629	/nfs/dbraw/zinc/07/06/29/457070629.db2.gz	AIRHUJNKOALYTH-CYBMUJFWSA-N	0	3	334.420	3.111	20	30		EGEDHN
CCOCC(C)(C)NCC(=O)Nc1ccccc1SC[C@@H](C)C#N	ZINC000339374946	457075733	/nfs/dbraw/zinc/07/57/33/457075733.db2.gz	NRXPOBKKRQNEDH-AWEZNQCLSA-N	0	3	349.500	3.282	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCN(Cc2ccccc2)C2(CCCCC2)C1	ZINC000359367719	457077175	/nfs/dbraw/zinc/07/71/75/457077175.db2.gz	DQDQXGXLCUCJJL-QGZVFWFLSA-N	0	3	325.456	3.193	20	30		EGEDHN
CC(C#N)C(=O)N1CCN(Cc2ccccc2)C2(CCCCC2)C1	ZINC000359367719	457077180	/nfs/dbraw/zinc/07/71/80/457077180.db2.gz	DQDQXGXLCUCJJL-QGZVFWFLSA-N	0	3	325.456	3.193	20	30		EGEDHN
CCN(Cc1ccc(C(=O)N2CCC(F)(C#N)CC2)cc1)C1CC1	ZINC000359378982	457078116	/nfs/dbraw/zinc/07/81/16/457078116.db2.gz	CVIIBRNUGCNNRQ-UHFFFAOYSA-N	0	3	329.419	3.139	20	30		EGEDHN
N#Cc1ccc(OC2CCC(NCc3ccn(C(F)F)n3)CC2)nc1	ZINC000346660463	457098139	/nfs/dbraw/zinc/09/81/39/457098139.db2.gz	BPQAPEVRAWBHFB-UHFFFAOYSA-N	0	3	347.369	3.025	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cnn(C(CC)CC)c2CC)CC1	ZINC000359615621	457101250	/nfs/dbraw/zinc/10/12/50/457101250.db2.gz	DDXSCUKDDQTFED-UHFFFAOYSA-N	0	3	332.492	3.187	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCN1C	ZINC000330914746	457104214	/nfs/dbraw/zinc/10/42/14/457104214.db2.gz	JHWZSEBBBOLQMP-KOLCDFICSA-N	0	3	345.321	3.401	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCc2nc(C(C)C)c(C)s2)CC1	ZINC000350024464	457147122	/nfs/dbraw/zinc/14/71/22/457147122.db2.gz	ANUZKGVLUYEDCC-UHFFFAOYSA-N	0	3	336.505	3.025	20	30		EGEDHN
CC(C)(C)c1ccc(C(C)(C)NCC(=O)NC2(C#N)CCC2)cc1	ZINC000331392073	457178169	/nfs/dbraw/zinc/17/81/69/457178169.db2.gz	DLDVAPRIKDMFTN-UHFFFAOYSA-N	0	3	327.472	3.371	20	30		EGEDHN
N#CCCCOc1cccc(CN[C@H](CO)Cc2ccc(F)cc2)c1	ZINC000346808403	457178292	/nfs/dbraw/zinc/17/82/92/457178292.db2.gz	ZHXUFYIQGUBDPO-IBGZPJMESA-N	0	3	342.414	3.201	20	30		EGEDHN
C[C@@H](C(=O)NCCCN1CCc2ccccc2C1)c1cccc(C#N)c1	ZINC000359980865	457183854	/nfs/dbraw/zinc/18/38/54/457183854.db2.gz	HTGGNZLJZBRJQL-QGZVFWFLSA-N	0	3	347.462	3.226	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)[C@@H](C)C#N)c1ccc(C(F)(F)F)cc1	ZINC000347038430	457197204	/nfs/dbraw/zinc/19/72/04/457197204.db2.gz	OZZAZISMZWDNOL-SWLSCSKDSA-N	0	3	341.377	3.364	20	30		EGEDHN
COCCN(C(=O)C(C)C#N)[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000347029977	457197652	/nfs/dbraw/zinc/19/76/52/457197652.db2.gz	BWOIYAPHHBMXDR-NWDGAFQWSA-N	0	3	328.334	3.401	20	30		EGEDHN
CCS[C@H]1CCCCN(CC(=O)N(C)C2(C#N)CCCCC2)C1	ZINC000350950322	457212562	/nfs/dbraw/zinc/21/25/62/457212562.db2.gz	MNQYJMUAFSBPIK-INIZCTEOSA-N	0	3	337.533	3.279	20	30		EGEDHN
COc1cc([C@H](C)NC(=O)C(C)C#N)ccc1OCc1ccncc1	ZINC000347077753	457219027	/nfs/dbraw/zinc/21/90/27/457219027.db2.gz	UZHAOOPMXTXTHU-KBPBESRZSA-N	0	3	339.395	3.006	20	30		EGEDHN
CC(C#N)C(=O)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000347139666	457251191	/nfs/dbraw/zinc/25/11/91/457251191.db2.gz	SJPYTCYIOOHPNM-AAEUAGOBSA-N	0	3	344.802	3.256	20	30		EGEDHN
CC(C)[C@@]1(CO)CCCN(C(=O)C(C#N)CCc2ccccc2)C1	ZINC000360170774	457287112	/nfs/dbraw/zinc/28/71/12/457287112.db2.gz	KRSUSDOAUTXNMI-QUCCMNQESA-N	0	3	328.456	3.016	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@@H]1CCC[C@]1(C)CO	ZINC000351516101	457302276	/nfs/dbraw/zinc/30/22/76/457302276.db2.gz	IBCFNEGXSZRPAL-SJLPKXTDSA-N	0	3	334.485	3.044	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccc(CC#N)cc2)C1	ZINC000340102123	457333469	/nfs/dbraw/zinc/33/34/69/457333469.db2.gz	LVUGHIWJNOPTAS-OXQOHEQNSA-N	0	3	333.435	3.318	20	30		EGEDHN
N#CCCCCN1CCC[C@@H](NC(=O)CCCc2ccccc2)C1	ZINC000352359446	457356719	/nfs/dbraw/zinc/35/67/19/457356719.db2.gz	AEJQDNOZMVXSEB-LJQANCHMSA-N	0	3	327.472	3.284	20	30		EGEDHN
CC(C#N)C(=O)N[C@H](c1ccc(OC(F)(F)F)cc1)C(F)(F)F	ZINC000360800014	457359981	/nfs/dbraw/zinc/35/99/81/457359981.db2.gz	VDFZVXLMZNWAFP-GMSGAONNSA-N	0	3	340.223	3.464	20	30		EGEDHN
COC[C@H]1CCCCN([C@H](C)C(=O)N(CCC#N)c2ccccc2)C1	ZINC000342575352	457373273	/nfs/dbraw/zinc/37/32/73/457373273.db2.gz	XVOBBJIQNZICOR-MSOLQXFVSA-N	0	3	343.471	3.070	20	30		EGEDHN
N#C[C@@]1(C(=O)N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)CC12CCCC2	ZINC000425002561	457401667	/nfs/dbraw/zinc/40/16/67/457401667.db2.gz	GBUIUNAFPVCBNK-NNMXDRDESA-N	0	3	349.478	3.193	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2COc3c2cccc3Cl)CC1	ZINC000360912391	457429912	/nfs/dbraw/zinc/42/99/12/457429912.db2.gz	LKJLPXSHYGIFHF-MRXNPFEDSA-N	0	3	349.862	3.113	20	30		EGEDHN
CC(C)N(C)CC(=O)N(Cc1cccc(C(F)(F)F)c1)[C@H](C)C#N	ZINC000425085854	457434312	/nfs/dbraw/zinc/43/43/12/457434312.db2.gz	MEYNCDPYCOSIKW-CYBMUJFWSA-N	0	3	341.377	3.286	20	30		EGEDHN
CC[C@H](C(=O)N(Cc1cccc(C(F)(F)F)c1)[C@@H](C)C#N)N(C)C	ZINC000425091061	457436145	/nfs/dbraw/zinc/43/61/45/457436145.db2.gz	WJSHEZPQMBCDFW-SWLSCSKDSA-N	0	3	341.377	3.286	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](CN(C)Cc3cccnc3)C2)CC1	ZINC000356069973	457444998	/nfs/dbraw/zinc/44/49/98/457444998.db2.gz	SMQVKVJNAJEHNX-SFHVURJKSA-N	0	3	327.472	3.108	20	30		EGEDHN
C=CCCC1(C(=O)NCc2ccc(CN3CCC(O)CC3)cc2)CC1	ZINC000356100375	457446929	/nfs/dbraw/zinc/44/69/29/457446929.db2.gz	SGIVRJFOKLKZRV-UHFFFAOYSA-N	0	3	342.483	3.006	20	30		EGEDHN
COc1cc(C#N)ccc1CN1CCC(CCCn2ccnc2)CC1	ZINC000361072952	457565115	/nfs/dbraw/zinc/56/51/15/457565115.db2.gz	KPBAPOOTYMCFDD-UHFFFAOYSA-N	0	3	338.455	3.456	20	30		EGEDHN
CCOC(=O)C[C@@H](C)N(C)Cc1ccc(C#N)cc1C(F)(F)F	ZINC000356414982	457614919	/nfs/dbraw/zinc/61/49/19/457614919.db2.gz	ONQPGGOYUFUKFD-LLVKDONJSA-N	0	3	328.334	3.351	20	30		EGEDHN
CO[C@@H]1CCCN([C@H](C)C(=O)N(CCC#N)c2ccc(C)cc2)CC1	ZINC000374696413	457689033	/nfs/dbraw/zinc/68/90/33/457689033.db2.gz	XKPQOHIAVKJWSX-IEBWSBKVSA-N	0	3	343.471	3.131	20	30		EGEDHN
CN(C)[C@H](CNC(=O)[C@@H](C#N)CCc1ccccc1)c1ccccc1	ZINC000433112519	457760047	/nfs/dbraw/zinc/76/00/47/457760047.db2.gz	BEGUTRPFTUJCGX-WOJBJXKFSA-N	0	3	335.451	3.178	20	30		EGEDHN
CN(C)Cc1cccc(CNC(=O)[C@H](C#N)CCc2ccccc2)c1	ZINC000433225565	457784304	/nfs/dbraw/zinc/78/43/04/457784304.db2.gz	BXCBKLTZOZSRBG-FQEVSTJZSA-N	0	3	335.451	3.137	20	30		EGEDHN
C=CCC[C@@H](N[C@@H]1CCN(C2CCOCC2)C1=O)c1ccccc1	ZINC000366121498	457795182	/nfs/dbraw/zinc/79/51/82/457795182.db2.gz	CXDVFDYSRBYFDZ-RTBURBONSA-N	0	3	328.456	3.063	20	30		EGEDHN
C=C[C@H](CC(=O)N1C[C@@H](SC)[C@H](N2CCCC2)C1)c1ccccc1	ZINC000361625754	457808755	/nfs/dbraw/zinc/80/87/55/457808755.db2.gz	VRZBSPZIJJNLHB-BHIYHBOVSA-N	0	3	344.524	3.385	20	30		EGEDHN
C[C@@H](c1ccc(S(N)(=O)=O)cc1)N(C)CCC1(C#N)CCCCC1	ZINC000411155529	457815714	/nfs/dbraw/zinc/81/57/14/457815714.db2.gz	NSJVGTSVAKIPHL-HNNXBMFYSA-N	0	3	349.500	3.191	20	30		EGEDHN
CN(C)[C@@H](CC(=O)N(CCC#N)Cc1ccccn1)c1ccccc1	ZINC000433363508	457821836	/nfs/dbraw/zinc/82/18/36/457821836.db2.gz	ROZIFGPCASTLBR-IBGZPJMESA-N	0	3	336.439	3.017	20	30		EGEDHN
COc1cccc2c1CCN(C(=O)C(C#N)CCc1ccccc1)C2	ZINC000433382240	457825831	/nfs/dbraw/zinc/82/58/31/457825831.db2.gz	NGIPDRIIYWZXLL-QGZVFWFLSA-N	0	3	334.419	3.352	20	30		EGEDHN
C[C@@H](CN(C)C(=O)C(C#N)CCc1ccccc1)c1nccs1	ZINC000433382793	457826043	/nfs/dbraw/zinc/82/60/43/457826043.db2.gz	PXJXBMFONFOPQL-GOEBONIOSA-N	0	3	327.453	3.478	20	30		EGEDHN
Cc1cc(CNCc2cccc(CN3CCO[C@H](C)C3)c2)ccc1C#N	ZINC000443985848	457834928	/nfs/dbraw/zinc/83/49/28/457834928.db2.gz	ZYUBCEXRUOEYQQ-GOSISDBHSA-N	0	3	349.478	3.377	20	30		EGEDHN
Cc1cc(CN[C@H](Cc2ccccc2)[C@H](O)C(F)F)ccc1C#N	ZINC000443997516	457837678	/nfs/dbraw/zinc/83/76/78/457837678.db2.gz	MGBOAPTVEIRVKL-MSOLQXFVSA-N	0	3	330.378	3.194	20	30		EGEDHN
C=CCCCCCN(C)C(=O)C(=O)Nc1ccc(CN(C)C)c(C)c1	ZINC000411259943	457844873	/nfs/dbraw/zinc/84/48/73/457844873.db2.gz	YUGGGSDAFCFOOS-UHFFFAOYSA-N	0	3	345.487	3.200	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN[C@H]2CCN(c3ccccc3F)C2)cc1	ZINC000366589266	457862180	/nfs/dbraw/zinc/86/21/80/457862180.db2.gz	FBMCYSYZABEKAN-WBVHZDCISA-N	0	3	339.414	3.485	20	30		EGEDHN
C=CCN1CC[C@@H](N2CCC(c3c(C)[nH]c4ccccc43)CC2)C1=O	ZINC000366890469	457906008	/nfs/dbraw/zinc/90/60/08/457906008.db2.gz	DQVYIWRJOIHCOI-LJQANCHMSA-N	0	3	337.467	3.443	20	30		EGEDHN
CC(C)(C#N)CCCCN1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000444656397	457929388	/nfs/dbraw/zinc/92/93/88/457929388.db2.gz	FGHJRBBTSLHGJN-AWEZNQCLSA-N	0	3	331.420	3.196	20	30		EGEDHN
C=CCN(C)CCN(CC)[C@H](C)c1nc(Cc2ccccc2)no1	ZINC000411640621	457936239	/nfs/dbraw/zinc/93/62/39/457936239.db2.gz	KXQBTLVCAVTXFQ-MRXNPFEDSA-N	0	3	328.460	3.161	20	30		EGEDHN
Cc1cc(NC(=O)c2cccc(CC#N)c2)ccc1OCCN(C)C	ZINC000458199459	457965591	/nfs/dbraw/zinc/96/55/91/457965591.db2.gz	RJVYIEHNTLHEMR-UHFFFAOYSA-N	0	3	337.423	3.254	20	30		EGEDHN
Cc1ccccc1[C@H](CC(F)(F)F)NCCC(=O)N(C)CCC#N	ZINC000444777358	457974570	/nfs/dbraw/zinc/97/45/70/457974570.db2.gz	FMWUWYXPQSZVOU-HNNXBMFYSA-N	0	3	341.377	3.340	20	30		EGEDHN
N#Cc1cc(Br)ccc1CNC1(C2CC2)CCOCC1	ZINC000367862970	457990529	/nfs/dbraw/zinc/99/05/29/457990529.db2.gz	AFHFTIWOJLJQHH-UHFFFAOYSA-N	0	3	335.245	3.370	20	30		EGEDHN
C=C(C)CCNC(=O)NCC1(N[C@H](C)c2ccccc2)CCOCC1	ZINC000458372067	458027323	/nfs/dbraw/zinc/02/73/23/458027323.db2.gz	MBHUBOIPDMLIOQ-QGZVFWFLSA-N	0	3	345.487	3.152	20	30		EGEDHN
C=CCN1CC[C@H](N[C@H](c2ccccc2)C2(CO)CCCCC2)C1=O	ZINC000412004158	458041824	/nfs/dbraw/zinc/04/18/24/458041824.db2.gz	BRFCADTWHGQSSO-RBUKOAKNSA-N	0	3	342.483	3.047	20	30		EGEDHN
C=CCC[C@H](NC(=O)N[C@H]1CN(C2CC2)C[C@@H]1C)c1ccccc1	ZINC000435098849	458092619	/nfs/dbraw/zinc/09/26/19/458092619.db2.gz	OCIYKKBZQCCQRB-SNRMKQJTSA-N	0	3	327.472	3.476	20	30		EGEDHN
CC(C)N1CC[C@H](N(C)C(=O)N[C@H](CCC#N)c2ccccc2)C1	ZINC000458579460	458100219	/nfs/dbraw/zinc/10/02/19/458100219.db2.gz	NJXVJAGTYIIFLD-ZWKOTPCHSA-N	0	3	328.460	3.156	20	30		EGEDHN
Cn1cc([C@H](NCCCC2(C#N)CCOCC2)c2ccccc2)cn1	ZINC000369177550	458113407	/nfs/dbraw/zinc/11/34/07/458113407.db2.gz	GPXSRKYIUWOHRC-LJQANCHMSA-N	0	3	338.455	3.200	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)NCC1(CC#N)CC1)c1ccccc1	ZINC000362346468	458119224	/nfs/dbraw/zinc/11/92/24/458119224.db2.gz	MICLOUWTHKHGRM-QGZVFWFLSA-N	0	3	328.460	3.063	20	30		EGEDHN
C=CCC1(NC(=O)NCCCN2CCCO[C@H](C)C2)CCCCC1	ZINC000458712944	458144730	/nfs/dbraw/zinc/14/47/30/458144730.db2.gz	HCXMROYQXVKOMZ-QGZVFWFLSA-N	0	3	337.508	3.066	20	30		EGEDHN
N#CCSc1cccc(C(=O)N2CCCN(CC3CCC3)CC2)c1	ZINC000412309338	458161441	/nfs/dbraw/zinc/16/14/41/458161441.db2.gz	KSWJDANKEVFEKV-UHFFFAOYSA-N	0	3	343.496	3.250	20	30		EGEDHN
C=C(C)CCNC(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000458768755	458164024	/nfs/dbraw/zinc/16/40/24/458164024.db2.gz	WAKYOJMKVCOOJJ-GOSISDBHSA-N	0	3	333.476	3.342	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1CNCc1cc(O)ccc1Br	ZINC000435742305	458195018	/nfs/dbraw/zinc/19/50/18/458195018.db2.gz	NCFIKUUSAIWQSW-ABAIWWIYSA-N	0	3	326.234	3.226	20	30		EGEDHN
C=CCn1nnnc1SCc1cccc(CN2CCCCC2)c1	ZINC000412994373	458290340	/nfs/dbraw/zinc/29/03/40/458290340.db2.gz	QFIXHGIARJPYRU-UHFFFAOYSA-N	0	3	329.473	3.137	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCSC3(CCC3)CC2)CC1	ZINC000413232024	458296473	/nfs/dbraw/zinc/29/64/73/458296473.db2.gz	FYAPWSMCZHKXJC-UHFFFAOYSA-N	0	3	337.533	3.098	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H]1NC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000459236094	458298186	/nfs/dbraw/zinc/29/81/86/458298186.db2.gz	MJIKPADEVAXREW-RTBURBONSA-N	0	3	342.487	3.066	20	30		EGEDHN
CN(CCC#N)C[C@H](O)CN1CC2(CCCCC2)[C@H]1c1ccccc1	ZINC000414135687	458315351	/nfs/dbraw/zinc/31/53/51/458315351.db2.gz	DOGKVSJRCAPJHO-VQTJNVASSA-N	0	3	341.499	3.200	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NCc1ccc(S(C)(=O)=O)s1	ZINC000414540031	458322965	/nfs/dbraw/zinc/32/29/65/458322965.db2.gz	TWQHQNZUSUEWKE-OAHLLOKOSA-N	0	3	335.494	3.429	20	30		EGEDHN
CC(C)(C#N)c1ccc(NC(=O)N2C[C@@H](c3ccccc3)[C@H](N)C2)cc1	ZINC000414838022	458325519	/nfs/dbraw/zinc/32/55/19/458325519.db2.gz	YBFPMGJORBHTHL-RBUKOAKNSA-N	0	3	348.450	3.446	20	30		EGEDHN
CN(C)C1(CNC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)CC1	ZINC000416304394	458342604	/nfs/dbraw/zinc/34/26/04/458342604.db2.gz	UUYYOQQINJSGLJ-UHFFFAOYSA-N	0	3	349.434	3.369	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1SC[C@@H](CC)OC	ZINC000416901085	458356879	/nfs/dbraw/zinc/35/68/79/458356879.db2.gz	JSSKBDWWYKRZAK-OAHLLOKOSA-N	0	3	338.521	3.010	20	30		EGEDHN
CC(C)c1ccc([C@@H](N)CNC(=O)NCC(C)(C)CCC#N)cc1	ZINC000418212243	458373909	/nfs/dbraw/zinc/37/39/09/458373909.db2.gz	URABVEBNCUGEQU-KRWDZBQOSA-N	0	3	330.476	3.439	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Cc2ccc(Cl)c(OC)c2)CC1	ZINC000448923043	458415758	/nfs/dbraw/zinc/41/57/58/458415758.db2.gz	SVGYPQBKGJCXPR-UHFFFAOYSA-N	0	3	336.863	3.048	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)[C@@]1(C#N)CC12CCCC2)C(C)C	ZINC000448974677	458417414	/nfs/dbraw/zinc/41/74/14/458417414.db2.gz	LUBLYGBDLGXHFI-PXNSSMCTSA-N	0	3	329.488	3.275	20	30		EGEDHN
CC(C)(C)O[C@@H]1C[C@H](NCc2cc(C#N)cs2)[C@@H]1n1cccn1	ZINC000449653328	458427946	/nfs/dbraw/zinc/42/79/46/458427946.db2.gz	BZHNQBZRVGJMQD-XHSDSOJGSA-N	0	3	330.457	3.103	20	30		EGEDHN
C=CCC[C@H](CO)NCc1nc2cc(C(F)(F)F)ccc2n1C	ZINC000449696313	458429746	/nfs/dbraw/zinc/42/97/46/458429746.db2.gz	HQLOCDALOUIDQZ-GFCCVEGCSA-N	0	3	327.350	3.009	20	30		EGEDHN
C=CCC[C@@H](CO)NCc1ccc(-c2ccccc2C(=O)OC)o1	ZINC000449701934	458429811	/nfs/dbraw/zinc/42/98/11/458429811.db2.gz	XWQQZAAMUMQWNW-AWEZNQCLSA-N	0	3	329.396	3.150	20	30		EGEDHN
CCO[C@@H]1CCC[C@H]1NCc1ccc(OC)c(OCCCC#N)c1	ZINC000449754337	458430522	/nfs/dbraw/zinc/43/05/22/458430522.db2.gz	JANZMARODALHSP-IAGOWNOFSA-N	0	3	332.444	3.425	20	30		EGEDHN
C=CCOc1ccc(CNC2(CO)CCSCC2)cc1Cl	ZINC000459734856	458461688	/nfs/dbraw/zinc/46/16/88/458461688.db2.gz	UPNADCCSWWAFCI-UHFFFAOYSA-N	0	3	327.877	3.253	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)CN1[C@H](C)C[C@H](c2ccccc2)[C@@H]1C	ZINC000451184170	458468760	/nfs/dbraw/zinc/46/87/60/458468760.db2.gz	LLMVOWWRGMYOGF-NDUPCHFUSA-N	0	3	327.472	3.307	20	30		EGEDHN
CN(CCOc1ccc(C#N)cc1)[C@@H](CO)c1ccc(Cl)cc1	ZINC000451329514	458473988	/nfs/dbraw/zinc/47/39/88/458473988.db2.gz	XIPPKGIITXKGEM-SFHVURJKSA-N	0	3	330.815	3.256	20	30		EGEDHN
CC1(C)[C@H](NCc2ccc(C#N)cc2OC(F)F)[C@@H]2CCCO[C@@H]21	ZINC000451478003	458478503	/nfs/dbraw/zinc/47/85/03/458478503.db2.gz	JIFAOXIYHWPOCU-IMJJTQAJSA-N	0	3	336.382	3.453	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCC[S@](=O)c1cc(Cl)ccc1Cl	ZINC000451610800	458483379	/nfs/dbraw/zinc/48/33/79/458483379.db2.gz	ZTWROHYVOPTWKB-UVARLRKDSA-N	0	3	334.268	3.034	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC(=O)N[C@@H](c1ccccc1)C1CCCC1	ZINC000451675409	458485213	/nfs/dbraw/zinc/48/52/13/458485213.db2.gz	PWKBVBLALNFIKV-DYXWJJEUSA-N	0	3	342.483	3.357	20	30		EGEDHN
CCO[C@@H]1CCC[C@H]1NCC(=O)N(CCC#N)c1cc(C)cc(C)c1	ZINC000452019401	458493361	/nfs/dbraw/zinc/49/33/61/458493361.db2.gz	MLSMOEDJYGMZTB-RTBURBONSA-N	0	3	343.471	3.097	20	30		EGEDHN
OCCC[C@H]1CCN(CC#Cc2ccc(OC(F)(F)F)cc2)C1	ZINC000452124819	458495244	/nfs/dbraw/zinc/49/52/44/458495244.db2.gz	RRAREANDWFFMSS-HNNXBMFYSA-N	0	3	327.346	3.031	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NC[C@@H]2CSc3ccccc32)cc1	ZINC000452214726	458497027	/nfs/dbraw/zinc/49/70/27/458497027.db2.gz	OGIHSXCGEBCCJT-DLBZAZTESA-N	0	3	347.443	3.246	20	30		EGEDHN
C=CCN1CCC(N[C@H](c2nccn2C)c2ccc(Cl)cc2)CC1	ZINC000453092293	458519150	/nfs/dbraw/zinc/51/91/50/458519150.db2.gz	DHQLGKVHSHEDKX-SFHVURJKSA-N	0	3	344.890	3.403	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)Nc2cccc(C#Cc3ccccn3)c2)CCN1C	ZINC000438071196	458527956	/nfs/dbraw/zinc/52/79/56/458527956.db2.gz	HQDRJYOGTTYGRJ-JXFKEZNVSA-N	0	3	348.450	3.086	20	30		EGEDHN
COc1cc(CN2CC[C@](C)(C(=O)OC(C)(C)C)C2)ccc1C#N	ZINC000453623765	458538849	/nfs/dbraw/zinc/53/88/49/458538849.db2.gz	PFOUFSGPGDJFPQ-IBGZPJMESA-N	0	3	330.428	3.121	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1ccc2nc(Cc3ccccc3)oc2c1	ZINC000424118877	458562885	/nfs/dbraw/zinc/56/28/85/458562885.db2.gz	DNAQIFAMOKJKQI-MRXNPFEDSA-N	0	3	348.406	3.378	20	30		EGEDHN
C=C(CC)CNC(=O)Nc1ccc(CCN2CCSCC2)cc1	ZINC000454639478	458569358	/nfs/dbraw/zinc/56/93/58/458569358.db2.gz	CDLHVQOMEOQRSF-UHFFFAOYSA-N	0	3	333.501	3.366	20	30		EGEDHN
C[C@@H](CNC(=O)C(C)(C)Cc1ccc(C#N)cc1)N1CCC[C@H](C)C1	ZINC000454726592	458573043	/nfs/dbraw/zinc/57/30/43/458573043.db2.gz	BPYCJTOXBXRUGW-IRXDYDNUSA-N	0	3	341.499	3.364	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](CN)c2ccc3ccccc3c2)CCOCC1	ZINC000424163785	458574973	/nfs/dbraw/zinc/57/49/73/458574973.db2.gz	VYXTYXLPIVQDKM-LJQANCHMSA-N	0	3	338.451	3.329	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N1CCC[C@@H](CCCc2ccccc2)C1	ZINC000424168212	458576442	/nfs/dbraw/zinc/57/64/42/458576442.db2.gz	IADYICLSLPSURI-MOPGFXCFSA-N	0	3	327.472	3.269	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1c(F)cccc1OC)C(C)C	ZINC000469500953	458577547	/nfs/dbraw/zinc/57/75/47/458577547.db2.gz	DCPOCTWNKOFAHT-INIZCTEOSA-N	0	3	334.435	3.263	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)NCc1cnc(C)cc1C)C(C)C	ZINC000455560978	458604099	/nfs/dbraw/zinc/60/40/99/458604099.db2.gz	QCHROPNIFMIUJK-IBGZPJMESA-N	0	3	344.503	3.196	20	30		EGEDHN
C[C@@H](C(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)c1cccc(C#N)c1	ZINC000462260670	458608272	/nfs/dbraw/zinc/60/82/72/458608272.db2.gz	TVQWPZOIRPWIMK-UTKZUKDTSA-N	0	3	347.462	3.395	20	30		EGEDHN
C[C@@H]1CN(C(=O)C(C)(C)Cc2ccc(C#N)cc2)CCN(C2CC2)C1	ZINC000456032640	458628776	/nfs/dbraw/zinc/62/87/76/458628776.db2.gz	OKZKJDRQTWBWEE-INIZCTEOSA-N	0	3	339.483	3.070	20	30		EGEDHN
C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)C(C)(C)Cc1ccc(C#N)cc1	ZINC000456065986	458630606	/nfs/dbraw/zinc/63/06/06/458630606.db2.gz	VEDRYKORHZVHKV-VQIMIIECSA-N	0	3	339.483	3.212	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)[C@@H](CC)c2ccccc2OC)CC1	ZINC000494156984	458634840	/nfs/dbraw/zinc/63/48/40/458634840.db2.gz	PMJOERHJMZUQKN-SFHVURJKSA-N	0	3	345.487	3.438	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCCN1CCN(C)C[C@@H]1c1ccccc1	ZINC000424586470	458671011	/nfs/dbraw/zinc/67/10/11/458671011.db2.gz	TUGGNJLMVPYSRK-LJQANCHMSA-N	0	3	343.515	3.084	20	30		EGEDHN
C[C@@H]1CCCC[C@@H]1C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000424593066	458674042	/nfs/dbraw/zinc/67/40/42/458674042.db2.gz	BXIYKPYOEPQZGU-APWZRJJASA-N	0	3	327.472	3.275	20	30		EGEDHN
CO[C@@H]1C[C@@H](N(C)C(=O)C(C#N)CCc2ccccc2)C12CCC2	ZINC000456591221	458723232	/nfs/dbraw/zinc/72/32/32/458723232.db2.gz	QAQJUVDNGGMPPZ-RCCFBDPRSA-N	0	3	326.440	3.175	20	30		EGEDHN
C=CCOc1cccc(CN2CCC[C@@H](C(=O)NCCCC)C2)c1	ZINC000512526321	458785779	/nfs/dbraw/zinc/78/57/79/458785779.db2.gz	FCRXAPOBGNYTHK-GOSISDBHSA-N	0	3	330.472	3.380	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)[C@@H](C)N1CC[C@H](Cc2ccccc2)[C@@H]1C	ZINC000472339015	458787822	/nfs/dbraw/zinc/78/78/22/458787822.db2.gz	BBVYRBCUWJHIAB-GMLUQMLDSA-N	0	3	341.499	3.382	20	30		EGEDHN
C=CCCCCNC(=O)NCC1(N2CCSCC2)CCCC1	ZINC000472824485	458809960	/nfs/dbraw/zinc/80/99/60/458809960.db2.gz	FZWWEBZTQZPRGM-UHFFFAOYSA-N	0	3	325.522	3.004	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N(C)Cc1cccc(O)c1)C(C)C	ZINC000515844779	458813337	/nfs/dbraw/zinc/81/33/37/458813337.db2.gz	KITAZLPQCQNRPL-LJQANCHMSA-N	0	3	345.487	3.232	20	30		EGEDHN
N#CCC1(CNC[C@H](O)COc2cc(Cl)ccc2Cl)CC1	ZINC000516645772	458821159	/nfs/dbraw/zinc/82/11/59/458821159.db2.gz	QFDGYEUAOXDHBE-LBPRGKRZSA-N	0	3	329.227	3.017	20	30		EGEDHN
Cc1csc(NC(=O)CN[C@H](CCCC#N)c2ccccc2)n1	ZINC000433030152	458828970	/nfs/dbraw/zinc/82/89/70/458828970.db2.gz	VHPKOJUSMZDBOW-OAHLLOKOSA-N	0	3	328.441	3.415	20	30		EGEDHN
C=CC1CCN(C(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)CC1	ZINC000466523322	458903592	/nfs/dbraw/zinc/90/35/92/458903592.db2.gz	VYRDLFDBOHOKBT-LPHOPBHVSA-N	0	3	327.472	3.257	20	30		EGEDHN
C=C(C)Cn1c(-c2sccc2C)nnc1N1CCN2CCC[C@H]2C1	ZINC000555242614	458904117	/nfs/dbraw/zinc/90/41/17/458904117.db2.gz	SFAKWZLYIZAFAX-HNNXBMFYSA-N	0	3	343.500	3.176	20	30		EGEDHN
CC(C)CN(Cc1cnn(C)c1)C(=O)C(C#N)CCc1ccccc1	ZINC000457340117	458925893	/nfs/dbraw/zinc/92/58/93/458925893.db2.gz	HFTVWIXGXSIADJ-IBGZPJMESA-N	0	3	338.455	3.177	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@]2(C1)CCCN([C@@H]1CC[C@@H](C#N)C1)C2	ZINC000495794358	458956688	/nfs/dbraw/zinc/95/66/88/458956688.db2.gz	SBUNKCPPALQDQR-MDZRGWNJSA-N	0	3	333.476	3.402	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)C1(C#N)CC(C)C1)c1cccc(OC)c1	ZINC000531808573	458981530	/nfs/dbraw/zinc/98/15/30/458981530.db2.gz	VAPLGEAUZXLULX-VDUSKEEQSA-N	0	3	343.471	3.134	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1nc(-c2ccc(Cl)cc2)cs1	ZINC000577363831	459022219	/nfs/dbraw/zinc/02/22/19/459022219.db2.gz	OKNQPLTXMUSPQF-GFCCVEGCSA-N	0	3	334.832	3.423	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N1CCC(CCN2CCOCC2)CC1	ZINC000442675006	459023862	/nfs/dbraw/zinc/02/38/62/459023862.db2.gz	ATAQVMMBCKJKGR-QGZVFWFLSA-N	0	3	327.472	3.054	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1ccc(OC)c(F)c1)C(C)C	ZINC000496014379	459036668	/nfs/dbraw/zinc/03/66/68/459036668.db2.gz	OBPWHGOFPGRZEQ-QGZVFWFLSA-N	0	3	334.435	3.263	20	30		EGEDHN
COc1cc(CN(Cc2ccccc2)[C@H](CO)C2CC2)ccc1C#N	ZINC000442849422	459045979	/nfs/dbraw/zinc/04/59/79/459045979.db2.gz	GYRLRKIUEJHJPY-HXUWFJFHSA-N	0	3	336.435	3.340	20	30		EGEDHN
COC(=O)c1csc(-c2cccc(CN[C@H]3CC[C@H](C#N)C3)c2)n1	ZINC000442859216	459047509	/nfs/dbraw/zinc/04/75/09/459047509.db2.gz	QHFMTWRPTCHVJI-WFASDCNBSA-N	0	3	341.436	3.379	20	30		EGEDHN
Cc1c(C#N)cccc1NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1	ZINC000532750188	459139745	/nfs/dbraw/zinc/13/97/45/459139745.db2.gz	NFSGHUXRAJSGOO-GOSISDBHSA-N	0	3	334.423	3.112	20	30		EGEDHN
N#Cc1ccc(NC(=O)CN2CCC[C@H]2[C@H]2CCCOC2)cc1Cl	ZINC000567790350	459169525	/nfs/dbraw/zinc/16/95/25/459169525.db2.gz	XWZHLFRMMWXRPD-YOEHRIQHSA-N	0	3	347.846	3.041	20	30		EGEDHN
C[C@@](C#N)(NC(=O)[C@@H]1CCN(Cc2ccccc2)C1)C1CCCCC1	ZINC000578336777	459185338	/nfs/dbraw/zinc/18/53/38/459185338.db2.gz	PJRITSSNSOTFPY-NQIIRXRSSA-N	0	3	339.483	3.487	20	30		EGEDHN
C=CCCSCCNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1	ZINC000594960120	459193639	/nfs/dbraw/zinc/19/36/39/459193639.db2.gz	KGPVZZZVOJBPKK-UHFFFAOYSA-N	0	3	346.456	3.394	20	30		EGEDHN
C=C(C)CN1CCC(Nc2nc3ccc(OC)cc3nc2C)CC1	ZINC000558903243	459222329	/nfs/dbraw/zinc/22/23/29/459222329.db2.gz	AYPAMPCTHCUNFS-UHFFFAOYSA-N	0	3	326.444	3.399	20	30		EGEDHN
C=CCCSCCN[C@@H](C)CS(=O)(=O)c1ccc(C)cc1	ZINC000595061056	459232104	/nfs/dbraw/zinc/23/21/04/459232104.db2.gz	XUXKNWHMZMHHSR-HNNXBMFYSA-N	0	3	327.515	3.056	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H]1CCN(C(=O)Nc2cccc(CC#N)c2)C1	ZINC000590854884	459246672	/nfs/dbraw/zinc/24/66/72/459246672.db2.gz	QNJDQKHJPCYLHL-HXUWFJFHSA-N	0	3	348.450	3.491	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN[C@H](CC)c1ccncc1	ZINC000579704389	459250816	/nfs/dbraw/zinc/25/08/16/459250816.db2.gz	SNRZWJRBAUSTMX-RBUKOAKNSA-N	0	3	326.440	3.291	20	30		EGEDHN
Cc1ccc(CN2CC[C@H](CN(C)C(=O)C3(C#N)CC(C)C3)C2)s1	ZINC000579722077	459250845	/nfs/dbraw/zinc/25/08/45/459250845.db2.gz	DXRLSGHWVVLWDM-NLGTXKQRSA-N	0	3	345.512	3.277	20	30		EGEDHN
C[C@@H](CCC#N)N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000496700138	459293147	/nfs/dbraw/zinc/29/31/47/459293147.db2.gz	JYANKIDXQCFVQY-WMZOPIPTSA-N	0	3	329.444	3.317	20	30		EGEDHN
Cc1ccccc1[C@@H]1C[C@@H](C)N(CC(=O)NCc2ccc(C#N)cc2)C1	ZINC000523441471	459303421	/nfs/dbraw/zinc/30/34/21/459303421.db2.gz	UWYBSIGVOVZMQV-YLJYHZDGSA-N	0	3	347.462	3.361	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)N1CCC[C@H](CC#N)C1)c1ccsc1	ZINC000595451281	459307232	/nfs/dbraw/zinc/30/72/32/459307232.db2.gz	ZONIRJCMMCCDON-NVXWUHKLSA-N	0	3	348.516	3.466	20	30		EGEDHN
CC(C)N1CCN(c2cccc(Nc3ncc(C#N)cc3F)c2)CC1	ZINC000591153903	459324259	/nfs/dbraw/zinc/32/42/59/459324259.db2.gz	PMJGWYBUDSWDEZ-UHFFFAOYSA-N	0	3	339.418	3.366	20	30		EGEDHN
N#CCCn1cc(CN2CCC(CCO)CC2)c(-c2ccccc2)n1	ZINC000535781973	459357696	/nfs/dbraw/zinc/35/76/96/459357696.db2.gz	WYYUOWYFZVUGNR-UHFFFAOYSA-N	0	3	338.455	3.058	20	30		EGEDHN
C=CCNC(=O)NC(=O)CN[C@@H](c1ccc(Cl)cc1)C1CCCC1	ZINC000538206826	459370043	/nfs/dbraw/zinc/37/00/43/459370043.db2.gz	YWSGBBIOQYKPKI-QGZVFWFLSA-N	0	3	349.862	3.173	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC(=O)N[C@@H](C)c1cccc2ccccc21	ZINC000582468183	459370193	/nfs/dbraw/zinc/37/01/93/459370193.db2.gz	UYYXXGCIDNVXIX-BEVDRBHNSA-N	0	3	338.451	3.340	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC[C@H]2CCCC[C@@H]2C(F)(F)F)CC1	ZINC000483740505	459387883	/nfs/dbraw/zinc/38/78/83/459387883.db2.gz	GNCWBPIDVVTOMT-HIFRSBDPSA-N	0	3	347.425	3.305	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1ccccc1SCC(F)(F)F	ZINC000591593236	459409094	/nfs/dbraw/zinc/40/90/94/459409094.db2.gz	XZQHONBJZVXQKO-JTQLQIEISA-N	0	3	331.363	3.301	20	30		EGEDHN
Cc1ccccc1[C@H]1C[C@H](C)N(Cc2cnc3c(C#N)cnn3c2)C1	ZINC000582786969	459427410	/nfs/dbraw/zinc/42/74/10/459427410.db2.gz	RZRBLLBEFQMHDE-RDJZCZTQSA-N	0	3	331.423	3.287	20	30		EGEDHN
C[C@H]1CCN(CCNC(=O)c2ccccc2-c2ccccc2C#N)C1	ZINC000525293421	459443854	/nfs/dbraw/zinc/44/38/54/459443854.db2.gz	YHBXTABSLKEVPX-INIZCTEOSA-N	0	3	333.435	3.297	20	30		EGEDHN
Cc1csc(NC(=O)N2CCN(C3CCC3)C[C@@H](C)C2)c1C#N	ZINC000569619657	459482030	/nfs/dbraw/zinc/48/20/30/459482030.db2.gz	VSHVJFXWTJQWDO-GFCCVEGCSA-N	0	3	332.473	3.266	20	30		EGEDHN
C[C@@H](C(=O)N(CCC#N)c1ccc(F)cc1)N(C)C[C@H]1CC1(C)C	ZINC000595910003	459482511	/nfs/dbraw/zinc/48/25/11/459482511.db2.gz	APVKDGOKEZJWAJ-LSDHHAIUSA-N	0	3	331.435	3.439	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(OC3CCCC3)nc2)CC1	ZINC000541949378	459514449	/nfs/dbraw/zinc/51/44/49/459514449.db2.gz	VJBCLCTXFCZLLN-UHFFFAOYSA-N	0	3	343.471	3.173	20	30		EGEDHN
N#CC[C@H]1CCCN(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)C1	ZINC000596089398	459515786	/nfs/dbraw/zinc/51/57/86/459515786.db2.gz	ZOYLKAJQAUBFIM-MJGOQNOKSA-N	0	3	340.471	3.159	20	30		EGEDHN
C[C@H]1CN(C)CC[C@H]1N(C)c1cc(Br)c(C#N)cc1F	ZINC000569824660	459516948	/nfs/dbraw/zinc/51/69/48/459516948.db2.gz	IXKSHXGSOLGVET-IINYFYTJSA-N	0	3	340.240	3.236	20	30		EGEDHN
Cn1ncc(C#N)c1NCC1CCN(Cc2ccccc2Cl)CC1	ZINC000596122042	459529144	/nfs/dbraw/zinc/52/91/44/459529144.db2.gz	INKBTUBZMAWIKA-UHFFFAOYSA-N	0	3	343.862	3.269	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)NCC1CC(F)(F)C1)C(C)C	ZINC000487814260	459534300	/nfs/dbraw/zinc/53/43/00/459534300.db2.gz	ATHCSGCHLHJUCD-HNNXBMFYSA-N	0	3	329.435	3.030	20	30		EGEDHN
Cc1nc(NC[C@H]2CCCN(C)[C@@H]2c2cccs2)ccc1C#N	ZINC000488062881	459537531	/nfs/dbraw/zinc/53/75/31/459537531.db2.gz	IEWIRJADAPOJSJ-QAPCUYQASA-N	0	3	326.469	3.240	20	30		EGEDHN
Cc1cccc([C@@H]2CCN(C[C@H](O)COc3ccc(C#N)cc3)C2)c1	ZINC000542319770	459548173	/nfs/dbraw/zinc/54/81/73/459548173.db2.gz	KBUUOOOFCDOXKN-UXHICEINSA-N	0	3	336.435	3.096	20	30		EGEDHN
C=CCn1cccc1C(=O)N(CC)Cc1ccc(CN(C)C)cc1	ZINC000488846007	459554214	/nfs/dbraw/zinc/55/42/14/459554214.db2.gz	XGWVJMDVBSYRDK-UHFFFAOYSA-N	0	3	325.456	3.398	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@@H]1CCCN(Cc2cccs2)C1	ZINC000488985167	459557828	/nfs/dbraw/zinc/55/78/28/459557828.db2.gz	QOTCHTKDCUCJJT-INIZCTEOSA-N	0	3	343.496	3.378	20	30		EGEDHN
CC[C@@H]1CCC[C@H](CN2CCN(c3nccnc3C#N)C[C@@H]2C)C1	ZINC000542465660	459559044	/nfs/dbraw/zinc/55/90/44/459559044.db2.gz	IAIULSSPSAAEST-BBWFWOEESA-N	0	3	327.476	3.075	20	30		EGEDHN
C=C(CNC(=O)N1CCN([C@@H]2C[C@@H]2C)C[C@H](C)C1)c1ccccc1	ZINC000491189447	459603834	/nfs/dbraw/zinc/60/38/34/459603834.db2.gz	VZMUUPBZRRVEBX-TXPKVOOTSA-N	0	3	327.472	3.072	20	30		EGEDHN
C#CCn1ccc(CN(CCOC)c2ccnc3ccc(C)cc32)n1	ZINC000491243743	459608980	/nfs/dbraw/zinc/60/89/80/459608980.db2.gz	YYBPLRTUSRFFMJ-UHFFFAOYSA-N	0	3	334.423	3.026	20	30		EGEDHN
CN(C)CCOc1ccc(-c2noc(-c3ccc(C#N)s3)n2)cc1	ZINC000573258851	459649923	/nfs/dbraw/zinc/64/99/23/459649923.db2.gz	VJBUNDVNMAUXIO-UHFFFAOYSA-N	0	3	340.408	3.277	20	30		EGEDHN
CC(C)N(C(=O)c1ccc(C#N)cn1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000592693997	459669121	/nfs/dbraw/zinc/66/91/21/459669121.db2.gz	HFZHABVWHOGCTE-IBGZPJMESA-N	0	3	348.450	3.078	20	30		EGEDHN
C#CCN(C)CCCNC(=S)Nc1ccc(SC(F)F)cc1	ZINC000491800494	459675788	/nfs/dbraw/zinc/67/57/88/459675788.db2.gz	AAUUDVGNRNRQPW-UHFFFAOYSA-N	0	3	343.468	3.243	20	30		EGEDHN
CC(C#N)C(=O)N(CCCNC(=O)OC(C)(C)C)Cc1ccccc1	ZINC000492260925	459697267	/nfs/dbraw/zinc/69/72/67/459697267.db2.gz	UKASBFNOACWBOB-HNNXBMFYSA-N	0	3	345.443	3.090	20	30		EGEDHN
C[C@@H]1CN(C(=O)C(C#N)CCc2ccccc2)CC2(CCCC2)O1	ZINC000592904948	459717736	/nfs/dbraw/zinc/71/77/36/459717736.db2.gz	UNVJHMFXEWFNPQ-SJLPKXTDSA-N	0	3	326.440	3.319	20	30		EGEDHN
C[C@@H]1CN(C(=O)C(C#N)CCc2ccccc2)CC2(CCCC2)O1	ZINC000592904930	459718448	/nfs/dbraw/zinc/71/84/48/459718448.db2.gz	UNVJHMFXEWFNPQ-AEFFLSMTSA-N	0	3	326.440	3.319	20	30		EGEDHN
C=CCCSCCNC(=O)N1CC[C@@H](N(C)Cc2ccccc2)C1	ZINC000596722034	459740271	/nfs/dbraw/zinc/74/02/71/459740271.db2.gz	OIDHNHHUCOWRDZ-GOSISDBHSA-N	0	3	347.528	3.212	20	30		EGEDHN
N#Cc1ccc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)cc1C#N	ZINC000593068523	459763208	/nfs/dbraw/zinc/76/32/08/459763208.db2.gz	PNANKQHACSJOFB-ZIAGYGMSSA-N	0	3	337.301	3.116	20	30		EGEDHN
CC(C)(C#N)CCCN1CCN(CCCC(C)(C)C#N)[C@H](CCO)C1	ZINC000564280525	459771964	/nfs/dbraw/zinc/77/19/64/459771964.db2.gz	FBUGJLTVBXTYDW-GOSISDBHSA-N	0	3	348.535	3.015	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H]2CC[C@@H]2c2ccc(F)cc2)CC1	ZINC000528446605	459807444	/nfs/dbraw/zinc/80/74/44/459807444.db2.gz	BMGRTKJQLWWQPD-MOPGFXCFSA-N	0	3	330.447	3.476	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCc2cccc(OCC)c2)CC1	ZINC000528447356	459807572	/nfs/dbraw/zinc/80/75/72/459807572.db2.gz	GSKZVTHYQAJESS-UHFFFAOYSA-N	0	3	330.472	3.175	20	30		EGEDHN
N#CC1(C[C@@H](O)CN2CCC[C@H]2c2nc3ccc(Cl)cc3[nH]2)CC1	ZINC000528500495	459809254	/nfs/dbraw/zinc/80/92/54/459809254.db2.gz	BSAFCUKURJPTJQ-CJNGLKHVSA-N	0	3	344.846	3.408	20	30		EGEDHN
Cc1ccc2occ(CC(=O)C(C#N)C(=O)NC3CCCCC3)c2c1	ZINC000528922262	459817214	/nfs/dbraw/zinc/81/72/14/459817214.db2.gz	XAVGYYISJCKVAD-KRWDZBQOSA-N	0	3	338.407	3.442	20	30		EGEDHN
CC[C@H](c1nnc(NC(=O)[C@H](N)CCCC#N)s1)c1ccccc1	ZINC000566179249	459820254	/nfs/dbraw/zinc/82/02/54/459820254.db2.gz	IWXBWEBHSZKNSS-UONOGXRCSA-N	0	3	343.456	3.040	20	30		EGEDHN
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCc1ccc(C#N)cc1C	ZINC000585755343	459841292	/nfs/dbraw/zinc/84/12/92/459841292.db2.gz	HIMGIIYWMOHVCO-OXJNMPFZSA-N	0	3	336.435	3.377	20	30		EGEDHN
CCCN(C(=O)[C@@H](C#N)CC)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000593446149	459892733	/nfs/dbraw/zinc/89/27/33/459892733.db2.gz	LSFNYSNIGSRZED-MOPGFXCFSA-N	0	3	327.472	3.439	20	30		EGEDHN
CC1(C)CN(C2(CNc3cc(C#N)ccn3)CCCCC2)CCO1	ZINC000587973685	459897118	/nfs/dbraw/zinc/89/71/18/459897118.db2.gz	NUKBZEXDCWCQAM-UHFFFAOYSA-N	0	3	328.460	3.179	20	30		EGEDHN
N#CC(C(=O)c1ccc2c(c1)[nH]c(=O)n2C1CCCC1)c1ccncn1	ZINC000546153765	459900887	/nfs/dbraw/zinc/90/08/87/459900887.db2.gz	WXMAFVIWGDNCPL-CQSZACIVSA-N	0	3	347.378	3.137	20	30		EGEDHN
Cc1cc(N2CCN(C3CCC3)C[C@@H](C)C2)c(C#N)cc1[N+](=O)[O-]	ZINC000575018987	459910359	/nfs/dbraw/zinc/91/03/59/459910359.db2.gz	GTEKPGYPXIEKIZ-CYBMUJFWSA-N	0	3	328.416	3.086	20	30		EGEDHN
CN(C)Cc1ccccc1CNC(=O)c1cc2ccccc2n1CC#N	ZINC000609161030	459916880	/nfs/dbraw/zinc/91/68/80/459916880.db2.gz	UWXXTPSEJYEUAB-UHFFFAOYSA-N	0	3	346.434	3.156	20	30		EGEDHN
CN(CCNC(=O)c1cc2ccccc2n1CC#N)Cc1ccccc1	ZINC000609166569	459918181	/nfs/dbraw/zinc/91/81/81/459918181.db2.gz	HEIUTOYPDGFQHT-UHFFFAOYSA-N	0	3	346.434	3.027	20	30		EGEDHN
N#CCCCCCC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000588150503	459920858	/nfs/dbraw/zinc/92/08/58/459920858.db2.gz	YMVFKJLISIVPAP-UHFFFAOYSA-N	0	3	327.472	3.284	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCc1cnccc1C(F)(F)F	ZINC000598571105	459943949	/nfs/dbraw/zinc/94/39/49/459943949.db2.gz	ZUKOPPRHANCTNH-CQSZACIVSA-N	0	3	347.340	3.489	20	30		EGEDHN
COc1cc2c(c(OC)c1OC)CCN(C[C@@H](C)CCC#N)CC2	ZINC000602485157	459963691	/nfs/dbraw/zinc/96/36/91/459963691.db2.gz	PMQAXNFAZBCJNY-AWEZNQCLSA-N	0	3	332.444	3.053	20	30		EGEDHN
COCCN(Cc1ccc(F)c(Cl)c1)C[C@@H](O)CC(C)(C)C#N	ZINC000598619555	459964389	/nfs/dbraw/zinc/96/43/89/459964389.db2.gz	DYLKDIKVZYMDLD-AWEZNQCLSA-N	0	3	342.842	3.228	20	30		EGEDHN
CCn1ccnc1[C@@H](C)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000593726381	459965009	/nfs/dbraw/zinc/96/50/09/459965009.db2.gz	ZNPXXHVRIJFKHG-MRXNPFEDSA-N	0	3	337.471	3.090	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN1CCC(c2ccc3cccnc3n2)CC1	ZINC000598622209	459967180	/nfs/dbraw/zinc/96/71/80/459967180.db2.gz	GGWJLHSDLVZHQF-QGZVFWFLSA-N	0	3	338.455	3.110	20	30		EGEDHN
C[C@H](C#N)CN(C)C(=O)N[C@@H](CN1CCCCC1)c1ccccc1	ZINC000609640192	460001630	/nfs/dbraw/zinc/00/16/30/460001630.db2.gz	ZRTBWCRHASDCKR-AEFFLSMTSA-N	0	3	328.460	3.015	20	30		EGEDHN
COc1ccccc1[C@H](CNC[C@H](O)CC(C)(C)C#N)OC(C)C	ZINC000598723453	460006183	/nfs/dbraw/zinc/00/61/83/460006183.db2.gz	HZJJFWARKJSBBG-QAPCUYQASA-N	0	3	334.460	3.052	20	30		EGEDHN
CC(C)(C)OC(=O)c1cccc(CNC[C@@H](O)CC(C)(C)C#N)c1	ZINC000598722925	460006338	/nfs/dbraw/zinc/00/63/38/460006338.db2.gz	BSNSXJLJJINFSO-INIZCTEOSA-N	0	3	332.444	3.032	20	30		EGEDHN
COCCCOc1cccc(CN[C@@H](C)CC2(C#N)CCOCC2)c1	ZINC000602580189	460008162	/nfs/dbraw/zinc/00/81/62/460008162.db2.gz	DYTGBYYLYVWYCB-KRWDZBQOSA-N	0	3	346.471	3.290	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CC[C@@](CO)(Cc2ccc(F)cc2)C1	ZINC000588984937	460015785	/nfs/dbraw/zinc/01/57/85/460015785.db2.gz	UZQVCGCINKOCQY-OAQYLSRUSA-N	0	3	338.426	3.433	20	30		EGEDHN
N#CC(C(=O)c1cnc2n1CCCCC2)c1nc(C2CC2)cs1	ZINC000621721549	460027328	/nfs/dbraw/zinc/02/73/28/460027328.db2.gz	SLBKVVOKLCGBFK-LBPRGKRZSA-N	0	3	326.425	3.433	20	30		EGEDHN
N#Cc1cccc(CN[C@H]2CCN(c3ccccc3C(F)(F)F)C2)n1	ZINC000602623679	460028416	/nfs/dbraw/zinc/02/84/16/460028416.db2.gz	YVMSDSRWWKHSQP-HNNXBMFYSA-N	0	3	346.356	3.341	20	30		EGEDHN
C[C@@H](CCC#N)CNc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1	ZINC000602656490	460046137	/nfs/dbraw/zinc/04/61/37/460046137.db2.gz	YSDCPWIKFMNOII-LPHOPBHVSA-N	0	3	342.487	3.205	20	30		EGEDHN
CCCN(CC(=O)Nc1ccc(C#N)cc1)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C	ZINC000610133513	460068051	/nfs/dbraw/zinc/06/80/51/460068051.db2.gz	XZDLXNKJISYGKI-UHOSZYNNSA-N	0	3	341.455	3.022	20	30		EGEDHN
N#CC[C@H]1CCCN(C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)C1	ZINC000597911391	460106062	/nfs/dbraw/zinc/10/60/62/460106062.db2.gz	LGCAPJXEEDRZNU-SJLPKXTDSA-N	0	3	343.446	3.190	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H](C)OCc2ccc(C)cc2)CC1	ZINC000625323161	460128118	/nfs/dbraw/zinc/12/81/18/460128118.db2.gz	QPNNDRYFVKBMLY-KRWDZBQOSA-N	0	3	330.472	3.057	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2N[C@@H]1CC(=O)N(c2ccccc2F)C1	ZINC000589729646	460133058	/nfs/dbraw/zinc/13/30/58/460133058.db2.gz	LUXNAYRIUZUILF-APWZRJJASA-N	0	3	349.409	3.470	20	30		EGEDHN
N#CCc1ccc(OC[C@H](O)CN2CCC(C3CCCC3)CC2)cc1	ZINC000610370873	460137876	/nfs/dbraw/zinc/13/78/76/460137876.db2.gz	SGILWEHXDPPQEG-HXUWFJFHSA-N	0	3	342.483	3.395	20	30		EGEDHN
C[C@@H]1CCc2c(F)cccc2[C@@H]1NCc1cnc2c(C#N)cnn2c1	ZINC000576466059	460147827	/nfs/dbraw/zinc/14/78/27/460147827.db2.gz	MKTJDPLGRRACBV-KZULUSFZSA-N	0	3	335.386	3.153	20	30		EGEDHN
C[C@@H](C(=O)N(CCN(C)C)Cc1cccc(C#N)c1)C1CCCC1	ZINC000610520787	460174137	/nfs/dbraw/zinc/17/41/37/460174137.db2.gz	WXRNIIVBBZRCQS-MRXNPFEDSA-N	0	3	327.472	3.275	20	30		EGEDHN
C[C@H](CC(=O)NCCc1ccccc1)N[C@H]1CCc2cc(C#N)ccc21	ZINC000618801372	460181767	/nfs/dbraw/zinc/18/17/67/460181767.db2.gz	AMMLVTVOUXKQKA-IERDGZPVSA-N	0	3	347.462	3.273	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)C(=O)N1CCCN(C2CCCC2)CC1	ZINC000594297175	460182950	/nfs/dbraw/zinc/18/29/50/460182950.db2.gz	CVHXPUAUMBYTEJ-KRWDZBQOSA-N	0	3	339.483	3.214	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CN(Cc1ccc(F)cc1)C1CC1	ZINC000599250468	460206145	/nfs/dbraw/zinc/20/61/45/460206145.db2.gz	NVHPCLCQNPVJCF-LJQANCHMSA-N	0	3	340.398	3.102	20	30		EGEDHN
N#Cc1ccc(SCC(=O)N[C@@H]2CCN(C3CCCCC3)C2)cc1	ZINC000598220461	460210366	/nfs/dbraw/zinc/21/03/66/460210366.db2.gz	PMKQPBLHPDEXJM-MRXNPFEDSA-N	0	3	343.496	3.174	20	30		EGEDHN
N#CCCCC[C@@H](N)C(=O)Nc1ncc(Cc2ccc(F)cc2)s1	ZINC000594424938	460213948	/nfs/dbraw/zinc/21/39/48/460213948.db2.gz	DZADVSAZZGSYPC-OAHLLOKOSA-N	0	3	346.431	3.223	20	30		EGEDHN
N#CCCCC[C@H](N)C(=O)Nc1cc(F)ccc1OCC(F)(F)F	ZINC000594426025	460215762	/nfs/dbraw/zinc/21/57/62/460215762.db2.gz	BZCXASNTZBVIHQ-NSHDSACASA-N	0	3	347.312	3.117	20	30		EGEDHN
C[C@H](NC1CCN(CC#N)CC1)c1sccc1Br	ZINC000610813240	460241213	/nfs/dbraw/zinc/24/12/13/460241213.db2.gz	AZXOXJSRFAGSJZ-JTQLQIEISA-N	0	3	328.279	3.149	20	30		EGEDHN
N#Cc1ccc(CCN[C@@H](Cc2ccccc2)[C@H](O)C(F)(F)F)cc1	ZINC000603146903	460254191	/nfs/dbraw/zinc/25/41/91/460254191.db2.gz	VQDBCNQIIFSIAN-ROUUACIJSA-N	0	3	348.368	3.225	20	30		EGEDHN
CC[C@H](CN1CCCC1)NC(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000610986443	460270941	/nfs/dbraw/zinc/27/09/41/460270941.db2.gz	RIPPXTOPLKDZOB-MSOLQXFVSA-N	0	3	328.460	3.205	20	30		EGEDHN
COc1ccc(CN2CC[C@H](N(C)Cc3ccccc3)C2)cc1C#N	ZINC000610994624	460274978	/nfs/dbraw/zinc/27/49/78/460274978.db2.gz	KZEJLRVUTANMLJ-FQEVSTJZSA-N	0	3	335.451	3.273	20	30		EGEDHN
C[C@@H]1CN(CCOc2cccc(C#N)c2)CC[C@@H]1C(=O)OC(C)(C)C	ZINC000599586148	460281077	/nfs/dbraw/zinc/28/10/77/460281077.db2.gz	HBCCCKHAORSXOG-QAPCUYQASA-N	0	3	344.455	3.237	20	30		EGEDHN
CCC(C#N)(CC)C(=O)NC[C@H](C1CC1)N(C)Cc1ccccc1	ZINC000599776601	460332007	/nfs/dbraw/zinc/33/20/07/460332007.db2.gz	DEGWJUPGMSMCRK-GOSISDBHSA-N	0	3	327.472	3.343	20	30		EGEDHN
COc1cc(NC(=O)N2CCCN(C(C)(C)C)CC2)c(F)cc1C#N	ZINC000599817319	460339887	/nfs/dbraw/zinc/33/98/87/460339887.db2.gz	JRLBMTNJATYUGJ-UHFFFAOYSA-N	0	3	348.422	3.044	20	30		EGEDHN
C[C@@H](NCCCS(=O)(=O)c1ccc(F)cc1)c1cccc(C#N)c1	ZINC000611389120	460352923	/nfs/dbraw/zinc/35/29/23/460352923.db2.gz	XGHCKGGFTLFIFO-CQSZACIVSA-N	0	3	346.427	3.212	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2NCc1cccc(-n2cncn2)c1	ZINC000611393666	460353429	/nfs/dbraw/zinc/35/34/29/460353429.db2.gz	ZIHORQCIFJKRDX-HXUWFJFHSA-N	0	3	329.407	3.306	20	30		EGEDHN
N#Cc1cccc(OC2CCN(Cc3cccc4n[nH]cc43)CC2)c1	ZINC000600111206	460386527	/nfs/dbraw/zinc/38/65/27/460386527.db2.gz	AIYLSAAQERLVOI-UHFFFAOYSA-N	0	3	332.407	3.478	20	30		EGEDHN
N#CC1(CCCN2CCC[C@@H](OCC(F)(F)F)C2)CCOCC1	ZINC000619620406	460399333	/nfs/dbraw/zinc/39/93/33/460399333.db2.gz	LOGTVGBUHGKGNY-CQSZACIVSA-N	0	3	334.382	3.130	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)c(Cl)c1)c1ccc(-n2cnnn2)cc1	ZINC000619755555	460431873	/nfs/dbraw/zinc/43/18/73/460431873.db2.gz	ZQYNOOVASFHXGI-LBPRGKRZSA-N	0	3	338.802	3.038	20	30		EGEDHN
C[C@@H](C1CCN(C)CC1)N(C)C(=O)NCc1ccc(C#N)c(Cl)c1	ZINC000619826092	460451514	/nfs/dbraw/zinc/45/15/14/460451514.db2.gz	GYKFXWMDFISJHZ-ZDUSSCGKSA-N	0	3	348.878	3.083	20	30		EGEDHN
C=CCOc1c(Cl)cc(CNC[C@@H](O)[C@@H](C)CC)cc1OC	ZINC000623417224	460538663	/nfs/dbraw/zinc/53/86/63/460538663.db2.gz	XHWBVLBTIREQIU-SWLSCSKDSA-N	0	3	327.852	3.410	20	30		EGEDHN
C[C@H]1CN(C)CC[C@@H]1N(C)C(=O)c1ccc(C#Cc2ccccc2)cc1	ZINC000607515871	460855322	/nfs/dbraw/zinc/85/53/22/460855322.db2.gz	ZLXJUAKRRRJAPM-AVRDEDQJSA-N	0	3	346.474	3.499	20	30		EGEDHN
COc1cc(C#N)ccc1NC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000613373067	460925582	/nfs/dbraw/zinc/92/55/82/460925582.db2.gz	CNMYPCNWZFXQLV-UHFFFAOYSA-N	0	3	349.434	3.418	20	30		EGEDHN
C[C@H](NC(=O)C(C#N)CCc1ccccc1)c1ccc2[nH]c(=O)oc2c1	ZINC000601864964	460930313	/nfs/dbraw/zinc/93/03/13/460930313.db2.gz	NLMVPVFHKZFRNB-BBRMVZONSA-N	0	3	349.390	3.483	20	30		EGEDHN
C=CC[C@@H]1CCCN(C(=O)[C@@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000617785276	460976991	/nfs/dbraw/zinc/97/69/91/460976991.db2.gz	IGCSLAQHZYMWGX-IEBWSBKVSA-N	0	3	327.472	3.108	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN(C)CCc2cnccn2)cc1OC	ZINC000628235288	461057446	/nfs/dbraw/zinc/05/74/46/461057446.db2.gz	GZIIUXCYMDMBPK-UHFFFAOYSA-N	0	3	347.846	3.378	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccn(C)c2-c2ccccc2)CC1	ZINC000668369900	461259897	/nfs/dbraw/zinc/25/98/97/461259897.db2.gz	HXTFPMOCESHGBP-UHFFFAOYSA-N	0	3	337.467	3.462	20	30		EGEDHN
CC#CC[C@H](CO)NCc1c(C)nn(-c2ccc(Cl)cc2)c1C	ZINC000641769684	461362383	/nfs/dbraw/zinc/36/23/83/461362383.db2.gz	XXZHUFUAYUWUPH-MRXNPFEDSA-N	0	3	331.847	3.006	20	30		EGEDHN
C=CCN(C(=O)NC[C@@H](N)c1ccc(C(C)C)cc1)[C@@H](C)COC	ZINC000659510900	461370140	/nfs/dbraw/zinc/37/01/40/461370140.db2.gz	CMHXRLWGMPIOPH-MAUKXSAKSA-N	0	3	333.476	3.042	20	30		EGEDHN
C=CCN(CCC(=O)NCc1cnc(C)s1)Cc1ccccc1	ZINC000639439738	461923759	/nfs/dbraw/zinc/92/37/59/461923759.db2.gz	QCNMURHMXBIGKX-UHFFFAOYSA-N	0	3	329.469	3.146	20	30		EGEDHN
C=CCCn1cc(CNC[C@@H]2CCCO[C@@H]2c2ccccc2)nn1	ZINC000657329576	462051262	/nfs/dbraw/zinc/05/12/62/462051262.db2.gz	RYHKAGMDXDCRTE-PKOBYXMFSA-N	0	3	326.444	3.112	20	30		EGEDHN
C=CCCn1cc(CNCC(C)(C)N[C@@H](C)c2ccccc2)nn1	ZINC000657365730	462074848	/nfs/dbraw/zinc/07/48/48/462074848.db2.gz	GDIYSWCMWJQHBJ-INIZCTEOSA-N	0	3	327.476	3.073	20	30		EGEDHN
C=CCN(Cc1ccc(OCc2nccn2C)cc1)[C@H](C)COC	ZINC000661242055	462166014	/nfs/dbraw/zinc/16/60/14/462166014.db2.gz	IURSGNGWNWDKEL-MRXNPFEDSA-N	0	3	329.444	3.022	20	30		EGEDHN
C=CC[C@@H]1CCCN([C@@H](C)C(=O)Nc2ccc(OC)c(OC)c2)C1	ZINC000661379971	462225755	/nfs/dbraw/zinc/22/57/55/462225755.db2.gz	KBYFYEVCJBGCOB-LSDHHAIUSA-N	0	3	332.444	3.319	20	30		EGEDHN
C=C1CCN(C(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)CC1	ZINC000264485291	534460381	/nfs/dbraw/zinc/46/03/81/534460381.db2.gz	MUHFQNQFDIEPLH-UHFFFAOYSA-N	0	3	327.472	3.009	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]2CN(Cc3ccc(C#N)o3)C[C@H]21	ZINC000363844127	534894535	/nfs/dbraw/zinc/89/45/35/534894535.db2.gz	IAESLMUXPUOEGE-KBRIMQKVSA-N	0	3	345.443	3.276	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H](C)CCOc2ccccc2)CC1	ZINC000174296069	526595856	/nfs/dbraw/zinc/59/58/56/526595856.db2.gz	LRLFOPTUQXYEJP-KRWDZBQOSA-N	0	3	330.472	3.248	20	30		EGEDHN
C#CCCCCNC(=O)N1CCCN(CCCc2ccccc2)CC1	ZINC000154958924	526697687	/nfs/dbraw/zinc/69/76/87/526697687.db2.gz	DASYFNZJTLGFGU-UHFFFAOYSA-N	0	3	341.499	3.140	20	30		EGEDHN
C=CCOc1cccc(CN2CCC3(CC2)[C@H](O)C[C@H]3OCC)c1	ZINC000130230937	526898818	/nfs/dbraw/zinc/89/88/18/526898818.db2.gz	PRGUUGIADZOIII-RTBURBONSA-N	0	3	331.456	3.003	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC(CN2C[C@@H](C)O[C@H](C)C2)CC1	ZINC000130008163	527023907	/nfs/dbraw/zinc/02/39/07/527023907.db2.gz	GUWNKYYGZQAONA-IAGOWNOFSA-N	0	3	334.504	3.103	20	30		EGEDHN
CC1CCN([C@@H](CNC(=O)c2cc(C#N)c[nH]2)c2cccs2)CC1	ZINC000175095146	528260570	/nfs/dbraw/zinc/26/05/70/528260570.db2.gz	QNVKDKSBEPIMDS-INIZCTEOSA-N	0	3	342.468	3.151	20	30		EGEDHN
CC(C)OC(=O)C[C@@H]1CCCN(CCCOc2cccc(C#N)c2)C1	ZINC000184488062	535302504	/nfs/dbraw/zinc/30/25/04/535302504.db2.gz	LGTKACPBVNAMSE-SFHVURJKSA-N	0	3	344.455	3.381	20	30		EGEDHN
CCN1CCC(NC(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)CC1	ZINC000266127078	535471100	/nfs/dbraw/zinc/47/11/00/535471100.db2.gz	QHYIXWYKFJFUSU-UHFFFAOYSA-N	0	3	340.349	3.183	20	30		EGEDHN
CCCN1CCC[C@H]1CNC(=O)[C@@H]1CCCN1C(=O)c1ccccc1	ZINC000329215216	547491934	/nfs/dbraw/zinc/49/19/34/547491934.db2.gz	MIVQBFXEWNAOMF-ROUUACIJSA-N	0	3	343.471	3.122	20	30		EGEDHN
C=C(CNC(=O)N[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1	ZINC000672682457	548462025	/nfs/dbraw/zinc/46/20/25/548462025.db2.gz	KJFZWNXKXJHYDX-FQEVSTJZSA-N	0	3	335.451	3.274	20	30		EGEDHN
CCn1nccc1C(=O)C(C#N)c1nc2ccccc2n1C(F)F	ZINC000681352734	549985717	/nfs/dbraw/zinc/98/57/17/549985717.db2.gz	QPQXLCSANFWMJJ-JTQLQIEISA-N	0	3	329.310	3.138	20	30		EGEDHN
CC(C)N1CCC(NC(=S)Nc2ccc(C#N)c(Cl)c2)CC1	ZINC000726447166	574554180	/nfs/dbraw/zinc/55/41/80/574554180.db2.gz	NCOLBRZIGKRSIW-UHFFFAOYSA-N	0	3	336.892	3.371	20	30		EGEDHN
C=CCSc1nc2ccccc2n1CN(CC)CCC(=O)OC	ZINC000738095608	574729980	/nfs/dbraw/zinc/72/99/80/574729980.db2.gz	AGPCSLCRIVXEGZ-UHFFFAOYSA-N	0	3	333.457	3.157	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CNC[C@H](c2ccsc2)N(C)C)cc1	ZINC000728712898	574767715	/nfs/dbraw/zinc/76/77/15/574767715.db2.gz	CAZXIDCGUVRCLB-RDTXWAMCSA-N	0	3	329.469	3.431	20	30		EGEDHN
C[C@@H]1CCCC1=NNC(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000729140234	574818382	/nfs/dbraw/zinc/81/83/82/574818382.db2.gz	BWZFFDOQCGUTGU-OAHLLOKOSA-N	0	3	344.528	3.291	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cc(C)c(Cl)cc2OC)CC1	ZINC000730124720	574922136	/nfs/dbraw/zinc/92/21/36/574922136.db2.gz	CQZVSEUYMOREKD-UHFFFAOYSA-N	0	3	337.851	3.429	20	30		EGEDHN
CN(C)CCOc1ccc(N(C)C(=O)/C=C\c2ccccc2C#N)cc1	ZINC000732004263	575230662	/nfs/dbraw/zinc/23/06/62/575230662.db2.gz	JCUDSMDKGNLNPZ-JYRVWZFOSA-N	0	3	349.434	3.175	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)/C=C\c1cncc(F)c1)C(C)C	ZINC000733162507	575311946	/nfs/dbraw/zinc/31/19/46/575311946.db2.gz	ZPIJQYZANLYVPA-JTHGQSKGSA-N	0	3	331.435	3.049	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)/C=C\c1cnc(C)s1)C(C)C	ZINC000733161807	575312375	/nfs/dbraw/zinc/31/23/75/575312375.db2.gz	QDBUNLCCFHGIAM-JJEJIETFSA-N	0	3	333.501	3.280	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)CO[C@@H]2CCCC[C@H]2C)cc1	ZINC000733678872	575381265	/nfs/dbraw/zinc/38/12/65/575381265.db2.gz	MLXAECFQWSBDGH-LSBZLQRGSA-N	0	3	342.439	3.492	20	30		EGEDHN
C=CC[C@H](NC(=O)NC[C@@H](C)N1CCCC[C@H]1C)c1ccncc1	ZINC000734658889	575533183	/nfs/dbraw/zinc/53/31/83/575533183.db2.gz	NDFWHCDCZCNHHX-NUJGCVRESA-N	0	3	330.476	3.261	20	30		EGEDHN
C[C@H](CC(=O)C(C#N)C(=O)NC1CCCCC1)c1cccc(F)c1	ZINC000734964740	575582404	/nfs/dbraw/zinc/58/24/04/575582404.db2.gz	ZUXYGGYOINCEOO-DYVFJYSZSA-N	0	3	330.403	3.477	20	30		EGEDHN
CC[C@H](C#N)Oc1cccc(CNC(=O)[C@@H](CC)N(CC)CC)c1	ZINC000736018428	575752022	/nfs/dbraw/zinc/75/20/22/575752022.db2.gz	BXADCNRQMFPYTG-SJLPKXTDSA-N	0	3	331.460	3.104	20	30		EGEDHN
C#CCCN1CCC(NC(=O)CCCc2c[nH]c3ccccc23)CC1	ZINC000740737638	576621654	/nfs/dbraw/zinc/62/16/54/576621654.db2.gz	GSTFQSHVIKCTAN-UHFFFAOYSA-N	0	3	337.467	3.095	20	30		EGEDHN
C#CCOc1cc(F)ccc1NC(=O)NCCN1CCCC[C@@H]1CC	ZINC000743199766	576803162	/nfs/dbraw/zinc/80/31/62/576803162.db2.gz	PEFSUFNYHMDACO-INIZCTEOSA-N	0	3	347.434	3.224	20	30		EGEDHN
C#CCOc1cc(F)ccc1NC(=O)N1CCCN(C(C)(C)C)CC1	ZINC000743199582	576803187	/nfs/dbraw/zinc/80/31/87/576803187.db2.gz	HOCLYLSTLSPIKS-UHFFFAOYSA-N	0	3	347.434	3.176	20	30		EGEDHN
C#CCCN1CCC(NC(=O)[C@@H](CC(C)C)c2ccccc2)CC1	ZINC000743489929	576810259	/nfs/dbraw/zinc/81/02/59/576810259.db2.gz	MRMJQHHMVBPAGQ-FQEVSTJZSA-N	0	3	326.484	3.420	20	30		EGEDHN
C#CCCN1CCC(NC(=O)C[C@H](c2ccccc2)C(C)C)CC1	ZINC000743491824	576810306	/nfs/dbraw/zinc/81/03/06/576810306.db2.gz	MLIGYRIQXKWOPX-FQEVSTJZSA-N	0	3	326.484	3.420	20	30		EGEDHN
C#CCCCNC(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1	ZINC000743692513	576814777	/nfs/dbraw/zinc/81/47/77/576814777.db2.gz	DQTVXFXQBJIOIG-LJQANCHMSA-N	0	3	327.472	3.172	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)[C@H](C)c2ccc(C)o2)c1	ZINC000744027046	576819082	/nfs/dbraw/zinc/81/90/82/576819082.db2.gz	GRNQXOXNYDECDA-IUODEOHRSA-N	0	3	326.352	3.048	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)[C@H](C)c1ccc(C)o1	ZINC000744031734	576819288	/nfs/dbraw/zinc/81/92/88/576819288.db2.gz	BTFVRNSCWGQQNF-OLZOCXBDSA-N	0	3	326.352	3.048	20	30		EGEDHN
C[C@@H]1CCCN(Cc2cc(=O)n3c4ccccc4[nH]c3c2C#N)CC1	ZINC000745170920	576842902	/nfs/dbraw/zinc/84/29/02/576842902.db2.gz	VAGPJTGWUKZCKH-ZBFHGGJFSA-N	0	3	334.423	3.346	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CNCc2ccc([S@](C)=O)cc2)cc1	ZINC000751151810	1299516883	/nfs/dbraw/zinc/51/68/83/1299516883.db2.gz	FYFDPDXYIYFVML-FATZIPQQSA-N	0	3	328.437	3.005	20	30		EGEDHN
COCCN(Cc1ccc(C#N)cc1)C[C@H](O)c1ccc(Cl)cc1	ZINC000069072036	1292229723	/nfs/dbraw/zinc/22/97/23/1292229723.db2.gz	VWFBBCWJHJDAOS-IBGZPJMESA-N	0	3	344.842	3.394	20	30		EGEDHN
CCOC(=O)N[C@H](C(=O)C(C#N)c1nc(C(C)C)cs1)C(C)C	ZINC000080458210	1292604811	/nfs/dbraw/zinc/60/48/11/1292604811.db2.gz	CIRCYIRDEMOENB-YPMHNXCESA-N	0	3	337.445	3.213	20	30		EGEDHN
C#CCOc1ccc([C@@H](C)NCc2ccc([S@@](C)=O)cc2)cc1	ZINC000090221440	1292791298	/nfs/dbraw/zinc/79/12/98/1292791298.db2.gz	TXTJIRVTXNKUBO-CMJOXMDJSA-N	0	3	327.449	3.287	20	30		EGEDHN
C#CCOc1ccccc1CN1CCC[C@H]1C[C@H](O)c1ccco1	ZINC000091958672	1292850179	/nfs/dbraw/zinc/85/01/79/1292850179.db2.gz	BIKMKHVGQRIVCI-ROUUACIJSA-N	0	3	325.408	3.380	20	30		EGEDHN
CCCCCCCC(=O)NCc1ccc(CN2CCN(C)CC2)cc1	ZINC000105301150	1293031952	/nfs/dbraw/zinc/03/19/52/1293031952.db2.gz	BHXCKRFCTYXWHO-UHFFFAOYSA-N	0	3	345.531	3.411	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)c1cccc(CC)n1	ZINC000835063467	1293196410	/nfs/dbraw/zinc/19/64/10/1293196410.db2.gz	YYRYMQCHCQKYSK-AWEZNQCLSA-N	0	3	337.379	3.004	20	30		EGEDHN
C#CCOc1ccccc1CNC[C@H](O)c1cccc(OC(C)C)c1	ZINC000116925634	1293212110	/nfs/dbraw/zinc/21/21/10/1293212110.db2.gz	XCUGXPSTOJZMNU-FQEVSTJZSA-N	0	3	339.435	3.309	20	30		EGEDHN
CC[C@H](C)[C@H](NC(=O)OC)C(=O)C(C#N)c1nc(C(C)C)cs1	ZINC000835200475	1293232245	/nfs/dbraw/zinc/23/22/45/1293232245.db2.gz	KHVIODBBILNRCC-LOWVWBTDSA-N	0	3	337.445	3.213	20	30		EGEDHN
CC[C@H](CC(F)(F)F)C(=O)C(C#N)C(=O)NCc1cccc(C)c1	ZINC000835340519	1293268548	/nfs/dbraw/zinc/26/85/48/1293268548.db2.gz	NGHCSGIHYKTJLL-KGLIPLIRSA-N	0	3	340.345	3.299	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN2CCN(CCc3ccccc3)CC2)cc1	ZINC000122314119	1293407961	/nfs/dbraw/zinc/40/79/61/1293407961.db2.gz	CHSUMVDPXYSTJD-IBGZPJMESA-N	0	3	349.478	3.338	20	30		EGEDHN
N#CC(C(=O)COc1ccccc1-c1ccccc1)C(=O)N1CCCC1	ZINC000124443499	1293475170	/nfs/dbraw/zinc/47/51/70/1293475170.db2.gz	CLRPTQYULLAAAO-GOSISDBHSA-N	0	3	348.402	3.064	20	30		EGEDHN
N#CC(C(=O)COc1ccc(F)c(Cl)c1)C(=O)Nc1ccccc1	ZINC000128207244	1293586049	/nfs/dbraw/zinc/58/60/49/1293586049.db2.gz	ZKSIAOLVDCLPCL-ZDUSSCGKSA-N	0	3	346.745	3.205	20	30		EGEDHN
CC[C@@H](SC)C(=O)C(C#N)C(=O)Nc1ccc(OC)c(Cl)c1	ZINC000156513253	1294146981	/nfs/dbraw/zinc/14/69/81/1294146981.db2.gz	SBKSATGFKWGXGK-GXFFZTMASA-N	0	3	340.832	3.138	20	30		EGEDHN
C[C@H](CCOc1ccccc1)C(=O)C(C#N)C(=O)Nc1ccccc1	ZINC000173968262	1294474821	/nfs/dbraw/zinc/47/48/21/1294474821.db2.gz	YUBYLPYMXQYZDJ-QAPCUYQASA-N	0	3	336.391	3.439	20	30		EGEDHN
N#CC(C(=O)CC[C@H]1CCOC1)C(=O)Nc1cccc2ccccc21	ZINC000176092517	1294590783	/nfs/dbraw/zinc/59/07/83/1294590783.db2.gz	KALBUSSCGOSTFT-WMLDXEAASA-N	0	3	336.391	3.304	20	30		EGEDHN
CC[C@H](NCC(=O)N(CCC#N)c1ccc(C)c(C)c1)[C@@H]1CCCO1	ZINC000182241692	1295029983	/nfs/dbraw/zinc/02/99/83/1295029983.db2.gz	KYAQHXPJBSGOFP-OALUTQOASA-N	0	3	343.471	3.097	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@H](NCC#Cc1ccc(F)cc1)C1CC1	ZINC000185194381	1295246386	/nfs/dbraw/zinc/24/63/86/1295246386.db2.gz	SLYWPOYUVIOJCK-QGZVFWFLSA-N	0	3	332.419	3.070	20	30		EGEDHN
Cc1cc(C)c(OCC(=O)C(C#N)C(=O)Nc2ccccc2)c(C)c1	ZINC000193441481	1295869366	/nfs/dbraw/zinc/86/93/66/1295869366.db2.gz	HHZSEHGZMKNSCB-KRWDZBQOSA-N	0	3	336.391	3.338	20	30		EGEDHN
N#CC(C(=O)C[C@@H]1CCCO1)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000193481685	1295875170	/nfs/dbraw/zinc/87/51/70/1295875170.db2.gz	BLNOFRFBYMPTLO-STQMWFEESA-N	0	3	341.194	3.210	20	30		EGEDHN
CC[C@@H](C)c1ccc(NC(=O)C(C#N)C(=O)COCC2CC2)cc1	ZINC000193492979	1295877976	/nfs/dbraw/zinc/87/79/76/1295877976.db2.gz	QVHBUXDRKMNCHD-CXAGYDPISA-N	0	3	328.412	3.274	20	30		EGEDHN
CO[C@H](C)CC(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000195492280	1296072348	/nfs/dbraw/zinc/07/23/48/1296072348.db2.gz	XITXZGZFRGGLME-PSASIEDQSA-N	0	3	329.183	3.066	20	30		EGEDHN
C#CCOc1ccc(Br)cc1CNCCOCCC=C	ZINC000229880221	1296159299	/nfs/dbraw/zinc/15/92/99/1296159299.db2.gz	DNSUUAUVKMDARG-UHFFFAOYSA-N	0	3	338.245	3.143	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CNCc2ccc(-n3cccn3)cc2)cc1	ZINC000237599846	1296252302	/nfs/dbraw/zinc/25/23/02/1296252302.db2.gz	QKSVOLMNDXVZNX-MRXNPFEDSA-N	0	3	332.407	3.453	20	30		EGEDHN
N#CC(C(=O)NC1CCCCC1)C(=O)[C@@H]1C[C@H]1c1c(F)cccc1F	ZINC000247010097	1296380078	/nfs/dbraw/zinc/38/00/78/1296380078.db2.gz	MHQAZSZFZMZVDR-MCIONIFRSA-N	0	3	346.377	3.226	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CNC[C@H](O)c2c(F)cccc2F)cc1	ZINC000304344037	1296922672	/nfs/dbraw/zinc/92/26/72/1296922672.db2.gz	ZESVBIGXZUWNJM-SJCJKPOMSA-N	0	3	332.350	3.079	20	30		EGEDHN
CN1CCCC[C@@H]1CNc1cc(Br)c(C#N)cc1F	ZINC000311507981	1297108910	/nfs/dbraw/zinc/10/89/10/1297108910.db2.gz	QUHUOLZPFKIPMH-LLVKDONJSA-N	0	3	326.213	3.356	20	30		EGEDHN
C=CCOc1cc(OC)ccc1-c1nc([C@@H]2CN3CCC2CC3)no1	ZINC000350067426	1297389038	/nfs/dbraw/zinc/38/90/38/1297389038.db2.gz	OURRLEWABISTGB-MRXNPFEDSA-N	0	3	341.411	3.119	20	30		EGEDHN
C[C@H](NC(=O)/C=C\c1ccccc1C#N)[C@@H](c1ccccc1)N(C)C	ZINC000588490417	1298073884	/nfs/dbraw/zinc/07/38/84/1298073884.db2.gz	WZOMXOPPZBSBBU-SJHCLKHRSA-N	0	3	333.435	3.379	20	30		EGEDHN
C[C@H]1CCN(Cc2ccccc2)C[C@H]1NC(=O)c1cccc(C#N)c1	ZINC000716261101	1298296312	/nfs/dbraw/zinc/29/63/12/1298296312.db2.gz	DBXNQWJNWANRTQ-OXJNMPFZSA-N	0	3	333.435	3.199	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]\[C@H]2CCN(CC(F)(F)F)C2)c([O-])c1	ZINC000747032968	1298712647	/nfs/dbraw/zinc/71/26/47/1298712647.db2.gz	LEZKQEHEMUSDDZ-LKEIMFIWSA-N	0	3	343.393	3.294	20	30		EGEDHN
C=C(Cl)C[C@@H](N)C(=O)N(C)Cc1ccccc1OC(F)(F)F	ZINC000876575017	1298840407	/nfs/dbraw/zinc/84/04/07/1298840407.db2.gz	RODUHDLXLYYOKM-LLVKDONJSA-N	0	3	336.741	3.014	20	30		EGEDHN
Cc1ccc(C[NH+]2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c([O-])c1	ZINC000876658724	1298903117	/nfs/dbraw/zinc/90/31/17/1298903117.db2.gz	DLXQZWVPMRQVAX-UHFFFAOYSA-N	0	3	349.434	3.423	20	30		EGEDHN
C=CC[C@@H](NCc1ccc(N2CCC(O)CC2)cc1)c1ccncc1	ZINC000877045799	1299129529	/nfs/dbraw/zinc/12/95/29/1299129529.db2.gz	CNVWDCDWWWBAGS-OAQYLSRUSA-N	0	3	337.467	3.450	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN2CC[C@@H](OCc3ccccn3)C2)cc1	ZINC000877645746	1299453290	/nfs/dbraw/zinc/45/32/90/1299453290.db2.gz	VGFGZIQCSIDOJA-OXQOHEQNSA-N	0	3	337.423	3.164	20	30		EGEDHN
CCOC(=O)c1sc(C2CCN([C@H]3CC[C@H](C#N)C3)CC2)nc1C	ZINC000879679276	1300672644	/nfs/dbraw/zinc/67/26/44/1300672644.db2.gz	JCJYGWFDAQEYBW-ZFWWWQNUSA-N	0	3	347.484	3.500	20	30		EGEDHN
CCO[C@@H](CC(=O)C(C#N)C(=O)Nc1ccccc1Cl)C(C)C	ZINC000761038030	1301386244	/nfs/dbraw/zinc/38/62/44/1301386244.db2.gz	PXNIFHWBAWDKDB-WBMJQRKESA-N	0	3	336.819	3.439	20	30		EGEDHN
C[C@H]1CN(C2CC2)C[C@@H]1Nc1nccc(Oc2cccc(C#N)c2)n1	ZINC000882083545	1301820018	/nfs/dbraw/zinc/82/00/18/1301820018.db2.gz	BTXJLDICWGALRH-GUYCJALGSA-N	0	3	335.411	3.035	20	30		EGEDHN
Cc1nc(C#N)cc(NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)n1	ZINC000882373325	1301936648	/nfs/dbraw/zinc/93/66/48/1301936648.db2.gz	RHKOOEYTGBSGMN-SFHVURJKSA-N	0	3	339.443	3.159	20	30		EGEDHN
CC[C@H](C)c1ccc(NC(=O)C(C#N)C(=O)[C@@H]2C[C@]23CCOC3)cc1	ZINC000764755346	1302127415	/nfs/dbraw/zinc/12/74/15/1302127415.db2.gz	FDTKOYJSHXYWAW-RFHZUNJHSA-N	0	3	340.423	3.274	20	30		EGEDHN
CCCCCCCN1C(=O)N[C@@]2(CCN(Cc3ccccc3)C2)C1=O	ZINC000767143157	1302591563	/nfs/dbraw/zinc/59/15/63/1302591563.db2.gz	FWPDASSUVZORLY-HXUWFJFHSA-N	0	3	343.471	3.153	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](Cc2ccccc2)C(C)C)CC1	ZINC000884161236	1302758942	/nfs/dbraw/zinc/75/89/42/1302758942.db2.gz	ABSGHCRSOVISIM-IBGZPJMESA-N	0	3	329.488	3.203	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(Cc3ccc4c(c3)COC4)CC2)cc1	ZINC000768219014	1302859046	/nfs/dbraw/zinc/85/90/46/1302859046.db2.gz	FWPJYSLNUSHTCB-UHFFFAOYSA-N	0	3	347.462	3.296	20	30		EGEDHN
CCCCCCN(CCN1CCOCC1)Cc1cc(C#N)cs1	ZINC000769105391	1303048641	/nfs/dbraw/zinc/04/86/41/1303048641.db2.gz	BSKYHFPOPAGTGN-UHFFFAOYSA-N	0	3	335.517	3.334	20	30		EGEDHN
C#CCN(Cc1c(C)nn(CC(=O)OC(C)C)c1C)C1CCCCC1	ZINC000769145637	1303056128	/nfs/dbraw/zinc/05/61/28/1303056128.db2.gz	KYENMXMFIBTATB-UHFFFAOYSA-N	0	3	345.487	3.219	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccccc2Oc2ccccn2)CC1	ZINC000885665712	1303227151	/nfs/dbraw/zinc/22/71/51/1303227151.db2.gz	AQYRUXZQFBUHSO-UHFFFAOYSA-N	0	3	335.407	3.158	20	30		EGEDHN
C=CCC1(O)CCN(C[C@@H](O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000886762393	1303589369	/nfs/dbraw/zinc/58/93/69/1303589369.db2.gz	YCZTWTYKBKJXSV-OAHLLOKOSA-N	0	3	329.362	3.142	20	30		EGEDHN
C=CCC1(O)CCN(Cc2cc(=O)oc3cc4c(cc23)CCC4)CC1	ZINC000886768433	1303591190	/nfs/dbraw/zinc/59/11/90/1303591190.db2.gz	ASLKHBIRZQNTCC-UHFFFAOYSA-N	0	3	339.435	3.185	20	30		EGEDHN
Cc1cc(CN2CC[C@@H](CNC(=O)OC(C)(C)C)C2)ccc1C#N	ZINC000774861864	1303868250	/nfs/dbraw/zinc/86/82/50/1303868250.db2.gz	FPTHQIPPLNOFGE-INIZCTEOSA-N	0	3	329.444	3.213	20	30		EGEDHN
N#C[C@H](OC(=O)C1CCN(c2ccc(F)cc2)C1=O)C1CCCCC1	ZINC000776378041	1304143821	/nfs/dbraw/zinc/14/38/21/1304143821.db2.gz	HYCSMEYRDPWMPK-SJORKVTESA-N	0	3	344.386	3.194	20	30		EGEDHN
CC1(C)CC(N=Nc2cc(Cl)nc(N)n2)CN1Cc1ccccc1	ZINC000778546757	1304462765	/nfs/dbraw/zinc/46/27/65/1304462765.db2.gz	NQSRWFPLTGMMFP-UHFFFAOYSA-N	0	3	344.850	3.165	20	30		EGEDHN
C=CC[C@H](CO)C[NH2+][C@H](C)c1cc(Br)cc(C)c1[O-]	ZINC000779040723	1304521889	/nfs/dbraw/zinc/52/18/89/1304521889.db2.gz	KNRPOGGGOMLAKF-NEPJUHHUSA-N	0	3	328.250	3.298	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N1CC[C@H](N2CC(=O)Nc3ccccc32)C1	ZINC000782194139	1304928550	/nfs/dbraw/zinc/92/85/50/1304928550.db2.gz	LLWXAPXULUCVGZ-YJBOKZPZSA-N	0	3	346.434	3.152	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(Cl)cc1)C(=O)[C@@H]1CCOC2(CCC2)C1	ZINC000892493777	1305405026	/nfs/dbraw/zinc/40/50/26/1305405026.db2.gz	RWWRDHQROPDMJE-DOMZBBRYSA-N	0	3	346.814	3.337	20	30		EGEDHN
Cc1cccc(CNC(=O)C(C#N)C(=O)CCCc2ccsc2)c1	ZINC000786539959	1305594378	/nfs/dbraw/zinc/59/43/78/1305594378.db2.gz	FZEKJTGTCBKTCF-QGZVFWFLSA-N	0	3	340.448	3.405	20	30		EGEDHN
N#CC(C(=O)CCC1CCCC1)C(=O)NCc1ccc(F)c(F)c1	ZINC000786571645	1305602654	/nfs/dbraw/zinc/60/26/54/1305602654.db2.gz	YHBGVHZIIZAGDU-CQSZACIVSA-N	0	3	334.366	3.260	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2c(F)ccc(F)c2Cl)C1	ZINC001020623058	1317808035	/nfs/dbraw/zinc/80/80/35/1317808035.db2.gz	KJZSNCWMBHYBBM-KYZUINATSA-N	0	3	335.181	3.221	20	30		EGEDHN
N#CC(C(=O)CCc1ccccc1C(N)=O)c1ccc2ccccc2n1	ZINC000796627755	1310048915	/nfs/dbraw/zinc/04/89/15/1310048915.db2.gz	DGPTWVNVFGVDRC-KRWDZBQOSA-N	0	3	343.386	3.143	20	30		EGEDHN
C#CCN(CCC(=O)N1CCc2sccc2C1)Cc1ccccc1	ZINC000796640329	1310053317	/nfs/dbraw/zinc/05/33/17/1310053317.db2.gz	XSSHJRZGXKUHJW-UHFFFAOYSA-N	0	3	338.476	3.158	20	30		EGEDHN
C[C@H](NCc1ccc(C[S@@](C)=O)cc1)c1ccc(OCC#N)cc1	ZINC000797135636	1310145581	/nfs/dbraw/zinc/14/55/81/1310145581.db2.gz	YKORLIXQRSHUIE-IZHWHUGBSA-N	0	3	342.464	3.318	20	30		EGEDHN
C[C@@H](NC(=O)C(C)(C)C)C(=O)C(C#N)c1ncc(C(C)(C)C)s1	ZINC000797571481	1310214117	/nfs/dbraw/zinc/21/41/17/1310214117.db2.gz	RZLGPEWVIXJUHT-MNOVXSKESA-N	0	3	335.473	3.168	20	30		EGEDHN
Cc1noc(C[C@@H]2CCCN(Cc3ccc(O[C@@H](C)C#N)cc3)C2)n1	ZINC000897579075	1310392024	/nfs/dbraw/zinc/39/20/24/1310392024.db2.gz	NUEDZXQYPJEAEA-YOEHRIQHSA-N	0	3	340.427	3.124	20	30		EGEDHN
Cc1noc(C[C@@H]2CCCN(Cc3ccc(O[C@H](C)C#N)cc3)C2)n1	ZINC000897579072	1310392367	/nfs/dbraw/zinc/39/23/67/1310392367.db2.gz	NUEDZXQYPJEAEA-PBHICJAKSA-N	0	3	340.427	3.124	20	30		EGEDHN
COc1cc(CNC[C@H]2COC3(CCCCCC3)O2)ccc1C#N	ZINC000799340838	1310529187	/nfs/dbraw/zinc/52/91/87/1310529187.db2.gz	KMNQEUSWKCYMJY-KRWDZBQOSA-N	0	3	330.428	3.122	20	30		EGEDHN
N#C[C@@H]1CC[C@H]([NH2+][C@H]2CCCN(Cc3cc(Cl)ccc3[O-])C2)C1	ZINC000799718040	1310604796	/nfs/dbraw/zinc/60/47/96/1310604796.db2.gz	ZJHBLONDNNOVLK-COXVUDFISA-N	0	3	333.863	3.292	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)[C@@H]1CCCC(F)(F)C1	ZINC000800386486	1310747106	/nfs/dbraw/zinc/74/71/06/1310747106.db2.gz	KTIDHGVSKLUYPT-NEPJUHHUSA-N	0	3	336.338	3.168	20	30		EGEDHN
Cc1cccc(CNC(=O)C(C#N)C(=O)[C@@H]2CCCC(F)(F)C2)c1	ZINC000800409207	1310750159	/nfs/dbraw/zinc/75/01/59/1310750159.db2.gz	KEELYUYVEMUWSL-CABCVRRESA-N	0	3	334.366	3.146	20	30		EGEDHN
C#CCN1CCC[C@H](CNC(=O)c2c(Cl)cccc2Cl)C1	ZINC001023717187	1319852963	/nfs/dbraw/zinc/85/29/63/1319852963.db2.gz	FQXCRDQTIPRMNI-GFCCVEGCSA-N	0	3	325.239	3.068	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N(C)Cc1ccc(Cl)c(Cl)c1	ZINC000836487876	1320493951	/nfs/dbraw/zinc/49/39/51/1320493951.db2.gz	SEMTUUNFSOMWPT-UHFFFAOYSA-N	0	3	342.270	3.090	20	30		EGEDHN
Cc1ccc(C#N)cc1C(=O)NC[C@@H](c1ccccc1)N1CCCC1	ZINC000929469842	1328606753	/nfs/dbraw/zinc/60/67/53/1328606753.db2.gz	QONLBYWRHFLREO-FQEVSTJZSA-N	0	3	333.435	3.434	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)C[C@@H]3C=CCCC3)C2)cc1F	ZINC001019029071	1317012154	/nfs/dbraw/zinc/01/21/54/1317012154.db2.gz	LMJAYOHKBHJPIX-QAPCUYQASA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3ccc(OC)c(F)c3)C2)CC1	ZINC001019331266	1317172414	/nfs/dbraw/zinc/17/24/14/1317172414.db2.gz	QBHRFOROBCCMSN-KRWDZBQOSA-N	0	3	346.446	3.271	20	30		EGEDHN
CC1(C)CC[C@H](C(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)C1	ZINC001019347852	1317183789	/nfs/dbraw/zinc/18/37/89/1317183789.db2.gz	QPSLSBQDGGDXTQ-KBPBESRZSA-N	0	3	331.485	3.137	20	30		EGEDHN
C=C1CCC(C(=O)N(C)C2CCN(CCc3ccccn3)CC2)CC1	ZINC000900465435	1317291765	/nfs/dbraw/zinc/29/17/65/1317291765.db2.gz	SFCYMIVSRCZKNZ-UHFFFAOYSA-N	0	3	341.499	3.293	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)N2CC[C@H](NCc3ccc(C#N)c(F)c3)C2)CC1	ZINC001019682059	1317328911	/nfs/dbraw/zinc/32/89/11/1317328911.db2.gz	MNMJLAJKYDWTFY-ZVZYQTTQSA-N	0	3	343.446	3.214	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)CCc3cccs3)C2)s1	ZINC001019757204	1317404657	/nfs/dbraw/zinc/40/46/57/1317404657.db2.gz	GIVHXISGDWFCHM-ZDUSSCGKSA-N	0	3	345.493	3.005	20	30		EGEDHN
CCC(C)(CC)C(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001019794301	1317424683	/nfs/dbraw/zinc/42/46/83/1317424683.db2.gz	ZKVWFQGWSONQFC-INIZCTEOSA-N	0	3	331.435	3.214	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)C2CC(OCC)C2)cc1	ZINC000805856089	1317431781	/nfs/dbraw/zinc/43/17/81/1317431781.db2.gz	QWYSLGOGJPOBBB-VMWRSERWSA-N	0	3	342.439	3.492	20	30		EGEDHN
C#CCN(Cc1ccccc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000806309590	1317478585	/nfs/dbraw/zinc/47/85/85/1317478585.db2.gz	HUMFXKSMNHOOAE-OAQYLSRUSA-N	0	3	347.462	3.106	20	30		EGEDHN
CCN(Cc1ccc(F)cc1F)CC1CCN(C(=O)[C@@H](C)C#N)CC1	ZINC000957690482	1317558717	/nfs/dbraw/zinc/55/87/17/1317558717.db2.gz	LVQRVYIYAQRPLR-AWEZNQCLSA-N	0	3	349.425	3.185	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H]2CCCO[C@H]2c2ccccc2)C1	ZINC001020250732	1317610725	/nfs/dbraw/zinc/61/07/25/1317610725.db2.gz	NKUODQBMELVTBK-TVFCKZIOSA-N	0	3	348.874	3.144	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC(CN(CC)Cc3ocnc3C)CC2)C1	ZINC000957750675	1317618379	/nfs/dbraw/zinc/61/83/79/1317618379.db2.gz	BCDBOGWYLBNNEA-UHFFFAOYSA-N	0	3	345.487	3.400	20	30		EGEDHN
C#C[C@H](NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C)C(C)(C)C	ZINC000808313674	1317660172	/nfs/dbraw/zinc/66/01/72/1317660172.db2.gz	ZTGLTEYVJGUFCW-HKUYNNGSSA-N	0	3	341.499	3.340	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C2CCCCCCC2)C1	ZINC001020379669	1317670542	/nfs/dbraw/zinc/67/05/42/1317670542.db2.gz	DNLXMDGSISEPCO-SHTZXODSSA-N	0	3	343.309	3.492	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)C[C@@H]2C[C@H]2Cc2ccccc2)C1	ZINC001020422418	1317691134	/nfs/dbraw/zinc/69/11/34/1317691134.db2.gz	YWXOIRKYCHWBMS-XMTFNYHQSA-N	0	3	332.875	3.245	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2csc(-c3ccco3)n2)C1	ZINC001020521107	1317740445	/nfs/dbraw/zinc/74/04/45/1317740445.db2.gz	BVLQOISXTBHOGM-XYPYZODXSA-N	0	3	337.832	3.006	20	30		EGEDHN
C[C@@H]1CCCC[C@H]1C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001020526161	1317746155	/nfs/dbraw/zinc/74/61/55/1317746155.db2.gz	SNSQTFSMLQKESA-BNEJOLLZSA-N	0	3	343.446	3.260	20	30		EGEDHN
C[C@@H]1CCCC[C@H]1C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001020525911	1317746176	/nfs/dbraw/zinc/74/61/76/1317746176.db2.gz	NHRIOOLMCJNISU-BNEJOLLZSA-N	0	3	343.446	3.260	20	30		EGEDHN
CC1(C(=O)N[C@H]2C[C@H](NCc3ccc(C#N)cc3F)C2)CCCCC1	ZINC001020542878	1317757563	/nfs/dbraw/zinc/75/75/63/1317757563.db2.gz	WORHJJQNBGXVAY-QAQDUYKDSA-N	0	3	343.446	3.405	20	30		EGEDHN
C[NH+](C)CCc1ccc(C(=O)N([O-])Cc2ccccc2Cl)cc1	ZINC000904193806	1317809141	/nfs/dbraw/zinc/80/91/41/1317809141.db2.gz	VVMGPTFFNYCSLN-UHFFFAOYSA-N	0	3	332.831	3.476	20	30		EGEDHN
C#Cc1ccc(CNCc2cc(OC)c(OCC)c(OC)c2)cc1	ZINC000809611024	1317844413	/nfs/dbraw/zinc/84/44/13/1317844413.db2.gz	NUWFZEPYCIHWON-UHFFFAOYSA-N	0	3	325.408	3.374	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)[C@@H]2CCCC[C@H]2CC)C1	ZINC001020843482	1317950969	/nfs/dbraw/zinc/95/09/69/1317950969.db2.gz	HOFUYXDTYYQADA-KBUPBQIOSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)C2(c3ccccc3F)CCC2)C1	ZINC001020915239	1317996402	/nfs/dbraw/zinc/99/64/02/1317996402.db2.gz	LJLNNOQLXQXMAD-HDJSIYSDSA-N	0	3	336.838	3.237	20	30		EGEDHN
COCC1(C(=O)C(C#N)c2nc3cc(F)ccc3s2)CCOCC1	ZINC000810576063	1318025461	/nfs/dbraw/zinc/02/54/61/1318025461.db2.gz	NYGWURNJUDDZJB-GFCCVEGCSA-N	0	3	348.399	3.055	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cccc(OCC(C)C)c2)C1	ZINC001021028095	1318052697	/nfs/dbraw/zinc/05/26/97/1318052697.db2.gz	CVXICPJVYULDLG-WKILWMFISA-N	0	3	336.863	3.324	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc(C(F)(F)F)s2)C1	ZINC001021120948	1318103142	/nfs/dbraw/zinc/10/31/42/1318103142.db2.gz	PMQGOQROMIXEQC-KYZUINATSA-N	0	3	338.782	3.370	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)C2CC=CC2)cc1F	ZINC000959934695	1318274415	/nfs/dbraw/zinc/27/44/15/1318274415.db2.gz	ULSXEYQDOUKSAE-SFHVURJKSA-N	0	3	341.430	3.134	20	30		EGEDHN
Cc1cc(C(=O)N2CCCC[C@H]2CNCc2ccc(C#N)s2)co1	ZINC000959981878	1318297811	/nfs/dbraw/zinc/29/78/11/1318297811.db2.gz	UNGJRFIKZJFRHR-HNNXBMFYSA-N	0	3	343.452	3.306	20	30		EGEDHN
CC(F)(F)C(=O)N1CCC[C@@H]2CN(Cc3cccc(C#N)c3)CC[C@H]21	ZINC001021500596	1318312037	/nfs/dbraw/zinc/31/20/37/1318312037.db2.gz	ZMHYVQOQQOGSAD-IAGOWNOFSA-N	0	3	347.409	3.026	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@H]2CN(Cc3ccc(C#N)cc3)CC[C@@H]21	ZINC001021528609	1318363959	/nfs/dbraw/zinc/36/39/59/1318363959.db2.gz	ZISQIJFEEQMZQT-OALUTQOASA-N	0	3	325.456	3.027	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@H]2CN(Cc3cccc(C#N)c3)CC[C@@H]21	ZINC001021528580	1318364492	/nfs/dbraw/zinc/36/44/92/1318364492.db2.gz	YXSUHATZEKXIGQ-OALUTQOASA-N	0	3	325.456	3.027	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@H](CCCN3C(=O)/C=C\C3CC3)C2)c1	ZINC001021542566	1318381034	/nfs/dbraw/zinc/38/10/34/1318381034.db2.gz	UYQSLQJMCSVPLD-JUJZYJCFSA-N	0	3	349.478	3.337	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@@H](CCCN3C(=O)c3cc[nH]c3)C2)cc1	ZINC001021587197	1318431693	/nfs/dbraw/zinc/43/16/93/1318431693.db2.gz	BAVHFSIQKKDFIF-VQTJNVASSA-N	0	3	348.450	3.013	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2sccc2Cl)C1	ZINC001021589705	1318434025	/nfs/dbraw/zinc/43/40/25/1318434025.db2.gz	BJDKGVLMXKJFIB-ZFWWWQNUSA-N	0	3	336.888	3.351	20	30		EGEDHN
C[C@@](NCCCCC1(C#N)CCC1)(C(N)=O)c1cccc(Cl)c1	ZINC000930018512	1328765724	/nfs/dbraw/zinc/76/57/24/1328765724.db2.gz	NXCRIVJAZFZJBF-KRWDZBQOSA-N	0	3	333.863	3.494	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)C(C)(C)c1cccnc1	ZINC000960274913	1318438907	/nfs/dbraw/zinc/43/89/07/1318438907.db2.gz	GEIAFVJRBQJMGF-WOJBJXKFSA-N	0	3	349.478	3.307	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cccc(CC)n1	ZINC000960278047	1318440763	/nfs/dbraw/zinc/44/07/63/1318440763.db2.gz	MJLPOLYQYMXPDF-WOJBJXKFSA-N	0	3	335.451	3.206	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)C[C@H]1CCC(C)(C)CO1	ZINC000960292598	1318446968	/nfs/dbraw/zinc/44/69/68/1318446968.db2.gz	YPQLBBFFLZMBDS-YVWKXTFCSA-N	0	3	342.483	3.140	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1coc(C2CC2)n1	ZINC000960309635	1318454504	/nfs/dbraw/zinc/45/45/04/1318454504.db2.gz	DPOJWTITFNSBIA-SJLPKXTDSA-N	0	3	337.423	3.114	20	30		EGEDHN
C[C@H](NCc1cc(C#N)cs1)c1ccc(N2CCCNC2=O)cc1	ZINC000812801907	1318459593	/nfs/dbraw/zinc/45/95/93/1318459593.db2.gz	RBNNWOSNIUEAOP-ZDUSSCGKSA-N	0	3	340.452	3.390	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@@H]1Cc2ccccc2[C@H]1NCC(=C)C	ZINC000960325625	1318462238	/nfs/dbraw/zinc/46/22/38/1318462238.db2.gz	PDSQORKMBYXMIY-FYYLOGMGSA-N	0	3	344.458	3.158	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cccc(N(C)C)c1	ZINC000960329573	1318464406	/nfs/dbraw/zinc/46/44/06/1318464406.db2.gz	IIDCPDVVNMXJER-NHCUHLMSSA-N	0	3	349.478	3.314	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc3ccc(C)cc3[nH]2)C1	ZINC001021637794	1318492903	/nfs/dbraw/zinc/49/29/03/1318492903.db2.gz	AFPVLKMJAZBXBC-YLJYHZDGSA-N	0	3	335.451	3.036	20	30		EGEDHN
C=C1CCN(C(=O)Nc2ccc(CCN3CCSCC3)cc2)CC1	ZINC000930031731	1328769691	/nfs/dbraw/zinc/76/96/91/1328769691.db2.gz	LFESXXLWASBZHD-UHFFFAOYSA-N	0	3	345.512	3.462	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cccc3ncccc32)C1	ZINC001021644985	1318502301	/nfs/dbraw/zinc/50/23/01/1318502301.db2.gz	JUFBXNPAGPEALX-LAUBAEHRSA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc3cc(C)ccc3[nH]2)C1	ZINC001021647855	1318506575	/nfs/dbraw/zinc/50/65/75/1318506575.db2.gz	GYONPDGHYSVMDQ-LAUBAEHRSA-N	0	3	349.478	3.426	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(Cl)cc2C)C1	ZINC001021663706	1318525048	/nfs/dbraw/zinc/52/50/48/1318525048.db2.gz	DIGLFZLMRNJAEK-YJBOKZPZSA-N	0	3	330.859	3.208	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)[C@@H]1CC=CCC1	ZINC000960417603	1318541423	/nfs/dbraw/zinc/54/14/23/1318541423.db2.gz	LJGZRFAWHKNGLR-UXHICEINSA-N	0	3	337.467	3.337	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2csc(C(C)C)n2)C1	ZINC001021692643	1318566741	/nfs/dbraw/zinc/56/67/41/1318566741.db2.gz	VQAGQUJVAKSUKR-NVXWUHKLSA-N	0	3	345.512	3.216	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(C(F)F)cc2)C1	ZINC001021691748	1318567222	/nfs/dbraw/zinc/56/72/22/1318567222.db2.gz	RQBFOADZYFKQRE-DLBZAZTESA-N	0	3	332.394	3.184	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cccc(Cl)c2)C1	ZINC001021716093	1318596437	/nfs/dbraw/zinc/59/64/37/1318596437.db2.gz	BWZFPWSYMLTCBW-AEFFLSMTSA-N	0	3	330.859	3.290	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2c[nH]c3ccc(C)cc23)C1	ZINC001021738676	1318646689	/nfs/dbraw/zinc/64/66/89/1318646689.db2.gz	CPHFIVPBHYHLOQ-LAUBAEHRSA-N	0	3	349.478	3.426	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(CF)cc2)C1	ZINC001021742272	1318654554	/nfs/dbraw/zinc/65/45/54/1318654554.db2.gz	CWAYSGDRXRJWQY-OALUTQOASA-N	0	3	328.431	3.106	20	30		EGEDHN
Cc1csc(C(=O)N[C@H]2C[C@@H](NCc3cc(C#N)ccc3F)C2)c1	ZINC001022050572	1318780593	/nfs/dbraw/zinc/78/05/93/1318780593.db2.gz	OKVUMXMOCBFEJZ-GASCZTMLSA-N	0	3	343.427	3.118	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)NCCc1csc(-c2ccccc2)n1	ZINC000912000411	1318792714	/nfs/dbraw/zinc/79/27/14/1318792714.db2.gz	DFHKWMJEMOGMAY-MRXNPFEDSA-N	0	3	329.469	3.152	20	30		EGEDHN
C=CCC(F)(F)C(=O)NC[C@H](c1cccc(OC)c1)N(CC)CC	ZINC000814875009	1318837116	/nfs/dbraw/zinc/83/71/16/1318837116.db2.gz	OASVPNCVCNWQDX-MRXNPFEDSA-N	0	3	340.414	3.406	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N1CCC(CCc2ccc(O)cc2)CC1	ZINC000912182485	1318843740	/nfs/dbraw/zinc/84/37/40/1318843740.db2.gz	IDSLMHJJHHWDBI-LJQANCHMSA-N	0	3	330.472	3.247	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)Nc1cccc(C(=O)N(C)C)c1	ZINC000912196127	1318845988	/nfs/dbraw/zinc/84/59/88/1318845988.db2.gz	RMJVIBPFRMYDJF-QGZVFWFLSA-N	0	3	333.476	3.405	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)Nc1ccc(Cl)c(C(N)=O)c1	ZINC000912301402	1318864685	/nfs/dbraw/zinc/86/46/85/1318864685.db2.gz	RUFRCMRFXBJGTA-OAHLLOKOSA-N	0	3	339.867	3.455	20	30		EGEDHN
C#CCNC(=O)CC[N@H+](Cc1ccccc1[O-])[C@H](C)c1ccccc1	ZINC000815078434	1318884987	/nfs/dbraw/zinc/88/49/87/1318884987.db2.gz	YUHNCYKAKLYVTO-QGZVFWFLSA-N	0	3	336.435	3.095	20	30		EGEDHN
C#CCNC(=O)CC[N@@H+](Cc1ccccc1[O-])[C@H](C)c1ccccc1	ZINC000815078434	1318884990	/nfs/dbraw/zinc/88/49/90/1318884990.db2.gz	YUHNCYKAKLYVTO-QGZVFWFLSA-N	0	3	336.435	3.095	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@@H]2CCC[C@@H](C(F)(F)F)C2)C1	ZINC001022343534	1318900261	/nfs/dbraw/zinc/90/02/61/1318900261.db2.gz	PISKDCDCTFXZJP-LPWJVIDDSA-N	0	3	338.801	3.344	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)C2CCc3ccccc3CC2)C1	ZINC001022339155	1318900644	/nfs/dbraw/zinc/90/06/44/1318900644.db2.gz	MRSRDUAAPHSRPT-HDICACEKSA-N	0	3	332.875	3.171	20	30		EGEDHN
CC(C)(C)[C@@H]1C[C@H]1C(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001022416747	1318930935	/nfs/dbraw/zinc/93/09/35/1318930935.db2.gz	OJXTTYLTKGNPJD-YYIAUSFCSA-N	0	3	343.446	3.116	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@@H](NCc3cc(Cl)ccc3OC)C2)C1	ZINC001022680781	1319064614	/nfs/dbraw/zinc/06/46/14/1319064614.db2.gz	OTYHCKQZKBOXLV-IYBDPMFKSA-N	0	3	348.874	3.442	20	30		EGEDHN
N#CC(C(=O)C1CCC(OC[C@H]2CCCO2)CC1)c1ccccn1	ZINC000815907234	1319070964	/nfs/dbraw/zinc/07/09/64/1319070964.db2.gz	WHZMRKDOKCLYJA-BACDZXNISA-N	0	3	328.412	3.012	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)[C@H]1CCC[C@H](OC)C1)c1ccccc1	ZINC000816038849	1319091723	/nfs/dbraw/zinc/09/17/23/1319091723.db2.gz	ISAPYRMEEPOVMX-FJIDUMEYSA-N	0	3	342.439	3.168	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N[C@H]1C[C@@H](NCc2ccccc2Cl)C1	ZINC001022841798	1319133926	/nfs/dbraw/zinc/13/39/26/1319133926.db2.gz	HQYMNJVKDSTRLD-DFGXFYAUSA-N	0	3	348.874	3.058	20	30		EGEDHN
CCC(=O)N1CCC[C@@H]([C@@H]2CCN(Cc3cc(C#N)ccc3F)C2)C1	ZINC000961070589	1319182863	/nfs/dbraw/zinc/18/28/63/1319182863.db2.gz	URXDSNANGAUWAW-IAGOWNOFSA-N	0	3	343.446	3.168	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2[nH]ccc2-c2ccccc2)C1	ZINC001022965360	1319191207	/nfs/dbraw/zinc/19/12/07/1319191207.db2.gz	UETNQJDVRGFQGS-GASCZTMLSA-N	0	3	329.831	3.285	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)c2ccc(Cl)s2)C1	ZINC001023053670	1319241508	/nfs/dbraw/zinc/24/15/08/1319241508.db2.gz	KUOLQJVSQGYTDF-DTORHVGOSA-N	0	3	349.681	3.161	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@H](CNC(=O)c3cccs3)C2)c1	ZINC001023213320	1319349925	/nfs/dbraw/zinc/34/99/25/1319349925.db2.gz	GBBCFJWYICFXDG-KRWDZBQOSA-N	0	3	339.464	3.262	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)[C@@H]2CCCC[C@H]2C(F)(F)F)C1	ZINC001023424464	1319524471	/nfs/dbraw/zinc/52/44/71/1319524471.db2.gz	ZBUYDDJUXJDHHT-ARFHVFGLSA-N	0	3	344.421	3.207	20	30		EGEDHN
C[C@@H](N[C@@H]1CC[C@H](C#N)C1)c1ccc(S(=O)(=O)C(F)F)cc1	ZINC000818356922	1319535343	/nfs/dbraw/zinc/53/53/43/1319535343.db2.gz	SPTJLAHTRKMCAB-NTZNESFSSA-N	0	3	328.384	3.026	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc3c([nH]2)c(F)ccc3C)C1	ZINC001023453932	1319555741	/nfs/dbraw/zinc/55/57/41/1319555741.db2.gz	LFUAOQNBLDOZII-OAHLLOKOSA-N	0	3	341.430	3.081	20	30		EGEDHN
C#CCN(C)CCCNC(=O)/C=C\c1cccc(OC2CCCC2)c1	ZINC000818588721	1319563330	/nfs/dbraw/zinc/56/33/30/1319563330.db2.gz	DQXJTVMLCCFREI-SEYXRHQNSA-N	0	3	340.467	3.093	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2csc3ccccc23)C1	ZINC001023514827	1319619786	/nfs/dbraw/zinc/61/97/86/1319619786.db2.gz	STQNJGODNZRNOA-HNNXBMFYSA-N	0	3	326.465	3.366	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CCCN(Cc3cccnc3)C2)CC1	ZINC001023573123	1319689869	/nfs/dbraw/zinc/68/98/69/1319689869.db2.gz	STXSIQDGZCURQH-SFHVURJKSA-N	0	3	327.472	3.156	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)CCc1nc2ccccc2o1	ZINC000916876232	1319718379	/nfs/dbraw/zinc/71/83/79/1319718379.db2.gz	SZFGWLFUKKDBIS-AWEZNQCLSA-N	0	3	341.411	3.166	20	30		EGEDHN
N#CC(C(=O)COc1cccc(Cl)c1)C(=O)Nc1ccccc1	ZINC000916898615	1319721031	/nfs/dbraw/zinc/72/10/31/1319721031.db2.gz	FHXXJRPIKVIYTI-HNNXBMFYSA-N	0	3	328.755	3.066	20	30		EGEDHN
CCc1cccc(CC)c1NC(=O)C(C#N)C(=O)CC[C@H]1CCCO1	ZINC000916910286	1319722313	/nfs/dbraw/zinc/72/23/13/1319722313.db2.gz	WLRITMSZELVNCX-SJORKVTESA-N	0	3	342.439	3.418	20	30		EGEDHN
COc1ccc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)cc1F	ZINC000916910650	1319723209	/nfs/dbraw/zinc/72/32/09/1319723209.db2.gz	SGBWVFAOOCQRTM-LLVKDONJSA-N	0	3	346.745	3.449	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)c1cc2ccccc2o1	ZINC000916929076	1319726650	/nfs/dbraw/zinc/72/66/50/1319726650.db2.gz	AZSRCLFOJJWUPB-CYBMUJFWSA-N	0	3	334.331	3.403	20	30		EGEDHN
N#CC(C(=O)COCC1CC1)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000916931681	1319726667	/nfs/dbraw/zinc/72/66/67/1319726667.db2.gz	MGJIKMXAOSTXAI-LLVKDONJSA-N	0	3	341.194	3.067	20	30		EGEDHN
Cc1cccc(C)c1C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC000961853200	1319747502	/nfs/dbraw/zinc/74/75/02/1319747502.db2.gz	BYOFGSGNCPGLMQ-KXTWHKPSSA-N	0	3	345.446	3.035	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1ccc(C)c(-c2nc(C)co2)c1	ZINC000930412384	1328850378	/nfs/dbraw/zinc/85/03/78/1328850378.db2.gz	YNFCLUOQVAIDFI-UHFFFAOYSA-N	0	3	340.427	3.035	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cccc3ccsc32)C1	ZINC001023685930	1319801807	/nfs/dbraw/zinc/80/18/07/1319801807.db2.gz	MZFKDJXATMQNRC-HNNXBMFYSA-N	0	3	326.465	3.366	20	30		EGEDHN
N#Cc1c(Cl)nsc1N1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1	ZINC000819947300	1319808422	/nfs/dbraw/zinc/80/84/22/1319808422.db2.gz	YORLKAQQKMYKBA-DZGCQCFKSA-N	0	3	344.871	3.379	20	30		EGEDHN
Cc1cccc(C)c1C(=O)NC1CC(CNCc2ccccc2C#N)C1	ZINC000962343578	1319918689	/nfs/dbraw/zinc/91/86/89/1319918689.db2.gz	FHXPLEJPIVVWRL-UHFFFAOYSA-N	0	3	347.462	3.473	20	30		EGEDHN
Cc1nc(C2CC2)ccc1C(=O)C(C#N)c1nnc2n1CCCCC2	ZINC000821621001	1320023239	/nfs/dbraw/zinc/02/32/39/1320023239.db2.gz	CKUZRSRBCNJLPZ-HNNXBMFYSA-N	0	3	335.411	3.075	20	30		EGEDHN
C#Cc1cnc(NC[C@@H](c2ccc(OC)cc2)N2CCCCC2)nc1	ZINC000827294665	1320441619	/nfs/dbraw/zinc/44/16/19/1320441619.db2.gz	LDBVJEJBCZXNME-IBGZPJMESA-N	0	3	336.439	3.106	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N[C@H](C)c1csc2ccccc21	ZINC000836288493	1320469741	/nfs/dbraw/zinc/46/97/41/1320469741.db2.gz	WUJVQTPYJYNWET-CQSZACIVSA-N	0	3	329.469	3.217	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N1CCCCC[C@H]1c1ccc(C)o1	ZINC000838622805	1320795824	/nfs/dbraw/zinc/79/58/24/1320795824.db2.gz	OIMORNCMMVYCID-KRWDZBQOSA-N	0	3	331.460	3.170	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1ccc(OCCCC)cc1C	ZINC000838623993	1320795988	/nfs/dbraw/zinc/79/59/88/1320795988.db2.gz	BAXPRJFYYXCFAH-UHFFFAOYSA-N	0	3	331.460	3.251	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1ccc(OC(F)F)c(Cl)c1	ZINC000838624368	1320796230	/nfs/dbraw/zinc/79/62/30/1320796230.db2.gz	UGTCAEKLIVXZCL-UHFFFAOYSA-N	0	3	345.777	3.018	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)[C@H](CC(C)C)OC)c1ccccc1	ZINC000842341804	1321374668	/nfs/dbraw/zinc/37/46/68/1321374668.db2.gz	ABLLVQAFCMNAQG-IKGGRYGDSA-N	0	3	330.428	3.024	20	30		EGEDHN
CCN(CC)c1ccc(/C=N\[C@@H]2CCN(C(C)(C)C)C2=O)c(O)c1	ZINC000843265604	1321495721	/nfs/dbraw/zinc/49/57/21/1321495721.db2.gz	HFXMJIFAPAVMTL-FPXKJXHESA-N	0	3	331.460	3.057	20	30		EGEDHN
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NCC3(C#N)CCC3)C[C@@H]2C1	ZINC000843413321	1321513526	/nfs/dbraw/zinc/51/35/26/1321513526.db2.gz	LCXUWBBRWJOICQ-XHSDSOJGSA-N	0	3	333.476	3.305	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)C(=O)N1C[C@@H](N(C)C)Cc2ccccc21	ZINC000846865048	1321817947	/nfs/dbraw/zinc/81/79/47/1321817947.db2.gz	HOQZLTLPEWXQGM-UZLBHIALSA-N	0	3	347.462	3.256	20	30		EGEDHN
CO[C@@H](C)CCC(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847747250	1321900250	/nfs/dbraw/zinc/90/02/50/1321900250.db2.gz	DNOXSCARQSOAFT-KRWDZBQOSA-N	0	3	344.455	3.151	20	30		EGEDHN
Cc1ccc(C(=O)OCC2(C#N)CCN(Cc3ccccc3)CC2)nc1	ZINC000847749024	1321900260	/nfs/dbraw/zinc/90/02/60/1321900260.db2.gz	LWFAOUYYYRGFOB-UHFFFAOYSA-N	0	3	349.434	3.353	20	30		EGEDHN
CO[C@H](C)CCC(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847747251	1321900369	/nfs/dbraw/zinc/90/03/69/1321900369.db2.gz	DNOXSCARQSOAFT-QGZVFWFLSA-N	0	3	344.455	3.151	20	30		EGEDHN
CCO[C@@H](CC)C(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847749493	1321900517	/nfs/dbraw/zinc/90/05/17/1321900517.db2.gz	RQMINFKJYPUQPH-SFHVURJKSA-N	0	3	344.455	3.151	20	30		EGEDHN
COC(=O)Cc1ccccc1CN[C@@H](C)c1ccc(C#N)c(F)c1	ZINC000848572898	1321978648	/nfs/dbraw/zinc/97/86/48/1321978648.db2.gz	MWPBKQAESXXCMW-ZDUSSCGKSA-N	0	3	326.371	3.264	20	30		EGEDHN
C/C(=C/C(=O)N1CCC[C@@H](CNCc2ccccc2C#N)C1)C1CC1	ZINC001023869059	1321987865	/nfs/dbraw/zinc/98/78/65/1321987865.db2.gz	VXSOUGJBOXBTGT-NIFLVVHWSA-N	0	3	337.467	3.243	20	30		EGEDHN
CCC(C)(C)N1CCN(c2cc(C(F)(F)F)cnc2C#N)CC1	ZINC000848761018	1322005071	/nfs/dbraw/zinc/00/50/71/1322005071.db2.gz	MWXXBZLHHFCGKP-UHFFFAOYSA-N	0	3	326.366	3.283	20	30		EGEDHN
N#CCOc1ccc(CNCc2ccc(O[C@@H]3CCOC3)cc2)cc1	ZINC000850120761	1322194983	/nfs/dbraw/zinc/19/49/83/1322194983.db2.gz	BNWWCPIBPYFREH-HXUWFJFHSA-N	0	3	338.407	3.046	20	30		EGEDHN
C=CCCn1cc(CNCCc2c[nH]c3ccc(Cl)cc23)nn1	ZINC000850159887	1322200997	/nfs/dbraw/zinc/20/09/97/1322200997.db2.gz	ILJVVDSUWKZIQB-UHFFFAOYSA-N	0	3	329.835	3.321	20	30		EGEDHN
CC(C)(C)O[C@@H]1C[C@H]1C(=O)C(C#N)C(=O)Nc1ccccc1Cl	ZINC000850758979	1322285879	/nfs/dbraw/zinc/28/58/79/1322285879.db2.gz	FTXBXBHSLCTATQ-JTNHKYCSSA-N	0	3	334.803	3.191	20	30		EGEDHN
CC1(CC(=O)N2CCC[C@H](CNCc3cc(F)ccc3C#N)C2)CC1	ZINC001024064839	1323106838	/nfs/dbraw/zinc/10/68/38/1323106838.db2.gz	CSWPGQJNYRVLQU-OAHLLOKOSA-N	0	3	343.446	3.216	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001024094195	1323125405	/nfs/dbraw/zinc/12/54/05/1323125405.db2.gz	GIJVYDPIYBSFFX-HNNXBMFYSA-N	0	3	343.446	3.238	20	30		EGEDHN
CCC(C)(C)C(=O)N1CCC[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001024129655	1323154209	/nfs/dbraw/zinc/15/42/09/1323154209.db2.gz	WYNDDQWBYQBMHD-OAHLLOKOSA-N	0	3	345.462	3.462	20	30		EGEDHN
CC1(C(=O)N2CCC[C@@H](CNCc3ccccc3C#N)C2)CC=CC1	ZINC001024138076	1323162753	/nfs/dbraw/zinc/16/27/53/1323162753.db2.gz	ZANUHFUGNJFNEZ-KRWDZBQOSA-N	0	3	337.467	3.243	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H](CNCc3ncc(C)s3)C2)C1	ZINC001024146327	1323171513	/nfs/dbraw/zinc/17/15/13/1323171513.db2.gz	SMLFXVJQZWFQMR-HNNXBMFYSA-N	0	3	333.501	3.136	20	30		EGEDHN
C=C(Br)CNC1CCC(N(C)C(=O)C(C)(C)F)CC1	ZINC000962976938	1323179685	/nfs/dbraw/zinc/17/96/85/1323179685.db2.gz	WXZYMOBRIDQLBJ-UHFFFAOYSA-N	0	3	335.261	3.002	20	30		EGEDHN
CN(C(=O)c1ccncc1)C1CCC(NCc2ccccc2C#N)CC1	ZINC000962993180	1323181475	/nfs/dbraw/zinc/18/14/75/1323181475.db2.gz	CFWFPUJFWSLZTE-UHFFFAOYSA-N	0	3	348.450	3.126	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001024167486	1323182762	/nfs/dbraw/zinc/18/27/62/1323182762.db2.gz	RTIWLZBZPPQCFK-QMTMVMCOSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=CCC1(NCc2nnnn2-c2ccc(OC(F)F)cc2)CCCC1	ZINC000852587690	1323210831	/nfs/dbraw/zinc/21/08/31/1323210831.db2.gz	BIMCOODCPRXDHC-UHFFFAOYSA-N	0	3	349.385	3.242	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)c2ccc(C)n2C)C1	ZINC000963251366	1323260632	/nfs/dbraw/zinc/26/06/32/1323260632.db2.gz	PFOJXLKZAXVDGG-DLBZAZTESA-N	0	3	349.906	3.403	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N(C)C1CCN(CCc2ccccn2)CC1	ZINC000931290077	1329086596	/nfs/dbraw/zinc/08/65/96/1329086596.db2.gz	HLTWPCUQESOSKM-KRWDZBQOSA-N	0	3	329.488	3.149	20	30		EGEDHN
C=CCCN1CCCC[C@H]1CNC(=O)c1oc(CC2CC2)nc1C	ZINC001024437831	1323398948	/nfs/dbraw/zinc/39/89/48/1323398948.db2.gz	BHBBIOJTQWLILM-INIZCTEOSA-N	0	3	331.460	3.096	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cc(Cl)c(Cl)n1C	ZINC001024469125	1323424708	/nfs/dbraw/zinc/42/47/08/1323424708.db2.gz	VMJCVWVNMHDSNT-GFCCVEGCSA-N	0	3	344.286	3.492	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cncn1-c1ccccc1	ZINC001024480284	1323435058	/nfs/dbraw/zinc/43/50/58/1323435058.db2.gz	GAHCNDUINLMYDE-GOSISDBHSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cc(-c2ccccc2)n[nH]1	ZINC001024540360	1323480992	/nfs/dbraw/zinc/48/09/92/1323480992.db2.gz	JWHRKJFXCWHPKT-KRWDZBQOSA-N	0	3	338.455	3.237	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccncc1OC(C)C	ZINC001024576523	1323512893	/nfs/dbraw/zinc/51/28/93/1323512893.db2.gz	VXLWVOQYZMBBCQ-MRXNPFEDSA-N	0	3	331.460	3.029	20	30		EGEDHN
C=CCCN1CCCC[C@H]1CNC(=O)c1cc2ncccc2s1	ZINC001024587263	1323523182	/nfs/dbraw/zinc/52/31/82/1323523182.db2.gz	FPYCDHKMKOHQCC-AWEZNQCLSA-N	0	3	329.469	3.457	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ncoc1-c1cccs1	ZINC001024716928	1323622192	/nfs/dbraw/zinc/62/21/92/1323622192.db2.gz	OMBHGOPATREMCA-CQSZACIVSA-N	0	3	343.452	3.011	20	30		EGEDHN
C=CCCN1CCCC[C@H]1CNC(=O)c1cc2cccnc2s1	ZINC001024744906	1323644313	/nfs/dbraw/zinc/64/43/13/1323644313.db2.gz	IREKDIMPMDAUSY-HNNXBMFYSA-N	0	3	329.469	3.457	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cnn(CC(C)C)c1C	ZINC001024781456	1323683720	/nfs/dbraw/zinc/68/37/20/1323683720.db2.gz	USRSKPCRJFCWDP-KRWDZBQOSA-N	0	3	332.492	3.008	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cc(C)n(C(C)(C)C)n1	ZINC001024802830	1323706088	/nfs/dbraw/zinc/70/60/88/1323706088.db2.gz	ARAAUSPKORJBLF-INIZCTEOSA-N	0	3	332.492	3.107	20	30		EGEDHN
C[C@H](NC[C@H]1CCCCN1C(=O)C#CC1CC1)c1ccc(F)cc1F	ZINC001024957297	1323799153	/nfs/dbraw/zinc/79/91/53/1323799153.db2.gz	BTCXNMCOUOZFGF-WMLDXEAASA-N	0	3	346.421	3.410	20	30		EGEDHN
O=C(C#CC1CC1)N1CCCC[C@@H]1CNCc1sccc1Cl	ZINC001024960253	1323802012	/nfs/dbraw/zinc/80/20/12/1323802012.db2.gz	REXQLWSDVYNCPW-CQSZACIVSA-N	0	3	336.888	3.286	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCCC[C@H]1CNCc1cccc(OC)n1	ZINC001025038121	1323840574	/nfs/dbraw/zinc/84/05/74/1323840574.db2.gz	RUDHIIXEYHDVQN-KRWDZBQOSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCCC[C@H]1CNCc1c(C)noc1C	ZINC001025069578	1323870676	/nfs/dbraw/zinc/87/06/76/1323870676.db2.gz	LUUKBDBNUABCMA-LPHOPBHVSA-N	0	3	333.476	3.364	20	30		EGEDHN
CC(C)(C)C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)cc1F	ZINC001025145419	1323920698	/nfs/dbraw/zinc/92/06/98/1323920698.db2.gz	JGACEYPTIUZDDY-INIZCTEOSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=C(C)C[N@@H+]1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccccc1[O-]	ZINC001025200626	1323984274	/nfs/dbraw/zinc/98/42/74/1323984274.db2.gz	FOYKYIPEVURVCK-QZTJIDSGSA-N	0	3	328.456	3.427	20	30		EGEDHN
C=C(C)C[N@H+]1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccccc1[O-]	ZINC001025200626	1323984277	/nfs/dbraw/zinc/98/42/77/1323984277.db2.gz	FOYKYIPEVURVCK-QZTJIDSGSA-N	0	3	328.456	3.427	20	30		EGEDHN
O=C(C#CC1CC1)N1CCCC[C@@H]1[C@H]1CCCN1CCC(F)(F)F	ZINC001025229613	1324016081	/nfs/dbraw/zinc/01/60/81/1324016081.db2.gz	NCDGULZKLYTBAF-HZPDHXFCSA-N	0	3	342.405	3.198	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccncc1CC	ZINC001025244415	1324041824	/nfs/dbraw/zinc/04/18/24/1324041824.db2.gz	JLOCCAUGDGGJBN-PMACEKPBSA-N	0	3	339.483	3.126	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1onc2c1CCCC2	ZINC001025250137	1324050517	/nfs/dbraw/zinc/05/05/17/1324050517.db2.gz	HETDDMLNVCTPJC-QZTJIDSGSA-N	0	3	343.471	3.199	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccn2ccccc12	ZINC001025252550	1324056835	/nfs/dbraw/zinc/05/68/35/1324056835.db2.gz	XUYKLYHAVXURGM-UXHICEINSA-N	0	3	335.451	3.032	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(C2CC2)on1	ZINC001025254367	1324061288	/nfs/dbraw/zinc/06/12/88/1324061288.db2.gz	IFJRZMJVCZUMBE-QZTJIDSGSA-N	0	3	341.455	3.034	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)C1CC2(CCC2)C1	ZINC001025257834	1324066206	/nfs/dbraw/zinc/06/62/06/1324066206.db2.gz	AJQNBJAVCPAUNW-MOPGFXCFSA-N	0	3	328.500	3.436	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)Cc1cc(C)ccc1C	ZINC001025264082	1324075233	/nfs/dbraw/zinc/07/52/33/1324075233.db2.gz	VTPIPMXBJKMTTI-LEWJYISDSA-N	0	3	338.495	3.325	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc[nH]c1C1CCC1	ZINC001025269574	1324083672	/nfs/dbraw/zinc/08/36/72/1324083672.db2.gz	TUCUBOXIOBKLQS-MOPGFXCFSA-N	0	3	339.483	3.375	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)C1(C(F)(F)F)CC1	ZINC001025271889	1324088157	/nfs/dbraw/zinc/08/81/57/1324088157.db2.gz	JPJISVAJJJWBMH-HUUCEWRRSA-N	0	3	342.405	3.198	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(C2CC2)no1	ZINC001025275169	1324094173	/nfs/dbraw/zinc/09/41/73/1324094173.db2.gz	TWYFRXNPDYTDRS-SJORKVTESA-N	0	3	329.444	3.197	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)C1(CC)CCOCC1	ZINC001025281349	1324103129	/nfs/dbraw/zinc/10/31/29/1324103129.db2.gz	TXJDKPPOYOHBSX-OALUTQOASA-N	0	3	346.515	3.062	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1coc(CCC)n1	ZINC001025289843	1324113935	/nfs/dbraw/zinc/11/39/35/1324113935.db2.gz	UCXRMYNZOTUBBZ-IAGOWNOFSA-N	0	3	331.460	3.272	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)[C@H]1[C@H]2[C@@H]1[C@@H]1CC[C@H]2C1	ZINC001025304997	1324139236	/nfs/dbraw/zinc/13/92/36/1324139236.db2.gz	SNYKGKPEUKQACX-OCZHUQCSSA-N	0	3	340.511	3.147	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(C)c(OC)c(C)c2)C1	ZINC001025419950	1324253499	/nfs/dbraw/zinc/25/34/99/1324253499.db2.gz	QOXWLXLJKNVBBC-MSOLQXFVSA-N	0	3	342.483	3.166	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc3nccc(C)c3c2)C1	ZINC001025428033	1324263077	/nfs/dbraw/zinc/26/30/77/1324263077.db2.gz	KDWLCHALUANXKO-HKUYNNGSSA-N	0	3	349.478	3.397	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccccc2C(C)(C)C)C1	ZINC001025450749	1324293874	/nfs/dbraw/zinc/29/38/74/1324293874.db2.gz	MMPDNZGIVLJJOP-SJORKVTESA-N	0	3	326.484	3.448	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc3ccccc3cc2F)C1	ZINC001025482805	1324329816	/nfs/dbraw/zinc/32/98/16/1324329816.db2.gz	QORZLVTVVSGNFN-MAUKXSAKSA-N	0	3	338.426	3.442	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc3cscc3s2)C1	ZINC001025484272	1324331850	/nfs/dbraw/zinc/33/18/50/1324331850.db2.gz	BNCUWMVWTJZRSZ-OLZOCXBDSA-N	0	3	332.494	3.426	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc3ccsc3[nH]2)C1	ZINC001025500601	1324348592	/nfs/dbraw/zinc/34/85/92/1324348592.db2.gz	UZTPDCHIYPJBHR-ZFWWWQNUSA-N	0	3	329.469	3.083	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(C)c(C)cc2Cl)C1	ZINC001025502198	1324351699	/nfs/dbraw/zinc/35/16/99/1324351699.db2.gz	KWOIOJMWSNEERL-HOTGVXAUSA-N	0	3	332.875	3.420	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(C(C)C)cn2)C1	ZINC001025531293	1324377922	/nfs/dbraw/zinc/37/79/22/1324377922.db2.gz	OZTPXBKJOPBWRT-WMZOPIPTSA-N	0	3	327.472	3.059	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc[nH]c2C2CCC2)C1	ZINC001025536901	1324383581	/nfs/dbraw/zinc/38/35/81/1324383581.db2.gz	YTAWDYOGCCDVOH-RDJZCZTQSA-N	0	3	327.472	3.136	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cccc(F)c2Cl)C1	ZINC001025538357	1324385108	/nfs/dbraw/zinc/38/51/08/1324385108.db2.gz	GJSFKZOXAWGXMX-ZIAGYGMSSA-N	0	3	336.838	3.333	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(C(F)F)cc2F)C1	ZINC001025567222	1324413072	/nfs/dbraw/zinc/41/30/72/1324413072.db2.gz	QSKCZRIXNGVLRO-GXTWGEPZSA-N	0	3	338.373	3.227	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ncsc2C(C)C)C1	ZINC001025595674	1324442866	/nfs/dbraw/zinc/44/28/66/1324442866.db2.gz	QOXPIOVCQBDEDI-CABCVRRESA-N	0	3	333.501	3.120	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccccc2OC(C)C)C1	ZINC001025600965	1324448823	/nfs/dbraw/zinc/44/88/23/1324448823.db2.gz	PLMKWFOEMNYCJV-MSOLQXFVSA-N	0	3	342.483	3.327	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(Cl)cc(Cl)c2)C1	ZINC001025609251	1324460145	/nfs/dbraw/zinc/46/01/45/1324460145.db2.gz	NGMLCPIHKMRSQB-QWHCGFSZSA-N	0	3	339.266	3.457	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2c(C)cc(C)cc2C)C1	ZINC001025611570	1324462413	/nfs/dbraw/zinc/46/24/13/1324462413.db2.gz	MLLIXDGEWYUHGS-OALUTQOASA-N	0	3	326.484	3.465	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc3c(c2)CCCC3)C1	ZINC001025611650	1324464309	/nfs/dbraw/zinc/46/43/09/1324464309.db2.gz	NQJVHACSDSDHAO-DYESRHJHSA-N	0	3	338.495	3.419	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(Cl)cn2CC)C1	ZINC001025623721	1324473730	/nfs/dbraw/zinc/47/37/30/1324473730.db2.gz	HOZBGSUZVWYUBB-GJZGRUSLSA-N	0	3	335.879	3.015	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(OC3CCC3)cc2)C1	ZINC001025626557	1324477360	/nfs/dbraw/zinc/47/73/60/1324477360.db2.gz	DMDQTRNHNDKOKD-WMZOPIPTSA-N	0	3	340.467	3.081	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(C(C)(F)F)cc2)C1	ZINC001025637506	1324489269	/nfs/dbraw/zinc/48/92/69/1324489269.db2.gz	UYXGKLFNPJBKBM-GOEBONIOSA-N	0	3	334.410	3.262	20	30		EGEDHN
CC(C)(C)CC(=O)N1C[C@@H]2CC[C@H](NCc3ccccc3C#N)[C@H]2C1	ZINC001026200749	1324660233	/nfs/dbraw/zinc/66/02/33/1324660233.db2.gz	LIZHSUZBZLWIQD-FHWLQOOXSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H]2CC[C@H](NCc3nc(C)oc3C)[C@H]2C1	ZINC001026330424	1324731258	/nfs/dbraw/zinc/73/12/58/1324731258.db2.gz	ISWJHNRFUGAPOJ-ULQDDVLXSA-N	0	3	345.487	3.220	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H]2CC[C@H](NCc3csc(C)n3)[C@@H]2C1	ZINC001026330842	1324731370	/nfs/dbraw/zinc/73/13/70/1324731370.db2.gz	LZGQLIASCILLKF-UAGQMJEPSA-N	0	3	347.528	3.380	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H]2CC[C@@H](NCc3ccccc3C#N)[C@H]2C1	ZINC001026332737	1324733068	/nfs/dbraw/zinc/73/30/68/1324733068.db2.gz	PDZKGJMYNKECBR-GBESFXJTSA-N	0	3	337.467	3.097	20	30		EGEDHN
CC(C)(C)C(=O)N1C[C@@H]2CC[C@H](NCc3cc(F)ccc3C#N)[C@H]2C1	ZINC001026406146	1324778986	/nfs/dbraw/zinc/77/89/86/1324778986.db2.gz	VHEPFISXKMZSOV-WBAXXEDZSA-N	0	3	343.446	3.070	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)c2coc(C)c2)CC1	ZINC001026484248	1324840315	/nfs/dbraw/zinc/84/03/15/1324840315.db2.gz	MPULZLBWNNZJAQ-UHFFFAOYSA-N	0	3	341.249	3.127	20	30		EGEDHN
CC1(C(=O)NC2CCC(NCc3cc(F)ccc3C#N)CC2)CC1	ZINC001026499640	1324850886	/nfs/dbraw/zinc/85/08/86/1324850886.db2.gz	PXNMFNLMBKCXCR-UHFFFAOYSA-N	0	3	329.419	3.014	20	30		EGEDHN
C=C1CCC(C(=O)NC2CCC(NCc3cc(C)no3)CC2)CC1	ZINC001026553993	1324890602	/nfs/dbraw/zinc/89/06/02/1324890602.db2.gz	AXYBDCMVBGGSJN-UHFFFAOYSA-N	0	3	331.460	3.246	20	30		EGEDHN
CC1(C)CC(C(=O)N2CC[C@H](CNCc3cc(F)ccc3C#N)C2)C1	ZINC001026822108	1325034999	/nfs/dbraw/zinc/03/49/99/1325034999.db2.gz	VCIUPYPPOAWLFK-CQSZACIVSA-N	0	3	343.446	3.072	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)c2sccc2F)C1	ZINC001026826841	1325035945	/nfs/dbraw/zinc/03/59/45/1325035945.db2.gz	PJFBKKZYCBBVQF-ZDUSSCGKSA-N	0	3	343.427	3.011	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)c2ccns2)C1	ZINC000963311207	1325096752	/nfs/dbraw/zinc/09/67/52/1325096752.db2.gz	QLQLOCCTDHUQRZ-KGLIPLIRSA-N	0	3	339.892	3.212	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)c2ccoc2C2CC2)C1	ZINC001027022388	1325158830	/nfs/dbraw/zinc/15/88/30/1325158830.db2.gz	MDYDMZPOZHCJKT-HNNXBMFYSA-N	0	3	349.434	3.281	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H](CNCc2oc(CC)nc2C)C1	ZINC001027038047	1325171853	/nfs/dbraw/zinc/17/18/53/1325171853.db2.gz	GUXYEPDPYMNLMX-DNVCBOLYSA-N	0	3	333.476	3.086	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H](CNCc2oc(CCC)nc2C)C1	ZINC001027039061	1325173392	/nfs/dbraw/zinc/17/33/92/1325173392.db2.gz	UZWUVJHLSLFZMC-UZLBHIALSA-N	0	3	347.503	3.476	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](CNCc3c(F)cccc3F)C2)C1	ZINC001027051304	1325190553	/nfs/dbraw/zinc/19/05/53/1325190553.db2.gz	WSDCQASPLXAEQB-AWEZNQCLSA-N	0	3	334.410	3.259	20	30		EGEDHN
C=Cc1ccc(C(=O)N2CC[C@H](CNCc3ccccc3C#N)C2)cc1	ZINC001027083394	1325208377	/nfs/dbraw/zinc/20/83/77/1325208377.db2.gz	HOLOIAMPQOUJEB-GOSISDBHSA-N	0	3	345.446	3.453	20	30		EGEDHN
C=C[C@@H](C(=O)N1CC[C@H](CNCc2nccs2)C1)c1ccccc1	ZINC001027231330	1325326845	/nfs/dbraw/zinc/32/68/45/1325326845.db2.gz	QRSJDZQMNDNRDP-NVXWUHKLSA-N	0	3	341.480	3.051	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)[C@@H]2CC=CCC2)C1	ZINC001027294661	1325430225	/nfs/dbraw/zinc/43/02/25/1325430225.db2.gz	YWYKDNXVFHHJNQ-UXHICEINSA-N	0	3	337.467	3.337	20	30		EGEDHN
CN(Cc1ccc(C#N)c(F)c1)[C@@H]1CCCN(C(=O)c2ccoc2)C1	ZINC001027298104	1325439518	/nfs/dbraw/zinc/43/95/18/1325439518.db2.gz	VZAYADKOYVQBRN-QGZVFWFLSA-N	0	3	341.386	3.027	20	30		EGEDHN
C=CC[C@H](NCc1cc(C(=O)OC)c2n1CCCC2)c1ccncc1	ZINC000856771010	1325521366	/nfs/dbraw/zinc/52/13/66/1325521366.db2.gz	VSTNAQQXRHNEBF-SFHVURJKSA-N	0	3	339.439	3.413	20	30		EGEDHN
Cc1cc(C(=O)N2CCC[C@@H](N(C)Cc3ccc(C#N)cc3)C2)co1	ZINC001027383453	1325582839	/nfs/dbraw/zinc/58/28/39/1325582839.db2.gz	HJRMWWXFFUZXDM-LJQANCHMSA-N	0	3	337.423	3.196	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)c2cc3cc(Cl)ccc3o2)C1	ZINC001027482296	1327736272	/nfs/dbraw/zinc/73/62/72/1327736272.db2.gz	BEFSYTCFNGGPLD-OAHLLOKOSA-N	0	3	330.815	3.256	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)C2(C)CC=CC2)C1	ZINC001027558546	1327869282	/nfs/dbraw/zinc/86/92/82/1327869282.db2.gz	ZJAGKBBLHKIVFG-LJQANCHMSA-N	0	3	337.467	3.337	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@@H](N(C)Cc3ccc(F)c(C#N)c3)C2)CC1	ZINC001027562186	1327879469	/nfs/dbraw/zinc/87/94/69/1327879469.db2.gz	JYDQZBVCEHVGAU-QGZVFWFLSA-N	0	3	343.446	3.310	20	30		EGEDHN
CC(C)C1(C(=O)N2CCC[C@H](N(C)Cc3cccc(C#N)c3)C2)CC1	ZINC001027567152	1327896456	/nfs/dbraw/zinc/89/64/56/1327896456.db2.gz	RIRUSKCGRUYLAQ-IBGZPJMESA-N	0	3	339.483	3.417	20	30		EGEDHN
N#Cc1ccccc1CNC1CC2(C1)CC(NC(=O)[C@@H]1C[C@H]1C1CC1)C2	ZINC000965397406	1327990937	/nfs/dbraw/zinc/99/09/37/1327990937.db2.gz	JVHROEAKWUIAFT-UWHVAVRXSA-N	0	3	349.478	3.121	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@@H]1CCCN1Cc1cccc(C)c1	ZINC001027931851	1328409538	/nfs/dbraw/zinc/40/95/38/1328409538.db2.gz	MDQZILXCCUEHAJ-IBGZPJMESA-N	0	3	337.467	3.377	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2cn(C)c3ccc(F)cc23)C1	ZINC000966787647	1328412578	/nfs/dbraw/zinc/41/25/78/1328412578.db2.gz	QCPWQTIZOIHERC-KSSFIOAISA-N	0	3	343.446	3.334	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccccc2C(C)(C)C)C1	ZINC000966892682	1328458031	/nfs/dbraw/zinc/45/80/31/1328458031.db2.gz	PSFBLOLUOPRDRT-APWZRJJASA-N	0	3	326.484	3.448	20	30		EGEDHN
CC(=[NH+][N-]c1ccnc(C)c1)c1ccc(N2CCOCC2)cc1Cl	ZINC000863159210	1329530754	/nfs/dbraw/zinc/53/07/54/1329530754.db2.gz	HSXKDNUPFWZCKB-UHFFFAOYSA-N	0	3	344.846	3.138	20	30		EGEDHN
C#CCNC(=O)[C@@H](C)N[C@@H](CCCc1ccccc1)c1ccccc1	ZINC000863400200	1329551866	/nfs/dbraw/zinc/55/18/66/1329551866.db2.gz	JDWSZKPSGSQDKA-NQIIRXRSSA-N	0	3	334.463	3.478	20	30		EGEDHN
C[C@]12CN(Cc3nnc(-c4ccc(C#N)cc4)o3)C[C@H]1[C@H]1C=C[C@@H]2C1	ZINC000933707561	1329915058	/nfs/dbraw/zinc/91/50/58/1329915058.db2.gz	UEVOWRHXJIUAOM-PFRQMTDMSA-N	0	3	332.407	3.252	20	30		EGEDHN
Cc1ccc(C#N)cc1C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1	ZINC000935030844	1330024156	/nfs/dbraw/zinc/02/41/56/1330024156.db2.gz	ITRXLRLQAWFLCX-INIZCTEOSA-N	0	3	348.450	3.217	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)C2(c3cc(C)cc(C)c3)CC2)CC1	ZINC001052939138	1348757607	/nfs/dbraw/zinc/75/76/07/1348757607.db2.gz	LNDHFISBBMYEBY-FQEVSTJZSA-N	0	3	338.495	3.329	20	30		EGEDHN
CC1(C(=O)N[C@H]2CCN(Cc3ccc(C#N)cc3)CC2(C)C)CCC1	ZINC000940953995	1331272110	/nfs/dbraw/zinc/27/21/10/1331272110.db2.gz	IDHQJIMCSFQADJ-SFHVURJKSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@H]1CN(Cc2cccc(C#N)c2)CC[C@H]1NC(=O)C1(F)CCCC1	ZINC000942195164	1331874984	/nfs/dbraw/zinc/87/49/84/1331874984.db2.gz	GSLHVMLEZFFAFL-MAUKXSAKSA-N	0	3	343.446	3.167	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc(C3CCC3)cc2)[C@@H](C)C1	ZINC000942535590	1331961250	/nfs/dbraw/zinc/96/12/50/1331961250.db2.gz	LHXVVSQOHZBVPS-LAUBAEHRSA-N	0	3	338.495	3.347	20	30		EGEDHN
C[C@@H]1CN(Cc2cccc(C#N)c2)CC[C@@H]1NC(=O)C1(C)CCC1	ZINC000942560070	1331974902	/nfs/dbraw/zinc/97/49/02/1331974902.db2.gz	KMYRGZAAPCLJFN-QAPCUYQASA-N	0	3	325.456	3.075	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2nsc3ccc(C)cc32)[C@@H](C)C1	ZINC000942561930	1331976054	/nfs/dbraw/zinc/97/60/54/1331976054.db2.gz	DYFUJDMUBQIMJO-HOCLYGCPSA-N	0	3	341.480	3.068	20	30		EGEDHN
Cc1coc(C(=O)N[C@H]2CCN(Cc3cccc(C#N)c3)C[C@H]2C)c1	ZINC000942565388	1331978613	/nfs/dbraw/zinc/97/86/13/1331978613.db2.gz	KWIOCZJTNUCFPM-QAPCUYQASA-N	0	3	337.423	3.100	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3scnc3C)C[C@@H]2C)C1	ZINC000942602646	1332000480	/nfs/dbraw/zinc/00/04/80/1332000480.db2.gz	LUXRURDFFYCQJK-ZFWWWQNUSA-N	0	3	333.501	3.134	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3ccc(OC)cc3)C[C@@H]2C)C1	ZINC000942603218	1332001550	/nfs/dbraw/zinc/00/15/50/1332001550.db2.gz	UFZYRSDRYJLKDJ-LPHOPBHVSA-N	0	3	342.483	3.378	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3cccc(OC)c3)C[C@H]2C)C1	ZINC000942608103	1332004358	/nfs/dbraw/zinc/00/43/58/1332004358.db2.gz	PNCJPMCAIFIWPA-APWZRJJASA-N	0	3	342.483	3.378	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc3nc(C)ccc3c2)[C@H](C)C1	ZINC000943737973	1332250046	/nfs/dbraw/zinc/25/00/46/1332250046.db2.gz	JDJYDWJVJFFVSI-DNVCBOLYSA-N	0	3	335.451	3.007	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2sc(CC3CC3)nc2C)[C@@H](C)C1	ZINC000943771127	1332261057	/nfs/dbraw/zinc/26/10/57/1332261057.db2.gz	FDZJBYHVAQREHU-WFASDCNBSA-N	0	3	333.501	3.030	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C)c(C)c2Cl)[C@@H](C)C1	ZINC000944078980	1332322407	/nfs/dbraw/zinc/32/24/07/1332322407.db2.gz	IFMPETCTOIVQCM-WMLDXEAASA-N	0	3	332.875	3.420	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccsc2C(F)(F)F)[C@@H](C)C1	ZINC000944344530	1332379484	/nfs/dbraw/zinc/37/94/84/1332379484.db2.gz	ARMYHDDTFALKKF-CMPLNLGQSA-N	0	3	332.391	3.393	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2coc3ccc(F)cc23)[C@@H](C)C1	ZINC000944492140	1332413792	/nfs/dbraw/zinc/41/37/92/1332413792.db2.gz	OBFQSIINCMZDIA-GUYCJALGSA-N	0	3	328.387	3.035	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc3[nH]c(C)c(C)c3c2)[C@H](C)C1	ZINC000944892226	1332445824	/nfs/dbraw/zinc/44/58/24/1332445824.db2.gz	YZLYRQPKSUFHGI-KUHUBIRLSA-N	0	3	337.467	3.248	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccccc2CC(C)C)[C@@H](C)C1	ZINC000945365123	1332567696	/nfs/dbraw/zinc/56/76/96/1332567696.db2.gz	ILOSGMARIZNNRM-FXAWDEMLSA-N	0	3	326.484	3.349	20	30		EGEDHN
N#Cc1ccccc1CN1C[C@@H]2CCN(C(=O)CC3CC3)CC[C@@H]2C1	ZINC000946443794	1332828508	/nfs/dbraw/zinc/82/85/08/1332828508.db2.gz	LOWBIJMLZFILMR-BGYRXZFFSA-N	0	3	337.467	3.029	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3cc(C4CC4)on3)CC[C@@H]2C1	ZINC000946700034	1332880428	/nfs/dbraw/zinc/88/04/28/1332880428.db2.gz	QWJUFWJMCGMJCB-GASCZTMLSA-N	0	3	349.862	3.089	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H]2CN(Cc3nocc3C)C[C@H]2CC1	ZINC000946758832	1332893471	/nfs/dbraw/zinc/89/34/71/1332893471.db2.gz	VZAZPWUFALDYDR-FUHIMQAGSA-N	0	3	345.487	3.256	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3cccn3CC)CC[C@@H]2C1	ZINC000946892959	1332926263	/nfs/dbraw/zinc/92/62/63/1332926263.db2.gz	UMJHFBZJXWOBAJ-IYBDPMFKSA-N	0	3	335.879	3.045	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)c2ccccc2[O-])CC[N@@H+]1Cc1ccc(C#N)cc1	ZINC000947070966	1333002004	/nfs/dbraw/zinc/00/20/04/1333002004.db2.gz	NSNJWHKYUBONEH-YJBOKZPZSA-N	0	3	349.434	3.047	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)c2ccccc2[O-])CC[N@H+]1Cc1ccc(C#N)cc1	ZINC000947070966	1333002008	/nfs/dbraw/zinc/00/20/08/1333002008.db2.gz	NSNJWHKYUBONEH-YJBOKZPZSA-N	0	3	349.434	3.047	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2cc(C#N)c[nH]2)CCN1C/C=C/c1ccccc1	ZINC000947173872	1333036510	/nfs/dbraw/zinc/03/65/10/1333036510.db2.gz	AUPXDFXFDZAFNF-HXSXWYSASA-N	0	3	348.450	3.182	20	30		EGEDHN
Cc1cc(CN2CC[C@@H](NC(=O)c3c[nH]c(C#N)c3)C[C@H]2C)cs1	ZINC000947205442	1333052358	/nfs/dbraw/zinc/05/23/58/1333052358.db2.gz	QLQSKROTCKVILJ-MLGOLLRUSA-N	0	3	342.468	3.039	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)C2CC(C)(C)C2)CCN1Cc1cccc(C#N)c1	ZINC000947271491	1333072782	/nfs/dbraw/zinc/07/27/82/1333072782.db2.gz	JFWGJIYPMNBPSH-DNVCBOLYSA-N	0	3	339.483	3.464	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2coc3cc(F)ccc23)C[C@@H]1C	ZINC000947293032	1333079847	/nfs/dbraw/zinc/07/98/47/1333079847.db2.gz	ZEVQKHNUAZENQS-YOEHRIQHSA-N	0	3	342.414	3.107	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccn(C3CCCCC3)n2)C[C@@H]1C	ZINC000947314141	1333085465	/nfs/dbraw/zinc/08/54/65/1333085465.db2.gz	FNHSTRMPZYLBAZ-JKSUJKDBSA-N	0	3	330.476	3.157	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C(F)F)ccc2F)C[C@H]1C	ZINC000947319495	1333087095	/nfs/dbraw/zinc/08/70/95/1333087095.db2.gz	RSMAYDRUTMETGL-TZMCWYRMSA-N	0	3	338.373	3.369	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2snc(Cl)c2Cl)C[C@H]1C	ZINC000947356522	1333101183	/nfs/dbraw/zinc/10/11/83/1333101183.db2.gz	MROKFYZNACOPMR-RKDXNWHRSA-N	0	3	334.272	3.219	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3cccc(Cl)c3)CC2)C[C@@H]1C	ZINC000947370980	1333107256	/nfs/dbraw/zinc/10/72/56/1333107256.db2.gz	XDXWPNSIDIAMIN-MAUKXSAKSA-N	0	3	344.886	3.364	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)C2(C3CC3)CC2)CCN1Cc1cccc(C#N)c1	ZINC000947426230	1333123251	/nfs/dbraw/zinc/12/32/51/1333123251.db2.gz	OIWJMSCFNRCHKT-KXBFYZLASA-N	0	3	337.467	3.218	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(C)CCC(F)(F)CC2)C[C@H]1C	ZINC000947460846	1333137511	/nfs/dbraw/zinc/13/75/11/1333137511.db2.gz	ZXFXYXOQJFJOCL-CABCVRRESA-N	0	3	326.431	3.194	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2[nH]c3ccccc3c2Cl)C[C@H]1C	ZINC000947497213	1333147445	/nfs/dbraw/zinc/14/74/45/1333147445.db2.gz	HGKSMADHINKAGK-KGLIPLIRSA-N	0	3	343.858	3.427	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc(CC(C)C)cc2)C[C@@H]1C	ZINC000947519815	1333155107	/nfs/dbraw/zinc/15/51/07/1333155107.db2.gz	JCAUQDBNOJSIPV-GHTZIAJQSA-N	0	3	340.511	3.420	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C)c3cccnc23)C[C@@H]1C	ZINC000947554421	1333169504	/nfs/dbraw/zinc/16/95/04/1333169504.db2.gz	BLMDUXOJLDJSGB-DLBZAZTESA-N	0	3	335.451	3.149	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C)c3cccnc23)C[C@@H]1C	ZINC000947554423	1333169953	/nfs/dbraw/zinc/16/99/53/1333169953.db2.gz	BLMDUXOJLDJSGB-IRXDYDNUSA-N	0	3	335.451	3.149	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)C2(C)CCC2)CCN1Cc1ccc(C#N)cc1	ZINC000947622052	1333196347	/nfs/dbraw/zinc/19/63/47/1333196347.db2.gz	ZYGCWPXIKLJGJX-YJBOKZPZSA-N	0	3	325.456	3.218	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2c(C)[nH]c3ccccc32)C[C@H]1C	ZINC000947669988	1333216564	/nfs/dbraw/zinc/21/65/64/1333216564.db2.gz	ASUYXVKKQYEXHA-WBVHZDCISA-N	0	3	337.467	3.011	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccccc2-n2cccc2)C[C@H]1C	ZINC000947686444	1333223203	/nfs/dbraw/zinc/22/32/03/1333223203.db2.gz	YHZIEBYPQQQSOP-MSOLQXFVSA-N	0	3	335.451	3.083	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2c(C)cc(C)cc2C)C[C@@H]1C	ZINC000947689941	1333225063	/nfs/dbraw/zinc/22/50/63/1333225063.db2.gz	OJOHOZLVGBTBED-OALUTQOASA-N	0	3	326.484	3.147	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C(C)C)nc2CC)C[C@@H]1C	ZINC000947725593	1333241522	/nfs/dbraw/zinc/24/15/22/1333241522.db2.gz	BJEAYXMRZXDDCX-DLBZAZTESA-N	0	3	341.499	3.373	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2cccc(Cl)c2F)C[C@H]1C	ZINC000947751476	1333250965	/nfs/dbraw/zinc/25/09/65/1333250965.db2.gz	YDCHYVWYUTWRBG-UKRRQHHQSA-N	0	3	336.838	3.014	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccccc2OCC(C)C)C[C@H]1C	ZINC000947818894	1333270421	/nfs/dbraw/zinc/27/04/21/1333270421.db2.gz	BPBXQVRDMMLTPF-SJORKVTESA-N	0	3	330.472	3.490	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccccc2OCC(C)C)C[C@@H]1C	ZINC000947821229	1333271144	/nfs/dbraw/zinc/27/11/44/1333271144.db2.gz	RPJPXXUGJOMLCJ-ZWKOTPCHSA-N	0	3	342.483	3.327	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2csc(-c3ccoc3)n2)C[C@H]1C	ZINC000947820396	1333271168	/nfs/dbraw/zinc/27/11/68/1333271168.db2.gz	LCTNTUAITFQDRW-TZMCWYRMSA-N	0	3	331.441	3.172	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnc3ccc(F)cc3c2)C[C@@H]1C	ZINC000947895642	1333296044	/nfs/dbraw/zinc/29/60/44/1333296044.db2.gz	PQVZNNGXVQUSFZ-SUMWQHHRSA-N	0	3	327.403	3.143	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cnc(CC(C)(C)C)s2)C[C@H]1C	ZINC000947903007	1333299455	/nfs/dbraw/zinc/29/94/55/1333299455.db2.gz	BCXSCMHEXMCFLL-CABCVRRESA-N	0	3	347.528	3.338	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnn(CCC(C)C)c2C)C[C@H]1C	ZINC000947903678	1333300555	/nfs/dbraw/zinc/30/05/55/1333300555.db2.gz	LYSRDBSRVJIIIL-WBVHZDCISA-N	0	3	332.492	3.006	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C(C)(C)c2ccc(C)cc2)C[C@H]1C	ZINC000947944527	1333314449	/nfs/dbraw/zinc/31/44/49/1333314449.db2.gz	WRFIRYPMIRMZJQ-IEBWSBKVSA-N	0	3	326.484	3.265	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccccc2C(F)(F)F)C[C@@H]1C	ZINC000947962451	1333321753	/nfs/dbraw/zinc/32/17/53/1333321753.db2.gz	MZIUCBXLRDBBLO-UONOGXRCSA-N	0	3	338.373	3.311	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2coc3ccc(F)cc23)C[C@@H]1C	ZINC000947975420	1333329187	/nfs/dbraw/zinc/32/91/87/1333329187.db2.gz	NJUKOYCLHGAEQX-DZGCQCFKSA-N	0	3	328.387	3.178	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3ccccc3)CCCC2)C[C@@H]1C	ZINC000948001678	1333338163	/nfs/dbraw/zinc/33/81/63/1333338163.db2.gz	DHALBUYBIZIQSL-AZUAARDMSA-N	0	3	338.495	3.491	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccc(OCC(C)C)c2)C[C@@H]1C	ZINC000948017984	1333343942	/nfs/dbraw/zinc/34/39/42/1333343942.db2.gz	YHPXPLAKNAIVSZ-PKOBYXMFSA-N	0	3	342.483	3.327	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C(C)(C)c2ccccc2C)C[C@H]1C	ZINC000948089299	1333371777	/nfs/dbraw/zinc/37/17/77/1333371777.db2.gz	BVWPTJKZKACDDD-MSOLQXFVSA-N	0	3	326.484	3.265	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(N(C)CCC)cc2)C[C@@H]1C	ZINC000948095303	1333372800	/nfs/dbraw/zinc/37/28/00/1333372800.db2.gz	VCHDDGYRSUOFSO-HKUYNNGSSA-N	0	3	341.499	3.139	20	30		EGEDHN
CC1CC(C(=O)N(C)[C@H]2CCCN(Cc3cccc(C#N)c3)CC2)C1	ZINC000948285856	1333463305	/nfs/dbraw/zinc/46/33/05/1333463305.db2.gz	DZEMXGMCICGLBG-GQOXECLESA-N	0	3	339.483	3.417	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2cccc(-n3cccc3)c2)CC1	ZINC000948591328	1333587360	/nfs/dbraw/zinc/58/73/60/1333587360.db2.gz	UZCBKHDCIOQVKQ-IBGZPJMESA-N	0	3	335.451	3.037	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cccc(-n3cccc3)c2)CC1	ZINC000948590122	1333587503	/nfs/dbraw/zinc/58/75/03/1333587503.db2.gz	IYHGSISFXUEXOQ-HXUWFJFHSA-N	0	3	349.478	3.427	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)[C@@H](C)c2c(F)cccc2F)CC1	ZINC000948621589	1333600555	/nfs/dbraw/zinc/60/05/55/1333600555.db2.gz	RAHJTKKBIFOORZ-HOTGVXAUSA-N	0	3	348.437	3.405	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N(C)[C@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948687964	1333631412	/nfs/dbraw/zinc/63/14/12/1333631412.db2.gz	GEBRAOHBVCAPHL-SNRMKQJTSA-N	0	3	325.456	3.027	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2nccc3ccccc32)CC1	ZINC000948725867	1333648164	/nfs/dbraw/zinc/64/81/64/1333648164.db2.gz	JPBQDGDDZCFLJR-SFHVURJKSA-N	0	3	335.451	3.185	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2c3ccccc3CCN2CCCC)nc1	ZINC000948979692	1333756138	/nfs/dbraw/zinc/75/61/38/1333756138.db2.gz	ZWBPITKTKQHHGT-OAQYLSRUSA-N	0	3	347.462	3.192	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1cc(C)cc(Cl)c1)CCO2	ZINC000949141615	1333783950	/nfs/dbraw/zinc/78/39/50/1333783950.db2.gz	GOGZLBXDOVFKGY-UHFFFAOYSA-N	0	3	348.874	3.141	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C13CCC(CC1)C3(C)C)CCO2	ZINC000949206936	1333796203	/nfs/dbraw/zinc/79/62/03/1333796203.db2.gz	FWUDCHGWHAEFOC-UHFFFAOYSA-N	0	3	346.515	3.082	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1c(C)cc(C)cc1C)CCO2	ZINC000949241808	1333802085	/nfs/dbraw/zinc/80/20/85/1333802085.db2.gz	SBWYYZGBLFMJRV-UHFFFAOYSA-N	0	3	342.483	3.105	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@@H]3CCC[C@@H]4C[C@@H]43)CC2)C1	ZINC000949402282	1333838431	/nfs/dbraw/zinc/83/84/31/1333838431.db2.gz	XFKOIFWSMYXASQ-QRVBRYPASA-N	0	3	346.515	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@H]3CCCC[C@@H]3C)CC2)C1	ZINC000949451203	1333850841	/nfs/dbraw/zinc/85/08/41/1333850841.db2.gz	SUAOSJIRNUSZEL-ROUUACIJSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C3(C)CCCCC3)CC2)C1	ZINC000949458567	1333852757	/nfs/dbraw/zinc/85/27/57/1333852757.db2.gz	IBJZQWCTHWSNHL-UHFFFAOYSA-N	0	3	334.504	3.226	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@@]3(C)CCC[C@H]3C)CC2)C1	ZINC000949463128	1333853935	/nfs/dbraw/zinc/85/39/35/1333853935.db2.gz	KGEMQOPQRREAKF-MJGOQNOKSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)c3occc3CC)CC2)C1	ZINC000949466650	1333855602	/nfs/dbraw/zinc/85/56/02/1333855602.db2.gz	ONBYBLCZLHVUQH-UHFFFAOYSA-N	0	3	346.471	3.115	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@@H]3CCCCC3(C)C)CC2)C1	ZINC000949534492	1333870823	/nfs/dbraw/zinc/87/08/23/1333870823.db2.gz	ZVRQHQLPLNXHRF-SFHVURJKSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2ccc(-n3cccc3)cc2)C1	ZINC000967273998	1335683338	/nfs/dbraw/zinc/68/33/38/1335683338.db2.gz	ODLIADFCKBTISI-YLJYHZDGSA-N	0	3	337.467	3.494	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2nc(Cl)sc2C)C1	ZINC000967313638	1335697824	/nfs/dbraw/zinc/69/78/24/1335697824.db2.gz	OKWVSXKFQVJPKO-CMPLNLGQSA-N	0	3	327.881	3.121	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2cc3c(cc(C)cc3C)[nH]2)C1	ZINC000967463468	1335748532	/nfs/dbraw/zinc/74/85/32/1335748532.db2.gz	IDWVDQPCXANOAI-YWZLYKJASA-N	0	3	337.467	3.248	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2nsc3ccc(C)cc32)C1	ZINC000967780506	1335815808	/nfs/dbraw/zinc/81/58/08/1335815808.db2.gz	PRSGPEAMVYBFPR-GOEBONIOSA-N	0	3	341.480	3.068	20	30		EGEDHN
C=C(C)CCN1CC[C@H](C)[C@H](NC(=O)c2ocnc2C(F)F)C1	ZINC000968331096	1335891751	/nfs/dbraw/zinc/89/17/51/1335891751.db2.gz	KCLLFDIUAVDNHF-NWDGAFQWSA-N	0	3	327.375	3.019	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cc(C(C)(C)C)oc2C)C1	ZINC000968357546	1335901637	/nfs/dbraw/zinc/90/16/37/1335901637.db2.gz	OULSMOWXJOBJAW-PBHICJAKSA-N	0	3	330.472	3.349	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)Cc2c[nH]c3cc(C)ccc23)C1	ZINC000968405697	1335922546	/nfs/dbraw/zinc/92/25/46/1335922546.db2.gz	PMQSERUKTPUVJM-JXFKEZNVSA-N	0	3	339.483	3.422	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2occc2Br)C1	ZINC000968426053	1335926534	/nfs/dbraw/zinc/92/65/34/1335926534.db2.gz	ANDDXZPSUKWWPB-AAEUAGOBSA-N	0	3	341.249	3.058	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2cccc(C(C)(C)C)c2)C1	ZINC000968453755	1335929895	/nfs/dbraw/zinc/92/98/95/1335929895.db2.gz	GGAWEYPHDAEKMY-LPHOPBHVSA-N	0	3	326.484	3.448	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2cccn2C2CCCC2)C1	ZINC000968477582	1335936020	/nfs/dbraw/zinc/93/60/20/1335936020.db2.gz	UMWYJPOSUGSXTL-WMZOPIPTSA-N	0	3	327.472	3.067	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2ccc3scnc3c2)C1	ZINC000968498255	1335941980	/nfs/dbraw/zinc/94/19/80/1335941980.db2.gz	YUUMTYGDGKRBEU-BBRMVZONSA-N	0	3	329.469	3.313	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)C2(c3ccccc3C)CCC2)C1	ZINC000968592159	1335976270	/nfs/dbraw/zinc/97/62/70/1335976270.db2.gz	LHOBPBYMUNDTCG-AZUAARDMSA-N	0	3	338.495	3.267	20	30		EGEDHN
C[C@@H](N[C@@H]1CCN(C(=O)C#CC2CC2)C1)c1ccc(F)c(Cl)c1	ZINC000968617936	1335985242	/nfs/dbraw/zinc/98/52/42/1335985242.db2.gz	QADNLVRAUHSMSZ-IUODEOHRSA-N	0	3	334.822	3.144	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)Cc2ccc(OCC)cc2)C1	ZINC000968618675	1335985265	/nfs/dbraw/zinc/98/52/65/1335985265.db2.gz	HWLXYJSXEGLNRC-APWZRJJASA-N	0	3	330.472	3.031	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cccc(OCC(C)C)c2)C1	ZINC000968628330	1335990361	/nfs/dbraw/zinc/99/03/61/1335990361.db2.gz	WNMHPXJYVGJCGO-XLIONFOSSA-N	0	3	342.483	3.185	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccc(COC(C)C)cc2)C1	ZINC000968628535	1335990445	/nfs/dbraw/zinc/99/04/45/1335990445.db2.gz	ZZOHYSKNZXZMRA-YLJYHZDGSA-N	0	3	342.483	3.075	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)C23CC(C(F)(F)F)(C2)C3)C1	ZINC000968681414	1336008473	/nfs/dbraw/zinc/00/84/73/1336008473.db2.gz	JCKFQNXSOWOYES-VRLRAXNCSA-N	0	3	330.394	3.122	20	30		EGEDHN
N#Cc1ccc(CN2CCCCC[C@@H]2CNC(=O)C2CCC2)cc1	ZINC000968724315	1336024376	/nfs/dbraw/zinc/02/43/76/1336024376.db2.gz	DEGPQHIURTUCFD-LJQANCHMSA-N	0	3	325.456	3.219	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C1	ZINC000968795711	1336054470	/nfs/dbraw/zinc/05/44/70/1336054470.db2.gz	VZTYRAYZHWRFIC-GFCCVEGCSA-N	0	3	337.876	3.089	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1ccc2cccnc2n1	ZINC000968861033	1336071275	/nfs/dbraw/zinc/07/12/75/1336071275.db2.gz	DYPUNZBYVHQQGP-QGZVFWFLSA-N	0	3	338.455	3.180	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccc(-n2cccn2)cc1	ZINC000968890317	1336081378	/nfs/dbraw/zinc/08/13/78/1336081378.db2.gz	GNAGBHCYQMGOHY-LJQANCHMSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)[C@@H]1CCc2ccc(OC)cc21	ZINC000968890603	1336081676	/nfs/dbraw/zinc/08/16/76/1336081676.db2.gz	LQKMQISQKOGVLX-PKOBYXMFSA-N	0	3	342.483	3.272	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1ccsc1COC	ZINC000968916899	1336088379	/nfs/dbraw/zinc/08/83/79/1336088379.db2.gz	KGUFLCBBOGAMBR-OAHLLOKOSA-N	0	3	336.501	3.445	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1ccc2cnccc2n1	ZINC000969044486	1336125876	/nfs/dbraw/zinc/12/58/76/1336125876.db2.gz	QZZIEEFITROBFV-QGZVFWFLSA-N	0	3	338.455	3.180	20	30		EGEDHN
N#Cc1ccc(CN2CCCCC[C@@H]2CNC(=O)[C@@H]2CC23CC3)cc1	ZINC000969049837	1336128170	/nfs/dbraw/zinc/12/81/70/1336128170.db2.gz	OOFANORVUXODAB-MOPGFXCFSA-N	0	3	337.467	3.219	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1nc2ccccn2c1F	ZINC000969098182	1336142244	/nfs/dbraw/zinc/14/22/44/1336142244.db2.gz	YNRXHDNXDBFKQL-OAHLLOKOSA-N	0	3	344.434	3.024	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cc2c(C)cccn2c1	ZINC000969114994	1336149735	/nfs/dbraw/zinc/14/97/35/1336149735.db2.gz	MKIWCDZOWGAHBF-GOSISDBHSA-N	0	3	325.456	3.408	20	30		EGEDHN
C#CCN1CCCCC[C@@H]1CNC(=O)c1c[nH]c2c1cccc2CC	ZINC000969156377	1336165599	/nfs/dbraw/zinc/16/55/99/1336165599.db2.gz	RHQFZMSYHYQUPT-QGZVFWFLSA-N	0	3	337.467	3.338	20	30		EGEDHN
C#CCCN1CC([C@@H](C)NC(=O)c2cc(Cl)sc2Cl)C1	ZINC000969843436	1336253360	/nfs/dbraw/zinc/25/33/60/1336253360.db2.gz	AOCJCADBSRVUOA-SECBINFHSA-N	0	3	331.268	3.128	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccc(-c3ccncc3)o2)CC1	ZINC001005497666	1336361915	/nfs/dbraw/zinc/36/19/15/1336361915.db2.gz	PFBAWKPWDRNNFY-UHFFFAOYSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)C2(c3cccc(F)c3)CCC2)CC1	ZINC001005801929	1336403324	/nfs/dbraw/zinc/40/33/24/1336403324.db2.gz	BVLUDIKNNMBLBK-UHFFFAOYSA-N	0	3	330.447	3.356	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)N(C)C2CCN(Cc3ccc(C#N)cc3)CC2)C1	ZINC001006082070	1336448771	/nfs/dbraw/zinc/44/87/71/1336448771.db2.gz	JXALLSMNSKBIKR-LPHOPBHVSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2ccccc2OCC2CC2)CC1	ZINC001006438735	1336506419	/nfs/dbraw/zinc/50/64/19/1336506419.db2.gz	LOYYQWRVGYOFEE-UHFFFAOYSA-N	0	3	328.456	3.198	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN(CCc3cccs3)C2)cc1	ZINC001008150909	1336780904	/nfs/dbraw/zinc/78/09/04/1336780904.db2.gz	XAOBYLITDFEYIK-GOSISDBHSA-N	0	3	338.476	3.166	20	30		EGEDHN
C#CCCN1CCC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2)C1	ZINC001008830713	1336931846	/nfs/dbraw/zinc/93/18/46/1336931846.db2.gz	ZXNOCESRLABXIZ-OKZBNKHCSA-N	0	3	330.859	3.047	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2cc(F)c3ncccc3c2)C1	ZINC001008885389	1336937516	/nfs/dbraw/zinc/93/75/16/1336937516.db2.gz	ZILOYYOKYIIOBY-INIZCTEOSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2cnc3ccc(F)cc3c2)C1	ZINC001009087236	1336966484	/nfs/dbraw/zinc/96/64/84/1336966484.db2.gz	CBQUDJXJXPWQSN-QGZVFWFLSA-N	0	3	327.403	3.144	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCN([C@H](C)c3ccccc3)C2)cn1	ZINC001009276360	1336996011	/nfs/dbraw/zinc/99/60/11/1336996011.db2.gz	OIBVIEOQSDNYHS-UZLBHIALSA-N	0	3	333.435	3.018	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CCN(Cc2c(C)cccc2C)C1	ZINC001014721622	1337883922	/nfs/dbraw/zinc/88/39/22/1337883922.db2.gz	FWWUAZSAMUGYNO-SFHVURJKSA-N	0	3	337.467	3.295	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(CCc3ccc(CC)cc3)C2)C1	ZINC001015670214	1338246787	/nfs/dbraw/zinc/24/67/87/1338246787.db2.gz	KZNXVNHKBVAVQZ-LJQANCHMSA-N	0	3	326.484	3.338	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N[C@H]1CCN(Cc2ccc(C)cc2)C1	ZINC001015815782	1338324536	/nfs/dbraw/zinc/32/45/36/1338324536.db2.gz	BWWULXMKHTWVRO-UFYCRDLUSA-N	0	3	342.483	3.057	20	30		EGEDHN
C[C@H](C(=O)N[C@H]1CC12CCN(Cc1cccc(C#N)c1)CC2)C1CC1	ZINC001016566096	1338649672	/nfs/dbraw/zinc/64/96/72/1338649672.db2.gz	RTTJUZFSTOQACF-KXBFYZLASA-N	0	3	337.467	3.075	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@H]3NC(=O)C3(C4CC4)CC3)CC2)c1	ZINC001016675732	1338687247	/nfs/dbraw/zinc/68/72/47/1338687247.db2.gz	LHAVVWIQXYXOOA-LJQANCHMSA-N	0	3	349.478	3.219	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cc(C)c3ccccc3n2)CC1	ZINC001016687628	1338690734	/nfs/dbraw/zinc/69/07/34/1338690734.db2.gz	KVMFCVGUPPSCRY-FQEVSTJZSA-N	0	3	347.462	3.151	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)Cc2ccc(C(F)F)cc2)CC1	ZINC001016724396	1338703094	/nfs/dbraw/zinc/70/30/94/1338703094.db2.gz	QBQBZJCZZKYIQJ-KRWDZBQOSA-N	0	3	346.421	3.161	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)C(C)(C)c2ccc(Cl)cc2)CC1	ZINC001016801367	1338731602	/nfs/dbraw/zinc/73/16/02/1338731602.db2.gz	WREGRAIXQYHZHK-QGZVFWFLSA-N	0	3	344.886	3.222	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CC23CCN(Cc2ccccn2)CC3)CC1	ZINC001016804371	1338732230	/nfs/dbraw/zinc/73/22/30/1338732230.db2.gz	XGEURXNJBHNCGK-IBGZPJMESA-N	0	3	339.483	3.299	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccc(C)cc2Cl)CC1	ZINC001016833922	1338740253	/nfs/dbraw/zinc/74/02/53/1338740253.db2.gz	VMKQZFNVHQWLSA-QGZVFWFLSA-N	0	3	330.859	3.256	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)C(C)(C)c2ccc(CC)cc2)CC1	ZINC001016921324	1338770215	/nfs/dbraw/zinc/77/02/15/1338770215.db2.gz	QCIZLHYUXUTURW-IBGZPJMESA-N	0	3	338.495	3.131	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cccc3ccccc32)CC1	ZINC001016953749	1338783015	/nfs/dbraw/zinc/78/30/15/1338783015.db2.gz	WYMYVUVQBPKUSF-HXUWFJFHSA-N	0	3	332.447	3.447	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccc(F)cc2Cl)CC1	ZINC001016955246	1338783338	/nfs/dbraw/zinc/78/33/38/1338783338.db2.gz	ICKIEYRBZCQZIA-MRXNPFEDSA-N	0	3	334.822	3.087	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC[C@H](CN(C)Cc3ccccn3)C2)cc1	ZINC001017176276	1338919802	/nfs/dbraw/zinc/91/98/02/1338919802.db2.gz	KDHAMZVMOQAPNM-LJQANCHMSA-N	0	3	347.462	3.047	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H](CN(C)Cc2cnc(C)nc2)C1	ZINC001017178893	1338922696	/nfs/dbraw/zinc/92/26/96/1338922696.db2.gz	BYMMLBYAEPUKFI-KRWDZBQOSA-N	0	3	344.503	3.058	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](CN(C)Cc2scnc2C)C1	ZINC001017179571	1338922850	/nfs/dbraw/zinc/92/28/50/1338922850.db2.gz	KROFIYLLMGFDQY-HNNXBMFYSA-N	0	3	335.517	3.334	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](CN(C)Cc2c(C)onc2CC)C1	ZINC001017181254	1338925910	/nfs/dbraw/zinc/92/59/10/1338925910.db2.gz	YUJMIOLNURNSPU-MRXNPFEDSA-N	0	3	347.503	3.428	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1c2c[nH]nc2ccc1C	ZINC001017688558	1339391177	/nfs/dbraw/zinc/39/11/77/1339391177.db2.gz	GUBMURFBPBVTPI-IYBDPMFKSA-N	0	3	338.455	3.126	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@H]1CCC(C)(C)CO1	ZINC001017746341	1339410046	/nfs/dbraw/zinc/41/00/46/1339410046.db2.gz	BKMDUZKMEPAPSE-FGTMMUONSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CO[C@H]1CCC[C@@H](C)C1	ZINC001018014550	1339481420	/nfs/dbraw/zinc/48/14/20/1339481420.db2.gz	LQUDVTXAROHLLY-YRXWBPOGSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](c1cccnc1)C(C)C	ZINC001018100118	1339501485	/nfs/dbraw/zinc/50/14/85/1339501485.db2.gz	XQGSHFCIRLJSOE-ZCNNSNEGSA-N	0	3	341.499	3.463	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H]1CCO[C@@H](CC)C1	ZINC001018155995	1339517481	/nfs/dbraw/zinc/51/74/81/1339517481.db2.gz	IESPFPSAXCKJNG-YRXWBPOGSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccc(COC)c1	ZINC001018167426	1339520498	/nfs/dbraw/zinc/52/04/98/1339520498.db2.gz	VJNDWSAXSYTKKJ-BGYRXZFFSA-N	0	3	342.483	3.017	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cnn(CC(C)C)c1C	ZINC001018224645	1339539586	/nfs/dbraw/zinc/53/95/86/1339539586.db2.gz	QXVUYSWOUMSZLA-HDICACEKSA-N	0	3	344.503	3.103	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)Oc1ccc(C)cc1	ZINC001018244847	1339547830	/nfs/dbraw/zinc/54/78/30/1339547830.db2.gz	FBHRCDNYSPIEPA-QRVBRYPASA-N	0	3	342.483	3.404	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1c[nH]c2ccc(F)cc12	ZINC001018343614	1339585807	/nfs/dbraw/zinc/58/58/07/1339585807.db2.gz	ADCFQRPEAAEJEQ-GASCZTMLSA-N	0	3	327.403	3.172	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC[C@H](NC2c3ccccc3-c3ccccc32)C1	ZINC001018633270	1339688401	/nfs/dbraw/zinc/68/84/01/1339688401.db2.gz	VTIVHSBXWQXXSR-CABCVRRESA-N	0	3	331.419	3.107	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1sccc1-n1cccc1	ZINC001028059786	1340403648	/nfs/dbraw/zinc/40/36/48/1340403648.db2.gz	GVSFDNXEGDWCCL-HNNXBMFYSA-N	0	3	329.469	3.309	20	30		EGEDHN
C#CCCN1CCC[C@@H]1CNC(=O)c1ccccc1O[C@H](C)CC	ZINC001028171316	1340466289	/nfs/dbraw/zinc/46/62/89/1340466289.db2.gz	FACLFDUWEVVKJV-IAGOWNOFSA-N	0	3	328.456	3.081	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1cccc(-c2cnco2)c1	ZINC001028235570	1340497551	/nfs/dbraw/zinc/49/75/51/1340497551.db2.gz	AHEJTQLHFQJXCT-QGZVFWFLSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1cnn(C(CC)CC)c1C	ZINC001028250742	1340511780	/nfs/dbraw/zinc/51/17/80/1340511780.db2.gz	MAXUDTXOBAHMGH-QGZVFWFLSA-N	0	3	332.492	3.323	20	30		EGEDHN
Cc1cccc(C(=O)NC[C@@H]2CCN(Cc3cccc(C#N)c3)C2)c1	ZINC001028376430	1340604440	/nfs/dbraw/zinc/60/44/40/1340604440.db2.gz	ZNJYNYKNRMPQGL-IBGZPJMESA-N	0	3	333.435	3.119	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](CNC(=O)C3CC4(CCC4)C3)C2)cc1	ZINC001028746243	1340787739	/nfs/dbraw/zinc/78/77/39/1340787739.db2.gz	ADRZAUDIJMDHMZ-SFHVURJKSA-N	0	3	337.467	3.077	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CCN(Cc3scnc3C)C2)CC1	ZINC001028780351	1340812934	/nfs/dbraw/zinc/81/29/34/1340812934.db2.gz	HRGJXTFQIKINIH-OAHLLOKOSA-N	0	3	333.501	3.136	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](CNC(=O)[C@H]3CC34CCCC4)C2)cc1	ZINC001028909304	1340881125	/nfs/dbraw/zinc/88/11/25/1340881125.db2.gz	JAXRYOCMPHYXMP-RBUKOAKNSA-N	0	3	337.467	3.077	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)c2cc3cccc(Cl)c3o2)C1	ZINC001029027019	1340912226	/nfs/dbraw/zinc/91/22/26/1340912226.db2.gz	GVWROSJQVSQDDS-CYBMUJFWSA-N	0	3	330.815	3.161	20	30		EGEDHN
CCCC(=O)N1CCC([C@H](C)NCc2cc(F)ccc2C#N)CC1	ZINC001029037351	1340914129	/nfs/dbraw/zinc/91/41/29/1340914129.db2.gz	DHRHYZDUKJDFLI-AWEZNQCLSA-N	0	3	331.435	3.214	20	30		EGEDHN
C[C@@H](NCc1c(F)cccc1F)C1CCN(C(=O)C#CC2CC2)CC1	ZINC001029097748	1340929582	/nfs/dbraw/zinc/92/95/82/1340929582.db2.gz	IIMIPJDCPYITNW-CQSZACIVSA-N	0	3	346.421	3.095	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H](CN(C)Cc2cncc(C)c2)C1	ZINC001029825380	1341087336	/nfs/dbraw/zinc/08/73/36/1341087336.db2.gz	CJDLKGSMXYBYFU-YLJYHZDGSA-N	0	3	329.488	3.273	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H](CN(C)Cc2ncccc2C)C1	ZINC001029826477	1341087627	/nfs/dbraw/zinc/08/76/27/1341087627.db2.gz	QYFBOSVXYNDTFY-XLIONFOSSA-N	0	3	329.488	3.273	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](CN(C)Cc3cncc(F)c3)C2)CC1	ZINC001029826787	1341087955	/nfs/dbraw/zinc/08/79/55/1341087955.db2.gz	VUUFASXHPRJNFZ-INIZCTEOSA-N	0	3	345.462	3.247	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CCC(CN(C)Cc2ccc(C#N)s2)CC1	ZINC001029985503	1341145037	/nfs/dbraw/zinc/14/50/37/1341145037.db2.gz	ZTPNMAMERCLBCI-MRXNPFEDSA-N	0	3	337.464	3.038	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC(CN(C)[C@@H](C)c2cnccn2)CC1	ZINC001029989932	1341147839	/nfs/dbraw/zinc/14/78/39/1341147839.db2.gz	DHFNOAJZLUVQCQ-JXFKEZNVSA-N	0	3	344.503	3.310	20	30		EGEDHN
C#Cc1ccc(C(=O)NCC2CN(Cc3c(C)cc(C)cc3C)C2)cc1	ZINC001031892282	1341417636	/nfs/dbraw/zinc/41/76/36/1341417636.db2.gz	VFEGQYMGTBVGDR-UHFFFAOYSA-N	0	3	346.474	3.455	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H]1CCCC[C@@H]1C(F)(F)F	ZINC001032477878	1341519672	/nfs/dbraw/zinc/51/96/72/1341519672.db2.gz	RXEGKYBLWJZSGI-XQLPTFJDSA-N	0	3	330.394	3.216	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H]1CCO[C@H]1c1ccccc1	ZINC001032676917	1341578851	/nfs/dbraw/zinc/57/88/51/1341578851.db2.gz	JCSLDUHQWYSTSF-HAGHYFMRSA-N	0	3	340.467	3.016	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H](c1cccnc1)C(C)C	ZINC001032699917	1341585430	/nfs/dbraw/zinc/58/54/30/1341585430.db2.gz	BXXYTJCPUVZMBU-GBESFXJTSA-N	0	3	327.472	3.073	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H](C)c1ccc(F)c(F)c1	ZINC001032794167	1341615400	/nfs/dbraw/zinc/61/54/00/1341615400.db2.gz	LLUNBLBANOQYNB-BPUTZDHNSA-N	0	3	334.410	3.320	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)C1CC(c2cccc(F)c2)C1	ZINC001032816025	1341625404	/nfs/dbraw/zinc/62/54/04/1341625404.db2.gz	APRNWGNQBOLOHV-VHZYLWGESA-N	0	3	328.431	3.181	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)[C@@H]2CC=CC[C@H]2C(F)(F)F)C1	ZINC001033192941	1341749230	/nfs/dbraw/zinc/74/92/30/1341749230.db2.gz	ZERDVUMXKSEXOI-RBSFLKMASA-N	0	3	330.394	3.240	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)C[C@H]2CCOc3ccccc32)C1	ZINC001033335015	1341785993	/nfs/dbraw/zinc/78/59/93/1341785993.db2.gz	ZAMUZOSPZXVMCG-IAGOWNOFSA-N	0	3	328.456	3.052	20	30		EGEDHN
C#Cc1cncc(C(=O)N(C)[C@H]2CCN(Cc3ccc(C)cc3C)C2)c1	ZINC001033405371	1341816921	/nfs/dbraw/zinc/81/69/21/1341816921.db2.gz	LXOSQSJTJOFRQN-NRFANRHFSA-N	0	3	347.462	3.026	20	30		EGEDHN
C#CCCN1CC[C@@H](N(C)C(=O)C(C)(C)c2cccc(Cl)c2)C1	ZINC001033457796	1341832341	/nfs/dbraw/zinc/83/23/41/1341832341.db2.gz	DDOIQNPCRLKMRV-QGZVFWFLSA-N	0	3	332.875	3.174	20	30		EGEDHN
C=C(C)CCN1CC[C@H](N(C)C(=O)c2cnc([C@@H]3CCCO3)s2)C1	ZINC001033485087	1341842369	/nfs/dbraw/zinc/84/23/69/1341842369.db2.gz	XCYQLBPHDKSQDH-GJZGRUSLSA-N	0	3	349.500	3.107	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC001033495849	1341846824	/nfs/dbraw/zinc/84/68/24/1341846824.db2.gz	BSNQYAAXAFQKKU-AABGKKOBSA-N	0	3	342.483	3.091	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)[C@]2(C)CCCc3ccccc32)C1	ZINC001033510821	1341852762	/nfs/dbraw/zinc/85/27/62/1341852762.db2.gz	WXJRHYHJMQHBPK-GHTZIAJQSA-N	0	3	326.484	3.389	20	30		EGEDHN
C#CCCN1CC[C@H](N(C)C(=O)c2coc3ccc(Cl)cc23)C1	ZINC001033623170	1341907053	/nfs/dbraw/zinc/90/70/53/1341907053.db2.gz	DJKSVLGGWWLPDU-AWEZNQCLSA-N	0	3	330.815	3.256	20	30		EGEDHN
C#CCCN1CC[C@H](N(C)C(=O)c2csc3c2CC[C@@H](C)C3)C1	ZINC001033634515	1341916746	/nfs/dbraw/zinc/91/67/46/1341916746.db2.gz	QNBSRHNSRCKBJY-CABCVRRESA-N	0	3	330.497	3.043	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cnn(C(C)(C)C)c2C)C1	ZINC001033847798	1342042612	/nfs/dbraw/zinc/04/26/12/1342042612.db2.gz	YEFDFSVFGXBTCD-INIZCTEOSA-N	0	3	332.492	3.059	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2oc3c(cccc3F)c2C)C1	ZINC001033858556	1342047881	/nfs/dbraw/zinc/04/78/81/1342047881.db2.gz	ILUKBYDTKCMUMU-OAHLLOKOSA-N	0	3	342.414	3.440	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cccc3c2O[C@@H](C)C3)C1	ZINC001033898993	1342070900	/nfs/dbraw/zinc/07/09/00/1342070900.db2.gz	FGPJXKCDMOJZCT-DOTOQJQBSA-N	0	3	328.456	3.123	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@@H]2COc3ccc(Cl)cc32)C1	ZINC001033902083	1342075469	/nfs/dbraw/zinc/07/54/69/1342075469.db2.gz	XPOIEJCUTXLIFN-NVXWUHKLSA-N	0	3	348.874	3.315	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)[C@H]2CCc3c2cccc3Cl)C1	ZINC001033902822	1342075895	/nfs/dbraw/zinc/07/58/95/1342075895.db2.gz	SBFMCHYHTHBKEG-QAPCUYQASA-N	0	3	344.886	3.316	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N(CC)[C@@H]1CCN(Cc2cccc(C)c2)C1	ZINC001033960686	1342113620	/nfs/dbraw/zinc/11/36/20/1342113620.db2.gz	ZVEVEZGMZORYPV-AQNXPRMDSA-N	0	3	342.483	3.009	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2csc(C(C)(C)C)n2)C1	ZINC001033992323	1342134715	/nfs/dbraw/zinc/13/47/15/1342134715.db2.gz	QNSYURFIXPYYRT-CQSZACIVSA-N	0	3	333.501	3.000	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccc(-c3c[nH]cn3)cc2)C1	ZINC001034009162	1342146863	/nfs/dbraw/zinc/14/68/63/1342146863.db2.gz	HDTXRCBMOMJCHJ-SFHVURJKSA-N	0	3	338.455	3.189	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@H]2CCCc3sc(C)nc32)C1	ZINC001034015195	1342151658	/nfs/dbraw/zinc/15/16/58/1342151658.db2.gz	MAEYDDXOKZYIKE-CVEARBPZSA-N	0	3	347.528	3.370	20	30		EGEDHN
C=CCCN1CC[C@H](N(CC)C(=O)c2cc3nc(C)ccc3o2)C1	ZINC001034024368	1342162298	/nfs/dbraw/zinc/16/22/98/1342162298.db2.gz	ABUGMDBXKAJDMD-HNNXBMFYSA-N	0	3	327.428	3.249	20	30		EGEDHN
N#Cc1ccc(CN2CCCC[C@H](NC(=O)C[C@H]3C=CCC3)C2)cc1	ZINC001034092191	1342232104	/nfs/dbraw/zinc/23/21/04/1342232104.db2.gz	URTTUDRHDJTSOG-PXNSSMCTSA-N	0	3	337.467	3.385	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2c(C)nn(C(C)(C)C)c2C)C1	ZINC001034232909	1342336278	/nfs/dbraw/zinc/33/62/78/1342336278.db2.gz	ZDAUOOHCJPVXHM-QGZVFWFLSA-N	0	3	346.519	3.415	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)c2cc(Cl)c(Cl)n2C)C1	ZINC001034238260	1342339309	/nfs/dbraw/zinc/33/93/09/1342339309.db2.gz	BPWWWHKXSILWDI-NSHDSACASA-N	0	3	330.259	3.102	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@@H]2CCCN2c2ccccc2)C1	ZINC001034239692	1342340393	/nfs/dbraw/zinc/34/03/93/1342340393.db2.gz	AFQKCDXDXDKTJW-QUCCMNQESA-N	0	3	341.499	3.202	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC001034267843	1342359425	/nfs/dbraw/zinc/35/94/25/1342359425.db2.gz	ZCSNRYOKEFKBGQ-RTBURBONSA-N	0	3	341.499	3.060	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2n[nH]c(C3CC3)c2Cl)C1	ZINC001034289733	1342375936	/nfs/dbraw/zinc/37/59/36/1342375936.db2.gz	BSERMZFFJIMPCQ-CYBMUJFWSA-N	0	3	336.867	3.101	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)c2coc3ccc(OC)cc32)C1	ZINC001034304766	1342387603	/nfs/dbraw/zinc/38/76/03/1342387603.db2.gz	XTLMAFKAUULPBZ-CQSZACIVSA-N	0	3	328.412	3.212	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2cc(-c3cccs3)on2)C1	ZINC001034334784	1342409559	/nfs/dbraw/zinc/40/95/59/1342409559.db2.gz	SAWFQTYJLBAPBD-AWEZNQCLSA-N	0	3	343.452	3.011	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cc3cc(F)ccc3[nH]2)C1	ZINC001034335807	1342410532	/nfs/dbraw/zinc/41/05/32/1342410532.db2.gz	HPVBWYKSROZXLM-MRXNPFEDSA-N	0	3	329.419	3.467	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2nsc3ccc(C)cc32)C1	ZINC001034344287	1342416728	/nfs/dbraw/zinc/41/67/28/1342416728.db2.gz	GVBWQJAPKPKMNQ-OAHLLOKOSA-N	0	3	341.480	3.212	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccn(C(CC)CC)n2)C1	ZINC001034430419	1342492212	/nfs/dbraw/zinc/49/22/12/1342492212.db2.gz	FAYPPPPQGSJICH-INIZCTEOSA-N	0	3	332.492	3.405	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@@H]2OCC[C@@H]2c2ccccc2)C1	ZINC001034441306	1342503572	/nfs/dbraw/zinc/50/35/72/1342503572.db2.gz	FHBCACWXHDEFJY-XUVXKRRUSA-N	0	3	342.483	3.106	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@]2(C)OCCc3ccccc32)C1	ZINC001034552490	1342614972	/nfs/dbraw/zinc/61/49/72/1342614972.db2.gz	NGPBGAFYGSUYCQ-GHTZIAJQSA-N	0	3	342.483	3.021	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)c2cccc3c2OCC3(C)C)C1	ZINC001034565405	1342620292	/nfs/dbraw/zinc/62/02/92/1342620292.db2.gz	RNOCBCMFWXJFCP-OAHLLOKOSA-N	0	3	328.456	3.127	20	30		EGEDHN
Cc1cnccc1C(=O)N[C@H]1CC[C@H](NCc2ccccc2C#N)CC1	ZINC001034641511	1342667083	/nfs/dbraw/zinc/66/70/83/1342667083.db2.gz	CDMYYKHJQQXGGH-WGSAOQKQSA-N	0	3	348.450	3.093	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)C(C)(C)C2CC2)CC1	ZINC001034712712	1342709039	/nfs/dbraw/zinc/70/90/39/1342709039.db2.gz	WYJQHMZOPKWKAN-HDJSIYSDSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CC[C@H](NCc3snnc3C)CC2)CC1	ZINC001034725872	1342720343	/nfs/dbraw/zinc/72/03/43/1342720343.db2.gz	OTTWQDBWBIVKHI-WKILWMFISA-N	0	3	348.516	3.110	20	30		EGEDHN
N#Cc1ccc(F)cc1CN[C@H]1CC[C@H](NC(=O)[C@H]2CC23CC3)CC1	ZINC001034744746	1342732493	/nfs/dbraw/zinc/73/24/93/1342732493.db2.gz	OILMYMDLGKGMCJ-KZNAEPCWSA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)[C@H]2C[C@@]2(C)CC)CC1	ZINC001034765687	1342745007	/nfs/dbraw/zinc/74/50/07/1342745007.db2.gz	GWJHLFNYEYGNDN-IXYNUQLISA-N	0	3	343.309	3.348	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)s1)C(C)(C)C	ZINC001034973094	1342859447	/nfs/dbraw/zinc/85/94/47/1342859447.db2.gz	LPKBMTYNMMKOIP-ZIAGYGMSSA-N	0	3	333.501	3.383	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]1CNCc1cc(C)ccc1OC	ZINC001035012688	1342874936	/nfs/dbraw/zinc/87/49/36/1342874936.db2.gz	JWNHFUMWYBHWQR-QGZVFWFLSA-N	0	3	330.472	3.296	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H]1CNCc1cnc(Cl)s1	ZINC001035034882	1342889110	/nfs/dbraw/zinc/88/91/10/1342889110.db2.gz	AAJMSYQXYIHXPH-MLGOLLRUSA-N	0	3	341.908	3.479	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]2CNCc2ccnc(Cl)c2)C1	ZINC001035042035	1342894023	/nfs/dbraw/zinc/89/40/23/1342894023.db2.gz	WFKBKGSNEUCTON-OAHLLOKOSA-N	0	3	333.863	3.172	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]2CNCc2cc(F)ccc2OC)C1	ZINC001035042871	1342894929	/nfs/dbraw/zinc/89/49/29/1342894929.db2.gz	NECJSNNHVPPJEY-QGZVFWFLSA-N	0	3	346.446	3.271	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC2(CCN(Cc3ccc(Cl)cc3)C2)CC1	ZINC001035168328	1342984034	/nfs/dbraw/zinc/98/40/34/1342984034.db2.gz	VMOIEJHNLWTWLU-OAHLLOKOSA-N	0	3	345.874	3.314	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC2(CCN(Cc3cnoc3C)C2)CC1	ZINC001035225515	1343046012	/nfs/dbraw/zinc/04/60/12/1343046012.db2.gz	DCDBNYRENJNMEH-LJQANCHMSA-N	0	3	345.487	3.400	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@@H]1C[C@H]1c1sccc1C)CC2	ZINC001035705905	1343144273	/nfs/dbraw/zinc/14/42/73/1343144273.db2.gz	GZTOPYXOTONVOO-IAGOWNOFSA-N	0	3	342.508	3.108	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@H](C)Oc1cccc(F)c1)CC2	ZINC001035710549	1343145614	/nfs/dbraw/zinc/14/56/14/1343145614.db2.gz	VPKPWJMTPWEACX-INIZCTEOSA-N	0	3	346.446	3.094	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cccc3c1CCCC3)CC2	ZINC001035714321	1343147793	/nfs/dbraw/zinc/14/77/93/1343147793.db2.gz	NRSAQOZNNMVYPQ-UHFFFAOYSA-N	0	3	336.479	3.127	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cccc(-n3cccc3)c1)CC2	ZINC001035742831	1343163790	/nfs/dbraw/zinc/16/37/90/1343163790.db2.gz	AOCGMOLGCHXXAK-UHFFFAOYSA-N	0	3	347.462	3.039	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc(C)c(OC)c1)CC2	ZINC001035746355	1343166295	/nfs/dbraw/zinc/16/62/95/1343166295.db2.gz	WXXGGPJPHOKXPM-UHFFFAOYSA-N	0	3	328.456	3.118	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cc1cccc3ncccc13)CC2	ZINC001035750894	1343169206	/nfs/dbraw/zinc/16/92/06/1343169206.db2.gz	VLEIDHMMWMNSIP-UHFFFAOYSA-N	0	3	349.478	3.278	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@H]1CCCC[C@H]1C1CC1)CC2	ZINC001035757244	1343172859	/nfs/dbraw/zinc/17/28/59/1343172859.db2.gz	IBMWJLOAEOCKRP-OALUTQOASA-N	0	3	328.500	3.151	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@H]1[C@@H]3c4ccccc4C[C@H]13)CC2	ZINC001035814361	1343212353	/nfs/dbraw/zinc/21/23/53/1343212353.db2.gz	MZTLVKBAGXUZMI-XUVXKRRUSA-N	0	3	336.479	3.073	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C1(c3ccccc3F)CC1)CC2	ZINC001035831347	1343219441	/nfs/dbraw/zinc/21/94/41/1343219441.db2.gz	JBPBSFXIAUOSAT-UHFFFAOYSA-N	0	3	342.458	3.358	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cc1ccc3c(c1)CCC3)CC2	ZINC001035848119	1343228427	/nfs/dbraw/zinc/22/84/27/1343228427.db2.gz	OINFPCYURDCIQR-UHFFFAOYSA-N	0	3	338.495	3.218	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H](C)c1cccc(OC)c1)CC2	ZINC001035858552	1343234620	/nfs/dbraw/zinc/23/46/20/1343234620.db2.gz	VHSFRJCZYNPZRE-KRWDZBQOSA-N	0	3	342.483	3.299	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)C13CC(C(C)(C)C)(C1)C3)CC2	ZINC001035861766	1343237753	/nfs/dbraw/zinc/23/77/53/1343237753.db2.gz	QGIXQSKFQMFULL-UHFFFAOYSA-N	0	3	328.500	3.151	20	30		EGEDHN
C[C@H]1CN(C(=O)c2ccsc2)CC[C@H]1NCc1ccccc1C#N	ZINC001035901983	1343259554	/nfs/dbraw/zinc/25/95/54/1343259554.db2.gz	SFQGYVDEWKQGQH-KBXCAEBGSA-N	0	3	339.464	3.260	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCC2CC2)CC[C@@H]1NCc1ccccc1C#N	ZINC001035966337	1343292218	/nfs/dbraw/zinc/29/22/18/1343292218.db2.gz	JHXMBRYFOMSWPD-BEFAXECRSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCC2CC2)CC[C@H]1NCc1ccccc1C#N	ZINC001035966339	1343292290	/nfs/dbraw/zinc/29/22/90/1343292290.db2.gz	JHXMBRYFOMSWPD-DNVCBOLYSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](NCc2cc(C3CC3)no2)[C@H](C)C1	ZINC001036144547	1343327053	/nfs/dbraw/zinc/32/70/53/1343327053.db2.gz	SWQQFDISHUORCP-CJNGLKHVSA-N	0	3	331.460	3.091	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3cnc(C)o3)[C@@H](C)C2)CC1	ZINC001036174604	1343346931	/nfs/dbraw/zinc/34/69/31/1343346931.db2.gz	PUNGFIBEEJXEQW-KSSFIOAISA-N	0	3	331.460	3.056	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCCN(C(=O)C2(C)CCC2)C1	ZINC001036428001	1343480808	/nfs/dbraw/zinc/48/08/08/1343480808.db2.gz	OSTCJJNAJHSJFQ-LPHOPBHVSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCCN(C(=O)C(C)(C)C)C1	ZINC001036466042	1343500655	/nfs/dbraw/zinc/50/06/55/1343500655.db2.gz	PEBYKBSFPYIKKT-MAUKXSAKSA-N	0	3	327.472	3.321	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@H](C)[C@H]1CNCc1cc(C#N)ccc1F	ZINC001036492263	1343515340	/nfs/dbraw/zinc/51/53/40/1343515340.db2.gz	JODVKMJQOJUTHC-HNAYVOBHSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@H](C)[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001036496594	1343518055	/nfs/dbraw/zinc/51/80/55/1343518055.db2.gz	YUMFUCGDAIURHS-KXBFYZLASA-N	0	3	345.462	3.460	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC[C@H](C)[C@H]1CNCc1ccc(C#N)cc1F	ZINC001036532931	1343540552	/nfs/dbraw/zinc/54/05/52/1343540552.db2.gz	KNRZSYLGTARLRV-GANJRWFKSA-N	0	3	343.446	3.380	20	30		EGEDHN
C[C@H]1CCCN(C(=O)C#CC2CC2)[C@@H]1CNCc1cc(F)cc(F)c1	ZINC001036550564	1343549733	/nfs/dbraw/zinc/54/97/33/1343549733.db2.gz	XQAOMNQEWSXDMW-IFXJQAMLSA-N	0	3	346.421	3.095	20	30		EGEDHN
CCC(=O)N1CC[C@@H]2[C@@H](CCN2CC#Cc2cccc(Cl)c2)C1	ZINC001036607804	1343572195	/nfs/dbraw/zinc/57/21/95/1343572195.db2.gz	BGOIRKHPWCAGDO-FUHWJXTLSA-N	0	3	330.859	3.024	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@H]2[C@H](CCN2Cc2ccc(F)c(C#N)c2)C1	ZINC001036628227	1343585427	/nfs/dbraw/zinc/58/54/27/1343585427.db2.gz	YCDXAJLCQIGEKS-APWZRJJASA-N	0	3	341.430	3.086	20	30		EGEDHN
O=C(C1=CCCC1)N1CC[C@@H]2[C@H](CCN2CC#Cc2ccccc2)C1	ZINC001036687160	1343630081	/nfs/dbraw/zinc/63/00/81/1343630081.db2.gz	YDPAUNZTIJWGHE-NHCUHLMSSA-N	0	3	334.463	3.071	20	30		EGEDHN
CC1(CC(=O)N2CC[C@H]3[C@H](CCN3Cc3ccc(C#N)s3)C2)CC1	ZINC001036777047	1343707201	/nfs/dbraw/zinc/70/72/01/1343707201.db2.gz	UQIHZNIIJJNLES-PBHICJAKSA-N	0	3	343.496	3.233	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2conc2C)C1	ZINC001036793671	1343725787	/nfs/dbraw/zinc/72/57/87/1343725787.db2.gz	JLPHPNFSGIHNIU-DOTOQJQBSA-N	0	3	331.460	3.008	20	30		EGEDHN
CC1(C(=O)N2CC[C@@H]3[C@H](CCN3CC#Cc3ccccc3)C2)CCC1	ZINC001036793142	1343725892	/nfs/dbraw/zinc/72/58/92/1343725892.db2.gz	ZYEHPDAJOPKPBN-WOJBJXKFSA-N	0	3	336.479	3.151	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H]3[C@H](CCN3Cc3conc3C)C2)CC1	ZINC001036810889	1343746542	/nfs/dbraw/zinc/74/65/42/1343746542.db2.gz	JONXIIPRVPESNP-MJGOQNOKSA-N	0	3	343.471	3.152	20	30		EGEDHN
CC1(C(=O)N2CC[C@@H]3[C@@H](CCN3Cc3ccccc3C#N)C2)CC=CC1	ZINC001036812817	1343748752	/nfs/dbraw/zinc/74/87/52/1343748752.db2.gz	MTWSHAXWNHBVAW-VQTJNVASSA-N	0	3	349.478	3.337	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCCC[C@@H]2CNCc2cc(C)no2)C1	ZINC001037236528	1344060258	/nfs/dbraw/zinc/06/02/58/1344060258.db2.gz	RPUNVXSYLBWEMY-WBVHZDCISA-N	0	3	331.460	3.104	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCCC[C@@H]2CNCc2cscn2)C1	ZINC001037239418	1344062014	/nfs/dbraw/zinc/06/20/14/1344062014.db2.gz	GJRKATXXLWEZGY-ZBFHGGJFSA-N	0	3	333.501	3.264	20	30		EGEDHN
CC[C@@H]1CN(C(=O)C(C)(C)F)CC[C@H]1NCc1cc(F)ccc1C#N	ZINC001037760653	1344075583	/nfs/dbraw/zinc/07/55/83/1344075583.db2.gz	HIQLMLRLGHGSND-CXAGYDPISA-N	0	3	349.425	3.162	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](NCc2cscn2)[C@H](CC)C1	ZINC001037894433	1344166301	/nfs/dbraw/zinc/16/63/01/1344166301.db2.gz	YZMSRPQBTIZCHJ-ZBFHGGJFSA-N	0	3	335.517	3.462	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](NCc3cscn3)[C@@H](CC)C2)C1	ZINC001037913958	1344175005	/nfs/dbraw/zinc/17/50/05/1344175005.db2.gz	IQBFEIZJNNHSMU-GOEBONIOSA-N	0	3	333.501	3.216	20	30		EGEDHN
C=CCCN1CC[C@H]1CNC(=O)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC001038256146	1344346976	/nfs/dbraw/zinc/34/69/76/1344346976.db2.gz	FPXUHLPFWDIMFY-XJCPWDRGSA-N	0	3	344.421	3.368	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCN2CC2CCC(F)(F)CC2)cc1	ZINC001038581063	1344493659	/nfs/dbraw/zinc/49/36/59/1344493659.db2.gz	FSUQMECYTVNAPJ-SFHVURJKSA-N	0	3	346.421	3.298	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)/C=C(/C)C2CC2)CC[C@H]1c1ccc(F)cc1	ZINC001079149286	1357196770	/nfs/dbraw/zinc/19/67/70/1357196770.db2.gz	LHECMVBEGDGNCW-MJULWQABSA-N	0	3	340.442	3.089	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)CCC2CCC2)CC[C@H]1c1ccc(F)cc1	ZINC001079150631	1357197350	/nfs/dbraw/zinc/19/73/50/1357197350.db2.gz	ZEIWSSINSIPJJX-VQTJNVASSA-N	0	3	342.458	3.313	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1ccc(N(CC)CC)cc1	ZINC001038951498	1344674529	/nfs/dbraw/zinc/67/45/29/1344674529.db2.gz	YTFWIRIRKSJLIB-LJQANCHMSA-N	0	3	329.488	3.303	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)NCCN[C@@H](C)c1ccc(Cl)c(Cl)c1	ZINC001126377435	1372961354	/nfs/dbraw/zinc/96/13/54/1372961354.db2.gz	AOCVJVPGWSWQCY-ZBEGNZNMSA-N	0	3	345.270	3.087	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)NCCN[C@H](C)c1ccc(Cl)c(Cl)c1	ZINC001126377432	1372961362	/nfs/dbraw/zinc/96/13/62/1372961362.db2.gz	AOCVJVPGWSWQCY-BZNIZROVSA-N	0	3	345.270	3.087	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)c3cccc(C)n3)CC2)C1	ZINC001039106649	1344777708	/nfs/dbraw/zinc/77/77/08/1344777708.db2.gz	TZZLUBDGEIWEQU-KRWDZBQOSA-N	0	3	347.890	3.317	20	30		EGEDHN
C=CCC[N@H+]1CC[C@@H](C2CCN(C(=O)c3ccccc3[O-])CC2)C1	ZINC001039107786	1344778117	/nfs/dbraw/zinc/77/81/17/1344778117.db2.gz	ADQWTJCOVZLJRB-QGZVFWFLSA-N	0	3	328.456	3.142	20	30		EGEDHN
C=CCC[N@@H+]1CC[C@@H](C2CCN(C(=O)c3ccccc3[O-])CC2)C1	ZINC001039107786	1344778121	/nfs/dbraw/zinc/77/81/21/1344778121.db2.gz	ADQWTJCOVZLJRB-QGZVFWFLSA-N	0	3	328.456	3.142	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cccc(F)c2C)C1	ZINC001039212969	1344928455	/nfs/dbraw/zinc/92/84/55/1344928455.db2.gz	ZDTLYAOTIFNHAI-PXNSSMCTSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccc(C)c(F)c2)C1	ZINC001039216717	1344933375	/nfs/dbraw/zinc/93/33/75/1344933375.db2.gz	RGUPSWIPTAUMFQ-PKOBYXMFSA-N	0	3	328.431	3.084	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc(C)n(CC)c2C)C1	ZINC001039219758	1344937268	/nfs/dbraw/zinc/93/72/68/1344937268.db2.gz	VHROLZXOTLXFCO-AZUAARDMSA-N	0	3	341.499	3.075	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2c(C)coc2C)C1	ZINC001039221122	1344938594	/nfs/dbraw/zinc/93/85/94/1344938594.db2.gz	KPERNYPXYXLATJ-MSOLQXFVSA-N	0	3	328.456	3.236	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cccc3ncccc32)C1	ZINC001039226899	1344945677	/nfs/dbraw/zinc/94/56/77/1344945677.db2.gz	ZRXAGGIISVXPLL-DYESRHJHSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)Cc2ccc(C)c(C)c2)C1	ZINC001039237047	1344959006	/nfs/dbraw/zinc/95/90/06/1344959006.db2.gz	ATRVSQOSRFMICF-LEWJYISDSA-N	0	3	338.495	3.182	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(C)c(C)s2)C1	ZINC001039238506	1344962684	/nfs/dbraw/zinc/96/26/84/1344962684.db2.gz	IQHRMAVPGGBZSS-SJORKVTESA-N	0	3	330.497	3.315	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc3ccccc3[nH]2)C1	ZINC001039238856	1344963281	/nfs/dbraw/zinc/96/32/81/1344963281.db2.gz	KVZQRCLQLTVEKJ-PXNSSMCTSA-N	0	3	335.451	3.118	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cccc3[nH]ccc32)C1	ZINC001039240867	1344965641	/nfs/dbraw/zinc/96/56/41/1344965641.db2.gz	ZZSOPPHKOZNBOE-OXJNMPFZSA-N	0	3	335.451	3.118	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc3c(C)cccn3c2)C1	ZINC001039242875	1344969877	/nfs/dbraw/zinc/96/98/77/1344969877.db2.gz	CWOCJXNFGXOAST-ICSRJNTNSA-N	0	3	349.478	3.198	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccc(OCC)cc2)C1	ZINC001039249823	1344980312	/nfs/dbraw/zinc/98/03/12/1344980312.db2.gz	KDIZIYBTIYWZEY-AZUAARDMSA-N	0	3	340.467	3.035	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)Cc2sc(C)cc2C)C1	ZINC001039250564	1344982464	/nfs/dbraw/zinc/98/24/64/1344982464.db2.gz	PLFUGKBWJAEZGS-MSOLQXFVSA-N	0	3	344.524	3.244	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)CCc2ccc(C)s2)C1	ZINC001039252816	1344984343	/nfs/dbraw/zinc/98/43/43/1344984343.db2.gz	PUZBRDBTWBDWDY-HKUYNNGSSA-N	0	3	344.524	3.325	20	30		EGEDHN
N#Cc1ccccc1CNC1C[C@H]2CCC[C@@H](C1)N2C(=O)c1ccc[nH]1	ZINC001039264861	1344989423	/nfs/dbraw/zinc/98/94/23/1344989423.db2.gz	JVTNDONESRPVLX-YQQQUEKLSA-N	0	3	348.450	3.202	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C(C)(C)c1cccs1	ZINC001039415827	1345056623	/nfs/dbraw/zinc/05/66/23/1345056623.db2.gz	XKGAEZNRFUPJMG-CVEARBPZSA-N	0	3	330.497	3.114	20	30		EGEDHN
C=CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1oc(C(C)C)nc1C	ZINC001039448452	1345073083	/nfs/dbraw/zinc/07/30/83/1345073083.db2.gz	PESAIYGAYOZVJC-CVEARBPZSA-N	0	3	331.460	3.361	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CCOc2ccccc21	ZINC001039453460	1345076096	/nfs/dbraw/zinc/07/60/96/1345076096.db2.gz	DCKRSXZSPVWSHG-ZIFCJYIRSA-N	0	3	340.467	3.194	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC1CC(OCC)C1	ZINC001039896175	1345238841	/nfs/dbraw/zinc/23/88/41/1345238841.db2.gz	FTHVPRBSXGNDHF-NJHPSFRLSA-N	0	3	348.531	3.469	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC[C@H]1CCOC1	ZINC001039896625	1345239155	/nfs/dbraw/zinc/23/91/55/1345239155.db2.gz	NSLOSXDBPGHCPA-GNBUJSLZSA-N	0	3	334.504	3.081	20	30		EGEDHN
C#Cc1ccc(C(=O)N2C[C@H]3CCC[C@@H](C2)N3CCC(C)(C)C)nc1	ZINC001039979405	1345277166	/nfs/dbraw/zinc/27/71/66/1345277166.db2.gz	UFLZKRVLTVXHKO-HDICACEKSA-N	0	3	339.483	3.178	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@]2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001040047681	1345309942	/nfs/dbraw/zinc/30/99/42/1345309942.db2.gz	VVEBYMATIXXNFU-OAQYLSRUSA-N	0	3	339.483	3.419	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CC[C@]2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001040084236	1345329601	/nfs/dbraw/zinc/32/96/01/1345329601.db2.gz	RZADBQAHAKTBQG-DYESRHJHSA-N	0	3	339.483	3.419	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@]2(C1)CCCN(Cc1cccc(F)c1)C2	ZINC001040198873	1345372538	/nfs/dbraw/zinc/37/25/38/1345372538.db2.gz	XBYDJFQCQKNFQI-OAQYLSRUSA-N	0	3	340.442	3.054	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)Cc3c(C)cccc3Cl)C2)C1	ZINC001040280335	1345408749	/nfs/dbraw/zinc/40/87/49/1345408749.db2.gz	DRECABQDHFPRMI-FQEVSTJZSA-N	0	3	344.886	3.139	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(-n4cccc4)cc3)C2)C1	ZINC001040281569	1345409792	/nfs/dbraw/zinc/40/97/92/1345409792.db2.gz	CTSTYFZPZYOTBI-JOCHJYFZSA-N	0	3	347.462	3.039	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cccc(C(C)C)n3)C2)C1	ZINC001040282250	1345410875	/nfs/dbraw/zinc/41/08/75/1345410875.db2.gz	HOAFJVAAQBCAMU-HXUWFJFHSA-N	0	3	327.472	3.319	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cccc4cccnc43)C2)C1	ZINC001040284069	1345411314	/nfs/dbraw/zinc/41/13/14/1345411314.db2.gz	SFJQQWVIGNVUME-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)Cc3cccc(C(F)F)c3)C2)C1	ZINC001040289040	1345413501	/nfs/dbraw/zinc/41/35/01/1345413501.db2.gz	ATUWVHNTIVNOBB-FQEVSTJZSA-N	0	3	346.421	3.114	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cc4ccsc4[nH]3)C2)C1	ZINC001040319847	1345430017	/nfs/dbraw/zinc/43/00/17/1345430017.db2.gz	LELMZKBHCUGISR-LJQANCHMSA-N	0	3	341.480	3.181	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ccn(C(C)C)c3C)C2)C1	ZINC001040349402	1345447266	/nfs/dbraw/zinc/44/72/66/1345447266.db2.gz	FPZBTTQXOTWTRX-NRFANRHFSA-N	0	3	341.499	3.329	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3c(F)cc(F)cc3F)C2)C1	ZINC001040358860	1345452890	/nfs/dbraw/zinc/45/28/90/1345452890.db2.gz	AJFUIZSOYKBZNY-SFHVURJKSA-N	0	3	338.373	3.218	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)C[C@@H](C)c3cccc(F)c3)C2)C1	ZINC001040383149	1345467914	/nfs/dbraw/zinc/46/79/14/1345467914.db2.gz	GFTPDSYRGTZJFU-UTKZUKDTSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3ccc(C(C)C)nc3C)C2)C1	ZINC001040398023	1345476081	/nfs/dbraw/zinc/47/60/81/1345476081.db2.gz	CMWOGJXYZWKXIM-NRFANRHFSA-N	0	3	339.483	3.075	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3ccn(C(CC)CC)n3)C2)C1	ZINC001040433044	1345495255	/nfs/dbraw/zinc/49/52/55/1345495255.db2.gz	RKVTYBWJEIWJGX-HXUWFJFHSA-N	0	3	344.503	3.358	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@H](C)c3ccc(C)o3)C2)C1	ZINC001040433949	1345497382	/nfs/dbraw/zinc/49/73/82/1345497382.db2.gz	BCQUISVWEDOKLK-YLJYHZDGSA-N	0	3	328.456	3.029	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3cc(C(C)C)oc3C)C2)C1	ZINC001040479253	1345513839	/nfs/dbraw/zinc/51/38/39/1345513839.db2.gz	PLUXPNYSTUBHSK-HXUWFJFHSA-N	0	3	328.456	3.273	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3c(C)nn(CCC)c3C)C2)C1	ZINC001040484817	1345516094	/nfs/dbraw/zinc/51/60/94/1345516094.db2.gz	RULQOBKCDPPBEC-FQEVSTJZSA-N	0	3	344.503	3.024	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ccc(OCC)cc3)C2)C1	ZINC001040514398	1345527841	/nfs/dbraw/zinc/52/78/41/1345527841.db2.gz	BUHZGFGWSZYSDS-NRFANRHFSA-N	0	3	340.467	3.037	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)Cc3ccc(C)c(C)c3)C2)C1	ZINC001040520652	1345531343	/nfs/dbraw/zinc/53/13/43/1345531343.db2.gz	UVVXNOPHNGBPMJ-QFIPXVFZSA-N	0	3	338.495	3.184	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@@H](C)c3ccccc3C)C2)C1	ZINC001040539644	1345536715	/nfs/dbraw/zinc/53/67/15/1345536715.db2.gz	PXVWZAPMEMFADT-UGKGYDQZSA-N	0	3	338.495	3.436	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@@]3(C)CCC(C)=C(C)C3)C2)C1	ZINC001040548045	1345542093	/nfs/dbraw/zinc/54/20/93/1345542093.db2.gz	PFNLYEMGMZAYLW-LEWJYISDSA-N	0	3	328.500	3.461	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3c(F)cc(C)cc3F)C2)CC1	ZINC001040768514	1345577053	/nfs/dbraw/zinc/57/70/53/1345577053.db2.gz	UYYCUFSEDQTKJO-UHFFFAOYSA-N	0	3	346.421	3.225	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC2(C1)CCN(Cc1ccccn1)CC2	ZINC001040798477	1345578786	/nfs/dbraw/zinc/57/87/86/1345578786.db2.gz	RFDXJGNKPDJFBE-UHFFFAOYSA-N	0	3	341.499	3.498	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC2(C1)CCN(Cc1cccnc1)CC2	ZINC001040803014	1345580010	/nfs/dbraw/zinc/58/00/10/1345580010.db2.gz	XHKBLDBVHQUBMM-UHFFFAOYSA-N	0	3	327.472	3.108	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccc(C(C)C)cn3)C2)CC1	ZINC001040848998	1345588375	/nfs/dbraw/zinc/58/83/75/1345588375.db2.gz	MZRZSEPDPQIWNS-UHFFFAOYSA-N	0	3	339.483	3.156	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@H](C)Cc3cccs3)C2)CC1	ZINC001040869784	1345590604	/nfs/dbraw/zinc/59/06/04/1345590604.db2.gz	PNTPFASHVIPAFO-QGZVFWFLSA-N	0	3	344.524	3.265	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@H]3C[C@@]3(CC)C(C)C)C2)CC1	ZINC001040902564	1345597232	/nfs/dbraw/zinc/59/72/32/1345597232.db2.gz	WFSPOFMNGLCKAE-NQIIRXRSSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccsc3C(F)F)C2)CC1	ZINC001040924200	1345601681	/nfs/dbraw/zinc/60/16/81/1345601681.db2.gz	JVNZFXMCQBOMSW-UHFFFAOYSA-N	0	3	338.423	3.247	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccc(OC(C)C)cc3)C2)CC1	ZINC001040931427	1345603727	/nfs/dbraw/zinc/60/37/27/1345603727.db2.gz	MQKQICSFUXWXOZ-UHFFFAOYSA-N	0	3	340.467	3.035	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@H](CC)c3ccc(F)cc3)C2)CC1	ZINC001040950913	1345607858	/nfs/dbraw/zinc/60/78/58/1345607858.db2.gz	AVHSPYLISDWESH-LJQANCHMSA-N	0	3	342.458	3.267	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CC[C@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001041086763	1345648993	/nfs/dbraw/zinc/64/89/93/1345648993.db2.gz	IWNJJHGBCNKVCF-UZLBHIALSA-N	0	3	325.456	3.029	20	30		EGEDHN
C/C(=C\C(=O)N1CC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1)C1CC1	ZINC001041098322	1345652342	/nfs/dbraw/zinc/65/23/42/1345652342.db2.gz	RXTXIHCXLCDBJC-YAECTWJJSA-N	0	3	349.478	3.339	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3c(C)c(F)ccc3Cl)C2)C1	ZINC001041418739	1345724260	/nfs/dbraw/zinc/72/42/60/1345724260.db2.gz	NKCFTSLEQNVXMH-LJQANCHMSA-N	0	3	348.849	3.349	20	30		EGEDHN
C=CCN1CC[C@@]2(CCN(C(=O)c3cc(-c4ccccc4)no3)C2)C1	ZINC001041438348	1345727091	/nfs/dbraw/zinc/72/70/91/1345727091.db2.gz	YAMSRJKAOFZXDV-HXUWFJFHSA-N	0	3	337.423	3.066	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)[C@@H](C)c3c(F)cccc3F)C2)C1	ZINC001041475113	1345738447	/nfs/dbraw/zinc/73/84/47/1345738447.db2.gz	HWHIARYHVZHQFJ-MGPUTAFESA-N	0	3	346.421	3.016	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@]3(CCN(C(=O)[C@]45C[C@H]4CCC5)C3)C2)c1	ZINC001041491422	1345744166	/nfs/dbraw/zinc/74/41/66/1345744166.db2.gz	INGZJVNQXADTEQ-BAGYTPMASA-N	0	3	349.478	3.173	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@]2(CCN(Cc3ccccn3)C2)C1	ZINC001041536033	1345755299	/nfs/dbraw/zinc/75/52/99/1345755299.db2.gz	LXNXVKVLZQVCIM-FQEVSTJZSA-N	0	3	327.472	3.108	20	30		EGEDHN
CC1(C(=O)N2CC[C@@]3(CCN(Cc4cccc(C#N)c4)C3)C2)CCC1	ZINC001041555633	1345765282	/nfs/dbraw/zinc/76/52/82/1345765282.db2.gz	GSRSMDJXRRXZKP-OAQYLSRUSA-N	0	3	337.467	3.173	20	30		EGEDHN
C[C@]1(C(=O)N2CC[C@]3(CCN(Cc4ccc(C#N)cc4)C3)C2)C=CCC1	ZINC001041560142	1345770188	/nfs/dbraw/zinc/77/01/88/1345770188.db2.gz	PFVKLQZSQLLWLE-VXKWHMMOSA-N	0	3	349.478	3.339	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)C[C@@H](C)c3cccc(F)c3)C2)C1	ZINC001041660307	1345814291	/nfs/dbraw/zinc/81/42/91/1345814291.db2.gz	NMJCTIKPWUNGSA-UTKZUKDTSA-N	0	3	342.458	3.267	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)[C@@H]3C[C@H]3c3ccccc3C)C2)C1	ZINC001041736233	1345835930	/nfs/dbraw/zinc/83/59/30/1345835930.db2.gz	MYFOGGBENOCBSE-VWPQPMDRSA-N	0	3	336.479	3.046	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3oc4ccccc4c3Cl)C2)C1	ZINC001041786190	1345849334	/nfs/dbraw/zinc/84/93/34/1345849334.db2.gz	RXLOFYTUYGMFIW-LJQANCHMSA-N	0	3	342.826	3.257	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)C3(C4CCCCC4)CC3)C2)C1	ZINC001041806149	1345857590	/nfs/dbraw/zinc/85/75/90/1345857590.db2.gz	USYDDRISBISAFM-FQEVSTJZSA-N	0	3	328.500	3.295	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3sc(C(C)C)nc3C)C2)C1	ZINC001041829060	1345865924	/nfs/dbraw/zinc/86/59/24/1345865924.db2.gz	MLSGFQRBPLWGEO-IBGZPJMESA-N	0	3	345.512	3.136	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)CC[C@H]3CCc4ccccc43)C2)C1	ZINC001041842950	1345870121	/nfs/dbraw/zinc/87/01/21/1345870121.db2.gz	KPWVFWLMAZSXJX-KNQAVFIVSA-N	0	3	336.479	3.054	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)C3(C(F)(F)F)CCCC3)C2)C1	ZINC001041855738	1345875032	/nfs/dbraw/zinc/87/50/32/1345875032.db2.gz	NHRGDJKJFXGNLS-MRXNPFEDSA-N	0	3	342.405	3.057	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3ccc(C4=CCCC4)cc3)C2)C1	ZINC001041867488	1345877519	/nfs/dbraw/zinc/87/75/19/1345877519.db2.gz	UEFDTEVSDCAIEF-JOCHJYFZSA-N	0	3	334.463	3.425	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3CCN(C(=O)C4CCCC4)C[C@H]32)cc1	ZINC001041886139	1345883118	/nfs/dbraw/zinc/88/31/18/1345883118.db2.gz	WEOXJZAIMWVDGT-AZUAARDMSA-N	0	3	337.467	3.171	20	30		EGEDHN
CC(C(=O)N1CC[C@H]2CCN(Cc3cccc(C#N)c3)[C@@H]2C1)=C1CCC1	ZINC001042054064	1345932254	/nfs/dbraw/zinc/93/22/54/1345932254.db2.gz	GKSSBFQMYAPJIX-NHCUHLMSSA-N	0	3	349.478	3.481	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3oc(CC4CC4)nc3C)C[C@H]21	ZINC001042064812	1345933636	/nfs/dbraw/zinc/93/36/36/1345933636.db2.gz	JUFIIBXNLXEJIS-DLBZAZTESA-N	0	3	343.471	3.048	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3conc3C3CCCC3)C[C@H]21	ZINC001042091824	1345941782	/nfs/dbraw/zinc/94/17/82/1345941782.db2.gz	YMXCNYPWIYNFGH-MAUKXSAKSA-N	0	3	343.471	3.445	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C3C4CC5CC(C4)CC3C5)C[C@@H]21	ZINC001042095871	1345943141	/nfs/dbraw/zinc/94/31/41/1345943141.db2.gz	RFYVBVRDWBECPR-SKAPGREJSA-N	0	3	328.500	3.168	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(C4CCCCC4)n[nH]3)C[C@@H]21	ZINC001042099250	1345943625	/nfs/dbraw/zinc/94/36/25/1345943625.db2.gz	YXYSZYCBSCMLBK-APWZRJJASA-N	0	3	342.487	3.180	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C3(C)CCC(F)(F)CC3)C[C@@H]21	ZINC001042119379	1345948887	/nfs/dbraw/zinc/94/88/87/1345948887.db2.gz	GSWCWULMVXRLSE-CABCVRRESA-N	0	3	326.431	3.311	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cc(F)cc4ccoc43)C[C@H]21	ZINC001042122197	1345949692	/nfs/dbraw/zinc/94/96/92/1345949692.db2.gz	NAZZLFRAIZYIOC-RDTXWAMCSA-N	0	3	340.398	3.132	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3coc4cc(F)ccc34)C[C@H]21	ZINC001042124253	1345950247	/nfs/dbraw/zinc/95/02/47/1345950247.db2.gz	DKLBLKBJETVHCT-SUMWQHHRSA-N	0	3	328.387	3.294	20	30		EGEDHN
C#CCN1CC[C@H]2CCN(C(=O)c3ccc4c5c(cccc53)CC4)C[C@@H]21	ZINC001042146322	1345956781	/nfs/dbraw/zinc/95/67/81/1345956781.db2.gz	NOXDVWBUXFOPMS-KKSFZXQISA-N	0	3	344.458	3.108	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)Cc3cccc(C4CC4)c3)C[C@H]21	ZINC001042163363	1345962068	/nfs/dbraw/zinc/96/20/68/1345962068.db2.gz	SITYVZRFPVGGJO-PZJWPPBQSA-N	0	3	336.479	3.053	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3scnc3C)[C@@H]2C1	ZINC001042183335	1345971343	/nfs/dbraw/zinc/97/13/43/1345971343.db2.gz	JGLFMJZMFDZFAH-JKSUJKDBSA-N	0	3	347.528	3.477	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)c3ccc(F)c4ccccc34)C[C@H]21	ZINC001042238877	1345999933	/nfs/dbraw/zinc/99/99/33/1345999933.db2.gz	AEHVOLFILSTDGV-FOIQADDNSA-N	0	3	336.410	3.149	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3oc(CC(C)C)nc3C)C[C@H]21	ZINC001042261867	1346009390	/nfs/dbraw/zinc/00/93/90/1346009390.db2.gz	AQMIGBHXVDLQJZ-IAGOWNOFSA-N	0	3	345.487	3.294	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3csc(C(C)C)n3)C[C@H]21	ZINC001042265237	1346012072	/nfs/dbraw/zinc/01/20/72/1346012072.db2.gz	DSOZJHRAGIIHQX-GDBMZVCRSA-N	0	3	333.501	3.379	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cnn(C4CCCCC4)c3)C[C@@H]21	ZINC001042305070	1346025425	/nfs/dbraw/zinc/02/54/25/1346025425.db2.gz	WOXHFOXWINJVEX-APWZRJJASA-N	0	3	342.487	3.111	20	30		EGEDHN
C#CCN1CC[C@H]2CCN(C(=O)c3ccc(Cl)c4occc43)C[C@H]21	ZINC001042309004	1346027727	/nfs/dbraw/zinc/02/77/27/1346027727.db2.gz	JFUFSGJUQHRLMI-SUMWQHHRSA-N	0	3	342.826	3.256	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3coc(-c4ccccc4)n3)C[C@H]21	ZINC001042316182	1346030894	/nfs/dbraw/zinc/03/08/94/1346030894.db2.gz	IUWPROWONBCXII-CRAIPNDOSA-N	0	3	337.423	3.064	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C(C)(C)c3ccc(F)cc3)C[C@H]21	ZINC001042317106	1346030925	/nfs/dbraw/zinc/03/09/25/1346030925.db2.gz	WENBHSXCLMHWEO-CRAIPNDOSA-N	0	3	330.447	3.212	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)CC34CC5CC(CC(C5)C3)C4)C[C@H]21	ZINC001042332735	1346039841	/nfs/dbraw/zinc/03/98/41/1346039841.db2.gz	XBVMECBHSRXOHH-PHMMFBKASA-N	0	3	340.511	3.149	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3sccc3C3CC3)C[C@@H]21	ZINC001042344148	1346047299	/nfs/dbraw/zinc/04/72/99/1346047299.db2.gz	TZVNMWIIXMOYSZ-WBVHZDCISA-N	0	3	328.481	3.185	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3csc(C4CC4)n3)C[C@H]21	ZINC001042375441	1346063051	/nfs/dbraw/zinc/06/30/51/1346063051.db2.gz	XHHCJBGXTZJEQK-XJKSGUPXSA-N	0	3	331.485	3.133	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc(C(C)(F)F)cc3)C[C@H]21	ZINC001042380496	1346065612	/nfs/dbraw/zinc/06/56/12/1346065612.db2.gz	UCFYLSDFCBVMEH-CRAIPNDOSA-N	0	3	346.421	3.358	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C(C)(C)c3ccccc3C)C[C@H]21	ZINC001042382302	1346066285	/nfs/dbraw/zinc/06/62/85/1346066285.db2.gz	GJCKTPDYQWAABN-UYAOXDASSA-N	0	3	338.495	3.219	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3nccnc3C)C[C@H]2C)CC1	ZINC001044730245	1346414616	/nfs/dbraw/zinc/41/46/16/1346414616.db2.gz	OJPGIBSNVBRNDY-CRAIPNDOSA-N	0	3	342.487	3.001	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)C(F)=C2CCCC2)s1	ZINC001044993007	1346477269	/nfs/dbraw/zinc/47/72/69/1346477269.db2.gz	BLZMEMYUKVHTRG-AWEZNQCLSA-N	0	3	347.459	3.498	20	30		EGEDHN
CC1(C)CC(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)s2)C1	ZINC001045023393	1346482306	/nfs/dbraw/zinc/48/23/06/1346482306.db2.gz	NKCUGEMLAHJUHE-AWEZNQCLSA-N	0	3	331.485	3.137	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)C[C@H]2C=CCCC2)s1	ZINC001045088790	1346492913	/nfs/dbraw/zinc/49/29/13/1346492913.db2.gz	SVCWKCJZWNAUPF-HOTGVXAUSA-N	0	3	343.496	3.447	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H]1CNCc1ccc(C#N)c(F)c1)C(C)(C)C	ZINC001045093596	1346494051	/nfs/dbraw/zinc/49/40/51/1346494051.db2.gz	ZMBCAUDKVHLDHP-YOEHRIQHSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC1(NC(=O)[C@H]2CC=CCC2)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045364461	1346575218	/nfs/dbraw/zinc/57/52/18/1346575218.db2.gz	HMUYHBHJPPVPBV-IBGZPJMESA-N	0	3	337.467	3.385	20	30		EGEDHN
CC1(NC(=O)[C@@H]2CCC2(F)F)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045475242	1346602519	/nfs/dbraw/zinc/60/25/19/1346602519.db2.gz	HGXCNGDLPWGVFT-INIZCTEOSA-N	0	3	347.409	3.074	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2cc3c([nH]2)c(F)ccc3C)CC1	ZINC001045482628	1346605354	/nfs/dbraw/zinc/60/53/54/1346605354.db2.gz	POVXHTPKGJWMKO-UHFFFAOYSA-N	0	3	341.430	3.223	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2oc3ccccc3c2OC)CC1	ZINC001045521153	1346616123	/nfs/dbraw/zinc/61/61/23/1346616123.db2.gz	OBZVWPITZOCOGF-UHFFFAOYSA-N	0	3	328.412	3.212	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC001045626698	1346651452	/nfs/dbraw/zinc/65/14/52/1346651452.db2.gz	OHDPOJAAEQOFFH-UHFFFAOYSA-N	0	3	326.362	3.476	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@H]1[C@@H]3CCCC[C@@H]31)C2	ZINC001045926827	1346762733	/nfs/dbraw/zinc/76/27/33/1346762733.db2.gz	LEZZTSVMGPLIHO-XODKDNOYSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)Cc1ccccc1CC)C2	ZINC001045947267	1346782996	/nfs/dbraw/zinc/78/29/96/1346782996.db2.gz	KIUVNLLJJCPSKP-JOCHJYFZSA-N	0	3	338.495	3.129	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc(C)c(F)c1)C2	ZINC001045950580	1346785267	/nfs/dbraw/zinc/78/52/67/1346785267.db2.gz	GIVLXAYMNZNKAV-HXUWFJFHSA-N	0	3	328.431	3.086	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)CCc1ccc(C)cc1)C2	ZINC001045951152	1346786016	/nfs/dbraw/zinc/78/60/16/1346786016.db2.gz	VMVFWLMPWHAKIN-QFIPXVFZSA-N	0	3	338.495	3.265	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc[nH]c1C(C)C)C2	ZINC001045962142	1346797541	/nfs/dbraw/zinc/79/75/41/1346797541.db2.gz	XVJHRDRLFDKHKO-HXUWFJFHSA-N	0	3	327.472	3.090	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc(C)c(F)c1F)C2	ZINC001045968165	1346803070	/nfs/dbraw/zinc/80/30/70/1346803070.db2.gz	KWPGJRZAFVUGOK-HXUWFJFHSA-N	0	3	346.421	3.225	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc(F)cc(Cl)c1)C2	ZINC001045969923	1346805798	/nfs/dbraw/zinc/80/57/98/1346805798.db2.gz	CDIGUDWKYUPBMB-LJQANCHMSA-N	0	3	348.849	3.431	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H](C)c1ccc(C)o1)C2	ZINC001045973305	1346809419	/nfs/dbraw/zinc/80/94/19/1346809419.db2.gz	OLYPAPKBPIHLBQ-GHTZIAJQSA-N	0	3	342.483	3.419	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1csc(C(C)C)n1)C2	ZINC001045974277	1346810839	/nfs/dbraw/zinc/81/08/39/1346810839.db2.gz	XNZNZXXOZDHEFV-LJQANCHMSA-N	0	3	345.512	3.218	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H]1CC13CCCC3)C2	ZINC001045976151	1346812491	/nfs/dbraw/zinc/81/24/91/1346812491.db2.gz	SBGODJDDOXMAAT-ICSRJNTNSA-N	0	3	328.500	3.295	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)C(C)(C)C(C)(F)F)C2	ZINC001045981970	1346821047	/nfs/dbraw/zinc/82/10/47/1346821047.db2.gz	KTWPPHUCAZWRNR-SFHVURJKSA-N	0	3	326.431	3.006	20	30		EGEDHN
C[C@]1(NC(=O)c2c[nH]c(C#N)c2)CCN(Cc2ccc(C3CC3)cc2)C1	ZINC001046253372	1346909934	/nfs/dbraw/zinc/90/99/34/1346909934.db2.gz	XEZKUJKRBCGPLN-NRFANRHFSA-N	0	3	348.450	3.158	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2coc3c2cccc3OC)C1	ZINC001046319076	1346933705	/nfs/dbraw/zinc/93/37/05/1346933705.db2.gz	PAIMMJJTMLUUIZ-LJQANCHMSA-N	0	3	328.412	3.212	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2cc(Cl)c(Cl)n2C)C1	ZINC001046359600	1346949421	/nfs/dbraw/zinc/94/94/21/1346949421.db2.gz	JZYIOFTWOSCKJC-OAHLLOKOSA-N	0	3	330.259	3.102	20	30		EGEDHN
C#CCCN1CC[C@](C)(NC(=O)c2cc3c(o2)c(F)ccc3C)C1	ZINC001046508883	1346998999	/nfs/dbraw/zinc/99/89/99/1346998999.db2.gz	ULQCBMXQGCEKQJ-IBGZPJMESA-N	0	3	328.387	3.098	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2ccc(N(C)CCC)cc2)C1	ZINC001046878035	1347142198	/nfs/dbraw/zinc/14/21/98/1347142198.db2.gz	WCLMBPUJZGEFSP-HXUWFJFHSA-N	0	3	329.488	3.303	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2cccc3[nH]ccc32)C1	ZINC001046973545	1347172562	/nfs/dbraw/zinc/17/25/62/1347172562.db2.gz	OADYMVGKHSPHIB-CQSZACIVSA-N	0	3	347.409	3.431	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2ccc(C)cc2F)C1	ZINC001046979312	1347175475	/nfs/dbraw/zinc/17/54/75/1347175475.db2.gz	ZKEGFEXYILHABP-CQSZACIVSA-N	0	3	340.389	3.397	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@H](CNC(=O)[C@H]2CCCCC2(C)C)C1	ZINC001046995574	1347178310	/nfs/dbraw/zinc/17/83/10/1347178310.db2.gz	PNAPBXZJOKJYGF-HZPDHXFCSA-N	0	3	340.458	3.300	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)/C=C/c3ccco3)C2)CC1	ZINC001047219052	1347250396	/nfs/dbraw/zinc/25/03/96/1347250396.db2.gz	IYFXMLTXPKLCMM-SGQUHAKNSA-N	0	3	340.467	3.267	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)[C@H]3CC=CCC3)C2)CC1	ZINC001047220973	1347252518	/nfs/dbraw/zinc/25/25/18/1347252518.db2.gz	AANNUBATRJIKKM-VQTJNVASSA-N	0	3	328.500	3.317	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)C3=CCCCCC3)C2)CC1	ZINC001047237983	1347264796	/nfs/dbraw/zinc/26/47/96/1347264796.db2.gz	VTPRJXIRQKTTDC-HXUWFJFHSA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3c(C)coc3C)C2)CC1	ZINC001047240900	1347267005	/nfs/dbraw/zinc/26/70/05/1347267005.db2.gz	LAVJWNFOKBHFAO-SFHVURJKSA-N	0	3	328.456	3.094	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)CCc3ccsc3)C2)CC1	ZINC001047242866	1347268573	/nfs/dbraw/zinc/26/85/73/1347268573.db2.gz	GUONWMJNDQFWPN-IBGZPJMESA-N	0	3	344.524	3.265	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@@H]3C[C@@H]4CCCC[C@H]34)C2)CC1	ZINC001047250983	1347276112	/nfs/dbraw/zinc/27/61/12/1347276112.db2.gz	MTEZZAIXLIOWQQ-XSDIEEQYSA-N	0	3	342.527	3.397	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)Cc3cccc(C)c3)C2)CC1	ZINC001047253132	1347277359	/nfs/dbraw/zinc/27/73/59/1347277359.db2.gz	SRNSYRFCNBOVGH-NRFANRHFSA-N	0	3	338.495	3.121	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)[C@@H]3CC34CCC4)C2)CC1	ZINC001047258371	1347281213	/nfs/dbraw/zinc/28/12/13/1347281213.db2.gz	BFWBVWQAUCIREV-MOPGFXCFSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3ccc(C)cc3F)C2)CC1	ZINC001047259107	1347281811	/nfs/dbraw/zinc/28/18/11/1347281811.db2.gz	KVLOUFLWEITWSM-SFHVURJKSA-N	0	3	342.458	3.332	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)C(C3CC3)C3CC3)C2)CC1	ZINC001047262795	1347283935	/nfs/dbraw/zinc/28/39/35/1347283935.db2.gz	UVDNKLHHXGRCEL-LJQANCHMSA-N	0	3	328.500	3.006	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)C(C)(C)C(F)(F)F)C2)CC1	ZINC001047264279	1347285307	/nfs/dbraw/zinc/28/53/07/1347285307.db2.gz	NXMKHEFIRFDUBA-OAHLLOKOSA-N	0	3	344.421	3.159	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC001047683781	1347329044	/nfs/dbraw/zinc/32/90/44/1347329044.db2.gz	SCNUCXXLVPJSLF-OXQOHEQNSA-N	0	3	333.435	3.199	20	30		EGEDHN
C[C@@H](NCc1cc(F)ccc1C#N)[C@@H]1CCN(C(=O)CCC2CC2)C1	ZINC001047766979	1347365050	/nfs/dbraw/zinc/36/50/50/1347365050.db2.gz	XZVIZVJVLGFOLD-RHSMWYFYSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@@H](NCc1cc(F)ccc1C#N)[C@@H]1CCN(C(=O)CC2CCC2)C1	ZINC001047774720	1347366841	/nfs/dbraw/zinc/36/68/41/1347366841.db2.gz	OZVHQYUGLNQQOK-RHSMWYFYSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@H](NCc1cc(F)ccc1C#N)[C@H]1CCN(C(=O)CC2CCC2)C1	ZINC001047774724	1347367089	/nfs/dbraw/zinc/36/70/89/1347367089.db2.gz	OZVHQYUGLNQQOK-YOEHRIQHSA-N	0	3	343.446	3.214	20	30		EGEDHN
CC(C)C1(C(=O)N2CC[C@@H]([C@@H](C)NCc3ccccc3C#N)C2)CC1	ZINC001047969286	1347428384	/nfs/dbraw/zinc/42/83/84/1347428384.db2.gz	GONYANYGTNWFSE-VQIMIIECSA-N	0	3	339.483	3.321	20	30		EGEDHN
CCC1(C(=O)N2CC[C@@H]([C@@H](C)NCc3cc(F)ccc3C#N)C2)CC1	ZINC001047969935	1347428939	/nfs/dbraw/zinc/42/89/39/1347428939.db2.gz	ICMSFTPMZOIAOS-GDBMZVCRSA-N	0	3	343.446	3.214	20	30		EGEDHN
CCC(CC)C(=O)N1C[C@H](C)[C@H](CNCc2ccccc2C#N)C1	ZINC001048150605	1347482201	/nfs/dbraw/zinc/48/22/01/1347482201.db2.gz	DEPAAYIBDOTZIB-HNAYVOBHSA-N	0	3	327.472	3.179	20	30		EGEDHN
C[C@H]1CN(C(=O)CC2CCC2)C[C@@H]1CNCc1cc(F)ccc1C#N	ZINC001048191260	1347488803	/nfs/dbraw/zinc/48/88/03/1347488803.db2.gz	BWCXNLZKGJGDKB-KSSFIOAISA-N	0	3	343.446	3.072	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H](C)[C@H](CNCc2nc3ccccc3o2)C1	ZINC001048346513	1347525609	/nfs/dbraw/zinc/52/56/09/1347525609.db2.gz	YSZQNDJQDLIXBG-LSDHHAIUSA-N	0	3	341.455	3.224	20	30		EGEDHN
CCC(C)(C)C(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001048361017	1347530978	/nfs/dbraw/zinc/53/09/78/1347530978.db2.gz	YFANZWPNXZHAFU-CRAIPNDOSA-N	0	3	327.472	3.179	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](CNCc3ccn(C(C)C)n3)[C@H](C)C2)C1	ZINC001048373695	1347534320	/nfs/dbraw/zinc/53/43/20/1347534320.db2.gz	IWVMUCGBYPLKRZ-IAGOWNOFSA-N	0	3	344.503	3.004	20	30		EGEDHN
O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)N2CC#Cc1ccccc1)c1ccoc1	ZINC001048504180	1347571034	/nfs/dbraw/zinc/57/10/34/1347571034.db2.gz	REBQNDGEMALINU-NUZGMZIFSA-N	0	3	348.446	3.304	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CN(Cc3ccc(F)cc3)C[C@H]2C1	ZINC001049026385	1347709671	/nfs/dbraw/zinc/70/96/71/1347709671.db2.gz	OCSBLPWRXNALDC-FUHIMQAGSA-N	0	3	330.447	3.318	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C[C@H]3C[C@@H](C)CC(C)(C)C3)C[C@@H]2C1	ZINC001049117820	1347729206	/nfs/dbraw/zinc/72/92/06/1347729206.db2.gz	KHTBQVPQCMSLFA-MKXGPGLRSA-N	0	3	330.516	3.252	20	30		EGEDHN
CCC(C)(CC)C(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@H]2C1	ZINC001049223059	1347749850	/nfs/dbraw/zinc/74/98/50/1347749850.db2.gz	FWXWPDICGGJDHX-KDURUIRLSA-N	0	3	339.483	3.275	20	30		EGEDHN
C=C[C@H](C(=O)N1C[C@H]2CN(C/C=C/Cl)C[C@H]2C1)c1ccccc1	ZINC001049229645	1347751767	/nfs/dbraw/zinc/75/17/67/1347751767.db2.gz	OZLMNUNSIJQCHA-VMHNCFKSSA-N	0	3	330.859	3.099	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc4cccc(Cl)c4o3)C[C@@H]2C1	ZINC001049255665	1347759521	/nfs/dbraw/zinc/75/95/21/1347759521.db2.gz	HQZQPROQRPISSU-GASCZTMLSA-N	0	3	342.826	3.113	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@H]2[C@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049293570	1347775415	/nfs/dbraw/zinc/77/54/15/1347775415.db2.gz	UNZTXUBMLFRXMX-RBUKOAKNSA-N	0	3	325.456	3.170	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@@H]2CCCN3C(=O)C2CC=CC2)c1	ZINC001049397377	1347820247	/nfs/dbraw/zinc/82/02/47/1347820247.db2.gz	RUUNRXIUGPDLIF-PMACEKPBSA-N	0	3	335.451	3.090	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@H]2CCCN3C(=O)C2=CCCC2)c1	ZINC001049414174	1347836937	/nfs/dbraw/zinc/83/69/37/1347836937.db2.gz	BTRHNBNXDTXANM-UXHICEINSA-N	0	3	335.451	3.234	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc2nc(C)oc2c1	ZINC001049530403	1347894352	/nfs/dbraw/zinc/89/43/52/1347894352.db2.gz	CCADJAGHAMRMMF-DLBZAZTESA-N	0	3	325.412	3.001	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)C2(C3CC3)CC2)cc1	ZINC001049541695	1347898715	/nfs/dbraw/zinc/89/87/15/1347898715.db2.gz	ONRHXXHHFKXETA-WOJBJXKFSA-N	0	3	349.478	3.314	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1coc2cc(F)ccc12	ZINC001049565645	1347912981	/nfs/dbraw/zinc/91/29/81/1347912981.db2.gz	VVVQLAKCCYHAOH-IRXDYDNUSA-N	0	3	328.387	3.437	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1ccc(CCCC)cc1	ZINC001049578872	1347918650	/nfs/dbraw/zinc/91/86/50/1347918650.db2.gz	GBGUTEWZLNSHMT-RTWAWAEBSA-N	0	3	338.495	3.270	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(C)c2cccnc12	ZINC001049597942	1347929957	/nfs/dbraw/zinc/92/99/57/1347929957.db2.gz	HPXJOROIVFCCNZ-OALUTQOASA-N	0	3	335.451	3.408	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1cccc(C2CC2)c1	ZINC001049612099	1347935702	/nfs/dbraw/zinc/93/57/02/1347935702.db2.gz	LZHZELRITAZTKB-SFTDATJTSA-N	0	3	336.479	3.195	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)CCc1ccc(Cl)cc1	ZINC001049620552	1347938469	/nfs/dbraw/zinc/93/84/69/1347938469.db2.gz	FTXFEKYOVFQGDW-MOPGFXCFSA-N	0	3	344.886	3.361	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)CCc1cccc(Cl)c1	ZINC001049625063	1347940730	/nfs/dbraw/zinc/94/07/30/1347940730.db2.gz	GMIXNCRXWGAJIM-RBUKOAKNSA-N	0	3	344.886	3.361	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@H]2CCCN3C(=O)[C@H]2C[C@H]3C[C@H]3C2)cc1	ZINC001049657190	1347958072	/nfs/dbraw/zinc/95/80/72/1347958072.db2.gz	BTOGNIAJRRFHOF-IFLJBQAJSA-N	0	3	349.478	3.170	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@@H]2CCCN3C(=O)[C@H]2C[C@H]3C[C@H]3C2)cc1	ZINC001049657195	1347959097	/nfs/dbraw/zinc/95/90/97/1347959097.db2.gz	BTOGNIAJRRFHOF-ZPAWYTMASA-N	0	3	349.478	3.170	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(Cl)cc1OC	ZINC001049671490	1347965881	/nfs/dbraw/zinc/96/58/81/1347965881.db2.gz	LNMTZLZFNNGIQV-HOTGVXAUSA-N	0	3	334.847	3.214	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(-c2cccs2)n[nH]1	ZINC001049744930	1347997444	/nfs/dbraw/zinc/99/74/44/1347997444.db2.gz	BWDWBCTZXWYIOK-CVEARBPZSA-N	0	3	342.468	3.003	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1ccc(Cl)c(F)c1	ZINC001049746101	1347997714	/nfs/dbraw/zinc/99/77/14/1347997714.db2.gz	CNDZKGLVEIWFQY-MSOLQXFVSA-N	0	3	348.849	3.110	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](CC)Oc1ccccc1C	ZINC001049757939	1348004558	/nfs/dbraw/zinc/00/45/58/1348004558.db2.gz	DRVPSSVRHMWONJ-IPMKNSEASA-N	0	3	342.483	3.404	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)C1(c2cccc(F)c2)CC1	ZINC001049762520	1348007968	/nfs/dbraw/zinc/00/79/68/1348007968.db2.gz	PSQIIOWBORUAGL-MSOLQXFVSA-N	0	3	328.431	3.109	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cnc(C(C)C)nc1C	ZINC001049768768	1348012170	/nfs/dbraw/zinc/01/21/70/1348012170.db2.gz	DPBRJXAMQNMVTR-ZWKOTPCHSA-N	0	3	342.487	3.163	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@H]2CCCN3C(=O)[C@@H]2C[C@H]2C2CC2)cc1	ZINC001049778950	1348017264	/nfs/dbraw/zinc/01/72/64/1348017264.db2.gz	ZYZXAIRGTWHDRU-BQJUDKOJSA-N	0	3	349.478	3.170	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)C1(Cc2ccccc2F)CC1	ZINC001049784349	1348020493	/nfs/dbraw/zinc/02/04/93/1348020493.db2.gz	VWDSQTQZILEKSA-OALUTQOASA-N	0	3	342.458	3.400	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1csc(C(C)(C)C)n1	ZINC001049784777	1348020497	/nfs/dbraw/zinc/02/04/97/1348020497.db2.gz	WRYXRQIHKCMOKB-CABCVRRESA-N	0	3	333.501	3.306	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccccc1F	ZINC001049785827	1348021118	/nfs/dbraw/zinc/02/11/18/1348021118.db2.gz	ZJNGBFBAXGCBNJ-ISARSNTHSA-N	0	3	328.431	3.181	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1cccc(OC)c1F	ZINC001049800070	1348026273	/nfs/dbraw/zinc/02/62/73/1348026273.db2.gz	AGWJOQQOKPMOGA-CVEARBPZSA-N	0	3	332.419	3.089	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cnoc1-c1ccccc1	ZINC001049822767	1348039808	/nfs/dbraw/zinc/03/98/08/1348039808.db2.gz	NVKJZXORVBWJCJ-ROUUACIJSA-N	0	3	337.423	3.207	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1coc(-c2ccccc2)n1	ZINC001049847823	1348056521	/nfs/dbraw/zinc/05/65/21/1348056521.db2.gz	FSTLWYYOMMMQEX-MOPGFXCFSA-N	0	3	349.434	3.044	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C1CCC(C2CC2)CC1	ZINC001049869606	1348075137	/nfs/dbraw/zinc/07/51/37/1348075137.db2.gz	IJUOQDBVAAUGJH-NTFDOXNWSA-N	0	3	328.500	3.291	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1nsc2ccccc21	ZINC001049907701	1348105456	/nfs/dbraw/zinc/10/54/56/1348105456.db2.gz	FBDXXWJMPIIPRY-IRXDYDNUSA-N	0	3	341.480	3.090	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)C12CC(c3ccccc3)(C1)C2	ZINC001049916980	1348110886	/nfs/dbraw/zinc/11/08/86/1348110886.db2.gz	KCJMZFRPAGWGSF-CDNGDFIJSA-N	0	3	336.479	3.360	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](C)Cc1ccc(F)cc1	ZINC001049926301	1348117013	/nfs/dbraw/zinc/11/70/13/1348117013.db2.gz	NGZIXSFKVXKQMR-AYOQOUSVSA-N	0	3	330.447	3.256	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)C1(C(F)(F)F)CCCC1	ZINC001049933929	1348120904	/nfs/dbraw/zinc/12/09/04/1348120904.db2.gz	UIRGXUSFDDBFNT-KBPBESRZSA-N	0	3	330.394	3.360	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001049979848	1348143373	/nfs/dbraw/zinc/14/33/73/1348143373.db2.gz	TYQPLUFAVYMHQM-AYOQOUSVSA-N	0	3	325.456	3.027	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cscc3C(F)F)[C@@H]2C1	ZINC001050048080	1348165321	/nfs/dbraw/zinc/16/53/21/1348165321.db2.gz	CDXBYZOQQMXRNQ-SMDDNHRTSA-N	0	3	326.412	3.408	20	30		EGEDHN
C#CCCN1C[C@@H]2CCCN(C(=O)c3scc(C)c3Cl)[C@@H]2C1	ZINC001050056204	1348167215	/nfs/dbraw/zinc/16/72/15/1348167215.db2.gz	SGUQNFDNMXITDA-UONOGXRCSA-N	0	3	336.888	3.270	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3csc(C(F)(F)F)c3)[C@@H]2C1	ZINC001050084912	1348176875	/nfs/dbraw/zinc/17/68/75/1348176875.db2.gz	OJKRDUWGRHXFDX-WCQYABFASA-N	0	3	344.402	3.489	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)[C@@H]3C[C@H]3c3c(F)cccc3F)[C@@H]2C1	ZINC001050136612	1348193305	/nfs/dbraw/zinc/19/33/05/1348193305.db2.gz	DLBWIWMHRXWZBO-LUXYFRNMSA-N	0	3	346.421	3.177	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)Cc3coc4cc(C)ccc34)[C@@H]2C1	ZINC001050197160	1348208211	/nfs/dbraw/zinc/20/82/11/1348208211.db2.gz	JJARLHFNEQTVKF-QFBILLFUSA-N	0	3	338.451	3.393	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)Cc3ccc4ccccc4c3)[C@@H]2C1	ZINC001050198078	1348208626	/nfs/dbraw/zinc/20/86/26/1348208626.db2.gz	XEARUQIKQYBYBH-LEWJYISDSA-N	0	3	334.463	3.491	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H]3[C@@H](C=C(C)C)C3(C)C)C2)CC1	ZINC001050584356	1348293691	/nfs/dbraw/zinc/29/36/91/1348293691.db2.gz	CRHJVPCDHIKJPL-QZTJIDSGSA-N	0	3	328.500	3.173	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC2(C1)CCN(CCC(F)(F)F)CC2	ZINC001050645493	1348313664	/nfs/dbraw/zinc/31/36/64/1348313664.db2.gz	OHLNCYXGSXSZCX-HNNXBMFYSA-N	0	3	332.410	3.466	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1cncc(C)c1)CC2	ZINC001050645571	1348313945	/nfs/dbraw/zinc/31/39/45/1348313945.db2.gz	QYHOLSJKPBDBIR-HXUWFJFHSA-N	0	3	341.499	3.417	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3ccc(C)c4ccccc34)C2)CC1	ZINC001050679462	1348324346	/nfs/dbraw/zinc/32/43/46/1348324346.db2.gz	HULKPNSDGIKQFL-UHFFFAOYSA-N	0	3	332.447	3.319	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@H](CC3CCCC3)C(C)C)C2)CC1	ZINC001050687817	1348327384	/nfs/dbraw/zinc/32/73/84/1348327384.db2.gz	USLGPTGNOFBCAF-LJQANCHMSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc(C(F)F)cc3)C2)CC1	ZINC001050701152	1348331200	/nfs/dbraw/zinc/33/12/00/1348331200.db2.gz	VYIKZBDDQUPHFO-UHFFFAOYSA-N	0	3	332.394	3.186	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)C(C)(C)c3ccc(CC)cc3)C2)CC1	ZINC001050725904	1348338724	/nfs/dbraw/zinc/33/87/24/1348338724.db2.gz	MZCOZZZPBVMJMJ-UHFFFAOYSA-N	0	3	338.495	3.084	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3c[nH]c4c3cccc4CC)C2)CC1	ZINC001050765415	1348351963	/nfs/dbraw/zinc/35/19/63/1348351963.db2.gz	PSOZFTUHHIKQCQ-UHFFFAOYSA-N	0	3	349.478	3.292	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)[C@@H]3CCCOCC3)cccc2C1	ZINC001051284957	1348417714	/nfs/dbraw/zinc/41/77/14/1348417714.db2.gz	QSXWRCUBCUFLBA-QGZVFWFLSA-N	0	3	342.483	3.054	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)[C@H]3CCO[C@@H](C)C3)cccc2C1	ZINC001051303874	1348426852	/nfs/dbraw/zinc/42/68/52/1348426852.db2.gz	QAOJVUYKDYSIOB-IRXDYDNUSA-N	0	3	342.483	3.052	20	30		EGEDHN
C=C(C)CCN1CCN([C@H]2CCN(C(=O)CC3CCCCC3)C2)CC1	ZINC001051978228	1348493715	/nfs/dbraw/zinc/49/37/15/1348493715.db2.gz	OHHGBUOSFZNZCY-FQEVSTJZSA-N	0	3	347.547	3.142	20	30		EGEDHN
C=CCCN1CCN([C@@H]2CCN(C(=O)C3(CC)CCCCC3)C2)CC1	ZINC001052120137	1348503791	/nfs/dbraw/zinc/50/37/91/1348503791.db2.gz	ZFEXMCQTIAOPJN-LJQANCHMSA-N	0	3	347.547	3.142	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N[C@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC001052313723	1348519433	/nfs/dbraw/zinc/51/94/33/1348519433.db2.gz	CAQJWJWFCKHFQX-ZWKOTPCHSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc3cc(C)ccc3n2)CC1	ZINC001052550054	1348575367	/nfs/dbraw/zinc/57/53/67/1348575367.db2.gz	SASNPTYKFBKALU-SFHVURJKSA-N	0	3	335.451	3.151	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc(-c3ccco3)o2)CC1	ZINC001052548754	1348575376	/nfs/dbraw/zinc/57/53/76/1348575376.db2.gz	DGPIXZWYWLYJDF-OAHLLOKOSA-N	0	3	326.396	3.147	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCCN(Cc3cccnc3)CC2)CC1	ZINC001052681933	1348628995	/nfs/dbraw/zinc/62/89/95/1348628995.db2.gz	KATPTQLFNHFMDD-LJQANCHMSA-N	0	3	327.472	3.299	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCN(Cc3scnc3C)CC2)C1	ZINC001052690567	1348634538	/nfs/dbraw/zinc/63/45/38/1348634538.db2.gz	NXSWIZMAWPJKRF-OAHLLOKOSA-N	0	3	333.501	3.279	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc(C)c(OCC)c2)CC1	ZINC001052765399	1348670003	/nfs/dbraw/zinc/67/00/03/1348670003.db2.gz	YOGBSOXCCCUVRY-SFHVURJKSA-N	0	3	328.456	3.001	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc(C(F)F)cc2F)CC1	ZINC001052822964	1348690678	/nfs/dbraw/zinc/69/06/78/1348690678.db2.gz	WFWKQDMXLXLFTJ-CQSZACIVSA-N	0	3	338.373	3.371	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc(OC)c(C3CC3)c2)CC1	ZINC001052829128	1348693716	/nfs/dbraw/zinc/69/37/16/1348693716.db2.gz	LUYWWIBEMSGITN-SFHVURJKSA-N	0	3	340.467	3.180	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2ccc(O[C@H](C)CC)cc2)CC1	ZINC001052848962	1348700508	/nfs/dbraw/zinc/70/05/08/1348700508.db2.gz	JEFHVQCLNHGBQL-SJLPKXTDSA-N	0	3	328.456	3.081	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2csc3c2CC[C@H](C)C3)CC1	ZINC001052911643	1348743482	/nfs/dbraw/zinc/74/34/82/1348743482.db2.gz	LULROTTYEKSHBY-JKSUJKDBSA-N	0	3	344.524	3.481	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cc(C)nc3ccccc32)CC1	ZINC001052914874	1348745958	/nfs/dbraw/zinc/74/59/58/1348745958.db2.gz	WRCPLSZMALPNQS-QGZVFWFLSA-N	0	3	335.451	3.151	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cccc(OCC(C)C)c2)CC1	ZINC001052920963	1348749010	/nfs/dbraw/zinc/74/90/10/1348749010.db2.gz	GAGZENZLHQGLSK-LJQANCHMSA-N	0	3	342.483	3.329	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@@H]2CCCCc3ccccc32)CC1	ZINC001052960287	1348772588	/nfs/dbraw/zinc/77/25/88/1348772588.db2.gz	QCEURFFJUCRRPB-TZIWHRDSSA-N	0	3	338.495	3.491	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccsc2)C1	ZINC001053063650	1348875025	/nfs/dbraw/zinc/87/50/25/1348875025.db2.gz	POBZTMFTEHGMMN-SJLPKXTDSA-N	0	3	330.497	3.478	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cnccc2C)C1	ZINC001053074556	1348892536	/nfs/dbraw/zinc/89/25/36/1348892536.db2.gz	CHGSMXDKTPMQPZ-UYAOXDASSA-N	0	3	339.483	3.120	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cccc(F)c2C)C1	ZINC001053086521	1348908757	/nfs/dbraw/zinc/90/87/57/1348908757.db2.gz	MUCDUXHUWFMNLD-YLJYHZDGSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cc(C)cc(C)n2)C1	ZINC001053087683	1348911976	/nfs/dbraw/zinc/91/19/76/1348911976.db2.gz	MYRIANTYFNOSRM-UYAOXDASSA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2scnc2CC)C1	ZINC001053088622	1348914045	/nfs/dbraw/zinc/91/40/45/1348914045.db2.gz	YFCNSALMHPVXPW-RDJZCZTQSA-N	0	3	345.512	3.045	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccncc2Cl)C1	ZINC001053098008	1348929214	/nfs/dbraw/zinc/92/92/14/1348929214.db2.gz	JBODSKXJRFBBFP-YJBOKZPZSA-N	0	3	345.874	3.075	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cccn2C(C)C)C1	ZINC001053103952	1348938637	/nfs/dbraw/zinc/93/86/37/1348938637.db2.gz	BDMHMIMRSNYEQY-MOPGFXCFSA-N	0	3	341.499	3.409	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)CCc2ccccc2)C1	ZINC001053104137	1348939523	/nfs/dbraw/zinc/93/95/23/1348939523.db2.gz	COWGGYCQRJZMIU-LEWJYISDSA-N	0	3	338.495	3.346	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cccc3cccnc31)C2	ZINC001054161149	1349163265	/nfs/dbraw/zinc/16/32/65/1349163265.db2.gz	YHLCXHPNHSJOHF-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc(Cl)ccc1F)C2	ZINC001054161482	1349163620	/nfs/dbraw/zinc/16/36/20/1349163620.db2.gz	GWVSFGUXWSJFEI-SFHVURJKSA-N	0	3	334.822	3.040	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@]2(CCN(Cc3cnccc3C)C2)C1	ZINC001054177653	1349179713	/nfs/dbraw/zinc/17/97/13/1349179713.db2.gz	PQUWBWGDLKJHFV-NRFANRHFSA-N	0	3	341.499	3.417	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@]2(CCN(Cc3ccccn3)C2)C1	ZINC001054178017	1349180373	/nfs/dbraw/zinc/18/03/73/1349180373.db2.gz	VYIQGYYCLYZQJM-FQEVSTJZSA-N	0	3	327.472	3.108	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cccc(Cl)c1F)C2	ZINC001054185616	1349188711	/nfs/dbraw/zinc/18/87/11/1349188711.db2.gz	GJOBDGQBTDPFBL-LJQANCHMSA-N	0	3	348.849	3.431	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)Cc1c(C)cc(C)cc1C)C2	ZINC001054190223	1349192595	/nfs/dbraw/zinc/19/25/95/1349192595.db2.gz	DYVALWDLDKMMJM-QFIPXVFZSA-N	0	3	338.495	3.102	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@]2(CCN(Cc3cccnc3)C2)C1	ZINC001054192090	1349193774	/nfs/dbraw/zinc/19/37/74/1349193774.db2.gz	QWGXMCNKUIVYRE-RTWAWAEBSA-N	0	3	341.499	3.498	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@]2(CCN(Cc3ccccn3)C2)C1	ZINC001054192287	1349194354	/nfs/dbraw/zinc/19/43/54/1349194354.db2.gz	TZABTCUCYCHNLZ-LEWJYISDSA-N	0	3	341.499	3.498	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc[nH]c1C1CCC1)C2	ZINC001054198465	1349200520	/nfs/dbraw/zinc/20/05/20/1349200520.db2.gz	XOOJTHGUUIXVQB-OAQYLSRUSA-N	0	3	339.483	3.234	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H](C)Cc1cccs1)C2	ZINC001054204832	1349205915	/nfs/dbraw/zinc/20/59/15/1349205915.db2.gz	FDLHGQVMODKAFZ-FXAWDEMLSA-N	0	3	344.524	3.265	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@H](C)c1cccc(C)c1)C2	ZINC001054206465	1349208496	/nfs/dbraw/zinc/20/84/96/1349208496.db2.gz	JCUJUCJQYLHYHX-DENIHFKCSA-N	0	3	338.495	3.436	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@H](C)c1cc(C)oc1C)C2	ZINC001054215312	1349214882	/nfs/dbraw/zinc/21/48/82/1349214882.db2.gz	QYQYAIWVMAZWHW-UTKZUKDTSA-N	0	3	342.483	3.338	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)C[C@H](C)c1ccccc1F)C2	ZINC001054215212	1349214896	/nfs/dbraw/zinc/21/48/96/1349214896.db2.gz	PHHKHIHLZCTZHQ-UWJYYQICSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)C[C@@H]1CCc3ccccc31)C2	ZINC001054216367	1349215867	/nfs/dbraw/zinc/21/58/67/1349215867.db2.gz	UQGMKMLPFIGVBD-SIKLNZKXSA-N	0	3	336.479	3.054	20	30		EGEDHN
CC(C)(C)C(=O)N1CCC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001054231524	1349224916	/nfs/dbraw/zinc/22/49/16/1349224916.db2.gz	UMCVRZVZCWCOCJ-NRFANRHFSA-N	0	3	339.483	3.419	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)Cc1cccc3ccccc31)C2	ZINC001054231712	1349225346	/nfs/dbraw/zinc/22/53/46/1349225346.db2.gz	YHUXNNNXQIRXEG-QHCPKHFHSA-N	0	3	346.474	3.330	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(C(F)F)o1)C2	ZINC001054233718	1349226389	/nfs/dbraw/zinc/22/63/89/1349226389.db2.gz	QRPLNDDZEAOHIJ-SFHVURJKSA-N	0	3	336.382	3.169	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)CCc1cccs1)C2	ZINC001054238653	1349232851	/nfs/dbraw/zinc/23/28/51/1349232851.db2.gz	AYSZCUMCPOZHEJ-LJQANCHMSA-N	0	3	330.497	3.019	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H](C)Cc1ccccc1)C2	ZINC001054243432	1349236560	/nfs/dbraw/zinc/23/65/60/1349236560.db2.gz	HMBMQUZZGIVVOJ-SIKLNZKXSA-N	0	3	338.495	3.203	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@H]3CCOC[C@@H]3C)cc2C1	ZINC001054280890	1349281955	/nfs/dbraw/zinc/28/19/55/1349281955.db2.gz	VYHCAZMDDDPZAV-JXFKEZNVSA-N	0	3	342.483	3.257	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3coc(C4CC4)n3)cc2C1	ZINC001054285054	1349287167	/nfs/dbraw/zinc/28/71/67/1349287167.db2.gz	QQGKOLPFASAOHG-UHFFFAOYSA-N	0	3	337.423	3.374	20	30		EGEDHN
Cc1sccc1C(=O)N1C[C@@H](C)[C@@H](NCc2ccc(C#N)s2)C1	ZINC001054626737	1349420745	/nfs/dbraw/zinc/42/07/45/1349420745.db2.gz	CUZVVWMNKKHWLL-BZNIZROVSA-N	0	3	345.493	3.240	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@@H](C)[C@H](NCc2cc(C)ns2)C1	ZINC001054678639	1349434943	/nfs/dbraw/zinc/43/49/43/1349434943.db2.gz	IHCCAWGBIJKLJJ-QMTHXVAHSA-N	0	3	341.908	3.167	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H](NCc2ccccc2OC2CC2)[C@@H](C)C1	ZINC001054976890	1349534954	/nfs/dbraw/zinc/53/49/54/1349534954.db2.gz	QLMDZJJFTYAUHC-YJBOKZPZSA-N	0	3	342.483	3.377	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H](C)C[C@@H](C)NCc1ocnc1C	ZINC001134449376	1376544024	/nfs/dbraw/zinc/54/40/24/1376544024.db2.gz	UCNZHZPJLJCBLO-MNOVXSKESA-N	0	3	327.856	3.135	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CN(Cc3ccccc3N(C)C)C[C@H]2C)C1	ZINC001080404406	1357608166	/nfs/dbraw/zinc/60/81/66/1357608166.db2.gz	GMVQZHPAKGSFPJ-SJLPKXTDSA-N	0	3	341.499	3.045	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@]2(c3ccccc3)CC2(C)C)C1	ZINC001080658028	1357718013	/nfs/dbraw/zinc/71/80/13/1357718013.db2.gz	AATWCGDKNVLWRI-HGHGUNKESA-N	0	3	326.484	3.367	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3csc(C)c3C)C2)CC1	ZINC001086924235	1359249652	/nfs/dbraw/zinc/24/96/52/1359249652.db2.gz	NDYXIMDDESUPMB-AWEZNQCLSA-N	0	3	330.497	3.315	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cccc(C)c3F)C2)CC1	ZINC001086924061	1359250015	/nfs/dbraw/zinc/25/00/15/1359250015.db2.gz	JBHYYFWYNXJRKR-INIZCTEOSA-N	0	3	328.431	3.084	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc(C(F)F)ccc2F)CC[C@H]1C	ZINC001071512502	1354736927	/nfs/dbraw/zinc/73/69/27/1354736927.db2.gz	YLRAYMTVFBTXOD-TZMCWYRMSA-N	0	3	338.373	3.369	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)[C@H](C)C(F)(F)F)C1	ZINC001088359194	1359842722	/nfs/dbraw/zinc/84/27/22/1359842722.db2.gz	TXRLLCYGEXOPMJ-NWDGAFQWSA-N	0	3	326.790	3.298	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCCC[C@@H](NCc2cccc(OC)n2)C1	ZINC001088359670	1359843273	/nfs/dbraw/zinc/84/32/73/1359843273.db2.gz	DMEZRVBUFKMJPR-QGZVFWFLSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2c(C)noc2C(F)F)CC[C@H]1C	ZINC001071601465	1354788896	/nfs/dbraw/zinc/78/88/96/1354788896.db2.gz	AGNOINFAELOSHC-PWSUYJOCSA-N	0	3	327.375	3.079	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2cccc3cnccc32)CC[C@@H]1C	ZINC001071609049	1354794204	/nfs/dbraw/zinc/79/42/04/1354794204.db2.gz	GLULCHSLAPJZCH-QFBILLFUSA-N	0	3	337.467	3.323	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cnoc2-c2ccco2)CC[C@@H]1C	ZINC001071623197	1354805442	/nfs/dbraw/zinc/80/54/42/1354805442.db2.gz	SKWABQOUUYDMFH-UONOGXRCSA-N	0	3	329.400	3.093	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2[nH]c3ccccc3c2Cl)CC[C@H]1C	ZINC001071646176	1354824080	/nfs/dbraw/zinc/82/40/80/1354824080.db2.gz	SXIRSDOWQRYYSU-KGLIPLIRSA-N	0	3	343.858	3.427	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cccc(-n3cccc3)c2)CC[C@@H]1C	ZINC001071654670	1354829558	/nfs/dbraw/zinc/82/95/58/1354829558.db2.gz	HIMNESSIBSNRRI-PKOBYXMFSA-N	0	3	335.451	3.083	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cncc(OC(C)C)c2)CC[C@@H]1C	ZINC001071739029	1354888810	/nfs/dbraw/zinc/88/88/10/1354888810.db2.gz	MAYWJCWGYPEQGY-RDJZCZTQSA-N	0	3	331.460	3.028	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc3cc(OC)ccc3[nH]2)CC[C@@H]1C	ZINC001071779028	1354926403	/nfs/dbraw/zinc/92/64/03/1354926403.db2.gz	DHZATCLBTZYKTQ-GOEBONIOSA-N	0	3	341.455	3.335	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccsc2)CC(C)(C)C1	ZINC001089419383	1360413243	/nfs/dbraw/zinc/41/32/43/1360413243.db2.gz	FIBVVIWYGFRIMP-YESZJQIVSA-N	0	3	330.497	3.092	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(N3CC=CC3)cc2)CC[C@@H]1C	ZINC001071821866	1354962094	/nfs/dbraw/zinc/96/20/94/1354962094.db2.gz	SYOUQQHMYUVRNN-PKOBYXMFSA-N	0	3	339.483	3.222	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(C(F)F)c(F)c2)CC[C@@H]1C	ZINC001071822612	1354962655	/nfs/dbraw/zinc/96/26/55/1354962655.db2.gz	ZELARKXMEOWXHU-JSGCOSHPSA-N	0	3	338.373	3.369	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2c[nH]c3ccc(F)cc23)CC[C@@H]1C	ZINC001071851993	1354979714	/nfs/dbraw/zinc/97/97/14/1354979714.db2.gz	TUALUUVPRHPAQS-WMLDXEAASA-N	0	3	343.446	3.395	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccccc2-n2cccn2)CC[C@@H]1C	ZINC001071851767	1354980377	/nfs/dbraw/zinc/98/03/77/1354980377.db2.gz	POKLASAEMKWCTG-DLBZAZTESA-N	0	3	338.455	3.031	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2cc(Br)co2)CC[C@H]1C	ZINC001071868652	1354994365	/nfs/dbraw/zinc/99/43/65/1354994365.db2.gz	LWFVAZXCTNQVEF-DGCLKSJQSA-N	0	3	341.249	3.201	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2cc(Br)co2)CC[C@@H]1C	ZINC001071868653	1354993526	/nfs/dbraw/zinc/99/35/26/1354993526.db2.gz	LWFVAZXCTNQVEF-WCQYABFASA-N	0	3	341.249	3.201	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2occc2Br)CC[C@@H]1C	ZINC001071903964	1355016609	/nfs/dbraw/zinc/01/66/09/1355016609.db2.gz	AAEFXUHVFBIYAA-NWDGAFQWSA-N	0	3	341.249	3.201	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2occc2Br)CC[C@@H]1C	ZINC001071903965	1355016678	/nfs/dbraw/zinc/01/66/78/1355016678.db2.gz	AAEFXUHVFBIYAA-RYUDHWBXSA-N	0	3	341.249	3.201	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cccc(C(F)(F)F)n2)CC[C@@H]1C	ZINC001071931558	1355032486	/nfs/dbraw/zinc/03/24/86/1355032486.db2.gz	XGGKVFNDEMSZQV-STQMWFEESA-N	0	3	341.377	3.259	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc(-c3ccccc3)ccn2)CC[C@H]1C	ZINC001071934009	1355033420	/nfs/dbraw/zinc/03/34/20/1355033420.db2.gz	FTIDTNXXDLCZFV-XLIONFOSSA-N	0	3	347.462	3.355	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2cc3cccnc3s2)CC[C@@H]1C	ZINC001071957210	1355042318	/nfs/dbraw/zinc/04/23/18/1355042318.db2.gz	FHXCYVLURHQZOU-ZFWWWQNUSA-N	0	3	329.469	3.455	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cncc(C(F)(F)F)c2)CC[C@H]1C	ZINC001071957524	1355042831	/nfs/dbraw/zinc/04/28/31/1355042831.db2.gz	JSFYOUMVZJSABW-IUODEOHRSA-N	0	3	341.377	3.259	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2c(C)nn(CCC)c2C)CC[C@H]1C	ZINC001071972516	1355052902	/nfs/dbraw/zinc/05/29/02/1355052902.db2.gz	WUPWTBJZNYPWCB-RHSMWYFYSA-N	0	3	332.492	3.069	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccsc2C(F)(F)F)CC[C@@H]1C	ZINC001072026105	1355087380	/nfs/dbraw/zinc/08/73/80/1355087380.db2.gz	CMWDBEGYLYIEAF-RYUDHWBXSA-N	0	3	344.402	3.373	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc(C)c(F)cc2Cl)CC[C@@H]1C	ZINC001072028793	1355089685	/nfs/dbraw/zinc/08/96/85/1355089685.db2.gz	BWXVNATZJOBFKH-KBPBESRZSA-N	0	3	336.838	3.394	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc(C)c(F)cc2Cl)CC[C@H]1C	ZINC001072028800	1355090149	/nfs/dbraw/zinc/09/01/49/1355090149.db2.gz	BWXVNATZJOBFKH-ZIAGYGMSSA-N	0	3	336.838	3.394	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)Cc2coc3cc(C)ccc23)CC[C@H]1C	ZINC001072048383	1355102935	/nfs/dbraw/zinc/10/29/35/1355102935.db2.gz	JYIVZWXWRGSLMC-AEFFLSMTSA-N	0	3	338.451	3.276	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc3[nH]c(C)c(C)c3c2)CC[C@H]1C	ZINC001072066712	1355109914	/nfs/dbraw/zinc/10/99/14/1355109914.db2.gz	OBOGYNQJUVAWRG-KDOFPFPSSA-N	0	3	337.467	3.391	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc3ccccc3n2CC)CC[C@@H]1C	ZINC001072092754	1355124614	/nfs/dbraw/zinc/12/46/14/1355124614.db2.gz	WZRRWEHINVHWCX-WMZOPIPTSA-N	0	3	337.467	3.267	20	30		EGEDHN
C=C(Cl)CN1C[C@H](NC(=O)c2ccccc2CN(C)C)CC[C@@H]1C	ZINC001072099707	1355129702	/nfs/dbraw/zinc/12/97/02/1355129702.db2.gz	WIXSKLZMMYRNRS-DOTOQJQBSA-N	0	3	349.906	3.083	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cnc(C2CC2)nc1	ZINC001089705022	1360607386	/nfs/dbraw/zinc/60/73/86/1360607386.db2.gz	AYVBBVDSWUUARH-QGZVFWFLSA-N	0	3	342.487	3.151	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(N(C)C)c(F)c2)CC[C@@H]1C	ZINC001072103017	1355131716	/nfs/dbraw/zinc/13/17/16/1355131716.db2.gz	SLWJREPXSIRXRU-HOCLYGCPSA-N	0	3	333.451	3.051	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(CC)c(CC)c2)CC[C@H]1C	ZINC001072124357	1355142346	/nfs/dbraw/zinc/14/23/46/1355142346.db2.gz	ZITBTMOXXROXCF-OXQOHEQNSA-N	0	3	326.484	3.417	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cscc2C(F)(F)F)CC[C@H]1C	ZINC001072127179	1355143992	/nfs/dbraw/zinc/14/39/92/1355143992.db2.gz	PZMUSRIIYGPBDM-NEPJUHHUSA-N	0	3	344.402	3.373	20	30		EGEDHN
C[C@H]1CCN(C(=O)C2CCCC2)C[C@@H]1CNCc1ccccc1C#N	ZINC001072155945	1355157412	/nfs/dbraw/zinc/15/74/12/1355157412.db2.gz	JOMZITXZPKYDGX-JXFKEZNVSA-N	0	3	339.483	3.323	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@H](C)[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001072170914	1355165810	/nfs/dbraw/zinc/16/58/10/1355165810.db2.gz	IZTDBHJHYIZIBX-MAUKXSAKSA-N	0	3	343.446	3.238	20	30		EGEDHN
C[C@H]1CCN(C(=O)CCC2CC2)C[C@H]1CNCc1ccccc1C#N	ZINC001072231674	1355196201	/nfs/dbraw/zinc/19/62/01/1355196201.db2.gz	LEQSSWUXOCBIKD-OXJNMPFZSA-N	0	3	339.483	3.323	20	30		EGEDHN
C[C@@H]1CCN(C(=O)CC2CCC2)C[C@H]1CNCc1ccccc1C#N	ZINC001072241363	1355201711	/nfs/dbraw/zinc/20/17/11/1355201711.db2.gz	VRHPICPACUQBNC-OXQOHEQNSA-N	0	3	339.483	3.323	20	30		EGEDHN
C[C@H]1CCN(C(=O)C2(C)CCC2)C[C@H]1CNCc1ccccc1C#N	ZINC001072338584	1355246286	/nfs/dbraw/zinc/24/62/86/1355246286.db2.gz	DMOGIULRVRZLTO-QFBILLFUSA-N	0	3	339.483	3.323	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC2(C1)CCN([C@@H]1CCc3ccc(Cl)cc31)C2	ZINC001072551540	1355330272	/nfs/dbraw/zinc/33/02/72/1355330272.db2.gz	HGLSZVDXVHGZJJ-CXAGYDPISA-N	0	3	343.858	3.021	20	30		EGEDHN
CC[C@H](c1ccc(Cl)cc1)N1CCC2(CN(C(=O)[C@H](C)C#N)C2)C1	ZINC001072553425	1355330814	/nfs/dbraw/zinc/33/08/14/1355330814.db2.gz	ZKJZBUGZCVFZKC-RHSMWYFYSA-N	0	3	345.874	3.485	20	30		EGEDHN
O=C(C#CC1CC1)N1CC2(C1)CCN(Cc1ccc(C(F)F)cc1)C2	ZINC001072721396	1355406596	/nfs/dbraw/zinc/40/65/96/1355406596.db2.gz	QDNJNQCPLQSAES-UHFFFAOYSA-N	0	3	344.405	3.072	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CC2(C1)CCN(Cc1ccsc1)C2	ZINC001072814522	1355449075	/nfs/dbraw/zinc/44/90/75/1355449075.db2.gz	IAKYNZARSGCJMJ-UHFFFAOYSA-N	0	3	341.480	3.084	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC3(C2)CCN(CCc2ccccc2F)C3)C1	ZINC001072964427	1355527272	/nfs/dbraw/zinc/52/72/72/1355527272.db2.gz	WSESIBVNBFWDQF-UHFFFAOYSA-N	0	3	342.458	3.259	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C(C)(C)c3ccccc3Cl)C2)C1	ZINC001073136238	1355615936	/nfs/dbraw/zinc/61/59/36/1355615936.db2.gz	FOYURRUXTONBEV-UHFFFAOYSA-N	0	3	344.886	3.175	20	30		EGEDHN
C[C@H](CC(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2)C1CC1	ZINC001073464048	1355797076	/nfs/dbraw/zinc/79/70/76/1355797076.db2.gz	XPQVVEWODTUJSZ-MRXNPFEDSA-N	0	3	337.467	3.029	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2ccc(CCCC)cc2)C1	ZINC001073686807	1355864725	/nfs/dbraw/zinc/86/47/25/1355864725.db2.gz	BDMKVSYTZOSHEH-FQEVSTJZSA-N	0	3	344.499	3.426	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2ccsc2C(F)F)C1	ZINC001073874194	1355930874	/nfs/dbraw/zinc/93/08/74/1355930874.db2.gz	VTWCCJJEWKGUAJ-GFCCVEGCSA-N	0	3	344.427	3.083	20	30		EGEDHN
C=CCCN1C[C@@H](C)[C@H](NC(=O)c2cnc(-c3ccco3)s2)C1	ZINC001080818511	1357744255	/nfs/dbraw/zinc/74/42/55/1357744255.db2.gz	MZUAGNGWISDNTQ-CHWSQXEVSA-N	0	3	331.441	3.029	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(CF)cc1	ZINC001073973088	1356004666	/nfs/dbraw/zinc/00/46/66/1356004666.db2.gz	QDLHYKHIRIUVPR-MAUKXSAKSA-N	0	3	331.435	3.129	20	30		EGEDHN
C[C@H]1[C@@H](NCc2ccc(C#N)c(F)c2)CCN1C(=O)[C@H]1CC=CCC1	ZINC001074524815	1356204153	/nfs/dbraw/zinc/20/41/53/1356204153.db2.gz	TZVVNMXADRGRAP-QOKNQOGYSA-N	0	3	341.430	3.133	20	30		EGEDHN
C[C@H](N[C@H]1CCN(C(=O)C#CC2CC2)[C@H]1C)c1ccc(F)cc1F	ZINC001074643048	1356220676	/nfs/dbraw/zinc/22/06/76/1356220676.db2.gz	XGCRDJSYIUBNLW-LXIYXOSZSA-N	0	3	332.394	3.018	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)Cn3cc(C)c4ccccc43)[C@@H]2C1	ZINC001076353659	1356557370	/nfs/dbraw/zinc/55/73/70/1356557370.db2.gz	PFZPWDWOOIRWOS-FXAWDEMLSA-N	0	3	337.467	3.059	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cccn3C3CCCC3)[C@@H]2C1	ZINC001076404338	1356571030	/nfs/dbraw/zinc/57/10/30/1356571030.db2.gz	QGQLNFYNSCLNQE-QFBILLFUSA-N	0	3	327.472	3.326	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)c3ccc(Cl)c4occc43)[C@@H]2C1	ZINC001076451733	1356580220	/nfs/dbraw/zinc/58/02/20/1356580220.db2.gz	IYUFSZOZYJOSDD-BLLLJJGKSA-N	0	3	330.815	3.419	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)CC3C4CC5CC(C4)CC3C5)[C@@H]2C1	ZINC001076595557	1356627037	/nfs/dbraw/zinc/62/70/37/1356627037.db2.gz	ICXFSCIINYVAMT-LFIPAYMNSA-N	0	3	328.500	3.168	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@@H](C)c2cccs2)C[C@H]1C(F)(F)F	ZINC001099306211	1363741024	/nfs/dbraw/zinc/74/10/24/1363741024.db2.gz	RSQNFSQANAUYGJ-YNEHKIRRSA-N	0	3	346.418	3.407	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H](c1ccccc1)N(C)C	ZINC001099349606	1363766145	/nfs/dbraw/zinc/76/61/45/1363766145.db2.gz	QOUPHNDOHVDWJD-RBUKOAKNSA-N	0	3	343.515	3.082	20	30		EGEDHN
C#CCOCCN(C)Cc1cc(Br)cc2cccnc21	ZINC001323093303	1387287845	/nfs/dbraw/zinc/28/78/45/1387287845.db2.gz	DQKIMDDCFZBDPK-UHFFFAOYSA-N	0	3	333.229	3.079	20	30		EGEDHN
CC1(C(=O)N[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C23CCC3)CC1	ZINC001078629821	1357041097	/nfs/dbraw/zinc/04/10/97/1357041097.db2.gz	PIOLBXAQIULSRK-IRXDYDNUSA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(C)CCN1C[C@@H](C)[C@H](NC(=O)c2sc(Cl)nc2Cl)C1	ZINC001080951252	1357768492	/nfs/dbraw/zinc/76/84/92/1357768492.db2.gz	LZRVABCADOAPOL-NXEZZACHSA-N	0	3	348.299	3.466	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)Cc2ccccc2CC)C[C@H]1c1ccccc1	ZINC001081132146	1357844021	/nfs/dbraw/zinc/84/40/21/1357844021.db2.gz	KAWNMWZJTGFXAF-FCHUYYIVSA-N	0	3	346.474	3.009	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C2(C3CCC3)CCC2)C[C@H]1c1ccccc1	ZINC001081154127	1357845066	/nfs/dbraw/zinc/84/50/66/1357845066.db2.gz	XFKUNNBDOJUQEN-VQTJNVASSA-N	0	3	336.479	3.174	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@]2(C)CC=C(C)CC2)C[C@H]1c1ccccc1	ZINC001081229880	1357851116	/nfs/dbraw/zinc/85/11/16/1357851116.db2.gz	DVYZCKSUXPRJID-TUNNFDKTSA-N	0	3	336.479	3.340	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2ccc3sccc3c2)[C@H](OC)C1	ZINC001082290389	1358007478	/nfs/dbraw/zinc/00/74/78/1358007478.db2.gz	XDXOZNXBZMSWRK-IAGOWNOFSA-N	0	3	344.480	3.297	20	30		EGEDHN
COc1ccc([C@H](NC(C)C)C(=O)N2CCCC(C)(C)[C@H]2C#N)cc1	ZINC001183389799	1387305960	/nfs/dbraw/zinc/30/59/60/1387305960.db2.gz	SGGHPDUHMZYTDB-MSOLQXFVSA-N	0	3	343.471	3.275	20	30		EGEDHN
C=C1CCC(C(=O)N2CCO[C@@H]3CN(CCCC4CCC4)C[C@@H]32)CC1	ZINC001083183994	1358122629	/nfs/dbraw/zinc/12/26/29/1358122629.db2.gz	KCXDFZBIIHHKKA-VQTJNVASSA-N	0	3	346.515	3.225	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)CCC3CCCCC3)[C@H]2C1	ZINC001083264023	1358128464	/nfs/dbraw/zinc/12/84/64/1358128464.db2.gz	CLKVNRWUGVVKLF-RBUKOAKNSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)CC3CCC(C)(C)CC3)[C@H]2C1	ZINC001083294407	1358129429	/nfs/dbraw/zinc/12/94/29/1358129429.db2.gz	ZKXQUZFIOAHLMJ-RBUKOAKNSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3cc4ccncc4s3)[C@@H]2C1	ZINC001084408515	1358209309	/nfs/dbraw/zinc/20/93/09/1358209309.db2.gz	NBEWEIPTNPUBFQ-HZPDHXFCSA-N	0	3	341.480	3.409	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)c3ccccc3-c3ccncc3)[C@@H]2C1	ZINC001084450452	1358217080	/nfs/dbraw/zinc/21/70/80/1358217080.db2.gz	IWGZOWJLZVWDIU-WIYYLYMNSA-N	0	3	347.462	3.471	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)C[C@@H](C)c3ccc(CC)cc3)[C@@H]2C1	ZINC001084657195	1358271122	/nfs/dbraw/zinc/27/11/22/1358271122.db2.gz	VIRLKRKKALCPCQ-DUXKGJEZSA-N	0	3	338.495	3.299	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)c3ccc(O[C@@H](C)CC)cc3)[C@@H]2C1	ZINC001084760589	1358303677	/nfs/dbraw/zinc/30/36/77/1358303677.db2.gz	QDIVNRFJBFLGPL-ILZDJORESA-N	0	3	340.467	3.034	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@H]3CCc4c3cccc4Cl)C[C@@H]21	ZINC001084990909	1358360823	/nfs/dbraw/zinc/36/08/23/1358360823.db2.gz	NQYQTZPDZNBBKG-BJZITVGISA-N	0	3	344.886	3.479	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H]2CCN(Cc3cncc(C)c3)[C@H]2C1	ZINC001085024110	1358370796	/nfs/dbraw/zinc/37/07/96/1358370796.db2.gz	VHXRQZDLMADCKF-SVFBPWRDSA-N	0	3	341.499	3.415	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@]3(C)CCC(C)=C(C)C3)C[C@@H]21	ZINC001085104303	1358392776	/nfs/dbraw/zinc/39/27/76/1358392776.db2.gz	XASWUNULCDCVJV-SVFBPWRDSA-N	0	3	328.500	3.459	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)C1(F)CCCC1	ZINC001085251559	1358444573	/nfs/dbraw/zinc/44/45/73/1358444573.db2.gz	XHRKUUXDZSFEGN-CHWSQXEVSA-N	0	3	347.272	3.194	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccncc1Cl	ZINC001085342833	1358472298	/nfs/dbraw/zinc/47/22/98/1358472298.db2.gz	NIOJXHAFRLBQHE-ZIAGYGMSSA-N	0	3	328.243	3.118	20	30		EGEDHN
Cc1ccccc1[C@@H](C)N1CC[C@@H]1CN(C)C(=O)c1c[nH]c(C#N)c1	ZINC001085556766	1358592053	/nfs/dbraw/zinc/59/20/53/1358592053.db2.gz	ZMKQENHCGQIFSX-CRAIPNDOSA-N	0	3	336.439	3.102	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cn(C(C)(C)C)nc1C	ZINC001085593727	1358620289	/nfs/dbraw/zinc/62/02/89/1358620289.db2.gz	PRJUBCUCNYZMOX-MRXNPFEDSA-N	0	3	332.492	3.059	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N(C)C[C@H]1CCN1CCCC1CCCC1	ZINC001085599854	1358625431	/nfs/dbraw/zinc/62/54/31/1358625431.db2.gz	CPYNGQISSVTTKD-AQNXPRMDSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N(C)C[C@H]1CCN1CCC1=CCCCC1	ZINC001085601542	1358626902	/nfs/dbraw/zinc/62/69/02/1358626902.db2.gz	ZREWPLCSHHYDJG-AQNXPRMDSA-N	0	3	346.515	3.391	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cnn2c1ccc(C)c2C	ZINC001085647876	1358658996	/nfs/dbraw/zinc/65/89/96/1358658996.db2.gz	XBPPGAJUMBGSTG-QGZVFWFLSA-N	0	3	340.471	3.064	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cccc([C@@H]2CCOC2)c1	ZINC001085682128	1358683813	/nfs/dbraw/zinc/68/38/13/1358683813.db2.gz	NTCBOMCTCHLIBG-UXHICEINSA-N	0	3	342.483	3.303	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc(C)n([C@@H](C)C2CC2)n1	ZINC001085685322	1358686842	/nfs/dbraw/zinc/68/68/42/1358686842.db2.gz	OWEUWVZZTCALRZ-FUHWJXTLSA-N	0	3	344.503	3.275	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1cc(C)n(C(CC)CC)n1	ZINC001085685194	1358687098	/nfs/dbraw/zinc/68/70/98/1358687098.db2.gz	LQDLNXSCUPQACC-QGZVFWFLSA-N	0	3	332.492	3.275	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@H]1CCOc2c(F)cccc21	ZINC001085714474	1358705985	/nfs/dbraw/zinc/70/59/85/1358705985.db2.gz	LHMMQQGIGHJHPS-WBVHZDCISA-N	0	3	346.446	3.191	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@@H]1COc2ccc(Cl)cc21	ZINC001085722575	1358711738	/nfs/dbraw/zinc/71/17/38/1358711738.db2.gz	BHDWRDRKMWTYAQ-DOTOQJQBSA-N	0	3	348.874	3.315	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C[C@@H]2CCN2CCc2ccc(C)cc2)cc1	ZINC001085756813	1358736703	/nfs/dbraw/zinc/73/67/03/1358736703.db2.gz	QYVDPFBFGDRVPT-QFIPXVFZSA-N	0	3	346.474	3.365	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc(F)c(F)c1F	ZINC001085791877	1358767247	/nfs/dbraw/zinc/76/72/47/1358767247.db2.gz	VIPATFHFONUJBX-LBPRGKRZSA-N	0	3	326.362	3.216	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N(C)C[C@H]1CCN1CCCC1CCCC1	ZINC001085869662	1358835093	/nfs/dbraw/zinc/83/50/93/1358835093.db2.gz	XOLAKYNOHOKGLW-AABGKKOBSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc2c(c1)C[C@@H](C)O2	ZINC001085875394	1358839613	/nfs/dbraw/zinc/83/96/13/1358839613.db2.gz	ZKOYKZGWQSBJCF-QAPCUYQASA-N	0	3	328.456	3.123	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@@H]1CCOc2ccccc21	ZINC001085876162	1358840523	/nfs/dbraw/zinc/84/05/23/1358840523.db2.gz	SUANXIKGNORBBD-SJLPKXTDSA-N	0	3	328.456	3.052	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc2ccn(C)c2c1	ZINC001085906198	1358865001	/nfs/dbraw/zinc/86/50/01/1358865001.db2.gz	BSVPODHPBJXMTK-SFHVURJKSA-N	0	3	325.456	3.291	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1c[nH]nc1C1CCCCC1	ZINC001085918106	1358879171	/nfs/dbraw/zinc/87/91/71/1358879171.db2.gz	UOBJTENSRCDAGC-MRXNPFEDSA-N	0	3	330.476	3.180	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@H]1Cc2ccc(Cl)cc21	ZINC001085951351	1358907792	/nfs/dbraw/zinc/90/77/92/1358907792.db2.gz	DLXJEAXXSXRBSJ-WMZOPIPTSA-N	0	3	332.875	3.479	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc(-c2ccc(C)o2)n[nH]1	ZINC001085969473	1358925558	/nfs/dbraw/zinc/92/55/58/1358925558.db2.gz	BWJAAYYMVXCAFN-OAHLLOKOSA-N	0	3	342.443	3.091	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1ccc(OCC2CC2)cc1	ZINC001085979185	1358933456	/nfs/dbraw/zinc/93/34/56/1358933456.db2.gz	MAIHJEWTQQEUHJ-SFHVURJKSA-N	0	3	328.456	3.198	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc(F)cc3ccncc32)C1	ZINC001086088226	1358992633	/nfs/dbraw/zinc/99/26/33/1358992633.db2.gz	LSLLJCOKKMUVKJ-JNSHFYNHSA-N	0	3	347.821	3.224	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(C)c3cccnc23)C1	ZINC001086151085	1359009644	/nfs/dbraw/zinc/00/96/44/1359009644.db2.gz	MKOMNJABNCNGAQ-GASCZTMLSA-N	0	3	343.858	3.394	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)[C@@H]2CCCC[C@@H]2C)C1	ZINC001086182243	1359018575	/nfs/dbraw/zinc/01/85/75/1359018575.db2.gz	WECFHFYUOAPDIL-SPWCGHHHSA-N	0	3	343.309	3.206	20	30		EGEDHN
C[C@H]1CC[C@@H](C(=O)NC[C@H]2C[C@@H](NCc3ccc(C#N)cc3F)C2)C1	ZINC001086216243	1359029951	/nfs/dbraw/zinc/02/99/51/1359029951.db2.gz	NKJYMTZVCXFYRD-KMANFZQXSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@@H]2CCO[C@H]2c2ccccc2)C1	ZINC001086222732	1359032219	/nfs/dbraw/zinc/03/22/19/1359032219.db2.gz	FSWFPSJEGCEOIY-SPUZQDLCSA-N	0	3	348.874	3.001	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc3ccn(C)c3c2)C1	ZINC001086245505	1359041018	/nfs/dbraw/zinc/04/10/18/1359041018.db2.gz	LQIOLPTULCOFMW-AKAXFMLLSA-N	0	3	331.847	3.029	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@H]2CCCc3ccccc32)C1	ZINC001086400292	1359087991	/nfs/dbraw/zinc/08/79/91/1359087991.db2.gz	AYDHOFUFMAWNTA-ZVZYQTTQSA-N	0	3	332.875	3.343	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc3c(c2)C(C)(C)CO3)C1	ZINC001086426611	1359094108	/nfs/dbraw/zinc/09/41/08/1359094108.db2.gz	ZLAACQZBIXTGFF-CTYIDZIISA-N	0	3	348.874	3.207	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)[C@@H]2CCCC[C@@H]2C)C1	ZINC001086462963	1359106664	/nfs/dbraw/zinc/10/66/64/1359106664.db2.gz	WECFHFYUOAPDIL-CYUUQNCZSA-N	0	3	343.309	3.206	20	30		EGEDHN
C[C@@H]1CC[C@@H](C(=O)NC[C@H]2C[C@H](NCc3ccc(C#N)cc3F)C2)C1	ZINC001086496107	1359119854	/nfs/dbraw/zinc/11/98/54/1359119854.db2.gz	NKJYMTZVCXFYRD-GFOCRRMGSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc(Cl)cn2CC)C1	ZINC001086554503	1359143692	/nfs/dbraw/zinc/14/36/92/1359143692.db2.gz	NQTDAPFYDTUWEZ-AULYBMBSSA-N	0	3	330.259	3.012	20	30		EGEDHN
C=CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2ncoc2CC)C1	ZINC001086580058	1359154524	/nfs/dbraw/zinc/15/45/24/1359154524.db2.gz	LMIQONYXVBSBSO-DLBZAZTESA-N	0	3	339.439	3.011	20	30		EGEDHN
CC1(C(=O)NCC2(NCc3ccc(F)c(C#N)c3)CC2)CCCCC1	ZINC001323530561	1387383010	/nfs/dbraw/zinc/38/30/10/1387383010.db2.gz	MPBPROHOINORPK-UHFFFAOYSA-N	0	3	343.446	3.406	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccsc2COC)C1	ZINC001086732342	1359192945	/nfs/dbraw/zinc/19/29/45/1359192945.db2.gz	HFZKQOAXADHNTD-QWHCGFSZSA-N	0	3	342.892	3.135	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H]3CCCC4(CC4)C3)C2)CC1	ZINC001086923454	1359249450	/nfs/dbraw/zinc/24/94/50/1359249450.db2.gz	RSPLVRPVNIJLAB-ZWKOTPCHSA-N	0	3	328.500	3.293	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)[C@H]3CCC(F)(F)C3)C2)CC1	ZINC001086926914	1359251813	/nfs/dbraw/zinc/25/18/13/1359251813.db2.gz	NPDOCGPTZFPCPW-CVEARBPZSA-N	0	3	338.442	3.148	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc(F)ccc3F)C2)CC1	ZINC001086927021	1359252174	/nfs/dbraw/zinc/25/21/74/1359252174.db2.gz	QFESKZOZCLSYBD-OAHLLOKOSA-N	0	3	346.421	3.305	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H]3CCC=CCCC3)C2)CC1	ZINC001086928611	1359253037	/nfs/dbraw/zinc/25/30/37/1359253037.db2.gz	JBSMLZGINHNCFY-RBUKOAKNSA-N	0	3	328.500	3.459	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3ccn4ccccc34)C2)CC1	ZINC001086932078	1359255719	/nfs/dbraw/zinc/25/57/19/1359255719.db2.gz	ZVBKHNSNLNTSKO-SFHVURJKSA-N	0	3	349.478	3.279	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc(Cl)cc3F)C2)CC1	ZINC001086931630	1359255943	/nfs/dbraw/zinc/25/59/43/1359255943.db2.gz	MZNIJYSHEPIJMO-CQSZACIVSA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc(F)c(C)c3)C2)CC1	ZINC001086939253	1359261551	/nfs/dbraw/zinc/26/15/51/1359261551.db2.gz	LKUCUURAGZJNAR-INIZCTEOSA-N	0	3	328.431	3.084	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H](F)c3ccccc3)C2)CC1	ZINC001086945977	1359267192	/nfs/dbraw/zinc/26/71/92/1359267192.db2.gz	MTLTWYZKMPLDCG-HKUYNNGSSA-N	0	3	342.458	3.424	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)Cc3ccc(C)c(C)c3)C2)CC1	ZINC001086955640	1359276491	/nfs/dbraw/zinc/27/64/91/1359276491.db2.gz	RVHBKYOSIAVNRO-LJQANCHMSA-N	0	3	338.495	3.182	20	30		EGEDHN
CC(C)C(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccc(C#N)cc1F	ZINC001087123070	1359297135	/nfs/dbraw/zinc/29/71/35/1359297135.db2.gz	YILSHTIDRIYVIC-PBHICJAKSA-N	0	3	331.435	3.070	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccc(C#N)cc1F	ZINC001087123663	1359297140	/nfs/dbraw/zinc/29/71/40/1359297140.db2.gz	UYYCHCQDTFLXRM-RKVPGOIHSA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC[C@@H](C)C[C@H]1CNCc1sccc1Cl	ZINC001087136496	1359301690	/nfs/dbraw/zinc/30/16/90/1359301690.db2.gz	WBDSALXHEYOMFI-AGIUHOORSA-N	0	3	339.892	3.278	20	30		EGEDHN
C[C@@H]1CCN(C(=O)C2CC=CC2)[C@H](CNCc2ccc(C#N)s2)C1	ZINC001087139746	1359302793	/nfs/dbraw/zinc/30/27/93/1359302793.db2.gz	QEOWRAZCFZJRTJ-ZBFHGGJFSA-N	0	3	343.496	3.303	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3sccc3C)C(C)(C)[C@@H]21	ZINC001087265329	1359334710	/nfs/dbraw/zinc/33/47/10/1359334710.db2.gz	SWDIGPCVPAJRHH-DJIMGWMZSA-N	0	3	330.497	3.299	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc(C)s1	ZINC001087266584	1359338476	/nfs/dbraw/zinc/33/84/76/1359338476.db2.gz	NUIBVOGRXPLBJC-HYVNUMGLSA-N	0	3	330.497	3.299	20	30		EGEDHN
CC(C)C(=O)N[C@@H]1[C@@H]2CCCN(Cc3ccc(C#N)cc3)[C@H]2C1(C)C	ZINC001087274229	1359347431	/nfs/dbraw/zinc/34/74/31/1359347431.db2.gz	MUAOOKGRHDOEHX-IPMKNSEASA-N	0	3	339.483	3.319	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc4occc4[nH]3)C(C)(C)[C@H]21	ZINC001087288795	1359367930	/nfs/dbraw/zinc/36/79/30/1359367930.db2.gz	CANHBNJCMCRKLR-BVGQSLNGSA-N	0	3	339.439	3.003	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3occ4c3CCC4)C(C)(C)[C@H]21	ZINC001087297001	1359378474	/nfs/dbraw/zinc/37/84/74/1359378474.db2.gz	JMYUPMMJJCLVAM-NEWSRXKRSA-N	0	3	340.467	3.010	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3occc3CC)C(C)(C)[C@H]21	ZINC001087303903	1359386774	/nfs/dbraw/zinc/38/67/74/1359386774.db2.gz	UTDNNUXOJCTPFQ-NXHRZFHOSA-N	0	3	328.456	3.084	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(C)ccc3F)C(C)(C)[C@H]21	ZINC001087304666	1359388177	/nfs/dbraw/zinc/38/81/77/1359388177.db2.gz	FUNOARZKTPUCQW-LZQZEXGQSA-N	0	3	342.458	3.376	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)Cc3ccc(CC)cc3)C(C)(C)[C@H]21	ZINC001087307287	1359394145	/nfs/dbraw/zinc/39/41/45/1359394145.db2.gz	XEPDJNXDBRDZJI-NRSPTQNISA-N	0	3	338.495	3.030	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3oc(CC)cc3C)C(C)(C)[C@@H]21	ZINC001087312231	1359399876	/nfs/dbraw/zinc/39/98/76/1359399876.db2.gz	AZHPGSPREUUTDE-KBAYOESNSA-N	0	3	328.456	3.002	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(F)cc3C)C(C)(C)[C@@H]21	ZINC001087314095	1359403141	/nfs/dbraw/zinc/40/31/41/1359403141.db2.gz	FOUCRMZNTZNQNZ-GUDVDZBRSA-N	0	3	342.458	3.376	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(C)c(F)c(C)c3)C(C)(C)[C@@H]21	ZINC001087318178	1359410039	/nfs/dbraw/zinc/41/00/39/1359410039.db2.gz	SKIDMDOVGWLWDI-BHIYHBOVSA-N	0	3	342.458	3.295	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc(Cl)cn3CC)C(C)(C)[C@H]21	ZINC001087319365	1359411809	/nfs/dbraw/zinc/41/18/09/1359411809.db2.gz	MMSPIIFOMGCONW-PVAVHDDUSA-N	0	3	347.890	3.013	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc(F)s3)C(C)(C)[C@H]21	ZINC001087319635	1359412140	/nfs/dbraw/zinc/41/21/40/1359412140.db2.gz	RBJDVJUTEQVZDN-KCXAZCMYSA-N	0	3	334.460	3.129	20	30		EGEDHN
C=CCN1CCC[C@@H]2[C@@H](NC(=O)c3scnc3Cl)C(C)(C)[C@H]21	ZINC001087320016	1359412966	/nfs/dbraw/zinc/41/29/66/1359412966.db2.gz	XPJPSTGLKBJLLZ-RTXFEEFZSA-N	0	3	339.892	3.201	20	30		EGEDHN
C=CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)c2ccsn2)C1	ZINC001087430280	1359463014	/nfs/dbraw/zinc/46/30/14/1359463014.db2.gz	HCPFCQDQLXETLD-SJLPKXTDSA-N	0	3	341.480	3.307	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccn(C3CCCCC3)n2)[C@H]1CC	ZINC001087571553	1359537636	/nfs/dbraw/zinc/53/76/36/1359537636.db2.gz	ZYEMYAIZESVPPP-FUHWJXTLSA-N	0	3	330.476	3.157	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2ccc(CC(C)C)cc2)[C@H]1CC	ZINC001087646657	1359569663	/nfs/dbraw/zinc/56/96/63/1359569663.db2.gz	MGJZFYJDAMCJIZ-VQTJNVASSA-N	0	3	326.484	3.030	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)[C@@H]2CCc3cc(C)ccc3O2)[C@H]1CC	ZINC001087658341	1359575541	/nfs/dbraw/zinc/57/55/41/1359575541.db2.gz	ZSXOHNIZNJBZDQ-NSHGMRRFSA-N	0	3	342.483	3.234	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnn(CCCC)c2CC)[C@H]1CC	ZINC001087790433	1359647203	/nfs/dbraw/zinc/64/72/03/1359647203.db2.gz	MSTZRVUFXRSYQY-FUHWJXTLSA-N	0	3	332.492	3.014	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C[C@@H]2CCc3ccccc3C2)[C@H]1CC	ZINC001087808815	1359658758	/nfs/dbraw/zinc/65/87/58/1359658758.db2.gz	LBBFZUFIMKMODQ-JRGCBEDISA-N	0	3	338.495	3.174	20	30		EGEDHN
CC(C)=C(F)C(=O)N1C[C@H]2CCN(Cc3ccc(C#N)cc3)C[C@H]2C1	ZINC001087931945	1359712843	/nfs/dbraw/zinc/71/28/43/1359712843.db2.gz	BKSZPDKSJSUYHY-MSOLQXFVSA-N	0	3	341.430	3.102	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3c(Cl)oc4ccccc43)C[C@@H]2C1	ZINC001088076994	1359747284	/nfs/dbraw/zinc/74/72/84/1359747284.db2.gz	FNXPJECVNJQSQX-KGLIPLIRSA-N	0	3	342.826	3.113	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3ccc(Cl)cc3C)C[C@@H]2C1	ZINC001088090520	1359752234	/nfs/dbraw/zinc/75/22/34/1359752234.db2.gz	SMODEUATATWDDO-CVEARBPZSA-N	0	3	330.859	3.066	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](CNCc2oc(C)nc2C)[C@@H](C)C1	ZINC001184231136	1387417124	/nfs/dbraw/zinc/41/71/24/1387417124.db2.gz	LHROPLGVCMHGKG-YJBOKZPZSA-N	0	3	345.487	3.059	20	30		EGEDHN
C=CCN1CC[C@@H](OCC2CCN(C(=O)c3ccccc3C)CC2)C1	ZINC001088228471	1359807675	/nfs/dbraw/zinc/80/76/75/1359807675.db2.gz	QYJDCRKEVKKDBK-LJQANCHMSA-N	0	3	342.483	3.124	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCCCC[C@H](NCC(=C)Cl)C1	ZINC001088327397	1359831679	/nfs/dbraw/zinc/83/16/79/1359831679.db2.gz	MPEWZWIQGWORQD-INIZCTEOSA-N	0	3	335.879	3.401	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)[C@H]2Cc3ccccc32)C1	ZINC001088371530	1359853854	/nfs/dbraw/zinc/85/38/54/1359853854.db2.gz	JWTLHUBPUIJRLP-WMZOPIPTSA-N	0	3	332.875	3.440	20	30		EGEDHN
C=C1CCC(C(=O)N2CCCCC[C@H](NCc3cnn(C)c3)C2)CC1	ZINC001088373763	1359855104	/nfs/dbraw/zinc/85/51/04/1359855104.db2.gz	NXWGREJAWBWIAM-IBGZPJMESA-N	0	3	344.503	3.027	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2cccc3nc[nH]c32)C1	ZINC001088403483	1359875921	/nfs/dbraw/zinc/87/59/21/1359875921.db2.gz	VHBPCXKXYLMHSD-AWEZNQCLSA-N	0	3	346.862	3.290	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)CC[C@@H]2CCCOC2)C1	ZINC001088407015	1359878821	/nfs/dbraw/zinc/87/88/21/1359878821.db2.gz	KCWXRBLUZWCUOH-IRXDYDNUSA-N	0	3	342.911	3.307	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2cnoc2C2CC2)C1	ZINC001088409026	1359880572	/nfs/dbraw/zinc/88/05/72/1359880572.db2.gz	VULKSLYMJCETJO-CQSZACIVSA-N	0	3	337.851	3.279	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2cc3c([nH]2)CCC3)C1	ZINC001088413175	1359884182	/nfs/dbraw/zinc/88/41/82/1359884182.db2.gz	ZQTQBFXKNSUCOT-HNNXBMFYSA-N	0	3	335.879	3.230	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2ccc(OC)cc2)C1	ZINC001088417264	1359887262	/nfs/dbraw/zinc/88/72/62/1359887262.db2.gz	KPNXXGKQAJGBRI-MRXNPFEDSA-N	0	3	336.863	3.422	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2nc(C)c(C)s2)C1	ZINC001088428440	1359896596	/nfs/dbraw/zinc/89/65/96/1359896596.db2.gz	UEBODJUJGXBGNA-CQSZACIVSA-N	0	3	341.908	3.487	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)Cc2csc(C(C)(C)C)n2)[C@H]1C	ZINC001088923041	1360104981	/nfs/dbraw/zinc/10/49/81/1360104981.db2.gz	NPKDDOLVWCJKJB-HIFRSBDPSA-N	0	3	335.517	3.138	20	30		EGEDHN
C=CCCN1CC[C@H](NC(=O)c2sc(CC3CC3)nc2C)[C@H]1C	ZINC001088942423	1360109348	/nfs/dbraw/zinc/10/93/48/1360109348.db2.gz	TWJAWYOJZJCMCH-HIFRSBDPSA-N	0	3	333.501	3.173	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)C[C@@H]2CCc3ccccc3C2)[C@H]1C	ZINC001089001476	1360133218	/nfs/dbraw/zinc/13/32/18/1360133218.db2.gz	JJKKZYTXOONTIO-HLIPFELVSA-N	0	3	326.484	3.337	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc3c(o2)CCCC3)CC(C)(C)C1	ZINC001089406923	1360405428	/nfs/dbraw/zinc/40/54/28/1360405428.db2.gz	UDJKGRKPVNVTJL-INIZCTEOSA-N	0	3	328.456	3.012	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cn(C)c3ccccc23)CC(C)(C)C1	ZINC001089433755	1360425029	/nfs/dbraw/zinc/42/50/29/1360425029.db2.gz	MQMUYFAAPLXYOQ-INIZCTEOSA-N	0	3	337.467	3.032	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3ncccc3o2)CC(C)(C)C1	ZINC001089439368	1360429452	/nfs/dbraw/zinc/42/94/52/1360429452.db2.gz	FCMKYQIONRUWNM-HNNXBMFYSA-N	0	3	339.439	3.072	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@@H](C)c2c(F)cccc2F)CC(C)(C)C1	ZINC001089440484	1360430626	/nfs/dbraw/zinc/43/06/26/1360430626.db2.gz	AMOCIOSOLCPLPG-GJZGRUSLSA-N	0	3	348.437	3.308	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2nccc3occc32)CC(C)(C)C1	ZINC001089446347	1360435558	/nfs/dbraw/zinc/43/55/58/1360435558.db2.gz	WFURRZSBHCMESN-OAHLLOKOSA-N	0	3	339.439	3.072	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@@H]2CCCCC2(F)F)CC(C)(C)C1	ZINC001089448342	1360437251	/nfs/dbraw/zinc/43/72/51/1360437251.db2.gz	CHPCPWIRATYGMH-CABCVRRESA-N	0	3	326.431	3.052	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C2CCC(F)(F)CC2)CC(C)(C)C1	ZINC001089501723	1360475529	/nfs/dbraw/zinc/47/55/29/1360475529.db2.gz	GPBOBPLILCKSIT-HNNXBMFYSA-N	0	3	326.431	3.052	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cccc(F)c2OCC)CC(C)(C)C1	ZINC001089526567	1360490556	/nfs/dbraw/zinc/49/05/56/1360490556.db2.gz	DECBFVNJDWSFLL-HNNXBMFYSA-N	0	3	346.446	3.078	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cnn([C@@H](C)CC)c2C)CC(C)(C)C1	ZINC001089536645	1360495361	/nfs/dbraw/zinc/49/53/61/1360495361.db2.gz	FBSDWDJYGNGWDL-DOTOQJQBSA-N	0	3	344.503	3.016	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@@H](C)c2ccc(C)cc2)CC(C)(C)C1	ZINC001089539884	1360497300	/nfs/dbraw/zinc/49/73/00/1360497300.db2.gz	OYHSQYKULQVMNY-HKUYNNGSSA-N	0	3	326.484	3.339	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc(C)c(CC)s2)CC(C)(C)C1	ZINC001089555454	1360505911	/nfs/dbraw/zinc/50/59/11/1360505911.db2.gz	KWBHJIRIAAAALZ-HNNXBMFYSA-N	0	3	332.513	3.473	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@H](C)c2ccc(F)cc2F)CC(C)(C)C1	ZINC001089560941	1360508919	/nfs/dbraw/zinc/50/89/19/1360508919.db2.gz	KPMQYVYLQKNJLU-GDBMZVCRSA-N	0	3	348.437	3.308	20	30		EGEDHN
C=C(C)CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1snnc1C	ZINC001089607678	1360530657	/nfs/dbraw/zinc/53/06/57/1360530657.db2.gz	PWOXVVGRUVADSH-CQSZACIVSA-N	0	3	336.505	3.033	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)[C@H]1COc2ccccc2C1	ZINC001089667122	1360577506	/nfs/dbraw/zinc/57/75/06/1360577506.db2.gz	BMJCYPWOHZFMAH-MSOLQXFVSA-N	0	3	342.483	3.031	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(C)c(F)c1	ZINC001089667922	1360577896	/nfs/dbraw/zinc/57/78/96/1360577896.db2.gz	OPDYYXOXTCIQLZ-KRWDZBQOSA-N	0	3	330.447	3.378	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1nc(C)c(C)nc1C	ZINC001089668661	1360578584	/nfs/dbraw/zinc/57/85/84/1360578584.db2.gz	ZXPACSXMRXSKAO-KRWDZBQOSA-N	0	3	344.503	3.198	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc2c(c1)CCOC2	ZINC001089669288	1360579253	/nfs/dbraw/zinc/57/92/53/1360579253.db2.gz	JULZHWACTBYWCW-IBGZPJMESA-N	0	3	342.483	3.166	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1nccc2occc21	ZINC001089675045	1360583452	/nfs/dbraw/zinc/58/34/52/1360583452.db2.gz	HCBMNOPTOPTBSA-AWEZNQCLSA-N	0	3	327.428	3.234	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(OC)cs1	ZINC001089677497	1360586059	/nfs/dbraw/zinc/58/60/59/1360586059.db2.gz	YIRROTVGLZOLPE-CQSZACIVSA-N	0	3	334.485	3.000	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(C(C)C)cn1	ZINC001089692875	1360598485	/nfs/dbraw/zinc/59/84/85/1360598485.db2.gz	CZWPYFDIOWFUTF-SFHVURJKSA-N	0	3	341.499	3.449	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc2c(c1)CCO2	ZINC001089697558	1360601668	/nfs/dbraw/zinc/60/16/68/1360601668.db2.gz	PKQDGLGTGXZGNX-KRWDZBQOSA-N	0	3	328.456	3.028	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H]1C[C@H]1c1cccnc1	ZINC001089699904	1360602995	/nfs/dbraw/zinc/60/29/95/1360602995.db2.gz	RZOMKOHCNVHENF-GBESFXJTSA-N	0	3	341.499	3.368	20	30		EGEDHN
C#CCOc1ccc(C(=O)NC[C@@H]2CCC(C)(C)CN2CC=C)cc1	ZINC001089706340	1360609125	/nfs/dbraw/zinc/60/91/25/1360609125.db2.gz	QXYHGFFAPMVPIW-SFHVURJKSA-N	0	3	340.467	3.105	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1oc(C(C)C)nc1C	ZINC001089709727	1360614118	/nfs/dbraw/zinc/61/41/18/1360614118.db2.gz	WMZPPMDEBFOLNU-MRXNPFEDSA-N	0	3	345.487	3.350	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc2sccc2[nH]1	ZINC001089719948	1360622327	/nfs/dbraw/zinc/62/23/27/1360622327.db2.gz	OLGFWPBTTWRMNI-CQSZACIVSA-N	0	3	343.496	3.473	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(OC)cc1	ZINC001089726310	1360629163	/nfs/dbraw/zinc/62/91/63/1360629163.db2.gz	KXMZWOXAFQUQPY-QGZVFWFLSA-N	0	3	330.472	3.492	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1(C2CC2)CC1	ZINC001089824496	1360681360	/nfs/dbraw/zinc/68/13/60/1360681360.db2.gz	OPVUSNJEPBKNOD-SVGFKBNWSA-N	0	3	334.891	3.098	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1cocc1C	ZINC001089846912	1360695146	/nfs/dbraw/zinc/69/51/46/1360695146.db2.gz	NPOLUNBFZHPTSA-MPTYRVRUSA-N	0	3	334.847	3.123	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1occc1CC	ZINC001089858426	1360703252	/nfs/dbraw/zinc/70/32/52/1360703252.db2.gz	AILAIOJGBIIQPL-YVSFHVDLSA-N	0	3	348.874	3.377	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C[C@H]2CC=CCC2)CC2(CCOCC2)C1	ZINC001089950969	1360760705	/nfs/dbraw/zinc/76/07/05/1360760705.db2.gz	DPKCOUQKGTWPLS-OALUTQOASA-N	0	3	346.515	3.296	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](CNCc2oc(CC)nc2C)[C@@H](C)C1	ZINC001184497794	1387473101	/nfs/dbraw/zinc/47/31/01/1387473101.db2.gz	NBPZIKWNAAJSLI-DOTOQJQBSA-N	0	3	347.503	3.476	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)[C@H]2CC[C@H](C)CC2)CC2(CCOCC2)C1	ZINC001089969826	1360772556	/nfs/dbraw/zinc/77/25/56/1360772556.db2.gz	YHTALJSDEMZERE-FHWLQOOXSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2csc(C(C)C)n2)C1	ZINC001091283770	1361030996	/nfs/dbraw/zinc/03/09/96/1361030996.db2.gz	SQNSZRGLWBGHST-UHFFFAOYSA-N	0	3	327.881	3.117	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc(C3CCCC3)no2)C1	ZINC001091372697	1361066605	/nfs/dbraw/zinc/06/66/05/1361066605.db2.gz	WNYDVUZGVGPXRO-UHFFFAOYSA-N	0	3	337.851	3.183	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2c[nH]c3ccc(F)cc23)C1	ZINC001091394390	1361079013	/nfs/dbraw/zinc/07/90/13/1361079013.db2.gz	TZHWXTBPVFNZIM-UHFFFAOYSA-N	0	3	335.810	3.158	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc(C)cc(Cl)c3)C[C@]2(C)C1	ZINC001091854636	1361235507	/nfs/dbraw/zinc/23/55/07/1361235507.db2.gz	MUOROTIDXUPBBC-APWZRJJASA-N	0	3	330.859	3.066	20	30		EGEDHN
C[C@]1(C(=O)N2C[C@H]3CN(Cc4ccc(C#N)cc4)C[C@@]3(C)C2)C=CCC1	ZINC001091929346	1361252601	/nfs/dbraw/zinc/25/26/01/1361252601.db2.gz	IXYMTSBYZHDERO-HJNYFJLDSA-N	0	3	349.478	3.195	20	30		EGEDHN
CC1(C(=O)N2C[C@H]3CN(Cc4ccc(C#N)cc4)C[C@@]3(C)C2)CC=CC1	ZINC001091977775	1361264949	/nfs/dbraw/zinc/26/49/49/1361264949.db2.gz	SGFDLEPNEPZUBI-KNQAVFIVSA-N	0	3	349.478	3.195	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CN(Cc4scnc4C)C[C@@]3(C)C2)C1	ZINC001091995824	1361269823	/nfs/dbraw/zinc/26/98/23/1361269823.db2.gz	KRKFTSOWOXFJPW-BEFAXECRSA-N	0	3	345.512	3.088	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3c(Cl)cccc3Cl)C[C@]2(C)C1	ZINC001092224470	1361330378	/nfs/dbraw/zinc/33/03/78/1361330378.db2.gz	DMQXBVDTDVHVJG-PXAZEXFGSA-N	0	3	337.250	3.021	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc(C)c(CC)s3)C[C@]2(C)C1	ZINC001092260225	1361347003	/nfs/dbraw/zinc/34/70/03/1361347003.db2.gz	PKRAHBCSFMANKV-BEFAXECRSA-N	0	3	330.497	3.036	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3sccc3C(C)C)C[C@]2(C)C1	ZINC001092295602	1361356791	/nfs/dbraw/zinc/35/67/91/1361356791.db2.gz	ADJOIAXSXHRQSQ-BEFAXECRSA-N	0	3	330.497	3.289	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)c2ccccc2F)CC1	ZINC001093351441	1361565282	/nfs/dbraw/zinc/56/52/82/1361565282.db2.gz	AMDPMQXHAKYZQR-LJQANCHMSA-N	0	3	340.442	3.166	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)NC[C@]12CCC[C@H]1N(Cc1ccc(C#N)s1)CC2	ZINC001094490428	1361827339	/nfs/dbraw/zinc/82/73/39/1361827339.db2.gz	VIHCGAIPNBNAKK-VVHMCBODSA-N	0	3	343.496	3.137	20	30		EGEDHN
CC#CCN1CC[C@@]2(CNC(=O)c3cc([C@H](C)CC)no3)CCC[C@@H]12	ZINC001094531654	1361847438	/nfs/dbraw/zinc/84/74/38/1361847438.db2.gz	ZNMSWDASHMGRCM-XFQXTVEOSA-N	0	3	343.471	3.186	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3ccc4ccccc4c3)CCC[C@@H]12	ZINC001094566045	1361863499	/nfs/dbraw/zinc/86/34/99/1361863499.db2.gz	NXLVTTOOCASMNL-IFMALSPDSA-N	0	3	332.447	3.447	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3ccc(OC(C)C)cc3)CCC[C@@H]12	ZINC001094571456	1361864515	/nfs/dbraw/zinc/86/45/15/1361864515.db2.gz	KTRZIFOECCJTAI-TZIWHRDSSA-N	0	3	340.467	3.081	20	30		EGEDHN
CC(C)N(C)CC(=O)NCCCCCCNc1cccc(F)c1C#N	ZINC001094960141	1361963483	/nfs/dbraw/zinc/96/34/83/1361963483.db2.gz	RXCFJKDUZNTSDA-UHFFFAOYSA-N	0	3	348.466	3.126	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1c(C)noc1C(F)F)C2	ZINC001095600585	1362180940	/nfs/dbraw/zinc/18/09/40/1362180940.db2.gz	XBAALWXRFHENSY-AGIUHOORSA-N	0	3	339.386	3.222	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H]1CCc3cc(F)ccc31)C2	ZINC001095772692	1362224899	/nfs/dbraw/zinc/22/48/99/1362224899.db2.gz	AWPYRQSTGCJFHX-YSHGAJCASA-N	0	3	328.431	3.153	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1)C2	ZINC001096133082	1362399906	/nfs/dbraw/zinc/39/99/06/1362399906.db2.gz	ACZVPPKFLVKRSP-LFDJNIOPSA-N	0	3	342.870	3.188	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@@H]1OCCc3ccsc31)C2	ZINC001096376115	1362479029	/nfs/dbraw/zinc/47/90/29/1362479029.db2.gz	QRAULQXDYJFYAQ-QZWWFDLISA-N	0	3	346.496	3.050	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H]1Cc3ccc(Cl)cc31)C2	ZINC001096460248	1362518787	/nfs/dbraw/zinc/51/87/87/1362518787.db2.gz	SWHGMZFKVWPKKY-UBDQQSCGSA-N	0	3	330.859	3.277	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](C)c1cccc(OC)c1)C2	ZINC001096615355	1362598600	/nfs/dbraw/zinc/59/86/00/1362598600.db2.gz	LINXISSNTIJLRU-JZGRTCEGSA-N	0	3	328.456	3.096	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1csc(CC(C)C)n1)C2	ZINC001096652453	1362617716	/nfs/dbraw/zinc/61/77/16/1362617716.db2.gz	LYASFJDABWZVLI-YCPHGPKFSA-N	0	3	333.501	3.253	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cnc(CC(C)C)s1)C(C)C	ZINC001482571603	1395093204	/nfs/dbraw/zinc/09/32/04/1395093204.db2.gz	MWFYDFABCWGORP-ZDUSSCGKSA-N	0	3	343.924	3.438	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](NCc2ccc(Cl)cc2OC)C1	ZINC001185034645	1387592231	/nfs/dbraw/zinc/59/22/31/1387592231.db2.gz	DQFLTJLHXPORGL-QGZVFWFLSA-N	0	3	348.874	3.233	20	30		EGEDHN
Cc1cccc([C@H](C)N2[C@@H]3CC[C@H]2[C@H](NC(=O)c2c[nH]c(C#N)c2)C3)c1	ZINC001096975219	1362801103	/nfs/dbraw/zinc/80/11/03/1362801103.db2.gz	RFVAAYOYPGNKDU-PSAKCFHXSA-N	0	3	348.450	3.291	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H]1CC[C@H](C3CCC3)CC1)C2	ZINC001097256307	1362903931	/nfs/dbraw/zinc/90/39/31/1362903931.db2.gz	RDQDQDAXPADDAV-WAPOTWQKSA-N	0	3	328.500	3.338	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1c(C)noc1C(C)C)C2	ZINC001097263663	1362906392	/nfs/dbraw/zinc/90/63/92/1362906392.db2.gz	WPBRGCDAVMKISS-OAGGEKHMSA-N	0	3	331.460	3.408	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001185061775	1387605289	/nfs/dbraw/zinc/60/52/89/1387605289.db2.gz	PMKVGAJYCIQIBG-MJGOQNOKSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@@H](NCc2cc(C)ccc2OC)C1	ZINC001185064739	1387607727	/nfs/dbraw/zinc/60/77/27/1387607727.db2.gz	WYJLOZCDXUHULR-SJLPKXTDSA-N	0	3	330.472	3.296	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C1(c3cccc(C)c3)CCC1)C2	ZINC001097618024	1363076927	/nfs/dbraw/zinc/07/69/27/1363076927.db2.gz	KXNLRQAMLSAESX-AQNXPRMDSA-N	0	3	336.479	3.162	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](CNCc3cnc(C)o3)[C@@H](C)C2)CCC1	ZINC001185093805	1387617199	/nfs/dbraw/zinc/61/71/99/1387617199.db2.gz	DAFUWAGLTPJYPK-RDJZCZTQSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C13CC(c4ccccc4)(C1)C3)C2	ZINC001098473348	1363336617	/nfs/dbraw/zinc/33/66/17/1363336617.db2.gz	BPJMMTISUVBOFC-IEPIWIGSSA-N	0	3	336.479	3.406	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(N(C)CCC)cc1)C2	ZINC001098502017	1363344835	/nfs/dbraw/zinc/34/48/35/1363344835.db2.gz	OSEONLPMNGZJMX-AQNXPRMDSA-N	0	3	341.499	3.444	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)C[C@H](NC(=O)CC1CC1)c1ccccc1O2	ZINC001098541031	1363362160	/nfs/dbraw/zinc/36/21/60/1363362160.db2.gz	GHBFGUBBEJIUJI-GHTZIAJQSA-N	0	3	340.467	3.447	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccccc1Cl)C[C@@H](C)O2	ZINC001098656422	1363421603	/nfs/dbraw/zinc/42/16/03/1363421603.db2.gz	RERBBRPWQPYXOL-OAHLLOKOSA-N	0	3	348.874	3.222	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)CC(C1CC1)C1CC1)C[C@@H](C)O2	ZINC001098662743	1363424498	/nfs/dbraw/zinc/42/44/98/1363424498.db2.gz	KZEIEPQFELANES-MRXNPFEDSA-N	0	3	346.515	3.081	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1CCCCC1(C)C)C[C@@H](C)O2	ZINC001098664036	1363425610	/nfs/dbraw/zinc/42/56/10/1363425610.db2.gz	MNGRPWAIMANOQB-QZTJIDSGSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2csc([C@@H](C)OC)n2)C1	ZINC001098835697	1363487234	/nfs/dbraw/zinc/48/72/34/1363487234.db2.gz	FLCLATMDVYRSSW-GLJUWKHASA-N	0	3	349.500	3.011	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2csc([C@H](C)OC)n2)C1	ZINC001098835696	1363487595	/nfs/dbraw/zinc/48/75/95/1363487595.db2.gz	FLCLATMDVYRSSW-DEYYWGMASA-N	0	3	349.500	3.011	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cccc3c2CCCC3)C1	ZINC001098852983	1363492911	/nfs/dbraw/zinc/49/29/11/1363492911.db2.gz	NCIYYXWEEWQKOX-AVRDEDQJSA-N	0	3	336.479	3.173	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(C)c(F)cc2F)C1	ZINC001098892200	1363506922	/nfs/dbraw/zinc/50/69/22/1363506922.db2.gz	WUKYWPWNRPOKBD-LIRRHRJNSA-N	0	3	334.410	3.434	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)c1occc1C	ZINC001098895177	1363508486	/nfs/dbraw/zinc/50/84/86/1363508486.db2.gz	QWLWUAHWLDKJPY-INIZCTEOSA-N	0	3	334.460	3.011	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)CCc1ccco1	ZINC001098895706	1363509081	/nfs/dbraw/zinc/50/90/81/1363509081.db2.gz	WWVRIGVGTKDKMW-KRWDZBQOSA-N	0	3	348.487	3.022	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)CCc1cncc(C)c1	ZINC001099135800	1363646750	/nfs/dbraw/zinc/64/67/50/1363646750.db2.gz	PZBNDXQUQHXFTD-SFHVURJKSA-N	0	3	329.488	3.115	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H]2Cc3ccc(Cl)cc32)C1	ZINC001099142239	1363651431	/nfs/dbraw/zinc/65/14/31/1363651431.db2.gz	BMIAUZMZJAFIEJ-FNHZYXHNSA-N	0	3	330.859	3.136	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(C)c3c2CCC3)C1	ZINC001099178222	1363674816	/nfs/dbraw/zinc/67/48/16/1363674816.db2.gz	FSFIZIWAFMRQHX-JTSKRJEESA-N	0	3	336.479	3.091	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)C[C@H](C=C)CC	ZINC001099194839	1363685951	/nfs/dbraw/zinc/68/59/51/1363685951.db2.gz	SWNCJJQGXLTKEI-MSOLQXFVSA-N	0	3	336.520	3.398	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@H](CC)OC1CCCC1	ZINC001099251453	1363714122	/nfs/dbraw/zinc/71/41/22/1363714122.db2.gz	JZXIXOYPEVZJQU-HKUYNNGSSA-N	0	3	348.531	3.354	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)COCc1ccccc1C	ZINC001099263691	1363721266	/nfs/dbraw/zinc/72/12/66/1363721266.db2.gz	IKAJCWFYZHNMLD-IBGZPJMESA-N	0	3	344.499	3.304	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)CCC1(C)CC1	ZINC001099292215	1363735117	/nfs/dbraw/zinc/73/51/17/1363735117.db2.gz	RHPNNEDTKQYMEL-QGZVFWFLSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@@H]2CCC(C)(C)C2)C[C@H]1C(F)(F)F	ZINC001099302773	1363738720	/nfs/dbraw/zinc/73/87/20/1363738720.db2.gz	BEYLHGHWNXIJHS-MGPQQGTHSA-N	0	3	332.410	3.368	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)COc1ccccc1F	ZINC001099339376	1363759922	/nfs/dbraw/zinc/75/99/22/1363759922.db2.gz	HXEOVSGEJNJQTD-MRXNPFEDSA-N	0	3	348.462	3.387	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)[C@H](C)C1CCOCC1	ZINC001099379258	1363780601	/nfs/dbraw/zinc/78/06/01/1363780601.db2.gz	ILYQTJYMARWMCM-AEFFLSMTSA-N	0	3	336.520	3.232	20	30		EGEDHN
CCCCCCCCCCC(=O)N[C@@H]1CCN(CCCF)C[C@H]1O	ZINC001100083618	1364011482	/nfs/dbraw/zinc/01/14/82/1364011482.db2.gz	UTWXLNGLQGHGNO-QZTJIDSGSA-N	0	3	344.515	3.428	20	30		EGEDHN
C=CCCC(=O)NCC1CC(NCc2cnc(-c3ccccc3)o2)C1	ZINC001100176780	1364036388	/nfs/dbraw/zinc/03/63/88/1364036388.db2.gz	DXYSOVCCSZTYDT-UHFFFAOYSA-N	0	3	339.439	3.292	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)NCC1CC(NCC#Cc2ccccc2Cl)C1	ZINC001100246306	1364057613	/nfs/dbraw/zinc/05/76/13/1364057613.db2.gz	YPFYPWXXNWTTAP-PREGVCBESA-N	0	3	344.886	3.222	20	30		EGEDHN
Cc1coc(C)c1C(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100294036	1364070685	/nfs/dbraw/zinc/07/06/85/1364070685.db2.gz	CZASWGZLIKNUMD-UHFFFAOYSA-N	0	3	336.435	3.046	20	30		EGEDHN
CCCC[C@H](C)C(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100296654	1364071218	/nfs/dbraw/zinc/07/12/18/1364071218.db2.gz	LHOSYBFBRKQNSZ-KKXNLOMOSA-N	0	3	326.484	3.349	20	30		EGEDHN
C[C@@H](NC1CC(CNC(=O)C#CC2CC2)C1)c1cccc(Cl)c1F	ZINC001100314770	1364077664	/nfs/dbraw/zinc/07/76/64/1364077664.db2.gz	CUSSVDKVHSKTDS-LRVUVFPRSA-N	0	3	348.849	3.438	20	30		EGEDHN
CCC(C)(C)CC(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100361955	1364091891	/nfs/dbraw/zinc/09/18/91/1364091891.db2.gz	JXEYXEGUXLKCAP-UHFFFAOYSA-N	0	3	326.484	3.349	20	30		EGEDHN
C=C(C)CCC(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100371276	1364094742	/nfs/dbraw/zinc/09/47/42/1364094742.db2.gz	YZJUBFOZVLLXOB-UHFFFAOYSA-N	0	3	328.431	3.018	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)Cc2ccc(C)cc2Cl)C1	ZINC001100459021	1364121854	/nfs/dbraw/zinc/12/18/54/1364121854.db2.gz	QEGCWOWHZKRVHP-UHFFFAOYSA-N	0	3	341.282	3.428	20	30		EGEDHN
CC1(C)CCC[C@@H]1C(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100574715	1364169957	/nfs/dbraw/zinc/16/99/57/1364169957.db2.gz	BNUWQYIWOPEOMS-SOAGJPPSSA-N	0	3	338.495	3.349	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)C2(CCCC)CC2)C1	ZINC001100642818	1364201309	/nfs/dbraw/zinc/20/13/09/1364201309.db2.gz	PDGJQCZVRKVFSZ-UHFFFAOYSA-N	0	3	343.309	3.350	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1	ZINC001100644702	1364202283	/nfs/dbraw/zinc/20/22/83/1364202283.db2.gz	CXEAUABCSDXPEQ-LAGYLCCXSA-N	0	3	343.446	3.284	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC1CC(NCc2cc(F)ccc2OC)C1	ZINC001100645129	1364202529	/nfs/dbraw/zinc/20/25/29/1364202529.db2.gz	VJVUWAOFYGCUBN-GAGFWEIESA-N	0	3	348.462	3.421	20	30		EGEDHN
C=CCC1(C(=O)NCC2CC(NCC#Cc3ccccc3)C2)CCC1	ZINC001100648731	1364204733	/nfs/dbraw/zinc/20/47/33/1364204733.db2.gz	VLVGICHDOXQUJJ-UHFFFAOYSA-N	0	3	336.479	3.269	20	30		EGEDHN
CC(C)C1(C(=O)NCC2CC(NCc3cc(C#N)ccc3F)C2)CC1	ZINC001100659117	1364207332	/nfs/dbraw/zinc/20/73/32/1364207332.db2.gz	HPSIXPUYJYQLOX-UHFFFAOYSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC2CC(NCc3ccc(C#N)cc3F)C2)C1	ZINC001100661502	1364207970	/nfs/dbraw/zinc/20/79/70/1364207970.db2.gz	XIZOBJCTLIYFTA-UHFFFAOYSA-N	0	3	341.430	3.038	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@H](CC)Cc2ccccc2)C1	ZINC001100722505	1364235177	/nfs/dbraw/zinc/23/51/77/1364235177.db2.gz	MCBVGQNQFIKFAL-LXPRWKDFSA-N	0	3	334.891	3.492	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C(C)(C)CC(F)(F)F)C1	ZINC001100832485	1364282581	/nfs/dbraw/zinc/28/25/81/1364282581.db2.gz	FRPRVLPOZOUPHW-UHFFFAOYSA-N	0	3	326.790	3.202	20	30		EGEDHN
C=CCN1CC[C@H](Oc2ccnc(CNC(=O)C[C@H](C)C(C)C)c2)C1	ZINC001101092718	1364409625	/nfs/dbraw/zinc/40/96/25/1364409625.db2.gz	WBZFVAUCDPSXBI-LPHOPBHVSA-N	0	3	345.487	3.019	20	30		EGEDHN
C=C(C)CN1CC[C@H](Oc2ccnc(CNC(=O)C[C@@H](C)CC)c2)C1	ZINC001101093827	1364410478	/nfs/dbraw/zinc/41/04/78/1364410478.db2.gz	KWMNPTYQMSUCNV-LPHOPBHVSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=C(C)CN1CC[C@@H](Oc2ccnc(CNC(=O)[C@H](C)C(C)C)c2)C1	ZINC001101097016	1364412724	/nfs/dbraw/zinc/41/27/24/1364412724.db2.gz	HBQRTMZEFBNJCG-VQIMIIECSA-N	0	3	345.487	3.019	20	30		EGEDHN
C=CCCC(=O)N1C[C@H]2CN(Cc3c(C)nsc3C)C[C@@]2(C)C1	ZINC001101167852	1364443570	/nfs/dbraw/zinc/44/35/70/1364443570.db2.gz	XOMTXSVGCPAZJF-QAPCUYQASA-N	0	3	333.501	3.006	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@H]2CN(CCc3csc(C)n3)C[C@@]2(C)C1	ZINC001101253585	1364487476	/nfs/dbraw/zinc/48/74/76/1364487476.db2.gz	RKZWGYCVEFZHBQ-APWZRJJASA-N	0	3	347.528	3.131	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)CCCc3ccc(Cl)cc3)C[C@]2(C)C1	ZINC001101289299	1364500580	/nfs/dbraw/zinc/50/05/80/1364500580.db2.gz	HATMQQYTRWJBJL-XLIONFOSSA-N	0	3	344.886	3.076	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@H]2CN(Cc3cncc(C)c3)C[C@@]2(C)C1	ZINC001101333278	1364513578	/nfs/dbraw/zinc/51/35/78/1364513578.db2.gz	OBRHUGVWYBZRAH-QFUCXCTJSA-N	0	3	341.499	3.273	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@H]2CN(Cc3cccnc3C)C[C@@]2(C)C1	ZINC001101336879	1364515616	/nfs/dbraw/zinc/51/56/16/1364515616.db2.gz	TTXKDDIKECQLJL-SCWSEQNSSA-N	0	3	341.499	3.273	20	30		EGEDHN
C=CCCCC(=O)N1C[C@H]2CN(Cc3cccc(F)c3)C[C@@]2(C)C1	ZINC001101346841	1364520319	/nfs/dbraw/zinc/52/03/19/1364520319.db2.gz	JVBZYDNXDMMIKZ-XLIONFOSSA-N	0	3	330.447	3.462	20	30		EGEDHN
CC/C=C(/C)C(=O)NC[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1C	ZINC001101777849	1364722923	/nfs/dbraw/zinc/72/29/23/1364722923.db2.gz	QYFKEUZWBJQFBD-DZLAQPFJSA-N	0	3	343.446	3.238	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@@H]1CN(Cc2cccc(C(C)C)n2)C[C@H]1C	ZINC001101946935	1364786722	/nfs/dbraw/zinc/78/67/22/1364786722.db2.gz	RCCJBXJVTNDNKR-QZTJIDSGSA-N	0	3	341.499	3.049	20	30		EGEDHN
CCC1(C(=O)NC[C@@H]2CN(CC#Cc3ccccc3)C[C@H]2C)CCC1	ZINC001102256341	1364969675	/nfs/dbraw/zinc/96/96/75/1364969675.db2.gz	MYXIFHJBJWWWDV-UYAOXDASSA-N	0	3	338.495	3.303	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CNC(=O)C1(C)CC=CC1	ZINC001102318695	1364999400	/nfs/dbraw/zinc/99/94/00/1364999400.db2.gz	FUVGYHAXXAJDNF-HUUCEWRRSA-N	0	3	343.496	3.160	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@@H]1CN(Cc2cc(C)ns2)C[C@H]1C	ZINC001102327453	1365003233	/nfs/dbraw/zinc/00/32/33/1365003233.db2.gz	VPILQXUMRSCBNO-DDUZABMNSA-N	0	3	335.517	3.238	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)NC[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1C	ZINC001102422981	1365047442	/nfs/dbraw/zinc/04/74/42/1365047442.db2.gz	IQIURRRGHPKWOH-IIDMSEBBSA-N	0	3	345.462	3.174	20	30		EGEDHN
C=C[C@H](C(=O)NC[C@@H]1CN(C/C=C\Cl)C[C@H]1C)c1ccccc1	ZINC001102592021	1365128088	/nfs/dbraw/zinc/12/80/88/1365128088.db2.gz	JENAJJZKUUSMBB-NYWIHWJNSA-N	0	3	332.875	3.393	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CCNC(=O)C1=CCCC1	ZINC001102857403	1365255587	/nfs/dbraw/zinc/25/55/87/1365255587.db2.gz	ZUBZBOBFSFREMJ-GDBMZVCRSA-N	0	3	343.496	3.304	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCC[C@@H]1CN(Cc2ccc(F)cn2)C[C@H]1C	ZINC001103033303	1365348025	/nfs/dbraw/zinc/34/80/25/1365348025.db2.gz	FTLJTRYEDLMLEJ-HZPDHXFCSA-N	0	3	347.478	3.397	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2conc2C(C)C)C1	ZINC001103080893	1365369539	/nfs/dbraw/zinc/36/95/39/1365369539.db2.gz	PWUZNPDZHFPHKD-TZMCWYRMSA-N	0	3	339.867	3.238	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cc(Cl)cn2C)C1	ZINC001103208390	1365436611	/nfs/dbraw/zinc/43/66/11/1365436611.db2.gz	DHLZGBBLDAIKLX-DGCLKSJQSA-N	0	3	344.286	3.119	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC[C@@H]1CN(Cc2ccc(F)cn2)C[C@H]1C	ZINC001103307955	1365485737	/nfs/dbraw/zinc/48/57/37/1365485737.db2.gz	NDWBZJMLVMSSQK-HZPDHXFCSA-N	0	3	347.478	3.397	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2ccc(C)nc2C)C1	ZINC001103746836	1365762081	/nfs/dbraw/zinc/76/20/81/1365762081.db2.gz	YQASHOXWXXIKJS-MLGOLLRUSA-N	0	3	335.879	3.139	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@H](CCNCc2cc(C3CC3)no2)C1	ZINC001103977753	1365857183	/nfs/dbraw/zinc/85/71/83/1365857183.db2.gz	DDXRRBVNFUXFPP-GDBMZVCRSA-N	0	3	331.460	3.092	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2ccc(F)cc2F)C1	ZINC001104124857	1365918485	/nfs/dbraw/zinc/91/84/85/1365918485.db2.gz	UNNCCZQRKQCILE-NVXWUHKLSA-N	0	3	348.437	3.343	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](C)[C@H](CCNCc2ccc(F)cn2)C1	ZINC001104563601	1366078028	/nfs/dbraw/zinc/07/80/28/1366078028.db2.gz	OKIJYIVDMPKAMT-GVDBMIGSSA-N	0	3	347.478	3.397	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@@H](C)[C@H](CCNCc2ocnc2C)C1	ZINC001104564021	1366078778	/nfs/dbraw/zinc/07/87/78/1366078778.db2.gz	AUVYEQDKGUKABC-HYVNUMGLSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H](C)[C@H](CCNCc2c(C)noc2C)C1	ZINC001104631441	1366110316	/nfs/dbraw/zinc/11/03/16/1366110316.db2.gz	NKXLOSXLTJTWCD-ZTQAJYAQSA-N	0	3	347.503	3.468	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2ccc3c(c2)CCO3)C[C@H]1C	ZINC001104711418	1366139961	/nfs/dbraw/zinc/13/99/61/1366139961.db2.gz	JBSBBNDXQUKMQY-CXAGYDPISA-N	0	3	348.874	3.062	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)[C@@H](C)OCCC(C)C)C[C@H]1C	ZINC001105090674	1366320368	/nfs/dbraw/zinc/32/03/68/1366320368.db2.gz	FXIMJAUGAKPTGV-DJIMGWMZSA-N	0	3	344.927	3.264	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@@H](CNCc2nc(C)c(C)s2)[C@H](C)C1	ZINC001106025803	1366606849	/nfs/dbraw/zinc/60/68/49/1366606849.db2.gz	IRWRJJMTPUWBCD-RHSMWYFYSA-N	0	3	347.528	3.138	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCCC2CC2)C[C@H]1CNCc1ccccc1C#N	ZINC001106560041	1366735603	/nfs/dbraw/zinc/73/56/03/1366735603.db2.gz	HLHPONALHLSDRV-OXQOHEQNSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](NCc2ccc(OC)c(F)c2)C1	ZINC001185969303	1387838174	/nfs/dbraw/zinc/83/81/74/1387838174.db2.gz	XZZIVBZJFIBLLC-OAHLLOKOSA-N	0	3	334.435	3.127	20	30		EGEDHN
COCC#CCN1CC[C@@]2(CNC(=O)CCCC(C)(C)C)CCC[C@@H]12	ZINC001107330751	1366930676	/nfs/dbraw/zinc/93/06/76/1366930676.db2.gz	MNCRQAJRVJPODP-WIYYLYMNSA-N	0	3	348.531	3.213	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@]12CCC[C@H]1N(Cc1ccc(F)cc1)CC2	ZINC001107394298	1366950983	/nfs/dbraw/zinc/95/09/83/1366950983.db2.gz	XDEKIROEXZRTMY-TZIWHRDSSA-N	0	3	342.458	3.346	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@]12CCC[C@H]1N(Cc1cc(C)ncn1)CC2	ZINC001107424147	1366960431	/nfs/dbraw/zinc/96/04/31/1366960431.db2.gz	AAEIMJXOZFRJAA-UYAOXDASSA-N	0	3	342.487	3.002	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@]12CCC[C@H]1N(Cc1cnoc1C)CC2	ZINC001107499981	1366997127	/nfs/dbraw/zinc/99/71/27/1366997127.db2.gz	RUVFWMXKELVKFA-YLJYHZDGSA-N	0	3	345.487	3.446	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)C[C@@H](C)CCCCC)[C@@H]2C1	ZINC001189341618	1366997350	/nfs/dbraw/zinc/99/73/50/1366997350.db2.gz	GUONRXWLJYCOLC-GBESFXJTSA-N	0	3	336.520	3.328	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCN(C(=O)/C=C/C(C)(C)C)C1	ZINC001189427183	1367018465	/nfs/dbraw/zinc/01/84/65/1367018465.db2.gz	FIKYNYYDRMBLAX-XSFOEPMVSA-N	0	3	325.456	3.193	20	30		EGEDHN
C=CCCC(=O)NC[C@@]1(C)CN(CC2CCC3(CC3)CC2)CCO1	ZINC001107802258	1367153443	/nfs/dbraw/zinc/15/34/43/1367153443.db2.gz	NCRKSGRXCBKATD-IBGZPJMESA-N	0	3	334.504	3.130	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@H](N(C)Cc2cccc(C(F)F)c2)C1	ZINC001190053058	1367161756	/nfs/dbraw/zinc/16/17/56/1367161756.db2.gz	DCJVCVIYEFWJOJ-KRWDZBQOSA-N	0	3	334.410	3.316	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2ccsc2C)C1	ZINC001107930042	1367207686	/nfs/dbraw/zinc/20/76/86/1367207686.db2.gz	CKPDXVDWYVZSBJ-RDTXWAMCSA-N	0	3	336.501	3.232	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)[C@@H](C)CCc3cccc(F)c3)[C@@H]2C1	ZINC001190281861	1367217450	/nfs/dbraw/zinc/21/74/50/1367217450.db2.gz	MAZIBUKGSIOPJS-VDZJLULYSA-N	0	3	330.447	3.113	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NC[C@]1(C)CN(CCC(C)(C)C)CCO1	ZINC001107970562	1367223406	/nfs/dbraw/zinc/22/34/06/1367223406.db2.gz	CHUJEQSHOSNUBS-GOSISDBHSA-N	0	3	344.927	3.408	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2C[C@H](OC)c1ccccc1	ZINC001109604277	1367227694	/nfs/dbraw/zinc/22/76/94/1367227694.db2.gz	BITLXVQXDNMGBQ-XWSJACJDSA-N	0	3	342.483	3.308	20	30		EGEDHN
C#CCC1(C(=O)NC[C@]2(C)CN(C[C@@H](C)CC(C)C)CCO2)CCC1	ZINC001107990922	1367232203	/nfs/dbraw/zinc/23/22/03/1367232203.db2.gz	QWIGGBHFMJIRJT-AZUAARDMSA-N	0	3	348.531	3.069	20	30		EGEDHN
CCC(C)(C)CC(=O)N1CC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001190345828	1367233463	/nfs/dbraw/zinc/23/34/63/1367233463.db2.gz	YIWPUQZRINNPEL-SFHVURJKSA-N	0	3	327.472	3.417	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](c1ccncc1)C(C)C)C2	ZINC001109643736	1367260720	/nfs/dbraw/zinc/26/07/20/1367260720.db2.gz	YETFXZNSJHJMQO-XWSJACJDSA-N	0	3	327.472	3.119	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](N(C)Cc2ccc(C)c(OC)c2)C1	ZINC001190428305	1367263077	/nfs/dbraw/zinc/26/30/77/1367263077.db2.gz	GJWRISLZKFRAAP-GOSISDBHSA-N	0	3	330.472	3.393	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@@H](N(C)Cc3ccc(CF)cc3)C2)CCC1	ZINC001190595034	1367301872	/nfs/dbraw/zinc/30/18/72/1367301872.db2.gz	MYXJOMQBEOEQCO-LJQANCHMSA-N	0	3	342.458	3.382	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@@H](N(C)C/C=C/c3ccccc3)C2)CCC1	ZINC001190595740	1367302925	/nfs/dbraw/zinc/30/29/25/1367302925.db2.gz	RYNCIDLTMRSJMT-WUTDNEBXSA-N	0	3	336.479	3.426	20	30		EGEDHN
CC[C@H](CC(F)F)C(=O)N1CC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001190614193	1367308402	/nfs/dbraw/zinc/30/84/02/1367308402.db2.gz	WNQHHWQDRUNVQF-SJORKVTESA-N	0	3	349.425	3.272	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@]1(C)CN(CC2CC(C)(C)C2)CCO1	ZINC001108147679	1367309607	/nfs/dbraw/zinc/30/96/07/1367309607.db2.gz	BZDWOJLZGPGVTL-OXJNMPFZSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@]1(C)CN(CC2CCCCC2)CCO1	ZINC001108150534	1367311483	/nfs/dbraw/zinc/31/14/83/1367311483.db2.gz	FAQRONCHPKRYEQ-FXAWDEMLSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2ccc(C)cc2C)C1	ZINC001108377108	1367423954	/nfs/dbraw/zinc/42/39/54/1367423954.db2.gz	WYACCONAVQUWFC-NQIIRXRSSA-N	0	3	344.499	3.479	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)Cc2ccccc2C)C1	ZINC001108390078	1367431220	/nfs/dbraw/zinc/43/12/20/1367431220.db2.gz	SJMGJSGNFUYCQU-WIYYLYMNSA-N	0	3	344.499	3.099	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1c(C)cc(C)cc1C)C2	ZINC001110070183	1367491777	/nfs/dbraw/zinc/49/17/77/1367491777.db2.gz	OFETWEBGDBDIHY-QYZOEREBSA-N	0	3	342.483	3.150	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H]1CCCCC1(C)C)C2	ZINC001110175106	1367545942	/nfs/dbraw/zinc/54/59/42/1367545942.db2.gz	NKJAFAPUOWXUTM-BDXSIMOUSA-N	0	3	334.504	3.127	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](CCC=C)c1ccccc1)C2	ZINC001110214312	1367568531	/nfs/dbraw/zinc/56/85/31/1367568531.db2.gz	DEDBPQNORNJTTK-CGXNFDGLSA-N	0	3	336.479	3.481	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCN(C(=O)CCCC2CC2)C1	ZINC001191858616	1367615293	/nfs/dbraw/zinc/61/52/93/1367615293.db2.gz	BSSQEXQXBBJLJH-LJQANCHMSA-N	0	3	325.456	3.171	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](N(C)Cc2ccc(C)c(OC)c2)C1	ZINC001191859639	1367616528	/nfs/dbraw/zinc/61/65/28/1367616528.db2.gz	OXHUPBJYIZUSPH-IBGZPJMESA-N	0	3	342.483	3.230	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@@H](N(C)CCOc2ccc(F)cc2)C1	ZINC001191891324	1367628486	/nfs/dbraw/zinc/62/84/86/1367628486.db2.gz	XTLGCQUKJMIIDL-FUHWJXTLSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H](N(C)CCOCc2ccccc2)C1	ZINC001191902875	1367631112	/nfs/dbraw/zinc/63/11/12/1367631112.db2.gz	STAHLCGGAZQGQW-AZUAARDMSA-N	0	3	344.499	3.338	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](N(C)Cc2ccc3c(c2)COC3)C1	ZINC001192073431	1367680502	/nfs/dbraw/zinc/68/05/02/1367680502.db2.gz	UAKPVPZKCHHTND-LJQANCHMSA-N	0	3	328.456	3.106	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](N(C)CCOc3ccccc3)C2)CC1	ZINC001192180663	1367708157	/nfs/dbraw/zinc/70/81/57/1367708157.db2.gz	KVUYGCJPYONDJE-IBGZPJMESA-N	0	3	342.483	3.345	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](N(C)CCc3scnc3C)C2)CC1	ZINC001192205234	1367717128	/nfs/dbraw/zinc/71/71/28/1367717128.db2.gz	DFELHFLGQCERJS-MRXNPFEDSA-N	0	3	347.528	3.273	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccc2ncccc2c1	ZINC001109045818	1367737995	/nfs/dbraw/zinc/73/79/95/1367737995.db2.gz	CXHZXUNREMHBMR-HOJAQTOUSA-N	0	3	335.451	3.423	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2C[C@H](OC)c1ccccc1	ZINC001109054895	1367742122	/nfs/dbraw/zinc/74/21/22/1367742122.db2.gz	DYUUUQWCSRKRGN-XWSJACJDSA-N	0	3	328.456	3.062	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cnc([C@@H](C)OC)s1)C2	ZINC001110565564	1367836853	/nfs/dbraw/zinc/83/68/53/1367836853.db2.gz	GFONSBILFDNDID-TUVASFSCSA-N	0	3	349.500	3.152	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@H]2CCC(C)=C(C)C2)C1	ZINC001193201484	1367965170	/nfs/dbraw/zinc/96/51/70/1367965170.db2.gz	JVKHBOAKGIPOKM-IPMKNSEASA-N	0	3	336.520	3.255	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CC1=CCCCC1	ZINC001110863361	1368042880	/nfs/dbraw/zinc/04/28/80/1368042880.db2.gz	GFDDYYIFRUSMPB-WERVVEIQSA-N	0	3	346.515	3.437	20	30		EGEDHN
CCCCCCCCC(=O)N1CC[C@@H](N(C)CCc2ccnn2C)C1	ZINC001193631140	1368079199	/nfs/dbraw/zinc/07/91/99/1368079199.db2.gz	SYGBTPDPINKSNZ-LJQANCHMSA-N	0	3	348.535	3.246	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2ccc3ccccc3c2)C1	ZINC001193664603	1368088970	/nfs/dbraw/zinc/08/89/70/1368088970.db2.gz	XOYNQPDPMGCHAS-HXUWFJFHSA-N	0	3	338.451	3.189	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3CCCOC(C)C)CC1	ZINC001110989867	1368136358	/nfs/dbraw/zinc/13/63/58/1368136358.db2.gz	YYVLZCJAWQGUBW-KURKYZTESA-N	0	3	334.504	3.269	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2C[C@@H]1CC(C)(C)CO1	ZINC001111072595	1368152171	/nfs/dbraw/zinc/15/21/71/1368152171.db2.gz	OAAUCWLNVJWOGV-TWMKSMIVSA-N	0	3	334.504	3.125	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](C)CC1CCCC1)C2	ZINC001111097354	1368158134	/nfs/dbraw/zinc/15/81/34/1368158134.db2.gz	VCWAEOMMLGAIGR-AITUJVMLSA-N	0	3	334.504	3.127	20	30		EGEDHN
C=C[C@@H](C(=O)N1CC[C@H](N(C)CCOCCCC)C1)c1ccccc1	ZINC001194182617	1368201136	/nfs/dbraw/zinc/20/11/36/1368201136.db2.gz	BWBUTYCVTRRCFP-VQTJNVASSA-N	0	3	344.499	3.306	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2sccc2C(C)C)C1	ZINC001194218389	1368211098	/nfs/dbraw/zinc/21/10/98/1368211098.db2.gz	QRUIWBQRCHSAEV-HNNXBMFYSA-N	0	3	336.501	3.220	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)[C@H](CC)c2ccc(F)cc2)C1	ZINC001194324263	1368231097	/nfs/dbraw/zinc/23/10/97/1368231097.db2.gz	BABWFOYCVHYGPI-RTBURBONSA-N	0	3	348.462	3.055	20	30		EGEDHN
C=CCCOCC(=O)N1CC[C@@H](N(C)[C@@H](C)c2cccc(F)c2)C1	ZINC001194396538	1368251421	/nfs/dbraw/zinc/25/14/21/1368251421.db2.gz	FBRKJYPCJQJVCA-MAUKXSAKSA-N	0	3	334.435	3.012	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)CC(C)(C)CC(F)(F)F)C2	ZINC001111325798	1368267002	/nfs/dbraw/zinc/26/70/02/1368267002.db2.gz	VZFNGNHWJDLCEM-MCIONIFRSA-N	0	3	330.394	3.100	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCCOc1cccc(C)c1)C2	ZINC001111356023	1368270981	/nfs/dbraw/zinc/27/09/81/1368270981.db2.gz	KOOSZVUGVPQAEU-RLLQIKCJSA-N	0	3	342.483	3.452	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCc1nc3ccccc3o1)C2	ZINC001111394053	1368289930	/nfs/dbraw/zinc/28/99/30/1368289930.db2.gz	JHBYDCCCCPVSJI-OIISXLGYSA-N	0	3	339.439	3.058	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCc1ccc(Cl)s1)C2	ZINC001111406134	1368301248	/nfs/dbraw/zinc/30/12/48/1368301248.db2.gz	VKTMDUSXYQTEHN-YUELXQCFSA-N	0	3	336.888	3.079	20	30		EGEDHN
C=CC[C@@H](C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCOCC)c1ccccc1	ZINC001111434632	1368306447	/nfs/dbraw/zinc/30/64/47/1368306447.db2.gz	XANNZRJAMGPTAW-WTGUMLROSA-N	0	3	342.483	3.104	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCC(C)(C)c1ccccc1)C2	ZINC001111499634	1368321910	/nfs/dbraw/zinc/32/19/10/1368321910.db2.gz	PZJQDUVWNOEDCV-AQNXPRMDSA-N	0	3	338.495	3.489	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)C[C@@H](NC(=O)CCCC)c1ccccc1O2	ZINC001111529091	1368326828	/nfs/dbraw/zinc/32/68/28/1368326828.db2.gz	DMPQMCHHDNTMAD-NQIIRXRSSA-N	0	3	340.467	3.284	20	30		EGEDHN
CCCCCCCCCCOC(=O)NC1(CO)CCN(C)CC1	ZINC001194929352	1368349691	/nfs/dbraw/zinc/34/96/91/1368349691.db2.gz	AJRNWLJLEVLWAJ-UHFFFAOYSA-N	0	3	328.497	3.310	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CCCN([C@H](C)c2ccccc2)CC1	ZINC001195125361	1368383566	/nfs/dbraw/zinc/38/35/66/1368383566.db2.gz	LATOBUFNMBLFSW-MSOLQXFVSA-N	0	3	330.472	3.263	20	30		EGEDHN
C=CCOCC(=O)N1CCCN(Cc2ccccc2C(C)C)CC1	ZINC001195283528	1368413498	/nfs/dbraw/zinc/41/34/98/1368413498.db2.gz	DLCYMHJLBUURBX-UHFFFAOYSA-N	0	3	330.472	3.047	20	30		EGEDHN
O=C(C#CC1CC1)N[C@]12CCC[C@H]1CN(C/C=C\c1ccccc1)C2	ZINC001111739587	1368436803	/nfs/dbraw/zinc/43/68/03/1368436803.db2.gz	BROJFEXYZLMKCM-OXMSUVNMSA-N	0	3	334.463	3.084	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H](CC)OC2CCCCC2)C1	ZINC001111746354	1368440897	/nfs/dbraw/zinc/44/08/97/1368440897.db2.gz	RLBIPUNDZARSLN-QRFRQXIXSA-N	0	3	334.504	3.271	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@]12CCC[C@H]1CN(CCc1ccns1)C2	ZINC001111850271	1368504131	/nfs/dbraw/zinc/50/41/31/1368504131.db2.gz	HUEXGVLQHQBRNI-BXWFABGCSA-N	0	3	347.528	3.259	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2c(Cl)cnn2C)CC1	ZINC001195866355	1368507417	/nfs/dbraw/zinc/50/74/17/1368507417.db2.gz	YPSRUUGAYUTLTH-UHFFFAOYSA-N	0	3	340.899	3.192	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2c(F)cncc2F)CC1	ZINC001195981759	1368527144	/nfs/dbraw/zinc/52/71/44/1368527144.db2.gz	FDCVSAPTXXOWMR-UHFFFAOYSA-N	0	3	337.414	3.254	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cnn(C)c2CCC)CC1	ZINC001196408680	1368608855	/nfs/dbraw/zinc/60/88/55/1368608855.db2.gz	GAGIHHGXTZTBCT-UHFFFAOYSA-N	0	3	348.535	3.491	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)CC(C)(C)c2ccccc2)C1	ZINC001112007924	1368610749	/nfs/dbraw/zinc/61/07/49/1368610749.db2.gz	KSDHCENQVRXWJV-UGKGYDQZSA-N	0	3	338.495	3.348	20	30		EGEDHN
C=CCCCN1C[C@@H](O)[C@H](NC(=O)[C@@H](CC)CC2CCCCC2)C1	ZINC001196609366	1368647745	/nfs/dbraw/zinc/64/77/45/1368647745.db2.gz	ZFVXGBSUTSHEFF-IPMKNSEASA-N	0	3	336.520	3.111	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)c2ccoc2C(C)C)C[C@H]1C(F)(F)F	ZINC001112213870	1368722163	/nfs/dbraw/zinc/72/21/63/1368722163.db2.gz	FTYUNUBECYPWDW-ZIAGYGMSSA-N	0	3	342.361	3.019	20	30		EGEDHN
C=C(C)CN1CCCN(C(=O)CCCc2ccc(OC)cc2)CC1	ZINC001197022807	1368733183	/nfs/dbraw/zinc/73/31/83/1368733183.db2.gz	XGLNELNJVMXUCU-UHFFFAOYSA-N	0	3	330.472	3.128	20	30		EGEDHN
C=CCCC1(C(=O)N2CCCN(CCC[C@H]3CCOC3)CC2)CC1	ZINC001197062369	1368737614	/nfs/dbraw/zinc/73/76/14/1368737614.db2.gz	PAKPOSKOAHPBHI-SFHVURJKSA-N	0	3	334.504	3.084	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@@H]2CCC[C@]2(CNCc2cscn2)C1	ZINC001112315863	1368761610	/nfs/dbraw/zinc/76/16/10/1368761610.db2.gz	VZXLSNMBQVXAIW-LPHOPBHVSA-N	0	3	345.512	3.055	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2ncc3n2CCCC3)CC1	ZINC001198167184	1368971294	/nfs/dbraw/zinc/97/12/94/1368971294.db2.gz	YHHHCYJXWDMPDH-UHFFFAOYSA-N	0	3	346.519	3.338	20	30		EGEDHN
C=CC[C@H](C(=O)N1CCCN(C[C@@H](CC)OC)CC1)c1ccccc1	ZINC001198197485	1368978450	/nfs/dbraw/zinc/97/84/50/1368978450.db2.gz	OPUIJDJIKAOUMD-UXHICEINSA-N	0	3	344.499	3.306	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)c2ccc(C)cc2C)C1	ZINC001198293235	1368999079	/nfs/dbraw/zinc/99/90/79/1368999079.db2.gz	YMPHCUBZEUAKHQ-RTBURBONSA-N	0	3	332.488	3.049	20	30		EGEDHN
C=CCCOCC(=O)N1CCCN(CC/C=C/c2ccccc2)CC1	ZINC001198330706	1369010033	/nfs/dbraw/zinc/01/00/33/1369010033.db2.gz	PJDYLFQLJJMJGD-KPKJPENVSA-N	0	3	342.483	3.217	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N1CCCN(CC/C=C/c2ccccc2)CC1	ZINC001198342773	1369011787	/nfs/dbraw/zinc/01/17/87/1369011787.db2.gz	AICAVNDWOHAIAX-UBIUBJKMSA-N	0	3	342.483	3.215	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)c1occc1C)c1ccccc1OC	ZINC001198530344	1369054091	/nfs/dbraw/zinc/05/40/91/1369054091.db2.gz	QIYWYLWXMRQBEM-MRXNPFEDSA-N	0	3	328.412	3.233	20	30		EGEDHN
COc1ccccc1[C@H](CNC(=O)[C@@H](C)C#N)NCCCC1CCC1	ZINC001198617801	1369074568	/nfs/dbraw/zinc/07/45/68/1369074568.db2.gz	SPWYBCYBJXZURA-YJBOKZPZSA-N	0	3	343.471	3.182	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)/C=C\C1CC1)c1ccccc1OC	ZINC001198635273	1369077976	/nfs/dbraw/zinc/07/79/76/1369077976.db2.gz	DTDBUVKDBCAXNS-LENZSSGSSA-N	0	3	328.456	3.375	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)c1cc[nH]c1C)c1ccccc1OC	ZINC001198647171	1369080588	/nfs/dbraw/zinc/08/05/88/1369080588.db2.gz	KACLQDYSJPVSPM-SFHVURJKSA-N	0	3	341.455	3.359	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)c1coc(C)n1)c1ccccc1OC	ZINC001198685997	1369090914	/nfs/dbraw/zinc/09/09/14/1369090914.db2.gz	JEBCUPLNUUNZGI-MRXNPFEDSA-N	0	3	343.427	3.019	20	30		EGEDHN
CC#CCCCC(=O)N1CCC([C@@H]2CCCN(CCF)CC2)CC1	ZINC001186597094	1387979627	/nfs/dbraw/zinc/97/96/27/1387979627.db2.gz	FMLFHVKGSAHZAT-GOSISDBHSA-N	0	3	336.495	3.490	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)c1[nH]ccc1C)c1ccccc1OC	ZINC001198706914	1369095837	/nfs/dbraw/zinc/09/58/37/1369095837.db2.gz	ZHCVRXUVBTWSKX-KRWDZBQOSA-N	0	3	341.455	3.359	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)c2ccccc2-c2cn[nH]c2)CC1	ZINC001112936959	1369096631	/nfs/dbraw/zinc/09/66/31/1369096631.db2.gz	JWCSEYQNAHPTRU-INIZCTEOSA-N	0	3	338.455	3.189	20	30		EGEDHN
CC/C=C\CCN[C@H](CNC(=O)C#CC(C)C)c1ccccc1OC	ZINC001198713071	1369097258	/nfs/dbraw/zinc/09/72/58/1369097258.db2.gz	LNZNOVNEHFNJOI-LIXSYLKWSA-N	0	3	342.483	3.458	20	30		EGEDHN
C#CCC1(C(=O)NC[C@H](NCCC)c2ccccc2OC)CCC1	ZINC001198752508	1369105217	/nfs/dbraw/zinc/10/52/17/1369105217.db2.gz	QWLGQTYPTAUGAV-KRWDZBQOSA-N	0	3	328.456	3.046	20	30		EGEDHN
C=CCC[C@H](C)N[C@H](CNC(=O)c1cnco1)c1ccccc1OC	ZINC001198819526	1369121534	/nfs/dbraw/zinc/12/15/34/1369121534.db2.gz	UJWYQWNOXHUOGR-GOEBONIOSA-N	0	3	343.427	3.099	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)[C@@H](CCC)OC)c1ccccc1OC	ZINC001198828018	1369123992	/nfs/dbraw/zinc/12/39/92/1369123992.db2.gz	WJSMUBMEJJCTPX-IEBWSBKVSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@H](CCC)OCC)c1ccccc1OC	ZINC001198857508	1369131302	/nfs/dbraw/zinc/13/13/02/1369131302.db2.gz	QMWOMIOIJBPWED-HKUYNNGSSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)[C@@H]1C[C@H]1C1CC1)c1ccccc1OC	ZINC001198931927	1369152278	/nfs/dbraw/zinc/15/22/78/1369152278.db2.gz	GRYYLLNWSVWALC-OTWHNJEPSA-N	0	3	342.483	3.454	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NC[C@@H](NCCC(C)C)c1ccccc1OC	ZINC001199002786	1369169962	/nfs/dbraw/zinc/16/99/62/1369169962.db2.gz	ZYSIAXYXJNNIIB-FUHWJXTLSA-N	0	3	348.487	3.079	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)Cn2cc(C)c3ccccc32)CC1	ZINC001113424500	1369417817	/nfs/dbraw/zinc/41/78/17/1369417817.db2.gz	CNHUDDMCRLQGGG-GOSISDBHSA-N	0	3	339.483	3.449	20	30		EGEDHN
CCCCCCCN1CCN(C(=O)c2cc(C(F)(F)F)[nH]n2)CC1	ZINC001113429259	1369421287	/nfs/dbraw/zinc/42/12/87/1369421287.db2.gz	RSPWOXXUAVQCRD-UHFFFAOYSA-N	0	3	346.397	3.157	20	30		EGEDHN
CCC(C)(C)CC(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001200759134	1369423850	/nfs/dbraw/zinc/42/38/50/1369423850.db2.gz	QKGVCQXYZHBOQS-UHFFFAOYSA-N	0	3	327.472	3.465	20	30		EGEDHN
C#CCC1(C(=O)N2CCC(NC/C(Cl)=C/Cl)CC2)CCC1	ZINC001201002446	1369464997	/nfs/dbraw/zinc/46/49/97/1369464997.db2.gz	MWDHVGWEGUYOCA-QBFSEMIESA-N	0	3	329.271	3.080	20	30		EGEDHN
CSc1ccc(NC(=S)N2CCC3SC(=O)C=C3C2)cc1	ZINC001201180709	1369491501	/nfs/dbraw/zinc/49/15/01/1369491501.db2.gz	WANVRQWHOCIYEA-CYBMUJFWSA-N	0	3	336.507	3.379	20	30		EGEDHN
CC#CCCCC(=O)N1CCC(NCc2oc(C(C)C)nc2C)CC1	ZINC001202076041	1369681828	/nfs/dbraw/zinc/68/18/28/1369681828.db2.gz	QGVZVDLJJLFPDR-UHFFFAOYSA-N	0	3	345.487	3.381	20	30		EGEDHN
CCC(=O)N[C@H]1C[C@@H](NCC#Cc2ccccc2Cl)C12CCC2	ZINC001202257774	1369724100	/nfs/dbraw/zinc/72/41/00/1369724100.db2.gz	BIXAHZQFBSQZEI-SJORKVTESA-N	0	3	330.859	3.119	20	30		EGEDHN
CC(C)CC(=O)N[C@@H]1C[C@H](NCc2ccc(C#N)cc2F)C12CCC2	ZINC001202340611	1369743169	/nfs/dbraw/zinc/74/31/69/1369743169.db2.gz	KUQHGXBQAWAJNY-ZWKOTPCHSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC(N[C@@H](C)c3cnc(C)cn3)CC2)CC1	ZINC001202365216	1369751457	/nfs/dbraw/zinc/75/14/57/1369751457.db2.gz	LBCNPWIRRFSTMI-INIZCTEOSA-N	0	3	342.487	3.173	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@H](NC(=O)CCC2CC2)C12CCC2	ZINC001202655006	1369839071	/nfs/dbraw/zinc/83/90/71/1369839071.db2.gz	NOSCTUAZWXMTAC-KGLIPLIRSA-N	0	3	341.293	3.102	20	30		EGEDHN
C/C=C(/C)C(=O)N[C@@H]1C[C@H](NCC#Cc2ccc(F)cc2)C12CCC2	ZINC001202722843	1369866743	/nfs/dbraw/zinc/86/67/43/1369866743.db2.gz	BZNAYAZJFXQYGS-PZXAFMGGSA-N	0	3	340.442	3.160	20	30		EGEDHN
C/C=C(\C)C(=O)N[C@@H]1C[C@H](NCC#Cc2ccc(F)cc2)C12CCC2	ZINC001202722837	1369866977	/nfs/dbraw/zinc/86/69/77/1369866977.db2.gz	BZNAYAZJFXQYGS-HZQXIFESSA-N	0	3	340.442	3.160	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1[C@H]2CN(Cc3ccc(CF)cc3)C[C@H]21	ZINC001114328124	1369888602	/nfs/dbraw/zinc/88/86/02/1369888602.db2.gz	IXZCCNZWZYZCHZ-DZFIZOCASA-N	0	3	330.447	3.305	20	30		EGEDHN
Cc1ccc(CN2CC[C@H](NC(=O)Nc3cccc(C#N)c3)C2)cc1	ZINC001202799187	1369897400	/nfs/dbraw/zinc/89/74/00/1369897400.db2.gz	IPSPWXAPWVNSGQ-IBGZPJMESA-N	0	3	334.423	3.263	20	30		EGEDHN
Cc1cc[nH]c1C(=O)N[C@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202824749	1369902575	/nfs/dbraw/zinc/90/25/75/1369902575.db2.gz	SSYRRKKYQYAANO-OALUTQOASA-N	0	3	347.462	3.005	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1C[C@H](NCc2cncs2)C12CCC2	ZINC001202967570	1369939468	/nfs/dbraw/zinc/93/94/68/1369939468.db2.gz	CHAGZQNNOHMJKR-GJZGRUSLSA-N	0	3	333.501	3.262	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1C[C@@H](NCc2c(C)noc2CC)C12CCC2	ZINC001202986112	1369946075	/nfs/dbraw/zinc/94/60/75/1369946075.db2.gz	GSJPBVQNGCNEJY-QZTJIDSGSA-N	0	3	345.487	3.419	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1C[C@H](NCc2c(C)noc2CC)C12CCC2	ZINC001202986113	1369946121	/nfs/dbraw/zinc/94/61/21/1369946121.db2.gz	GSJPBVQNGCNEJY-ROUUACIJSA-N	0	3	345.487	3.419	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1C[C@@H](NCc2oc(C)nc2C)C12CCC2	ZINC001202987809	1369946657	/nfs/dbraw/zinc/94/66/57/1369946657.db2.gz	OUOVYFCEMUCNMC-IAGOWNOFSA-N	0	3	331.460	3.165	20	30		EGEDHN
C=C(Br)CNC1CCN(C(=O)[C@@H](CC)CCC)CC1	ZINC001203098680	1369982813	/nfs/dbraw/zinc/98/28/13/1369982813.db2.gz	CCSZCZWSVZTDLI-ZDUSSCGKSA-N	0	3	331.298	3.302	20	30		EGEDHN
C#CCCCCCC(=O)NC1[C@H]2CN(C/C=C/c3ccccc3)C[C@@H]12	ZINC001114692217	1370029025	/nfs/dbraw/zinc/02/90/25/1370029025.db2.gz	CSIXCXINYMSOTK-ACYLXSKWSA-N	0	3	336.479	3.330	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1C[C@H](NCc2cnc(C)o2)C12CCC2	ZINC001203255650	1370043160	/nfs/dbraw/zinc/04/31/60/1370043160.db2.gz	DHBLYHOWBHYYLF-JKSUJKDBSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1C[C@H](NCc2ccns2)C12CCC2	ZINC001203258295	1370044819	/nfs/dbraw/zinc/04/48/19/1370044819.db2.gz	QXGJIQDRXCOJKC-GJZGRUSLSA-N	0	3	333.501	3.262	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1[C@H]2CN(CCOC3CCCCCC3)C[C@H]21	ZINC001114724576	1370047003	/nfs/dbraw/zinc/04/70/03/1370047003.db2.gz	PGARRUDJKLAHPI-LMCOJAPRSA-N	0	3	348.531	3.375	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1C[C@@H](NCc2c(C)noc2CC)C12CCC2	ZINC001203281512	1370060398	/nfs/dbraw/zinc/06/03/98/1370060398.db2.gz	PWEKYJAPMYOATE-IAGOWNOFSA-N	0	3	345.487	3.275	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1[C@H]2CN(CCOc3cccc(CC)c3)C[C@H]21	ZINC001114759702	1370065605	/nfs/dbraw/zinc/06/56/05/1370065605.db2.gz	NIPTXGSBFKUHLJ-KXTWHKPSSA-N	0	3	342.483	3.031	20	30		EGEDHN
C=CCCC1(C(=O)NC2[C@H]3CN(C/C=C\c4ccccc4)C[C@@H]23)CC1	ZINC001114777111	1370074437	/nfs/dbraw/zinc/07/44/37/1370074437.db2.gz	XNVCIKAROQIUAW-RNEAHLQBSA-N	0	3	336.479	3.493	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)CC(F)(F)C(F)F)C12CCC2	ZINC001203418482	1370117836	/nfs/dbraw/zinc/11/78/36/1370117836.db2.gz	HQEULMTXWFIWNA-VHSXEESVSA-N	0	3	342.764	3.046	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)CC(F)(F)C(F)F)C12CCC2	ZINC001203418480	1370118175	/nfs/dbraw/zinc/11/81/75/1370118175.db2.gz	HQEULMTXWFIWNA-NXEZZACHSA-N	0	3	342.764	3.046	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)CCCc2cccnc2)C12CCC2	ZINC001203554323	1370167839	/nfs/dbraw/zinc/16/78/39/1370167839.db2.gz	BZRCIVYYSGSNBA-DLBZAZTESA-N	0	3	347.890	3.174	20	30		EGEDHN
Cc1ccc(N2C[C@@]3(CCN(Cc4cccc(C#N)c4)C3)CC2=O)cc1	ZINC001203760771	1370253236	/nfs/dbraw/zinc/25/32/36/1370253236.db2.gz	NWJOLDMHNSINED-QFIPXVFZSA-N	0	3	345.446	3.496	20	30		EGEDHN
C=CCO[C@@H]1CO[C@]2(C1)CCCN(Cc1ccc(OC)c(C)c1)C2	ZINC001203896155	1370304716	/nfs/dbraw/zinc/30/47/16/1370304716.db2.gz	HWQFDPWUMRAVFM-ICSRJNTNSA-N	0	3	331.456	3.330	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CN(Cc3ccc(CC)cc3)C2)CC1	ZINC001204174109	1370399805	/nfs/dbraw/zinc/39/98/05/1370399805.db2.gz	VHQDOZTYXZLRNT-UHFFFAOYSA-N	0	3	328.456	3.469	20	30		EGEDHN
O=C(NCC1(NCC#Cc2ccccc2)CCCCC1)c1ccco1	ZINC001115383842	1370421051	/nfs/dbraw/zinc/42/10/51/1370421051.db2.gz	JJLWFZBYBAYLNS-UHFFFAOYSA-N	0	3	336.435	3.354	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3ccc(F)c(Cl)c3)C2)C1=O	ZINC001204282516	1370431023	/nfs/dbraw/zinc/43/10/23/1370431023.db2.gz	URHKPWVWKLBMMU-GOSISDBHSA-N	0	3	336.838	3.480	20	30		EGEDHN
O=C(NCC1(NCC#Cc2ccccc2)CCCCC1)c1ccc[nH]1	ZINC001115403739	1370435150	/nfs/dbraw/zinc/43/51/50/1370435150.db2.gz	HDRCYQFQMLPZPJ-UHFFFAOYSA-N	0	3	335.451	3.089	20	30		EGEDHN
C=CCOc1ccc(CN2CCC3(CCN(CC)C3=O)CC2)cc1	ZINC001204302525	1370437700	/nfs/dbraw/zinc/43/77/00/1370437700.db2.gz	LSIUBFWRALWYFX-UHFFFAOYSA-N	0	3	328.456	3.086	20	30		EGEDHN
COc1ccc(C#N)cc1CNC1(CNC(=O)C(C)C)CCCCC1	ZINC001115412221	1370441278	/nfs/dbraw/zinc/44/12/78/1370441278.db2.gz	ULGGVZWKDYPTET-UHFFFAOYSA-N	0	3	343.471	3.132	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CCN(Cc3ccc(CC)o3)C2)C1	ZINC001204389236	1370463290	/nfs/dbraw/zinc/46/32/90/1370463290.db2.gz	NAZQRZHKFPMXEH-LJQANCHMSA-N	0	3	332.444	3.453	20	30		EGEDHN
Cn1ccc(C(=O)NCC2(NCC#Cc3ccccc3)CCCCC2)c1	ZINC001115482174	1370486941	/nfs/dbraw/zinc/48/69/41/1370486941.db2.gz	WVCCCAPNYSEZKH-UHFFFAOYSA-N	0	3	349.478	3.099	20	30		EGEDHN
CN1CCN(Cc2cccc(Nc3ncc(C#N)cc3Cl)c2)CC1	ZINC001204491890	1370491565	/nfs/dbraw/zinc/49/15/65/1370491565.db2.gz	YRUWYMWXNUKKKN-UHFFFAOYSA-N	0	3	341.846	3.098	20	30		EGEDHN
COc1cc(C#N)cc(Nc2cccc(CN3CCN(C)CC3)c2)c1	ZINC001204573641	1370519616	/nfs/dbraw/zinc/51/96/16/1370519616.db2.gz	CQFSGLRHPZUPJT-UHFFFAOYSA-N	0	3	336.439	3.058	20	30		EGEDHN
N[C@H]1CN(Cc2ccc(C(F)(F)F)cc2C(F)(F)F)C[C@H]1F	ZINC001204821043	1370583754	/nfs/dbraw/zinc/58/37/54/1370583754.db2.gz	YNKYYRMPVBIXHL-MNOVXSKESA-N	0	3	330.247	3.205	20	30		EGEDHN
C=CCCN1C[C@@H](O)[C@H](N(Cc2ccccc2)C(=O)C[C@H](C)CC)C1	ZINC001205133080	1370659531	/nfs/dbraw/zinc/65/95/31/1370659531.db2.gz	YOPZUTJPBUUWDT-MISYRCLQSA-N	0	3	344.499	3.073	20	30		EGEDHN
C=CC(C)(C)CC(=O)N(Cc1ccccc1)[C@@H]1CN(CCC)C[C@H]1O	ZINC001205144307	1370662717	/nfs/dbraw/zinc/66/27/17/1370662717.db2.gz	CGCGQQUECWBBHH-RTBURBONSA-N	0	3	344.499	3.073	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCC1(NCc2cc(C)ncn2)CCCCC1	ZINC001115684969	1370667899	/nfs/dbraw/zinc/66/78/99/1370667899.db2.gz	OZRJODSNPRAJIQ-KRWDZBQOSA-N	0	3	344.503	3.296	20	30		EGEDHN
C=CCC(C)(C)C(=O)N(Cc1ccccc1)[C@@H]1CN(C(C)C)C[C@H]1O	ZINC001205195857	1370676016	/nfs/dbraw/zinc/67/60/16/1370676016.db2.gz	QZGKNZLCHIBYRI-RTBURBONSA-N	0	3	344.499	3.071	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC(CNCc2ocnc2C)CC1	ZINC001205386790	1370739243	/nfs/dbraw/zinc/73/92/43/1370739243.db2.gz	HMISXYWSBHBNKW-UHFFFAOYSA-N	0	3	331.460	3.080	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC(CNCc2csc(C)n2)CC1	ZINC001205397635	1370743762	/nfs/dbraw/zinc/74/37/62/1370743762.db2.gz	FYWQAQZMRBYWKA-UHFFFAOYSA-N	0	3	335.517	3.382	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)CC(C)(C)CC)C[C@H]1c1cccc(F)c1	ZINC001205409754	1370746663	/nfs/dbraw/zinc/74/66/63/1370746663.db2.gz	FBBMGYFKJKKRLN-ZWKOTPCHSA-N	0	3	330.447	3.169	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H]2CCO[C@H](CC)C2)CCCCC1	ZINC001115809191	1370791987	/nfs/dbraw/zinc/79/19/87/1370791987.db2.gz	BLBSQEFJAGOJPD-JKSUJKDBSA-N	0	3	342.911	3.353	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)N1CCC(CNCc2ccccc2C#N)CC1	ZINC001205956062	1370922942	/nfs/dbraw/zinc/92/29/42/1370922942.db2.gz	ZKJIXBVGWDWLBP-DLBZAZTESA-N	0	3	339.483	3.345	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)N1CCC(CNCc2csc(C)n2)CC1	ZINC001205961504	1370923923	/nfs/dbraw/zinc/92/39/23/1370923923.db2.gz	YRSJSSQJJWYJDJ-KBPBESRZSA-N	0	3	335.517	3.238	20	30		EGEDHN
CC(C)Cc1ccc(CN2C[C@@H](C)[C@H](NC(=O)C#CC3CC3)C2)cc1	ZINC001206952072	1371243018	/nfs/dbraw/zinc/24/30/18/1371243018.db2.gz	XCFISQAOYYTIQB-DYESRHJHSA-N	0	3	338.495	3.235	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc3ccccc3c2)C[C@H]1NC(=O)C#CC1CC1	ZINC001206953252	1371243548	/nfs/dbraw/zinc/24/35/48/1371243548.db2.gz	ZBZIDZMVTGITFW-IIBYNOLFSA-N	0	3	332.447	3.190	20	30		EGEDHN
Cc1ccccc1C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001207109742	1371297037	/nfs/dbraw/zinc/29/70/37/1371297037.db2.gz	XZUQDFHNAODMMG-HXUWFJFHSA-N	0	3	332.447	3.241	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CN(Cc2ccccc2N(C)C)C[C@H]1C	ZINC001207158637	1371315786	/nfs/dbraw/zinc/31/57/86/1371315786.db2.gz	VQOXGUKVJILKBD-SJLPKXTDSA-N	0	3	343.515	3.291	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN(Cc2cccc(N(C)C)c2)C[C@H]1C	ZINC001207179174	1371322074	/nfs/dbraw/zinc/32/20/74/1371322074.db2.gz	AQZZIZCIDAFWIB-VQIMIIECSA-N	0	3	329.488	3.045	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN(CC[C@@H]2CC2(Cl)Cl)C[C@H]1C	ZINC001207215210	1371331399	/nfs/dbraw/zinc/33/13/99/1371331399.db2.gz	CRWKSIRLGVEZKF-MGPQQGTHSA-N	0	3	333.303	3.363	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN(C[C@@H](O)c2ccc(CC)cc2)C[C@H]1C	ZINC001207215811	1371331648	/nfs/dbraw/zinc/33/16/48/1371331648.db2.gz	QAUXMLCAUOBFEW-NSISKUIASA-N	0	3	344.499	3.075	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC[C@@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207361715	1371374039	/nfs/dbraw/zinc/37/40/39/1371374039.db2.gz	ACQJIGTZZNHOEL-MAUKXSAKSA-N	0	3	332.875	3.318	20	30		EGEDHN
CC[C@@H](C)N[C@@H](CNC(=O)Nc1sccc1C#N)c1ccco1	ZINC001119831575	1371410987	/nfs/dbraw/zinc/41/09/87/1371410987.db2.gz	YZFAMZTVVZWSML-YPMHNXCESA-N	0	3	332.429	3.464	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)COc2ccsc2)CCCCC1	ZINC001120010136	1371453546	/nfs/dbraw/zinc/45/35/46/1371453546.db2.gz	NLYBBGYLOAADSI-UHFFFAOYSA-N	0	3	342.892	3.288	20	30		EGEDHN
C=CCCCCCN1C[C@@H](C)[C@H](NC(=O)c2snnc2C2CC2)C1	ZINC001207628896	1371458632	/nfs/dbraw/zinc/45/86/32/1371458632.db2.gz	KNVHKIIZVVUZTA-UKRRQHHQSA-N	0	3	348.516	3.212	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H](NCc2ccc(Cl)cc2OC)C1	ZINC001207654140	1371465845	/nfs/dbraw/zinc/46/58/45/1371465845.db2.gz	OGSHZKSLFVBDKZ-MRXNPFEDSA-N	0	3	336.863	3.395	20	30		EGEDHN
CC(C)(C)/C=C\C(=O)N1CCC[C@H](NCc2ccc(C#N)s2)C1	ZINC001207710954	1371482764	/nfs/dbraw/zinc/48/27/64/1371482764.db2.gz	VELVERJPVFTAQK-CKXPSTMWSA-N	0	3	331.485	3.303	20	30		EGEDHN
CCC[C@H](C)C(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207718465	1371485624	/nfs/dbraw/zinc/48/56/24/1371485624.db2.gz	QMBHKCZTZVTNMM-QFBILLFUSA-N	0	3	330.447	3.194	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@@H](NCC#Cc2ccc(Cl)cc2)C1)C1CC1	ZINC001207753957	1371494985	/nfs/dbraw/zinc/49/49/85/1371494985.db2.gz	GVMLUAKRHKECJK-DNVCBOLYSA-N	0	3	344.886	3.318	20	30		EGEDHN
Cc1cc(C)c(C(=O)N2CCC[C@@H](NCC#Cc3ccccc3)C2)o1	ZINC001207765267	1371497840	/nfs/dbraw/zinc/49/78/40/1371497840.db2.gz	ZGNZRRKHCCNEQU-LJQANCHMSA-N	0	3	336.435	3.142	20	30		EGEDHN
C#CCCCCC(=O)N1CCC[C@@H](NCc2ccc(Cl)nc2)C1	ZINC001207860155	1371522907	/nfs/dbraw/zinc/52/29/07/1371522907.db2.gz	HYKLAPPYHLFBNI-MRXNPFEDSA-N	0	3	333.863	3.009	20	30		EGEDHN
C=CCOC[C@@H]1c2c(ncn2C)CCN1C[C@H](C)c1ccccc1	ZINC001207904159	1371532819	/nfs/dbraw/zinc/53/28/19/1371532819.db2.gz	CNKURKKSZAMQNB-QFBILLFUSA-N	0	3	325.456	3.326	20	30		EGEDHN
CC[C@@H](C)CC(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207914709	1371537423	/nfs/dbraw/zinc/53/74/23/1371537423.db2.gz	NMXPYYJFDQVEEI-VQIMIIECSA-N	0	3	330.447	3.194	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)COCCCC)C1	ZINC001120355222	1371544810	/nfs/dbraw/zinc/54/48/10/1371544810.db2.gz	GIQRHPTVJDIBNO-SJORKVTESA-N	0	3	342.911	3.259	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207943601	1371545355	/nfs/dbraw/zinc/54/53/55/1371545355.db2.gz	CBLVVINLRHVUEV-IBGZPJMESA-N	0	3	342.870	3.076	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC[C@@H](NCc2ccccc2OC(C)C)C1	ZINC001207995359	1371562297	/nfs/dbraw/zinc/56/22/97/1371562297.db2.gz	GMXWGYNGLPNOSA-LJQANCHMSA-N	0	3	342.483	3.214	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001208255572	1371686002	/nfs/dbraw/zinc/68/60/02/1371686002.db2.gz	MAEGZRPYBQQLGC-KRWDZBQOSA-N	0	3	329.419	3.134	20	30		EGEDHN
O=C([C@@H]1CCC(F)(F)C1)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001208296090	1371705084	/nfs/dbraw/zinc/70/50/84/1371705084.db2.gz	LWWMDXGUEIMYJP-MSOLQXFVSA-N	0	3	346.421	3.054	20	30		EGEDHN
C#CCC1(C(=O)N2CCC[C@@H](NCc3cc(F)cc(F)c3)C2)CCC1	ZINC001208319673	1371716453	/nfs/dbraw/zinc/71/64/53/1371716453.db2.gz	WVGMETYAQTUAKR-GOSISDBHSA-N	0	3	346.421	3.239	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1CN(Cc2ccc(OC)cc2)C[C@H]1C	ZINC001208393448	1371751961	/nfs/dbraw/zinc/75/19/61/1371751961.db2.gz	QYWUASOUDMUFMJ-GPMSIDNRSA-N	0	3	330.472	3.234	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1)C(C)(C)C	ZINC001208423312	1371762612	/nfs/dbraw/zinc/76/26/12/1371762612.db2.gz	HFBZREAETLBWGU-QFBILLFUSA-N	0	3	344.474	3.440	20	30		EGEDHN
C=CCCC(=O)NC1CC2(CC(NCc3oc(CC)nc3C)C2)C1	ZINC001120819401	1371771593	/nfs/dbraw/zinc/77/15/93/1371771593.db2.gz	XIBHPFAYBCFZBY-UHFFFAOYSA-N	0	3	331.460	3.029	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN(Cc2cccc(N(C)C)c2)C[C@H]1C	ZINC001208452597	1371771851	/nfs/dbraw/zinc/77/18/51/1371771851.db2.gz	UECSGERHJUHWRA-VQIMIIECSA-N	0	3	329.488	3.045	20	30		EGEDHN
C=C(Br)CNC1CC2(C1)CC(NC(=O)/C=C(/C)CC)C2	ZINC001121072589	1371847770	/nfs/dbraw/zinc/84/77/70/1371847770.db2.gz	WHLDLONRVVGDGL-WZUFQYTHSA-N	0	3	341.293	3.268	20	30		EGEDHN
CC(C)C#CC(=O)NC1CC2(CC(NCc3cc(F)ccc3F)C2)C1	ZINC001121076889	1371849495	/nfs/dbraw/zinc/84/94/95/1371849495.db2.gz	GTXWTMNJEGXLSP-UHFFFAOYSA-N	0	3	346.421	3.141	20	30		EGEDHN
C=C(C)CCC(=O)NC1CC2(C1)CC(N[C@@H](C)c1cnc(C)cn1)C2	ZINC001121183866	1371881856	/nfs/dbraw/zinc/88/18/56/1371881856.db2.gz	PMOKYEPRDVWKEB-AKJOHPPZSA-N	0	3	342.487	3.219	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC[C@H](NCc2ccc(Cl)nc2)C1	ZINC001209003355	1371971650	/nfs/dbraw/zinc/97/16/50/1371971650.db2.gz	GRPYXFVSIFYWQD-KRWDZBQOSA-N	0	3	347.890	3.399	20	30		EGEDHN
C=CCN(CCN1CCC[C@H](OCc2ccccc2)C1)C(=O)OCC	ZINC001209022598	1371976567	/nfs/dbraw/zinc/97/65/67/1371976567.db2.gz	NOFVRQDECKHLQL-IBGZPJMESA-N	0	3	346.471	3.312	20	30		EGEDHN
COCCCN1CCC(C#N)(c2ccc(Br)cc2)CC1	ZINC001209051918	1371983613	/nfs/dbraw/zinc/98/36/13/1371983613.db2.gz	LYUIMVAESAYEFH-UHFFFAOYSA-N	0	3	337.261	3.343	20	30		EGEDHN
CC#CCCCC(=O)NC1CC2(CC(NCc3nc(C)cs3)C2)C1	ZINC001121580227	1372015407	/nfs/dbraw/zinc/01/54/07/1372015407.db2.gz	HVUDWHWMXYYWCX-UHFFFAOYSA-N	0	3	345.512	3.162	20	30		EGEDHN
C=CCn1c(CCCCC#N)nnc1N1CCN(C(C)(C)CC)CC1	ZINC001121592358	1372018561	/nfs/dbraw/zinc/01/85/61/1372018561.db2.gz	KUMAIDNPVAGHNU-UHFFFAOYSA-N	0	3	344.507	3.011	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC[C@@H](NCc2cc(CO)ccc2F)C1	ZINC001209183785	1372028813	/nfs/dbraw/zinc/02/88/13/1372028813.db2.gz	PVNIRQRHIGGAAC-MAUKXSAKSA-N	0	3	348.462	3.001	20	30		EGEDHN
CC1(C)CC(CC(=O)N2CCC[C@H](NCC#Cc3ccccc3)C2)C1	ZINC001209212854	1372040001	/nfs/dbraw/zinc/04/00/01/1372040001.db2.gz	HNFPKTXEOZVENQ-FQEVSTJZSA-N	0	3	338.495	3.445	20	30		EGEDHN
C=CCC1(C(=O)NC2CC3(CC(NCc4conc4C)C3)C2)CCC1	ZINC001121713341	1372056016	/nfs/dbraw/zinc/05/60/16/1372056016.db2.gz	GTMZISJCBDJEBJ-UHFFFAOYSA-N	0	3	343.471	3.246	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC1CC2(CC(NCc3conc3C)C2)C1	ZINC001121713377	1372056170	/nfs/dbraw/zinc/05/61/70/1372056170.db2.gz	HVJSPQIFDSDEQZ-VCCMTOOWSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC1CC2(C1)CC(N[C@@H](C)c1cnccn1)C2	ZINC001121714067	1372057034	/nfs/dbraw/zinc/05/70/34/1372057034.db2.gz	USNUAFNFFHZPDG-FAJZIOONSA-N	0	3	342.487	3.157	20	30		EGEDHN
C=CCn1c(C2CCN(C)CC2)nnc1N(CCC#N)CCC(C)C	ZINC001121715196	1372057723	/nfs/dbraw/zinc/05/77/23/1372057723.db2.gz	SUWKHEZVPCBZIP-UHFFFAOYSA-N	0	3	344.507	3.039	20	30		EGEDHN
C=CCCCCCCN1CCN(C(=O)OC(C)(C)C)C[C@H](O)C1	ZINC001209431095	1372104728	/nfs/dbraw/zinc/10/47/28/1372104728.db2.gz	HFGWIDRRSDBVIN-MRXNPFEDSA-N	0	3	326.481	3.037	20	30		EGEDHN
C=CCCCCCCN1C[C@H]2C[C@H](C(=O)NCc3ccco3)[C@@H](C1)O2	ZINC001209437892	1372106260	/nfs/dbraw/zinc/10/62/60/1372106260.db2.gz	YEIGJFLCBTWUJW-CEXWTWQISA-N	0	3	346.471	3.122	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)NCCc1nc2cc(Cl)ccc2s1	ZINC001121912426	1372121231	/nfs/dbraw/zinc/12/12/31/1372121231.db2.gz	IFKDDEZJMMTPGL-LBPRGKRZSA-N	0	3	337.876	3.292	20	30		EGEDHN
C=CCC1(C(=O)N2CCC[C@H](NCc3scnc3C)C2)CCC1	ZINC001209504006	1372122384	/nfs/dbraw/zinc/12/23/84/1372122384.db2.gz	OOEDHFAJHDQESF-HNNXBMFYSA-N	0	3	333.501	3.279	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N1CCC(OCc2ccc(F)cc2)CC1	ZINC001122041569	1372159826	/nfs/dbraw/zinc/15/98/26/1372159826.db2.gz	RCDXOJNHPBVLMR-GOSISDBHSA-N	0	3	334.435	3.017	20	30		EGEDHN
O=C([C@H]1CC12CC2)N1CCC[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001209807281	1372203890	/nfs/dbraw/zinc/20/38/90/1372203890.db2.gz	DEIRUHJPXKNXBM-ZWKOTPCHSA-N	0	3	342.870	3.072	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(SC(F)F)cc1)C(=O)[C@@H]1C[C@H]1F	ZINC001122449670	1372249943	/nfs/dbraw/zinc/24/99/43/1372249943.db2.gz	VOQAQTUGTYULBI-OUAUKWLOSA-N	0	3	328.315	3.007	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CCCN(C)C2)nnc1N1C[C@H](C)[C@H](C)[C@H]1C	ZINC001122544007	1372271242	/nfs/dbraw/zinc/27/12/42/1372271242.db2.gz	QXWGFUAUUKLLDX-NXOAAHMSSA-N	0	3	331.508	3.144	20	30		EGEDHN
C[C@@H](CC(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1)n1cccc1	ZINC001210736019	1372416415	/nfs/dbraw/zinc/41/64/15/1372416415.db2.gz	HNEHWBVHXUMPMA-FPOVZHCZSA-N	0	3	349.478	3.072	20	30		EGEDHN
C=CCC[C@@H]1CCCN1C(=O)NC1CCN(CCOC(C)C)CC1	ZINC001123515909	1372494063	/nfs/dbraw/zinc/49/40/63/1372494063.db2.gz	XDHUONYMDHEBDX-GOSISDBHSA-N	0	3	337.508	3.016	20	30		EGEDHN
C=CCC1(C(=O)N2CCC[C@@H](NCc3cnn(C)c3)C2)CCCCC1	ZINC001211213729	1372504223	/nfs/dbraw/zinc/50/42/23/1372504223.db2.gz	RYJOHEHKXQMKFU-GOSISDBHSA-N	0	3	344.503	3.027	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1C[C@@H](c2ccccc2)[C@H](NC/C=C/Cl)C1	ZINC001211598911	1372588486	/nfs/dbraw/zinc/58/84/86/1372588486.db2.gz	ODHRXFOIIRDMDF-WJRNRCBFSA-N	0	3	344.886	3.373	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C2(C3CC3)CCC2)C[C@H]1c1ccccc1	ZINC001211640504	1372594321	/nfs/dbraw/zinc/59/43/21/1372594321.db2.gz	WYGFKZFRLANMBO-VQTJNVASSA-N	0	3	336.479	3.174	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C2(F)CCCCC2)C[C@H]1c1ccccc1	ZINC001211700454	1372604253	/nfs/dbraw/zinc/60/42/53/1372604253.db2.gz	BTWDKCLNGOAJRW-RBUKOAKNSA-N	0	3	342.458	3.266	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)/C=C\c2ccco2)[C@H](OC)C1	ZINC001211786838	1372615301	/nfs/dbraw/zinc/61/53/01/1372615301.db2.gz	AOLUXLPJIJHUOX-QAZIKRLUSA-N	0	3	334.460	3.079	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)CCC(F)(F)F)[C@H](OC)C1	ZINC001212084998	1372654482	/nfs/dbraw/zinc/65/44/82/1372654482.db2.gz	LBQLKFOVVTWBHN-ZIAGYGMSSA-N	0	3	338.414	3.115	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NCCNCc1cc(Cl)cc(Cl)c1	ZINC001124488894	1372706232	/nfs/dbraw/zinc/70/62/32/1372706232.db2.gz	VXQRXTLHOVJSRK-LBPRGKRZSA-N	0	3	345.270	3.180	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)Cc2ccc(C)cc2)[C@H](OC)C1	ZINC001213134788	1372846862	/nfs/dbraw/zinc/84/68/62/1372846862.db2.gz	HZNSDAWYQPYDPL-WOJBJXKFSA-N	0	3	344.499	3.099	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)C(C)(C)C2CCC2)[C@H](OC)C1	ZINC001213223950	1372863488	/nfs/dbraw/zinc/86/34/88/1372863488.db2.gz	GQYLPEFJOUHAGQ-QZTJIDSGSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CN([C@@H]2CCc3ccccc32)C[C@H]1OC	ZINC001213260712	1372870134	/nfs/dbraw/zinc/87/01/34/1372870134.db2.gz	PZFKQXVOBNEPSH-GUDVDZBRSA-N	0	3	342.483	3.092	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1CN(CCCC2CCCC2)C[C@H]1OC	ZINC001213269138	1372871841	/nfs/dbraw/zinc/87/18/41/1372871841.db2.gz	AWOYXRNVHDOMMO-WOJBJXKFSA-N	0	3	348.531	3.356	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2cc[nH]c2CCC)[C@H](OC)C1	ZINC001213312887	1372881697	/nfs/dbraw/zinc/88/16/97/1372881697.db2.gz	WGMYCVADKBDITQ-RTBURBONSA-N	0	3	347.503	3.143	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)[C@@H](CCC)CC2CCCC2)[C@H](OC)C1	ZINC001213525199	1372920052	/nfs/dbraw/zinc/92/00/52/1372920052.db2.gz	WBRRUEIRUCPYPB-IPMKNSEASA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2cc(C(C)C)oc2C)[C@H](OC)C1	ZINC001213655453	1372940643	/nfs/dbraw/zinc/94/06/43/1372940643.db2.gz	QEEGYFGTSPCZLX-SJLPKXTDSA-N	0	3	334.460	3.107	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)C[C@H](c2ccccc2)C(C)C)[C@H](OC)C1	ZINC001213706357	1372948026	/nfs/dbraw/zinc/94/80/26/1372948026.db2.gz	CBFXJGXMRSEJEZ-XUVXKRRUSA-N	0	3	344.499	3.208	20	30		EGEDHN
CC[C@@H](C)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001214156446	1373016558	/nfs/dbraw/zinc/01/65/58/1373016558.db2.gz	STXODDLFLLJRLT-IIDMSEBBSA-N	0	3	332.875	3.174	20	30		EGEDHN
CCCCC(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001214162185	1373017761	/nfs/dbraw/zinc/01/77/61/1373017761.db2.gz	ZZVJBUSOOGDBGE-CRAIPNDOSA-N	0	3	332.875	3.318	20	30		EGEDHN
CCC[C@@H](C)CC(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001214296477	1373039374	/nfs/dbraw/zinc/03/93/74/1373039374.db2.gz	JCDMWCICXPDGGT-MBOZVWFJSA-N	0	3	344.474	3.440	20	30		EGEDHN
C[C@@H]1CN(C(=O)/C=C\C(C)(C)C)C[C@H]1NCc1ccc(C#N)c(F)c1	ZINC001214356003	1373048738	/nfs/dbraw/zinc/04/87/38/1373048738.db2.gz	LXFZXSUKJIDGEH-IEHAEYMASA-N	0	3	343.446	3.236	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2=CCCC2)C[C@H]1NCC#Cc1ccccc1Cl	ZINC001214430993	1373059538	/nfs/dbraw/zinc/05/95/38/1373059538.db2.gz	HIIDRDOOFMTWCG-DNVCBOLYSA-N	0	3	342.870	3.238	20	30		EGEDHN
C=CCn1cccc1C(=O)N1C[C@@H](C)[C@H](NCC=C(Cl)Cl)C1	ZINC001214861390	1373131675	/nfs/dbraw/zinc/13/16/75/1373131675.db2.gz	SOIDSKVQTFGYTN-CHWSQXEVSA-N	0	3	342.270	3.043	20	30		EGEDHN
CC1=C(C)C[C@H](C(=O)NCCNCc2ccc(C#N)c(F)c2)CC1	ZINC001128031601	1373210748	/nfs/dbraw/zinc/21/07/48/1373210748.db2.gz	WRSLQEZEDDBFEZ-MRXNPFEDSA-N	0	3	329.419	3.040	20	30		EGEDHN
CCC(CC)CC(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2)C1	ZINC001216086436	1373260757	/nfs/dbraw/zinc/26/07/57/1373260757.db2.gz	WUITXHBTBJSJGM-YLJYHZDGSA-N	0	3	326.484	3.301	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](C)[C@H](NCc3ccccn3)C2)CCCC1	ZINC001217105286	1373387935	/nfs/dbraw/zinc/38/79/35/1373387935.db2.gz	FSTVTYDXPNWPEI-SJLPKXTDSA-N	0	3	327.472	3.155	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)/C=C\c3ccco3)[C@H]2C1	ZINC001217196345	1373403519	/nfs/dbraw/zinc/40/35/19/1373403519.db2.gz	MFDCSHVMFQVMRT-APFRWWSVSA-N	0	3	346.471	3.175	20	30		EGEDHN
CC[C@H]1CCC[C@@]1(C)C(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001130258932	1373479999	/nfs/dbraw/zinc/47/99/99/1373479999.db2.gz	SKQWCQZAEBCFKC-QFBILLFUSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)[C@H](CC)CCCC)C1	ZINC001130350996	1373500556	/nfs/dbraw/zinc/50/05/56/1373500556.db2.gz	BGQHDUVMJRWTFG-HZPDHXFCSA-N	0	3	332.492	3.218	20	30		EGEDHN
Cc1ccc(C#N)cc1C(=O)N[C@]1(C)CCN(Cc2ccccc2)C1	ZINC001130393592	1373517635	/nfs/dbraw/zinc/51/76/35/1373517635.db2.gz	SGROSNXMXGEMNL-OAQYLSRUSA-N	0	3	333.435	3.261	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)C2(CC(C)C)CCC2)C1	ZINC001130402104	1373521710	/nfs/dbraw/zinc/52/17/10/1373521710.db2.gz	WAFLLBLFENKAFY-MRXNPFEDSA-N	0	3	344.503	3.218	20	30		EGEDHN
Cc1c(F)ccc(Cl)c1C(=O)NCCNCc1cccc(C#N)c1	ZINC001130558576	1373559481	/nfs/dbraw/zinc/55/94/81/1373559481.db2.gz	FRUAZWDENLSKHD-UHFFFAOYSA-N	0	3	345.805	3.179	20	30		EGEDHN
O=C(/C=C\c1ccc(O[C@@H]2CC[C@@H]3NCCO[C@@H]23)cc1)c1ccccc1	ZINC001218127544	1373566177	/nfs/dbraw/zinc/56/61/77/1373566177.db2.gz	SKXTVYITAQPFAM-XBOZKJBZSA-N	0	3	349.430	3.481	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)[C@@H]3CCCC34CC4)[C@H]2C1	ZINC001218169161	1373572337	/nfs/dbraw/zinc/57/23/37/1373572337.db2.gz	YFCLNICZIAOREM-GBESFXJTSA-N	0	3	346.515	3.225	20	30		EGEDHN
C=C(C)CN1C[C@H](OC)C[C@H]1Cn1ccc(NC(=O)CCCCC)n1	ZINC001130877921	1373601525	/nfs/dbraw/zinc/60/15/25/1373601525.db2.gz	OHSZLBIXCSCZFJ-DLBZAZTESA-N	0	3	348.491	3.067	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCO[C@@H]2CN(CC/C=C/CCC)C[C@@H]21	ZINC001218516523	1373627665	/nfs/dbraw/zinc/62/76/65/1373627665.db2.gz	DCLGWVJBBWVHDQ-PEEKWUTASA-N	0	3	334.504	3.247	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)[C@@H](C)CC3CCCC3)[C@H]2C1	ZINC001218715752	1373646905	/nfs/dbraw/zinc/64/69/05/1373646905.db2.gz	KXZUVEDNWXDVTC-YTQUADARSA-N	0	3	334.504	3.081	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)Cc2ccc(C(F)F)cc2)s1	ZINC001131260135	1373671067	/nfs/dbraw/zinc/67/10/67/1373671067.db2.gz	QBBQPKWIYGOWEK-UHFFFAOYSA-N	0	3	349.406	3.006	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2OCCN(C(=O)c3ccc(C)cc3C)[C@H]2C1	ZINC001219014814	1373679921	/nfs/dbraw/zinc/67/99/21/1373679921.db2.gz	UJOJBVQQLIIFQK-YSIASYRMSA-N	0	3	342.483	3.183	20	30		EGEDHN
CCc1cc(NC(=O)[C@@H](N)C2Cc3ccccc3C2)cc(CC)c1C#N	ZINC001219112502	1373687302	/nfs/dbraw/zinc/68/73/02/1373687302.db2.gz	JRXPJNSAELFOSR-NRFANRHFSA-N	0	3	347.462	3.364	20	30		EGEDHN
C=CCCC(=O)N1C[C@H](C)O[C@]2(CCN(Cc3ccc(C)cc3)C2)C1	ZINC001131645605	1373741103	/nfs/dbraw/zinc/74/11/03/1373741103.db2.gz	HSNVVIAKHFTGPJ-RXVVDRJESA-N	0	3	342.483	3.153	20	30		EGEDHN
C=CCCC(=O)N1C[C@H](C)O[C@]2(CCN(Cc3cccc(C)c3)C2)C1	ZINC001131645162	1373741316	/nfs/dbraw/zinc/74/13/16/1373741316.db2.gz	BYNJRWXWRHVMAV-RXVVDRJESA-N	0	3	342.483	3.153	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)[C@H]2CCCC[C@H]2C2CC2)ccc1F	ZINC001131743408	1373782004	/nfs/dbraw/zinc/78/20/04/1373782004.db2.gz	ZGPOBUFQCULQTJ-ROUUACIJSA-N	0	3	343.446	3.120	20	30		EGEDHN
C=CCCCCCN1CC[C@@H]2CN(C(=O)c3oc(CC)nc3C)[C@@H]2C1	ZINC001221918528	1373803238	/nfs/dbraw/zinc/80/32/38/1373803238.db2.gz	NYINSEIPDYFSNL-IAGOWNOFSA-N	0	3	345.487	3.438	20	30		EGEDHN
C=CCCCCCN1CC[C@@H]2CN(C(=O)c3cc(CC)on3)[C@@H]2C1	ZINC001221954236	1373808093	/nfs/dbraw/zinc/80/80/93/1373808093.db2.gz	FGILKOPVCYUAQW-CRAIPNDOSA-N	0	3	331.460	3.130	20	30		EGEDHN
CC[C@@H](SC)C(=O)NCC1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001222857279	1373890347	/nfs/dbraw/zinc/89/03/47/1373890347.db2.gz	XXFUGMGHOPMGPE-GOSISDBHSA-N	0	3	345.512	3.028	20	30		EGEDHN
C[NH+]1CCC(c2ccc(C(=O)Nc3ccc([O-])c(C#N)c3)cc2)CC1	ZINC001188315392	1388288784	/nfs/dbraw/zinc/28/87/84/1388288784.db2.gz	AILKHVWIHDLXJI-UHFFFAOYSA-N	0	3	335.407	3.325	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC[C@H](C)N(CCOCc2ccccc2)C1	ZINC001131896543	1375032562	/nfs/dbraw/zinc/03/25/62/1375032562.db2.gz	TVGVXYRZXNTINV-HKUYNNGSSA-N	0	3	330.472	3.139	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@@H](C)N(Cc2ccc(OC)c(C)c2)C1	ZINC001131894657	1375032774	/nfs/dbraw/zinc/03/27/74/1375032774.db2.gz	BALRJZMLWXJTCY-SJLPKXTDSA-N	0	3	330.472	3.439	20	30		EGEDHN
CCCCCCCN1C[C@H](NC(=O)c2cc(OC)no2)CC[C@@H]1C	ZINC001131981429	1375080802	/nfs/dbraw/zinc/08/08/02/1375080802.db2.gz	WGZOJAHZKYGAJC-LSDHHAIUSA-N	0	3	337.464	3.236	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1CC[C@@H](C)N(Cc2ccc3cc[nH]c3c2)C1	ZINC001132021672	1375102089	/nfs/dbraw/zinc/10/20/89/1375102089.db2.gz	OANOTWTUODBPKE-VQIMIIECSA-N	0	3	337.467	3.296	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1CC[C@H](C)N(Cc2ccc3cc[nH]c3c2)C1	ZINC001132021671	1375102628	/nfs/dbraw/zinc/10/26/28/1375102628.db2.gz	OANOTWTUODBPKE-QFBILLFUSA-N	0	3	337.467	3.296	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1CC[C@@H](C)N(CCCc2cccc(F)c2)C1	ZINC001132022236	1375103789	/nfs/dbraw/zinc/10/37/89/1375103789.db2.gz	WZEFDUPVORGZDD-YLJYHZDGSA-N	0	3	344.474	3.387	20	30		EGEDHN
C[C@H]1CC[C@H](NC(=O)C#CC(C)(C)C)CN1CCc1cccs1	ZINC001132039320	1375111544	/nfs/dbraw/zinc/11/15/44/1375111544.db2.gz	YGZMSNKCQFZMTB-HOTGVXAUSA-N	0	3	332.513	3.309	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COc2cc(C)ccc2F)CC[C@@H]1C	ZINC001132041754	1375112796	/nfs/dbraw/zinc/11/27/96/1375112796.db2.gz	KEZOVIIDHFIXSN-JKSUJKDBSA-N	0	3	334.435	3.058	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@@H]2CCCC[C@H]2NC(=O)/C=C/C2CC2)c1	ZINC001225569230	1375126156	/nfs/dbraw/zinc/12/61/56/1375126156.db2.gz	HZXUDOTZGFBKBG-HLKZIGTNSA-N	0	3	341.430	3.181	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CC[C@@H](C)N(Cc2ccc(CO)cc2)C1	ZINC001132073360	1375134236	/nfs/dbraw/zinc/13/42/36/1375134236.db2.gz	VHKJINGNYJHUMH-VQIMIIECSA-N	0	3	330.472	3.004	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NCC1CCN(Cc2ccc(C)c(F)c2)CC1	ZINC001225632165	1375135930	/nfs/dbraw/zinc/13/59/30/1375135930.db2.gz	ZBEPWPCIBVVZLW-INIZCTEOSA-N	0	3	348.462	3.053	20	30		EGEDHN
C#CCC1(C(=O)N[C@H]2CC[C@H](C)N(CCOCCC(C)C)C2)CCC1	ZINC001132101780	1375148503	/nfs/dbraw/zinc/14/85/03/1375148503.db2.gz	OITSPYVPUCVRNB-OALUTQOASA-N	0	3	348.531	3.212	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2sc3nccn3c2C)CC[C@H]1C	ZINC001132116870	1375157104	/nfs/dbraw/zinc/15/71/04/1375157104.db2.gz	XIJFOSUTIFPKKG-HIFRSBDPSA-N	0	3	346.500	3.253	20	30		EGEDHN
CC/C=C(\C)C(=O)NC1CCN(Cc2ccc(OCC#N)cc2)CC1	ZINC001226369814	1375247897	/nfs/dbraw/zinc/24/78/97/1375247897.db2.gz	QZOPIUKZDAZZHD-AYSLTRBKSA-N	0	3	341.455	3.026	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCCc2ccc(OC)cc2)CC[C@@H]1C	ZINC001132265591	1375255797	/nfs/dbraw/zinc/25/57/97/1375255797.db2.gz	PGRIKOZKFFPFBO-WMZOPIPTSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2ccc(C=C)cc2)CC[C@H]1C	ZINC001132310605	1375288578	/nfs/dbraw/zinc/28/85/78/1375288578.db2.gz	LYNRRZWGQSXDQC-APWZRJJASA-N	0	3	328.456	3.115	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1CC[C@H](C)N(CCc2cnn(CC)c2)C1	ZINC001132330566	1375310499	/nfs/dbraw/zinc/31/04/99/1375310499.db2.gz	JFUBMMYONNNKJN-WMZOPIPTSA-N	0	3	346.519	3.017	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)C23CCC(CC2)C3(C)C)CC[C@H]1C	ZINC001132340192	1375319499	/nfs/dbraw/zinc/31/94/99/1375319499.db2.gz	OLCSHRPGJWPNFW-BXAPWLEFSA-N	0	3	348.531	3.375	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2(Cc3ccccc3F)CC2)CC[C@@H]1C	ZINC001132346195	1375324462	/nfs/dbraw/zinc/32/44/62/1375324462.db2.gz	VXAXVICVFBQLTM-FUHWJXTLSA-N	0	3	342.458	3.141	20	30		EGEDHN
C=CCOCCCC(=O)NC1CCN(Cc2cc(F)ccc2C)CC1	ZINC001226759951	1375326988	/nfs/dbraw/zinc/32/69/88/1375326988.db2.gz	IADSLSGCKBQXNC-UHFFFAOYSA-N	0	3	348.462	3.198	20	30		EGEDHN
CCCCCCCCCCC(=O)N[C@H]1CC[C@@H](C)N(CCO)C1	ZINC001132435981	1375380823	/nfs/dbraw/zinc/38/08/23/1375380823.db2.gz	IJNMCQCVXVIZLU-MSOLQXFVSA-N	0	3	326.525	3.479	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2cccc(C)c2C)CC[C@H]1C	ZINC001132458526	1375401160	/nfs/dbraw/zinc/40/11/60/1375401160.db2.gz	WEPLTTSAEPJJQA-SJLPKXTDSA-N	0	3	330.472	3.089	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COc2ccc3c(c2)CCC3)CC[C@@H]1C	ZINC001132462049	1375404530	/nfs/dbraw/zinc/40/45/30/1375404530.db2.gz	VLYKXVKEQPLAEJ-QFBILLFUSA-N	0	3	342.483	3.099	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCc2c[nH]c3ccccc23)CC[C@H]1C	ZINC001132463911	1375406272	/nfs/dbraw/zinc/40/62/72/1375406272.db2.gz	JZDNHKVGFVICEL-NVXWUHKLSA-N	0	3	325.456	3.256	20	30		EGEDHN
C[C@H]1CCCC[C@@H]1OCCN1CCC(NC(=O)C#CC(C)(C)C)CC1	ZINC001227243824	1375410934	/nfs/dbraw/zinc/41/09/34/1375410934.db2.gz	CUGYALDQKAFJJR-HKUYNNGSSA-N	0	3	348.531	3.212	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)Cc2ccc(C)c(C)c2)CC[C@@H]1C	ZINC001132469790	1375411171	/nfs/dbraw/zinc/41/11/71/1375411171.db2.gz	WMIIRVYOCOLWRY-ICSRJNTNSA-N	0	3	344.499	3.018	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COc2ccccc2CC)CC[C@H]1C	ZINC001132472733	1375412879	/nfs/dbraw/zinc/41/28/79/1375412879.db2.gz	LIAPKJSBWMMSHE-SJLPKXTDSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCOc2cc(C)ccc2C)CC[C@H]1C	ZINC001132472464	1375413564	/nfs/dbraw/zinc/41/35/64/1375413564.db2.gz	HIVOBQPKCYPPAQ-QZTJIDSGSA-N	0	3	330.472	3.227	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COc2cc(C)ccc2C)CC[C@@H]1C	ZINC001132498998	1375426612	/nfs/dbraw/zinc/42/66/12/1375426612.db2.gz	ACSNERDQSZBDNP-ZWKOTPCHSA-N	0	3	330.472	3.227	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCOc2cccc(OC)c2)CC[C@H]1C	ZINC001132521663	1375438020	/nfs/dbraw/zinc/43/80/20/1375438020.db2.gz	GWGBVHBHZNWBON-IAGOWNOFSA-N	0	3	346.471	3.009	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2cccc(C3CC3)c2)CC[C@@H]1C	ZINC001132522971	1375439845	/nfs/dbraw/zinc/43/98/45/1375439845.db2.gz	VVKNWMSRFQQRNJ-OXJNMPFZSA-N	0	3	342.483	3.349	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1CC[C@@H](C)N(Cc2ccc(CF)cc2)C1	ZINC001132529120	1375443637	/nfs/dbraw/zinc/44/36/37/1375443637.db2.gz	IUNRCFKODPHRQO-VQIMIIECSA-N	0	3	348.462	3.218	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1CC[C@@H](C)N(Cc2ccccc2C)C1	ZINC001132530326	1375444249	/nfs/dbraw/zinc/44/42/49/1375444249.db2.gz	WQZCJHNZSMSQIC-IEBWSBKVSA-N	0	3	330.472	3.057	20	30		EGEDHN
CC1(CC(=O)N[C@@H]2CCCC[C@H]2NCC#Cc2ccc(F)cc2)CC1	ZINC001227603403	1375451600	/nfs/dbraw/zinc/45/16/00/1375451600.db2.gz	PMSLETPWEYGWHO-RTBURBONSA-N	0	3	342.458	3.384	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)C2(CC=C)CCCC2)CC[C@@H]1C	ZINC001132547148	1375454721	/nfs/dbraw/zinc/45/47/21/1375454721.db2.gz	XRCNGVXDULIJFW-ZWKOTPCHSA-N	0	3	334.504	3.295	20	30		EGEDHN
C#CCN1CC[C@@H](CN(Cc2scnc2C)C(=O)C[C@@H](C)CC)C1	ZINC001132557806	1375463725	/nfs/dbraw/zinc/46/37/25/1375463725.db2.gz	DOIUTUYEJAQMIK-DOTOQJQBSA-N	0	3	347.528	3.171	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCNCc1csc(Br)c1	ZINC001132577475	1375473863	/nfs/dbraw/zinc/47/38/63/1375473863.db2.gz	WFBORLRUDJXBEL-QWRGUYRKSA-N	0	3	345.306	3.175	20	30		EGEDHN
CC[C@H](C#CC(=O)OC)Oc1ccc2ccccc2c1CN(C)C	ZINC001228442682	1375572388	/nfs/dbraw/zinc/57/23/88/1375572388.db2.gz	WDZIBBBWHVWDJZ-MRXNPFEDSA-N	0	3	325.408	3.235	20	30		EGEDHN
Cc1cnc(CNC[C@@H]2CN(C(=O)C#CC(C)(C)C)CC[C@H]2C)s1	ZINC001132820409	1375583399	/nfs/dbraw/zinc/58/33/99/1375583399.db2.gz	VFWNFZQIAWPOEE-GDBMZVCRSA-N	0	3	347.528	3.075	20	30		EGEDHN
C=CCCCC(=O)NC1CCN(Cc2ccc3c(c2)COC3)CC1	ZINC001228927720	1375717743	/nfs/dbraw/zinc/71/77/43/1375717743.db2.gz	KJKVWSFWVUHUDQ-UHFFFAOYSA-N	0	3	328.456	3.154	20	30		EGEDHN
COc1cc2c(Cl)c(C#N)cnc2cc1O[C@H]1CN2CCC1CC2	ZINC001229106439	1375765210	/nfs/dbraw/zinc/76/52/10/1375765210.db2.gz	NPJXTPFDEKTYJR-KRWDZBQOSA-N	0	3	343.814	3.241	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](C)[C@@H](CNCc3cnc(C)o3)C2)CCC1	ZINC001133104787	1375777292	/nfs/dbraw/zinc/77/72/92/1375777292.db2.gz	KCYFOESLJPQXCD-WBVHZDCISA-N	0	3	345.487	3.304	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2cc(F)c(Cl)cc2F)c1	ZINC001133118043	1375785918	/nfs/dbraw/zinc/78/59/18/1375785918.db2.gz	DATGJLVVMJDMBD-UHFFFAOYSA-N	0	3	349.768	3.009	20	30		EGEDHN
C[C@H](C(=O)NCCNCc1ccc(C#N)cc1)c1ccc(Cl)cc1	ZINC001133244720	1375864615	/nfs/dbraw/zinc/86/46/15/1375864615.db2.gz	MKEBSTHHFLYAPH-AWEZNQCLSA-N	0	3	341.842	3.221	20	30		EGEDHN
C=C1CCC(C(=O)NCCNCc2ccc(OC)c(Cl)c2)CC1	ZINC001133365597	1375948112	/nfs/dbraw/zinc/94/81/12/1375948112.db2.gz	YCNLBUQQTWJZHU-UHFFFAOYSA-N	0	3	336.863	3.301	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCNCc1csc(Br)c1	ZINC001133382995	1375964692	/nfs/dbraw/zinc/96/46/92/1375964692.db2.gz	FKKIHIHJQHJMFZ-CQSZACIVSA-N	0	3	345.306	3.319	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C[C@@H](C)SC	ZINC001133392601	1375977292	/nfs/dbraw/zinc/97/72/92/1375977292.db2.gz	FBXWOIDPZMLSOW-CQSZACIVSA-N	0	3	338.904	3.033	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)C[C@H]1C[C@@H]1C	ZINC001133403639	1375988058	/nfs/dbraw/zinc/98/80/58/1375988058.db2.gz	BXJQEGFXGKAZQF-DOTOQJQBSA-N	0	3	332.875	3.328	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1occc1CC	ZINC001133403733	1375988883	/nfs/dbraw/zinc/98/88/83/1375988883.db2.gz	GIKGLBIPQOWPEO-UHFFFAOYSA-N	0	3	344.842	3.361	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H]1C[C@H]1C(C)C	ZINC001133407576	1375992954	/nfs/dbraw/zinc/99/29/54/1375992954.db2.gz	JHIBGJDUQVMXRM-ZWKOTPCHSA-N	0	3	332.875	3.184	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H]1CC12CCCC2	ZINC001133410655	1375993959	/nfs/dbraw/zinc/99/39/59/1375993959.db2.gz	UBIIELNIQAXOMI-SFHVURJKSA-N	0	3	344.886	3.472	20	30		EGEDHN
C=CCC1(C(=O)NC2CCN(CCOCC(C)C)CC2)CCCC1	ZINC001230475437	1376033601	/nfs/dbraw/zinc/03/36/01/1376033601.db2.gz	KFFHHPFZIFAJCG-UHFFFAOYSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC([C@H]2CCCN2Cc2ccon2)CC1	ZINC001230586690	1376088918	/nfs/dbraw/zinc/08/89/18/1376088918.db2.gz	DYRNAHYBQKHJTI-VQIMIIECSA-N	0	3	345.487	3.480	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)c1ccsc1	ZINC001133633590	1376128905	/nfs/dbraw/zinc/12/89/05/1376128905.db2.gz	UVZYRDOVMQNTEF-MNOVXSKESA-N	0	3	331.279	3.143	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)c1cc(Cl)c[nH]1)NCc1ccccc1C#N	ZINC001133670763	1376146578	/nfs/dbraw/zinc/14/65/78/1376146578.db2.gz	FCHKKIQUQDYZNF-STQMWFEESA-N	0	3	344.846	3.226	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)c1cc(Cl)c[nH]1	ZINC001133672407	1376147556	/nfs/dbraw/zinc/14/75/56/1376147556.db2.gz	ZKNBKTZYFQNHFZ-ZJUUUORDSA-N	0	3	348.672	3.063	20	30		EGEDHN
C#CCCN(CCCNC(=O)[C@@H](C)C(CC)CC)Cc1cccnc1	ZINC001230796336	1376151186	/nfs/dbraw/zinc/15/11/86/1376151186.db2.gz	AESOXWZFCUDMJT-SFHVURJKSA-N	0	3	343.515	3.486	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)c1ccc(Cl)o1	ZINC001133682713	1376151277	/nfs/dbraw/zinc/15/12/77/1376151277.db2.gz	CABNBYBOOXGVCS-VHSXEESVSA-N	0	3	349.656	3.328	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)C1(C)CC(=C)C1)Cc1cccnc1	ZINC001230840778	1376164999	/nfs/dbraw/zinc/16/49/99/1376164999.db2.gz	HIHMKXNMLGLSOL-UHFFFAOYSA-N	0	3	327.472	3.322	20	30		EGEDHN
Cc1ncsc1C(=O)N[C@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001133784045	1376206011	/nfs/dbraw/zinc/20/60/11/1376206011.db2.gz	FFBNRYVRXHMCGJ-QWHCGFSZSA-N	0	3	342.468	3.010	20	30		EGEDHN
C/C(=C\C(=O)N[C@H](C)C[C@@H](C)NCc1cc(F)ccc1C#N)C1CC1	ZINC001133867072	1376243495	/nfs/dbraw/zinc/24/34/95/1376243495.db2.gz	PQBYVGRUEXKXDW-ISJXMTRFSA-N	0	3	343.446	3.427	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H]2CN(Cc3cccc(OC)c3)C[C@H]21	ZINC001188999141	1388431062	/nfs/dbraw/zinc/43/10/62/1388431062.db2.gz	FAWOEOFTTZLTTR-PKOBYXMFSA-N	0	3	328.456	3.084	20	30		EGEDHN
COCCCOc1ccc(CN2CCC(CC#N)CC2)cc1OC	ZINC001231542901	1376259927	/nfs/dbraw/zinc/25/99/27/1376259927.db2.gz	LZNQZICASICHBA-UHFFFAOYSA-N	0	3	332.444	3.236	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H]2CN(Cc3cc(C)ccc3OC)C[C@H]21	ZINC001189006339	1388435189	/nfs/dbraw/zinc/43/51/89/1388435189.db2.gz	CGHZBFZZFLUFAI-PKOBYXMFSA-N	0	3	342.483	3.393	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)C=C1CCC1)NCc1cc(F)ccc1C#N	ZINC001134113778	1376374826	/nfs/dbraw/zinc/37/48/26/1376374826.db2.gz	FQEBAERWCJAHOS-ZIAGYGMSSA-N	0	3	329.419	3.181	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCCN(Cc3cc4c[nH]ccc-4n3)C2)cc1	ZINC001232017954	1376387078	/nfs/dbraw/zinc/38/70/78/1376387078.db2.gz	BUGRUMKFCSCFST-LJQANCHMSA-N	0	3	332.407	3.478	20	30		EGEDHN
C#CCCCC(=O)N[C@H](C)C[C@@H](C)NCc1ccn(C(CC)CC)n1	ZINC001134206242	1376417802	/nfs/dbraw/zinc/41/78/02/1376417802.db2.gz	QULPDPPTMIPZPP-IAGOWNOFSA-N	0	3	346.519	3.421	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)C(C)=C1CCC1	ZINC001134308913	1376467894	/nfs/dbraw/zinc/46/78/94/1376467894.db2.gz	WBCFEVNQXSJLNM-RYUDHWBXSA-N	0	3	329.282	3.268	20	30		EGEDHN
COC(=O)[C@H](c1ccccc1)[C@@H]1CCCCN1Cc1cccc(C#N)n1	ZINC001232926439	1376537942	/nfs/dbraw/zinc/53/79/42/1376537942.db2.gz	PDSLBPSQKVVXRA-VQTJNVASSA-N	0	3	349.434	3.265	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H](C)C[C@@H](C)NCc1ncc(Cl)n1C	ZINC001134454359	1376546365	/nfs/dbraw/zinc/54/63/65/1376546365.db2.gz	VXOPRCVIXOBHSV-CHWSQXEVSA-N	0	3	340.899	3.049	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H](C)C[C@H](C)NCc1nc2ccccc2n1C	ZINC001134471222	1376555448	/nfs/dbraw/zinc/55/54/48/1376555448.db2.gz	VMKXFBAZHCZZIG-HOTGVXAUSA-N	0	3	342.487	3.303	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CC[C@@H]2[C@@H](CN2C(=O)OC(C)(C)C)C1	ZINC001233079923	1376566578	/nfs/dbraw/zinc/56/65/78/1376566578.db2.gz	QRPXJFFVGKVMTA-QZTJIDSGSA-N	0	3	341.455	3.308	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1sncc1C)[C@H]2CC	ZINC001233319583	1376614139	/nfs/dbraw/zinc/61/41/39/1376614139.db2.gz	ULURLGLKUJRFTQ-WMZOPIPTSA-N	0	3	333.501	3.373	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H](C)C[C@@H](C)NCc1nc(C)cs1	ZINC001134608316	1376623288	/nfs/dbraw/zinc/62/32/88/1376623288.db2.gz	UNAVSSRXGYKHDV-KGLIPLIRSA-N	0	3	346.500	3.126	20	30		EGEDHN
C#CCCCC(=O)N(C)C[C@H]1CCN1CCCCc1ccccc1	ZINC001233948566	1376742633	/nfs/dbraw/zinc/74/26/33/1376742633.db2.gz	YFLRKBOVEPFLHJ-HXUWFJFHSA-N	0	3	326.484	3.346	20	30		EGEDHN
C#CCCCC(=O)N(C)C[C@H]1CCN1[C@@H](CCOC)c1ccccc1	ZINC001233967256	1376745298	/nfs/dbraw/zinc/74/52/98/1376745298.db2.gz	YFPZTXAMBASDPX-UXHICEINSA-N	0	3	342.483	3.100	20	30		EGEDHN
CCCCCCCN1CC[C@H]1CN(C)C(=O)[C@@H]1CCCc2n[nH]cc21	ZINC001234323552	1376809249	/nfs/dbraw/zinc/80/92/49/1376809249.db2.gz	QWXWNVDNSQLJCW-DLBZAZTESA-N	0	3	346.519	3.333	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)CC1(C)CC1)NCc1cc(F)ccc1C#N	ZINC001135061752	1376874377	/nfs/dbraw/zinc/87/43/77/1376874377.db2.gz	DTKSTIZCBAQNLB-KGLIPLIRSA-N	0	3	331.435	3.260	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](C)C[C@H](C)NCc1csnc1OC	ZINC001135181576	1376954517	/nfs/dbraw/zinc/95/45/17/1376954517.db2.gz	RLHCVVFLRNEXBZ-STQMWFEESA-N	0	3	339.505	3.127	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H](C)C[C@H](C)NCC(=C)Br)cc1	ZINC001135184400	1376957213	/nfs/dbraw/zinc/95/72/13/1376957213.db2.gz	HFYWECVYDQKZKI-KBPBESRZSA-N	0	3	349.272	3.063	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H](C)C[C@H](C)NCc2ncc(C)s2)cc1	ZINC001135184974	1376958154	/nfs/dbraw/zinc/95/81/54/1376958154.db2.gz	RQIMKSHAYZCONL-UONOGXRCSA-N	0	3	341.480	3.120	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](C)C[C@@H](C)NCc1nccn1C(F)F	ZINC001135185505	1376959364	/nfs/dbraw/zinc/95/93/64/1376959364.db2.gz	YYXSLMUPHCKOAX-OLZOCXBDSA-N	0	3	342.434	3.253	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H](C)C[C@@H](C)NCC(=C)Br	ZINC001135188584	1376962639	/nfs/dbraw/zinc/96/26/39/1376962639.db2.gz	MTEOGGSCFDQKAF-CABCVRRESA-N	0	3	343.309	3.352	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H](C)C[C@@H](C)NCc1oc(C)nc1C	ZINC001135194387	1376965406	/nfs/dbraw/zinc/96/54/06/1376965406.db2.gz	UPNSCGDUMBAVNG-CABCVRRESA-N	0	3	333.476	3.248	20	30		EGEDHN
Cc1cocc1C(=O)N[C@@H](C)C[C@@H](C)NCc1cc(F)ccc1C#N	ZINC001135202787	1376972259	/nfs/dbraw/zinc/97/22/59/1376972259.db2.gz	IIWYOUANDAMSEY-KGLIPLIRSA-N	0	3	343.402	3.286	20	30		EGEDHN
Cc1cocc1C(=O)N[C@@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001135202235	1376972519	/nfs/dbraw/zinc/97/25/19/1376972519.db2.gz	CJRLXKNTGBWZDL-GJZGRUSLSA-N	0	3	325.412	3.146	20	30		EGEDHN
N#Cc1cc(Br)ccc1-c1noc([C@H]2N[C@@H]3CC[C@H]2C3)n1	ZINC001249210670	1377072634	/nfs/dbraw/zinc/07/26/34/1377072634.db2.gz	JEHYPGLHRWTDKJ-KDDOJWQBSA-N	0	3	345.200	3.184	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1cc(F)ccc1C#N)NC(=O)C1CC2(CC2)C1	ZINC001135445987	1377100261	/nfs/dbraw/zinc/10/02/61/1377100261.db2.gz	IPIMZLATXPUAHP-UONOGXRCSA-N	0	3	343.446	3.260	20	30		EGEDHN
Cc1cccc(C(=O)NCCNCc2ccc(F)c(C#N)c2)c1Cl	ZINC001135529025	1377130970	/nfs/dbraw/zinc/13/09/70/1377130970.db2.gz	BRSNGJMQARJONR-UHFFFAOYSA-N	0	3	345.805	3.179	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H](C)C[C@@H](C)NCc1ccn(C(C)C)n1	ZINC001135565360	1377147607	/nfs/dbraw/zinc/14/76/07/1377147607.db2.gz	UEWQKCQMRVPCLC-HZPDHXFCSA-N	0	3	334.508	3.439	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H](C)C[C@H](C)NCc1csnc1OC	ZINC001135565205	1377148082	/nfs/dbraw/zinc/14/80/82/1377148082.db2.gz	QVTNLTSNYSXTGO-STQMWFEESA-N	0	3	339.505	3.127	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)CCc1nc(C)cs1)C1CC1	ZINC001267856625	1377475381	/nfs/dbraw/zinc/47/53/81/1377475381.db2.gz	UDHKQBYAQQKLRD-MRXNPFEDSA-N	0	3	341.908	3.011	20	30		EGEDHN
CC(C)(C)OC(=O)C[C@@H]1CCCN1Cc1ccc(OCC#N)cc1	ZINC001137121533	1377482294	/nfs/dbraw/zinc/48/22/94/1377482294.db2.gz	PWUWUWQTSZWRJA-INIZCTEOSA-N	0	3	330.428	3.285	20	30		EGEDHN
C=CCOC(=O)N1CC2(C1)CCN(Cc1cc3ccccc3[nH]1)CC2	ZINC001137313913	1377516806	/nfs/dbraw/zinc/51/68/06/1377516806.db2.gz	ZNWSDGGTEWQAMG-UHFFFAOYSA-N	0	3	339.439	3.388	20	30		EGEDHN
O=C1C=C2CN(Cc3cccc(F)c3Br)CCC2S1	ZINC001137718893	1377604708	/nfs/dbraw/zinc/60/47/08/1377604708.db2.gz	XHWXOJAHQUXKSA-GFCCVEGCSA-N	0	3	342.233	3.362	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CCC(NC(=O)C(C)(C)C)CC2)c1[O-]	ZINC001138631325	1377757742	/nfs/dbraw/zinc/75/77/42/1377757742.db2.gz	PFKUTQSTWYLSOF-UHFFFAOYSA-N	0	3	330.472	3.247	20	30		EGEDHN
C=C(C)COc1ccccc1CN1CCC(C(C)(C)C(N)=O)CC1	ZINC001138664984	1377765101	/nfs/dbraw/zinc/76/51/01/1377765101.db2.gz	DCDZDIPFNOVAMI-UHFFFAOYSA-N	0	3	330.472	3.365	20	30		EGEDHN
C=CCCCC(=O)N(C)[C@@H]1CCN(CC[C@@H]2CC2(Cl)Cl)C1	ZINC001753442119	1440402019	/nfs/dbraw/zinc/40/20/19/1440402019.db2.gz	WAGXNDQBVHTUMN-ZIAGYGMSSA-N	0	3	333.303	3.459	20	30		EGEDHN
C=CCN1C(=O)CCC[C@@]12CCCN(Cc1cnc3[nH]ccc3c1)C2	ZINC001138744916	1377779479	/nfs/dbraw/zinc/77/94/79/1377779479.db2.gz	YORUQCBFEDBLOR-FQEVSTJZSA-N	0	3	338.455	3.096	20	30		EGEDHN
N#Cc1ccc(Oc2ccc(CN3CCC[C@@H](CO)CC3)cn2)cc1	ZINC001139427145	1377882241	/nfs/dbraw/zinc/88/22/41/1377882241.db2.gz	WJVIHUPAPDPFGJ-QGZVFWFLSA-N	0	3	337.423	3.340	20	30		EGEDHN
C[C@H]1CCCN(Cc2ccc(Oc3ccc(C#N)cc3)nc2)[C@H]1CO	ZINC001139427232	1377882252	/nfs/dbraw/zinc/88/22/52/1377882252.db2.gz	ZFHCFKJVCRDDFL-KXBFYZLASA-N	0	3	337.423	3.338	20	30		EGEDHN
COc1ccc(CCN(Cc2cc(C#N)ccc2F)C[C@H](C)O)cc1	ZINC001139646678	1377925106	/nfs/dbraw/zinc/92/51/06/1377925106.db2.gz	DJFFTFICCAOSEC-HNNXBMFYSA-N	0	3	342.414	3.131	20	30		EGEDHN
Cc1ccc(CN2CCC(C(=O)N3CCCCCC3)CC2)cc1C#N	ZINC001139723707	1377941373	/nfs/dbraw/zinc/94/13/73/1377941373.db2.gz	FOPLICQEUGYLLP-UHFFFAOYSA-N	0	3	339.483	3.481	20	30		EGEDHN
C=CCO[C@@H]1CO[C@]2(C1)CCCN(Cc1ccc(COC)s1)C2	ZINC001139830762	1377958095	/nfs/dbraw/zinc/95/80/95/1377958095.db2.gz	XCSGZDGPYSNXBN-YJBOKZPZSA-N	0	3	337.485	3.221	20	30		EGEDHN
CCCCOC(=O)[C@H]1CCN(Cc2c[nH]c3ccc(C#N)cc23)C1	ZINC001140116646	1378012096	/nfs/dbraw/zinc/01/20/96/1378012096.db2.gz	CNYCLTMIWDIDIF-HNNXBMFYSA-N	0	3	325.412	3.205	20	30		EGEDHN
Cc1ccc(O[C@H]2CCN(Cc3c[nH]c4ccc(C#N)cc34)C2)nc1	ZINC001140117242	1378012145	/nfs/dbraw/zinc/01/21/45/1378012145.db2.gz	ONICAFMQQTUXHO-KRWDZBQOSA-N	0	3	332.407	3.396	20	30		EGEDHN
COC(=O)[C@H](c1ccccc1)[C@@H]1CCCCN1Cc1ccc(C#N)nc1	ZINC001140545941	1378082907	/nfs/dbraw/zinc/08/29/07/1378082907.db2.gz	QNNUXBGEKNPCQW-VQTJNVASSA-N	0	3	349.434	3.265	20	30		EGEDHN
Cc1ccc(F)c(CN2CC[C@@]3(CCN(CCCC#N)C3=O)C2)c1F	ZINC001273304055	1378096058	/nfs/dbraw/zinc/09/60/58/1378096058.db2.gz	RLHLMBXHNNYLIF-LJQANCHMSA-N	0	3	347.409	3.001	20	30		EGEDHN
CSc1nc(CN(C)CCN(C)Cc2ccccc2)ccc1C#N	ZINC001141945513	1378396551	/nfs/dbraw/zinc/39/65/51/1378396551.db2.gz	BKVCIMAWGKNWFF-UHFFFAOYSA-N	0	3	340.496	3.239	20	30		EGEDHN
CC1(C)CN(Cc2ccc(C#N)cc2)CC[C@@H]1NC(=O)CCC1CC1	ZINC001281543134	1378443690	/nfs/dbraw/zinc/44/36/90/1378443690.db2.gz	YLIXWTPQNCUBRL-IBGZPJMESA-N	0	3	339.483	3.465	20	30		EGEDHN
N#Cc1cncc(CN2CCN([C@@H]3CCCc4ccccc43)CC2)c1	ZINC001144083892	1378680793	/nfs/dbraw/zinc/68/07/93/1378680793.db2.gz	WGJPXMAGIVEORG-OAQYLSRUSA-N	0	3	332.451	3.148	20	30		EGEDHN
C#Cc1ccc(CN(C)C[C@@H]2CN(Cc3ccccc3)CCO2)cc1	ZINC001144578733	1378747483	/nfs/dbraw/zinc/74/74/83/1378747483.db2.gz	LAIMBNHKAFUHDS-JOCHJYFZSA-N	0	3	334.463	3.001	20	30		EGEDHN
C=CCN1C(=O)CCC12CCN(Cc1ccc3scnc3c1)CC2	ZINC001144734911	1378766160	/nfs/dbraw/zinc/76/61/60/1378766160.db2.gz	QYIARSIMHPGBID-UHFFFAOYSA-N	0	3	341.480	3.439	20	30		EGEDHN
CC[C@@H](CC(=O)NCCNCc1cccc(C#N)c1)c1ccccc1	ZINC001147474493	1379028982	/nfs/dbraw/zinc/02/89/82/1379028982.db2.gz	JMONAZFWRYNIAK-IBGZPJMESA-N	0	3	335.451	3.348	20	30		EGEDHN
C[C@H](CN(C)C(=O)C1=CCCCCC1)NCc1ccc(C#N)s1	ZINC001283598699	1379044627	/nfs/dbraw/zinc/04/46/27/1379044627.db2.gz	PLODQLGZZSLSNA-CQSZACIVSA-N	0	3	331.485	3.447	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC2(C1)CCN(Cc1ncccc1C)C2	ZINC001147631339	1379052863	/nfs/dbraw/zinc/05/28/63/1379052863.db2.gz	UFAGUUCBCWBERZ-UHFFFAOYSA-N	0	3	327.472	3.027	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)N1CC2(C1)CCN(CCOc1ccccc1)C2	ZINC001148095202	1379117195	/nfs/dbraw/zinc/11/71/95/1379117195.db2.gz	DVEAAICZDWIFOL-QZTJIDSGSA-N	0	3	342.483	3.058	20	30		EGEDHN
C=CCCCC(=O)N1CC2(C1)CCN(CCc1ccccc1F)C2	ZINC001148200048	1379133079	/nfs/dbraw/zinc/13/30/79/1379133079.db2.gz	ZLFOOVCTJZCCQY-UHFFFAOYSA-N	0	3	330.447	3.259	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC2(C1)CCN(Cc1ccc(OC)cc1)C2	ZINC001148357719	1379156128	/nfs/dbraw/zinc/15/61/28/1379156128.db2.gz	PVKZIPOIKLBEAU-UHFFFAOYSA-N	0	3	342.483	3.332	20	30		EGEDHN
CCCCCCCCC(=O)NCCN[C@H](C)C(=O)NC(C)(C)CC	ZINC001148727770	1379254759	/nfs/dbraw/zinc/25/47/59/1379254759.db2.gz	KENJDPMANQCCCM-MRXNPFEDSA-N	0	3	341.540	3.136	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C[C@H](C)CCc3ccccc3)C2)C1	ZINC001148873902	1379288849	/nfs/dbraw/zinc/28/88/49/1379288849.db2.gz	AOCQLLUCXFAQHA-LJQANCHMSA-N	0	3	338.495	3.203	20	30		EGEDHN
CN1CCC[C@H]2CN(C(=O)c3ccc(C(C)(C)CCC#N)cc3)C[C@H]21	ZINC001148906685	1379296118	/nfs/dbraw/zinc/29/61/18/1379296118.db2.gz	WFAQKELQKQPBKQ-PKOBYXMFSA-N	0	3	339.483	3.434	20	30		EGEDHN
C=CCC[C@H](C(=O)N1CC2(C1)CCN(CC#CC)C2)c1ccccc1	ZINC001148941206	1379300917	/nfs/dbraw/zinc/30/09/17/1379300917.db2.gz	GSKZQYWTCXELBH-FQEVSTJZSA-N	0	3	336.479	3.294	20	30		EGEDHN
CCCCCCC[N@@H+]1CCCO[C@@H](CNC(=O)c2ccccc2[O-])C1	ZINC001149168145	1379338743	/nfs/dbraw/zinc/33/87/43/1379338743.db2.gz	OCILDFHNGUDYQA-KRWDZBQOSA-N	0	3	348.487	3.183	20	30		EGEDHN
CCCCCCC[N@H+]1CCCO[C@@H](CNC(=O)c2ccccc2[O-])C1	ZINC001149168145	1379338746	/nfs/dbraw/zinc/33/87/46/1379338746.db2.gz	OCILDFHNGUDYQA-KRWDZBQOSA-N	0	3	348.487	3.183	20	30		EGEDHN
C=CCCC(=O)NC[C@@H]1CN(Cc2cc(C)sc2C)CCCO1	ZINC001149339850	1379366323	/nfs/dbraw/zinc/36/63/23/1379366323.db2.gz	FNEWIURYRAZNAY-QGZVFWFLSA-N	0	3	336.501	3.038	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC[C@H]1CN(CC2=CCCCC2)CCCO1	ZINC001149765168	1379441600	/nfs/dbraw/zinc/44/16/00/1379441600.db2.gz	SAONWZJXSYHQOR-FQEVSTJZSA-N	0	3	346.515	3.462	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)CCC2CCCCC2)cc1F	ZINC001149786029	1379445994	/nfs/dbraw/zinc/44/59/94/1379445994.db2.gz	KLNRQNOJLDCXSO-UHFFFAOYSA-N	0	3	331.435	3.264	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)[C@@H](c2ccccc2)C(C)C)C1	ZINC001150380038	1379542207	/nfs/dbraw/zinc/54/22/07/1379542207.db2.gz	OLXGYYYJSJDWKT-WOJBJXKFSA-N	0	3	344.499	3.209	20	30		EGEDHN
CCc1cc(C(=O)NCCNCc2ccc(C#N)s2)sc1C	ZINC001150388042	1379544234	/nfs/dbraw/zinc/54/42/34/1379544234.db2.gz	VRUWGVXVAZKONS-UHFFFAOYSA-N	0	3	333.482	3.072	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)[C@H](CC)Cc2ccccc2)C1	ZINC001150393217	1379545858	/nfs/dbraw/zinc/54/58/58/1379545858.db2.gz	BHLWIIQYJKMMPX-UXHICEINSA-N	0	3	344.499	3.039	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)C(C)(C)C2CCCCC2)C1	ZINC001150425124	1379552343	/nfs/dbraw/zinc/55/23/43/1379552343.db2.gz	GOMVBLRBUCDMDV-SFHVURJKSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)C[C@@H]2C=CCCC2)CC1	ZINC001151175000	1379671623	/nfs/dbraw/zinc/67/16/23/1379671623.db2.gz	STRJBBOAKGILIM-GOSISDBHSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@H]2[C@@H](C=C(C)C)C2(C)C)CC1	ZINC001151209027	1379677555	/nfs/dbraw/zinc/67/75/55/1379677555.db2.gz	DAZSDXDKSCHLCE-QZTJIDSGSA-N	0	3	348.531	3.398	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@@H](C)C2CCCC2)CC1	ZINC001151387617	1379709397	/nfs/dbraw/zinc/70/93/97/1379709397.db2.gz	OKOMGHNJJURGCE-KRWDZBQOSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2cc(C)ccc2C)CC1	ZINC001151402466	1379711544	/nfs/dbraw/zinc/71/15/44/1379711544.db2.gz	GSWSONGVIYUTKT-UHFFFAOYSA-N	0	3	330.472	3.090	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cc3cccc(F)c3o2)s1	ZINC001151700856	1379766463	/nfs/dbraw/zinc/76/64/63/1379766463.db2.gz	JPRXCGQULPIYSO-UHFFFAOYSA-N	0	3	343.383	3.025	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)c1cc(C)oc1C	ZINC001151847222	1379797605	/nfs/dbraw/zinc/79/76/05/1379797605.db2.gz	UTDCMVTVSLRROI-CQSZACIVSA-N	0	3	339.439	3.409	20	30		EGEDHN
CCCCCC(=O)NC[C@@H](C)N(CC)Cc1ccc(OC)c(C#N)c1	ZINC001151879989	1379808398	/nfs/dbraw/zinc/80/83/98/1379808398.db2.gz	JULOFRNHFALYLB-MRXNPFEDSA-N	0	3	345.487	3.474	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)CC[C@@H]2CCc3ccccc32)c1	ZINC001152041253	1379848653	/nfs/dbraw/zinc/84/86/53/1379848653.db2.gz	ORRCEPBAAJDUMW-FQEVSTJZSA-N	0	3	347.462	3.274	20	30		EGEDHN
CCC[C@@H](C)C(=O)NC[C@@H](C)N(CC)Cc1ccc(F)c(C#N)c1	ZINC001152459626	1379936790	/nfs/dbraw/zinc/93/67/90/1379936790.db2.gz	HLJTVNRAQXUZBN-HUUCEWRRSA-N	0	3	333.451	3.460	20	30		EGEDHN
CCCC[C@@H](C(=O)NCCNCc1ccc(C#N)c(F)c1)C(C)C	ZINC001152653379	1379963132	/nfs/dbraw/zinc/96/31/32/1379963132.db2.gz	WNKGDWABBOTWMY-QGZVFWFLSA-N	0	3	333.451	3.366	20	30		EGEDHN
CCN(Cc1ccc(OC)c(C#N)c1)[C@H](C)CNC(=O)C(F)=C(C)C	ZINC001152723440	1379975919	/nfs/dbraw/zinc/97/59/19/1379975919.db2.gz	CCPQKQDNYUJSQL-CQSZACIVSA-N	0	3	347.434	3.157	20	30		EGEDHN
CC1(C)CCC[C@H](C(=O)NCCNCc2ccc(C#N)c(F)c2)C1	ZINC001152832265	1379985421	/nfs/dbraw/zinc/98/54/21/1379985421.db2.gz	YEMUZOBZADCHNH-HNNXBMFYSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NCCN[C@@H](C)c1ccc(Cl)c(Cl)c1	ZINC001153148526	1380027857	/nfs/dbraw/zinc/02/78/57/1380027857.db2.gz	FTPVTYBDYMRPJL-RYUDHWBXSA-N	0	3	345.270	3.351	20	30		EGEDHN
CC/C(C)=C/C(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)c(F)c1	ZINC001153188716	1380032017	/nfs/dbraw/zinc/03/20/17/1380032017.db2.gz	UTZJRJKXKIGNSE-AAWPKVBNSA-N	0	3	331.435	3.380	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)C1C=CC=CC=C1	ZINC001153625770	1380106812	/nfs/dbraw/zinc/10/68/12/1380106812.db2.gz	IEVNDTMOZOZCTK-QGZVFWFLSA-N	0	3	335.451	3.183	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1oc2ccc(F)cc2c1C	ZINC001153827982	1380138336	/nfs/dbraw/zinc/13/83/36/1380138336.db2.gz	DYQPJVLKYWCWEK-CYBMUJFWSA-N	0	3	330.403	3.344	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2cc(-c3ccccc3)co2)c1	ZINC001153848626	1380142988	/nfs/dbraw/zinc/14/29/88/1380142988.db2.gz	MNDKGLASJIHYSO-UHFFFAOYSA-N	0	3	345.402	3.338	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)C1(CCF)CC1	ZINC001154444043	1380278814	/nfs/dbraw/zinc/27/88/14/1380278814.db2.gz	QBFNUTHLJHWXCC-CQSZACIVSA-N	0	3	349.425	3.164	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)C(C)(C)C(F)F	ZINC001155126637	1380413659	/nfs/dbraw/zinc/41/36/59/1380413659.db2.gz	OBANIADVQNIINR-CYBMUJFWSA-N	0	3	337.414	3.176	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NCCCNCc1cccc(Cl)c1F	ZINC001155426368	1380450995	/nfs/dbraw/zinc/45/09/95/1380450995.db2.gz	ALYABPQHGCCXJD-CYBMUJFWSA-N	0	3	342.842	3.056	20	30		EGEDHN
C=CCOCCCC(=O)NCCCN[C@H](C)c1c(F)cccc1F	ZINC001156165793	1380534872	/nfs/dbraw/zinc/53/48/72/1380534872.db2.gz	NCXGXNGOIALINW-CQSZACIVSA-N	0	3	340.414	3.105	20	30		EGEDHN
Cc1cnc(N2CCC[C@@H](NCOCC[Si](C)(C)C)C2)c(C#N)c1	ZINC001156464698	1380579300	/nfs/dbraw/zinc/57/93/00/1380579300.db2.gz	UEJTWIZGNGWGPW-QGZVFWFLSA-N	0	3	346.551	3.132	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1ccc2[nH]c(C)c(C)c2c1	ZINC001156828989	1380662919	/nfs/dbraw/zinc/66/29/19/1380662919.db2.gz	LCIZFDSPYVEFFF-CQSZACIVSA-N	0	3	325.456	3.248	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1sc(C(C)(C)C)nc1C	ZINC001157329386	1380843196	/nfs/dbraw/zinc/84/31/96/1380843196.db2.gz	VIWGEBBTALDXRD-CYBMUJFWSA-N	0	3	335.517	3.213	20	30		EGEDHN
C#CCCCC(=O)N1CCCC[C@@H]1CN(C)Cc1cccc(C#N)c1	ZINC001157884928	1381059689	/nfs/dbraw/zinc/05/96/89/1381059689.db2.gz	KGWTVRNZIJPMRG-HXUWFJFHSA-N	0	3	337.467	3.175	20	30		EGEDHN
C[C@H]1C[C@H]1c1ccc(C(=O)NCCCNCc2ccccc2C#N)o1	ZINC001157919264	1381070563	/nfs/dbraw/zinc/07/05/63/1381070563.db2.gz	PGHDCARULRQHMA-WMLDXEAASA-N	0	3	337.423	3.184	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)Cc1ccc2c(c1)CCCO2	ZINC001158101336	1381127556	/nfs/dbraw/zinc/12/75/56/1381127556.db2.gz	CMTFGKIRFPKWKR-LJQANCHMSA-N	0	3	342.483	3.053	20	30		EGEDHN
CN1CCN(C(F)(F)c2ccc(Cl)nc2C#N)C2(CCCC2)C1	ZINC001158408594	1381233627	/nfs/dbraw/zinc/23/36/27/1381233627.db2.gz	KWTFBSUPAHYYTE-UHFFFAOYSA-N	0	3	340.805	3.216	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc(C(C)C)[nH]c1=O	ZINC001158571490	1381304558	/nfs/dbraw/zinc/30/45/58/1381304558.db2.gz	MERXJEHGYBNGPJ-OAHLLOKOSA-N	0	3	331.460	3.023	20	30		EGEDHN
Cc1cccc(C(=O)NCCCNCc2cc(C#N)ccc2F)c1F	ZINC001158566777	1381305139	/nfs/dbraw/zinc/30/51/39/1381305139.db2.gz	UMWMHBBPKZKOBP-UHFFFAOYSA-N	0	3	343.377	3.055	20	30		EGEDHN
C[C@H]1CCC[C@@H]1CC(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001158620019	1381324964	/nfs/dbraw/zinc/32/49/64/1381324964.db2.gz	ZGPVYPKGENWIOR-GOEBONIOSA-N	0	3	331.435	3.120	20	30		EGEDHN
CC1=C(C)C[C@@H](C(=O)NCCCNCc2cc(C#N)ccc2F)CC1	ZINC001158720910	1381365485	/nfs/dbraw/zinc/36/54/85/1381365485.db2.gz	NJDHHTYTXOCTBE-KRWDZBQOSA-N	0	3	343.446	3.430	20	30		EGEDHN
CCCCCCCCCC(=O)N1CCCC[C@@H]1CN(C)CCO	ZINC001158782068	1381397283	/nfs/dbraw/zinc/39/72/83/1381397283.db2.gz	ZXFLGAQULAAHGF-GOSISDBHSA-N	0	3	326.525	3.432	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1cc(C)cc(C)c1	ZINC001158787276	1381399032	/nfs/dbraw/zinc/39/90/32/1381399032.db2.gz	PGZQNDVRSWGWOQ-HXUWFJFHSA-N	0	3	344.499	3.433	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)CCOc1ccccc1F	ZINC001158824983	1381418008	/nfs/dbraw/zinc/41/80/08/1381418008.db2.gz	GUOBEQLBBLJYIJ-MRXNPFEDSA-N	0	3	334.435	3.094	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)COc1cccc(CC)c1	ZINC001158829581	1381421808	/nfs/dbraw/zinc/42/18/08/1381421808.db2.gz	BJPLLISHQLGMLH-GOSISDBHSA-N	0	3	330.472	3.127	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)CCc1nc2ccccc2o1	ZINC001158846681	1381429881	/nfs/dbraw/zinc/42/98/81/1381429881.db2.gz	FRFFLTMAXQAYGG-MRXNPFEDSA-N	0	3	341.455	3.259	20	30		EGEDHN
C=CCCC(=O)NCCC1=CCN(CCOc2cccc(F)c2)CC1	ZINC001159538920	1381822025	/nfs/dbraw/zinc/82/20/25/1381822025.db2.gz	RSSWDOZDKXMGRX-UHFFFAOYSA-N	0	3	346.446	3.309	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H](C)OCCCCCC)CC1	ZINC001160142229	1382013825	/nfs/dbraw/zinc/01/38/25/1382013825.db2.gz	BZBLIHRJVRQGCF-GOSISDBHSA-N	0	3	334.504	3.134	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc3nccc(C)c3c2)CC1	ZINC001160236366	1382043489	/nfs/dbraw/zinc/04/34/89/1382043489.db2.gz	QELAZFRGKPXULC-UHFFFAOYSA-N	0	3	335.451	3.481	20	30		EGEDHN
Cc1ccc([C@H](C#N)c2ccc(Nc3ccc(CN)nc3)nn2)cc1	ZINC001160396524	1382093037	/nfs/dbraw/zinc/09/30/37/1382093037.db2.gz	KPTHTHIIEWSNAJ-KRWDZBQOSA-N	0	3	330.395	3.038	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc3nc(C)oc3c2)CC1	ZINC001160415637	1382098187	/nfs/dbraw/zinc/09/81/87/1382098187.db2.gz	AQDORQAMRIIZIZ-UHFFFAOYSA-N	0	3	325.412	3.074	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cccc(-n3cccc3)c2)CC1	ZINC001160613759	1382152585	/nfs/dbraw/zinc/15/25/85/1382152585.db2.gz	RZRGQMMKRKHPJF-UHFFFAOYSA-N	0	3	347.462	3.253	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@H]2[C@@H](C=C(C)C)C2(C)C)CC1	ZINC001160646611	1382160174	/nfs/dbraw/zinc/16/01/74/1382160174.db2.gz	STRNGYSGJHQBKU-RTBURBONSA-N	0	3	328.500	3.387	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCC1=CCN(CCOCC2CC2)CC1	ZINC001160941212	1382244305	/nfs/dbraw/zinc/24/43/05/1382244305.db2.gz	LNZMXNNYYISTNA-IAGOWNOFSA-N	0	3	334.504	3.010	20	30		EGEDHN
C=CCN1CCC[C@H]1CNc1nc(C)cc(Cl)c1C(=O)OCC	ZINC001160953006	1382250330	/nfs/dbraw/zinc/25/03/30/1382250330.db2.gz	MHMQEAUAJHTMBR-ZDUSSCGKSA-N	0	3	337.851	3.282	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)[C@H]1CCCc2ccccc21	ZINC001161018378	1382273909	/nfs/dbraw/zinc/27/39/09/1382273909.db2.gz	BVWVWNCDSMCWOG-NRFANRHFSA-N	0	3	347.462	3.274	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H]2CC[C@@H](C(F)(F)F)C2)CC1	ZINC001161019249	1382274831	/nfs/dbraw/zinc/27/48/31/1382274831.db2.gz	AKKBVYVIJYQFAU-LSDHHAIUSA-N	0	3	330.394	3.289	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cnoc2-c2ccccc2)CC1	ZINC001161617961	1382461121	/nfs/dbraw/zinc/46/11/21/1382461121.db2.gz	YKFDATOLIOXVQP-UHFFFAOYSA-N	0	3	349.434	3.117	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc(F)c(F)c(F)c2F)CC1	ZINC001161758682	1382496682	/nfs/dbraw/zinc/49/66/82/1382496682.db2.gz	LQTJQLDBDZAJRI-UHFFFAOYSA-N	0	3	342.336	3.181	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc(OC)c(Cl)c2)CC1	ZINC001161845216	1382527838	/nfs/dbraw/zinc/52/78/38/1382527838.db2.gz	YELSVEXANWYSLK-UHFFFAOYSA-N	0	3	334.847	3.287	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H](CC)CCCC	ZINC001162710521	1382844365	/nfs/dbraw/zinc/84/43/65/1382844365.db2.gz	WYADEBJNDQPIRC-HXUWFJFHSA-N	0	3	328.500	3.497	20	30		EGEDHN
C[C@H](N)c1nc2ccccc2n1-c1nc(Cl)nc(Cl)c1C#N	ZINC001162759320	1382862059	/nfs/dbraw/zinc/86/20/59/1382862059.db2.gz	CKBBZBCLJWAYTF-ZETCQYMHSA-N	0	3	333.182	3.014	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CCCC12CC2	ZINC001162841160	1382891821	/nfs/dbraw/zinc/89/18/21/1382891821.db2.gz	OGSNKNZBKRMERK-HXUWFJFHSA-N	0	3	338.495	3.251	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C1(C2CC2)CCC1	ZINC001162871119	1382900785	/nfs/dbraw/zinc/90/07/85/1382900785.db2.gz	HXVWSWGKELXOER-UHFFFAOYSA-N	0	3	338.495	3.251	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C[C@@H]1CC[C@@H](C)C1	ZINC001162892071	1382907124	/nfs/dbraw/zinc/90/71/24/1382907124.db2.gz	GMUDCWKHVYBIII-TZIWHRDSSA-N	0	3	340.511	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1ccoc1C1CC1	ZINC001162905887	1382911286	/nfs/dbraw/zinc/91/12/86/1382911286.db2.gz	ATOPCYGSSQNDIX-UHFFFAOYSA-N	0	3	336.435	3.065	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)CCC1(C)CC1	ZINC001162977385	1382935101	/nfs/dbraw/zinc/93/51/01/1382935101.db2.gz	NTORFUYIWIULBL-UHFFFAOYSA-N	0	3	326.484	3.251	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C[C@H](C)c1ccccc1	ZINC001162992630	1382940467	/nfs/dbraw/zinc/94/04/67/1382940467.db2.gz	UPGDMPNEWQZOCH-FQEVSTJZSA-N	0	3	348.490	3.474	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)Cc1cccc(C2CC2)c1	ZINC001163115048	1382969367	/nfs/dbraw/zinc/96/93/67/1382969367.db2.gz	WWSGDCBDFZFHOX-UHFFFAOYSA-N	0	3	347.462	3.274	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)C[C@@H]2CC=CCC2)c1	ZINC001164002044	1383145185	/nfs/dbraw/zinc/14/51/85/1383145185.db2.gz	YELPJANYFKWZOT-OAHLLOKOSA-N	0	3	329.419	3.040	20	30		EGEDHN
CC#CCCCC(=O)NCCCNCc1nc(C(C)(C)C)cs1	ZINC001164251042	1383171204	/nfs/dbraw/zinc/17/12/04/1383171204.db2.gz	CGRJWVCZHMGZIS-UHFFFAOYSA-N	0	3	335.517	3.230	20	30		EGEDHN
C#CCCCC(=O)NCCC1(CNCc2oc(C(C)C)nc2C)CC1	ZINC001164297691	1383175356	/nfs/dbraw/zinc/17/53/56/1383175356.db2.gz	JZFICBLXKLITEC-UHFFFAOYSA-N	0	3	345.487	3.286	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCCCNCc1nsc2ccccc21	ZINC001164360792	1383181151	/nfs/dbraw/zinc/18/11/51/1383181151.db2.gz	UADNNHBKSLEWCN-CQSZACIVSA-N	0	3	331.485	3.495	20	30		EGEDHN
O=C(C#CC1CC1)NCCC1(CNCc2ccc(Cl)cc2F)CC1	ZINC001164487528	1383192282	/nfs/dbraw/zinc/19/22/82/1383192282.db2.gz	VTBAZEHPMZBZSH-UHFFFAOYSA-N	0	3	348.849	3.269	20	30		EGEDHN
Cc1cnc(N(C)[C@@H]2CN(Cc3ccccc3)CC[C@H]2C)c(C#N)n1	ZINC001165180473	1383242667	/nfs/dbraw/zinc/24/26/67/1383242667.db2.gz	BDHBWYGGAAWTMB-DNVCBOLYSA-N	0	3	335.455	3.004	20	30		EGEDHN
C[C@H]1CCN(Cc2ccccc2)C[C@H]1N(C)c1nccc(C#N)c1F	ZINC001165184581	1383243584	/nfs/dbraw/zinc/24/35/84/1383243584.db2.gz	XDYCHIXFCNCNCF-MAUKXSAKSA-N	0	3	338.430	3.439	20	30		EGEDHN
C=C(C)CCC(=O)NCCC1(CNCC(=C)Br)CC1	ZINC001165258528	1383259185	/nfs/dbraw/zinc/25/91/85/1383259185.db2.gz	DIJQNEKIVKFLJP-UHFFFAOYSA-N	0	3	329.282	3.127	20	30		EGEDHN
CC[C@H]1CCC[C@H]1C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001166036235	1383380211	/nfs/dbraw/zinc/38/02/11/1383380211.db2.gz	MAHASJHDEXHMSI-DOTOQJQBSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)[C@@]2(C)C=CCC2)CC1	ZINC001166654711	1383453949	/nfs/dbraw/zinc/45/39/49/1383453949.db2.gz	IMCKSDRVCABXFA-HNNXBMFYSA-N	0	3	341.293	3.127	20	30		EGEDHN
C=C/C(C)=C\CC(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001166679535	1383459152	/nfs/dbraw/zinc/45/91/52/1383459152.db2.gz	XKHHKPJSXMPKAI-IUXPMGMMSA-N	0	3	337.467	3.457	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCC1(CNCC(=C)Br)CC1	ZINC001166693681	1383461662	/nfs/dbraw/zinc/46/16/62/1383461662.db2.gz	JEQQUARGYXBQGH-GXTWGEPZSA-N	0	3	343.309	3.229	20	30		EGEDHN
Cc1coc(C(=O)NCCC2(CNCc3ccccc3C#N)CC2)c1	ZINC001166737063	1383468867	/nfs/dbraw/zinc/46/88/67/1383468867.db2.gz	MTMQEOUXYARBQR-UHFFFAOYSA-N	0	3	337.423	3.150	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCCC1(CNCc2conc2CC)CC1	ZINC001166746216	1383470646	/nfs/dbraw/zinc/47/06/46/1383470646.db2.gz	DQIBRQSTRBRRIB-HNNXBMFYSA-N	0	3	333.476	3.215	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@@H]2CCCc3cccnc32)CC1	ZINC001166793008	1383477686	/nfs/dbraw/zinc/47/76/86/1383477686.db2.gz	AYOOWUJEXLPLRR-MRXNPFEDSA-N	0	3	347.890	3.130	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@@H]2CCc3ccccc3C2)CC1	ZINC001167328772	1383599681	/nfs/dbraw/zinc/59/96/81/1383599681.db2.gz	TWGCIHAKLWNUMW-GOSISDBHSA-N	0	3	346.902	3.420	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@H](C)c1cccc(C)c1	ZINC001167410113	1383626339	/nfs/dbraw/zinc/62/63/39/1383626339.db2.gz	ZHGLEDIJYPKEEM-CQSZACIVSA-N	0	3	339.277	3.103	20	30		EGEDHN
Cc1cc2c(cc1C#N)[nH]nc2NC(=O)c1cccc(CN(C)C)c1	ZINC001300270699	1383657225	/nfs/dbraw/zinc/65/72/25/1383657225.db2.gz	JBWCWQGBHBZOBH-UHFFFAOYSA-N	0	3	333.395	3.057	20	30		EGEDHN
CC(C)[C@@H]1C[C@@H]1C(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001167578323	1383675829	/nfs/dbraw/zinc/67/58/29/1383675829.db2.gz	KDDVQMAMYUBCQU-OALUTQOASA-N	0	3	339.483	3.226	20	30		EGEDHN
C[C@@H](CC(C)(C)C)C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001167664809	1383703883	/nfs/dbraw/zinc/70/38/83/1383703883.db2.gz	VIKMTOOPPQFPKP-AWEZNQCLSA-N	0	3	333.451	3.366	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@H](C)OCCC(C)C)CC1	ZINC001168435369	1383905694	/nfs/dbraw/zinc/90/56/94/1383905694.db2.gz	VDGYNTXLQLIAQA-HNNXBMFYSA-N	0	3	330.900	3.066	20	30		EGEDHN
C[C@@H](CCCCNCc1cc(F)ccc1C#N)NC(=O)C(C)(F)F	ZINC001168768857	1383997696	/nfs/dbraw/zinc/99/76/96/1383997696.db2.gz	KBAUUHVEYZLTFI-LBPRGKRZSA-N	0	3	341.377	3.117	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2ccc(C#N)c(F)c2)CN1C(=O)OC(C)(C)C	ZINC001168821584	1384019172	/nfs/dbraw/zinc/01/91/72/1384019172.db2.gz	FBBJXRGWECBKLM-IUODEOHRSA-N	0	3	333.407	3.185	20	30		EGEDHN
CCc1cccc(CN[C@H]2CCCN(c3ccc(C#N)cc3)C2=O)c1	ZINC001308370018	1384122342	/nfs/dbraw/zinc/12/23/42/1384122342.db2.gz	WANIMBCCVHELRH-FQEVSTJZSA-N	0	3	333.435	3.406	20	30		EGEDHN
CC[C@@H](CN(C)C[C@H](O)CC#N)Oc1ccc(Cl)c(Cl)c1	ZINC001169353272	1384139254	/nfs/dbraw/zinc/13/92/54/1384139254.db2.gz	MXRDNWOSVPTGAU-NEPJUHHUSA-N	0	3	331.243	3.357	20	30		EGEDHN
CC[C@@H]1CCN([C@H](C)C(=O)N(CCC#N)c2ccccc2OC)[C@H]1C	ZINC001169494736	1384154354	/nfs/dbraw/zinc/15/43/54/1384154354.db2.gz	OKHBIIOWAACEBM-GVDBMIGSSA-N	0	3	343.471	3.451	20	30		EGEDHN
COCCCCC(=O)N[C@@H](C)CCCCNCc1ccccc1C#N	ZINC001169656133	1384169432	/nfs/dbraw/zinc/16/94/32/1384169432.db2.gz	QOZJFZFTCICQNP-KRWDZBQOSA-N	0	3	345.487	3.140	20	30		EGEDHN
CC[C@@]1(C(C)C)C[C@@H]1C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001169730048	1384179585	/nfs/dbraw/zinc/17/95/85/1384179585.db2.gz	QXYUBYMTXROBFI-XLIONFOSSA-N	0	3	345.462	3.366	20	30		EGEDHN
CC[C@@H](SC)C(=O)N[C@H](C)CCCCNCc1ccccc1C#N	ZINC001170213284	1384266081	/nfs/dbraw/zinc/26/60/81/1384266081.db2.gz	XZBINRCBJHBICG-CRAIPNDOSA-N	0	3	347.528	3.464	20	30		EGEDHN
C#CCCCC(=O)N[C@@H](C)CCCCNCc1ccn(C(C)C)n1	ZINC001170453132	1384323278	/nfs/dbraw/zinc/32/32/78/1384323278.db2.gz	IMODFLRDOQNZBA-KRWDZBQOSA-N	0	3	332.492	3.032	20	30		EGEDHN
C[C@H](N)c1ncc(-c2ccccc2)n1-c1cc(Cl)nc(CC#N)n1	ZINC001170680568	1384363794	/nfs/dbraw/zinc/36/37/94/1384363794.db2.gz	YWWLCUIQOPQEQG-NSHDSACASA-N	0	3	338.802	3.068	20	30		EGEDHN
Cc1csc(CNCCCC[C@@H](C)NC(=O)C#CC(C)(C)C)n1	ZINC001170710219	1384371795	/nfs/dbraw/zinc/37/17/95/1384371795.db2.gz	NDXKVRIMVSSRHG-CQSZACIVSA-N	0	3	335.517	3.266	20	30		EGEDHN
N#Cc1cccc([C@H](O)CN2CC[C@@]3(C2)CCc2ccccc2O3)c1	ZINC001170733055	1384374935	/nfs/dbraw/zinc/37/49/35/1384374935.db2.gz	PTCDSUPGTBRXTM-TZIWHRDSSA-N	0	3	334.419	3.061	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H](C)CCCCNCc1cn(C(C)C)nn1	ZINC001171008513	1384428763	/nfs/dbraw/zinc/42/87/63/1384428763.db2.gz	NHKBPDHECVTROB-MRXNPFEDSA-N	0	3	349.523	3.226	20	30		EGEDHN
C=CCOC(=O)N[C@H]1CCCN([C@H]2CCc3cccc(F)c3C2)C1	ZINC001171014288	1384429626	/nfs/dbraw/zinc/42/96/26/1384429626.db2.gz	XRQWBTJSCTVJTJ-HOTGVXAUSA-N	0	3	332.419	3.060	20	30		EGEDHN
CC(C)C[C@H]([NH2+][C@H]1CCc2cc(Cl)c(Cl)cc2C1)C(=O)N[O-]	ZINC001171149633	1384454964	/nfs/dbraw/zinc/45/49/64/1384454964.db2.gz	KCBDPJFLDVMJOS-WFASDCNBSA-N	0	3	345.270	3.360	20	30		EGEDHN
N=C(Nc1ccc(-n2ccnc2)nc1)c1ccc2cc(O)ccc2c1	ZINC001171182906	1384462249	/nfs/dbraw/zinc/46/22/49/1384462249.db2.gz	WHJLQCMUBLSXAF-UHFFFAOYSA-N	0	3	329.363	3.163	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1CC[C@@](O)(C(F)(F)F)[C@H](C)C1	ZINC001171208836	1384469099	/nfs/dbraw/zinc/46/90/99/1384469099.db2.gz	FRTCZKDKTGJJMN-IOASZLSFSA-N	0	3	326.362	3.124	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H](C)CCCCNCc1cc(C)no1	ZINC001171259955	1384481064	/nfs/dbraw/zinc/48/10/64/1384481064.db2.gz	BTBHYSSDOJEOEY-OAHLLOKOSA-N	0	3	344.459	3.049	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)NCCCNCc2ccc(C#N)cc2F)CC1	ZINC001171661549	1384593941	/nfs/dbraw/zinc/59/39/41/1384593941.db2.gz	NMHDZWCFESGHNU-KOMQPUFPSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CN([C@H]3Cc4cccc(F)c4C3)C2)CC1	ZINC001171795490	1384639650	/nfs/dbraw/zinc/63/96/50/1384639650.db2.gz	XMRFUGSHTFEZQM-INIZCTEOSA-N	0	3	344.430	3.013	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1scnc1CC	ZINC001316872316	1384657311	/nfs/dbraw/zinc/65/73/11/1384657311.db2.gz	BKCHQZGSYWZROM-GXTWGEPZSA-N	0	3	341.908	3.431	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1cccc2cn[nH]c21	ZINC001316877986	1384662636	/nfs/dbraw/zinc/66/26/36/1384662636.db2.gz	LFQDHKMDTCCTKF-XJKSGUPXSA-N	0	3	346.862	3.288	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1cccc2c[nH]nc21	ZINC001316877986	1384662639	/nfs/dbraw/zinc/66/26/39/1384662639.db2.gz	LFQDHKMDTCCTKF-XJKSGUPXSA-N	0	3	346.862	3.288	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)NCc1ccncc1Br	ZINC001172296883	1384762575	/nfs/dbraw/zinc/76/25/75/1384762575.db2.gz	JRHCHUQDEDPSHQ-GFCCVEGCSA-N	0	3	330.229	3.437	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)N1CCN(Cc2ccc(F)cc2)CC1	ZINC001172309691	1384765064	/nfs/dbraw/zinc/76/50/64/1384765064.db2.gz	VZFLFKYVNORYPF-QGZVFWFLSA-N	0	3	337.442	3.446	20	30		EGEDHN
CCOC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1[C@@H](C)Cc1ccc(C#N)cc1	ZINC001172311762	1384766271	/nfs/dbraw/zinc/76/62/71/1384766271.db2.gz	XOSBXCSIOKMQIF-QZHFEQFPSA-N	0	3	326.440	3.153	20	30		EGEDHN
CC[C@H](N[C@H]1CCN(C(=O)OC(C)(C)C)[C@H](C#N)C1)c1cccnc1	ZINC001172973693	1384893533	/nfs/dbraw/zinc/89/35/33/1384893533.db2.gz	GVBXYIZNGPMTTI-ULQDDVLXSA-N	0	3	344.459	3.414	20	30		EGEDHN
C=CCOC1CCC(N2CCN(c3nc4ccccc4o3)CC2)CC1	ZINC001173321133	1384957687	/nfs/dbraw/zinc/95/76/87/1384957687.db2.gz	XIIQAIMALIXLGW-UHFFFAOYSA-N	0	3	341.455	3.464	20	30		EGEDHN
C=CCCCC(=O)N1CCCC[C@@H]1CNCc1cnn(C(C)(C)C)c1	ZINC001317191270	1384965087	/nfs/dbraw/zinc/96/50/87/1384965087.db2.gz	CRVHODLDBFTKPE-GOSISDBHSA-N	0	3	346.519	3.465	20	30		EGEDHN
COC(=O)c1ccccc1N1CCN(C2CCC(C)(C#N)CC2)CC1	ZINC001173599301	1384985285	/nfs/dbraw/zinc/98/52/85/1384985285.db2.gz	JRXLYNQYIXKLTP-UHFFFAOYSA-N	0	3	341.455	3.068	20	30		EGEDHN
C=C(Br)CN[C@@H](C)CCNC(=O)[C@@H](C)C1CCCC1	ZINC001317412231	1385123100	/nfs/dbraw/zinc/12/31/00/1385123100.db2.gz	YFUUUWUIRAWBDU-STQMWFEESA-N	0	3	331.298	3.206	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](C)CCCCNCc1cc2n(n1)CCC2	ZINC001174671800	1385132024	/nfs/dbraw/zinc/13/20/24/1385132024.db2.gz	HJJFWAMDTYOHGB-INIZCTEOSA-N	0	3	346.519	3.196	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H](C)CCCCNCc1nnc(C(C)C)[nH]1	ZINC001174848637	1385159223	/nfs/dbraw/zinc/15/92/23/1385159223.db2.gz	FJBNJOBGIANULE-JKSUJKDBSA-N	0	3	349.523	3.295	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H](C)CCCCNCc1cc(C)n(C)n1	ZINC001175081940	1385191715	/nfs/dbraw/zinc/19/17/15/1385191715.db2.gz	LBBPZPBNVONLEW-KXBFYZLASA-N	0	3	334.508	3.095	20	30		EGEDHN
CCN(CCNC(=O)c1ccc(F)cc1C)Cc1cccc(C#N)c1	ZINC001317491541	1385191956	/nfs/dbraw/zinc/19/19/56/1385191956.db2.gz	ZTHSFGINFHOTAB-UHFFFAOYSA-N	0	3	339.414	3.258	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1ccc(Cl)s1	ZINC001175280067	1385239389	/nfs/dbraw/zinc/23/93/89/1385239389.db2.gz	CJUFKTUHZBVRCB-UHFFFAOYSA-N	0	3	337.670	3.020	20	30		EGEDHN
CCCN(CCNC(=O)c1cc(C#N)c[nH]1)Cc1ccc(Cl)cc1	ZINC001317539471	1385274553	/nfs/dbraw/zinc/27/45/53/1385274553.db2.gz	XTTUANJNISGEAB-UHFFFAOYSA-N	0	3	344.846	3.182	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H](C)CCCCNCc1cc(C)n(C)n1	ZINC001175467896	1385299903	/nfs/dbraw/zinc/29/99/03/1385299903.db2.gz	ACQRJOUBAQLOFX-OAHLLOKOSA-N	0	3	334.508	3.095	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)[C@@H]1C[C@H]1C1CC1	ZINC001175643691	1385361334	/nfs/dbraw/zinc/36/13/34/1385361334.db2.gz	FOZJIVHRAUNHFU-UIAACRFSSA-N	0	3	339.483	3.369	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)c1nccs1	ZINC001175848098	1385421151	/nfs/dbraw/zinc/42/11/51/1385421151.db2.gz	LSROCFPZEDLADP-AWEZNQCLSA-N	0	3	342.468	3.093	20	30		EGEDHN
C=C[C@H](CC(=O)NCCCNCc1ccc(F)cn1)c1ccccc1	ZINC001176762419	1385688007	/nfs/dbraw/zinc/68/80/07/1385688007.db2.gz	BEUWIGICSXRWCX-MRXNPFEDSA-N	0	3	341.430	3.177	20	30		EGEDHN
Cc1ccccc1[C@H](C)C(=O)NCCCNCc1ccccc1C#N	ZINC001176790429	1385700255	/nfs/dbraw/zinc/70/02/55/1385700255.db2.gz	MRJPFASTMKGMTG-KRWDZBQOSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@@H]1CCCCC1(C)C	ZINC001177192958	1385855225	/nfs/dbraw/zinc/85/52/25/1385855225.db2.gz	XBXNNHCCVUJKFH-ZDUSSCGKSA-N	0	3	331.298	3.207	20	30		EGEDHN
C=CCCC(=O)N(CCCNCc1cnc(C)cn1)CC1CCCC1	ZINC001177245726	1385883042	/nfs/dbraw/zinc/88/30/42/1385883042.db2.gz	GCLLAUYMQLWDRZ-UHFFFAOYSA-N	0	3	344.503	3.250	20	30		EGEDHN
C[C@@H](C#N)C(=O)N[C@H]1CC[C@H](NCc2nc(C(C)(C)C)cs2)CC1	ZINC001318948138	1385892656	/nfs/dbraw/zinc/89/26/56/1385892656.db2.gz	OEAGNZSPRXYBFT-IHRRRGAJSA-N	0	3	348.516	3.117	20	30		EGEDHN
C[C@@H]1CCCC[C@H]1CC(=O)NCCCNCc1ccccc1C#N	ZINC001177309869	1385908307	/nfs/dbraw/zinc/90/83/07/1385908307.db2.gz	JRAFEWZVKIQUTD-SJORKVTESA-N	0	3	327.472	3.371	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N(CCCNCC(=C)Cl)CC1CCCC1	ZINC001177495792	1385979285	/nfs/dbraw/zinc/97/92/85/1385979285.db2.gz	GLGQAIXJQVQZLS-MRXNPFEDSA-N	0	3	342.911	3.329	20	30		EGEDHN
C=CCC[C@@H](C(=O)NCCCNCc1cnoc1C)c1ccccc1	ZINC001177552177	1385995302	/nfs/dbraw/zinc/99/53/02/1385995302.db2.gz	ADNSZZBDQXQEOO-LJQANCHMSA-N	0	3	341.455	3.329	20	30		EGEDHN
Cc1cc(N)cc2sc(=N)n(C(=O)C(C#N)Cc3cccs3)c21	ZINC001177912159	1386080663	/nfs/dbraw/zinc/08/06/63/1386080663.db2.gz	LVOSIWYZBURONS-JTQLQIEISA-N	0	3	342.449	3.157	20	30		EGEDHN
C[C@H](C#N)C(=O)NC1(CNCc2ccc(Cl)cc2F)CCCC1	ZINC001698628067	1406270338	/nfs/dbraw/zinc/27/03/38/1406270338.db2.gz	PRFKAEYWKXZXMG-GFCCVEGCSA-N	0	3	337.826	3.157	20	30		EGEDHN
N#Cc1ccccc1CNCCCCCCNC(=O)c1cncs1	ZINC001177937735	1386089647	/nfs/dbraw/zinc/08/96/47/1386089647.db2.gz	MKXFMZUQWMEBRM-UHFFFAOYSA-N	0	3	342.468	3.095	20	30		EGEDHN
C=CCOCCCC(=O)N1CC[C@H](NCc2cc(C)ccc2F)[C@@H]1C	ZINC001178435055	1386216182	/nfs/dbraw/zinc/21/61/82/1386216182.db2.gz	VLTUBQBKMFEFMP-LPHOPBHVSA-N	0	3	348.462	3.196	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2cccc(Cl)c2)CCN1C(=O)C1=CCCC1	ZINC001178459833	1386224018	/nfs/dbraw/zinc/22/40/18/1386224018.db2.gz	XZZLNOUHEVIEIV-KXBFYZLASA-N	0	3	342.870	3.381	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCCCCCCN[C@H](C)c1nnc(C)[nH]1	ZINC001179335220	1386453937	/nfs/dbraw/zinc/45/39/37/1386453937.db2.gz	HNZBFTGDXRUVPP-HUUCEWRRSA-N	0	3	335.496	3.043	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCCCCCCN[C@@H](C)c1nnc(CC)[nH]1	ZINC001179339573	1386455670	/nfs/dbraw/zinc/45/56/70/1386455670.db2.gz	HUPFBLQWYHBPAB-CVEARBPZSA-N	0	3	349.523	3.297	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@@H]1C	ZINC001179363893	1386463960	/nfs/dbraw/zinc/46/39/60/1386463960.db2.gz	ABOHYICYFRGZTN-UWVAXJGDSA-N	0	3	342.458	3.359	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H](NCc2cn(C(C)C)nc2C)[C@@H]1C	ZINC001179384673	1386469950	/nfs/dbraw/zinc/46/99/50/1386469950.db2.gz	TWTADNXLYKIUKU-AYBZRNKSSA-N	0	3	346.519	3.454	20	30		EGEDHN
N#Cc1ccccc1CNCCCCCCNC(=O)[C@@H]1CC[C@H](F)C1	ZINC001179388041	1386470820	/nfs/dbraw/zinc/47/08/20/1386470820.db2.gz	LJOLUIOHSWXMLX-APWZRJJASA-N	0	3	345.462	3.463	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)C1CCC(F)CC1	ZINC001179481419	1386494057	/nfs/dbraw/zinc/49/40/57/1386494057.db2.gz	GZHIIJOGFCTDPR-ACAXCVFMSA-N	0	3	342.458	3.145	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCCCCCNCc1nccn1CC	ZINC001179481491	1386494193	/nfs/dbraw/zinc/49/41/93/1386494193.db2.gz	GKPFLXHGVVGWFJ-IBGZPJMESA-N	0	3	334.508	3.272	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NCCCCCCNC/C(Cl)=C\Cl	ZINC001180433172	1386794873	/nfs/dbraw/zinc/79/48/73/1386794873.db2.gz	CYDZQQIOCXKURP-UQRISPGASA-N	0	3	337.291	3.163	20	30		EGEDHN
C=CCC[C@@H](C)[NH2+]C[C@]1(C)CN(C(=O)c2ccccc2[O-])C[C@H]1C	ZINC001180640716	1386854742	/nfs/dbraw/zinc/85/47/42/1386854742.db2.gz	UMXDHSKVJPCREI-JXXFODFXSA-N	0	3	330.472	3.435	20	30		EGEDHN
C[C@@H]1CN(C(=O)C#CC(C)(C)C)C[C@@]1(C)CNC/C(Cl)=C\Cl	ZINC001181420051	1386992059	/nfs/dbraw/zinc/99/20/59/1386992059.db2.gz	ZRPNNDGLEABHCV-ABPQQPFJSA-N	0	3	345.314	3.429	20	30		EGEDHN
CCC[C@H](C)CC(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001181500469	1387005245	/nfs/dbraw/zinc/00/52/45/1387005245.db2.gz	CMLSGJIPDGRAOW-WMLDXEAASA-N	0	3	331.435	3.214	20	30		EGEDHN
CCCCN(CC)[C@@H](C(=O)N1C[C@@H](F)C[C@H]1C#N)c1ccccc1	ZINC001182233605	1387128397	/nfs/dbraw/zinc/12/83/97/1387128397.db2.gz	IRPFSPFCDIZYEZ-OKZBNKHCSA-N	0	3	331.435	3.312	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2cnc(C)o2)C1	ZINC001182305768	1387143804	/nfs/dbraw/zinc/14/38/04/1387143804.db2.gz	OKDSJZWGZZIFOR-SPYBWZPUSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](C)[C@](C)(CNCc3oc(C)nc3C)C2)C1	ZINC001182558739	1387187456	/nfs/dbraw/zinc/18/74/56/1387187456.db2.gz	SVHCYJNQMSMPKK-JLTOFOAXSA-N	0	3	345.487	3.222	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](NCc2ccc(Cl)nc2)C1	ZINC001182818454	1387228986	/nfs/dbraw/zinc/22/89/86/1387228986.db2.gz	GHOZKFBBQKUZAL-MRXNPFEDSA-N	0	3	333.863	3.194	20	30		EGEDHN
C[C@H](CC(=O)N1CCC[C@@H]1CNCC#Cc1ccccc1)n1cccc1	ZINC001698746725	1406397998	/nfs/dbraw/zinc/39/79/98/1406397998.db2.gz	VSDGRCXIHVREDL-TZIWHRDSSA-N	0	3	349.478	3.072	20	30		EGEDHN
C=CCn1c([C@H](CC)OCC)nnc1N1CCN(C(C)(C)CC)CC1	ZINC001338990527	1389853037	/nfs/dbraw/zinc/85/30/37/1389853037.db2.gz	XBZZGALLUUJCSD-INIZCTEOSA-N	0	3	349.523	3.262	20	30		EGEDHN
CCn1c([C@@H](C)CCC#N)nnc1N1CCN(CCC(C)(C)C)CC1	ZINC001339746343	1390128023	/nfs/dbraw/zinc/12/80/23/1390128023.db2.gz	QKHRJBNFJVBYNK-INIZCTEOSA-N	0	3	346.523	3.263	20	30		EGEDHN
C=CCn1c([C@@H](C)OC(C)(C)C)nnc1N1CCN([C@@H](C)CC)CC1	ZINC001339775580	1390140089	/nfs/dbraw/zinc/14/00/89/1390140089.db2.gz	WMBVYYXXZOXDJH-JKSUJKDBSA-N	0	3	349.523	3.261	20	30		EGEDHN
CC(C)(C)[C@@H](CNCc1cc(C#N)ccc1F)NC(=O)C(C)(C)F	ZINC001332755186	1390181407	/nfs/dbraw/zinc/18/14/07/1390181407.db2.gz	YPAZWIREIRAOQE-OAHLLOKOSA-N	0	3	337.414	3.066	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc(OCC2CCOCC2)cc1	ZINC001340078336	1390221810	/nfs/dbraw/zinc/22/18/10/1390221810.db2.gz	ARULBAPGLDNSDX-SFHVURJKSA-N	0	3	332.444	3.114	20	30		EGEDHN
C[C@@H](CNCc1ccccc1C#N)CNC(=O)[C@H]1CCCC(F)(F)C1	ZINC001698769279	1406427758	/nfs/dbraw/zinc/42/77/58/1406427758.db2.gz	XWVCCVAFRFFTIY-GJZGRUSLSA-N	0	3	349.425	3.226	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1cc(F)ccc1OCC(F)(F)F	ZINC001341310926	1390469370	/nfs/dbraw/zinc/46/93/70/1390469370.db2.gz	WUBSDDUJUIUVSJ-LLVKDONJSA-N	0	3	334.313	3.389	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N1CCC[C@H]1c1nc2ccccc2n1CC	ZINC001343410398	1390712172	/nfs/dbraw/zinc/71/21/72/1390712172.db2.gz	YMUMKZKJESAELO-QAPCUYQASA-N	0	3	340.471	3.403	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)NC[C@H](Cc1ccccc1)c1ccccn1	ZINC001343459769	1390715464	/nfs/dbraw/zinc/71/54/64/1390715464.db2.gz	PWOJCSZEHMPZKN-RBUKOAKNSA-N	0	3	337.467	3.208	20	30		EGEDHN
CSc1ccc(CCC(=O)C(C#N)C(=O)NC2CCCCC2)cc1	ZINC001343581677	1390724257	/nfs/dbraw/zinc/72/42/57/1390724257.db2.gz	CSXMHUUVSVKWMJ-QGZVFWFLSA-N	0	3	344.480	3.499	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)[C@H]2CCC[C@H]2OC)cc1	ZINC001343590165	1390724814	/nfs/dbraw/zinc/72/48/14/1390724814.db2.gz	LODGWTMBSOKVMN-RCCFBDPRSA-N	0	3	342.439	3.492	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)c2ccsc2)CCCC1	ZINC001698793518	1406458418	/nfs/dbraw/zinc/45/84/18/1406458418.db2.gz	JPPZPOIYEKKSNB-UHFFFAOYSA-N	0	3	343.290	3.289	20	30		EGEDHN
Cn1ncc(C(=O)C(C#N)c2nccn2Cc2ccccc2)c1C1CC1	ZINC001343841584	1390739310	/nfs/dbraw/zinc/73/93/10/1390739310.db2.gz	FYKRSBVKKJSCJZ-INIZCTEOSA-N	0	3	345.406	3.032	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)c1cc(-c2ccc(C)c(C)c2)[nH]n1	ZINC001345647322	1390871973	/nfs/dbraw/zinc/87/19/73/1390871973.db2.gz	WGQFHZFXSOINLQ-OAHLLOKOSA-N	0	3	333.395	3.400	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cc3ncccc3o2)CCCC1	ZINC001698799068	1406472494	/nfs/dbraw/zinc/47/24/94/1406472494.db2.gz	IUXNXRVVKVHTNF-UHFFFAOYSA-N	0	3	333.819	3.213	20	30		EGEDHN
C#CC[C@H](CC)c1nnc(N2CCN([C@@H](C)CC)CC2)n1CC1CC1	ZINC001351432743	1391639315	/nfs/dbraw/zinc/63/93/15/1391639315.db2.gz	CWKGSZXDELOUJG-WMZOPIPTSA-N	0	3	343.519	3.126	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)NCc1ccc2c(c1)nc(CC)n2C1CC1	ZINC001353870173	1392103964	/nfs/dbraw/zinc/10/39/64/1392103964.db2.gz	RUYGTWCGJAHXTF-MRXNPFEDSA-N	0	3	340.471	3.233	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N1CCO[C@@H](c2c(F)cccc2Cl)C1	ZINC001354145792	1392122956	/nfs/dbraw/zinc/12/29/56/1392122956.db2.gz	QTZQTWIYMLXQQI-HUUCEWRRSA-N	0	3	340.826	3.063	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1cc(C2CC2)n[nH]1	ZINC001479829012	1392415806	/nfs/dbraw/zinc/41/58/06/1392415806.db2.gz	ICWDQBYTMRXOSG-MLGOLLRUSA-N	0	3	336.867	3.012	20	30		EGEDHN
CCCC1(C(=O)NC[C@@H]2CCCN(Cc3ccc(C#N)cc3)C2)CC1	ZINC001480263532	1392647581	/nfs/dbraw/zinc/64/75/81/1392647581.db2.gz	UDZRRFJVJNPYIR-IBGZPJMESA-N	0	3	339.483	3.467	20	30		EGEDHN
C[C@H](NC(=O)CCCF)[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001480384684	1392728342	/nfs/dbraw/zinc/72/83/42/1392728342.db2.gz	XJKDXCFRUBKDGT-YJBOKZPZSA-N	0	3	331.435	3.025	20	30		EGEDHN
CCN(CCNC(=O)c1cc(C)ccc1F)Cc1ccc(C#N)cc1	ZINC001481002828	1393081891	/nfs/dbraw/zinc/08/18/91/1393081891.db2.gz	RFIONMUQBLCRTB-UHFFFAOYSA-N	0	3	339.414	3.258	20	30		EGEDHN
C=CCCCCCN1CC[C@@H](NC(=O)c2csc(Cl)n2)C1	ZINC001490567729	1394267583	/nfs/dbraw/zinc/26/75/83/1394267583.db2.gz	CDWWVZRBLRQDCG-GFCCVEGCSA-N	0	3	327.881	3.347	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCCN(C(=O)CCCF)C1	ZINC001490768976	1394332402	/nfs/dbraw/zinc/33/24/02/1394332402.db2.gz	XRSWUMMLVIRYCO-AWEZNQCLSA-N	0	3	337.464	3.040	20	30		EGEDHN
C[C@@H](CNCc1ccccc1C#N)CNC(=O)CCCC(F)(F)F	ZINC001482142538	1394767629	/nfs/dbraw/zinc/76/76/29/1394767629.db2.gz	MJYPYGSQDSRSCD-ZDUSSCGKSA-N	0	3	341.377	3.133	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)c1cc(C#N)c[nH]1)NCc1ccccc1Cl	ZINC001698962201	1406716779	/nfs/dbraw/zinc/71/67/79/1406716779.db2.gz	XIHZQHIJPXEMNE-QGZVFWFLSA-N	0	3	344.846	3.084	20	30		EGEDHN
CC(C)[C@H](CNC(=O)c1cc(C#N)c[nH]1)NCc1ccccc1Cl	ZINC001698962200	1406716892	/nfs/dbraw/zinc/71/68/92/1406716892.db2.gz	XIHZQHIJPXEMNE-KRWDZBQOSA-N	0	3	344.846	3.084	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cccc2ccncc21)C(C)C	ZINC001698977342	1406748289	/nfs/dbraw/zinc/74/82/89/1406748289.db2.gz	HMBWFICQUDSYBF-QGZVFWFLSA-N	0	3	331.847	3.331	20	30		EGEDHN
C=C(Cl)C[NH2+]C[C@H]1CC[C@H](CNC(=O)c2ccccc2[O-])CC1	ZINC001484392381	1395363935	/nfs/dbraw/zinc/36/39/35/1395363935.db2.gz	OUNKLOXEGCIEEH-SHTZXODSSA-N	0	3	336.863	3.271	20	30		EGEDHN
CN(CCCN(C)C(=O)CC(C)(C)C)Cc1ccc(F)c(C#N)c1	ZINC001484732848	1395494312	/nfs/dbraw/zinc/49/43/12/1395494312.db2.gz	IXXCACLXOZLIIF-UHFFFAOYSA-N	0	3	333.451	3.414	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1c[nH]nc1C(C)(C)C	ZINC001485264383	1395749005	/nfs/dbraw/zinc/74/90/05/1395749005.db2.gz	MOMZCFNCFVMNCT-UHFFFAOYSA-N	0	3	340.899	3.148	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)C[C@@H](C)SC)CC1	ZINC001505395131	1396282460	/nfs/dbraw/zinc/28/24/60/1396282460.db2.gz	ABIWDIJTCPCGHV-CQSZACIVSA-N	0	3	332.941	3.441	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)[C@H](OCC)C2CC2)CC1	ZINC001505396892	1396284953	/nfs/dbraw/zinc/28/49/53/1396284953.db2.gz	UIGADXKZCGRGSU-QGZVFWFLSA-N	0	3	342.911	3.115	20	30		EGEDHN
C[C@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)C(C)(C)C1CCC1	ZINC001496131990	1396608599	/nfs/dbraw/zinc/60/85/99/1396608599.db2.gz	YLLGAGCWLRBISV-CQSZACIVSA-N	0	3	345.462	3.460	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](C)CNCc2ccc(F)c(C#N)c2)sc1C	ZINC001497981491	1396901689	/nfs/dbraw/zinc/90/16/89/1396901689.db2.gz	JHBFKJYBBZIUDE-GFCCVEGCSA-N	0	3	345.443	3.284	20	30		EGEDHN
CCCC(C)(C)C(=O)NC[C@@H](NCc1ccc(C#N)s1)C1CC1	ZINC001690167566	1404366008	/nfs/dbraw/zinc/36/60/08/1404366008.db2.gz	WAFVDDQWNANYGE-MRXNPFEDSA-N	0	3	333.501	3.430	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)Cc1cccc(Cl)c1F	ZINC001690865132	1404783794	/nfs/dbraw/zinc/78/37/94/1404783794.db2.gz	FMVQKZWUDWMMBL-LLVKDONJSA-N	0	3	333.234	3.259	20	30		EGEDHN
CC(C)CCC(=O)NC[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001691764698	1405478408	/nfs/dbraw/zinc/47/84/08/1405478408.db2.gz	GISUYFUMQNBVDY-JCNLHEQBSA-N	0	3	331.435	3.118	20	30		EGEDHN
CCCC1(C(=O)NC[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)CC1	ZINC001691810955	1405524017	/nfs/dbraw/zinc/52/40/17/1405524017.db2.gz	PPRDOASMNKVGKD-JCNLHEQBSA-N	0	3	343.446	3.262	20	30		EGEDHN
CCN(CCNC(=O)[C@@H]1CCC(C)(C)C1)Cc1cccc(C#N)c1	ZINC001731811784	1427994583	/nfs/dbraw/zinc/99/45/83/1427994583.db2.gz	SQLDMZFJPLGHOL-GOSISDBHSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2c(C)noc2C)CCCC[C@@H]1C	ZINC001732254168	1428495488	/nfs/dbraw/zinc/49/54/88/1428495488.db2.gz	TUJDFWFNCQWEKP-APPDUMDISA-N	0	3	339.867	3.312	20	30		EGEDHN
Cc1ccc(C)c(C(=O)NC[C@@H](C)CNCc2ccccc2C#N)c1	ZINC001732369416	1428551604	/nfs/dbraw/zinc/55/16/04/1428551604.db2.gz	JWDKTGZBOQPKOA-INIZCTEOSA-N	0	3	335.451	3.331	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H]2Cc3cccc(C)c3O2)CCCC1	ZINC001732400536	1428566527	/nfs/dbraw/zinc/56/65/27/1428566527.db2.gz	SECFNGOQXPSLRC-INIZCTEOSA-N	0	3	348.874	3.070	20	30		EGEDHN
CCCc1ccc(C(=O)N[C@H](C)CNCc2ccc(C#N)s2)cc1	ZINC001699376175	1412683226	/nfs/dbraw/zinc/68/32/26/1412683226.db2.gz	GDARBIQQBSNDIJ-CQSZACIVSA-N	0	3	341.480	3.480	20	30		EGEDHN
Cc1coc(C(=O)N[C@H](CNCc2ccc(C#N)s2)C(C)(C)C)c1	ZINC001700996375	1414644715	/nfs/dbraw/zinc/64/47/15/1414644715.db2.gz	XRCFQNWPHVEFMX-MRXNPFEDSA-N	0	3	345.468	3.456	20	30		EGEDHN
CC(C)(C(=O)N[C@H]1CCC[C@@H]1CNCc1ccccc1C#N)C(F)F	ZINC001732625147	1428888514	/nfs/dbraw/zinc/88/85/14/1428888514.db2.gz	OYIRQRAOFQOVHA-CVEARBPZSA-N	0	3	349.425	3.224	20	30		EGEDHN
CC[C@H]1CC[C@H](C(=O)N[C@@H](C)CNCc2ccc(C#N)s2)CC1	ZINC001733020146	1429139133	/nfs/dbraw/zinc/13/91/33/1429139133.db2.gz	BXBQDNGHWFTGHM-KKUMJFAQSA-N	0	3	333.501	3.430	20	30		EGEDHN
C=C(Cn1c(C)nnc1N1C[C@H](C)N(CC)C[C@@H]1C)c1ccccc1	ZINC001705742081	1417133332	/nfs/dbraw/zinc/13/33/32/1417133332.db2.gz	JDWJADBQTLHBBB-IRXDYDNUSA-N	0	3	339.487	3.219	20	30		EGEDHN
Cc1oc(C)c(C(=O)N[C@@H](C)CN(C)Cc2ccc(C#N)cc2)c1C	ZINC001733045722	1429179082	/nfs/dbraw/zinc/17/90/82/1429179082.db2.gz	VGPBNTJLXKYVRT-ZDUSSCGKSA-N	0	3	339.439	3.327	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CCN(CCCOc2ccc(C)c(C)c2)C1	ZINC001713080349	1417626995	/nfs/dbraw/zinc/62/69/95/1417626995.db2.gz	FOSPMLSJYIKAKV-GOSISDBHSA-N	0	3	330.472	3.229	20	30		EGEDHN
CC1(C)CC(C(=O)NC[C@@H](NCc2cc(C#N)ccc2F)C2CC2)C1	ZINC001713109630	1417671070	/nfs/dbraw/zinc/67/10/70/1417671070.db2.gz	VPMCZQKFTWAMDO-GOSISDBHSA-N	0	3	343.446	3.118	20	30		EGEDHN
C[C@H](NC(=O)C(C)(C)F)[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001713272429	1417887841	/nfs/dbraw/zinc/88/78/41/1417887841.db2.gz	VOTLFVCWIBPEHN-YOEHRIQHSA-N	0	3	331.435	3.023	20	30		EGEDHN
C[C@@H](NC(=O)CC1(C)CC1)[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001713276369	1417897529	/nfs/dbraw/zinc/89/75/29/1417897529.db2.gz	UTJNVKBRBXWEDX-VQIMIIECSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@@H](C(=O)NC1(CNCc2cc(C#N)ccc2F)CCCC1)C1CC1	ZINC001714131770	1418934943	/nfs/dbraw/zinc/93/49/43/1418934943.db2.gz	CEIWPIFFKSELNC-CQSZACIVSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1nsc2ccc(C)cc21	ZINC001714485207	1419208492	/nfs/dbraw/zinc/20/84/92/1419208492.db2.gz	PNFPYUGLTDAVPX-GFCCVEGCSA-N	0	3	337.876	3.455	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2ccc(F)c(F)c2)CCCC1	ZINC001715091570	1419832484	/nfs/dbraw/zinc/83/24/84/1419832484.db2.gz	JKTHUJBHMNTNFX-UHFFFAOYSA-N	0	3	328.790	3.350	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)C3CCCCCC3)CC2)cc1	ZINC001733238069	1429379609	/nfs/dbraw/zinc/37/96/09/1429379609.db2.gz	GERWCPRUTFODBM-UHFFFAOYSA-N	0	3	325.456	3.267	20	30		EGEDHN
Cc1cccc(C(=O)NCC2(NCc3ccc(C#N)cc3)CC2)c1F	ZINC001733244635	1429388705	/nfs/dbraw/zinc/38/87/05/1429388705.db2.gz	SSQJQVIHALPVMB-UHFFFAOYSA-N	0	3	337.398	3.058	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)CCc1c(C)noc1Cl)C(C)C	ZINC001715511894	1420196076	/nfs/dbraw/zinc/19/60/76/1420196076.db2.gz	QPILAZDCZSMRJV-CYBMUJFWSA-N	0	3	348.274	3.052	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cnoc1-c1ccccc1)C(C)C	ZINC001715689147	1420295412	/nfs/dbraw/zinc/29/54/12/1420295412.db2.gz	DRYPJEPNYGEBIC-INIZCTEOSA-N	0	3	347.846	3.438	20	30		EGEDHN
CC(C)SCC(=O)N1CC[C@@H](NCc2ccccc2C#N)C[C@@H]1C	ZINC001716757104	1420906463	/nfs/dbraw/zinc/90/64/63/1420906463.db2.gz	HSVRZDITTAKVED-MAUKXSAKSA-N	0	3	345.512	3.169	20	30		EGEDHN
CC1(C(=O)NCC2(NCc3ccc(C#N)s3)CCC2)CCCC1	ZINC001717154471	1421144901	/nfs/dbraw/zinc/14/49/01/1421144901.db2.gz	ABWTVIIUKURLCQ-UHFFFAOYSA-N	0	3	331.485	3.329	20	30		EGEDHN
CC(C)SCC(=O)N[C@@H]1CCN(Cc2ccc(C#N)cc2)[C@H](C)C1	ZINC001717329763	1421265335	/nfs/dbraw/zinc/26/53/35/1421265335.db2.gz	MPCLYLULOJDWNL-CRAIPNDOSA-N	0	3	345.512	3.169	20	30		EGEDHN
CC(C)SCC(=O)N[C@H]1CCN(Cc2ccc(C#N)cc2)[C@H](C)C1	ZINC001717329765	1421265397	/nfs/dbraw/zinc/26/53/97/1421265397.db2.gz	MPCLYLULOJDWNL-QAPCUYQASA-N	0	3	345.512	3.169	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)c2ccsn2)CC1	ZINC001717355888	1421290610	/nfs/dbraw/zinc/29/06/10/1421290610.db2.gz	FEPXQKCSLPKMPC-UHFFFAOYSA-N	0	3	327.881	3.070	20	30		EGEDHN
C[C@@H](CNC(=O)CC(C1CC1)C1CC1)N(C)Cc1cccc(C#N)c1	ZINC001717500018	1421443405	/nfs/dbraw/zinc/44/34/05/1421443405.db2.gz	OIJYQUNSSLODHU-HNNXBMFYSA-N	0	3	339.483	3.321	20	30		EGEDHN
CCCC[C@H](CNCc1ccc(F)c(C#N)c1)NC(=O)C(C)(C)F	ZINC001717528125	1421463871	/nfs/dbraw/zinc/46/38/71/1421463871.db2.gz	NFVPVPDSHQUDRC-OAHLLOKOSA-N	0	3	337.414	3.210	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)c3cc4ccccc4o3)CC2)cc1	ZINC001723588015	1424476385	/nfs/dbraw/zinc/47/63/85/1424476385.db2.gz	MSBBZAHLWLJMOZ-UHFFFAOYSA-N	0	3	345.402	3.357	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)CCOC(C)C)CC2)C1	ZINC001723597272	1424484000	/nfs/dbraw/zinc/48/40/00/1424484000.db2.gz	LHIPOCLYEABPSY-QGZVFWFLSA-N	0	3	342.911	3.115	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1CCN(Cc2cccc(N(C)C)c2)C1	ZINC001731372423	1427302110	/nfs/dbraw/zinc/30/21/10/1427302110.db2.gz	TYFJDRBIDSGIOS-KRWDZBQOSA-N	0	3	329.488	3.045	20	30		EGEDHN
Cc1ccc(CCC(=O)NC[C@@H](C)NCc2ccc(C#N)s2)s1	ZINC001731642809	1427703413	/nfs/dbraw/zinc/70/34/13/1427703413.db2.gz	RNZGRSJXCAYZGR-GFCCVEGCSA-N	0	3	347.509	3.217	20	30		EGEDHN
CCCN(CCNC(=O)[C@@H](C)C1CCC1)Cc1ccc(C#N)cc1	ZINC001731866078	1428113683	/nfs/dbraw/zinc/11/36/83/1428113683.db2.gz	HFZNYCFYTNMMQG-INIZCTEOSA-N	0	3	327.472	3.323	20	30		EGEDHN
CCCN(CCNC(=O)C1CC2(CCC2)C1)Cc1cccc(C#N)c1	ZINC001731867934	1428118847	/nfs/dbraw/zinc/11/88/47/1428118847.db2.gz	BLSJQZPRGAFXDE-UHFFFAOYSA-N	0	3	339.483	3.467	20	30		EGEDHN
N#Cc1cc(CNC2(CNC(=O)C3(F)CCCC3)CCC2)ccc1F	ZINC001733719615	1429940077	/nfs/dbraw/zinc/94/00/77/1429940077.db2.gz	VAWRVUNDKDZIPU-UHFFFAOYSA-N	0	3	347.409	3.108	20	30		EGEDHN
CCCC(=O)N[C@H]1CCN(Cc2ccc(OCC#N)cc2)CC1(C)C	ZINC001733872998	1437699547	/nfs/dbraw/zinc/69/95/47/1437699547.db2.gz	WBDBVSFJAQNJLX-SFHVURJKSA-N	0	3	343.471	3.106	20	30		EGEDHN
C[C@@H](CNC(=O)CC(C)(C)C1CC1)N(C)Cc1cccc(C#N)c1	ZINC001734029635	1437817765	/nfs/dbraw/zinc/81/77/65/1437817765.db2.gz	BOEVRUWUHQNBRN-HNNXBMFYSA-N	0	3	327.472	3.321	20	30		EGEDHN
CCCC[C@@H](CNCc1ccc(C#N)s1)NC(=O)c1cscn1	ZINC001734097129	1437881331	/nfs/dbraw/zinc/88/13/31/1437881331.db2.gz	WUNDVKOGFIZKNH-LBPRGKRZSA-N	0	3	348.497	3.155	20	30		EGEDHN
CCCC(=O)NC[C@H]1CCCCCN1Cc1ccc(OCC#N)cc1	ZINC001734100857	1437885329	/nfs/dbraw/zinc/88/53/29/1437885329.db2.gz	PVFMYPDROFPWKC-GOSISDBHSA-N	0	3	343.471	3.250	20	30		EGEDHN
CN(CCCNC(=O)/C=C\C(C)(C)C)Cc1ccc(F)c(C#N)c1	ZINC001751953717	1440128159	/nfs/dbraw/zinc/12/81/59/1440128159.db2.gz	XMHQISIADBJOMT-HJWRWDBZSA-N	0	3	331.435	3.238	20	30		EGEDHN
Cc1cc[nH]c1C(=O)N1CCCC[C@H]1[C@H](C)NCC#Cc1ccccc1	ZINC001752144188	1440145441	/nfs/dbraw/zinc/14/54/41/1440145441.db2.gz	CFTCUFXOIXSZNV-ICSRJNTNSA-N	0	3	349.478	3.348	20	30		EGEDHN
C=C(C)CCC(=O)N1CCCC[C@H]1[C@H](C)NCc1cccnc1OC	ZINC001752146104	1440146010	/nfs/dbraw/zinc/14/60/10/1440146010.db2.gz	IXDWOJKQBWHWMC-WMZOPIPTSA-N	0	3	345.487	3.306	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1c(C)nsc1C	ZINC001752156792	1440147371	/nfs/dbraw/zinc/14/73/71/1440147371.db2.gz	MESNISOTYZLBLW-BXUZGUMPSA-N	0	3	341.908	3.485	20	30		EGEDHN
CCN(CC#Cc1ccc(F)cc1)CCCNC(=O)C1(CC)CC1	ZINC001752210036	1440154717	/nfs/dbraw/zinc/15/47/17/1440154717.db2.gz	HOMIOKIBZOFPOK-UHFFFAOYSA-N	0	3	330.447	3.196	20	30		EGEDHN
CC#CCN(CCCNC(=O)c1ccc(C(C)C)nc1CC)C1CC1	ZINC001752273853	1440163416	/nfs/dbraw/zinc/16/34/16/1440163416.db2.gz	GRNHDRITAPQOTF-UHFFFAOYSA-N	0	3	341.499	3.375	20	30		EGEDHN
CC(C)CCOCCN1CCC(N(C)C(=O)C#CC(C)(C)C)CC1	ZINC001752299881	1440167507	/nfs/dbraw/zinc/16/75/07/1440167507.db2.gz	OFFOZSVVYHZHEM-UHFFFAOYSA-N	0	3	336.520	3.021	20	30		EGEDHN
C=C1CCC(C(=O)NCCN2CCN(CC/C=C/CCC)CC2)CC1	ZINC001752373262	1440172362	/nfs/dbraw/zinc/17/23/62/1440172362.db2.gz	PNFMYWXJQOXNDV-AATRIKPKSA-N	0	3	347.547	3.213	20	30		EGEDHN
C=CCCCC(=O)NCCN1CCN([C@@H](C)c2ccccc2C)CC1	ZINC001752373153	1440172377	/nfs/dbraw/zinc/17/23/77/1440172377.db2.gz	NRPVBIXLYMTPEL-IBGZPJMESA-N	0	3	343.515	3.146	20	30		EGEDHN
C=CCOCC(=O)N[C@H]1CC12CCN([C@@H](C)c1ccccc1F)CC2	ZINC001752419019	1440175439	/nfs/dbraw/zinc/17/54/39/1440175439.db2.gz	BIUDDYQZOKTRPS-YJBOKZPZSA-N	0	3	346.446	3.060	20	30		EGEDHN
CCC[C@@H](C)C(=O)NC[C@@H](NCc1ccc(C#N)cc1F)C1CC1	ZINC001752452660	1440182631	/nfs/dbraw/zinc/18/26/31/1440182631.db2.gz	WFLMTMNMTLZSMT-FZKQIMNGSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)c1cc2cnccc2o1	ZINC001752538409	1440194364	/nfs/dbraw/zinc/19/43/64/1440194364.db2.gz	KGZDYDKNPLYSGS-BHYGNILZSA-N	0	3	339.439	3.471	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)c1cc(CCC)on1	ZINC001752543739	1440194861	/nfs/dbraw/zinc/19/48/61/1440194861.db2.gz	UGZJSPFXQUQSHC-OAGGEKHMSA-N	0	3	331.460	3.271	20	30		EGEDHN
O=C(N[C@H]1C[C@H](NCC#Cc2ccccc2)C1)[C@H]1CC[C@@H]2C[C@@H]2CC1	ZINC001752647808	1440197898	/nfs/dbraw/zinc/19/78/98/1440197898.db2.gz	UCSGWZHEOJHCQW-GZFFKNQQSA-N	0	3	336.479	3.101	20	30		EGEDHN
O=C(N[C@H]1C[C@H](NCC#Cc2ccccc2)C1)c1ccc2cc[nH]c2c1	ZINC001752669954	1440198781	/nfs/dbraw/zinc/19/87/81/1440198781.db2.gz	RIXHOFKEWWVCDT-MXVIHJGJSA-N	0	3	343.430	3.070	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)C[C@@H](C)c2ccc(OC)cc2)C1	ZINC001752687232	1440200022	/nfs/dbraw/zinc/20/00/22/1440200022.db2.gz	JYDQYKZRHNTVEH-DAXOMENPSA-N	0	3	336.863	3.178	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)C1(Cc2ccccc2F)CC1	ZINC001752824174	1440222648	/nfs/dbraw/zinc/22/26/48/1440222648.db2.gz	QUFIATAJMROAQR-SFHVURJKSA-N	0	3	342.458	3.142	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)COC[C@@H](C)c1ccccc1	ZINC001752825284	1440223230	/nfs/dbraw/zinc/22/32/30/1440223230.db2.gz	OXGHJECFZIGMLJ-UYAOXDASSA-N	0	3	344.499	3.354	20	30		EGEDHN
C=CCCOCC(=O)NC[C@H]1CCCCN1Cc1ccc(C)cc1C	ZINC001752826209	1440223775	/nfs/dbraw/zinc/22/37/75/1440223775.db2.gz	VYDHHSVOYXCIAL-HXUWFJFHSA-N	0	3	344.499	3.367	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)CCc2ccc(C)cc2C)C1	ZINC001752842558	1440231380	/nfs/dbraw/zinc/23/13/80/1440231380.db2.gz	XZOJBBSKYTZCCW-TZIWHRDSSA-N	0	3	340.511	3.476	20	30		EGEDHN
C=CCC1(C(=O)NC[C@H](C)N[C@@H](C)c2ccccc2F)CCOCC1	ZINC001752916195	1440247163	/nfs/dbraw/zinc/24/71/63/1440247163.db2.gz	KWZJEUNUFRXRER-HOTGVXAUSA-N	0	3	348.462	3.354	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](CNCc2ccn(C(C)C)n2)C1	ZINC001752937411	1440250587	/nfs/dbraw/zinc/25/05/87/1440250587.db2.gz	FCMAZJBAKGLUTA-INIZCTEOSA-N	0	3	332.492	3.004	20	30		EGEDHN
C=C(Cl)CNCCc1ccc(CNC(=O)C2CC3(CC3)C2)cc1	ZINC001752984499	1440257853	/nfs/dbraw/zinc/25/78/53/1440257853.db2.gz	AUMUMJCFPLQAEA-UHFFFAOYSA-N	0	3	332.875	3.378	20	30		EGEDHN
CC#CCN(C)[C@@H]1CCCN(C(=O)C[C@H]2CCCc3ccccc32)C1	ZINC001752996989	1440262535	/nfs/dbraw/zinc/26/25/35/1440262535.db2.gz	JZZITPZLIYLDME-WOJBJXKFSA-N	0	3	338.495	3.443	20	30		EGEDHN
CC#CCN(C)[C@@H]1CCCN(C(=O)C[C@H](C)c2cccc(OC)c2)C1	ZINC001752999813	1440263896	/nfs/dbraw/zinc/26/38/96/1440263896.db2.gz	ICKVBFDSEQDQRS-PKOBYXMFSA-N	0	3	342.483	3.135	20	30		EGEDHN
CC#CCN(C)[C@H]1CCCN(C(=O)[C@H](C)Cc2ccc(C)cc2)C1	ZINC001753000376	1440264316	/nfs/dbraw/zinc/26/43/16/1440264316.db2.gz	RVCGTGJEJQCXJX-QUCCMNQESA-N	0	3	326.484	3.120	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H]2CCCNC(=O)CC2CC2)c(F)c1	ZINC001753023290	1440270567	/nfs/dbraw/zinc/27/05/67/1440270567.db2.gz	QMZAUUGKMHSHEO-GOSISDBHSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCC[C@H]1CCCN1Cc1nccnc1C	ZINC001753033401	1440273695	/nfs/dbraw/zinc/27/36/95/1440273695.db2.gz	LVTHKLMSJATQCJ-FXAWDEMLSA-N	0	3	344.503	3.248	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCN(C)Cc2ccc3cc[nH]c3c2)cc1	ZINC001753059812	1440282906	/nfs/dbraw/zinc/28/29/06/1440282906.db2.gz	WBZDCSMXVMUXCS-UHFFFAOYSA-N	0	3	331.419	3.011	20	30		EGEDHN
CCN(CCNC(=O)CC1CCCCC1)Cc1cccc(C#N)c1	ZINC001753077685	1440292363	/nfs/dbraw/zinc/29/23/63/1440292363.db2.gz	DNQMIBLLAAVLAO-UHFFFAOYSA-N	0	3	327.472	3.467	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@@H]1CCN(Cc2oc(CC)nc2C)C1	ZINC001753132302	1440317281	/nfs/dbraw/zinc/31/72/81/1440317281.db2.gz	LYDDRJMTALHALM-CVEARBPZSA-N	0	3	333.476	3.086	20	30		EGEDHN
CCCN(CCNC(=O)[C@H]1C[C@H]2C[C@H]2C1)Cc1ccc(C#N)c(F)c1	ZINC001753147251	1440325277	/nfs/dbraw/zinc/32/52/77/1440325277.db2.gz	XQJVPVNBESTQRP-PIIMJCKOSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=CCOCC(=O)NCCN(C1CC1)[C@H]1CCc2ccc(Cl)cc21	ZINC001753152999	1440329280	/nfs/dbraw/zinc/32/92/80/1440329280.db2.gz	RJBXJZODPSDSJG-SFHVURJKSA-N	0	3	348.874	3.111	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCN(Cc2cc(C)cc(C)c2)C2CC2)nc1	ZINC001753162307	1440334742	/nfs/dbraw/zinc/33/47/42/1440334742.db2.gz	FDBOEOPVNSEOTL-UHFFFAOYSA-N	0	3	347.462	3.074	20	30		EGEDHN
CN(CCNCc1ccc(C#N)s1)C(=O)[C@@H]1C[C@H]1CC(C)(C)C	ZINC001753190643	1440337529	/nfs/dbraw/zinc/33/75/29/1440337529.db2.gz	MWTJXIBZWGHZSJ-XJKSGUPXSA-N	0	3	333.501	3.240	20	30		EGEDHN
C[C@H](C(=O)N(C)CCNCc1ccc(C#N)c(F)c1)c1ccsc1	ZINC001753230737	1440341142	/nfs/dbraw/zinc/34/11/42/1440341142.db2.gz	QCKKKCGTZRLETL-ZDUSSCGKSA-N	0	3	345.443	3.111	20	30		EGEDHN
CC[C@H](Cc1ccccc1)C(=O)N(C)CCNCc1ccc(C#N)cc1	ZINC001753237208	1440341675	/nfs/dbraw/zinc/34/16/75/1440341675.db2.gz	VXYCOBKKRTUNEB-OAQYLSRUSA-N	0	3	349.478	3.375	20	30		EGEDHN
CN(CCNCc1cccc(C#N)c1)C(=O)[C@@]1(C)C[C@@H]1c1ccccc1	ZINC001753240225	1440341951	/nfs/dbraw/zinc/34/19/51/1440341951.db2.gz	KNXKZFUTIVUQMP-IRLDBZIGSA-N	0	3	347.462	3.300	20	30		EGEDHN
Cc1ccccc1C[C@H](C)C(=O)N(C)CCNCc1cccc(C#N)c1	ZINC001753266327	1440344758	/nfs/dbraw/zinc/34/47/58/1440344758.db2.gz	JSZOZCWYSMFTFZ-SFHVURJKSA-N	0	3	349.478	3.294	20	30		EGEDHN
C=C(C)CN[C@@H](CNC(=O)[C@]1(F)CCOC1)c1ccc(C(C)C)cc1	ZINC001753294541	1440351793	/nfs/dbraw/zinc/35/17/93/1440351793.db2.gz	PBNZSJLMXMFZQL-ICSRJNTNSA-N	0	3	348.462	3.262	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@H](NCCOC2CCC2)c2ccccc2)C1	ZINC001753301968	1440354222	/nfs/dbraw/zinc/35/42/22/1440354222.db2.gz	RICCBVXFNVAXMP-IBGZPJMESA-N	0	3	342.483	3.359	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CCC)C(=O)c2ncnc3sccc32)C1	ZINC001753316769	1440360098	/nfs/dbraw/zinc/36/00/98/1440360098.db2.gz	ZUFOLMMFKKZTGT-CQSZACIVSA-N	0	3	344.484	3.194	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CCC)C(=O)CCOc2ccccc2C)C1	ZINC001753321707	1440363865	/nfs/dbraw/zinc/36/38/65/1440363865.db2.gz	CJBKQKDWVZQIEE-LJQANCHMSA-N	0	3	342.483	3.100	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CCC)C(=O)[C@H](C)Oc2ccc(C)cc2)C1	ZINC001753323882	1440365471	/nfs/dbraw/zinc/36/54/71/1440365471.db2.gz	SGGCPKLUZDGBGO-RBUKOAKNSA-N	0	3	342.483	3.099	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CCC)C(=O)[C@@H](C)OC2CCCCCC2)C1	ZINC001753328923	1440368258	/nfs/dbraw/zinc/36/82/58/1440368258.db2.gz	QJLCZNWOSXXBGA-RTBURBONSA-N	0	3	348.531	3.451	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](CN(C)Cc2c(C)onc2CC)C1	ZINC001753355325	1440379638	/nfs/dbraw/zinc/37/96/38/1440379638.db2.gz	PPWFUGUIZLFCGL-MRXNPFEDSA-N	0	3	333.476	3.182	20	30		EGEDHN
C=CCCCC(=O)N1CCC(CN(C)[C@H](C)c2cnccn2)CC1	ZINC001753365325	1440384788	/nfs/dbraw/zinc/38/47/88/1440384788.db2.gz	CJAMLIWRUODOMC-MRXNPFEDSA-N	0	3	330.476	3.064	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)CCCOc1ccccc1C	ZINC001753423154	1440395846	/nfs/dbraw/zinc/39/58/46/1440395846.db2.gz	YGKSDBDYYIXSRC-OALUTQOASA-N	0	3	342.483	3.405	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H]2C[C@H]1CN2C(=O)c1ncccc1OCCC	ZINC001753424133	1440395991	/nfs/dbraw/zinc/39/59/91/1440395991.db2.gz	MDSJRFRRLDVLRF-ULQDDVLXSA-N	0	3	343.471	3.124	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H]2C[C@H]1CN2C(=O)COc1ccc(C)cc1C	ZINC001753427895	1440397475	/nfs/dbraw/zinc/39/74/75/1440397475.db2.gz	OWQQPFVYMCVXBP-QYZOEREBSA-N	0	3	342.483	3.322	20	30		EGEDHN
C=CCCCC(=O)N(C)[C@H]1CCN(Cc2cccc(OC)c2C)C1	ZINC001753441575	1440402036	/nfs/dbraw/zinc/40/20/36/1440402036.db2.gz	LWRISPGUVMDYFT-SFHVURJKSA-N	0	3	330.472	3.393	20	30		EGEDHN
C=CCOCCN1CC[C@H](N(C)C(=O)C[C@H](C)c2ccccc2C)C1	ZINC001753445535	1440403766	/nfs/dbraw/zinc/40/37/66/1440403766.db2.gz	OADSKFHMKGIUFH-OALUTQOASA-N	0	3	344.499	3.224	20	30		EGEDHN
C=CCCC(=O)N(CC)[C@@H]1CCN(CCOc2cccc(C)c2)C1	ZINC001753453536	1440407160	/nfs/dbraw/zinc/40/71/60/1440407160.db2.gz	SFIGWXLYAMMHRA-GOSISDBHSA-N	0	3	330.472	3.263	20	30		EGEDHN
C#CCCCC(=O)N(CC)[C@@H]1CCN(Cc2cccc(COC)c2)C1	ZINC001753455637	1440408098	/nfs/dbraw/zinc/40/80/98/1440408098.db2.gz	MZEICSAVUJYXKR-HXUWFJFHSA-N	0	3	342.483	3.059	20	30		EGEDHN
CC[C@H](CNC(=O)C=C1CCC1)NCC#Cc1cccc(Cl)c1	ZINC001753469664	1440413772	/nfs/dbraw/zinc/41/37/72/1440413772.db2.gz	DUXLXNHCVOEMEV-GOSISDBHSA-N	0	3	330.859	3.286	20	30		EGEDHN
C=C[C@@H](C(=O)NC[C@@H](CC)NCc1cncc(F)c1)c1ccccc1	ZINC001753496445	1440421595	/nfs/dbraw/zinc/42/15/95/1440421595.db2.gz	DPBNCLFXESPUPZ-RTBURBONSA-N	0	3	341.430	3.175	20	30		EGEDHN
C[C@H](CC(=O)NC1(CNCC#Cc2ccccc2)CCCC1)C1CC1	ZINC001753511248	1440425965	/nfs/dbraw/zinc/42/59/65/1440425965.db2.gz	DIJKJLLGMPHOEI-GOSISDBHSA-N	0	3	338.495	3.493	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1c[nH]c2ccccc12)C1CC1	ZINC001753519303	1440428155	/nfs/dbraw/zinc/42/81/55/1440428155.db2.gz	AYCSNEPGEIGTBT-SFHVURJKSA-N	0	3	331.847	3.409	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N[C@@](C)(CNCc1ccc(C#N)cc1F)C1CC1	ZINC001753524772	1440429403	/nfs/dbraw/zinc/42/94/03/1440429403.db2.gz	LGHZHRQAEPSGBD-VLIAUNLRSA-N	0	3	345.462	3.364	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1sc(C)nc1C)C1CC1	ZINC001753527701	1440430051	/nfs/dbraw/zinc/43/00/51/1440430051.db2.gz	PIBNSMYEWMWTFW-OAHLLOKOSA-N	0	3	327.881	3.001	20	30		EGEDHN
C[C@@H]1CCCC[C@]1(CNCC#Cc1ccccc1)NC(=O)c1cc[nH]c1	ZINC001753532605	1440431508	/nfs/dbraw/zinc/43/15/08/1440431508.db2.gz	TWRIGKPAOMISHN-XMSQKQJNSA-N	0	3	349.478	3.335	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)Cc2cccnc2C)CCCC[C@@H]1C	ZINC001753535881	1440432566	/nfs/dbraw/zinc/43/25/66/1440432566.db2.gz	NAPYVDIZMUKYRN-LIRRHRJNSA-N	0	3	349.906	3.340	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCC1CCN([C@H](C)c2cnccn2)CC1	ZINC001753597315	1440445089	/nfs/dbraw/zinc/44/50/89/1440445089.db2.gz	TVGVJQRFBGAMLG-OXQOHEQNSA-N	0	3	344.503	3.358	20	30		EGEDHN
C=CCCC(=O)NC[C@H](C)CNCc1nc2cc(C)ccc2s1	ZINC001753607469	1440448303	/nfs/dbraw/zinc/44/83/03/1440448303.db2.gz	RBHULBNWZOFPMG-CQSZACIVSA-N	0	3	331.485	3.413	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cc(COC)cs2)CCCC1	ZINC001753665864	1440460191	/nfs/dbraw/zinc/46/01/91/1440460191.db2.gz	QOZHPPYNHUYFRV-UHFFFAOYSA-N	0	3	342.892	3.279	20	30		EGEDHN
C[C@]1(C(=O)NCC2(NCC#Cc3ccccc3)CCCC2)C=CCC1	ZINC001753667195	1440460638	/nfs/dbraw/zinc/46/06/38/1440460638.db2.gz	SZYBBDPEQWPYNX-NRFANRHFSA-N	0	3	336.479	3.413	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CO[C@@H]2CCCC[C@H]2C)CCCC1	ZINC001753669465	1440461452	/nfs/dbraw/zinc/46/14/52/1440461452.db2.gz	SNJHRVWGFJBLRF-GDBMZVCRSA-N	0	3	342.911	3.353	20	30		EGEDHN
Cc1cc(F)cc(C(=O)N(C)[C@@H](C)CNCc2ccc(C#N)s2)c1	ZINC001753714642	1440471522	/nfs/dbraw/zinc/47/15/22/1440471522.db2.gz	GHHJTGZEMCQCBS-ZDUSSCGKSA-N	0	3	345.443	3.318	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCCCN1C(=O)c1c(C)noc1C	ZINC001753770766	1440485469	/nfs/dbraw/zinc/48/54/69/1440485469.db2.gz	CEOOADCCZGKPMS-AWEZNQCLSA-N	0	3	325.840	3.018	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@H]([C@H](C)NCc2nnc(C(C)C)[nH]2)C1	ZINC001753815331	1440493683	/nfs/dbraw/zinc/49/36/83/1440493683.db2.gz	LMDLGQOVIVWEAD-HOTGVXAUSA-N	0	3	347.507	3.001	20	30		EGEDHN
CC/C(C)=C/C(=O)NC[C@@H](NCc1cc(C#N)ccc1F)C(C)C	ZINC001753828512	1440499012	/nfs/dbraw/zinc/49/90/12/1440499012.db2.gz	HYCREDZJFMFVNI-ODHXBGJQSA-N	0	3	331.435	3.284	20	30		EGEDHN
C=C(Br)CN[C@@H](CNC(=O)[C@H]1CC[C@H](C)CC1)C(C)C	ZINC001753843194	1440503498	/nfs/dbraw/zinc/50/34/98/1440503498.db2.gz	FNLVIXYRSHLDGY-QEJZJMRPSA-N	0	3	345.325	3.452	20	30		EGEDHN
C=CCOCCN(C)CCN(C)C(=O)c1cccc2c1CCCCC2	ZINC001753855895	1440508721	/nfs/dbraw/zinc/50/87/21/1440508721.db2.gz	MULXFOWSWYHBCP-UHFFFAOYSA-N	0	3	344.499	3.162	20	30		EGEDHN
C=C[C@H](CC(=O)N(C)CCN(C)C[C@H]1CCCCO1)c1ccccc1	ZINC001753869292	1440516508	/nfs/dbraw/zinc/51/65/08/1440516508.db2.gz	NWKBLUFMWSRCFA-UYAOXDASSA-N	0	3	344.499	3.306	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H]2[C@H](CCN2Cc2oc(C)nc2C)C1	ZINC001753871817	1440517754	/nfs/dbraw/zinc/51/77/54/1440517754.db2.gz	HGSRSDBESFUTKZ-SJORKVTESA-N	0	3	331.460	3.071	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H]2[C@H](CCN2Cc2cc(C)ns2)C1	ZINC001753873752	1440518475	/nfs/dbraw/zinc/51/84/75/1440518475.db2.gz	UUKLYYHYOHZIGI-SJLPKXTDSA-N	0	3	345.512	3.068	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CCC[C@@H]1CNCc1ncc(C)s1	ZINC001753895379	1440522719	/nfs/dbraw/zinc/52/27/19/1440522719.db2.gz	MXDPLRUXVKQDQU-HUUCEWRRSA-N	0	3	335.517	3.428	20	30		EGEDHN
CCC(C)(CC)C(=O)NC/C=C\CNCc1ccc(C#N)c(F)c1	ZINC001754207519	1440550768	/nfs/dbraw/zinc/55/07/68/1440550768.db2.gz	CHZLXQSYVVOGDJ-SREVYHEPSA-N	0	3	331.435	3.286	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](C)CNCC#Cc2cccc(Cl)c2)co1	ZINC001754222433	1440552857	/nfs/dbraw/zinc/55/28/57/1440552857.db2.gz	ABBZFFHIMBBMEO-CYBMUJFWSA-N	0	3	330.815	3.001	20	30		EGEDHN
Cc1cccc([C@@H](C)C(=O)N[C@@H](C)CNCC#Cc2ccccc2)c1	ZINC001754284772	1440563885	/nfs/dbraw/zinc/56/38/85/1440563885.db2.gz	UCGUONKNYMFUDK-RBUKOAKNSA-N	0	3	334.463	3.245	20	30		EGEDHN
C=CCOCCN(C)C[C@@H](C)NC(=O)c1cc2ccccc2s1	ZINC001754315120	1440575075	/nfs/dbraw/zinc/57/50/75/1440575075.db2.gz	HSAVASIPPQOVIR-CQSZACIVSA-N	0	3	332.469	3.154	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)CN(C)Cc2cccc(C)c2)CCOCC1	ZINC001754343286	1440589015	/nfs/dbraw/zinc/58/90/15/1440589015.db2.gz	RAHWCFUSVCRHKT-SFHVURJKSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=C(Br)CNCCCN(C)C(=O)CC1=CCCCC1	ZINC001754363542	1440591977	/nfs/dbraw/zinc/59/19/77/1440591977.db2.gz	TZNBADGTFWOPIS-UHFFFAOYSA-N	0	3	329.282	3.224	20	30		EGEDHN
CN(CCCNCc1ccc(Cl)cc1Cl)C(=O)C#CC1CC1	ZINC001754369926	1440592472	/nfs/dbraw/zinc/59/24/72/1440592472.db2.gz	IIIOAIVOYOYNEV-UHFFFAOYSA-N	0	3	339.266	3.345	20	30		EGEDHN
CN(CCCNCc1ccccc1C#N)C(=O)CCc1ccccc1	ZINC001754409633	1440596223	/nfs/dbraw/zinc/59/62/23/1440596223.db2.gz	FALMOCYIUOJLJZ-UHFFFAOYSA-N	0	3	335.451	3.129	20	30		EGEDHN
C=CCC[C@@H](C)N1CC[C@H]1CNC(=O)c1c(F)cc(OC)cc1F	ZINC001754493876	1440610983	/nfs/dbraw/zinc/61/09/83/1440610983.db2.gz	HIIVMLLCCGXNRF-OLZOCXBDSA-N	0	3	338.398	3.132	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)c3coc(C(F)F)c3)CC2)cc1	ZINC001754522367	1440620064	/nfs/dbraw/zinc/62/00/64/1440620064.db2.gz	KKISCNDYGBCWPN-UHFFFAOYSA-N	0	3	345.349	3.141	20	30		EGEDHN
Cc1ccccc1CCC(=O)NCC1(NCc2ccc(C#N)cc2)CC1	ZINC001754526281	1440621072	/nfs/dbraw/zinc/62/10/72/1440621072.db2.gz	MBBDWJQUGHXNFY-UHFFFAOYSA-N	0	3	347.462	3.238	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC2(C1)CCN(Cc1cccnc1)CC2	ZINC001754560677	1440633524	/nfs/dbraw/zinc/63/35/24/1440633524.db2.gz	VQVXFFBVLGTAPX-UHFFFAOYSA-N	0	3	327.472	3.252	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001754566374	1440635698	/nfs/dbraw/zinc/63/56/98/1440635698.db2.gz	RXIKCMHCDUYTBL-NRFANRHFSA-N	0	3	337.467	3.339	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)CCCC2CC2)s1	ZINC001754615668	1440644509	/nfs/dbraw/zinc/64/45/09/1440644509.db2.gz	XHFTWUWEQVBKDX-HNNXBMFYSA-N	0	3	331.485	3.281	20	30		EGEDHN
C[C@H](C#N)C(=O)NC1(C)CCN([C@H]2CCc3ccc(Cl)cc32)CC1	ZINC001754623445	1440645821	/nfs/dbraw/zinc/64/58/21/1440645821.db2.gz	DTCXTKHJNQBNBI-DYVFJYSZSA-N	0	3	345.874	3.458	20	30		EGEDHN
C#CCN1CCC2(CO[C@H](CNC(=O)[C@H](CCCC)C(C)C)C2)CC1	ZINC001754632054	1440648159	/nfs/dbraw/zinc/64/81/59/1440648159.db2.gz	ISKZYGSXRCGVFU-RBUKOAKNSA-N	0	3	348.531	3.069	20	30		EGEDHN
C#CCN(C(=O)C1CCC1)C1CCN(Cc2cccc(CC)c2)CC1	ZINC001754633645	1440648401	/nfs/dbraw/zinc/64/84/01/1440648401.db2.gz	DXPKUOOUNWYAKY-UHFFFAOYSA-N	0	3	338.495	3.475	20	30		EGEDHN
C#CCN(C(=O)CC(C)(C)C1CC1)C1CCN(CCOC(C)C)CC1	ZINC001754635374	1440648537	/nfs/dbraw/zinc/64/85/37/1440648537.db2.gz	FNDQPYNPHSZDBH-UHFFFAOYSA-N	0	3	348.531	3.164	20	30		EGEDHN
C#CCNC[C@H](NC(=O)CCOC(C)C)c1ccc2ccccc2c1	ZINC001754643704	1440649489	/nfs/dbraw/zinc/64/94/89/1440649489.db2.gz	FWCMZAROACRWTJ-FQEVSTJZSA-N	0	3	338.451	3.035	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H](CNCc1ccnc(OC)c1)C1CCCC1	ZINC001754653029	1440652667	/nfs/dbraw/zinc/65/26/67/1440652667.db2.gz	RUZUPDCTEHJNCJ-KRWDZBQOSA-N	0	3	345.487	3.067	20	30		EGEDHN
C=CCCOCC(=O)N1CCCC[C@@]2(CCN(C/C=C\Cl)C2)C1	ZINC001754661726	1440655218	/nfs/dbraw/zinc/65/52/18/1440655218.db2.gz	KEECUFLPMAYMBN-KKMIYCERSA-N	0	3	340.895	3.036	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@](C)(CNCc2oc(CC)nc2C)C1	ZINC001754704369	1440668737	/nfs/dbraw/zinc/66/87/37/1440668737.db2.gz	GUFWCRSFHLFURB-PMACEKPBSA-N	0	3	347.503	3.476	20	30		EGEDHN
CC#CCN1CCC[C@@](C)(CNC(=O)C(C)(C)c2cccc(F)c2)C1	ZINC001754730721	1440679217	/nfs/dbraw/zinc/67/92/17/1440679217.db2.gz	LSOXZSQJYJNHHP-NRFANRHFSA-N	0	3	344.474	3.345	20	30		EGEDHN
C=CCN1CCC[C@](C)(CNC(=O)c2nc(Cl)sc2C)C1	ZINC001754736959	1440682615	/nfs/dbraw/zinc/68/26/15/1440682615.db2.gz	WLMVVLRDSGDCGQ-OAHLLOKOSA-N	0	3	327.881	3.123	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)C[C@@H](OCC)C(C)C)C2)CC1	ZINC001754784341	1440687295	/nfs/dbraw/zinc/68/72/95/1440687295.db2.gz	UYECASLIVOBGBJ-WOJBJXKFSA-N	0	3	348.531	3.021	20	30		EGEDHN
CC/C(C)=C\C(=O)N1CC[C@H]([C@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001754793586	1440688990	/nfs/dbraw/zinc/68/89/90/1440688990.db2.gz	YOWGKAXMKGQDRY-FBEWKCLCSA-N	0	3	343.446	3.380	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)C2(CCF)CC2)C1	ZINC001754796457	1440689538	/nfs/dbraw/zinc/68/95/38/1440689538.db2.gz	BVPGSLKTQQNIHY-YJBOKZPZSA-N	0	3	343.446	3.025	20	30		EGEDHN
C#CCNCCN(Cc1ccccc1)C(=O)[C@@H]1CCCC[C@H]1CC	ZINC001754836913	1440697060	/nfs/dbraw/zinc/69/70/60/1440697060.db2.gz	ACYCXARXJMKKAU-WOJBJXKFSA-N	0	3	326.484	3.454	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1ccc(C)nc1C	ZINC001754863971	1440701926	/nfs/dbraw/zinc/70/19/26/1440701926.db2.gz	RTIKIIMXTBLHHH-OALUTQOASA-N	0	3	327.472	3.230	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)CCCCc1ccc(C)cc1	ZINC001754871577	1440705287	/nfs/dbraw/zinc/70/52/87/1440705287.db2.gz	KGWVPLDNRHJBNU-NHCUHLMSSA-N	0	3	338.495	3.406	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CCN(C(=O)/C(C)=C/CC)C1	ZINC001754905095	1440707562	/nfs/dbraw/zinc/70/75/62/1440707562.db2.gz	ATDVXPRZDLZDGS-IMBBRHANSA-N	0	3	329.282	3.080	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCN(C(=O)c2ccnn2[C@H](C)CC)C1	ZINC001754917720	1440708951	/nfs/dbraw/zinc/70/89/51/1440708951.db2.gz	WDLPSWQNTBMXGG-CABCVRRESA-N	0	3	338.883	3.048	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCN(C(=O)c2c3c[nH]nc3ccc2C)C1	ZINC001754921138	1440709287	/nfs/dbraw/zinc/70/92/87/1440709287.db2.gz	ODVIZRYPQCJTCM-AWEZNQCLSA-N	0	3	346.862	3.066	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](CCNCc2cc(F)ccc2F)C1	ZINC001754928236	1440710124	/nfs/dbraw/zinc/71/01/24/1440710124.db2.gz	MSWHTEMUBSEDBU-INIZCTEOSA-N	0	3	348.437	3.487	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CC[C@H](CCNCc2ccccc2C#N)C1	ZINC001754934808	1440711145	/nfs/dbraw/zinc/71/11/45/1440711145.db2.gz	SINCEGULKYLDDM-IRXDYDNUSA-N	0	3	327.472	3.179	20	30		EGEDHN
C=CCN(C)Cc1ccccc1CNC(=O)c1cn2cc(C)ccc2n1	ZINC001754945968	1440712953	/nfs/dbraw/zinc/71/29/53/1440712953.db2.gz	PGZUUGJBHDJBMB-UHFFFAOYSA-N	0	3	348.450	3.191	20	30		EGEDHN
C=C(C)CN(C)Cc1ccccc1CNC(=O)[C@@H](C)n1cccc1	ZINC001754946075	1440713180	/nfs/dbraw/zinc/71/31/80/1440713180.db2.gz	UMHWRJGPTPWANA-QGZVFWFLSA-N	0	3	325.456	3.373	20	30		EGEDHN
CC#CCN[C@@H](C)c1ccc(CNC(=O)CCCc2ccccn2)cc1	ZINC001754949256	1440714625	/nfs/dbraw/zinc/71/46/25/1440714625.db2.gz	ZAHNBVWKYRFLJK-SFHVURJKSA-N	0	3	349.478	3.395	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H]1Cc2ccccc2CN1C[C@H](CC)OC	ZINC001755075371	1440748227	/nfs/dbraw/zinc/74/82/27/1440748227.db2.gz	FKGPLDROSQYKDX-PMACEKPBSA-N	0	3	344.499	3.311	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2ccc(C3CC3)cc2)CCOCC1	ZINC001755100071	1440751885	/nfs/dbraw/zinc/75/18/85/1440751885.db2.gz	DWZBUFIADRLDIT-UHFFFAOYSA-N	0	3	348.874	3.185	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@@H](OC)C3CCC3)cc2C1	ZINC001755102028	1440753219	/nfs/dbraw/zinc/75/32/19/1440753219.db2.gz	FUWYKPSSVQTUEB-IBGZPJMESA-N	0	3	328.456	3.010	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NCc1ccc2c(c1)CN(CC1CC1)C2)OCC	ZINC001755102275	1440753464	/nfs/dbraw/zinc/75/34/64/1440753464.db2.gz	OXFKMAZJMDCHNB-FQEVSTJZSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=C(C)CN1CCN(CCCCCNC(=O)[C@H]2CCCC23CC3)CC1	ZINC001755173247	1440770165	/nfs/dbraw/zinc/77/01/65/1440770165.db2.gz	NLDTUKZRSLAMET-LJQANCHMSA-N	0	3	347.547	3.047	20	30		EGEDHN
C=CCN(C)C[C@@H]1CCCN1C(=O)c1ccccc1C(F)(F)F	ZINC001755200275	1440779278	/nfs/dbraw/zinc/77/92/78/1440779278.db2.gz	FJWLLIZQVBDRQN-ZDUSSCGKSA-N	0	3	326.362	3.428	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)s1)[C@H](C)NC(=O)c1ccoc1Cl	ZINC001755235047	1440787932	/nfs/dbraw/zinc/78/79/32/1440787932.db2.gz	XQITXNTVDWORHD-ZJUUUORDSA-N	0	3	337.832	3.163	20	30		EGEDHN
Cc1cocc1C(=O)N[C@H](C)[C@H](C)NCC#Cc1ccc(Cl)cc1	ZINC001755248787	1440791411	/nfs/dbraw/zinc/79/14/11/1440791411.db2.gz	LFFVWGMUSNUVHE-LSDHHAIUSA-N	0	3	344.842	3.390	20	30		EGEDHN
CN(C(=O)C#CC1CC1)C1CCC(NC/C(Cl)=C/Cl)CC1	ZINC001755273819	1440798409	/nfs/dbraw/zinc/79/84/09/1440798409.db2.gz	DOWGNUPULKOOJZ-RAXLEYEMSA-N	0	3	329.271	3.078	20	30		EGEDHN
C[C@@H](NCC(C)(C)CN(C)C(=O)[C@@H](C)C#N)c1nc2ccccc2o1	ZINC001755279410	1440800206	/nfs/dbraw/zinc/80/02/06/1440800206.db2.gz	NONWRTVHIZWMPO-UONOGXRCSA-N	0	3	342.443	3.123	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccc(C#N)[nH]1)N(C)Cc1cccc(C(F)F)c1	ZINC001755296212	1440806339	/nfs/dbraw/zinc/80/63/39/1440806339.db2.gz	KEGUDPIXNNYTOQ-LBPRGKRZSA-N	0	3	346.381	3.074	20	30		EGEDHN
C#CCCCCC(=O)NC[C@H](C)N(C)[C@@H]1CCc2ccc(F)cc21	ZINC001755296741	1440806705	/nfs/dbraw/zinc/80/67/05/1440806705.db2.gz	QKNOQGWDXGNYLX-HNAYVOBHSA-N	0	3	330.447	3.443	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@H](C)N(C)Cc1ccc(-n2cccn2)cc1	ZINC001755310737	1440813251	/nfs/dbraw/zinc/81/32/51/1440813251.db2.gz	BTXZWNPTEIWTID-INIZCTEOSA-N	0	3	340.471	3.021	20	30		EGEDHN
C#CCN1CCCCC[C@@H]1CNC(=O)CCCc1ccc(F)cc1	ZINC001755368066	1440835893	/nfs/dbraw/zinc/83/58/93/1440835893.db2.gz	MCYDMAJXCHLAOH-LJQANCHMSA-N	0	3	330.447	3.142	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@]2(CCN(C(=O)c3cccc(F)c3)C2)C1	ZINC001755399793	1440842751	/nfs/dbraw/zinc/84/27/51/1440842751.db2.gz	QIROMPMNZUDCDP-OXJNMPFZSA-N	0	3	346.446	3.097	20	30		EGEDHN
C[C@@H](C#N)C(=O)N[C@@H]1CN(Cc2cc3ccccc3s2)CC1(C)C	ZINC001755407365	1440844817	/nfs/dbraw/zinc/84/48/17/1440844817.db2.gz	OGBNNASBZMJXQE-SUMWQHHRSA-N	0	3	341.480	3.388	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1CN([C@H](C)c2ccccc2)CC1(C)C	ZINC001755416115	1440848961	/nfs/dbraw/zinc/84/89/61/1440848961.db2.gz	OYJWORAJYHTUFZ-AEFFLSMTSA-N	0	3	330.472	3.167	20	30		EGEDHN
C=C(Cl)CNC[C@H]1C[C@H](NC(=O)C[C@H](C)c2c(C)noc2C)C1	ZINC001755473505	1440859130	/nfs/dbraw/zinc/85/91/30/1440859130.db2.gz	NLTHIGNAWHROOQ-LKTVYLICSA-N	0	3	339.867	3.022	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H](CNCc3oc(CC)nc3C)C2)CCC1	ZINC001755478291	1440859732	/nfs/dbraw/zinc/85/97/32/1440859732.db2.gz	WQYHKDNTQNNKKH-WKILWMFISA-N	0	3	345.487	3.276	20	30		EGEDHN
C=C(Cl)CNC[C@H]1C[C@H](NC(=O)[C@H](C)Cc2ccccc2F)C1	ZINC001755478707	1440859792	/nfs/dbraw/zinc/85/97/92/1440859792.db2.gz	MYWGTIUJTGDJRW-XNRPHZJLSA-N	0	3	338.854	3.241	20	30		EGEDHN
C=C(Cl)CNCCC[C@H](C)NC(=O)c1sc(C)cc1OC	ZINC001755517440	1440864448	/nfs/dbraw/zinc/86/44/48/1440864448.db2.gz	CILSRQVSSGXMHW-NSHDSACASA-N	0	3	330.881	3.306	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC[C@@H](NCc2nc(C)oc2C)C(C)C)C1	ZINC001755551225	1440872144	/nfs/dbraw/zinc/87/21/44/1440872144.db2.gz	RVMKQQFJUHJXTQ-MRXNPFEDSA-N	0	3	333.476	3.268	20	30		EGEDHN
CN(C(=O)CC1CCCC1)[C@@H](CNCC#Cc1ccccc1)C1CC1	ZINC001755556210	1440873218	/nfs/dbraw/zinc/87/32/18/1440873218.db2.gz	WEOYHWSXTWXGSQ-NRFANRHFSA-N	0	3	338.495	3.445	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N(C)C[C@@H](C)NCc1ccc(C#N)c(F)c1	ZINC001755589696	1440881305	/nfs/dbraw/zinc/88/13/05/1440881305.db2.gz	ZGUWUZKQJINGNC-CQSZACIVSA-N	0	3	333.451	3.316	20	30		EGEDHN
C/C(=C/C(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@H]1C)C1CC1	ZINC001755660242	1440892610	/nfs/dbraw/zinc/89/26/10/1440892610.db2.gz	ALXGVSLPAKNRHT-JZSDMUGZSA-N	0	3	340.442	3.113	20	30		EGEDHN
C=CCOCCN1CC[C@@]2(NC(=O)C(F)=C3CCCC3)CCC[C@@H]12	ZINC001755699415	1440899242	/nfs/dbraw/zinc/89/92/42/1440899242.db2.gz	WFWGXUSPJSQBAI-APWZRJJASA-N	0	3	336.451	3.100	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@]12CCC[C@@H]1N(Cc1cccnc1)CC2	ZINC001755703507	1440901422	/nfs/dbraw/zinc/90/14/22/1440901422.db2.gz	YIKRDPQFJOZSNI-FXAWDEMLSA-N	0	3	327.472	3.297	20	30		EGEDHN
C#CCN1CC[C@]2(NC(=O)C[C@H](C)c3ccc(F)cc3)CCC[C@@H]12	ZINC001755705312	1440902584	/nfs/dbraw/zinc/90/25/84/1440902584.db2.gz	WZFQRISWTXCFOC-QKYXUNIQSA-N	0	3	328.431	3.066	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H]2CCC[C@H](NCc3nccs3)[C@@H]2C1	ZINC001755708223	1440903079	/nfs/dbraw/zinc/90/30/79/1440903079.db2.gz	WHRHONRQNBTRPJ-XHSDSOJGSA-N	0	3	333.501	3.216	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)CCOCc2ccccc2)[C@H]1C	ZINC001755719581	1440906828	/nfs/dbraw/zinc/90/68/28/1440906828.db2.gz	AMCULKNQPQAJTA-MJGOQNOKSA-N	0	3	330.472	3.139	20	30		EGEDHN
CS[C@H](C)CC(=O)N1C[C@@H](NCC#Cc2ccccc2)C(C)(C)C1	ZINC001755755835	1440913906	/nfs/dbraw/zinc/91/39/06/1440913906.db2.gz	VXDDIPUDUCESRT-SJLPKXTDSA-N	0	3	344.524	3.006	20	30		EGEDHN
CS[C@@H](C)CC(=O)N1C[C@@H](NCC#Cc2ccccc2)C(C)(C)C1	ZINC001755755834	1440913919	/nfs/dbraw/zinc/91/39/19/1440913919.db2.gz	VXDDIPUDUCESRT-FUHWJXTLSA-N	0	3	344.524	3.006	20	30		EGEDHN
CC(C)(C)[C@@H](CNCC#Cc1ccccc1)NC(=O)CC(F)(F)F	ZINC001755821910	1440925911	/nfs/dbraw/zinc/92/59/11/1440925911.db2.gz	QKOQZFKBKMTTGF-OAHLLOKOSA-N	0	3	340.389	3.111	20	30		EGEDHN
CC(C)(C)[C@H](CNCc1ccc(C#N)s1)NC(=O)CCC(F)F	ZINC001755828442	1440927966	/nfs/dbraw/zinc/92/79/66/1440927966.db2.gz	IJOTZWCMXWLWJE-ZDUSSCGKSA-N	0	3	343.443	3.286	20	30		EGEDHN
COCC#CCN1CCC([C@@H](C)NC(=O)CC2(C)CCCCC2)CC1	ZINC001755844481	1440932666	/nfs/dbraw/zinc/93/26/66/1440932666.db2.gz	XGLHDDFTUHEGRJ-GOSISDBHSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=C(Cl)CNC1CC(N(C)C(=O)C[C@@H](C)c2c(C)noc2C)C1	ZINC001755858506	1440936294	/nfs/dbraw/zinc/93/62/94/1440936294.db2.gz	HGFQHJZKLUWVJO-SFNBMPIDSA-N	0	3	339.867	3.117	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC1=CCN(CCc2scnc2C)CC1	ZINC001755892758	1440941885	/nfs/dbraw/zinc/94/18/85/1440941885.db2.gz	UWLUONLHDNLUHK-IBGZPJMESA-N	0	3	347.528	3.345	20	30		EGEDHN
C=CC[C@H]1CCCC[C@@H]1[NH2+]CCCOc1ccc(-c2nn[n-]n2)cc1	ZINC001573329715	947425395	/nfs/dbraw/zinc/42/53/95/947425395.db2.gz	NQAVYFCZRZPWFY-YJBOKZPZSA-N	0	3	341.459	3.360	20	30		EGEDHN
CC(C)CN(C(=O)/C=C/c1ccc(C#N)cc1)C1CCN(C)CC1	ZINC000265129468	534993680	/nfs/dbraw/zinc/99/36/80/534993680.db2.gz	QRDDKTJNCWCTRE-CMDGGOBGSA-N	0	3	325.456	3.150	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)NCCN1CCC[C@H](C)C1	ZINC000066178452	215019188	/nfs/dbraw/zinc/01/91/88/215019188.db2.gz	OYLJLDGZMJEKKF-KRWDZBQOSA-N	0	3	342.487	3.210	20	30		EGEDHN
Cc1ccc(OCC(=O)C(C#N)C(=O)Nc2ccccc2Cl)cc1	ZINC000103504471	219309150	/nfs/dbraw/zinc/30/91/50/219309150.db2.gz	AKAGUHIVPNORFG-CQSZACIVSA-N	0	3	342.782	3.375	20	30		EGEDHN
C[C@H](N[C@@H](CN1CCOCC1)c1ccccc1)c1cccc(C#N)c1	ZINC000181421344	234179505	/nfs/dbraw/zinc/17/95/05/234179505.db2.gz	OCVSPFXVWCZIOK-UWJYYQICSA-N	0	3	335.451	3.282	20	30		EGEDHN
Cc1ccc([C@H](CN[C@@H](C)c2cccc(C#N)c2)N2CCOCC2)o1	ZINC000181423988	234182050	/nfs/dbraw/zinc/18/20/50/234182050.db2.gz	RABIMJPLMSACHA-LPHOPBHVSA-N	0	3	339.439	3.184	20	30		EGEDHN
C[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCCC1)c1cccc(C#N)c1	ZINC000181638582	234262746	/nfs/dbraw/zinc/26/27/46/234262746.db2.gz	OVKMYJWLIKYJPL-LAUBAEHRSA-N	0	3	347.462	3.443	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CN2CCC[C@H]2c2cccs2)cc1	ZINC000040475823	213311839	/nfs/dbraw/zinc/31/18/39/213311839.db2.gz	NSQNREJSIXMHHZ-RDJZCZTQSA-N	0	3	328.437	3.197	20	30		EGEDHN
COc1cc(F)c([C@@H](C)NCCOc2cccc(C#N)c2)cc1OC	ZINC000183504750	235114944	/nfs/dbraw/zinc/11/49/44/235114944.db2.gz	NGYZSBMWUIKPTE-CYBMUJFWSA-N	0	3	344.386	3.444	20	30		EGEDHN
C[C@@H](NC(=O)OC(C)(C)C)C1CCN(Cc2cc(C#N)n(C)c2)CC1	ZINC000191311697	239033224	/nfs/dbraw/zinc/03/32/24/239033224.db2.gz	OCURXHPPFHSKQC-CQSZACIVSA-N	0	3	346.475	3.022	20	30		EGEDHN
COC[C@@H](NC[C@H](O)c1ccc(C#N)cc1)c1ccc(Cl)cc1	ZINC000193668969	240258115	/nfs/dbraw/zinc/25/81/15/240258115.db2.gz	KCFYXRWPXGNUSI-MSOLQXFVSA-N	0	3	330.815	3.222	20	30		EGEDHN
COc1cc([C@H](C)NCc2cccc(C#N)c2)cc(OC)c1OC	ZINC000079720665	217250129	/nfs/dbraw/zinc/25/01/29/217250129.db2.gz	BWENAVFOJJVARF-ZDUSSCGKSA-N	0	3	326.396	3.435	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCCSc2ccccc2)CC1	ZINC000264355384	246392969	/nfs/dbraw/zinc/39/29/69/246392969.db2.gz	DXXFQZZJFUQSGT-UHFFFAOYSA-N	0	3	333.501	3.118	20	30		EGEDHN
CC[C@H]1CCCN(C(C)(C)CNC(=O)c2c(F)cc(C#N)cc2F)C1	ZINC000095410145	218347172	/nfs/dbraw/zinc/34/71/72/218347172.db2.gz	XRXYSQQXQXWWRH-ZDUSSCGKSA-N	0	3	349.425	3.467	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN2CCC(c3nc4ccccc4[nH]3)CC2)cc1	ZINC000268618727	252072551	/nfs/dbraw/zinc/07/25/51/252072551.db2.gz	AULZZCOAXURUJF-FQEVSTJZSA-N	0	3	346.434	3.348	20	30		EGEDHN
C#CCNC(=O)CCN[C@H](C)c1sc(-c2ccc(C)cc2)nc1C	ZINC000268775710	252224947	/nfs/dbraw/zinc/22/49/47/252224947.db2.gz	AFTGZSAJGREORP-CQSZACIVSA-N	0	3	341.480	3.217	20	30		EGEDHN
C[C@@H]1SCCN(CCC(=O)Nc2sc3c(c2C#N)CCC3)[C@H]1C	ZINC000118415278	221147088	/nfs/dbraw/zinc/14/70/88/221147088.db2.gz	LCJUWFRQCKDOQT-RYUDHWBXSA-N	0	3	349.525	3.263	20	30		EGEDHN
C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCCN(Cc2cc(C#N)n(C)c2)C1	ZINC000191366147	533233033	/nfs/dbraw/zinc/23/30/33/533233033.db2.gz	PIYYGYKDMYFPGN-GDBMZVCRSA-N	0	3	346.475	3.022	20	30		EGEDHN
C[C@@H](NC1CCN(Cc2ccc(C#N)cc2)CC1)c1ccncc1F	ZINC000338010948	141073026	/nfs/dbraw/zinc/07/30/26/141073026.db2.gz	JGEGDZGBMDLKEY-OAHLLOKOSA-N	0	3	338.430	3.408	20	30		EGEDHN
CC(C)C[C@H](CN[C@@H](C)c1ccc(C#N)c(F)c1)N1CCOCC1	ZINC000346195508	141177578	/nfs/dbraw/zinc/17/75/78/141177578.db2.gz	OXMMLEPUKCIVFF-MAUKXSAKSA-N	0	3	333.451	3.095	20	30		EGEDHN
C[C@H](NCCC(=O)NCc1ccccc1)c1ccc(C#N)c(F)c1	ZINC000346219661	141182954	/nfs/dbraw/zinc/18/29/54/141182954.db2.gz	UMPJFAMIRKWFLZ-AWEZNQCLSA-N	0	3	325.387	3.054	20	30		EGEDHN
COC(=O)C[C@@H](NCc1ccc(C#N)cc1OC)C1CCCCC1	ZINC000347967227	141225796	/nfs/dbraw/zinc/22/57/96/141225796.db2.gz	SVQHMBOIOFMTPU-QGZVFWFLSA-N	0	3	330.428	3.168	20	30		EGEDHN
Cc1ccc(CNC(=O)C2CCN(Cc3cccc(C#N)c3)CC2)cc1	ZINC000175323674	144062184	/nfs/dbraw/zinc/06/21/84/144062184.db2.gz	IXJDOXGHKDLLDJ-UHFFFAOYSA-N	0	3	347.462	3.395	20	30		EGEDHN
CC1CCN([C@H](CNC(=O)c2cc(C#N)c[nH]2)c2ccccc2)CC1	ZINC000175396706	144063564	/nfs/dbraw/zinc/06/35/64/144063564.db2.gz	NJVKEGGAAHGLKT-LJQANCHMSA-N	0	3	336.439	3.089	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN2CC[C@@H](c3c(F)cccc3F)C2)cc1	ZINC000185319546	144111419	/nfs/dbraw/zinc/11/14/19/144111419.db2.gz	WVTDBZUQYQAUTR-QAPCUYQASA-N	0	3	328.362	3.359	20	30		EGEDHN
CC1CCC(N2CCN(C(=O)Nc3cccc(C#N)c3)CC2)CC1	ZINC000115639502	152025085	/nfs/dbraw/zinc/02/50/85/152025085.db2.gz	KJRUFSIHVGKUCE-UHFFFAOYSA-N	0	3	326.444	3.286	20	30		EGEDHN
COc1cc(C#N)ccc1CN(CCc1ccccc1)[C@H]1CCOC1	ZINC000121180516	152331684	/nfs/dbraw/zinc/33/16/84/152331684.db2.gz	VMIVGUSRROWLRM-FQEVSTJZSA-N	0	3	336.435	3.400	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(Cc3ccc(C#N)c(F)c3)CC2)cc1	ZINC000191864248	153225354	/nfs/dbraw/zinc/22/53/54/153225354.db2.gz	CBTRQKQBSVBMNG-UHFFFAOYSA-N	0	3	348.425	3.277	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H](c3nc(C4CC4)n[nH]3)C2)cc1F	ZINC000192139076	153245109	/nfs/dbraw/zinc/24/51/09/153245109.db2.gz	YCJWAPYCRSILFI-OAHLLOKOSA-N	0	3	325.391	3.072	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H](c3n[nH]c(C4CC4)n3)C2)cc1F	ZINC000192139076	153245111	/nfs/dbraw/zinc/24/51/11/153245111.db2.gz	YCJWAPYCRSILFI-OAHLLOKOSA-N	0	3	325.391	3.072	20	30		EGEDHN
N#Cc1ccc(CNCc2ccc(NC(=O)c3ccncc3)cc2)cc1	ZINC000237970492	153547809	/nfs/dbraw/zinc/54/78/09/153547809.db2.gz	YBYRVBUVFLUFKB-UHFFFAOYSA-N	0	3	342.402	3.495	20	30		EGEDHN
CN(C)CCN(Cc1csc(C2CC2)n1)Cc1ccc(C#N)cc1	ZINC000348888475	156277376	/nfs/dbraw/zinc/27/73/76/156277376.db2.gz	ABHGHFWQDYSMJJ-UHFFFAOYSA-N	0	3	340.496	3.456	20	30		EGEDHN
COCc1ccc(CN(CCN(C)C)Cc2ccc(C#N)cc2)cc1	ZINC000348893294	156278859	/nfs/dbraw/zinc/27/88/59/156278859.db2.gz	LIAYWMOEFGPTAM-UHFFFAOYSA-N	0	3	337.467	3.268	20	30		EGEDHN
C[C@@H]1CN(CCC2CCN(Cc3cc(C#N)cs3)CC2)C[C@H](C)O1	ZINC000093844436	162030489	/nfs/dbraw/zinc/03/04/89/162030489.db2.gz	OMXDVKPLLJNVLF-IYBDPMFKSA-N	0	3	347.528	3.331	20	30		EGEDHN
C[C@@H](CNC(=O)CCc1ccc(C#N)cc1)N(C)Cc1ccccc1	ZINC000110349519	162124545	/nfs/dbraw/zinc/12/45/45/162124545.db2.gz	YLQDHRKWDLKZEB-KRWDZBQOSA-N	0	3	335.451	3.128	20	30		EGEDHN
CN(C)C[C@@H](NC(=O)c1ccc(C#N)cc1)c1ccc(Cl)cc1	ZINC000338760228	163341227	/nfs/dbraw/zinc/34/12/27/163341227.db2.gz	DRZSSWBHXDIASQ-QGZVFWFLSA-N	0	3	327.815	3.244	20	30		EGEDHN
CNC(=O)[C@H](Cc1c[nH]c2ccccc12)N[C@H](C)c1cccc(C#N)c1	ZINC000344144095	164114116	/nfs/dbraw/zinc/11/41/16/164114116.db2.gz	SSMWNRXTKNYURA-VLIAUNLRSA-N	0	3	346.434	3.047	20	30		EGEDHN
CNC(=O)[C@H](Cc1c[nH]c2ccccc12)N[C@@H](C)c1cccc(C#N)c1	ZINC000344144096	164114331	/nfs/dbraw/zinc/11/43/31/164114331.db2.gz	SSMWNRXTKNYURA-XOBRGWDASA-N	0	3	346.434	3.047	20	30		EGEDHN
N#Cc1ccc(OC[C@@H]2CN(Cc3ccccc3)CCCO2)cc1F	ZINC000351896998	165140494	/nfs/dbraw/zinc/14/04/94/165140494.db2.gz	KDMKRYYGEQARMB-IBGZPJMESA-N	0	3	340.398	3.367	20	30		EGEDHN
N#Cc1ccc([C@@H](NCC2(Cc3ccccc3)CCCC2)C(N)=O)cc1	ZINC000351910935	165147328	/nfs/dbraw/zinc/14/73/28/165147328.db2.gz	SVLNCUQMIRWKGO-HXUWFJFHSA-N	0	3	347.462	3.477	20	30		EGEDHN
C[C@@H](c1ccc(C#N)cc1)N1CC[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000172397485	287132025	/nfs/dbraw/zinc/13/20/25/287132025.db2.gz	CKDHDZBROGAMDS-GOEBONIOSA-N	0	3	329.444	3.466	20	30		EGEDHN
CC(C)C[C@H](C)N1CCN(c2oc(-c3ccco3)nc2C#N)CC1	ZINC000355747726	166295794	/nfs/dbraw/zinc/29/57/94/166295794.db2.gz	SIDYMENCOUYSMU-AWEZNQCLSA-N	0	3	328.416	3.363	20	30		EGEDHN
C[C@H](C(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(C#N)c1	ZINC000359890888	167259211	/nfs/dbraw/zinc/25/92/11/167259211.db2.gz	XTJVLDOSJIVTMZ-OXJNMPFZSA-N	0	3	333.435	3.052	20	30		EGEDHN
C[C@@]1(CNC(=O)c2cc(C#N)cs2)CCN(Cc2ccccc2)C1	ZINC000367179932	168190307	/nfs/dbraw/zinc/19/03/07/168190307.db2.gz	IMQVAESGDPWXGL-IBGZPJMESA-N	0	3	339.464	3.262	20	30		EGEDHN
N#Cc1ccc(OC2CCN(CCO[C@@H]3CCCCO3)CC2)c(F)c1	ZINC000367583401	168244539	/nfs/dbraw/zinc/24/45/39/168244539.db2.gz	CTZTVPMUWGCETF-LJQANCHMSA-N	0	3	348.418	3.084	20	30		EGEDHN
C[C@H](CN1CCCCC1)NC(=O)N(Cc1ccc(C#N)cc1)C1CC1	ZINC000171305456	227004770	/nfs/dbraw/zinc/00/47/70/227004770.db2.gz	XQVSHZMUDVEADY-MRXNPFEDSA-N	0	3	340.471	3.107	20	30		EGEDHN
N#Cc1cc(Cl)ccc1NC[C@H](O)CN1CCc2ccccc2C1	ZINC000301517514	269951740	/nfs/dbraw/zinc/95/17/40/269951740.db2.gz	KEJOQEOFAGYPDC-SFHVURJKSA-N	0	3	341.842	3.043	20	30		EGEDHN
C[C@H](N[C@@H]1CCO[C@H]1C1CC1)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000330254297	270045208	/nfs/dbraw/zinc/04/52/08/270045208.db2.gz	JIPQARLQEWLPJK-JJMVLAAESA-N	0	3	345.468	3.242	20	30		EGEDHN
CCOC(=O)c1ccc(C#N)c(SC[C@H]2CCCCN2C(C)C)n1	ZINC000412991568	270047318	/nfs/dbraw/zinc/04/73/18/270047318.db2.gz	RIDLAACDYOMQDC-OAHLLOKOSA-N	0	3	347.484	3.485	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CCC[C@H](CC(F)(F)F)C2)cc1	ZINC000421970709	270048869	/nfs/dbraw/zinc/04/88/69/270048869.db2.gz	SWTLFWRLLJLURT-CVEARBPZSA-N	0	3	349.356	3.432	20	30		EGEDHN
N#Cc1ccccc1OCCN1CC2(CCC2)[C@@H]1C1CCOCC1	ZINC000425553239	270049093	/nfs/dbraw/zinc/04/90/93/270049093.db2.gz	LVUZUABRCTVABW-IBGZPJMESA-N	0	3	326.440	3.218	20	30		EGEDHN
CC(C)(C)[C@@H](CN1CCc2ccccc2C1)Nc1nccc(C#N)n1	ZINC000450380130	270053134	/nfs/dbraw/zinc/05/31/34/270053134.db2.gz	QXWKEKZEMIFLCO-GOSISDBHSA-N	0	3	335.455	3.233	20	30		EGEDHN
Cc1cc(F)cc2c1ncc(C#N)c2N1CCN(C)[C@@H](C(C)C)C1	ZINC000487081955	270055926	/nfs/dbraw/zinc/05/59/26/270055926.db2.gz	BECKDYSMTPJBBX-QGZVFWFLSA-N	0	3	326.419	3.330	20	30		EGEDHN
CCN1CCN(Cc2cccc(OCc3ccccc3C#N)c2)CC1	ZINC000505346381	270058996	/nfs/dbraw/zinc/05/89/96/270058996.db2.gz	WCLKNWMAIUAHHQ-UHFFFAOYSA-N	0	3	335.451	3.275	20	30		EGEDHN
COc1cc(CN[C@@H](C)c2ccc([S@](C)=O)cc2)ccc1C#N	ZINC000281691297	266829123	/nfs/dbraw/zinc/82/91/23/266829123.db2.gz	NANVKDVYNQRCLG-NPMABZOXSA-N	0	3	328.437	3.155	20	30		EGEDHN
C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCN2[C@H](C(N)=O)c2ccc(C#N)cc2)C1	ZINC000331918354	267032445	/nfs/dbraw/zinc/03/24/45/267032445.db2.gz	LKTPIFUBTJCJJQ-RUZYHRDJSA-N	0	3	341.455	3.396	20	30		EGEDHN
C[C@@H](CCN1CCN(C)CC1)Nc1ccc(C(F)(F)F)cc1C#N	ZINC000274500522	267247554	/nfs/dbraw/zinc/24/75/54/267247554.db2.gz	RWGVGLIZQADHHT-ZDUSSCGKSA-N	0	3	340.393	3.015	20	30		EGEDHN
CCO[C@H]1C[C@H](NC2(c3cccc(C#N)c3)CC2)C12CCOCC2	ZINC000274514028	267249320	/nfs/dbraw/zinc/24/93/20/267249320.db2.gz	XAXWEZACKDNRJO-ROUUACIJSA-N	0	3	326.440	3.111	20	30		EGEDHN
CN(C[C@H]1CCN(Cc2ccccc2)C1)C(=O)c1ccc(C#N)s1	ZINC000487552982	267309744	/nfs/dbraw/zinc/30/97/44/267309744.db2.gz	QQJRVVQQRSQAFL-MRXNPFEDSA-N	0	3	339.464	3.214	20	30		EGEDHN
CN1CCC(Nc2ccccc2NC(=O)c2ccc(C#N)s2)CC1	ZINC000487740375	267334610	/nfs/dbraw/zinc/33/46/10/267334610.db2.gz	PGXOXBHQUSNEPB-UHFFFAOYSA-N	0	3	340.452	3.378	20	30		EGEDHN
CO[C@@H]1CCCC[C@H]1N[C@H](C)C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000275253297	267336678	/nfs/dbraw/zinc/33/66/78/267336678.db2.gz	QLPVSHCICZGPCI-HFBAOOFYSA-N	0	3	335.835	3.086	20	30		EGEDHN
Cc1cc([C@@H](C)NC[C@@H](O)COc2ccc(C#N)cc2)c(C)s1	ZINC000193131546	267361952	/nfs/dbraw/zinc/36/19/52/267361952.db2.gz	GQIOCWKOPSUWQK-CZUORRHYSA-N	0	3	330.453	3.327	20	30		EGEDHN
Cc1cc2cc(CNC(=O)C(C#N)Cc3ccc(C#N)cc3)ccc2[nH]1	ZINC000344052348	267368231	/nfs/dbraw/zinc/36/82/31/267368231.db2.gz	KKNVBESVYBDTHS-LJQANCHMSA-N	0	3	342.402	3.347	20	30		EGEDHN
COC(=O)[C@]1(c2ccccc2)CCN(Cc2ccc(F)c(C#N)c2)C1	ZINC000428805225	267396194	/nfs/dbraw/zinc/39/61/94/267396194.db2.gz	WARKBTULJUXXLW-HXUWFJFHSA-N	0	3	338.382	3.014	20	30		EGEDHN
Cc1cc(NC(=O)c2cc(C#N)cc(N(C)C)c2)ccc1CN(C)C	ZINC000458255448	268010399	/nfs/dbraw/zinc/01/03/99/268010399.db2.gz	BDFHEEGGQLDUDD-UHFFFAOYSA-N	0	3	336.439	3.247	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CCC=C(c3ccco3)C2)cc1	ZINC000288125461	268088324	/nfs/dbraw/zinc/08/83/24/268088324.db2.gz	BXZFVSAWILVGJJ-GOSISDBHSA-N	0	3	331.375	3.149	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCC2(c3cccc(F)c3)CC2)cc1	ZINC000280296233	268089516	/nfs/dbraw/zinc/08/95/16/268089516.db2.gz	FLMFGWCUAQSGOE-QGZVFWFLSA-N	0	3	347.393	3.228	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@H]2CSc3ccccc32)cc1	ZINC000348294157	268091928	/nfs/dbraw/zinc/09/19/28/268091928.db2.gz	QJWWOHOPKHPPOH-WBVHZDCISA-N	0	3	333.416	3.204	20	30		EGEDHN
N#Cc1cccc([C@@H]2C[C@H]2C(=O)N2CCC[C@@H]2CN2CCCCC2)c1	ZINC000411967030	268287718	/nfs/dbraw/zinc/28/77/18/268287718.db2.gz	CUHHULMGZKTLAI-HSALFYBXSA-N	0	3	337.467	3.139	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1CCc2sc(Cl)cc21	ZINC000530234659	268303636	/nfs/dbraw/zinc/30/36/36/268303636.db2.gz	SFJJGHBGTAEOBA-TZMCWYRMSA-N	0	3	348.855	3.290	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1CCc2c1cccc2Cl	ZINC000530230717	268304088	/nfs/dbraw/zinc/30/40/88/268304088.db2.gz	IRTNQUWPFLSYPR-RDTXWAMCSA-N	0	3	342.826	3.228	20	30		EGEDHN
N#Cc1cnc(N2CCCN(CCCc3ccccc3)CC2)c(F)c1	ZINC000413101390	268312083	/nfs/dbraw/zinc/31/20/83/268312083.db2.gz	CYQDXRRLNHSGQV-UHFFFAOYSA-N	0	3	338.430	3.237	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)C(=O)NCCN1CCC[C@H](C)C1	ZINC000046378975	275136959	/nfs/dbraw/zinc/13/69/59/275136959.db2.gz	NNPJMLDAVNRSOF-KRWDZBQOSA-N	0	3	342.487	3.212	20	30		EGEDHN
N#Cc1cccc(CNCCOc2cccc(Br)c2)c1	ZINC000048446821	275146385	/nfs/dbraw/zinc/14/63/85/275146385.db2.gz	WUALSIYAUBXXEQ-UHFFFAOYSA-N	0	3	331.213	3.489	20	30		EGEDHN
N#Cc1ccc(CNCCOc2cccc(Br)c2)cc1	ZINC000048446819	275146442	/nfs/dbraw/zinc/14/64/42/275146442.db2.gz	CYUPUQPJXRQCKF-UHFFFAOYSA-N	0	3	331.213	3.489	20	30		EGEDHN
C[C@H](N[C@@H](CO)Cc1c[nH]c2ccccc12)c1ccc(C#N)c(F)c1	ZINC000271929907	275242391	/nfs/dbraw/zinc/24/23/91/275242391.db2.gz	HNUDIACRUXANPN-SUMWQHHRSA-N	0	3	337.398	3.433	20	30		EGEDHN
CC(C)(C)n1cc(C#N)cc1NC(=O)N1CCN(C2CCCC2)CC1	ZINC000171144094	275542704	/nfs/dbraw/zinc/54/27/04/275542704.db2.gz	RXRMBUDJDGIBEL-UHFFFAOYSA-N	0	3	343.475	3.207	20	30		EGEDHN
CCN(CCN1CCCCCC1)C(=O)c1c(F)cc(C#N)cc1F	ZINC000345475016	279188257	/nfs/dbraw/zinc/18/82/57/279188257.db2.gz	WGYVKACKYRULCM-UHFFFAOYSA-N	0	3	335.398	3.175	20	30		EGEDHN
CN1CCC(N(Cc2ccccc2)C(=O)c2cccc(C#N)c2)CC1	ZINC000129066793	289881435	/nfs/dbraw/zinc/88/14/35/289881435.db2.gz	QCOJCBJOPBLMCS-UHFFFAOYSA-N	0	3	333.435	3.295	20	30		EGEDHN
Cc1csc(=O)n1CCN(Cc1ccc(C#N)cc1)CC(C)C	ZINC000346800421	293016819	/nfs/dbraw/zinc/01/68/19/293016819.db2.gz	YGQDDMCMWLIZRX-UHFFFAOYSA-N	0	3	329.469	3.248	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@H](N[C@H](CN1CCOCC1)c1ccccc1)CC2	ZINC000353411127	303201685	/nfs/dbraw/zinc/20/16/85/303201685.db2.gz	JSPJVJHRGSAYJX-FGZHOGPDSA-N	0	3	347.462	3.209	20	30		EGEDHN
CN1CC[C@@H](NC(=O)C2(c3cccc(C#N)c3)CC2)[C@@H]1c1ccccc1	ZINC000536262650	314103394	/nfs/dbraw/zinc/10/33/94/314103394.db2.gz	IRCMXQICQDRXLK-UXHICEINSA-N	0	3	345.446	3.151	20	30		EGEDHN
C[C@H](NCCNc1ccc(-c2ccccc2)nn1)c1ccc(C#N)cc1	ZINC000540594211	314391007	/nfs/dbraw/zinc/39/10/07/314391007.db2.gz	PJWFGCFTAXKYJV-INIZCTEOSA-N	0	3	343.434	3.200	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CNCc2csc3ccccc23)cc1	ZINC000554869941	315353653	/nfs/dbraw/zinc/35/36/53/315353653.db2.gz	YUUVHZFQVZJLRR-INIZCTEOSA-N	0	3	338.432	3.302	20	30		EGEDHN
C[C@H](NCCNc1ccc2ccccc2n1)c1ccc(C#N)c(F)c1	ZINC000561769807	315782346	/nfs/dbraw/zinc/78/23/46/315782346.db2.gz	JYRJZVAKSJAQDX-AWEZNQCLSA-N	0	3	334.398	3.430	20	30		EGEDHN
Cc1cnccc1CCN1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC000564910261	316231134	/nfs/dbraw/zinc/23/11/34/316231134.db2.gz	JWUUZFHFGBVLDM-UHFFFAOYSA-N	0	3	334.467	3.012	20	30		EGEDHN
Cc1ccccc1C[C@H]1CCCN1Cc1cnc2c(C#N)cnn2c1	ZINC000565303893	316307139	/nfs/dbraw/zinc/30/71/39/316307139.db2.gz	VWIMAAQIAUJFLB-LJQANCHMSA-N	0	3	331.423	3.117	20	30		EGEDHN
Cc1cc(CNc2ccc(CN3CCN(C)CC3)cc2)ccc1C#N	ZINC000565636831	316349387	/nfs/dbraw/zinc/34/93/87/316349387.db2.gz	RPCSYNMSHRHHDT-UHFFFAOYSA-N	0	3	334.467	3.226	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CN[C@H]2CCSc3ccccc32)cc1	ZINC000568971725	316848265	/nfs/dbraw/zinc/84/82/65/316848265.db2.gz	IUABNRKJYGLVFN-YJBOKZPZSA-N	0	3	340.448	3.125	20	30		EGEDHN
C[C@]1(O)CCCN(CC#Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000279945559	455878072	/nfs/dbraw/zinc/87/80/72/455878072.db2.gz	GLSFMUHIRJQKEZ-INIZCTEOSA-N	0	3	327.346	3.174	20	30		EGEDHN
N#Cc1ccc(CNCC2(CN3CCOCC3)CCCCC2)c(F)c1	ZINC000178794508	323360864	/nfs/dbraw/zinc/36/08/64/323360864.db2.gz	QVYNZYNRASQAOH-UHFFFAOYSA-N	0	3	345.462	3.070	20	30		EGEDHN
Cc1nc2ccccc2c(N2CCN(c3ccc(C#N)cn3)CC2)c1C	ZINC000181852639	323508647	/nfs/dbraw/zinc/50/86/47/323508647.db2.gz	GHQLBPWAVSAZOB-UHFFFAOYSA-N	0	3	343.434	3.445	20	30		EGEDHN
CN(C1Cc2ccccc2C1)[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000578721490	325007598	/nfs/dbraw/zinc/00/75/98/325007598.db2.gz	NLKNSLDQHQPLBU-OAQYLSRUSA-N	0	3	345.446	3.153	20	30		EGEDHN
CCO[C@H]1C[C@H](N(C)Cc2cnc3c(C#N)cnn3c2)C1(CC)CC	ZINC000580952098	325313248	/nfs/dbraw/zinc/31/32/48/325313248.db2.gz	HKFIJXVMFUGYSE-IRXDYDNUSA-N	0	3	341.459	3.017	20	30		EGEDHN
C=CCN1CCC(NC(=O)C[C@@H](C)Cc2ccccc2OC)CC1	ZINC000264470716	455220295	/nfs/dbraw/zinc/22/02/95/455220295.db2.gz	SSJXTOKYZZTZOM-INIZCTEOSA-N	0	3	330.472	3.031	20	30		EGEDHN
CCOc1cccc([C@@H](C)NC[C@H](O)COc2ccc(C#N)cc2)c1	ZINC000180710338	455232458	/nfs/dbraw/zinc/23/24/58/455232458.db2.gz	NJFRQSWLPJJJSI-QAPCUYQASA-N	0	3	340.423	3.047	20	30		EGEDHN
C[C@@H](NC(=O)[C@H](N)CCCC#N)c1cc(F)c(Cl)cc1Cl	ZINC000424061424	458548185	/nfs/dbraw/zinc/54/81/85/458548185.db2.gz	FFPASULBBDAPHI-AMIZOPFISA-N	0	3	332.206	3.331	20	30		EGEDHN
C=CC[C@H](C)N[C@H](C)c1ccc(S(=O)(=O)C(F)F)c(OC)c1	ZINC000180949521	455268257	/nfs/dbraw/zinc/26/82/57/455268257.db2.gz	UMRYHDDVIMWELX-WDEREUQCSA-N	0	3	333.400	3.307	20	30		EGEDHN
OCC[C@@H]1CCCCN1CC#Cc1ccc(OC(F)(F)F)cc1	ZINC000158466097	455305970	/nfs/dbraw/zinc/30/59/70/455305970.db2.gz	BHSREENRCAKUAW-HNNXBMFYSA-N	0	3	327.346	3.174	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N1CCC[C@](C)(C#N)C1)C(C)C	ZINC000612358105	460604860	/nfs/dbraw/zinc/60/48/60/460604860.db2.gz	PYABILOHIADFPI-PKOBYXMFSA-N	0	3	332.492	3.020	20	30		EGEDHN
N#CCc1ccc(OC[C@H](O)CN(Cc2ccccc2)C2CC2)cc1	ZINC000025259849	453763379	/nfs/dbraw/zinc/76/33/79/453763379.db2.gz	XZNBZDKZKQJYIR-HXUWFJFHSA-N	0	3	336.435	3.157	20	30		EGEDHN
C[C@@H](NC[C@H](O)COc1ccc(Cl)cc1)c1ccc(C#N)cc1	ZINC000030532769	453836349	/nfs/dbraw/zinc/83/63/49/453836349.db2.gz	BOPWEAHBNGYFQF-DYVFJYSZSA-N	0	3	330.815	3.302	20	30		EGEDHN
CSc1ccc([C@H](C)NC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000030534647	453836368	/nfs/dbraw/zinc/83/63/68/453836368.db2.gz	BLCCNPSERVJKTG-WMLDXEAASA-N	0	3	342.464	3.371	20	30		EGEDHN
N#Cc1ccc(NC(=O)NCC2(N3CCSCC3)CCCC2)cc1	ZINC000031096579	453838569	/nfs/dbraw/zinc/83/85/69/453838569.db2.gz	NHKFAIZJORPBFM-UHFFFAOYSA-N	0	3	344.484	3.041	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)c1cccc(C#N)c1)c1ccsc1	ZINC000031988775	453860507	/nfs/dbraw/zinc/86/05/07/453860507.db2.gz	WKJHEBJMSQVIOD-KRWDZBQOSA-N	0	3	327.453	3.433	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1CCC[C@H](c2ccccc2)CC1	ZINC000066897821	453884209	/nfs/dbraw/zinc/88/42/09/453884209.db2.gz	WRLHZDCVZBDOFM-MJGOQNOKSA-N	0	3	327.472	3.264	20	30		EGEDHN
C=CCN(Cc1ccc(Cl)s1)C(=O)NC1CCN(C)CC1	ZINC000053963284	453902450	/nfs/dbraw/zinc/90/24/50/453902450.db2.gz	MTZSAZFSWGOXCD-UHFFFAOYSA-N	0	3	327.881	3.193	20	30		EGEDHN
N#Cc1ccc(OCCN2CC[C@@H](COCc3ccccc3)C2)cc1	ZINC000075864490	453933413	/nfs/dbraw/zinc/93/34/13/453933413.db2.gz	QAZZBEVQUAKRGM-HXUWFJFHSA-N	0	3	336.435	3.476	20	30		EGEDHN
N#CC(C(=O)c1cnn(Cc2ccccc2Cl)c1)c1ccccn1	ZINC000041492259	453969156	/nfs/dbraw/zinc/96/91/56/453969156.db2.gz	QFFPUBOHABCXKU-OAHLLOKOSA-N	0	3	336.782	3.470	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccc(NC(=O)C(C)C)cc2)nc(C)n1	ZINC000041560150	453972335	/nfs/dbraw/zinc/97/23/35/453972335.db2.gz	SBMOQXWIGMDAIH-INIZCTEOSA-N	0	3	336.395	3.178	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccc(OC(F)(F)F)cc2)nc(C)n1	ZINC000041574092	453973248	/nfs/dbraw/zinc/97/32/48/453973248.db2.gz	HZWRAXAPDFJFPD-ZDUSSCGKSA-N	0	3	335.285	3.482	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1CC[C@@H](Oc2ccccc2)C1	ZINC000077316251	454090000	/nfs/dbraw/zinc/09/00/00/454090000.db2.gz	BIDQZQMYCLIFKF-GOSISDBHSA-N	0	3	338.407	3.099	20	30		EGEDHN
C#CCN(CCc1nc2ccccc2c(=O)[nH]1)[C@H]1CCc2ccccc21	ZINC000077328637	454092122	/nfs/dbraw/zinc/09/21/22/454092122.db2.gz	MNSWZOLZHSPMFQ-FQEVSTJZSA-N	0	3	343.430	3.088	20	30		EGEDHN
N#Cc1ccc(CNC(=O)C2CCN(Cc3ccccc3)CC2)cc1	ZINC000057155808	454107222	/nfs/dbraw/zinc/10/72/22/454107222.db2.gz	POJMHFCASUFPFP-UHFFFAOYSA-N	0	3	333.435	3.087	20	30		EGEDHN
C=C(C)COCCNC(=O)NCC(C)(C)N[C@H](C)c1ccccc1	ZINC000130207035	454181469	/nfs/dbraw/zinc/18/14/69/454181469.db2.gz	KQVKMTVIPNGVRA-MRXNPFEDSA-N	0	3	333.476	3.008	20	30		EGEDHN
C#CCCCCC(=O)Nc1ccc(N(C)C2CCN(C)CC2)cc1	ZINC000119659435	454211036	/nfs/dbraw/zinc/21/10/36/454211036.db2.gz	URFSATGNMRWPEU-UHFFFAOYSA-N	0	3	327.472	3.349	20	30		EGEDHN
C=CCCS(=O)(=O)NCc1ccccc1CN1CCCC[C@@H]1C	ZINC000119680806	454213603	/nfs/dbraw/zinc/21/36/03/454213603.db2.gz	UHFKPUDKJROMMM-INIZCTEOSA-N	0	3	336.501	3.057	20	30		EGEDHN
CCN1CCN(c2ccccc2CN(C)Cc2cccc(C#N)c2)CC1	ZINC000130776133	454218430	/nfs/dbraw/zinc/21/84/30/454218430.db2.gz	WYJMHFJEZGAGOR-UHFFFAOYSA-N	0	3	348.494	3.332	20	30		EGEDHN
CC[C@@H](c1ccc(F)cc1F)N(C)CCCc1[nH]nc(N)c1C#N	ZINC000089943456	454242505	/nfs/dbraw/zinc/24/25/05/454242505.db2.gz	WDVALNRCDQQIHH-INIZCTEOSA-N	0	3	333.386	3.157	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC1CCN([C@H](C)c2ccccc2)CC1	ZINC000071909306	454252112	/nfs/dbraw/zinc/25/21/12/454252112.db2.gz	MXFZCFWSIZCTPK-IAGOWNOFSA-N	0	3	330.472	3.309	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc(C(F)(F)F)nc2)CC1	ZINC000131425194	454252632	/nfs/dbraw/zinc/25/26/32/454252632.db2.gz	GLCCRRPFTOKKGH-UHFFFAOYSA-N	0	3	342.365	3.262	20	30		EGEDHN
C=CCNC(=O)[C@@H](C)N[C@@H](C)c1ccc(OCc2cccnc2)cc1	ZINC000120090232	454256648	/nfs/dbraw/zinc/25/66/48/454256648.db2.gz	DDQCMPJXOJZOPC-JKSUJKDBSA-N	0	3	339.439	3.002	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(Cc2ccccc2OC)C2CC2)CC1	ZINC000072270222	454279641	/nfs/dbraw/zinc/27/96/41/454279641.db2.gz	XVFWBHQPVYNKLT-UHFFFAOYSA-N	0	3	343.471	3.020	20	30		EGEDHN
CCc1ccc(C(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)cc1	ZINC000047010860	454318385	/nfs/dbraw/zinc/31/83/85/454318385.db2.gz	DEIVXRTZLDTNAT-UHFFFAOYSA-N	0	3	335.451	3.325	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)c1cc(F)cc(F)c1	ZINC000047010558	454318578	/nfs/dbraw/zinc/31/85/78/454318578.db2.gz	TUQIXNNAUMHNFC-UHFFFAOYSA-N	0	3	343.377	3.040	20	30		EGEDHN
CCN(Cc1ccccc1C)C[C@@H](O)COc1ccc(CC#N)cc1	ZINC000078875952	454331470	/nfs/dbraw/zinc/33/14/70/454331470.db2.gz	MRIVRZFPVUTJLH-HXUWFJFHSA-N	0	3	338.451	3.323	20	30		EGEDHN
CN(C)[C@H](CNC(=O)N(C)Cc1ccc(C#N)cc1)c1ccccc1	ZINC000079121278	454372007	/nfs/dbraw/zinc/37/20/07/454372007.db2.gz	WRFRXFUULDINPL-LJQANCHMSA-N	0	3	336.439	3.003	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N[C@@H](C)c1ccccn1)C(C)C	ZINC000079206321	454381458	/nfs/dbraw/zinc/38/14/58/454381458.db2.gz	RGCTVSFZFNPVKL-FUHWJXTLSA-N	0	3	330.476	3.140	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N[C@@H](C)c1ccccn1)C(C)C	ZINC000079206326	454381784	/nfs/dbraw/zinc/38/17/84/454381784.db2.gz	RGCTVSFZFNPVKL-WMZOPIPTSA-N	0	3	330.476	3.140	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC2(c3ccccc3)CCCC2)CC1	ZINC000073216066	454408883	/nfs/dbraw/zinc/40/88/83/454408883.db2.gz	LSMQZKCCOILHAT-UHFFFAOYSA-N	0	3	327.472	3.406	20	30		EGEDHN
Cc1noc([C@@H]2CCCN(Cc3ccc(O[C@@H](C)C#N)cc3)C2)n1	ZINC000091832558	454477709	/nfs/dbraw/zinc/47/77/09/454477709.db2.gz	JHYUNCCUFRMUPR-XJKSGUPXSA-N	0	3	326.400	3.049	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cc2c(s1)CCOC2)C(C)C	ZINC000103205744	454542767	/nfs/dbraw/zinc/54/27/67/454542767.db2.gz	OZTUCXHOZXOWSV-MRXNPFEDSA-N	0	3	348.512	3.249	20	30		EGEDHN
N#CC(C(=O)CCc1cccc(Cl)c1)C(=O)Nc1ccccn1	ZINC000103717480	454564530	/nfs/dbraw/zinc/56/45/30/454564530.db2.gz	UWHVAPFZTGFUAA-AWEZNQCLSA-N	0	3	327.771	3.015	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(Cc3cccc4c[nH]nc43)CC2)cc1	ZINC000122814363	454571334	/nfs/dbraw/zinc/57/13/34/454571334.db2.gz	XMVLZQXKOXDSAT-UHFFFAOYSA-N	0	3	345.450	3.142	20	30		EGEDHN
CCC[C@H](C)NC(=O)[C@@H]1CCCN(Cc2ccc(OC)c(C#N)c2)C1	ZINC000135013678	454624275	/nfs/dbraw/zinc/62/42/75/454624275.db2.gz	HSUANRCILBDRGB-DOTOQJQBSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000135096586	454633123	/nfs/dbraw/zinc/63/31/23/454633123.db2.gz	YRHJHTDHCMZCJX-TZIWHRDSSA-N	0	3	344.499	3.151	20	30		EGEDHN
CN(CCC1CCN(c2ccncc2)CC1)C[C@H](C#N)CCC#N	ZINC000092820954	454640108	/nfs/dbraw/zinc/64/01/08/454640108.db2.gz	YFUFQJFEQZAXIC-SFHVURJKSA-N	0	3	325.460	3.063	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)c1ccc(Cl)s1	ZINC000065931153	454641261	/nfs/dbraw/zinc/64/12/61/454641261.db2.gz	ILWQTUZXIOXRNM-UHFFFAOYSA-N	0	3	347.871	3.477	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCSc2ccc(OC)cc2)CC1	ZINC000106038048	454675755	/nfs/dbraw/zinc/67/57/55/454675755.db2.gz	BFGGIYLAPNWPMD-UHFFFAOYSA-N	0	3	348.512	3.334	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](CC)c2nc(C)cs2)CC1	ZINC000106275383	454689467	/nfs/dbraw/zinc/68/94/67/454689467.db2.gz	ZWIADSYMMURUHI-HNNXBMFYSA-N	0	3	336.505	3.242	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2CCc3c2cccc3C)CC1	ZINC000106275371	454689904	/nfs/dbraw/zinc/68/99/04/454689904.db2.gz	RMSZIPVIQNGCHF-LJQANCHMSA-N	0	3	327.472	3.322	20	30		EGEDHN
CN(C)Cc1cccc(CNC(=O)[C@@H]2C[C@H]2c2cccc(C#N)c2)c1	ZINC000081130432	454690148	/nfs/dbraw/zinc/69/01/48/454690148.db2.gz	HOHJIQNGTXEPFX-VQTJNVASSA-N	0	3	333.435	3.040	20	30		EGEDHN
CC(C)[C@H](CCO)NCC(=O)Nc1ccccc1S[C@@H](C)CC#N	ZINC000161851923	454728643	/nfs/dbraw/zinc/72/86/43/454728643.db2.gz	BUYUMIROCREHNG-GJZGRUSLSA-N	0	3	349.500	3.016	20	30		EGEDHN
C[C@H](C(=O)N(CCC#N)c1ccc(F)cc1)N1C[C@@H]2CCC[C@@H]2C1	ZINC000152848547	454732903	/nfs/dbraw/zinc/73/29/03/454732903.db2.gz	UYCFKZRATWTNNK-OAGGEKHMSA-N	0	3	329.419	3.193	20	30		EGEDHN
CCOC(=O)CC[C@@H]1CCCN(Cc2ccc(OC)c(C#N)c2)C1	ZINC000162096102	454751156	/nfs/dbraw/zinc/75/11/56/454751156.db2.gz	JKDBLBFFXPGBMP-HNNXBMFYSA-N	0	3	330.428	3.122	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1	ZINC000162974296	454814002	/nfs/dbraw/zinc/81/40/02/454814002.db2.gz	UKJKMQYMNFOLSP-QGZVFWFLSA-N	0	3	345.487	3.137	20	30		EGEDHN
Cc1ccc([C@@H](CNC(=O)C2(C#N)CCCC2)N2CCCC2)cc1	ZINC000143190539	454842016	/nfs/dbraw/zinc/84/20/16/454842016.db2.gz	WXRURXCFRRMMLP-GOSISDBHSA-N	0	3	325.456	3.332	20	30		EGEDHN
C=C(CN[C@H](C)c1cccc(S(=O)(=O)N(C)C)c1)c1ccccc1	ZINC000266876736	455467034	/nfs/dbraw/zinc/46/70/34/455467034.db2.gz	OIYVZKQQHXEEOR-MRXNPFEDSA-N	0	3	344.480	3.301	20	30		EGEDHN
COCCOC[C@@H]1CCN(CC#Cc2ccc(C(F)(F)F)cc2)C1	ZINC000177350926	454855056	/nfs/dbraw/zinc/85/50/56/454855056.db2.gz	JFSDTTWTOWGZPL-MRXNPFEDSA-N	0	3	341.373	3.042	20	30		EGEDHN
CC(C)c1csc(C(C#N)C(=O)c2ccc(-n3cnnc3)cc2)n1	ZINC000177745925	454899193	/nfs/dbraw/zinc/89/91/93/454899193.db2.gz	PRBNRBGJWGYMQG-CQSZACIVSA-N	0	3	337.408	3.337	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC[C@@H](C)c2cccc(C)c2)CC1	ZINC000154872227	454938389	/nfs/dbraw/zinc/93/83/89/454938389.db2.gz	NPNXRXDUSXTNOY-QGZVFWFLSA-N	0	3	329.488	3.438	20	30		EGEDHN
C=CCC[C@H](NCCS(=O)(=O)c1ccc(Cl)cc1)C1CC1	ZINC000178683325	454966945	/nfs/dbraw/zinc/96/69/45/454966945.db2.gz	CTNIOENANNSTCG-INIZCTEOSA-N	0	3	327.877	3.448	20	30		EGEDHN
CCCN(CC(=O)NCC#Cc1cccc(C(F)(F)F)c1)C1CC1	ZINC000171680114	455086174	/nfs/dbraw/zinc/08/61/74/455086174.db2.gz	KIDKKXMVKIVLLT-UHFFFAOYSA-N	0	3	338.373	3.048	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)CNC1(c2ccc(F)cc2)CCCC1	ZINC000171694111	455086673	/nfs/dbraw/zinc/08/66/73/455086673.db2.gz	QZKLXDBEUDGFLT-SFHVURJKSA-N	0	3	331.435	3.239	20	30		EGEDHN
C[C@H](C(=O)NCCCCC#N)N1CCC(Cc2ccccc2)CC1	ZINC000171806468	455095220	/nfs/dbraw/zinc/09/52/20/455095220.db2.gz	ZJUKMSQGPMYZFK-QGZVFWFLSA-N	0	3	327.472	3.140	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccccc2NC(=O)C(C)(C)C)CC1	ZINC000171976356	455105323	/nfs/dbraw/zinc/10/53/23/455105323.db2.gz	PJZFAUMJVYMZDP-UHFFFAOYSA-N	0	3	343.471	3.051	20	30		EGEDHN
CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Nc1ccccc1O[C@@H](C)C#N	ZINC000180015231	455116536	/nfs/dbraw/zinc/11/65/36/455116536.db2.gz	JWYKKLDPZMNKAU-XHSDSOJGSA-N	0	3	342.443	3.068	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@H]2Cc2ccc(C)cc2)CC1	ZINC000172265112	455141096	/nfs/dbraw/zinc/14/10/96/455141096.db2.gz	JOOFXCANFNJISD-FQEVSTJZSA-N	0	3	341.499	3.362	20	30		EGEDHN
C[C@](C#N)(NC(=O)CN[C@H](c1ccc(F)cc1)C1CCCC1)C1CC1	ZINC000180283028	455154696	/nfs/dbraw/zinc/15/46/96/455154696.db2.gz	XOZOGUICUFMWKB-VQTJNVASSA-N	0	3	343.446	3.455	20	30		EGEDHN
C=C(C)CN1CCC(N[C@@H](c2cnn(C)c2)c2cccc(F)c2)CC1	ZINC000180489974	455181265	/nfs/dbraw/zinc/18/12/65/455181265.db2.gz	KTZMEZWLHHALEP-HXUWFJFHSA-N	0	3	342.462	3.279	20	30		EGEDHN
C=CCn1c(SCCN2CCC(C)CC2)nnc1-c1ccccn1	ZINC000157495534	455199882	/nfs/dbraw/zinc/19/98/82/455199882.db2.gz	JLGFOTJJJDWTQA-UHFFFAOYSA-N	0	3	343.500	3.350	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H]2CCSc3ccc(F)cc32)CC1	ZINC000264379405	455201756	/nfs/dbraw/zinc/20/17/56/455201756.db2.gz	IFJCUWNCVQSCQP-INIZCTEOSA-N	0	3	349.475	3.312	20	30		EGEDHN
C[C@H]1Cc2ccccc2CN1CCC(=O)Nc1sccc1C#N	ZINC000172905008	455208063	/nfs/dbraw/zinc/20/80/63/455208063.db2.gz	NJGWWXHPMUPZHX-ZDUSSCGKSA-N	0	3	325.437	3.395	20	30		EGEDHN
CCC1(CC)[C@H](N[C@H](C)C(=O)Nc2ccccc2C#N)[C@H](C)[C@H]1OC	ZINC000245596998	455337224	/nfs/dbraw/zinc/33/72/24/455337224.db2.gz	IWGZCTNEZVNCDP-MJSCVDMRSA-N	0	3	343.471	3.315	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@@H](CCO)C(C)(C)C	ZINC000181487952	455343425	/nfs/dbraw/zinc/34/34/25/455343425.db2.gz	MGRKCOOCSMRVBJ-INIZCTEOSA-N	0	3	336.501	3.290	20	30		EGEDHN
C[C@H](N[C@H]1CC(=O)N(c2ccccc2)C1)c1ccc(OCC#N)cc1	ZINC000181589966	455359018	/nfs/dbraw/zinc/35/90/18/455359018.db2.gz	AQTRRBWLZNZJCR-RDJZCZTQSA-N	0	3	335.407	3.045	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000184303273	455368532	/nfs/dbraw/zinc/36/85/32/455368532.db2.gz	VLFCXKBJMQFPDL-FXAWDEMLSA-N	0	3	344.499	3.151	20	30		EGEDHN
C#CCC(C)(C)C(=O)N[C@@H]1CC2(CCN(C)CC2)Oc2ccccc21	ZINC000184352612	455373172	/nfs/dbraw/zinc/37/31/72/455373172.db2.gz	AKGRZLGYBOUTEE-QGZVFWFLSA-N	0	3	340.467	3.140	20	30		EGEDHN
C[C@@H](NCCCS(=O)(=O)c1ccccc1)c1cccc(C#N)c1	ZINC000181982403	455408895	/nfs/dbraw/zinc/40/88/95/455408895.db2.gz	MOFNVWZMCQYJOZ-OAHLLOKOSA-N	0	3	328.437	3.073	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC[C@@H]2c2ccc(Cl)cc2)CC1	ZINC000266563319	455431224	/nfs/dbraw/zinc/43/12/24/455431224.db2.gz	URQQWDIDYYNPKF-QGZVFWFLSA-N	0	3	333.863	3.447	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(Cl)c(OC(F)F)c2)CC1	ZINC000182268310	455476708	/nfs/dbraw/zinc/47/67/08/455476708.db2.gz	XUEJXLFBGLKXGZ-UHFFFAOYSA-N	0	3	342.773	3.225	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@@H](C)N1CCC[C@@H](COC)C1	ZINC000246691408	455517442	/nfs/dbraw/zinc/51/74/42/455517442.db2.gz	HUFWVZWWGVMXDN-HZPDHXFCSA-N	0	3	336.501	3.010	20	30		EGEDHN
N#Cc1cccc(CNc2ccccc2CN2CCC(CO)CC2)c1	ZINC000267238186	455522170	/nfs/dbraw/zinc/52/21/70/455522170.db2.gz	RHXLNCHBDSXYNX-UHFFFAOYSA-N	0	3	335.451	3.375	20	30		EGEDHN
C=Cc1ccc(C(=O)N(CCN(C)C)Cc2cccc(C#N)c2)cc1	ZINC000185271229	455531971	/nfs/dbraw/zinc/53/19/71/455531971.db2.gz	YGMNWWZCRLLKTO-UHFFFAOYSA-N	0	3	333.435	3.405	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H](CNC(=O)C1(C#N)CCCCC1)C1CC1	ZINC000185296627	455536314	/nfs/dbraw/zinc/53/63/14/455536314.db2.gz	WQNKDBDCNRDVCR-IBGZPJMESA-N	0	3	339.483	3.487	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000176120947	455543310	/nfs/dbraw/zinc/54/33/10/455543310.db2.gz	ZPSWNMOSMGJDOA-LMMKCTJWSA-N	0	3	330.472	3.137	20	30		EGEDHN
C[C@H](NC[C@H](O)COc1ccc(C#N)cc1)c1cc2ccccc2o1	ZINC000182634492	455557183	/nfs/dbraw/zinc/55/71/83/455557183.db2.gz	COVCBZFZTJDQQH-YOEHRIQHSA-N	0	3	336.391	3.395	20	30		EGEDHN
COc1ccc(CN[C@H]2CCO[C@H]2c2ccc(F)c(F)c2)cc1C#N	ZINC000182695880	455570742	/nfs/dbraw/zinc/57/07/42/455570742.db2.gz	RPFZZCBNDSHFFN-HKUYNNGSSA-N	0	3	344.361	3.465	20	30		EGEDHN
N#Cc1cc(C(=O)N2C[C@H]3CCCN3Cc3ccccc32)ccc1F	ZINC000283802942	455596349	/nfs/dbraw/zinc/59/63/49/455596349.db2.gz	ATENZPVIIPJNPM-QGZVFWFLSA-N	0	3	335.382	3.322	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCc1ccc(OCCN(C)C)c(OC)c1	ZINC000268138884	455598820	/nfs/dbraw/zinc/59/88/20/455598820.db2.gz	CAWCKSYZNSWCCJ-UHFFFAOYSA-N	0	3	346.471	3.020	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N(Cc1ccccc1)C1CCN(C)CC1	ZINC000292229418	455602020	/nfs/dbraw/zinc/60/20/20/455602020.db2.gz	CXUXBNZQPRPRBS-UHFFFAOYSA-N	0	3	346.474	3.333	20	30		EGEDHN
Cc1cnc(C2CCN(C[C@H](O)c3ccc(C#N)cc3)CC2)s1	ZINC000277577991	455603795	/nfs/dbraw/zinc/60/37/95/455603795.db2.gz	VNCKLIBSAYVOIE-KRWDZBQOSA-N	0	3	327.453	3.236	20	30		EGEDHN
C=CCN(C(=O)c1ccc(N2CCN(C(C)C)CC2)cc1)C1CC1	ZINC000271363307	455610897	/nfs/dbraw/zinc/61/08/97/455610897.db2.gz	GRTSUIPFZSENPO-UHFFFAOYSA-N	0	3	327.472	3.008	20	30		EGEDHN
C[C@@H](N[C@@H]1CCC[C@H](C#N)C1)c1cc(F)ccc1N1CCN(C)CC1	ZINC000185821923	455628957	/nfs/dbraw/zinc/62/89/57/455628957.db2.gz	KKODVTATIYYGEC-SOLBZPMBSA-N	0	3	344.478	3.310	20	30		EGEDHN
N#C[C@@H]1CCC[C@H](NCc2cc3c(c(Br)c2)OCO3)C1	ZINC000185882442	455642282	/nfs/dbraw/zinc/64/22/82/455642282.db2.gz	HGIBKJPYAGJJPJ-PWSUYJOCSA-N	0	3	337.217	3.350	20	30		EGEDHN
C=CCCOCCN[C@@H](C)c1ccc(OCc2nccn2C)cc1	ZINC000271500931	455661717	/nfs/dbraw/zinc/66/17/17/455661717.db2.gz	MBDSXTWAJRNWCH-INIZCTEOSA-N	0	3	329.444	3.242	20	30		EGEDHN
COC(=O)[C@@H]1CN(CCC(C)(C)C#N)C[C@H]1c1ccc(Cl)cc1	ZINC000292449278	455665999	/nfs/dbraw/zinc/66/59/99/455665999.db2.gz	PGMIRLCVFZCXRU-JKSUJKDBSA-N	0	3	334.847	3.468	20	30		EGEDHN
CN1CC[C@H](NC(=O)/C=C/c2cccc(C#N)c2)[C@H]1c1ccccc1	ZINC000247987559	455666655	/nfs/dbraw/zinc/66/66/55/455666655.db2.gz	INJVRPJKCMZDAK-XYURJSSKSA-N	0	3	331.419	3.133	20	30		EGEDHN
C=CCSCCN[C@H](CC)c1ccccc1OCC(=O)N(C)C	ZINC000271545096	455679985	/nfs/dbraw/zinc/67/99/85/455679985.db2.gz	ZAJXXSMVFIAUAC-MRXNPFEDSA-N	0	3	336.501	3.114	20	30		EGEDHN
C[C@@H](NC[C@@H](O)COc1cccc2[nH]ccc21)c1ccc(C#N)cc1	ZINC000268462247	455689568	/nfs/dbraw/zinc/68/95/68/455689568.db2.gz	UWWLGWDVDRVKJP-RHSMWYFYSA-N	0	3	335.407	3.130	20	30		EGEDHN
Cc1nc([C@@H]2CCCN(CC#Cc3ccc(C(F)(F)F)cc3)C2)n[nH]1	ZINC000268502144	455699625	/nfs/dbraw/zinc/69/96/25/455699625.db2.gz	SNXRFMIUSTZATJ-OAHLLOKOSA-N	0	3	348.372	3.363	20	30		EGEDHN
Cc1n[nH]c([C@@H]2CCCN(CC#Cc3ccc(C(F)(F)F)cc3)C2)n1	ZINC000268502144	455699628	/nfs/dbraw/zinc/69/96/28/455699628.db2.gz	SNXRFMIUSTZATJ-OAHLLOKOSA-N	0	3	348.372	3.363	20	30		EGEDHN
Cc1nnc([C@@H]2CCCN(CC#Cc3ccc(C(F)(F)F)cc3)C2)[nH]1	ZINC000268502144	455699634	/nfs/dbraw/zinc/69/96/34/455699634.db2.gz	SNXRFMIUSTZATJ-OAHLLOKOSA-N	0	3	348.372	3.363	20	30		EGEDHN
C=CCN1CCC(N[C@@H]2CCCc3oc(C(=O)OCC)c(C)c32)CC1	ZINC000192839371	455703408	/nfs/dbraw/zinc/70/34/08/455703408.db2.gz	LOMIURZCHAVLKR-MRXNPFEDSA-N	0	3	346.471	3.382	20	30		EGEDHN
CN(C)c1ccc(CN(C[C@@H](O)c2ccc(C#N)cc2)C2CC2)cc1	ZINC000268593116	455709954	/nfs/dbraw/zinc/70/99/54/455709954.db2.gz	GKNLVZVUXAAGDG-OAQYLSRUSA-N	0	3	335.451	3.322	20	30		EGEDHN
N#CCOc1cccc(NC(=O)N2CCN(C3CCCCC3)CC2)c1	ZINC000268849615	455715139	/nfs/dbraw/zinc/71/51/39/455715139.db2.gz	CCUKZRCKKIGWMD-UHFFFAOYSA-N	0	3	342.443	3.071	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C1(C#N)CCCCC1	ZINC000248777668	455730919	/nfs/dbraw/zinc/73/09/19/455730919.db2.gz	HSCRKGYOCFJHMT-SJLPKXTDSA-N	0	3	325.456	3.097	20	30		EGEDHN
C[C@@H]1CN(Cc2cccc(CN[C@@H]3CCC[C@@H](C#N)C3)c2)CCO1	ZINC000248855899	455734562	/nfs/dbraw/zinc/73/45/62/455734562.db2.gz	PHJDQHIGWRDRNY-MBOZVWFJSA-N	0	3	327.472	3.079	20	30		EGEDHN
N#C[C@H]1CC[C@H](N2CCC(NC(=O)Nc3ccc(F)cc3)CC2)C1	ZINC000292711991	455738184	/nfs/dbraw/zinc/73/81/84/455738184.db2.gz	FFORPEOBIVXQAK-GUYCJALGSA-N	0	3	330.407	3.104	20	30		EGEDHN
N#C[C@H]1CCC[C@@H](N[C@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)C1	ZINC000193059932	455740349	/nfs/dbraw/zinc/74/03/49/455740349.db2.gz	XNTFRIFVHFPBKE-OZVIIMIRSA-N	0	3	335.810	3.256	20	30		EGEDHN
C[C@@H](NCCOc1cccc(C#N)c1)c1ccc([S@](C)=O)cc1	ZINC000271764892	455751711	/nfs/dbraw/zinc/75/17/11/455751711.db2.gz	CZRBVOJWINPGQU-FATZIPQQSA-N	0	3	328.437	3.025	20	30		EGEDHN
CCS[C@@H]1CCCC[C@@H]1N[C@H](C)C(=O)NC1(C#N)CCCCC1	ZINC000249499855	455758961	/nfs/dbraw/zinc/75/89/61/455758961.db2.gz	IFJNGMNWEKVIQA-OWCLPIDISA-N	0	3	337.533	3.371	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cnn(C(C)(C)C)c1C)C(C)C	ZINC000193467521	455759626	/nfs/dbraw/zinc/75/96/26/455759626.db2.gz	JWMPCQJEEJARHF-GOSISDBHSA-N	0	3	346.519	3.375	20	30		EGEDHN
C#CCOc1cccc(NC(=O)N2CCN(C3CCC3)C[C@H](C)C2)c1	ZINC000292970351	455768587	/nfs/dbraw/zinc/76/85/87/455768587.db2.gz	PYHVAVRRZXWWEL-INIZCTEOSA-N	0	3	341.455	3.037	20	30		EGEDHN
OC[C@@H]1CCCN(CC#Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000293027703	455771724	/nfs/dbraw/zinc/77/17/24/455771724.db2.gz	FZEGCVIMGGFZJR-OAHLLOKOSA-N	0	3	327.346	3.031	20	30		EGEDHN
COc1ccc(CN[C@H](C)[C@H]2CCCCO2)cc1OCCCC#N	ZINC000271941844	455800668	/nfs/dbraw/zinc/80/06/68/455800668.db2.gz	BTURIYYQZHCQCW-NVXWUHKLSA-N	0	3	332.444	3.425	20	30		EGEDHN
CCc1cc[n+](C(C(=O)c2nccs2)C(=S)[N-][C@@H](C)CC)cc1	ZINC000278285012	455805772	/nfs/dbraw/zinc/80/57/72/455805772.db2.gz	QFKAQQPBINOXMF-LBPRGKRZSA-O	0	3	348.517	3.320	20	30		EGEDHN
CCn1nccc1C1CCN(CCCOc2cccc(C#N)c2)CC1	ZINC000278790809	455848291	/nfs/dbraw/zinc/84/82/91/455848291.db2.gz	DWQCWWLFZKUILY-UHFFFAOYSA-N	0	3	338.455	3.423	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN[C@H](c1ccc(F)c(C)c1)C1CC1	ZINC000272125032	455852696	/nfs/dbraw/zinc/85/26/96/455852696.db2.gz	UTTRFIORDIOGHP-YJYMSZOUSA-N	0	3	331.435	3.183	20	30		EGEDHN
CC[C@H](NC[C@@H](O)c1ccc(C#N)cc1)c1ccc(OC)c(OC)c1	ZINC000285476976	455853950	/nfs/dbraw/zinc/85/39/50/455853950.db2.gz	OFLCTQARVFBPKL-ZWKOTPCHSA-N	0	3	340.423	3.350	20	30		EGEDHN
Cc1ccc2c(c1)CC[C@@H]2NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000279281364	455862071	/nfs/dbraw/zinc/86/20/71/455862071.db2.gz	KGCPJMVFEPEYHE-QUCCMNQESA-N	0	3	329.403	3.353	20	30		EGEDHN
CC(C)(CNC(=O)C(C#N)Cc1ccc(C#N)cc1)c1ccc(F)cc1	ZINC000279288188	455862214	/nfs/dbraw/zinc/86/22/14/455862214.db2.gz	KVITYOTYGSVYFD-QGZVFWFLSA-N	0	3	349.409	3.474	20	30		EGEDHN
COc1ccc([C@H](C)NC(=O)C(C#N)Cc2ccc(C#N)cc2)cc1	ZINC000279812898	455873428	/nfs/dbraw/zinc/87/34/28/455873428.db2.gz	XNEVMIMYSYSADQ-KSSFIOAISA-N	0	3	333.391	3.127	20	30		EGEDHN
C[C@@H](N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O)c1cccc(C#N)c1	ZINC000272255748	455893724	/nfs/dbraw/zinc/89/37/24/455893724.db2.gz	WCPQQVIREOJLHH-QRWLVFNGSA-N	0	3	344.418	3.276	20	30		EGEDHN
CC[C@@H]1c2ccccc2CCN1C[C@H](O)COc1ccc(C#N)cc1	ZINC000261480634	455906262	/nfs/dbraw/zinc/90/62/62/455906262.db2.gz	MGEXGWRRAWQXFH-GHTZIAJQSA-N	0	3	336.435	3.307	20	30		EGEDHN
CC[C@@H](NCCn1cc(Br)cn1)c1ccc(C#N)cc1	ZINC000285843103	455927848	/nfs/dbraw/zinc/92/78/48/455927848.db2.gz	YLVLZJXPHUMDLS-OAHLLOKOSA-N	0	3	333.233	3.258	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2ccc(CC#N)cc2)CN1Cc1ccccc1	ZINC000270382684	455943832	/nfs/dbraw/zinc/94/38/32/455943832.db2.gz	QCQNQCAIZNGZGV-OXQOHEQNSA-N	0	3	333.435	3.145	20	30		EGEDHN
C[C@@H]1CN(CCN(C)Cc2ccccc2C(C)(C)C#N)C[C@H](C)O1	ZINC000195327837	455945350	/nfs/dbraw/zinc/94/53/50/455945350.db2.gz	IYUCIANDSCYIGI-CALCHBBNSA-N	0	3	329.488	3.029	20	30		EGEDHN
CN(C)Cc1ccc(-c2noc(Cc3cccc(OCC#N)c3)n2)cc1	ZINC000270435147	455953892	/nfs/dbraw/zinc/95/38/92/455953892.db2.gz	CQXAOYFFBGYTIT-UHFFFAOYSA-N	0	3	348.406	3.291	20	30		EGEDHN
C=C(C)[C@H](NC(=O)NCCN(CC)C1CC1)c1ccc(F)c(F)c1	ZINC000187818758	455956913	/nfs/dbraw/zinc/95/69/13/455956913.db2.gz	OCLBUJREJLYXSF-KRWDZBQOSA-N	0	3	337.414	3.366	20	30		EGEDHN
C=C(C)CN(CC)[C@H](C)C(=O)NC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000216482862	456028938	/nfs/dbraw/zinc/02/89/38/456028938.db2.gz	NABNWYGMKXGFJP-ZIUDEIKKSA-N	0	3	347.503	3.068	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000280736157	456041172	/nfs/dbraw/zinc/04/11/72/456041172.db2.gz	WJMPYXXSCNJTBF-IFXJQAMLSA-N	0	3	337.423	3.100	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@@H](C)N1CC[C@](C)(COC)C1	ZINC000296834475	456048996	/nfs/dbraw/zinc/04/89/96/456048996.db2.gz	SKKINRMZNWSCJN-QAPCUYQASA-N	0	3	336.501	3.010	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)N2CC[C@@H](N3CCCCC3)C2)cc1	ZINC000287013915	456059911	/nfs/dbraw/zinc/05/99/11/456059911.db2.gz	RPCRJXJMEZIUPT-GOSISDBHSA-N	0	3	343.471	3.021	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N[C@H](C)C2CCCC2)cc1	ZINC000287419847	456069336	/nfs/dbraw/zinc/06/93/36/456069336.db2.gz	UVAQWNWIEAHQRY-QWHCGFSZSA-N	0	3	349.456	3.073	20	30		EGEDHN
C=CCOc1ccc(CN[C@H](CC)[C@@H](O)C(F)(F)F)cc1OC	ZINC000271018977	456099225	/nfs/dbraw/zinc/09/92/25/456099225.db2.gz	ULLNSSNTAIMLHF-IUODEOHRSA-N	0	3	333.350	3.051	20	30		EGEDHN
C=CCc1cc(CNCC[C@H](O)c2ccccc2)cc(OC)c1O	ZINC000289443264	456125843	/nfs/dbraw/zinc/12/58/43/456125843.db2.gz	MDUOZDCDSWCDJB-SFHVURJKSA-N	0	3	327.424	3.343	20	30		EGEDHN
C=C[C@@H](CO)N[C@@H](C)c1cccc(OCc2cn3ccccc3n2)c1	ZINC000289703133	456137820	/nfs/dbraw/zinc/13/78/20/456137820.db2.gz	ISESDPCHQVZTOE-RDJZCZTQSA-N	0	3	337.423	3.111	20	30		EGEDHN
CCC1(O)CCN(Cc2ccc(OC)c(OCCCC#N)c2)CC1	ZINC000271166102	456150834	/nfs/dbraw/zinc/15/08/34/456150834.db2.gz	CLRLYKSTDFWXMT-UHFFFAOYSA-N	0	3	332.444	3.115	20	30		EGEDHN
CN(C)CC1(NC(=O)Nc2cccc(C#Cc3ccccn3)c2)CCC1	ZINC000281209502	456165357	/nfs/dbraw/zinc/16/53/57/456165357.db2.gz	AQLFUBAPEZKUAM-UHFFFAOYSA-N	0	3	348.450	3.087	20	30		EGEDHN
Cc1cccc(CN(CCN(C)C)c2ccc(Cl)c(C#N)n2)c1	ZINC000301641756	456172322	/nfs/dbraw/zinc/17/23/22/456172322.db2.gz	MKURJHIHCQGFEY-UHFFFAOYSA-N	0	3	328.847	3.483	20	30		EGEDHN
CCO[C@@H]1C[C@H](/[NH+]=C/c2ccc(N(CC)CC)cc2[O-])[C@@]12CCCO2	ZINC000273538214	456237406	/nfs/dbraw/zinc/23/74/06/456237406.db2.gz	SNUWWJNMXYMJNP-HJAXGLAQSA-N	0	3	346.471	3.384	20	30		EGEDHN
N#C[C@@H]1CCC[C@@H](NCc2cccc(C(=O)NCc3ccco3)c2)C1	ZINC000274205008	456252276	/nfs/dbraw/zinc/25/22/76/456252276.db2.gz	MBHDZOVMMINWID-CRAIPNDOSA-N	0	3	337.423	3.382	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N1CC[C@@H]2CCN(C)C[C@@H]21)c1ccc(F)c(F)c1	ZINC000274846646	456265724	/nfs/dbraw/zinc/26/57/24/456265724.db2.gz	AAWCAXFLBHASHF-KKXDTOCCSA-N	0	3	349.425	3.318	20	30		EGEDHN
CC[C@@H](NCc1ccc(C#N)c(OC)c1)[C@@H](O)c1c(F)cccc1F	ZINC000281674556	456289815	/nfs/dbraw/zinc/28/98/15/456289815.db2.gz	LWGWIMXLKJLZFZ-VQIMIIECSA-N	0	3	346.377	3.447	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000290356749	456303606	/nfs/dbraw/zinc/30/36/06/456303606.db2.gz	LCJSHSMIMQWPKD-AVRDEDQJSA-N	0	3	346.474	3.237	20	30		EGEDHN
C=C(C)CN(CCCC1(C#N)CCOCC1)Cc1ccc(CO)o1	ZINC000352791854	456313803	/nfs/dbraw/zinc/31/38/03/456313803.db2.gz	JJDRXFRBDDKJQC-UHFFFAOYSA-N	0	3	332.444	3.251	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cccc(CC#N)c2)C1	ZINC000336907013	456315604	/nfs/dbraw/zinc/31/56/04/456315604.db2.gz	YNXDGMHAYZHPGI-OXJNMPFZSA-N	0	3	333.435	3.318	20	30		EGEDHN
CCC[C@@]1(C(=O)OCC)CCCN1CCCC1(C#N)CCOCC1	ZINC000337266991	456342504	/nfs/dbraw/zinc/34/25/04/456342504.db2.gz	ZRVSDSPCTMAUDA-IBGZPJMESA-N	0	3	336.476	3.285	20	30		EGEDHN
CN(C[C@H]1CCN(C)[C@@H]1c1cccnc1)c1nccc(C#N)c1Cl	ZINC000343011337	456355637	/nfs/dbraw/zinc/35/56/37/456355637.db2.gz	DYGBBEHZZYZJQE-NVXWUHKLSA-N	0	3	341.846	3.131	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)N(C)C[C@H]1CCCN(C)C1	ZINC000340384654	456429525	/nfs/dbraw/zinc/42/95/25/456429525.db2.gz	BNUFLVIEAARDSM-HNNXBMFYSA-N	0	3	341.480	3.495	20	30		EGEDHN
C=CCCN(C)C(=O)Nc1ccc(N2CCN(CC)CC2)cc1C	ZINC000276279779	456431687	/nfs/dbraw/zinc/43/16/87/456431687.db2.gz	ICQLLTYFAPFDRF-UHFFFAOYSA-N	0	3	330.476	3.177	20	30		EGEDHN
COc1cc(CN2CCC[C@H]2C[C@@H](O)c2ccco2)ccc1C#N	ZINC000282384016	456496425	/nfs/dbraw/zinc/49/64/25/456496425.db2.gz	QVMNZMPJWFIIGB-DLBZAZTESA-N	0	3	326.396	3.248	20	30		EGEDHN
C[C@H](CNC(=O)Nc1ccc(C#N)c(Cl)c1)N1CCC(C)CC1	ZINC000343281458	456504547	/nfs/dbraw/zinc/50/45/47/456504547.db2.gz	DGQIELQOCGAOSO-CYBMUJFWSA-N	0	3	334.851	3.454	20	30		EGEDHN
CN1CC=C(CNC(=O)c2cccc(Nc3ccc(C#N)cc3)c2)CC1	ZINC000343289556	456509835	/nfs/dbraw/zinc/50/98/35/456509835.db2.gz	BXEZRKAWYQMEDV-UHFFFAOYSA-N	0	3	346.434	3.294	20	30		EGEDHN
CN(CC(C)(C)C#N)C(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F	ZINC000353165442	456532900	/nfs/dbraw/zinc/53/29/00/456532900.db2.gz	TWWLRLDKCZRYOK-INIZCTEOSA-N	0	3	349.425	3.152	20	30		EGEDHN
COc1cc(CN[C@@H]2CCN([C@@H](C)c3ccccc3)C2)ccc1C#N	ZINC000353194355	456550642	/nfs/dbraw/zinc/55/06/42/456550642.db2.gz	TVUHDSAVBPIKRV-OXJNMPFZSA-N	0	3	335.451	3.492	20	30		EGEDHN
COc1cc([C@@H](C)N[C@@H](C)c2cccc(C#N)c2)ccc1OCCO	ZINC000305756561	456554903	/nfs/dbraw/zinc/55/49/03/456554903.db2.gz	AIXUAMVDZCIOQO-LSDHHAIUSA-N	0	3	340.423	3.350	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C(=O)[C@H]1CCCN1Cc1ccccc1	ZINC000299149240	456621045	/nfs/dbraw/zinc/62/10/45/456621045.db2.gz	LOVPXVAWWNGXNZ-HXUWFJFHSA-N	0	3	333.435	3.181	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1ccccc1OCC#N)C(C)C	ZINC000299156478	456622077	/nfs/dbraw/zinc/62/20/77/456622077.db2.gz	RYMRRSXHJOTDEH-SFHVURJKSA-N	0	3	341.455	3.017	20	30		EGEDHN
N#Cc1ccc(C(=O)N2CCC(N3CCc4ccccc4C3)CC2)cc1	ZINC000299303605	456653514	/nfs/dbraw/zinc/65/35/14/456653514.db2.gz	AHOPBGXHNDYWDH-UHFFFAOYSA-N	0	3	345.446	3.221	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N[C@H](C)c1ccncc1F)C(C)C	ZINC000338080266	456659002	/nfs/dbraw/zinc/65/90/02/456659002.db2.gz	BFICYIGBWMFRMC-QAPCUYQASA-N	0	3	348.466	3.280	20	30		EGEDHN
N#Cc1ccc(NC(=O)CN[C@H]2CCC[C@H]2OCc2ccccc2)cc1	ZINC000348523261	456735421	/nfs/dbraw/zinc/73/54/21/456735421.db2.gz	CNRVCMXFIADBJT-VQTJNVASSA-N	0	3	349.434	3.224	20	30		EGEDHN
CC(C)(C)c1cn2c(n1)CC[C@@H](NC(=O)C1CCN(C3CC3)CC1)C2	ZINC000328712101	456743017	/nfs/dbraw/zinc/74/30/17/456743017.db2.gz	CEQGDFMHLPBXDF-OAHLLOKOSA-N	0	3	344.503	3.326	20	30		EGEDHN
C[C@@H]1C[C@@H](N2CCCC2)CN1c1ccc(C#N)cc1Br	ZINC000343614772	456745220	/nfs/dbraw/zinc/74/52/20/456745220.db2.gz	SFMKNUOATVBOGZ-TZMCWYRMSA-N	0	3	334.261	3.384	20	30		EGEDHN
COc1ccc(CN[C@@H](C)[C@@H]2OCCc3sccc32)cc1C#N	ZINC000291762314	456747713	/nfs/dbraw/zinc/74/77/13/456747713.db2.gz	RQDXRNGPQQQFAA-SGTLLEGYSA-N	0	3	328.437	3.420	20	30		EGEDHN
CN(Cc1ccccc1)C1CN(c2ccc(C(F)(F)F)c(C#N)n2)C1	ZINC000343625135	456752464	/nfs/dbraw/zinc/75/24/64/456752464.db2.gz	KNIVPELZILWEFN-UHFFFAOYSA-N	0	3	346.356	3.293	20	30		EGEDHN
CC(C)(C)C(=O)NC[C@H]1CCCN(C(=O)C2CCN(C3CC3)CC2)C1	ZINC000328769559	456756956	/nfs/dbraw/zinc/75/69/56/456756956.db2.gz	QTUCAHIQVFWJJA-OAHLLOKOSA-N	0	3	349.519	3.102	20	30		EGEDHN
CN(Cc1ccccc1)C1CN(c2c(C#N)cnc3ccccc32)C1	ZINC000343631067	456757668	/nfs/dbraw/zinc/75/76/68/456757668.db2.gz	MRRQIIKSXZHQLA-UHFFFAOYSA-N	0	3	328.419	3.427	20	30		EGEDHN
C[C@H](NC(=O)[C@@H]1CCCN1C1CCCC1)[C@H](O)Cc1ccccc1	ZINC000328926774	456791965	/nfs/dbraw/zinc/79/19/65/456791965.db2.gz	FJQQRRBRNCINBV-ZYSHUDEJSA-N	0	3	330.472	3.342	20	30		EGEDHN
CCCN(CCN1CCCCCC1)CC(=O)Nc1sccc1C#N	ZINC000344096015	456795900	/nfs/dbraw/zinc/79/59/00/456795900.db2.gz	WLXQBHCXYGVHMO-UHFFFAOYSA-N	0	3	348.516	3.146	20	30		EGEDHN
CCOc1c(Br)cc(CNCCCC#N)cc1OC	ZINC000344362187	456821557	/nfs/dbraw/zinc/82/15/57/456821557.db2.gz	RRTITJDLGZXVIE-UHFFFAOYSA-N	0	3	327.222	3.250	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)NC[C@H](C)N2CCCC[C@H]2C)cc1	ZINC000344098294	456796053	/nfs/dbraw/zinc/79/60/53/456796053.db2.gz	JCOCNWXSMLNIMA-SJORKVTESA-N	0	3	345.487	3.314	20	30		EGEDHN
C=C(C)COCCNCc1cnc2c(C)cc(Br)cn12	ZINC000344321854	456816982	/nfs/dbraw/zinc/81/69/82/456816982.db2.gz	GATRFINGHQHTDT-UHFFFAOYSA-N	0	3	338.249	3.088	20	30		EGEDHN
CC(C)n1ncc2cc(C(=O)N[C@@H]3CCN(C4CCCC4)C3)cnc21	ZINC000329189982	456851165	/nfs/dbraw/zinc/85/11/65/456851165.db2.gz	RQPQBYBGNNFRBP-MRXNPFEDSA-N	0	3	341.459	3.334	20	30		EGEDHN
CN(C)c1cc(Br)cc(C(=O)C(C#N)c2ccccn2)c1	ZINC000344749339	456854067	/nfs/dbraw/zinc/85/40/67/456854067.db2.gz	UCRSEBIZUHTDQE-CQSZACIVSA-N	0	3	344.212	3.400	20	30		EGEDHN
C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)c1ccc(OC2CCCC2)nc1	ZINC000329276261	456865546	/nfs/dbraw/zinc/86/55/46/456865546.db2.gz	BYOMIBXKPMFNBR-CXAGYDPISA-N	0	3	329.444	3.190	20	30		EGEDHN
O=C(NCc1ccccc1CN1CCC[C@@H]1CO)C1CCSCC1	ZINC000329332414	456873813	/nfs/dbraw/zinc/87/38/13/456873813.db2.gz	MTMAKLGTMPHQRI-GOSISDBHSA-N	0	3	348.512	3.243	20	30		EGEDHN
C[C@H](NC(=O)[C@H]1CCCN1C(=O)CC(C)(C)C)C1=CCN(C)CC1	ZINC000329337750	456874143	/nfs/dbraw/zinc/87/41/43/456874143.db2.gz	MQCRTUYINSKJMQ-GOEBONIOSA-N	0	3	335.492	3.021	20	30		EGEDHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)NCC(C)(C)CCC#N	ZINC000341538570	456875321	/nfs/dbraw/zinc/87/53/21/456875321.db2.gz	WNLBJQOOQBKLGY-MRXNPFEDSA-N	0	3	330.476	3.136	20	30		EGEDHN
CN(CCC#N)C(=O)CCN[C@@H](CC(F)(F)F)c1ccccc1	ZINC000341593740	456879801	/nfs/dbraw/zinc/87/98/01/456879801.db2.gz	QKQALZSCAMBWMV-AWEZNQCLSA-N	0	3	327.350	3.032	20	30		EGEDHN
C[C@@H](C(=O)NC(=O)Nc1ccc2c(c1)OCCO2)N(C)CC1CCC1	ZINC000329392781	456883741	/nfs/dbraw/zinc/88/37/41/456883741.db2.gz	VWVNPPKZJMBYGU-LBPRGKRZSA-N	0	3	347.415	3.080	20	30		EGEDHN
CCn1cc(Br)cc1C(=O)C(C#N)c1cc(C)nc(C)n1	ZINC000339018188	456902805	/nfs/dbraw/zinc/90/28/05/456902805.db2.gz	WCQQCALAALMDTG-LBPRGKRZSA-N	0	3	347.216	3.167	20	30		EGEDHN
C[C@H](NC(=O)N[C@@H]1CCCOc2ccc(F)cc21)C1=CCN(C)CC1	ZINC000329515633	456903354	/nfs/dbraw/zinc/90/33/54/456903354.db2.gz	OPEUYWBWQLHYPY-SUMWQHHRSA-N	0	3	347.434	3.193	20	30		EGEDHN
CC[C@@H]1CCc2nc(NC(=O)N[C@H]3CCc4[nH]cnc4C3)sc2C1	ZINC000329522059	456904443	/nfs/dbraw/zinc/90/44/43/456904443.db2.gz	PFRBVWCZCNNRRV-MNOVXSKESA-N	0	3	345.472	3.265	20	30		EGEDHN
CC[C@@H]1CCc2nc(NC(=O)N[C@H]3CCc4nc[nH]c4C3)sc2C1	ZINC000329522059	456904444	/nfs/dbraw/zinc/90/44/44/456904444.db2.gz	PFRBVWCZCNNRRV-MNOVXSKESA-N	0	3	345.472	3.265	20	30		EGEDHN
Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)N[C@@H]1CCN(C)[C@H](C)C1	ZINC000329703472	456930213	/nfs/dbraw/zinc/93/02/13/456930213.db2.gz	IUJBWOOKDIXWHC-XYPHTWIQSA-N	0	3	347.507	3.340	20	30		EGEDHN
[O-]C(NC[C@@H]1CCc2nccn2C1)=[NH+][C@@H]1CC[C@@H]2CCCC[C@H]2C1	ZINC000329902205	456958700	/nfs/dbraw/zinc/95/87/00/456958700.db2.gz	PFNBAJJPFQHQPB-LUKYLMHMSA-N	0	3	330.476	3.308	20	30		EGEDHN
C[C@@H]1CCN(Cc2cccc(OCc3ccccc3C#N)c2)C[C@H]1O	ZINC000349408311	456964507	/nfs/dbraw/zinc/96/45/07/456964507.db2.gz	PDXBSHRGRQUBNJ-IIBYNOLFSA-N	0	3	336.435	3.340	20	30		EGEDHN
C[C@H](NCc1ccc(F)cc1C#N)C1CCN(CC(F)(F)F)CC1	ZINC000339155026	456967697	/nfs/dbraw/zinc/96/76/97/456967697.db2.gz	BADCRSLUHCTBLC-LBPRGKRZSA-N	0	3	343.368	3.450	20	30		EGEDHN
Cc1nnsc1C(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1	ZINC000329969929	456968557	/nfs/dbraw/zinc/96/85/57/456968557.db2.gz	XQNHDIDTQMYHKM-UHFFFAOYSA-N	0	3	345.472	3.013	20	30		EGEDHN
C=CC[C@@H](CO)CN[C@H]1CCCOc2cc(Br)ccc21	ZINC000341885213	456986744	/nfs/dbraw/zinc/98/67/44/456986744.db2.gz	LBKQVFICASPTHC-DOMZBBRYSA-N	0	3	340.261	3.437	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)CN1C1CC1	ZINC000330214791	457005376	/nfs/dbraw/zinc/00/53/76/457005376.db2.gz	GKQWNFHWAKYJSD-DGCLKSJQSA-N	0	3	327.428	3.496	20	30		EGEDHN
N#Cc1cccc(CN2CCC(CCCN3CCOCC3)CC2)c1F	ZINC000356471979	457006898	/nfs/dbraw/zinc/00/68/98/457006898.db2.gz	ICNCGJVMDXAFMO-UHFFFAOYSA-N	0	3	345.462	3.022	20	30		EGEDHN
CCn1ccnc1[C@@H]1CCCCN1C(=O)NC[C@H]1CCCCN1CC	ZINC000330280634	457021157	/nfs/dbraw/zinc/02/11/57/457021157.db2.gz	SSNCSNSITJXELC-SJORKVTESA-N	0	3	347.507	3.218	20	30		EGEDHN
CC(C)[C@H](C(=O)N[C@@H]1CCOC2(CCOCC2)C1)N1CCCCC1	ZINC000330307004	457024551	/nfs/dbraw/zinc/02/45/51/457024551.db2.gz	LQKHFWOLVRQJCX-IAGOWNOFSA-N	0	3	338.492	3.182	20	30		EGEDHN
CCS(=O)(=O)c1ccc([C@H](C)NCc2ccc(CC#N)cc2)cc1	ZINC000341965041	457028329	/nfs/dbraw/zinc/02/83/29/457028329.db2.gz	HNZOUDUYDGJZSY-HNNXBMFYSA-N	0	3	342.464	3.397	20	30		EGEDHN
Cn1cncc1[C@@H]1C[C@H](NC(=O)[C@H]2CCCN2C2CCCC2)CCO1	ZINC000330330793	457029578	/nfs/dbraw/zinc/02/95/78/457029578.db2.gz	NOQQXEDYODQGSV-KYJSFNMBSA-N	0	3	346.475	3.004	20	30		EGEDHN
N#CC(C(=O)c1cccc(C(=O)Nc2ccccc2)c1)c1ccncn1	ZINC000354053929	457033659	/nfs/dbraw/zinc/03/36/59/457033659.db2.gz	PYTHSAYMPNZQAD-QGZVFWFLSA-N	0	3	342.358	3.219	20	30		EGEDHN
O=C(N[C@@H](CO)CN1CCCCC1)c1ccc(Cl)c(Cl)c1	ZINC000330600235	457059383	/nfs/dbraw/zinc/05/93/83/457059383.db2.gz	FUBXXJSNHRZVKK-GFCCVEGCSA-N	0	3	331.243	3.145	20	30		EGEDHN
CC[C@H](C)n1nc(NC(=O)NCC(C)(C)N2CCCCC2)cc1C	ZINC000330688086	457070414	/nfs/dbraw/zinc/07/04/14/457070414.db2.gz	NYNYCJAVRVQJIA-AWEZNQCLSA-N	0	3	335.496	3.175	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N[C@@H](C)c1cncc(F)c1)C(C)C	ZINC000359346799	457075674	/nfs/dbraw/zinc/07/56/74/457075674.db2.gz	ZMDVBOWGGCEUPL-MAUKXSAKSA-N	0	3	348.466	3.280	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCN1C	ZINC000330914748	457103507	/nfs/dbraw/zinc/10/35/07/457103507.db2.gz	JHWZSEBBBOLQMP-MWLCHTKSSA-N	0	3	345.321	3.401	20	30		EGEDHN
Cc1nn(CC(F)(F)F)cc1C(=O)N[C@H](C)CN1CCC[C@H](C)C1	ZINC000331041271	457123953	/nfs/dbraw/zinc/12/39/53/457123953.db2.gz	DMIUGFXDDQZLAE-NWDGAFQWSA-N	0	3	346.397	3.179	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N[C@H]1CCN(Cc2ccccc2)[C@H]1C)OCC	ZINC000359829602	457135247	/nfs/dbraw/zinc/13/52/47/457135247.db2.gz	FYQRDWZDLWKRQV-WDSOQIARSA-N	0	3	330.472	3.137	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F	ZINC000349992341	457136076	/nfs/dbraw/zinc/13/60/76/457136076.db2.gz	REQXTOZPQYEXOI-NVXWUHKLSA-N	0	3	349.425	3.152	20	30		EGEDHN
N#CCSCCCN1CCC([C@H]2C(=O)Nc3ccccc32)CC1	ZINC000362898619	457146828	/nfs/dbraw/zinc/14/68/28/457146828.db2.gz	KLJGZICAKAMVMU-QGZVFWFLSA-N	0	3	329.469	3.081	20	30		EGEDHN
C=C(CN[C@H](C)c1ccc(S(=O)(=O)N(C)C)cc1)c1ccccc1	ZINC000346782943	457167874	/nfs/dbraw/zinc/16/78/74/457167874.db2.gz	UJCULFVQMMPFNE-MRXNPFEDSA-N	0	3	344.480	3.301	20	30		EGEDHN
C=CCOc1ccc(C(=O)NCCN2CCCC[C@H]2CC)cc1OC	ZINC000354373425	457186993	/nfs/dbraw/zinc/18/69/93/457186993.db2.gz	SPJAEXKGMDABHX-QGZVFWFLSA-N	0	3	346.471	3.254	20	30		EGEDHN
CC(C#N)C(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000347117408	457237971	/nfs/dbraw/zinc/23/79/71/457237971.db2.gz	UFYCHAHJZLRXIS-NSHDSACASA-N	0	3	340.254	3.234	20	30		EGEDHN
C=CCN(C[C@H]1CCC(C)(C)O1)[C@@H](C)c1cccc(-n2cnnn2)c1	ZINC000360072006	457238096	/nfs/dbraw/zinc/23/80/96/457238096.db2.gz	NZQIRZYOKMGXCB-MAUKXSAKSA-N	0	3	341.459	3.169	20	30		EGEDHN
CCN(CCC#N)C(=O)CN1CCC[C@H](c2ccc(F)cc2)CC1	ZINC000351255199	457247376	/nfs/dbraw/zinc/24/73/76/457247376.db2.gz	QCOSFMKTDMTLEL-INIZCTEOSA-N	0	3	331.435	3.157	20	30		EGEDHN
N#CC(C(=O)c1cc(C2CC2)nn1-c1ccccc1)c1ccncn1	ZINC000354479181	457249303	/nfs/dbraw/zinc/24/93/03/457249303.db2.gz	WFGRIRWEIKLRQN-HNNXBMFYSA-N	0	3	329.363	3.030	20	30		EGEDHN
C=CCOc1ccc(CN2CCC[C@](CO)(C(C)C)C2)cc1OC	ZINC000354562162	457289584	/nfs/dbraw/zinc/28/95/84/457289584.db2.gz	IEAIWOSQKTXXBJ-FQEVSTJZSA-N	0	3	333.472	3.491	20	30		EGEDHN
N#C[C@@H](c1ccc(Br)cc1)N1CCN(CC2CCC2)CC1	ZINC000354875827	457326718	/nfs/dbraw/zinc/32/67/18/457326718.db2.gz	LCBQCOYEFXDPOE-KRWDZBQOSA-N	0	3	348.288	3.431	20	30		EGEDHN
CC[C@@H](CC#N)N[C@H](C)CCCCN1C(=O)c2ccccc2C1=O	ZINC000351980610	457328843	/nfs/dbraw/zinc/32/88/43/457328843.db2.gz	GCAXNIUSEYXCKP-CABCVRRESA-N	0	3	327.428	3.123	20	30		EGEDHN
CCOC(=O)c1ccc(C(=O)C(C#N)c2nc3ccccc3[nH]2)cc1	ZINC000355111161	457343391	/nfs/dbraw/zinc/34/33/91/457343391.db2.gz	DQEXPPQEDYGTFB-AWEZNQCLSA-N	0	3	333.347	3.230	20	30		EGEDHN
C=CCCOCCCCC(=O)N1CCCN(Cc2ccccc2)CC1	ZINC000342607770	457397292	/nfs/dbraw/zinc/39/72/92/457397292.db2.gz	NDQVNAMPDPBMOL-UHFFFAOYSA-N	0	3	344.499	3.484	20	30		EGEDHN
CSCC[C@H](N[C@H]1CCCCc2cc(C#N)ccc21)C(=O)N(C)C	ZINC000352505186	457423398	/nfs/dbraw/zinc/42/33/98/457423398.db2.gz	YSRJKQSCQHLBPR-ROUUACIJSA-N	0	3	345.512	3.125	20	30		EGEDHN
C[C@H](C(=O)N(C)[C@@H](C)CC#N)N1CCC(Cc2ccccc2)CC1	ZINC000347623368	457555752	/nfs/dbraw/zinc/55/57/52/457555752.db2.gz	XRZTVBVULBNQCH-DLBZAZTESA-N	0	3	327.472	3.090	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)c1cccc(CC#N)c1	ZINC000370163986	457570329	/nfs/dbraw/zinc/57/03/29/457570329.db2.gz	VFQUHJFRDXDYCZ-DYESRHJHSA-N	0	3	347.462	3.393	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN(Cc1cccnc1)C(C)C	ZINC000357615588	457623871	/nfs/dbraw/zinc/62/38/71/457623871.db2.gz	CPDSSALPKLMCAG-HXUWFJFHSA-N	0	3	340.467	3.460	20	30		EGEDHN
CCOc1nc(C)ccc1C(=O)C(C#N)c1nc2ccccc2n1C	ZINC000361194468	457641143	/nfs/dbraw/zinc/64/11/43/457641143.db2.gz	SOYMYIJSVZKAKQ-AWEZNQCLSA-N	0	3	334.379	3.166	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H](C)[C@H](c1ccccc1C)N(C)C	ZINC000357852651	457712085	/nfs/dbraw/zinc/71/20/85/457712085.db2.gz	BPLXNMSDMYEBTN-QFBILLFUSA-N	0	3	325.456	3.404	20	30		EGEDHN
C[C@@H]1C[C@H](c2ccccc2)CN1CC(=O)NCc1cccc(C#N)c1	ZINC000365340456	457745094	/nfs/dbraw/zinc/74/50/94/457745094.db2.gz	VTDBEWDLISGXML-UZLBHIALSA-N	0	3	333.435	3.052	20	30		EGEDHN
CCC[C@@H](C#N)N(C)C(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F	ZINC000410836465	457761182	/nfs/dbraw/zinc/76/11/82/457761182.db2.gz	RTDGXVBRBMNOHG-DLBZAZTESA-N	0	3	349.425	3.294	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC[C@@](C)(c3ccc(C)cc3)C2)CC1	ZINC000366102577	457792925	/nfs/dbraw/zinc/79/29/25/457792925.db2.gz	GKECPCHGHVVFMG-OAQYLSRUSA-N	0	3	341.499	3.318	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)[C@H](C#N)CCc2ccccc2)N(C)C)cc1	ZINC000433305246	457803821	/nfs/dbraw/zinc/80/38/21/457803821.db2.gz	PKFXKGUUXLWKKV-SFTDATJTSA-N	0	3	349.478	3.487	20	30		EGEDHN
N#CCCn1cc(CNCc2cccc(C#N)c2)c(-c2ccncc2)n1	ZINC000433324317	457811374	/nfs/dbraw/zinc/81/13/74/457811374.db2.gz	DCEWWDZWSZKLAI-UHFFFAOYSA-N	0	3	342.406	3.020	20	30		EGEDHN
Cc1cccc2nc(CNC(=O)C(C#N)CCc3ccccc3)cn21	ZINC000433346086	457817520	/nfs/dbraw/zinc/81/75/20/457817520.db2.gz	BNQQOUDUWMZZON-KRWDZBQOSA-N	0	3	332.407	3.032	20	30		EGEDHN
CN(C)[C@H](CC(=O)N(CCC#N)Cc1ccccn1)c1ccccc1	ZINC000433363510	457821342	/nfs/dbraw/zinc/82/13/42/457821342.db2.gz	ROZIFGPCASTLBR-LJQANCHMSA-N	0	3	336.439	3.017	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N[C@@H](CCO)C1CCCCC1	ZINC000433382357	457825925	/nfs/dbraw/zinc/82/59/25/457825925.db2.gz	CVOURNQTVZJOGL-OALUTQOASA-N	0	3	328.456	3.206	20	30		EGEDHN
N#CCCN(C(=O)CN1CC[C@@H]2CCC[C@@H]21)c1cccc(Cl)c1	ZINC000426474832	457837710	/nfs/dbraw/zinc/83/77/10/457837710.db2.gz	VWZAOGKROBSKHK-YOEHRIQHSA-N	0	3	331.847	3.461	20	30		EGEDHN
N#CC1(CCN2CC[C@@H]3[C@@H](CCC(=O)N3C3CC3)C2)CCCCC1	ZINC000411398482	457875077	/nfs/dbraw/zinc/87/50/77/457875077.db2.gz	OSTGPRUXBFSPND-FUHWJXTLSA-N	0	3	329.488	3.326	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CCc3cccc(Cl)c3C2)cc1	ZINC000458008908	457901151	/nfs/dbraw/zinc/90/11/51/457901151.db2.gz	FIHJPEOGTFAFBM-QGZVFWFLSA-N	0	3	349.821	3.479	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cccc(F)c1C#N)C(C)C	ZINC000426816524	457908496	/nfs/dbraw/zinc/90/84/96/457908496.db2.gz	LDLKRXLWUXUARE-SFHVURJKSA-N	0	3	329.419	3.126	20	30		EGEDHN
C[C@@H](N[C@@H]1C[C@H](OC(C)(C)C)C1(C)C)C(=O)NC1(C#N)CCCCC1	ZINC000412066952	458077405	/nfs/dbraw/zinc/07/74/05/458077405.db2.gz	GRJCARPOLXMMEY-OAGGEKHMSA-N	0	3	349.519	3.289	20	30		EGEDHN
COCCN1CCC(Nc2nc3c(cc2C#N)CCCC3(C)C)CC1	ZINC000428092078	458078627	/nfs/dbraw/zinc/07/86/27/458078627.db2.gz	ABJPATAHLGIHGS-UHFFFAOYSA-N	0	3	342.487	3.090	20	30		EGEDHN
C#CCCOc1ccc(CN2CCC(OC[C@H]3CCOC3)CC2)cc1	ZINC000371801945	458079603	/nfs/dbraw/zinc/07/96/03/458079603.db2.gz	IPRKDZRJQWRNQA-IBGZPJMESA-N	0	3	343.467	3.106	20	30		EGEDHN
C=CCC[C@H](NC(=O)N[C@H]1CN(C2CC2)C[C@H]1C)c1ccccc1	ZINC000435098848	458092272	/nfs/dbraw/zinc/09/22/72/458092272.db2.gz	OCIYKKBZQCCQRB-MNEFBYGVSA-N	0	3	327.472	3.476	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)NCC1(CC#N)CC1)c1ccccc1	ZINC000362346466	458118799	/nfs/dbraw/zinc/11/87/99/458118799.db2.gz	MICLOUWTHKHGRM-KRWDZBQOSA-N	0	3	328.460	3.063	20	30		EGEDHN
CC[C@@]1(O)CCN(Cc2cccc(OCc3cccc(C#N)c3)c2)C1	ZINC000428449029	458145477	/nfs/dbraw/zinc/14/54/77/458145477.db2.gz	QOJNHDDPOYHVDU-OAQYLSRUSA-N	0	3	336.435	3.484	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Cc1c(F)cccc1F)C(C)C	ZINC000446112621	458150047	/nfs/dbraw/zinc/15/00/47/458150047.db2.gz	HVWGSLKHIOCRJB-SFHVURJKSA-N	0	3	336.426	3.322	20	30		EGEDHN
CSc1ccc([C@H](CNC(=O)NCC2(CC#N)CC2)N(C)C)cc1	ZINC000458737839	458152697	/nfs/dbraw/zinc/15/26/97/458152697.db2.gz	PQLYJNSOXYPHND-INIZCTEOSA-N	0	3	346.500	3.004	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)C1(C2CC2)CCOCC1)C(C)C	ZINC000372002428	458156368	/nfs/dbraw/zinc/15/63/68/458156368.db2.gz	GYPKMVHOCSIXCP-GOSISDBHSA-N	0	3	334.504	3.008	20	30		EGEDHN
CC(C)(C)c1ccncc1CNC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000412566197	458234820	/nfs/dbraw/zinc/23/48/20/458234820.db2.gz	SZJMVHQGAPMFHN-KRWDZBQOSA-N	0	3	346.434	3.249	20	30		EGEDHN
N#Cc1cccc(CNC(=O)CN[C@@H]2CCC[C@@H]2c2ccccc2)c1	ZINC000376278549	458257057	/nfs/dbraw/zinc/25/70/57/458257057.db2.gz	HTUOWNFSVJDACA-WOJBJXKFSA-N	0	3	333.435	3.100	20	30		EGEDHN
C=CCC[C@@H](C)N[C@H]1CCN(c2cccc(Br)c2)C1=O	ZINC000447065676	458258960	/nfs/dbraw/zinc/25/89/60/458258960.db2.gz	IEOBHGKDXYMOLG-DOMZBBRYSA-N	0	3	337.261	3.499	20	30		EGEDHN
C[C@H]1CN(c2cccc3cnccc32)CCN1CCCSCC#N	ZINC000447391995	458292123	/nfs/dbraw/zinc/29/21/23/458292123.db2.gz	AJAVYADZWFIXSK-INIZCTEOSA-N	0	3	340.496	3.392	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)NC(=O)NC1CCN(CC=C)CC1	ZINC000413240060	458296446	/nfs/dbraw/zinc/29/64/46/458296446.db2.gz	NIVFOTPPTQEIKQ-IBGZPJMESA-N	0	3	327.472	3.123	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NC(=O)N(C)[C@@H]1CCN(C)C[C@H]1C	ZINC000413834739	458310175	/nfs/dbraw/zinc/31/01/75/458310175.db2.gz	MLCDQABEAFZAJX-BHIYHBOVSA-N	0	3	329.488	3.155	20	30		EGEDHN
N#CC1(c2ccccc2)CC(N[C@@H](CO)Cc2c[nH]c3ccccc23)C1	ZINC000372685021	458317423	/nfs/dbraw/zinc/31/74/23/458317423.db2.gz	RPQIWOAJIZMQTJ-FLPIEVNYSA-N	0	3	345.446	3.285	20	30		EGEDHN
COc1cc(CN2CCNC[C@@H]2c2cccc(Cl)c2)ccc1C#N	ZINC000414735158	458325550	/nfs/dbraw/zinc/32/55/50/458325550.db2.gz	LYNUWCBPPAKBNY-GOSISDBHSA-N	0	3	341.842	3.367	20	30		EGEDHN
C=CCN(C)CCN(CC)[C@H](C)C(=O)Nc1cccc2ncccc21	ZINC000429729930	458364276	/nfs/dbraw/zinc/36/42/76/458364276.db2.gz	JTUDMPSHNAOXKP-MRXNPFEDSA-N	0	3	340.471	3.002	20	30		EGEDHN
C[C@@H](NC(=O)NC[C@@H]1N(C)CCCC1(C)C)c1ccc(C#N)cc1	ZINC000447977872	458373419	/nfs/dbraw/zinc/37/34/19/458373419.db2.gz	PTJKXLCIDVOPLW-PBHICJAKSA-N	0	3	328.460	3.039	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)N1C[C@H](N2CCCC2)C[C@H]1C	ZINC000376791824	458390150	/nfs/dbraw/zinc/39/01/50/458390150.db2.gz	IKNKOTPTGNTJLL-GDBMZVCRSA-N	0	3	342.443	3.047	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)[C@]1(C#N)CC12CCCC2)C(C)C	ZINC000448974676	458417497	/nfs/dbraw/zinc/41/74/97/458417497.db2.gz	LUBLYGBDLGXHFI-FXAWDEMLSA-N	0	3	329.488	3.275	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)[C@H]1CC12CCSCC2)C(C)C	ZINC000448974635	458417549	/nfs/dbraw/zinc/41/75/49/458417549.db2.gz	LKYXYWIONNGEFY-SJORKVTESA-N	0	3	336.545	3.335	20	30		EGEDHN
C=CCC1(C(=O)NCCCCN2CCN(CC)CC2)CCCCC1	ZINC000448973331	458417818	/nfs/dbraw/zinc/41/78/18/458417818.db2.gz	AECVTICJACUJPV-UHFFFAOYSA-N	0	3	335.536	3.047	20	30		EGEDHN
C=CC(C)(C)C(=O)NCC1(N[C@@H](C)c2ccccc2)CCOCC1	ZINC000448985998	458418501	/nfs/dbraw/zinc/41/85/01/458418501.db2.gz	XYEBDGATOSGMIK-INIZCTEOSA-N	0	3	330.472	3.215	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCc1ccc(Br)c2cccnc12	ZINC000449518446	458426009	/nfs/dbraw/zinc/42/60/09/458426009.db2.gz	JYDLLRRCWRJKDY-CABCVRRESA-N	0	3	333.229	3.430	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)NCC(C)(C)CCC#N	ZINC000376977378	458434203	/nfs/dbraw/zinc/43/42/03/458434203.db2.gz	YUVDJYKGFNEVQF-WMZOPIPTSA-N	0	3	342.487	3.136	20	30		EGEDHN
Cc1[nH]c(C#N)cc1C(=O)Nc1ccc(OCCN(C)C)c(Cl)c1	ZINC000449888589	458434558	/nfs/dbraw/zinc/43/45/58/458434558.db2.gz	ACWSAWZUVVDSQU-UHFFFAOYSA-N	0	3	346.818	3.041	20	30		EGEDHN
CC(C)(CCC#N)CNC(=O)N1CCCN(Cc2ccccc2)CC1	ZINC000377031302	458444866	/nfs/dbraw/zinc/44/48/66/458444866.db2.gz	NLKWNSGFOKTECK-UHFFFAOYSA-N	0	3	342.487	3.234	20	30		EGEDHN
C=CCC1(C(=O)NCc2ccccc2CN2CC[C@@H](O)C2)CCCC1	ZINC000450516334	458451427	/nfs/dbraw/zinc/45/14/27/458451427.db2.gz	BAKXLDHMRCJCDD-LJQANCHMSA-N	0	3	342.483	3.006	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)cc2Br)CCN(C2CC2)C1	ZINC000451093661	458465476	/nfs/dbraw/zinc/46/54/76/458465476.db2.gz	OENBZSKCQDOKFP-CYBMUJFWSA-N	0	3	348.288	3.237	20	30		EGEDHN
CCN1CC[C@H]2CC[C@@H](C1)N2Cc1ccc(C#N)cc1OC(F)F	ZINC000437611092	458474018	/nfs/dbraw/zinc/47/40/18/458474018.db2.gz	ZIFIEHMENJRZIW-CVEARBPZSA-N	0	3	335.398	3.218	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2[C@@H]3CCO[C@H]3C23CCC3)c(OC(F)F)c1	ZINC000451506682	458479675	/nfs/dbraw/zinc/47/96/75/458479675.db2.gz	UZRLXFGCAUHZRX-NUEKZKHPSA-N	0	3	334.366	3.207	20	30		EGEDHN
CO[C@@H]1CCC[C@H]1N[C@H](C)C(=O)N(CCC#N)c1cc(C)cc(C)c1	ZINC000451635570	458484586	/nfs/dbraw/zinc/48/45/86/458484586.db2.gz	XZFSXVWIOVNWBM-BHIYHBOVSA-N	0	3	343.471	3.096	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC(=O)N1CC[C@@H](C)Sc2ccccc21	ZINC000451685394	458485329	/nfs/dbraw/zinc/48/53/29/458485329.db2.gz	ZOPRCBIGLNQAKH-INMHGKMJSA-N	0	3	346.496	3.227	20	30		EGEDHN
Cc1cc(CN(CCC(N)=O)[C@H]2CCOc3ccccc32)ccc1C#N	ZINC000451704074	458486556	/nfs/dbraw/zinc/48/65/56/458486556.db2.gz	CBGKQPLBSNPPHX-IBGZPJMESA-N	0	3	349.434	3.068	20	30		EGEDHN
C=CCN1CC[C@@H](N2CCC(Cc3cc(F)cc(F)c3)CC2)C1=O	ZINC000451929558	458490823	/nfs/dbraw/zinc/49/08/23/458490823.db2.gz	SVASECQEXPGSNA-GOSISDBHSA-N	0	3	334.410	3.006	20	30		EGEDHN
C[C@H](NCCS(=O)(=O)c1ccc(C#N)cc1)[C@H]1CCC[C@H](C)C1	ZINC000452073295	458494323	/nfs/dbraw/zinc/49/43/23/458494323.db2.gz	VCBDESYOWLHCCB-ZOBUZTSGSA-N	0	3	334.485	3.136	20	30		EGEDHN
C[C@@H]1CN(C(=O)C[C@H](CC#N)c2ccccc2)CCN(C2CC2)C1	ZINC000452167216	458497130	/nfs/dbraw/zinc/49/71/30/458497130.db2.gz	BOSGLJRBWOMQPP-WMZOPIPTSA-N	0	3	325.456	3.017	20	30		EGEDHN
CC[C@@H](CNc1ccccc1)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000452459417	458500968	/nfs/dbraw/zinc/50/09/68/458500968.db2.gz	IWIZEXHBIKGHBI-MOPGFXCFSA-N	0	3	346.434	3.247	20	30		EGEDHN
CO[C@H](CNC(=O)C(C#N)CCc1ccccc1)Cc1ccccc1	ZINC000452816772	458510888	/nfs/dbraw/zinc/51/08/88/458510888.db2.gz	MXBUINGNPPUZJA-PMACEKPBSA-N	0	3	336.435	3.133	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCc1cccc(C(F)(F)F)n1	ZINC000452895530	458513056	/nfs/dbraw/zinc/51/30/56/458513056.db2.gz	QOBAGIQXFITBOU-AWEZNQCLSA-N	0	3	347.340	3.489	20	30		EGEDHN
C=CCn1c([C@H](C)CC)nnc1N1CCN([C@@H]2C[C@@H]2C)C[C@@H](C)C1	ZINC000453423103	458527503	/nfs/dbraw/zinc/52/75/03/458527503.db2.gz	BKKWNQJBXDBLBJ-WCXIOVBPSA-N	0	3	331.508	3.144	20	30		EGEDHN
C=CCn1c(CC(C)(C)C)nnc1N1CCN([C@@H]2C[C@H]2C)C[C@@H](C)C1	ZINC000453428100	458527735	/nfs/dbraw/zinc/52/77/35/458527735.db2.gz	ZMXOYCZSGYAHKB-BRWVUGGUSA-N	0	3	345.535	3.219	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H](N)c2ccc(C(C)C)cc2)CCOCC1	ZINC000424084961	458554129	/nfs/dbraw/zinc/55/41/29/458554129.db2.gz	YSQWMRNIKWZTEK-GOSISDBHSA-N	0	3	330.472	3.299	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N[C@H](c1ccccc1)c1ccc(F)cc1	ZINC000424104533	458558730	/nfs/dbraw/zinc/55/87/30/458558730.db2.gz	UPNRNJNPYNQBBR-ZWKOTPCHSA-N	0	3	325.387	3.052	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)NCC1(c2cccc(F)c2)CCCCC1	ZINC000424103488	458559154	/nfs/dbraw/zinc/55/91/54/458559154.db2.gz	NGAJJCUHNXYIGJ-QGZVFWFLSA-N	0	3	331.435	3.165	20	30		EGEDHN
C=C(C)CCNC(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000454410441	458560939	/nfs/dbraw/zinc/56/09/39/458560939.db2.gz	SYIXESGJZPFRNC-UHFFFAOYSA-N	0	3	345.487	3.173	20	30		EGEDHN
CC(C)COc1ccc(C(C)(C)CNC(=O)[C@H](N)CCCC#N)cc1	ZINC000424111587	458561392	/nfs/dbraw/zinc/56/13/92/458561392.db2.gz	AVHZRQQWEALHQE-GOSISDBHSA-N	0	3	345.487	3.136	20	30		EGEDHN
COc1ccc(-c2ccc(CNC(=O)[C@H](N)CCCC#N)s2)cc1	ZINC000424123746	458563833	/nfs/dbraw/zinc/56/38/33/458563833.db2.gz	NCGPQMOFQUWHQO-MRXNPFEDSA-N	0	3	343.452	3.061	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)NCCCc1ccc(Cl)cc1Cl	ZINC000424124685	458564138	/nfs/dbraw/zinc/56/41/38/458564138.db2.gz	PILCKPUGZQCSED-AWEZNQCLSA-N	0	3	328.243	3.063	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N1Cc2ccccc2C[C@H]1c1ccccc1	ZINC000424124189	458564269	/nfs/dbraw/zinc/56/42/69/458564269.db2.gz	MAHNLXUKAJEHEL-UXHICEINSA-N	0	3	333.435	3.334	20	30		EGEDHN
Cc1ccsc1[C@H](Cc1ccccc1)NC(=O)[C@H](N)CCCC#N	ZINC000424123782	458564363	/nfs/dbraw/zinc/56/43/63/458564363.db2.gz	LINRDMXCZRKQLS-SJORKVTESA-N	0	3	341.480	3.478	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)NCC1(Sc2ccccc2)CCCC1	ZINC000424135170	458567554	/nfs/dbraw/zinc/56/75/54/458567554.db2.gz	IYXLLEFHPICWOB-MRXNPFEDSA-N	0	3	331.485	3.229	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N1CCC(c2nc3ccccc3s2)CC1	ZINC000424135467	458568193	/nfs/dbraw/zinc/56/81/93/458568193.db2.gz	MKJOQFOYRNSPDK-CQSZACIVSA-N	0	3	342.468	3.023	20	30		EGEDHN
CC[C@H](Cc1ccc(Cl)cc1Cl)NC(=O)[C@@H](N)CCCC#N	ZINC000424145280	458570320	/nfs/dbraw/zinc/57/03/20/458570320.db2.gz	UPVJMAHLVBSTRC-HIFRSBDPSA-N	0	3	342.270	3.452	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)C2CCC(F)(F)CC2)CC1	ZINC000493808429	458574470	/nfs/dbraw/zinc/57/44/70/458574470.db2.gz	JNQAOSOHKRJSEO-UHFFFAOYSA-N	0	3	329.435	3.246	20	30		EGEDHN
CC(C)Oc1ccc2ccccc2c1CNC(=O)[C@@H](N)CCCC#N	ZINC000424168267	458576628	/nfs/dbraw/zinc/57/66/28/458576628.db2.gz	IHCRPWIHXGDJON-SFHVURJKSA-N	0	3	339.439	3.264	20	30		EGEDHN
C=CCC[C@@H](NC[C@@]1(N2CCOCC2)CCSC1)c1ccco1	ZINC000373700955	458577426	/nfs/dbraw/zinc/57/74/26/458577426.db2.gz	PFBMMKCEXQLPAF-AEFFLSMTSA-N	0	3	336.501	3.084	20	30		EGEDHN
CN(Cc1ccccc1NC(=O)[C@H](N)CCCC#N)c1ccccc1	ZINC000424177997	458579042	/nfs/dbraw/zinc/57/90/42/458579042.db2.gz	VTEOBDQFOWZLNS-GOSISDBHSA-N	0	3	336.439	3.283	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)[C@H]1CC2CCC1CC2	ZINC000431840143	458632077	/nfs/dbraw/zinc/63/20/77/458632077.db2.gz	KJDLLPQAUJBZET-GQOXECLESA-N	0	3	339.483	3.275	20	30		EGEDHN
Cc1cc(N(CCC#N)C(=O)CN[C@]2(C)CCO[C@H]2C)ccc1Cl	ZINC000494257519	458648698	/nfs/dbraw/zinc/64/86/98/458648698.db2.gz	RPVIICOIZUIDLT-KBXCAEBGSA-N	0	3	349.862	3.052	20	30		EGEDHN
C=CCN(CCc1ccccc1)C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000470869788	458657884	/nfs/dbraw/zinc/65/78/84/458657884.db2.gz	KSKANMWCHXDRMY-NRFANRHFSA-N	0	3	343.430	3.498	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)NC[C@H](C)N1CCC[C@@H](C)C1	ZINC000463506291	458706674	/nfs/dbraw/zinc/70/66/74/458706674.db2.gz	JAUNNPGEWKLEBM-CVEARBPZSA-N	0	3	346.471	3.110	20	30		EGEDHN
C=CCCCCNC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1	ZINC000471696231	458714839	/nfs/dbraw/zinc/71/48/39/458714839.db2.gz	GHCUWTWUQLRAAQ-UHFFFAOYSA-N	0	3	329.488	3.303	20	30		EGEDHN
C[C@@H](C(=O)NC1(C#N)CCC1)N1CCC[C@@H](c2ccccc2)CC1	ZINC000530336216	458749957	/nfs/dbraw/zinc/74/99/57/458749957.db2.gz	TXHWQEZWQFJWKL-FUHWJXTLSA-N	0	3	325.456	3.207	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)[C@H]1CCCN1C1CCCC1	ZINC000439957161	458770184	/nfs/dbraw/zinc/77/01/84/458770184.db2.gz	KJPYHTLZNKXAPG-GOSISDBHSA-N	0	3	328.456	3.275	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)N(CCC)CCN2CCCC2)cc1	ZINC000509364096	458771637	/nfs/dbraw/zinc/77/16/37/458771637.db2.gz	JPLCLCSWABKQQF-UHFFFAOYSA-N	0	3	345.487	3.269	20	30		EGEDHN
C=C(C)CN(CCc1ccc2c(c1)CCO2)Cc1ccc(CO)o1	ZINC000512198287	458783102	/nfs/dbraw/zinc/78/31/02/458783102.db2.gz	AJCYHRMNVSODOY-UHFFFAOYSA-N	0	3	327.424	3.328	20	30		EGEDHN
C[C@@H]1CN(CCCNc2ccc(C(F)(F)F)cc2C#N)CCCO1	ZINC000432850896	458800708	/nfs/dbraw/zinc/80/07/08/458800708.db2.gz	IEFXKJHVVADEAU-CYBMUJFWSA-N	0	3	341.377	3.490	20	30		EGEDHN
C[C@H]1[C@H](Nc2ccc(Cl)c(C#N)n2)CCN1Cc1ccccc1	ZINC000516506426	458818846	/nfs/dbraw/zinc/81/88/46/458818846.db2.gz	CWYGCGWOZQBRLW-XJKSGUPXSA-N	0	3	326.831	3.103	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)[C@H](C)c2c(F)cccc2F)CC1	ZINC000517341159	458828808	/nfs/dbraw/zinc/82/88/08/458828808.db2.gz	GPCSGCPRABZPOO-CYBMUJFWSA-N	0	3	337.414	3.318	20	30		EGEDHN
CCCCN(C)CCNC(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1	ZINC000465914396	458861606	/nfs/dbraw/zinc/86/16/06/458861606.db2.gz	AUQFMJOWQRVCJJ-MOPGFXCFSA-N	0	3	342.487	3.200	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](C(C)(C)C)C(F)(F)F)CC1	ZINC000548512318	458872270	/nfs/dbraw/zinc/87/22/70/458872270.db2.gz	HBRWSYWGEOOWCR-ZDUSSCGKSA-N	0	3	335.414	3.303	20	30		EGEDHN
C=C(C)Cn1c(-c2ccc(C)o2)nnc1N1CCN(CC(C)C)CC1	ZINC000549647361	458882591	/nfs/dbraw/zinc/88/25/91/458882591.db2.gz	QEFFWCAFMRZYDQ-UHFFFAOYSA-N	0	3	343.475	3.201	20	30		EGEDHN
CC1(C)CCCN(C(=O)[C@@H]2CCN(Cc3ccccc3)C2)[C@H]1C#N	ZINC000553578428	458895908	/nfs/dbraw/zinc/89/59/08/458895908.db2.gz	VUGORMKCOILJLF-MSOLQXFVSA-N	0	3	325.456	3.049	20	30		EGEDHN
C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)NC1CCN(CC)CC1	ZINC000554240922	458898141	/nfs/dbraw/zinc/89/81/41/458898141.db2.gz	QFPPOLVYGRUJAS-UHFFFAOYSA-N	0	3	347.507	3.036	20	30		EGEDHN
CCOC(=O)[C@@H](C)[C@@H](C)NCC#Cc1ccc(OC(F)(F)F)cc1	ZINC000554816098	458901674	/nfs/dbraw/zinc/90/16/74/458901674.db2.gz	DTRRMWCONIRLMU-QWHCGFSZSA-N	0	3	343.345	3.114	20	30		EGEDHN
C[C@H]1CCC[C@@H]1CNC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000466718798	458915302	/nfs/dbraw/zinc/91/53/02/458915302.db2.gz	JLUPMYQJCZEVCU-QFBILLFUSA-N	0	3	342.487	3.068	20	30		EGEDHN
COc1ccc([C@H](CNC[C@H](C#N)CCC#N)N2CCCCC2)cc1	ZINC000556483511	458966112	/nfs/dbraw/zinc/96/61/12/458966112.db2.gz	XTHBXCVZZGVOPI-PXNSSMCTSA-N	0	3	340.471	3.255	20	30		EGEDHN
CCCN(CCN1CCCCC1)Cc1cccc(C(=O)OC)c1C#N	ZINC000556847594	459020951	/nfs/dbraw/zinc/02/09/51/459020951.db2.gz	UCZDDDZVAOHJQA-UHFFFAOYSA-N	0	3	343.471	3.043	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Cn1ccc2ccccc21)C(C)C	ZINC000495982277	459026796	/nfs/dbraw/zinc/02/67/96/459026796.db2.gz	ONJJCSIEEKVGQP-FQEVSTJZSA-N	0	3	339.483	3.456	20	30		EGEDHN
N#Cc1ccc(CN[C@]2(Cc3ccc(Cl)cc3)CCOC2)nc1	ZINC000577505015	459043647	/nfs/dbraw/zinc/04/36/47/459043647.db2.gz	BBBGDYSMYBPOGS-SFHVURJKSA-N	0	3	327.815	3.098	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@H](C#N)CCC#N	ZINC000496038757	459046445	/nfs/dbraw/zinc/04/64/45/459046445.db2.gz	GNCONHOEVCEABZ-HOTGVXAUSA-N	0	3	334.464	3.199	20	30		EGEDHN
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@@H](C#N)CCC#N)C[C@H]2C1	ZINC000496040661	459047396	/nfs/dbraw/zinc/04/73/96/459047396.db2.gz	DLJCNFWLEOOTJL-QZWWFDLISA-N	0	3	346.475	3.055	20	30		EGEDHN
CC[C@@H](C(=O)NCC#Cc1ccc(C(F)(F)F)cc1)N(CC)CC	ZINC000477529501	459048494	/nfs/dbraw/zinc/04/84/94/459048494.db2.gz	VNBJYHQYQDBQIR-INIZCTEOSA-N	0	3	340.389	3.294	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)N[C@H]1CCN(CC2CC2)C1	ZINC000590033394	459070183	/nfs/dbraw/zinc/07/01/83/459070183.db2.gz	FCPUXVUPGZEAPZ-HNNXBMFYSA-N	0	3	339.464	3.296	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)CCOCCNC(=O)OC(C)(C)C	ZINC000496113665	459071175	/nfs/dbraw/zinc/07/11/75/459071175.db2.gz	GHEZFIQVGLCJAH-OAHLLOKOSA-N	0	3	347.459	3.092	20	30		EGEDHN
CC(C#N)C(=O)NCc1cccc2c1CCCN2C(=O)OC(C)(C)C	ZINC000496140954	459084687	/nfs/dbraw/zinc/08/46/87/459084687.db2.gz	JVJAKOMULNMICB-ZDUSSCGKSA-N	0	3	343.427	3.150	20	30		EGEDHN
CCOC1CC2(C1)CCN(C(=O)C(C#N)CCc1ccccc1)C2	ZINC000557657570	459097299	/nfs/dbraw/zinc/09/72/99/459097299.db2.gz	XMVZIEFEUOKYLH-PGYGNJIDSA-N	0	3	326.440	3.177	20	30		EGEDHN
CN1CCN(c2c(C#N)cnc3ccccc32)C[C@@H]1Cc1ccccc1	ZINC000557726630	459104016	/nfs/dbraw/zinc/10/40/16/459104016.db2.gz	RKTAEECIBLABBK-IBGZPJMESA-N	0	3	342.446	3.470	20	30		EGEDHN
C[C@H](CN(C)[C@H]1CCN(c2ccc(C#N)cc2)C1=O)c1ccccc1	ZINC000532517923	459105232	/nfs/dbraw/zinc/10/52/32/459105232.db2.gz	GFBNKTSKCLWZDV-UZLBHIALSA-N	0	3	333.435	3.399	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CCSCC[C@H]1C)C(C)C	ZINC000478763357	459107477	/nfs/dbraw/zinc/10/74/77/459107477.db2.gz	QEQXYDOFYWNKSO-IAGOWNOFSA-N	0	3	339.549	3.222	20	30		EGEDHN
Cc1cccc2c1CC[C@H]2NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000567464343	459110053	/nfs/dbraw/zinc/11/00/53/459110053.db2.gz	OZMZBNUZCRCSQX-LAUBAEHRSA-N	0	3	336.435	3.078	20	30		EGEDHN
C=CCOc1ccc(CNC[C@H](CO)Cc2ccco2)cc1Cl	ZINC000532675984	459127250	/nfs/dbraw/zinc/12/72/50/459127250.db2.gz	UGDMFMPSTWPGAN-OAHLLOKOSA-N	0	3	335.831	3.439	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC(Cc3ccccc3)CC2)CC1	ZINC000521239744	459134511	/nfs/dbraw/zinc/13/45/11/459134511.db2.gz	WRGHHHNQRJOVGU-UHFFFAOYSA-N	0	3	341.499	3.301	20	30		EGEDHN
COc1ccc(N2C[C@@H](N[C@H](C)c3ccc(C#N)cc3)CC2=O)cc1	ZINC000594722568	459140553	/nfs/dbraw/zinc/14/05/53/459140553.db2.gz	RVVGBTYHMZVIEV-PBHICJAKSA-N	0	3	335.407	3.023	20	30		EGEDHN
N#CCN1CCC(NCc2cnc(-c3ccccc3F)s2)CC1	ZINC000590645824	459170889	/nfs/dbraw/zinc/17/08/89/459170889.db2.gz	UVVZMRKEDNUONT-UHFFFAOYSA-N	0	3	330.432	3.027	20	30		EGEDHN
C[C@@H](C1CC1)N(CC(=O)NCc1cccc(C#N)c1)Cc1ccccc1	ZINC000521820747	459179511	/nfs/dbraw/zinc/17/95/11/459179511.db2.gz	VOPNNGHCDRSWTG-KRWDZBQOSA-N	0	3	347.462	3.475	20	30		EGEDHN
Cc1nn2c(nc(C(C)C)c2CNCCc2ccc(C#N)cc2)s1	ZINC000594955452	459192690	/nfs/dbraw/zinc/19/26/90/459192690.db2.gz	OTYDBTZNSXOKKW-UHFFFAOYSA-N	0	3	339.468	3.427	20	30		EGEDHN
C=CCCSCCNCc1cnc2ccc(Br)cn12	ZINC000594960231	459193839	/nfs/dbraw/zinc/19/38/39/459193839.db2.gz	NNANNTDOQXWTAO-UHFFFAOYSA-N	0	3	340.290	3.496	20	30		EGEDHN
C=CCOCCN[C@@H](C)c1ccc(F)c(I)c1	ZINC000590778551	459213819	/nfs/dbraw/zinc/21/38/19/459213819.db2.gz	PBKXUGVARUKVFK-JTQLQIEISA-N	0	3	349.187	3.284	20	30		EGEDHN
N#CCCCN[C@H]1CCc2ccc(I)cc21	ZINC000595034339	459223717	/nfs/dbraw/zinc/22/37/17/459223717.db2.gz	VKKLOBMIQCKCKU-ZDUSSCGKSA-N	0	3	326.181	3.172	20	30		EGEDHN
C[C@H]1CCN(C)CCN1C(=O)c1ccc(C#Cc2ccccc2)cc1	ZINC000522188598	459225966	/nfs/dbraw/zinc/22/59/66/459225966.db2.gz	URXMFVWECIUNBM-SFHVURJKSA-N	0	3	332.447	3.253	20	30		EGEDHN
N#Cc1ccccc1-c1ccc(C[N@@H+]2CC[C@@H](c3nnc[n-]3)C2)cc1	ZINC000578620520	459232140	/nfs/dbraw/zinc/23/21/40/459232140.db2.gz	BYALUKUZEMZDLJ-GOSISDBHSA-N	0	3	329.407	3.333	20	30		EGEDHN
N#Cc1ccccc1-c1ccc(C[N@H+]2CC[C@@H](c3nnc[n-]3)C2)cc1	ZINC000578620520	459232146	/nfs/dbraw/zinc/23/21/46/459232146.db2.gz	BYALUKUZEMZDLJ-GOSISDBHSA-N	0	3	329.407	3.333	20	30		EGEDHN
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C)[C@H]1NCc1ccc(C#N)cn1	ZINC000496584077	459248068	/nfs/dbraw/zinc/24/80/68/459248068.db2.gz	ODONXGDPLFNVND-CPUCHLNUSA-N	0	3	344.459	3.077	20	30		EGEDHN
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@H]1NCc1ccc(C#N)cn1	ZINC000496584083	459248620	/nfs/dbraw/zinc/24/86/20/459248620.db2.gz	ODONXGDPLFNVND-KEYYUXOJSA-N	0	3	344.459	3.077	20	30		EGEDHN
N#CC(C(=O)c1ccnn1C1CCCC1)c1cnc2ccccc2n1	ZINC000579785053	459251841	/nfs/dbraw/zinc/25/18/41/459251841.db2.gz	VWZMZJJKLPUCET-AWEZNQCLSA-N	0	3	331.379	3.431	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN1CCC[C@@H](Cc2ccc(OC)cc2)C1	ZINC000580140513	459256511	/nfs/dbraw/zinc/25/65/11/459256511.db2.gz	VEVCGJJRSGITSY-IBGZPJMESA-N	0	3	344.499	3.374	20	30		EGEDHN
CN(CC[C@H]1Sc2ccccc2NC1=O)Cc1cccc(C#N)c1	ZINC000595286217	459266019	/nfs/dbraw/zinc/26/60/19/459266019.db2.gz	ABUBBGCGDBBVEC-GOSISDBHSA-N	0	3	337.448	3.493	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)NC[C@H](C)N1CCCC1	ZINC000559593184	459267632	/nfs/dbraw/zinc/26/76/32/459267632.db2.gz	KKVJTUYWDFVACB-LBPRGKRZSA-N	0	3	327.453	3.296	20	30		EGEDHN
CCc1ccccc1[C@H](CNC(=O)C(C)C#N)NC(=O)OC(C)(C)C	ZINC000496638188	459268868	/nfs/dbraw/zinc/26/88/68/459268868.db2.gz	BAWDKQIGWHOPNL-CJNGLKHVSA-N	0	3	345.443	3.091	20	30		EGEDHN
CC1CC(C#N)(C(=O)NC[C@H](CN(C)C)c2ccc(Cl)cc2)C1	ZINC000581552824	459273805	/nfs/dbraw/zinc/27/38/05/459273805.db2.gz	PVBNFYUURWXGFT-NSWWBONSSA-N	0	3	333.863	3.041	20	30		EGEDHN
C[C@@H]1CCCC[C@H]1CCNCCS(=O)(=O)c1ccc(C#N)cc1	ZINC000568502091	459298099	/nfs/dbraw/zinc/29/80/99/459298099.db2.gz	FHCXGDFKZGYPSC-WBVHZDCISA-N	0	3	334.485	3.138	20	30		EGEDHN
N#CC[C@@H]1CCCN(C(=O)N[C@H](CN2CCCC2)c2ccccc2)C1	ZINC000595438762	459302055	/nfs/dbraw/zinc/30/20/55/459302055.db2.gz	ARBUMBRVVWOVAV-PKOBYXMFSA-N	0	3	340.471	3.159	20	30		EGEDHN
CN(CCc1nc(-c2ccccc2)no1)CCc1ccc(C#N)cc1	ZINC000595484512	459320817	/nfs/dbraw/zinc/32/08/17/459320817.db2.gz	QIXJUCATUCYAPB-UHFFFAOYSA-N	0	3	332.407	3.325	20	30		EGEDHN
C[C@@H](NC(=O)N[C@@H](C)CN1CCC(C)CC1)c1cccc(C#N)c1	ZINC000595541536	459339073	/nfs/dbraw/zinc/33/90/73/459339073.db2.gz	UFQSTSCMZDCAKK-JKSUJKDBSA-N	0	3	328.460	3.039	20	30		EGEDHN
CC(C)(C)OC(=O)CC1(NCc2cc(C#N)ccc2F)CCOCC1	ZINC000595545473	459341695	/nfs/dbraw/zinc/34/16/95/459341695.db2.gz	BTIXDXGQPARZEW-UHFFFAOYSA-N	0	3	348.418	3.068	20	30		EGEDHN
C[C@@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1cccc(-n2cnnn2)c1	ZINC000591348826	459358794	/nfs/dbraw/zinc/35/87/94/459358794.db2.gz	FLINLJVMVUPYEF-JLTOFOAXSA-N	0	3	344.422	3.262	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1CCC[C@H]1c1c(C)cccc1C	ZINC000595600059	459360388	/nfs/dbraw/zinc/36/03/88/459360388.db2.gz	FZTFUBRXLPZCDA-QAPCUYQASA-N	0	3	327.472	3.449	20	30		EGEDHN
N#Cc1ccccc1OCCN1CCCN2c3ccccc3C[C@@H]2C1	ZINC000568935149	459368381	/nfs/dbraw/zinc/36/83/81/459368381.db2.gz	IZTGNNGNEXQQFH-LJQANCHMSA-N	0	3	333.435	3.074	20	30		EGEDHN
C[C@@]1(NCC(=O)NC2(C#N)CCCCC2)CCCc2ccccc21	ZINC000538707965	459373924	/nfs/dbraw/zinc/37/39/24/459373924.db2.gz	GYVMAEQOBWODJU-LJQANCHMSA-N	0	3	325.456	3.170	20	30		EGEDHN
CN1CC[C@H]2CCN(C(=O)c3ccc(C#Cc4ccccc4)cc3)[C@H]2C1	ZINC000538713899	459374043	/nfs/dbraw/zinc/37/40/43/459374043.db2.gz	BWLQKXPUERVWCF-UNMCSNQZSA-N	0	3	344.458	3.253	20	30		EGEDHN
CC(C)(C)C1CC(N[C@H]2CCN(Cc3ccc(C#N)cc3)C2=O)C1	ZINC000560610509	459379858	/nfs/dbraw/zinc/37/98/58/459379858.db2.gz	VBPKRWMIADDVMY-ABHNRTSZSA-N	0	3	325.456	3.073	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H]1CCN(C(C)(C)C)C1	ZINC000595704514	459406458	/nfs/dbraw/zinc/40/64/58/459406458.db2.gz	RZRZOKKYLHEZDT-SFHVURJKSA-N	0	3	342.487	3.353	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)[C@@H](C)N1CCC(Cc2ccccc2)CC1	ZINC000484286572	459411530	/nfs/dbraw/zinc/41/15/30/459411530.db2.gz	BFPOVFAIJLUPEX-QZTJIDSGSA-N	0	3	341.499	3.338	20	30		EGEDHN
C=CCN(CC(=O)NCCc1ccccc1OC)CC1CCCCC1	ZINC000484482824	459415877	/nfs/dbraw/zinc/41/58/77/459415877.db2.gz	AKKXOSWZTORMOV-UHFFFAOYSA-N	0	3	344.499	3.422	20	30		EGEDHN
C[C@H](Nc1ccc(C(F)(F)F)c(C#N)n1)[C@H](c1ccccc1)N(C)C	ZINC000569233765	459418548	/nfs/dbraw/zinc/41/85/48/459418548.db2.gz	AVYBGKHFWBYUMJ-YVEFUNNKSA-N	0	3	348.372	3.497	20	30		EGEDHN
Cc1nsc(N2CCCN(CCCc3ccccc3)CC2)c1C#N	ZINC000561335195	459444218	/nfs/dbraw/zinc/44/42/18/459444218.db2.gz	MVVAHLLLJNMAIK-UHFFFAOYSA-N	0	3	340.496	3.468	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN2CC[C@@H](Oc3ccccc3)C2)c1	ZINC000595832208	459458679	/nfs/dbraw/zinc/45/86/79/459458679.db2.gz	SVZSBAHIXHDZFK-LJQANCHMSA-N	0	3	335.407	3.040	20	30		EGEDHN
C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NCc1cccc(C#N)c1F	ZINC000497172716	459472350	/nfs/dbraw/zinc/47/23/50/459472350.db2.gz	NLGIVBIBPSXEST-XJKSGUPXSA-N	0	3	347.434	3.432	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@H](N[C@@H]3CCc4ccc(F)cc43)C2=O)cc1	ZINC000541881667	459504735	/nfs/dbraw/zinc/50/47/35/459504735.db2.gz	YKKGFOFOEHQMAJ-UXHICEINSA-N	0	3	349.409	3.470	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N[C@@H]1CCO[C@@H](c2ccccn2)C1	ZINC000569802654	459512670	/nfs/dbraw/zinc/51/26/70/459512670.db2.gz	NXGBKNGFFXGHRI-QWFCFKBJSA-N	0	3	349.434	3.190	20	30		EGEDHN
Cc1cccc(C)c1CN(CC(=O)NC1(C#N)CCC1)CC(C)C	ZINC000592137965	459533457	/nfs/dbraw/zinc/53/34/57/459533457.db2.gz	VXXUBEUOETZCQM-UHFFFAOYSA-N	0	3	327.472	3.324	20	30		EGEDHN
C[C@@H]1CCCC[C@H]1OCCN1CC[C@H](Oc2ccc(C#N)cn2)C1	ZINC000562363288	459546407	/nfs/dbraw/zinc/54/64/07/459546407.db2.gz	QRTXZRKJCDYELM-BPQIPLTHSA-N	0	3	329.444	3.002	20	30		EGEDHN
C=CCc1ccc(OC[C@H](O)CN2CC3(C2)CCCC3)c(OC)c1	ZINC000488585399	459547294	/nfs/dbraw/zinc/54/72/94/459547294.db2.gz	UAMBBZSCYQVAJF-QGZVFWFLSA-N	0	3	331.456	3.039	20	30		EGEDHN
Cc1ccccc1[C@@H](C(C)C)N(C)CC(=O)N[C@](C)(C#N)C1CC1	ZINC000488739276	459550238	/nfs/dbraw/zinc/55/02/38/459550238.db2.gz	KSHJDLAATCZTJK-WOJBJXKFSA-N	0	3	327.472	3.432	20	30		EGEDHN
Cc1cc(CNC[C@H](O)COc2ccc(CC#N)cc2)ccc1Cl	ZINC000570157134	459552760	/nfs/dbraw/zinc/55/27/60/459552760.db2.gz	YXULYPWQCGHLCI-KRWDZBQOSA-N	0	3	344.842	3.244	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H](C)c2ccc(SCC)cc2)CC1	ZINC000490618069	459581633	/nfs/dbraw/zinc/58/16/33/459581633.db2.gz	USJBXAOYCJRCGJ-OAHLLOKOSA-N	0	3	330.497	3.321	20	30		EGEDHN
CC[C@H](NCc1ccc(C#N)c(C)c1)C(=O)NCc1cccs1	ZINC000592374093	459583829	/nfs/dbraw/zinc/58/38/29/459583829.db2.gz	DGLWICDISXGISL-KRWDZBQOSA-N	0	3	327.453	3.113	20	30		EGEDHN
C#CCN1CCC(C(=O)NCc2cc(Cl)sc2Cl)CC1	ZINC000490914883	459589838	/nfs/dbraw/zinc/58/98/38/459589838.db2.gz	JVXHMBLDKQTACE-UHFFFAOYSA-N	0	3	331.268	3.016	20	30		EGEDHN
CC[C@@H](N[C@@H](C)c1cccc(C#N)c1)C(=O)NCc1cccs1	ZINC000592393964	459590473	/nfs/dbraw/zinc/59/04/73/459590473.db2.gz	LXGRPEHGBWYPOH-SUMWQHHRSA-N	0	3	327.453	3.365	20	30		EGEDHN
C#C[C@H](NC(=O)NC1CCN(C2CC2)CC1)c1ccc(Cl)cc1F	ZINC000491095854	459597070	/nfs/dbraw/zinc/59/70/70/459597070.db2.gz	MYCQKVQUJYCTRF-KRWDZBQOSA-N	0	3	349.837	3.079	20	30		EGEDHN
C#CCNC(=O)C1CCN(Cc2ccccc2Oc2ccccc2)CC1	ZINC000491099854	459597967	/nfs/dbraw/zinc/59/79/67/459597967.db2.gz	DCUXHZSXKSPXBC-UHFFFAOYSA-N	0	3	348.446	3.440	20	30		EGEDHN
C#C[C@@H](NC(=O)N[C@@H](C)C1=CCN(C)CC1)c1ccc(Cl)cc1F	ZINC000491220043	459605577	/nfs/dbraw/zinc/60/55/77/459605577.db2.gz	JSOFEGKNZALHBF-YVEFUNNKSA-N	0	3	349.837	3.103	20	30		EGEDHN
C#C[C@@H](C)N(C)CCC(=O)N[C@@H](c1cccs1)c1ccccc1	ZINC000491339678	459617925	/nfs/dbraw/zinc/61/79/25/459617925.db2.gz	RPLKITCQTLKNOE-DNVCBOLYSA-N	0	3	326.465	3.297	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)[C@H]2CCCc3ccccc32)CC1	ZINC000592526142	459625567	/nfs/dbraw/zinc/62/55/67/459625567.db2.gz	UQBBDJYRHLPGKM-IBGZPJMESA-N	0	3	327.472	3.356	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H]2CC[C@@H](c3ccc(Cl)cc3)C2)CC1	ZINC000491556768	459636819	/nfs/dbraw/zinc/63/68/19/459636819.db2.gz	YYVDUZWCKNZTOR-IEBWSBKVSA-N	0	3	344.886	3.438	20	30		EGEDHN
N#CC1(NC(=O)CN2CCCC[C@H]2CCCc2ccccc2)CCC1	ZINC000527377255	459638482	/nfs/dbraw/zinc/63/84/82/459638482.db2.gz	UXVWGWABJJRCOU-IBGZPJMESA-N	0	3	339.483	3.426	20	30		EGEDHN
COC[C@@H](NCC(=O)Nc1ccccc1S[C@H](C)CC#N)C(C)C	ZINC000543452129	459659626	/nfs/dbraw/zinc/65/96/26/459659626.db2.gz	KUYMSYGXWHYYDP-GDBMZVCRSA-N	0	3	349.500	3.280	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN[C@H]2CCCc3ccc(F)cc32)cc1	ZINC000573479944	459683894	/nfs/dbraw/zinc/68/38/94/459683894.db2.gz	ADNKEPLIVFVJKE-XLIONFOSSA-N	0	3	340.398	3.104	20	30		EGEDHN
CN(C)CCN(Cc1cccs1)C(=O)/C=C/c1ccc(C#N)cc1	ZINC000492067579	459690553	/nfs/dbraw/zinc/69/05/53/459690553.db2.gz	LXCWJJNKXUBHJO-MDZDMXLPSA-N	0	3	339.464	3.223	20	30		EGEDHN
CC[C@H](C)N[C@@H](CNC(=O)N1CCC[C@@H](CC#N)C1)c1ccco1	ZINC000596599316	459692054	/nfs/dbraw/zinc/69/20/54/459692054.db2.gz	TXAGFGFRUQMKDN-JYJNAYRXSA-N	0	3	332.448	3.044	20	30		EGEDHN
CC[C@H](C)N[C@@H](CNC(=O)N1CCC[C@H](CC#N)C1)c1ccco1	ZINC000596599317	459692652	/nfs/dbraw/zinc/69/26/52/459692652.db2.gz	TXAGFGFRUQMKDN-XHSDSOJGSA-N	0	3	332.448	3.044	20	30		EGEDHN
C[C@H](O)[C@@H]1CCCN(Cc2cn(CCC#N)nc2-c2ccccc2)C1	ZINC000543748512	459694425	/nfs/dbraw/zinc/69/44/25/459694425.db2.gz	TZRGCVWOCUZKRX-FUHWJXTLSA-N	0	3	338.455	3.057	20	30		EGEDHN
CN1CC[C@H](NC(=O)/C=C\c2ccc(C#N)cc2)[C@@H]1c1ccccc1	ZINC000492248321	459697063	/nfs/dbraw/zinc/69/70/63/459697063.db2.gz	MIEXSQLKEXQBKM-FJCXHAQZSA-N	0	3	331.419	3.133	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@@H]1CNCc1ncc(Br)cc1F	ZINC000527704177	459706908	/nfs/dbraw/zinc/70/69/08/459706908.db2.gz	VIICJGFCOGCXRM-QMTHXVAHSA-N	0	3	329.213	3.054	20	30		EGEDHN
CN(C(=O)C(C[C@@H]1CCCO1)C(F)(F)F)c1cccc(C#N)c1	ZINC000593038128	459749488	/nfs/dbraw/zinc/74/94/88/459749488.db2.gz	WILFRLYWSBIUQB-KBPBESRZSA-N	0	3	326.318	3.269	20	30		EGEDHN
CCn1cc(CN(CCOc2ccc(C#N)cc2OC)C(C)C)cn1	ZINC000593081387	459766836	/nfs/dbraw/zinc/76/68/36/459766836.db2.gz	NHOIPCLSCAKTMI-UHFFFAOYSA-N	0	3	342.443	3.073	20	30		EGEDHN
Cc1cccc(C)c1[C@H](C)NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000564494965	459774711	/nfs/dbraw/zinc/77/47/11/459774711.db2.gz	FBKNGXPDBPDQIU-PKOBYXMFSA-N	0	3	338.451	3.460	20	30		EGEDHN
N#C[C@@H]1CCC[C@H](N[C@H]2CCN(c3ccc(Cl)cc3F)C2=O)C1	ZINC000527992678	459790209	/nfs/dbraw/zinc/79/02/09/459790209.db2.gz	ZGVIBWXMBMNCGZ-ZLDLUXBVSA-N	0	3	335.810	3.256	20	30		EGEDHN
N#CCCC1CCN(Cc2cn(CCC#N)nc2-c2ccncc2)CC1	ZINC000574452614	459820773	/nfs/dbraw/zinc/82/07/73/459820773.db2.gz	CUUJQQVCLZTOCY-UHFFFAOYSA-N	0	3	348.454	3.375	20	30		EGEDHN
COCc1ccc(NC(=O)NCCN2[C@H](C)CCC[C@H]2C)cc1C#N	ZINC000529210093	459825657	/nfs/dbraw/zinc/82/56/57/459825657.db2.gz	CMJBAUFHOQFZPE-HUUCEWRRSA-N	0	3	344.459	3.089	20	30		EGEDHN
C=CCOCC(=O)Nc1ccc(SCCN2CCCCC2)cc1	ZINC000566275215	459833852	/nfs/dbraw/zinc/83/38/52/459833852.db2.gz	USQBGOAVVMCPDV-UHFFFAOYSA-N	0	3	334.485	3.406	20	30		EGEDHN
C[C@@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccc2c(c1)OCC(=O)N2	ZINC000586793865	459874806	/nfs/dbraw/zinc/87/48/06/459874806.db2.gz	JMHZVYBSBFQYIC-PXAZEXFGSA-N	0	3	333.391	3.227	20	30		EGEDHN
CS(=O)(=O)[C@@H]1CCC[C@H](N[C@H]2CCCCc3cc(C#N)ccc32)C1	ZINC000574858193	459882186	/nfs/dbraw/zinc/88/21/86/459882186.db2.gz	NWLLVXIWGPOEJZ-SCTDSRPQSA-N	0	3	346.496	3.271	20	30		EGEDHN
COc1cc(C#N)ccc1NC(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000602309088	459891421	/nfs/dbraw/zinc/89/14/21/459891421.db2.gz	YAKLYQDYXOBEOM-KRWDZBQOSA-N	0	3	335.407	3.027	20	30		EGEDHN
C=CCOc1ccc(C(=O)Nc2cccc3c2CCNC3)cc1OC	ZINC000574915668	459894008	/nfs/dbraw/zinc/89/40/08/459894008.db2.gz	RNONWVCKHULCPH-UHFFFAOYSA-N	0	3	338.407	3.158	20	30		EGEDHN
CCC(C#N)C(=O)N(C)[C@@H](C(=O)OC)c1cccc(Cl)c1Cl	ZINC000598428315	459897023	/nfs/dbraw/zinc/89/70/23/459897023.db2.gz	MVHKHSYESPTOAZ-NOZJJQNGSA-N	0	3	343.210	3.216	20	30		EGEDHN
N#Cc1ccccc1NC(=O)CCN1CCC[C@H]1c1ccc(O)cc1	ZINC000609144467	459911446	/nfs/dbraw/zinc/91/14/46/459911446.db2.gz	VHAQOTOOQNMZKX-IBGZPJMESA-N	0	3	335.407	3.430	20	30		EGEDHN
CCC(C#N)C(=O)N[C@@](C)(C(=O)OC)c1ccc(Cl)c(Cl)c1	ZINC000593614749	459934074	/nfs/dbraw/zinc/93/40/74/459934074.db2.gz	AFRMDROXTBFMSP-RFAUZJTJSA-N	0	3	343.210	3.048	20	30		EGEDHN
C[C@H](CCC#N)CN1CCCN(C(=O)c2cccc(Cl)c2)CC1	ZINC000602450797	459943001	/nfs/dbraw/zinc/94/30/01/459943001.db2.gz	YNIQQEBAKWABPX-OAHLLOKOSA-N	0	3	333.863	3.428	20	30		EGEDHN
CN(Cc1cc(Br)cs1)C[C@@H](O)CC(C)(C)C#N	ZINC000598585389	459954422	/nfs/dbraw/zinc/95/44/22/459954422.db2.gz	BZFIVMYOKZNLCA-NSHDSACASA-N	0	3	331.279	3.243	20	30		EGEDHN
CCc1ncc(CNC2CCN(Cc3cccc(C#N)c3)CC2)s1	ZINC000593693374	459954602	/nfs/dbraw/zinc/95/46/02/459954602.db2.gz	WQZPDZMLNTUELD-UHFFFAOYSA-N	0	3	340.496	3.331	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000598621894	459967524	/nfs/dbraw/zinc/96/75/24/459967524.db2.gz	YNAIATXDNAAARJ-NVXWUHKLSA-N	0	3	331.416	3.075	20	30		EGEDHN
COC(=O)c1cc(CN[C@@H]2CCc3cc(C#N)ccc32)n2c1CCCC2	ZINC000598636995	459971687	/nfs/dbraw/zinc/97/16/87/459971687.db2.gz	JVNDHRMXHJZQHM-LJQANCHMSA-N	0	3	349.434	3.260	20	30		EGEDHN
CC[C@@H](C)C(=O)Nc1cccc(CNC[C@H](O)CC(C)(C)C#N)c1	ZINC000598700411	459998143	/nfs/dbraw/zinc/99/81/43/459998143.db2.gz	NEGXWFPAHAZYQR-RHSMWYFYSA-N	0	3	331.460	3.062	20	30		EGEDHN
CC(=O)N1CC[C@H](N[C@H](C)CC2(C#N)CCOCC2)c2ccccc21	ZINC000602578974	460005469	/nfs/dbraw/zinc/00/54/69/460005469.db2.gz	XRJVDOSRLAURBV-QAPCUYQASA-N	0	3	341.455	3.173	20	30		EGEDHN
CC1CCC(Oc2cc(CNC[C@@H](O)CC(C)(C)C#N)ccn2)CC1	ZINC000598720651	460006442	/nfs/dbraw/zinc/00/64/42/460006442.db2.gz	QQDLCSCAISTWMH-NXYGQSRBSA-N	0	3	345.487	3.429	20	30		EGEDHN
COc1ccccc1[C@@H](CNC[C@@H](O)CC(C)(C)C#N)OC(C)C	ZINC000598723452	460006575	/nfs/dbraw/zinc/00/65/75/460006575.db2.gz	HZJJFWARKJSBBG-MAUKXSAKSA-N	0	3	334.460	3.052	20	30		EGEDHN
CC(C)[C@@](C)(Cc1ccc(Cl)cc1)NC(=O)[C@@H](N)CCCC#N	ZINC000602586797	460012589	/nfs/dbraw/zinc/01/25/89/460012589.db2.gz	VSSZICJVSBTLHQ-FUHWJXTLSA-N	0	3	335.879	3.435	20	30		EGEDHN
C[C@H](CCC#N)CN[C@@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000602616373	460024716	/nfs/dbraw/zinc/02/47/16/460024716.db2.gz	NAJRYSDCEOHJAA-TZMCWYRMSA-N	0	3	339.361	3.340	20	30		EGEDHN
C[C@H](c1ccc(C#N)cc1)N1CCC(C(N)=O)(c2ccccc2)CC1	ZINC000609823576	460024915	/nfs/dbraw/zinc/02/49/15/460024915.db2.gz	QUOIHMZVHKYKAI-MRXNPFEDSA-N	0	3	333.435	3.138	20	30		EGEDHN
O=C(c1ccc(C#Cc2ccccc2)cc1)N1CC[C@@H](N2CCCC2)C1	ZINC000589140411	460037146	/nfs/dbraw/zinc/03/71/46/460037146.db2.gz	IGYQTEBGCWOCOR-JOCHJYFZSA-N	0	3	344.458	3.397	20	30		EGEDHN
CCOC(=O)C[C@@H](c1ccccc1)C1CCN(C(=O)C(C)C#N)CC1	ZINC000609920248	460039549	/nfs/dbraw/zinc/03/95/49/460039549.db2.gz	WOYJHCISLFXILL-QAPCUYQASA-N	0	3	342.439	3.122	20	30		EGEDHN
COc1cccc(CN(CCN(C)C)Cc2ccc(C#N)cc2)c1F	ZINC000589194639	460051337	/nfs/dbraw/zinc/05/13/37/460051337.db2.gz	YLKJFJHPSLQEOE-UHFFFAOYSA-N	0	3	341.430	3.270	20	30		EGEDHN
CSc1ccc([C@H](CNCc2cccc(C#N)n2)N(C)C)cc1	ZINC000602673429	460058360	/nfs/dbraw/zinc/05/83/60/460058360.db2.gz	URLBONJRTJMBGT-SFHVURJKSA-N	0	3	326.469	3.068	20	30		EGEDHN
Cc1cc(C)c(C#N)c(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)n1	ZINC000598858122	460071864	/nfs/dbraw/zinc/07/18/64/460071864.db2.gz	WXIGKUQBDKQMTM-YPMHNXCESA-N	0	3	341.333	3.256	20	30		EGEDHN
Cc1cccc(C)c1OC[C@H](O)CN[C@@H]1CCc2ccc(C#N)cc21	ZINC000589338047	460075354	/nfs/dbraw/zinc/07/53/54/460075354.db2.gz	PYNXVRIEMCEFIH-UYAOXDASSA-N	0	3	336.435	3.192	20	30		EGEDHN
N#CCN1CCC(NCc2ccc(Br)cc2Cl)CC1	ZINC000610270941	460100672	/nfs/dbraw/zinc/10/06/72/460100672.db2.gz	UHPNOFMPPRMFMR-UHFFFAOYSA-N	0	3	342.668	3.180	20	30		EGEDHN
N#Cc1ccc(N2CCN(CC3CCCCC3)CC2)cc1[N+](=O)[O-]	ZINC000589566210	460103495	/nfs/dbraw/zinc/10/34/95/460103495.db2.gz	LWXZBKXNRQRKPW-UHFFFAOYSA-N	0	3	328.416	3.169	20	30		EGEDHN
C=CCc1ccc(OC[C@@H](O)CNCc2cc(C)cs2)c(OC)c1	ZINC000576339896	460121082	/nfs/dbraw/zinc/12/10/82/460121082.db2.gz	KMIMIOMSWISMFO-INIZCTEOSA-N	0	3	347.480	3.323	20	30		EGEDHN
N#Cc1ccc(CNC(=O)N[C@@H]2CCCN3CCCC[C@@H]23)cc1Cl	ZINC000594247134	460170121	/nfs/dbraw/zinc/17/01/21/460170121.db2.gz	AIXDODANHCSPMY-SJORKVTESA-N	0	3	346.862	3.028	20	30		EGEDHN
CC(C)(C)N1C[C@@H](C(=O)N[C@@H]2CCCC[C@@H]2C#N)[C@H](C(F)(F)F)C1	ZINC000598094129	460171914	/nfs/dbraw/zinc/17/19/14/460171914.db2.gz	COZVDPRRHAMLAA-AAVRWANBSA-N	0	3	345.409	3.094	20	30		EGEDHN
N#Cc1ccccc1NC1CCN(CCOc2ccccc2C#N)CC1	ZINC000602896467	460174768	/nfs/dbraw/zinc/17/47/68/460174768.db2.gz	RDNYSUVGOOXDFB-UHFFFAOYSA-N	0	3	346.434	3.385	20	30		EGEDHN
C[C@@H](N[C@@H]1CCO[C@H]1c1ccccc1)C(=O)Nc1cccc(C#N)c1	ZINC000602918260	460183394	/nfs/dbraw/zinc/18/33/94/460183394.db2.gz	PHQDBXDSLUSZSA-ZMYBRWDISA-N	0	3	335.407	3.005	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CCC[C@@H](OC2CCC2)C1	ZINC000594390901	460203015	/nfs/dbraw/zinc/20/30/15/460203015.db2.gz	YCGPSAWVEMCDKO-PKOBYXMFSA-N	0	3	326.440	3.319	20	30		EGEDHN
CC(C)OC(=O)C[C@H](NC(=O)C(C#N)CCc1ccccc1)C(C)C	ZINC000594407499	460208347	/nfs/dbraw/zinc/20/83/47/460208347.db2.gz	KJALXDNUNSQSOW-MSOLQXFVSA-N	0	3	344.455	3.241	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)cc1)C[C@@H](O)COc1ccccc1C#N	ZINC000599273688	460213509	/nfs/dbraw/zinc/21/35/09/460213509.db2.gz	GXLDZMJOCUKORN-HXUWFJFHSA-N	0	3	349.434	3.080	20	30		EGEDHN
C[C@]1(NC[C@@H](O)COc2ccccc2C#N)CCCc2ccccc21	ZINC000599327315	460229391	/nfs/dbraw/zinc/22/93/91/460229391.db2.gz	RGNKSOXEJUDGRP-NQIIRXRSSA-N	0	3	336.435	3.139	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)Nc1ccnc(C#N)c1)c1ccsc1	ZINC000603140470	460252103	/nfs/dbraw/zinc/25/21/03/460252103.db2.gz	VPBQUBGMRFPYAL-INIZCTEOSA-N	0	3	343.456	3.219	20	30		EGEDHN
CC(C)(C#N)CCCN[C@@H](Cc1ccccc1)[C@H](O)C(F)(F)F	ZINC000603147490	460254839	/nfs/dbraw/zinc/25/48/39/460254839.db2.gz	YRQSPGHHJKWYEB-GJZGRUSLSA-N	0	3	328.378	3.440	20	30		EGEDHN
C[C@H]1CN(CCC(=O)Nc2sccc2C#N)C[C@H](C)C1(F)F	ZINC000599512154	460265191	/nfs/dbraw/zinc/26/51/91/460265191.db2.gz	DGLSNDFVLRULPE-QWRGUYRKSA-N	0	3	327.400	3.171	20	30		EGEDHN
COC(=O)c1cnc(C2CCN(CCCC(C)(C)C#N)CC2)s1	ZINC000599555292	460273956	/nfs/dbraw/zinc/27/39/56/460273956.db2.gz	GKLNOSPLNWPTQM-UHFFFAOYSA-N	0	3	335.473	3.439	20	30		EGEDHN
CN(Cc1ccccc1)C[C@@H](O)COc1ccc(C#N)cc1Cl	ZINC000611112890	460290766	/nfs/dbraw/zinc/29/07/66/460290766.db2.gz	HWRADPKCZGTVHQ-MRXNPFEDSA-N	0	3	330.815	3.083	20	30		EGEDHN
CC[C@H](NCC(=O)N(CCC#N)CCC#N)c1cc(C)ccc1C	ZINC000599640571	460295566	/nfs/dbraw/zinc/29/55/66/460295566.db2.gz	JUBZDHFYNKCLPQ-SFHVURJKSA-N	0	3	326.444	3.000	20	30		EGEDHN
Cc1ccc(CN2CC[C@H](CN(C)c3cccc(C#N)n3)C2)s1	ZINC000603398879	460296703	/nfs/dbraw/zinc/29/67/03/460296703.db2.gz	CVTILWBPTGMBLR-OAHLLOKOSA-N	0	3	326.469	3.282	20	30		EGEDHN
CN1CCCC(C)(C)[C@H]1CNC(=O)c1cc2ccccc2n1CC#N	ZINC000619232725	460306708	/nfs/dbraw/zinc/30/67/08/460306708.db2.gz	VPJDBUOCTVZADZ-GOSISDBHSA-N	0	3	338.455	3.015	20	30		EGEDHN
C[C@@H](NCCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1cccc(C#N)c1	ZINC000611387196	460350565	/nfs/dbraw/zinc/35/05/65/460350565.db2.gz	GZTZWZRYTIABDK-CYBMUJFWSA-N	0	3	338.367	3.146	20	30		EGEDHN
C[C@@H](NC[C@@H](O)COCc1ccccc1Cl)c1cccc(C#N)c1	ZINC000611388208	460351481	/nfs/dbraw/zinc/35/14/81/460351481.db2.gz	LELLKQZNPGUNJC-RDTXWAMCSA-N	0	3	344.842	3.440	20	30		EGEDHN
CC(C)c1ccc(CNC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000604416407	460423460	/nfs/dbraw/zinc/42/34/60/460423460.db2.gz	IYBQKDRZFJNECH-FQEVSTJZSA-N	0	3	338.451	3.406	20	30		EGEDHN
Cc1cccc2c1CC[C@@H]2N[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000617099079	460743204	/nfs/dbraw/zinc/74/32/04/460743204.db2.gz	PWGHAOKUTZYXNR-LEWJYISDSA-N	0	3	345.446	3.245	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccccc2N(C)CCC)CC1	ZINC000627095713	460748226	/nfs/dbraw/zinc/74/82/26/460748226.db2.gz	GDZDPCYQBBDUCR-UHFFFAOYSA-N	0	3	330.476	3.305	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2cccc3[nH]ccc32)CC1	ZINC000632986998	460921687	/nfs/dbraw/zinc/92/16/87/460921687.db2.gz	SXKGWAHUPOWTDT-UHFFFAOYSA-N	0	3	326.444	3.008	20	30		EGEDHN
C[C@H]1CN(CCCNc2nc(C(C)(C)C)ccc2C#N)CCCO1	ZINC000617843285	460993102	/nfs/dbraw/zinc/99/31/02/460993102.db2.gz	YBYIXPGPAGSLJS-HNNXBMFYSA-N	0	3	330.476	3.164	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN(C)CC(C)(C)CO)cc1OC	ZINC000628298088	461078360	/nfs/dbraw/zinc/07/83/60/461078360.db2.gz	UMIAADUBMXEQCM-UHFFFAOYSA-N	0	3	327.852	3.364	20	30		EGEDHN
C=CCN(CC=C)C(=O)c1ccc(NC(=O)[C@H](N)CCC(C)C)cc1	ZINC000637936473	461137385	/nfs/dbraw/zinc/13/73/85/461137385.db2.gz	FVEPZKNKZRNHRF-GOSISDBHSA-N	0	3	343.471	3.203	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Cc2cccc(OC)c2Cl)CC1	ZINC000668370008	461259164	/nfs/dbraw/zinc/25/91/64/461259164.db2.gz	KUAPQVMTTIQVCB-UHFFFAOYSA-N	0	3	336.863	3.048	20	30		EGEDHN
FC1(F)CC12CCN(CC#CCN1CCC3(CC3(F)F)CC1)CC2	ZINC000649774183	461338008	/nfs/dbraw/zinc/33/80/08/461338008.db2.gz	WNDFYJCWRIHKCQ-UHFFFAOYSA-N	0	3	344.396	3.232	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)[C@H](C)c1nc(C)cs1)C(C)C	ZINC000668683427	461380044	/nfs/dbraw/zinc/38/00/44/461380044.db2.gz	VZSUDGGKWVTCIO-HOTGVXAUSA-N	0	3	335.517	3.370	20	30		EGEDHN
CC#CCN(C)C(=O)c1ccccc1OCCN1CCCC[C@@H]1C	ZINC000647541883	461755386	/nfs/dbraw/zinc/75/53/86/461755386.db2.gz	DBYWMZZKYATNJA-KRWDZBQOSA-N	0	3	328.456	3.035	20	30		EGEDHN
C=CCc1cc(CN[C@@H](C(C)C)[C@H](O)C(F)(F)F)cc(OC)c1O	ZINC000643883364	461825808	/nfs/dbraw/zinc/82/58/08/461825808.db2.gz	AFTLKFVKTCBBOK-HOCLYGCPSA-N	0	3	347.377	3.167	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2CC[C@@H]2c2ccccc2)CC1	ZINC000660596574	461871532	/nfs/dbraw/zinc/87/15/32/461871532.db2.gz	FXAAWFFQXISOHE-RTBURBONSA-N	0	3	327.472	3.272	20	30		EGEDHN
N#Cc1ccc(CCN2CC[C@]3(C2)CC(=O)c2ccccc2O3)cc1	ZINC000660804087	461978078	/nfs/dbraw/zinc/97/80/78/461978078.db2.gz	RCQAETNAZIYLJB-OAQYLSRUSA-N	0	3	332.403	3.211	20	30		EGEDHN
C=CCCn1cc(CNCCc2c[nH]c3cc(Cl)ccc23)nn1	ZINC000657336448	462053937	/nfs/dbraw/zinc/05/39/37/462053937.db2.gz	QZKKFCQCFYJDAO-UHFFFAOYSA-N	0	3	329.835	3.321	20	30		EGEDHN
C=CCOCCCC(=O)N(C(C)C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000648566251	462180192	/nfs/dbraw/zinc/18/01/92/462180192.db2.gz	WXLYWAADBPJRBQ-HXUWFJFHSA-N	0	3	344.499	3.481	20	30		EGEDHN
CSc1ccc(C(=O)N(CCN(C)C)Cc2cccc(C#N)c2)o1	ZINC000171801597	534180965	/nfs/dbraw/zinc/18/09/65/534180965.db2.gz	SHMUKHLCXQPDPI-UHFFFAOYSA-N	0	3	343.452	3.077	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cccc(OCC(C)C)c2)CC1	ZINC000171739012	526441834	/nfs/dbraw/zinc/44/18/34/526441834.db2.gz	MKGFLGGMXDDMPS-UHFFFAOYSA-N	0	3	331.460	3.493	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@H]1CCCC[C@@H]1NCc1ccc(C#N)o1	ZINC000174564873	526473461	/nfs/dbraw/zinc/47/34/61/526473461.db2.gz	DKMBMXQZQCMMBS-CJNGLKHVSA-N	0	3	333.432	3.324	20	30		EGEDHN
C=C(C)COc1cc(CN2CCC(C3OCCO3)CC2)ccc1OC	ZINC000130126461	526659790	/nfs/dbraw/zinc/65/97/90/526659790.db2.gz	KSVWWYQTMFIYJG-UHFFFAOYSA-N	0	3	347.455	3.235	20	30		EGEDHN
C#CCCCCNC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000154948273	526695817	/nfs/dbraw/zinc/69/58/17/526695817.db2.gz	QELNHKCYRMQJFR-IBGZPJMESA-N	0	3	327.472	3.096	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccccc2CCC(F)(F)F)CC1	ZINC000156921722	526933341	/nfs/dbraw/zinc/93/33/41/526933341.db2.gz	VFIUQBBNWLMKST-UHFFFAOYSA-N	0	3	338.373	3.465	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@H](C)C1CCOCC1	ZINC000179836149	527012659	/nfs/dbraw/zinc/01/26/59/527012659.db2.gz	HXMIDQFQRSGWKI-CQSZACIVSA-N	0	3	334.485	3.308	20	30		EGEDHN
CC(C)C[C@H]1OCCC[C@H]1NCC(=O)Nc1cc(Cl)ccc1C#N	ZINC000186323300	528609157	/nfs/dbraw/zinc/60/91/57/528609157.db2.gz	UPPQVLFVBMJQGK-NVXWUHKLSA-N	0	3	349.862	3.333	20	30		EGEDHN
CCCC[C@@H](CNC(=O)OC(C)(C)C)NCc1cc(C#N)n(C)c1	ZINC000191317078	528824825	/nfs/dbraw/zinc/82/48/25/528824825.db2.gz	UMWSPHKGRYOEIA-HNNXBMFYSA-N	0	3	334.464	3.070	20	30		EGEDHN
CCN1CCCC[C@@H]1CNC(=O)[C@@H]1CCCN(C(=O)C(C)(C)C)C1	ZINC000329436534	547496751	/nfs/dbraw/zinc/49/67/51/547496751.db2.gz	JIWPXAIVCRTNFX-HZPDHXFCSA-N	0	3	337.508	3.102	20	30		EGEDHN
O=C(Cc1cc(F)cc2c1OCOC2)NC[C@@H]1CCCCN1C1CC1	ZINC000329969575	547511424	/nfs/dbraw/zinc/51/14/24/547511424.db2.gz	WQSVUHCOJJZHPN-KRWDZBQOSA-N	0	3	348.418	3.208	20	30		EGEDHN
CCC#C[C@H](C)N[C@@H](C)c1ccc(S(=O)(=O)N(CC)CC)cc1	ZINC000678728976	549549236	/nfs/dbraw/zinc/54/92/36/549549236.db2.gz	QWFMSDJROANIIB-HOTGVXAUSA-N	0	3	336.501	3.170	20	30		EGEDHN
OCC1(NCC#Cc2ccc(OC(F)(F)F)cc2)CCCCC1	ZINC000678974358	549607378	/nfs/dbraw/zinc/60/73/78/549607378.db2.gz	GWOOGDBFRPRLNL-UHFFFAOYSA-N	0	3	327.346	3.222	20	30		EGEDHN
C=CCN1CC[C@H](N(C)CCCc2ccc(C(F)(F)F)cc2)C1=O	ZINC000685004194	550392853	/nfs/dbraw/zinc/39/28/53/550392853.db2.gz	JRQOBXHLHSJTGK-INIZCTEOSA-N	0	3	340.389	3.357	20	30		EGEDHN
CN(C)C[C@H]1CCCCN1C(=S)Nc1ccc(C#N)c(Cl)c1	ZINC000726483342	574558719	/nfs/dbraw/zinc/55/87/19/574558719.db2.gz	UEBSNFXPBMDCLO-CQSZACIVSA-N	0	3	336.892	3.325	20	30		EGEDHN
C#Cc1cccc(N(CC)C(=O)[C@@H]2CCCN(Cc3cccnc3)C2)c1	ZINC000728539962	574757940	/nfs/dbraw/zinc/75/79/40/574757940.db2.gz	VJMNPXGKOFKALX-HXUWFJFHSA-N	0	3	347.462	3.328	20	30		EGEDHN
C#Cc1ccc(C(=O)N(CC)[C@H]2CCN([C@@H](C)c3ccccc3)C2)nc1	ZINC000728861814	574779810	/nfs/dbraw/zinc/77/98/10/574779810.db2.gz	PSYHQWSGGGVCNE-PXNSSMCTSA-N	0	3	347.462	3.361	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C(F)(F)c2ccc(F)cc2)CC1	ZINC000729976783	574900677	/nfs/dbraw/zinc/90/06/77/574900677.db2.gz	AIULUJHYEOLNCF-UHFFFAOYSA-N	0	3	326.362	3.074	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](C)Cc2ccccc2Cl)CC1	ZINC000730119531	574923640	/nfs/dbraw/zinc/92/36/40/574923640.db2.gz	VSAHPQYQKWSOGF-AWEZNQCLSA-N	0	3	335.879	3.221	20	30		EGEDHN
COC(=O)NCCC(=O)C(C#N)c1nc(-c2ccc(C)cc2)cs1	ZINC000730921076	575035615	/nfs/dbraw/zinc/03/56/15/575035615.db2.gz	VCFPZMBECPBDDG-CYBMUJFWSA-N	0	3	343.408	3.041	20	30		EGEDHN
Fc1ccc(CCN2CCC(N=Nc3ccc(F)cn3)CC2)cc1	ZINC000731318714	575065299	/nfs/dbraw/zinc/06/52/99/575065299.db2.gz	NSGKLTNLGKCNRA-UHFFFAOYSA-N	0	3	330.382	3.466	20	30		EGEDHN
Cc1ncc(C=CC(=O)C(C#N)C(=O)Nc2ccccc2Cl)s1	ZINC000732900486	575295249	/nfs/dbraw/zinc/29/52/49/575295249.db2.gz	PCKSPSLDJFWGQF-SYTKJHMZSA-N	0	3	345.811	3.466	20	30		EGEDHN
C[C@@H](CCO)SCC(=O)C(C#N)c1nc(-c2ccccc2)cs1	ZINC000741733780	575331104	/nfs/dbraw/zinc/33/11/04/575331104.db2.gz	WXAKUVDBTZZSNN-JSGCOSHPSA-N	0	3	346.477	3.490	20	30		EGEDHN
C#CCOc1ccc(NC(=O)NCCN2CCCC[C@H]2CC)cc1	ZINC000733633260	575376141	/nfs/dbraw/zinc/37/61/41/575376141.db2.gz	AVWDFQJKGRCHKE-QGZVFWFLSA-N	0	3	329.444	3.085	20	30		EGEDHN
Cc1cc(C=NNC(=N)N)cc(C)c1OCc1ccccc1Cl	ZINC000734744162	575548041	/nfs/dbraw/zinc/54/80/41/575548041.db2.gz	CNMMIGCVAXEEJU-UHFFFAOYSA-N	0	3	330.819	3.353	20	30		EGEDHN
N#CC(C(=O)CCCn1ccccc1=O)c1ccc2ccccc2n1	ZINC000735203118	575621186	/nfs/dbraw/zinc/62/11/86/575621186.db2.gz	ARENQUQBIYEBGS-INIZCTEOSA-N	0	3	331.375	3.053	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)Cc3ccc([N+](=O)[O-])cc3)nc21	ZINC000735788010	575712884	/nfs/dbraw/zinc/71/28/84/575712884.db2.gz	BCMPNRIWENNURG-AWEZNQCLSA-N	0	3	334.335	3.199	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)Cc3ccc(OCC#N)cc3)nc21	ZINC000735793046	575715261	/nfs/dbraw/zinc/71/52/61/575715261.db2.gz	PTDFOEGHPLHTTK-INIZCTEOSA-N	0	3	344.374	3.193	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2ccccc2SC(C)C)CC1	ZINC000740738743	576621993	/nfs/dbraw/zinc/62/19/93/576621993.db2.gz	KIEHZSVMZUFSCC-UHFFFAOYSA-N	0	3	330.497	3.405	20	30		EGEDHN
C#CCCN1CCC(NC(=O)[C@H](C)Oc2cccc(C(C)C)c2)CC1	ZINC000740738335	576622095	/nfs/dbraw/zinc/62/20/95/576622095.db2.gz	ADCOIVCHYVZXFN-KRWDZBQOSA-N	0	3	342.483	3.181	20	30		EGEDHN
CCOc1ccc(/C=N/CC2([NH+](C)C)Cc3ccccc3C2)c([O-])c1	ZINC000741466196	576688322	/nfs/dbraw/zinc/68/83/22/576688322.db2.gz	HZVRHMJIJMEOSN-HYARGMPZSA-N	0	3	338.451	3.309	20	30		EGEDHN
COc1ccc(CN[C@H]2CCN([C@H](C)c3ccccc3)C2)cc1C#N	ZINC000742370382	576774770	/nfs/dbraw/zinc/77/47/70/576774770.db2.gz	PKKFNVNTDKQARQ-UZLBHIALSA-N	0	3	335.451	3.492	20	30		EGEDHN
C#CCCN1CCC(NC(=O)C[C@@H](C)c2ccc(CC)cc2)CC1	ZINC000743490512	576810277	/nfs/dbraw/zinc/81/02/77/576810277.db2.gz	QMILJFCVXXQEKH-QGZVFWFLSA-N	0	3	326.484	3.347	20	30		EGEDHN
C[C@@H]([NH2+][C@H](C)c1ccc(-c2nnn[n-]2)c(F)c1)c1cccc(C#N)c1	ZINC000824530454	609147045	/nfs/dbraw/zinc/14/70/45/609147045.db2.gz	LUDUSEAVRLDCCG-VXGBXAGGSA-N	0	3	336.374	3.289	20	30		EGEDHN
C=CCc1cc(CN2CCN(c3ccccc3)CC2)c(O)c(OC)c1	ZINC000006997350	1291056305	/nfs/dbraw/zinc/05/63/05/1291056305.db2.gz	WEBWJOLPHRRWDA-UHFFFAOYSA-N	0	3	338.451	3.452	20	30		EGEDHN
Cc1ccc(C(=O)CCC(=O)C(C#N)C(=O)NC2CCCCC2)cc1	ZINC000050678903	1291654554	/nfs/dbraw/zinc/65/45/54/1291654554.db2.gz	DIBZUFPQVYWKKG-KRWDZBQOSA-N	0	3	340.423	3.116	20	30		EGEDHN
CC(C)(C)OC(=O)NCCCC(=O)C(C#N)c1nc2ccccc2o1	ZINC000066516849	1292119999	/nfs/dbraw/zinc/11/99/99/1292119999.db2.gz	PQZWVICORXKBFX-LBPRGKRZSA-N	0	3	343.383	3.309	20	30		EGEDHN
C[C@@H](Cc1cccc(F)c1)C(=O)C(C#N)C(=O)NC1CCCCC1	ZINC000069285167	1292238862	/nfs/dbraw/zinc/23/88/62/1292238862.db2.gz	RGBYMEXZHPLRRP-SUMWQHHRSA-N	0	3	330.403	3.162	20	30		EGEDHN
N#Cc1ccc(F)c(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)c1	ZINC000827826613	1292383125	/nfs/dbraw/zinc/38/31/25/1292383125.db2.gz	JHTUOFYUIOBHAO-KRWDZBQOSA-N	0	3	337.398	3.092	20	30		EGEDHN
C#CCOc1cccc(NC(=O)NC[C@H](c2ccccc2)N(C)C)c1	ZINC000108520489	1293081802	/nfs/dbraw/zinc/08/18/02/1293081802.db2.gz	SSLLAPOOQLQEGZ-LJQANCHMSA-N	0	3	337.423	3.123	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)CC[C@@H]1CCCCO1	ZINC000111945171	1293113311	/nfs/dbraw/zinc/11/33/11/1293113311.db2.gz	YDJYBIPZDPKQII-GJZGRUSLSA-N	0	3	344.411	3.082	20	30		EGEDHN
N#Cc1ccc(CN[C@H](Cc2ccccc2Cl)[C@H]2CCCO2)nc1	ZINC000834773934	1293145873	/nfs/dbraw/zinc/14/58/73/1293145873.db2.gz	LSCGLALTUKGHCH-RTBURBONSA-N	0	3	341.842	3.487	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)C[C@H]1OCCc2ccccc21	ZINC000115902592	1293196572	/nfs/dbraw/zinc/19/65/72/1293196572.db2.gz	CURATDNICYEOMM-IEBWSBKVSA-N	0	3	342.439	3.096	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)[C@H](CCC)OC)cc1	ZINC000835062275	1293196698	/nfs/dbraw/zinc/19/66/98/1293196698.db2.gz	NKAKQSBIZVYAOK-SJORKVTESA-N	0	3	330.428	3.492	20	30		EGEDHN
CCc1cccc(CC)c1NC(=O)C(C#N)C(=O)CSC(F)F	ZINC000835062949	1293197049	/nfs/dbraw/zinc/19/70/49/1293197049.db2.gz	GXPOJRDKPUFRKW-GFCCVEGCSA-N	0	3	340.395	3.415	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)CCO[C@H](C)CC(C)C	ZINC000120062352	1293301584	/nfs/dbraw/zinc/30/15/84/1293301584.db2.gz	VACBBSWDPJONET-HUUCEWRRSA-N	0	3	346.427	3.184	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)C(=O)NC1CC1)c1ccc(C(F)(F)F)cc1	ZINC000121321576	1293365417	/nfs/dbraw/zinc/36/54/17/1293365417.db2.gz	YRHWUNBYXXYONS-HZMBPMFUSA-N	0	3	338.329	3.186	20	30		EGEDHN
CC[C@H](C)c1ccc(NC(=O)C(C#N)C(=O)[C@@H]2CCCCO2)cc1	ZINC000122005900	1293399818	/nfs/dbraw/zinc/39/98/18/1293399818.db2.gz	GIASDGOEQPKIHM-JQFCIGGWSA-N	0	3	328.412	3.417	20	30		EGEDHN
N#CC(C(=O)Cc1ccoc1)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000123658140	1293450683	/nfs/dbraw/zinc/45/06/83/1293450683.db2.gz	QFYXFRBGMUDMBB-CYBMUJFWSA-N	0	3	337.162	3.476	20	30		EGEDHN
CC(C)Oc1cccc(CC(=O)C(C#N)C(=O)NC2CCCCC2)c1	ZINC000124759833	1293484611	/nfs/dbraw/zinc/48/46/11/1293484611.db2.gz	PSSIXIFNNWHQHD-SFHVURJKSA-N	0	3	342.439	3.174	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)[C@@H](C)Oc2cccc(C)c2)c1	ZINC000127518701	1293567020	/nfs/dbraw/zinc/56/70/20/1293567020.db2.gz	FBBQIDIXVKLGEO-QAPCUYQASA-N	0	3	336.391	3.418	20	30		EGEDHN
[O-]c1ccc(Cl)cc1/C=N/C1CC[NH+]([C@@H]2CCCC[C@@H]2O)CC1	ZINC000128469404	1293593870	/nfs/dbraw/zinc/59/38/70/1293593870.db2.gz	NGRDOGPAGWDGPI-SEUFLYEGSA-N	0	3	336.863	3.232	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)CC(c1ccccc1)c1ccccc1	ZINC000130549136	1293661177	/nfs/dbraw/zinc/66/11/77/1293661177.db2.gz	XRAXSBKZKSGNBY-LJQANCHMSA-N	0	3	334.419	3.442	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@](C)(NCC#Cc1ccc(F)cc1)C1CC1	ZINC000133263905	1293740274	/nfs/dbraw/zinc/74/02/74/1293740274.db2.gz	BGTNHKDOAFOVKW-HXUWFJFHSA-N	0	3	346.446	3.460	20	30		EGEDHN
CC[C@H](C)OCC(=O)C(C#N)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000152367621	1293966360	/nfs/dbraw/zinc/96/63/60/1293966360.db2.gz	ZPYMRVOZPJFVGK-ZANVPECISA-N	0	3	343.210	3.456	20	30		EGEDHN
Cc1cc(=O)oc2cc(OCCN(C)Cc3ccc(C#N)cc3)ccc12	ZINC000157554322	1294181648	/nfs/dbraw/zinc/18/16/48/1294181648.db2.gz	FZDIBEXIMIQNOY-UHFFFAOYSA-N	0	3	348.402	3.484	20	30		EGEDHN
C#CCCOc1ccc(CNc2ccc(N3CCN(C)CC3)cc2)cc1	ZINC000158152640	1294197354	/nfs/dbraw/zinc/19/73/54/1294197354.db2.gz	BRHXBKVAXYQNAV-UHFFFAOYSA-N	0	3	349.478	3.453	20	30		EGEDHN
C[C@H](NCc1ccc(-n2cncn2)cc1)c1ccc(OCC#N)cc1	ZINC000171768523	1294416408	/nfs/dbraw/zinc/41/64/08/1294416408.db2.gz	UFOQMWXNORCOON-HNNXBMFYSA-N	0	3	333.395	3.020	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)[C@@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1	ZINC000173984258	1294475634	/nfs/dbraw/zinc/47/56/34/1294475634.db2.gz	HUZSZXPRLFZXML-MGPQQGTHSA-N	0	3	339.222	3.330	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)c1cc(OC)cs1	ZINC000177600166	1294681769	/nfs/dbraw/zinc/68/17/69/1294681769.db2.gz	PUCNIDFHYGGYDI-GFCCVEGCSA-N	0	3	344.392	3.117	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN(C)C[C@@H]2COc3ccccc3O2)cc1	ZINC000179633993	1294810046	/nfs/dbraw/zinc/81/00/46/1294810046.db2.gz	GZLQTLIISDEYMT-MAUKXSAKSA-N	0	3	338.407	3.249	20	30		EGEDHN
C[C@@H](C#N)Oc1ccccc1NC(=O)N(CCN(C)C)C1CCCC1	ZINC000180015178	1294852704	/nfs/dbraw/zinc/85/27/04/1294852704.db2.gz	MDXCKNYTGPMRQL-HNNXBMFYSA-N	0	3	344.459	3.316	20	30		EGEDHN
CC(C)N1CCN(c2ccc(C(=O)O[C@H]3CC[C@H](C#N)C3)cc2)CC1	ZINC000183714109	1295139755	/nfs/dbraw/zinc/13/97/55/1295139755.db2.gz	PNHHCKOKJIAFTD-LPHOPBHVSA-N	0	3	341.455	3.066	20	30		EGEDHN
N#CC(C(=O)Cc1c(F)cccc1Cl)C(=O)Nc1ccccc1	ZINC000193441064	1295867773	/nfs/dbraw/zinc/86/77/73/1295867773.db2.gz	IAQKWZUOEUOYKV-ZDUSSCGKSA-N	0	3	330.746	3.369	20	30		EGEDHN
N#CC(C(=O)Cc1ccsc1)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000193475202	1295874055	/nfs/dbraw/zinc/87/40/55/1295874055.db2.gz	LAWJLMLIVQEWHH-NSHDSACASA-N	0	3	336.775	3.431	20	30		EGEDHN
N#CC(C(=O)CCc1ccco1)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000193475393	1295874533	/nfs/dbraw/zinc/87/45/33/1295874533.db2.gz	JZOJOPMVGYTVEZ-LBPRGKRZSA-N	0	3	334.734	3.352	20	30		EGEDHN
N#CC(C(=O)C[C@H]1CCCO1)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000193481716	1295874885	/nfs/dbraw/zinc/87/48/85/1295874885.db2.gz	BLNOFRFBYMPTLO-OLZOCXBDSA-N	0	3	341.194	3.210	20	30		EGEDHN
C#CCOc1ccccc1CNC[C@H](C)Oc1ccccc1OC	ZINC000237154730	1296223909	/nfs/dbraw/zinc/22/39/09/1296223909.db2.gz	KEJXVMKCJLUUMM-INIZCTEOSA-N	0	3	325.408	3.264	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CNC[C@H](O)c2c(F)cccc2F)cc1	ZINC000304344033	1296922439	/nfs/dbraw/zinc/92/24/39/1296922439.db2.gz	ZESVBIGXZUWNJM-PXAZEXFGSA-N	0	3	332.350	3.079	20	30		EGEDHN
Cc1nc(C#N)cc(N2C[C@H](C)N(Cc3ccccc3)[C@@H](C)[C@@H]2C)n1	ZINC000404416494	1297750579	/nfs/dbraw/zinc/75/05/79/1297750579.db2.gz	GOYXQKLVIHDMDB-JYJNAYRXSA-N	0	3	335.455	3.144	20	30		EGEDHN
C#CCCCNC(=O)N(CCC)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000745902691	1298498524	/nfs/dbraw/zinc/49/85/24/1298498524.db2.gz	UVLXFLYRUCPRSG-HXUWFJFHSA-N	0	3	341.499	3.486	20	30		EGEDHN
Cc1ccc2c(CCC(=O)C(C#N)C(=O)NC3CCCC3)c[nH]c2c1	ZINC000745947502	1298502654	/nfs/dbraw/zinc/50/26/54/1298502654.db2.gz	BGRDZJLGSDIIFI-QGZVFWFLSA-N	0	3	337.423	3.177	20	30		EGEDHN
CC(C)C(=O)N1CCCC[C@H]1C(=O)C(C#N)c1nc(C(C)C)cs1	ZINC000747196992	1298740445	/nfs/dbraw/zinc/74/04/45/1298740445.db2.gz	STQJBJBVJLPFLQ-ZFWWWQNUSA-N	0	3	347.484	3.480	20	30		EGEDHN
COc1cccc(O)c1/C=N/C1CCN([C@@H](C)c2ccncc2)CC1	ZINC000747689929	1298833247	/nfs/dbraw/zinc/83/32/47/1298833247.db2.gz	BBUOAAOCQOWJJF-WXUSHSQQSA-N	0	3	339.439	3.440	20	30		EGEDHN
C#CCOc1ccc(-c2nc(-c3ccc(CN(C)C)cc3)no2)cc1	ZINC000747861932	1298874284	/nfs/dbraw/zinc/87/42/84/1298874284.db2.gz	LZPPENHLJZLTIK-UHFFFAOYSA-N	0	3	333.391	3.477	20	30		EGEDHN
C=C(Cl)C[C@@H](N)C(=O)Nc1ccc(N2CCCC2)c(Cl)c1	ZINC000876745630	1298954574	/nfs/dbraw/zinc/95/45/74/1298954574.db2.gz	DVYGNDPVOXFTHJ-CYBMUJFWSA-N	0	3	328.243	3.349	20	30		EGEDHN
C=CC[C@H](NCc1ccc(N2CCC(O)CC2)cc1)c1ccncc1	ZINC000877045798	1299129603	/nfs/dbraw/zinc/12/96/03/1299129603.db2.gz	CNVWDCDWWWBAGS-NRFANRHFSA-N	0	3	337.467	3.450	20	30		EGEDHN
C#CCCOc1ccc(CN2CC[C@H](OCc3ccccn3)C2)cc1	ZINC000877645679	1299453160	/nfs/dbraw/zinc/45/31/60/1299453160.db2.gz	SBZLNWQVQNNUTG-NRFANRHFSA-N	0	3	336.435	3.275	20	30		EGEDHN
CC[C@@H](C)c1ccc(NC(=O)C(C#N)C(=O)C[C@H]2CCOC2)cc1	ZINC000753912945	1300039004	/nfs/dbraw/zinc/03/90/04/1300039004.db2.gz	IBJZRBKPTUQCTF-CKEIUWERSA-N	0	3	328.412	3.274	20	30		EGEDHN
COC(=O)[C@@H](C)[C@@H](NCc1ccc(OCC#N)cc1)c1ccccc1	ZINC000756893371	1300583624	/nfs/dbraw/zinc/58/36/24/1300583624.db2.gz	YDJAOXODYPGIFS-HNAYVOBHSA-N	0	3	338.407	3.229	20	30		EGEDHN
COc1ccc(C(=O)C(C#N)C(=O)Nc2cccc(C)c2)nc1Cl	ZINC000766841611	1302529176	/nfs/dbraw/zinc/52/91/76/1302529176.db2.gz	VJLJDRARTNKIOX-GFCCVEGCSA-N	0	3	343.770	3.013	20	30		EGEDHN
Cc1ccc(N2CCC[C@@H](NCc3ccc(C#N)c(C)c3)C2=O)cc1	ZINC000767689520	1302745489	/nfs/dbraw/zinc/74/54/89/1302745489.db2.gz	HWKGWOVAPGWXOE-HXUWFJFHSA-N	0	3	333.435	3.460	20	30		EGEDHN
C#C[C@H](CC)OC(=O)C1CCN(c2cc(Cl)ccc2Cl)C1=O	ZINC000768059822	1302813150	/nfs/dbraw/zinc/81/31/50/1302813150.db2.gz	AHXWENYTZCBLEO-VXGBXAGGSA-N	0	3	340.206	3.301	20	30		EGEDHN
C#CCCOc1ccc(CN(C)C[C@H]2COc3ccccc3O2)cc1	ZINC000768178183	1302844363	/nfs/dbraw/zinc/84/43/63/1302844363.db2.gz	FPOFEBPLSVESTR-IBGZPJMESA-N	0	3	337.419	3.361	20	30		EGEDHN
C#CCOc1ccc(CN(Cc2ccc(C(=O)NC)cc2)C2CC2)cc1	ZINC000768422062	1302898915	/nfs/dbraw/zinc/89/89/15/1302898915.db2.gz	KYSWDKMXGVIRGY-UHFFFAOYSA-N	0	3	348.446	3.223	20	30		EGEDHN
C#CCOc1ccc(CNC(C)(C)C(=O)NCC2CCCCC2)cc1	ZINC000769933048	1303195311	/nfs/dbraw/zinc/19/53/11/1303195311.db2.gz	AEPLMWJLDUAOLT-UHFFFAOYSA-N	0	3	342.483	3.263	20	30		EGEDHN
N#CC(C(=O)CCC(=O)c1ccccn1)c1ccc2ccccc2n1	ZINC000770842230	1303320559	/nfs/dbraw/zinc/32/05/59/1303320559.db2.gz	IBLBWBFCCJZBAD-HNNXBMFYSA-N	0	3	329.359	3.469	20	30		EGEDHN
COc1cc(Cl)c(C)cc1NC(=O)C(C#N)C(=O)Cc1ccco1	ZINC000772645646	1303558260	/nfs/dbraw/zinc/55/82/60/1303558260.db2.gz	OAGCJGFZBLAEDP-LBPRGKRZSA-N	0	3	346.770	3.140	20	30		EGEDHN
CCN(CC)C(=O)[C@H](Cc1ccccc1)N[C@@H]1CCC[C@@H](C#N)C1	ZINC000774110514	1303775624	/nfs/dbraw/zinc/77/56/24/1303775624.db2.gz	IAZDMCAMJVUKAO-QRVBRYPASA-N	0	3	327.472	3.138	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)c1	ZINC000774251344	1303790815	/nfs/dbraw/zinc/79/08/15/1303790815.db2.gz	IHWVYBMDJQQLJJ-JKSUJKDBSA-N	0	3	343.362	3.076	20	30		EGEDHN
COc1cc(CNCc2ccc(C#N)cc2)ccc1OC(=O)C1CC1	ZINC000776018912	1304080964	/nfs/dbraw/zinc/08/09/64/1304080964.db2.gz	KQBKUXMJJCCNLF-UHFFFAOYSA-N	0	3	336.391	3.172	20	30		EGEDHN
C[C@H](NCc1ccccc1Cn1cncn1)c1ccc(OCC#N)cc1	ZINC000776154759	1304102388	/nfs/dbraw/zinc/10/23/88/1304102388.db2.gz	WBYXWLAAJACEGM-INIZCTEOSA-N	0	3	347.422	3.080	20	30		EGEDHN
C=CC[C@@H](CO)C[NH2+][C@H](C)c1cc(Br)cc(C)c1[O-]	ZINC000779040726	1304521930	/nfs/dbraw/zinc/52/19/30/1304521930.db2.gz	KNRPOGGGOMLAKF-VXGBXAGGSA-N	0	3	328.250	3.298	20	30		EGEDHN
COc1ccc(C(C)=NNc2ccncc2)cc1CN1CCCCC1	ZINC000779812638	1304608626	/nfs/dbraw/zinc/60/86/26/1304608626.db2.gz	VSBMGXVGGJOVJP-UHFFFAOYSA-N	0	3	338.455	3.334	20	30		EGEDHN
C#CCCCCCC(=O)NC1CCN([C@@H](C)c2ccncc2)CC1	ZINC000780659397	1304721890	/nfs/dbraw/zinc/72/18/90/1304721890.db2.gz	UHOAFWWSMNNUAB-KRWDZBQOSA-N	0	3	327.472	3.307	20	30		EGEDHN
CC[C@@H](C#N)OC(=O)C1CCN(c2cc(Cl)ccc2Cl)C1=O	ZINC000781167728	1304782383	/nfs/dbraw/zinc/78/23/83/1304782383.db2.gz	RJSYDXQIEJNXFT-WDEREUQCSA-N	0	3	341.194	3.192	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N1CC[C@H](N2CC(=O)Nc3ccccc32)C1	ZINC000782194138	1304928421	/nfs/dbraw/zinc/92/84/21/1304928421.db2.gz	LLWXAPXULUCVGZ-QAPCUYQASA-N	0	3	346.434	3.152	20	30		EGEDHN
CC(=O)N[C@@H](CC(C)C)C(=O)C(C#N)c1nc2cc(F)ccc2s1	ZINC000783379343	1305084723	/nfs/dbraw/zinc/08/47/23/1305084723.db2.gz	SVIJEIXBGGMEAA-JSGCOSHPSA-N	0	3	347.415	3.162	20	30		EGEDHN
N#CCOc1ccc(CN2CC[C@@H](Oc3cccc(F)c3)C2)cc1	ZINC000784484510	1305249993	/nfs/dbraw/zinc/24/99/93/1305249993.db2.gz	LOGHWNWPBZAYNU-LJQANCHMSA-N	0	3	326.371	3.381	20	30		EGEDHN
C[C@@H]1CC[C@H](CCC(=O)C(C#N)C(=O)NCc2cccc(Cl)c2)O1	ZINC000786541863	1305594044	/nfs/dbraw/zinc/59/40/44/1305594044.db2.gz	WYLXVORVQRSCEM-WQVCFCJDSA-N	0	3	348.830	3.013	20	30		EGEDHN
C[C@@H](N[C@H](C)c1ccc(N2CCNC2=O)cc1)c1ccc(C#N)cc1	ZINC000786808805	1305633986	/nfs/dbraw/zinc/63/39/86/1305633986.db2.gz	FWCPIHQDXYLHJY-HUUCEWRRSA-N	0	3	334.423	3.500	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)[C@H]1CCCCS1)c1ccccc1	ZINC000787046200	1305683004	/nfs/dbraw/zinc/68/30/04/1305683004.db2.gz	PPYZWBLBDYEAEY-OWCLPIDISA-N	0	3	330.453	3.248	20	30		EGEDHN
COc1ccc(C(C)=NOC[C@@H]2CCOC2)cc1CN1CCCC1	ZINC000788028862	1305848762	/nfs/dbraw/zinc/84/87/62/1305848762.db2.gz	CACNWKVKBFXANT-MRXNPFEDSA-N	0	3	332.444	3.068	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]\Cc2cccn(CC)c2=O)c([O-])c1	ZINC000788319752	1305921340	/nfs/dbraw/zinc/92/13/40/1305921340.db2.gz	WYNNIJLLVUEDDP-MOSHPQCFSA-N	0	3	327.428	3.039	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2csc(C(C)(C)C)n2)C1	ZINC001020753087	1317905730	/nfs/dbraw/zinc/90/57/30/1317905730.db2.gz	MIIDWCMQMXVCIH-XYPYZODXSA-N	0	3	327.881	3.044	20	30		EGEDHN
C=CCC1(O)CCN(Cc2ccc(OC)c(OCCCC#N)c2)CC1	ZINC000895835804	1309545385	/nfs/dbraw/zinc/54/53/85/1309545385.db2.gz	PSLGJKDPOCCSMJ-UHFFFAOYSA-N	0	3	344.455	3.281	20	30		EGEDHN
C[C@H](Cn1ccc2ccccc21)C(=O)C(C#N)C(=O)NC1CCCC1	ZINC000796805462	1310090727	/nfs/dbraw/zinc/09/07/27/1310090727.db2.gz	ZNMTYGWEBLUHSE-PBHICJAKSA-N	0	3	337.423	3.045	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)[C@@H]1CCC(F)(F)C1)c1ccccc1	ZINC000796894863	1310106739	/nfs/dbraw/zinc/10/67/39/1310106739.db2.gz	ZMJHAEZPVROUMZ-KFWWJZLASA-N	0	3	334.366	3.398	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](CN(C)Cc3cccnc3)C2)CC1	ZINC000897480438	1310348192	/nfs/dbraw/zinc/34/81/92/1310348192.db2.gz	AAOQEUYTZRJBGO-SFHVURJKSA-N	0	3	327.472	3.108	20	30		EGEDHN
Cc1cccc(CN(CCN(C)C)C(=O)c2ccc(C)c(C#N)c2)c1	ZINC000799332622	1310526498	/nfs/dbraw/zinc/52/64/98/1310526498.db2.gz	KIOQBLFLUWWXJZ-UHFFFAOYSA-N	0	3	335.451	3.379	20	30		EGEDHN
CN(C1CCCC1)C(C)(C)C(=O)OCCCC1(C#N)CCOCC1	ZINC000800194466	1310698363	/nfs/dbraw/zinc/69/83/63/1310698363.db2.gz	YWIWOXSUVQUHPR-UHFFFAOYSA-N	0	3	336.476	3.283	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2c(Cl)cccc2Cl)C1	ZINC001023719986	1319857782	/nfs/dbraw/zinc/85/77/82/1319857782.db2.gz	KAEMTPCNEYGWJZ-CYBMUJFWSA-N	0	3	339.266	3.459	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc(C(C)(F)F)cc2)C1	ZINC001023781736	1319931164	/nfs/dbraw/zinc/93/11/64/1319931164.db2.gz	SYWQFYPNIUVAQG-OAHLLOKOSA-N	0	3	334.410	3.263	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000822262098	1320065342	/nfs/dbraw/zinc/06/53/42/1320065342.db2.gz	UYPUCIBXVJRMDR-FQEVSTJZSA-N	0	3	348.446	3.093	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N(CCC)[C@H](C)c1ccccc1OC	ZINC000836489407	1320494157	/nfs/dbraw/zinc/49/41/57/1320494157.db2.gz	ZRHSVGQCAXQFIG-QGZVFWFLSA-N	0	3	345.487	3.133	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)c(C)s1	ZINC001019104709	1317046720	/nfs/dbraw/zinc/04/67/20/1317046720.db2.gz	DNNORCBTSWDVJI-ZDUSSCGKSA-N	0	3	345.493	3.302	20	30		EGEDHN
C=CCOc1c(Cl)cc(CNC[C@@H](O)c2ccco2)cc1OC	ZINC000858092348	1328680190	/nfs/dbraw/zinc/68/01/90/1328680190.db2.gz	CRBZVGXENKMQAW-CQSZACIVSA-N	0	3	337.803	3.330	20	30		EGEDHN
Cc1ccc(C(=O)/C=C/C(=O)N(C)C2CCN(C(C)C)CC2)cc1	ZINC000900080174	1317232320	/nfs/dbraw/zinc/23/23/20/1317232320.db2.gz	FFOLGDYHUCFYQD-MDZDMXLPSA-N	0	3	328.456	3.065	20	30		EGEDHN
C/C(=C(\F)C(=O)N(CCN(C)C)Cc1cccc(C#N)c1)C1CC1	ZINC000900419829	1317286351	/nfs/dbraw/zinc/28/63/51/1317286351.db2.gz	ZJCNWBYAZJKYAM-NBVRZTHBSA-N	0	3	329.419	3.102	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)C3CCC=CCC3)C2)cc1F	ZINC001019787277	1317420138	/nfs/dbraw/zinc/42/01/38/1317420138.db2.gz	GSGGOBLWOSHYNY-SFHVURJKSA-N	0	3	341.430	3.134	20	30		EGEDHN
CCN(Cc1ccccc1C#N)CC1CCN(C(=O)[C@@H]2C[C@H]2C)CC1	ZINC000957670486	1317541565	/nfs/dbraw/zinc/54/15/65/1317541565.db2.gz	UWNYFCGNOPLQKI-OXQOHEQNSA-N	0	3	339.483	3.275	20	30		EGEDHN
Cc1sccc1C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001020130776	1317554190	/nfs/dbraw/zinc/55/41/90/1317554190.db2.gz	IUIAYPQWUKLNHQ-SHTZXODSSA-N	0	3	343.427	3.118	20	30		EGEDHN
C[C@]1(C(=O)N[C@H]2C[C@H](NCc3ccc(C#N)cc3F)C2)CC=CCC1	ZINC001020193132	1317587585	/nfs/dbraw/zinc/58/75/85/1317587585.db2.gz	JIYVMFGWUULALD-ZWOKBUDYSA-N	0	3	341.430	3.181	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC(CN(CC)Cc2cnoc2C)CC1	ZINC000957737530	1317602063	/nfs/dbraw/zinc/60/20/63/1317602063.db2.gz	LUVNPSVMMUZCSQ-UHFFFAOYSA-N	0	3	333.476	3.256	20	30		EGEDHN
CN(C)CCN1c2ccccc2C(=NNc2ccc(Cl)cc2)C1=O	ZINC000807942907	1317602717	/nfs/dbraw/zinc/60/27/17/1317602717.db2.gz	YTEDMOQVKNIFKS-UHFFFAOYSA-N	0	3	342.830	3.064	20	30		EGEDHN
C#CCOc1ccccc1CNC[C@H](OC)c1cccc(OC)c1	ZINC000858204098	1328710311	/nfs/dbraw/zinc/71/03/11/1328710311.db2.gz	GLLACTAORZKSNV-FQEVSTJZSA-N	0	3	325.408	3.185	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC(CN(CC)Cc2cncn2C)CC1	ZINC000957749510	1317616031	/nfs/dbraw/zinc/61/60/31/1317616031.db2.gz	KQAPOLKKLUIBKM-HXUWFJFHSA-N	0	3	346.519	3.083	20	30		EGEDHN
C#C[C@H](NC(=O)NC[C@@H](c1ccccc1)N1CCCC1)C(C)(C)C	ZINC000808316678	1317661135	/nfs/dbraw/zinc/66/11/35/1317661135.db2.gz	VZZMTMWMOMTNBE-ROUUACIJSA-N	0	3	327.472	3.171	20	30		EGEDHN
C[C@@H]1CCCC[C@@H]1C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001020525913	1317745834	/nfs/dbraw/zinc/74/58/34/1317745834.db2.gz	NHRIOOLMCJNISU-PILAGYSTSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@H](NCc3cccc(C(C)C)n3)C2)C1	ZINC001020562775	1317774525	/nfs/dbraw/zinc/77/45/25/1317774525.db2.gz	OQLPGJVVPZMGDO-QAQDUYKDSA-N	0	3	327.472	3.298	20	30		EGEDHN
C#C[C@@H](C)NCc1ccc(OCc2ccc([N+](=O)[O-])cc2)c(OC)c1	ZINC000809683736	1317862173	/nfs/dbraw/zinc/86/21/73/1317862173.db2.gz	MKOXCYFLUCKZEC-CQSZACIVSA-N	0	3	340.379	3.294	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2)C1	ZINC001020712046	1317880920	/nfs/dbraw/zinc/88/09/20/1317880920.db2.gz	WJUHNNNDKIPLMP-YHUYYLMFSA-N	0	3	339.266	3.433	20	30		EGEDHN
CC1/C(=C/c2cccc(C(=O)OC(C)(C)C)c2)C(=O)c2ncnn21	ZINC000905083804	1317921906	/nfs/dbraw/zinc/92/19/06/1317921906.db2.gz	FOTVPWMCQAPCRT-HOXUKUGESA-N	0	3	325.368	3.074	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1	ZINC000810192182	1317972569	/nfs/dbraw/zinc/97/25/69/1317972569.db2.gz	LIGXYPDRRBSHNJ-UWJYYQICSA-N	0	3	332.447	3.162	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@H](N[C@@H]1CCCN(Cc3ccccc3)C1=O)CC2	ZINC000810229021	1317981140	/nfs/dbraw/zinc/98/11/40/1317981140.db2.gz	QCUGDZGZNNBGFB-NHCUHLMSSA-N	0	3	345.446	3.326	20	30		EGEDHN
CCc1cccc(CC)c1NC(=O)C(C#N)C(=O)c1cccc(C#N)n1	ZINC000810529389	1318018410	/nfs/dbraw/zinc/01/84/10/1318018410.db2.gz	FRRZOSOCSJQAAJ-MRXNPFEDSA-N	0	3	346.390	3.039	20	30		EGEDHN
N#CC(C(=O)Cc1cccc(Cl)c1F)C(=O)NC1CCCCC1	ZINC000810529932	1318018447	/nfs/dbraw/zinc/01/84/47/1318018447.db2.gz	RLRILOWWUOKGKK-CYBMUJFWSA-N	0	3	336.794	3.179	20	30		EGEDHN
CCc1cccc(CC)c1NC(=O)C(C#N)C(=O)c1cccc(C#N)n1	ZINC000810529388	1318018596	/nfs/dbraw/zinc/01/85/96/1318018596.db2.gz	FRRZOSOCSJQAAJ-INIZCTEOSA-N	0	3	346.390	3.039	20	30		EGEDHN
COC(=O)c1cccc(CC(=O)C(C#N)c2nc3ccccc3o2)c1	ZINC000810537230	1318018826	/nfs/dbraw/zinc/01/88/26/1318018826.db2.gz	ZOKGLQCQSBKAQQ-CQSZACIVSA-N	0	3	334.331	3.033	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)C[C@@H]2CCc3ccccc3C2)C1	ZINC001020976655	1318026962	/nfs/dbraw/zinc/02/69/62/1318026962.db2.gz	IANAVMOHNINYKX-ZTFGCOKTSA-N	0	3	332.875	3.171	20	30		EGEDHN
C#CC[C@@H](CCOC)NCc1ccc(Br)c(F)c1F	ZINC000858334265	1328739160	/nfs/dbraw/zinc/73/91/60/1328739160.db2.gz	KRYOIGDIAHPRIA-NSHDSACASA-N	0	3	332.188	3.245	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)C2(c3cc(C)cc(C)c3)CC2)C1	ZINC001021057265	1318061925	/nfs/dbraw/zinc/06/19/25/1318061925.db2.gz	NGXFNZGIYXYMRE-QAQDUYKDSA-N	0	3	332.875	3.324	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2coc(C3CCCCC3)n2)C1	ZINC001021115339	1318098977	/nfs/dbraw/zinc/09/89/77/1318098977.db2.gz	LULUYOPDIPDPET-HDJSIYSDSA-N	0	3	337.851	3.325	20	30		EGEDHN
N#Cc1ccc(CN2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)[C@@H]2CCCC3(CC3)C2)cc1	ZINC000959874065	1318244123	/nfs/dbraw/zinc/24/41/23/1318244123.db2.gz	RSSNUHCIXDCMJO-ZRNYENFQSA-N	0	3	349.478	3.075	20	30		EGEDHN
C/C(=C\C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)s1)C1CC1	ZINC000959898193	1318256299	/nfs/dbraw/zinc/25/62/99/1318256299.db2.gz	GAJCLDBYINFSPU-DKGMDFAASA-N	0	3	343.496	3.447	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)C2CC=CC2)s1	ZINC000959935539	1318274485	/nfs/dbraw/zinc/27/44/85/1318274485.db2.gz	ZYDQPQKDUUUYJX-HNNXBMFYSA-N	0	3	329.469	3.057	20	30		EGEDHN
C#C[C@@H](NC(=O)NC1CCN(CC(=C)C)CC1)c1ccc(Cl)cc1	ZINC000811876333	1318283919	/nfs/dbraw/zinc/28/39/19/1318283919.db2.gz	OBAYLYOGFOXRKY-GOSISDBHSA-N	0	3	345.874	3.354	20	30		EGEDHN
CC(C)(F)C(=O)N1CCC[C@H]2CN(Cc3ccc(C#N)cc3)CC[C@H]21	ZINC001021497474	1318304227	/nfs/dbraw/zinc/30/42/27/1318304227.db2.gz	XXTBREMNRRFMPG-ZWKOTPCHSA-N	0	3	343.446	3.119	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@H]2CN(Cc3ccc(C#N)cc3)CC[C@H]21	ZINC001021507617	1318323262	/nfs/dbraw/zinc/32/32/62/1318323262.db2.gz	ZTELHIHCZUKIEU-VQTJNVASSA-N	0	3	339.483	3.417	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1c(Cl)cccc1C(F)(F)F	ZINC000908437807	1318343538	/nfs/dbraw/zinc/34/35/38/1318343538.db2.gz	TYHYECLDPDOTBQ-UHFFFAOYSA-N	0	3	332.753	3.044	20	30		EGEDHN
COc1ccc(C(C)=NOCCOC(C)C)cc1CN1CCCC1	ZINC000812239154	1318349287	/nfs/dbraw/zinc/34/92/87/1318349287.db2.gz	NSKSZPVTKGUDAM-UHFFFAOYSA-N	0	3	334.460	3.457	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@@H](CCCN3C(=O)/C=C\C3CC3)C2)c1	ZINC001021542563	1318381227	/nfs/dbraw/zinc/38/12/27/1318381227.db2.gz	UYQSLQJMCSVPLD-BRYSGOQDSA-N	0	3	349.478	3.337	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1[nH]ccc1C1CC1	ZINC000960271274	1318437197	/nfs/dbraw/zinc/43/71/97/1318437197.db2.gz	OJILDFXQJSYLQJ-RTBURBONSA-N	0	3	335.451	3.454	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc3occc3c2)C1	ZINC001021594764	1318439421	/nfs/dbraw/zinc/43/94/21/1318439421.db2.gz	PRVOBTCAFQLLHN-MOPGFXCFSA-N	0	3	336.435	3.383	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1coc(C(F)F)c1	ZINC000960299253	1318450883	/nfs/dbraw/zinc/45/08/83/1318450883.db2.gz	HAOXGIIZYLPFLN-GDBMZVCRSA-N	0	3	332.350	3.389	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1oc(C2CC2)nc1C	ZINC000960312966	1318455965	/nfs/dbraw/zinc/45/59/65/1318455965.db2.gz	IPRKCAPWHZVLMI-IAGOWNOFSA-N	0	3	337.423	3.032	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc2ccccn2c1	ZINC000960312313	1318456055	/nfs/dbraw/zinc/45/60/55/1318456055.db2.gz	KFCZXRXHZBQQQA-WOJBJXKFSA-N	0	3	331.419	3.111	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ncoc1C1CC1	ZINC000960324801	1318461604	/nfs/dbraw/zinc/46/16/04/1318461604.db2.gz	SSHUFTGYGFOLCA-IAGOWNOFSA-N	0	3	337.423	3.114	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@@H](C)n1c(C)ccc1C	ZINC000960335252	1318468541	/nfs/dbraw/zinc/46/85/41/1318468541.db2.gz	WAEZYLLYAFOTGI-NSISKUIASA-N	0	3	337.467	3.224	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cn(CC)c3ccccc23)C1	ZINC001021628016	1318480452	/nfs/dbraw/zinc/48/04/52/1318480452.db2.gz	RRKMHOKZDIVNHQ-YLJYHZDGSA-N	0	3	349.478	3.221	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)CCc2ccc3[nH]ccc3c2)C1	ZINC001021636379	1318492052	/nfs/dbraw/zinc/49/20/52/1318492052.db2.gz	PYAIBZHOFPZIAN-PZJWPPBQSA-N	0	3	349.478	3.047	20	30		EGEDHN
COC[C@H](C)[C@@H](C)C(=O)C(C#N)C(=O)Nc1cccc2ccccc21	ZINC000813059517	1318493009	/nfs/dbraw/zinc/49/30/09/1318493009.db2.gz	BBYNRRHVPNNEKK-JJRVBVJISA-N	0	3	338.407	3.406	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)C[C@H]1C=CCC1	ZINC000960397810	1318525024	/nfs/dbraw/zinc/52/50/24/1318525024.db2.gz	HPKLKQZMGOIQOX-FXAWDEMLSA-N	0	3	337.467	3.337	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc3occc3s2)C1	ZINC001021667007	1318530242	/nfs/dbraw/zinc/53/02/42/1318530242.db2.gz	FECUGYOORVYEIG-KGLIPLIRSA-N	0	3	328.437	3.054	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)[C@H]1CC=CCC1	ZINC000960421293	1318544901	/nfs/dbraw/zinc/54/49/01/1318544901.db2.gz	VHYGJLYXTYXRTM-VQTJNVASSA-N	0	3	337.467	3.337	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H](CCCN2C(=O)c2noc3c2CCCCC3)C1	ZINC001021677358	1318546395	/nfs/dbraw/zinc/54/63/95/1318546395.db2.gz	HTADHGSKQYQGKW-WBVHZDCISA-N	0	3	343.471	3.056	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(Cl)c(F)c2)C1	ZINC001021678360	1318547806	/nfs/dbraw/zinc/54/78/06/1318547806.db2.gz	XHWLQPACKHECHT-YJBOKZPZSA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(F)cc2C)C1	ZINC001021718765	1318600910	/nfs/dbraw/zinc/60/09/10/1318600910.db2.gz	JNXSIAOWFMNGGE-VQIMIIECSA-N	0	3	328.431	3.084	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC[C@@H]1CN(C)Cc1ccc(C(F)F)cc1	ZINC000960503164	1318610442	/nfs/dbraw/zinc/61/04/42/1318610442.db2.gz	PMDSHJMIIGHBFH-XJKSGUPXSA-N	0	3	335.398	3.207	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc3[nH]ccc3s2)C1	ZINC001021723603	1318612860	/nfs/dbraw/zinc/61/28/60/1318612860.db2.gz	VMOPJOFSHCJTNI-ZBFHGGJFSA-N	0	3	341.480	3.179	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(F)cc2Cl)C1	ZINC001021727213	1318623293	/nfs/dbraw/zinc/62/32/93/1318623293.db2.gz	KKPANVBGWDYBPL-KBXCAEBGSA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2oc3ccccc3c2C)C1	ZINC001021729032	1318628706	/nfs/dbraw/zinc/62/87/06/1318628706.db2.gz	XIESEVUJHVWCKR-FUHWJXTLSA-N	0	3	336.435	3.301	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)Cc2ccc3ccccc3c2)C1	ZINC001021730718	1318632053	/nfs/dbraw/zinc/63/20/53/1318632053.db2.gz	PWTMFHVNSWXPQZ-VXKWHMMOSA-N	0	3	346.474	3.328	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2sccc2CC)C1	ZINC001021738593	1318646865	/nfs/dbraw/zinc/64/68/65/1318646865.db2.gz	APUNPNODPINDQY-IAGOWNOFSA-N	0	3	330.497	3.260	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc3cccc(F)c3o2)C1	ZINC001021740981	1318653075	/nfs/dbraw/zinc/65/30/75/1318653075.db2.gz	XTUNATGCWFYFMA-WBVHZDCISA-N	0	3	340.398	3.132	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc3c(cccc3C)o2)C1	ZINC001021746991	1318664135	/nfs/dbraw/zinc/66/41/35/1318664135.db2.gz	RUROEXGFXHDCES-AEFFLSMTSA-N	0	3	336.435	3.301	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H]2C[C@@H](NCc3ccc(C#N)cc3F)C2)s1	ZINC001021783280	1318681027	/nfs/dbraw/zinc/68/10/27/1318681027.db2.gz	HSAZHKZRZJSBHG-GASCZTMLSA-N	0	3	343.427	3.118	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@@H](NC(=O)CC3CCCC3)C2)c(F)c1	ZINC001021790890	1318685693	/nfs/dbraw/zinc/68/56/93/1318685693.db2.gz	RNHBRYXQOJHNOW-CALCHBBNSA-N	0	3	329.419	3.014	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)[C@@H]1CC1(C)C	ZINC000960564895	1318696275	/nfs/dbraw/zinc/69/62/75/1318696275.db2.gz	QZPKGTGMZIPNSB-ROUUACIJSA-N	0	3	325.456	3.027	20	30		EGEDHN
Cc1cc(C(=O)N2CCC[C@H]2CN(C)Cc2cccc(C#N)c2)co1	ZINC000960592343	1318721484	/nfs/dbraw/zinc/72/14/84/1318721484.db2.gz	VEARKHHOCDUTSG-IBGZPJMESA-N	0	3	337.423	3.196	20	30		EGEDHN
C[C@H](c1ccc(F)c(F)c1)N(C)C[C@H]1CCCN1C(=O)C#CC1CC1	ZINC000960614325	1318741175	/nfs/dbraw/zinc/74/11/75/1318741175.db2.gz	QLVMTDGTKMQPSA-RHSMWYFYSA-N	0	3	346.421	3.362	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)Cc2coc3ccc(C)cc23)C1	ZINC001022152351	1318821774	/nfs/dbraw/zinc/82/17/74/1318821774.db2.gz	XXSGASOHRDAFCH-GASCZTMLSA-N	0	3	332.831	3.273	20	30		EGEDHN
C=CCC(F)(F)C(=O)N(CCN(C)C)Cc1ccc(F)cc1F	ZINC000815138183	1318906637	/nfs/dbraw/zinc/90/66/37/1318906637.db2.gz	GLFIOOLWBBJEHO-UHFFFAOYSA-N	0	3	332.341	3.066	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2scnc2C2CCCC2)C1	ZINC001022376116	1318911051	/nfs/dbraw/zinc/91/10/51/1318911051.db2.gz	PZZUQZGEUJHJON-BETUJISGSA-N	0	3	339.892	3.404	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccccc2-n2cccc2)C1	ZINC001022643665	1319035386	/nfs/dbraw/zinc/03/53/86/1319035386.db2.gz	SXGXCJZRIOWWJM-GASCZTMLSA-N	0	3	329.831	3.080	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc(F)c(Cl)c2F)C1	ZINC001022648698	1319041270	/nfs/dbraw/zinc/04/12/70/1319041270.db2.gz	OOKGXOABAIDGTQ-DTORHVGOSA-N	0	3	335.181	3.221	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@@]2(c3ccccc3)CC2(C)C)C1	ZINC001022880149	1319147879	/nfs/dbraw/zinc/14/78/79/1319147879.db2.gz	IYKGJTGHGJUHBH-FCEWJHQRSA-N	0	3	332.875	3.344	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@]2(CC)C(C)C)C1	ZINC001022913776	1319164375	/nfs/dbraw/zinc/16/43/75/1319164375.db2.gz	RUXOXTHUCJWINC-KNCOVGOOSA-N	0	3	343.309	3.204	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2)C1	ZINC001023011125	1319217706	/nfs/dbraw/zinc/21/77/06/1319217706.db2.gz	ZGWUTRQNJFJVOR-BETUJISGSA-N	0	3	332.753	3.308	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@@H]([C@@H]2CCN(CC#Cc3ccccc3)C2)C1	ZINC000961149281	1319270083	/nfs/dbraw/zinc/27/00/83/1319270083.db2.gz	WEQAFMAKQRVTCJ-NHCUHLMSSA-N	0	3	338.495	3.255	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)C2CCC(C)(C)CC2)C1	ZINC001023141155	1319283505	/nfs/dbraw/zinc/28/35/05/1319283505.db2.gz	VLEIZWUGJWAIRD-OKILXGFUSA-N	0	3	343.309	3.348	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H](CNC(=O)c3ccsc3)C2)cc1	ZINC001023218948	1319353313	/nfs/dbraw/zinc/35/33/13/1319353313.db2.gz	GQSDQWVBFIOJNK-QGZVFWFLSA-N	0	3	339.464	3.262	20	30		EGEDHN
C[NH+](C)C1CCC(/N=C\c2cc(Br)ccc2[O-])CC1	ZINC000817708140	1319426741	/nfs/dbraw/zinc/42/67/41/1319426741.db2.gz	UMYAFIMDUPYCNM-YVLHZVERSA-N	0	3	325.250	3.446	20	30		EGEDHN
C#Cc1cccc(NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)c1	ZINC000915339376	1319470359	/nfs/dbraw/zinc/47/03/59/1319470359.db2.gz	NWEBRRXJCGOVJS-FQEVSTJZSA-N	0	3	333.435	3.454	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](C2CCN(C(=O)c3ccn(C)c3)CC2)C1	ZINC000961347964	1319503817	/nfs/dbraw/zinc/50/38/17/1319503817.db2.gz	BXXOPKLMTAPXJO-KRWDZBQOSA-N	0	3	349.906	3.342	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](C2CCN(C(=O)C#CC3CC3)CC2)C1	ZINC000961363873	1319521214	/nfs/dbraw/zinc/52/12/14/1319521214.db2.gz	CBVIFGTVXUFAMR-SFHVURJKSA-N	0	3	334.891	3.103	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](C2CCN(C(=O)[C@H](F)CC)CC2)C1	ZINC000961400382	1319555206	/nfs/dbraw/zinc/55/52/06/1319555206.db2.gz	IZGLJCMPIXFLKI-JKSUJKDBSA-N	0	3	330.875	3.438	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1csc(-c2cccc(Cl)c2)n1	ZINC000818588730	1319564163	/nfs/dbraw/zinc/56/41/63/1319564163.db2.gz	FFMZKBBKCRUBGY-UHFFFAOYSA-N	0	3	347.871	3.148	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1ccc(Cl)c(C(F)(F)F)c1	ZINC000818611883	1319569871	/nfs/dbraw/zinc/56/98/71/1319569871.db2.gz	HBPPTWFNCFRFCB-UHFFFAOYSA-N	0	3	332.753	3.044	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2[C@H]3CN([C@H](C)c4ccc(F)cc4)C[C@H]32)cc1	ZINC000961427710	1319582171	/nfs/dbraw/zinc/58/21/71/1319582171.db2.gz	BSJPXUJYXKEGCY-PLBGURBNSA-N	0	3	348.421	3.228	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CNCc2cccc(NC(=O)C3CCC3)c2)cc1	ZINC000818952320	1319587853	/nfs/dbraw/zinc/58/78/53/1319587853.db2.gz	JHMLCFSSUGJKGF-FQEVSTJZSA-N	0	3	349.434	3.120	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc(C)c(Cl)c2F)C1	ZINC001023507172	1319615657	/nfs/dbraw/zinc/61/56/57/1319615657.db2.gz	PJJGKMKNHUEAMZ-CQSZACIVSA-N	0	3	336.838	3.253	20	30		EGEDHN
COc1ccc(OC)c([C@H](O)CNCc2ccc(C#N)c(Cl)c2)c1	ZINC000819294685	1319691910	/nfs/dbraw/zinc/69/19/10/1319691910.db2.gz	ILIVBDYHBVAPLM-QGZVFWFLSA-N	0	3	346.814	3.052	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2[C@H]3CN([C@@H](C)c4cccc(OC)c4)C[C@H]32)C1	ZINC000961735891	1319718508	/nfs/dbraw/zinc/71/85/08/1319718508.db2.gz	UPAFFGGTXVESQD-WQANXHIZSA-N	0	3	340.467	3.159	20	30		EGEDHN
Cc1ccc(OCC(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)cc1	ZINC000916884027	1319720634	/nfs/dbraw/zinc/72/06/34/1319720634.db2.gz	YKFPHCYXIHZPPO-MRXNPFEDSA-N	0	3	342.782	3.375	20	30		EGEDHN
CCCc1cc(C(=O)C(C#N)C(=O)Nc2ccc(F)c(Cl)c2)n[nH]1	ZINC000916939545	1319725581	/nfs/dbraw/zinc/72/55/81/1319725581.db2.gz	PLELBFLHFFCGKG-NSHDSACASA-N	0	3	348.765	3.116	20	30		EGEDHN
C#CCN1CCC[C@H](CNC(=O)c2cc(Cl)ccc2Cl)C1	ZINC001023718372	1319853726	/nfs/dbraw/zinc/85/37/26/1319853726.db2.gz	ROKMUGXSDOYZPZ-GFCCVEGCSA-N	0	3	325.239	3.068	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2c3ccccc3oc2CC)C1	ZINC001023764581	1319914276	/nfs/dbraw/zinc/91/42/76/1319914276.db2.gz	MHKBQDLMHAJUMF-INIZCTEOSA-N	0	3	338.451	3.460	20	30		EGEDHN
Cc1ccc(C(=O)N2c3ccccc3CC[C@H]2CN(C)C)cc1C#N	ZINC000823906209	1320216083	/nfs/dbraw/zinc/21/60/83/1320216083.db2.gz	VVNPHSUIDBBELZ-IBGZPJMESA-N	0	3	333.435	3.390	20	30		EGEDHN
CCCCCCCCCC(=O)N1CCC(N2CCN(C)CC2)CC1	ZINC000827468695	1320455867	/nfs/dbraw/zinc/45/58/67/1320455867.db2.gz	ZRDBZEKEIGNKTO-UHFFFAOYSA-N	0	3	337.552	3.366	20	30		EGEDHN
C#Cc1cccc(CNC(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)c1	ZINC000838586064	1320792848	/nfs/dbraw/zinc/79/28/48/1320792848.db2.gz	BKXUKWUMKFFIGF-OXQOHEQNSA-N	0	3	335.451	3.159	20	30		EGEDHN
COc1ccc(CN(C)C[C@@H](O)c2ccc(C#N)cc2)cc1Cl	ZINC000839660089	1320954368	/nfs/dbraw/zinc/95/43/68/1320954368.db2.gz	BJBMTOODQPMFKS-QGZVFWFLSA-N	0	3	330.815	3.386	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]\C[C@H](O)Cc2cccc(F)c2)c([O-])c1	ZINC000840707070	1321131264	/nfs/dbraw/zinc/13/12/64/1321131264.db2.gz	NEHPAJCDQILERN-UUMRFZBWSA-N	0	3	344.430	3.400	20	30		EGEDHN
C[C@@H](NCC(C)(C)CC#N)c1ccc(S(=O)(=O)C(F)F)cc1	ZINC000840786509	1321147982	/nfs/dbraw/zinc/14/79/82/1321147982.db2.gz	QUORTOXXIYOOIX-LLVKDONJSA-N	0	3	330.400	3.273	20	30		EGEDHN
CN1CCC(NC(=S)Nc2ccc(OC(C)(C)C)c(C#N)c2)CC1	ZINC000840790227	1321148572	/nfs/dbraw/zinc/14/85/72/1321148572.db2.gz	VTTBQEUNUGJIMI-UHFFFAOYSA-N	0	3	346.500	3.116	20	30		EGEDHN
COc1cc(CN(C)CCCN(C)C(=O)OC(C)(C)C)ccc1C#N	ZINC000840972701	1321191252	/nfs/dbraw/zinc/19/12/52/1321191252.db2.gz	ROJNCUZJZBLIGP-UHFFFAOYSA-N	0	3	347.459	3.256	20	30		EGEDHN
CC[C@@H](OC1CCCC1)C(=O)C(C#N)C(=O)Nc1ccccc1OC	ZINC000842289532	1321368270	/nfs/dbraw/zinc/36/82/70/1321368270.db2.gz	QROKRELVTKJGAE-GOEBONIOSA-N	0	3	344.411	3.080	20	30		EGEDHN
N#CC(C(=O)c1ccc(N)c([N+](=O)[O-])c1)c1nc(C2CC2)cs1	ZINC000842938957	1321451181	/nfs/dbraw/zinc/45/11/81/1321451181.db2.gz	MXGUKDWZHTYGKP-SNVBAGLBSA-N	0	3	328.353	3.001	20	30		EGEDHN
C#Cc1cccc(NC(=O)N[C@@]2(C)CCN(Cc3ccccc3)C2)c1	ZINC000844497953	1321613326	/nfs/dbraw/zinc/61/33/26/1321613326.db2.gz	KGVUXCFYDXDZAK-NRFANRHFSA-N	0	3	333.435	3.454	20	30		EGEDHN
C[C@@H](COCC(=O)C(C#N)C(=O)Nc1ccccc1)c1ccccc1	ZINC000845442169	1321708177	/nfs/dbraw/zinc/70/81/77/1321708177.db2.gz	KKGKWWMJXNDULH-MAUKXSAKSA-N	0	3	336.391	3.154	20	30		EGEDHN
CC(=O)N[C@H](c1ccccc1F)[C@H](C)NCc1ccc(C#N)cc1	ZINC000924701867	1323120087	/nfs/dbraw/zinc/12/00/87/1323120087.db2.gz	SOMCMWRWULLJTF-DJJJIMSYSA-N	0	3	325.387	3.053	20	30		EGEDHN
CC1(C(=O)N2CCC[C@H](CNCc3cc(F)ccc3C#N)C2)CCC1	ZINC001024096118	1323126536	/nfs/dbraw/zinc/12/65/36/1323126536.db2.gz	BRXOZMPBZCBKSD-OAHLLOKOSA-N	0	3	343.446	3.216	20	30		EGEDHN
C#C[C@](C)(CC)NCC(=O)N[C@@H](c1cccs1)c1ccccc1	ZINC000852098197	1323145473	/nfs/dbraw/zinc/14/54/73/1323145473.db2.gz	HFKYONOAUIRPPY-RTBURBONSA-N	0	3	326.465	3.345	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H](CNCc3ccn(C(C)C)n3)C2)C1	ZINC001024145871	1323171375	/nfs/dbraw/zinc/17/13/75/1323171375.db2.gz	JHFWNQSCKCVHQF-KRWDZBQOSA-N	0	3	344.503	3.149	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H](CNCc3oc(CC)nc3C)C2)C1	ZINC001024146367	1323171788	/nfs/dbraw/zinc/17/17/88/1323171788.db2.gz	UDCSQLZUDWVXJB-INIZCTEOSA-N	0	3	345.487	3.230	20	30		EGEDHN
N#CC[C@H]1CCCN(CC(=O)C(C#N)c2nc3ccccc3s2)C1	ZINC000852319644	1323178748	/nfs/dbraw/zinc/17/87/48/1323178748.db2.gz	QTXJONRPGWJPKY-KGLIPLIRSA-N	0	3	338.436	3.098	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H](CNCc2ccccc2C#N)C1)C(C)(F)F	ZINC001024162128	1323179851	/nfs/dbraw/zinc/17/98/51/1323179851.db2.gz	ROEVMLUNYZVFNX-CABCVRRESA-N	0	3	349.425	3.178	20	30		EGEDHN
C=C(Br)CNC1CCC(N(C)C(=O)[C@@H](C)C2CC2)CC1	ZINC000963202645	1323230516	/nfs/dbraw/zinc/23/05/16/1323230516.db2.gz	NZDOOOZJKNGOPJ-GRTSSRMGSA-N	0	3	343.309	3.300	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)[C@@H]1CCCC[C@H]1C(F)(F)F	ZINC001024487604	1323440007	/nfs/dbraw/zinc/44/00/07/1323440007.db2.gz	QMURYIOERSPLEX-ARFHVFGLSA-N	0	3	344.421	3.349	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@@H]1CCc2cc(C)ccc2O1	ZINC001024553534	1323493882	/nfs/dbraw/zinc/49/38/82/1323493882.db2.gz	CFVUQBJPISPLAP-ICSRJNTNSA-N	0	3	342.483	3.235	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccc(C(F)(F)F)nc1	ZINC001024586968	1323520688	/nfs/dbraw/zinc/52/06/88/1323520688.db2.gz	WTVOQYMEFFHJJK-CQSZACIVSA-N	0	3	341.377	3.261	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccc(F)c(Cl)c1F	ZINC001024638039	1323565059	/nfs/dbraw/zinc/56/50/59/1323565059.db2.gz	RHQBEGUHNDLIIX-GFCCVEGCSA-N	0	3	340.801	3.226	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccc(C(C)C)nc1CC	ZINC001024652865	1323575098	/nfs/dbraw/zinc/57/50/98/1323575098.db2.gz	XKSJBKCXTNMEHH-QGZVFWFLSA-N	0	3	341.499	3.375	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccc(C2CC2)nc1C	ZINC001024656717	1323577300	/nfs/dbraw/zinc/57/73/00/1323577300.db2.gz	QHEOTMIIVGCOQN-QGZVFWFLSA-N	0	3	327.472	3.428	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccc(OCC)c(C)c1	ZINC001024689939	1323605336	/nfs/dbraw/zinc/60/53/36/1323605336.db2.gz	OSDSNIALYROGQF-GOSISDBHSA-N	0	3	328.456	3.001	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1cccn1C1CCCC1	ZINC001024732721	1323634494	/nfs/dbraw/zinc/63/44/94/1323634494.db2.gz	YBRIWIHMKHMZPR-GOSISDBHSA-N	0	3	327.472	3.211	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccc(C)nc1OCCC	ZINC001024733900	1323635536	/nfs/dbraw/zinc/63/55/36/1323635536.db2.gz	QCVWKHGNRFEGHT-QGZVFWFLSA-N	0	3	345.487	3.339	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCCCN2CC2=CCCCC2)cn1	ZINC001024769712	1323669115	/nfs/dbraw/zinc/66/91/15/1323669115.db2.gz	LHWXUMCVMNZHBP-HXUWFJFHSA-N	0	3	337.467	3.148	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccccc1C(F)(F)F	ZINC001024774600	1323674766	/nfs/dbraw/zinc/67/47/66/1323674766.db2.gz	RXDKCLSFKGVFIH-AWEZNQCLSA-N	0	3	338.373	3.313	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccsc1C(F)(F)F	ZINC001024778475	1323681025	/nfs/dbraw/zinc/68/10/25/1323681025.db2.gz	ZHIRTZNKKBYRQB-LBPRGKRZSA-N	0	3	344.402	3.375	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)[C@H]1CCCCc2ccccc21	ZINC001024816706	1323719434	/nfs/dbraw/zinc/71/94/34/1323719434.db2.gz	OOXJIPRQLCCWTP-FPOVZHCZSA-N	0	3	338.495	3.491	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1cscc1C(F)(F)F	ZINC001024833949	1323735637	/nfs/dbraw/zinc/73/56/37/1323735637.db2.gz	MTPSCYRHKGYNJB-GFCCVEGCSA-N	0	3	344.402	3.375	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCCC[C@@H]1CNCc1cccc(Cl)c1F	ZINC001024902699	1323772126	/nfs/dbraw/zinc/77/21/26/1323772126.db2.gz	YBAGYXPUMHYJDR-GXTWGEPZSA-N	0	3	337.826	3.109	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCCC[C@H]1CNCc1ccnc(OC)c1	ZINC001025037522	1323840177	/nfs/dbraw/zinc/84/01/77/1323840177.db2.gz	IHAKHBCAIMWFSB-KRWDZBQOSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@H]1CNCc1cccc(OCC)n1	ZINC001025040696	1323843705	/nfs/dbraw/zinc/84/37/05/1323843705.db2.gz	JLVPKVXMQBZMOQ-KRWDZBQOSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCCC[C@H]1CNCc1ccc(OC)nc1	ZINC001025069229	1323869621	/nfs/dbraw/zinc/86/96/21/1323869621.db2.gz	DVYXWMMMKHPWLJ-PXNSSMCTSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCCC[C@H]1CNCc1cncc(C)c1	ZINC001025069874	1323870565	/nfs/dbraw/zinc/87/05/65/1323870565.db2.gz	RHIDTQXBBVJYMW-AZUAARDMSA-N	0	3	329.488	3.463	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)[C@@H]2CC23CCC3)s1	ZINC001025100502	1323894621	/nfs/dbraw/zinc/89/46/21/1323894621.db2.gz	KRPNUQJQSXFISL-PBHICJAKSA-N	0	3	343.496	3.281	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccccc1F	ZINC001025190347	1323967515	/nfs/dbraw/zinc/96/75/15/1323967515.db2.gz	AXFWHBIPRBXMOT-RTBURBONSA-N	0	3	328.431	3.308	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)Cc1cccs1	ZINC001025190921	1323969050	/nfs/dbraw/zinc/96/90/50/1323969050.db2.gz	CTPVYQQTKPLKHD-ZWKOTPCHSA-N	0	3	330.497	3.159	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)CCc1ccco1	ZINC001025200617	1323984858	/nfs/dbraw/zinc/98/48/58/1323984858.db2.gz	FNZUXTMJFNSJKP-RTBURBONSA-N	0	3	328.456	3.081	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1c(C)[nH]nc1Cl	ZINC001025237700	1324027904	/nfs/dbraw/zinc/02/79/04/1324027904.db2.gz	OEDJXITWRKYGCY-KBPBESRZSA-N	0	3	336.867	3.017	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(C)c(F)cc1F	ZINC001025240119	1324035042	/nfs/dbraw/zinc/03/50/42/1324035042.db2.gz	LUVAYMPSKCINFC-RTBURBONSA-N	0	3	346.421	3.366	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)C1(C(F)(F)F)CCC1	ZINC001025246695	1324045815	/nfs/dbraw/zinc/04/58/15/1324045815.db2.gz	YWVBVQNTSZKFCR-HUUCEWRRSA-N	0	3	342.405	3.198	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)C1(C(F)(F)F)CCC1	ZINC001025246696	1324046508	/nfs/dbraw/zinc/04/65/08/1324046508.db2.gz	YWVBVQNTSZKFCR-LSDHHAIUSA-N	0	3	342.405	3.198	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccn2ccccc12	ZINC001025249359	1324049818	/nfs/dbraw/zinc/04/98/18/1324049818.db2.gz	BHKZLXLVYXHUQN-NHCUHLMSSA-N	0	3	349.478	3.422	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(C)ccc1OC	ZINC001025252563	1324057530	/nfs/dbraw/zinc/05/75/30/1324057530.db2.gz	XYERBQRXKHPHNE-RBUKOAKNSA-N	0	3	340.467	3.096	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc(C)c(C)n1	ZINC001025252719	1324058181	/nfs/dbraw/zinc/05/81/81/1324058181.db2.gz	QIGJIGAIMBIZSI-VQTJNVASSA-N	0	3	339.483	3.181	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)CCc1cccc(C)c1	ZINC001025254921	1324061322	/nfs/dbraw/zinc/06/13/22/1324061322.db2.gz	NFDKFZMAJLUWQM-RTWAWAEBSA-N	0	3	338.495	3.406	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(C(C)C)on1	ZINC001025254908	1324061536	/nfs/dbraw/zinc/06/15/36/1324061536.db2.gz	NBNWNWUNAHHJAW-QZTJIDSGSA-N	0	3	343.471	3.280	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc2ccsc2[nH]1	ZINC001025256688	1324064980	/nfs/dbraw/zinc/06/49/80/1324064980.db2.gz	ZIOPPCIZRKOUQL-DLBZAZTESA-N	0	3	341.480	3.322	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc[nH]c1CCC	ZINC001025264323	1324075716	/nfs/dbraw/zinc/07/57/16/1324075716.db2.gz	ZLCPFHJRTFUSLZ-UXHICEINSA-N	0	3	341.499	3.450	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc(C)cc1F	ZINC001025274302	1324091676	/nfs/dbraw/zinc/09/16/76/1324091676.db2.gz	WLJRETMWNNMXCI-OALUTQOASA-N	0	3	328.431	3.226	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccn(C(C)C)n1	ZINC001025275686	1324097269	/nfs/dbraw/zinc/09/72/69/1324097269.db2.gz	YJBDJOHYXAHXSP-ZWKOTPCHSA-N	0	3	330.476	3.109	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ncoc1C(C)C	ZINC001025286886	1324108532	/nfs/dbraw/zinc/10/85/32/1324108532.db2.gz	LYAXBCPREBJVQB-IAGOWNOFSA-N	0	3	343.471	3.280	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)Cc1ccccc1Cl	ZINC001025295535	1324125125	/nfs/dbraw/zinc/12/51/25/1324125125.db2.gz	HFAPRGDWDAXEAH-RTBURBONSA-N	0	3	344.886	3.361	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cccn1C(C)C	ZINC001025297625	1324130940	/nfs/dbraw/zinc/13/09/40/1324130940.db2.gz	ZCRZXZWZLDGXOQ-ROUUACIJSA-N	0	3	327.472	3.161	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1c(C)nsc1C	ZINC001025300093	1324133219	/nfs/dbraw/zinc/13/32/19/1324133219.db2.gz	BGGVUPOQHOAIPI-IRXDYDNUSA-N	0	3	345.512	3.242	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)CC(C1CC1)C1CC1	ZINC001025301550	1324135030	/nfs/dbraw/zinc/13/50/30/1324135030.db2.gz	LRIGGMATADOJAV-VQTJNVASSA-N	0	3	328.500	3.291	20	30		EGEDHN
C[C@H](NC(=O)C1CCC1)[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001025316142	1324150658	/nfs/dbraw/zinc/15/06/58/1324150658.db2.gz	ISDYMVFSNJPWLV-HNAYVOBHSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc3c(o2)CCCC3)C1	ZINC001025438763	1324277550	/nfs/dbraw/zinc/27/75/50/1324277550.db2.gz	IBFHHHOKSJLZGJ-NVXWUHKLSA-N	0	3	328.456	3.012	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(C)c(F)cc2F)C1	ZINC001025455910	1324295740	/nfs/dbraw/zinc/29/57/40/1324295740.db2.gz	MZXNZWGSXFEIOE-LSDHHAIUSA-N	0	3	334.410	3.127	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cccc3ccc(C)nc32)C1	ZINC001025457277	1324298027	/nfs/dbraw/zinc/29/80/27/1324298027.db2.gz	ULCFVTZVWLROOM-WMZOPIPTSA-N	0	3	335.451	3.007	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cccc3c(C)c(C)[nH]c32)C1	ZINC001025459825	1324304895	/nfs/dbraw/zinc/30/48/95/1324304895.db2.gz	SVHHRXQQHXLQMU-IRXDYDNUSA-N	0	3	337.467	3.248	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(-n3cccc3)cc2)C1	ZINC001025474766	1324320256	/nfs/dbraw/zinc/32/02/56/1324320256.db2.gz	NRDONNRWTMLNDW-AZUAARDMSA-N	0	3	349.478	3.331	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2nc3ccccc3cc2C)C1	ZINC001025484700	1324332598	/nfs/dbraw/zinc/33/25/98/1324332598.db2.gz	HSZMRBMSGYOPCQ-HKUYNNGSSA-N	0	3	349.478	3.397	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2c(F)ccc(C)c2F)C1	ZINC001025524005	1324370744	/nfs/dbraw/zinc/37/07/44/1324370744.db2.gz	RLMNRLRETIVLFW-LSDHHAIUSA-N	0	3	334.410	3.127	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2oc(CC(C)C)nc2C)C1	ZINC001025555259	1324403260	/nfs/dbraw/zinc/40/32/60/1324403260.db2.gz	LCPFYBCXIXKQDN-NVXWUHKLSA-N	0	3	345.487	3.035	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2csc(C(C)(C)C)n2)C1	ZINC001025560261	1324407478	/nfs/dbraw/zinc/40/74/78/1324407478.db2.gz	CAXIQRHCAQEEQI-CABCVRRESA-N	0	3	347.528	3.294	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cccc(F)c2OCC)C1	ZINC001025577586	1324417410	/nfs/dbraw/zinc/41/74/10/1324417410.db2.gz	CYEFQKQMMCASSA-HZPDHXFCSA-N	0	3	346.446	3.078	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccccc2OC(C)C)C1	ZINC001025600967	1324449136	/nfs/dbraw/zinc/44/91/36/1324449136.db2.gz	PLMKWFOEMNYCJV-ROUUACIJSA-N	0	3	342.483	3.327	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2sccc2C2CC2)C1	ZINC001025611683	1324463943	/nfs/dbraw/zinc/46/39/43/1324463943.db2.gz	OBBOJZRGXOTLRK-GOEBONIOSA-N	0	3	330.497	3.479	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(OC(C)C)cc2)C1	ZINC001025614719	1324468531	/nfs/dbraw/zinc/46/85/31/1324468531.db2.gz	OIEKNQHVPFRBLI-MJGOQNOKSA-N	0	3	342.483	3.327	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(C(F)(F)F)s2)C1	ZINC001025635558	1324488407	/nfs/dbraw/zinc/48/84/07/1324488407.db2.gz	RWPTUJYGFYRIED-NEPJUHHUSA-N	0	3	344.402	3.230	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CC[C@H]2CN(C(=O)CCC3CC3)C[C@@H]21	ZINC001026222154	1324671054	/nfs/dbraw/zinc/67/10/54/1324671054.db2.gz	ZGVGCGKRCNRTIZ-SLFFLAALSA-N	0	3	337.467	3.075	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H]2CC[C@H](NCc3ncoc3C(C)C)[C@H]2C1	ZINC001026329221	1324730446	/nfs/dbraw/zinc/73/04/46/1324730446.db2.gz	AAZWYDWIKHFYRA-JYJNAYRXSA-N	0	3	345.487	3.337	20	30		EGEDHN
CC(C)(C)C(=O)N1C[C@@H]2CC[C@@H](NCc3cc(F)ccc3C#N)[C@@H]2C1	ZINC001026406143	1324778841	/nfs/dbraw/zinc/77/88/41/1324778841.db2.gz	VHEPFISXKMZSOV-BMGDILEWSA-N	0	3	343.446	3.070	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)c2coc(C)n2)C1	ZINC000963289534	1325074504	/nfs/dbraw/zinc/07/45/04/1325074504.db2.gz	JNJSCYVBXMGOLD-HOCLYGCPSA-N	0	3	337.851	3.052	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](CNCc2oc(CCC)nc2C)C1	ZINC001026988642	1325126906	/nfs/dbraw/zinc/12/69/06/1325126906.db2.gz	LSFALLXTHANBGA-MRXNPFEDSA-N	0	3	347.503	3.476	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](CNCc2nc(C)c(C)s2)C1	ZINC001026988445	1325127023	/nfs/dbraw/zinc/12/70/23/1325127023.db2.gz	GPMXAHLGFHTHMM-HNNXBMFYSA-N	0	3	335.517	3.300	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](CNCc2nc(C)c(C)s2)C1	ZINC001026988446	1325127498	/nfs/dbraw/zinc/12/74/98/1325127498.db2.gz	GPMXAHLGFHTHMM-OAHLLOKOSA-N	0	3	335.517	3.300	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](CNCc2ccn(C3CCCC3)n2)C1	ZINC001026994665	1325132035	/nfs/dbraw/zinc/13/20/35/1325132035.db2.gz	WEHOENPRHDPUDP-INIZCTEOSA-N	0	3	344.503	3.149	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)CC(C)(F)F)C1	ZINC000963355963	1325151051	/nfs/dbraw/zinc/15/10/51/1325151051.db2.gz	AEYCLJDCUOUKDY-UONOGXRCSA-N	0	3	334.838	3.487	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)c2nccs2)C1	ZINC000963374676	1325180475	/nfs/dbraw/zinc/18/04/75/1325180475.db2.gz	RRJQUWHDQJVDOU-UONOGXRCSA-N	0	3	339.892	3.212	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)[C@]23C[C@H]2CCCC3)C1	ZINC001027049696	1325187147	/nfs/dbraw/zinc/18/71/47/1325187147.db2.gz	MNMSYAPKWBSSPR-LDQXTDLNSA-N	0	3	337.467	3.077	20	30		EGEDHN
C=C[C@H](C(=O)N1CC[C@@H](CNCc2nccs2)C1)c1ccccc1	ZINC001027231331	1325326711	/nfs/dbraw/zinc/32/67/11/1325326711.db2.gz	QRSJDZQMNDNRDP-RDJZCZTQSA-N	0	3	341.480	3.051	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@@H](N(C)Cc2cc3ccccc3o2)C1	ZINC001027335256	1325495024	/nfs/dbraw/zinc/49/50/24/1325495024.db2.gz	FBEYLKALMCZRCR-GDBMZVCRSA-N	0	3	325.412	3.015	20	30		EGEDHN
CN(Cc1ccc(C#N)c(F)c1)[C@@H]1CCCN(C(=O)C2CC=CC2)C1	ZINC001027345710	1325507327	/nfs/dbraw/zinc/50/73/27/1325507327.db2.gz	UZYKDIPCAPAHFE-GOSISDBHSA-N	0	3	341.430	3.086	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)[C@H]2[C@@H]3CCC[C@@H]32)C1	ZINC001027354482	1325527282	/nfs/dbraw/zinc/52/72/82/1325527282.db2.gz	FPGXPABFYZBKGA-VNTMZGSJSA-N	0	3	337.467	3.027	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CCC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001027365052	1325555303	/nfs/dbraw/zinc/55/53/03/1325555303.db2.gz	MRRGSLAFYAXRAW-KRWDZBQOSA-N	0	3	329.419	3.244	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)/C=C\c2ccc[nH]2)C1	ZINC001027381776	1325579237	/nfs/dbraw/zinc/57/92/37/1325579237.db2.gz	HKGRLSDJLJIUKO-GDCKJWNLSA-N	0	3	348.450	3.023	20	30		EGEDHN
CN(Cc1ccc(Cl)c(F)c1)[C@H]1CCCN(C(=O)C#CC2CC2)C1	ZINC001027405243	1327629472	/nfs/dbraw/zinc/62/94/72/1327629472.db2.gz	FXZFOXHGDKELHC-INIZCTEOSA-N	0	3	348.849	3.315	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)[C@H]2CCC2(F)F)C1	ZINC001027458444	1327701458	/nfs/dbraw/zinc/70/14/58/1327701458.db2.gz	JHSCVFNXRKMUIX-DLBZAZTESA-N	0	3	347.409	3.026	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)c2ccc3c4c(cccc42)CC3)C1	ZINC001027485637	1327742208	/nfs/dbraw/zinc/74/22/08/1327742208.db2.gz	FTXCPUYCLTVCPF-SFHVURJKSA-N	0	3	332.447	3.108	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H](N(C)C[C@@H](O)c2ccccc2)C1	ZINC001027519397	1327790430	/nfs/dbraw/zinc/79/04/30/1327790430.db2.gz	LTZZFTSTFVRDEK-RBUKOAKNSA-N	0	3	344.499	3.245	20	30		EGEDHN
CN(Cc1ccc(F)c(C#N)c1)[C@@H]1CCCN(C(=O)C2(C)CCC2)C1	ZINC001027528547	1327807396	/nfs/dbraw/zinc/80/73/96/1327807396.db2.gz	XIEMJROUYMGXNJ-QGZVFWFLSA-N	0	3	343.446	3.310	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)[C@H]2C[C@H]3C[C@H]3C2)C1	ZINC001027537870	1327834099	/nfs/dbraw/zinc/83/40/99/1327834099.db2.gz	RUWZJZDSXMVQIW-FUMNGEBKSA-N	0	3	337.467	3.027	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001027585578	1327922308	/nfs/dbraw/zinc/92/23/08/1327922308.db2.gz	LGBDAYKGHJYEIU-GUDVDZBRSA-N	0	3	325.456	3.027	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2coc(Br)c2)C1	ZINC000966522743	1328332162	/nfs/dbraw/zinc/33/21/62/1328332162.db2.gz	JEXRCEDYSCVARJ-AAEUAGOBSA-N	0	3	341.249	3.058	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(C(=O)CC3CCCCC3)C2)cc1F	ZINC000966833858	1328434369	/nfs/dbraw/zinc/43/43/69/1328434369.db2.gz	CXVOIKUTXXDJMG-GOSISDBHSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2cnc(-c3ccccc3)o2)C1	ZINC000966884707	1328451938	/nfs/dbraw/zinc/45/19/38/1328451938.db2.gz	PYHDNUXVBRZVAG-RDJZCZTQSA-N	0	3	339.439	3.358	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)Cc2ccc3cccnc3c2)C1	ZINC000966903359	1328465496	/nfs/dbraw/zinc/46/54/96/1328465496.db2.gz	FNGBRKKLGGLROA-UZLBHIALSA-N	0	3	337.467	3.180	20	30		EGEDHN
C=CCCN1CCC[C@@H]1CNC(=O)c1sc(C)nc1CC(C)C	ZINC001028004302	1328466123	/nfs/dbraw/zinc/46/61/23/1328466123.db2.gz	XGCAOLDPDNXNRD-OAHLLOKOSA-N	0	3	335.517	3.420	20	30		EGEDHN
CCCCCCCC[C@H](C)CC(=O)N1CC[C@@H](N2CC[C@@H](O)C2)C1	ZINC000861714197	1329437589	/nfs/dbraw/zinc/43/75/89/1329437589.db2.gz	JAGLBLWJXGBUIT-IPMKNSEASA-N	0	3	338.536	3.431	20	30		EGEDHN
CN(CCCC1(C#N)CCOCC1)CC(=O)NCCC1=CCCCC1	ZINC000933356509	1329882524	/nfs/dbraw/zinc/88/25/24/1329882524.db2.gz	OLQUACUYQAOBIF-UHFFFAOYSA-N	0	3	347.503	3.025	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccc(F)s2)C[C@H]1NCc1ccc(C#N)s1	ZINC000939847968	1331002588	/nfs/dbraw/zinc/00/25/88/1331002588.db2.gz	YLYCEFIHCKCTMY-ZWNOBZJWSA-N	0	3	349.456	3.071	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(F)c3ccccc3c2)[C@H](C)C1	ZINC000942109488	1331833948	/nfs/dbraw/zinc/83/39/48/1331833948.db2.gz	ONAWTEIMTDAYOW-QRWLVFNGSA-N	0	3	338.426	3.442	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccccc2C(C)(C)C)[C@H](C)C1	ZINC000942164443	1331856263	/nfs/dbraw/zinc/85/62/63/1331856263.db2.gz	RUKWBUYUVRVXFH-VQIMIIECSA-N	0	3	326.484	3.448	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)nn2C(CC)CC)[C@@H](C)C1	ZINC000942201829	1331876477	/nfs/dbraw/zinc/87/64/77/1331876477.db2.gz	AJWNDXPRLVOPSR-YJBOKZPZSA-N	0	3	344.503	3.016	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2csc(C(F)(F)F)c2)[C@H](C)C1	ZINC000942260027	1331889525	/nfs/dbraw/zinc/88/95/25/1331889525.db2.gz	WBGQWGJARNLRNP-ZYHUDNBSSA-N	0	3	332.391	3.393	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2c(C)cccc2Cl)[C@@H](C)C1	ZINC000942272825	1331893666	/nfs/dbraw/zinc/89/36/66/1331893666.db2.gz	RYGVEDWGQKKRMI-MAUKXSAKSA-N	0	3	332.875	3.041	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2cccc(C)c2Cl)[C@H](C)C1	ZINC000942467981	1331941098	/nfs/dbraw/zinc/94/10/98/1331941098.db2.gz	VRAIURDRYSTSEB-NVXWUHKLSA-N	0	3	332.875	3.041	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3cscc3s2)[C@@H](C)C1	ZINC000942521590	1331952900	/nfs/dbraw/zinc/95/29/00/1331952900.db2.gz	WXVHWEKKQOSHQY-JSGCOSHPSA-N	0	3	332.494	3.426	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2nc3ccccc3cc2C)[C@H](C)C1	ZINC000942525120	1331954891	/nfs/dbraw/zinc/95/48/91/1331954891.db2.gz	KBNNZBIPCNPSJH-SJLPKXTDSA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3c(cc(C)cc3C)[nH]2)[C@@H](C)C1	ZINC000942538623	1331964135	/nfs/dbraw/zinc/96/41/35/1331964135.db2.gz	TUHVGUCCUXVBPK-FUHWJXTLSA-N	0	3	337.467	3.248	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2sccc2-n2cccc2)[C@@H](C)C1	ZINC000942544757	1331967062	/nfs/dbraw/zinc/96/70/62/1331967062.db2.gz	DZTYQKOJZVJPGW-JKSUJKDBSA-N	0	3	341.480	3.002	20	30		EGEDHN
Cc1coc(C(=O)N[C@H]2CCN(Cc3ccc(C#N)cc3)C[C@H]2C)c1	ZINC000942565352	1331978594	/nfs/dbraw/zinc/97/85/94/1331978594.db2.gz	KNNKLQOOBNVRQZ-QAPCUYQASA-N	0	3	337.423	3.100	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3scnc3C)C[C@H]2C)C1	ZINC000942602645	1332000749	/nfs/dbraw/zinc/00/07/49/1332000749.db2.gz	LUXRURDFFYCQJK-UKRRQHHQSA-N	0	3	333.501	3.134	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3ccc(OC)cc3)C[C@@H]2C)C1	ZINC000942603219	1332001444	/nfs/dbraw/zinc/00/14/44/1332001444.db2.gz	UFZYRSDRYJLKDJ-QFBILLFUSA-N	0	3	342.483	3.378	20	30		EGEDHN
C[C@H]1CN(Cc2ccc(C#N)cc2)CC[C@@H]1NC(=O)C1CC2(CC2)C1	ZINC000942701595	1332023033	/nfs/dbraw/zinc/02/30/33/1332023033.db2.gz	SMZUVHSIKSGOCK-KXBFYZLASA-N	0	3	337.467	3.075	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccc(C(C)(C)C)c2)[C@@H](C)C1	ZINC000943744696	1332251991	/nfs/dbraw/zinc/25/19/91/1332251991.db2.gz	LVJVBPLJQDQDJW-QFBILLFUSA-N	0	3	326.484	3.448	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccc(C(F)F)cc2F)[C@H](C)C1	ZINC000943756166	1332254562	/nfs/dbraw/zinc/25/45/62/1332254562.db2.gz	MCGVFLXURWEFLL-IAQYHMDHSA-N	0	3	326.362	3.390	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(-c3ccccc3)ccn2)[C@@H](C)C1	ZINC000943765385	1332258352	/nfs/dbraw/zinc/25/83/52/1332258352.db2.gz	CKEMZEHJEWXOPO-PXNSSMCTSA-N	0	3	347.462	3.212	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc3ccsc32)[C@@H](C)C1	ZINC000943985880	1332303538	/nfs/dbraw/zinc/30/35/38/1332303538.db2.gz	BJGLZPRDBLXMCB-YOEHRIQHSA-N	0	3	326.465	3.365	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3ccccc3C)CCC2)[C@H](C)C1	ZINC000944444172	1332413398	/nfs/dbraw/zinc/41/33/98/1332413398.db2.gz	JRZSEOOUSGDGDJ-UYAOXDASSA-N	0	3	338.495	3.267	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc3[nH]c(C)c(C)c3c2)[C@@H](C)C1	ZINC000944892229	1332445970	/nfs/dbraw/zinc/44/59/70/1332445970.db2.gz	YZLYRQPKSUFHGI-LIRRHRJNSA-N	0	3	337.467	3.248	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C(C)(C)c2ccccc2C)[C@H](C)C1	ZINC000945806511	1332678398	/nfs/dbraw/zinc/67/83/98/1332678398.db2.gz	DRYRXCVWMZPESC-IEBWSBKVSA-N	0	3	326.484	3.123	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2sc(C(C)(C)C)nc2C)[C@@H](C)C1	ZINC000945809946	1332679144	/nfs/dbraw/zinc/67/91/44/1332679144.db2.gz	WIQSLWHXRRCYCS-DZGCQCFKSA-N	0	3	347.528	3.213	20	30		EGEDHN
N#Cc1ccccc1CN1C[C@@H]2CCN(C(=O)C3CC=CC3)CC[C@@H]2C1	ZINC000946533137	1332848208	/nfs/dbraw/zinc/84/82/08/1332848208.db2.gz	FOLCOFWXHMGHIF-OYRHEFFESA-N	0	3	349.478	3.195	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@@H]3CCC(F)(F)C3)CC[C@@H]2C1	ZINC000946618142	1332863946	/nfs/dbraw/zinc/86/39/46/1332863946.db2.gz	VJUPRYBRFLELDK-KFWWJZLASA-N	0	3	346.849	3.345	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3conc3C3CC3)CC[C@@H]2C1	ZINC000946770003	1332896208	/nfs/dbraw/zinc/89/62/08/1332896208.db2.gz	GOMLYGPKPPNZHP-GASCZTMLSA-N	0	3	349.862	3.089	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@@H]3CC34CCCC4)CC[C@@H]2C1	ZINC000946845925	1332913517	/nfs/dbraw/zinc/91/35/17/1332913517.db2.gz	MCUDBKNGBIXSRS-BBWFWOEESA-N	0	3	336.907	3.490	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3cc4c([nH]3)CCC4)CC[C@@H]2C1	ZINC000946856304	1332917230	/nfs/dbraw/zinc/91/72/30/1332917230.db2.gz	FGFRNGPNZMEKQR-IYBDPMFKSA-N	0	3	347.890	3.040	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)c2cccs2)CCN1Cc1cccc(C#N)c1	ZINC000947018342	1332976083	/nfs/dbraw/zinc/97/60/83/1332976083.db2.gz	XDOQJEYOKUHIDQ-WMLDXEAASA-N	0	3	339.464	3.403	20	30		EGEDHN
Cc1occc1C(=O)N[C@H]1CCN(Cc2cccc(C#N)c2)[C@@H](C)C1	ZINC000947032423	1332982353	/nfs/dbraw/zinc/98/23/53/1332982353.db2.gz	OHOAAWUGXBHECL-KSSFIOAISA-N	0	3	337.423	3.243	20	30		EGEDHN
Cc1cnccc1C(=O)N[C@H]1CCN(Cc2cccc(C#N)c2)[C@@H](C)C1	ZINC000947280625	1333076191	/nfs/dbraw/zinc/07/61/91/1333076191.db2.gz	DKVDPNPOBPHHHR-LPHOPBHVSA-N	0	3	348.450	3.045	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2coc3cc(F)ccc23)C[C@@H]1C	ZINC000947293030	1333079791	/nfs/dbraw/zinc/07/97/91/1333079791.db2.gz	ZEVQKHNUAZENQS-WMLDXEAASA-N	0	3	342.414	3.107	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2coc3ccc(C)cc23)C[C@H]1C	ZINC000947356076	1333101225	/nfs/dbraw/zinc/10/12/25/1333101225.db2.gz	HETFOHDNYKQDEW-SJLPKXTDSA-N	0	3	338.451	3.276	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnc(-c3ccccc3)o2)C[C@@H]1C	ZINC000947417197	1333120564	/nfs/dbraw/zinc/12/05/64/1333120564.db2.gz	NDUWVWKXNWKOKB-HOCLYGCPSA-N	0	3	325.412	3.110	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(C)oc2C(F)(F)F)C[C@H]1C	ZINC000947758289	1333253842	/nfs/dbraw/zinc/25/38/42/1333253842.db2.gz	LDQIJKUJXOMCCX-ZYHUDNBSSA-N	0	3	330.350	3.376	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2csc(C(C)(C)C)n2)C[C@@H]1C	ZINC000947810577	1333268196	/nfs/dbraw/zinc/26/81/96/1333268196.db2.gz	MLEXNQPROQIYOL-KBPBESRZSA-N	0	3	333.501	3.047	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@H](C)C2)ccn1	ZINC000947833485	1333273308	/nfs/dbraw/zinc/27/33/08/1333273308.db2.gz	UKJRBZCZTIXPAF-OXQOHEQNSA-N	0	3	348.450	3.045	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C(F)F)cc2F)C[C@H]1C	ZINC000947850359	1333279176	/nfs/dbraw/zinc/27/91/76/1333279176.db2.gz	ZKLIQBMNAQUIMO-OCCSQVGLSA-N	0	3	338.373	3.369	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2c[nH]nc2C2CCCCC2)C[C@H]1C	ZINC000947917534	1333306299	/nfs/dbraw/zinc/30/62/99/1333306299.db2.gz	XTIIEXOAVYMSRZ-WBVHZDCISA-N	0	3	342.487	3.063	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)[C@@]2(c3ccccc3)C[C@H](F)C2)C[C@H]1C	ZINC000947980968	1333330009	/nfs/dbraw/zinc/33/00/09/1333330009.db2.gz	SLLWDUZAEZGOCX-RDPOXOKHSA-N	0	3	342.458	3.049	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3ccccc3n2CC)C[C@H]1C	ZINC000948060295	1333359283	/nfs/dbraw/zinc/35/92/83/1333359283.db2.gz	AZYJBICZLNCQLC-SJLPKXTDSA-N	0	3	337.467	3.267	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C(C)(F)F)cc2)C[C@@H]1C	ZINC000948105919	1333376122	/nfs/dbraw/zinc/37/61/22/1333376122.db2.gz	ZELHRCLYKIDNAM-WMLDXEAASA-N	0	3	334.410	3.404	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C(C)(F)F)cc2)C[C@@H]1C	ZINC000948105921	1333376152	/nfs/dbraw/zinc/37/61/52/1333376152.db2.gz	ZELHRCLYKIDNAM-YOEHRIQHSA-N	0	3	334.410	3.404	20	30		EGEDHN
CN(C(=O)c1cccnc1)[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948129323	1333383106	/nfs/dbraw/zinc/38/31/06/1333383106.db2.gz	SZBOZXJKYVEJIH-HXUWFJFHSA-N	0	3	348.450	3.080	20	30		EGEDHN
C[C@@H](C(=O)N(C)[C@H]1CCCN(Cc2cccc(C#N)c2)CC1)C1CC1	ZINC000948274344	1333456732	/nfs/dbraw/zinc/45/67/32/1333456732.db2.gz	TVXAEMYYDLWNCV-UZLBHIALSA-N	0	3	339.483	3.417	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2cscc2C(F)F)CC1	ZINC000948382008	1333503703	/nfs/dbraw/zinc/50/37/03/1333503703.db2.gz	WSDVJSIMSYVFAK-LBPRGKRZSA-N	0	3	326.412	3.245	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](N(C)C(=O)c2ccn3cncc3c2)CC1	ZINC000948593831	1333588783	/nfs/dbraw/zinc/58/87/83/1333588783.db2.gz	IMPGMFMYUQPMBG-INIZCTEOSA-N	0	3	346.862	3.013	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)[C@@H](C)c2c(F)cccc2F)CC1	ZINC000948621591	1333600663	/nfs/dbraw/zinc/60/06/63/1333600663.db2.gz	RAHJTKKBIFOORZ-JKSUJKDBSA-N	0	3	348.437	3.405	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2ccc(C)nc2C2CC2)CC1	ZINC000948656417	1333615605	/nfs/dbraw/zinc/61/56/05/1333615605.db2.gz	YKPWCINHIJXMHG-GOSISDBHSA-N	0	3	339.483	3.217	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2ccc(F)c(Cl)c2F)CC1	ZINC000948746665	1333656607	/nfs/dbraw/zinc/65/66/07/1333656607.db2.gz	HMLVOZUMJRVBJI-LBPRGKRZSA-N	0	3	340.801	3.178	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)Cc2ccc(CC)cc2)CC1	ZINC000948816953	1333696188	/nfs/dbraw/zinc/69/61/88/1333696188.db2.gz	QDNMSDZNGFCODD-HXUWFJFHSA-N	0	3	326.484	3.128	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)[C@@]2(C)CCCc3ccccc32)CC1	ZINC000948852131	1333708951	/nfs/dbraw/zinc/70/89/51/1333708951.db2.gz	IHPYNMVFTDAHOI-KNQAVFIVSA-N	0	3	338.495	3.227	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@H]1CNC(=O)c1cccn1C	ZINC000948889584	1333720590	/nfs/dbraw/zinc/72/05/90/1333720590.db2.gz	AOLISPVVNQHYMY-HXUWFJFHSA-N	0	3	337.467	3.321	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@H]1CNC(=O)[C@@H]1CCCOCC1	ZINC000948913240	1333730859	/nfs/dbraw/zinc/73/08/59/1333730859.db2.gz	QTKAIMDPASPFGA-UYAOXDASSA-N	0	3	342.483	3.095	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@H]1CNC(=O)[C@H]1C[C@@H]1C(F)F	ZINC000948916204	1333733137	/nfs/dbraw/zinc/73/31/37/1333733137.db2.gz	PZEADXPSGIVKHQ-YESZJQIVSA-N	0	3	334.410	3.179	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@@H]1CNC(=O)c1c[nH]nc1C	ZINC000948946445	1333743085	/nfs/dbraw/zinc/74/30/85/1333743085.db2.gz	LDYJKJAGQWJQBQ-IBGZPJMESA-N	0	3	338.455	3.014	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1cccc(Cl)c1C)CCO2	ZINC000949102359	1333778700	/nfs/dbraw/zinc/77/87/00/1333778700.db2.gz	JJIXLMJXQRCOEL-UHFFFAOYSA-N	0	3	348.874	3.141	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1[C@@H]3CCCCCC[C@@H]13)CCO2	ZINC000949200152	1333794344	/nfs/dbraw/zinc/79/43/44/1333794344.db2.gz	KNDQFVCKRPTGBJ-QZTJIDSGSA-N	0	3	346.515	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C[C@@H]3CC[C@@H]4C[C@@H]43)CC2)C1	ZINC000949401749	1333838251	/nfs/dbraw/zinc/83/82/51/1333838251.db2.gz	KXAOBEBHGBPGDY-QYZOEREBSA-N	0	3	346.515	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3sccc3CC)CC2)C1	ZINC000949531877	1333869079	/nfs/dbraw/zinc/86/90/79/1333869079.db2.gz	SFTQWKMGWQMUMT-UHFFFAOYSA-N	0	3	348.512	3.194	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C3C[C@H](C)C[C@@H](C)C3)CC2)C1	ZINC000949533677	1333870183	/nfs/dbraw/zinc/87/01/83/1333870183.db2.gz	CVACVOLCKWFJAU-QZTJIDSGSA-N	0	3	348.531	3.328	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(-n3cccc3)cc2)C1	ZINC000967273996	1335683348	/nfs/dbraw/zinc/68/33/48/1335683348.db2.gz	ODLIADFCKBTISI-XLIONFOSSA-N	0	3	337.467	3.494	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccc3c4c(cccc42)CC3)C1	ZINC000967287051	1335689748	/nfs/dbraw/zinc/68/97/48/1335689748.db2.gz	CRVGEZQXXVCSKH-KKSFZXQISA-N	0	3	346.474	3.402	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CN(CCOC3CCC3)CC[C@@H]2C)CC1	ZINC000968193974	1335869489	/nfs/dbraw/zinc/86/94/89/1335869489.db2.gz	XGMWRDNQKHKEFF-LPHOPBHVSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(C)c(OCC)c2)C1	ZINC000968382790	1335912131	/nfs/dbraw/zinc/91/21/31/1335912131.db2.gz	VUVCCCWDWLIJDL-QAPCUYQASA-N	0	3	330.472	3.410	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](C)[C@H](NC(=O)c2scnc2C2CC2)C1	ZINC000968399656	1335919620	/nfs/dbraw/zinc/91/96/20/1335919620.db2.gz	GUHXUTIVZCEPRG-UKRRQHHQSA-N	0	3	333.501	3.427	20	30		EGEDHN
C=C(C)CCN1CC[C@H](C)[C@H](NC(=O)c2sc(CC)nc2C)C1	ZINC000968406025	1335922541	/nfs/dbraw/zinc/92/25/41/1335922541.db2.gz	WDLLEONJTPSPDO-DZGCQCFKSA-N	0	3	335.517	3.420	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2ccc(-c3cn[nH]c3)cc2)C1	ZINC000968406256	1335922895	/nfs/dbraw/zinc/92/28/95/1335922895.db2.gz	ZESTUPAUTCHHMX-KXBFYZLASA-N	0	3	338.455	3.093	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2occc2Br)C1	ZINC000968426055	1335926510	/nfs/dbraw/zinc/92/65/10/1335926510.db2.gz	ANDDXZPSUKWWPB-WCQYABFASA-N	0	3	341.249	3.058	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2c[nH]nc2-c2ccsc2)C1	ZINC000968480541	1335936520	/nfs/dbraw/zinc/93/65/20/1335936520.db2.gz	NTGMZQBQTZGHAF-CJNGLKHVSA-N	0	3	344.484	3.155	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)C2(c3ccccc3F)CC2)C1	ZINC000968498053	1335942136	/nfs/dbraw/zinc/94/21/36/1335942136.db2.gz	VVTDDRGHAWLROR-QAPCUYQASA-N	0	3	330.447	3.260	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2ncccc2C(F)(F)F)C1	ZINC000968500386	1335942948	/nfs/dbraw/zinc/94/29/48/1335942948.db2.gz	CZWPPRXWCACZHS-TZMCWYRMSA-N	0	3	341.377	3.117	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2ncccc2C(F)(F)F)C1	ZINC000968500384	1335943025	/nfs/dbraw/zinc/94/30/25/1335943025.db2.gz	CZWPPRXWCACZHS-JSGCOSHPSA-N	0	3	341.377	3.117	20	30		EGEDHN
C=C(C)CCN1CC[C@H](C)[C@@H](NC(=O)c2sccc2COC)C1	ZINC000968539987	1335957006	/nfs/dbraw/zinc/95/70/06/1335957006.db2.gz	RYPOHFMFPSBZLN-HOCLYGCPSA-N	0	3	336.501	3.301	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2sc(CCC)nc2C)C1	ZINC000968643411	1335994137	/nfs/dbraw/zinc/99/41/37/1335994137.db2.gz	LTPATPXISAXOKM-HIFRSBDPSA-N	0	3	335.517	3.420	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2cc3ccccc3n2CC)C1	ZINC000968682228	1336008536	/nfs/dbraw/zinc/00/85/36/1336008536.db2.gz	PCAIVBXYVFXRBM-WMZOPIPTSA-N	0	3	337.467	3.125	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)C2(c3cccc(C)c3)CC2)C1	ZINC000968682170	1336008878	/nfs/dbraw/zinc/00/88/78/1336008878.db2.gz	OXOTWUDGVIXXAW-PKOBYXMFSA-N	0	3	326.484	3.429	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)Cc2cccc(OC(C)C)c2)C1	ZINC000968687982	1336011439	/nfs/dbraw/zinc/01/14/39/1336011439.db2.gz	ITNJPNVBNVEFGV-XLIONFOSSA-N	0	3	344.499	3.419	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H](NCc2ccccc2N(C)C)C1	ZINC000968795257	1336054072	/nfs/dbraw/zinc/05/40/72/1336054072.db2.gz	JTERAWRUEIBPGU-MRXNPFEDSA-N	0	3	349.906	3.222	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1c(C)noc1CCC	ZINC000968856492	1336069754	/nfs/dbraw/zinc/06/97/54/1336069754.db2.gz	JAIXWHFZOVEOHA-INIZCTEOSA-N	0	3	333.476	3.486	20	30		EGEDHN
C#CCCN1CCCCC[C@@H]1CNC(=O)c1ccoc1C(F)(F)F	ZINC000968875357	1336075044	/nfs/dbraw/zinc/07/50/44/1336075044.db2.gz	YTSNDLOYWVKGKI-CYBMUJFWSA-N	0	3	342.361	3.296	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)C1C2CC3CC(C2)CC1C3	ZINC000968890759	1336081960	/nfs/dbraw/zinc/08/19/60/1336081960.db2.gz	MYNBDYADRVOSSI-XIWZRWORSA-N	0	3	342.527	3.443	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cc(C(C)C)nn1CC	ZINC000968931390	1336094572	/nfs/dbraw/zinc/09/45/72/1336094572.db2.gz	MZHXHZJECFNVRN-INIZCTEOSA-N	0	3	332.492	3.187	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)C1CCC(F)(F)CC1	ZINC000969046778	1336126322	/nfs/dbraw/zinc/12/63/22/1336126322.db2.gz	VESZBKGHNXFILO-INIZCTEOSA-N	0	3	326.431	3.196	20	30		EGEDHN
C#CCCN1CCCCC[C@@H]1CNC(=O)c1scnc1C(C)(C)C	ZINC000969062184	1336134066	/nfs/dbraw/zinc/13/40/66/1336134066.db2.gz	LAUBGSWDLYCKGK-OAHLLOKOSA-N	0	3	347.528	3.438	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1ccc(OC)c(C)c1	ZINC000969072672	1336137876	/nfs/dbraw/zinc/13/78/76/1336137876.db2.gz	OYIAXULYYYUWSG-GOSISDBHSA-N	0	3	328.456	3.001	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1coc(C2CCC2)n1	ZINC000969106061	1336146329	/nfs/dbraw/zinc/14/63/29/1336146329.db2.gz	SETOKLXPZRUAOO-MRXNPFEDSA-N	0	3	331.460	3.493	20	30		EGEDHN
C#CCCN1CCCCC[C@H]1CNC(=O)c1cnc(C2CC2)s1	ZINC000969122147	1336151093	/nfs/dbraw/zinc/15/10/93/1336151093.db2.gz	YEMLLPVQQGRUFK-HNNXBMFYSA-N	0	3	331.485	3.018	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1c(OC)cccc1OC	ZINC000969127491	1336153215	/nfs/dbraw/zinc/15/32/15/1336153215.db2.gz	YCKWSVQKOJNNDC-INIZCTEOSA-N	0	3	346.471	3.254	20	30		EGEDHN
N#Cc1cc(CN[C@@H]2CCN(C(=O)C[C@H]3CC=CCC3)C2)ccc1F	ZINC000969599002	1336226776	/nfs/dbraw/zinc/22/67/76/1336226776.db2.gz	ZJYWNWZMDGNFIJ-MAUKXSAKSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H](C)C1CN(CC2=CCCCC2)C1	ZINC000969843074	1336253194	/nfs/dbraw/zinc/25/31/94/1336253194.db2.gz	VZVOZNPMJXQRBG-MRXNPFEDSA-N	0	3	327.472	3.225	20	30		EGEDHN
C#CCCN1CC([C@@H](C)NC(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000970455493	1336308905	/nfs/dbraw/zinc/30/89/05/1336308905.db2.gz	SNDLSFVLONRABA-DUXKGJEZSA-N	0	3	338.495	3.420	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)c2cc(F)cc3cccnc32)C1	ZINC000970523264	1336316547	/nfs/dbraw/zinc/31/65/47/1336316547.db2.gz	NELYAHLSTWXEPL-CYBMUJFWSA-N	0	3	327.403	3.000	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCN(C(=O)C2=CCCCCC2)C1	ZINC000971404789	1336342713	/nfs/dbraw/zinc/34/27/13/1336342713.db2.gz	WWKUTXBWPLMZDM-FQEVSTJZSA-N	0	3	337.467	3.481	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)C2(c3cccnc3)CCCC2)CC1	ZINC001005893886	1336417459	/nfs/dbraw/zinc/41/74/59/1336417459.db2.gz	SJHANPJMQWAIAE-UHFFFAOYSA-N	0	3	327.472	3.002	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cccnc2OCC(C)C)CC1	ZINC001006303228	1336486528	/nfs/dbraw/zinc/48/65/28/1336486528.db2.gz	NXIWSCSKRIRZLM-UHFFFAOYSA-N	0	3	345.487	3.229	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2cc(C)n(C(CC)CC)n2)C1	ZINC001007728723	1336691884	/nfs/dbraw/zinc/69/18/84/1336691884.db2.gz	STTTVGWQULZMNA-MRXNPFEDSA-N	0	3	332.492	3.323	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2cc(-c3ccccc3)on2)C1	ZINC001007866564	1336721872	/nfs/dbraw/zinc/72/18/72/1336721872.db2.gz	DTHJQBAABGSQDU-MRXNPFEDSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=C(C)CCN1CCC[C@H](NC(=O)c2cc(-c3ccco3)on2)C1	ZINC001008112717	1336772241	/nfs/dbraw/zinc/77/22/41/1336772241.db2.gz	KIELLIAZSRTPND-AWEZNQCLSA-N	0	3	329.400	3.095	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CCCN([C@@H](C)c3cccc(C)c3)C2)c1	ZINC001008466940	1336864294	/nfs/dbraw/zinc/86/42/94/1336864294.db2.gz	ATCYFILDMALURA-UWJYYQICSA-N	0	3	347.462	3.327	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2csc(-c3ccoc3)n2)C1	ZINC001008907115	1336941408	/nfs/dbraw/zinc/94/14/08/1336941408.db2.gz	ZXGKATWLSFHSKR-AWEZNQCLSA-N	0	3	331.441	3.173	20	30		EGEDHN
C=C(C)CCN1CCC[C@H](NC(=O)c2cc3cccnc3s2)C1	ZINC001009088877	1336966917	/nfs/dbraw/zinc/96/69/17/1336966917.db2.gz	SUMSASUVKCDZIO-HNNXBMFYSA-N	0	3	329.469	3.457	20	30		EGEDHN
C#CCCN1CCC[C@@H](NC(=O)c2ccc(O[C@@H](C)CC)cc2)C1	ZINC001009105704	1336970361	/nfs/dbraw/zinc/97/03/61/1336970361.db2.gz	COPNELHXTSQRHY-FUHWJXTLSA-N	0	3	328.456	3.081	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCN([C@H](C)c3ccccc3C)C2)cn1	ZINC001009273150	1336995182	/nfs/dbraw/zinc/99/51/82/1336995182.db2.gz	DFTNFOBXEYXSEN-XLIONFOSSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(CCc3ccc(C)cc3)C2)cc1	ZINC001015481406	1338155553	/nfs/dbraw/zinc/15/55/53/1338155553.db2.gz	GBPPELQNYNFMGI-NRFANRHFSA-N	0	3	332.447	3.023	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(CCc3ccc(CC)cc3)C2)cc1	ZINC001015488433	1338157462	/nfs/dbraw/zinc/15/74/62/1338157462.db2.gz	PRGLHTVECQQHLJ-QFIPXVFZSA-N	0	3	346.474	3.277	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2cccc3c(C)c(C)[nH]c32)CC1	ZINC001016690656	1338691861	/nfs/dbraw/zinc/69/18/61/1338691861.db2.gz	OQNWLZVLBPSLSQ-SFHVURJKSA-N	0	3	335.451	3.002	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)Cc2cc3ccccc3s2)CC1	ZINC001016724699	1338703058	/nfs/dbraw/zinc/70/30/58/1338703058.db2.gz	WBEQMXJFDQTSCD-GOSISDBHSA-N	0	3	338.476	3.048	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)[C@@H](c2ccccc2)C2CC2)CC1	ZINC001016726029	1338703803	/nfs/dbraw/zinc/70/38/03/1338703803.db2.gz	LKKOOWFCKKTPEV-PMACEKPBSA-N	0	3	336.479	3.174	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(-c3ccco3)o2)CC1	ZINC001016727261	1338704063	/nfs/dbraw/zinc/70/40/63/1338704063.db2.gz	QXQUUOXMBYHNHB-SFHVURJKSA-N	0	3	338.407	3.147	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2cc(C)c(Cl)cc2C)CC1	ZINC001016761698	1338715743	/nfs/dbraw/zinc/71/57/43/1338715743.db2.gz	AHEXFHJJZLEILG-KRWDZBQOSA-N	0	3	330.859	3.174	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cc3c(ccc(C)c3C)[nH]2)CC1	ZINC001016764611	1338717022	/nfs/dbraw/zinc/71/70/22/1338717022.db2.gz	WOMTYFZVCCENQX-HXUWFJFHSA-N	0	3	349.478	3.392	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@@H]3NC(=O)[C@H]3C[C@H]4C[C@H]4C3)CC2)c1	ZINC001016787859	1338727402	/nfs/dbraw/zinc/72/74/02/1338727402.db2.gz	ZRSBRSBUQBHGEA-NMLBUPMWSA-N	0	3	349.478	3.075	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2ccc(F)c3ccccc23)CC1	ZINC001016845472	1338744855	/nfs/dbraw/zinc/74/48/55/1338744855.db2.gz	JCPCLSMLYXTUOF-LJQANCHMSA-N	0	3	336.410	3.196	20	30		EGEDHN
CC(C)(C)C(=O)N[C@@H]1CC12CCN(Cc1cccc(C#N)c1)CC2	ZINC001016939703	1338776077	/nfs/dbraw/zinc/77/60/77/1338776077.db2.gz	IDJIOPZGHGJUNV-QGZVFWFLSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2sccc2C(F)F)CC1	ZINC001016952748	1338782235	/nfs/dbraw/zinc/78/22/35/1338782235.db2.gz	XRXIHKRVJLKFPH-ZDUSSCGKSA-N	0	3	338.423	3.293	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(F)cc2Cl)CC1	ZINC001016955242	1338783450	/nfs/dbraw/zinc/78/34/50/1338783450.db2.gz	ICKIEYRBZCQZIA-INIZCTEOSA-N	0	3	334.822	3.087	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2sccc2C2CC2)CC1	ZINC001016957999	1338784469	/nfs/dbraw/zinc/78/44/69/1338784469.db2.gz	GEEZOYPEUQZSQB-MRXNPFEDSA-N	0	3	328.481	3.233	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2csc3c2CCCC3)CC1	ZINC001016961813	1338785528	/nfs/dbraw/zinc/78/55/28/1338785528.db2.gz	UVVKCIFJFSOVDR-GOSISDBHSA-N	0	3	342.508	3.235	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)CC2C3CC4CC(C3)CC2C4)CC1	ZINC001016979530	1338790815	/nfs/dbraw/zinc/79/08/15/1338790815.db2.gz	AWXGTLIKMTWCTE-BROHZWGRSA-N	0	3	340.511	3.053	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)C23CC(C(C)(C)C)(C2)C3)CC1	ZINC001016993929	1338797420	/nfs/dbraw/zinc/79/74/20/1338797420.db2.gz	QGVPKUZCWZLBMW-ATIQYGATSA-N	0	3	328.500	3.197	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCCN(C(=O)c2ccoc2)C1	ZINC001017045590	1338833561	/nfs/dbraw/zinc/83/35/61/1338833561.db2.gz	CHOKNEOVYPTFEL-AWEZNQCLSA-N	0	3	343.452	3.197	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC[C@@H](CN(C)Cc3ccccn3)C2)cc1	ZINC001017176274	1338920178	/nfs/dbraw/zinc/92/01/78/1338920178.db2.gz	KDHAMZVMOQAPNM-IBGZPJMESA-N	0	3	347.462	3.047	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C1(C(F)(F)F)CCC1	ZINC001017666145	1339387638	/nfs/dbraw/zinc/38/76/38/1339387638.db2.gz	GNZBTWSUTXXAFU-OKILXGFUSA-N	0	3	330.394	3.360	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccc(CC)c1	ZINC001017670591	1339388229	/nfs/dbraw/zinc/38/82/29/1339388229.db2.gz	FPJAVBQVOVOJGK-BGYRXZFFSA-N	0	3	326.484	3.433	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cn1c(C)cc2ccccc21	ZINC001017717438	1339400072	/nfs/dbraw/zinc/40/00/72/1339400072.db2.gz	OEJQVQYDJOSNII-KDURUIRLSA-N	0	3	337.467	3.201	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1COc2cc(C)c(C)cc21	ZINC001017768734	1339414614	/nfs/dbraw/zinc/41/46/14/1339414614.db2.gz	HJFNTEWZIGRLFA-ZIFCJYIRSA-N	0	3	340.467	3.031	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C(C)(C)CC1CCOCC1	ZINC001018119087	1339505278	/nfs/dbraw/zinc/50/52/78/1339505278.db2.gz	IWPDJUDHBCSOHE-KDURUIRLSA-N	0	3	348.531	3.471	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@H](NCc2ccc(Cl)c(Cl)c2)C1	ZINC001018831985	1339735314	/nfs/dbraw/zinc/73/53/14/1339735314.db2.gz	XTQHNELIKIJDAS-AWEZNQCLSA-N	0	3	337.250	3.097	20	30		EGEDHN
Cc1cccc(C(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)c1F	ZINC001018895589	1339743894	/nfs/dbraw/zinc/74/38/94/1339743894.db2.gz	QVFURRBAICQPFA-ZDUSSCGKSA-N	0	3	343.427	3.072	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@H](NCc2sc(C)nc2C)C1	ZINC001018910223	1339750600	/nfs/dbraw/zinc/75/06/00/1339750600.db2.gz	NSEIDGOWGSRFGH-ZDUSSCGKSA-N	0	3	341.908	3.229	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1ccnc(O[C@@H](C)CC)c1	ZINC001028250057	1340509881	/nfs/dbraw/zinc/50/98/81/1340509881.db2.gz	PKKGBROHEYCHJW-RDJZCZTQSA-N	0	3	331.460	3.029	20	30		EGEDHN
C=CCCN1CCC[C@H]1CNC(=O)c1cnc(-c2ccco2)s1	ZINC001028278971	1340533200	/nfs/dbraw/zinc/53/32/00/1340533200.db2.gz	UMCPMMVHGYGRIY-ZDUSSCGKSA-N	0	3	331.441	3.173	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H](CNC(=O)C3CCCCCC3)C2)c1	ZINC001028442612	1340642607	/nfs/dbraw/zinc/64/26/07/1340642607.db2.gz	FOLWUPUQGPXHSX-LJQANCHMSA-N	0	3	339.483	3.467	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](CNC(=O)c3[nH]ccc3C3CC3)C2)cc1	ZINC001028588914	1340716255	/nfs/dbraw/zinc/71/62/55/1340716255.db2.gz	IUIPSXCWLWRPAM-QGZVFWFLSA-N	0	3	348.450	3.016	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H]1C(=O)NC[C@@H]1CCN(Cc2ccc(C#N)cc2)C1	ZINC001028812728	1340831150	/nfs/dbraw/zinc/83/11/50/1340831150.db2.gz	MFBRAKRUCQUGTN-XUVXKRRUSA-N	0	3	339.483	3.179	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC001028814969	1340833398	/nfs/dbraw/zinc/83/33/98/1340833398.db2.gz	JCOVWZXYASJOAS-CEWLAPEOSA-N	0	3	338.495	3.422	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@H]2CCN(Cc3cccc(C#N)c3)C2)cc1C	ZINC001028966786	1340895458	/nfs/dbraw/zinc/89/54/58/1340895458.db2.gz	JNVVKZCMMOQGBQ-HXUWFJFHSA-N	0	3	347.462	3.427	20	30		EGEDHN
C[C@@H](C(=O)N1CCC([C@H](C)NCc2ccccc2C#N)CC1)C1CC1	ZINC001029076851	1340924504	/nfs/dbraw/zinc/92/45/04/1340924504.db2.gz	DJNWDSCDQXZLLC-CVEARBPZSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC([C@@H](C)NCc2cnc(C)o2)CC1	ZINC001029139743	1340940567	/nfs/dbraw/zinc/94/05/67/1340940567.db2.gz	IDSZEIRAVSTGFK-AUUYWEPGSA-N	0	3	333.476	3.302	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCC([C@H](C)NCc2ccccc2C#N)CC1	ZINC001029147038	1340942728	/nfs/dbraw/zinc/94/27/28/1340942728.db2.gz	YPVHPPYQCIKVPN-RZQQEMMASA-N	0	3	339.483	3.321	20	30		EGEDHN
N#Cc1cc(C(=O)N2C[C@H]3CC[C@@H](C2)N3CCCC2CCCC2)c[nH]1	ZINC001029277372	1340966090	/nfs/dbraw/zinc/96/60/90/1340966090.db2.gz	FLVWHDSOWHUGBV-KDURUIRLSA-N	0	3	340.471	3.146	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CC[C@@H](C1)N2CC1CC(F)(F)C1	ZINC001029454049	1340993614	/nfs/dbraw/zinc/99/36/14/1340993614.db2.gz	RKKNJJPGYQQRAO-HLLBOEOZSA-N	0	3	326.431	3.309	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CC[C@@H](C2)N3C[C@@H](OC)C2CCCC2)C1	ZINC001029465452	1340996785	/nfs/dbraw/zinc/99/67/85/1340996785.db2.gz	XTBWRHFIKBIKJQ-CEXWTWQISA-N	0	3	346.515	3.223	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N1C[C@H]2CC[C@@H](C1)N2CC1=CCCCC1	ZINC001029511858	1341003460	/nfs/dbraw/zinc/00/34/60/1341003460.db2.gz	FCHWLZUCPLTOQA-YRPNKDGESA-N	0	3	344.499	3.143	20	30		EGEDHN
C=C[C@@H](C(=O)N1C[C@H]2CC[C@@H](C1)N2C[C@@H](CC)OC)c1ccccc1	ZINC001029594646	1341018191	/nfs/dbraw/zinc/01/81/91/1341018191.db2.gz	TUHKFJXKCFKPRP-IYWMVGAKSA-N	0	3	342.483	3.056	20	30		EGEDHN
C/C(=C\C(=O)N1CC[C@H](CN(C)Cc2ccc(C#N)s2)C1)C1CC1	ZINC001029663040	1341037332	/nfs/dbraw/zinc/03/73/32/1341037332.db2.gz	DPYDSAGQQAXQMP-AAWPKVBNSA-N	0	3	343.496	3.256	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCN(C(=O)CCC2CCC2)C1	ZINC001029691164	1341045237	/nfs/dbraw/zinc/04/52/37/1341045237.db2.gz	BRBOGWXJCWGJJM-INIZCTEOSA-N	0	3	345.512	3.480	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCN(C(=O)C2=CCCC2)C1	ZINC001029705578	1341050567	/nfs/dbraw/zinc/05/05/67/1341050567.db2.gz	LTAQUIVCZXTBLE-CQSZACIVSA-N	0	3	329.469	3.010	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](CN(C)Cc2oc(CCC)nc2C)C1	ZINC001029801323	1341077263	/nfs/dbraw/zinc/07/72/63/1341077263.db2.gz	LDKMBWDUQPQHGE-INIZCTEOSA-N	0	3	347.503	3.428	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCN(C(=O)C(C)(C)C2CC2)C1	ZINC001029813828	1341083795	/nfs/dbraw/zinc/08/37/95/1341083795.db2.gz	FGVNSJDTFMELEH-CQSZACIVSA-N	0	3	345.512	3.336	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](CN(C)Cc3ocnc3C)C2)CC1	ZINC001029825818	1341086983	/nfs/dbraw/zinc/08/69/83/1341086983.db2.gz	ILMVHFPKNWCGBU-MRXNPFEDSA-N	0	3	331.460	3.010	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](CN(C)[C@H](C)c3cnccn3)C2)CC1	ZINC001029825360	1341087148	/nfs/dbraw/zinc/08/71/48/1341087148.db2.gz	CENDPFMZWMAVKG-SJORKVTESA-N	0	3	342.487	3.064	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCN(C(=O)C2CC3(CC3)C2)C1	ZINC001029837836	1341092505	/nfs/dbraw/zinc/09/25/05/1341092505.db2.gz	VVPYQGCSWHCILJ-CQSZACIVSA-N	0	3	343.496	3.090	20	30		EGEDHN
C#CCCN1CCC[C@H](N(Cc2ccccc2)C(=O)c2cccn2C)C1	ZINC001029917076	1341117337	/nfs/dbraw/zinc/11/73/37/1341117337.db2.gz	HULQSGCYXRYJHM-FQEVSTJZSA-N	0	3	349.478	3.155	20	30		EGEDHN
C=C(C)CN1CCC[C@H](N(Cc2ccccc2)C(=O)[C@H]2CCOC2)C1	ZINC001029918029	1341118290	/nfs/dbraw/zinc/11/82/90/1341118290.db2.gz	VHSLETJHUUKSDI-PMACEKPBSA-N	0	3	342.483	3.092	20	30		EGEDHN
C#CCCN1CCC[C@@H](N(Cc2ccccc2)C(=O)c2cc[nH]c2)C1	ZINC001029920369	1341119929	/nfs/dbraw/zinc/11/99/29/1341119929.db2.gz	VQMHGQSPSPZPJS-HXUWFJFHSA-N	0	3	335.451	3.145	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC(CN(C)Cc2cc(C#N)ccc2F)CC1	ZINC001029937208	1341128557	/nfs/dbraw/zinc/12/85/57/1341128557.db2.gz	HTQUPNGEYHUSAB-OAHLLOKOSA-N	0	3	345.462	3.414	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC(CN(C)[C@H](C)c2cnc(C)cn2)CC1	ZINC001029984541	1341144086	/nfs/dbraw/zinc/14/40/86/1341144086.db2.gz	IGPBTOWHSYGUND-MRXNPFEDSA-N	0	3	344.503	3.229	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC(CN(C)Cc2cnoc2C)CC1	ZINC001029990750	1341148109	/nfs/dbraw/zinc/14/81/09/1341148109.db2.gz	QFXAYHCAJLNCDR-LJQANCHMSA-N	0	3	333.476	3.256	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NCC1CN([C@H](C)c2cccc(C)c2)C1	ZINC001032043701	1341445123	/nfs/dbraw/zinc/44/51/23/1341445123.db2.gz	KDSHOOTUDVJCAC-UXPWSPDFSA-N	0	3	342.483	3.085	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)CCn1ccc2ccccc21	ZINC001032772991	1341609891	/nfs/dbraw/zinc/60/98/91/1341609891.db2.gz	IPPMDORRPZNUBJ-OALUTQOASA-N	0	3	337.467	3.283	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(OC2CCC2)cc1	ZINC001032794563	1341615590	/nfs/dbraw/zinc/61/55/90/1341615590.db2.gz	PHHIXWLPRQGXEU-IRXDYDNUSA-N	0	3	326.440	3.093	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2cc(F)cc3ccncc32)C1	ZINC001033092248	1341720744	/nfs/dbraw/zinc/72/07/44/1341720744.db2.gz	PCDLJEZICRDOLU-MRXNPFEDSA-N	0	3	327.403	3.096	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2c(F)ccc3ccncc32)C1	ZINC001033103273	1341723943	/nfs/dbraw/zinc/72/39/43/1341723943.db2.gz	VSSCMCTWMVAOFF-OAHLLOKOSA-N	0	3	327.403	3.096	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)[C@H]2CCc3c2cccc3Cl)C1	ZINC001033267178	1341763253	/nfs/dbraw/zinc/76/32/53/1341763253.db2.gz	AQJBCRXKYPGSQK-YOEHRIQHSA-N	0	3	332.875	3.479	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@H]2CCN(Cc3ccc(C)cc3)C2)cc1	ZINC001033323726	1341781083	/nfs/dbraw/zinc/78/10/83/1341781083.db2.gz	XGFSXGJILDGKDW-NRFANRHFSA-N	0	3	332.447	3.323	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@@H]2CCN(CCOc3ccc(C)cc3)C2)C1	ZINC001033394604	1341811553	/nfs/dbraw/zinc/81/15/53/1341811553.db2.gz	XFRYRLBVZSVCLU-GOSISDBHSA-N	0	3	342.483	3.263	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@@H]2CCN(CC[C@@H]3CC3(Cl)Cl)C2)C1	ZINC001033400793	1341814454	/nfs/dbraw/zinc/81/44/54/1341814454.db2.gz	XJXBTKOVZLVXSG-ZIAGYGMSSA-N	0	3	345.314	3.459	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)Cc2c[nH]c3cccc(C)c23)C1	ZINC001033597260	1341890035	/nfs/dbraw/zinc/89/00/35/1341890035.db2.gz	QJDZMGASUOVQQQ-KRWDZBQOSA-N	0	3	325.456	3.128	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2cccc(OCC(C)C)c2)C1	ZINC001033648777	1341928056	/nfs/dbraw/zinc/92/80/56/1341928056.db2.gz	OXBYXRQHAHZPQO-GOSISDBHSA-N	0	3	330.472	3.444	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2ccc(COC(C)C)cc2)C1	ZINC001033659361	1341933578	/nfs/dbraw/zinc/93/35/78/1341933578.db2.gz	ZDNWMKJNZAAPIT-IBGZPJMESA-N	0	3	330.472	3.334	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)C2CC(c3ccc(F)cc3)C2)C1	ZINC001033707685	1341969871	/nfs/dbraw/zinc/96/98/71/1341969871.db2.gz	OQENQUTVUFAMBW-TVPLGVNVSA-N	0	3	330.447	3.428	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2cc3c(ccc(C)c3C)[nH]2)C1	ZINC001033923631	1342090193	/nfs/dbraw/zinc/09/01/93/1342090193.db2.gz	SOWCHKMWJIZWHH-QGZVFWFLSA-N	0	3	337.467	3.344	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2cc(C(C)(C)C)oc2C)C1	ZINC001033969736	1342120951	/nfs/dbraw/zinc/12/09/51/1342120951.db2.gz	YKJQIMKZAAVYQO-MRXNPFEDSA-N	0	3	330.472	3.445	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cc(F)c3ncccc3c2)C1	ZINC001033988028	1342132264	/nfs/dbraw/zinc/13/22/64/1342132264.db2.gz	GBJKNCYBUFVTDO-KRWDZBQOSA-N	0	3	341.430	3.486	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cnn(C3CCCC3)c2C)C1	ZINC001034017967	1342154648	/nfs/dbraw/zinc/15/46/48/1342154648.db2.gz	VRBDWOJRGQGEIH-GOSISDBHSA-N	0	3	344.503	3.419	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccc(N(C)C)c(F)c2)C1	ZINC001034052075	1342194048	/nfs/dbraw/zinc/19/40/48/1342194048.db2.gz	GCGWEDLVTCHCAN-MRXNPFEDSA-N	0	3	333.451	3.004	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2ccc(C(C)(F)F)cc2)C1	ZINC001034057151	1342197430	/nfs/dbraw/zinc/19/74/30/1342197430.db2.gz	RKEUCIMIIMEIOV-KRWDZBQOSA-N	0	3	334.410	3.358	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cn(C(C)(C)C)nc2C)C1	ZINC001034200591	1342311398	/nfs/dbraw/zinc/31/13/98/1342311398.db2.gz	QRIXNWFMPOLOIS-MRXNPFEDSA-N	0	3	332.492	3.107	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cnn(C(C)(C)C)c2C)C1	ZINC001034228431	1342332602	/nfs/dbraw/zinc/33/26/02/1342332602.db2.gz	FHWJYZCZFCQEFM-MRXNPFEDSA-N	0	3	332.492	3.107	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccn(C3CCCC3)n2)C1	ZINC001034229178	1342334210	/nfs/dbraw/zinc/33/42/10/1342334210.db2.gz	NDOHYQHMWFBOGY-MRXNPFEDSA-N	0	3	330.476	3.159	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cncn2-c2ccccc2)C1	ZINC001034247555	1342344742	/nfs/dbraw/zinc/34/47/42/1342344742.db2.gz	PZXCILJNGKLQHQ-QGZVFWFLSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)[C@@H]2CC=CC[C@H]2C(F)(F)F)C1	ZINC001034270386	1342360899	/nfs/dbraw/zinc/36/08/99/1342360899.db2.gz	GHSUQWLGNOKGPV-RBSFLKMASA-N	0	3	330.394	3.288	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cc(C)cc(OC)c2C)C1	ZINC001034293667	1342376688	/nfs/dbraw/zinc/37/66/88/1342376688.db2.gz	ZOBHHVYOSXOMBQ-KRWDZBQOSA-N	0	3	330.472	3.472	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cnc(C)nc2C(C)C)C1	ZINC001034433603	1342496193	/nfs/dbraw/zinc/49/61/93/1342496193.db2.gz	GLWXCCCZWPDAPF-INIZCTEOSA-N	0	3	330.476	3.069	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)C(C)(C)c2cccc(OC)c2)C1	ZINC001034477417	1342534392	/nfs/dbraw/zinc/53/43/92/1342534392.db2.gz	NPDSLZHNFTXTIA-QGZVFWFLSA-N	0	3	330.472	3.130	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2ccsc2C(F)(F)F)C1	ZINC001034510984	1342570285	/nfs/dbraw/zinc/57/02/85/1342570285.db2.gz	KYZARMDZCKWELU-GFCCVEGCSA-N	0	3	344.402	3.375	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)Cc2coc3cc(C)ccc23)C1	ZINC001034514146	1342573678	/nfs/dbraw/zinc/57/36/78/1342573678.db2.gz	GKLMKZVTDJEILX-KRWDZBQOSA-N	0	3	326.440	3.440	20	30		EGEDHN
C[C@@H](C(=O)N[C@H]1CC[C@H](NCc2cc(F)ccc2C#N)CC1)C1CC1	ZINC001034616130	1342649832	/nfs/dbraw/zinc/64/98/32/1342649832.db2.gz	TZAWHWJLSSRBCZ-UPRAQXHNSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC[C@H](N[C@H](C)c3cnc(C)cn3)CC2)C1	ZINC001034729877	1342724684	/nfs/dbraw/zinc/72/46/84/1342724684.db2.gz	QMBCTDZLDNKOTA-BRWVUGGUSA-N	0	3	342.487	3.219	20	30		EGEDHN
N#Cc1ccc(CNCc2ccc(CNC(=O)C3CC3)cc2)cc1F	ZINC001034805013	1342769087	/nfs/dbraw/zinc/76/90/87/1342769087.db2.gz	REJSEFNLTGJGJD-UHFFFAOYSA-N	0	3	337.398	3.013	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)Cc2cccc(F)c2)C12CCC2	ZINC001078799566	1357091311	/nfs/dbraw/zinc/09/13/11/1357091311.db2.gz	CWJOLDRWBVSSIR-HOTGVXAUSA-N	0	3	336.838	3.138	20	30		EGEDHN
C[C@@]1(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)s2)CC=CCC1	ZINC001034944397	1342845351	/nfs/dbraw/zinc/84/53/51/1342845351.db2.gz	DTZLHWQUBOFBKU-DNVCBOLYSA-N	0	3	343.496	3.447	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]1CNCc1cnc(Cl)s1	ZINC001035011565	1342875051	/nfs/dbraw/zinc/87/50/51/1342875051.db2.gz	FMLRRVJLKCCOJF-GFCCVEGCSA-N	0	3	341.908	3.479	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)N1CCC2(CCN(CC#Cc3ccccc3)C2)CC1	ZINC001035156972	1342972086	/nfs/dbraw/zinc/97/20/86/1342972086.db2.gz	OSMVDFOGJOTCJT-UYAOXDASSA-N	0	3	336.479	3.009	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC2(CCN(Cc3ccc(C#N)s3)C2)CC1	ZINC001035159475	1342977446	/nfs/dbraw/zinc/97/74/46/1342977446.db2.gz	GEZDLFRFKRZVJO-HNNXBMFYSA-N	0	3	345.512	3.480	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccc3cc(C)ccc3n1)CC2	ZINC001035748875	1343167782	/nfs/dbraw/zinc/16/77/82/1343167782.db2.gz	BFJCTBILBPIOLV-UHFFFAOYSA-N	0	3	347.462	3.105	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@@H]1CCCC[C@@H]1C1CC1)CC2	ZINC001035757249	1343172742	/nfs/dbraw/zinc/17/27/42/1343172742.db2.gz	IBMWJLOAEOCKRP-RTBURBONSA-N	0	3	328.500	3.151	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@H]1CC[C@H](C(F)(F)F)C1)CC2	ZINC001035777277	1343188148	/nfs/dbraw/zinc/18/81/48/1343188148.db2.gz	KUKPVLPDGKMRBA-GJZGRUSLSA-N	0	3	344.421	3.466	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cc1cc(C)cc(C)c1)CC2	ZINC001035782062	1343192822	/nfs/dbraw/zinc/19/28/22/1343192822.db2.gz	ACGBXYDLQCVJKF-UHFFFAOYSA-N	0	3	326.484	3.346	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@H]1CCc3ccccc3C1)CC2	ZINC001035805288	1343206723	/nfs/dbraw/zinc/20/67/23/1343206723.db2.gz	CTNMFOCDDDRXLU-FQEVSTJZSA-N	0	3	338.495	3.292	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc3ncsc3c1)CC2	ZINC001035847059	1343227545	/nfs/dbraw/zinc/22/75/45/1343227545.db2.gz	GHYOFMYZCDETCQ-UHFFFAOYSA-N	0	3	341.480	3.410	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@H](C)Oc1ccc(F)cc1)CC2	ZINC001035849618	1343229593	/nfs/dbraw/zinc/22/95/93/1343229593.db2.gz	FVGRJHCTPIQKAU-INIZCTEOSA-N	0	3	346.446	3.094	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H](OC)C1CCCCC1)CC2	ZINC001035865120	1343239042	/nfs/dbraw/zinc/23/90/42/1343239042.db2.gz	NWWQNVNVHONFBG-SFHVURJKSA-N	0	3	334.504	3.082	20	30		EGEDHN
C[C@H]1CN(C(=O)C2CCCC2)CC[C@@H]1NCc1ccccc1C#N	ZINC001035881327	1343245920	/nfs/dbraw/zinc/24/59/20/1343245920.db2.gz	VWBSPARTDVKXKA-KXBFYZLASA-N	0	3	325.456	3.075	20	30		EGEDHN
Cc1ccoc1C(=O)N1CC[C@H](NCc2ccccc2C#N)[C@H](C)C1	ZINC001035924525	1343274958	/nfs/dbraw/zinc/27/49/58/1343274958.db2.gz	SHRIULCONHRWFW-QAPCUYQASA-N	0	3	337.423	3.100	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2CCC2)CC[C@H]1NCc1ccccc1C#N	ZINC001035977771	1343296949	/nfs/dbraw/zinc/29/69/49/1343296949.db2.gz	OKDFTUHDSVPGSK-DNVCBOLYSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@@H](NCc2ccccc2C#N)[C@H](C)C1	ZINC001035981585	1343299618	/nfs/dbraw/zinc/29/96/18/1343299618.db2.gz	SVCMBLOTPJITNO-RHSMWYFYSA-N	0	3	329.419	3.148	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](NCc2ccn(C(C)C)n2)[C@@H](C)C1	ZINC001036140659	1343325144	/nfs/dbraw/zinc/32/51/44/1343325144.db2.gz	CZSLVSLZCBRSMV-DOTOQJQBSA-N	0	3	332.492	3.003	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](NCc2csc(CC)n2)[C@@H](C)C1	ZINC001036148715	1343330624	/nfs/dbraw/zinc/33/06/24/1343330624.db2.gz	FTCCTYNWPYLDRW-DZGCQCFKSA-N	0	3	335.517	3.244	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](NCc3cc(C4CC4)no3)[C@H](C)C2)C1	ZINC001036171389	1343344167	/nfs/dbraw/zinc/34/41/67/1343344167.db2.gz	XHQPSVXXRFFBQB-PBHICJAKSA-N	0	3	343.471	3.235	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]([C@@H](C)NCc2cc(C3CC3)no2)C1	ZINC001036429401	1343481789	/nfs/dbraw/zinc/48/17/89/1343481789.db2.gz	ULYDERLUODWTER-ZBFHGGJFSA-N	0	3	345.487	3.481	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@@H]([C@@H](C)NCc3cnc(C)o3)C2)CC1	ZINC001036431736	1343483712	/nfs/dbraw/zinc/48/37/12/1343483712.db2.gz	VLFTWMRUNGFQOX-CRAIPNDOSA-N	0	3	345.487	3.446	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@H]([C@H](C)NCc3ccccc3C#N)C2)CC1	ZINC001036439555	1343488613	/nfs/dbraw/zinc/48/86/13/1343488613.db2.gz	PWYNDSCQAOIOJP-LPHOPBHVSA-N	0	3	339.483	3.465	20	30		EGEDHN
CCCC(=O)N1CCC[C@H](C)[C@@H]1CNCc1cc(C#N)ccc1OC	ZINC001036483050	1343508654	/nfs/dbraw/zinc/50/86/54/1343508654.db2.gz	AZDZZHIRTRVHBE-YJBOKZPZSA-N	0	3	343.471	3.084	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)C(C)(C)F)[C@H]1CNCc1cc(C#N)ccc1F	ZINC001036501042	1343519664	/nfs/dbraw/zinc/51/96/64/1343519664.db2.gz	NRMRQGVQUGVKFM-DYVFJYSZSA-N	0	3	349.425	3.162	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@@H](C)[C@@H]1CNCc1ccc(C#N)s1	ZINC001036503588	1343521292	/nfs/dbraw/zinc/52/12/92/1343521292.db2.gz	ODUGIDZWYIJLSY-PBHICJAKSA-N	0	3	331.485	3.303	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccccc2C#N)C1	ZINC001036652401	1343602137	/nfs/dbraw/zinc/60/21/37/1343602137.db2.gz	RSOKFAILHFGDFU-VQTJNVASSA-N	0	3	339.483	3.417	20	30		EGEDHN
C/C=C(\C)C(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccc(C#N)c(F)c2)C1	ZINC001036682516	1343624681	/nfs/dbraw/zinc/62/46/81/1343624681.db2.gz	FFFCGOMYSCVWIA-HVAXQBDLSA-N	0	3	341.430	3.086	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@@H]3[C@H](CCN3CC#Cc3ccccc3)C2)co1	ZINC001036699574	1343638753	/nfs/dbraw/zinc/63/87/53/1343638753.db2.gz	RJZIDPIFVADKGK-TZIWHRDSSA-N	0	3	348.446	3.176	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2[C@@H](CCN2Cc2ccccc2C#N)C1	ZINC001036789872	1343719705	/nfs/dbraw/zinc/71/97/05/1343719705.db2.gz	YXFLNTREQUBNNK-OALUTQOASA-N	0	3	337.467	3.193	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2[C@@H](CCN2Cc2ccccc2F)C1	ZINC001036792894	1343725050	/nfs/dbraw/zinc/72/50/50/1343725050.db2.gz	WHYZECVXACPVEU-WMZOPIPTSA-N	0	3	330.447	3.461	20	30		EGEDHN
O=C([C@H]1C[C@H]2C[C@H]2C1)N1CC[C@@H]2[C@@H](CCN2CC#Cc2ccccc2)C1	ZINC001036798310	1343732115	/nfs/dbraw/zinc/73/21/15/1343732115.db2.gz	IZOTVNFENBVWQB-VNXMGFANSA-N	0	3	348.490	3.007	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCC[C@H]1NC(=O)C1CCCC1	ZINC001036923042	1343867109	/nfs/dbraw/zinc/86/71/09/1343867109.db2.gz	ZLKOHELCWIRTMQ-RTBURBONSA-N	0	3	325.456	3.123	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCC[C@H]1NC(=O)C1CCC1	ZINC001037138494	1343988173	/nfs/dbraw/zinc/98/81/73/1343988173.db2.gz	KVDDEVHTGUGMOE-RTBURBONSA-N	0	3	325.456	3.123	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCC[C@H]1NC(=O)c1ccoc1	ZINC001037147373	1343997758	/nfs/dbraw/zinc/99/77/58/1343997758.db2.gz	DZSUZFFIKBUAGR-IEBWSBKVSA-N	0	3	337.423	3.230	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCC[C@H]1NC(=O)c1ccccn1	ZINC001037159647	1344009276	/nfs/dbraw/zinc/00/92/76/1344009276.db2.gz	GYYCXJYKVQFOEB-RTBURBONSA-N	0	3	348.450	3.032	20	30		EGEDHN
CC[C@H]1CN(C(=O)CC2CC2)CC[C@H]1NCc1cc(F)ccc1C#N	ZINC001037756906	1344073404	/nfs/dbraw/zinc/07/34/04/1344073404.db2.gz	FTUZDONDPPMXLO-HNAYVOBHSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](NCc2csc(C)n2)[C@@H](CC)C1	ZINC001037895333	1344166762	/nfs/dbraw/zinc/16/67/62/1344166762.db2.gz	FNOGRWNXOXYSKY-GOEBONIOSA-N	0	3	335.517	3.380	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](NCc3cc(C)no3)[C@@H](CC)C2)C1	ZINC001037915778	1344176010	/nfs/dbraw/zinc/17/60/10/1344176010.db2.gz	RVHGXNNEJZAORH-RDJZCZTQSA-N	0	3	331.460	3.056	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@](C)(C=C)CC)CC[C@H]1c1ccc(F)cc1	ZINC001079157804	1357198344	/nfs/dbraw/zinc/19/83/44/1357198344.db2.gz	BZQUBPFFSCBDTF-ZVDOUQERSA-N	0	3	342.458	3.335	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)c3cccnc3)CC2)C1	ZINC001039109118	1344780621	/nfs/dbraw/zinc/78/06/21/1344780621.db2.gz	NVNVGUJHSPUXKF-KRWDZBQOSA-N	0	3	333.863	3.008	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC([C@H]2CCN(Cc3ccns3)C2)CC1	ZINC001039150010	1344833499	/nfs/dbraw/zinc/83/34/99/1344833499.db2.gz	HGONPLFVHFJHBR-INIZCTEOSA-N	0	3	347.528	3.416	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)[C@H]3C[C@H]4C[C@H]4C3)CC2)C1	ZINC001039151987	1344835404	/nfs/dbraw/zinc/83/54/04/1344835404.db2.gz	QBGHEBBRDCMLFE-WNRNVDISSA-N	0	3	336.907	3.346	20	30		EGEDHN
O=C(C(F)F)N1CCCC[C@H]1[C@@H]1CCN(CC#Cc2ccccc2)C1	ZINC001039183498	1344882291	/nfs/dbraw/zinc/88/22/91/1344882291.db2.gz	KSHUXVRRELKQDF-MSOLQXFVSA-N	0	3	346.421	3.006	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccoc2Cl)C1	ZINC001039199013	1344909605	/nfs/dbraw/zinc/90/96/05/1344909605.db2.gz	NXXLLNUAZHSRNH-ZBFHGGJFSA-N	0	3	334.847	3.273	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc(F)ccc2F)C1	ZINC001039212433	1344927704	/nfs/dbraw/zinc/92/77/04/1344927704.db2.gz	FZZYUYKPRRCNDU-HNAYVOBHSA-N	0	3	346.421	3.305	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)Cc2ccc(C)cc2)C1	ZINC001039220407	1344937869	/nfs/dbraw/zinc/93/78/69/1344937869.db2.gz	ZBIKCORBZOWTJY-RTWAWAEBSA-N	0	3	338.495	3.264	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccoc2C2CC2)C1	ZINC001039225045	1344942618	/nfs/dbraw/zinc/94/26/18/1344942618.db2.gz	KZSQMZHNPHNTEP-SJLPKXTDSA-N	0	3	326.440	3.107	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc3cc(C)ccc3[nH]2)C1	ZINC001039224853	1344943017	/nfs/dbraw/zinc/94/30/17/1344943017.db2.gz	IZSMXCDWAAGUKD-DYESRHJHSA-N	0	3	349.478	3.426	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cccc(Cl)c2F)C1	ZINC001039225507	1344943914	/nfs/dbraw/zinc/94/39/14/1344943914.db2.gz	PSSWHFZENWHRGP-PBHICJAKSA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2oc(C(C)C)nc2C)C1	ZINC001039236215	1344957921	/nfs/dbraw/zinc/95/79/21/1344957921.db2.gz	XNGMMMBTSJQJFZ-SJORKVTESA-N	0	3	343.471	3.056	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2oc(C(C)C)nc2C)C1	ZINC001039236214	1344958183	/nfs/dbraw/zinc/95/81/83/1344958183.db2.gz	XNGMMMBTSJQJFZ-IRXDYDNUSA-N	0	3	343.471	3.056	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cccc3cc[nH]c32)C1	ZINC001039236413	1344958219	/nfs/dbraw/zinc/95/82/19/1344958219.db2.gz	BTHLDGKXXSLKPQ-IEBWSBKVSA-N	0	3	335.451	3.118	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cccc3c2CCC3)C1	ZINC001039241425	1344966796	/nfs/dbraw/zinc/96/67/96/1344966796.db2.gz	AWXXYIYXYZDLIV-WIYYLYMNSA-N	0	3	336.479	3.125	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc3[nH]ccc3s2)C1	ZINC001039249456	1344979712	/nfs/dbraw/zinc/97/97/12/1344979712.db2.gz	IQWRFQQLHRGFFK-GDBMZVCRSA-N	0	3	341.480	3.179	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)CCc2ccc(C)s2)C1	ZINC001039252818	1344984474	/nfs/dbraw/zinc/98/44/74/1344984474.db2.gz	PUZBRDBTWBDWDY-MJGOQNOKSA-N	0	3	344.524	3.325	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)Cc2cc(C)ccc2F)C1	ZINC001039256059	1344986192	/nfs/dbraw/zinc/98/61/92/1344986192.db2.gz	HPGHGHWHMVKKNQ-YLJYHZDGSA-N	0	3	342.458	3.013	20	30		EGEDHN
N#Cc1ccccc1CNC1C[C@H]2CCC[C@@H](C1)N2C(=O)[C@@H]1CC12CC2	ZINC001039301295	1345003815	/nfs/dbraw/zinc/00/38/15/1345003815.db2.gz	HAKOJWIUJDIJCM-NXEWRWPSSA-N	0	3	349.478	3.360	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)Oc1cccc(F)c1	ZINC001039378706	1345034837	/nfs/dbraw/zinc/03/48/37/1345034837.db2.gz	FJKUUHBFNVKWHS-JQHSSLGASA-N	0	3	346.446	3.234	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1oc(C(F)F)cc1C	ZINC001039388891	1345040574	/nfs/dbraw/zinc/04/05/74/1345040574.db2.gz	PLWDHQXJADSAMI-KGLIPLIRSA-N	0	3	336.382	3.228	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(OC)cc1C	ZINC001039427548	1345063463	/nfs/dbraw/zinc/06/34/63/1345063463.db2.gz	ABDBASPXJMKIBR-SJORKVTESA-N	0	3	328.456	3.259	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)Cc1c(C)noc1C	ZINC001039449451	1345073800	/nfs/dbraw/zinc/07/38/00/1345073800.db2.gz	UPYRHFDFQBMQAO-OLMNPRSZSA-N	0	3	345.487	3.111	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)c1ccc(C)s1	ZINC001039459668	1345078994	/nfs/dbraw/zinc/07/89/94/1345078994.db2.gz	HTOVEHROGGESQH-BBWFWOEESA-N	0	3	330.497	3.249	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CCC[C@@H](C1)N2C[C@@H]1CCCOC1	ZINC001039823630	1345200476	/nfs/dbraw/zinc/20/04/76/1345200476.db2.gz	UORFMNSQCASMHT-OKZBNKHCSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cccc4scnc43)C2)C1	ZINC001040206502	1345375296	/nfs/dbraw/zinc/37/52/96/1345375296.db2.gz	XDHGIIFZGKZLJL-IBGZPJMESA-N	0	3	341.480	3.410	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3c(C)noc3C(C)C)C2)C1	ZINC001040252180	1345395898	/nfs/dbraw/zinc/39/58/98/1345395898.db2.gz	DOXCKQCGYIJKON-IBGZPJMESA-N	0	3	331.460	3.221	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(CC)s3)C2)C1	ZINC001040283164	1345411196	/nfs/dbraw/zinc/41/11/96/1345411196.db2.gz	ODJYEKJRBMHMIX-LJQANCHMSA-N	0	3	330.497	3.262	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ccc(CC)s3)C2)C1	ZINC001040283163	1345411715	/nfs/dbraw/zinc/41/17/15/1345411715.db2.gz	ODJYEKJRBMHMIX-IBGZPJMESA-N	0	3	330.497	3.262	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@]2(C1)CCCN(Cc1ccccn1)C2	ZINC001040373986	1345461287	/nfs/dbraw/zinc/46/12/87/1345461287.db2.gz	YFALXPJPSKZCMG-RTWAWAEBSA-N	0	3	341.499	3.498	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3ncsc3C3CC3)C2)C1	ZINC001040392858	1345472742	/nfs/dbraw/zinc/47/27/42/1345472742.db2.gz	XFTWGMYFXAZLKV-SFHVURJKSA-N	0	3	331.485	3.135	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@@H](CC)OC3CCCC3)C2)C1	ZINC001040432302	1345494520	/nfs/dbraw/zinc/49/45/20/1345494520.db2.gz	RTMSQURBSAZAKM-TZIWHRDSSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3sc(C)cc3OC)C2)C1	ZINC001040433016	1345495738	/nfs/dbraw/zinc/49/57/38/1345495738.db2.gz	RGMOLBBFNKHVON-GOSISDBHSA-N	0	3	334.485	3.179	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@H]3C[C@@H]3c3ccccc3)C2)C1	ZINC001040433721	1345496966	/nfs/dbraw/zinc/49/69/66/1345496966.db2.gz	YTRYBCFOVKQRIZ-RZUBCFFCSA-N	0	3	336.479	3.128	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@@H](C)c3ccc(C)o3)C2)C1	ZINC001040433943	1345497397	/nfs/dbraw/zinc/49/73/97/1345497397.db2.gz	BCQUISVWEDOKLK-FXAWDEMLSA-N	0	3	328.456	3.029	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)C[C@H]3CCc4ccccc43)C2)C1	ZINC001040461528	1345509902	/nfs/dbraw/zinc/50/99/02/1345509902.db2.gz	WFOQMVHFTHTFSE-DENIHFKCSA-N	0	3	336.479	3.054	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@@H](C)c3ccc(C)cc3)C2)C1	ZINC001040496016	1345520514	/nfs/dbraw/zinc/52/05/14/1345520514.db2.gz	CYCYZCARKVLZJV-SIKLNZKXSA-N	0	3	338.495	3.436	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@H](C)c3ccc(F)cc3F)C2)C1	ZINC001040537615	1345536235	/nfs/dbraw/zinc/53/62/35/1345536235.db2.gz	BLKKKVQMIPNKSA-FOIQADDNSA-N	0	3	346.421	3.016	20	30		EGEDHN
C=C[C@H](C(=O)N1CC[C@@]2(C1)CCCN(CC#CC)C2)c1ccccc1	ZINC001040538111	1345536252	/nfs/dbraw/zinc/53/62/52/1345536252.db2.gz	GFBRPQAAOWJNLF-UNMCSNQZSA-N	0	3	336.479	3.294	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@H](CC)c3ccc(F)cc3)C2)C1	ZINC001040546835	1345540956	/nfs/dbraw/zinc/54/09/56/1345540956.db2.gz	HBEAYSBAJMUYBR-TZIWHRDSSA-N	0	3	342.458	3.267	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)C3(C)C(C)(C)C3(C)C)C2)C1	ZINC001040551767	1345543486	/nfs/dbraw/zinc/54/34/86/1345543486.db2.gz	QTFBERZMFOYJPI-OAQYLSRUSA-N	0	3	330.516	3.397	20	30		EGEDHN
Cc1ccc(CN2CCC3(CCN(C(=O)[C@@H](C)C#N)C3)CC2)cc1F	ZINC001040642587	1345559004	/nfs/dbraw/zinc/55/90/04/1345559004.db2.gz	AJGDZCTVJXKHPE-INIZCTEOSA-N	0	3	343.446	3.108	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cccc(F)c3C)C2)CC1	ZINC001040709921	1345568465	/nfs/dbraw/zinc/56/84/65/1345568465.db2.gz	HDHKIBHIDISCMS-UHFFFAOYSA-N	0	3	328.431	3.086	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@@H]3CCC(C)=C(C)C3)C2)CC1	ZINC001040714798	1345569174	/nfs/dbraw/zinc/56/91/74/1345569174.db2.gz	NGYAXQIPEMALLT-LJQANCHMSA-N	0	3	328.500	3.461	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC2(C1)CCN(Cc1ocnc1C)CC2	ZINC001040798458	1345578811	/nfs/dbraw/zinc/57/88/11/1345578811.db2.gz	QMDFYAGXOKIHJR-UHFFFAOYSA-N	0	3	345.487	3.400	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cccc(C(F)F)c3)C2)CC1	ZINC001040920409	1345600733	/nfs/dbraw/zinc/60/07/33/1345600733.db2.gz	SOWFSEAVTWWAAN-UHFFFAOYSA-N	0	3	332.394	3.186	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cc(Cl)cn3CC)C2)CC1	ZINC001040941234	1345605808	/nfs/dbraw/zinc/60/58/08/1345605808.db2.gz	KUGQAFSGIMFOAE-UHFFFAOYSA-N	0	3	347.890	3.113	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cccc(OCCC)c3)C2)C1	ZINC001041336966	1345705346	/nfs/dbraw/zinc/70/53/46/1345705346.db2.gz	WJSUURFPDLWGGV-NRFANRHFSA-N	0	3	340.467	3.037	20	30		EGEDHN
Cc1cocc1C(=O)N1CC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001041549237	1345761467	/nfs/dbraw/zinc/76/14/67/1345761467.db2.gz	NQBJLUCMDZMZCQ-NRFANRHFSA-N	0	3	349.434	3.198	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)[C@H](C)Cc3ccccc3Cl)C2)C1	ZINC001041714968	1345828737	/nfs/dbraw/zinc/82/87/37/1345828737.db2.gz	AXDPSYYXYXIYHM-OXQOHEQNSA-N	0	3	344.886	3.076	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)C[C@H](C)c3ccccc3F)C2)C1	ZINC001041741647	1345838175	/nfs/dbraw/zinc/83/81/75/1345838175.db2.gz	RLDSKVLWTBJJLS-UWJYYQICSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3cccc(Cl)c3Cl)C2)C1	ZINC001041801757	1345855565	/nfs/dbraw/zinc/85/55/65/1345855565.db2.gz	NQPPOAXRFQTDRB-QGZVFWFLSA-N	0	3	337.250	3.165	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3cc4c(s3)CC[C@H](C)C4)C2)C1	ZINC001041825438	1345864859	/nfs/dbraw/zinc/86/48/59/1345864859.db2.gz	LERXTYYNVSDXPM-YWZLYKJASA-N	0	3	342.508	3.044	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)CC[C@@H]3CCc4ccccc43)C2)C1	ZINC001041842952	1345869776	/nfs/dbraw/zinc/86/97/76/1345869776.db2.gz	KPWVFWLMAZSXJX-UGKGYDQZSA-N	0	3	336.479	3.054	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccc(C(C)C)s3)C2)C1	ZINC001041847705	1345872779	/nfs/dbraw/zinc/87/27/79/1345872779.db2.gz	CBFOYAXNZJBBRF-LJQANCHMSA-N	0	3	330.497	3.433	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccc(CC)c(CC)c3)C2)C1	ZINC001041868026	1345877534	/nfs/dbraw/zinc/87/75/34/1345877534.db2.gz	ZTBLYXCUUGHGNM-QFIPXVFZSA-N	0	3	338.495	3.373	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CCN(C(=O)C4=CCCC4)C[C@@H]32)cc1	ZINC001042009226	1345923823	/nfs/dbraw/zinc/92/38/23/1345923823.db2.gz	CJTLTKYQHLEUFI-QUCCMNQESA-N	0	3	335.451	3.091	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@H]2CCN(Cc3ccc(C#N)cc3)[C@H]2C1	ZINC001042014415	1345925679	/nfs/dbraw/zinc/92/56/79/1345925679.db2.gz	RLYSEXHTRQAVOS-MSOLQXFVSA-N	0	3	341.430	3.244	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc4ccccc4nc3C)C[C@@H]21	ZINC001042085758	1345940390	/nfs/dbraw/zinc/94/03/90/1345940390.db2.gz	QTUMCYJGINHHDE-JXFKEZNVSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(C4CC4)[nH]c3C3CC3)C[C@H]21	ZINC001042114330	1345947526	/nfs/dbraw/zinc/94/75/26/1345947526.db2.gz	JWNZQMGSEHRWNB-DNVCBOLYSA-N	0	3	339.483	3.492	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)Cc3ccc(C)c(Cl)c3)C[C@H]21	ZINC001042114479	1345947598	/nfs/dbraw/zinc/94/75/98/1345947598.db2.gz	KTUTTZDWKKHLQS-IEBWSBKVSA-N	0	3	344.886	3.137	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cn(CC)c4ccccc34)C[C@H]21	ZINC001042142058	1345955175	/nfs/dbraw/zinc/95/51/75/1345955175.db2.gz	KVOFYNYPZSCQMB-LAUBAEHRSA-N	0	3	349.478	3.221	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)Cc3cccc(C)c3Cl)C[C@@H]21	ZINC001042150017	1345957306	/nfs/dbraw/zinc/95/73/06/1345957306.db2.gz	VUTOQZIYQMCIQR-AEFFLSMTSA-N	0	3	344.886	3.137	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cc(C)ccc3C3CC3)C[C@@H]21	ZINC001042162504	1345961273	/nfs/dbraw/zinc/96/12/73/1345961273.db2.gz	IXGQYRRKPGWEFJ-RXVVDRJESA-N	0	3	336.479	3.432	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cc4ccc(C)cc4[nH]3)C[C@@H]21	ZINC001042168010	1345963833	/nfs/dbraw/zinc/96/38/33/1345963833.db2.gz	QPKJYEQFOCTXLY-UZLBHIALSA-N	0	3	335.451	3.036	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CCN(C(=O)[C@H]4C[C@H]5C[C@H]5C4)C[C@H]32)c1	ZINC001042196050	1345978563	/nfs/dbraw/zinc/97/85/63/1345978563.db2.gz	GIVMXCMCQNGPSW-CRSSMBPESA-N	0	3	349.478	3.027	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc(Cl)c(C)c3)C[C@@H]21	ZINC001042214976	1345988961	/nfs/dbraw/zinc/98/89/61/1345988961.db2.gz	WSDCNBZBKROQHH-YJBOKZPZSA-N	0	3	330.859	3.208	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3noc4c3CCCCC4)C[C@H]21	ZINC001042250821	1346005632	/nfs/dbraw/zinc/00/56/32/1346005632.db2.gz	DVKKHDXJOLNMSH-NVXWUHKLSA-N	0	3	343.471	3.056	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3cnc(C(C)C)nc3C)C[C@H]21	ZINC001042259166	1346009292	/nfs/dbraw/zinc/00/92/92/1346009292.db2.gz	FUZRBPHMTJCXGO-FUHWJXTLSA-N	0	3	342.487	3.021	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3oc(CC(C)C)nc3C)C[C@@H]21	ZINC001042261869	1346009827	/nfs/dbraw/zinc/00/98/27/1346009827.db2.gz	AQMIGBHXVDLQJZ-SJORKVTESA-N	0	3	345.487	3.294	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(F)c4ncccc4c3)C[C@H]21	ZINC001042271524	1346014232	/nfs/dbraw/zinc/01/42/32/1346014232.db2.gz	ZLUXQVJUPNIUBU-KBXCAEBGSA-N	0	3	339.414	3.096	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccccc3OCC(C)C)C[C@@H]21	ZINC001042271757	1346014292	/nfs/dbraw/zinc/01/42/92/1346014292.db2.gz	FWZRLZIXYBCLAJ-HKUYNNGSSA-N	0	3	342.483	3.444	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc4sccc4c3)C[C@@H]21	ZINC001042296950	1346021621	/nfs/dbraw/zinc/02/16/21/1346021621.db2.gz	JOCLAHQYWYATNA-QAPCUYQASA-N	0	3	338.476	3.461	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cnn(C4CCCC4)c3C)C[C@H]21	ZINC001042306332	1346025985	/nfs/dbraw/zinc/02/59/85/1346025985.db2.gz	FZMHSNMYQKLKIS-VQIMIIECSA-N	0	3	342.487	3.029	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cc(C)n(C(C)C)c3C)C[C@H]21	ZINC001042345807	1346047920	/nfs/dbraw/zinc/04/79/20/1346047920.db2.gz	NQVRMRFKDUMPHO-AZUAARDMSA-N	0	3	341.499	3.246	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)CCc3ccc(CC)cc3)C[C@@H]21	ZINC001042351941	1346051630	/nfs/dbraw/zinc/05/16/30/1346051630.db2.gz	VIJVKQLIEKSUCL-RTWAWAEBSA-N	0	3	338.495	3.128	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)CCc3ccc(CC)cc3)C[C@H]21	ZINC001042351939	1346051882	/nfs/dbraw/zinc/05/18/82/1346051882.db2.gz	VIJVKQLIEKSUCL-LEWJYISDSA-N	0	3	338.495	3.128	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(OCC4CC4)cc3)C[C@H]21	ZINC001042354794	1346053126	/nfs/dbraw/zinc/05/31/26/1346053126.db2.gz	GWLYUMTVQCCUJE-FXAWDEMLSA-N	0	3	340.467	3.198	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2cc(F)ccc2C#N)CCN1C(=O)c1ccoc1	ZINC001044457218	1346337701	/nfs/dbraw/zinc/33/77/01/1346337701.db2.gz	FSGFDTGRVAXAQP-FZKQIMNGSA-N	0	3	341.386	3.073	20	30		EGEDHN
C[C@H]1C[C@@H](NCc2cc(F)ccc2C#N)CCN1C(=O)C1CC=CC1	ZINC001044524216	1346356324	/nfs/dbraw/zinc/35/63/24/1346356324.db2.gz	SUQXQXUDCWLLCO-LIRRHRJNSA-N	0	3	341.430	3.133	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)C23CCC(CC2)C3)s1	ZINC001045094475	1346493767	/nfs/dbraw/zinc/49/37/67/1346493767.db2.gz	FGAMAXPHWHZWPE-HVEKOLDVSA-N	0	3	343.496	3.281	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@H]2CNCc2cc(C)ns2)CC1	ZINC001045182518	1346517806	/nfs/dbraw/zinc/51/78/06/1346517806.db2.gz	VJKTYDRMTZWPFX-INIZCTEOSA-N	0	3	333.501	3.279	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)C(C2CC2)C2CC2)s1	ZINC001045268893	1346544399	/nfs/dbraw/zinc/54/43/99/1346544399.db2.gz	FTVUJRRWUMCJHV-HNNXBMFYSA-N	0	3	343.496	3.137	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1	ZINC001045404106	1346585188	/nfs/dbraw/zinc/58/51/88/1346585188.db2.gz	KRVWBDXDRIJJMW-QGZVFWFLSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)[C@@H]2C[C@H]2c2ccccc2CC)CC1	ZINC001045537332	1346621107	/nfs/dbraw/zinc/62/11/07/1346621107.db2.gz	WRNJHLLSRYACTQ-VQTJNVASSA-N	0	3	338.495	3.347	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1cccc(C#N)c1	ZINC001045857875	1346722755	/nfs/dbraw/zinc/72/27/55/1346722755.db2.gz	NRAALUYCEQDHMZ-AHRSYUTCSA-N	0	3	339.483	3.416	20	30		EGEDHN
Cc1c[nH]cc1C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1cccc(C#N)c1	ZINC001045889739	1346734791	/nfs/dbraw/zinc/73/47/91/1346734791.db2.gz	RTIMZLVBVVEYEE-MOPGFXCFSA-N	0	3	348.450	3.074	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccccc1F)C2	ZINC001045908108	1346745058	/nfs/dbraw/zinc/74/50/58/1346745058.db2.gz	BCSWBMBSDNQENS-HXUWFJFHSA-N	0	3	328.431	3.167	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCCC[C@]2(CCN(Cc3ccccc3F)C2)C1	ZINC001045925012	1346761487	/nfs/dbraw/zinc/76/14/87/1346761487.db2.gz	QATOPBJBCBZHBW-OXQOHEQNSA-N	0	3	343.446	3.190	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1sccc1Cl)C2	ZINC001045940314	1346776458	/nfs/dbraw/zinc/77/64/58/1346776458.db2.gz	VZJMSSHZQBLCKF-KRWDZBQOSA-N	0	3	336.888	3.353	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1conc1C(C)C)C2	ZINC001045943668	1346779588	/nfs/dbraw/zinc/77/95/88/1346779588.db2.gz	LMYZABHTDYESEJ-FQEVSTJZSA-N	0	3	343.471	3.140	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)Cc1ccccc1CC)C2	ZINC001045947268	1346782538	/nfs/dbraw/zinc/78/25/38/1346782538.db2.gz	KIUVNLLJJCPSKP-QFIPXVFZSA-N	0	3	338.495	3.129	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)C[C@H]1C=CCCC1)C2	ZINC001045947943	1346783190	/nfs/dbraw/zinc/78/31/90/1346783190.db2.gz	QCUPNACVAUCZHE-FPOVZHCZSA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccn(C(C)C)c1C)C2	ZINC001045961746	1346796833	/nfs/dbraw/zinc/79/68/33/1346796833.db2.gz	SJDLKTOFLVOKKJ-OAQYLSRUSA-N	0	3	341.499	3.329	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H](CC)OC1CCCC1)C2	ZINC001045971071	1346807265	/nfs/dbraw/zinc/80/72/65/1346807265.db2.gz	MHHCBVJSXQHZRM-TZIWHRDSSA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@H](C)c1ccc(C)o1)C2	ZINC001045971719	1346807842	/nfs/dbraw/zinc/80/78/42/1346807842.db2.gz	QWRVJXPILZULFG-XLIONFOSSA-N	0	3	328.456	3.029	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc3cnccc3c1)C2	ZINC001045977724	1346814065	/nfs/dbraw/zinc/81/40/65/1346814065.db2.gz	HGIQJISBXXJIAR-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1sccc1OC)C2	ZINC001045980443	1346817221	/nfs/dbraw/zinc/81/72/21/1346817221.db2.gz	YPXNAKWKOBCTEZ-IBGZPJMESA-N	0	3	346.496	3.098	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cccc(Cl)c1)C2	ZINC001045980780	1346818449	/nfs/dbraw/zinc/81/84/49/1346818449.db2.gz	JFVCDLQMJPRGTM-LJQANCHMSA-N	0	3	330.859	3.291	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1c[nH]c3ccc(C)cc13)C2	ZINC001045986060	1346826959	/nfs/dbraw/zinc/82/69/59/1346826959.db2.gz	GCEANWLYAMMUAJ-QFIPXVFZSA-N	0	3	349.478	3.428	20	30		EGEDHN
C=CCN1CC[C@@H](N2CCN(C(=O)CCC3CCCCCC3)CC2)C1	ZINC001046043336	1346831790	/nfs/dbraw/zinc/83/17/90/1346831790.db2.gz	CDODXCUHWNFJHL-HXUWFJFHSA-N	0	3	347.547	3.142	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2ccc3c(c2)C(C)(C)CO3)C1	ZINC001046477048	1346988525	/nfs/dbraw/zinc/98/85/25/1346988525.db2.gz	OAAZCDBTZYRWJF-HXUWFJFHSA-N	0	3	328.456	3.127	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2F)C1	ZINC001046509594	1346999189	/nfs/dbraw/zinc/99/91/89/1346999189.db2.gz	ZNDBJCSUFYGRIN-FCEWJHQRSA-N	0	3	334.410	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2cc(F)c3ncccc3c2)C1	ZINC001046705748	1347068539	/nfs/dbraw/zinc/06/85/39/1347068539.db2.gz	CJBOMXCBFXSACZ-LJQANCHMSA-N	0	3	327.403	3.144	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@]2(C)CCN(Cc3ccc(C)cc3C)C2)cn1	ZINC001046779665	1347097068	/nfs/dbraw/zinc/09/70/68/1347097068.db2.gz	XHSHYQGSVJQJAA-QFIPXVFZSA-N	0	3	347.462	3.074	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@]2(C)CCN(Cc3cccc(CC)c3)C2)nc1	ZINC001046781240	1347097446	/nfs/dbraw/zinc/09/74/46/1347097446.db2.gz	GFQVCBRMUACFRG-QFIPXVFZSA-N	0	3	347.462	3.020	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@]2(C)CCN(Cc3ccccc3CC)C2)cn1	ZINC001046784148	1347099649	/nfs/dbraw/zinc/09/96/49/1347099649.db2.gz	YBPDGVRAUHQPSM-JOCHJYFZSA-N	0	3	347.462	3.020	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2ccc(N(C)CCC)cc2)C1	ZINC001046878034	1347141963	/nfs/dbraw/zinc/14/19/63/1347141963.db2.gz	WCLMBPUJZGEFSP-FQEVSTJZSA-N	0	3	329.488	3.303	20	30		EGEDHN
C#CCCN1CC[C@](C)(NC(=O)c2cc3cccc(Cl)c3o2)C1	ZINC001046880551	1347142715	/nfs/dbraw/zinc/14/27/15/1347142715.db2.gz	KABJRKIXEURKSY-SFHVURJKSA-N	0	3	330.815	3.304	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2ccccc2F)C1	ZINC001046908792	1347148735	/nfs/dbraw/zinc/14/87/35/1347148735.db2.gz	PTEDEFZGOGDRJW-CYBMUJFWSA-N	0	3	326.362	3.089	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2sccc2C)C1	ZINC001046910939	1347149975	/nfs/dbraw/zinc/14/99/75/1347149975.db2.gz	UUAQYZVBJKOFSG-CYBMUJFWSA-N	0	3	328.428	3.320	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2cc(C)c(C)o2)C1	ZINC001046928906	1347155514	/nfs/dbraw/zinc/15/55/14/1347155514.db2.gz	VRVWZSWVYKTDHQ-AWEZNQCLSA-N	0	3	326.387	3.160	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@@H](CNC(=O)[C@@H]2CCCC3(CC3)C2)C1	ZINC001046939163	1347158053	/nfs/dbraw/zinc/15/80/53/1347158053.db2.gz	KJKCRAZTGKFYJM-CVEARBPZSA-N	0	3	338.442	3.054	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2c(C)nsc2C)C1	ZINC001046996658	1347179297	/nfs/dbraw/zinc/17/92/97/1347179297.db2.gz	WLRKSAZOFJZTAS-ZDUSSCGKSA-N	0	3	343.443	3.023	20	30		EGEDHN
O=C(CC1CCC1)N[C@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1ccccc1)C2	ZINC001047043778	1347194584	/nfs/dbraw/zinc/19/45/84/1347194584.db2.gz	CRPAPAPPEOEKIQ-ACRUOGEOSA-N	0	3	336.479	3.197	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@H]3C[C@@H](C2)N(Cc2oc(C)nc2C)C3)C1	ZINC001047144393	1347219794	/nfs/dbraw/zinc/21/97/94/1347219794.db2.gz	ZYBWDFHJBAREAW-ULQDDVLXSA-N	0	3	343.471	3.117	20	30		EGEDHN
CC(C)(C)C(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(Cc1ccc(C#N)c(F)c1)C2	ZINC001047187600	1347235091	/nfs/dbraw/zinc/23/50/91/1347235091.db2.gz	DXUFPHZLRSARPM-XIRDDKMYSA-N	0	3	343.446	3.213	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3ccc(F)cc3)C2)CC1	ZINC001047219374	1347250944	/nfs/dbraw/zinc/25/09/44/1347250944.db2.gz	MDHWDSQGRZWRGJ-GOSISDBHSA-N	0	3	328.431	3.023	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3ccc(F)cc3)C2)CC1	ZINC001047219377	1347251462	/nfs/dbraw/zinc/25/14/62/1347251462.db2.gz	MDHWDSQGRZWRGJ-SFHVURJKSA-N	0	3	328.431	3.023	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)c3ccc(C)o3)C2)CC1	ZINC001047223656	1347254105	/nfs/dbraw/zinc/25/41/05/1347254105.db2.gz	MLFYKJCQTZNVSA-GOSISDBHSA-N	0	3	328.456	3.176	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3oc(C)cc3C)C2)CC1	ZINC001047232906	1347261407	/nfs/dbraw/zinc/26/14/07/1347261407.db2.gz	QPLJFSAGWVCDLO-GOSISDBHSA-N	0	3	328.456	3.094	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@H]3[C@@H]4CCCC[C@@H]43)C2)CC1	ZINC001047232834	1347261421	/nfs/dbraw/zinc/26/14/21/1347261421.db2.gz	PIMSKFAGWNDQGJ-ZRNYENFQSA-N	0	3	328.500	3.006	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3cscc3C)C2)CC1	ZINC001047233362	1347262039	/nfs/dbraw/zinc/26/20/39/1347262039.db2.gz	YGVMETGRTIMSSM-QGZVFWFLSA-N	0	3	330.497	3.254	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)Cc3ccc(C)o3)C2)CC1	ZINC001047234970	1347263013	/nfs/dbraw/zinc/26/30/13/1347263013.db2.gz	UVMAJXJMZRAQTG-IBGZPJMESA-N	0	3	342.483	3.104	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3cc(C)cs3)C2)CC1	ZINC001047238644	1347265156	/nfs/dbraw/zinc/26/51/56/1347265156.db2.gz	CELVIIVOEIATPN-QGZVFWFLSA-N	0	3	330.497	3.254	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)c3ccc(CC)o3)C2)CC1	ZINC001047245908	1347270987	/nfs/dbraw/zinc/27/09/87/1347270987.db2.gz	GDHJEKJWVVYCPO-SFHVURJKSA-N	0	3	342.483	3.430	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)Cc3ccccc3)C2)CC1	ZINC001047246290	1347271112	/nfs/dbraw/zinc/27/11/12/1347271112.db2.gz	KJNYMBXDEKZVER-NRFANRHFSA-N	0	3	338.495	3.203	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3cc[nH]c3C3CC3)C2)CC1	ZINC001047247143	1347272459	/nfs/dbraw/zinc/27/24/59/1347272459.db2.gz	CTBFCGWDSIRCFB-SFHVURJKSA-N	0	3	339.483	3.090	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@@H]3C[C@H]3C(C)(C)C)C2)CC1	ZINC001047250155	1347274693	/nfs/dbraw/zinc/27/46/93/1347274693.db2.gz	DNAWJQWONWAPAT-GUDVDZBRSA-N	0	3	330.516	3.252	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3ccc4[nH]ccc4c3)C2)CC1	ZINC001047252790	1347277394	/nfs/dbraw/zinc/27/73/94/1347277394.db2.gz	JPPKHFBZGYKCQG-FQEVSTJZSA-N	0	3	349.478	3.365	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)C3(C(C)(F)F)CC3)C2)CC1	ZINC001047255746	1347279466	/nfs/dbraw/zinc/27/94/66/1347279466.db2.gz	CXTBZJAYFQTBOX-MRXNPFEDSA-N	0	3	338.442	3.006	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@@H](C)Cc3ccco3)C2)CC1	ZINC001047257731	1347280682	/nfs/dbraw/zinc/28/06/82/1347280682.db2.gz	PNOLTEAVMYHKQU-HKUYNNGSSA-N	0	3	342.483	3.042	20	30		EGEDHN
C[C@@H](NCc1cc(F)ccc1C#N)[C@@H]1CCN(C(=O)CC(C)(C)C)C1	ZINC001047711939	1347344547	/nfs/dbraw/zinc/34/45/47/1347344547.db2.gz	DISKFWONJSNKET-GDBMZVCRSA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)CC(C)(C)C)C1	ZINC001047717630	1347347805	/nfs/dbraw/zinc/34/78/05/1347347805.db2.gz	XWNAPJRBTZDETP-MAUKXSAKSA-N	0	3	327.472	3.321	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@@H]([C@@H](C)NCc2ccccc2C#N)C1	ZINC001047723536	1347350603	/nfs/dbraw/zinc/35/06/03/1347350603.db2.gz	BHRGVIZBTRBDEF-DNVCBOLYSA-N	0	3	327.472	3.321	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@@H]([C@@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001047733090	1347354789	/nfs/dbraw/zinc/35/47/89/1347354789.db2.gz	RCPYCIQAPLBZRF-RHSMWYFYSA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)CCC2CC2)C1	ZINC001047766268	1347364809	/nfs/dbraw/zinc/36/48/09/1347364809.db2.gz	NUPUMTUGPYQIEQ-HNAYVOBHSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)C2C=CC=CC=C2)C1	ZINC001047859736	1347391705	/nfs/dbraw/zinc/39/17/05/1347391705.db2.gz	WMMQMQCOSGSEME-LAUBAEHRSA-N	0	3	347.462	3.183	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]([C@H](C)NCc2nc(C)cs2)C1	ZINC001047929247	1347413509	/nfs/dbraw/zinc/41/35/09/1347413509.db2.gz	QDHXONKKIXVHGI-GJZGRUSLSA-N	0	3	335.517	3.380	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]([C@H](C)NCc3csc(CC)n3)C2)C1	ZINC001047965106	1347427041	/nfs/dbraw/zinc/42/70/41/1347427041.db2.gz	JEEMUEGEXMEMDP-GJZGRUSLSA-N	0	3	347.528	3.388	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)C2(CF)CCC2)C1	ZINC001047987075	1347434922	/nfs/dbraw/zinc/43/49/22/1347434922.db2.gz	XYBCZWSGFZCBHJ-QAPCUYQASA-N	0	3	343.446	3.025	20	30		EGEDHN
C[C@H]1CN(C(=O)C#CC2CC2)C[C@H]1CNCc1c(F)cccc1Cl	ZINC001048246110	1347501558	/nfs/dbraw/zinc/50/15/58/1347501558.db2.gz	MDZBVHVOOXZBCR-DZGCQCFKSA-N	0	3	348.849	3.077	20	30		EGEDHN
C[C@H]1CN(C(=O)C2(C)CCCC2)C[C@H]1CNCc1ccccc1C#N	ZINC001048328639	1347519640	/nfs/dbraw/zinc/51/96/40/1347519640.db2.gz	NWEYNQIENMGODT-QFBILLFUSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](C)[C@@H](CNCc2nc(C)cs2)C1	ZINC001048337596	1347522454	/nfs/dbraw/zinc/52/24/54/1347522454.db2.gz	DYQWKCGTCHNNQK-ZFWWWQNUSA-N	0	3	335.517	3.238	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2(C)CCC2)C[C@@H]1CNCc1cc(F)ccc1C#N	ZINC001048345767	1347525332	/nfs/dbraw/zinc/52/53/32/1347525332.db2.gz	WSVIYGQYGWUZBI-PBHICJAKSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H](CNCc3nccs3)[C@H](C)C2)CC1	ZINC001048370336	1347532954	/nfs/dbraw/zinc/53/29/54/1347532954.db2.gz	ROOGLNAZDBKYAR-GDBMZVCRSA-N	0	3	333.501	3.074	20	30		EGEDHN
C[C@@H]1C[C@@H]1C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2CC#Cc1ccccc1	ZINC001048497923	1347568209	/nfs/dbraw/zinc/56/82/09/1347568209.db2.gz	ADMQJZNKXYUTDI-RQXATKFSSA-N	0	3	336.479	3.053	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)[C@]23C[C@H]2CCC3)CC1	ZINC001048626532	1347624471	/nfs/dbraw/zinc/62/44/71/1347624471.db2.gz	SAAHILCWNHFQEZ-DYESRHJHSA-N	0	3	339.483	3.251	20	30		EGEDHN
C[C@H](C(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@H]2C1)C(C)(C)C	ZINC001048893362	1347677992	/nfs/dbraw/zinc/67/79/92/1347677992.db2.gz	VGOHDCLSEPAPMH-LZQZEXGQSA-N	0	3	339.483	3.131	20	30		EGEDHN
CC1(C(=O)N2C[C@H]3CN(Cc4cccc(C#N)c4)C[C@H]3C2)CCCC1	ZINC001048967477	1347694051	/nfs/dbraw/zinc/69/40/51/1347694051.db2.gz	YUSDBJUOWCNYTR-KDURUIRLSA-N	0	3	337.467	3.029	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@H]2C1	ZINC001049025015	1347709334	/nfs/dbraw/zinc/70/93/34/1347709334.db2.gz	DBCWDSIUVKHVDL-ZVDOUQERSA-N	0	3	337.467	3.051	20	30		EGEDHN
C/C(=C\C(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1ccc(C#N)cc1)C1CC1	ZINC001049351609	1347800771	/nfs/dbraw/zinc/80/07/71/1347800771.db2.gz	LYDRVKAVUCWMCG-UZAOCVSLSA-N	0	3	349.478	3.480	20	30		EGEDHN
CC1CC(C(=O)N2CCC[C@@H]3[C@H]2CCN3Cc2ccc(C#N)cc2)C1	ZINC001049408035	1347830760	/nfs/dbraw/zinc/83/07/60/1347830760.db2.gz	TZXUUHRJFVNGER-CVMOCDCISA-N	0	3	337.467	3.170	20	30		EGEDHN
Cc1ccc(F)cc1CN1CC[C@H]2[C@H]1CCCN2C(=O)C#CC1CC1	ZINC001049466595	1347862678	/nfs/dbraw/zinc/86/26/78/1347862678.db2.gz	GYYFFKZDHMDXRS-UXHICEINSA-N	0	3	340.442	3.113	20	30		EGEDHN
C=CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cnc([C@H](C)OC)s1	ZINC001049472257	1347865004	/nfs/dbraw/zinc/86/50/04/1347865004.db2.gz	ADGQTFFWFLIIMS-SOUVJXGZSA-N	0	3	349.500	3.106	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1sccc1C	ZINC001049475334	1347866403	/nfs/dbraw/zinc/86/64/03/1347866403.db2.gz	SZTQXDVFOFXTMV-TVFCKZIOSA-N	0	3	342.508	3.249	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(C)c(OC)c(C)c1	ZINC001049493411	1347875792	/nfs/dbraw/zinc/87/57/92/1347875792.db2.gz	YYEWJJIWENKIBM-RTBURBONSA-N	0	3	340.467	3.014	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)C2(C3CC3)CC2)c1	ZINC001049541332	1347899077	/nfs/dbraw/zinc/89/90/77/1347899077.db2.gz	OIENYBZWABQQRZ-VQTJNVASSA-N	0	3	349.478	3.314	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC001049551439	1347904411	/nfs/dbraw/zinc/90/44/11/1347904411.db2.gz	FZZAPEZSLKQWMU-WCVJEAGWSA-N	0	3	342.405	3.382	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(C)n([C@@H](C)CC)n1	ZINC001049564687	1347912351	/nfs/dbraw/zinc/91/23/51/1347912351.db2.gz	PITPMPUBTKAHAT-BMGDILEWSA-N	0	3	330.476	3.027	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1coc2cc(F)ccc12	ZINC001049565648	1347912965	/nfs/dbraw/zinc/91/29/65/1347912965.db2.gz	VVVQLAKCCYHAOH-SJORKVTESA-N	0	3	328.387	3.437	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1coc2ccc(OC)cc21	ZINC001049586664	1347923904	/nfs/dbraw/zinc/92/39/04/1347923904.db2.gz	UXIWMARMBNKOMJ-ROUUACIJSA-N	0	3	340.423	3.306	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](C)c1c(F)cccc1F	ZINC001049595843	1347928579	/nfs/dbraw/zinc/92/85/79/1347928579.db2.gz	TYLXUNAVMCCPQM-IAOVAPTHSA-N	0	3	334.410	3.320	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](C)c1c(F)cccc1F	ZINC001049595845	1347928975	/nfs/dbraw/zinc/92/89/75/1347928975.db2.gz	TYLXUNAVMCCPQM-RRQGHBQHSA-N	0	3	334.410	3.320	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(C)c2cccnc12	ZINC001049598281	1347930034	/nfs/dbraw/zinc/93/00/34/1347930034.db2.gz	MIJOXJBEQJDGOK-PMACEKPBSA-N	0	3	347.462	3.245	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)CCc1cccc(Cl)c1	ZINC001049625056	1347940670	/nfs/dbraw/zinc/94/06/70/1347940670.db2.gz	GMIXNCRXWGAJIM-MOPGFXCFSA-N	0	3	344.886	3.361	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]2[C@H]1CCN2CCc1csc(C)n1	ZINC001049643091	1347950669	/nfs/dbraw/zinc/95/06/69/1347950669.db2.gz	CPFTVDSJFMQUIX-IAGOWNOFSA-N	0	3	347.528	3.272	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1c(F)ccc(F)c1F	ZINC001049677358	1347968418	/nfs/dbraw/zinc/96/84/18/1347968418.db2.gz	UIACQYBWZJMHMW-CABCVRRESA-N	0	3	338.373	3.359	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccccc1-n1cccc1	ZINC001049686803	1347971794	/nfs/dbraw/zinc/97/17/94/1347971794.db2.gz	HOEIWEKPHLPPCH-UXHICEINSA-N	0	3	335.451	3.342	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc2occc2s1	ZINC001049718269	1347989438	/nfs/dbraw/zinc/98/94/38/1347989438.db2.gz	LIZBECVYEHXKBN-UONOGXRCSA-N	0	3	328.437	3.197	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H]1[C@@H]2CCCCCC[C@@H]21	ZINC001049749272	1347998950	/nfs/dbraw/zinc/99/89/50/1347998950.db2.gz	QXXZHLMYJPIYMY-IVDHNXQLSA-N	0	3	328.500	3.291	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1c[nH]c2c1cccc2C	ZINC001049763074	1348007721	/nfs/dbraw/zinc/00/77/21/1348007721.db2.gz	UCSLHGDALRWXPG-WOJBJXKFSA-N	0	3	349.478	3.107	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)C1(Cc2ccc(F)cc2)CC1	ZINC001049772940	1348014875	/nfs/dbraw/zinc/01/48/75/1348014875.db2.gz	MFDHDRJRCOKDQD-OALUTQOASA-N	0	3	342.458	3.400	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccccc1F	ZINC001049785830	1348021634	/nfs/dbraw/zinc/02/16/34/1348021634.db2.gz	ZJNGBFBAXGCBNJ-QFHJOOASSA-N	0	3	328.431	3.181	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cccc(F)c1OCC	ZINC001049814905	1348034096	/nfs/dbraw/zinc/03/40/96/1348034096.db2.gz	PGGVGDRHACWPBO-DLBZAZTESA-N	0	3	332.419	3.089	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cnc2ccc(F)cc2c1	ZINC001049825022	1348041379	/nfs/dbraw/zinc/04/13/79/1348041379.db2.gz	LPLLGLXNCPGRPK-OALUTQOASA-N	0	3	339.414	3.239	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cnn(C(CC)CC)c1C	ZINC001049835837	1348048956	/nfs/dbraw/zinc/04/89/56/1348048956.db2.gz	SYZJEPGVHOYECO-OALUTQOASA-N	0	3	344.503	3.418	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(C2CC2)s1	ZINC001049839976	1348052156	/nfs/dbraw/zinc/05/21/56/1348052156.db2.gz	KKGBRJTWYFUDLE-HZPDHXFCSA-N	0	3	328.481	3.328	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1cccc2ccccc21	ZINC001049852968	1348059550	/nfs/dbraw/zinc/05/95/50/1348059550.db2.gz	BQHPVGUDTVQLBY-NHCUHLMSSA-N	0	3	332.447	3.081	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1cccc2ccccc21	ZINC001049853080	1348059663	/nfs/dbraw/zinc/05/96/63/1348059663.db2.gz	CABLJABSYNKGOV-FGZHOGPDSA-N	0	3	346.474	3.471	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C[C@@H]1CCCc2ccccc21	ZINC001049854596	1348060739	/nfs/dbraw/zinc/06/07/39/1348060739.db2.gz	OCWOWMKHELAJAG-CEWLAPEOSA-N	0	3	336.479	3.195	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C[C@H]1CCCc2ccccc21	ZINC001049854597	1348061089	/nfs/dbraw/zinc/06/10/89/1348061089.db2.gz	OCWOWMKHELAJAG-HLAWJBBLSA-N	0	3	336.479	3.195	20	30		EGEDHN
C=CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1scnc1Cl	ZINC001049899237	1348099995	/nfs/dbraw/zinc/09/99/95/1348099995.db2.gz	CUYHGBOCGVOALW-RYUDHWBXSA-N	0	3	325.865	3.052	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](C)c1ccc(F)c(F)c1	ZINC001049904812	1348103158	/nfs/dbraw/zinc/10/31/58/1348103158.db2.gz	RWJOYYGNKWDWLY-GDIGMMSISA-N	0	3	346.421	3.157	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](C)c1ccc(F)c(F)c1	ZINC001049904816	1348103388	/nfs/dbraw/zinc/10/33/88/1348103388.db2.gz	RWJOYYGNKWDWLY-NIKGAXFTSA-N	0	3	346.421	3.157	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](C)Cc1ccc(OC)cc1	ZINC001049910912	1348107254	/nfs/dbraw/zinc/10/72/54/1348107254.db2.gz	WOWGQNWZXAKSGB-LSTHTHJFSA-N	0	3	342.483	3.125	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3oc(CC4CC4)nc3C)[C@@H]2C1	ZINC001050048003	1348165170	/nfs/dbraw/zinc/16/51/70/1348165170.db2.gz	XUOQZVXNTBXPBZ-DLBZAZTESA-N	0	3	343.471	3.048	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3ccc(C(F)F)nc3)[C@@H]2C1	ZINC001050062406	1348170055	/nfs/dbraw/zinc/17/00/55/1348170055.db2.gz	PDWCCWUJDZZXSA-GOEBONIOSA-N	0	3	335.398	3.132	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3ccc(-c4cnco4)cc3)[C@@H]2C1	ZINC001050077099	1348174454	/nfs/dbraw/zinc/17/44/54/1348174454.db2.gz	OHQVOJFNAIUMCU-ZWKOTPCHSA-N	0	3	337.423	3.064	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001050145123	1348195632	/nfs/dbraw/zinc/19/56/32/1348195632.db2.gz	GCVDTEUMQOMYKS-IYWMVGAKSA-N	0	3	337.467	3.027	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)Cc3ccc(Cl)c(F)c3)[C@@H]2C1	ZINC001050148952	1348196967	/nfs/dbraw/zinc/19/69/67/1348196967.db2.gz	ANDRRDYOXVSSNS-WMLDXEAASA-N	0	3	336.838	3.130	20	30		EGEDHN
C#CCCN1C[C@@H]2CCCN(C(=O)c3cc(C(CC)CC)no3)[C@@H]2C1	ZINC001050160224	1348199528	/nfs/dbraw/zinc/19/95/28/1348199528.db2.gz	UCJCNCVNFKDTTD-FUHWJXTLSA-N	0	3	343.471	3.138	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cc(Cl)cc(OC)c3)[C@@H]2C1	ZINC001050167686	1348202012	/nfs/dbraw/zinc/20/20/12/1348202012.db2.gz	LYEOBTNTZHHBSY-SUMWQHHRSA-N	0	3	334.847	3.071	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)COc3ccccc3C(C)C)[C@@H]2C1	ZINC001050197377	1348208030	/nfs/dbraw/zinc/20/80/30/1348208030.db2.gz	NIYAQMRSFWSKLQ-PKOBYXMFSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cccc(OCC(C)C)c3)[C@@H]2C1	ZINC001050197319	1348208187	/nfs/dbraw/zinc/20/81/87/1348208187.db2.gz	ATZWWBJUNAVITE-AZUAARDMSA-N	0	3	342.483	3.444	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cc(C)n(C(C)C)c3C)[C@@H]2C1	ZINC001050198355	1348208841	/nfs/dbraw/zinc/20/88/41/1348208841.db2.gz	MGNQEFUUQSVLFY-PKOBYXMFSA-N	0	3	329.488	3.408	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3ccc(OCC4CC4)cc3)[C@@H]2C1	ZINC001050204769	1348210887	/nfs/dbraw/zinc/21/08/87/1348210887.db2.gz	KWWYYQKBVOWYKZ-AZUAARDMSA-N	0	3	340.467	3.198	20	30		EGEDHN
CCC(CC)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001050439748	1348267386	/nfs/dbraw/zinc/26/73/86/1348267386.db2.gz	WGDJAMNRKHSWRE-UHFFFAOYSA-N	0	3	339.483	3.419	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)CC3CC(c4ccccc4)C3)C2)CC1	ZINC001050570746	1348291938	/nfs/dbraw/zinc/29/19/38/1348291938.db2.gz	HYWKWHHYTNRNRO-UHFFFAOYSA-N	0	3	336.479	3.128	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)C3CC(C)(C)CC(C)(C)C3)C2)CC1	ZINC001050605848	1348299092	/nfs/dbraw/zinc/29/90/92/1348299092.db2.gz	VSAKHTNQVBOUFD-UHFFFAOYSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)C[C@@H]3C[C@H](C)CC(C)(C)C3)C2)CC1	ZINC001050700190	1348330973	/nfs/dbraw/zinc/33/09/73/1348330973.db2.gz	BKJWKVVXSQUCQO-ROUUACIJSA-N	0	3	330.516	3.397	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3ccnc(C)c3)cccc2C1	ZINC001051304088	1348426747	/nfs/dbraw/zinc/42/67/47/1348426747.db2.gz	SAORMHUBZWLSQF-UHFFFAOYSA-N	0	3	335.451	3.254	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2cc(Cl)sc2Cl)CC1	ZINC001052444943	1348542999	/nfs/dbraw/zinc/54/29/99/1348542999.db2.gz	JNYKWWXVSMRRIX-SNVBAGLBSA-N	0	3	331.268	3.272	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2coc3c2cccc3OC)CC1	ZINC001052379891	1348536451	/nfs/dbraw/zinc/53/64/51/1348536451.db2.gz	SBBRXOPTVRTFQE-HNNXBMFYSA-N	0	3	340.423	3.049	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H](NC(=O)C3(F)CCCC3)CC2)cc1	ZINC001052506686	1348561461	/nfs/dbraw/zinc/56/14/61/1348561461.db2.gz	JPLFNJMHLWFJEY-GOSISDBHSA-N	0	3	343.446	3.311	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2csc(C(F)(F)F)c2)CC1	ZINC001052524586	1348565806	/nfs/dbraw/zinc/56/58/06/1348565806.db2.gz	FDCVGRYURDNRJX-ZDUSSCGKSA-N	0	3	344.402	3.375	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)Cc2cccc(C(F)F)c2)CC1	ZINC001052552854	1348577090	/nfs/dbraw/zinc/57/70/90/1348577090.db2.gz	BDGOYSOESHYIMG-QGZVFWFLSA-N	0	3	334.410	3.161	20	30		EGEDHN
CC(C)(C(=O)N[C@@H]1CCCN(Cc2ccc(C#N)cc2)CC1)C1CC1	ZINC001052638141	1348606596	/nfs/dbraw/zinc/60/65/96/1348606596.db2.gz	SONIYRGCTDYEIV-LJQANCHMSA-N	0	3	339.483	3.465	20	30		EGEDHN
Cc1ncccc1C(=O)N[C@@H]1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC001052668603	1348622247	/nfs/dbraw/zinc/62/22/47/1348622247.db2.gz	QWCHILNICNWLPB-LJQANCHMSA-N	0	3	348.450	3.046	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc(C(F)F)c(F)c2)CC1	ZINC001052707515	1348643671	/nfs/dbraw/zinc/64/36/71/1348643671.db2.gz	FUDGYXBOZFQBSA-AWEZNQCLSA-N	0	3	338.373	3.371	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2ccccc2O[C@@H](C)CC)CC1	ZINC001052754621	1348664109	/nfs/dbraw/zinc/66/41/09/1348664109.db2.gz	OFPPBQRJSHCNRC-DLBZAZTESA-N	0	3	328.456	3.081	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)Cc2ccccc2OC(C)C)CC1	ZINC001052790537	1348680874	/nfs/dbraw/zinc/68/08/74/1348680874.db2.gz	MVVNNVZRCIBRKI-LJQANCHMSA-N	0	3	342.483	3.010	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc(O[C@@H](C)CC)cc2)CC1	ZINC001052849061	1348700753	/nfs/dbraw/zinc/70/07/53/1348700753.db2.gz	LFIRRCPMGLSGTK-PKOBYXMFSA-N	0	3	342.483	3.472	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)C2(c3ccccc3F)CCC2)CC1	ZINC001052862244	1348706711	/nfs/dbraw/zinc/70/67/11/1348706711.db2.gz	KOZRLRLPALNAFF-KRWDZBQOSA-N	0	3	342.458	3.241	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2ccc(Cl)c3occc32)CC1	ZINC001052862783	1348707642	/nfs/dbraw/zinc/70/76/42/1348707642.db2.gz	ZBWCEUZBUCOLNP-ZDUSSCGKSA-N	0	3	330.815	3.304	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2ccc(-c3cccs3)o2)CC1	ZINC001052906013	1348738745	/nfs/dbraw/zinc/73/87/45/1348738745.db2.gz	RRHIXHAKDKERIG-AWEZNQCLSA-N	0	3	328.437	3.226	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc(CC(C)C)cc2)CC1	ZINC001052924347	1348750423	/nfs/dbraw/zinc/75/04/23/1348750423.db2.gz	ZVIJCBWOWGOJIU-FQEVSTJZSA-N	0	3	326.484	3.493	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc3[nH]c(C)c(C)c3c2)CC1	ZINC001052925531	1348751570	/nfs/dbraw/zinc/75/15/70/1348751570.db2.gz	RNTWGIHCOCHYSO-SFHVURJKSA-N	0	3	337.467	3.392	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2sc(CCC)nc2C)CC1	ZINC001052929410	1348752742	/nfs/dbraw/zinc/75/27/42/1348752742.db2.gz	BIIDVRDBZOLMAS-HNNXBMFYSA-N	0	3	333.501	3.012	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)CC2C3CC4CC(C3)CC2C4)CC1	ZINC001052947035	1348763215	/nfs/dbraw/zinc/76/32/15/1348763215.db2.gz	HCJIIDUDPJNVKL-BIKXEMDZSA-N	0	3	328.500	3.053	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@H](C)c2ccc(F)cc2F)CC1	ZINC001052948190	1348765224	/nfs/dbraw/zinc/76/52/24/1348765224.db2.gz	YSHSBXUSHJJCQY-GDBMZVCRSA-N	0	3	334.410	3.062	20	30		EGEDHN
C#CCCN1C[C@@H](C)[C@H](NC(=O)c2ccc(C(C)(C)CC)cc2)C1	ZINC001079925411	1357425412	/nfs/dbraw/zinc/42/54/12/1357425412.db2.gz	WLDJFYYXESWSAY-VQIMIIECSA-N	0	3	326.484	3.448	20	30		EGEDHN
C=CC[N@H+]1CCC[C@@H]([C@H]2CCCN(C(=O)c3ccccc3[O-])C2)C1	ZINC001053008638	1348807471	/nfs/dbraw/zinc/80/74/71/1348807471.db2.gz	SMXLENYYHZWVKJ-SJORKVTESA-N	0	3	328.456	3.142	20	30		EGEDHN
C=CC[N@@H+]1CCC[C@@H]([C@H]2CCCN(C(=O)c3ccccc3[O-])C2)C1	ZINC001053008638	1348807474	/nfs/dbraw/zinc/80/74/74/1348807474.db2.gz	SMXLENYYHZWVKJ-SJORKVTESA-N	0	3	328.456	3.142	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2sccc2C)C1	ZINC001053062294	1348873527	/nfs/dbraw/zinc/87/35/27/1348873527.db2.gz	YDGBHARKMOOFGM-DLBZAZTESA-N	0	3	330.497	3.396	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccoc2C)C1	ZINC001053065053	1348878188	/nfs/dbraw/zinc/87/81/88/1348878188.db2.gz	BOUZLZZDTAEPLR-IEBWSBKVSA-N	0	3	328.456	3.318	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2scnc2C)C1	ZINC001053070003	1348883489	/nfs/dbraw/zinc/88/34/89/1348883489.db2.gz	RQUVAZUZUMUUEB-IAGOWNOFSA-N	0	3	345.512	3.182	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)/C=C(\C)C2CC2)C1	ZINC001053072330	1348888273	/nfs/dbraw/zinc/88/82/73/1348888273.db2.gz	QFTONUVENPPDIE-HIILJBGESA-N	0	3	328.500	3.459	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(C)c(C)o2)C1	ZINC001053079684	1348900311	/nfs/dbraw/zinc/90/03/11/1348900311.db2.gz	KSBDKGFTIWIPPX-MSOLQXFVSA-N	0	3	328.456	3.236	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2[nH]ccc2C)C1	ZINC001053083700	1348905119	/nfs/dbraw/zinc/90/51/19/1348905119.db2.gz	LMAREJMECNHUGQ-MSOLQXFVSA-N	0	3	327.472	3.053	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2onc(C)c2C)C1	ZINC001053088412	1348912996	/nfs/dbraw/zinc/91/29/96/1348912996.db2.gz	UYGGXRPTKQJFNW-MSOLQXFVSA-N	0	3	343.471	3.021	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cc(Cl)cn2C)C1	ZINC001053092479	1348919234	/nfs/dbraw/zinc/91/92/34/1348919234.db2.gz	RTDVYAHRHHVHRB-DOTOQJQBSA-N	0	3	347.890	3.018	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cc(C)co2)C1	ZINC001053094178	1348922587	/nfs/dbraw/zinc/92/25/87/1348922587.db2.gz	UIMUOLCNOJUUMB-QZTJIDSGSA-N	0	3	328.456	3.318	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccc(Cl)[nH]2)C1	ZINC001053094475	1348923417	/nfs/dbraw/zinc/92/34/17/1348923417.db2.gz	FRKCGSVEDFKWFL-DOTOQJQBSA-N	0	3	347.890	3.398	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)[C@H]2C[C@H]3C[C@H]3C2)C1	ZINC001053094289	1348923862	/nfs/dbraw/zinc/92/38/62/1348923862.db2.gz	DBLALVSFRTVVJL-SWBPCFCJSA-N	0	3	328.500	3.149	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cc3ccccn3c2)C1	ZINC001053100007	1348932003	/nfs/dbraw/zinc/93/20/03/1348932003.db2.gz	CJWUZGGRAHCQCV-NQIIRXRSSA-N	0	3	349.478	3.279	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2occc2CC)C1	ZINC001053099793	1348932614	/nfs/dbraw/zinc/93/26/14/1348932614.db2.gz	YZUQZNFQTPLFCK-ZWKOTPCHSA-N	0	3	328.456	3.182	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2c(C)nsc2C)C1	ZINC001053104735	1348940716	/nfs/dbraw/zinc/94/07/16/1348940716.db2.gz	IUUZCRKPLHUQIM-DLBZAZTESA-N	0	3	345.512	3.100	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(OC)cc2)C1	ZINC001053105642	1348942916	/nfs/dbraw/zinc/94/29/16/1348942916.db2.gz	QCGAJZHAUOTRKV-UYAOXDASSA-N	0	3	340.467	3.035	20	30		EGEDHN
C=C(C)CCN1Cc2ccccc2C[C@@H]1CNC(=O)[C@H]1CC1(F)F	ZINC001054039750	1349135326	/nfs/dbraw/zinc/13/53/26/1349135326.db2.gz	IJDGLWDPGPTBOS-IAGOWNOFSA-N	0	3	334.410	3.151	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)Cc1cccc(CC)c1)C2	ZINC001054155298	1349158181	/nfs/dbraw/zinc/15/81/81/1349158181.db2.gz	NVTQHWGZYQMHJP-QFIPXVFZSA-N	0	3	338.495	3.129	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)Cc1cccc(C(C)C)c1)C2	ZINC001054160236	1349162082	/nfs/dbraw/zinc/16/20/82/1349162082.db2.gz	ZFGAVEXVFNVPIC-QFIPXVFZSA-N	0	3	338.495	3.300	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)CCc1ccc3[nH]ccc3c1)C2	ZINC001054165738	1349167991	/nfs/dbraw/zinc/16/79/91/1349167991.db2.gz	NPQOYLQKMQUDJC-QFIPXVFZSA-N	0	3	349.478	3.048	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@]2(CCN(Cc3cnc(C)s3)C2)C1	ZINC001054175921	1349177577	/nfs/dbraw/zinc/17/75/77/1349177577.db2.gz	YEODDEPELMIBEU-LJQANCHMSA-N	0	3	347.528	3.478	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@]2(CCN(Cc3ccccn3)C2)C1	ZINC001054192290	1349193946	/nfs/dbraw/zinc/19/39/46/1349193946.db2.gz	TZABTCUCYCHNLZ-SFTDATJTSA-N	0	3	341.499	3.498	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(C(C)C)nc1C)C2	ZINC001054199185	1349201264	/nfs/dbraw/zinc/20/12/64/1349201264.db2.gz	PMHXEWRGWNPMNB-NRFANRHFSA-N	0	3	339.483	3.075	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)C1CCC(F)(F)CC1)C2	ZINC001054202876	1349204728	/nfs/dbraw/zinc/20/47/28/1349204728.db2.gz	BVZYWGRMCZSJND-GOSISDBHSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc3ccn(C)c3c1)C2	ZINC001054224102	1349218779	/nfs/dbraw/zinc/21/87/79/1349218779.db2.gz	VHHBLSATDOLCDR-QFIPXVFZSA-N	0	3	349.478	3.130	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc(C)c(F)cc1Cl)C2	ZINC001054234059	1349226373	/nfs/dbraw/zinc/22/63/73/1349226373.db2.gz	WINWDWWNHJVURA-IBGZPJMESA-N	0	3	348.849	3.349	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)C1CCC(C(F)F)CC1)C2	ZINC001054235015	1349227443	/nfs/dbraw/zinc/22/74/43/1349227443.db2.gz	NTIYXTDOONVBGN-RJYAGPCLSA-N	0	3	338.442	3.006	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(CC(C)C)cc1)C2	ZINC001054239981	1349234567	/nfs/dbraw/zinc/23/45/67/1349234567.db2.gz	YHQZBGXVLUXYKS-JOCHJYFZSA-N	0	3	338.495	3.446	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@H](CC)c1ccc(F)cc1)C2	ZINC001054245856	1349239794	/nfs/dbraw/zinc/23/97/94/1349239794.db2.gz	FUOFWWVAOHKMRM-TZIWHRDSSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc3cccc(C)c3o1)C2	ZINC001054246686	1349241210	/nfs/dbraw/zinc/24/12/10/1349241210.db2.gz	GONFWTZKDFIOGG-OAQYLSRUSA-N	0	3	336.435	3.303	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3conc3CC)cc2C1	ZINC001054280321	1349280903	/nfs/dbraw/zinc/28/09/03/1349280903.db2.gz	FRCFCCNUQYKZHW-UHFFFAOYSA-N	0	3	339.439	3.449	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cc(C)nn3CC)cc2C1	ZINC001054283918	1349284993	/nfs/dbraw/zinc/28/49/93/1349284993.db2.gz	WRFVCGGWPKZDNY-UHFFFAOYSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@@H]3C[C@@]34CCOC4)cc2C1	ZINC001054288963	1349293048	/nfs/dbraw/zinc/29/30/48/1349293048.db2.gz	PLRCDPOWRIRHJK-PZJWPPBQSA-N	0	3	340.467	3.011	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3coc(CCC)n3)cc2C1	ZINC001054289759	1349294668	/nfs/dbraw/zinc/29/46/68/1349294668.db2.gz	PGEUVYDXXORBMS-UHFFFAOYSA-N	0	3	339.439	3.449	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](C)[C@H](NCc2cc(F)ccc2OC)C1	ZINC001054970994	1349532078	/nfs/dbraw/zinc/53/20/78/1349532078.db2.gz	KYFCLRVNNVHWFL-WMLDXEAASA-N	0	3	348.462	3.373	20	30		EGEDHN
C#CCCN1C[C@@H](C)[C@H](NC(=O)C(C)(C)c2ccc(Cl)cc2)C1	ZINC001080374785	1357592167	/nfs/dbraw/zinc/59/21/67/1357592167.db2.gz	NSAOZGOWWRHTEG-RHSMWYFYSA-N	0	3	332.875	3.077	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C1=CCCCCC1)C[C@@H](C)O2	ZINC001071161301	1354482509	/nfs/dbraw/zinc/48/25/09/1354482509.db2.gz	IADILRHCHZAYMW-YLJYHZDGSA-N	0	3	332.488	3.145	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C(C)(C)C(=C)Cl)C[C@H](C)O2	ZINC001071170906	1354486035	/nfs/dbraw/zinc/48/60/35/1354486035.db2.gz	DWGZOYMIPQWUQV-KSSFIOAISA-N	0	3	340.895	3.033	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1csc(C)c1C)C[C@H](C)O2	ZINC001071168415	1354486354	/nfs/dbraw/zinc/48/63/54/1354486354.db2.gz	APGRVFHNWVSZFG-IFXJQAMLSA-N	0	3	348.512	3.246	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1cc(C)sc1C)C[C@@H](C)O2	ZINC001071185355	1354491364	/nfs/dbraw/zinc/49/13/64/1354491364.db2.gz	FCOAKMCIQXCEAA-AUUYWEPGSA-N	0	3	348.512	3.246	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1ccccc1OC1CCC1	ZINC001085808247	1358786305	/nfs/dbraw/zinc/78/63/05/1358786305.db2.gz	ZMHWKZYCGPPNQH-MRXNPFEDSA-N	0	3	328.456	3.340	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](C)O[C@]2(CCN(CC=C(C)C)C2)C1	ZINC001071199898	1354500021	/nfs/dbraw/zinc/50/00/21/1354500021.db2.gz	QWLANHHFUGRFDB-PXNSSMCTSA-N	0	3	334.504	3.247	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1occc1C(C)C)C[C@H](C)O2	ZINC001071202576	1354502682	/nfs/dbraw/zinc/50/26/82/1354502682.db2.gz	XDQGJNZDNRKBAG-OXJNMPFZSA-N	0	3	346.471	3.285	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc3c(c2)[C@@H](C)CO3)C1	ZINC001086174736	1359014621	/nfs/dbraw/zinc/01/46/21/1359014621.db2.gz	QJMMDJSYHZETJE-CORIIIEPSA-N	0	3	334.847	3.033	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cccc(F)c3C)C2)CC1	ZINC001086924330	1359249715	/nfs/dbraw/zinc/24/97/15/1359249715.db2.gz	POOJQGFIQXBNTP-OAHLLOKOSA-N	0	3	328.431	3.084	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cccc(F)c3C)C2)CC1	ZINC001086924329	1359249910	/nfs/dbraw/zinc/24/99/10/1359249910.db2.gz	POOJQGFIQXBNTP-HNNXBMFYSA-N	0	3	328.431	3.084	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cn(-c3ccccc3)cn2)CC[C@@H]1C	ZINC001071527549	1354746890	/nfs/dbraw/zinc/74/68/90/1354746890.db2.gz	FSBLVJFYINAYLF-IRXDYDNUSA-N	0	3	338.455	3.031	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cnn(C(C)(C)C)c2C)CC[C@H]1C	ZINC001071544303	1354757463	/nfs/dbraw/zinc/75/74/63/1354757463.db2.gz	WTXPDCKEHAARCS-GDBMZVCRSA-N	0	3	332.492	3.105	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)c2cn(C)c3ccc(F)cc23)CC[C@H]1C	ZINC001071572433	1354771466	/nfs/dbraw/zinc/77/14/66/1354771466.db2.gz	VVCPIDVHOUABJA-UKRRQHHQSA-N	0	3	329.419	3.086	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2ccc3cccnc3c2)CC[C@H]1C	ZINC001071607559	1354792963	/nfs/dbraw/zinc/79/29/63/1354792963.db2.gz	PSZCSHJPXKNQCN-APWZRJJASA-N	0	3	337.467	3.323	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cn2c(C)cc3ccccc32)CC[C@H]1C	ZINC001071660314	1354832894	/nfs/dbraw/zinc/83/28/94/1354832894.db2.gz	UAWCKOREXIBJHE-VQIMIIECSA-N	0	3	339.483	3.495	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc(-c3ccccc3)n[nH]2)CC[C@@H]1C	ZINC001071663523	1354834736	/nfs/dbraw/zinc/83/47/36/1354834736.db2.gz	OOVSUFZOLRLCHO-DOTOQJQBSA-N	0	3	338.455	3.236	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2c(C)occ2C(F)(F)F)CC[C@@H]1C	ZINC001071689163	1354852507	/nfs/dbraw/zinc/85/25/07/1354852507.db2.gz	GTJUNAQPBGOCPC-AAEUAGOBSA-N	0	3	342.361	3.213	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2nc3ccccc3cc2C)CC[C@H]1C	ZINC001071696219	1354857802	/nfs/dbraw/zinc/85/78/02/1354857802.db2.gz	XHCRSSJAFRSQAG-AEFFLSMTSA-N	0	3	335.451	3.149	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2ocnc2C(F)(F)F)CC[C@H]1C	ZINC001071705315	1354864134	/nfs/dbraw/zinc/86/41/34/1354864134.db2.gz	NNMLGRREXQZLDL-NEPJUHHUSA-N	0	3	345.365	3.242	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc(Cl)c(Cl)[nH]2)CC[C@H]1C	ZINC001071714891	1354872487	/nfs/dbraw/zinc/87/24/87/1354872487.db2.gz	BIFBWIJBCHGYKJ-GHMZBOCLSA-N	0	3	330.259	3.480	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc3c(ccc(C)c3C)[nH]2)CC[C@H]1C	ZINC001071739850	1354889749	/nfs/dbraw/zinc/88/97/49/1354889749.db2.gz	ZCJDXGZWZVZKNG-WBVHZDCISA-N	0	3	337.467	3.391	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CC[C@@H](C)N(CCOC3CCC3)C2)CC1	ZINC001071794419	1354938773	/nfs/dbraw/zinc/93/87/73/1354938773.db2.gz	CDEBZVORUMBDPT-AEFFLSMTSA-N	0	3	334.504	3.271	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc(C)oc2C(F)(F)F)CC[C@@H]1C	ZINC001071859031	1354986962	/nfs/dbraw/zinc/98/69/62/1354986962.db2.gz	XMGXMGXXKFEPHM-AAEUAGOBSA-N	0	3	342.361	3.213	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccccc2OCC(C)C)CC[C@@H]1C	ZINC001071904177	1355016555	/nfs/dbraw/zinc/01/65/55/1355016555.db2.gz	DNDWNYKWTDRJNV-ROUUACIJSA-N	0	3	342.483	3.327	20	30		EGEDHN
C=C(C)CCN1C[C@H](NC(=O)c2snnc2C(C)C)CC[C@H]1C	ZINC001071919678	1355024491	/nfs/dbraw/zinc/02/44/91/1355024491.db2.gz	GCVKDUOYRFAKOT-ZIAGYGMSSA-N	0	3	336.505	3.210	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cccc3c2OCCCO3)CC[C@H]1C	ZINC001071934679	1355033177	/nfs/dbraw/zinc/03/31/77/1355033177.db2.gz	QQHACSYMKUCZAC-CVEARBPZSA-N	0	3	344.455	3.007	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2[nH]c3ccc(C)cc3c2C)CC[C@H]1C	ZINC001071954952	1355041615	/nfs/dbraw/zinc/04/16/15/1355041615.db2.gz	ZFYPGUZOXNIVJG-NVXWUHKLSA-N	0	3	337.467	3.391	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cnn(CCC(C)C)c2C)CC[C@H]1C	ZINC001071972823	1355054511	/nfs/dbraw/zinc/05/45/11/1355054511.db2.gz	BPUZIPJHXPSQHH-AEFFLSMTSA-N	0	3	346.519	3.396	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cnn(C(CC)CC)c2C)CC[C@@H]1C	ZINC001071976675	1355055586	/nfs/dbraw/zinc/05/55/86/1355055586.db2.gz	GUGCQVXEZDXANV-DOTOQJQBSA-N	0	3	344.503	3.159	20	30		EGEDHN
C=C(C)CCN1C[C@H](NC(=O)c2sccc2COC)CC[C@H]1C	ZINC001071993655	1355063760	/nfs/dbraw/zinc/06/37/60/1355063760.db2.gz	VKPVBTUNYRWEOI-GDBMZVCRSA-N	0	3	336.501	3.443	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2)CC[C@H]1C	ZINC001072015240	1355078172	/nfs/dbraw/zinc/07/81/72/1355078172.db2.gz	ADPWIWAJZUOTJT-CJNGLKHVSA-N	0	3	338.373	3.311	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2ccc(Br)o2)CC[C@H]1C	ZINC001072019202	1355082012	/nfs/dbraw/zinc/08/20/12/1355082012.db2.gz	DZSGCWRISGBTDC-VXGBXAGGSA-N	0	3	341.249	3.201	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2coc3ccc(F)cc23)CC[C@H]1C	ZINC001072027513	1355088954	/nfs/dbraw/zinc/08/89/54/1355088954.db2.gz	ZUISLBNGDGFYGY-UKRRQHHQSA-N	0	3	328.387	3.178	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C23CC(c4ccccc4)(C2)C3)CC[C@@H]1C	ZINC001072110320	1355136862	/nfs/dbraw/zinc/13/68/62/1355136862.db2.gz	WDOUGRHMBJVJSI-FIFAKTGDSA-N	0	3	336.479	3.101	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(CC)c(CC)c2)CC[C@H]1C	ZINC001072124358	1355141930	/nfs/dbraw/zinc/14/19/30/1355141930.db2.gz	ZITBTMOXXROXCF-UZLBHIALSA-N	0	3	326.484	3.417	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(OC(C)C)cn2)CC[C@@H]1C	ZINC001072125912	1355142874	/nfs/dbraw/zinc/14/28/74/1355142874.db2.gz	HMRPMTBQVKDQBI-HOTGVXAUSA-N	0	3	331.460	3.028	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](C)[C@H](CNCc3cnc(C)o3)C2)CC1	ZINC001072356158	1355254616	/nfs/dbraw/zinc/25/46/16/1355254616.db2.gz	HIGKXZVBWGXRNO-MAUKXSAKSA-N	0	3	345.487	3.304	20	30		EGEDHN
CC[C@@H](c1ccc(Cl)cc1)N1CCC2(CN(C(=O)[C@H](C)C#N)C2)C1	ZINC001072553424	1355331109	/nfs/dbraw/zinc/33/11/09/1355331109.db2.gz	ZKJZBUGZCVFZKC-PBHICJAKSA-N	0	3	345.874	3.485	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001072928070	1355502696	/nfs/dbraw/zinc/50/26/96/1355502696.db2.gz	RKRGFIHEVSSGEX-UHFFFAOYSA-N	0	3	325.456	3.029	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1cccnc1C)C2	ZINC001072944658	1355512754	/nfs/dbraw/zinc/51/27/54/1355512754.db2.gz	IPEFXQDKHLWORP-IBGZPJMESA-N	0	3	327.472	3.027	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1sc(C)nc1C)C2	ZINC001072945224	1355513453	/nfs/dbraw/zinc/51/34/53/1355513453.db2.gz	XAHIJVKVTUYLFD-GOSISDBHSA-N	0	3	347.528	3.397	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)[C@@H]4CC45CCCC5)C3)C2)c1	ZINC001073101659	1355597413	/nfs/dbraw/zinc/59/74/13/1355597413.db2.gz	VOLHYVXPCUWXOG-IBGZPJMESA-N	0	3	349.478	3.173	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CN(C(=O)C(C4CC4)C4CC4)C3)C2)cc1	ZINC001073114927	1355604573	/nfs/dbraw/zinc/60/45/73/1355604573.db2.gz	LJKLJDBKXDFAQL-UHFFFAOYSA-N	0	3	349.478	3.029	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2cc(C(C)(C)C)oc2C)C1	ZINC001073789002	1355899667	/nfs/dbraw/zinc/89/96/67/1355899667.db2.gz	XXUHEWAQEGCALF-MRXNPFEDSA-N	0	3	348.487	3.282	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2cccc3ccsc32)C1	ZINC001073844760	1355915406	/nfs/dbraw/zinc/91/54/06/1355915406.db2.gz	ADTLQDWGGFGFKE-MRXNPFEDSA-N	0	3	344.480	3.298	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2ccc(C3CC3)s2)C1	ZINC001073856604	1355920544	/nfs/dbraw/zinc/92/05/44/1355920544.db2.gz	KNSHSARKFGJAIS-HNNXBMFYSA-N	0	3	334.485	3.022	20	30		EGEDHN
C#CCCN1CCCO[C@@H](CNC(=O)c2ccc([C@@H](C)CC)cc2)C1	ZINC001073899377	1355946312	/nfs/dbraw/zinc/94/63/12/1355946312.db2.gz	RIYRHUOULCMQQL-PXNSSMCTSA-N	0	3	342.483	3.044	20	30		EGEDHN
C=C[C@H](C(=O)N1CC[C@H](NCc2ncccc2C)[C@@H]1C)c1ccccc1	ZINC001075125300	1356319546	/nfs/dbraw/zinc/31/95/46/1356319546.db2.gz	XEGWAOURPQSPNE-IHPCNDPISA-N	0	3	349.478	3.439	20	30		EGEDHN
C=CCCN1C[C@@H]2CCN(C(=O)c3cc4ccncc4s3)[C@@H]2C1	ZINC001075887263	1356440629	/nfs/dbraw/zinc/44/06/29/1356440629.db2.gz	DTDGNJVRUNSLCA-LSDHHAIUSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)Cc3cc4ccccc4s3)[C@@H]2C1	ZINC001076030959	1356469552	/nfs/dbraw/zinc/46/95/52/1356469552.db2.gz	GPTOAWUAHCLFRN-DOTOQJQBSA-N	0	3	326.465	3.163	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@@H](CC)Oc3ccccc3C)[C@@H]2C1	ZINC001076306701	1356544431	/nfs/dbraw/zinc/54/44/31/1356544431.db2.gz	AOSHEUIEUJYPOW-IPMKNSEASA-N	0	3	342.483	3.261	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)Cc1csc(C2CC2)n1	ZINC001099257304	1363717959	/nfs/dbraw/zinc/71/79/59/1363717959.db2.gz	CZVJZLUXQIJAIH-MRXNPFEDSA-N	0	3	347.528	3.356	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)C[C@H](C)C1CC1	ZINC001099359593	1363772589	/nfs/dbraw/zinc/77/25/89/1363772589.db2.gz	RSYYXTPFDYYTSI-WMZOPIPTSA-N	0	3	336.520	3.232	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@H](NC(=O)CC3CC3)C23CCC3)c(F)c1	ZINC001078531567	1356998574	/nfs/dbraw/zinc/99/85/74/1356998574.db2.gz	OHTDSUXQKNZEEX-ROUUACIJSA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc(CC)ccn2)C12CCC2	ZINC001078628294	1357040819	/nfs/dbraw/zinc/04/08/19/1357040819.db2.gz	BXTJXKMZEJCZTM-JKSUJKDBSA-N	0	3	333.863	3.027	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2C[C@@H](NCc3oc(C)nc3C)C23CCC3)C1	ZINC001078721063	1357065957	/nfs/dbraw/zinc/06/59/57/1357065957.db2.gz	VMHBELFBRLFVJD-IAGOWNOFSA-N	0	3	343.471	3.165	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H]2CCC=CCCC2)C[C@H]1c1ccccc1	ZINC001081132032	1357843839	/nfs/dbraw/zinc/84/38/39/1357843839.db2.gz	DHFOCLKJOUHRDF-PCCBWWKXSA-N	0	3	336.479	3.340	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)Cc2cc(C)ccc2C)C[C@H]1c1ccccc1	ZINC001081173790	1357846744	/nfs/dbraw/zinc/84/67/44/1357846744.db2.gz	NIIUFUUDUYPIQJ-FCHUYYIVSA-N	0	3	346.474	3.063	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H](C)c2ccc(C)cc2)C[C@H]1c1ccccc1	ZINC001081215689	1357850037	/nfs/dbraw/zinc/85/00/37/1357850037.db2.gz	ROBWVXYIPRLYMX-YUXAGFNASA-N	0	3	346.474	3.316	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2ccc(C3CCC3)cc2)[C@H](OC)C1	ZINC001081768659	1357862708	/nfs/dbraw/zinc/86/27/08/1357862708.db2.gz	XRAMCMWBZZIRSV-WOJBJXKFSA-N	0	3	342.483	3.349	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2cccc(C3CCCC3)c2)[C@H](OC)C1	ZINC001082326904	1358017787	/nfs/dbraw/zinc/01/77/87/1358017787.db2.gz	URQNFKWCSOGLJL-WOJBJXKFSA-N	0	3	342.483	3.349	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2cc3cccc(C)c3o2)[C@H](OC)C1	ZINC001082387065	1358024419	/nfs/dbraw/zinc/02/44/19/1358024419.db2.gz	JYXAUVXXOUZSQI-SJLPKXTDSA-N	0	3	342.439	3.136	20	30		EGEDHN
C[C@H](C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1)C(C)(C)C	ZINC001082594810	1358065598	/nfs/dbraw/zinc/06/55/98/1358065598.db2.gz	LRUZICITTMUXJG-HBUWYVDXSA-N	0	3	345.462	3.316	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H](C)[C@H](NCc2ccc(Cl)nc2)C1	ZINC001082721900	1358080215	/nfs/dbraw/zinc/08/02/15/1358080215.db2.gz	OGIFGFNTCQRCEW-DDUZABMNSA-N	0	3	335.879	3.274	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)CC3CCCCCC3)[C@H]2C1	ZINC001083206474	1358123098	/nfs/dbraw/zinc/12/30/98/1358123098.db2.gz	BQMZWTLZFDPIPH-RBUKOAKNSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2C[C@H]3CCN(CC[C@H](C)F)C[C@H]32)cc1	ZINC001084459879	1358220211	/nfs/dbraw/zinc/22/02/11/1358220211.db2.gz	AKABZPCSPHJLJJ-KVSKMBFKSA-N	0	3	346.446	3.146	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)c3ccc(C)c4cccnc34)[C@@H]2C1	ZINC001084528216	1358231224	/nfs/dbraw/zinc/23/12/24/1358231224.db2.gz	JVJHZOVSXAIFNC-VQIMIIECSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H]3CCN(C[C@H]4CC(C)(C)CO4)C[C@H]32)CC1	ZINC001084635027	1358262797	/nfs/dbraw/zinc/26/27/97/1358262797.db2.gz	NHYZNIFPVMWXPD-GUDVDZBRSA-N	0	3	346.515	3.081	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CCN(CCc4ccc(C)cc4)C[C@H]32)C1	ZINC001084645874	1358267924	/nfs/dbraw/zinc/26/79/24/1358267924.db2.gz	IFVSNLANYSVNTC-WOJBJXKFSA-N	0	3	338.495	3.427	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)[C@@H](CC)Cc3cccc(C)c3)[C@@H]2C1	ZINC001084704717	1358286627	/nfs/dbraw/zinc/28/66/27/1358286627.db2.gz	OQKXENIBBQABKL-PWRODBHTSA-N	0	3	338.495	3.120	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)C(C)(C)c3ccc(CC)cc3)[C@@H]2C1	ZINC001084764359	1358304619	/nfs/dbraw/zinc/30/46/19/1358304619.db2.gz	CUYIUMUFHURMDS-UYAOXDASSA-N	0	3	338.495	3.083	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@H](CC)OC3CCCCC3)C[C@@H]21	ZINC001084939951	1358351936	/nfs/dbraw/zinc/35/19/36/1358351936.db2.gz	UGFYFQMJHVWJEK-NEWSRXKRSA-N	0	3	334.504	3.223	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CC[C@H]2CCN(Cc3cccc(C#N)c3)[C@H]2C1	ZINC001085048494	1358378392	/nfs/dbraw/zinc/37/83/92/1358378392.db2.gz	RMKADILJSCXKAS-AHRSYUTCSA-N	0	3	339.483	3.273	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C[C@H]3CCc4ccccc43)C[C@@H]21	ZINC001085059501	1358381230	/nfs/dbraw/zinc/38/12/30/1358381230.db2.gz	CQOHFNARBOTTPQ-SBHAEUEKSA-N	0	3	336.479	3.053	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@@H]2CCCC[C@H]2NC(=O)c2ccoc2)c1	ZINC001085133653	1358407952	/nfs/dbraw/zinc/40/79/52/1358407952.db2.gz	JZZWJVRCYAJCBH-QZTJIDSGSA-N	0	3	341.386	3.121	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccccc1COC	ZINC001085257737	1358445180	/nfs/dbraw/zinc/44/51/80/1358445180.db2.gz	WPPBVDQSNIJFIP-IAGOWNOFSA-N	0	3	336.863	3.216	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cnc2ccc(C)cn21	ZINC001085273083	1358448594	/nfs/dbraw/zinc/44/85/94/1358448594.db2.gz	NHGPQLIHUZFYRT-HUUCEWRRSA-N	0	3	346.862	3.026	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccc(C)cc1OC	ZINC001085399383	1358488991	/nfs/dbraw/zinc/48/89/91/1358488991.db2.gz	IITCTZMMWNCIMD-HZPDHXFCSA-N	0	3	336.863	3.387	20	30		EGEDHN
CN(C[C@H]1CCN1CCCC1CCCC1)C(=O)c1cc(C#N)c[nH]1	ZINC001085534311	1358571087	/nfs/dbraw/zinc/57/10/87/1358571087.db2.gz	HQHJMNBIWITXHB-QGZVFWFLSA-N	0	3	328.460	3.003	20	30		EGEDHN
CC[C@@H](c1ccccc1)N1CC[C@H]1CN(C)C(=O)c1c[nH]c(C#N)c1	ZINC001085553199	1358589778	/nfs/dbraw/zinc/58/97/78/1358589778.db2.gz	ZAHYAIZDTFCWCJ-OALUTQOASA-N	0	3	336.439	3.184	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1nccc2ccsc21	ZINC001085651505	1358659904	/nfs/dbraw/zinc/65/99/04/1358659904.db2.gz	VXFNLJGYKUWGMC-HNNXBMFYSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N(C)C[C@H]1CCN1CCC(C)C	ZINC001085678150	1358681627	/nfs/dbraw/zinc/68/16/27/1358681627.db2.gz	BZOSJNQAMNUDEC-QGZVFWFLSA-N	0	3	330.472	3.444	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N(C)C[C@H]1CCN1CCC1CC1	ZINC001085678774	1358683474	/nfs/dbraw/zinc/68/34/74/1358683474.db2.gz	QOTHDOYFNNCSBH-QGZVFWFLSA-N	0	3	328.456	3.198	20	30		EGEDHN
C=C1CCC(C(=O)N(C)C[C@H]2CCN2CC2CC(F)(F)C2)CC1	ZINC001085800843	1358776038	/nfs/dbraw/zinc/77/60/38/1358776038.db2.gz	CXVPSYJTCPAYFJ-MRXNPFEDSA-N	0	3	326.431	3.311	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc(C2CC2)nc1C	ZINC001085824240	1358794399	/nfs/dbraw/zinc/79/43/99/1358794399.db2.gz	DLPVMHRZQUVLFB-KRWDZBQOSA-N	0	3	327.472	3.380	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N(C)C[C@H]1CCN1CCCC1CCCC1	ZINC001085827599	1358795696	/nfs/dbraw/zinc/79/56/96/1358795696.db2.gz	XHGCIMNOUKGAPW-QRVBRYPASA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc(Cl)c(OC)c1	ZINC001085855192	1358822196	/nfs/dbraw/zinc/82/21/96/1358822196.db2.gz	SAEAOAZZSCCYHX-HNNXBMFYSA-N	0	3	336.863	3.461	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1coc(C2CCCC2)n1	ZINC001085899380	1358856232	/nfs/dbraw/zinc/85/62/32/1358856232.db2.gz	CICOZWMOJREEHO-MRXNPFEDSA-N	0	3	331.460	3.445	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cncc(C(F)(F)F)c1	ZINC001085908094	1358866998	/nfs/dbraw/zinc/86/69/98/1358866998.db2.gz	XTMJEGGPHSERMB-OAHLLOKOSA-N	0	3	341.377	3.213	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1ccc(OCC2CC2)cc1	ZINC001085979184	1358933029	/nfs/dbraw/zinc/93/30/29/1358933029.db2.gz	MAIHJEWTQQEUHJ-GOSISDBHSA-N	0	3	328.456	3.198	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@H]1Cc2c1cccc2Cl	ZINC001085995301	1358950547	/nfs/dbraw/zinc/95/05/47/1358950547.db2.gz	JHQYJQJGXXARTJ-YOEHRIQHSA-N	0	3	332.875	3.479	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cnc3ccsc3c2)C1	ZINC001086167083	1359013051	/nfs/dbraw/zinc/01/30/51/1359013051.db2.gz	YXLIQRRFUDEJJD-BJHJDKERSA-N	0	3	335.860	3.147	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2C[C@@H](NCc3c(C)nsc3C)C2)CC1	ZINC001086187375	1359020662	/nfs/dbraw/zinc/02/06/62/1359020662.db2.gz	RRNLDXQVXVDOEC-WOVMCDHWSA-N	0	3	347.528	3.491	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cccc(F)c2OCC)C1	ZINC001086235962	1359035154	/nfs/dbraw/zinc/03/51/54/1359035154.db2.gz	TWUMFVFVBDWPBS-BETUJISGSA-N	0	3	340.826	3.075	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@@H]2C[C@H]2c2sccc2C)C1	ZINC001086365470	1359078724	/nfs/dbraw/zinc/07/87/24/1359078724.db2.gz	RJKJAXDVPPESBB-KBUPBQIOSA-N	0	3	338.904	3.397	20	30		EGEDHN
CC[C@@]1(C)C[C@@H]1C(=O)NC[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001086520415	1359128408	/nfs/dbraw/zinc/12/84/08/1359128408.db2.gz	FCAVKWUNBPCAMK-OYRIPWCXSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc3ccncc3c2)C1	ZINC001086527107	1359132852	/nfs/dbraw/zinc/13/28/52/1359132852.db2.gz	IIGFNPRWMSVBDE-WJYNOGRTSA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc3c(s2)CCCC3)C1	ZINC001086547584	1359141062	/nfs/dbraw/zinc/14/10/62/1359141062.db2.gz	RBBBHNSSQYBLEU-MQMHXKEQSA-N	0	3	338.904	3.477	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)C2CC(c3ccccc3)C2)C1	ZINC001086562640	1359147952	/nfs/dbraw/zinc/14/79/52/1359147952.db2.gz	ATKFGBLBLQGYHD-GPYOTGNMSA-N	0	3	332.875	3.417	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)[C@@H]2C[C@@H]3C=C[C@H]2CC3)C1	ZINC001086589003	1359157295	/nfs/dbraw/zinc/15/72/95/1359157295.db2.gz	AONVIPXNKMWTFO-KMKNWIINSA-N	0	3	348.490	3.196	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)Cc2ccc(C)cc2)C1	ZINC001086597951	1359159410	/nfs/dbraw/zinc/15/94/10/1359159410.db2.gz	HMGSLOPQCJBDNB-FCHUYYIVSA-N	0	3	346.474	3.145	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)[C@H]2CCCC2(C)C)C1	ZINC001086604525	1359161524	/nfs/dbraw/zinc/16/15/24/1359161524.db2.gz	HIKWRVYNZIVYCH-XUVXKRRUSA-N	0	3	338.495	3.420	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cc(C)n(CC)c2C)C1	ZINC001086748946	1359194293	/nfs/dbraw/zinc/19/42/93/1359194293.db2.gz	AKBKQOHIUADFRU-JKSUJKDBSA-N	0	3	337.895	3.365	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2nc(Cl)sc2C)C1	ZINC001086754210	1359195645	/nfs/dbraw/zinc/19/56/45/1359195645.db2.gz	FDFDSHLFKUHGES-WDEREUQCSA-N	0	3	348.299	3.346	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)[C@@H]2C[C@H]2c2ccccc2)C1	ZINC001086857299	1359214835	/nfs/dbraw/zinc/21/48/35/1359214835.db2.gz	VNYKTGIUZCNYFF-XOYOTBSWSA-N	0	3	332.875	3.417	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3cc4occc4[nH]3)C2)CC1	ZINC001086926004	1359251459	/nfs/dbraw/zinc/25/14/59/1359251459.db2.gz	NCMAORHDYVRULM-HNNXBMFYSA-N	0	3	339.439	3.101	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H]3C[C@H]3C(C)(C)C)C2)CC1	ZINC001086932405	1359256187	/nfs/dbraw/zinc/25/61/87/1359256187.db2.gz	JYDQVJSRZDRUOW-RCCFBDPRSA-N	0	3	330.516	3.395	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H](C)c3ccsc3)C2)CC1	ZINC001086941389	1359263264	/nfs/dbraw/zinc/26/32/64/1359263264.db2.gz	SIDWJHPNICJIBK-CVEARBPZSA-N	0	3	330.497	3.188	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc(C)ccc3F)C2)CC1	ZINC001086944968	1359265673	/nfs/dbraw/zinc/26/56/73/1359265673.db2.gz	NWOJNBWEXJYRKI-MRXNPFEDSA-N	0	3	328.431	3.084	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc(F)cc3C)C2)CC1	ZINC001086953543	1359273577	/nfs/dbraw/zinc/27/35/77/1359273577.db2.gz	LMVUSLDLMVNZKR-MRXNPFEDSA-N	0	3	328.431	3.084	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc(F)cc3C)C2)CC1	ZINC001086953574	1359273788	/nfs/dbraw/zinc/27/37/88/1359273788.db2.gz	MFSUTXQJCRGZOH-KRWDZBQOSA-N	0	3	342.458	3.474	20	30		EGEDHN
C[C@@H]1CCN(C(=O)C2CCC2)[C@H](CNCc2ccc(C#N)c(F)c2)C1	ZINC001087107393	1359287358	/nfs/dbraw/zinc/28/73/58/1359287358.db2.gz	TVFMPZLYPVTWIP-KDOFPFPSSA-N	0	3	343.446	3.214	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccc(C#N)s1	ZINC001087114791	1359293048	/nfs/dbraw/zinc/29/30/48/1359293048.db2.gz	GRXATAIXTRVDLP-CABCVRRESA-N	0	3	331.485	3.303	20	30		EGEDHN
C[C@@H]1CCN(C(=O)c2ccoc2)[C@H](CNCc2ccc(C#N)s2)C1	ZINC001087120661	1359296758	/nfs/dbraw/zinc/29/67/58/1359296758.db2.gz	LBRINJVSYIJFMT-HIFRSBDPSA-N	0	3	343.452	3.243	20	30		EGEDHN
CC(C)C(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC001087122913	1359297068	/nfs/dbraw/zinc/29/70/68/1359297068.db2.gz	RGTOMUGNGXMMGB-PBHICJAKSA-N	0	3	331.435	3.070	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](CNCc2nc(C)sc2C)[C@H](C)C1	ZINC001184077197	1387388687	/nfs/dbraw/zinc/38/86/87/1387388687.db2.gz	HQMZROWJSBPTSB-CJNGLKHVSA-N	0	3	335.517	3.300	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(C)oc3C)C(C)(C)[C@H]21	ZINC001087271182	1359344325	/nfs/dbraw/zinc/34/43/25/1359344325.db2.gz	NLBKKIVSXGWLHP-NXHRZFHOSA-N	0	3	328.456	3.139	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cccc(C)c1F	ZINC001087287417	1359365607	/nfs/dbraw/zinc/36/56/07/1359365607.db2.gz	HGEHKMOVSAMPDE-NZSAHSFTSA-N	0	3	342.458	3.376	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)Cc3c(C)cccc3C)C(C)(C)[C@H]21	ZINC001087287349	1359366245	/nfs/dbraw/zinc/36/62/45/1359366245.db2.gz	GFIGRQBCWYRXRB-QMMLZNLJSA-N	0	3	338.495	3.084	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc(C)c(F)cc1F	ZINC001087291206	1359369894	/nfs/dbraw/zinc/36/98/94/1359369894.db2.gz	QIOMZNCPWMLDLO-JEBQAFNWSA-N	0	3	346.421	3.125	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3c[nH]c4ccccc34)C(C)(C)[C@H]21	ZINC001087293358	1359374292	/nfs/dbraw/zinc/37/42/92/1359374292.db2.gz	COIUQXVWULJFPZ-LZQZEXGQSA-N	0	3	335.451	3.020	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cn(C)c4ccccc34)C(C)(C)[C@H]21	ZINC001087293844	1359374395	/nfs/dbraw/zinc/37/43/95/1359374395.db2.gz	KVTVXBUPTSBQBM-AHRSYUTCSA-N	0	3	349.478	3.030	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc(F)c3Cl)C(C)(C)[C@H]21	ZINC001087304771	1359389745	/nfs/dbraw/zinc/38/97/45/1359389745.db2.gz	HMINMRRUULFHGJ-XYPHTWIQSA-N	0	3	348.849	3.331	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc4c(c3)CCC=C4)C(C)(C)[C@H]21	ZINC001087314589	1359404489	/nfs/dbraw/zinc/40/44/89/1359404489.db2.gz	NPXVUHPMPQBGBL-NJYVYQBISA-N	0	3	348.490	3.498	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc(C(F)F)c3)C(C)(C)[C@@H]21	ZINC001087315327	1359404905	/nfs/dbraw/zinc/40/49/05/1359404905.db2.gz	ZTCQXALNDMCJRN-BRWVUGGUSA-N	0	3	346.421	3.476	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc(C(F)F)c3)C(C)(C)[C@H]21	ZINC001087315330	1359405356	/nfs/dbraw/zinc/40/53/56/1359405356.db2.gz	ZTCQXALNDMCJRN-ZACQAIPSSA-N	0	3	346.421	3.476	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)[C@@H]2CC23CCC3)C1	ZINC001087438566	1359465777	/nfs/dbraw/zinc/46/57/77/1359465777.db2.gz	FLIHXPZTKKZPEP-HSALFYBXSA-N	0	3	336.479	3.174	20	30		EGEDHN
C=CCCN1CC[C@H](c2ccc(F)cc2)[C@H](NC(=O)[C@H]2CC23CC3)C1	ZINC001087468406	1359480504	/nfs/dbraw/zinc/48/05/04/1359480504.db2.gz	XETGRCVQNZFYOL-GUDVDZBRSA-N	0	3	342.458	3.476	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)C[C@@H]2C=CCC2)CCN1Cc1cccc(C#N)c1	ZINC001087496857	1359496819	/nfs/dbraw/zinc/49/68/19/1359496819.db2.gz	OKAKWOSPJOFIHC-LSTHTHJFSA-N	0	3	337.467	3.384	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)c2cc(C#N)c[nH]2)CCN1Cc1csc(C)c1	ZINC001087535603	1359518380	/nfs/dbraw/zinc/51/83/80/1359518380.db2.gz	RWEWCOMVFMMODX-DOTOQJQBSA-N	0	3	342.468	3.039	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2c(C)nn(C(C)(C)C)c2C)[C@H]1CC	ZINC001087592950	1359546576	/nfs/dbraw/zinc/54/65/76/1359546576.db2.gz	HFPMTXKCOBBRHL-DLBZAZTESA-N	0	3	346.519	3.414	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2c(Cl)n[nH]c2C2CC2)[C@H]1CC	ZINC001087598209	1359548839	/nfs/dbraw/zinc/54/88/39/1359548839.db2.gz	YSDKQLKWRPOJQA-QWHCGFSZSA-N	0	3	336.867	3.099	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccccc2-n2cccc2)[C@H]1CC	ZINC001087711603	1359604313	/nfs/dbraw/zinc/60/43/13/1359604313.db2.gz	NCXNXLSQAFZQCJ-RBUKOAKNSA-N	0	3	335.451	3.083	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2ccc(F)c(Cl)c2F)[C@H]1CC	ZINC001087712853	1359604701	/nfs/dbraw/zinc/60/47/01/1359604701.db2.gz	DGYCBOVXXGKWRC-UONOGXRCSA-N	0	3	340.801	3.224	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2csc(C(C)(C)C)n2)[C@H]1CC	ZINC001087762605	1359631987	/nfs/dbraw/zinc/63/19/87/1359631987.db2.gz	DATKAVJQKZALGP-DZGCQCFKSA-N	0	3	333.501	3.047	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccnc(O[C@H](C)CC)c2)[C@H]1CC	ZINC001087789249	1359646455	/nfs/dbraw/zinc/64/64/55/1359646455.db2.gz	GMUOMXFVQJXCDF-HYVNUMGLSA-N	0	3	331.460	3.028	20	30		EGEDHN
CCC(CC)C(=O)N1C[C@H]2CCN(Cc3cccc(C#N)c3)C[C@H]2C1	ZINC001087890360	1359699773	/nfs/dbraw/zinc/69/97/73/1359699773.db2.gz	FWSYDXKDCODRNU-UXHICEINSA-N	0	3	339.483	3.275	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)C[C@@H](C)c3ccc(CC)cc3)C[C@@H]2C1	ZINC001088103125	1359757149	/nfs/dbraw/zinc/75/71/49/1359757149.db2.gz	KIXVXBIHTOVNKW-UIFIKXQLSA-N	0	3	338.495	3.156	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)[C@H](CC3CCCC3)C(C)C)C[C@@H]2C1	ZINC001088128502	1359767417	/nfs/dbraw/zinc/76/74/17/1359767417.db2.gz	SLCDDTYYZAYSMG-HSALFYBXSA-N	0	3	330.516	3.252	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCCCN(C(=O)C=C2CCC2)C1	ZINC001088294336	1359828860	/nfs/dbraw/zinc/82/88/60/1359828860.db2.gz	VYWSJOCJBPPANB-OAHLLOKOSA-N	0	3	341.293	3.366	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)C[C@H]2CC(C)(C)CO2)C1	ZINC001088346614	1359833378	/nfs/dbraw/zinc/83/33/78/1359833378.db2.gz	UKJVKYJGAAGKPP-HOTGVXAUSA-N	0	3	342.911	3.305	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2cc(CCC)n[nH]2)C1	ZINC001088357008	1359841190	/nfs/dbraw/zinc/84/11/90/1359841190.db2.gz	QKQJLCNTPRJVRO-OAHLLOKOSA-N	0	3	338.883	3.089	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCCCC[C@@H](NCc2cnoc2C)C1	ZINC001088358864	1359842163	/nfs/dbraw/zinc/84/21/63/1359842163.db2.gz	LSUCOIWOQVFKRY-QGZVFWFLSA-N	0	3	333.476	3.446	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCCCC[C@H](NCc2cnc(C)nc2)C1	ZINC001088374493	1359855979	/nfs/dbraw/zinc/85/59/79/1359855979.db2.gz	IRFDHDLTPSIFGE-AZUAARDMSA-N	0	3	344.503	3.248	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2cccn3ccnc23)C1	ZINC001088397717	1359872960	/nfs/dbraw/zinc/87/29/60/1359872960.db2.gz	PASBHOSYSIAYOR-HNNXBMFYSA-N	0	3	346.862	3.061	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)COc2ccccc2)C1	ZINC001088418805	1359888601	/nfs/dbraw/zinc/88/86/01/1359888601.db2.gz	ZKKFZTPFJKTREB-MRXNPFEDSA-N	0	3	336.863	3.179	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)[C@@H](C)C2CCOCC2)C1	ZINC001088435738	1359903248	/nfs/dbraw/zinc/90/32/48/1359903248.db2.gz	NVILOBSZZZQUSX-DOTOQJQBSA-N	0	3	342.911	3.162	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](CNCc2c(F)cccc2F)[C@H](C)C1	ZINC001184303438	1387425245	/nfs/dbraw/zinc/42/52/45/1387425245.db2.gz	YYXFBCSJNZIYJW-CVEARBPZSA-N	0	3	348.437	3.343	20	30		EGEDHN
C[C@@H]1[C@@H](NC(=O)c2cc(C#N)c[nH]2)CCN1Cc1ccc(C2CC2)cc1	ZINC001088511581	1359948708	/nfs/dbraw/zinc/94/87/08/1359948708.db2.gz	UJXICEFBHFKSDN-KUHUBIRLSA-N	0	3	348.450	3.157	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2cc3cc(Cl)ccc3[nH]2)[C@H]1C	ZINC001088785909	1360044766	/nfs/dbraw/zinc/04/47/66/1360044766.db2.gz	FWYHVCHGDZDHBZ-DOMZBBRYSA-N	0	3	329.831	3.037	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3ccc(C)cc3)[C@@H]2C)cc1	ZINC001088787607	1360045261	/nfs/dbraw/zinc/04/52/61/1360045261.db2.gz	SYNZJSCMABUCGM-UTKZUKDTSA-N	0	3	332.447	3.369	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@H](CNC/C(Cl)=C\Cl)[C@@H](C)C1	ZINC001184358420	1387439969	/nfs/dbraw/zinc/43/99/69/1387439969.db2.gz	WKEXIFFGZLYUFA-ADFWIADRSA-N	0	3	331.287	3.039	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCCN1C(=O)C1CC=CC1	ZINC001089142874	1360198096	/nfs/dbraw/zinc/19/80/96/1360198096.db2.gz	HAEMXAUQMHZARO-FQEVSTJZSA-N	0	3	337.467	3.337	20	30		EGEDHN
CC(F)(F)C(=O)N[C@H]1CCN(CC#Cc2ccccc2)CC(C)(C)C1	ZINC001089299299	1360318265	/nfs/dbraw/zinc/31/82/65/1360318265.db2.gz	RQRNCKBTLRIZKC-KRWDZBQOSA-N	0	3	348.437	3.300	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(C(C)C)nc2)CC(C)(C)C1	ZINC001089403298	1360402412	/nfs/dbraw/zinc/40/24/12/1360402412.db2.gz	QONKLZBURKTFIC-QGZVFWFLSA-N	0	3	327.472	3.059	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2cccc3ncccc23)CC(C)(C)C1	ZINC001089439072	1360429699	/nfs/dbraw/zinc/42/96/99/1360429699.db2.gz	QLUIGDABGWSHDL-GOSISDBHSA-N	0	3	349.478	3.017	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(C)nc2C2CC2)CC(C)(C)C1	ZINC001089449089	1360437922	/nfs/dbraw/zinc/43/79/22/1360437922.db2.gz	HPAZAPYOCQHEHW-QGZVFWFLSA-N	0	3	339.483	3.121	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2scnc2C(C)(C)C)CC(C)(C)C1	ZINC001089515352	1360485491	/nfs/dbraw/zinc/48/54/91/1360485491.db2.gz	VTUWEIDQXDSPMY-AWEZNQCLSA-N	0	3	347.528	3.294	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2scnc2C2CC2)CC(C)(C)C1	ZINC001089515388	1360485688	/nfs/dbraw/zinc/48/56/88/1360485688.db2.gz	WQVCAXPRDCPWES-OAHLLOKOSA-N	0	3	345.512	3.264	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cnoc2C(C)C)CC(C)(C)C1	ZINC001089534425	1360494388	/nfs/dbraw/zinc/49/43/88/1360494388.db2.gz	SRPPZLYEGHOGCX-HNNXBMFYSA-N	0	3	331.460	3.042	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2oc(CCC)nc2C)CC(C)(C)C1	ZINC001089540960	1360498051	/nfs/dbraw/zinc/49/80/51/1360498051.db2.gz	GECNTUWAACBDLY-INIZCTEOSA-N	0	3	345.487	3.179	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc(C)nc3ccccc32)CC(C)(C)C1	ZINC001089551258	1360502823	/nfs/dbraw/zinc/50/28/23/1360502823.db2.gz	FKKHUDDUQOAVQW-QGZVFWFLSA-N	0	3	349.478	3.397	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc(Cl)ccc2OC)CC(C)(C)C1	ZINC001089555868	1360505805	/nfs/dbraw/zinc/50/58/05/1360505805.db2.gz	NEKIPJITPFMQDT-HNNXBMFYSA-N	0	3	348.874	3.202	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@@H](C)c2cccc(F)c2)CC(C)(C)C1	ZINC001089560253	1360508181	/nfs/dbraw/zinc/50/81/81/1360508181.db2.gz	AJAVUZVCYZVUJX-MAUKXSAKSA-N	0	3	330.447	3.169	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc(C)c(F)c(C)c2)CC(C)(C)C1	ZINC001089561585	1360508946	/nfs/dbraw/zinc/50/89/46/1360508946.db2.gz	RQNSTCPOUJYMSB-KRWDZBQOSA-N	0	3	330.447	3.296	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cn(C)nc1C1CC1	ZINC001089646488	1360559035	/nfs/dbraw/zinc/55/90/35/1360559035.db2.gz	OFAVWDJEQOUTSC-INIZCTEOSA-N	0	3	344.503	3.094	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ncccc1CC	ZINC001089661172	1360571608	/nfs/dbraw/zinc/57/16/08/1360571608.db2.gz	SZPXVKUYKGPBJB-QGZVFWFLSA-N	0	3	329.488	3.441	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H]1COc2ccccc2C1	ZINC001089667126	1360576994	/nfs/dbraw/zinc/57/69/94/1360576994.db2.gz	BMJCYPWOHZFMAH-ROUUACIJSA-N	0	3	342.483	3.031	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1c(C)onc1C1CC1	ZINC001089671392	1360581460	/nfs/dbraw/zinc/58/14/60/1360581460.db2.gz	QQABWJHJUFJHNQ-MRXNPFEDSA-N	0	3	343.471	3.104	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc2ccccn2c1	ZINC001089705490	1360607831	/nfs/dbraw/zinc/60/78/31/1360607831.db2.gz	GFCXIQPYUCYRCU-SFHVURJKSA-N	0	3	325.456	3.346	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cnn(CCC)c1C	ZINC001089716164	1360617742	/nfs/dbraw/zinc/61/77/42/1360617742.db2.gz	AXOWAXYVVWYFBI-KRWDZBQOSA-N	0	3	346.519	3.398	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cnn(CC(C)C)c1	ZINC001089716740	1360618227	/nfs/dbraw/zinc/61/82/27/1360618227.db2.gz	QCCWQIFGMGUAJV-GOSISDBHSA-N	0	3	346.519	3.336	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cn2ccccc2n1	ZINC001089730224	1360633248	/nfs/dbraw/zinc/63/32/48/1360633248.db2.gz	XUCJLJZIOOHZGK-INIZCTEOSA-N	0	3	340.471	3.131	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc2c(s1)CCC2	ZINC001089730134	1360633418	/nfs/dbraw/zinc/63/34/18/1360633418.db2.gz	WRSBINSIQMYWGG-MRXNPFEDSA-N	0	3	344.524	3.481	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](CNCc2cc(C)no2)[C@@H](C)C1	ZINC001184457950	1387465622	/nfs/dbraw/zinc/46/56/22/1387465622.db2.gz	CRDJUFWUBKHNNY-MAUKXSAKSA-N	0	3	345.487	3.326	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1ccc(C)o1	ZINC001089767630	1360656982	/nfs/dbraw/zinc/65/69/82/1360656982.db2.gz	XXSKNZSPKPSLLX-FZKCQIBNSA-N	0	3	334.847	3.123	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1CC2(CCC2)C1	ZINC001089849598	1360696700	/nfs/dbraw/zinc/69/67/00/1360696700.db2.gz	HENHKMSJTYLALQ-RANZSIQMSA-N	0	3	348.918	3.488	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1cc(C)co1	ZINC001089850937	1360697424	/nfs/dbraw/zinc/69/74/24/1360697424.db2.gz	RKWBGEUTRKDNAD-JONQDZQNSA-N	0	3	334.847	3.123	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1(C)CC(=C)C1	ZINC001089865589	1360708408	/nfs/dbraw/zinc/70/84/08/1360708408.db2.gz	QWURTJKHLVTWDP-NXOAAHMSSA-N	0	3	334.891	3.264	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(F)cc2)CC2(CCOCC2)C1	ZINC001089914882	1360742139	/nfs/dbraw/zinc/74/21/39/1360742139.db2.gz	ZCAZKVAIJLXVHA-GOSISDBHSA-N	0	3	346.446	3.003	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](CNCc2cc(C3CC3)no2)[C@@H](C)C1	ZINC001184498813	1387473762	/nfs/dbraw/zinc/47/37/62/1387473762.db2.gz	VWMYFEKKWAEFTL-RDJZCZTQSA-N	0	3	345.487	3.483	20	30		EGEDHN
C=C(C)CN1CC[C@@H](NC(=O)c2ccc(C(C)(C)CC)cc2)[C@@H](O)C1	ZINC001090346878	1360893957	/nfs/dbraw/zinc/89/39/57/1360893957.db2.gz	HXMWSTNJBFDQTJ-MOPGFXCFSA-N	0	3	344.499	3.115	20	30		EGEDHN
C=CCOc1ccc(C(=O)NCC2CC(NCC(=C)Cl)C2)cc1	ZINC001091103878	1360993209	/nfs/dbraw/zinc/99/32/09/1360993209.db2.gz	LLGRRADMXYGUPN-UHFFFAOYSA-N	0	3	334.847	3.102	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C2CCc3ccccc3CC2)C1	ZINC001091108984	1360993670	/nfs/dbraw/zinc/99/36/70/1360993670.db2.gz	OVFBBUWEAPRXDT-UHFFFAOYSA-N	0	3	346.902	3.419	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc(C)cc(OC)c2C)C1	ZINC001091121782	1360994541	/nfs/dbraw/zinc/99/45/41/1360994541.db2.gz	RYOBQIHNYBJRDF-UHFFFAOYSA-N	0	3	336.863	3.163	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2nccc3ccccc32)C1	ZINC001091207061	1361007558	/nfs/dbraw/zinc/00/75/58/1361007558.db2.gz	MVMRWBXLRVMRQL-UHFFFAOYSA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(F)c(Cl)c2)C1	ZINC001091209762	1361008727	/nfs/dbraw/zinc/00/87/27/1361008727.db2.gz	JQZYBQMRKGOZSU-UHFFFAOYSA-N	0	3	331.218	3.330	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc3ncccc3c2)C1	ZINC001091210478	1361008750	/nfs/dbraw/zinc/00/87/50/1361008750.db2.gz	GGZIBAAIGFRWPK-UHFFFAOYSA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc(C(CC)CC)no2)C1	ZINC001091270553	1361027356	/nfs/dbraw/zinc/02/73/56/1361027356.db2.gz	WECUTSPOWKMZRE-UHFFFAOYSA-N	0	3	339.867	3.429	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H]2C[C@H]2c2ccccc2F)C1	ZINC001091274530	1361028617	/nfs/dbraw/zinc/02/86/17/1361028617.db2.gz	SXLLBLVIRPLGIR-FPCDFSMTSA-N	0	3	336.838	3.166	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H]2C[C@H]2c2ccccc2OC)C1	ZINC001091275601	1361028977	/nfs/dbraw/zinc/02/89/77/1361028977.db2.gz	KWZPRBYGEPTSST-YQEWQEHLSA-N	0	3	348.874	3.036	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc(Cl)cc(OC)c2)C1	ZINC001091295621	1361034889	/nfs/dbraw/zinc/03/48/89/1361034889.db2.gz	AKCVGJJZEIOWTI-UHFFFAOYSA-N	0	3	343.254	3.199	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H]2Cc3ccc(Cl)cc32)C1	ZINC001091346388	1361053216	/nfs/dbraw/zinc/05/32/16/1361053216.db2.gz	DXVFJSAKWRIHHA-HFLCMSJXSA-N	0	3	339.266	3.217	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H]3CN(Cc4cccnc4)C[C@@]3(C)C2)CC1	ZINC001091979279	1361265545	/nfs/dbraw/zinc/26/55/45/1361265545.db2.gz	ZBJDLZGFWVMOAB-CTNGQTDRSA-N	0	3	339.483	3.108	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3ccc(F)c4ccccc34)C[C@]2(C)C1	ZINC001092037499	1361278782	/nfs/dbraw/zinc/27/87/82/1361278782.db2.gz	QFMPYOFZRGRVGR-VFNWGFHPSA-N	0	3	336.410	3.006	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3ccc(Cl)cc3Cl)C[C@]2(C)C1	ZINC001092223345	1361329747	/nfs/dbraw/zinc/32/97/47/1361329747.db2.gz	JREUAVBHKFBMTO-PXAZEXFGSA-N	0	3	337.250	3.021	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3ccc(C4=CCCC4)cc3)C[C@]2(C)C1	ZINC001092333072	1361366874	/nfs/dbraw/zinc/36/68/74/1361366874.db2.gz	TXRKJLOWLCSSRV-IRLDBZIGSA-N	0	3	334.463	3.281	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C[C@H]2CC=CCC2)CC1	ZINC001093376799	1361586974	/nfs/dbraw/zinc/58/69/74/1361586974.db2.gz	OGVUPRHSLVBHOY-GHTZIAJQSA-N	0	3	340.511	3.459	20	30		EGEDHN
N#Cc1ccc(NC(=O)N2CC[C@@H]3CN(Cc4ccccc4)C[C@H]32)cc1	ZINC001184742206	1387524973	/nfs/dbraw/zinc/52/49/73/1387524973.db2.gz	FRIVCXYDLWTNOU-UYAOXDASSA-N	0	3	346.434	3.296	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3coc4cc(F)ccc34)CCC[C@@H]12	ZINC001094453935	1361807546	/nfs/dbraw/zinc/80/75/46/1361807546.db2.gz	GYUOACGMVIQVPI-UYAOXDASSA-N	0	3	340.398	3.180	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@]23CCC[C@H]2N(C[C@@H](F)CC)CC3)cc1	ZINC001094486345	1361825035	/nfs/dbraw/zinc/82/50/35/1361825035.db2.gz	BBBSYZFUAGOWQK-QKNQBKEWSA-N	0	3	342.458	3.390	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)CC1(c2ccc(F)cc2)CCC1	ZINC001184887164	1387554861	/nfs/dbraw/zinc/55/48/61/1387554861.db2.gz	TWHKMRCOVWJBLE-SFHVURJKSA-N	0	3	330.447	3.404	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1ccc(CCCC)cc1)C2	ZINC001095702848	1362205519	/nfs/dbraw/zinc/20/55/19/1362205519.db2.gz	CLFJHNNTTZFIEB-HKBOAZHASA-N	0	3	338.495	3.317	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1)C2	ZINC001095913344	1362285126	/nfs/dbraw/zinc/28/51/26/1362285126.db2.gz	HFRJCQMXXGMQEP-ZSAUSMIDSA-N	0	3	348.899	3.250	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1ccc(F)c(Cl)c1)C2	ZINC001096059182	1362358072	/nfs/dbraw/zinc/35/80/72/1362358072.db2.gz	YOQJFGUHDAMUIN-COXVUDFISA-N	0	3	336.838	3.319	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](C)c1cc3ccccc3o1)C2	ZINC001096305159	1362458428	/nfs/dbraw/zinc/45/84/28/1362458428.db2.gz	OMZVBJSVLYKGJX-BGTYHANMSA-N	0	3	336.435	3.281	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@]1(c3ccccc3)C[C@H](F)C1)C2	ZINC001096454989	1362518095	/nfs/dbraw/zinc/51/80/95/1362518095.db2.gz	GWNPEKWGARNOCD-XLIFZOOWSA-N	0	3	342.458	3.354	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C1(c3ccccc3)CCCC1)C2	ZINC001096492442	1362535531	/nfs/dbraw/zinc/53/55/31/1362535531.db2.gz	XLEYBIMXDIDXFY-AABGKKOBSA-N	0	3	336.479	3.243	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cccc3c1CCCCC3)C2	ZINC001097281304	1362912386	/nfs/dbraw/zinc/91/23/86/1362912386.db2.gz	HOGAGWQHWLDXMO-UIFIKXQLSA-N	0	3	336.479	3.314	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc(F)cc3cccnc31)C2	ZINC001097967670	1363182726	/nfs/dbraw/zinc/18/27/26/1363182726.db2.gz	DFYKKSIAUXCNSA-NXHRZFHOSA-N	0	3	339.414	3.285	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(-c3ccccc3)nc1)C2	ZINC001098095264	1363221886	/nfs/dbraw/zinc/22/18/86/1363221886.db2.gz	HLGYZBPQIULQCQ-NRSPTQNISA-N	0	3	345.446	3.107	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc3c(s1)CCOC3)C2	ZINC001098238668	1363265937	/nfs/dbraw/zinc/26/59/37/1363265937.db2.gz	HHVVEEYVUNDOOR-OAGGEKHMSA-N	0	3	346.496	3.122	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cnc(C3CC3)s1)C2	ZINC001098255233	1363272805	/nfs/dbraw/zinc/27/28/05/1363272805.db2.gz	BGQYAZAGAKERLW-KFWWJZLASA-N	0	3	331.485	3.322	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1c(CC)oc3ccccc31)C2	ZINC001098469679	1363334995	/nfs/dbraw/zinc/33/49/95/1363334995.db2.gz	TXOKGEMLBPOZRI-OIISXLGYSA-N	0	3	336.435	3.354	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)C[C@H](NC(=O)C(C)C)c1ccccc1O2	ZINC001098541907	1363364781	/nfs/dbraw/zinc/36/47/81/1363364781.db2.gz	TVRQOXCSZLWKMA-FXAWDEMLSA-N	0	3	328.456	3.303	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C=C1CCCCC1)C[C@@H](C)O2	ZINC001098571190	1363382122	/nfs/dbraw/zinc/38/21/22/1363382122.db2.gz	NUXFGYGBOCOFJM-QGZVFWFLSA-N	0	3	332.488	3.145	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)CC1=CCCCC1)C[C@@H](C)O2	ZINC001098578287	1363386189	/nfs/dbraw/zinc/38/61/89/1363386189.db2.gz	PXMCWCFQSJTCTJ-QGZVFWFLSA-N	0	3	332.488	3.145	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1csc(C)c1C)C[C@@H](C)O2	ZINC001098600045	1363394088	/nfs/dbraw/zinc/39/40/88/1363394088.db2.gz	RXWQHZVMGMRJIP-CQSZACIVSA-N	0	3	348.512	3.246	20	30		EGEDHN
C=CCCCCCNCc1cn([C@@H]2CCN(C(=O)CCCC)C2)nn1	ZINC001098618536	1363401579	/nfs/dbraw/zinc/40/15/79/1363401579.db2.gz	DAXZGXUJDGRJHU-GOSISDBHSA-N	0	3	347.507	3.078	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1cc(F)ccc1C)C[C@@H](C)O2	ZINC001098623401	1363403466	/nfs/dbraw/zinc/40/34/66/1363403466.db2.gz	FJEGVERQURSTJG-MRXNPFEDSA-N	0	3	346.446	3.016	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N[C@]12CCC[C@H]1CN(Cc1cccc(C#N)c1)C2	ZINC001098796128	1363470657	/nfs/dbraw/zinc/47/06/57/1363470657.db2.gz	GLRIGPGMMYPIIG-WFXMLNOXSA-N	0	3	337.467	3.075	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ocnc2-c2ccccc2)C1	ZINC001098867932	1363498701	/nfs/dbraw/zinc/49/87/01/1363498701.db2.gz	WKXCTNFGLWKLNG-JXFKEZNVSA-N	0	3	337.423	3.112	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(C)oc1C	ZINC001098879655	1363501934	/nfs/dbraw/zinc/50/19/34/1363501934.db2.gz	DFFWYWVBRURGLI-KRWDZBQOSA-N	0	3	348.487	3.319	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)Cc2ccc(F)cc2Cl)C1	ZINC001099013679	1363574344	/nfs/dbraw/zinc/57/43/44/1363574344.db2.gz	RZDDGWNSLHLJKM-KSSFIOAISA-N	0	3	336.838	3.178	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(C)c(C)o1	ZINC001099016527	1363576618	/nfs/dbraw/zinc/57/66/18/1363576618.db2.gz	LQCPJFFUIQDZTE-KRWDZBQOSA-N	0	3	348.487	3.319	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2noc3c2CCCCC3)C1	ZINC001099057290	1363598966	/nfs/dbraw/zinc/59/89/66/1363598966.db2.gz	SIRQGIAOLXGSHL-YWZLYKJASA-N	0	3	343.471	3.104	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(OCC)c(C)c2)C1	ZINC001099059700	1363600245	/nfs/dbraw/zinc/60/02/45/1363600245.db2.gz	HXOSKOVVDHOIPU-PXNSSMCTSA-N	0	3	328.456	3.164	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(OCC)c(C)c2)C1	ZINC001099060144	1363601265	/nfs/dbraw/zinc/60/12/65/1363601265.db2.gz	LWHCSXNRDJRYPF-RXVVDRJESA-N	0	3	340.467	3.001	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)C(C)(C)CC(F)F	ZINC001099106425	1363625084	/nfs/dbraw/zinc/62/50/84/1363625084.db2.gz	FPPDNTSMWSCMQV-AWEZNQCLSA-N	0	3	328.447	3.298	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)C2CCC(C(F)F)CC2)C1	ZINC001099142988	1363651979	/nfs/dbraw/zinc/65/19/79/1363651979.db2.gz	GTFSAMZZNUNHSJ-GETDIDHLSA-N	0	3	338.442	3.052	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2cc3c(s2)CCC3)C1	ZINC001099149977	1363657262	/nfs/dbraw/zinc/65/72/62/1363657262.db2.gz	PAHWNBIYVFBAOD-KXBFYZLASA-N	0	3	330.497	3.397	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cccc(OCC(C)C)c2)C1	ZINC001099154147	1363659856	/nfs/dbraw/zinc/65/98/56/1363659856.db2.gz	TYPCOKNVMOIROF-RXVVDRJESA-N	0	3	342.483	3.492	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(CC(C)C)cc2)C1	ZINC001099155468	1363660903	/nfs/dbraw/zinc/66/09/03/1363660903.db2.gz	QTGWJXXSJDVHLR-UNMCSNQZSA-N	0	3	338.495	3.493	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)C1(C)CCCC1	ZINC001099158637	1363662579	/nfs/dbraw/zinc/66/25/79/1363662579.db2.gz	JLTJLZBQPUZQFI-QGZVFWFLSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@H](C)CC(=C)C	ZINC001099187979	1363679720	/nfs/dbraw/zinc/67/97/20/1363679720.db2.gz	AJNCTEJWHYCWOA-MSOLQXFVSA-N	0	3	336.520	3.398	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2cc(F)ccc2F)C[C@H]1C(F)(F)F	ZINC001099264523	1363722325	/nfs/dbraw/zinc/72/23/25/1363722325.db2.gz	LXUZOKDTOCXOFJ-TZMCWYRMSA-N	0	3	348.315	3.133	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@H]2CCC(C)(C)C2)C[C@H]1C(F)(F)F	ZINC001099302772	1363738517	/nfs/dbraw/zinc/73/85/17/1363738517.db2.gz	BEYLHGHWNXIJHS-BFHYXJOUSA-N	0	3	332.410	3.368	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2c(C)cccc2C)C[C@H]1C(F)(F)F	ZINC001099312205	1363744907	/nfs/dbraw/zinc/74/49/07/1363744907.db2.gz	MEPKLEGPZXINJR-HUUCEWRRSA-N	0	3	340.389	3.472	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)CCCc1ccccn1	ZINC001099320266	1363747640	/nfs/dbraw/zinc/74/76/40/1363747640.db2.gz	HSZYYLWOUPUBRK-SFHVURJKSA-N	0	3	329.488	3.197	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2ccc(C3CC3)s2)C[C@H]1C(F)(F)F	ZINC001099330670	1363753796	/nfs/dbraw/zinc/75/37/96/1363753796.db2.gz	CHYQEOZMWDQDEK-VXGBXAGGSA-N	0	3	344.402	3.404	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)COc1ccc(C)cc1C	ZINC001099334756	1363757212	/nfs/dbraw/zinc/75/72/12/1363757212.db2.gz	MUTQITAYZMNAQI-GOSISDBHSA-N	0	3	344.499	3.475	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)Cc1csc(CC)n1	ZINC001099354418	1363768933	/nfs/dbraw/zinc/76/89/33/1363768933.db2.gz	SAPHZBKGOHXLCQ-INIZCTEOSA-N	0	3	349.544	3.431	20	30		EGEDHN
CCCC(=O)N1C[C@@H]2CCC[C@]2(CNCc2cc(F)ccc2C#N)C1	ZINC001099358804	1363772018	/nfs/dbraw/zinc/77/20/18/1363772018.db2.gz	CMGYYZZGIUKFPO-PXNSSMCTSA-N	0	3	343.446	3.216	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)CC(F)(F)C(F)(F)F	ZINC001099379430	1363780759	/nfs/dbraw/zinc/78/07/59/1363780759.db2.gz	KBWJOHHXWDTWSN-LLVKDONJSA-N	0	3	342.352	3.367	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)CCC1(C)CC1	ZINC001099544552	1363841107	/nfs/dbraw/zinc/84/11/07/1363841107.db2.gz	QPTWHTGRQDNLPO-YVSFHVDLSA-N	0	3	336.907	3.488	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CC(=C)C)CC3(CCOCC3)C2)CCC1	ZINC001099589072	1363871633	/nfs/dbraw/zinc/87/16/33/1363871633.db2.gz	OYCQECOWRQWQDD-SFHVURJKSA-N	0	3	346.515	3.296	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)[C@H](C)CC2CCCC2)CC2(CCOCC2)C1	ZINC001099594483	1363877454	/nfs/dbraw/zinc/87/74/54/1363877454.db2.gz	DSTAQTOLURDQAN-MJGOQNOKSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)C[C@@H](C)C(C)(C)C)CC2(CCOCC2)C1	ZINC001099596602	1363879353	/nfs/dbraw/zinc/87/93/53/1363879353.db2.gz	HIFCMLAGJLAYSC-SJORKVTESA-N	0	3	336.520	3.232	20	30		EGEDHN
CCCCCCCCC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1O	ZINC001100085463	1364012113	/nfs/dbraw/zinc/01/21/13/1364012113.db2.gz	LRELGHFIENOTDR-VQTJNVASSA-N	0	3	346.515	3.489	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CCN(CC=C(C)C)C[C@@H]2O)CCCCC1	ZINC001100121516	1364021385	/nfs/dbraw/zinc/02/13/85/1364021385.db2.gz	BRYRPRTULGIADY-MSOLQXFVSA-N	0	3	334.504	3.031	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C(CC)CC)C[C@H]1c1ccc(OC)cc1	ZINC001100152600	1364028377	/nfs/dbraw/zinc/02/83/77/1364028377.db2.gz	AKSHMGSASLPBRB-VQTJNVASSA-N	0	3	342.483	3.039	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NCC1CC(NCc2cc(C)ccc2F)C1	ZINC001100166518	1364033358	/nfs/dbraw/zinc/03/33/58/1364033358.db2.gz	JCIRWYZQIBQRSB-KLHKWILBSA-N	0	3	348.462	3.100	20	30		EGEDHN
CC(C)C#CC(=O)NCC1CC(N[C@H](C)c2ccc(F)cc2F)C1	ZINC001100305168	1364073614	/nfs/dbraw/zinc/07/36/14/1364073614.db2.gz	XOBCIOIFOXKIJU-VQCLRJIVSA-N	0	3	334.410	3.170	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCC1CC(NCc2cccc(OCC)n2)C1	ZINC001100364902	1364093077	/nfs/dbraw/zinc/09/30/77/1364093077.db2.gz	ZQVOGZWPEUWYFY-UHFFFAOYSA-N	0	3	345.487	3.067	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)[C@](C)(F)CCCC)C1	ZINC001100461155	1364122880	/nfs/dbraw/zinc/12/28/80/1364122880.db2.gz	MXNOVJLXSAOWDU-SSDMNJCBSA-N	0	3	349.288	3.298	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100560198	1364162552	/nfs/dbraw/zinc/16/25/52/1364162552.db2.gz	XCRIHUMOWPCEBJ-UHFFFAOYSA-N	0	3	342.458	3.264	20	30		EGEDHN
C#CCCCCCC(=O)NCC1CC(NCc2c(C)nsc2C)C1	ZINC001100570112	1364166940	/nfs/dbraw/zinc/16/69/40/1364166940.db2.gz	DGMHHXSGLAPYLD-UHFFFAOYSA-N	0	3	347.528	3.328	20	30		EGEDHN
C=C/C(C)=C/CC(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1	ZINC001100583324	1364174161	/nfs/dbraw/zinc/17/41/61/1364174161.db2.gz	QKFXKWOFMVECHA-LNKIKWGQSA-N	0	3	341.430	3.204	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100595797	1364180898	/nfs/dbraw/zinc/18/08/98/1364180898.db2.gz	GSKRLRWWQIMVGC-VQSBYGRUSA-N	0	3	342.458	3.264	20	30		EGEDHN
C=CCC1(C(=O)NCC2CC(NCc3oc(CC)nc3C)C2)CCC1	ZINC001100645748	1364202836	/nfs/dbraw/zinc/20/28/36/1364202836.db2.gz	TVXNERVDXZYGLC-UHFFFAOYSA-N	0	3	345.487	3.276	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)NCC1CC(NCC#Cc2ccc(Cl)cc2)C1	ZINC001100687668	1364218945	/nfs/dbraw/zinc/21/89/45/1364218945.db2.gz	GDOVMULAJBTQIW-JGJLBUBWSA-N	0	3	344.886	3.222	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@H](CC)c2c(C)noc2C)C1	ZINC001100757804	1364248251	/nfs/dbraw/zinc/24/82/51/1364248251.db2.gz	KPUBOZCIAHNXDR-YMAMQOFZSA-N	0	3	339.867	3.022	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@H](c2cccnc2)C(C)C)C1	ZINC001100787141	1364261843	/nfs/dbraw/zinc/26/18/43/1364261843.db2.gz	RNGMAJRBUXFSOZ-PREGVCBESA-N	0	3	335.879	3.058	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)CC(CC)CC)C1	ZINC001100794352	1364264201	/nfs/dbraw/zinc/26/42/01/1364264201.db2.gz	QQHCKBPQCUYNHC-UHFFFAOYSA-N	0	3	331.298	3.206	20	30		EGEDHN
O=C(NCC1CC(NCC#Cc2ccccc2)C1)[C@@H]1CC12CCCC2	ZINC001100827906	1364281187	/nfs/dbraw/zinc/28/11/87/1364281187.db2.gz	ZYIAWEITJFQWEI-MHJFOBGBSA-N	0	3	336.479	3.103	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)C(C)(C)CC(C)C)C1	ZINC001100841042	1364286471	/nfs/dbraw/zinc/28/64/71/1364286471.db2.gz	CEONQGIXRDVRNM-UHFFFAOYSA-N	0	3	345.325	3.452	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)Cc2sc(C)cc2C)C1	ZINC001100929871	1364334224	/nfs/dbraw/zinc/33/42/24/1364334224.db2.gz	AFDCBNDACUIVJG-UHFFFAOYSA-N	0	3	326.893	3.144	20	30		EGEDHN
C=CCC1(C(=O)NCC2CC(NCc3cncs3)C2)CCCC1	ZINC001101080511	1364403860	/nfs/dbraw/zinc/40/38/60/1364403860.db2.gz	VDCAEXTXOVYICU-UHFFFAOYSA-N	0	3	333.501	3.264	20	30		EGEDHN
C=CCN1CC[C@H](Oc2ccnc(CNC(=O)C[C@@H](C)CCC)c2)C1	ZINC001101090671	1364408679	/nfs/dbraw/zinc/40/86/79/1364408679.db2.gz	OQUOZEOFECYBQL-LPHOPBHVSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=CCN1CC[C@H](Oc2ccnc(CNC(=O)C(C)(C)C(C)C)c2)C1	ZINC001101093857	1364410950	/nfs/dbraw/zinc/41/09/50/1364410950.db2.gz	LKTBMDTVTLMPEN-SFHVURJKSA-N	0	3	345.487	3.019	20	30		EGEDHN
C#CCCCC(=O)N1C[C@H]2CN(Cc3cc(F)ccc3C)C[C@@]2(C)C1	ZINC001101216889	1364467792	/nfs/dbraw/zinc/46/77/92/1364467792.db2.gz	NXDIBDNBRADVIA-NQIIRXRSSA-N	0	3	342.458	3.218	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)CCC(C)(C)c3ccccc3)C[C@]2(C)C1	ZINC001101487167	1364579668	/nfs/dbraw/zinc/57/96/68/1364579668.db2.gz	QVKXSSQWISDLCV-KNQAVFIVSA-N	0	3	338.495	3.158	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC(C(C)(C)CNCc2ccn(C)n2)CC1	ZINC001101545797	1364610385	/nfs/dbraw/zinc/61/03/85/1364610385.db2.gz	RSXSHAMQGLZFTQ-UHFFFAOYSA-N	0	3	346.519	3.131	20	30		EGEDHN
C=CCC[C@@H](C)N1CC2(C1)C[C@H](NC(=O)CC(C)(C)C)c1nccn12	ZINC001101610047	1364654826	/nfs/dbraw/zinc/65/48/26/1364654826.db2.gz	DVDWUZRBRJEBKJ-CVEARBPZSA-N	0	3	344.503	3.246	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1CNC(=O)CCC1CC1	ZINC001101830984	1364742388	/nfs/dbraw/zinc/74/23/88/1364742388.db2.gz	KWIUHNLOWDTMKP-RDTXWAMCSA-N	0	3	343.446	3.072	20	30		EGEDHN
C#CCCCC(=O)NC[C@@H]1CN(Cc2ccccc2Cl)C[C@H]1C	ZINC001101920682	1364775483	/nfs/dbraw/zinc/77/54/83/1364775483.db2.gz	FOXWHSOXDARFOJ-NVXWUHKLSA-N	0	3	332.875	3.328	20	30		EGEDHN
Cc1ccc(CN2C[C@@H](CNC(=O)C#CC3CC3)[C@H](C)C2)c(Cl)c1	ZINC001101951605	1364789119	/nfs/dbraw/zinc/78/91/19/1364789119.db2.gz	YIDZJHHBNITNGJ-CRAIPNDOSA-N	0	3	344.886	3.246	20	30		EGEDHN
CC(C)C(C)(C)C(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C	ZINC001102000141	1364805966	/nfs/dbraw/zinc/80/59/66/1364805966.db2.gz	BBTURHJSOIXKBP-UYAOXDASSA-N	0	3	340.511	3.404	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1CNC(=O)C1(C)CCCC1	ZINC001102200629	1364930089	/nfs/dbraw/zinc/93/00/89/1364930089.db2.gz	NDHBHBVBLAZQEF-UYAOXDASSA-N	0	3	338.495	3.303	20	30		EGEDHN
C#CCCCCC(=O)NCC[C@@H]1CN([C@@H](C)c2ncc(C)o2)C[C@H]1C	ZINC001102883486	1365272477	/nfs/dbraw/zinc/27/24/77/1365272477.db2.gz	UARPQSKXJNJITF-BPQIPLTHSA-N	0	3	345.487	3.312	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCC[C@@H]1CN(Cc2cc(C)no2)C[C@H]1C	ZINC001103021986	1365341773	/nfs/dbraw/zinc/34/17/73/1365341773.db2.gz	SAUUZEHAQSSSPG-CRAIPNDOSA-N	0	3	345.487	3.326	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2[nH]ccc2C2CC2)C1	ZINC001103072951	1365365292	/nfs/dbraw/zinc/36/52/92/1365365292.db2.gz	PKHJWJJLKKPXQQ-IUODEOHRSA-N	0	3	335.879	3.332	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cc(OC)cs2)C1	ZINC001103304963	1365483555	/nfs/dbraw/zinc/48/35/55/1365483555.db2.gz	HMFOQKQQEMNSCV-DGCLKSJQSA-N	0	3	342.892	3.197	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC[C@@H]1CN(Cc2cnc(C)o2)C[C@H]1C	ZINC001103307844	1365485467	/nfs/dbraw/zinc/48/54/67/1365485467.db2.gz	HHATZOLLIIYKCC-GDBMZVCRSA-N	0	3	333.476	3.160	20	30		EGEDHN
C#CCCCCCC(=O)NCC[C@@H]1CN(Cc2ccns2)C[C@H]1C	ZINC001103311699	1365487299	/nfs/dbraw/zinc/48/72/99/1365487299.db2.gz	HFTHEKXDXWAVOU-IAGOWNOFSA-N	0	3	347.528	3.301	20	30		EGEDHN
CC[C@H](F)C(=O)NCC[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1C	ZINC001103320176	1365491768	/nfs/dbraw/zinc/49/17/68/1365491768.db2.gz	PKJXWVCOFLQMIU-XYPHTWIQSA-N	0	3	349.425	3.020	20	30		EGEDHN
C=CCCCC(=O)NCC[C@@H]1CN(Cc2cc(C3CC3)no2)C[C@H]1C	ZINC001103382118	1365527159	/nfs/dbraw/zinc/52/71/59/1365527159.db2.gz	ADTFHTQXBYKEDM-NVXWUHKLSA-N	0	3	345.487	3.483	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC[C@@H]1CN(Cc2ccns2)C[C@H]1C	ZINC001103402050	1365538364	/nfs/dbraw/zinc/53/83/64/1365538364.db2.gz	YQQXARBEXRYBFH-RKVPGOIHSA-N	0	3	335.517	3.320	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2c[nH]c3ncccc23)C1	ZINC001103734709	1365755257	/nfs/dbraw/zinc/75/52/57/1365755257.db2.gz	PANTWBDTEXIMCE-TZMCWYRMSA-N	0	3	346.862	3.003	20	30		EGEDHN
CC(C)CC(=O)N1C[C@@H](C)[C@H](CCNCc2ccccc2C#N)C1	ZINC001103831652	1365803862	/nfs/dbraw/zinc/80/38/62/1365803862.db2.gz	XKFMPOIFVXPAPH-VQIMIIECSA-N	0	3	327.472	3.179	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2ccncc2CC)C[C@H]1C	ZINC001104371998	1365991939	/nfs/dbraw/zinc/99/19/39/1365991939.db2.gz	MJBCMAJEENZUQP-CZUORRHYSA-N	0	3	335.879	3.084	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2ccn3ccccc23)C[C@H]1C	ZINC001104406668	1366009012	/nfs/dbraw/zinc/00/90/12/1366009012.db2.gz	CDJUTMWUTVKEKN-GDBMZVCRSA-N	0	3	345.874	3.380	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2ccc3[nH]ccc3n2)C[C@H]1C	ZINC001104414519	1366013747	/nfs/dbraw/zinc/01/37/47/1366013747.db2.gz	ZYAJGULAPNBPNH-TZMCWYRMSA-N	0	3	346.862	3.003	20	30		EGEDHN
C#CCCCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2conc2C)C1	ZINC001104493904	1366048075	/nfs/dbraw/zinc/04/80/75/1366048075.db2.gz	RRMBNCVSJVJLIV-SJLPKXTDSA-N	0	3	345.487	3.141	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](C)[C@H](CCNCc2ccn(CC)n2)C1	ZINC001104563840	1366078552	/nfs/dbraw/zinc/07/85/52/1366078552.db2.gz	WZGSZSSTLBQXEZ-RCCFBDPRSA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](C)[C@H](CCNCc2oc(C)nc2C)C1	ZINC001104563803	1366078716	/nfs/dbraw/zinc/07/87/16/1366078716.db2.gz	VQGXFTSTHSXDAI-HDMKZQKVSA-N	0	3	347.503	3.468	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)CC2CC(OCC)C2)C[C@H]1C	ZINC001104573215	1366082616	/nfs/dbraw/zinc/08/26/16/1366082616.db2.gz	MAUMRRACYUBDTB-CRYBEJKASA-N	0	3	342.911	3.018	20	30		EGEDHN
C=CCCC1(C(=O)N2C[C@@H](C)[C@H](CCNCc3cnc(C)o3)C2)CC1	ZINC001104631246	1366110124	/nfs/dbraw/zinc/11/01/24/1366110124.db2.gz	GIEJOZSTEBJNLN-NVXWUHKLSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H](C)[C@H](CCNCc2ccc(F)cn2)C1	ZINC001104731368	1366148421	/nfs/dbraw/zinc/14/84/21/1366148421.db2.gz	FKEDBYYHUCCHAM-HZPDHXFCSA-N	0	3	347.478	3.397	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H](C)[C@H](CCNCc2conc2C)C1	ZINC001104731461	1366149156	/nfs/dbraw/zinc/14/91/56/1366149156.db2.gz	JRXFEXYJAJBNRY-GDBMZVCRSA-N	0	3	333.476	3.160	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)CC(C)=C(C)C)CC1	ZINC001105394540	1366443999	/nfs/dbraw/zinc/44/39/99/1366443999.db2.gz	ZVCHKVWSKOIHCN-HXUWFJFHSA-N	0	3	328.500	3.459	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)N[C@H]1C[C@@](CNCCF)(c2ccccc2)C1	ZINC001105433640	1366465798	/nfs/dbraw/zinc/46/57/98/1366465798.db2.gz	KMVSAVPVNZHFGN-HNAWSFBYSA-N	0	3	332.463	3.220	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@@H](CNCc2csc(CC)n2)[C@H](C)C1	ZINC001106031078	1366607457	/nfs/dbraw/zinc/60/74/57/1366607457.db2.gz	PLNGPMPGGSHAKU-HZPDHXFCSA-N	0	3	347.528	3.083	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](NCc2cc(C)ccc2OC)C1	ZINC001185933460	1387830014	/nfs/dbraw/zinc/83/00/14/1387830014.db2.gz	YQZPLJXZYJTFPP-QGZVFWFLSA-N	0	3	330.472	3.296	20	30		EGEDHN
CC(C)=CC(=O)NC[C@]12CCC[C@H]1N(CC#Cc1ccccc1)CC2	ZINC001107273540	1366912429	/nfs/dbraw/zinc/91/24/29/1366912429.db2.gz	PZANMXLAKBJSAU-IFMALSPDSA-N	0	3	336.479	3.365	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@]12CCC[C@H]1N(Cc1ocnc1C)CC2	ZINC001107424277	1366960308	/nfs/dbraw/zinc/96/03/08/1366960308.db2.gz	FWXZFGNPFHTYKB-IEBWSBKVSA-N	0	3	331.460	3.200	20	30		EGEDHN
CC(C)[C@H](C)CC(=O)N1CC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001189326205	1366991925	/nfs/dbraw/zinc/99/19/25/1366991925.db2.gz	DDBAZZZKEUAWPU-VQIMIIECSA-N	0	3	327.472	3.273	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCOC1CCCCCC1	ZINC001109204757	1367001254	/nfs/dbraw/zinc/00/12/54/1367001254.db2.gz	XAKJSYIDWXMAGZ-HOJAQTOUSA-N	0	3	346.515	3.251	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)C[C@@H](C)C3CCCCC3)[C@@H]2C1	ZINC001189398938	1367011629	/nfs/dbraw/zinc/01/16/29/1367011629.db2.gz	TZQSDQRXCAZGDE-YZGWKJHDSA-N	0	3	348.531	3.328	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@]12CCC[C@H]1N(Cc1conc1C)CC2	ZINC001107560834	1367043325	/nfs/dbraw/zinc/04/33/25/1367043325.db2.gz	YOLUULOLGDSBFF-YLJYHZDGSA-N	0	3	345.487	3.446	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C1(Cc3ccccc3)CCC1)C2	ZINC001109414954	1367111746	/nfs/dbraw/zinc/11/17/46/1367111746.db2.gz	VCZFLEFCRQNLIF-AABGKKOBSA-N	0	3	336.479	3.144	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2cccc(F)c2)C1	ZINC001107706188	1367112254	/nfs/dbraw/zinc/11/22/54/1367112254.db2.gz	IHRKEIYLAGGOEG-DNVCBOLYSA-N	0	3	334.435	3.001	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)C=C2CCCCC2)C1	ZINC001107786434	1367145840	/nfs/dbraw/zinc/14/58/40/1367145840.db2.gz	XYKAELVBEDFREJ-FXAWDEMLSA-N	0	3	334.504	3.439	20	30		EGEDHN
C[C@H](c1ccc(F)cc1)N(C)[C@H]1CCN(C(=O)C#CC(C)(C)C)C1	ZINC001190085280	1367169990	/nfs/dbraw/zinc/16/99/90/1367169990.db2.gz	WJLHTHLLRLPRBT-QAPCUYQASA-N	0	3	330.447	3.469	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCc1ccc(C(C)C)cc1)C2	ZINC001109517066	1367172214	/nfs/dbraw/zinc/17/22/14/1367172214.db2.gz	TVAFQWJLZGYXQC-HKBOAZHASA-N	0	3	338.495	3.487	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2cscc2C)C1	ZINC001107850967	1367174640	/nfs/dbraw/zinc/17/46/40/1367174640.db2.gz	USOMBUQPQALPLU-QAPCUYQASA-N	0	3	336.501	3.232	20	30		EGEDHN
C=CCCCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc(OCC)no1)C2	ZINC001109530027	1367180895	/nfs/dbraw/zinc/18/08/95/1367180895.db2.gz	DJQKVURISYQFKD-PMPSAXMXSA-N	0	3	347.459	3.155	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2C[C@@H]1CC(C)(C)CO1	ZINC001109604270	1367227460	/nfs/dbraw/zinc/22/74/60/1367227460.db2.gz	AZZGSJVSSSKPNG-XWSJACJDSA-N	0	3	346.515	3.107	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](N(C)CCOc2ccc(F)cc2)C1	ZINC001190388008	1367248355	/nfs/dbraw/zinc/24/83/55/1367248355.db2.gz	JXROAHJNJUZOSZ-QGZVFWFLSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@]1(C)CN(CC2CC(C)(C)C2)CCO1	ZINC001108114437	1367288482	/nfs/dbraw/zinc/28/84/82/1367288482.db2.gz	DPTZIJAXYNPDOJ-FQEVSTJZSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@]1(C)CN(CC2CCC(C)CC2)CCO1	ZINC001108119512	1367291648	/nfs/dbraw/zinc/29/16/48/1367291648.db2.gz	OJHVIBZLDMEAAZ-UHYCVJNDSA-N	0	3	336.520	3.232	20	30		EGEDHN
CC#CCCCC(=O)NC[C@]1(C)CN(C[C@@H](C)CC(C)C)CCO1	ZINC001108144163	1367305707	/nfs/dbraw/zinc/30/57/07/1367305707.db2.gz	LLHABBZGWKXMEX-AZUAARDMSA-N	0	3	336.520	3.069	20	30		EGEDHN
CC#CCCCC(=O)NC[C@]1(C)CN(CC2CCC(C)CC2)CCO1	ZINC001108143914	1367305958	/nfs/dbraw/zinc/30/59/58/1367305958.db2.gz	HMCWDAYAPKFGKU-GZNCHQMQSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2ccccc2CC)C1	ZINC001108166307	1367320202	/nfs/dbraw/zinc/32/02/02/1367320202.db2.gz	ZDDZNUOYARXQEO-DYESRHJHSA-N	0	3	344.499	3.424	20	30		EGEDHN
C=CCCC1(C(=O)NC[C@@]2(C)CN(CC(CC)CC)CCO2)CC1	ZINC001108185885	1367329275	/nfs/dbraw/zinc/32/92/75/1367329275.db2.gz	GSRBKJQGHWDERN-IBGZPJMESA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCCC1(C(=O)NC[C@]2(C)CN(CCC(C)(C)C)CCO2)CC1	ZINC001108185526	1367329478	/nfs/dbraw/zinc/32/94/78/1367329478.db2.gz	AWEHGOMLELQLCW-LJQANCHMSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2cc(C)cc(F)c2)C1	ZINC001108236910	1367353793	/nfs/dbraw/zinc/35/37/93/1367353793.db2.gz	UFUKISHONXGFFV-JXFKEZNVSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2ccc(C)cc2)C1	ZINC001108362831	1367412424	/nfs/dbraw/zinc/41/24/24/1367412424.db2.gz	SPESALLVMPMIMU-FXAWDEMLSA-N	0	3	330.472	3.170	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)Cc2ccccc2C)C1	ZINC001108390074	1367431295	/nfs/dbraw/zinc/43/12/95/1367431295.db2.gz	SJMGJSGNFUYCQU-NQIIRXRSSA-N	0	3	344.499	3.099	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2ccc(CCCC)cc2)C1	ZINC001191226641	1367451730	/nfs/dbraw/zinc/45/17/30/1367451730.db2.gz	KXUCNDDLXOOVMY-HXUWFJFHSA-N	0	3	344.499	3.378	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C(CC)(CC)c1ccccc1)C2	ZINC001110132796	1367515792	/nfs/dbraw/zinc/51/57/92/1367515792.db2.gz	JGTNUZRWLWHVKO-AABGKKOBSA-N	0	3	338.495	3.489	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCc1cc(C)sc1C)C2	ZINC001110174321	1367545734	/nfs/dbraw/zinc/54/57/34/1367545734.db2.gz	WVGDIJWVUUGJEN-SQNIBIBYSA-N	0	3	330.497	3.042	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@@H](C)CCc1ccccc1)C2	ZINC001110180217	1367549198	/nfs/dbraw/zinc/54/91/98/1367549198.db2.gz	YRYQINVGXWFMSN-NRDMVMEKSA-N	0	3	338.495	3.390	20	30		EGEDHN
C=CCC[C@@H](C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCOC)c1ccccc1	ZINC001110212893	1367566643	/nfs/dbraw/zinc/56/66/43/1367566643.db2.gz	TVVVZAVLHQVCFK-ZRNYENFQSA-N	0	3	342.483	3.104	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001191868161	1367620754	/nfs/dbraw/zinc/62/07/54/1367620754.db2.gz	OZEINKCYLQEWTQ-VQIMIIECSA-N	0	3	325.456	3.193	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@H](N(C)CCOc2ccccc2F)C1	ZINC001191889750	1367626870	/nfs/dbraw/zinc/62/68/70/1367626870.db2.gz	JRZHOLKQGTXOHQ-SJORKVTESA-N	0	3	348.462	3.340	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](N(C)C[C@@H](OC)c2ccccc2)C1	ZINC001192093422	1367686008	/nfs/dbraw/zinc/68/60/08/1367686008.db2.gz	JUMVNDIKBBENAS-RBUKOAKNSA-N	0	3	330.472	3.263	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@H](N(C)CCc3scnc3C)C2)CC1	ZINC001192205226	1367717378	/nfs/dbraw/zinc/71/73/78/1367717378.db2.gz	DFELHFLGQCERJS-INIZCTEOSA-N	0	3	347.528	3.273	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](N(C)C[C@H]3CC(C)(C)CO3)C2)CC1	ZINC001192217701	1367720717	/nfs/dbraw/zinc/72/07/17/1367720717.db2.gz	HYFVAGOFHIXAMF-IAGOWNOFSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCN1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)[C@H](F)CC)C1	ZINC001186196517	1387895285	/nfs/dbraw/zinc/89/52/85/1387895285.db2.gz	LAYZUURBXSQNND-KBAYOESNSA-N	0	3	336.426	3.282	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](N(C)C[C@H]3CC(C)(C)CO3)C2)CCC1	ZINC001192227556	1367724323	/nfs/dbraw/zinc/72/43/23/1367724323.db2.gz	SBQVXLDFJIGXCT-IAGOWNOFSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](N(C)C[C@H](OC)c3ccccc3)C2)C1	ZINC001192257402	1367732430	/nfs/dbraw/zinc/73/24/30/1367732430.db2.gz	ODAABEMFVRWKNH-OALUTQOASA-N	0	3	342.483	3.263	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)CC/C=C/c2ccccc2)C1	ZINC001192326866	1367753752	/nfs/dbraw/zinc/75/37/52/1367753752.db2.gz	UBCWDIGZEFCPTA-OEMHODTASA-N	0	3	342.483	3.215	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccc2ncccc2c1	ZINC001110493631	1367781376	/nfs/dbraw/zinc/78/13/76/1367781376.db2.gz	YNPUWPXQSGZQEY-NRSPTQNISA-N	0	3	347.462	3.260	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2[C@@H](C)c1cccc(OC)c1	ZINC001110496953	1367784772	/nfs/dbraw/zinc/78/47/72/1367784772.db2.gz	JAPPHILPWITCCS-ZSXHRAQDSA-N	0	3	340.467	3.281	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCc1cc3ccccc3o1)C2	ZINC001110788013	1367987257	/nfs/dbraw/zinc/98/72/57/1367987257.db2.gz	UFDNGKBZZBMIJP-QRQLOZEOSA-N	0	3	336.435	3.110	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)C2(C3CCCCC3)CC2)C1	ZINC001193704593	1368099534	/nfs/dbraw/zinc/09/95/34/1368099534.db2.gz	HKDXYHIPHKUBMI-SFHVURJKSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CC1CC(F)(F)C1	ZINC001110933752	1368103962	/nfs/dbraw/zinc/10/39/62/1368103962.db2.gz	PYAIREAYRRMXEL-XZDPQHSOSA-N	0	3	326.431	3.356	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2ccccc2C2CCC2)C1	ZINC001193747114	1368106370	/nfs/dbraw/zinc/10/63/70/1368106370.db2.gz	SXOKWARGTUCXSM-SFHVURJKSA-N	0	3	342.483	3.303	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2ccsc2C(F)F)C1	ZINC001193755088	1368108183	/nfs/dbraw/zinc/10/81/83/1368108183.db2.gz	FCPZESJSSOQFEM-LBPRGKRZSA-N	0	3	344.427	3.035	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCc1cc(Cl)cs1)C2	ZINC001111073303	1368153547	/nfs/dbraw/zinc/15/35/47/1368153547.db2.gz	DCCBYFKDYDCNQF-BMFZPTHFSA-N	0	3	336.888	3.079	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)C2(CC=C)CCCCC2)C1	ZINC001194192988	1368205820	/nfs/dbraw/zinc/20/58/20/1368205820.db2.gz	ZZUSCZOPQWDUKB-GOSISDBHSA-N	0	3	334.504	3.248	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)C[C@@H](C)c2ccc(F)cc2)C1	ZINC001194200875	1368207822	/nfs/dbraw/zinc/20/78/22/1368207822.db2.gz	PDEFIALWWBYQRC-APWZRJJASA-N	0	3	348.462	3.055	20	30		EGEDHN
C=CCCCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc(Cl)no1)C2	ZINC001111305254	1368261199	/nfs/dbraw/zinc/26/11/99/1368261199.db2.gz	JFZQVGXZZDXXNG-MCIONIFRSA-N	0	3	337.851	3.410	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H](O)[C@H](NC(=O)c2cc3ccccc3s2)C1	ZINC001194442577	1368262358	/nfs/dbraw/zinc/26/23/58/1368262358.db2.gz	DNVREHXZMNEAIK-NUEKZKHPSA-N	0	3	344.480	3.031	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](N(C)C[C@H]3CC(C)(C)CO3)C2)CCCC1	ZINC001194565792	1368288286	/nfs/dbraw/zinc/28/82/86/1368288286.db2.gz	ADJWCCITHKODHO-ZWKOTPCHSA-N	0	3	348.531	3.471	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)CC[C@H]1CCc3ccccc31)C2	ZINC001111446279	1368310503	/nfs/dbraw/zinc/31/05/03/1368310503.db2.gz	NQGIONSSEOAVFG-UKAVVXHISA-N	0	3	336.479	3.241	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCCC1CCCC1)C2	ZINC001111475949	1368315566	/nfs/dbraw/zinc/31/55/66/1368315566.db2.gz	LUCPGVNEACFKFP-QRVBRYPASA-N	0	3	334.504	3.271	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](C)Cc1ccccc1C)C2	ZINC001111478107	1368315835	/nfs/dbraw/zinc/31/58/35/1368315835.db2.gz	MQRSVUIZIMEQEL-AFYVEPGGSA-N	0	3	326.484	3.471	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](C)Cc1ccc(C)cc1)C2	ZINC001111475914	1368316201	/nfs/dbraw/zinc/31/62/01/1368316201.db2.gz	KFERKKOVCSBAPA-AFYVEPGGSA-N	0	3	326.484	3.471	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H]1CCCCC1(C)C)C2	ZINC001111480283	1368317315	/nfs/dbraw/zinc/31/73/15/1368317315.db2.gz	NKJAFAPUOWXUTM-XDNAFOTISA-N	0	3	334.504	3.127	20	30		EGEDHN
CCC(CC)C(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(C#N)cc1)C2	ZINC001111606286	1368367496	/nfs/dbraw/zinc/36/74/96/1368367496.db2.gz	XZYMFRZPYZSXKZ-FPOVZHCZSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CCCN([C@H]2CCc3ccccc32)CC1	ZINC001195174600	1368393492	/nfs/dbraw/zinc/39/34/92/1368393492.db2.gz	QIVRLJRZZZBABT-PXNSSMCTSA-N	0	3	342.483	3.189	20	30		EGEDHN
C#CCCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1cnccc1C)C2	ZINC001111711458	1368428685	/nfs/dbraw/zinc/42/86/85/1368428685.db2.gz	UPIQFWOODUXNBO-FPOVZHCZSA-N	0	3	339.483	3.054	20	30		EGEDHN
CC[C@@H](C)CC(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(C#N)cc1)C2	ZINC001111728133	1368430588	/nfs/dbraw/zinc/43/05/88/1368430588.db2.gz	WDDNOUCLDVHLQC-PBEJRMEISA-N	0	3	339.483	3.465	20	30		EGEDHN
Cc1cc(F)ccc1CN1C[C@@H]2CCC[C@]2(NC(=O)C#CC(C)C)C1	ZINC001111736404	1368435496	/nfs/dbraw/zinc/43/54/96/1368435496.db2.gz	GHINRICYDCXOSH-RXVVDRJESA-N	0	3	342.458	3.264	20	30		EGEDHN
Cc1cc(CN2C[C@@H]3CCC[C@]3(NC(=O)C#CC(C)C)C2)cs1	ZINC001111739024	1368437089	/nfs/dbraw/zinc/43/70/89/1368437089.db2.gz	WBPROSFNWMPMBF-HKUYNNGSSA-N	0	3	330.497	3.187	20	30		EGEDHN
N#Cc1cc(C(=O)N2CCCN(CC/C=C/c3ccccc3)CC2)c[nH]1	ZINC001195535978	1368450955	/nfs/dbraw/zinc/45/09/55/1368450955.db2.gz	RGPOZLUYTDHWIS-RUDMXATFSA-N	0	3	348.450	3.138	20	30		EGEDHN
Cc1cccc(C)c1CN1CCCN(C(=O)C#CC(C)(C)C)CC1	ZINC001195785637	1368489416	/nfs/dbraw/zinc/48/94/16/1368489416.db2.gz	SPVGSYQMTQRPFQ-UHFFFAOYSA-N	0	3	326.484	3.387	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)CCCc2ccccc2)C1	ZINC001195829637	1368499280	/nfs/dbraw/zinc/49/92/80/1368499280.db2.gz	RVRFFEHJXIWXPR-WOJBJXKFSA-N	0	3	346.515	3.141	20	30		EGEDHN
CC#CCCCC(=O)N[C@]12CCC[C@H]1CN(CCC(F)(F)F)C2	ZINC001111846203	1368499990	/nfs/dbraw/zinc/49/99/90/1368499990.db2.gz	VNNQNXITCVBBBK-HOCLYGCPSA-N	0	3	330.394	3.103	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N1CCCN(CC/C=C\CCC)CC1	ZINC001195885771	1368510900	/nfs/dbraw/zinc/51/09/00/1368510900.db2.gz	CMQYAMTTYSFWNB-MGBKSAOESA-N	0	3	334.504	3.248	20	30		EGEDHN
C#CCN1C[C@@H]2CCC[C@]2(NC(=O)CC(C2CCC2)C2CCC2)C1	ZINC001111873360	1368520023	/nfs/dbraw/zinc/52/00/23/1368520023.db2.gz	WWXOQQLGVJSFTD-RXVVDRJESA-N	0	3	328.500	3.197	20	30		EGEDHN
C#CCN1C[C@@H]2CCC[C@]2(NC(=O)C[C@H](c2ccccc2)C(C)C)C1	ZINC001111935812	1368566624	/nfs/dbraw/zinc/56/66/24/1368566624.db2.gz	VHMGLQNIOLFPBY-ONTIZHBOSA-N	0	3	338.495	3.420	20	30		EGEDHN
C=CCC[C@H](C)N1CCCN(C(=O)c2cc(C(F)(F)F)no2)CC1	ZINC001196223585	1368571278	/nfs/dbraw/zinc/57/12/78/1368571278.db2.gz	YQDSORFNBLIQFV-LBPRGKRZSA-N	0	3	345.365	3.196	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H](C)Cc2ccc(OC)cc2)C1	ZINC001111999583	1368603654	/nfs/dbraw/zinc/60/36/54/1368603654.db2.gz	PSJGTHVHRYCANP-MMOPVJDHSA-N	0	3	342.483	3.031	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2c[nH]nc2C(C)C)CC1	ZINC001196394215	1368606678	/nfs/dbraw/zinc/60/66/78/1368606678.db2.gz	DPEHPCYRHCMYLP-UHFFFAOYSA-N	0	3	332.492	3.427	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@@H](C)c2cccc(C)c2)C1	ZINC001196447025	1368616434	/nfs/dbraw/zinc/61/64/34/1368616434.db2.gz	ZHFVATNELDCZLS-DFQSSKMNSA-N	0	3	346.515	3.230	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2ncc3ccccn32)CC1	ZINC001196501189	1368629005	/nfs/dbraw/zinc/62/90/05/1368629005.db2.gz	XQGLIYSFAANGKA-UHFFFAOYSA-N	0	3	342.487	3.453	20	30		EGEDHN
C=C(C)CCN1C[C@@H](O)[C@H](NC(=O)[C@H](CCC)CC2CCCC2)C1	ZINC001196616223	1368650390	/nfs/dbraw/zinc/65/03/90/1368650390.db2.gz	IGIQKDWGDGJIAT-GUDVDZBRSA-N	0	3	336.520	3.111	20	30		EGEDHN
C=CCCN1CCCN(C(=O)[C@H](C)OCc2ccccc2C)CC1	ZINC001196689781	1368663735	/nfs/dbraw/zinc/66/37/35/1368663735.db2.gz	NHSZIQDWXQKBPX-SFHVURJKSA-N	0	3	330.472	3.011	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)[C@H](C)CC2CCCC2)C[C@H]1C(F)(F)F	ZINC001112173698	1368700538	/nfs/dbraw/zinc/70/05/38/1368700538.db2.gz	KYXDETREJXZMOR-FVQBIDKESA-N	0	3	344.421	3.205	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2noc3c2CCCC3)CC1	ZINC001197244954	1368770398	/nfs/dbraw/zinc/77/03/98/1368770398.db2.gz	IWHMEMOPHHQFRQ-UHFFFAOYSA-N	0	3	345.487	3.448	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2ccnc(C3CC3)n2)CC1	ZINC001197309233	1368785211	/nfs/dbraw/zinc/78/52/11/1368785211.db2.gz	XDXJKOGETFYJPV-UHFFFAOYSA-N	0	3	342.487	3.248	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cnn(CC)c2C)CC1	ZINC001197536343	1368835269	/nfs/dbraw/zinc/83/52/69/1368835269.db2.gz	BALLWBJDMQVIPK-UHFFFAOYSA-N	0	3	332.492	3.106	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)C[C@@H](CC)C(C)C)C1	ZINC001197942232	1368928746	/nfs/dbraw/zinc/92/87/46/1368928746.db2.gz	XKJNBKMFCAXWIS-KZNAEPCWSA-N	0	3	326.525	3.190	20	30		EGEDHN
C=CC[C@H](C(=O)N1CCCN(CCC[C@@H](C)O)CC1)c1ccccc1	ZINC001198196292	1368977834	/nfs/dbraw/zinc/97/78/34/1368977834.db2.gz	AJFMQRFJDXAYBX-QUCCMNQESA-N	0	3	344.499	3.042	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N1CCCN(CCCc2cccc(C)c2)CC1	ZINC001198343709	1369013475	/nfs/dbraw/zinc/01/34/75/1369013475.db2.gz	MSCXHSWZBZDTRR-IBGZPJMESA-N	0	3	344.499	3.053	20	30		EGEDHN
C=CCC[C@H](C)N[C@H](CNC(=O)C(C)(F)F)c1ccccc1OC	ZINC001198482536	1369042257	/nfs/dbraw/zinc/04/22/57/1369042257.db2.gz	PXVSPASPSOMCOW-DZGCQCFKSA-N	0	3	340.414	3.452	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)c1cccs1)c1ccccc1OC	ZINC001198505962	1369048343	/nfs/dbraw/zinc/04/83/43/1369048343.db2.gz	CCFAOKRYZXYUPG-HNNXBMFYSA-N	0	3	330.453	3.394	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)c1ccc[nH]1)c1ccccc1OC	ZINC001198522765	1369052204	/nfs/dbraw/zinc/05/22/04/1369052204.db2.gz	PVRJOYBHSBIXIB-QGZVFWFLSA-N	0	3	327.428	3.050	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)CCCOCC)c1ccccc1OC	ZINC001198567238	1369062250	/nfs/dbraw/zinc/06/22/50/1369062250.db2.gz	NVXKQFKEJNDMBQ-SFHVURJKSA-N	0	3	348.487	3.225	20	30		EGEDHN
C=CCC[C@H](C)N[C@@H](CNC(=O)c1ccon1)c1ccccc1OC	ZINC001198577026	1369064516	/nfs/dbraw/zinc/06/45/16/1369064516.db2.gz	HCUPFEMWSPWGLO-YOEHRIQHSA-N	0	3	343.427	3.099	20	30		EGEDHN
C=CCOCC(=O)NC[C@H](NCC/C=C\CC)c1ccccc1OC	ZINC001198605880	1369071678	/nfs/dbraw/zinc/07/16/78/1369071678.db2.gz	LCHXRDZAXFTPMM-MJRGOJFPSA-N	0	3	346.471	3.001	20	30		EGEDHN
CCCCCCN[C@@H](CNC(=O)[C@@H](C)C#N)c1ccccc1OC	ZINC001198616279	1369073384	/nfs/dbraw/zinc/07/33/84/1369073384.db2.gz	GXKMUVWPRZNFKO-RDJZCZTQSA-N	0	3	331.460	3.182	20	30		EGEDHN
COc1ccccc1[C@@H](CNC(=O)[C@@H](C)C#N)NCCCC1CCC1	ZINC001198617799	1369074483	/nfs/dbraw/zinc/07/44/83/1369074483.db2.gz	SPWYBCYBJXZURA-MAUKXSAKSA-N	0	3	343.471	3.182	20	30		EGEDHN
COc1ccccc1[C@H](CNC(=O)[C@@H](C)C#N)NCCC1CCCC1	ZINC001198618102	1369075014	/nfs/dbraw/zinc/07/50/14/1369075014.db2.gz	WPLLHRJHWKJVDY-YJBOKZPZSA-N	0	3	343.471	3.182	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)c1cncc(C)c1)c1ccccc1OC	ZINC001198634890	1369078564	/nfs/dbraw/zinc/07/85/64/1369078564.db2.gz	ANPFQXVAOMYSSN-GOSISDBHSA-N	0	3	339.439	3.035	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@H]1[C@@H]2CCC[C@@H]21)c1ccccc1OC	ZINC001198648206	1369081823	/nfs/dbraw/zinc/08/18/23/1369081823.db2.gz	TYUAXSPXLHJOLN-JHDROBOHSA-N	0	3	328.456	3.064	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)CCOc2cccc(F)c2)CC1	ZINC001112926670	1369092658	/nfs/dbraw/zinc/09/26/58/1369092658.db2.gz	KOYCUHAEYNASHT-MRXNPFEDSA-N	0	3	334.435	3.094	20	30		EGEDHN
CCCCN[C@@H](CNC(=O)C#CC(C)(C)C)c1ccccc1OC	ZINC001198724501	1369100406	/nfs/dbraw/zinc/10/04/06/1369100406.db2.gz	WPMAXOHULYNHOG-KRWDZBQOSA-N	0	3	330.472	3.292	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)c2cn(C)c3ccc(F)cc23)CC1	ZINC001112972108	1369117677	/nfs/dbraw/zinc/11/76/77/1369117677.db2.gz	FHDYCRAFVQYEBX-HNNXBMFYSA-N	0	3	343.446	3.430	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NC[C@@H](NC(C)C)c1ccccc1OC	ZINC001198820187	1369121550	/nfs/dbraw/zinc/12/15/50/1369121550.db2.gz	YWRCXKREVWGONT-XLIONFOSSA-N	0	3	348.487	3.079	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@H](NCC1CC1)c1ccccc1OC	ZINC001198835143	1369125629	/nfs/dbraw/zinc/12/56/29/1369125629.db2.gz	RVJKTKQMQJOMTD-IBGZPJMESA-N	0	3	342.483	3.436	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@H](NCCCF)c1ccccc1OC	ZINC001198857506	1369131534	/nfs/dbraw/zinc/13/15/34/1369131534.db2.gz	QMICKAYOXIMFPM-WBVHZDCISA-N	0	3	336.451	3.404	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@@H](CCC)OCC)c1ccccc1OC	ZINC001198857510	1369131618	/nfs/dbraw/zinc/13/16/18/1369131618.db2.gz	QMWOMIOIJBPWED-IEBWSBKVSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCCC(=O)NC[C@H](NCCCCOC)c1ccccc1OC	ZINC001198876339	1369136898	/nfs/dbraw/zinc/13/68/98/1369136898.db2.gz	RCUDFMSRGVAQKD-SFHVURJKSA-N	0	3	348.487	3.225	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)CC(C)(F)F)c1ccccc1OC	ZINC001198885665	1369140157	/nfs/dbraw/zinc/14/01/57/1369140157.db2.gz	NZQTVVYFMSCUBM-HNNXBMFYSA-N	0	3	340.414	3.454	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)c2n[nH]c(C3CC3)c2Cl)CC1	ZINC001113069138	1369178853	/nfs/dbraw/zinc/17/88/53/1369178853.db2.gz	QCACOLDBPRSGPO-LBPRGKRZSA-N	0	3	336.867	3.053	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)C2CCC(C)(C)CC2)C1	ZINC001199217567	1369192735	/nfs/dbraw/zinc/19/27/35/1369192735.db2.gz	UCHOQIVKSNQUAX-QZTJIDSGSA-N	0	3	338.536	3.335	20	30		EGEDHN
CCC[C@H](CC)C(=O)N1CC[C@@H](NCc2ccc(OC)c(C#N)c2)C1	ZINC001186631929	1387990536	/nfs/dbraw/zinc/99/05/36/1387990536.db2.gz	ZPOAJURYYTVUAY-FUHWJXTLSA-N	0	3	343.471	3.084	20	30		EGEDHN
CCC[C@@H](CC)C(=O)N1CC[C@@H](NCc2ccc(OC)c(C#N)c2)C1	ZINC001186631930	1387990728	/nfs/dbraw/zinc/99/07/28/1387990728.db2.gz	ZPOAJURYYTVUAY-SJLPKXTDSA-N	0	3	343.471	3.084	20	30		EGEDHN
CCCCCCCCCCNC(=S)NC1(CO)CCN(C)CC1	ZINC001200219203	1369330444	/nfs/dbraw/zinc/33/04/44/1369330444.db2.gz	XLFNTIWZCROYIU-UHFFFAOYSA-N	0	3	343.581	3.048	20	30		EGEDHN
C#CCCCC(=O)N1CCC(NCc2ccn(C(CC)CC)n2)CC1	ZINC001200325116	1369348964	/nfs/dbraw/zinc/34/89/64/1369348964.db2.gz	OLEGSLPPXFODMS-UHFFFAOYSA-N	0	3	344.503	3.128	20	30		EGEDHN
O=C1C=C2CN(C(=S)Nc3ccc(F)c(Cl)c3)CCC2S1	ZINC001200584156	1369395450	/nfs/dbraw/zinc/39/54/50/1369395450.db2.gz	XDGHBHDMIKMIFX-LBPRGKRZSA-N	0	3	342.848	3.450	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)c2c[nH]c(=O)c3ccccc23)CC1	ZINC001113404006	1369401774	/nfs/dbraw/zinc/40/17/74/1369401774.db2.gz	XAHMARXITMHAFO-OAHLLOKOSA-N	0	3	339.439	3.053	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)c2ccc(C(C)C)[nH]c2=O)CC1	ZINC001113406123	1369403912	/nfs/dbraw/zinc/40/39/12/1369403912.db2.gz	WAGDKOATQVNRLB-OAHLLOKOSA-N	0	3	331.460	3.023	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N1CCN(C[C@H](C)CC(C)C)CC1	ZINC001113417777	1369412709	/nfs/dbraw/zinc/41/27/09/1369412709.db2.gz	USLYNDBBOOLTFG-QYZOEREBSA-N	0	3	336.520	3.184	20	30		EGEDHN
N#Cc1ccc(Br)c(CNCC2(CO)CCCCC2)c1	ZINC001200923879	1369450444	/nfs/dbraw/zinc/45/04/44/1369450444.db2.gz	UQSHSTSRHOWPNQ-UHFFFAOYSA-N	0	3	337.261	3.353	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)C[C@H]2OCCc3ccccc32)CC1	ZINC001113559422	1369493127	/nfs/dbraw/zinc/49/31/27/1369493127.db2.gz	SRIJJZDBWZKEKO-FXAWDEMLSA-N	0	3	342.483	3.189	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)CCOCc2ccccc2)CC1	ZINC001113648321	1369542686	/nfs/dbraw/zinc/54/26/86/1369542686.db2.gz	DOJOLFYVOQXIBQ-GOSISDBHSA-N	0	3	330.472	3.092	20	30		EGEDHN
CCCCCCCCN1CCCn2nnc(Cn3ccnc3)c2C1	ZINC001201813237	1369628160	/nfs/dbraw/zinc/62/81/60/1369628160.db2.gz	COYLVSZMTFRSRB-UHFFFAOYSA-N	0	3	330.480	3.089	20	30		EGEDHN
CC#CCNC[C@H]1CN(C(=O)CC(C)(C)C2CCCCC2)CCCO1	ZINC001201863614	1369635909	/nfs/dbraw/zinc/63/59/09/1369635909.db2.gz	OITCLIRRIBITSR-IBGZPJMESA-N	0	3	348.531	3.213	20	30		EGEDHN
CC#CCCCC(=O)N1CCC(NCc2nc3ccccc3o2)CC1	ZINC001202075190	1369681737	/nfs/dbraw/zinc/68/17/37/1369681737.db2.gz	BKAOEKPBVJQPRK-UHFFFAOYSA-N	0	3	339.439	3.102	20	30		EGEDHN
O=C(N[C@H]1C[C@@H](NCC#Cc2ccc(Cl)cc2)C12CCC2)C1CC1	ZINC001202282056	1369728747	/nfs/dbraw/zinc/72/87/47/1369728747.db2.gz	XDZOBZWKVKIXOH-MSOLQXFVSA-N	0	3	342.870	3.119	20	30		EGEDHN
Cc1occc1C(=O)N[C@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202383972	1369756527	/nfs/dbraw/zinc/75/65/27/1369756527.db2.gz	ONDYTGBNUUKWDV-UXHICEINSA-N	0	3	348.446	3.270	20	30		EGEDHN
CC(C)=CC(=O)N[C@@H]1C[C@@H](NCc2cc(C#N)ccc2F)C12CCC2	ZINC001202384016	1369756575	/nfs/dbraw/zinc/75/65/75/1369756575.db2.gz	PPQOTWNNVTZZFV-QZTJIDSGSA-N	0	3	341.430	3.181	20	30		EGEDHN
CC[C@H](CC(C)C)C(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001186895094	1388024364	/nfs/dbraw/zinc/02/43/64/1388024364.db2.gz	JTYWEBUIXFYREG-SJLPKXTDSA-N	0	3	345.462	3.460	20	30		EGEDHN
CCCCC(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C12CCC2	ZINC001202489400	1369788501	/nfs/dbraw/zinc/78/85/01/1369788501.db2.gz	KYKXZRDVCYBLAJ-MSOLQXFVSA-N	0	3	343.446	3.405	20	30		EGEDHN
Cc1cc(C(=O)N[C@H]2C[C@@H](NCC#Cc3ccccc3)C23CCC3)co1	ZINC001202785866	1369892094	/nfs/dbraw/zinc/89/20/94/1369892094.db2.gz	RNIUCVYVHNQPHT-UXHICEINSA-N	0	3	348.446	3.270	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1[C@H]2CN(CCOC3CCCCCC3)C[C@H]21	ZINC001114341627	1369901615	/nfs/dbraw/zinc/90/16/15/1369901615.db2.gz	ZQVXVLSFVVOTLH-RUYXUALKSA-N	0	3	348.531	3.375	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202988348	1369947004	/nfs/dbraw/zinc/94/70/04/1369947004.db2.gz	SABRDDMJLUKARK-VQTJNVASSA-N	0	3	336.479	3.411	20	30		EGEDHN
CC(C)C[C@H](C)CC(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001187004716	1388038824	/nfs/dbraw/zinc/03/88/24/1388038824.db2.gz	UZEKLDYJXWYDNL-MAUKXSAKSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C(Br)CNC1CCN(C(=O)[C@H](C)[C@H](C)CC)CC1	ZINC001203092035	1369980030	/nfs/dbraw/zinc/98/00/30/1369980030.db2.gz	IMQCGQPDTBXEIC-DGCLKSJQSA-N	0	3	331.298	3.158	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1C[C@H](NCc2c(C)noc2C)C12CCC2	ZINC001203256293	1370044204	/nfs/dbraw/zinc/04/42/04/1370044204.db2.gz	HIICSALXSBGROO-DLBZAZTESA-N	0	3	345.487	3.411	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C)c(OC)c3)C[C@H]21	ZINC001114724288	1370047127	/nfs/dbraw/zinc/04/71/27/1370047127.db2.gz	JWQMMVCBGUMORH-LBKNJMOBSA-N	0	3	342.483	3.152	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1[C@H]2CN(CCOc3ccccc3C)C[C@H]21	ZINC001114728183	1370049869	/nfs/dbraw/zinc/04/98/69/1370049869.db2.gz	CIVBVNXPAOXACF-LXGFNABISA-N	0	3	342.483	3.023	20	30		EGEDHN
Cc1coc(C(=O)N[C@@H]2C[C@H](NCC#Cc3ccccc3)C23CCC3)c1	ZINC001203282247	1370061441	/nfs/dbraw/zinc/06/14/41/1370061441.db2.gz	WMIXVNZDDPHRTN-VQTJNVASSA-N	0	3	348.446	3.270	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1C[C@H](NCc2conc2CC)C12CCC2	ZINC001203341622	1370090053	/nfs/dbraw/zinc/09/00/53/1370090053.db2.gz	RZQAIMAZXYJESG-DLBZAZTESA-N	0	3	331.460	3.110	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@@H](NCc3ccccn3)C23CCC3)CCC1	ZINC001203364747	1370099032	/nfs/dbraw/zinc/09/90/32/1370099032.db2.gz	BHHFCDUTLTWMMB-MSOLQXFVSA-N	0	3	339.483	3.345	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H](NCc3cnoc3C)C23CCC3)CCC1	ZINC001203365603	1370099838	/nfs/dbraw/zinc/09/98/38/1370099838.db2.gz	HZANPOMBKJPEIB-IRXDYDNUSA-N	0	3	343.471	3.246	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1C[C@H](NCc2oc(C)nc2C)C12CCC2	ZINC001203451602	1370131583	/nfs/dbraw/zinc/13/15/83/1370131583.db2.gz	KCTGMZLLGGGYCI-IRXDYDNUSA-N	0	3	345.487	3.411	20	30		EGEDHN
CC(C)(C)C(=O)N[C@H]1C[C@H](NCC#Cc2ccc(F)cc2)C12CCC2	ZINC001203629666	1370193359	/nfs/dbraw/zinc/19/33/59/1370193359.db2.gz	BKXMZSGSFKYWQW-ROUUACIJSA-N	0	3	342.458	3.240	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)CCCc2ccccn2)C12CCC2	ZINC001203640234	1370196699	/nfs/dbraw/zinc/19/66/99/1370196699.db2.gz	ALENZHYAXIMEHL-IAGOWNOFSA-N	0	3	347.890	3.174	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)C(C)(C)C(F)(F)F)C12CCC2	ZINC001203642181	1370198624	/nfs/dbraw/zinc/19/86/24/1370198624.db2.gz	XAEUQKWTCBSUDW-GHMZBOCLSA-N	0	3	338.801	3.344	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)COc2cccc(C)c2)C12CCC2	ZINC001203737553	1370241591	/nfs/dbraw/zinc/24/15/91/1370241591.db2.gz	HYIPUKKITGZDNX-IRXDYDNUSA-N	0	3	348.874	3.143	20	30		EGEDHN
CN1C(=O)C2(CCN(Cc3cccc(C#N)c3)CC2)[C@H]1c1ccccc1	ZINC001203760395	1370252904	/nfs/dbraw/zinc/25/29/04/1370252904.db2.gz	IVMGBCTVLNTFJE-HXUWFJFHSA-N	0	3	345.446	3.354	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H]2CN(CCOc3cc(C)ccc3C)C[C@H]21	ZINC001187210779	1388072899	/nfs/dbraw/zinc/07/28/99/1388072899.db2.gz	ZBQVZYAMHYYLSJ-RBUKOAKNSA-N	0	3	342.483	3.181	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@@H]2[C@H](CCN2Cc2nccs2)C1	ZINC001204370738	1370456589	/nfs/dbraw/zinc/45/65/89/1370456589.db2.gz	JXJHFMVDYADNSS-QZTJIDSGSA-N	0	3	338.480	3.111	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)/C=C\C2CC2)CCCCC1	ZINC001115464966	1370470164	/nfs/dbraw/zinc/47/01/64/1370470164.db2.gz	QVGQOBQYVWVYQQ-FPLPWBNLSA-N	0	3	341.293	3.270	20	30		EGEDHN
C[C@H](C(=O)NCC1(NCC#Cc2ccccc2)CCCCC1)C1CC1	ZINC001115466606	1370472090	/nfs/dbraw/zinc/47/20/90/1370472090.db2.gz	TVRMPGIJCOJJMR-SFHVURJKSA-N	0	3	338.495	3.493	20	30		EGEDHN
CN1CCN(Cc2cccc(Nc3ccc(F)c(C#N)c3F)c2)CC1	ZINC001204564250	1370517825	/nfs/dbraw/zinc/51/78/25/1370517825.db2.gz	KWOOQDYFKOOFEM-UHFFFAOYSA-N	0	3	342.393	3.327	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H](OCC)C(C)C)CCCCC1	ZINC001115533959	1370531405	/nfs/dbraw/zinc/53/14/05/1370531405.db2.gz	ZQCXWCCWQDMZHC-OAHLLOKOSA-N	0	3	330.900	3.209	20	30		EGEDHN
CCCSCC(=O)N1CCC(CNCc2ccccc2C#N)CC1	ZINC001204649762	1370537116	/nfs/dbraw/zinc/53/71/16/1370537116.db2.gz	PXPBLOOWIBTRLM-UHFFFAOYSA-N	0	3	345.512	3.030	20	30		EGEDHN
CC1(C(=O)NCC2(NCC#Cc3ccc(F)cc3)CCCCC2)CC1	ZINC001115548833	1370545455	/nfs/dbraw/zinc/54/54/55/1370545455.db2.gz	VOMCWQMEPRHVJJ-UHFFFAOYSA-N	0	3	342.458	3.386	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H]2CN(Cc3cccc(OCCC)c3)C[C@H]21	ZINC001187239872	1388079261	/nfs/dbraw/zinc/07/92/61/1388079261.db2.gz	ITFMBCJRDRQRAX-AZUAARDMSA-N	0	3	342.483	3.474	20	30		EGEDHN
COc1ccc(Nc2ccc(CN3CCN(C)CC3)cc2)c(C#N)c1	ZINC001204747438	1370564253	/nfs/dbraw/zinc/56/42/53/1370564253.db2.gz	WHILHUMPHBFLAQ-UHFFFAOYSA-N	0	3	336.439	3.058	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cc(Cl)cn2C)CCCCC1	ZINC001115621713	1370617377	/nfs/dbraw/zinc/61/73/77/1370617377.db2.gz	XFECDCUHZVGBMA-UHFFFAOYSA-N	0	3	344.286	3.453	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N(Cc1ccccc1)[C@@H]1CN(CCC)C[C@H]1O	ZINC001205164173	1370667035	/nfs/dbraw/zinc/66/70/35/1370667035.db2.gz	VXOSJLIDLCUWTB-RTBURBONSA-N	0	3	344.499	3.073	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCC1(NCc2cc(C)ncn2)CCCCC1	ZINC001115684897	1370667447	/nfs/dbraw/zinc/66/74/47/1370667447.db2.gz	MHHIUQYAYGEDSZ-INIZCTEOSA-N	0	3	344.503	3.296	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccc(Cl)[nH]2)CCCCC1	ZINC001115718744	1370697627	/nfs/dbraw/zinc/69/76/27/1370697627.db2.gz	VOWNSTVCVVCGSF-UHFFFAOYSA-N	0	3	330.259	3.443	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H](C)CCC)CC[C@H]1c1ccc(F)cc1	ZINC001205263087	1370699559	/nfs/dbraw/zinc/69/95/59/1370699559.db2.gz	KAQQQRWATKSXGF-AYOQOUSVSA-N	0	3	330.447	3.169	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](c2ccc(F)cc2)[C@H](NCCF)C1	ZINC001205306885	1370715973	/nfs/dbraw/zinc/71/59/73/1370715973.db2.gz	COTXFJHHSWZYLC-ZWKOTPCHSA-N	0	3	336.426	3.426	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](c2ccc(F)cc2)[C@H](NCCF)C1	ZINC001205307142	1370716126	/nfs/dbraw/zinc/71/61/26/1370716126.db2.gz	QVZKXALYFOKUOZ-RBUKOAKNSA-N	0	3	348.437	3.263	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H](C)CC(C)C)CC[C@H]1c1ccc(F)cc1	ZINC001205318881	1370720911	/nfs/dbraw/zinc/72/09/11/1370720911.db2.gz	SRPMJAASYQWNHY-FFZOFVMBSA-N	0	3	344.474	3.415	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)CCCCC)C[C@H]1c1cccc(F)c1	ZINC001205367721	1370733333	/nfs/dbraw/zinc/73/33/33/1370733333.db2.gz	RCYWAHWTEGXKSK-RBUKOAKNSA-N	0	3	330.447	3.313	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C(CC=C)CC=C)C[C@H]1c1cccc(F)c1	ZINC001205412387	1370747825	/nfs/dbraw/zinc/74/78/25/1370747825.db2.gz	LOOJJSLUIHTFRL-VQTJNVASSA-N	0	3	340.442	3.111	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H](CC)CC(C)C)C[C@H]1c1cccc(F)c1	ZINC001205448511	1370759365	/nfs/dbraw/zinc/75/93/65/1370759365.db2.gz	GZEUBMMARLGWQH-LSTHTHJFSA-N	0	3	344.474	3.415	20	30		EGEDHN
C[C@H](NCc1cccc(OCC#N)c1)c1ccc2c(c1)CCC(=O)N2	ZINC001116467032	1370918649	/nfs/dbraw/zinc/91/86/49/1370918649.db2.gz	QFZRHGCISOFZGC-AWEZNQCLSA-N	0	3	335.407	3.324	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)N1CCC(CNCc2ccccc2C#N)CC1	ZINC001205956064	1370922920	/nfs/dbraw/zinc/92/29/20/1370922920.db2.gz	ZKJIXBVGWDWLBP-IRXDYDNUSA-N	0	3	339.483	3.345	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)N1CCC(CNCc2csc(CC)n2)CC1	ZINC001205961084	1370923680	/nfs/dbraw/zinc/92/36/80/1370923680.db2.gz	LMNGLKKPZGOIGD-CABCVRRESA-N	0	3	349.544	3.492	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC(CNCc2ccn(C(C)C)n2)CC1	ZINC001205975900	1370927598	/nfs/dbraw/zinc/92/75/98/1370927598.db2.gz	QLDMVRXDVGNFQC-QGZVFWFLSA-N	0	3	346.519	3.395	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC(CN[C@H](C)c2cnc(C)cn2)CC1	ZINC001205988688	1370930650	/nfs/dbraw/zinc/93/06/50/1370930650.db2.gz	JWVJGUAKSBYUHL-SJORKVTESA-N	0	3	344.503	3.277	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC(CNCc2csc(C)n2)CC1	ZINC001205988601	1370930839	/nfs/dbraw/zinc/93/08/39/1370930839.db2.gz	IJMZFCYIMGLRHP-AWEZNQCLSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C(CN1CCCC1)c1nc(-c2cccc(-c3ccccn3)n2)no1	ZINC001206100846	1370960236	/nfs/dbraw/zinc/96/02/36/1370960236.db2.gz	WHMXKRZKZUNWOL-UHFFFAOYSA-N	0	3	333.395	3.303	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC(CNCc2ncc(C)s2)CC1	ZINC001206427951	1371051450	/nfs/dbraw/zinc/05/14/50/1371051450.db2.gz	QJFDDXNAHILMLT-UHFFFAOYSA-N	0	3	335.517	3.382	20	30		EGEDHN
C#CCN(CC1CC1)C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C	ZINC001117863935	1371104657	/nfs/dbraw/zinc/10/46/57/1371104657.db2.gz	DQHDZKSVCAOSMH-SFHVURJKSA-N	0	3	345.512	3.066	20	30		EGEDHN
C=CCOCC(=O)N[C@@H]1CN(Cc2cc3ccccc3s2)C[C@H]1C	ZINC001206614136	1371109340	/nfs/dbraw/zinc/10/93/40/1371109340.db2.gz	OPNXTHWWDHWZNZ-RHSMWYFYSA-N	0	3	344.480	3.040	20	30		EGEDHN
Cc1cc([C@H](C)NC[C@H](O)COc2ccc(CC#N)cc2)c(C)o1	ZINC001326148451	1388119375	/nfs/dbraw/zinc/11/93/75/1388119375.db2.gz	ZSQMKPZKPVLLAM-YOEHRIQHSA-N	0	3	328.412	3.053	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CN([C@H]2CCc3ccc(F)cc32)C[C@H]1C	ZINC001206911631	1371220797	/nfs/dbraw/zinc/22/07/97/1371220797.db2.gz	WONGBCUAZGGTBF-ZMYBRWDISA-N	0	3	328.431	3.053	20	30		EGEDHN
O=C(C1CCC1)N1CCC[C@@H](NCC#Cc2ccccc2Cl)C1	ZINC001207011893	1371266804	/nfs/dbraw/zinc/26/68/04/1371266804.db2.gz	CIOABCQEVHBOKY-QGZVFWFLSA-N	0	3	330.859	3.072	20	30		EGEDHN
CN(Cc1cc(C#N)n(C)c1)[C@H]1CCCC[C@@H]1NC(=O)OC(C)(C)C	ZINC001207110191	1371297187	/nfs/dbraw/zinc/29/71/87/1371297187.db2.gz	GHHSSAGWSYBLPY-IRXDYDNUSA-N	0	3	346.475	3.164	20	30		EGEDHN
O=C(C[C@@H]1C=CCC1)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207232057	1371336338	/nfs/dbraw/zinc/33/63/38/1371336338.db2.gz	IAHCQOKQGXPFIR-UYAOXDASSA-N	0	3	340.442	3.114	20	30		EGEDHN
CCCCCC(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207344066	1371365771	/nfs/dbraw/zinc/36/57/71/1371365771.db2.gz	ROPLWXWGACTLSH-IBGZPJMESA-N	0	3	330.447	3.338	20	30		EGEDHN
CC/C=C(/C)C(=O)N1CCC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001207567373	1371438411	/nfs/dbraw/zinc/43/84/11/1371438411.db2.gz	ZHIVFNYCFQVGEC-UOJXKXAVSA-N	0	3	329.419	3.134	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CCC[C@H](NCc2cc(C)ccc2F)C1	ZINC001207622663	1371454878	/nfs/dbraw/zinc/45/48/78/1371454878.db2.gz	IGEFZAXGUGXCBG-WMZOPIPTSA-N	0	3	348.462	3.196	20	30		EGEDHN
O=C(CC1CCC1)N1CCC[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207737180	1371489377	/nfs/dbraw/zinc/48/93/77/1371489377.db2.gz	BAXGEJPTVFYBRP-IBGZPJMESA-N	0	3	344.886	3.462	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N1CCC[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207818954	1371512760	/nfs/dbraw/zinc/51/27/60/1371512760.db2.gz	CTHGZBOUUGNBJP-ROUUACIJSA-N	0	3	344.886	3.318	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)CCOC(C)C)C1	ZINC001120317890	1371530833	/nfs/dbraw/zinc/53/08/33/1371530833.db2.gz	CPGNRKIAPPXNBI-SJORKVTESA-N	0	3	342.911	3.257	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H](NCc2cccc(C(C)C)n2)C1	ZINC001207943813	1371544832	/nfs/dbraw/zinc/54/48/32/1371544832.db2.gz	FUDZMVJYDNDTEW-GOSISDBHSA-N	0	3	327.472	3.089	20	30		EGEDHN
C=CCOCc1nn(CC2CC2)c2c1CN(CC[C@@H](C)SC)CC2	ZINC001208141812	1371608122	/nfs/dbraw/zinc/60/81/22/1371608122.db2.gz	LFXQBWFEBNGHDB-OAHLLOKOSA-N	0	3	349.544	3.495	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CCC[C@@H](NCC=C(Cl)Cl)C1)OCC	ZINC001208264014	1371690686	/nfs/dbraw/zinc/69/06/86/1371690686.db2.gz	HNZAPIQVDMCJBO-KGLIPLIRSA-N	0	3	349.302	3.257	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CN(C[C@@H](OC)c2ccccc2)C[C@H]1C	ZINC001208295006	1371704467	/nfs/dbraw/zinc/70/44/67/1371704467.db2.gz	WUVQCRMPSPFOFZ-BHIYHBOVSA-N	0	3	344.499	3.413	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CN(CC[C@@H]2CC2(Cl)Cl)C[C@H]1C	ZINC001208374159	1371740975	/nfs/dbraw/zinc/74/09/75/1371740975.db2.gz	AVCWTMYFARSWJP-RBSFLKMASA-N	0	3	345.314	3.200	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2CCC[C@H](NC[C@@H](F)CC)C2)cc1	ZINC001208433225	1371765152	/nfs/dbraw/zinc/76/51/52/1371765152.db2.gz	VNZHCTYXCYXDME-IRXDYDNUSA-N	0	3	334.435	3.194	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1CN(CCc2scnc2C)C[C@H]1C	ZINC001208512181	1371794918	/nfs/dbraw/zinc/79/49/18/1371794918.db2.gz	YRGAHIFUMOHVSS-DDUZABMNSA-N	0	3	335.517	3.033	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)CC/C=C\c2ccccc2)C1	ZINC001208583716	1371827612	/nfs/dbraw/zinc/82/76/12/1371827612.db2.gz	BVSDVEHRUOPBRJ-GDSCYZHGSA-N	0	3	342.483	3.119	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC1CC2(CC(NCc3oc(C)nc3C)C2)C1	ZINC001121174855	1371878321	/nfs/dbraw/zinc/87/83/21/1371878321.db2.gz	BMJPMQITIUTTEO-UHFFFAOYSA-N	0	3	345.487	3.411	20	30		EGEDHN
C=C(C)CCC(=O)NC1CC2(CC(NCC(=C)Br)C2)C1	ZINC001121179932	1371880811	/nfs/dbraw/zinc/88/08/11/1371880811.db2.gz	HHBLJMGOPUNBRH-UHFFFAOYSA-N	0	3	341.293	3.268	20	30		EGEDHN
C=C(C)CCC(=O)NC1CC2(CC(NCc3cc(C4CC4)no3)C2)C1	ZINC001121183299	1371881350	/nfs/dbraw/zinc/88/13/50/1371881350.db2.gz	IIMPBEHRPLGELO-UHFFFAOYSA-N	0	3	343.471	3.425	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@H]1CN(CCc2ccc(C#N)cc2)CC12CC2	ZINC001208921107	1371946308	/nfs/dbraw/zinc/94/63/08/1371946308.db2.gz	ZEYIKOPTKMNZHH-QGZVFWFLSA-N	0	3	341.455	3.090	20	30		EGEDHN
CO[C@H](CN1CCN(CCc2ccc(C#N)cc2)CC1)c1ccccc1	ZINC001208929546	1371949572	/nfs/dbraw/zinc/94/95/72/1371949572.db2.gz	QSQHFMWHEPCJJP-JOCHJYFZSA-N	0	3	349.478	3.106	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001208960352	1371962680	/nfs/dbraw/zinc/96/26/80/1371962680.db2.gz	GAVOUDAUXOHFOU-KRWDZBQOSA-N	0	3	344.886	3.484	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC[C@@H](NCc2ccc(Cl)nc2)C1	ZINC001209003357	1371971796	/nfs/dbraw/zinc/97/17/96/1371971796.db2.gz	GRPYXFVSIFYWQD-QGZVFWFLSA-N	0	3	347.890	3.399	20	30		EGEDHN
COCOCCCN(Cc1ccc(C#N)cc1)Cc1ccc(C#N)cc1	ZINC001209030955	1371979009	/nfs/dbraw/zinc/97/90/09/1371979009.db2.gz	FBKZTOBQOWTNAC-UHFFFAOYSA-N	0	3	349.434	3.443	20	30		EGEDHN
O=C(CCCF)N1CCC[C@@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001209085303	1371992750	/nfs/dbraw/zinc/99/27/50/1371992750.db2.gz	BJVAMWCONOVXSC-QGZVFWFLSA-N	0	3	336.838	3.022	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001209147460	1372014664	/nfs/dbraw/zinc/01/46/64/1372014664.db2.gz	XEMZGIFBOCPWBL-XLIONFOSSA-N	0	3	342.458	3.360	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001209182521	1372027412	/nfs/dbraw/zinc/02/74/12/1372027412.db2.gz	FCIPLDMJANXAHC-PXNSSMCTSA-N	0	3	342.458	3.360	20	30		EGEDHN
C=CCCCCN1CCO[C@@H]2[C@H](COCc3cccnc3)CC[C@@H]21	ZINC001209202691	1372036363	/nfs/dbraw/zinc/03/63/63/1372036363.db2.gz	NJEHLYNDPLQRLN-SLFFLAALSA-N	0	3	330.472	3.434	20	30		EGEDHN
C=CCO[C@@H]1CO[C@]2(C1)CCCN(CCc1ccc(F)c(F)c1)C2	ZINC001209243498	1372047832	/nfs/dbraw/zinc/04/78/32/1372047832.db2.gz	HRZBKTWGXWWFIL-LPHOPBHVSA-N	0	3	337.410	3.333	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC1CC2(CC(NCc3cnc(C)o3)C2)C1	ZINC001121713381	1372055974	/nfs/dbraw/zinc/05/59/74/1372055974.db2.gz	HYDZGARTJJQHLE-LZUQWOSISA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC1CC2(CC(NCc3ccn(CC)n3)C2)C1	ZINC001121714194	1372056634	/nfs/dbraw/zinc/05/66/34/1372056634.db2.gz	YZRSSIKBRHMEJK-JLYZFGFVSA-N	0	3	344.503	3.022	20	30		EGEDHN
C=CCCCCCCN1C[C@H](O)C[C@@H](NC(=O)OC(C)(C)C)C1	ZINC001209430922	1372104380	/nfs/dbraw/zinc/10/43/80/1372104380.db2.gz	DRJCLWNSPCBHEQ-HZPDHXFCSA-N	0	3	326.481	3.083	20	30		EGEDHN
C=CCOC(=O)N[C@H]1CCCN(Cc2c[nH]c3c2cccc3C)C1	ZINC001209490196	1372119511	/nfs/dbraw/zinc/11/95/11/1372119511.db2.gz	RUJCVQRXEOIJKQ-INIZCTEOSA-N	0	3	327.428	3.353	20	30		EGEDHN
C=CCC1(C(=O)N2CCC[C@H](NCc3cc(C)ns3)C2)CCC1	ZINC001209504548	1372123431	/nfs/dbraw/zinc/12/34/31/1372123431.db2.gz	SIKHDZQMULIOBQ-HNNXBMFYSA-N	0	3	333.501	3.279	20	30		EGEDHN
Cn1nc2ccccc2c1CN1CCC[C@H](Oc2ccc(C#N)cc2)C1	ZINC001209539379	1372132194	/nfs/dbraw/zinc/13/21/94/1372132194.db2.gz	JZRKOJCXSVVEGB-SFHVURJKSA-N	0	3	346.434	3.488	20	30		EGEDHN
Cc1[nH]c2ncccc2c1CN1CCN(c2ccc(C#N)cc2)CC1	ZINC001209586781	1372144619	/nfs/dbraw/zinc/14/46/19/1372144619.db2.gz	DIHXWHUKQJFBSC-UHFFFAOYSA-N	0	3	331.423	3.065	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CCCN(C)C2)nnc1N1CC[C@H](C)[C@H]1CC	ZINC001122631301	1372287662	/nfs/dbraw/zinc/28/76/62/1372287662.db2.gz	PSUILXLYMTZXIE-YESZJQIVSA-N	0	3	331.508	3.288	20	30		EGEDHN
CC(C)C[C@@H](C)C(=O)N1CCC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001210358748	1372331744	/nfs/dbraw/zinc/33/17/44/1372331744.db2.gz	NXIVEKXRQBSNBX-CRAIPNDOSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)[C@@H]1CCOC(C)(C)C1)c1ccccc1	ZINC001122898326	1372338156	/nfs/dbraw/zinc/33/81/56/1372338156.db2.gz	UTIKOSLXLHYXPZ-ZACQAIPSSA-N	0	3	342.439	3.168	20	30		EGEDHN
O=C(CCc1ccccc1)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001210823968	1372433706	/nfs/dbraw/zinc/43/37/06/1372433706.db2.gz	HGZWVZSJIUQYNZ-QFIPXVFZSA-N	0	3	346.474	3.252	20	30		EGEDHN
C=CCCOCC(=O)N1CCC[C@H](NCc2ccccc2Cl)C1	ZINC001211355462	1372539460	/nfs/dbraw/zinc/53/94/60/1372539460.db2.gz	SBFYSIRKFARMBT-INIZCTEOSA-N	0	3	336.863	3.013	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)c2ccccc2CC(C)C)C1	ZINC001211401080	1372551158	/nfs/dbraw/zinc/55/11/58/1372551158.db2.gz	GRPXJPRLTFKUGB-YLJYHZDGSA-N	0	3	344.499	3.138	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C2=CCCCCC2)C[C@H]1c1ccccc1	ZINC001211584239	1372586468	/nfs/dbraw/zinc/58/64/68/1372586468.db2.gz	ICAKEUWYWMCANN-LEWJYISDSA-N	0	3	336.479	3.484	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C2CCC(F)CC2)C[C@H]1c1ccccc1	ZINC001211667155	1372599681	/nfs/dbraw/zinc/59/96/81/1372599681.db2.gz	XDGGIYXQKFDYMV-GHBBCFCZSA-N	0	3	342.458	3.122	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)/C=C/c2ccco2)[C@H](OC)C1	ZINC001211786837	1372615617	/nfs/dbraw/zinc/61/56/17/1372615617.db2.gz	AOLUXLPJIJHUOX-NDZBKKTDSA-N	0	3	334.460	3.079	20	30		EGEDHN
CCCCCCCC[C@H](C)C(=O)N1CC[C@@H](NCC#CCOC)C1	ZINC001188015310	1388213975	/nfs/dbraw/zinc/21/39/75/1388213975.db2.gz	AVBXVWSKPJQPIU-RBUKOAKNSA-N	0	3	336.520	3.213	20	30		EGEDHN
CO[C@@H]1CN(CCC2CCCCCC2)C[C@H]1NC(=O)C#CC(C)(C)C	ZINC001212255143	1372679936	/nfs/dbraw/zinc/67/99/36/1372679936.db2.gz	DTVBGTOHMMZISE-RTBURBONSA-N	0	3	348.531	3.212	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)CC2CC(F)(F)C2)[C@H](OC)C1	ZINC001212479175	1372712820	/nfs/dbraw/zinc/71/28/20/1372712820.db2.gz	KCZZKRLZPIHXTH-HZPDHXFCSA-N	0	3	346.462	3.208	20	30		EGEDHN
C=C[C@@H](CC(=O)N1CC[C@@H](NCc2cccnc2)C1)c1ccccc1	ZINC001188039411	1388224906	/nfs/dbraw/zinc/22/49/06/1388224906.db2.gz	BVUBCRUFTLMGFV-AZUAARDMSA-N	0	3	335.451	3.132	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN(CCCCc2ccccc2)C[C@H]1OC	ZINC001213268629	1372871382	/nfs/dbraw/zinc/87/13/82/1372871382.db2.gz	OMFGWTKYGMLBOV-RTBURBONSA-N	0	3	344.499	3.037	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2c(C)cccc2Cl)[C@H](OC)C1	ZINC001213372923	1372895120	/nfs/dbraw/zinc/89/51/20/1372895120.db2.gz	WQCSDZOTBZBTDG-HZPDHXFCSA-N	0	3	336.863	3.044	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccco2)[C@H](OC)C1	ZINC001213466781	1372909887	/nfs/dbraw/zinc/90/98/87/1372909887.db2.gz	VTYRPNQEHHDMSH-YWTNHNAXSA-N	0	3	348.487	3.169	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2csc(C)c2)[C@H](OC)C1	ZINC001213572229	1372928785	/nfs/dbraw/zinc/92/87/85/1372928785.db2.gz	NOQAILFYTIJUDE-IAGOWNOFSA-N	0	3	338.517	3.456	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)C[C@@H](C)c2ccco2)[C@H](OC)C1	ZINC001213733646	1372953226	/nfs/dbraw/zinc/95/32/26/1372953226.db2.gz	JFEJQBLNLOWKFU-ZHALLVOQSA-N	0	3	348.487	3.335	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2ccc(CC)cc2)[C@H](OC)C1	ZINC001213799850	1372963345	/nfs/dbraw/zinc/96/33/45/1372963345.db2.gz	DNBYVBPLFDZRCA-WOJBJXKFSA-N	0	3	344.499	3.424	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@H]2[C@H]3[C@@H]2[C@@H]2CC[C@H]3C2)[C@H](OC)C1	ZINC001213951073	1372985396	/nfs/dbraw/zinc/98/53/96/1372985396.db2.gz	AJJUDGUHVSRURA-JGOWZFCDSA-N	0	3	348.531	3.064	20	30		EGEDHN
C=CCOCC(=O)N1C[C@@H](C)[C@H](N[C@H](C)c2ccccc2Cl)C1	ZINC001214329840	1373045016	/nfs/dbraw/zinc/04/50/16/1373045016.db2.gz	MLEOELJSWGVHID-CKEIUWERSA-N	0	3	336.863	3.040	20	30		EGEDHN
C[C@@H]1CN(C(=O)C=C2CCC2)C[C@H]1NCC#Cc1ccc(Cl)cc1	ZINC001214427198	1373058804	/nfs/dbraw/zinc/05/88/04/1373058804.db2.gz	QAEDZJXWBOWLQB-DNVCBOLYSA-N	0	3	342.870	3.238	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](C)[C@H](NCc2cc(Cl)ccc2F)C1	ZINC001214528848	1373074776	/nfs/dbraw/zinc/07/47/76/1373074776.db2.gz	DCVMGQFRKSPZCB-CXAGYDPISA-N	0	3	336.838	3.219	20	30		EGEDHN
CCc1ccc2occ(C(=O)NCCNCc3ccc(C#N)cc3)c2c1	ZINC001127409177	1373124503	/nfs/dbraw/zinc/12/45/03/1373124503.db2.gz	YSGQWOMSXGOCLK-UHFFFAOYSA-N	0	3	347.418	3.386	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2cccc(C(F)F)c2F)c1	ZINC001127519058	1373134057	/nfs/dbraw/zinc/13/40/57/1373134057.db2.gz	DXBPZMXTNUJPIX-UHFFFAOYSA-N	0	3	347.340	3.155	20	30		EGEDHN
C=C(C)CNCc1ccncc1O[C@H]1CCN(C(=O)CCC(C)C)C1	ZINC001127868054	1373192622	/nfs/dbraw/zinc/19/26/22/1373192622.db2.gz	ZECKCWTWLCWQFV-SFHVURJKSA-N	0	3	345.487	3.163	20	30		EGEDHN
CC(C)=C(C)CC(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001215331654	1373198848	/nfs/dbraw/zinc/19/88/48/1373198848.db2.gz	JVJHMBAGKSESRN-DNVCBOLYSA-N	0	3	343.446	3.380	20	30		EGEDHN
CC#CCCCC(=O)N1C[C@@H](C)[C@H](NCc2cccc(C(C)C)n2)C1	ZINC001215363348	1373202786	/nfs/dbraw/zinc/20/27/86/1373202786.db2.gz	JWBFAQFJTWHHDM-YLJYHZDGSA-N	0	3	341.499	3.335	20	30		EGEDHN
CCCc1ccc(C(=O)NCCNCc2ccc(C#N)cc2)s1	ZINC001128335079	1373252788	/nfs/dbraw/zinc/25/27/88/1373252788.db2.gz	OYDREHNWDMTVDO-UHFFFAOYSA-N	0	3	327.453	3.092	20	30		EGEDHN
CCCc1ccc(C(=O)NCCNCc2ccc(C#N)s2)s1	ZINC001128334193	1373253069	/nfs/dbraw/zinc/25/30/69/1373253069.db2.gz	DAGPJTDVXVQDNK-UHFFFAOYSA-N	0	3	333.482	3.153	20	30		EGEDHN
CCC[C@H](CC)C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001216105036	1373263902	/nfs/dbraw/zinc/26/39/02/1373263902.db2.gz	SWSOWTHBMOOEFE-JKIFEVAISA-N	0	3	333.501	3.383	20	30		EGEDHN
C#CCC1(C(=O)NCCNCc2ccccc2C(F)(F)F)CCC1	ZINC001129124628	1373348943	/nfs/dbraw/zinc/34/89/43/1373348943.db2.gz	AZDNYYCCYMXVCB-UHFFFAOYSA-N	0	3	338.373	3.105	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)C/C=C\c2ccccc2F)c1	ZINC001130169550	1373468496	/nfs/dbraw/zinc/46/84/96/1373468496.db2.gz	FXPYCKZWEGBKME-YWEYNIOJSA-N	0	3	337.398	3.007	20	30		EGEDHN
C=CCCCC(=O)NCc1ccncc1O[C@H]1CCN(CC(=C)C)C1	ZINC001130321382	1373492701	/nfs/dbraw/zinc/49/27/01/1373492701.db2.gz	LSMFKWLALMSDCC-SFHVURJKSA-N	0	3	343.471	3.083	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)[C@@H](C)CCCC)[C@H]2C1	ZINC001217795308	1373501785	/nfs/dbraw/zinc/50/17/85/1373501785.db2.gz	SUGZNYNEJZBCDL-GBESFXJTSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCOc1ccc(C(=O)NCCNCc2cc(F)ccc2C)cc1	ZINC001130371378	1373507996	/nfs/dbraw/zinc/50/79/96/1373507996.db2.gz	QBBNNQBTNIXMAO-UHFFFAOYSA-N	0	3	342.414	3.219	20	30		EGEDHN
Cc1ccc(C#N)cc1C(=O)N[C@@]1(C)CCN(Cc2ccccc2)C1	ZINC001130393591	1373517856	/nfs/dbraw/zinc/51/78/56/1373517856.db2.gz	SGROSNXMXGEMNL-NRFANRHFSA-N	0	3	333.435	3.261	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCO[C@@H]2CN(CCCC(C)C)C[C@@H]21	ZINC001217988343	1373528249	/nfs/dbraw/zinc/52/82/49/1373528249.db2.gz	UPBPNBSACSMVAN-RBUKOAKNSA-N	0	3	334.504	3.103	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)C(CCC)CCC)C1	ZINC001130415816	1373529016	/nfs/dbraw/zinc/52/90/16/1373529016.db2.gz	PYGXTCXXYBRERV-INIZCTEOSA-N	0	3	332.492	3.218	20	30		EGEDHN
CCC[C@@H]1CCC[C@H]1C(=O)NCCNCc1ccc(C#N)c(F)c1	ZINC001130566743	1373561595	/nfs/dbraw/zinc/56/15/95/1373561595.db2.gz	KFFKTTVWHXPKOX-NVXWUHKLSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2OCCN(C(=O)c3ccc(C)c(F)c3)[C@H]2C1	ZINC001218261060	1373585309	/nfs/dbraw/zinc/58/53/09/1373585309.db2.gz	VNEDTZANILGJIQ-AYOQOUSVSA-N	0	3	346.446	3.014	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2OCCN(C(=O)c3ccc(C)cc3F)[C@H]2C1	ZINC001218677741	1373643397	/nfs/dbraw/zinc/64/33/97/1373643397.db2.gz	ZKLDWUQIVCJZLL-AYOQOUSVSA-N	0	3	346.446	3.014	20	30		EGEDHN
N#Cc1c(F)ccc(NC(=O)[C@H]2C[C@H](c3ccccc3)CCN2)c1F	ZINC001218914135	1373666823	/nfs/dbraw/zinc/66/68/23/1373666823.db2.gz	QVTQNKCEYJUOKT-CXAGYDPISA-N	0	3	341.361	3.311	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2OCCN(C(=O)c3ccc(F)cc3C)[C@H]2C1	ZINC001218996275	1373675492	/nfs/dbraw/zinc/67/54/92/1373675492.db2.gz	WXVYDDZOGUXQCS-AYOQOUSVSA-N	0	3	346.446	3.014	20	30		EGEDHN
CCCC[C@H](CC)CC(=O)NCCNCc1ccc(OC)c(C#N)c1	ZINC001131484916	1373708514	/nfs/dbraw/zinc/70/85/14/1373708514.db2.gz	QCJZHHLCAOBPBF-INIZCTEOSA-N	0	3	345.487	3.379	20	30		EGEDHN
N#Cc1ccc(-c2ccccc2NC(=O)[C@@H](N)C2CCCCC2)nc1	ZINC001219422086	1373708793	/nfs/dbraw/zinc/70/87/93/1373708793.db2.gz	FHFUTKBUIZZOOT-IBGZPJMESA-N	0	3	334.423	3.466	20	30		EGEDHN
N#CCc1cc(NC(=O)[C@H](N)C23CC4CC(CC(C4)C2)C3)ccc1F	ZINC001219518760	1373713578	/nfs/dbraw/zinc/71/35/78/1373713578.db2.gz	XCZQEVQZVUMXKW-HLJROMEYSA-N	0	3	341.430	3.374	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)C2(C)CCCCCC2)[C@@H](O)C1	ZINC001219816765	1373733537	/nfs/dbraw/zinc/73/35/37/1373733537.db2.gz	NMQWONSHVBLICD-MSOLQXFVSA-N	0	3	336.520	3.255	20	30		EGEDHN
CC(C)(NC(=O)[C@@](C)(N)Cc1ccc(F)cc1)c1ccc(C#N)cc1	ZINC001219990036	1373744367	/nfs/dbraw/zinc/74/43/67/1373744367.db2.gz	XBTVYZUCAWGMHS-FQEVSTJZSA-N	0	3	339.414	3.009	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1CN(CCC2CCCCCC2)C[C@@H]1O	ZINC001220293344	1373764219	/nfs/dbraw/zinc/76/42/19/1373764219.db2.gz	DINDVXLTGVLXQU-HBFSDRIKSA-N	0	3	336.520	3.111	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@H](C)O[C@]3(CCN(CC(=C)C)C3)C2)CCCC1	ZINC001131703570	1373772650	/nfs/dbraw/zinc/77/26/50/1373772650.db2.gz	DQTHHRUJVDWREV-RXVVDRJESA-N	0	3	346.515	3.391	20	30		EGEDHN
CC/C=C(\C)C(=O)N1CC[C@H]2CCN(Cc3cccc(C#N)c3)[C@H]2C1	ZINC001222377527	1373828411	/nfs/dbraw/zinc/82/84/11/1373828411.db2.gz	CQAQUCULAWQLSY-RPGUYHPLSA-N	0	3	337.467	3.337	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC[C@H](C)N(CCOc2ccc(OC)cc2)C1	ZINC001131895253	1375032192	/nfs/dbraw/zinc/03/21/92/1375032192.db2.gz	HNGAZIAOLQFORX-IRXDYDNUSA-N	0	3	346.471	3.009	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3cccnc3C)[C@H]2C1	ZINC001223587349	1375039183	/nfs/dbraw/zinc/03/91/83/1375039183.db2.gz	VEMZYQSGDBPJRJ-MJGOQNOKSA-N	0	3	341.499	3.415	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CCCC[C@H]1NCc1cnn(C(C)(C)C)c1	ZINC001225308199	1375102955	/nfs/dbraw/zinc/10/29/55/1375102955.db2.gz	VQJCUKYFACUDKA-IAGOWNOFSA-N	0	3	332.492	3.121	20	30		EGEDHN
Cc1ccc(CCC(=O)NCCNCc2cccc(C#N)c2)c(C)c1	ZINC001132026726	1375106362	/nfs/dbraw/zinc/10/63/62/1375106362.db2.gz	OUACMQOOSHKPJS-UHFFFAOYSA-N	0	3	335.451	3.014	20	30		EGEDHN
Cc1ncsc1CCN1C[C@@H](NC(=O)C#CC(C)(C)C)CC[C@H]1C	ZINC001132037510	1375110958	/nfs/dbraw/zinc/11/09/58/1375110958.db2.gz	DBNXOVVWPUJXKA-ZBFHGGJFSA-N	0	3	347.528	3.013	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N[C@H]2CC[C@@H](C)N(CC(=C)C)C2)cc1	ZINC001132041481	1375112736	/nfs/dbraw/zinc/11/27/36/1375112736.db2.gz	FQZOURTYQHEIOH-MJGOQNOKSA-N	0	3	340.467	3.248	20	30		EGEDHN
C=CCCOCC(=O)NCC1CCN([C@@H](C)c2ccccc2F)CC1	ZINC001225626189	1375134720	/nfs/dbraw/zinc/13/47/20/1375134720.db2.gz	UJFFSQLXRVMCOK-INIZCTEOSA-N	0	3	348.462	3.308	20	30		EGEDHN
C#CCN1CCC(CNC(=O)C[C@H](C)CCc2ccccc2)CC1	ZINC001225626092	1375134835	/nfs/dbraw/zinc/13/48/35/1375134835.db2.gz	RLQMAGLFCCBPTA-GOSISDBHSA-N	0	3	326.484	3.107	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NCC1CCN([C@@H](C)c2ccc(F)cc2)CC1	ZINC001225631233	1375135985	/nfs/dbraw/zinc/13/59/85/1375135985.db2.gz	JVPDNYNZBUDOPK-HOTGVXAUSA-N	0	3	348.462	3.306	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCc2cccc(OC)c2F)CC[C@@H]1C	ZINC001132082114	1375136778	/nfs/dbraw/zinc/13/67/78/1375136778.db2.gz	FQXMXBQWKQOQGO-DOTOQJQBSA-N	0	3	348.462	3.312	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCOc2ccc(C)cc2C)CC[C@H]1C	ZINC001132083786	1375138359	/nfs/dbraw/zinc/13/83/59/1375138359.db2.gz	WVEQHWYBAQMIRW-QZTJIDSGSA-N	0	3	330.472	3.227	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)CCCc2ccc(C)s2)CC1	ZINC001225711869	1375149164	/nfs/dbraw/zinc/14/91/64/1375149164.db2.gz	LLSGRIOXDYWCQW-UHFFFAOYSA-N	0	3	332.513	3.231	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)COCCCCCCCC)CC[C@H]1C	ZINC001132107035	1375151348	/nfs/dbraw/zinc/15/13/48/1375151348.db2.gz	XAWBIYRZSZQGNS-MOPGFXCFSA-N	0	3	336.520	3.356	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2(Cc3ccccc3)CCC2)CC[C@H]1C	ZINC001132111610	1375154442	/nfs/dbraw/zinc/15/44/42/1375154442.db2.gz	UHBWLFJJMYUUOE-UYAOXDASSA-N	0	3	338.495	3.392	20	30		EGEDHN
N#Cc1cc(OC[C@H]2CN(Cc3ccccc3)CCCO2)ccc1F	ZINC001225820910	1375160552	/nfs/dbraw/zinc/16/05/52/1375160552.db2.gz	TWCMPRONDUYZSK-LJQANCHMSA-N	0	3	340.398	3.367	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2ncc(Cl)s2)CC[C@H]1C	ZINC001132170499	1375186128	/nfs/dbraw/zinc/18/61/28/1375186128.db2.gz	ZKBZMBLCHXVLOB-NEPJUHHUSA-N	0	3	327.881	3.345	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)CCc2cccc(C)c2)CC[C@@H]1C	ZINC001132207495	1375210420	/nfs/dbraw/zinc/21/04/20/1375210420.db2.gz	UGGDPLJYUSBSDR-ICSRJNTNSA-N	0	3	344.499	3.099	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1CC[C@@H](C)N(CCOCC(C)C)C1	ZINC001132240360	1375235161	/nfs/dbraw/zinc/23/51/61/1375235161.db2.gz	FTVXQXKGAFGJQR-MOPGFXCFSA-N	0	3	336.520	3.212	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)Cc2cc(C)cc(C)c2)CC[C@H]1C	ZINC001132262613	1375253198	/nfs/dbraw/zinc/25/31/98/1375253198.db2.gz	ZWQNPZGKQXAVPS-UYAOXDASSA-N	0	3	344.499	3.018	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1CCCC[C@H]1NCc1ccccn1	ZINC001226434294	1375257753	/nfs/dbraw/zinc/25/77/53/1375257753.db2.gz	HFHKRZACIULOLJ-RTBURBONSA-N	0	3	327.472	3.367	20	30		EGEDHN
C=CCCC(=O)NC1CCN(CCOc2c(C)cccc2C)CC1	ZINC001226518315	1375273484	/nfs/dbraw/zinc/27/34/84/1375273484.db2.gz	GCVXQERJEVCWGZ-UHFFFAOYSA-N	0	3	330.472	3.229	20	30		EGEDHN
C[C@H](C#N)C(=O)NC1CCN(C/C=C\c2ccc(Cl)cc2)CC1	ZINC001226640784	1375298553	/nfs/dbraw/zinc/29/85/53/1375298553.db2.gz	PPIBHONWMNIYDL-PYLYLYNFSA-N	0	3	331.847	3.093	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COc2ccsc2Cl)CC[C@H]1C	ZINC001132344056	1375321837	/nfs/dbraw/zinc/32/18/37/1375321837.db2.gz	LTACEAGQIRQDCY-OLZOCXBDSA-N	0	3	342.892	3.326	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](NC(=O)CN(C)CCCCCC)CC[C@H]1C	ZINC001132365697	1375330069	/nfs/dbraw/zinc/33/00/69/1375330069.db2.gz	OFFJIHDPDBUFHK-SJORKVTESA-N	0	3	343.943	3.220	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C(C)(C)Cc2ccccc2)CC[C@@H]1C	ZINC001132409657	1375359057	/nfs/dbraw/zinc/35/90/57/1375359057.db2.gz	CKIBLMFSBWFPRU-PKOBYXMFSA-N	0	3	326.484	3.248	20	30		EGEDHN
C#CCCCCC(=O)NC1CCN(CCO[C@H]2CCCC[C@H]2C)CC1	ZINC001226969776	1375374764	/nfs/dbraw/zinc/37/47/64/1375374764.db2.gz	OWBQUTAUBQVMIM-QUCCMNQESA-N	0	3	348.531	3.356	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2ccc(Cl)cc2)CC[C@H]1C	ZINC001132441331	1375385117	/nfs/dbraw/zinc/38/51/17/1375385117.db2.gz	NOAFXMRENBICQK-PBHICJAKSA-N	0	3	336.863	3.125	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)NC1CCN(Cc2ccc(CCC)cc2)CC1	ZINC001227123295	1375394032	/nfs/dbraw/zinc/39/40/32/1375394032.db2.gz	BIDYUKPYOBNYDY-NRFANRHFSA-N	0	3	344.499	3.047	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1CC[C@@H](C)N(Cc2ccccc2CC)C1	ZINC001132529175	1375443954	/nfs/dbraw/zinc/44/39/54/1375443954.db2.gz	JMULVYCHUJEWAR-XLIONFOSSA-N	0	3	344.499	3.311	20	30		EGEDHN
C#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)CCCC=C)CC1	ZINC001132554000	1375459608	/nfs/dbraw/zinc/45/96/08/1375459608.db2.gz	AEDCPGOTBLSGHY-HXUWFJFHSA-N	0	3	339.483	3.254	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2N(Cc2nccs2)C(=O)C(C)(C)C)CC1	ZINC001132583390	1375475752	/nfs/dbraw/zinc/47/57/52/1375475752.db2.gz	ZMIDIJMTUMAWTK-OAHLLOKOSA-N	0	3	345.512	3.006	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CCCC[C@H]1NCc1n[nH]c(C(C)C)n1	ZINC001228112803	1375518820	/nfs/dbraw/zinc/51/88/20/1375518820.db2.gz	ODWOBLMSBFGEBF-ARFHVFGLSA-N	0	3	347.507	3.047	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](C)[C@H](CNCc2cc(C3CC3)no2)C1	ZINC001132700479	1375520822	/nfs/dbraw/zinc/52/08/22/1375520822.db2.gz	ILWJSWLYAUUHNL-GOEBONIOSA-N	0	3	331.460	3.092	20	30		EGEDHN
C=CCc1cc(OC)c(O[C@@H]2CCCN(C(C)C)C2)c(C(=O)OC)c1	ZINC001228246346	1375533248	/nfs/dbraw/zinc/53/32/48/1375533248.db2.gz	QEAONARLJRVICB-MRXNPFEDSA-N	0	3	347.455	3.462	20	30		EGEDHN
CC#CCCCC(=O)NC1CCN(CCO[C@@H]2CCCC[C@@H]2C)CC1	ZINC001228712674	1375649305	/nfs/dbraw/zinc/64/93/05/1375649305.db2.gz	YMKCNMCXXGXWFA-AZUAARDMSA-N	0	3	348.531	3.356	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NC1CCN(Cc2cccc(COC)c2)CC1	ZINC001228750424	1375663570	/nfs/dbraw/zinc/66/35/70/1375663570.db2.gz	YPUOWMXGMFCODH-DLBZAZTESA-N	0	3	344.499	3.372	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC1CCN(Cc2sc(C)nc2C)CC1	ZINC001228809565	1375683835	/nfs/dbraw/zinc/68/38/35/1375683835.db2.gz	JYIVNQRGAOQGFV-HNNXBMFYSA-N	0	3	335.517	3.443	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC1CCN(CCc2scnc2C)CC1	ZINC001228809239	1375684041	/nfs/dbraw/zinc/68/40/41/1375684041.db2.gz	GKWRKGCCBZBESR-OAHLLOKOSA-N	0	3	335.517	3.177	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](C)[C@H](CNCc2csc(C)n2)C1	ZINC001133072144	1375759070	/nfs/dbraw/zinc/75/90/70/1375759070.db2.gz	GIMAXOJWVRHKSX-GOEBONIOSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](C)[C@@H](CNCc2cscn2)C1	ZINC001133143705	1375805447	/nfs/dbraw/zinc/80/54/47/1375805447.db2.gz	WTQJXVLKTPQXIM-CABCVRRESA-N	0	3	335.517	3.320	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@H]1[C@@H]2CCCC[C@@H]21	ZINC001133390705	1375974631	/nfs/dbraw/zinc/97/46/31/1375974631.db2.gz	FHPGOCJOEVSDNP-BWTSREIZSA-N	0	3	344.886	3.328	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@H]1CC1(C)C	ZINC001133392838	1375978878	/nfs/dbraw/zinc/97/88/78/1375978878.db2.gz	PRHIGNFORDPULI-QGZVFWFLSA-N	0	3	332.875	3.328	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)CC(C)(C)C=C	ZINC001133398507	1375982262	/nfs/dbraw/zinc/98/22/62/1375982262.db2.gz	ZWRVUEBRPUBJPA-UHFFFAOYSA-N	0	3	332.875	3.494	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@H]1CC12CCC2	ZINC001133405694	1375990911	/nfs/dbraw/zinc/99/09/11/1375990911.db2.gz	LOBKWEIKDTYXSM-QGZVFWFLSA-N	0	3	330.859	3.082	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)c1ccccc1F	ZINC001133523909	1376058112	/nfs/dbraw/zinc/05/81/12/1376058112.db2.gz	AYBYJWHDYXMPEW-VXGBXAGGSA-N	0	3	343.240	3.221	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)C1CC(F)(F)C1)Cc1cccnc1	ZINC001230727346	1376135807	/nfs/dbraw/zinc/13/58/07/1376135807.db2.gz	XEEHCIABWNNTJU-UHFFFAOYSA-N	0	3	337.414	3.011	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCCN(Cc1cccnc1)C[C@H](C)OC	ZINC001230769561	1376145262	/nfs/dbraw/zinc/14/52/62/1376145262.db2.gz	XQXZRENLSCHKOI-KRWDZBQOSA-N	0	3	347.503	3.027	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCCN(CCCOC)Cc1cccnc1	ZINC001230769307	1376145584	/nfs/dbraw/zinc/14/55/84/1376145584.db2.gz	JQVAEKBHGLNATJ-UHFFFAOYSA-N	0	3	347.503	3.029	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)CC(C)(C)COC)Cc1cccnc1	ZINC001230808193	1376153830	/nfs/dbraw/zinc/15/38/30/1376153830.db2.gz	UAPKXROEDNYTHU-UHFFFAOYSA-N	0	3	347.503	3.029	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCCN(CCCOCC)Cc1cccnc1	ZINC001230811775	1376155363	/nfs/dbraw/zinc/15/53/63/1376155363.db2.gz	SSCIZYOJQBVAMK-UHFFFAOYSA-N	0	3	347.503	3.029	20	30		EGEDHN
CC(C)[C@@H](Cc1ccccc1)C(=O)NCCNCc1ccc(C#N)cc1	ZINC001133777087	1376203305	/nfs/dbraw/zinc/20/33/05/1376203305.db2.gz	VQCHICBRCGWRSS-OAQYLSRUSA-N	0	3	349.478	3.279	20	30		EGEDHN
Cc1ccc2ccccc2c1CN1CC[C@H]1CN(C)C(=O)[C@@H](C)C#N	ZINC001231284800	1376221006	/nfs/dbraw/zinc/22/10/06/1376221006.db2.gz	WKGCGHIRRANOIJ-WMZOPIPTSA-N	0	3	335.451	3.341	20	30		EGEDHN
C#CC1CCN(Cc2ccc(OCCCOC)c(OCC)c2)CC1	ZINC001231549801	1376261845	/nfs/dbraw/zinc/26/18/45/1376261845.db2.gz	IJIXCERFWYXTAT-UHFFFAOYSA-N	0	3	331.456	3.346	20	30		EGEDHN
C=CCOc1cccc(CN2CCC(NC(=O)N(CC)CC)CC2)c1	ZINC001231624276	1376285188	/nfs/dbraw/zinc/28/51/88/1376285188.db2.gz	KYRFOSHWDYHQMX-UHFFFAOYSA-N	0	3	345.487	3.267	20	30		EGEDHN
C#Cc1cccc(CN2CCC3(C[C@@H](c4ccccc4)C(=O)N3)CC2)c1	ZINC001231657482	1376295273	/nfs/dbraw/zinc/29/52/73/1376295273.db2.gz	QXCQDILGNQHAIW-NRFANRHFSA-N	0	3	344.458	3.306	20	30		EGEDHN
C#Cc1cccc(CN2CCC(c3noc(C(F)(F)F)n3)CC2)c1	ZINC001231658986	1376298686	/nfs/dbraw/zinc/29/86/86/1376298686.db2.gz	CKSULWWVJDGCLB-UHFFFAOYSA-N	0	3	335.329	3.449	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)c1oc(C)cc1C	ZINC001134042117	1376327931	/nfs/dbraw/zinc/32/79/31/1376327931.db2.gz	KZZIMHZMIFAWJB-VXGBXAGGSA-N	0	3	343.265	3.292	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)C=C1CCC1)NCc1cc(F)ccc1C#N	ZINC001134113776	1376374383	/nfs/dbraw/zinc/37/43/83/1376374383.db2.gz	FQEBAERWCJAHOS-KGLIPLIRSA-N	0	3	329.419	3.181	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](C)C[C@H](C)NCc2cc(F)ccc2C#N)co1	ZINC001134176456	1376400325	/nfs/dbraw/zinc/40/03/25/1376400325.db2.gz	BDGPHJBWYRRXNI-QWHCGFSZSA-N	0	3	343.402	3.286	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)c1c(C)coc1C	ZINC001134289219	1376460615	/nfs/dbraw/zinc/46/06/15/1376460615.db2.gz	SGZLEELXSQOAKC-NEPJUHHUSA-N	0	3	343.265	3.292	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1nc(C(C)(C)C)cs1)NC(=O)C#CC1CC1	ZINC001134321542	1376475475	/nfs/dbraw/zinc/47/54/75/1376475475.db2.gz	ITZZJJURWKJMLG-UONOGXRCSA-N	0	3	347.528	3.227	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H](C)C[C@@H](C)NCc1csnc1OC	ZINC001134457708	1376548602	/nfs/dbraw/zinc/54/86/02/1376548602.db2.gz	SCDDDLZFVHOERC-CHWSQXEVSA-N	0	3	339.505	3.127	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2ncc(C)s2)CCC1	ZINC001134594186	1376617506	/nfs/dbraw/zinc/61/75/06/1376617506.db2.gz	YBASVZNXTUPOPV-ZIAGYGMSSA-N	0	3	333.501	3.018	20	30		EGEDHN
CN(C[C@H]1CCN1CC/C=C/c1ccccc1)C(=O)c1ccc(C#N)[nH]1	ZINC001233691880	1376696226	/nfs/dbraw/zinc/69/62/26/1376696226.db2.gz	CYQPDDQGVJOIQU-NTPDMAOXSA-N	0	3	348.450	3.136	20	30		EGEDHN
Cc1cc(C)c(C(=O)N[C@@H](C)C[C@H](C)NCc2ccccc2C#N)[nH]1	ZINC001134757148	1376702915	/nfs/dbraw/zinc/70/29/15/1376702915.db2.gz	UNNUPDWIVHAULC-HOCLYGCPSA-N	0	3	338.455	3.190	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)CCC(C)(F)F	ZINC001134761633	1376706599	/nfs/dbraw/zinc/70/65/99/1376706599.db2.gz	QWNWMPQTWGJGMG-GHMZBOCLSA-N	0	3	341.240	3.203	20	30		EGEDHN
C#CCCCC(=O)N(C)C[C@H]1CCN1Cc1c(C)cc(C)cc1C	ZINC001233914717	1376737251	/nfs/dbraw/zinc/73/72/51/1376737251.db2.gz	DNRVFVTWZAGNIO-LJQANCHMSA-N	0	3	326.484	3.448	20	30		EGEDHN
CCCCCCCN1CC[C@H]1CN(C)C(=O)[C@H]1CCCc2n[nH]cc21	ZINC001234323554	1376809680	/nfs/dbraw/zinc/80/96/80/1376809680.db2.gz	QWXWNVDNSQLJCW-IRXDYDNUSA-N	0	3	346.519	3.333	20	30		EGEDHN
CC1(C)C2CCC1(C(=O)NCCNCc1ccc(C#N)s1)CC2	ZINC001134987590	1376829371	/nfs/dbraw/zinc/82/93/71/1376829371.db2.gz	UEXKLFOFHYZNQV-UHFFFAOYSA-N	0	3	331.485	3.042	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H](C)C[C@H](C)NCc1csnc1OC	ZINC001135181575	1376954913	/nfs/dbraw/zinc/95/49/13/1376954913.db2.gz	RLHCVVFLRNEXBZ-QWHCGFSZSA-N	0	3	339.505	3.127	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H](C)C[C@H](C)NCc1ccn(C(C)C)n1	ZINC001135194369	1376966241	/nfs/dbraw/zinc/96/62/41/1376966241.db2.gz	UHOZTOZXHOWBRG-ROUUACIJSA-N	0	3	346.519	3.421	20	30		EGEDHN
C=CC1(CC(=O)NCCNCc2cnn(C(C)(C)C)c2)CCCCC1	ZINC001135196831	1376967954	/nfs/dbraw/zinc/96/79/54/1376967954.db2.gz	KVWCOBWLRLNXAV-UHFFFAOYSA-N	0	3	346.519	3.371	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)[C@H]1C[C@H]2C[C@H]2C1)NCc1cc(F)ccc1C#N	ZINC001135247131	1377000544	/nfs/dbraw/zinc/00/05/44/1377000544.db2.gz	QHLGLPXNZCJWQS-FITYOTRXSA-N	0	3	343.446	3.116	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)C(C)(C)C1CC1)NCc1ccccc1C#N	ZINC001135248293	1377001469	/nfs/dbraw/zinc/00/14/69/1377001469.db2.gz	YGZWMNNFIOGTJV-GJZGRUSLSA-N	0	3	327.472	3.367	20	30		EGEDHN
C[C@H](CC(=O)NCCNCc1ccc(C#N)cc1)c1ccccc1F	ZINC001135390343	1377069926	/nfs/dbraw/zinc/06/99/26/1377069926.db2.gz	JPAABPFWWYDEPX-OAHLLOKOSA-N	0	3	339.414	3.097	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2ccn(CC)n2)CCC1	ZINC001135395202	1377071555	/nfs/dbraw/zinc/07/15/55/1377071555.db2.gz	ORIWUHANAYLYOJ-HOTGVXAUSA-N	0	3	332.492	3.022	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)c1occc1Cl	ZINC001135399034	1377073979	/nfs/dbraw/zinc/07/39/79/1377073979.db2.gz	PEEUZUSNDKAAFL-UWVGGRQHSA-N	0	3	349.656	3.328	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1ccccc1C#N)NC(=O)C1(C)CC=CC1	ZINC001135412706	1377081084	/nfs/dbraw/zinc/08/10/84/1377081084.db2.gz	UTMHAPMHARPQPO-JKSUJKDBSA-N	0	3	325.456	3.287	20	30		EGEDHN
Cc1ccc(Cl)cc1C(=O)NCCNCc1ccc(C#N)s1	ZINC001135501412	1377120830	/nfs/dbraw/zinc/12/08/30/1377120830.db2.gz	SDTASNAAMNJVPL-UHFFFAOYSA-N	0	3	333.844	3.101	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)C1(CF)CCC1)NCc1ccccc1C#N	ZINC001135502100	1377121196	/nfs/dbraw/zinc/12/11/96/1377121196.db2.gz	WUCXDUADDFOQDK-CABCVRRESA-N	0	3	331.435	3.071	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H](C)C[C@H](C)NCc1ccn(C(C)C)n1	ZINC001135565361	1377147684	/nfs/dbraw/zinc/14/76/84/1377147684.db2.gz	UEWQKCQMRVPCLC-JKSUJKDBSA-N	0	3	334.508	3.439	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)C(C1CC1)C1CC1	ZINC001135902804	1377255544	/nfs/dbraw/zinc/25/55/44/1377255544.db2.gz	ZDWYPLZEHSGEBH-RYUDHWBXSA-N	0	3	343.309	3.204	20	30		EGEDHN
C[C@H]1CCCN(CCNC(=O)c2c(Cl)cc(C#N)cc2Cl)C1	ZINC001136225111	1377366181	/nfs/dbraw/zinc/36/61/81/1377366181.db2.gz	RZRLNWVAZNDQGL-NSHDSACASA-N	0	3	340.254	3.327	20	30		EGEDHN
COC(=O)c1ccc2c(CN(C)Cc3ccc(C#N)cc3)c[nH]c2c1	ZINC001138265013	1377695599	/nfs/dbraw/zinc/69/55/99/1377695599.db2.gz	KTBZTAKBPQXSLC-UHFFFAOYSA-N	0	3	333.391	3.458	20	30		EGEDHN
Cc1c2ccccc2[nH]c1CN1CCCN(c2ccc(C#N)cn2)CC1	ZINC001138402554	1377718152	/nfs/dbraw/zinc/71/81/52/1377718152.db2.gz	OWHQUPBBCHQAGP-UHFFFAOYSA-N	0	3	345.450	3.455	20	30		EGEDHN
C#CCOc1ccc(CN(Cc2cccnc2)C2CCOCC2)cc1	ZINC001138558760	1377741836	/nfs/dbraw/zinc/74/18/36/1377741836.db2.gz	IITIMECTAPBPLQ-UHFFFAOYSA-N	0	3	336.435	3.275	20	30		EGEDHN
C#CCOc1ccc(CN2CCN(CCc3cccs3)CC2)cc1	ZINC001138559344	1377741854	/nfs/dbraw/zinc/74/18/54/1377741854.db2.gz	RPUCFGDIEVVAPJ-UHFFFAOYSA-N	0	3	340.492	3.120	20	30		EGEDHN
C#CCOc1ccc(CN2CCC(NC(=O)CC(C)(C)C)CC2)cc1	ZINC001138560855	1377743168	/nfs/dbraw/zinc/74/31/68/1377743168.db2.gz	RKSYVZWRMKOMOF-UHFFFAOYSA-N	0	3	342.483	3.215	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCCN(C(=O)CC(C)C)CC2)c1[O-]	ZINC001138629970	1377756854	/nfs/dbraw/zinc/75/68/54/1377756854.db2.gz	LPRCVSVVOQPQQN-UHFFFAOYSA-N	0	3	330.472	3.201	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCCN(C(=O)CC(C)C)CC2)c1[O-]	ZINC001138629970	1377756855	/nfs/dbraw/zinc/75/68/55/1377756855.db2.gz	LPRCVSVVOQPQQN-UHFFFAOYSA-N	0	3	330.472	3.201	20	30		EGEDHN
C=CCN1C(=O)CCC12CCN(Cc1ccc3c(c1)CCCO3)CC2	ZINC001138715572	1377771478	/nfs/dbraw/zinc/77/14/78/1377771478.db2.gz	IWQRAPGKKSLMLQ-UHFFFAOYSA-N	0	3	340.467	3.155	20	30		EGEDHN
C=CCOc1ccccc1CN1CCC2(CC(=O)N(C(C)C)C2)CC1	ZINC001139031414	1377820294	/nfs/dbraw/zinc/82/02/94/1377820294.db2.gz	XKDSCHKLGINUMK-UHFFFAOYSA-N	0	3	342.483	3.474	20	30		EGEDHN
C=CCO[C@H]1CO[C@@]2(C1)CCCN(Cc1ccc(C)c(C#N)c1)C2	ZINC001139723764	1377941240	/nfs/dbraw/zinc/94/12/40/1377941240.db2.gz	FUIQBWFFVFNCEL-WOJBJXKFSA-N	0	3	326.440	3.193	20	30		EGEDHN
C=CCO[C@H]1CO[C@]2(C1)CCCN(Cc1ccc(COC)s1)C2	ZINC001139830760	1377958266	/nfs/dbraw/zinc/95/82/66/1377958266.db2.gz	XCSGZDGPYSNXBN-QAPCUYQASA-N	0	3	337.485	3.221	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@@H]1CC[N@@H+](Cc1cc(F)ccc1[O-])C2	ZINC001140053951	1377996801	/nfs/dbraw/zinc/99/68/01/1377996801.db2.gz	GANFVMRSNLOPGV-RTBURBONSA-N	0	3	335.419	3.105	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@@H]1CC[N@H+](Cc1cc(F)ccc1[O-])C2	ZINC001140053951	1377996802	/nfs/dbraw/zinc/99/68/02/1377996802.db2.gz	GANFVMRSNLOPGV-RTBURBONSA-N	0	3	335.419	3.105	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3c[nH]c4ccc(C#N)cc34)C2)C1=O	ZINC001140112951	1378010390	/nfs/dbraw/zinc/01/03/90/1378010390.db2.gz	PCOYREHBWGVNCE-NRFANRHFSA-N	0	3	348.450	3.040	20	30		EGEDHN
Cc1cccnc1N1CCCN(Cc2c[nH]c3ccc(C#N)cc23)CC1	ZINC001140114779	1378010671	/nfs/dbraw/zinc/01/06/71/1378010671.db2.gz	ZAPSGYYWJQUSOK-UHFFFAOYSA-N	0	3	345.450	3.455	20	30		EGEDHN
Cc1cnccc1O[C@@H]1CCN(Cc2c[nH]c3ccc(C#N)cc23)C1	ZINC001140117023	1378011970	/nfs/dbraw/zinc/01/19/70/1378011970.db2.gz	KJDAFWQADQYBHB-QGZVFWFLSA-N	0	3	332.407	3.396	20	30		EGEDHN
Cc1cccc(O[C@H]2CCN(Cc3c[nH]c4ccc(C#N)cc34)C2)n1	ZINC001140117129	1378012066	/nfs/dbraw/zinc/01/20/66/1378012066.db2.gz	LXNNMNSVNSULJK-KRWDZBQOSA-N	0	3	332.407	3.396	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@@]23CCN(CCCC)C3=O)c1[O-]	ZINC001273360189	1378099148	/nfs/dbraw/zinc/09/91/48/1378099148.db2.gz	HZBGVVWZSOZMAN-NRFANRHFSA-N	0	3	342.483	3.488	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@@]23CCN(CCCC)C3=O)c1[O-]	ZINC001273360189	1378099151	/nfs/dbraw/zinc/09/91/51/1378099151.db2.gz	HZBGVVWZSOZMAN-NRFANRHFSA-N	0	3	342.483	3.488	20	30		EGEDHN
CCc1cccc(CN2CCC3(CCN(CCCC#N)C3=O)CC2)c1	ZINC001273651211	1378107874	/nfs/dbraw/zinc/10/78/74/1378107874.db2.gz	FALUHIJTVBQYLY-UHFFFAOYSA-N	0	3	339.483	3.367	20	30		EGEDHN
C=CCN1C(=O)CCC[C@]12CCC[N@@H+](Cc1ccc(C)cc1[O-])C2	ZINC001140952423	1378191860	/nfs/dbraw/zinc/19/18/60/1378191860.db2.gz	RIYCYHRSLJLBGE-HXUWFJFHSA-N	0	3	328.456	3.234	20	30		EGEDHN
C=CCN1C(=O)CCC[C@]12CCC[N@H+](Cc1ccc(C)cc1[O-])C2	ZINC001140952423	1378191861	/nfs/dbraw/zinc/19/18/61/1378191861.db2.gz	RIYCYHRSLJLBGE-HXUWFJFHSA-N	0	3	328.456	3.234	20	30		EGEDHN
C=CCO[C@H]1CO[C@]2(C1)CCCN(Cc1cnc(CCCC)[nH]1)C2	ZINC001141069920	1378229132	/nfs/dbraw/zinc/22/91/32/1378229132.db2.gz	IPGYDKWEXMPJRH-MJGOQNOKSA-N	0	3	333.476	3.078	20	30		EGEDHN
COc1cccc(CCN(C)Cc2ccc(C#N)c(SC)n2)c1	ZINC001141941622	1378396654	/nfs/dbraw/zinc/39/66/54/1378396654.db2.gz	QRSBIOTWFWSEOV-UHFFFAOYSA-N	0	3	327.453	3.358	20	30		EGEDHN
O[C@@H]1CCN(Cc2ccc(C#Cc3ccccc3)s2)CC[C@H]1F	ZINC001141972461	1378400435	/nfs/dbraw/zinc/40/04/35/1378400435.db2.gz	KRQDFGRXYFRPHV-RTBURBONSA-N	0	3	329.440	3.443	20	30		EGEDHN
CCOc1cc(F)c(CN2CCC3SC(=O)C=C3C2)c(F)c1	ZINC001143568708	1378618515	/nfs/dbraw/zinc/61/85/15/1378618515.db2.gz	HTYOGIMXAQZCAW-OAHLLOKOSA-N	0	3	325.380	3.138	20	30		EGEDHN
CCOc1c(F)cc(CN2CCC3SC(=O)C=C3C2)cc1F	ZINC001144016776	1378671473	/nfs/dbraw/zinc/67/14/73/1378671473.db2.gz	IETMOIPZSCDIBF-AWEZNQCLSA-N	0	3	325.380	3.138	20	30		EGEDHN
N#Cc1ccc(CN2C[C@H]3CCC[C@@]3(COCc3ccncc3)C2)nc1	ZINC001144158829	1378689980	/nfs/dbraw/zinc/68/99/80/1378689980.db2.gz	QYWQZQFLHJJCBZ-CTNGQTDRSA-N	0	3	348.450	3.167	20	30		EGEDHN
C#Cc1ccc(CN2CCC[C@@]3(C[C@H](OCC4CC4)CO3)C2)cc1	ZINC001144568642	1378745669	/nfs/dbraw/zinc/74/56/69/1378745669.db2.gz	AXUUANDZKJQVNT-LEWJYISDSA-N	0	3	325.452	3.218	20	30		EGEDHN
CC(C)OCCCC(=O)N[C@@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001146797075	1378921638	/nfs/dbraw/zinc/92/16/38/1378921638.db2.gz	ILELSALZLSGKLN-SJORKVTESA-N	0	3	345.487	3.136	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2cc(C)no2)CCCC1	ZINC001146830963	1378931337	/nfs/dbraw/zinc/93/13/37/1378931337.db2.gz	PHBOBKMJJOEZGN-GJZGRUSLSA-N	0	3	333.476	3.492	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)N1CC2(C1)CCN(Cc1ccc(C)nc1C)C2	ZINC001148086934	1379113975	/nfs/dbraw/zinc/11/39/75/1379113975.db2.gz	AZTJNXSANSSDPV-WBVHZDCISA-N	0	3	341.499	3.191	20	30		EGEDHN
CC(C)[C@@H]1CN(C(=O)c2cccc(Nc3ccc(C#N)cc3)c2)CCN1	ZINC001148128473	1379122218	/nfs/dbraw/zinc/12/22/18/1379122218.db2.gz	IQXOYLKAEGATHK-FQEVSTJZSA-N	0	3	348.450	3.372	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C[C@@H](CC)c3ccc(C)cc3)C2)C1	ZINC001148292775	1379147090	/nfs/dbraw/zinc/14/70/90/1379147090.db2.gz	SQGQEEUMZQMHLQ-LJQANCHMSA-N	0	3	338.495	3.436	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C[C@@H](c3ccccc3)C(C)C)C2)C1	ZINC001148598651	1379221566	/nfs/dbraw/zinc/22/15/66/1379221566.db2.gz	GHQGNNVXUOLEGP-HXUWFJFHSA-N	0	3	338.495	3.374	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)C[C@H]2CCCc3ccccc32)cc1	ZINC001148655610	1379234715	/nfs/dbraw/zinc/23/47/15/1379234715.db2.gz	PKEAGTHDGGCDLR-HXUWFJFHSA-N	0	3	347.462	3.274	20	30		EGEDHN
CCCCCCCCCCC(=O)NCCNCC(=O)NCCCC	ZINC001148763724	1379264143	/nfs/dbraw/zinc/26/41/43/1379264143.db2.gz	AEZSPBAYJBUXOK-UHFFFAOYSA-N	0	3	341.540	3.139	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@H]1CN(Cc2ccc(C)cc2)CCCO1	ZINC001149788360	1379446820	/nfs/dbraw/zinc/44/68/20/1379446820.db2.gz	GJDUVQWZZZNUOZ-IBGZPJMESA-N	0	3	330.472	3.058	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H]1CN(Cc2ccc(CC)cc2)CCCO1	ZINC001149797368	1379449172	/nfs/dbraw/zinc/44/91/72/1379449172.db2.gz	URJBJTHFBLKCDO-HXUWFJFHSA-N	0	3	344.499	3.312	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2sccc2C2CC2)cc1	ZINC001150035493	1379487629	/nfs/dbraw/zinc/48/76/29/1379487629.db2.gz	VNNOHHIOFRBEHV-UHFFFAOYSA-N	0	3	325.437	3.017	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H]1CN(Cc2ccccc2CC)CCCO1	ZINC001150085636	1379492100	/nfs/dbraw/zinc/49/21/00/1379492100.db2.gz	RMIFNQQZVDOVTI-LJQANCHMSA-N	0	3	344.499	3.168	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)CCc2ccccc2Cl)cc1	ZINC001150284922	1379528904	/nfs/dbraw/zinc/52/89/04/1379528904.db2.gz	LVFQBITVZCEHDE-UHFFFAOYSA-N	0	3	341.842	3.050	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)CC(C2CCC2)C2CCC2)C1	ZINC001150317214	1379532158	/nfs/dbraw/zinc/53/21/58/1379532158.db2.gz	IAKGQVJMSORQSN-IBGZPJMESA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)CC/C=C/c2ccccc2)C1	ZINC001150318702	1379533423	/nfs/dbraw/zinc/53/34/23/1379533423.db2.gz	UDQOWMFJQYMFDW-OJWOGGGRSA-N	0	3	342.483	3.263	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)[C@]2(C)CC[C@H](C)C2(C)C)C1	ZINC001150417898	1379551977	/nfs/dbraw/zinc/55/19/77/1379551977.db2.gz	UEPZSLYJLHFLED-ZWOKBUDYSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)CCc2cc(C)cc(C)c2)C1	ZINC001150546556	1379565756	/nfs/dbraw/zinc/56/57/56/1379565756.db2.gz	GEMKLWVVSSBTKF-FQEVSTJZSA-N	0	3	344.499	3.019	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)C(C)(C)Cc2ccccc2)C1	ZINC001150553373	1379566972	/nfs/dbraw/zinc/56/69/72/1379566972.db2.gz	LARGZFSTLQNKGP-IBGZPJMESA-N	0	3	344.499	3.039	20	30		EGEDHN
CC(C)Cc1ccc(C(=O)NCCNCc2ccc(C#N)s2)cc1	ZINC001150597672	1379577384	/nfs/dbraw/zinc/57/73/84/1379577384.db2.gz	RAODMXINGMTGJA-UHFFFAOYSA-N	0	3	341.480	3.338	20	30		EGEDHN
C=CC[C@H](C(=O)NC[C@@H]1CN(CC(=C)C)CCCO1)c1ccccc1	ZINC001150745414	1379604202	/nfs/dbraw/zinc/60/42/02/1379604202.db2.gz	PFJGLVJEVXYNOX-UXHICEINSA-N	0	3	342.483	3.130	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2sccc2Cl)CC1	ZINC001151132839	1379666152	/nfs/dbraw/zinc/66/61/52/1379666152.db2.gz	ZMXKINNEBORHEK-UHFFFAOYSA-N	0	3	342.892	3.188	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@H](C)c2ccc(C)o2)CC1	ZINC001151346570	1379703140	/nfs/dbraw/zinc/70/31/40/1379703140.db2.gz	ZXGPNFTWGZTQQO-QGZVFWFLSA-N	0	3	348.487	3.255	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@@H](C)c2ccccc2F)CC1	ZINC001151374335	1379707227	/nfs/dbraw/zinc/70/72/27/1379707227.db2.gz	GXUMWVCTGMDWFF-INIZCTEOSA-N	0	3	348.462	3.103	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)C2CC(C(C)(C)C)C2)CC1	ZINC001151415352	1379715702	/nfs/dbraw/zinc/71/57/02/1379715702.db2.gz	OJCZMJABHHOZTO-UHFFFAOYSA-N	0	3	336.520	3.232	20	30		EGEDHN
C[C@@H](CC(=O)NCCNCc1cccc(C#N)c1)c1ccc(F)cc1	ZINC001152111449	1379864360	/nfs/dbraw/zinc/86/43/60/1379864360.db2.gz	WQDCTTIQBIPSHN-HNNXBMFYSA-N	0	3	339.414	3.097	20	30		EGEDHN
C[C@@H](CC(=O)NCCNCc1ccc(C#N)cc1)c1ccc(F)cc1	ZINC001152115629	1379864592	/nfs/dbraw/zinc/86/45/92/1379864592.db2.gz	PQVWXFIGBPMYOL-HNNXBMFYSA-N	0	3	339.414	3.097	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC[C@@H](C)N(CC)Cc1ccc(F)cc1	ZINC001152227779	1379890378	/nfs/dbraw/zinc/89/03/78/1379890378.db2.gz	JBUBGVNGTNCQRD-HZPDHXFCSA-N	0	3	336.451	3.134	20	30		EGEDHN
C=CCCC(=O)NC[C@@H](C)N(CC)C[C@@H](O)c1ccc(CC)cc1	ZINC001152312786	1379905703	/nfs/dbraw/zinc/90/57/03/1379905703.db2.gz	BHPPKKWZROHXSV-VQIMIIECSA-N	0	3	332.488	3.075	20	30		EGEDHN
CCN(Cc1ccccc1C(F)(F)F)[C@H](C)CNC(=O)[C@@H](C)C#N	ZINC001152413980	1379930125	/nfs/dbraw/zinc/93/01/25/1379930125.db2.gz	SWJVUESTVGVJJT-QWHCGFSZSA-N	0	3	341.377	3.192	20	30		EGEDHN
C[C@@H]1CCCC[C@H]1CC(=O)NCCNCc1ccc(C#N)c(F)c1	ZINC001153251420	1380044658	/nfs/dbraw/zinc/04/46/58/1380044658.db2.gz	BHCPDEPLVBKREA-ZBFHGGJFSA-N	0	3	331.435	3.120	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1cc(F)c2ccccc2c1	ZINC001153769104	1380126055	/nfs/dbraw/zinc/12/60/55/1380126055.db2.gz	OAHYQIWDJYELAQ-OAHLLOKOSA-N	0	3	326.415	3.442	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)[C@H]1CCCC12CC2	ZINC001154015842	1380181077	/nfs/dbraw/zinc/18/10/77/1380181077.db2.gz	WKGKPBLFLWDNRE-VQIMIIECSA-N	0	3	339.483	3.465	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)C1(CCF)CC1	ZINC001154443799	1380278764	/nfs/dbraw/zinc/27/87/64/1380278764.db2.gz	DZGUDJAUTMAYHE-CQSZACIVSA-N	0	3	349.425	3.164	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H](C)N(CC)Cc2ccsc2)cc1	ZINC001154577166	1380308790	/nfs/dbraw/zinc/30/87/90/1380308790.db2.gz	JHEWOUPRKMRZNG-OAHLLOKOSA-N	0	3	326.465	3.370	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@H](C)N(CC)Cc1ccccc1N(C)C	ZINC001154719481	1380339573	/nfs/dbraw/zinc/33/95/73/1380339573.db2.gz	DNLWQLSKEGKDRN-GOSISDBHSA-N	0	3	343.515	3.273	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@@H](C)N(CC)Cc1cccc(C#N)c1	ZINC001155067358	1380402568	/nfs/dbraw/zinc/40/25/68/1380402568.db2.gz	XDVNJUMISDQRQR-OXQOHEQNSA-N	0	3	327.472	3.487	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)NC[C@@H](C)N(CC)Cc1ccc(F)c(C#N)c1	ZINC001155112810	1380411296	/nfs/dbraw/zinc/41/12/96/1380411296.db2.gz	YMZNRWBIHSNXIL-QGPMSJSTSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NCCCNCc1cc(F)ccc1Cl	ZINC001155427470	1380451398	/nfs/dbraw/zinc/45/13/98/1380451398.db2.gz	SJHLIDPIDXHBRD-CYBMUJFWSA-N	0	3	342.842	3.056	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@@H](C)N(CC)C[C@@H](O)c1ccccc1	ZINC001155489941	1380459844	/nfs/dbraw/zinc/45/98/44/1380459844.db2.gz	PKHAROXJJYYPAZ-SJLPKXTDSA-N	0	3	332.488	3.149	20	30		EGEDHN
Cc1cc(C#N)cc(N2CCC[C@@H](NCOCC[Si](C)(C)C)C2)n1	ZINC001156472646	1380580174	/nfs/dbraw/zinc/58/01/74/1380580174.db2.gz	NMBFHTQYNWPGSM-QGZVFWFLSA-N	0	3	346.551	3.132	20	30		EGEDHN
N#Cc1c2c(cnc1-n1cncc1CNCc1ccccc1)CCCC2	ZINC001156515747	1380587290	/nfs/dbraw/zinc/58/72/90/1380587290.db2.gz	OSFHOJCFSGULLK-UHFFFAOYSA-N	0	3	343.434	3.308	20	30		EGEDHN
N#Cc1cc(C(F)(F)n2nc(CN)c3ccccc32)cc(Cl)n1	ZINC001156855444	1380696164	/nfs/dbraw/zinc/69/61/64/1380696164.db2.gz	KBHPQOLPZPUZAX-UHFFFAOYSA-N	0	3	333.729	3.013	20	30		EGEDHN
C=CCCOCC(=O)NC[C@@H](C)N(CC)C/C=C/c1ccccc1	ZINC001157214135	1380812107	/nfs/dbraw/zinc/81/21/07/1380812107.db2.gz	XUQDPYQKYNTICL-LVMGUKCRSA-N	0	3	330.472	3.119	20	30		EGEDHN
Cc1c(Cl)c(Cl)nc(N2C[C@H]3CCCN(C)[C@H]3C2)c1C#N	ZINC001157259098	1380826757	/nfs/dbraw/zinc/82/67/57/1380826757.db2.gz	CQFMOOPPZNKLPV-PWSUYJOCSA-N	0	3	325.243	3.099	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)C[C@@H](C)Cc1cccc(F)c1	ZINC001158046147	1381111296	/nfs/dbraw/zinc/11/12/96/1381111296.db2.gz	OXBBTDRJCYJMJV-ZDUSSCGKSA-N	0	3	326.843	3.243	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccnc(-c2ccco2)c1	ZINC001158113860	1381131686	/nfs/dbraw/zinc/13/16/86/1381131686.db2.gz	XVWLIJWNIQUOOA-QGZVFWFLSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC001158117769	1381132970	/nfs/dbraw/zinc/13/29/70/1381132970.db2.gz	GAVWZKDSGRKFCA-AZUAARDMSA-N	0	3	341.499	3.012	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc(F)c(F)cc1F	ZINC001158413674	1381237084	/nfs/dbraw/zinc/23/70/84/1381237084.db2.gz	XWGCCGHVJQSONH-GFCCVEGCSA-N	0	3	326.362	3.216	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)Cc1c[nH]c2ccc(F)cc12	ZINC001158518314	1381277400	/nfs/dbraw/zinc/27/74/00/1381277400.db2.gz	FZMDYGHKZUMMMM-QGZVFWFLSA-N	0	3	343.446	3.348	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc(Cl)c(OC)c1	ZINC001158554419	1381295959	/nfs/dbraw/zinc/29/59/59/1381295959.db2.gz	JZKTUKFVKOILNX-OAHLLOKOSA-N	0	3	336.863	3.461	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cccc(C(F)(F)F)n1	ZINC001158638879	1381333635	/nfs/dbraw/zinc/33/36/35/1381333635.db2.gz	CEMMBSSIWWUQEK-CYBMUJFWSA-N	0	3	341.377	3.213	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1cccn1C(C)C	ZINC001158876984	1381447655	/nfs/dbraw/zinc/44/76/55/1381447655.db2.gz	TZFWAVULWPHVKS-GOSISDBHSA-N	0	3	347.503	3.198	20	30		EGEDHN
C=C[C@H](C(=O)N1CCCC[C@@H]1CN(C)CCOCC)c1ccccc1	ZINC001158900693	1381455624	/nfs/dbraw/zinc/45/56/24/1381455624.db2.gz	JYNLETHLQQVZPP-UXHICEINSA-N	0	3	344.499	3.306	20	30		EGEDHN
C#CCC1(C(=O)NCCCN[C@H](C)c2cc(F)ccc2F)CCC1	ZINC001159666450	1381863275	/nfs/dbraw/zinc/86/32/75/1381863275.db2.gz	VFULVYSPWRJSRC-CQSZACIVSA-N	0	3	334.410	3.315	20	30		EGEDHN
C#CCCOc1ccc(C(=O)NCCC2=CCN(CC=C)CC2)cc1	ZINC001160107663	1381999409	/nfs/dbraw/zinc/99/94/09/1381999409.db2.gz	QVXFXAFWZHSGGP-UHFFFAOYSA-N	0	3	338.451	3.027	20	30		EGEDHN
C=C(C)CCC(=O)NCCC1=CCN(CCc2ccns2)CC1	ZINC001160264203	1382055399	/nfs/dbraw/zinc/05/53/99/1382055399.db2.gz	IOUARGZYZJNFET-UHFFFAOYSA-N	0	3	333.501	3.180	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H]2CCc3ccc(OC)cc32)CC1	ZINC001160368006	1382085338	/nfs/dbraw/zinc/08/53/38/1382085338.db2.gz	YMXWLHDJBVRRJW-LJQANCHMSA-N	0	3	340.467	3.049	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H]2C[C@H]2c2ccsc2)CC1	ZINC001160485671	1382119257	/nfs/dbraw/zinc/11/92/57/1382119257.db2.gz	JDGRKUHRLQFLDC-ZWKOTPCHSA-N	0	3	328.481	3.013	20	30		EGEDHN
N#CCN(Cc1ccccc1)C(=O)[C@@H]1CCC[C@H](c2ccccc2)N1	ZINC001160670018	1382166280	/nfs/dbraw/zinc/16/62/80/1382166280.db2.gz	PWZMBQOXNVTWEA-UXHICEINSA-N	0	3	333.435	3.422	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc(C(F)(F)F)cn2)CC1	ZINC001160845376	1382215280	/nfs/dbraw/zinc/21/52/80/1382215280.db2.gz	GQXLAIUDXSGNMR-UHFFFAOYSA-N	0	3	339.361	3.038	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc3cc(F)ccc3[nH]2)CC1	ZINC001160856427	1382217397	/nfs/dbraw/zinc/21/73/97/1382217397.db2.gz	LOSAUAURNLKENZ-UHFFFAOYSA-N	0	3	339.414	3.082	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCC1=CCN(Cc2cnccc2C)CC1	ZINC001160941846	1382245209	/nfs/dbraw/zinc/24/52/09/1382245209.db2.gz	RQJLPMMMSJXOTJ-FUHWJXTLSA-N	0	3	341.499	3.487	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)Cc2cccc(Cl)c2)CC1	ZINC001161083629	1382293569	/nfs/dbraw/zinc/29/35/69/1382293569.db2.gz	DQGBAVFRDOGUBA-UHFFFAOYSA-N	0	3	330.859	3.044	20	30		EGEDHN
N#Cc1cnc(Cl)cc1NC1CCN(Cc2ccc(O)cc2)CC1	ZINC001161129771	1382311817	/nfs/dbraw/zinc/31/18/17/1382311817.db2.gz	GMPIMVKGVXUNAV-UHFFFAOYSA-N	0	3	342.830	3.389	20	30		EGEDHN
N#Cc1c(Cl)ccnc1NC1CCN(Cc2ccc(O)cc2)CC1	ZINC001161129367	1382311992	/nfs/dbraw/zinc/31/19/92/1382311992.db2.gz	FPWHYLLKUQVWHT-UHFFFAOYSA-N	0	3	342.830	3.389	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCC2=CCN(CCc3ccns3)CC2)C1	ZINC001161173523	1382324097	/nfs/dbraw/zinc/32/40/97/1382324097.db2.gz	PUHPOGQJDPOUMV-UHFFFAOYSA-N	0	3	345.512	3.180	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NCCCNCC=C(Cl)Cl	ZINC001161174159	1382325605	/nfs/dbraw/zinc/32/56/05/1382325605.db2.gz	DGHFVBDNAFMMJI-UHFFFAOYSA-N	0	3	343.254	3.280	20	30		EGEDHN
Cc1nc(C#N)cnc1NCC1CCN(Cc2ccccc2F)CC1	ZINC001161194176	1382336156	/nfs/dbraw/zinc/33/61/56/1382336156.db2.gz	MMIHHKZLYGDNFH-UHFFFAOYSA-N	0	3	339.418	3.120	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@H]1CCC[C@@H]1CCC	ZINC001161419853	1382404662	/nfs/dbraw/zinc/40/46/62/1382404662.db2.gz	UPINRRPWHJZOCS-KBPBESRZSA-N	0	3	331.298	3.207	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H](CC)Oc2cccc(C)c2)CC1	ZINC001161471783	1382417384	/nfs/dbraw/zinc/41/73/84/1382417384.db2.gz	FRCNGUYUIGMIOG-FQEVSTJZSA-N	0	3	342.483	3.477	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc(OC)cc2Cl)CC1	ZINC001161491186	1382421444	/nfs/dbraw/zinc/42/14/44/1382421444.db2.gz	JNVXBHYYSWZUQC-UHFFFAOYSA-N	0	3	334.847	3.287	20	30		EGEDHN
C[C@H](c1ccccc1)N(C(=O)[C@@H]1C[C@@H](F)CCN1)C1=CC(=O)CCC1	ZINC001161510549	1382427189	/nfs/dbraw/zinc/42/71/89/1382427189.db2.gz	ZNQATYCIMKANRZ-ALKREAHSSA-N	0	3	344.430	3.303	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc(CC)c(CC)o2)CC1	ZINC001161716241	1382487720	/nfs/dbraw/zinc/48/77/20/1382487720.db2.gz	JBJJIJLWFDYTIK-UHFFFAOYSA-N	0	3	328.456	3.180	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H](C)OCc2ccc(F)cc2)CC1	ZINC001161801423	1382510909	/nfs/dbraw/zinc/51/09/09/1382510909.db2.gz	IXTQJGKWAJYJJC-MRXNPFEDSA-N	0	3	346.446	3.055	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)COc2c(C)cc(C)cc2C)CC1	ZINC001161818325	1382519052	/nfs/dbraw/zinc/51/90/52/1382519052.db2.gz	SCMQOEFQUQMTFO-UHFFFAOYSA-N	0	3	342.483	3.315	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)COc2ccc(C)cc2C)CC1	ZINC001161848984	1382528556	/nfs/dbraw/zinc/52/85/56/1382528556.db2.gz	GROGPJGUXRKELL-UHFFFAOYSA-N	0	3	328.456	3.007	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2sc(C(C)C)nc2C)CC1	ZINC001161863531	1382534379	/nfs/dbraw/zinc/53/43/79/1382534379.db2.gz	RVYMKYMWLXVWSC-UHFFFAOYSA-N	0	3	345.512	3.350	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C[C@H](C)c2ccc(F)cc2)CC1	ZINC001161924930	1382554645	/nfs/dbraw/zinc/55/46/45/1382554645.db2.gz	QETOTPWQFGWQFG-KRWDZBQOSA-N	0	3	342.458	3.481	20	30		EGEDHN
Cc1cccc2ncc(CNc3ccc(/N=C/N(C)C)c(C#N)c3)n21	ZINC001162349499	1382737285	/nfs/dbraw/zinc/73/72/85/1382737285.db2.gz	OSFMGYTYWIAQIV-YDZHTSKRSA-N	0	3	332.411	3.348	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC1(COC)CCN(C[C@@H](F)CC)CC1	ZINC001162393638	1382746889	/nfs/dbraw/zinc/74/68/89/1382746889.db2.gz	YYBQLHPPGWNLLA-INIZCTEOSA-N	0	3	342.499	3.182	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@H]2CCCC[C@@H]2CC)(COC)CC1	ZINC001162558794	1382789649	/nfs/dbraw/zinc/78/96/49/1382789649.db2.gz	RSLKIULWJZBMNQ-OALUTQOASA-N	0	3	348.531	3.071	20	30		EGEDHN
CCC(=O)N(CCNCc1ccc(C#N)s1)CCc1ccccc1	ZINC001162650970	1382821267	/nfs/dbraw/zinc/82/12/67/1382821267.db2.gz	FDDZTQRRHSXSIR-UHFFFAOYSA-N	0	3	341.480	3.191	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)c1ccccc1C	ZINC001162678502	1382830491	/nfs/dbraw/zinc/83/04/91/1382830491.db2.gz	SCRVECLQBIPZKJ-UHFFFAOYSA-N	0	3	334.463	3.293	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CCC[C@H](F)C1	ZINC001162807165	1382879263	/nfs/dbraw/zinc/87/92/63/1382879263.db2.gz	ZCJMQDBCJREFTO-UXHICEINSA-N	0	3	344.474	3.199	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CCCC1(C)C	ZINC001162892972	1382907693	/nfs/dbraw/zinc/90/76/93/1382907693.db2.gz	ZGDVOLKAFFNYCA-FQEVSTJZSA-N	0	3	340.511	3.497	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N(CCNCC#CC)CCc1ccccc1	ZINC001162897731	1382909263	/nfs/dbraw/zinc/90/92/63/1382909263.db2.gz	HDWDETNJJYQABF-IBGZPJMESA-N	0	3	326.484	3.273	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@]1(C)CCC[C@@H]1C	ZINC001162918968	1382917094	/nfs/dbraw/zinc/91/70/94/1382917094.db2.gz	JLFRXDSXRCEHHI-UGKGYDQZSA-N	0	3	340.511	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)Cc1ccc(CC)cc1	ZINC001162952545	1382925811	/nfs/dbraw/zinc/92/58/11/1382925811.db2.gz	SGFWFQHJWIYTOK-UHFFFAOYSA-N	0	3	348.490	3.086	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1cc(C)c(CC)o1	ZINC001162983033	1382937241	/nfs/dbraw/zinc/93/72/41/1382937241.db2.gz	XGYCIADGNUAPBK-UHFFFAOYSA-N	0	3	338.451	3.058	20	30		EGEDHN
CC(C)C(=O)NCCC1(CNCC#Cc2ccccc2Cl)CC1	ZINC001163458263	1383055787	/nfs/dbraw/zinc/05/57/87/1383055787.db2.gz	AYWHLDRKULYUGE-UHFFFAOYSA-N	0	3	332.875	3.224	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)CCc1ccc(C)c(Cl)c1	ZINC001163479825	1383060860	/nfs/dbraw/zinc/06/08/60/1383060860.db2.gz	SXESZZASPUGNSE-UHFFFAOYSA-N	0	3	329.271	3.429	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)/C(C)=C/CC)CC1	ZINC001163677214	1383103324	/nfs/dbraw/zinc/10/33/24/1383103324.db2.gz	VSXPSMAKQIKCPD-LFYBBSHMSA-N	0	3	329.282	3.127	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)/C(C)=C\CC)CC1	ZINC001163677215	1383103896	/nfs/dbraw/zinc/10/38/96/1383103896.db2.gz	VSXPSMAKQIKCPD-XGICHPGQSA-N	0	3	329.282	3.127	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCCNCc2cc(F)ccc2Cl)cc1	ZINC001163734490	1383116297	/nfs/dbraw/zinc/11/62/97/1383116297.db2.gz	QANPEHBYIVUXOE-UHFFFAOYSA-N	0	3	344.817	3.370	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCC1(CN[C@H](C)c2c(F)cccc2F)CC1	ZINC001163841001	1383127804	/nfs/dbraw/zinc/12/78/04/1383127804.db2.gz	LHVKNVRUJHJSOK-CHWSQXEVSA-N	0	3	335.398	3.062	20	30		EGEDHN
C#CCCCCCC(=O)NCCCNCc1oc(C(C)C)nc1C	ZINC001163969252	1383141309	/nfs/dbraw/zinc/14/13/09/1383141309.db2.gz	FEZJPZZOALQSIR-UHFFFAOYSA-N	0	3	333.476	3.286	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCC1(CN[C@H](C)c2cnccn2)CC1	ZINC001164648426	1383213641	/nfs/dbraw/zinc/21/36/41/1383213641.db2.gz	KUXNPSVFKCBIBE-MRXNPFEDSA-N	0	3	342.487	3.182	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCC1(CNCc2conc2CC)CC1	ZINC001165215201	1383250504	/nfs/dbraw/zinc/25/05/04/1383250504.db2.gz	LOAGINPTNJKUTN-UHFFFAOYSA-N	0	3	333.476	3.215	20	30		EGEDHN
Cc1c(F)ccc2nc(Cl)c(C#N)c(-n3ncc4c3CCNC4)c12	ZINC001165222627	1383252952	/nfs/dbraw/zinc/25/29/52/1383252952.db2.gz	FTKXMXQECCNSLV-UHFFFAOYSA-N	0	3	341.777	3.039	20	30		EGEDHN
C=C(C)CCC(=O)NCCC1(CNCc2ccc(C#N)cc2F)CC1	ZINC001165258929	1383259774	/nfs/dbraw/zinc/25/97/74/1383259774.db2.gz	WRLPLVPQPPSVAL-UHFFFAOYSA-N	0	3	343.446	3.430	20	30		EGEDHN
C[C@H]1CCC[C@@H](C(=O)NCCCNCc2ccc(C#N)cc2F)C1	ZINC001165424089	1383293075	/nfs/dbraw/zinc/29/30/75/1383293075.db2.gz	JCMWDAJKYHVDBU-GOEBONIOSA-N	0	3	331.435	3.120	20	30		EGEDHN
N#Cc1ccc2c(c1)ncnc2NCC1CN(Cc2ccccc2)C1	ZINC001165427347	1383294096	/nfs/dbraw/zinc/29/40/96/1383294096.db2.gz	OCWJFEBGVDLACU-UHFFFAOYSA-N	0	3	329.407	3.045	20	30		EGEDHN
C[C@H]1CCC[C@]1(C)C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001166053463	1383383276	/nfs/dbraw/zinc/38/32/76/1383383276.db2.gz	DDEDVLAXFOQEPC-LIRRHRJNSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCCNCc2ccn(C(CC)CC)n2)C1	ZINC001166248842	1383406637	/nfs/dbraw/zinc/40/66/37/1383406637.db2.gz	HOOUZOAHMDEIJO-UHFFFAOYSA-N	0	3	332.492	3.196	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C[C@@H]2CCC(C)(C)CO2)CC1	ZINC001166264850	1383407820	/nfs/dbraw/zinc/40/78/20/1383407820.db2.gz	FTCCDNQDGPMIPO-HNNXBMFYSA-N	0	3	342.911	3.210	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCC1(CNCc2cccnc2OC)CC1	ZINC001166546390	1383436652	/nfs/dbraw/zinc/43/66/52/1383436652.db2.gz	WZHWCANYCPEEBI-UHFFFAOYSA-N	0	3	345.487	3.069	20	30		EGEDHN
C[C@@H]1CCCN(c2nccnc2C(C#N)C(=O)OC(C)(C)C)[C@H]1C	ZINC001166612972	1383447324	/nfs/dbraw/zinc/44/73/24/1383447324.db2.gz	BZEHUTWVIPACDC-HZSPNIEDSA-N	0	3	330.432	3.050	20	30		EGEDHN
C=C1CCC(C(=O)NCCC2(CNCc3ccccn3)CC2)CC1	ZINC001167012852	1383517800	/nfs/dbraw/zinc/51/78/00/1383517800.db2.gz	SBSWKQNXGGTGEC-UHFFFAOYSA-N	0	3	327.472	3.204	20	30		EGEDHN
CN(C)/C=N/c1ccc(NCc2ccc(-c3ncon3)cc2)cc1C#N	ZINC001167097832	1383538658	/nfs/dbraw/zinc/53/86/58/1383538658.db2.gz	VJZABRIJLGHLKG-WSDLNYQXSA-N	0	3	346.394	3.442	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)[C@H]2C[C@H]2C(C)C)CC1	ZINC001167579902	1383677336	/nfs/dbraw/zinc/67/73/36/1383677336.db2.gz	WRAFDICOWKBQPF-KBPBESRZSA-N	0	3	343.309	3.063	20	30		EGEDHN
CC[C@@]1(C)C[C@@H]1C(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001167583030	1383679165	/nfs/dbraw/zinc/67/91/65/1383679165.db2.gz	FDCQFEACQVQBHV-QUCCMNQESA-N	0	3	339.483	3.371	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cc3sccc3[nH]2)CC1	ZINC001167625846	1383691645	/nfs/dbraw/zinc/69/16/45/1383691645.db2.gz	IGAMFLJGYPZWMJ-UHFFFAOYSA-N	0	3	337.876	3.472	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)C12CCC(CC1)C2(C)C	ZINC001167859070	1383760840	/nfs/dbraw/zinc/76/08/40/1383760840.db2.gz	PTNABVQWMUSUGK-UHFFFAOYSA-N	0	3	343.309	3.207	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc3c(c2)CCC3)CC1	ZINC001168076972	1383812117	/nfs/dbraw/zinc/81/21/17/1383812117.db2.gz	AWGACMNNNTZPDK-UHFFFAOYSA-N	0	3	332.875	3.418	20	30		EGEDHN
C[C@@H](CC(=O)NCCC1(CNCc2ccccc2C#N)CC1)C1CC1	ZINC001168354915	1383881437	/nfs/dbraw/zinc/88/14/37/1383881437.db2.gz	RJQQLPFYUVENPD-INIZCTEOSA-N	0	3	339.483	3.371	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CN([C@@H](C)Cc3cccc(F)c3)C2)CC1	ZINC001168476286	1383917404	/nfs/dbraw/zinc/91/74/04/1383917404.db2.gz	SGFGQANBGZRGTI-INIZCTEOSA-N	0	3	346.446	3.477	20	30		EGEDHN
COC(=O)[C@]12CN(Cc3ccc(C#N)cc3Cl)C[C@H]1CCCC2	ZINC001307882026	1384049095	/nfs/dbraw/zinc/04/90/95/1384049095.db2.gz	FOWIWPITSHGMJO-CRAIPNDOSA-N	0	3	332.831	3.377	20	30		EGEDHN
CC(C)C[C@@H]1CN(C)CCN1Cc1cc(Cl)ccc1OCC#N	ZINC001308101016	1384092692	/nfs/dbraw/zinc/09/26/92/1384092692.db2.gz	UFKZJOHFZFRFTH-QGZVFWFLSA-N	0	3	335.879	3.404	20	30		EGEDHN
C[C@@]1(CNCc2cc(C#N)ccc2Br)CCCC[C@@H]1O	ZINC001308301817	1384117902	/nfs/dbraw/zinc/11/79/02/1384117902.db2.gz	JAETWSDYZPVZPK-HOTGVXAUSA-N	0	3	337.261	3.352	20	30		EGEDHN
CC[C@@H]1CCN([C@@H](C)C(=O)N(CCC#N)c2ccccc2OC)[C@@H]1C	ZINC001169494737	1384154144	/nfs/dbraw/zinc/15/41/44/1384154144.db2.gz	OKHBIIOWAACEBM-IXDOHACOSA-N	0	3	343.471	3.451	20	30		EGEDHN
C[Si](C)(C)C#Cc1ccc(N2CCCc3ccc(CN)nc32)cn1	ZINC001169590212	1384162710	/nfs/dbraw/zinc/16/27/10/1384162710.db2.gz	AINQMCUHYNMQLJ-UHFFFAOYSA-N	0	3	336.515	3.249	20	30		EGEDHN
CC[C@@]1(C(C)C)C[C@@H]1C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001169732794	1384180098	/nfs/dbraw/zinc/18/00/98/1384180098.db2.gz	ZYMCJLQMWVASDW-XLIONFOSSA-N	0	3	345.462	3.366	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@H](C)CCCCNCc1c(F)cccc1Cl	ZINC001169833107	1384190185	/nfs/dbraw/zinc/19/01/85/1384190185.db2.gz	TUACUYXPUZDOOZ-CHWSQXEVSA-N	0	3	339.842	3.403	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)[C@@H]1CC1(C)C	ZINC001170221300	1384268507	/nfs/dbraw/zinc/26/85/07/1384268507.db2.gz	IZVHNWQUBGLFTF-QAPCUYQASA-N	0	3	327.472	3.369	20	30		EGEDHN
COC(=O)[C@@]1(C)CCCN1C1CCC(C#N)(c2ccccc2)CC1	ZINC001170378770	1384303732	/nfs/dbraw/zinc/30/37/32/1384303732.db2.gz	KOUYFQMWRTWCAA-SKINQDTJSA-N	0	3	326.440	3.418	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H](C)CCCCNCc1nnc(C)n1CCC	ZINC001171035731	1384433805	/nfs/dbraw/zinc/43/38/05/1384433805.db2.gz	PIUUAUIIHMVEOV-MRXNPFEDSA-N	0	3	349.523	3.117	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H](C)CCCCNCc1csnc1OC	ZINC001171043438	1384435310	/nfs/dbraw/zinc/43/53/10/1384435310.db2.gz	MCYUOKFDRFINAM-CQSZACIVSA-N	0	3	339.505	3.273	20	30		EGEDHN
Cc1ccnc(OC2CCN([C@@H](C)Cc3cccc(C#N)c3)CC2)n1	ZINC001171230021	1384475032	/nfs/dbraw/zinc/47/50/32/1384475032.db2.gz	ARLQMSKIFWZALW-INIZCTEOSA-N	0	3	336.439	3.131	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@@H](C)c1ccc(C)cc1	ZINC001171531800	1384553754	/nfs/dbraw/zinc/55/37/54/1384553754.db2.gz	NURMXSUAXPOLMG-AWEZNQCLSA-N	0	3	339.277	3.103	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1cccc2cn[nH]c21	ZINC001316877980	1384662469	/nfs/dbraw/zinc/66/24/69/1384662469.db2.gz	LFQDHKMDTCCTKF-CZUORRHYSA-N	0	3	346.862	3.288	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1cccc2c[nH]nc21	ZINC001316877980	1384662476	/nfs/dbraw/zinc/66/24/76/1384662476.db2.gz	LFQDHKMDTCCTKF-CZUORRHYSA-N	0	3	346.862	3.288	20	30		EGEDHN
CCCCCCCN1CC[C@H](NC(=O)c2cc(C(F)(F)F)no2)C1	ZINC001316982691	1384740779	/nfs/dbraw/zinc/74/07/79/1384740779.db2.gz	MAFQMSHQWYYHQA-LBPRGKRZSA-N	0	3	347.381	3.468	20	30		EGEDHN
CCCCCCC[C@@H](CC)N1CCCn2nnc(CNC(C)=O)c2C1	ZINC001172354154	1384776379	/nfs/dbraw/zinc/77/63/79/1384776379.db2.gz	FIVHVNRLYFJZLR-QGZVFWFLSA-N	0	3	349.523	3.259	20	30		EGEDHN
CCCCC(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1cccc(C#N)c1	ZINC001317099001	1384861809	/nfs/dbraw/zinc/86/18/09/1384861809.db2.gz	TVIIVRDZCBUZFL-YQQQUEKLSA-N	0	3	325.456	3.360	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C[C@H]1C#N	ZINC001172985107	1384895564	/nfs/dbraw/zinc/89/55/64/1384895564.db2.gz	OCMHEODSTUSQHU-OLZOCXBDSA-N	0	3	346.456	3.001	20	30		EGEDHN
C[C@H]1CC[C@H](NCc2csc(C#N)c2)CN1C(=O)OC(C)(C)C	ZINC001173062376	1384904656	/nfs/dbraw/zinc/90/46/56/1384904656.db2.gz	UKAIPEAWFUITLV-JSGCOSHPSA-N	0	3	335.473	3.497	20	30		EGEDHN
CC(C)SCC(=O)N1CCC[C@@H](CNCc2ccccc2C#N)C1	ZINC001317146923	1384914693	/nfs/dbraw/zinc/91/46/93/1384914693.db2.gz	VBHFLCFGWSBWDK-INIZCTEOSA-N	0	3	345.512	3.028	20	30		EGEDHN
C=CCOC1CCC(N2CCn3c(CN(C)C(C)C)cnc3C2)CC1	ZINC001173321417	1384958163	/nfs/dbraw/zinc/95/81/63/1384958163.db2.gz	LEZMCXUMWXCONL-UHFFFAOYSA-N	0	3	346.519	3.053	20	30		EGEDHN
CC1(C#N)CCC(N2CC[C@@H](n3cc(Br)cn3)C2)CC1	ZINC001173596893	1384984735	/nfs/dbraw/zinc/98/47/35/1384984735.db2.gz	HDFRSNLPQSKTIF-SHARSMKWSA-N	0	3	337.265	3.365	20	30		EGEDHN
CCOC(=O)c1c(C)oc(Nc2ccccc2CN(C)C)c1C#N	ZINC001173929442	1385032144	/nfs/dbraw/zinc/03/21/44/1385032144.db2.gz	BEZXNHGCUQVPFF-UHFFFAOYSA-N	0	3	327.384	3.442	20	30		EGEDHN
CCc1ccccc1C(=O)NC[C@@H](C)NCc1ccc(F)c(C#N)c1	ZINC001317267522	1385037471	/nfs/dbraw/zinc/03/74/71/1385037471.db2.gz	IZVLTDQJRNRKPQ-CQSZACIVSA-N	0	3	339.414	3.168	20	30		EGEDHN
CCOC(=O)c1sc(SC)c(C#N)c1Nc1ccncc1C	ZINC001174536145	1385117792	/nfs/dbraw/zinc/11/77/92/1385117792.db2.gz	MVJTTYOXJWXGFO-UHFFFAOYSA-N	0	3	333.438	3.387	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1coc(-c2ccccc2)n1	ZINC001317413417	1385124166	/nfs/dbraw/zinc/12/41/66/1385124166.db2.gz	XSYAWVUYKHLALZ-ZDUSSCGKSA-N	0	3	333.819	3.192	20	30		EGEDHN
C[C@@H](CCNC(=O)c1ccc(CF)cc1)NCc1ccccc1C#N	ZINC001317415957	1385125848	/nfs/dbraw/zinc/12/58/48/1385125848.db2.gz	PXHBODYMPMMKPW-HNNXBMFYSA-N	0	3	339.414	3.326	20	30		EGEDHN
CC#CCCCC(=O)N[C@H](C)CCCCNCc1csc(C)n1	ZINC001174798523	1385150552	/nfs/dbraw/zinc/15/05/52/1385150552.db2.gz	NMHWBJPOJXTKGK-OAHLLOKOSA-N	0	3	335.517	3.410	20	30		EGEDHN
C=CCCCC(=O)N[C@@H](C)CCCCNCc1nnc(C(C)C)[nH]1	ZINC001174988175	1385179882	/nfs/dbraw/zinc/17/98/82/1385179882.db2.gz	VJXLBMQQTYKMGD-HNNXBMFYSA-N	0	3	335.496	3.049	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)CCCCNCc2cc(C)n(C)n2)CCC1	ZINC001175089432	1385193267	/nfs/dbraw/zinc/19/32/67/1385193267.db2.gz	JGRNOMBXFUQNCF-MRXNPFEDSA-N	0	3	346.519	3.240	20	30		EGEDHN
C[C@H](CCCCNCc1cc(F)ccc1C#N)NC(=O)[C@@H]1CC12CC2	ZINC001175442303	1385290984	/nfs/dbraw/zinc/29/09/84/1385290984.db2.gz	KJAGSRTVHAUTPF-KDOFPFPSSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H](C)CCCCNCc1cn(C(C)C)nn1	ZINC001175468743	1385301260	/nfs/dbraw/zinc/30/12/60/1385301260.db2.gz	JYYMIXSMNINXQM-MRXNPFEDSA-N	0	3	349.523	3.226	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)C12CCC(CC1)CC2	ZINC001176706996	1385666206	/nfs/dbraw/zinc/66/62/06/1385666206.db2.gz	OUJDATQPKGCTNY-UHFFFAOYSA-N	0	3	325.456	3.125	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC2(c3ccccc3OC)CCC2)CC1	ZINC001318589038	1385773918	/nfs/dbraw/zinc/77/39/18/1385773918.db2.gz	WXSUNFRJUVLBSO-UHFFFAOYSA-N	0	3	343.471	3.024	20	30		EGEDHN
CC1(C)CCC(C(=O)NCCCNCc2ccccc2C#N)CC1	ZINC001177160817	1385839232	/nfs/dbraw/zinc/83/92/32/1385839232.db2.gz	PUHTZTLYYTTZEI-UHFFFAOYSA-N	0	3	327.472	3.371	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2ccsn2)CCCC[C@@H]1C	ZINC001318743321	1385850451	/nfs/dbraw/zinc/85/04/51/1385850451.db2.gz	HNOIOQLUZWXYHV-NHYWBVRUSA-N	0	3	327.881	3.164	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@H]1CCCCC1(C)C	ZINC001177192957	1385854673	/nfs/dbraw/zinc/85/46/73/1385854673.db2.gz	XBXNNHCCVUJKFH-CYBMUJFWSA-N	0	3	331.298	3.207	20	30		EGEDHN
C#CCC1(C(=O)NCCCNCc2c(C)onc2CC)CCCCC1	ZINC001177217752	1385870660	/nfs/dbraw/zinc/87/06/60/1385870660.db2.gz	MAJCOQOYLIEMPG-UHFFFAOYSA-N	0	3	345.487	3.115	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NCCCNCc1cccc(Cl)c1Cl	ZINC001177273718	1385892861	/nfs/dbraw/zinc/89/28/61/1385892861.db2.gz	XFFRQXRYIKPZRR-GFCCVEGCSA-N	0	3	345.270	3.180	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)Cc1cccnc1	ZINC001177290810	1385899305	/nfs/dbraw/zinc/89/93/05/1385899305.db2.gz	NDELYQCRXOWUQL-UHFFFAOYSA-N	0	3	349.906	3.375	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCC1CCN(Cc2ccccc2Cl)CC1	ZINC001319018996	1385927590	/nfs/dbraw/zinc/92/75/90/1385927590.db2.gz	DZIRIFZNYIMAGX-CQSZACIVSA-N	0	3	333.863	3.218	20	30		EGEDHN
Cc1ccccc1C(C)(C)C(=O)NCCCNCc1ccccc1C#N	ZINC001177472316	1385969562	/nfs/dbraw/zinc/96/95/62/1385969562.db2.gz	BWDRIKDNIGXSRR-UHFFFAOYSA-N	0	3	349.478	3.440	20	30		EGEDHN
C=CCC1(C(=O)NCCCNCC(=C)Br)CCCC1	ZINC001177553084	1385996099	/nfs/dbraw/zinc/99/60/99/1385996099.db2.gz	XCTBXRGZOQFJAO-UHFFFAOYSA-N	0	3	329.282	3.127	20	30		EGEDHN
CCO[C@@H](CC)C(=O)NCCCCCCNCc1ccccc1C#N	ZINC001177970504	1386098605	/nfs/dbraw/zinc/09/86/05/1386098605.db2.gz	TZJVWUADNHEEKY-IBGZPJMESA-N	0	3	345.487	3.140	20	30		EGEDHN
C[C@@H](NCCCCCCNC(=O)[C@@H](C)C#N)c1c(F)cccc1F	ZINC001178059828	1386119395	/nfs/dbraw/zinc/11/93/95/1386119395.db2.gz	RDOVUXNORSCXLO-UONOGXRCSA-N	0	3	337.414	3.452	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2cccc(Cl)c2)CCN1C(=O)CCC1CC1	ZINC001178391483	1386204990	/nfs/dbraw/zinc/20/49/90/1386204990.db2.gz	NFZJUQRVYLJVOD-KXBFYZLASA-N	0	3	344.886	3.461	20	30		EGEDHN
CC(C)(C)C#CC(=O)NCCCCCCNCc1cc(C2CC2)no1	ZINC001178442660	1386218961	/nfs/dbraw/zinc/21/89/61/1386218961.db2.gz	XOUNLLINYYYIJM-UHFFFAOYSA-N	0	3	345.487	3.368	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCCCCCNCc1nnc(C(C)C)[nH]1	ZINC001178579606	1386255182	/nfs/dbraw/zinc/25/51/82/1386255182.db2.gz	BLHXVLDGFRZYMQ-UHFFFAOYSA-N	0	3	349.523	3.297	20	30		EGEDHN
C=CCn1cccc1C(=O)NCCCCCCNCc1cnc(C)o1	ZINC001178702405	1386283380	/nfs/dbraw/zinc/28/33/80/1386283380.db2.gz	OPTFARPSHPGUAL-UHFFFAOYSA-N	0	3	344.459	3.051	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)[C@H](C)Oc2ccccc2)CCCC1	ZINC001698639807	1406287257	/nfs/dbraw/zinc/28/72/57/1406287257.db2.gz	WHWGVNPIJWJMEG-HNNXBMFYSA-N	0	3	336.863	3.225	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCCCCCN[C@H](C)c1nnc(C)[nH]1	ZINC001179212381	1386424546	/nfs/dbraw/zinc/42/45/46/1386424546.db2.gz	LEUADDQJJIWATG-CQSZACIVSA-N	0	3	335.496	3.043	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCCCCCCNCc1ccn(CC)n1	ZINC001179335401	1386454726	/nfs/dbraw/zinc/45/47/26/1386454726.db2.gz	JQJHFSRKCZEGQD-QGZVFWFLSA-N	0	3	334.508	3.272	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCCCCCCNCc1cc(OC)no1	ZINC001179339534	1386455757	/nfs/dbraw/zinc/45/57/57/1386455757.db2.gz	GYZLCQNQCXRACK-OAHLLOKOSA-N	0	3	337.464	3.052	20	30		EGEDHN
C=CCCCCC[NH2+]CCCCCCNC(=O)c1c(C)nc[n-]c1=O	ZINC001179348867	1386459417	/nfs/dbraw/zinc/45/94/17/1386459417.db2.gz	VEORMQISAGFTEW-UHFFFAOYSA-N	0	3	348.491	3.117	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](NCc2ccc(F)c(F)c2)[C@@H]1C	ZINC001179359895	1386462868	/nfs/dbraw/zinc/46/28/68/1386462868.db2.gz	HYEPARCROYPVAV-KSSFIOAISA-N	0	3	334.410	3.237	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCCCCCN[C@@H](C)c1nnc(CC)[nH]1	ZINC001179482602	1386495178	/nfs/dbraw/zinc/49/51/78/1386495178.db2.gz	XOKGGFJLVHKIEI-KXBFYZLASA-N	0	3	349.523	3.297	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)[C@@H]1CCC(C)(C)C1	ZINC001179513334	1386503542	/nfs/dbraw/zinc/50/35/42/1386503542.db2.gz	WGFZHFMXRPCCAU-SXLOBPIMSA-N	0	3	338.495	3.443	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCCCCCN[C@H](C)c1nnc(CC)[nH]1	ZINC001179692585	1386555854	/nfs/dbraw/zinc/55/58/54/1386555854.db2.gz	LGZHHZBUWAWCJY-OAHLLOKOSA-N	0	3	349.523	3.297	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)[C@@H]1CC12CCCC2	ZINC001179856425	1386608559	/nfs/dbraw/zinc/60/85/59/1386608559.db2.gz	ACKYWMONDCESMC-IHPCNDPISA-N	0	3	336.479	3.197	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)Cc2ccc(C)nc2)CCCC[C@@H]1C	ZINC001698660649	1406311456	/nfs/dbraw/zinc/31/14/56/1406311456.db2.gz	KVOJXWUQJHJVOI-LIRRHRJNSA-N	0	3	349.906	3.340	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)Cc2cncs2)CCCC[C@H]1C	ZINC001698662507	1406313328	/nfs/dbraw/zinc/31/33/28/1406313328.db2.gz	RWYMKFOSOGTLHG-WBMJQRKESA-N	0	3	341.908	3.093	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2=CCCC2)C[C@@]1(C)CNCc1ccccc1C#N	ZINC001181142785	1386946083	/nfs/dbraw/zinc/94/60/83/1386946083.db2.gz	IWDRRAWBFPQAQW-IIBYNOLFSA-N	0	3	337.467	3.243	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](NCc2cnc(-c3ccccc3)s2)C1	ZINC001181542878	1387012520	/nfs/dbraw/zinc/01/25/20/1387012520.db2.gz	GIKVUMNIJCKHMK-MRXNPFEDSA-N	0	3	341.480	3.467	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H](C)CN(C)Cc2ccc(C#N)cc2)c(C)s1	ZINC001322196873	1387098999	/nfs/dbraw/zinc/09/89/99/1387098999.db2.gz	QAYSAWJGUPWVAY-ZDUSSCGKSA-N	0	3	341.480	3.487	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2ccn(C(C)C)n2)C1	ZINC001182207966	1387121043	/nfs/dbraw/zinc/12/10/43/1387121043.db2.gz	LGFAYSJNZAZHLR-OXQOHEQNSA-N	0	3	346.519	3.250	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](C)[C@](C)(CNCc3ocnc3C)C2)CCC1	ZINC001182506682	1387179763	/nfs/dbraw/zinc/17/97/63/1387179763.db2.gz	VFPFBLIBRJSEOV-DNVCBOLYSA-N	0	3	345.487	3.304	20	30		EGEDHN
C[C@@H](C(=O)N(C)CCN(C)Cc1ccccc1)c1ccc(C#N)cc1	ZINC001182793660	1387225316	/nfs/dbraw/zinc/22/53/16/1387225316.db2.gz	NDVCDTMWHMOIKW-QGZVFWFLSA-N	0	3	335.451	3.252	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](NCc2cc(C)ccc2OC)C1	ZINC001182825234	1387230711	/nfs/dbraw/zinc/23/07/11/1387230711.db2.gz	NDUVYLFQIAJUJJ-LJQANCHMSA-N	0	3	342.483	3.463	20	30		EGEDHN
CS[C@H](C)CC(=O)N(C)CC(C)(C)CNCc1ccccc1C#N	ZINC001329280377	1389048741	/nfs/dbraw/zinc/04/87/41/1389048741.db2.gz	YUDCALZIOQHMCW-OAHLLOKOSA-N	0	3	347.528	3.274	20	30		EGEDHN
C=C(Cl)CNC[C@H](C1CC1)N(C)C(=O)c1cccc2nc(C)[nH]c21	ZINC001331347867	1389712828	/nfs/dbraw/zinc/71/28/28/1389712828.db2.gz	PGCYIQOJBQRBIU-MRXNPFEDSA-N	0	3	346.862	3.064	20	30		EGEDHN
CCC1(C(=O)N[C@@H](CNCc2ccc(C#N)s2)C(C)(C)C)CC1	ZINC001332856035	1390201573	/nfs/dbraw/zinc/20/15/73/1390201573.db2.gz	GERQLTXKVSKDFA-HNNXBMFYSA-N	0	3	333.501	3.430	20	30		EGEDHN
C[C@@H](c1ccncc1)N1CCC(Nc2ccc(C#N)cc2CO)CC1	ZINC001333685248	1390374081	/nfs/dbraw/zinc/37/40/81/1390374081.db2.gz	OMGCGKPQGDTRJE-HNNXBMFYSA-N	0	3	336.439	3.083	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)NC[C@@H]1CCN(c2cc(Cl)ccc2C)C1	ZINC001340847564	1390383459	/nfs/dbraw/zinc/38/34/59/1390383459.db2.gz	ZTVSDLRPUNIBLU-DOTOQJQBSA-N	0	3	349.906	3.275	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)Nc1ccc(N(C)C(=O)NC)cc1	ZINC001341594161	1390507623	/nfs/dbraw/zinc/50/76/23/1390507623.db2.gz	QVBMGPAJXNFTTA-QGZVFWFLSA-N	0	3	348.491	3.479	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1cccc(OCc2ccccn2)c1	ZINC001341644540	1390513455	/nfs/dbraw/zinc/51/34/55/1390513455.db2.gz	HMIHYUWPKCDOGB-SFHVURJKSA-N	0	3	325.412	3.283	20	30		EGEDHN
C[C@H]1CN(Cc2ccccn2)CC[C@@H]1Nc1ccc(OCC#N)cc1	ZINC001341853807	1390537853	/nfs/dbraw/zinc/53/78/53/1390537853.db2.gz	ABBCBVBRSLHIJA-JXFKEZNVSA-N	0	3	336.439	3.306	20	30		EGEDHN
CC(C)[C@@H]1C[C@@H](C(=O)C(C#N)C(=O)Nc2ccccc2Cl)CCO1	ZINC001341948492	1390553232	/nfs/dbraw/zinc/55/32/32/1390553232.db2.gz	VENMFYYCVAJYBW-ZENOOKHLSA-N	0	3	348.830	3.439	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccnn1Cc1ccc(Cl)s1	ZINC001342138468	1390576920	/nfs/dbraw/zinc/57/69/20/1390576920.db2.gz	PMKBEEYJTFVXBA-GFCCVEGCSA-N	0	3	338.864	3.268	20	30		EGEDHN
N#CC(C(=O)CSCc1cccs1)C(=O)NC1CCCCC1	ZINC001342518827	1390621385	/nfs/dbraw/zinc/62/13/85/1390621385.db2.gz	JHCGNLXEMGYYLE-CQSZACIVSA-N	0	3	336.482	3.139	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)N1CCC[C@H](Cc2nccn2C)C1	ZINC001343556755	1390722337	/nfs/dbraw/zinc/72/23/37/1390722337.db2.gz	FYEXRVKTOPQNDH-QZTJIDSGSA-N	0	3	348.535	3.279	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)N1CCC[C@@H](Cc2nccn2C)C1	ZINC001343556756	1390722448	/nfs/dbraw/zinc/72/24/48/1390722448.db2.gz	FYEXRVKTOPQNDH-ROUUACIJSA-N	0	3	348.535	3.279	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)c2csc(C#N)c2)N(C)C)cc1	ZINC001344048589	1390752224	/nfs/dbraw/zinc/75/22/24/1390752224.db2.gz	ZNOBHYRDASMJCI-KRWDZBQOSA-N	0	3	327.453	3.215	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCc1ncc(-c2ccccc2)o1	ZINC001344322814	1390782088	/nfs/dbraw/zinc/78/20/88/1390782088.db2.gz	YVVRVIHOEDEVBS-HNNXBMFYSA-N	0	3	334.379	3.367	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCCOc1ccc2c(c1)CCC2	ZINC001345647290	1390871760	/nfs/dbraw/zinc/87/17/60/1390871760.db2.gz	VMRIMCMELOKRFN-GOSISDBHSA-N	0	3	337.423	3.427	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(-c3c(F)cccc3F)no2)CC1	ZINC001345904552	1390892468	/nfs/dbraw/zinc/89/24/68/1390892468.db2.gz	DJJLGZSBZHYHOP-UHFFFAOYSA-N	0	3	347.365	3.000	20	30		EGEDHN
N#Cc1ccc(C(=O)C(C#N)c2nccn2Cc2ccccc2)cc1	ZINC001347064522	1390997638	/nfs/dbraw/zinc/99/76/38/1390997638.db2.gz	ZUVUQDWBLSVHMW-SFHVURJKSA-N	0	3	326.359	3.293	20	30		EGEDHN
N#CC(C(=O)C=Cc1nccs1)C(=O)Nc1ccccc1Cl	ZINC001347091960	1390999619	/nfs/dbraw/zinc/99/96/19/1390999619.db2.gz	LASDIHHRGADIHZ-OMMCCPJFSA-N	0	3	331.784	3.157	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cnc(C)nc2C2CC2)CCCC1	ZINC001698803100	1406481472	/nfs/dbraw/zinc/48/14/72/1406481472.db2.gz	DXCFGTRKDUJRMP-UHFFFAOYSA-N	0	3	348.878	3.047	20	30		EGEDHN
C[C@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)C1C(C)(C)C1(C)C	ZINC001698816254	1406506049	/nfs/dbraw/zinc/50/60/49/1406506049.db2.gz	RJMHYEUGMSQERU-CYBMUJFWSA-N	0	3	345.462	3.316	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccc(NC[C@@H]2CCCO2)c(F)c1	ZINC001353559875	1392039667	/nfs/dbraw/zinc/03/96/67/1392039667.db2.gz	PAIBOSUOFPBFGU-GOEBONIOSA-N	0	3	335.423	3.039	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)Cc2cccc(C(F)F)c2)C1	ZINC001479381079	1392229788	/nfs/dbraw/zinc/22/97/88/1392229788.db2.gz	ZYPQGNMUMILMDZ-CTYIDZIISA-N	0	3	342.817	3.404	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N[C@H]1CCCN(Cc2ccc(C)cc2)C1)OCC	ZINC001481535184	1394393801	/nfs/dbraw/zinc/39/38/01/1394393801.db2.gz	OMYRZYMADHUTOD-PMACEKPBSA-N	0	3	344.499	3.447	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)CCCc2ccccn2)CCCC1	ZINC001481911986	1394592366	/nfs/dbraw/zinc/59/23/66/1394592366.db2.gz	PXAVYUGVSRUMPA-UHFFFAOYSA-N	0	3	335.879	3.175	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2coc(C)n2)CCCC[C@@H]1C	ZINC001481957591	1394619136	/nfs/dbraw/zinc/61/91/36/1394619136.db2.gz	QQUQCJJODFGBCH-MEDUHNTESA-N	0	3	325.840	3.004	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2coc(C)n2)CCCC[C@H]1C	ZINC001481957590	1394619654	/nfs/dbraw/zinc/61/96/54/1394619654.db2.gz	QQUQCJJODFGBCH-BZNIZROVSA-N	0	3	325.840	3.004	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC(CCN[C@@H](C)c2c(F)cccc2F)CC1	ZINC001481996404	1394656024	/nfs/dbraw/zinc/65/60/24/1394656024.db2.gz	FTVOQFGVFYKXCZ-KGLIPLIRSA-N	0	3	349.425	3.404	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)N(C)C(=O)c1cccc(F)c1F	ZINC001482322284	1394893383	/nfs/dbraw/zinc/89/33/83/1394893383.db2.gz	BIOSBZUTAVWLMJ-LLVKDONJSA-N	0	3	349.406	3.148	20	30		EGEDHN
CN(CCC1CCN(C(=O)C2CC2)CC1)Cc1cc(C#N)ccc1F	ZINC001698968875	1406730273	/nfs/dbraw/zinc/73/02/73/1406730273.db2.gz	CKEIEYLVZVJAHH-UHFFFAOYSA-N	0	3	343.446	3.168	20	30		EGEDHN
C=C(Br)CN[C@H](CNC(=O)C1(F)CCCCC1)C(C)C	ZINC001698977431	1406748451	/nfs/dbraw/zinc/74/84/51/1406748451.db2.gz	JLVLVWFTYNHZAC-CYBMUJFWSA-N	0	3	349.288	3.298	20	30		EGEDHN
Cc1sccc1CC(=O)NC[C@H](C)N(C)Cc1ccc(C#N)cc1	ZINC001485358825	1395834265	/nfs/dbraw/zinc/83/42/65/1395834265.db2.gz	RSUXZVKRKLESLV-AWEZNQCLSA-N	0	3	341.480	3.107	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)c1cc2ccccc2o1	ZINC001495798384	1396558671	/nfs/dbraw/zinc/55/86/71/1396558671.db2.gz	MVZFHYKWGJNELP-OAHLLOKOSA-N	0	3	347.418	3.460	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)NC(=O)c1ccc(Cl)cc1	ZINC001498168435	1396930766	/nfs/dbraw/zinc/93/07/66/1396930766.db2.gz	JDRWODWGVUZZKE-NSHDSACASA-N	0	3	333.844	3.181	20	30		EGEDHN
CCc1ccccc1CC(=O)N[C@H](C)CN(C)Cc1cccc(C#N)c1	ZINC001498316963	1396964337	/nfs/dbraw/zinc/96/43/37/1396964337.db2.gz	OZHHGKVGUQQBIJ-QGZVFWFLSA-N	0	3	349.478	3.300	20	30		EGEDHN
Cc1cccc(C(=O)NC[C@@H](NCc2ccc(C#N)s2)C2CC2)c1	ZINC001690141543	1404340692	/nfs/dbraw/zinc/34/06/92/1404340692.db2.gz	XEUUCEDJWSJKTD-GOSISDBHSA-N	0	3	339.464	3.226	20	30		EGEDHN
CCCC[C@@](C)(F)C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001690281923	1404444666	/nfs/dbraw/zinc/44/46/66/1404444666.db2.gz	NDTPQMJSSAHKKK-GPMSIDNRSA-N	0	3	349.425	3.353	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)CCc2cccc(OCC)c2)C1	ZINC001690302067	1404460991	/nfs/dbraw/zinc/46/09/91/1404460991.db2.gz	UXQUWBRXARZGOD-WKILWMFISA-N	0	3	336.863	3.007	20	30		EGEDHN
Cc1cc(C(=O)NCC[C@@H](C)NCc2ccccc2C#N)oc1C	ZINC001690839348	1404770516	/nfs/dbraw/zinc/77/05/16/1404770516.db2.gz	KRTWGOJAASJQNS-CQSZACIVSA-N	0	3	325.412	3.066	20	30		EGEDHN
CCCC1(C(=O)NC[C@H]2C[C@H](NCc3ccc(C#N)cc3F)C2)CC1	ZINC001691164153	1405099755	/nfs/dbraw/zinc/09/97/55/1405099755.db2.gz	OLCNFTFNELRYJC-JCNLHEQBSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@@H](C)OC2CCCCCC2)C1	ZINC001691520382	1405317959	/nfs/dbraw/zinc/31/79/59/1405317959.db2.gz	IMJHTJDSMXLFSK-BZUAXINKSA-N	0	3	342.911	3.351	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@@H](C)c2ccc(F)cc2F)C1	ZINC001691831521	1405545272	/nfs/dbraw/zinc/54/52/72/1405545272.db2.gz	PKOQHGHVHFYDCP-OBJOEFQTSA-N	0	3	342.817	3.305	20	30		EGEDHN
CC[C@@H](CNC(=O)c1cc(C(C)C)on1)NCc1ccc(C#N)s1	ZINC001732210050	1428458411	/nfs/dbraw/zinc/45/84/11/1428458411.db2.gz	LHJPDTZJJDMDLE-LBPRGKRZSA-N	0	3	346.456	3.029	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)CC2(OC)CCC2)CCCC[C@H]1C	ZINC001732255839	1428496762	/nfs/dbraw/zinc/49/67/62/1428496762.db2.gz	BKHHEENQBFMLSI-KDOFPFPSSA-N	0	3	342.911	3.353	20	30		EGEDHN
CC(C)n1cccc1C(=O)N(C)[C@@H](C)CNCc1ccc(C#N)s1	ZINC001732454639	1428588972	/nfs/dbraw/zinc/58/89/72/1428588972.db2.gz	PNUMATVXSUCCOH-AWEZNQCLSA-N	0	3	344.484	3.252	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccc(C(F)F)cc1)NC(=O)c1cc(C#N)c[nH]1	ZINC001699440901	1412768306	/nfs/dbraw/zinc/76/83/06/1412768306.db2.gz	GJPWEJOOUWTIOO-LBPRGKRZSA-N	0	3	346.381	3.074	20	30		EGEDHN
Cc1coc(C)c1C(=O)NC[C@@H](C)N(C)Cc1ccc(C#N)cc1	ZINC001700458290	1414052167	/nfs/dbraw/zinc/05/21/67/1414052167.db2.gz	XOOGWOZRSPKCCS-CQSZACIVSA-N	0	3	325.412	3.018	20	30		EGEDHN
C[C@@H](CNC(=O)C1(C)CCCCC1)N(C)Cc1cccc(C#N)c1	ZINC001700473246	1414095054	/nfs/dbraw/zinc/09/50/54/1414095054.db2.gz	GJFRQGXZPHKRCJ-INIZCTEOSA-N	0	3	327.472	3.465	20	30		EGEDHN
CCCC[C@@H](CNCc1ccc(C#N)s1)NC(=O)c1ccncc1	ZINC001700518046	1414171508	/nfs/dbraw/zinc/17/15/08/1414171508.db2.gz	WQYPIFGFHHNVJY-HNNXBMFYSA-N	0	3	342.468	3.093	20	30		EGEDHN
Cc1ccc(C)c(C(=O)N[C@H](C)CNCc2ccc(C#N)s2)c1	ZINC001732980081	1429106646	/nfs/dbraw/zinc/10/66/46/1429106646.db2.gz	OXTFWZNVFWKMDQ-CQSZACIVSA-N	0	3	327.453	3.145	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)CCc2cc(C)cc(C)c2)C1	ZINC001707091344	1417197092	/nfs/dbraw/zinc/19/70/92/1417197092.db2.gz	WTFIPRCIBOHZTI-IYARVYRRSA-N	0	3	334.891	3.473	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1cc(Cl)no1	ZINC001713002277	1417556236	/nfs/dbraw/zinc/55/62/36/1417556236.db2.gz	JFJRCUPEMICOND-GHMZBOCLSA-N	0	3	332.231	3.053	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)CC2(C)CCCCC2)C1	ZINC001713164096	1417738912	/nfs/dbraw/zinc/73/89/12/1417738912.db2.gz	GXYNTAADYSVFHH-HDJSIYSDSA-N	0	3	343.309	3.492	20	30		EGEDHN
COc1ccc(CN[C@@H](C)CNC(=O)C2=CCCCCC2)cc1C#N	ZINC001713306671	1417932161	/nfs/dbraw/zinc/93/21/61/1417932161.db2.gz	BFOKZCUEANUJTR-HNNXBMFYSA-N	0	3	341.455	3.052	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1ccc2cnccc2c1)C1CC1	ZINC001714174727	1418981972	/nfs/dbraw/zinc/98/19/72/1418981972.db2.gz	OYEHFGDQTBBVRQ-IBGZPJMESA-N	0	3	343.858	3.475	20	30		EGEDHN
CC(C)CC(C)(C)C(=O)NC[C@@H](C)CNCc1ccccc1C#N	ZINC001714444028	1419175833	/nfs/dbraw/zinc/17/58/33/1419175833.db2.gz	KMNGWMRMPXVVLT-INIZCTEOSA-N	0	3	329.488	3.472	20	30		EGEDHN
CC(C)(C(=O)NC[C@H]1CCN(Cc2cccc(C#N)c2)C1)C1CCC1	ZINC001714638070	1419409266	/nfs/dbraw/zinc/40/92/66/1419409266.db2.gz	QWJGBTXARIKESQ-GOSISDBHSA-N	0	3	339.483	3.323	20	30		EGEDHN
CC[C@H](CNC(=O)c1ccoc1Cl)NCc1ccc(C#N)s1	ZINC001715062957	1419801438	/nfs/dbraw/zinc/80/14/38/1419801438.db2.gz	ZYTHLJTYVYKBAE-SNVBAGLBSA-N	0	3	337.832	3.164	20	30		EGEDHN
CC[C@@H](CNC(=O)[C@H]1CC[C@H](C)CC1)NCc1ccc(C#N)s1	ZINC001715085091	1419823917	/nfs/dbraw/zinc/82/39/17/1419823917.db2.gz	OXUULPMOUXHEAU-KKUMJFAQSA-N	0	3	333.501	3.430	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cnc2ccsc2c1)C(C)C	ZINC001715505391	1420188468	/nfs/dbraw/zinc/18/84/68/1420188468.db2.gz	SEQQGNRUVCOIEV-CQSZACIVSA-N	0	3	337.876	3.393	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)CCc1ccsc1	ZINC001716024028	1420480116	/nfs/dbraw/zinc/48/01/16/1420480116.db2.gz	QYSCACRYPNQPHX-OAHLLOKOSA-N	0	3	341.480	3.189	20	30		EGEDHN
C[C@@H](CN(C)Cc1cccc(C#N)c1)NC(=O)c1cc2ccccn2c1	ZINC001716043800	1420506990	/nfs/dbraw/zinc/50/69/90/1420506990.db2.gz	ZEABDSOISYHDGY-INIZCTEOSA-N	0	3	346.434	3.061	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)c3coc4ccccc34)CC2)cc1	ZINC001733264845	1429421885	/nfs/dbraw/zinc/42/18/85/1429421885.db2.gz	WAMKESXIMXWIQV-UHFFFAOYSA-N	0	3	345.402	3.357	20	30		EGEDHN
C[C@H](C#N)C(=O)NCc1ccc2c(c1)CN(CCC1CCCC1)C2	ZINC001717269118	1421224624	/nfs/dbraw/zinc/22/46/24/1421224624.db2.gz	ARXJFXADKVJCLW-OAHLLOKOSA-N	0	3	325.456	3.358	20	30		EGEDHN
C[C@@H](CCNC(=O)C1(F)CCCCC1)NCc1cc(C#N)ccc1F	ZINC001717342356	1421279883	/nfs/dbraw/zinc/27/98/83/1421279883.db2.gz	PQKBKKZEHOWWLA-AWEZNQCLSA-N	0	3	349.425	3.354	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2ccc(C#N)s2)CN1C(=O)CCC(C)(F)F	ZINC001717817976	1421636829	/nfs/dbraw/zinc/63/68/29/1421636829.db2.gz	NNEXENHZVQWLAW-VXGBXAGGSA-N	0	3	341.427	3.134	20	30		EGEDHN
CCCC1(C(=O)NCC2(NCc3ccc(F)c(C#N)c3)CC2)CCC1	ZINC001723547554	1424459743	/nfs/dbraw/zinc/45/97/43/1424459743.db2.gz	YVMNXJOHUCOUGL-UHFFFAOYSA-N	0	3	343.446	3.406	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)c2c(C)noc2C)CC1	ZINC001725024805	1425442697	/nfs/dbraw/zinc/44/26/97/1425442697.db2.gz	XPFOTPQPMUSBTG-UHFFFAOYSA-N	0	3	339.867	3.218	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)CCc1cncc(C)c1	ZINC001725144657	1425625643	/nfs/dbraw/zinc/62/56/43/1425625643.db2.gz	UNRHJYNQBKGDSH-UHFFFAOYSA-N	0	3	337.895	3.149	20	30		EGEDHN
C=C(Br)CNCC(C)(C)CN(C)C(=O)C1(CC)CC1	ZINC001725150221	1425634657	/nfs/dbraw/zinc/63/46/57/1425634657.db2.gz	OAUSDMANZOSXRJ-UHFFFAOYSA-N	0	3	331.298	3.159	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1ccc(F)c(OC)c1	ZINC001725147884	1425631088	/nfs/dbraw/zinc/63/10/88/1425631088.db2.gz	BGCDXISYRMSMJJ-UHFFFAOYSA-N	0	3	342.842	3.275	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2ccc(C#N)s2)CN1C(=O)CCC(F)(F)F	ZINC001725580086	1426235981	/nfs/dbraw/zinc/23/59/81/1426235981.db2.gz	FJSPHKAWQCTMMB-GHMZBOCLSA-N	0	3	345.390	3.041	20	30		EGEDHN
CCc1sc(C(=O)NC[C@@H](C)NCc2ccc(C#N)s2)cc1C	ZINC001731635384	1427689777	/nfs/dbraw/zinc/68/97/77/1427689777.db2.gz	UXKHXOXXWZQQRC-GFCCVEGCSA-N	0	3	347.509	3.460	20	30		EGEDHN
Cc1ccc(C)c(C(=O)NC[C@H](C)N(C)Cc2ccc(C#N)cc2)c1	ZINC001734059021	1437851193	/nfs/dbraw/zinc/85/11/93/1437851193.db2.gz	MASYHPOZMYZRDN-KRWDZBQOSA-N	0	3	335.451	3.425	20	30		EGEDHN
Cc1ccccc1CC(=O)N(C)C[C@H](C)NCc1ccc(C#N)s1	ZINC001734355619	1438072989	/nfs/dbraw/zinc/07/29/89/1438072989.db2.gz	WOGLDHSIKRMRBV-HNNXBMFYSA-N	0	3	341.480	3.107	20	30		EGEDHN
C=C(Br)CN[C@@H](C)[C@@H]1CCCCN1C(=O)CC1(C)CC1	ZINC001752142841	1440145029	/nfs/dbraw/zinc/14/50/29/1440145029.db2.gz	KGRXVDIBEHWDKE-KBPBESRZSA-N	0	3	343.309	3.444	20	30		EGEDHN
C#CCCCCC(=O)N1CCCC[C@@H]1[C@H](C)NCc1c(C)noc1C	ZINC001752143561	1440145189	/nfs/dbraw/zinc/14/51/89/1440145189.db2.gz	UDQLWMXTXOEQRZ-QFBILLFUSA-N	0	3	345.487	3.344	20	30		EGEDHN
C=CCOCCN1CCC(N(C)C(=O)C2(CC=C)CCCC2)CC1	ZINC001752310438	1440170001	/nfs/dbraw/zinc/17/00/01/1440170001.db2.gz	NPECGYHORDEWQO-UHFFFAOYSA-N	0	3	334.504	3.248	20	30		EGEDHN
COCC#CCN1CCC2(C[C@H]2NC(=O)[C@H](C)CCC(C)(C)C)CC1	ZINC001752434677	1440179832	/nfs/dbraw/zinc/17/98/32/1440179832.db2.gz	IUSCKIAZGVVWJA-QZTJIDSGSA-N	0	3	348.531	3.069	20	30		EGEDHN
O=C(NC[C@H](NCC#Cc1ccc(Cl)cc1)C1CC1)C1CCCC1	ZINC001752441242	1440181342	/nfs/dbraw/zinc/18/13/42/1440181342.db2.gz	CCNLMIIPORFKLH-IBGZPJMESA-N	0	3	344.886	3.366	20	30		EGEDHN
CCC[C@@H](C)C(=O)NC[C@H](NCc1ccc(C#N)cc1F)C1CC1	ZINC001752452659	1440182634	/nfs/dbraw/zinc/18/26/34/1440182634.db2.gz	WFLMTMNMTLZSMT-ACJLOTCBSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C/C(C)=C\CC(=O)NC[C@H](NCc1ccc(C#N)cc1F)C1CC1	ZINC001752478965	1440185180	/nfs/dbraw/zinc/18/51/80/1440185180.db2.gz	CTARTDMCLSYLJR-SYJCXWOLSA-N	0	3	341.430	3.204	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H](CN(C)Cc2cccc(Cl)n2)C1	ZINC001752505255	1440189036	/nfs/dbraw/zinc/18/90/36/1440189036.db2.gz	XLXYPKXUMGOPCF-OAHLLOKOSA-N	0	3	335.879	3.372	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC[C@@H](CN(C)Cc2ccccn2)C1	ZINC001752515918	1440191144	/nfs/dbraw/zinc/19/11/44/1440191144.db2.gz	CENCCIHNYBBYIS-IBGZPJMESA-N	0	3	341.499	3.336	20	30		EGEDHN
C=CCCCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)/C=C\c1ccc[nH]1	ZINC001752531669	1440193987	/nfs/dbraw/zinc/19/39/87/1440193987.db2.gz	CYKFTYKMXQLQKZ-VFROIZBESA-N	0	3	327.472	3.450	20	30		EGEDHN
COc1ccc(Cl)c(CN[C@H]2C[C@H](NC(=O)C#CC(C)(C)C)C2)c1	ZINC001752629345	1440197087	/nfs/dbraw/zinc/19/70/87/1440197087.db2.gz	UJUWKBSBTJPCGI-SHTZXODSSA-N	0	3	348.874	3.135	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N[C@H]1C[C@H](N[C@H](C)c2ccccc2F)C1)OCC	ZINC001752634855	1440197306	/nfs/dbraw/zinc/19/73/06/1440197306.db2.gz	QYYVMFNQIVHVJJ-NNFUDEMPSA-N	0	3	348.462	3.495	20	30		EGEDHN
CC[C@H](C)[C@@H](C)C(=O)N[C@H]1C[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001752674566	1440199273	/nfs/dbraw/zinc/19/92/73/1440199273.db2.gz	XGWCXHVVUZXALE-QXGSTGNESA-N	0	3	330.447	3.096	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H]2CN(Cc3ccsc3)CC[C@H]21	ZINC001752706791	1440202861	/nfs/dbraw/zinc/20/28/61/1440202861.db2.gz	ROPCUGFASPYPLM-ZWKOTPCHSA-N	0	3	330.497	3.365	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)CC[C@H]2CCc3ccccc32)C1	ZINC001752775546	1440206775	/nfs/dbraw/zinc/20/67/75/1440206775.db2.gz	NOODCWNWZUEVJE-ZACQAIPSSA-N	0	3	332.875	3.486	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@@H]1CCCN(Cc2ncccc2C)C1	ZINC001752785735	1440211191	/nfs/dbraw/zinc/21/11/91/1440211191.db2.gz	DFKAAHDTZGSYEG-ROUUACIJSA-N	0	3	329.488	3.321	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@H]1CCCN(Cc2c(C)onc2CC)C1	ZINC001752786062	1440211360	/nfs/dbraw/zinc/21/13/60/1440211360.db2.gz	JZFGZAUHUMHHSL-IAGOWNOFSA-N	0	3	347.503	3.476	20	30		EGEDHN
C[C@H](NC(=O)CCC1CC1)[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001752835945	1440227684	/nfs/dbraw/zinc/22/76/84/1440227684.db2.gz	CSMDTKAYNNEARA-JXFKEZNVSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)CC(C)(C)CC(F)F)C1	ZINC001752838276	1440228835	/nfs/dbraw/zinc/22/88/35/1440228835.db2.gz	ZYDJVLSJBLILEF-LSDHHAIUSA-N	0	3	328.447	3.298	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)[C@H](C)CCC)CC1	ZINC001752849083	1440233125	/nfs/dbraw/zinc/23/31/25/1440233125.db2.gz	XJILGOZFWTVSGX-LMWSTFAQSA-N	0	3	331.298	3.348	20	30		EGEDHN
C[C@@H](CNC(=O)C#CC1CC1)NC1c2ccccc2-c2ccccc21	ZINC001752870707	1440237088	/nfs/dbraw/zinc/23/70/88/1440237088.db2.gz	ZSMQHIHADRIXKK-HNNXBMFYSA-N	0	3	330.431	3.264	20	30		EGEDHN
Cc1cc(C(=O)NC[C@@H](C)NCc2ccc(C#N)c(F)c2)sc1C	ZINC001752917990	1440247675	/nfs/dbraw/zinc/24/76/75/1440247675.db2.gz	CJTWQVWOGCFZNH-GFCCVEGCSA-N	0	3	345.443	3.284	20	30		EGEDHN
C[C@@H](CNC(=O)C1(C)CCC(C)CC1)NCc1ccc(C#N)s1	ZINC001752921913	1440248913	/nfs/dbraw/zinc/24/89/13/1440248913.db2.gz	BFGQMEREGGLHKF-FVRSWCFKSA-N	0	3	333.501	3.430	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccc(CF)cc1)NCc1ccc(C#N)c(F)c1	ZINC001752922232	1440248988	/nfs/dbraw/zinc/24/89/88/1440248988.db2.gz	IAKFVYCINNTGAQ-ZDUSSCGKSA-N	0	3	343.377	3.075	20	30		EGEDHN
CC(C)C#CC(=O)NCCC[C@@H]1CCCN1Cc1cccc(F)c1F	ZINC001753028510	1440272310	/nfs/dbraw/zinc/27/23/10/1440272310.db2.gz	ICXFIOLPUXOXNX-QGZVFWFLSA-N	0	3	348.437	3.485	20	30		EGEDHN
C=CCC1(C(=O)NCCN(C)Cc2cccc(N(C)C)c2)CCCC1	ZINC001753076334	1440291458	/nfs/dbraw/zinc/29/14/58/1440291458.db2.gz	DNGJNZNGRCUBGP-UHFFFAOYSA-N	0	3	343.515	3.437	20	30		EGEDHN
CCN(CCNC(=O)c1ccc(Cl)o1)Cc1cccc(C#N)c1	ZINC001753077744	1440292258	/nfs/dbraw/zinc/29/22/58/1440292258.db2.gz	GGFOIKIKUDTBNG-UHFFFAOYSA-N	0	3	331.803	3.057	20	30		EGEDHN
CCN(CCNC(=O)[C@@H](C)C#N)Cc1ccc(-c2ccccc2)cc1	ZINC001753079352	1440293105	/nfs/dbraw/zinc/29/31/05/1440293105.db2.gz	JKPNKMITEZWDJF-KRWDZBQOSA-N	0	3	335.451	3.451	20	30		EGEDHN
CCN(CCNC(=O)[C@@H](C)c1ccc(C)o1)Cc1cccc(C#N)c1	ZINC001753091505	1440299331	/nfs/dbraw/zinc/29/93/31/1440299331.db2.gz	XQNBRNRNLDWKSB-INIZCTEOSA-N	0	3	339.439	3.202	20	30		EGEDHN
C#CCCCCC(=O)NC[C@H]1CCCN1Cc1ccc2c(c1)CCC2	ZINC001753101167	1440304409	/nfs/dbraw/zinc/30/44/09/1440304409.db2.gz	LSIQHKCELQIRBL-OAQYLSRUSA-N	0	3	338.495	3.450	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@H]1CCCN1Cc1ccc(OC)cc1	ZINC001753110718	1440308327	/nfs/dbraw/zinc/30/83/27/1440308327.db2.gz	SUBLZQFCOVKWOL-FUHWJXTLSA-N	0	3	330.472	3.378	20	30		EGEDHN
CCCN(CCNC(=O)c1ccoc1CC)Cc1cccc(C#N)c1	ZINC001753144422	1440323249	/nfs/dbraw/zinc/32/32/49/1440323249.db2.gz	VRBRNBKMGYHUEZ-UHFFFAOYSA-N	0	3	339.439	3.356	20	30		EGEDHN
COc1ccc(CNCCN(C)C(=O)CCC2CCCC2)cc1C#N	ZINC001753166959	1440336103	/nfs/dbraw/zinc/33/61/03/1440336103.db2.gz	QEPFAQPOQRRSTG-UHFFFAOYSA-N	0	3	343.471	3.085	20	30		EGEDHN
C#CCCN[C@H](CNC(=O)Cc1cc(C)ccc1F)c1ccccc1	ZINC001753302898	1440354737	/nfs/dbraw/zinc/35/47/37/1440354737.db2.gz	LYKKNBPVKVFBCL-HXUWFJFHSA-N	0	3	338.426	3.147	20	30		EGEDHN
C#CCCN[C@H](CNC(=O)c1csc(Cl)c1)c1ccccc1	ZINC001753312499	1440357123	/nfs/dbraw/zinc/35/71/23/1440357123.db2.gz	SGUDDCPOBTVHKL-OAHLLOKOSA-N	0	3	332.856	3.486	20	30		EGEDHN
C#CCCN1CC[C@H](N(CCC)C(=O)c2cc(C)c(F)cc2F)C1	ZINC001753316948	1440360301	/nfs/dbraw/zinc/36/03/01/1440360301.db2.gz	DSSJIQHLENPGKA-HNNXBMFYSA-N	0	3	334.410	3.223	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CCC)C(=O)C[C@@H]2CCC(C)(C)CO2)C1	ZINC001753318194	1440361045	/nfs/dbraw/zinc/36/10/45/1440361045.db2.gz	FHSGDOYNLAIYFS-ROUUACIJSA-N	0	3	336.520	3.471	20	30		EGEDHN
Cc1ccc(C(=O)NCC[C@H]2CCN(Cc3ccc(C#N)s3)C2)o1	ZINC001753322155	1440364198	/nfs/dbraw/zinc/36/41/98/1440364198.db2.gz	SUWFJCNTQZDZPY-AWEZNQCLSA-N	0	3	343.452	3.163	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](N(CCC)C(=O)c2[nH]nc3ccccc32)C1	ZINC001753323499	1440365060	/nfs/dbraw/zinc/36/50/60/1440365060.db2.gz	NXOBWNIEZBUCDZ-CQSZACIVSA-N	0	3	346.862	3.242	20	30		EGEDHN
CC(F)(F)CCC(=O)NCC[C@@H]1CCN(Cc2ccccc2C#N)C1	ZINC001753330431	1440368904	/nfs/dbraw/zinc/36/89/04/1440368904.db2.gz	JEYVSJFHDHCEON-OAHLLOKOSA-N	0	3	349.425	3.322	20	30		EGEDHN
C=C[C@@H](CC(=O)N1CCC(CN(C)CCF)CC1)c1ccccc1	ZINC001753367887	1440386333	/nfs/dbraw/zinc/38/63/33/1440386333.db2.gz	HQUQJGLMMGDZFX-SFHVURJKSA-N	0	3	332.463	3.486	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCC1CN(CCc2ccc(CC)cc2)C1	ZINC001753404628	1440391680	/nfs/dbraw/zinc/39/16/80/1440391680.db2.gz	MNXYUUJMRXVKPV-UHFFFAOYSA-N	0	3	328.500	3.442	20	30		EGEDHN
CC#CCCCC(=O)NCC1CN(CCc2ccc(CC)cc2)C1	ZINC001753408502	1440392595	/nfs/dbraw/zinc/39/25/95/1440392595.db2.gz	PYYIHTLRAQOILS-UHFFFAOYSA-N	0	3	326.484	3.033	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H]2C[C@H]1CN2C(=O)C(C)(C)C1CCOCC1	ZINC001753423760	1440396155	/nfs/dbraw/zinc/39/61/55/1440396155.db2.gz	XSLZZLXHZSZYHS-SZMVWBNQSA-N	0	3	334.504	3.079	20	30		EGEDHN
C=CCCCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1ccc(Cl)c(F)c1	ZINC001753424676	1440396456	/nfs/dbraw/zinc/39/64/56/1440396456.db2.gz	GXTKPPFGWBJQDB-GJZGRUSLSA-N	0	3	336.838	3.273	20	30		EGEDHN
C=CCCCCCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1ccccc1F	ZINC001753426977	1440397132	/nfs/dbraw/zinc/39/71/32/1440397132.db2.gz	XWIONXNHBWHWSK-ROUUACIJSA-N	0	3	330.447	3.400	20	30		EGEDHN
C#CCCCC(=O)N(C)[C@H]1CCN(CCCOc2ccccc2C)C1	ZINC001753435688	1440399880	/nfs/dbraw/zinc/39/98/80/1440399880.db2.gz	WQRULNPHTCVFIJ-IBGZPJMESA-N	0	3	342.483	3.100	20	30		EGEDHN
CCN(C(=O)[C@@H](C)C#N)[C@H]1CCN(Cc2cc3ccccc3s2)C1	ZINC001753453916	1440407379	/nfs/dbraw/zinc/40/73/79/1440407379.db2.gz	ZJGYQOMIMUJUAG-HOCLYGCPSA-N	0	3	341.480	3.484	20	30		EGEDHN
CC[C@H](CNC(=O)c1ccc(C)o1)NCC#Cc1cccc(Cl)c1	ZINC001753464976	1440412516	/nfs/dbraw/zinc/41/25/16/1440412516.db2.gz	VLLVYTVLCLIZMD-QGZVFWFLSA-N	0	3	344.842	3.391	20	30		EGEDHN
CC[C@@H](CNC(=O)CCC1CC1)NCC#Cc1cccc(Cl)c1	ZINC001753468249	1440413366	/nfs/dbraw/zinc/41/33/66/1440413366.db2.gz	CWXDZQTWEHSLSA-SFHVURJKSA-N	0	3	332.875	3.366	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H](CC)NCc2cccc(C(C)C)n2)cc1	ZINC001753481831	1440416824	/nfs/dbraw/zinc/41/68/24/1440416824.db2.gz	ZFIGHEZJBGIUEQ-IBGZPJMESA-N	0	3	349.478	3.485	20	30		EGEDHN
C#CCNCc1ccc(CNC(=O)[C@H](C)c2cccc(Cl)c2)cc1	ZINC001753592500	1440443286	/nfs/dbraw/zinc/44/32/86/1440443286.db2.gz	PHZORKVJFGWSNF-OAHLLOKOSA-N	0	3	340.854	3.483	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCC2CCN(C[C@@H](F)CC)CC2)cc1	ZINC001753597390	1440445118	/nfs/dbraw/zinc/44/51/18/1440445118.db2.gz	MEADSUJEAONUOT-IBGZPJMESA-N	0	3	330.447	3.248	20	30		EGEDHN
C[C@@H](CNCc1ccccc1C#N)CNC(=O)CC1(C)CCCC1	ZINC001753609916	1440448808	/nfs/dbraw/zinc/44/88/08/1440448808.db2.gz	AIRNGFODOPAYKJ-INIZCTEOSA-N	0	3	327.472	3.371	20	30		EGEDHN
CCC[C@@H](C)CC(=O)N(C)[C@@H](C)CNCc1ccc(F)c(C#N)c1	ZINC001753682500	1440464845	/nfs/dbraw/zinc/46/48/45/1440464845.db2.gz	RGGNRZUROOFLOI-CABCVRRESA-N	0	3	333.451	3.460	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)c(F)c1)N(C)C(=O)C(C)(C)C1CCC1	ZINC001753704325	1440469199	/nfs/dbraw/zinc/46/91/99/1440469199.db2.gz	AGCYVUQFFUNOIA-AWEZNQCLSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=CCC1(C(=O)N(C)[C@@H](C)CNCc2ccc(C#N)s2)CCC1	ZINC001753710341	1440470457	/nfs/dbraw/zinc/47/04/57/1440470457.db2.gz	CCCHBXKPEAOVLT-AWEZNQCLSA-N	0	3	331.485	3.303	20	30		EGEDHN
Cc1ccc([C@H](C)C(=O)N(C)[C@H](C)CNCc2ccc(C#N)s2)o1	ZINC001753716539	1440472105	/nfs/dbraw/zinc/47/21/05/1440472105.db2.gz	WCHSKCBOPGQHDP-OCCSQVGLSA-N	0	3	345.468	3.261	20	30		EGEDHN
CC(C)C[C@@H](CNCc1ccc(F)c(C#N)c1)NC(=O)C1(C)CC1	ZINC001753735154	1440477558	/nfs/dbraw/zinc/47/75/58/1440477558.db2.gz	QEYKXFNFMDBMBM-INIZCTEOSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](NCc2ccn(C(C)C)n2)[C@H](C)C1	ZINC001753755388	1440483046	/nfs/dbraw/zinc/48/30/46/1440483046.db2.gz	QJDLODJHJQMSLD-AEFFLSMTSA-N	0	3	346.519	3.393	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](NCc2ccn(C(C)C)n2)[C@H](C)C1	ZINC001753755390	1440483119	/nfs/dbraw/zinc/48/31/19/1440483119.db2.gz	QJDLODJHJQMSLD-SJLPKXTDSA-N	0	3	346.519	3.393	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCCC[C@H]1CCNCc1cnc(C)o1	ZINC001753776364	1440486496	/nfs/dbraw/zinc/48/64/96/1440486496.db2.gz	DHNAWXRSSKXBEG-INIZCTEOSA-N	0	3	333.476	3.446	20	30		EGEDHN
Cc1nc(C)c(CNCC[C@@H]2CCCCN2C(=O)C#CC(C)(C)C)o1	ZINC001753777500	1440486716	/nfs/dbraw/zinc/48/67/16/1440486716.db2.gz	RORCLJOVQVXUSB-KRWDZBQOSA-N	0	3	345.487	3.202	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H](C)[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001753803721	1440491463	/nfs/dbraw/zinc/49/14/63/1440491463.db2.gz	AQYKBMYGEUZBON-KXBFYZLASA-N	0	3	343.446	3.380	20	30		EGEDHN
CC(C)[C@H](CNC(=O)C1CCCC1)NCc1ccc(C#N)cc1F	ZINC001753822237	1440496695	/nfs/dbraw/zinc/49/66/95/1440496695.db2.gz	FGANQMDAHOKPIE-SFHVURJKSA-N	0	3	331.435	3.118	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)c1c[nH]c(C#N)c1)NCc1ccccc1Cl	ZINC001753828036	1440498924	/nfs/dbraw/zinc/49/89/24/1440498924.db2.gz	BCZPBLGBWPCXRJ-QGZVFWFLSA-N	0	3	344.846	3.084	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N(C)CCN(C)[C@H](C)c1ccc(F)cc1	ZINC001753865628	1440514167	/nfs/dbraw/zinc/51/41/67/1440514167.db2.gz	YODHRHIVBQTADR-MNEFBYGVSA-N	0	3	348.462	3.258	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1CCC[C@H]1CNCc1csc(C2CC2)n1	ZINC001753883929	1440520819	/nfs/dbraw/zinc/52/08/19/1440520819.db2.gz	BYODOHOJXWPBGJ-DOTOQJQBSA-N	0	3	345.512	3.054	20	30		EGEDHN
C[C@H](CCNCc1cc(C#N)ccc1F)NC(=O)/C=C\C(C)(C)C	ZINC001753953475	1440525528	/nfs/dbraw/zinc/52/55/28/1440525528.db2.gz	NWYOOUYRRILMMX-IUCKJTJTSA-N	0	3	331.435	3.284	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)CCNCc2ccccc2C#N)CCC1	ZINC001753996816	1440529745	/nfs/dbraw/zinc/52/97/45/1440529745.db2.gz	NRYUNKLAYSXCEF-MRXNPFEDSA-N	0	3	325.456	3.289	20	30		EGEDHN
C=C(Cl)CNCC[C@@H](C)NC(=O)[C@H](C)Cc1cccc(F)c1	ZINC001754026876	1440533172	/nfs/dbraw/zinc/53/31/72/1440533172.db2.gz	NYXSEACAYYAQGB-TZMCWYRMSA-N	0	3	326.843	3.241	20	30		EGEDHN
C#CCC1(C(=O)N(CC)CCNCc2cccnc2C)CCCCC1	ZINC001754084142	1440539886	/nfs/dbraw/zinc/53/98/86/1440539886.db2.gz	XNSGMIBXLWOLCJ-UHFFFAOYSA-N	0	3	341.499	3.302	20	30		EGEDHN
N#Cc1ccc(CNC/C=C\CNC(=O)[C@@]23C[C@@H]2CCCC3)cc1F	ZINC001754169558	1440546864	/nfs/dbraw/zinc/54/68/64/1440546864.db2.gz	VCLYDHKGHGTNII-PPEMJRFFSA-N	0	3	341.430	3.040	20	30		EGEDHN
CC(C)[C@]1(C)C[C@H]1C(=O)NC/C=C\CNCc1cccc(C#N)c1	ZINC001754190183	1440548950	/nfs/dbraw/zinc/54/89/50/1440548950.db2.gz	BOEZAJBMQZVCKG-YOYZPVNRSA-N	0	3	325.456	3.002	20	30		EGEDHN
N#Cc1cccc(CNC/C=C\CNC(=O)[C@@H]2C[C@H]2c2ccccc2)c1	ZINC001754196849	1440549550	/nfs/dbraw/zinc/54/95/50/1440549550.db2.gz	KQIXUJAXJYZFGI-ZYNVHPMPSA-N	0	3	345.446	3.124	20	30		EGEDHN
CC[C@@H](Cc1ccccc1)C(=O)N[C@H](C)CNCC#Cc1ccccc1	ZINC001754243200	1440556324	/nfs/dbraw/zinc/55/63/24/1440556324.db2.gz	CVIZRUFFSPEAIK-KNQAVFIVSA-N	0	3	348.490	3.401	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H](C)CNCc1cc(Cl)cc2c1OCC2	ZINC001754278975	1440562663	/nfs/dbraw/zinc/56/26/63/1440562663.db2.gz	SJKUUUUXIOVWDO-LBPRGKRZSA-N	0	3	336.863	3.081	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)CNCc2ccc(Cl)nc2)CCCC1	ZINC001754297688	1440566735	/nfs/dbraw/zinc/56/67/35/1440566735.db2.gz	WSHCZGNZOQUQOW-AWEZNQCLSA-N	0	3	335.879	3.466	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H](C)CN(C)CCOc1ccccc1F	ZINC001754320452	1440577692	/nfs/dbraw/zinc/57/76/92/1440577692.db2.gz	WWMQZNJZACEOJH-OAHLLOKOSA-N	0	3	336.451	3.243	20	30		EGEDHN
C=C(Br)CNCCCN(C)C(=O)[C@H]1CCC(C)=C(C)C1	ZINC001754372633	1440592681	/nfs/dbraw/zinc/59/26/81/1440592681.db2.gz	CSDGMBWZSMYFCL-HNNXBMFYSA-N	0	3	343.309	3.470	20	30		EGEDHN
C=C(Cl)CNCCCN(C)C(=O)CCc1ccc(Cl)cc1	ZINC001754387291	1440593910	/nfs/dbraw/zinc/59/39/10/1440593910.db2.gz	HJDSPLFAVCQIGU-UHFFFAOYSA-N	0	3	329.271	3.463	20	30		EGEDHN
CCCCCCCN1CC[C@@H]1CNC(=O)C1CC2(C1)CCOCC2	ZINC001754500345	1440613913	/nfs/dbraw/zinc/61/39/13/1440613913.db2.gz	MVTFLZSXIDGFTR-GOSISDBHSA-N	0	3	336.520	3.354	20	30		EGEDHN
CC(C)(C)C#CC(=O)NCC1(NCc2ccc(F)c(Cl)c2)CC1	ZINC001754514238	1440618299	/nfs/dbraw/zinc/61/82/99/1440618299.db2.gz	VWRBDRYYBPNDQX-UHFFFAOYSA-N	0	3	336.838	3.267	20	30		EGEDHN
C[C@H]1CCC[C@@]1(C)C(=O)NCC1(NCc2ccc(C#N)c(F)c2)CC1	ZINC001754523949	1440620470	/nfs/dbraw/zinc/62/04/70/1440620470.db2.gz	NTMLOLHHCRBCNE-IFXJQAMLSA-N	0	3	343.446	3.262	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@]2(CCN(Cc3ccccn3)C2)C1	ZINC001754565072	1440635129	/nfs/dbraw/zinc/63/51/29/1440635129.db2.gz	GDSGTDILPJFTBI-NRFANRHFSA-N	0	3	339.483	3.090	20	30		EGEDHN
CC(C)(C)/C=C\C(=O)N1CCC[C@H]1CNCc1ccc(C#N)s1	ZINC001754607246	1440643366	/nfs/dbraw/zinc/64/33/66/1440643366.db2.gz	VYLQBYDHABURKA-CKXPSTMWSA-N	0	3	331.485	3.303	20	30		EGEDHN
C#CCN(C(=O)CC1CC(OCC)C1)C1CCN(CC=C(C)C)CC1	ZINC001754640319	1440649037	/nfs/dbraw/zinc/64/90/37/1440649037.db2.gz	NVCZFSBNUDBKDP-UHFFFAOYSA-N	0	3	346.515	3.084	20	30		EGEDHN
C[C@@H](C#N)C(=O)N[C@]1(C)CCN(Cc2ccc(C3CCC3)cc2)C1	ZINC001754668801	1440657210	/nfs/dbraw/zinc/65/72/10/1440657210.db2.gz	SHLKZXOOSMVNFK-MGPUTAFESA-N	0	3	325.456	3.194	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@](C)(CNCc3nccs3)C2)CC1	ZINC001754704630	1440668745	/nfs/dbraw/zinc/66/87/45/1440668745.db2.gz	MABIASUYUVGJOC-SFHVURJKSA-N	0	3	333.501	3.218	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC1(C)CCN(Cc2cnoc2C)CC1	ZINC001754720704	1440673139	/nfs/dbraw/zinc/67/31/39/1440673139.db2.gz	RYDSQVVBGOPJKR-UHFFFAOYSA-N	0	3	333.476	3.304	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@]1(C)CCCN(Cc2ncccc2C)C1	ZINC001754726666	1440676472	/nfs/dbraw/zinc/67/64/72/1440676472.db2.gz	FYKVVZBYQGORKE-HXUWFJFHSA-N	0	3	329.488	3.465	20	30		EGEDHN
CC#CCN1CCC[C@@](C)(CNC(=O)[C@@H](C)OC2CCCCCC2)C1	ZINC001754729930	1440678531	/nfs/dbraw/zinc/67/85/31/1440678531.db2.gz	ABIDDAZFEQZBLF-NQIIRXRSSA-N	0	3	348.531	3.356	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@@H](CNC(=O)C2(CC(C)C)CCC2)C1	ZINC001754743787	1440683928	/nfs/dbraw/zinc/68/39/28/1440683928.db2.gz	RUMBIQFDPOJWKC-INIZCTEOSA-N	0	3	340.458	3.300	20	30		EGEDHN
C=CCN[C@H](CNC(=O)[C@H](C)n1cccc1)c1ccccc1CC	ZINC001754786308	1440687939	/nfs/dbraw/zinc/68/79/39/1440687939.db2.gz	WUNGICVTRZBIDF-QFBILLFUSA-N	0	3	325.456	3.245	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H]2[C@H]1CCN2Cc1ccc(F)cc1	ZINC001754865238	1440702643	/nfs/dbraw/zinc/70/26/43/1440702643.db2.gz	IRYPGGKJLFUBEQ-RBUKOAKNSA-N	0	3	328.431	3.195	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H]1CCCN2C(=O)CCCCc1ccc(C)cc1	ZINC001754871578	1440705424	/nfs/dbraw/zinc/70/54/24/1440705424.db2.gz	KGWVPLDNRHJBNU-RTWAWAEBSA-N	0	3	338.495	3.406	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@H]2CN(Cc3ccc(OC)cc3)C[C@H]21	ZINC001754873429	1440706047	/nfs/dbraw/zinc/70/60/47/1440706047.db2.gz	JBOQHJBWMGRFKN-AZUAARDMSA-N	0	3	342.483	3.474	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC[C@H]2CN(Cc3ccc(OC)cc3)C[C@H]21	ZINC001754874207	1440706252	/nfs/dbraw/zinc/70/62/52/1440706252.db2.gz	OFXOCXIFPMLTQD-AZUAARDMSA-N	0	3	342.483	3.474	20	30		EGEDHN
CCCCCC(=O)N1CC[C@H](CCNCc2ccccc2C#N)C1	ZINC001754902416	1440707163	/nfs/dbraw/zinc/70/71/63/1440707163.db2.gz	JKTMCQGZKRJMQU-KRWDZBQOSA-N	0	3	327.472	3.467	20	30		EGEDHN
CC[C@@H](C)CC(=O)N1CC[C@H](CCNCc2cc(C#N)ccc2F)C1	ZINC001754913106	1440708375	/nfs/dbraw/zinc/70/83/75/1440708375.db2.gz	SEXZIXLBTLIFAE-CVEARBPZSA-N	0	3	345.462	3.462	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCN(C(=O)C2(C(F)F)CCCC2)C1	ZINC001754927733	1440710020	/nfs/dbraw/zinc/71/00/20/1440710020.db2.gz	GASOZFFPPXVDMJ-ZDUSSCGKSA-N	0	3	334.838	3.393	20	30		EGEDHN
C=CCN(C)Cc1ccccc1CNC(=O)c1cc(C(C)C)nn1C	ZINC001754952352	1440715266	/nfs/dbraw/zinc/71/52/66/1440715266.db2.gz	ACGMCFCCTOCUOY-UHFFFAOYSA-N	0	3	340.471	3.091	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1CC[C@H](CN[C@H](C)c2ncccn2)CC1	ZINC001754956481	1440716650	/nfs/dbraw/zinc/71/66/50/1440716650.db2.gz	SJBJSEIRFWZXSR-BRWVUGGUSA-N	0	3	344.503	3.405	20	30		EGEDHN
C[C@@H](CC(=O)N[C@H]1CCCN(Cc2cccc(C#N)c2)CC1)C1CC1	ZINC001755034804	1440733602	/nfs/dbraw/zinc/73/36/02/1440733602.db2.gz	ZKUNEFUALLNLAS-JXFKEZNVSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN(C)CCCN(C)C(=O)[C@H](CC)Cc1cccc(C)c1	ZINC001755045953	1440740689	/nfs/dbraw/zinc/74/06/89/1440740689.db2.gz	OMBNIBCWAGWBKN-HXUWFJFHSA-N	0	3	328.500	3.367	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC[C@@H]1Cc2ccccc2CN1CC(C)C	ZINC001755074437	1440748045	/nfs/dbraw/zinc/74/80/45/1440748045.db2.gz	ZBHFPUZAQYOVIS-XLIONFOSSA-N	0	3	344.499	3.167	20	30		EGEDHN
CCCCCC(=O)N1C[C@H](NCC#Cc2ccc(F)cc2)[C@@H](C)C1	ZINC001755103223	1440753664	/nfs/dbraw/zinc/75/36/64/1440753664.db2.gz	IPQQLTFLDSFVTG-LPHOPBHVSA-N	0	3	330.447	3.194	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)[C@H](CC)c2c(C)noc2C)C(C)(C)C1	ZINC001755142298	1440761358	/nfs/dbraw/zinc/76/13/58/1440761358.db2.gz	PYYYBBFJIRAWPK-SJORKVTESA-N	0	3	345.487	3.025	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)COc2cccc(CC)c2)C(C)(C)C1	ZINC001755143794	1440762253	/nfs/dbraw/zinc/76/22/53/1440762253.db2.gz	PTCVENHWLILWFJ-GOSISDBHSA-N	0	3	330.472	3.031	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC(O)(CN[C@H](C)c2ccccc2F)CC1	ZINC001755154500	1440763178	/nfs/dbraw/zinc/76/31/78/1440763178.db2.gz	QUZLDBMEMQSBQV-MRXNPFEDSA-N	0	3	348.462	3.186	20	30		EGEDHN
C=CCCCN1CCc2ccccc2[C@@H]1CNC(=O)c1cc(C)on1	ZINC001755172486	1440769542	/nfs/dbraw/zinc/76/95/42/1440769542.db2.gz	SAYCBCRHSBCNFM-IBGZPJMESA-N	0	3	339.439	3.278	20	30		EGEDHN
C#CCCN[C@@H]1c2ccccc2C[C@H]1NC(=O)CCc1ccsc1	ZINC001755186439	1440773317	/nfs/dbraw/zinc/77/33/17/1440773317.db2.gz	SVHJXZSFPJXIFN-UYAOXDASSA-N	0	3	338.476	3.076	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)C[C@H](C)C(F)(F)F	ZINC001755187105	1440773450	/nfs/dbraw/zinc/77/34/50/1440773450.db2.gz	VPJWBIGTRGRWTL-SGIREYDYSA-N	0	3	326.362	3.133	20	30		EGEDHN
C=CCN(C)C[C@@H]1CCCN1C(=O)C(C)(C)c1ccccc1OC	ZINC001755202345	1440780515	/nfs/dbraw/zinc/78/05/15/1440780515.db2.gz	DGMCJKGICISBHX-INIZCTEOSA-N	0	3	330.472	3.082	20	30		EGEDHN
CC(C)C(=O)N[C@@H](C)[C@H](C)NCC#Cc1ccc(C(F)(F)F)cc1	ZINC001755226876	1440786111	/nfs/dbraw/zinc/78/61/11/1440786111.db2.gz	QRXPHOMXTTZZRY-KBPBESRZSA-N	0	3	340.389	3.196	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)s1)[C@H](C)NC(=O)c1ccoc1Cl	ZINC001755235045	1440787984	/nfs/dbraw/zinc/78/79/84/1440787984.db2.gz	XQITXNTVDWORHD-UWVGGRQHSA-N	0	3	337.832	3.163	20	30		EGEDHN
CC(C)c1cccc(CN[C@@H](C)[C@H](C)NC(=O)C#CC(C)(C)C)n1	ZINC001755251597	1440791938	/nfs/dbraw/zinc/79/19/38/1440791938.db2.gz	FPFYWMZEDWRIGU-HOTGVXAUSA-N	0	3	329.488	3.237	20	30		EGEDHN
CCCc1ccc(CN(C)[C@H](C)CNC(=O)c2ccc(C#N)[nH]2)cc1	ZINC001755296898	1440806722	/nfs/dbraw/zinc/80/67/22/1440806722.db2.gz	RPQARDZQFKNFJT-OAHLLOKOSA-N	0	3	338.455	3.089	20	30		EGEDHN
CC(C(=O)NC[C@@H](C)N(C)Cc1ccc(OCC#N)cc1)=C1CCC1	ZINC001755299732	1440807995	/nfs/dbraw/zinc/80/79/95/1440807995.db2.gz	VTNXBXFPTCECIV-OAHLLOKOSA-N	0	3	341.455	3.026	20	30		EGEDHN
CCCc1[nH]ccc1C(=O)NC[C@H](C)N(C)Cc1cccc(C#N)c1	ZINC001755312515	1440814207	/nfs/dbraw/zinc/81/42/07/1440814207.db2.gz	GJDGDVPHCHMXBQ-HNNXBMFYSA-N	0	3	338.455	3.089	20	30		EGEDHN
C=CCC1(C(=O)NC[C@H](C)N(C)Cc2ccc3c(c2)COC3)CCC1	ZINC001755315541	1440815637	/nfs/dbraw/zinc/81/56/37/1440815637.db2.gz	RTUDYDOPJQLIMD-INIZCTEOSA-N	0	3	342.483	3.400	20	30		EGEDHN
CCCC[C@H](CNCC#Cc1ccccc1)NC(=O)c1ccc(C)nc1	ZINC001755356298	1440829736	/nfs/dbraw/zinc/82/97/36/1440829736.db2.gz	KAMAVAHVWBFDQB-OAQYLSRUSA-N	0	3	349.478	3.320	20	30		EGEDHN
CCc1cccc(CN2C[C@H](NC(=O)C#CC(C)C)C(C)(C)C2)c1	ZINC001755405916	1440844423	/nfs/dbraw/zinc/84/44/23/1440844423.db2.gz	ANLDQHQIRBAQMA-IBGZPJMESA-N	0	3	326.484	3.235	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CN(CCOCCCC)CC2(C)C)CC1	ZINC001755413517	1440847650	/nfs/dbraw/zinc/84/76/50/1440847650.db2.gz	FIMBHXJQQJWRRQ-SFHVURJKSA-N	0	3	336.520	3.376	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1C[C@H](CNCc2c(F)cccc2F)C1	ZINC001755469350	1440858638	/nfs/dbraw/zinc/85/86/38/1440858638.db2.gz	MFDRSXPGNPKSDV-SHTZXODSSA-N	0	3	334.410	3.143	20	30		EGEDHN
C=C(Br)CNC[C@H]1C[C@H](NC(=O)CC2(C)CCCC2)C1	ZINC001755470337	1440858753	/nfs/dbraw/zinc/85/87/53/1440858753.db2.gz	UIQQQEHNSCVXQE-HDJSIYSDSA-N	0	3	343.309	3.350	20	30		EGEDHN
C[C@H](CCCNCc1ccccc1C#N)NC(=O)CCC(F)(F)F	ZINC001755491933	1440861603	/nfs/dbraw/zinc/86/16/03/1440861603.db2.gz	VGDICLGKHKBDJA-CYBMUJFWSA-N	0	3	341.377	3.275	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](C)CCCNCc2ccc(C#N)cc2F)co1	ZINC001755495369	1440862012	/nfs/dbraw/zinc/86/20/12/1440862012.db2.gz	HMPSALFKFDNDEA-CYBMUJFWSA-N	0	3	343.402	3.287	20	30		EGEDHN
C=C(Cl)CNCCC[C@@H](C)NC(=O)c1cc2ccccc2c(=O)o1	ZINC001755502547	1440862784	/nfs/dbraw/zinc/86/27/84/1440862784.db2.gz	YSKAYCFLCAJJOX-CYBMUJFWSA-N	0	3	348.830	3.034	20	30		EGEDHN
CCC(C)(C)C(=O)N(C)[C@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001755566181	1440875801	/nfs/dbraw/zinc/87/58/01/1440875801.db2.gz	NVAMVJCODMAMFX-MRXNPFEDSA-N	0	3	333.501	3.383	20	30		EGEDHN
C[C@@H](CN(C)C(=O)[C@@H]1CCCC1(C)C)NCc1ccc(F)c(C#N)c1	ZINC001755601366	1440884201	/nfs/dbraw/zinc/88/42/01/1440884201.db2.gz	LKGRHNOKJBCSDZ-YOEHRIQHSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)[C@H]1C	ZINC001755657956	1440892330	/nfs/dbraw/zinc/89/23/30/1440892330.db2.gz	DOFJFUAVQHBYGG-RDTXWAMCSA-N	0	3	329.419	3.133	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](NCc2cc(Cl)cc3c2OCC3)C[C@@H]1C	ZINC001755671785	1440894013	/nfs/dbraw/zinc/89/40/13/1440894013.db2.gz	BWCIIPFBZLWDRS-GUYCJALGSA-N	0	3	348.874	3.320	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@H](NCc2cn(C(C)C)nc2C)C[C@@H]1C	ZINC001755673800	1440894328	/nfs/dbraw/zinc/89/43/28/1440894328.db2.gz	BQRCQPSYODLKGG-MAUKXSAKSA-N	0	3	332.492	3.208	20	30		EGEDHN
C[C@H]1C[C@@H](NCc2ccc(F)c(F)c2)CN1C(=O)C#CC(C)(C)C	ZINC001755679287	1440894991	/nfs/dbraw/zinc/89/49/91/1440894991.db2.gz	VICVVPXTINUSKB-DZGCQCFKSA-N	0	3	334.410	3.093	20	30		EGEDHN
C=CCN1CCC[C@@H](NC(=O)CCCOc2cccc(C)c2)[C@@H]1C	ZINC001755720646	1440907217	/nfs/dbraw/zinc/90/72/17/1440907217.db2.gz	IOMOZRSDCUPUDO-PKOBYXMFSA-N	0	3	330.472	3.309	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CC[C@H](CNCc2csc(C)n2)C1	ZINC001755725468	1440909297	/nfs/dbraw/zinc/90/92/97/1440909297.db2.gz	AIORXTSTCSWWDW-JKSUJKDBSA-N	0	3	333.501	3.020	20	30		EGEDHN
C=C(C)CN(C)CCN(C(=O)Cc1cc(C)ccc1OC)C(C)C	ZINC001755812458	1440921128	/nfs/dbraw/zinc/92/11/28/1440921128.db2.gz	QQIUGIGFEHVLGW-UHFFFAOYSA-N	0	3	332.488	3.291	20	30		EGEDHN
CC(C)(C)[C@@H](CNCC#Cc1ccc(F)cc1)NC(=O)C1CC=CC1	ZINC001755819908	1440925377	/nfs/dbraw/zinc/92/53/77/1440925377.db2.gz	JFAGGFLBJAVZLI-LJQANCHMSA-N	0	3	342.458	3.264	20	30		EGEDHN
C[C@@H](NC(=O)[C@H](C)C1CC1)C1CCN(Cc2cccc(C#N)c2)CC1	ZINC001755843203	1440932231	/nfs/dbraw/zinc/93/22/31/1440932231.db2.gz	XVSNBLPZRWLEKQ-HZPDHXFCSA-N	0	3	339.483	3.321	20	30		EGEDHN
C#CCN1CCC([C@@H](C)NC(=O)CC(C)(C)c2ccccc2)CC1	ZINC001755845271	1440933095	/nfs/dbraw/zinc/93/30/95/1440933095.db2.gz	DNTZQVBONABYRQ-QGZVFWFLSA-N	0	3	326.484	3.204	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N(C)C1CC(NCc2ccncc2Cl)C1	ZINC001755859637	1440936312	/nfs/dbraw/zinc/93/63/12/1440936312.db2.gz	ASFSEWSZDSOXPR-IUDNXUCKSA-N	0	3	335.879	3.416	20	30		EGEDHN
C=CCNCc1ccc(CNC(=O)c2cccn2C(C)C)c(F)c1	ZINC001755903086	1440944442	/nfs/dbraw/zinc/94/44/42/1440944442.db2.gz	ZDRQVYUBUKNYDQ-UHFFFAOYSA-N	0	3	329.419	3.414	20	30		EGEDHN
CN1CCN(CC2(C)CCN(c3ccc(Cl)cc3C#N)CC2)CC1	ZINC000368199814	168324341	/nfs/dbraw/zinc/32/43/41/168324341.db2.gz	JEWICDYPYICPEU-UHFFFAOYSA-N	0	3	346.906	3.066	20	30		EGEDHN
CCc1cnc(CNC2CCN(Cc3ccc(C#N)cc3)CC2)s1	ZINC000181834240	529652523	/nfs/dbraw/zinc/65/25/23/529652523.db2.gz	IZUPVDISQCGHQC-UHFFFAOYSA-N	0	3	340.496	3.331	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@]3(C2)CCCN(C(=O)c2ccco2)C3)cc1	ZINC000003956177	210096467	/nfs/dbraw/zinc/09/64/67/210096467.db2.gz	KJXPLRHAJDJIBT-NRFANRHFSA-N	0	3	349.434	3.280	20	30	aggregator	EGEDHN
C[C@H](NC(C)(C)CNC(=O)Cc1ccc(C#N)cc1)c1ccccc1	ZINC000068387387	215303508	/nfs/dbraw/zinc/30/35/08/215303508.db2.gz	ODWFVMXQKQCZHR-INIZCTEOSA-N	0	3	335.451	3.346	20	30		EGEDHN
C[C@H](N[C@H](CN1CCOCC1)c1ccccc1)c1cccc(C#N)c1	ZINC000181421379	234179871	/nfs/dbraw/zinc/17/98/71/234179871.db2.gz	OCVSPFXVWCZIOK-LAUBAEHRSA-N	0	3	335.451	3.282	20	30		EGEDHN
COC[C@@H](NC1CCN(Cc2ccc(C#N)cc2)CC1)c1ccco1	ZINC000181848858	234348774	/nfs/dbraw/zinc/34/87/74/234348774.db2.gz	NRELAKWNLOSZOF-LJQANCHMSA-N	0	3	339.439	3.093	20	30		EGEDHN
N#Cc1ccc([C@H](NC[C@@H]2CCCC[C@H]2C(F)(F)F)C(N)=O)cc1	ZINC000352271929	283187998	/nfs/dbraw/zinc/18/79/98/283187998.db2.gz	SVPVXLSIMPQIDW-ZNMIVQPWSA-N	0	3	339.361	3.043	20	30		EGEDHN
N#Cc1ccc(CNCCc2ccc(OCC(F)(F)F)nc2)s1	ZINC000187571916	236249654	/nfs/dbraw/zinc/24/96/54/236249654.db2.gz	LXOWXABRFDCUEK-UHFFFAOYSA-N	0	3	341.358	3.288	20	30		EGEDHN
C[C@H](NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1cccc(C#N)c1	ZINC000191831353	239323378	/nfs/dbraw/zinc/32/33/78/239323378.db2.gz	CNBWTRPQTZUAQT-PGRDOPGGSA-N	0	3	349.478	3.500	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)c2cccc(C#N)c2)CCN1Cc1ccccc1	ZINC000079554897	217241553	/nfs/dbraw/zinc/24/15/53/217241553.db2.gz	OPFOTULBIJBOER-JXFKEZNVSA-N	0	3	333.435	3.341	20	30		EGEDHN
C#CCOc1ccc(CN[C@H](C)c2ccc3c(c2)CCC(=O)N3)cc1	ZINC000264970622	247097376	/nfs/dbraw/zinc/09/73/76/247097376.db2.gz	QUYQKZBESRIBEH-OAHLLOKOSA-N	0	3	334.419	3.434	20	30		EGEDHN
C#CCOc1ccc(CN[C@@H](C)c2ccc3c(c2)CCC(=O)N3)cc1	ZINC000264970618	247097473	/nfs/dbraw/zinc/09/74/73/247097473.db2.gz	QUYQKZBESRIBEH-HNNXBMFYSA-N	0	3	334.419	3.434	20	30		EGEDHN
C#CCNC(=O)[C@H](C)N[C@@H](C)c1ccc(-c2ccccc2OC)cc1	ZINC000266435079	248298829	/nfs/dbraw/zinc/29/88/29/248298829.db2.gz	FDCSKBCKUWRQKX-HOTGVXAUSA-N	0	3	336.435	3.151	20	30		EGEDHN
C=CCN(CC=C)C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000267417875	251040182	/nfs/dbraw/zinc/04/01/82/251040182.db2.gz	PLHKYCNKFGWIIV-HKUYNNGSSA-N	0	3	327.472	3.281	20	30		EGEDHN
CCN(Cc1ccc(OC)c(OC)c1)C[C@@H](O)c1ccc(C#N)cc1	ZINC000268572212	252033657	/nfs/dbraw/zinc/03/36/57/252033657.db2.gz	AXEUUHCHNJMTSI-GOSISDBHSA-N	0	3	340.423	3.131	20	30		EGEDHN
Cn1nc(C(C)(C)C)cc1C(=O)C(C#N)c1nc2ccccc2n1C	ZINC000097466026	219026444	/nfs/dbraw/zinc/02/64/44/219026444.db2.gz	XXLVMBUQHYJQED-GFCCVEGCSA-N	0	3	335.411	3.094	20	30		EGEDHN
COC(=O)[C@H](C)Oc1ccc(CN(C)Cc2cccc(C#N)c2)cc1	ZINC000130785751	533207605	/nfs/dbraw/zinc/20/76/05/533207605.db2.gz	OMSINDXRPVZDLD-HNNXBMFYSA-N	0	3	338.407	3.131	20	30		EGEDHN
C[C@@H](N[C@@H]1CCCN(c2ccc(C#N)cc2F)C1)c1cncs1	ZINC000160150380	533521302	/nfs/dbraw/zinc/52/13/02/533521302.db2.gz	WIYLRHYATNKFAS-TZMCWYRMSA-N	0	3	330.432	3.473	20	30		EGEDHN
C[C@@H](N[C@@H]1CCCN(C(=O)Cc2ccccc2)C1)c1ccc(C#N)cc1	ZINC000338032454	141076957	/nfs/dbraw/zinc/07/69/57/141076957.db2.gz	VXOBJCFVJFZGNZ-DYESRHJHSA-N	0	3	347.462	3.443	20	30		EGEDHN
COCC[C@H](NCC(=O)Nc1sc(C)c(C)c1C#N)C(C)(C)C	ZINC000338366462	141109140	/nfs/dbraw/zinc/10/91/40/141109140.db2.gz	XPPYGTXCTCGGAU-AWEZNQCLSA-N	0	3	337.489	3.216	20	30		EGEDHN
COc1cc(CN(C)CCOc2ccc(C#N)cc2)cc(OC)c1	ZINC000353465577	141302673	/nfs/dbraw/zinc/30/26/73/141302673.db2.gz	YAFKGUAGOZOAFH-UHFFFAOYSA-N	0	3	326.396	3.086	20	30		EGEDHN
C[C@@H](NC(=O)C1(c2cccc(C#N)c2)CC1)[C@@H](c1ccccc1)N(C)C	ZINC000356233337	141324482	/nfs/dbraw/zinc/32/44/82/141324482.db2.gz	PTSIMJRFXSOKHD-UZLBHIALSA-N	0	3	347.462	3.397	20	30		EGEDHN
CN(C)c1ccccc1CN1CCCN(c2ccccc2C#N)CC1	ZINC000173524361	144043922	/nfs/dbraw/zinc/04/39/22/144043922.db2.gz	KWGZPEHIJQDIQH-UHFFFAOYSA-N	0	3	334.467	3.337	20	30		EGEDHN
CC(C)[C@@]1(C)C[C@@H]1C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000185607651	144116044	/nfs/dbraw/zinc/11/60/44/144116044.db2.gz	KCGTXYXQFWAGPX-UYAOXDASSA-N	0	3	327.472	3.131	20	30		EGEDHN
N#Cc1cccc(OCCCN2CC[C@]3(C2)OCc2ccccc23)c1	ZINC000186693455	144141293	/nfs/dbraw/zinc/14/12/93/144141293.db2.gz	CYGIAZYXUHVTSY-OAQYLSRUSA-N	0	3	334.419	3.459	20	30		EGEDHN
COc1ccc([C@@H](C)NCCOc2ccc(C#N)cc2OC)cc1	ZINC000341209648	155208439	/nfs/dbraw/zinc/20/84/39/155208439.db2.gz	MPFPMWVIPAKKDU-CQSZACIVSA-N	0	3	326.396	3.305	20	30		EGEDHN
CC(C)CO[C@@H]1CCN(CCC(=O)Nc2ccc(C#N)c(Cl)c2)C1	ZINC000120052302	152247032	/nfs/dbraw/zinc/24/70/32/152247032.db2.gz	QQFVWTUKUFFZFY-MRXNPFEDSA-N	0	3	349.862	3.287	20	30		EGEDHN
CCCCNC(=O)[C@@H]1CC[C@@H](C)N(Cc2ccc(C#N)cc2OC)C1	ZINC000120710955	152295547	/nfs/dbraw/zinc/29/55/47/152295547.db2.gz	HSQIUZQYLHGHEE-CRAIPNDOSA-N	0	3	343.471	3.084	20	30		EGEDHN
C[C@H]1CC[C@@H](CC(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)C1	ZINC000122102291	152389931	/nfs/dbraw/zinc/38/99/31/152389931.db2.gz	JVVHYAVPRYKTGT-QFBILLFUSA-N	0	3	327.472	3.275	20	30		EGEDHN
Cn1cc(CN[C@@H]2CCN(C)[C@@H]2c2ccc(Cl)c(F)c2)cc1C#N	ZINC000191484739	153200093	/nfs/dbraw/zinc/20/00/93/153200093.db2.gz	KMZMHCLXSFZJQK-QZTJIDSGSA-N	0	3	346.837	3.224	20	30		EGEDHN
N#Cc1ccccc1COc1cccc(CN2CCC[C@@H](O)CC2)c1	ZINC000354750922	166022595	/nfs/dbraw/zinc/02/25/95/166022595.db2.gz	WJXJKERNBXMFJA-HXUWFJFHSA-N	0	3	336.435	3.484	20	30		EGEDHN
C[C@H](CN(C)C)NC(=O)c1ccccc1Sc1ccccc1C#N	ZINC000346170355	164355394	/nfs/dbraw/zinc/35/53/94/164355394.db2.gz	VSUQBRGYMRYPBT-CQSZACIVSA-N	0	3	339.464	3.389	20	30		EGEDHN
CC[C@H](C)N[C@H](CNC(=O)NCc1cccc(C#N)c1)c1ccco1	ZINC000350394919	165040343	/nfs/dbraw/zinc/04/03/43/165040343.db2.gz	BNUZMPYTROUAMM-WMLDXEAASA-N	0	3	340.427	3.080	20	30		EGEDHN
CN(C)CCOc1cccc(NC(=O)c2cc(C#N)ccc2Cl)c1	ZINC000351965355	165171406	/nfs/dbraw/zinc/17/14/06/165171406.db2.gz	SEHVNVBRMZUPCH-UHFFFAOYSA-N	0	3	343.814	3.404	20	30		EGEDHN
C[C@@H]1[C@@H](NC(=O)Nc2ccc(C#N)cc2)CCN1Cc1ccccc1	ZINC000359021704	167040929	/nfs/dbraw/zinc/04/09/29/167040929.db2.gz	UFCOVUHVKMPQNS-BEFAXECRSA-N	0	3	334.423	3.343	20	30		EGEDHN
Cc1nc(NC[C@H](Cc2ccccc2)N(C)C)c(Cl)cc1C#N	ZINC000359847534	167247267	/nfs/dbraw/zinc/24/72/67/167247267.db2.gz	XAPWYEWAMXFHRE-INIZCTEOSA-N	0	3	328.847	3.500	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H]1CCN(C(=O)c2ccc(F)c(C#N)c2)C1	ZINC000367602431	168247851	/nfs/dbraw/zinc/24/78/51/168247851.db2.gz	SUXKDNOPEIDUJB-GOSISDBHSA-N	0	3	337.398	3.044	20	30		EGEDHN
CCN1CCN(Cc2ccc(NCc3ccc(C#N)cc3)cc2)CC1	ZINC000122489384	222099675	/nfs/dbraw/zinc/09/96/75/222099675.db2.gz	TUYYUNCABNPQQW-UHFFFAOYSA-N	0	3	334.467	3.308	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)s1)c1cccc(N2CCOCC2)c1	ZINC000421877458	269843483	/nfs/dbraw/zinc/84/34/83/269843483.db2.gz	KSEQVWORRZBBEK-CQSZACIVSA-N	0	3	327.453	3.307	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@@H](NC/C=C/c3ccc(F)cc3)C2=O)cc1	ZINC000503915389	269964835	/nfs/dbraw/zinc/96/48/35/269964835.db2.gz	WCZYIOPKQLMVQN-JHLGBQPCSA-N	0	3	349.409	3.496	20	30		EGEDHN
COc1ccc(CN2CCCN(c3ccc(F)cc3C#N)CC2)cc1	ZINC000301211475	270043661	/nfs/dbraw/zinc/04/36/61/270043661.db2.gz	VLNZPLZSURJMIC-UHFFFAOYSA-N	0	3	339.414	3.418	20	30		EGEDHN
N#Cc1ccc(OC2CCN(CCOCC3CCC3)CC2)c(F)c1	ZINC000419271534	270048344	/nfs/dbraw/zinc/04/83/44/270048344.db2.gz	FOZPGLUZJJXIJE-UHFFFAOYSA-N	0	3	332.419	3.357	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@@H](NCCNC(=O)CCCc1ccccc1)CC2	ZINC000424327015	270049148	/nfs/dbraw/zinc/04/91/48/270049148.db2.gz	NXEMNGJYJFFRDO-NRFANRHFSA-N	0	3	347.462	3.274	20	30		EGEDHN
C[C@H](N[C@@H]1CCO[C@@H]1C1CC1)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000330254295	270045336	/nfs/dbraw/zinc/04/53/36/270045336.db2.gz	JIPQARLQEWLPJK-DRZCJDIDSA-N	0	3	345.468	3.242	20	30		EGEDHN
Cc1ccc(C#N)cc1NC(=O)NC[C@H]1CCN1C1CCCCC1	ZINC000528949181	270060066	/nfs/dbraw/zinc/06/00/66/270060066.db2.gz	RXDKXMGSMJQAHA-QGZVFWFLSA-N	0	3	326.444	3.395	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CN(C1CC1)[C@@H]1CCc2ccccc21	ZINC000528410323	270060193	/nfs/dbraw/zinc/06/01/93/270060193.db2.gz	LBBOZNDEQMQIEK-PZJWPPBQSA-N	0	3	348.446	3.450	20	30		EGEDHN
CCC(CC)[C@H](CCNC(=O)C(C#N)Cc1ccc(C#N)cc1)OC	ZINC000348354567	266005557	/nfs/dbraw/zinc/00/55/57/266005557.db2.gz	YQFBJVHFKACWSO-MOPGFXCFSA-N	0	3	341.455	3.198	20	30		EGEDHN
CCS[C@@H]1CCC[C@@H]1NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000280499901	266345794	/nfs/dbraw/zinc/34/57/94/266345794.db2.gz	QTPTXUSJJMDNTJ-IXDOHACOSA-N	0	3	327.453	3.031	20	30		EGEDHN
CCS[C@@H]1CCC[C@H]1NCC(=O)Nc1cc(Cl)ccc1C#N	ZINC000286377494	266346733	/nfs/dbraw/zinc/34/67/33/266346733.db2.gz	YYGLWRIXLYJPKK-UKRRQHHQSA-N	0	3	337.876	3.414	20	30		EGEDHN
CCN(C)C(=O)[C@@H](N[C@H]1CCCCc2cc(C#N)ccc21)C(C)C	ZINC000453289534	267050767	/nfs/dbraw/zinc/05/07/67/267050767.db2.gz	SDZFUBYUXNULMK-OALUTQOASA-N	0	3	327.472	3.418	20	30		EGEDHN
CCO[C@@H]1CCC[C@H]1N[C@@H](C)C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000452017185	267146628	/nfs/dbraw/zinc/14/66/28/267146628.db2.gz	OJRISABIJKLOOR-IUIKQTSFSA-N	0	3	335.835	3.086	20	30		EGEDHN
C[C@H](CCc1ccco1)N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000272534750	267153005	/nfs/dbraw/zinc/15/30/05/267153005.db2.gz	JUJHXBIRBCDNOC-BEFAXECRSA-N	0	3	337.423	3.258	20	30		EGEDHN
C[C@H](NC(=O)NCc1ccc(C#N)cc1)[C@H](c1ccccc1)N(C)C	ZINC000287294048	267174558	/nfs/dbraw/zinc/17/45/58/267174558.db2.gz	ZUJOHVPZDGSWLZ-HNAYVOBHSA-N	0	3	336.439	3.049	20	30		EGEDHN
C[C@H](NCCOc1cccc(C#N)c1)c1ccc([S@](C)=O)cc1	ZINC000271764902	267183596	/nfs/dbraw/zinc/18/35/96/267183596.db2.gz	CZRBVOJWINPGQU-PSLXWICFSA-N	0	3	328.437	3.025	20	30		EGEDHN
CC[C@H](Cc1ccccc1)N(C)CC(=O)NCc1cccc(C#N)c1	ZINC000525126825	267215127	/nfs/dbraw/zinc/21/51/27/267215127.db2.gz	QYSOKOYTYOHOTB-HXUWFJFHSA-N	0	3	335.451	3.128	20	30		EGEDHN
CN(C)C[C@@H](NC(=O)/C=C\c1ccc(C#N)cc1)c1ccc(F)cc1	ZINC000493379545	267282957	/nfs/dbraw/zinc/28/29/57/267282957.db2.gz	FLJDYNYEHNMGBK-XCJXAGMVSA-N	0	3	337.398	3.130	20	30		EGEDHN
CN(CCC(=O)Nc1cccc(C#N)c1)Cc1cc(F)cc(F)c1	ZINC000444697363	267303526	/nfs/dbraw/zinc/30/35/26/267303526.db2.gz	XVLBVBVPPVYCMQ-UHFFFAOYSA-N	0	3	329.350	3.297	20	30		EGEDHN
Cc1ccccc1[C@@H](NCC(=O)NCc1ccc(C#N)cc1)C1CC1	ZINC000272000294	267503630	/nfs/dbraw/zinc/50/36/30/267503630.db2.gz	IDZWHDZMGGNVIS-NRFANRHFSA-N	0	3	333.435	3.224	20	30		EGEDHN
C[C@@H](c1ccc(C#N)cc1F)N1CCC[C@H](CC(C)(C)C(N)=O)C1	ZINC000453271976	267720777	/nfs/dbraw/zinc/72/07/77/267720777.db2.gz	DJTUSDBIBQHSAO-DZGCQCFKSA-N	0	3	331.435	3.372	20	30		EGEDHN
Cc1cc(CNc2ccccc2CN2CCC(O)CC2)ccc1C#N	ZINC000443987718	268001624	/nfs/dbraw/zinc/00/16/24/268001624.db2.gz	KXRRVFKKZHFBST-UHFFFAOYSA-N	0	3	335.451	3.436	20	30		EGEDHN
N#Cc1cc(NC(=O)C2CCN(C3CC3)CC2)ccc1Br	ZINC000297627759	268005241	/nfs/dbraw/zinc/00/52/41/268005241.db2.gz	ANEXVLLSQOQBQI-UHFFFAOYSA-N	0	3	348.244	3.134	20	30		EGEDHN
Cc1cc(NCc2ccc(OC3CCN(C)CC3)cc2)cc(C#N)n1	ZINC000516934460	268012335	/nfs/dbraw/zinc/01/23/35/268012335.db2.gz	XFZNQJWOJMSWIJ-UHFFFAOYSA-N	0	3	336.439	3.347	20	30		EGEDHN
Cc1cccc(C2=CCN(C[C@@H](O)COc3ccccc3C#N)CC2)c1	ZINC000528428936	268050793	/nfs/dbraw/zinc/05/07/93/268050793.db2.gz	DAGIOYPDQUVNJF-OAQYLSRUSA-N	0	3	348.446	3.396	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CC[C@H](Cc3ccccc3)C2)cc1	ZINC000280517782	268084167	/nfs/dbraw/zinc/08/41/67/268084167.db2.gz	RPRQFOMJWFGDRZ-RTWAWAEBSA-N	0	3	343.430	3.332	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCC2(c3ccc(F)cc3)CC2)cc1	ZINC000279244845	268085195	/nfs/dbraw/zinc/08/51/95/268085195.db2.gz	GKHIZLCOKSTNBT-KRWDZBQOSA-N	0	3	347.393	3.228	20	30		EGEDHN
N#Cc1ccc(NC(=O)CN[C@H]2CCCC23CCOCC3)cc1Cl	ZINC000282111967	268140598	/nfs/dbraw/zinc/14/05/98/268140598.db2.gz	QALIKPMLVKROLI-INIZCTEOSA-N	0	3	347.846	3.089	20	30		EGEDHN
N#Cc1cc(NC(=O)NC[C@@H]2CCN2C2CCCCC2)ccc1F	ZINC000528965288	268187991	/nfs/dbraw/zinc/18/79/91/268187991.db2.gz	XNZYVIIYYSQYNC-INIZCTEOSA-N	0	3	330.407	3.226	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H]2[C@H]2CCC[C@H]2O)c(OC(F)F)c1	ZINC000451426481	268218744	/nfs/dbraw/zinc/21/87/44/268218744.db2.gz	VAYOGWRFDBVPGI-BZUAXINKSA-N	0	3	336.382	3.285	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)c(Br)c1	ZINC000451415651	268219232	/nfs/dbraw/zinc/21/92/32/268219232.db2.gz	FOJQMLYXVYUCPW-UAGQMJEPSA-N	0	3	349.272	3.446	20	30		EGEDHN
N#Cc1cccc(OCCN[C@H](CCO)c2ccc(Cl)cc2)c1	ZINC000287019824	268274299	/nfs/dbraw/zinc/27/42/99/268274299.db2.gz	RGUKHFKKEIWMGG-GOSISDBHSA-N	0	3	330.815	3.304	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN1CCC(C(F)(F)F)CC1	ZINC000330932829	268307587	/nfs/dbraw/zinc/30/75/87/268307587.db2.gz	YZIKOAPRCAUYRY-UHFFFAOYSA-N	0	3	331.363	3.223	20	30		EGEDHN
N#Cc1cnc(N2C[C@H]3CCN(Cc4ccccc4)C[C@H]3C2)c(F)c1	ZINC000413295342	268313056	/nfs/dbraw/zinc/31/30/56/268313056.db2.gz	DLGWTSKSKQPBPE-MSOLQXFVSA-N	0	3	336.414	3.051	20	30		EGEDHN
N#Cc1ccc(Cl)c(C(=O)N2CCC[C@H]2CN2CCCCC2)c1	ZINC000285345599	275866704	/nfs/dbraw/zinc/86/67/04/275866704.db2.gz	PEWLAGPHJKDKGG-HNNXBMFYSA-N	0	3	331.847	3.302	20	30		EGEDHN
CC(C)(CO)[C@H](NC[C@@H](O)c1ccc(C#N)cc1)c1cccs1	ZINC000289782823	276393599	/nfs/dbraw/zinc/39/35/99/276393599.db2.gz	MSYMSZMJODCUFG-NVXWUHKLSA-N	0	3	330.453	3.003	20	30		EGEDHN
O=C(NCCn1ccnc1)N1CCCC[C@@H]1c1ccc(F)cc1F	ZINC000328588536	295377893	/nfs/dbraw/zinc/37/78/93/295377893.db2.gz	SBNLSTYDAVMKTJ-MRXNPFEDSA-N	0	3	334.370	3.303	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC000063626338	307355331	/nfs/dbraw/zinc/35/53/31/307355331.db2.gz	NNCRYOQFSPSIKI-KRWDZBQOSA-N	0	3	329.444	3.295	20	30		EGEDHN
CN(C)CCN(C(=O)c1ccc(C#N)c(Cl)c1)c1ccccc1	ZINC000155589218	307816850	/nfs/dbraw/zinc/81/68/50/307816850.db2.gz	VWUQQTMTVKYWIC-UHFFFAOYSA-N	0	3	327.815	3.420	20	30		EGEDHN
COc1ccc(OC)c(CCCNCc2ccc(C#N)cc2F)c1	ZINC000535368786	314043442	/nfs/dbraw/zinc/04/34/42/314043442.db2.gz	IACXNOKMDVYPAI-UHFFFAOYSA-N	0	3	328.387	3.437	20	30		EGEDHN
C[C@@H](CCc1ccccc1)CN1CCN(c2nccnc2C#N)C[C@@H]1C	ZINC000539408555	314312010	/nfs/dbraw/zinc/31/20/10/314312010.db2.gz	YKVQOFNAJURTHO-ROUUACIJSA-N	0	3	349.482	3.128	20	30		EGEDHN
CCSCC[C@H](C)N(C)CC(=O)N(C)C1(C#N)CCCCC1	ZINC000072900364	454361650	/nfs/dbraw/zinc/36/16/50/454361650.db2.gz	OQMSMUXDRHKLTJ-HNNXBMFYSA-N	0	3	325.522	3.135	20	30		EGEDHN
C[C@@H]1CSC[C@H]1NCC(=O)Nc1sc2c(c1C#N)CCCCC2	ZINC000552006362	315187409	/nfs/dbraw/zinc/18/74/09/315187409.db2.gz	LLKZEDYGHPOUKD-BXUZGUMPSA-N	0	3	349.525	3.168	20	30		EGEDHN
C[C@@]1(NC(=O)NCc2cccc(C#N)c2)CCN(Cc2ccccc2)C1	ZINC000563814338	316073845	/nfs/dbraw/zinc/07/38/45/316073845.db2.gz	RGBCNWKZEWPUMT-OAQYLSRUSA-N	0	3	348.450	3.022	20	30		EGEDHN
COc1ccc(CN(C)C)cc1NC(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1	ZINC000564784102	316204378	/nfs/dbraw/zinc/20/43/78/316204378.db2.gz	SJHAELYEBPWOKN-ZWKOTPCHSA-N	0	3	349.434	3.371	20	30		EGEDHN
C[C@@H]1CN(Cc2cnc3c(C#N)cnn3c2)CC[C@H]1c1ccccc1	ZINC000564989632	316242928	/nfs/dbraw/zinc/24/29/28/316242928.db2.gz	VHEJTZMEJSPTAM-DNVCBOLYSA-N	0	3	331.423	3.227	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(Cl)c(Cl)cc2OC)CC1	ZINC000176522778	454755145	/nfs/dbraw/zinc/75/51/45/454755145.db2.gz	MWEBKCXGPPPKFR-UHFFFAOYSA-N	0	3	343.254	3.382	20	30		EGEDHN
N#Cc1ccc([C@H](NC[C@H]2CCC[C@H]2c2ccccc2)C(N)=O)cc1	ZINC000569094567	316865119	/nfs/dbraw/zinc/86/51/19/316865119.db2.gz	WBZOAHHWKQFDCE-AABGKKOBSA-N	0	3	333.435	3.258	20	30		EGEDHN
C[C@@H]1C[C@@H](C(C)(C)C)CCN1CC(=O)NCc1ccc(C#N)cc1	ZINC000570072176	317004273	/nfs/dbraw/zinc/00/42/73/317004273.db2.gz	QHICJOSIMVUYLK-QAPCUYQASA-N	0	3	327.472	3.321	20	30		EGEDHN
CC(C)(C)c1ccc(OC[C@@H](O)CNCc2ccc(C#N)cc2)cc1	ZINC000571908749	317264985	/nfs/dbraw/zinc/26/49/85/317264985.db2.gz	BZEBESHMOXXZJZ-IBGZPJMESA-N	0	3	338.451	3.385	20	30		EGEDHN
COc1ccc([C@H](NCc2cnc3c(C#N)cnn3c2)C(C)C)cc1	ZINC000571983035	317274546	/nfs/dbraw/zinc/27/45/46/317274546.db2.gz	LQSDZHWGCMZXBF-GOSISDBHSA-N	0	3	335.411	3.096	20	30		EGEDHN
CCN1CC[C@H]2CC[C@@H](C1)N2Cc1cc(C#N)ccc1Br	ZINC000191806378	455521879	/nfs/dbraw/zinc/52/18/79/455521879.db2.gz	VETYMNLIWDVAGI-CVEARBPZSA-N	0	3	348.288	3.379	20	30		EGEDHN
C#CC(C)(C)N(C)CCC(=O)Nc1cc(OC)c(Cl)cc1OC	ZINC000298633880	456505691	/nfs/dbraw/zinc/50/56/91/456505691.db2.gz	WCJZZSXBPAQEQY-UHFFFAOYSA-N	0	3	338.835	3.029	20	30		EGEDHN
CN(Cc1ccccc1)C1(CNC(=O)c2ccc(C#N)cc2)CCC1	ZINC000386654883	324268882	/nfs/dbraw/zinc/26/88/82/324268882.db2.gz	LECIOILXIBQYSG-UHFFFAOYSA-N	0	3	333.435	3.343	20	30		EGEDHN
N#CCC1(CNCc2cccc(I)c2)CC1	ZINC000309597071	456576096	/nfs/dbraw/zinc/57/60/96/456576096.db2.gz	UXZXPNGIRZZRCH-UHFFFAOYSA-N	0	3	326.181	3.075	20	30		EGEDHN
N#Cc1cc(N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)ncn1	ZINC000580688865	325283223	/nfs/dbraw/zinc/28/32/23/325283223.db2.gz	BLJPSJNPNXGFKY-CQSZACIVSA-N	0	3	347.344	3.053	20	30		EGEDHN
C=CCN(C)CCN(CC)[C@@H](C)C(=O)Nc1cc(Cl)ccc1F	ZINC000411647367	457938799	/nfs/dbraw/zinc/93/87/99/457938799.db2.gz	XUZNSVPAZJSKHQ-ZDUSSCGKSA-N	0	3	341.858	3.246	20	30		EGEDHN
CCC[C@@H](C)NC(=O)[C@@H]1CCCN(Cc2ccc(OCC#N)cc2)C1	ZINC000264520536	455228959	/nfs/dbraw/zinc/22/89/59/455228959.db2.gz	ABKHCONBMJBJMM-SJLPKXTDSA-N	0	3	343.471	3.106	20	30		EGEDHN
C[C@@H](CNC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)N(C)C	ZINC000264523487	455229022	/nfs/dbraw/zinc/22/90/22/455229022.db2.gz	DWYLNDKCYJODFO-AWEZNQCLSA-N	0	3	338.411	3.422	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(-c3cnco3)cc2)CC1	ZINC000264527091	455230516	/nfs/dbraw/zinc/23/05/16/455230516.db2.gz	YWXMEJNNPPDIMZ-UHFFFAOYSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2nc(C(C)C)ncc2Cl)CC1	ZINC000264529926	455231437	/nfs/dbraw/zinc/23/14/37/455231437.db2.gz	ZXGJHFVAIPHTFB-UHFFFAOYSA-N	0	3	336.867	3.024	20	30		EGEDHN
CC(C)CN(CCN(C)C)C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000455704771	458607981	/nfs/dbraw/zinc/60/79/81/458607981.db2.gz	OBPVIORUOIYPGB-UHFFFAOYSA-N	0	3	336.867	3.458	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](C)Cc2cc(C)cc(C)c2)CC1	ZINC000173196883	455245845	/nfs/dbraw/zinc/24/58/45/455245845.db2.gz	MAHSFHODWKLKLJ-QGZVFWFLSA-N	0	3	329.488	3.184	20	30		EGEDHN
C[C@@H](N[C@H](C)c1ccc(-c2ccncc2)cc1)C(=O)N(C)CCC#N	ZINC000180911030	455263028	/nfs/dbraw/zinc/26/30/28/455263028.db2.gz	SFASHXQNLUCECB-HZPDHXFCSA-N	0	3	336.439	3.160	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN(C)[C@H](C)c1cccc(O)c1	ZINC000158075830	455266007	/nfs/dbraw/zinc/26/60/07/455266007.db2.gz	OWIAACOOJWQKRH-CQSZACIVSA-N	0	3	326.396	3.344	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN(C)[C@@H](C)c1cccc(O)c1	ZINC000158075676	455266584	/nfs/dbraw/zinc/26/65/84/455266584.db2.gz	OWIAACOOJWQKRH-AWEZNQCLSA-N	0	3	326.396	3.344	20	30		EGEDHN
CCS(=O)(=O)CCCCCN(Cc1ccc(C#N)cc1)C(C)C	ZINC000190473413	455327298	/nfs/dbraw/zinc/32/72/98/455327298.db2.gz	OKYKPVJGWLGPGD-UHFFFAOYSA-N	0	3	336.501	3.374	20	30		EGEDHN
CNC(=O)C1CCN(Cc2ccc(-c3ccccc3C#N)cc2)CC1	ZINC000024992094	453754053	/nfs/dbraw/zinc/75/40/53/453754053.db2.gz	TZIXVLHXOBGYBE-UHFFFAOYSA-N	0	3	333.435	3.183	20	30		EGEDHN
C[C@H](NC[C@@H](O)COc1ccc(CC#N)cc1)c1ccc(Cl)cc1	ZINC000025867550	453788039	/nfs/dbraw/zinc/78/80/39/453788039.db2.gz	AMFBRMZMAJNPHG-KBXCAEBGSA-N	0	3	344.842	3.497	20	30		EGEDHN
C[C@@H](NC[C@H](O)COCc1ccc(Cl)cc1)c1ccc(C#N)cc1	ZINC000030532589	453836335	/nfs/dbraw/zinc/83/63/35/453836335.db2.gz	SYAWUWXSQXLIDF-KUHUBIRLSA-N	0	3	344.842	3.440	20	30		EGEDHN
C[C@@H](NC(=O)NCc1ccc(CN(C)C)cc1)c1ccc(C#N)cc1	ZINC000031105944	453838786	/nfs/dbraw/zinc/83/87/86/453838786.db2.gz	WGNXNHYFICDCGO-OAHLLOKOSA-N	0	3	336.439	3.180	20	30		EGEDHN
CN(C)CCN(C(=O)CSCc1ccc(C#N)cc1)C1CCCC1	ZINC000053153035	453862453	/nfs/dbraw/zinc/86/24/53/453862453.db2.gz	RCNMZHSGBKTHLB-UHFFFAOYSA-N	0	3	345.512	3.124	20	30		EGEDHN
CC(C)[C@H](NCCS(=O)(=O)c1ccc(C#N)cc1)c1ccccc1	ZINC000081512372	453880342	/nfs/dbraw/zinc/88/03/42/453880342.db2.gz	QCQWKDIOUGSMNJ-IBGZPJMESA-N	0	3	342.464	3.319	20	30		EGEDHN
C#CCN1CCC(C(=O)NCC(C)(C)c2ccc(Cl)cc2)CC1	ZINC000066921529	453885993	/nfs/dbraw/zinc/88/59/93/453885993.db2.gz	UVVFLSFKRHMMHW-UHFFFAOYSA-N	0	3	332.875	3.079	20	30		EGEDHN
Cc1ccc([C@@H](CNCc2cccc(C#N)c2)N2CCOCC2)s1	ZINC000075603929	453909997	/nfs/dbraw/zinc/90/99/97/453909997.db2.gz	VTPXRPRTMJIYQN-GOSISDBHSA-N	0	3	341.480	3.091	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cc(Cl)ccc2OCCC)CC1	ZINC000067207117	453911020	/nfs/dbraw/zinc/91/10/20/453911020.db2.gz	FAEDWZDPQABXGR-UHFFFAOYSA-N	0	3	334.847	3.413	20	30		EGEDHN
O=C(NCC#Cc1ccccc1)N[C@@H](CN1CCCC1)c1ccccc1	ZINC000075690766	453919472	/nfs/dbraw/zinc/91/94/72/453919472.db2.gz	ANILWPDMZCPWOG-NRFANRHFSA-N	0	3	347.462	3.174	20	30		EGEDHN
N#CCc1ccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000076085119	453960774	/nfs/dbraw/zinc/96/07/74/453960774.db2.gz	KLEUCSLOYRMZLU-IBGZPJMESA-N	0	3	334.423	3.149	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)c2cccc(Nc3ncccn3)c2)n1	ZINC000041516060	453969987	/nfs/dbraw/zinc/96/99/87/453969987.db2.gz	GQHLYRVKOAKLJU-CQSZACIVSA-N	0	3	335.392	3.475	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@H](C)CN2CCC[C@@H](C)C2)cc1OC	ZINC000055405153	453982404	/nfs/dbraw/zinc/98/24/04/453982404.db2.gz	XNJFBFGAONKYIH-HZPDHXFCSA-N	0	3	346.471	3.110	20	30		EGEDHN
C[C@H](NC(=O)NCC(C)(C)N1CCCCC1)c1ccc(C#N)cc1	ZINC000042317656	454005800	/nfs/dbraw/zinc/00/58/00/454005800.db2.gz	VCKYZPBVUGKSES-HNNXBMFYSA-N	0	3	328.460	3.183	20	30		EGEDHN
N#Cc1nnc2ccccc2c1N1CCCN(Cc2ccccc2)CC1	ZINC000077188135	454072451	/nfs/dbraw/zinc/07/24/51/454072451.db2.gz	GTOICCACRGGNLP-UHFFFAOYSA-N	0	3	343.434	3.214	20	30		EGEDHN
C=CCOc1cccc(NC(=O)N2CCN(c3ccncc3)CC2)c1	ZINC000056772266	454079187	/nfs/dbraw/zinc/07/91/87/454079187.db2.gz	STQUSFYMVWWNSK-UHFFFAOYSA-N	0	3	338.411	3.001	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1CC[C@H](Nc2ccccc2)C1	ZINC000077277183	454084393	/nfs/dbraw/zinc/08/43/93/454084393.db2.gz	HGFFBDDSCYKLMY-SFHVURJKSA-N	0	3	337.423	3.132	20	30		EGEDHN
CN(CCC(=O)Nc1cccc(C#N)c1)Cc1ccc(F)c(F)c1	ZINC000044438862	454101424	/nfs/dbraw/zinc/10/14/24/454101424.db2.gz	LLKKMVAJMWKJKQ-UHFFFAOYSA-N	0	3	329.350	3.297	20	30		EGEDHN
COc1cc(C(=O)C(C#N)c2cnc3ccccc3n2)cc(OC)c1C	ZINC000190923238	455406674	/nfs/dbraw/zinc/40/66/74/455406674.db2.gz	FLCIOKMWTOGEIE-CQSZACIVSA-N	0	3	347.374	3.446	20	30		EGEDHN
N#Cc1ccccc1-c1ccccc1C(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000057553783	454135345	/nfs/dbraw/zinc/13/53/45/454135345.db2.gz	YJFHHXJMDVMDJL-MRXNPFEDSA-N	0	3	331.419	3.192	20	30		EGEDHN
N#Cc1ccc(Cl)cc1NC[C@H]1C[C@@H](O)CN1Cc1ccccc1	ZINC000089644904	454173392	/nfs/dbraw/zinc/17/33/92/454173392.db2.gz	OSHKAZVEQCYVAP-QZTJIDSGSA-N	0	3	341.842	3.259	20	30		EGEDHN
CCn1cc(C(=O)C(C#N)c2nnc3n2CCCCC3)c2ccccc21	ZINC000058267325	454176388	/nfs/dbraw/zinc/17/63/88/454176388.db2.gz	VPDKJIJXEDHZCE-OAHLLOKOSA-N	0	3	347.422	3.469	20	30		EGEDHN
C=CCN(Cc1ccccc1)C[C@@H](O)COCc1ccccc1F	ZINC000045821995	454185496	/nfs/dbraw/zinc/18/54/96/454185496.db2.gz	MNDUYSDJQTZHMG-LJQANCHMSA-N	0	3	329.415	3.391	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)C1(C#N)CCCCC1	ZINC000119585888	454206564	/nfs/dbraw/zinc/20/65/64/454206564.db2.gz	HSCRKGYOCFJHMT-AEFFLSMTSA-N	0	3	325.456	3.097	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN(CC)CC(C)C)cc1	ZINC000046064316	454213469	/nfs/dbraw/zinc/21/34/69/454213469.db2.gz	JPBNVCZYGKGTQT-UHFFFAOYSA-N	0	3	331.460	3.310	20	30		EGEDHN
N#CCc1ccc(OC[C@H](O)CN2CCC[C@@H]2c2ccsc2)cc1	ZINC000046089060	454217385	/nfs/dbraw/zinc/21/73/85/454217385.db2.gz	NJIYNNWZBCJOOY-IEBWSBKVSA-N	0	3	342.464	3.391	20	30		EGEDHN
C#CCN1CCC(C(=O)NC2(c3ccc(F)cc3F)CCCC2)CC1	ZINC000089854898	454217597	/nfs/dbraw/zinc/21/75/97/454217597.db2.gz	MZTVXVSQZRCGIP-UHFFFAOYSA-N	0	3	346.421	3.196	20	30		EGEDHN
N#CC(C(=O)[C@H]1CCCN(C(=O)C2CC2)C1)c1ccc2ccccc2n1	ZINC000089873128	454222592	/nfs/dbraw/zinc/22/25/92/454222592.db2.gz	RGTXGXKAEROICO-DLBZAZTESA-N	0	3	347.418	3.060	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CN2CCC[C@@H]2c2ccsc2)cc1	ZINC000071850383	454231569	/nfs/dbraw/zinc/23/15/69/454231569.db2.gz	IIFXTTHDPMJCMI-FUHWJXTLSA-N	0	3	328.437	3.197	20	30		EGEDHN
C[C@@H](CNC(=O)Nc1ccc(C#N)c(Cl)c1)N1CCC[C@H](C)C1	ZINC000058859470	454238518	/nfs/dbraw/zinc/23/85/18/454238518.db2.gz	PPRSNQLUCIYKTA-STQMWFEESA-N	0	3	334.851	3.454	20	30		EGEDHN
COc1cc(CN(CCOc2ccccc2C#N)C2CC2)ccc1O	ZINC000089975234	454250597	/nfs/dbraw/zinc/25/05/97/454250597.db2.gz	UWHAFOKDSKDNMX-UHFFFAOYSA-N	0	3	338.407	3.316	20	30		EGEDHN
CN(CCC(=O)NCc1ccccc1Cl)Cc1ccc(C#N)cc1	ZINC000046529256	454261032	/nfs/dbraw/zinc/26/10/32/454261032.db2.gz	CQLIPDQFLCMBMS-UHFFFAOYSA-N	0	3	341.842	3.350	20	30		EGEDHN
COc1cc(F)c([C@H](C)NCCOc2ccc(C#N)cc2)cc1OC	ZINC000090106808	454279637	/nfs/dbraw/zinc/27/96/37/454279637.db2.gz	RHBKMBZVEKZWBN-ZDUSSCGKSA-N	0	3	344.386	3.444	20	30		EGEDHN
C[C@H](C(=O)Nc1ccc(C#N)c(Cl)c1)N(C)CCC1CCOCC1	ZINC000120401381	454296947	/nfs/dbraw/zinc/29/69/47/454296947.db2.gz	DWMOFGCQFVABPD-CYBMUJFWSA-N	0	3	349.862	3.287	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@@H](C)N2CCC[C@H](C)C2)cc1OC	ZINC000060555701	454301438	/nfs/dbraw/zinc/30/14/38/454301438.db2.gz	YGBSIKZHVPWVHN-JKSUJKDBSA-N	0	3	346.471	3.110	20	30		EGEDHN
CCN(Cc1cccs1)C[C@H](O)COc1ccc(CC#N)cc1	ZINC000060943255	454321994	/nfs/dbraw/zinc/32/19/94/454321994.db2.gz	GRDVFVJQHJNFMG-INIZCTEOSA-N	0	3	330.453	3.076	20	30		EGEDHN
CC(C)[C@H](NCc1cccc(OCCCC#N)c1)C(=O)N1CCCC1	ZINC000073011021	454381082	/nfs/dbraw/zinc/38/10/82/454381082.db2.gz	QLPLYLWIQFUIFS-IBGZPJMESA-N	0	3	343.471	3.106	20	30		EGEDHN
CC[C@H](N[C@H]1CCCN(c2ccc(C#N)cc2F)C1)c1cnn(C)c1	ZINC000097016866	454387681	/nfs/dbraw/zinc/38/76/81/454387681.db2.gz	PRNBPWOIAQJXHT-WMZOPIPTSA-N	0	3	341.434	3.141	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(CNCc3cccc(C#N)c3)cc2)C[C@H](C)O1	ZINC000047609582	454389988	/nfs/dbraw/zinc/38/99/88/454389988.db2.gz	RKQJVHURAMXVPA-HDICACEKSA-N	0	3	349.478	3.457	20	30		EGEDHN
C[C@H]1CN(Cc2ccc(CNCc3cccc(C#N)c3)cc2)C[C@H](C)O1	ZINC000047609584	454390155	/nfs/dbraw/zinc/39/01/55/454390155.db2.gz	RKQJVHURAMXVPA-ROUUACIJSA-N	0	3	349.478	3.457	20	30		EGEDHN
C=CCc1cc(CN2CCC[C@H](c3cc[nH]n3)C2)cc(OC)c1O	ZINC000121208573	454406007	/nfs/dbraw/zinc/40/60/07/454406007.db2.gz	JUASPTDWPBUSDR-INIZCTEOSA-N	0	3	327.428	3.232	20	30		EGEDHN
Cc1occc1CN(C)CCC(=O)Nc1sc2c(c1C#N)CCC2	ZINC000063559673	454423801	/nfs/dbraw/zinc/42/38/01/454423801.db2.gz	CVGKGYLHMRQUEV-UHFFFAOYSA-N	0	3	343.452	3.471	20	30		EGEDHN
CCCN(CCC)CC(=O)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000097205664	454425202	/nfs/dbraw/zinc/42/52/02/454425202.db2.gz	MYXVIIWWIKEMQS-UHFFFAOYSA-N	0	3	340.389	3.295	20	30		EGEDHN
CC(C)(C)[C@@H](NCC(=O)N(CCC#N)CCC#N)c1ccccc1	ZINC000097267710	454429490	/nfs/dbraw/zinc/42/94/90/454429490.db2.gz	WKURLOGSBNQWDI-SFHVURJKSA-N	0	3	326.444	3.019	20	30		EGEDHN
C[C@@H](CNC(=O)CSCc1ccc(C#N)cc1)N1CCC[C@H](C)C1	ZINC000048230535	454459687	/nfs/dbraw/zinc/45/96/87/454459687.db2.gz	AVQNPEAHHRQAAW-HOTGVXAUSA-N	0	3	345.512	3.028	20	30		EGEDHN
N#Cc1cc([N+](=O)[O-])ccc1N1CCN(CC2CCCCC2)CC1	ZINC000064129222	454466883	/nfs/dbraw/zinc/46/68/83/454466883.db2.gz	PELPIARZAOHOLW-UHFFFAOYSA-N	0	3	328.416	3.169	20	30		EGEDHN
CCn1nc(C(C)C)cc1C(=O)C(C#N)c1nc2ccccc2n1C	ZINC000122108847	454508854	/nfs/dbraw/zinc/50/88/54/454508854.db2.gz	DZCWMRGYTDIERL-CYBMUJFWSA-N	0	3	335.411	3.403	20	30		EGEDHN
COCCOc1ccc([C@@H](C)NCc2ccc(C#N)cc2)cc1OC	ZINC000048715318	454510435	/nfs/dbraw/zinc/51/04/35/454510435.db2.gz	QJOHEMZWMLFQEX-OAHLLOKOSA-N	0	3	340.423	3.443	20	30		EGEDHN
C=C(C)COc1cc(CN[C@H]2CC(=O)N(C(C)(C)C)C2)ccc1OC	ZINC000080235780	454553995	/nfs/dbraw/zinc/55/39/95/454553995.db2.gz	AIQZMTIJKJCFTD-INIZCTEOSA-N	0	3	346.471	3.139	20	30		EGEDHN
CC(C)c1cc(C(=O)C(C#N)c2ccc(C(F)(F)F)cn2)n(C)n1	ZINC000080252854	454556782	/nfs/dbraw/zinc/55/67/82/454556782.db2.gz	RJYVFRBEHNSVPT-LLVKDONJSA-N	0	3	336.317	3.447	20	30		EGEDHN
C=CCNC(=O)NC(=O)[C@H](C)N[C@@H](C)c1ccc(SC(C)C)cc1	ZINC000103499424	454561371	/nfs/dbraw/zinc/56/13/71/454561371.db2.gz	HJNGVTAKXAPROF-KBPBESRZSA-N	0	3	349.500	3.238	20	30		EGEDHN
CCN1CCCC[C@H]1C(=O)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000104228891	454578807	/nfs/dbraw/zinc/57/88/07/454578807.db2.gz	GECUHFDPRASMFG-INIZCTEOSA-N	0	3	338.373	3.048	20	30		EGEDHN
N#CCSCCCN1CCCN(Cc2ccc(Cl)cc2)CC1	ZINC000080626361	454608832	/nfs/dbraw/zinc/60/88/32/454608832.db2.gz	PHTSUZXJWODITJ-UHFFFAOYSA-N	0	3	337.920	3.495	20	30		EGEDHN
C=C(C)COCCNC(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1	ZINC000135036463	454627181	/nfs/dbraw/zinc/62/71/81/454627181.db2.gz	SHEKLORNASJPGM-LJQANCHMSA-N	0	3	345.487	3.024	20	30		EGEDHN
COc1ccc(CN(CCc2ccccc2)[C@@H]2CCOC2)cc1C#N	ZINC000135137755	454637243	/nfs/dbraw/zinc/63/72/43/454637243.db2.gz	JQRLJFFSFMYUAK-HXUWFJFHSA-N	0	3	336.435	3.400	20	30		EGEDHN
N#Cc1cccc(OCCN2CCC[C@@H](C(=O)Nc3ccccc3)C2)c1	ZINC000052315307	454667519	/nfs/dbraw/zinc/66/75/19/454667519.db2.gz	OSDWATBSZXSGMI-GOSISDBHSA-N	0	3	349.434	3.288	20	30		EGEDHN
CN(C)CCOc1ccc(CNc2ccc(C#N)cc2[N+](=O)[O-])cc1	ZINC000052408005	454671204	/nfs/dbraw/zinc/67/12/04/454671204.db2.gz	VBXXNIYMWQRMIY-UHFFFAOYSA-N	0	3	340.383	3.019	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Cc2cccc(OC(C)C)c2)CC1	ZINC000106035603	454674932	/nfs/dbraw/zinc/67/49/32/454674932.db2.gz	PJDSDOMYZNWIKR-UHFFFAOYSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(OC(C)C)c(OC)c2)CC1	ZINC000106040008	454675552	/nfs/dbraw/zinc/67/55/52/454675552.db2.gz	RDCJSKOTFFQCLA-UHFFFAOYSA-N	0	3	346.471	3.253	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](c2ccccc2)C2CC2)CC1	ZINC000106256569	454688794	/nfs/dbraw/zinc/68/87/94/454688794.db2.gz	WZDBPFAWLZXRQV-IBGZPJMESA-N	0	3	327.472	3.477	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCCc2ccc(Cl)cc2)CC1	ZINC000106254551	454689093	/nfs/dbraw/zinc/68/90/93/454689093.db2.gz	GPWLYZHOBMBABF-UHFFFAOYSA-N	0	3	335.879	3.222	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cccnc2OC(C)C)CC1	ZINC000106321357	454690543	/nfs/dbraw/zinc/69/05/43/454690543.db2.gz	ZXGCWQBLPVSHOJ-UHFFFAOYSA-N	0	3	332.448	3.031	20	30		EGEDHN
C=C(C)COc1cc(CN2CC[C@@](C)(C(=O)OC)C2)ccc1OC	ZINC000093814096	454736416	/nfs/dbraw/zinc/73/64/16/454736416.db2.gz	CPVKAMJPTCTZNS-LJQANCHMSA-N	0	3	333.428	3.035	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)c2cccc(CC#N)c2)CN1Cc1ccccc1	ZINC000176802651	454784906	/nfs/dbraw/zinc/78/49/06/454784906.db2.gz	FHWZVIGJSVUPEH-JXFKEZNVSA-N	0	3	333.435	3.145	20	30		EGEDHN
C[C@@H]1CN(C[C@@H]2CCCN2CC#Cc2ccc(Cl)cc2)C[C@H](C)O1	ZINC000177046735	454815787	/nfs/dbraw/zinc/81/57/87/454815787.db2.gz	HVEZUBNFGUHDLB-QKLQHJQFSA-N	0	3	346.902	3.265	20	30		EGEDHN
FC(F)(F)c1ccc(C#CCN2CCC[C@@H](C3OCCO3)C2)cc1	ZINC000177100901	454823336	/nfs/dbraw/zinc/82/33/36/454823336.db2.gz	JNTHNIVUKJOZHM-OAHLLOKOSA-N	0	3	339.357	3.142	20	30		EGEDHN
CCN1CCC(NC(=O)Nc2cccc(C#Cc3ccccn3)c2)CC1	ZINC000111769282	454875415	/nfs/dbraw/zinc/87/54/15/454875415.db2.gz	QUAIMDPTICAPOT-UHFFFAOYSA-N	0	3	348.450	3.087	20	30		EGEDHN
C=CC1CCN(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)CC1	ZINC000111819181	454876005	/nfs/dbraw/zinc/87/60/05/454876005.db2.gz	YIHMJRKHBMWAOK-IBGZPJMESA-N	0	3	327.472	3.431	20	30		EGEDHN
C[C@H](NCc1ccc(N(C)CCC#N)cc1)C(=O)Nc1ccccc1	ZINC000112100257	454879685	/nfs/dbraw/zinc/87/96/85/454879685.db2.gz	IXTPYNMSRQJDTC-INIZCTEOSA-N	0	3	336.439	3.153	20	30		EGEDHN
C#CCOc1ccc([C@H](C)NCc2ccc(-n3ccnc3C)nc2)cc1	ZINC000126359362	454888743	/nfs/dbraw/zinc/88/87/43/454888743.db2.gz	GBBMNXSLXPYINH-INIZCTEOSA-N	0	3	346.434	3.439	20	30		EGEDHN
C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000160730795	455492913	/nfs/dbraw/zinc/49/29/13/455492913.db2.gz	ZVHAPLBELRWNNV-NJAFHUGGSA-N	0	3	328.460	3.013	20	30		EGEDHN
CC#CCCCC(=O)NC[C@H](c1cccc(OC)c1)N1CCCC1	ZINC000185036153	455489979	/nfs/dbraw/zinc/48/99/79/455489979.db2.gz	XFIFZADRYRGJPV-LJQANCHMSA-N	0	3	328.456	3.142	20	30		EGEDHN
Cc1ncc(CON=C(N)c2ccccc2CN2CCCCC2)s1	ZINC000171233591	455048137	/nfs/dbraw/zinc/04/81/37/455048137.db2.gz	KZIYAOCWWUFUBO-UHFFFAOYSA-N	0	3	344.484	3.275	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(-c3ccccc3F)o2)CC1	ZINC000171724553	455089253	/nfs/dbraw/zinc/08/92/53/455089253.db2.gz	VDGXVDJMILJRRS-UHFFFAOYSA-N	0	3	328.387	3.466	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cccc(OC(F)F)c2)CC1	ZINC000171737498	455090451	/nfs/dbraw/zinc/09/04/51/455090451.db2.gz	MYPIFFWEQZZXPV-UHFFFAOYSA-N	0	3	325.359	3.060	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(N3CCCC3)cc2C)CC1	ZINC000171740278	455091074	/nfs/dbraw/zinc/09/10/74/455091074.db2.gz	AXWMZSHFZJXANI-UHFFFAOYSA-N	0	3	342.487	3.367	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccccc2OC(F)F)CC1	ZINC000171740058	455091340	/nfs/dbraw/zinc/09/13/40/455091340.db2.gz	SJXIFESFDLKWHS-UHFFFAOYSA-N	0	3	325.359	3.060	20	30		EGEDHN
N#Cc1ccc(F)cc1CN1CCC[C@H](c2n[nH]c(C3CC3)n2)C1	ZINC000152250013	455092191	/nfs/dbraw/zinc/09/21/91/455092191.db2.gz	IBMDEZVQQUOULG-AWEZNQCLSA-N	0	3	325.391	3.072	20	30		EGEDHN
CCOCc1cc(CNCc2ccc(OCC#N)cc2)ccc1OC	ZINC000171769135	455092906	/nfs/dbraw/zinc/09/29/06/455092906.db2.gz	JZNXAVLBKSBBDC-UHFFFAOYSA-N	0	3	340.423	3.424	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cccc(Cl)c2OC(C)C)CC1	ZINC000118242724	455101168	/nfs/dbraw/zinc/10/11/68/455101168.db2.gz	VKNQHRKISVZTQQ-UHFFFAOYSA-N	0	3	334.847	3.411	20	30		EGEDHN
CC(C)N(CCn1cnc2ccccc2c1=O)Cc1ccc(C#N)cc1	ZINC000172245728	455138214	/nfs/dbraw/zinc/13/82/14/455138214.db2.gz	SIWSSAFXLGQMTM-UHFFFAOYSA-N	0	3	346.434	3.179	20	30		EGEDHN
CCN(CCC#N)C(=O)CN[C@@H](c1ccc(F)cc1)C1CCCC1	ZINC000180280362	455154687	/nfs/dbraw/zinc/15/46/87/455154687.db2.gz	KZKNNOXRUNVWMN-LJQANCHMSA-N	0	3	331.435	3.409	20	30		EGEDHN
N#Cc1cccc(OCCCCC(=O)NCCN2CCCCCC2)c1	ZINC000264837283	455289875	/nfs/dbraw/zinc/28/98/75/455289875.db2.gz	KGNQABMKCUDNSH-UHFFFAOYSA-N	0	3	343.471	3.100	20	30		EGEDHN
N#CCCN(CC1CC1)C(=O)c1ccc(CN2CCCCC2)cc1	ZINC000264012206	455182627	/nfs/dbraw/zinc/18/26/27/455182627.db2.gz	BOJWDCSTBPEADL-UHFFFAOYSA-N	0	3	325.456	3.438	20	30		EGEDHN
C=CCSCCNCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1	ZINC000237786012	455218784	/nfs/dbraw/zinc/21/87/84/455218784.db2.gz	HDNOZWNQTBSTDI-UHFFFAOYSA-N	0	3	332.429	3.004	20	30		EGEDHN
N#CC1(NC(=O)CNC2(c3ccccc3)CCCC2)CCCCC1	ZINC000183548629	455304712	/nfs/dbraw/zinc/30/47/12/455304712.db2.gz	LNKLPZJRIGNEFJ-UHFFFAOYSA-N	0	3	325.456	3.388	20	30		EGEDHN
C[C@@H](NCCC(=O)N1CCCCCC1)c1ccc(OCC#N)cc1	ZINC000181634231	455365958	/nfs/dbraw/zinc/36/59/58/455365958.db2.gz	OZLPEBNVVLQATQ-MRXNPFEDSA-N	0	3	329.444	3.032	20	30		EGEDHN
C[C@@H]1C[C@@H]1[C@H](NCC(=O)N[C@](C)(C#N)C1CC1)c1ccc(Cl)cc1	ZINC000245874815	455390086	/nfs/dbraw/zinc/39/00/86/455390086.db2.gz	JZURBRWCTHFZNH-YDISMWLMSA-N	0	3	345.874	3.435	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cnn(CCCC)c2C)CC1	ZINC000159881623	455412425	/nfs/dbraw/zinc/41/24/25/455412425.db2.gz	LWISHCAYGOWAFW-UHFFFAOYSA-N	0	3	333.480	3.154	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H](C(=C)C)c2ccc(F)c(F)c2)CC1	ZINC000184840862	455458411	/nfs/dbraw/zinc/45/84/11/455458411.db2.gz	QSLCMACPMBRQOP-SFHVURJKSA-N	0	3	332.394	3.043	20	30		EGEDHN
C[C@@H](c1ccc(C#N)cc1)N1CCC[C@@H](CNC(=O)C(C)(C)C)C1	ZINC000246351229	455474895	/nfs/dbraw/zinc/47/48/95/455474895.db2.gz	KBDUUTMITXDJPN-RDJZCZTQSA-N	0	3	327.472	3.494	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N[C@H](CC)[C@H]1CCCO1	ZINC000182300232	455483517	/nfs/dbraw/zinc/48/35/17/455483517.db2.gz	VDVAVZIEQBBOJH-USXIJHARSA-N	0	3	336.501	3.198	20	30		EGEDHN
CC[C@@H](NCC(=O)N(CCC#N)c1cc(C)cc(C)c1)[C@@H]1CCCO1	ZINC000182304249	455483906	/nfs/dbraw/zinc/48/39/06/455483906.db2.gz	CYXZBIUGKUNRIV-MOPGFXCFSA-N	0	3	343.471	3.097	20	30		EGEDHN
C=CCCC[C@H](C)N[C@H](C(N)=O)c1ccc(Br)cc1	ZINC000182343696	455493817	/nfs/dbraw/zinc/49/38/17/455493817.db2.gz	IPAGWTQWNAEJPZ-FZMZJTMJSA-N	0	3	325.250	3.310	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC2(Cc3cccc(F)c3)CCC2)CC1	ZINC000185386605	455552067	/nfs/dbraw/zinc/55/20/67/455552067.db2.gz	GEHMYKZHBRDULU-UHFFFAOYSA-N	0	3	345.462	3.241	20	30		EGEDHN
C=CCN(Cc1cccc(C#N)c1)C(=O)c1ccc(CN(C)C)cc1	ZINC000161512562	455577414	/nfs/dbraw/zinc/57/74/14/455577414.db2.gz	WMXZWXASGLNJLX-UHFFFAOYSA-N	0	3	333.435	3.448	20	30		EGEDHN
N#CCC[C@H](NC(=O)NC[C@H]1CCCCN1C1CC1)c1ccccc1	ZINC000277669303	455629514	/nfs/dbraw/zinc/62/95/14/455629514.db2.gz	ZUIJHPFMLXPZST-MOPGFXCFSA-N	0	3	340.471	3.348	20	30		EGEDHN
CC[C@H](Cc1ccc(C)cc1)N(C)CC(=O)N[C@](C)(C#N)C1CC1	ZINC000247642921	455632757	/nfs/dbraw/zinc/63/27/57/455632757.db2.gz	TXIKTXIWBGMUHI-UYAOXDASSA-N	0	3	327.472	3.056	20	30		EGEDHN
C=CCC[C@H](NC(=O)N1CC[C@@]2(CCN(C)C2)C1)c1ccccc1	ZINC000292509006	455682780	/nfs/dbraw/zinc/68/27/80/455682780.db2.gz	HLZVEHFEAXKEGR-AZUAARDMSA-N	0	3	327.472	3.431	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCCN(c2ccccc2C#N)CC1	ZINC000186168775	455708588	/nfs/dbraw/zinc/70/85/88/455708588.db2.gz	IEENIIVWQKDKHY-UHFFFAOYSA-N	0	3	330.435	3.451	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCC(NC(=O)c2ccsc2)CC1	ZINC000186175723	455710275	/nfs/dbraw/zinc/71/02/75/455710275.db2.gz	YBOCHHOGJOCGJB-UHFFFAOYSA-N	0	3	339.464	3.323	20	30		EGEDHN
N#C[C@@H]1CCC[C@H](N[C@H]2CCCN(Cc3ccc(F)cc3F)C2=O)C1	ZINC000248881145	455736739	/nfs/dbraw/zinc/73/67/39/455736739.db2.gz	KPYVOGGMXRAVQD-SKDZVZGDSA-N	0	3	347.409	3.128	20	30		EGEDHN
Cc1cc(C#N)ccc1CNC(C)(C)C(=O)NCC1CCCCC1	ZINC000186316333	455741535	/nfs/dbraw/zinc/74/15/35/455741535.db2.gz	PJMXQVGATZLRIZ-UHFFFAOYSA-N	0	3	327.472	3.431	20	30		EGEDHN
COc1ccc([C@@H](NCC(=O)NC2(C#N)CCCCC2)C2CC2)cc1	ZINC000193349837	455753669	/nfs/dbraw/zinc/75/36/69/455753669.db2.gz	AQRLMIZKPGVWDG-IBGZPJMESA-N	0	3	341.455	3.079	20	30		EGEDHN
CCO[C@H]1C[C@@H](O)C12CCN(Cc1ccccc1C(C)(C)C#N)CC2	ZINC000268986682	455753895	/nfs/dbraw/zinc/75/38/95/455753895.db2.gz	QXWHWASUERVYCZ-MOPGFXCFSA-N	0	3	342.483	3.240	20	30		EGEDHN
C[C@H](N[C@@H]1CCN(Cc2ccccc2)C1=O)c1ccc(OCC#N)cc1	ZINC000271788630	455760848	/nfs/dbraw/zinc/76/08/48/455760848.db2.gz	IONPASOVYWLLSG-OXJNMPFZSA-N	0	3	349.434	3.041	20	30		EGEDHN
COc1ccc2c(c1)OC[C@@H](N[C@@H](C)c1ccc(OCC#N)cc1)C2	ZINC000271899426	455798122	/nfs/dbraw/zinc/79/81/22/455798122.db2.gz	VFXOOHWRBHEVLX-YOEHRIQHSA-N	0	3	338.407	3.252	20	30		EGEDHN
C[NH+](C)CCN(Cc1ccc(C#N)cc1)Cc1c(F)ccc([O-])c1F	ZINC000293841945	455798473	/nfs/dbraw/zinc/79/84/73/455798473.db2.gz	HEPWCAWPKCWWPS-UHFFFAOYSA-N	0	3	345.393	3.106	20	30		EGEDHN
Cc1cccc(OC[C@H](O)CN[C@@H](C)c2ccc(C#N)c(F)c2)c1	ZINC000271944341	455800865	/nfs/dbraw/zinc/80/08/65/455800865.db2.gz	PNQMIUXTHJMCQC-WMLDXEAASA-N	0	3	328.387	3.096	20	30		EGEDHN
CC[C@@H](C)[N-]C(=S)C(C(=O)c1nccs1)[n+]1ccc(C)cc1	ZINC000278367924	455830871	/nfs/dbraw/zinc/83/08/71/455830871.db2.gz	ZHIMWIJMWIPVSS-GFCCVEGCSA-O	0	3	334.490	3.066	20	30		EGEDHN
Cn1cc(CN[C@@H]2CCN(C)[C@H]2c2ccc(Cl)cc2)cc1C#N	ZINC000253350802	455833331	/nfs/dbraw/zinc/83/33/31/455833331.db2.gz	BINCBMQJNFZCFW-MSOLQXFVSA-N	0	3	328.847	3.085	20	30		EGEDHN
CS[C@@H]1CCN(Cc2cn(CCC#N)nc2-c2ccccc2)C1	ZINC000295123164	455840352	/nfs/dbraw/zinc/84/03/52/455840352.db2.gz	WWUVDDAOGFPDKX-QGZVFWFLSA-N	0	3	326.469	3.401	20	30		EGEDHN
CC[C@H]([NH2+]CCCNC(=O)c1cccc([O-])c1)c1ccc(C#N)cc1	ZINC000278693437	455843804	/nfs/dbraw/zinc/84/38/04/455843804.db2.gz	KNSMLNRLMZSYKQ-IBGZPJMESA-N	0	3	337.423	3.125	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2nc3c(s2)C[C@@H](CC)CC3)CC1	ZINC000194470869	455846297	/nfs/dbraw/zinc/84/62/97/455846297.db2.gz	ALDNXSKLSRJONB-ZDUSSCGKSA-N	0	3	348.516	3.430	20	30		EGEDHN
CC(C)N1CCCN(C(=O)N[C@@H](CCC#N)c2ccccc2)CC1	ZINC000269629194	455851226	/nfs/dbraw/zinc/85/12/26/455851226.db2.gz	FFOWDONFCDCWAE-SFHVURJKSA-N	0	3	328.460	3.157	20	30		EGEDHN
CC[C@@H](NCc1cccc(OCC(=O)OC)c1)c1ccc(C#N)cc1	ZINC000278895052	455852691	/nfs/dbraw/zinc/85/26/91/455852691.db2.gz	YWGJJHYISCTCJT-LJQANCHMSA-N	0	3	338.407	3.351	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2c[nH]cc2-c2ccccc2F)CC1	ZINC000279063774	455857424	/nfs/dbraw/zinc/85/74/24/455857424.db2.gz	QHJKMJLYOOTBCA-UHFFFAOYSA-N	0	3	327.403	3.201	20	30		EGEDHN
CCN(C[C@H]1CCN(Cc2ccccc2)C1)C(=O)CC(C)(C)C#N	ZINC000279091371	455857902	/nfs/dbraw/zinc/85/79/02/455857902.db2.gz	WJASLBVQNKLFQV-SFHVURJKSA-N	0	3	327.472	3.297	20	30		EGEDHN
CCN1CCC[C@H]1CN(Cc1ccc(O)cc1)C(=O)CC(C)(C)C#N	ZINC000279350202	455863622	/nfs/dbraw/zinc/86/36/22/455863622.db2.gz	JHTJUYATHQRFLQ-KRWDZBQOSA-N	0	3	343.471	3.145	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H]2CC[C@H](c3ccc(F)cc3)C2)CC1	ZINC000279395436	455864717	/nfs/dbraw/zinc/86/47/17/455864717.db2.gz	ATSOFGQIVJJWGB-QFBILLFUSA-N	0	3	345.462	3.411	20	30		EGEDHN
CC[C@H](Cc1ccccc1)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000279436961	455864898	/nfs/dbraw/zinc/86/48/98/455864898.db2.gz	YGPMGGMDFSYSTH-VQTJNVASSA-N	0	3	331.419	3.378	20	30		EGEDHN
COc1ccc([C@H](C)N[C@H]2CCCN(c3ccc(C#N)cc3)C2=O)cc1	ZINC000272188338	455871487	/nfs/dbraw/zinc/87/14/87/455871487.db2.gz	JRVMIFUYOWZANR-YWZLYKJASA-N	0	3	349.434	3.413	20	30		EGEDHN
Cc1ccc(C[NH+](C)C)cc1[N-]S(=O)(=O)c1ccc(C#N)cc1C	ZINC000187135303	455872764	/nfs/dbraw/zinc/87/27/64/455872764.db2.gz	QUKZVWAEDBPWDP-UHFFFAOYSA-N	0	3	343.452	3.038	20	30		EGEDHN
CC(C)(C#N)c1ccc(C(=O)N2CCC[C@@H]2CN2CCCC2)cc1	ZINC000279809639	455873460	/nfs/dbraw/zinc/87/34/60/455873460.db2.gz	OGVPWVZZWBXSGD-GOSISDBHSA-N	0	3	325.456	3.188	20	30		EGEDHN
CC1(C)[C@H](NCC#Cc2ccc(OC(F)(F)F)cc2)[C@@H]2CCO[C@H]21	ZINC000296470468	455947569	/nfs/dbraw/zinc/94/75/69/455947569.db2.gz	XUJLEJIQOHNRCX-ARFHVFGLSA-N	0	3	339.357	3.340	20	30		EGEDHN
C#CC[C@H](NC(=O)NC1CCN(CC(=C)C)CC1)c1ccccc1	ZINC000270467429	455962609	/nfs/dbraw/zinc/96/26/09/455962609.db2.gz	UYUXTZUBQRFUCF-IBGZPJMESA-N	0	3	325.456	3.091	20	30		EGEDHN
C[C@H](CN1CCC[C@@H](C)C1)NC(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000280597813	456010109	/nfs/dbraw/zinc/01/01/09/456010109.db2.gz	NTASYZUNGNTACC-HZPDHXFCSA-N	0	3	327.472	3.338	20	30		EGEDHN
C[C@@H](NC(=O)NCc1cccc(C#N)c1)[C@H](c1ccccc1)N(C)C	ZINC000286944734	456058310	/nfs/dbraw/zinc/05/83/10/456058310.db2.gz	CPKOBGBQWACXFR-DNVCBOLYSA-N	0	3	336.439	3.049	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2Cc3cccc(Cl)c3C2)CC1	ZINC000287157588	456062761	/nfs/dbraw/zinc/06/27/61/456062761.db2.gz	BXYJLJJHFYJQPO-UHFFFAOYSA-N	0	3	333.863	3.406	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1	ZINC000188491453	456072492	/nfs/dbraw/zinc/07/24/92/456072492.db2.gz	GMVQHFSYUZUJGG-FUHIMQAGSA-N	0	3	336.520	3.327	20	30		EGEDHN
C=CCN1CCC(N[C@@H](COC)c2cccc(Cl)c2F)CC1	ZINC000287891685	456081730	/nfs/dbraw/zinc/08/17/30/456081730.db2.gz	YZSSLOUNGFGIQO-INIZCTEOSA-N	0	3	326.843	3.407	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H](CC)[C@H](O)C(F)(F)F)cc1OC	ZINC000271018989	456098727	/nfs/dbraw/zinc/09/87/27/456098727.db2.gz	ULLNSSNTAIMLHF-WFASDCNBSA-N	0	3	333.350	3.051	20	30		EGEDHN
C=CCOc1ccc(CN[C@H](CC)[C@H](O)C(F)(F)F)cc1OC	ZINC000271018971	456098801	/nfs/dbraw/zinc/09/88/01/456098801.db2.gz	ULLNSSNTAIMLHF-DOMZBBRYSA-N	0	3	333.350	3.051	20	30		EGEDHN
C=CCS(=O)(=O)CCN[C@H](C)CCc1cccc(C(F)(F)F)c1	ZINC000272926705	456114965	/nfs/dbraw/zinc/11/49/65/456114965.db2.gz	YWPPWWDIWWIABL-CYBMUJFWSA-N	0	3	349.418	3.217	20	30		EGEDHN
CC(C)(C)OC(=O)N1C[C@@H]2CCN(Cc3cccc(C#N)c3)C[C@H]2C1	ZINC000289509196	456128675	/nfs/dbraw/zinc/12/86/75/456128675.db2.gz	KQPDSCRWXILZIH-ROUUACIJSA-N	0	3	341.455	3.247	20	30		EGEDHN
CN1CCC[C@@]2(CCN(C(=O)Nc3ccc(C#N)cc3Cl)C2)C1	ZINC000297142977	456130022	/nfs/dbraw/zinc/13/00/22/456130022.db2.gz	QLXZYKZYJRCLQD-QGZVFWFLSA-N	0	3	332.835	3.161	20	30		EGEDHN
Cc1ccc(C[C@H](CO)NCc2cccc(OCCCC#N)c2)cc1	ZINC000188985611	456189652	/nfs/dbraw/zinc/18/96/52/456189652.db2.gz	UVWSSRZGUYEPSG-HXUWFJFHSA-N	0	3	338.451	3.371	20	30		EGEDHN
C[C@@H]1CN(CC2CCN(c3cccc(F)c3C#N)CC2)C[C@H](C)O1	ZINC000263779187	456220032	/nfs/dbraw/zinc/22/00/32/456220032.db2.gz	VIVITNYCAWABEP-GASCZTMLSA-N	0	3	331.435	3.023	20	30		EGEDHN
C[C@@H](C1CCN(C)CC1)N(C)C(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000273404283	456228607	/nfs/dbraw/zinc/22/86/07/456228607.db2.gz	HIZNWFNECUUBSM-LPHOPBHVSA-N	0	3	342.487	3.403	20	30		EGEDHN
COc1cc(CN[C@@H](CN(C)C)c2ccc(F)cc2)ccc1C#N	ZINC000290103985	456241437	/nfs/dbraw/zinc/24/14/37/456241437.db2.gz	KOMXQWBJEYHQTQ-SFHVURJKSA-N	0	3	327.403	3.098	20	30		EGEDHN
CNC(=O)c1ccc(CNCc2cccc(OCCCC#N)c2)cc1	ZINC000237188406	456244388	/nfs/dbraw/zinc/24/43/88/456244388.db2.gz	QCCPNVQHIMJJGR-UHFFFAOYSA-N	0	3	337.423	3.019	20	30		EGEDHN
C#C[C@@H](N[C@H](C)CC(=O)Nc1ccc(OC)cc1OC)C(C)(C)C	ZINC000290244656	456273998	/nfs/dbraw/zinc/27/39/98/456273998.db2.gz	VBYZPSKSEQYFBR-CXAGYDPISA-N	0	3	332.444	3.058	20	30		EGEDHN
C#CCOc1ccccc1NC(=O)Nc1ccccc1CCN(C)C	ZINC000275690920	456287241	/nfs/dbraw/zinc/28/72/41/456287241.db2.gz	REVOZRIVAJDNLU-UHFFFAOYSA-N	0	3	337.423	3.447	20	30		EGEDHN
CCN1C[C@H](C)N(Cc2ccc(C#N)cc2Br)[C@@H](C)C1	ZINC000347710263	456318406	/nfs/dbraw/zinc/31/84/06/456318406.db2.gz	SJROFODAHRVTCJ-STQMWFEESA-N	0	3	336.277	3.235	20	30		EGEDHN
N#CC1(CCCN[C@@H](CO)c2cccc(Cl)c2F)CCOCC1	ZINC000337220919	456339519	/nfs/dbraw/zinc/33/95/19/456339519.db2.gz	KXZHGUKMJNBTEJ-HNNXBMFYSA-N	0	3	340.826	3.203	20	30		EGEDHN
N#CC1(CCCN[C@H](CO)c2cccc(Cl)c2F)CCOCC1	ZINC000337220920	456339988	/nfs/dbraw/zinc/33/99/88/456339988.db2.gz	KXZHGUKMJNBTEJ-OAHLLOKOSA-N	0	3	340.826	3.203	20	30		EGEDHN
COc1ccc([C@H](N[C@@H](C)C(=O)N[C@](C)(C#N)C(C)C)C2CC2)cc1	ZINC000343007985	456352684	/nfs/dbraw/zinc/35/26/84/456352684.db2.gz	LFYQLUWXBJCUTN-BOUXLOLZSA-N	0	3	343.471	3.179	20	30		EGEDHN
CC(C#N)C(=O)N1CCN(C2c3ccccc3-c3ccccc32)CC1	ZINC000337460807	456354583	/nfs/dbraw/zinc/35/45/83/456354583.db2.gz	KHRBIIHEFZOPNO-HNNXBMFYSA-N	0	3	331.419	3.060	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)CN(Cc1ccccc1)[C@H](C)C1CC1	ZINC000302806972	456406654	/nfs/dbraw/zinc/40/66/54/456406654.db2.gz	DLMHUGRNBRPALI-OXQOHEQNSA-N	0	3	327.472	3.342	20	30		EGEDHN
CN(C[C@H](O)COc1ccc(Oc2ccc(C#N)cc2)cc1)C1CC1	ZINC000290797457	456431475	/nfs/dbraw/zinc/43/14/75/456431475.db2.gz	PBYXIUNQYVPKEE-KRWDZBQOSA-N	0	3	338.407	3.184	20	30		EGEDHN
C[C@@H](CCC#N)N1CCC[C@H](CNC(=O)Nc2cccc(F)c2)C1	ZINC000276296289	456438630	/nfs/dbraw/zinc/43/86/30/456438630.db2.gz	IVVPJXOTTROLRH-LSDHHAIUSA-N	0	3	332.423	3.351	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@@H](C)N1CCCN(Cc2ccccc2)CC1	ZINC000302956238	456439456	/nfs/dbraw/zinc/43/94/56/456439456.db2.gz	NWOYMQHVUFTPDF-LJQANCHMSA-N	0	3	343.515	3.007	20	30		EGEDHN
COCCOCc1ccc(CNC(=N)Nc2cc(F)ccc2F)cc1	ZINC000290943028	456474826	/nfs/dbraw/zinc/47/48/26/456474826.db2.gz	KZEWDTYUXZSJSZ-UHFFFAOYSA-N	0	3	349.381	3.055	20	30		EGEDHN
CN(Cc1cc(C#N)cs1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000353126417	456508766	/nfs/dbraw/zinc/50/87/66/456508766.db2.gz	MNGCWJDFSLNJKW-UHFFFAOYSA-N	0	3	339.464	3.356	20	30		EGEDHN
Cn1cc(CNCCc2nc3cc(Cl)ccc3s2)cc1C#N	ZINC000276594714	456525044	/nfs/dbraw/zinc/52/50/44/456525044.db2.gz	FFEKMIMIPZBWHR-UHFFFAOYSA-N	0	3	330.844	3.492	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H]2CCO[C@H]2c2cccnc2)cc1OC	ZINC000343392537	456586262	/nfs/dbraw/zinc/58/62/62/456586262.db2.gz	PCPWCRPVPFPMSC-XLIONFOSSA-N	0	3	340.423	3.275	20	30		EGEDHN
CO[C@@H]1CCCC[C@@H]1N[C@@H](C)C(=O)N(CCC#N)c1ccc(C)cc1	ZINC000276909781	456618189	/nfs/dbraw/zinc/61/81/89/456618189.db2.gz	FQDIENCELCGTMR-YTQUADARSA-N	0	3	343.471	3.177	20	30		EGEDHN
C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)N[C@@H](C)c1ccc(C#N)cc1	ZINC000299155662	456621618	/nfs/dbraw/zinc/62/16/18/456621618.db2.gz	BZMOXYUCTLPWKW-PMPSAXMXSA-N	0	3	328.460	3.039	20	30		EGEDHN
CN(CCC#N)c1ccc(CN2CC(C)(C)[C@@H]2[C@@H]2CCCO2)cc1	ZINC000291460748	456650446	/nfs/dbraw/zinc/65/04/46/456650446.db2.gz	DCZZIFUDUCFBHX-OALUTQOASA-N	0	3	327.472	3.426	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N(C)[C@@H](C)c1ccncc1)C(C)C	ZINC000299345979	456662559	/nfs/dbraw/zinc/66/25/59/456662559.db2.gz	GTNHOVXZFVZCNQ-PKOBYXMFSA-N	0	3	344.503	3.483	20	30		EGEDHN
Cc1ccnc(N(CCN(C)C)Cc2cccc(Cl)c2)c1C#N	ZINC000343536909	456692835	/nfs/dbraw/zinc/69/28/35/456692835.db2.gz	TYZRDWHHXOKMHQ-UHFFFAOYSA-N	0	3	328.847	3.483	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)Nc1cccc(CN2CCC(O)CC2)c1	ZINC000338228632	456719311	/nfs/dbraw/zinc/71/93/11/456719311.db2.gz	KNDXJWFCOJMHEB-UHFFFAOYSA-N	0	3	349.434	3.076	20	30		EGEDHN
Cc1ccc(NC(=O)[C@H](C)N2CCC[C@@H]2[C@H]2COCC[C@H]2O)c(C)c1	ZINC000328694248	456738753	/nfs/dbraw/zinc/73/87/53/456738753.db2.gz	CVWDTDMZSONNBZ-QFHJOOASSA-N	0	3	346.471	3.142	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)Nc1ccc(CN2CCN(CC)CC2)cc1	ZINC000343669075	456766329	/nfs/dbraw/zinc/76/63/29/456766329.db2.gz	BPIVUBXGRATPBN-FQEVSTJZSA-N	0	3	329.488	3.365	20	30		EGEDHN
C[C@@H](N[C@@H](C)C(=O)Nc1sc2c(c1C#N)CCC2)[C@H]1CCOC1	ZINC000328814252	456767724	/nfs/dbraw/zinc/76/77/24/456767724.db2.gz	NJVKJOWKFRETKM-WOPDTQHZSA-N	0	3	333.457	3.100	20	30		EGEDHN
CN1CCC(Oc2ccc(CNC(=O)NC[C@@H]3CC3(C)C)cc2)CC1	ZINC000328879393	456783153	/nfs/dbraw/zinc/78/31/53/456783153.db2.gz	LIVAKUXAWYDTOF-INIZCTEOSA-N	0	3	345.487	3.209	20	30		EGEDHN
COc1ccc([C@@H](CNc2cccc(F)c2C#N)N(C)C)cc1OC	ZINC000301055433	456785032	/nfs/dbraw/zinc/78/50/32/456785032.db2.gz	BDMYIRZJOLNCQK-QGZVFWFLSA-N	0	3	343.402	3.429	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)NC[C@@H](C)N2CCCC[C@H]2C)cc1	ZINC000344098292	456796591	/nfs/dbraw/zinc/79/65/91/456796591.db2.gz	JCOCNWXSMLNIMA-IAGOWNOFSA-N	0	3	345.487	3.314	20	30		EGEDHN
C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H]1CCN(C)[C@H](C)C1	ZINC000353643836	456823460	/nfs/dbraw/zinc/82/34/60/456823460.db2.gz	PUFQETOFYAPXOS-SJLPKXTDSA-N	0	3	347.507	3.034	20	30		EGEDHN
C[C@@H]1CN(c2cccc(F)c2)CCN1CCCC1(C#N)CCOCC1	ZINC000292041432	456838166	/nfs/dbraw/zinc/83/81/66/456838166.db2.gz	AEMFBPFWAYLNJP-QGZVFWFLSA-N	0	3	345.462	3.437	20	30		EGEDHN
COc1ccc(C)cc1NC(=O)[C@H]1CCCN1C[C@@H]1CCCOC1	ZINC000329174114	456849285	/nfs/dbraw/zinc/84/92/85/456849285.db2.gz	AWRZSHXSIIINPZ-DOTOQJQBSA-N	0	3	332.444	3.483	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccc([C@H]3CCCOC3)cc2)nc(C)n1	ZINC000329251164	456860940	/nfs/dbraw/zinc/86/09/40/456860940.db2.gz	BGWFDYBEDRCCOZ-ROUUACIJSA-N	0	3	335.407	3.478	20	30		EGEDHN
CCN1CCC(NC(=O)Nc2csc(-c3ccccn3)n2)CC1	ZINC000329264795	456864217	/nfs/dbraw/zinc/86/42/17/456864217.db2.gz	DYBZTOBXNWKCPD-UHFFFAOYSA-N	0	3	331.445	3.015	20	30		EGEDHN
N#CC(=C([O-])c1cncc(C(F)(F)F)c1)c1nc2ccccc2[nH]1	ZINC000344854453	456868367	/nfs/dbraw/zinc/86/83/67/456868367.db2.gz	XHAGSAPSJAKLAC-LLVKDONJSA-N	0	3	330.269	3.467	20	30		EGEDHN
N#CC(C(=O)c1cncc(C(F)(F)F)c1)c1nc2ccccc2[nH]1	ZINC000344854453	456868373	/nfs/dbraw/zinc/86/83/73/456868373.db2.gz	XHAGSAPSJAKLAC-LLVKDONJSA-N	0	3	330.269	3.467	20	30		EGEDHN
C=CCOc1ccc(CN2CC[C@@H](COC(F)F)C2)cc1OC	ZINC000348865276	456884771	/nfs/dbraw/zinc/88/47/71/456884771.db2.gz	DBFDTQRJHALGIQ-CQSZACIVSA-N	0	3	327.371	3.321	20	30		EGEDHN
CCN1CCCC[C@@H]1CNC(=O)N1CCC(c2ccc(O)cc2)CC1	ZINC000329428885	456888355	/nfs/dbraw/zinc/88/83/55/456888355.db2.gz	HECJKWYXHMROBI-GOSISDBHSA-N	0	3	345.487	3.360	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H]2COc3ccc(Cl)cc32)CC1	ZINC000353765266	456896643	/nfs/dbraw/zinc/89/66/43/456896643.db2.gz	IEYBARSMMZBYOE-INIZCTEOSA-N	0	3	349.862	3.113	20	30		EGEDHN
C[C@@H]1CCN(C(=O)NC2CC(C(F)(F)F)C2)C[C@@H]1n1ccnc1	ZINC000329712913	456930992	/nfs/dbraw/zinc/93/09/92/456930992.db2.gz	QSQZFGIAHOSSTD-XVSSEFHLSA-N	0	3	330.354	3.021	20	30		EGEDHN
CC(C#N)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000345117391	456931831	/nfs/dbraw/zinc/93/18/31/456931831.db2.gz	DIGXUOUOQIHJPJ-NSHDSACASA-N	0	3	340.254	3.234	20	30		EGEDHN
CCc1nccn1[C@@H]1CCCN(C([O-])=[NH+]C[C@@H]2CCCCS2)C1	ZINC000329765342	456937618	/nfs/dbraw/zinc/93/76/18/456937618.db2.gz	WWQWXQXYPMRMFQ-CABCVRRESA-N	0	3	336.505	3.282	20	30		EGEDHN
C[C@@H](CN1C[C@H](C)C[C@H](C)C1)NC(=O)[C@H]1CCC(=O)c2cccn21	ZINC000329828595	456947514	/nfs/dbraw/zinc/94/75/14/456947514.db2.gz	DHXYCAGSCUEWKT-QSJFSLAZSA-N	0	3	331.460	3.329	20	30		EGEDHN
C=CCOCCN1CCC(c2noc(-c3ccccc3OC)n2)CC1	ZINC000339122785	456951212	/nfs/dbraw/zinc/95/12/12/456951212.db2.gz	NLIMADBDCIISLS-UHFFFAOYSA-N	0	3	343.427	3.127	20	30		EGEDHN
C[C@@H]1CCN(Cc2cccc(OCc3ccccc3C#N)c2)C[C@@H]1O	ZINC000349408310	456964860	/nfs/dbraw/zinc/96/48/60/456964860.db2.gz	PDXBSHRGRQUBNJ-IERDGZPVSA-N	0	3	336.435	3.340	20	30		EGEDHN
C[C@@H]1CCN(Cc2cccc(OCc3cccc(C#N)c3)c2)C[C@H]1O	ZINC000349420756	456966911	/nfs/dbraw/zinc/96/69/11/456966911.db2.gz	RNPMEFBRMJCCHG-IIBYNOLFSA-N	0	3	336.435	3.340	20	30		EGEDHN
[O-]C(=[NH+]C[C@@H]1CCc2nccn2C1)N1CCC[C@]2(CC=CCC2)C1	ZINC000329965597	456968531	/nfs/dbraw/zinc/96/85/31/456968531.db2.gz	UKFLXBLRVGOPHN-QFBILLFUSA-N	0	3	328.460	3.182	20	30		EGEDHN
CCCN(CCN1CCCCCC1)C(=O)c1ccc(CC#N)cc1	ZINC000345344771	456975534	/nfs/dbraw/zinc/97/55/34/456975534.db2.gz	QKLNTQGLASEXJE-UHFFFAOYSA-N	0	3	327.472	3.481	20	30		EGEDHN
CS(=O)(=O)C1(CN[C@@H]2CCCCc3cc(C#N)ccc32)CCCC1	ZINC000353948609	456976564	/nfs/dbraw/zinc/97/65/64/456976564.db2.gz	VZDBPRHGNLCDEH-GOSISDBHSA-N	0	3	346.496	3.273	20	30		EGEDHN
CCN1CCCC[C@@H]1CNC(=O)NC[C@H]1CCO[C@@H]1c1ccccc1	ZINC000330163140	456993681	/nfs/dbraw/zinc/99/36/81/456993681.db2.gz	SMVBJKBIRJNZRW-GUDVDZBRSA-N	0	3	345.487	3.142	20	30		EGEDHN
C[C@H]1CCN(C)CCN1C(=O)c1ccccc1-c1ccccc1C#N	ZINC000354009245	457005248	/nfs/dbraw/zinc/00/52/48/457005248.db2.gz	VBQWOFZDVLOVJH-INIZCTEOSA-N	0	3	333.435	3.391	20	30		EGEDHN
CCN1CCC[C@@H]1CNC(=O)c1sc([C@@H]2CCCOC2)nc1C	ZINC000330250224	457012740	/nfs/dbraw/zinc/01/27/40/457012740.db2.gz	MWEHKTRPASHAKD-ZIAGYGMSSA-N	0	3	337.489	3.134	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)NC[C@H]2CCCCO2)CCN1Cc1ccccc1	ZINC000330264592	457015971	/nfs/dbraw/zinc/01/59/71/457015971.db2.gz	YCXXZJXJODMRPI-BHIYHBOVSA-N	0	3	345.487	3.112	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cnc(C)nc1C(C)C)C(C)C	ZINC000358886487	457024294	/nfs/dbraw/zinc/02/42/94/457024294.db2.gz	MBQDEGBVIZHKAC-GOSISDBHSA-N	0	3	344.503	3.337	20	30		EGEDHN
C[C@@H]1C[C@H]1N1CCN(C(=O)c2cccc(SCC#N)c2)C[C@@H](C)C1	ZINC000346285321	457029568	/nfs/dbraw/zinc/02/95/68/457029568.db2.gz	YLSMIHLQOJFINB-HDMKZQKVSA-N	0	3	343.496	3.105	20	30		EGEDHN
Cc1ccc(NC(=O)NC2CCN(C)CC2)cc1OCC(F)F	ZINC000330430540	457042801	/nfs/dbraw/zinc/04/28/01/457042801.db2.gz	MTAHELJUGWOEJQ-UHFFFAOYSA-N	0	3	327.375	3.059	20	30		EGEDHN
COCC1(C#N)CCN(Cc2ccc(O)c3nc(C)ccc23)CC1	ZINC000341988025	457044485	/nfs/dbraw/zinc/04/44/85/457044485.db2.gz	JIDQBVOMQOHTRW-UHFFFAOYSA-N	0	3	325.412	3.001	20	30		EGEDHN
CN(CCCNC(=O)NCC(C)(C)CCC#N)Cc1ccccc1	ZINC000349880878	457092194	/nfs/dbraw/zinc/09/21/94/457092194.db2.gz	QIBJUCLGNDKRJF-UHFFFAOYSA-N	0	3	330.476	3.138	20	30		EGEDHN
CN1CCC(NC(=O)c2cc(NC(=O)C(C)(C)C)ccc2F)CC1	ZINC000330901707	457101592	/nfs/dbraw/zinc/10/15/92/457101592.db2.gz	RSZVOEDMFPGOBN-UHFFFAOYSA-N	0	3	335.423	3.209	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N[C@H](CN1CCCC1)c1ccccc1)OCC	ZINC000339426227	457108490	/nfs/dbraw/zinc/10/84/90/457108490.db2.gz	RXRQICVJCSFTLZ-RTBURBONSA-N	0	3	330.472	3.311	20	30		EGEDHN
CC(C)(C#N)c1nc(-c2ccc(OCCN3CCCC3)cc2)no1	ZINC000356676220	457114193	/nfs/dbraw/zinc/11/41/93/457114193.db2.gz	FAWOIBJDXRCVFL-UHFFFAOYSA-N	0	3	326.400	3.012	20	30		EGEDHN
COC(=O)c1ccc(C(C)C)c(NC(=O)NC2CCN(C)CC2)c1	ZINC000330991755	457116004	/nfs/dbraw/zinc/11/60/04/457116004.db2.gz	UBEHUPDSQHALKG-UHFFFAOYSA-N	0	3	333.432	3.017	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)[C@H](CC)N(CC)CC)cc1	ZINC000359797932	457130743	/nfs/dbraw/zinc/13/07/43/457130743.db2.gz	NPSIRAWGSCJHGP-SFHVURJKSA-N	0	3	331.460	3.452	20	30		EGEDHN
Cc1cccc(NC(=O)Nc2cccc(CNC(=O)C(C)C#N)c2)c1	ZINC000347062101	457211014	/nfs/dbraw/zinc/21/10/14/457211014.db2.gz	GLGWCNDXNQLDTK-AWEZNQCLSA-N	0	3	336.395	3.415	20	30		EGEDHN
Cc1nc(N(CCN(C)C)Cc2ccccc2)c(Cl)cc1C#N	ZINC000360057579	457229356	/nfs/dbraw/zinc/22/93/56/457229356.db2.gz	ZGETUDDLRJPOJV-UHFFFAOYSA-N	0	3	328.847	3.483	20	30		EGEDHN
COc1ccc(C(=O)C(C#N)c2ccncn2)cc1-c1ccccn1	ZINC000354472653	457246495	/nfs/dbraw/zinc/24/64/95/457246495.db2.gz	PEFJQTRFKKUSLV-OAHLLOKOSA-N	0	3	330.347	3.037	20	30		EGEDHN
CCCOc1c(Cl)cc(C(=O)C(C#N)c2ccncn2)cc1OC	ZINC000354476294	457247983	/nfs/dbraw/zinc/24/79/83/457247983.db2.gz	ZDEYZZMSIJTCIU-LBPRGKRZSA-N	0	3	345.786	3.417	20	30		EGEDHN
C=CCOCCCC(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000354725854	457316488	/nfs/dbraw/zinc/31/64/88/457316488.db2.gz	ZPPMRHVDIPIEBE-IBGZPJMESA-N	0	3	330.472	3.092	20	30		EGEDHN
N#Cc1ccc(S(=O)(=O)CCN[C@@H](c2cccs2)C2CC2)cc1	ZINC000342472767	457323843	/nfs/dbraw/zinc/32/38/43/457323843.db2.gz	RMQWSIPCIIQFHC-QGZVFWFLSA-N	0	3	346.477	3.134	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccc(CC#N)cc2)C1	ZINC000340102124	457333497	/nfs/dbraw/zinc/33/34/97/457333497.db2.gz	LVUGHIWJNOPTAS-UZLBHIALSA-N	0	3	333.435	3.318	20	30		EGEDHN
CC(=O)Nc1c[nH]nc1[C@@H]1CCCN([C@@H](C)c2cccc(C#N)c2)C1	ZINC000332366013	457357196	/nfs/dbraw/zinc/35/71/96/457357196.db2.gz	VWLRIEQMPZWUTR-SUMWQHHRSA-N	0	3	337.427	3.180	20	30		EGEDHN
C=CCN1CCC(NC(=O)CCCSc2ccc(OC)cc2)CC1	ZINC000352444603	457371870	/nfs/dbraw/zinc/37/18/70/457371870.db2.gz	FAYGUUXRSDBESU-UHFFFAOYSA-N	0	3	348.512	3.334	20	30		EGEDHN
C=CCS(=O)(=O)CCN[C@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1	ZINC000378184489	457381412	/nfs/dbraw/zinc/38/14/12/457381412.db2.gz	PJQBNXZZBRZBEG-GRYCIOLGSA-N	0	3	333.906	3.084	20	30		EGEDHN
N#CCCCOc1cccc(CN(CCO)[C@H]2CCCSC2)c1	ZINC000355563485	457388983	/nfs/dbraw/zinc/38/89/83/457388983.db2.gz	JHXPOLTVALFROT-KRWDZBQOSA-N	0	3	334.485	3.059	20	30		EGEDHN
C[C@@H](NCc1cccc(-n2cncn2)c1)c1ccc(OCC#N)cc1	ZINC000378460270	457401156	/nfs/dbraw/zinc/40/11/56/457401156.db2.gz	VKOFZAJELDZFRQ-OAHLLOKOSA-N	0	3	333.395	3.020	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C1(C#N)CCCC1	ZINC000398171765	457497127	/nfs/dbraw/zinc/49/71/27/457497127.db2.gz	PAGFWIDHMUXMCJ-WMZOPIPTSA-N	0	3	325.456	3.097	20	30		EGEDHN
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@H](NCc3ccc(C#N)o3)C[C@@H]2C1	ZINC000401121707	457523678	/nfs/dbraw/zinc/52/36/78/457523678.db2.gz	OOAPMHJYJPMWIF-RRFJBIMHSA-N	0	3	345.443	3.276	20	30		EGEDHN
C=CCOc1cccc(CN2CCC[C@H]2C[C@H](O)c2cnn(C)c2)c1	ZINC000374254940	457547524	/nfs/dbraw/zinc/54/75/24/457547524.db2.gz	HCQHHYSADJINSQ-ICSRJNTNSA-N	0	3	341.455	3.073	20	30		EGEDHN
C[C@@H](CC#N)N(C)C(=O)[C@H](C)N1CCC(Cc2ccccc2)CC1	ZINC000347623372	457556372	/nfs/dbraw/zinc/55/63/72/457556372.db2.gz	XRZTVBVULBNQCH-IRXDYDNUSA-N	0	3	327.472	3.090	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N(C)C[C@@H](O)COc1ccc(F)cc1	ZINC000425531932	457587569	/nfs/dbraw/zinc/58/75/69/457587569.db2.gz	AUNJOTUBNGYLIG-KBXCAEBGSA-N	0	3	328.387	3.130	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](c2ccc(F)cc2)C(C)C)CC1	ZINC000410269744	457635954	/nfs/dbraw/zinc/63/59/54/457635954.db2.gz	PGUGYMBZYXKHQT-SFHVURJKSA-N	0	3	333.451	3.472	20	30		EGEDHN
N#CC(C(=O)c1ccc(OC(F)F)cn1)c1nc2ccccc2[nH]1	ZINC000357777528	457685721	/nfs/dbraw/zinc/68/57/21/457685721.db2.gz	DWTWORQSPNYECQ-SNVBAGLBSA-N	0	3	328.278	3.049	20	30		EGEDHN
Cc1nn(C)cc1[C@H](C)N[C@H]1CCCN(c2ccc(C#N)cc2F)C1	ZINC000361346103	457701663	/nfs/dbraw/zinc/70/16/63/457701663.db2.gz	MMBIHIZJNSESDN-BBRMVZONSA-N	0	3	341.434	3.059	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)N[C@@H](C)[C@@H](c1ccccc1C)N(C)C	ZINC000357859387	457715391	/nfs/dbraw/zinc/71/53/91/457715391.db2.gz	VMIVHGSSNQCXQF-UGSOOPFHSA-N	0	3	325.412	3.189	20	30		EGEDHN
Cc1ccccc1[C@H]([C@H](C)NC(=O)Cc1ccc(C#N)cc1)N(C)C	ZINC000357879190	457721632	/nfs/dbraw/zinc/72/16/32/457721632.db2.gz	VJJSDRXKALGWSM-KKSFZXQISA-N	0	3	335.451	3.217	20	30		EGEDHN
CCC[C@H](C#N)N(C)C(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F	ZINC000410836466	457761685	/nfs/dbraw/zinc/76/16/85/457761685.db2.gz	RTDGXVBRBMNOHG-IAGOWNOFSA-N	0	3	349.425	3.294	20	30		EGEDHN
N#CC(C(=O)c1ccc2nccnc2c1)c1cnc2ccccc2n1	ZINC000361530958	457775025	/nfs/dbraw/zinc/77/50/25/457775025.db2.gz	NEPGLKBUASCTTL-ZDUSSCGKSA-N	0	3	325.331	3.063	20	30		EGEDHN
C#CCCCCNC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000366051351	457789804	/nfs/dbraw/zinc/78/98/04/457789804.db2.gz	BEMYVEOMGKGHIF-LJQANCHMSA-N	0	3	327.472	3.001	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC[C@](C)(c3ccc(C)cc3)C2)CC1	ZINC000366102576	457793093	/nfs/dbraw/zinc/79/30/93/457793093.db2.gz	GKECPCHGHVVFMG-NRFANRHFSA-N	0	3	341.499	3.318	20	30		EGEDHN
Cc1ccc([C@@H]2COCCN2C(=O)C(C#N)CCc2ccccc2)o1	ZINC000433347061	457816447	/nfs/dbraw/zinc/81/64/47/457816447.db2.gz	KJILMIVZAHCEBE-ROUUACIJSA-N	0	3	338.407	3.261	20	30		EGEDHN
Cc1cccc(N(CCC#N)C(=O)CN2CC[C@@H]3CCC[C@H]32)c1C	ZINC000426476731	457838053	/nfs/dbraw/zinc/83/80/53/457838053.db2.gz	VVIJWZXLAKACRX-PKOBYXMFSA-N	0	3	325.456	3.425	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)NC[C@H]1CCCCN1C1CC1	ZINC000433920660	457911714	/nfs/dbraw/zinc/91/17/14/457911714.db2.gz	QTNNOGDLHXNKJE-GOSISDBHSA-N	0	3	343.471	3.068	20	30		EGEDHN
COc1cccc2c1C[C@@H](NC(=O)C(C#N)CCc1ccccc1)C2	ZINC000458071946	457921783	/nfs/dbraw/zinc/92/17/83/457921783.db2.gz	CJJQDMJSYGPEBG-ROUUACIJSA-N	0	3	334.419	3.051	20	30		EGEDHN
CN(CC(C)(C)C#N)C(=O)NC[C@@H]1CCCN(Cc2cccs2)C1	ZINC000458098584	457931298	/nfs/dbraw/zinc/93/12/98/457931298.db2.gz	HHKIAZPABIELAO-HNNXBMFYSA-N	0	3	348.516	3.151	20	30		EGEDHN
CC(C)(CC#N)CNC(=O)NCC1CCN(Cc2cccs2)CC1	ZINC000458111773	457935997	/nfs/dbraw/zinc/93/59/97/457935997.db2.gz	PQUBYFVVEZBNHT-UHFFFAOYSA-N	0	3	348.516	3.199	20	30		EGEDHN
C=CCN1CCC(NC(=O)CCCCC(=O)c2ccc(F)cc2)CC1	ZINC000427085992	457941905	/nfs/dbraw/zinc/94/19/05/457941905.db2.gz	HWIRPGRFHREVSU-UHFFFAOYSA-N	0	3	346.446	3.335	20	30		EGEDHN
C=CCN(Cc1cccc(C#N)c1)C(=O)[C@H](C)N1[C@H](C)CC[C@H]1C	ZINC000411713005	457958821	/nfs/dbraw/zinc/95/88/21/457958821.db2.gz	VNAPTGZHXRDQNZ-ZACQAIPSSA-N	0	3	325.456	3.334	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)c(F)c1)C[C@H](O)COc1ccccc1	ZINC000444808708	457982971	/nfs/dbraw/zinc/98/29/71/457982971.db2.gz	VCFOKGUDSMMKCC-SFHVURJKSA-N	0	3	342.414	3.348	20	30		EGEDHN
C#Cc1ccc(CN2CCC(c3nc(-c4ccccn4)no3)CC2)cc1	ZINC000368017255	458005613	/nfs/dbraw/zinc/00/56/13/458005613.db2.gz	HLMNQXRSTMOJMQ-UHFFFAOYSA-N	0	3	344.418	3.493	20	30		EGEDHN
C=C(C)COc1cc(CN2CC[C@@](CO)(C(C)C)C2)ccc1OC	ZINC000368219158	458019108	/nfs/dbraw/zinc/01/91/08/458019108.db2.gz	ACNXLEYKRGCCLR-HXUWFJFHSA-N	0	3	333.472	3.491	20	30		EGEDHN
N#CC(=C([O-])c1cccc([N+](=O)[O-])c1)c1cc(C(F)(F)F)ccn1	ZINC000362192463	458040831	/nfs/dbraw/zinc/04/08/31/458040831.db2.gz	SPQPNALZQXIDJQ-LBPRGKRZSA-N	0	3	335.241	3.499	20	30		EGEDHN
N#CC(C(=O)c1cccc([N+](=O)[O-])c1)c1cc(C(F)(F)F)ccn1	ZINC000362192463	458040836	/nfs/dbraw/zinc/04/08/36/458040836.db2.gz	SPQPNALZQXIDJQ-LBPRGKRZSA-N	0	3	335.241	3.499	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CCC[C@H](N2CCCC2=O)CC1	ZINC000412055157	458070295	/nfs/dbraw/zinc/07/02/95/458070295.db2.gz	KOCCBAQPIBDSGO-SFHVURJKSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]([C@H](C)CC)C(F)(F)F)CC1	ZINC000446291774	458172808	/nfs/dbraw/zinc/17/28/08/458172808.db2.gz	BZEQDNMQSPYXIF-OCCSQVGLSA-N	0	3	335.414	3.303	20	30		EGEDHN
CN1CC[C@@H]2CCN(C(=O)N[C@H](CCCC#N)c3ccccc3)[C@@H]2C1	ZINC000458805914	458178663	/nfs/dbraw/zinc/17/86/63/458178663.db2.gz	VQQZEXZPNLIBIG-GUDVDZBRSA-N	0	3	340.471	3.157	20	30		EGEDHN
Cc1ccc(CC2CCN([C@H](C)C(=O)N(C)CCC#N)CC2)cc1C	ZINC000428721754	458199555	/nfs/dbraw/zinc/19/95/55/458199555.db2.gz	FLAFPRAHSHPBAG-GOSISDBHSA-N	0	3	341.499	3.319	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N(C)C1CCN(Cc2ccccc2)CC1)OCC	ZINC000372304079	458272127	/nfs/dbraw/zinc/27/21/27/458272127.db2.gz	BDRXAFAYXAQQOM-FQEVSTJZSA-N	0	3	344.499	3.481	20	30		EGEDHN
N#Cc1cnc(NCc2ccc(OCCN3CCCC3)cc2)c(F)c1	ZINC000413150998	458293776	/nfs/dbraw/zinc/29/37/76/458293776.db2.gz	YEBKRYSMKOOAJI-UHFFFAOYSA-N	0	3	340.402	3.179	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NC(=O)N(C)CC1CCN(C)CC1	ZINC000413828467	458308609	/nfs/dbraw/zinc/30/86/09/458308609.db2.gz	UWXCQKRIUSVBGI-LJQANCHMSA-N	0	3	329.488	3.157	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)NC(=O)N1CCCC12CCN(C)CC2	ZINC000413841772	458310831	/nfs/dbraw/zinc/31/08/31/458310831.db2.gz	XCXYJNHPQLXTOY-IBGZPJMESA-N	0	3	341.499	3.444	20	30		EGEDHN
CC(C)OC1CC(N2CCCN(Cc3ccc(C#N)cc3)CC2)C1	ZINC000459274288	458312127	/nfs/dbraw/zinc/31/21/27/458312127.db2.gz	BDXYILYCOQTLLN-UHFFFAOYSA-N	0	3	327.472	3.022	20	30		EGEDHN
C=CCOc1cccc(CN2CCC[C@H](N3CCCC3=O)CC2)c1	ZINC000414555486	458324168	/nfs/dbraw/zinc/32/41/68/458324168.db2.gz	UMZYFLGYXCSGRH-SFHVURJKSA-N	0	3	328.456	3.228	20	30		EGEDHN
C[C@@H](CC#N)Sc1ccccc1NC(=O)N1C[C@@H](C)NC[C@H]1C	ZINC000415161576	458329166	/nfs/dbraw/zinc/32/91/66/458329166.db2.gz	MSFXGFYIQAHQJW-MCIONIFRSA-N	0	3	332.473	3.295	20	30		EGEDHN
N#C[C@@H](NC(=O)C12CCCN1CCC2)c1cccc(Cl)c1Cl	ZINC000415374424	458331770	/nfs/dbraw/zinc/33/17/70/458331770.db2.gz	IRIGKBXWZUZBIM-CYBMUJFWSA-N	0	3	338.238	3.303	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Nc1ccc(OC)c(N)c1)C(C)C	ZINC000415819337	458334190	/nfs/dbraw/zinc/33/41/90/458334190.db2.gz	ZAKWLZXUHDXBBG-KRWDZBQOSA-N	0	3	346.475	3.098	20	30		EGEDHN
C[C@@](C#N)(NC(=O)CN1CC[C@H](c2ccccc2)C1(C)C)C1CC1	ZINC000421013199	458405864	/nfs/dbraw/zinc/40/58/64/458405864.db2.gz	FYXBHRVKWMCOPN-XLIONFOSSA-N	0	3	325.456	3.063	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN[C@H](CC(F)F)c2ccccc2)cc1	ZINC000420990083	458406114	/nfs/dbraw/zinc/40/61/14/458406114.db2.gz	ZSUNRHILUJMUML-SJLPKXTDSA-N	0	3	346.377	3.284	20	30		EGEDHN
C=CCOc1ccc(CC(=O)NC[C@@H](C)N2CCC(C)CC2)cc1	ZINC000448810163	458411030	/nfs/dbraw/zinc/41/10/30/458411030.db2.gz	HSARLKKOGMMYHS-QGZVFWFLSA-N	0	3	330.472	3.031	20	30		EGEDHN
C=C(C)CCNCc1cc(I)cc([N+](=O)[O-])c1	ZINC000449477272	458424707	/nfs/dbraw/zinc/42/47/07/458424707.db2.gz	OWTRVRXEQUYRAP-UHFFFAOYSA-N	0	3	346.168	3.255	20	30		EGEDHN
C=CCc1cc(CN(C)[C@H](CO)c2ccccc2)cc(OC)c1O	ZINC000449459689	458424920	/nfs/dbraw/zinc/42/49/20/458424920.db2.gz	YLVIMFQQPUHSEY-GOSISDBHSA-N	0	3	327.424	3.295	20	30		EGEDHN
C[C@@H](CC(=O)N(C)c1ccccc1)NCc1ccc(C#N)c(F)c1	ZINC000449736103	458430003	/nfs/dbraw/zinc/43/00/03/458430003.db2.gz	KVTGNZISCWDZPB-AWEZNQCLSA-N	0	3	325.387	3.229	20	30		EGEDHN
COc1ccc(CN2CC(C)(C)[C@@H]3COC[C@@H]32)cc1OCCCC#N	ZINC000449783402	458431509	/nfs/dbraw/zinc/43/15/09/458431509.db2.gz	OVURCQJRTATNIT-SJORKVTESA-N	0	3	344.455	3.235	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)CCCC1	ZINC000449824896	458431842	/nfs/dbraw/zinc/43/18/42/458431842.db2.gz	FZEVTALIKBCDSW-HDICACEKSA-N	0	3	348.531	3.471	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN(C)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000459670963	458442551	/nfs/dbraw/zinc/44/25/51/458442551.db2.gz	GHFJTVBIYCYWBN-NZSAHSFTSA-N	0	3	327.472	3.263	20	30		EGEDHN
CCCCN(CC(=O)N[C@](C)(C#N)C(C)C)[C@@H]1CCCC[C@H]1OC	ZINC000451652726	458484456	/nfs/dbraw/zinc/48/44/56/458484456.db2.gz	QNLZKAKCFMGXCF-ZHALLVOQSA-N	0	3	337.508	3.101	20	30		EGEDHN
COC(=O)[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@@H]1c1ccccc1	ZINC000452007331	458493199	/nfs/dbraw/zinc/49/31/99/458493199.db2.gz	QFXFYTNJKSUSHC-QZTJIDSGSA-N	0	3	338.382	3.086	20	30		EGEDHN
C[C@H](NCCS(=O)(=O)c1ccc(C#N)cc1)[C@@H]1CCC[C@H](C)C1	ZINC000452073293	458493957	/nfs/dbraw/zinc/49/39/57/458493957.db2.gz	VCBDESYOWLHCCB-YQQAZPJKSA-N	0	3	334.485	3.136	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCC[C@H]2CCc3ccccc32)cc1	ZINC000452314847	458498932	/nfs/dbraw/zinc/49/89/32/458498932.db2.gz	LOKOFPRLBDLRHY-WOJBJXKFSA-N	0	3	343.430	3.477	20	30		EGEDHN
C=C(CC)CN[C@@H](C)c1ccc(S(=O)(=O)NCc2ccco2)cc1	ZINC000453359505	458524260	/nfs/dbraw/zinc/52/42/60/458524260.db2.gz	MJSKZOBYDMLMPN-HNNXBMFYSA-N	0	3	348.468	3.375	20	30		EGEDHN
C=C(C)Cn1c([C@@H]2CCCCO2)nnc1N1CCN([C@@H](C)CC)CC1	ZINC000453464884	458533430	/nfs/dbraw/zinc/53/34/30/458533430.db2.gz	MEPLQYHDXBGCDJ-IRXDYDNUSA-N	0	3	347.507	3.016	20	30		EGEDHN
Cc1nc(NC(=O)[C@@H](N)CCCC#N)sc1Cc1ccc(C)cc1	ZINC000424088705	458555869	/nfs/dbraw/zinc/55/58/69/458555869.db2.gz	HIBDMOIBKTZARF-HNNXBMFYSA-N	0	3	342.468	3.310	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N(CCc1ccccc1F)C1CCCC1	ZINC000424092152	458557332	/nfs/dbraw/zinc/55/73/32/458557332.db2.gz	GCJDIHSHLDIWGM-SFHVURJKSA-N	0	3	331.435	3.161	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)NCc1ccc(OC2CCCCC2)cc1	ZINC000424114824	458562107	/nfs/dbraw/zinc/56/21/07/458562107.db2.gz	SFQOLIPUAYCABN-SFHVURJKSA-N	0	3	329.444	3.035	20	30		EGEDHN
CC(C)(NC(=O)[C@@H](N)CCCC#N)c1ccc(Cl)c(Cl)c1	ZINC000424115569	458562194	/nfs/dbraw/zinc/56/21/94/458562194.db2.gz	VONGOKYUVLKWSF-ZDUSSCGKSA-N	0	3	328.243	3.366	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)Cc2ccc(C)c(C)c2)CC1	ZINC000454456220	458562459	/nfs/dbraw/zinc/56/24/59/458562459.db2.gz	CPAMWPCWSYWQCZ-UHFFFAOYSA-N	0	3	329.488	3.485	20	30		EGEDHN
CC(C)COc1ccc(C(C)(C)NC(=O)[C@H](N)CCCC#N)cc1	ZINC000424136013	458567304	/nfs/dbraw/zinc/56/73/04/458567304.db2.gz	KFRDDOCMUCPOCK-QGZVFWFLSA-N	0	3	331.460	3.094	20	30		EGEDHN
CC[C@H](C(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1)N(CC)CC	ZINC000461757891	458571868	/nfs/dbraw/zinc/57/18/68/458571868.db2.gz	YADOUYPKUZBQJF-OTWHNJEPSA-N	0	3	327.472	3.405	20	30		EGEDHN
C[C@@H]1[C@H](NC(=O)N[C@@H](CCCC#N)c2ccccc2)CCCN1C	ZINC000431457568	458575645	/nfs/dbraw/zinc/57/56/45/458575645.db2.gz	JKNDZBTZSFAAAJ-NXHRZFHOSA-N	0	3	328.460	3.203	20	30		EGEDHN
COc1ccc(OCc2ccccn2)c(CN[C@@H]2CC[C@H](C#N)C2)c1	ZINC000424190820	458581943	/nfs/dbraw/zinc/58/19/43/458581943.db2.gz	GQLRZCKUJLKTAJ-DOTOQJQBSA-N	0	3	337.423	3.451	20	30		EGEDHN
C[C@H](CN1CCC[C@H](C)C1)NC(=O)C(C)(C)Cc1ccc(C#N)cc1	ZINC000454995216	458582237	/nfs/dbraw/zinc/58/22/37/458582237.db2.gz	NJAFJEJCFLKADL-DLBZAZTESA-N	0	3	341.499	3.364	20	30		EGEDHN
N#C[C@H]1CC[C@@H](NCc2ccc(I)cc2)C1	ZINC000424199887	458582830	/nfs/dbraw/zinc/58/28/30/458582830.db2.gz	LDLJNDFHYABAFS-WCQYABFASA-N	0	3	326.181	3.073	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N[C@H]1CCc2ccc(-c3ccccc3)cc21	ZINC000424195640	458583098	/nfs/dbraw/zinc/58/30/98/458583098.db2.gz	YFXMBNIVBBIMSJ-PMACEKPBSA-N	0	3	333.435	3.478	20	30		EGEDHN
C[C@H](CNC(=O)C(C)(C)Cc1ccc(C#N)cc1)N1CCC(C)CC1	ZINC000455110272	458586029	/nfs/dbraw/zinc/58/60/29/458586029.db2.gz	ZAEIEHIIKQSIJR-QGZVFWFLSA-N	0	3	341.499	3.364	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCCN(c3ccc(C#N)cc3F)C2)s1	ZINC000378004143	458597017	/nfs/dbraw/zinc/59/70/17/458597017.db2.gz	MYIALCQHQHNDBF-AWEZNQCLSA-N	0	3	340.427	3.389	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NC1CCN([C@H](C)c2ccccc2)CC1	ZINC000424499870	458650502	/nfs/dbraw/zinc/65/05/02/458650502.db2.gz	GXMKBEFGKBBDJY-AHRSYUTCSA-N	0	3	342.483	3.309	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C(C)(C)COCc2ccccc2)CC1	ZINC000503317652	458702111	/nfs/dbraw/zinc/70/21/11/458702111.db2.gz	YKXSYFYOPBMXAL-UHFFFAOYSA-N	0	3	344.499	3.386	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N(C)Cc1ccc(O)cc1)C(C)C	ZINC000503439354	458708506	/nfs/dbraw/zinc/70/85/06/458708506.db2.gz	RYJWIAATGNIKRW-LJQANCHMSA-N	0	3	345.487	3.232	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Cc1cc(F)ccc1F)C(C)C	ZINC000463814444	458720184	/nfs/dbraw/zinc/72/01/84/458720184.db2.gz	MMFYXDQGIOKYGS-SFHVURJKSA-N	0	3	336.426	3.322	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@@H](C)N1CC[C@@H](c2ccc(OC)cc2)C1	ZINC000504488611	458739317	/nfs/dbraw/zinc/73/93/17/458739317.db2.gz	MUZXOKQNZPFMSM-SJLPKXTDSA-N	0	3	330.472	3.298	20	30		EGEDHN
C=C(C)CN(Cc1ccccc1)C(=O)N[C@@H]1CN(C2CC2)C[C@H]1C	ZINC000472046306	458763898	/nfs/dbraw/zinc/76/38/98/458763898.db2.gz	BTGUHXWKANDLIW-VQIMIIECSA-N	0	3	327.472	3.257	20	30		EGEDHN
C=CCOc1cccc(NC(=O)NC[C@@H](C)N2CCC[C@@H](C)C2)c1	ZINC000510718479	458776303	/nfs/dbraw/zinc/77/63/03/458776303.db2.gz	OHHDEAXJRIBVFH-HZPDHXFCSA-N	0	3	331.460	3.493	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCc1c(F)cc(F)cc1F	ZINC000511118196	458777970	/nfs/dbraw/zinc/77/79/70/458777970.db2.gz	ALYOSMJDUMQIBY-CYBMUJFWSA-N	0	3	332.325	3.493	20	30		EGEDHN
C=C(CNC(=O)N1CCC[C@H]1CN1CCCCC1)c1ccccc1	ZINC000512668506	458786776	/nfs/dbraw/zinc/78/67/76/458786776.db2.gz	VJQILQNAOKJMGD-IBGZPJMESA-N	0	3	327.472	3.360	20	30		EGEDHN
C[C@H]1[C@H](Cc2ccccc2)CCN1CC(=O)Nc1cccc(C#N)c1	ZINC000472343265	458788116	/nfs/dbraw/zinc/78/81/16/458788116.db2.gz	JUXFIBDDFWMLDZ-LPHOPBHVSA-N	0	3	333.435	3.450	20	30		EGEDHN
C[C@H]1C[C@@H](c2ccccc2)N(CC(=O)NCc2ccc(C#N)cc2)C1	ZINC000513227083	458792575	/nfs/dbraw/zinc/79/25/75/458792575.db2.gz	AKXQUXHKAINKCW-JXFKEZNVSA-N	0	3	333.435	3.258	20	30		EGEDHN
C=CCCCCCN(C)Cc1cc(Cl)cc(S(N)(=O)=O)c1	ZINC000515063695	458805448	/nfs/dbraw/zinc/80/54/48/458805448.db2.gz	YFMGYJOVQBGGLD-UHFFFAOYSA-N	0	3	330.881	3.166	20	30		EGEDHN
CCCN(CCN1CCCCCC1)C(=O)Cc1cccc(C#N)c1	ZINC000516811152	458821704	/nfs/dbraw/zinc/82/17/04/458821704.db2.gz	GETLIZPSJDHUFV-UHFFFAOYSA-N	0	3	327.472	3.215	20	30		EGEDHN
CCN(CCC#N)C(=O)CN[C@@H]1CC(C)(C)CCc2ccccc21	ZINC000440619813	458833721	/nfs/dbraw/zinc/83/37/21/458833721.db2.gz	CKLMHIXEEKQHPJ-GOSISDBHSA-N	0	3	327.472	3.442	20	30		EGEDHN
C=CC[C@@H](CO)N[C@@H](C)c1ccc(CNC(=O)OC(C)(C)C)nc1C	ZINC000495377482	458845114	/nfs/dbraw/zinc/84/51/14/458845114.db2.gz	PSIWSJZGVWFEGT-HOCLYGCPSA-N	0	3	349.475	3.002	20	30		EGEDHN
CCCCN(C)CCNC(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1	ZINC000465914401	458862006	/nfs/dbraw/zinc/86/20/06/458862006.db2.gz	AUQFMJOWQRVCJJ-RTBURBONSA-N	0	3	342.487	3.200	20	30		EGEDHN
CC(C)(C)N(CC(=O)NCc1ccc(C#N)cc1)Cc1ccccc1	ZINC000474271267	458872528	/nfs/dbraw/zinc/87/25/28/458872528.db2.gz	IXRLFSQWDXAVMP-UHFFFAOYSA-N	0	3	335.451	3.475	20	30		EGEDHN
CC(C)(C)N(CC(=O)NCc1cccc(C#N)c1)Cc1ccccc1	ZINC000474278052	458874375	/nfs/dbraw/zinc/87/43/75/458874375.db2.gz	NPJSXMOWSLFXDB-UHFFFAOYSA-N	0	3	335.451	3.475	20	30		EGEDHN
C=CCn1c(CC2CCCCC2)nnc1N1CC[C@H](N2CCCC2)C1	ZINC000548853889	458875468	/nfs/dbraw/zinc/87/54/68/458875468.db2.gz	NBZOKXGNUOOKGU-SFHVURJKSA-N	0	3	343.519	3.261	20	30		EGEDHN
C=CCn1c(CC)nnc1N1CCN(Cc2ccccc2)C(C)(C)C1	ZINC000548913149	458876672	/nfs/dbraw/zinc/87/66/72/458876672.db2.gz	GSIMUXHETSCEAU-UHFFFAOYSA-N	0	3	339.487	3.127	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CCC(OC(C)C)CC1	ZINC000531163998	458881973	/nfs/dbraw/zinc/88/19/73/458881973.db2.gz	IRMLGOCTLWOOSW-SFHVURJKSA-N	0	3	333.472	3.044	20	30		EGEDHN
CC(C)N(CCC#N)C(=O)[C@@H]1CN(C(C)(C)C)C[C@H]1C(F)(F)F	ZINC000550354382	458885372	/nfs/dbraw/zinc/88/53/72/458885372.db2.gz	MWTSONWUEOXKIZ-CHWSQXEVSA-N	0	3	333.398	3.046	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])CC1	ZINC000550381644	458885400	/nfs/dbraw/zinc/88/54/00/458885400.db2.gz	KXLYFZNEQPARKZ-UHFFFAOYSA-N	0	3	345.443	3.029	20	30		EGEDHN
Cc1cc(C#N)cc(NC(=O)N2CCN(C3CCC3)C[C@H](C)C2)c1	ZINC000518705719	458886737	/nfs/dbraw/zinc/88/67/37/458886737.db2.gz	OJEHRLPCVBHJST-HNNXBMFYSA-N	0	3	326.444	3.205	20	30		EGEDHN
C=CCNC(=O)NC(=O)CN(CC(C)C)[C@@H](C)c1ccccc1C	ZINC000551723838	458888983	/nfs/dbraw/zinc/88/89/83/458888983.db2.gz	SJFJYNAUVFNMLX-INIZCTEOSA-N	0	3	331.460	3.026	20	30		EGEDHN
CC[C@](C)(C#N)c1nc(-c2ccc3c(c2)C(SC)C(=O)N3)no1	ZINC000554808081	458901446	/nfs/dbraw/zinc/90/14/46/458901446.db2.gz	KKJFIMLEYBXHST-MLGOLLRUSA-N	0	3	328.397	3.284	20	30		EGEDHN
CC(C)(C)c1ccc(OC[C@@H](O)CNCc2cccc(C#N)c2)cc1	ZINC000518964049	458902455	/nfs/dbraw/zinc/90/24/55/458902455.db2.gz	XVKJKDVWRAMSGM-IBGZPJMESA-N	0	3	338.451	3.385	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@]1(C)CCN(Cc2ccc(C#N)cc2)C1	ZINC000495659113	458911191	/nfs/dbraw/zinc/91/11/91/458911191.db2.gz	RDJRTVPXJUSCSQ-IBGZPJMESA-N	0	3	329.444	3.295	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@@H](C)N1CCC[C@@H]1c1cccc(N(C)C)c1	ZINC000441347514	458924533	/nfs/dbraw/zinc/92/45/33/458924533.db2.gz	ALJNTDTTYJCICI-YLJYHZDGSA-N	0	3	341.499	3.479	20	30		EGEDHN
N#Cc1nccc(N2CCN(Cc3ccccc3)C3(CCCCC3)C2)n1	ZINC000566485257	458947272	/nfs/dbraw/zinc/94/72/72/458947272.db2.gz	CXQORIXGYJYNQX-UHFFFAOYSA-N	0	3	347.466	3.373	20	30		EGEDHN
C=CCCN(C)CC(=O)NC[C@H](c1ccccc1Cl)N1CCCC1	ZINC000467296421	458966434	/nfs/dbraw/zinc/96/64/34/458966434.db2.gz	DFAJMQZDDNBOPB-GOSISDBHSA-N	0	3	349.906	3.101	20	30		EGEDHN
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NCc1ccc(C#N)c(F)c1	ZINC000556514732	458968346	/nfs/dbraw/zinc/96/83/46/458968346.db2.gz	HZZCXUVTUMEIRM-KSSFIOAISA-N	0	3	340.398	3.207	20	30		EGEDHN
CN(C[C@H](O)CNc1ccc(Oc2ccc(C#N)cc2)cc1)C1CC1	ZINC000577098827	458979215	/nfs/dbraw/zinc/97/92/15/458979215.db2.gz	JXTOOWVPSGMEFV-GOSISDBHSA-N	0	3	337.423	3.218	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN[C@@H]1CCCc2occc21	ZINC000566792297	459000797	/nfs/dbraw/zinc/00/07/97/459000797.db2.gz	QAWBSSLQXGXTNF-FUHWJXTLSA-N	0	3	327.424	3.415	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC[C@H](C(F)(F)F)C2(C)C)CC1	ZINC000468327714	459014435	/nfs/dbraw/zinc/01/44/35/459014435.db2.gz	RTJUHFVQAGOFKB-ZDUSSCGKSA-N	0	3	333.398	3.009	20	30		EGEDHN
C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NCc1cccc(F)c1C#N	ZINC000495966951	459022036	/nfs/dbraw/zinc/02/20/36/459022036.db2.gz	FZDPCKWSLIPCJP-CXAGYDPISA-N	0	3	347.434	3.432	20	30		EGEDHN
C[C@H](c1ccccc1)N1CCC(NC(=O)C2(C#N)CC(C)C2)CC1	ZINC000532065024	459024817	/nfs/dbraw/zinc/02/48/17/459024817.db2.gz	QTABOKULJFGECD-LFDOHDQPSA-N	0	3	325.456	3.268	20	30		EGEDHN
Cc1c(C#N)cccc1NC(=O)N1CCN(C2CCC2)C[C@@H](C)C1	ZINC000577453186	459033471	/nfs/dbraw/zinc/03/34/71/459033471.db2.gz	KSUIUSZOTSGQKN-CQSZACIVSA-N	0	3	326.444	3.205	20	30		EGEDHN
N#Cc1cccc(CNC(=O)CN(Cc2ccccc2)CC2CCC2)c1	ZINC000520169112	459035189	/nfs/dbraw/zinc/03/51/89/459035189.db2.gz	WOOSTYJNSVIEAU-UHFFFAOYSA-N	0	3	347.462	3.477	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1C)C(C)C	ZINC000496014675	459037607	/nfs/dbraw/zinc/03/76/07/459037607.db2.gz	PONCOGHMMBGKIY-GOSISDBHSA-N	0	3	345.443	3.332	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)[C@@H]1COc2ccccc2C1)C(C)C	ZINC000496029666	459043209	/nfs/dbraw/zinc/04/32/09/459043209.db2.gz	RQEPOAJZLHDIMO-OALUTQOASA-N	0	3	342.483	3.053	20	30		EGEDHN
CC(=O)NCC[C@H]1CCCN(Cc2cccc(OCCCC#N)c2)C1	ZINC000558426160	459157771	/nfs/dbraw/zinc/15/77/71/459157771.db2.gz	GJXQNNCMPMYSBJ-GOSISDBHSA-N	0	3	343.471	3.107	20	30		EGEDHN
CN(C)CCc1ccccc1NC(=O)N1CCC(CCC#N)CC1	ZINC000567813518	459171494	/nfs/dbraw/zinc/17/14/94/459171494.db2.gz	FWEPQAXMCOMCRJ-UHFFFAOYSA-N	0	3	328.460	3.338	20	30		EGEDHN
COC(=O)[C@@H]1CCC[C@@H]1NCc1ccc(C#N)cc1C(F)(F)F	ZINC000590658860	459173536	/nfs/dbraw/zinc/17/35/36/459173536.db2.gz	HQCZSSQGLUBHGP-OCCSQVGLSA-N	0	3	326.318	3.008	20	30		EGEDHN
CC(C)C[C@@H](CN1CCCC1)NC(=O)N[C@@H](C)c1cccc(C#N)c1	ZINC000590807514	459228607	/nfs/dbraw/zinc/22/86/07/459228607.db2.gz	IJBNROKJCXLAPW-LPHOPBHVSA-N	0	3	342.487	3.429	20	30		EGEDHN
C=CCOCCN[C@]1(Cc2ccc(C(F)(F)F)cc2)CCOC1	ZINC000559248242	459244839	/nfs/dbraw/zinc/24/48/39/459244839.db2.gz	PIRPTMUQEDIAQC-INIZCTEOSA-N	0	3	329.362	3.199	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCCCSc1ccccn1	ZINC000579483739	459247256	/nfs/dbraw/zinc/24/72/56/459247256.db2.gz	USVXVUVDRDJDDA-KRWDZBQOSA-N	0	3	339.464	3.453	20	30		EGEDHN
C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1CN[C@@H]1CC[C@H](C#N)C1	ZINC000496716512	459297564	/nfs/dbraw/zinc/29/75/64/459297564.db2.gz	MZXNIHKAXGYQSV-BYNSBNAKSA-N	0	3	337.464	3.029	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](C2CCCCC2)C(F)(F)F)CC1	ZINC000482270526	459299690	/nfs/dbraw/zinc/29/96/90/459299690.db2.gz	FOFJADOPQCSHDD-OAHLLOKOSA-N	0	3	347.425	3.447	20	30		EGEDHN
N#C[C@@H]1CC[C@H](N[C@@H]2CCCN(c3ccc(OC(F)F)cc3)C2=O)C1	ZINC000582097036	459306142	/nfs/dbraw/zinc/30/61/42/459306142.db2.gz	SQUMQVROSPYTPR-DVOMOZLQSA-N	0	3	349.381	3.065	20	30		EGEDHN
CC(=O)NCCN(CCc1ccc(C#N)cc1)Cc1ccc(C)s1	ZINC000595476955	459316473	/nfs/dbraw/zinc/31/64/73/459316473.db2.gz	QNYVVBKIAZGBAU-UHFFFAOYSA-N	0	3	341.480	3.109	20	30		EGEDHN
C=CC1CCN(C[C@@H](O)COc2cccc(C(F)(F)F)c2)CC1	ZINC000523607678	459316497	/nfs/dbraw/zinc/31/64/97/459316497.db2.gz	PGXYTYOYKPGJJZ-OAHLLOKOSA-N	0	3	329.362	3.343	20	30		EGEDHN
C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NCc1ccc(F)cc1C#N	ZINC000496776196	459319545	/nfs/dbraw/zinc/31/95/45/459319545.db2.gz	NVBNKQZWGQKVKP-DYVFJYSZSA-N	0	3	347.434	3.432	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NC[C@H](c1ccc(CC)cc1)N(C)C)OCC	ZINC000534416884	459326313	/nfs/dbraw/zinc/32/63/13/459326313.db2.gz	WTJJRAZLRBPYIP-RTBURBONSA-N	0	3	332.488	3.339	20	30		EGEDHN
CC(C)(C)c1ccc(OC[C@H](O)CN2CCC[C@@H](CC#N)C2)cc1	ZINC000595608906	459364277	/nfs/dbraw/zinc/36/42/77/459364277.db2.gz	BPTKMJNOJNCKHA-FUHWJXTLSA-N	0	3	330.472	3.349	20	30		EGEDHN
C=CCCC[C@@H](C)NC(=O)CCCN1CCN(c2ccccc2)CC1	ZINC000538331008	459370533	/nfs/dbraw/zinc/37/05/33/459370533.db2.gz	HNKNKCNFQQXEEM-LJQANCHMSA-N	0	3	343.515	3.450	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC[C@@H]2CCCC[C@H]2C(F)(F)F)CC1	ZINC000483740502	459387677	/nfs/dbraw/zinc/38/76/77/459387677.db2.gz	GNCWBPIDVVTOMT-DZGCQCFKSA-N	0	3	347.425	3.305	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1)OCC	ZINC000569090622	459393721	/nfs/dbraw/zinc/39/37/21/459393721.db2.gz	HQTURXGSZXBYJC-IRXDYDNUSA-N	0	3	338.879	3.430	20	30		EGEDHN
CCCOc1ccc(CN2CC[C@H](Oc3ccc(C#N)cn3)C2)cc1	ZINC000569181187	459408139	/nfs/dbraw/zinc/40/81/39/459408139.db2.gz	JFHLMBPDUQPKMT-IBGZPJMESA-N	0	3	337.423	3.395	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2NC[C@@H](O)COc1ccccc1F	ZINC000569232091	459418524	/nfs/dbraw/zinc/41/85/24/459418524.db2.gz	ITVPCUXWICPZOW-APWZRJJASA-N	0	3	340.398	3.104	20	30		EGEDHN
CCC[C@H](NC[C@H](O)COc1ccc(CC#N)cc1)c1ccccn1	ZINC000591734585	459426566	/nfs/dbraw/zinc/42/65/66/459426566.db2.gz	UNEGDHKNXMALFC-HKUYNNGSSA-N	0	3	339.439	3.018	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@H](NC/C=C/c3ccccc3)C2=O)cc1	ZINC000485257666	459447308	/nfs/dbraw/zinc/44/73/08/459447308.db2.gz	GJDXJUYQRAAGCT-BFSLETRISA-N	0	3	331.419	3.357	20	30		EGEDHN
CN(Cc1ccccc1)[C@H]1CCN(c2ncc3c(c2C#N)CCC3)C1	ZINC000591820760	459447576	/nfs/dbraw/zinc/44/75/76/459447576.db2.gz	RDVFAEZDJWGJSU-SFHVURJKSA-N	0	3	332.451	3.153	20	30		EGEDHN
N#CCC[C@@H](NC(=O)NC[C@H]1NCCc2ccccc21)c1ccccc1	ZINC000582954105	459457093	/nfs/dbraw/zinc/45/70/93/459457093.db2.gz	SJDPAMNLAOLHTR-WOJBJXKFSA-N	0	3	348.450	3.218	20	30		EGEDHN
Cc1ccccc1OC[C@H](O)CN[C@H]1CCCc2cc(C#N)ccc21	ZINC000569569182	459472732	/nfs/dbraw/zinc/47/27/32/459472732.db2.gz	WOSYYBDNRTVKQX-QUCCMNQESA-N	0	3	336.435	3.274	20	30		EGEDHN
C[C@H](Cc1ccsc1)N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000541882250	459505869	/nfs/dbraw/zinc/50/58/69/459505869.db2.gz	TXZRJXHLMMEPMA-RDTXWAMCSA-N	0	3	339.464	3.336	20	30		EGEDHN
N#Cc1nc(NC[C@@H]2CCCN(Cc3ccccc3)C2)sc1Cl	ZINC000596091997	459517817	/nfs/dbraw/zinc/51/78/17/459517817.db2.gz	HCVZANNDAHVBKM-AWEZNQCLSA-N	0	3	346.887	3.414	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H](C)Oc2ccc3c(c2)CCC3)CC1	ZINC000592075686	459520260	/nfs/dbraw/zinc/52/02/60/459520260.db2.gz	SWIYBOBIFSORAG-MRXNPFEDSA-N	0	3	342.483	3.099	20	30		EGEDHN
N#CC[C@]1(O)CCN(CCCCOc2cccc(C(F)(F)F)c2)C1	ZINC000592145914	459535727	/nfs/dbraw/zinc/53/57/27/459535727.db2.gz	BGFZIXRTBYKUDV-INIZCTEOSA-N	0	3	342.361	3.215	20	30		EGEDHN
C=CCCCCCN1CCC[C@H](S(=O)(=O)NC2CCCC2)C1	ZINC000488323823	459542913	/nfs/dbraw/zinc/54/29/13/459542913.db2.gz	RHYHUMXZRYWONL-KRWDZBQOSA-N	0	3	328.522	3.059	20	30		EGEDHN
C[C@@H]1OCC[C@]1(O)CN(Cc1ccc(C#N)s1)Cc1ccccc1	ZINC000583468230	459543640	/nfs/dbraw/zinc/54/36/40/459543640.db2.gz	METDQSRMTBXEGD-KXBFYZLASA-N	0	3	342.464	3.162	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C	ZINC000488957623	459557459	/nfs/dbraw/zinc/55/74/59/459557459.db2.gz	STXJHPVVQAXLCP-SFHVURJKSA-N	0	3	337.467	3.411	20	30		EGEDHN
CCCN(C(=O)Nc1cc(C#N)cn1C(C)(C)C)[C@H]1CCN(C)C1	ZINC000592252656	459561267	/nfs/dbraw/zinc/56/12/67/459561267.db2.gz	JXHAZQVCOIUNJQ-HNNXBMFYSA-N	0	3	331.464	3.063	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CCC[C@H](c3ccncc3)C2)cc1	ZINC000570969567	459562462	/nfs/dbraw/zinc/56/24/62/459562462.db2.gz	FNRKKQJCGLXDFD-PMACEKPBSA-N	0	3	344.418	3.042	20	30		EGEDHN
CC1(C#N)CCC(NCc2ccncc2OC[C@H]2CCOC2)CC1	ZINC000572106853	459576611	/nfs/dbraw/zinc/57/66/11/459576611.db2.gz	NGPIEYJWLINXQO-DMKPSLHHSA-N	0	3	329.444	3.059	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H](CCCCOC)c2ccccc2)CC1	ZINC000490739798	459586410	/nfs/dbraw/zinc/58/64/10/459586410.db2.gz	KZFCQSZVTHCDBJ-FQEVSTJZSA-N	0	3	342.483	3.006	20	30		EGEDHN
N#CC(C(=O)c1cc2ccccc2n1CC(F)(F)F)c1ccncn1	ZINC000490936889	459591662	/nfs/dbraw/zinc/59/16/62/459591662.db2.gz	JPRCXHBYKSGOLJ-LBPRGKRZSA-N	0	3	344.296	3.484	20	30		EGEDHN
C[C@@H]1C[C@@H]1c1ccc(CNC(=O)C(C#N)Cc2ccc(C#N)cc2)o1	ZINC000527159614	459600006	/nfs/dbraw/zinc/60/00/06/459600006.db2.gz	LYCNCJJLJMDDHK-SKDZVZGDSA-N	0	3	333.391	3.273	20	30		EGEDHN
C#C[C@H](NC(=O)N[C@H](C)C1=CCN(C)CC1)c1ccc(Cl)cc1F	ZINC000491220040	459605923	/nfs/dbraw/zinc/60/59/23/459605923.db2.gz	JSOFEGKNZALHBF-PXAZEXFGSA-N	0	3	349.837	3.103	20	30		EGEDHN
C[C@@H]1CCCN(CC#Cc2ccc(OC(F)(F)F)cc2)[C@H]1CO	ZINC000499055955	459617929	/nfs/dbraw/zinc/61/79/29/459617929.db2.gz	ZBVKBVPXZDRCBS-CJNGLKHVSA-N	0	3	327.346	3.030	20	30		EGEDHN
CC(C)Cc1ccc([C@@H](NCC(=O)NC2(C#N)CCC2)C2CC2)cc1	ZINC000527377923	459638706	/nfs/dbraw/zinc/63/87/06/459638706.db2.gz	HCWMUWUHLPRDJR-HXUWFJFHSA-N	0	3	339.483	3.488	20	30		EGEDHN
C[C@@H]1C[C@@H]1[C@@H](NCC(=O)NC1(C#N)CCC1)c1ccc(Cl)cc1	ZINC000527385145	459639601	/nfs/dbraw/zinc/63/96/01/459639601.db2.gz	AJVVDQWFSMLVMB-PVUWLOKVSA-N	0	3	331.847	3.189	20	30		EGEDHN
CCc1cc(N2CCN(c3cnccc3C#N)CC2)c2ccccc2n1	ZINC000584089317	459649726	/nfs/dbraw/zinc/64/97/26/459649726.db2.gz	PUSAJVDQCZFHLU-UHFFFAOYSA-N	0	3	343.434	3.390	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cnc(Cl)c(C(F)(F)F)c2)CC1	ZINC000491726277	459661435	/nfs/dbraw/zinc/66/14/35/459661435.db2.gz	FZHAVSJLDFUKBT-UHFFFAOYSA-N	0	3	345.752	3.038	20	30		EGEDHN
N#CCC[C@H](C#N)CN[C@@H]1CCCN(Cc2ccc(F)cc2Cl)C1	ZINC000562993755	459688553	/nfs/dbraw/zinc/68/85/53/459688553.db2.gz	NLHNNIJVPYACQN-RHSMWYFYSA-N	0	3	348.853	3.477	20	30		EGEDHN
CC(C)N(C(=O)c1ccc(C#N)[nH]1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000592870832	459707592	/nfs/dbraw/zinc/70/75/92/459707592.db2.gz	GITSPQMJCYDAPS-GOSISDBHSA-N	0	3	336.439	3.011	20	30		EGEDHN
CC(C)(C)N1CC[C@H](NC(=O)N(Cc2ccc(C#N)cc2)C2CC2)C1	ZINC000596681439	459725766	/nfs/dbraw/zinc/72/57/66/459725766.db2.gz	USQYCNUCIKUJCY-KRWDZBQOSA-N	0	3	340.471	3.105	20	30		EGEDHN
C[C@@H]1C[C@@H](c2ccccc2)[C@@H](C)N1Cc1cnc2c(C#N)cnn2c1	ZINC000573802475	459737280	/nfs/dbraw/zinc/73/72/80/459737280.db2.gz	JRRPNEAGUUPUAR-SPYBWZPUSA-N	0	3	331.423	3.367	20	30		EGEDHN
Cc1ccc(CN2CC[C@H](CN(C)C(=O)CC(C)(C)C#N)C2)s1	ZINC000564091850	459771319	/nfs/dbraw/zinc/77/13/19/459771319.db2.gz	FNEMKEOGKHYKGQ-OAHLLOKOSA-N	0	3	333.501	3.277	20	30		EGEDHN
CCc1ccc([C@H](C#N)NC(=O)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000564224639	459772361	/nfs/dbraw/zinc/77/23/61/459772361.db2.gz	NULFNJDSPYLIDA-SFTDATJTSA-N	0	3	347.462	3.452	20	30		EGEDHN
N#CCc1cccc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)c1	ZINC000593169789	459795313	/nfs/dbraw/zinc/79/53/13/459795313.db2.gz	NPGACRZSKVLWKB-KBPBESRZSA-N	0	3	326.318	3.439	20	30		EGEDHN
CN(CCN1CCCCC1)C(=O)Nc1cc(C#N)cn1C(C)(C)C	ZINC000593184345	459800132	/nfs/dbraw/zinc/80/01/32/459800132.db2.gz	GAXVLPAVFNRGGC-UHFFFAOYSA-N	0	3	331.464	3.064	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CCC=C(c2ccccn2)C1	ZINC000566346905	459847364	/nfs/dbraw/zinc/84/73/64/459847364.db2.gz	KQLKLMQQOUMJKL-SFHVURJKSA-N	0	3	331.419	3.470	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@@H]2CC[C@@H]2c2ccccc2)cc1	ZINC000598303992	459855920	/nfs/dbraw/zinc/85/59/20/459855920.db2.gz	DJFXMNKUSOOGQP-XUVXKRRUSA-N	0	3	329.403	3.303	20	30		EGEDHN
CN(C(=O)[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(C#N)cc1F	ZINC000602253595	459878774	/nfs/dbraw/zinc/87/87/74/459878774.db2.gz	LRBBMKJQGPBVQM-QGZVFWFLSA-N	0	3	337.398	3.182	20	30		EGEDHN
CC[C@@H](C#N)C(=O)N(CCN1CCCC1)Cc1ccc(Cl)cc1	ZINC000593457474	459894657	/nfs/dbraw/zinc/89/46/57/459894657.db2.gz	MGDYBAINEMDOGV-INIZCTEOSA-N	0	3	333.863	3.314	20	30		EGEDHN
C[C@H](c1ccccc1)[C@H](O)CNC(=O)C(C#N)CCc1ccccc1	ZINC000598480642	459911192	/nfs/dbraw/zinc/91/11/92/459911192.db2.gz	WKIKKQPJHCSFJO-NSISKUIASA-N	0	3	336.435	3.040	20	30		EGEDHN
C[C@@H](CCC#N)CN1CCN(C(=O)Cc2cccc(Cl)c2)[C@@H](C)C1	ZINC000602475010	459957097	/nfs/dbraw/zinc/95/70/97/459957097.db2.gz	HCZRTKYIDOTZBJ-HOTGVXAUSA-N	0	3	347.890	3.355	20	30		EGEDHN
CCCOc1ccc([C@H](C)NC[C@H](O)CC(C)(C)C#N)cc1OC	ZINC000598603657	459960610	/nfs/dbraw/zinc/96/06/10/459960610.db2.gz	YDNNXROTBAXMBK-GOEBONIOSA-N	0	3	334.460	3.435	20	30		EGEDHN
C[C@H](NC1CCN(Cc2cccc(C#N)c2)CC1)c1ccc(F)cn1	ZINC000593719385	459962709	/nfs/dbraw/zinc/96/27/09/459962709.db2.gz	CQDQSECCPFWTGS-HNNXBMFYSA-N	0	3	338.430	3.408	20	30		EGEDHN
C=CCCOCC(=O)N(CCC)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000624956408	459985905	/nfs/dbraw/zinc/98/59/05/459985905.db2.gz	RFHIVCBFTQQYBN-FQEVSTJZSA-N	0	3	344.499	3.482	20	30		EGEDHN
COc1ccc(CNC[C@@H](O)CC(C)(C)C#N)cc1OC1CCCC1	ZINC000598719459	460004864	/nfs/dbraw/zinc/00/48/64/460004864.db2.gz	INMAOMCBLXMALZ-INIZCTEOSA-N	0	3	346.471	3.407	20	30		EGEDHN
C[C@@H](CC1(C#N)CCOCC1)NCc1ccc(OC(C)(C)C)nc1	ZINC000602586989	460012018	/nfs/dbraw/zinc/01/20/18/460012018.db2.gz	CLEHEQVPUZOHQI-HNNXBMFYSA-N	0	3	331.460	3.447	20	30		EGEDHN
C[C@H](CNC(=O)[C@@H](C)Cc1ccc(C#N)cc1)N(C)Cc1ccccc1	ZINC000593974821	460036115	/nfs/dbraw/zinc/03/61/15/460036115.db2.gz	GTNNAELAQORXNM-ZWKOTPCHSA-N	0	3	349.478	3.374	20	30		EGEDHN
CCCOc1ccc(O[C@@H]2CCCC[C@H]2NC(=O)C(C)C#N)cc1	ZINC000609921550	460039596	/nfs/dbraw/zinc/03/95/96/460039596.db2.gz	LSZQQHLFHITAHX-BMGDILEWSA-N	0	3	330.428	3.441	20	30		EGEDHN
C[C@H](CC1(C#N)CCOCC1)NC[C@]1(C)OCCc2sccc21	ZINC000602669002	460055696	/nfs/dbraw/zinc/05/56/96/460055696.db2.gz	ZHJNOLXCCHWNIH-PBHICJAKSA-N	0	3	334.485	3.225	20	30		EGEDHN
C[C@@H](CC1(C#N)CCOCC1)NC[C@]1(C)OCCc2sccc21	ZINC000602669065	460055786	/nfs/dbraw/zinc/05/57/86/460055786.db2.gz	ZHJNOLXCCHWNIH-YOEHRIQHSA-N	0	3	334.485	3.225	20	30		EGEDHN
N#Cc1ccc2c(c1)CCCC[C@@H]2NCc1ccc(CC(N)=O)cc1	ZINC000589344806	460076441	/nfs/dbraw/zinc/07/64/41/460076441.db2.gz	KFWOFPMBVDPIKI-FQEVSTJZSA-N	0	3	333.435	3.143	20	30		EGEDHN
N#Cc1cnc2c(F)ccc(F)c2c1N1CCN(C2CCCC2)CC1	ZINC000610245759	460094417	/nfs/dbraw/zinc/09/44/17/460094417.db2.gz	FVAPHYBRKGPTHC-UHFFFAOYSA-N	0	3	342.393	3.449	20	30		EGEDHN
CC[C@@]1(O)CCCN(Cc2ccc(OC)c(OCCCC#N)c2)C1	ZINC000602740940	460100727	/nfs/dbraw/zinc/10/07/27/460100727.db2.gz	RTPOKFPSHSSAJE-LJQANCHMSA-N	0	3	332.444	3.115	20	30		EGEDHN
CC1(C(=O)N2CCC[C@H](CC#N)C2)CCN(Cc2ccccc2)CC1	ZINC000597905940	460103027	/nfs/dbraw/zinc/10/30/27/460103027.db2.gz	INPFKWHGSGLKRT-LJQANCHMSA-N	0	3	339.483	3.441	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@H](C)CC[S@@](C)=O)cc1OC	ZINC000598966776	460108835	/nfs/dbraw/zinc/10/88/35/460108835.db2.gz	HILHRWJIMSVTAQ-VERVWZFWSA-N	0	3	345.892	3.160	20	30		EGEDHN
CCO[C@@H]1C[C@@H](N[C@@H](C)C(=O)Nc2cccc(C#N)c2)C12CCCC2	ZINC000610345022	460127515	/nfs/dbraw/zinc/12/75/15/460127515.db2.gz	USLAIQHDNLGSHN-BMGDILEWSA-N	0	3	341.455	3.213	20	30		EGEDHN
C[C@@H](CNC(=O)N[C@@H](C)c1cccc(C#N)c1)N1CCCC[C@@H]1C	ZINC000610347628	460128163	/nfs/dbraw/zinc/12/81/63/460128163.db2.gz	XFGNRGZMXVDKKH-JYJNAYRXSA-N	0	3	328.460	3.181	20	30		EGEDHN
C[C@@H](NC(=O)NC[C@H](c1ccccc1)N(C)C)c1cccc(C#N)c1	ZINC000610356020	460131927	/nfs/dbraw/zinc/13/19/27/460131927.db2.gz	HLSBBTVEULCVIK-DNVCBOLYSA-N	0	3	336.439	3.221	20	30		EGEDHN
C[C@H](CC#N)Sc1ccccc1NC(=O)NCC1(N(C)C)CC1	ZINC000602843187	460156147	/nfs/dbraw/zinc/15/61/47/460156147.db2.gz	WDUYXQOKYZUTHI-CYBMUJFWSA-N	0	3	332.473	3.297	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN[C@@H]([C@H]1CCCO1)C1(CO)CCC1	ZINC000602889918	460173025	/nfs/dbraw/zinc/17/30/25/460173025.db2.gz	GCHCCAPXGPDHSH-MOPGFXCFSA-N	0	3	342.483	3.288	20	30		EGEDHN
C[C@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccc(-n2cncn2)cc1	ZINC000618806207	460184106	/nfs/dbraw/zinc/18/41/06/460184106.db2.gz	PZMQAXSLLZRFOV-XOBRGWDASA-N	0	3	329.407	3.477	20	30		EGEDHN
CN(CCc1cccc(Br)c1)Cc1ccc(C#N)cn1	ZINC000576716545	460200223	/nfs/dbraw/zinc/20/02/23/460200223.db2.gz	ZRZMOMURYORZMP-UHFFFAOYSA-N	0	3	330.229	3.390	20	30		EGEDHN
C[C@@](C#N)(NC(=O)CNC1(c2ccccc2)CCCCC1)C1CC1	ZINC000610677045	460213523	/nfs/dbraw/zinc/21/35/23/460213523.db2.gz	PWUFVKDOLNMBRP-IBGZPJMESA-N	0	3	325.456	3.244	20	30		EGEDHN
C[C@H](NC(=O)[C@@H](N)CCCCC#N)c1nc(-c2ccccc2)cs1	ZINC000594434796	460218307	/nfs/dbraw/zinc/21/83/07/460218307.db2.gz	TVAMQNMLIBIWOH-ZFWWWQNUSA-N	0	3	342.468	3.399	20	30		EGEDHN
N#CCCCC[C@@H](N)C(=O)Nc1ccc(-n2cnc3ccccc32)cc1	ZINC000594441929	460221135	/nfs/dbraw/zinc/22/11/35/460221135.db2.gz	YSYJEAVZSHABRR-QGZVFWFLSA-N	0	3	347.422	3.375	20	30		EGEDHN
C[C@H](NC1CCN(CC#N)CC1)c1cc(Br)ccc1F	ZINC000610813496	460240869	/nfs/dbraw/zinc/24/08/69/460240869.db2.gz	ITKILYDCUUQXFZ-NSHDSACASA-N	0	3	340.240	3.227	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N[C@@H](C)CN2CCC(C)CC2)cc1	ZINC000618983981	460242553	/nfs/dbraw/zinc/24/25/53/460242553.db2.gz	OISQHNAYJRMLHQ-KRWDZBQOSA-N	0	3	330.472	3.031	20	30		EGEDHN
CCN(Cc1c[nH]c2ccccc12)C[C@@H](O)COc1ccccc1C#N	ZINC000599382899	460243326	/nfs/dbraw/zinc/24/33/26/460243326.db2.gz	VCLMXQIKADEIQR-GOSISDBHSA-N	0	3	349.434	3.301	20	30		EGEDHN
C=C(C)CN1CCC(Nc2ccc(C#N)cc2COCCOC)CC1	ZINC000603289212	460278183	/nfs/dbraw/zinc/27/81/83/460278183.db2.gz	CWEPUUOWSHCSSK-UHFFFAOYSA-N	0	3	343.471	3.174	20	30		EGEDHN
C[C@@H]1CN(c2c(C#N)cnn2-c2ccccc2)CCN(C2CCC2)C1	ZINC000603389465	460295385	/nfs/dbraw/zinc/29/53/85/460295385.db2.gz	WJQZJAQLCVTKTG-INIZCTEOSA-N	0	3	335.455	3.055	20	30		EGEDHN
CC(C)(C)C1=CCN(C[C@H](O)COc2ccc(CC#N)cc2)CC1	ZINC000611152468	460297488	/nfs/dbraw/zinc/29/74/88/460297488.db2.gz	WDHXTHOJLKPVTH-SFHVURJKSA-N	0	3	328.456	3.171	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN(C)C[C@@H]1CCCO[C@H]1c1ccccc1	ZINC000622841094	460331581	/nfs/dbraw/zinc/33/15/81/460331581.db2.gz	BOUHFABZLTWBPN-FPOVZHCZSA-N	0	3	342.483	3.287	20	30		EGEDHN
C[C@H](NC[C@H](O)COc1ccccc1Cl)c1cccc(C#N)c1	ZINC000611386300	460350433	/nfs/dbraw/zinc/35/04/33/460350433.db2.gz	KTXKPQHCDCXJTE-BBRMVZONSA-N	0	3	330.815	3.302	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2NCCC(=O)N1CCCCCC1	ZINC000611391974	460353626	/nfs/dbraw/zinc/35/36/26/460353626.db2.gz	DAGXBPIXINIDQJ-LJQANCHMSA-N	0	3	325.456	3.318	20	30		EGEDHN
CN1CCCC(C)(C)[C@@H]1CNC(=O)NCc1ccc(C#N)c(Cl)c1	ZINC000619761000	460435194	/nfs/dbraw/zinc/43/51/94/460435194.db2.gz	FYYCJYIRQRIEKE-INIZCTEOSA-N	0	3	348.878	3.131	20	30		EGEDHN
CC(C)(C)N1CCCN(C(=O)NCc2ccc(C#N)c(Cl)c2)CC1	ZINC000619827274	460450776	/nfs/dbraw/zinc/45/07/76/460450776.db2.gz	ZANIOMUYWFQUNA-UHFFFAOYSA-N	0	3	348.878	3.227	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1c(F)cccc1[N+](=O)[O-])C(C)C	ZINC000601164927	460737579	/nfs/dbraw/zinc/73/75/79/460737579.db2.gz	INZPWACKFGKBTC-MRXNPFEDSA-N	0	3	349.406	3.162	20	30		EGEDHN
N#Cc1cc(F)cc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)c1	ZINC000601714182	460881456	/nfs/dbraw/zinc/88/14/56/460881456.db2.gz	SVYMEAIEYIAQGN-CHWSQXEVSA-N	0	3	330.281	3.383	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNc1cc(C(C)C)nc2ncnn21)C(C)C	ZINC000613413994	460937753	/nfs/dbraw/zinc/93/77/53/460937753.db2.gz	ATGQXUUIINVWQC-QGZVFWFLSA-N	0	3	342.491	3.358	20	30		EGEDHN
COCCCN1CCC(Nc2nc(C(C)(C)C)ccc2C#N)CC1	ZINC000613418472	460939010	/nfs/dbraw/zinc/93/90/10/460939010.db2.gz	ROHVWCOBIVYDPJ-UHFFFAOYSA-N	0	3	330.476	3.164	20	30		EGEDHN
C=CCN(Cc1cc(Br)ccc1F)C(=O)CNC(C)C	ZINC000659253669	461250930	/nfs/dbraw/zinc/25/09/30/461250930.db2.gz	YGAZYDNCBDOPQW-UHFFFAOYSA-N	0	3	343.240	3.101	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1ncoc1C(F)(F)F)C(C)C	ZINC000668682889	461380421	/nfs/dbraw/zinc/38/04/21/461380421.db2.gz	OKHVITLUBGZGCX-LBPRGKRZSA-N	0	3	345.365	3.122	20	30		EGEDHN
CC(=O)c1cc(C#N)ccc1NC(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000637326618	461482115	/nfs/dbraw/zinc/48/21/15/461482115.db2.gz	DIVNIWITLSSVMN-GOSISDBHSA-N	0	3	347.418	3.221	20	30		EGEDHN
C=CC(C)(C)CNC(=O)N1CCCN(Cc2ccccc2C)CC1	ZINC000653091610	461496757	/nfs/dbraw/zinc/49/67/57/461496757.db2.gz	MLWBSPHDIFAWML-UHFFFAOYSA-N	0	3	329.488	3.425	20	30		EGEDHN
C=CCC[C@H](NCc1ccc(S(=O)(=O)NC)cc1)c1ccccc1	ZINC000660201953	461636199	/nfs/dbraw/zinc/63/61/99/461636199.db2.gz	ZYVOGLRXBACHRP-IBGZPJMESA-N	0	3	344.480	3.392	20	30		EGEDHN
C=CCCCCNC(=O)N1CC[C@@H](N(C)CCc2ccccc2)C1	ZINC000664699531	462153541	/nfs/dbraw/zinc/15/35/41/462153541.db2.gz	XHBBWGCPTBZSRS-LJQANCHMSA-N	0	3	329.488	3.301	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)N[C@H]1CCCN2CCCC[C@H]12	ZINC000654318465	462161388	/nfs/dbraw/zinc/16/13/88/462161388.db2.gz	NEUVLDLQECMEOP-ZWKOTPCHSA-N	0	3	344.455	3.007	20	30		EGEDHN
C=CCN(C[C@H](O)Cc1ccccc1C(F)(F)F)[C@@H](C)COC	ZINC000661239686	462166205	/nfs/dbraw/zinc/16/62/05/462166205.db2.gz	INVLGIKEFBPEGZ-DZGCQCFKSA-N	0	3	331.378	3.132	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@H](C)Cc2ccc(OCC)cc2)CC1	ZINC000665242507	462366327	/nfs/dbraw/zinc/36/63/27/462366327.db2.gz	HJCCELNLWQRTSF-MRXNPFEDSA-N	0	3	330.472	3.031	20	30		EGEDHN
C[C@H](NCCNc1nccc(C(F)(F)F)n1)c1cccc(C#N)c1	ZINC000181777874	533859214	/nfs/dbraw/zinc/85/92/14/533859214.db2.gz	HZPZSOOANYKWKM-NSHDSACASA-N	0	3	335.333	3.130	20	30		EGEDHN
COc1cccc(CC(=O)C(C#N)C(=O)Nc2ccccc2Cl)c1	ZINC000103504454	525876596	/nfs/dbraw/zinc/87/65/96/525876596.db2.gz	IIBRDUVJLJIDEO-AWEZNQCLSA-N	0	3	342.782	3.239	20	30		EGEDHN
C=CCN1CCC(NC(=O)/C=C/c2ccccc2Br)CC1	ZINC000171726626	526415435	/nfs/dbraw/zinc/41/54/35/526415435.db2.gz	RMPAVRSVIABPFR-BQYQJAHWSA-N	0	3	349.272	3.229	20	30		EGEDHN
C=CCN1CCC(NC(=O)CSc2nc3ccccc3s2)CC1	ZINC000171727526	526423254	/nfs/dbraw/zinc/42/32/54/526423254.db2.gz	XNNYBWMHTRPKMN-UHFFFAOYSA-N	0	3	347.509	3.155	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@H]2c2ccccc2C)CC1	ZINC000171740393	526427016	/nfs/dbraw/zinc/42/70/16/526427016.db2.gz	UUOPBLAUOICVID-IBGZPJMESA-N	0	3	327.472	3.492	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H](c2ccc(Cl)cc2)[C@H]2C[C@@H]2C)CC1	ZINC000174635105	526931555	/nfs/dbraw/zinc/93/15/55/526931555.db2.gz	XMSGKXJOYQIOBS-ZOCIIQOWSA-N	0	3	344.886	3.499	20	30		EGEDHN
CC(C)n1cccc1C(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000179651357	528600890	/nfs/dbraw/zinc/60/08/90/528600890.db2.gz	APHBXXWTIDZBBK-UHFFFAOYSA-N	0	3	338.455	3.145	20	30		EGEDHN
COC(=O)C[C@H](NCc1ccc(C#N)cc1OC)C1CCCCC1	ZINC000347967225	536346811	/nfs/dbraw/zinc/34/68/11/536346811.db2.gz	SVQHMBOIOFMTPU-KRWDZBQOSA-N	0	3	330.428	3.168	20	30		EGEDHN
C[C@H](NCCOc1ccc(C#N)cc1)c1ccc([S@@](C)=O)cc1	ZINC000090107615	546652801	/nfs/dbraw/zinc/65/28/01/546652801.db2.gz	NKHOGFCOSPWDQP-PSLXWICFSA-N	0	3	328.437	3.025	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H](C)c2cccc(-n3cnnn3)c2)cc1	ZINC000671764778	548356434	/nfs/dbraw/zinc/35/64/34/548356434.db2.gz	MVEAZYVDXXJPQK-HNNXBMFYSA-N	0	3	335.411	3.078	20	30		EGEDHN
C=CCCOCC(=O)N1CC[C@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000673801767	548629252	/nfs/dbraw/zinc/62/92/52/548629252.db2.gz	WSBSEMDPXCMJDI-OAQYLSRUSA-N	0	3	342.483	3.094	20	30		EGEDHN
C=CCC[C@H](O)CN1CCC(c2c(OC)cc(OC)cc2OC)CC1	ZINC000675487304	548928311	/nfs/dbraw/zinc/92/83/11/548928311.db2.gz	HATWGDHPSAZEHX-INIZCTEOSA-N	0	3	349.471	3.219	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc3c(cnn3C(F)F)c2)CC1	ZINC000676601694	549114786	/nfs/dbraw/zinc/11/47/86/549114786.db2.gz	XXNNUOOBJKMBST-UHFFFAOYSA-N	0	3	349.385	3.203	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2cnc(OC(C)C)c(Cl)c2)nc(C)n1	ZINC000678323890	549469106	/nfs/dbraw/zinc/46/91/06/549469106.db2.gz	VNKDWVLJVWXJPI-CYBMUJFWSA-N	0	3	344.802	3.419	20	30		EGEDHN
CCC#C[C@H](C)N[C@H](C)c1ccc(S(=O)(=O)N(CC)CC)cc1	ZINC000678728979	549549203	/nfs/dbraw/zinc/54/92/03/549549203.db2.gz	QWFMSDJROANIIB-JKSUJKDBSA-N	0	3	336.501	3.170	20	30		EGEDHN
C[C@@H](CNC(=S)Nc1ccc(C#N)c(Cl)c1)N1CCCCC1	ZINC000726471269	574556071	/nfs/dbraw/zinc/55/60/71/574556071.db2.gz	JGZNGHZBSBGQND-LBPRGKRZSA-N	0	3	336.892	3.372	20	30		EGEDHN
CN(C)CCOc1ccc(CN=Nc2cnc3ccccc3n2)cc1	ZINC000727255428	574656052	/nfs/dbraw/zinc/65/60/52/574656052.db2.gz	CFNHHIBUPKTBJP-UHFFFAOYSA-N	0	3	335.411	3.016	20	30		EGEDHN
COc1ccccc1OCCNCc1ccc(O[C@H](C)C#N)cc1	ZINC000728713067	574767779	/nfs/dbraw/zinc/76/77/79/574767779.db2.gz	IUPUMEVKDNYOAX-OAHLLOKOSA-N	0	3	326.396	3.155	20	30		EGEDHN
C#CCOc1ccccc1CNCCCOc1ccccc1OC	ZINC000729679780	574877711	/nfs/dbraw/zinc/87/77/11/574877711.db2.gz	QXFFOBBYYXVISY-UHFFFAOYSA-N	0	3	325.408	3.266	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H](C)c2csc3ccccc32)CC1	ZINC000729961699	574898933	/nfs/dbraw/zinc/89/89/33/574898933.db2.gz	QXRPIGVZFDFTQM-AWEZNQCLSA-N	0	3	326.465	3.424	20	30		EGEDHN
C#Cc1cccc(NC(=O)CCCN2CCN(c3ccccc3)CC2)c1	ZINC000731842451	575211538	/nfs/dbraw/zinc/21/15/38/575211538.db2.gz	KCOUBAJXRUSNFK-UHFFFAOYSA-N	0	3	347.462	3.209	20	30		EGEDHN
C[C@H](CCO)SCC(=O)C(C#N)c1nc(-c2ccccc2)cs1	ZINC000741733783	575331140	/nfs/dbraw/zinc/33/11/40/575331140.db2.gz	WXAKUVDBTZZSNN-OCCSQVGLSA-N	0	3	346.477	3.490	20	30		EGEDHN
C=CC[C@@H](NC(=O)NCC(C)(C)N1CCCCC1)c1ccncc1	ZINC000734654469	575532302	/nfs/dbraw/zinc/53/23/02/575532302.db2.gz	VTFUSSBVHXVBTA-QGZVFWFLSA-N	0	3	330.476	3.263	20	30		EGEDHN
C[C@H](CNC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1)C(C)(C)C	ZINC000734674409	575540192	/nfs/dbraw/zinc/54/01/92/575540192.db2.gz	VEWGARFJXOJLIM-MRXNPFEDSA-N	0	3	344.503	3.314	20	30		EGEDHN
C#CCCN1CCC(NC(=O)COc2ccc(C(C)C)c(C)c2)CC1	ZINC000740738107	576622105	/nfs/dbraw/zinc/62/21/05/576622105.db2.gz	USLWXHWOAYQEQF-UHFFFAOYSA-N	0	3	342.483	3.101	20	30		EGEDHN
C[C@@H]1CCCN(Cc2cc(=O)n3c4ccccc4[nH]c3c2C#N)[C@@H]1C	ZINC000741790093	576722068	/nfs/dbraw/zinc/72/20/68/576722068.db2.gz	BFNMHFNSWOOBDO-IIAWOOMASA-N	0	3	334.423	3.344	20	30		EGEDHN
C[C@H](CNC(=O)c1ccccc1SCC#N)N1CCC(C)CC1	ZINC000742401837	576779989	/nfs/dbraw/zinc/77/99/89/576779989.db2.gz	VODHHAQPLPXOJH-OAHLLOKOSA-N	0	3	331.485	3.152	20	30		EGEDHN
C#CCOc1ccc(F)cc1NC(=O)N1CCCN(C(C)(C)C)CC1	ZINC000743201965	576803336	/nfs/dbraw/zinc/80/33/36/576803336.db2.gz	SWYVCNSHPRUEAU-UHFFFAOYSA-N	0	3	347.434	3.176	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)Cc2cc(F)ccc2F)cc1	ZINC000744027698	576819127	/nfs/dbraw/zinc/81/91/27/576819127.db2.gz	BJKYYRSBNKYIPX-MRXNPFEDSA-N	0	3	342.345	3.417	20	30		EGEDHN
N#CC(C(=O)C[C@H](Cc1ccccc1)c1ccccc1)C(=O)NC1CC1	ZINC000744031472	576819312	/nfs/dbraw/zinc/81/93/12/576819312.db2.gz	XXNFJVGWEVOOTC-ICSRJNTNSA-N	0	3	346.430	3.390	20	30		EGEDHN
Cc1cc(F)c(Br)cc1NC(=O)[C@@H](N)CCCCC#N	ZINC000691554110	1298133936	/nfs/dbraw/zinc/13/39/36/1298133936.db2.gz	MEJJPXMFQCNSHK-LBPRGKRZSA-N	0	3	342.212	3.246	20	30		EGEDHN
C#Cc1cccc(NC(=O)N(CCN(C)C)Cc2ccc(F)cc2)c1	ZINC000048072964	1291595771	/nfs/dbraw/zinc/59/57/71/1291595771.db2.gz	WHGUKCIDDLYCOP-UHFFFAOYSA-N	0	3	339.414	3.403	20	30		EGEDHN
N#CC(C(=O)CCc1nc(-c2ccco2)no1)c1nc2ccccc2[nH]1	ZINC000073972115	1292331009	/nfs/dbraw/zinc/33/10/09/1292331009.db2.gz	RLDYXIVUQVBHON-LLVKDONJSA-N	0	3	347.334	3.015	20	30		EGEDHN
C#CC[C@@H](NC[C@@H]1CN(C2CCCCC2)C(=O)O1)c1ccccc1	ZINC000828154986	1292436750	/nfs/dbraw/zinc/43/67/50/1292436750.db2.gz	IASBCSJWSHYAIU-RTBURBONSA-N	0	3	326.440	3.494	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@H](C)CCc1cccc(F)c1	ZINC000076818810	1292444347	/nfs/dbraw/zinc/44/43/47/1292444347.db2.gz	KPZMTTVDEQRWFK-RHSMWYFYSA-N	0	3	332.419	3.410	20	30		EGEDHN
CCOC(=O)N[C@@H](C(=O)C(C#N)c1nc(C(C)C)cs1)C(C)C	ZINC000080458214	1292604786	/nfs/dbraw/zinc/60/47/86/1292604786.db2.gz	CIRCYIRDEMOENB-DGCLKSJQSA-N	0	3	337.445	3.213	20	30		EGEDHN
COc1ccc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)cc1C#N	ZINC000830413074	1292717457	/nfs/dbraw/zinc/71/74/57/1292717457.db2.gz	FGXUSPJBPOCSAO-OLZOCXBDSA-N	0	3	342.317	3.253	20	30		EGEDHN
CCN(CCSC)CC(=O)C(C#N)c1nc2ccccc2s1	ZINC000830999420	1292799002	/nfs/dbraw/zinc/79/90/02/1292799002.db2.gz	KEHYWYQVEDKDKM-LBPRGKRZSA-N	0	3	333.482	3.157	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)c2cc3c(s2)CCOC3)c1	ZINC000103330029	1293002302	/nfs/dbraw/zinc/00/23/02/1293002302.db2.gz	HBFPHQSWYVVFRS-CQSZACIVSA-N	0	3	340.404	3.090	20	30		EGEDHN
C#CCOc1ccc(CN[C@@H]2CCN(C(C)=O)Cc3ccccc32)cc1	ZINC000834893209	1293166332	/nfs/dbraw/zinc/16/63/32/1293166332.db2.gz	UAUIERLJRVKKPR-JOCHJYFZSA-N	0	3	348.446	3.282	20	30		EGEDHN
COc1ccc(C(C)=NN[C@@H]2CCOC2(C)C)cc1CN1CCCC1	ZINC000835013996	1293187798	/nfs/dbraw/zinc/18/77/98/1293187798.db2.gz	LWEGEYWQINVQIG-LJQANCHMSA-N	0	3	345.487	3.172	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)CCCC(=O)C(C)(C)C)cc1	ZINC000835064993	1293197561	/nfs/dbraw/zinc/19/75/61/1293197561.db2.gz	LKHIQTKFIDHPSA-HNNXBMFYSA-N	0	3	344.411	3.128	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)C(=O)NC1CC1)c1ccc(C(F)(F)F)cc1	ZINC000121321264	1293365790	/nfs/dbraw/zinc/36/57/90/1293365790.db2.gz	YRHWUNBYXXYONS-IINYFYTJSA-N	0	3	338.329	3.186	20	30		EGEDHN
Cc1ccc(C(C)C)cc1O[C@H](C)C(=O)C(C#N)C(=O)N1CCCC1	ZINC000124844940	1293486793	/nfs/dbraw/zinc/48/67/93/1293486793.db2.gz	KTCJBLMUPAWOGL-WBVHZDCISA-N	0	3	342.439	3.217	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@@H](C)Oc1cccc(C)c1	ZINC000125598048	1293511885	/nfs/dbraw/zinc/51/18/85/1293511885.db2.gz	YPNNAYVKKAGZHT-NVXWUHKLSA-N	0	3	330.428	3.168	20	30		EGEDHN
N#CC(C(=O)COc1ccc(F)c(Cl)c1)C(=O)Nc1ccccc1	ZINC000128207463	1293585788	/nfs/dbraw/zinc/58/57/88/1293585788.db2.gz	ZKSIAOLVDCLPCL-CYBMUJFWSA-N	0	3	346.745	3.205	20	30		EGEDHN
N#CC1(c2ccccc2)CC(NC[C@@H]2COC3(CCCCC3)O2)C1	ZINC000128349899	1293590429	/nfs/dbraw/zinc/59/04/29/1293590429.db2.gz	NJHZKXNKJVKWCP-JLAWEPINSA-N	0	3	326.440	3.276	20	30		EGEDHN
COc1ccc([C@@H](CCO)NCc2ccc(O[C@@H](C)C#N)cc2)cc1	ZINC000128726072	1293602668	/nfs/dbraw/zinc/60/26/68/1293602668.db2.gz	KYASBIYSXVTIKZ-MGPUTAFESA-N	0	3	340.423	3.199	20	30		EGEDHN
CC(C)OCCC(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000129781864	1293633813	/nfs/dbraw/zinc/63/38/13/1293633813.db2.gz	ISPLMAYHSTZFKR-LLVKDONJSA-N	0	3	343.210	3.456	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)CCCc1cccs1	ZINC000129842673	1293635835	/nfs/dbraw/zinc/63/58/35/1293635835.db2.gz	BETPFRUXGQVTFV-AWEZNQCLSA-N	0	3	342.420	3.427	20	30		EGEDHN
CCCCNC(=O)C1(NCc2ccc(OC)c(C#N)c2)CCCCC1	ZINC000135210088	1293789397	/nfs/dbraw/zinc/78/93/97/1293789397.db2.gz	NQJSKSWIBANUMI-UHFFFAOYSA-N	0	3	343.471	3.276	20	30		EGEDHN
N#CC(C(=O)CC[C@H]1CCCCO1)C(=O)Nc1ccc(Cl)cc1	ZINC000171796841	1294417657	/nfs/dbraw/zinc/41/76/57/1294417657.db2.gz	IDABCXCZNOKXKF-CABCVRRESA-N	0	3	334.803	3.337	20	30		EGEDHN
C[C@H](CC(=O)C(C#N)C(=O)N1CCCC1)Cc1ccc(Cl)cc1	ZINC000179787913	1294828081	/nfs/dbraw/zinc/82/80/81/1294828081.db2.gz	NHLLIZXKHNIZQP-BBRMVZONSA-N	0	3	332.831	3.240	20	30		EGEDHN
N#CC(C(=O)COCc1ccccc1)C(=O)Nc1ccc(Cl)cc1	ZINC000193399921	1295862107	/nfs/dbraw/zinc/86/21/07/1295862107.db2.gz	PNGHBEUYAFQBHY-INIZCTEOSA-N	0	3	342.782	3.204	20	30		EGEDHN
N#CC(C(=O)C[C@@H]1CCCO1)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000193467760	1295872153	/nfs/dbraw/zinc/87/21/53/1295872153.db2.gz	KFUSBVHQZPEOIL-WDEREUQCSA-N	0	3	341.194	3.210	20	30		EGEDHN
N#CC(C(=O)Cc1ccsc1)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000193475214	1295875472	/nfs/dbraw/zinc/87/54/72/1295875472.db2.gz	LAWJLMLIVQEWHH-LLVKDONJSA-N	0	3	336.775	3.431	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCCC[C@H]1CNCc1cc(C#N)cs1	ZINC000224159763	1296134467	/nfs/dbraw/zinc/13/44/67/1296134467.db2.gz	DSXLXDCKJFFDBY-AWEZNQCLSA-N	0	3	335.473	3.499	20	30		EGEDHN
C[C@@H]1CC[C@@H](CCC(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)O1	ZINC000246539633	1296359637	/nfs/dbraw/zinc/35/96/37/1296359637.db2.gz	JMMUOGWXPCQNQN-UGFHNGPFSA-N	0	3	334.803	3.335	20	30		EGEDHN
N#CC(C(=O)NC1CCCCC1)C(=O)[C@H]1C[C@@H]1c1cccc(F)c1F	ZINC000246540070	1296360062	/nfs/dbraw/zinc/36/00/62/1296360062.db2.gz	JSODCMFJYWDXSJ-ILXRZTDVSA-N	0	3	346.377	3.226	20	30		EGEDHN
N#CC(C(=O)NC1CCCCC1)C(=O)[C@@H]1C[C@H]1c1cccc(F)c1F	ZINC000246540101	1296360162	/nfs/dbraw/zinc/36/01/62/1296360162.db2.gz	JSODCMFJYWDXSJ-ZNMIVQPWSA-N	0	3	346.377	3.226	20	30		EGEDHN
CN(C)CCN(C(=O)/C=C\c1ccccc1C#N)C1CCCCC1	ZINC000255343337	1296522671	/nfs/dbraw/zinc/52/26/71/1296522671.db2.gz	RPSXZKKZCLFAIF-SEYXRHQNSA-N	0	3	325.456	3.294	20	30		EGEDHN
[O-]c1ccc(Cl)cc1/C=N\C1CC[NH+]([C@@H]2CCCC[C@H]2O)CC1	ZINC000255570136	1296550064	/nfs/dbraw/zinc/55/00/64/1296550064.db2.gz	NGRDOGPAGWDGPI-BJSXHXNNSA-N	0	3	336.863	3.232	20	30		EGEDHN
CC[C@@H](NCc1ccc(OCC#N)cc1)C(=O)Nc1ccc(C)cc1	ZINC000871872062	1296582768	/nfs/dbraw/zinc/58/27/68/1296582768.db2.gz	GJVURQRASNXGPK-LJQANCHMSA-N	0	3	337.423	3.404	20	30		EGEDHN
C[C@H](N[C@@H](C)c1ccc2[nH]c(=O)[nH]c2c1)c1ccc(OCC#N)cc1	ZINC000327355984	1297248731	/nfs/dbraw/zinc/24/87/31/1297248731.db2.gz	GNTFEMAZEJVMGA-STQMWFEESA-N	0	3	336.395	3.170	20	30		EGEDHN
C#CCOc1ccc(Br)cc1CNC[C@@H]1CCC=CO1	ZINC000380014983	1297541839	/nfs/dbraw/zinc/54/18/39/1297541839.db2.gz	KLYKBGNFQSHLLU-HNNXBMFYSA-N	0	3	336.229	3.243	20	30		EGEDHN
CCc1nc(C#N)cc(N2C[C@H](C)N(Cc3ccccc3)[C@@H](C)[C@@H]2C)n1	ZINC000404423341	1297753051	/nfs/dbraw/zinc/75/30/51/1297753051.db2.gz	JWIOHBUPBFLANL-ULQDDVLXSA-N	0	3	349.482	3.398	20	30		EGEDHN
COc1csc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)c1	ZINC000747108410	1298728832	/nfs/dbraw/zinc/72/88/32/1298728832.db2.gz	OQYRCTSERKAQAG-SNVBAGLBSA-N	0	3	334.784	3.371	20	30		EGEDHN
CN(C)Cc1ccc(-c2noc(COc3cccc(C#N)c3)n2)cc1	ZINC000747863630	1298874579	/nfs/dbraw/zinc/87/45/79/1298874579.db2.gz	OFRYGEWBPSTIKR-UHFFFAOYSA-N	0	3	334.379	3.249	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@H](NCc1cccc(C#N)n1)C1CCCC1	ZINC000877479998	1299332512	/nfs/dbraw/zinc/33/25/12/1299332512.db2.gz	IIAZQDVDWCIGFI-KRWDZBQOSA-N	0	3	344.459	3.126	20	30		EGEDHN
C=CC[C@@H](CC)NCc1cc(C2CN(C(=O)OC(C)(C)C)C2)no1	ZINC000877496997	1299348004	/nfs/dbraw/zinc/34/80/04/1299348004.db2.gz	AXFZQYKPDTYPOH-CQSZACIVSA-N	0	3	335.448	3.453	20	30		EGEDHN
CC(C)CN(CCC#N)C(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000751373418	1299543454	/nfs/dbraw/zinc/54/34/54/1299543454.db2.gz	GGHOVKUBJKQPGE-SFHVURJKSA-N	0	3	345.462	3.436	20	30		EGEDHN
C#C[C@H](CC)NC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1	ZINC000753033852	1299849707	/nfs/dbraw/zinc/84/97/07/1299849707.db2.gz	RXNXTYQHQYDFSH-CVEARBPZSA-N	0	3	333.501	3.232	20	30		EGEDHN
CC(=O)[C@](C#N)(CCN1CCC[C@](CO)(C(C)C)C1)c1ccccc1	ZINC000878655262	1300129172	/nfs/dbraw/zinc/12/91/72/1300129172.db2.gz	KRAARICIJGKFSS-LEWJYISDSA-N	0	3	342.483	3.158	20	30		EGEDHN
C=C(C)COCCNCc1ccc(N2CCCCC2)c([N+](=O)[O-])c1	ZINC000761987850	1301583593	/nfs/dbraw/zinc/58/35/93/1301583593.db2.gz	UXKPGZJXAQLIQP-UHFFFAOYSA-N	0	3	333.432	3.267	20	30		EGEDHN
C#Cc1cccc(NC(=S)N[C@H]2CN(Cc3ccccc3)C[C@H]2C)c1	ZINC000764933781	1302170192	/nfs/dbraw/zinc/17/01/92/1302170192.db2.gz	VJZCYRDUQKHOHT-UZLBHIALSA-N	0	3	349.503	3.475	20	30		EGEDHN
C#CCCCN1CCN(Cc2csc(-c3ccccc3)n2)CC1	ZINC000766894495	1302540432	/nfs/dbraw/zinc/54/04/32/1302540432.db2.gz	CPBORDNTKCMVCY-UHFFFAOYSA-N	0	3	325.481	3.341	20	30		EGEDHN
CCCCN(Cc1ccccc1F)C(=O)C1CC2(C1)CNC[C@H]2C#N	ZINC000884121813	1302744528	/nfs/dbraw/zinc/74/45/28/1302744528.db2.gz	ZHXGFXCMFWAHMB-OHTSDLOESA-N	0	3	343.446	3.094	20	30		EGEDHN
C[C@H]1CN(CCCCNc2nc3ccccc3cc2C#N)C[C@H](C)O1	ZINC000768532647	1302928054	/nfs/dbraw/zinc/92/80/54/1302928054.db2.gz	CUNSPXVFMCZWFO-HOTGVXAUSA-N	0	3	338.455	3.408	20	30		EGEDHN
C#CCOc1ccccc1CN(C)CCCNC(=O)OC(C)(C)C	ZINC000769464267	1303118235	/nfs/dbraw/zinc/11/82/35/1303118235.db2.gz	YIBMYWJFEUOFHK-UHFFFAOYSA-N	0	3	332.444	3.045	20	30		EGEDHN
C[C@H](N[C@H]1CCN(c2ccc(C#N)cc2)C1=O)c1ccc(N(C)C)cc1	ZINC000774487389	1303816161	/nfs/dbraw/zinc/81/61/61/1303816161.db2.gz	ZZNOQVLOLIKDRC-YWZLYKJASA-N	0	3	348.450	3.080	20	30		EGEDHN
C#CC[C@@H](NC[C@H](O)COc1ccccc1Cl)c1ccccc1	ZINC000775401140	1303957556	/nfs/dbraw/zinc/95/75/56/1303957556.db2.gz	RAPMZAUHJWFQDI-FUHWJXTLSA-N	0	3	329.827	3.434	20	30		EGEDHN
C#C[C@H](N[C@@H](C)CC(=O)Nc1ccc(C)cc1Cl)[C@H]1CCCO1	ZINC000775572025	1303987140	/nfs/dbraw/zinc/98/71/40/1303987140.db2.gz	NWRFAJBKGIRNIB-JLJPHGGASA-N	0	3	334.847	3.136	20	30		EGEDHN
N#CC(C(=O)NC1CCCC1)C(=O)[C@H]1CCc2c1cccc2Cl	ZINC000776079452	1304091782	/nfs/dbraw/zinc/09/17/82/1304091782.db2.gz	DEEOWESMRIMCFZ-GJZGRUSLSA-N	0	3	330.815	3.137	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CNCCCOC[C@H]1CCCO1	ZINC000778150700	1304402990	/nfs/dbraw/zinc/40/29/90/1304402990.db2.gz	BCEGQNVJDKYQAD-OAHLLOKOSA-N	0	3	337.847	3.027	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)Cc2ccc(Cl)s2)C1	ZINC000968387031	1335915044	/nfs/dbraw/zinc/91/50/44/1335915044.db2.gz	TTWZHLPOLNCJGT-GXTWGEPZSA-N	0	3	326.893	3.347	20	30		EGEDHN
CC(C)Cn1cc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)cn1	ZINC000781767683	1304872573	/nfs/dbraw/zinc/87/25/73/1304872573.db2.gz	WQDNZOOSAKVFQB-CYBMUJFWSA-N	0	3	344.802	3.154	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(F)c(Cl)c1)C(=O)[C@@H]1CCCCS1	ZINC000783353132	1305082865	/nfs/dbraw/zinc/08/28/65/1305082865.db2.gz	PLPIAORMCIEBFS-GWCFXTLKSA-N	0	3	340.807	3.412	20	30		EGEDHN
CC(C)Cn1ccc(C(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)n1	ZINC000892493516	1305403746	/nfs/dbraw/zinc/40/37/46/1305403746.db2.gz	LAUOXYBSTYXOEK-CQSZACIVSA-N	0	3	344.802	3.154	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)CC(C)(C)OC)cc1	ZINC000786311855	1305554498	/nfs/dbraw/zinc/55/44/98/1305554498.db2.gz	NANZCLVDRAFXEB-INIZCTEOSA-N	0	3	330.428	3.492	20	30		EGEDHN
Cc1nc(CC(=O)C(C#N)C(=O)Nc2ccccc2Cl)c(C)s1	ZINC000786315520	1305554916	/nfs/dbraw/zinc/55/49/16/1305554916.db2.gz	ZNGIBXZMCDNGKL-NSHDSACASA-N	0	3	347.827	3.303	20	30		EGEDHN
Cc1nc(CC(=O)C(C#N)C(=O)Nc2ccccc2Cl)c(C)s1	ZINC000786315518	1305555307	/nfs/dbraw/zinc/55/53/07/1305555307.db2.gz	ZNGIBXZMCDNGKL-LLVKDONJSA-N	0	3	347.827	3.303	20	30		EGEDHN
Cc1ccc([C@H](C)C(=O)C(C#N)C(=O)NCc2cccc(Cl)c2)o1	ZINC000786530202	1305590121	/nfs/dbraw/zinc/59/01/21/1305590121.db2.gz	GDJWEYZUWZPVKI-SWLSCSKDSA-N	0	3	344.798	3.370	20	30		EGEDHN
C#C[C@H](NC1CC(c2ccc(Br)cc2)C1)[C@@H]1CCCO1	ZINC000786921319	1305658881	/nfs/dbraw/zinc/65/88/81/1305658881.db2.gz	XNQFSWLJGZLRJG-KMZOKZLKSA-N	0	3	334.257	3.466	20	30		EGEDHN
C[C@@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccc(N2CCNC2=O)cc1	ZINC000787028768	1305679066	/nfs/dbraw/zinc/67/90/66/1305679066.db2.gz	WHZCINIOIMIQCL-JLTOFOAXSA-N	0	3	346.434	3.426	20	30		EGEDHN
C#CCn1ccc(CN(CC)C[C@H](C)Cc2ccc(OC)c(F)c2)n1	ZINC000789758349	1306212345	/nfs/dbraw/zinc/21/23/45/1306212345.db2.gz	KBDWEVHUUYSTQH-MRXNPFEDSA-N	0	3	343.446	3.365	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2c(C)c(F)ccc2Cl)C1	ZINC001020324634	1317644122	/nfs/dbraw/zinc/64/41/22/1317644122.db2.gz	CMCADIFHWGEVGN-XYPYZODXSA-N	0	3	331.218	3.390	20	30		EGEDHN
C=CC(C)(C)Cc1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1	ZINC000896065166	1309682007	/nfs/dbraw/zinc/68/20/07/1309682007.db2.gz	CHXGQXUPTFSUJF-UHFFFAOYSA-N	0	3	341.459	3.028	20	30		EGEDHN
C#CCCOc1ccc(CN2CCC(Cc3noc(C)n3)CC2)cc1	ZINC000896552168	1309913055	/nfs/dbraw/zinc/91/30/55/1309913055.db2.gz	YLZGSVSRWUZFIN-UHFFFAOYSA-N	0	3	339.439	3.235	20	30		EGEDHN
CCc1occc1C(=O)C(C#N)C(=O)Nc1ccc(OC)c(Cl)c1	ZINC000797548920	1310210310	/nfs/dbraw/zinc/21/03/10/1310210310.db2.gz	SKZACMLBCUREFG-GFCCVEGCSA-N	0	3	346.770	3.465	20	30		EGEDHN
C[C@H](NC(=O)C1CCCC1)C(=O)C(C#N)c1ncc(C(C)(C)C)s1	ZINC000797568645	1310212587	/nfs/dbraw/zinc/21/25/87/1310212587.db2.gz	KNVALGFPGDKIHT-WCQYABFASA-N	0	3	347.484	3.312	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1	ZINC000798288138	1310337676	/nfs/dbraw/zinc/33/76/76/1310337676.db2.gz	TWDHXXFUBQIPEN-GVDBMIGSSA-N	0	3	330.403	3.335	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](O)c2cccc(Br)c2)s1	ZINC000801733815	1316943483	/nfs/dbraw/zinc/94/34/83/1316943483.db2.gz	XNPKIXPLINZDMF-CQSZACIVSA-N	0	3	337.242	3.205	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3ccc(C#N)c(F)c3)C2)CC1	ZINC001019331171	1317171738	/nfs/dbraw/zinc/17/17/38/1317171738.db2.gz	LFVBUOBBBQNTHG-SFHVURJKSA-N	0	3	341.430	3.134	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@H](NCc3ccc(C#N)c(F)c3)C2)cc1	ZINC001019699825	1317349370	/nfs/dbraw/zinc/34/93/70/1317349370.db2.gz	VHQAIBHHGAFNJQ-SFHVURJKSA-N	0	3	337.398	3.010	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)s1	ZINC001019943936	1317469852	/nfs/dbraw/zinc/46/98/52/1317469852.db2.gz	DJCWLZZIJWOCRH-SHTZXODSSA-N	0	3	343.427	3.118	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC2(CCN(Cc3conc3C)CC2)CC1	ZINC000957586240	1317479227	/nfs/dbraw/zinc/47/92/27/1317479227.db2.gz	FBQVYCWEWDVBIJ-UHFFFAOYSA-N	0	3	345.487	3.400	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@H](NC(=O)C3=CCCCCC3)C2)c(F)c1	ZINC001020102315	1317544284	/nfs/dbraw/zinc/54/42/84/1317544284.db2.gz	OXFLBGGUPOFVTO-IYARVYRRSA-N	0	3	341.430	3.325	20	30		EGEDHN
CCN(Cc1cc(F)ccc1F)CC1CCN(C(=O)[C@H](C)C#N)CC1	ZINC000957691060	1317558588	/nfs/dbraw/zinc/55/85/88/1317558588.db2.gz	ZXIWXBPPGPSUNK-CQSZACIVSA-N	0	3	349.425	3.185	20	30		EGEDHN
CN(C)C[C@H](NC(=O)/C=C\c1ccccc1C#N)c1ccc(F)cc1	ZINC000807703515	1317578720	/nfs/dbraw/zinc/57/87/20/1317578720.db2.gz	IWZXOTQCJZYQST-ADYPVZHUSA-N	0	3	337.398	3.130	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)[C@]2(C)CCC[C@H]2CC)C1	ZINC001020295135	1317630962	/nfs/dbraw/zinc/63/09/62/1317630962.db2.gz	MGHKBNKEZKVXTB-IXYNUQLISA-N	0	3	343.309	3.348	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H]2CCC[C@@H](C(F)(F)F)C2)C1	ZINC001020335994	1317651489	/nfs/dbraw/zinc/65/14/89/1317651489.db2.gz	PISKDCDCTFXZJP-FDYHWXHSSA-N	0	3	338.801	3.344	20	30		EGEDHN
C#C[C@@H](NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1)C(C)(C)C	ZINC000808315862	1317659796	/nfs/dbraw/zinc/65/97/96/1317659796.db2.gz	NKWJVWBKTVOWPH-PKOBYXMFSA-N	0	3	341.499	3.340	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H]2CC[C@H]2c2ccc(F)cc2)C1	ZINC001020428323	1317692029	/nfs/dbraw/zinc/69/20/29/1317692029.db2.gz	DQJXHUPMIYOJOF-LUKYLMHMSA-N	0	3	336.838	3.309	20	30		EGEDHN
C#C[C@@H](CC)NCc1sc(N2CCOCC2)nc1-c1ccccc1	ZINC000809686464	1317863374	/nfs/dbraw/zinc/86/33/74/1317863374.db2.gz	UXXKLMPYENTLGZ-INIZCTEOSA-N	0	3	341.480	3.148	20	30		EGEDHN
CCOc1cc(/C=C2/C(=O)c3ncnn3C2C)ccc1OC(F)F	ZINC000905080253	1317920652	/nfs/dbraw/zinc/92/06/52/1317920652.db2.gz	JPAWUCKWTHSLJJ-CAXXOGMASA-N	0	3	335.310	3.119	20	30		EGEDHN
Cc1nn(Cc2ccc(C)cc2)c(C)c1/C=C1\C(=O)c2ncnn2C1C	ZINC000905079705	1317920767	/nfs/dbraw/zinc/92/07/67/1317920767.db2.gz	FOBQCDPKDVCERM-FNMPFJKNSA-N	0	3	347.422	3.289	20	30		EGEDHN
C[C@@H]1CN(CC(=O)C(C#N)c2nc3ccccc3s2)CCC1(F)F	ZINC000810045873	1317942981	/nfs/dbraw/zinc/94/29/81/1317942981.db2.gz	IZLIQQVETSNIBQ-NEPJUHHUSA-N	0	3	349.406	3.450	20	30		EGEDHN
C[C@@H](C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1)C1CCCC1	ZINC001020907417	1317993444	/nfs/dbraw/zinc/99/34/44/1317993444.db2.gz	AMAJCHROQIFEMY-FSPWUOQZSA-N	0	3	343.446	3.260	20	30		EGEDHN
COc1cccnc1CC(=O)C(C#N)c1nc2cc(F)ccc2s1	ZINC000810575928	1318025670	/nfs/dbraw/zinc/02/56/70/1318025670.db2.gz	LRZTZNNTJGAVSS-LLVKDONJSA-N	0	3	341.367	3.258	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc(OCC3CC3)cc2)C1	ZINC001021070031	1318067708	/nfs/dbraw/zinc/06/77/08/1318067708.db2.gz	QFCFAHBEGUNHEA-WKILWMFISA-N	0	3	334.847	3.078	20	30		EGEDHN
N#CCC1(OC(=O)C2CCN(c3ccc(Cl)cc3)C2=O)CCC1	ZINC000810858455	1318068484	/nfs/dbraw/zinc/06/84/84/1318068484.db2.gz	XNSHXSGCPDMGIJ-AWEZNQCLSA-N	0	3	332.787	3.072	20	30		EGEDHN
C=C1CC(C)(C(=O)NC2C[C@H]3CC[C@@H](C2)N3Cc2c(C)noc2C)C1	ZINC001021371341	1318216865	/nfs/dbraw/zinc/21/68/65/1318216865.db2.gz	SFGHJCPSYIABNA-ALOPSCKCSA-N	0	3	343.471	3.259	20	30		EGEDHN
CC[C@H](O)CNN=Cc1ccc(N(CC)Cc2ccccc2)cc1	ZINC000811656766	1318220000	/nfs/dbraw/zinc/22/00/00/1318220000.db2.gz	VTNOVOPWDHUPEN-FQEVSTJZSA-N	0	3	325.456	3.408	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)cc1F	ZINC000959954790	1318286663	/nfs/dbraw/zinc/28/66/63/1318286663.db2.gz	OCYPAMJCNMECPI-YQMISUSPSA-N	0	3	329.419	3.134	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@@H](CCCN3C(=O)c3ccco3)C2)cc1	ZINC001021492976	1318293014	/nfs/dbraw/zinc/29/30/14/1318293014.db2.gz	OCZOHHBPSPHRDA-RBUKOAKNSA-N	0	3	349.434	3.278	20	30		EGEDHN
CC1=C(C)C[C@H](C(=O)N[C@@H]2[C@H]3CN(Cc4ccc(C#N)cc4)C[C@H]32)CC1	ZINC000960052190	1318331728	/nfs/dbraw/zinc/33/17/28/1318331728.db2.gz	NPDPFCUTGVIKKG-CGXNFDGLSA-N	0	3	349.478	3.241	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cscc2C(F)F)C1	ZINC001021592699	1318437866	/nfs/dbraw/zinc/43/78/66/1318437866.db2.gz	SPCRQDLBYGGJRM-IUODEOHRSA-N	0	3	338.423	3.245	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1nccc2occc21	ZINC000960295562	1318447942	/nfs/dbraw/zinc/44/79/42/1318447942.db2.gz	IXEPIHWDAINDDD-IEBWSBKVSA-N	0	3	347.418	3.389	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc2c(c1)[C@H](C)CO2	ZINC000960296744	1318449634	/nfs/dbraw/zinc/44/96/34/1318449634.db2.gz	RVLUQYBYSJWEEO-YFZFPPMRSA-N	0	3	348.446	3.354	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2nc(C(C)(C)C)cs2)C1	ZINC001021606071	1318452877	/nfs/dbraw/zinc/45/28/77/1318452877.db2.gz	GPWYELWCBZZSTA-HUUCEWRRSA-N	0	3	345.512	3.000	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cccc2[nH]ccc21	ZINC000960309935	1318454182	/nfs/dbraw/zinc/45/41/82/1318454182.db2.gz	XNQJHLODKOPXJJ-WOJBJXKFSA-N	0	3	331.419	3.339	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1c(C)[nH]nc1C(C)C	ZINC000960325424	1318462521	/nfs/dbraw/zinc/46/25/21/1318462521.db2.gz	ZMRSRUHMLYTCAV-VQIMIIECSA-N	0	3	338.455	3.013	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1c(C)n[nH]c1C(C)C	ZINC000960325424	1318462527	/nfs/dbraw/zinc/46/25/27/1318462527.db2.gz	ZMRSRUHMLYTCAV-VQIMIIECSA-N	0	3	338.455	3.013	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccccc1OCC	ZINC000960331304	1318464240	/nfs/dbraw/zinc/46/42/40/1318464240.db2.gz	UIQGIZKYSKEHKP-UYAOXDASSA-N	0	3	336.435	3.257	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc2[nH]ccc2s1	ZINC000960331270	1318464714	/nfs/dbraw/zinc/46/47/14/1318464714.db2.gz	RZBRNWVYZXCZAR-CRAIPNDOSA-N	0	3	337.448	3.401	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1c[nH]c2ccc(F)cc12	ZINC000960342290	1318470111	/nfs/dbraw/zinc/47/01/11/1318470111.db2.gz	LQDYZTVEKCWPGJ-WOJBJXKFSA-N	0	3	349.409	3.478	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(Cl)cc2F)C1	ZINC001021626163	1318476912	/nfs/dbraw/zinc/47/69/12/1318476912.db2.gz	DENBBYOCPMWZBT-KDOFPFPSSA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)Cc2cccc(C3CC3)c2)C1	ZINC001021635295	1318490352	/nfs/dbraw/zinc/49/03/52/1318490352.db2.gz	JMWRXDNBGPHQRS-NHCUHLMSSA-N	0	3	336.479	3.053	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc3[nH]ccc3c2)C1	ZINC001021651889	1318513473	/nfs/dbraw/zinc/51/34/73/1318513473.db2.gz	FTQHBSUOOTZIOJ-UYAOXDASSA-N	0	3	335.451	3.118	20	30		EGEDHN
Cc1ccc(C(=O)N2CCC[C@H]2CN(C)Cc2ccc(C#N)cc2)o1	ZINC000960391105	1318517787	/nfs/dbraw/zinc/51/77/87/1318517787.db2.gz	LXCVQVCAYXAZBR-SFHVURJKSA-N	0	3	337.423	3.196	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cccc(Cl)c2F)C1	ZINC001021658131	1318521026	/nfs/dbraw/zinc/52/10/26/1318521026.db2.gz	KIFKZFJBNCCGIT-YOEHRIQHSA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc[nH]c2C2CCC2)C1	ZINC001021666854	1318529318	/nfs/dbraw/zinc/52/93/18/1318529318.db2.gz	CIQXFSOSEPACOL-MJGOQNOKSA-N	0	3	339.483	3.232	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cccc3[nH]ccc32)C1	ZINC001021673806	1318538991	/nfs/dbraw/zinc/53/89/91/1318538991.db2.gz	MAKMBMCKGXVWQY-JXFKEZNVSA-N	0	3	335.451	3.118	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2[nH]c3ccc(C)cc3c2C)C1	ZINC001021703689	1318576515	/nfs/dbraw/zinc/57/65/15/1318576515.db2.gz	AYNKTJWWILUOPF-FXAWDEMLSA-N	0	3	349.478	3.344	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccoc2CCC)C1	ZINC001021714578	1318593425	/nfs/dbraw/zinc/59/34/25/1318593425.db2.gz	XOMCOVLYMJFLJH-FUHWJXTLSA-N	0	3	328.456	3.182	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2sccc2C(F)F)C1	ZINC001021723202	1318609215	/nfs/dbraw/zinc/60/92/15/1318609215.db2.gz	SBKLTDUKTNLZRN-GXTWGEPZSA-N	0	3	338.423	3.245	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(C(F)F)o2)C1	ZINC001021723988	1318615538	/nfs/dbraw/zinc/61/55/38/1318615538.db2.gz	HRAMJJKIBZQCTG-ZIAGYGMSSA-N	0	3	336.382	3.167	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(C)c(CC)s2)C1	ZINC001021728591	1318624844	/nfs/dbraw/zinc/62/48/44/1318624844.db2.gz	APMNCUITGLSBQA-JKSUJKDBSA-N	0	3	330.497	3.179	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(Cl)s2)C1	ZINC001021728119	1318625539	/nfs/dbraw/zinc/62/55/39/1318625539.db2.gz	RKSQRFPNZWNYAD-KGLIPLIRSA-N	0	3	336.888	3.351	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)CCc2ccccc2F)C1	ZINC001021732726	1318637600	/nfs/dbraw/zinc/63/76/00/1318637600.db2.gz	HCQWMDXGIQUQEQ-ICSRJNTNSA-N	0	3	342.458	3.095	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc3c(c2)CCC3)C1	ZINC001021733893	1318640175	/nfs/dbraw/zinc/64/01/75/1318640175.db2.gz	SOXIRIZQJKZYTH-RTWAWAEBSA-N	0	3	336.479	3.125	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H]1CN(C)Cc1ccc(C#N)cc1)C1CC1	ZINC000960529155	1318646951	/nfs/dbraw/zinc/64/69/51/1318646951.db2.gz	MUENBYOKYIDXQX-KXBFYZLASA-N	0	3	325.456	3.027	20	30		EGEDHN
C#CCOc1ccc([C@H](C)NCc2cc3ccccc3n(C)c2=O)cc1	ZINC000813883759	1318649736	/nfs/dbraw/zinc/64/97/36/1318649736.db2.gz	WPHUWZNREBJQGV-INIZCTEOSA-N	0	3	346.430	3.401	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)/C=C\c1ccc[nH]1	ZINC000960589697	1318719701	/nfs/dbraw/zinc/71/97/01/1318719701.db2.gz	LDFVQRJDCYLHEN-GDCKJWNLSA-N	0	3	348.450	3.023	20	30		EGEDHN
CN(Cc1ccc(C(F)F)cc1)C[C@H]1CCCN1C(=O)C#CC1CC1	ZINC000960612064	1318737820	/nfs/dbraw/zinc/73/78/20/1318737820.db2.gz	DRCCMGXFYMPOID-GOSISDBHSA-N	0	3	346.421	3.460	20	30		EGEDHN
C[C@@H](c1ccc(F)c(F)c1)N(C)C[C@H]1CCCN1C(=O)C#CC1CC1	ZINC000960614328	1318741485	/nfs/dbraw/zinc/74/14/85/1318741485.db2.gz	QLVMTDGTKMQPSA-WMLDXEAASA-N	0	3	346.421	3.362	20	30		EGEDHN
C[C@H](c1ccc(F)cc1)N(C)C[C@@H]1CCCN1C(=O)C#CC1CC1	ZINC000960618131	1318745071	/nfs/dbraw/zinc/74/50/71/1318745071.db2.gz	OTTLOWAZSDKBTN-BEFAXECRSA-N	0	3	328.431	3.223	20	30		EGEDHN
C[C@@]1(C(=O)N[C@H]2C[C@@H](NCc3cc(C#N)ccc3F)C2)CC=CCC1	ZINC001022132876	1318813000	/nfs/dbraw/zinc/81/30/00/1318813000.db2.gz	UAQIHNWXURLOOC-FUHIMQAGSA-N	0	3	341.430	3.181	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]1CN(C)Cc1ccc(OC)cc1	ZINC000960786315	1318887429	/nfs/dbraw/zinc/88/74/29/1318887429.db2.gz	DGDFOBKYDKNQLI-KRWDZBQOSA-N	0	3	330.472	3.330	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)C2(c3cccc(F)c3)CCC2)C1	ZINC001022522701	1318977265	/nfs/dbraw/zinc/97/72/65/1318977265.db2.gz	VOCLBATYJGAFTJ-IYBDPMFKSA-N	0	3	336.838	3.237	20	30		EGEDHN
C[C@H]1CC[C@@H](CC(=O)N[C@H]2C[C@@H](NCc3cc(C#N)ccc3F)C2)C1	ZINC001022563180	1318992801	/nfs/dbraw/zinc/99/28/01/1318992801.db2.gz	FQXYWGZZLSOJTI-IHETXDGRSA-N	0	3	343.446	3.260	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@@H]1CN(C)Cc1cccc(C#N)c1	ZINC000960894302	1319031736	/nfs/dbraw/zinc/03/17/36/1319031736.db2.gz	HUNKTVYWOYCIJO-GUDVDZBRSA-N	0	3	325.456	3.027	20	30		EGEDHN
C#CCN(C)CCC[NH2+][C@@H](C)c1cc(Br)cc(C)c1[O-]	ZINC000815652555	1319037475	/nfs/dbraw/zinc/03/74/75/1319037475.db2.gz	HXFKQRWKSMNQRO-ZDUSSCGKSA-N	0	3	339.277	3.069	20	30		EGEDHN
CC1(C(=O)N[C@H]2C[C@@H](NCc3cc(C#N)ccc3F)C2)CCCCC1	ZINC001022646719	1319038781	/nfs/dbraw/zinc/03/87/81/1319038781.db2.gz	SLZCZJAUMPIHDT-CALCHBBNSA-N	0	3	343.446	3.405	20	30		EGEDHN
C=Cc1ccc(C(=O)N[C@H]2C[C@@H](NCc3ccc(C#N)cc3F)C2)cc1	ZINC001022756106	1319089178	/nfs/dbraw/zinc/08/91/78/1319089178.db2.gz	LPLMECKSIQBSAG-KDURUIRLSA-N	0	3	349.409	3.391	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)[C@@H]1CCC[C@H](OC)C1)c1ccccc1	ZINC000816038852	1319092202	/nfs/dbraw/zinc/09/22/02/1319092202.db2.gz	ISAPYRMEEPOVMX-XDNAFOTISA-N	0	3	342.439	3.168	20	30		EGEDHN
CC[C@@H](NC(=O)C(C#N)C(=O)CCc1cncs1)c1ccccc1	ZINC000816038568	1319092567	/nfs/dbraw/zinc/09/25/67/1319092567.db2.gz	ATARHBMBCZFDMR-JKSUJKDBSA-N	0	3	341.436	3.052	20	30		EGEDHN
C[C@H]1[C@H](OC(=O)c2cccc(C#N)n2)CCCN1Cc1ccccc1	ZINC000816468530	1319161803	/nfs/dbraw/zinc/16/18/03/1319161803.db2.gz	ITERPRQEJPFPIM-HNAYVOBHSA-N	0	3	335.407	3.163	20	30		EGEDHN
C[C@@H](CC(=O)N1CCC[C@H]1CN(C)Cc1ccc(C#N)cc1)C1CC1	ZINC000961041655	1319165839	/nfs/dbraw/zinc/16/58/39/1319165839.db2.gz	XQBVJJYDZHIHJY-JXFKEZNVSA-N	0	3	339.483	3.417	20	30		EGEDHN
CCC(=O)N1CCC[C@@H]([C@H]2CCN(Cc3ccc(C#N)cc3F)C2)C1	ZINC000961068368	1319182491	/nfs/dbraw/zinc/18/24/91/1319182491.db2.gz	PJHWQVRQYTUCOQ-SJORKVTESA-N	0	3	343.446	3.168	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@H]([C@H]2CCCN(C(=O)C3CC3)C2)C1	ZINC000961082266	1319194025	/nfs/dbraw/zinc/19/40/25/1319194025.db2.gz	RKLNIZNGFGBJKH-PMACEKPBSA-N	0	3	337.467	3.029	20	30		EGEDHN
CCCC(=O)N1CCC[C@H]([C@@H]2CCN(Cc3ccc(C#N)s3)C2)C1	ZINC000961102365	1319212701	/nfs/dbraw/zinc/21/27/01/1319212701.db2.gz	TZPBWLYZTUBKCY-JKSUJKDBSA-N	0	3	345.512	3.480	20	30		EGEDHN
CCCC(=O)N1CCC[C@@H]([C@H]2CCN(Cc3ccc(C#N)s3)C2)C1	ZINC000961102345	1319213413	/nfs/dbraw/zinc/21/34/13/1319213413.db2.gz	TZPBWLYZTUBKCY-CVEARBPZSA-N	0	3	345.512	3.480	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@H](CNC(=O)[C@@H]3CC=CCC3)C2)c1	ZINC001023230344	1319370110	/nfs/dbraw/zinc/37/01/10/1319370110.db2.gz	TVBZUPYZXBYCJA-WOJBJXKFSA-N	0	3	337.467	3.243	20	30		EGEDHN
CCC(=O)N1CCC([C@@H]2CCCN(Cc3ccccc3C#N)C2)CC1	ZINC000961300140	1319462026	/nfs/dbraw/zinc/46/20/26/1319462026.db2.gz	SOMLKKMJSOLWOB-LJQANCHMSA-N	0	3	339.483	3.419	20	30		EGEDHN
N#CC1(CCCC[NH+]2CCC(C[N-]C(=O)C(F)(F)F)CC2)CCC1	ZINC000930307733	1328830758	/nfs/dbraw/zinc/83/07/58/1328830758.db2.gz	AMZJHHFDJXAUJB-UHFFFAOYSA-N	0	3	345.409	3.241	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)N2CCC[C@@H](C#N)C2)N2CCCC2)cc1	ZINC000915413459	1319481839	/nfs/dbraw/zinc/48/18/39/1319481839.db2.gz	KTYZBARLMUFFAN-HKUYNNGSSA-N	0	3	340.471	3.077	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](C2CCN(C(=O)[C@H](C)SC)CC2)C1	ZINC000961328949	1319484687	/nfs/dbraw/zinc/48/46/87/1319484687.db2.gz	CVJHYKFPPDKRBY-GOEBONIOSA-N	0	3	344.952	3.441	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2oc3c(cccc3F)c2C)C1	ZINC001023414522	1319519598	/nfs/dbraw/zinc/51/95/98/1319519598.db2.gz	VFOYIWYXEMTKSE-OAHLLOKOSA-N	0	3	342.414	3.345	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1ccccc1CCC(F)(F)F	ZINC000930344835	1328838184	/nfs/dbraw/zinc/83/81/84/1328838184.db2.gz	PIQROHXFHDHKRN-UHFFFAOYSA-N	0	3	341.377	3.258	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1sc(-c2ccccc2)cc1OC	ZINC000818599256	1319566955	/nfs/dbraw/zinc/56/69/55/1319566955.db2.gz	GBZAEMZYVKWLQT-UHFFFAOYSA-N	0	3	342.464	3.109	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@H](CNC(=O)[C@]34C[C@H]3CCC4)C2)c1	ZINC001023501995	1319605606	/nfs/dbraw/zinc/60/56/06/1319605606.db2.gz	NSVVMROYYGHTOE-SFHLNBCPSA-N	0	3	337.467	3.077	20	30		EGEDHN
C=CCN1CCC[C@@H](CNC(=O)c2cc(-c3cccs3)on2)C1	ZINC001023511940	1319616631	/nfs/dbraw/zinc/61/66/31/1319616631.db2.gz	BTVNZILEHMHCFX-ZDUSSCGKSA-N	0	3	331.441	3.031	20	30		EGEDHN
CC1(C)CC[C@H]1C(=O)NC[C@@H]1CCCN(Cc2ccc(C#N)cc2)C1	ZINC001023537679	1319645381	/nfs/dbraw/zinc/64/53/81/1319645381.db2.gz	MPEXLWFYZPGGAC-OALUTQOASA-N	0	3	339.483	3.323	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)COc1ccccc1C(C)C	ZINC000916875199	1319718953	/nfs/dbraw/zinc/71/89/53/1319718953.db2.gz	VSWUDZITYDNZFY-INIZCTEOSA-N	0	3	330.428	3.204	20	30		EGEDHN
Cc1ccccc1OCC(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1	ZINC000916881330	1319720478	/nfs/dbraw/zinc/72/04/78/1319720478.db2.gz	OCVZSFPLDBBXMT-OAHLLOKOSA-N	0	3	342.782	3.375	20	30		EGEDHN
Cc1cc(C)n([C@H](C)CC(=O)C(C#N)C(=O)Nc2cccc(C)c2)n1	ZINC000916898425	1319720947	/nfs/dbraw/zinc/72/09/47/1319720947.db2.gz	CSRWFPYSFMLPHA-WBVHZDCISA-N	0	3	338.411	3.107	20	30		EGEDHN
N#CC(C(=O)COC1CCCCC1)C(=O)Nc1ccccc1Cl	ZINC000916909486	1319723516	/nfs/dbraw/zinc/72/35/16/1319723516.db2.gz	BVHZHDFSENHMNL-ZDUSSCGKSA-N	0	3	334.803	3.337	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000916912036	1319724175	/nfs/dbraw/zinc/72/41/75/1319724175.db2.gz	IDPNEFXYHTYMLS-INIZCTEOSA-N	0	3	337.335	3.118	20	30		EGEDHN
C=CCN1CCC[C@@H](CNC(=O)c2ncoc2-c2cccs2)C1	ZINC001023653583	1319774609	/nfs/dbraw/zinc/77/46/09/1319774609.db2.gz	BDIDTCCYUZJPEU-ZDUSSCGKSA-N	0	3	331.441	3.031	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc(C)nc3ccccc32)C1	ZINC001023735797	1319878627	/nfs/dbraw/zinc/87/86/27/1319878627.db2.gz	RABQJSKUVLWCJD-QGZVFWFLSA-N	0	3	335.451	3.008	20	30		EGEDHN
C=C1CC(C)(C(=O)NC2CC(CNCc3nc(C)c(C)s3)C2)C1	ZINC000962267925	1319893343	/nfs/dbraw/zinc/89/33/43/1319893343.db2.gz	VRWISMASFSNUPU-UHFFFAOYSA-N	0	3	333.501	3.101	20	30		EGEDHN
C=CCN1CCC[C@@H](CNC(=O)c2ccc(C(F)(F)F)s2)C1	ZINC001023772798	1319922557	/nfs/dbraw/zinc/92/25/57/1319922557.db2.gz	BWUSCCIPRSGDLF-NSHDSACASA-N	0	3	332.391	3.395	20	30		EGEDHN
CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(CNCc2ccc(C#N)cc2F)C1	ZINC000823801563	1320208374	/nfs/dbraw/zinc/20/83/74/1320208374.db2.gz	JEUMFJQNLOBDDK-DNVCBOLYSA-N	0	3	345.418	3.044	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCC[C@]2(C)CC2(Cl)Cl)CC1	ZINC000836288089	1320469060	/nfs/dbraw/zinc/46/90/60/1320469060.db2.gz	SYAUCZNAWUPSKL-OAHLLOKOSA-N	0	3	348.318	3.300	20	30		EGEDHN
C[C@H]1CC(C)(C)CN1Cc1cc(=O)n2c3ccccc3[nH]c2c1C#N	ZINC000839658408	1320953381	/nfs/dbraw/zinc/95/33/81/1320953381.db2.gz	MSOSFXMIMSPGQP-ZFWWWQNUSA-N	0	3	334.423	3.344	20	30		EGEDHN
C[C@H](NC(=O)c1cccs1)C(=O)C(C#N)c1nc(C2CC2)cs1	ZINC000842938170	1321451286	/nfs/dbraw/zinc/45/12/86/1321451286.db2.gz	IYIGMYQMJGYHBX-GXSJLCMTSA-N	0	3	345.449	3.077	20	30		EGEDHN
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@H](NCC3(C#N)CCC3)C[C@H]2C1	ZINC000843413319	1321513648	/nfs/dbraw/zinc/51/36/48/1321513648.db2.gz	LCXUWBBRWJOICQ-HRCADAONSA-N	0	3	333.476	3.305	20	30		EGEDHN
N#CC(C(=O)CCCc1ccc2c(c1)CCCC2)C(=O)N1CCCC1	ZINC000845440213	1321707717	/nfs/dbraw/zinc/70/77/17/1321707717.db2.gz	OVLFZKYODBKFDR-IBGZPJMESA-N	0	3	338.451	3.219	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)C(=O)N1C[C@@H](N(C)C)Cc2ccccc21	ZINC000846865045	1321818332	/nfs/dbraw/zinc/81/83/32/1321818332.db2.gz	HOQZLTLPEWXQGM-JXFKEZNVSA-N	0	3	347.462	3.256	20	30		EGEDHN
CSC[C@@H](C)C(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847749597	1321900596	/nfs/dbraw/zinc/90/05/96/1321900596.db2.gz	WBPQBRDKEQHEPG-MRXNPFEDSA-N	0	3	346.496	3.335	20	30		EGEDHN
C[C@@H](COC(=O)c1cnc(C(F)(F)F)c(C#N)c1)N1CCCCC1	ZINC000847963201	1321917186	/nfs/dbraw/zinc/91/71/86/1321917186.db2.gz	OFFUZKUPWYMAQK-NSHDSACASA-N	0	3	341.333	3.003	20	30		EGEDHN
C#CCCOc1ccc(CN[C@@H]2CCc3ccccc3NC2=O)cc1	ZINC000848561522	1321976605	/nfs/dbraw/zinc/97/66/05/1321976605.db2.gz	XMFYMVGGIZQZSN-HXUWFJFHSA-N	0	3	334.419	3.132	20	30		EGEDHN
CCN1CCN(c2ccc(N=Cc3cccc(O)c3O)c(C)c2)CC1	ZINC000920944785	1322238092	/nfs/dbraw/zinc/23/80/92/1322238092.db2.gz	KOFBJPVFJJNPAL-UHFFFAOYSA-N	0	3	339.439	3.299	20	30		EGEDHN
C#CCOc1ccc([C@H](C)NCC2(S(C)(=O)=O)CCCCC2)cc1	ZINC000850531284	1322262214	/nfs/dbraw/zinc/26/22/14/1322262214.db2.gz	ISIMKSQPAFFRTJ-INIZCTEOSA-N	0	3	349.496	3.097	20	30		EGEDHN
Cc1cc(C[C@@H](C)NCc2cc(C#N)ccc2Br)[nH]n1	ZINC000921861756	1322413990	/nfs/dbraw/zinc/41/39/90/1322413990.db2.gz	YTFJBEPCCSAYGD-SNVBAGLBSA-N	0	3	333.233	3.073	20	30		EGEDHN
Cc1cc(C[C@@H](C)NCc2cc(C#N)ccc2Br)n[nH]1	ZINC000921861756	1322413993	/nfs/dbraw/zinc/41/39/93/1322413993.db2.gz	YTFJBEPCCSAYGD-SNVBAGLBSA-N	0	3	333.233	3.073	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC[C@@H](CNCc2ocnc2C)C1	ZINC001024002388	1323072655	/nfs/dbraw/zinc/07/26/55/1323072655.db2.gz	CCLYNURTGWZSST-AWEZNQCLSA-N	0	3	339.867	3.090	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](CNCc2nc3ccccc3o2)C1	ZINC001024095138	1323126438	/nfs/dbraw/zinc/12/64/38/1323126438.db2.gz	RDNGRNMSWMUASV-HNNXBMFYSA-N	0	3	341.455	3.368	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@@H](CNCc3ccccc3C#N)C2)CCC1	ZINC001024108934	1323140507	/nfs/dbraw/zinc/14/05/07/1323140507.db2.gz	COUUWUBGLZZKTG-KRWDZBQOSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H](CNCc2oc(C)nc2C)C1	ZINC001024137889	1323163122	/nfs/dbraw/zinc/16/31/22/1323163122.db2.gz	VBTRDAKJGRLLGX-LPHOPBHVSA-N	0	3	333.476	3.222	20	30		EGEDHN
N#CC[C@@H]1CCCN(CC(=O)C(C#N)c2nc3ccccc3s2)C1	ZINC000852319643	1323178999	/nfs/dbraw/zinc/17/89/99/1323178999.db2.gz	QTXJONRPGWJPKY-KBPBESRZSA-N	0	3	338.436	3.098	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)c2ccccn2)C1	ZINC000963236460	1323247421	/nfs/dbraw/zinc/24/74/21/1323247421.db2.gz	RRLAGBJPSNMATQ-RDJZCZTQSA-N	0	3	333.863	3.151	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)c2ccccc2O)C1	ZINC000963252412	1323262959	/nfs/dbraw/zinc/26/29/59/1323262959.db2.gz	VJJYMBHVEMIEKW-NVXWUHKLSA-N	0	3	348.874	3.461	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)[C@@H]1[C@@H](c2ccccc2)C1(C)C	ZINC001024440037	1323402539	/nfs/dbraw/zinc/40/25/39/1323402539.db2.gz	JQOBZPSYWQGZSJ-AQNXPRMDSA-N	0	3	338.495	3.420	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NC[C@@H]1CCCCN1CC(=C)C	ZINC001024515537	1323466142	/nfs/dbraw/zinc/46/61/42/1323466142.db2.gz	UWTFEIYSMFDPOR-KRWDZBQOSA-N	0	3	328.456	3.412	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccc2cc(C)ccc2n1	ZINC001024545997	1323487639	/nfs/dbraw/zinc/48/76/39/1323487639.db2.gz	SSTNURPRUFBUQH-SFHVURJKSA-N	0	3	335.451	3.151	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cc2cc(F)ccc2[nH]1	ZINC001024588707	1323523478	/nfs/dbraw/zinc/52/34/78/1323523478.db2.gz	DCQGSXWQANLOEE-MRXNPFEDSA-N	0	3	329.419	3.467	20	30		EGEDHN
N#CC1(CCN2CCN(CCc3ccncc3)CC2)CCCCC1	ZINC000931342476	1329098916	/nfs/dbraw/zinc/09/89/16/1329098916.db2.gz	QOKIZZXXZWBPHT-UHFFFAOYSA-N	0	3	326.488	3.106	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@@H]1CCc2ccccc2C1	ZINC001024681986	1323596586	/nfs/dbraw/zinc/59/65/86/1323596586.db2.gz	UZNMQJPZRAGYJB-UXHICEINSA-N	0	3	326.484	3.338	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccc(N(CC)CC)cc1	ZINC001024777238	1323678271	/nfs/dbraw/zinc/67/82/71/1323678271.db2.gz	HEKYQXGLPUEBSG-HXUWFJFHSA-N	0	3	341.499	3.140	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccsc1C(F)F	ZINC001024780674	1323683852	/nfs/dbraw/zinc/68/38/52/1323683852.db2.gz	APSNDYTVESBVJX-GFCCVEGCSA-N	0	3	326.412	3.293	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)C1CCC(C(F)F)CC1	ZINC001024782012	1323685950	/nfs/dbraw/zinc/68/59/50/1323685950.db2.gz	FSEIHRFAVBCDJP-GPANFISMSA-N	0	3	326.431	3.052	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccccc1OCC1CC1	ZINC001024813985	1323714857	/nfs/dbraw/zinc/71/48/57/1323714857.db2.gz	LBJLUURFJUVOIJ-GOSISDBHSA-N	0	3	340.467	3.083	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1	ZINC001024819402	1323724195	/nfs/dbraw/zinc/72/41/95/1323724195.db2.gz	OMSOHDXTRHXTAF-MRXNPFEDSA-N	0	3	343.431	3.009	20	30		EGEDHN
CC(C)CC(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)c(F)c1	ZINC001024850395	1323745319	/nfs/dbraw/zinc/74/53/19/1323745319.db2.gz	OYJXQCFSCYZANN-QGZVFWFLSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCCC[C@@H]1CNCc1ccc(OC)nc1	ZINC001025037375	1323840219	/nfs/dbraw/zinc/84/02/19/1323840219.db2.gz	BJBUQTKAKAGBPC-QGZVFWFLSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@H]1CNCc1ccnc(Cl)c1	ZINC001025041253	1323845088	/nfs/dbraw/zinc/84/50/88/1323845088.db2.gz	XMBCOSBPMAITHC-HNNXBMFYSA-N	0	3	335.879	3.418	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)[C@H]2C[C@H]3C[C@H]3C2)s1	ZINC001025053027	1323858965	/nfs/dbraw/zinc/85/89/65/1323858965.db2.gz	JDPQYPNTCPMYRG-FXUDXRNXSA-N	0	3	343.496	3.137	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)CCc1ccco1	ZINC001025200615	1323984232	/nfs/dbraw/zinc/98/42/32/1323984232.db2.gz	FNZUXTMJFNSJKP-OALUTQOASA-N	0	3	328.456	3.081	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cncc(Cl)c1C	ZINC001025240493	1324034039	/nfs/dbraw/zinc/03/40/39/1324034039.db2.gz	PETMPLJXKBOLOY-ZWKOTPCHSA-N	0	3	345.874	3.136	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(C)c(F)cc1F	ZINC001025240118	1324035152	/nfs/dbraw/zinc/03/51/52/1324035152.db2.gz	LUVAYMPSKCINFC-RBUKOAKNSA-N	0	3	346.421	3.366	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccnc2ccccc21	ZINC001025251334	1324054177	/nfs/dbraw/zinc/05/41/77/1324054177.db2.gz	RTWZXVFOHLBADV-LEWJYISDSA-N	0	3	347.462	3.327	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)C1(C2CC2)CCC1	ZINC001025254153	1324059775	/nfs/dbraw/zinc/05/97/75/1324059775.db2.gz	DZTHJDKMHFENPP-MOPGFXCFSA-N	0	3	328.500	3.436	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(C(C)C)on1	ZINC001025254907	1324060846	/nfs/dbraw/zinc/06/08/46/1324060846.db2.gz	NBNWNWUNAHHJAW-MSOLQXFVSA-N	0	3	343.471	3.280	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(C2CC2)on1	ZINC001025254589	1324060956	/nfs/dbraw/zinc/06/09/56/1324060956.db2.gz	LEMOZJOJQALFAC-IRXDYDNUSA-N	0	3	329.444	3.197	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc2ncccc2c1	ZINC001025264534	1324075825	/nfs/dbraw/zinc/07/58/25/1324075825.db2.gz	AVVURENUNUNVRD-SFTDATJTSA-N	0	3	347.462	3.327	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cncc(Cl)c1	ZINC001025278405	1324099700	/nfs/dbraw/zinc/09/97/00/1324099700.db2.gz	SHJUPUWFLMEZCM-ZWKOTPCHSA-N	0	3	345.874	3.217	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cnoc1C(C)C	ZINC001025288176	1324110991	/nfs/dbraw/zinc/11/09/91/1324110991.db2.gz	STEHFIXZYSQFGE-DLBZAZTESA-N	0	3	331.460	3.443	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1coc(CCC)n1	ZINC001025288196	1324111530	/nfs/dbraw/zinc/11/15/30/1324111530.db2.gz	JJNZCUIJGZZHEE-MSOLQXFVSA-N	0	3	343.471	3.110	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)Cc1ccccc1F	ZINC001025294784	1324124330	/nfs/dbraw/zinc/12/43/30/1324124330.db2.gz	CRVMGYOTAGYFHX-PMACEKPBSA-N	0	3	342.458	3.237	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc(OCC)cc1	ZINC001025296556	1324128290	/nfs/dbraw/zinc/12/82/90/1324128290.db2.gz	KFHQWFIGKVUPRE-VQTJNVASSA-N	0	3	340.467	3.178	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)Cc1sc(C)cc1C	ZINC001025297053	1324129586	/nfs/dbraw/zinc/12/95/86/1324129586.db2.gz	NTZJFRAXBCAYJF-ZWKOTPCHSA-N	0	3	344.524	3.386	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(C)n(C(C)C)n1	ZINC001025304152	1324138445	/nfs/dbraw/zinc/13/84/45/1324138445.db2.gz	MJTVAYSAGYPXFO-RBUKOAKNSA-N	0	3	344.503	3.418	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cscc2C(F)F)C1	ZINC001025424553	1324257519	/nfs/dbraw/zinc/25/75/19/1324257519.db2.gz	FMBURRXROIXCKZ-NEPJUHHUSA-N	0	3	326.412	3.149	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2nc(C(C)(C)C)cs2)C1	ZINC001025445368	1324285600	/nfs/dbraw/zinc/28/56/00/1324285600.db2.gz	LWRSCXBSJAKUFJ-GJZGRUSLSA-N	0	3	347.528	3.294	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(C)c3ccccc3n2)C1	ZINC001025457753	1324299208	/nfs/dbraw/zinc/29/92/08/1324299208.db2.gz	FHAXZTOTRVYFQG-IAGOWNOFSA-N	0	3	335.451	3.007	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc3ccccc3s2)C1	ZINC001025471458	1324317332	/nfs/dbraw/zinc/31/73/32/1324317332.db2.gz	FAXWTKSJTQTLKE-ZBFHGGJFSA-N	0	3	326.465	3.365	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccnc3ccccc32)C1	ZINC001025480645	1324327790	/nfs/dbraw/zinc/32/77/90/1324327790.db2.gz	YTWPONWFXKLJKK-SJORKVTESA-N	0	3	335.451	3.088	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(C3CC3)oc2C2CC2)C1	ZINC001025484226	1324332184	/nfs/dbraw/zinc/33/21/84/1324332184.db2.gz	AVHVBEDZHYKIOB-YOEHRIQHSA-N	0	3	340.467	3.498	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cnc3ccsc3c2)C1	ZINC001025503869	1324353213	/nfs/dbraw/zinc/35/32/13/1324353213.db2.gz	VWBVGQTUNZWVEJ-GJZGRUSLSA-N	0	3	341.480	3.150	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc3ccccc3n2C)C1	ZINC001025518838	1324362590	/nfs/dbraw/zinc/36/25/90/1324362590.db2.gz	INHZWNJZRURJRC-SJLPKXTDSA-N	0	3	337.467	3.032	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc3occc3s2)C1	ZINC001025534920	1324382571	/nfs/dbraw/zinc/38/25/71/1324382571.db2.gz	RDIVXGUCVSIVAF-KGLIPLIRSA-N	0	3	330.453	3.348	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2oc(CC(C)C)nc2C)C1	ZINC001025555261	1324403547	/nfs/dbraw/zinc/40/35/47/1324403547.db2.gz	LCPFYBCXIXKQDN-WBVHZDCISA-N	0	3	345.487	3.035	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccsc2C(F)(F)F)C1	ZINC001025603103	1324451209	/nfs/dbraw/zinc/45/12/09/1324451209.db2.gz	QPNCVKSOVHRSIW-NEPJUHHUSA-N	0	3	344.402	3.230	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(-c3cccs3)o2)C1	ZINC001025607147	1324457483	/nfs/dbraw/zinc/45/74/83/1324457483.db2.gz	SGNNXJYEOIEVSY-CABCVRRESA-N	0	3	342.464	3.472	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2coc3ccc(F)cc23)C1	ZINC001025609350	1324460261	/nfs/dbraw/zinc/46/02/61/1324460261.db2.gz	NYGSANQWJCVLEJ-ZIAGYGMSSA-N	0	3	328.387	3.035	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2sc(C(C)C)nc2C)C1	ZINC001025618429	1324470893	/nfs/dbraw/zinc/47/08/93/1324470893.db2.gz	BGQYNDSRFDSLLF-ZFWWWQNUSA-N	0	3	333.501	3.038	20	30		EGEDHN
CCC(CC)C(=O)N1C[C@@H]2CC[C@@H](NCc3ccccc3C#N)[C@H]2C1	ZINC001026203857	1324662887	/nfs/dbraw/zinc/66/28/87/1324662887.db2.gz	YCSVWRSDODGNIP-SLFFLAALSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H]2CC[C@H](NCc3ncoc3C(C)C)[C@@H]2C1	ZINC001026329223	1324730557	/nfs/dbraw/zinc/73/05/57/1324730557.db2.gz	AAZWYDWIKHFYRA-XHSDSOJGSA-N	0	3	345.487	3.337	20	30		EGEDHN
CC1(C(=O)N2C[C@@H]3CC[C@H](NCc4ccccc4C#N)[C@@H]3C2)CCC1	ZINC001026332699	1324733003	/nfs/dbraw/zinc/73/30/03/1324733003.db2.gz	OKSWBFZQQZBMQC-OTWHNJEPSA-N	0	3	337.467	3.075	20	30		EGEDHN
Cc1cc[nH]c1C(=O)NC1CCC(NCc2ccccc2C#N)CC1	ZINC001026486882	1324842479	/nfs/dbraw/zinc/84/24/79/1324842479.db2.gz	WKXGMCUSMIBOSO-UHFFFAOYSA-N	0	3	336.439	3.026	20	30		EGEDHN
C=C1CCC(C(=O)NC2CCC(NCc3ccn(CC)n3)CC2)CC1	ZINC001026554025	1324890080	/nfs/dbraw/zinc/89/00/80/1324890080.db2.gz	DHDZEQLZHVETBA-UHFFFAOYSA-N	0	3	344.503	3.166	20	30		EGEDHN
CC(C(=O)N1CC[C@@H](CNCc2cc(F)ccc2C#N)C1)=C1CCC1	ZINC001026835659	1325040756	/nfs/dbraw/zinc/04/07/56/1325040756.db2.gz	CAFISHSPFOWXIC-HNNXBMFYSA-N	0	3	341.430	3.136	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)c2cc[nH]c2C)C1	ZINC000963282030	1325063132	/nfs/dbraw/zinc/06/31/32/1325063132.db2.gz	NMJZHOMIKWLNRE-WBVHZDCISA-N	0	3	335.879	3.392	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)c2coc(C)n2)C1	ZINC000963289535	1325075009	/nfs/dbraw/zinc/07/50/09/1325075009.db2.gz	JNJSCYVBXMGOLD-ZBFHGGJFSA-N	0	3	337.851	3.052	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@H](CNCc2ccccc2C#N)C1)C(C)(C)C	ZINC001026919932	1325082650	/nfs/dbraw/zinc/08/26/50/1325082650.db2.gz	QQCXUHWQTOTVEP-JKSUJKDBSA-N	0	3	327.472	3.179	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](CNCc3nc(C)sc3C)C2)C1	ZINC001027051334	1325190105	/nfs/dbraw/zinc/19/01/05/1325190105.db2.gz	XOSPTDGOOOPABJ-HNNXBMFYSA-N	0	3	333.501	3.054	20	30		EGEDHN
C=C(Br)CNC1CC2(C1)CC(NC(=O)C1CCCC1)C2	ZINC000963476633	1325272719	/nfs/dbraw/zinc/27/27/19/1325272719.db2.gz	PAFCYNPGJRZNAG-UHFFFAOYSA-N	0	3	341.293	3.102	20	30		EGEDHN
C/C(=C/C(=O)N1CCC[C@H](N(C)Cc2cccc(C#N)c2)C1)C1CC1	ZINC001027313385	1325465448	/nfs/dbraw/zinc/46/54/48/1325465448.db2.gz	DRWLNEBERAZTQQ-VZEGMYIASA-N	0	3	337.467	3.337	20	30		EGEDHN
C[C@@H](CC(C)(C)C#N)N[C@@H]1CCCN(Cc2ccc(F)cc2F)C1=O	ZINC000926255912	1325492860	/nfs/dbraw/zinc/49/28/60/1325492860.db2.gz	NKHIZLGROIVVJX-SUMWQHHRSA-N	0	3	349.425	3.374	20	30		EGEDHN
Cc1nc(C(C)C)ccc1CN(C)[C@@H]1CCCN(C(=O)[C@H](C)C#N)C1	ZINC001027336216	1325495712	/nfs/dbraw/zinc/49/57/12/1325495712.db2.gz	NZHFOBTXDAHRGJ-CRAIPNDOSA-N	0	3	342.487	3.096	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)[C@H]2[C@@H]3CCC[C@@H]32)C1	ZINC001027354483	1325528299	/nfs/dbraw/zinc/52/82/99/1325528299.db2.gz	FPGXPABFYZBKGA-ZRNYENFQSA-N	0	3	337.467	3.027	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)/C=C\c2ccc[nH]2)C1	ZINC001027382321	1325581125	/nfs/dbraw/zinc/58/11/25/1325581125.db2.gz	QQPDRKQUOOCKQJ-JPMGXVIASA-N	0	3	348.450	3.023	20	30		EGEDHN
N#CC(C(=O)CCCc1ccc2c(c1)OCCCO2)c1ccccn1	ZINC000860467189	1329320746	/nfs/dbraw/zinc/32/07/46/1329320746.db2.gz	GHACAASDJNDQDT-INIZCTEOSA-N	0	3	336.391	3.442	20	30		EGEDHN
CCO[C@H](C(=O)C(C#N)C(=O)Nc1cccc2ccccc21)C1CC1	ZINC000860469310	1329320945	/nfs/dbraw/zinc/32/09/45/1329320945.db2.gz	HWANWEHWIUZEBP-APWZRJJASA-N	0	3	336.391	3.302	20	30		EGEDHN
C=C1CCC(C(=O)NC2CC3(CC(NCc4cnoc4C)C3)C2)CC1	ZINC000964881323	1327747392	/nfs/dbraw/zinc/74/73/92/1327747392.db2.gz	PLVJVGDWCONOES-UHFFFAOYSA-N	0	3	343.471	3.246	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)CC2(C)CC2)C1	ZINC001027495858	1327759252	/nfs/dbraw/zinc/75/92/52/1327759252.db2.gz	HQDUGUAHIZAFFF-GOSISDBHSA-N	0	3	325.456	3.171	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)[C@]2(C)C=CCC2)C1	ZINC001027532346	1327816499	/nfs/dbraw/zinc/81/64/99/1327816499.db2.gz	YRSKQOIFVQLZEH-TZIWHRDSSA-N	0	3	337.467	3.337	20	30		EGEDHN
CC(C)C1(C(=O)N2CCC[C@@H](N(C)Cc3ccc(C#N)cc3)C2)CC1	ZINC001027567762	1327897891	/nfs/dbraw/zinc/89/78/91/1327897891.db2.gz	ZYNFNDFBGHYOCU-LJQANCHMSA-N	0	3	339.483	3.417	20	30		EGEDHN
Cc1c([C@H](C)NCCNc2ccc(C#N)cn2)cnn1-c1ccccc1	ZINC000927165634	1327903402	/nfs/dbraw/zinc/90/34/02/1327903402.db2.gz	QGQGPBUDKPRKHE-HNNXBMFYSA-N	0	3	346.438	3.210	20	30		EGEDHN
COc1ccc([C@@H](NCCNc2ccc(C#N)cn2)C2CC2)c(F)c1	ZINC000927169354	1327906272	/nfs/dbraw/zinc/90/62/72/1327906272.db2.gz	YDTITWUKVFQGDE-IBGZPJMESA-N	0	3	340.402	3.254	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@@H](N(C)Cc2ccc(F)c(C#N)c2)C1	ZINC001027585270	1327920064	/nfs/dbraw/zinc/92/00/64/1327920064.db2.gz	DYRWHFUGUFEVNW-KBAYOESNSA-N	0	3	343.446	3.166	20	30		EGEDHN
CN(Cc1ccc(F)c(C#N)c1)[C@@H]1CCCN(C(=O)C(C)(C)C)C1	ZINC001027658076	1328042335	/nfs/dbraw/zinc/04/23/35/1328042335.db2.gz	CUWKCXBKJJEKEZ-MRXNPFEDSA-N	0	3	331.435	3.166	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1	ZINC001027663061	1328054393	/nfs/dbraw/zinc/05/43/93/1328054393.db2.gz	VRPCLSLHMSUSOU-ZDUSSCGKSA-N	0	3	325.239	3.163	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2cc(F)cc3ccncc32)C1	ZINC000966171029	1328213962	/nfs/dbraw/zinc/21/39/62/1328213962.db2.gz	ZKTUPDXUAPCXTD-AUUYWEPGSA-N	0	3	341.430	3.390	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2ccc3cc(C)cn3c2)C1	ZINC000966632324	1328362667	/nfs/dbraw/zinc/36/26/67/1328362667.db2.gz	KLOODWIEEDTSDK-QFBILLFUSA-N	0	3	325.456	3.264	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](C)[C@@H](NC(=O)c2nc3cccnc3s2)C1	ZINC000966750400	1328400503	/nfs/dbraw/zinc/40/05/03/1328400503.db2.gz	HQEVQTZASBYFPR-HIFRSBDPSA-N	0	3	344.484	3.098	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1cc(C2CCCCC2)n[nH]1	ZINC001027935888	1328413759	/nfs/dbraw/zinc/41/37/59/1328413759.db2.gz	UCONFYRZCUBMQE-MRXNPFEDSA-N	0	3	330.476	3.228	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1ccnc(-c2ccco2)c1	ZINC001027955445	1328424966	/nfs/dbraw/zinc/42/49/66/1328424966.db2.gz	BXBVAXCGZVSYTM-MRXNPFEDSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2nccc3ccsc32)C1	ZINC000966846038	1328436869	/nfs/dbraw/zinc/43/68/69/1328436869.db2.gz	OOQFXMSEWMQUKO-UKRRQHHQSA-N	0	3	329.469	3.313	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@H](OCCC)c2ccc(F)cc2C)CC1	ZINC000932140484	1329788315	/nfs/dbraw/zinc/78/83/15/1329788315.db2.gz	CVMYSYPWCIWJMQ-LJQANCHMSA-N	0	3	348.462	3.368	20	30		EGEDHN
C[C@H](c1ccccc1)[C@H]1CCCN1CC(=O)N[C@](C)(C#N)C1CC1	ZINC000932279657	1329803070	/nfs/dbraw/zinc/80/30/70/1329803070.db2.gz	RVYFVQYCFHZUIO-XFQXTVEOSA-N	0	3	325.456	3.063	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@](C)(C2CC2)C(F)(F)F)CC1	ZINC000933593095	1329904670	/nfs/dbraw/zinc/90/46/70/1329904670.db2.gz	WTBCBHZPOGNNNU-OAHLLOKOSA-N	0	3	333.398	3.057	20	30		EGEDHN
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)c1c[nH]c(C#N)c1	ZINC000866180557	1330074428	/nfs/dbraw/zinc/07/44/28/1330074428.db2.gz	RHJUDPONEZWNAP-LJQANCHMSA-N	0	3	336.439	3.013	20	30		EGEDHN
C[C@H](NCc1cc2c([nH]c1=O)CCCC2)c1ccc(OCC#N)cc1	ZINC000866640467	1330136951	/nfs/dbraw/zinc/13/69/51/1330136951.db2.gz	GRZNZSYQDXFESX-AWEZNQCLSA-N	0	3	337.423	3.419	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc3c2CCCCC3)[C@@H](C)C1	ZINC000942157363	1331851012	/nfs/dbraw/zinc/85/10/12/1331851012.db2.gz	QJXNYJSCGWETEK-UWJYYQICSA-N	0	3	338.495	3.419	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(C(C)(C)CC)cc2)[C@@H](C)C1	ZINC000942163425	1331854274	/nfs/dbraw/zinc/85/42/74/1331854274.db2.gz	KLTRJFAOKOHFND-QFBILLFUSA-N	0	3	326.484	3.448	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccccc2C(C)(C)CC)[C@@H](C)C1	ZINC000942163873	1331855799	/nfs/dbraw/zinc/85/57/99/1331855799.db2.gz	PAJNWSZXKFMPNY-LPHOPBHVSA-N	0	3	326.484	3.448	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2sc(C)nc2CC(C)C)[C@H](C)C1	ZINC000942313691	1331900455	/nfs/dbraw/zinc/90/04/55/1331900455.db2.gz	LGOGLBGQXIAPQB-HIFRSBDPSA-N	0	3	335.517	3.276	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(CCCC)cc2)[C@@H](C)C1	ZINC000942391018	1331920557	/nfs/dbraw/zinc/92/05/57/1331920557.db2.gz	DOGUJNSSSYZMOX-FXAWDEMLSA-N	0	3	326.484	3.493	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(C(F)F)cc2)[C@@H](C)C1	ZINC000942468105	1331941049	/nfs/dbraw/zinc/94/10/49/1331941049.db2.gz	VURRETQQVJNYNE-YOEHRIQHSA-N	0	3	334.410	3.017	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnc3c(F)cccc3c2)[C@H](C)C1	ZINC000942497698	1331946974	/nfs/dbraw/zinc/94/69/74/1331946974.db2.gz	ULOBPCWDBTUKDB-CXAGYDPISA-N	0	3	327.403	3.000	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)cc2)CC[C@H]1NC(=O)C1(C)CCCC1	ZINC000942540069	1331964993	/nfs/dbraw/zinc/96/49/93/1331964993.db2.gz	GRHSBTFIAUOPEW-VQIMIIECSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3ccc(F)cc3)CCC2)[C@@H](C)C1	ZINC000942547044	1331968733	/nfs/dbraw/zinc/96/87/33/1331968733.db2.gz	FIAOBOYEVQVWEI-QFBILLFUSA-N	0	3	342.458	3.097	20	30		EGEDHN
Cc1coc(C(=O)N[C@@H]2CCN(Cc3cccc(C#N)c3)C[C@H]2C)c1	ZINC000942565386	1331978110	/nfs/dbraw/zinc/97/81/10/1331978110.db2.gz	KWIOCZJTNUCFPM-CRAIPNDOSA-N	0	3	337.423	3.100	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)cc2)CC[C@H]1NC(=O)C(C)(C)C1CC1	ZINC000942569345	1331980571	/nfs/dbraw/zinc/98/05/71/1331980571.db2.gz	JCAYLKYPVCGEIZ-DNVCBOLYSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2csc(-c3ccco3)n2)[C@@H](C)C1	ZINC000942584340	1331990362	/nfs/dbraw/zinc/99/03/62/1331990362.db2.gz	WDORGRRSSOFXOE-STQMWFEESA-N	0	3	331.441	3.029	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(-c3ccccc3)o2)[C@H](C)C1	ZINC000942937194	1332062284	/nfs/dbraw/zinc/06/22/84/1332062284.db2.gz	HTJQHAVOLCPLNX-SJLPKXTDSA-N	0	3	336.435	3.410	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc3nc(C)sc3c2)[C@@H](C)C1	ZINC000943990027	1332305508	/nfs/dbraw/zinc/30/55/08/1332305508.db2.gz	ZUIWYFPGSUHJCC-XJKSGUPXSA-N	0	3	341.480	3.068	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2c[nH]nc2C2CCCCC2)[C@@H](C)C1	ZINC000944081222	1332323333	/nfs/dbraw/zinc/32/33/33/1332323333.db2.gz	RAHLGVHMBKSBAU-YOEHRIQHSA-N	0	3	330.476	3.084	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccc(Cl)c2Cl)[C@H](C)C1	ZINC000944303073	1332367186	/nfs/dbraw/zinc/36/71/86/1332367186.db2.gz	AETIIHMUDNLOTR-IUODEOHRSA-N	0	3	339.266	3.457	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(Cl)ccc2Cl)[C@@H](C)C1	ZINC000944305248	1332367805	/nfs/dbraw/zinc/36/78/05/1332367805.db2.gz	LRPUTMDOKRJHRT-LRDDRELGSA-N	0	3	339.266	3.457	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C(C)(C)C)cc2)[C@@H](C)C1	ZINC000944306203	1332369030	/nfs/dbraw/zinc/36/90/30/1332369030.db2.gz	RBVVNSYHRICNSX-QFBILLFUSA-N	0	3	326.484	3.448	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3ccccc3C)CCC2)[C@@H](C)C1	ZINC000944444170	1332413272	/nfs/dbraw/zinc/41/32/72/1332413272.db2.gz	JRZSEOOUSGDGDJ-ICSRJNTNSA-N	0	3	338.495	3.267	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccccc2-c2ccccc2)[C@@H](C)C1	ZINC000944698361	1332422607	/nfs/dbraw/zinc/42/26/07/1332422607.db2.gz	FRKMMEBKNOMERQ-UWJYYQICSA-N	0	3	332.447	3.427	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2csc3c2CCCC3)[C@@H](C)C1	ZINC000944698283	1332422640	/nfs/dbraw/zinc/42/26/40/1332422640.db2.gz	FAQHOTAUCRSNFW-YOEHRIQHSA-N	0	3	330.497	3.090	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(CC(C)C)cc2)[C@H](C)C1	ZINC000944789216	1332424494	/nfs/dbraw/zinc/42/44/94/1332424494.db2.gz	KJLPVHGFFLVTPQ-XLIONFOSSA-N	0	3	326.484	3.349	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3ccccc3F)CC[C@@H]2C1	ZINC000946454296	1332833940	/nfs/dbraw/zinc/83/39/40/1332833940.db2.gz	BLTHMSHILRSISE-GASCZTMLSA-N	0	3	336.838	3.362	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)C2CCCC2)CCN1Cc1ccc(C#N)cc1	ZINC000946972109	1332949798	/nfs/dbraw/zinc/94/97/98/1332949798.db2.gz	WKWJZJZNWWQOOB-DNVCBOLYSA-N	0	3	325.456	3.218	20	30		EGEDHN
Cc1cncc(C(=O)N[C@H]2CCN(Cc3ccc(C#N)cc3)[C@@H](C)C2)c1	ZINC000947162925	1333031022	/nfs/dbraw/zinc/03/10/22/1333031022.db2.gz	NUBLBGFIDAOPQS-JXFKEZNVSA-N	0	3	348.450	3.045	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)C2CC(F)(F)C2)CCN1Cc1cccc(C#N)c1	ZINC000947169948	1333034297	/nfs/dbraw/zinc/03/42/97/1333034297.db2.gz	AQXLRSFDPORBDD-SUMWQHHRSA-N	0	3	347.409	3.073	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccccc2CC(C)(C)C)C[C@H]1C	ZINC000947429462	1333124982	/nfs/dbraw/zinc/12/49/82/1333124982.db2.gz	IDDSRDXXZLTENB-SJLPKXTDSA-N	0	3	326.484	3.491	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2c(C)c(F)ccc2Cl)C[C@H]1C	ZINC000947467592	1333139862	/nfs/dbraw/zinc/13/98/62/1333139862.db2.gz	CPHMTJYKBBQLIP-TZMCWYRMSA-N	0	3	336.838	3.394	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2sc(C)nc2CC(C)C)C[C@@H]1C	ZINC000947506304	1333149789	/nfs/dbraw/zinc/14/97/89/1333149789.db2.gz	NLASSHRBISRVPS-GOEBONIOSA-N	0	3	347.528	3.256	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccc(-n3cccc3)c2)C[C@@H]1C	ZINC000947512047	1333151409	/nfs/dbraw/zinc/15/14/09/1333151409.db2.gz	SQWCMGXRQPJJST-PKOBYXMFSA-N	0	3	335.451	3.083	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnc3c(F)cccc3c2)C[C@H]1C	ZINC000947547469	1333167536	/nfs/dbraw/zinc/16/75/36/1333167536.db2.gz	RNOKRTRSRIAXEQ-CZUORRHYSA-N	0	3	327.403	3.143	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(CCC(F)(F)F)[C@@H](C)C2)cc1	ZINC000947612115	1333192401	/nfs/dbraw/zinc/19/24/01/1333192401.db2.gz	UAAGOSDWWXMNGN-XJKSGUPXSA-N	0	3	338.373	3.203	20	30		EGEDHN
Cc1cocc1C(=O)N[C@@H]1CCN(Cc2cccc(C#N)c2)[C@H](C)C1	ZINC000947623487	1333197229	/nfs/dbraw/zinc/19/72/29/1333197229.db2.gz	BMBAQXUJAZRSIW-CRAIPNDOSA-N	0	3	337.423	3.243	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)C(C)(C)C2CC2)CCN1Cc1ccc(C#N)cc1	ZINC000947635573	1333202380	/nfs/dbraw/zinc/20/23/80/1333202380.db2.gz	VWVRLHBNBZFYFX-BEFAXECRSA-N	0	3	339.483	3.464	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(F)c(Cl)cc2F)C[C@@H]1C	ZINC000947674998	1333218151	/nfs/dbraw/zinc/21/81/51/1333218151.db2.gz	DPKIDFAAGMXRQI-WDEREUQCSA-N	0	3	328.790	3.387	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3scnc3C)[C@H](C)C2)C1	ZINC000947702890	1333233556	/nfs/dbraw/zinc/23/35/56/1333233556.db2.gz	UJNBSZHTJWPQKV-HIFRSBDPSA-N	0	3	333.501	3.277	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C(F)F)c(F)c2)C[C@H]1C	ZINC000947720077	1333240261	/nfs/dbraw/zinc/24/02/61/1333240261.db2.gz	XKXHTORKWDUWMD-OCCSQVGLSA-N	0	3	338.373	3.369	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2cccc3sccc32)C[C@H]1C	ZINC000947780213	1333259933	/nfs/dbraw/zinc/25/99/33/1333259933.db2.gz	XVOYKLHWTZLZMA-ZBFHGGJFSA-N	0	3	326.465	3.046	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2scnc2C(C)(C)C)C[C@@H]1C	ZINC000947792389	1333263283	/nfs/dbraw/zinc/26/32/83/1333263283.db2.gz	LTXSOMIKFXNETA-KBPBESRZSA-N	0	3	333.501	3.047	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2c[nH]c3cc(C)ccc23)C[C@@H]1C	ZINC000947800237	1333265499	/nfs/dbraw/zinc/26/54/99/1333265499.db2.gz	GYIDYGCIZLDMLY-WMZOPIPTSA-N	0	3	337.467	3.011	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc(COC(C)C)cc2)C[C@H]1C	ZINC000948015635	1333342593	/nfs/dbraw/zinc/34/25/93/1333342593.db2.gz	GBJVOZAELSPASM-APWZRJJASA-N	0	3	330.472	3.380	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2sc(CCC)nc2C)C[C@H]1C	ZINC000948036077	1333348801	/nfs/dbraw/zinc/34/88/01/1333348801.db2.gz	NMWLSFAHWHXRPB-HIFRSBDPSA-N	0	3	333.501	3.010	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3cc(C)cc(C)c3)CC2)C[C@@H]1C	ZINC000948044379	1333352226	/nfs/dbraw/zinc/35/22/26/1333352226.db2.gz	QKGXNQQGGRJWIJ-AZUAARDMSA-N	0	3	338.495	3.327	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3cccc(F)c3o2)C[C@H]1C	ZINC000948064436	1333360937	/nfs/dbraw/zinc/36/09/37/1333360937.db2.gz	CNWIMVNMIAHVBP-UKRRQHHQSA-N	0	3	328.387	3.178	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2c(C)oc3ccccc32)C[C@H]1C	ZINC000948104009	1333375276	/nfs/dbraw/zinc/37/52/76/1333375276.db2.gz	JCQGEUUMIKSYAA-WBVHZDCISA-N	0	3	338.451	3.276	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C(C)(F)F)cc2)C[C@H]1C	ZINC000948105916	1333376242	/nfs/dbraw/zinc/37/62/42/1333376242.db2.gz	ZELHRCLYKIDNAM-PBHICJAKSA-N	0	3	334.410	3.404	20	30		EGEDHN
C[C@H](C(=O)N(C)[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1)C1CC1	ZINC000948274342	1333456572	/nfs/dbraw/zinc/45/65/72/1333456572.db2.gz	TVXAEMYYDLWNCV-OXJNMPFZSA-N	0	3	339.483	3.417	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)C[C@@H]2CCC(F)(F)C2)CC1	ZINC000948424079	1333520157	/nfs/dbraw/zinc/52/01/57/1333520157.db2.gz	GFZWUSNUFMDZGO-HOTGVXAUSA-N	0	3	326.431	3.148	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2oc(C(F)F)cc2C)CC1	ZINC000948451833	1333531218	/nfs/dbraw/zinc/53/12/18/1333531218.db2.gz	FMYDGQRHNVZGPV-CQSZACIVSA-N	0	3	338.398	3.475	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cc(C)n([C@@H](C)CC)n2)CC1	ZINC000948570234	1333580282	/nfs/dbraw/zinc/58/02/82/1333580282.db2.gz	ITAOLTKUCUQJCW-WMZOPIPTSA-N	0	3	344.503	3.112	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)Cc2cccc(C(C)C)c2)CC1	ZINC000948587276	1333586327	/nfs/dbraw/zinc/58/63/27/1333586327.db2.gz	VRUYJHDHRYMVPD-FQEVSTJZSA-N	0	3	326.484	3.299	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)Cc2cc3ccccc3s2)CC1	ZINC000948612514	1333596684	/nfs/dbraw/zinc/59/66/84/1333596684.db2.gz	ORZGHBWVEKDNIC-KRWDZBQOSA-N	0	3	340.492	3.390	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2ccn(C(C)C)c2C)CC1	ZINC000948705990	1333641274	/nfs/dbraw/zinc/64/12/74/1333641274.db2.gz	RJVXKOSMBPCDQF-SFHVURJKSA-N	0	3	329.488	3.327	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2cc3cccc(OC)c3o2)CC1	ZINC000948729461	1333650267	/nfs/dbraw/zinc/65/02/67/1333650267.db2.gz	KMQWOTNWYIVSOW-MRXNPFEDSA-N	0	3	340.423	3.001	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cc3occc3s2)CC1	ZINC000948766135	1333668797	/nfs/dbraw/zinc/66/87/97/1333668797.db2.gz	GUSKEKLRUQVWBZ-CQSZACIVSA-N	0	3	330.453	3.444	20	30		EGEDHN
N#Cc1ccc(C(=O)NC[C@H]2c3ccccc3CCN2CC2CCC2)[nH]1	ZINC000948909955	1333729507	/nfs/dbraw/zinc/72/95/07/1333729507.db2.gz	FJRXWCZQOGPIHH-FQEVSTJZSA-N	0	3	348.450	3.016	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)/C=C(\C)C3CC3)CC2)C1	ZINC000949310758	1333821272	/nfs/dbraw/zinc/82/12/72/1333821272.db2.gz	BWMHNMHQJWUPPV-SAPNQHFASA-N	0	3	332.488	3.002	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)c3c(C)coc3C)CC2)C1	ZINC000949355380	1333829963	/nfs/dbraw/zinc/82/99/63/1333829963.db2.gz	NZFHRIQBKRHONS-UHFFFAOYSA-N	0	3	346.471	3.170	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@@H]3CCCC4(CC4)C3)CC2)C1	ZINC000949366177	1333831576	/nfs/dbraw/zinc/83/15/76/1333831576.db2.gz	XFVWRHRIVBDBCE-GOSISDBHSA-N	0	3	346.515	3.226	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@]3(C)CC=CCC3)CC2)C1	ZINC000949376152	1333833718	/nfs/dbraw/zinc/83/37/18/1333833718.db2.gz	URLMUPLDYUVHPP-LJQANCHMSA-N	0	3	332.488	3.002	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C[C@@H]3CC[C@H](C)C3)CC2)C1	ZINC000949444701	1333848570	/nfs/dbraw/zinc/84/85/70/1333848570.db2.gz	KZVXZPFJEHJPTF-ZWKOTPCHSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@H](C)c3cccs3)CC2)C1	ZINC000949470994	1333857343	/nfs/dbraw/zinc/85/73/43/1333857343.db2.gz	NHLHHRAGNDTFGN-MRXNPFEDSA-N	0	3	348.512	3.121	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@H](C)c3ccco3)CC2)C1	ZINC000949470547	1333857467	/nfs/dbraw/zinc/85/74/67/1333857467.db2.gz	CVFKZWICANBKOJ-QGZVFWFLSA-N	0	3	346.471	3.043	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@@H](C)CC3CCCC3)CC2)C1	ZINC000949487347	1333859978	/nfs/dbraw/zinc/85/99/78/1333859978.db2.gz	QZSUGYNTOQTHAI-SFHVURJKSA-N	0	3	348.531	3.472	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2[nH]c3ccccc3c2Cl)C1	ZINC000967231587	1335677234	/nfs/dbraw/zinc/67/72/34/1335677234.db2.gz	QPAUMCFDQNMRJJ-CJNGLKHVSA-N	0	3	343.858	3.285	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2ccc(-n3cccc3)cc2)C1	ZINC000967273994	1335683250	/nfs/dbraw/zinc/68/32/50/1335683250.db2.gz	ODLIADFCKBTISI-PXNSSMCTSA-N	0	3	337.467	3.494	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)Cn2c(C)cc3ccccc32)C1	ZINC000967275138	1335684513	/nfs/dbraw/zinc/68/45/13/1335684513.db2.gz	UTIIATWJWQOPLW-APWZRJJASA-N	0	3	339.483	3.352	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)Cn2c(C)cc3ccccc32)C1	ZINC000967275139	1335684768	/nfs/dbraw/zinc/68/47/68/1335684768.db2.gz	UTIIATWJWQOPLW-LPHOPBHVSA-N	0	3	339.483	3.352	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2occc2-c2ccccc2)C1	ZINC000967284819	1335688203	/nfs/dbraw/zinc/68/82/03/1335688203.db2.gz	OKXAGABBGFLFJU-LPHOPBHVSA-N	0	3	336.435	3.410	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)Cc2cccc3ncccc23)C1	ZINC000967290966	1335691722	/nfs/dbraw/zinc/69/17/22/1335691722.db2.gz	GJQMBFQHFMAKOJ-JXFKEZNVSA-N	0	3	337.467	3.180	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)Cc2ccc(C(F)F)cc2)C1	ZINC000967332339	1335703343	/nfs/dbraw/zinc/70/33/43/1335703343.db2.gz	DCRVAJYJCCKCEL-YOEHRIQHSA-N	0	3	334.410	3.017	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2noc3c2CC(C)(C)CC3)C1	ZINC000967424555	1335734525	/nfs/dbraw/zinc/73/45/25/1335734525.db2.gz	SDIVQQYDGLZQFE-GDBMZVCRSA-N	0	3	345.487	3.206	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2ccccc2OCC(C)C)C1	ZINC000968430495	1335927561	/nfs/dbraw/zinc/92/75/61/1335927561.db2.gz	CWMCNSKLMSUPQU-PKOBYXMFSA-N	0	3	342.483	3.185	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CN(CC3=CCCCC3)CC[C@@H]2C)nc1	ZINC000968549418	1335959667	/nfs/dbraw/zinc/95/96/67/1335959667.db2.gz	QNGKEAMKYILDCO-JXFKEZNVSA-N	0	3	337.467	3.004	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)Cc2cccc3ccccc32)C1	ZINC000968568545	1335962110	/nfs/dbraw/zinc/96/21/10/1335962110.db2.gz	ASDSZMSPSNEVBF-UTKZUKDTSA-N	0	3	334.463	3.232	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)Cc2c(F)cccc2Cl)C1	ZINC000968584140	1335973238	/nfs/dbraw/zinc/97/32/38/1335973238.db2.gz	STCKXAHOIRRKMO-SUMWQHHRSA-N	0	3	338.854	3.424	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2cc(C)nc3ccccc32)C1	ZINC000968609444	1335982154	/nfs/dbraw/zinc/98/21/54/1335982154.db2.gz	HHTFOSPDNAMSHN-YWZLYKJASA-N	0	3	335.451	3.007	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccc3[nH]c(C)c(C)c3c2)C1	ZINC000968634891	1335991482	/nfs/dbraw/zinc/99/14/82/1335991482.db2.gz	BMUCZZUKFMCQRM-XOBRGWDASA-N	0	3	337.467	3.248	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2cccc3oc(C)nc32)C1	ZINC000968688934	1336012735	/nfs/dbraw/zinc/01/27/35/1336012735.db2.gz	QJWBNLCVCYWDAH-XJKSGUPXSA-N	0	3	327.428	3.153	20	30		EGEDHN
Cc1cccc(C(=O)N2CC[C@@H](NCc3ccc(C#N)s3)C2)c1F	ZINC000968763208	1336043414	/nfs/dbraw/zinc/04/34/14/1336043414.db2.gz	QVFURRBAICQPFA-CYBMUJFWSA-N	0	3	343.427	3.072	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC000968791990	1336052599	/nfs/dbraw/zinc/05/25/99/1336052599.db2.gz	HOMWHRAXAMOQTL-MRXNPFEDSA-N	0	3	331.435	3.070	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1cccc(OCCC)c1	ZINC000968876941	1336075824	/nfs/dbraw/zinc/07/58/24/1336075824.db2.gz	LNUUZBPKVXEZER-LJQANCHMSA-N	0	3	342.483	3.473	20	30		EGEDHN
C#CCCN1CCCCC[C@@H]1CNC(=O)c1nc(C(C)(C)C)cs1	ZINC000968898689	1336084488	/nfs/dbraw/zinc/08/44/88/1336084488.db2.gz	HRQOCZVRAVRYSR-OAHLLOKOSA-N	0	3	347.528	3.438	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccc2c(c1)[C@H](C)CO2	ZINC000968998303	1336115037	/nfs/dbraw/zinc/11/50/37/1336115037.db2.gz	RMIICYHALIUOFM-NVXWUHKLSA-N	0	3	328.456	3.343	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1c(F)cc(OC)cc1F	ZINC000969042634	1336125316	/nfs/dbraw/zinc/12/53/16/1336125316.db2.gz	YCVQOFNQPCDNAK-ZDUSSCGKSA-N	0	3	338.398	3.134	20	30		EGEDHN
N#Cc1ccc(CN2CCCCC[C@@H]2CNC(=O)[C@H]2CC23CC3)cc1	ZINC000969049840	1336128112	/nfs/dbraw/zinc/12/81/12/1336128112.db2.gz	OOFANORVUXODAB-RTBURBONSA-N	0	3	337.467	3.219	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1n[nH]c2c1C[C@@H](C)CC2	ZINC000969093737	1336140219	/nfs/dbraw/zinc/14/02/19/1336140219.db2.gz	XGEQRDDXSSATJZ-HOTGVXAUSA-N	0	3	344.503	3.085	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1csc(Cl)n1	ZINC000969105876	1336145992	/nfs/dbraw/zinc/14/59/92/1336145992.db2.gz	PYVKVMFBGNUKCD-GFCCVEGCSA-N	0	3	327.881	3.347	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](NCc2ccccc2OC(C)C)C1	ZINC000969576569	1336225449	/nfs/dbraw/zinc/22/54/49/1336225449.db2.gz	KAQTVJACHKECOX-QGZVFWFLSA-N	0	3	330.472	3.377	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3ccccc3N(C)C)C2)CC1	ZINC000969830175	1336252060	/nfs/dbraw/zinc/25/20/60/1336252060.db2.gz	FTBCIKXCADWJKN-LJQANCHMSA-N	0	3	341.499	3.190	20	30		EGEDHN
CC1(C)CC[C@H](C(=O)N2CC[C@@H](NCc3ccc(C#N)c(F)c3)C2)C1	ZINC000969867254	1336254883	/nfs/dbraw/zinc/25/48/83/1336254883.db2.gz	LUSLSTVUADBPAC-DOTOQJQBSA-N	0	3	343.446	3.214	20	30		EGEDHN
Cc1cccc(C)c1C(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C1	ZINC000970062938	1336275197	/nfs/dbraw/zinc/27/51/97/1336275197.db2.gz	KUWLFYAJLVMYRL-OAHLLOKOSA-N	0	3	339.464	3.241	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cc3ccncc3s2)CC1	ZINC001005503982	1336363604	/nfs/dbraw/zinc/36/36/04/1336363604.db2.gz	PEMDUZQJGWCDJE-UHFFFAOYSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)[C@@H]2CCC[C@H](C(F)(F)F)C2)CC1	ZINC001005637980	1336386531	/nfs/dbraw/zinc/38/65/31/1336386531.db2.gz	JSCXHBQFPKLHNK-KGLIPLIRSA-N	0	3	332.410	3.464	20	30		EGEDHN
CN(C(=O)C1(C)CC=CC1)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001005941845	1336427046	/nfs/dbraw/zinc/42/70/46/1336427046.db2.gz	JVNZQAYAGXXEPC-UHFFFAOYSA-N	0	3	337.467	3.337	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2ccccc2OC2CCC2)CC1	ZINC001005970918	1336432430	/nfs/dbraw/zinc/43/24/30/1336432430.db2.gz	WETXZQPPDGBIKC-UHFFFAOYSA-N	0	3	328.456	3.340	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccc(C3CC3)nc2C)CC1	ZINC001006018895	1336437982	/nfs/dbraw/zinc/43/79/82/1336437982.db2.gz	KFYCPJUDVUFRLU-UHFFFAOYSA-N	0	3	327.472	3.380	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2noc3c2CCCCC3)CC1	ZINC001006071198	1336446677	/nfs/dbraw/zinc/44/66/77/1336446677.db2.gz	CGXZAYKHUNRELD-UHFFFAOYSA-N	0	3	331.460	3.056	20	30		EGEDHN
Cc1ccccc1[C@@H](C)N1CCC[C@H](NC(=O)c2cc(C#N)c[nH]2)C1	ZINC001007031663	1336629371	/nfs/dbraw/zinc/62/93/71/1336629371.db2.gz	XECBZXWUGBGXLL-WBVHZDCISA-N	0	3	336.439	3.150	20	30		EGEDHN
C#CCCN1CCC[C@H](NC(=O)c2ccc3c4c(cccc42)CC3)C1	ZINC001007866093	1336722209	/nfs/dbraw/zinc/72/22/09/1336722209.db2.gz	BOABPYDGAHMHKF-SFHVURJKSA-N	0	3	332.447	3.156	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCCN(C[C@@H]3CC(C)(C)CO3)C2)CC1	ZINC001008418656	1336847380	/nfs/dbraw/zinc/84/73/80/1336847380.db2.gz	PIOYQSBITVODLN-MSOLQXFVSA-N	0	3	334.504	3.129	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CCCN(Cc3c(C)cccc3C)C2)c1	ZINC001008470038	1336864651	/nfs/dbraw/zinc/86/46/51/1336864651.db2.gz	RVZSLTCDERQGRZ-FQEVSTJZSA-N	0	3	347.462	3.074	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)Cc2csc(C(C)(C)C)n2)C1	ZINC001008874770	1336935868	/nfs/dbraw/zinc/93/58/68/1336935868.db2.gz	JTLZINSBYYFGKN-AWEZNQCLSA-N	0	3	335.517	3.140	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)C[C@@H]2CCc3ccccc3C2)C1	ZINC001009325095	1337007004	/nfs/dbraw/zinc/00/70/04/1337007004.db2.gz	HTKABRHAKVGMSC-YLJYHZDGSA-N	0	3	326.484	3.338	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)Cc2ccc(OC(C)C)cc2)C1	ZINC001009604891	1337045107	/nfs/dbraw/zinc/04/51/07/1337045107.db2.gz	ULGRLZDPQVDYSO-GOSISDBHSA-N	0	3	330.472	3.173	20	30		EGEDHN
N#Cc1cc(C(=O)N[C@H]2CCN(Cc3ccc4ccccc4c3)C2)c[nH]1	ZINC001010694898	1337242209	/nfs/dbraw/zinc/24/22/09/1337242209.db2.gz	CEXKDMGJALMQLQ-IBGZPJMESA-N	0	3	344.418	3.044	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H]2CC23CCN(Cc2cccc(C#N)c2)CC3)o1	ZINC001016492779	1338624254	/nfs/dbraw/zinc/62/42/54/1338624254.db2.gz	YBNVYRIDBPCMQJ-IBGZPJMESA-N	0	3	349.434	3.244	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2ccc3c4c(cccc42)CC3)CC1	ZINC001016714406	1338699533	/nfs/dbraw/zinc/69/95/33/1338699533.db2.gz	ASDHNOHOQYMJBH-HXUWFJFHSA-N	0	3	344.458	3.156	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2)CC1	ZINC001016869961	1338753561	/nfs/dbraw/zinc/75/35/61/1338753561.db2.gz	NSAWAZZJKPSRKB-RCCFBDPRSA-N	0	3	342.870	3.047	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)Cc2c[nH]c3cc(C)ccc23)CC1	ZINC001016875165	1338755494	/nfs/dbraw/zinc/75/54/94/1338755494.db2.gz	JYUYNNFTZDBVPZ-HXUWFJFHSA-N	0	3	349.478	3.013	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(C3CC3)s2)CC1	ZINC001016931783	1338774045	/nfs/dbraw/zinc/77/40/45/1338774045.db2.gz	WESYFMCCDOYHCU-KRWDZBQOSA-N	0	3	328.481	3.233	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2csc3c2CC[C@H](C)C3)CC1	ZINC001016957040	1338783909	/nfs/dbraw/zinc/78/39/09/1338783909.db2.gz	WCDQCOSADYRLAL-KSSFIOAISA-N	0	3	342.508	3.090	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cc3c(cccc3C)o2)CC1	ZINC001016990444	1338795330	/nfs/dbraw/zinc/79/53/30/1338795330.db2.gz	MLLIZWXSMDCHFS-IBGZPJMESA-N	0	3	336.435	3.349	20	30		EGEDHN
CCCC(=O)N1CCC[C@H](CN(C)Cc2cc(C#N)ccc2OC)C1	ZINC001017023093	1338814477	/nfs/dbraw/zinc/81/44/77/1338814477.db2.gz	LSROHLJYJMVCQQ-QGZVFWFLSA-N	0	3	343.471	3.037	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC[C@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001017092656	1338861328	/nfs/dbraw/zinc/86/13/28/1338861328.db2.gz	IOLHBXOXDKTIHZ-PSGIOISBSA-N	0	3	331.485	3.256	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H](CN(C)Cc2ccc(F)cn2)C1	ZINC001017202289	1338947036	/nfs/dbraw/zinc/94/70/36/1338947036.db2.gz	RZHCKYBRBFBZMH-OXQOHEQNSA-N	0	3	347.478	3.493	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H](CN(C)Cc2cnoc2C)C1	ZINC001017202469	1338948443	/nfs/dbraw/zinc/94/84/43/1338948443.db2.gz	XSEXQTOSMYCNBD-APWZRJJASA-N	0	3	333.476	3.256	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccc(C(F)F)c1	ZINC001017730619	1339406241	/nfs/dbraw/zinc/40/62/41/1339406241.db2.gz	QOZYTWXCIWVATD-CALCHBBNSA-N	0	3	334.410	3.418	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1Cc2ccc(Cl)cc21	ZINC001018227937	1339540712	/nfs/dbraw/zinc/54/07/12/1339540712.db2.gz	QGYUOMYPPLKZQA-JZXOWHBKSA-N	0	3	330.859	3.231	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)CCc1cc(F)ccc1F	ZINC001018303377	1339569443	/nfs/dbraw/zinc/56/94/43/1339569443.db2.gz	NMNAOXISYUTOMD-CALCHBBNSA-N	0	3	334.410	3.149	20	30		EGEDHN
Cc1ccsc1C(=O)N1CC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001018426049	1339612483	/nfs/dbraw/zinc/61/24/83/1339612483.db2.gz	RFRIBXWNCJXFNU-HNNXBMFYSA-N	0	3	343.427	3.072	20	30		EGEDHN
N#Cc1cc(CN[C@H]2CCN(C(=O)C(F)=C3CCCC3)C2)ccc1F	ZINC001018711885	1339708379	/nfs/dbraw/zinc/70/83/79/1339708379.db2.gz	LMIUCBLPGUWYAI-INIZCTEOSA-N	0	3	345.393	3.185	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CCCN2CCOc2ccccc2)CC1	ZINC001028117692	1340438421	/nfs/dbraw/zinc/43/84/21/1340438421.db2.gz	RYVVAUSHMZCREI-LJQANCHMSA-N	0	3	342.483	3.392	20	30		EGEDHN
C=CCCN1CCC[C@@H]1CNC(=O)c1cnc(-c2ccoc2)s1	ZINC001028186348	1340474105	/nfs/dbraw/zinc/47/41/05/1340474105.db2.gz	IYNJYHIVLCTZPG-CQSZACIVSA-N	0	3	331.441	3.173	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCCN2Cc2ccccc2CC)nc1	ZINC001028269444	1340523513	/nfs/dbraw/zinc/52/35/13/1340523513.db2.gz	MRRHBUFAECBDAR-HXUWFJFHSA-N	0	3	347.462	3.020	20	30		EGEDHN
C#CCCN1CCC[C@@H]1CNC(=O)c1cc2c(s1)CC[C@@H](C)C2	ZINC001028306150	1340555018	/nfs/dbraw/zinc/55/50/18/1340555018.db2.gz	DJBDBQMFNOBFMO-GDBMZVCRSA-N	0	3	330.497	3.090	20	30		EGEDHN
Cc1ccsc1C(=O)NC[C@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC001028369669	1340597363	/nfs/dbraw/zinc/59/73/63/1340597363.db2.gz	QSYMIWJIIHTAGS-QGZVFWFLSA-N	0	3	339.464	3.180	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](CNC(=O)[C@H]3CCCC34CC4)C2)cc1	ZINC001028628664	1340734101	/nfs/dbraw/zinc/73/41/01/1340734101.db2.gz	XNIZEOWIBBTJIY-RBUKOAKNSA-N	0	3	337.467	3.077	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H](CNC(=O)C34CCC(CC3)C4)C2)c1	ZINC001028631591	1340734838	/nfs/dbraw/zinc/73/48/38/1340734838.db2.gz	LRRXAOHWOVXENX-BSLVTKGXSA-N	0	3	337.467	3.077	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H](CNC(=O)C3CC4(CCC4)C3)C2)c1	ZINC001028747062	1340787410	/nfs/dbraw/zinc/78/74/10/1340787410.db2.gz	WNDCBTLJLQSLJD-GOSISDBHSA-N	0	3	337.467	3.077	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CCN(Cc3c(C)nsc3C)C2)CC1	ZINC001028780523	1340813027	/nfs/dbraw/zinc/81/30/27/1340813027.db2.gz	KKHXCUAXRKRMAI-INIZCTEOSA-N	0	3	347.528	3.444	20	30		EGEDHN
C#CCN1CC[C@@H](CNC(=O)[C@@H]2C[C@H]2c2cccc3ccccc32)C1	ZINC001028874002	1340874019	/nfs/dbraw/zinc/87/40/19/1340874019.db2.gz	NVLKHFKCDHMZRL-ORYQWCPZSA-N	0	3	332.447	3.015	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](CNC(=O)[C@@H]3CC34CCCC4)C2)cc1	ZINC001028909303	1340881392	/nfs/dbraw/zinc/88/13/92/1340881392.db2.gz	JAXRYOCMPHYXMP-OALUTQOASA-N	0	3	337.467	3.077	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)c2ccc(Cl)c(CCC)c2)C1	ZINC001028928957	1340885843	/nfs/dbraw/zinc/88/58/43/1340885843.db2.gz	USSQSTWHIXZFOE-OAHLLOKOSA-N	0	3	332.875	3.368	20	30		EGEDHN
Cc1cc(C)cc(C(=O)NC[C@H]2CCN(Cc3cccc(C#N)c3)C2)c1	ZINC001028953510	1340893112	/nfs/dbraw/zinc/89/31/12/1340893112.db2.gz	HQUFHNVQBCTFHE-HXUWFJFHSA-N	0	3	347.462	3.427	20	30		EGEDHN
C[C@@H](NCc1cc(F)ccc1C#N)C1CCN(C(=O)C(C)(C)F)CC1	ZINC001029034842	1340913383	/nfs/dbraw/zinc/91/33/83/1340913383.db2.gz	IFKGJTBDEYSBQR-CYBMUJFWSA-N	0	3	349.425	3.162	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)C1CCN(C(=O)[C@H]2CC23CC3)CC1	ZINC001029151277	1340943514	/nfs/dbraw/zinc/94/35/14/1340943514.db2.gz	ZTPXMCVJSUHNFR-HNAYVOBHSA-N	0	3	337.467	3.075	20	30		EGEDHN
C[C@H](C#N)C(=O)N1C[C@H]2CC[C@@H](C1)N2[C@H]1CCc2c1cccc2Cl	ZINC001029244624	1340960690	/nfs/dbraw/zinc/96/06/90/1340960690.db2.gz	JVBVTBQYXLKORY-ZXTQRBJTSA-N	0	3	343.858	3.162	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CC[C@@H](C1)N2CCC1CCOCC1	ZINC001029454206	1340993610	/nfs/dbraw/zinc/99/36/10/1340993610.db2.gz	VJGGHHZNBIUZOK-WSTZPKSXSA-N	0	3	334.504	3.081	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCN(C(=O)c2cccs2)C1	ZINC001029634192	1341027982	/nfs/dbraw/zinc/02/79/82/1341027982.db2.gz	OMIQTZNFBKEZFO-CYBMUJFWSA-N	0	3	345.493	3.275	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCN(C(=O)c2cccs2)C1	ZINC001029634193	1341028102	/nfs/dbraw/zinc/02/81/02/1341028102.db2.gz	OMIQTZNFBKEZFO-ZDUSSCGKSA-N	0	3	345.493	3.275	20	30		EGEDHN
CN(Cc1ccccc1Cl)C[C@H]1CCN(C(=O)C#CC2CC2)C1	ZINC001029733378	1341057506	/nfs/dbraw/zinc/05/75/06/1341057506.db2.gz	INBZSQKDHMTVBQ-MRXNPFEDSA-N	0	3	330.859	3.034	20	30		EGEDHN
CN(Cc1ccccc1Cl)C[C@@H]1CCN(C(=O)C#CC2CC2)C1	ZINC001029733377	1341057635	/nfs/dbraw/zinc/05/76/35/1341057635.db2.gz	INBZSQKDHMTVBQ-INIZCTEOSA-N	0	3	330.859	3.034	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc3c(cc(C)cc3C)[nH]2)CC[C@@H]1C	ZINC001071712981	1354871467	/nfs/dbraw/zinc/87/14/67/1354871467.db2.gz	WZTWYAOSOQMRFF-IRXDYDNUSA-N	0	3	337.467	3.391	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](CN(C)Cc2cc(F)cc(F)c2)C1	ZINC001029801055	1341076896	/nfs/dbraw/zinc/07/68/96/1341076896.db2.gz	FXVJTQHCNHKOAW-AWEZNQCLSA-N	0	3	336.426	3.457	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](CN(C)Cc2ncccc2C)C1	ZINC001029826475	1341087587	/nfs/dbraw/zinc/08/75/87/1341087587.db2.gz	QYFBOSVXYNDTFY-FXAWDEMLSA-N	0	3	329.488	3.273	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](CN(C)Cc3ccccn3)C2)CC1	ZINC001029826717	1341087622	/nfs/dbraw/zinc/08/76/22/1341087622.db2.gz	USFXSEAKKPMQMM-KRWDZBQOSA-N	0	3	327.472	3.108	20	30		EGEDHN
C#CCCN1CCC[C@H](N(Cc2ccccc2)C(=O)c2cc[nH]c2C)C1	ZINC001029916832	1341116921	/nfs/dbraw/zinc/11/69/21/1341116921.db2.gz	DNPHERLVKXHNRB-FQEVSTJZSA-N	0	3	349.478	3.453	20	30		EGEDHN
C#CCCN1CCC[C@H](N(Cc2ccccc2)C(=O)c2ccc[nH]2)C1	ZINC001029918164	1341118268	/nfs/dbraw/zinc/11/82/68/1341118268.db2.gz	YJLDVCAGHDHNJM-IBGZPJMESA-N	0	3	335.451	3.145	20	30		EGEDHN
CCN1CCC[C@H](N(Cc2ccccc2)C(=O)c2ccc(C#N)[nH]2)C1	ZINC001029918303	1341118363	/nfs/dbraw/zinc/11/83/63/1341118363.db2.gz	BDVHTMRGCXKGSZ-SFHVURJKSA-N	0	3	336.439	3.013	20	30		EGEDHN
C#CCCN1CCC[C@H](N(Cc2ccccc2)C(=O)[C@@H]2CC2(F)F)C1	ZINC001029919999	1341119384	/nfs/dbraw/zinc/11/93/84/1341119384.db2.gz	LWUAJKSRNWEHQX-ROUUACIJSA-N	0	3	346.421	3.158	20	30		EGEDHN
CN(Cc1cc(C#N)ccc1F)CC1CCN(C(=O)C(C)(C)F)CC1	ZINC001029925412	1341121940	/nfs/dbraw/zinc/12/19/40/1341121940.db2.gz	UBXRVSDVXRUZJP-UHFFFAOYSA-N	0	3	349.425	3.116	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)CC1CCN(C(=O)c2ccoc2)CC1	ZINC001029934786	1341127431	/nfs/dbraw/zinc/12/74/31/1341127431.db2.gz	AWMNCISXXQOQHS-UHFFFAOYSA-N	0	3	343.452	3.197	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)CC1CCN(C(=O)C=C2CCC2)CC1	ZINC001029955724	1341134542	/nfs/dbraw/zinc/13/45/42/1341134542.db2.gz	RPLODVFWQJCSAL-UHFFFAOYSA-N	0	3	343.496	3.400	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC(CN(C)Cc3ocnc3C)CC2)CC1	ZINC001029989730	1341148000	/nfs/dbraw/zinc/14/80/00/1341148000.db2.gz	AFJOXEULFOFQBH-UHFFFAOYSA-N	0	3	345.487	3.400	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](C)[C@H](CNCc2csc(CC)n2)C1	ZINC001072336887	1355245166	/nfs/dbraw/zinc/24/51/66/1355245166.db2.gz	VCUNPUPFUHAYLB-LSDHHAIUSA-N	0	3	349.544	3.492	20	30		EGEDHN
C#Cc1ccc(C(=O)NCC2CN(Cc3ccc(C)cc3C)C2)cc1	ZINC001031891938	1341417613	/nfs/dbraw/zinc/41/76/13/1341417613.db2.gz	FPFRBSWSQLWOBG-UHFFFAOYSA-N	0	3	332.447	3.147	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1cc2ccccc2s1	ZINC001032516425	1341528996	/nfs/dbraw/zinc/52/89/96/1341528996.db2.gz	XFZRFGKIHOPMHS-HOTGVXAUSA-N	0	3	326.465	3.305	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C1(c2cccnc2)CCCC1	ZINC001032593067	1341550727	/nfs/dbraw/zinc/55/07/27/1341550727.db2.gz	ZJPDGUMNILNKSI-OALUTQOASA-N	0	3	339.483	3.145	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1c(C)cc(C)cc1C	ZINC001032602689	1341554875	/nfs/dbraw/zinc/55/48/75/1341554875.db2.gz	WSDWQPXGCIHYLB-OALUTQOASA-N	0	3	326.484	3.406	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(OCC)c(C)c1	ZINC001032658608	1341573273	/nfs/dbraw/zinc/57/32/73/1341573273.db2.gz	ZUIGNFXAXLJTHG-ROUUACIJSA-N	0	3	328.456	3.259	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1c[nH]c2cccc(C)c12	ZINC001032738751	1341596353	/nfs/dbraw/zinc/59/63/53/1341596353.db2.gz	JGULSEWITHIIJO-ROUUACIJSA-N	0	3	337.467	3.270	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2coc3ccc(OC)cc23)C1	ZINC001033254236	1341759804	/nfs/dbraw/zinc/75/98/04/1341759804.db2.gz	BBVNWMQQLRMUDG-AWEZNQCLSA-N	0	3	328.412	3.164	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2sccc2-n2cccc2)C1	ZINC001033307840	1341775440	/nfs/dbraw/zinc/77/54/40/1341775440.db2.gz	DXZNYHVRWSNXFC-OAHLLOKOSA-N	0	3	329.469	3.261	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@@H]2CCN(Cc3ccc(C)cc3)C2)cc1	ZINC001033323727	1341781056	/nfs/dbraw/zinc/78/10/56/1341781056.db2.gz	XGFSXGJILDGKDW-OAQYLSRUSA-N	0	3	332.447	3.323	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)C[C@@H]2CCOc3ccccc32)C1	ZINC001033335016	1341785955	/nfs/dbraw/zinc/78/59/55/1341785955.db2.gz	ZAMUZOSPZXVMCG-IRXDYDNUSA-N	0	3	328.456	3.052	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)Cc2c[nH]c3cc(C)ccc23)C1	ZINC001033494467	1341846361	/nfs/dbraw/zinc/84/63/61/1341846361.db2.gz	LFCAZNUCYRZUGD-QGZVFWFLSA-N	0	3	325.456	3.128	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@@H]2CCN(Cc3ccc(C)c(C)c3)C2)nc1	ZINC001033596260	1341889846	/nfs/dbraw/zinc/88/98/46/1341889846.db2.gz	JHQFYMWSPRAVAO-HXUWFJFHSA-N	0	3	347.462	3.026	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2cscc2C(F)F)C1	ZINC001033830819	1342031315	/nfs/dbraw/zinc/03/13/15/1342031315.db2.gz	PCWUMJNSEOEWPL-LBPRGKRZSA-N	0	3	326.412	3.245	20	30		EGEDHN
C=C(C)CCN1CC[C@H](N(CC)C(=O)c2sc3nccn3c2C)C1	ZINC001033861324	1342049316	/nfs/dbraw/zinc/04/93/16/1342049316.db2.gz	GUEVXNYFKGYIEA-HNNXBMFYSA-N	0	3	346.500	3.207	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2cc(C)n(C(CC)CC)n2)C1	ZINC001033877421	1342055224	/nfs/dbraw/zinc/05/52/24/1342055224.db2.gz	FTDGYKCXXYZYLH-GOSISDBHSA-N	0	3	344.503	3.112	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2ccc(-n3cccc3)cc2)C1	ZINC001033888564	1342062202	/nfs/dbraw/zinc/06/22/02/1342062202.db2.gz	RWHMYUVQFRIFRO-HXUWFJFHSA-N	0	3	335.451	3.037	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cccc3c2O[C@H](C)C3)C1	ZINC001033898997	1342070087	/nfs/dbraw/zinc/07/00/87/1342070087.db2.gz	FGPJXKCDMOJZCT-WBVHZDCISA-N	0	3	328.456	3.123	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@@H]2CCc3ccc(F)cc3O2)C1	ZINC001033901915	1342075030	/nfs/dbraw/zinc/07/50/30/1342075030.db2.gz	SSBWSDVGSIJUGX-ROUUACIJSA-N	0	3	346.446	3.018	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@@H]2CCc3cc(F)ccc32)C1	ZINC001033902531	1342076342	/nfs/dbraw/zinc/07/63/42/1342076342.db2.gz	KFNNHADFNPHLDJ-PKOBYXMFSA-N	0	3	330.447	3.354	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@@H]2CCCc3cccnc32)C1	ZINC001033932060	1342095659	/nfs/dbraw/zinc/09/56/59/1342095659.db2.gz	GDMYYCOPCVWHSB-QZTJIDSGSA-N	0	3	327.472	3.000	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccc(C(C)C)[nH]c2=O)C1	ZINC001033981778	1342128539	/nfs/dbraw/zinc/12/85/39/1342128539.db2.gz	XIJFRXOAXARKBN-HNNXBMFYSA-N	0	3	331.460	3.023	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccc4nccc(C)c4c3)[C@@H]2C1	ZINC001075833548	1356431169	/nfs/dbraw/zinc/43/11/69/1356431169.db2.gz	YVFMIDBZRZSVCY-FXAWDEMLSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cncc(C(F)(F)F)c2)C1	ZINC001034008104	1342145247	/nfs/dbraw/zinc/14/52/47/1342145247.db2.gz	ZERJNJMRCRFLBN-OAHLLOKOSA-N	0	3	341.377	3.213	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@@H]2Cc3cc(C)c(C)cc3O2)C1	ZINC001034047769	1342187155	/nfs/dbraw/zinc/18/71/55/1342187155.db2.gz	KHXKKQMKTWNSMJ-ICSRJNTNSA-N	0	3	342.483	3.106	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2ccc(N(C)CCC)cc2)C1	ZINC001034057063	1342197993	/nfs/dbraw/zinc/19/79/93/1342197993.db2.gz	RGPSOUCRHRXCAS-FQEVSTJZSA-N	0	3	341.499	3.093	20	30		EGEDHN
C=CCCN1C[C@@H]2CCN(C(=O)c3cc4cccnc4s3)[C@@H]2C1	ZINC001076426213	1356575086	/nfs/dbraw/zinc/57/50/86/1356575086.db2.gz	RXPXYAAZCPPIPR-LSDHHAIUSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)C2(c3ccc(F)cc3)CC2)C1	ZINC001034230311	1342335327	/nfs/dbraw/zinc/33/53/27/1342335327.db2.gz	CIPJAFQDKWRRGG-GOSISDBHSA-N	0	3	330.447	3.404	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2c(C)c(F)ccc2Cl)C1	ZINC001034278465	1342369198	/nfs/dbraw/zinc/36/91/98/1342369198.db2.gz	JOTQLYUWQLXFJI-AWEZNQCLSA-N	0	3	336.838	3.395	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2c(C)occ2C(F)(F)F)C1	ZINC001034313973	1342394147	/nfs/dbraw/zinc/39/41/47/1342394147.db2.gz	FYUUVGXIVZQRQE-ZDUSSCGKSA-N	0	3	342.361	3.214	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cccc(-n3cccn3)c2)C1	ZINC001034449502	1342509726	/nfs/dbraw/zinc/50/97/26/1342509726.db2.gz	VEXZFKYFJLKSIJ-GOSISDBHSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)Cc2ccccc2OC(C)C)C1	ZINC001034454164	1342512800	/nfs/dbraw/zinc/51/28/00/1342512800.db2.gz	ZXYRLHHEFMGCNL-GOSISDBHSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ncccc2C(F)(F)F)C1	ZINC001034471104	1342526017	/nfs/dbraw/zinc/52/60/17/1342526017.db2.gz	DNAKGXIFQUSCFF-CYBMUJFWSA-N	0	3	341.377	3.261	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc(OC(C)C)cn2)C1	ZINC001034560096	1342618855	/nfs/dbraw/zinc/61/88/55/1342618855.db2.gz	UJNHQIVFAIGNAE-MRXNPFEDSA-N	0	3	331.460	3.029	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1CC[C@H](NC(=O)C2CC(F)(F)C2)CC1	ZINC001034621932	1342655554	/nfs/dbraw/zinc/65/55/54/1342655554.db2.gz	ZSCBYXNPQLNZEX-QAQDUYKDSA-N	0	3	347.409	3.121	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N[C@H]1CC[C@H](NCc2ccccc2C#N)CC1	ZINC001034627333	1342659864	/nfs/dbraw/zinc/65/98/64/1342659864.db2.gz	QUEXRITYYZTXHN-BZSNNMDCSA-N	0	3	325.456	3.121	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)[C@@H]2C[C@H]2CCC)CC1	ZINC001034729766	1342724784	/nfs/dbraw/zinc/72/47/84/1342724784.db2.gz	PEURVJDRMXIEEJ-KBUPBQIOSA-N	0	3	343.309	3.348	20	30		EGEDHN
CC(C)[C@@H]1C[C@@H]1C(=O)N[C@H]1CC[C@H](NCc2ccccc2C#N)CC1	ZINC001034771772	1342751021	/nfs/dbraw/zinc/75/10/21/1342751021.db2.gz	STAXEBQWWUDGCX-MUGJNUQGSA-N	0	3	339.483	3.367	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2ccc(OCC)cc2)C12CCC2	ZINC001078799084	1357090837	/nfs/dbraw/zinc/09/08/37/1357090837.db2.gz	VVJFOGDLIGILGF-SJORKVTESA-N	0	3	348.874	3.468	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)Cc2cccc(F)c2)C12CCC2	ZINC001078799565	1357091288	/nfs/dbraw/zinc/09/12/88/1357091288.db2.gz	CWJOLDRWBVSSIR-CVEARBPZSA-N	0	3	336.838	3.138	20	30		EGEDHN
CC1(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)cc2F)CCCC1	ZINC001035006266	1342872667	/nfs/dbraw/zinc/87/26/67/1342872667.db2.gz	PGLIYGMUEOQIEW-QGZVFWFLSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]1CNCc1c(C)noc1CC	ZINC001035010682	1342874339	/nfs/dbraw/zinc/87/43/39/1342874339.db2.gz	GIBXNRZUPHFIRQ-OAHLLOKOSA-N	0	3	333.476	3.228	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]1CNCc1cccc(OCC)n1	ZINC001035011569	1342874782	/nfs/dbraw/zinc/87/47/82/1342874782.db2.gz	FPXHODDJHYJBJA-QGZVFWFLSA-N	0	3	345.487	3.163	20	30		EGEDHN
CC(=O)N1CCC2(CCN(CC#Cc3cccc(Cl)c3)C2)CC1	ZINC001035146293	1342958189	/nfs/dbraw/zinc/95/81/89/1342958189.db2.gz	ZSKCTBJBYKQFSE-UHFFFAOYSA-N	0	3	330.859	3.026	20	30		EGEDHN
O=C(c1ccoc1)N1CCC2(CCN(CC#Cc3ccccc3)C2)CC1	ZINC001035159155	1342975971	/nfs/dbraw/zinc/97/59/71/1342975971.db2.gz	WNMWXEYKHXGLDA-UHFFFAOYSA-N	0	3	348.446	3.259	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC2(CCN(Cc3cnc(C)o3)C2)CC1	ZINC001035213201	1343031621	/nfs/dbraw/zinc/03/16/21/1343031621.db2.gz	GLMNIIWFSIDCLS-UHFFFAOYSA-N	0	3	345.487	3.400	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C[C@H]1CCC[C@H](OC)C1)CC2	ZINC001035722759	1343152904	/nfs/dbraw/zinc/15/29/04/1343152904.db2.gz	OCIQDTOGCADKIQ-ROUUACIJSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C1(C(F)(F)F)CCC1)CC2	ZINC001035736148	1343160973	/nfs/dbraw/zinc/16/09/73/1343160973.db2.gz	WVDFGTNUCVNZAM-UHFFFAOYSA-N	0	3	330.394	3.220	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc(C)n(CC)c1C)CC2	ZINC001035744658	1343165261	/nfs/dbraw/zinc/16/52/61/1343165261.db2.gz	OZSIPKPPWXOHRY-UHFFFAOYSA-N	0	3	329.488	3.239	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)CCc1cccc(OC)c1)CC2	ZINC001035751114	1343169547	/nfs/dbraw/zinc/16/95/47/1343169547.db2.gz	ZIHBOWVGNNGWFY-UHFFFAOYSA-N	0	3	342.483	3.128	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)CCc1cccc(C)c1)CC2	ZINC001035758607	1343173535	/nfs/dbraw/zinc/17/35/35/1343173535.db2.gz	GLGNPMYLPQIWOQ-UHFFFAOYSA-N	0	3	326.484	3.428	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccccc1OCC)CC2	ZINC001035844967	1343225950	/nfs/dbraw/zinc/22/59/50/1343225950.db2.gz	WNPCJXLJPGOBRA-UHFFFAOYSA-N	0	3	328.456	3.199	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CCCC2)CC[C@@H]1NCc1ccccc1C#N	ZINC001035881324	1343246000	/nfs/dbraw/zinc/24/60/00/1343246000.db2.gz	VWBSPARTDVKXKA-BEFAXECRSA-N	0	3	325.456	3.075	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@@H](NCc3ccccc3C#N)[C@@H](C)C2)o1	ZINC001035897023	1343257009	/nfs/dbraw/zinc/25/70/09/1343257009.db2.gz	OKNSJVAXSFGBMG-KBXCAEBGSA-N	0	3	337.423	3.100	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](NCc3csc(C)n3)[C@@H](C)C2)C1	ZINC001036167070	1343340491	/nfs/dbraw/zinc/34/04/91/1343340491.db2.gz	CPVXYYROEXXERV-BBRMVZONSA-N	0	3	333.501	3.134	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@@H]([C@@H](C)NCc2ccccc2C#N)C1	ZINC001036339162	1343424715	/nfs/dbraw/zinc/42/47/15/1343424715.db2.gz	DOOKOMFZRXPLLI-VQIMIIECSA-N	0	3	325.456	3.241	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCCN(C(=O)c2ccoc2)C1	ZINC001036361509	1343442925	/nfs/dbraw/zinc/44/29/25/1343442925.db2.gz	JUBJJVAYOMUOBM-YJBOKZPZSA-N	0	3	337.423	3.182	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCCN(C(=O)C2(C)CC2)C1	ZINC001036408333	1343469150	/nfs/dbraw/zinc/46/91/50/1343469150.db2.gz	ILIJPMFCYHFJRG-QAPCUYQASA-N	0	3	325.456	3.075	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]([C@H](C)NCc2nccs2)C1	ZINC001036430366	1343482627	/nfs/dbraw/zinc/48/26/27/1343482627.db2.gz	AGEJBZNNVJFRAJ-LSDHHAIUSA-N	0	3	335.517	3.462	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)CC2CC2)[C@@H]1CNCc1ccc(C#N)s1	ZINC001036492107	1343514756	/nfs/dbraw/zinc/51/47/56/1343514756.db2.gz	BPZUFUVVXWRUCO-CXAGYDPISA-N	0	3	331.485	3.137	20	30		EGEDHN
CCCC(=O)N1CCC[C@H](C)[C@@H]1CNCc1cc(C#N)ccc1F	ZINC001036492096	1343514859	/nfs/dbraw/zinc/51/48/59/1343514859.db2.gz	BOENTANHGGZODK-KSSFIOAISA-N	0	3	331.435	3.214	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@@H](C)[C@H]1CNCc1cc(C#N)ccc1F	ZINC001036492257	1343515267	/nfs/dbraw/zinc/51/52/67/1343515267.db2.gz	JODVKMJQOJUTHC-DNVCBOLYSA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@H]1CCCN(C(=O)C2=CCCC2)[C@@H]1CNCc1ccc(C#N)s1	ZINC001036535579	1343542975	/nfs/dbraw/zinc/54/29/75/1343542975.db2.gz	XJJXSQXZTMKAFA-KBXCAEBGSA-N	0	3	343.496	3.447	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@H]2[C@@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001036632214	1343589666	/nfs/dbraw/zinc/58/96/66/1343589666.db2.gz	KAOKAGJXOYFOSY-YOEHRIQHSA-N	0	3	329.469	3.009	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@H]2CN(C(=O)CC3CCC3)CC[C@@H]21	ZINC001036678399	1343618577	/nfs/dbraw/zinc/61/85/77/1343618577.db2.gz	PXQUTVIDBSPAPY-PMACEKPBSA-N	0	3	337.467	3.171	20	30		EGEDHN
C/C=C(/C)C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccc(C#N)cc2F)C1	ZINC001036682869	1343625185	/nfs/dbraw/zinc/62/51/85/1343625185.db2.gz	KQTWFYKUEVDYCO-PKXYKUNZSA-N	0	3	341.430	3.086	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCC[C@H]1NC(=O)CC1CCC1	ZINC001036970613	1343900255	/nfs/dbraw/zinc/90/02/55/1343900255.db2.gz	PBZUOJUNGNLARY-RBUKOAKNSA-N	0	3	325.456	3.123	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@H]1CCCC[C@H]1NC(=O)C1CCC1	ZINC001037139173	1343989064	/nfs/dbraw/zinc/98/90/64/1343989064.db2.gz	MIODYIYHDRABJK-VQIMIIECSA-N	0	3	343.446	3.262	20	30		EGEDHN
CC[C@@H]1CN(C(=O)C(C)C)CC[C@@H]1NCc1cc(F)ccc1C#N	ZINC001037781915	1344092825	/nfs/dbraw/zinc/09/28/25/1344092825.db2.gz	AYJQRXSWCKTICA-KDOFPFPSSA-N	0	3	331.435	3.070	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1ocnc1-c1ccccc1	ZINC001038334284	1344384282	/nfs/dbraw/zinc/38/42/82/1344384282.db2.gz	YGNCPOGIDOBUFE-INIZCTEOSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1ccc(-c2cnco2)cc1	ZINC001038421175	1344421256	/nfs/dbraw/zinc/42/12/56/1344421256.db2.gz	YUALSMGRDZTUAH-QGZVFWFLSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)[C@H](C)SC)CC2)C1	ZINC001039109900	1344781408	/nfs/dbraw/zinc/78/14/08/1344781408.db2.gz	OWZBGWQCFQZYMY-DZGCQCFKSA-N	0	3	330.925	3.051	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)C3CC4(CC4)C3)CC2)C1	ZINC001039163611	1344848804	/nfs/dbraw/zinc/84/88/04/1344848804.db2.gz	DJJGIPJXZCNEFA-MRXNPFEDSA-N	0	3	336.907	3.490	20	30		EGEDHN
CCC(=O)N1CCCC[C@@H]1[C@@H]1CCN(Cc2ccc(F)c(C#N)c2)C1	ZINC001039181179	1344878659	/nfs/dbraw/zinc/87/86/59/1344878659.db2.gz	SBXACWIOMZNROY-VQIMIIECSA-N	0	3	343.446	3.310	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)C2C(C)(C)C2(C)C)C1	ZINC001039201537	1344911323	/nfs/dbraw/zinc/91/13/23/1344911323.db2.gz	ALTUQGZTPMINCK-IAGOWNOFSA-N	0	3	330.516	3.395	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc3c(o2)CCCC3)C1	ZINC001039209737	1344922405	/nfs/dbraw/zinc/92/24/05/1344922405.db2.gz	LDXMKPKFBRUDKG-QZTJIDSGSA-N	0	3	340.467	3.108	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc(C)cc(C)n2)C1	ZINC001039210484	1344924447	/nfs/dbraw/zinc/92/44/47/1344924447.db2.gz	AVVKMCUUVFRJSZ-ICSRJNTNSA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccc(Cl)cc2F)C1	ZINC001039216445	1344933386	/nfs/dbraw/zinc/93/33/86/1344933386.db2.gz	OXJXYPIFLOMVIN-KBXCAEBGSA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(C)c(F)c2)C1	ZINC001039216503	1344933480	/nfs/dbraw/zinc/93/34/80/1344933480.db2.gz	PQFYUIAQWYNHRP-UYAOXDASSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cccc3cccnc32)C1	ZINC001039217247	1344933826	/nfs/dbraw/zinc/93/38/26/1344933826.db2.gz	GOHZKFNXWVVPDC-AZUAARDMSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(CC)s2)C1	ZINC001039218080	1344935175	/nfs/dbraw/zinc/93/51/75/1344935175.db2.gz	KJEFVWLXRQDMSQ-RDJZCZTQSA-N	0	3	330.497	3.260	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc3cc(C)ccc3[nH]2)C1	ZINC001039224859	1344942757	/nfs/dbraw/zinc/94/27/57/1344942757.db2.gz	IZSMXCDWAAGUKD-UWJYYQICSA-N	0	3	349.478	3.426	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)Cc2ccccc2C)C1	ZINC001039241125	1344966022	/nfs/dbraw/zinc/96/60/22/1344966022.db2.gz	XSIHDNKJFHFHFW-RTWAWAEBSA-N	0	3	338.495	3.264	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)Cc2ccccc2C)C1	ZINC001039241127	1344966196	/nfs/dbraw/zinc/96/61/96/1344966196.db2.gz	XSIHDNKJFHFHFW-SFTDATJTSA-N	0	3	338.495	3.264	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)Cc2ccccc2C)C1	ZINC001039241123	1344966226	/nfs/dbraw/zinc/96/62/26/1344966226.db2.gz	XSIHDNKJFHFHFW-NHCUHLMSSA-N	0	3	338.495	3.264	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccc(F)cc2Cl)C1	ZINC001039241294	1344966422	/nfs/dbraw/zinc/96/64/22/1344966422.db2.gz	YXMGMXUTDOFOKG-KBXCAEBGSA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccc3[nH]ccc3c2)C1	ZINC001039247248	1344976920	/nfs/dbraw/zinc/97/69/20/1344976920.db2.gz	XBJSKRGYLMOFJT-ICSRJNTNSA-N	0	3	335.451	3.118	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(OCC)cc2)C1	ZINC001039249824	1344980617	/nfs/dbraw/zinc/98/06/17/1344980617.db2.gz	KDIZIYBTIYWZEY-ICSRJNTNSA-N	0	3	340.467	3.035	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(OC(C)C)nc1	ZINC001039382164	1345037158	/nfs/dbraw/zinc/03/71/58/1345037158.db2.gz	DACJELVDXQAARF-MSOLQXFVSA-N	0	3	343.471	3.124	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)CCc1ccc(OC)c(F)c1	ZINC001039404570	1345050052	/nfs/dbraw/zinc/05/00/52/1345050052.db2.gz	IDQAEQJWNSWORD-SJORKVTESA-N	0	3	346.446	3.018	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2c(c1)CCOC2	ZINC001039404419	1345050282	/nfs/dbraw/zinc/05/02/82/1345050282.db2.gz	ZQDVCIOSPMDATJ-UXHICEINSA-N	0	3	340.467	3.014	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1cc(F)c(C)cc1F	ZINC001039409931	1345053230	/nfs/dbraw/zinc/05/32/30/1345053230.db2.gz	NQEINKYVCUKEHM-CVEARBPZSA-N	0	3	334.410	3.067	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc(F)cc1Cl	ZINC001039429011	1345064019	/nfs/dbraw/zinc/06/40/19/1345064019.db2.gz	JEGSUXZKKRGANJ-CVEARBPZSA-N	0	3	336.838	3.273	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](c1cccnc1)C(C)C	ZINC001039455773	1345076774	/nfs/dbraw/zinc/07/67/74/1345076774.db2.gz	QKYCTQHHVHAMSP-AABGKKOBSA-N	0	3	341.499	3.463	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)COc1ccc(CC)cc1	ZINC001039465780	1345083561	/nfs/dbraw/zinc/08/35/61/1345083561.db2.gz	ZPCNNCRRPLEQSX-MOPGFXCFSA-N	0	3	342.483	3.269	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)Cc1ccccc1C	ZINC001039475780	1345090129	/nfs/dbraw/zinc/09/01/29/1345090129.db2.gz	JFOIHVOIZRNTMW-TYPHKJRUSA-N	0	3	338.495	3.262	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)CC1CCC(OC)CC1	ZINC001039478158	1345092448	/nfs/dbraw/zinc/09/24/48/1345092448.db2.gz	GIPIDNSZNPTDBN-IAFLDTSXSA-N	0	3	334.504	3.223	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C1(c2ccccc2C)CC1	ZINC001039478863	1345092955	/nfs/dbraw/zinc/09/29/55/1345092955.db2.gz	UMCSAYSMWIDSTN-MOPGFXCFSA-N	0	3	336.479	3.115	20	30		EGEDHN
CC(F)(F)C(=O)N1CC[C@]2(C1)CCCN(Cc1cccc(C#N)c1)C2	ZINC001040037002	1345301842	/nfs/dbraw/zinc/30/18/42/1345301842.db2.gz	MZYQZFVOEONTEK-LJQANCHMSA-N	0	3	347.409	3.028	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@@]2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001040047679	1345309930	/nfs/dbraw/zinc/30/99/30/1345309930.db2.gz	VVEBYMATIXXNFU-NRFANRHFSA-N	0	3	339.483	3.419	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)Cc3ccc(C(F)F)cc3)C2)C1	ZINC001040291364	1345415044	/nfs/dbraw/zinc/41/50/44/1345415044.db2.gz	MJPBXDCHADAFLY-HXUWFJFHSA-N	0	3	346.421	3.114	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ccoc3C3CC3)C2)C1	ZINC001040354104	1345449723	/nfs/dbraw/zinc/44/97/23/1345449723.db2.gz	MXEFUOKFVBEPRM-FQEVSTJZSA-N	0	3	326.440	3.108	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ccc4[nH]ccc4c3)C2)C1	ZINC001040361895	1345455156	/nfs/dbraw/zinc/45/51/56/1345455156.db2.gz	XQNILENOQJYOSF-NRFANRHFSA-N	0	3	335.451	3.119	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@@H](C)c3cccs3)C2)C1	ZINC001040390192	1345471875	/nfs/dbraw/zinc/47/18/75/1345471875.db2.gz	HMBGPQFMWCYYQW-QFBILLFUSA-N	0	3	330.497	3.189	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ccc(C(C)C)cn3)C2)C1	ZINC001040393367	1345473897	/nfs/dbraw/zinc/47/38/97/1345473897.db2.gz	BAWQHAONRCCAIJ-NRFANRHFSA-N	0	3	339.483	3.156	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3csc(Cl)c3)C2)C1	ZINC001040433064	1345496323	/nfs/dbraw/zinc/49/63/23/1345496323.db2.gz	RXFCDSBXCLVPEC-QGZVFWFLSA-N	0	3	336.888	3.353	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3sc(CC)nc3C)C2)C1	ZINC001040446098	1345504359	/nfs/dbraw/zinc/50/43/59/1345504359.db2.gz	JFRQPLBGNWFFCC-GOSISDBHSA-N	0	3	333.501	3.128	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3cccn3C3CCCC3)C2)C1	ZINC001040464694	1345510464	/nfs/dbraw/zinc/51/04/64/1345510464.db2.gz	OXNJADUNPUSIFR-NRFANRHFSA-N	0	3	339.483	3.165	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3cccc4ccsc43)C2)C1	ZINC001040478933	1345513670	/nfs/dbraw/zinc/51/36/70/1345513670.db2.gz	MEXZCNNLIFHHHF-FQEVSTJZSA-N	0	3	338.476	3.463	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3ccc4ccccc4c3)C2)C1	ZINC001040506811	1345524663	/nfs/dbraw/zinc/52/46/63/1345524663.db2.gz	OISMZFBQFSVRGS-JOCHJYFZSA-N	0	3	332.447	3.401	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cc4c(s3)CCC4)C2)C1	ZINC001040521309	1345531027	/nfs/dbraw/zinc/53/10/27/1345531027.db2.gz	ZOKPPYDZDCWPFX-LJQANCHMSA-N	0	3	330.497	3.351	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)CCc3ccc(CC)cc3)C2)C1	ZINC001040523170	1345532304	/nfs/dbraw/zinc/53/23/04/1345532304.db2.gz	UYTLNDSGORPKJY-JOCHJYFZSA-N	0	3	338.495	3.129	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3c(Cl)cccc3OC)C2)C1	ZINC001040544645	1345539172	/nfs/dbraw/zinc/53/91/72/1345539172.db2.gz	YUGQKGRJAPUMDZ-LJQANCHMSA-N	0	3	348.874	3.463	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cnc(C(C)C)s3)C2)C1	ZINC001040555179	1345544949	/nfs/dbraw/zinc/54/49/49/1345544949.db2.gz	HIDJUUMWCBKXEO-LJQANCHMSA-N	0	3	345.512	3.218	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccc4nccc(C)c4c3)C2)CC1	ZINC001040716992	1345569785	/nfs/dbraw/zinc/56/97/85/1345569785.db2.gz	XOYYFOHUQOVTJP-UHFFFAOYSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@H]3CCC[C@H]3C(F)F)C2)CC1	ZINC001040730572	1345571713	/nfs/dbraw/zinc/57/17/13/1345571713.db2.gz	WOPZVGQADZOWMK-CVEARBPZSA-N	0	3	338.442	3.006	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCC2(C1)CCN(C/C=C\Cl)CC2	ZINC001040730125	1345571773	/nfs/dbraw/zinc/57/17/73/1345571773.db2.gz	QQSSCHUTDNKYRC-WTKPLQERSA-N	0	3	347.890	3.355	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cn(CC)c4ccccc34)C2)CC1	ZINC001040765452	1345576592	/nfs/dbraw/zinc/57/65/92/1345576592.db2.gz	KCBQBCHKZHKQCX-UHFFFAOYSA-N	0	3	349.478	3.223	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccn(C(C)C)c3C)C2)CC1	ZINC001040817034	1345582168	/nfs/dbraw/zinc/58/21/68/1345582168.db2.gz	KMBIVAQQUOBJJC-UHFFFAOYSA-N	0	3	341.499	3.329	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3nccc4ccccc43)C2)CC1	ZINC001040820199	1345582657	/nfs/dbraw/zinc/58/26/57/1345582657.db2.gz	QFNIVVFVNXYQPZ-UHFFFAOYSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@]3(C)CC[C@H](C)C3(C)C)C2)CC1	ZINC001040874915	1345592198	/nfs/dbraw/zinc/59/21/98/1345592198.db2.gz	MMHUMKDNGPMHOQ-PXNSSMCTSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@H](C)c3cc(C)oc3C)C2)CC1	ZINC001040882483	1345593486	/nfs/dbraw/zinc/59/34/86/1345593486.db2.gz	GJIHIKQEICTBEB-QGZVFWFLSA-N	0	3	342.483	3.338	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@]3(CCN(C(=O)C4CCCC4)C3)C2)c1	ZINC001040995116	1345617799	/nfs/dbraw/zinc/61/77/99/1345617799.db2.gz	SKOLULZRYYGKEX-NRFANRHFSA-N	0	3	337.467	3.173	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3c(C)c(F)ccc3Cl)C2)C1	ZINC001041418738	1345724187	/nfs/dbraw/zinc/72/41/87/1345724187.db2.gz	NKCFTSLEQNVXMH-IBGZPJMESA-N	0	3	348.849	3.349	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3sc4ccccc4c3C)C2)C1	ZINC001041452331	1345731720	/nfs/dbraw/zinc/73/17/20/1345731720.db2.gz	BTQZAQSJKBFECV-FQEVSTJZSA-N	0	3	338.476	3.381	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3cc4c(o3)c(F)ccc4C)C2)C1	ZINC001041501762	1345745598	/nfs/dbraw/zinc/74/55/98/1345745598.db2.gz	BTAFMSGFMOHCAF-HXUWFJFHSA-N	0	3	340.398	3.052	20	30		EGEDHN
CCC1(C(=O)N2CC[C@]3(CCN(Cc4cccc(C#N)c4)C3)C2)CC1	ZINC001041642983	1345808307	/nfs/dbraw/zinc/80/83/07/1345808307.db2.gz	RLXBQLVCDOJVCB-FQEVSTJZSA-N	0	3	337.467	3.173	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)[C@H](C)OC3CCCCCC3)C2)C1	ZINC001041662010	1345815169	/nfs/dbraw/zinc/81/51/69/1345815169.db2.gz	ZURHJBWQHDFDDC-GHTZIAJQSA-N	0	3	346.515	3.062	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccc(C)cc3Cl)C2)C1	ZINC001041703275	1345823273	/nfs/dbraw/zinc/82/32/73/1345823273.db2.gz	FIDLMATZRUVEQG-IBGZPJMESA-N	0	3	330.859	3.210	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)Cc3cccc4sccc43)C2)C1	ZINC001041724530	1345833141	/nfs/dbraw/zinc/83/31/41/1345833141.db2.gz	ZUTPYPLYVJDYAL-FQEVSTJZSA-N	0	3	338.476	3.001	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)C[C@@H](C)c3ccccc3F)C2)C1	ZINC001041741644	1345838197	/nfs/dbraw/zinc/83/81/97/1345838197.db2.gz	RLDSKVLWTBJJLS-DYESRHJHSA-N	0	3	342.458	3.267	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)[C@@H](C)c3ccc(CC)cc3)C2)C1	ZINC001041742255	1345838475	/nfs/dbraw/zinc/83/84/75/1345838475.db2.gz	YZWAWEZTQXTRAP-AVRDEDQJSA-N	0	3	338.495	3.300	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)[C@H](F)CC3CCCCC3)C2)C1	ZINC001041788411	1345850202	/nfs/dbraw/zinc/85/02/02/1345850202.db2.gz	DCYFHATUUUUJTN-UYAOXDASSA-N	0	3	334.479	3.243	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cccc4ccccc43)C2)C1	ZINC001041813497	1345860162	/nfs/dbraw/zinc/86/01/62/1345860162.db2.gz	BOVANXCOTUBDFJ-JOCHJYFZSA-N	0	3	332.447	3.401	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cc(C)c(CC)s3)C2)C1	ZINC001041820829	1345863624	/nfs/dbraw/zinc/86/36/24/1345863624.db2.gz	YMRXZUINIKKTAX-LJQANCHMSA-N	0	3	330.497	3.180	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccc(CC(C)C)cc3)C2)C1	ZINC001041822191	1345863862	/nfs/dbraw/zinc/86/38/62/1345863862.db2.gz	PJXXXAXQQJMFJT-JOCHJYFZSA-N	0	3	338.495	3.446	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)[C@H](C)c3ccc(F)cc3F)C2)C1	ZINC001041838763	1345868103	/nfs/dbraw/zinc/86/81/03/1345868103.db2.gz	BPALEKNAAUHDIX-FOIQADDNSA-N	0	3	346.421	3.016	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)[C@@H](CC)c3ccc(Cl)cc3)C2)C1	ZINC001041842075	1345869859	/nfs/dbraw/zinc/86/98/59/1345869859.db2.gz	AKGFFWLFTODPRX-AZUAARDMSA-N	0	3	344.886	3.391	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)[C@H](c3ccc(F)cc3)C(C)C)C2)C1	ZINC001041847621	1345872721	/nfs/dbraw/zinc/87/27/21/1345872721.db2.gz	SOALMWUVKWJLGU-FPOVZHCZSA-N	0	3	342.458	3.123	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccc(-c4ccccc4)[nH]3)C2)C1	ZINC001041852362	1345873881	/nfs/dbraw/zinc/87/38/81/1345873881.db2.gz	SFYCANLJWUXQMW-QFIPXVFZSA-N	0	3	347.462	3.243	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3oc(CC4CC4)nc3C)C[C@@H]21	ZINC001042064814	1345933657	/nfs/dbraw/zinc/93/36/57/1345933657.db2.gz	JUFIIBXNLXEJIS-IRXDYDNUSA-N	0	3	343.471	3.048	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(C(C)(C)C)cn3)C[C@@H]21	ZINC001042065079	1345933736	/nfs/dbraw/zinc/93/37/36/1345933736.db2.gz	OJWUYFFJXAWTFP-YJBOKZPZSA-N	0	3	327.472	3.102	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(-c4ccncc4)o3)C[C@H]21	ZINC001042094402	1345942252	/nfs/dbraw/zinc/94/22/52/1345942252.db2.gz	RNGUUSRJSGISTG-DOTOQJQBSA-N	0	3	337.423	3.064	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C3(C)CCC(F)(F)CC3)C[C@H]21	ZINC001042119382	1345948851	/nfs/dbraw/zinc/94/88/51/1345948851.db2.gz	GSWCWULMVXRLSE-LSDHHAIUSA-N	0	3	326.431	3.311	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)Cc3cccc(C(C)C)c3)C[C@H]21	ZINC001042136294	1345953476	/nfs/dbraw/zinc/95/34/76/1345953476.db2.gz	UDXUDUGUGFNQPH-TZIWHRDSSA-N	0	3	338.495	3.299	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3cccnc3C(F)F)C[C@H]21	ZINC001042146477	1345956772	/nfs/dbraw/zinc/95/67/72/1345956772.db2.gz	QBCUZKXYPYMUGV-UKRRQHHQSA-N	0	3	335.398	3.132	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(Cl)c(Cl)[nH]3)C[C@H]21	ZINC001042174871	1345966294	/nfs/dbraw/zinc/96/62/94/1345966294.db2.gz	YTTOADDEVTXVDP-GXFFZTMASA-N	0	3	328.243	3.044	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3ccc(F)cc3)[C@H]2C1	ZINC001042184824	1345972158	/nfs/dbraw/zinc/97/21/58/1345972158.db2.gz	ZTDAPWSSLYKKBW-AEFFLSMTSA-N	0	3	330.447	3.461	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3cc4ncccc4s3)C[C@H]21	ZINC001042185111	1345972943	/nfs/dbraw/zinc/97/29/43/1345972943.db2.gz	QCPODNSKAOTIIU-GDBMZVCRSA-N	0	3	341.480	3.409	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3ccc(C)nc3C)[C@H]2C1	ZINC001042188163	1345974780	/nfs/dbraw/zinc/97/47/80/1345974780.db2.gz	QCYJZLDTJBFMQA-HKUYNNGSSA-N	0	3	341.499	3.333	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CCN(C(=O)[C@H]4C[C@H]5C[C@H]5C4)C[C@@H]32)c1	ZINC001042196051	1345978594	/nfs/dbraw/zinc/97/85/94/1345978594.db2.gz	GIVMXCMCQNGPSW-MJCUULBUSA-N	0	3	349.478	3.027	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3ccc(F)c(F)c3F)C[C@H]21	ZINC001042207752	1345986052	/nfs/dbraw/zinc/98/60/52/1345986052.db2.gz	SYFGWZBGPWZSKO-SWLSCSKDSA-N	0	3	338.373	3.216	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc(Cl)cc3C)C[C@@H]21	ZINC001042216700	1345989817	/nfs/dbraw/zinc/98/98/17/1345989817.db2.gz	QTLRCKOXKDIPSM-QAPCUYQASA-N	0	3	330.859	3.208	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc4cc(F)ccc4o3)C[C@@H]21	ZINC001042251752	1346006489	/nfs/dbraw/zinc/00/64/89/1346006489.db2.gz	GPGAADIUYPNTSZ-BBRMVZONSA-N	0	3	328.387	3.294	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cnn(C(C)C)c3C3CC3)C[C@H]21	ZINC001042308067	1346026682	/nfs/dbraw/zinc/02/66/82/1346026682.db2.gz	SJMCQRFTJXTQMG-MAUKXSAKSA-N	0	3	342.487	3.064	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C3(c4ccccc4F)CCC3)C[C@@H]21	ZINC001042310182	1346027446	/nfs/dbraw/zinc/02/74/46/1346027446.db2.gz	RMIXMTRQEFMMFA-APWZRJJASA-N	0	3	342.458	3.356	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccccc3C(F)(F)F)C[C@@H]21	ZINC001042327198	1346035982	/nfs/dbraw/zinc/03/59/82/1346035982.db2.gz	MCUTYNYQKWCMPM-CJNGLKHVSA-N	0	3	338.373	3.428	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc4cccc(F)c4o3)C[C@@H]21	ZINC001042366955	1346058723	/nfs/dbraw/zinc/05/87/23/1346058723.db2.gz	YNQLAVZZDNIKJA-BBRMVZONSA-N	0	3	328.387	3.294	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C34CC(C(C)(C)C)(C3)C4)C[C@H]21	ZINC001042375129	1346062527	/nfs/dbraw/zinc/06/25/27/1346062527.db2.gz	SMABLZRYTJWFLM-FBIZOPLVSA-N	0	3	328.500	3.149	20	30		EGEDHN
C/C=C(\C)C(=O)N1CC[C@H](NCc2cc(F)ccc2C#N)C[C@H]1C	ZINC001044528522	1346357966	/nfs/dbraw/zinc/35/79/66/1346357966.db2.gz	AVLDQOYHTNVLPA-OAGRXBFHSA-N	0	3	329.419	3.133	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)[C@H]2CC=CCC2)s1	ZINC001044918962	1346462918	/nfs/dbraw/zinc/46/29/18/1346462918.db2.gz	FBHATFKDLIAFIG-GJZGRUSLSA-N	0	3	329.469	3.057	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]2CNCc2ccnc(Cl)c2)C1	ZINC001045191385	1346525501	/nfs/dbraw/zinc/52/55/01/1346525501.db2.gz	WFKBKGSNEUCTON-HNNXBMFYSA-N	0	3	333.863	3.172	20	30		EGEDHN
Cc1cccnc1C(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045400066	1346583414	/nfs/dbraw/zinc/58/34/14/1346583414.db2.gz	MKUVWRABQNICKT-UHFFFAOYSA-N	0	3	348.450	3.046	20	30		EGEDHN
CC1(C)CC[C@@H]1C(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1	ZINC001045527476	1346616919	/nfs/dbraw/zinc/61/69/19/1346616919.db2.gz	RJTWONICLQVPDS-GOSISDBHSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC1(NC(=O)[C@@H]2CC[C@H](F)C2)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045539750	1346623286	/nfs/dbraw/zinc/62/32/86/1346623286.db2.gz	XIVNXLWNONNWDS-MSOLQXFVSA-N	0	3	343.446	3.167	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)[C@@H]2C[C@H]2c2c(F)cccc2F)CC1	ZINC001045549134	1346627190	/nfs/dbraw/zinc/62/71/90/1346627190.db2.gz	RTXDTGDDRKQARY-ZIAGYGMSSA-N	0	3	334.410	3.225	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2cc(F)c(F)cc2Cl)CC1	ZINC001045634720	1346654547	/nfs/dbraw/zinc/65/45/47/1346654547.db2.gz	UWOZTNQLZPWQIY-UHFFFAOYSA-N	0	3	328.790	3.389	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)[C@@H]2C[C@@H]2c2cc(F)ccc2F)CC1	ZINC001045643378	1346656894	/nfs/dbraw/zinc/65/68/94/1346656894.db2.gz	ATVNHEUCRCHPIE-GDBMZVCRSA-N	0	3	334.410	3.225	20	30		EGEDHN
C/C(=C\C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1ccc(C#N)cc1)C1CC1	ZINC001045727003	1346680648	/nfs/dbraw/zinc/68/06/48/1346680648.db2.gz	VAGIEKDQXAVJQC-RBSFPSQFSA-N	0	3	349.478	3.480	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1cc2ccccc2o1	ZINC001045735359	1346682996	/nfs/dbraw/zinc/68/29/96/1346682996.db2.gz	NGRDEYIRNGONHN-UAGQMJEPSA-N	0	3	337.423	3.158	20	30		EGEDHN
CCC(=O)N1CCCC[C@]2(CCN(Cc3ccc(C#N)s3)C2)C1	ZINC001045902345	1346739929	/nfs/dbraw/zinc/73/99/29/1346739929.db2.gz	AATRRBNVDWOOSN-GOSISDBHSA-N	0	3	331.485	3.234	20	30		EGEDHN
CC(C)C(=O)N1CCCC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001045920049	1346756606	/nfs/dbraw/zinc/75/66/06/1346756606.db2.gz	YPNUJJXIWYFSLI-OAQYLSRUSA-N	0	3	339.483	3.419	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1oc(C)cc1C)C2	ZINC001045932179	1346769429	/nfs/dbraw/zinc/76/94/29/1346769429.db2.gz	ZSLBOBMUWGTIPD-HXUWFJFHSA-N	0	3	328.456	3.238	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCCC[C@]2(CCN(CC#CC)C2)C1	ZINC001045942556	1346778769	/nfs/dbraw/zinc/77/87/69/1346778769.db2.gz	ZYLWKAOEUSUHHR-LJQANCHMSA-N	0	3	336.907	3.493	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H]1C[C@H]1c1ccsc1)C2	ZINC001045946798	1346782110	/nfs/dbraw/zinc/78/21/10/1346782110.db2.gz	AAUCSLUANLVRGU-NLWGTHIKSA-N	0	3	342.508	3.189	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H]1CCC=CCCC1)C2	ZINC001045947995	1346783517	/nfs/dbraw/zinc/78/35/17/1346783517.db2.gz	RPWHRSDDVASHGP-CTNGQTDRSA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H]1CCCCC1(F)F)C2	ZINC001045954870	1346789603	/nfs/dbraw/zinc/78/96/03/1346789603.db2.gz	JOFZAOJHNGZZOC-FUHWJXTLSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccoc1C1CC1)C2	ZINC001045959849	1346794896	/nfs/dbraw/zinc/79/48/96/1346794896.db2.gz	BPXNPNPYPDTDFX-NRFANRHFSA-N	0	3	340.467	3.499	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H]1Cc3ccccc31)C2	ZINC001045962912	1346798217	/nfs/dbraw/zinc/79/82/17/1346798217.db2.gz	SCXVHERTMPDEEE-IRLDBZIGSA-N	0	3	336.479	3.054	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@H](C)c1ccsc1)C2	ZINC001045964799	1346799750	/nfs/dbraw/zinc/79/97/50/1346799750.db2.gz	BRYASWOQYLZWAD-APWZRJJASA-N	0	3	330.497	3.189	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc3cccnc3c1)C2	ZINC001045973311	1346809487	/nfs/dbraw/zinc/80/94/87/1346809487.db2.gz	KQLZBFCFWBZEMS-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc(C(C)C)no1)C2	ZINC001045974099	1346809863	/nfs/dbraw/zinc/80/98/63/1346809863.db2.gz	YCJRZNMOVNYUQQ-HXUWFJFHSA-N	0	3	343.471	3.140	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc(F)cc1C)C2	ZINC001045981162	1346819264	/nfs/dbraw/zinc/81/92/64/1346819264.db2.gz	QFDQBVVDXCJJCL-HXUWFJFHSA-N	0	3	328.431	3.086	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@H](C)c1ccccc1C)C2	ZINC001045985654	1346827157	/nfs/dbraw/zinc/82/71/57/1346827157.db2.gz	ZCTIDYZEXFISJX-KNQAVFIVSA-N	0	3	338.495	3.436	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)[C@@H]2C[C@H]2c2c(F)cccc2F)C1	ZINC001046605226	1347036271	/nfs/dbraw/zinc/03/62/71/1347036271.db2.gz	PILNMIMLFNZAPH-PJIJBLCYSA-N	0	3	334.410	3.225	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@]2(C)CCN([C@H](C)c3ccccc3)C2)c1	ZINC001046605716	1347036479	/nfs/dbraw/zinc/03/64/79/1347036479.db2.gz	XADMKRQJDSOTEA-IERDGZPVSA-N	0	3	333.435	3.018	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@]2(C)CCN(Cc3ccccc3CC)C2)c1	ZINC001046608586	1347038151	/nfs/dbraw/zinc/03/81/51/1347038151.db2.gz	XRYMWWNDYLTSNH-JOCHJYFZSA-N	0	3	347.462	3.020	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@]2(C)CCN(Cc3ccc(C)c(C)c3)C2)nc1	ZINC001046784208	1347099211	/nfs/dbraw/zinc/09/92/11/1347099211.db2.gz	ZQUBZRIBZRCKRR-QFIPXVFZSA-N	0	3	347.462	3.074	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2ccoc2Cl)C1	ZINC001046933573	1347156992	/nfs/dbraw/zinc/15/69/92/1347156992.db2.gz	DMOKSKJKGGHBBY-LLVKDONJSA-N	0	3	332.778	3.196	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2ccc(F)c(F)c2)C1	ZINC001046947160	1347160215	/nfs/dbraw/zinc/16/02/15/1347160215.db2.gz	ICFPFVHHNIPWCN-ZDUSSCGKSA-N	0	3	344.352	3.228	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2cccnc2C2CC2)C1	ZINC001046954227	1347163097	/nfs/dbraw/zinc/16/30/97/1347163097.db2.gz	QIOLZNDDARUZEB-OAHLLOKOSA-N	0	3	349.425	3.222	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2ncc(Cl)s2)C1	ZINC001046958461	1347165189	/nfs/dbraw/zinc/16/51/89/1347165189.db2.gz	YFNBUEOVMCOBBK-SNVBAGLBSA-N	0	3	349.834	3.060	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2ccn(CC)c2C)C1	ZINC001046963210	1347167874	/nfs/dbraw/zinc/16/78/74/1347167874.db2.gz	FPMFJPZPCMSXGW-OAHLLOKOSA-N	0	3	339.430	3.080	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2ccc3[nH]ccc3c2)C1	ZINC001046969896	1347171844	/nfs/dbraw/zinc/17/18/44/1347171844.db2.gz	GAUPEWNYXFLLLA-MRXNPFEDSA-N	0	3	347.409	3.431	20	30		EGEDHN
O=C(N[C@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1ccccc1)C2)C1CCCC1	ZINC001047007771	1347183765	/nfs/dbraw/zinc/18/37/65/1347183765.db2.gz	RROVOURLILHGSF-JBACZVJFSA-N	0	3	336.479	3.197	20	30		EGEDHN
CC(C)(C)C(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1C#N)C2	ZINC001047189308	1347236385	/nfs/dbraw/zinc/23/63/85/1347236385.db2.gz	SHGQYVYPJKAOHG-QGTPRVQTSA-N	0	3	325.456	3.073	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)c3cccc(F)c3)C2)CC1	ZINC001047222347	1347253660	/nfs/dbraw/zinc/25/36/60/1347253660.db2.gz	XGTBZJAZIFPOCD-IBGZPJMESA-N	0	3	342.458	3.413	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)c3cnc(C)s3)C2)CC1	ZINC001047231050	1347259766	/nfs/dbraw/zinc/25/97/66/1347259766.db2.gz	KFCKUVVAILUMPA-KRWDZBQOSA-N	0	3	345.512	3.039	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@H](C2CCN(C/C=C\Cl)CC2)C1	ZINC001047236946	1347264233	/nfs/dbraw/zinc/26/42/33/1347264233.db2.gz	LFXFBSUAHPKDFF-KSMNPYHXSA-N	0	3	334.891	3.103	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@@]3(C)CC=CCC3)C2)CC1	ZINC001047240107	1347266492	/nfs/dbraw/zinc/26/64/92/1347266492.db2.gz	ZZFURDYPUKMYBC-CTNGQTDRSA-N	0	3	328.500	3.317	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@@H]3CCCC34CC4)C2)CC1	ZINC001047245159	1347270407	/nfs/dbraw/zinc/27/04/07/1347270407.db2.gz	WZBIVSDOLSELPR-MOPGFXCFSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)C[C@@H]3CC=CCC3)C2)CC1	ZINC001047251447	1347276237	/nfs/dbraw/zinc/27/62/37/1347276237.db2.gz	JOPGVDMTUUXXHJ-QUCCMNQESA-N	0	3	328.500	3.317	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@H](C)c3ccccc3)C2)CC1	ZINC001047263263	1347284531	/nfs/dbraw/zinc/28/45/31/1347284531.db2.gz	DMRURIHNTPHCEV-WIYYLYMNSA-N	0	3	338.495	3.374	20	30		EGEDHN
C=C(C)CCN1C[C@H](O)[C@@H](N(C)C(=O)c2ccccc2C2CCC2)C1	ZINC001047614189	1347313949	/nfs/dbraw/zinc/31/39/49/1347313949.db2.gz	DCXDZTWOKCFDCF-PMACEKPBSA-N	0	3	342.483	3.037	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)/C=C\c2ccco2)C1	ZINC001047689773	1347332371	/nfs/dbraw/zinc/33/23/71/1347332371.db2.gz	BNMFZGZLOHHZSS-KJYTYGLYSA-N	0	3	349.434	3.191	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)CCC2CCC2)C1	ZINC001047787967	1347371638	/nfs/dbraw/zinc/37/16/38/1347371638.db2.gz	VAPGQHUHNCEHFY-OXJNMPFZSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@H]([C@H](C)NCc2cscn2)C1	ZINC001047855870	1347390650	/nfs/dbraw/zinc/39/06/50/1347390650.db2.gz	ONNWTFWBPVEXIE-AAEUAGOBSA-N	0	3	341.908	3.248	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]([C@@H](C)NCc3nc(C)sc3C)C2)C1	ZINC001047965306	1347426788	/nfs/dbraw/zinc/42/67/88/1347426788.db2.gz	LXQGPWUSKRUFRJ-CJNGLKHVSA-N	0	3	347.528	3.443	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]([C@H](C)NCc3csc(C)n3)C2)C1	ZINC001047967854	1347427977	/nfs/dbraw/zinc/42/79/77/1347427977.db2.gz	YTLJNOXEHNNPLN-DZGCQCFKSA-N	0	3	333.501	3.134	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)C2CC3(CC3)C2)C1	ZINC001047970653	1347429272	/nfs/dbraw/zinc/42/92/72/1347429272.db2.gz	XKPDSEGVUGDYEK-CRAIPNDOSA-N	0	3	337.467	3.075	20	30		EGEDHN
CCC1(C(=O)N2CC[C@@H]([C@@H](C)NCc3ccccc3C#N)C2)CC1	ZINC001047971020	1347429362	/nfs/dbraw/zinc/42/93/62/1347429362.db2.gz	MLRQAPBKVPBOMO-CRAIPNDOSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2cc(C(F)F)ccc2F)C1	ZINC001079711773	1357354932	/nfs/dbraw/zinc/35/49/32/1357354932.db2.gz	QLAFPNMOQCUFCP-IAQYHMDHSA-N	0	3	326.362	3.390	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccccc2)C[C@H]1CNCc1ccccc1C#N	ZINC001048111772	1347470265	/nfs/dbraw/zinc/47/02/65/1347470265.db2.gz	FJVZSTNFKZJHIT-OXQOHEQNSA-N	0	3	333.435	3.056	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001048338016	1347522230	/nfs/dbraw/zinc/52/22/30/1347522230.db2.gz	HLTILFDKFXFSFG-VQIMIIECSA-N	0	3	339.483	3.345	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)[C@@H](CNCc2csc(CCC)n2)C1	ZINC001048344651	1347524799	/nfs/dbraw/zinc/52/47/99/1347524799.db2.gz	QTOPBSIJPRQPJQ-CABCVRRESA-N	0	3	349.544	3.492	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H](C)[C@@H](CNCc3cscn3)C2)CC1	ZINC001048375001	1347535051	/nfs/dbraw/zinc/53/50/51/1347535051.db2.gz	SZBVEKHPKWOOFX-ZBFHGGJFSA-N	0	3	333.501	3.074	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)c2ccsc2)CC1	ZINC001048623910	1347623294	/nfs/dbraw/zinc/62/32/94/1347623294.db2.gz	VKXYGPWMFOMPON-UHFFFAOYSA-N	0	3	341.480	3.436	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)[C@@H]2C[C@H]2CCC)CC1	ZINC001048626276	1347624228	/nfs/dbraw/zinc/62/42/28/1347624228.db2.gz	HGAVHBOPXHORNM-YLJYHZDGSA-N	0	3	341.499	3.497	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)[C@H]2CCC2(F)F)CC1	ZINC001048627287	1347624852	/nfs/dbraw/zinc/62/48/52/1347624852.db2.gz	JUCLWBSAXIEBAX-QGZVFWFLSA-N	0	3	349.425	3.106	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CN(Cc3c(C)noc3CC)C[C@H]2C1	ZINC001048976181	1347695784	/nfs/dbraw/zinc/69/57/84/1347695784.db2.gz	GDPWKHRHSOOOCC-IYBDPMFKSA-N	0	3	345.487	3.038	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)[C@@H](CC3CCCCC3)C(C)C)C[C@@H]2C1	ZINC001049100322	1347725923	/nfs/dbraw/zinc/72/59/23/1347725923.db2.gz	XSJAXALAWALQKN-ZCNNSNEGSA-N	0	3	330.516	3.252	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc(CC)c(CCC)s3)C[C@@H]2C1	ZINC001049210216	1347748126	/nfs/dbraw/zinc/74/81/26/1347748126.db2.gz	RMRPDRYWNOWSTG-CALCHBBNSA-N	0	3	344.524	3.290	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)C[C@@H]2C=CCC2)c1	ZINC001049314022	1347787430	/nfs/dbraw/zinc/78/74/30/1347787430.db2.gz	KXUCIZXHPCRNRW-DUXKGJEZSA-N	0	3	349.478	3.480	20	30		EGEDHN
C/C(=C\C(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1ccc(C#N)cc1)C1CC1	ZINC001049351608	1347801150	/nfs/dbraw/zinc/80/11/50/1347801150.db2.gz	LYDRVKAVUCWMCG-NQCYKCSBSA-N	0	3	349.478	3.480	20	30		EGEDHN
Cc1[nH]ccc1C(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049406837	1347830173	/nfs/dbraw/zinc/83/01/73/1347830173.db2.gz	NQMQGLLPPYPZFH-PMACEKPBSA-N	0	3	348.450	3.074	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc2c(o1)CCCC2	ZINC001049514679	1347886873	/nfs/dbraw/zinc/88/68/73/1347886873.db2.gz	IPZQRBPLNVAPKP-DLBZAZTESA-N	0	3	328.456	3.413	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cnc(-c2ccccc2)o1	ZINC001049537324	1347896477	/nfs/dbraw/zinc/89/64/77/1347896477.db2.gz	NIBLDFAOADJPAF-ZWKOTPCHSA-N	0	3	349.434	3.044	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1ccc(C)cc1Cl	ZINC001049554925	1347906942	/nfs/dbraw/zinc/90/69/42/1347906942.db2.gz	IPNWNSAOECLGLJ-MOPGFXCFSA-N	0	3	344.886	3.280	20	30		EGEDHN
C=CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ncc(Cl)s1	ZINC001049588932	1347924470	/nfs/dbraw/zinc/92/44/70/1347924470.db2.gz	INZJYSOEWHUUCW-NEPJUHHUSA-N	0	3	325.865	3.052	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc2cc(F)ccc2[nH]1	ZINC001049627897	1347942172	/nfs/dbraw/zinc/94/21/72/1347942172.db2.gz	CIALPTJZKVCWTI-MSOLQXFVSA-N	0	3	327.403	3.172	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1c(F)ccc(F)c1F	ZINC001049677359	1347968618	/nfs/dbraw/zinc/96/86/18/1347968618.db2.gz	UIACQYBWZJMHMW-GJZGRUSLSA-N	0	3	338.373	3.359	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(F)c(Cl)c1F	ZINC001049690059	1347973024	/nfs/dbraw/zinc/97/30/24/1347973024.db2.gz	NNUGEYYBELFTHF-KBPBESRZSA-N	0	3	340.801	3.483	20	30		EGEDHN
CC(F)(F)CC(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049694052	1347975934	/nfs/dbraw/zinc/97/59/34/1347975934.db2.gz	ANQIPFIMYATGKU-SJORKVTESA-N	0	3	347.409	3.169	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1c(F)ccc(F)c1Cl	ZINC001049743474	1347996929	/nfs/dbraw/zinc/99/69/29/1347996929.db2.gz	QFPZBBYEKJDDFA-KGLIPLIRSA-N	0	3	340.801	3.483	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1ccc(F)c(Cl)c1	ZINC001049747882	1347998440	/nfs/dbraw/zinc/99/84/40/1347998440.db2.gz	LGCRJJHGHOOKMO-QZTJIDSGSA-N	0	3	348.849	3.110	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1ccc(C(C)(C)C)cc1	ZINC001049748791	1347999187	/nfs/dbraw/zinc/99/91/87/1347999187.db2.gz	PFPKVEHLLNATGZ-VQTJNVASSA-N	0	3	338.495	3.225	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](C)c1ccccc1F	ZINC001049799117	1348025741	/nfs/dbraw/zinc/02/57/41/1348025741.db2.gz	SZKPDHWCUZYPHK-ATZDWAIDSA-N	0	3	328.431	3.018	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc2nc(C)ccc2c1	ZINC001049799403	1348026535	/nfs/dbraw/zinc/02/65/35/1348026535.db2.gz	VOIZRUNBSXRTFI-PMACEKPBSA-N	0	3	335.451	3.408	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc2scnc2c1	ZINC001049820361	1348037481	/nfs/dbraw/zinc/03/74/81/1348037481.db2.gz	KAWFIRLKMSEJOW-JKSUJKDBSA-N	0	3	327.453	3.161	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cnn(CCC)c1C1CC1	ZINC001049834353	1348047809	/nfs/dbraw/zinc/04/78/09/1348047809.db2.gz	AMRIWTVXTVDSEI-MSOLQXFVSA-N	0	3	342.487	3.035	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cnn(CCCC)c1CC	ZINC001049835231	1348048279	/nfs/dbraw/zinc/04/82/79/1348048279.db2.gz	HBAGEHILKNWUNZ-MOPGFXCFSA-N	0	3	344.503	3.111	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@](C)(OC)c1ccccc1	ZINC001049846607	1348055903	/nfs/dbraw/zinc/05/59/03/1348055903.db2.gz	KMPOFQOWGSULNP-SFHLNBCPSA-N	0	3	342.483	3.190	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)CC12CC3CC(CC(C3)C1)C2	ZINC001049866018	1348072772	/nfs/dbraw/zinc/07/27/72/1348072772.db2.gz	XGFSWTGAWQMLBM-PHMMFBKASA-N	0	3	340.511	3.291	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1coc2ccc(F)cc12	ZINC001049867997	1348073736	/nfs/dbraw/zinc/07/37/36/1348073736.db2.gz	QKPTXVOSROCJMD-DLBZAZTESA-N	0	3	328.387	3.437	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc2c(s1)CCC2	ZINC001049874704	1348079664	/nfs/dbraw/zinc/07/96/64/1348079664.db2.gz	BBZJIYNIJDWTGM-JKSUJKDBSA-N	0	3	330.497	3.492	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(CC)c(C)s1	ZINC001049880493	1348085364	/nfs/dbraw/zinc/08/53/64/1348085364.db2.gz	BNIKTACCGCGFSE-SJORKVTESA-N	0	3	330.497	3.321	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1sc(CCC)nc1C	ZINC001049888854	1348093899	/nfs/dbraw/zinc/09/38/99/1348093899.db2.gz	ABNGAWNWZSSEGX-JKSUJKDBSA-N	0	3	345.512	3.106	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc2cccc(F)c2o1	ZINC001049903921	1348103145	/nfs/dbraw/zinc/10/31/45/1348103145.db2.gz	LMYRYIXLCOFOOV-IAGOWNOFSA-N	0	3	340.398	3.274	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1[nH]c2ccccc2c1OC	ZINC001049919921	1348112670	/nfs/dbraw/zinc/11/26/70/1348112670.db2.gz	YPSZPXVVUGNPPZ-SJORKVTESA-N	0	3	339.439	3.041	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](C)Cc1cccc(F)c1	ZINC001049925739	1348116434	/nfs/dbraw/zinc/11/64/34/1348116434.db2.gz	FYCJTZIVDHNMRQ-FFZOFVMBSA-N	0	3	342.458	3.093	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(N(C)C(C)C)cc1	ZINC001049928917	1348118938	/nfs/dbraw/zinc/11/89/38/1348118938.db2.gz	WJZLRTJZSCTRQI-WOJBJXKFSA-N	0	3	341.499	3.396	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1c[nH]c2ccc(F)cc12	ZINC001049938206	1348123245	/nfs/dbraw/zinc/12/32/45/1348123245.db2.gz	YJOGKCRZNZHQKU-ZWKOTPCHSA-N	0	3	327.403	3.172	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cccc4scnc43)[C@@H]2C1	ZINC001050047917	1348165456	/nfs/dbraw/zinc/16/54/56/1348165456.db2.gz	SUEFEGRVOBNQDR-DZGCQCFKSA-N	0	3	327.453	3.019	20	30		EGEDHN
C#CCCN1C[C@@H]2CCCN(C(=O)c3ccc(CCC)s3)[C@@H]2C1	ZINC001050055423	1348167582	/nfs/dbraw/zinc/16/75/82/1348167582.db2.gz	AYHDWFZLDHCWPR-DOTOQJQBSA-N	0	3	330.497	3.260	20	30		EGEDHN
C#CCCN1C[C@@H]2CCCN(C(=O)c3cc4c(s3)CCCC4)[C@@H]2C1	ZINC001050197285	1348208163	/nfs/dbraw/zinc/20/81/63/1348208163.db2.gz	ZAKIJRDCCFTWCH-DLBZAZTESA-N	0	3	342.508	3.187	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)CCn3ccc4ccccc43)[C@@H]2C1	ZINC001050197991	1348208917	/nfs/dbraw/zinc/20/89/17/1348208917.db2.gz	RPVKFGXQLFCYFL-AZUAARDMSA-N	0	3	337.467	3.140	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3cc(C)n(C(C)(C)C)n3)[C@@H]2C1	ZINC001050202282	1348210686	/nfs/dbraw/zinc/21/06/86/1348210686.db2.gz	LNCVEMWBTMTTKK-FUHWJXTLSA-N	0	3	344.503	3.059	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@@H]3CC[C@@H](c4ccccc4)C3)C2)CC1	ZINC001050565065	1348290806	/nfs/dbraw/zinc/29/08/06/1348290806.db2.gz	WDGOTWDYFXQSDT-WOJBJXKFSA-N	0	3	336.479	3.128	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc(C)c4cccnc34)C2)CC1	ZINC001050594913	1348296639	/nfs/dbraw/zinc/29/66/39/1348296639.db2.gz	VXYOBJYOEUBCFA-UHFFFAOYSA-N	0	3	347.462	3.105	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1cnccc1C)CC2	ZINC001050645576	1348313885	/nfs/dbraw/zinc/31/38/85/1348313885.db2.gz	RFAKNMJNUCPWKR-FQEVSTJZSA-N	0	3	341.499	3.417	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1cccnc1)CC2	ZINC001050645456	1348313930	/nfs/dbraw/zinc/31/39/30/1348313930.db2.gz	NBRFCTHPSQLZGF-IBGZPJMESA-N	0	3	327.472	3.108	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@@H](Cc3ccccc3)C(C)C)C2)CC1	ZINC001050663547	1348321321	/nfs/dbraw/zinc/32/13/21/1348321321.db2.gz	SDXFSCLLMFQLDJ-FQEVSTJZSA-N	0	3	338.495	3.059	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C3(C4CCCCC4)CC3)C2)CC1	ZINC001050741098	1348344737	/nfs/dbraw/zinc/34/47/37/1348344737.db2.gz	DGYLXXACSWVNMF-UHFFFAOYSA-N	0	3	328.500	3.295	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)C3(c4ccccc4)CCCC3)C2)CC1	ZINC001050746185	1348346934	/nfs/dbraw/zinc/34/69/34/1348346934.db2.gz	FTRQSBWIHWHAEE-UHFFFAOYSA-N	0	3	336.479	3.056	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3cc[nH]c3CCC)cccc2C1	ZINC001051298574	1348424398	/nfs/dbraw/zinc/42/43/98/1348424398.db2.gz	XHKYUGYUZVRSSX-UHFFFAOYSA-N	0	3	349.478	3.279	20	30		EGEDHN
C=C(C)CCN1CCN([C@H]2CCN(C(=O)CC3=CCCCC3)C2)CC1	ZINC001051997710	1348495511	/nfs/dbraw/zinc/49/55/11/1348495511.db2.gz	GXBLULVXKLANAV-FQEVSTJZSA-N	0	3	345.531	3.062	20	30		EGEDHN
Cc1cccc(C(=O)N[C@H]2CCCN(Cc3cccc(C#N)c3)CC2)n1	ZINC001052207719	1348511452	/nfs/dbraw/zinc/51/14/52/1348511452.db2.gz	FLHHXBUHNSDIDI-IBGZPJMESA-N	0	3	348.450	3.046	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2oc3c(cccc3F)c2C)CC1	ZINC001052446520	1348542890	/nfs/dbraw/zinc/54/28/90/1348542890.db2.gz	MABKAPSHUGRFNS-AWEZNQCLSA-N	0	3	328.387	3.098	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H](NC(=O)[C@H]3CCC3(F)F)CC2)cc1	ZINC001052480905	1348551585	/nfs/dbraw/zinc/55/15/85/1348551585.db2.gz	FZAKTFMFWBCEPO-DLBZAZTESA-N	0	3	347.409	3.074	20	30		EGEDHN
C[C@H](C(=O)N[C@H]1CCCN(Cc2cccc(C#N)c2)CC1)C1CCC1	ZINC001052484731	1348552858	/nfs/dbraw/zinc/55/28/58/1348552858.db2.gz	RYJRFZUJUFWDAU-JXFKEZNVSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cc(F)c(Cl)cc2F)CC1	ZINC001052669676	1348622632	/nfs/dbraw/zinc/62/26/32/1348622632.db2.gz	ZKTTXBJYNZRFFB-GFCCVEGCSA-N	0	3	340.801	3.226	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCCN(Cc3cccnc3C)CC2)C1	ZINC001052690886	1348634505	/nfs/dbraw/zinc/63/45/05/1348634505.db2.gz	QEXAHUKAIZIENM-SFHVURJKSA-N	0	3	327.472	3.217	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCCN(Cc3oc(CC)nc3C)CC2)C1	ZINC001052693268	1348636249	/nfs/dbraw/zinc/63/62/49/1348636249.db2.gz	QVLDPNQUKBXUSU-INIZCTEOSA-N	0	3	345.487	3.372	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)Cc2cccc3sccc32)CC1	ZINC001052765626	1348670104	/nfs/dbraw/zinc/67/01/04/1348670104.db2.gz	JZPPENDKKUTCTI-MRXNPFEDSA-N	0	3	326.465	3.048	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)C[C@@H]2CCCc3ccccc32)CC1	ZINC001052885275	1348722220	/nfs/dbraw/zinc/72/22/20/1348722220.db2.gz	QILRLHSZAAEREB-VQTJNVASSA-N	0	3	338.495	3.491	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cc(C)c(F)cc2Cl)CC1	ZINC001052900121	1348734615	/nfs/dbraw/zinc/73/46/15/1348734615.db2.gz	DYHGZVJMHPPMLD-CQSZACIVSA-N	0	3	336.838	3.395	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@@H]2C[C@H]2c2cccc(F)c2F)CC1	ZINC001052948128	1348764611	/nfs/dbraw/zinc/76/46/11/1348764611.db2.gz	YLEJYDKYOBDYTP-HYVNUMGLSA-N	0	3	346.421	3.062	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](NC(=O)c2ccccc2CN(C)C)CC1	ZINC001052955738	1348769775	/nfs/dbraw/zinc/76/97/75/1348769775.db2.gz	JLBQQDDTZCVECB-KRWDZBQOSA-N	0	3	349.906	3.085	20	30		EGEDHN
CCC(=O)N1CCC[C@H]([C@@H]2CCCN(Cc3ccc(C#N)s3)C2)C1	ZINC001052996493	1348793442	/nfs/dbraw/zinc/79/34/42/1348793442.db2.gz	JIJNFUAMFMZPMM-CVEARBPZSA-N	0	3	345.512	3.480	20	30		EGEDHN
CC(=O)N1CCC[C@H]([C@@H]2CCCN(Cc3ccccc3C#N)C2)C1	ZINC001052998146	1348794780	/nfs/dbraw/zinc/79/47/80/1348794780.db2.gz	VJZWLKXOPAIWTC-UXHICEINSA-N	0	3	325.456	3.029	20	30		EGEDHN
CC(=O)N1CCC[C@@H]([C@@H]2CCCN(Cc3ccccc3C#N)C2)C1	ZINC001052998148	1348794937	/nfs/dbraw/zinc/79/49/37/1348794937.db2.gz	VJZWLKXOPAIWTC-WOJBJXKFSA-N	0	3	325.456	3.029	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@H]([C@H]2CCCN(C/C=C\Cl)C2)C1	ZINC001053023305	1348821691	/nfs/dbraw/zinc/82/16/91/1348821691.db2.gz	HYBHZAZADRPGHG-FYABJIJZSA-N	0	3	334.891	3.103	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)/C=C(/C)C2CC2)C1	ZINC001053072329	1348888517	/nfs/dbraw/zinc/88/85/17/1348888517.db2.gz	QFTONUVENPPDIE-GXOVGCKYSA-N	0	3	328.500	3.459	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2csc(C)n2)C1	ZINC001053095577	1348926247	/nfs/dbraw/zinc/92/62/47/1348926247.db2.gz	KALUTTHPMAMOSK-WMZOPIPTSA-N	0	3	345.512	3.182	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccc(F)cc2C)C1	ZINC001053105299	1348941967	/nfs/dbraw/zinc/94/19/67/1348941967.db2.gz	TYGMIXMTDSDTRL-FXAWDEMLSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)CCc2ccc(C)o2)C1	ZINC001053105417	1348942220	/nfs/dbraw/zinc/94/22/20/1348942220.db2.gz	OJBHQYJMJZYNBF-QUCCMNQESA-N	0	3	342.483	3.247	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)Cc2ccccc2F)C1	ZINC001053107085	1348945543	/nfs/dbraw/zinc/94/55/43/1348945543.db2.gz	YZMXGFWFMQUPHV-QUCCMNQESA-N	0	3	342.458	3.095	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(CF)cc2)C1	ZINC001053107143	1348946516	/nfs/dbraw/zinc/94/65/16/1348946516.db2.gz	ADKHEAVBJNSQSG-PMACEKPBSA-N	0	3	342.458	3.496	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)C[C@H]1CCC(F)(F)C1)C2	ZINC001054143037	1349153184	/nfs/dbraw/zinc/15/31/84/1349153184.db2.gz	MUOYHKYKOFRTSD-SJLPKXTDSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(Cl)cc1F)C2	ZINC001054162042	1349164627	/nfs/dbraw/zinc/16/46/27/1349164627.db2.gz	VWENYRXXNPKPGL-SFHVURJKSA-N	0	3	334.822	3.040	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)Cc1cccc(C(F)F)c1)C2	ZINC001054163337	1349165844	/nfs/dbraw/zinc/16/58/44/1349165844.db2.gz	GITBGPSSNHQETP-FQEVSTJZSA-N	0	3	346.421	3.114	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc(C)cc(Cl)c1)C2	ZINC001054165032	1349167171	/nfs/dbraw/zinc/16/71/71/1349167171.db2.gz	YFYLFNSXAYLWOY-IBGZPJMESA-N	0	3	330.859	3.210	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@]2(CCN(Cc3ocnc3C)C2)C1	ZINC001054175823	1349177567	/nfs/dbraw/zinc/17/75/67/1349177567.db2.gz	WPANIIOGQAKQQV-LJQANCHMSA-N	0	3	331.460	3.010	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)C[C@@H]1CCCC1(F)F)C2	ZINC001054184682	1349187263	/nfs/dbraw/zinc/18/72/63/1349187263.db2.gz	JTQZREHQFDTYJW-WMZOPIPTSA-N	0	3	338.442	3.150	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@]2(CCN(Cc3ocnc3C)C2)C1	ZINC001054191281	1349193236	/nfs/dbraw/zinc/19/32/36/1349193236.db2.gz	DXMNJWZHSUGCAH-VQTJNVASSA-N	0	3	345.487	3.400	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@H]1CCCC(F)(F)C1)C2	ZINC001054196618	1349199732	/nfs/dbraw/zinc/19/97/32/1349199732.db2.gz	KQUSKJYPEXUGKG-WMZOPIPTSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)C[C@@H]1CCc3ccccc31)C2	ZINC001054216368	1349215613	/nfs/dbraw/zinc/21/56/13/1349215613.db2.gz	UQGMKMLPFIGVBD-UGKGYDQZSA-N	0	3	336.479	3.054	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(C(F)F)o1)C2	ZINC001054233717	1349225722	/nfs/dbraw/zinc/22/57/22/1349225722.db2.gz	QRPLNDDZEAOHIJ-GOSISDBHSA-N	0	3	336.382	3.169	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc(C)c(CC)s1)C2	ZINC001054236731	1349229397	/nfs/dbraw/zinc/22/93/97/1349229397.db2.gz	MRNUWXIYPWYQKF-LJQANCHMSA-N	0	3	330.497	3.180	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1oc3ccccc3c1C)C2	ZINC001054237681	1349230706	/nfs/dbraw/zinc/23/07/06/1349230706.db2.gz	ZYVHOSCONYDOGH-NRFANRHFSA-N	0	3	336.435	3.303	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc3c(c1)CCC3)C2	ZINC001054238893	1349232644	/nfs/dbraw/zinc/23/26/44/1349232644.db2.gz	GHGNDKVJTZHWNF-QFIPXVFZSA-N	0	3	336.479	3.127	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3cnn(CC)c3)cc2C1	ZINC001054259629	1349255742	/nfs/dbraw/zinc/25/57/42/1349255742.db2.gz	KPKOGGMYKOSESE-UHFFFAOYSA-N	0	3	338.455	3.115	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@@H]3CCCOCC3)cc2C1	ZINC001054263065	1349260864	/nfs/dbraw/zinc/26/08/64/1349260864.db2.gz	DKTMLKNMDIGPNO-GOSISDBHSA-N	0	3	342.483	3.401	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3csc(=O)[nH]3)cc2C1	ZINC001054277174	1349277713	/nfs/dbraw/zinc/27/77/13/1349277713.db2.gz	ONGUMEDNRQYKFN-UHFFFAOYSA-N	0	3	343.452	3.061	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CCCCC2)C[C@@H]1NCc1ccc(C#N)c(F)c1	ZINC001054344267	1349322707	/nfs/dbraw/zinc/32/27/07/1349322707.db2.gz	CKVHPUBITNIQNM-KUHUBIRLSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccoc2Cl)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054615029	1349415415	/nfs/dbraw/zinc/41/54/15/1349415415.db2.gz	WNDLKZJBBAAGGO-YGRLFVJLSA-N	0	3	349.843	3.116	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001054970325	1349530804	/nfs/dbraw/zinc/53/08/04/1349530804.db2.gz	BEYAJULWWDGGKN-KDOFPFPSSA-N	0	3	343.446	3.236	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@H](NCc2ccnc(Cl)c2)C1	ZINC001054970410	1349531573	/nfs/dbraw/zinc/53/15/73/1349531573.db2.gz	CIMLYWNLKAPVCM-UKRRQHHQSA-N	0	3	335.879	3.274	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2ccc(C(C)C)nc2CC)C1	ZINC001080455976	1357625158	/nfs/dbraw/zinc/62/51/58/1357625158.db2.gz	GVBXPFVGQLMUAL-DNVCBOLYSA-N	0	3	329.488	3.394	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2ccc(CC)c(CC)c2)[C@H](OC)C1	ZINC001082404569	1358028267	/nfs/dbraw/zinc/02/82/67/1358028267.db2.gz	VVASHYSAGRDMSU-WOJBJXKFSA-N	0	3	344.499	3.207	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)[C@H]2CCC(C)=C(C)C2)C1	ZINC001070410205	1354340306	/nfs/dbraw/zinc/34/03/06/1354340306.db2.gz	XTMWWALFQCNUQU-IRXDYDNUSA-N	0	3	342.487	3.138	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C(C)(C)C1CCCC1)C[C@@H](C)O2	ZINC001071178652	1354488588	/nfs/dbraw/zinc/48/85/88/1354488588.db2.gz	UGULKUZCDMBEGO-UTKZUKDTSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1cc[nH]c1C(C)C)C[C@H](C)O2	ZINC001071201512	1354502183	/nfs/dbraw/zinc/50/21/83/1354502183.db2.gz	FXGMOTJSGLHISV-OXJNMPFZSA-N	0	3	345.487	3.020	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1cc(C)ccc1F)C[C@H](C)O2	ZINC001071215506	1354510005	/nfs/dbraw/zinc/51/00/05/1354510005.db2.gz	COTWCFUSGYBLDJ-JXFKEZNVSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1cccc(Cl)c1)C[C@@H](C)O2	ZINC001071232697	1354515819	/nfs/dbraw/zinc/51/58/19/1354515819.db2.gz	AIQVYONTYHJGBD-BEFAXECRSA-N	0	3	348.874	3.222	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(F)c3ccncc23)C1	ZINC001086175781	1359015867	/nfs/dbraw/zinc/01/58/67/1359015867.db2.gz	LRWJQZFMJYWNBS-BETUJISGSA-N	0	3	347.821	3.224	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(N(C)C)cc2F)CC[C@@H]1C	ZINC001071567664	1354767255	/nfs/dbraw/zinc/76/72/55/1354767255.db2.gz	AWOJPMWOZVXGQK-GJZGRUSLSA-N	0	3	333.451	3.051	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cn(C)c3ccc(F)cc23)CC[C@H]1C	ZINC001071571195	1354770833	/nfs/dbraw/zinc/77/08/33/1354770833.db2.gz	AOTQJSKSHMAEII-GDBMZVCRSA-N	0	3	343.446	3.476	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(OC)c(OC)c2C)CC[C@H]1C	ZINC001071597422	1354786155	/nfs/dbraw/zinc/78/61/55/1354786155.db2.gz	JALJKWMEWGRUJX-ZBFHGGJFSA-N	0	3	346.471	3.171	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@H]2CC[C@@H](C)N(CCCF)C2)cc1	ZINC001071619274	1354802667	/nfs/dbraw/zinc/80/26/67/1354802667.db2.gz	MEOOJIQQXMVCCJ-WBVHZDCISA-N	0	3	334.435	3.194	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2c3c[nH]nc3ccc2C)CC[C@@H]1C	ZINC001071624272	1354806957	/nfs/dbraw/zinc/80/69/57/1354806957.db2.gz	GNLZVBNKXKBGEV-GJZGRUSLSA-N	0	3	326.444	3.030	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cnc3ccccc3c2C)CC[C@@H]1C	ZINC001071695729	1354857223	/nfs/dbraw/zinc/85/72/23/1354857223.db2.gz	SISIJXGPQHPRNL-RDJZCZTQSA-N	0	3	335.451	3.149	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2cc(F)c(C)cc2F)CC[C@H]1C	ZINC001071701947	1354861968	/nfs/dbraw/zinc/86/19/68/1354861968.db2.gz	QPWRFOOHVHCEJQ-GDBMZVCRSA-N	0	3	336.426	3.361	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2cc3ncccc3s2)CC[C@H]1C	ZINC001071734750	1354887657	/nfs/dbraw/zinc/88/76/57/1354887657.db2.gz	AADCBINNUGDVBI-ZIAGYGMSSA-N	0	3	329.469	3.455	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C2(c3cccnc3)CCCC2)CC[C@H]1C	ZINC001071773164	1354920268	/nfs/dbraw/zinc/92/02/68/1354920268.db2.gz	XGRXHKVMPPNLSN-IEBWSBKVSA-N	0	3	341.499	3.439	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CC[C@H](C)N(CC3=CCCCC3)C2)c1	ZINC001071814612	1354955743	/nfs/dbraw/zinc/95/57/43/1354955743.db2.gz	KLBBSCZESXVFFM-OXJNMPFZSA-N	0	3	337.467	3.146	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(C(C)C)nc2CC)CC[C@@H]1C	ZINC001071828077	1354966096	/nfs/dbraw/zinc/96/60/96/1354966096.db2.gz	IPTYUEBUPCUPQR-IRXDYDNUSA-N	0	3	341.499	3.373	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C(C)(C)c2ccccc2F)CC[C@@H]1C	ZINC001071896539	1355011663	/nfs/dbraw/zinc/01/16/63/1355011663.db2.gz	GVQBQWLPJVDNKJ-JKSUJKDBSA-N	0	3	330.447	3.096	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C(C)(C)c2ccccc2F)CC[C@@H]1C	ZINC001071896536	1355011811	/nfs/dbraw/zinc/01/18/11/1355011811.db2.gz	GVQBQWLPJVDNKJ-HOTGVXAUSA-N	0	3	330.447	3.096	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccccc2C(F)(F)F)CC[C@H]1C	ZINC001072016036	1355079293	/nfs/dbraw/zinc/07/92/93/1355079293.db2.gz	LKMQAILUTVZFHX-KGLIPLIRSA-N	0	3	338.373	3.311	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2coc3ccc(F)cc23)CC[C@H]1C	ZINC001072027512	1355088826	/nfs/dbraw/zinc/08/88/26/1355088826.db2.gz	ZUISLBNGDGFYGY-HIFRSBDPSA-N	0	3	328.387	3.178	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cnn(CC(C)C)c2C)CC[C@@H]1C	ZINC001072029803	1355091436	/nfs/dbraw/zinc/09/14/36/1355091436.db2.gz	JUZGJLKRBRSNIZ-DOTOQJQBSA-N	0	3	332.492	3.006	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)Cc2coc3cc(C)ccc23)CC[C@H]1C	ZINC001072048393	1355102843	/nfs/dbraw/zinc/10/28/43/1355102843.db2.gz	JYIVZWXWRGSLMC-SJLPKXTDSA-N	0	3	338.451	3.276	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)c2c[nH]c3c2cccc3CC)CC[C@@H]1C	ZINC001072098825	1355128196	/nfs/dbraw/zinc/12/81/96/1355128196.db2.gz	GXUOGDWYHSRFOC-HOCLYGCPSA-N	0	3	325.456	3.499	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1cnnc2ccccc21	ZINC001089704289	1360607238	/nfs/dbraw/zinc/60/72/38/1360607238.db2.gz	VAHGKYXJWUUDNO-HNNXBMFYSA-N	0	3	338.455	3.036	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](C)[C@H](CNCc2nccn2CC)C1	ZINC001072335492	1355244573	/nfs/dbraw/zinc/24/45/73/1355244573.db2.gz	NRTIFOIPIKBRQN-IAGOWNOFSA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](C)[C@@H](CNCc2nccn2CC)C1	ZINC001072335496	1355244759	/nfs/dbraw/zinc/24/47/59/1355244759.db2.gz	NRTIFOIPIKBRQN-SJORKVTESA-N	0	3	346.519	3.080	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)CCC4CCC4)C3)C2)c1	ZINC001072595267	1355349594	/nfs/dbraw/zinc/34/95/94/1355349594.db2.gz	KOCVLXZFEMVBKY-UHFFFAOYSA-N	0	3	337.467	3.173	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C[C@@H]3C[C@H](C)CC(C)(C)C3)C2)C1	ZINC001073062895	1355575677	/nfs/dbraw/zinc/57/56/77/1355575677.db2.gz	XMPHZXRVSFJSRA-ROUUACIJSA-N	0	3	330.516	3.397	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3ccc(Cl)c(Cl)c3)C2)C1	ZINC001073144973	1355623806	/nfs/dbraw/zinc/62/38/06/1355623806.db2.gz	GWFUBFNLKJSTGX-UHFFFAOYSA-N	0	3	325.239	3.327	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3cc4c(s3)CCCCC4)C2)C1	ZINC001073403936	1355758362	/nfs/dbraw/zinc/75/83/62/1355758362.db2.gz	HBPMQNSKVSQGPM-UHFFFAOYSA-N	0	3	330.497	3.351	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)CC[C@@H]3CCc4ccccc43)C2)C1	ZINC001073450678	1355786309	/nfs/dbraw/zinc/78/63/09/1355786309.db2.gz	DTNJSIZMLMZKQQ-IBGZPJMESA-N	0	3	336.479	3.054	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2ccccc2C2(C)CC2)C1	ZINC001073759940	1355891377	/nfs/dbraw/zinc/89/13/77/1355891377.db2.gz	MSPDCYDLQCLVRC-KRWDZBQOSA-N	0	3	342.483	3.135	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2cc(C(C)C)oc2C)C1	ZINC001073841396	1355914587	/nfs/dbraw/zinc/91/45/87/1355914587.db2.gz	JUJMEHDYZAQLPE-MRXNPFEDSA-N	0	3	334.460	3.108	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2cccc3ccccc32)C1	ZINC001073874175	1355931156	/nfs/dbraw/zinc/93/11/56/1355931156.db2.gz	VMCNSXPCPMDTGO-SFHVURJKSA-N	0	3	338.451	3.237	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2csc3c2CCCC3)C1	ZINC001073880425	1355937126	/nfs/dbraw/zinc/93/71/26/1355937126.db2.gz	IVMHAONRLORGDQ-OAHLLOKOSA-N	0	3	348.512	3.024	20	30		EGEDHN
C=C[C@@H](C(=O)N1CC[C@H](NCc2cccnc2)[C@@H]1C)c1ccccc1	ZINC001075125126	1356319693	/nfs/dbraw/zinc/31/96/93/1356319693.db2.gz	SQMNSFQAHIMLPM-DBVUQKKJSA-N	0	3	335.451	3.130	20	30		EGEDHN
CC(=O)N1CCC([C@@H]2CCCN(Cc3ccccc3C#N)CC2)CC1	ZINC001075442192	1356371286	/nfs/dbraw/zinc/37/12/86/1356371286.db2.gz	ZPGUQXFKYRHFLY-GOSISDBHSA-N	0	3	339.483	3.419	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](C2CCN(C(=O)[C@H](C)C#N)CC2)CC1	ZINC001075448230	1356380623	/nfs/dbraw/zinc/38/06/23/1356380623.db2.gz	RBSPPYSZNZOSHR-ZBFHGGJFSA-N	0	3	337.895	3.239	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)Cc3coc4ccc(C)cc34)[C@@H]2C1	ZINC001075842782	1356432133	/nfs/dbraw/zinc/43/21/33/1356432133.db2.gz	CCPPROFWLORSQI-QFBILLFUSA-N	0	3	338.451	3.393	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cc(C4CC4)[nH]c3C3CC3)[C@@H]2C1	ZINC001075944914	1356452475	/nfs/dbraw/zinc/45/24/75/1356452475.db2.gz	VEVLAXPBOLTYNJ-QFBILLFUSA-N	0	3	339.483	3.492	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccc(-n4cccc4)cc3)[C@@H]2C1	ZINC001076001951	1356464263	/nfs/dbraw/zinc/46/42/63/1356464263.db2.gz	OHXAUZSHVSBBHR-AZUAARDMSA-N	0	3	335.451	3.200	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@@H](C)c3c(F)cccc3F)[C@@H]2C1	ZINC001076044292	1356472638	/nfs/dbraw/zinc/47/26/38/1356472638.db2.gz	WQDPWDPMOOQZSG-GRDNDAEWSA-N	0	3	334.410	3.177	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1scnc1Cl)C2	ZINC001098417391	1363320623	/nfs/dbraw/zinc/32/06/23/1363320623.db2.gz	OYMNFVSYKBNHDC-UTUOFQBUSA-N	0	3	325.865	3.098	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@@H](CC)Oc3ccccc3F)[C@@H]2C1	ZINC001076461236	1356583519	/nfs/dbraw/zinc/58/35/19/1356583519.db2.gz	XJZJVFAEEYOVTK-CGTJXYLNSA-N	0	3	346.446	3.092	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)[C@H](CC)Cc3ccccc3C)[C@@H]2C1	ZINC001076460848	1356583689	/nfs/dbraw/zinc/58/36/89/1356583689.db2.gz	FNXHKTUDCAANCH-YZGWKJHDSA-N	0	3	326.484	3.282	20	30		EGEDHN
C#CCCN1CC[C@]2(C1)C[C@H](NC(=O)C(C)(C)C)c1ccccc1O2	ZINC001098545865	1363367948	/nfs/dbraw/zinc/36/79/48/1363367948.db2.gz	ZNZOYKDFYOKNAU-LAUBAEHRSA-N	0	3	340.467	3.140	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2coc(C3CCCC3)n2)C1	ZINC001099099145	1363621306	/nfs/dbraw/zinc/62/13/06/1363621306.db2.gz	BAZZIGBLBXZGCX-JXFKEZNVSA-N	0	3	343.471	3.493	20	30		EGEDHN
C=C(C)CCN1C[C@@H](O)[C@H](NC(=O)c2cccc(C3CCCC3)c2)C1	ZINC001078008664	1356885971	/nfs/dbraw/zinc/88/59/71/1356885971.db2.gz	PNNJUZSNKKAYMY-WOJBJXKFSA-N	0	3	342.483	3.085	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2ccc(C3CC3)cc2)C[C@H]1C(F)(F)F	ZINC001099344710	1363762655	/nfs/dbraw/zinc/76/26/55/1363762655.db2.gz	PINPZRPBOYUJKL-HZPDHXFCSA-N	0	3	338.373	3.343	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@@H]2C[C@@H](NC(=O)CC3CC3)C23CCC3)c1	ZINC001078530886	1356998275	/nfs/dbraw/zinc/99/82/75/1356998275.db2.gz	DETQBMDSBXZDOK-QZTJIDSGSA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@H](NC(=O)C2=CCCC2)C12CCC2	ZINC001078588560	1357022479	/nfs/dbraw/zinc/02/24/79/1357022479.db2.gz	DBVQWIPKAFBNGC-KGLIPLIRSA-N	0	3	339.277	3.022	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)Cc2cccc(OCCC)c2)C1	ZINC001080744150	1357730781	/nfs/dbraw/zinc/73/07/81/1357730781.db2.gz	MCYVBHVNAPXPLX-VQIMIIECSA-N	0	3	330.472	3.031	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2c(C)cncc2C)C12CCC2	ZINC001078680281	1357052673	/nfs/dbraw/zinc/05/26/73/1357052673.db2.gz	NQWAAQQDWAPILX-HUUCEWRRSA-N	0	3	333.863	3.082	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@H](NCc3ncccc3C)C23CCC3)C1	ZINC001078720580	1357065869	/nfs/dbraw/zinc/06/58/69/1357065869.db2.gz	NIRYVNDZQKPIRU-ROUUACIJSA-N	0	3	339.483	3.263	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2C[C@@H](NCc3ccns3)C23CCC3)C1	ZINC001078720584	1357066000	/nfs/dbraw/zinc/06/60/00/1357066000.db2.gz	NJMOGMIPQLCOFX-HUUCEWRRSA-N	0	3	331.485	3.016	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2nc(C3CC3)oc2C)C12CCC2	ZINC001078767399	1357073750	/nfs/dbraw/zinc/07/37/50/1357073750.db2.gz	JLVDZFWKVHUIKY-KGLIPLIRSA-N	0	3	349.862	3.244	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H]2CCCC3(CC3)C2)C[C@H]1c1ccccc1	ZINC001081116846	1357836764	/nfs/dbraw/zinc/83/67/64/1357836764.db2.gz	CUSMLICMVDDMGS-HSALFYBXSA-N	0	3	336.479	3.174	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2c(C)oc(C)c2C)C[C@H]1c1ccccc1	ZINC001081143131	1357844630	/nfs/dbraw/zinc/84/46/30/1357844630.db2.gz	NLYWXQYXZWDFET-RBUKOAKNSA-N	0	3	336.435	3.036	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2ccc(CCC)cc2)C[C@H]1c1ccccc1	ZINC001081170941	1357846894	/nfs/dbraw/zinc/84/68/94/1357846894.db2.gz	WHVKPGYFOPCMOR-FCHUYYIVSA-N	0	3	346.474	3.470	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C(CC)(CC)CC)C[C@H]1c1ccccc1	ZINC001081204648	1357849248	/nfs/dbraw/zinc/84/92/48/1357849248.db2.gz	BPZLHVCNVVAUSD-RBUKOAKNSA-N	0	3	326.484	3.420	20	30		EGEDHN
C[C@H](C#N)C(=O)N1C[C@H]2CCN(Cc3ccc4ccccc4c3)C[C@H]21	ZINC001084233047	1358167936	/nfs/dbraw/zinc/16/79/36/1358167936.db2.gz	RADPORPSSMRJPM-CDHQVMDDSA-N	0	3	333.435	3.032	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)c3cc(C)c(Cl)cc3C)[C@@H]2C1	ZINC001084571226	1358240143	/nfs/dbraw/zinc/24/01/43/1358240143.db2.gz	LXJUBSFAIGLZPN-CRAIPNDOSA-N	0	3	330.859	3.126	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@H](C)Cc3ccccc3F)[C@@H]2C1	ZINC001084657584	1358271950	/nfs/dbraw/zinc/27/19/50/1358271950.db2.gz	FOROUEGSBNRCHD-SZVBFZGTSA-N	0	3	330.447	3.113	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3cc4cc(F)ccc4o3)[C@@H]2C1	ZINC001084695408	1358284261	/nfs/dbraw/zinc/28/42/61/1358284261.db2.gz	RDVGHHBIHNKKGX-CZUORRHYSA-N	0	3	328.387	3.294	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)Cc3csc(C(C)(C)C)n3)[C@@H]2C1	ZINC001084724101	1358292592	/nfs/dbraw/zinc/29/25/92/1358292592.db2.gz	NEWHUUNLAGKJCI-GDBMZVCRSA-N	0	3	347.528	3.092	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3cc4cccc(F)c4o3)[C@@H]2C1	ZINC001084840087	1358324191	/nfs/dbraw/zinc/32/41/91/1358324191.db2.gz	NDVIRBRCHGEAMA-GDBMZVCRSA-N	0	3	328.387	3.294	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@@H](CC)c3ccc(F)cc3)[C@@H]2C1	ZINC001084858127	1358331411	/nfs/dbraw/zinc/33/14/11/1358331411.db2.gz	LMTQHPPMMUSRLB-NZSAHSFTSA-N	0	3	330.447	3.428	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)CCc3cccc(OCC)c3)[C@@H]2C1	ZINC001084859970	1358332311	/nfs/dbraw/zinc/33/23/11/1358332311.db2.gz	SZYHGZACNRHILE-UYAOXDASSA-N	0	3	342.483	3.127	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3sc(C(C)(C)C)nc3C)[C@@H]2C1	ZINC001084868761	1358335518	/nfs/dbraw/zinc/33/55/18/1358335518.db2.gz	BXLDQYBNDYBIBI-HUUCEWRRSA-N	0	3	347.528	3.471	20	30		EGEDHN
C/C(=C/C(=O)N1CC[C@H]2CCN(Cc3cccc(C#N)c3)[C@H]2C1)C1CC1	ZINC001084897186	1358343081	/nfs/dbraw/zinc/34/30/81/1358343081.db2.gz	ROCRZYOECKKANA-BJXLYJTFSA-N	0	3	349.478	3.337	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C3CCC(C4CC4)CC3)C[C@@H]21	ZINC001085084913	1358387306	/nfs/dbraw/zinc/38/73/06/1358387306.db2.gz	LOJQXXLXNZWROJ-NBDWZHNGSA-N	0	3	328.500	3.149	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@H]3Cc4c3cccc4Cl)C[C@@H]21	ZINC001085104022	1358392523	/nfs/dbraw/zinc/39/25/23/1358392523.db2.gz	AXFGXYVRLZFEHH-SKDZVZGDSA-N	0	3	330.859	3.089	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCCC[C@H]2NC(=O)CC2CC2)c(F)c1	ZINC001085116157	1358396769	/nfs/dbraw/zinc/39/67/69/1358396769.db2.gz	ZCHGZHYUOUQHFJ-QZTJIDSGSA-N	0	3	329.419	3.014	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cnc2cc(C)ccn21	ZINC001085208209	1358434205	/nfs/dbraw/zinc/43/42/05/1358434205.db2.gz	GTJUAXHGTWMVAO-HUUCEWRRSA-N	0	3	346.862	3.026	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)C[C@@H]1CCC(C)(C)CO1	ZINC001085278166	1358450122	/nfs/dbraw/zinc/45/01/22/1358450122.db2.gz	TUWAXJQJPSXSAG-ARFHVFGLSA-N	0	3	342.911	3.351	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCC[C@H]2NCc2ccc(F)cn2)C1	ZINC001085325024	1358468074	/nfs/dbraw/zinc/46/80/74/1358468074.db2.gz	UXQOJUGHYZBAMR-IAGOWNOFSA-N	0	3	331.435	3.094	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccc(COC)cc1	ZINC001085417888	1358494505	/nfs/dbraw/zinc/49/45/05/1358494505.db2.gz	XPAJWMFLZFKCGV-IAGOWNOFSA-N	0	3	336.863	3.216	20	30		EGEDHN
Cc1ccccc1[C@@H](C)N1CC[C@H]1CN(C)C(=O)c1cc(C#N)c[nH]1	ZINC001085534915	1358572416	/nfs/dbraw/zinc/57/24/16/1358572416.db2.gz	WASKFODKIMXWSD-WBVHZDCISA-N	0	3	336.439	3.102	20	30		EGEDHN
Cc1ccccc1[C@@H](C)N1CC[C@H]1CN(C)C(=O)c1ccc(C#N)[nH]1	ZINC001085553697	1358589472	/nfs/dbraw/zinc/58/94/72/1358589472.db2.gz	UNSCXYDTRRFSDJ-WBVHZDCISA-N	0	3	336.439	3.102	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cn(C(C)(C)C)nc1C	ZINC001085593726	1358620310	/nfs/dbraw/zinc/62/03/10/1358620310.db2.gz	PRJUBCUCNYZMOX-INIZCTEOSA-N	0	3	332.492	3.059	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1c(F)c(F)cc(F)c1F	ZINC001085610330	1358630979	/nfs/dbraw/zinc/63/09/79/1358630979.db2.gz	PKRLMWWQZYCUIF-LLVKDONJSA-N	0	3	344.352	3.356	20	30		EGEDHN
C=CCn1cccc1C(=O)N(C)C[C@@H]1CCN1CCCC1CCC1	ZINC001085641550	1358654900	/nfs/dbraw/zinc/65/49/00/1358654900.db2.gz	PLSXPRQERVJBEW-SFHVURJKSA-N	0	3	329.488	3.401	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1cn(CC)c2ccccc12	ZINC001085709439	1358701620	/nfs/dbraw/zinc/70/16/20/1358701620.db2.gz	HYDVAQYLBWCIRJ-INIZCTEOSA-N	0	3	325.456	3.384	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@@H]1CCc2ccc(F)cc2O1	ZINC001085723311	1358712233	/nfs/dbraw/zinc/71/22/33/1358712233.db2.gz	UGQVELHYKNVUQS-ROUUACIJSA-N	0	3	346.446	3.018	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc(C(F)(F)F)cn1	ZINC001085753953	1358734515	/nfs/dbraw/zinc/73/45/15/1358734515.db2.gz	VFFCQSXWSXLMBB-CQSZACIVSA-N	0	3	341.377	3.213	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1noc2c1CCCCC2	ZINC001085849118	1358818082	/nfs/dbraw/zinc/81/80/82/1358818082.db2.gz	PNMCZMFMEFKUDI-HNNXBMFYSA-N	0	3	331.460	3.056	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cnc(C(C)C)nc1C	ZINC001085857623	1358825261	/nfs/dbraw/zinc/82/52/61/1358825261.db2.gz	CUZPTIXLCNGYII-MRXNPFEDSA-N	0	3	330.476	3.021	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc2scnc2c1	ZINC001085903347	1358862192	/nfs/dbraw/zinc/86/21/92/1358862192.db2.gz	CEKUGRCZJYKEFA-HNNXBMFYSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1cc(F)c(F)cc1Cl	ZINC001085956607	1358913705	/nfs/dbraw/zinc/91/37/05/1358913705.db2.gz	GXKDLOMPHIXMQN-NSHDSACASA-N	0	3	328.790	3.341	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)[C@@H]1C[C@H]1c1cccc(F)c1F	ZINC001085980940	1358934337	/nfs/dbraw/zinc/93/43/37/1358934337.db2.gz	ALGIHWUZMSALHP-VNQPRFMTSA-N	0	3	334.410	3.177	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2c(F)ccc3ccncc32)C1	ZINC001086092194	1358993885	/nfs/dbraw/zinc/99/38/85/1358993885.db2.gz	GTRNYYPUAZPWPG-XBXGTLAGSA-N	0	3	347.821	3.224	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@H](CNC(=O)[C@H]3CC=CCC3)C2)c(F)c1	ZINC001086306805	1359063119	/nfs/dbraw/zinc/06/31/19/1359063119.db2.gz	VKJBKWJYTNUOIP-BQFCYCMXSA-N	0	3	341.430	3.038	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc(C)cc(OC)c2C)C1	ZINC001086418440	1359091818	/nfs/dbraw/zinc/09/18/18/1359091818.db2.gz	RYOBQIHNYBJRDF-SHTZXODSSA-N	0	3	336.863	3.163	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc3scnc3c2)C1	ZINC001086523741	1359131334	/nfs/dbraw/zinc/13/13/34/1359131334.db2.gz	GIWAAPLPJPKUFL-AULYBMBSSA-N	0	3	335.860	3.147	20	30		EGEDHN
C=C(C)CN1C[C@@H](c2ccccc2)[C@H](NC(=O)C2CC(F)(F)C2)C1	ZINC001086581709	1359154826	/nfs/dbraw/zinc/15/48/26/1359154826.db2.gz	JQQLPJWHXDBPBJ-DLBZAZTESA-N	0	3	334.410	3.192	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cc(F)c(F)c(F)c2)C1	ZINC001086809969	1359205458	/nfs/dbraw/zinc/20/54/58/1359205458.db2.gz	QVCMYPHNSYGOFZ-CMPLNLGQSA-N	0	3	346.780	3.345	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](CNCc2nc(C)c(C)s2)[C@@H](C)C1	ZINC001184017980	1387382348	/nfs/dbraw/zinc/38/23/48/1387382348.db2.gz	CSZRWYBOBANZRW-XJKSGUPXSA-N	0	3	335.517	3.300	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc(C)c(C)o3)C2)CC1	ZINC001086917074	1359245187	/nfs/dbraw/zinc/24/51/87/1359245187.db2.gz	YYUWFXUMADJXNF-MRXNPFEDSA-N	0	3	328.456	3.236	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)CCc3ccsc3)C2)CC1	ZINC001086927158	1359251830	/nfs/dbraw/zinc/25/18/30/1359251830.db2.gz	UGIPUDDQJIOENQ-KRWDZBQOSA-N	0	3	344.524	3.407	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc4cc(C)cn4c3)C2)CC1	ZINC001086926760	1359252235	/nfs/dbraw/zinc/25/22/35/1359252235.db2.gz	JEQNPZSCFFPZOT-GOSISDBHSA-N	0	3	349.478	3.198	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)COC3CCCCC3)C2)CC1	ZINC001086929962	1359254355	/nfs/dbraw/zinc/25/43/55/1359254355.db2.gz	UZUQGNAIEWJHRC-GOSISDBHSA-N	0	3	346.515	3.062	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)CC3CC(F)(F)C3)C2)CC1	ZINC001086929621	1359254247	/nfs/dbraw/zinc/25/42/47/1359254247.db2.gz	MNHDTAXOGAYSKG-OAHLLOKOSA-N	0	3	338.442	3.148	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cc4cc(C)ccc4[nH]3)C2)CC1	ZINC001086936222	1359259541	/nfs/dbraw/zinc/25/95/41/1359259541.db2.gz	LDRVMGCSBFOQTM-KRWDZBQOSA-N	0	3	349.478	3.426	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)C[C@H]3CCCC3(F)F)C2)CC1	ZINC001086939195	1359261665	/nfs/dbraw/zinc/26/16/65/1359261665.db2.gz	KCOVCPVBPRKIKO-HZPDHXFCSA-N	0	3	338.442	3.148	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc([C@H](C)CC)no3)C2)CC1	ZINC001086947014	1359268068	/nfs/dbraw/zinc/26/80/68/1359268068.db2.gz	OCKIMFCPGDTJCA-HZPDHXFCSA-N	0	3	343.471	3.138	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3oc(CC)cc3C)C2)CC1	ZINC001086953331	1359273669	/nfs/dbraw/zinc/27/36/69/1359273669.db2.gz	FRGLEZJEMDPAGZ-QGZVFWFLSA-N	0	3	342.483	3.490	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc(F)cc3F)C2)CC1	ZINC001086955032	1359275501	/nfs/dbraw/zinc/27/55/01/1359275501.db2.gz	BCAQZUVQJUVAON-OAHLLOKOSA-N	0	3	346.421	3.305	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H](C)Cc3ccccc3)C2)CC1	ZINC001086957123	1359278240	/nfs/dbraw/zinc/27/82/40/1359278240.db2.gz	FNGGZUNODOZEKL-OALUTQOASA-N	0	3	338.495	3.201	20	30		EGEDHN
C[C@@H]1CCN(C(=O)CC2CC2)[C@H](CNCc2ccc(C#N)cc2F)C1	ZINC001087109254	1359288786	/nfs/dbraw/zinc/28/87/86/1359288786.db2.gz	DYCRAWIFHDQKCK-KDOFPFPSSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](CNCc2nc(C)sc2C)[C@@H](C)C1	ZINC001184077199	1387388530	/nfs/dbraw/zinc/38/85/30/1387388530.db2.gz	HQMZROWJSBPTSB-XJKSGUPXSA-N	0	3	335.517	3.300	20	30		EGEDHN
C[C@@H]1CCN(C(=O)C=C2CCC2)[C@H](CNCc2ccc(C#N)s2)C1	ZINC001087147000	1359306784	/nfs/dbraw/zinc/30/67/84/1359306784.db2.gz	BJQQZBZHFJHVIN-ZBFHGGJFSA-N	0	3	343.496	3.447	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccccc3F)C(C)(C)[C@H]21	ZINC001087267118	1359338666	/nfs/dbraw/zinc/33/86/66/1359338666.db2.gz	VWUMHZJGHMJUPW-NXHRZFHOSA-N	0	3	328.431	3.068	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3c(C)oc(C)c3C)C(C)(C)[C@@H]21	ZINC001087295408	1359375987	/nfs/dbraw/zinc/37/59/87/1359375987.db2.gz	JALMGVKNUSLRGD-BHIYHBOVSA-N	0	3	342.483	3.447	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3coc(C(F)F)c3)C(C)(C)[C@H]21	ZINC001087300415	1359383557	/nfs/dbraw/zinc/38/35/57/1359383557.db2.gz	KJVJJAGNIJVFQK-SNPRPXQTSA-N	0	3	336.382	3.069	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc(C)cc(F)c1	ZINC001087304492	1359388330	/nfs/dbraw/zinc/38/83/30/1359388330.db2.gz	CPJRWFZSYIBJJY-CEXWTWQISA-N	0	3	342.458	3.376	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc4occc4s3)C(C)(C)[C@@H]21	ZINC001087304948	1359389514	/nfs/dbraw/zinc/38/95/14/1359389514.db2.gz	KDFQHPNULSTICJ-CSMYWGQOSA-N	0	3	342.464	3.346	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc4ccn(C)c4c3)C(C)(C)[C@H]21	ZINC001087313766	1359402716	/nfs/dbraw/zinc/40/27/16/1359402716.db2.gz	ZZSSSGHCIYKKDQ-HOJAQTOUSA-N	0	3	349.478	3.030	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc4ccccc4n3)C(C)(C)[C@H]21	ZINC001087315190	1359405284	/nfs/dbraw/zinc/40/52/84/1359405284.db2.gz	XORRESLZFXQNCL-UXPWSPDFSA-N	0	3	347.462	3.087	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1sc(C)nc1C	ZINC001087315926	1359406004	/nfs/dbraw/zinc/40/60/04/1359406004.db2.gz	KHKKNDIZKBUOLW-HYVNUMGLSA-N	0	3	345.512	3.002	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)Cc1ccc(C)c(C)c1	ZINC001087316422	1359406380	/nfs/dbraw/zinc/40/63/80/1359406380.db2.gz	RHBFRJIOHJXOEW-HLAWJBBLSA-N	0	3	338.495	3.084	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc4cnccc43)C(C)(C)[C@H]21	ZINC001087317687	1359409333	/nfs/dbraw/zinc/40/93/33/1359409333.db2.gz	LJEGOGWKGDBQQF-AQNXPRMDSA-N	0	3	347.462	3.087	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cccc2c1CCC2	ZINC001087320020	1359413331	/nfs/dbraw/zinc/41/33/31/1359413331.db2.gz	XSGANMDPIHTOSQ-HSALFYBXSA-N	0	3	336.479	3.027	20	30		EGEDHN
C=CCCN1CC[C@H](c2ccc(F)cc2)[C@H](NC(=O)c2ccc[nH]2)C1	ZINC001087462071	1359477803	/nfs/dbraw/zinc/47/78/03/1359477803.db2.gz	QJJXHBDAOIWYHL-IEBWSBKVSA-N	0	3	341.430	3.318	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cnn(-c3ccccc3)c2)[C@H]1CC	ZINC001087646798	1359569372	/nfs/dbraw/zinc/56/93/72/1359569372.db2.gz	UHWRYTHPTLNZHU-RBUKOAKNSA-N	0	3	338.455	3.031	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2c(C)noc2C(F)(F)F)[C@H]1CC	ZINC001087742966	1359623229	/nfs/dbraw/zinc/62/32/29/1359623229.db2.gz	IAZUZTQQLOKZMF-NWDGAFQWSA-N	0	3	345.365	3.161	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccccc2OC(C)C)[C@H]1CC	ZINC001087761492	1359632409	/nfs/dbraw/zinc/63/24/09/1359632409.db2.gz	VZIILPAYOVGULH-RBUKOAKNSA-N	0	3	342.483	3.009	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnn(CCC(C)C)c2C)[C@H]1CC	ZINC001087790085	1359645953	/nfs/dbraw/zinc/64/59/53/1359645953.db2.gz	UJTWAFLKCYIFHE-ZWKOTPCHSA-N	0	3	332.492	3.006	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(C)n(CC3CC3)c2C)[C@H]1CC	ZINC001087797195	1359650255	/nfs/dbraw/zinc/65/02/55/1359650255.db2.gz	BYIAFMDRKWCFAP-RBUKOAKNSA-N	0	3	329.488	3.284	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc(N(C)C(C)C)cc2)[C@H]1CC	ZINC001087847241	1359679548	/nfs/dbraw/zinc/67/95/48/1359679548.db2.gz	WUVQBYNGENPDAD-RBUKOAKNSA-N	0	3	329.488	3.300	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CCN(Cc3ccc(C#N)cc3)C[C@H]2C1	ZINC001088067013	1359741417	/nfs/dbraw/zinc/74/14/17/1359741417.db2.gz	KCBCMWUCDBFYIW-MOPGFXCFSA-N	0	3	337.467	3.051	20	30		EGEDHN
C[C@@]1(C(=O)N2C[C@H]3CCN(Cc4ccc(C#N)cc4)C[C@H]3C2)C=CCC1	ZINC001088071531	1359744174	/nfs/dbraw/zinc/74/41/74/1359744174.db2.gz	MBTCEBDOZCLHDD-RZUBCFFCSA-N	0	3	349.478	3.195	20	30		EGEDHN
Cc1cocc1C(=O)N1C[C@H]2CCN(Cc3ccc(C#N)cc3)C[C@H]2C1	ZINC001088070464	1359744761	/nfs/dbraw/zinc/74/47/61/1359744761.db2.gz	NHKCEVLHUWOROM-MOPGFXCFSA-N	0	3	349.434	3.054	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3ccc(Cl)c(C)c3)C[C@@H]2C1	ZINC001088090174	1359751399	/nfs/dbraw/zinc/75/13/99/1359751399.db2.gz	BCSQEYQFEBTVIR-SJORKVTESA-N	0	3	330.859	3.066	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CCN(Cc4cccnc4C)C[C@H]3C2)C1	ZINC001088098640	1359755655	/nfs/dbraw/zinc/75/56/55/1359755655.db2.gz	UQUGCOAEKUZKMF-MOPGFXCFSA-N	0	3	339.483	3.027	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3ccsc3C(F)F)C[C@@H]2C1	ZINC001088186299	1359785803	/nfs/dbraw/zinc/78/58/03/1359785803.db2.gz	RLPQFXXUOYDNRZ-OLZOCXBDSA-N	0	3	338.423	3.103	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3cc(C)c(F)cc3Cl)C[C@@H]2C1	ZINC001088184125	1359786089	/nfs/dbraw/zinc/78/60/89/1359786089.db2.gz	ORVMJNURAPKGCJ-CABCVRRESA-N	0	3	348.849	3.205	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2ncc(F)cc2F)C1	ZINC001088337246	1359832444	/nfs/dbraw/zinc/83/24/44/1359832444.db2.gz	ZSOCNNMBNOVVAB-ZDUSSCGKSA-N	0	3	343.805	3.087	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCCCC[C@H](NCc2cn(C)nc2C)C1	ZINC001088374684	1359856317	/nfs/dbraw/zinc/85/63/17/1359856317.db2.gz	NPZCPZYNMVFJSS-ICSRJNTNSA-N	0	3	346.519	3.192	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2nc(C)oc2C)C1	ZINC001088403699	1359876242	/nfs/dbraw/zinc/87/62/42/1359876242.db2.gz	BLOQMYKGWPROLG-AWEZNQCLSA-N	0	3	325.840	3.018	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)CC[C@@H]2CCCOC2)C1	ZINC001088407013	1359878931	/nfs/dbraw/zinc/87/89/31/1359878931.db2.gz	KCWXRBLUZWCUOH-DLBZAZTESA-N	0	3	342.911	3.307	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)[C@H](OC)C2CCCC2)C1	ZINC001088419522	1359889379	/nfs/dbraw/zinc/88/93/79/1359889379.db2.gz	RVHLWVFTBNECFD-IAGOWNOFSA-N	0	3	342.911	3.305	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2c[nH]c3ncccc23)C1	ZINC001088426254	1359894143	/nfs/dbraw/zinc/89/41/43/1359894143.db2.gz	PETHLJYTMMHHHX-CQSZACIVSA-N	0	3	346.862	3.290	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](CNCc2nc(C)sc2C)[C@@H](C)C1	ZINC001184311209	1387426887	/nfs/dbraw/zinc/42/68/87/1387426887.db2.gz	GMYPYKFMFWLPGB-YOEHRIQHSA-N	0	3	347.528	3.138	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cc(C3CCCCC3)n[nH]2)[C@H]1C	ZINC001088628469	1359997033	/nfs/dbraw/zinc/99/70/33/1359997033.db2.gz	UOZRSKQSXZQOOP-ZBFHGGJFSA-N	0	3	330.476	3.226	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)C2CC(c3cccc(F)c3)C2)[C@H]1C	ZINC001089077163	1360161756	/nfs/dbraw/zinc/16/17/56/1360161756.db2.gz	QGQKOKRXTILACQ-MRTGAJDVSA-N	0	3	330.447	3.474	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@@H](CNCc2c(F)cccc2F)[C@@H](C)C1	ZINC001184356033	1387438986	/nfs/dbraw/zinc/43/89/86/1387438986.db2.gz	GSYOVEXOGFYXDA-HOTGVXAUSA-N	0	3	348.437	3.198	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCCN1C(=O)[C@H]1CC1(C)C	ZINC001089160180	1360215708	/nfs/dbraw/zinc/21/57/08/1360215708.db2.gz	ITJBSRKCJUZDPP-RBUKOAKNSA-N	0	3	339.483	3.417	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@@H]2C[C@H]2c2sccc2C)CC(C)(C)C1	ZINC001089384053	1360385721	/nfs/dbraw/zinc/38/57/21/1360385721.db2.gz	NGESADGJAAUQLU-GVDBMIGSSA-N	0	3	344.524	3.400	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2oc(C(F)F)cc2C)CC(C)(C)C1	ZINC001089411243	1360408229	/nfs/dbraw/zinc/40/82/29/1360408229.db2.gz	FDFONOFCSMSXEB-ZDUSSCGKSA-N	0	3	338.398	3.379	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc(C)c(F)cc2F)CC(C)(C)C1	ZINC001089418340	1360411755	/nfs/dbraw/zinc/41/17/55/1360411755.db2.gz	NPZJKTVKZCQTIA-CQSZACIVSA-N	0	3	334.410	3.127	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc(C)n([C@@H](C)CC)n2)CC(C)(C)C1	ZINC001089427430	1360419839	/nfs/dbraw/zinc/41/98/39/1360419839.db2.gz	QHSYFKHMJQMEIO-DOTOQJQBSA-N	0	3	344.503	3.016	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cccc(C(C)C)n2)CC(C)(C)C1	ZINC001089429565	1360421203	/nfs/dbraw/zinc/42/12/03/1360421203.db2.gz	CGIOETZXAMICEO-MRXNPFEDSA-N	0	3	327.472	3.059	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc3cc(F)ccc3[nH]2)CC(C)(C)C1	ZINC001089457299	1360444149	/nfs/dbraw/zinc/44/41/49/1360444149.db2.gz	UNWFAXTVJCUZJP-INIZCTEOSA-N	0	3	341.430	3.161	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc3c(c2)[C@@H](C)CO3)CC(C)(C)C1	ZINC001089468746	1360452590	/nfs/dbraw/zinc/45/25/90/1360452590.db2.gz	CQTUVNVSQCZUGW-DOTOQJQBSA-N	0	3	340.467	3.036	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc3cccnc3c2)CC(C)(C)C1	ZINC001089520885	1360488705	/nfs/dbraw/zinc/48/87/05/1360488705.db2.gz	BSKBOCCKJSGBJT-SFHVURJKSA-N	0	3	335.451	3.088	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2ccc(Cl)cc2)CC(C)(C)C1	ZINC001089551206	1360502711	/nfs/dbraw/zinc/50/27/11/1360502711.db2.gz	DEKCBGZBDNKQKI-QGZVFWFLSA-N	0	3	332.875	3.123	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C2CC(c3ccccc3)C2)CC(C)(C)C1	ZINC001089566591	1360513095	/nfs/dbraw/zinc/51/30/95/1360513095.db2.gz	OEYMNECUMDUFPS-SOAGJPPSSA-N	0	3	338.495	3.420	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2c[nH]c3ccc(F)cc23)CC(C)(C)C1	ZINC001089568460	1360514192	/nfs/dbraw/zinc/51/41/92/1360514192.db2.gz	LGOUAJLAZCFSQC-OAHLLOKOSA-N	0	3	341.430	3.161	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cnc(CC(C)C)s2)CC(C)(C)C1	ZINC001089568546	1360514247	/nfs/dbraw/zinc/51/42/47/1360514247.db2.gz	MNBFFVXZIRBBET-HNNXBMFYSA-N	0	3	347.528	3.195	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(OCC)nc1	ZINC001089648143	1360561096	/nfs/dbraw/zinc/56/10/96/1360561096.db2.gz	GQWNCWNHYQWVET-QGZVFWFLSA-N	0	3	345.487	3.277	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1nc(C)sc1C	ZINC001089657063	1360568771	/nfs/dbraw/zinc/56/87/71/1360568771.db2.gz	QGNLKKGXELZNFQ-OAHLLOKOSA-N	0	3	333.501	3.004	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1n[nH]c2c1CCCC2	ZINC001089663303	1360573060	/nfs/dbraw/zinc/57/30/60/1360573060.db2.gz	LVPBCHVBVLZYNH-OAHLLOKOSA-N	0	3	344.503	3.085	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)[C@]12CCC[C@H]1OCC2	ZINC001089669504	1360579150	/nfs/dbraw/zinc/57/91/50/1360579150.db2.gz	NWGGONIHGFCPQT-QKLQHJQFSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1c[nH]nc1-c1ccoc1	ZINC001089671432	1360581561	/nfs/dbraw/zinc/58/15/61/1360581561.db2.gz	RUBOFPCYTVSJPA-OAHLLOKOSA-N	0	3	342.443	3.076	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(CCC)[nH]c(=O)c1	ZINC001089707151	1360610036	/nfs/dbraw/zinc/61/00/36/1360610036.db2.gz	FOHLRQRFZULQLJ-KRWDZBQOSA-N	0	3	345.487	3.146	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(C)cc2c[nH]nc21	ZINC001089709765	1360614282	/nfs/dbraw/zinc/61/42/82/1360614282.db2.gz	XSRATPSYIDHLGK-INIZCTEOSA-N	0	3	340.471	3.278	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1csc(Cl)n1	ZINC001089719922	1360622564	/nfs/dbraw/zinc/62/25/64/1360622564.db2.gz	MVZAFPDFVNLECT-LBPRGKRZSA-N	0	3	339.892	3.040	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(OC)cc(OC)c1	ZINC001089730087	1360633564	/nfs/dbraw/zinc/63/35/64/1360633564.db2.gz	VYWNIILVBPNGJM-MRXNPFEDSA-N	0	3	346.471	3.110	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(F)cc1F	ZINC001089730064	1360633580	/nfs/dbraw/zinc/63/35/80/1360633580.db2.gz	VQXFOVURLHBVDH-HNNXBMFYSA-N	0	3	334.410	3.209	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](CNCc2cc(C)no2)[C@H](C)C1	ZINC001184457948	1387465498	/nfs/dbraw/zinc/46/54/98/1387465498.db2.gz	CRDJUFWUBKHNNY-CRAIPNDOSA-N	0	3	345.487	3.326	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)CCC1CCC1	ZINC001089789802	1360664135	/nfs/dbraw/zinc/66/41/35/1360664135.db2.gz	OFYKZYFLXUIDKU-MLHJIOFPSA-N	0	3	336.907	3.488	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1c(C)coc1C	ZINC001089809202	1360672869	/nfs/dbraw/zinc/67/28/69/1360672869.db2.gz	NWNISFDUUSFVKB-YVSFHVDLSA-N	0	3	348.874	3.431	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](CNCc2ccn(CC)n2)[C@@H](C)C1	ZINC001184473845	1387468395	/nfs/dbraw/zinc/46/83/95/1387468395.db2.gz	RXCRATOYNJSELP-DLBZAZTESA-N	0	3	346.519	3.080	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](CNCc2cc(C)no2)[C@H](C)C1	ZINC001184484877	1387469755	/nfs/dbraw/zinc/46/97/55/1387469755.db2.gz	DJKXDAYCPXDOMQ-ZBFHGGJFSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccoc2CC)CC2(CCOCC2)C1	ZINC001089939283	1360754606	/nfs/dbraw/zinc/75/46/06/1360754606.db2.gz	NRZIHTIECBONDK-INIZCTEOSA-N	0	3	346.471	3.019	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)[C@@H]2CCCC2(C)C)CC2(CCOCC2)C1	ZINC001089952030	1360761591	/nfs/dbraw/zinc/76/15/91/1360761591.db2.gz	ROFBCPQTOVVIII-ROUUACIJSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2csc(C)c2)CC2(CCOCC2)C1	ZINC001089961492	1360768457	/nfs/dbraw/zinc/76/84/57/1360768457.db2.gz	JPOLZFGIFOVUES-KRWDZBQOSA-N	0	3	348.512	3.234	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)[C@H]2CC23CCCC3)CC2(CCOCC2)C1	ZINC001089965386	1360769978	/nfs/dbraw/zinc/76/99/78/1360769978.db2.gz	ZGLKAXVWZDHIDE-QZTJIDSGSA-N	0	3	346.515	3.130	20	30		EGEDHN
CC[C@@H](C)CC(=O)N1CC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001323848546	1387475114	/nfs/dbraw/zinc/47/51/14/1387475114.db2.gz	SQCKMCRSQTYEEB-UTKZUKDTSA-N	0	3	339.483	3.419	20	30		EGEDHN
CC[C@H](C(=O)N[C@@H](C)CCCCNc1cccc(F)c1C#N)N(C)C	ZINC001090103447	1360826424	/nfs/dbraw/zinc/82/64/24/1360826424.db2.gz	OTMOSRZANJUDKP-KBXCAEBGSA-N	0	3	348.466	3.124	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](CNCc2ccn(C(C)C)n2)[C@H](C)C1	ZINC001184509949	1387478587	/nfs/dbraw/zinc/47/85/87/1387478587.db2.gz	BQZMCRPFWPONKW-QZTJIDSGSA-N	0	3	346.519	3.395	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)c2cccc(C)c2)C1	ZINC001090909086	1360951011	/nfs/dbraw/zinc/95/10/11/1360951011.db2.gz	CHHXPYAWLVXCLL-UHFFFAOYSA-N	0	3	337.261	3.002	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cccc(-n3cccc3)c2)C1	ZINC001091127295	1360994983	/nfs/dbraw/zinc/99/49/83/1360994983.db2.gz	HZGFAVOODGXLLX-UHFFFAOYSA-N	0	3	343.858	3.328	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc3c(c2)[C@@H](C)CO3)C1	ZINC001091195483	1361004296	/nfs/dbraw/zinc/00/42/96/1361004296.db2.gz	QJMMDJSYHZETJE-ZOODHJKOSA-N	0	3	334.847	3.033	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)C2CCC(=C)CC2)C1	ZINC001091212829	1361008999	/nfs/dbraw/zinc/00/89/99/1361008999.db2.gz	BPRYLAPNAJOVRT-UHFFFAOYSA-N	0	3	341.293	3.126	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)[C@@H]2C[C@H]2CC(C)C)C1	ZINC001091243386	1361018581	/nfs/dbraw/zinc/01/85/81/1361018581.db2.gz	FTKIOBUPVUWXSK-HXSCFSKGSA-N	0	3	343.309	3.062	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(OC)c(Cl)c2)C1	ZINC001091355888	1361058139	/nfs/dbraw/zinc/05/81/39/1361058139.db2.gz	AYOJNUSTINUBMZ-UHFFFAOYSA-N	0	3	343.254	3.199	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(F)c3occc32)C1	ZINC001091374003	1361067285	/nfs/dbraw/zinc/06/72/85/1361067285.db2.gz	OGJLHUKDUSTONZ-UHFFFAOYSA-N	0	3	336.794	3.422	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3scc(C)c3Cl)C[C@]2(C)C1	ZINC001091698809	1361184641	/nfs/dbraw/zinc/18/46/41/1361184641.db2.gz	ZMAMQUSIJVFCJN-DYVFJYSZSA-N	0	3	336.888	3.127	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)[C@H]3CC[C@H](C4CCC4)CC3)C[C@]2(C)C1	ZINC001091754458	1361212373	/nfs/dbraw/zinc/21/23/73/1361212373.db2.gz	QFXMESKVOCCBFA-XCJLJZCSSA-N	0	3	328.500	3.006	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CN(Cc3oc(C)nc3C)C[C@@]2(C)C1	ZINC001091910973	1361243999	/nfs/dbraw/zinc/24/39/99/1361243999.db2.gz	LKNVXRXDGSLWGK-UZLBHIALSA-N	0	3	345.487	3.174	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@@]2(C)C1	ZINC001091916614	1361247674	/nfs/dbraw/zinc/24/76/74/1361247674.db2.gz	JOMUWUQUBGWONA-NQIIRXRSSA-N	0	3	337.467	3.051	20	30		EGEDHN
Cc1cocc1C(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@@]2(C)C1	ZINC001091925668	1361251115	/nfs/dbraw/zinc/25/11/15/1361251115.db2.gz	JKIYTCLFALYSFG-NQIIRXRSSA-N	0	3	349.434	3.054	20	30		EGEDHN
Cc1cocc1C(=O)N1C[C@H]2CN(Cc3ccc(C#N)cc3)C[C@@]2(C)C1	ZINC001091925648	1361251416	/nfs/dbraw/zinc/25/14/16/1361251416.db2.gz	ISBUSWDYMFKLJK-NQIIRXRSSA-N	0	3	349.434	3.054	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CN(Cc4ccc(F)cc4)C[C@@]3(C)C2)C1	ZINC001091996655	1361269632	/nfs/dbraw/zinc/26/96/32/1361269632.db2.gz	YZDHCOUKKRVZNF-UTKZUKDTSA-N	0	3	342.458	3.462	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)CC(C3CCC3)C3CCC3)C[C@]2(C)C1	ZINC001092016623	1361274462	/nfs/dbraw/zinc/27/44/62/1361274462.db2.gz	ZERWUMGVCOGJAE-NQIIRXRSSA-N	0	3	328.500	3.006	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc(C)cc3Cl)C[C@]2(C)C1	ZINC001092037235	1361279007	/nfs/dbraw/zinc/27/90/07/1361279007.db2.gz	BSDXUMDPDIJFPZ-BEFAXECRSA-N	0	3	330.859	3.066	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3cc4c(s3)CCCCC4)C[C@]2(C)C1	ZINC001092251350	1361341805	/nfs/dbraw/zinc/34/18/05/1361341805.db2.gz	CVENYOUDYBPZRU-UZLBHIALSA-N	0	3	342.508	3.044	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3c(CC)oc4ccccc43)C[C@]2(C)C1	ZINC001092307869	1361360472	/nfs/dbraw/zinc/36/04/72/1361360472.db2.gz	XNJDGIVXRRTXCI-VFNWGFHPSA-N	0	3	336.435	3.022	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C(C)=C2CCC2)CC1	ZINC001093371795	1361581429	/nfs/dbraw/zinc/58/14/29/1361581429.db2.gz	VECKJJZGDHETRP-LJQANCHMSA-N	0	3	326.484	3.213	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H](CNCc2ncc(C)s2)[C@H](C)C1	ZINC001094018577	1361725063	/nfs/dbraw/zinc/72/50/63/1361725063.db2.gz	UZABGOWGZOLTMK-SIIHOXLZSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@]23CCC[C@H]2N(CCF)CC3)cc1	ZINC001094451269	1361806053	/nfs/dbraw/zinc/80/60/53/1361806053.db2.gz	UWRNDAQIRVYVBZ-UYAOXDASSA-N	0	3	346.446	3.195	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3ccc4c(c3)C=CCC4)CCC[C@@H]12	ZINC001094532539	1361848233	/nfs/dbraw/zinc/84/82/33/1361848233.db2.gz	ZYSYDSBQJCQLCD-IFMALSPDSA-N	0	3	334.463	3.254	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3sccc3C(C)C)CCC[C@@H]12	ZINC001094582315	1361869841	/nfs/dbraw/zinc/86/98/41/1361869841.db2.gz	MMJSISRKTZOQER-VQIMIIECSA-N	0	3	330.497	3.479	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1C[C@H]2C[C@@H](C1)N(C(=O)C1=CCCC1)C2	ZINC001094896023	1361937034	/nfs/dbraw/zinc/93/70/34/1361937034.db2.gz	LTKJLWCYIRVWNC-BEVDRBHNSA-N	0	3	335.451	3.138	20	30		EGEDHN
Cc1cccc(C)c1CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(C#N)[nH]1)C2	ZINC001095327695	1362103323	/nfs/dbraw/zinc/10/33/23/1362103323.db2.gz	ATHYXZMRDQAXHD-UXPWSPDFSA-N	0	3	348.450	3.039	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1coc3c1cccc3OC)C2	ZINC001095421218	1362134642	/nfs/dbraw/zinc/13/46/42/1362134642.db2.gz	QHNYFTRDLWHRTB-COXVUDFISA-N	0	3	340.423	3.353	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cccc([C@@H]3CCOC3)c1)C2	ZINC001095650173	1362196772	/nfs/dbraw/zinc/19/67/72/1362196772.db2.gz	IVHZRGGLVHMWFL-ZRNYENFQSA-N	0	3	340.467	3.102	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1cc(F)c(C)cc1F)C2	ZINC001095807908	1362238825	/nfs/dbraw/zinc/23/88/25/1362238825.db2.gz	LHAWWVFQAUKEQB-JLSDUUJJSA-N	0	3	334.410	3.113	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cnn(C(C)C)c1Cl)C2	ZINC001095822285	1362245505	/nfs/dbraw/zinc/24/55/05/1362245505.db2.gz	FIZAXUZUZKPCRO-SNPRPXQTSA-N	0	3	336.867	3.029	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](C)c1ccc(Cl)cc1)C2	ZINC001095961415	1362309933	/nfs/dbraw/zinc/30/99/33/1362309933.db2.gz	HMPJXLJCVWWDRK-ZSGPHXLJSA-N	0	3	330.859	3.188	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H]1CCO[C@H]1c1ccccc1)C2	ZINC001096144774	1362404651	/nfs/dbraw/zinc/40/46/51/1362404651.db2.gz	QRIRBRWYDXZTOP-SLHNCBLASA-N	0	3	340.467	3.062	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(Cl)c3occc31)C2	ZINC001096325990	1362462745	/nfs/dbraw/zinc/46/27/45/1362462745.db2.gz	BAUIABPYDWWONA-DQYPLSBCSA-N	0	3	342.826	3.445	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](CNCc2csc(C)n2)[C@@H](C)C1	ZINC001184967827	1387575432	/nfs/dbraw/zinc/57/54/32/1387575432.db2.gz	MBJSWJRDWSOEDF-RDJZCZTQSA-N	0	3	347.528	3.219	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(N(CC)CC)cc1)C2	ZINC001096420603	1362502544	/nfs/dbraw/zinc/50/25/44/1362502544.db2.gz	FDCCJKLWRBJXTD-AABGKKOBSA-N	0	3	341.499	3.444	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(OC)c(OCC)c1)C2	ZINC001096504331	1362539761	/nfs/dbraw/zinc/53/97/61/1362539761.db2.gz	CKJAHHMVRNLQRK-IKGGRYGDSA-N	0	3	344.455	3.005	20	30		EGEDHN
C[C@H](C(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1)C1CCC1	ZINC001324317829	1387590008	/nfs/dbraw/zinc/59/00/08/1387590008.db2.gz	AZAXHHHUOGGPBO-INIZCTEOSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1sc(C3CC3)nc1C)C2	ZINC001097065783	1362830771	/nfs/dbraw/zinc/83/07/71/1362830771.db2.gz	DTUYOGOIKVQEDH-KFWWJZLASA-N	0	3	331.485	3.240	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1ccc(CCCC)cc1)C2	ZINC001097458018	1363002217	/nfs/dbraw/zinc/00/22/17/1363002217.db2.gz	CLFJHNNTTZFIEB-NJYVYQBISA-N	0	3	338.495	3.317	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1coc3ccc(OC)cc13)C2	ZINC001097505195	1363026683	/nfs/dbraw/zinc/02/66/83/1363026683.db2.gz	JVVQHGKRRKXMCN-XWIAVFTESA-N	0	3	340.423	3.353	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc3c(ccc(C)c3C)[nH]1)C2	ZINC001097640564	1363086664	/nfs/dbraw/zinc/08/66/64/1363086664.db2.gz	PEBPABHNGACYCJ-ZTNFWEORSA-N	0	3	335.451	3.143	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C(C)(C)c1cccc(F)c1)C2	ZINC001097834018	1363136062	/nfs/dbraw/zinc/13/60/62/1363136062.db2.gz	HCPCDSSXFJKQRQ-KURKYZTESA-N	0	3	330.447	3.401	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@H](CNCc3nccs3)[C@H](C)C2)CC1	ZINC001185094461	1387617462	/nfs/dbraw/zinc/61/74/62/1387617462.db2.gz	IRRQUDXXOAZPAQ-HZPDHXFCSA-N	0	3	347.528	3.464	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1csc3c1CC[C@H](C)C3)C2	ZINC001098324007	1363299571	/nfs/dbraw/zinc/29/95/71/1363299571.db2.gz	VJKKAUYANNBDIW-JFTQMJAMSA-N	0	3	342.508	3.231	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1c[nH]cc1-c1ccccc1)C2	ZINC001098400376	1363316597	/nfs/dbraw/zinc/31/65/97/1363316597.db2.gz	AZGTVFPFZSWQBB-AHRSYUTCSA-N	0	3	333.435	3.040	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccoc1C1CC1)C[C@H](C)O2	ZINC001098631372	1363406875	/nfs/dbraw/zinc/40/68/75/1363406875.db2.gz	WAWVPLRZNKXVJG-HNNXBMFYSA-N	0	3	344.455	3.039	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H](C)c1ccsc1)C[C@H](C)O2	ZINC001098635227	1363409321	/nfs/dbraw/zinc/40/93/21/1363409321.db2.gz	FJAGJIHIQOPYIC-JKSUJKDBSA-N	0	3	348.512	3.120	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H](C)C1CCCC1)C[C@H](C)O2	ZINC001098652418	1363418275	/nfs/dbraw/zinc/41/82/75/1363418275.db2.gz	CZEWSHWEPLKPFB-IRXDYDNUSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)Cc2coc3cc(F)ccc23)C1	ZINC001098829941	1363485523	/nfs/dbraw/zinc/48/55/23/1363485523.db2.gz	XISVEBOODCGARV-YWZLYKJASA-N	0	3	342.414	3.271	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccccc1C	ZINC001098854908	1363493439	/nfs/dbraw/zinc/49/34/39/1363493439.db2.gz	DPZLKQDQIBWUDB-GOSISDBHSA-N	0	3	344.499	3.418	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H](C)c2ccc(Cl)cc2)C1	ZINC001099013843	1363574760	/nfs/dbraw/zinc/57/47/60/1363574760.db2.gz	YYHJCBCBXGWCDA-KNBMTAEXSA-N	0	3	344.886	3.438	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(F)cc3cccnc32)C1	ZINC001099059223	1363600484	/nfs/dbraw/zinc/60/04/84/1363600484.db2.gz	BLMMYRAPOAYGDF-YWZLYKJASA-N	0	3	339.414	3.144	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@]2(C)C[C@@H]2c2ccccc2)C1	ZINC001099074261	1363608547	/nfs/dbraw/zinc/60/85/47/1363608547.db2.gz	SEWPTPSHAVWNHB-MXNKGDRCSA-N	0	3	336.479	3.174	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc3scnc3c2)C1	ZINC001099101357	1363622665	/nfs/dbraw/zinc/62/26/65/1363622665.db2.gz	VCOCCQSMQZVMRJ-KSSFIOAISA-N	0	3	327.453	3.067	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)C1(F)CCCC1	ZINC001099130860	1363642783	/nfs/dbraw/zinc/64/27/83/1363642783.db2.gz	TZHBFKHHTIGBNP-MRXNPFEDSA-N	0	3	340.483	3.078	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)C[C@@H]1CCC(C)(C)CO1	ZINC001099144407	1363652886	/nfs/dbraw/zinc/65/28/86/1363652886.db2.gz	HCYOGHLGZGQKOX-SJORKVTESA-N	0	3	336.520	3.375	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc3c(c2)CCCC3)C1	ZINC001099148150	1363655315	/nfs/dbraw/zinc/65/53/15/1363655315.db2.gz	YOBPFIUDWYHCIJ-UNMCSNQZSA-N	0	3	336.479	3.173	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2cc(C)oc2C)C[C@H]1C(F)(F)F	ZINC001099210039	1363693550	/nfs/dbraw/zinc/69/35/50/1363693550.db2.gz	UJVNLKXNMDIELN-ZIAGYGMSSA-N	0	3	330.350	3.065	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2ccc(Cl)o2)C[C@H]1C(F)(F)F	ZINC001099212011	1363693764	/nfs/dbraw/zinc/69/37/64/1363693764.db2.gz	OOKYWAXCEZTXIC-NXEZZACHSA-N	0	3	336.741	3.102	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)[C@H](C)c1c(C)n[nH]c1C	ZINC001099269929	1363724538	/nfs/dbraw/zinc/72/45/38/1363724538.db2.gz	HETIQWBMTIKGAG-PBHICJAKSA-N	0	3	346.519	3.313	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@@H]2C[C@@H]3CCCC[C@H]23)C[C@H]1C(F)(F)F	ZINC001099283404	1363731254	/nfs/dbraw/zinc/73/12/54/1363731254.db2.gz	BMMXJWXJXSLBCI-AALSBFMBSA-N	0	3	344.421	3.368	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)C2(C3CCC3)CCC2)C[C@H]1C(F)(F)F	ZINC001099285260	1363731366	/nfs/dbraw/zinc/73/13/66/1363731366.db2.gz	SYGZTSCFIMLMON-ZIAGYGMSSA-N	0	3	330.394	3.122	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)Cc1ccc(OC)cc1F	ZINC001099291796	1363735145	/nfs/dbraw/zinc/73/51/45/1363735145.db2.gz	MVCBZZZZRQHSAA-MRXNPFEDSA-N	0	3	348.462	3.170	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2ccoc2C2CC2)C[C@H]1C(F)(F)F	ZINC001099298600	1363736929	/nfs/dbraw/zinc/73/69/29/1363736929.db2.gz	WXZFXYWNZUISKQ-ZIAGYGMSSA-N	0	3	342.361	3.326	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2ccc(C)cc2Cl)C[C@H]1C(F)(F)F	ZINC001099311658	1363745047	/nfs/dbraw/zinc/74/50/47/1363745047.db2.gz	KZAQNDXQSKVOFS-TZMCWYRMSA-N	0	3	346.780	3.427	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)CCc1c(C)noc1C	ZINC001099329806	1363754005	/nfs/dbraw/zinc/75/40/05/1363754005.db2.gz	UTRDLMAOHCAURH-INIZCTEOSA-N	0	3	333.476	3.017	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2c(F)cccc2F)C[C@H]1C(F)(F)F	ZINC001099336920	1363757838	/nfs/dbraw/zinc/75/78/38/1363757838.db2.gz	YDEGIEZOGADPGT-ZWNOBZJWSA-N	0	3	348.315	3.133	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@@H](C)c2ccccc2C)C[C@H]1C(F)(F)F	ZINC001099346814	1363763633	/nfs/dbraw/zinc/76/36/33/1363763633.db2.gz	UAXUMZGNZHWPNZ-NUEKZKHPSA-N	0	3	340.389	3.263	20	30		EGEDHN
C=CCCC[N@@H+]1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1ccccc1[O-]	ZINC001099400637	1363787308	/nfs/dbraw/zinc/78/73/08/1363787308.db2.gz	FXAFPTMNMZVHOP-NQYYFHDYSA-N	0	3	340.467	3.141	20	30		EGEDHN
C=CCCC[N@H+]1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1ccccc1[O-]	ZINC001099400637	1363787310	/nfs/dbraw/zinc/78/73/10/1363787310.db2.gz	FXAFPTMNMZVHOP-NQYYFHDYSA-N	0	3	340.467	3.141	20	30		EGEDHN
C/C=C(\C)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2ccccc2C#N)C1	ZINC001099407818	1363789080	/nfs/dbraw/zinc/78/90/80/1363789080.db2.gz	NTJJDLNROZQPQS-AZDIFBQUSA-N	0	3	337.467	3.243	20	30		EGEDHN
N#Cc1ccccc1CNC[C@]12CCC[C@H]1CN(C(=O)C1=CCCC1)C2	ZINC001099413066	1363792020	/nfs/dbraw/zinc/79/20/20/1363792020.db2.gz	TYVLNEORFXIIFV-UNMCSNQZSA-N	0	3	349.478	3.387	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1CN(CC(=C)C)CC2(CCOCC2)C1	ZINC001099583528	1363865080	/nfs/dbraw/zinc/86/50/80/1363865080.db2.gz	UIPMMEPTSCCEAZ-LJQANCHMSA-N	0	3	346.515	3.318	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)[C@H](C)C(CC)CC)CC2(CCOCC2)C1	ZINC001099583583	1363865331	/nfs/dbraw/zinc/86/53/31/1363865331.db2.gz	VLTFNLOJBWVCAP-SJLPKXTDSA-N	0	3	336.520	3.232	20	30		EGEDHN
CCN(CC(=O)Nc1c(C#N)c(C)c(C)n1CCCOC)C(C)(C)C	ZINC001324502503	1387653892	/nfs/dbraw/zinc/65/38/92/1387653892.db2.gz	KXFXFKLKKOWMKT-UHFFFAOYSA-N	0	3	348.491	3.072	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)CCCCCCCCCC)[C@@H](O)C1	ZINC001100082361	1364011427	/nfs/dbraw/zinc/01/14/27/1364011427.db2.gz	AQOWHNMRKCQLAF-OALUTQOASA-N	0	3	336.520	3.092	20	30		EGEDHN
CCCCCCCCCC(=O)N[C@@H]1CCN(CCCF)C[C@@H]1O	ZINC001100087225	1364014202	/nfs/dbraw/zinc/01/42/02/1364014202.db2.gz	IATSSOBAFQISOC-SJORKVTESA-N	0	3	330.488	3.038	20	30		EGEDHN
CC(C)[C@@H](C)CC(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100172884	1364035487	/nfs/dbraw/zinc/03/54/87/1364035487.db2.gz	IAMSUQMINDLXHD-KKXNLOMOSA-N	0	3	326.484	3.205	20	30		EGEDHN
C=CCCC(=O)NCC1CC(NCc2cc(Cl)ccc2OC)C1	ZINC001100178545	1364037227	/nfs/dbraw/zinc/03/72/27/1364037227.db2.gz	PNIDZMFNMPTJDM-UHFFFAOYSA-N	0	3	336.863	3.299	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](CNCc2ocnc2C)[C@@H](C)C1	ZINC001185224665	1387656410	/nfs/dbraw/zinc/65/64/10/1387656410.db2.gz	GIDHQAUEQXIGPZ-GOEBONIOSA-N	0	3	333.476	3.160	20	30		EGEDHN
O=C(CC1CCC1)NCC1CC(NCC#Cc2ccc(Cl)cc2)C1	ZINC001100220674	1364048287	/nfs/dbraw/zinc/04/82/87/1364048287.db2.gz	RYWSWPYBXKERKK-UHFFFAOYSA-N	0	3	344.886	3.366	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)C=C(CC)CC)C1	ZINC001100241323	1364054566	/nfs/dbraw/zinc/05/45/66/1364054566.db2.gz	NUHXYAZWBRXOHK-UHFFFAOYSA-N	0	3	329.282	3.126	20	30		EGEDHN
C#CCCCCC(=O)NCC1CC(NCc2cccc(F)c2F)C1	ZINC001100259321	1364060755	/nfs/dbraw/zinc/06/07/55/1364060755.db2.gz	GOGAXOMDQQPPKJ-UHFFFAOYSA-N	0	3	334.410	3.143	20	30		EGEDHN
C#CCCCC(=O)NCC1CC(NCc2cc(F)ccc2Cl)C1	ZINC001100283857	1364067039	/nfs/dbraw/zinc/06/70/39/1364067039.db2.gz	XTMWSFXLLAGKJJ-UHFFFAOYSA-N	0	3	336.838	3.267	20	30		EGEDHN
C#CCCCC(=O)NCC1CC(NCc2ccc(Cl)cc2OC)C1	ZINC001100284337	1364067812	/nfs/dbraw/zinc/06/78/12/1364067812.db2.gz	KGBULQYEOMEFSN-UHFFFAOYSA-N	0	3	348.874	3.137	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NCC1CC(NCc2oc(C)nc2C)C1	ZINC001100363319	1364092111	/nfs/dbraw/zinc/09/21/11/1364092111.db2.gz	YDGFGTHCJKKTAW-UHFFFAOYSA-N	0	3	339.867	3.055	20	30		EGEDHN
CC#CCCCC(=O)NCC1CC(NCc2cccc(C(C)C)n2)C1	ZINC001100590939	1364177508	/nfs/dbraw/zinc/17/75/08/1364177508.db2.gz	JUVSOIXZTISISM-UHFFFAOYSA-N	0	3	341.499	3.383	20	30		EGEDHN
O=C(NCC1CC(NCC#Cc2ccccc2)C1)C1CC2(CCC2)C1	ZINC001100591950	1364178122	/nfs/dbraw/zinc/17/81/22/1364178122.db2.gz	YHYBVMNEMBZCEQ-UHFFFAOYSA-N	0	3	336.479	3.103	20	30		EGEDHN
CC1(C)CC(CC(=O)NCC2CC(NCC#Cc3ccccc3)C2)C1	ZINC001100605798	1364186457	/nfs/dbraw/zinc/18/64/57/1364186457.db2.gz	UVMKAFJLTYOPQO-UHFFFAOYSA-N	0	3	338.495	3.349	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)C(C)(C)CCC)C1	ZINC001100625694	1364194945	/nfs/dbraw/zinc/19/49/45/1364194945.db2.gz	SUPHXWAIFMVKCK-UHFFFAOYSA-N	0	3	331.298	3.206	20	30		EGEDHN
C=CCCC1(C(=O)NCC2CC(NCc3ncccc3C)C2)CC1	ZINC001100642658	1364200951	/nfs/dbraw/zinc/20/09/51/1364200951.db2.gz	JFSPNCMRJSURQD-UHFFFAOYSA-N	0	3	327.472	3.121	20	30		EGEDHN
CC1(C)CC[C@@H](C(=O)NCC2CC(NCC#Cc3ccccc3)C2)C1	ZINC001100655663	1364206773	/nfs/dbraw/zinc/20/67/73/1364206773.db2.gz	VCWAVLMQJOZKNF-IOJLRTSASA-N	0	3	338.495	3.349	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@H](C)Cc2ccc(F)cc2)C1	ZINC001101062546	1364397148	/nfs/dbraw/zinc/39/71/48/1364397148.db2.gz	WBPLSUSFHVWBTK-OLJMKKDRSA-N	0	3	338.854	3.241	20	30		EGEDHN
C=CCC1(C(=O)NCC2CC(N[C@@H](C)c3cnccn3)C2)CCCC1	ZINC001101080405	1364403696	/nfs/dbraw/zinc/40/36/96/1364403696.db2.gz	NXMLNLWFBWXGDS-GTPINHCMSA-N	0	3	342.487	3.159	20	30		EGEDHN
C=CCC1(C(=O)NCC2CC(NCc3cnoc3C)C2)CCCC1	ZINC001101080227	1364403997	/nfs/dbraw/zinc/40/39/97/1364403997.db2.gz	FHYKLCVZARDLET-UHFFFAOYSA-N	0	3	331.460	3.104	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@H]2CN(Cc3oc(C)nc3C)C[C@@]2(C)C1	ZINC001101338117	1364516196	/nfs/dbraw/zinc/51/61/96/1364516196.db2.gz	XQDXZICSKICWIK-HLIPFELVSA-N	0	3	345.487	3.174	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@H]2CN(Cc3c(C)noc3C)C[C@@]2(C)C1	ZINC001101337950	1364516781	/nfs/dbraw/zinc/51/67/81/1364516781.db2.gz	RMSJLUPCKINZBU-HLIPFELVSA-N	0	3	345.487	3.174	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)C[C@@H](c3ccccc3)C(C)C)C[C@]2(C)C1	ZINC001101426484	1364558304	/nfs/dbraw/zinc/55/83/04/1364558304.db2.gz	JGINYOZETLKMET-SJBKTWHCSA-N	0	3	338.495	3.230	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C/C=C\c3ccc(C)cc3)C[C@]2(C)C1	ZINC001101496004	1364581653	/nfs/dbraw/zinc/58/16/53/1364581653.db2.gz	AXJDKWHYKWNIJG-ZLESYDNNSA-N	0	3	336.479	3.202	20	30		EGEDHN
C=CCC[C@H](C)N1CC2(C1)C[C@@H](NC(=O)CCC(C)C)c1nccn12	ZINC001101607665	1364652699	/nfs/dbraw/zinc/65/26/99/1364652699.db2.gz	UVDDHAYIVHMOGL-DLBZAZTESA-N	0	3	344.503	3.246	20	30		EGEDHN
C=CCC[C@@H](C)N1CC2(C1)C[C@@H](NC(=O)C(CC)CC)c1nccn12	ZINC001101610108	1364654704	/nfs/dbraw/zinc/65/47/04/1364654704.db2.gz	GUQZPBVYPYKUJK-NVXWUHKLSA-N	0	3	344.503	3.246	20	30		EGEDHN
C=CCC[C@H](C)N1CC2(C1)C[C@H](NC(=O)C(F)=C(C)C)c1nccn12	ZINC001101622860	1364660002	/nfs/dbraw/zinc/66/00/02/1364660002.db2.gz	RQOPBQOJOOUOPL-GJZGRUSLSA-N	0	3	346.450	3.073	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1CC2(CN(CCC(C)(C)C)C2)n2ccnc21	ZINC001101641583	1364667308	/nfs/dbraw/zinc/66/73/08/1364667308.db2.gz	UPRNUZGHYJGXFQ-INIZCTEOSA-N	0	3	344.503	3.248	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccc(Cl)cc2)C[C@H]1CNC(=O)CC1CC1	ZINC001101672612	1364683576	/nfs/dbraw/zinc/68/35/76/1364683576.db2.gz	UZGDWRZQWPZRBT-CRAIPNDOSA-N	0	3	344.886	3.176	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CNC(=O)CCC1CCC1	ZINC001101860433	1364754038	/nfs/dbraw/zinc/75/40/38/1364754038.db2.gz	AGSVQNQJNGTWCW-GDBMZVCRSA-N	0	3	345.512	3.384	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@@H]1CN(Cc2ccc(Cl)cc2)C[C@H]1C	ZINC001101946763	1364786767	/nfs/dbraw/zinc/78/67/67/1364786767.db2.gz	JFZPYJHMTGMWMB-NVXWUHKLSA-N	0	3	332.875	3.184	20	30		EGEDHN
C[C@@H](c1ccc(F)c(F)c1)N1C[C@@H](CNC(=O)C#CC2CC2)[C@H](C)C1	ZINC001101953872	1364788899	/nfs/dbraw/zinc/78/88/99/1364788899.db2.gz	HPVYGFKHQMCYJR-JKIFEVAISA-N	0	3	346.421	3.123	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001102219565	1364940634	/nfs/dbraw/zinc/94/06/34/1364940634.db2.gz	MYCPAVRWSFWQKB-HUUCEWRRSA-N	0	3	345.512	3.406	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1C	ZINC001102226212	1364943712	/nfs/dbraw/zinc/94/37/12/1364943712.db2.gz	GTWGDPUPGLDMAG-RHSMWYFYSA-N	0	3	343.446	3.094	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2ccc(C)s2)C1	ZINC001102641499	1365150079	/nfs/dbraw/zinc/15/00/79/1365150079.db2.gz	MPIFJSCFJPGMEI-BXUZGUMPSA-N	0	3	326.893	3.497	20	30		EGEDHN
CC(C)=CC(=O)NCC[C@@H]1CN(Cc2ccc(C#N)cc2F)C[C@H]1C	ZINC001102647984	1365153877	/nfs/dbraw/zinc/15/38/77/1365153877.db2.gz	LBTBTBQUEGPSMX-NVXWUHKLSA-N	0	3	343.446	3.238	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1CCNC(=O)c1ccoc1	ZINC001102662006	1365160294	/nfs/dbraw/zinc/16/02/94/1365160294.db2.gz	DKVFIHQIEKWEMX-NVXWUHKLSA-N	0	3	337.423	3.039	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](NCc3ccc(F)c(C#N)c3)C2)CCC1	ZINC001185463811	1387722742	/nfs/dbraw/zinc/72/27/42/1387722742.db2.gz	ZJYQHIXMROTORJ-QGZVFWFLSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2occ3c2CCC3)C1	ZINC001103273298	1365465901	/nfs/dbraw/zinc/46/59/01/1365465901.db2.gz	YIEJKWHPFMIYFQ-TZMCWYRMSA-N	0	3	336.863	3.209	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC[C@@H]1CN(Cc2cc(C)no2)C[C@H]1C	ZINC001103307954	1365485359	/nfs/dbraw/zinc/48/53/59/1365485359.db2.gz	NCZGZGGVSSKZSZ-GDBMZVCRSA-N	0	3	333.476	3.160	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NCC[C@@H]1CN(CC(=C)Cl)C[C@H]1C	ZINC001103678523	1365723616	/nfs/dbraw/zinc/72/36/16/1365723616.db2.gz	VZCZYFPWBLSEFV-DNVCBOLYSA-N	0	3	344.886	3.037	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)Cc2ccccc2F)C1	ZINC001103690891	1365730980	/nfs/dbraw/zinc/73/09/80/1365730980.db2.gz	DKUDKNAKRGHZKT-CZUORRHYSA-N	0	3	338.854	3.195	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2ccoc2Cl)C[C@H]1C	ZINC001104127236	1365919599	/nfs/dbraw/zinc/91/95/99/1365919599.db2.gz	XLWTXRKPYJQYIW-ZYHUDNBSSA-N	0	3	331.243	3.373	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)C[C@@H](OCC)C(=C)C)C[C@H]1C	ZINC001104255445	1365969261	/nfs/dbraw/zinc/96/92/61/1365969261.db2.gz	UUMVEJAUYYLCBM-DJIMGWMZSA-N	0	3	342.911	3.184	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)C(C)(C)CC(F)F)C[C@H]1C	ZINC001104279500	1365975729	/nfs/dbraw/zinc/97/57/29/1365975729.db2.gz	BUXSIFRFSSHSIS-DGCLKSJQSA-N	0	3	336.854	3.495	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@H](CCNCc2conc2CC)C1	ZINC001104485740	1366045311	/nfs/dbraw/zinc/04/53/11/1366045311.db2.gz	LLMMDPCEPYKAHC-HZPDHXFCSA-N	0	3	347.503	3.414	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](C)[C@H](CCNCc2c(C)noc2C)C1	ZINC001104563638	1366078839	/nfs/dbraw/zinc/07/88/39/1366078839.db2.gz	POMZOUFSZIFCEH-HDMKZQKVSA-N	0	3	347.503	3.468	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2ccn(CC)c2C)C[C@H]1C	ZINC001104569394	1366081988	/nfs/dbraw/zinc/08/19/88/1366081988.db2.gz	XAMDYKLPGPHJFH-CZUORRHYSA-N	0	3	337.895	3.257	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H](C)[C@H](CCNCc2cnc(C)o2)C1	ZINC001104631381	1366109959	/nfs/dbraw/zinc/10/99/59/1366109959.db2.gz	KSSAGQPHKIYHIT-IDHHARJASA-N	0	3	333.476	3.160	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)/C=C\C(C)(C)C)CC1	ZINC001105391854	1366440074	/nfs/dbraw/zinc/44/00/74/1366440074.db2.gz	NXEKRUHVOGSZKY-XCJXAGMVSA-N	0	3	328.500	3.315	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC([C@@H]2N(C/C=C\Cl)CC23CCC3)CC1	ZINC001105392243	1366440332	/nfs/dbraw/zinc/44/03/32/1366440332.db2.gz	WJYUGRDZYNRHAL-PHPVXXBSSA-N	0	3	348.918	3.491	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](CNCc2cc(C3CC3)no2)[C@H](C)C1	ZINC001106185086	1366617969	/nfs/dbraw/zinc/61/79/69/1366617969.db2.gz	BEVXJDWAPQCVNQ-GDBMZVCRSA-N	0	3	345.487	3.338	20	30		EGEDHN
C=CCCC(=O)NC[C@]12CCC[C@H]1N(Cc1oc(C)nc1C)CC2	ZINC001107326611	1366929094	/nfs/dbraw/zinc/92/90/94/1366929094.db2.gz	BVXRXKHPQCFLTH-IEBWSBKVSA-N	0	3	331.460	3.118	20	30		EGEDHN
C#CCCCCC(=O)NC[C@]12CCC[C@H]1N(Cc1conc1C)CC2	ZINC001107371817	1366945638	/nfs/dbraw/zinc/94/56/38/1366945638.db2.gz	CPHOTSNSFNPACF-UYAOXDASSA-N	0	3	343.471	3.037	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@]12CCC[C@H]1N(Cc1cnc(C)o1)CC2	ZINC001107514864	1367012794	/nfs/dbraw/zinc/01/27/94/1367012794.db2.gz	AAAPHLNGLJYCCS-ILZDJORESA-N	0	3	345.487	3.446	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCN(C(=O)/C=C\C(C)(C)C)C1	ZINC001189437746	1367021416	/nfs/dbraw/zinc/02/14/16/1367021416.db2.gz	HWTZHOKCZOCGEK-FYGXRCCRSA-N	0	3	325.456	3.193	20	30		EGEDHN
CCC[C@H](C(=O)NC[C@]12CCC[C@H]1N(CC#CCOC)CC2)C(C)C	ZINC001107564268	1367045529	/nfs/dbraw/zinc/04/55/29/1367045529.db2.gz	OYZLFTWRBHBDBV-QKNQBKEWSA-N	0	3	348.531	3.069	20	30		EGEDHN
CCC[C@@H](C(=O)NC[C@]12CCC[C@H]1N(CC#CCOC)CC2)C(C)C	ZINC001107564269	1367046092	/nfs/dbraw/zinc/04/60/92/1367046092.db2.gz	OYZLFTWRBHBDBV-SFHLNBCPSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccccc1)OCC	ZINC001109357733	1367085794	/nfs/dbraw/zinc/08/57/94/1367085794.db2.gz	WMCYHWHOBZFFCK-FUMNGEBKSA-N	0	3	342.483	3.279	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCOc1cc(C)cc(C)c1)C2	ZINC001109373634	1367092323	/nfs/dbraw/zinc/09/23/23/1367092323.db2.gz	NOTGLKRHAINLOZ-HOJAQTOUSA-N	0	3	342.483	3.370	20	30		EGEDHN
CC[C@H](C)CC(=O)N1CC[C@H](N(C)Cc2ccc(OCC#N)cc2)C1	ZINC001189855634	1367119407	/nfs/dbraw/zinc/11/94/07/1367119407.db2.gz	BBPMLCWUOLPXJR-WMZOPIPTSA-N	0	3	343.471	3.058	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](N(C)CCOc2cccc(Cl)c2)C1	ZINC001189926983	1367134182	/nfs/dbraw/zinc/13/41/82/1367134182.db2.gz	VJOBUCKJIMZNJT-QGZVFWFLSA-N	0	3	348.874	3.055	20	30		EGEDHN
CCCC[C@@H](C)C(=O)N1CC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001189974262	1367144308	/nfs/dbraw/zinc/14/43/08/1367144308.db2.gz	VGRIJHNIEKVQFC-APWZRJJASA-N	0	3	327.472	3.417	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)CCCC3CCCCC3)[C@@H]2C1	ZINC001190059139	1367163144	/nfs/dbraw/zinc/16/31/44/1367163144.db2.gz	OYEUARWDWDAVDD-VQTJNVASSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@]1(C)CN(CC2CCC(C)CC2)CCO1	ZINC001107976594	1367226372	/nfs/dbraw/zinc/22/63/72/1367226372.db2.gz	QATWTMXBCDZZOE-AFMYVXGZSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](N(C)C[C@@H]2CC(C)(C)CO2)C1	ZINC001190353644	1367235480	/nfs/dbraw/zinc/23/54/80/1367235480.db2.gz	BBHAEANLQJCMSE-ROUUACIJSA-N	0	3	334.504	3.103	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)[C@H](CCCC)C(C)C)[C@@H]2C1	ZINC001190394103	1367250624	/nfs/dbraw/zinc/25/06/24/1367250624.db2.gz	GTVHBCDRJMFPON-IPMKNSEASA-N	0	3	336.520	3.184	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@]1(C)CN(CC2CCC(C)CC2)CCO1	ZINC001108119511	1367291427	/nfs/dbraw/zinc/29/14/27/1367291427.db2.gz	OJHVIBZLDMEAAZ-LBXVMSDZSA-N	0	3	336.520	3.232	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCc1cc(Cl)cs1)C2	ZINC001109769451	1367311914	/nfs/dbraw/zinc/31/19/14/1367311914.db2.gz	DCCBYFKDYDCNQF-KBMXLJTQSA-N	0	3	336.888	3.079	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](C)Cc1ccccc1Cl)C2	ZINC001109778745	1367316966	/nfs/dbraw/zinc/31/69/66/1367316966.db2.gz	UHCWURRAHLNVFH-FXECBMLZSA-N	0	3	344.886	3.263	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1sc(C)cc1OC)C2	ZINC001109797176	1367327587	/nfs/dbraw/zinc/32/75/87/1367327587.db2.gz	XWLDGFMRWRGIMA-ILXRZTDVSA-N	0	3	334.485	3.366	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)C2(CC=C)CCC2)C1	ZINC001108187984	1367331162	/nfs/dbraw/zinc/33/11/62/1367331162.db2.gz	PIGVXCUVBFOUIB-PKOBYXMFSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CC1(CC(=O)N[C@H]2C[C@H]3CC[C@@H]2N3[C@@H](C)COC)CCCCC1	ZINC001109830387	1367344455	/nfs/dbraw/zinc/34/44/55/1367344455.db2.gz	XQJODXJXOOCHJH-MHORFTMASA-N	0	3	334.504	3.269	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)C2(F)CCCCC2)C1	ZINC001108322627	1367390099	/nfs/dbraw/zinc/39/00/99/1367390099.db2.gz	AGAWDXRPOKLQSS-SJLPKXTDSA-N	0	3	340.483	3.221	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2oc(CC)cc2C)C1	ZINC001108344270	1367401691	/nfs/dbraw/zinc/40/16/91/1367401691.db2.gz	KSBPPANCICUKIX-OXQOHEQNSA-N	0	3	348.487	3.326	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@@H](CC)C(C)(C)C)C2	ZINC001109970077	1367435637	/nfs/dbraw/zinc/43/56/37/1367435637.db2.gz	MZLXXVHIKISYPC-BDXSIMOUSA-N	0	3	336.520	3.373	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](C)CCC(C)(C)C)C2	ZINC001109981019	1367442244	/nfs/dbraw/zinc/44/22/44/1367442244.db2.gz	KUSNDAGOKRJLGB-BDXSIMOUSA-N	0	3	336.520	3.373	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2ccc(CF)cc2)C1	ZINC001108429001	1367453466	/nfs/dbraw/zinc/45/34/66/1367453466.db2.gz	DURMYMNQFWBQTN-OXJNMPFZSA-N	0	3	348.462	3.332	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3CCC[C@H](C)O)CCCC1	ZINC001110214654	1367568479	/nfs/dbraw/zinc/56/84/79/1367568479.db2.gz	PHVSHLJZWAKMBW-MHORFTMASA-N	0	3	334.504	3.005	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](N(C)CCc2csc(C)n2)C1	ZINC001191755334	1367578022	/nfs/dbraw/zinc/57/80/22/1367578022.db2.gz	WLSWJFVIMZJTNF-GOSISDBHSA-N	0	3	347.528	3.110	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](N(C)Cc2cccc(F)c2)C1	ZINC001191754572	1367578229	/nfs/dbraw/zinc/57/82/29/1367578229.db2.gz	QRWBOMAHRAAJCC-IBGZPJMESA-N	0	3	330.447	3.442	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H](N(C)Cc2ccccc2N(C)C)C1	ZINC001191868089	1367619964	/nfs/dbraw/zinc/61/99/64/1367619964.db2.gz	NVPABBOUQDPMGC-PKOBYXMFSA-N	0	3	343.515	3.388	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H](N(C)Cc2cccc(OC)c2)C1	ZINC001191867716	1367620779	/nfs/dbraw/zinc/62/07/79/1367620779.db2.gz	HFCRNEJHAWTLQA-AEFFLSMTSA-N	0	3	330.472	3.330	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](N(C)CCOc2ccccc2C)C1	ZINC001191868415	1367622673	/nfs/dbraw/zinc/62/26/73/1367622673.db2.gz	SXPYFRXCYJJLAQ-LJQANCHMSA-N	0	3	342.483	3.100	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@@H](N(C)CCOc2ccccc2F)C1	ZINC001191889748	1367626932	/nfs/dbraw/zinc/62/69/32/1367626932.db2.gz	JRZHOLKQGTXOHQ-IAGOWNOFSA-N	0	3	348.462	3.340	20	30		EGEDHN
CC[C@@H](c1ccccc1)N1[C@@H]2CC[C@H]1[C@@H](NC(=O)CSCC#N)C2	ZINC001108951665	1367680478	/nfs/dbraw/zinc/68/04/78/1367680478.db2.gz	DBPQFIRNMBMQRM-OWSLCNJRSA-N	0	3	343.496	3.116	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](N(C)CCOc2ccccc2C)C1	ZINC001192093767	1367686542	/nfs/dbraw/zinc/68/65/42/1367686542.db2.gz	MNGSALNXWMKNLE-SFHVURJKSA-N	0	3	330.472	3.263	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1cccc(OC)c1C	ZINC001110494861	1367782404	/nfs/dbraw/zinc/78/24/04/1367782404.db2.gz	ZXDQHKOLPMDTFD-QRVBRYPASA-N	0	3	340.467	3.029	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCCc1ccsc1	ZINC001110544106	1367822386	/nfs/dbraw/zinc/82/23/86/1367822386.db2.gz	WSFXOUNDOGMXAY-KURKYZTESA-N	0	3	344.524	3.452	20	30		EGEDHN
CCC(CC)CC(=O)N1CC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001193087487	1367941173	/nfs/dbraw/zinc/94/11/73/1367941173.db2.gz	CNOYESWNJCNFJM-LJQANCHMSA-N	0	3	327.472	3.417	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)[C@H](F)CCCCCC)C1	ZINC001193479401	1368042980	/nfs/dbraw/zinc/04/29/80/1368042980.db2.gz	VAGUDRBTLWBUIH-IAGOWNOFSA-N	0	3	328.472	3.030	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)C(C)(C)c2ccc(C)cc2)C1	ZINC001193531546	1368055468	/nfs/dbraw/zinc/05/54/68/1368055468.db2.gz	CGPXEJNYRVCBLG-LJQANCHMSA-N	0	3	344.499	3.008	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC001193651741	1368084736	/nfs/dbraw/zinc/08/47/36/1368084736.db2.gz	LLIFLIUUMJNCTK-IBGZPJMESA-N	0	3	344.499	3.333	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3CCCOC(C)C)CC1	ZINC001110982040	1368132911	/nfs/dbraw/zinc/13/29/11/1368132911.db2.gz	FBRIFKTTWACMBO-QRVBRYPASA-N	0	3	334.504	3.269	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C1(Cc3ccccc3F)CC1)C2	ZINC001111122297	1368161828	/nfs/dbraw/zinc/16/18/28/1368161828.db2.gz	CNMGEFPGSWJMEH-QRQLOZEOSA-N	0	3	342.458	3.446	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@@H]2CCC=CCCC2)C1	ZINC001194033112	1368171246	/nfs/dbraw/zinc/17/12/46/1368171246.db2.gz	WXVHDQCEZRUTJB-GUDVDZBRSA-N	0	3	334.504	3.031	20	30		EGEDHN
C=CCC[C@H](C)N1[C@@H]2CC[C@H]1[C@H](NC(=O)c1snnc1C(C)C)C2	ZINC001111175317	1368180402	/nfs/dbraw/zinc/18/04/02/1368180402.db2.gz	YMUKJBBRMUXBBD-YJNKXOJESA-N	0	3	348.516	3.351	20	30		EGEDHN
CCCCCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1conc1COC)C2	ZINC001111270432	1368237079	/nfs/dbraw/zinc/23/70/79/1368237079.db2.gz	RBTWCHFETNMLGO-KYJSFNMBSA-N	0	3	349.475	3.127	20	30		EGEDHN
C=CCCOCC(=O)N1CC[C@H](N(C)[C@@H](C)c2ccc(F)cc2)C1	ZINC001194396594	1368252233	/nfs/dbraw/zinc/25/22/33/1368252233.db2.gz	GDFIMSIAAPOYOW-YJBOKZPZSA-N	0	3	334.435	3.012	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)C/C=C\c2ccc(C)cc2)C1	ZINC001194590036	1368292636	/nfs/dbraw/zinc/29/26/36/1368292636.db2.gz	CZPNXTKVPHWIKJ-KKHYBRAUSA-N	0	3	342.483	3.134	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCc1cc(F)ccc1F)C2	ZINC001111462287	1368311770	/nfs/dbraw/zinc/31/17/70/1368311770.db2.gz	PMIZQZXZHCJKNH-NXHRZFHOSA-N	0	3	334.410	3.195	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1c(C)cccc1C	ZINC001111489870	1368319427	/nfs/dbraw/zinc/31/94/27/1368319427.db2.gz	NEJCDOHQOKWDAW-LFGUQSLTSA-N	0	3	342.483	3.116	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](CCC=C)c1ccccc1)C2	ZINC001111522410	1368324834	/nfs/dbraw/zinc/32/48/34/1368324834.db2.gz	DEDBPQNORNJTTK-NCYKPQTJSA-N	0	3	336.479	3.481	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](CCC=C)c1ccccc1)C2	ZINC001111522409	1368325312	/nfs/dbraw/zinc/32/53/12/1368325312.db2.gz	DEDBPQNORNJTTK-MHTWAQMVSA-N	0	3	336.479	3.481	20	30		EGEDHN
C=CCCC(=O)N1Cc2ccccc2OC2(CCN(CC)CC2)C1	ZINC001111529778	1368329702	/nfs/dbraw/zinc/32/97/02/1368329702.db2.gz	PVIMKUIDFSACFB-UHFFFAOYSA-N	0	3	328.456	3.228	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@](C)(CC)CCC)C[C@@H](C)O2	ZINC001111551202	1368342798	/nfs/dbraw/zinc/34/27/98/1368342798.db2.gz	UGVVNRIGMYXUPX-IEBWSBKVSA-N	0	3	336.520	3.471	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@]12CCC[C@H]1CN(CCc1ccccc1Cl)C2	ZINC001111668210	1368416431	/nfs/dbraw/zinc/41/64/31/1368416431.db2.gz	CUIXSFIZXJLJHT-ALKREAHSSA-N	0	3	345.874	3.013	20	30		EGEDHN
CC(C)C#CC(=O)N1CCCN(C[C@@H]2CCCC(F)(F)C2)CC1	ZINC001195775365	1368487559	/nfs/dbraw/zinc/48/75/59/1368487559.db2.gz	YAGAMGLARROLAK-MRXNPFEDSA-N	0	3	326.431	3.006	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2csc([C@@H]3CCCO3)n2)CC1	ZINC001195865163	1368506214	/nfs/dbraw/zinc/50/62/14/1368506214.db2.gz	IQSXXUACFQFQKL-INIZCTEOSA-N	0	3	349.500	3.109	20	30		EGEDHN
C=C(C)CCC(=O)N1CCCN(CCCOc2ccc(F)cc2)CC1	ZINC001196009599	1368534334	/nfs/dbraw/zinc/53/43/34/1368534334.db2.gz	BENLPBZPHKCZID-UHFFFAOYSA-N	0	3	348.462	3.485	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2ocnc2-c2ccccc2)CC1	ZINC001196092935	1368547643	/nfs/dbraw/zinc/54/76/43/1368547643.db2.gz	QAAYWQWIRDQTQJ-UHFFFAOYSA-N	0	3	339.439	3.456	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cncc(COC)c2)CC1	ZINC001196185074	1368564668	/nfs/dbraw/zinc/56/46/68/1368564668.db2.gz	MVBKYUKDRCHTGP-UHFFFAOYSA-N	0	3	345.487	3.122	20	30		EGEDHN
C#CCCN1CCCN(C(=O)CCCc2ccc(Cl)cc2)CC1	ZINC001196409885	1368608935	/nfs/dbraw/zinc/60/89/35/1368608935.db2.gz	ZCVRIGGXEKNAHT-UHFFFAOYSA-N	0	3	332.875	3.220	20	30		EGEDHN
C=CCCN1C[C@@H](O)[C@H](NC(=O)[C@H](CCC)CC2CCCCC2)C1	ZINC001196637815	1368653881	/nfs/dbraw/zinc/65/38/81/1368653881.db2.gz	MWFPLPYEBWIFSD-GUDVDZBRSA-N	0	3	336.520	3.111	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2cc3c(C)nn(C)c3s2)CC1	ZINC001196698968	1368666524	/nfs/dbraw/zinc/66/65/24/1368666524.db2.gz	YXRJRQBJRIJBKO-UHFFFAOYSA-N	0	3	346.500	3.057	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)CC2CCCCCC2)C[C@H]1C(F)(F)F	ZINC001112171562	1368699728	/nfs/dbraw/zinc/69/97/28/1368699728.db2.gz	OIXPWBMXSIEVGQ-HZPDHXFCSA-N	0	3	344.421	3.349	20	30		EGEDHN
C=CC1(CC(=O)N[C@@H]2CN(CC/C=C\CC)C[C@H]2O)CCCCC1	ZINC001196860441	1368702060	/nfs/dbraw/zinc/70/20/60/1368702060.db2.gz	GYHZVYYYSTXZOH-OSFIAYCASA-N	0	3	334.504	3.031	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2cc(F)c(F)cc2F)CC1	ZINC001196953417	1368719524	/nfs/dbraw/zinc/71/95/24/1368719524.db2.gz	OWFDBQSWRNVOPF-UHFFFAOYSA-N	0	3	326.362	3.218	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)CCCCC(C)C)C1	ZINC001197066992	1368738104	/nfs/dbraw/zinc/73/81/04/1368738104.db2.gz	LUJIINYHEPOPCD-QZTJIDSGSA-N	0	3	326.525	3.335	20	30		EGEDHN
C#Cc1cncc(C(=O)N2CCCN(CCCCCCC)CC2)c1	ZINC001197118339	1368748070	/nfs/dbraw/zinc/74/80/70/1368748070.db2.gz	JFWSALPSNHHIIU-UHFFFAOYSA-N	0	3	327.472	3.181	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cc(C)nn2CC)CC1	ZINC001197236298	1368769176	/nfs/dbraw/zinc/76/91/76/1368769176.db2.gz	HKRNZIYMJJGDKF-UHFFFAOYSA-N	0	3	334.508	3.330	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2ccn(C(CC)CC)n2)CC1	ZINC001197330911	1368789348	/nfs/dbraw/zinc/78/93/48/1368789348.db2.gz	FIATVJIEZFFAJW-UHFFFAOYSA-N	0	3	332.492	3.358	20	30		EGEDHN
C#CCCN1CCCN(C(=O)[C@@H](CC(C)C)c2ccccc2)CC1	ZINC001197378743	1368801877	/nfs/dbraw/zinc/80/18/77/1368801877.db2.gz	DQVJBDNWBKYJGX-FQEVSTJZSA-N	0	3	326.484	3.374	20	30		EGEDHN
C#CCCN1CCCN(C(=O)C[C@@H](c2ccccc2)C(C)C)CC1	ZINC001197795239	1368899620	/nfs/dbraw/zinc/89/96/20/1368899620.db2.gz	UXNYDFYABYJCIH-HXUWFJFHSA-N	0	3	326.484	3.374	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2cnc(C)o2)C1	ZINC001112537541	1368919198	/nfs/dbraw/zinc/91/91/98/1368919198.db2.gz	LJMQKKHGXJUWEN-JXFKEZNVSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cn(C)nc2C(C)C)CC1	ZINC001198092516	1368958395	/nfs/dbraw/zinc/95/83/95/1368958395.db2.gz	PUXKBTSJHDFGDK-UHFFFAOYSA-N	0	3	346.519	3.438	20	30		EGEDHN
O=C(CC#Cc1ccccc1)N1CCCN(CCc2ccccc2)CC1	ZINC001198197371	1368978814	/nfs/dbraw/zinc/97/88/14/1368978814.db2.gz	LXWZBFSPPOMLCN-UHFFFAOYSA-N	0	3	346.474	3.205	20	30		EGEDHN
C#CC[C@H](CC(=O)N1CCCN(CC[C@@H](C)F)CC1)c1ccccc1	ZINC001198394418	1369022547	/nfs/dbraw/zinc/02/25/47/1369022547.db2.gz	IWKWUXDTZKEYJL-UYAOXDASSA-N	0	3	344.474	3.466	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N2CCN(CC(CC)CC)CC2)cc1	ZINC001112842983	1369041328	/nfs/dbraw/zinc/04/13/28/1369041328.db2.gz	IBPWGPAIBZIIIZ-UHFFFAOYSA-N	0	3	342.483	3.283	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)c1cc(C)on1)c1ccccc1OC	ZINC001198515010	1369049941	/nfs/dbraw/zinc/04/99/41/1369049941.db2.gz	JDEYDYUILZCYJO-QGZVFWFLSA-N	0	3	343.427	3.019	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)c1ccc(C)nc1)c1ccccc1OC	ZINC001198529484	1369053698	/nfs/dbraw/zinc/05/36/98/1369053698.db2.gz	FSNSPSWWRXDMFF-GOSISDBHSA-N	0	3	339.439	3.035	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)c1ccc(C)nc1)c1ccccc1OC	ZINC001198529485	1369054194	/nfs/dbraw/zinc/05/41/94/1369054194.db2.gz	FSNSPSWWRXDMFF-SFHVURJKSA-N	0	3	339.439	3.035	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@H](C)OCC(C)C)c1ccccc1OC	ZINC001198577354	1369064548	/nfs/dbraw/zinc/06/45/48/1369064548.db2.gz	IXYSNYPOZZGOAS-FUHWJXTLSA-N	0	3	348.487	3.079	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)/C=C(\C)C1CC1)c1ccccc1OC	ZINC001198578004	1369064956	/nfs/dbraw/zinc/06/49/56/1369064956.db2.gz	MOCQXQAVBXGKLS-DUVHGLKDSA-N	0	3	328.456	3.375	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)/C=C/C1CC1)c1ccccc1OC	ZINC001198635272	1369078396	/nfs/dbraw/zinc/07/83/96/1369078396.db2.gz	DTDBUVKDBCAXNS-DOJUMQAQSA-N	0	3	328.456	3.375	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)[C@H]1CC1(F)F)c1ccccc1OC	ZINC001198712980	1369097131	/nfs/dbraw/zinc/09/71/31/1369097131.db2.gz	JLVWJZHBUUYRGD-CABCVRRESA-N	0	3	338.398	3.064	20	30		EGEDHN
C=CCC[C@@H](C)N[C@H](CNC(=O)c1cc[nH]c1)c1ccccc1OC	ZINC001198743444	1369103947	/nfs/dbraw/zinc/10/39/47/1369103947.db2.gz	ZLZROPSTMNSCEN-CRAIPNDOSA-N	0	3	341.455	3.439	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)c1ccsn1)c1ccccc1OC	ZINC001198766659	1369108611	/nfs/dbraw/zinc/10/86/11/1369108611.db2.gz	FRWIKHAPSLLAGK-MRXNPFEDSA-N	0	3	345.468	3.179	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)Cc1ccccc1)c1ccccc1OC	ZINC001198777341	1369111830	/nfs/dbraw/zinc/11/18/30/1369111830.db2.gz	YOLKQFSDYMPBQI-IBGZPJMESA-N	0	3	338.451	3.261	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@]12C[C@H]1CCC2)c1ccccc1OC	ZINC001198805630	1369118437	/nfs/dbraw/zinc/11/84/37/1369118437.db2.gz	DJNNVLDKBOIRLF-WRWLIDTKSA-N	0	3	328.456	3.208	20	30		EGEDHN
CC#CCCCC(=O)NC[C@H](NCC[C@@H](C)F)c1ccccc1OC	ZINC001198854863	1369129443	/nfs/dbraw/zinc/12/94/43/1369129443.db2.gz	ANHANKDLGBYLBW-AEFFLSMTSA-N	0	3	348.462	3.384	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)[C@H]1C[C@H]2C[C@H]2C1)c1ccccc1OC	ZINC001198857579	1369132365	/nfs/dbraw/zinc/13/23/65/1369132365.db2.gz	RPXXWCHYLGEWHZ-FAJBIJEISA-N	0	3	342.483	3.454	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)[C@@H]1CC12CC2)c1ccccc1OC	ZINC001198916864	1369148380	/nfs/dbraw/zinc/14/83/80/1369148380.db2.gz	VPUJBXIVVCMNEA-IRXDYDNUSA-N	0	3	328.456	3.208	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@H]1CC12CCC2)c1ccccc1OC	ZINC001198925849	1369151383	/nfs/dbraw/zinc/15/13/83/1369151383.db2.gz	YQIYSYNTTQSZNZ-IAGOWNOFSA-N	0	3	328.456	3.208	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@H]2CCCC(C)(C)C2)C1	ZINC001199210254	1369191307	/nfs/dbraw/zinc/19/13/07/1369191307.db2.gz	DZYOZSPVJLFUSS-RCCFBDPRSA-N	0	3	338.536	3.335	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)[C@H]2CCc3cc(F)ccc32)CC1	ZINC001113111387	1369209963	/nfs/dbraw/zinc/20/99/63/1369209963.db2.gz	VRKPIQAQJSIYGW-BEFAXECRSA-N	0	3	330.447	3.354	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)CCc2ccc(F)cc2F)CC1	ZINC001113486798	1369461805	/nfs/dbraw/zinc/46/18/05/1369461805.db2.gz	CCIRTPGTUFGOLB-OAHLLOKOSA-N	0	3	336.426	3.396	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCCO[C@H](CNCc2ccsc2)C1	ZINC001201233180	1369501584	/nfs/dbraw/zinc/50/15/84/1369501584.db2.gz	LZUQMOLHBNFUND-NVXWUHKLSA-N	0	3	336.501	3.058	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)C[C@H]2OCc3ccccc32)CC1	ZINC001113591939	1369505162	/nfs/dbraw/zinc/50/51/62/1369505162.db2.gz	SGQADCLRQSHGAY-QFBILLFUSA-N	0	3	328.456	3.147	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)CCc2nc3ccccc3o2)CC1	ZINC001113623661	1369526061	/nfs/dbraw/zinc/52/60/61/1369526061.db2.gz	WPTHKUVFDCXDKA-MRXNPFEDSA-N	0	3	341.455	3.259	20	30		EGEDHN
CC#CCNC[C@@H]1CN(C(=O)[C@H](CC2CCCC2)C(C)C)CCCO1	ZINC001201548459	1369572819	/nfs/dbraw/zinc/57/28/19/1369572819.db2.gz	XKNSPEPYOFHLOY-WOJBJXKFSA-N	0	3	348.531	3.069	20	30		EGEDHN
CN1CCN(c2cc(Nc3cc(C#N)cn3C(C)(C)C)ccn2)CC1	ZINC001201650889	1369596945	/nfs/dbraw/zinc/59/69/45/1369596945.db2.gz	HNIHGYJOOZONBX-UHFFFAOYSA-N	0	3	338.459	3.005	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)N1CCC(NCc2ccncc2Cl)CC1	ZINC001202092784	1369686665	/nfs/dbraw/zinc/68/66/65/1369686665.db2.gz	RHHOCOSVJANOAZ-KBPBESRZSA-N	0	3	335.879	3.274	20	30		EGEDHN
C#CCNC[C@@H]1CN(C(=O)CC2CCC(C(C)(C)C)CC2)CCCO1	ZINC001202164405	1369705036	/nfs/dbraw/zinc/70/50/36/1369705036.db2.gz	LYHUIXIKMSHSRV-CTWPCTMYSA-N	0	3	348.531	3.069	20	30		EGEDHN
CCCCC(=O)N[C@@H]1C[C@H](NCc2ccc(C#N)cc2F)C12CCC2	ZINC001202489403	1369788638	/nfs/dbraw/zinc/78/86/38/1369788638.db2.gz	KYKXZRDVCYBLAJ-ZWKOTPCHSA-N	0	3	343.446	3.405	20	30		EGEDHN
CCCCC(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C12CCC2	ZINC001202491748	1369789304	/nfs/dbraw/zinc/78/93/04/1369789304.db2.gz	WKDFGKBEAXCIKG-MSOLQXFVSA-N	0	3	343.446	3.405	20	30		EGEDHN
C/C(=C\C(=O)N[C@@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2)C1CC1	ZINC001202573445	1369809578	/nfs/dbraw/zinc/80/95/78/1369809578.db2.gz	LYNTWDJFXCPEJO-SOZVNFAGSA-N	0	3	348.490	3.411	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1[C@H]2CN([C@H]3CCc4c3c(F)ccc4F)C[C@H]21	ZINC001114348859	1369905612	/nfs/dbraw/zinc/90/56/12/1369905612.db2.gz	RSLGYADXKMPTBL-AMVBQIFNSA-N	0	3	346.421	3.355	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1C[C@H](NCc2nc(C)c(C)s2)C12CCC2	ZINC001202844804	1369905704	/nfs/dbraw/zinc/90/57/04/1369905704.db2.gz	AAXXEUWFZMLMSX-JKSUJKDBSA-N	0	3	345.512	3.080	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H]1C[C@H](NCc2cccc(F)c2F)C12CCC2	ZINC001202868115	1369912643	/nfs/dbraw/zinc/91/26/43/1369912643.db2.gz	VSVZLNYJOYGIMR-IRXDYDNUSA-N	0	3	346.421	3.141	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1C[C@H](NCc2c(C)noc2C)C12CCC2	ZINC001202960243	1369937216	/nfs/dbraw/zinc/93/72/16/1369937216.db2.gz	LNXSTOLBDVIAIQ-DLBZAZTESA-N	0	3	345.487	3.411	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202988344	1369947216	/nfs/dbraw/zinc/94/72/16/1369947216.db2.gz	SABRDDMJLUKARK-PMACEKPBSA-N	0	3	336.479	3.411	20	30		EGEDHN
CCCN1CCc2c(N)sc(Nc3cnc(C#N)c(F)c3)c2C1	ZINC001203056147	1369968830	/nfs/dbraw/zinc/96/88/30/1369968830.db2.gz	ZAHJQVVIRLIKOB-UHFFFAOYSA-N	0	3	331.420	3.248	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1[C@H]2CN(CC[C@@H]3CC3(Cl)Cl)C[C@H]21	ZINC001114680256	1370021985	/nfs/dbraw/zinc/02/19/85/1370021985.db2.gz	GBBHVOSPWDSDDX-MQYQWHSLSA-N	0	3	345.314	3.219	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CCN(Cc3cc(CC)no3)CC2)CC1	ZINC001203211787	1370026183	/nfs/dbraw/zinc/02/61/83/1370026183.db2.gz	HZXIVRZODFWPGK-UHFFFAOYSA-N	0	3	347.459	3.238	20	30		EGEDHN
C=CCOC(=O)N1CCCC2(CCN(Cc3cccn3C)CC2)C1	ZINC001203254430	1370042459	/nfs/dbraw/zinc/04/24/59/1370042459.db2.gz	YYNMYBFMFVYVEE-UHFFFAOYSA-N	0	3	331.460	3.026	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C)c(OC)c3)C[C@H]21	ZINC001114729503	1370051602	/nfs/dbraw/zinc/05/16/02/1370051602.db2.gz	SQIVLWJEOCJHFH-DZKDUJFISA-N	0	3	342.483	3.152	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1C[C@@H](NCc2c(C)onc2CC)C12CCC2	ZINC001203272564	1370053506	/nfs/dbraw/zinc/05/35/06/1370053506.db2.gz	DLVPQEDEVPPCLY-IAGOWNOFSA-N	0	3	345.487	3.275	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1C[C@H](NCc2c(C)noc2C)C12CCC2	ZINC001203272073	1370053534	/nfs/dbraw/zinc/05/35/34/1370053534.db2.gz	ASMGRLPGTONRPY-JKSUJKDBSA-N	0	3	331.460	3.021	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1[C@H]2CN(CCc3ccccc3F)C[C@H]21	ZINC001114791659	1370082986	/nfs/dbraw/zinc/08/29/86/1370082986.db2.gz	INABQQFSIJZFQC-QXOCSCLMSA-N	0	3	330.447	3.017	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(CF)cc3)C[C@H]21	ZINC001114792727	1370083540	/nfs/dbraw/zinc/08/35/40/1370083540.db2.gz	WGXHZBPDKMCPLZ-DOADOZAASA-N	0	3	330.447	3.305	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1[C@H]2CN(CCc3ccc(F)c(F)c3)C[C@H]21	ZINC001114792295	1370083585	/nfs/dbraw/zinc/08/35/85/1370083585.db2.gz	QXJKEFKAZJHTGD-JBZZYGANSA-N	0	3	348.437	3.156	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1C[C@@H](NCc2ncccc2C)C12CCC2	ZINC001203341606	1370089886	/nfs/dbraw/zinc/08/98/86/1370089886.db2.gz	RWPARMSOAYMRJH-MSOLQXFVSA-N	0	3	327.472	3.263	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C2(CC)CC2)C12CCC2	ZINC001203359474	1370097620	/nfs/dbraw/zinc/09/76/20/1370097620.db2.gz	SPKVBFCIFUEOSQ-STQMWFEESA-N	0	3	341.293	3.102	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2C[C@H](NCc3cnoc3C)C23CCC3)CC1	ZINC001203372424	1370102758	/nfs/dbraw/zinc/10/27/58/1370102758.db2.gz	FAUACKVFXJUWOY-DLBZAZTESA-N	0	3	343.471	3.246	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1C[C@H](NCc2ccns2)C12CCC2	ZINC001203453505	1370132001	/nfs/dbraw/zinc/13/20/01/1370132001.db2.gz	SPQUODUKFBXYPI-LSDHHAIUSA-N	0	3	333.501	3.262	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)COc2ccc(C)cc2)C12CCC2	ZINC001203695095	1370223942	/nfs/dbraw/zinc/22/39/42/1370223942.db2.gz	PFHOJINCWNKLKW-IAGOWNOFSA-N	0	3	348.874	3.143	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CN2Cc3ccccc3C3(CCC3)C2)cc1	ZINC001325873751	1388059777	/nfs/dbraw/zinc/05/97/77/1388059777.db2.gz	IIKBEJURVQQNJQ-IBGZPJMESA-N	0	3	348.446	3.235	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@]3(CC(=O)N(c4cccc(F)c4)C3)C2)c1	ZINC001203760582	1370253127	/nfs/dbraw/zinc/25/31/27/1370253127.db2.gz	MGJJEDFEDVSUGA-OAQYLSRUSA-N	0	3	349.409	3.326	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@]3(CC(=O)N(c4ccsc4)C3)C2)c1	ZINC001203762191	1370254989	/nfs/dbraw/zinc/25/49/89/1370254989.db2.gz	MWBFYDBGRAUGJT-LJQANCHMSA-N	0	3	337.448	3.249	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CCN(Cc3cccc(F)c3)C2)C1	ZINC001203784063	1370262393	/nfs/dbraw/zinc/26/23/93/1370262393.db2.gz	BZUSBDUYSWHECX-IBGZPJMESA-N	0	3	332.419	3.436	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(C[C@@H](OCC4CC4)CO3)CC2)cc1	ZINC001203903571	1370307637	/nfs/dbraw/zinc/30/76/37/1370307637.db2.gz	XIKMSGWYRKNYJK-LJQANCHMSA-N	0	3	326.440	3.108	20	30		EGEDHN
O=C1C=C2CN(Cc3cc(Br)cs3)CCC2S1	ZINC001204026384	1370351471	/nfs/dbraw/zinc/35/14/71/1370351471.db2.gz	HVPYNBQWPYWDGV-NSHDSACASA-N	0	3	330.272	3.285	20	30		EGEDHN
CC[C@H](CC(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C1)C(C)C	ZINC001187207849	1388071478	/nfs/dbraw/zinc/07/14/78/1388071478.db2.gz	IOGTVUDPCZEDMB-HUUCEWRRSA-N	0	3	333.501	3.383	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)C2CCCC2)CCCCC1	ZINC001115377079	1370416098	/nfs/dbraw/zinc/41/60/98/1370416098.db2.gz	ANGPMTUOXGLSIA-UHFFFAOYSA-N	0	3	343.309	3.494	20	30		EGEDHN
Cc1ccc(O[C@@H]2C[C@H]3CN(Cc4ccccc4C#N)CCN3C2)cc1	ZINC001204369813	1370456171	/nfs/dbraw/zinc/45/61/71/1370456171.db2.gz	DMRIGQUTCAGEGG-RBBKRZOGSA-N	0	3	347.462	3.204	20	30		EGEDHN
Cc1ccc(F)c(CNC2(CNC(=O)[C@@H](C)C#N)CCCCC2)c1	ZINC001115453704	1370461321	/nfs/dbraw/zinc/46/13/21/1370461321.db2.gz	YVHNAKPRTRHDAK-HNNXBMFYSA-N	0	3	331.435	3.203	20	30		EGEDHN
O=C1C=C2CN(Cc3cc(Br)ccc3F)CCC2S1	ZINC001204496171	1370492894	/nfs/dbraw/zinc/49/28/94/1370492894.db2.gz	JAEAGAZJSMRDNA-ZDUSSCGKSA-N	0	3	342.233	3.362	20	30		EGEDHN
C#CCCCC(=O)NCC1(NCc2c(C)onc2CC)CCCCC1	ZINC001115507287	1370507073	/nfs/dbraw/zinc/50/70/73/1370507073.db2.gz	JUMJLHQZXAQULB-UHFFFAOYSA-N	0	3	345.487	3.258	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)NCC1(NCc2ccccc2F)CCCCC1	ZINC001115507032	1370507158	/nfs/dbraw/zinc/50/71/58/1370507158.db2.gz	ACFFYNIYYUSPAP-IBGZPJMESA-N	0	3	348.462	3.062	20	30		EGEDHN
O=C1C=C2CN(Cc3ccc(Br)cc3F)CCC2S1	ZINC001204552529	1370512937	/nfs/dbraw/zinc/51/29/37/1370512937.db2.gz	ZCUAJVXSWPLONH-CYBMUJFWSA-N	0	3	342.233	3.362	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cc(CC)ccn2)CCCCC1	ZINC001115552529	1370549546	/nfs/dbraw/zinc/54/95/46/1370549546.db2.gz	XTLUEUPSMHIURW-UHFFFAOYSA-N	0	3	335.879	3.419	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H](OC)[C@H](C)CC)CCCCC1	ZINC001115606444	1370604800	/nfs/dbraw/zinc/60/48/00/1370604800.db2.gz	GJIUSUZHULAEMQ-HIFRSBDPSA-N	0	3	330.900	3.209	20	30		EGEDHN
CC#CCCCC(=O)NCC1(NCc2c(C)noc2C)CCCCC1	ZINC001115680396	1370663966	/nfs/dbraw/zinc/66/39/66/1370663966.db2.gz	ZYIJNXZMRSJPIL-UHFFFAOYSA-N	0	3	345.487	3.394	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC1(NCc2cnoc2C)CCCCC1	ZINC001115712301	1370691262	/nfs/dbraw/zinc/69/12/62/1370691262.db2.gz	FGELWTGGIPCDAE-SFHVURJKSA-N	0	3	333.476	3.494	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2ccoc2)CC[C@H]1c1ccc(F)cc1	ZINC001205245362	1370693843	/nfs/dbraw/zinc/69/38/43/1370693843.db2.gz	RCTFOTDBGGDZJC-RBUKOAKNSA-N	0	3	340.398	3.030	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@H](C)CC)CC[C@H]1c1ccc(F)cc1	ZINC001205251791	1370695911	/nfs/dbraw/zinc/69/59/11/1370695911.db2.gz	NEQWJMISUJVOCT-AYOQOUSVSA-N	0	3	330.447	3.169	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC[C@@H](c2ccc(F)cc2)[C@H](NC/C=C\Cl)C1	ZINC001205262959	1370699091	/nfs/dbraw/zinc/69/90/91/1370699091.db2.gz	HJFJNXSUGWDCEQ-OJASNFKASA-N	0	3	349.837	3.012	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC(CNCc2ccn(C(C)C)n2)CC1	ZINC001205975899	1370927357	/nfs/dbraw/zinc/92/73/57/1370927357.db2.gz	QLDMVRXDVGNFQC-KRWDZBQOSA-N	0	3	346.519	3.395	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC(CNCc2cc(C3CC3)no2)CC1	ZINC001205988110	1370930174	/nfs/dbraw/zinc/93/01/74/1370930174.db2.gz	AMOFDWODNRZIMQ-OAHLLOKOSA-N	0	3	345.487	3.483	20	30		EGEDHN
C=CCCCC(=O)N1CCC(CNCc2ccn(C(C)C)n2)CC1	ZINC001206092987	1370958966	/nfs/dbraw/zinc/95/89/66/1370958966.db2.gz	COORJDVOGIZCOU-UHFFFAOYSA-N	0	3	332.492	3.149	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CCN(Cc3sc(C)nc3C)C2)C1	ZINC001206144715	1370971369	/nfs/dbraw/zinc/97/13/69/1370971369.db2.gz	YIHIYGJLAWQTOT-GOSISDBHSA-N	0	3	349.500	3.370	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N[C@@H]1CN(Cc2ccc(CF)cc2)C[C@H]1C	ZINC001206485334	1371069632	/nfs/dbraw/zinc/06/96/32/1371069632.db2.gz	IEPFNRWYLNLHHG-GPMSIDNRSA-N	0	3	348.462	3.074	20	30		EGEDHN
N#Cc1ccc(C(=O)COC2CCN(Cc3ccccc3)CC2)cc1	ZINC001206491634	1371070945	/nfs/dbraw/zinc/07/09/45/1371070945.db2.gz	ITYBQNRZSHDTBD-UHFFFAOYSA-N	0	3	334.419	3.422	20	30		EGEDHN
Cc1cc([C@H](C)NC[C@@H](O)COc2ccc(CC#N)cc2)c(C)o1	ZINC001326148450	1388119655	/nfs/dbraw/zinc/11/96/55/1388119655.db2.gz	ZSQMKPZKPVLLAM-WMLDXEAASA-N	0	3	328.412	3.053	20	30		EGEDHN
CCC(=CC(=O)N1CC[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21)CC	ZINC001187519051	1388120539	/nfs/dbraw/zinc/12/05/39/1388120539.db2.gz	ZRLIBACBXUTWTF-VQTJNVASSA-N	0	3	337.467	3.337	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc3cc[nH]c3c2)C[C@H]1NC(=O)C#CC(C)(C)C	ZINC001206952020	1371242352	/nfs/dbraw/zinc/24/23/52/1371242352.db2.gz	UOWKMHLPLLDHLR-DNVCBOLYSA-N	0	3	337.467	3.154	20	30		EGEDHN
Cc1cccc(C(=O)N2CCC[C@@H](NCC#Cc3ccccc3)C2)c1	ZINC001207136595	1371305611	/nfs/dbraw/zinc/30/56/11/1371305611.db2.gz	UURBJLQAKRIAGK-OAQYLSRUSA-N	0	3	332.447	3.241	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN(Cc2ccc3c(c2)CCC3)C[C@H]1C	ZINC001207190903	1371325745	/nfs/dbraw/zinc/32/57/45/1371325745.db2.gz	ZNLFYELLXKIONV-OXQOHEQNSA-N	0	3	326.484	3.468	20	30		EGEDHN
O=C(c1ccoc1)N1CCC[C@@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207276882	1371347271	/nfs/dbraw/zinc/34/72/71/1371347271.db2.gz	MQZIURSGJSHPQI-GOSISDBHSA-N	0	3	342.826	3.179	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207361716	1371373648	/nfs/dbraw/zinc/37/36/48/1371373648.db2.gz	ACQJIGTZZNHOEL-QAPCUYQASA-N	0	3	332.875	3.318	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@@H](C)CCc2ccc(F)cc2)C1	ZINC001207431839	1371393895	/nfs/dbraw/zinc/39/38/95/1371393895.db2.gz	CVCZGWGAWKOCML-FRQCXROJSA-N	0	3	332.463	3.407	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2CN(Cc3cc(C)cc(C)c3)C[C@H]2C)CCC1	ZINC001207509766	1371419435	/nfs/dbraw/zinc/41/94/35/1371419435.db2.gz	AFYASSVCVCJCEP-UYAOXDASSA-N	0	3	338.495	3.434	20	30		EGEDHN
CC(C)[C@H](C)CC(=O)N1CCC[C@@H](NCc2ccc(C#N)s2)C1	ZINC001207645408	1371462924	/nfs/dbraw/zinc/46/29/24/1371462924.db2.gz	MROJJXCASRKCPO-HUUCEWRRSA-N	0	3	333.501	3.383	20	30		EGEDHN
CC(C)[C@@H](C)CC(=O)N1CCC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001207646365	1371462947	/nfs/dbraw/zinc/46/29/47/1371462947.db2.gz	SPCUWORJOITGTL-YJBOKZPZSA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@@H](CCCC(C)(C)O)CCN1CCN(c2cc(C#N)ccn2)CC1	ZINC001207677929	1371472264	/nfs/dbraw/zinc/47/22/64/1371472264.db2.gz	AHCZLYTZWKDPPK-KRWDZBQOSA-N	0	3	344.503	3.043	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H](NCC#Cc2cccc(Cl)c2)C1)C1CC1	ZINC001207754748	1371495055	/nfs/dbraw/zinc/49/50/55/1371495055.db2.gz	QXIATMDCANQXNP-KXBFYZLASA-N	0	3	344.886	3.318	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H]2[C@H]3[C@@H]2[C@@H]2CC[C@H]3C2)CCCCC1	ZINC001120226089	1371509251	/nfs/dbraw/zinc/50/92/51/1371509251.db2.gz	GDTSJISBVSMAOK-OEXSFMSHSA-N	0	3	336.907	3.440	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H](C)C[C@H]2CCCO2)CCCCC1	ZINC001120226358	1371509534	/nfs/dbraw/zinc/50/95/34/1371509534.db2.gz	MCKMZIVREDNSQK-GDBMZVCRSA-N	0	3	342.911	3.353	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC[C@H](NCc2cncc(C)c2)C1	ZINC001208193178	1371633370	/nfs/dbraw/zinc/63/33/70/1371633370.db2.gz	BXAHSZNZFXCSEB-IBGZPJMESA-N	0	3	327.472	3.239	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CN(CCCOc2ccccc2)C[C@H]1C	ZINC001208298520	1371705847	/nfs/dbraw/zinc/70/58/47/1371705847.db2.gz	QRRZDRILIDRNCF-IEBWSBKVSA-N	0	3	344.499	3.494	20	30		EGEDHN
CC(C)(CC(F)F)C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001208316281	1371714039	/nfs/dbraw/zinc/71/40/39/1371714039.db2.gz	REMLRLRGQZHIDW-QGZVFWFLSA-N	0	3	348.437	3.300	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN([C@H]2CCc3c2cccc3F)C[C@H]1C	ZINC001208317903	1371715353	/nfs/dbraw/zinc/71/53/53/1371715353.db2.gz	APVVLGWSMZTFPP-XWIAVFTESA-N	0	3	330.447	3.462	20	30		EGEDHN
C#CCC1(C(=O)N2CCC[C@@H](NCc3ccc(Cl)nc3)C2)CCC1	ZINC001208318705	1371715642	/nfs/dbraw/zinc/71/56/42/1371715642.db2.gz	GAJNQKVKCPSTBQ-MRXNPFEDSA-N	0	3	345.874	3.009	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CN(CCOCCC(C)C)C[C@H]2C)CC1	ZINC001208500587	1371789862	/nfs/dbraw/zinc/78/98/62/1371789862.db2.gz	VAZMBORZSPSAPV-IEBWSBKVSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC1CC2(CC(NCc3cc(C)no3)C2)C1	ZINC001121164016	1371873330	/nfs/dbraw/zinc/87/33/30/1371873330.db2.gz	WARIGHUVTMCQMH-UHFFFAOYSA-N	0	3	331.460	3.102	20	30		EGEDHN
N#Cc1cccc(CCCN2CCN(CCc3cccs3)CC2)c1	ZINC001208853381	1371918026	/nfs/dbraw/zinc/91/80/26/1371918026.db2.gz	JXTRLFZHVZWJCL-UHFFFAOYSA-N	0	3	339.508	3.413	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@H]1CCN(CCCc2ccc(C#N)cc2)C1	ZINC001208855377	1371919977	/nfs/dbraw/zinc/91/99/77/1371919977.db2.gz	ACJZYGQESDRMQK-KRWDZBQOSA-N	0	3	329.444	3.090	20	30		EGEDHN
C[C@@H]1CCN(CCc2ccc(C#N)cc2)C[C@H]1NC(=O)OC(C)(C)C	ZINC001208921094	1371946387	/nfs/dbraw/zinc/94/63/87/1371946387.db2.gz	YIFOGRKZSLRWQW-CRAIPNDOSA-N	0	3	343.471	3.336	20	30		EGEDHN
COc1ccc(N2CCN(CCc3ccc(C#N)cc3)CC2)c(C)c1	ZINC001208928363	1371948923	/nfs/dbraw/zinc/94/89/23/1371948923.db2.gz	BEJCOUAETBUNKV-UHFFFAOYSA-N	0	3	335.451	3.240	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC[C@@H](NCc2c(C)nsc2C)C1	ZINC001209002353	1371970559	/nfs/dbraw/zinc/97/05/59/1371970559.db2.gz	AAQKUKDTPAWNTG-QGZVFWFLSA-N	0	3	347.528	3.424	20	30		EGEDHN
CC1(C(=O)N2CCC[C@H](NCC#Cc3ccccc3Cl)C2)CCC1	ZINC001209004309	1371971675	/nfs/dbraw/zinc/97/16/75/1371971675.db2.gz	NOYXCJVDOPXLAL-KRWDZBQOSA-N	0	3	344.886	3.462	20	30		EGEDHN
CC[C@H](F)C(=O)N1CCC[C@@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001209020953	1371976459	/nfs/dbraw/zinc/97/64/59/1371976459.db2.gz	XSQCAZZXHZFMNH-SJORKVTESA-N	0	3	336.838	3.020	20	30		EGEDHN
C#CCCCCCC(=O)NC1CC2(CC(NCc3ocnc3C)C2)C1	ZINC001121534325	1372002250	/nfs/dbraw/zinc/00/22/50/1372002250.db2.gz	DYPLIZRIAJBCRY-UHFFFAOYSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC1CC2(CC(NCc3oc(C)nc3C)C2)C1	ZINC001121617197	1372027439	/nfs/dbraw/zinc/02/74/39/1372027439.db2.gz	UDBCSYCLVGIDQR-ONHPUITHSA-N	0	3	345.487	3.411	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC[C@@H](NCc2ccnc(Cl)c2)C1	ZINC001209183060	1372027491	/nfs/dbraw/zinc/02/74/91/1372027491.db2.gz	LFGSSQAOGNHQJS-GDBMZVCRSA-N	0	3	335.879	3.418	20	30		EGEDHN
C=CCCCCN1Cc2cn(CC3CCOCC3)nc2[C@H](COC)C1	ZINC001209200964	1372035921	/nfs/dbraw/zinc/03/59/21/1372035921.db2.gz	QYMDQJYEYOIUDH-IBGZPJMESA-N	0	3	347.503	3.212	20	30		EGEDHN
C#CCCCN1CC[C@H](NC(=O)OC(C)(C)C)[C@@H](C(F)(F)F)C1	ZINC001209268117	1372054832	/nfs/dbraw/zinc/05/48/32/1372054832.db2.gz	UIBFRJRYXRFMSX-STQMWFEESA-N	0	3	334.382	3.177	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC1CC2(C1)CC(N[C@H](C)c1cnccn1)C2	ZINC001121714064	1372056928	/nfs/dbraw/zinc/05/69/28/1372056928.db2.gz	USNUAFNFFHZPDG-CBYVUIQDSA-N	0	3	342.487	3.157	20	30		EGEDHN
CCCC(C)(C)C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001209355755	1372077155	/nfs/dbraw/zinc/07/71/55/1372077155.db2.gz	LCXHZGMMSLNVJU-IBGZPJMESA-N	0	3	326.484	3.445	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC1CC2(C1)CC(N[C@H](C)c1cnccn1)C2	ZINC001121842123	1372099399	/nfs/dbraw/zinc/09/93/99/1372099399.db2.gz	VLPSIBGWBHVIQB-NUVKBMONSA-N	0	3	342.487	3.157	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@H](NCC#Cc3ccc(Cl)cc3)C2)CC1	ZINC001209473588	1372115708	/nfs/dbraw/zinc/11/57/08/1372115708.db2.gz	AEEDIIKKSGCLEZ-SFHVURJKSA-N	0	3	344.886	3.462	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)NCc1cccc(OC)c1OC1CCCC1	ZINC001121955691	1372132870	/nfs/dbraw/zinc/13/28/70/1372132870.db2.gz	XDDKMEDTKFLFGG-KRWDZBQOSA-N	0	3	346.471	3.316	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)CCCC(=O)OC(C)(C)C	ZINC001122023793	1372155476	/nfs/dbraw/zinc/15/54/76/1372155476.db2.gz	SSMSCQQECJXIIW-CYBMUJFWSA-N	0	3	341.411	3.262	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N[C@H](C)c1nc(-c2ccc(Cl)cc2)no1	ZINC001122111628	1372177188	/nfs/dbraw/zinc/17/71/88/1372177188.db2.gz	CHWWBSRFWJARJT-RISCZKNCSA-N	0	3	348.834	3.251	20	30		EGEDHN
O=C([C@@H]1CC12CC2)N1CCC[C@@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001209807278	1372203858	/nfs/dbraw/zinc/20/38/58/1372203858.db2.gz	DEIRUHJPXKNXBM-MSOLQXFVSA-N	0	3	342.870	3.072	20	30		EGEDHN
CC(C)[C@@H]1C[C@H](C(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)CCO1	ZINC001122449225	1372249568	/nfs/dbraw/zinc/24/95/68/1372249568.db2.gz	SARPWHDRCZDOCJ-KCXAZCMYSA-N	0	3	348.830	3.439	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(SC(F)F)cc1)C(=O)[C@@H]1C[C@@H]1F	ZINC001122449671	1372250027	/nfs/dbraw/zinc/25/00/27/1372250027.db2.gz	VOQAQTUGTYULBI-VWYCJHECSA-N	0	3	328.315	3.007	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)[C@@H]2[C@H]3CCCO[C@H]32)cc1	ZINC001122541767	1372270270	/nfs/dbraw/zinc/27/02/70/1372270270.db2.gz	BHIYCPUYNFJKOU-VUHPKUFZSA-N	0	3	340.423	3.102	20	30		EGEDHN
CC[C@@H](C)c1ccc(NC(=O)C(C#N)C(=O)COC(F)(F)F)cc1	ZINC001122547857	1372272342	/nfs/dbraw/zinc/27/23/42/1372272342.db2.gz	YMXWFEBDHBTONI-ZWNOBZJWSA-N	0	3	342.317	3.384	20	30		EGEDHN
CCCCCCCCCC(=O)N[C@@H]1CN(CCn2cccn2)C[C@H]1C	ZINC001210574248	1372382947	/nfs/dbraw/zinc/38/29/47/1372382947.db2.gz	XYGYIWIHTPSHMT-RTBURBONSA-N	0	3	348.535	3.460	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1)c1ccccc1	ZINC001210774085	1372424235	/nfs/dbraw/zinc/42/42/35/1372424235.db2.gz	QZAYVUVBBBPNNS-DENIHFKCSA-N	0	3	346.474	3.422	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CCOCC3CC3)C[C@H]2C)CCCCC1	ZINC001211235070	1372509182	/nfs/dbraw/zinc/50/91/82/1372509182.db2.gz	HHJVBULKEGCLRU-IEBWSBKVSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)[C@]2(C)CCC(C)=C(C)C2)C1	ZINC001211401055	1372551685	/nfs/dbraw/zinc/55/16/85/1372551685.db2.gz	FJSMWOLDADZRBA-QWFCFKBJSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@H](OC(C)C)c2ccccc2)C1	ZINC001211513171	1372570459	/nfs/dbraw/zinc/57/04/59/1372570459.db2.gz	KULBNYXPUBELIO-BHIYHBOVSA-N	0	3	330.472	3.165	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@@H]2C[C@H]2C(C)(C)C)C[C@H]1c1ccccc1	ZINC001211632406	1372592847	/nfs/dbraw/zinc/59/28/47/1372592847.db2.gz	BIDKBJVWRLXPRV-IYWMVGAKSA-N	0	3	338.495	3.276	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2ccccc2CC)C[C@H]1c1ccccc1	ZINC001211659043	1372598224	/nfs/dbraw/zinc/59/82/24/1372598224.db2.gz	DMZPQJHAMBOYDM-FCHUYYIVSA-N	0	3	346.474	3.470	20	30		EGEDHN
CCCCCCCC[C@@H](C)C(=O)N1CC[C@@H](NCc2cncn2C)C1	ZINC001188015533	1388214333	/nfs/dbraw/zinc/21/43/33/1388214333.db2.gz	GTYRLAQOJZQJQW-QZTJIDSGSA-N	0	3	348.535	3.497	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@]2(C)CC=CCC2)[C@H](OC)C1	ZINC001212316844	1372685113	/nfs/dbraw/zinc/68/51/13/1372685113.db2.gz	XIOXSPWHZPZLPR-QWFCFKBJSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1CN(CC/C=C\CCC)C[C@H]1OC	ZINC001212321108	1372685747	/nfs/dbraw/zinc/68/57/47/1372685747.db2.gz	ROVRJTWTNCAVTJ-PSUNPMBVSA-N	0	3	334.504	3.317	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CN([C@H](C)c2ccccc2)C[C@H]1OC	ZINC001212333020	1372688351	/nfs/dbraw/zinc/68/83/51/1372688351.db2.gz	TWILHRHLSYIEQE-KBAYOESNSA-N	0	3	330.472	3.165	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)[C@H]2CC[C@H](C3CCC3)CC2)[C@H](OC)C1	ZINC001212425731	1372704240	/nfs/dbraw/zinc/70/42/40/1372704240.db2.gz	BAZNVZLPPGOMNT-UAFMIMERSA-N	0	3	348.531	3.375	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2cncc(CC)c2)[C@H](OC)C1	ZINC001213173491	1372852701	/nfs/dbraw/zinc/85/27/01/1372852701.db2.gz	LFZPLYLXJHFMIA-RTBURBONSA-N	0	3	347.503	3.043	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2cccc(C3CCC3)c2)[C@H](OC)C1	ZINC001213719141	1372951127	/nfs/dbraw/zinc/95/11/27/1372951127.db2.gz	PBNVDBLADJJEEF-WOJBJXKFSA-N	0	3	342.483	3.349	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)C[C@H](C)c2ccco2)[C@H](OC)C1	ZINC001213733645	1372952956	/nfs/dbraw/zinc/95/29/56/1372952956.db2.gz	JFEJQBLNLOWKFU-YQVWRLOYSA-N	0	3	348.487	3.335	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H](NC(=O)c2ccc(C(F)F)o2)[C@H](OC)C1	ZINC001213792683	1372962918	/nfs/dbraw/zinc/96/29/18/1372962918.db2.gz	NREFXZNWONZVPR-LALPHHSUSA-N	0	3	342.386	3.001	20	30		EGEDHN
C=CC[C@H](C(=O)N[C@@H]1CN(CCCCC)C[C@H]1OC)c1ccccc1	ZINC001213895581	1372976101	/nfs/dbraw/zinc/97/61/01/1372976101.db2.gz	IJLYXXWSNLVASX-XUVXKRRUSA-N	0	3	344.499	3.352	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)[C@@]2(C)CCC(C)=C(C)C2)[C@H](OC)C1	ZINC001213948790	1372985442	/nfs/dbraw/zinc/98/54/42/1372985442.db2.gz	BSSLMDQPYMXBBL-GGPKGHCWSA-N	0	3	334.504	3.295	20	30		EGEDHN
Cc1ccc(C(=O)N2C[C@@H](C)[C@H](NCC#Cc3ccccc3)C2)s1	ZINC001214056522	1373001615	/nfs/dbraw/zinc/00/16/15/1373001615.db2.gz	NJJPVJWLTBWQBM-CRAIPNDOSA-N	0	3	338.476	3.158	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H]2CN(Cc3cccc(COC)c3)C[C@H]21	ZINC001188080752	1388237679	/nfs/dbraw/zinc/23/76/79/1388237679.db2.gz	JZXMJYABXYJRNG-VQTJNVASSA-N	0	3	342.483	3.222	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@H](NCc2ccccc2OC(C)C)C1	ZINC001214302193	1373040781	/nfs/dbraw/zinc/04/07/81/1373040781.db2.gz	VWCOVWDVGXFYRW-SJLPKXTDSA-N	0	3	330.472	3.377	20	30		EGEDHN
CC(C)(C)C#CC(=O)NCCNCc1cc(Cl)cc(Cl)c1	ZINC001126915579	1373051419	/nfs/dbraw/zinc/05/14/19/1373051419.db2.gz	FWFZYKIPNSNSLD-UHFFFAOYSA-N	0	3	327.255	3.249	20	30		EGEDHN
C[C@H](C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(Cl)cc2)C1)C1CC1	ZINC001214400303	1373054686	/nfs/dbraw/zinc/05/46/86/1373054686.db2.gz	BKAVDNQFULCCTJ-ZRGWGRIASA-N	0	3	344.886	3.174	20	30		EGEDHN
C/C=C(/C)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001214413680	1373057368	/nfs/dbraw/zinc/05/73/68/1373057368.db2.gz	JETJHHYQQJSIMM-YPHGIUPASA-N	0	3	330.859	3.094	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@@H](C)[C@H](NCc2cc(C)ccc2OC)C1	ZINC001214468076	1373066836	/nfs/dbraw/zinc/06/68/36/1373066836.db2.gz	UGQSBPHHPKCWKO-IEBWSBKVSA-N	0	3	342.483	3.134	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@@H](C)[C@H](N[C@H](C)c2ccccc2Cl)C1	ZINC001214580462	1373084161	/nfs/dbraw/zinc/08/41/61/1373084161.db2.gz	YTHNFMAMWHVCEJ-IIDMSEBBSA-N	0	3	332.875	3.497	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](C)[C@H](NCc3cncs3)C2)CCCC1	ZINC001217117679	1373389717	/nfs/dbraw/zinc/38/97/17/1373389717.db2.gz	PGBPZBYJXLHITE-GDBMZVCRSA-N	0	3	333.501	3.216	20	30		EGEDHN
Cc1cccc2c(C(=O)NCCNCc3ccc(C#N)cc3)coc21	ZINC001129556970	1373397336	/nfs/dbraw/zinc/39/73/36/1373397336.db2.gz	BAKUVBFBPBMOAS-UHFFFAOYSA-N	0	3	333.391	3.133	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)C/C=C/c2ccc(F)cc2)s1	ZINC001130172161	1373469715	/nfs/dbraw/zinc/46/97/15/1373469715.db2.gz	YQEUZJUVGLODGI-OWOJBTEDSA-N	0	3	343.427	3.068	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)C=C(CC)CC)[C@H]2C1	ZINC001217643383	1373480930	/nfs/dbraw/zinc/48/09/30/1373480930.db2.gz	LQDNQCUHYVUMSK-RBUKOAKNSA-N	0	3	334.504	3.391	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)C[C@@H](C)SC)[C@H]2C1	ZINC001217654968	1373482677	/nfs/dbraw/zinc/48/26/77/1373482677.db2.gz	NSZNBOKROYJHBR-IXDOHACOSA-N	0	3	342.549	3.010	20	30		EGEDHN
C=C(C)CN1CC[C@H](Oc2cnccc2CNC(=O)/C(C)=C\CC)C1	ZINC001130315229	1373490623	/nfs/dbraw/zinc/49/06/23/1373490623.db2.gz	NTLNWRTUOHHWIS-LQAFDQLZSA-N	0	3	343.471	3.083	20	30		EGEDHN
Fc1ccc(C#Cc2ccc(O[C@H]3CC[C@@H]4NCCO[C@H]43)cc2)cc1	ZINC001218150442	1373570803	/nfs/dbraw/zinc/57/08/03/1373570803.db2.gz	KEWYKEBXJLYIJU-PCCBWWKXSA-N	0	3	337.394	3.124	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2OCCN(C(=O)c3c(C)oc(C)c3C)[C@H]2C1	ZINC001218260548	1373585742	/nfs/dbraw/zinc/58/57/42/1373585742.db2.gz	NRRDXJYPGOJBGE-JEBQAFNWSA-N	0	3	346.471	3.085	20	30		EGEDHN
C=CCCCC(=O)N1CCO[C@@H]2CN([C@H](CC)c3ccccc3)C[C@@H]21	ZINC001218557829	1373633034	/nfs/dbraw/zinc/63/30/34/1373633034.db2.gz	LBVUXEAEQYVOKJ-HSALFYBXSA-N	0	3	342.483	3.406	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)Nc1cc(-c2ccccc2O)no1	ZINC001218712911	1373646354	/nfs/dbraw/zinc/64/63/54/1373646354.db2.gz	MSRPISNLBBQXNX-AWEZNQCLSA-N	0	3	329.400	3.450	20	30		EGEDHN
C=CCCC1(C(=O)N2C[C@@H](C)O[C@@]3(CCN(CC=C(C)C)C3)C2)CC1	ZINC001131688480	1373763781	/nfs/dbraw/zinc/76/37/81/1373763781.db2.gz	MRZDQLGGDCJWQL-WIYYLYMNSA-N	0	3	346.515	3.391	20	30		EGEDHN
C=CCCOCCCCC(=O)N1C[C@H]2CCN(CC=C(C)C)C[C@H]21	ZINC001221547644	1373778692	/nfs/dbraw/zinc/77/86/92/1373778692.db2.gz	SNSVHZQKWOBLCO-RTBURBONSA-N	0	3	334.504	3.248	20	30		EGEDHN
C=CCCCCCN1CC[C@@H]2CN(C(=O)c3nc(C)oc3C)[C@@H]2C1	ZINC001221887847	1373802520	/nfs/dbraw/zinc/80/25/20/1373802520.db2.gz	GLRADLRHELEHPH-IAGOWNOFSA-N	0	3	331.460	3.184	20	30		EGEDHN
C=C[C@@H](CC(=O)N1C[C@H]2CCN(CCCF)C[C@H]21)c1ccccc1	ZINC001222038107	1373813156	/nfs/dbraw/zinc/81/31/56/1373813156.db2.gz	MKOOZMZOCXLSKE-QXAKKESOSA-N	0	3	330.447	3.239	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC[C@@H](C)N(Cc2ccccc2N(C)C)C1	ZINC001131898599	1375034330	/nfs/dbraw/zinc/03/43/30/1375034330.db2.gz	BKFQENYODXBQHP-AEFFLSMTSA-N	0	3	329.488	3.188	20	30		EGEDHN
CC(C)(C)CC(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1	ZINC001224825955	1375079202	/nfs/dbraw/zinc/07/92/02/1375079202.db2.gz	DPEABRCWQUWYSQ-RTBURBONSA-N	0	3	326.484	3.491	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CC[C@H](C)N(CCOC2CCCCCC2)C1	ZINC001131996658	1375089315	/nfs/dbraw/zinc/08/93/15/1375089315.db2.gz	WZFLEJAPGDDQTF-OALUTQOASA-N	0	3	348.531	3.498	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CC[C@@H](C)N(Cc2ccc3cc[nH]c3c2)C1	ZINC001132003595	1375093777	/nfs/dbraw/zinc/09/37/77/1375093777.db2.gz	XRFQCXXDKCCGRC-APWZRJJASA-N	0	3	337.467	3.441	20	30		EGEDHN
CCc1ccccc1CN1C[C@@H](NC(=O)C#CC(C)C)CC[C@@H]1C	ZINC001132016002	1375099995	/nfs/dbraw/zinc/09/99/95/1375099995.db2.gz	CMLWDOBCDKAIKW-PXNSSMCTSA-N	0	3	326.484	3.378	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H]1CC[C@H](C)N(Cc2cccc3cccnc32)C1	ZINC001132018844	1375101505	/nfs/dbraw/zinc/10/15/05/1375101505.db2.gz	ZENDJOYGQXTHJA-PXNSSMCTSA-N	0	3	349.478	3.363	20	30		EGEDHN
Cc1cc(CN2C[C@H](NC(=O)C#CC3CC3)CC[C@@H]2C)c(C)s1	ZINC001132034746	1375109521	/nfs/dbraw/zinc/10/95/21/1375109521.db2.gz	UTWPDWKICKYXNE-SCLBCKFNSA-N	0	3	330.497	3.247	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CC[C@@H](C)N(CCn2nc(C)cc2C)C1	ZINC001132060844	1375126050	/nfs/dbraw/zinc/12/60/50/1375126050.db2.gz	MBXDFGXDRSNLAB-SJLPKXTDSA-N	0	3	346.519	3.071	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)C[C@@H](C)CCc2ccccc2)CC1	ZINC001225626223	1375134600	/nfs/dbraw/zinc/13/46/00/1375134600.db2.gz	VFPMZMKYUITCQG-IBGZPJMESA-N	0	3	340.511	3.497	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)C[C@H](C)CCc2ccccc2)CC1	ZINC001225626225	1375134829	/nfs/dbraw/zinc/13/48/29/1375134829.db2.gz	VFPMZMKYUITCQG-LJQANCHMSA-N	0	3	340.511	3.497	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)C(C)(C)C2CCCC2)CC[C@H]1C	ZINC001132105049	1375149715	/nfs/dbraw/zinc/14/97/15/1375149715.db2.gz	ALPSEERPUYJLIZ-SJLPKXTDSA-N	0	3	336.520	3.375	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CCCC[C@H]1NCc1c(C)noc1C	ZINC001225752294	1375152173	/nfs/dbraw/zinc/15/21/73/1375152173.db2.gz	FLTVZPGMCAVCNC-QZTJIDSGSA-N	0	3	331.460	3.002	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CCCC[C@H]1NCc1cc(C)ns1	ZINC001225771694	1375153862	/nfs/dbraw/zinc/15/38/62/1375153862.db2.gz	TZEXVYQBCYJVLA-IAGOWNOFSA-N	0	3	333.501	3.162	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCc2ccc(OC)c(F)c2)CC[C@@H]1C	ZINC001132168947	1375184026	/nfs/dbraw/zinc/18/40/26/1375184026.db2.gz	HQYOUIAMHDDWIP-DOTOQJQBSA-N	0	3	348.462	3.312	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2ocnc2C(F)(F)F)CC[C@H]1C	ZINC001132195811	1375200896	/nfs/dbraw/zinc/20/08/96/1375200896.db2.gz	VWTRZNJAJFGWJX-NEPJUHHUSA-N	0	3	345.365	3.242	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CC[C@H](C)N(CCOc2ccccc2)C1	ZINC001132223379	1375220813	/nfs/dbraw/zinc/22/08/13/1375220813.db2.gz	CLZQBGZCHZPEFL-RBUKOAKNSA-N	0	3	342.483	3.228	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCc2cccc(N(C)C)c2)CC[C@H]1C	ZINC001132237621	1375232990	/nfs/dbraw/zinc/23/29/90/1375232990.db2.gz	KLKLKIONNXRYSE-MJGOQNOKSA-N	0	3	343.515	3.230	20	30		EGEDHN
C=CCCC(=O)NC1CCN(CCOc2ccc(OCC)cc2)CC1	ZINC001226518874	1375273467	/nfs/dbraw/zinc/27/34/67/1375273467.db2.gz	NSYICJXENBPKBW-UHFFFAOYSA-N	0	3	346.471	3.011	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2ccc(C=C)cc2)CC[C@@H]1C	ZINC001132310609	1375288830	/nfs/dbraw/zinc/28/88/30/1375288830.db2.gz	LYNRRZWGQSXDQC-QFBILLFUSA-N	0	3	328.456	3.115	20	30		EGEDHN
C#CCCCCCC(=O)NCCNCc1ccc(Cl)c(OC)c1	ZINC001132404254	1375355414	/nfs/dbraw/zinc/35/54/14/1375355414.db2.gz	XUTVGOZUGBUSIY-UHFFFAOYSA-N	0	3	336.863	3.138	20	30		EGEDHN
C#CCCCC(=O)NC1CCN([C@@H]2CCc3c2cccc3F)CC1	ZINC001227108430	1375390836	/nfs/dbraw/zinc/39/08/36/1375390836.db2.gz	QGEXTJWULJSTPQ-LJQANCHMSA-N	0	3	328.431	3.197	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2CC[C@H](C)N(CC=C(C)C)C2)CCOCC1	ZINC001132454046	1375396273	/nfs/dbraw/zinc/39/62/73/1375396273.db2.gz	VGLVFCCIAGZGCS-ROUUACIJSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2ccc(CC)cc2)CC[C@H]1C	ZINC001132458316	1375401204	/nfs/dbraw/zinc/40/12/04/1375401204.db2.gz	TZOSTPMROFGQMN-APWZRJJASA-N	0	3	330.472	3.034	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COc2cccc(CC)c2)CC[C@@H]1C	ZINC001132469009	1375410120	/nfs/dbraw/zinc/41/01/20/1375410120.db2.gz	PVKHUHLRRDAWHD-FUHWJXTLSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COc2ccc(C)c(C)c2)CC[C@@H]1C	ZINC001132499826	1375427255	/nfs/dbraw/zinc/42/72/55/1375427255.db2.gz	KTDUTOZAVKFJSN-ZWKOTPCHSA-N	0	3	330.472	3.227	20	30		EGEDHN
C=C(C)CCC(=O)NC1CCN(C[C@@H](OC)c2ccccc2)CC1	ZINC001227596958	1375449472	/nfs/dbraw/zinc/44/94/72/1375449472.db2.gz	ORRQUSPWRPXZFV-LJQANCHMSA-N	0	3	330.472	3.311	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)C2(CC=C)CCCC2)CC[C@H]1C	ZINC001132547145	1375454531	/nfs/dbraw/zinc/45/45/31/1375454531.db2.gz	XRCNGVXDULIJFW-MSOLQXFVSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CCCC(=O)N(Cc1scnc1C)C[C@H]1CCN(CC#CC)C1	ZINC001132559280	1375467645	/nfs/dbraw/zinc/46/76/45/1375467645.db2.gz	WAZXSRMHEJEEJK-KRWDZBQOSA-N	0	3	345.512	3.092	20	30		EGEDHN
C#CCN1CC[C@H](CN(Cc2scnc2C)C(=O)/C=C(/C)CC)C1	ZINC001132563265	1375469185	/nfs/dbraw/zinc/46/91/85/1375469185.db2.gz	QBQGDBCWWDNDOO-MJSCBBHESA-N	0	3	345.512	3.092	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2N(Cc2nccs2)C(=O)CCC)CC1	ZINC001132567424	1375470916	/nfs/dbraw/zinc/47/09/16/1375470916.db2.gz	YSKXGJPTLOCNMG-INIZCTEOSA-N	0	3	345.512	3.150	20	30		EGEDHN
CC#CCCCC(=O)NCCNCc1cnc(-c2ccccc2)s1	ZINC001132601590	1375481622	/nfs/dbraw/zinc/48/16/22/1375481622.db2.gz	FRTLEDCDBNHESY-UHFFFAOYSA-N	0	3	341.480	3.210	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](C)[C@@H](CNCc2ncc(C)s2)C1	ZINC001132761260	1375551621	/nfs/dbraw/zinc/55/16/21/1375551621.db2.gz	HPYZQPRGNJIRKJ-RDJZCZTQSA-N	0	3	347.528	3.219	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](C)[C@H](CNC/C(Cl)=C/Cl)C1	ZINC001132786370	1375564136	/nfs/dbraw/zinc/56/41/36/1375564136.db2.gz	TYGFWRJVBUWOJL-AVWIDUKFSA-N	0	3	331.287	3.183	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CCCC[C@H]2NCc2ccns2)CCC1	ZINC001228406407	1375567227	/nfs/dbraw/zinc/56/72/27/1375567227.db2.gz	FPDRBIGCPDFTLH-HZPDHXFCSA-N	0	3	333.501	3.407	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@H](C)[C@H](CNC/C(Cl)=C\Cl)C1	ZINC001132809265	1375575406	/nfs/dbraw/zinc/57/54/06/1375575406.db2.gz	NKNZEHKAGDHJNA-ADFWIADRSA-N	0	3	331.287	3.039	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2csc3ccccc23)CC1	ZINC001228492928	1375579966	/nfs/dbraw/zinc/57/99/66/1375579966.db2.gz	HXBGBRIOUDRQJL-UHFFFAOYSA-N	0	3	344.480	3.298	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CCN(C[C@@H](O)c2ccc(CC)cc2)CC1	ZINC001228631469	1375621565	/nfs/dbraw/zinc/62/15/65/1375621565.db2.gz	MMHQLOJVRMSNKN-LJQANCHMSA-N	0	3	344.499	3.075	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NC1CCN(CCc2scnc2C)CC1	ZINC001228749099	1375662365	/nfs/dbraw/zinc/66/23/65/1375662365.db2.gz	POCRAJBJXHRVCV-KBPBESRZSA-N	0	3	335.517	3.033	20	30		EGEDHN
CC#CCCCC(=O)NC1CCN(C[C@H](OC)c2ccccc2)CC1	ZINC001228770306	1375670464	/nfs/dbraw/zinc/67/04/64/1375670464.db2.gz	HNBJUUPHNOCZBQ-FQEVSTJZSA-N	0	3	342.483	3.148	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)CCc1csc(C)n1	ZINC001228907989	1375711065	/nfs/dbraw/zinc/71/10/65/1375711065.db2.gz	IUTDYYNPPMHJAL-HUUCEWRRSA-N	0	3	341.908	3.154	20	30		EGEDHN
C[C@H](c1ccccn1)N1CC[C@@H](Oc2ncnc3ccc(C#N)cc32)C1	ZINC001229107681	1375765057	/nfs/dbraw/zinc/76/50/57/1375765057.db2.gz	MWSMOFZWMRPVQY-GDBMZVCRSA-N	0	3	345.406	3.111	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](C)[C@@H](CNCc2cc(C)no2)C1	ZINC001133137927	1375798322	/nfs/dbraw/zinc/79/83/22/1375798322.db2.gz	AAJRQFHKATZVQJ-HOCLYGCPSA-N	0	3	333.476	3.160	20	30		EGEDHN
C[C@@H](C(=O)NCCNCc1cccc(C#N)c1)c1ccc(Cl)cc1	ZINC001133244741	1375865264	/nfs/dbraw/zinc/86/52/64/1375865264.db2.gz	NBRVWNLIGJBUMJ-CQSZACIVSA-N	0	3	341.842	3.221	20	30		EGEDHN
Cc1cc(Cl)ccc1C(=O)NCCNCc1cccc(C#N)c1	ZINC001133248590	1375867616	/nfs/dbraw/zinc/86/76/16/1375867616.db2.gz	JOQZHTSQWMHMRQ-UHFFFAOYSA-N	0	3	327.815	3.040	20	30		EGEDHN
Cc1ccc(CCCC(=O)NCCNCc2cccc(C#N)c2)cc1	ZINC001133254401	1375872190	/nfs/dbraw/zinc/87/21/90/1375872190.db2.gz	ALZDDSDVHKXFFH-UHFFFAOYSA-N	0	3	335.451	3.095	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@H]2CN(Cc3cccc(OC)c3)C[C@H]21	ZINC001188908529	1388405994	/nfs/dbraw/zinc/40/59/94/1388405994.db2.gz	GSLONXFZKIPDJV-IMFGXOCKSA-N	0	3	342.483	3.330	20	30		EGEDHN
Cc1ccc(C(=O)NCCNCc2cccc(C#N)c2)cc1Cl	ZINC001133261632	1375877224	/nfs/dbraw/zinc/87/72/24/1375877224.db2.gz	QPMZJKAKYIRMKY-UHFFFAOYSA-N	0	3	327.815	3.040	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)C[C@@H](CC)c2ccccc2)CC1	ZINC001230017019	1375931278	/nfs/dbraw/zinc/93/12/78/1375931278.db2.gz	SISDFBVHBISDBL-GOSISDBHSA-N	0	3	344.499	3.354	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@]1(C)C=CCC1	ZINC001133401919	1375986731	/nfs/dbraw/zinc/98/67/31/1375986731.db2.gz	UXTVFPBDDJULNX-IBGZPJMESA-N	0	3	330.859	3.248	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)C1CC2(CC2)C1	ZINC001133403730	1375988608	/nfs/dbraw/zinc/98/86/08/1375988608.db2.gz	GDDCJELDYVXXAA-UHFFFAOYSA-N	0	3	344.886	3.472	20	30		EGEDHN
C#C[C@@H](COc1cccc(Cl)c1)Oc1ccc2[nH]c(N)nc2c1	ZINC001230518815	1376052011	/nfs/dbraw/zinc/05/20/11/1376052011.db2.gz	UFSYEMYYVVZRGE-LBPRGKRZSA-N	0	3	327.771	3.258	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)c1ccccc1F	ZINC001133523908	1376058780	/nfs/dbraw/zinc/05/87/80/1376058780.db2.gz	AYBYJWHDYXMPEW-RYUDHWBXSA-N	0	3	343.240	3.221	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1cc(F)ccc1C#N)NC(=O)c1ccccc1	ZINC001133526659	1376061900	/nfs/dbraw/zinc/06/19/00/1376061900.db2.gz	WZOAMQYDECNJSO-LSDHHAIUSA-N	0	3	339.414	3.384	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)c1ccccc1C	ZINC001133554276	1376082268	/nfs/dbraw/zinc/08/22/68/1376082268.db2.gz	AAWUVTGAAPTFES-ZIAGYGMSSA-N	0	3	339.277	3.390	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCNCc2cnc(-c3ccccc3)s2)C1	ZINC001133566083	1376093936	/nfs/dbraw/zinc/09/39/36/1376093936.db2.gz	UOYOPTZEQGMXCA-UHFFFAOYSA-N	0	3	341.480	3.372	20	30		EGEDHN
Cc1occc1C(=O)N[C@H](C)C[C@H](C)NCc1cc(F)ccc1C#N	ZINC001133627655	1376125706	/nfs/dbraw/zinc/12/57/06/1376125706.db2.gz	IFZWBUZQLJHULD-QWHCGFSZSA-N	0	3	343.402	3.286	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)c1ccsc1)NCc1cc(F)ccc1C#N	ZINC001133633924	1376130127	/nfs/dbraw/zinc/13/01/27/1376130127.db2.gz	ZTEOADYTOWRQBB-STQMWFEESA-N	0	3	345.443	3.446	20	30		EGEDHN
C#CCCN(CCCNC(=O)C(C)=C1CCCC1)Cc1cccnc1	ZINC001230732033	1376137012	/nfs/dbraw/zinc/13/70/12/1376137012.db2.gz	WEZVMVMAFARVOB-UHFFFAOYSA-N	0	3	339.483	3.304	20	30		EGEDHN
C#CCCN(CCCNC(=O)[C@@H]1CCCC[C@@H]1C)Cc1cccnc1	ZINC001230829323	1376161949	/nfs/dbraw/zinc/16/19/49/1376161949.db2.gz	FLRICUNBBMXVJW-AZUAARDMSA-N	0	3	341.499	3.240	20	30		EGEDHN
C#CCCN(CCCNC(=O)C(C)(C)CC=C)Cc1cccnc1	ZINC001230859810	1376166051	/nfs/dbraw/zinc/16/60/51/1376166051.db2.gz	QQWGOZRFWHZNSU-UHFFFAOYSA-N	0	3	327.472	3.016	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)[C@@H]1CC12CCC2)Cc1cccnc1	ZINC001230861159	1376169012	/nfs/dbraw/zinc/16/90/12/1376169012.db2.gz	AYQXNZWAHDIXBB-SFHVURJKSA-N	0	3	327.472	3.156	20	30		EGEDHN
C#CCCN(CCCNC(=O)CCc1ccccc1)Cc1cccnc1	ZINC001230911509	1376181193	/nfs/dbraw/zinc/18/11/93/1376181193.db2.gz	IGZFQZGCQFWPGH-UHFFFAOYSA-N	0	3	349.478	3.046	20	30		EGEDHN
C=CCCC(=O)N[C@H](C)C[C@@H](C)NCc1nc2ccc(F)cc2o1	ZINC001133887701	1376250734	/nfs/dbraw/zinc/25/07/34/1376250734.db2.gz	BFORZQDLGPRUGD-CHWSQXEVSA-N	0	3	333.407	3.306	20	30		EGEDHN
C=CCOCC(=O)N[C@H](C)C[C@H](C)NCc1c(F)cccc1Cl	ZINC001133908812	1376260008	/nfs/dbraw/zinc/26/00/08/1376260008.db2.gz	CGJCGJDEUALWDC-QWHCGFSZSA-N	0	3	342.842	3.055	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3nc4c(s3)CCCC4)C2)C1=O	ZINC001231580936	1376270151	/nfs/dbraw/zinc/27/01/51/1376270151.db2.gz	VPKXAIGRYFTSQO-IBGZPJMESA-N	0	3	345.512	3.022	20	30		EGEDHN
C#Cc1cccc(CN2CC[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]32)c1	ZINC001231658214	1376297302	/nfs/dbraw/zinc/29/73/02/1376297302.db2.gz	RHNZBCWNTDAYOB-ZWKOTPCHSA-N	0	3	326.440	3.109	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1ccccc1C#N)NC(=O)CCC(F)(F)F	ZINC001134003625	1376306062	/nfs/dbraw/zinc/30/60/62/1376306062.db2.gz	LCOGDQUECGKFRB-QWHCGFSZSA-N	0	3	341.377	3.274	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H]2CN(CCc3ccccc3F)C[C@H]21	ZINC001189007339	1388435095	/nfs/dbraw/zinc/43/50/95/1388435095.db2.gz	SHNDZLWXSVIEDN-PKOBYXMFSA-N	0	3	330.447	3.257	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)CC1CCC1)NCc1cc(F)ccc1C#N	ZINC001134027130	1376317621	/nfs/dbraw/zinc/31/76/21/1376317621.db2.gz	ZCFQBXLYZJZEKM-KGLIPLIRSA-N	0	3	331.435	3.260	20	30		EGEDHN
CN(CCC#N)c1ccc(CN(CCO)Cc2cccs2)cc1	ZINC001231818462	1376319847	/nfs/dbraw/zinc/31/98/47/1376319847.db2.gz	ZIPHROMSEFKUJC-UHFFFAOYSA-N	0	3	329.469	3.092	20	30		EGEDHN
COc1ccc(CNCCNC(=O)C[C@H](C)CC(C)(C)C)cc1C#N	ZINC001134254933	1376438966	/nfs/dbraw/zinc/43/89/66/1376438966.db2.gz	NIAZFVLNYJRJTE-HNNXBMFYSA-N	0	3	345.487	3.235	20	30		EGEDHN
CC(C(=O)N[C@H](C)C[C@H](C)NCc1ccccc1C#N)=C1CCC1	ZINC001134307430	1376466397	/nfs/dbraw/zinc/46/63/97/1376466397.db2.gz	MCIFXCNUWKRTKM-LSDHHAIUSA-N	0	3	325.456	3.432	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@H]1CCN(Cc1cccc(CF)n1)C2	ZINC001232534574	1376478289	/nfs/dbraw/zinc/47/82/89/1376478289.db2.gz	RWXJKFWJZJHGNG-RBUKOAKNSA-N	0	3	334.435	3.125	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)CCc2cc(Cl)cs2)cc1	ZINC001134461381	1376549493	/nfs/dbraw/zinc/54/94/93/1376549493.db2.gz	SOFYZJPZVLZTCV-UHFFFAOYSA-N	0	3	347.871	3.112	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)C[C@@H](C)NC/C(Cl)=C\Cl)CCC1	ZINC001134593197	1376615823	/nfs/dbraw/zinc/61/58/23/1376615823.db2.gz	JFNUHYIBXSAORH-HUPKAIDTSA-N	0	3	331.287	3.372	20	30		EGEDHN
C#CCCCC(=O)N(C)C[C@@H]1CCN1C[C@@H]1CCCC(F)(F)C1	ZINC001233948589	1376742231	/nfs/dbraw/zinc/74/22/31/1376742231.db2.gz	YXDTYXDUSFJZHW-CVEARBPZSA-N	0	3	326.431	3.148	20	30		EGEDHN
CN(C[C@H]1CCN1C[C@H]1CCCC(F)(F)C1)C(=O)C#CC(C)(C)C	ZINC001234215563	1376788192	/nfs/dbraw/zinc/78/81/92/1376788192.db2.gz	MORGWZGHHBDZJE-JKSUJKDBSA-N	0	3	340.458	3.394	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](C)C[C@H](C)NCC(=C)Br	ZINC001135183979	1376957154	/nfs/dbraw/zinc/95/71/54/1376957154.db2.gz	AEBLHBCIDPGRTI-STQMWFEESA-N	0	3	331.298	3.370	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2oc(C)nc2C)CC1	ZINC001135384127	1377066858	/nfs/dbraw/zinc/06/68/58/1377066858.db2.gz	ZLTLLCYFBVYTEG-KGLIPLIRSA-N	0	3	333.476	3.411	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C[C@H](C)NCc2conc2CC)CCC1	ZINC001135393916	1377071328	/nfs/dbraw/zinc/07/13/28/1377071328.db2.gz	ABCWGFZPGUFDBE-LSDHHAIUSA-N	0	3	333.476	3.356	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H](C)C[C@@H](C)NCc2oc(CC)nc2C)C1	ZINC001135426606	1377089942	/nfs/dbraw/zinc/08/99/42/1377089942.db2.gz	FTFGIGPUDZJEIJ-KGLIPLIRSA-N	0	3	333.476	3.275	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)C(C)(C)C(F)F	ZINC001135427303	1377090937	/nfs/dbraw/zinc/09/09/37/1377090937.db2.gz	PFEMHVPADCOYRX-UWVGGRQHSA-N	0	3	341.240	3.059	20	30		EGEDHN
CC[C@@H]1CCCC[C@H]1C(=O)NCCNCc1ccc(C#N)c(F)c1	ZINC001136081175	1377333994	/nfs/dbraw/zinc/33/39/94/1377333994.db2.gz	QIBBAAHUBQHIGF-NVXWUHKLSA-N	0	3	331.435	3.120	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@H](CCNC(=O)CCCC2CC2)C1	ZINC001267560634	1377456985	/nfs/dbraw/zinc/45/69/85/1377456985.db2.gz	BICYGQQRDWVVOG-SFHVURJKSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@H]1CCN(Cc1cnn(C(C)C)c1)C2	ZINC001137076571	1377473997	/nfs/dbraw/zinc/47/39/97/1377473997.db2.gz	KTSVYDWGIMFJCJ-RBUKOAKNSA-N	0	3	333.476	3.038	20	30		EGEDHN
CCC#CC(=O)N1CCC[C@]2(CN(C[C@H](CC)CCCC)CCO2)C1	ZINC001268951561	1377532198	/nfs/dbraw/zinc/53/21/98/1377532198.db2.gz	VPTXBBOTXYRNCM-CTNGQTDRSA-N	0	3	348.531	3.310	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@@]3(CCCN3C(=O)C(C)C)C2)c1[O-]	ZINC001138628912	1377756910	/nfs/dbraw/zinc/75/69/10/1377756910.db2.gz	JTSBYVWGQIDNRN-NRFANRHFSA-N	0	3	342.483	3.344	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@@]3(CCCN3C(=O)C(C)C)C2)c1[O-]	ZINC001138628912	1377756911	/nfs/dbraw/zinc/75/69/11/1377756911.db2.gz	JTSBYVWGQIDNRN-NRFANRHFSA-N	0	3	342.483	3.344	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2C[C@@H]3CCC[C@@H]3[C@H]2C(=O)OCC)c1[O-]	ZINC001138630495	1377757881	/nfs/dbraw/zinc/75/78/81/1377757881.db2.gz	XVEFSBBVBNQOPU-SZMVWBNQSA-N	0	3	329.440	3.284	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2C[C@@H]3CCC[C@@H]3[C@H]2C(=O)OCC)c1[O-]	ZINC001138630495	1377757887	/nfs/dbraw/zinc/75/78/87/1377757887.db2.gz	XVEFSBBVBNQOPU-SZMVWBNQSA-N	0	3	329.440	3.284	20	30		EGEDHN
C=CCc1cccc(CN2C[C@@H]3CCC[C@@H]3[C@H]2C(=O)OCC)c1O	ZINC001138630495	1377757891	/nfs/dbraw/zinc/75/78/91/1377757891.db2.gz	XVEFSBBVBNQOPU-SZMVWBNQSA-N	0	3	329.440	3.284	20	30		EGEDHN
C=CCO[C@@H]1CO[C@]2(C1)CCCN(Cc1ccc3c(c1)CCCO3)C2	ZINC001138715653	1377772162	/nfs/dbraw/zinc/77/21/62/1377772162.db2.gz	QODLUKHCYBOZCE-FPOVZHCZSA-N	0	3	343.467	3.338	20	30		EGEDHN
N#Cc1cccc(O[C@@H]2CCCN(Cc3ccc4nonc4c3)C2)c1	ZINC001139222879	1377856020	/nfs/dbraw/zinc/85/60/20/1377856020.db2.gz	YHCWMIJTACCGQJ-QGZVFWFLSA-N	0	3	334.379	3.138	20	30		EGEDHN
N#Cc1ccnc(-c2ccc(CN3CCC[C@H](n4cncn4)C3)cc2)c1	ZINC001139405215	1377880287	/nfs/dbraw/zinc/88/02/87/1377880287.db2.gz	KHEPCMPNPRSMMB-IBGZPJMESA-N	0	3	344.422	3.049	20	30		EGEDHN
C#CCN(Cc1ccccc1-n1cncn1)[C@@H]1CCc2ccccc21	ZINC001139421008	1377880995	/nfs/dbraw/zinc/88/09/95/1377880995.db2.gz	MMHDKSSVCUZDRH-OAQYLSRUSA-N	0	3	328.419	3.390	20	30		EGEDHN
Cc1cccnc1O[C@@H]1CCN(Cc2c[nH]c3c2cccc3C#N)C1	ZINC001139707657	1377938072	/nfs/dbraw/zinc/93/80/72/1377938072.db2.gz	NZMKQECSVOSISO-QGZVFWFLSA-N	0	3	332.407	3.396	20	30		EGEDHN
C=CCn1cc(CN2CCN([C@H]3CCCc4ccccc43)CC2)cn1	ZINC001139771353	1377949128	/nfs/dbraw/zinc/94/91/28/1377949128.db2.gz	XTWCGTDYJAYBFR-NRFANRHFSA-N	0	3	336.483	3.264	20	30		EGEDHN
CCCCOC(=O)[C@@H]1CCN(Cc2c[nH]c3ccc(C#N)cc23)C1	ZINC001140116650	1378011669	/nfs/dbraw/zinc/01/16/69/1378011669.db2.gz	CNYCLTMIWDIDIF-OAHLLOKOSA-N	0	3	325.412	3.205	20	30		EGEDHN
Cc1ccnc(O[C@H]2CCCN(Cc3c[nH]c4ccc(C#N)cc34)C2)n1	ZINC001140117031	1378011997	/nfs/dbraw/zinc/01/19/97/1378011997.db2.gz	KQTAWXRJGVJMJA-KRWDZBQOSA-N	0	3	347.422	3.181	20	30		EGEDHN
C=CCN1C(=O)CC[C@@]12CCCN(Cc1cc(F)cc(OC)c1)CC2	ZINC001140480544	1378070448	/nfs/dbraw/zinc/07/04/48/1378070448.db2.gz	LYHZUTPEZXNYGN-HXUWFJFHSA-N	0	3	346.446	3.367	20	30		EGEDHN
CCc1cccc(CN2CCC[C@@]23CCN(CCCC#N)C3=O)c1	ZINC001273651451	1378107524	/nfs/dbraw/zinc/10/75/24/1378107524.db2.gz	KKBFGLGCRCIADD-FQEVSTJZSA-N	0	3	325.456	3.120	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@H]1CCN(Cc1cnc(CCCC)[nH]1)C2	ZINC001141068223	1378226437	/nfs/dbraw/zinc/22/64/37/1378226437.db2.gz	BCELKKSZYGYOKB-ICSRJNTNSA-N	0	3	347.503	3.326	20	30		EGEDHN
CC1(C(N)=O)CCN(Cc2ccc(C#Cc3ccccc3)s2)CC1	ZINC001141977641	1378400401	/nfs/dbraw/zinc/40/04/01/1378400401.db2.gz	LDYIDNFEADQWPM-UHFFFAOYSA-N	0	3	338.476	3.235	20	30		EGEDHN
C[C@@H]1CN(Cc2c[nH]c3cc(C#N)ccc23)CC[C@]1(O)C(F)(F)F	ZINC001142911740	1378508097	/nfs/dbraw/zinc/50/80/97/1378508097.db2.gz	HTCKJRCZHVKWBY-BDJLRTHQSA-N	0	3	337.345	3.175	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3c[nH]c4cc(C#N)ccc34)C2)C1=O	ZINC001142916614	1378508266	/nfs/dbraw/zinc/50/82/66/1378508266.db2.gz	GLRKBPLYDJKPRC-NRFANRHFSA-N	0	3	348.450	3.040	20	30		EGEDHN
N#Cc1ccc2c(CN3CCc4ncnc(C5CC5)c4CC3)c[nH]c2c1	ZINC001142928845	1378511530	/nfs/dbraw/zinc/51/15/30/1378511530.db2.gz	MRSNHMLPBXTXQG-UHFFFAOYSA-N	0	3	343.434	3.308	20	30		EGEDHN
C#Cc1ccc(CN2CCC(Oc3ccc(C(=O)OC)cc3)CC2)cc1	ZINC001144573263	1378746795	/nfs/dbraw/zinc/74/67/95/1378746795.db2.gz	GCNWETOURHYYJO-UHFFFAOYSA-N	0	3	349.430	3.498	20	30		EGEDHN
CC(C)OCCCC(=O)N[C@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001146797072	1378921508	/nfs/dbraw/zinc/92/15/08/1378921508.db2.gz	ILELSALZLSGKLN-DLBZAZTESA-N	0	3	345.487	3.136	20	30		EGEDHN
CC(C)(Cc1ccccc1)C(=O)NCCNCc1cccc(C#N)c1	ZINC001146869183	1378937791	/nfs/dbraw/zinc/93/77/91/1378937791.db2.gz	MQHKSYOODHXVTP-UHFFFAOYSA-N	0	3	335.451	3.033	20	30		EGEDHN
Cc1cc(C(=O)N(C)[C@H](CNCc2ccc(C#N)s2)C2CC2)co1	ZINC001283493603	1378985985	/nfs/dbraw/zinc/98/59/85/1378985985.db2.gz	LLWMAAFFIYGBSL-QGZVFWFLSA-N	0	3	343.452	3.162	20	30		EGEDHN
C#CCCCCCC(=O)N1CC2(C1)CCN(Cc1ncccc1C)C2	ZINC001148059973	1379111189	/nfs/dbraw/zinc/11/11/89/1379111189.db2.gz	SYCQLRVQMOBLBY-UHFFFAOYSA-N	0	3	339.483	3.008	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3ccc(OCCCC)cc3)C2)C1	ZINC001148733163	1379255908	/nfs/dbraw/zinc/25/59/08/1379255908.db2.gz	HRYQHYIOLUCZLX-UHFFFAOYSA-N	0	3	328.456	3.199	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccccc2C2CCC2)s1	ZINC001149364471	1379369987	/nfs/dbraw/zinc/36/99/87/1379369987.db2.gz	HVEOYKMKJOMITF-UHFFFAOYSA-N	0	3	339.464	3.407	20	30		EGEDHN
C[C@@H]1CCN(Cc2ccccc2)C[C@@H]1NC(=O)Cc1cccc(C#N)c1	ZINC001150143986	1379502726	/nfs/dbraw/zinc/50/27/26/1379502726.db2.gz	WAAAUGCPFYIWRY-UTKZUKDTSA-N	0	3	347.462	3.128	20	30		EGEDHN
Cc1cc(C)c(C(=O)NCCNCc2ccc(C#N)s2)c(C)c1	ZINC001150164415	1379506556	/nfs/dbraw/zinc/50/65/56/1379506556.db2.gz	XBNNWZZHIXDOGI-UHFFFAOYSA-N	0	3	327.453	3.065	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@H]1CN(Cc2ccc(C)cc2)CCCO1	ZINC001150380280	1379541966	/nfs/dbraw/zinc/54/19/66/1379541966.db2.gz	QTVYLNUSTSFKHD-IBGZPJMESA-N	0	3	344.499	3.304	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)[C@H](C)CC2CCCCC2)C1	ZINC001150417563	1379551889	/nfs/dbraw/zinc/55/18/89/1379551889.db2.gz	NUCVWNPKSJGCPX-MJGOQNOKSA-N	0	3	336.520	3.376	20	30		EGEDHN
CCCCCCCCC(=O)NC[C@H]1CN(CCCF)CCCO1	ZINC001150625681	1379581642	/nfs/dbraw/zinc/58/16/42/1379581642.db2.gz	ODULEPXHMZQSAX-KRWDZBQOSA-N	0	3	330.488	3.304	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)CC(C)(C)c2ccccc2)C1	ZINC001150773199	1379611914	/nfs/dbraw/zinc/61/19/14/1379611914.db2.gz	YTHIIHAWQVELBG-LJQANCHMSA-N	0	3	344.499	3.138	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@@H]2CCC[C@@H](F)C2)CC1	ZINC001151128013	1379663722	/nfs/dbraw/zinc/66/37/22/1379663722.db2.gz	DGTOFCIFNVWWIQ-IAGOWNOFSA-N	0	3	340.483	3.078	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2ccc([C@H]3C[C@@H]3C)o2)CC1	ZINC001151128609	1379665119	/nfs/dbraw/zinc/66/51/19/1379665119.db2.gz	QGKMTBUEGSOXDE-HOTGVXAUSA-N	0	3	346.471	3.190	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2cc3ccsc3[nH]2)CC1	ZINC001151237507	1379684368	/nfs/dbraw/zinc/68/43/68/1379684368.db2.gz	WUKFQJZKGYVKCA-UHFFFAOYSA-N	0	3	347.484	3.016	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)C[C@H]2CC=CCC2)CC1	ZINC001151254392	1379687945	/nfs/dbraw/zinc/68/79/45/1379687945.db2.gz	ITBRXUKYCOGFFM-SFHVURJKSA-N	0	3	334.504	3.296	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)Cc1cccs1	ZINC001151560529	1379738344	/nfs/dbraw/zinc/73/83/44/1379738344.db2.gz	YVJJDLDDIUJMJK-OAHLLOKOSA-N	0	3	341.480	3.189	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)C1CCCCC1	ZINC001151637531	1379751293	/nfs/dbraw/zinc/75/12/93/1379751293.db2.gz	KFRFBTJSGJBBHE-MRXNPFEDSA-N	0	3	327.472	3.465	20	30		EGEDHN
C=CC[C@H](C(=O)NCCNCc1cnc(C)s1)c1ccccc1	ZINC001151838364	1379793280	/nfs/dbraw/zinc/79/32/80/1379793280.db2.gz	RAPMORWXIOBECY-KRWDZBQOSA-N	0	3	329.469	3.017	20	30		EGEDHN
CC1=CC[C@](C)(C(=O)NCCNCc2ccc(C#N)c(F)c2)CC1	ZINC001151912755	1379814560	/nfs/dbraw/zinc/81/45/60/1379814560.db2.gz	AERYBVUAGRMDML-IBGZPJMESA-N	0	3	329.419	3.040	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)C(=O)NCCNCc1ccc(F)cc1	ZINC001151923372	1379816039	/nfs/dbraw/zinc/81/60/39/1379816039.db2.gz	XRUVTLNABWHOCZ-LJQANCHMSA-N	0	3	340.442	3.467	20	30		EGEDHN
COc1ccc(CNCCNC(=O)C(C)(C)CC(C)(C)C)cc1C#N	ZINC001151938622	1379818998	/nfs/dbraw/zinc/81/89/98/1379818998.db2.gz	PKJSJXNLAKTSHZ-UHFFFAOYSA-N	0	3	345.487	3.235	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)/C=C(\C)C1CC1	ZINC001152128585	1379868084	/nfs/dbraw/zinc/86/80/84/1379868084.db2.gz	JWXRAVHJPXTEGP-AAWPKVBNSA-N	0	3	343.446	3.380	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cccc(C3CC3)c2)cc1F	ZINC001152722253	1379976065	/nfs/dbraw/zinc/97/60/65/1379976065.db2.gz	UJMNIYRMJJLJBK-UHFFFAOYSA-N	0	3	337.398	3.094	20	30		EGEDHN
CC1(C)CCC[C@@H](C(=O)NCCNCc2ccc(F)c(C#N)c2)C1	ZINC001152832244	1379985431	/nfs/dbraw/zinc/98/54/31/1379985431.db2.gz	XXVHVCCWDJZDOK-OAHLLOKOSA-N	0	3	331.435	3.120	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H](C)N(CC)Cc1ccc(F)c(F)c1	ZINC001152842230	1379986127	/nfs/dbraw/zinc/98/61/27/1379986127.db2.gz	SEZHHFMOEOYSDU-OAHLLOKOSA-N	0	3	336.426	3.485	20	30		EGEDHN
Cc1ccc(CCCCC(=O)NCCNCc2ccc(C#N)cc2)cc1	ZINC001153191882	1380032814	/nfs/dbraw/zinc/03/28/14/1380032814.db2.gz	TUZJDFZUKKTEGF-UHFFFAOYSA-N	0	3	349.478	3.486	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc(-c3ccccc3)[nH]2)cc1	ZINC001153432829	1380075315	/nfs/dbraw/zinc/07/53/15/1380075315.db2.gz	ALMLBERJIFJQHI-UHFFFAOYSA-N	0	3	344.418	3.073	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)C1C=CC=CC=C1	ZINC001153625635	1380106768	/nfs/dbraw/zinc/10/67/68/1380106768.db2.gz	BHYRFXAKICJAGT-QGZVFWFLSA-N	0	3	335.451	3.183	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)[C@@H]1CCC(F)(F)C1	ZINC001153743809	1380121378	/nfs/dbraw/zinc/12/13/78/1380121378.db2.gz	ONQYDRJDGLZIHB-RHSMWYFYSA-N	0	3	349.425	3.320	20	30		EGEDHN
C#CCC1(C(=O)NC[C@@H](C)N(CC)Cc2ccc(C#N)cc2)CCC1	ZINC001153776077	1380127308	/nfs/dbraw/zinc/12/73/08/1380127308.db2.gz	AIHZEEBURGAWNQ-QGZVFWFLSA-N	0	3	337.467	3.078	20	30		EGEDHN
C=CCC[C@@H](C(=O)NCCNCc1cnccc1C)c1ccccc1	ZINC001153817907	1380135761	/nfs/dbraw/zinc/13/57/61/1380135761.db2.gz	UDUXEVSFKJSBOE-HXUWFJFHSA-N	0	3	337.467	3.346	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)CC(C)(C)c1ccc(F)cc1	ZINC001153831041	1380139668	/nfs/dbraw/zinc/13/96/68/1380139668.db2.gz	RLLJZUMJQQQJHZ-MRXNPFEDSA-N	0	3	332.463	3.343	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)c1cccc2nc3ccccc3nc21	ZINC001153870398	1380147040	/nfs/dbraw/zinc/14/70/40/1380147040.db2.gz	AVCFMSLELSTCBH-HNNXBMFYSA-N	0	3	346.434	3.163	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@@H]1CCc2c1cccc2Cl	ZINC001154355609	1380263000	/nfs/dbraw/zinc/26/30/00/1380263000.db2.gz	FLFDTXLXZIPQLK-RHSMWYFYSA-N	0	3	332.875	3.220	20	30		EGEDHN
CCN(Cc1ccc(OC)c(C#N)c1)[C@H](C)CNC(=O)CC1(C)CC1	ZINC001154373503	1380266510	/nfs/dbraw/zinc/26/65/10/1380266510.db2.gz	KBXKURINLHQTJY-OAHLLOKOSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NC[C@@H](C)N(CC)Cc1ccsc1	ZINC001154477565	1380285076	/nfs/dbraw/zinc/28/50/76/1380285076.db2.gz	POJIJPYXRNCAMV-QAPCUYQASA-N	0	3	338.517	3.304	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H](C)N(CC)Cc1ccc2nonc2c1	ZINC001154584421	1380310671	/nfs/dbraw/zinc/31/06/71/1380310671.db2.gz	GFMGBOBZHIOXCL-CQSZACIVSA-N	0	3	344.459	3.152	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)c1cocc1C	ZINC001154661561	1380326578	/nfs/dbraw/zinc/32/65/78/1380326578.db2.gz	WCDOQUNDDQZTCH-OAHLLOKOSA-N	0	3	325.412	3.100	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)C(C)(C)C1CC1	ZINC001154757793	1380347446	/nfs/dbraw/zinc/34/74/46/1380347446.db2.gz	UWFLZHNUGKWZHZ-CQSZACIVSA-N	0	3	345.462	3.460	20	30		EGEDHN
CCCC1(C(=O)NC[C@@H](C)N(CC)Cc2ccc(C#N)cc2)CC1	ZINC001155085750	1380405859	/nfs/dbraw/zinc/40/58/59/1380405859.db2.gz	QOHULTXCXFKIPF-MRXNPFEDSA-N	0	3	327.472	3.465	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)C(C)(C)C(F)F	ZINC001155126128	1380413549	/nfs/dbraw/zinc/41/35/49/1380413549.db2.gz	DRNFGTZYTKIRHG-CYBMUJFWSA-N	0	3	337.414	3.176	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)C1CC2(CC2)C1	ZINC001155167958	1380418373	/nfs/dbraw/zinc/41/83/73/1380418373.db2.gz	WJTJHIOQXNGYBL-CQSZACIVSA-N	0	3	343.446	3.214	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@@H](Cc1ccccc1)C(C)C	ZINC001155210486	1380425521	/nfs/dbraw/zinc/42/55/21/1380425521.db2.gz	IIHHGFZYACZFSH-QUCCMNQESA-N	0	3	328.500	3.351	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)[C@@H](C)C(C)(F)F	ZINC001155295100	1380434272	/nfs/dbraw/zinc/43/42/72/1380434272.db2.gz	KYCJOANPOJTLLN-ZIAGYGMSSA-N	0	3	337.414	3.176	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)Cc1ccc(C(C)(C)C)cc1	ZINC001155484694	1380459270	/nfs/dbraw/zinc/45/92/70/1380459270.db2.gz	NTPRJYRZVJZIEY-QGZVFWFLSA-N	0	3	328.500	3.377	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)[C@H]1CC12CCC2	ZINC001155504731	1380462078	/nfs/dbraw/zinc/46/20/78/1380462078.db2.gz	YYVSYTCXXKGNGJ-CRAIPNDOSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@H]1CCN(Cc2ccccc2)C[C@@H]1N(C)c1nccc(F)c1C#N	ZINC001156342076	1380561690	/nfs/dbraw/zinc/56/16/90/1380561690.db2.gz	VTPOLLAYMGPITO-KXBFYZLASA-N	0	3	338.430	3.439	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)CCCOc1ccc(C)cc1	ZINC001156740437	1380620885	/nfs/dbraw/zinc/62/08/85/1380620885.db2.gz	LUKQOXPECAJULF-GOSISDBHSA-N	0	3	330.472	3.004	20	30		EGEDHN
C#CCCCC(=O)NCCCNCc1nc(C)c(C(C)(C)C)s1	ZINC001157171485	1380793531	/nfs/dbraw/zinc/79/35/31/1380793531.db2.gz	VJYRMZAIIZJNCT-UHFFFAOYSA-N	0	3	335.517	3.148	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCCC[C@@H]1CN(C)C/C=C\c1ccccc1	ZINC001157695487	1381005219	/nfs/dbraw/zinc/00/52/19/1381005219.db2.gz	BELWGRCDRPEGSW-YFZQEUPRSA-N	0	3	325.456	3.172	20	30		EGEDHN
C=CCCC(=O)N1CCCC[C@@H]1CN(C)CCc1scnc1C	ZINC001157705972	1381009643	/nfs/dbraw/zinc/00/96/43/1381009643.db2.gz	PXXQVMBCLQDEJH-MRXNPFEDSA-N	0	3	335.517	3.273	20	30		EGEDHN
N#Cc1cc(Cl)nc(C(F)(F)N2CCN[C@H](c3ccccc3)C2)c1	ZINC001157765514	1381027010	/nfs/dbraw/zinc/02/70/10/1381027010.db2.gz	UKZMJCKYOQTCEX-AWEZNQCLSA-N	0	3	348.784	3.302	20	30		EGEDHN
CCC(CC)C(=O)N[C@@H]1CCN(Cc2ccc(C#N)cc2)[C@H](C)C1	ZINC001328237694	1388694433	/nfs/dbraw/zinc/69/44/33/1388694433.db2.gz	BORXCKQXOQGDBD-DNVCBOLYSA-N	0	3	327.472	3.464	20	30		EGEDHN
CC(C)C#CC(=O)N1CCCC[C@@H]1CN(C)CCOCCC(C)C	ZINC001157930544	1381074342	/nfs/dbraw/zinc/07/43/42/1381074342.db2.gz	IBJZWQFWHLQRMY-LJQANCHMSA-N	0	3	336.520	3.021	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)CCc1ncc(C(C)(C)C)o1	ZINC001158077575	1381122509	/nfs/dbraw/zinc/12/25/09/1381122509.db2.gz	VBCXMJYELDNWEZ-MRXNPFEDSA-N	0	3	347.503	3.404	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)Cc1cncc2ccccc21	ZINC001158082759	1381123393	/nfs/dbraw/zinc/12/33/93/1381123393.db2.gz	KIHZNINPYMQLMM-LJQANCHMSA-N	0	3	337.467	3.276	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1CCOc2c(F)cccc21	ZINC001158206760	1381159247	/nfs/dbraw/zinc/15/92/47/1381159247.db2.gz	GBDXJVQLCJJAJL-NVXWUHKLSA-N	0	3	346.446	3.191	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCCC[C@@H]1CN(C)CCOCC(F)F	ZINC001158378053	1381224632	/nfs/dbraw/zinc/22/46/32/1381224632.db2.gz	VMBAFEYGBFTTBU-HZPDHXFCSA-N	0	3	346.462	3.183	20	30		EGEDHN
CN1CCN(C(F)(F)c2cc(Cl)ncc2C#N)C2(CCCC2)C1	ZINC001158410667	1381235005	/nfs/dbraw/zinc/23/50/05/1381235005.db2.gz	XKCHKEQBSJYQJS-UHFFFAOYSA-N	0	3	340.805	3.216	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCCNCc1cnc(Cl)s1	ZINC001158746897	1381379803	/nfs/dbraw/zinc/37/98/03/1381379803.db2.gz	LCSNVLDFFXBLJZ-UHFFFAOYSA-N	0	3	327.881	3.161	20	30		EGEDHN
C[C@H](c1ccccc1)N(c1cc2c(nn1)CCNC2)C1=CC(=O)CCC1	ZINC001158796959	1381403460	/nfs/dbraw/zinc/40/34/60/1381403460.db2.gz	MIBHGLYMAFXXNO-OAHLLOKOSA-N	0	3	348.450	3.327	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)COc1c(C)cccc1C	ZINC001158830040	1381422267	/nfs/dbraw/zinc/42/22/67/1381422267.db2.gz	OIQMCTPJEJZTCI-GOSISDBHSA-N	0	3	330.472	3.181	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCCNCc1ccn(C2CCCC2)n1	ZINC001158887220	1381449900	/nfs/dbraw/zinc/44/99/00/1381449900.db2.gz	RTHNSRYNOAEFCZ-UHFFFAOYSA-N	0	3	332.492	3.196	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)CCOCc1ccccc1	ZINC001158894075	1381451759	/nfs/dbraw/zinc/45/17/59/1381451759.db2.gz	MTEHCYPRXHUMHG-LJQANCHMSA-N	0	3	330.472	3.092	20	30		EGEDHN
C=CCCOCC(=O)N1CCCC[C@@H]1CN(C)Cc1cccc(F)c1	ZINC001158942449	1381475519	/nfs/dbraw/zinc/47/55/19/1381475519.db2.gz	IBAVGCQYPJXBSH-LJQANCHMSA-N	0	3	348.462	3.231	20	30		EGEDHN
C=CCCC(=O)NCCC1=CCN(Cc2ccc(OC)cc2)CC1	ZINC001159538674	1381821998	/nfs/dbraw/zinc/82/19/98/1381821998.db2.gz	GUSYSTJTXBPBKL-UHFFFAOYSA-N	0	3	328.456	3.300	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCC1=CCN([C@@H]2CCc3ccc(F)cc32)CC1	ZINC001159593585	1381839384	/nfs/dbraw/zinc/83/93/84/1381839384.db2.gz	HACXWHGDJJJORD-IFXJQAMLSA-N	0	3	341.430	3.111	20	30		EGEDHN
C=CCOCC(=O)NCCC1=CCN(C/C=C\c2ccccc2)CC1	ZINC001159600929	1381843734	/nfs/dbraw/zinc/84/37/34/1381843734.db2.gz	JGKKPTUPQIEJNY-TWGQIWQCSA-N	0	3	340.467	3.041	20	30		EGEDHN
C#CCC1(C(=O)NCCCNCc2nc(C(C)(C)C)cs2)CCC1	ZINC001159657999	1381861173	/nfs/dbraw/zinc/86/11/73/1381861173.db2.gz	HQWVYCLVLJTLCY-UHFFFAOYSA-N	0	3	347.528	3.230	20	30		EGEDHN
C=CCOC(=O)[C@@H](N)CCCCNc1nc(C)cc2ccccc21	ZINC001159925626	1381939654	/nfs/dbraw/zinc/93/96/54/1381939654.db2.gz	QDYTYKWDJSHJNT-KRWDZBQOSA-N	0	3	327.428	3.182	20	30		EGEDHN
C=CCn1cccc1C(=O)NCCCN[C@H](C)c1cc(F)ccc1F	ZINC001159988352	1381961074	/nfs/dbraw/zinc/96/10/74/1381961074.db2.gz	XMBQMWKLULBFOC-CQSZACIVSA-N	0	3	347.409	3.423	20	30		EGEDHN
C=CCn1cccc1C(=O)NCCCN[C@H](C)c1c(F)cccc1F	ZINC001159988179	1381961172	/nfs/dbraw/zinc/96/11/72/1381961172.db2.gz	RSQKGDGAXLGIME-CQSZACIVSA-N	0	3	347.409	3.423	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)CC2(c3ccccc3)CC2)CC1	ZINC001160314059	1382069860	/nfs/dbraw/zinc/06/98/60/1382069860.db2.gz	FMVVBKJPKSTXDB-UHFFFAOYSA-N	0	3	336.479	3.270	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)C/C=C/Cc1ccccc1	ZINC001160319525	1382071800	/nfs/dbraw/zinc/07/18/00/1382071800.db2.gz	WALWFNRVLCJRCQ-QPJJXVBHSA-N	0	3	347.462	3.343	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2nc(C(C)(C)C)cs2)CC1	ZINC001160416514	1382099010	/nfs/dbraw/zinc/09/90/10/1382099010.db2.gz	OQWSXLBQNCUXSM-UHFFFAOYSA-N	0	3	345.512	3.216	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cccc3ccc(C)nc32)CC1	ZINC001160449863	1382106548	/nfs/dbraw/zinc/10/65/48/1382106548.db2.gz	PZQUUNPODVBRLE-UHFFFAOYSA-N	0	3	335.451	3.481	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)Cc2ccc3cnccc3c2)CC1	ZINC001160658040	1382161798	/nfs/dbraw/zinc/16/17/98/1382161798.db2.gz	PHVKKNIIHABMPL-UHFFFAOYSA-N	0	3	335.451	3.102	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cnc3ccccc3c2C)CC1	ZINC001160700550	1382173938	/nfs/dbraw/zinc/17/39/38/1382173938.db2.gz	XBSSFSFTZIXCCH-UHFFFAOYSA-N	0	3	347.462	3.319	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@]1(C)CCC[C@@H]1CC	ZINC001160980052	1382260904	/nfs/dbraw/zinc/26/09/04/1382260904.db2.gz	YCZHPHVVWMGNIA-DZGCQCFKSA-N	0	3	331.298	3.207	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCC2=CCN(CCOCC3CCC3)CC2)C1	ZINC001161173859	1382325634	/nfs/dbraw/zinc/32/56/34/1382325634.db2.gz	VXIDMPVPYXZMCK-UHFFFAOYSA-N	0	3	346.515	3.298	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@H](C)Cc2ccccc2F)CC1	ZINC001161199338	1382338134	/nfs/dbraw/zinc/33/81/34/1382338134.db2.gz	IFZSIKDQIUICQG-QGZVFWFLSA-N	0	3	342.458	3.166	20	30		EGEDHN
CCCCCCCCCCN(C)C(=O)[C@@H](N)CCCCNC(C)=O	ZINC001161226169	1382347522	/nfs/dbraw/zinc/34/75/22/1382347522.db2.gz	GEBSDIVUVSIUOU-SFHVURJKSA-N	0	3	341.540	3.219	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)Cc2c(F)cccc2Cl)CC1	ZINC001161766124	1382499231	/nfs/dbraw/zinc/49/92/31/1382499231.db2.gz	INLOTMBKCUYYKQ-UHFFFAOYSA-N	0	3	348.849	3.183	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@]2(c3ccccc3)CCCO2)CC1	ZINC001161779016	1382503225	/nfs/dbraw/zinc/50/32/25/1382503225.db2.gz	AHBFKTKJERYVHI-NRFANRHFSA-N	0	3	340.467	3.017	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H](C)Oc2ccc(C)cc2)CC1	ZINC001161825265	1382521656	/nfs/dbraw/zinc/52/16/56/1382521656.db2.gz	YRKWEYITEWPSIK-QGZVFWFLSA-N	0	3	328.456	3.087	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H](C)Cc2ccc(C)cc2)CC1	ZINC001161963826	1382574803	/nfs/dbraw/zinc/57/48/03/1382574803.db2.gz	TZBMWSODMNUGIS-IBGZPJMESA-N	0	3	338.495	3.335	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H]2Cc3c2cccc3Cl)CC1	ZINC001161982510	1382586478	/nfs/dbraw/zinc/58/64/78/1382586478.db2.gz	HKGYUQPBLCJEEH-GOSISDBHSA-N	0	3	342.870	3.141	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCC1(COC)CCN(C[C@H](F)CC)CC1	ZINC001162428548	1382756637	/nfs/dbraw/zinc/75/66/37/1382756637.db2.gz	JCIRBNXFLGBYNF-DLBZAZTESA-N	0	3	342.499	3.182	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)[C@H](c1ccccc1)C1CC1	ZINC001162508302	1382776346	/nfs/dbraw/zinc/77/63/46/1382776346.db2.gz	UHPFHGMRJMATBY-OAQYLSRUSA-N	0	3	347.462	3.348	20	30		EGEDHN
C#CCN1CCC(CNC(=O)[C@@H](CC)CC2CCCC2)(COC)CC1	ZINC001162513824	1382778178	/nfs/dbraw/zinc/77/81/78/1382778178.db2.gz	VIEDQKYMCQMZPB-IBGZPJMESA-N	0	3	348.531	3.071	20	30		EGEDHN
Cc1ccc2c(c1)[C@H](Nc1ccc(/N=C/N(C)C)c(C#N)c1)C(=O)N2	ZINC001162577525	1382796528	/nfs/dbraw/zinc/79/65/28/1382796528.db2.gz	ZQQKIJPGSYHPED-NIQDBXHUSA-N	0	3	333.395	3.193	20	30		EGEDHN
CCC(=O)N(CCNCc1cccc(C#N)c1)CCc1ccccc1	ZINC001162651128	1382821358	/nfs/dbraw/zinc/82/13/58/1382821358.db2.gz	HFBBEJBBODZQCO-UHFFFAOYSA-N	0	3	335.451	3.129	20	30		EGEDHN
C[C@@H](C#N)C(=O)N(CCNCc1ccsc1)CCc1ccccc1	ZINC001162741006	1382854050	/nfs/dbraw/zinc/85/40/50/1382854050.db2.gz	DRDZJKNJABMQNJ-INIZCTEOSA-N	0	3	341.480	3.069	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)c1sccc1F	ZINC001162802562	1382876945	/nfs/dbraw/zinc/87/69/45/1382876945.db2.gz	LSUISCQJVOAQCD-UHFFFAOYSA-N	0	3	344.455	3.185	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C(C)(C)C(=C)Cl	ZINC001162822055	1382886052	/nfs/dbraw/zinc/88/60/52/1382886052.db2.gz	FZGFWZVGXFJYKY-UHFFFAOYSA-N	0	3	332.875	3.059	20	30		EGEDHN
C=CCC(CC=C)C(=O)N(CCNCCF)CCc1ccccc1	ZINC001162822697	1382886868	/nfs/dbraw/zinc/88/68/68/1382886868.db2.gz	ZRBIKKQDRSNUMZ-UHFFFAOYSA-N	0	3	332.463	3.385	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)CC1CC(C)(C)C1	ZINC001162898054	1382909247	/nfs/dbraw/zinc/90/92/47/1382909247.db2.gz	VCPDAABFMDDSAI-UHFFFAOYSA-N	0	3	340.511	3.497	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CCC[C@@H](C)C1	ZINC001162907152	1382911584	/nfs/dbraw/zinc/91/15/84/1382911584.db2.gz	YWWISXGFVUXRRI-TZIWHRDSSA-N	0	3	340.511	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H](C)CC1CCCC1	ZINC001162952239	1382925924	/nfs/dbraw/zinc/92/59/24/1382925924.db2.gz	IQEDOYGCNDUMQU-IBGZPJMESA-N	0	3	340.511	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1cccc(C)c1C	ZINC001162992845	1382940953	/nfs/dbraw/zinc/94/09/53/1382940953.db2.gz	YXNBXHXGGHTODT-UHFFFAOYSA-N	0	3	334.463	3.211	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CCCC(C)(C)C1	ZINC001163007026	1382946788	/nfs/dbraw/zinc/94/67/88/1382946788.db2.gz	NFIFQTLONOFXPY-HXUWFJFHSA-N	0	3	340.511	3.497	20	30		EGEDHN
N#Cc1c(Cl)cc(Br)cc1N[C@H]1CN2CCC1CC2	ZINC001163393131	1383040805	/nfs/dbraw/zinc/04/08/05/1383040805.db2.gz	NDMHFLRVGNDICL-AWEZNQCLSA-N	0	3	340.652	3.480	20	30		EGEDHN
CC[C@@H](C)C(=O)NCCC1(CNCc2ccc(C#N)cc2F)CC1	ZINC001163496868	1383065557	/nfs/dbraw/zinc/06/55/57/1383065557.db2.gz	VUNPYAUODBAXDY-CQSZACIVSA-N	0	3	331.435	3.120	20	30		EGEDHN
C/C(=C\C(=O)NCCC1(CNCc2ccccc2C#N)CC1)C1CC1	ZINC001163614964	1383088629	/nfs/dbraw/zinc/08/86/29/1383088629.db2.gz	NGTLFFICOOZEBY-FOWTUZBSSA-N	0	3	337.467	3.291	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCCNCc1ccccc1Br	ZINC001163963511	1383140462	/nfs/dbraw/zinc/14/04/62/1383140462.db2.gz	BULRSHFGNRDEBQ-UHFFFAOYSA-N	0	3	339.277	3.257	20	30		EGEDHN
Cc1cc(CN)nn1-c1ccc(C)c(NC(=O)c2cccc(C#N)c2)c1	ZINC001163984698	1383143146	/nfs/dbraw/zinc/14/31/46/1383143146.db2.gz	ARYHOWGKBQHBRV-UHFFFAOYSA-N	0	3	345.406	3.072	20	30		EGEDHN
C#CCCCC(=O)NCCC1(CNCc2cc(F)ccc2OC)CC1	ZINC001164308913	1383176371	/nfs/dbraw/zinc/17/63/71/1383176371.db2.gz	OVHGYALANHPXFN-UHFFFAOYSA-N	0	3	346.446	3.014	20	30		EGEDHN
Cc1ccc([C@H](C#N)c2ccc(N3CCN(C(C)(C)C)CC3)nn2)cc1	ZINC001165089093	1383226052	/nfs/dbraw/zinc/22/60/52/1383226052.db2.gz	VRNRUGFYZZTNFZ-SFHVURJKSA-N	0	3	349.482	3.361	20	30		EGEDHN
Cc1c(F)ccc2nc(Cl)c(C#N)c(N3CC(C)(N(C)C)C3)c12	ZINC001165122292	1383231888	/nfs/dbraw/zinc/23/18/88/1383231888.db2.gz	VKBAQHWFWORWEZ-UHFFFAOYSA-N	0	3	332.810	3.348	20	30		EGEDHN
C=C(C)CCC(=O)NCCC1(CNCc2cccc(Cl)n2)CC1	ZINC001165258603	1383259406	/nfs/dbraw/zinc/25/94/06/1383259406.db2.gz	HNRFFUSYTBTGHI-UHFFFAOYSA-N	0	3	335.879	3.467	20	30		EGEDHN
C[C@H]1CCCC[C@@H]1C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001165411640	1383290386	/nfs/dbraw/zinc/29/03/86/1383290386.db2.gz	VCNAPGNYHMWXDN-YOEHRIQHSA-N	0	3	331.435	3.120	20	30		EGEDHN
CCOC(=O)c1cc(NCC2CN(Cc3ccccc3)C2)ccc1C#N	ZINC001165470012	1383299587	/nfs/dbraw/zinc/29/95/87/1383299587.db2.gz	YFXSXGNHDCHVCK-UHFFFAOYSA-N	0	3	349.434	3.279	20	30		EGEDHN
CC1(C(=O)NCCCNCc2ccc(C#N)cc2F)CCCCC1	ZINC001165760561	1383340857	/nfs/dbraw/zinc/34/08/57/1383340857.db2.gz	IANRTIFGLCLENO-UHFFFAOYSA-N	0	3	331.435	3.264	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2c[nH]c3ccccc23)CC1	ZINC001166010381	1383376432	/nfs/dbraw/zinc/37/64/32/1383376432.db2.gz	AVVPZIZNGAEJMA-UHFFFAOYSA-N	0	3	331.847	3.410	20	30		EGEDHN
C[C@@H]1CCC[C@@]1(C)C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001166053418	1383382884	/nfs/dbraw/zinc/38/28/84/1383382884.db2.gz	CLYBGGKTFFMGHA-AUUYWEPGSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2c(C)cc(C)nc2C)CC1	ZINC001166294312	1383409702	/nfs/dbraw/zinc/40/97/02/1383409702.db2.gz	JEHCZSSOQVZDFW-UHFFFAOYSA-N	0	3	335.879	3.249	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001166579255	1383440605	/nfs/dbraw/zinc/44/06/05/1383440605.db2.gz	HVRJVDYKDYXUGX-UHFFFAOYSA-N	0	3	325.456	3.147	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCCC1(CNCc2oc(C)nc2C)CC1	ZINC001166764999	1383474120	/nfs/dbraw/zinc/47/41/20/1383474120.db2.gz	DUJSNOVDMJPUHR-MRXNPFEDSA-N	0	3	333.476	3.270	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cc3ccccc3n2C)CC1	ZINC001166882423	1383493719	/nfs/dbraw/zinc/49/37/19/1383493719.db2.gz	LSXINFZEBXNHAH-UHFFFAOYSA-N	0	3	345.874	3.421	20	30		EGEDHN
C=CCCCC(=O)NCCC1(CNCc2c(C)onc2CC)CC1	ZINC001166909839	1383498100	/nfs/dbraw/zinc/49/81/00/1383498100.db2.gz	CFOMHNZMXXQCFT-UHFFFAOYSA-N	0	3	333.476	3.278	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)C1[C@H]2CCCCCC[C@H]12	ZINC001167296346	1383588437	/nfs/dbraw/zinc/58/84/37/1383588437.db2.gz	NWAWDQNHUBIIDY-OALUTQOASA-N	0	3	339.483	3.371	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCC1(CNCc2cccc(OC)n2)CC1	ZINC001167339814	1383602912	/nfs/dbraw/zinc/60/29/12/1383602912.db2.gz	NTNCVWPAZQBHCP-UHFFFAOYSA-N	0	3	345.487	3.069	20	30		EGEDHN
CC(C)[C@H](C)C(=O)NCCC1(CNCc2cc(C#N)ccc2F)CC1	ZINC001167366705	1383611916	/nfs/dbraw/zinc/61/19/16/1383611916.db2.gz	PGCCHSMQPKEMEJ-HNNXBMFYSA-N	0	3	345.462	3.366	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@H](C)c2c(C)noc2C)CC1	ZINC001167459210	1383638138	/nfs/dbraw/zinc/63/81/38/1383638138.db2.gz	WSWWBLRZNQVECA-GFCCVEGCSA-N	0	3	339.867	3.024	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2occ3c2CCCC3)CC1	ZINC001167874795	1383763146	/nfs/dbraw/zinc/76/31/46/1383763146.db2.gz	GVDXXJPDMPKVMT-UHFFFAOYSA-N	0	3	336.863	3.401	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cc3c(s2)CCC3)CC1	ZINC001167987918	1383789191	/nfs/dbraw/zinc/78/91/91/1383789191.db2.gz	RFMLWLLKWBMMKO-UHFFFAOYSA-N	0	3	338.904	3.479	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)CC(F)(F)C(F)(F)F)CC1	ZINC001168565413	1383937922	/nfs/dbraw/zinc/93/79/22/1383937922.db2.gz	OCYUUCUUOQICMW-UHFFFAOYSA-N	0	3	348.743	3.203	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)C[C@@H]1CCc2ccccc21	ZINC001168834948	1384026452	/nfs/dbraw/zinc/02/64/52/1384026452.db2.gz	HCLNDUXTRHDQRX-SFHVURJKSA-N	0	3	347.462	3.274	20	30		EGEDHN
C[C@@]1(CNCc2cc(C#N)ccc2Br)CCCC[C@H]1O	ZINC001308301816	1384117760	/nfs/dbraw/zinc/11/77/60/1384117760.db2.gz	JAETWSDYZPVZPK-CVEARBPZSA-N	0	3	337.261	3.352	20	30		EGEDHN
CS[C@H](C)C(=O)N[C@@H](C)CCCCNCc1ccccc1C#N	ZINC001169343982	1384138677	/nfs/dbraw/zinc/13/86/77/1384138677.db2.gz	VNVZNPPAAQMIOO-LSDHHAIUSA-N	0	3	333.501	3.074	20	30		EGEDHN
Cc1ccc(C(=NO)Nc2cc(CN3CCCCC3)ccn2)nc1	ZINC001169405987	1384144796	/nfs/dbraw/zinc/14/47/96/1384144796.db2.gz	JAROXTARQINJTB-UHFFFAOYSA-N	0	3	325.416	3.019	20	30		EGEDHN
N#CCc1cc2ccccc2nc1N1CCCc2ccc(CN)nc21	ZINC001169591569	1384162653	/nfs/dbraw/zinc/16/26/53/1384162653.db2.gz	WOAXRODEAFJRIF-UHFFFAOYSA-N	0	3	329.407	3.239	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)[C@H]2C[C@@H]2C2CCCC2)c1	ZINC001169681766	1384173174	/nfs/dbraw/zinc/17/31/74/1384173174.db2.gz	RWCQNYAKYAYVIG-MSOLQXFVSA-N	0	3	343.446	3.120	20	30		EGEDHN
CC[C@]1(C(C)C)C[C@@H]1C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001169732796	1384179979	/nfs/dbraw/zinc/17/99/79/1384179979.db2.gz	ZYMCJLQMWVASDW-YLJYHZDGSA-N	0	3	345.462	3.366	20	30		EGEDHN
C[C@H](CCCCNC/C(Cl)=C\Cl)NC(=O)c1cc(C#N)c[nH]1	ZINC001170043818	1384224505	/nfs/dbraw/zinc/22/45/05/1384224505.db2.gz	SKRKSKUJQHIZSG-ZTFCMROMSA-N	0	3	343.258	3.084	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)[C@H]1CC1(C)C	ZINC001170221297	1384268684	/nfs/dbraw/zinc/26/86/84/1384268684.db2.gz	IZVHNWQUBGLFTF-MAUKXSAKSA-N	0	3	327.472	3.369	20	30		EGEDHN
CC[C@H](Cc1ccc2c(c1)OCO2)NC(=N)c1ccc(Cl)cn1	ZINC001170409087	1384310363	/nfs/dbraw/zinc/31/03/63/1384310363.db2.gz	XTHPDBUJGMXMSA-CYBMUJFWSA-N	0	3	331.803	3.190	20	30		EGEDHN
Cc1cnc(CNCCCC[C@@H](C)NC(=O)C#CC(C)(C)C)s1	ZINC001170708589	1384371369	/nfs/dbraw/zinc/37/13/69/1384371369.db2.gz	BGDPHAUFAUMMBS-CQSZACIVSA-N	0	3	335.517	3.266	20	30		EGEDHN
CC(C)N1CCN(Cc2ccc(NCCCS)c(F)c2)CC1	ZINC001171008021	1384428642	/nfs/dbraw/zinc/42/86/42/1384428642.db2.gz	AMDKMLDVCYWTAF-UHFFFAOYSA-N	0	3	325.497	3.084	20	30		EGEDHN
Cc1cc2c(cc1NC(=N)c1ccc3cc(O)ccc3c1)CC(=O)N2	ZINC001171182917	1384462258	/nfs/dbraw/zinc/46/22/58/1384462258.db2.gz	WOUXSQALQVUJOU-UHFFFAOYSA-N	0	3	331.375	3.385	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1CC[C@H](F)[C@@](O)(C(F)(F)F)CC1	ZINC001171210749	1384469804	/nfs/dbraw/zinc/46/98/04/1384469804.db2.gz	WEEQGHVPRRDTAS-UHOFOFEASA-N	0	3	344.352	3.217	20	30		EGEDHN
Cc1nc2cncc(NC3(C#N)CCN(Cc4ccccc4)CC3)c2[nH]1	ZINC001171278222	1384483774	/nfs/dbraw/zinc/48/37/74/1384483774.db2.gz	ZMKNTRWMEMHAJY-UHFFFAOYSA-N	0	3	346.438	3.237	20	30		EGEDHN
Cc1nc2c(cncc2NC2(C#N)CCN(Cc3ccccc3)CC2)[nH]1	ZINC001171278222	1384483776	/nfs/dbraw/zinc/48/37/76/1384483776.db2.gz	ZMKNTRWMEMHAJY-UHFFFAOYSA-N	0	3	346.438	3.237	20	30		EGEDHN
C=CCN1CCN([C@@H]2CCN(C(=O)OC(C)(C)C)C3(CCC3)C2)CC1	ZINC001171852916	1384660737	/nfs/dbraw/zinc/66/07/37/1384660737.db2.gz	KVFBUWQSAUUUNO-QGZVFWFLSA-N	0	3	349.519	3.112	20	30		EGEDHN
C=CCN1CCN([C@H]2C[C@H]3CCC[C@@H](C2)N3C(=O)OC(C)(C)C)CC1	ZINC001172095273	1384726300	/nfs/dbraw/zinc/72/63/00/1384726300.db2.gz	PEDPMLNFXXQOIM-PIIMJCKOSA-N	0	3	349.519	3.111	20	30		EGEDHN
C=CCOC(=O)N[C@H]1CCCN([C@H]2CSc3ccccc3C2)C1	ZINC001172207608	1384748590	/nfs/dbraw/zinc/74/85/90/1384748590.db2.gz	HXVFSYUCVQPLKB-JKSUJKDBSA-N	0	3	332.469	3.080	20	30		EGEDHN
CCCCCCC[C@@H](CC)N1CCN(CC(=O)NC(C)C)CC1	ZINC001172353627	1384776568	/nfs/dbraw/zinc/77/65/68/1384776568.db2.gz	ADDKNSMEKABSKJ-GOSISDBHSA-N	0	3	325.541	3.268	20	30		EGEDHN
C[C@H](CCCC#N)N1CCO[C@]2(CCC[C@H]2COc2ccccn2)C1	ZINC001172494467	1384803997	/nfs/dbraw/zinc/80/39/97/1384803997.db2.gz	HCZZIPMSDBDBAY-WSTZPKSXSA-N	0	3	343.471	3.414	20	30		EGEDHN
N#C[C@@H]1CCN([C@H]2CC[C@H]3CN(C(=O)c4ccccc4)CC[C@H]3C2)C1	ZINC001172531516	1384809323	/nfs/dbraw/zinc/80/93/23/1384809323.db2.gz	MQJHTIVDZGDQSB-LEAZDLGRSA-N	0	3	337.467	3.163	20	30		EGEDHN
COC(=O)[C@@H]1CCC[C@H](N2CCC(C#N)(c3ccccc3)CC2)C1	ZINC001172612265	1384819357	/nfs/dbraw/zinc/81/93/57/1384819357.db2.gz	TWESWPGXRODQDV-AEFFLSMTSA-N	0	3	326.440	3.276	20	30		EGEDHN
C[C@@H](CCN(C)C(=O)OC(C)(C)C)NC(=N)c1ccc(Cl)cn1	ZINC001172953916	1384888812	/nfs/dbraw/zinc/88/88/12/1384888812.db2.gz	LMAAPGQBADIVKI-NSHDSACASA-N	0	3	340.855	3.086	20	30		EGEDHN
C[C@@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C#N)C1)c1ccncc1	ZINC001172967657	1384891988	/nfs/dbraw/zinc/89/19/88/1384891988.db2.gz	ZHLUJXZKBDJHEU-BMFZPTHFSA-N	0	3	330.432	3.024	20	30		EGEDHN
CC[C@@H](CC#N)NC1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1	ZINC001173010510	1384897762	/nfs/dbraw/zinc/89/77/62/1384897762.db2.gz	XNUPDLCUFGXYDO-NSHDSACASA-N	0	3	338.358	3.124	20	30		EGEDHN
CC1(CCC(=O)N2CCC[C@H](CNCc3ccccc3C#N)C2)CC1	ZINC001317161273	1384924889	/nfs/dbraw/zinc/92/48/89/1384924889.db2.gz	KOKGXCPHYSFCBO-QGZVFWFLSA-N	0	3	339.483	3.467	20	30		EGEDHN
COc1ccc(N2CCN(C3CCC(C)(C#N)CC3)CC2)c(OC)c1	ZINC001173600626	1384985397	/nfs/dbraw/zinc/98/53/97/1384985397.db2.gz	GYFCDSZPXSTFNQ-UHFFFAOYSA-N	0	3	343.471	3.298	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@H](C)CCCCNCc1ccn(CC)n1	ZINC001174848605	1385159549	/nfs/dbraw/zinc/15/95/49/1385159549.db2.gz	FBLPZYXUFZPYHX-DLBZAZTESA-N	0	3	334.508	3.270	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@H](C)CCCCNCc1cn(C(C)C)nn1	ZINC001175082258	1385191709	/nfs/dbraw/zinc/19/17/09/1385191709.db2.gz	NHENOCHEVJFMTC-APWZRJJASA-N	0	3	349.523	3.226	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)[C@H]1CC12CC2	ZINC001175453777	1385296567	/nfs/dbraw/zinc/29/65/67/1385296567.db2.gz	VXAJIMANYPBPFG-CRAIPNDOSA-N	0	3	325.456	3.123	20	30		EGEDHN
C=CCC1(C(=O)NCCCN[C@H](C)c2cnc(C)cn2)CCCCC1	ZINC001176790596	1385700374	/nfs/dbraw/zinc/70/03/74/1385700374.db2.gz	OEKUSDFHOMHURV-QGZVFWFLSA-N	0	3	344.503	3.469	20	30		EGEDHN
C=CCCOCC(=O)N[C@H](C)CCCCNC/C(Cl)=C/Cl	ZINC001176801696	1385705972	/nfs/dbraw/zinc/70/59/72/1385705972.db2.gz	PRJZSTWQXBJOJV-JFBXQDQPSA-N	0	3	337.291	3.163	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)CCCCNCc2nccn2C)CCCC1	ZINC001176847602	1385722476	/nfs/dbraw/zinc/72/24/76/1385722476.db2.gz	CLOYMTSMRBKCRT-KRWDZBQOSA-N	0	3	346.519	3.321	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)CC(C2CC2)C2CC2)c1	ZINC001177042626	1385782798	/nfs/dbraw/zinc/78/27/98/1385782798.db2.gz	RFRUYIBKHCBONG-UHFFFAOYSA-N	0	3	343.446	3.120	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)[C@H]2CC3CCC2CC3)c1	ZINC001177074844	1385797371	/nfs/dbraw/zinc/79/73/71/1385797371.db2.gz	WLTGYHOHZVOWAQ-PVARCSIZSA-N	0	3	343.446	3.120	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)CCCC(C)=O	ZINC001177210916	1385864998	/nfs/dbraw/zinc/86/49/98/1385864998.db2.gz	CCWRKCAKJFEGCB-UHFFFAOYSA-N	0	3	342.911	3.497	20	30		EGEDHN
C#CCC1(C(=O)NCCCNCc2ccncc2Cl)CCCCC1	ZINC001177217958	1385870775	/nfs/dbraw/zinc/87/07/75/1385870775.db2.gz	WVEXJKAJRDVBCF-UHFFFAOYSA-N	0	3	347.890	3.305	20	30		EGEDHN
N#Cc1ccc(CNCc2ccc(CNC(=O)CC3CC3)cc2)cc1	ZINC001318988378	1385911933	/nfs/dbraw/zinc/91/19/33/1385911933.db2.gz	WDQZWDJQALABEU-UHFFFAOYSA-N	0	3	333.435	3.264	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)NCCCCCCNCc1cc(F)ccc1C#N	ZINC001177819800	1386056274	/nfs/dbraw/zinc/05/62/74/1386056274.db2.gz	QYBYSZKJFMCZAH-KSSFIOAISA-N	0	3	331.435	3.120	20	30		EGEDHN
Cc1cc2c(ncnc2NC(=O)C(C#N)Cc2cccs2)s1	ZINC001177904907	1386079450	/nfs/dbraw/zinc/07/94/50/1386079450.db2.gz	QBJKJKDMDBGKOS-JTQLQIEISA-N	0	3	328.422	3.382	20	30		EGEDHN
N#CC(Cc1cccs1)C(=O)NCc1ccc(-c2c[nH]cn2)cc1	ZINC001177918301	1386084656	/nfs/dbraw/zinc/08/46/56/1386084656.db2.gz	UTXHXLCVAALNKV-HNNXBMFYSA-N	0	3	336.420	3.137	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@@H]1C	ZINC001178151634	1386143661	/nfs/dbraw/zinc/14/36/61/1386143661.db2.gz	NRKLOMWELBVDHC-KXBFYZLASA-N	0	3	330.447	3.192	20	30		EGEDHN
C#CCCCC(=O)NCCCCCCNCc1nc2ccccc2o1	ZINC001178327733	1386189883	/nfs/dbraw/zinc/18/98/83/1386189883.db2.gz	PKXARCDZJOPKEK-UHFFFAOYSA-N	0	3	341.455	3.398	20	30		EGEDHN
C#CCCCC(=O)NCCCCCCNCc1csc(CC)n1	ZINC001178335173	1386191558	/nfs/dbraw/zinc/19/15/58/1386191558.db2.gz	SQGVWDDQMGUXQG-UHFFFAOYSA-N	0	3	335.517	3.275	20	30		EGEDHN
CCC[C@H](C)C(=O)N1CC[C@H](NCc2cc(C#N)ccc2OC)[C@@H]1C	ZINC001178376178	1386200860	/nfs/dbraw/zinc/20/08/60/1386200860.db2.gz	YHHHCVROLDVQFM-MPGHIAIKSA-N	0	3	343.471	3.082	20	30		EGEDHN
Cc1cscc1C(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C	ZINC001178431726	1386215278	/nfs/dbraw/zinc/21/52/78/1386215278.db2.gz	OYIRCDDHVCKGIR-LPHOPBHVSA-N	0	3	338.476	3.301	20	30		EGEDHN
Cc1csc(CNCCCCCCNC(=O)C#CC(C)(C)C)n1	ZINC001178446447	1386220631	/nfs/dbraw/zinc/22/06/31/1386220631.db2.gz	YOKDKAVVTGFRGC-UHFFFAOYSA-N	0	3	335.517	3.267	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2Cl)CCN1C(=O)C1=CCCC1	ZINC001178459381	1386224299	/nfs/dbraw/zinc/22/42/99/1386224299.db2.gz	NEYHCLMSKVUWRU-KXBFYZLASA-N	0	3	342.870	3.381	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCCCCCN[C@H](C)c1nnc(C)[nH]1	ZINC001178566940	1386250476	/nfs/dbraw/zinc/25/04/76/1386250476.db2.gz	JQUJEIWVWFBVNL-OAHLLOKOSA-N	0	3	347.507	3.209	20	30		EGEDHN
CC[C@H](C)CC(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)[C@@H]1C	ZINC001178567206	1386251037	/nfs/dbraw/zinc/25/10/37/1386251037.db2.gz	NEYPFBVKACZOIC-DEYYWGMASA-N	0	3	331.435	3.213	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](NCc2cc(Cl)ccc2OC)[C@@H]1C	ZINC001178587783	1386256423	/nfs/dbraw/zinc/25/64/23/1386256423.db2.gz	VZIMBROSAVOWBR-YOEHRIQHSA-N	0	3	348.874	3.231	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](NCc2ccccc2OC(C)C)[C@@H]1C	ZINC001178599830	1386259426	/nfs/dbraw/zinc/25/94/26/1386259426.db2.gz	LAWFJKJGJYHXEZ-HKUYNNGSSA-N	0	3	342.483	3.356	20	30		EGEDHN
Cc1ccc(CN[C@H]2CCN(C(=O)C#CC(C)C)[C@H]2C)c(Cl)c1	ZINC001178653154	1386269846	/nfs/dbraw/zinc/26/98/46/1386269846.db2.gz	OLNHJXRKGPESQN-YJBOKZPZSA-N	0	3	332.875	3.387	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CC[C@H](NCC=C(Cl)Cl)[C@@H]2C)cc1	ZINC001179281439	1386438127	/nfs/dbraw/zinc/43/81/27/1386438127.db2.gz	PNVFDOWUFVPDBG-WFASDCNBSA-N	0	3	337.250	3.180	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCCCCCNCc1cc2n(n1)CCC2	ZINC001179306814	1386445748	/nfs/dbraw/zinc/44/57/48/1386445748.db2.gz	MSIDTKDYICHZQS-IRXDYDNUSA-N	0	3	346.519	3.054	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)[C@@H]1C	ZINC001179351640	1386460319	/nfs/dbraw/zinc/46/03/19/1386460319.db2.gz	RPHBQVQPGDMXEF-ILLLVBBMSA-N	0	3	341.430	3.299	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@H](NCc2ccc(C#N)s2)[C@@H]1C	ZINC001179384738	1386469899	/nfs/dbraw/zinc/46/98/99/1386469899.db2.gz	VMBCJWSADVYQPZ-ZQIUZPCESA-N	0	3	331.485	3.301	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@H](NCc2ccc(Cl)nc2)[C@@H]1C	ZINC001179384578	1386470150	/nfs/dbraw/zinc/47/01/50/1386470150.db2.gz	QLWKIVVPKSEYQI-LZWOXQAQSA-N	0	3	335.879	3.416	20	30		EGEDHN
C=CCCCC(=O)NCCCCCCNCc1nnc(C)n1C1CC1	ZINC001179421456	1386480095	/nfs/dbraw/zinc/48/00/95/1386480095.db2.gz	KAXPSRAZOIZAEA-UHFFFAOYSA-N	0	3	347.507	3.044	20	30		EGEDHN
N#Cc1ccccc1CNCCCCCCNC(=O)C1(CF)CCC1	ZINC001179630097	1386535210	/nfs/dbraw/zinc/53/52/10/1386535210.db2.gz	JXTCGWLFSMLKFR-UHFFFAOYSA-N	0	3	345.462	3.464	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)/C=C/c1c(F)ccc(F)c1Cl	ZINC001179774397	1386579859	/nfs/dbraw/zinc/57/98/59/1386579859.db2.gz	MNGURSLPSDSEHW-ZCRIDZFUSA-N	0	3	340.801	3.398	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C)C1CCCC1	ZINC001179897049	1386621895	/nfs/dbraw/zinc/62/18/95/1386621895.db2.gz	YAVWDCQJONENHJ-LQWHRVPQSA-N	0	3	338.495	3.443	20	30		EGEDHN
CCC[C@H](C)CC(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001181501196	1387006341	/nfs/dbraw/zinc/00/63/41/1387006341.db2.gz	ITVJPMLHFWFNKA-WMLDXEAASA-N	0	3	331.435	3.214	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)[C@](C)(CNCc2ccn(C(C)C)n2)C1	ZINC001181630298	1387026960	/nfs/dbraw/zinc/02/69/60/1387026960.db2.gz	SSSIEMOWIGNVJO-YLJYHZDGSA-N	0	3	346.519	3.395	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)CO[C@@H]1C[C@H](C)CC[C@H]1C(C)C	ZINC001182149371	1387112835	/nfs/dbraw/zinc/11/28/35/1387112835.db2.gz	FRKJAVSMGGHCKM-YDZRNGNQSA-N	0	3	336.520	3.230	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2nccn2CC)C1	ZINC001182305741	1387142939	/nfs/dbraw/zinc/14/29/39/1387142939.db2.gz	MXAMRSMIPQDKAU-SQGPQFPESA-N	0	3	346.519	3.080	20	30		EGEDHN
C[C@@H](CNC(=O)CCc1ccccc1)N(C)Cc1cccc(C#N)c1	ZINC001329599453	1389175313	/nfs/dbraw/zinc/17/53/13/1389175313.db2.gz	BZGVBPBOMJYCTD-KRWDZBQOSA-N	0	3	335.451	3.128	20	30		EGEDHN
Cc1ccc2c(c1)[C@H]1CN(C)CC[C@H]1N2C(=O)c1ccc(C#N)cc1F	ZINC001337237119	1389283213	/nfs/dbraw/zinc/28/32/13/1389283213.db2.gz	PATSJHLLVNNMRC-YLJYHZDGSA-N	0	3	349.409	3.454	20	30		EGEDHN
CC(C)CCC(=O)N(C)[C@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001331253061	1389668498	/nfs/dbraw/zinc/66/84/98/1389668498.db2.gz	FHUNBEYAQPUCMS-LJQANCHMSA-N	0	3	345.462	3.460	20	30		EGEDHN
Cc1cc(C(=O)NC[C@@H](C)CNCc2ccccc2C#N)c(C)s1	ZINC001698753731	1406404756	/nfs/dbraw/zinc/40/47/56/1406404756.db2.gz	KJIQRRSRYZVIAH-ZDUSSCGKSA-N	0	3	341.480	3.392	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N[C@H](C)c1noc(-c2ccc(Cl)cc2)n1	ZINC001340123973	1390231535	/nfs/dbraw/zinc/23/15/35/1390231535.db2.gz	WRURBEBVSJYRKY-BXUZGUMPSA-N	0	3	348.834	3.251	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc(N2C[C@@H](C)O[C@@H](C)C2)c(F)c1	ZINC001340173416	1390241711	/nfs/dbraw/zinc/24/17/11/1390241711.db2.gz	ROEOPZNFQJSIHA-VBQJREDUSA-N	0	3	349.450	3.061	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccc(C)c(C(=O)N(C)C(C)C)c1	ZINC001340254427	1390258796	/nfs/dbraw/zinc/25/87/96/1390258796.db2.gz	SFDNMJFNNZNSKD-QGZVFWFLSA-N	0	3	331.460	3.098	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N1CCC(Oc2ccc(F)cc2F)CC1	ZINC001340605318	1390325745	/nfs/dbraw/zinc/32/57/45/1390325745.db2.gz	WXWIXDWMFRQTMB-INIZCTEOSA-N	0	3	338.398	3.018	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)NC[C@H]1CCN(c2cc(Cl)ccc2C)C1	ZINC001340847570	1390383540	/nfs/dbraw/zinc/38/35/40/1390383540.db2.gz	ZTVSDLRPUNIBLU-WBVHZDCISA-N	0	3	349.906	3.275	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1cc(Br)ccc1OCC	ZINC001341492703	1390493702	/nfs/dbraw/zinc/49/37/02/1390493702.db2.gz	IIUVBUKMQYCISL-GFCCVEGCSA-N	0	3	341.249	3.470	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N[C@H](C)c1nc(-c2ccc(CC)cc2)no1	ZINC001341513749	1390496510	/nfs/dbraw/zinc/49/65/10/1390496510.db2.gz	CZJOVQFDIRFIIC-CZUORRHYSA-N	0	3	342.443	3.160	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)Nc1cc(C(N)=O)sc1C	ZINC001341513443	1390496680	/nfs/dbraw/zinc/49/66/80/1390496680.db2.gz	DMCHFFKVGFBFNI-LBPRGKRZSA-N	0	3	325.478	3.172	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)[C@@H](C)OC1CCCCC1	ZINC001341886221	1390544677	/nfs/dbraw/zinc/54/46/77/1390544677.db2.gz	QHRLTKRHWZHYCQ-HIFRSBDPSA-N	0	3	344.411	3.080	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)Cc3c[nH]c4cnccc34)nc21	ZINC001341929853	1390551163	/nfs/dbraw/zinc/55/11/63/1390551163.db2.gz	LJQIMQDBRDKNDB-AWEZNQCLSA-N	0	3	329.363	3.167	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)c2csc(C#N)c2)N(C)C)cc1	ZINC001344048590	1390752270	/nfs/dbraw/zinc/75/22/70/1390752270.db2.gz	ZNOBHYRDASMJCI-QGZVFWFLSA-N	0	3	327.453	3.215	20	30		EGEDHN
N#CC(C(=O)CCc1nc(C2CCCC2)no1)c1cccc(F)n1	ZINC001347123698	1391003813	/nfs/dbraw/zinc/00/38/13/1391003813.db2.gz	MZTMMTACMDZNEQ-GFCCVEGCSA-N	0	3	328.347	3.070	20	30		EGEDHN
COc1cccc([C@H]2CCN(C(=O)[C@H](N)CCCCC#N)C2(C)C)c1	ZINC001349848525	1391375702	/nfs/dbraw/zinc/37/57/02/1391375702.db2.gz	CEUWWTILFCJLFD-QZTJIDSGSA-N	0	3	343.471	3.201	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N1CC[C@@H]2CCCC[C@@H]2C1	ZINC001351542928	1391650053	/nfs/dbraw/zinc/65/00/53/1391650053.db2.gz	ABGFQWQBQJOVDK-KSZLIROESA-N	0	3	343.519	3.290	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@@H](CC)Cc2ccccc2)C1	ZINC001479398949	1392234155	/nfs/dbraw/zinc/23/41/55/1392234155.db2.gz	MCBVGQNQFIKFAL-BZSNNMDCSA-N	0	3	334.891	3.492	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CN(C(=O)C4CC5(CCC5)C4)C3)C2)cc1	ZINC001479760052	1392371785	/nfs/dbraw/zinc/37/17/85/1392371785.db2.gz	CTRNPFWTCCPYLA-UHFFFAOYSA-N	0	3	349.478	3.173	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)COC1CCCCC1	ZINC001479825076	1392413652	/nfs/dbraw/zinc/41/36/52/1392413652.db2.gz	JIQWKJAUZRLSHE-RDJZCZTQSA-N	0	3	342.911	3.447	20	30		EGEDHN
C[C@@H](NC(=O)CCCF)[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001480384676	1392728381	/nfs/dbraw/zinc/72/83/81/1392728381.db2.gz	XJKDXCFRUBKDGT-CRAIPNDOSA-N	0	3	331.435	3.025	20	30		EGEDHN
CCN(CCNC(=O)c1cscc1C)Cc1cccc(C#N)c1	ZINC001480967017	1393053614	/nfs/dbraw/zinc/05/36/14/1393053614.db2.gz	CRYLKZIUBRCSOT-UHFFFAOYSA-N	0	3	327.453	3.180	20	30		EGEDHN
CCN(CCNC(=O)[C@@H]1CCCCC1(F)F)Cc1cccc(C#N)c1	ZINC001480990265	1393071741	/nfs/dbraw/zinc/07/17/41/1393071741.db2.gz	JITHRZQHSRTXMH-KRWDZBQOSA-N	0	3	349.425	3.322	20	30		EGEDHN
CCCN(CCNC(=O)c1ccsc1)Cc1cccc(C#N)c1	ZINC001481129564	1393128011	/nfs/dbraw/zinc/12/80/11/1393128011.db2.gz	SHMVLSYQAHSCRB-UHFFFAOYSA-N	0	3	327.453	3.262	20	30		EGEDHN
CCCN(CCNC(=O)c1oc(C)cc1C)Cc1cccc(C#N)c1	ZINC001481133166	1393128904	/nfs/dbraw/zinc/12/89/04/1393128904.db2.gz	MNLOXPNEYWEMCU-UHFFFAOYSA-N	0	3	339.439	3.410	20	30		EGEDHN
CCCN(CCNC(=O)c1coc(C)c1)Cc1ccc(F)c(C#N)c1	ZINC001481133853	1393129193	/nfs/dbraw/zinc/12/91/93/1393129193.db2.gz	LLICJAVLBHPKPC-UHFFFAOYSA-N	0	3	343.402	3.241	20	30		EGEDHN
C[C@H](CNC(=O)C1(C(F)F)CCCC1)NCc1ccc(C#N)s1	ZINC001491560346	1394516886	/nfs/dbraw/zinc/51/68/86/1394516886.db2.gz	PKEHEVDGHFIQNE-LLVKDONJSA-N	0	3	341.427	3.040	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2ccc(C)cc2OC)CCCC1	ZINC001481912426	1394592635	/nfs/dbraw/zinc/59/26/35/1394592635.db2.gz	XNJSZVVTJFUIBZ-UHFFFAOYSA-N	0	3	336.863	3.388	20	30		EGEDHN
Cc1oc(C)c(C(=O)N(C)[C@@H](C)CNCc2ccc(C#N)s2)c1C	ZINC001482307050	1394880902	/nfs/dbraw/zinc/88/09/02/1394880902.db2.gz	UTQKRMBZKYEKQV-NSHDSACASA-N	0	3	345.468	3.388	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)Cc1ccc(Cl)s1)C(C)C	ZINC001698972647	1406737342	/nfs/dbraw/zinc/73/73/42/1406737342.db2.gz	GLWYNVNEASLLGV-GFCCVEGCSA-N	0	3	335.300	3.427	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1ccc2ccncc2c1)C(C)C	ZINC001698977583	1406749543	/nfs/dbraw/zinc/74/95/43/1406749543.db2.gz	KQDVPXBIOIISOV-KRWDZBQOSA-N	0	3	331.847	3.331	20	30		EGEDHN
Cc1ccc(C(=O)NCC2(NCc3ccc(F)c(C#N)c3)CC2)s1	ZINC001499148849	1397054644	/nfs/dbraw/zinc/05/46/44/1397054644.db2.gz	MWBZVNBKBRBMIF-UHFFFAOYSA-N	0	3	343.427	3.120	20	30		EGEDHN
Cc1cc(C(=O)NCC[C@@H](C)NCc2ccccc2C#N)c(C)o1	ZINC001690831375	1404766727	/nfs/dbraw/zinc/76/67/27/1404766727.db2.gz	DUEMBGPLLVZGLR-CYBMUJFWSA-N	0	3	325.412	3.066	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1ccnc(-c2ccco2)c1	ZINC001690848959	1404775653	/nfs/dbraw/zinc/77/56/53/1404775653.db2.gz	PKAQOOCSTQIFFC-ZDUSSCGKSA-N	0	3	333.819	3.192	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)Cn2c(C)cc3ccccc32)C1	ZINC001691103557	1405043317	/nfs/dbraw/zinc/04/33/17/1405043317.db2.gz	IJGQZOSYDWRXGH-WOVMCDHWSA-N	0	3	345.874	3.187	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H](CNC(=O)CC3CCCC3)C2)c1	ZINC001691115214	1405056443	/nfs/dbraw/zinc/05/64/43/1405056443.db2.gz	GHWJWEMOAVRLOD-LJQANCHMSA-N	0	3	325.456	3.077	20	30		EGEDHN
N#Cc1ccc(F)c(CNCC2(NC(=O)[C@@H]3CC34CC4)CCCC2)c1	ZINC001732236619	1428482878	/nfs/dbraw/zinc/48/28/78/1428482878.db2.gz	WJIWXOVNFBOZJM-INIZCTEOSA-N	0	3	341.430	3.016	20	30		EGEDHN
COc1cc(Cl)ccc1CNC1(CNC(=O)[C@@H](C)C#N)CCCC1	ZINC001732389932	1428559652	/nfs/dbraw/zinc/55/96/52/1428559652.db2.gz	YHPUZZUQEZLJQY-ZDUSSCGKSA-N	0	3	349.862	3.027	20	30		EGEDHN
CC(C)C[C@@H](CNCc1ccc(C#N)s1)NC(=O)c1ccns1	ZINC001732463743	1428594451	/nfs/dbraw/zinc/59/44/51/1428594451.db2.gz	FUCHYPNRXJGGJY-LBPRGKRZSA-N	0	3	348.497	3.011	20	30		EGEDHN
C[C@@H](C(=O)N[C@@H](C)CNCc1ccc(F)c(C#N)c1)c1ccccc1	ZINC001699428465	1412744230	/nfs/dbraw/zinc/74/42/30/1412744230.db2.gz	YOAYCGVYUIYXHI-LSDHHAIUSA-N	0	3	339.414	3.095	20	30		EGEDHN
CCC(C)(CC)C(=O)N[C@@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001699602572	1412965050	/nfs/dbraw/zinc/96/50/50/1412965050.db2.gz	MYVKXMOWUZXHHS-INIZCTEOSA-N	0	3	333.501	3.430	20	30		EGEDHN
CCCCC(=O)NC[C@]1(C)CCCN(Cc2cccc(C#N)c2)C1	ZINC001699873156	1413324050	/nfs/dbraw/zinc/32/40/50/1413324050.db2.gz	ZOHQRAPCZUGDPR-FQEVSTJZSA-N	0	3	327.472	3.467	20	30		EGEDHN
C[C@H](C#N)C(=O)N(C)CCN(C)C1c2ccccc2-c2ccccc21	ZINC001732574890	1428773900	/nfs/dbraw/zinc/77/39/00/1428773900.db2.gz	CPTHYGRXXJXNQN-OAHLLOKOSA-N	0	3	333.435	3.306	20	30		EGEDHN
C[C@H](CNC(=O)C1CC2(CCC2)C1)N(C)Cc1cccc(C#N)c1	ZINC001700469581	1414084637	/nfs/dbraw/zinc/08/46/37/1414084637.db2.gz	GSHQMKFJKGHDTM-OAHLLOKOSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@@H](CNC(=O)c1cc2ccccn2c1)N(C)Cc1ccc(C#N)cc1	ZINC001700478339	1414109274	/nfs/dbraw/zinc/10/92/74/1414109274.db2.gz	VZIBEXXYNOONFL-INIZCTEOSA-N	0	3	346.434	3.061	20	30		EGEDHN
C=C(Cl)Cn1c(C2CCC2)nnc1N1C[C@H](C)N(CC)C[C@@H]1C	ZINC001705753077	1417133685	/nfs/dbraw/zinc/13/36/85/1417133685.db2.gz	PIOUJBFQDTWXAL-KBPBESRZSA-N	0	3	337.899	3.217	20	30		EGEDHN
Cc1oc(C)c(C(=O)N[C@H](C)CN(C)Cc2ccc(C#N)cc2)c1C	ZINC001733045721	1429178983	/nfs/dbraw/zinc/17/89/83/1429178983.db2.gz	VGPBNTJLXKYVRT-CYBMUJFWSA-N	0	3	339.439	3.327	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1cc(C)sn1	ZINC001712996158	1417547200	/nfs/dbraw/zinc/54/72/00/1417547200.db2.gz	GRKUFRKRPWCXTK-JSGCOSHPSA-N	0	3	327.881	3.177	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)CCc1cc(C)on1	ZINC001713001281	1417554369	/nfs/dbraw/zinc/55/43/69/1417554369.db2.gz	YSELTONDXPTMJJ-GDBMZVCRSA-N	0	3	339.867	3.027	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1cc(CCC)n[nH]1	ZINC001713001433	1417554813	/nfs/dbraw/zinc/55/48/13/1417554813.db2.gz	ZDSJEZAAVHMQOY-BBRMVZONSA-N	0	3	338.883	3.088	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)C1(C)CCCCC1	ZINC001733054176	1429194904	/nfs/dbraw/zinc/19/49/04/1429194904.db2.gz	HHIBZQXDGCYTOO-INIZCTEOSA-N	0	3	327.472	3.465	20	30		EGEDHN
Cc1cocc1C(=O)N1CCCC[C@@H]1CNCC#Cc1ccccc1	ZINC001713264891	1417873094	/nfs/dbraw/zinc/87/30/94/1417873094.db2.gz	YOZGURNKKMFHSR-LJQANCHMSA-N	0	3	336.435	3.224	20	30		EGEDHN
CCC(CC)C(=O)N[C@@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001733163081	1429265362	/nfs/dbraw/zinc/26/53/62/1429265362.db2.gz	CFLWUEOFSLQICK-SFHVURJKSA-N	0	3	331.435	3.118	20	30		EGEDHN
C[C@@H](C(=O)NC[C@H](C)NCc1ccc(F)c(C#N)c1)c1ccccc1	ZINC001714298135	1419076986	/nfs/dbraw/zinc/07/69/86/1419076986.db2.gz	CESVTGQOXBVPGP-LSDHHAIUSA-N	0	3	339.414	3.095	20	30		EGEDHN
CC1(C(=O)NCc2ccc(CNCc3ccc(C#N)s3)cc2)CC1	ZINC001714319519	1419097679	/nfs/dbraw/zinc/09/76/79/1419097679.db2.gz	INQIMXSNAAXJER-UHFFFAOYSA-N	0	3	339.464	3.326	20	30		EGEDHN
CCC1(C(=O)NC[C@H](C)CNCc2ccccc2C#N)CCCC1	ZINC001714441453	1419173346	/nfs/dbraw/zinc/17/33/46/1419173346.db2.gz	FLUGCKIPDZPCNK-MRXNPFEDSA-N	0	3	327.472	3.371	20	30		EGEDHN
CCC1(C(=O)NC[C@@H](C)CNCc2ccccc2C#N)CCCC1	ZINC001714441452	1419173531	/nfs/dbraw/zinc/17/35/31/1419173531.db2.gz	FLUGCKIPDZPCNK-INIZCTEOSA-N	0	3	327.472	3.371	20	30		EGEDHN
Cc1cc(C)cc(C(=O)NC[C@@H](C)CNCc2ccccc2C#N)c1	ZINC001714447224	1419179342	/nfs/dbraw/zinc/17/93/42/1419179342.db2.gz	ZMTVINVLPDWWHF-KRWDZBQOSA-N	0	3	335.451	3.331	20	30		EGEDHN
C[C@@H](CNCc1ccccc1C#N)CNC(=O)C12CCC(CC1)CC2	ZINC001714453356	1419185925	/nfs/dbraw/zinc/18/59/25/1419185925.db2.gz	MOLIOLQOYRPEMD-BQJIDLTASA-N	0	3	339.483	3.371	20	30		EGEDHN
CCc1ccc(C(=O)NCC[C@@H](C)NCc2ccccc2C#N)s1	ZINC001714477767	1419201373	/nfs/dbraw/zinc/20/13/73/1419201373.db2.gz	OBCITXJUVOUFAR-CQSZACIVSA-N	0	3	341.480	3.480	20	30		EGEDHN
CCc1ccccc1CC(=O)NCCN(CC)Cc1cccc(C#N)c1	ZINC001714583616	1419323630	/nfs/dbraw/zinc/32/36/30/1419323630.db2.gz	BPHXPWYSUIWQOW-UHFFFAOYSA-N	0	3	349.478	3.301	20	30		EGEDHN
CC(C)(C(=O)NC[C@@H]1CCN(Cc2cccc(C#N)c2)C1)C1CCC1	ZINC001714638073	1419409399	/nfs/dbraw/zinc/40/93/99/1419409399.db2.gz	QWJGBTXARIKESQ-SFHVURJKSA-N	0	3	339.483	3.323	20	30		EGEDHN
Cc1ccccc1CCCN1CC[C@@H](NC(=O)C#CC(C)(C)C)C1	ZINC001715003668	1419734014	/nfs/dbraw/zinc/73/40/14/1419734014.db2.gz	WNTIHUYGODSIFE-LJQANCHMSA-N	0	3	326.484	3.168	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)Cc2ccc(F)cc2F)CCCC1	ZINC001715093942	1419835132	/nfs/dbraw/zinc/83/51/32/1419835132.db2.gz	BQSLXBADGCJJTD-UHFFFAOYSA-N	0	3	342.817	3.278	20	30		EGEDHN
CCC(=O)N[C@@]1(CNCc2cc(C#N)ccc2OC)CCCC[C@H]1C	ZINC001715128599	1419877131	/nfs/dbraw/zinc/87/71/31/1419877131.db2.gz	MWCOLLAXDNWRKC-FOIQADDNSA-N	0	3	343.471	3.132	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)C1(C)CCC1)NCc1ccc(C#N)cc1F	ZINC001715499279	1420181843	/nfs/dbraw/zinc/18/18/43/1420181843.db2.gz	AOXYHXLPGRYFAP-QGZVFWFLSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1ccc(C)c(F)c1F)C(C)C	ZINC001715504245	1420187362	/nfs/dbraw/zinc/18/73/62/1420187362.db2.gz	NSKXHTLSVIQKNE-CYBMUJFWSA-N	0	3	330.806	3.370	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cccc(C(F)(F)F)n1)C(C)C	ZINC001715510090	1420193873	/nfs/dbraw/zinc/19/38/73/1420193873.db2.gz	WVEITFAPFPWASA-GFCCVEGCSA-N	0	3	349.784	3.197	20	30		EGEDHN
CC1(CC(=O)N[C@H]2CCC[C@@H]2CNCc2ccccc2C#N)CC1	ZINC001715566844	1420256387	/nfs/dbraw/zinc/25/63/87/1420256387.db2.gz	KLODQOLRPJDWSX-MSOLQXFVSA-N	0	3	325.456	3.123	20	30		EGEDHN
Cc1ccc(F)c(C(=O)N[C@@H](C)CN(C)Cc2cccc(C#N)c2)c1	ZINC001716042027	1420504763	/nfs/dbraw/zinc/50/47/63/1420504763.db2.gz	BGFFALFDABCFLZ-HNNXBMFYSA-N	0	3	339.414	3.256	20	30		EGEDHN
CCCC[C@@H](CNCc1ccc(F)c(C#N)c1)NC(=O)C(C)(C)F	ZINC001717528124	1421463750	/nfs/dbraw/zinc/46/37/50/1421463750.db2.gz	NFVPVPDSHQUDRC-HNNXBMFYSA-N	0	3	337.414	3.210	20	30		EGEDHN
CC(C)(C)[C@H](CNCc1ccc(C#N)s1)NC(=O)c1ccco1	ZINC001717955236	1421726695	/nfs/dbraw/zinc/72/66/95/1421726695.db2.gz	ISPFGSUIYSOSQL-HNNXBMFYSA-N	0	3	331.441	3.147	20	30		EGEDHN
CC1(C)C(C(=O)N2CCC[C@@H]2CNCC#Cc2ccccc2)C1(C)C	ZINC001733338145	1429522246	/nfs/dbraw/zinc/52/22/46/1429522246.db2.gz	KTWZYHBFPOJLSG-GOSISDBHSA-N	0	3	338.495	3.301	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@@](C)(CNCc3ccccc3C#N)C2)co1	ZINC001733429114	1429636225	/nfs/dbraw/zinc/63/62/25/1429636225.db2.gz	FHFNQQCKXBNNPN-FQEVSTJZSA-N	0	3	337.423	3.102	20	30		EGEDHN
Cc1ccccc1C(=O)N[C@@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001723273740	1424327062	/nfs/dbraw/zinc/32/70/62/1424327062.db2.gz	JUYRGFBEBAXXAU-SFHVURJKSA-N	0	3	339.464	3.226	20	30		EGEDHN
CCCC1(C(=O)N2CC[C@H]([C@H](C)NCc3ccccc3C#N)C2)CC1	ZINC001733539859	1429745541	/nfs/dbraw/zinc/74/55/41/1429745541.db2.gz	RZHUMGZSPWEOCG-LPHOPBHVSA-N	0	3	339.483	3.465	20	30		EGEDHN
CCCC1(C(=O)N2CC[C@H]([C@@H](C)NCc3ccccc3C#N)C2)CC1	ZINC001733539858	1429745627	/nfs/dbraw/zinc/74/56/27/1429745627.db2.gz	RZHUMGZSPWEOCG-APWZRJJASA-N	0	3	339.483	3.465	20	30		EGEDHN
CCCCC(=O)NC[C@@]1(C)CCCN(Cc2ccc(C#N)cc2)C1	ZINC001724312096	1424796123	/nfs/dbraw/zinc/79/61/23/1424796123.db2.gz	SFMFFRUTAPTPON-HXUWFJFHSA-N	0	3	327.472	3.467	20	30		EGEDHN
C#CCCCC(=O)N1CCCC[C@@H]1CNCc1cccc(Cl)n1	ZINC001724777456	1425141928	/nfs/dbraw/zinc/14/19/28/1425141928.db2.gz	KYCSHVDYLYWGPS-MRXNPFEDSA-N	0	3	333.863	3.009	20	30		EGEDHN
CCCC1(C(=O)N(C)C[C@@H](C)NCc2ccc(F)c(C#N)c2)CC1	ZINC001725506321	1426189328	/nfs/dbraw/zinc/18/93/28/1426189328.db2.gz	LZHNVQNKJDOQIK-CQSZACIVSA-N	0	3	331.435	3.214	20	30		EGEDHN
CC(C)CCC(=O)N[C@H]1CC[C@@H](CNCc2ccccc2C#N)C1	ZINC001725644295	1426324722	/nfs/dbraw/zinc/32/47/22/1426324722.db2.gz	WDGPDNJPYYROOR-APWZRJJASA-N	0	3	327.472	3.369	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1ncoc1C1CC1	ZINC001731294981	1427237339	/nfs/dbraw/zinc/23/73/39/1427237339.db2.gz	STHNDIQUUZHXKT-GXTWGEPZSA-N	0	3	337.851	3.277	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1c[nH]nc1C1CC1	ZINC001731296147	1427238564	/nfs/dbraw/zinc/23/85/64/1427238564.db2.gz	WTSASOFZEOUPMM-WFASDCNBSA-N	0	3	336.867	3.012	20	30		EGEDHN
Cc1ccsc1C(=O)NC[C@@H](NCc1ccc(C#N)s1)C1CC1	ZINC001731388634	1427338778	/nfs/dbraw/zinc/33/87/78/1427338778.db2.gz	IMRBLYBXJXLWHU-OAHLLOKOSA-N	0	3	345.493	3.288	20	30		EGEDHN
CCC1(C(=O)NC2CCC(NCc3ccccc3C#N)CC2)CC1	ZINC001731574064	1427617864	/nfs/dbraw/zinc/61/78/64/1427617864.db2.gz	LUSRMEDXYVOEGY-UHFFFAOYSA-N	0	3	325.456	3.265	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)CC3CCCC3)CCC2)s1	ZINC001733711212	1429927688	/nfs/dbraw/zinc/92/76/88/1429927688.db2.gz	ATQZAPAZCZWLIT-UHFFFAOYSA-N	0	3	331.485	3.329	20	30		EGEDHN
CC(C)C(C)(C)C(=O)NCC[C@H](C)NCc1cc(C#N)ccc1F	ZINC001733905264	1437723425	/nfs/dbraw/zinc/72/34/25/1437723425.db2.gz	XVOMGTHMBNIOCY-AWEZNQCLSA-N	0	3	333.451	3.364	20	30		EGEDHN
CCc1ccccc1CC(=O)NC[C@H](C)N(C)Cc1ccc(C#N)cc1	ZINC001734048636	1437838290	/nfs/dbraw/zinc/83/82/90/1437838290.db2.gz	XCEWZCDJSUWLBF-KRWDZBQOSA-N	0	3	349.478	3.300	20	30		EGEDHN
C#CCCCCC(=O)N1CCCC[C@@H]1[C@@H](C)NCc1c(C)noc1C	ZINC001752143562	1440145283	/nfs/dbraw/zinc/14/52/83/1440145283.db2.gz	UDQLWMXTXOEQRZ-VQIMIIECSA-N	0	3	345.487	3.344	20	30		EGEDHN
CCN(CCCNC(=O)[C@@H]1CCC[C@@H]2C[C@@H]21)Cc1ccc(C#N)s1	ZINC001752193147	1440152767	/nfs/dbraw/zinc/15/27/67/1440152767.db2.gz	MVKWONVDNZAUKM-OLMNPRSZSA-N	0	3	345.512	3.384	20	30		EGEDHN
C=CCCCN1CC[C@@H](NC(=O)c2nc(Cl)sc2Cl)C1	ZINC001752394477	1440173467	/nfs/dbraw/zinc/17/34/67/1440173467.db2.gz	VTMRWCYDXXBMMA-SECBINFHSA-N	0	3	334.272	3.220	20	30		EGEDHN
CC(C)CC(=O)N[C@H]1CC12CCN(Cc1cccc(C#N)c1)CC2	ZINC001752414964	1440174641	/nfs/dbraw/zinc/17/46/41/1440174641.db2.gz	FHZWPDSBVMVSEI-SFHVURJKSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@H](C(=O)NC[C@@H](NCC#Cc1ccc(F)cc1)C1CC1)C1CCC1	ZINC001752468793	1440184154	/nfs/dbraw/zinc/18/41/54/1440184154.db2.gz	NREGCFGPMSMFBP-MGPUTAFESA-N	0	3	342.458	3.098	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H](NCC#Cc1ccccc1Cl)C1CC1	ZINC001752473276	1440184723	/nfs/dbraw/zinc/18/47/23/1440184723.db2.gz	OXGYCCCAMZSOKT-GOSISDBHSA-N	0	3	344.886	3.388	20	30		EGEDHN
CC1(C(=O)NC[C@H](NCC#Cc2ccc(F)cc2)C2CC2)CCCC1	ZINC001752473824	1440184940	/nfs/dbraw/zinc/18/49/40/1440184940.db2.gz	UHDWEYCEVOBSTI-IBGZPJMESA-N	0	3	342.458	3.242	20	30		EGEDHN
N#Cc1ccc(CN[C@H](CNC(=O)[C@]23C[C@H]2CCCC3)C2CC2)s1	ZINC001752482823	1440185953	/nfs/dbraw/zinc/18/59/53/1440185953.db2.gz	SLSCSUYYWIRIDB-LSBZLQRGSA-N	0	3	343.496	3.184	20	30		EGEDHN
C=CCCCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C(C)(C)c1cnc[nH]1	ZINC001752542834	1440194770	/nfs/dbraw/zinc/19/47/70/1440194770.db2.gz	FBVSJAJVNDYDPU-CALCHBBNSA-N	0	3	344.503	3.109	20	30		EGEDHN
CC[C@@H](C)[C@@H](C)C(=O)N[C@H]1C[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001752674565	1440199251	/nfs/dbraw/zinc/19/92/51/1440199251.db2.gz	XGWCXHVVUZXALE-OHDICMOHSA-N	0	3	330.447	3.096	20	30		EGEDHN
CCCCCCC(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001752774588	1440206475	/nfs/dbraw/zinc/20/64/75/1440206475.db2.gz	DFSJAOMWYVFUET-CALCHBBNSA-N	0	3	331.435	3.405	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@@H](NCc3conc3C)C2)CCCCC1	ZINC001752775731	1440206807	/nfs/dbraw/zinc/20/68/07/1440206807.db2.gz	TWHKLSCXFXYUGO-CALCHBBNSA-N	0	3	331.460	3.246	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC[C@@H]1CCCN(Cc2cccc(C(F)F)c2)C1	ZINC001752780186	1440208644	/nfs/dbraw/zinc/20/86/44/1440208644.db2.gz	UCIPAQAKLKVAAT-ZFWWWQNUSA-N	0	3	335.398	3.112	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC[C@H]1CCCN(Cc2cccnc2C)C1	ZINC001752784093	1440210084	/nfs/dbraw/zinc/21/00/84/1440210084.db2.gz	VWEBWZOFQDWLOJ-GOSISDBHSA-N	0	3	341.499	3.487	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001752786007	1440211496	/nfs/dbraw/zinc/21/14/96/1440211496.db2.gz	IRPAPBQZNRXYJK-FXAWDEMLSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@H](CNCc2ccccc2C#N)C1	ZINC001752808271	1440216210	/nfs/dbraw/zinc/21/62/10/1440216210.db2.gz	XWSWRUKTRUDVCU-QGZVFWFLSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=CCOCCN1CCCC[C@H]1CNC(=O)c1cc2ccsc2[nH]1	ZINC001752828120	1440224462	/nfs/dbraw/zinc/22/44/62/1440224462.db2.gz	QEEKXUYQLZKSMF-HNNXBMFYSA-N	0	3	347.484	3.016	20	30		EGEDHN
COCC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)CCCC(C)C	ZINC001752833404	1440226580	/nfs/dbraw/zinc/22/65/80/1440226580.db2.gz	FSHVTGJODNQTDC-WOJBJXKFSA-N	0	3	348.531	3.308	20	30		EGEDHN
C[C@@H](CNC(=O)C=C1CCCCC1)NCc1ccc(F)c(C#N)c1	ZINC001752862130	1440235805	/nfs/dbraw/zinc/23/58/05/1440235805.db2.gz	NZXZQGMLBGMAPI-AWEZNQCLSA-N	0	3	329.419	3.182	20	30		EGEDHN
CC#CCCCC(=O)N[C@H]1CCC[C@H](NCc2ccn(C(C)C)n2)C1	ZINC001752975717	1440255978	/nfs/dbraw/zinc/25/59/78/1440255978.db2.gz	FGDQJAHVYZGRBO-ROUUACIJSA-N	0	3	344.503	3.175	20	30		EGEDHN
CC#CCN(C)[C@@H]1CCCN(C(=O)[C@@H](C)Cc2ccc(C)cc2)C1	ZINC001753000374	1440264445	/nfs/dbraw/zinc/26/44/45/1440264445.db2.gz	RVCGTGJEJQCXJX-AZUAARDMSA-N	0	3	326.484	3.120	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)C=C1CCCCC1	ZINC001753003083	1440265236	/nfs/dbraw/zinc/26/52/36/1440265236.db2.gz	UDUZJWFCKQCAJE-CYBMUJFWSA-N	0	3	329.282	3.270	20	30		EGEDHN
CC(C(=O)NCC[C@@H](C)NCc1cc(C#N)ccc1F)=C1CCC1	ZINC001753005608	1440265631	/nfs/dbraw/zinc/26/56/31/1440265631.db2.gz	SUBCEQLTONUFKY-CYBMUJFWSA-N	0	3	329.419	3.182	20	30		EGEDHN
C[C@H](CCNC(=O)[C@]12C[C@H]1CCCC2)NCc1ccccc1C#N	ZINC001753013581	1440267696	/nfs/dbraw/zinc/26/76/96/1440267696.db2.gz	PPZYPMUCWBHOLX-XFQXTVEOSA-N	0	3	325.456	3.123	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCC[C@H]1CCCN1Cc1conc1C	ZINC001753036251	1440274945	/nfs/dbraw/zinc/27/49/45/1440274945.db2.gz	USCICWRXEBPFQQ-KRWDZBQOSA-N	0	3	333.476	3.446	20	30		EGEDHN
C=CCOCC(=O)NCCN(C)Cc1c(C)cc(C(C)(C)C)cc1C	ZINC001753044162	1440277329	/nfs/dbraw/zinc/27/73/29/1440277329.db2.gz	XILTULAHHVCPTC-UHFFFAOYSA-N	0	3	346.515	3.352	20	30		EGEDHN
C#Cc1cncc(C(=O)NCCN(C)Cc2ccc3ccccc3c2)c1	ZINC001753064320	1440284723	/nfs/dbraw/zinc/28/47/23/1440284723.db2.gz	OGOLRTPIWIMFCR-UHFFFAOYSA-N	0	3	343.430	3.078	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCN(C)Cc2ccc(C3CCC3)cc2)nc1	ZINC001753071148	1440288502	/nfs/dbraw/zinc/28/85/02/1440288502.db2.gz	AUJGMPXWYMWTDS-UHFFFAOYSA-N	0	3	347.462	3.192	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)CCNCc2c(C)cccc2Cl)cc1	ZINC001753219630	1440339968	/nfs/dbraw/zinc/33/99/68/1440339968.db2.gz	XLEIUFSWNWYRRW-UHFFFAOYSA-N	0	3	340.854	3.492	20	30		EGEDHN
C=C(C)CN[C@H](CNC(=O)C1=COCCO1)c1ccc(C(C)C)cc1	ZINC001753294435	1440351629	/nfs/dbraw/zinc/35/16/29/1440351629.db2.gz	MWKYVIDMQMTFEE-GOSISDBHSA-N	0	3	344.455	3.021	20	30		EGEDHN
C=C(C)CN[C@H](CNC(=O)c1nc(C)n2ccccc12)c1ccccc1	ZINC001753300535	1440353861	/nfs/dbraw/zinc/35/38/61/1440353861.db2.gz	VLHGQDDMSMWSAL-GOSISDBHSA-N	0	3	348.450	3.280	20	30		EGEDHN
C#CCCN[C@H](CNC(=O)C[C@H]1CCC(C)(C)CO1)c1ccccc1	ZINC001753300574	1440353936	/nfs/dbraw/zinc/35/39/36/1440353936.db2.gz	WJXJBEJTQZTDDB-RTBURBONSA-N	0	3	342.483	3.052	20	30		EGEDHN
C=CC1(CC(=O)NC[C@H](NC[C@@H](C)O)c2ccccc2)CCCCC1	ZINC001753309029	1440356129	/nfs/dbraw/zinc/35/61/29/1440356129.db2.gz	AWBFZUUWMUHYPV-MJGOQNOKSA-N	0	3	344.499	3.341	20	30		EGEDHN
CC#CCN1CC[C@H](N(CCC)C(=O)c2cc(CCCCC)[nH]n2)C1	ZINC001753320097	1440362790	/nfs/dbraw/zinc/36/27/90/1440362790.db2.gz	SZLRFXNSJLWQPV-SFHVURJKSA-N	0	3	344.503	3.092	20	30		EGEDHN
CC(C)CC(=O)NCC[C@@H]1CCN(Cc2ccc(C#N)c(F)c2)C1	ZINC001753320843	1440363476	/nfs/dbraw/zinc/36/34/76/1440363476.db2.gz	JJABYYVUAIOTEU-OAHLLOKOSA-N	0	3	331.435	3.072	20	30		EGEDHN
C[C@H](CC(=O)NCC[C@H]1CCN(Cc2ccc(C#N)s2)C1)C1CC1	ZINC001753340809	1440375328	/nfs/dbraw/zinc/37/53/28/1440375328.db2.gz	KEVLENJFCIONAQ-CABCVRRESA-N	0	3	345.512	3.384	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N1CC[C@H](CN(C)CC#Cc2ccc(Cl)cc2)C1	ZINC001753352920	1440378861	/nfs/dbraw/zinc/37/88/61/1440378861.db2.gz	SONUDCNFXIGOLO-WDYCEAGBSA-N	0	3	344.886	3.128	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC(CN(C)Cc2oc(C)nc2C)CC1	ZINC001753364252	1440384421	/nfs/dbraw/zinc/38/44/21/1440384421.db2.gz	VJXQRCKPKHHOMJ-UHFFFAOYSA-N	0	3	333.476	3.318	20	30		EGEDHN
C=CCCCCCN1C[C@@H]2C[C@H]1CN2C(=O)c1cnc2[nH]ccc2c1	ZINC001753421974	1440395489	/nfs/dbraw/zinc/39/54/89/1440395489.db2.gz	DRJUIABNJGCVOV-ROUUACIJSA-N	0	3	338.455	3.160	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H]2C[C@H]1CN2C(=O)c1cccc(F)c1OCC	ZINC001753425360	1440396623	/nfs/dbraw/zinc/39/66/23/1440396623.db2.gz	NXEYZETZOKFDLR-JYJNAYRXSA-N	0	3	346.446	3.478	20	30		EGEDHN
C=CCCC(=O)NC[C@H](CC)NCc1cc(Cl)cc2c1OCC2	ZINC001753466880	1440413116	/nfs/dbraw/zinc/41/31/16/1440413116.db2.gz	MLSGLRDSAMXSFE-INIZCTEOSA-N	0	3	336.863	3.226	20	30		EGEDHN
CC[C@H](CNC(=O)c1cc[nH]c1C(C)C)NCC#Cc1ccccc1	ZINC001753483109	1440417099	/nfs/dbraw/zinc/41/70/99/1440417099.db2.gz	IHKUKEVRUDXPOB-GOSISDBHSA-N	0	3	337.467	3.288	20	30		EGEDHN
C=C[C@H](C(=O)NC[C@@H](CC)NCc1cncc(F)c1)c1ccccc1	ZINC001753496442	1440421593	/nfs/dbraw/zinc/42/15/93/1440421593.db2.gz	DPBNCLFXESPUPZ-MOPGFXCFSA-N	0	3	341.430	3.175	20	30		EGEDHN
C#CCC1(C(=O)NC[C@H](CC)NCc2ncccc2C)CCCCC1	ZINC001753496569	1440421726	/nfs/dbraw/zinc/42/17/26/1440421726.db2.gz	GXXCDWQPZKDFPW-SFHVURJKSA-N	0	3	341.499	3.348	20	30		EGEDHN
C#CCC1(C(=O)NC[C@@H](CC)NCc2ncccc2C)CCCCC1	ZINC001753496568	1440421789	/nfs/dbraw/zinc/42/17/89/1440421789.db2.gz	GXXCDWQPZKDFPW-GOSISDBHSA-N	0	3	341.499	3.348	20	30		EGEDHN
C=C(C)CCC(=O)N[C@](C)(CNCC#Cc1ccc(F)cc1)C1CC1	ZINC001753518863	1440428072	/nfs/dbraw/zinc/42/80/72/1440428072.db2.gz	RGBQHKKKHXDANW-OAQYLSRUSA-N	0	3	342.458	3.408	20	30		EGEDHN
CC#CCCCC(=O)N[C@@](C)(CNCc1cccc(Cl)n1)C1CC1	ZINC001753521854	1440428724	/nfs/dbraw/zinc/42/87/24/1440428724.db2.gz	VGTDMLCXGOCAOE-IBGZPJMESA-N	0	3	347.890	3.303	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1cc(CC(C)C)c[nH]1)C1CC1	ZINC001753528689	1440430275	/nfs/dbraw/zinc/43/02/75/1440430275.db2.gz	RWHPETLNJIWRTD-SFHVURJKSA-N	0	3	337.895	3.454	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2ccc(C)n2C)CCCC[C@H]1C	ZINC001753529301	1440430552	/nfs/dbraw/zinc/43/05/52/1440430552.db2.gz	CXWVUGKSLXSSPY-FZKQIMNGSA-N	0	3	337.895	3.354	20	30		EGEDHN
N#Cc1ccccc1CNCCC1CCN(C(=O)C2=CCCC2)CC1	ZINC001753566128	1440437694	/nfs/dbraw/zinc/43/76/94/1440437694.db2.gz	HGKBVHQALVQCQM-UHFFFAOYSA-N	0	3	337.467	3.387	20	30		EGEDHN
C=CCCC(=O)NCCC1CCN(Cc2c(C)onc2CC)CC1	ZINC001753593630	1440443814	/nfs/dbraw/zinc/44/38/14/1440443814.db2.gz	HNAKQQHLQAINLO-UHFFFAOYSA-N	0	3	333.476	3.230	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)CCCC2CC2)s1	ZINC001753601366	1440446491	/nfs/dbraw/zinc/44/64/91/1440446491.db2.gz	XHFTWUWEQVBKDX-OAHLLOKOSA-N	0	3	331.485	3.281	20	30		EGEDHN
C=CCCC(=O)N1CCC2(CCN(Cc3cc(C)ns3)C2)CC1	ZINC001753602265	1440446686	/nfs/dbraw/zinc/44/66/86/1440446686.db2.gz	HBINAKIADPSSIZ-UHFFFAOYSA-N	0	3	333.501	3.232	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)C(C)(C)c1ccccc1	ZINC001753641943	1440454696	/nfs/dbraw/zinc/45/46/96/1440454696.db2.gz	FEHRURKZJARQQC-QGZVFWFLSA-N	0	3	349.478	3.378	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cccc3c2O[C@@H](C)C3)CCCC1	ZINC001753667054	1440460681	/nfs/dbraw/zinc/46/06/81/1440460681.db2.gz	PYHVTYOMHOBNSR-AWEZNQCLSA-N	0	3	348.874	3.395	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cc3n(c2)CCCC3)CCCC1	ZINC001753672149	1440462439	/nfs/dbraw/zinc/46/24/39/1440462439.db2.gz	PENINXVVKZEXEF-UHFFFAOYSA-N	0	3	335.879	3.209	20	30		EGEDHN
C[C@@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)CC1CCCC1	ZINC001753677483	1440463702	/nfs/dbraw/zinc/46/37/02/1440463702.db2.gz	PIEVXIVVXLYWSQ-AWEZNQCLSA-N	0	3	331.435	3.214	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccc(Cl)cc1)N(C)C(=O)[C@H]1[C@@H]2CCC[C@@H]21	ZINC001753687372	1440465774	/nfs/dbraw/zinc/46/57/74/1440465774.db2.gz	MNLAHXPKNOERNB-WQANXHIZSA-N	0	3	344.886	3.174	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccc(Cl)cc1)N(C)C(=O)C1=CCCC1	ZINC001753687064	1440465879	/nfs/dbraw/zinc/46/58/79/1440465879.db2.gz	ZGVVYGLJZGCYMF-HNNXBMFYSA-N	0	3	330.859	3.238	20	30		EGEDHN
C[C@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)c1occc1Cl	ZINC001753710335	1440470397	/nfs/dbraw/zinc/47/03/97/1440470397.db2.gz	BXYXBDJKXIZKOC-LLVKDONJSA-N	0	3	349.793	3.194	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)N(C)C(=O)C(C)(C)C(F)(F)F	ZINC001753723139	1440473638	/nfs/dbraw/zinc/47/36/38/1440473638.db2.gz	GBNTZLOMJXKECS-JTQLQIEISA-N	0	3	347.406	3.145	20	30		EGEDHN
CC(C)C[C@H](CNCC#Cc1ccccc1Cl)NC(=O)C(C)C	ZINC001753732819	1440476685	/nfs/dbraw/zinc/47/66/85/1440476685.db2.gz	KRMAWOQHHBGAIE-QGZVFWFLSA-N	0	3	334.891	3.468	20	30		EGEDHN
CC(C)C[C@@H](CNCC#Cc1ccccc1)NC(=O)CCC1CC1	ZINC001753733646	1440476820	/nfs/dbraw/zinc/47/68/20/1440476820.db2.gz	TZPBLOAIEFNASV-FQEVSTJZSA-N	0	3	326.484	3.349	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](NCc2c(F)cccc2F)[C@@H](C)C1	ZINC001753759970	1440483841	/nfs/dbraw/zinc/48/38/41/1440483841.db2.gz	MZKCIQPFIATLNX-HNAYVOBHSA-N	0	3	348.437	3.485	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@H]([C@H](C)NCc2ccn(CC)n2)C1	ZINC001753799728	1440490624	/nfs/dbraw/zinc/49/06/24/1440490624.db2.gz	QGKHZPDYOUGTSU-IRXDYDNUSA-N	0	3	346.519	3.222	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H](C)[C@H]1CNCc1ccc(C#N)cc1F	ZINC001753803720	1440491469	/nfs/dbraw/zinc/49/14/69/1440491469.db2.gz	AQYKBMYGEUZBON-HNAYVOBHSA-N	0	3	343.446	3.380	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H](C)[C@@H]1CNCc1ccc(Cl)nc1	ZINC001753819608	1440495322	/nfs/dbraw/zinc/49/53/22/1440495322.db2.gz	VRJMDARYXREPAP-WBVHZDCISA-N	0	3	347.890	3.255	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC(CCN(C)Cc2ccnn2C)CC1	ZINC001753821414	1440496290	/nfs/dbraw/zinc/49/62/90/1440496290.db2.gz	CHEFFAMEDZYDLF-UHFFFAOYSA-N	0	3	346.519	3.083	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)C1CCC1)NCC#Cc1ccccc1Cl	ZINC001753822428	1440496902	/nfs/dbraw/zinc/49/69/02/1440496902.db2.gz	IVANFTNLSDSRHU-GOSISDBHSA-N	0	3	332.875	3.222	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)[C@@H]1CCC1(C)C)NCC#Cc1ccccc1	ZINC001753839289	1440502064	/nfs/dbraw/zinc/50/20/64/1440502064.db2.gz	WDJNAAMONPPEAX-RBUKOAKNSA-N	0	3	326.484	3.205	20	30		EGEDHN
CC(C)[C@H](CNC(=O)[C@H]1CCC1(C)C)NCC#Cc1ccccc1	ZINC001753839285	1440502066	/nfs/dbraw/zinc/50/20/66/1440502066.db2.gz	WDJNAAMONPPEAX-MOPGFXCFSA-N	0	3	326.484	3.205	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H]2[C@H](CCN2Cc2oc(C)nc2C)C1	ZINC001753871813	1440517625	/nfs/dbraw/zinc/51/76/25/1440517625.db2.gz	HGSRSDBESFUTKZ-IAGOWNOFSA-N	0	3	331.460	3.071	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H]2[C@@H](CCN2Cc2oc(C)nc2C)C1	ZINC001753871811	1440517678	/nfs/dbraw/zinc/51/76/78/1440517678.db2.gz	HGSRSDBESFUTKZ-DLBZAZTESA-N	0	3	331.460	3.071	20	30		EGEDHN
C=C(Cl)CNCC[C@H](C)NC(=O)c1c(Cl)cncc1Cl	ZINC001753997606	1440529641	/nfs/dbraw/zinc/52/96/41/1440529641.db2.gz	ZLRFSFGPMIUKLM-VIFPVBQESA-N	0	3	336.650	3.239	20	30		EGEDHN
CCN(CCN[C@H]1CCc2c1cc(F)cc2F)C(=O)C#CC(C)(C)C	ZINC001754045713	1440535039	/nfs/dbraw/zinc/53/50/39/1440535039.db2.gz	YATZRYPMDUJALY-SFHVURJKSA-N	0	3	348.437	3.440	20	30		EGEDHN
Cc1cc(Cl)ccc1CNC/C=C/CNC(=O)C#CC(C)(C)C	ZINC001754118716	1440542575	/nfs/dbraw/zinc/54/25/75/1440542575.db2.gz	CHQCDRNPYDMHIX-AATRIKPKSA-N	0	3	332.875	3.460	20	30		EGEDHN
O=C(C#CC1CC1)NC/C=C\CN[C@@H]1CCc2c1cccc2Cl	ZINC001754119526	1440542759	/nfs/dbraw/zinc/54/27/59/1440542759.db2.gz	MICXKBPVKPFPPU-QFRLHKFZSA-N	0	3	328.843	3.003	20	30		EGEDHN
C=C1CCC(C(=O)NC/C=C/CNCc2ccccc2N(C)C)CC1	ZINC001754167009	1440546659	/nfs/dbraw/zinc/54/66/59/1440546659.db2.gz	VJBHMGIIBDVMGW-VOTSOKGWSA-N	0	3	341.499	3.261	20	30		EGEDHN
COCC#CCNC/C=C/CNC(=O)CC1CCC(C(C)(C)C)CC1	ZINC001754212758	1440551476	/nfs/dbraw/zinc/55/14/76/1440551476.db2.gz	HDYQLJWOCWKVJV-AATRIKPKSA-N	0	3	348.531	3.141	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@H](C)CNCC#Cc1ccc(Cl)cc1	ZINC001754241632	1440555785	/nfs/dbraw/zinc/55/57/85/1440555785.db2.gz	OUEMYBFWXNKCTJ-DNVCBOLYSA-N	0	3	332.875	3.388	20	30		EGEDHN
C=CCOCCN(C)C[C@H](C)NC(=O)c1cc2ccccc2s1	ZINC001754315119	1440575112	/nfs/dbraw/zinc/57/51/12/1440575112.db2.gz	HSAVASIPPQOVIR-AWEZNQCLSA-N	0	3	332.469	3.154	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](C)CN(C)Cc2ccc(OC)cc2)CC1	ZINC001754324100	1440579608	/nfs/dbraw/zinc/57/96/08/1440579608.db2.gz	ZCISWOSGIXYETC-MRXNPFEDSA-N	0	3	330.472	3.378	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)[C@H](C)c1cccs1	ZINC001754324559	1440579836	/nfs/dbraw/zinc/57/98/36/1440579836.db2.gz	ACTSXBLSSUIXGJ-HUUCEWRRSA-N	0	3	341.480	3.360	20	30		EGEDHN
C=CCOCCN(C)C[C@H](C)NC(=O)c1cc2cc(C)c(C)cc2o1	ZINC001754330816	1440583674	/nfs/dbraw/zinc/58/36/74/1440583674.db2.gz	LCUPVCWDWLESJQ-INIZCTEOSA-N	0	3	344.455	3.302	20	30		EGEDHN
Cc1nc(CNCCCN(C)C(=O)C#CC2CC2)sc1C(C)(C)C	ZINC001754370005	1440592403	/nfs/dbraw/zinc/59/24/03/1440592403.db2.gz	LQRUCJLVESSQFV-UHFFFAOYSA-N	0	3	347.528	3.101	20	30		EGEDHN
C=Cc1ccc(C(=O)N[C@@H](CNCC#Cc2ccccc2)C2CC2)cc1	ZINC001754452798	1440601524	/nfs/dbraw/zinc/60/15/24/1440601524.db2.gz	KQEAUPSTYHRDPP-QFIPXVFZSA-N	0	3	344.458	3.479	20	30		EGEDHN
CC[C@@H]1CN(C(=O)C#CC(C)C)CC[C@@H]1NCc1nc(C)sc1C	ZINC001754464802	1440604048	/nfs/dbraw/zinc/60/40/48/1440604048.db2.gz	MNQJOMZVYYOKKG-SJORKVTESA-N	0	3	347.528	3.136	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](NCc3cnns3)[C@@H](CC)C2)CCC1	ZINC001754471481	1440605542	/nfs/dbraw/zinc/60/55/42/1440605542.db2.gz	ZDFXJNLMLSBTNQ-HOCLYGCPSA-N	0	3	348.516	3.001	20	30		EGEDHN
C=CCC[C@@H](C)N1CC[C@@H]1CNC(=O)c1occc1Br	ZINC001754498196	1440613029	/nfs/dbraw/zinc/61/30/29/1440613029.db2.gz	UVYBJSHECMCYJS-VXGBXAGGSA-N	0	3	341.249	3.201	20	30		EGEDHN
CC[C@@H](NC1(CNC(=O)c2cc(C#N)c[nH]2)CC1)c1ccc(F)cc1	ZINC001754512112	1440617791	/nfs/dbraw/zinc/61/77/91/1440617791.db2.gz	UGQUJTCHFZREQN-MRXNPFEDSA-N	0	3	340.402	3.029	20	30		EGEDHN
CC#CCN(CCOC)C1CCN(C(=O)[C@H]2C[C@H](C)C[C@H](C)C2)CC1	ZINC001754550841	1440629909	/nfs/dbraw/zinc/62/99/09/1440629909.db2.gz	GLYWOOZPHYCBAO-BWTSREIZSA-N	0	3	348.531	3.021	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](NCc2ccn(C(C)C)n2)C[C@@H]1C	ZINC001754596375	1440641504	/nfs/dbraw/zinc/64/15/04/1440641504.db2.gz	VZQLVUZSOLORSO-IRXDYDNUSA-N	0	3	332.492	3.289	20	30		EGEDHN
C#CCN(C(=O)c1cc(F)ccc1F)C1CCN(CC=C(C)C)CC1	ZINC001754638782	1440648905	/nfs/dbraw/zinc/64/89/05/1440648905.db2.gz	LBBPSQSAMONCQW-UHFFFAOYSA-N	0	3	346.421	3.471	20	30		EGEDHN
C#CCN(C(=O)[C@@H]1C[C@]1(C)C(C)C)C1CCN(CCOC(C)C)CC1	ZINC001754641482	1440649156	/nfs/dbraw/zinc/64/91/56/1440649156.db2.gz	CRUANZUVDCUDQU-PZJWPPBQSA-N	0	3	348.531	3.020	20	30		EGEDHN
CC#CCNC[C@H](NC(=O)c1ncoc1C)c1ccc2ccccc2c1	ZINC001754644179	1440649728	/nfs/dbraw/zinc/64/97/28/1440649728.db2.gz	PRNZNBPINNTADQ-IBGZPJMESA-N	0	3	347.418	3.220	20	30		EGEDHN
Cc1cc[nH]c1C(=O)N[C@@H](CNCC#Cc1ccccc1)C1CCCC1	ZINC001754646603	1440650574	/nfs/dbraw/zinc/65/05/74/1440650574.db2.gz	IYEKRKCXSAOOSB-FQEVSTJZSA-N	0	3	349.478	3.253	20	30		EGEDHN
C=CCOCCN1CC[C@@](C)(NC(=O)c2cc(C(C)(C)C)oc2C)C1	ZINC001754680778	1440662149	/nfs/dbraw/zinc/66/21/49/1440662149.db2.gz	ULHGRHYLXQXJOX-HXUWFJFHSA-N	0	3	348.487	3.282	20	30		EGEDHN
C[C@@]1(CNCc2ccccc2C#N)CCN(C(=O)C2CC3(CC3)C2)C1	ZINC001754705615	1440669049	/nfs/dbraw/zinc/66/90/49/1440669049.db2.gz	HRDOHINVJNTMAY-FQEVSTJZSA-N	0	3	337.467	3.077	20	30		EGEDHN
C=C(Cl)CN1CCC(C)(CNC(=O)c2ccn(C)c2CC)CC1	ZINC001754720287	1440672925	/nfs/dbraw/zinc/67/29/25/1440672925.db2.gz	KQXUUWSAGJLRON-UHFFFAOYSA-N	0	3	337.895	3.172	20	30		EGEDHN
C=CCN1CCC[C@@](C)(CNC(=O)c2ccc3nc(C)oc3c2)C1	ZINC001754727353	1440676890	/nfs/dbraw/zinc/67/68/90/1440676890.db2.gz	IWLDPOWZDYCLTA-IBGZPJMESA-N	0	3	327.428	3.154	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@H](CNC(=O)C(C)(C)C2CCCC2)C1	ZINC001754744048	1440684142	/nfs/dbraw/zinc/68/41/42/1440684142.db2.gz	VNZVJTVWSLUNIJ-MRXNPFEDSA-N	0	3	340.458	3.300	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H](C2CCN(Cc3conc3C)CC2)C1	ZINC001754784768	1440687317	/nfs/dbraw/zinc/68/73/17/1440687317.db2.gz	ZMINUUPMOXJBTK-GOSISDBHSA-N	0	3	345.487	3.400	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)C2(CCF)CC2)C1	ZINC001754796455	1440689519	/nfs/dbraw/zinc/68/95/19/1440689519.db2.gz	BVPGSLKTQQNIHY-MAUKXSAKSA-N	0	3	343.446	3.025	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@H]2CN([C@@H](C)c3ccc(Cl)cc3)C[C@H]2C1	ZINC001754842135	1440697978	/nfs/dbraw/zinc/69/79/78/1440697978.db2.gz	LDDBTWAEVOOOSP-RYQLBKOJSA-N	0	3	344.886	3.451	20	30		EGEDHN
C=CC[C@@H](C(=O)N1C[C@H]2CN(C[C@@H](F)CC)C[C@H]2C1)c1ccccc1	ZINC001754847892	1440699644	/nfs/dbraw/zinc/69/96/44/1440699644.db2.gz	KIOYXKIADKUQPL-ZGXWSNOMSA-N	0	3	344.474	3.485	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@]1(CO)CCCN(Cc2ccc(C)c(C)c2)C1	ZINC001754856404	1440700400	/nfs/dbraw/zinc/70/04/00/1440700400.db2.gz	KNRIHKSQWOYGIK-NRFANRHFSA-N	0	3	344.499	3.103	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCN(C(=O)c2ccnn2[C@@H](C)CC)C1	ZINC001754917723	1440708998	/nfs/dbraw/zinc/70/89/98/1440708998.db2.gz	WDLPSWQNTBMXGG-LSDHHAIUSA-N	0	3	338.883	3.048	20	30		EGEDHN
C=C(C)CN(C)Cc1ccccc1CNC(=O)C1CC(OCC)C1	ZINC001754946081	1440713075	/nfs/dbraw/zinc/71/30/75/1440713075.db2.gz	UWMNFZIBMGHPLS-UHFFFAOYSA-N	0	3	330.472	3.126	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)NCc1ccc([C@@H](C)NC/C=C/Cl)cc1	ZINC001754947559	1440713789	/nfs/dbraw/zinc/71/37/89/1440713789.db2.gz	OMGUOFIIDPTVGY-LQFMSZPZSA-N	0	3	336.863	3.033	20	30		EGEDHN
C#CCN[C@H](C)c1ccc(CNC(=O)c2ccc(COC)cc2)cc1	ZINC001754951595	1440715066	/nfs/dbraw/zinc/71/50/66/1440715066.db2.gz	YXRABPXHOPEQJG-MRXNPFEDSA-N	0	3	336.435	3.047	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)CCc3ccncc3)cccc2C1	ZINC001754975543	1440719943	/nfs/dbraw/zinc/71/99/43/1440719943.db2.gz	BRAFQKYCWTXGEM-UHFFFAOYSA-N	0	3	349.478	3.265	20	30		EGEDHN
C#CCCCCCC(=O)NCc1cccc2c1CCN(CCC#C)C2	ZINC001754975832	1440720066	/nfs/dbraw/zinc/72/00/66/1440720066.db2.gz	QJSTZULWGWOFSL-UHFFFAOYSA-N	0	3	336.479	3.268	20	30		EGEDHN
C=CCCC(=O)N1CCO[C@H](CN[C@H](C)c2ccccc2Cl)C1	ZINC001754994827	1440725453	/nfs/dbraw/zinc/72/54/53/1440725453.db2.gz	CIHFZHKUKZGCAZ-HUUCEWRRSA-N	0	3	336.863	3.184	20	30		EGEDHN
C=CCCCN1CCN([C@@H]2CCN(C(=O)CC3=CCCCC3)C2)CC1	ZINC001755017427	1440726316	/nfs/dbraw/zinc/72/63/16/1440726316.db2.gz	NBMOBASDVLPUMX-HXUWFJFHSA-N	0	3	345.531	3.062	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC[C@H]1Cc2ccccc2CN1CC(C)C	ZINC001755074438	1440747925	/nfs/dbraw/zinc/74/79/25/1440747925.db2.gz	ZBHFPUZAQYOVIS-YLJYHZDGSA-N	0	3	344.499	3.167	20	30		EGEDHN
C[C@H]1CN(C(=O)c2ccoc2C2CC2)C[C@H]1NCC#Cc1ccccc1	ZINC001755113437	1440754480	/nfs/dbraw/zinc/75/44/80/1440754480.db2.gz	HKIULAZUNOENJE-OXJNMPFZSA-N	0	3	348.446	3.259	20	30		EGEDHN
C=Cc1ccc(C(=O)N2C[C@H](C)[C@H](NCC#Cc3ccccc3)C2)cc1	ZINC001755116402	1440755013	/nfs/dbraw/zinc/75/50/13/1440755013.db2.gz	NFFHRYWYVVMGGP-PGRDOPGGSA-N	0	3	344.458	3.431	20	30		EGEDHN
CC(C)CC(=O)N[C@H]1CCN(Cc2cccc(C#N)c2)CC1(C)C	ZINC001755136580	1440758344	/nfs/dbraw/zinc/75/83/44/1440758344.db2.gz	BVEUVIXWQDEDSN-SFHVURJKSA-N	0	3	327.472	3.321	20	30		EGEDHN
C=CCCCN1CCc2ccccc2[C@@H]1CNC(=O)c1[nH]cnc1C	ZINC001755170885	1440768929	/nfs/dbraw/zinc/76/89/29/1440768929.db2.gz	CXXBHAHRLJSXRP-SFHVURJKSA-N	0	3	338.455	3.014	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@H]1CNC(=O)C1(C)CCOCC1	ZINC001755171522	1440769034	/nfs/dbraw/zinc/76/90/34/1440769034.db2.gz	XIKZCLVOVCWANQ-LJQANCHMSA-N	0	3	342.483	3.095	20	30		EGEDHN
CC(C)CCCN1CCc2ccccc2[C@@H]1CNC(=O)[C@@H](C)C#N	ZINC001755172171	1440769533	/nfs/dbraw/zinc/76/95/33/1440769533.db2.gz	LIIXKTBPLQZUBF-LPHOPBHVSA-N	0	3	327.472	3.298	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)[C@H]2CC[C@@H](CC)O2)CC1	ZINC001755183318	1440771887	/nfs/dbraw/zinc/77/18/87/1440771887.db2.gz	HRQMIAYCXIAFQL-IAGOWNOFSA-N	0	3	342.911	3.257	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]2CN(C)CCc2scnc2C)C1	ZINC001755199466	1440778838	/nfs/dbraw/zinc/77/88/38/1440778838.db2.gz	WZGYVGMIJGOYKZ-INIZCTEOSA-N	0	3	347.528	3.273	20	30		EGEDHN
C=CCN(C)C[C@@H]1CCCN1C(=O)Cc1cccc(OC(C)C)c1	ZINC001755202559	1440780834	/nfs/dbraw/zinc/78/08/34/1440780834.db2.gz	HULVNHBAVFITSO-SFHVURJKSA-N	0	3	330.472	3.125	20	30		EGEDHN
C=CCOCCN(C)[C@H](C)CNC(=O)c1cc2ccccc2cc1F	ZINC001755307836	1440811947	/nfs/dbraw/zinc/81/19/47/1440811947.db2.gz	OVEWYAUZDKQBOL-OAHLLOKOSA-N	0	3	344.430	3.232	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NC[C@@H](C)N(C)Cc1ccccc1CC	ZINC001755324595	1440820855	/nfs/dbraw/zinc/82/08/55/1440820855.db2.gz	OINAQQXLFKGFNT-GOSISDBHSA-N	0	3	348.490	3.410	20	30		EGEDHN
C=CC(C)(C)C(=O)N(C)CC[C@H](NCc1cc2n(n1)CCC2)C(C)C	ZINC001755341164	1440825287	/nfs/dbraw/zinc/82/52/87/1440825287.db2.gz	CCRVOJZSTJYQOY-SFHVURJKSA-N	0	3	346.519	3.004	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2cc(C)c(C)cn2)CCCCC1	ZINC001755352028	1440828063	/nfs/dbraw/zinc/82/80/63/1440828063.db2.gz	KYCIFJKKDUGQKO-UHFFFAOYSA-N	0	3	335.879	3.473	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H](C)C1CN(CCc2ccc3ccccc3c2)C1	ZINC001755373377	1440837792	/nfs/dbraw/zinc/83/77/92/1440837792.db2.gz	JBIOFBXZHQVTRE-SFHVURJKSA-N	0	3	348.490	3.478	20	30		EGEDHN
C=CCOCCN1CC([C@@H](C)NC(=O)c2cccc(C(C)C)c2)C1	ZINC001755388446	1440841320	/nfs/dbraw/zinc/84/13/20/1440841320.db2.gz	CUOGHCUISAXZQU-MRXNPFEDSA-N	0	3	330.472	3.063	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)C[C@@H](C)c2ccccc2OC)C(C)(C)C1	ZINC001755415976	1440848758	/nfs/dbraw/zinc/84/87/58/1440848758.db2.gz	MYHCXNLIHIDZGM-QAPCUYQASA-N	0	3	330.472	3.201	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC[C@@H]1[C@H]2CN(CCC(F)(F)F)C[C@H]21	ZINC001755422577	1440850121	/nfs/dbraw/zinc/85/01/21/1440850121.db2.gz	GMKUVJAWLZALLZ-QKDCVEJESA-N	0	3	330.394	3.001	20	30		EGEDHN
CCC[C@@H](CC)C(=O)NC[C@@H]1[C@H]2CN(Cc3cccc(C#N)c3)C[C@H]21	ZINC001755430218	1440851002	/nfs/dbraw/zinc/85/10/02/1440851002.db2.gz	OVRGSPRNXIQQCC-WTGUMLROSA-N	0	3	339.483	3.179	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CC[C@@H](NC(=O)CCc3ccco3)C[C@@H]2C1	ZINC001755449462	1440852768	/nfs/dbraw/zinc/85/27/68/1440852768.db2.gz	FXTWUZOSCGODPQ-ARFHVFGLSA-N	0	3	336.863	3.181	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CC[C@@H](NC(=O)C3(C(F)F)CCC3)C[C@H]2C1	ZINC001755453892	1440854752	/nfs/dbraw/zinc/85/47/52/1440854752.db2.gz	UHFLTJIZSUONPB-MELADBBJSA-N	0	3	346.849	3.391	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CC[C@@H](NC(=O)C3(C(F)F)CCC3)C[C@@H]2C1	ZINC001755453890	1440854764	/nfs/dbraw/zinc/85/47/64/1440854764.db2.gz	UHFLTJIZSUONPB-BFHYXJOUSA-N	0	3	346.849	3.391	20	30		EGEDHN
C=C(Br)CNCCC[C@@H](NC(C)=O)c1ccccc1	ZINC001755546806	1440870764	/nfs/dbraw/zinc/87/07/64/1440870764.db2.gz	JEHLNEZWSGJILL-OAHLLOKOSA-N	0	3	325.250	3.142	20	30		EGEDHN
CC[C@H](C)CC(=O)N(C)[C@H](CNCc1cc(C#N)ccc1F)C1CC1	ZINC001755570568	1440876786	/nfs/dbraw/zinc/87/67/86/1440876786.db2.gz	DMQCQRVXRRPZSC-IFXJQAMLSA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@H](CN(C)C(=O)C1(C(F)F)CCCC1)NCC#Cc1ccccc1	ZINC001755600793	1440884103	/nfs/dbraw/zinc/88/41/03/1440884103.db2.gz	HSQYLQSRCJHVIW-MRXNPFEDSA-N	0	3	348.437	3.300	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N(C)C[C@@H](C)NCc1ccc(C#N)c(F)c1	ZINC001755605003	1440885193	/nfs/dbraw/zinc/88/51/93/1440885193.db2.gz	GJJJPLLQMOBXNO-KUHUBIRLSA-N	0	3	331.435	3.236	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@H](CO)NCc1ccc(C(C)(C)C)cc1	ZINC001755640641	1440890848	/nfs/dbraw/zinc/89/08/48/1440890848.db2.gz	NRXIJCGEAMKOLU-GOSISDBHSA-N	0	3	346.515	3.153	20	30		EGEDHN
C/C(=C\C(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@H]1C)C1CC1	ZINC001755660243	1440892587	/nfs/dbraw/zinc/89/25/87/1440892587.db2.gz	ALXGVSLPAKNRHT-WERIUEKSSA-N	0	3	340.442	3.113	20	30		EGEDHN
CCCc1[nH]ccc1C(=O)N1C[C@H](NCC#Cc2ccccc2)C[C@@H]1C	ZINC001755683818	1440895558	/nfs/dbraw/zinc/89/55/58/1440895558.db2.gz	YZFXTDQSNKRXFG-PKOBYXMFSA-N	0	3	349.478	3.212	20	30		EGEDHN
CC#CCN1CC[C@]2(NC(=O)[C@H](CC)OC3CCCCC3)CCC[C@@H]12	ZINC001755699110	1440899066	/nfs/dbraw/zinc/89/90/66/1440899066.db2.gz	SMCXWWWKQSFFNV-QKNQBKEWSA-N	0	3	346.515	3.251	20	30		EGEDHN
C=CCOCCN1CC[C@]2(NC(=O)C(F)=C3CCCC3)CCC[C@H]12	ZINC001755699417	1440899120	/nfs/dbraw/zinc/89/91/20/1440899120.db2.gz	WFWGXUSPJSQBAI-QFBILLFUSA-N	0	3	336.451	3.100	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)CCc2ccc(F)cc2F)[C@H]1C	ZINC001755721356	1440907571	/nfs/dbraw/zinc/90/75/71/1440907571.db2.gz	NJWRSZSCDRTMPZ-KDOFPFPSSA-N	0	3	336.426	3.443	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CC[C@@H](CNCc2nc(C)c(C)s2)C1	ZINC001755743556	1440912029	/nfs/dbraw/zinc/91/20/29/1440912029.db2.gz	KADROCVPPMUYNH-IAGOWNOFSA-N	0	3	347.528	3.328	20	30		EGEDHN
CC1(C)CN(C(=O)C2(CCF)CC2)C[C@@H]1NCc1ccc(C#N)s1	ZINC001755760571	1440914879	/nfs/dbraw/zinc/91/48/79/1440914879.db2.gz	PXWMKXWBOYUYPW-HNNXBMFYSA-N	0	3	349.475	3.086	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1C[C@@H](NCC#Cc2ccccc2)C(C)(C)C1	ZINC001755763974	1440915636	/nfs/dbraw/zinc/91/56/36/1440915636.db2.gz	LRFRXFWJSXAPAW-PKOBYXMFSA-N	0	3	326.484	3.157	20	30		EGEDHN
Cc1cccc(C)c1OCCN(C)CCN(C(=O)[C@@H](C)C#N)C(C)C	ZINC001755810609	1440920174	/nfs/dbraw/zinc/92/01/74/1440920174.db2.gz	GBPMVLBLQKSTQN-SFHVURJKSA-N	0	3	345.487	3.011	20	30		EGEDHN
C=CCC(C)(C)C(=O)N(C)C1CC(N[C@@H](C)c2cnc(C)cn2)C1	ZINC001755862239	1440936986	/nfs/dbraw/zinc/93/69/86/1440936986.db2.gz	BGJXCFJZDWHRSR-FHERZECASA-N	0	3	330.476	3.027	20	30		EGEDHN
C[C@H](CC(=O)N(C)C1CC(NCc2cc(C#N)ccc2F)C1)C1CC1	ZINC001755865490	1440937700	/nfs/dbraw/zinc/93/77/00/1440937700.db2.gz	GGLACKJBVWKIDK-NLNFPOJYSA-N	0	3	343.446	3.213	20	30		EGEDHN
C#CCN1CCC(C2(NC(=O)[C@H](C)c3cccc(Cl)c3)CC2)CC1	ZINC001755870230	1440938935	/nfs/dbraw/zinc/93/89/35/1440938935.db2.gz	YXEKITAHQJCVIG-OAHLLOKOSA-N	0	3	344.886	3.438	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC1=CCN(Cc2ccc(CO)cc2)CC1	ZINC001755894600	1440942177	/nfs/dbraw/zinc/94/21/77/1440942177.db2.gz	VIEZSRGVZLPJNT-UHFFFAOYSA-N	0	3	342.483	3.030	20	30		EGEDHN
CCCC(=O)NCc1ccc(CNCc2cccc(C#N)c2)cc1F	ZINC001755900504	1440943822	/nfs/dbraw/zinc/94/38/22/1440943822.db2.gz	IUVIILQUQBNXIS-UHFFFAOYSA-N	0	3	339.414	3.403	20	30		EGEDHN
CC(C)(C)[C@H](NCC(=O)N[C@@](C)(C#N)C1CC1)c1ccc(F)cc1	ZINC000053644248	214192984	/nfs/dbraw/zinc/19/29/84/214192984.db2.gz	XKJTVDUDSUGVND-MJGOQNOKSA-N	0	3	331.435	3.311	20	30		EGEDHN
Cc1ccc(NC(=O)C2CCN(Cc3ccc(C#N)cc3)CC2)nc1	ZINC000058157487	214484763	/nfs/dbraw/zinc/48/47/63/214484763.db2.gz	UUHOKAHUUNFZCO-UHFFFAOYSA-N	0	3	334.423	3.112	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CN[C@@H](Cc1ccccc1)C1CC1	ZINC000181545846	234226584	/nfs/dbraw/zinc/22/65/84/234226584.db2.gz	DCFYBINBKXPLAM-INIZCTEOSA-N	0	3	325.437	3.169	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(CCC(=O)c3ccccc3)CC2)cc1	ZINC000181935243	234385858	/nfs/dbraw/zinc/38/58/58/234385858.db2.gz	PHCNJICMGOBZRD-UHFFFAOYSA-N	0	3	347.462	3.339	20	30		EGEDHN
C[C@H](NC[C@H](c1cccs1)N1CCOCC1)c1ccc(C#N)cc1	ZINC000072287937	299317351	/nfs/dbraw/zinc/31/73/51/299317351.db2.gz	QMGLUPVGKNJVMS-MAUKXSAKSA-N	0	3	341.480	3.344	20	30		EGEDHN
Cc1nc(C(=O)N[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)ccc1C#N	ZINC000079557805	217240358	/nfs/dbraw/zinc/24/03/58/217240358.db2.gz	VKVOOEFVMHUFFO-BEFAXECRSA-N	0	3	348.450	3.045	20	30		EGEDHN
CC[C@@H](N[C@H]1CCN(Cc2ccccc2)C1=O)c1ccc(C#N)cc1	ZINC000278875537	269675799	/nfs/dbraw/zinc/67/57/99/269675799.db2.gz	XJSZXXWVSSOWPR-UXHICEINSA-N	0	3	333.435	3.400	20	30		EGEDHN
COc1cccc(N2C[C@H](N[C@H](C)c3cccc(C#N)c3)CC2=O)c1	ZINC000378452268	169123093	/nfs/dbraw/zinc/12/30/93/169123093.db2.gz	LEELLPYXWATOBO-RHSMWYFYSA-N	0	3	335.407	3.023	20	30		EGEDHN
C#CCCOc1ccc(CN[C@H](C)[C@H](O)c2cccc(F)c2)cc1	ZINC000267147992	250774655	/nfs/dbraw/zinc/77/46/55/250774655.db2.gz	BLLVCCCEWHHINF-QRWLVFNGSA-N	0	3	327.399	3.440	20	30		EGEDHN
C#CCOc1ccc([C@@H](C)NC[C@H](O)c2ccc(OC)cc2)cc1	ZINC000268761617	252212266	/nfs/dbraw/zinc/21/22/66/252212266.db2.gz	OBVJTVHVKFGFBB-QRWLVFNGSA-N	0	3	325.408	3.091	20	30		EGEDHN
C#CCNC(=O)CCN[C@@H](C)c1ccc(-c2ccccc2OC)cc1	ZINC000268850903	252298275	/nfs/dbraw/zinc/29/82/75/252298275.db2.gz	YAHUUOMRWROFII-INIZCTEOSA-N	0	3	336.435	3.152	20	30		EGEDHN
C[C@@H](NC[C@H]1CN(Cc2ccccc2)CCCO1)c1ccc(C#N)cc1	ZINC000191835296	533435207	/nfs/dbraw/zinc/43/52/07/533435207.db2.gz	BOTCRRNDKUIODM-GCJKJVERSA-N	0	3	349.478	3.500	20	30		EGEDHN
Cc1nc(C(=O)NC2CCN([C@H](C)c3ccccc3)CC2)ccc1C#N	ZINC000172247551	144018783	/nfs/dbraw/zinc/01/87/83/144018783.db2.gz	UUFGJLHUKKWBPF-MRXNPFEDSA-N	0	3	348.450	3.217	20	30		EGEDHN
Cc1sc(NC(=O)CN[C@@H]2CCCO[C@H]2CC(C)C)c(C#N)c1C	ZINC000186389077	144131999	/nfs/dbraw/zinc/13/19/99/144131999.db2.gz	CJAYCMSBZDOGID-CVEARBPZSA-N	0	3	349.500	3.358	20	30		EGEDHN
CCO[C@@H]1C[C@H](NCC(=O)Nc2oc(C)c(C)c2C#N)C1(CC)CC	ZINC000187051781	144151128	/nfs/dbraw/zinc/15/11/28/144151128.db2.gz	RYEFEKLWECVRAR-JKSUJKDBSA-N	0	3	347.459	3.280	20	30		EGEDHN
C[C@H](CNC(=O)CSc1ccc(C#N)cc1)N1CCCC[C@H]1C	ZINC000343206218	144194230	/nfs/dbraw/zinc/19/42/30/144194230.db2.gz	MLSFSLSBFFQIAN-HUUCEWRRSA-N	0	3	331.485	3.029	20	30		EGEDHN
COc1cc(C#N)ccc1CN(CCCO)[C@H]1CCc2ccccc21	ZINC000121149939	152328666	/nfs/dbraw/zinc/32/86/66/152328666.db2.gz	CVTFZLXIRNLRQP-FQEVSTJZSA-N	0	3	336.435	3.439	20	30		EGEDHN
C[C@@H]1CC[C@H](CC(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)C1	ZINC000122101620	152389802	/nfs/dbraw/zinc/38/98/02/152389802.db2.gz	JVVHYAVPRYKTGT-APWZRJJASA-N	0	3	327.472	3.275	20	30		EGEDHN
CCOC[C@@H](N[C@H](C)C(=O)Nc1ccc(C#N)c(Cl)c1)C(C)C	ZINC000189814615	153098707	/nfs/dbraw/zinc/09/87/07/153098707.db2.gz	KJNWESPNIJMEAY-MLGOLLRUSA-N	0	3	337.851	3.189	20	30		EGEDHN
CCOC[C@H](N[C@H](C)C(=O)Nc1ccc(C#N)c(Cl)c1)C(C)C	ZINC000189814595	153099034	/nfs/dbraw/zinc/09/90/34/153099034.db2.gz	KJNWESPNIJMEAY-WBMJQRKESA-N	0	3	337.851	3.189	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN1CCC(c2ccncc2)CC1	ZINC000191640383	153213818	/nfs/dbraw/zinc/21/38/18/153213818.db2.gz	YXYQMGDUKHNSFE-UHFFFAOYSA-N	0	3	340.452	3.223	20	30		EGEDHN
C[C@H](N[C@@H]1CCCC[C@H]1OC(F)F)C(=O)Nc1ccccc1C#N	ZINC000337373812	154317178	/nfs/dbraw/zinc/31/71/78/154317178.db2.gz	ADYSRSOMRVKSBN-NILFDRSVSA-N	0	3	337.370	3.025	20	30		EGEDHN
Cc1cc(CN(CCN(C)C)Cc2ccc(C#N)cc2)ccc1C#N	ZINC000348903882	156283891	/nfs/dbraw/zinc/28/38/91/156283891.db2.gz	IJEMPULDXDYJOI-UHFFFAOYSA-N	0	3	332.451	3.302	20	30		EGEDHN
COc1ccc(CNCc2cn(C)nc2-c2ccc(C#N)cc2)cc1	ZINC000180027367	162720168	/nfs/dbraw/zinc/72/01/68/162720168.db2.gz	JMFGFVIZRZYFFE-UHFFFAOYSA-N	0	3	332.407	3.257	20	30		EGEDHN
C[C@H](N[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O)[C@@H](C)c1ccccc1	ZINC000248953017	163048049	/nfs/dbraw/zinc/04/80/49/163048049.db2.gz	BHFQNSFPQNDDLZ-WWMYMODYSA-N	0	3	347.462	3.441	20	30		EGEDHN
CNC(=O)[C@H](Cc1c[nH]c2ccccc12)N[C@@H](C)c1ccc(C#N)cc1	ZINC000344092033	164101442	/nfs/dbraw/zinc/10/14/42/164101442.db2.gz	CPUHGUPWEQKWFU-XOBRGWDASA-N	0	3	346.434	3.047	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)[C@H]1CCCC1(C)C	ZINC000355292797	166155516	/nfs/dbraw/zinc/15/55/16/166155516.db2.gz	OEJAFTDTKDAIBJ-GOSISDBHSA-N	0	3	327.472	3.275	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)NCc2cccc(C#N)c2)CN1Cc1ccccc1	ZINC000123089679	222214666	/nfs/dbraw/zinc/21/46/66/222214666.db2.gz	XPHVBZGGZZMZFI-UZLBHIALSA-N	0	3	348.450	3.020	20	30		EGEDHN
C[C@@H](CN(C)C)NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1	ZINC000287196322	269835488	/nfs/dbraw/zinc/83/54/88/269835488.db2.gz	YWPVPEJMZZWBTO-AWEZNQCLSA-N	0	3	338.411	3.422	20	30		EGEDHN
N#Cc1c(N[C@H]2CCCN(Cc3ccccc3)C2)nc2ccccn12	ZINC000302064931	270044314	/nfs/dbraw/zinc/04/43/14/270044314.db2.gz	CPCMTZWZEBIGNX-KRWDZBQOSA-N	0	3	331.423	3.282	20	30		EGEDHN
CCc1ccccc1[C@@H](N)CNC(=O)N[C@@H](C)c1ccc(C#N)cc1	ZINC000417108002	270047567	/nfs/dbraw/zinc/04/75/67/270047567.db2.gz	IDBNVHQKKOLVHX-LIRRHRJNSA-N	0	3	336.439	3.181	20	30		EGEDHN
CC1CCN([C@@H](CNc2nccc(C#N)n2)c2cccs2)CC1	ZINC000296196931	265991517	/nfs/dbraw/zinc/99/15/17/265991517.db2.gz	BXLAJEQOPDOEGI-HNNXBMFYSA-N	0	3	327.457	3.295	20	30		EGEDHN
CCN(C[C@H](O)COc1ccc(C#N)cc1)[C@@H](C)c1ccc(C#N)cc1	ZINC000299031032	266134177	/nfs/dbraw/zinc/13/41/77/266134177.db2.gz	HWBSDGBUQHMIDI-JXFKEZNVSA-N	0	3	349.434	3.253	20	30		EGEDHN
CCS[C@H]1CCC[C@H]1NCC(=O)Nc1sc(C)c(C)c1C#N	ZINC000286205119	266347898	/nfs/dbraw/zinc/34/78/98/266347898.db2.gz	QFTLRTDIHLNHSK-KGLIPLIRSA-N	0	3	337.514	3.439	20	30		EGEDHN
C=C(C)CN(Cc1ccccc1)C[C@H](O)COc1ccc(C#N)cc1	ZINC000470909189	266809510	/nfs/dbraw/zinc/80/95/10/266809510.db2.gz	OQWWGYZTWBBTEB-FQEVSTJZSA-N	0	3	336.435	3.376	20	30		EGEDHN
CCCCN(C)CCNC(=O)N1CC=C(c2ccc(C#N)cc2)CC1	ZINC000502163442	267006300	/nfs/dbraw/zinc/00/63/00/267006300.db2.gz	KJFSJMRDKKIVFQ-UHFFFAOYSA-N	0	3	340.471	3.089	20	30		EGEDHN
CCCCN(C)CCNC(=O)N(CCC)Cc1ccc(C#N)cc1	ZINC000491075791	267006321	/nfs/dbraw/zinc/00/63/21/267006321.db2.gz	IJSNFYCECDCOKE-UHFFFAOYSA-N	0	3	330.476	3.212	20	30		EGEDHN
C[C@@H]1CCSCCN1CCC(=O)Nc1sc2c(c1C#N)CCC2	ZINC000279169451	267025795	/nfs/dbraw/zinc/02/57/95/267025795.db2.gz	BUILTBGYRNRONB-GFCCVEGCSA-N	0	3	349.525	3.264	20	30		EGEDHN
C[C@H](CCCC(F)(F)F)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000348510936	267150831	/nfs/dbraw/zinc/15/08/31/267150831.db2.gz	QOCBQVQEWGTPOF-DOMZBBRYSA-N	0	3	337.345	3.478	20	30		EGEDHN
CCOc1ccc2c(c1)CCN(CCC(=O)Nc1cccc(C#N)c1)C2	ZINC000433450356	267172643	/nfs/dbraw/zinc/17/26/43/267172643.db2.gz	MQVZZTMGDQITFX-UHFFFAOYSA-N	0	3	349.434	3.344	20	30		EGEDHN
C[C@H](NC(=O)C(C#N)Cc1ccc(C#N)cc1)c1cccc(F)c1F	ZINC000348418210	267177183	/nfs/dbraw/zinc/17/71/83/267177183.db2.gz	WUYUJIHAZHGUJT-WFASDCNBSA-N	0	3	339.345	3.396	20	30		EGEDHN
CC[C@H](NC[C@@H]1CN(Cc2ccccc2)CCO1)c1ccc(C#N)cc1	ZINC000447511410	267222047	/nfs/dbraw/zinc/22/20/47/267222047.db2.gz	UDCFUEUMABKKQK-YADHBBJMSA-N	0	3	349.478	3.500	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CCN(C(=O)c2ccc(C#N)cc2)C1	ZINC000324138653	267234628	/nfs/dbraw/zinc/23/46/28/267234628.db2.gz	LVRVEFVMTBCMEW-KRWDZBQOSA-N	0	3	333.435	3.152	20	30		EGEDHN
C[C@H](NC(=O)c1c(F)cc(C#N)cc1F)[C@@H](c1ccccc1)N(C)C	ZINC000274617069	267262489	/nfs/dbraw/zinc/26/24/89/267262489.db2.gz	LHCBQOGAHXPXSK-SGTLLEGYSA-N	0	3	343.377	3.258	20	30		EGEDHN
CN(C)C[C@H](NC(=O)/C=C\c1ccc(C#N)cc1)c1ccc(F)cc1	ZINC000493379542	267281751	/nfs/dbraw/zinc/28/17/51/267281751.db2.gz	FLJDYNYEHNMGBK-DIBVOSKASA-N	0	3	337.398	3.130	20	30		EGEDHN
CC1(C)CC[C@@H](CN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)O1	ZINC000274760711	267282765	/nfs/dbraw/zinc/28/27/65/267282765.db2.gz	DKDDJEPTSKRPLI-SFHVURJKSA-N	0	3	341.455	3.166	20	30		EGEDHN
CN(CCN(C)C1CC1)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1	ZINC000274856651	267296787	/nfs/dbraw/zinc/29/67/87/267296787.db2.gz	YDJBKYATHWOEES-UHFFFAOYSA-N	0	3	340.349	3.135	20	30		EGEDHN
COC(=O)N1CCC([C@@H](C)N[C@@H](C)c2ccc(C#N)cc2F)CC1	ZINC000492554204	267376963	/nfs/dbraw/zinc/37/69/63/267376963.db2.gz	YWJGHPNQLDTDQD-OLZOCXBDSA-N	0	3	333.407	3.215	20	30		EGEDHN
Cc1ccc([C@@H](CNc2nc3ccccn3c2C#N)N2CCCC2)o1	ZINC000302109630	267440376	/nfs/dbraw/zinc/44/03/76/267440376.db2.gz	TURYKAYFLGSURC-MRXNPFEDSA-N	0	3	335.411	3.356	20	30		EGEDHN
C[C@@H](C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1)c1cccc(C#N)c1	ZINC000461903815	267681073	/nfs/dbraw/zinc/68/10/73/267681073.db2.gz	UYTBKUVKRQFXAT-DYESRHJHSA-N	0	3	347.462	3.443	20	30		EGEDHN
C[C@H](NC(=O)OC(C)(C)C)[C@H](C)N[C@H]1CCc2ccc(C#N)cc21	ZINC000496559852	267847863	/nfs/dbraw/zinc/84/78/63/267847863.db2.gz	TYQBHBUZKMHIKD-DCGLDWPTSA-N	0	3	329.444	3.437	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCc2ccc(Cl)cc2F)cc1	ZINC000348504935	268085807	/nfs/dbraw/zinc/08/58/07/268085807.db2.gz	DEYYFDOCEBZFTF-HNNXBMFYSA-N	0	3	341.773	3.349	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CC=C(c3ccccc3F)C2)cc1	ZINC000370033811	268088329	/nfs/dbraw/zinc/08/83/29/268088329.db2.gz	TWWFWALXWYXKQS-GOSISDBHSA-N	0	3	345.377	3.305	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCC2(Cc3ccccc3)CC2)cc1	ZINC000279852439	268090192	/nfs/dbraw/zinc/09/01/92/268090192.db2.gz	BDGFDSHJPSCELL-HXUWFJFHSA-N	0	3	343.430	3.380	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@@H]2CCCOc3ccccc32)cc1	ZINC000279306108	268091979	/nfs/dbraw/zinc/09/19/79/268091979.db2.gz	MPURXELTTDOTAD-IEBWSBKVSA-N	0	3	345.402	3.271	20	30		EGEDHN
N#Cc1ccc(N2CCC(NCc3ccc([N+](=O)[O-])cc3)CC2)cc1	ZINC000299575592	268107651	/nfs/dbraw/zinc/10/76/51/268107651.db2.gz	CHLAYWFAFSFGBV-UHFFFAOYSA-N	0	3	336.395	3.225	20	30		EGEDHN
N#Cc1ccc(N2CCN(Cc3ccccc3)C3(CCCCC3)C2)nn1	ZINC000301915016	268118741	/nfs/dbraw/zinc/11/87/41/268118741.db2.gz	DCLHFQGQYQCMHW-UHFFFAOYSA-N	0	3	347.466	3.373	20	30		EGEDHN
N#Cc1cc(Br)ccc1CN[C@H]([C@H](CO)C1CC1)C1CC1	ZINC000451611111	268174708	/nfs/dbraw/zinc/17/47/08/268174708.db2.gz	LBQDANDNZKOEAS-SJORKVTESA-N	0	3	349.272	3.207	20	30		EGEDHN
N#Cc1ccc(C(=O)NCC2CCN(Cc3cccs3)CC2)s1	ZINC000486906171	268197787	/nfs/dbraw/zinc/19/77/87/268197787.db2.gz	JIEBUZWNFPLAGM-UHFFFAOYSA-N	0	3	345.493	3.323	20	30		EGEDHN
N#Cc1ccc(CNCCc2cc(F)cc3c2OCOC3)cc1F	ZINC000421327790	268233092	/nfs/dbraw/zinc/23/30/92/268233092.db2.gz	RDIUMYCDAWZIDX-UHFFFAOYSA-N	0	3	330.334	3.035	20	30		EGEDHN
N#Cc1ccc(CNC[C@@]2(CO)C[C@@H]2c2ccc(F)cc2)c(F)c1	ZINC000428543443	268233574	/nfs/dbraw/zinc/23/35/74/268233574.db2.gz	SERXFMDIKQHJND-IEBWSBKVSA-N	0	3	328.362	3.092	20	30		EGEDHN
N#Cc1ccc(CNC[C@]2(O)CCC[C@@H](C(F)(F)F)C2)cc1F	ZINC000421383032	268233604	/nfs/dbraw/zinc/23/36/04/268233604.db2.gz	JQIRGEOEUGZACC-HIFRSBDPSA-N	0	3	330.325	3.271	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN2CCS[C@@H]3CCCC[C@@H]32)c1	ZINC000333205393	268264993	/nfs/dbraw/zinc/26/49/93/268264993.db2.gz	AKTFOSUTGWGGSD-DLBZAZTESA-N	0	3	329.469	3.247	20	30		EGEDHN
N#Cc1ccnc(NC2CCN(CCOc3ccc(F)cc3)CC2)c1	ZINC000287960221	268296603	/nfs/dbraw/zinc/29/66/03/268296603.db2.gz	SSXPSFKRQHIWDS-UHFFFAOYSA-N	0	3	340.402	3.048	20	30		EGEDHN
Cc1cccc(C(=O)NCCN[C@@H](C)c2ccc(C#N)c(F)c2)c1	ZINC000271927246	275242148	/nfs/dbraw/zinc/24/21/48/275242148.db2.gz	JODGMVYFLWTZFT-AWEZNQCLSA-N	0	3	325.387	3.086	20	30		EGEDHN
CN1CC[C@H](NC(=O)/C=C\c2cccc(C#N)c2)[C@H]1c1ccccc1	ZINC000255121882	308041018	/nfs/dbraw/zinc/04/10/18/308041018.db2.gz	INJVRPJKCMZDAK-OKDBNQDESA-N	0	3	331.419	3.133	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](O)COCc2ccc(Cl)cc2)cc1F	ZINC000404160471	308908560	/nfs/dbraw/zinc/90/85/60/308908560.db2.gz	QFTRFMXDJAFSNP-KRWDZBQOSA-N	0	3	348.805	3.018	20	30		EGEDHN
C[C@@H](CCc1ccccc1)CN1CCN(c2cc(C#N)ccn2)CC1	ZINC000538307157	314239450	/nfs/dbraw/zinc/23/94/50/314239450.db2.gz	ACVGPHUNQQILLS-SFHVURJKSA-N	0	3	334.467	3.344	20	30		EGEDHN
C[C@H](CCc1ccccc1)CN1CCN(c2nccnc2C#N)C[C@H]1C	ZINC000539408553	314312502	/nfs/dbraw/zinc/31/25/02/314312502.db2.gz	YKVQOFNAJURTHO-QZTJIDSGSA-N	0	3	349.482	3.128	20	30		EGEDHN
CN(C)CCOc1ccc(-c2noc(-c3cccc(C#N)c3)n2)cc1	ZINC000544971406	314727501	/nfs/dbraw/zinc/72/75/01/314727501.db2.gz	FXZBNZQLWLUSHC-UHFFFAOYSA-N	0	3	334.379	3.216	20	30		EGEDHN
C[C@H](NCC(=O)NCc1ccc(C#N)cc1)c1ccc2c(c1)CCCC2	ZINC000545520060	314768758	/nfs/dbraw/zinc/76/87/58/314768758.db2.gz	BVFFXLRBEAAKAH-INIZCTEOSA-N	0	3	347.462	3.404	20	30		EGEDHN
CCC[C@@H]1CCCC[C@@H]1NCCS(=O)(=O)c1ccc(C#N)cc1	ZINC000548487625	315016163	/nfs/dbraw/zinc/01/61/63/315016163.db2.gz	ADIGYPGBSYWGES-AEFFLSMTSA-N	0	3	334.485	3.280	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CNCc2cc3c(s2)CCCC3)cc1	ZINC000548928899	315064091	/nfs/dbraw/zinc/06/40/91/315064091.db2.gz	BGZDAKQWCDTQOD-MRXNPFEDSA-N	0	3	342.464	3.028	20	30		EGEDHN
N#Cc1csc(CN[C@H]2CCN(C(=O)Nc3ccccc3)C2)c1	ZINC000549011902	315069455	/nfs/dbraw/zinc/06/94/55/315069455.db2.gz	IBKKCOGRIUAECY-HNNXBMFYSA-N	0	3	326.425	3.016	20	30		EGEDHN
COc1ccc(CNC2CCN(c3ccc(C#N)cc3)CC2)c(F)c1	ZINC000552274824	315210211	/nfs/dbraw/zinc/21/02/11/315210211.db2.gz	CEMXEQHYGFBUNY-UHFFFAOYSA-N	0	3	339.414	3.465	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN[C@H]2CCc3sc(Cl)cc32)cc1	ZINC000564651109	316182548	/nfs/dbraw/zinc/18/25/48/316182548.db2.gz	KFEIMZXOGGXDBA-DOMZBBRYSA-N	0	3	348.855	3.290	20	30		EGEDHN
N#Cc1cccc(CNC[C@@H](O)CO[C@@H]2CCCc3ccccc32)c1	ZINC000564844046	316215731	/nfs/dbraw/zinc/21/57/31/316215731.db2.gz	HSYFGJOMYNUCLZ-TZIWHRDSSA-N	0	3	336.435	3.103	20	30		EGEDHN
C[C@H]1C[C@@H](C(C)(C)C)CCN1CC(=O)NCc1cccc(C#N)c1	ZINC000565125640	316271270	/nfs/dbraw/zinc/27/12/70/316271270.db2.gz	QYQSWURVBVZRLG-YJBOKZPZSA-N	0	3	327.472	3.321	20	30		EGEDHN
N#Cc1cnc2c(Cl)cccc2c1NC[C@@H]1CCCN1CCCO	ZINC000570678355	317092673	/nfs/dbraw/zinc/09/26/73/317092673.db2.gz	OXHPXXLHSWUSQO-AWEZNQCLSA-N	0	3	344.846	3.019	20	30		EGEDHN
C[C@@H](N[C@@H]1CCCN(C)c2ccccc21)C(=O)Nc1cccc(C#N)c1	ZINC000573177314	317446647	/nfs/dbraw/zinc/44/66/47/317446647.db2.gz	QQHUTRYDUGQWCZ-DNVCBOLYSA-N	0	3	348.450	3.446	20	30		EGEDHN
CN(CCC(C)(C)C#N)[C@@H](CO)c1cccc(Br)c1	ZINC000272058351	455835070	/nfs/dbraw/zinc/83/50/70/455835070.db2.gz	WAMWUEXWBBKELG-AWEZNQCLSA-N	0	3	325.250	3.354	20	30		EGEDHN
Cc1cccc([C@H](CNCc2cc(C#N)cs2)N2CCOCC2)c1	ZINC000177684841	323343442	/nfs/dbraw/zinc/34/34/42/323343442.db2.gz	BYBPKFCZYNORLY-IBGZPJMESA-N	0	3	341.480	3.091	20	30		EGEDHN
C[C@@H](NCC(=O)Nc1ccc(C#N)cc1)c1cccc(-n2cccn2)c1	ZINC000183588498	323623717	/nfs/dbraw/zinc/62/37/17/323623717.db2.gz	XZUABLQVLRTCJT-OAHLLOKOSA-N	0	3	345.406	3.033	20	30		EGEDHN
COCCCC[C@H](NCc1cnc2c(C#N)cnn2c1)c1ccccc1	ZINC000582242070	325425257	/nfs/dbraw/zinc/42/52/57/325425257.db2.gz	XTHDGNRXGWDNCR-IBGZPJMESA-N	0	3	349.438	3.249	20	30		EGEDHN
CCN(CCC#N)C(=O)CN[C@@H](c1cccc(F)c1)C1CCCC1	ZINC000180998161	455274274	/nfs/dbraw/zinc/27/42/74/455274274.db2.gz	WMHCFQKKKQCUKO-LJQANCHMSA-N	0	3	331.435	3.409	20	30		EGEDHN
CCc1nn(C)cc1C(=O)C(C#N)C(=O)Nc1cccc2ccccc21	ZINC000181252621	455308302	/nfs/dbraw/zinc/30/83/02/455308302.db2.gz	XZQUETHCXFWMGV-OAHLLOKOSA-N	0	3	346.390	3.097	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CCS[C@@H](C)[C@H]1C)C(C)C	ZINC000605349499	460568367	/nfs/dbraw/zinc/56/83/67/460568367.db2.gz	YOZXRKJXHFGGTN-IXDOHACOSA-N	0	3	339.549	3.220	20	30		EGEDHN
CC(=O)Nc1ccc(SCC(=O)C(C#N)c2nc(C)cs2)cc1	ZINC000007835082	453123342	/nfs/dbraw/zinc/12/33/42/453123342.db2.gz	MMGMYTIWBGTOHH-CQSZACIVSA-N	0	3	345.449	3.379	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)N2CCC[C@](C)(C#N)C2)N(C)C)cc1	ZINC000612357985	460604423	/nfs/dbraw/zinc/60/44/23/460604423.db2.gz	YXALQNOFXPQWSZ-AZUAARDMSA-N	0	3	342.487	3.187	20	30		EGEDHN
C[C@]1(C#N)CCCN(C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)C1	ZINC000612364152	460606217	/nfs/dbraw/zinc/60/62/17/460606217.db2.gz	DYMJPLDBKWFJJP-FXAWDEMLSA-N	0	3	343.446	3.190	20	30		EGEDHN
C[C@@]1(C#N)CCCN(C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)C1	ZINC000612364154	460606878	/nfs/dbraw/zinc/60/68/78/460606878.db2.gz	DYMJPLDBKWFJJP-XLIONFOSSA-N	0	3	343.446	3.190	20	30		EGEDHN
COc1cccc(CN2CCCN(Cc3ccc(C#N)cc3)CC2)c1	ZINC000022850323	453699864	/nfs/dbraw/zinc/69/98/64/453699864.db2.gz	RBWQYIWEWRQACA-UHFFFAOYSA-N	0	3	335.451	3.275	20	30		EGEDHN
C[C@H](NCCC(=O)N(C)CCC#N)c1cccc(C(F)(F)F)c1	ZINC000181611669	455362121	/nfs/dbraw/zinc/36/21/21/455362121.db2.gz	VXWPAWMMJFMNLI-LBPRGKRZSA-N	0	3	327.350	3.118	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H](O)COCc1ccccc1Cl	ZINC000027208024	453812969	/nfs/dbraw/zinc/81/29/69/453812969.db2.gz	GTHWTVGLHQYOLR-SFHVURJKSA-N	0	3	344.842	3.221	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)CCc2ccc(C#N)cc2)N(C)C)cc1	ZINC000027597712	453819405	/nfs/dbraw/zinc/81/94/05/453819405.db2.gz	UNYDZDIASRRPMI-NRFANRHFSA-N	0	3	349.478	3.472	20	30		EGEDHN
C#CCNC(=O)[C@H](C)NC[C@H](c1c[nH]c2ccccc21)c1ccccc1	ZINC000029569859	453829860	/nfs/dbraw/zinc/82/98/60/453829860.db2.gz	GNNIJHPVGYUVPW-LPHOPBHVSA-N	0	3	345.446	3.027	20	30		EGEDHN
C[C@H](NC[C@H](O)COc1ccc(Cl)cc1)c1ccc(C#N)cc1	ZINC000030532771	453836337	/nfs/dbraw/zinc/83/63/37/453836337.db2.gz	BOPWEAHBNGYFQF-GUYCJALGSA-N	0	3	330.815	3.302	20	30		EGEDHN
CCN1CCC[C@@H]1CNC(=O)c1ccccc1-c1ccccc1C#N	ZINC000052834655	453846238	/nfs/dbraw/zinc/84/62/38/453846238.db2.gz	JXSBLCBRUJJKJH-QGZVFWFLSA-N	0	3	333.435	3.439	20	30		EGEDHN
O=C(Nc1nnc2ccccn21)c1ccc(CN2CCCCC2)cc1	ZINC000031805438	453855316	/nfs/dbraw/zinc/85/53/16/453855316.db2.gz	PYOMHSNLZVWHIW-UHFFFAOYSA-N	0	3	335.411	3.352	20	30		EGEDHN
CCN1CCCN(C(=O)c2cccc(Nc3ccc(C#N)cc3)c2)CC1	ZINC000159524977	455382695	/nfs/dbraw/zinc/38/26/95/455382695.db2.gz	SVMQIZOOLYEMJD-UHFFFAOYSA-N	0	3	348.450	3.470	20	30		EGEDHN
CN(C)Cc1cccc(C(=O)N[C@H](C#N)c2ccccc2Cl)c1	ZINC000081400168	453869085	/nfs/dbraw/zinc/86/90/85/453869085.db2.gz	ZHYPAAXPKOVYCF-QGZVFWFLSA-N	0	3	327.815	3.396	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(N3CCC(C)CC3)cc2)CC1	ZINC000067132147	453905061	/nfs/dbraw/zinc/90/50/61/453905061.db2.gz	BTRVVVMFHLPFTO-UHFFFAOYSA-N	0	3	339.483	3.207	20	30		EGEDHN
N#Cc1cccc(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)c1	ZINC000067361782	453924520	/nfs/dbraw/zinc/92/45/20/453924520.db2.gz	ALWJHGOFHVFCSX-IBGZPJMESA-N	0	3	333.435	3.200	20	30		EGEDHN
C[C@H](NC(=O)NCCN(C)Cc1ccccc1)c1ccc(C#N)cc1	ZINC000054764234	453945713	/nfs/dbraw/zinc/94/57/13/453945713.db2.gz	OPHSYMGTKRQGCW-INIZCTEOSA-N	0	3	336.439	3.050	20	30		EGEDHN
CCS[C@H]1CC[C@H](N(C)CC(=O)N(C)C2(C#N)CCCCC2)C1	ZINC000076069633	453957683	/nfs/dbraw/zinc/95/76/83/453957683.db2.gz	YHDUICLCCGPIGX-HOTGVXAUSA-N	0	3	337.533	3.277	20	30		EGEDHN
CN1CCC(NC(=O)Nc2cccc(C#Cc3ccccc3)c2)CC1	ZINC000076097482	453963487	/nfs/dbraw/zinc/96/34/87/453963487.db2.gz	VHDOJMILJYNYFN-UHFFFAOYSA-N	0	3	333.435	3.302	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccc(NC(=O)C(C)C)cc2)nc(C)n1	ZINC000041560148	453971712	/nfs/dbraw/zinc/97/17/12/453971712.db2.gz	SBMOQXWIGMDAIH-MRXNPFEDSA-N	0	3	336.395	3.178	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2cccc(Nc3ncccn3)c2)nc(C)n1	ZINC000041560435	453972310	/nfs/dbraw/zinc/97/23/10/453972310.db2.gz	GXYZQBHFZDAOBH-INIZCTEOSA-N	0	3	344.378	3.117	20	30		EGEDHN
Cc1ccccc1CN1CCC(NC(=O)c2cc(C#N)cs2)CC1	ZINC000084181745	453975374	/nfs/dbraw/zinc/97/53/74/453975374.db2.gz	IFKJDASASYUOCH-UHFFFAOYSA-N	0	3	339.464	3.323	20	30		EGEDHN
N#CCc1cccc(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)c1	ZINC000042378868	454008868	/nfs/dbraw/zinc/00/88/68/454008868.db2.gz	ROBDBGAMUKYWLL-FQEVSTJZSA-N	0	3	333.435	3.320	20	30		EGEDHN
CN(C)[C@H](CNC(=O)Nc1ccc(F)c(C#N)c1)c1ccccc1	ZINC000077499790	454113880	/nfs/dbraw/zinc/11/38/80/454113880.db2.gz	UBJWGGQGBRURBD-QGZVFWFLSA-N	0	3	326.375	3.122	20	30		EGEDHN
N#CCc1ccc(C(=O)N2C[C@H]3CCCN3Cc3ccccc32)cc1	ZINC000089422281	454148206	/nfs/dbraw/zinc/14/82/06/454148206.db2.gz	OANABGUENIBXMR-LJQANCHMSA-N	0	3	331.419	3.377	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN(CC)CC2CC2)cc1	ZINC000070014730	454164392	/nfs/dbraw/zinc/16/43/92/454164392.db2.gz	JGSKUZVDLMXJSS-UHFFFAOYSA-N	0	3	329.444	3.064	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)C2CCN(Cc3cccc(C#N)c3)CC2)C1	ZINC000045804005	454183819	/nfs/dbraw/zinc/18/38/19/454183819.db2.gz	GHJLGOTUIIOCBI-MRXNPFEDSA-N	0	3	325.456	3.029	20	30		EGEDHN
C[C@@H]1CN(Cc2cn(CCC#N)nc2-c2ccccc2)CCS1	ZINC000131320229	454246376	/nfs/dbraw/zinc/24/63/76/454246376.db2.gz	KBPDXFKRUILUNS-OAHLLOKOSA-N	0	3	326.469	3.401	20	30		EGEDHN
C[C@H](NC[C@H](O)c1ccc(C#N)cc1)c1cccc(N2CCCC2=O)c1	ZINC000095984701	454250833	/nfs/dbraw/zinc/25/08/33/454250833.db2.gz	YLWMDMVMKIGERO-YWZLYKJASA-N	0	3	349.434	3.069	20	30		EGEDHN
CN(Cc1ccc(N(C)CCC#N)cc1)Cc1ccc2c(c1)OCO2	ZINC000120063221	454253722	/nfs/dbraw/zinc/25/37/22/454253722.db2.gz	FQGPCRHIXSMFCF-UHFFFAOYSA-N	0	3	337.423	3.397	20	30		EGEDHN
C=CCNC(=O)[C@@H](C)N[C@H](C)c1ccc(OCc2cccnc2)cc1	ZINC000120090388	454257317	/nfs/dbraw/zinc/25/73/17/454257317.db2.gz	DDQCMPJXOJZOPC-HZPDHXFCSA-N	0	3	339.439	3.002	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@H](C)N2CCC[C@@H](C)C2)cc1OC	ZINC000046954363	454307780	/nfs/dbraw/zinc/30/77/80/454307780.db2.gz	YGBSIKZHVPWVHN-CVEARBPZSA-N	0	3	346.471	3.110	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2nc(C(C)C)cs2)CC1	ZINC000132529523	454345786	/nfs/dbraw/zinc/34/57/86/454345786.db2.gz	BOGBDZRVTYGPEA-UHFFFAOYSA-N	0	3	336.505	3.106	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](CCC#N)c2ccccc2)CC1	ZINC000132798167	454366845	/nfs/dbraw/zinc/36/68/45/454366845.db2.gz	PYQZCSYTNUXQAJ-LJQANCHMSA-N	0	3	340.471	3.371	20	30		EGEDHN
Cc1cccc(C2(NCC(=O)N[C@@](C)(C#N)C3CC3)CCCC2)c1	ZINC000072962862	454372365	/nfs/dbraw/zinc/37/23/65/454372365.db2.gz	WBFQEFKHLOKLAK-IBGZPJMESA-N	0	3	325.456	3.162	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(CNCc3cccc(C#N)c3)cc2)C[C@@H](C)O1	ZINC000047609586	454389618	/nfs/dbraw/zinc/38/96/18/454389618.db2.gz	RKQJVHURAMXVPA-QZTJIDSGSA-N	0	3	349.478	3.457	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N[C@H](C)c1cccnc1)C(C)C	ZINC000079268997	454389611	/nfs/dbraw/zinc/38/96/11/454389611.db2.gz	WXNKZCMVAXORHI-SJLPKXTDSA-N	0	3	330.476	3.140	20	30		EGEDHN
C[C@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(C#N)cc1	ZINC000047966356	454424192	/nfs/dbraw/zinc/42/41/92/454424192.db2.gz	CLEQSBXTFZSXHT-OXJNMPFZSA-N	0	3	348.450	3.193	20	30		EGEDHN
C=CCOCCCC(=O)NC[C@@H](C(C)C)N1CCc2ccccc2C1	ZINC000079494199	454425240	/nfs/dbraw/zinc/42/52/40/454425240.db2.gz	ZEWWVMRJWBWGLF-FQEVSTJZSA-N	0	3	344.499	3.168	20	30		EGEDHN
CN(C)Cc1ccccc1NC(=O)CSCc1ccc(C#N)cc1	ZINC000048193603	454454718	/nfs/dbraw/zinc/45/47/18/454454718.db2.gz	NKDKWYMSWKEIFT-UHFFFAOYSA-N	0	3	339.464	3.492	20	30		EGEDHN
N#Cc1cccc(OC2CCN(Cc3cccc4c[nH]nc43)CC2)c1	ZINC000092034294	454505068	/nfs/dbraw/zinc/50/50/68/454505068.db2.gz	WWDKQMGERJWLLI-UHFFFAOYSA-N	0	3	332.407	3.478	20	30		EGEDHN
Cc1nc(-c2ccc(C(=O)C(C#N)c3nc4ccccc4[nH]3)cc2)n[nH]1	ZINC000134120921	454506272	/nfs/dbraw/zinc/50/62/72/454506272.db2.gz	DLBBWRSAIUCJTE-AWEZNQCLSA-N	0	3	342.362	3.147	20	30		EGEDHN
CCCc1c(C(=O)C(C#N)c2nc(C)cs2)[nH]c(C)c1C(=O)OC	ZINC000048789509	454516183	/nfs/dbraw/zinc/51/61/83/454516183.db2.gz	VMOVAZNCJBJRFQ-GFCCVEGCSA-N	0	3	345.424	3.317	20	30		EGEDHN
CN(CC#Cc1ccc(OC(F)(F)F)cc1)[C@H](CO)C(C)(C)C	ZINC000134445707	454544199	/nfs/dbraw/zinc/54/41/99/454544199.db2.gz	XJVLSLWHNWNRLO-OAHLLOKOSA-N	0	3	329.362	3.276	20	30		EGEDHN
C=CCc1cc(CN[C@@H](COC)Cc2ccccc2)cc(OC)c1O	ZINC000080244316	454554998	/nfs/dbraw/zinc/55/49/98/454554998.db2.gz	HUULPGIZWWZEEV-LJQANCHMSA-N	0	3	341.451	3.477	20	30		EGEDHN
COc1ccccc1C(C)(C)NCCC(=O)Nc1sccc1C#N	ZINC000103484465	454560492	/nfs/dbraw/zinc/56/04/92/454560492.db2.gz	AXFSTNAPHZQWNO-UHFFFAOYSA-N	0	3	343.452	3.482	20	30		EGEDHN
CCN(Cc1ccc(OC)c(OCCCC#N)c1)C[C@H]1CCCO1	ZINC000092407762	454562510	/nfs/dbraw/zinc/56/25/10/454562510.db2.gz	ZKYDFHJXGSOHCB-QGZVFWFLSA-N	0	3	332.444	3.379	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1ccc2c(c1)COC2)C(C)C	ZINC000049993138	454566733	/nfs/dbraw/zinc/56/67/33/454566733.db2.gz	ITMXQUSHBHHGLG-LJQANCHMSA-N	0	3	328.456	3.145	20	30		EGEDHN
C=CCc1cc(CNCc2ccc([S@@](C)=O)cc2)cc(OC)c1O	ZINC000080344752	454569392	/nfs/dbraw/zinc/56/93/92/454569392.db2.gz	AEMKQZOQSQBAFT-DEOSSOPVSA-N	0	3	345.464	3.157	20	30		EGEDHN
C[C@](C#N)(NC(=O)CN[C@@H](c1ccc(F)cc1)C1CCC1)C1CC1	ZINC000104706132	454596308	/nfs/dbraw/zinc/59/63/08/454596308.db2.gz	TXSUTDOGZPUOGA-RTBURBONSA-N	0	3	329.419	3.065	20	30		EGEDHN
C=CCN(CC=C)C(=O)c1ccc(N2CCN(C(C)C)CC2)cc1	ZINC000065741931	454617829	/nfs/dbraw/zinc/61/78/29/454617829.db2.gz	LRKQTWSONIJYNM-UHFFFAOYSA-N	0	3	327.472	3.031	20	30		EGEDHN
N#Cc1cccc(OCCN2CCCN(Cc3ccccc3)CC2)c1	ZINC000051508306	454628194	/nfs/dbraw/zinc/62/81/94/454628194.db2.gz	XMABNVGQKPZPDL-UHFFFAOYSA-N	0	3	335.451	3.145	20	30		EGEDHN
C[C@H](CO)CSCC(=O)C(C#N)c1nc(-c2ccccc2)cs1	ZINC000074787368	454635804	/nfs/dbraw/zinc/63/58/04/454635804.db2.gz	YOGQXTOJHIFKRB-TZMCWYRMSA-N	0	3	346.477	3.348	20	30		EGEDHN
COc1ccc(CN2CCC[C@H]2C[C@H](O)c2ccco2)cc1C#N	ZINC000135148264	454638363	/nfs/dbraw/zinc/63/83/63/454638363.db2.gz	UOQFSTNRLBHAGF-IRXDYDNUSA-N	0	3	326.396	3.248	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)c1sccc1C#N)c1ccsc1	ZINC000052035051	454650507	/nfs/dbraw/zinc/65/05/07/454650507.db2.gz	KBVDINRPXFOZMJ-AWEZNQCLSA-N	0	3	333.482	3.494	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Cc2ccc(C(F)(F)F)cc2)CC1	ZINC000106038145	454675951	/nfs/dbraw/zinc/67/59/51/454675951.db2.gz	SBLRHTQJBBTYLU-UHFFFAOYSA-N	0	3	340.389	3.405	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2nc(Cl)ccc2Cl)CC1	ZINC000106038609	454676182	/nfs/dbraw/zinc/67/61/82/454676182.db2.gz	RRVXSEMWFWUHBV-UHFFFAOYSA-N	0	3	328.243	3.159	20	30		EGEDHN
COCC1CCN(Cc2cn(CCC#N)nc2-c2ccccc2)CC1	ZINC000093103483	454682855	/nfs/dbraw/zinc/68/28/55/454682855.db2.gz	OWTXYBOUCZQZGM-UHFFFAOYSA-N	0	3	338.455	3.322	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN(C)[C@@H](C)CNC(=O)OC(C)(C)C)cc1	ZINC000093360159	454708248	/nfs/dbraw/zinc/70/82/48/454708248.db2.gz	NVMWOKUSFOTIJF-GJZGRUSLSA-N	0	3	347.459	3.322	20	30		EGEDHN
C=C[C@@H](C)NCc1ccc(OCc2ccc(C(=O)OC)o2)c(OC)c1	ZINC000152758349	454721688	/nfs/dbraw/zinc/72/16/88/454721688.db2.gz	LWAIDCHZQSBEKU-CYBMUJFWSA-N	0	3	345.395	3.318	20	30		EGEDHN
CCN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)NCCCCC#N	ZINC000176391749	454738409	/nfs/dbraw/zinc/73/84/09/454738409.db2.gz	PKWQFUUUYKUMEU-LJQANCHMSA-N	0	3	342.487	3.234	20	30		EGEDHN
C[C@H]1CN(Cc2cccc(CNCc3ccc(C#N)s3)c2)CCO1	ZINC000176955318	454803249	/nfs/dbraw/zinc/80/32/49/454803249.db2.gz	UXOHLTWRSMVQDD-HNNXBMFYSA-N	0	3	341.480	3.130	20	30		EGEDHN
N#CCCN(CCC#N)C(=O)CN[C@@H](c1ccccc1)C1CCCC1	ZINC000109800879	454837050	/nfs/dbraw/zinc/83/70/50/454837050.db2.gz	CTMPQWUIDICOKF-FQEVSTJZSA-N	0	3	338.455	3.163	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1	ZINC000143002936	454839933	/nfs/dbraw/zinc/83/99/33/454839933.db2.gz	SIRNYWIPVGXWNR-PKOBYXMFSA-N	0	3	330.472	3.229	20	30		EGEDHN
C=CC1CCN(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)CC1	ZINC000111789671	454876135	/nfs/dbraw/zinc/87/61/35/454876135.db2.gz	QBQKAXXOQAQMSS-IBGZPJMESA-N	0	3	327.472	3.431	20	30		EGEDHN
N#CCCN(C(=O)CN1C[C@H]2CCC[C@@H]2C1)c1cccc(Cl)c1	ZINC000154323955	454884862	/nfs/dbraw/zinc/88/48/62/454884862.db2.gz	GKEJDZCXASDYED-HUUCEWRRSA-N	0	3	331.847	3.319	20	30		EGEDHN
N#CCCCOc1cccc(CNCCC(=O)Nc2ccccc2)c1	ZINC000113346283	454924373	/nfs/dbraw/zinc/92/43/73/454924373.db2.gz	CSLGRFIEWMCCFK-UHFFFAOYSA-N	0	3	337.423	3.488	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@H](CNC(=O)c3ccccc3)C2)c1	ZINC000178054756	454930208	/nfs/dbraw/zinc/93/02/08/454930208.db2.gz	WNUUXBQHWQAIMH-LJQANCHMSA-N	0	3	333.435	3.200	20	30		EGEDHN
CC(C)OCCN1CCC(N=Cc2cc3ccccc3[nH]c2=O)CC1	ZINC000178298589	454946536	/nfs/dbraw/zinc/94/65/36/454946536.db2.gz	LGEMQAALVMFHPB-KGENOOAVSA-N	0	3	341.455	3.249	20	30		EGEDHN
C=CCOc1ccc(CNC[C@](C)(O)c2ccccc2)cc1OC	ZINC000114508245	454959242	/nfs/dbraw/zinc/95/92/42/454959242.db2.gz	RZMOCWINEQQTIN-FQEVSTJZSA-N	0	3	327.424	3.257	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCC(C)(C)c2cccs2)CC1	ZINC000114527295	454960484	/nfs/dbraw/zinc/96/04/84/454960484.db2.gz	LJTHIDCINFLYEM-UHFFFAOYSA-N	0	3	335.517	3.365	20	30		EGEDHN
C=CC[C@H](C)[C@@H](C)NCc1ccccc1S(=O)(=O)NC(C)(C)C	ZINC000155098959	454962931	/nfs/dbraw/zinc/96/29/31/454962931.db2.gz	IGBHTJNIJXQKHT-LSDHHAIUSA-N	0	3	338.517	3.454	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@@H](C)N1CC[C@H](c2ccc(OC)cc2)C1	ZINC000155230992	454977235	/nfs/dbraw/zinc/97/72/35/454977235.db2.gz	GFMSGKGWUCTHBI-AEFFLSMTSA-N	0	3	328.456	3.074	20	30		EGEDHN
CC1CCC(N2CCN(C(=O)Nc3ccc(CC#N)cc3)CC2)CC1	ZINC000115751746	455028449	/nfs/dbraw/zinc/02/84/49/455028449.db2.gz	KBBOIWUIESBRCY-UHFFFAOYSA-N	0	3	340.471	3.481	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H]2c3ccccc3CC[C@@H]2C)CC1	ZINC000179357240	455038209	/nfs/dbraw/zinc/03/82/09/455038209.db2.gz	OSHUVDSRYPWCMJ-KXBFYZLASA-N	0	3	327.472	3.260	20	30		EGEDHN
N#CC(C(=O)c1ccc(C2(C#N)CC2)cc1)c1nnc2n1CCCCC2	ZINC000179913815	455098094	/nfs/dbraw/zinc/09/80/94/455098094.db2.gz	KHQJGMGQANACFB-MRXNPFEDSA-N	0	3	345.406	3.050	20	30		EGEDHN
N#CC(C(=O)c1ccc(C2(C#N)CC2)cc1)c1nnc2n1CCCCC2	ZINC000179913830	455098200	/nfs/dbraw/zinc/09/82/00/455098200.db2.gz	KHQJGMGQANACFB-INIZCTEOSA-N	0	3	345.406	3.050	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H](CC)c2ccc(OC)cc2)CC1	ZINC000180479699	455178290	/nfs/dbraw/zinc/17/82/90/455178290.db2.gz	OXKLHUBYRRFHER-LJQANCHMSA-N	0	3	330.472	3.346	20	30		EGEDHN
Cc1nccn1-c1ccc(CNCc2ccc(O[C@@H](C)C#N)cc2)cn1	ZINC000237495770	455189249	/nfs/dbraw/zinc/18/92/49/455189249.db2.gz	RRBAXACWYHCALW-HNNXBMFYSA-N	0	3	347.422	3.156	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](C)c2cc(C)ccc2OC)CC1	ZINC000264428906	455211384	/nfs/dbraw/zinc/21/13/84/455211384.db2.gz	TVZQUVAFOSQFLF-HNNXBMFYSA-N	0	3	331.460	3.014	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC000158325341	455292864	/nfs/dbraw/zinc/29/28/64/455292864.db2.gz	KRWMPCRAJNWNHU-FQEVSTJZSA-N	0	3	341.455	3.391	20	30		EGEDHN
CCNC(=O)c1ccc(CN[C@H](C)c2ccc(OCC#N)cc2)cc1	ZINC000181506072	455345090	/nfs/dbraw/zinc/34/50/90/455345090.db2.gz	MTVYQADGTXVWHN-OAHLLOKOSA-N	0	3	337.423	3.189	20	30		EGEDHN
CN(C(=O)CN[C@@H](Cc1ccccc1)C1CC1)C1(C#N)CCCCC1	ZINC000181559371	455355743	/nfs/dbraw/zinc/35/57/43/455355743.db2.gz	YEBGOPDLKAXPOH-IBGZPJMESA-N	0	3	339.483	3.282	20	30		EGEDHN
COc1ccc2oc([C@H](C)NCCC(=O)N(C)CCC#N)c(C)c2c1	ZINC000184335211	455371946	/nfs/dbraw/zinc/37/19/46/455371946.db2.gz	YUCKOLIWMPJXNM-AWEZNQCLSA-N	0	3	343.427	3.163	20	30		EGEDHN
N#CC(C(=O)c1ccc2c(c1)CCC(=O)N2)c1cnc2ccccc2n1	ZINC000190894185	455399128	/nfs/dbraw/zinc/39/91/28/455399128.db2.gz	NRPCXMGLMPOSOL-AWEZNQCLSA-N	0	3	342.358	3.005	20	30		EGEDHN
CC(C)(C#N)CCCN1CCC(NC(=O)NC2CCCCC2)CC1	ZINC000174832606	455415798	/nfs/dbraw/zinc/41/57/98/455415798.db2.gz	ORANZIOSGBSRPC-UHFFFAOYSA-N	0	3	334.508	3.413	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN1CCS[C@@H]2CCCC[C@H]21	ZINC000246089408	455424118	/nfs/dbraw/zinc/42/41/18/455424118.db2.gz	GSEHKYFOVYOAPM-ZIAGYGMSSA-N	0	3	335.498	3.308	20	30		EGEDHN
C[C@@H](NC[C@@H]1COC2(CCCCC2)O1)c1ccc(OCC#N)cc1	ZINC000182130640	455442548	/nfs/dbraw/zinc/44/25/48/455442548.db2.gz	YCCTYMDXEVNKPY-CRAIPNDOSA-N	0	3	330.428	3.315	20	30		EGEDHN
C=CCN(Cc1ccccc1F)C(=O)N[C@@H]1C[C@@H](C)N(C2CC2)C1	ZINC000175612290	455471079	/nfs/dbraw/zinc/47/10/79/455471079.db2.gz	VEYPTFKGCZGIEA-GDBMZVCRSA-N	0	3	331.435	3.149	20	30		EGEDHN
CC[C@@H](NCCC(=O)Nc1sccc1C#N)c1c(C)noc1C	ZINC000182452791	455517130	/nfs/dbraw/zinc/51/71/30/455517130.db2.gz	JPOVTRASTQQFFY-CYBMUJFWSA-N	0	3	332.429	3.294	20	30		EGEDHN
CC#CCCCC(=O)Nc1cccc(N2CCN(CC3CC3)CC2)c1	ZINC000185284468	455533533	/nfs/dbraw/zinc/53/35/33/455533533.db2.gz	ZFOXCOHUGLNJBQ-UHFFFAOYSA-N	0	3	339.483	3.351	20	30		EGEDHN
CC[C@]1(CO)CCCN1Cc1ccc(OC)c(OCCCC#N)c1	ZINC000191957299	455534873	/nfs/dbraw/zinc/53/48/73/455534873.db2.gz	JTTNETCBSVDVPS-LJQANCHMSA-N	0	3	332.444	3.115	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)c1c(F)cc(C#N)cc1F	ZINC000182538508	455535447	/nfs/dbraw/zinc/53/54/47/455535447.db2.gz	LAYYBGJOBLPFOB-ZDUSSCGKSA-N	0	3	343.377	3.087	20	30		EGEDHN
Cc1nnc(-c2cccc(C(=O)C(C#N)c3nc4ccccc4[nH]3)c2)o1	ZINC000161175915	455543912	/nfs/dbraw/zinc/54/39/12/455543912.db2.gz	VAAXVBSROQXWNX-AWEZNQCLSA-N	0	3	343.346	3.411	20	30		EGEDHN
N#CCCn1cc(CNCCNc2ccccn2)c(-c2ccccc2)n1	ZINC000268094958	455591417	/nfs/dbraw/zinc/59/14/17/455591417.db2.gz	BWESBZPEBOHRNX-UHFFFAOYSA-N	0	3	346.438	3.060	20	30		EGEDHN
COc1ccccc1N(CCC#N)C(=O)[C@H](C)N1C[C@@H]2CCC[C@H]2C1	ZINC000247495125	455611479	/nfs/dbraw/zinc/61/14/79/455611479.db2.gz	XDQVNLQTRNJQKX-ULQDDVLXSA-N	0	3	341.455	3.062	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2CN[C@@H]2CCC[C@H](C#N)C2)C[C@@H](C)O1	ZINC000192754325	455686343	/nfs/dbraw/zinc/68/63/43/455686343.db2.gz	MOQMQPGIXYAQMU-DCXXXQMHSA-N	0	3	341.499	3.468	20	30		EGEDHN
C[NH+](C)C1CCN(c2ccc(/N=C/c3cccc([O-])c3O)cc2)CC1	ZINC000271578880	455690376	/nfs/dbraw/zinc/69/03/76/455690376.db2.gz	BMDZFZGTQZXOBA-KGENOOAVSA-N	0	3	339.439	3.379	20	30		EGEDHN
CCCCN(C)C(=O)C1CCN(Cc2ccc(C#N)cc2C)CC1	ZINC000186170826	455709184	/nfs/dbraw/zinc/70/91/84/455709184.db2.gz	PDLARJVFZTYMLH-UHFFFAOYSA-N	0	3	327.472	3.337	20	30		EGEDHN
C#CCCCCC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000271685885	455721631	/nfs/dbraw/zinc/72/16/31/455721631.db2.gz	PVGKTQZTJRDOBB-UHFFFAOYSA-N	0	3	342.483	3.014	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCC[C@H](CNC(=O)C(C)(C)C)C1	ZINC000186229897	455722027	/nfs/dbraw/zinc/72/20/27/455722027.db2.gz	PJIZWAVKMPXHHF-QGZVFWFLSA-N	0	3	327.472	3.241	20	30		EGEDHN
C#CC[C@@H](NC(=O)N1CCN(C2CCC2)C[C@H](C)C1)c1ccccc1	ZINC000292778974	455755552	/nfs/dbraw/zinc/75/55/52/455755552.db2.gz	XVKSCDZGUIZTEE-FXAWDEMLSA-N	0	3	339.483	3.267	20	30		EGEDHN
C[C@H](NC[C@H]1CN(Cc2ccccc2)CCO1)c1cccc(C#N)c1	ZINC000271785801	455759369	/nfs/dbraw/zinc/75/93/69/455759369.db2.gz	GZPPLVKJQIEDHW-UWJYYQICSA-N	0	3	335.451	3.110	20	30		EGEDHN
C=CCC(C)(C)CNC(=O)c1ccc(CN2CCC(CO)CC2)cc1	ZINC000293851827	455799002	/nfs/dbraw/zinc/79/90/02/455799002.db2.gz	VAXUXXXCUDWCBV-UHFFFAOYSA-N	0	3	344.499	3.223	20	30		EGEDHN
CC(C)(C)OC(=O)N1C[C@@H]2CCN(Cc3ccc(C#N)o3)CC[C@@H]2C1	ZINC000294053180	455803901	/nfs/dbraw/zinc/80/39/01/455803901.db2.gz	XFZYADUXJIFDOS-GASCZTMLSA-N	0	3	345.443	3.230	20	30		EGEDHN
C[C@@H](N[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccc(C#N)c(F)c1	ZINC000271966320	455807352	/nfs/dbraw/zinc/80/73/52/455807352.db2.gz	SPMSAKWGFYSNBI-DOMZBBRYSA-N	0	3	333.407	3.357	20	30		EGEDHN
C=CCOc1ccc(C(=O)Nc2ccc3c(c2)CNCC3)cc1OC	ZINC000269220148	455814373	/nfs/dbraw/zinc/81/43/73/455814373.db2.gz	RDJBXZKPGKBTQF-UHFFFAOYSA-N	0	3	338.407	3.158	20	30		EGEDHN
C=CCN1CCC(NC(=O)CCc2ccc3ccccc3c2O)CC1	ZINC000294595663	455821262	/nfs/dbraw/zinc/82/12/62/455821262.db2.gz	LTFXWHISJBMNHL-UHFFFAOYSA-N	0	3	338.451	3.245	20	30		EGEDHN
CCn1cc([C@H](C)NC2CCN(Cc3ccc(C#N)cc3)CC2)cn1	ZINC000294854287	455829314	/nfs/dbraw/zinc/82/93/14/455829314.db2.gz	NQDZFSBPVNWQQY-INIZCTEOSA-N	0	3	337.471	3.090	20	30		EGEDHN
COc1ccc(CNCC2([C@H](O)C(C)C)CC2)cc1OCCCC#N	ZINC000272075718	455840210	/nfs/dbraw/zinc/84/02/10/455840210.db2.gz	QHHOJVUKMJKSHF-LJQANCHMSA-N	0	3	346.471	3.264	20	30		EGEDHN
C[C@H](c1ccncc1)N1CCC(/N=C/c2cccc(O)c2O)CC1	ZINC000269592684	455849407	/nfs/dbraw/zinc/84/94/07/455849407.db2.gz	IUFCDUYRGGBYER-CNRHGSOZSA-N	0	3	325.412	3.137	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@@H](C)N(C)CC1(N(C)C)CCC1	ZINC000186961349	455857107	/nfs/dbraw/zinc/85/71/07/455857107.db2.gz	WPJNIDPTPVUGOX-MRXNPFEDSA-N	0	3	349.544	3.067	20	30		EGEDHN
C=CCSCCNC(=O)NC[C@H](c1ccccc1)N1CCCC1	ZINC000194637214	455866691	/nfs/dbraw/zinc/86/66/91/455866691.db2.gz	HFDFOVUJFQDBRM-QGZVFWFLSA-N	0	3	333.501	3.042	20	30		EGEDHN
CN1CCN(CCCOc2cccc(C#N)c2)[C@H](c2ccccc2)C1	ZINC000255956267	455877449	/nfs/dbraw/zinc/87/74/49/455877449.db2.gz	LWNJYMJCLBXFGR-NRFANRHFSA-N	0	3	335.451	3.316	20	30		EGEDHN
C=CCN(CCc1ccco1)C[C@@H](O)COCc1ccccc1F	ZINC000272233350	455885383	/nfs/dbraw/zinc/88/53/83/455885383.db2.gz	FGBDQVGNICODIN-QGZVFWFLSA-N	0	3	333.403	3.027	20	30		EGEDHN
C=CCN(CCc1ccco1)C[C@H](O)COCc1ccccc1F	ZINC000272233345	455885851	/nfs/dbraw/zinc/88/58/51/455885851.db2.gz	FGBDQVGNICODIN-KRWDZBQOSA-N	0	3	333.403	3.027	20	30		EGEDHN
CN(CC1(c2ccccc2)CC1)C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000280130278	455899010	/nfs/dbraw/zinc/89/90/10/455899010.db2.gz	VCTVLXHDITZVKP-IBGZPJMESA-N	0	3	343.430	3.431	20	30		EGEDHN
C=C(C)COc1cccc(NC(=O)N2CC[C@@H]3CCN(C)C[C@@H]32)c1	ZINC000272368062	455928044	/nfs/dbraw/zinc/92/80/44/455928044.db2.gz	GGCREYKBMTVZIV-YJBOKZPZSA-N	0	3	329.444	3.199	20	30		EGEDHN
CN(C(=O)c1ccc(CC#N)cc1)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000270352787	455935375	/nfs/dbraw/zinc/93/53/75/455935375.db2.gz	IGGKWBJZHPFVGX-OAQYLSRUSA-N	0	3	347.462	3.489	20	30		EGEDHN
Cc1cc(NC(=O)C2CCN([C@H](C)c3cccc(C#N)c3)CC2)no1	ZINC000187662587	455935695	/nfs/dbraw/zinc/93/56/95/455935695.db2.gz	UXCMHECRWXATEW-CQSZACIVSA-N	0	3	338.411	3.266	20	30		EGEDHN
C=CCn1c(SC[C@@H]2CCN(C)C2)nnc1-c1cccc(C)c1	ZINC000187666759	455936069	/nfs/dbraw/zinc/93/60/69/455936069.db2.gz	IFRABLMGGKHIHW-OAHLLOKOSA-N	0	3	328.485	3.483	20	30		EGEDHN
CCO[C@H]1C[C@H](NCC#Cc2ccc(Cl)cc2)C12CCOCC2	ZINC000286129491	455985194	/nfs/dbraw/zinc/98/51/94/455985194.db2.gz	MORLCRFRXSZKMU-ROUUACIJSA-N	0	3	333.859	3.255	20	30		EGEDHN
COC(=O)[C@H]1CCN(Cc2cccc(OCCCC#N)c2)C[C@@H]1C	ZINC000188115745	456001127	/nfs/dbraw/zinc/00/11/27/456001127.db2.gz	BSEDVFSKDMNKTD-YJBOKZPZSA-N	0	3	330.428	3.000	20	30		EGEDHN
C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000280597811	456008608	/nfs/dbraw/zinc/00/86/08/456008608.db2.gz	NTASYZUNGNTACC-CVEARBPZSA-N	0	3	327.472	3.338	20	30		EGEDHN
Cc1nsc(N2CC[C@]3(CCN(Cc4ccccc4)C3)C2)c1C#N	ZINC000286294875	456018042	/nfs/dbraw/zinc/01/80/42/456018042.db2.gz	JASXKGVOCOTJSO-IBGZPJMESA-N	0	3	338.480	3.426	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1CNCc1cc([N+](=O)[O-])ccc1OC(F)F	ZINC000280697955	456034318	/nfs/dbraw/zinc/03/43/18/456034318.db2.gz	SDFULNWJHUTAHO-NHYWBVRUSA-N	0	3	342.342	3.267	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)NC[C@H]1CCCN(Cc2cccs2)C1	ZINC000280800370	456054953	/nfs/dbraw/zinc/05/49/53/456054953.db2.gz	RTQLXHZBXDZASR-CQSZACIVSA-N	0	3	343.452	3.163	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)N1c2ccc(C)cc2[C@@H]2CN(C)CC[C@@H]21	ZINC000280821327	456059523	/nfs/dbraw/zinc/05/95/23/456059523.db2.gz	DXNYIEKPUQWIBQ-HKUYNNGSSA-N	0	3	335.407	3.216	20	30		EGEDHN
C#CCCCCNC(=O)N1CC[C@@]2(CCN(Cc3ccccc3)C2)C1	ZINC000287181919	456063569	/nfs/dbraw/zinc/06/35/69/456063569.db2.gz	TYBWMRONFXMCKE-OAQYLSRUSA-N	0	3	339.483	3.098	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N[C@@H]2CCCC2(C)C)cc1	ZINC000287382971	456068598	/nfs/dbraw/zinc/06/85/98/456068598.db2.gz	RRZRLMCTDNENFR-IUODEOHRSA-N	0	3	349.456	3.073	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2Cc3ccccc3OC[C@@H]2C)CC1	ZINC000272874270	456097736	/nfs/dbraw/zinc/09/77/36/456097736.db2.gz	BEPIYSQWPHDPEF-INIZCTEOSA-N	0	3	343.471	3.020	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CC[C@]2(CCN(Cc3ccccc3)C2)C1	ZINC000288617557	456100627	/nfs/dbraw/zinc/10/06/27/456100627.db2.gz	ZXVHNHVQKAXSCD-NQIIRXRSSA-N	0	3	342.483	3.092	20	30		EGEDHN
C[C@@H](CN(C)[C@H](C)C(=O)NC1(C#N)CCCCC1)c1ccccc1	ZINC000332625374	456100944	/nfs/dbraw/zinc/10/09/44/456100944.db2.gz	USGFCVCMJBTRGO-DLBZAZTESA-N	0	3	327.472	3.453	20	30		EGEDHN
C=CCc1cc(CNCC[C@@H](O)c2ccccc2)cc(OC)c1O	ZINC000289443262	456126262	/nfs/dbraw/zinc/12/62/62/456126262.db2.gz	MDUOZDCDSWCDJB-GOSISDBHSA-N	0	3	327.424	3.343	20	30		EGEDHN
COc1cc(CN(CCN(C)C)Cc2ccc(C#N)cc2)ccc1C#N	ZINC000289702240	456138516	/nfs/dbraw/zinc/13/85/16/456138516.db2.gz	GFKGVZHXVKWOED-UHFFFAOYSA-N	0	3	348.450	3.002	20	30		EGEDHN
CCC1(O)CCN(Cc2cn(CCC#N)nc2-c2ccccc2)CC1	ZINC000271196754	456166834	/nfs/dbraw/zinc/16/68/34/456166834.db2.gz	OBMXMHXHJFTFKZ-UHFFFAOYSA-N	0	3	338.455	3.201	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CCC([C@@H]2CCCO2)CC1	ZINC000189151605	456241399	/nfs/dbraw/zinc/24/13/99/456241399.db2.gz	KLWJYEMMQINQQK-PMACEKPBSA-N	0	3	345.483	3.046	20	30		EGEDHN
COc1ccc(CNCc2cccc(CO)c2)cc1OCCCC#N	ZINC000237240249	456252516	/nfs/dbraw/zinc/25/25/16/456252516.db2.gz	NORUCJHSBKKSEY-UHFFFAOYSA-N	0	3	340.423	3.160	20	30		EGEDHN
CN(CC(=O)N[C@](C)(C#N)C1CC1)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000297622489	456265753	/nfs/dbraw/zinc/26/57/53/456265753.db2.gz	VYVNVHRNVKICKG-NLWGTHIKSA-N	0	3	325.456	3.063	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ncoc2-c2ccc(F)cc2)CC1	ZINC000274830717	456266286	/nfs/dbraw/zinc/26/62/86/456266286.db2.gz	QVRFLWQSIPCIFR-UHFFFAOYSA-N	0	3	343.402	3.251	20	30		EGEDHN
CO[C@H]1CCCC[C@H]1NCC(=O)N(CCC#N)c1cc(C)cc(C)c1	ZINC000275241115	456271828	/nfs/dbraw/zinc/27/18/28/456271828.db2.gz	OMBKFTGHDQJSNH-MOPGFXCFSA-N	0	3	343.471	3.097	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN(C(C)C)C(C)C)cc1	ZINC000352770481	456292225	/nfs/dbraw/zinc/29/22/25/456292225.db2.gz	SJUTUGKKOXJUJS-UHFFFAOYSA-N	0	3	331.460	3.451	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1SCC(F)(F)F	ZINC000337436593	456353233	/nfs/dbraw/zinc/35/32/33/456353233.db2.gz	IINWPOKOXPKKLA-UHFFFAOYSA-N	0	3	334.411	3.147	20	30		EGEDHN
CCc1ccc(N2CCN(CCCC3(C#N)CCOCC3)CC2)cc1	ZINC000281897426	456353441	/nfs/dbraw/zinc/35/34/41/456353441.db2.gz	FJDAJJNTTNIXSV-UHFFFAOYSA-N	0	3	341.499	3.472	20	30		EGEDHN
COCCN(CCCC1(C#N)CCOCC1)Cc1ccc(C#N)cc1	ZINC000281956034	456371504	/nfs/dbraw/zinc/37/15/04/456371504.db2.gz	JYNMFPDNLRCDEY-UHFFFAOYSA-N	0	3	341.455	3.107	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CCN1CCCC1(C#N)CCOCC1	ZINC000282088729	456409973	/nfs/dbraw/zinc/40/99/73/456409973.db2.gz	VDLVMCVUAGJLDD-LJQANCHMSA-N	0	3	341.499	3.293	20	30		EGEDHN
COc1cccc(CCCN2CCN(c3ccccc3C#N)CC2)c1	ZINC000303834958	456489590	/nfs/dbraw/zinc/48/95/90/456489590.db2.gz	ALTZIDTYGKHSNB-UHFFFAOYSA-N	0	3	335.451	3.322	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)NCCN1CCC2(CCCCC2)CC1	ZINC000337758269	456527112	/nfs/dbraw/zinc/52/71/12/456527112.db2.gz	YGTOONRJDIMIMU-UHFFFAOYSA-N	0	3	329.444	3.236	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)C[C@H](O)COCc1cccs1	ZINC000298777356	456537906	/nfs/dbraw/zinc/53/79/06/456537906.db2.gz	JPFZFQSNHMKJDO-KRWDZBQOSA-N	0	3	347.480	3.322	20	30		EGEDHN
CCCCOC1CCN(C(=O)C(C#N)Cc2ccc(C#N)cc2)CC1	ZINC000348282330	456594540	/nfs/dbraw/zinc/59/45/40/456594540.db2.gz	VXYGVWFOOAFRNG-GOSISDBHSA-N	0	3	339.439	3.048	20	30		EGEDHN
Cc1cc(CN[C@H]2CCCN(C(=O)Cc3ccccc3)C2)ccc1C#N	ZINC000337947707	456618205	/nfs/dbraw/zinc/61/82/05/456618205.db2.gz	ZMXSHYGJZRHHIM-NRFANRHFSA-N	0	3	347.462	3.190	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3sccc32)cc1	ZINC000321185274	456636395	/nfs/dbraw/zinc/63/63/95/456636395.db2.gz	DANBVAUWHWIUCN-WMLDXEAASA-N	0	3	328.437	3.027	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1ccc2c(c1)ncn2C)C(C)C	ZINC000338059959	456657679	/nfs/dbraw/zinc/65/76/79/456657679.db2.gz	HICIWNSTYCRWDB-LJQANCHMSA-N	0	3	340.471	3.002	20	30		EGEDHN
CN(C)C[C@H](NC(=O)Cc1ccc(C#N)cc1)c1ccc(Cl)cc1	ZINC000282971641	456678792	/nfs/dbraw/zinc/67/87/92/456678792.db2.gz	OWZDGMAANBFFEL-SFHVURJKSA-N	0	3	341.842	3.173	20	30		EGEDHN
Cc1ccnc(N(CCN(C)C)Cc2ccc(F)c(F)c2)c1C#N	ZINC000343523383	456681801	/nfs/dbraw/zinc/68/18/01/456681801.db2.gz	FYSSSARTPCVBJR-UHFFFAOYSA-N	0	3	330.382	3.108	20	30		EGEDHN
CC(C)(Cc1nc2ccccc2[nH]1)C(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000328671438	456733422	/nfs/dbraw/zinc/73/34/22/456733422.db2.gz	NIZPZTNXUCGNMD-CYBMUJFWSA-N	0	3	326.444	3.325	20	30		EGEDHN
Cc1n[nH]c(C)c1[C@H]1CCCN1CCC(=O)Nc1ccccc1C#N	ZINC000299582550	456735113	/nfs/dbraw/zinc/73/51/13/456735113.db2.gz	HUCZBRPWTATQDW-QGZVFWFLSA-N	0	3	337.427	3.064	20	30		EGEDHN
CCc1ccccc1NC(=O)[C@H](C)N1CCC[C@@H]1[C@H]1COCC[C@@H]1O	ZINC000328691008	456738235	/nfs/dbraw/zinc/73/82/35/456738235.db2.gz	BVQMEYQVXJSPIL-WLWJZTKJSA-N	0	3	346.471	3.087	20	30		EGEDHN
CC[C@H]1CCCCN1CCNC(=O)NC1(c2cccc(C#N)c2)CC1	ZINC000353547968	456749962	/nfs/dbraw/zinc/74/99/62/456749962.db2.gz	YZXCQPBFBPVIAX-SFHVURJKSA-N	0	3	340.471	3.111	20	30		EGEDHN
CN(Cc1ccccc1)CC(C)(C)NC(=O)c1ccc(C#N)s1	ZINC000338295154	456752987	/nfs/dbraw/zinc/75/29/87/456752987.db2.gz	DUXPXJYTAHFOGT-UHFFFAOYSA-N	0	3	327.453	3.260	20	30		EGEDHN
Cc1cccc(C)c1NC(=O)[C@H](C)N1CCC[C@@H]1[C@@H]1COCC[C@H]1O	ZINC000328765571	456756367	/nfs/dbraw/zinc/75/63/67/456756367.db2.gz	FBJJBXVQUKRWAM-WNRNVDISSA-N	0	3	346.471	3.142	20	30		EGEDHN
Cc1nc(-c2cccc(C)c2)[nH]c1C(=O)N[C@@H]1CN(C2CC2)C[C@H]1C	ZINC000328798003	456763317	/nfs/dbraw/zinc/76/33/17/456763317.db2.gz	FQTOGHWIQAFGNK-CXAGYDPISA-N	0	3	338.455	3.481	20	30		EGEDHN
Cc1cccc(C)c1NC(=O)CN1CCC[C@@H]1[C@H]1COCC[C@]1(C)O	ZINC000328968286	456802749	/nfs/dbraw/zinc/80/27/49/456802749.db2.gz	NTAWRRWGSXOMMK-HLIPFELVSA-N	0	3	346.471	3.143	20	30		EGEDHN
CC(C)N(Cc1nnc(-c2ccccc2Cl)o1)C(=O)C(C)C#N	ZINC000348700241	456819576	/nfs/dbraw/zinc/81/95/76/456819576.db2.gz	HWWJQGHITXESEJ-LLVKDONJSA-N	0	3	332.791	3.287	20	30		EGEDHN
C=CCSCCNC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1	ZINC000338581054	456842078	/nfs/dbraw/zinc/84/20/78/456842078.db2.gz	PCIHKNPEMDJWPO-OAHLLOKOSA-N	0	3	341.908	3.161	20	30		EGEDHN
CCN(Cc1ccc(C(=O)N[C@](C)(C#N)CCSC)cc1)C1CC1	ZINC000344670744	456846070	/nfs/dbraw/zinc/84/60/70/456846070.db2.gz	MKPYIDGRYGDHGA-IBGZPJMESA-N	0	3	345.512	3.436	20	30		EGEDHN
COc1ccc(C)cc1NC(=O)[C@@H]1CCCN1C[C@@H]1CCCOC1	ZINC000329174116	456849370	/nfs/dbraw/zinc/84/93/70/456849370.db2.gz	AWRZSHXSIIINPZ-RDJZCZTQSA-N	0	3	332.444	3.483	20	30		EGEDHN
CC(C)n1nccc1[C@H]1OCC[C@@H]1NC(=O)CN1[C@H](C)CC[C@H]1C	ZINC000329205945	456853434	/nfs/dbraw/zinc/85/34/34/456853434.db2.gz	XGVRCIOWMUYQSD-BSXFFOKHSA-N	0	3	334.464	3.123	20	30		EGEDHN
C[C@@H](NC(=O)[C@@H]1CC(=O)N(C2CCC(C)CC2)C1)C1=CCN(C)CC1	ZINC000329263991	456863107	/nfs/dbraw/zinc/86/31/07/456863107.db2.gz	BOTVDUWLVDSTQY-CQDXFGNVSA-N	0	3	347.503	3.021	20	30		EGEDHN
Cc1c(C(=O)C(C#N)c2nnc3n2CCCCC3)ccn1C(C)C	ZINC000344922709	456870785	/nfs/dbraw/zinc/87/07/85/456870785.db2.gz	SOJNMMCQXUSDPO-HNNXBMFYSA-N	0	3	325.416	3.185	20	30		EGEDHN
CC(C#N)C(=O)NCc1nc2c(s1)C[C@H](c1ccccc1)CC2	ZINC000344986105	456887768	/nfs/dbraw/zinc/88/77/68/456887768.db2.gz	LFTMPEMOXAXEQT-TZMCWYRMSA-N	0	3	325.437	3.191	20	30		EGEDHN
CC[C@@H]1C[C@H](C(=O)N[C@@H]2CN(C)C[C@H]2c2ccccc2)CC(=O)N1	ZINC000329469320	456894672	/nfs/dbraw/zinc/89/46/72/456894672.db2.gz	XKJZQAIAAKVUKL-VVLHAWIVSA-N	0	3	329.444	3.186	20	30		EGEDHN
Cc1cc(N2CCC([C@H](O)C(=O)NC3CC3)CC2)c2ccccc2n1	ZINC000329707451	456929628	/nfs/dbraw/zinc/92/96/28/456929628.db2.gz	KNDOSAAHUCCLFP-IBGZPJMESA-N	0	3	339.439	3.239	20	30		EGEDHN
C=CCOCCN1CCC(Oc2cccc(Br)c2)CC1	ZINC000339088451	456935586	/nfs/dbraw/zinc/93/55/86/456935586.db2.gz	PGVQBMSZECISRW-UHFFFAOYSA-N	0	3	340.261	3.495	20	30		EGEDHN
C[C@@H]1Oc2c(cccc2C(=O)NCCN2CCCC(C)(C)C2)NC1=O	ZINC000329890695	456956829	/nfs/dbraw/zinc/95/68/29/456956829.db2.gz	GRBUGNHEPNJACP-ZDUSSCGKSA-N	0	3	345.443	3.482	20	30		EGEDHN
CC1(C)CCCN(CCNC(=O)CCc2cccc3c2OCO3)C1	ZINC000329926173	456962239	/nfs/dbraw/zinc/96/22/39/456962239.db2.gz	WAQGLUVGWAZPSR-UHFFFAOYSA-N	0	3	332.444	3.426	20	30		EGEDHN
CC(=O)N[C@H](C)C1CCN(Cc2cccc3c2OCCCO3)CC1	ZINC000330084440	456983020	/nfs/dbraw/zinc/98/30/20/456983020.db2.gz	CDWOKKNROMNELP-CQSZACIVSA-N	0	3	332.444	3.425	20	30		EGEDHN
C[C@H](CN1CCCCC1)NC(=O)NC[C@H]1CCO[C@@H]1c1ccccc1	ZINC000330148383	456991575	/nfs/dbraw/zinc/99/15/75/456991575.db2.gz	MEHBOJFVBXSJNH-BHIYHBOVSA-N	0	3	345.487	3.142	20	30		EGEDHN
C[C@@H](C(=O)NC1(C#N)CCC1)N(C)CC12CC3CC(CC(C3)C1)C2	ZINC000345773977	456992737	/nfs/dbraw/zinc/99/27/37/456992737.db2.gz	PTDGUKFQSZSGSV-ISOUWHGUSA-N	0	3	329.488	3.086	20	30		EGEDHN
N#Cc1ccc(CN2CCN(Cc3cccc4[nH]ccc43)CC2)cc1	ZINC000349616019	456996650	/nfs/dbraw/zinc/99/66/50/456996650.db2.gz	UTRQSJXAPSZTQH-UHFFFAOYSA-N	0	3	330.435	3.357	20	30		EGEDHN
CCn1nccc1[C@@H]1OCC[C@H]1CNC(=O)[C@@H](C)N1CCCCCC1	ZINC000330180837	456996773	/nfs/dbraw/zinc/99/67/73/456996773.db2.gz	NOOZUSBXCNWIHB-SOLBZPMBSA-N	0	3	348.491	3.202	20	30		EGEDHN
CO[C@H](C)c1nc(C)c(C(=O)N[C@H]2CCN(C3CCCC3)C2)s1	ZINC000330191502	457000425	/nfs/dbraw/zinc/00/04/25/457000425.db2.gz	XBLZTCXAGUTZQD-OLZOCXBDSA-N	0	3	337.489	3.480	20	30		EGEDHN
C=CCC[C@@H](NCC(=O)NCc1cccc(C#N)c1)c1ccccc1	ZINC000341925015	457004451	/nfs/dbraw/zinc/00/44/51/457004451.db2.gz	IDOINPRZCGJYNY-HXUWFJFHSA-N	0	3	333.435	3.472	20	30		EGEDHN
O=C(NC1CCN(C(=O)[C@@H]2CCCN2C2CC2)CC1)C1CCCCC1	ZINC000330255192	457012799	/nfs/dbraw/zinc/01/27/99/457012799.db2.gz	JUYDFKDTXGYRPM-SFHVURJKSA-N	0	3	347.503	3.141	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CC2(CCC2)[C@@H]1[C@@H]1CCCO1	ZINC000330293479	457023481	/nfs/dbraw/zinc/02/34/81/457023481.db2.gz	DSKKZWNOEAKBLB-FHWLQOOXSA-N	0	3	338.451	3.319	20	30		EGEDHN
C[NH+]1CCC(C)(CNC(=O)c2cc([O-])ccc2C(F)(F)F)CC1	ZINC000330445240	457044983	/nfs/dbraw/zinc/04/49/83/457044983.db2.gz	XCOHJTLWXXXRLU-UHFFFAOYSA-N	0	3	330.350	3.448	20	30		EGEDHN
COCC1(C#N)CCN(Cc2ccc(-n3nc(C)cc3C)cc2)CC1	ZINC000341997188	457051614	/nfs/dbraw/zinc/05/16/14/457051614.db2.gz	WAHXJLVSACRNOR-UHFFFAOYSA-N	0	3	338.455	3.241	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N(CCN(C)C)Cc1cccc(F)c1)OCC	ZINC000339400710	457095071	/nfs/dbraw/zinc/09/50/71/457095071.db2.gz	GSLFOZOXDDYHPS-GOSISDBHSA-N	0	3	336.451	3.087	20	30		EGEDHN
COc1cccc(C(=O)N[C@@H]2CCN(C)[C@@H](C)C2)c1OC(F)F	ZINC000330894480	457101205	/nfs/dbraw/zinc/10/12/05/457101205.db2.gz	FJJSQFIWVVMDSD-WDEREUQCSA-N	0	3	328.359	3.084	20	30		EGEDHN
C=CCC[C@@H](O)CN[C@H](c1cncc(Br)c1)C1CC1	ZINC000342093303	457104781	/nfs/dbraw/zinc/10/47/81/457104781.db2.gz	QUPMCXHWBXGAND-CABCVRRESA-N	0	3	325.250	3.212	20	30		EGEDHN
Cn1cc(CN[C@@H]2CCc3cc(Br)ccc32)cc1C#N	ZINC000359736194	457125965	/nfs/dbraw/zinc/12/59/65/457125965.db2.gz	NUTUWCPMSOEQTG-MRXNPFEDSA-N	0	3	330.229	3.436	20	30		EGEDHN
Cc1nn(C)c2ncc(CN[C@@H]3CCCc4cc(C#N)ccc43)cc12	ZINC000346724381	457132715	/nfs/dbraw/zinc/13/27/15/457132715.db2.gz	HAJUUTCCHKYBTL-LJQANCHMSA-N	0	3	331.423	3.316	20	30		EGEDHN
Cc1ccc(Cl)cc1NC(=O)C(C#N)c1ccc([N+](=O)[O-])cn1	ZINC000359919769	457147674	/nfs/dbraw/zinc/14/76/74/457147674.db2.gz	WARRFADTTMRSMU-GFCCVEGCSA-N	0	3	330.731	3.198	20	30		EGEDHN
CC[C@@H]1CN(CC(=O)N(CC)CCC#N)CC[C@@H]1c1ccccc1	ZINC000350040975	457152221	/nfs/dbraw/zinc/15/22/21/457152221.db2.gz	LZBWNXBJHQKDQX-MJGOQNOKSA-N	0	3	327.472	3.264	20	30		EGEDHN
Cc1cc(CN2CCCN(Cc3ccc(C#N)cc3)CC2)ccc1C#N	ZINC000362961301	457176151	/nfs/dbraw/zinc/17/61/51/457176151.db2.gz	VMEGDHRXPYVFHD-UHFFFAOYSA-N	0	3	344.462	3.446	20	30		EGEDHN
N#Cc1ccc(C(=O)NC2CCN(Cc3ccccc3)CC2)s1	ZINC000362979064	457182470	/nfs/dbraw/zinc/18/24/70/457182470.db2.gz	GYAWCMGNENJMDK-UHFFFAOYSA-N	0	3	325.437	3.014	20	30		EGEDHN
CC[C@@H]1CCCCN1CCNC(=O)CSCc1ccc(C#N)cc1	ZINC000354395828	457198252	/nfs/dbraw/zinc/19/82/52/457198252.db2.gz	LGLNNVXDCYONJN-GOSISDBHSA-N	0	3	345.512	3.172	20	30		EGEDHN
CC[C@@](C)(C#N)C(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1	ZINC000354396297	457198841	/nfs/dbraw/zinc/19/88/41/457198841.db2.gz	USCOESSBAKIYDP-IBGZPJMESA-N	0	3	328.460	3.095	20	30		EGEDHN
C[C@@H](O)[C@H]1CCN(Cc2cccc(OCc3ccccc3C#N)c2)C1	ZINC000356919806	457219975	/nfs/dbraw/zinc/21/99/75/457219975.db2.gz	SCHJYYYFAUJDNF-APWZRJJASA-N	0	3	336.435	3.340	20	30		EGEDHN
CC(C#N)C(=O)N1CCc2c(cccc2NC(=O)Nc2ccccc2)C1	ZINC000347118441	457239500	/nfs/dbraw/zinc/23/95/00/457239500.db2.gz	VHURZGLGWAUXOI-CQSZACIVSA-N	0	3	348.406	3.375	20	30		EGEDHN
N#CC(C(=O)c1ccc(NC(=O)c2ccccc2)cc1)c1ccncn1	ZINC000354471995	457244433	/nfs/dbraw/zinc/24/44/33/457244433.db2.gz	TYWLFVVIUFZXTI-QGZVFWFLSA-N	0	3	342.358	3.219	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N[C@@H]2CCC(C)(C)C2)cc1	ZINC000351696586	457314480	/nfs/dbraw/zinc/31/44/80/457314480.db2.gz	WYTINNQUJWLRLJ-TZMCWYRMSA-N	0	3	349.456	3.073	20	30		EGEDHN
C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H]1CCCN(C)[C@H]1C	ZINC000355079954	457339875	/nfs/dbraw/zinc/33/98/75/457339875.db2.gz	JXWWEWPUDDGQFC-FUHWJXTLSA-N	0	3	347.507	3.034	20	30		EGEDHN
C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)[C@@H](CC)N(CC)CC	ZINC000342507917	457341992	/nfs/dbraw/zinc/34/19/92/457341992.db2.gz	ZWRNFNPRFUUJLR-GOSISDBHSA-N	0	3	334.508	3.489	20	30		EGEDHN
C[C@H](CNc1ccc(C#N)c([N+](=O)[O-])c1)N1CCc2ccccc2C1	ZINC000357188068	457365820	/nfs/dbraw/zinc/36/58/20/457365820.db2.gz	JBNBVZOEBRTDFL-CQSZACIVSA-N	0	3	336.395	3.325	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1SCCCSC	ZINC000360863893	457390650	/nfs/dbraw/zinc/39/06/50/457390650.db2.gz	IKNPNEBTGFOSTN-UHFFFAOYSA-N	0	3	340.562	3.338	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1	ZINC000352474334	457395355	/nfs/dbraw/zinc/39/53/55/457395355.db2.gz	GCJISQVURHHKPT-XKGZKEIXSA-N	0	3	330.472	3.167	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C[C@@H](CC#N)c2ccccc2)CC1	ZINC000355654240	457397123	/nfs/dbraw/zinc/39/71/23/457397123.db2.gz	GSZKUURUVUJGQW-GOSISDBHSA-N	0	3	325.456	3.231	20	30		EGEDHN
N#CCc1cccc(C(=O)N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)c1	ZINC000425000447	457399623	/nfs/dbraw/zinc/39/96/23/457399623.db2.gz	BROSCMLOTXPVTB-LEWJYISDSA-N	0	3	345.446	3.099	20	30		EGEDHN
C=CC[C@@H](CO)CNCc1ccc(-c2ccccc2C(=O)OC)o1	ZINC000360907789	457426049	/nfs/dbraw/zinc/42/60/49/457426049.db2.gz	BDSXUUXWIVOIBH-CQSZACIVSA-N	0	3	329.396	3.007	20	30		EGEDHN
C[C@@H](CNc1c(C#N)cnc2ccccc21)N(C)Cc1ccccc1	ZINC000390632093	457440382	/nfs/dbraw/zinc/44/03/82/457440382.db2.gz	BBTGLSFGYLVPRO-INIZCTEOSA-N	0	3	330.435	3.461	20	30		EGEDHN
C[C@H]1CCCN(C(=O)C2CCN(Cc3ccc(CC#N)cc3)CC2)C1	ZINC000342674934	457447251	/nfs/dbraw/zinc/44/72/51/457447251.db2.gz	XIGLZAANYJDZPP-KRWDZBQOSA-N	0	3	339.483	3.223	20	30		EGEDHN
C=CCCN(C)CC(=O)N(C)Cc1ccc2cc(OC)ccc2c1	ZINC000342735167	457488764	/nfs/dbraw/zinc/48/87/64/457488764.db2.gz	OGTUNDBVNRRGHX-UHFFFAOYSA-N	0	3	326.440	3.315	20	30		EGEDHN
CCC(C#N)(CC)C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000398187769	457497105	/nfs/dbraw/zinc/49/71/05/457497105.db2.gz	VTBOYKXFCUCOJF-SJLPKXTDSA-N	0	3	327.472	3.343	20	30		EGEDHN
CN1CCC[C@]2(CCN(C(=O)C[C@@H](CC#N)c3ccccc3)C2)C1	ZINC000356243647	457550467	/nfs/dbraw/zinc/55/04/67/457550467.db2.gz	BZWQLTSJFPFHIN-QUCCMNQESA-N	0	3	325.456	3.018	20	30		EGEDHN
COc1cc2c(c(OC)c1OC)CCN(CC(C)(C)CCC#N)CC2	ZINC000374258737	457550961	/nfs/dbraw/zinc/55/09/61/457550961.db2.gz	WZVPWDJCKBOEJA-UHFFFAOYSA-N	0	3	346.471	3.443	20	30		EGEDHN
C[C@H](CN1CCCCC1)NC(=O)N(C)[C@@H](C)c1cccc(C#N)c1	ZINC000425454635	457561585	/nfs/dbraw/zinc/56/15/85/457561585.db2.gz	BEURQEPVIFWXGN-CVEARBPZSA-N	0	3	328.460	3.135	20	30		EGEDHN
C=CCC1(C(=O)N(C)[C@H]2CCN(Cc3ccccc3)C2)CCOCC1	ZINC000425548283	457594479	/nfs/dbraw/zinc/59/44/79/457594479.db2.gz	YKNPRDPVPZRHPT-IBGZPJMESA-N	0	3	342.483	3.092	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)NCc1cccc(C)c1)C(C)C	ZINC000410253790	457635790	/nfs/dbraw/zinc/63/57/90/457635790.db2.gz	RQMUFPFHWSVQEY-LJQANCHMSA-N	0	3	329.488	3.493	20	30		EGEDHN
CO[C@@H]1CCCN(CC#Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000374666604	457684156	/nfs/dbraw/zinc/68/41/56/457684156.db2.gz	XUBYTCDLBPATAX-OAHLLOKOSA-N	0	3	327.346	3.438	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)N[C@H](C)[C@H](c1ccccc1C)N(C)C	ZINC000357859385	457714350	/nfs/dbraw/zinc/71/43/50/457714350.db2.gz	VMIVHGSSNQCXQF-FZKQIMNGSA-N	0	3	325.412	3.189	20	30		EGEDHN
N#Cc1ccc(OC2CCN(CCCO[C@H]3CCCCO3)CC2)cc1	ZINC000374882024	457726587	/nfs/dbraw/zinc/72/65/87/457726587.db2.gz	VINNRNSUNOZVNB-FQEVSTJZSA-N	0	3	344.455	3.335	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@H]2Cc2ccc(F)cc2)CC1	ZINC000365185299	457729435	/nfs/dbraw/zinc/72/94/35/457729435.db2.gz	ISPRAXHOFBNJST-IBGZPJMESA-N	0	3	345.462	3.193	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)N1C[C@H]2CN(Cc3ccccc3)CC[C@@H]2C1	ZINC000365728737	457772221	/nfs/dbraw/zinc/77/22/21/457772221.db2.gz	WADSPTPFXSYZHM-QZTJIDSGSA-N	0	3	349.434	3.054	20	30		EGEDHN
C[C@@H]1CCCC[C@H]1OCCNC(=O)C(C#N)CCc1ccccc1	ZINC000433225226	457784668	/nfs/dbraw/zinc/78/46/68/457784668.db2.gz	APBADBONXLNULG-NZSAHSFTSA-N	0	3	328.456	3.470	20	30		EGEDHN
CC[C@@H](CNC(=O)NCC(C)(C)CC#N)N1CCc2ccccc2C1	ZINC000457703762	457800361	/nfs/dbraw/zinc/80/03/61/457800361.db2.gz	XLZRHLLEYXOQEX-SFHVURJKSA-N	0	3	342.487	3.062	20	30		EGEDHN
CN(C)[C@@H](CC(=O)N(CCC#N)Cc1cccnc1)c1ccccc1	ZINC000433318982	457810800	/nfs/dbraw/zinc/81/08/00/457810800.db2.gz	PUGARGYXXWCNPR-IBGZPJMESA-N	0	3	336.439	3.017	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN2CC(Cc3ccc(F)c(F)c3)C2)cc1	ZINC000371176951	457817610	/nfs/dbraw/zinc/81/76/10/457817610.db2.gz	MLYPAKRSKOVTQG-LJQANCHMSA-N	0	3	328.362	3.044	20	30		EGEDHN
CCOCCCNC(=O)C1CCN(CCC2(C#N)CCCCC2)CC1	ZINC000411165067	457819260	/nfs/dbraw/zinc/81/92/60/457819260.db2.gz	NXIHSIJLGZPGGA-UHFFFAOYSA-N	0	3	349.519	3.105	20	30		EGEDHN
Cc1ccc2cc(CN3CC[C@@H](Oc4ccc(C#N)cn4)C3)ccc2n1	ZINC000366513815	457835928	/nfs/dbraw/zinc/83/59/28/457835928.db2.gz	BYPGZKRIDCWKQL-LJQANCHMSA-N	0	3	344.418	3.463	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N(C)CC(C)(C)C#N)C1	ZINC000457944064	457877326	/nfs/dbraw/zinc/87/73/26/457877326.db2.gz	YOSNYGZQRVZBLB-WBVHZDCISA-N	0	3	328.460	3.013	20	30		EGEDHN
C[C@@H](NC[C@H](C)S(C)(=O)=O)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000411503213	457904465	/nfs/dbraw/zinc/90/44/65/457904465.db2.gz	KCRJVXCIZRNSNE-LSDHHAIUSA-N	0	3	342.464	3.309	20	30		EGEDHN
C=CCN(C)CCN(CC)[C@@H](C)c1nc(-c2ccc(OC)cc2)no1	ZINC000411641293	457937134	/nfs/dbraw/zinc/93/71/34/457937134.db2.gz	LTEBAGYNFAFNSX-HNNXBMFYSA-N	0	3	344.459	3.246	20	30		EGEDHN
Cc1cc(NC(=O)[C@]2(C#N)CC23CCCC3)ccc1OCCN(C)C	ZINC000458206881	457969270	/nfs/dbraw/zinc/96/92/70/457969270.db2.gz	ILICROPQUHULTP-HXUWFJFHSA-N	0	3	341.455	3.348	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccccc2COC(C)(C)C)CC1	ZINC000358389093	457970913	/nfs/dbraw/zinc/97/09/13/457970913.db2.gz	ALNXFZCBYTVVRL-UHFFFAOYSA-N	0	3	330.472	3.382	20	30		EGEDHN
C[C@@H](C(=O)N(CCN(C)C)Cc1ccsc1)c1cccc(C#N)c1	ZINC000458212730	457972547	/nfs/dbraw/zinc/97/25/47/457972547.db2.gz	BKPNJKVSBIPHLN-OAHLLOKOSA-N	0	3	341.480	3.314	20	30		EGEDHN
N#Cc1cc(C(=O)N2CC[C@@]3(C2)CCCN(Cc2ccccc2)C3)c[nH]1	ZINC000367768200	457979929	/nfs/dbraw/zinc/97/99/29/457979929.db2.gz	MOSKWKHMGJCGEU-NRFANRHFSA-N	0	3	348.450	3.015	20	30		EGEDHN
CC1(C)CCN([C@H]2CCCN(c3ccc(C#N)cc3)C2=O)CCS1	ZINC000434690557	458036892	/nfs/dbraw/zinc/03/68/92/458036892.db2.gz	ICZKQUMDCRKJRH-KRWDZBQOSA-N	0	3	343.496	3.271	20	30		EGEDHN
C#CCC1(C(=O)NCC2CCN(c3ccncc3)CC2)CCCCC1	ZINC000368464344	458039687	/nfs/dbraw/zinc/03/96/87/458039687.db2.gz	DZRIWPNPVMIXSG-UHFFFAOYSA-N	0	3	339.483	3.388	20	30		EGEDHN
N#Cc1ccc(OC2CCN(Cc3ccc(CO)cc3)CC2)c(F)c1	ZINC000375741486	458044634	/nfs/dbraw/zinc/04/46/34/458044634.db2.gz	IXWVVTSUYCVSQZ-UHFFFAOYSA-N	0	3	340.398	3.233	20	30		EGEDHN
C[C@H](C(=O)N(C)CCC#N)N1CC[C@@](C)(CCc2ccccc2)C1	ZINC000434904797	458064357	/nfs/dbraw/zinc/06/43/57/458064357.db2.gz	GWGXTHKXSBFWCZ-YLJYHZDGSA-N	0	3	327.472	3.092	20	30		EGEDHN
CCN(CCC#N)C(=O)CN1CC[C@](C)(CCc2ccccc2)C1	ZINC000434903683	458064759	/nfs/dbraw/zinc/06/47/59/458064759.db2.gz	KIOBPOJSSACTDB-FQEVSTJZSA-N	0	3	327.472	3.093	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)N(C)CC(C)(C)C#N)CCN1Cc1ccccc1	ZINC000458498065	458071252	/nfs/dbraw/zinc/07/12/52/458071252.db2.gz	OHIYPTPCOHJCSW-AEFFLSMTSA-N	0	3	342.487	3.231	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)N(C)CC(C)(C)C#N)CCN1Cc1ccccc1	ZINC000458498067	458071745	/nfs/dbraw/zinc/07/17/45/458071745.db2.gz	OHIYPTPCOHJCSW-SJLPKXTDSA-N	0	3	342.487	3.231	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)NCC(C)(C)CC#N)CCN1Cc1ccccc1	ZINC000458513562	458076744	/nfs/dbraw/zinc/07/67/44/458076744.db2.gz	YTYNIMPBKQKORP-FUHWJXTLSA-N	0	3	342.487	3.279	20	30		EGEDHN
C=CCc1cc(CN2CCC([C@@H]3CCOC3)CC2)cc(OC)c1O	ZINC000371810808	458083312	/nfs/dbraw/zinc/08/33/12/458083312.db2.gz	SOWCUVVYHCXIIN-GOSISDBHSA-N	0	3	331.456	3.378	20	30		EGEDHN
Cc1nn(C)cc1[C@H]1CCCN1Cc1ccc(N(C)CCC#N)cc1	ZINC000375852228	458096915	/nfs/dbraw/zinc/09/69/15/458096915.db2.gz	WKBMAMYFHNXBAX-HXUWFJFHSA-N	0	3	337.471	3.416	20	30		EGEDHN
CN(Cc1nc2ccccc2n1C)C(=O)C(C#N)CCc1ccccc1	ZINC000358737286	458182504	/nfs/dbraw/zinc/18/25/04/458182504.db2.gz	OEXULQXBIRCBJC-QGZVFWFLSA-N	0	3	346.434	3.304	20	30		EGEDHN
C=CCN1CCC(NC(=O)CCc2c[nH]c3cc(C)ccc23)CC1	ZINC000362597749	458291004	/nfs/dbraw/zinc/29/10/04/458291004.db2.gz	BDXDOOJHOZBQAE-UHFFFAOYSA-N	0	3	325.456	3.176	20	30		EGEDHN
COCC1(C#N)CCN(c2ccnc3cc(OC)c(OC)cc32)CC1	ZINC000413289307	458297100	/nfs/dbraw/zinc/29/71/00/458297100.db2.gz	JKKJCOWWHCDKDB-UHFFFAOYSA-N	0	3	341.411	3.009	20	30		EGEDHN
C[C@H]1CCN(C(=O)NCC(C)(C)CC#N)CCN1Cc1ccccc1	ZINC000459262110	458306707	/nfs/dbraw/zinc/30/67/07/458306707.db2.gz	UCIYGTLUTFHTGN-KRWDZBQOSA-N	0	3	342.487	3.232	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1C[C@@H](O)C[C@H]1c1ccccc1	ZINC000413928558	458311680	/nfs/dbraw/zinc/31/16/80/458311680.db2.gz	ALVYPTPSIKOVBE-UFYCRDLUSA-N	0	3	334.419	3.093	20	30		EGEDHN
C[C@@H]1C[C@H](O)CN(Cc2cccc(OCc3cccc(C#N)c3)c2)C1	ZINC000414523009	458321972	/nfs/dbraw/zinc/32/19/72/458321972.db2.gz	HPOUZOMOFBGOTK-UZLBHIALSA-N	0	3	336.435	3.340	20	30		EGEDHN
COc1cc(CN2C[C@H](C)NCc3ccc(F)cc32)ccc1C#N	ZINC000414874299	458325311	/nfs/dbraw/zinc/32/53/11/458325311.db2.gz	SGBIALXPJFFGBJ-ZDUSSCGKSA-N	0	3	325.387	3.204	20	30		EGEDHN
C=CCc1cc(CN2CCNC[C@H]2c2ccccc2)cc(OC)c1O	ZINC000415132401	458327257	/nfs/dbraw/zinc/32/72/57/458327257.db2.gz	UDDFINIPDBSZTO-IBGZPJMESA-N	0	3	338.451	3.276	20	30		EGEDHN
N#C[C@H](NC(=O)C12CCCN1CCC2)c1ccc(Cl)c(Cl)c1	ZINC000415378353	458332012	/nfs/dbraw/zinc/33/20/12/458332012.db2.gz	NEEQILAFCPSHTE-AWEZNQCLSA-N	0	3	338.238	3.303	20	30		EGEDHN
C=CCN(C)CCN(CC)[C@H](C)C(=O)Nc1cccc(Cl)c1C	ZINC000429717959	458363536	/nfs/dbraw/zinc/36/35/36/458363536.db2.gz	DHVXEIFZNOAXRY-OAHLLOKOSA-N	0	3	337.895	3.415	20	30		EGEDHN
N#CCCCCNCc1ccc(F)cc1I	ZINC000417915664	458368186	/nfs/dbraw/zinc/36/81/86/458368186.db2.gz	UQQCJAHJMUZYAU-UHFFFAOYSA-N	0	3	332.160	3.214	20	30		EGEDHN
CN1CCCC(C)(C)[C@H]1CNC(=O)N[C@H](CCC#N)c1ccccc1	ZINC000447962236	458371286	/nfs/dbraw/zinc/37/12/86/458371286.db2.gz	KEBSDYOZVMDAKR-QZTJIDSGSA-N	0	3	342.487	3.451	20	30		EGEDHN
CCN1CCC(NC(=O)c2sc3ccc(C#N)cc3c2C)CC1	ZINC000429855394	458377740	/nfs/dbraw/zinc/37/77/40/458377740.db2.gz	BYNSEYDFWSESOK-UHFFFAOYSA-N	0	3	327.453	3.296	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)c2ncc(C(C)(C)C)s2)cn1	ZINC000419827153	458392250	/nfs/dbraw/zinc/39/22/50/458392250.db2.gz	BCLXBQFDRWDXBN-NSHDSACASA-N	0	3	330.413	3.090	20	30		EGEDHN
C=CCc1cc(CN2CC[C@H](C(=O)OC)[C@@H]2C(C)C)cc(OC)c1O	ZINC000430110362	458403051	/nfs/dbraw/zinc/40/30/51/458403051.db2.gz	IAIFFAAKMIXDNW-WMZOPIPTSA-N	0	3	347.455	3.149	20	30		EGEDHN
COc1ccc(CN2CC[C@@H](O)CC23CCC3)cc1OCCCC#N	ZINC000421377807	458412612	/nfs/dbraw/zinc/41/26/12/458412612.db2.gz	UJMMHJPZIKGSNH-QGZVFWFLSA-N	0	3	344.455	3.257	20	30		EGEDHN
COc1ccc(CN[C@H]2CCO[C@H]2C2CC2)cc1OCCCC#N	ZINC000373179392	458420232	/nfs/dbraw/zinc/42/02/32/458420232.db2.gz	ZCQNULAVSXRNIB-LPHOPBHVSA-N	0	3	330.428	3.035	20	30		EGEDHN
CC(C)(C)[C@H]([NH2+]C1CCC(C)(C#N)CC1)c1nc(-c2nc[n-]n2)no1	ZINC000449198278	458420863	/nfs/dbraw/zinc/42/08/63/458420863.db2.gz	AYZLWDVEDCKJOP-VMBJYNEYSA-N	0	3	343.435	3.004	20	30		EGEDHN
CCNC(=O)C(C)(C)NCCC(C#N)(c1ccccc1)c1ccccc1	ZINC000459586151	458421091	/nfs/dbraw/zinc/42/10/91/458421091.db2.gz	KORVBDJUZTVCQL-UHFFFAOYSA-N	0	3	349.478	3.391	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)s1)c1cccc(OCCN(C)C)c1	ZINC000421872530	458423087	/nfs/dbraw/zinc/42/30/87/458423087.db2.gz	GVJZYJRYWZWMTP-CQSZACIVSA-N	0	3	329.469	3.411	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)C2CC(OC(C)(C)C)C2)CC1	ZINC000422166816	458425907	/nfs/dbraw/zinc/42/59/07/458425907.db2.gz	QPEBWLCJGJJGBT-UHFFFAOYSA-N	0	3	337.508	3.014	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCc1cc2c(c(Br)c1)OCO2	ZINC000449546220	458426303	/nfs/dbraw/zinc/42/63/03/458426303.db2.gz	AZQCQULMBRTSDY-OLZOCXBDSA-N	0	3	340.217	3.001	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CCN(c2nc3ccccn3c2C#N)C1	ZINC000450811624	458457374	/nfs/dbraw/zinc/45/73/74/458457374.db2.gz	OEXVLNAXGYMGKE-KRWDZBQOSA-N	0	3	345.450	3.164	20	30		EGEDHN
N#Cc1cccc(OCCCN2CCC[C@@](O)(C(F)(F)F)CC2)c1	ZINC000377085704	458457731	/nfs/dbraw/zinc/45/77/31/458457731.db2.gz	CHROWHKYBDNIPE-INIZCTEOSA-N	0	3	342.361	3.106	20	30		EGEDHN
CCCCO[C@H]1C[C@H](NCC(=O)Nc2oc(C)c(C)c2C#N)C1(C)C	ZINC000450976673	458460954	/nfs/dbraw/zinc/46/09/54/458460954.db2.gz	ZVVAKFXZSZVAFS-HOTGVXAUSA-N	0	3	347.459	3.280	20	30		EGEDHN
CC[C@@H]1OCC[C@H]1NCC(=O)Nc1ccccc1S[C@H](C)CC#N	ZINC000459771935	458474228	/nfs/dbraw/zinc/47/42/28/458474228.db2.gz	JBNVGLMCAMXJST-FMKPAKJESA-N	0	3	347.484	3.176	20	30		EGEDHN
N#Cc1ccc(CN[C@H]([C@@H](CO)C2CC2)C2CC2)c(Br)c1	ZINC000451611659	458483187	/nfs/dbraw/zinc/48/31/87/458483187.db2.gz	LQERDHGXPGZBDD-RDJZCZTQSA-N	0	3	349.272	3.207	20	30		EGEDHN
CC[C@H](C)N[C@@H](CNC(=O)[C@@]1(C#N)CC12CCCC2)c1ccco1	ZINC000451670461	458484667	/nfs/dbraw/zinc/48/46/67/458484667.db2.gz	CTPMOKHWPAUOFU-DOXZYTNZSA-N	0	3	329.444	3.299	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1C[C@@H](C)C[C@H]1c1cccnc1	ZINC000373411848	458485359	/nfs/dbraw/zinc/48/53/59/458485359.db2.gz	HPRZGUQWMJWZQC-YJBOKZPZSA-N	0	3	337.423	3.424	20	30		EGEDHN
C=CCN1CC[C@H](N2CCC(Cc3cc(F)ccc3F)CC2)C1=O	ZINC000451970006	458491330	/nfs/dbraw/zinc/49/13/30/458491330.db2.gz	XEEFNONGIORTTK-SFHVURJKSA-N	0	3	334.410	3.006	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NCC(C)(C)N[C@@H](C)c1ccccc1	ZINC000437834544	458499244	/nfs/dbraw/zinc/49/92/44/458499244.db2.gz	FJRQYEGXYAPIBU-OXJNMPFZSA-N	0	3	332.488	3.461	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)NC[C@H]1N(C)CCCC1(C)C	ZINC000468487785	458521277	/nfs/dbraw/zinc/52/12/77/458521277.db2.gz	MTJSBHYFOZHPRN-GOSISDBHSA-N	0	3	346.471	3.110	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1N[C@@H](C)c1ccc(OC)c(Br)c1	ZINC000453348348	458524230	/nfs/dbraw/zinc/52/42/30/458524230.db2.gz	HNEZSTMCIPFVQY-GDLCADMTSA-N	0	3	326.234	3.452	20	30		EGEDHN
CC(=O)NCCc1ccc([C@@H](C)NCc2ccc(C#N)c(F)c2)cc1	ZINC000453362426	458524772	/nfs/dbraw/zinc/52/47/72/458524772.db2.gz	BAOBQQVUTYRZOQ-CQSZACIVSA-N	0	3	339.414	3.227	20	30		EGEDHN
C=C(C)Cn1c(-c2ccc(C)o2)nnc1N1CCCN(C(C)C)CC1	ZINC000453449111	458531081	/nfs/dbraw/zinc/53/10/81/458531081.db2.gz	DWLJNDSCVAVPCF-UHFFFAOYSA-N	0	3	343.475	3.343	20	30		EGEDHN
CN(C)CCN(Cc1cccc(Cl)c1)C(=O)NCC1(CC#N)CC1	ZINC000431205628	458542969	/nfs/dbraw/zinc/54/29/69/458542969.db2.gz	YXJBFQQLYMFEHO-UHFFFAOYSA-N	0	3	348.878	3.107	20	30		EGEDHN
Cc1ccc(-c2csc(NC(=O)[C@@H](N)CCCC#N)n2)cc1C	ZINC000424076517	458551952	/nfs/dbraw/zinc/55/19/52/458551952.db2.gz	MFNOTOGTVKKNOH-AWEZNQCLSA-N	0	3	328.441	3.387	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N1Cc2ccccc2[C@H](c2ccccc2)C1	ZINC000424085343	458554765	/nfs/dbraw/zinc/55/47/65/458554765.db2.gz	PLDXHDBHOGXQHA-PMACEKPBSA-N	0	3	333.435	3.182	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N(Cc1ccc(F)cc1F)C1CCCC1	ZINC000424100641	458557793	/nfs/dbraw/zinc/55/77/93/458557793.db2.gz	XJISLYRXSABQGX-QGZVFWFLSA-N	0	3	335.398	3.257	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N(Cc1ccc(F)cc1F)C1CCCC1	ZINC000424100637	458558217	/nfs/dbraw/zinc/55/82/17/458558217.db2.gz	XJISLYRXSABQGX-KRWDZBQOSA-N	0	3	335.398	3.257	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)NCC1(c2cccc(Cl)c2)CCCC1	ZINC000424107412	458559870	/nfs/dbraw/zinc/55/98/70/458559870.db2.gz	UOQBPGCZTOUEFT-MRXNPFEDSA-N	0	3	333.863	3.289	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1ccc(OCc2ccccc2F)cc1	ZINC000424111123	458560642	/nfs/dbraw/zinc/56/06/42/458560642.db2.gz	FRERCLMRKYAHBD-GOSISDBHSA-N	0	3	341.386	3.364	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCc2cc(C3CC3)ccc2F)CC1	ZINC000454548224	458566121	/nfs/dbraw/zinc/56/61/21/458566121.db2.gz	POMQGTJMYCMGHQ-UHFFFAOYSA-N	0	3	331.435	3.153	20	30		EGEDHN
CC(C)[C@@H](NC(=O)[C@@H](N)CCCC#N)c1ccc(Cl)cc1F	ZINC000424169779	458576087	/nfs/dbraw/zinc/57/60/87/458576087.db2.gz	KFAHMRGXGRJJKT-LSDHHAIUSA-N	0	3	325.815	3.314	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)[C@H](C)c1cccc(C#N)c1)C(C)C	ZINC000461893698	458577049	/nfs/dbraw/zinc/57/70/49/458577049.db2.gz	FWCHAIYGNWTTQD-XLIONFOSSA-N	0	3	339.483	3.477	20	30		EGEDHN
Cc1cc(CNCCNC(=O)CCCc2ccccc2)ccc1C#N	ZINC000424184407	458578901	/nfs/dbraw/zinc/57/89/01/458578901.db2.gz	FCXCIZVCOAIFAY-UHFFFAOYSA-N	0	3	335.451	3.095	20	30		EGEDHN
COc1cc(CNCCC(C)(C)C(=O)OC(C)(C)C)ccc1C#N	ZINC000424191828	458581890	/nfs/dbraw/zinc/58/18/90/458581890.db2.gz	RWEOSOFGCWEQRZ-UHFFFAOYSA-N	0	3	332.444	3.414	20	30		EGEDHN
COc1cc(CN[C@@H]2CC[C@H](C#N)C2)ccc1OCc1ccncc1	ZINC000424207159	458584537	/nfs/dbraw/zinc/58/45/37/458584537.db2.gz	XJUCEZLNPFLQJO-FUHWJXTLSA-N	0	3	337.423	3.451	20	30		EGEDHN
CC[C@H](CN(CC)[C@H](C)C(=O)NC1(C#N)CCC1)c1ccccc1	ZINC000469790537	458592453	/nfs/dbraw/zinc/59/24/53/458592453.db2.gz	KKVNUEYKGABZIS-IAGOWNOFSA-N	0	3	327.472	3.453	20	30		EGEDHN
C[C@H]1C[C@@H](N(C)C(=O)Nc2ccc(CC#N)cc2Cl)CCN1C	ZINC000455698130	458606282	/nfs/dbraw/zinc/60/62/82/458606282.db2.gz	FOQTXCFFXRAJJY-JSGCOSHPSA-N	0	3	334.851	3.352	20	30		EGEDHN
CC(C)(C#N)c1ccc(C(=O)N2CCC[C@H](N3CCCC3)C2)cc1	ZINC000373850093	458625685	/nfs/dbraw/zinc/62/56/85/458625685.db2.gz	JREYJUFEDVTXQI-SFHVURJKSA-N	0	3	325.456	3.188	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCCc2cccc(Cl)c2)cc1	ZINC000470741365	458647822	/nfs/dbraw/zinc/64/78/22/458647822.db2.gz	WJHIFZZFTRLPIC-KRWDZBQOSA-N	0	3	337.810	3.253	20	30		EGEDHN
C=CCN(CCCN1C(=O)c2ccccc2C1=O)Cc1ccccc1	ZINC000502618464	458661901	/nfs/dbraw/zinc/66/19/01/458661901.db2.gz	KGJRNLKGFUKAMG-UHFFFAOYSA-N	0	3	334.419	3.361	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)Nc1ccc(CN2CCN(CC)CC2)cc1	ZINC000424588942	458671579	/nfs/dbraw/zinc/67/15/79/458671579.db2.gz	WSHTUFDQUUCZCV-UHFFFAOYSA-N	0	3	329.488	3.365	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)CCOCC1	ZINC000424604541	458677708	/nfs/dbraw/zinc/67/77/08/458677708.db2.gz	HHQXAKNGYQCGTR-MJGOQNOKSA-N	0	3	342.483	3.311	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](CN(C)Cc2scnc2C)C1	ZINC000424802877	458736097	/nfs/dbraw/zinc/73/60/97/458736097.db2.gz	YAPLHEDWXBPWNI-OAHLLOKOSA-N	0	3	335.517	3.334	20	30		EGEDHN
CC(C)Oc1ccc(C#N)cc1NC(=O)N[C@H](C)CN1CCCCC1	ZINC000505667519	458746639	/nfs/dbraw/zinc/74/66/39/458746639.db2.gz	ZTUOIHAZDAKYDI-OAHLLOKOSA-N	0	3	344.459	3.341	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H](Cc2ccc(Cl)cc2)C(N)=O)cc1	ZINC000506630372	458751297	/nfs/dbraw/zinc/75/12/97/458751297.db2.gz	KHMRAWSVBGIISX-SFHVURJKSA-N	0	3	344.842	3.091	20	30		EGEDHN
C=CCOc1cccc(CN2CCC[C@H](C(=O)NCCCC)C2)c1	ZINC000512526322	458785555	/nfs/dbraw/zinc/78/55/55/458785555.db2.gz	FCRXAPOBGNYTHK-SFHVURJKSA-N	0	3	330.472	3.380	20	30		EGEDHN
C[C@H]1[C@@H](Cc2ccccc2)CCN1CC(=O)NC1(C#N)CCCCC1	ZINC000472354663	458790751	/nfs/dbraw/zinc/79/07/51/458790751.db2.gz	VFXQCVSYYGAVGX-PKOBYXMFSA-N	0	3	339.483	3.282	20	30		EGEDHN
C=C[C@H]1CCCCN1C(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000472380355	458792467	/nfs/dbraw/zinc/79/24/67/458792467.db2.gz	HAJOCQVTZQNZIR-MOPGFXCFSA-N	0	3	327.472	3.259	20	30		EGEDHN
CCCN(CC(=O)N(CC)C[C@@H](C)C#N)[C@@H]1CCc2ccccc2C1	ZINC000513632674	458795036	/nfs/dbraw/zinc/79/50/36/458795036.db2.gz	FGJRGJPXVDVZHT-FXAWDEMLSA-N	0	3	341.499	3.264	20	30		EGEDHN
CCN(C[C@@H]1CCCN1CC)C(=O)C(C)(C)Oc1ccc(C#N)cc1	ZINC000547798113	458795620	/nfs/dbraw/zinc/79/56/20/458795620.db2.gz	KPRYFNXYGALGSJ-KRWDZBQOSA-N	0	3	343.471	3.048	20	30		EGEDHN
C=CCn1c(SC[C@H]2CCN(C)C2)nnc1-c1ccc(F)cc1	ZINC000473789274	458843929	/nfs/dbraw/zinc/84/39/29/458843929.db2.gz	MLYBCCFTGYVOHA-ZDUSSCGKSA-N	0	3	332.448	3.314	20	30		EGEDHN
COc1cc(CN[C@@H]2CCCN(c3cccc(F)c3)C2)ccc1C#N	ZINC000440824750	458858937	/nfs/dbraw/zinc/85/89/37/458858937.db2.gz	PNYNJRACQNWTDI-GOSISDBHSA-N	0	3	339.414	3.465	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNc1nc2ccccc2cc1CO)C(C)C	ZINC000518350485	458859844	/nfs/dbraw/zinc/85/98/44/458859844.db2.gz	CYAJTGGABIVTOX-FQEVSTJZSA-N	0	3	339.483	3.260	20	30		EGEDHN
CC(C)(C#N)c1ccc(C(=O)NCC(C)(C)N2CCCCC2)cc1	ZINC000474204782	458868268	/nfs/dbraw/zinc/86/82/68/458868268.db2.gz	GNEDCZWGXHMDSI-UHFFFAOYSA-N	0	3	327.472	3.482	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)C2(C#N)CCC2)N(CC)CC)cc1	ZINC000554220397	458898325	/nfs/dbraw/zinc/89/83/25/458898325.db2.gz	QZKHLUORLBUTJO-GOSISDBHSA-N	0	3	327.472	3.442	20	30		EGEDHN
C=C(C)Cn1c(N2CC[C@@H](N3CCCCC3)C2)nnc1C(C)(C)C	ZINC000555269519	458905102	/nfs/dbraw/zinc/90/51/02/458905102.db2.gz	PDVLWMZBJNSGIE-MRXNPFEDSA-N	0	3	331.508	3.216	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@]2(C)CCCc3ccccc32)CC1	ZINC000519271072	458929519	/nfs/dbraw/zinc/92/95/19/458929519.db2.gz	NVZBFWKKTGMFGP-OAQYLSRUSA-N	0	3	326.484	3.437	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN(C)CCc1cccs1	ZINC000441514606	458956107	/nfs/dbraw/zinc/95/61/07/458956107.db2.gz	KCAFPGUFULAATO-QGZVFWFLSA-N	0	3	331.481	3.391	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)N(C)CC(C)(C)C#N)N(C)C)cc1	ZINC000457476790	458971557	/nfs/dbraw/zinc/97/15/57/458971557.db2.gz	KKGVROGYMPMWIV-KRWDZBQOSA-N	0	3	330.476	3.043	20	30		EGEDHN
C=CCC1(C(=O)N=c2ccn(C3CCN(C)CC3)[nH]2)CCCCC1	ZINC000519688316	458987654	/nfs/dbraw/zinc/98/76/54/458987654.db2.gz	LZVDNRAAHXUIGL-UHFFFAOYSA-N	0	3	330.476	3.037	20	30		EGEDHN
C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NCC#Cc1ccc(F)cc1	ZINC000495949947	459015644	/nfs/dbraw/zinc/01/56/44/459015644.db2.gz	ZLVUXIDGLKUKQB-MAUKXSAKSA-N	0	3	346.446	3.412	20	30		EGEDHN
C[C@@H]1OCC[C@@]1(O)CN(Cc1ccccc1)Cc1cccc(C#N)c1	ZINC000566882179	459016043	/nfs/dbraw/zinc/01/60/43/459016043.db2.gz	JFONJFZCBNDCRK-LAUBAEHRSA-N	0	3	336.435	3.100	20	30		EGEDHN
C[C@H](CCC#N)N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000495982633	459026364	/nfs/dbraw/zinc/02/63/64/459026364.db2.gz	OUPFLSMSQXSEDK-MRXNPFEDSA-N	0	3	329.444	3.317	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(CN[C@@H]3CC[C@@H](C#N)C3)cc2)C[C@H](C)O1	ZINC000442722339	459026544	/nfs/dbraw/zinc/02/65/44/459026544.db2.gz	VDMLHHYCSIDDJX-WOUAJJJCSA-N	0	3	327.472	3.078	20	30		EGEDHN
CN(C)C[C@H](NC(=O)c1ccc(Cl)c(C#N)c1)c1ccc(F)cc1	ZINC000577435280	459032147	/nfs/dbraw/zinc/03/21/47/459032147.db2.gz	JATLEDJINCEUCH-KRWDZBQOSA-N	0	3	345.805	3.383	20	30		EGEDHN
CN(C)C[C@@H](NC(=O)c1ccc(Cl)c(C#N)c1)c1ccc(F)cc1	ZINC000577435286	459032595	/nfs/dbraw/zinc/03/25/95/459032595.db2.gz	JATLEDJINCEUCH-QGZVFWFLSA-N	0	3	345.805	3.383	20	30		EGEDHN
N#C[C@@H]1CC[C@H](NC[C@H](O)COc2cccc(Cl)c2Cl)C1	ZINC000442778841	459034744	/nfs/dbraw/zinc/03/47/44/459034744.db2.gz	KXEXMOOOYMVREU-WOPDTQHZSA-N	0	3	329.227	3.015	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N[C@H]1CCCN(C)[C@@H]1C)c1ccc(F)c(F)c1	ZINC000477195702	459035121	/nfs/dbraw/zinc/03/51/21/459035121.db2.gz	VXXZIZFHMQFWBO-DQYPLSBCSA-N	0	3	337.414	3.364	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1ccc(F)c(OC)c1)C(C)C	ZINC000477231926	459037082	/nfs/dbraw/zinc/03/70/82/459037082.db2.gz	OIXXNGNWNOXDGS-QGZVFWFLSA-N	0	3	334.435	3.263	20	30		EGEDHN
CC(C)c1ccc([C@H](N)CNC(=O)N2CCC(CC#N)CC2)cc1	ZINC000577606504	459060173	/nfs/dbraw/zinc/06/01/73/459060173.db2.gz	RJJXJTDANFJETK-GOSISDBHSA-N	0	3	328.460	3.145	20	30		EGEDHN
Cc1nn(-c2cccc(Br)c2)cc1CNCCCC#N	ZINC000594501430	459064456	/nfs/dbraw/zinc/06/44/56/459064456.db2.gz	WAEGAINPSSDANW-UHFFFAOYSA-N	0	3	333.233	3.337	20	30		EGEDHN
Cc1cc(CN[C@H]2CCCN(C3CCCCC3)C2=O)ccc1C#N	ZINC000577854017	459107555	/nfs/dbraw/zinc/10/75/55/459107555.db2.gz	NBLLSYUASKBKBL-IBGZPJMESA-N	0	3	325.456	3.280	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)NCc1ccccc1Oc1cccc(F)c1	ZINC000567462999	459110710	/nfs/dbraw/zinc/11/07/10/459110710.db2.gz	YRLBYAUSRCBRKG-QGZVFWFLSA-N	0	3	341.386	3.255	20	30		EGEDHN
C[C@@H]1C[C@H]1N1CCN(C(=O)c2ccc(C#N)c(Cl)c2)C[C@@H](C)C1	ZINC000558023232	459126106	/nfs/dbraw/zinc/12/61/06/459126106.db2.gz	IMOGADHUMIAZCE-OGHNNQOOSA-N	0	3	331.847	3.014	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1CCN([C@@H]2C[C@H]2C)C[C@@H](C)C1	ZINC000558023827	459126914	/nfs/dbraw/zinc/12/69/14/459126914.db2.gz	FRBTWKYMWMPTLR-JFIYKMOQSA-N	0	3	328.456	3.054	20	30		EGEDHN
C[C@@H](CNC(=O)NC1(c2cccc(C#N)c2)CC1)N1CCCC[C@H]1C	ZINC000479387236	459137251	/nfs/dbraw/zinc/13/72/51/459137251.db2.gz	NPGCHCALTIYMOO-CVEARBPZSA-N	0	3	340.471	3.109	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)N(C)[C@@H](C)C1CCN(C)CC1	ZINC000567960882	459198767	/nfs/dbraw/zinc/19/87/67/459198767.db2.gz	CPQAVGOKWKEFMV-HNNXBMFYSA-N	0	3	346.471	3.062	20	30		EGEDHN
CO[C@](C)(CNCc1ccc(C#N)s1)COCc1ccccc1	ZINC000594975840	459202998	/nfs/dbraw/zinc/20/29/98/459202998.db2.gz	VQGAYNLUERWGOU-GOSISDBHSA-N	0	3	330.453	3.331	20	30		EGEDHN
C=CCCS(=O)(=O)NC[C@H](CC(C)C)N[C@H](C)c1ccccc1	ZINC000480975881	459226412	/nfs/dbraw/zinc/22/64/12/459226412.db2.gz	CVTDARNXNHIEBV-AEFFLSMTSA-N	0	3	338.517	3.247	20	30		EGEDHN
C=C(C)Cn1c(CC(C)(C)C)nnc1N1CCN(C)[C@H](C(C)C)C1	ZINC000559010652	459230607	/nfs/dbraw/zinc/23/06/07/459230607.db2.gz	JGQBJTZSODWWQW-INIZCTEOSA-N	0	3	333.524	3.219	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccncc2Oc2ccccc2)CC1	ZINC000579670082	459249254	/nfs/dbraw/zinc/24/92/54/459249254.db2.gz	BUXOLHFGWZEQLP-UHFFFAOYSA-N	0	3	337.423	3.254	20	30		EGEDHN
N#CCc1ccc(OC[C@@H](O)CNCc2coc3ccccc23)cc1	ZINC000579947948	459253953	/nfs/dbraw/zinc/25/39/53/459253953.db2.gz	KWZBHNRJSUFJOO-KRWDZBQOSA-N	0	3	336.391	3.028	20	30		EGEDHN
C[C@@H](NC(=O)N1CCC(CC#N)CC1)[C@@H](c1ccccc1)N(C)C	ZINC000580483790	459260479	/nfs/dbraw/zinc/26/04/79/459260479.db2.gz	OAJIKZJKBXYWAG-QAPCUYQASA-N	0	3	328.460	3.013	20	30		EGEDHN
N#Cc1ccc(CCN2CCC(OC[C@H]3CCCCO3)CC2)cc1	ZINC000595347333	459281571	/nfs/dbraw/zinc/28/15/71/459281571.db2.gz	SQFOJFSQRJRAKO-HXUWFJFHSA-N	0	3	328.456	3.151	20	30		EGEDHN
Cc1ccc(NC(=O)[C@H]2CCCN(CCc3ccc(C#N)cc3)C2)nc1	ZINC000595377210	459286908	/nfs/dbraw/zinc/28/69/08/459286908.db2.gz	MKJSKAZJRIAQMX-IBGZPJMESA-N	0	3	348.450	3.155	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1ccc(N(C)C)c(F)c1)C(C)C	ZINC000523655294	459319603	/nfs/dbraw/zinc/31/96/03/459319603.db2.gz	BJCVREZPCSTSOT-LJQANCHMSA-N	0	3	347.478	3.320	20	30		EGEDHN
Cc1cc(CN2CCC(c3nnc4n3CCCC4)CC2)ccc1C#N	ZINC000568736699	459336095	/nfs/dbraw/zinc/33/60/95/459336095.db2.gz	QJGGBXJSFWUWMV-UHFFFAOYSA-N	0	3	335.455	3.174	20	30		EGEDHN
C[C@H](OC[C@H](O)CN1CCC[C@H](CC#N)C1)c1ccc(Cl)cc1	ZINC000595610475	459365602	/nfs/dbraw/zinc/36/56/02/459365602.db2.gz	ZLCFHEZXGAVKTR-HDMKZQKVSA-N	0	3	336.863	3.404	20	30		EGEDHN
C=CCCC[C@@H](C)NC(=O)CCN1CCN(c2cccc(C)c2)CC1	ZINC000539437544	459377297	/nfs/dbraw/zinc/37/72/97/459377297.db2.gz	WEVKQUIWFDBQJO-LJQANCHMSA-N	0	3	343.515	3.368	20	30		EGEDHN
C=CCCC[C@H](C)NC(=O)CCN1CCN(c2cccc(C)c2)CC1	ZINC000539437543	459377454	/nfs/dbraw/zinc/37/74/54/459377454.db2.gz	WEVKQUIWFDBQJO-IBGZPJMESA-N	0	3	343.515	3.368	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1CCC[C@H]([C@H]2CCCCO2)C1	ZINC000595790405	459442764	/nfs/dbraw/zinc/44/27/64/459442764.db2.gz	PSCOHGQINPUEIU-ZWKOTPCHSA-N	0	3	344.455	3.227	20	30		EGEDHN
C=CCN(CCc1ccco1)Cc1ccc(-n2cncn2)c(F)c1	ZINC000541846745	459498087	/nfs/dbraw/zinc/49/80/87/459498087.db2.gz	BGDPONQSVCCNAL-UHFFFAOYSA-N	0	3	326.375	3.230	20	30		EGEDHN
C[C@@H](N(CC(=O)NC1(C#N)CCC1)Cc1ccccc1)C(C)(C)C	ZINC000525885643	459511901	/nfs/dbraw/zinc/51/19/01/459511901.db2.gz	KJTHHFANBLWCCR-MRXNPFEDSA-N	0	3	327.472	3.486	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@H](c1cccs1)N1CCCC1	ZINC000488561496	459547012	/nfs/dbraw/zinc/54/70/12/459547012.db2.gz	MISOGMLUNSHWEW-MRXNPFEDSA-N	0	3	329.469	3.303	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN(C)CCc1ccccc1O	ZINC000542321760	459547767	/nfs/dbraw/zinc/54/77/67/459547767.db2.gz	MKKPSIHWRIOSAQ-LJQANCHMSA-N	0	3	341.451	3.035	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@H](c1ccc(CC)cc1)N(C)C	ZINC000488601048	459547863	/nfs/dbraw/zinc/54/78/63/459547863.db2.gz	XQTVGXPBLZSPQM-LJQANCHMSA-N	0	3	325.456	3.269	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000488742366	459549954	/nfs/dbraw/zinc/54/99/54/459549954.db2.gz	FAQIIIFNCYKFMV-IEBWSBKVSA-N	0	3	337.467	3.457	20	30		EGEDHN
CC(C)(CCC#N)CNC(=O)N[C@]1(C)CCN(Cc2ccccc2)C1	ZINC000570051028	459551716	/nfs/dbraw/zinc/55/17/16/459551716.db2.gz	SBKXQULPQBVBNR-HXUWFJFHSA-N	0	3	342.487	3.280	20	30		EGEDHN
CCCN(C(=O)Nc1cc(C#N)ccc1OC(C)C)[C@@H]1CCN(C)C1	ZINC000592224593	459553708	/nfs/dbraw/zinc/55/37/08/459553708.db2.gz	TXNCGTYYGLRTQA-MRXNPFEDSA-N	0	3	344.459	3.293	20	30		EGEDHN
COc1cccc(C2(NCCCSCC#N)CCOCC2)c1F	ZINC000572468639	459579861	/nfs/dbraw/zinc/57/98/61/459579861.db2.gz	MTDMYKUYYKIKPE-UHFFFAOYSA-N	0	3	338.448	3.076	20	30		EGEDHN
C[C@H](C(=O)NC1(C#N)CCC1)N1CC[C@@](C)(CCc2ccccc2)C1	ZINC000527048424	459582092	/nfs/dbraw/zinc/58/20/92/459582092.db2.gz	LQSIBIZMHJCUJN-YLJYHZDGSA-N	0	3	339.483	3.282	20	30		EGEDHN
C[C@@H](NC(C)(C)CNC(=O)N1CCC[C@H](CC#N)C1)c1ccccc1	ZINC000596305420	459590029	/nfs/dbraw/zinc/59/00/29/459590029.db2.gz	UQVDRQHSCWJTOK-IAGOWNOFSA-N	0	3	342.487	3.451	20	30		EGEDHN
C#C[C@H](NC1CCC(CS(C)(=O)=O)CC1)c1ccc(Cl)cc1	ZINC000491126068	459599408	/nfs/dbraw/zinc/59/94/08/459599408.db2.gz	KJEUZSONWWZOLN-IMRCBTMISA-N	0	3	339.888	3.207	20	30		EGEDHN
C[C@H]1C[C@@H](c2ccc(F)cc2)CN1Cc1cnc2c(C#N)cnn2c1	ZINC000572961602	459602581	/nfs/dbraw/zinc/60/25/81/459602581.db2.gz	MJHSYVRFJJDCFE-XJKSGUPXSA-N	0	3	335.386	3.118	20	30		EGEDHN
C[C@H]1C[C@@H](Nc2c(C#N)cnc3ccc(Cl)cc32)CN1C1CC1	ZINC000583845064	459604575	/nfs/dbraw/zinc/60/45/75/459604575.db2.gz	ULHLZHRURMHCJD-SMDDNHRTSA-N	0	3	326.831	3.219	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N1CCC(C(=O)NCC(F)(F)F)CC1	ZINC000527190883	459604672	/nfs/dbraw/zinc/60/46/72/459604672.db2.gz	LTWIQDZYEYWOJC-GFCCVEGCSA-N	0	3	339.361	3.010	20	30		EGEDHN
C#C[C@@H](C)N(C)CCC(=O)N[C@H](c1cccs1)c1ccccc1	ZINC000491339677	459618027	/nfs/dbraw/zinc/61/80/27/459618027.db2.gz	RPLKITCQTLKNOE-BEFAXECRSA-N	0	3	326.465	3.297	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cnn(C(CC)CC)c2CC)CC1	ZINC000491395014	459622962	/nfs/dbraw/zinc/62/29/62/459622962.db2.gz	QBHPFNXPVYRECJ-UHFFFAOYSA-N	0	3	330.476	3.090	20	30		EGEDHN
N#Cc1cccc(C2(N[C@H]3CCN(CCc4ccccc4)C3)CC2)c1	ZINC000583950144	459623973	/nfs/dbraw/zinc/62/39/73/459623973.db2.gz	SXSKHJOYXOLGHL-NRFANRHFSA-N	0	3	331.463	3.454	20	30		EGEDHN
N#Cc1cccc(C2(N[C@@H]3CCN(CCc4ccccc4)C3)CC2)c1	ZINC000583950145	459624220	/nfs/dbraw/zinc/62/42/20/459624220.db2.gz	SXSKHJOYXOLGHL-OAQYLSRUSA-N	0	3	331.463	3.454	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCc2cc3ccccc3o2)cc1	ZINC000527321640	459627398	/nfs/dbraw/zinc/62/73/98/459627398.db2.gz	QEAHZERRNYPJJT-KRWDZBQOSA-N	0	3	329.359	3.303	20	30		EGEDHN
C=CCN1CC[C@H](N2CC[C@@H](Cc3ccc(C(C)C)cc3)C2)C1=O	ZINC000499635569	459642865	/nfs/dbraw/zinc/64/28/65/459642865.db2.gz	YCFHQAGFCIFFDU-ICSRJNTNSA-N	0	3	326.484	3.461	20	30		EGEDHN
N#Cc1cnn2cc(CNCC3(c4ccccc4Cl)CC3)cnc12	ZINC000584113766	459658638	/nfs/dbraw/zinc/65/86/38/459658638.db2.gz	GZRHGTFQVRAWQL-UHFFFAOYSA-N	0	3	337.814	3.076	20	30		EGEDHN
C[C@H](NC(=O)N1CCC[C@H](CC#N)C1)[C@H](c1ccccc1)N(C)C	ZINC000596596991	459691564	/nfs/dbraw/zinc/69/15/64/459691564.db2.gz	HWWXIOGUVAPEDZ-LZLYRXPVSA-N	0	3	328.460	3.013	20	30		EGEDHN
C/C=C(/C=C\C(=O)N(CCN(C)C)Cc1cccc(C#N)c1)CC	ZINC000492117431	459691998	/nfs/dbraw/zinc/69/19/98/459691998.db2.gz	IYOJWVJLSFISMY-ANIYQSBXSA-N	0	3	325.456	3.361	20	30		EGEDHN
CC1(C)CN(C(=O)C(C#N)Cc2ccc(C#N)cc2)[C@H]1c1cccnc1	ZINC000592800981	459693787	/nfs/dbraw/zinc/69/37/87/459693787.db2.gz	DWDHNHDCURLZID-OALUTQOASA-N	0	3	344.418	3.245	20	30		EGEDHN
CC(C#N)C(=O)N(CCCNC(=O)OC(C)(C)C)Cc1ccccc1	ZINC000492260926	459697741	/nfs/dbraw/zinc/69/77/41/459697741.db2.gz	UKASBFNOACWBOB-OAHLLOKOSA-N	0	3	345.443	3.090	20	30		EGEDHN
C[C@@H]1CC2(CN1C(=O)C(C#N)CCc1ccccc1)CCOCC2	ZINC000592894625	459714743	/nfs/dbraw/zinc/71/47/43/459714743.db2.gz	NCSFWSMXAVDZQZ-AEFFLSMTSA-N	0	3	326.440	3.177	20	30		EGEDHN
C[C@@H](CCc1cccc(F)c1)N1CCN(c2cc(C#N)ccn2)CC1	ZINC000543985951	459716468	/nfs/dbraw/zinc/71/64/68/459716468.db2.gz	HBODBTOSJVRFBB-INIZCTEOSA-N	0	3	338.430	3.236	20	30		EGEDHN
N#CCc1ccc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)cc1	ZINC000593014663	459740125	/nfs/dbraw/zinc/74/01/25/459740125.db2.gz	CGCAPMNYRLOFIK-KBPBESRZSA-N	0	3	326.318	3.439	20	30		EGEDHN
CN(C(=O)C(C[C@@H]1CCCO1)C(F)(F)F)c1ccc(C#N)cc1	ZINC000593073073	459765090	/nfs/dbraw/zinc/76/50/90/459765090.db2.gz	OTYSSIJCCDAILL-UONOGXRCSA-N	0	3	326.318	3.269	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)Nc1ccc2c(c1)CNCCO2	ZINC000563507394	459766069	/nfs/dbraw/zinc/76/60/69/459766069.db2.gz	ZZZGKFCPBDZDHU-UHFFFAOYSA-N	0	3	343.452	3.450	20	30		EGEDHN
CCn1cc(CN(CCC(=O)Nc2cccc(C#N)c2)C(C)C)cn1	ZINC000593081214	459767073	/nfs/dbraw/zinc/76/70/73/459767073.db2.gz	OYOZAGDRTZQSOR-UHFFFAOYSA-N	0	3	339.443	3.014	20	30		EGEDHN
COC(=O)COc1c(C)cc(CN2CCC(CCC#N)CC2)cc1C	ZINC000564990852	459779857	/nfs/dbraw/zinc/77/98/57/459779857.db2.gz	OLKDPHGKWHRPBD-UHFFFAOYSA-N	0	3	344.455	3.371	20	30		EGEDHN
COc1cc(C#N)ccc1NC(=O)C(C[C@H]1CCCO1)C(F)(F)F	ZINC000593129322	459782147	/nfs/dbraw/zinc/78/21/47/459782147.db2.gz	UOFITIAXVAXRAE-VXGBXAGGSA-N	0	3	342.317	3.253	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C2CCc3ccccc3CC2)CC1	ZINC000528448061	459807334	/nfs/dbraw/zinc/80/73/34/459807334.db2.gz	KFCUAWBVMGSWIU-UHFFFAOYSA-N	0	3	326.484	3.338	20	30		EGEDHN
C[C@H]1O[C@@H](C)[C@H](C)[C@H]1C(=O)C(C#N)c1nc(-c2ccncc2)cs1	ZINC000528932574	459818507	/nfs/dbraw/zinc/81/85/07/459818507.db2.gz	HSLVBRTYMJKGFM-HCBXJVOMSA-N	0	3	341.436	3.441	20	30		EGEDHN
C[C@@H](CN1CCC(C)CC1)NC(=O)C(C)(C)c1cc(F)cc(C#N)c1	ZINC000598259641	459841441	/nfs/dbraw/zinc/84/14/41/459841441.db2.gz	CGZKPPPAOZKPNZ-HNNXBMFYSA-N	0	3	345.462	3.212	20	30		EGEDHN
CC[C@@H](NC1CCN(c2ccc(C#N)cn2)CC1)c1ccc(F)cn1	ZINC000585794083	459849169	/nfs/dbraw/zinc/84/91/69/459849169.db2.gz	BPGVFOLQDVPLAD-QGZVFWFLSA-N	0	3	339.418	3.197	20	30		EGEDHN
N#Cc1cccc(CN2CCC(Nc3ccncc3Cl)CC2)c1	ZINC000593514874	459913057	/nfs/dbraw/zinc/91/30/57/459913057.db2.gz	GGEBCKLNODHDSU-UHFFFAOYSA-N	0	3	326.831	3.105	20	30		EGEDHN
COc1ccc([C@@H]2CCCN2C[C@@H](O)CC(C)(C)C#N)c(OC)c1	ZINC000598584781	459954537	/nfs/dbraw/zinc/95/45/37/459954537.db2.gz	VPWRGZBZWBNFSB-YOEHRIQHSA-N	0	3	332.444	3.141	20	30		EGEDHN
CN(Cc1cccc(OC(F)(F)F)c1)C[C@H](O)CC(C)(C)C#N	ZINC000598593403	459956058	/nfs/dbraw/zinc/95/60/58/459956058.db2.gz	SLRRWJQMHJKPFD-CYBMUJFWSA-N	0	3	330.350	3.318	20	30		EGEDHN
CCCN(C[C@H](O)CC(C)(C)C#N)[C@H](C)C(=O)Nc1ccccc1C	ZINC000598612925	459962632	/nfs/dbraw/zinc/96/26/32/459962632.db2.gz	FROHFGRLBMSVBS-IAGOWNOFSA-N	0	3	345.487	3.335	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN[C@@H](CCO)c1cccc(C(F)(F)F)c1	ZINC000598618832	459965792	/nfs/dbraw/zinc/96/57/92/459965792.db2.gz	RMIQAMMTTBILFT-CABCVRRESA-N	0	3	344.377	3.019	20	30		EGEDHN
N#CCCCCNC(=O)N[C@H](CN1CCCCC1)c1ccccc1	ZINC000609639957	460001881	/nfs/dbraw/zinc/00/18/81/460001881.db2.gz	YWTPZIRMUQZKBQ-GOSISDBHSA-N	0	3	328.460	3.207	20	30		EGEDHN
C[C@@H](Cc1ccccc1Br)NCc1cccc(C#N)n1	ZINC000602572332	460002338	/nfs/dbraw/zinc/00/23/38/460002338.db2.gz	YLKUKDXNOJKBSU-LBPRGKRZSA-N	0	3	330.229	3.437	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CNCc1cc(Cl)ccc1OC(F)F	ZINC000598719722	460005326	/nfs/dbraw/zinc/00/53/26/460005326.db2.gz	KNMUPNAPEZYBRH-GFCCVEGCSA-N	0	3	332.778	3.332	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CNCc1cccc(Br)c1Cl	ZINC000598727147	460007318	/nfs/dbraw/zinc/00/73/18/460007318.db2.gz	DFMJKSAHJKCVJV-LLVKDONJSA-N	0	3	345.668	3.493	20	30		EGEDHN
CCCOc1ccc(O[C@@H]2CCCC[C@H]2NC(=O)C(C)C#N)cc1	ZINC000609921553	460039732	/nfs/dbraw/zinc/03/97/32/460039732.db2.gz	LSZQQHLFHITAHX-ZTFGCOKTSA-N	0	3	330.428	3.441	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)C(=O)N1CCN(C2CCCCC2)CC1	ZINC000593993138	460045357	/nfs/dbraw/zinc/04/53/57/460045357.db2.gz	KIHHUXPKDSGTNZ-KRWDZBQOSA-N	0	3	339.483	3.214	20	30		EGEDHN
C[C@@H](CC1(C#N)CCOCC1)N[C@@H](C)c1ccc2c(c1)CCC(=O)N2	ZINC000602658458	460049245	/nfs/dbraw/zinc/04/92/45/460049245.db2.gz	YERKRDWNXOFGQA-GJZGRUSLSA-N	0	3	341.455	3.321	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCN(Cc3cccc4ncccc34)C2)nc1	ZINC000602673567	460057184	/nfs/dbraw/zinc/05/71/84/460057184.db2.gz	VVENRLVNIIWQAJ-KRWDZBQOSA-N	0	3	330.391	3.155	20	30		EGEDHN
CC[C@@H](N[C@H]1CCN(C(=O)C2CCCC2)C1)c1ccc(C#N)cc1	ZINC000618571417	460067335	/nfs/dbraw/zinc/06/73/35/460067335.db2.gz	MMMXKBBCPVVSDT-RBUKOAKNSA-N	0	3	325.456	3.390	20	30		EGEDHN
N#Cc1ccc(NC(=O)N[C@@H]2CCCN3CCCC[C@H]23)c(Cl)c1	ZINC000594084981	460094890	/nfs/dbraw/zinc/09/48/90/460094890.db2.gz	UXESAVLUMICXID-HZPDHXFCSA-N	0	3	332.835	3.350	20	30		EGEDHN
CC(C)(C)n1cc(C#N)cc1NC(=O)N[C@@H]1CCCN2CCCC[C@@H]12	ZINC000594095691	460099380	/nfs/dbraw/zinc/09/93/80/460099380.db2.gz	BYUCIJLIEHHYFB-CVEARBPZSA-N	0	3	343.475	3.253	20	30		EGEDHN
N#Cc1c(Br)cccc1N1CCN(c2ccncc2)CC1	ZINC000589557179	460103215	/nfs/dbraw/zinc/10/32/15/460103215.db2.gz	ODAIEPRHHLOPJH-UHFFFAOYSA-N	0	3	343.228	3.042	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@@H](C)CC[S@](C)=O)cc1OC	ZINC000598966777	460108100	/nfs/dbraw/zinc/10/81/00/460108100.db2.gz	HILHRWJIMSVTAQ-YTEVENLXSA-N	0	3	345.892	3.160	20	30		EGEDHN
CCOC(=O)c1[nH]c(C)c(CN[C@@H]2CCc3cc(C#N)ccc32)c1C	ZINC000598973948	460112038	/nfs/dbraw/zinc/11/20/38/460112038.db2.gz	IJVHYAOYRMVPML-GOSISDBHSA-N	0	3	337.423	3.457	20	30		EGEDHN
C[C@@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(C#N)c1	ZINC000610357254	460133749	/nfs/dbraw/zinc/13/37/49/460133749.db2.gz	JNYAYSPJPRGQDE-OXQOHEQNSA-N	0	3	348.450	3.193	20	30		EGEDHN
N#Cc1ccc(OCCN[C@@H](Cn2cccn2)c2ccccc2)cc1	ZINC000610432864	460149974	/nfs/dbraw/zinc/14/99/74/460149974.db2.gz	FTMBJZLMCZXOHX-FQEVSTJZSA-N	0	3	332.407	3.165	20	30		EGEDHN
C[C@H](c1ccc(F)c(F)c1)N(C)C[C@H](O)COc1ccccc1C#N	ZINC000599255730	460206051	/nfs/dbraw/zinc/20/60/51/460206051.db2.gz	IWPCHZVTUNUWFS-CJNGLKHVSA-N	0	3	346.377	3.269	20	30		EGEDHN
C[C@@H](NC(=O)[C@H](N)CCCCC#N)c1ccc(Br)cc1	ZINC000594431932	460217615	/nfs/dbraw/zinc/21/76/15/460217615.db2.gz	STCJXSQOWWXXRC-BXUZGUMPSA-N	0	3	338.249	3.038	20	30		EGEDHN
CC(C)[C@@H](NC[C@@H](O)COc1ccccc1C#N)c1ccc(F)cc1	ZINC000599312485	460226641	/nfs/dbraw/zinc/22/66/41/460226641.db2.gz	UTNVBZZOPKKFNA-UYAOXDASSA-N	0	3	342.414	3.424	20	30		EGEDHN
CCOc1cccc([C@H](C)NC[C@@H](O)COc2ccccc2C#N)c1	ZINC000599349033	460234851	/nfs/dbraw/zinc/23/48/51/460234851.db2.gz	JVHOFUDTUNROPO-MAUKXSAKSA-N	0	3	340.423	3.047	20	30		EGEDHN
Cc1cc([C@@H](C)NC[C@H](O)COc2ccccc2C#N)ccc1F	ZINC000599355143	460236539	/nfs/dbraw/zinc/23/65/39/460236539.db2.gz	VAHZZQBMTBLIOP-PBHICJAKSA-N	0	3	328.387	3.096	20	30		EGEDHN
C[C@@H](N[C@@H](C)c1cccc(C#N)c1)c1cccc(NS(C)(=O)=O)c1	ZINC000610830416	460245514	/nfs/dbraw/zinc/24/55/14/460245514.db2.gz	RKAMBOMYYSFVAT-UONOGXRCSA-N	0	3	343.452	3.342	20	30		EGEDHN
COc1cc(Cl)c(CNC2CCN(CC#N)CC2)cc1Cl	ZINC000611084222	460287791	/nfs/dbraw/zinc/28/77/91/460287791.db2.gz	ZKNYWARVLQWPCS-UHFFFAOYSA-N	0	3	328.243	3.080	20	30		EGEDHN
C=CCC1(NCCS(=O)(=O)c2cccc(OC)c2)CCCCC1	ZINC000625936287	460309782	/nfs/dbraw/zinc/30/97/82/460309782.db2.gz	GRXRZCARCWEOJR-UHFFFAOYSA-N	0	3	337.485	3.338	20	30		EGEDHN
N#Cc1ccccc1N1CCN(C[C@@H]2CCOc3ccccc32)CC1	ZINC000611253811	460318611	/nfs/dbraw/zinc/31/86/11/460318611.db2.gz	LVBFGEMACFPTRO-SFHVURJKSA-N	0	3	333.435	3.247	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NC[C@H]2CCc3ccccc3C2)cc1	ZINC000619291795	460322384	/nfs/dbraw/zinc/32/23/84/460322384.db2.gz	PHZUUPFZDBIJBT-RXVVDRJESA-N	0	3	343.430	3.162	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NC[C@@H]2CCc3ccccc3C2)cc1	ZINC000619291796	460322757	/nfs/dbraw/zinc/32/27/57/460322757.db2.gz	PHZUUPFZDBIJBT-WIYYLYMNSA-N	0	3	343.430	3.162	20	30		EGEDHN
CC1CCN(CCNc2c(C#N)cnc3c(F)ccc(Cl)c32)CC1	ZINC000603857189	460349598	/nfs/dbraw/zinc/34/95/98/460349598.db2.gz	CNQYIFOURPVUSY-UHFFFAOYSA-N	0	3	346.837	3.465	20	30		EGEDHN
C[C@@H](NC[C@H](O)COCc1ccc(Cl)cc1)c1cccc(C#N)c1	ZINC000611388014	460351218	/nfs/dbraw/zinc/35/12/18/460351218.db2.gz	WCGMJPRBQIUDBW-KUHUBIRLSA-N	0	3	344.842	3.440	20	30		EGEDHN
C[C@@H]1CCc2c(C#N)c(NC(=O)CCN3CC=CCC3)sc2C1	ZINC000611517469	460385015	/nfs/dbraw/zinc/38/50/15/460385015.db2.gz	FWVOVIMKZTZMOD-CYBMUJFWSA-N	0	3	329.469	3.335	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)c(Cl)c1)c1ccc(-n2cnnn2)cc1	ZINC000619755554	460431780	/nfs/dbraw/zinc/43/17/80/460431780.db2.gz	ZQYNOOVASFHXGI-GFCCVEGCSA-N	0	3	338.802	3.038	20	30		EGEDHN
CCN1C[C@@H](CN(C)Cc2ccc(CC#N)cc2)Oc2ccccc21	ZINC000612058572	460522971	/nfs/dbraw/zinc/52/29/71/460522971.db2.gz	FNIUWLYJFKQNSF-LJQANCHMSA-N	0	3	335.451	3.472	20	30		EGEDHN
CC[C@H](CC#N)NC(=O)c1ccccc1OCCN1CCCC[C@@H]1C	ZINC000613037134	460809094	/nfs/dbraw/zinc/80/90/94/460809094.db2.gz	HXTHMDAPXDOVJJ-DLBZAZTESA-N	0	3	343.471	3.362	20	30		EGEDHN
CC(C)(C)[C@](C)(C#N)NC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000613365871	460923535	/nfs/dbraw/zinc/92/35/35/460923535.db2.gz	DGIPYYNFEMUWJU-FQEVSTJZSA-N	0	3	327.472	3.343	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN(C)C[C@@H]2CCOC2)cc1OC	ZINC000628187024	461040657	/nfs/dbraw/zinc/04/06/57/461040657.db2.gz	CBJWVNMIJOPNCP-ZDUSSCGKSA-N	0	3	325.836	3.382	20	30		EGEDHN
CCc1ccc(F)cc1C(=O)C(C#N)c1nnc2n1CCCCC2	ZINC000633900667	461320306	/nfs/dbraw/zinc/32/03/06/461320306.db2.gz	SBOVGOALCKEWRI-OAHLLOKOSA-N	0	3	326.375	3.196	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N(C)CCN1CCCCC1	ZINC000649888634	461423503	/nfs/dbraw/zinc/42/35/03/461423503.db2.gz	AKCZROURXKGLRG-KRWDZBQOSA-N	0	3	349.544	3.069	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN(C)CC2CC(O)C2)cc1OC	ZINC000639092252	461723163	/nfs/dbraw/zinc/72/31/63/461723163.db2.gz	YXBCYHBMMJSUCI-UHFFFAOYSA-N	0	3	325.836	3.116	20	30		EGEDHN
C=CCN(Cc1ccc(Cl)s1)C(=O)[C@H]1CNCCC1(F)F	ZINC000643983556	461851333	/nfs/dbraw/zinc/85/13/33/461851333.db2.gz	CGKOZVSOYROVSP-LLVKDONJSA-N	0	3	334.819	3.161	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N1CCCN(Cc2ccccc2C)CC1	ZINC000644297124	461934506	/nfs/dbraw/zinc/93/45/06/461934506.db2.gz	OPSWVBNZWIKZMW-UXHICEINSA-N	0	3	342.483	3.011	20	30		EGEDHN
C=CCN(C[C@@H](O)COc1cccc2ccccc21)[C@H](C)COC	ZINC000661248174	462169581	/nfs/dbraw/zinc/16/95/81/462169581.db2.gz	SVZZDSYKKPJAIC-SJLPKXTDSA-N	0	3	329.440	3.102	20	30		EGEDHN
C=CCN(C(=O)N[C@H](C)[C@H](c1ccccc1C)N(C)C)[C@@H](C)COC	ZINC000664870033	462225521	/nfs/dbraw/zinc/22/55/21/462225521.db2.gz	NXQFYYIBSRWNAN-YQVWRLOYSA-N	0	3	347.503	3.219	20	30		EGEDHN
C=CCN1CCC(NC(=O)Cc2coc3cc(C)c(C)cc23)CC1	ZINC000171722322	526424027	/nfs/dbraw/zinc/42/40/27/526424027.db2.gz	ZSTCPJPUPZBEDB-UHFFFAOYSA-N	0	3	326.440	3.359	20	30		EGEDHN
C=CCN1CCC(NC(=O)Cc2nc(-c3ccsc3)oc2C)CC1	ZINC000171716386	526424424	/nfs/dbraw/zinc/42/44/24/526424424.db2.gz	ZJQHPKBLPOHFDR-UHFFFAOYSA-N	0	3	345.468	3.021	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc3cnn(C(C)C)c3c2)CC1	ZINC000171637474	526441611	/nfs/dbraw/zinc/44/16/11/526441611.db2.gz	UZGOMKUCKGQHOL-UHFFFAOYSA-N	0	3	341.459	3.389	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(C(C)C)nc3onc(C)c32)CC1	ZINC000171721235	526446750	/nfs/dbraw/zinc/44/67/50/526446750.db2.gz	LWLQXGRNSUQIOL-UHFFFAOYSA-N	0	3	342.443	3.035	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc(OCC)c(OC)c2)CC1	ZINC000171581137	526596432	/nfs/dbraw/zinc/59/64/32/526596432.db2.gz	USDYLGNLAAJJRC-UHFFFAOYSA-N	0	3	347.459	3.256	20	30		EGEDHN
C=CCC1(C(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)CCC1	ZINC000189687293	527052335	/nfs/dbraw/zinc/05/23/35/527052335.db2.gz	WATREDZBVDFIKF-INIZCTEOSA-N	0	3	327.472	3.470	20	30		EGEDHN
Cc1cc(C(=O)C(C#N)c2nnc3n2CCCCC3)cc(C)c1F	ZINC000153527630	546880898	/nfs/dbraw/zinc/88/08/98/546880898.db2.gz	SCLNFOOPDYZLCT-CQSZACIVSA-N	0	3	326.375	3.251	20	30		EGEDHN
CCO[C@@H]1C[C@@H](N[C@@H](C)C(=O)NC2(C#N)CCCCC2)C12CCCC2	ZINC000332880915	547523770	/nfs/dbraw/zinc/52/37/70/547523770.db2.gz	LDGMXBSFPLOUDE-GVDBMIGSSA-N	0	3	347.503	3.045	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN2CC[C@](CO)(c3ccccc3)C2)cc1	ZINC000365835901	547778413	/nfs/dbraw/zinc/77/84/13/547778413.db2.gz	GDYRPNHTSZENHO-UWJYYQICSA-N	0	3	336.435	3.113	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N[C@H]1CCC(F)(F)C1)C(C)C	ZINC000675662257	548955280	/nfs/dbraw/zinc/95/52/80/548955280.db2.gz	VPYCNVYBJXDYJA-LSDHHAIUSA-N	0	3	329.435	3.172	20	30		EGEDHN
N#CC(C(=O)c1ccc(N2CCCC2)nn1)c1ccc2ccccc2n1	ZINC000677222685	549232269	/nfs/dbraw/zinc/23/22/69/549232269.db2.gz	YIQMCDVYICYFBN-HNNXBMFYSA-N	0	3	343.390	3.115	20	30		EGEDHN
CCC#C[C@H](C)N(C)C[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000677479678	549277867	/nfs/dbraw/zinc/27/78/67/549277867.db2.gz	LOLQUQJGSXKKKT-UONOGXRCSA-N	0	3	329.362	3.179	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccnc(OC(C)C)c2)CC1	ZINC000681850145	550043255	/nfs/dbraw/zinc/04/32/55/550043255.db2.gz	VTZLEIGRCWNZRU-UHFFFAOYSA-N	0	3	332.448	3.031	20	30		EGEDHN
C#CCCN1CCC(NC(=O)Cc2ccc(CCCC)cc2)CC1	ZINC000740739039	574812606	/nfs/dbraw/zinc/81/26/06/574812606.db2.gz	SVPIGEMDSXWHHT-UHFFFAOYSA-N	0	3	326.484	3.176	20	30		EGEDHN
CCCCNC(=O)[C@@H]1CC[C@H](C)N(Cc2ccc(OCC#N)cc2)C1	ZINC000729268186	574834378	/nfs/dbraw/zinc/83/43/78/574834378.db2.gz	PPPXQBHMJLNGGK-FUHWJXTLSA-N	0	3	343.471	3.106	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)CCc1nc2cc(Cl)ccc2s1	ZINC000730687548	575010528	/nfs/dbraw/zinc/01/05/28/575010528.db2.gz	OWQRJGUEGVOTOY-NSHDSACASA-N	0	3	349.843	3.116	20	30		EGEDHN
CCN(CC)c1ccc(C=[NH+]Cc2cc3c([nH]c2=O)CCC3)c([O-])c1	ZINC000733080978	575305998	/nfs/dbraw/zinc/30/59/98/575305998.db2.gz	IITXNFIDECVDIO-CIAFOILYSA-N	0	3	339.439	3.447	20	30		EGEDHN
C=CCc1cc(OCC)cc(CN2CCN(C3CCC3)CC2)c1O	ZINC000733297287	575325767	/nfs/dbraw/zinc/32/57/67/575325767.db2.gz	LFLJZEUGKPYOMO-UHFFFAOYSA-N	0	3	330.472	3.190	20	30		EGEDHN
C#CCOc1ccc(NC(=O)NCCN2CCCC[C@@H]2CC)cc1	ZINC000733633258	575376286	/nfs/dbraw/zinc/37/62/86/575376286.db2.gz	AVWDFQJKGRCHKE-KRWDZBQOSA-N	0	3	329.444	3.085	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)CCc2csc(C)n2)cc1	ZINC000733678523	575381248	/nfs/dbraw/zinc/38/12/48/575381248.db2.gz	BQOPECXPDVZUBY-MRXNPFEDSA-N	0	3	341.436	3.294	20	30		EGEDHN
C[C@@H]1[C@H](C)SCCN1CC(=O)C(C#N)c1nc2ccccc2s1	ZINC000735673405	575698237	/nfs/dbraw/zinc/69/82/37/575698237.db2.gz	BCALNQMXEOVZQN-FRRDWIJNSA-N	0	3	345.493	3.298	20	30		EGEDHN
N#CC(C(=O)CCc1cc(Cl)cs1)C(=O)NCc1ccccc1	ZINC000737316359	576203634	/nfs/dbraw/zinc/20/36/34/576203634.db2.gz	JKDQZUCMWQESKB-OAHLLOKOSA-N	0	3	346.839	3.359	20	30		EGEDHN
N#CCN(CC(=O)C(C#N)c1nc2ccccc2s1)C1CCCC1	ZINC000738330682	576314723	/nfs/dbraw/zinc/31/47/23/576314723.db2.gz	VAOAJJNDVCSNRO-CQSZACIVSA-N	0	3	338.436	3.241	20	30		EGEDHN
N#Cc1ccc([C@@H](NCc2ccc(C[NH+]3CCCC3)cc2)C(=O)[O-])cc1	ZINC000739106356	576378166	/nfs/dbraw/zinc/37/81/66/576378166.db2.gz	LQDUJQXXTITCTL-HXUWFJFHSA-N	0	3	349.434	3.070	20	30		EGEDHN
CC(C)N(CCC#N)Cn1ccc(=O)c2cccc(Br)c21	ZINC000739841045	576508791	/nfs/dbraw/zinc/50/87/91/576508791.db2.gz	DFHGZHMEQDMEPF-UHFFFAOYSA-N	0	3	348.244	3.346	20	30		EGEDHN
C#CCCN1CCC(NC(=O)CCc2ccc(C(C)C)cc2)CC1	ZINC000740737528	576621707	/nfs/dbraw/zinc/62/17/07/576621707.db2.gz	FGNROXCBIVHUBA-UHFFFAOYSA-N	0	3	326.484	3.347	20	30		EGEDHN
C#CCCN1CCC(NC(=O)[C@@H](C)Oc2ccc(Cl)c(C)c2)CC1	ZINC000740736525	576621799	/nfs/dbraw/zinc/62/17/99/576621799.db2.gz	XSXKJHQFVXENQW-OAHLLOKOSA-N	0	3	348.874	3.020	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2cc(Cl)ccc2OC(C)C)CC1	ZINC000740739025	576622052	/nfs/dbraw/zinc/62/20/52/576622052.db2.gz	SNWRFSLMVJWTEZ-UHFFFAOYSA-N	0	3	348.874	3.345	20	30		EGEDHN
C#CCOc1ccc(CNC[C@H](O)c2c(F)cccc2Cl)cc1	ZINC000741255368	576668953	/nfs/dbraw/zinc/66/89/53/576668953.db2.gz	TVUMDPCMQSDIEF-KRWDZBQOSA-N	0	3	333.790	3.314	20	30		EGEDHN
COc1ccc(CNN=C(C)c2cccc(OCCN(C)C)c2)cc1	ZINC000743531336	576811215	/nfs/dbraw/zinc/81/12/15/576811215.db2.gz	REAWWBHEASJWIB-UHFFFAOYSA-N	0	3	341.455	3.149	20	30		EGEDHN
N#CC(C(=O)NC1CCCCC1)C(=O)[C@H]1C[C@@]12CCc1ccccc12	ZINC000744027152	576819072	/nfs/dbraw/zinc/81/90/72/576819072.db2.gz	KEVLLVPFANWQSJ-YRISNDGFSA-N	0	3	336.435	3.048	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)[C@@H](C)c2ccc(C)o2)cc1	ZINC000744033718	576819297	/nfs/dbraw/zinc/81/92/97/576819297.db2.gz	VRGOLRILXKSZRB-WFASDCNBSA-N	0	3	326.352	3.048	20	30		EGEDHN
COc1ccc(CN(C)CCC(=O)Nc2ccc(C#N)cc2)cc1F	ZINC000026256719	1291270094	/nfs/dbraw/zinc/27/00/94/1291270094.db2.gz	YFPGAZVJLGNAES-UHFFFAOYSA-N	0	3	341.386	3.167	20	30		EGEDHN
COc1ccc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)cc1C#N	ZINC000830413076	1292717816	/nfs/dbraw/zinc/71/78/16/1292717816.db2.gz	FGXUSPJBPOCSAO-STQMWFEESA-N	0	3	342.317	3.253	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)[C@H](C)Cc1ccc(Cl)cc1Cl	ZINC000107409404	1293066414	/nfs/dbraw/zinc/06/64/14/1293066414.db2.gz	AEWDLVLJPMWSER-ZWNOBZJWSA-N	0	3	341.238	3.405	20	30		EGEDHN
C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)C(C#N)C(=O)NC1CC1	ZINC000107409273	1293066427	/nfs/dbraw/zinc/06/64/27/1293066427.db2.gz	WBFLJTFCQXCPEH-NOZJJQNGSA-N	0	3	339.222	3.159	20	30		EGEDHN
CCC[C@H](OC)C(=O)C(C#N)C(=O)Nc1c(CC)cccc1CC	ZINC000835062932	1293196536	/nfs/dbraw/zinc/19/65/36/1293196536.db2.gz	GRNGWMURQJNVOS-HOTGVXAUSA-N	0	3	330.428	3.274	20	30		EGEDHN
Cc1ccc(C(C)C)c(O[C@H](C)C(=O)C(C#N)C(=O)N2CCCC2)c1	ZINC000124815349	1293486302	/nfs/dbraw/zinc/48/63/02/1293486302.db2.gz	XBFJAJVLDVUBTC-NVXWUHKLSA-N	0	3	342.439	3.217	20	30		EGEDHN
C[C@@H](Oc1cccc(C(C)(C)C)c1)C(=O)C(C#N)C(=O)N1CCCC1	ZINC000124839714	1293487022	/nfs/dbraw/zinc/48/70/22/1293487022.db2.gz	XMIULMXVPUWOLY-PBHICJAKSA-N	0	3	342.439	3.083	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)[C@@H](C)Oc2cccc(F)c2)c1	ZINC000127751507	1293572174	/nfs/dbraw/zinc/57/21/74/1293572174.db2.gz	JNZGNUXHIGEUFA-CXAGYDPISA-N	0	3	340.354	3.249	20	30		EGEDHN
Cc1cc(OCC(=O)C(C#N)C(=O)Nc2ccccc2)ccc1Cl	ZINC000128080711	1293582300	/nfs/dbraw/zinc/58/23/00/1293582300.db2.gz	GWWCHEKHELDQCO-HNNXBMFYSA-N	0	3	342.782	3.375	20	30		EGEDHN
Cc1cc2occ(CC(=O)C(C#N)C(=O)NC3CC3)c2cc1C(C)C	ZINC000129153958	1293615204	/nfs/dbraw/zinc/61/52/04/1293615204.db2.gz	FOARWNCMDMZOQO-QGZVFWFLSA-N	0	3	338.407	3.395	20	30		EGEDHN
FC(F)(F)Oc1ccc(C#CCN2CC[C@H]3OCCC[C@@H]3C2)cc1	ZINC000157285899	1294173497	/nfs/dbraw/zinc/17/34/97/1294173497.db2.gz	ZOTSCDHHSHXVAS-NVXWUHKLSA-N	0	3	339.357	3.438	20	30		EGEDHN
Cc1cccc2c(CCC(=O)C(C#N)C(=O)Nc3ccccn3)c[nH]c21	ZINC000174012747	1294477019	/nfs/dbraw/zinc/47/70/19/1294477019.db2.gz	YEXVVUDSDFWHSU-INIZCTEOSA-N	0	3	346.390	3.152	20	30		EGEDHN
COc1ccc(CNCc2cccc(Cn3cccn3)c2)cc1C#N	ZINC000174295711	1294492685	/nfs/dbraw/zinc/49/26/85/1294492685.db2.gz	XPBANELTKXHMHG-UHFFFAOYSA-N	0	3	332.407	3.101	20	30		EGEDHN
C=CCSc1nc2ccccc2n1CN1CC[C@@H](OCCOC)C1	ZINC000188922017	1295487644	/nfs/dbraw/zinc/48/76/44/1295487644.db2.gz	DMXKBVSASVMKCA-OAHLLOKOSA-N	0	3	347.484	3.009	20	30		EGEDHN
N#CC(C(=O)COCc1ccccc1)C(=O)Nc1ccc(Cl)cc1	ZINC000193399910	1295861849	/nfs/dbraw/zinc/86/18/49/1295861849.db2.gz	PNGHBEUYAFQBHY-MRXNPFEDSA-N	0	3	342.782	3.204	20	30		EGEDHN
CCO[C@@H]1C[C@@H]1C(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000193468133	1295873060	/nfs/dbraw/zinc/87/30/60/1295873060.db2.gz	GSKWTXAFTSZAAH-OPQQBVKSSA-N	0	3	341.194	3.066	20	30		EGEDHN
Cc1ccc(CCNCc2cc(C#N)ccc2Br)nc1	ZINC000922171962	1322471755	/nfs/dbraw/zinc/47/17/55/1322471755.db2.gz	OLQDGLYFFUYXPT-UHFFFAOYSA-N	0	3	330.229	3.357	20	30		EGEDHN
N#CC(C(=O)NC1CC1)C(=O)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl	ZINC000245897414	1296329821	/nfs/dbraw/zinc/32/98/21/1296329821.db2.gz	FCKKEHDVOBSJED-UPJWGTAASA-N	0	3	337.206	3.084	20	30		EGEDHN
C#CCN1CCC(C(=O)n2ccc(C)cc2=NC2CCCCC2)CC1	ZINC000255399023	1296530893	/nfs/dbraw/zinc/53/08/93/1296530893.db2.gz	XFLLMLRQYUMUQW-UHFFFAOYSA-N	0	3	339.483	3.015	20	30		EGEDHN
C[C@@H](NCCC(C)(C)C#N)c1cc(F)ccc1N1CCC(O)CC1	ZINC000305769568	1297047410	/nfs/dbraw/zinc/04/74/10/1297047410.db2.gz	GRNUTTLWNPRGFU-CQSZACIVSA-N	0	3	333.451	3.377	20	30		EGEDHN
Cc1ccc([N+](=O)[O-])c(C)c1CNCc1ccc(OCC#N)cc1	ZINC000873045824	1297244833	/nfs/dbraw/zinc/24/48/33/1297244833.db2.gz	LYBQEAUXKBDZMJ-UHFFFAOYSA-N	0	3	325.368	3.404	20	30		EGEDHN
C[C@@H](N[C@@H](C)c1ccc2[nH]c(=O)[nH]c2c1)c1ccc(OCC#N)cc1	ZINC000327355973	1297248029	/nfs/dbraw/zinc/24/80/29/1297248029.db2.gz	GNTFEMAZEJVMGA-OLZOCXBDSA-N	0	3	336.395	3.170	20	30		EGEDHN
COc1cccc(O)c1/C=N/C1CCN([C@H](C)c2ccncc2)CC1	ZINC000747689928	1298833140	/nfs/dbraw/zinc/83/31/40/1298833140.db2.gz	BBUOAAOCQOWJJF-QQHUYRGFSA-N	0	3	339.439	3.440	20	30		EGEDHN
C=C(Cl)C[C@@H](N)C(=O)N1CCC[C@@H]1c1nc2cc(C)ccc2[nH]1	ZINC000876875800	1299046549	/nfs/dbraw/zinc/04/65/49/1299046549.db2.gz	AZGYFAFCQXNTAZ-IUODEOHRSA-N	0	3	332.835	3.005	20	30		EGEDHN
S=C(NN=C1CCCC[C@@H]1N1CCCCC1)Nc1cccnc1	ZINC000748782149	1299078614	/nfs/dbraw/zinc/07/86/14/1299078614.db2.gz	JOJNYHJXIVTNSN-INIZCTEOSA-N	0	3	331.489	3.153	20	30		EGEDHN
C=CCc1cc(CNCc2ccc(CO)cc2)cc(OC)c1OC	ZINC000877022057	1299115649	/nfs/dbraw/zinc/11/56/49/1299115649.db2.gz	NTCCEXNVKKOICA-UHFFFAOYSA-N	0	3	327.424	3.214	20	30		EGEDHN
C=CC(C)(C)CNCc1cc(C2CN(C(=O)OC(C)(C)C)C2)no1	ZINC000877566222	1299403496	/nfs/dbraw/zinc/40/34/96/1299403496.db2.gz	WPWLYKDLJWOTBH-UHFFFAOYSA-N	0	3	335.448	3.311	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNCc1cccc(C#N)n1	ZINC000877571217	1299405826	/nfs/dbraw/zinc/40/58/26/1299405826.db2.gz	YXOJDWBCAGSIFN-KRWDZBQOSA-N	0	3	344.459	3.223	20	30		EGEDHN
C#CCOc1cccc(NC(=O)N(CCN(C)C)C2CCCC2)c1	ZINC000751886921	1299643978	/nfs/dbraw/zinc/64/39/78/1299643978.db2.gz	JLHUJZANRUJMTF-UHFFFAOYSA-N	0	3	329.444	3.037	20	30		EGEDHN
CO[C@@H]1C[C@H](N[C@@H](C)C(=O)N(CCC#N)c2ccc(C)cc2)C1(C)C	ZINC000753159070	1299885803	/nfs/dbraw/zinc/88/58/03/1299885803.db2.gz	WUBDAANOQIZNCN-RYQLBKOJSA-N	0	3	343.471	3.033	20	30		EGEDHN
C[C@H](NCC(=O)N(CCC#N)CCC#N)c1csc2ccccc21	ZINC000754737111	1300206157	/nfs/dbraw/zinc/20/61/57/1300206157.db2.gz	MUUVLRCKSROKOH-AWEZNQCLSA-N	0	3	340.452	3.208	20	30		EGEDHN
C=CC(C)(C)CC(=O)Nc1cccc2c1CCN(CC(C)(C)O)C2	ZINC000879453521	1300546016	/nfs/dbraw/zinc/54/60/16/1300546016.db2.gz	IXZCMODJLFIJFD-UHFFFAOYSA-N	0	3	330.472	3.356	20	30		EGEDHN
C#CC[C@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1	ZINC000757059184	1300626462	/nfs/dbraw/zinc/62/64/62/1300626462.db2.gz	NNRFFSALZGUZES-RTWAWAEBSA-N	0	3	347.462	3.325	20	30		EGEDHN
Cc1ccn(CNC2(c3ccc(F)cc3)CCCC2)c(=O)c1C#N	ZINC000758196405	1300809913	/nfs/dbraw/zinc/80/99/13/1300809913.db2.gz	ZGGZUONLRUWLIH-UHFFFAOYSA-N	0	3	325.387	3.184	20	30		EGEDHN
C#CCCN[C@H](c1ccc(CC)cc1)c1cccc(S(C)(=O)=O)c1	ZINC000760296705	1301249033	/nfs/dbraw/zinc/24/90/33/1301249033.db2.gz	RWPMNIXVYXPDSP-HXUWFJFHSA-N	0	3	341.476	3.355	20	30		EGEDHN
CCO[C@H](CC(=O)C(C#N)C(=O)Nc1ccccc1Cl)C(C)C	ZINC000761038023	1301385961	/nfs/dbraw/zinc/38/59/61/1301385961.db2.gz	PXNIFHWBAWDKDB-BLLLJJGKSA-N	0	3	336.819	3.439	20	30		EGEDHN
C=CCN1CCC(Nc2nccc(Oc3cccc(C#N)c3)n2)CC1	ZINC000881947737	1301765011	/nfs/dbraw/zinc/76/50/11/1301765011.db2.gz	UREGVYLQVSUYCG-UHFFFAOYSA-N	0	3	335.411	3.203	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN[C@@H]2CCOc3c(Cl)cccc32)cc1	ZINC000763235227	1301854096	/nfs/dbraw/zinc/85/40/96/1301854096.db2.gz	JMSDTQDKFHFWBN-SJORKVTESA-N	0	3	328.799	3.358	20	30		EGEDHN
CC[C@H](C)c1ccc(NC(=O)C(C#N)C(=O)[C@H]2C[C@]23CCOC3)cc1	ZINC000764755341	1302127701	/nfs/dbraw/zinc/12/77/01/1302127701.db2.gz	FDTKOYJSHXYWAW-ITSWUFQBSA-N	0	3	340.423	3.274	20	30		EGEDHN
C#CCOc1ccc(CNCc2cccc(C3(C)OCCO3)c2)cc1	ZINC000883127632	1302264250	/nfs/dbraw/zinc/26/42/50/1302264250.db2.gz	AVNBTYDLOFZPEI-UHFFFAOYSA-N	0	3	337.419	3.208	20	30		EGEDHN
C[C@H](NCc1ccc(N2CCNC2=O)cc1)c1ccc(C#N)c(F)c1	ZINC000883286483	1302366545	/nfs/dbraw/zinc/36/65/45/1302366545.db2.gz	UXAGDXUOYOHAGD-ZDUSSCGKSA-N	0	3	338.386	3.078	20	30		EGEDHN
Cc1nn(Cc2ccccc2)c(C)c1C=NOCCN1CCCCC1	ZINC000766712412	1302505250	/nfs/dbraw/zinc/50/52/50/1302505250.db2.gz	NOMLDKIZCGOUOF-UHFFFAOYSA-N	0	3	340.471	3.385	20	30		EGEDHN
Cc1cc(CN[C@H]2CCCN(Cc3ccccc3)C2=O)ccc1C#N	ZINC000767684091	1302744517	/nfs/dbraw/zinc/74/45/17/1302744517.db2.gz	MGWWNMQXIAGASN-FQEVSTJZSA-N	0	3	333.435	3.148	20	30		EGEDHN
CSC[C@@H]1CCCN1CC(=O)C(C#N)c1nc2ccccc2s1	ZINC000767905507	1302780708	/nfs/dbraw/zinc/78/07/08/1302780708.db2.gz	HJXKHEDSDRKHDU-QWHCGFSZSA-N	0	3	345.493	3.300	20	30		EGEDHN
C#CCCOc1ccc(CN(C)Cc2ccc3c(c2)OCCO3)cc1	ZINC000768184704	1302846731	/nfs/dbraw/zinc/84/67/31/1302846731.db2.gz	TYBHPMDBIYGROU-UHFFFAOYSA-N	0	3	337.419	3.492	20	30		EGEDHN
C#C[C@H](C)N(C)C[C@H](O)CO[C@@H](c1ccccc1)c1ccccc1C	ZINC000769976337	1303201016	/nfs/dbraw/zinc/20/10/16/1303201016.db2.gz	ZJHLITDHNDZIQV-VCOUNFBDSA-N	0	3	337.463	3.415	20	30		EGEDHN
C=CCC1(O)CCN(Cc2ccc(OC[C@H]3CCCO3)cc2)CC1	ZINC000886776282	1303594862	/nfs/dbraw/zinc/59/48/62/1303594862.db2.gz	BIMVVNJJGLEXNU-LJQANCHMSA-N	0	3	331.456	3.147	20	30		EGEDHN
C=C(Cl)COc1ccc([C@@H](C)N[C@H]2CC(=O)N(C(C)C)C2)cc1	ZINC000773008630	1303606027	/nfs/dbraw/zinc/60/60/27/1303606027.db2.gz	WNCYHUDSMHXHCF-ZBFHGGJFSA-N	0	3	336.863	3.478	20	30		EGEDHN
C[C@H](N[C@@H](C)c1ccc(N(C)C)cc1)C(=O)NC1(C#N)CCCCC1	ZINC000774484672	1303816601	/nfs/dbraw/zinc/81/66/01/1303816601.db2.gz	PLONEHHHXBYHOE-HOTGVXAUSA-N	0	3	342.487	3.134	20	30		EGEDHN
Cc1cc(CN2CCC[C@@H](C(=O)Nc3ccccn3)C2)ccc1C#N	ZINC000774834763	1303865927	/nfs/dbraw/zinc/86/59/27/1303865927.db2.gz	XYZGOWIDKVFSFC-GOSISDBHSA-N	0	3	334.423	3.112	20	30		EGEDHN
C#CC[C@H](NC[C@@H](O)COc1ccccc1Cl)c1ccccc1	ZINC000775401139	1303957396	/nfs/dbraw/zinc/95/73/96/1303957396.db2.gz	RAPMZAUHJWFQDI-AEFFLSMTSA-N	0	3	329.827	3.434	20	30		EGEDHN
C#CC[C@@H](NC[C@@H](O)COc1ccccc1Cl)c1ccccc1	ZINC000775401141	1303957453	/nfs/dbraw/zinc/95/74/53/1303957453.db2.gz	RAPMZAUHJWFQDI-SJLPKXTDSA-N	0	3	329.827	3.434	20	30		EGEDHN
C#C[C@H](N[C@H](CC)CSc1ccccc1[N+](=O)[O-])[C@H]1CCCO1	ZINC000775571754	1303987251	/nfs/dbraw/zinc/98/72/51/1303987251.db2.gz	KYOXFTZKFGFKJG-IJEWVQPXSA-N	0	3	334.441	3.236	20	30		EGEDHN
CC[C@@H](C#N)Oc1cccc(CNCc2ccc(C(=O)OC)cc2)c1	ZINC000776185983	1304108667	/nfs/dbraw/zinc/10/86/67/1304108667.db2.gz	RMDSFWDKTHGLMH-SFHVURJKSA-N	0	3	338.407	3.444	20	30		EGEDHN
C#CCN(C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCc2ccccc21	ZINC000776580095	1304174125	/nfs/dbraw/zinc/17/41/25/1304174125.db2.gz	QZYWNPCQTJIRGL-WOJBJXKFSA-N	0	3	336.391	3.251	20	30		EGEDHN
C=CCCOCC(=O)N(CCC)C1CCN(Cc2ccccc2)CC1	ZINC000889490915	1304501773	/nfs/dbraw/zinc/50/17/73/1304501773.db2.gz	MEKRZQSPVWKARR-UHFFFAOYSA-N	0	3	344.499	3.482	20	30		EGEDHN
C#CCOc1ccc(CNC2(C(=O)NCCC)CCCCC2)cc1	ZINC000779169029	1304538414	/nfs/dbraw/zinc/53/84/14/1304538414.db2.gz	LJTMSPGDZUEXDA-UHFFFAOYSA-N	0	3	328.456	3.017	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)[C@@H]2[C@H]3CCCO[C@H]32)cc1	ZINC000780304852	1304674926	/nfs/dbraw/zinc/67/49/26/1304674926.db2.gz	BHIYCPUYNFJKOU-VXIBKDFQSA-N	0	3	340.423	3.102	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C	ZINC000891248319	1304999676	/nfs/dbraw/zinc/99/96/76/1304999676.db2.gz	KODTWBVLLOAQOP-LJQANCHMSA-N	0	3	329.488	3.055	20	30		EGEDHN
N#Cc1ccc(F)c(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)c1	ZINC000891454925	1305054702	/nfs/dbraw/zinc/05/47/02/1305054702.db2.gz	SVYZAYIQDWONHS-GHMZBOCLSA-N	0	3	330.281	3.383	20	30		EGEDHN
N#CC(C(=O)Nc1cccc2ccccc21)C(=O)[C@@H]1OC[C@@H]2CCC[C@@H]21	ZINC000892490286	1305402925	/nfs/dbraw/zinc/40/29/25/1305402925.db2.gz	RTXSDCDVFUCDLD-UJAMICLKSA-N	0	3	348.402	3.302	20	30		EGEDHN
Cc1cccc(CNC(=O)C(C#N)C(=O)CCCc2cccs2)c1	ZINC000786551482	1305596814	/nfs/dbraw/zinc/59/68/14/1305596814.db2.gz	YNHNCNSXUFTWIO-QGZVFWFLSA-N	0	3	340.448	3.405	20	30		EGEDHN
C#C[C@@H](NC1CC(c2ccc(Br)cc2)C1)[C@H]1CCCO1	ZINC000786921321	1305658556	/nfs/dbraw/zinc/65/85/56/1305658556.db2.gz	XNQFSWLJGZLRJG-OKEQZYBDSA-N	0	3	334.257	3.466	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)[C@H]3CC(=O)c4ccccc43)nc21	ZINC000789376514	1306149979	/nfs/dbraw/zinc/14/99/79/1306149979.db2.gz	AAEULFWGKQQGBI-LSDHHAIUSA-N	0	3	329.359	3.418	20	30		EGEDHN
Cc1cccc2nc(C(C#N)C(=O)[C@H]3CC(=O)c4ccccc43)[nH]c21	ZINC000789376514	1306149983	/nfs/dbraw/zinc/14/99/83/1306149983.db2.gz	AAEULFWGKQQGBI-LSDHHAIUSA-N	0	3	329.359	3.418	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)c(F)c1)c1ccc(N2CCOCC2)cc1	ZINC000792275878	1309154286	/nfs/dbraw/zinc/15/42/86/1309154286.db2.gz	FDRZAWDXPFTZHF-HNNXBMFYSA-N	0	3	339.414	3.385	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)C1CC(c2ccc(F)cc2)C1	ZINC000796739729	1310077188	/nfs/dbraw/zinc/07/71/88/1310077188.db2.gz	FDDHFGSKPMATIG-VMBOVVBDSA-N	0	3	330.403	3.335	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)[C@@H]1CCC(F)(F)C1)c1ccccc1	ZINC000796894861	1310106816	/nfs/dbraw/zinc/10/68/16/1310106816.db2.gz	ZMJHAEZPVROUMZ-ILXRZTDVSA-N	0	3	334.366	3.398	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)c1ccoc1CC	ZINC000797548616	1310209711	/nfs/dbraw/zinc/20/97/11/1310209711.db2.gz	JKDQAVSZAWQOIT-ZDUSSCGKSA-N	0	3	326.352	3.202	20	30		EGEDHN
C=CC[C@@H](CC)NC(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000798375519	1310348915	/nfs/dbraw/zinc/34/89/15/1310348915.db2.gz	JQQXPHADQZTSCS-QGZVFWFLSA-N	0	3	331.529	3.470	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1C#N	ZINC000799303991	1310520611	/nfs/dbraw/zinc/52/06/11/1310520611.db2.gz	QAWCMFNHRKLDFU-FQEVSTJZSA-N	0	3	333.435	3.434	20	30		EGEDHN
COc1cc(CNC[C@@H](O)c2c(F)cccc2Cl)ccc1C#N	ZINC000799338300	1310528830	/nfs/dbraw/zinc/52/88/30/1310528830.db2.gz	JQEZUNKQLAOSAC-OAHLLOKOSA-N	0	3	334.778	3.183	20	30		EGEDHN
Cc1ccc(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)cc1C#N	ZINC000799676113	1310598673	/nfs/dbraw/zinc/59/86/73/1310598673.db2.gz	TYPMABXLELTMQR-UHFFFAOYSA-N	0	3	349.434	3.076	20	30		EGEDHN
C[C@H](N[C@@H]1CC[C@H](C#N)C1)c1cc(F)ccc1N1CCC(O)CC1	ZINC000799717691	1310604998	/nfs/dbraw/zinc/60/49/98/1310604998.db2.gz	SSAXGCYIEOXYKD-OFQRWUPVSA-N	0	3	331.435	3.130	20	30		EGEDHN
C=CCOc1ccc(CNCc2ccc(CCO)cc2)cc1OC	ZINC000898172786	1310613352	/nfs/dbraw/zinc/61/33/52/1310613352.db2.gz	ZMWMJFGEGOVXKM-UHFFFAOYSA-N	0	3	327.424	3.085	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)[C@H]2CCCC(F)(F)C2)cc1	ZINC000800385321	1310747162	/nfs/dbraw/zinc/74/71/62/1310747162.db2.gz	ACIQLJNPPZYOAM-SMDDNHRTSA-N	0	3	336.338	3.168	20	30		EGEDHN
C=C1CCC(C(=O)NCC2CCN(Cc3ccncc3)CC2)CC1	ZINC000898673487	1310820780	/nfs/dbraw/zinc/82/07/80/1310820780.db2.gz	RQTQYDXODXACPW-UHFFFAOYSA-N	0	3	327.472	3.156	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N2C[C@H](N(C)C)Cc3ccccc32)cc1	ZINC000823222490	1320162938	/nfs/dbraw/zinc/16/29/38/1320162938.db2.gz	LNFVJCFCKBFGRF-LJQANCHMSA-N	0	3	348.446	3.222	20	30		EGEDHN
C#Cc1cccc(CNC(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)c1	ZINC000836249315	1320464358	/nfs/dbraw/zinc/46/43/58/1320464358.db2.gz	IUHVWVCRWUMTJJ-LAUBAEHRSA-N	0	3	347.462	3.303	20	30		EGEDHN
C[C@@H](C#N)OCCN1CC[C@H](Oc2ccc(Cl)c(Cl)c2)C1	ZINC000801927133	1316967192	/nfs/dbraw/zinc/96/71/92/1316967192.db2.gz	IGQLSGQGCSHNEO-AAEUAGOBSA-N	0	3	329.227	3.375	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)c1cc(C)cc(C)n1	ZINC000802040652	1316975754	/nfs/dbraw/zinc/97/57/54/1316975754.db2.gz	IYFZSZDCMTWDJV-CQSZACIVSA-N	0	3	337.379	3.058	20	30		EGEDHN
CC(C)(C)[C@@H]1C[C@H]1C(=O)N1CC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001019132221	1317064443	/nfs/dbraw/zinc/06/44/43/1317064443.db2.gz	MGDFNPNOXJZSIG-GVDBMIGSSA-N	0	3	343.446	3.070	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](NCc2cc(C)ccc2OC)C1	ZINC001019232385	1317116111	/nfs/dbraw/zinc/11/61/11/1317116111.db2.gz	YMORFQJHVKTVMQ-KRWDZBQOSA-N	0	3	330.472	3.296	20	30		EGEDHN
C=CCNC(=S)N(CCC)C1CCN(Cc2ccccc2)CC1	ZINC000899660743	1317127793	/nfs/dbraw/zinc/12/77/93/1317127793.db2.gz	YQDKRIGZECXORB-UHFFFAOYSA-N	0	3	331.529	3.424	20	30		EGEDHN
C=CCOc1c(Cl)cc(CNC[C@H](O)c2ccco2)cc1OC	ZINC000858092346	1328680322	/nfs/dbraw/zinc/68/03/22/1328680322.db2.gz	CRBZVGXENKMQAW-AWEZNQCLSA-N	0	3	337.803	3.330	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3ccc(C)nc3C)C2)CC1	ZINC001019331131	1317172387	/nfs/dbraw/zinc/17/23/87/1317172387.db2.gz	KBRXNBLYBQPSMV-IBGZPJMESA-N	0	3	327.472	3.135	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC2(CCN(C/C(Cl)=C/Cl)CC2)CC1	ZINC000957520086	1317421459	/nfs/dbraw/zinc/42/14/59/1317421459.db2.gz	NXENMCVEYAYKMH-JFBXQDQPSA-N	0	3	344.286	3.170	20	30		EGEDHN
Cc1cccc(C(=O)N[C@H]2C[C@H](NCc3ccc(C#N)cc3F)C2)c1	ZINC001019963720	1317478940	/nfs/dbraw/zinc/47/89/40/1317478940.db2.gz	KNMZCJBZGMATLB-IYARVYRRSA-N	0	3	337.398	3.056	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@H](NC(=O)C=C3CCCCC3)C2)c1	ZINC001020015179	1317501716	/nfs/dbraw/zinc/50/17/16/1317501716.db2.gz	RXYLIKBFOQWRBR-IYARVYRRSA-N	0	3	341.430	3.325	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H](CN2CCCCC2)c2ccccc2)c1	ZINC000806922881	1317537622	/nfs/dbraw/zinc/53/76/22/1317537622.db2.gz	VIEYGCVGEMEQOA-HXUWFJFHSA-N	0	3	333.435	3.020	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)c2ccc3occc3c2)C1	ZINC001020182320	1317577689	/nfs/dbraw/zinc/57/76/89/1317577689.db2.gz	NKCFHCMNQCNXSD-HDJSIYSDSA-N	0	3	349.228	3.192	20	30		EGEDHN
CC[C@@H](NCc1ccc(CS(C)(=O)=O)cc1)c1cccc(C#N)c1	ZINC000902756499	1317612317	/nfs/dbraw/zinc/61/23/17/1317612317.db2.gz	HNACXCQNKXLNRG-LJQANCHMSA-N	0	3	342.464	3.344	20	30		EGEDHN
CC[C@H](N[C@@H]1CCN(c2ccccc2OC)C1=O)c1cccc(C#N)c1	ZINC000902879436	1317625828	/nfs/dbraw/zinc/62/58/28/1317625828.db2.gz	VKNASSNPAQQELM-ZWKOTPCHSA-N	0	3	349.434	3.413	20	30		EGEDHN
C#C[C@H](NC(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1)C(C)(C)C	ZINC000808243807	1317649666	/nfs/dbraw/zinc/64/96/66/1317649666.db2.gz	PPASRAYBUIJHMV-NJAFHUGGSA-N	0	3	327.472	3.169	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2sc(C)nc2CC(C)C)C1	ZINC001020357011	1317658805	/nfs/dbraw/zinc/65/88/05/1317658805.db2.gz	LIMJSCKPWATRNE-JOCQHMNTSA-N	0	3	341.908	3.253	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)CC1	ZINC001020550100	1317761840	/nfs/dbraw/zinc/76/18/40/1317761840.db2.gz	HUWNLARFPQEGNI-IYARVYRRSA-N	0	3	341.430	3.181	20	30		EGEDHN
CC[C@@H]1CCC[C@@H]1C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001020554165	1317767419	/nfs/dbraw/zinc/76/74/19/1317767419.db2.gz	LWIBKEWZPXYWBJ-DDBAPUKQSA-N	0	3	343.446	3.260	20	30		EGEDHN
C[C@H]1CCC[C@@]1(C)C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001020555778	1317769542	/nfs/dbraw/zinc/76/95/42/1317769542.db2.gz	RGWAZDZRVZWEDY-VZYKRBATSA-N	0	3	343.446	3.260	20	30		EGEDHN
C#C[C@H]([NH2+]Cc1cc(Br)cc(OC)c1[O-])C(C)(C)C	ZINC000809781310	1317899918	/nfs/dbraw/zinc/89/99/18/1317899918.db2.gz	ORBLIQGRSIRTIQ-ZDUSSCGKSA-N	0	3	326.234	3.301	20	30		EGEDHN
COc1ccc(/C=C2/C(=O)c3ncnn3C2C)cc1OCC(C)C	ZINC000905081275	1317921804	/nfs/dbraw/zinc/92/18/04/1317921804.db2.gz	QQVUXGQDWFMJRK-CWZJEYLYSA-N	0	3	327.384	3.162	20	30		EGEDHN
CCCCOc1cc(/C=C2/C(=O)c3ncnn3C2C)ccc1OC	ZINC000905081213	1317921825	/nfs/dbraw/zinc/92/18/25/1317921825.db2.gz	PYJHZKFEQOHTGN-IGVUGNCQSA-N	0	3	327.384	3.307	20	30		EGEDHN
COc1cc(C#N)ccc1C(=O)N1c2ccccc2CC[C@H]1CN(C)C	ZINC000905729907	1317986213	/nfs/dbraw/zinc/98/62/13/1317986213.db2.gz	WAKPRHBXSOECDY-KRWDZBQOSA-N	0	3	349.434	3.090	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)Cc2cccc(OCCC)c2)C1	ZINC001020898148	1317988999	/nfs/dbraw/zinc/98/89/99/1317988999.db2.gz	JVCDYHHRMFGTQU-WKILWMFISA-N	0	3	336.863	3.007	20	30		EGEDHN
CC[C@H](C)c1ccc(NC(=O)C(C#N)C(=O)c2cccc(C#N)n2)cc1	ZINC000810532365	1318019128	/nfs/dbraw/zinc/01/91/28/1318019128.db2.gz	CZPDDJLTHFBGAN-GUYCJALGSA-N	0	3	346.390	3.428	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@H](CCCN3C(=O)CC3CC3)C2)cc1	ZINC001021497320	1318305075	/nfs/dbraw/zinc/30/50/75/1318305075.db2.gz	XAQOFMBHQSTKOE-UXHICEINSA-N	0	3	337.467	3.171	20	30		EGEDHN
C[C@@H]1[C@@H](NC(=O)c2ccsc2C#N)CCN1Cc1ccccc1	ZINC000908230725	1318316223	/nfs/dbraw/zinc/31/62/23/1318316223.db2.gz	SXXMNKCXNHUOQF-CJNGLKHVSA-N	0	3	325.437	3.013	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@H](CCCN3C(=O)c3ccco3)C2)c1	ZINC001021507418	1318324635	/nfs/dbraw/zinc/32/46/35/1318324635.db2.gz	YTYKKWQDXIEBFG-RTBURBONSA-N	0	3	349.434	3.278	20	30		EGEDHN
C#C[C@H](CCC)NC(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000812380516	1318379540	/nfs/dbraw/zinc/37/95/40/1318379540.db2.gz	GBAFZJGCBYWMQY-IEBWSBKVSA-N	0	3	345.487	3.178	20	30		EGEDHN
C#C[C@@H](C)N(C)C(=O)NC[C@H](c1ccc(CC(C)C)cc1)N(C)C	ZINC000812390266	1318380905	/nfs/dbraw/zinc/38/09/05/1318380905.db2.gz	ZFUXCZKTRCSCFA-VQIMIIECSA-N	0	3	329.488	3.151	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@@H](CCCN3C(=O)C3=CCCC3)C2)cc1	ZINC001021561646	1318410126	/nfs/dbraw/zinc/41/01/26/1318410126.db2.gz	FPJPXEKONOQEFU-LEWJYISDSA-N	0	3	349.478	3.481	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@H]2CN(Cc3ccccc3F)CC[C@@H]21	ZINC001021581708	1318425510	/nfs/dbraw/zinc/42/55/10/1318425510.db2.gz	RBDGUOYTENKSBK-ICSRJNTNSA-N	0	3	340.442	3.052	20	30		EGEDHN
C[C@](NCCCCC1(C#N)CCC1)(C(N)=O)c1cccc(Cl)c1	ZINC000930018513	1328765770	/nfs/dbraw/zinc/76/57/70/1328765770.db2.gz	NXCRIVJAZFZJBF-QGZVFWFLSA-N	0	3	333.863	3.494	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc2oc(C)nc2c1	ZINC000960277742	1318440844	/nfs/dbraw/zinc/44/08/44/1318440844.db2.gz	FSJVJKKGKRBMMJ-UYAOXDASSA-N	0	3	347.418	3.308	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc(OC)cc1F	ZINC000960280703	1318442722	/nfs/dbraw/zinc/44/27/22/1318442722.db2.gz	INAIFZXTYKVVEY-RTBURBONSA-N	0	3	340.398	3.006	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cccc2c1O[C@H](C)C2	ZINC000960286538	1318445236	/nfs/dbraw/zinc/44/52/36/1318445236.db2.gz	AUNIVPLVZKDZOU-JSNMRZPZSA-N	0	3	348.446	3.181	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(C(C)C)nc2)C1	ZINC001021602780	1318446173	/nfs/dbraw/zinc/44/61/73/1318446173.db2.gz	JBIPFACEMPRBDN-QUCCMNQESA-N	0	3	339.483	3.155	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ncc(C)cc1C	ZINC000960290636	1318446565	/nfs/dbraw/zinc/44/65/65/1318446565.db2.gz	HXSOUZUPXWBAKK-UYAOXDASSA-N	0	3	335.451	3.260	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc(OC)cs1	ZINC000960292986	1318448350	/nfs/dbraw/zinc/44/83/50/1318448350.db2.gz	MPTRFDSGSDGZEA-SJLPKXTDSA-N	0	3	342.464	3.318	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@@H]1CCCCC1(F)F	ZINC000960296416	1318448972	/nfs/dbraw/zinc/44/89/72/1318448972.db2.gz	OJOBLCMOHCFODD-GVDBMIGSSA-N	0	3	334.410	3.370	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)Cc1ccsc1C	ZINC000960309609	1318454028	/nfs/dbraw/zinc/45/40/28/1318454028.db2.gz	DASXBBVXLSVHEX-IEBWSBKVSA-N	0	3	326.465	3.157	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)C2C3CC4CC(C3)CC2C4)C1	ZINC001021607033	1318454129	/nfs/dbraw/zinc/45/41/29/1318454129.db2.gz	TYAUKTZMPTZSOK-VXHMAKRFSA-N	0	3	340.511	3.005	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cccc2cnccc21	ZINC000960329669	1318464488	/nfs/dbraw/zinc/46/44/88/1318464488.db2.gz	NAWNLSUILLYVGP-NHCUHLMSSA-N	0	3	343.430	3.406	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2coc3cc(F)ccc32)C1	ZINC001021619376	1318468894	/nfs/dbraw/zinc/46/88/94/1318468894.db2.gz	KSVKASSQIUEIFU-KSSFIOAISA-N	0	3	340.398	3.132	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cn(CC)c3ccccc23)C1	ZINC001021628010	1318480861	/nfs/dbraw/zinc/48/08/61/1318480861.db2.gz	RRKMHOKZDIVNHQ-FXAWDEMLSA-N	0	3	349.478	3.221	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(Cl)cc2F)C1	ZINC001021627631	1318480891	/nfs/dbraw/zinc/48/08/91/1318480891.db2.gz	OMCRZGBQQMKGCR-GUYCJALGSA-N	0	3	334.822	3.039	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)CCc2ccc(Cl)cc2)C1	ZINC001021638546	1318494790	/nfs/dbraw/zinc/49/47/90/1318494790.db2.gz	FWYHYXTYFOJYHZ-HKUYNNGSSA-N	0	3	344.886	3.219	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(C(C)C)cn2)C1	ZINC001021667529	1318531122	/nfs/dbraw/zinc/53/11/22/1318531122.db2.gz	INOSQJGSLONDCB-UYAOXDASSA-N	0	3	339.483	3.155	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)CC(C)(C)C	ZINC000960428430	1318551664	/nfs/dbraw/zinc/55/16/64/1318551664.db2.gz	NYLJILCXPJWLPM-SFHVURJKSA-N	0	3	327.472	3.417	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(C(C)C)oc2C)C1	ZINC001021703639	1318574064	/nfs/dbraw/zinc/57/40/64/1318574064.db2.gz	ANXNKANGZBIXCQ-FUHWJXTLSA-N	0	3	328.456	3.271	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cccc3ccncc32)C1	ZINC001021705450	1318576205	/nfs/dbraw/zinc/57/62/05/1318576205.db2.gz	DDSOVPQYTBIOSU-GHTZIAJQSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)CCc2cc(C)cc(C)c2)C1	ZINC001021708547	1318584187	/nfs/dbraw/zinc/58/41/87/1318584187.db2.gz	FIXDZINOESYPAU-SFTDATJTSA-N	0	3	338.495	3.182	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccoc2CCC)C1	ZINC001021714580	1318593312	/nfs/dbraw/zinc/59/33/12/1318593312.db2.gz	XOMCOVLYMJFLJH-WMZOPIPTSA-N	0	3	328.456	3.182	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(CC(C)C)c[nH]2)C1	ZINC001021718467	1318599457	/nfs/dbraw/zinc/59/94/57/1318599457.db2.gz	YAKWSTHBVOQLMT-AZUAARDMSA-N	0	3	341.499	3.163	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)Cc2c[nH]c3ccccc23)C1	ZINC001021722507	1318610741	/nfs/dbraw/zinc/61/07/41/1318610741.db2.gz	OICMMVQHLVWDCU-UWJYYQICSA-N	0	3	349.478	3.047	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@@H]1CN(C)Cc1cccc(C(F)F)c1	ZINC000960506387	1318615818	/nfs/dbraw/zinc/61/58/18/1318615818.db2.gz	ZDIKVNSBUICWBS-CZUORRHYSA-N	0	3	335.398	3.207	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(F)cc2Cl)C1	ZINC001021727215	1318623911	/nfs/dbraw/zinc/62/39/11/1318623911.db2.gz	KKPANVBGWDYBPL-KSSFIOAISA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2ccc3ccccc3c2)C1	ZINC001021730714	1318631910	/nfs/dbraw/zinc/63/19/10/1318631910.db2.gz	PWTMFHVNSWXPQZ-FCHUYYIVSA-N	0	3	346.474	3.328	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc3cccc(F)c3o2)C1	ZINC001021740977	1318650010	/nfs/dbraw/zinc/65/00/10/1318650010.db2.gz	XTUNATGCWFYFMA-DOTOQJQBSA-N	0	3	340.398	3.132	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc3cc(C)ccc3o2)C1	ZINC001021742353	1318655999	/nfs/dbraw/zinc/65/59/99/1318655999.db2.gz	KGCMPKLJECJCDS-AEFFLSMTSA-N	0	3	336.435	3.301	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)C23CC(C(C)(C)C)(C2)C3)C1	ZINC001021746172	1318661855	/nfs/dbraw/zinc/66/18/55/1318661855.db2.gz	IYMHWOYCBHPBCF-FBIZOPLVSA-N	0	3	328.500	3.149	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)C1CC(C)(C)C1	ZINC000960607592	1318732854	/nfs/dbraw/zinc/73/28/54/1318732854.db2.gz	KPOCCLIFSQTNDP-LJQANCHMSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1	ZINC000911632636	1318754320	/nfs/dbraw/zinc/75/43/20/1318754320.db2.gz	IFGULROVXBCWFD-LJQANCHMSA-N	0	3	329.488	3.319	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)N1CCC[C@H](c2nc(C)no2)C1	ZINC000911643660	1318755487	/nfs/dbraw/zinc/75/54/87/1318755487.db2.gz	VHHAZGUKBJKSEH-JKSUJKDBSA-N	0	3	336.480	3.162	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N1CCC(CCc2ccc(O)cc2)CC1	ZINC000912182480	1318842503	/nfs/dbraw/zinc/84/25/03/1318842503.db2.gz	IDSLMHJJHHWDBI-IBGZPJMESA-N	0	3	330.472	3.247	20	30		EGEDHN
FC(F)(F)[C@H]1C=C(NNc2ccnc(Br)c2)CCO1	ZINC000814904690	1318844586	/nfs/dbraw/zinc/84/45/86/1318844586.db2.gz	UYETYXKNIUIQCN-SECBINFHSA-N	0	3	338.127	3.353	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)c2cscc2Cl)C1	ZINC001022246094	1318855884	/nfs/dbraw/zinc/85/58/84/1318855884.db2.gz	RIVCROJBAWLIQV-DTORHVGOSA-N	0	3	349.681	3.161	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1cc(Cl)ccc1C(=O)NCCC	ZINC000912304715	1318864741	/nfs/dbraw/zinc/86/47/41/1318864741.db2.gz	UQHHNWDWXOLPPU-CQSZACIVSA-N	0	3	337.851	3.102	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccc(C(=O)N2CCCC[C@@H]2C)cc1	ZINC000912309889	1318865292	/nfs/dbraw/zinc/86/52/92/1318865292.db2.gz	ARWIQUFWGTYGFO-MAUKXSAKSA-N	0	3	343.471	3.323	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@@H](NC(=O)C34CCC(CC3)C4)C2)c(F)c1	ZINC001022289432	1318879931	/nfs/dbraw/zinc/87/99/31/1318879931.db2.gz	XWDPQFXSUFTLSQ-FOELVNDASA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)[C@H]2CCC[C@H]2CCC)C1	ZINC001022333171	1318896504	/nfs/dbraw/zinc/89/65/04/1318896504.db2.gz	NWWJDFILMLUFTK-KBXIAJHMSA-N	0	3	343.309	3.348	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)[C@@]1(C)C=CCC1	ZINC000960792971	1318902084	/nfs/dbraw/zinc/90/20/84/1318902084.db2.gz	SHMSIRAEAOATRL-FPOVZHCZSA-N	0	3	337.467	3.337	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]2CN(C)Cc2cccc(OC)c2)C1	ZINC000960846409	1318984264	/nfs/dbraw/zinc/98/42/64/1318984264.db2.gz	KRSMUPSUBNIWLF-SFHVURJKSA-N	0	3	342.483	3.474	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@@H](NCc3cccc(OC)c3Cl)C2)C1	ZINC001022681553	1319065919	/nfs/dbraw/zinc/06/59/19/1319065919.db2.gz	XNBFHTJRVKQUNZ-GASCZTMLSA-N	0	3	348.874	3.442	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2sc(CC3CC3)nc2C)C1	ZINC001022892738	1319153592	/nfs/dbraw/zinc/15/35/92/1319153592.db2.gz	HVPWJMNPXYUDIA-BETUJISGSA-N	0	3	339.892	3.007	20	30		EGEDHN
CCC(=O)N1CCC[C@@H]([C@@H]2CCN(Cc3ccc(C#N)cc3F)C2)C1	ZINC000961068359	1319183139	/nfs/dbraw/zinc/18/31/39/1319183139.db2.gz	PJHWQVRQYTUCOQ-IAGOWNOFSA-N	0	3	343.446	3.168	20	30		EGEDHN
O=C(C1CC1)N1CCC[C@H]([C@@H]2CCN(CC#Cc3ccccc3)C2)C1	ZINC000961075752	1319186819	/nfs/dbraw/zinc/18/68/19/1319186819.db2.gz	FEKHOAINCOHCDA-LEWJYISDSA-N	0	3	336.479	3.009	20	30		EGEDHN
CN(C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1)[C@@H]1CCCN(C)C1	ZINC000930250155	1328820095	/nfs/dbraw/zinc/82/00/95/1328820095.db2.gz	XRIIEZKNCYNWPM-CYBMUJFWSA-N	0	3	340.349	3.135	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)C2(c3ccc(C)cc3)CCC2)C1	ZINC001023147376	1319293148	/nfs/dbraw/zinc/29/31/48/1319293148.db2.gz	MMLLZBQGUGDZHE-CALCHBBNSA-N	0	3	332.875	3.406	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](C2CCN(C(=O)CSC)CC2)C1	ZINC000961324980	1319483281	/nfs/dbraw/zinc/48/32/81/1319483281.db2.gz	YJQPUMDWUCAIRG-HNNXBMFYSA-N	0	3	330.925	3.053	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccccc2-c2ccncc2)C1	ZINC001023444682	1319541424	/nfs/dbraw/zinc/54/14/24/1319541424.db2.gz	SQXFPOOSJNYTLG-SFHVURJKSA-N	0	3	347.462	3.214	20	30		EGEDHN
C(=NNCCN1CCCCC1)c1c(-c2ccccc2)nc2ccccn12	ZINC000915975905	1319576220	/nfs/dbraw/zinc/57/62/20/1319576220.db2.gz	YBZXKDGDTBFILD-UHFFFAOYSA-N	0	3	347.466	3.411	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN[C@H](c2ccc(F)cc2)[C@H]2CCCO2)cc1	ZINC000818968348	1319595041	/nfs/dbraw/zinc/59/50/41/1319595041.db2.gz	RLMJZHRILJZWAG-VAMGGRTRSA-N	0	3	340.398	3.241	20	30		EGEDHN
Cc1cocc1C(=O)NC[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001023534184	1319635646	/nfs/dbraw/zinc/63/56/46/1319635646.db2.gz	JAPFLLJTVGOSPU-GOSISDBHSA-N	0	3	337.423	3.102	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CCCN(Cc3cncc(C)c3)C2)CC1	ZINC001023572711	1319691245	/nfs/dbraw/zinc/69/12/45/1319691245.db2.gz	LTACXMQDHBRKOT-GOSISDBHSA-N	0	3	341.499	3.465	20	30		EGEDHN
Cc1ccccc1OCC(=O)C(C#N)C(=O)Nc1ccccc1Cl	ZINC000916906262	1319722884	/nfs/dbraw/zinc/72/28/84/1319722884.db2.gz	PEVVLVZAPJOIAM-ZDUSSCGKSA-N	0	3	342.782	3.375	20	30		EGEDHN
CCOCCCC(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000916932618	1319725715	/nfs/dbraw/zinc/72/57/15/1319725715.db2.gz	ZWCVKJGTSKGJSJ-LLVKDONJSA-N	0	3	343.210	3.457	20	30		EGEDHN
Cc1csc(C(=O)NC2CC(CNCc3ccccc3C#N)C2)c1	ZINC000961806259	1319737488	/nfs/dbraw/zinc/73/74/88/1319737488.db2.gz	FBBIOYQWLHKBQS-UHFFFAOYSA-N	0	3	339.464	3.226	20	30		EGEDHN
C=CCN1CCC[C@H](CNC(=O)c2csc(-c3ccoc3)n2)C1	ZINC001023652377	1319772877	/nfs/dbraw/zinc/77/28/77/1319772877.db2.gz	HKIINDPRHMUTSO-CYBMUJFWSA-N	0	3	331.441	3.031	20	30		EGEDHN
C#CCN1CCC[C@H](CNC(=O)c2ccc(Cl)c3occc32)C1	ZINC001023698371	1319825266	/nfs/dbraw/zinc/82/52/66/1319825266.db2.gz	YNZGHVAUXSLJMV-CYBMUJFWSA-N	0	3	330.815	3.161	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCN(C(=O)C2CCCC2)C1	ZINC001023797690	1319942271	/nfs/dbraw/zinc/94/22/71/1319942271.db2.gz	XSSSSUBIPBVMOC-MRXNPFEDSA-N	0	3	325.456	3.077	20	30		EGEDHN
Cc1occc1C(=O)N1CCC[C@@H](CNCc2ccccc2C#N)C1	ZINC001023831710	1319976026	/nfs/dbraw/zinc/97/60/26/1319976026.db2.gz	QBWDHDVOVAEQQD-INIZCTEOSA-N	0	3	337.423	3.102	20	30		EGEDHN
Cn1nc(C(F)(F)F)c(CNCCc2ccc(C#N)cc2)c1Cl	ZINC000826840201	1320408134	/nfs/dbraw/zinc/40/81/34/1320408134.db2.gz	VYZWQEDYNHMWBG-UHFFFAOYSA-N	0	3	342.752	3.296	20	30		EGEDHN
C#C[C@H](NC(=O)NC[C@@H](N[C@@H](C)CC)c1ccco1)c1ccccc1	ZINC000827067705	1320424376	/nfs/dbraw/zinc/42/43/76/1320424376.db2.gz	QTJFIACWYJQYOX-RYQLBKOJSA-N	0	3	339.439	3.383	20	30		EGEDHN
C#Cc1cnc(NC[C@@H](c2cccs2)N2CCC(C)CC2)nc1	ZINC000827298013	1320441605	/nfs/dbraw/zinc/44/16/05/1320441605.db2.gz	FXODVZMUXUCISW-INIZCTEOSA-N	0	3	326.469	3.405	20	30		EGEDHN
C#Cc1cnc(N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)nc1	ZINC000827630890	1320463242	/nfs/dbraw/zinc/46/32/42/1320463242.db2.gz	XZJCCFAOZWKINK-MRXNPFEDSA-N	0	3	346.356	3.163	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1ccc2oc(C(C)(C)C)nc2c1	ZINC000838624265	1320796154	/nfs/dbraw/zinc/79/61/54/1320796154.db2.gz	PCCCHRUCCOARCY-UHFFFAOYSA-N	0	3	342.443	3.202	20	30		EGEDHN
CSc1ccc([C@H](C/N=C/c2ccc(O)c(O)c2O)N(C)C)cc1	ZINC000840707106	1321131174	/nfs/dbraw/zinc/13/11/74/1321131174.db2.gz	SHXMMFPMRBTBAM-RPJLVFAOSA-N	0	3	346.452	3.247	20	30		EGEDHN
CCCCCCCC[C@H](C)CC(=O)N1CC[C@H](N2CC[C@H](O)C2)C1	ZINC000861714194	1329437610	/nfs/dbraw/zinc/43/76/10/1329437610.db2.gz	JAGLBLWJXGBUIT-FHWLQOOXSA-N	0	3	338.536	3.431	20	30		EGEDHN
CCCc1ccc(CCCC(=O)C(C#N)C(=O)N2CCCC2)cc1	ZINC000842680815	1321417407	/nfs/dbraw/zinc/41/74/07/1321417407.db2.gz	AEIIOTRDXWBJES-GOSISDBHSA-N	0	3	326.440	3.293	20	30		EGEDHN
COCC1(CC(=O)C(C#N)C(=O)Nc2cccc3ccccc32)CC1	ZINC000842687491	1321418839	/nfs/dbraw/zinc/41/88/39/1321418839.db2.gz	XHKKTHPAYGDZDG-INIZCTEOSA-N	0	3	336.391	3.304	20	30		EGEDHN
Cc1nn(C(C)C)cc1C(=O)C(C#N)C(=O)Nc1ccccc1Cl	ZINC000847624844	1321885803	/nfs/dbraw/zinc/88/58/03/1321885803.db2.gz	XXZOOKKYVORQPU-LBPRGKRZSA-N	0	3	344.802	3.387	20	30		EGEDHN
C/C(=C/C(=O)N1CCC[C@H](CNCc2ccccc2C#N)C1)C1CC1	ZINC001023869061	1321987688	/nfs/dbraw/zinc/98/76/88/1321987688.db2.gz	VXSOUGJBOXBTGT-ZFOVBUMHSA-N	0	3	337.467	3.243	20	30		EGEDHN
COc1cc(CN(C)CCCOc2ccc(C#N)cc2)cc(OC)c1	ZINC000920089705	1322136071	/nfs/dbraw/zinc/13/60/71/1322136071.db2.gz	XYNJMDOSBDXQOJ-UHFFFAOYSA-N	0	3	340.423	3.476	20	30		EGEDHN
C=CCOc1ccc(CNCc2cc(N(C)C)ccn2)cc1OC	ZINC000922479880	1322537843	/nfs/dbraw/zinc/53/78/43/1322537843.db2.gz	FMDHIKIBGQHQRU-UHFFFAOYSA-N	0	3	327.428	3.011	20	30		EGEDHN
CCN(CC)C(=O)[C@@H](Cc1ccccc1)N[C@H](C)CC(C)(C)C#N	ZINC000924530904	1323044671	/nfs/dbraw/zinc/04/46/71/1323044671.db2.gz	BVFJORHNOZWJKP-SJLPKXTDSA-N	0	3	329.488	3.384	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC[C@@H](CNCc2nccs2)C1	ZINC001024002726	1323073493	/nfs/dbraw/zinc/07/34/93/1323073493.db2.gz	IAQIHDWQPRXCNA-ZDUSSCGKSA-N	0	3	341.908	3.250	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H](CNCc2ccccc2C#N)C1)C1CCC1	ZINC001024037278	1323089355	/nfs/dbraw/zinc/08/93/55/1323089355.db2.gz	ZQIIPLOWCHKJPZ-DLBZAZTESA-N	0	3	339.483	3.323	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCN(C(=O)[C@]23C[C@H]2CCC3)C1	ZINC001024071788	1323109342	/nfs/dbraw/zinc/10/93/42/1323109342.db2.gz	HVHZTPLENSPFOH-OZOXKJRCSA-N	0	3	337.467	3.077	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H](CNCc2csc(C)n2)C1	ZINC001024138049	1323163221	/nfs/dbraw/zinc/16/32/21/1323163221.db2.gz	YTNGGBUJXRCGRU-MAUKXSAKSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=CCN(C[C@@H](O)c1ccc(Br)cc1)[C@H](C)COC	ZINC000852358460	1323182237	/nfs/dbraw/zinc/18/22/37/1323182237.db2.gz	SPQLCDKBDQVRDA-IUODEOHRSA-N	0	3	328.250	3.005	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@@H]([C@@H]2CCCN2Cc2ccccc2C#N)C1	ZINC000963260696	1323272866	/nfs/dbraw/zinc/27/28/66/1323272866.db2.gz	VTOZUXCZGGSBEM-UXHICEINSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=CCCN1CCCC[C@H]1CNC(=O)c1sc(Cl)nc1C	ZINC001024458430	1323414443	/nfs/dbraw/zinc/41/44/43/1323414443.db2.gz	FHSXDJOINNPKPJ-LBPRGKRZSA-N	0	3	327.881	3.265	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccc(-n2cccn2)cc1	ZINC001024476407	1323428929	/nfs/dbraw/zinc/42/89/29/1323428929.db2.gz	CHERXVNMVUCYPI-IBGZPJMESA-N	0	3	338.455	3.033	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccnn1C(CC)CC	ZINC001024480101	1323433327	/nfs/dbraw/zinc/43/33/27/1323433327.db2.gz	ZIYGBNFRYLYRQK-KRWDZBQOSA-N	0	3	332.492	3.405	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccc2c(c1)OCCCO2	ZINC001024480365	1323435547	/nfs/dbraw/zinc/43/55/47/1323435547.db2.gz	IAHTXHPHFFOEBQ-KRWDZBQOSA-N	0	3	344.455	3.008	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1nccc2ccsc21	ZINC001024491984	1323444294	/nfs/dbraw/zinc/44/42/94/1323444294.db2.gz	IWBWDURQWHYZDV-HNNXBMFYSA-N	0	3	329.469	3.457	20	30		EGEDHN
C=CCCN1CCCC[C@H]1CNC(=O)c1ccc(-c2cc[nH]n2)s1	ZINC001024498560	1323445830	/nfs/dbraw/zinc/44/58/30/1323445830.db2.gz	XHYCOLKQHQYKGE-AWEZNQCLSA-N	0	3	344.484	3.299	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccccc1-c1ccncc1	ZINC001024508221	1323455862	/nfs/dbraw/zinc/45/58/62/1323455862.db2.gz	HLTBLLPRFNRKSZ-IBGZPJMESA-N	0	3	347.462	3.356	20	30		EGEDHN
C=CCN1CCCC[C@H]1CNC(=O)c1cn(CC)c2ccccc12	ZINC001024542547	1323485304	/nfs/dbraw/zinc/48/53/04/1323485304.db2.gz	XWPJUONXGAQLDR-INIZCTEOSA-N	0	3	325.456	3.432	20	30		EGEDHN
C=C(C)CCN1CCCC[C@@H]1CNC(=O)c1nc2c(s1)CCC2	ZINC001024553021	1323494681	/nfs/dbraw/zinc/49/46/81/1323494681.db2.gz	QFZOJZFPLIMWOX-CQSZACIVSA-N	0	3	333.501	3.182	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cccc2c1O[C@H](C)C2	ZINC001024561814	1323502864	/nfs/dbraw/zinc/50/28/64/1323502864.db2.gz	YYCYKVLHJGSUPR-NVXWUHKLSA-N	0	3	328.456	3.170	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1cc2cc(Cl)ccc2[nH]1	ZINC001024593512	1323526889	/nfs/dbraw/zinc/52/68/89/1323526889.db2.gz	PCNWCGGJNQMWTF-INIZCTEOSA-N	0	3	343.858	3.429	20	30		EGEDHN
C=C(C)CCN1CCCC[C@H]1CNC(=O)c1nc(Cl)cs1	ZINC001024617633	1323545678	/nfs/dbraw/zinc/54/56/78/1323545678.db2.gz	KXRAILJVOKJTIE-LBPRGKRZSA-N	0	3	327.881	3.347	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccc2c(c1)[C@H](C)CO2	ZINC001024617902	1323547676	/nfs/dbraw/zinc/54/76/76/1323547676.db2.gz	NCCRJSMWOWVOBX-NVXWUHKLSA-N	0	3	328.456	3.343	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@@H]1CCc2cccc(OC)c21	ZINC001024696324	1323612639	/nfs/dbraw/zinc/61/26/39/1323612639.db2.gz	GHEQGYVLHKEFER-QZTJIDSGSA-N	0	3	342.483	3.272	20	30		EGEDHN
C=C(C)CCN1CCCC[C@H]1CNC(=O)c1snnc1C(C)C	ZINC001024726779	1323629079	/nfs/dbraw/zinc/62/90/79/1323629079.db2.gz	ATIDANBVTHFBJU-AWEZNQCLSA-N	0	3	336.505	3.212	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccnc(O[C@@H](C)CC)c1	ZINC001024746928	1323646889	/nfs/dbraw/zinc/64/68/89/1323646889.db2.gz	JGUDTTVJICYHKA-FUHWJXTLSA-N	0	3	345.487	3.419	20	30		EGEDHN
C[C@H](NC[C@H]1CCCCN1C(=O)C#CC1CC1)c1ccccc1F	ZINC001024958549	1323800378	/nfs/dbraw/zinc/80/03/78/1323800378.db2.gz	YTAJVOYYDQADMH-DOTOQJQBSA-N	0	3	328.431	3.271	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)c(F)c1	ZINC001025041048	1323843663	/nfs/dbraw/zinc/84/36/63/1323843663.db2.gz	RURQYHGGWNKWIW-QGZVFWFLSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@@H]1CNCc1ccnc(Cl)c1	ZINC001025041254	1323844757	/nfs/dbraw/zinc/84/47/57/1323844757.db2.gz	XMBCOSBPMAITHC-OAHLLOKOSA-N	0	3	335.879	3.418	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)C2(CF)CCC2)s1	ZINC001025090035	1323887091	/nfs/dbraw/zinc/88/70/91/1323887091.db2.gz	AZBVUHCOWFRAQE-AWEZNQCLSA-N	0	3	349.475	3.230	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc(Cl)o1	ZINC001025199570	1323982533	/nfs/dbraw/zinc/98/25/33/1323982533.db2.gz	XNSZPHBYTPRZNH-CABCVRRESA-N	0	3	334.847	3.415	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(C)oc1C	ZINC001025202547	1323987850	/nfs/dbraw/zinc/98/78/50/1323987850.db2.gz	YZQANGGKPUGDII-RBUKOAKNSA-N	0	3	328.456	3.379	20	30		EGEDHN
C=CCC[N@H+]1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccccc1[O-]	ZINC001025202263	1323989273	/nfs/dbraw/zinc/98/92/73/1323989273.db2.gz	WHLBVEDBJWCIQI-ZWKOTPCHSA-N	0	3	328.456	3.427	20	30		EGEDHN
C=CCC[N@@H+]1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccccc1[O-]	ZINC001025202263	1323989275	/nfs/dbraw/zinc/98/92/75/1323989275.db2.gz	WHLBVEDBJWCIQI-ZWKOTPCHSA-N	0	3	328.456	3.427	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)CCc1ccoc1	ZINC001025217473	1324010302	/nfs/dbraw/zinc/01/03/02/1324010302.db2.gz	DCAJGNBYDAKGCK-RBUKOAKNSA-N	0	3	328.456	3.081	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1csc(C)c1C	ZINC001025236440	1324025801	/nfs/dbraw/zinc/02/58/01/1324025801.db2.gz	USUBELMFHHAVRJ-MSOLQXFVSA-N	0	3	330.497	3.457	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)Cc1cccc(CC)c1	ZINC001025243389	1324038505	/nfs/dbraw/zinc/03/85/05/1324038505.db2.gz	NXLNCGDLHNXIHB-RTWAWAEBSA-N	0	3	338.495	3.270	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1onc2c1CCCC2	ZINC001025250139	1324050150	/nfs/dbraw/zinc/05/01/50/1324050150.db2.gz	HETDDMLNVCTPJC-ZWKOTPCHSA-N	0	3	343.471	3.199	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccncc1Cl	ZINC001025273928	1324090066	/nfs/dbraw/zinc/09/00/66/1324090066.db2.gz	SJFRXKUZQJFFJM-ROUUACIJSA-N	0	3	345.874	3.217	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cccc2c1ccn2C	ZINC001025276234	1324098263	/nfs/dbraw/zinc/09/82/63/1324098263.db2.gz	HLUIMWLLMYXKAW-SFTDATJTSA-N	0	3	349.478	3.271	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc2cccnc2c1	ZINC001025278768	1324100692	/nfs/dbraw/zinc/10/06/92/1324100692.db2.gz	VGJNDMCIEPNMCF-RTWAWAEBSA-N	0	3	347.462	3.327	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(CCC)on1	ZINC001025283878	1324104509	/nfs/dbraw/zinc/10/45/09/1324104509.db2.gz	BZMXMOLJGBPCKZ-MOPGFXCFSA-N	0	3	343.471	3.110	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)Cn1ccc2ccccc21	ZINC001025293572	1324120392	/nfs/dbraw/zinc/12/03/92/1324120392.db2.gz	DQFMXMRCHMFUMW-RTWAWAEBSA-N	0	3	349.478	3.120	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)C(C)(C)C(C)(F)F	ZINC001025293462	1324120803	/nfs/dbraw/zinc/12/08/03/1324120803.db2.gz	RVAHDLTXKPBLEU-CABCVRRESA-N	0	3	326.431	3.147	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)Cc1ccccc1Cl	ZINC001025295533	1324125694	/nfs/dbraw/zinc/12/56/94/1324125694.db2.gz	HFAPRGDWDAXEAH-OALUTQOASA-N	0	3	344.886	3.361	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1c(C)nsc1C	ZINC001025302130	1324136390	/nfs/dbraw/zinc/13/63/90/1324136390.db2.gz	RYFWNGHCRDGJCW-HOTGVXAUSA-N	0	3	333.501	3.405	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(C)n(C(C)C)n1	ZINC001025304151	1324137868	/nfs/dbraw/zinc/13/78/68/1324137868.db2.gz	MJTVAYSAGYPXFO-OALUTQOASA-N	0	3	344.503	3.418	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2coc3cc(F)ccc23)C1	ZINC001025461873	1324307765	/nfs/dbraw/zinc/30/77/65/1324307765.db2.gz	XNEPPOPJVVRXPS-KGLIPLIRSA-N	0	3	328.387	3.035	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2csc(C(F)(F)F)c2)C1	ZINC001025471728	1324316405	/nfs/dbraw/zinc/31/64/05/1324316405.db2.gz	IMPDQYFGNWGOAZ-VXGBXAGGSA-N	0	3	344.402	3.230	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2occc2-c2ccccc2)C1	ZINC001025480202	1324325824	/nfs/dbraw/zinc/32/58/24/1324325824.db2.gz	RERRRYKVGNFNHC-SJLPKXTDSA-N	0	3	336.435	3.410	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2nc3ccccc3cc2C)C1	ZINC001025484702	1324332753	/nfs/dbraw/zinc/33/27/53/1324332753.db2.gz	HSZMRBMSGYOPCQ-MJGOQNOKSA-N	0	3	349.478	3.397	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2nc3ccccc3cc2C)C1	ZINC001025485979	1324335255	/nfs/dbraw/zinc/33/52/55/1324335255.db2.gz	QYMRVILLOCHHNE-SJLPKXTDSA-N	0	3	335.451	3.007	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(C)c3cccnc23)C1	ZINC001025489060	1324340047	/nfs/dbraw/zinc/34/00/47/1324340047.db2.gz	NSBULCMYBRAZET-IRXDYDNUSA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(C)nc2C(C)C)C1	ZINC001025489735	1324340709	/nfs/dbraw/zinc/34/07/09/1324340709.db2.gz	QIZUYMRXIBBVSI-MSOLQXFVSA-N	0	3	341.499	3.367	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H](C)[C@H]2CCCN(Cc3cccnc3)C2)cc1	ZINC001025501323	1324350706	/nfs/dbraw/zinc/35/07/06/1324350706.db2.gz	CRINBKXJFKXKEN-UWJYYQICSA-N	0	3	347.462	3.093	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(F)c(Cl)cc2F)C1	ZINC001025520095	1324363531	/nfs/dbraw/zinc/36/35/31/1324363531.db2.gz	ASRGFOIVRIPLRI-RYUDHWBXSA-N	0	3	340.801	3.082	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(F)cc(Cl)c2)C1	ZINC001025539554	1324386570	/nfs/dbraw/zinc/38/65/70/1324386570.db2.gz	OYQREFWYVQCQAP-KGLIPLIRSA-N	0	3	336.838	3.333	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(Cl)c(OC)c2)C1	ZINC001025553018	1324400822	/nfs/dbraw/zinc/40/08/22/1324400822.db2.gz	QDMGVVRUFFTOHJ-HOCLYGCPSA-N	0	3	348.874	3.202	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(-c3ccccc3)ccn2)C1	ZINC001025579888	1324419057	/nfs/dbraw/zinc/41/90/57/1324419057.db2.gz	PPZDNJYJJTVTMK-YLJYHZDGSA-N	0	3	347.462	3.212	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc3ccccc3n2)C1	ZINC001025606348	1324455350	/nfs/dbraw/zinc/45/53/50/1324455350.db2.gz	DQRNUGGQLMISHW-SJLPKXTDSA-N	0	3	335.451	3.088	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)C23CC4CC(CC(C4)C2)C3)C1	ZINC001025606433	1324456122	/nfs/dbraw/zinc/45/61/22/1324456122.db2.gz	FOVCJFPAENTYEQ-CYSNLQCGSA-N	0	3	328.500	3.053	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(OC3CCC3)cc2)C1	ZINC001025626556	1324477043	/nfs/dbraw/zinc/47/70/43/1324477043.db2.gz	DMDQTRNHNDKOKD-SJLPKXTDSA-N	0	3	340.467	3.081	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(-c3ccccc3)co2)C1	ZINC001025640384	1324490289	/nfs/dbraw/zinc/49/02/89/1324490289.db2.gz	MLIDOKUYZVUXIO-SJLPKXTDSA-N	0	3	336.435	3.410	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(-c3ccccc3)co2)C1	ZINC001025640385	1324490924	/nfs/dbraw/zinc/49/09/24/1324490924.db2.gz	MLIDOKUYZVUXIO-WMZOPIPTSA-N	0	3	336.435	3.410	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H]2CC[C@H](NCc3ccn(C(C)C)n3)[C@H]2C1	ZINC001026329593	1324730356	/nfs/dbraw/zinc/73/03/56/1324730356.db2.gz	ZIEVNRPPGJRMNV-SZMVWBNQSA-N	0	3	344.503	3.003	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H]2CC[C@H](NCc3cscn3)[C@H]2C1	ZINC001026331887	1324731909	/nfs/dbraw/zinc/73/19/09/1324731909.db2.gz	ZKVPLZNXAJHPOA-BPUTZDHNSA-N	0	3	333.501	3.072	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H]3CC[C@H](NCc4nccs4)[C@@H]3C2)CC1	ZINC001026345737	1324742727	/nfs/dbraw/zinc/74/27/27/1324742727.db2.gz	BVNLYTCKDGDVMT-BBWFWOEESA-N	0	3	345.512	3.216	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H]3CC[C@H](NCc4csc(C)n4)[C@@H]3C2)C1	ZINC001026353073	1324747282	/nfs/dbraw/zinc/74/72/82/1324747282.db2.gz	XSSJWEOCBUCQNS-UAGQMJEPSA-N	0	3	345.512	3.134	20	30		EGEDHN
Cc1cncc(C(=O)NC2CCC(NCc3ccccc3C#N)CC2)c1	ZINC001026470449	1324828674	/nfs/dbraw/zinc/82/86/74/1324828674.db2.gz	AZVRKHKDSKBVQV-UHFFFAOYSA-N	0	3	348.450	3.093	20	30		EGEDHN
N#Cc1ccccc1CNC1CCC(NC(=O)C2(F)CCCC2)CC1	ZINC001026518584	1324864698	/nfs/dbraw/zinc/86/46/98/1324864698.db2.gz	YVRMDLFSUHWHMJ-UHFFFAOYSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)[C@H]2CCC2(C)C)CC1	ZINC001026545611	1324882648	/nfs/dbraw/zinc/88/26/48/1324882648.db2.gz	HDHNMOKPJCEOKI-JXQTWKCFSA-N	0	3	343.309	3.348	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@@H]1CCN(C(=O)CC2CCCC2)C1	ZINC001026656985	1324955205	/nfs/dbraw/zinc/95/52/05/1324955205.db2.gz	AOHAVGNIDQGSMO-INIZCTEOSA-N	0	3	343.446	3.216	20	30		EGEDHN
CC1(CC(=O)N2CC[C@H](CNCc3ccccc3C#N)C2)CCCC1	ZINC001026825043	1325036079	/nfs/dbraw/zinc/03/60/79/1325036079.db2.gz	ZIXUFNURNLBKMT-QGZVFWFLSA-N	0	3	339.483	3.467	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCN(C(=O)C[C@@H]2C=CCCC2)C1	ZINC001026914115	1325076610	/nfs/dbraw/zinc/07/66/10/1325076610.db2.gz	RVIQRFCNZWPULN-QZTJIDSGSA-N	0	3	337.467	3.243	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](CNCc2nc(C)sc2C)C1	ZINC001026988848	1325128115	/nfs/dbraw/zinc/12/81/15/1325128115.db2.gz	QQNSMILGJRIDBM-OAHLLOKOSA-N	0	3	335.517	3.300	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@H](CNCc3ccccc3C#N)C2)cs1	ZINC001027122551	1325239418	/nfs/dbraw/zinc/23/94/18/1325239418.db2.gz	YXJJKENIQITKED-OAHLLOKOSA-N	0	3	339.464	3.180	20	30		EGEDHN
CCC(CC)Nc1ccncc1NC(=O)c1cc(C#N)ccc1F	ZINC000854577619	1325279780	/nfs/dbraw/zinc/27/97/80/1325279780.db2.gz	HRWWAFARXAPQJK-UHFFFAOYSA-N	0	3	326.375	3.367	20	30		EGEDHN
N#Cc1ccccc1CNC1CC2(C1)CC(NC(=O)c1ccccc1)C2	ZINC000963503445	1325281588	/nfs/dbraw/zinc/28/15/88/1325281588.db2.gz	RHGHVZMRIGQVQN-UHFFFAOYSA-N	0	3	345.446	3.389	20	30		EGEDHN
C[C@@]1(NC(=O)c2cc(C#N)ccc2F)CCN(Cc2ccccc2)C1	ZINC000855031329	1325335986	/nfs/dbraw/zinc/33/59/86/1325335986.db2.gz	IVNWTSZYYSXFKD-HXUWFJFHSA-N	0	3	337.398	3.092	20	30		EGEDHN
Cc1[nH]ccc1C(=O)NC1CC2(CC(NCc3ccccc3C#N)C2)C1	ZINC000963672425	1325372528	/nfs/dbraw/zinc/37/25/28/1325372528.db2.gz	WCQRDOQULOZZSE-UHFFFAOYSA-N	0	3	348.450	3.026	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@@H](N(C)Cc2ccc(F)c(C#N)c2)C1	ZINC001027279706	1325404058	/nfs/dbraw/zinc/40/40/58/1325404058.db2.gz	DFWMFMJKNNRDKD-QGZVFWFLSA-N	0	3	329.419	3.086	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H](N(C)Cc2cccc(C#N)c2)C1)C1CC1	ZINC001027350325	1325515300	/nfs/dbraw/zinc/51/53/00/1325515300.db2.gz	AOBFCVYBSQKVDX-HNAYVOBHSA-N	0	3	325.456	3.027	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)cc2)C1)C1CC1	ZINC001027352537	1325522469	/nfs/dbraw/zinc/52/24/69/1325522469.db2.gz	XACPVAKFVBJAOH-KXBFYZLASA-N	0	3	325.456	3.027	20	30		EGEDHN
CN(Cc1ccc(F)c(C#N)c1)[C@H]1CCCN(C(=O)[C@H]2CC2(C)C)C1	ZINC001027373060	1325566463	/nfs/dbraw/zinc/56/64/63/1325566463.db2.gz	FHHSCRZWFVURED-DLBZAZTESA-N	0	3	343.446	3.166	20	30		EGEDHN
CCN(C(=O)OC(C)(C)C)[C@H](C)C(=O)C(C#N)c1nc(C)cs1	ZINC000860449615	1329318449	/nfs/dbraw/zinc/31/84/49/1329318449.db2.gz	CLUQLAYRROHFJP-NEPJUHHUSA-N	0	3	337.445	3.273	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)[C@@H]1C[C@H]1c1ccco1)c1ccccc1	ZINC000860693480	1329344942	/nfs/dbraw/zinc/34/49/42/1329344942.db2.gz	HGKLPHRIWBFAPF-NCOADZHNSA-N	0	3	336.391	3.359	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)c2cc3ccc(F)cc3s2)C1	ZINC001027481532	1327734110	/nfs/dbraw/zinc/73/41/10/1327734110.db2.gz	LWQGWWRWRWBBNC-HNNXBMFYSA-N	0	3	330.428	3.210	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)CC2(C)CC2)C1	ZINC001027496319	1327758194	/nfs/dbraw/zinc/75/81/94/1327758194.db2.gz	OVULIRMTXRDVSK-SFHVURJKSA-N	0	3	325.456	3.171	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](N(C)Cc2ccc(OC)c(F)c2)C1	ZINC001027521438	1327793591	/nfs/dbraw/zinc/79/35/91/1327793591.db2.gz	CSXVRUZZZVDZBO-MRXNPFEDSA-N	0	3	348.462	3.469	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)C(C)(C)C2CC2)C1	ZINC001027540555	1327840093	/nfs/dbraw/zinc/84/00/93/1327840093.db2.gz	ZEIUADGOJQWMRC-IBGZPJMESA-N	0	3	339.483	3.417	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)CC(C)(F)F)C1	ZINC001027562856	1327881591	/nfs/dbraw/zinc/88/15/91/1327881591.db2.gz	XIYUUDRAMVTILP-MRXNPFEDSA-N	0	3	335.398	3.026	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)C2CC3(CC3)C2)C1	ZINC001027570368	1327901343	/nfs/dbraw/zinc/90/13/43/1327901343.db2.gz	CZKNBJQJJYWDEJ-IBGZPJMESA-N	0	3	337.467	3.171	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001027585253	1327921429	/nfs/dbraw/zinc/92/14/29/1327921429.db2.gz	DFNXZVBBGCTCDE-CEXWTWQISA-N	0	3	325.456	3.027	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)[C@@H]2CC23CCC3)C1	ZINC001027596592	1327945061	/nfs/dbraw/zinc/94/50/61/1327945061.db2.gz	XBNQCRORJYZRJE-MOPGFXCFSA-N	0	3	337.467	3.171	20	30		EGEDHN
N#Cc1ccccc1CNC1CC2(C1)CC(NC(=O)[C@@H]1CC13CCC3)C2	ZINC000965295318	1327975070	/nfs/dbraw/zinc/97/50/70/1327975070.db2.gz	LGSDFQKFNIUUSZ-FCOWATRHSA-N	0	3	349.478	3.265	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)c2ccc(-c3cccs3)o2)C1	ZINC001027667380	1328059123	/nfs/dbraw/zinc/05/91/23/1328059123.db2.gz	QOFICQNNZGPVGQ-AWEZNQCLSA-N	0	3	328.437	3.178	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1scnc1Cl)C2	ZINC000965918486	1328104452	/nfs/dbraw/zinc/10/44/52/1328104452.db2.gz	BKLHBLBYMHSBPT-UHFFFAOYSA-N	0	3	346.283	3.180	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2cc(C(F)F)ccc2F)C1	ZINC000966164539	1328211108	/nfs/dbraw/zinc/21/11/08/1328211108.db2.gz	CAEUXDIMBQQGEA-MLGOLLRUSA-N	0	3	338.373	3.227	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2cccc(OCCC)c2)C1	ZINC000966393187	1328289063	/nfs/dbraw/zinc/28/90/63/1328289063.db2.gz	YGRIAZJXZOISBJ-VQIMIIECSA-N	0	3	330.472	3.492	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H]1CNC(=O)c1cnc([C@H](C)OC)s1	ZINC001027886225	1328353770	/nfs/dbraw/zinc/35/37/70/1328353770.db2.gz	PJWHDPGYNKRKEE-UONOGXRCSA-N	0	3	337.489	3.011	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NC[C@H]1CCCN1Cc1cccc(C)c1	ZINC001027888274	1328355536	/nfs/dbraw/zinc/35/55/36/1328355536.db2.gz	KSUKZXAZEOPJBL-AQNXPRMDSA-N	0	3	342.483	3.057	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cccc3c2CCCCC3)C1	ZINC000966888438	1328455445	/nfs/dbraw/zinc/45/54/45/1328455445.db2.gz	RNRJAQLFECHACU-UTKZUKDTSA-N	0	3	338.495	3.419	20	30		EGEDHN
C#CCNC(=O)[C@@H](C)N[C@H](CCCc1ccccc1)c1ccccc1	ZINC000863400204	1329551997	/nfs/dbraw/zinc/55/19/97/1329551997.db2.gz	JDWSZKPSGSQDKA-WIYYLYMNSA-N	0	3	334.463	3.478	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cccc(Oc3ccccn3)c2)CC1	ZINC000865193229	1329675556	/nfs/dbraw/zinc/67/55/56/1329675556.db2.gz	IFNMURPWFXFQPL-UHFFFAOYSA-N	0	3	337.423	3.254	20	30		EGEDHN
COc1ccccc1NC(=O)[C@H]1CCCN(Cc2ccc(C#N)cc2)C1	ZINC000932634962	1329829590	/nfs/dbraw/zinc/82/95/90/1329829590.db2.gz	DYZWCHRVGKUJEC-SFHVURJKSA-N	0	3	349.434	3.418	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)Nc1cccc(CN2CCC(CO)CC2)c1	ZINC000934430686	1329978248	/nfs/dbraw/zinc/97/82/48/1329978248.db2.gz	WSGMOILRWYPPJT-INIZCTEOSA-N	0	3	330.472	3.432	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N(C[C@H](O)CC(C)(C)C)C1CCN(C)CC1	ZINC000935816745	1330087905	/nfs/dbraw/zinc/08/79/05/1330087905.db2.gz	GILQBUVYZGZSGX-FUHWJXTLSA-N	0	3	338.536	3.309	20	30		EGEDHN
Cc1ccc(C#N)cc1C(=O)N[C@@H](CN(C)C)c1ccc(F)cc1	ZINC000935985890	1330101718	/nfs/dbraw/zinc/10/17/18/1330101718.db2.gz	QLOPLQPDQYNBIC-SFHVURJKSA-N	0	3	325.387	3.039	20	30		EGEDHN
CCc1ccoc1C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC000939071846	1330369662	/nfs/dbraw/zinc/36/96/62/1330369662.db2.gz	ASUOIBUMUFJKRG-MLGOLLRUSA-N	0	3	343.452	3.025	20	30		EGEDHN
CC1(C)CN(Cc2cccc(C#N)c2)CC[C@@H]1NC(=O)C1=CCCC1	ZINC000940674672	1331152607	/nfs/dbraw/zinc/15/26/07/1331152607.db2.gz	VVFDWGGDKMPFHP-IBGZPJMESA-N	0	3	337.467	3.385	20	30		EGEDHN
CC1(C(=O)N[C@H]2CCN(Cc3cccc(C#N)c3)CC2(C)C)CCC1	ZINC000940951189	1331270096	/nfs/dbraw/zinc/27/00/96/1331270096.db2.gz	ZKUSNDXAEOTXKB-SFHVURJKSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC1(C(=O)N[C@@H]2CCN(Cc3ccc(C#N)cc3)CC2(C)C)CCC1	ZINC000940953993	1331272235	/nfs/dbraw/zinc/27/22/35/1331272235.db2.gz	IDHQJIMCSFQADJ-GOSISDBHSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)[C@H]2CC[C@H](C3CCC3)CC2)[C@@H](C)C1	ZINC000942145278	1331847074	/nfs/dbraw/zinc/84/70/74/1331847074.db2.gz	YFCQNHIKLAFMGL-LEAZDLGRSA-N	0	3	330.516	3.443	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@@H](C)C(CC)CC)C1	ZINC001194316235	1368230110	/nfs/dbraw/zinc/23/01/10/1368230110.db2.gz	SAIFUOHFQUONJA-CGTJXYLNSA-N	0	3	326.525	3.190	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3sccc3s2)[C@H](C)C1	ZINC000942183742	1331867021	/nfs/dbraw/zinc/86/70/21/1331867021.db2.gz	LERFSKKCIGUNMJ-OLZOCXBDSA-N	0	3	332.494	3.426	20	30		EGEDHN
C[C@@H]1CN(Cc2cccc(C#N)c2)CC[C@H]1NC(=O)Cc1ccccc1	ZINC000942188586	1331869367	/nfs/dbraw/zinc/86/93/67/1331869367.db2.gz	LMYNAWUJBGCSNO-DYESRHJHSA-N	0	3	347.462	3.128	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)nn2C(CC)CC)[C@H](C)C1	ZINC000942201828	1331876581	/nfs/dbraw/zinc/87/65/81/1331876581.db2.gz	AJWNDXPRLVOPSR-QAPCUYQASA-N	0	3	344.503	3.016	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(CCCC)cc2)[C@H](C)C1	ZINC000942391023	1331920802	/nfs/dbraw/zinc/92/08/02/1331920802.db2.gz	DOGUJNSSSYZMOX-YLJYHZDGSA-N	0	3	326.484	3.493	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2occc2-c2ccccc2)[C@H](C)C1	ZINC000942392699	1331922534	/nfs/dbraw/zinc/92/25/34/1331922534.db2.gz	KAQLKMGWQQDUEG-APWZRJJASA-N	0	3	336.435	3.410	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2cc3ccccc3s2)[C@H](C)C1	ZINC000942465356	1331939817	/nfs/dbraw/zinc/93/98/17/1331939817.db2.gz	FLDNZZGAOQOSMD-CRAIPNDOSA-N	0	3	340.492	3.294	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3c(o2)c(F)ccc3C)[C@H](C)C1	ZINC000942526882	1331956334	/nfs/dbraw/zinc/95/63/34/1331956334.db2.gz	CTZJLOMDHWTPNY-PBHICJAKSA-N	0	3	342.414	3.344	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3cnccc3C)C[C@H]2C)cc1	ZINC000942553943	1331970843	/nfs/dbraw/zinc/97/08/43/1331970843.db2.gz	WFHAPUVYUZOGEB-UTKZUKDTSA-N	0	3	347.462	3.012	20	30		EGEDHN
C[C@H]1CN(Cc2ccc(C#N)cc2)CC[C@@H]1NC(=O)C1(C)CCC1	ZINC000942560597	1331975370	/nfs/dbraw/zinc/97/53/70/1331975370.db2.gz	SMVJBZYZLCSQDE-YJBOKZPZSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2c(C)cc(C)cc2C)[C@@H](C)C1	ZINC000942597566	1331995478	/nfs/dbraw/zinc/99/54/78/1331995478.db2.gz	LRJRWRUUORVMMJ-AZUAARDMSA-N	0	3	326.484	3.004	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCN(CCc3ccns3)C[C@@H]2C)CC1	ZINC000942599987	1331996978	/nfs/dbraw/zinc/99/69/78/1331996978.db2.gz	IOXKVFYEBILTLP-MAUKXSAKSA-N	0	3	347.528	3.259	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3cccc(C#N)c3)C[C@@H]2C)C1	ZINC000942603017	1332000710	/nfs/dbraw/zinc/00/07/10/1332000710.db2.gz	QUFQUAZPZINCLZ-QFBILLFUSA-N	0	3	337.467	3.241	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)oc2C(F)(F)F)[C@H](C)C1	ZINC000943207284	1332120767	/nfs/dbraw/zinc/12/07/67/1332120767.db2.gz	FYUKXRHAEFNUMK-BXUZGUMPSA-N	0	3	342.361	3.070	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2csc(-c3ccoc3)n2)[C@H](C)C1	ZINC000943688542	1332238890	/nfs/dbraw/zinc/23/88/90/1332238890.db2.gz	DZNQKVCQIFLWKH-OCCSQVGLSA-N	0	3	331.441	3.029	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccccc2C(F)(F)F)[C@@H](C)C1	ZINC000944263778	1332356882	/nfs/dbraw/zinc/35/68/82/1332356882.db2.gz	LECARGHEWAAVTN-WFASDCNBSA-N	0	3	326.362	3.332	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccccc2C(F)(F)F)[C@H](C)C1	ZINC000944263776	1332357025	/nfs/dbraw/zinc/35/70/25/1332357025.db2.gz	LECARGHEWAAVTN-IUODEOHRSA-N	0	3	326.362	3.332	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)nc3ccccc32)[C@H](C)C1	ZINC000944619940	1332419268	/nfs/dbraw/zinc/41/92/68/1332419268.db2.gz	PWWVJVVCHSNVOV-BEFAXECRSA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3ccc(Cl)cc3)CC2)[C@@H](C)C1	ZINC000944655462	1332421683	/nfs/dbraw/zinc/42/16/83/1332421683.db2.gz	QNPFTCYDAHQLNE-YJBOKZPZSA-N	0	3	344.886	3.222	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc(OCC(C)C)c2)[C@H](C)C1	ZINC000944810263	1332426650	/nfs/dbraw/zinc/42/66/50/1332426650.db2.gz	HDGHFSNRBYZYLR-XLIONFOSSA-N	0	3	342.483	3.185	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3cc[nH]c3CC)CC[C@@H]2C1	ZINC000946577967	1332856889	/nfs/dbraw/zinc/85/68/89/1332856889.db2.gz	FYFUOLBNZYSXGH-GASCZTMLSA-N	0	3	335.879	3.114	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CC[C@H]2CN(CC(=C)Cl)C[C@H]2CC1	ZINC000946623130	1332864419	/nfs/dbraw/zinc/86/44/19/1332864419.db2.gz	DAAFKTWGYODAIE-CALCHBBNSA-N	0	3	347.890	3.211	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)C2CCCC2)CCN1Cc1ccc(C#N)cc1	ZINC000946972111	1332949506	/nfs/dbraw/zinc/94/95/06/1332949506.db2.gz	WKWJZJZNWWQOOB-KXBFYZLASA-N	0	3	325.456	3.218	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H]2CCN(Cc3cccc(C#N)c3)[C@H](C)C2)cn1	ZINC000947052466	1332991344	/nfs/dbraw/zinc/99/13/44/1332991344.db2.gz	KQNFJQZKUDYWGU-OXQOHEQNSA-N	0	3	348.450	3.045	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(F)c(C(F)F)c2)C[C@@H]1C	ZINC000947319708	1333087467	/nfs/dbraw/zinc/08/74/67/1333087467.db2.gz	UNOZWTPMYXVIOB-GXTWGEPZSA-N	0	3	338.373	3.369	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3ccccc3nc2C)C[C@H]1C	ZINC000947365056	1333104470	/nfs/dbraw/zinc/10/44/70/1333104470.db2.gz	HGYXYIYVFMUCLM-CRAIPNDOSA-N	0	3	335.451	3.149	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2[nH]c3ccccc3c2Cl)C[C@@H]1C	ZINC000947497210	1333147306	/nfs/dbraw/zinc/14/73/06/1333147306.db2.gz	HGKSMADHINKAGK-KBPBESRZSA-N	0	3	343.858	3.427	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2cccc(C(C)C)c2)C[C@H]1C	ZINC000947498767	1333148139	/nfs/dbraw/zinc/14/81/39/1333148139.db2.gz	YQVIVUKTGVYYQL-YLJYHZDGSA-N	0	3	326.484	3.345	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2sccc2-n2cccc2)C[C@@H]1C	ZINC000947597542	1333187803	/nfs/dbraw/zinc/18/78/03/1333187803.db2.gz	ICDWOCBSONZFEW-GJZGRUSLSA-N	0	3	329.469	3.308	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C(C)(C)c2ccc(Cl)cc2)C[C@@H]1C	ZINC000947670644	1333217207	/nfs/dbraw/zinc/21/72/07/1333217207.db2.gz	HBSLCCPMQUEOEL-YOEHRIQHSA-N	0	3	332.875	3.220	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccccc2-n2cccc2)C[C@H]1C	ZINC000947686445	1333223702	/nfs/dbraw/zinc/22/37/02/1333223702.db2.gz	YHZIEBYPQQQSOP-QZTJIDSGSA-N	0	3	335.451	3.083	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H]2CCN(Cc3cccc(C#N)c3)[C@@H](C)C2)ccn1	ZINC000947818876	1333270678	/nfs/dbraw/zinc/27/06/78/1333270678.db2.gz	BMALZKBDDFBANU-OXJNMPFZSA-N	0	3	348.450	3.045	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2csc(-c3ccoc3)n2)C[C@H]1C	ZINC000947820249	1333270916	/nfs/dbraw/zinc/27/09/16/1333270916.db2.gz	JUFITMONJNXSTO-HIFRSBDPSA-N	0	3	343.452	3.009	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(-c3ccccc3)nc2)C[C@H]1C	ZINC000947849967	1333279473	/nfs/dbraw/zinc/27/94/73/1333279473.db2.gz	WIBFJKPVDPZRQO-XLIONFOSSA-N	0	3	347.462	3.355	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2[nH]c3ccc(C)cc3c2C)C[C@H]1C	ZINC000947878167	1333288606	/nfs/dbraw/zinc/28/86/06/1333288606.db2.gz	LPASXOMXSNXNPS-WBVHZDCISA-N	0	3	337.467	3.391	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C(C)(C)c2ccc(C)cc2)C[C@H]1C	ZINC000947944530	1333314329	/nfs/dbraw/zinc/31/43/29/1333314329.db2.gz	WRFIRYPMIRMZJQ-MJGOQNOKSA-N	0	3	326.484	3.265	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(F)c(F)c(F)c2F)C[C@@H]1C	ZINC000947957727	1333320083	/nfs/dbraw/zinc/32/00/83/1333320083.db2.gz	MXNACGFODVLDHS-VHSXEESVSA-N	0	3	330.325	3.012	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc3[nH]c(C)c(C)c3c2)C[C@@H]1C	ZINC000948025303	1333345023	/nfs/dbraw/zinc/34/50/23/1333345023.db2.gz	GCRRCBOISTZLNW-KSSFIOAISA-N	0	3	337.467	3.391	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cscc2C(F)(F)F)C[C@H]1C	ZINC000948105213	1333375849	/nfs/dbraw/zinc/37/58/49/1333375849.db2.gz	SFHPAYBVAKWZJU-NEPJUHHUSA-N	0	3	344.402	3.373	20	30		EGEDHN
CN(C(=O)c1ccccn1)[C@H]1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC000948130794	1333383846	/nfs/dbraw/zinc/38/38/46/1333383846.db2.gz	COBNISVKHABUDF-IBGZPJMESA-N	0	3	348.450	3.080	20	30		EGEDHN
CN(C(=O)c1ccco1)[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948148984	1333394741	/nfs/dbraw/zinc/39/47/41/1333394741.db2.gz	LTAARAVCKRIUNR-GOSISDBHSA-N	0	3	337.423	3.278	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)[C@@H]2[C@@H](c3ccccc3)C2(C)C)CC1	ZINC000948378559	1333502100	/nfs/dbraw/zinc/50/21/00/1333502100.db2.gz	XRXZNPDLVNQRQA-ZCNNSNEGSA-N	0	3	338.495	3.372	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2ccc3c4c(cccc42)CC3)CC1	ZINC000948597492	1333589742	/nfs/dbraw/zinc/58/97/42/1333589742.db2.gz	CGOXQBYSJHCBNS-IBGZPJMESA-N	0	3	346.474	3.498	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)[C@@H]2CCc3c2cccc3Cl)CC1	ZINC000948621077	1333599787	/nfs/dbraw/zinc/59/97/87/1333599787.db2.gz	LQILIZRQVWAJBN-MAUKXSAKSA-N	0	3	344.886	3.316	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)[C@@H]2C[C@]2(C)c2ccccc2)CC1	ZINC000948627680	1333602657	/nfs/dbraw/zinc/60/26/57/1333602657.db2.gz	BQGUBAUODSHUQZ-RZUBCFFCSA-N	0	3	338.495	3.300	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@@H]2CCCN(Cc3cccnc3)CC2)C1	ZINC000948746694	1333656873	/nfs/dbraw/zinc/65/68/73/1333656873.db2.gz	ICJWAMKEJPKXJV-GOSISDBHSA-N	0	3	327.472	3.251	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cc(F)c(F)c(F)c2)CC1	ZINC000948804871	1333687946	/nfs/dbraw/zinc/68/79/46/1333687946.db2.gz	SIBXRSNEYLGQJC-AWEZNQCLSA-N	0	3	338.373	3.054	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)Cc2cccc3sccc32)CC1	ZINC000948829110	1333701215	/nfs/dbraw/zinc/70/12/15/1333701215.db2.gz	DQCXWXBFGYKIEJ-KRWDZBQOSA-N	0	3	340.492	3.390	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@H]1CNC(=O)c1c[nH]c(C#N)c1	ZINC000948905914	1333728238	/nfs/dbraw/zinc/72/82/38/1333728238.db2.gz	GNRHCXJGRBUKIG-HXUWFJFHSA-N	0	3	348.450	3.182	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@H]1CNC(=O)c1c(C)ccn1C	ZINC000948910462	1333730559	/nfs/dbraw/zinc/73/05/59/1333730559.db2.gz	SGNSJLVZYNGZNM-LJQANCHMSA-N	0	3	337.467	3.239	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NC[C@@H]1c2ccccc2CCN1C(C)C	ZINC000948919890	1333734577	/nfs/dbraw/zinc/73/45/77/1333734577.db2.gz	STXFOCPAVQFRRH-AQNXPRMDSA-N	0	3	342.483	3.092	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1CC[C@H](C(C)C)CC1)CCO2	ZINC000949217493	1333796993	/nfs/dbraw/zinc/79/69/93/1333796993.db2.gz	MHTHIKYROCUTON-WGSAOQKQSA-N	0	3	348.531	3.328	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H]1CCCC[C@@H]1CC)CCO2	ZINC000949221207	1333797626	/nfs/dbraw/zinc/79/76/26/1333797626.db2.gz	UZFKEQZCKXLBSG-ZWKOTPCHSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1cccc(C(C)C)c1)CCO2	ZINC000949223457	1333798329	/nfs/dbraw/zinc/79/83/29/1333798329.db2.gz	LSTNDHVIPPTSRU-UHFFFAOYSA-N	0	3	342.483	3.303	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)/C=C(/C)C3CC3)CC2)C1	ZINC000949310759	1333821339	/nfs/dbraw/zinc/82/13/39/1333821339.db2.gz	BWMHNMHQJWUPPV-VKAVYKQESA-N	0	3	332.488	3.002	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)c3cc(C)cs3)CC2)C1	ZINC000949362409	1333830477	/nfs/dbraw/zinc/83/04/77/1333830477.db2.gz	NRFHTRLTGPNQGA-UHFFFAOYSA-N	0	3	348.512	3.330	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3ccc(C)cc3F)CC2)C1	ZINC000949480570	1333858944	/nfs/dbraw/zinc/85/89/44/1333858944.db2.gz	UNYMFCBFXMSAHF-UHFFFAOYSA-N	0	3	346.446	3.017	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@H](C)C3CCCC3)CC2)C1	ZINC000949509488	1333863297	/nfs/dbraw/zinc/86/32/97/1333863297.db2.gz	SDSHHMNHFVTONL-QGZVFWFLSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3ccoc3CCC)CC2)C1	ZINC000949509308	1333863438	/nfs/dbraw/zinc/86/34/38/1333863438.db2.gz	ORURSVMRCJPNSF-UHFFFAOYSA-N	0	3	346.471	3.115	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2cc(-c3ccccc3)on2)C1	ZINC000967289047	1335690808	/nfs/dbraw/zinc/69/08/08/1335690808.db2.gz	QVMQXCPLBOVDHZ-YJBOKZPZSA-N	0	3	339.439	3.358	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2nc3ccccc3cc2C)C1	ZINC000967415975	1335731461	/nfs/dbraw/zinc/73/14/61/1335731461.db2.gz	YZJHAVWIXVQIIH-BEFAXECRSA-N	0	3	335.451	3.007	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)C2(c3cccc(F)c3)CC2)C1	ZINC000968375044	1335909443	/nfs/dbraw/zinc/90/94/43/1335909443.db2.gz	QTBMPRBMVXAYFU-CRAIPNDOSA-N	0	3	330.447	3.260	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](C)[C@@H](NC(=O)c2sc(CC)nc2C)C1	ZINC000968406026	1335922166	/nfs/dbraw/zinc/92/21/66/1335922166.db2.gz	WDLLEONJTPSPDO-HIFRSBDPSA-N	0	3	335.517	3.420	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](C)[C@H](NC(=O)c2cnc(C3CC3)s2)C1	ZINC000968565603	1335961250	/nfs/dbraw/zinc/96/12/50/1335961250.db2.gz	HRCUMPRRIXBSNS-UKRRQHHQSA-N	0	3	333.501	3.427	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2cccc(Cl)c2Cl)C1	ZINC000968584151	1335972964	/nfs/dbraw/zinc/97/29/64/1335972964.db2.gz	SZGSCTDTYRZIBM-SWLSCSKDSA-N	0	3	339.266	3.457	20	30		EGEDHN
Cc1csc(C(=O)N2CC[C@@H](NCc3ccc(F)c(C#N)c3)C2)c1	ZINC000968602239	1335981010	/nfs/dbraw/zinc/98/10/10/1335981010.db2.gz	DUJSRQIABIOUOM-OAHLLOKOSA-N	0	3	343.427	3.072	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2cccc3oc(C)nc32)C1	ZINC000968688931	1336012130	/nfs/dbraw/zinc/01/21/30/1336012130.db2.gz	QJWBNLCVCYWDAH-BBRMVZONSA-N	0	3	327.428	3.153	20	30		EGEDHN
C[C@@]1(C(=O)N2CC[C@@H](NCc3ccc(C#N)c(F)c3)C2)CC=CCC1	ZINC000968782906	1336048435	/nfs/dbraw/zinc/04/84/35/1336048435.db2.gz	FMYHKMMTBHBPDQ-YLJYHZDGSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1cc(COC)cs1	ZINC000968936893	1336096697	/nfs/dbraw/zinc/09/66/97/1336096697.db2.gz	UKEBRXGGVIRJFC-INIZCTEOSA-N	0	3	336.501	3.445	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1c[nH]nc1-c1ccccc1	ZINC000968971719	1336105699	/nfs/dbraw/zinc/10/56/99/1336105699.db2.gz	RPDPVDPZNSGZQI-QGZVFWFLSA-N	0	3	338.455	3.237	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)NC[C@@H]1CCCCCN1Cc1ccc(C#N)cc1	ZINC000968984367	1336108837	/nfs/dbraw/zinc/10/88/37/1336108837.db2.gz	AZBYYDIQFGVLHX-AYOQOUSVSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1cnc(C(C)C)nc1C	ZINC000969059511	1336133060	/nfs/dbraw/zinc/13/30/60/1336133060.db2.gz	MNEMBSSIENKPGX-QGZVFWFLSA-N	0	3	344.503	3.459	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cccc2[nH]c(C)nc21	ZINC000969101198	1336143700	/nfs/dbraw/zinc/14/37/00/1336143700.db2.gz	UGUNERPFXFIGPX-HNNXBMFYSA-N	0	3	326.444	3.032	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1cc2c(C)cccn2c1	ZINC000969115426	1336149651	/nfs/dbraw/zinc/14/96/51/1336149651.db2.gz	PJOXXUCOQHXGLA-LJQANCHMSA-N	0	3	337.467	3.245	20	30		EGEDHN
C#CCCN1CCCCC[C@@H]1CNC(=O)c1cnc(C2CC2)s1	ZINC000969122148	1336151190	/nfs/dbraw/zinc/15/11/90/1336151190.db2.gz	YEMLLPVQQGRUFK-OAHLLOKOSA-N	0	3	331.485	3.018	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1ccc(C)c2c1CCC2	ZINC000969156326	1336165992	/nfs/dbraw/zinc/16/59/92/1336165992.db2.gz	PPZAORCHUAEXFH-GOSISDBHSA-N	0	3	338.495	3.481	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccc(N(CC)CC)nc1	ZINC000969160893	1336167571	/nfs/dbraw/zinc/16/75/71/1336167571.db2.gz	MWLKLEQDWZDKKS-SFHVURJKSA-N	0	3	344.503	3.088	20	30		EGEDHN
C#CCCN1CC([C@H](C)NC(=O)c2csc3cc(C)ccc23)C1	ZINC000969748572	1336242725	/nfs/dbraw/zinc/24/27/25/1336242725.db2.gz	HOSZSEOTTYHFOL-AWEZNQCLSA-N	0	3	326.465	3.283	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2c(Cl)n[nH]c2C2CC2)CC1	ZINC001005490611	1336360412	/nfs/dbraw/zinc/36/04/12/1336360412.db2.gz	BRYPOBBRBUZZDN-UHFFFAOYSA-N	0	3	336.867	3.053	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cc3c([nH]2)c(F)ccc3C)CC1	ZINC001005626771	1336384396	/nfs/dbraw/zinc/38/43/96/1336384396.db2.gz	ZJIPHZSNDCFRBC-UHFFFAOYSA-N	0	3	329.419	3.338	20	30		EGEDHN
C=C1CCC(C(=O)N(C)C2CCN(CCOC3CCC3)CC2)CC1	ZINC001005936267	1336425995	/nfs/dbraw/zinc/42/59/95/1336425995.db2.gz	KFRLTGHYQLEJDV-UHFFFAOYSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccc(Cl)c(OC)c2)CC1	ZINC001006088484	1336450697	/nfs/dbraw/zinc/45/06/97/1336450697.db2.gz	RTGPXHCBAOEQQH-UHFFFAOYSA-N	0	3	336.863	3.461	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccc(-c3c[nH]cn3)cc2)CC1	ZINC001006238806	1336474330	/nfs/dbraw/zinc/47/43/30/1336474330.db2.gz	LTJUMTQSWRNRRY-UHFFFAOYSA-N	0	3	338.455	3.189	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cnn([C@H](C)CC)c2C)CC1	ZINC001006275345	1336479875	/nfs/dbraw/zinc/47/98/75/1336479875.db2.gz	OPPDRXBVWOPBKK-OAHLLOKOSA-N	0	3	332.492	3.275	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)Cc2c[nH]c3cccc(C)c23)CC1	ZINC001006304539	1336486600	/nfs/dbraw/zinc/48/66/00/1336486600.db2.gz	AYDJNINZSPLGDD-UHFFFAOYSA-N	0	3	325.456	3.128	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cccc3oc(C)nc32)CC1	ZINC001006458585	1336510160	/nfs/dbraw/zinc/51/01/60/1336510160.db2.gz	FOYHGPCWBXMMBG-UHFFFAOYSA-N	0	3	327.428	3.249	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CCCN(Cc2cccc(C)c2)C1	ZINC001007502445	1336659455	/nfs/dbraw/zinc/65/94/55/1336659455.db2.gz	JRDAQPVNUITSMK-LJQANCHMSA-N	0	3	337.467	3.377	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CCCN([C@@H](C)c3ccccc3C)C2)c1	ZINC001008469372	1336864761	/nfs/dbraw/zinc/86/47/61/1336864761.db2.gz	PRPXUUTTXUNBFP-PXNSSMCTSA-N	0	3	347.462	3.327	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2ncoc2-c2cccs2)C1	ZINC001008906016	1336941302	/nfs/dbraw/zinc/94/13/02/1336941302.db2.gz	QUXBPHGLXZXWDH-CYBMUJFWSA-N	0	3	331.441	3.173	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCN([C@@H](CC)c3ccccc3)C2)nc1	ZINC001009270825	1336994447	/nfs/dbraw/zinc/99/44/47/1336994447.db2.gz	TYZROJOIKYZTKQ-FPOVZHCZSA-N	0	3	347.462	3.408	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCN([C@H](CC)c3ccccc3)C2)nc1	ZINC001009270838	1336994497	/nfs/dbraw/zinc/99/44/97/1336994497.db2.gz	TYZROJOIKYZTKQ-PZJWPPBQSA-N	0	3	347.462	3.408	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)C[C@H]2CCc3ccccc3C2)C1	ZINC001009325084	1337007076	/nfs/dbraw/zinc/00/70/76/1337007076.db2.gz	HTKABRHAKVGMSC-FXAWDEMLSA-N	0	3	326.484	3.338	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CCN(Cc2cc(C)ccc2C)C1	ZINC001014726288	1337886992	/nfs/dbraw/zinc/88/69/92/1337886992.db2.gz	WYCDLUCHGYGZAI-IBGZPJMESA-N	0	3	337.467	3.295	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CCN(Cc2ccc3cc[nH]c3c2)C1	ZINC001014730569	1337889354	/nfs/dbraw/zinc/88/93/54/1337889354.db2.gz	CUQLQJDGRQHBES-SFHVURJKSA-N	0	3	348.450	3.160	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N[C@@H]1CCN(Cc2cc(C)sc2C)C1	ZINC001015828944	1338328976	/nfs/dbraw/zinc/32/89/76/1338328976.db2.gz	NAVLTAFBJBDLEA-SQNIBIBYSA-N	0	3	348.512	3.037	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccc3nccc(C)c3c2)CC1	ZINC001016637198	1338672321	/nfs/dbraw/zinc/67/23/21/1338672321.db2.gz	AFVHRSVOKGEYOD-HXUWFJFHSA-N	0	3	347.462	3.151	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccc(-c3ccco3)o2)CC1	ZINC001016727260	1338704075	/nfs/dbraw/zinc/70/40/75/1338704075.db2.gz	QXQUUOXMBYHNHB-GOSISDBHSA-N	0	3	338.407	3.147	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccc(C)c(Cl)c2F)CC1	ZINC001016746273	1338710530	/nfs/dbraw/zinc/71/05/30/1338710530.db2.gz	ULUXVAOGMGNTRB-OAHLLOKOSA-N	0	3	348.849	3.395	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)C(C2CCC2)C2CCC2)CC1	ZINC001016798696	1338731090	/nfs/dbraw/zinc/73/10/90/1338731090.db2.gz	RVTXNOKVJAEYCQ-SFHVURJKSA-N	0	3	328.500	3.197	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)Cc2cccc(Cl)c2F)CC1	ZINC001016846221	1338745776	/nfs/dbraw/zinc/74/57/76/1338745776.db2.gz	BMMMKAYEJCGVRL-MRXNPFEDSA-N	0	3	348.849	3.016	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cc(C(CC)CC)no2)CC1	ZINC001016868901	1338753216	/nfs/dbraw/zinc/75/32/16/1338753216.db2.gz	ZGHARPGVRSYOQI-GOSISDBHSA-N	0	3	343.471	3.186	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)Cc2c[nH]c3cc(C)ccc23)CC1	ZINC001016875162	1338755655	/nfs/dbraw/zinc/75/56/55/1338755655.db2.gz	JYUYNNFTZDBVPZ-FQEVSTJZSA-N	0	3	349.478	3.013	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cc(C(C)C)oc2C)CC1	ZINC001016907456	1338765956	/nfs/dbraw/zinc/76/59/56/1338765956.db2.gz	RUTOAZWMOGWRRU-SFHVURJKSA-N	0	3	328.456	3.319	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)[C@H](C)c2cc3ccccc3o2)CC1	ZINC001016921281	1338770453	/nfs/dbraw/zinc/77/04/53/1338770453.db2.gz	PULGPUWUSBBQRF-BEFAXECRSA-N	0	3	336.435	3.140	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccc(C3CC3)s2)CC1	ZINC001016931784	1338773837	/nfs/dbraw/zinc/77/38/37/1338773837.db2.gz	WESYFMCCDOYHCU-QGZVFWFLSA-N	0	3	328.481	3.233	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2cc3cc(C)c(C)cc3o2)CC1	ZINC001016933261	1338773849	/nfs/dbraw/zinc/77/38/49/1338773849.db2.gz	HZADRJGRFFXTRL-IBGZPJMESA-N	0	3	336.435	3.267	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)C2CCC(C3CC3)CC2)CC1	ZINC001016953176	1338782418	/nfs/dbraw/zinc/78/24/18/1338782418.db2.gz	BRYQPDYWRWJKGR-ACBHZAAOSA-N	0	3	328.500	3.197	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccc3[nH]c(C)c(C)c3c2)CC1	ZINC001016969974	1338787296	/nfs/dbraw/zinc/78/72/96/1338787296.db2.gz	YJHPSJNKGKBMNE-FQEVSTJZSA-N	0	3	349.478	3.392	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2sccc2C(C)C)CC1	ZINC001016982877	1338791708	/nfs/dbraw/zinc/79/17/08/1338791708.db2.gz	NCASEPSTDYFPIP-MRXNPFEDSA-N	0	3	330.497	3.479	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2oc3c(cccc3C)c2C)CC1	ZINC001016986745	1338793324	/nfs/dbraw/zinc/79/33/24/1338793324.db2.gz	SZTYYTRBWFUHJX-KRWDZBQOSA-N	0	3	336.435	3.267	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCCN(C(=O)CC2(C)CC2)C1	ZINC001017164240	1338912138	/nfs/dbraw/zinc/91/21/38/1338912138.db2.gz	VXRRZFUTTNCFPD-HNNXBMFYSA-N	0	3	345.512	3.480	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](CN(C)Cc2cncc(C)c2)C1	ZINC001017179815	1338923891	/nfs/dbraw/zinc/92/38/91/1338923891.db2.gz	PMIYBTKCRKOEDB-QGZVFWFLSA-N	0	3	329.488	3.273	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H](CN(C)Cc2ccc(F)cn2)C1	ZINC001017179699	1338924137	/nfs/dbraw/zinc/92/41/37/1338924137.db2.gz	MVRQEMUELPJDAR-MRXNPFEDSA-N	0	3	347.478	3.493	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@@H](CN(C)Cc3cccnc3)C2)CC1	ZINC001017197036	1338942545	/nfs/dbraw/zinc/94/25/45/1338942545.db2.gz	MQLQAFWLCYJPFF-IBGZPJMESA-N	0	3	341.499	3.498	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H](CN(C)Cc2cn(C)nc2C)C1	ZINC001017201676	1338947287	/nfs/dbraw/zinc/94/72/87/1338947287.db2.gz	KRXGZBBRMGGPRU-YLJYHZDGSA-N	0	3	346.519	3.001	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H](CN(C)Cc3c(C)noc3C)C2)C1	ZINC001017206593	1338952938	/nfs/dbraw/zinc/95/29/38/1338952938.db2.gz	JYYPYBSHBSHMOU-QGZVFWFLSA-N	0	3	345.487	3.318	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccccc1COC	ZINC001017704150	1339395586	/nfs/dbraw/zinc/39/55/86/1339395586.db2.gz	BMWKUSDKCNUUIR-HDICACEKSA-N	0	3	328.456	3.088	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccnc(C2CC2)c1	ZINC001017709404	1339397192	/nfs/dbraw/zinc/39/71/92/1339397192.db2.gz	NPQNOBSRPXZEIV-HDICACEKSA-N	0	3	325.456	3.214	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](OC)c1ccccc1	ZINC001018196013	1339527765	/nfs/dbraw/zinc/52/77/65/1339527765.db2.gz	YGZPWKLMZNXMMZ-CEXWTWQISA-N	0	3	328.456	3.016	20	30		EGEDHN
N#Cc1cc(CN[C@H]2CCN(C(=O)C3=CCCCCC3)C2)ccc1F	ZINC001018762793	1339721405	/nfs/dbraw/zinc/72/14/05/1339721405.db2.gz	NUJXZLLLJVZAKC-SFHVURJKSA-N	0	3	341.430	3.278	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)NC[C@@H]1CCCN1Cc1cc(C)sc1C	ZINC001028147274	1340452545	/nfs/dbraw/zinc/45/25/45/1340452545.db2.gz	SRMRCBBSFUVGCG-KSZLIROESA-N	0	3	348.512	3.037	20	30		EGEDHN
C=CCCN1CCC[C@H]1CNC(=O)c1cnc(-c2ccoc2)s1	ZINC001028186347	1340474670	/nfs/dbraw/zinc/47/46/70/1340474670.db2.gz	IYNJYHIVLCTZPG-AWEZNQCLSA-N	0	3	331.441	3.173	20	30		EGEDHN
C=CCN1CCC[C@@H]1CNC(=O)[C@@H]1CCCO[C@H]1c1ccc(C)cc1	ZINC001028189833	1340475958	/nfs/dbraw/zinc/47/59/58/1340475958.db2.gz	IOMBWFNOWYWIAZ-AQNXPRMDSA-N	0	3	342.483	3.229	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1cc(C)n(CC2CC2)c1C	ZINC001028264873	1340521431	/nfs/dbraw/zinc/52/14/31/1340521431.db2.gz	QBPXWJYJVBJNPT-GOSISDBHSA-N	0	3	329.488	3.285	20	30		EGEDHN
CC1(C)C(C(=O)NC[C@H]2CCN(Cc3cccc(C#N)c3)C2)C1(C)C	ZINC001028467372	1340656880	/nfs/dbraw/zinc/65/68/80/1340656880.db2.gz	BTNDOKNBJNIGHZ-QGZVFWFLSA-N	0	3	339.483	3.179	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H](CNC(=O)c3ccoc3Cl)C2)c1	ZINC001028502527	1340674645	/nfs/dbraw/zinc/67/46/45/1340674645.db2.gz	YVEONRFJYDTJAR-OAHLLOKOSA-N	0	3	343.814	3.057	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)c2cc3ccc(F)cc3s2)C1	ZINC001028668813	1340748651	/nfs/dbraw/zinc/74/86/51/1340748651.db2.gz	JXTNVISIEPIEAP-ZDUSSCGKSA-N	0	3	330.428	3.115	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCN(Cc3cccc(F)c3)C2)cc1	ZINC001028730060	1340778718	/nfs/dbraw/zinc/77/87/18/1340778718.db2.gz	CZQFELJFUAFHHM-SFHVURJKSA-N	0	3	336.410	3.059	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](CNC(=O)C3CC4(CCC4)C3)C2)cc1	ZINC001028746242	1340786880	/nfs/dbraw/zinc/78/68/80/1340786880.db2.gz	ADRZAUDIJMDHMZ-GOSISDBHSA-N	0	3	337.467	3.077	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)NC[C@@H]1CCN(Cc2ccsc2)C1	ZINC001028855398	1340862818	/nfs/dbraw/zinc/86/28/18/1340862818.db2.gz	BCRIJBMSOHGKCO-SZMVWBNQSA-N	0	3	348.512	3.058	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)C1CCN(C(=O)/C=C/C2CC2)CC1	ZINC001029074300	1340923766	/nfs/dbraw/zinc/92/37/66/1340923766.db2.gz	LZNBWKZYLJVZIZ-FDMDGMSGSA-N	0	3	337.467	3.241	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)C1CCN(C(=O)[C@H]2CC2(C)C)CC1	ZINC001029083080	1340927040	/nfs/dbraw/zinc/92/70/40/1340927040.db2.gz	QSIKZXKLPBJFLX-DNVCBOLYSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC([C@@H](C)NCc2nccn2CC)CC1	ZINC001029136748	1340939828	/nfs/dbraw/zinc/93/98/28/1340939828.db2.gz	KYMXWSPWHYWSTN-UZLBHIALSA-N	0	3	346.519	3.222	20	30		EGEDHN
CCC1(C(=O)N2CCC([C@H](C)NCc3ccccc3C#N)CC2)CC1	ZINC001029139230	1340940536	/nfs/dbraw/zinc/94/05/36/1340940536.db2.gz	AYRHJOSTLMDDPY-INIZCTEOSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@H](CN(C)Cc2ocnc2C)C1	ZINC001029749007	1341062761	/nfs/dbraw/zinc/06/27/61/1341062761.db2.gz	QVQDJELFVVDESB-CQSZACIVSA-N	0	3	339.867	3.042	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](CN(C)Cc3ccc(F)cn3)C2)CC1	ZINC001029826049	1341087604	/nfs/dbraw/zinc/08/76/04/1341087604.db2.gz	LMTZCOPJYIYKOJ-MRXNPFEDSA-N	0	3	345.462	3.247	20	30		EGEDHN
CC(C)=CC(=O)N1CCC(CN(C)Cc2ccc(C#N)s2)CC1	ZINC001029929506	1341124574	/nfs/dbraw/zinc/12/45/74/1341124574.db2.gz	UXMORGJDUSRWDW-UHFFFAOYSA-N	0	3	331.485	3.256	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC(CN(C)Cc2ccccc2Cl)CC1	ZINC001029946702	1341130857	/nfs/dbraw/zinc/13/08/57/1341130857.db2.gz	TUFAAHUYKXBHPK-CQSZACIVSA-N	0	3	333.863	3.170	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC(CN(C)Cc3cncc(F)c3)CC2)C1	ZINC001029993633	1341150146	/nfs/dbraw/zinc/15/01/46/1341150146.db2.gz	KTRFHUGHUCUSHN-UHFFFAOYSA-N	0	3	345.462	3.247	20	30		EGEDHN
C=CCn1cccc1C(=O)NCC1CN(Cc2ccccc2CC)C1	ZINC001031731309	1341394418	/nfs/dbraw/zinc/39/44/18/1341394418.db2.gz	SHKIOOBXPIQLNO-UHFFFAOYSA-N	0	3	337.467	3.098	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(F)c2occc21	ZINC001032792815	1341614987	/nfs/dbraw/zinc/61/49/87/1341614987.db2.gz	NHZWBMROBXSUNI-KBPBESRZSA-N	0	3	328.387	3.437	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)[C@@H]2CCCC[C@@H]2C(F)(F)F)C1	ZINC001033191245	1341748749	/nfs/dbraw/zinc/74/87/49/1341748749.db2.gz	HBVUHLHHBZNPGK-KFWWJZLASA-N	0	3	332.410	3.464	20	30		EGEDHN
C#CCCN1CC[C@@H](N(C)C(=O)c2cc(C3CC3)oc2C2CC2)C1	ZINC001033282707	1341766769	/nfs/dbraw/zinc/76/67/69/1341766769.db2.gz	JZAMLWQAVUFUDP-MRXNPFEDSA-N	0	3	326.440	3.204	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)C[C@@H]2CCOc3ccccc32)C1	ZINC001033335014	1341785895	/nfs/dbraw/zinc/78/58/95/1341785895.db2.gz	ZAMUZOSPZXVMCG-DLBZAZTESA-N	0	3	328.456	3.052	20	30		EGEDHN
C#CCCN1CC[C@H](N(C)C(=O)C(C)(C)c2ccc(Cl)cc2)C1	ZINC001033383344	1341805140	/nfs/dbraw/zinc/80/51/40/1341805140.db2.gz	JVWXINKSCZZYBE-KRWDZBQOSA-N	0	3	332.875	3.174	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N(C)[C@H]1CCN(Cc2cccc(C)c2)C1	ZINC001033617583	1341905313	/nfs/dbraw/zinc/90/53/13/1341905313.db2.gz	WBKYIIAAUVDULS-QFIPXVFZSA-N	0	3	346.474	3.252	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2ccc(N(C)C(C)C)cc2)C1	ZINC001033700839	1341966967	/nfs/dbraw/zinc/96/69/67/1341966967.db2.gz	BPJJTVTUFSLNQL-LJQANCHMSA-N	0	3	329.488	3.254	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)[C@@H]2C[C@H]2c2sccc2C)C1	ZINC001033838031	1342035814	/nfs/dbraw/zinc/03/58/14/1342035814.db2.gz	VWSHGYSIDGNYTM-GVDBMIGSSA-N	0	3	330.497	3.106	20	30		EGEDHN
C=CCCN1CC[C@@H](N(CC)C(=O)c2oc(CC3CC3)nc2C)C1	ZINC001033837036	1342035817	/nfs/dbraw/zinc/03/58/17/1342035817.db2.gz	QPLRVSKXOFXWQD-MRXNPFEDSA-N	0	3	331.460	3.048	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccc(C(C)(C)C)cn2)C1	ZINC001033838318	1342035866	/nfs/dbraw/zinc/03/58/66/1342035866.db2.gz	RSORKZJCZNHAAO-QGZVFWFLSA-N	0	3	329.488	3.492	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@@H]2C[C@]2(C)c2ccccc2)C1	ZINC001033900043	1342071459	/nfs/dbraw/zinc/07/14/59/1342071459.db2.gz	MDXLRNYCWDVFQQ-IRFCIJBXSA-N	0	3	326.484	3.463	20	30		EGEDHN
C=CCCN1CC[C@@H](N(CC)C(=O)c2cc3ncccc3s2)C1	ZINC001033914427	1342083413	/nfs/dbraw/zinc/08/34/13/1342083413.db2.gz	CKWVTZGYYJYZMX-CQSZACIVSA-N	0	3	329.469	3.409	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2nsc3ccc(C)cc32)C1	ZINC001033920118	1342089029	/nfs/dbraw/zinc/08/90/29/1342089029.db2.gz	PUSAVGKCAFVJLI-OAHLLOKOSA-N	0	3	341.480	3.164	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2c[nH]c(-c3ccccc3)n2)C1	ZINC001033973299	1342122850	/nfs/dbraw/zinc/12/28/50/1342122850.db2.gz	XHHOUJFGQNOHGO-KRWDZBQOSA-N	0	3	338.455	3.189	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cc(F)cc3cccnc32)C1	ZINC001033973323	1342123988	/nfs/dbraw/zinc/12/39/88/1342123988.db2.gz	CCBJZJOLVMFJIB-QGZVFWFLSA-N	0	3	341.430	3.486	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccc(COC)c(F)c2)C1	ZINC001034026849	1342165382	/nfs/dbraw/zinc/16/53/82/1342165382.db2.gz	WDLLAXUWHYUKSR-QGZVFWFLSA-N	0	3	334.435	3.085	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2ccc(C(F)(F)F)cc2)C1	ZINC001034030127	1342169453	/nfs/dbraw/zinc/16/94/53/1342169453.db2.gz	REEADPCCRJANGB-INIZCTEOSA-N	0	3	338.373	3.265	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cc(OC)c(OC)cc2C)C1	ZINC001034048692	1342189315	/nfs/dbraw/zinc/18/93/15/1342189315.db2.gz	SLLYELIILPWPDH-INIZCTEOSA-N	0	3	346.471	3.125	20	30		EGEDHN
N#Cc1ccc(CN2CCCC[C@@H](NC(=O)C[C@@H]3C=CCC3)C2)cc1	ZINC001034092195	1342231625	/nfs/dbraw/zinc/23/16/25/1342231625.db2.gz	URTTUDRHDJTSOG-YLJYHZDGSA-N	0	3	337.467	3.385	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cn(C(C)(C)C)nc2C)C1	ZINC001034200590	1342310678	/nfs/dbraw/zinc/31/06/78/1342310678.db2.gz	QRIXNWFMPOLOIS-INIZCTEOSA-N	0	3	332.492	3.107	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)Cc2coc3ccc(C)cc23)C1	ZINC001034228816	1342332701	/nfs/dbraw/zinc/33/27/01/1342332701.db2.gz	ACWIUXNHRQGBLI-QGZVFWFLSA-N	0	3	326.440	3.440	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@@H]2CCN(C)c3ccccc32)C1	ZINC001034247885	1342345669	/nfs/dbraw/zinc/34/56/69/1342345669.db2.gz	VSPSGOLJGAXYLF-IEBWSBKVSA-N	0	3	341.499	3.157	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)c2ccc(-c3cnco3)cc2)C1	ZINC001034277657	1342368259	/nfs/dbraw/zinc/36/82/59/1342368259.db2.gz	RTTAHVFFQNWHJE-KRWDZBQOSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccn(-c3ccccc3)n2)C1	ZINC001034281649	1342371247	/nfs/dbraw/zinc/37/12/47/1342371247.db2.gz	CSTNGAUWQRTEOQ-QGZVFWFLSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@H]2CCOc3c(F)cccc32)C1	ZINC001034296264	1342379482	/nfs/dbraw/zinc/37/94/82/1342379482.db2.gz	NLPPMCWUPRWSMD-WBVHZDCISA-N	0	3	346.446	3.239	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2ccc3cc(C)ccc3n2)C1	ZINC001034299544	1342382499	/nfs/dbraw/zinc/38/24/99/1342382499.db2.gz	HEVDDCPGXTTWBS-GOSISDBHSA-N	0	3	335.451	3.151	20	30		EGEDHN
C=CCCN1CCCC[C@H](NC(=O)c2scnc2C(F)F)C1	ZINC001034301304	1342384131	/nfs/dbraw/zinc/38/41/31/1342384131.db2.gz	JFMORHJQVBNUPO-NSHDSACASA-N	0	3	329.416	3.241	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCCCN(C[C@@H](O)c3ccccc3)C2)C1	ZINC001034390396	1342460021	/nfs/dbraw/zinc/46/00/21/1342460021.db2.gz	ZSRAFJOGLOPDED-RBUKOAKNSA-N	0	3	342.483	3.047	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)Cc2noc3ccc(F)cc23)C1	ZINC001034438312	1342500025	/nfs/dbraw/zinc/50/00/25/1342500025.db2.gz	CRRZRESFPHYPCA-HNNXBMFYSA-N	0	3	345.418	3.056	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cccc(-n3cccn3)c2)C1	ZINC001034449504	1342509475	/nfs/dbraw/zinc/50/94/75/1342509475.db2.gz	VEXZFKYFJLKSIJ-SFHVURJKSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccnc(C(F)(F)F)c2)C1	ZINC001034471650	1342526334	/nfs/dbraw/zinc/52/63/34/1342526334.db2.gz	JNOBPQPDPHPDFD-CQSZACIVSA-N	0	3	341.377	3.261	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2c(C)nn(CCC)c2C)C1	ZINC001034476173	1342532365	/nfs/dbraw/zinc/53/23/65/1342532365.db2.gz	GRSOENCCDJMPQJ-QGZVFWFLSA-N	0	3	332.492	3.070	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)C(C)(C)c2cccc(OC)c2)C1	ZINC001034477414	1342533978	/nfs/dbraw/zinc/53/39/78/1342533978.db2.gz	NPDSLZHNFTXTIA-KRWDZBQOSA-N	0	3	330.472	3.130	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccnc(OC(C)C)c2)C1	ZINC001034482945	1342539776	/nfs/dbraw/zinc/53/97/76/1342539776.db2.gz	NFYKWKMNVYGPFZ-QGZVFWFLSA-N	0	3	331.460	3.029	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)[C@@]2(c3ccccc3)C[C@H](F)C2)C1	ZINC001034508903	1342568221	/nfs/dbraw/zinc/56/82/21/1342568221.db2.gz	RSWMQJNSERNIJQ-QWFCFKBJSA-N	0	3	330.447	3.213	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc(OCC3CC3)nc2)C1	ZINC001034537821	1342595381	/nfs/dbraw/zinc/59/53/81/1342595381.db2.gz	FBHUDWHJKPMSHT-SFHVURJKSA-N	0	3	343.471	3.031	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CC[C@H](NCc3nccn3CC)CC2)CC1	ZINC001034724754	1342718315	/nfs/dbraw/zinc/71/83/15/1342718315.db2.gz	SKDQRUJRBGAHLC-IYARVYRRSA-N	0	3	344.503	3.166	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC[C@H](N[C@@H](C)c3cnc(C)cn3)CC2)C1	ZINC001034729879	1342724831	/nfs/dbraw/zinc/72/48/31/1342724831.db2.gz	QMBCTDZLDNKOTA-ULQDDVLXSA-N	0	3	342.487	3.219	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001035012190	1342875201	/nfs/dbraw/zinc/87/52/01/1342875201.db2.gz	VHKUVQZBHGMKKN-QGZVFWFLSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]2CNCc2ccc(Cl)nc2)C1	ZINC001035041173	1342893430	/nfs/dbraw/zinc/89/34/30/1342893430.db2.gz	JRIPLNSCSNPSRK-OAHLLOKOSA-N	0	3	333.863	3.172	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)c(F)c2)C1	ZINC001035044717	1342896810	/nfs/dbraw/zinc/89/68/10/1342896810.db2.gz	NSQIESHDOCBFSK-QGZVFWFLSA-N	0	3	341.430	3.134	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001035067272	1342907994	/nfs/dbraw/zinc/90/79/94/1342907994.db2.gz	LNVFGHQZQPUARR-WMLDXEAASA-N	0	3	331.435	3.070	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)[C@H]2CC23CCCC3)s1	ZINC001035096181	1342923956	/nfs/dbraw/zinc/92/39/56/1342923956.db2.gz	PTVHRJNLGKBCII-RHSMWYFYSA-N	0	3	343.496	3.281	20	30		EGEDHN
C=C[C@H](C(=O)N1CCC[C@@H]1CNCc1ccns1)c1ccccc1	ZINC001035130721	1342947038	/nfs/dbraw/zinc/94/70/38/1342947038.db2.gz	AOJWHCXHBFDKIK-AEFFLSMTSA-N	0	3	341.480	3.194	20	30		EGEDHN
O=C(CC1CC1)N1CCC2(CCN(CC#Cc3ccccc3)C2)CC1	ZINC001035150694	1342964110	/nfs/dbraw/zinc/96/41/10/1342964110.db2.gz	DJYGFWCHSCRVFT-UHFFFAOYSA-N	0	3	336.479	3.153	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N1CCC2(CCN(Cc3ccccc3C#N)C2)CC1	ZINC001035154756	1342968944	/nfs/dbraw/zinc/96/89/44/1342968944.db2.gz	YTCQNPMYBXGBTE-LPHOPBHVSA-N	0	3	337.467	3.029	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC2(CCN(Cc3ccccc3Cl)C2)CC1	ZINC001035167996	1342984779	/nfs/dbraw/zinc/98/47/79/1342984779.db2.gz	QEJHSOPDBFPAFU-OAHLLOKOSA-N	0	3	345.874	3.314	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC3(CCN(C/C=C/Cl)C3)CC2)cc1	ZINC001035213305	1343031153	/nfs/dbraw/zinc/03/11/53/1343031153.db2.gz	VMSFELBUDMTOIW-QDEBKDIKSA-N	0	3	342.870	3.349	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC2(CCN(Cc3conc3CC)C2)CC1	ZINC001035213049	1343031494	/nfs/dbraw/zinc/03/14/94/1343031494.db2.gz	DEBVFFDUHHZUBK-UHFFFAOYSA-N	0	3	345.487	3.264	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1conc1C1CCCC1)CC2	ZINC001035723673	1343153667	/nfs/dbraw/zinc/15/36/67/1343153667.db2.gz	YKUOSIDNHBNQRJ-UHFFFAOYSA-N	0	3	343.471	3.446	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)Cc1ccc(C)c(Cl)c1)CC2	ZINC001035729470	1343156649	/nfs/dbraw/zinc/15/66/49/1343156649.db2.gz	GGQNIQNDPRKERA-UHFFFAOYSA-N	0	3	344.886	3.139	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)CCc1ccc(F)cc1)CC2	ZINC001035742573	1343163874	/nfs/dbraw/zinc/16/38/74/1343163874.db2.gz	IWXBIHWQGKTRDX-UHFFFAOYSA-N	0	3	330.447	3.259	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC2(CN(C[C@H]3CCCCO3)C2)CC1	ZINC001035785507	1343196304	/nfs/dbraw/zinc/19/63/04/1343196304.db2.gz	ULZSPKBDDKQUJJ-IEBWSBKVSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC3(CN(C[C@@H]4CC(C)(C)CO4)C3)CC2)C1	ZINC001035788327	1343200137	/nfs/dbraw/zinc/20/01/37/1343200137.db2.gz	DVFKNMICOIXSMF-KRWDZBQOSA-N	0	3	346.515	3.082	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@H](C)OC1CCCCCC1)CC2	ZINC001035790865	1343201755	/nfs/dbraw/zinc/20/17/55/1343201755.db2.gz	WHGBIWBHOIULTK-SFHVURJKSA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@]1(C)CC[C@H](C)C1(C)C)CC2	ZINC001035810418	1343210028	/nfs/dbraw/zinc/21/00/28/1343210028.db2.gz	KPVLBQOABXVFFG-PXNSSMCTSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@H]1CC[C@H](C(C)C)CC1)CC2	ZINC001035822898	1343215493	/nfs/dbraw/zinc/21/54/93/1343215493.db2.gz	PSSRZFHOAGPZOO-WGSAOQKQSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccc3nc(C)ccc3c1)CC2	ZINC001035822118	1343215804	/nfs/dbraw/zinc/21/58/04/1343215804.db2.gz	RZBPCBVUAYRKNM-UHFFFAOYSA-N	0	3	347.462	3.105	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@H](C)c1ccc(C)s1)CC2	ZINC001035838528	1343221169	/nfs/dbraw/zinc/22/11/69/1343221169.db2.gz	CKQBTICDMDLFTO-MRXNPFEDSA-N	0	3	330.497	3.108	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)C1CCC(C3CC3)CC1)CC2	ZINC001035844175	1343225809	/nfs/dbraw/zinc/22/58/09/1343225809.db2.gz	AYZMOLLTKNZAFZ-UHFFFAOYSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)Cc1ccc3ccccc3c1)CC2	ZINC001035849767	1343229601	/nfs/dbraw/zinc/22/96/01/1343229601.db2.gz	GXNPBWBSATZUNK-UHFFFAOYSA-N	0	3	346.474	3.330	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc(C)n(C(C)(C)C)n1)CC2	ZINC001035852872	1343230671	/nfs/dbraw/zinc/23/06/71/1343230671.db2.gz	OIBSKKGHYSTAGY-UHFFFAOYSA-N	0	3	344.503	3.061	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H](C)c1cccc(F)c1)CC2	ZINC001035855690	1343232271	/nfs/dbraw/zinc/23/22/71/1343232271.db2.gz	UQUPNTLUOCHUGA-INIZCTEOSA-N	0	3	330.447	3.430	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@@H](C)c1ccc(F)cc1F)CC2	ZINC001035855750	1343232689	/nfs/dbraw/zinc/23/26/89/1343232689.db2.gz	VKLMXRRJJQCWRO-HNNXBMFYSA-N	0	3	346.421	3.016	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1c[nH]c3ccc(C)cc13)CC2	ZINC001035857724	1343233753	/nfs/dbraw/zinc/23/37/53/1343233753.db2.gz	RJZXAAGCCMJGLI-UHFFFAOYSA-N	0	3	335.451	3.038	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@@H](NCc2ccccc2C#N)[C@@H](C)C1	ZINC001035918863	1343272476	/nfs/dbraw/zinc/27/24/76/1343272476.db2.gz	KIMSDBTVOIMIKR-HNAYVOBHSA-N	0	3	327.472	3.321	20	30		EGEDHN
Cc1ccoc1C(=O)N1CC[C@@H](NCc2ccccc2C#N)[C@H](C)C1	ZINC001035924523	1343275183	/nfs/dbraw/zinc/27/51/83/1343275183.db2.gz	SHRIULCONHRWFW-CRAIPNDOSA-N	0	3	337.423	3.100	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@H](NCc2ccccc2C#N)[C@@H](C)C1	ZINC001035981587	1343299356	/nfs/dbraw/zinc/29/93/56/1343299356.db2.gz	SVCMBLOTPJITNO-YOEHRIQHSA-N	0	3	329.419	3.148	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@@H](NCc2cc(F)ccc2C#N)[C@H](C)C1	ZINC001035990053	1343303364	/nfs/dbraw/zinc/30/33/64/1343303364.db2.gz	FAPJIUODXKHMOV-CXAGYDPISA-N	0	3	347.409	3.287	20	30		EGEDHN
Cc1coc(C(=O)N2CC[C@@H](NCc3ccccc3C#N)[C@@H](C)C2)c1	ZINC001036148234	1343329653	/nfs/dbraw/zinc/32/96/53/1343329653.db2.gz	ZQHPVYZTTSCMBP-MAUKXSAKSA-N	0	3	337.423	3.100	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](NCc2csc(CC)n2)[C@@H](C)C1	ZINC001036148718	1343330728	/nfs/dbraw/zinc/33/07/28/1343330728.db2.gz	FTCCTYNWPYLDRW-ZFWWWQNUSA-N	0	3	335.517	3.244	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](NCc3cc(C4CC4)no3)[C@@H](C)C2)C1	ZINC001036171391	1343344176	/nfs/dbraw/zinc/34/41/76/1343344176.db2.gz	XHQPSVXXRFFBQB-WMLDXEAASA-N	0	3	343.471	3.235	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@H](C)[C@@H]1CNCc1cc(C#N)ccc1F	ZINC001036503306	1343521627	/nfs/dbraw/zinc/52/16/27/1343521627.db2.gz	MWLQTSFPLRUFLL-KXBFYZLASA-N	0	3	343.446	3.380	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@@H](C)[C@@H]1CNCc1cc(C#N)ccc1F	ZINC001036510750	1343526674	/nfs/dbraw/zinc/52/66/74/1343526674.db2.gz	QRASJHBFSLAGRN-KDOFPFPSSA-N	0	3	331.435	3.070	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC[C@H](C)[C@@H]1CNCc1ccc(C#N)s1	ZINC001036533043	1343540528	/nfs/dbraw/zinc/54/05/28/1343540528.db2.gz	LXUMEYUTTBZZMG-PVVMPVRASA-N	0	3	331.485	3.303	20	30		EGEDHN
CCC(=O)N1CC[C@H]2[C@H](CCN2CC#Cc2cccc(Cl)c2)C1	ZINC001036607803	1343572327	/nfs/dbraw/zinc/57/23/27/1343572327.db2.gz	BGOIRKHPWCAGDO-AEFFLSMTSA-N	0	3	330.859	3.024	20	30		EGEDHN
O=C(C1CCCC1)N1CC[C@@H]2[C@H](CCN2CC#Cc2ccccc2)C1	ZINC001036621544	1343580435	/nfs/dbraw/zinc/58/04/35/1343580435.db2.gz	VIQFXHSMMJHBNX-NHCUHLMSSA-N	0	3	336.479	3.151	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@H]2[C@H](CCN2Cc2sccc2Cl)C1	ZINC001036714038	1343646934	/nfs/dbraw/zinc/64/69/34/1343646934.db2.gz	RWEMMJIKSZWNIJ-ZBFHGGJFSA-N	0	3	348.899	3.238	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H]3[C@H](CCN3Cc3conc3C)C2)CC1	ZINC001036810888	1343745674	/nfs/dbraw/zinc/74/56/74/1343745674.db2.gz	JONXIIPRVPESNP-IEBWSBKVSA-N	0	3	343.471	3.152	20	30		EGEDHN
CCC1(C(=O)N2CC[C@H]3[C@@H](CCN3Cc3ccc(C#N)s3)C2)CC1	ZINC001036814090	1343750880	/nfs/dbraw/zinc/75/08/80/1343750880.db2.gz	IXYHUVIXTDECBN-YOEHRIQHSA-N	0	3	343.496	3.233	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCC[C@@H]1NC(=O)CC1CCC1	ZINC001036970611	1343900461	/nfs/dbraw/zinc/90/04/61/1343900461.db2.gz	PBZUOJUNGNLARY-MOPGFXCFSA-N	0	3	325.456	3.123	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCC[C@H]2CNCc2nc(C)sc2C)C1	ZINC001037075532	1343968302	/nfs/dbraw/zinc/96/83/02/1343968302.db2.gz	QWUBXYWUWWUZCF-HOTGVXAUSA-N	0	3	347.528	3.491	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCC[C@@H]1NC(=O)c1ccncc1	ZINC001037162788	1344010941	/nfs/dbraw/zinc/01/09/41/1344010941.db2.gz	OHNAVAZJMLCSEC-PMACEKPBSA-N	0	3	348.450	3.032	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCCC[C@H]2CNCc2cc(C)no2)C1	ZINC001037236525	1344060013	/nfs/dbraw/zinc/06/00/13/1344060013.db2.gz	RPUNVXSYLBWEMY-RDJZCZTQSA-N	0	3	331.460	3.104	20	30		EGEDHN
CC[C@@H]1CN(C(=O)C(C)(C)F)CC[C@@H]1NCc1cc(F)ccc1C#N	ZINC001037760655	1344075610	/nfs/dbraw/zinc/07/56/10/1344075610.db2.gz	HIQLMLRLGHGSND-DYVFJYSZSA-N	0	3	349.425	3.162	20	30		EGEDHN
CC[C@@H]1CN(C(=O)C=C(C)C)CC[C@H]1NCc1cc(F)ccc1C#N	ZINC001037781544	1344092122	/nfs/dbraw/zinc/09/21/22/1344092122.db2.gz	WBSNOMDQRWDVOM-DNVCBOLYSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](NCc3nc(C)oc3C)[C@@H](CC)C2)C1	ZINC001037914874	1344175831	/nfs/dbraw/zinc/17/58/31/1344175831.db2.gz	NNEAKJHJJLITLP-DLBZAZTESA-N	0	3	345.487	3.364	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1c(C)nn(C(C)(C)C)c1C	ZINC001038331115	1344383777	/nfs/dbraw/zinc/38/37/77/1344383777.db2.gz	USHZHVQNLAKGCD-MRXNPFEDSA-N	0	3	332.492	3.025	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C[C@H]2C=CCC2)CC[C@H]1c1ccc(F)cc1	ZINC001079148937	1357196491	/nfs/dbraw/zinc/19/64/91/1357196491.db2.gz	UBOPFFFODCGZQJ-FFZOFVMBSA-N	0	3	340.442	3.089	20	30		EGEDHN
C=C(Cl)C[N@H+]1CC[C@H](C2CCN(C(=O)c3ccccc3[O-])CC2)C1	ZINC001039110600	1344782856	/nfs/dbraw/zinc/78/28/56/1344782856.db2.gz	RCYLSYDCUFZAOL-INIZCTEOSA-N	0	3	348.874	3.319	20	30		EGEDHN
C=C(Cl)C[N@@H+]1CC[C@H](C2CCN(C(=O)c3ccccc3[O-])CC2)C1	ZINC001039110600	1344782858	/nfs/dbraw/zinc/78/28/58/1344782858.db2.gz	RCYLSYDCUFZAOL-INIZCTEOSA-N	0	3	348.874	3.319	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)c3cc(F)c[nH]3)CC2)C1	ZINC001039145025	1344826458	/nfs/dbraw/zinc/82/64/58/1344826458.db2.gz	SCKIMTYMSAZECQ-AWEZNQCLSA-N	0	3	339.842	3.080	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)[C@@H](F)C(C)C)CC2)C1	ZINC001039150917	1344834340	/nfs/dbraw/zinc/83/43/40/1344834340.db2.gz	CXWZGPLEPIOFNB-HOTGVXAUSA-N	0	3	330.875	3.294	20	30		EGEDHN
CCC(=O)N1CCCC[C@@H]1[C@H]1CCN(Cc2ccc(C#N)s2)C1	ZINC001039181652	1344878178	/nfs/dbraw/zinc/87/81/78/1344878178.db2.gz	YWGBZMZCYSYLMH-WMLDXEAASA-N	0	3	331.485	3.233	20	30		EGEDHN
O=C(C(F)F)N1CCCC[C@@H]1[C@@H]1CCN(CC#Cc2ccccc2)C1	ZINC001039183499	1344882735	/nfs/dbraw/zinc/88/27/35/1344882735.db2.gz	KSHUXVRRELKQDF-QZTJIDSGSA-N	0	3	346.421	3.006	20	30		EGEDHN
O=C(C1CC1)N1CCCC[C@@H]1[C@H]1CCN(CC#Cc2ccccc2)C1	ZINC001039184182	1344883745	/nfs/dbraw/zinc/88/37/45/1344883745.db2.gz	ORLXKJHBNVAVCQ-LEWJYISDSA-N	0	3	336.479	3.151	20	30		EGEDHN
C=CCC[N@H+]1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001039194183	1344900865	/nfs/dbraw/zinc/90/08/65/1344900865.db2.gz	VMGYTQBNYZYGHM-AEFFLSMTSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=CCC[N@@H+]1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001039194183	1344900867	/nfs/dbraw/zinc/90/08/67/1344900867.db2.gz	VMGYTQBNYZYGHM-AEFFLSMTSA-N	0	3	328.456	3.285	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)C2C(C)(C)C2(C)C)C1	ZINC001039201539	1344910899	/nfs/dbraw/zinc/91/08/99/1344910899.db2.gz	ALTUQGZTPMINCK-SJORKVTESA-N	0	3	330.516	3.395	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cccc(C)c2F)C1	ZINC001039213054	1344928474	/nfs/dbraw/zinc/92/84/74/1344928474.db2.gz	ZRGALQAPKNSDMS-FUHWJXTLSA-N	0	3	328.431	3.084	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(C)sc2C)C1	ZINC001039219949	1344937112	/nfs/dbraw/zinc/93/71/12/1344937112.db2.gz	WNFAJAPJPJTQFW-AEFFLSMTSA-N	0	3	330.497	3.315	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)Cc2ccsc2C)C1	ZINC001039230302	1344949991	/nfs/dbraw/zinc/94/99/91/1344949991.db2.gz	KAMNIIVHEGFAAX-MOPGFXCFSA-N	0	3	344.524	3.325	20	30		EGEDHN
C=C1CCC(C(=O)N2CCCC[C@H]2[C@H]2CCN(CC#CC)C2)CC1	ZINC001039233049	1344952557	/nfs/dbraw/zinc/95/25/57/1344952557.db2.gz	ZMDLYGDRKDLYQP-PMACEKPBSA-N	0	3	328.500	3.459	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)Cc2ccc(CC)cc2)C1	ZINC001039236378	1344957742	/nfs/dbraw/zinc/95/77/42/1344957742.db2.gz	BCACOYGQISAHBO-RTWAWAEBSA-N	0	3	338.495	3.128	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccc3cc[nH]c3c2)C1	ZINC001039236476	1344958086	/nfs/dbraw/zinc/95/80/86/1344958086.db2.gz	CQQWCSKDXZHSHU-AZUAARDMSA-N	0	3	335.451	3.118	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(F)cc2F)C1	ZINC001039238530	1344962390	/nfs/dbraw/zinc/96/23/90/1344962390.db2.gz	IVSFUVOGEQZZNH-KXBFYZLASA-N	0	3	346.421	3.305	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)CCc2ccccc2F)C1	ZINC001039240492	1344965476	/nfs/dbraw/zinc/96/54/76/1344965476.db2.gz	UWQBAQASGHUNGA-QUCCMNQESA-N	0	3	342.458	3.095	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cccc3[nH]ccc32)C1	ZINC001039240866	1344965588	/nfs/dbraw/zinc/96/55/88/1344965588.db2.gz	ZZSOPPHKOZNBOE-JXFKEZNVSA-N	0	3	335.451	3.118	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc(OC)cs2)C1	ZINC001039245317	1344973664	/nfs/dbraw/zinc/97/36/64/1344973664.db2.gz	NTQCDLPRMMEHEB-RDJZCZTQSA-N	0	3	346.496	3.097	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)CC(C2CC2)C2CC2)C1	ZINC001039244918	1344973950	/nfs/dbraw/zinc/97/39/50/1344973950.db2.gz	ZOPOMHZAIRBRDS-ICSRJNTNSA-N	0	3	328.500	3.149	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)CCc2ccccc2)C1	ZINC001039246023	1344975372	/nfs/dbraw/zinc/97/53/72/1344975372.db2.gz	OLJGUJYZFIRZKZ-SFTDATJTSA-N	0	3	338.495	3.346	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccc(Cl)s2)C1	ZINC001039251640	1344982868	/nfs/dbraw/zinc/98/28/68/1344982868.db2.gz	WFYZQBPUWXMVTE-UONOGXRCSA-N	0	3	336.888	3.351	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccn2c1CCCC2	ZINC001039386091	1345038913	/nfs/dbraw/zinc/03/89/13/1345038913.db2.gz	XDIICRQZEGVJKC-SJORKVTESA-N	0	3	327.472	3.079	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@H](C)c1c(C)noc1C	ZINC001039395806	1345044381	/nfs/dbraw/zinc/04/43/81/1345044381.db2.gz	KWDSSTUZDJPYAZ-QGTPRVQTSA-N	0	3	345.487	3.426	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1C[C@]1(C)c1ccccc1	ZINC001039407994	1345052796	/nfs/dbraw/zinc/05/27/96/1345052796.db2.gz	RMRHYZXQOKJUNV-FCIYXJNOSA-N	0	3	336.479	3.053	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccccc1-n1cccc1	ZINC001039428397	1345063476	/nfs/dbraw/zinc/06/34/76/1345063476.db2.gz	LCZGZHZVXISJKX-MOPGFXCFSA-N	0	3	347.462	3.180	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)c1ccc(F)c(F)c1	ZINC001039471762	1345087202	/nfs/dbraw/zinc/08/72/02/1345087202.db2.gz	LIUQQGCTSAKRMM-OIISXLGYSA-N	0	3	346.421	3.157	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC1CCC2(CC2)CC1	ZINC001039531402	1345131975	/nfs/dbraw/zinc/13/19/75/1345131975.db2.gz	OHYVKZKAOBFJFF-RYQLBKOJSA-N	0	3	329.488	3.182	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CCC[C@@H](C1)N2CCCC1CCOCC1	ZINC001039820126	1345199506	/nfs/dbraw/zinc/19/95/06/1345199506.db2.gz	AUINTMXRUDDTNC-KDURUIRLSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CCC[C@@H](C1)N2C[C@@H]1C[C@@]12CCOC2	ZINC001039823048	1345199685	/nfs/dbraw/zinc/19/96/85/1345199685.db2.gz	NRLMABZFJZXCIX-LXGFNABISA-N	0	3	346.515	3.081	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CCC[C@@H](C1)N2CCC1CCOCC1	ZINC001039822711	1345200044	/nfs/dbraw/zinc/20/00/44/1345200044.db2.gz	JDCHYPJXLAGTDC-KDURUIRLSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CCC[C@@H](C1)N2C[C@H]1CCO[C@@H](C)C1	ZINC001039823398	1345200191	/nfs/dbraw/zinc/20/01/91/1345200191.db2.gz	RKVJVXYJXRTUMM-CADBVGFASA-N	0	3	348.531	3.469	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC1CC(C)(C)C1	ZINC001039923255	1345246370	/nfs/dbraw/zinc/24/63/70/1345246370.db2.gz	PNTKMADZSFJAIK-HCXYKTFWSA-N	0	3	346.515	3.079	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC(C)C	ZINC001039941460	1345254058	/nfs/dbraw/zinc/25/40/58/1345254058.db2.gz	SQJQLLUVQPHNNX-RDGPPVDQSA-N	0	3	334.504	3.079	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@]3(CCN(C(=O)CC4CC4)C3)C2)c1	ZINC001040038634	1345304917	/nfs/dbraw/zinc/30/49/17/1345304917.db2.gz	XGVOWFMPKGZABN-NRFANRHFSA-N	0	3	337.467	3.173	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3coc(C(C)(C)C)n3)C2)C1	ZINC001040201686	1345373294	/nfs/dbraw/zinc/37/32/94/1345373294.db2.gz	NEBPCFWLCFQNLP-LJQANCHMSA-N	0	3	331.460	3.086	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3nsc4ccccc43)C2)C1	ZINC001040221573	1345381370	/nfs/dbraw/zinc/38/13/70/1345381370.db2.gz	SXEOCTUHRBOGKG-LJQANCHMSA-N	0	3	341.480	3.410	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3cccc(-n4cccc4)c3)C2)C1	ZINC001040281904	1345409885	/nfs/dbraw/zinc/40/98/85/1345409885.db2.gz	GCJGJMKDUCMRJE-QFIPXVFZSA-N	0	3	347.462	3.039	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@H](c3ccccc3)C3CC3)C2)C1	ZINC001040289089	1345413886	/nfs/dbraw/zinc/41/38/86/1345413886.db2.gz	CCNZHOBQEIJLEB-IRLDBZIGSA-N	0	3	336.479	3.128	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)Cc3cccc(C4CC4)c3)C2)C1	ZINC001040310952	1345425293	/nfs/dbraw/zinc/42/52/93/1345425293.db2.gz	RIFBDWLMOABFRV-JOCHJYFZSA-N	0	3	336.479	3.054	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@H](C)c3ccccc3F)C2)C1	ZINC001040457539	1345509353	/nfs/dbraw/zinc/50/93/53/1345509353.db2.gz	XGDUVXLEASOKSD-DYESRHJHSA-N	0	3	342.458	3.267	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ncsc3C(C)C)C2)C1	ZINC001040492081	1345517667	/nfs/dbraw/zinc/51/76/67/1345517667.db2.gz	LZFMUVYYTRFDQL-IBGZPJMESA-N	0	3	345.512	3.218	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3ccc4c(c3)CCC=C4)C2)C1	ZINC001040493823	1345519618	/nfs/dbraw/zinc/51/96/18/1345519618.db2.gz	RBCPSXXYWQWTLY-JOCHJYFZSA-N	0	3	334.463	3.207	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3cc(CC)c(C)s3)C2)C1	ZINC001040522198	1345532040	/nfs/dbraw/zinc/53/20/40/1345532040.db2.gz	KKTWSXXQJMTAFE-IBGZPJMESA-N	0	3	330.497	3.180	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)CCc3ccc(CC)cc3)C2)C1	ZINC001040523172	1345532803	/nfs/dbraw/zinc/53/28/03/1345532803.db2.gz	UYTLNDSGORPKJY-QFIPXVFZSA-N	0	3	338.495	3.129	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3sccc3CC)C2)C1	ZINC001040542298	1345537402	/nfs/dbraw/zinc/53/74/02/1345537402.db2.gz	GJSBFSIELWNMJD-LJQANCHMSA-N	0	3	330.497	3.262	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3coc4ccccc34)C2)C1	ZINC001040553221	1345544324	/nfs/dbraw/zinc/54/43/24/1345544324.db2.gz	SSUWPEQRCDQEDS-OAQYLSRUSA-N	0	3	336.435	3.384	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CCN(C(=O)/C=C/C4CC4)C3)CC2)c1	ZINC001040649627	1345559898	/nfs/dbraw/zinc/55/98/98/1345559898.db2.gz	YZNFXYGDFXKOQR-VOTSOKGWSA-N	0	3	349.478	3.339	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)Cc3cccc(C)c3Cl)C2)CC1	ZINC001040770095	1345576977	/nfs/dbraw/zinc/57/69/77/1345576977.db2.gz	AYGBJSZOYNSRFG-UHFFFAOYSA-N	0	3	344.886	3.139	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)Cc3cc(C)ccc3C)C2)CC1	ZINC001040830204	1345584009	/nfs/dbraw/zinc/58/40/09/1345584009.db2.gz	LCPQAABFRQQZBF-UHFFFAOYSA-N	0	3	338.495	3.184	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC3(C2)CCN(Cc2ocnc2C)CC3)C1	ZINC001040840154	1345586650	/nfs/dbraw/zinc/58/66/50/1345586650.db2.gz	OTZNQCADBWZCIL-UHFFFAOYSA-N	0	3	343.471	3.154	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)Cc3sc(C)cc3C)C2)CC1	ZINC001040925544	1345602156	/nfs/dbraw/zinc/60/21/56/1345602156.db2.gz	VDENECIAYBRCAU-UHFFFAOYSA-N	0	3	344.524	3.245	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cc4c(s3)CCCC4)C2)CC1	ZINC001040931963	1345604330	/nfs/dbraw/zinc/60/43/30/1345604330.db2.gz	YFBKORFYAJBXNB-UHFFFAOYSA-N	0	3	342.508	3.188	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cc4ccccc4o3)C2)CC1	ZINC001040931635	1345604386	/nfs/dbraw/zinc/60/43/86/1345604386.db2.gz	RHXXKUNFHZEMOJ-UHFFFAOYSA-N	0	3	336.435	3.384	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)C34CC(c5ccccc5)(C3)C4)C2)CC1	ZINC001040953934	1345609717	/nfs/dbraw/zinc/60/97/17/1345609717.db2.gz	TZCFRESURKIIDR-UHFFFAOYSA-N	0	3	348.490	3.056	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001041025816	1345627583	/nfs/dbraw/zinc/62/75/83/1345627583.db2.gz	GASDRYPTGBJLSM-HXUWFJFHSA-N	0	3	325.456	3.029	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1)C1CC1	ZINC001041175167	1345666162	/nfs/dbraw/zinc/66/61/62/1345666162.db2.gz	RROZLDCVFNEZGP-HRAATJIYSA-N	0	3	337.467	3.029	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N1CC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001041215002	1345679841	/nfs/dbraw/zinc/67/98/41/1345679841.db2.gz	LFMHTQBSDIAJIV-WIYYLYMNSA-N	0	3	337.467	3.029	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)[C@@H](CC)OC3CCCCC3)C2)C1	ZINC001041282292	1345693469	/nfs/dbraw/zinc/69/34/69/1345693469.db2.gz	JBYSWQWTJQXVNS-CTNGQTDRSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@]2(CCN(Cc3cnc(C)s3)C2)C1	ZINC001041536827	1345755597	/nfs/dbraw/zinc/75/55/97/1345755597.db2.gz	RPPASMCBCZWUEQ-IBGZPJMESA-N	0	3	347.528	3.478	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@]2(CCN(Cc3ccc(F)cc3)C2)C1	ZINC001041545867	1345760063	/nfs/dbraw/zinc/76/00/63/1345760063.db2.gz	ZCTHKNWIWVBXMT-FQEVSTJZSA-N	0	3	330.447	3.462	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)C(C)(C)c3ccc(Cl)cc3)C2)C1	ZINC001041613021	1345794586	/nfs/dbraw/zinc/79/45/86/1345794586.db2.gz	DOSXJYQDAWEZMM-FQEVSTJZSA-N	0	3	344.886	3.175	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@]2(CCN(Cc3cnc(C)s3)C2)C1	ZINC001041625934	1345800681	/nfs/dbraw/zinc/80/06/81/1345800681.db2.gz	MPUQHBTYBVKDCV-RTBURBONSA-N	0	3	347.528	3.478	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)C[C@@H](C)c3ccc(CC)cc3)C2)C1	ZINC001041669780	1345817414	/nfs/dbraw/zinc/81/74/14/1345817414.db2.gz	XLBCIUPILIVOPZ-GCJKJVERSA-N	0	3	338.495	3.300	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cc(F)ccc3Cl)C2)C1	ZINC001041709287	1345825885	/nfs/dbraw/zinc/82/58/85/1345825885.db2.gz	URMKZGLHAXPKPP-GOSISDBHSA-N	0	3	334.822	3.040	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3ccccc3O[C@@H](C)CC)C2)C1	ZINC001041718162	1345829865	/nfs/dbraw/zinc/82/98/65/1345829865.db2.gz	WYSCPHPVPWCLRS-UWJYYQICSA-N	0	3	340.467	3.035	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3scnc3C(C)(C)C)C2)C1	ZINC001041729413	1345833971	/nfs/dbraw/zinc/83/39/71/1345833971.db2.gz	STYUHEIVENYYFP-IBGZPJMESA-N	0	3	345.512	3.002	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)CCc3c[nH]c4ccccc34)C2)C1	ZINC001041816384	1345861306	/nfs/dbraw/zinc/86/13/06/1345861306.db2.gz	NMMNXJOJKDYWBJ-QFIPXVFZSA-N	0	3	349.478	3.048	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3csc4c3CCCC4)C2)C1	ZINC001041818237	1345862092	/nfs/dbraw/zinc/86/20/92/1345862092.db2.gz	PLVJLDXNCNQRHY-HXUWFJFHSA-N	0	3	342.508	3.188	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)COc3cccc(C(C)C)c3)C[C@H]21	ZINC001042074858	1345938539	/nfs/dbraw/zinc/93/85/39/1345938539.db2.gz	ZKJDWFQFCUSRNN-YLJYHZDGSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc4ccccc4nc3C)C[C@@H]21	ZINC001042085761	1345940491	/nfs/dbraw/zinc/94/04/91/1345940491.db2.gz	QTUMCYJGINHHDE-UZLBHIALSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ocnc3-c3ccccc3)C[C@@H]21	ZINC001042089231	1345941467	/nfs/dbraw/zinc/94/14/67/1345941467.db2.gz	WJCNUGQARDWXSC-RDJZCZTQSA-N	0	3	337.423	3.064	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)c3ccc4c5c(cccc53)CC4)C[C@H]21	ZINC001042146321	1345956828	/nfs/dbraw/zinc/95/68/28/1345956828.db2.gz	NOXDVWBUXFOPMS-IIBYNOLFSA-N	0	3	344.458	3.108	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C3(c4cccc(F)c4)CCC3)C[C@@H]21	ZINC001042177545	1345967999	/nfs/dbraw/zinc/96/79/99/1345967999.db2.gz	WVORELYKXNEYIE-APWZRJJASA-N	0	3	342.458	3.356	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3ccc(OC)cc3)[C@H]2C1	ZINC001042186196	1345973209	/nfs/dbraw/zinc/97/32/09/1345973209.db2.gz	DXBMMNJHOWDTSH-HKUYNNGSSA-N	0	3	342.483	3.330	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3cnccc3C)[C@H]2C1	ZINC001042186835	1345974041	/nfs/dbraw/zinc/97/40/41/1345974041.db2.gz	JVPPKDRPMFGQAE-AEFFLSMTSA-N	0	3	327.472	3.025	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3cccc(C#N)c3)[C@@H]2C1	ZINC001042209065	1345986877	/nfs/dbraw/zinc/98/68/77/1345986877.db2.gz	WXLOHNIIJQCLLH-RBUKOAKNSA-N	0	3	339.483	3.417	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)Cc3c(C)cc(C)cc3C)C[C@H]21	ZINC001042212298	1345987753	/nfs/dbraw/zinc/98/77/53/1345987753.db2.gz	BBFVQQDJWLADBK-PZJWPPBQSA-N	0	3	338.495	3.100	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(OCC)c(C)c3)C[C@H]21	ZINC001042252824	1346006281	/nfs/dbraw/zinc/00/62/81/1346006281.db2.gz	NTROJJFFWWXEIB-FUHWJXTLSA-N	0	3	328.456	3.116	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc4c(c3)C=CCC4)C[C@H]21	ZINC001042263781	1346011092	/nfs/dbraw/zinc/01/10/92/1346011092.db2.gz	YSJABZYIWHXACW-GHTZIAJQSA-N	0	3	334.463	3.206	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cnoc3-c3ccccc3)C[C@H]21	ZINC001042297898	1346022953	/nfs/dbraw/zinc/02/29/53/1346022953.db2.gz	XEGAXYPFNXAXFM-MAUKXSAKSA-N	0	3	337.423	3.064	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3[nH]ccc3-c3ccccc3)C[C@H]21	ZINC001042308074	1346026817	/nfs/dbraw/zinc/02/68/17/1346026817.db2.gz	DJBYEQNTGPXDMQ-UYAOXDASSA-N	0	3	347.462	3.241	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C3(c4ccccc4F)CCC3)C[C@H]21	ZINC001042310185	1346027262	/nfs/dbraw/zinc/02/72/62/1346027262.db2.gz	RMIXMTRQEFMMFA-VQIMIIECSA-N	0	3	342.458	3.356	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@H]2C1	ZINC001042324994	1346033456	/nfs/dbraw/zinc/03/34/56/1346033456.db2.gz	YHYUCWWDGASKPV-ROUUACIJSA-N	0	3	325.456	3.027	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3cc4c(s3)CCCC4)C[C@@H]21	ZINC001042338744	1346043191	/nfs/dbraw/zinc/04/31/91/1346043191.db2.gz	LVHMHBFUNCEERS-WBVHZDCISA-N	0	3	342.508	3.187	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)CCc3ccc(CC)cc3)C[C@H]21	ZINC001042351940	1346051365	/nfs/dbraw/zinc/05/13/65/1346051365.db2.gz	VIJVKQLIEKSUCL-NHCUHLMSSA-N	0	3	338.495	3.128	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)CCc3ccc(CC)cc3)C[C@@H]21	ZINC001042351942	1346051682	/nfs/dbraw/zinc/05/16/82/1346051682.db2.gz	VIJVKQLIEKSUCL-SFTDATJTSA-N	0	3	338.495	3.128	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc4cccc(F)c4o3)C[C@H]21	ZINC001042366958	1346058846	/nfs/dbraw/zinc/05/88/46/1346058846.db2.gz	YNQLAVZZDNIKJA-XJKSGUPXSA-N	0	3	328.387	3.294	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3cc4cccc(C)c4o3)C[C@@H]21	ZINC001042370178	1346060014	/nfs/dbraw/zinc/06/00/14/1346060014.db2.gz	CHXPVXDZNKTLHJ-AEFFLSMTSA-N	0	3	336.435	3.301	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc(C(C)(F)F)cc3)C[C@@H]21	ZINC001042380500	1346065182	/nfs/dbraw/zinc/06/51/82/1346065182.db2.gz	UCFYLSDFCBVMEH-QAPCUYQASA-N	0	3	346.421	3.358	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cccc4c3OCC4(C)C)C[C@H]21	ZINC001042382635	1346065901	/nfs/dbraw/zinc/06/59/01/1346065901.db2.gz	KIZPLFKCTMUPID-MAUKXSAKSA-N	0	3	340.467	3.079	20	30		EGEDHN
COc1ccc(C(C)C)cc1CNC[C@@H]1CCCN1C(=O)[C@@H](C)C#N	ZINC001044960759	1346470037	/nfs/dbraw/zinc/47/00/37/1346470037.db2.gz	HSAIBJFNSOOBNA-YJBOKZPZSA-N	0	3	343.471	3.059	20	30		EGEDHN
CC(C(=O)N1CCC[C@H]1CNCc1ccc(C#N)s1)=C1CCC1	ZINC001045033218	1346483821	/nfs/dbraw/zinc/48/38/21/1346483821.db2.gz	AOLHLIACJJVUSH-HNNXBMFYSA-N	0	3	329.469	3.201	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H]1CNCc1c(C)noc1CC	ZINC001045148757	1346505854	/nfs/dbraw/zinc/50/58/54/1346505854.db2.gz	GIBXNRZUPHFIRQ-HNNXBMFYSA-N	0	3	333.476	3.228	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H]1CNCc1cn(C(C)C)nc1C	ZINC001045149025	1346506619	/nfs/dbraw/zinc/50/66/19/1346506619.db2.gz	NASWABCASPRAPR-SFHVURJKSA-N	0	3	346.519	3.455	20	30		EGEDHN
CC(C)(C(=O)N1CCC[C@H]1CNCc1ccc(C#N)cc1F)C1CC1	ZINC001045162163	1346511110	/nfs/dbraw/zinc/51/11/10/1346511110.db2.gz	BGJPNRUWQSQAPJ-KRWDZBQOSA-N	0	3	343.446	3.214	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)c(F)c2)CCC1	ZINC001045161923	1346511355	/nfs/dbraw/zinc/51/13/55/1346511355.db2.gz	OMEVJJMENAGXPD-KRWDZBQOSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)[C@@H]2CC[C@H]2c2ccc(F)cc2)CC1	ZINC001045511589	1346613762	/nfs/dbraw/zinc/61/37/62/1346613762.db2.gz	SZRJAMCKDZKXPW-ZWKOTPCHSA-N	0	3	330.447	3.476	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)[C@@H]2CC[C@@H]2c2ccc(F)cc2)CC1	ZINC001045511857	1346613874	/nfs/dbraw/zinc/61/38/74/1346613874.db2.gz	XLZKCJXMMXVNHJ-RTBURBONSA-N	0	3	342.458	3.313	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2coc(-c3ccccc3)n2)CC1	ZINC001045622722	1346650155	/nfs/dbraw/zinc/65/01/55/1346650155.db2.gz	NTSWOBVNOMHSEG-UHFFFAOYSA-N	0	3	325.412	3.112	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)C2CC(c3ccc(F)cc3)C2)CC1	ZINC001045650356	1346659275	/nfs/dbraw/zinc/65/92/75/1346659275.db2.gz	UPLSMJCVCZNKMH-UHFFFAOYSA-N	0	3	342.458	3.313	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cccc(F)c1)C2	ZINC001045911732	1346749513	/nfs/dbraw/zinc/74/95/13/1346749513.db2.gz	PKUWJWOCGSTRRQ-FQEVSTJZSA-N	0	3	328.431	3.167	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCCC[C@]2(CCN(Cc3cccc(F)c3)C2)C1	ZINC001045920862	1346757865	/nfs/dbraw/zinc/75/78/65/1346757865.db2.gz	BVVIZYZPZCMBHM-OXQOHEQNSA-N	0	3	343.446	3.190	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc(Cl)cc1F)C2	ZINC001045950644	1346785505	/nfs/dbraw/zinc/78/55/05/1346785505.db2.gz	ICKYIVSHPMZZOM-LJQANCHMSA-N	0	3	348.849	3.431	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccn3ccccc13)C2	ZINC001045952679	1346787955	/nfs/dbraw/zinc/78/79/55/1346787955.db2.gz	PIXIQCRXHFLBKQ-JOCHJYFZSA-N	0	3	349.478	3.281	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)C[C@@H]1CCCC1(F)F)C2	ZINC001045961915	1346797101	/nfs/dbraw/zinc/79/71/01/1346797101.db2.gz	VDCIQWDEWAZRMZ-WMZOPIPTSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)Cc1ccc(CC)cc1)C2	ZINC001045969043	1346804250	/nfs/dbraw/zinc/80/42/50/1346804250.db2.gz	JXUYTNGGLUHGOW-JOCHJYFZSA-N	0	3	338.495	3.129	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)C1CCC(F)(F)CC1)C2	ZINC001045969283	1346805019	/nfs/dbraw/zinc/80/50/19/1346805019.db2.gz	NIXQQYHWHFRXGH-SFHVURJKSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H](C)c1ccccc1F)C2	ZINC001045974943	1346811798	/nfs/dbraw/zinc/81/17/98/1346811798.db2.gz	QPWNATXDOARULL-UWJYYQICSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1occ3c1CCCC3)C2	ZINC001045982017	1346820828	/nfs/dbraw/zinc/82/08/28/1346820828.db2.gz	LWWQICOTURXDHC-NRFANRHFSA-N	0	3	340.467	3.110	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)Cc1ccc(C)s1)C2	ZINC001045986167	1346826600	/nfs/dbraw/zinc/82/66/00/1346826600.db2.gz	JCJDUIIQRZTUQX-FQEVSTJZSA-N	0	3	344.524	3.327	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)C13CCC(CC1)CC3)C2	ZINC001045986477	1346827526	/nfs/dbraw/zinc/82/75/26/1346827526.db2.gz	RQGICCQOIBNVCC-CKHPTIKVSA-N	0	3	328.500	3.295	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)CCc1ccc(C)s1)C2	ZINC001045988238	1346829777	/nfs/dbraw/zinc/82/97/77/1346829777.db2.gz	LCKOIRBKIPREPQ-HXUWFJFHSA-N	0	3	344.524	3.327	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2ccc(F)c3ccncc23)C1	ZINC001046565798	1347019906	/nfs/dbraw/zinc/01/99/06/1347019906.db2.gz	UUEVZWYMGGRECI-LJQANCHMSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@]1(C)CCN(Cc2cc(C)sc2C)C1	ZINC001046635006	1347043640	/nfs/dbraw/zinc/04/36/40/1347043640.db2.gz	OFGYXWKJFMHRNM-AOIWGVFYSA-N	0	3	348.512	3.037	20	30		EGEDHN
C=CCCN1CC[C@@](C)(NC(=O)c2sc(CC3CC3)nc2C)C1	ZINC001046734357	1347077135	/nfs/dbraw/zinc/07/71/35/1347077135.db2.gz	PTLFZQVITLCQHG-GOSISDBHSA-N	0	3	333.501	3.174	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCNCc1ccc(Br)c(F)c1	ZINC001132395936	1375350246	/nfs/dbraw/zinc/35/02/46/1375350246.db2.gz	VKVHOVTXHYHAEV-UHFFFAOYSA-N	0	3	343.240	3.006	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2cc(F)ccc2C)C1	ZINC001046964070	1347168420	/nfs/dbraw/zinc/16/84/20/1347168420.db2.gz	YZZRWPVDNJJREN-CQSZACIVSA-N	0	3	340.389	3.397	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2ccc(C)cc2F)C1	ZINC001046979311	1347175251	/nfs/dbraw/zinc/17/52/51/1347175251.db2.gz	ZKEGFEXYILHABP-AWEZNQCLSA-N	0	3	340.389	3.397	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@@H](CNC(=O)[C@@H]2CCCCC2(C)C)C1	ZINC001046995573	1347178500	/nfs/dbraw/zinc/17/85/00/1347178500.db2.gz	PNAPBXZJOKJYGF-HOTGVXAUSA-N	0	3	340.458	3.300	20	30		EGEDHN
CC1(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)N(CC#Cc2ccccc2)C3)CCC1	ZINC001047128075	1347214264	/nfs/dbraw/zinc/21/42/64/1347214264.db2.gz	WQYBZWZHYGUAPP-ZCNNSNEGSA-N	0	3	336.479	3.197	20	30		EGEDHN
CC1(C(=O)N[C@H]2C[C@H]3C[C@@H](C2)N(CC#Cc2ccccc2)C3)CC=CC1	ZINC001047141471	1347218292	/nfs/dbraw/zinc/21/82/92/1347218292.db2.gz	UQUPQRXVVKNTQY-ACRUOGEOSA-N	0	3	348.490	3.364	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)c3ccc(C)o3)C2)CC1	ZINC001047223658	1347254127	/nfs/dbraw/zinc/25/41/27/1347254127.db2.gz	MLFYKJCQTZNVSA-SFHVURJKSA-N	0	3	328.456	3.176	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)C[C@@H]3C=CCC3)C2)CC1	ZINC001047224015	1347254192	/nfs/dbraw/zinc/25/41/92/1347254192.db2.gz	UKTZQCXBBXVPNN-QUCCMNQESA-N	0	3	328.500	3.317	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3cscc3C)C2)CC1	ZINC001047233361	1347262033	/nfs/dbraw/zinc/26/20/33/1347262033.db2.gz	YGVMETGRTIMSSM-KRWDZBQOSA-N	0	3	330.497	3.254	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@H]3CCCC34CC4)C2)CC1	ZINC001047245163	1347270643	/nfs/dbraw/zinc/27/06/43/1347270643.db2.gz	WZBIVSDOLSELPR-RBUKOAKNSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)[C@H]3C[C@H]4C[C@H]4C3)C2)CC1	ZINC001047247569	1347272825	/nfs/dbraw/zinc/27/28/25/1347272825.db2.gz	GZIAAEDSXPOPIV-ZRNYENFQSA-N	0	3	328.500	3.006	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3occc3CC)C2)CC1	ZINC001047255424	1347279317	/nfs/dbraw/zinc/27/93/17/1347279317.db2.gz	ZHYWTKCPRXKHIY-GOSISDBHSA-N	0	3	328.456	3.039	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@@H](C)C3CCCC3)C2)CC1	ZINC001047263083	1347284159	/nfs/dbraw/zinc/28/41/59/1347284159.db2.gz	YRPSHRUUNAUNPJ-PXNSSMCTSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@H]3CC[C@H](C)CC3)C2)CC1	ZINC001047263153	1347284483	/nfs/dbraw/zinc/28/44/83/1347284483.db2.gz	AMLQWWMEIWSQAZ-MISYRCLQSA-N	0	3	330.516	3.397	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)C2CCCC2)C1	ZINC001047674543	1347325552	/nfs/dbraw/zinc/32/55/52/1347325552.db2.gz	VRTBHEWNJKQPKD-BEFAXECRSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@@H](NCc1cc(F)ccc1C#N)[C@H]1CCN(C(=O)C2=CCCC2)C1	ZINC001047800152	1347376449	/nfs/dbraw/zinc/37/64/49/1347376449.db2.gz	OVVNXHZVTIBVFH-PBHICJAKSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]([C@H](C)NCc2csc(CC)n2)C1	ZINC001047932347	1347414856	/nfs/dbraw/zinc/41/48/56/1347414856.db2.gz	PCECDKCBNCJMLU-UONOGXRCSA-N	0	3	335.517	3.244	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]([C@@H](C)NCc3csc(CC)n3)C2)C1	ZINC001047965105	1347427013	/nfs/dbraw/zinc/42/70/13/1347427013.db2.gz	JEEMUEGEXMEMDP-CABCVRRESA-N	0	3	347.528	3.388	20	30		EGEDHN
C[C@H]1CN(C(=O)C2CC(C)(C)C2)C[C@H]1CNCc1ccccc1C#N	ZINC001048241034	1347500719	/nfs/dbraw/zinc/50/07/19/1347500719.db2.gz	YYDXCJINXBSSBC-HNAYVOBHSA-N	0	3	339.483	3.179	20	30		EGEDHN
C[C@H]1CN(C(=O)C2CC(C)(C)C2)C[C@@H]1CNCc1ccccc1C#N	ZINC001048241035	1347500805	/nfs/dbraw/zinc/50/08/05/1347500805.db2.gz	YYDXCJINXBSSBC-KXBFYZLASA-N	0	3	339.483	3.179	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](CNCc2csc(CC)n2)[C@H](C)C1	ZINC001048337703	1347522418	/nfs/dbraw/zinc/52/24/18/1347522418.db2.gz	FIVNOUJZGSOUFC-HUUCEWRRSA-N	0	3	349.544	3.492	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H](C)[C@@H](CNCc2c(F)cccc2F)C1	ZINC001048344765	1347525077	/nfs/dbraw/zinc/52/50/77/1347525077.db2.gz	RMPQBIIBOVWHPQ-KBPBESRZSA-N	0	3	336.426	3.361	20	30		EGEDHN
Cc1ccc(C(=O)N2C[C@H](C)[C@H](CNCc3ccccc3C#N)C2)cc1	ZINC001048455155	1347555700	/nfs/dbraw/zinc/55/57/00/1347555700.db2.gz	PRFUATPMRFOPBM-LAUBAEHRSA-N	0	3	347.462	3.365	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)C2C=CC=CC=C2)CC1	ZINC001048627296	1347624858	/nfs/dbraw/zinc/62/48/58/1347624858.db2.gz	KEMCAQMOCHXZSZ-UHFFFAOYSA-N	0	3	349.478	3.359	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc4cc(Cl)ccc4o3)C[C@@H]2C1	ZINC001048923734	1347684474	/nfs/dbraw/zinc/68/44/74/1347684474.db2.gz	FMLULPCTHSWEJK-GASCZTMLSA-N	0	3	342.826	3.113	20	30		EGEDHN
CCC1(C(=O)N2C[C@H]3CN(Cc4cccc(C#N)c4)C[C@H]3C2)CCC1	ZINC001048994550	1347701875	/nfs/dbraw/zinc/70/18/75/1347701875.db2.gz	LNQXMTQZUXEYPI-KDURUIRLSA-N	0	3	337.467	3.029	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@H]2C1	ZINC001049025014	1347709340	/nfs/dbraw/zinc/70/93/40/1347709340.db2.gz	DBCWDSIUVKHVDL-SVFBPWRDSA-N	0	3	337.467	3.051	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)CCC2CC2)c1	ZINC001049385317	1347813653	/nfs/dbraw/zinc/81/36/53/1347813653.db2.gz	BMPBRZBLNKEMRA-VQTJNVASSA-N	0	3	337.467	3.314	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1csc([C@H](C)OC)n1	ZINC001049472288	1347865573	/nfs/dbraw/zinc/86/55/73/1347865573.db2.gz	AVZDDNRCIMHKKB-NUEKZKHPSA-N	0	3	349.500	3.106	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(F)cc2ccncc21	ZINC001049482421	1347870309	/nfs/dbraw/zinc/87/03/09/1347870309.db2.gz	XKUDKAAGJWHONB-MOPGFXCFSA-N	0	3	339.414	3.239	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(C)c(OC)c(C)c1	ZINC001049491683	1347874468	/nfs/dbraw/zinc/87/44/68/1347874468.db2.gz	PHOPVBULIBAMGR-ZWKOTPCHSA-N	0	3	328.456	3.177	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(C)c(OC)c(C)c1	ZINC001049491679	1347874932	/nfs/dbraw/zinc/87/49/32/1347874932.db2.gz	PHOPVBULIBAMGR-QZTJIDSGSA-N	0	3	328.456	3.177	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cccc(OCCC)c1	ZINC001049502437	1347881282	/nfs/dbraw/zinc/88/12/82/1347881282.db2.gz	NXJLXHVFSNMZGZ-MOPGFXCFSA-N	0	3	328.456	3.340	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1c(C)nn(C(C)(C)C)c1C	ZINC001049507503	1347883923	/nfs/dbraw/zinc/88/39/23/1347883923.db2.gz	JNOZKUMCAHGKOR-IRXDYDNUSA-N	0	3	344.503	3.120	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C1C2CC3CC(C2)CC1C3	ZINC001049522064	1347890184	/nfs/dbraw/zinc/89/01/84/1347890184.db2.gz	OJUNXZXSBMJKTP-JBUMSTDASA-N	0	3	328.500	3.310	20	30		EGEDHN
C=C(C)CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1snnc1C1CC1	ZINC001049532308	1347894546	/nfs/dbraw/zinc/89/45/46/1347894546.db2.gz	OKYYYFNOZZTSLG-GJZGRUSLSA-N	0	3	346.500	3.061	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccnc(-c2ccco2)c1	ZINC001049544699	1347900236	/nfs/dbraw/zinc/90/02/36/1347900236.db2.gz	OOTZKTOFLDXFQR-MSOLQXFVSA-N	0	3	337.423	3.207	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1CCC[C@@H]2[C@@H]1CCN2CC=C	ZINC001049554598	1347906917	/nfs/dbraw/zinc/90/69/17/1347906917.db2.gz	GUNRQDVIYGGWTQ-MSOLQXFVSA-N	0	3	326.440	3.116	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1ccc(CCCC)cc1	ZINC001049578873	1347919058	/nfs/dbraw/zinc/91/90/58/1347919058.db2.gz	GBGUTEWZLNSHMT-SFTDATJTSA-N	0	3	338.495	3.270	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc2ncccc2o1	ZINC001049600485	1347930500	/nfs/dbraw/zinc/93/05/00/1347930500.db2.gz	AUOKKSDFHUIXGE-CVEARBPZSA-N	0	3	325.412	3.083	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)CCc1ccc(Cl)cc1	ZINC001049620554	1347938558	/nfs/dbraw/zinc/93/85/58/1347938558.db2.gz	FTXFEKYOVFQGDW-RBUKOAKNSA-N	0	3	344.886	3.361	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C1(c2cccc(F)c2)CCC1	ZINC001049624726	1347940094	/nfs/dbraw/zinc/94/00/94/1347940094.db2.gz	AHELHQZAGVJDEC-RBUKOAKNSA-N	0	3	342.458	3.499	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(F)ccc1OC	ZINC001049630537	1347944104	/nfs/dbraw/zinc/94/41/04/1347944104.db2.gz	QTJWDDOQWNROJC-IRXDYDNUSA-N	0	3	332.419	3.089	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](c1ccncc1)C(C)C	ZINC001049673816	1347966630	/nfs/dbraw/zinc/96/66/30/1347966630.db2.gz	ZZDZRRKRDZZLJP-GUDVDZBRSA-N	0	3	327.472	3.073	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](c1ccncc1)C(C)C	ZINC001049673818	1347966991	/nfs/dbraw/zinc/96/69/91/1347966991.db2.gz	ZZDZRRKRDZZLJP-IPMKNSEASA-N	0	3	327.472	3.073	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]3[C@H]2CCN3CCC(F)(F)F)C1	ZINC001049704703	1347982233	/nfs/dbraw/zinc/98/22/33/1347982233.db2.gz	ZJDQDNQQWGRZMI-ZIAGYGMSSA-N	0	3	330.394	3.360	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]3[C@@H]2CCN3Cc2ccc(C#N)cc2)C1	ZINC001049711539	1347986467	/nfs/dbraw/zinc/98/64/67/1347986467.db2.gz	MXNDVBGVZYXRKK-UXHICEINSA-N	0	3	349.478	3.480	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)C2CC3(CC3)C2)c1	ZINC001049711826	1347986729	/nfs/dbraw/zinc/98/67/29/1347986729.db2.gz	VSKFYGORRAACDY-WOJBJXKFSA-N	0	3	349.478	3.314	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cn(CC)nc1C(C)C	ZINC001049757983	1348004276	/nfs/dbraw/zinc/00/42/76/1348004276.db2.gz	FHUIPRGROHZQSU-QZTJIDSGSA-N	0	3	344.503	3.281	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C1(c2cccc(F)c2)CC1	ZINC001049762521	1348007644	/nfs/dbraw/zinc/00/76/44/1348007644.db2.gz	PSQIIOWBORUAGL-QZTJIDSGSA-N	0	3	328.431	3.109	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1cccc2sccc21	ZINC001049762631	1348007836	/nfs/dbraw/zinc/00/78/36/1348007836.db2.gz	QWCQVNZISPIFPP-QZTJIDSGSA-N	0	3	338.476	3.142	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](CC)Cc1ccccc1	ZINC001049763984	1348008409	/nfs/dbraw/zinc/00/84/09/1348008409.db2.gz	STEFJRGJGBARQQ-PCCBWWKXSA-N	0	3	338.495	3.344	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1sc(C)cc1OC	ZINC001049766586	1348010266	/nfs/dbraw/zinc/01/02/66/1348010266.db2.gz	LUISYKNEBNKQPE-LSDHHAIUSA-N	0	3	334.485	3.320	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc([C@@H](C)CC)no1	ZINC001049772276	1348014055	/nfs/dbraw/zinc/01/40/55/1348014055.db2.gz	YZNNMEYJYFQSNN-BHYGNILZSA-N	0	3	331.460	3.443	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc([C@H](C)CC)no1	ZINC001049772278	1348014226	/nfs/dbraw/zinc/01/42/26/1348014226.db2.gz	YZNNMEYJYFQSNN-HYVNUMGLSA-N	0	3	331.460	3.443	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cn1cc(C)c2ccccc21	ZINC001049777737	1348016291	/nfs/dbraw/zinc/01/62/91/1348016291.db2.gz	RMVRDEYVHCKCPF-WOJBJXKFSA-N	0	3	337.467	3.201	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1c[nH]c2cc(C)ccc12	ZINC001049778066	1348017438	/nfs/dbraw/zinc/01/74/38/1348017438.db2.gz	MOSFKMGZDGCQFL-SFTDATJTSA-N	0	3	349.478	3.107	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1ccccc1OC(C)C	ZINC001049783085	1348019885	/nfs/dbraw/zinc/01/98/85/1348019885.db2.gz	NWYABICUFAYWGF-RBUKOAKNSA-N	0	3	342.483	3.268	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](CC)c1c(C)noc1C	ZINC001049787305	1348021905	/nfs/dbraw/zinc/02/19/05/1348021905.db2.gz	GYXCPJIRIBDOHU-IXDOHACOSA-N	0	3	331.460	3.036	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(C)nc1OCC	ZINC001049810960	1348031290	/nfs/dbraw/zinc/03/12/90/1348031290.db2.gz	DPDRWMKISRVPOY-ZWKOTPCHSA-N	0	3	343.471	3.044	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1noc2c1C[C@H](C)CC2	ZINC001049824481	1348041133	/nfs/dbraw/zinc/04/11/33/1348041133.db2.gz	WLKNDWXMFUCADT-HYVNUMGLSA-N	0	3	343.471	3.054	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](C)c1ccc(C)s1	ZINC001049835262	1348048253	/nfs/dbraw/zinc/04/82/53/1348048253.db2.gz	HDGZFOQCOFREME-BRWVUGGUSA-N	0	3	330.497	3.249	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(C2CC2)s1	ZINC001049839975	1348051961	/nfs/dbraw/zinc/05/19/61/1348051961.db2.gz	KKGBRJTWYFUDLE-HOTGVXAUSA-N	0	3	328.481	3.328	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H]1Cc2ccc(Cl)cc21	ZINC001049871272	1348076796	/nfs/dbraw/zinc/07/67/96/1348076796.db2.gz	PZOGWGHZDYBEGU-GUDVDZBRSA-N	0	3	342.870	3.068	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(OC(C)C)cc1	ZINC001049871541	1348077094	/nfs/dbraw/zinc/07/70/94/1348077094.db2.gz	MFZMNUSGKSKGQD-RTBURBONSA-N	0	3	328.456	3.339	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc2ncsc2c1	ZINC001049871804	1348077331	/nfs/dbraw/zinc/07/73/31/1348077331.db2.gz	NZHULUQKUUWFNX-HZPDHXFCSA-N	0	3	327.453	3.161	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1sccc1C1CC1	ZINC001049877883	1348083332	/nfs/dbraw/zinc/08/33/32/1348083332.db2.gz	SBYZPHVHLFIFPZ-IRXDYDNUSA-N	0	3	328.481	3.328	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)COc1ccccc1C(C)C	ZINC001049881027	1348086485	/nfs/dbraw/zinc/08/64/85/1348086485.db2.gz	LGRXEGSXLFRAAE-MOPGFXCFSA-N	0	3	342.483	3.440	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(C)n(C(C)C)c1C	ZINC001049884192	1348089354	/nfs/dbraw/zinc/08/93/54/1348089354.db2.gz	AMNCFGVKKHIUGO-WOJBJXKFSA-N	0	3	341.499	3.388	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1ccc2ccccc2c1	ZINC001049884177	1348089523	/nfs/dbraw/zinc/08/95/23/1348089523.db2.gz	AGBLMSHKJJKJOK-LEWJYISDSA-N	0	3	332.447	3.081	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C(C)(C)c1ccc(OC)cc1	ZINC001049902983	1348102858	/nfs/dbraw/zinc/10/28/58/1348102858.db2.gz	DBKVIILYVYNKOX-RTBURBONSA-N	0	3	342.483	3.224	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](C)Cc1ccc(C)cc1	ZINC001049914108	1348108961	/nfs/dbraw/zinc/10/89/61/1348108961.db2.gz	MSRYHCDGIMKBHS-YSIASYRMSA-N	0	3	326.484	3.425	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)CCc1cc(C)sc1C	ZINC001049922926	1348114757	/nfs/dbraw/zinc/11/47/57/1348114757.db2.gz	JBIIUINKXXYAMU-RBUKOAKNSA-N	0	3	344.524	3.386	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](C)Cc1ccc(F)cc1	ZINC001049926892	1348117826	/nfs/dbraw/zinc/11/78/26/1348117826.db2.gz	SJGGXNWYZVQJCU-NSISKUIASA-N	0	3	342.458	3.093	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cc(C)n(C(CC)CC)n3)[C@@H]2C1	ZINC001050081032	1348176305	/nfs/dbraw/zinc/17/63/05/1348176305.db2.gz	OOUHPAGALYFTPE-QFBILLFUSA-N	0	3	344.503	3.275	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)C[C@@H]3C[C@H]3Cc3ccccc3)[C@@H]2C1	ZINC001050102448	1348184138	/nfs/dbraw/zinc/18/41/38/1348184138.db2.gz	WUCFLEFANWSTLK-JSXRDJHFSA-N	0	3	338.495	3.364	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)CCc3ccc(F)cc3F)[C@@H]2C1	ZINC001050175293	1348203023	/nfs/dbraw/zinc/20/30/23/1348203023.db2.gz	OMDDCAGVBGTPPB-MAUKXSAKSA-N	0	3	334.410	3.006	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)[C@H](C)Cc3ccc(C)cc3)[C@@H]2C1	ZINC001050210144	1348212094	/nfs/dbraw/zinc/21/20/94/1348212094.db2.gz	OAPZGHFPRCDFLK-YZGWKJHDSA-N	0	3	326.484	3.282	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC[C@H](CN[C@@H](C)c3ncccn3)CC2)C1	ZINC001050363211	1348239545	/nfs/dbraw/zinc/23/95/45/1348239545.db2.gz	QHJZVWJDRATOHX-ULQDDVLXSA-N	0	3	342.487	3.159	20	30		EGEDHN
C[C@@H](c1ccccc1F)N1CCC2(CN(C(=O)C#CC3CC3)C2)CC1	ZINC001050514671	1348281895	/nfs/dbraw/zinc/28/18/95/1348281895.db2.gz	SKOSLHFDUWOQLR-INIZCTEOSA-N	0	3	340.442	3.225	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC2(C1)CCN(Cc1oc(CC)nc1C)CC2	ZINC001050616499	1348303764	/nfs/dbraw/zinc/30/37/64/1348303764.db2.gz	BHMZLOCYFRWJKM-UHFFFAOYSA-N	0	3	345.487	3.182	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H](C)c3ccc(Cl)cc3)C2)CC1	ZINC001050643971	1348313490	/nfs/dbraw/zinc/31/34/90/1348313490.db2.gz	ZBOPJJNUHYHURI-INIZCTEOSA-N	0	3	344.886	3.391	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)C[C@H](C)c3ccc(CC)cc3)C2)CC1	ZINC001050663543	1348321403	/nfs/dbraw/zinc/32/14/03/1348321403.db2.gz	SDCJJLBTZBBBDT-SFHVURJKSA-N	0	3	338.495	3.300	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)CC[C@@H]3CCc4ccccc43)C2)CC1	ZINC001050766545	1348352597	/nfs/dbraw/zinc/35/25/97/1348352597.db2.gz	QPZIXQPVCVVSGM-IBGZPJMESA-N	0	3	336.479	3.054	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)[C@@H]3CC[C@H](CC)O3)cccc2C1	ZINC001051290615	1348420734	/nfs/dbraw/zinc/42/07/34/1348420734.db2.gz	ZFWOAFMZVDDNQZ-ICSRJNTNSA-N	0	3	342.483	3.195	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3ccsn3)cccc2C1	ZINC001051292977	1348422061	/nfs/dbraw/zinc/42/20/61/1348422061.db2.gz	MAHFZAXHDQAVSG-UHFFFAOYSA-N	0	3	327.453	3.007	20	30		EGEDHN
C=C(C)CCN1CCN([C@@H]2CCN(C(=O)CCC3CCCC3)C2)CC1	ZINC001051974747	1348493470	/nfs/dbraw/zinc/49/34/70/1348493470.db2.gz	KFOXATRXRISBNA-HXUWFJFHSA-N	0	3	347.547	3.142	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@H]2CCc3c2cccc3Cl)CC1	ZINC001052565935	1348580868	/nfs/dbraw/zinc/58/08/68/1348580868.db2.gz	IJVONEVASZYFLD-YJBOKZPZSA-N	0	3	344.886	3.364	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cc3c(cc(C)cc3C)[nH]2)CC1	ZINC001052601667	1348592121	/nfs/dbraw/zinc/59/21/21/1348592121.db2.gz	PXWFYFYVMWXDTJ-KRWDZBQOSA-N	0	3	337.467	3.392	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)Cc2ccc(Cl)c(F)c2)CC1	ZINC001052745383	1348659067	/nfs/dbraw/zinc/65/90/67/1348659067.db2.gz	NMEHIPHKTDHXPR-HNNXBMFYSA-N	0	3	336.838	3.016	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cc3cc(F)ccc3o2)CC1	ZINC001052760476	1348667092	/nfs/dbraw/zinc/66/70/92/1348667092.db2.gz	GSQSLUSZAKXLJG-MRXNPFEDSA-N	0	3	328.387	3.180	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2)CC1	ZINC001052778083	1348674990	/nfs/dbraw/zinc/67/49/90/1348674990.db2.gz	HCFFQNOBYDAUJT-OKZBNKHCSA-N	0	3	330.859	3.047	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccccc2OCC(C)C)CC1	ZINC001052796864	1348683141	/nfs/dbraw/zinc/68/31/41/1348683141.db2.gz	HCGSEGVNBMUOFB-GOSISDBHSA-N	0	3	342.483	3.329	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H]2CCCN(Cc3ccc(C#N)cc3)CC2)ccn1	ZINC001052808677	1348686196	/nfs/dbraw/zinc/68/61/96/1348686196.db2.gz	DEQARPBBUDTQMM-HXUWFJFHSA-N	0	3	348.450	3.046	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2ccc(-c3ccco3)s2)CC1	ZINC001052838072	1348696127	/nfs/dbraw/zinc/69/61/27/1348696127.db2.gz	ZVIANDIBJOAYOR-CQSZACIVSA-N	0	3	328.437	3.226	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2sccc2C(F)F)CC1	ZINC001052901293	1348735005	/nfs/dbraw/zinc/73/50/05/1348735005.db2.gz	OSSKMMAQFVFZNK-GFCCVEGCSA-N	0	3	326.412	3.293	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2ccc(-c3cccs3)o2)CC1	ZINC001052906017	1348738623	/nfs/dbraw/zinc/73/86/23/1348738623.db2.gz	RRHIXHAKDKERIG-CQSZACIVSA-N	0	3	328.437	3.226	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cc(C)nc3ccccc32)CC1	ZINC001052914873	1348746392	/nfs/dbraw/zinc/74/63/92/1348746392.db2.gz	WRCPLSZMALPNQS-KRWDZBQOSA-N	0	3	335.451	3.151	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cc(C)n(C(C)C)c2C)CC1	ZINC001052923587	1348749519	/nfs/dbraw/zinc/74/95/19/1348749519.db2.gz	GYZPAVVHWYFURT-SFHVURJKSA-N	0	3	329.488	3.293	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2cc3cc(F)ccc3s2)CC1	ZINC001052923447	1348749545	/nfs/dbraw/zinc/74/95/45/1348749545.db2.gz	DDFZADLWOSBACR-OAHLLOKOSA-N	0	3	330.428	3.258	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc(OCC3CC3)cc2)CC1	ZINC001052945432	1348761917	/nfs/dbraw/zinc/76/19/17/1348761917.db2.gz	JEQZRBAIOOZMKN-LJQANCHMSA-N	0	3	340.467	3.083	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)COC2CCCC2)C1	ZINC001053070222	1348884645	/nfs/dbraw/zinc/88/46/45/1348884645.db2.gz	UPTQPADWAAERDX-UYAOXDASSA-N	0	3	346.515	3.062	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cncc(C)c2)C1	ZINC001053078185	1348896942	/nfs/dbraw/zinc/89/69/42/1348896942.db2.gz	OPIDKLDLAQEPFB-ICSRJNTNSA-N	0	3	339.483	3.120	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cc[nH]c2C(C)C)C1	ZINC001053094111	1348922450	/nfs/dbraw/zinc/92/24/50/1348922450.db2.gz	CTHHJQMNHQUWPC-IEBWSBKVSA-N	0	3	341.499	3.478	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cncc(Cl)c2)C1	ZINC001053100827	1348934283	/nfs/dbraw/zinc/93/42/83/1348934283.db2.gz	JKDWVWUGPZOSNM-CRAIPNDOSA-N	0	3	345.874	3.075	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2nc(C)c(C)s2)C1	ZINC001053104066	1348939113	/nfs/dbraw/zinc/93/91/13/1348939113.db2.gz	BPPRVIMZUFZQOS-SJORKVTESA-N	0	3	345.512	3.100	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(OC)cc2)C1	ZINC001053105639	1348943069	/nfs/dbraw/zinc/94/30/69/1348943069.db2.gz	QCGAJZHAUOTRKV-ICSRJNTNSA-N	0	3	340.467	3.035	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cc(F)cc(F)c2)C1	ZINC001053106613	1348944749	/nfs/dbraw/zinc/94/47/49/1348944749.db2.gz	UWESKCJEYTUATR-KXBFYZLASA-N	0	3	346.421	3.305	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H]1C[C@H]1c1ccsc1)C2	ZINC001054153545	1349157404	/nfs/dbraw/zinc/15/74/04/1349157404.db2.gz	SRJILXCXIPBFFJ-NSHGMRRFSA-N	0	3	342.508	3.189	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cccc(C(C)C)n1)C2	ZINC001054161033	1349163613	/nfs/dbraw/zinc/16/36/13/1349163613.db2.gz	VQMODQGVTPPXQU-OAQYLSRUSA-N	0	3	339.483	3.156	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc3ccc(C)cc3[nH]1)C2	ZINC001054171968	1349172973	/nfs/dbraw/zinc/17/29/73/1349172973.db2.gz	CWISYHGODGWBFG-QFIPXVFZSA-N	0	3	349.478	3.428	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc3c(cc(C)cc3C)[nH]1)C2	ZINC001054172379	1349173732	/nfs/dbraw/zinc/17/37/32/1349173732.db2.gz	MUDALRYLUCQEPR-JOCHJYFZSA-N	0	3	349.478	3.346	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc3ccsc3[nH]1)C2	ZINC001054173109	1349174429	/nfs/dbraw/zinc/17/44/29/1349174429.db2.gz	HWFFJODOLPJNFO-IBGZPJMESA-N	0	3	341.480	3.181	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CCC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001054176084	1349177872	/nfs/dbraw/zinc/17/78/72/1349177872.db2.gz	BIMRFNFQHNVOTL-QUCCMNQESA-N	0	3	343.446	3.121	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(C)cc1F)C2	ZINC001054203694	1349204816	/nfs/dbraw/zinc/20/48/16/1349204816.db2.gz	JVJIBRBPLWSGQZ-HXUWFJFHSA-N	0	3	328.431	3.086	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1[nH]c3ccc(C)cc3c1C)C2	ZINC001054223504	1349218314	/nfs/dbraw/zinc/21/83/14/1349218314.db2.gz	WCDYXIHQHGTBQV-JOCHJYFZSA-N	0	3	349.478	3.346	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cccc3ccncc31)C2	ZINC001054223440	1349218494	/nfs/dbraw/zinc/21/84/94/1349218494.db2.gz	VELUAMKMCWVXOE-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H](C)c1ccc(C)s1)C2	ZINC001054226913	1349220757	/nfs/dbraw/zinc/22/07/57/1349220757.db2.gz	GEPDEOYEWMYGKV-QFBILLFUSA-N	0	3	330.497	3.108	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)[C@H](C)c1ccc(C)s1)C2	ZINC001054226909	1349221062	/nfs/dbraw/zinc/22/10/62/1349221062.db2.gz	GEPDEOYEWMYGKV-APWZRJJASA-N	0	3	330.497	3.108	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)[C@H](F)CC1CCCCC1)C2	ZINC001054227291	1349221450	/nfs/dbraw/zinc/22/14/50/1349221450.db2.gz	GJYVOXXIOSOVIG-QUCCMNQESA-N	0	3	334.479	3.243	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc3[nH]ccc3s1)C2	ZINC001054233856	1349225790	/nfs/dbraw/zinc/22/57/90/1349225790.db2.gz	SJUAFZBZCTYVBV-IBGZPJMESA-N	0	3	341.480	3.181	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H](C)c1cccc(Cl)c1)C2	ZINC001054242612	1349236356	/nfs/dbraw/zinc/23/63/56/1349236356.db2.gz	PCUGNQLVLRRFEA-JXFKEZNVSA-N	0	3	344.886	3.391	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@H](C)c1cccc(F)c1)C2	ZINC001054243129	1349237104	/nfs/dbraw/zinc/23/71/04/1349237104.db2.gz	XEQKISDEHVFTSI-DYESRHJHSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)C[C@@H](C)c1ccc(F)cc1)C2	ZINC001054243817	1349237355	/nfs/dbraw/zinc/23/73/55/1349237355.db2.gz	OPXVOEYJLOVWAH-DYESRHJHSA-N	0	3	342.458	3.267	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1sccc1CC)C2	ZINC001054245586	1349239433	/nfs/dbraw/zinc/23/94/33/1349239433.db2.gz	WBUDAYAZDHJGAU-IBGZPJMESA-N	0	3	330.497	3.262	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)C13CC(c4ccccc4)(C1)C3)C2	ZINC001054246321	1349241077	/nfs/dbraw/zinc/24/10/77/1349241077.db2.gz	WBKGDIVXWVPLQE-DDRJZQQSSA-N	0	3	348.490	3.056	20	30		EGEDHN
CC(C)CCN1Cc2ccc(CNC(=O)c3c[nH]c(C#N)c3)cc2C1	ZINC001054261032	1349257656	/nfs/dbraw/zinc/25/76/56/1349257656.db2.gz	MSLGSIBRPPAYAL-UHFFFAOYSA-N	0	3	336.439	3.178	20	30		EGEDHN
C#Cc1cncc(C(=O)NCc2ccc3c(c2)CN(CCCC)C3)c1	ZINC001054281071	1349281929	/nfs/dbraw/zinc/28/19/29/1349281929.db2.gz	AMZNZUZPAGNPPY-UHFFFAOYSA-N	0	3	333.435	3.109	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3c(C)noc3CC)cc2C1	ZINC001054291293	1349296025	/nfs/dbraw/zinc/29/60/25/1349296025.db2.gz	GGWWLSULGURHLK-UHFFFAOYSA-N	0	3	339.439	3.367	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2CCCC2)C[C@H]1NCc1ccc(C#N)c(F)c1	ZINC001054347020	1349326736	/nfs/dbraw/zinc/32/67/36/1349326736.db2.gz	MSDPYDWDCCKEPS-AUUYWEPGSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@H]1CN(C(=O)CC2CCCC2)C[C@@H]1NCc1ccc(C#N)c(F)c1	ZINC001054347023	1349326822	/nfs/dbraw/zinc/32/68/22/1349326822.db2.gz	MSDPYDWDCCKEPS-LIRRHRJNSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@H](C)[C@H](NCc2cc(C)ns2)C1	ZINC001054678633	1349434902	/nfs/dbraw/zinc/43/49/02/1349434902.db2.gz	IHCCAWGBIJKLJJ-IINYFYTJSA-N	0	3	341.908	3.167	20	30		EGEDHN
C[C@H]1CN(C(=O)C2(C)CCCC2)C[C@H]1NCc1ccc(C#N)s1	ZINC001054944771	1349524649	/nfs/dbraw/zinc/52/46/49/1349524649.db2.gz	SWCOUVLEERDENC-XJKSGUPXSA-N	0	3	331.485	3.137	20	30		EGEDHN
C#Cc1ccc(C(=O)N2C[C@@H](C)[C@H](NCc3ccccc3F)C2)cc1	ZINC001054960849	1349528923	/nfs/dbraw/zinc/52/89/23/1349528923.db2.gz	FPTQFEIYPZZCMV-FOIQADDNSA-N	0	3	336.410	3.057	20	30		EGEDHN
CCC1(C(=O)N2C[C@@H](C)[C@@H](NCc3ccc(C#N)s3)C2)CCC1	ZINC001054987397	1349539539	/nfs/dbraw/zinc/53/95/39/1349539539.db2.gz	WPGBLYOSPVCYIG-CJNGLKHVSA-N	0	3	331.485	3.137	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2CC)C1	ZINC001080344568	1357580289	/nfs/dbraw/zinc/58/02/89/1357580289.db2.gz	FUOFSLMNDDBZRP-XWPNQZOQSA-N	0	3	326.484	3.365	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CN(Cc3cccc(OC)c3C)C[C@H]2C)C1	ZINC001080404618	1357608765	/nfs/dbraw/zinc/60/87/65/1357608765.db2.gz	QVQDYWRUYYYZQC-CRAIPNDOSA-N	0	3	342.483	3.296	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C1(C3CCC3)CCC1)C[C@H](C)O2	ZINC001071196806	1354497983	/nfs/dbraw/zinc/49/79/83/1354497983.db2.gz	IQOQGJJYJZNZHB-FXAWDEMLSA-N	0	3	346.515	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1ccc(F)c(C)c1)C[C@H](C)O2	ZINC001071203714	1354504277	/nfs/dbraw/zinc/50/42/77/1354504277.db2.gz	GSFQFRPMWKZHRT-JXFKEZNVSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1cc(C)ccc1F)C[C@H](C)O2	ZINC001071215507	1354510254	/nfs/dbraw/zinc/51/02/54/1354510254.db2.gz	COTWCFUSGYBLDJ-OXJNMPFZSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C(CC)(CC)CC)C[C@@H](C)O2	ZINC001071226050	1354513352	/nfs/dbraw/zinc/51/33/52/1354513352.db2.gz	UMHCYMQPJRMGTB-YLJYHZDGSA-N	0	3	336.520	3.471	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2coc3c2cccc3OC)CC[C@H]1C	ZINC001071512585	1354736876	/nfs/dbraw/zinc/73/68/76/1354736876.db2.gz	ZKUMEVNLLQLMHD-HUUCEWRRSA-N	0	3	340.423	3.047	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cccc(NC(=O)CC)c2)CC[C@@H]1C	ZINC001071544322	1354757704	/nfs/dbraw/zinc/75/77/04/1354757704.db2.gz	WWOYUZLKXXYOSJ-YJBOKZPZSA-N	0	3	343.471	3.194	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)[C@H](C)C(F)(F)F)C1	ZINC001088359195	1359843259	/nfs/dbraw/zinc/84/32/59/1359843259.db2.gz	TXRLLCYGEXOPMJ-RYUDHWBXSA-N	0	3	326.790	3.298	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2[nH]nc3ccc(C)cc32)CC[C@H]1C	ZINC001071642131	1354822097	/nfs/dbraw/zinc/82/20/97/1354822097.db2.gz	KXRJQDUTRPODIL-CABCVRRESA-N	0	3	326.444	3.030	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)c2cn(CC)c3ccccc23)CC[C@@H]1C	ZINC001071670584	1354840296	/nfs/dbraw/zinc/84/02/96/1354840296.db2.gz	NHKPFTBGXYQOME-HOTGVXAUSA-N	0	3	325.456	3.430	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2ncsc2C(F)(F)F)CC[C@H]1C	ZINC001071682631	1354849549	/nfs/dbraw/zinc/84/95/49/1354849549.db2.gz	ONNJQAZNZRCATK-GHMZBOCLSA-N	0	3	347.406	3.321	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(C)c3cccnc23)CC[C@H]1C	ZINC001071695526	1354857744	/nfs/dbraw/zinc/85/77/44/1354857744.db2.gz	QWHXPLGXJALUIB-SJORKVTESA-N	0	3	335.451	3.149	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2cc3c(C)nn(C)c3s2)CC[C@H]1C	ZINC001071719703	1354877562	/nfs/dbraw/zinc/87/75/62/1354877562.db2.gz	YYQVKHCZRNGMNY-TZMCWYRMSA-N	0	3	346.500	3.102	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2sccc2-n2cccc2)CC[C@H]1C	ZINC001071724605	1354880294	/nfs/dbraw/zinc/88/02/94/1354880294.db2.gz	JRDTUZDWBSAPSI-HZPDHXFCSA-N	0	3	341.480	3.145	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc3cc(F)ccc3[nH]2)CC[C@@H]1C	ZINC001071728230	1354884037	/nfs/dbraw/zinc/88/40/37/1354884037.db2.gz	JMNKDQPTWJJQIV-XJKSGUPXSA-N	0	3	329.419	3.466	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc3cc(F)ccc3[nH]2)CC[C@H]1C	ZINC001071728228	1354884175	/nfs/dbraw/zinc/88/41/75/1354884175.db2.gz	JMNKDQPTWJJQIV-CJNGLKHVSA-N	0	3	329.419	3.466	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)Cc2c(C)[nH]c3ccccc32)CC[C@H]1C	ZINC001071783447	1354931682	/nfs/dbraw/zinc/93/16/82/1354931682.db2.gz	OSYWIWPBSJHVIR-GDBMZVCRSA-N	0	3	325.456	3.174	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CC[C@@H](C)N(Cc3ccc(CO)cc3)C2)C1	ZINC001071807366	1354951683	/nfs/dbraw/zinc/95/16/83/1354951683.db2.gz	QZYBXLLECGLJIW-VQIMIIECSA-N	0	3	342.483	3.004	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CC[C@@H](C)N(Cc3ccc(C)cc3)C2)c1	ZINC001071816021	1354956849	/nfs/dbraw/zinc/95/68/49/1354956849.db2.gz	TUHUMNHQEGQSQE-UTKZUKDTSA-N	0	3	347.462	3.154	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cn(C)nc2C2CCCC2)CC[C@H]1C	ZINC001071817800	1354958720	/nfs/dbraw/zinc/95/87/20/1354958720.db2.gz	IHULGZYNJVXBHZ-NVXWUHKLSA-N	0	3	344.503	3.237	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2c[nH]c3ccc(F)cc23)CC[C@@H]1C	ZINC001071851994	1354980756	/nfs/dbraw/zinc/98/07/56/1354980756.db2.gz	TUALUUVPRHPAQS-YOEHRIQHSA-N	0	3	343.446	3.395	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2c(C)noc2C(F)(F)F)CC[C@@H]1C	ZINC001071854728	1354982304	/nfs/dbraw/zinc/98/23/04/1354982304.db2.gz	FFWXDIWKBVUDRG-JQWIXIFHSA-N	0	3	345.365	3.161	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C2(c3cccc(F)c3)CC2)CC[C@H]1C	ZINC001071855487	1354984195	/nfs/dbraw/zinc/98/41/95/1354984195.db2.gz	QJUSSUQQLYIGSF-CRAIPNDOSA-N	0	3	330.447	3.403	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cccc(N3CCCC3)c2)CC[C@H]1C	ZINC001071930512	1355030675	/nfs/dbraw/zinc/03/06/75/1355030675.db2.gz	GBSIFKZPAKTJFK-IEBWSBKVSA-N	0	3	341.499	3.446	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(C)nc2OCCC)CC[C@@H]1C	ZINC001071937779	1355034728	/nfs/dbraw/zinc/03/47/28/1355034728.db2.gz	HISBVVNWMVIPRC-DLBZAZTESA-N	0	3	345.487	3.338	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc(-n3cccc3)ccn2)CC[C@@H]1C	ZINC001071966547	1355048720	/nfs/dbraw/zinc/04/87/20/1355048720.db2.gz	FWUZMWRKABAABQ-IRXDYDNUSA-N	0	3	338.455	3.031	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2(c3ccccc3F)CCC2)CC[C@H]1C	ZINC001071990300	1355061436	/nfs/dbraw/zinc/06/14/36/1355061436.db2.gz	XTHDRVWNXJTZBY-IAGOWNOFSA-N	0	3	342.458	3.240	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)Cc2c[nH]c3cccc(C)c23)CC[C@@H]1C	ZINC001071997873	1355065758	/nfs/dbraw/zinc/06/57/58/1355065758.db2.gz	FSUCIZJFKFXWHV-RDJZCZTQSA-N	0	3	325.456	3.174	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CC[C@@H](C)N(Cc3ccc(C)cc3)C2)nc1	ZINC001071998279	1355066097	/nfs/dbraw/zinc/06/60/97/1355066097.db2.gz	IEUFMYJQRDNXAB-YLJYHZDGSA-N	0	3	347.462	3.154	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CC[C@H](C)N(Cc3cccc(C)c3)C2)nc1	ZINC001071999023	1355066928	/nfs/dbraw/zinc/06/69/28/1355066928.db2.gz	LYAGXPFRGIDHBE-FXAWDEMLSA-N	0	3	347.462	3.154	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccccc2OC(C)C)CC[C@@H]1C	ZINC001072008261	1355071998	/nfs/dbraw/zinc/07/19/98/1355071998.db2.gz	CVXDZYZHBRRAER-IRXDYDNUSA-N	0	3	328.456	3.080	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(N(CC)CC)cc2)CC[C@@H]1C	ZINC001072023454	1355086035	/nfs/dbraw/zinc/08/60/35/1355086035.db2.gz	RFBBUEGUHXRYJQ-PKOBYXMFSA-N	0	3	341.499	3.139	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)[C@@]2(c3ccccc3)C[C@H](F)C2)CC[C@H]1C	ZINC001072030630	1355091663	/nfs/dbraw/zinc/09/16/63/1355091663.db2.gz	SHXKEZRPJMVMIU-XLBJILASSA-N	0	3	342.458	3.049	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(COC(C)C)cc2)CC[C@H]1C	ZINC001072063601	1355109218	/nfs/dbraw/zinc/10/92/18/1355109218.db2.gz	VJOJRYWBGCRWIA-XLIONFOSSA-N	0	3	342.483	3.218	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cnn(C(C)(C)C)c2CC)CC[C@@H]1C	ZINC001072072292	1355113012	/nfs/dbraw/zinc/11/30/12/1355113012.db2.gz	IMJPQMCSYKKVIW-HOTGVXAUSA-N	0	3	346.519	3.359	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2nsc3ccccc32)CC[C@@H]1C	ZINC001072092262	1355124064	/nfs/dbraw/zinc/12/40/64/1355124064.db2.gz	OSZDOZBGELHMIC-LSDHHAIUSA-N	0	3	343.496	3.384	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)c2c[nH]c3c2cccc3CC)CC[C@H]1C	ZINC001072098823	1355128291	/nfs/dbraw/zinc/12/82/91/1355128291.db2.gz	GXUOGDWYHSRFOC-GDBMZVCRSA-N	0	3	325.456	3.499	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](C)[C@H](CNCc2ccn(CC)n2)C1	ZINC001072334618	1355244146	/nfs/dbraw/zinc/24/41/46/1355244146.db2.gz	DXMKRMWRYSZFMW-IAGOWNOFSA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](C)[C@@H](CNCc2cc(C)no2)C1	ZINC001072335334	1355244606	/nfs/dbraw/zinc/24/46/06/1355244606.db2.gz	NGNXMNSHHJNOGG-ZBFHGGJFSA-N	0	3	333.476	3.160	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)C4CCCCC4)C3)C2)c1	ZINC001072413462	1355278160	/nfs/dbraw/zinc/27/81/60/1355278160.db2.gz	LNEUULWQXHNPIQ-UHFFFAOYSA-N	0	3	337.467	3.173	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3cc(Cl)sc3Cl)C2)C1	ZINC001072815410	1355449113	/nfs/dbraw/zinc/44/91/13/1355449113.db2.gz	XZTVLLCAUOEMTE-UHFFFAOYSA-N	0	3	331.268	3.389	20	30		EGEDHN
C[C@@H](C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2)C1CCC1	ZINC001072846324	1355463065	/nfs/dbraw/zinc/46/30/65/1355463065.db2.gz	RYPNADUGRBDKQG-MRXNPFEDSA-N	0	3	337.467	3.029	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CN(C(=O)[C@@H]4CC[C@@H]5C[C@@H]5C4)C3)C2)cc1	ZINC001072878932	1355480136	/nfs/dbraw/zinc/48/01/36/1355480136.db2.gz	HUZUVWRXZWLHRH-VAMGGRTRSA-N	0	3	349.478	3.029	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@H]3CCC[C@@H](C(F)(F)F)C3)C2)C1	ZINC001072884453	1355483770	/nfs/dbraw/zinc/48/37/70/1355483770.db2.gz	VFPMGAYPGQVRHB-UONOGXRCSA-N	0	3	330.394	3.075	20	30		EGEDHN
C=C1CCC(C(=O)N2CC3(C2)CCN(CCC(F)(F)F)C3)CC1	ZINC001072946273	1355514697	/nfs/dbraw/zinc/51/46/97/1355514697.db2.gz	GBNXORSMEWARHD-UHFFFAOYSA-N	0	3	330.394	3.220	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC3(C2)CCN(Cc2cccc(OC)c2)C3)C1	ZINC001072964411	1355527066	/nfs/dbraw/zinc/52/70/66/1355527066.db2.gz	WBTKEQIHGLXTSL-UHFFFAOYSA-N	0	3	340.467	3.086	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H](CC3CCCC3)C(C)C)C2)C1	ZINC001073029628	1355557629	/nfs/dbraw/zinc/55/76/29/1355557629.db2.gz	CLUANNWLZMPHQE-IBGZPJMESA-N	0	3	330.516	3.397	20	30		EGEDHN
C[C@@H]1CC[C@@H](C(=O)N2CC3(C2)CCN(Cc2cccc(C#N)c2)C3)C1	ZINC001073031951	1355560457	/nfs/dbraw/zinc/56/04/57/1355560457.db2.gz	VXQLALSGVNUNCE-VQIMIIECSA-N	0	3	337.467	3.029	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3ccc(O[C@H](C)CC)cc3)C2)C1	ZINC001073106295	1355600805	/nfs/dbraw/zinc/60/08/05/1355600805.db2.gz	WZNZBNHJNNFNFH-MRXNPFEDSA-N	0	3	328.456	3.198	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H](C)c3ccc(Cl)s3)C2)C1	ZINC001073115108	1355605636	/nfs/dbraw/zinc/60/56/36/1355605636.db2.gz	QOCUHRNIDXHKAR-CYBMUJFWSA-N	0	3	336.888	3.063	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)CC3C4CC5CC(C4)CC3C5)C2)C1	ZINC001073447138	1355782757	/nfs/dbraw/zinc/78/27/57/1355782757.db2.gz	GGTPOFUURPVSHV-UHFFFAOYSA-N	0	3	328.500	3.169	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2ccccc2C(C)(C)C)C1	ZINC001073651968	1355853970	/nfs/dbraw/zinc/85/39/70/1355853970.db2.gz	LOOJQIAIMCIUGQ-QGZVFWFLSA-N	0	3	344.499	3.381	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2c(C)cccc2Cl)C1	ZINC001073755594	1355890684	/nfs/dbraw/zinc/89/06/84/1355890684.db2.gz	DIUNVDGVPGBLIH-HNNXBMFYSA-N	0	3	336.863	3.045	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2cccc(C)c2Cl)C1	ZINC001073825581	1355909350	/nfs/dbraw/zinc/90/93/50/1355909350.db2.gz	OUQPDGSNWNPXBA-OAHLLOKOSA-N	0	3	336.863	3.045	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2ccc3ccccc3c2)C1	ZINC001073865118	1355925605	/nfs/dbraw/zinc/92/56/05/1355925605.db2.gz	CISGMDADDOQNSE-FQEVSTJZSA-N	0	3	338.451	3.237	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCCN1C(=O)C1CC=CC1	ZINC001073978367	1356006569	/nfs/dbraw/zinc/00/65/69/1356006569.db2.gz	HAEMXAUQMHZARO-HXUWFJFHSA-N	0	3	337.467	3.337	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(C#N)cc1	ZINC001074053464	1356057551	/nfs/dbraw/zinc/05/75/51/1356057551.db2.gz	TZJNKZAQRNMYBZ-RTBURBONSA-N	0	3	345.462	3.365	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2CC[C@H]3CN(CC=C(C)C)C[C@H]32)cc1	ZINC001075958723	1356456795	/nfs/dbraw/zinc/45/67/95/1356456795.db2.gz	PGYXLBIPCIPUJQ-AZUAARDMSA-N	0	3	340.467	3.364	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccc(N(C)C(C)C)cc3)[C@@H]2C1	ZINC001076634569	1356639487	/nfs/dbraw/zinc/63/94/87/1356639487.db2.gz	OBXCXVLWZIPEKB-AZUAARDMSA-N	0	3	341.499	3.254	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)C3CC(c4ccc(F)cc4)C3)[C@@H]2C1	ZINC001076638112	1356640031	/nfs/dbraw/zinc/64/00/31/1356640031.db2.gz	JLPOBGUJEYBOHN-BOMAWHNGSA-N	0	3	328.431	3.038	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccoc2Cl)C12CCC2	ZINC001078601705	1357030498	/nfs/dbraw/zinc/03/04/98/1357030498.db2.gz	LFINCSVZBZFNME-NWDGAFQWSA-N	0	3	329.227	3.316	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2ccc(C)c(C)n2)C12CCC2	ZINC001078679493	1357052811	/nfs/dbraw/zinc/05/28/11/1357052811.db2.gz	CGOLRRFBVXZHLK-HZPDHXFCSA-N	0	3	333.863	3.082	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc(OC)cs2)C12CCC2	ZINC001078695669	1357059403	/nfs/dbraw/zinc/05/94/03/1357059403.db2.gz	PSGNZTFODKVEGF-KBPBESRZSA-N	0	3	340.876	3.140	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc[nH]c2CCC)C12CCC2	ZINC001078704731	1357062384	/nfs/dbraw/zinc/06/23/84/1357062384.db2.gz	BRQBMHSQXCHUNM-HOTGVXAUSA-N	0	3	335.879	3.350	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@H](NCc3cnc(C)o3)C23CCC3)CC1	ZINC001078716835	1357062707	/nfs/dbraw/zinc/06/27/07/1357062707.db2.gz	ZHNKXKUNDRUEIF-ROUUACIJSA-N	0	3	343.471	3.246	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@H](NCc3conc3CC)C23CCC3)C1	ZINC001078720844	1357065817	/nfs/dbraw/zinc/06/58/17/1357065817.db2.gz	RLFWTBJKTXAGDO-IRXDYDNUSA-N	0	3	343.471	3.110	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2cc3sccc3[nH]2)C[C@H]1c1ccccc1	ZINC001081208806	1357850000	/nfs/dbraw/zinc/85/00/00/1357850000.db2.gz	LMGZHHYNVFDPPS-MAUKXSAKSA-N	0	3	349.459	3.060	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2ccc(C3CC3)s2)[C@H](OC)C1	ZINC001082325697	1358018195	/nfs/dbraw/zinc/01/81/95/1358018195.db2.gz	WTTIFEVRWKHRQC-HUUCEWRRSA-N	0	3	334.485	3.021	20	30		EGEDHN
C[C@@H]1CN(C(=O)C[C@H]2C=CCCC2)C[C@H]1NCc1ccc(C#N)s1	ZINC001082587826	1358060633	/nfs/dbraw/zinc/06/06/33/1358060633.db2.gz	APCWCJFWZIPDMQ-RVKKMQEKSA-N	0	3	343.496	3.303	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H]1C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001082752312	1358086945	/nfs/dbraw/zinc/08/69/45/1358086945.db2.gz	BJJVEMAYWLPKPI-DTTOXWODSA-N	0	3	345.512	3.238	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)C[C@H]3CCCCC3(C)C)[C@H]2C1	ZINC001083293317	1358129297	/nfs/dbraw/zinc/12/92/97/1358129297.db2.gz	XRHAISULIGEBGV-CEXWTWQISA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)Cc3cccc(C)c3Cl)[C@@H]2C1	ZINC001084514212	1358229574	/nfs/dbraw/zinc/22/95/74/1358229574.db2.gz	FRFJWIKSBZHZON-IAGOWNOFSA-N	0	3	332.875	3.300	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CCN(CCc3cccs3)C[C@H]21	ZINC001084574190	1358241218	/nfs/dbraw/zinc/24/12/18/1358241218.db2.gz	USVIKAKIYJHFEY-NVXWUHKLSA-N	0	3	332.513	3.426	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@@H](C)c3ccc(CC)cc3)[C@@H]2C1	ZINC001084724008	1358292409	/nfs/dbraw/zinc/29/24/09/1358292409.db2.gz	IVKONINCYSLZKV-PWIZWCRZSA-N	0	3	326.484	3.461	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)C[C@@H](C)c3ccccc3F)[C@@H]2C1	ZINC001084724764	1358293870	/nfs/dbraw/zinc/29/38/70/1358293870.db2.gz	SPKRVLUFBYBDFM-GPMSIDNRSA-N	0	3	330.447	3.428	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3cc(F)c(F)cc3Cl)[C@@H]2C1	ZINC001084809666	1358315978	/nfs/dbraw/zinc/31/59/78/1358315978.db2.gz	ZULHIOHUFZQLHL-BDJLRTHQSA-N	0	3	340.801	3.341	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)Cc3cccc(OC(C)C)c3)[C@@H]2C1	ZINC001084862122	1358333942	/nfs/dbraw/zinc/33/39/42/1358333942.db2.gz	WAZFLUMYKODRMO-UYAOXDASSA-N	0	3	342.483	3.125	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@H](C)c3ccc(Cl)cc3)C[C@@H]21	ZINC001085022422	1358369484	/nfs/dbraw/zinc/36/94/84/1358369484.db2.gz	FOLOCBYKMYQBKD-SUMDDJOVSA-N	0	3	344.886	3.390	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)[C@H]3CCCCc4ccccc43)C[C@@H]21	ZINC001085102503	1358391412	/nfs/dbraw/zinc/39/14/12/1358391412.db2.gz	HQGYGPXVJDFPEW-GIVPXCGWSA-N	0	3	336.479	3.053	20	30		EGEDHN
CC1(C(=O)N[C@@H]2CCCC[C@H]2NCc2cc(C#N)ccc2F)CC1	ZINC001085205625	1358432897	/nfs/dbraw/zinc/43/28/97/1358432897.db2.gz	BAJBNVIAHOYHEI-IAGOWNOFSA-N	0	3	329.419	3.014	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cnoc1-c1ccco1	ZINC001085247645	1358444152	/nfs/dbraw/zinc/44/41/52/1358444152.db2.gz	UXWFLUFVXIEDDB-ZIAGYGMSSA-N	0	3	349.818	3.318	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cc2cnccc2o1	ZINC001085259817	1358445745	/nfs/dbraw/zinc/44/57/45/1358445745.db2.gz	GPYDSBGENVAIEE-ZIAGYGMSSA-N	0	3	333.819	3.211	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1CCC1(C)C	ZINC001085303564	1358459682	/nfs/dbraw/zinc/45/96/82/1358459682.db2.gz	PZHCAUKNUYGWBJ-BFHYXJOUSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H](C)c1c(C)noc1C	ZINC001085362888	1358478697	/nfs/dbraw/zinc/47/86/97/1358478697.db2.gz	ARZXLQXAOMCLLC-NILFDRSVSA-N	0	3	339.867	3.164	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cnn(C(C)C)c1C	ZINC001085388889	1358485853	/nfs/dbraw/zinc/48/58/53/1358485853.db2.gz	IASMPSXLLZZZDK-HZPDHXFCSA-N	0	3	338.883	3.156	20	30		EGEDHN
CC[C@H](c1ccccc1)N1CC[C@H]1CN(C)C(=O)c1ccc(C#N)[nH]1	ZINC001085542547	1358582291	/nfs/dbraw/zinc/58/22/91/1358582291.db2.gz	ADSMXFAXYGIGOJ-PKOBYXMFSA-N	0	3	336.439	3.184	20	30		EGEDHN
CN(C[C@H]1CCN1[C@H]1CCCc2ccccc21)C(=O)c1ccc(C#N)[nH]1	ZINC001085553754	1358589449	/nfs/dbraw/zinc/58/94/49/1358589449.db2.gz	XISRQYSUAZYYFZ-XLIONFOSSA-N	0	3	348.450	3.110	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc2cc(C)cn2c1	ZINC001085634238	1358651094	/nfs/dbraw/zinc/65/10/94/1358651094.db2.gz	LVVYSOLPAOHXMD-LJQANCHMSA-N	0	3	325.456	3.360	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@@H]1CCc2ccc(OC)cc21	ZINC001085644396	1358657300	/nfs/dbraw/zinc/65/73/00/1358657300.db2.gz	MVVAFMYGENZJAM-PKOBYXMFSA-N	0	3	342.483	3.224	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)[C@@H]1CCCO[C@H]1c1ccccc1	ZINC001085647815	1358659332	/nfs/dbraw/zinc/65/93/32/1358659332.db2.gz	VNKYCHYJGWJTCI-AQNXPRMDSA-N	0	3	342.483	3.263	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@H]1CCc2ccc(F)cc2O1	ZINC001085723310	1358712205	/nfs/dbraw/zinc/71/22/05/1358712205.db2.gz	UGQVELHYKNVUQS-QZTJIDSGSA-N	0	3	346.446	3.018	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc2ccc(OC)cc2[nH]1	ZINC001085755629	1358735497	/nfs/dbraw/zinc/73/54/97/1358735497.db2.gz	LUQVDUBTVGMGGR-MRXNPFEDSA-N	0	3	341.455	3.289	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1c(F)cc(F)cc1F	ZINC001085795018	1358769568	/nfs/dbraw/zinc/76/95/68/1358769568.db2.gz	LANSCGPXWLMZJX-CYBMUJFWSA-N	0	3	326.362	3.216	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@@H]1OCC[C@@H]1c1ccccc1	ZINC001085870314	1358835548	/nfs/dbraw/zinc/83/55/48/1358835548.db2.gz	QAKNMFVLNZHGQM-VAMGGRTRSA-N	0	3	342.483	3.058	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccccc1NC(=O)CC	ZINC001085879854	1358844142	/nfs/dbraw/zinc/84/41/42/1358844142.db2.gz	IYFVVGRBVHNHOZ-INIZCTEOSA-N	0	3	343.471	3.148	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cccc(N2CCCC2)c1	ZINC001085888873	1358848145	/nfs/dbraw/zinc/84/81/45/1358848145.db2.gz	KDZJIDTZUPPQNX-HXUWFJFHSA-N	0	3	341.499	3.399	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ncccc1C(F)(F)F	ZINC001085908795	1358868677	/nfs/dbraw/zinc/86/86/77/1358868677.db2.gz	RYXQUOGQDJQVMJ-CYBMUJFWSA-N	0	3	341.377	3.213	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1cnn(C(CC)CC)c1C	ZINC001085917279	1358877329	/nfs/dbraw/zinc/87/73/29/1358877329.db2.gz	VQJXHFUCIRIVGD-KRWDZBQOSA-N	0	3	332.492	3.275	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@H]1CCCc2sc(C)nc21	ZINC001085923499	1358881955	/nfs/dbraw/zinc/88/19/55/1358881955.db2.gz	ZNUQVSRMLAOSCA-CVEARBPZSA-N	0	3	347.528	3.370	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@H]1CCCc2sc(C)nc21	ZINC001085923500	1358882067	/nfs/dbraw/zinc/88/20/67/1358882067.db2.gz	ZNUQVSRMLAOSCA-HOTGVXAUSA-N	0	3	347.528	3.370	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc(OC)c(OCC)c1	ZINC001085960776	1358919105	/nfs/dbraw/zinc/91/91/05/1358919105.db2.gz	OBYVRGFYHMOFTK-KRWDZBQOSA-N	0	3	346.471	3.206	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc(OC)c(Cl)c1	ZINC001085964646	1358922933	/nfs/dbraw/zinc/92/29/33/1358922933.db2.gz	NPKLBDQAPUOCQC-HNNXBMFYSA-N	0	3	336.863	3.461	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccnc(-c3ccco3)c2)C1	ZINC001086116013	1359000445	/nfs/dbraw/zinc/00/04/45/1359000445.db2.gz	BTPJZZIDBGKYBR-OTVXOJSOSA-N	0	3	345.830	3.192	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cccc(-n3cccc3)c2)C1	ZINC001086140913	1359006498	/nfs/dbraw/zinc/00/64/98/1359006498.db2.gz	HZGFAVOODGXLLX-WOVMCDHWSA-N	0	3	343.858	3.328	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc3c(c2)C=CCC3)C1	ZINC001086224018	1359032609	/nfs/dbraw/zinc/03/26/09/1359032609.db2.gz	SUCVIWGNCZRBHF-UJKQEGAGSA-N	0	3	330.859	3.497	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc(F)c(Cl)cc2F)C1	ZINC001086461502	1359104778	/nfs/dbraw/zinc/10/47/78/1359104778.db2.gz	UGNBZIVJRRHDBO-MGCOHNPYSA-N	0	3	349.208	3.469	20	30		EGEDHN
CC[C@]1(C)C[C@@H]1C(=O)NC[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001086520417	1359128226	/nfs/dbraw/zinc/12/82/26/1359128226.db2.gz	FCAVKWUNBPCAMK-WVSUBDOOSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(C)c3c2CCC3)C1	ZINC001086560247	1359145828	/nfs/dbraw/zinc/14/58/28/1359145828.db2.gz	BMPAZEDUFGBHCQ-SHTZXODSSA-N	0	3	332.875	3.334	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2c[nH]c3ccc(F)cc23)C1	ZINC001086566058	1359149780	/nfs/dbraw/zinc/14/97/80/1359149780.db2.gz	TZHWXTBPVFNZIM-AULYBMBSSA-N	0	3	335.810	3.158	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)[C@@H](C)C2CCCC2)C1	ZINC001086619584	1359166482	/nfs/dbraw/zinc/16/64/82/1359166482.db2.gz	XZIUYAROJQUSDJ-DZFGPLHGSA-N	0	3	338.495	3.420	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)[C@H]2CC[C@H](C)CC2)C1	ZINC001086620740	1359166812	/nfs/dbraw/zinc/16/68/12/1359166812.db2.gz	KCUWKKRJJFFONX-ZIBCJSCZSA-N	0	3	338.495	3.420	20	30		EGEDHN
C=C(C)CN1C[C@@H](c2ccccc2)[C@H](NC(=O)Cc2ccc(C)nc2)C1	ZINC001086624284	1359167787	/nfs/dbraw/zinc/16/77/87/1359167787.db2.gz	WZWIJZBGWOPBGU-LEWJYISDSA-N	0	3	349.478	3.093	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2c(F)cccc2OC)C1	ZINC001086703869	1359189164	/nfs/dbraw/zinc/18/91/64/1359189164.db2.gz	VJQMVNMFIJLLGG-QWHCGFSZSA-N	0	3	340.826	3.075	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccccc2OCC)C1	ZINC001086866958	1359217125	/nfs/dbraw/zinc/21/71/25/1359217125.db2.gz	KOUNHDHZYHKDTP-LSDHHAIUSA-N	0	3	336.863	3.326	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3ccoc3Cl)C2)CC1	ZINC001086918362	1359246270	/nfs/dbraw/zinc/24/62/70/1359246270.db2.gz	LHCZHQIYTIPVMU-AWEZNQCLSA-N	0	3	334.847	3.273	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H]3CCCC4(CC4)C3)C2)CC1	ZINC001086923452	1359249219	/nfs/dbraw/zinc/24/92/19/1359249219.db2.gz	RSPLVRPVNIJLAB-QZTJIDSGSA-N	0	3	328.500	3.293	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)C[C@H]3C=CCCC3)C2)CC1	ZINC001086929037	1359253795	/nfs/dbraw/zinc/25/37/95/1359253795.db2.gz	VDLPLKCZJHQZPQ-MOPGFXCFSA-N	0	3	328.500	3.459	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc(Cl)ccc3F)C2)CC1	ZINC001086932022	1359255910	/nfs/dbraw/zinc/25/59/10/1359255910.db2.gz	YDTQVPJDOTTZND-CQSZACIVSA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc(C(C)C)on3)C2)CC1	ZINC001086934845	1359258299	/nfs/dbraw/zinc/25/82/99/1359258299.db2.gz	BUMRDNPDGBFNPD-MRXNPFEDSA-N	0	3	343.471	3.138	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccoc3C3CC3)C2)CC1	ZINC001086939754	1359262229	/nfs/dbraw/zinc/26/22/29/1359262229.db2.gz	YYPQUURQWOMANB-OAHLLOKOSA-N	0	3	326.440	3.107	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc(C)cc3F)C2)CC1	ZINC001086944614	1359265752	/nfs/dbraw/zinc/26/57/52/1359265752.db2.gz	CTOJDLNESGUOTQ-MRXNPFEDSA-N	0	3	328.431	3.084	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)Cc3ccc(C)c(C)c3)C2)CC1	ZINC001086955639	1359276425	/nfs/dbraw/zinc/27/64/25/1359276425.db2.gz	RVHBKYOSIAVNRO-IBGZPJMESA-N	0	3	338.495	3.182	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H](C)c3ccccc3C)C2)CC1	ZINC001086956807	1359277708	/nfs/dbraw/zinc/27/77/08/1359277708.db2.gz	XYWFBVFNVBVBJE-MOPGFXCFSA-N	0	3	338.495	3.435	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cncc4ccccc43)C2)CC1	ZINC001086958145	1359279196	/nfs/dbraw/zinc/27/91/96/1359279196.db2.gz	FIWBQHHRTYFTGR-KRWDZBQOSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3sccc3Cl)C(C)(C)[C@H]21	ZINC001087287616	1359365880	/nfs/dbraw/zinc/36/58/80/1359365880.db2.gz	KCHREIWIZJNJEP-DFBGVHRSSA-N	0	3	336.888	3.254	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cscc3Cl)C(C)(C)[C@H]21	ZINC001087291465	1359370869	/nfs/dbraw/zinc/37/08/69/1359370869.db2.gz	VFCQRQGVRUIMTB-DFBGVHRSSA-N	0	3	336.888	3.254	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc4[nH]ccc4c3)C(C)(C)[C@@H]21	ZINC001087300090	1359382679	/nfs/dbraw/zinc/38/26/79/1359382679.db2.gz	GSJYRNRSRDJBRI-BHIYHBOVSA-N	0	3	335.451	3.020	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)C3CC4(CCC4)C3)C(C)(C)[C@H]21	ZINC001087301117	1359384434	/nfs/dbraw/zinc/38/44/34/1359384434.db2.gz	WJBHEVZCGCHHHR-SQNIBIBYSA-N	0	3	328.500	3.195	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc4ccccc4n3C)C(C)(C)[C@H]21	ZINC001087302169	1359384895	/nfs/dbraw/zinc/38/48/95/1359384895.db2.gz	OPPDGMSRRHJLSG-UXPWSPDFSA-N	0	3	349.478	3.030	20	30		EGEDHN
C=CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc(C(C)C)no1	ZINC001087305458	1359390558	/nfs/dbraw/zinc/39/05/58/1359390558.db2.gz	SSEPFUBDQPRYKR-XOKHGSTOSA-N	0	3	331.460	3.203	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc2cc[nH]c2c1	ZINC001087305991	1359392139	/nfs/dbraw/zinc/39/21/39/1359392139.db2.gz	BOURPVQSZBZNNW-YZGWKJHDSA-N	0	3	349.478	3.410	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)Cc3ccsc3C)C(C)(C)[C@H]21	ZINC001087307848	1359394560	/nfs/dbraw/zinc/39/45/60/1359394560.db2.gz	IEWOLNVAZMEBNL-QRQLOZEOSA-N	0	3	344.524	3.228	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccoc3CCC)C(C)(C)[C@@H]21	ZINC001087312167	1359399855	/nfs/dbraw/zinc/39/98/55/1359399855.db2.gz	AAEKSPQHGIBLJB-KBAYOESNSA-N	0	3	328.456	3.084	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccoc3CCC)C(C)(C)[C@@H]21	ZINC001087312758	1359401277	/nfs/dbraw/zinc/40/12/77/1359401277.db2.gz	JWZBTKBXRMTLKP-BHIYHBOVSA-N	0	3	342.483	3.474	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc(F)cc1Cl	ZINC001087315914	1359405852	/nfs/dbraw/zinc/40/58/52/1359405852.db2.gz	KFZQSHWPOYXVBN-HYVNUMGLSA-N	0	3	348.849	3.331	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1sccc1CC	ZINC001087317683	1359409233	/nfs/dbraw/zinc/40/92/33/1359409233.db2.gz	LIUFIUWPZNJFDS-HYVNUMGLSA-N	0	3	330.497	3.163	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)C3CCC(C)(C)CC3)C(C)(C)[C@H]21	ZINC001087318701	1359410451	/nfs/dbraw/zinc/41/04/51/1359410451.db2.gz	BKOAGZSNUFFGND-SQNIBIBYSA-N	0	3	330.516	3.441	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1c[nH]c2ccc(C)cc12	ZINC001087319843	1359412059	/nfs/dbraw/zinc/41/20/59/1359412059.db2.gz	VGXAOEVZQGVJPC-UIAACRFSSA-N	0	3	349.478	3.328	20	30		EGEDHN
O=C(C1CCC1)N1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(CC#Cc2ccccc2)C1	ZINC001087325890	1359416622	/nfs/dbraw/zinc/41/66/22/1359416622.db2.gz	JRMATFBBIJCTKF-CMOCDZPBSA-N	0	3	348.490	3.007	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)c2cc(C#N)c[nH]2)CCN1C/C=C/c1ccccc1	ZINC001087534770	1359518263	/nfs/dbraw/zinc/51/82/63/1359518263.db2.gz	JALPRHWOKRXOIF-ULXJXQFFSA-N	0	3	348.450	3.182	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)C2CC(F)(F)C2)CCN1Cc1ccc(C#N)cc1	ZINC001087536380	1359518958	/nfs/dbraw/zinc/51/89/58/1359518958.db2.gz	ITMCENUIXADTEN-DLBZAZTESA-N	0	3	347.409	3.073	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)c2ccc(C#N)[nH]2)CCN1C/C=C\c1ccccc1	ZINC001087546066	1359525494	/nfs/dbraw/zinc/52/54/94/1359525494.db2.gz	OBZFYBCLXSLBDW-LZYRERBLSA-N	0	3	348.450	3.182	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)C2(C)CCC2)CCN1Cc1ccc(C#N)cc1	ZINC001087688446	1359590652	/nfs/dbraw/zinc/59/06/52/1359590652.db2.gz	HZCSUKFSQBUTGG-ZWKOTPCHSA-N	0	3	325.456	3.218	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)Cc2csc(C(C)(C)C)n2)[C@H]1CC	ZINC001087763339	1359633067	/nfs/dbraw/zinc/63/30/67/1359633067.db2.gz	OJARDFSITVTMJT-LSDHHAIUSA-N	0	3	335.517	3.138	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccnc(C(F)(F)F)c2)[C@H]1CC	ZINC001087783871	1359641686	/nfs/dbraw/zinc/64/16/86/1359641686.db2.gz	ZCFSPPWZGSRJEH-UONOGXRCSA-N	0	3	341.377	3.259	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnn(C(C)C)c2C2CC2)[C@H]1CC	ZINC001087789717	1359646154	/nfs/dbraw/zinc/64/61/54/1359646154.db2.gz	DZKUQUJQDATURV-DLBZAZTESA-N	0	3	330.476	3.110	20	30		EGEDHN
Cc1ccoc1C(=O)N1C[C@H]2CCN(Cc3ccc(C#N)cc3)C[C@H]2C1	ZINC001087886083	1359696509	/nfs/dbraw/zinc/69/65/09/1359696509.db2.gz	UQJBUEAVMWYSIH-MOPGFXCFSA-N	0	3	349.434	3.054	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3coc4ccc(CC)cc34)C[C@@H]2C1	ZINC001087968157	1359721208	/nfs/dbraw/zinc/72/12/08/1359721208.db2.gz	CRHUIYVJAIJYLR-SJORKVTESA-N	0	3	336.435	3.022	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3scc(C)c3Cl)C[C@@H]2C1	ZINC001087977812	1359724579	/nfs/dbraw/zinc/72/45/79/1359724579.db2.gz	XKSRKOSYJLCBMQ-KGLIPLIRSA-N	0	3	336.888	3.127	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3cc4ccc(F)cc4s3)C[C@@H]2C1	ZINC001088030705	1359729082	/nfs/dbraw/zinc/72/90/82/1359729082.db2.gz	DRTYCJKAEUUFIE-CABCVRRESA-N	0	3	342.439	3.068	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3cn(CC)c4ccccc34)C[C@@H]2C1	ZINC001088033322	1359729811	/nfs/dbraw/zinc/72/98/11/1359729811.db2.gz	CLKZBDIAUGHSHX-MSOLQXFVSA-N	0	3	349.478	3.078	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CCN(Cc3cccc(C#N)c3)C[C@H]2C1	ZINC001088066510	1359740049	/nfs/dbraw/zinc/74/00/49/1359740049.db2.gz	NCASDGYWYVBEAU-MOPGFXCFSA-N	0	3	337.467	3.051	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CCN(Cc4cncc(C)c4)C[C@H]3C2)C1	ZINC001088098264	1359755438	/nfs/dbraw/zinc/75/54/38/1359755438.db2.gz	BFJZQVVCQRRTCJ-MOPGFXCFSA-N	0	3	339.483	3.027	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3ccc4c(c3)CCC=C4)C[C@@H]2C1	ZINC001088171681	1359779238	/nfs/dbraw/zinc/77/92/38/1359779238.db2.gz	BKYNCDDMGLAOSY-RTWAWAEBSA-N	0	3	334.463	3.063	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3cccc(C(F)F)c3)C[C@@H]2C1	ZINC001088177715	1359782479	/nfs/dbraw/zinc/78/24/79/1359782479.db2.gz	RYJNEIBWEOFYRW-SJORKVTESA-N	0	3	332.394	3.041	20	30		EGEDHN
C=CCN1CC[C@H](OCC2CCN(C(=O)c3cccc(C)c3)CC2)C1	ZINC001088225546	1359803615	/nfs/dbraw/zinc/80/36/15/1359803615.db2.gz	PCEPUAIIYREAHF-FQEVSTJZSA-N	0	3	342.483	3.124	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2csc(C)n2)C1	ZINC001088368352	1359852091	/nfs/dbraw/zinc/85/20/91/1359852091.db2.gz	IIHXLXHSSJFBBK-ZDUSSCGKSA-N	0	3	327.881	3.178	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCCCC[C@@H](NCc3cncs3)C2)C1	ZINC001088378310	1359861441	/nfs/dbraw/zinc/86/14/41/1359861441.db2.gz	DWBJMTLEXHYJON-OAHLLOKOSA-N	0	3	333.501	3.360	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)CCc2cncs2)C1	ZINC001088381184	1359865178	/nfs/dbraw/zinc/86/51/78/1359865178.db2.gz	YZYLSCLBWLEIOC-CQSZACIVSA-N	0	3	341.908	3.189	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2ccc(OC)o2)C1	ZINC001088404566	1359877394	/nfs/dbraw/zinc/87/73/94/1359877394.db2.gz	ZNZCOSPOZYIHCI-ZDUSSCGKSA-N	0	3	326.824	3.015	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2c(C)nsc2C)C1	ZINC001088432223	1359900076	/nfs/dbraw/zinc/90/00/76/1359900076.db2.gz	PDLQXOYUAIGEMD-AWEZNQCLSA-N	0	3	341.908	3.487	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](CNCc2nc(C)sc2C)[C@H](C)C1	ZINC001184311207	1387426625	/nfs/dbraw/zinc/42/66/25/1387426625.db2.gz	GMYPYKFMFWLPGB-RHSMWYFYSA-N	0	3	347.528	3.138	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2coc3c2cccc3OC)[C@H]1C	ZINC001088570307	1359976221	/nfs/dbraw/zinc/97/62/21/1359976221.db2.gz	OCPHBBHENDZKQA-CJNGLKHVSA-N	0	3	328.412	3.210	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3cc(C)cc(C)c3)[C@@H]2C)nc1	ZINC001088988364	1360125876	/nfs/dbraw/zinc/12/58/76/1360125876.db2.gz	RCKHIULQOVGOSQ-XLIONFOSSA-N	0	3	347.462	3.073	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCCN1C(=O)/C=C\C1CC1	ZINC001089146114	1360201597	/nfs/dbraw/zinc/20/15/97/1360201597.db2.gz	SVSXHXXEDRYLIR-DUQGCJEPSA-N	0	3	337.467	3.337	20	30		EGEDHN
C[C@@H](C(=O)N1CCCC[C@H]1CN(C)Cc1ccc(C#N)cc1)C1CC1	ZINC001089147628	1360202870	/nfs/dbraw/zinc/20/28/70/1360202870.db2.gz	AYCLTTIRXHQVHX-UZLBHIALSA-N	0	3	339.483	3.417	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc(C)cc(OC)c2C)CC(C)(C)C1	ZINC001089430536	1360422368	/nfs/dbraw/zinc/42/23/68/1360422368.db2.gz	ODZWTEIMHZICNT-QGZVFWFLSA-N	0	3	342.483	3.166	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc3c(c2)[C@H](C)CO3)CC(C)(C)C1	ZINC001089468749	1360452295	/nfs/dbraw/zinc/45/22/95/1360452295.db2.gz	CQTUVNVSQCZUGW-NVXWUHKLSA-N	0	3	340.467	3.036	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2cccc(Cl)c2)CC(C)(C)C1	ZINC001089480035	1360462158	/nfs/dbraw/zinc/46/21/58/1360462158.db2.gz	MYKRXIZGZBHNRF-KRWDZBQOSA-N	0	3	332.875	3.123	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2c(F)ccc(C)c2F)CC(C)(C)C1	ZINC001089484487	1360464925	/nfs/dbraw/zinc/46/49/25/1360464925.db2.gz	XTGODBCRDORNGZ-AWEZNQCLSA-N	0	3	334.410	3.127	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cccc(F)c2Cl)CC(C)(C)C1	ZINC001089501181	1360475103	/nfs/dbraw/zinc/47/51/03/1360475103.db2.gz	BSOAIUSBHQFAJG-CYBMUJFWSA-N	0	3	336.838	3.333	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@@H](C)c2cccc(C)c2)CC(C)(C)C1	ZINC001089505372	1360477908	/nfs/dbraw/zinc/47/79/08/1360477908.db2.gz	FWIDFVXHVLKLSR-HKUYNNGSSA-N	0	3	326.484	3.339	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ncoc2C(C)(C)C)CC(C)(C)C1	ZINC001089538860	1360496835	/nfs/dbraw/zinc/49/68/35/1360496835.db2.gz	XZXAFAXCSIDZFQ-OAHLLOKOSA-N	0	3	345.487	3.216	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(C/C=C\Cl)CC(C)(C)C2)nc1	ZINC001089544469	1360499927	/nfs/dbraw/zinc/49/99/27/1360499927.db2.gz	SUEFYGYDIGXFTF-GEZBDVBVSA-N	0	3	345.874	3.036	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc3c(c2)CCCC3)CC(C)(C)C1	ZINC001089551242	1360503091	/nfs/dbraw/zinc/50/30/91/1360503091.db2.gz	FBPJUZHUSXXNOS-HXUWFJFHSA-N	0	3	338.495	3.419	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2scnc2Cl)CC(C)(C)C1	ZINC001089562398	1360509862	/nfs/dbraw/zinc/50/98/62/1360509862.db2.gz	DCOAEEFITHNHPX-LBPRGKRZSA-N	0	3	339.892	3.040	20	30		EGEDHN
CC(C)=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(C#N)[nH]1	ZINC001089626336	1360544366	/nfs/dbraw/zinc/54/43/66/1360544366.db2.gz	GJTRKALSWAKVDH-INIZCTEOSA-N	0	3	328.460	3.073	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1c(C)noc1CCC	ZINC001089639751	1360552919	/nfs/dbraw/zinc/55/29/19/1360552919.db2.gz	YYALOMMFYKDFPY-INIZCTEOSA-N	0	3	345.487	3.179	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cncc2[nH]ccc21	ZINC001089665080	1360574716	/nfs/dbraw/zinc/57/47/16/1360574716.db2.gz	SVFMHSWJNFJTBL-OAHLLOKOSA-N	0	3	340.471	3.359	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(C(C)(C)C)on1	ZINC001089668980	1360578483	/nfs/dbraw/zinc/57/84/83/1360578483.db2.gz	DBKTTYMQMDVQTC-HNNXBMFYSA-N	0	3	345.487	3.216	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1nc(C)c(C)nc1C	ZINC001089668662	1360578969	/nfs/dbraw/zinc/57/89/69/1360578969.db2.gz	ZXPACSXMRXSKAO-QGZVFWFLSA-N	0	3	344.503	3.198	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1cccc2c1CCOC2	ZINC001089669225	1360579184	/nfs/dbraw/zinc/57/91/84/1360579184.db2.gz	IXSZKZIWZWBRAW-KRWDZBQOSA-N	0	3	342.483	3.166	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(C)cn2ccnc12	ZINC001089671296	1360581498	/nfs/dbraw/zinc/58/14/98/1360581498.db2.gz	NUUQKVITEQIRMI-MRXNPFEDSA-N	0	3	340.471	3.049	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(C(C)C)on1	ZINC001089676508	1360584926	/nfs/dbraw/zinc/58/49/26/1360584926.db2.gz	IYMHOAVGESNFOQ-HNNXBMFYSA-N	0	3	331.460	3.042	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(OC)cc1C	ZINC001089687439	1360593784	/nfs/dbraw/zinc/59/37/84/1360593784.db2.gz	JXBZNDKJYHLREG-INIZCTEOSA-N	0	3	330.472	3.410	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(F)c(OC)c1	ZINC001089696965	1360602047	/nfs/dbraw/zinc/60/20/47/1360602047.db2.gz	KDEJERQKLJETBR-OAHLLOKOSA-N	0	3	334.435	3.241	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)C1CC2(C1)CCOCC2	ZINC001089726683	1360630011	/nfs/dbraw/zinc/63/00/11/1360630011.db2.gz	UAIIBEHVYXWBQP-SFHVURJKSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ncccc1OCC	ZINC001089741637	1360645388	/nfs/dbraw/zinc/64/53/88/1360645388.db2.gz	FANAIGZNYHHOHT-MRXNPFEDSA-N	0	3	345.487	3.277	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1ccccc1	ZINC001089759835	1360652621	/nfs/dbraw/zinc/65/26/21/1360652621.db2.gz	DVXBIUFJUGHOPZ-MLHJIOFPSA-N	0	3	330.859	3.222	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)CC1CCCC1	ZINC001089762108	1360653785	/nfs/dbraw/zinc/65/37/85/1360653785.db2.gz	CNCCJMFSXLUYDA-FJIDUMEYSA-N	0	3	336.907	3.488	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1C=CC=CC=C1	ZINC001089812835	1360674540	/nfs/dbraw/zinc/67/45/40/1360674540.db2.gz	PDFPUAIGOFYPPR-OKYOBFRVSA-N	0	3	344.886	3.206	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1cocc1C	ZINC001089846907	1360695285	/nfs/dbraw/zinc/69/52/85/1360695285.db2.gz	NPOLUNBFZHPTSA-IVSAIRAKSA-N	0	3	334.847	3.123	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CC2CCCC2)CC2(CCOCC2)C1	ZINC001089920362	1360745141	/nfs/dbraw/zinc/74/51/41/1360745141.db2.gz	QTADMGMKRLHRQF-GOSISDBHSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)C2CCCCCC2)CC2(CCOCC2)C1	ZINC001089928247	1360748791	/nfs/dbraw/zinc/74/87/91/1360748791.db2.gz	ZJHWONHVWSSWFI-SFHVURJKSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccsc2C)CC2(CCOCC2)C1	ZINC001089939563	1360754776	/nfs/dbraw/zinc/75/47/76/1360754776.db2.gz	PZTJFEDMTYERGB-INIZCTEOSA-N	0	3	348.512	3.234	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc(Cl)ccc2F)C1	ZINC001091130972	1360995556	/nfs/dbraw/zinc/99/55/56/1360995556.db2.gz	ZAWRHNMDQUBOED-UHFFFAOYSA-N	0	3	331.218	3.330	20	30		EGEDHN
C=C1CCC(C(=O)NCC2CC(NCc3c(C)noc3C)C2)CC1	ZINC001091213467	1361009622	/nfs/dbraw/zinc/00/96/22/1361009622.db2.gz	OCFFFOWPWWLZMJ-UHFFFAOYSA-N	0	3	331.460	3.022	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc3cccnc3c2)C1	ZINC001091288837	1361032709	/nfs/dbraw/zinc/03/27/09/1361032709.db2.gz	DLXRBVIHTOYEFI-UHFFFAOYSA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2c(Cl)cccc2OC)C1	ZINC001091375898	1361067725	/nfs/dbraw/zinc/06/77/25/1361067725.db2.gz	BRVMSTRDQMCIOI-UHFFFAOYSA-N	0	3	343.254	3.199	20	30		EGEDHN
Cc1ccoc1C(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@@]2(C)C1	ZINC001091483541	1361116035	/nfs/dbraw/zinc/11/60/35/1361116035.db2.gz	SVYVDHHIVYIVAR-NQIIRXRSSA-N	0	3	349.434	3.054	20	30		EGEDHN
Cc1ccc(CN2C[C@@H]3CN(C(=O)[C@@H](C)C#N)C[C@]3(C)C2)c(Cl)c1	ZINC001091543934	1361141072	/nfs/dbraw/zinc/14/10/72/1361141072.db2.gz	QUDYRMDKGFYTDA-GMBSWORKSA-N	0	3	345.874	3.088	20	30		EGEDHN
CC(C(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@@]2(C)C1)=C1CCC1	ZINC001091657396	1361171926	/nfs/dbraw/zinc/17/19/26/1361171926.db2.gz	WVGBBPGPIPULSN-IRLDBZIGSA-N	0	3	349.478	3.339	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3c(C)oc4ccccc43)C[C@]2(C)C1	ZINC001091695948	1361183216	/nfs/dbraw/zinc/18/32/16/1361183216.db2.gz	APDIGILJYVYWAC-IERDGZPVSA-N	0	3	336.435	3.158	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc(CCC)s3)C[C@]2(C)C1	ZINC001091707172	1361186640	/nfs/dbraw/zinc/18/66/40/1361186640.db2.gz	JDQKLQKADUQMPY-BEFAXECRSA-N	0	3	330.497	3.118	20	30		EGEDHN
C[C@@]12CN(Cc3cccc(C#N)c3)C[C@@H]1CN(C(=O)C1(C3CC3)CC1)C2	ZINC001091767735	1361214727	/nfs/dbraw/zinc/21/47/27/1361214727.db2.gz	OHFVMSSXMUFAKF-CTNGQTDRSA-N	0	3	349.478	3.029	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CN(Cc3scnc3C)C[C@@]2(C)C1	ZINC001091978452	1361265394	/nfs/dbraw/zinc/26/53/94/1361265394.db2.gz	RRDQUPOJZIQLIK-MNEFBYGVSA-N	0	3	347.528	3.334	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H]3CN(Cc4ccccn4)C[C@@]3(C)C2)CC1	ZINC001091979285	1361266023	/nfs/dbraw/zinc/26/60/23/1361266023.db2.gz	ZIDZDRUGHYYZHT-NQIIRXRSSA-N	0	3	339.483	3.108	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C[C@@H](C)c3ccccc3F)C[C@]2(C)C1	ZINC001092101991	1361301285	/nfs/dbraw/zinc/30/12/85/1361301285.db2.gz	RKJQYYBTBPUSJI-LZJOCLMNSA-N	0	3	342.458	3.123	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C34CC(C(C)(C)C)(C3)C4)C[C@]2(C)C1	ZINC001092312935	1361362342	/nfs/dbraw/zinc/36/23/42/1361362342.db2.gz	MMWQTQRRDJJEJF-OSAGKFRWSA-N	0	3	328.500	3.006	20	30		EGEDHN
C=C[C@H](COC)N[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)c2ccccc21	ZINC001324020747	1387511988	/nfs/dbraw/zinc/51/19/88/1387511988.db2.gz	BCHUSNZMRUYJEI-KBRIMQKVSA-N	0	3	332.444	3.488	20	30		EGEDHN
CC(=O)N1CCC([C@@H]2N(Cc3ccc(C#N)s3)CC23CCC3)CC1	ZINC001093348681	1361563572	/nfs/dbraw/zinc/56/35/72/1361563572.db2.gz	SIJYTRWDHIZEFM-SFHVURJKSA-N	0	3	343.496	3.233	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)/C=C(\C)C2CC2)CC1	ZINC001093359851	1361571967	/nfs/dbraw/zinc/57/19/67/1361571967.db2.gz	VOKXYEKWXBJTLP-KETLNSEPSA-N	0	3	326.484	3.069	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@H]2[C@@H]3CCCC[C@@H]32)CC1	ZINC001093364147	1361575038	/nfs/dbraw/zinc/57/50/38/1361575038.db2.gz	MTAMJSWARFMHRS-NMLBUPMWSA-N	0	3	340.511	3.149	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)[C@H](C)C(C)(C)C)CC1	ZINC001093372329	1361581921	/nfs/dbraw/zinc/58/19/21/1361581921.db2.gz	CEYQNWGPJDAVSV-FUHWJXTLSA-N	0	3	330.516	3.395	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C[C@@H]2C=CCCC2)CC1	ZINC001093372607	1361582619	/nfs/dbraw/zinc/58/26/19/1361582619.db2.gz	FXBLMZLMYZIXRD-WIYYLYMNSA-N	0	3	340.511	3.459	20	30		EGEDHN
C[C@@H](C(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1)C1CCC1	ZINC001093854492	1361706158	/nfs/dbraw/zinc/70/61/58/1361706158.db2.gz	ZDSYBXSHSFYNFF-JXXFODFXSA-N	0	3	339.483	3.179	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3ccc(CCC)s3)CCC[C@@H]12	ZINC001094427658	1361798085	/nfs/dbraw/zinc/79/80/85/1361798085.db2.gz	WZYNNTMZENGFKB-IEBWSBKVSA-N	0	3	330.497	3.308	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCN2CCC(Cc3ccccc3)CC2)C1	ZINC001184791415	1387541163	/nfs/dbraw/zinc/54/11/63/1387541163.db2.gz	FZLPIKBBIXTSKB-UHFFFAOYSA-N	0	3	326.484	3.414	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1C[C@H]2C[C@@H](C1)N(C(=O)CCC1CC1)C2	ZINC001094879869	1361933246	/nfs/dbraw/zinc/93/32/46/1361933246.db2.gz	MVCFTXMDEOONLB-DBVUQKKJSA-N	0	3	337.467	3.218	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC[C@@H]1CNCc1cnc(C)s1	ZINC001324162925	1387549795	/nfs/dbraw/zinc/54/97/95/1387549795.db2.gz	NEWNUOURCQWRDV-MRXNPFEDSA-N	0	3	333.501	3.301	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1c(F)c(F)cc(F)c1F)C2	ZINC001095450309	1362145412	/nfs/dbraw/zinc/14/54/12/1362145412.db2.gz	VWFBGEOAHNVQRM-ICCXJUOJSA-N	0	3	342.336	3.154	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cccc3c1CCCCC3)C2	ZINC001095581223	1362175392	/nfs/dbraw/zinc/17/53/92/1362175392.db2.gz	HOGAGWQHWLDXMO-QMMLZNLJSA-N	0	3	336.479	3.314	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3CC(=C)C)cc1	ZINC001095634307	1362191829	/nfs/dbraw/zinc/19/18/29/1362191829.db2.gz	IKHAUPSFGJWOSR-NEWSRXKRSA-N	0	3	326.440	3.163	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3CC[C@H](C)F)cc1	ZINC001095634618	1362192152	/nfs/dbraw/zinc/19/21/52/1362192152.db2.gz	XIYAGSFNDMRSDY-FXECBMLZSA-N	0	3	346.446	3.335	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CC[C@H](C)F	ZINC001095635618	1362192372	/nfs/dbraw/zinc/19/23/72/1362192372.db2.gz	KOFSGQACIXWNOP-MVJTYMMSSA-N	0	3	346.446	3.335	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(-n3cccc3)cc1)C2	ZINC001095706389	1362206840	/nfs/dbraw/zinc/20/68/40/1362206840.db2.gz	LWOISVQWHCZOEH-AABGKKOBSA-N	0	3	335.451	3.389	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1oc(CC(C)C)nc1C)C2	ZINC001096129206	1362398538	/nfs/dbraw/zinc/39/85/38/1362398538.db2.gz	POTWZQXRVNUSFD-PMPSAXMXSA-N	0	3	331.460	3.093	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(-c3ccccc3)nc1)C2	ZINC001096230849	1362445131	/nfs/dbraw/zinc/44/51/31/1362445131.db2.gz	HLGYZBPQIULQCQ-GIVPXCGWSA-N	0	3	345.446	3.107	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cnc([C@H](C)OC)s1)C2	ZINC001097079711	1362835198	/nfs/dbraw/zinc/83/51/98/1362835198.db2.gz	NQFZDNWMIISKFC-YJNKXOJESA-N	0	3	349.500	3.152	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cn3cc(C)nc3s1)C2	ZINC001097219173	1362890851	/nfs/dbraw/zinc/89/08/51/1362890851.db2.gz	VTWHVYUPXYVMKP-KFWWJZLASA-N	0	3	344.484	3.006	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](CNCc2oc(C)nc2C)[C@@H](C)C1	ZINC001185062783	1387605414	/nfs/dbraw/zinc/60/54/14/1387605414.db2.gz	VLALCVACNTZNMD-WMLDXEAASA-N	0	3	333.476	3.222	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc3ccccc3cc1F)C2	ZINC001097516241	1363033799	/nfs/dbraw/zinc/03/37/99/1363033799.db2.gz	SUUICCIVKXYHBH-AHRSYUTCSA-N	0	3	336.410	3.337	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(C(F)F)c(F)c1)C2	ZINC001097837662	1363137403	/nfs/dbraw/zinc/13/74/03/1363137403.db2.gz	PHPHLCFPGBRURU-WQVCFCJDSA-N	0	3	336.357	3.122	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C1(c3cccc(F)c3)CC1)C2	ZINC001097970764	1363184310	/nfs/dbraw/zinc/18/43/10/1363184310.db2.gz	SSUCVEQQHSJEPS-KURKYZTESA-N	0	3	328.431	3.155	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)C[C@@H](NC(=O)C(C)(C)F)c1ccccc1O2	ZINC001098541243	1363362571	/nfs/dbraw/zinc/36/25/71/1363362571.db2.gz	JJSVNDHANPXAFM-OXQOHEQNSA-N	0	3	346.446	3.395	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)C[C@H](NC(=O)C1(C)CC1)c1ccccc1O2	ZINC001098541695	1363363738	/nfs/dbraw/zinc/36/37/38/1363363738.db2.gz	QNVJRMCPTZDTOM-LAUBAEHRSA-N	0	3	340.467	3.447	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C(C)=C1CCCC1)C[C@@H](C)O2	ZINC001098583031	1363388410	/nfs/dbraw/zinc/38/84/10/1363388410.db2.gz	IITOWXOVAYAOOQ-MRXNPFEDSA-N	0	3	332.488	3.145	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1CCC(C)=C(C)C1)C[C@@H](C)O2	ZINC001098600314	1363393979	/nfs/dbraw/zinc/39/39/79/1363393979.db2.gz	YTBKSKAEIGSWDD-MOPGFXCFSA-N	0	3	346.515	3.391	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@H]1CC=CCC1)C[C@@H](C)O2	ZINC001098623770	1363404003	/nfs/dbraw/zinc/40/40/03/1363404003.db2.gz	QJXORSXYZWIEJC-MSOLQXFVSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccccc1CC)C[C@H](C)O2	ZINC001098631216	1363406978	/nfs/dbraw/zinc/40/69/78/1363406978.db2.gz	RVBKROSHWBYYBD-KRWDZBQOSA-N	0	3	342.483	3.131	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1cc(C)c(CC)o1)C[C@H](C)O2	ZINC001098653954	1363420053	/nfs/dbraw/zinc/42/00/53/1363420053.db2.gz	RXATXSRYFAICJU-INIZCTEOSA-N	0	3	346.471	3.032	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccc(C)c(C)c1)C[C@H](C)O2	ZINC001098658285	1363422437	/nfs/dbraw/zinc/42/24/37/1363422437.db2.gz	BMVZTTXLKNPJGP-SFHVURJKSA-N	0	3	342.483	3.185	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1CC3CCC1CC3)C[C@@H](C)O2	ZINC001098663187	1363425127	/nfs/dbraw/zinc/42/51/27/1363425127.db2.gz	YKIMFBJBHIOROT-UGXKVIGPSA-N	0	3	346.515	3.081	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cccc3scnc32)C1	ZINC001098835108	1363487437	/nfs/dbraw/zinc/48/74/37/1363487437.db2.gz	JZYARAXXKBBGKW-UGSOOPFHSA-N	0	3	327.453	3.067	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2oc(CC3CC3)nc2C)C1	ZINC001098837048	1363487669	/nfs/dbraw/zinc/48/76/69/1363487669.db2.gz	LCLMHZHGLMMMGW-JXFKEZNVSA-N	0	3	343.471	3.096	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)C[C@@H]2C[C@H]2c2ccccc2)C1	ZINC001098843055	1363489329	/nfs/dbraw/zinc/48/93/29/1363489329.db2.gz	WNOYJAIBYZCLIK-XWUOBKMESA-N	0	3	336.479	3.174	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2nsc3ccccc32)C1	ZINC001098851977	1363492693	/nfs/dbraw/zinc/49/26/93/1363492693.db2.gz	ZEMPCZSTMSLGEV-UGSOOPFHSA-N	0	3	327.453	3.067	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)C[C@@H]1C=CCC1	ZINC001098890334	1363507161	/nfs/dbraw/zinc/50/71/61/1363507161.db2.gz	YDLGYJMONXWIBW-MSOLQXFVSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2n[nH]c(C3CC3)c2Cl)C1	ZINC001098920361	1363520484	/nfs/dbraw/zinc/52/04/84/1363520484.db2.gz	KMCUXNDKRRADJF-UGSOOPFHSA-N	0	3	348.878	3.101	20	30		EGEDHN
C[C@H](C#N)C(=O)NC[C@H]1CCC(C)(C)CN1Cc1ccc(CF)cc1	ZINC001098976999	1363551027	/nfs/dbraw/zinc/55/10/27/1363551027.db2.gz	YTDGKTHXRSLBSF-CRAIPNDOSA-N	0	3	345.462	3.423	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC[C@H]1CCC(C)(C)CN1CCc1ccccc1F	ZINC001098981890	1363555276	/nfs/dbraw/zinc/55/52/76/1363555276.db2.gz	GTJPLOVTKWXDHP-DOTOQJQBSA-N	0	3	345.462	3.135	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)Cc2c(C)cc(C)cc2C)C1	ZINC001099010768	1363572562	/nfs/dbraw/zinc/57/25/62/1363572562.db2.gz	MXODXRCMHZWPQG-UGKGYDQZSA-N	0	3	338.495	3.148	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(C)c(C)o1	ZINC001099016528	1363576416	/nfs/dbraw/zinc/57/64/16/1363576416.db2.gz	LQCPJFFUIQDZTE-QGZVFWFLSA-N	0	3	348.487	3.319	20	30		EGEDHN
C#CCCCC(=O)NC[C@H]1CCC(C)(C)CN1CCOCCCC	ZINC001099043558	1363590319	/nfs/dbraw/zinc/59/03/19/1363590319.db2.gz	PXIOEXKVURZFFI-GOSISDBHSA-N	0	3	336.520	3.213	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H](C)Cn1ccc(C)n1	ZINC001099098073	1363620020	/nfs/dbraw/zinc/62/00/20/1363620020.db2.gz	IWCLPUKOBKANPI-SJLPKXTDSA-N	0	3	346.519	3.011	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)Cc1noc2ccccc12	ZINC001099135859	1363647509	/nfs/dbraw/zinc/64/75/09/1363647509.db2.gz	QZGTVNANNMRGCJ-HNNXBMFYSA-N	0	3	341.455	3.163	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cccc3c2OCC3(C)C)C1	ZINC001099187581	1363680140	/nfs/dbraw/zinc/68/01/40/1363680140.db2.gz	PWPJTEVGCZWMON-BTYIYWSLSA-N	0	3	340.467	3.127	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@@H]2C[C@H]2C(C)(C)C)C[C@H]1C(F)(F)F	ZINC001099279454	1363729012	/nfs/dbraw/zinc/72/90/12/1363729012.db2.gz	ZENHSBLNDQJYCM-AAVRWANBSA-N	0	3	332.410	3.224	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2c(C)oc(C)c2C)C[C@H]1C(F)(F)F	ZINC001099276663	1363728009	/nfs/dbraw/zinc/72/80/09/1363728009.db2.gz	IFZQZMFRUAGPFW-ZIAGYGMSSA-N	0	3	344.377	3.373	20	30		EGEDHN
CCCCCCCCC(=O)NC[C@H]1CCC(C)(C)CN1CCO	ZINC001099316665	1363746460	/nfs/dbraw/zinc/74/64/60/1363746460.db2.gz	ZCUYIIUSENJWTH-QGZVFWFLSA-N	0	3	326.525	3.336	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2ccoc2CCC)C[C@H]1C(F)(F)F	ZINC001099330972	1363754652	/nfs/dbraw/zinc/75/46/52/1363754652.db2.gz	NNJAZXFTFCEEBN-ZIAGYGMSSA-N	0	3	344.377	3.401	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2cc(F)cc(F)c2)C[C@H]1C(F)(F)F	ZINC001099340482	1363760627	/nfs/dbraw/zinc/76/06/27/1363760627.db2.gz	UXNYZLHALUKBFQ-ZIAGYGMSSA-N	0	3	348.315	3.133	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2cncc3ccccc32)C[C@H]1C(F)(F)F	ZINC001099345904	1363763450	/nfs/dbraw/zinc/76/34/50/1363763450.db2.gz	AGKZWTFESKVUSL-HZPDHXFCSA-N	0	3	349.356	3.013	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)Cc1cccc(OCC)c1	ZINC001099353920	1363767953	/nfs/dbraw/zinc/76/79/53/1363767953.db2.gz	IRCIWAVTEYAGMF-GOSISDBHSA-N	0	3	344.499	3.421	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H](OC)C1CCCCC1	ZINC001099380848	1363782040	/nfs/dbraw/zinc/78/20/40/1363782040.db2.gz	WNAIJKHOAIKSLE-OALUTQOASA-N	0	3	348.531	3.212	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)CSC(C)C	ZINC001099425340	1363795186	/nfs/dbraw/zinc/79/51/86/1363795186.db2.gz	QOGMPPZUUACJEB-FZKCQIBNSA-N	0	3	342.936	3.049	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H]3CCC[C@]3(CNCc3cc(C)no3)C2)C1	ZINC001099493069	1363819908	/nfs/dbraw/zinc/81/99/08/1363819908.db2.gz	FLFBHKIKEPBIHO-JXFKEZNVSA-N	0	3	343.471	3.058	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCCC(C)C)CC2(CCOCC2)C1	ZINC001099593187	1363875737	/nfs/dbraw/zinc/87/57/37/1363875737.db2.gz	SOOBZELTPLBPSP-GOSISDBHSA-N	0	3	336.520	3.376	20	30		EGEDHN
Cc1nc(C(C)C)oc1CNC1CC(CNC(=O)C#CC(C)(C)C)C1	ZINC001100317094	1364078378	/nfs/dbraw/zinc/07/83/78/1364078378.db2.gz	DIRNFTGEBODKDF-UHFFFAOYSA-N	0	3	345.487	3.140	20	30		EGEDHN
C[C@H](C(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1)C1CCC1	ZINC001100437177	1364114145	/nfs/dbraw/zinc/11/41/45/1364114145.db2.gz	YOPXBLPDDXGAAV-UQHVZDHRSA-N	0	3	343.446	3.118	20	30		EGEDHN
CC1(C(=O)NCC2CC(NCc3ccc(C#N)cc3F)C2)CCCC1	ZINC001100548046	1364156199	/nfs/dbraw/zinc/15/61/99/1364156199.db2.gz	BTLGFDBVSPGGRJ-UHFFFAOYSA-N	0	3	343.446	3.262	20	30		EGEDHN
CCCC1(C(=O)NCC2CC(NCC#Cc3ccccc3)C2)CCC1	ZINC001100589931	1364177099	/nfs/dbraw/zinc/17/70/99/1364177099.db2.gz	AVXHSFQIWYFXPO-UHFFFAOYSA-N	0	3	338.495	3.493	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCC1CC(NCc2c(C)nsc2C)C1	ZINC001100595810	1364181009	/nfs/dbraw/zinc/18/10/09/1364181009.db2.gz	GULFBVVHYDHDAP-QQFBHYJXSA-N	0	3	335.517	3.347	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCC1CC(NCc2cccc(OCC)n2)C1	ZINC001100595913	1364181228	/nfs/dbraw/zinc/18/12/28/1364181228.db2.gz	IQIHDWXLYBRHDT-KLHKWILBSA-N	0	3	345.487	3.067	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@H](CCC)c2ccccn2)C1	ZINC001100610926	1364187727	/nfs/dbraw/zinc/18/77/27/1364187727.db2.gz	CCSVAITVAGANNJ-UYSNPLJNSA-N	0	3	335.879	3.202	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC1CC(NCc2oc(CC)nc2C)C1	ZINC001100711201	1364230756	/nfs/dbraw/zinc/23/07/56/1364230756.db2.gz	DGOFDGPYIBBGKU-UHFFFAOYSA-N	0	3	333.476	3.132	20	30		EGEDHN
CCC[C@@H](CC)C(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100797975	1364266594	/nfs/dbraw/zinc/26/65/94/1364266594.db2.gz	NDBNPTYWURITKY-QPIRBTGLSA-N	0	3	344.474	3.488	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](NCc2cc(F)c(OC)c(F)c2)C1	ZINC001185304766	1387676194	/nfs/dbraw/zinc/67/61/94/1387676194.db2.gz	MSBZPUVCJQICHW-CQSZACIVSA-N	0	3	338.398	3.020	20	30		EGEDHN
C=CCN1CC[C@H](Oc2ccnc(CNC(=O)[C@@H](C)CC(C)C)c2)C1	ZINC001101097758	1364413410	/nfs/dbraw/zinc/41/34/10/1364413410.db2.gz	ZGZXIDBYSDFCRD-LPHOPBHVSA-N	0	3	345.487	3.019	20	30		EGEDHN
C=CCN1CC[C@@H](Oc2ccnc(CNC(=O)[C@@H](CC)CCC)c2)C1	ZINC001101097515	1364413463	/nfs/dbraw/zinc/41/34/63/1364413463.db2.gz	UQGMCGZKLSBGFW-QFBILLFUSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@H]2CN(Cc3cccnc3C)C[C@@]2(C)C1	ZINC001101337569	1364515566	/nfs/dbraw/zinc/51/55/66/1364515566.db2.gz	DUSJBLUYPFJCDX-QFUCXCTJSA-N	0	3	341.499	3.273	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C(CC(C)C)CC(C)C)C[C@]2(C)C1	ZINC001101479546	1364576734	/nfs/dbraw/zinc/57/67/34/1364576734.db2.gz	VNYFYPVBUBCXDV-CTNGQTDRSA-N	0	3	332.532	3.498	20	30		EGEDHN
C=CCCC(=O)N1CCC(C(C)(C)CNCc2nocc2C)CC1	ZINC001101519451	1364595648	/nfs/dbraw/zinc/59/56/48/1364595648.db2.gz	GLTVXXFIEHXUEC-UHFFFAOYSA-N	0	3	333.476	3.304	20	30		EGEDHN
C=CCCC(=O)N1CCC(C(C)(C)CNCc2nccn2CC)CC1	ZINC001101519913	1364595749	/nfs/dbraw/zinc/59/57/49/1364595749.db2.gz	XXLAVJZVMLJRES-UHFFFAOYSA-N	0	3	346.519	3.224	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC2(CN(C[C@@H](C)CC(C)C)C2)n2ccnc21	ZINC001101615203	1364656881	/nfs/dbraw/zinc/65/68/81/1364656881.db2.gz	CDHVEUIQNOHTBI-IRXDYDNUSA-N	0	3	344.503	3.103	20	30		EGEDHN
C/C=C(/C)C(=O)NC[C@@H]1CN(CC#Cc2cccc(Cl)c2)C[C@H]1C	ZINC001101862348	1364754943	/nfs/dbraw/zinc/75/49/43/1364754943.db2.gz	WLNYIXBHCXNHHT-BJBSRSQVSA-N	0	3	344.886	3.342	20	30		EGEDHN
CC[C@H](C)CC(=O)NC[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1C	ZINC001101918706	1364774321	/nfs/dbraw/zinc/77/43/21/1364774321.db2.gz	ZXQQNYOCFYXYKG-HDMKZQKVSA-N	0	3	345.462	3.318	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1CNC(=O)C1(C)CCC1	ZINC001102233461	1364950088	/nfs/dbraw/zinc/95/00/88/1364950088.db2.gz	XMWDZLMRJPSHED-RHSMWYFYSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C	ZINC001102263208	1364975293	/nfs/dbraw/zinc/97/52/93/1364975293.db2.gz	YOQXCQDTKHOQKO-SFHLNBCPSA-N	0	3	338.495	3.325	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@@H]1CN(Cc2cc(C)ns2)C[C@H]1C	ZINC001102263077	1364975782	/nfs/dbraw/zinc/97/57/82/1364975782.db2.gz	UZKVHFQDYCLBPV-FVQBIDKESA-N	0	3	335.517	3.238	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H]1CN(Cc2c(C)onc2CC)C[C@H]1C	ZINC001102295666	1364989077	/nfs/dbraw/zinc/98/90/77/1364989077.db2.gz	UZPCSYKPXNIDSW-GDBMZVCRSA-N	0	3	333.476	3.086	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@@H]1CN(Cc2conc2CC)C[C@H]1C	ZINC001102328775	1365004679	/nfs/dbraw/zinc/00/46/79/1365004679.db2.gz	XLXCYNIFTOFTQL-CLCXKQKWSA-N	0	3	333.476	3.023	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C	ZINC001102410000	1365043254	/nfs/dbraw/zinc/04/32/54/1365043254.db2.gz	FOBAPZQAKADOOS-UYAOXDASSA-N	0	3	338.495	3.325	20	30		EGEDHN
C/C=C(\C)C(=O)NCC[C@@H]1CN(Cc2ccc(C#N)cc2F)C[C@H]1C	ZINC001102841999	1365246858	/nfs/dbraw/zinc/24/68/58/1365246858.db2.gz	PNYBHLQHQCQABV-FZGIQDKVSA-N	0	3	343.446	3.238	20	30		EGEDHN
C=C(C)CCC(=O)NCC[C@@H]1CN(Cc2cc(OC)ccn2)C[C@H]1C	ZINC001103040329	1365351109	/nfs/dbraw/zinc/35/11/09/1365351109.db2.gz	QBZJRFCOWHZVNP-IAGOWNOFSA-N	0	3	345.487	3.021	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCC[C@@H]1CN(Cc2ccc(F)cn2)C[C@H]1C	ZINC001103344894	1365511205	/nfs/dbraw/zinc/51/12/05/1365511205.db2.gz	UVKVHUSJLVSUBJ-GVDBMIGSSA-N	0	3	347.478	3.397	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)C2CCC(F)CC2)C1	ZINC001103403699	1365539651	/nfs/dbraw/zinc/53/96/51/1365539651.db2.gz	ORWUDLHVGQTDKI-GOTCIRLWSA-N	0	3	330.875	3.341	20	30		EGEDHN
C=C1CCC(C(=O)NCC[C@@H]2CN(Cc3ccns3)C[C@H]2C)CC1	ZINC001103401832	1365537225	/nfs/dbraw/zinc/53/72/25/1365537225.db2.gz	PQAVNYXFTUVRAZ-NVXWUHKLSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2ccc(Cl)[nH]2)C1	ZINC001103412592	1365546051	/nfs/dbraw/zinc/54/60/51/1365546051.db2.gz	SPLGXQCUWQTVPK-ZYHUDNBSSA-N	0	3	330.259	3.108	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)CC[C@H]2CCCCO2)C1	ZINC001103483473	1365590289	/nfs/dbraw/zinc/59/02/89/1365590289.db2.gz	DHXZRPYPOVZCEM-DJIMGWMZSA-N	0	3	342.911	3.162	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)C[C@@H](C)n2cccc2)C1	ZINC001103657266	1365706833	/nfs/dbraw/zinc/70/68/33/1365706833.db2.gz	YFPODKRKYMNYAX-DJIMGWMZSA-N	0	3	337.895	3.266	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1CCNC(=O)C(C)(C)C	ZINC001103667915	1365715360	/nfs/dbraw/zinc/71/53/60/1365715360.db2.gz	VRKBUGZGSFPKPA-RHSMWYFYSA-N	0	3	345.462	3.318	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](C)[C@H](CCNCc2oc(C)nc2C)C1	ZINC001104239975	1365965940	/nfs/dbraw/zinc/96/59/40/1365965940.db2.gz	ZTMGFWLDZCKPTB-RHSMWYFYSA-N	0	3	347.503	3.468	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)[C@H](CCNCc2ccccc2C#N)C1	ZINC001104245554	1365966788	/nfs/dbraw/zinc/96/67/88/1365966788.db2.gz	PBCDZYSSILGSRM-YLJYHZDGSA-N	0	3	339.483	3.489	20	30		EGEDHN
CC#CCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2nc(C)cs2)C1	ZINC001104553314	1366072880	/nfs/dbraw/zinc/07/28/80/1366072880.db2.gz	XKPZPXNZDUZIJW-NVXWUHKLSA-N	0	3	347.528	3.219	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)/C=C/C(C)(C)C)CC1	ZINC001105391852	1366439916	/nfs/dbraw/zinc/43/99/16/1366439916.db2.gz	NXEKRUHVOGSZKY-LKQLOZHYSA-N	0	3	328.500	3.315	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC([C@H]2N(C/C=C\Cl)CC23CCC3)CC1	ZINC001105392241	1366440641	/nfs/dbraw/zinc/44/06/41/1366440641.db2.gz	WJYUGRDZYNRHAL-CPNNPKEDSA-N	0	3	348.918	3.491	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC([C@@H]2N(CC#C)CC23CCC3)CC1	ZINC001105394429	1366443257	/nfs/dbraw/zinc/44/32/57/1366443257.db2.gz	WUFKXCRORBBYGV-NRFANRHFSA-N	0	3	340.511	3.296	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(c2ccccc2)C[C@H](NC(=O)[C@H]2C[C@@H]2C)C1	ZINC001105403000	1366449644	/nfs/dbraw/zinc/44/96/44/1366449644.db2.gz	JWPAQIJDECOPLP-LZLXCTOHSA-N	0	3	332.875	3.201	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)N[C@H]1C[C@@](CNCCF)(c2ccccc2)C1	ZINC001105433641	1366465924	/nfs/dbraw/zinc/46/59/24/1366465924.db2.gz	KMVSAVPVNZHFGN-WBQJQJEBSA-N	0	3	332.463	3.220	20	30		EGEDHN
C=CCCC(=O)N1CCCC[C@H]1C1(CNCc2cnns2)CCC1	ZINC001105515534	1366503452	/nfs/dbraw/zinc/50/34/52/1366503452.db2.gz	HRWKQBGTGGINLZ-INIZCTEOSA-N	0	3	348.516	3.145	20	30		EGEDHN
CCC[C@H](C)C(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001105959594	1366602341	/nfs/dbraw/zinc/60/23/41/1366602341.db2.gz	VMVYRLCGYALKEV-FRQCXROJSA-N	0	3	327.472	3.179	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](CNCc2nc(C)c(C)s2)[C@H](C)C1	ZINC001106606364	1366753540	/nfs/dbraw/zinc/75/35/40/1366753540.db2.gz	GPKCZZHXDXBCGZ-CZUORRHYSA-N	0	3	335.517	3.300	20	30		EGEDHN
CCCC(=O)NC[C@]12CCC[C@H]1N(Cc1ccc(C#N)c(F)c1)CC2	ZINC001107261479	1366908025	/nfs/dbraw/zinc/90/80/25/1366908025.db2.gz	CGAZUAZJNJRSHP-UYAOXDASSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@]12CCC[C@H]1N(Cc1conc1C)CC2	ZINC001107534144	1367025969	/nfs/dbraw/zinc/02/59/69/1367025969.db2.gz	ZEYQVOYDPRGIOK-YZGWKJHDSA-N	0	3	345.487	3.446	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@@H](C)Cc1cccc(F)c1)C2	ZINC001109288237	1367039142	/nfs/dbraw/zinc/03/91/42/1367039142.db2.gz	SCLHAIJRGJNKKH-LDTOTXGLSA-N	0	3	342.458	3.139	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H]1CCC(C)=C(C)C1)C2	ZINC001109319795	1367050726	/nfs/dbraw/zinc/05/07/26/1367050726.db2.gz	HGYKIHRCENEUPL-RDGPPVDQSA-N	0	3	332.488	3.047	20	30		EGEDHN
COCC#CCN1CC[C@@]2(CNC(=O)C[C@H](C)C(C)(C)C)CCC[C@@H]12	ZINC001107618388	1367076287	/nfs/dbraw/zinc/07/62/87/1367076287.db2.gz	BMRHKBWDIROYHY-WAOWUJCRSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2C[C@H](OC)c1ccccc1	ZINC001109353167	1367084239	/nfs/dbraw/zinc/08/42/39/1367084239.db2.gz	LIKQJFGAUUIDCN-FYQPLNBISA-N	0	3	342.483	3.452	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCc1cccc(OC)c1F)C2	ZINC001109380887	1367095640	/nfs/dbraw/zinc/09/56/40/1367095640.db2.gz	VWIBIQBBULBHKP-IKGGRYGDSA-N	0	3	346.446	3.065	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](N(C)Cc2ccc(C)c(F)c2)C1	ZINC001189744804	1367100437	/nfs/dbraw/zinc/10/04/37/1367100437.db2.gz	ZRPIWXCBLHPXRD-GOSISDBHSA-N	0	3	330.447	3.360	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](N(C)Cc2cccc(C(F)F)c2)C1	ZINC001189910547	1367129785	/nfs/dbraw/zinc/12/97/85/1367129785.db2.gz	QMVMQXUVLAKHAT-QGZVFWFLSA-N	0	3	334.410	3.460	20	30		EGEDHN
C=CCCCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ncc(F)cc1F)C2	ZINC001109451524	1367130376	/nfs/dbraw/zinc/13/03/76/1367130376.db2.gz	QOPFXSHYNQACBD-PVAVHDDUSA-N	0	3	349.425	3.441	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](N(C)CCOC2CCCCCC2)C1	ZINC001189925371	1367132045	/nfs/dbraw/zinc/13/20/45/1367132045.db2.gz	AURCENMIRPCLQR-SFHVURJKSA-N	0	3	334.504	3.062	20	30		EGEDHN
CN(CCc1c(F)cccc1F)[C@H]1CCN(C(=O)C#CC(C)(C)C)C1	ZINC001190083747	1367168302	/nfs/dbraw/zinc/16/83/02/1367168302.db2.gz	FSAKBMQDWKONDU-HNNXBMFYSA-N	0	3	348.437	3.090	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)C[C@@H](C)CCc3ccccc3)[C@@H]2C1	ZINC001190440614	1367266233	/nfs/dbraw/zinc/26/62/33/1367266233.db2.gz	KJVYHVZMVXPEGN-YSIASYRMSA-N	0	3	326.484	3.364	20	30		EGEDHN
CC(C)CC1(C(=O)N2CC[C@H](N(C)Cc3cccc(C#N)c3)C2)CC1	ZINC001190595318	1367302765	/nfs/dbraw/zinc/30/27/65/1367302765.db2.gz	PGOXSPFAGYEJSA-IBGZPJMESA-N	0	3	339.483	3.417	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2cc[nH]c2C(C)C)C1	ZINC001108153531	1367313827	/nfs/dbraw/zinc/31/38/27/1367313827.db2.gz	QLMMXFGPZKQFQO-JXFKEZNVSA-N	0	3	347.503	3.314	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)C2(CCC=C)CC2)C1	ZINC001108185866	1367329561	/nfs/dbraw/zinc/32/95/61/1367329561.db2.gz	GPPFKJJAEXTTFI-MJGOQNOKSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CCCC1(C(=O)NC[C@@]2(C)CN(CC3CC(C)(C)C3)CCO2)CC1	ZINC001108186475	1367330593	/nfs/dbraw/zinc/33/05/93/1367330593.db2.gz	OSWAELJZTQGEKC-FQEVSTJZSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2cc(C)cc(F)c2)C1	ZINC001108236912	1367353346	/nfs/dbraw/zinc/35/33/46/1367353346.db2.gz	UFUKISHONXGFFV-OXQOHEQNSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=CCCCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1nc(C)oc1C)C2	ZINC001109878025	1367376748	/nfs/dbraw/zinc/37/67/48/1367376748.db2.gz	DMRYJZZKBXWCNI-IKGGRYGDSA-N	0	3	331.460	3.373	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)CCc2ccccc2)C1	ZINC001108363112	1367412291	/nfs/dbraw/zinc/41/22/91/1367412291.db2.gz	WHNVNGDJTKCWBH-WIYYLYMNSA-N	0	3	344.499	3.181	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2cc(C)cc(C)c2)C1	ZINC001108365459	1367414776	/nfs/dbraw/zinc/41/47/76/1367414776.db2.gz	KCTQDBGHVSQXIJ-RXVVDRJESA-N	0	3	344.499	3.479	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCCOc1ccccc1)C2	ZINC001110064288	1367489652	/nfs/dbraw/zinc/48/96/52/1367489652.db2.gz	CZWQLTCXOURKRI-NEWSRXKRSA-N	0	3	328.456	3.143	20	30		EGEDHN
C=CCC[C@@H](C)N1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1scnc1Cl)C2	ZINC001110105023	1367505164	/nfs/dbraw/zinc/50/51/64/1367505164.db2.gz	DLRCCHAIYICVJU-NDBYEHHHSA-N	0	3	339.892	3.486	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1cc(C)ccc1C	ZINC001110177873	1367547454	/nfs/dbraw/zinc/54/74/54/1367547454.db2.gz	MCCOTKHOGYETBR-AABGKKOBSA-N	0	3	342.483	3.118	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccc(CC)cc1	ZINC001110181690	1367550185	/nfs/dbraw/zinc/55/01/85/1367550185.db2.gz	LUABTACJLOMEFE-AABGKKOBSA-N	0	3	342.483	3.063	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3CCC[C@@H](C)O)CCCC1	ZINC001110214653	1367568744	/nfs/dbraw/zinc/56/87/44/1367568744.db2.gz	PHVSHLJZWAKMBW-BDXSIMOUSA-N	0	3	334.504	3.005	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](N(C)CCOc2ccccc2F)C1	ZINC001191913334	1367636859	/nfs/dbraw/zinc/63/68/59/1367636859.db2.gz	WZJJJSOTMBHHAV-IRXDYDNUSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001191913619	1367638090	/nfs/dbraw/zinc/63/80/90/1367638090.db2.gz	ZQXYBDARJYBSRD-VQIMIIECSA-N	0	3	325.456	3.193	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccc2ncccc2c1	ZINC001110368483	1367672588	/nfs/dbraw/zinc/67/25/88/1367672588.db2.gz	CXHZXUNREMHBMR-RLLQIKCJSA-N	0	3	335.451	3.423	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](N(C)CCOCc2ccccc2)C1	ZINC001192092820	1367684877	/nfs/dbraw/zinc/68/48/77/1367684877.db2.gz	DFYLKFODSVVBKX-IBGZPJMESA-N	0	3	330.472	3.092	20	30		EGEDHN
CCCC1(C(=O)N2CC[C@H](N(C)Cc3cccc(C#N)c3)C2)CC1	ZINC001192245619	1367728921	/nfs/dbraw/zinc/72/89/21/1367728921.db2.gz	GJSGLXRTOKZDOV-SFHVURJKSA-N	0	3	325.456	3.171	20	30		EGEDHN
CC(C)CCCC(=O)N1CC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001192489477	1367795126	/nfs/dbraw/zinc/79/51/26/1367795126.db2.gz	FTRKWRXFKBDCEK-IBGZPJMESA-N	0	3	327.472	3.417	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2C[C@H]1CC(C)(C)CO1	ZINC001110595212	1367855248	/nfs/dbraw/zinc/85/52/48/1367855248.db2.gz	GBDMDBMDDQELOP-MKXGPGLRSA-N	0	3	346.515	3.291	20	30		EGEDHN
CCCCCCC[C@H](C)NC(=O)NC1CCN(CCOC)CC1	ZINC001192950018	1367911050	/nfs/dbraw/zinc/91/10/50/1367911050.db2.gz	XGHYHYRVFDNIOK-INIZCTEOSA-N	0	3	327.513	3.145	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cnc(CC3CC3)s1)C2	ZINC001110844162	1368024888	/nfs/dbraw/zinc/02/48/88/1368024888.db2.gz	MAPPGTZJCJILRP-OAGGEKHMSA-N	0	3	345.512	3.397	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2C[C@H]1CC(C)(C)CO1	ZINC001110891907	1368066738	/nfs/dbraw/zinc/06/67/38/1368066738.db2.gz	FEROCKQTNGTGPY-VQHPVUNQSA-N	0	3	334.504	3.125	20	30		EGEDHN
CCCCCCCCC(=O)N1CC[C@H](N(C)CCc2ccnn2C)C1	ZINC001193631139	1368079313	/nfs/dbraw/zinc/07/93/13/1368079313.db2.gz	SYGBTPDPINKSNZ-IBGZPJMESA-N	0	3	348.535	3.246	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](c1ccncc1)C(C)C)C2	ZINC001110946837	1368114253	/nfs/dbraw/zinc/11/42/53/1368114253.db2.gz	YETFXZNSJHJMQO-AKHDSKFASA-N	0	3	327.472	3.119	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2cc(C)n(C(C)C)c2C)C1	ZINC001193913304	1368145401	/nfs/dbraw/zinc/14/54/01/1368145401.db2.gz	BOSKWXSYWZVXHU-GOSISDBHSA-N	0	3	347.503	3.035	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CC1CC(F)(F)C1	ZINC001111073344	1368152812	/nfs/dbraw/zinc/15/28/12/1368152812.db2.gz	FWAXSDXYCDKKGX-KFWWJZLASA-N	0	3	326.431	3.356	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)[C@]2(C)CCC(C)=C(C)C2)C1	ZINC001194360396	1368243365	/nfs/dbraw/zinc/24/33/65/1368243365.db2.gz	ZOISNUGWSSVCEN-UYAOXDASSA-N	0	3	334.504	3.248	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1oc(CCC)nc1C)C2	ZINC001111282249	1368250270	/nfs/dbraw/zinc/25/02/70/1368250270.db2.gz	HWTZWDXWNKKABD-OAGGEKHMSA-N	0	3	331.460	3.237	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)C[C@@H]2CCCCC2(C)C)C1	ZINC001194532495	1368280627	/nfs/dbraw/zinc/28/06/27/1368280627.db2.gz	TVEGBDSYOOZNOG-ZWKOTPCHSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCC[C@H](C(=O)N1CC[C@H](N(C)CCOCC)C1)c1ccccc1	ZINC001194555061	1368285162	/nfs/dbraw/zinc/28/51/62/1368285162.db2.gz	ICKORAGXECDOIL-PMACEKPBSA-N	0	3	344.499	3.306	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)C/C=C/c2ccc(C)cc2)C1	ZINC001194590041	1368292496	/nfs/dbraw/zinc/29/24/96/1368292496.db2.gz	CZPNXTKVPHWIKJ-RRFGBZISSA-N	0	3	342.483	3.134	20	30		EGEDHN
C=CC[C@@H](C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCCF)c1ccccc1	ZINC001111436414	1368306196	/nfs/dbraw/zinc/30/61/96/1368306196.db2.gz	GDBIOWOIUAOPCO-MKXGPGLRSA-N	0	3	330.447	3.427	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1cc(C)cc(C)c1	ZINC001111488338	1368319105	/nfs/dbraw/zinc/31/91/05/1368319105.db2.gz	HDIGWFYJCAPOKZ-AFYVEPGGSA-N	0	3	342.483	3.116	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccccc1CC	ZINC001111489927	1368320475	/nfs/dbraw/zinc/32/04/75/1368320475.db2.gz	OHQMBULTFDMWMJ-OBZTUIKSSA-N	0	3	342.483	3.062	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H](C)C(CC)CC)C[C@@H](C)O2	ZINC001111545491	1368338156	/nfs/dbraw/zinc/33/81/56/1368338156.db2.gz	HTHXMSGGGJYOKX-SJORKVTESA-N	0	3	336.520	3.327	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CCCN(Cc2c(C)cccc2C)CC1	ZINC001195174971	1368393442	/nfs/dbraw/zinc/39/34/42/1368393442.db2.gz	WHYVCTDRPDEECZ-IBGZPJMESA-N	0	3	344.499	3.319	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CN(CCC2CCCCCC2)C[C@H]1O	ZINC001195548771	1368452649	/nfs/dbraw/zinc/45/26/49/1368452649.db2.gz	HRXRTMLSRGNALW-BHIYHBOVSA-N	0	3	336.520	3.111	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(CC)s2)C1	ZINC001111800333	1368467781	/nfs/dbraw/zinc/46/77/81/1368467781.db2.gz	OBSLRVUIJURZKK-KXBFYZLASA-N	0	3	348.512	3.097	20	30		EGEDHN
CC(C)C#CC(=O)N1CCCN(CC[C@H]2CCCC2(F)F)CC1	ZINC001195780690	1368488610	/nfs/dbraw/zinc/48/86/10/1368488610.db2.gz	GOJSXNNIEKNNGP-MRXNPFEDSA-N	0	3	326.431	3.006	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)CCCc2ccc(C)cc2)C1	ZINC001111861648	1368511454	/nfs/dbraw/zinc/51/14/54/1368511454.db2.gz	XIMBHIWOLMQCFR-UNMCSNQZSA-N	0	3	338.495	3.312	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCCN(CCc2ccc(OC)cc2)CC1	ZINC001195982416	1368528443	/nfs/dbraw/zinc/52/84/43/1368528443.db2.gz	VTCKHAWSARIJNV-UHFFFAOYSA-N	0	3	344.499	3.374	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cn3c(n2)CCCC3)CC1	ZINC001196009889	1368534265	/nfs/dbraw/zinc/53/42/65/1368534265.db2.gz	GIHWXQJDTKPNRA-UHFFFAOYSA-N	0	3	346.519	3.338	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2ncc(OC)cc2F)CC1	ZINC001196078919	1368544939	/nfs/dbraw/zinc/54/49/39/1368544939.db2.gz	OWWZVCCKGLNHBC-UHFFFAOYSA-N	0	3	349.450	3.124	20	30		EGEDHN
C#CCN1C[C@@H]2CCC[C@]2(NC(=O)CCCc2cc(C)sc2C)C1	ZINC001112014525	1368619890	/nfs/dbraw/zinc/61/98/90/1368619890.db2.gz	XLHSEMCQCHQSQF-ICSRJNTNSA-N	0	3	344.524	3.292	20	30		EGEDHN
C=CCC[C@@H](C)N1CCCN(C(=O)c2ocnc2C(F)(F)F)CC1	ZINC001196619633	1368650673	/nfs/dbraw/zinc/65/06/73/1368650673.db2.gz	FSMFHMUYZCBFSM-GFCCVEGCSA-N	0	3	345.365	3.196	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cc(CCC)n[nH]2)CC1	ZINC001196705418	1368666790	/nfs/dbraw/zinc/66/67/90/1368666790.db2.gz	MZRKHYBSTHUPIE-UHFFFAOYSA-N	0	3	332.492	3.257	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cnc3n2CCCC3)CC1	ZINC001196900281	1368710259	/nfs/dbraw/zinc/71/02/59/1368710259.db2.gz	CVDDXKJJRYBGRK-UHFFFAOYSA-N	0	3	344.503	3.114	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2ccnc(OCC)c2)CC1	ZINC001197110254	1368745728	/nfs/dbraw/zinc/74/57/28/1368745728.db2.gz	BZPYNENIOYVLNA-UHFFFAOYSA-N	0	3	345.487	3.375	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)C(CC)(CC)CC)C1	ZINC001197230776	1368767775	/nfs/dbraw/zinc/76/77/75/1368767775.db2.gz	YPXCCDSYXLLKGE-IAGOWNOFSA-N	0	3	326.525	3.335	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H]2CCC[C@]2(CNC/C(Cl)=C\Cl)C1	ZINC001112330507	1368769884	/nfs/dbraw/zinc/76/98/84/1368769884.db2.gz	OFAMCOSPPJLFFY-QFYPQXEXSA-N	0	3	343.298	3.327	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@@H](C)c2ccc(C)cc2)C1	ZINC001197859204	1368914297	/nfs/dbraw/zinc/91/42/97/1368914297.db2.gz	JSPIEWTVDNETBI-DFQSSKMNSA-N	0	3	346.515	3.230	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)c2cc(C)cc(C)c2)C1	ZINC001198127475	1368963626	/nfs/dbraw/zinc/96/36/26/1368963626.db2.gz	QKKXBDNZXVXJRW-RTBURBONSA-N	0	3	332.488	3.049	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N1CCCN([C@@H](C)c2cc(C)ccc2C)CC1	ZINC001198344203	1369012565	/nfs/dbraw/zinc/01/25/65/1369012565.db2.gz	RDFJUVBVETZANR-RBUKOAKNSA-N	0	3	344.499	3.490	20	30		EGEDHN
C=CCCCCCN[C@@H](CNC(=O)C(F)F)c1ccccc1OC	ZINC001198471283	1369040277	/nfs/dbraw/zinc/04/02/77/1369040277.db2.gz	ISIQASFEEIEGEO-HNNXBMFYSA-N	0	3	340.414	3.454	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)c1ccccc1F)c1ccccc1OC	ZINC001198498686	1369046592	/nfs/dbraw/zinc/04/65/92/1369046592.db2.gz	AFKZUZAMBURIAU-SFHVURJKSA-N	0	3	342.414	3.471	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)[C@@H](C)C1CC1)c1ccccc1OC	ZINC001198647375	1369081312	/nfs/dbraw/zinc/08/13/12/1369081312.db2.gz	MTGVPTDIDLITSM-YJBOKZPZSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CCN(CC2CCC3(CC3)CC2)CC1)OCC	ZINC001112908918	1369086274	/nfs/dbraw/zinc/08/62/74/1369086274.db2.gz	IOGGHMVJQBBTNF-IBGZPJMESA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)Cc1ccc(C)o1)c1ccccc1OC	ZINC001198669064	1369087524	/nfs/dbraw/zinc/08/75/24/1369087524.db2.gz	XFENRSKQSWOIDK-GOSISDBHSA-N	0	3	342.439	3.162	20	30		EGEDHN
C#CCCCCC(=O)NC[C@H](NCC1CC1)c1ccccc1OC	ZINC001198677182	1369089252	/nfs/dbraw/zinc/08/92/52/1369089252.db2.gz	JLGYTVTYYKAIGA-SFHVURJKSA-N	0	3	328.456	3.046	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H](NCCCC)c1ccccc1OC	ZINC001198677523	1369089265	/nfs/dbraw/zinc/08/92/65/1369089265.db2.gz	NYLFZPMGZLNVOD-GOSISDBHSA-N	0	3	330.472	3.436	20	30		EGEDHN
C#CCCCC(=O)NC[C@@H](NCC1CCC1)c1ccccc1OC	ZINC001198693786	1369091940	/nfs/dbraw/zinc/09/19/40/1369091940.db2.gz	CWRARPPXWVOPOB-GOSISDBHSA-N	0	3	328.456	3.046	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)C#CC(C)(C)C)c1ccccc1OC	ZINC001198724796	1369100344	/nfs/dbraw/zinc/10/03/44/1369100344.db2.gz	ZZTFHOJZERYHGE-SFHVURJKSA-N	0	3	342.483	3.458	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)C#CC(C)(C)C)c1ccccc1OC	ZINC001198724031	1369100745	/nfs/dbraw/zinc/10/07/45/1369100745.db2.gz	OQHRPWKWDDRQHW-QGZVFWFLSA-N	0	3	328.456	3.068	20	30		EGEDHN
C#CCC1(C(=O)NC[C@H](NCC(C)C)c2ccccc2OC)CCC1	ZINC001198752192	1369105654	/nfs/dbraw/zinc/10/56/54/1369105654.db2.gz	NHTOIJQTMDBOPR-SFHVURJKSA-N	0	3	342.483	3.292	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@@H]1CCC1(F)F)c1ccccc1OC	ZINC001198766649	1369107971	/nfs/dbraw/zinc/10/79/71/1369107971.db2.gz	FNPLFADCHPFQFX-GJZGRUSLSA-N	0	3	338.398	3.064	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)CCC(F)F)c1ccccc1OC	ZINC001198797170	1369117130	/nfs/dbraw/zinc/11/71/30/1369117130.db2.gz	QPBMTIKIKRPSGS-HNNXBMFYSA-N	0	3	340.414	3.454	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H](NCCC=C)c2ccccc2OC)cc1	ZINC001198826266	1369123068	/nfs/dbraw/zinc/12/30/68/1369123068.db2.gz	HVRJJCUCOMLOKK-HXUWFJFHSA-N	0	3	348.446	3.313	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)C[C@@H](C)c2c(C)n[nH]c2C)CC1	ZINC001113032981	1369153718	/nfs/dbraw/zinc/15/37/18/1369153718.db2.gz	TVLWGAZRSRQWBH-CABCVRRESA-N	0	3	332.492	3.019	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)c1oncc1C)c1ccccc1OC	ZINC001198953063	1369157096	/nfs/dbraw/zinc/15/70/96/1369157096.db2.gz	HTENEMVPWVCPBZ-INIZCTEOSA-N	0	3	343.427	3.019	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)C(C1CC1)C1CC1)c1ccccc1OC	ZINC001198959336	1369158376	/nfs/dbraw/zinc/15/83/76/1369158376.db2.gz	ACNCIQWDLRRHFL-SFHVURJKSA-N	0	3	342.483	3.454	20	30		EGEDHN
C=C[C@@H](C(=O)NC[C@@H](NCC)c1ccccc1OC)c1ccccc1	ZINC001198992771	1369167090	/nfs/dbraw/zinc/16/70/90/1369167090.db2.gz	FRNDWUBMHQAJEO-IEBWSBKVSA-N	0	3	338.451	3.432	20	30		EGEDHN
C=CCCOCC(=O)NC[C@H](NCCCCC)c1ccccc1OC	ZINC001199002587	1369170389	/nfs/dbraw/zinc/17/03/89/1369170389.db2.gz	WHWZVFFMQRMGAZ-SFHVURJKSA-N	0	3	348.487	3.225	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)Cn2c(C)cc3ccccc32)CC1	ZINC001113080854	1369187640	/nfs/dbraw/zinc/18/76/40/1369187640.db2.gz	WAGJXECIFHFAMA-KRWDZBQOSA-N	0	3	339.483	3.449	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@]2(C)CCC(C)=C(C)C2)C1	ZINC001199225939	1369194565	/nfs/dbraw/zinc/19/45/65/1369194565.db2.gz	CMLHEZUSBDMFPU-SFHLNBCPSA-N	0	3	348.531	3.421	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)C[C@H]2CCOc3ccccc32)CC1	ZINC001113184667	1369250429	/nfs/dbraw/zinc/25/04/29/1369250429.db2.gz	RSPFDTJOHYUVQI-ZWKOTPCHSA-N	0	3	342.483	3.442	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC(NCc2nc3ccc(F)cc3o2)CC1	ZINC001200829159	1369435097	/nfs/dbraw/zinc/43/50/97/1369435097.db2.gz	NNIISQKBAWNFPH-UHFFFAOYSA-N	0	3	345.418	3.404	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CCC(NC/C(Cl)=C/Cl)CC1)OCC	ZINC001200850001	1369438759	/nfs/dbraw/zinc/43/87/59/1369438759.db2.gz	DPAJXLDPHLJTSQ-VSKPTYQZSA-N	0	3	349.302	3.257	20	30		EGEDHN
C#CCC1(C(=O)N2CCC(NCc3ccncc3Cl)CC2)CCC1	ZINC001201002093	1369464689	/nfs/dbraw/zinc/46/46/89/1369464689.db2.gz	IUMGVGNRPKNIJV-UHFFFAOYSA-N	0	3	345.874	3.009	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)C[C@H]2CCC3(CCC3)CO2)CC1	ZINC001113569699	1369496867	/nfs/dbraw/zinc/49/68/67/1369496867.db2.gz	SOWRFKGSMCPQLZ-QZTJIDSGSA-N	0	3	334.504	3.225	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1CCN(C[C@@H](C)CC(C)C)CC1	ZINC001113582001	1369502704	/nfs/dbraw/zinc/50/27/04/1369502704.db2.gz	SRRCINXASMYIHP-SFHVURJKSA-N	0	3	326.484	3.037	20	30		EGEDHN
CCCCCCCCCN1CCCn2c(=O)cc(CN(C)C)nc2C1	ZINC001201846273	1369633705	/nfs/dbraw/zinc/63/37/05/1369633705.db2.gz	FDEWZHNSPCPKKW-UHFFFAOYSA-N	0	3	348.535	3.261	20	30		EGEDHN
C=C(Br)CNC1CCN(C(=O)C2(CCC)CCC2)CC1	ZINC001202061753	1369678733	/nfs/dbraw/zinc/67/87/33/1369678733.db2.gz	FVBFXUHLEMMOQM-UHFFFAOYSA-N	0	3	343.309	3.446	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC(NCc2oc(CC)nc2C)CC1	ZINC001202130235	1369696140	/nfs/dbraw/zinc/69/61/40/1369696140.db2.gz	JZDNWCIXHOPVNA-HNNXBMFYSA-N	0	3	333.476	3.228	20	30		EGEDHN
C=CCCCC(=O)N1CCC(NCc2nc3ccccc3n2C)CC1	ZINC001202266397	1369725345	/nfs/dbraw/zinc/72/53/45/1369725345.db2.gz	CFTUBCVXIZIVHF-UHFFFAOYSA-N	0	3	340.471	3.010	20	30		EGEDHN
O=C(N[C@H]1C[C@H](NCC#Cc2ccc(Cl)cc2)C12CCC2)C1CC1	ZINC001202282058	1369728583	/nfs/dbraw/zinc/72/85/83/1369728583.db2.gz	XDZOBZWKVKIXOH-ROUUACIJSA-N	0	3	342.870	3.119	20	30		EGEDHN
CCCCC(=O)N[C@H]1C[C@H](NCC#Cc2ccc(F)cc2)C12CCC2	ZINC001202488086	1369787837	/nfs/dbraw/zinc/78/78/37/1369787837.db2.gz	FCMIFOWKTBBWKC-OALUTQOASA-N	0	3	342.458	3.384	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@H](NCc2oc(CCC)nc2C)C12CCC2	ZINC001202597860	1369818434	/nfs/dbraw/zinc/81/84/34/1369818434.db2.gz	BRPLNAFUVCTEQL-DLBZAZTESA-N	0	3	345.487	3.419	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@@H](NCc2ccc(C#N)cc2F)C12CCC2	ZINC001202598510	1369818634	/nfs/dbraw/zinc/81/86/34/1369818634.db2.gz	GZRSRBPPKGBDAR-QZTJIDSGSA-N	0	3	341.430	3.181	20	30		EGEDHN
C/C=C(\C)C(=O)N[C@@H]1C[C@H](NCc2cc(C#N)ccc2F)C12CCC2	ZINC001202725549	1369867532	/nfs/dbraw/zinc/86/75/32/1369867532.db2.gz	OEMIDSQLDCXUCX-XUAIMZCTSA-N	0	3	341.430	3.181	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1[C@H]2CN(Cc3csc(C)c3)C[C@H]21	ZINC001114326143	1369885690	/nfs/dbraw/zinc/88/56/90/1369885690.db2.gz	LTDQHNKXDNPESN-PIIMJCKOSA-N	0	3	330.497	3.371	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1C[C@@H](NCc2ncccc2C)C12CCC2	ZINC001202785069	1369891100	/nfs/dbraw/zinc/89/11/00/1369891100.db2.gz	OOQPSGVSKPZZDD-MOPGFXCFSA-N	0	3	339.483	3.101	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1C[C@@H](NCc2cc(F)ccc2F)C12CCC2	ZINC001202847297	1369907071	/nfs/dbraw/zinc/90/70/71/1369907071.db2.gz	RVHQOKXCHJZLRO-QZTJIDSGSA-N	0	3	346.421	3.285	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1C[C@H](NCc2ocnc2C)C12CCC2	ZINC001202959125	1369936868	/nfs/dbraw/zinc/93/68/68/1369936868.db2.gz	AHUUEXVELGTHGP-ROUUACIJSA-N	0	3	343.471	3.268	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1C[C@H](NCc2c(C)noc2C)C12CCC2	ZINC001202978794	1369944315	/nfs/dbraw/zinc/94/43/15/1369944315.db2.gz	IYMGODPOFKBNAJ-IRXDYDNUSA-N	0	3	331.460	3.165	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1[C@H]2CN(CCOc3cccc(C)c3)C[C@H]21	ZINC001114724454	1370047492	/nfs/dbraw/zinc/04/74/92/1370047492.db2.gz	NLWXFBHDYZMIIX-IJXRJRJASA-N	0	3	342.483	3.023	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1[C@H]2CN([C@H]3CCc4c3c(F)ccc4F)C[C@H]21	ZINC001114754439	1370063306	/nfs/dbraw/zinc/06/33/06/1370063306.db2.gz	BRMHGUIPAHNQRW-AMVBQIFNSA-N	0	3	346.421	3.355	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1[C@H]2CN(CCOc3cc(C)cc(C)c3)C[C@H]21	ZINC001114759690	1370065285	/nfs/dbraw/zinc/06/52/85/1370065285.db2.gz	NCOMNFFCLKYBKN-KXTWHKPSSA-N	0	3	342.483	3.085	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1[C@H]2CN(CCc3ccccc3Cl)C[C@H]21	ZINC001114759109	1370065320	/nfs/dbraw/zinc/06/53/20/1370065320.db2.gz	BYUBTGWGKVOTGE-MNZLEMJZSA-N	0	3	332.875	3.285	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@@H](NC(=O)C(C)(C)CC)C12CCC2	ZINC001203332835	1370085888	/nfs/dbraw/zinc/08/58/88/1370085888.db2.gz	QAEQKRLFYYZYBJ-CHWSQXEVSA-N	0	3	343.309	3.348	20	30		EGEDHN
O=C1C=C2CN(Cc3c(F)c(F)c(F)c(F)c3F)CCC2S1	ZINC001203364360	1370099050	/nfs/dbraw/zinc/09/90/50/1370099050.db2.gz	LGYUYCJFOSONBT-MRVPVSSYSA-N	0	3	335.297	3.156	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@@H](NCc3ccns3)C23CCC3)CCC1	ZINC001203366907	1370100352	/nfs/dbraw/zinc/10/03/52/1370100352.db2.gz	PMRUXJLJDJVJJA-CVEARBPZSA-N	0	3	345.512	3.407	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(NCc3ccn(C)n3)CC2)CCCCC1	ZINC001203847598	1370288021	/nfs/dbraw/zinc/28/80/21/1370288021.db2.gz	VUMGMJWXLDBVLN-UHFFFAOYSA-N	0	3	344.503	3.027	20	30		EGEDHN
Cc1cccc(N2C[C@@]3(CCN(Cc4ccc(C#N)cc4)C3)CC2=O)c1	ZINC001203901307	1370306734	/nfs/dbraw/zinc/30/67/34/1370306734.db2.gz	LDJHVMRLUHGVBR-QFIPXVFZSA-N	0	3	345.446	3.496	20	30		EGEDHN
C=CCOc1ccc(CN2CC[C@H](Oc3ccc(OC)cn3)C2)cc1	ZINC001204302480	1370437175	/nfs/dbraw/zinc/43/71/75/1370437175.db2.gz	JVVPHXDIEBJIOJ-IBGZPJMESA-N	0	3	340.423	3.308	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H](C)OCC(C)C)CCCCC1	ZINC001115433472	1370450874	/nfs/dbraw/zinc/45/08/74/1370450874.db2.gz	MJLLSYZKOHXMRX-HNNXBMFYSA-N	0	3	330.900	3.209	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@@H]2[C@@H](CCN2Cc2nccs2)C1	ZINC001204370740	1370456834	/nfs/dbraw/zinc/45/68/34/1370456834.db2.gz	JXJHFMVDYADNSS-ZWKOTPCHSA-N	0	3	338.480	3.111	20	30		EGEDHN
C=CCOCCCC(=O)NCC1(NCC(=C)Cl)CCCCC1	ZINC001115463402	1370467598	/nfs/dbraw/zinc/46/75/98/1370467598.db2.gz	OLGHUICYTNYPTH-UHFFFAOYSA-N	0	3	328.884	3.130	20	30		EGEDHN
C#CCCCC(=O)NCC1(NCc2c(C)noc2CC)CCCCC1	ZINC001115507128	1370507382	/nfs/dbraw/zinc/50/73/82/1370507382.db2.gz	CPVBBWUUSJJRKA-UHFFFAOYSA-N	0	3	345.487	3.258	20	30		EGEDHN
COc1cc(C#N)ccc1Nc1cccc(CN2CCN(C)CC2)c1	ZINC001204564646	1370517345	/nfs/dbraw/zinc/51/73/45/1370517345.db2.gz	OUSOVCYFROSEAB-UHFFFAOYSA-N	0	3	336.439	3.058	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H]2CC[C@@H](CC)O2)CCCCC1	ZINC001115559947	1370559973	/nfs/dbraw/zinc/55/99/73/1370559973.db2.gz	MJKSTMWSXACWBT-CABCVRRESA-N	0	3	328.884	3.105	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccc3cc[nH]c3n2)CCCCC1	ZINC001115583710	1370585760	/nfs/dbraw/zinc/58/57/60/1370585760.db2.gz	VHOPEYDQLAOZKA-UHFFFAOYSA-N	0	3	346.862	3.338	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)COC2CCCCC2)CCCCC1	ZINC001115609964	1370609173	/nfs/dbraw/zinc/60/91/73/1370609173.db2.gz	QZVJKYNOBNFCLC-UHFFFAOYSA-N	0	3	342.911	3.497	20	30		EGEDHN
CS[C@H](C)CC(=O)N1CCC(CNCc2ccccc2C#N)CC1	ZINC001205027635	1370633486	/nfs/dbraw/zinc/63/34/86/1370633486.db2.gz	VXSHBWHCMZNLHO-OAHLLOKOSA-N	0	3	345.512	3.028	20	30		EGEDHN
Cc1nc(C#N)ccc1Nc1ccc(C2(N3CCN(C)CC3)CC2)cc1	ZINC001205102539	1370650799	/nfs/dbraw/zinc/65/07/99/1370650799.db2.gz	SYCCZSJFFBQLGT-UHFFFAOYSA-N	0	3	347.466	3.242	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N(Cc1ccccc1)[C@@H]1CN(C(C)C)C[C@H]1O	ZINC001205181793	1370672050	/nfs/dbraw/zinc/67/20/50/1370672050.db2.gz	KXPIXOPWVLFMIU-SFHLNBCPSA-N	0	3	344.499	3.071	20	30		EGEDHN
C=CCCCC(=O)NCC1(NCc2ccc(F)cn2)CCCCC1	ZINC001115701377	1370682665	/nfs/dbraw/zinc/68/26/65/1370682665.db2.gz	KPJOBRYRMSNRBG-UHFFFAOYSA-N	0	3	333.451	3.486	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)CCCCC)CC[C@H]1c1ccc(F)cc1	ZINC001205244777	1370694142	/nfs/dbraw/zinc/69/41/42/1370694142.db2.gz	IDAGTQLNCQCXPA-RBUKOAKNSA-N	0	3	330.447	3.313	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC(CNCc2cc(C)no2)CC1	ZINC001205384398	1370738546	/nfs/dbraw/zinc/73/85/46/1370738546.db2.gz	QPEPAKLHGLYYDR-UHFFFAOYSA-N	0	3	331.460	3.080	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H](C)CC(C)(C)C)C[C@H]1c1cccc(F)c1	ZINC001205439934	1370755657	/nfs/dbraw/zinc/75/56/57/1370755657.db2.gz	QYNYCOAYXLNTRT-AYOQOUSVSA-N	0	3	344.474	3.415	20	30		EGEDHN
C=CCOCC(=O)N1CC[C@H]2CN([C@@H](CC)c3ccc(F)cc3)C[C@H]21	ZINC001187325682	1388094830	/nfs/dbraw/zinc/09/48/30/1388094830.db2.gz	CEEFZCKQNJIKNO-YTQUADARSA-N	0	3	346.446	3.012	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC(CNCc2oc(C)nc2C)CC1	ZINC001205897492	1370903211	/nfs/dbraw/zinc/90/32/11/1370903211.db2.gz	GVUSDIVNOPMTSV-UHFFFAOYSA-N	0	3	345.487	3.203	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)N1CCC(CNCc2cc(C3CC3)no2)CC1	ZINC001205955324	1370922614	/nfs/dbraw/zinc/92/26/14/1370922614.db2.gz	PRUIFWUSEXYBTQ-CABCVRRESA-N	0	3	345.487	3.338	20	30		EGEDHN
CCCCCC(=O)N[C@@H]1CN(Cc2ccc(OCC#N)cc2)C[C@H]1C	ZINC001206018565	1370940184	/nfs/dbraw/zinc/94/01/84/1370940184.db2.gz	RWCKZMQPIGDFKJ-VQIMIIECSA-N	0	3	343.471	3.106	20	30		EGEDHN
CC(C)(C)CCN1CCN(C(=O)Nc2cc(C#N)ccc2F)CC1	ZINC001206055636	1370950023	/nfs/dbraw/zinc/95/00/23/1370950023.db2.gz	JYWJJSMTVGHBFU-UHFFFAOYSA-N	0	3	332.423	3.283	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CN(Cc2ccc3ncccc3c2)C[C@H]1C	ZINC001206884885	1371206195	/nfs/dbraw/zinc/20/61/95/1371206195.db2.gz	KHGJGINYKNDMBH-DYESRHJHSA-N	0	3	349.478	3.365	20	30		EGEDHN
CC[C@@H](c1ccc(F)cc1)N1C[C@@H](C)[C@H](NC(=O)C#CC(C)C)C1	ZINC001206947022	1371240020	/nfs/dbraw/zinc/24/00/20/1371240020.db2.gz	BJGFBZQDXHRMJG-LZQZEXGQSA-N	0	3	330.447	3.373	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1CN(Cc2ccc(CC(C)C)cc2)C[C@H]1C	ZINC001206947181	1371240136	/nfs/dbraw/zinc/24/01/36/1371240136.db2.gz	JEFQIWBLBLNOHR-WIYYLYMNSA-N	0	3	340.511	3.481	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc3ncccc3c2)C[C@H]1NC(=O)C#CC(C)(C)C	ZINC001206950610	1371241967	/nfs/dbraw/zinc/24/19/67/1371241967.db2.gz	AMZUDJVLUGUTLQ-OXQOHEQNSA-N	0	3	349.478	3.221	20	30		EGEDHN
CC[C@H](c1ccc(F)cc1)N1C[C@@H](C)[C@H](NC(=O)C#CC2CC2)C1	ZINC001206953169	1371243661	/nfs/dbraw/zinc/24/36/61/1371243661.db2.gz	VDJOYWLCIJOASM-NIKGAXFTSA-N	0	3	328.431	3.127	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N[C@@H]2CN(CC=C(C)C)C[C@H]2C)cc1	ZINC001206956396	1371245622	/nfs/dbraw/zinc/24/56/22/1371245622.db2.gz	GXRAIKJOTWDQLA-YLJYHZDGSA-N	0	3	340.467	3.105	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CCN(Cc3cnc(C)s3)C2)C1	ZINC001207058990	1371281832	/nfs/dbraw/zinc/28/18/32/1371281832.db2.gz	QVFUWQQLRZDQRI-KRWDZBQOSA-N	0	3	335.473	3.062	20	30		EGEDHN
COC(=O)c1cccc(C2CCN(Cc3cc(C#N)n(C)c3)CC2)c1	ZINC001207108453	1371295400	/nfs/dbraw/zinc/29/54/00/1371295400.db2.gz	BLMMIUCSXVHULZ-UHFFFAOYSA-N	0	3	337.423	3.063	20	30		EGEDHN
C=CCCCN1C[C@@H](C)[C@H](NC(=O)c2sc(Cl)nc2C)C1	ZINC001207153311	1371313446	/nfs/dbraw/zinc/31/34/46/1371313446.db2.gz	TVIHPAMLZJJNFQ-ZYHUDNBSSA-N	0	3	327.881	3.121	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CN(Cc2cccc(OC)c2)C[C@H]1C	ZINC001207158126	1371313873	/nfs/dbraw/zinc/31/38/73/1371313873.db2.gz	HHAIGIXXHPJFSP-CRAIPNDOSA-N	0	3	330.472	3.234	20	30		EGEDHN
CC/C=C(\C)C(=O)N1CCC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001207565108	1371436539	/nfs/dbraw/zinc/43/65/39/1371436539.db2.gz	GIDYCUPUGYZWDL-ANQFXYINSA-N	0	3	329.419	3.134	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1CCC[C@@H](NCc2cc(C#N)ccc2OC)C1	ZINC001207718528	1371485260	/nfs/dbraw/zinc/48/52/60/1371485260.db2.gz	RNGDAGQEDZOWNX-CRAIPNDOSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)CCc2cc3ccccc3o2)C1	ZINC001207920934	1371538977	/nfs/dbraw/zinc/53/89/77/1371538977.db2.gz	GRSGGPNMDRGSHY-CRAIPNDOSA-N	0	3	326.440	3.378	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)COCCCC)C1	ZINC001120355221	1371544965	/nfs/dbraw/zinc/54/49/65/1371544965.db2.gz	GIQRHPTVJDIBNO-IRXDYDNUSA-N	0	3	342.911	3.259	20	30		EGEDHN
CC(C)c1cccc(CN[C@@H]2CCCN(C(=O)C#CC(C)(C)C)C2)n1	ZINC001208011026	1371567183	/nfs/dbraw/zinc/56/71/83/1371567183.db2.gz	TUFOYKHPSFWTFZ-GOSISDBHSA-N	0	3	341.499	3.335	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CCC[C@H](NCc2cc(F)cc(F)c2)C1	ZINC001208011072	1371567676	/nfs/dbraw/zinc/56/76/76/1371567676.db2.gz	UUMKUOSPCKLCDP-KRWDZBQOSA-N	0	3	334.410	3.095	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H]2CN([C@@H](C)c3cccc(OC)c3)C[C@H]21	ZINC001187714612	1388148712	/nfs/dbraw/zinc/14/87/12/1388148712.db2.gz	UIJSOLDZCNHRQN-XKGZKEIXSA-N	0	3	340.467	3.092	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC[C@H](NCc2cc(C)ccc2OC)C1	ZINC001208260977	1371688674	/nfs/dbraw/zinc/68/86/74/1371688674.db2.gz	IJFHLLSHGPPKHG-SFHVURJKSA-N	0	3	330.472	3.441	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H]2CN(Cc3ccc4ncccc4c3)C[C@H]21	ZINC001187737618	1388153039	/nfs/dbraw/zinc/15/30/39/1388153039.db2.gz	WIBRDUNXPYFFST-PZJWPPBQSA-N	0	3	347.462	3.071	20	30		EGEDHN
O=C(c1[nH]ccc1C1CC1)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001208306004	1371707832	/nfs/dbraw/zinc/70/78/32/1371707832.db2.gz	QWLQVKFFAREBNA-LJQANCHMSA-N	0	3	347.462	3.138	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CN(CCc2scnc2C)C[C@H]1C	ZINC001208388977	1371747981	/nfs/dbraw/zinc/74/79/81/1371747981.db2.gz	VJDUNDKUWBDRIV-IIAWOOMASA-N	0	3	335.517	3.033	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1CN(CCOc2ccccc2)C[C@H]1C	ZINC001208396554	1371753178	/nfs/dbraw/zinc/75/31/78/1371753178.db2.gz	YBUTVMRIKVKRJK-ZHALLVOQSA-N	0	3	330.472	3.104	20	30		EGEDHN
CC(C)(C)[C@@H]1C[C@H]1C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001208542132	1371808800	/nfs/dbraw/zinc/80/88/00/1371808800.db2.gz	MGJSMZWNNQOMIY-XUVXKRRUSA-N	0	3	338.495	3.301	20	30		EGEDHN
C[C@]1(C(=O)N2CCC[C@H](NCC#Cc3ccccc3)C2)C[C@H]2C[C@H]2C1	ZINC001208696576	1371865004	/nfs/dbraw/zinc/86/50/04/1371865004.db2.gz	JLOITAUBQFNDKA-CUXKYVRBSA-N	0	3	336.479	3.055	20	30		EGEDHN
CN(CC1CN(CCCc2cccc(C#N)c2)C1)C(=O)OC(C)(C)C	ZINC001208846221	1371915390	/nfs/dbraw/zinc/91/53/90/1371915390.db2.gz	XZUIZQFCJOJDIU-UHFFFAOYSA-N	0	3	343.471	3.290	20	30		EGEDHN
C=CCOC(=O)N[C@H]1CCCN(CCCc2ccccc2OC)C1	ZINC001208847839	1371916204	/nfs/dbraw/zinc/91/62/04/1371916204.db2.gz	XLZGAWLIWMEMEH-KRWDZBQOSA-N	0	3	332.444	3.004	20	30		EGEDHN
N#Cc1ccc(CCCN2CCN(CCOc3ccccc3)CC2)cc1	ZINC001208859299	1371922348	/nfs/dbraw/zinc/92/23/48/1371922348.db2.gz	WQUJGSBZGMUDPJ-UHFFFAOYSA-N	0	3	349.478	3.187	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)C[C@@H](C)c1ccncc1)C2	ZINC001121288687	1371923408	/nfs/dbraw/zinc/92/34/08/1371923408.db2.gz	JNIFJCQQQBZGNO-HKYFHIHASA-N	0	3	347.890	3.345	20	30		EGEDHN
N#Cc1ccc(CCCN2CC3(C2)CN(Cc2ccccc2)C3)cc1	ZINC001208863084	1371923418	/nfs/dbraw/zinc/92/34/18/1371923418.db2.gz	WCRBGTGMZYESPG-UHFFFAOYSA-N	0	3	331.463	3.309	20	30		EGEDHN
COc1cccc(OC2CCN(CCc3ccc(C#N)cc3)CC2)n1	ZINC001208929442	1371949733	/nfs/dbraw/zinc/94/97/33/1371949733.db2.gz	SDGNWBOEEBKHIC-UHFFFAOYSA-N	0	3	337.423	3.048	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CN(CCOc2ccc(C)cc2)C[C@H]1C	ZINC001208932558	1371950417	/nfs/dbraw/zinc/95/04/17/1371950417.db2.gz	FMWCQPJARUXVTP-IEBWSBKVSA-N	0	3	344.499	3.413	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CN(Cc2cccc(COC)c2)C[C@H]1C	ZINC001208963063	1371964122	/nfs/dbraw/zinc/96/41/22/1371964122.db2.gz	AWWPPJHURPCNOQ-VQIMIIECSA-N	0	3	344.499	3.372	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC[C@H](NCc2cnc(C)s2)C1	ZINC001209005295	1371972489	/nfs/dbraw/zinc/97/24/89/1371972489.db2.gz	UNKRCXGXJJZRAC-INIZCTEOSA-N	0	3	333.501	3.116	20	30		EGEDHN
CC1(CC(=O)NC2CC3(CC(NCc4ccccc4C#N)C3)C2)CC1	ZINC001121430688	1371972750	/nfs/dbraw/zinc/97/27/50/1371972750.db2.gz	HEVVYNGJCYCZOY-UHFFFAOYSA-N	0	3	337.467	3.265	20	30		EGEDHN
C=CCN(CCN1CCC(COc2ccccc2)CC1)C(=O)OCC	ZINC001209022238	1371976454	/nfs/dbraw/zinc/97/64/54/1371976454.db2.gz	SQYOSBBNEABCFD-UHFFFAOYSA-N	0	3	346.471	3.422	20	30		EGEDHN
O=C(CCCF)N1CCC[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001209085395	1371993419	/nfs/dbraw/zinc/99/34/19/1371993419.db2.gz	CCOXNZRHWPIKNN-KRWDZBQOSA-N	0	3	336.838	3.022	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC1CC2(CC(NCc3conc3C)C2)C1	ZINC001121527972	1372000580	/nfs/dbraw/zinc/00/05/80/1372000580.db2.gz	JTWVQYZWCNVTJL-UHFFFAOYSA-N	0	3	331.460	3.102	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@H](NCc2cc(F)cc(F)c2)C1	ZINC001209110628	1372001075	/nfs/dbraw/zinc/00/10/75/1372001075.db2.gz	CMZPYDIICPHNCV-SFHVURJKSA-N	0	3	334.410	3.239	20	30		EGEDHN
C=CCCCCN1CCO[C@@H]2[C@@H](COCc3cccnc3)CC[C@@H]21	ZINC001209202690	1372036034	/nfs/dbraw/zinc/03/60/34/1372036034.db2.gz	NJEHLYNDPLQRLN-HSALFYBXSA-N	0	3	330.472	3.434	20	30		EGEDHN
C=CCCCCN1CCO[C@@H]2[C@@H](COCc3nccs3)CC[C@H]21	ZINC001209204126	1372037193	/nfs/dbraw/zinc/03/71/93/1372037193.db2.gz	ZOPPXBXGTGWVML-JFIYKMOQSA-N	0	3	336.501	3.495	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC(F)(CN2CCC(CC#N)CC2)CC1	ZINC001209235601	1372046367	/nfs/dbraw/zinc/04/63/67/1372046367.db2.gz	CTSHMESSPFOTPB-UHFFFAOYSA-N	0	3	339.455	3.351	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)[C@@H](C)CC(F)(F)F)C2	ZINC001121687101	1372046711	/nfs/dbraw/zinc/04/67/11/1372046711.db2.gz	FLQBWHRUVHFEOT-ZTBHGZPVSA-N	0	3	338.801	3.344	20	30		EGEDHN
C=CCCC1(C(=O)NC2CC3(CC(NCc4cnoc4C)C3)C2)CC1	ZINC001121709207	1372054937	/nfs/dbraw/zinc/05/49/37/1372054937.db2.gz	VGNFXYXIZRRMGP-UHFFFAOYSA-N	0	3	343.471	3.246	20	30		EGEDHN
C[C@H](c1ccccc1)N(CCN1CCOCC1)Cc1ccc(C#N)cc1	ZINC001209293768	1372059615	/nfs/dbraw/zinc/05/96/15/1372059615.db2.gz	OENWLUGMCYTVGA-LJQANCHMSA-N	0	3	349.478	3.454	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC1CC2(CC(NCc3nccn3CC)C2)C1	ZINC001121841598	1372098304	/nfs/dbraw/zinc/09/83/04/1372098304.db2.gz	IVDKZUHMFGXOEJ-UHFFFAOYSA-N	0	3	344.503	3.022	20	30		EGEDHN
C=CCOC(=O)N[C@@H]1CCCN(Cc2c[nH]c3ccc(C)cc23)C1	ZINC001209500814	1372121337	/nfs/dbraw/zinc/12/13/37/1372121337.db2.gz	WNSOIPOFGBVGCF-MRXNPFEDSA-N	0	3	327.428	3.353	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)C[C@@H](C)n1cccc1)C2	ZINC001122087593	1372172488	/nfs/dbraw/zinc/17/24/88/1372172488.db2.gz	LBXWCEUPLGJLPD-XOGYLQAWSA-N	0	3	335.879	3.209	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001209865581	1372217009	/nfs/dbraw/zinc/21/70/09/1372217009.db2.gz	IHWLFEHGZKUIKG-QGZVFWFLSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@@H](NCc2cc(CO)ccc2F)C1	ZINC001209875068	1372219866	/nfs/dbraw/zinc/21/98/66/1372219866.db2.gz	NABSCNAFQZNGJY-QGZVFWFLSA-N	0	3	348.462	3.001	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)c2ccc3sccc3c2)C1	ZINC001209958160	1372241242	/nfs/dbraw/zinc/24/12/42/1372241242.db2.gz	WAZASTOJLXLBTN-RHSMWYFYSA-N	0	3	344.480	3.154	20	30		EGEDHN
C[C@H](Sc1ccc(F)cc1)C(=O)C(C#N)C(=O)NC1CCCCC1	ZINC001122541156	1372270346	/nfs/dbraw/zinc/27/03/46/1372270346.db2.gz	LNWBMMLZYUHCIC-BLLLJJGKSA-N	0	3	348.443	3.464	20	30		EGEDHN
CC[C@H](C)c1ccc(NC(=O)C(C#N)C(=O)c2ccc(C)nn2)cc1	ZINC001122547408	1372271699	/nfs/dbraw/zinc/27/16/99/1372271699.db2.gz	RHIYBJQFYQZFBQ-BLLLJJGKSA-N	0	3	336.395	3.260	20	30		EGEDHN
CC[C@@H](C)n1ncc(C(=O)C(C#N)c2nccn2CC)c1C1CC1	ZINC001123233820	1372403257	/nfs/dbraw/zinc/40/32/57/1372403257.db2.gz	ODCUDXWICMXTJD-OCCSQVGLSA-N	0	3	325.416	3.438	20	30		EGEDHN
CC[C@H](C)n1ncc(C(=O)C(C#N)c2nccn2CC)c1C1CC1	ZINC001123233818	1372403292	/nfs/dbraw/zinc/40/32/92/1372403292.db2.gz	ODCUDXWICMXTJD-GXTWGEPZSA-N	0	3	325.416	3.438	20	30		EGEDHN
N#CC(C(=O)CCCn1cccn1)c1nc2c(cccc2Cl)[nH]1	ZINC001123247408	1372406423	/nfs/dbraw/zinc/40/64/23/1372406423.db2.gz	KNDUUJJLGNVMHJ-NSHDSACASA-N	0	3	327.775	3.069	20	30		EGEDHN
Cc1ccccc1CC(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001211014688	1372470836	/nfs/dbraw/zinc/47/08/36/1372470836.db2.gz	LUDYCVSMIMPSBS-JOCHJYFZSA-N	0	3	346.474	3.170	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)C(=O)N[C@@H]1CN(CC(=C)C)C[C@H]1C	ZINC001211218261	1372505404	/nfs/dbraw/zinc/50/54/04/1372505404.db2.gz	QYUDFEHQIWOPMH-YZGWKJHDSA-N	0	3	326.484	3.434	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N[C@@H]1CN(Cc2ccc(C3CC3)cc2)C[C@H]1C	ZINC001211427110	1372556417	/nfs/dbraw/zinc/55/64/17/1372556417.db2.gz	AXZLUXNIVAPRLZ-GQIGUUNPSA-N	0	3	342.483	3.092	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2cc(C)c(C)o2)C[C@H]1c1ccccc1	ZINC001211571528	1372583047	/nfs/dbraw/zinc/58/30/47/1372583047.db2.gz	OTGDIZQDAOGSRH-RBUKOAKNSA-N	0	3	336.435	3.118	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2ccoc2Cl)C[C@H]1c1ccccc1	ZINC001211586136	1372586322	/nfs/dbraw/zinc/58/63/22/1372586322.db2.gz	FQYRFBXMAVWLTJ-DLBZAZTESA-N	0	3	342.826	3.154	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)Cc2cccc(C)c2)C[C@H]1c1ccccc1	ZINC001211662283	1372598464	/nfs/dbraw/zinc/59/84/64/1372598464.db2.gz	YOTHHLRWAYHLOB-FCHUYYIVSA-N	0	3	346.474	3.145	20	30		EGEDHN
CCCCCCCC[C@@H](C)C(=O)N1CC[C@@H](NCc2ccnn2C)C1	ZINC001188016248	1388214972	/nfs/dbraw/zinc/21/49/72/1388214972.db2.gz	VIWTXOXFYSSJIO-QZTJIDSGSA-N	0	3	348.535	3.497	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@@H]2C[C@@H]3C=C[C@H]2CC3)[C@H](OC)C1	ZINC001212301298	1372684102	/nfs/dbraw/zinc/68/41/02/1372684102.db2.gz	MBOJNYRSCYRRQQ-USYVTKNRSA-N	0	3	348.531	3.375	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)C(C)(C)CC(F)F)[C@H](OC)C1	ZINC001212397146	1372699698	/nfs/dbraw/zinc/69/96/98/1372699698.db2.gz	DMGFEIXFYONHSB-HUUCEWRRSA-N	0	3	348.478	3.454	20	30		EGEDHN
C=CCOCC(=O)NCCN[C@@H](CC)c1ccc(Cl)cc1Cl	ZINC001124767361	1372728929	/nfs/dbraw/zinc/72/89/29/1372728929.db2.gz	DMQINKMHURHRGH-HNNXBMFYSA-N	0	3	345.270	3.353	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H]2CN(CCOCCC(C)C)C[C@H]21	ZINC001188033089	1388222414	/nfs/dbraw/zinc/22/24/14/1388222414.db2.gz	BYNLCDKCKIOKLB-VQTJNVASSA-N	0	3	348.531	3.350	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN([C@H](C)c2cccc(C)c2)C[C@H]1OC	ZINC001213356901	1372890377	/nfs/dbraw/zinc/89/03/77/1372890377.db2.gz	DMDARMQNQCJPLU-BHIYHBOVSA-N	0	3	330.472	3.228	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CCC3=CCCCC3)C[C@H]2OC)CCC1	ZINC001213397509	1372900415	/nfs/dbraw/zinc/90/04/15/1372900415.db2.gz	PQBZJZQZOFVIJU-RTBURBONSA-N	0	3	346.515	3.439	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CCCC(C)(C)C)C[C@H]2OC)CCC1	ZINC001213397454	1372900626	/nfs/dbraw/zinc/90/06/26/1372900626.db2.gz	NKMYKCPNEOKBMU-IAGOWNOFSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@@H]2C[C@H]2CC(C)C)[C@H](OC)C1	ZINC001213462961	1372909350	/nfs/dbraw/zinc/90/93/50/1372909350.db2.gz	ZTZGODJTSUVJLZ-NCXUSEDFSA-N	0	3	336.520	3.230	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)[C@H](CCC)CC2CCCC2)[C@H](OC)C1	ZINC001213525198	1372919611	/nfs/dbraw/zinc/91/96/11/1372919611.db2.gz	WBRRUEIRUCPYPB-GUDVDZBRSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)C(C)(C)Cc2ccccc2)[C@H](OC)C1	ZINC001213681738	1372944664	/nfs/dbraw/zinc/94/46/64/1372944664.db2.gz	QSKSTQONKKIAIW-RTBURBONSA-N	0	3	344.499	3.037	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)[C@H](F)CC2CCCCC2)[C@H](OC)C1	ZINC001213728670	1372952363	/nfs/dbraw/zinc/95/23/63/1372952363.db2.gz	PJEATGCDEHNTCX-KZNAEPCWSA-N	0	3	340.483	3.077	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2ccccc2C2CCC2)[C@H](OC)C1	ZINC001213790826	1372962314	/nfs/dbraw/zinc/96/23/14/1372962314.db2.gz	WYJWQORTAMTAHE-WOJBJXKFSA-N	0	3	342.483	3.349	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2cc(C)c(CC)s2)[C@H](OC)C1	ZINC001213821088	1372966705	/nfs/dbraw/zinc/96/67/05/1372966705.db2.gz	KOBZPDIZHBCWSM-HUUCEWRRSA-N	0	3	336.501	3.014	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)C[C@@H](C)CCc2ccccc2)[C@H](OC)C1	ZINC001213966185	1372987953	/nfs/dbraw/zinc/98/79/53/1372987953.db2.gz	JWSSHVVBOPLBDW-DFQSSKMNSA-N	0	3	344.499	3.037	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)C(C)(C)c2ccccc2C)[C@H](OC)C1	ZINC001213985541	1372991117	/nfs/dbraw/zinc/99/11/17/1372991117.db2.gz	ANJVTOCSMCHQTD-RTBURBONSA-N	0	3	344.499	3.054	20	30		EGEDHN
C=CCOCCCC(=O)N1C[C@@H](C)[C@H](N[C@@H](C)c2ccccc2F)C1	ZINC001214395238	1373054437	/nfs/dbraw/zinc/05/44/37/1373054437.db2.gz	ZAWMXCQDDNJKMW-JTDSTZFVSA-N	0	3	348.462	3.306	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2cscc2C(F)F)c1	ZINC001127490660	1373130975	/nfs/dbraw/zinc/13/09/75/1373130975.db2.gz	ALMGWHUVXLDSER-UHFFFAOYSA-N	0	3	335.379	3.077	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2ccc(F)c(C(F)F)c2)c1	ZINC001127503095	1373132340	/nfs/dbraw/zinc/13/23/40/1373132340.db2.gz	IKWBYVRXDNVEOO-UHFFFAOYSA-N	0	3	347.340	3.155	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](C)[C@H](NCc2cn(C(C)C)nc2C)C1	ZINC001215436229	1373206958	/nfs/dbraw/zinc/20/69/58/1373206958.db2.gz	JLPQYPUBLVQCRD-CRAIPNDOSA-N	0	3	332.492	3.065	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)C[C@@H](C)CC)[C@@H](n2ccnn2)C1	ZINC001128953106	1373327605	/nfs/dbraw/zinc/32/76/05/1373327605.db2.gz	LUCKNPOTKWMPAW-KSZLIROESA-N	0	3	349.523	3.026	20	30		EGEDHN
C=C[C@H](CC(=O)N1C[C@@H](C)[C@H](NCc2cccnc2)C1)c1ccccc1	ZINC001216812077	1373346346	/nfs/dbraw/zinc/34/63/46/1373346346.db2.gz	ZSHRJCFYGRDZFF-YFVAEKQCSA-N	0	3	349.478	3.378	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)C3CCCCC3)[C@H]2C1	ZINC001217200924	1373404604	/nfs/dbraw/zinc/40/46/04/1373404604.db2.gz	RFPXTGBMUFQMTN-RBUKOAKNSA-N	0	3	336.520	3.449	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)CCc3ccoc3)[C@H]2C1	ZINC001217619541	1373474926	/nfs/dbraw/zinc/47/49/26/1373474926.db2.gz	BQGQPCDYFCTFEA-RBUKOAKNSA-N	0	3	348.487	3.094	20	30		EGEDHN
C=C(C)CN1CC[C@H](Oc2cnccc2CNC(=O)C(CC)CC)C1	ZINC001130313389	1373490995	/nfs/dbraw/zinc/49/09/95/1373490995.db2.gz	XAEPRQOJZQUHTI-SFHVURJKSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)C(C)(C)C2CCCC2)C1	ZINC001130395933	1373518854	/nfs/dbraw/zinc/51/88/54/1373518854.db2.gz	VGZFVJPMRYRLHG-HNNXBMFYSA-N	0	3	344.503	3.218	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)C(CCC)CCC)C1	ZINC001130415817	1373528202	/nfs/dbraw/zinc/52/82/02/1373528202.db2.gz	PYGXTCXXYBRERV-MRXNPFEDSA-N	0	3	332.492	3.218	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)[C@H](C)CCC(C)(C)C)C1	ZINC001130441714	1373540290	/nfs/dbraw/zinc/54/02/90/1373540290.db2.gz	DPMSAYMFDBBAEF-HZPDHXFCSA-N	0	3	346.519	3.464	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)[C@H]3CCCC34CC4)[C@H]2C1	ZINC001218169159	1373572444	/nfs/dbraw/zinc/57/24/44/1373572444.db2.gz	YFCLNICZIAOREM-CEXWTWQISA-N	0	3	346.515	3.225	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2OCCN(C(=O)c3ccc(C)c(F)c3)[C@H]2C1	ZINC001218261064	1373585156	/nfs/dbraw/zinc/58/51/56/1373585156.db2.gz	VNEDTZANILGJIQ-ZYSHUDEJSA-N	0	3	346.446	3.014	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)[C@H](C)CC(F)F)[C@H]2C1	ZINC001218314325	1373593647	/nfs/dbraw/zinc/59/36/47/1373593647.db2.gz	ZAGJMBYXMVNBSA-OWCLPIDISA-N	0	3	346.462	3.160	20	30		EGEDHN
CCCCc1ccc(C(=O)NCCNCc2cccc(C#N)c2)cc1	ZINC001131032321	1373628184	/nfs/dbraw/zinc/62/81/84/1373628184.db2.gz	WYGMXFHBRNUZNZ-UHFFFAOYSA-N	0	3	335.451	3.420	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCO[C@@H]2CN(CCCCCCC)C[C@@H]21	ZINC001218522485	1373629525	/nfs/dbraw/zinc/62/95/25/1373629525.db2.gz	ACINEOLWOZZIRL-CEXWTWQISA-N	0	3	336.520	3.471	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCO[C@@H]2CN(CC/C=C/CCC)C[C@@H]21	ZINC001218524404	1373630047	/nfs/dbraw/zinc/63/00/47/1373630047.db2.gz	XAVTUECMIQYEJE-HOHRJFBBSA-N	0	3	334.504	3.247	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)[C@H]3CCC(C)(C)C3)[C@H]2C1	ZINC001218599640	1373635587	/nfs/dbraw/zinc/63/55/87/1373635587.db2.gz	DBBIORNDYKFTNZ-GBESFXJTSA-N	0	3	348.531	3.471	20	30		EGEDHN
Cc1coc(NC(=O)[C@@H](N)Cc2ccc(OC(C)(C)C)cc2)c1C#N	ZINC001218764120	1373652895	/nfs/dbraw/zinc/65/28/95/1373652895.db2.gz	HVUNONWWQGIAGN-INIZCTEOSA-N	0	3	341.411	3.146	20	30		EGEDHN
C=CC1(CC(=O)N2CCO[C@@H]3CN(CCCC)C[C@@H]32)CCCCC1	ZINC001218776653	1373653934	/nfs/dbraw/zinc/65/39/34/1373653934.db2.gz	WFZRXGNQWYOWHJ-ZWKOTPCHSA-N	0	3	334.504	3.225	20	30		EGEDHN
N#Cc1c(F)ccc(NC(=O)[C@H]2C[C@@H](c3ccccc3)CCN2)c1F	ZINC001218914138	1373666582	/nfs/dbraw/zinc/66/65/82/1373666582.db2.gz	QVTQNKCEYJUOKT-SUMWQHHRSA-N	0	3	341.361	3.311	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2OCCN(C(=O)c3ccc(Cl)cc3)[C@H]2C1	ZINC001219004447	1373678627	/nfs/dbraw/zinc/67/86/27/1373678627.db2.gz	KIRKFCLJJDIMJP-FHLIZLRMSA-N	0	3	348.874	3.220	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)[C@H](c2ccccc2)C2CC2)s1	ZINC001131314725	1373679473	/nfs/dbraw/zinc/67/94/73/1373679473.db2.gz	TZBIOYSLQGEHOO-GOSISDBHSA-N	0	3	339.464	3.019	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@@H](NCc3cnccc3C)C2)CCCCC1	ZINC001188265770	1388277973	/nfs/dbraw/zinc/27/79/73/1388277973.db2.gz	NYGSFIVKWIOEOH-LJQANCHMSA-N	0	3	339.483	3.054	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)C2(C)CCCCCC2)[C@@H](O)C1	ZINC001219816633	1373733328	/nfs/dbraw/zinc/73/33/28/1373733328.db2.gz	IMKZXBPHIJMMBK-MSOLQXFVSA-N	0	3	338.536	3.479	20	30		EGEDHN
C#CCCCCCC(=O)N1C[C@H](C)O[C@@]2(CCN(CC=C(C)C)C2)C1	ZINC001131672894	1373754855	/nfs/dbraw/zinc/75/48/55/1373754855.db2.gz	CJIZTWBALWBRNF-PZJWPPBQSA-N	0	3	346.515	3.228	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](C)O[C@@]3(CCN(CC(=C)C)C3)C2)CCC1	ZINC001131681904	1373760217	/nfs/dbraw/zinc/76/02/17/1373760217.db2.gz	JYOICJJMOQFOLX-YLJYHZDGSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=CCCC1(C(=O)N2C[C@@H](C)O[C@@]3(CCN(CC(=C)C)C3)C2)CC1	ZINC001131688824	1373763850	/nfs/dbraw/zinc/76/38/50/1373763850.db2.gz	RYSKWBYOMBIGSG-YLJYHZDGSA-N	0	3	332.488	3.001	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)CN(C(=O)C(C)(C)CC(C)(C)C)C[C@H](C)O2	ZINC001131701154	1373771049	/nfs/dbraw/zinc/77/10/49/1373771049.db2.gz	PREIWORNPMRFIF-LAUBAEHRSA-N	0	3	348.531	3.164	20	30		EGEDHN
Cc1ccc(C2CC2)c(C(=O)NCCNCc2ccc(C#N)s2)c1	ZINC001131749940	1373785579	/nfs/dbraw/zinc/78/55/79/1373785579.db2.gz	VDIPVNQHSGPZPN-UHFFFAOYSA-N	0	3	339.464	3.325	20	30		EGEDHN
Cc1ccc(C)c(CN2C[C@H](NC(=O)CSCC#N)CC[C@@H]2C)c1	ZINC001131830766	1373827672	/nfs/dbraw/zinc/82/76/72/1373827672.db2.gz	UTUMVSFKNCWWEC-FUHWJXTLSA-N	0	3	345.512	3.029	20	30		EGEDHN
CC(C)SCC(=O)NCC1CCN(Cc2cccc(C#N)c2)CC1	ZINC001222434513	1373843592	/nfs/dbraw/zinc/84/35/92/1373843592.db2.gz	GGCIZTFINZOCGN-UHFFFAOYSA-N	0	3	345.512	3.028	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC[C@@H](C)N(CCOc2ccc(C)cc2)C1	ZINC001131896875	1375033356	/nfs/dbraw/zinc/03/33/56/1375033356.db2.gz	WULUKBLEIKRTMS-MSOLQXFVSA-N	0	3	330.472	3.309	20	30		EGEDHN
C=CCOCC(=O)N[C@@H]1CC[C@H](C)N(Cc2cc(C)sc2C)C1	ZINC001131896566	1375033894	/nfs/dbraw/zinc/03/38/94/1375033894.db2.gz	UAHHUQDTCAMLQF-SUMWQHHRSA-N	0	3	336.501	3.037	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@H](C)N(Cc2cccc(COC)c2)C1	ZINC001132003824	1375095269	/nfs/dbraw/zinc/09/52/69/1375095269.db2.gz	ZXYLOYZGUWLRCJ-FXAWDEMLSA-N	0	3	342.483	3.106	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@@H](C)N(Cc2cccc(COC)c2)C1	ZINC001132003827	1375095550	/nfs/dbraw/zinc/09/55/50/1375095550.db2.gz	ZXYLOYZGUWLRCJ-YLJYHZDGSA-N	0	3	342.483	3.106	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H]1CC[C@@H](C)N(CCCOc2ccccc2)C1	ZINC001132025377	1375104253	/nfs/dbraw/zinc/10/42/53/1375104253.db2.gz	PFCBEQQRPNVKRF-MOPGFXCFSA-N	0	3	342.483	3.084	20	30		EGEDHN
C=CCOCC(=O)N[C@@H]1CCCC[C@H]1NCc1sccc1Cl	ZINC001225361920	1375106610	/nfs/dbraw/zinc/10/66/10/1375106610.db2.gz	VQSYZNJMWPJUDU-ZIAGYGMSSA-N	0	3	342.892	3.121	20	30		EGEDHN
C[C@H]1CC[C@@H](NC(=O)C#CC2CC2)CN1Cc1ccccc1C1CC1	ZINC001132033403	1375107529	/nfs/dbraw/zinc/10/75/29/1375107529.db2.gz	FXCHMYZUGBBDNT-OXJNMPFZSA-N	0	3	336.479	3.447	20	30		EGEDHN
Cc1cncc(C(=O)N[C@@H]2CCCC[C@H]2NCC#Cc2ccccc2)c1	ZINC001225509011	1375116482	/nfs/dbraw/zinc/11/64/82/1375116482.db2.gz	UIPFJMFEWDUZGB-NHCUHLMSSA-N	0	3	347.462	3.072	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2ccc3occc3c2)CC[C@@H]1C	ZINC001132051199	1375118819	/nfs/dbraw/zinc/11/88/19/1375118819.db2.gz	YUSVRCHOWIGTDQ-YJBOKZPZSA-N	0	3	342.439	3.218	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1CC[C@H](C)N(CCOCC2CC2)C1	ZINC001132056662	1375121965	/nfs/dbraw/zinc/12/19/65/1375121965.db2.gz	BDXXFLCKLAUXBO-LPHOPBHVSA-N	0	3	334.504	3.151	20	30		EGEDHN
C=CCCOCC(=O)NCC1CCN([C@H](C)c2cccc(F)c2)CC1	ZINC001225626240	1375134526	/nfs/dbraw/zinc/13/45/26/1375134526.db2.gz	VMLXGVODWYREJS-MRXNPFEDSA-N	0	3	348.462	3.308	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NCC1CCN([C@H](C)c2cccc(F)c2)CC1	ZINC001225639510	1375137452	/nfs/dbraw/zinc/13/74/52/1375137452.db2.gz	RXWNUMSERVJDJI-HZPDHXFCSA-N	0	3	348.462	3.306	20	30		EGEDHN
C#CC[C@@H](CC(=O)NCC1CCN(CC#CC)CC1)c1ccccc1	ZINC001225683827	1375144138	/nfs/dbraw/zinc/14/41/38/1375144138.db2.gz	GGIKHKVHUUZIIQ-NRFANRHFSA-N	0	3	336.479	3.035	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)C(C)(C)C2CCCC2)CC[C@@H]1C	ZINC001132105048	1375149735	/nfs/dbraw/zinc/14/97/35/1375149735.db2.gz	ALPSEERPUYJLIZ-FUHWJXTLSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCc2ccccc2OCC)CC[C@@H]1C	ZINC001132156404	1375174026	/nfs/dbraw/zinc/17/40/26/1375174026.db2.gz	DWZFFAZOCMSJFG-FUHWJXTLSA-N	0	3	330.472	3.173	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CCCC[C@H]1NCc1cc(F)ccc1F	ZINC001225920755	1375175656	/nfs/dbraw/zinc/17/56/56/1375175656.db2.gz	FDUXTXDATXSTIA-QZTJIDSGSA-N	0	3	334.410	3.285	20	30		EGEDHN
C=CCCCN1C[C@H](NC(=O)c2nc3cnccc3s2)CC[C@@H]1C	ZINC001132164886	1375181152	/nfs/dbraw/zinc/18/11/52/1375181152.db2.gz	LGTRYUSUQFWCQH-UONOGXRCSA-N	0	3	344.484	3.240	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2cc3ccsc3[nH]2)CC[C@@H]1C	ZINC001132207385	1375210787	/nfs/dbraw/zinc/21/07/87/1375210787.db2.gz	UEDJGYAZYIDHMZ-ZFWWWQNUSA-N	0	3	347.484	3.015	20	30		EGEDHN
CC(C)c1ccc(CN2CCC(NC(=O)CSCC#N)CC2)cc1	ZINC001226151965	1375212556	/nfs/dbraw/zinc/21/25/56/1375212556.db2.gz	ABSJYFDKTTVXDC-UHFFFAOYSA-N	0	3	345.512	3.147	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1CC[C@@H](C)N(Cc2ccccc2N(C)C)C1	ZINC001132217697	1375214632	/nfs/dbraw/zinc/21/46/32/1375214632.db2.gz	FYKASNJWQJJVCW-AEFFLSMTSA-N	0	3	343.515	3.434	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1CCCC[C@H]1NCc1cnc(C)nc1	ZINC001226435759	1375258529	/nfs/dbraw/zinc/25/85/29/1375258529.db2.gz	ZQXHOUKYYDPHQQ-RTBURBONSA-N	0	3	342.487	3.070	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CCCC[C@H]1NCc1ccc(F)cn1	ZINC001226474579	1375264514	/nfs/dbraw/zinc/26/45/14/1375264514.db2.gz	PDOHSDFTQJQEPR-IAGOWNOFSA-N	0	3	333.451	3.340	20	30		EGEDHN
C=CCCC(=O)NC1CCN(CCOc2cc(C)ccc2C)CC1	ZINC001226518346	1375273575	/nfs/dbraw/zinc/27/35/75/1375273575.db2.gz	GQVVWPFFZRIZFK-UHFFFAOYSA-N	0	3	330.472	3.229	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CC[C@H](C)N(CCOCC3CC3)C2)CC1	ZINC001132292759	1375274371	/nfs/dbraw/zinc/27/43/71/1375274371.db2.gz	UWSAPAPVTVIPBJ-QFBILLFUSA-N	0	3	334.504	3.129	20	30		EGEDHN
CCC[C@H](C)C(=O)NC1CCN(Cc2ccc(OCC#N)cc2)CC1	ZINC001226664926	1375303913	/nfs/dbraw/zinc/30/39/13/1375303913.db2.gz	RWFZGPLAYYDMAK-INIZCTEOSA-N	0	3	343.471	3.106	20	30		EGEDHN
C#CCCCCC(=O)NC1CCN(CCO[C@@H]2CCCC[C@H]2C)CC1	ZINC001226969779	1375374844	/nfs/dbraw/zinc/37/48/44/1375374844.db2.gz	OWBQUTAUBQVMIM-UYAOXDASSA-N	0	3	348.531	3.356	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COc2ccc(C)cc2C)CC[C@H]1C	ZINC001132481575	1375417163	/nfs/dbraw/zinc/41/71/63/1375417163.db2.gz	HQCCYSKBOXKKDH-MSOLQXFVSA-N	0	3	330.472	3.227	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCCc2nc(C(C)C)no2)CC[C@@H]1C	ZINC001132486933	1375420337	/nfs/dbraw/zinc/42/03/37/1375420337.db2.gz	QFOSSGMKPFAWTQ-JKSUJKDBSA-N	0	3	348.491	3.061	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCOc2ccccc2C)CC[C@@H]1C	ZINC001132501593	1375427822	/nfs/dbraw/zinc/42/78/22/1375427822.db2.gz	ZFKZWXGMKOWSNJ-ZWKOTPCHSA-N	0	3	330.472	3.309	20	30		EGEDHN
C=C(C)CCC(=O)NC1CCN(Cc2ccc(C)c(OC)c2)CC1	ZINC001227596642	1375449671	/nfs/dbraw/zinc/44/96/71/1375449671.db2.gz	IWIBXBIMEDQAHQ-UHFFFAOYSA-N	0	3	330.472	3.441	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2ccc(C3CCC3)cc2)CC1	ZINC001227691682	1375461488	/nfs/dbraw/zinc/46/14/88/1375461488.db2.gz	AXLYNAOVSNDOIB-UHFFFAOYSA-N	0	3	342.483	3.351	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2coc3c2cccc3C)CC1	ZINC001227807630	1375477698	/nfs/dbraw/zinc/47/76/98/1375477698.db2.gz	VSCPVDPHPNMVHY-UHFFFAOYSA-N	0	3	342.439	3.138	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1CCCC[C@H]1NCc1ccns1	ZINC001227973749	1375496644	/nfs/dbraw/zinc/49/66/44/1375496644.db2.gz	XRZVQEYNQIOUCU-IAGOWNOFSA-N	0	3	333.501	3.244	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2ccc(CCCC)cc2)CC1	ZINC001228195879	1375526272	/nfs/dbraw/zinc/52/62/72/1375526272.db2.gz	IGSWIPLNGLKUEO-UHFFFAOYSA-N	0	3	344.499	3.426	20	30		EGEDHN
C=CCc1cc(OC)c(O[C@H]2CCCN(CC)C2)c(C(=O)OC)c1	ZINC001228246720	1375533293	/nfs/dbraw/zinc/53/32/93/1375533293.db2.gz	ZUXOHSXRGDAKOZ-HNNXBMFYSA-N	0	3	333.428	3.073	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](C)[C@H](CNC/C(Cl)=C\Cl)C1	ZINC001132786373	1375563909	/nfs/dbraw/zinc/56/39/09/1375563909.db2.gz	TYGFWRJVBUWOJL-WIGWJDOSSA-N	0	3	331.287	3.183	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)Nc1ccc(CN2CCC(O)CC2)cc1	ZINC001327113648	1388386453	/nfs/dbraw/zinc/38/64/53/1388386453.db2.gz	OAUYIVPUBZVAON-UHFFFAOYSA-N	0	3	349.434	3.076	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CCN(CCOc2cccc(CC)c2)CC1	ZINC001228631258	1375622116	/nfs/dbraw/zinc/62/21/16/1375622116.db2.gz	IYDQMWVWURSESI-UHFFFAOYSA-N	0	3	344.499	3.421	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CCN(CCO[C@@H]2CCCC[C@@H]2C)CC1	ZINC001228631972	1375622338	/nfs/dbraw/zinc/62/23/38/1375622338.db2.gz	ZAMQOLVIGIWIQO-FUHWJXTLSA-N	0	3	336.520	3.375	20	30		EGEDHN
C[C@@H]1CCN(C(=O)CCC(F)F)C[C@@H]1CNCc1ccccc1C#N	ZINC001132986280	1375694477	/nfs/dbraw/zinc/69/44/77/1375694477.db2.gz	DZQXFXMYLUDPMR-PBHICJAKSA-N	0	3	349.425	3.178	20	30		EGEDHN
COc1ccc(CNCc2cccc(OCC#N)c2)c(C)c1OC	ZINC001327140592	1388398892	/nfs/dbraw/zinc/39/88/92/1388398892.db2.gz	WHRNDMWHSWCXKW-UHFFFAOYSA-N	0	3	326.396	3.204	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](C)[C@H](CNCc2cc(C)no2)C1	ZINC001133137926	1375798760	/nfs/dbraw/zinc/79/87/60/1375798760.db2.gz	AAJRQFHKATZVQJ-GOEBONIOSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](C)[C@@H](CNCc2cnc(C)o2)C1	ZINC001133143716	1375805223	/nfs/dbraw/zinc/80/52/23/1375805223.db2.gz	WZEAEICIRPMJRE-ZBFHGGJFSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@H]2CN(CCOc3ccccc3)C[C@H]21	ZINC001188897737	1388403926	/nfs/dbraw/zinc/40/39/26/1388403926.db2.gz	WORKHBJJZOOVPX-WSTZPKSXSA-N	0	3	342.483	3.200	20	30		EGEDHN
Cc1ccc(C(=O)NCCNCc2ccc(C#N)cc2)cc1Cl	ZINC001133261341	1375875749	/nfs/dbraw/zinc/87/57/49/1375875749.db2.gz	LVDHUCXHYDNEPX-UHFFFAOYSA-N	0	3	327.815	3.040	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)C(C)(C)C(F)(F)F	ZINC001229827675	1375899905	/nfs/dbraw/zinc/89/99/05/1375899905.db2.gz	BPGXVJQHTZLXBV-GHMZBOCLSA-N	0	3	326.790	3.344	20	30		EGEDHN
Cc1cccc(Cl)c1C(=O)NCCNCc1ccc(C#N)c(F)c1	ZINC001133314001	1375917186	/nfs/dbraw/zinc/91/71/86/1375917186.db2.gz	BZPYKXGFFFQZMX-UHFFFAOYSA-N	0	3	345.805	3.179	20	30		EGEDHN
C=CCCC1(C(=O)NCCNCc2ccc(C(C)C)nc2C)CC1	ZINC001133376090	1375956667	/nfs/dbraw/zinc/95/66/67/1375956667.db2.gz	WMWOBBROAZCYLG-UHFFFAOYSA-N	0	3	329.488	3.466	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1coc(C)c1	ZINC001133395924	1375979498	/nfs/dbraw/zinc/97/94/98/1375979498.db2.gz	IWCZXSNCEOQAPR-UHFFFAOYSA-N	0	3	344.842	3.497	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1ccc(CC)o1	ZINC001133399049	1375982478	/nfs/dbraw/zinc/98/24/78/1375982478.db2.gz	ADPFLJZMHCFNEX-UHFFFAOYSA-N	0	3	344.842	3.361	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C(C)(C)C(F)F	ZINC001133403937	1375988143	/nfs/dbraw/zinc/98/81/43/1375988143.db2.gz	QGXQPVMLSABDOS-UHFFFAOYSA-N	0	3	342.817	3.183	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C(C1CC1)C1CC1	ZINC001133410500	1375993372	/nfs/dbraw/zinc/99/33/72/1375993372.db2.gz	JVYSXORCBVOGSS-UHFFFAOYSA-N	0	3	344.886	3.328	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C[C@H](C)C1CC1	ZINC001133410754	1375994727	/nfs/dbraw/zinc/99/47/27/1375994727.db2.gz	ZRINVBSCUVTMDT-HNNXBMFYSA-N	0	3	332.875	3.328	20	30		EGEDHN
C=C[C@H](C(=O)NC1CCN(CCOC2CCC2)CC1)c1ccccc1	ZINC001230332115	1375999728	/nfs/dbraw/zinc/99/97/28/1375999728.db2.gz	SGOIRGZVQFZOBE-FQEVSTJZSA-N	0	3	342.483	3.106	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CCCC[C@H]2NCc2ccnn2C)CCCC1	ZINC001230385903	1376012636	/nfs/dbraw/zinc/01/26/36/1376012636.db2.gz	DRXXCWRKJYMLBL-QZTJIDSGSA-N	0	3	344.503	3.074	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1C1CCN(C(=O)COC(C)(C)C)CC1	ZINC001230552320	1376073832	/nfs/dbraw/zinc/07/38/32/1376073832.db2.gz	MVMXVRBWPJDBGR-MRXNPFEDSA-N	0	3	342.911	3.257	20	30		EGEDHN
C#CCCN(CCCNC(=O)C[C@@H]1CCC[C@H]1C)Cc1cccnc1	ZINC001230767289	1376144421	/nfs/dbraw/zinc/14/44/21/1376144421.db2.gz	PTUNKJZEUANHHI-QUCCMNQESA-N	0	3	341.499	3.240	20	30		EGEDHN
C(#Cc1ccccc1CN1CCc2nccn2CC1)c1ccccc1	ZINC001231578962	1376270200	/nfs/dbraw/zinc/27/02/00/1376270200.db2.gz	VRGKADATBGXZOU-UHFFFAOYSA-N	0	3	327.431	3.341	20	30		EGEDHN
COc1cc(C#N)ccc1CN1CCC2(CC1)OC(=O)c1ccccc12	ZINC001231618606	1376283267	/nfs/dbraw/zinc/28/32/67/1376283267.db2.gz	PCXIOHVJJDOJAQ-UHFFFAOYSA-N	0	3	348.402	3.229	20	30		EGEDHN
N#Cc1cccc(O[C@@H]2CCCN(Cc3cc4cc[nH]c4cn3)C2)c1	ZINC001231669734	1376299518	/nfs/dbraw/zinc/29/95/18/1376299518.db2.gz	OBICNVQYAUJUAJ-LJQANCHMSA-N	0	3	332.407	3.478	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)C1C(C)(C)C1(C)C	ZINC001134076360	1376353013	/nfs/dbraw/zinc/35/30/13/1376353013.db2.gz	KOBAQVXAMRTERX-NWDGAFQWSA-N	0	3	345.325	3.450	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)C1=CCCC1)NCc1cc(F)ccc1C#N	ZINC001134119321	1376378575	/nfs/dbraw/zinc/37/85/75/1376378575.db2.gz	PHGDEANOEDXKNN-ZIAGYGMSSA-N	0	3	329.419	3.181	20	30		EGEDHN
N#Cc1ccccc1O[C@@H]1CCCN(Cc2cc3c[nH]ccc-3n2)C1	ZINC001232015444	1376383223	/nfs/dbraw/zinc/38/32/23/1376383223.db2.gz	IVJGFJRZMGGARB-GOSISDBHSA-N	0	3	332.407	3.478	20	30		EGEDHN
C#CCCCC(=O)N[C@H](C)C[C@H](C)NCc1ccn(C2CCCC2)n1	ZINC001134200907	1376415052	/nfs/dbraw/zinc/41/50/52/1376415052.db2.gz	JSGZAXBHRFNQNE-DLBZAZTESA-N	0	3	344.503	3.175	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)c1sccc1F)NCc1ccccc1C#N	ZINC001134274387	1376450083	/nfs/dbraw/zinc/45/00/83/1376450083.db2.gz	OSQDJPSQTQDKQW-OLZOCXBDSA-N	0	3	345.443	3.446	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H](C)C[C@@H](C)NCc1conc1CC	ZINC001134418278	1376523547	/nfs/dbraw/zinc/52/35/47/1376523547.db2.gz	IADJRAULESJTEE-HUUCEWRRSA-N	0	3	333.476	3.378	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H](C)C[C@@H](C)NCC(=C)Br	ZINC001134447070	1376542112	/nfs/dbraw/zinc/54/21/12/1376542112.db2.gz	FYNBGSAVMRWHPP-OLZOCXBDSA-N	0	3	331.298	3.370	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H](C)C[C@@H](C)NCc1cnc(C)o1	ZINC001134449788	1376544288	/nfs/dbraw/zinc/54/42/88/1376544288.db2.gz	WZDZQRAVCKMROG-MNOVXSKESA-N	0	3	327.856	3.135	20	30		EGEDHN
C=CCN1C(=O)CCC[C@@]12CCCN(Cc1cnc(C)c(C)c1)C2	ZINC001233159561	1376576824	/nfs/dbraw/zinc/57/68/24/1376576824.db2.gz	XUDCRUJICWTCQX-FQEVSTJZSA-N	0	3	327.472	3.232	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H](C)C[C@@H](C)NCc1nc(C)cs1	ZINC001134608318	1376623416	/nfs/dbraw/zinc/62/34/16/1376623416.db2.gz	UNAVSSRXGYKHDV-ZIAGYGMSSA-N	0	3	346.500	3.126	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H](C)C[C@@H](C)NC/C(Cl)=C\Cl	ZINC001134638735	1376637378	/nfs/dbraw/zinc/63/73/78/1376637378.db2.gz	UETFTRKLKVVDIP-HUPKAIDTSA-N	0	3	344.286	3.480	20	30		EGEDHN
Cc1cc(C)c(C(=O)N[C@@H](C)C[C@@H](C)NCc2ccccc2C#N)[nH]1	ZINC001134757150	1376703019	/nfs/dbraw/zinc/70/30/19/1376703019.db2.gz	UNNUPDWIVHAULC-ZBFHGGJFSA-N	0	3	338.455	3.190	20	30		EGEDHN
C#CCCCC(=O)N(C)C[C@H]1CCN1C[C@@H]1CCCC(F)(F)C1	ZINC001233948591	1376742094	/nfs/dbraw/zinc/74/20/94/1376742094.db2.gz	YXDTYXDUSFJZHW-HZPDHXFCSA-N	0	3	326.431	3.148	20	30		EGEDHN
C=CCCCCCN1CC[C@@H]1CN(C)C(=O)c1cc2n(n1)CCCC2	ZINC001235633481	1376881709	/nfs/dbraw/zinc/88/17/09/1376881709.db2.gz	PTWWKZDNXPZPER-GOSISDBHSA-N	0	3	344.503	3.112	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)C1(C)CCCC1	ZINC001135114490	1376907732	/nfs/dbraw/zinc/90/77/32/1376907732.db2.gz	ARWFZJHBELOSSA-OLZOCXBDSA-N	0	3	331.298	3.348	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N[C@H](C)C[C@H](C)NCC(=C)Br	ZINC001135243317	1376997477	/nfs/dbraw/zinc/99/74/77/1376997477.db2.gz	JRPQFAGUIBFLJO-WANXEPPHSA-N	0	3	329.282	3.290	20	30		EGEDHN
C=CCCCC(=O)N[C@@H](C)C[C@H](C)NCc1nc2ccccc2n1C	ZINC001135358039	1377050611	/nfs/dbraw/zinc/05/06/11/1377050611.db2.gz	LRZBGGWTGIBSKD-HOTGVXAUSA-N	0	3	342.487	3.303	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CCN(Cc3ccc4n3CCC4)C2)C1	ZINC001248821158	1377071560	/nfs/dbraw/zinc/07/15/60/1377071560.db2.gz	QDXNKQYFMWPWGO-HXUWFJFHSA-N	0	3	343.471	3.045	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](C)C[C@H](C)NCc2conc2CC)CC1	ZINC001135416138	1377083147	/nfs/dbraw/zinc/08/31/47/1377083147.db2.gz	QUMVFJRXPPUHBR-GJZGRUSLSA-N	0	3	333.476	3.356	20	30		EGEDHN
CC(C)(C)c1cccc(C(=O)NCCNCc2ccc(C#N)s2)c1	ZINC001135620443	1377165742	/nfs/dbraw/zinc/16/57/42/1377165742.db2.gz	WAPNHWCPRWLUJC-UHFFFAOYSA-N	0	3	341.480	3.437	20	30		EGEDHN
CCN(CCNC(=O)c1cc(C)oc1C)Cc1ccc(C#N)cc1	ZINC001266374932	1377299313	/nfs/dbraw/zinc/29/93/13/1377299313.db2.gz	HWURRWMCBHXNPR-UHFFFAOYSA-N	0	3	325.412	3.020	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CC[C@@H](N(C)Cc2ccc(F)cc2C)C1	ZINC001189242800	1388493590	/nfs/dbraw/zinc/49/35/90/1388493590.db2.gz	MCFLZMFYYGAWCG-QFBILLFUSA-N	0	3	348.462	3.148	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2ccn3c(C)cnc3c2)CCCC1	ZINC001269545128	1377558083	/nfs/dbraw/zinc/55/80/83/1377558083.db2.gz	DYKNUEWIJDPHEV-UHFFFAOYSA-N	0	3	346.862	3.027	20	30		EGEDHN
C#CCOc1ccc(CN2CCC[C@@H](c3ccccn3)C2)cc1OC	ZINC001138346121	1377706291	/nfs/dbraw/zinc/70/62/91/1377706291.db2.gz	YFJPECQSKCKGRZ-GOSISDBHSA-N	0	3	336.435	3.482	20	30		EGEDHN
C#CCOc1ccc(CN2CC[C@H](C(=O)OC)[C@@H]2c2ccccc2)cc1	ZINC001138560622	1377741917	/nfs/dbraw/zinc/74/19/17/1377741917.db2.gz	DANKOYGCYXCCHC-SFTDATJTSA-N	0	3	349.430	3.435	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CCC3(CCC(=O)N3CC=C)CC2)c1[O-]	ZINC001138626894	1377756189	/nfs/dbraw/zinc/75/61/89/1377756189.db2.gz	RYFZYGHPZKPPJB-UHFFFAOYSA-N	0	3	340.467	3.264	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCc3ncnc(C4CC4)c3CC2)c1[O-]	ZINC001138627353	1377756916	/nfs/dbraw/zinc/75/69/16/1377756916.db2.gz	DAOCWTPGVWMMOP-UHFFFAOYSA-N	0	3	335.451	3.389	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCc3ncnc(C4CC4)c3CC2)c1[O-]	ZINC001138627353	1377756917	/nfs/dbraw/zinc/75/69/17/1377756917.db2.gz	DAOCWTPGVWMMOP-UHFFFAOYSA-N	0	3	335.451	3.389	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CCC(NC(=O)N(CC)CC)CC2)c1[O-]	ZINC001138631326	1377758278	/nfs/dbraw/zinc/75/82/78/1377758278.db2.gz	PGCHAXUVIYOXTP-UHFFFAOYSA-N	0	3	345.487	3.137	20	30		EGEDHN
C=CCOC(=O)N[C@@H]1CCCN(Cc2c(C)cc(OC)c(C)c2C)C1	ZINC001138727928	1377775435	/nfs/dbraw/zinc/77/54/35/1377775435.db2.gz	XIOSRPGWLAPKOL-QGZVFWFLSA-N	0	3	346.471	3.497	20	30		EGEDHN
N#Cc1ccnc(-c2ccc(CN3CCC[C@H](n4ccnn4)C3)cc2)c1	ZINC001139406369	1377879673	/nfs/dbraw/zinc/87/96/73/1377879673.db2.gz	QBQHBAPLHXGNSH-IBGZPJMESA-N	0	3	344.422	3.049	20	30		EGEDHN
COC(=O)C1(C)CCN(Cc2ccc(-c3cc(C#N)ccn3)cc2)CC1	ZINC001139407314	1377880309	/nfs/dbraw/zinc/88/03/09/1377880309.db2.gz	XCVPJGDTSKYTKF-UHFFFAOYSA-N	0	3	349.434	3.395	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1ccc(C#N)c(F)c1)CC2	ZINC001139527379	1377897364	/nfs/dbraw/zinc/89/73/64/1377897364.db2.gz	CUVWJAMWUMEYQC-FQEVSTJZSA-N	0	3	341.430	3.230	20	30		EGEDHN
CC(C)(C)C(=O)NC1CCN(Cc2c[nH]c3c2cccc3C#N)CC1	ZINC001139707397	1377938181	/nfs/dbraw/zinc/93/81/81/1377938181.db2.gz	ZGNCAGGVIBRZOY-UHFFFAOYSA-N	0	3	338.455	3.166	20	30		EGEDHN
Cc1cc(O[C@@H]2CCCN(Cc3c[nH]c4c3cccc4C#N)C2)ncn1	ZINC001139707937	1377939352	/nfs/dbraw/zinc/93/93/52/1377939352.db2.gz	YYYCFZGVRDNXLW-QGZVFWFLSA-N	0	3	347.422	3.181	20	30		EGEDHN
N#Cc1ccc2[nH]cc(CN3CCN(CCc4ccccc4)CC3)c2c1	ZINC001140114280	1378010803	/nfs/dbraw/zinc/01/08/03/1378010803.db2.gz	MXDBIIBMJPPHDQ-UHFFFAOYSA-N	0	3	344.462	3.400	20	30		EGEDHN
CCc1noc(C2CCN(Cc3c[nH]c4ccc(C#N)cc34)CC2)n1	ZINC001140116195	1378011867	/nfs/dbraw/zinc/01/18/67/1378011867.db2.gz	VDGVPJWADORYOY-UHFFFAOYSA-N	0	3	335.411	3.365	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@H]1CCN(Cc1ccc(O)cc1F)C2	ZINC001140127304	1378013596	/nfs/dbraw/zinc/01/35/96/1378013596.db2.gz	YWPVSZKEWHDWIQ-RBUKOAKNSA-N	0	3	335.419	3.105	20	30		EGEDHN
C=C(C)CNC(=O)[C@H]1CC12CCN(Cc1cc(F)ccc1C)CC2	ZINC001272617230	1378076812	/nfs/dbraw/zinc/07/68/12/1378076812.db2.gz	UGYZWSHNCKHLBT-GOSISDBHSA-N	0	3	330.447	3.429	20	30		EGEDHN
C=C(C)CNC(=O)[C@H]1CC12CCN(Cc1cccc(OCC)c1)CC2	ZINC001273303948	1378095963	/nfs/dbraw/zinc/09/59/63/1378095963.db2.gz	PISNFRCDOHZNRA-LJQANCHMSA-N	0	3	342.483	3.380	20	30		EGEDHN
C=CCN1CC[C@]2(CCN(Cc3ccc(F)c(C)c3Cl)C2)C1=O	ZINC001274476903	1378127165	/nfs/dbraw/zinc/12/71/65/1378127165.db2.gz	LQQRDQCCCJZSNZ-SFHVURJKSA-N	0	3	336.838	3.398	20	30		EGEDHN
COc1ccc(CN2CCC[C@@H](Oc3ccc(C#N)cc3)C2)cc1N	ZINC001140903517	1378177500	/nfs/dbraw/zinc/17/75/00/1378177500.db2.gz	WFRRLDUPYSGEKP-GOSISDBHSA-N	0	3	337.423	3.192	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2C[C@H]3C[C@@]3(C(=O)N(CC)C(C)C)C2)c1[O-]	ZINC001277463860	1378224228	/nfs/dbraw/zinc/22/42/28/1378224228.db2.gz	PWQJXPCSXADTET-WIYYLYMNSA-N	0	3	342.483	3.200	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2C[C@H]3C[C@@]3(C(=O)N(CC)C(C)C)C2)c1[O-]	ZINC001277463860	1378224232	/nfs/dbraw/zinc/22/42/32/1378224232.db2.gz	PWQJXPCSXADTET-WIYYLYMNSA-N	0	3	342.483	3.200	20	30		EGEDHN
C=CCOC(=O)N1CC2(C1)CCN(Cc1ccc(C)cc1F)CC2	ZINC001141191136	1378262618	/nfs/dbraw/zinc/26/26/18/1378262618.db2.gz	AIOAXGYKYLIERU-UHFFFAOYSA-N	0	3	332.419	3.355	20	30		EGEDHN
COCCN(CCOC)Cc1ccc(Oc2ccc(C#N)cc2)cc1	ZINC001141287407	1378292273	/nfs/dbraw/zinc/29/22/73/1378292273.db2.gz	DOVIOFUFHBWGMD-UHFFFAOYSA-N	0	3	340.423	3.445	20	30		EGEDHN
COc1ccc(CN(C)CCCN(C)C(=O)CC(C)(C)C)cc1C#N	ZINC001280787949	1378376884	/nfs/dbraw/zinc/37/68/84/1378376884.db2.gz	SFSBJRFGPAYWBA-UHFFFAOYSA-N	0	3	345.487	3.283	20	30		EGEDHN
C[C@H]1CCN(Cc2ccccc2)C[C@@H]1N(C)C(=O)C#Cc1ccccc1	ZINC001142858973	1378497605	/nfs/dbraw/zinc/49/76/05/1378497605.db2.gz	LKXDMRLQNAVMHT-UGKGYDQZSA-N	0	3	346.474	3.407	20	30		EGEDHN
CCC(=O)N(CC)C1CCN(Cc2c[nH]c3cc(C#N)ccc23)CC1	ZINC001142925752	1378509911	/nfs/dbraw/zinc/50/99/11/1378509911.db2.gz	BVTYAOTYQYPMRW-UHFFFAOYSA-N	0	3	338.455	3.262	20	30		EGEDHN
COc1ccnc(O[C@@H]2CCN(Cc3c[nH]c4cc(C#N)ccc34)C2)c1	ZINC001142930312	1378511285	/nfs/dbraw/zinc/51/12/85/1378511285.db2.gz	IUUKHWSXTODPGN-QGZVFWFLSA-N	0	3	348.406	3.096	20	30		EGEDHN
N#CCCC(=O)Nc1ccc(N2CCN(Cc3ccccc3)CC2)cc1	ZINC001143199097	1378558077	/nfs/dbraw/zinc/55/80/77/1378558077.db2.gz	YPPZYZAJBOZHBC-UHFFFAOYSA-N	0	3	348.450	3.251	20	30		EGEDHN
C=C(Br)CN[C@@H](CNC(=O)C12CCC(CC1)C2)C(C)C	ZINC001753832542	1440500086	/nfs/dbraw/zinc/50/00/86/1440500086.db2.gz	POJAOSXXDVJLSU-BBBYJDLNSA-N	0	3	343.309	3.206	20	30		EGEDHN
C#Cc1ccc(CN2CCC3(C[C@@H](c4ccccc4)C(=O)N3)CC2)cc1	ZINC001144571659	1378745679	/nfs/dbraw/zinc/74/56/79/1378745679.db2.gz	DHXUAJWICRBKDS-NRFANRHFSA-N	0	3	344.458	3.306	20	30		EGEDHN
C#Cc1ccc(CN2CCC(Oc3cc(Cl)ncn3)CC2)cc1	ZINC001144573260	1378746905	/nfs/dbraw/zinc/74/69/05/1378746905.db2.gz	FXQXZUHFUAPEQL-UHFFFAOYSA-N	0	3	327.815	3.155	20	30		EGEDHN
N#C[C@H]1CCCN(Cc2c[nH]c3cc(Br)cnc23)CC1	ZINC001144703839	1378761736	/nfs/dbraw/zinc/76/17/36/1378761736.db2.gz	MUZVHQMANCQKTH-NSHDSACASA-N	0	3	333.233	3.451	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc3sccc3c2)s1	ZINC001146316092	1378814890	/nfs/dbraw/zinc/81/48/90/1378814890.db2.gz	DZYHGWKJIGPJSP-UHFFFAOYSA-N	0	3	341.461	3.354	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2cc(C)ncn2)CCCC1	ZINC001146820460	1378927203	/nfs/dbraw/zinc/92/72/03/1378927203.db2.gz	GATMIRHVDAQXKH-NVXWUHKLSA-N	0	3	344.503	3.294	20	30		EGEDHN
CCC[C@@H](C)CC(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001147165183	1378981450	/nfs/dbraw/zinc/98/14/50/1378981450.db2.gz	DBIJKXANIFQVER-QGZVFWFLSA-N	0	3	339.483	3.419	20	30		EGEDHN
CC(C)(C)/C=C\C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001147241734	1378994696	/nfs/dbraw/zinc/99/46/96/1378994696.db2.gz	ZNWRZXCDBXTIEZ-FPLPWBNLSA-N	0	3	337.467	3.195	20	30		EGEDHN
CCC[C@H](C)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001147250912	1378997995	/nfs/dbraw/zinc/99/79/95/1378997995.db2.gz	PFVUHCUNNIPCFW-INIZCTEOSA-N	0	3	325.456	3.029	20	30		EGEDHN
CC(C)C#CC(=O)N1CC2(C1)CCN([C@@H](C)c1ccc(F)cc1)C2	ZINC001147483037	1379031147	/nfs/dbraw/zinc/03/11/47/1379031147.db2.gz	JSMMGJIFQGTASS-INIZCTEOSA-N	0	3	328.431	3.080	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)N1CC2(C1)CCN(Cc1cccc(OC)c1)C2	ZINC001148088637	1379115204	/nfs/dbraw/zinc/11/52/04/1379115204.db2.gz	OQXYJDNULMEDAD-DLBZAZTESA-N	0	3	342.483	3.188	20	30		EGEDHN
C=CCCCC(=O)N1CC2(C1)CCN(CCOc1ccccc1C)C2	ZINC001148199869	1379132950	/nfs/dbraw/zinc/13/29/50/1379132950.db2.gz	SQTHGSNGXNXLEE-UHFFFAOYSA-N	0	3	342.483	3.264	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)Cc2cccc3ccccc32)s1	ZINC001148710430	1379247908	/nfs/dbraw/zinc/24/79/08/1379247908.db2.gz	IEEARSDGLIIHPB-UHFFFAOYSA-N	0	3	349.459	3.221	20	30		EGEDHN
C=CCCOCC(=O)N1CC2(C1)CCN([C@@H](C)c1ccc(F)cc1)C2	ZINC001148874527	1379289026	/nfs/dbraw/zinc/28/90/26/1379289026.db2.gz	ZOVCMLUTJUXYOC-INIZCTEOSA-N	0	3	346.446	3.014	20	30		EGEDHN
Cc1csc(Cl)c1C(=O)NCCNCc1cccc(C#N)c1	ZINC001149167121	1379338251	/nfs/dbraw/zinc/33/82/51/1379338251.db2.gz	XOCFEFGNRGTXTG-UHFFFAOYSA-N	0	3	333.844	3.101	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)CCC2CCCCC2)ccc1F	ZINC001149785914	1379445878	/nfs/dbraw/zinc/44/58/78/1379445878.db2.gz	HWNPXMWHPNZGCM-UHFFFAOYSA-N	0	3	331.435	3.264	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc3c(c2)CCCC3)s1	ZINC001149973676	1379476793	/nfs/dbraw/zinc/47/67/93/1379476793.db2.gz	JYBKZZNOVCNYRD-UHFFFAOYSA-N	0	3	339.464	3.018	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@@H]1CN(Cc2cccc(C)c2)CCCO1	ZINC001150246619	1379521638	/nfs/dbraw/zinc/52/16/38/1379521638.db2.gz	GMRZQQUYCQQYOL-TZIWHRDSSA-N	0	3	344.499	3.304	20	30		EGEDHN
C#CCCN1CCCO[C@H](CNC(=O)CCCCCCCCC)C1	ZINC001150641808	1379586914	/nfs/dbraw/zinc/58/69/14/1379586914.db2.gz	YXANYROCXNKLKF-LJQANCHMSA-N	0	3	336.520	3.358	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)C2(C3CCCCC3)CC2)C1	ZINC001150654248	1379590824	/nfs/dbraw/zinc/59/08/24/1379590824.db2.gz	VTRBUMLOANMUAR-GOSISDBHSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC1(CCOC)CCN(CC(=C)C)CC1	ZINC001151145395	1379667521	/nfs/dbraw/zinc/66/75/21/1379667521.db2.gz	RZPNAYHVTIJANI-UHFFFAOYSA-N	0	3	334.504	3.318	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2c(C)oc(C)c2C)CC1	ZINC001151198228	1379674871	/nfs/dbraw/zinc/67/48/71/1379674871.db2.gz	CAJJOHGZSHUDAD-UHFFFAOYSA-N	0	3	348.487	3.382	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2ccoc2CCC)CC1	ZINC001151392599	1379709875	/nfs/dbraw/zinc/70/98/75/1379709875.db2.gz	MTNKVOLIHZOXRU-UHFFFAOYSA-N	0	3	348.487	3.409	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)c1cccs1	ZINC001151662787	1379760063	/nfs/dbraw/zinc/76/00/63/1379760063.db2.gz	BJYNTXIZOWRTSW-CQSZACIVSA-N	0	3	327.453	3.260	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)c1ccoc1C	ZINC001151801183	1379783839	/nfs/dbraw/zinc/78/38/39/1379783839.db2.gz	NRTXSXZSCYHWSA-CYBMUJFWSA-N	0	3	343.402	3.239	20	30		EGEDHN
C=C[C@H](CC(=O)NCCNCc1ccc(C#N)cc1)c1ccccc1	ZINC001151942381	1379821517	/nfs/dbraw/zinc/82/15/17/1379821517.db2.gz	HDLNILSVXNBDOB-LJQANCHMSA-N	0	3	333.435	3.124	20	30		EGEDHN
C=C[C@H](C(=O)NCCNCc1ccc(F)c(F)c1)c1ccccc1	ZINC001151990284	1379832468	/nfs/dbraw/zinc/83/24/68/1379832468.db2.gz	FAFWVTICNXCZRI-INIZCTEOSA-N	0	3	330.378	3.140	20	30		EGEDHN
C=CCC1(C(=O)NCCNCc2ccc(C#N)cc2)CCCCC1	ZINC001152010839	1379837546	/nfs/dbraw/zinc/83/75/46/1379837546.db2.gz	RDSLVCWWUMSISQ-UHFFFAOYSA-N	0	3	325.456	3.291	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)/C=C(/C)C1CC1	ZINC001152128586	1379867801	/nfs/dbraw/zinc/86/78/01/1379867801.db2.gz	JWXRAVHJPXTEGP-KQGZCTBQSA-N	0	3	343.446	3.380	20	30		EGEDHN
Cc1ccc(C[C@@H](C)C(=O)NCCNCc2ccc(C#N)s2)cc1	ZINC001152691291	1379971163	/nfs/dbraw/zinc/97/11/63/1379971163.db2.gz	JMGUYFXKOIUUDJ-OAHLLOKOSA-N	0	3	341.480	3.013	20	30		EGEDHN
CC(C)(C)[C@H](CNCc1ccc(C#N)cc1F)NC(=O)[C@H]1CC1(C)C	ZINC001284575522	1379980219	/nfs/dbraw/zinc/98/02/19/1379980219.db2.gz	HTEWSYOKBSTVFV-WBVHZDCISA-N	0	3	345.462	3.364	20	30		EGEDHN
CC1=C(C)C[C@](C)(C(=O)NCCNCc2ccc(F)c(C#N)c2)CC1	ZINC001152934458	1379996208	/nfs/dbraw/zinc/99/62/08/1379996208.db2.gz	HVKFSWSGPKVTJF-HXUWFJFHSA-N	0	3	343.446	3.430	20	30		EGEDHN
CC[C@@H](C)CC(=O)NC[C@@H](C)N(CC)Cc1ccc(F)c(C#N)c1	ZINC001153006930	1380006859	/nfs/dbraw/zinc/00/68/59/1380006859.db2.gz	LTYQALUPOXYHAF-HUUCEWRRSA-N	0	3	333.451	3.460	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)c(F)c1	ZINC001153642069	1380109044	/nfs/dbraw/zinc/10/90/44/1380109044.db2.gz	OKGLARYEMXSXMD-OAHLLOKOSA-N	0	3	331.435	3.380	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)CCc1ccc(C)c(Cl)c1	ZINC001154509949	1380294213	/nfs/dbraw/zinc/29/42/13/1380294213.db2.gz	YCPGQXKXSRWPLK-MRXNPFEDSA-N	0	3	334.891	3.431	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H](C)N(CC)C[C@H](OC)c1ccccc1	ZINC001154605338	1380315228	/nfs/dbraw/zinc/31/52/28/1380315228.db2.gz	FXESSSNNUJEZPG-AEFFLSMTSA-N	0	3	332.488	3.413	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)C1(CC)CCC1	ZINC001154711848	1380336992	/nfs/dbraw/zinc/33/69/92/1380336992.db2.gz	KPQVPCBMYZKOFT-MRXNPFEDSA-N	0	3	327.472	3.465	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)c(F)c1	ZINC001154719549	1380339707	/nfs/dbraw/zinc/33/97/07/1380339707.db2.gz	GPHSUGGOITXJRU-MRXNPFEDSA-N	0	3	343.446	3.218	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)[C@H]1CCC1(C)C	ZINC001154736020	1380342669	/nfs/dbraw/zinc/34/26/69/1380342669.db2.gz	KMPRRAQMEJAVCX-RHSMWYFYSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H](C)N(CC)C[C@H](O)c1ccccc1F	ZINC001154927869	1380378122	/nfs/dbraw/zinc/37/81/22/1380378122.db2.gz	QSWDRCIICGVVIT-QAPCUYQASA-N	0	3	336.451	3.042	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H](C)N(CC)Cc1ccc(F)c(C#N)c1	ZINC001154957909	1380381077	/nfs/dbraw/zinc/38/10/77/1380381077.db2.gz	RTXRHFRUWIEHJL-OAHLLOKOSA-N	0	3	331.435	3.380	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H](C)N(CC)CCc2ccns2)CCC1	ZINC001155062217	1380401045	/nfs/dbraw/zinc/40/10/45/1380401045.db2.gz	YNAWVBZOPHZCOR-OAHLLOKOSA-N	0	3	335.517	3.259	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@@H](C)N(CC)Cc1ccnc(N(C)C)c1	ZINC001155066892	1380402470	/nfs/dbraw/zinc/40/24/70/1380402470.db2.gz	QIGFLFLHHWQBHF-UZLBHIALSA-N	0	3	346.519	3.077	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NCCCNCc1ccc(F)cc1Cl	ZINC001155427267	1380451568	/nfs/dbraw/zinc/45/15/68/1380451568.db2.gz	PIRXRKWJBKVVFD-CYBMUJFWSA-N	0	3	342.842	3.056	20	30		EGEDHN
CC[C@@H](CC(=O)NC[C@@H](C)N(CC)CC#CCOC)c1ccccc1	ZINC001156318424	1380557479	/nfs/dbraw/zinc/55/74/79/1380557479.db2.gz	ADGILJOUTAQJID-MOPGFXCFSA-N	0	3	344.499	3.047	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C[C@@H](C)c1ccccc1OC	ZINC001156448673	1380577034	/nfs/dbraw/zinc/57/70/34/1380577034.db2.gz	KDHJTOIZJDRMDR-IAGOWNOFSA-N	0	3	330.472	3.039	20	30		EGEDHN
CCOCc1cc(CNCc2cccc(OCC#N)c2)ccc1OC	ZINC001328194682	1388687273	/nfs/dbraw/zinc/68/72/73/1388687273.db2.gz	GBDZIORZTMSEEJ-UHFFFAOYSA-N	0	3	340.423	3.424	20	30		EGEDHN
CC(C)(CC(=O)NCCCNCc1cc(C#N)ccc1F)C1CC1	ZINC001157532858	1380958982	/nfs/dbraw/zinc/95/89/82/1380958982.db2.gz	ODYIXOOZVPZLNT-UHFFFAOYSA-N	0	3	331.435	3.120	20	30		EGEDHN
CC(C)C#CC(=O)NCCCNCc1c(Cl)cccc1Cl	ZINC001157644154	1380988587	/nfs/dbraw/zinc/98/85/87/1380988587.db2.gz	MNPYRTCPFKCNAH-UHFFFAOYSA-N	0	3	327.255	3.249	20	30		EGEDHN
C#CCCCC(=O)N1CCCC[C@@H]1CN(C)CCc1csc(C)n1	ZINC001157885114	1381059846	/nfs/dbraw/zinc/05/98/46/1381059846.db2.gz	ORCZYXOHOXCNKD-GOSISDBHSA-N	0	3	347.528	3.110	20	30		EGEDHN
CC(C)C#CC(=O)N1CCCC[C@@H]1CN(C)CCOc1ccccc1	ZINC001157930854	1381075341	/nfs/dbraw/zinc/07/53/41/1381075341.db2.gz	SKBNIJLDWKCFBL-LJQANCHMSA-N	0	3	342.483	3.038	20	30		EGEDHN
C=C(C)CCC(=O)N1CCCC[C@@H]1CN(C)CCOCC1CCC1	ZINC001158011912	1381102637	/nfs/dbraw/zinc/10/26/37/1381102637.db2.gz	VPTUUUMJMDWRBB-LJQANCHMSA-N	0	3	336.520	3.472	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc(-c2ccccc2)on1	ZINC001158200192	1381157128	/nfs/dbraw/zinc/15/71/28/1381157128.db2.gz	UTPLLJYEOLBGAF-QGZVFWFLSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCCNCc1ccn(C2CCCC2)n1	ZINC001158746613	1381380776	/nfs/dbraw/zinc/38/07/76/1381380776.db2.gz	CHMWTJHKLDMGHJ-UHFFFAOYSA-N	0	3	344.503	3.363	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc2nc(C)ccc2o1	ZINC001158767952	1381389944	/nfs/dbraw/zinc/38/99/44/1381389944.db2.gz	ABZPCQOKNFWPCL-OAHLLOKOSA-N	0	3	327.428	3.249	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc2ncsc2c1	ZINC001158824892	1381417912	/nfs/dbraw/zinc/41/79/12/1381417912.db2.gz	BMJAVKGXSIHELX-OAHLLOKOSA-N	0	3	329.469	3.409	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCC1=CCN([C@H](C)c2ccc(F)cc2)CC1	ZINC001159594385	1381840330	/nfs/dbraw/zinc/84/03/30/1381840330.db2.gz	PWJXXKGYVLGAHM-HUUCEWRRSA-N	0	3	329.419	3.185	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)CO[C@H]2CCCC[C@@H]2CC)CC1	ZINC001160107341	1381998944	/nfs/dbraw/zinc/99/89/44/1381998944.db2.gz	NMQUMBHPBBBIBI-PMACEKPBSA-N	0	3	346.515	3.134	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cccc(Cl)c2C)CC1	ZINC001160222002	1382039661	/nfs/dbraw/zinc/03/96/61/1382039661.db2.gz	UVLUCNFZLJRBRW-UHFFFAOYSA-N	0	3	330.859	3.424	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ncoc2-c2ccccc2)CC1	ZINC001160286709	1382062643	/nfs/dbraw/zinc/06/26/43/1382062643.db2.gz	XYUIHAHRPBUDMS-UHFFFAOYSA-N	0	3	337.423	3.280	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)CCCc1ccsc1	ZINC001160457349	1382108618	/nfs/dbraw/zinc/10/86/18/1382108618.db2.gz	JNDJDCSYHBYFGN-UHFFFAOYSA-N	0	3	341.480	3.239	20	30		EGEDHN
COc1cc(C#N)ccc1C(=O)N(CCN(C)C)CC1CCCCC1	ZINC001292112220	1382170541	/nfs/dbraw/zinc/17/05/41/1382170541.db2.gz	IUWSEKBLWDTHPA-UHFFFAOYSA-N	0	3	343.471	3.151	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)CC(C)(C)CC(F)F)CC1	ZINC001160715090	1382177097	/nfs/dbraw/zinc/17/70/97/1382177097.db2.gz	ZCNZULDCHVAXIZ-UHFFFAOYSA-N	0	3	326.431	3.220	20	30		EGEDHN
C=CCN1CCC[C@H]1CNc1cc2ncnc(Cl)c2cc1[N+](=O)[O-]	ZINC001160953264	1382250130	/nfs/dbraw/zinc/25/01/30/1382250130.db2.gz	ZSVBPNXHDSMEJO-NSHDSACASA-N	0	3	347.806	3.254	20	30		EGEDHN
C=CCN1CCC[C@H]1CNc1cncc(Oc2cccc(F)c2)n1	ZINC001160954052	1382250499	/nfs/dbraw/zinc/25/04/99/1382250499.db2.gz	OUZCVPCAXOXENQ-HNNXBMFYSA-N	0	3	328.391	3.470	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCCC1=CCN(CCc2ccns2)CC1	ZINC001160990564	1382263437	/nfs/dbraw/zinc/26/34/37/1382263437.db2.gz	CGASXCDGGVVDJR-INIZCTEOSA-N	0	3	347.528	3.426	20	30		EGEDHN
C=CCCCC(=O)NCCC1=CCN(CCOCC2CCC2)CC1	ZINC001161056867	1382285564	/nfs/dbraw/zinc/28/55/64/1382285564.db2.gz	RYIAQINJBGDTLC-UHFFFAOYSA-N	0	3	334.504	3.298	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)Cc2c(C)[nH]c3ccccc32)CC1	ZINC001161070513	1382290474	/nfs/dbraw/zinc/29/04/74/1382290474.db2.gz	LINMBZQZNWOUJU-UHFFFAOYSA-N	0	3	349.478	3.181	20	30		EGEDHN
N#CCc1cncc(NCC2CCN(Cc3ccccc3F)CC2)n1	ZINC001161194696	1382336108	/nfs/dbraw/zinc/33/61/08/1382336108.db2.gz	UUXKCAQWVBRLOM-UHFFFAOYSA-N	0	3	339.418	3.006	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc(F)c3ncccc3c2)CC1	ZINC001161492068	1382421848	/nfs/dbraw/zinc/42/18/48/1382421848.db2.gz	PKSZPFPHEGBNTH-UHFFFAOYSA-N	0	3	339.414	3.312	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2csc(-c3ccoc3)n2)CC1	ZINC001161491162	1382421975	/nfs/dbraw/zinc/42/19/75/1382421975.db2.gz	JGQQHDIYOXQYJY-UHFFFAOYSA-N	0	3	343.452	3.341	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cccnc2OCC(C)C)CC1	ZINC001161728903	1382490039	/nfs/dbraw/zinc/49/00/39/1382490039.db2.gz	BQGITTXJJIKAAC-UHFFFAOYSA-N	0	3	343.471	3.054	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)COc2c(C)cccc2C)CC1	ZINC001161829465	1382523140	/nfs/dbraw/zinc/52/31/40/1382523140.db2.gz	XZNOIHBDVPVJHD-UHFFFAOYSA-N	0	3	328.456	3.007	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)CCc2ccc(CC)cc2)CC1	ZINC001161850302	1382529868	/nfs/dbraw/zinc/52/98/68/1382529868.db2.gz	YOTWMBYVBIMKRV-UHFFFAOYSA-N	0	3	338.495	3.343	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H]2C[C@H]2c2cc(F)ccc2F)CC1	ZINC001161904170	1382545675	/nfs/dbraw/zinc/54/56/75/1382545675.db2.gz	HTJHGONLXBGQOI-FUHWJXTLSA-N	0	3	346.421	3.393	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@H]2Cc3c2cccc3Cl)CC1	ZINC001161982512	1382586775	/nfs/dbraw/zinc/58/67/75/1382586775.db2.gz	HKGYUQPBLCJEEH-SFHVURJKSA-N	0	3	342.870	3.141	20	30		EGEDHN
C#CCN1CCC(CNC(=O)[C@@H](CC)CCCCC)(COC)CC1	ZINC001162617281	1382811204	/nfs/dbraw/zinc/81/12/04/1382811204.db2.gz	DWAYRXNDJBCWQE-SFHVURJKSA-N	0	3	336.520	3.071	20	30		EGEDHN
C=CCC[NH2+]CCN(CCc1ccccc1)C(=O)c1ccccc1[O-]	ZINC001162709866	1382843780	/nfs/dbraw/zinc/84/37/80/1382843780.db2.gz	IICAGYYXMDNHCO-UHFFFAOYSA-N	0	3	338.451	3.243	20	30		EGEDHN
C[C@H](N)c1nc2ccccc2n1-c1ncc(C(F)(F)F)cc1C#N	ZINC001162760304	1382861696	/nfs/dbraw/zinc/86/16/96/1382861696.db2.gz	YJNRWESQLCEKLU-VIFPVBQESA-N	0	3	331.301	3.331	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C(F)=C1CCCC1	ZINC001162769614	1382866421	/nfs/dbraw/zinc/86/64/21/1382866421.db2.gz	OJDDKVUDFXUXQX-UHFFFAOYSA-N	0	3	342.458	3.468	20	30		EGEDHN
C[C@@H](N)c1nc2ccccc2n1-c1c(F)c(F)c(C#N)c(F)c1F	ZINC001162778029	1382869691	/nfs/dbraw/zinc/86/96/91/1382869691.db2.gz	XEQHCBCXAUDJRC-SSDOTTSWSA-N	0	3	334.276	3.473	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C[C@@H]1CCC[C@@H]1C	ZINC001162822439	1382886759	/nfs/dbraw/zinc/88/67/59/1382886759.db2.gz	QKKXOVMPGMTWMB-ICSRJNTNSA-N	0	3	326.484	3.107	20	30		EGEDHN
C#CCCCCCC(=O)N(CCNCC#CC)CCc1ccccc1	ZINC001162879518	1382903529	/nfs/dbraw/zinc/90/35/29/1382903529.db2.gz	BDUJEODNZRLLQB-UHFFFAOYSA-N	0	3	338.495	3.254	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)CCCC(C)C	ZINC001162946235	1382923726	/nfs/dbraw/zinc/92/37/26/1382923726.db2.gz	CGEFIOJPCOOVNR-UHFFFAOYSA-N	0	3	328.500	3.497	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C1(C)CC(F)(F)C1	ZINC001162982803	1382936314	/nfs/dbraw/zinc/93/63/14/1382936314.db2.gz	PNMHGEFIPLREDV-UHFFFAOYSA-N	0	3	348.437	3.106	20	30		EGEDHN
C=CCCCC(=O)NCc1ccc(CN2CCN(C(C)C)CC2)cc1	ZINC001163030296	1382952054	/nfs/dbraw/zinc/95/20/54/1382952054.db2.gz	RROCIUFYUBLZFT-UHFFFAOYSA-N	0	3	343.515	3.185	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@@H]1CCCC[C@@H]1C1CC1	ZINC001163173260	1382984511	/nfs/dbraw/zinc/98/45/11/1382984511.db2.gz	WTIMTWNYXDLKOA-HUUCEWRRSA-N	0	3	343.309	3.207	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)C2(C3CCC3)CCC2)c(F)c1	ZINC001163455760	1383055002	/nfs/dbraw/zinc/05/50/02/1383055002.db2.gz	MSCHUHSLCLAZND-UHFFFAOYSA-N	0	3	343.446	3.264	20	30		EGEDHN
CCOC(CCCNc1ccc(/N=C/N(C)C)c(C#N)c1)OCC	ZINC001163490394	1383063158	/nfs/dbraw/zinc/06/31/58/1383063158.db2.gz	IMBJZXRMUWNKBN-KGENOOAVSA-N	0	3	332.448	3.371	20	30		EGEDHN
N#Cc1c[nH]c2ncc(NC(=N)c3ccc(C(F)(F)F)cc3)cc12	ZINC001163683557	1383105455	/nfs/dbraw/zinc/10/54/55/1383105455.db2.gz	FXQYIKXAXZMUPK-UHFFFAOYSA-N	0	3	329.285	3.490	20	30		EGEDHN
CCC[C@@H](C)C(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001163840669	1383127828	/nfs/dbraw/zinc/12/78/28/1383127828.db2.gz	JCUCGEXIPQAJGZ-MRXNPFEDSA-N	0	3	327.472	3.371	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCC1(CNCc2cc(Cl)ccc2F)CC1	ZINC001163853883	1383129774	/nfs/dbraw/zinc/12/97/74/1383129774.db2.gz	GGTNPMNKGWFOSM-GFCCVEGCSA-N	0	3	337.826	3.015	20	30		EGEDHN
C[C@H]1CC[C@H](CC(=O)NCCCNCc2cc(C#N)ccc2F)C1	ZINC001164188065	1383164406	/nfs/dbraw/zinc/16/44/06/1383164406.db2.gz	RAYFFWGQUYXOAL-GJZGRUSLSA-N	0	3	331.435	3.120	20	30		EGEDHN
C[C@H]1CC[C@H](CC(=O)NCCCNCc2ccc(C#N)cc2F)C1	ZINC001164187290	1383164494	/nfs/dbraw/zinc/16/44/94/1383164494.db2.gz	HIBYRZHEOPMAPJ-GJZGRUSLSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCCNCc1cccc(OC)c1Cl	ZINC001164221947	1383167572	/nfs/dbraw/zinc/16/75/72/1383167572.db2.gz	GXMMTVYTUOEEMT-KGLIPLIRSA-N	0	3	338.879	3.403	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCCNCc1ccn(C(CC)CC)n1	ZINC001164223915	1383167898	/nfs/dbraw/zinc/16/78/98/1383167898.db2.gz	XVHCKQOIGGVORS-CVEARBPZSA-N	0	3	334.508	3.298	20	30		EGEDHN
C#CCCCC(=O)NCCC1(CNCc2oc(CCC)nc2C)CC1	ZINC001164297976	1383175529	/nfs/dbraw/zinc/17/55/29/1383175529.db2.gz	YASVTZSVDNXLPL-UHFFFAOYSA-N	0	3	345.487	3.115	20	30		EGEDHN
O=C(C#CC1CC1)NCCC1(CNCc2ccc(F)cc2Cl)CC1	ZINC001164479841	1383190894	/nfs/dbraw/zinc/19/08/94/1383190894.db2.gz	YIXKUWVZUICFKF-UHFFFAOYSA-N	0	3	348.849	3.269	20	30		EGEDHN
CCN1CCC(N(C)C(F)(F)c2ccc(Cl)nc2C#N)CC1	ZINC001165068718	1383221738	/nfs/dbraw/zinc/22/17/38/1383221738.db2.gz	WKYCHXHRUCGZMP-UHFFFAOYSA-N	0	3	328.794	3.072	20	30		EGEDHN
CN1CCC(Oc2ccnc(N(CC#N)Cc3ccccc3)c2)CC1	ZINC001165133712	1383234956	/nfs/dbraw/zinc/23/49/56/1383234956.db2.gz	HGTWEGSJCHLQRE-UHFFFAOYSA-N	0	3	336.439	3.085	20	30		EGEDHN
C[C@H]1CCN(Cc2ccccc2)C[C@H]1N(C)c1ncc(C#N)cc1F	ZINC001165184868	1383243913	/nfs/dbraw/zinc/24/39/13/1383243913.db2.gz	ZNKFXMYGGCKMGD-HNAYVOBHSA-N	0	3	338.430	3.439	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2conc2C(C)C)CC1	ZINC001165472597	1383300081	/nfs/dbraw/zinc/30/00/81/1383300081.db2.gz	NZXADPNGGFRAGV-UHFFFAOYSA-N	0	3	325.840	3.040	20	30		EGEDHN
C=CCCCC(=O)NCCCNCC(=O)Nc1ccc(C(C)C)cc1	ZINC001165535541	1383307868	/nfs/dbraw/zinc/30/78/68/1383307868.db2.gz	OVHVGQYRSYWKFT-UHFFFAOYSA-N	0	3	345.487	3.201	20	30		EGEDHN
C=CCCCC(=O)NCCCNCc1nc2ccc(OC)cc2s1	ZINC001165542794	1383308591	/nfs/dbraw/zinc/30/85/91/1383308591.db2.gz	LMVFDCMAVQCBIV-UHFFFAOYSA-N	0	3	347.484	3.257	20	30		EGEDHN
C=CCCC1(C(=O)NCCCNCc2ccc(C#N)cc2F)CC1	ZINC001165914240	1383364234	/nfs/dbraw/zinc/36/42/34/1383364234.db2.gz	WUMNCINWMOOTJN-UHFFFAOYSA-N	0	3	329.419	3.040	20	30		EGEDHN
C[C@H]1CCC[C@@]1(C)C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001166053461	1383383047	/nfs/dbraw/zinc/38/30/47/1383383047.db2.gz	DDEDVLAXFOQEPC-IFXJQAMLSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCC1(CNCc2ccc(F)cn2)CC1	ZINC001166696028	1383462574	/nfs/dbraw/zinc/46/25/74/1383462574.db2.gz	VQQABUHXHYXPOZ-CABCVRRESA-N	0	3	333.451	3.055	20	30		EGEDHN
C=CCCCC(=O)NCCC1(CNCc2c(C)noc2CC)CC1	ZINC001166910527	1383498593	/nfs/dbraw/zinc/49/85/93/1383498593.db2.gz	XECGVMYWEQZYSR-UHFFFAOYSA-N	0	3	333.476	3.278	20	30		EGEDHN
C=C1CCC(C(=O)NCCC2(CNCc3ocnc3C)CC2)CC1	ZINC001167029799	1383523235	/nfs/dbraw/zinc/52/32/35/1383523235.db2.gz	CPRSHMGVRNBODU-UHFFFAOYSA-N	0	3	331.460	3.106	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCC2(CNCc3c(C)onc3CC)CC2)C1	ZINC001167130193	1383546881	/nfs/dbraw/zinc/54/68/81/1383546881.db2.gz	LKMOGKUNTJGAFA-UHFFFAOYSA-N	0	3	345.487	3.278	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cccc3cc[nH]c32)CC1	ZINC001167299182	1383589541	/nfs/dbraw/zinc/58/95/41/1383589541.db2.gz	NGQOKCHOWJQMKO-UHFFFAOYSA-N	0	3	331.847	3.410	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@H]2CCO[C@H](CCC)C2)CC1	ZINC001167540109	1383660868	/nfs/dbraw/zinc/66/08/68/1383660868.db2.gz	NBLALUVODCNFCW-JKSUJKDBSA-N	0	3	342.911	3.210	20	30		EGEDHN
CC[C@]1(C)C[C@@H]1C(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001167583031	1383679029	/nfs/dbraw/zinc/67/90/29/1383679029.db2.gz	FDCQFEACQVQBHV-UYAOXDASSA-N	0	3	339.483	3.371	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)CCC2(C)CC2)CC1	ZINC001167601466	1383686487	/nfs/dbraw/zinc/68/64/87/1383686487.db2.gz	XZWUNIJVZUQOLC-UHFFFAOYSA-N	0	3	343.309	3.351	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C[C@H]2CCO[C@H](CC)C2)CC1	ZINC001167657985	1383701112	/nfs/dbraw/zinc/70/11/12/1383701112.db2.gz	KFFJWTSUXOUDHD-JKSUJKDBSA-N	0	3	342.911	3.210	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cc(CC(C)C)c[nH]2)CC1	ZINC001167753812	1383731339	/nfs/dbraw/zinc/73/13/39/1383731339.db2.gz	FJJWQRPOHXQWAM-UHFFFAOYSA-N	0	3	337.895	3.455	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1	ZINC001168052828	1383804026	/nfs/dbraw/zinc/80/40/26/1383804026.db2.gz	XTUUXKXLIPIIEO-LSDHHAIUSA-N	0	3	327.255	3.292	20	30		EGEDHN
C=CCOC(=O)N[C@@H]1CCCN([C@@H]2CCc3cc(F)ccc3C2)C1	ZINC001168447666	1383908586	/nfs/dbraw/zinc/90/85/86/1383908586.db2.gz	GEBNTCZHGQXXJO-QZTJIDSGSA-N	0	3	332.419	3.060	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)c1ccccn1	ZINC001168767722	1383996961	/nfs/dbraw/zinc/99/69/61/1383996961.db2.gz	AXJBKAHLHQVPCT-MRXNPFEDSA-N	0	3	336.439	3.032	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)c1cncs1	ZINC001169480753	1384152965	/nfs/dbraw/zinc/15/29/65/1384152965.db2.gz	RSHVLQPKGNVQDV-AWEZNQCLSA-N	0	3	342.468	3.093	20	30		EGEDHN
CCO[C@H](CC)C(=O)N[C@@H](C)CCCCNCc1ccccc1C#N	ZINC001169568666	1384160538	/nfs/dbraw/zinc/16/05/38/1384160538.db2.gz	REVSSDQPYPUDCY-QFBILLFUSA-N	0	3	345.487	3.138	20	30		EGEDHN
C=CC[C@H](Nc1ncc(C2=CCN(CC)CC2)cc1C)C(=O)OC	ZINC001169837231	1384190128	/nfs/dbraw/zinc/19/01/28/1384190128.db2.gz	ZOEBWDCTMNMJRD-KRWDZBQOSA-N	0	3	329.444	3.029	20	30		EGEDHN
CC[C@@H](C)OCC(=O)N[C@H](C)CCCCNCc1ccccc1C#N	ZINC001170233565	1384272302	/nfs/dbraw/zinc/27/23/02/1384272302.db2.gz	SNHHQXVVQGUZJS-IAGOWNOFSA-N	0	3	345.487	3.138	20	30		EGEDHN
N#CC1(c2ccccc2)CCC(N2CCN(c3ccncn3)CC2)CC1	ZINC001170396310	1384306943	/nfs/dbraw/zinc/30/69/43/1384306943.db2.gz	XGOSLGAZFXGWND-UHFFFAOYSA-N	0	3	347.466	3.003	20	30		EGEDHN
C#CCCCC(=O)N[C@H](C)CCCCNCc1ccccc1C#N	ZINC001170425386	1384315605	/nfs/dbraw/zinc/31/56/05/1384315605.db2.gz	MXTQJVGHWQFTGQ-QGZVFWFLSA-N	0	3	325.456	3.126	20	30		EGEDHN
CC(C)[Si](C#CN[C@]1(C)CCS(=O)(=O)C1)(C(C)C)C(C)C	ZINC001170555058	1384341442	/nfs/dbraw/zinc/34/14/42/1384341442.db2.gz	DOXKGKVBEWMLPJ-MRXNPFEDSA-N	0	3	329.582	3.332	20	30		EGEDHN
CCCc1nc(CNCCCC[C@H](C)NC(=O)C#CC2CC2)cs1	ZINC001170674125	1384361992	/nfs/dbraw/zinc/36/19/92/1384361992.db2.gz	MVHIYTFRRCJEFU-HNNXBMFYSA-N	0	3	347.528	3.274	20	30		EGEDHN
CC(C)n1ccc(CNCCCC[C@H](C)NC(=O)C#CC(C)(C)C)n1	ZINC001170694226	1384367365	/nfs/dbraw/zinc/36/73/65/1384367365.db2.gz	VPKKLRIXXSGLOP-KRWDZBQOSA-N	0	3	346.519	3.278	20	30		EGEDHN
C[C@H](CCCCNCc1cc(F)ccc1C#N)NC(=O)C1(C)CC1	ZINC001170923980	1384412279	/nfs/dbraw/zinc/41/22/79/1384412279.db2.gz	VPVPBKKQCVGUEP-CQSZACIVSA-N	0	3	331.435	3.262	20	30		EGEDHN
C=C[C@@H]1C[C@@]1(Nc1ccc([C@H]2CCCCN2C)cn1)C(=O)OCC	ZINC001170924713	1384412356	/nfs/dbraw/zinc/41/23/56/1384412356.db2.gz	PMFXBZYMHQWIDZ-MDZRGWNJSA-N	0	3	329.444	3.158	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H](C)CCCCN[C@H](C)c1nnc(C)[nH]1	ZINC001170963531	1384419226	/nfs/dbraw/zinc/41/92/26/1384419226.db2.gz	QCDQORHPZMCBAB-LSDHHAIUSA-N	0	3	347.507	3.207	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@@H](F)CCCCCC	ZINC001171153598	1384456684	/nfs/dbraw/zinc/45/66/84/1384456684.db2.gz	ULPIVPYGYSJYOX-ZDUSSCGKSA-N	0	3	337.277	3.299	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H](C)CCCCNCc1cnc(C)o1	ZINC001171260198	1384480907	/nfs/dbraw/zinc/48/09/07/1384480907.db2.gz	FMKWAJNYTGSRHG-HNNXBMFYSA-N	0	3	344.459	3.049	20	30		EGEDHN
C[C@@H](C(=O)NCCCNCc1cc(C#N)ccc1F)c1ccccc1	ZINC001171651300	1384592465	/nfs/dbraw/zinc/59/24/65/1384592465.db2.gz	IEVOSZRXQOIOJC-OAHLLOKOSA-N	0	3	339.414	3.097	20	30		EGEDHN
CC[C@H](C)[C@H]([NH2+][C@@H](C)Cc1ccc(C(F)(F)F)cc1)C(=O)N[O-]	ZINC001171966582	1384698288	/nfs/dbraw/zinc/69/82/88/1384698288.db2.gz	VZWYWAIMPSGHQW-MJVIPROJSA-N	0	3	332.366	3.146	20	30		EGEDHN
C=CCOC[C@@H]1c2c(ncn2C)CCN1C1CCC(OCC=C)CC1	ZINC001173321259	1384957950	/nfs/dbraw/zinc/95/79/50/1384957950.db2.gz	ZHTBPJFZEFQPMP-FAFZWHIHSA-N	0	3	345.487	3.036	20	30		EGEDHN
N#Cc1ccc(CNC2CCN(C(=O)c3ccc(Cl)cc3)CC2)o1	ZINC001173413231	1384967918	/nfs/dbraw/zinc/96/79/18/1384967918.db2.gz	JTKZKVLNTPXVPJ-UHFFFAOYSA-N	0	3	343.814	3.199	20	30		EGEDHN
C=CCO[C@H]1CO[C@]2(C1)CCCN(C1Cc3cc(F)c(F)cc3C1)C2	ZINC001173482338	1384978744	/nfs/dbraw/zinc/97/87/44/1384978744.db2.gz	IAVVDFGANMYXFU-XLIONFOSSA-N	0	3	349.421	3.258	20	30		EGEDHN
CC(C)(C)OC(=O)[C@H]1CCCCN1CNC1CCC(C)(C#N)CC1	ZINC001173590239	1384982289	/nfs/dbraw/zinc/98/22/89/1384982289.db2.gz	AGUIOWLLHYLZFV-KOHRHEQBSA-N	0	3	335.492	3.202	20	30		EGEDHN
CC[C@H](C)[C@H]([NH2+]C1CCC2(CCc3ccccc32)CC1)C(=O)N[O-]	ZINC001173685460	1385004034	/nfs/dbraw/zinc/00/40/34/1385004034.db2.gz	BDCVSJLHGZMMPU-NMDZEQAHSA-N	0	3	330.472	3.323	20	30		EGEDHN
CC[C@H](CC#N)NC1CCN(C(=O)c2ccc(F)c(Cl)c2)CC1	ZINC001173773564	1385015052	/nfs/dbraw/zinc/01/50/52/1385015052.db2.gz	JVNUXQBPQGENAU-CYBMUJFWSA-N	0	3	337.826	3.366	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)c1cccc(C)c1	ZINC001317391198	1385110713	/nfs/dbraw/zinc/11/07/13/1385110713.db2.gz	PFVUPGRGQOEEAE-CYBMUJFWSA-N	0	3	325.250	3.002	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](C)CCCCNCc1nccn1CC	ZINC001174649924	1385130336	/nfs/dbraw/zinc/13/03/36/1385130336.db2.gz	LMUOUSWQGXZLIS-INIZCTEOSA-N	0	3	334.508	3.270	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H](C)CCCCNCc1cn(C(C)C)nn1	ZINC001174849184	1385159867	/nfs/dbraw/zinc/15/98/67/1385159867.db2.gz	KOJAKSRFUPJRNG-IRXDYDNUSA-N	0	3	349.523	3.226	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@H](C)CCCCNCc1cc(C)n(C)n1	ZINC001174850157	1385160133	/nfs/dbraw/zinc/16/01/33/1385160133.db2.gz	UYLRVESECZGPDY-WBVHZDCISA-N	0	3	334.508	3.095	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H](C)CCCCN[C@@H](C)c2nnc(CC)[nH]2)C1	ZINC001175158988	1385208087	/nfs/dbraw/zinc/20/80/87/1385208087.db2.gz	MLLXVZKFTBYQFM-GJZGRUSLSA-N	0	3	347.507	3.049	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)C[C@H](C)c1ccccc1	ZINC001175317998	1385250828	/nfs/dbraw/zinc/25/08/28/1385250828.db2.gz	UDPYKOAVFKNNRG-ZDUSSCGKSA-N	0	3	339.277	3.185	20	30		EGEDHN
N#Cc1cc(N)c(NC2=CCN(Cc3ccccc3)CC2)cc1C#N	ZINC001175506763	1385315355	/nfs/dbraw/zinc/31/53/55/1385315355.db2.gz	LYDJHRYYLFXAIZ-UHFFFAOYSA-N	0	3	329.407	3.214	20	30		EGEDHN
Cc1c[nH]cc1C(=O)N[C@H](C)CCCCNCc1ccccc1C#N	ZINC001176563538	1385626502	/nfs/dbraw/zinc/62/65/02/1385626502.db2.gz	FRBISPDWZJPMOY-MRXNPFEDSA-N	0	3	338.455	3.273	20	30		EGEDHN
CCCCCCCC[C@@H](C)C(=O)NCCCNCc1nccn1C	ZINC001176706674	1385666532	/nfs/dbraw/zinc/66/65/32/1385666532.db2.gz	KNTFFDQBWNHKOW-QGZVFWFLSA-N	0	3	336.524	3.403	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)c1c[nH]c(C#N)c1	ZINC001177290519	1385899484	/nfs/dbraw/zinc/89/94/84/1385899484.db2.gz	FIDPRZBPLAXNDE-UHFFFAOYSA-N	0	3	348.878	3.251	20	30		EGEDHN
C=C[C@@](C)(O)CC(=O)N(CCCNCC(=C)Cl)CC1CCCC1	ZINC001177311430	1385908725	/nfs/dbraw/zinc/90/87/25/1385908725.db2.gz	FCXRBMXEQPFOMV-GOSISDBHSA-N	0	3	342.911	3.065	20	30		EGEDHN
CC(C)(C)n1cc(C#N)cc1NC(=O)C(C#N)Cc1cccs1	ZINC001177903105	1386078527	/nfs/dbraw/zinc/07/85/27/1386078527.db2.gz	FBUHKHIGHOSXIR-CYBMUJFWSA-N	0	3	326.425	3.497	20	30		EGEDHN
N#Cc1cc(C(=O)NCCCCCCNC/C(Cl)=C\Cl)c[nH]1	ZINC001178257982	1386175131	/nfs/dbraw/zinc/17/51/31/1386175131.db2.gz	RCKGWWHZWFOYND-MDWZMJQESA-N	0	3	343.258	3.085	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@@H]1C	ZINC001178375235	1386200040	/nfs/dbraw/zinc/20/00/40/1386200040.db2.gz	JMMAPZMHMUEVJK-GJYPPUQNSA-N	0	3	330.447	3.192	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2cccc(Cl)c2)CCN1C(=O)/C=C/C1CC1	ZINC001178432364	1386215240	/nfs/dbraw/zinc/21/52/40/1386215240.db2.gz	ZBWTVSHQKPXJFM-JJDZQTOISA-N	0	3	342.870	3.237	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](NCc2cccc(Cl)c2F)[C@@H]1C	ZINC001178599827	1386259441	/nfs/dbraw/zinc/25/94/41/1386259441.db2.gz	KYYXWYSUDBZGRA-BBRMVZONSA-N	0	3	336.838	3.362	20	30		EGEDHN
COc1cccc(CN[C@H]2CCN(C(=O)C#CC(C)C)[C@H]2C)c1Cl	ZINC001178652732	1386270022	/nfs/dbraw/zinc/27/00/22/1386270022.db2.gz	AOONXSYZMQGNKJ-HOCLYGCPSA-N	0	3	348.874	3.087	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)[C@H]2Cc3cccc(C)c3O2)CCCC1	ZINC001698637340	1406283974	/nfs/dbraw/zinc/28/39/74/1406283974.db2.gz	BISNMANQCGOJFM-MRXNPFEDSA-N	0	3	348.874	3.070	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](NCc2ccnc(Cl)c2)[C@@H]1C	ZINC001178791638	1386305473	/nfs/dbraw/zinc/30/54/73/1386305473.db2.gz	MHZKHLACZOIDGD-ZFWWWQNUSA-N	0	3	335.879	3.416	20	30		EGEDHN
CC(C)[C@H](CNC(=O)C1(F)CCCC1)NCc1cc(C#N)ccc1F	ZINC001319921212	1386392788	/nfs/dbraw/zinc/39/27/88/1386392788.db2.gz	DYPVERNHMCMCOA-KRWDZBQOSA-N	0	3	349.425	3.210	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccc(Cl)cc2)CCN1C(=O)CC1(C)CC1	ZINC001179165557	1386415638	/nfs/dbraw/zinc/41/56/38/1386415638.db2.gz	YSSZMGGCOOLWMR-YJBOKZPZSA-N	0	3	344.886	3.461	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](NCc2cccc(Cl)n2)[C@@H]1C	ZINC001179364645	1386463861	/nfs/dbraw/zinc/46/38/61/1386463861.db2.gz	OMRWNWGIHPTYEL-DZKIICNBSA-N	0	3	335.879	3.416	20	30		EGEDHN
C[C@H]1[C@@H](NCc2ccc(C#N)c(F)c2)CCN1C(=O)CCCC1CC1	ZINC001179369796	1386465336	/nfs/dbraw/zinc/46/53/36/1386465336.db2.gz	IIMZCXJFVDNDIE-LIRRHRJNSA-N	0	3	343.446	3.357	20	30		EGEDHN
C=CCCCC(=O)NCCCCCCNCc1nnc(C)n1CCC	ZINC001179421649	1386479693	/nfs/dbraw/zinc/47/96/93/1386479693.db2.gz	MMBVEBASFSEMMI-UHFFFAOYSA-N	0	3	349.523	3.119	20	30		EGEDHN
N#Cc1ccccc1CNCCCCCCNC(=O)c1nccs1	ZINC001179887291	1386619221	/nfs/dbraw/zinc/61/92/21/1386619221.db2.gz	QJPLGJXIWJZYCF-UHFFFAOYSA-N	0	3	342.468	3.095	20	30		EGEDHN
C[C@H](C#N)C(=O)Nc1ccc(N2CCN(Cc3ccccc3)CC2)cc1	ZINC001179896901	1386621716	/nfs/dbraw/zinc/62/17/16/1386621716.db2.gz	RQGJNWGDSGLQOP-QGZVFWFLSA-N	0	3	348.450	3.107	20	30		EGEDHN
N#CCCN(C(=O)CN1CC[C@H]2CCCC[C@H]2C1)c1ccccc1	ZINC001321718893	1386965102	/nfs/dbraw/zinc/96/51/02/1386965102.db2.gz	WOFNHDWRBXHBGH-MSOLQXFVSA-N	0	3	325.456	3.445	20	30		EGEDHN
C[C@H](CN(C)Cc1cccc(C#N)c1)NC(=O)CCc1ccsc1	ZINC001322178684	1387089438	/nfs/dbraw/zinc/08/94/38/1387089438.db2.gz	YSVKWKVBVHDCFM-OAHLLOKOSA-N	0	3	341.480	3.189	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H](C)[C@](C)(CNCc2cc(C)no2)C1	ZINC001182517725	1387181130	/nfs/dbraw/zinc/18/11/30/1387181130.db2.gz	WJGLITSWQNOZLE-MDASCCDHSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2cc(C)no2)C1	ZINC001182750617	1387218556	/nfs/dbraw/zinc/21/85/56/1387218556.db2.gz	OWBRWQJKEHGVQC-AUUYWEPGSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CC[C@@H](NCc2cc(C)ccc2F)C1)OCC	ZINC001182973815	1387252208	/nfs/dbraw/zinc/25/22/08/1387252208.db2.gz	SSEQFJQMIXVFQE-IEBWSBKVSA-N	0	3	348.462	3.196	20	30		EGEDHN
C=C[C@H](COC)N[C@@H]1CCc2ccc(I)cc21	ZINC001330316885	1389386286	/nfs/dbraw/zinc/38/62/86/1389386286.db2.gz	UOCFWWQLSSMSCS-TZMCWYRMSA-N	0	3	343.208	3.069	20	30		EGEDHN
C=CCN1CCC(NC(=O)COc2ccc(Cl)c(CC)c2)CC1	ZINC001338653339	1389723286	/nfs/dbraw/zinc/72/32/86/1389723286.db2.gz	KFHKSROUBZTUKP-UHFFFAOYSA-N	0	3	336.863	3.048	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccc(C#N)cc2F)C1	ZINC001338804845	1389772453	/nfs/dbraw/zinc/77/24/53/1389772453.db2.gz	MBAGLLMKLRYZSI-RHSMWYFYSA-N	0	3	337.398	3.263	20	30		EGEDHN
Cc1sccc1CC(=O)NC[C@H](C)CNCc1ccccc1C#N	ZINC001698764983	1406420488	/nfs/dbraw/zinc/42/04/88/1406420488.db2.gz	GLULAXMHGRTKGE-CQSZACIVSA-N	0	3	341.480	3.013	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc(Oc2ccc(C)nn2)cc1	ZINC001340726026	1390354402	/nfs/dbraw/zinc/35/44/02/1390354402.db2.gz	JSYSMIBZSVYKIO-INIZCTEOSA-N	0	3	326.400	3.199	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC001334162630	1390491914	/nfs/dbraw/zinc/49/19/14/1390491914.db2.gz	SXSMLSGTGNTCJW-IBGZPJMESA-N	0	3	343.515	3.307	20	30		EGEDHN
C[C@H](C(=O)C(C#N)C(=O)NC1CCCCC1)c1ccc(F)c(F)c1	ZINC001342580680	1390628826	/nfs/dbraw/zinc/62/88/26/1390628826.db2.gz	UAEITAWLPJYDAB-FZMZJTMJSA-N	0	3	334.366	3.226	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CCCN(C)C2)nnc1N1CCCCCCC1	ZINC001343007179	1390683299	/nfs/dbraw/zinc/68/32/99/1390683299.db2.gz	KFTZVDMVLQGGEI-KRWDZBQOSA-N	0	3	331.508	3.434	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N1CCC[C@@H]1c1cccc(Cl)c1	ZINC001344551277	1390799119	/nfs/dbraw/zinc/79/91/19/1390799119.db2.gz	DWPRAIRPUFBDEO-QGZVFWFLSA-N	0	3	333.863	3.142	20	30		EGEDHN
CC[C@@H](C)N1CCN(c2nnc(C(C)(C)CC#N)n2CC(C)C)CC1	ZINC001344927225	1390825189	/nfs/dbraw/zinc/82/51/89/1390825189.db2.gz	XYAIXRRDCWHVQQ-MRXNPFEDSA-N	0	3	346.523	3.046	20	30		EGEDHN
N#CC(C(=O)CCOCC(F)F)c1nc2c(cccc2Cl)[nH]1	ZINC001344930881	1390825600	/nfs/dbraw/zinc/82/56/00/1390825600.db2.gz	PXCDXNVVFSQQHO-MRVPVSSYSA-N	0	3	327.718	3.064	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN[C@@H](c2ccccc2)[C@H]2CCCO2)c1	ZINC001345606403	1390868204	/nfs/dbraw/zinc/86/82/04/1390868204.db2.gz	PIISLZZJQFUNGB-CTNGQTDRSA-N	0	3	349.434	3.397	20	30		EGEDHN
CCc1c(C(=O)C(C#N)c2ncc(Cl)n2C)cnn1C(C)(C)C	ZINC001345643241	1390871497	/nfs/dbraw/zinc/87/14/97/1390871497.db2.gz	OIHMDQUXUPDNSB-JTQLQIEISA-N	0	3	333.823	3.077	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCc1ccccc1Br	ZINC001346095604	1390907074	/nfs/dbraw/zinc/90/70/74/1390907074.db2.gz	HIFRRSNAJXHEPS-ZDUSSCGKSA-N	0	3	346.228	3.475	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)C[C@@H](C)Cc1ccccc1OC	ZINC001346096516	1390907359	/nfs/dbraw/zinc/90/73/59/1390907359.db2.gz	QVLQYHNRGNNKAZ-HOCLYGCPSA-N	0	3	325.412	3.357	20	30		EGEDHN
C[C@H](NC[C@H](O)COc1ccccc1C#N)c1ccc(Cl)c(F)c1	ZINC001348423523	1391216920	/nfs/dbraw/zinc/21/69/20/1391216920.db2.gz	TXWGTLGAJAQUAB-WFASDCNBSA-N	0	3	348.805	3.441	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)CCC2CCCC2)C1	ZINC001488810818	1391727681	/nfs/dbraw/zinc/72/76/81/1391727681.db2.gz	YUEITLBKJIMFMM-SHTZXODSSA-N	0	3	343.309	3.350	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)N1CC(C)(C)[C@H]1c1nccn1C	ZINC001354355504	1392139778	/nfs/dbraw/zinc/13/97/78/1392139778.db2.gz	AEKWNAJXRYSZIM-HZPDHXFCSA-N	0	3	334.508	3.408	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)N(C)C(=O)C1CC2(CCC2)C1	ZINC001698851753	1406555627	/nfs/dbraw/zinc/55/56/27/1406555627.db2.gz	JOAFMKSILAELFG-ZDUSSCGKSA-N	0	3	331.485	3.137	20	30		EGEDHN
C=CCCCN1CCC[C@@H](NC(=O)c2ccc(-c3cc[nH]n3)s2)C1	ZINC001479905692	1392473081	/nfs/dbraw/zinc/47/30/81/1392473081.db2.gz	URWZPEYXMMWDEY-CQSZACIVSA-N	0	3	344.484	3.299	20	30		EGEDHN
CCN(CCNC(=O)c1cc(C)c(C)o1)Cc1cccc(C#N)c1	ZINC001480970124	1393056929	/nfs/dbraw/zinc/05/69/29/1393056929.db2.gz	ZOLXVKRQEBLDRT-UHFFFAOYSA-N	0	3	325.412	3.020	20	30		EGEDHN
CCCN(CCNC(=O)[C@H](C)C1CC1)Cc1ccc(F)c(C#N)c1	ZINC001481133293	1393129203	/nfs/dbraw/zinc/12/92/03/1393129203.db2.gz	QUCOGUQJEOKCSR-CQSZACIVSA-N	0	3	331.435	3.072	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCN(Cc1ccc(C(C)(C)C)cc1)C1CC1	ZINC001481162237	1393139090	/nfs/dbraw/zinc/13/90/90/1393139090.db2.gz	GRQOCPZNNMVPKE-OAHLLOKOSA-N	0	3	327.472	3.224	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)CCCOc2cccc(C)c2)C1	ZINC001481538651	1394400166	/nfs/dbraw/zinc/40/01/66/1394400166.db2.gz	JTORMEGLZKQTEF-SFHVURJKSA-N	0	3	330.472	3.311	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1oc(CCC)nc1C)C1CC1	ZINC001481947612	1394612870	/nfs/dbraw/zinc/61/28/70/1394612870.db2.gz	VJJNJDZHKBDXRS-KRWDZBQOSA-N	0	3	339.867	3.176	20	30		EGEDHN
C[C@H](C#N)C(=O)NCC1(N[C@H](C)c2ccc(F)cc2F)CCCC1	ZINC001482213655	1394806772	/nfs/dbraw/zinc/80/67/72/1394806772.db2.gz	UTTOUGAKRJCUBQ-CHWSQXEVSA-N	0	3	335.398	3.204	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)[C@@H](C)CCC)CCCC1	ZINC001482213181	1394807438	/nfs/dbraw/zinc/80/74/38/1394807438.db2.gz	FQDKHIFMRBYYEM-LBPRGKRZSA-N	0	3	331.298	3.350	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)Cc1ccc(C)c(OC)c1)C(C)C	ZINC001698966961	1406726413	/nfs/dbraw/zinc/72/64/13/1406726413.db2.gz	ZZGHUOIMDXDCJM-INIZCTEOSA-N	0	3	338.879	3.029	20	30		EGEDHN
C=C(Cl)CN(CC1CC1)C1CCN(C(=O)c2ocnc2C)CC1	ZINC001483816128	1395101483	/nfs/dbraw/zinc/10/14/83/1395101483.db2.gz	PICIRJZHDMCNQB-UHFFFAOYSA-N	0	3	337.851	3.052	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cc(C(F)(F)F)ccn1)C(C)C	ZINC001698977578	1406749186	/nfs/dbraw/zinc/74/91/86/1406749186.db2.gz	KNBCXOLQZFPVBO-ZDUSSCGKSA-N	0	3	349.784	3.197	20	30		EGEDHN
C[C@@H](C(=O)NCC1(NCc2ccc(C#N)s2)CCC1)c1ccco1	ZINC001484650928	1395462659	/nfs/dbraw/zinc/46/26/59/1395462659.db2.gz	KCDBDEWTEZOBTA-CYBMUJFWSA-N	0	3	343.452	3.145	20	30		EGEDHN
CCC(=O)NCc1ccc(CNCc2ccc(F)c(C#N)c2)cc1	ZINC001495482018	1396536991	/nfs/dbraw/zinc/53/69/91/1396536991.db2.gz	WYGPDRZOGZNPFB-UHFFFAOYSA-N	0	3	325.387	3.013	20	30		EGEDHN
C=C(Br)CN[C@@H](CNC(=O)C1CCCCC1)C(C)C	ZINC001496523635	1396713593	/nfs/dbraw/zinc/71/35/93/1396713593.db2.gz	VUXNDLDMWYCMPN-AWEZNQCLSA-N	0	3	331.298	3.206	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)NC(=O)c1sccc1C1CC1	ZINC001497978698	1396900824	/nfs/dbraw/zinc/90/08/24/1396900824.db2.gz	MNFZYBKQQVSWOI-LLVKDONJSA-N	0	3	345.493	3.467	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CCN(CCCOc2ccccc2C)C1	ZINC001690093019	1404295519	/nfs/dbraw/zinc/29/55/19/1404295519.db2.gz	GNQUMEZLBJYYAD-GOSISDBHSA-N	0	3	330.472	3.311	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)c1cc(C)cs1	ZINC001690841063	1404771850	/nfs/dbraw/zinc/77/18/50/1404771850.db2.gz	DQLPMIJAVKXNMB-LLVKDONJSA-N	0	3	331.279	3.063	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC[C@H](C)NCc2cnc(Cl)s2)C1	ZINC001690862635	1404783053	/nfs/dbraw/zinc/78/30/53/1404783053.db2.gz	JUSSLWLLFHWTJI-NSHDSACASA-N	0	3	327.881	3.137	20	30		EGEDHN
C[C@H](C(=O)NC[C@H]1CCN(Cc2cccc(C#N)c2)C1)c1ccccc1	ZINC001691166692	1405102078	/nfs/dbraw/zinc/10/20/78/1405102078.db2.gz	YHTCCOJRZJYBSI-FXAWDEMLSA-N	0	3	347.462	3.300	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)C[C@H]2CCc3ccccc32)C1	ZINC001691529710	1405324091	/nfs/dbraw/zinc/32/40/91/1405324091.db2.gz	CSFNHHZDNFIAML-DJIMGWMZSA-N	0	3	332.875	3.343	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)C(C)(C)C2CCC2)C1	ZINC001691727508	1405451438	/nfs/dbraw/zinc/45/14/38/1405451438.db2.gz	JQWDAQRWZFLDMJ-XBXGTLAGSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C(Cl)CN(C)CC1CCN(C(=O)c2cccc3c[nH]nc32)CC1	ZINC001732085828	1428346017	/nfs/dbraw/zinc/34/60/17/1428346017.db2.gz	BJAAQODIQALDSD-UHFFFAOYSA-N	0	3	346.862	3.099	20	30		EGEDHN
CC(C)c1occc1C(=O)NC[C@@H](C)CNCc1ccccc1C#N	ZINC001732371758	1428552860	/nfs/dbraw/zinc/55/28/60/1428552860.db2.gz	FNMZWQUTHKFTMC-HNNXBMFYSA-N	0	3	339.439	3.430	20	30		EGEDHN
CCCC(C)(C)C(=O)N(C)[C@H](C)CNCc1cc(C#N)ccc1OC	ZINC001732436092	1428580033	/nfs/dbraw/zinc/58/00/33/1428580033.db2.gz	GEDCHPKZJIOXQX-OAHLLOKOSA-N	0	3	345.487	3.330	20	30		EGEDHN
C=C(Br)CNC[C@H]1[C@H](C)CCCN1C(=O)CCCC	ZINC001732535436	1428655888	/nfs/dbraw/zinc/65/58/88/1428655888.db2.gz	XODSIMWMYZMIKS-OCCSQVGLSA-N	0	3	331.298	3.302	20	30		EGEDHN
C[C@H](CN(C)Cc1cccc(C#N)c1)NC(=O)[C@@H](C)c1ccccc1	ZINC001699468542	1412842701	/nfs/dbraw/zinc/84/27/01/1412842701.db2.gz	WHVADFACBDMAGW-SJORKVTESA-N	0	3	335.451	3.298	20	30		EGEDHN
N#Cc1cccc(CNC2(CNC(=O)c3cc(Cl)cs3)CC2)c1	ZINC001699664596	1413050062	/nfs/dbraw/zinc/05/00/62/1413050062.db2.gz	MSJGFYOUXWMWMR-UHFFFAOYSA-N	0	3	345.855	3.325	20	30		EGEDHN
C[C@H](CC(=O)NCC1(NCc2ccc(C#N)cc2)CC1)c1ccco1	ZINC001699669338	1413058518	/nfs/dbraw/zinc/05/85/18/1413058518.db2.gz	BTUHZIWFVUFOSY-OAHLLOKOSA-N	0	3	337.423	3.083	20	30		EGEDHN
N#Cc1cccc(CNC2(CNC(=O)c3cc4ccccc4o3)CC2)c1	ZINC001699671635	1413061750	/nfs/dbraw/zinc/06/17/50/1413061750.db2.gz	KRYANZLRYFDEGX-UHFFFAOYSA-N	0	3	345.402	3.357	20	30		EGEDHN
C[C@@]1(CNC(=O)C2CCCC2)CCCN(Cc2cccc(C#N)c2)C1	ZINC001699866466	1413304321	/nfs/dbraw/zinc/30/43/21/1413304321.db2.gz	AESCSIUKJGRQFQ-NRFANRHFSA-N	0	3	339.483	3.467	20	30		EGEDHN
CCC(C)(C)C(=O)N[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC001700181065	1413594591	/nfs/dbraw/zinc/59/45/91/1413594591.db2.gz	NJVQXXLKGPPOTA-GOSISDBHSA-N	0	3	327.472	3.465	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1cnn2ccc(C)cc12	ZINC001700442093	1414014404	/nfs/dbraw/zinc/01/44/04/1414014404.db2.gz	LYELNWOJWWVHGF-UHFFFAOYSA-N	0	3	348.878	3.083	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1coc(CCC)n1	ZINC001700447767	1414026926	/nfs/dbraw/zinc/02/69/26/1414026926.db2.gz	LVQCDQULKPUPQJ-UHFFFAOYSA-N	0	3	327.856	3.067	20	30		EGEDHN
CCCc1occc1C(=O)NC[C@@H](C)N(C)Cc1ccc(C#N)cc1	ZINC001700482689	1414122710	/nfs/dbraw/zinc/12/27/10/1414122710.db2.gz	CRCNLIJQLUEEKR-OAHLLOKOSA-N	0	3	339.439	3.354	20	30		EGEDHN
C[C@@H](CN(C)C(=O)C1CC2(CCC2)C1)NCc1ccc(F)c(C#N)c1	ZINC001700764718	1414438412	/nfs/dbraw/zinc/43/84/12/1414438412.db2.gz	JFLLJRBXLRUWAA-AWEZNQCLSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2ccc(F)c(C#N)c2)CN1C(=O)CCCC1CC1	ZINC001700841001	1414491629	/nfs/dbraw/zinc/49/16/29/1414491629.db2.gz	KNBZAIYVRQIOSX-KDOFPFPSSA-N	0	3	343.446	3.357	20	30		EGEDHN
C=C(Br)CNC[C@@H](NC(=O)[C@H]1CC1(C)C)C(C)(C)C	ZINC001700988929	1414632450	/nfs/dbraw/zinc/63/24/50/1414632450.db2.gz	DVEHABLQSCVAST-VXGBXAGGSA-N	0	3	331.298	3.062	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@H](C)Cc2ccccc2F)C1	ZINC001707090402	1417196703	/nfs/dbraw/zinc/19/67/03/1417196703.db2.gz	MKZBTXOVANHBOY-XNRPHZJLSA-N	0	3	338.854	3.241	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H](CNC(=O)CCCC3CC3)C2)cc1	ZINC001713217423	1417796161	/nfs/dbraw/zinc/79/61/61/1417796161.db2.gz	BVIZIKHOUAOBLU-FQEVSTJZSA-N	0	3	339.483	3.467	20	30		EGEDHN
C[C@H](CNC(=O)C(C1CCC1)C1CCC1)NCc1ccc(C#N)s1	ZINC001713331434	1417955366	/nfs/dbraw/zinc/95/53/66/1417955366.db2.gz	BARSEAZNGKWWFW-CYBMUJFWSA-N	0	3	345.512	3.430	20	30		EGEDHN
CCN(CCNC(=O)C1(C(F)F)CCCC1)Cc1cccc(C#N)c1	ZINC001713490544	1418188938	/nfs/dbraw/zinc/18/89/38/1418188938.db2.gz	IWRQJJHIKORVAC-UHFFFAOYSA-N	0	3	349.425	3.322	20	30		EGEDHN
CCCN(CCNC(=O)c1cc(C)c(C)o1)Cc1cccc(C#N)c1	ZINC001713545332	1418313044	/nfs/dbraw/zinc/31/30/44/1418313044.db2.gz	WWSXHBINKHINLK-UHFFFAOYSA-N	0	3	339.439	3.410	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1ccc(OC)cc1C)C1CC1	ZINC001714170799	1418978973	/nfs/dbraw/zinc/97/89/73/1418978973.db2.gz	YEKBTTBOKDUEIR-SFHVURJKSA-N	0	3	336.863	3.244	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1cc2nc(C)ccc2o1)C1CC1	ZINC001714175249	1418982560	/nfs/dbraw/zinc/98/25/60/1418982560.db2.gz	ZWPHRHPQBZNELR-GOSISDBHSA-N	0	3	347.846	3.377	20	30		EGEDHN
Cc1cc(F)c(C(=O)NC[C@@H](C)NCc2ccc(C#N)s2)cc1F	ZINC001714245150	1419032266	/nfs/dbraw/zinc/03/22/66/1419032266.db2.gz	DYXYLBGXVCBKSZ-LLVKDONJSA-N	0	3	349.406	3.115	20	30		EGEDHN
CCCN(CCNC(=O)C1CC(C)(C)C1)Cc1ccc(F)c(C#N)c1	ZINC001714651620	1419429295	/nfs/dbraw/zinc/42/92/95/1419429295.db2.gz	BJLQQZNHFVJSKB-UHFFFAOYSA-N	0	3	345.462	3.462	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)CCc1ccc(F)cc1)C1CC1	ZINC001715120652	1419865690	/nfs/dbraw/zinc/86/56/90/1419865690.db2.gz	WTAJETNBFFDROA-SFHVURJKSA-N	0	3	338.854	3.385	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1cnc2ccccc2c1)C1CC1	ZINC001715122022	1419867470	/nfs/dbraw/zinc/86/74/70/1419867470.db2.gz	WZQDJJMIFLZGBS-IBGZPJMESA-N	0	3	343.858	3.475	20	30		EGEDHN
C[C@H]1CCCN(C(=O)CCCF)[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001715475166	1420154453	/nfs/dbraw/zinc/15/44/53/1420154453.db2.gz	OEGAOMIUQMZKBR-KBXCAEBGSA-N	0	3	349.425	3.164	20	30		EGEDHN
CC(C)[C@H](CNC(=O)C1(C)CCC1)NCc1ccc(C#N)cc1F	ZINC001715499277	1420181768	/nfs/dbraw/zinc/18/17/68/1420181768.db2.gz	AOXYHXLPGRYFAP-KRWDZBQOSA-N	0	3	331.435	3.118	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@H](NCc2ccc(C#N)cc2F)C(C)C)o1	ZINC001715518108	1420203945	/nfs/dbraw/zinc/20/39/45/1420203945.db2.gz	VITBWHPUNGSNCF-KRWDZBQOSA-N	0	3	343.402	3.143	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1oc(CCC)nc1C)C(C)C	ZINC001715690429	1420296453	/nfs/dbraw/zinc/29/64/53/1420296453.db2.gz	JMSVNOFWWXSUQU-CYBMUJFWSA-N	0	3	327.856	3.032	20	30		EGEDHN
N#Cc1cc(CNC2(CNC(=O)C34CCC(CC3)C4)CC2)ccc1F	ZINC001716686094	1420839461	/nfs/dbraw/zinc/83/94/61/1420839461.db2.gz	XLBUJEVVOBABPM-UHFFFAOYSA-N	0	3	341.430	3.016	20	30		EGEDHN
C=C(Cl)CN(CC1CC1)C1CCN(C(=O)C(C)(C)COC)CC1	ZINC001733276424	1429441064	/nfs/dbraw/zinc/44/10/64/1429441064.db2.gz	FAGHJXGDLUYPKT-UHFFFAOYSA-N	0	3	342.911	3.115	20	30		EGEDHN
CC1(CNC(=O)c2ccoc2)CCN(Cc2cccc(C#N)c2)CC1	ZINC001716881789	1421005740	/nfs/dbraw/zinc/00/57/40/1421005740.db2.gz	IPRLMIDEHJQCQL-UHFFFAOYSA-N	0	3	337.423	3.183	20	30		EGEDHN
C[C@]1(CNC(=O)c2ccoc2)CCCN(Cc2ccc(C#N)cc2)C1	ZINC001716891955	1421017211	/nfs/dbraw/zinc/01/72/11/1421017211.db2.gz	RTISBTLNTFTNHU-HXUWFJFHSA-N	0	3	337.423	3.183	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)C3C=CC=CC=C3)CCC2)s1	ZINC001717152207	1421142765	/nfs/dbraw/zinc/14/27/65/1421142765.db2.gz	SJSWAVJMODEAHQ-UHFFFAOYSA-N	0	3	339.464	3.047	20	30		EGEDHN
C=C(Br)CNCC(C)(C)CN(C)C(=O)c1ccccc1	ZINC001717449338	1421379268	/nfs/dbraw/zinc/37/92/68/1421379268.db2.gz	QIHVYVXALABHKZ-UHFFFAOYSA-N	0	3	339.277	3.283	20	30		EGEDHN
CC(C)(C)[C@@H](CNCc1ccc(C#N)s1)NC(=O)C1CCCC1	ZINC001717952491	1421723919	/nfs/dbraw/zinc/72/39/19/1421723919.db2.gz	JGSZDIOLVGTSFT-MRXNPFEDSA-N	0	3	333.501	3.430	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](NC(=O)CCC2CCC2)C2CC2)c(F)c1	ZINC001723290225	1424336782	/nfs/dbraw/zinc/33/67/82/1424336782.db2.gz	VCWDDEBCKOGLAP-LJQANCHMSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=CCC1(C(=O)N2CCC[C@@H]2CNCc2cc(C)ns2)CCC1	ZINC001723968587	1424613736	/nfs/dbraw/zinc/61/37/36/1424613736.db2.gz	AIMSLNLAKOBMBX-OAHLLOKOSA-N	0	3	333.501	3.279	20	30		EGEDHN
CC(C)C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccc(F)c(C#N)c1	ZINC001724596751	1424927360	/nfs/dbraw/zinc/92/73/60/1424927360.db2.gz	NTXQNQUHLSGZTA-VBUUOAMHSA-N	0	3	343.446	3.213	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N(C)CC(C)(C)CNCc1ccccc1C#N	ZINC001725150156	1425634738	/nfs/dbraw/zinc/63/47/38/1425634738.db2.gz	QWUXVYDIHHENLD-INIZCTEOSA-N	0	3	329.488	3.425	20	30		EGEDHN
C[C@H](CNC(=O)C12CCC(CC1)CC2)N(C)Cc1cccc(C#N)c1	ZINC001725195485	1425747581	/nfs/dbraw/zinc/74/75/81/1425747581.db2.gz	OEDBDFWSOQQXPI-ZGGTZUKQSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C(Br)CNC[C@@H](C1CC1)N(C)C(=O)CC1CCCC1	ZINC001725448337	1426113119	/nfs/dbraw/zinc/11/31/19/1426113119.db2.gz	FIEKTVPCGGWPOL-HNNXBMFYSA-N	0	3	343.309	3.302	20	30		EGEDHN
CC(C)(C(=O)N[C@@H]1CC[C@@H](CNCc2ccccc2C#N)C1)C(F)F	ZINC001725660307	1426342582	/nfs/dbraw/zinc/34/25/82/1426342582.db2.gz	KSSOEOCFYFASJL-CZUORRHYSA-N	0	3	349.425	3.224	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H](CNCc2ccc(C#N)s2)C(C)(C)C)co1	ZINC001725740357	1426415810	/nfs/dbraw/zinc/41/58/10/1426415810.db2.gz	RTLHMCKBDSNGRY-INIZCTEOSA-N	0	3	345.468	3.456	20	30		EGEDHN
CCCN(CCNC(=O)C1CC2(CC2)C1)Cc1cccc(C#N)c1	ZINC001731869085	1428121128	/nfs/dbraw/zinc/12/11/28/1428121128.db2.gz	NHAXGYIJDYXGBE-UHFFFAOYSA-N	0	3	325.456	3.077	20	30		EGEDHN
CC1(CCC(=O)NCC2(NCc3ccc(F)c(C#N)c3)CCC2)CC1	ZINC001733725605	1429951514	/nfs/dbraw/zinc/95/15/14/1429951514.db2.gz	LWZRKRCPEWFQCR-UHFFFAOYSA-N	0	3	343.446	3.406	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCCC[C@H]1CNCC#Cc1ccc(F)cc1	ZINC001733921246	1437735193	/nfs/dbraw/zinc/73/51/93/1437735193.db2.gz	XRDYEISFYUEOIA-SLWVEJNMSA-N	0	3	328.431	3.114	20	30		EGEDHN
C=C(Br)CNCC(C)(C)CN(C)C(=O)C[C@H](C)CC	ZINC001734016942	1437807196	/nfs/dbraw/zinc/80/71/96/1437807196.db2.gz	ULEGBTMRXAKBJK-GFCCVEGCSA-N	0	3	333.314	3.405	20	30		EGEDHN
C[C@H](CNC(=O)CC(C)(C)C1CC1)N(C)Cc1cccc(C#N)c1	ZINC001734029637	1437817979	/nfs/dbraw/zinc/81/79/79/1437817979.db2.gz	BOEVRUWUHQNBRN-OAHLLOKOSA-N	0	3	327.472	3.321	20	30		EGEDHN
CCc1ccsc1C(=O)NC[C@@H](C)N(C)Cc1ccc(C#N)cc1	ZINC001734067053	1437861763	/nfs/dbraw/zinc/86/17/63/1437861763.db2.gz	ZLGISUOOBKJKCC-CQSZACIVSA-N	0	3	341.480	3.432	20	30		EGEDHN
COc1ccc(CN[C@@H](C)CN(C)C(=O)CCC2CCC2)cc1C#N	ZINC001734317861	1438046432	/nfs/dbraw/zinc/04/64/32/1438046432.db2.gz	DDQDSVLYZMTMNH-HNNXBMFYSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=CCCC(=O)N(C)C1CCN(Cc2ccc(OC)c(C)c2)CC1	ZINC001752295522	1440167050	/nfs/dbraw/zinc/16/70/50/1440167050.db2.gz	RYDGETHZCDKHGO-UHFFFAOYSA-N	0	3	330.472	3.393	20	30		EGEDHN
C=CCOCCN1CCC(N(C)C(=O)[C@@]2(C)CC=C(C)CC2)CC1	ZINC001752310189	1440169625	/nfs/dbraw/zinc/16/96/25/1440169625.db2.gz	IKHRLUWEPLYSSI-FQEVSTJZSA-N	0	3	334.504	3.248	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CC12CCN(Cc1ncccc1C)CC2	ZINC001752436140	1440180483	/nfs/dbraw/zinc/18/04/83/1440180483.db2.gz	VDIZDKUOCPEEPS-GOSISDBHSA-N	0	3	341.499	3.463	20	30		EGEDHN
CC(C)(C)CC(=O)NC[C@@H](NCc1cc(C#N)ccc1F)C1CC1	ZINC001752453516	1440182854	/nfs/dbraw/zinc/18/28/54/1440182854.db2.gz	YILLASJHKFHFEZ-QGZVFWFLSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N[C@H]1C[C@H](N[C@@H](C)c2ccccc2F)C1)OCC	ZINC001752634854	1440197349	/nfs/dbraw/zinc/19/73/49/1440197349.db2.gz	QYYVMFNQIVHVJJ-IUVQAAGXSA-N	0	3	348.462	3.495	20	30		EGEDHN
O=C(N[C@H]1C[C@H](NCC#Cc2ccccc2Cl)C1)C1(F)CCCC1	ZINC001752638578	1440197445	/nfs/dbraw/zinc/19/74/45/1440197445.db2.gz	ALDOAZRXCURCPV-WKILWMFISA-N	0	3	348.849	3.211	20	30		EGEDHN
Cc1ccc2sc(CN[C@H]3C[C@H](NC(=O)C#CC(C)C)C3)nc2c1	ZINC001752653711	1440198179	/nfs/dbraw/zinc/19/81/79/1440198179.db2.gz	PHYFNNLOAWRSKU-SHTZXODSSA-N	0	3	341.480	3.001	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@H](C)CCOc2ccccc2)C1	ZINC001752692421	1440200805	/nfs/dbraw/zinc/20/08/05/1440200805.db2.gz	UIOSXFHWHROXJW-FVQBIDKESA-N	0	3	336.863	3.081	20	30		EGEDHN
O=C(C[C@H]1C=CCCC1)N[C@H]1C[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001752736482	1440204315	/nfs/dbraw/zinc/20/43/15/1440204315.db2.gz	AUFPJTHRCHSIMG-YSIASYRMSA-N	0	3	340.442	3.160	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)C[C@@H]2C[C@H]2Cc2ccccc2)C1	ZINC001752784401	1440210425	/nfs/dbraw/zinc/21/04/25/1440210425.db2.gz	BMAFARXYTDXKRF-HBMCJLEFSA-N	0	3	338.495	3.107	20	30		EGEDHN
C=CCOCCN1CCCC[C@H]1CNC(=O)[C@@H]1CCC(C)=C(C)C1	ZINC001752820350	1440220162	/nfs/dbraw/zinc/22/01/62/1440220162.db2.gz	DHQYSXFLKGEPCW-MOPGFXCFSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=CCOCCN1CCCC[C@@H]1CNC(=O)[C@H](C)c1cccc(C)c1	ZINC001752822723	1440221472	/nfs/dbraw/zinc/22/14/72/1440221472.db2.gz	MTYYNZTYBARKBL-UYAOXDASSA-N	0	3	344.499	3.272	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)Cc1noc2ccc(F)cc12	ZINC001752824504	1440222822	/nfs/dbraw/zinc/22/28/22/1440222822.db2.gz	YQRSGXMWJUCGCA-OAHLLOKOSA-N	0	3	345.418	3.056	20	30		EGEDHN
Cc1ncccc1C(=O)N1CCCC[C@H]1CNCC#Cc1ccccc1	ZINC001752829475	1440224914	/nfs/dbraw/zinc/22/49/14/1440224914.db2.gz	CJCOECBKFREJGA-FQEVSTJZSA-N	0	3	347.462	3.026	20	30		EGEDHN
CCCC1(C(=O)N2CCCC[C@@H]2[C@@H]2CCCN2CC#CCOC)CC1	ZINC001752833023	1440226229	/nfs/dbraw/zinc/22/62/29/1440226229.db2.gz	AJMOQSSEAQMING-RBUKOAKNSA-N	0	3	346.515	3.062	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)Cc2cccc(C(F)F)c2)C1	ZINC001752836435	1440228062	/nfs/dbraw/zinc/22/80/62/1440228062.db2.gz	NDZPUQSFNXPXMP-YJBOKZPZSA-N	0	3	348.437	3.407	20	30		EGEDHN
Cc1csc(CNC2CCC(NC(=O)C#CC(C)(C)C)CC2)n1	ZINC001752848522	1440233047	/nfs/dbraw/zinc/23/30/47/1440233047.db2.gz	QBSJBBOAHOJIIS-UHFFFAOYSA-N	0	3	333.501	3.018	20	30		EGEDHN
CC(C)(C)/C=C/C(=O)N1CC[C@@H](CNCc2ccccc2C#N)C1	ZINC001752934527	1440250198	/nfs/dbraw/zinc/25/01/98/1440250198.db2.gz	HYEQJDMCWGZQNR-DZZUKKPASA-N	0	3	325.456	3.099	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CCC[C@@H](NCc2csc(CCC)n2)C1	ZINC001752969451	1440254725	/nfs/dbraw/zinc/25/47/25/1440254725.db2.gz	ROUAKIPDWGYFKO-CVEARBPZSA-N	0	3	347.528	3.416	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1CCC[C@H](NCc2nccn2C(F)F)C1	ZINC001752971311	1440255099	/nfs/dbraw/zinc/25/50/99/1440255099.db2.gz	LBXBVPRFZGHKAC-KBPBESRZSA-N	0	3	340.418	3.152	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CCC[C@@H](NCc2nccn2C(F)F)C1	ZINC001752971314	1440255106	/nfs/dbraw/zinc/25/51/06/1440255106.db2.gz	LBXBVPRFZGHKAC-ZIAGYGMSSA-N	0	3	340.418	3.152	20	30		EGEDHN
CC#CCN(C)[C@H]1CCCN(C(=O)C[C@@H]2CCCc3ccccc32)C1	ZINC001752996986	1440262435	/nfs/dbraw/zinc/26/24/35/1440262435.db2.gz	JZZITPZLIYLDME-PMACEKPBSA-N	0	3	338.495	3.443	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@H](N(C)Cc2ccc(C)nc2C)C1	ZINC001752997692	1440262981	/nfs/dbraw/zinc/26/29/81/1440262981.db2.gz	XNYYEUSOZBSVBG-IBGZPJMESA-N	0	3	329.488	3.478	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1CCCNC(=O)c1ncoc1C1CC1	ZINC001753036549	1440274899	/nfs/dbraw/zinc/27/48/99/1440274899.db2.gz	ADAUKIJNWYIKGJ-AWEZNQCLSA-N	0	3	337.851	3.279	20	30		EGEDHN
CN(CCNC(=O)C#CC(C)(C)C)[C@H]1CCc2ccc(Cl)cc21	ZINC001753048710	1440278437	/nfs/dbraw/zinc/27/84/37/1440278437.db2.gz	BZIBWGAKGABCSB-KRWDZBQOSA-N	0	3	332.875	3.425	20	30		EGEDHN
CCN(CCNC(=O)c1ccc(F)cc1F)Cc1cccc(C#N)c1	ZINC001753094054	1440301392	/nfs/dbraw/zinc/30/13/92/1440301392.db2.gz	UKYNHZSTLCPWME-UHFFFAOYSA-N	0	3	343.377	3.088	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NC[C@@H]1CCN(Cc2cccc(F)c2)C1)OCC	ZINC001753128938	1440315874	/nfs/dbraw/zinc/31/58/74/1440315874.db2.gz	KWPKFTFIUXXLPE-HKUYNNGSSA-N	0	3	348.462	3.135	20	30		EGEDHN
CC(C)C#CC(=O)N(C)CCNCc1ccc(Cl)c(Cl)c1	ZINC001753187489	1440337448	/nfs/dbraw/zinc/33/74/48/1440337448.db2.gz	IYDLENKITBFZHK-UHFFFAOYSA-N	0	3	327.255	3.201	20	30		EGEDHN
CN(CCNCc1ccc(C#N)cc1)C(=O)C1(C)CCCCCC1	ZINC001753199304	1440338290	/nfs/dbraw/zinc/33/82/90/1440338290.db2.gz	PGVYOVFLVHJFOK-UHFFFAOYSA-N	0	3	327.472	3.467	20	30		EGEDHN
C#CCC1(C(=O)N(C)CCNCc2ccc(Cl)nc2)CCCCC1	ZINC001753266375	1440344898	/nfs/dbraw/zinc/34/48/98/1440344898.db2.gz	LKEDXGJSYZUHNR-UHFFFAOYSA-N	0	3	347.890	3.257	20	30		EGEDHN
C=C[C@H](CC(=O)N(C)CCNCc1ccc(C#N)cc1)c1ccccc1	ZINC001753271051	1440345412	/nfs/dbraw/zinc/34/54/12/1440345412.db2.gz	GTLBSDRSQXTCOJ-HXUWFJFHSA-N	0	3	347.462	3.466	20	30		EGEDHN
C#CCCN1CC[C@H](N(CCC)C(=O)c2cc(Cl)cn2CC)C1	ZINC001753322532	1440364367	/nfs/dbraw/zinc/36/43/67/1440364367.db2.gz	IDXUIBBPRAEYQQ-INIZCTEOSA-N	0	3	335.879	3.111	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC[C@@H]1CCN(Cc2cnc(C)s2)C1	ZINC001753335641	1440372122	/nfs/dbraw/zinc/37/21/22/1440372122.db2.gz	WSACRQLVJAQHKK-OAHLLOKOSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=CCC1(C(=O)NCC2CN(C[C@@H]3CC[C@H](C)O3)C2)CCCCC1	ZINC001753417382	1440394544	/nfs/dbraw/zinc/39/45/44/1440394544.db2.gz	OJZMXBXSODQATA-WMZOPIPTSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCCCN1C[C@@H]2C[C@H]1CN2C(=O)c1cncc2sccc21	ZINC001753424260	1440396465	/nfs/dbraw/zinc/39/64/65/1440396465.db2.gz	QKZJUWFXHWDWKY-KBPBESRZSA-N	0	3	327.453	3.161	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(N(C)C)cc1	ZINC001753426470	1440396857	/nfs/dbraw/zinc/39/68/57/1440396857.db2.gz	BLLHAPUMLRQNJI-MNEFBYGVSA-N	0	3	327.472	3.006	20	30		EGEDHN
C=CCCCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H](C)c1ccc(F)c(F)c1	ZINC001753428108	1440397643	/nfs/dbraw/zinc/39/76/43/1440397643.db2.gz	WPVWYRXCRLGULD-KBMXLJTQSA-N	0	3	334.410	3.320	20	30		EGEDHN
C=CCCCCCN1CC[C@@H](N(C)C(=O)c2snnc2C2CC2)C1	ZINC001753439667	1440401302	/nfs/dbraw/zinc/40/13/02/1440401302.db2.gz	QBOBYOXXHLZQPG-OAHLLOKOSA-N	0	3	348.516	3.308	20	30		EGEDHN
CC[C@@H](CNC(=O)[C@@H](C)C(C)(C)C)NCC#Cc1ccc(F)cc1	ZINC001753478792	1440415999	/nfs/dbraw/zinc/41/59/99/1440415999.db2.gz	MNKUMXXUHUTJPN-QAPCUYQASA-N	0	3	332.463	3.344	20	30		EGEDHN
CC[C@@H](CNC(=O)c1cc2ccccn2c1)NCC#Cc1ccccc1	ZINC001753487873	1440418407	/nfs/dbraw/zinc/41/84/07/1440418407.db2.gz	KJNNUYXJUVGCCB-FQEVSTJZSA-N	0	3	345.446	3.089	20	30		EGEDHN
C#CCC1(C(=O)NC[C@H](CC)NCc2scnc2C)CCCCC1	ZINC001753497087	1440421991	/nfs/dbraw/zinc/42/19/91/1440421991.db2.gz	KOYZXOPAKDDSJX-INIZCTEOSA-N	0	3	347.528	3.410	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)Cc2cccnc2C)CCCC[C@H]1C	ZINC001753535878	1440432457	/nfs/dbraw/zinc/43/24/57/1440432457.db2.gz	NAPYVDIZMUKYRN-AUUYWEPGSA-N	0	3	349.906	3.340	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@@H](CCNCc2cc(C#N)ccc2F)C1	ZINC001753541898	1440433672	/nfs/dbraw/zinc/43/36/72/1440433672.db2.gz	XSFSNAUORDPYLB-HNNXBMFYSA-N	0	3	331.435	3.072	20	30		EGEDHN
CC(C)(F)C(=O)NCCC1CCN(CC#Cc2ccccc2)CC1	ZINC001753592681	1440443383	/nfs/dbraw/zinc/44/33/83/1440443383.db2.gz	XTRUVFKELKYZFR-UHFFFAOYSA-N	0	3	330.447	3.005	20	30		EGEDHN
C=CCCC(=O)NC[C@@H](C)CNCc1nc2cc(C)ccc2s1	ZINC001753607468	1440448354	/nfs/dbraw/zinc/44/83/54/1440448354.db2.gz	RBHULBNWZOFPMG-AWEZNQCLSA-N	0	3	331.485	3.413	20	30		EGEDHN
C[C@@H](CNCc1ccccc1C#N)CNC(=O)c1sccc1Cl	ZINC001753614353	1440449403	/nfs/dbraw/zinc/44/94/03/1440449403.db2.gz	MAOGDJVEKQUYJX-LBPRGKRZSA-N	0	3	347.871	3.429	20	30		EGEDHN
C#CCCCCC(=O)NCC1(NCc2ncccc2C)CCCC1	ZINC001753662731	1440459266	/nfs/dbraw/zinc/45/92/66/1440459266.db2.gz	RINGDZKDJMYYPW-UHFFFAOYSA-N	0	3	327.472	3.102	20	30		EGEDHN
C#CCCCCC(=O)NCC1(NCc2cccc(Cl)n2)CCCC1	ZINC001753663057	1440459322	/nfs/dbraw/zinc/45/93/22/1440459322.db2.gz	ZUEFPSJSAWPKDS-UHFFFAOYSA-N	0	3	347.890	3.447	20	30		EGEDHN
C=CCOCCN1CC2(C1)CCN(C(=O)c1csc(C)c1C)CC2	ZINC001753673403	1440462751	/nfs/dbraw/zinc/46/27/51/1440462751.db2.gz	IEBWTEZOIIDPOP-UHFFFAOYSA-N	0	3	348.512	3.106	20	30		EGEDHN
Cc1ccccc1C(=O)N(C)[C@@H](C)CNCC#Cc1ccc(F)cc1	ZINC001753678018	1440463830	/nfs/dbraw/zinc/46/38/30/1440463830.db2.gz	VCYNMHQWVRQJJP-KRWDZBQOSA-N	0	3	338.426	3.236	20	30		EGEDHN
C#CCCCCC(=O)N(C)[C@@H](C)CNCC#Cc1cccc(Cl)c1	ZINC001753686192	1440465585	/nfs/dbraw/zinc/46/55/85/1440465585.db2.gz	SUKZDYLPZQABQC-KRWDZBQOSA-N	0	3	344.886	3.322	20	30		EGEDHN
Cc1cc(C)c(C(=O)N(C)[C@H](C)CNCc2ccc(C#N)c(F)c2)o1	ZINC001753686266	1440465628	/nfs/dbraw/zinc/46/56/28/1440465628.db2.gz	DZQNTGCVNBGRBJ-CYBMUJFWSA-N	0	3	343.402	3.158	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccc(F)cc1)N(C)C(=O)C1CC(C)(C)C1	ZINC001753690140	1440466427	/nfs/dbraw/zinc/46/64/27/1440466427.db2.gz	QDXUQIOTDFCZEE-HNNXBMFYSA-N	0	3	330.447	3.050	20	30		EGEDHN
CC(C)C[C@@H](CNCC#Cc1ccc(F)cc1)NC(=O)C1(C)CC1	ZINC001753735071	1440477451	/nfs/dbraw/zinc/47/74/51/1440477451.db2.gz	OLRMOQVXKFQORK-SFHVURJKSA-N	0	3	330.447	3.098	20	30		EGEDHN
CC(F)(F)CC(=O)N1CCCC[C@@H]1CCNCc1ccccc1C#N	ZINC001753796505	1440489922	/nfs/dbraw/zinc/48/99/22/1440489922.db2.gz	KBJDYLKKAPAZKY-QGZVFWFLSA-N	0	3	349.425	3.464	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CCC[C@H]1CNCc1ccccc1C#N	ZINC001753893326	1440522326	/nfs/dbraw/zinc/52/23/26/1440522326.db2.gz	AFLFVOAANRFJLZ-VQTJNVASSA-N	0	3	337.467	3.126	20	30		EGEDHN
C[C@H](CCNCc1c(Cl)cccc1Cl)NC(=O)C#CC1CC1	ZINC001753965167	1440526415	/nfs/dbraw/zinc/52/64/15/1440526415.db2.gz	WBWSDODXYQXGLF-GFCCVEGCSA-N	0	3	339.266	3.391	20	30		EGEDHN
C=C(Br)CNCC[C@H](C)NC(=O)[C@]1(C)CC=CCC1	ZINC001753967917	1440526723	/nfs/dbraw/zinc/52/67/23/1440526723.db2.gz	BVOZCHIJOJWDLF-DZGCQCFKSA-N	0	3	329.282	3.126	20	30		EGEDHN
C[C@@H](CCNCc1ccccc1C#N)NC(=O)c1ccoc1C1CC1	ZINC001753994811	1440529419	/nfs/dbraw/zinc/52/94/19/1440529419.db2.gz	XYDWPTPUSVDJBD-AWEZNQCLSA-N	0	3	337.423	3.327	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC/C=C\CNCc1cccc(Oc2ccccc2)c1	ZINC001754102486	1440541404	/nfs/dbraw/zinc/54/14/04/1440541404.db2.gz	BPHDYNHMQUKBTD-OSJSJHBBSA-N	0	3	349.434	3.401	20	30		EGEDHN
N#Cc1cccc(CNC/C=C/CNC(=O)C(F)=C2CCCC2)c1	ZINC001754110963	1440541955	/nfs/dbraw/zinc/54/19/55/1440541955.db2.gz	OBIXTYJMUPCAQT-ONEGZZNKSA-N	0	3	327.403	3.118	20	30		EGEDHN
C=C1CCC(C(=O)NC/C=C\CNCc2ccccc2N(C)C)CC1	ZINC001754167008	1440546633	/nfs/dbraw/zinc/54/66/33/1440546633.db2.gz	VJBHMGIIBDVMGW-SREVYHEPSA-N	0	3	341.499	3.261	20	30		EGEDHN
C[C@H](CNCc1ccc(F)c(C#N)c1)NC(=O)[C@@H](C)c1ccccc1	ZINC001754249998	1440557663	/nfs/dbraw/zinc/55/76/63/1440557663.db2.gz	YOAYCGVYUIYXHI-CABCVRRESA-N	0	3	339.414	3.095	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)NC(=O)[C@H]1CC[C@@H]2C[C@@H]2CC1	ZINC001754284148	1440563719	/nfs/dbraw/zinc/56/37/19/1440563719.db2.gz	VRJPTAAERHUBQB-XQLPTFJDSA-N	0	3	331.485	3.040	20	30		EGEDHN
C[C@@H]1CC[C@H](C(=O)N(C)CCCNCc2ccc(C#N)cc2F)C1	ZINC001754400895	1440595268	/nfs/dbraw/zinc/59/52/68/1440595268.db2.gz	KHNVIZGNEDVKET-ZBFHGGJFSA-N	0	3	331.435	3.072	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](NC(=O)c2ccc(F)cc2)C2CC2)s1	ZINC001754432208	1440597187	/nfs/dbraw/zinc/59/71/87/1440597187.db2.gz	DYIYVJNDWMKIQH-QGZVFWFLSA-N	0	3	343.427	3.057	20	30		EGEDHN
CCC(CC)CC(=O)N[C@@H](CNCC#Cc1ccccc1)C1CC1	ZINC001754455783	1440602153	/nfs/dbraw/zinc/60/21/53/1440602153.db2.gz	TXSKQUVAWFZQMD-FQEVSTJZSA-N	0	3	326.484	3.349	20	30		EGEDHN
C=CCC[C@@H](C)N1CC[C@H]1CNC(=O)c1c(C)nn(CCC)c1C	ZINC001754497913	1440613008	/nfs/dbraw/zinc/61/30/08/1440613008.db2.gz	RNUYATIVTOPHNT-PBHICJAKSA-N	0	3	332.492	3.069	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC2(NCc3ccc(OC)c(Cl)c3)CC2)C1	ZINC001754524993	1440620769	/nfs/dbraw/zinc/62/07/69/1440620769.db2.gz	YJOUMIISZYQQEE-UHFFFAOYSA-N	0	3	348.874	3.443	20	30		EGEDHN
C=CCCC(=O)N1CCCC[C@H]1[C@H]1CCN(Cc2cccnc2)C1	ZINC001754539686	1440625786	/nfs/dbraw/zinc/62/57/86/1440625786.db2.gz	UKPFAYLTTLQDSU-OALUTQOASA-N	0	3	327.472	3.251	20	30		EGEDHN
Cc1ncc(CN(CCNC(=O)[C@H](C)C#N)C2CCCCCC2)s1	ZINC001754546799	1440627934	/nfs/dbraw/zinc/62/79/34/1440627934.db2.gz	TXFVLSHNRYIUPZ-CQSZACIVSA-N	0	3	348.516	3.252	20	30		EGEDHN
CC#CCN(CCOC)C1CCN(C(=O)C2C[C@@H](C)C[C@H](C)C2)CC1	ZINC001754550843	1440629737	/nfs/dbraw/zinc/62/97/37/1440629737.db2.gz	GLYWOOZPHYCBAO-ROUUACIJSA-N	0	3	348.531	3.021	20	30		EGEDHN
CC#CCN(CCOC)C1CCN(C(=O)C[C@H](C)CC(C)C)CC1	ZINC001754550743	1440629827	/nfs/dbraw/zinc/62/98/27/1440629827.db2.gz	BWQVFUUACZDNOQ-GOSISDBHSA-N	0	3	336.520	3.021	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](NC/C(Cl)=C/Cl)C[C@H]1C	ZINC001754598193	1440641931	/nfs/dbraw/zinc/64/19/31/1440641931.db2.gz	HVQXIWIEWLVZFC-KHRZRBRSSA-N	0	3	331.287	3.468	20	30		EGEDHN
O=C(C1CCCC1)N1CCC[C@H]1CNCC#Cc1ccc(Cl)cc1	ZINC001754603869	1440642964	/nfs/dbraw/zinc/64/29/64/1440642964.db2.gz	OVHXIEGNGZMCKA-IBGZPJMESA-N	0	3	344.886	3.462	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@H]1CNCC#Cc1ccc(F)cc1	ZINC001754611346	1440643904	/nfs/dbraw/zinc/64/39/04/1440643904.db2.gz	ZOFGTLRPUHORGI-IBGZPJMESA-N	0	3	342.458	3.360	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)COc2ccccc2C(C)C)CC1	ZINC001754631369	1440647975	/nfs/dbraw/zinc/64/79/75/1440647975.db2.gz	OQSOWIJZBPVELK-UHFFFAOYSA-N	0	3	330.472	3.346	20	30		EGEDHN
C#CCCCCC(=O)N[C@]1(C)CCN(Cc2ccc3cc[nH]c3c2)C1	ZINC001754672964	1440658768	/nfs/dbraw/zinc/65/87/68/1440658768.db2.gz	RPHOPQFUNSEXDN-OAQYLSRUSA-N	0	3	337.467	3.442	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@](C)(CNCc2oc(CC)nc2C)C1	ZINC001754693628	1440666619	/nfs/dbraw/zinc/66/66/19/1440666619.db2.gz	VPGYXHKUDFECFH-FQEVSTJZSA-N	0	3	345.487	3.067	20	30		EGEDHN
C#CCN1CCC(C)(CNC(=O)c2cc3cc(Cl)ccc3[nH]2)CC1	ZINC001754718528	1440672307	/nfs/dbraw/zinc/67/23/07/1440672307.db2.gz	FILKCTNRYXBCKD-UHFFFAOYSA-N	0	3	343.858	3.286	20	30		EGEDHN
C=CCN1CCC[C@@](C)(CNC(=O)[C@H](C)CCOc2ccccc2)C1	ZINC001754734668	1440681728	/nfs/dbraw/zinc/68/17/28/1440681728.db2.gz	PDOHERPKRUQKNM-NQIIRXRSSA-N	0	3	344.499	3.496	20	30		EGEDHN
CC#CCN1CCC[C@@](C)(CNC(=O)[C@@H](C)Cc2ccc(C)cc2)C1	ZINC001754735325	1440682014	/nfs/dbraw/zinc/68/20/14/1440682014.db2.gz	ZEMIWCBVKKWBPL-UGKGYDQZSA-N	0	3	340.511	3.415	20	30		EGEDHN
C=CCN1CCC[C@](C)(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2F)C1	ZINC001754735755	1440682295	/nfs/dbraw/zinc/68/22/95/1440682295.db2.gz	JQPWQUTTXCEMMD-SQGPQFPESA-N	0	3	348.437	3.473	20	30		EGEDHN
C=CCN1CCC[C@@](C)(CNC(=O)[C@@H]2CCOc3c(F)cccc32)C1	ZINC001754735955	1440682427	/nfs/dbraw/zinc/68/24/27/1440682427.db2.gz	NYICERRYFDWPRE-UZLBHIALSA-N	0	3	346.446	3.096	20	30		EGEDHN
C=CCN[C@@H](CNC(=O)c1c[nH]nc1C1CC1)c1ccccc1CC	ZINC001754790537	1440688609	/nfs/dbraw/zinc/68/86/09/1440688609.db2.gz	QZYZULDLIRVVIC-SFHVURJKSA-N	0	3	338.455	3.096	20	30		EGEDHN
C=CCN[C@@H](CNC(=O)c1cn(CC)nc1C)c1ccccc1CC	ZINC001754791280	1440688621	/nfs/dbraw/zinc/68/86/21/1440688621.db2.gz	VATBEDOACORYQH-IBGZPJMESA-N	0	3	340.471	3.021	20	30		EGEDHN
CC/C(C)=C/C(=O)N1CC[C@H]([C@@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001754793587	1440688965	/nfs/dbraw/zinc/68/89/65/1440688965.db2.gz	YOWGKAXMKGQDRY-HEHZLSOZSA-N	0	3	343.446	3.380	20	30		EGEDHN
CC[C@@H](C)C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2CC#Cc1ccccc1	ZINC001754829796	1440694404	/nfs/dbraw/zinc/69/44/04/1440694404.db2.gz	UTJOXRDGGSZBKY-AYWYSENESA-N	0	3	338.495	3.443	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H]2CN(CCOc3ccccc3F)C[C@H]21	ZINC001754870881	1440704986	/nfs/dbraw/zinc/70/49/86/1440704986.db2.gz	NPRJABBWVODLFC-FUHWJXTLSA-N	0	3	346.446	3.094	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)CCCc1sccc1C	ZINC001754872433	1440705464	/nfs/dbraw/zinc/70/54/64/1440705464.db2.gz	YSDQNFWHKAXNEC-QZTJIDSGSA-N	0	3	344.524	3.468	20	30		EGEDHN
C=C(C)CN(C)Cc1ccccc1CNC(=O)[C@H](C)n1cccc1	ZINC001754946074	1440713223	/nfs/dbraw/zinc/71/32/23/1440713223.db2.gz	UMHWRJGPTPWANA-KRWDZBQOSA-N	0	3	325.456	3.373	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)CC(C)(C)COC)cccc2C1	ZINC001754975609	1440719949	/nfs/dbraw/zinc/71/99/49/1440719949.db2.gz	FHSMJMXAEQJRAC-UHFFFAOYSA-N	0	3	344.499	3.300	20	30		EGEDHN
CC#CCNC1(CNC(=O)c2ccc(Cl)c(Cl)c2)CCC1	ZINC001754991629	1440724661	/nfs/dbraw/zinc/72/46/61/1440724661.db2.gz	VGIFTAMBIWAYMR-UHFFFAOYSA-N	0	3	325.239	3.259	20	30		EGEDHN
C=CCCCN1CCN([C@@H]2CCN(C(=O)C(C)=C3CCCC3)C2)CC1	ZINC001755018039	1440726318	/nfs/dbraw/zinc/72/63/18/1440726318.db2.gz	SRHVIUYNXIPELJ-HXUWFJFHSA-N	0	3	345.531	3.062	20	30		EGEDHN
CCCN1Cc2ccc(CNC(=O)CC#Cc3ccccc3)cc2C1	ZINC001755101443	1440752521	/nfs/dbraw/zinc/75/25/21/1440752521.db2.gz	GJBINECYYDEYCI-UHFFFAOYSA-N	0	3	332.447	3.470	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@H](C)[C@H](NCc2ccc(Cl)nc2)C1	ZINC001755124318	1440756054	/nfs/dbraw/zinc/75/60/54/1440756054.db2.gz	VSGIRRMCALDOJK-WMLDXEAASA-N	0	3	347.890	3.440	20	30		EGEDHN
Cc1nc(C)c(CN2CC[C@@H](NC(=O)C#CC(C)C)C(C)(C)C2)s1	ZINC001755137666	1440759152	/nfs/dbraw/zinc/75/91/52/1440759152.db2.gz	BRXDIDSFHUWNBM-QGZVFWFLSA-N	0	3	347.528	3.136	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)C2(CCOCC)CCCC2)C(C)(C)C1	ZINC001755141427	1440760632	/nfs/dbraw/zinc/76/06/32/1440760632.db2.gz	GMLMOUNPGARWDF-KRWDZBQOSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)[C@@H](C)OCc2cccc(C)c2)C(C)(C)C1	ZINC001755142015	1440761003	/nfs/dbraw/zinc/76/10/03/1440761003.db2.gz	RTNSINNLIDPGFO-MJGOQNOKSA-N	0	3	344.499	3.303	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)[C@H](CC)Oc2ccccc2F)C(C)(C)C1	ZINC001755143942	1440762345	/nfs/dbraw/zinc/76/23/45/1440762345.db2.gz	SKEGAGTWDBMGCR-FUHWJXTLSA-N	0	3	348.462	3.386	20	30		EGEDHN
CC/C(C)=C/C(=O)N[C@@H]1CCN(Cc2cccc(C#N)c2)[C@@H](C)C1	ZINC001755159172	1440763985	/nfs/dbraw/zinc/76/39/85/1440763985.db2.gz	DJRZBQGUSDWOOD-SCAUPEPPSA-N	0	3	325.456	3.384	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CCN(Cc2cccc(F)c2)[C@H](C)C1	ZINC001755168745	1440767991	/nfs/dbraw/zinc/76/79/91/1440767991.db2.gz	GOEPTFCUWBEHAL-VQIMIIECSA-N	0	3	330.447	3.488	20	30		EGEDHN
C=CCCCC(=O)N1CCOC2(CCN(Cc3ccsc3)CC2)C1	ZINC001755174263	1440770362	/nfs/dbraw/zinc/77/03/62/1440770362.db2.gz	OLLBZKQINGMMGZ-UHFFFAOYSA-N	0	3	348.512	3.298	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCN1C(=O)[C@@H](C)OCc1ccc(C)cc1	ZINC001755196687	1440777146	/nfs/dbraw/zinc/77/71/46/1440777146.db2.gz	RJYAKZXTHHMQDC-IEBWSBKVSA-N	0	3	330.472	3.009	20	30		EGEDHN
C=C(Cl)CNCC1CC(NC(=O)[C@@H]2Cc3ccc(Cl)cc32)C1	ZINC001755221228	1440784657	/nfs/dbraw/zinc/78/46/57/1440784657.db2.gz	OSBNUBBFMIWMDI-HFLCMSJXSA-N	0	3	339.266	3.217	20	30		EGEDHN
C=C1CCC(C(=O)N(C)CC(C)(C)CNCc2nccs2)CC1	ZINC001755285768	1440802102	/nfs/dbraw/zinc/80/21/02/1440802102.db2.gz	ONAZTJPXCJUSOS-UHFFFAOYSA-N	0	3	335.517	3.464	20	30		EGEDHN
C[C@H](CNC(=O)C#CC(C)(C)C)N(C)CCOC1CCCCCC1	ZINC001755300212	1440808183	/nfs/dbraw/zinc/80/81/83/1440808183.db2.gz	LXTPPAMRHPZQBY-QGZVFWFLSA-N	0	3	336.520	3.212	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H](C)N(C)CCOc1ccccc1F	ZINC001755311558	1440813602	/nfs/dbraw/zinc/81/36/02/1440813602.db2.gz	QYEGVDOCVMHWEQ-OAHLLOKOSA-N	0	3	336.451	3.243	20	30		EGEDHN
C=CCOCCN(C)[C@H](C)CNC(=O)c1cccc(C(C)(C)C)c1	ZINC001755321612	1440818923	/nfs/dbraw/zinc/81/89/23/1440818923.db2.gz	QIIOUBSMAQRBLB-MRXNPFEDSA-N	0	3	332.488	3.237	20	30		EGEDHN
CC#CCCCC(=O)NC1(CNCc2c(C)noc2C)CCCCC1	ZINC001755353361	1440828526	/nfs/dbraw/zinc/82/85/26/1440828526.db2.gz	IYXICMWBMTYGII-UHFFFAOYSA-N	0	3	345.487	3.394	20	30		EGEDHN
CCCC[C@@H](CNCC#Cc1ccc(F)cc1)NC(=O)c1ccco1	ZINC001755356258	1440829503	/nfs/dbraw/zinc/82/95/03/1440829503.db2.gz	IZHJJWUYORAYSB-SFHVURJKSA-N	0	3	342.414	3.349	20	30		EGEDHN
C#CCN1CCCCC[C@H]1CNC(=O)CCCc1ccc(F)cc1	ZINC001755368065	1440835864	/nfs/dbraw/zinc/83/58/64/1440835864.db2.gz	MCYDMAJXCHLAOH-IBGZPJMESA-N	0	3	330.447	3.142	20	30		EGEDHN
CC#CCCCC(=O)N[C@H](C)C1CN(CCCc2ccsc2)C1	ZINC001755381869	1440839505	/nfs/dbraw/zinc/83/95/05/1440839505.db2.gz	BKTYESTWYYMQIU-MRXNPFEDSA-N	0	3	332.513	3.311	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)[C@@H](C)CCc2cccc(F)c2)C1	ZINC001755392312	1440842350	/nfs/dbraw/zinc/84/23/50/1440842350.db2.gz	STWHSQKGQPACKI-JKSUJKDBSA-N	0	3	332.463	3.407	20	30		EGEDHN
C=C(Cl)CNC[C@H]1C[C@H](NC(=O)[C@H](C)c2ccc(F)cc2F)C1	ZINC001755483764	1440860590	/nfs/dbraw/zinc/86/05/90/1440860590.db2.gz	VAPLZDSWAZZUBF-YRGRVCCFSA-N	0	3	342.817	3.305	20	30		EGEDHN
C=C(Cl)CNCCC[C@@H](C)NC(=O)c1c(Cl)n[nH]c1C1CC1	ZINC001755502640	1440862770	/nfs/dbraw/zinc/86/27/70/1440862770.db2.gz	KBVLZZTUPFLOAR-SNVBAGLBSA-N	0	3	345.274	3.181	20	30		EGEDHN
C[C@H](CCCNCC#Cc1ccccc1Cl)NC(=O)CCCF	ZINC001755510194	1440863426	/nfs/dbraw/zinc/86/34/26/1440863426.db2.gz	BMQIEKIMBCDMKY-OAHLLOKOSA-N	0	3	338.854	3.316	20	30		EGEDHN
C=C(Br)CNCCC[C@H](NC(C)=O)c1ccccc1	ZINC001755546805	1440870774	/nfs/dbraw/zinc/87/07/74/1440870774.db2.gz	JEHLNEZWSGJILL-HNNXBMFYSA-N	0	3	325.250	3.142	20	30		EGEDHN
CC[C@@H](F)C(=O)NCC[C@@H](NCc1cc(F)ccc1C#N)C(C)C	ZINC001755551898	1440872342	/nfs/dbraw/zinc/87/23/42/1440872342.db2.gz	PCYXLIWIBORXHR-IAGOWNOFSA-N	0	3	337.414	3.066	20	30		EGEDHN
C=C(Br)CNC[C@H](C1CC1)N(C)C(=O)C1(CC)CCC1	ZINC001755564203	1440875294	/nfs/dbraw/zinc/87/52/94/1440875294.db2.gz	HOEMYIOADWMMAU-CQSZACIVSA-N	0	3	343.309	3.302	20	30		EGEDHN
COc1ccc(CN[C@H](C)CN(C)C(=O)/C=C/C(C)(C)C)cc1C#N	ZINC001755581455	1440879477	/nfs/dbraw/zinc/87/94/77/1440879477.db2.gz	HNVNRVHNDQZRNW-BOLDSZDNSA-N	0	3	343.471	3.106	20	30		EGEDHN
C[C@H](CN(C)C(=O)CCCC1CC1)NCc1ccc(F)c(C#N)c1	ZINC001755602530	1440884457	/nfs/dbraw/zinc/88/44/57/1440884457.db2.gz	SSCVHZCYLFRRRM-CQSZACIVSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H](CO)N[C@H](C)c2ccccc2C)CCCC1	ZINC001755649426	1440891200	/nfs/dbraw/zinc/89/12/00/1440891200.db2.gz	UVNFRBLJKHMLEP-MSOLQXFVSA-N	0	3	344.499	3.259	20	30		EGEDHN
CC#CCN1CC[C@]2(NC(=O)C/C=C/c3ccc(F)cc3)CCC[C@H]12	ZINC001755700006	1440899391	/nfs/dbraw/zinc/89/93/91/1440899391.db2.gz	BPUXJHKCGGKVSH-AUWWATPCSA-N	0	3	340.442	3.366	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)CCOCc2ccccc2)[C@@H]1C	ZINC001755719582	1440906894	/nfs/dbraw/zinc/90/68/94/1440906894.db2.gz	AMCULKNQPQAJTA-PKOBYXMFSA-N	0	3	330.472	3.139	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1C[C@H](NCc2ccc(C#N)c(F)c2)C(C)(C)C1	ZINC001755753640	1440913554	/nfs/dbraw/zinc/91/35/54/1440913554.db2.gz	NXGCOXUSNWJKKE-KDOFPFPSSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC/C(C)=C/C(=O)N1C[C@@H](NCc2ccc(F)c(C#N)c2)C(C)(C)C1	ZINC001755759152	1440914555	/nfs/dbraw/zinc/91/45/55/1440914555.db2.gz	LNTUGFOMFWWUJF-ODHXBGJQSA-N	0	3	343.446	3.380	20	30		EGEDHN
C#CCCN(C)CCN(C(=O)[C@H]1C[C@@H]1c1cc(F)ccc1F)C(C)C	ZINC001755815456	1440923230	/nfs/dbraw/zinc/92/32/30/1440923230.db2.gz	LJDHNLOVYMYXIM-AEFFLSMTSA-N	0	3	348.437	3.260	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H](CNCc1cnc(C)nc1)C(C)(C)C	ZINC001755825744	1440927163	/nfs/dbraw/zinc/92/71/63/1440927163.db2.gz	VZPLSDDKSUYZPO-MRXNPFEDSA-N	0	3	332.492	3.008	20	30		EGEDHN
C#CCN1CCC([C@H](C)NC(=O)[C@@H](C)CCc2ccc(F)cc2)CC1	ZINC001755848856	1440934263	/nfs/dbraw/zinc/93/42/63/1440934263.db2.gz	NIYPBPQSBVDXBI-IRXDYDNUSA-N	0	3	344.474	3.244	20	30		EGEDHN
CC#CCN1CCC([C@H](C)NC(=O)Cc2ccccc2Cl)CC1	ZINC001755850934	1440934972	/nfs/dbraw/zinc/93/49/72/1440934972.db2.gz	OMHWQIGAGNNQHW-HNNXBMFYSA-N	0	3	332.875	3.123	20	30		EGEDHN
C=CCOCCN1CC=C(CNC(=O)[C@@]2(C)CC=C(C)CC2)CC1	ZINC001755899208	1440943447	/nfs/dbraw/zinc/94/34/47/1440943447.db2.gz	FAHXIMMPYXLULJ-FQEVSTJZSA-N	0	3	332.488	3.074	20	30		EGEDHN
CC(C)C[N@H+](CCC(C)(C)C#N)Cc1ccc(-c2nnn[n-]2)cc1	ZINC000824255557	946635427	/nfs/dbraw/zinc/63/54/27/946635427.db2.gz	NZOCQIYJKVCHLC-UHFFFAOYSA-N	0	3	326.448	3.265	20	30		EGEDHN
CC(C)C[N@@H+](CCC(C)(C)C#N)Cc1ccc(-c2nnn[n-]2)cc1	ZINC000824255557	946635429	/nfs/dbraw/zinc/63/54/29/946635429.db2.gz	NZOCQIYJKVCHLC-UHFFFAOYSA-N	0	3	326.448	3.265	20	30		EGEDHN
CC(C)C[N@H+](CCC(C)(C)C#N)Cc1ccc(-c2nn[n-]n2)cc1	ZINC000824255557	946635438	/nfs/dbraw/zinc/63/54/38/946635438.db2.gz	NZOCQIYJKVCHLC-UHFFFAOYSA-N	0	3	326.448	3.265	20	30		EGEDHN
CC(C)C[N@@H+](CCC(C)(C)C#N)Cc1ccc(-c2nn[n-]n2)cc1	ZINC000824255557	946635448	/nfs/dbraw/zinc/63/54/48/946635448.db2.gz	NZOCQIYJKVCHLC-UHFFFAOYSA-N	0	3	326.448	3.265	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)NCCN1CCC(C)CC1	ZINC000066178440	215018925	/nfs/dbraw/zinc/01/89/25/215018925.db2.gz	VZJKXPGVKOPPHQ-UHFFFAOYSA-N	0	3	342.487	3.210	20	30		EGEDHN
Cc1ccc([C@@H](CN[C@@H](C)c2ccc(C#N)cc2)N2CCOCC2)o1	ZINC000181423814	234181774	/nfs/dbraw/zinc/18/17/74/234181774.db2.gz	CEQGYJHRCOSARS-QFBILLFUSA-N	0	3	339.439	3.184	20	30		EGEDHN
C[C@H](N[C@H]1CN(Cc2ccccc2)CC[C@@H]1CO)c1ccc(C#N)cc1	ZINC000181784541	234322547	/nfs/dbraw/zinc/32/25/47/234322547.db2.gz	GLFDUJFRQLJVEU-WTOYTKOKSA-N	0	3	349.478	3.092	20	30		EGEDHN
N#Cc1ccc(CC(=O)N2C[C@@H]3CCCN3Cc3ccccc32)cc1	ZINC000194746165	283137083	/nfs/dbraw/zinc/13/70/83/283137083.db2.gz	RNOULFIRUGBXCQ-IBGZPJMESA-N	0	3	331.419	3.112	20	30		EGEDHN
N#Cc1cnc2c(F)cc(F)cc2c1N1CC[C@H](N2CCCCC2)C1	ZINC000352325695	283240045	/nfs/dbraw/zinc/24/00/45/283240045.db2.gz	VSLYGSMRAFTBGN-HNNXBMFYSA-N	0	3	342.393	3.449	20	30		EGEDHN
CN(C)C1(CN(C)C(=O)CCCCOc2cccc(C#N)c2)CCC1	ZINC000188040709	236399267	/nfs/dbraw/zinc/39/92/67/236399267.db2.gz	LERGXUQTZWWQDA-UHFFFAOYSA-N	0	3	343.471	3.050	20	30		EGEDHN
COCc1ccc([C@@H]2CCCN2C[C@H](O)c2ccc(C#N)cc2)o1	ZINC000131292473	223219924	/nfs/dbraw/zinc/21/99/24/223219924.db2.gz	GULUWNDYUAWEEV-ROUUACIJSA-N	0	3	326.396	3.168	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H]2CCc3cc(C)ccc32)CC1	ZINC000264321333	246347516	/nfs/dbraw/zinc/34/75/16/246347516.db2.gz	AYXYAFZHRRKYHN-IBGZPJMESA-N	0	3	327.472	3.322	20	30		EGEDHN
C#CCCOc1ccc(CNCc2ccc(OCCOC)cc2)cc1	ZINC000264959217	247087313	/nfs/dbraw/zinc/08/73/13/247087313.db2.gz	NJDSIARVWCOLBJ-UHFFFAOYSA-N	0	3	339.435	3.404	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N(CC)C[C@H]1CCN(Cc2ccccc2)C1	ZINC000266527815	248346100	/nfs/dbraw/zinc/34/61/00/248346100.db2.gz	JSPVQQFPUMBYFQ-ICSRJNTNSA-N	0	3	344.499	3.338	20	30		EGEDHN
CCN(C(=O)c1c[nH]c(C#N)c1)[C@H]1CCN([C@@H](C)c2ccccc2)C1	ZINC000378477007	169127039	/nfs/dbraw/zinc/12/70/39/169127039.db2.gz	XFSCRNQWSYJQRR-KXBFYZLASA-N	0	3	336.439	3.184	20	30		EGEDHN
CN(CCOc1ccccc1Cl)C[C@H](O)c1ccc(C#N)cc1	ZINC000268605482	252061908	/nfs/dbraw/zinc/06/19/08/252061908.db2.gz	JOQUMLTUPKIPGA-KRWDZBQOSA-N	0	3	330.815	3.256	20	30		EGEDHN
C[C@H](c1ccc([S@@](C)=O)cc1)N(C)C[C@H](O)c1ccc(C#N)cc1	ZINC000268729308	252179281	/nfs/dbraw/zinc/17/92/81/252179281.db2.gz	XAXHDLFYAKTBBS-LTJBIVKBSA-N	0	3	342.464	3.022	20	30		EGEDHN
N#Cc1ccc(CNc2ccccc2CN2CCC(O)CC2)s1	ZINC000119601883	221357901	/nfs/dbraw/zinc/35/79/01/221357901.db2.gz	LBTIQGNJDNIDRP-UHFFFAOYSA-N	0	3	327.453	3.189	20	30		EGEDHN
COc1ccc(CNC[C@@H](c2c(F)cccc2F)N(C)C)cc1C#N	ZINC000174399095	533665210	/nfs/dbraw/zinc/66/52/10/533665210.db2.gz	RLQIRPFIKLODDL-KRWDZBQOSA-N	0	3	345.393	3.238	20	30		EGEDHN
Cn1cc(CN2CC[C@@H](COC(F)F)C2)c(-c2ccc(C#N)cc2)n1	ZINC000353027192	141287109	/nfs/dbraw/zinc/28/71/09/141287109.db2.gz	MJZHWCSWWFCQLD-CQSZACIVSA-N	0	3	346.381	3.020	20	30		EGEDHN
CCO[C@H]1C[C@H](NCC(=O)Nc2sccc2C#N)C1(CC)CC	ZINC000187051042	144150970	/nfs/dbraw/zinc/15/09/70/144150970.db2.gz	MVMGXGBYNDCCNS-KBPBESRZSA-N	0	3	335.473	3.132	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN[C@H]2CCCc3c(O)cccc32)c1	ZINC000192368495	144173423	/nfs/dbraw/zinc/17/34/23/144173423.db2.gz	PYEBYVCJSZVCOZ-SFHVURJKSA-N	0	3	335.407	3.260	20	30		EGEDHN
N#Cc1cccc(F)c1CC(=O)N1C[C@H]2CCCN2Cc2ccccc21	ZINC000341380932	155258324	/nfs/dbraw/zinc/25/83/24/155258324.db2.gz	OXHWAGCHGAJRRU-QGZVFWFLSA-N	0	3	349.409	3.251	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CCc1ccc(C#N)cc1	ZINC000119564103	152214769	/nfs/dbraw/zinc/21/47/69/152214769.db2.gz	VSOXAOSCPYCJSV-UWJYYQICSA-N	0	3	347.462	3.128	20	30		EGEDHN
CCOC[C@H](N[C@@H](C)C(=O)Nc1ccc(C#N)c(Cl)c1)C(C)C	ZINC000189814558	153099457	/nfs/dbraw/zinc/09/94/57/153099457.db2.gz	KJNWESPNIJMEAY-LRDDRELGSA-N	0	3	337.851	3.189	20	30		EGEDHN
Cc1cccc([C@@H](O)CNCc2cn(C)nc2-c2ccc(C#N)cc2)c1	ZINC000305820821	154131354	/nfs/dbraw/zinc/13/13/54/154131354.db2.gz	QHMSAJNRSYTVDX-FQEVSTJZSA-N	0	3	346.434	3.090	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)N(C)CCN1CCCC1	ZINC000339916995	155031822	/nfs/dbraw/zinc/03/18/22/155031822.db2.gz	LMUAFIJNJKSLKB-UHFFFAOYSA-N	0	3	327.453	3.249	20	30		EGEDHN
COCCN(C)CC[C@H](NCc1cccc(C#N)c1)c1ccccc1	ZINC000348848524	156261675	/nfs/dbraw/zinc/26/16/75/156261675.db2.gz	MQMQKJYDSHBRGR-NRFANRHFSA-N	0	3	337.467	3.357	20	30		EGEDHN
CCN(CCN1CCCCCC1)C(=O)Nc1cc(C#N)ccc1OC	ZINC000349090004	156350651	/nfs/dbraw/zinc/35/06/51/156350651.db2.gz	UKYUTLAYMFGPKC-UHFFFAOYSA-N	0	3	344.459	3.297	20	30		EGEDHN
CN(C)CCNC(=O)c1ccccc1SCc1ccc(C#N)cc1	ZINC000125540933	162277230	/nfs/dbraw/zinc/27/72/30/162277230.db2.gz	BFCIRBDVKRGGRE-UHFFFAOYSA-N	0	3	339.464	3.142	20	30		EGEDHN
C[C@@H](NCCS(=O)(=O)c1ccc(C#N)cc1)[C@@H](C)c1ccccc1	ZINC000181525714	162793786	/nfs/dbraw/zinc/79/37/86/162793786.db2.gz	FMVUDPBECLMNHI-HZPDHXFCSA-N	0	3	342.464	3.114	20	30		EGEDHN
CCN1CCC[C@H]1CNc1c(C#N)cnc2c(F)ccc(Cl)c21	ZINC000338389660	163221240	/nfs/dbraw/zinc/22/12/40/163221240.db2.gz	ZHQASXXLAPUEEO-LBPRGKRZSA-N	0	3	332.810	3.217	20	30		EGEDHN
CN(CCOCc1ccc(C#N)cc1)C[C@H](O)CCc1ccccc1	ZINC000344076636	164098103	/nfs/dbraw/zinc/09/81/03/164098103.db2.gz	VJVXRAQLWFMYIW-OAQYLSRUSA-N	0	3	338.451	3.000	20	30		EGEDHN
C[C@@H](N[C@H](Cc1ccccc1)C(=O)N1CCCC1)c1ccc(C#N)cc1	ZINC000181638433	287064795	/nfs/dbraw/zinc/06/47/95/287064795.db2.gz	DXRMVUYGPKPROO-DYESRHJHSA-N	0	3	347.462	3.443	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)NC[C@H](C)N1CCCC[C@@H]1C	ZINC000352400085	165381510	/nfs/dbraw/zinc/38/15/10/165381510.db2.gz	BJGQLRBIVCJSDE-GJZGRUSLSA-N	0	3	344.459	3.341	20	30		EGEDHN
CC(C)(C)CCN1CCN(C(=O)Nc2ccc(C#N)c(F)c2)CC1	ZINC000353558341	165804944	/nfs/dbraw/zinc/80/49/44/165804944.db2.gz	ITIQAPNBOOMCLY-UHFFFAOYSA-N	0	3	332.423	3.283	20	30		EGEDHN
CN(C)[C@@H](CNc1ccc(C#N)c([N+](=O)[O-])c1)c1cccc(F)c1	ZINC000357310281	166643650	/nfs/dbraw/zinc/64/36/50/166643650.db2.gz	GMUFVKKRJPOECR-KRWDZBQOSA-N	0	3	328.347	3.320	20	30		EGEDHN
C[C@H](NC1CCN(Cc2ccc(C#N)cc2)CC1)c1cncc(F)c1	ZINC000359243285	167104567	/nfs/dbraw/zinc/10/45/67/167104567.db2.gz	QKIAGUOFXFIFPD-HNNXBMFYSA-N	0	3	338.430	3.408	20	30		EGEDHN
C[C@@H]1COc2ccccc2CN1CCC(=O)Nc1ccc(C#N)cc1	ZINC000359891425	167260014	/nfs/dbraw/zinc/26/00/14/167260014.db2.gz	BNZKCGOHUGFKLE-OAHLLOKOSA-N	0	3	335.407	3.170	20	30		EGEDHN
N#Cc1ccc(Br)c(CN2CC[C@H]([C@@H]3CCOC3)C2)c1	ZINC000365192977	168033093	/nfs/dbraw/zinc/03/30/93/168033093.db2.gz	YTEVJGPJBRIWOZ-UONOGXRCSA-N	0	3	335.245	3.179	20	30		EGEDHN
N#Cc1ccccc1OCCN1CCC2(CC1)OCc1ccccc12	ZINC000366115727	168084659	/nfs/dbraw/zinc/08/46/59/168084659.db2.gz	UBITUBYRPZLTCN-UHFFFAOYSA-N	0	3	334.419	3.459	20	30		EGEDHN
N#Cc1ccc(OC2CCN(CCO[C@H]3CCCCO3)CC2)c(F)c1	ZINC000367583400	168244894	/nfs/dbraw/zinc/24/48/94/168244894.db2.gz	CTZTVPMUWGCETF-IBGZPJMESA-N	0	3	348.418	3.084	20	30		EGEDHN
CSc1ccc([C@@H](CNc2cc(C)ncc2C#N)N(C)C)cc1	ZINC000425265407	270049369	/nfs/dbraw/zinc/04/93/69/270049369.db2.gz	DHXSVPJMEVTLNJ-GOSISDBHSA-N	0	3	326.469	3.120	20	30		EGEDHN
N#Cc1ccccc1COc1cccc(CNC[C@H](O)C2CCC2)c1	ZINC000449741100	270052852	/nfs/dbraw/zinc/05/28/52/270052852.db2.gz	SNFVZZRLSNFSOS-NRFANRHFSA-N	0	3	336.435	3.388	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@H](Cc2ccccc2)C2CC2)cc1	ZINC000470974064	270055153	/nfs/dbraw/zinc/05/51/53/270055153.db2.gz	GVQLCSUWSUPVRL-NHCUHLMSSA-N	0	3	343.430	3.378	20	30		EGEDHN
N#Cc1ccccc1COc1cccc(CNCCN2CC=CCC2)c1	ZINC000475498282	270055593	/nfs/dbraw/zinc/05/55/93/270055593.db2.gz	WHSZFQZXMKHOAX-UHFFFAOYSA-N	0	3	347.462	3.489	20	30		EGEDHN
Cc1cc(Oc2ncccc2C#N)ccc1NC(=O)/C=C/CN(C)C	ZINC000491644877	270058220	/nfs/dbraw/zinc/05/82/20/270058220.db2.gz	QWXUHQSHUKHXHJ-FNORWQNLSA-N	0	3	336.395	3.110	20	30		EGEDHN
CCC[C@@H](CC)NC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000195395576	266180848	/nfs/dbraw/zinc/18/08/48/266180848.db2.gz	LFIKIYWYJJBYGC-GOSISDBHSA-N	0	3	330.476	3.210	20	30		EGEDHN
CCOC(=O)Nc1ccc(NC2CCN(C3CC3)CC2)cc1C#N	ZINC000297361070	266267139	/nfs/dbraw/zinc/26/71/39/266267139.db2.gz	FUWDFEYBYPNUHQ-UHFFFAOYSA-N	0	3	328.416	3.165	20	30		EGEDHN
CN(C)Cc1cccc(NC(=O)NCc2cc(C#N)ccc2F)c1	ZINC000174869616	266505983	/nfs/dbraw/zinc/50/59/83/266505983.db2.gz	VZJRFBCVRIBUCY-UHFFFAOYSA-N	0	3	326.375	3.081	20	30		EGEDHN
C[C@@H](c1ccncc1)N1CCC(Nc2c(C#N)cccc2C#N)CC1	ZINC000302900440	267005349	/nfs/dbraw/zinc/00/53/49/267005349.db2.gz	SOQWWYMOGNBMEI-HNNXBMFYSA-N	0	3	331.423	3.462	20	30		EGEDHN
CCN(CC)C(=O)C1(NCc2ccc(C#N)c(OC)c2)CCCCC1	ZINC000440834958	267056189	/nfs/dbraw/zinc/05/61/89/267056189.db2.gz	WFAOIWKABGGLJX-UHFFFAOYSA-N	0	3	343.471	3.228	20	30		EGEDHN
C[C@@H]1Oc2cc(F)ccc2[C@H]1NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000360325033	267102219	/nfs/dbraw/zinc/10/22/19/267102219.db2.gz	MNFGBUXIYQGUTL-ODYMNIRHSA-N	0	3	349.365	3.018	20	30		EGEDHN
C[C@H](CCc1ccc(O)cc1)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000350476205	267154220	/nfs/dbraw/zinc/15/42/20/267154220.db2.gz	JLCAFYXZFFQTFG-DNVCBOLYSA-N	0	3	347.418	3.084	20	30		EGEDHN
C[C@H](NCCOc1cccc(C#N)c1)c1ccc(Br)cn1	ZINC000280644340	267183459	/nfs/dbraw/zinc/18/34/59/267183459.db2.gz	YLLLOFGXEJAGTI-LBPRGKRZSA-N	0	3	346.228	3.445	20	30		EGEDHN
C[C@H](O)C[C@H]1CCCCCN1Cc1nnc(-c2ccc(C#N)cc2)o1	ZINC000286059599	267193441	/nfs/dbraw/zinc/19/34/41/267193441.db2.gz	RLJPXOAKPNCCHG-WMLDXEAASA-N	0	3	340.427	3.124	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@H]1Nc1cc(C#N)ccc1[N+](=O)[O-]	ZINC000302211476	267234990	/nfs/dbraw/zinc/23/49/90/267234990.db2.gz	MNEAFKTXKBUQPV-KBXCAEBGSA-N	0	3	336.395	3.399	20	30		EGEDHN
C[C@H]1CN(Cc2ccc(CNCc3ccc(C#N)o3)cc2)C[C@H](C)O1	ZINC000174257371	267235017	/nfs/dbraw/zinc/23/50/17/267235017.db2.gz	FYFDDSJXZRLLBR-HOTGVXAUSA-N	0	3	339.439	3.050	20	30		EGEDHN
CN(C)CCOc1ccc(CNc2cccc(C#N)c2[N+](=O)[O-])cc1	ZINC000450261313	267281547	/nfs/dbraw/zinc/28/15/47/267281547.db2.gz	NNBDTKZZDAKZSG-UHFFFAOYSA-N	0	3	340.383	3.019	20	30		EGEDHN
CN(C)[C@@H]1Cc2ccccc2N(C(=O)[C@@H]2C[C@H]2c2cccc(C#N)c2)C1	ZINC000413408248	267287159	/nfs/dbraw/zinc/28/71/59/267287159.db2.gz	MKXQNXXROBAIHO-HSALFYBXSA-N	0	3	345.446	3.181	20	30		EGEDHN
CN1CCC(N(Cc2ccco2)C(=O)/C=C\c2ccc(C#N)cc2)CC1	ZINC000490946566	267332346	/nfs/dbraw/zinc/33/23/46/267332346.db2.gz	DIZLXWJFGFIAAU-HJWRWDBZSA-N	0	3	349.434	3.287	20	30		EGEDHN
N#Cc1ccc(C2=CCN(Cc3cc4c(cc3O)OCO4)CC2)cc1	ZINC000361066886	268055292	/nfs/dbraw/zinc/05/52/92/268055292.db2.gz	BRHNECQQBNSFEU-UHFFFAOYSA-N	0	3	334.375	3.282	20	30		EGEDHN
N#Cc1ccc(CNCCOc2cccc(C(F)(F)F)n2)s1	ZINC000270298440	268074243	/nfs/dbraw/zinc/07/42/43/268074243.db2.gz	RFJHWTQVQGMFMO-UHFFFAOYSA-N	0	3	327.331	3.202	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@H]2C[C@H](c3ccccc3F)C2)cc1	ZINC000280744769	268086725	/nfs/dbraw/zinc/08/67/25/268086725.db2.gz	SMPUZLWGPPTGDW-BZSNNMDCSA-N	0	3	347.393	3.442	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CC[C@H](c3ccc(F)cc3)C2)cc1	ZINC000280199794	268090021	/nfs/dbraw/zinc/09/00/21/268090021.db2.gz	UPEIODBMKLQGRI-RBUKOAKNSA-N	0	3	347.393	3.396	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CSCCN2Cc2ccccc2)cc1	ZINC000428551787	268233412	/nfs/dbraw/zinc/23/34/12/268233412.db2.gz	XXNAXDCCBYGFCJ-FQEVSTJZSA-N	0	3	337.492	3.265	20	30		EGEDHN
N#Cc1cnc2c(F)c(F)c(F)cc2c1N1CCN(CC2CC2)CC1	ZINC000439105518	268314229	/nfs/dbraw/zinc/31/42/29/268314229.db2.gz	DWEDIOWNKDGANU-UHFFFAOYSA-N	0	3	346.356	3.056	20	30		EGEDHN
CCCN(CCN1C(=O)c2ccccc2C1=O)Cc1ccc(C#N)cc1	ZINC000047740721	275143258	/nfs/dbraw/zinc/14/32/58/275143258.db2.gz	JSBQKBSFWLMNKC-UHFFFAOYSA-N	0	3	347.418	3.066	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CC2(CCN(C)CC2)Oc2ccccc21	ZINC000179743633	275379157	/nfs/dbraw/zinc/37/91/57/275379157.db2.gz	JREKKAGXNRBDJG-GOSISDBHSA-N	0	3	340.467	3.284	20	30		EGEDHN
CC(C)(CO)[C@@H](NCCOc1cccc(C#N)c1)c1cccs1	ZINC000289366931	276328639	/nfs/dbraw/zinc/32/86/39/276328639.db2.gz	OSOUHGLZWHUNHV-KRWDZBQOSA-N	0	3	330.453	3.348	20	30		EGEDHN
CS[C@@H]1CN(c2c(C#N)cnc3c(C)cc(C)cc32)C[C@H]1N(C)C	ZINC000340732506	278156561	/nfs/dbraw/zinc/15/65/61/278156561.db2.gz	AMLIUZXCYXOAEN-IAGOWNOFSA-N	0	3	340.496	3.205	20	30		EGEDHN
CC[C@H](N[C@H](C)C(=O)Nc1ccc(C#N)c(Cl)c1)[C@@H]1CCCO1	ZINC000248642663	308008373	/nfs/dbraw/zinc/00/83/73/308008373.db2.gz	ZUIAHMFWCSABCL-RLCCDNCMSA-N	0	3	335.835	3.086	20	30		EGEDHN
C[C@]1(NC[C@@H](O)COc2ccc(C#N)cc2)CCCc2ccccc21	ZINC000537605233	314195012	/nfs/dbraw/zinc/19/50/12/314195012.db2.gz	LFMLBUYZLQFTQY-NQIIRXRSSA-N	0	3	336.435	3.139	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1)C(=O)c1ccc(Cl)c(C#N)c1	ZINC000539785196	314337331	/nfs/dbraw/zinc/33/73/31/314337331.db2.gz	GWNLSRFUMJSXBA-UHFFFAOYSA-N	0	3	341.842	3.416	20	30		EGEDHN
CN(C)[C@H](CNc1nccc(C#N)c1Cl)c1ccc(Cl)cc1	ZINC000561261906	315752548	/nfs/dbraw/zinc/75/25/48/315752548.db2.gz	JSNHNBYRZZTEKT-CQSZACIVSA-N	0	3	335.238	3.397	20	30		EGEDHN
Cc1cc(CN[C@@H]2CCN(C(=O)Nc3ccccc3)C2)ccc1C#N	ZINC000572061648	317285749	/nfs/dbraw/zinc/28/57/49/317285749.db2.gz	VPKKJTBHOPIWAC-LJQANCHMSA-N	0	3	334.423	3.263	20	30		EGEDHN
C[C@@]1(NC(=O)CCc2ccc(C#N)cc2)CCN(Cc2ccccc2)C1	ZINC000572770430	317389072	/nfs/dbraw/zinc/38/90/72/317389072.db2.gz	SRIKEMHFNXRKAZ-JOCHJYFZSA-N	0	3	347.462	3.272	20	30		EGEDHN
COc1ccc(Cl)cc1NC(=O)CCNCc1ccc(C#N)cc1	ZINC000176749397	323333497	/nfs/dbraw/zinc/33/34/97/323333497.db2.gz	FDSKLRFFPUUHDJ-UHFFFAOYSA-N	0	3	343.814	3.339	20	30		EGEDHN
COc1ccc(Cl)cc1NC(=O)CCNCc1ccc(C#N)s1	ZINC000176981488	323335260	/nfs/dbraw/zinc/33/52/60/323335260.db2.gz	SERVNWPLQKUFOV-UHFFFAOYSA-N	0	3	349.843	3.400	20	30		EGEDHN
C[C@@H](NCCOc1cccc(C#N)c1)c1cccc(N2CCCC2=O)c1	ZINC000181446372	323483516	/nfs/dbraw/zinc/48/35/16/323483516.db2.gz	RBYINVWCRSGNNO-MRXNPFEDSA-N	0	3	349.434	3.415	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@@H](C)N1CC[C@H](c2ccccc2OC)C1	ZINC000158101717	455269886	/nfs/dbraw/zinc/26/98/86/455269886.db2.gz	PSEAQAJJCVPMFM-SJORKVTESA-N	0	3	328.456	3.074	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@H]2C[C@@H](O)C2(C)C)cc1OC	ZINC000623496765	460580461	/nfs/dbraw/zinc/58/04/61/460580461.db2.gz	JLXOAFWJMGRSGE-LSDHHAIUSA-N	0	3	325.836	3.162	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@H]1CCCC[C@H]1NCc1ccc(C#N)cc1	ZINC000075107972	453861902	/nfs/dbraw/zinc/86/19/02/453861902.db2.gz	CCSCNGXXQFKQNG-IAGOWNOFSA-N	0	3	329.444	3.484	20	30		EGEDHN
C=CCN(CCC(=O)Nc1cc(N)ccc1F)CCc1ccccc1	ZINC000083169545	453940389	/nfs/dbraw/zinc/94/03/89/453940389.db2.gz	OBTPTLLHDJLPFJ-UHFFFAOYSA-N	0	3	341.430	3.467	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@](C)(NCc1cccc(C#N)c1)C1CC1	ZINC000083456032	453949621	/nfs/dbraw/zinc/94/96/21/453949621.db2.gz	SFALHHVNJLOYKO-IBGZPJMESA-N	0	3	329.444	3.341	20	30		EGEDHN
N#Cc1csc(C(=O)N2CCCN(CC3CCCCC3)CC2)c1	ZINC000084182363	453975674	/nfs/dbraw/zinc/97/56/74/453975674.db2.gz	BHUNLEQTGFVTOZ-UHFFFAOYSA-N	0	3	331.485	3.348	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN1CCN(C2CCC(C(C)C)CC2)CC1	ZINC000084681278	454005729	/nfs/dbraw/zinc/00/57/29/454005729.db2.gz	VIWIWRFBZMGMDL-UHFFFAOYSA-N	0	3	347.547	3.019	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC[C@@H](Cc3ccc(F)cc3)C2)CC1	ZINC000076984282	454056420	/nfs/dbraw/zinc/05/64/20/454056420.db2.gz	IWCBCRULELANRU-KRWDZBQOSA-N	0	3	345.462	3.050	20	30		EGEDHN
C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)CCN1CCCC1	ZINC000077203850	454074473	/nfs/dbraw/zinc/07/44/73/454074473.db2.gz	WMVWVWAEEMCLIQ-HNNXBMFYSA-N	0	3	346.500	3.498	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](O)COc2cccc3ccccc32)cc1	ZINC000069160586	454084014	/nfs/dbraw/zinc/08/40/14/454084014.db2.gz	GQYGLIUZACFDOW-IBGZPJMESA-N	0	3	332.403	3.241	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1CCCc2sccc2C1	ZINC000077283653	454086087	/nfs/dbraw/zinc/08/60/87/454086087.db2.gz	QZCYFTBBDODLJB-UHFFFAOYSA-N	0	3	328.437	3.456	20	30		EGEDHN
COc1ccccc1N(CCC#N)C(=O)[C@H](C)N(C)CC1CCCC1	ZINC000069227553	454088551	/nfs/dbraw/zinc/08/85/51/454088551.db2.gz	VINPWWPCJGAESC-INIZCTEOSA-N	0	3	343.471	3.452	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)NCc1cccc(C#N)c1)C(C)C	ZINC000046039001	454210611	/nfs/dbraw/zinc/21/06/11/454210611.db2.gz	MAZNNEUBVJNGNE-IBGZPJMESA-N	0	3	340.471	3.056	20	30		EGEDHN
C[C@H]1CN(CC2CCN(Cc3ccc(F)c(C#N)c3)CC2)C[C@H](C)O1	ZINC000119795573	454221438	/nfs/dbraw/zinc/22/14/38/454221438.db2.gz	MVDPYRMTEOCRMS-HOTGVXAUSA-N	0	3	345.462	3.019	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNc1nnnn1-c1ccc(C)cc1)C(C)C	ZINC000071964278	454262491	/nfs/dbraw/zinc/26/24/91/454262491.db2.gz	CQRKBCZDMCJVFC-SFHVURJKSA-N	0	3	340.475	3.081	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)Cc2nc3ccccc3s2)CC1	ZINC000078545615	454273152	/nfs/dbraw/zinc/27/31/52/454273152.db2.gz	DKLLMLITSCIYPZ-UHFFFAOYSA-N	0	3	344.484	3.088	20	30		EGEDHN
C#CCOc1ccc([C@H](C)N[C@@H](CCO)c2ccc(OC)cc2)cc1	ZINC000120373896	454292724	/nfs/dbraw/zinc/29/27/24/454292724.db2.gz	RXEFNTCIBYQJBJ-KKSFZXQISA-N	0	3	339.435	3.482	20	30		EGEDHN
N#CC(C(=O)c1cccc(OC(F)F)c1)c1nnc2n1CCCCC2	ZINC000060851147	454316984	/nfs/dbraw/zinc/31/69/84/454316984.db2.gz	GYVXIWRRGRVUNS-ZDUSSCGKSA-N	0	3	346.337	3.096	20	30		EGEDHN
C#CCN1CCC(C(=O)NCC(C)(C)Cc2cccc(Cl)c2)CC1	ZINC000132278499	454327269	/nfs/dbraw/zinc/32/72/69/454327269.db2.gz	WPVGDVPUIBMFIF-UHFFFAOYSA-N	0	3	346.902	3.370	20	30		EGEDHN
N#CC(C(=O)c1cccc(OC(F)F)c1)c1nnc2n1CCCCC2	ZINC000072678677	454327298	/nfs/dbraw/zinc/32/72/98/454327298.db2.gz	GYVXIWRRGRVUNS-CYBMUJFWSA-N	0	3	346.337	3.096	20	30		EGEDHN
C=CCn1c(SCCN2CCCCC2)nnc1-c1ccncc1	ZINC000078927299	454337913	/nfs/dbraw/zinc/33/79/13/454337913.db2.gz	PUIAOTHEKHJPAC-UHFFFAOYSA-N	0	3	329.473	3.104	20	30		EGEDHN
C[C@H](O)[C@H](C)SCC(=O)C(C#N)c1nc(-c2ccccc2)cs1	ZINC000079064863	454363191	/nfs/dbraw/zinc/36/31/91/454363191.db2.gz	CBPPLTXCWJGWJC-SGMGOOAPSA-N	0	3	346.477	3.489	20	30		EGEDHN
Cc1nn(C)c2ncc(C(=O)C(C#N)c3ccc4ccccc4n3)cc12	ZINC000047376289	454365514	/nfs/dbraw/zinc/36/55/14/454365514.db2.gz	IMPQSWIEKZQHPZ-INIZCTEOSA-N	0	3	341.374	3.315	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CCC(OCC(C)C)CC1	ZINC000079391422	454407705	/nfs/dbraw/zinc/40/77/05/454407705.db2.gz	YKBGQYDFHBWVPF-IBGZPJMESA-N	0	3	347.499	3.292	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(c3nc4ccccc4[nH]3)CC2)cc1	ZINC000073260136	454413880	/nfs/dbraw/zinc/41/38/80/454413880.db2.gz	OPXZGJFTHFVJOP-UHFFFAOYSA-N	0	3	331.423	3.147	20	30		EGEDHN
CC[C@H]1CCCCN1CCNC(=O)c1cccc(SCC#N)c1	ZINC000079545745	454436067	/nfs/dbraw/zinc/43/60/67/454436067.db2.gz	CDIOBMLUNPMOOT-INIZCTEOSA-N	0	3	331.485	3.297	20	30		EGEDHN
C[C@H]1CN(CC2CCN(c3ccc(F)cc3C#N)CC2)C[C@H](C)O1	ZINC000091478917	454440120	/nfs/dbraw/zinc/44/01/20/454440120.db2.gz	DGHVYJPCGKEYAA-GJZGRUSLSA-N	0	3	331.435	3.023	20	30		EGEDHN
C[C@@H](CN1CCCCC1)NC(=O)N[C@H](CCC#N)c1ccccc1	ZINC000133798846	454468245	/nfs/dbraw/zinc/46/82/45/454468245.db2.gz	AJBGLFFMHHQLBO-FUHWJXTLSA-N	0	3	328.460	3.205	20	30		EGEDHN
Cc1noc(C)c1CON=C(N)c1cccc(CN2CCCCC2)c1	ZINC000101540832	454472923	/nfs/dbraw/zinc/47/29/23/454472923.db2.gz	OFUQSNVUEOKJKQ-UHFFFAOYSA-N	0	3	342.443	3.114	20	30		EGEDHN
Cc1nnc(NC[C@@H]2CCCN(Cc3cccs3)C2)c(C#N)c1C	ZINC000064550861	454490838	/nfs/dbraw/zinc/49/08/38/454490838.db2.gz	OAXXBNHOGNICCO-HNNXBMFYSA-N	0	3	341.484	3.351	20	30		EGEDHN
C[C@H]1CCc2c(C(=O)C(C#N)C(=O)Nc3ccccn3)csc2C1	ZINC000102387402	454503251	/nfs/dbraw/zinc/50/32/51/454503251.db2.gz	VCPROIRKSMYFKZ-WCQYABFASA-N	0	3	339.420	3.229	20	30		EGEDHN
C=CCOc1c(Br)cc(CNC[C@H](C)OC)cc1OC	ZINC000191144858	455451282	/nfs/dbraw/zinc/45/12/82/455451282.db2.gz	DWNRMHVNQBPMIT-NSHDSACASA-N	0	3	344.249	3.147	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)CCC1CCCC1	ZINC000065931263	454641226	/nfs/dbraw/zinc/64/12/26/454641226.db2.gz	CKMIAWPXZKQVAP-UHFFFAOYSA-N	0	3	327.472	3.419	20	30		EGEDHN
CCCNC(=O)[C@H]1CCCN(Cc2ccccc2C(C)(C)C#N)C1	ZINC000135162104	454641208	/nfs/dbraw/zinc/64/12/08/454641208.db2.gz	JERIFAZTKPSYAX-KRWDZBQOSA-N	0	3	327.472	3.226	20	30		EGEDHN
C=CCN(CCc1ccccc1)CCc1nc2ccccc2c(=O)[nH]1	ZINC000065959273	454645487	/nfs/dbraw/zinc/64/54/87/454645487.db2.gz	ACLSVKVEFFGOGK-UHFFFAOYSA-N	0	3	333.435	3.196	20	30		EGEDHN
C=CCCOCC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000606310183	460647220	/nfs/dbraw/zinc/64/72/20/460647220.db2.gz	KYTRLLQYARRAGD-PKOBYXMFSA-N	0	3	330.472	3.091	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2csc(-c3ccc(C)o3)n2)CC1	ZINC000106036446	454674268	/nfs/dbraw/zinc/67/42/68/454674268.db2.gz	FYQMSXQFFDXDIW-UHFFFAOYSA-N	0	3	345.468	3.482	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cnc3onc(C(C)C)c3c2)CC1	ZINC000106037383	454674997	/nfs/dbraw/zinc/67/49/97/454674997.db2.gz	LQGRJFKXTMPQEX-UHFFFAOYSA-N	0	3	342.443	3.117	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2ccccc2COCC)CC1	ZINC000106259039	454688653	/nfs/dbraw/zinc/68/86/53/454688653.db2.gz	CQFSWUDHHWKZMQ-UHFFFAOYSA-N	0	3	345.487	3.063	20	30		EGEDHN
CC[C@]1(NCC(=O)Nc2ccccc2S[C@H](C)CC#N)CCOC1	ZINC000616865340	460648440	/nfs/dbraw/zinc/64/84/40/460648440.db2.gz	LGKZWHLUBCWUIT-KDOFPFPSSA-N	0	3	347.484	3.178	20	30		EGEDHN
Cc1cc(C)cc(N(CCC#N)C(=O)CN2C[C@@H]3CCC[C@@H]3C2)c1	ZINC000152811827	454729185	/nfs/dbraw/zinc/72/91/85/454729185.db2.gz	TUWDMTVILMIZIS-HDICACEKSA-N	0	3	325.456	3.282	20	30		EGEDHN
CC(C)[C@H](CCO)NCC(=O)Nc1ccccc1S[C@H](C)CC#N	ZINC000161852205	454729554	/nfs/dbraw/zinc/72/95/54/454729554.db2.gz	BUYUMIROCREHNG-CABCVRRESA-N	0	3	349.500	3.016	20	30		EGEDHN
COc1cc(CN2CC[C@@H](Nc3ccc(C#N)cc3)C2)cc(OC)c1	ZINC000152964408	454747541	/nfs/dbraw/zinc/74/75/41/454747541.db2.gz	UDPQXDVNDDSPIH-GOSISDBHSA-N	0	3	337.423	3.262	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC[C@H](C)Oc2cccc(C)c2)CC1	ZINC000176501370	454752944	/nfs/dbraw/zinc/75/29/44/454752944.db2.gz	GQPWCLZWUSEJFO-KRWDZBQOSA-N	0	3	345.487	3.102	20	30		EGEDHN
COc1ccc([C@H](CNCc2ccc(C#N)s2)N(C)C)cc1OC	ZINC000176941654	454801021	/nfs/dbraw/zinc/80/10/21/454801021.db2.gz	AWSIVZAGFFIVFE-INIZCTEOSA-N	0	3	345.468	3.029	20	30		EGEDHN
Cc1ccc([C@@H](CNCc2ccc(C#N)s2)N2CCOCC2)cc1	ZINC000176951581	454803613	/nfs/dbraw/zinc/80/36/13/454803613.db2.gz	OGTKLJFRZDGOGN-LJQANCHMSA-N	0	3	341.480	3.091	20	30		EGEDHN
CC[C@@H](NCc1ccc(C#N)cc1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000153655084	454817945	/nfs/dbraw/zinc/81/79/45/454817945.db2.gz	TUFFSOYYLYGQKU-YADHBBJMSA-N	0	3	349.478	3.327	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2CCCc3sccc32)CC1	ZINC000163042417	454819524	/nfs/dbraw/zinc/81/95/24/454819524.db2.gz	AKFDZOZOOXRAHV-MRXNPFEDSA-N	0	3	333.501	3.465	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1	ZINC000143002714	454839881	/nfs/dbraw/zinc/83/98/81/454839881.db2.gz	SIRNYWIPVGXWNR-MJGOQNOKSA-N	0	3	330.472	3.229	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](C)Cc2ccc(C)s2)CC1	ZINC000125975937	454861138	/nfs/dbraw/zinc/86/11/38/454861138.db2.gz	WFYYJVLTRFOHLW-AWEZNQCLSA-N	0	3	335.517	3.327	20	30		EGEDHN
Cc1ccccc1[C@H](C(C)C)N(C)CC(=O)N[C@@](C)(C#N)C1CC1	ZINC000112357618	454885538	/nfs/dbraw/zinc/88/55/38/454885538.db2.gz	KSHJDLAATCZTJK-PMACEKPBSA-N	0	3	327.472	3.432	20	30		EGEDHN
C[C@@H](N[C@@H](C)c1ccc(C#N)cc1)c1cccc(NS(C)(=O)=O)c1	ZINC000154345699	454887356	/nfs/dbraw/zinc/88/73/56/454887356.db2.gz	ROLPKGNHXPYYPM-UONOGXRCSA-N	0	3	343.452	3.342	20	30		EGEDHN
CCN(CCC#N)C(=O)CN[C@@H](Cc1ccccc1)c1cccs1	ZINC000184995770	455484095	/nfs/dbraw/zinc/48/40/95/455484095.db2.gz	FYHIGJDMKMDALU-KRWDZBQOSA-N	0	3	341.480	3.384	20	30		EGEDHN
CCc1c(C(=O)C(C#N)c2nc3ccccc3n2C)cnn1CC(C)C	ZINC000165260672	454897246	/nfs/dbraw/zinc/89/72/46/454897246.db2.gz	YOYYFEYCOMMFIY-CQSZACIVSA-N	0	3	349.438	3.478	20	30		EGEDHN
CC(C)(CNC(=O)C(C)(C)Oc1ccc(C#N)cc1)N1CCCCC1	ZINC000155011672	454953926	/nfs/dbraw/zinc/95/39/26/454953926.db2.gz	CPGLXIWQVNSWFD-UHFFFAOYSA-N	0	3	343.471	3.096	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCC(OC(C)(C)C)CC2)CC1	ZINC000155594578	455020513	/nfs/dbraw/zinc/02/05/13/455020513.db2.gz	HTTKCVFBNGZLIG-UHFFFAOYSA-N	0	3	337.508	3.016	20	30		EGEDHN
CN(CCC#N)c1ccc(CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000128345767	455047048	/nfs/dbraw/zinc/04/70/48/455047048.db2.gz	GNGUZAMRELPUBL-IBGZPJMESA-N	0	3	343.471	3.202	20	30		EGEDHN
C#CCCCCNC(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000152019440	455062506	/nfs/dbraw/zinc/06/25/06/455062506.db2.gz	KVWFBVAVZBZQBP-HKUYNNGSSA-N	0	3	327.472	3.142	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@H](C)Oc2ccc(Cl)cc2C)CC1	ZINC000171725985	455089184	/nfs/dbraw/zinc/08/91/84/455089184.db2.gz	RBPSKMQKKJDYRF-AWEZNQCLSA-N	0	3	336.863	3.182	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)[C@H](C)c1c(C)noc1C)C(C)C	ZINC000156179021	455090186	/nfs/dbraw/zinc/09/01/86/455090186.db2.gz	BWZNQHQWAYVQPB-PBHICJAKSA-N	0	3	333.476	3.210	20	30		EGEDHN
C=CCCCN1CCC(C(=O)c2ccc3c(c2)NC(=O)[C@@H](C)O3)CC1	ZINC000117878130	455095142	/nfs/dbraw/zinc/09/51/42/455095142.db2.gz	VAANKDHPTDXIBD-CQSZACIVSA-N	0	3	342.439	3.267	20	30		EGEDHN
CCN(CC(=O)Nc1c(C#N)cnn1-c1ccccc1)[C@@H](C)C(C)C	ZINC000118833312	455113867	/nfs/dbraw/zinc/11/38/67/455113867.db2.gz	UIVZBXGIYUXTFS-HNNXBMFYSA-N	0	3	339.443	3.049	20	30		EGEDHN
COCc1ccccc1CNCc1cn(C)nc1-c1ccc(C#N)cc1	ZINC000180043000	455120792	/nfs/dbraw/zinc/12/07/92/455120792.db2.gz	BYGZGFQEEKIBBL-UHFFFAOYSA-N	0	3	346.434	3.395	20	30		EGEDHN
N#CCc1cccc(C(=O)NC[C@H]2CCCN2Cc2ccccc2)c1	ZINC000172112698	455124203	/nfs/dbraw/zinc/12/42/03/455124203.db2.gz	DWDATNMDMFCAJD-HXUWFJFHSA-N	0	3	333.435	3.147	20	30		EGEDHN
C=CCc1cc(CNCc2ccc(OCC#N)cc2)cc(OC)c1O	ZINC000172119604	455124410	/nfs/dbraw/zinc/12/44/10/455124410.db2.gz	VTAZZHSFCSOWMM-UHFFFAOYSA-N	0	3	338.407	3.321	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCc2cn(C)c3ccccc23)CC1	ZINC000152505327	455128413	/nfs/dbraw/zinc/12/84/13/455128413.db2.gz	KPLGDBUSADIKEY-UHFFFAOYSA-N	0	3	339.483	3.268	20	30		EGEDHN
CC(C)(C)C[C@@H](O)CNCc1cn(CCC#N)nc1-c1ccccc1	ZINC000172269489	455141187	/nfs/dbraw/zinc/14/11/87/455141187.db2.gz	VTBMWCKINXZRAR-GOSISDBHSA-N	0	3	340.471	3.350	20	30		EGEDHN
Cn1cc(CNCCOCc2ccccc2)c(-c2ccc(C#N)cc2)n1	ZINC000180275642	455154281	/nfs/dbraw/zinc/15/42/81/455154281.db2.gz	HGUCJJOGIDJXRT-UHFFFAOYSA-N	0	3	346.434	3.265	20	30		EGEDHN
C=CCNC(=O)CN[C@H](Cc1ccc(F)cc1)c1ccc(OC)cc1	ZINC000181136933	455293170	/nfs/dbraw/zinc/29/31/70/455293170.db2.gz	SEIOCOBTUOGNAL-LJQANCHMSA-N	0	3	342.414	3.010	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2CCCc3ccccc32)CC1	ZINC000264431317	455212050	/nfs/dbraw/zinc/21/20/50/455212050.db2.gz	ZSHBSFUPBSTBSD-LJQANCHMSA-N	0	3	327.472	3.404	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cccc(OC(F)F)c2)CC1	ZINC000264436491	455213205	/nfs/dbraw/zinc/21/32/05/455213205.db2.gz	YIQGQXVQXPYUFE-UHFFFAOYSA-N	0	3	339.386	3.450	20	30		EGEDHN
Cc1ccc(CNCc2cn(CCC#N)nc2-c2ccccc2)cn1	ZINC000264970715	455298343	/nfs/dbraw/zinc/29/83/43/455298343.db2.gz	QYGDXPBYZWLDKE-UHFFFAOYSA-N	0	3	331.423	3.457	20	30		EGEDHN
N#CC(C(=O)c1cnc(OCC2CC2)c(Cl)c1)c1ccccn1	ZINC000181484805	455342160	/nfs/dbraw/zinc/34/21/60/455342160.db2.gz	XQBLVJNEMXXRDL-ZDUSSCGKSA-N	0	3	327.771	3.409	20	30		EGEDHN
C[C@@H](NCC(=O)N(CCC#N)CCC#N)c1cc2ccccc2s1	ZINC000184379331	455374848	/nfs/dbraw/zinc/37/48/48/455374848.db2.gz	VYDFHHNPCHAGJL-CQSZACIVSA-N	0	3	340.452	3.208	20	30		EGEDHN
C[C@@H]1C[C@H]1[C@@H](NCCC(=O)N(C)CCC#N)c1ccc(Cl)cc1	ZINC000245835930	455384367	/nfs/dbraw/zinc/38/43/67/455384367.db2.gz	CPGRNMVXDALQSD-QBIMZIAESA-N	0	3	333.863	3.389	20	30		EGEDHN
C[C@H](N[C@H]1CN(Cc2ccccc2)CC[C@H]1CO)c1ccc(C#N)cc1	ZINC000245851877	455385919	/nfs/dbraw/zinc/38/59/19/455385919.db2.gz	GLFDUJFRQLJVEU-HSQYWUDLSA-N	0	3	349.478	3.092	20	30		EGEDHN
COc1ccc([C@@H](CCO)N[C@@H](C)c2ccc(OCC#N)cc2)cc1	ZINC000181911529	455398810	/nfs/dbraw/zinc/39/88/10/455398810.db2.gz	RELYYPIBWOGUJT-MGPUTAFESA-N	0	3	340.423	3.372	20	30		EGEDHN
COc1ccc(CN[C@H]2CCCC[C@@H]2OC)cc1OCCCC#N	ZINC000266129632	455423981	/nfs/dbraw/zinc/42/39/81/455423981.db2.gz	CJDPZHKWPSLWPC-IRXDYDNUSA-N	0	3	332.444	3.425	20	30		EGEDHN
C=C(C)[C@@H](NC(=O)NC[C@@H](C)N(C)C1CC1)c1ccc(F)c(F)c1	ZINC000184705955	455432559	/nfs/dbraw/zinc/43/25/59/455432559.db2.gz	DDZRZPUCWTVDLY-SJKOYZFVSA-N	0	3	337.414	3.364	20	30		EGEDHN
C[C@@H]1C[C@H](N(C)C(=O)c2cc(C#N)c[nH]2)CCN1Cc1ccccc1	ZINC000175731856	455489346	/nfs/dbraw/zinc/48/93/46/455489346.db2.gz	KFSSDBSEUMIDDO-CRAIPNDOSA-N	0	3	336.439	3.011	20	30		EGEDHN
C[C@H](NCCC(=O)N(C)CCC#N)c1ccc(C(F)(F)F)cc1	ZINC000182462339	455518025	/nfs/dbraw/zinc/51/80/25/455518025.db2.gz	GFELEONVPRKEKK-LBPRGKRZSA-N	0	3	327.350	3.118	20	30		EGEDHN
CCN(CC)C(=O)CCC1CCN(Cc2ccc(C#N)cc2)CC1	ZINC000182542134	455536182	/nfs/dbraw/zinc/53/61/82/455536182.db2.gz	JUVRYDWQGMMHOT-UHFFFAOYSA-N	0	3	327.472	3.419	20	30		EGEDHN
N#Cc1ccccc1OCCN1CCC[C@@H]1C[C@H](O)c1ccco1	ZINC000268236086	455626895	/nfs/dbraw/zinc/62/68/95/455626895.db2.gz	FUPFIJWXTGQWJD-SJORKVTESA-N	0	3	326.396	3.118	20	30		EGEDHN
N#CCC[C@@H](NC(=O)NC[C@@H]1CCCCN1C1CC1)c1ccccc1	ZINC000277669307	455629654	/nfs/dbraw/zinc/62/96/54/455629654.db2.gz	ZUIJHPFMLXPZST-RBUKOAKNSA-N	0	3	340.471	3.348	20	30		EGEDHN
C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NCc1ccc(C#N)cc1F	ZINC000277740847	455652675	/nfs/dbraw/zinc/65/26/75/455652675.db2.gz	KDDUURGTFRYALG-DYVFJYSZSA-N	0	3	347.434	3.432	20	30		EGEDHN
CCC1(CC)[C@H](N[C@H](C)C(=O)Nc2ccccc2C#N)C[C@@H]1OC	ZINC000248060347	455676470	/nfs/dbraw/zinc/67/64/70/455676470.db2.gz	YGECSTIFTRQMNG-XYPHTWIQSA-N	0	3	329.444	3.069	20	30		EGEDHN
COc1ccc([C@@H](OC)[C@H](C)NCc2ccc(OC)c(C#N)c2)cc1	ZINC000271589479	455694248	/nfs/dbraw/zinc/69/42/48/455694248.db2.gz	WPTDZDXZLHPKBH-XOBRGWDASA-N	0	3	340.423	3.441	20	30		EGEDHN
CC(C)(C#N)CCCCN1CCN(CCOc2ccccc2)CC1	ZINC000277880477	455695081	/nfs/dbraw/zinc/69/50/81/455695081.db2.gz	FCCHZESXXVFIBA-UHFFFAOYSA-N	0	3	329.488	3.403	20	30		EGEDHN
CCN(C(=O)c1cccc(CC#N)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000186332367	455745230	/nfs/dbraw/zinc/74/52/30/455745230.db2.gz	PCRCZPZGALNDCK-OAQYLSRUSA-N	0	3	347.462	3.489	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@H]2CCCCN2C2CC2)cc1OC	ZINC000278103451	455759792	/nfs/dbraw/zinc/75/97/92/455759792.db2.gz	ZOBOAAJBORDUAW-QGZVFWFLSA-N	0	3	344.455	3.007	20	30		EGEDHN
COc1cc(C)c(CN(C)CCOc2cccc(C#N)c2)cc1OC	ZINC000193589945	455766056	/nfs/dbraw/zinc/76/60/56/455766056.db2.gz	VLLLLOPKCOZGIY-UHFFFAOYSA-N	0	3	340.423	3.395	20	30		EGEDHN
CN(CCSCC(=O)NC1(C#N)CCCCC1)Cc1ccccc1	ZINC000193630139	455767956	/nfs/dbraw/zinc/76/79/56/455767956.db2.gz	SREORXHDYWAYMT-UHFFFAOYSA-N	0	3	345.512	3.194	20	30		EGEDHN
N#CCc1ccc(NC(=O)NC[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000193664581	455769541	/nfs/dbraw/zinc/76/95/41/455769541.db2.gz	VLXOQJFCTCLFQS-LJQANCHMSA-N	0	3	348.450	3.396	20	30		EGEDHN
C=CCn1c(COc2ccc(C)cc2)nnc1SCCN(C)C	ZINC000269035479	455769864	/nfs/dbraw/zinc/76/98/64/455769864.db2.gz	YACBFVZMKDNZBN-UHFFFAOYSA-N	0	3	332.473	3.005	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cnc3c(F)ccc(F)c3c2)CC1	ZINC000293146051	455775753	/nfs/dbraw/zinc/77/57/53/455775753.db2.gz	SDAKANTWEZFDDX-UHFFFAOYSA-N	0	3	345.393	3.283	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)N[C@H](CC)c1ccc(OC)c(OC)c1	ZINC000285036747	455780892	/nfs/dbraw/zinc/78/08/92/455780892.db2.gz	HZWGSBMNPBHRIJ-DOTOQJQBSA-N	0	3	346.471	3.334	20	30		EGEDHN
CN(C)CCN(Cc1ccco1)C(=O)Nc1ccc(C#N)cc1Cl	ZINC000269117377	455793187	/nfs/dbraw/zinc/79/31/87/455793187.db2.gz	IVBJYKQZMHRZBG-UHFFFAOYSA-N	0	3	346.818	3.400	20	30		EGEDHN
CC[C@H](CN(CC)CC(=O)N[C@@](C)(C#N)C1CC1)c1ccccc1	ZINC000186609288	455805716	/nfs/dbraw/zinc/80/57/16/455805716.db2.gz	JOWPEZYDNSXKFE-UZLBHIALSA-N	0	3	327.472	3.311	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C	ZINC000294428742	455814211	/nfs/dbraw/zinc/81/42/11/455814211.db2.gz	NQDXWCSXVJSPDJ-YOEHRIQHSA-N	0	3	336.501	3.109	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N2CCC[C@@H]2CN2CCCCC2)cc1	ZINC000294680987	455823818	/nfs/dbraw/zinc/82/38/18/455823818.db2.gz	TXEDGJZRZXAEOT-LJQANCHMSA-N	0	3	340.467	3.179	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)CSCC#N)N(CC)CC)cc1	ZINC000294676703	455824029	/nfs/dbraw/zinc/82/40/29/455824029.db2.gz	SOZFQTYBPCWVHK-KRWDZBQOSA-N	0	3	333.501	3.005	20	30		EGEDHN
CC[C@@H](C)[C@@H](CNCc1cn(CCC#N)nc1-c1ccncc1)OC	ZINC000294744878	455825922	/nfs/dbraw/zinc/82/59/22/455825922.db2.gz	HQFBQEHLAXGDND-CRAIPNDOSA-N	0	3	341.459	3.009	20	30		EGEDHN
CC[C@@H](NCCCS(=O)(=O)c1ccccc1)c1ccc(C#N)cc1	ZINC000278363447	455829411	/nfs/dbraw/zinc/82/94/11/455829411.db2.gz	BOGAGEXPRILMAW-LJQANCHMSA-N	0	3	342.464	3.463	20	30		EGEDHN
N#C[C@]1(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)CC12CCCC2	ZINC000295062186	455837440	/nfs/dbraw/zinc/83/74/40/455837440.db2.gz	KTVXQAIRVIPFFV-RXVVDRJESA-N	0	3	337.467	3.241	20	30		EGEDHN
CN(C[C@H](O)COc1ccccc1C(F)(F)F)[C@H]1CC[C@@H](C#N)C1	ZINC000278571805	455840676	/nfs/dbraw/zinc/84/06/76/455840676.db2.gz	JHRCDEMDAGPFLW-RDBSUJKOSA-N	0	3	342.361	3.069	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N2CCCCCCC2)cc1	ZINC000278651082	455843059	/nfs/dbraw/zinc/84/30/59/455843059.db2.gz	PUGZFGCUTFFZIK-CQSZACIVSA-N	0	3	349.456	3.170	20	30		EGEDHN
Cc1ccccc1CNCc1cn(CCC#N)nc1-c1ccncc1	ZINC000278782864	455848342	/nfs/dbraw/zinc/84/83/42/455848342.db2.gz	ZIMVKLYYORFYCI-UHFFFAOYSA-N	0	3	331.423	3.457	20	30		EGEDHN
CN(C(=O)[C@@H]1CCCN(Cc2ccccc2)C1)c1ccccc1C#N	ZINC000269859177	455854050	/nfs/dbraw/zinc/85/40/50/455854050.db2.gz	RBIANUXENYLAOQ-LJQANCHMSA-N	0	3	333.435	3.433	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N(Cc1ccco1)C1CCN(C)CC1)OCC	ZINC000270014889	455857740	/nfs/dbraw/zinc/85/77/40/455857740.db2.gz	BXLPONUAIZOUSA-SFHVURJKSA-N	0	3	334.460	3.074	20	30		EGEDHN
COc1ccc(CNCC2(OC)CCCC2)cc1OCCCC#N	ZINC000295981631	455865844	/nfs/dbraw/zinc/86/58/44/455865844.db2.gz	JMKDUFJSWHLTJV-UHFFFAOYSA-N	0	3	332.444	3.427	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC[C@@H](c3ccc(C)cc3C)C2)CC1	ZINC000279513703	455866688	/nfs/dbraw/zinc/86/66/88/455866688.db2.gz	LESZDKIUWRTBRI-GOSISDBHSA-N	0	3	341.499	3.453	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CCCN(Cc2ccccc2)CC1)OCC	ZINC000270054917	455867265	/nfs/dbraw/zinc/86/72/65/455867265.db2.gz	SCKPRCQIOCBMRY-IBGZPJMESA-N	0	3	330.472	3.092	20	30		EGEDHN
Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@@H]1N2C(=O)Cc1ccc(C#N)cc1	ZINC000279927645	455877966	/nfs/dbraw/zinc/87/79/66/455877966.db2.gz	KVPGCHFHMLLZOI-FPOVZHCZSA-N	0	3	345.446	3.244	20	30		EGEDHN
C[C@H]1C[C@H](N2CCCC2)CN1C(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000285656791	455891181	/nfs/dbraw/zinc/89/11/81/455891181.db2.gz	FAPPQISBODCULP-YJBOKZPZSA-N	0	3	325.456	3.187	20	30		EGEDHN
CCC[C@@]1(COC)CCCN1CC(=O)N(CCC#N)c1ccccc1	ZINC000194921939	455900787	/nfs/dbraw/zinc/90/07/87/455900787.db2.gz	MRZJOQCWMWJMGV-FQEVSTJZSA-N	0	3	343.471	3.214	20	30		EGEDHN
CO[C@@H](C)c1nc(CNC(=N)Nc2cc(F)ccc2F)cs1	ZINC000262239408	456015948	/nfs/dbraw/zinc/01/59/48/456015948.db2.gz	BFVBJKZRKKZNCY-QMMMGPOBSA-N	0	3	326.372	3.056	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)c2cc(C#N)oc2C)N(C)C)cc1	ZINC000280628730	456017738	/nfs/dbraw/zinc/01/77/38/456017738.db2.gz	SSXORHNFHBBAPU-SFHVURJKSA-N	0	3	325.412	3.055	20	30		EGEDHN
N=C(NCc1ccc(N2CCCCC2)nc1)Nc1cc(F)ccc1F	ZINC000262253132	456017843	/nfs/dbraw/zinc/01/78/43/456017843.db2.gz	DTLNUBONEUCXKS-UHFFFAOYSA-N	0	3	345.397	3.277	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)NCC(C)(C)N[C@H](C)c1ccccc1	ZINC000280652144	456022512	/nfs/dbraw/zinc/02/25/12/456022512.db2.gz	OHWUZLSMENFHBH-CYBMUJFWSA-N	0	3	325.412	3.319	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1CN[C@H](C)c1nnn(-c2ccc(F)cc2)c1C	ZINC000280928459	456086113	/nfs/dbraw/zinc/08/61/13/456086113.db2.gz	UWKNGJIVCLRUEC-WTANOLMUSA-N	0	3	344.434	3.347	20	30		EGEDHN
C=CCCN(C)C(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000288129390	456087598	/nfs/dbraw/zinc/08/75/98/456087598.db2.gz	YVVRNPONGNRJFF-GOSISDBHSA-N	0	3	333.476	3.294	20	30		EGEDHN
C=CCS(=O)(=O)CCN[C@@H](c1ccc(F)cc1)C1CCCC1	ZINC000272871269	456095832	/nfs/dbraw/zinc/09/58/32/456095832.db2.gz	OQAJSRBWQKZJDJ-QGZVFWFLSA-N	0	3	325.449	3.247	20	30		EGEDHN
C#Cc1ccc(CNCc2cccc(CN3CCO[C@H](C)C3)c2)cc1	ZINC000289221424	456117308	/nfs/dbraw/zinc/11/73/08/456117308.db2.gz	JIWIFGFIOJYQOS-GOSISDBHSA-N	0	3	334.463	3.178	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CN[C@@H](c1nc[nH]n1)c1ccccc1)C(C)C	ZINC000289199312	456117544	/nfs/dbraw/zinc/11/75/44/456117544.db2.gz	JOXOHBHUKZMXOM-RBUKOAKNSA-N	0	3	339.487	3.182	20	30		EGEDHN
CC(C)(C)OC(=O)N1C[C@H]2CN(Cc3ccc(C#N)cc3)CC[C@@H]2C1	ZINC000289461457	456125148	/nfs/dbraw/zinc/12/51/48/456125148.db2.gz	GNGFWBVESIRDJJ-QZTJIDSGSA-N	0	3	341.455	3.247	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NC[C@@H](c1cccs1)N1CCCC1	ZINC000289708380	456137726	/nfs/dbraw/zinc/13/77/26/456137726.db2.gz	GEIOZPKXVDNMEG-SFHVURJKSA-N	0	3	338.476	3.225	20	30		EGEDHN
CC[C@H]1CN(Cc2cn(CCC#N)nc2-c2ccccc2)CCCO1	ZINC000281147668	456146097	/nfs/dbraw/zinc/14/60/97/456146097.db2.gz	FFVHENFBEXWKKQ-IBGZPJMESA-N	0	3	338.455	3.465	20	30		EGEDHN
NC(=NOCc1cncc(F)c1)c1cccc(CN2CCCCC2)c1	ZINC000281201442	456163033	/nfs/dbraw/zinc/16/30/33/456163033.db2.gz	SAZJZSNFYBAITH-UHFFFAOYSA-N	0	3	342.418	3.044	20	30		EGEDHN
C=CCc1cc(CNC[C@H](O)CCc2ccccc2)cc(OC)c1O	ZINC000273074224	456168656	/nfs/dbraw/zinc/16/86/56/456168656.db2.gz	HSZOWMIRLGWPRG-LJQANCHMSA-N	0	3	341.451	3.213	20	30		EGEDHN
CC[C@H](CC#N)NCC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000289924299	456183606	/nfs/dbraw/zinc/18/36/06/456183606.db2.gz	YQMOGUYNQVVELW-GOSISDBHSA-N	0	3	329.444	3.317	20	30		EGEDHN
C=CCc1cc(CN[C@@H](CO)Cc2cccc(C)c2)cc(OC)c1O	ZINC000189026166	456203587	/nfs/dbraw/zinc/20/35/87/456203587.db2.gz	WVQDIKJNXYIRMM-LJQANCHMSA-N	0	3	341.451	3.131	20	30		EGEDHN
C#C[C@@H](NCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C(C)(C)C	ZINC000290052439	456226458	/nfs/dbraw/zinc/22/64/58/456226458.db2.gz	DRGTUMWLOMCRKJ-MRXNPFEDSA-N	0	3	326.400	3.133	20	30		EGEDHN
C=CC[C@H](CO)N[C@H]1C[C@@H](NC(=O)OC(C)(C)C)c2ccccc21	ZINC000273378247	456226962	/nfs/dbraw/zinc/22/69/62/456226962.db2.gz	BRGULHGRDIPZSK-XOKHGSTOSA-N	0	3	332.444	3.224	20	30		EGEDHN
C=CC[C@H](C(=O)NCCCCN1C[C@H](C)O[C@@H](C)C1)c1ccccc1	ZINC000275099895	456269871	/nfs/dbraw/zinc/26/98/71/456269871.db2.gz	CTPUPESAEPFOOW-BJLQDIEVSA-N	0	3	344.499	3.352	20	30		EGEDHN
C=CCOc1cccc(CN[C@H]2CCO[C@@H]2c2nccn2CC)c1	ZINC000275523271	456276101	/nfs/dbraw/zinc/27/61/01/456276101.db2.gz	LHLJCYPOIVCEDG-ROUUACIJSA-N	0	3	327.428	3.088	20	30		EGEDHN
C=CCOc1cccc(CN2CCC[C@@H]2CN2C[C@@H](C)O[C@H](C)C2)c1	ZINC000352766170	456287967	/nfs/dbraw/zinc/28/79/67/456287967.db2.gz	UZKHOUQSPNCPMZ-QWFCFKBJSA-N	0	3	344.499	3.325	20	30		EGEDHN
Cc1ccc([C@@H](CCn2cncn2)NCc2cccc(C#N)c2)cc1	ZINC000275708619	456291937	/nfs/dbraw/zinc/29/19/37/456291937.db2.gz	MOSHTINBEYNHBV-HXUWFJFHSA-N	0	3	331.423	3.379	20	30		EGEDHN
CN(Cc1cn(CCC#N)nc1-c1ccncc1)Cc1ccc(O)cc1	ZINC000290323609	456292940	/nfs/dbraw/zinc/29/29/40/456292940.db2.gz	DEXOKGPSXLBYOV-UHFFFAOYSA-N	0	3	347.422	3.196	20	30		EGEDHN
CC1(C)CN(C[C@@H](O)COc2ccc(C#N)cc2)Cc2ccccc21	ZINC000340240079	456334595	/nfs/dbraw/zinc/33/45/95/456334595.db2.gz	RCPSXUBDBVWOKV-GOSISDBHSA-N	0	3	336.435	3.091	20	30		EGEDHN
CC(C)[C@H](CNCc1nc(C#N)cs1)N1CCc2ccccc2C1	ZINC000352821507	456336627	/nfs/dbraw/zinc/33/66/27/456336627.db2.gz	HEWPQVPJOCHSIH-SFHVURJKSA-N	0	3	340.496	3.187	20	30		EGEDHN
C=CCSCCNCc1cnc(NC(=O)OC(C)(C)C)s1	ZINC000281890735	456351982	/nfs/dbraw/zinc/35/19/82/456351982.db2.gz	DYHFVQJYXJJVEW-UHFFFAOYSA-N	0	3	329.491	3.499	20	30		EGEDHN
N#Cc1csc(CNC2CCC(Oc3ccccc3C#N)CC2)n1	ZINC000352839517	456354417	/nfs/dbraw/zinc/35/44/17/456354417.db2.gz	KTUAQDPKYBCDBM-UHFFFAOYSA-N	0	3	338.436	3.366	20	30		EGEDHN
C=CCNC(=O)[C@H](C)N[C@@H](Cc1ccccc1)c1ccc(OC)cc1	ZINC000290535741	456356367	/nfs/dbraw/zinc/35/63/67/456356367.db2.gz	LENHZLJDCCUALJ-JXFKEZNVSA-N	0	3	338.451	3.259	20	30		EGEDHN
COc1cccc([C@H](CNCc2ccc(C#N)cc2F)N(C)C)c1	ZINC000298094882	456362127	/nfs/dbraw/zinc/36/21/27/456362127.db2.gz	QOOQYLWSLJTYDD-IBGZPJMESA-N	0	3	327.403	3.098	20	30		EGEDHN
N#Cc1ccc(CNCCc2cc(Cl)c3c(c2)OCCO3)c(F)c1	ZINC000343071375	456385835	/nfs/dbraw/zinc/38/58/35/456385835.db2.gz	LXJHANCWTXOMSB-UHFFFAOYSA-N	0	3	346.789	3.454	20	30		EGEDHN
N#Cc1c(F)cccc1NC[C@@H]1CN(Cc2ccccc2)CCCO1	ZINC000302783826	456397949	/nfs/dbraw/zinc/39/79/49/456397949.db2.gz	LKMNENFSNIIMHO-QGZVFWFLSA-N	0	3	339.414	3.400	20	30		EGEDHN
C[C@@H](NCCOCC(F)(F)C(F)F)c1ccc(OCC#N)cc1	ZINC000276152211	456401317	/nfs/dbraw/zinc/40/13/17/456401317.db2.gz	CDTLUFNNGIWAHT-LLVKDONJSA-N	0	3	334.313	3.157	20	30		EGEDHN
N#Cc1c(NC(=O)C2CCN(Cc3ccccc3)CC2)n[nH]c1C1CC1	ZINC000290710509	456410551	/nfs/dbraw/zinc/41/05/51/456410551.db2.gz	XELMJYDMERBIAD-UHFFFAOYSA-N	0	3	349.438	3.009	20	30		EGEDHN
C=CCn1c(COc2ccccc2)nnc1SC[C@H]1CCN(C)C1	ZINC000352929614	456421704	/nfs/dbraw/zinc/42/17/04/456421704.db2.gz	IKFOUTZHDUEFIU-HNNXBMFYSA-N	0	3	344.484	3.087	20	30		EGEDHN
C=CCOCCCN[C@@H](CCO)c1ccccc1Br	ZINC000348028116	456439451	/nfs/dbraw/zinc/43/94/51/456439451.db2.gz	CHYYLTAWHRCNRR-HNNXBMFYSA-N	0	3	328.250	3.055	20	30		EGEDHN
C#Cc1ccc(CN[C@H](C)c2ccc(N3CCCNC3=O)cc2)cc1	ZINC000291044109	456508555	/nfs/dbraw/zinc/50/85/55/456508555.db2.gz	HBVOVBXYIALTEF-MRXNPFEDSA-N	0	3	333.435	3.438	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@H](C)[C@H]1CCCOC1	ZINC000348142350	456511973	/nfs/dbraw/zinc/51/19/73/456511973.db2.gz	NEOFIMLHLQFTNT-CABCVRRESA-N	0	3	334.485	3.308	20	30		EGEDHN
C=CC1CCN(C[C@H](O)COc2ccc(/C=C/C)cc2OC)CC1	ZINC000348179771	456518441	/nfs/dbraw/zinc/51/84/41/456518441.db2.gz	HISAKNAIWNHXAE-JXTAAOLFSA-N	0	3	331.456	3.366	20	30		EGEDHN
C=CCC[C@H](O)CN1CCC(c2nc(-c3ccccc3)no2)CC1	ZINC000305077812	456523182	/nfs/dbraw/zinc/52/31/82/456523182.db2.gz	LOFWFKLDRBDLGQ-KRWDZBQOSA-N	0	3	327.428	3.243	20	30		EGEDHN
CCN(Cc1cn(CCC#N)nc1-c1ccccc1)C[C@@H](C)OC	ZINC000291095550	456526626	/nfs/dbraw/zinc/52/66/26/456526626.db2.gz	QGCDSMKVZHBRKD-MRXNPFEDSA-N	0	3	326.444	3.321	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000337794464	456550255	/nfs/dbraw/zinc/55/02/55/456550255.db2.gz	CLCGPRMGIJOVGS-LJQANCHMSA-N	0	3	333.435	3.261	20	30		EGEDHN
CCc1nc(C#N)cc(N2CC[C@@H](C)N(Cc3ccccc3)CC2)n1	ZINC000308172535	456572609	/nfs/dbraw/zinc/57/26/09/456572609.db2.gz	UZGSVTCEFIHEJJ-MRXNPFEDSA-N	0	3	335.455	3.011	20	30		EGEDHN
C[C@@H](N[C@H]1CCN(C(=O)Cc2ccccc2)C1)c1ccc(C#N)cc1	ZINC000340628684	456583442	/nfs/dbraw/zinc/58/34/42/456583442.db2.gz	ZEGSQFKBRZAINI-UZLBHIALSA-N	0	3	333.435	3.052	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N[C@@H]1CCN(Cc2ccccc2)CC1(C)C	ZINC000282673407	456589395	/nfs/dbraw/zinc/58/93/95/456589395.db2.gz	HFMDMTWXCTXDQY-IEBWSBKVSA-N	0	3	344.499	3.385	20	30		EGEDHN
CCN1CCC(Nc2cc(Br)c(C#N)cc2F)CC1	ZINC000311531038	456589852	/nfs/dbraw/zinc/58/98/52/456589852.db2.gz	WADMPIJDQRSVNH-UHFFFAOYSA-N	0	3	326.213	3.356	20	30		EGEDHN
CN(C)Cc1ccc(S(=O)(=O)Nc2ccc(C#N)cc2Cl)cc1	ZINC000340640895	456593694	/nfs/dbraw/zinc/59/36/94/456593694.db2.gz	ZMGYEEWMXCVCBP-UHFFFAOYSA-N	0	3	349.843	3.074	20	30		EGEDHN
Cc1ccc(C[C@H](C)NC(=O)C(C#N)Cc2ccc(C#N)cc2)s1	ZINC000348281201	456594793	/nfs/dbraw/zinc/59/47/93/456594793.db2.gz	KERUYEDRFJFWIH-GUYCJALGSA-N	0	3	337.448	3.358	20	30		EGEDHN
CO[C@@H]1CCCC[C@H]1N[C@@H](C)C(=O)N(CCC#N)c1ccc(C)cc1	ZINC000276909779	456618179	/nfs/dbraw/zinc/61/81/79/456618179.db2.gz	FQDIENCELCGTMR-QXAKKESOSA-N	0	3	343.471	3.177	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)N[C@H]1CCN(C)[C@H](C)C1	ZINC000340694469	456632266	/nfs/dbraw/zinc/63/22/66/456632266.db2.gz	FEQMINCQOYHEHC-RISCZKNCSA-N	0	3	327.453	3.294	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CN[C@H]2CCCc3sccc32)cc1	ZINC000321185277	456635605	/nfs/dbraw/zinc/63/56/05/456635605.db2.gz	DANBVAUWHWIUCN-YOEHRIQHSA-N	0	3	328.437	3.027	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N[C@@H](C)c1ccncc1F)C(C)C	ZINC000338080267	456658818	/nfs/dbraw/zinc/65/88/18/456658818.db2.gz	BFICYIGBWMFRMC-YJBOKZPZSA-N	0	3	348.466	3.280	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cnccc2Oc2ccccc2)CC1	ZINC000299505879	456714348	/nfs/dbraw/zinc/71/43/48/456714348.db2.gz	LKSXPEGZCNXTSZ-UHFFFAOYSA-N	0	3	335.407	3.158	20	30		EGEDHN
C=CCC[C@@H](NCCOc1ccc(S(C)(=O)=O)cc1)c1ccco1	ZINC000353499971	456718161	/nfs/dbraw/zinc/71/81/61/456718161.db2.gz	DVVXEZYJSUULHS-QGZVFWFLSA-N	0	3	349.452	3.359	20	30		EGEDHN
Cc1cc(CN(C)C(=O)C(C#N)Cc2ccc(C#N)cc2)ccc1F	ZINC000348510997	456722353	/nfs/dbraw/zinc/72/23/53/456722353.db2.gz	RHPFXIQYXYDFCV-SFHVURJKSA-N	0	3	335.382	3.347	20	30		EGEDHN
CN(CCCNC(=O)Nc1ccc(C#N)c(F)c1)Cc1ccccc1	ZINC000353509696	456724750	/nfs/dbraw/zinc/72/47/50/456724750.db2.gz	LEEKIPANBMGYIW-UHFFFAOYSA-N	0	3	340.402	3.341	20	30		EGEDHN
CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@@H](C)CCC#N)cc1	ZINC000299550200	456724815	/nfs/dbraw/zinc/72/48/15/456724815.db2.gz	FZYZZVKHZVRNOE-GJZGRUSLSA-N	0	3	337.489	3.060	20	30		EGEDHN
CC1(C)[C@H](NCC(=O)N[C@@H]2CCOc3ccccc32)[C@@H]2CCCO[C@@H]21	ZINC000328654760	456728728	/nfs/dbraw/zinc/72/87/28/456728728.db2.gz	MAXIDUJZEAYLJE-SFUIVIKGSA-N	0	3	344.455	3.260	20	30		EGEDHN
C=CCC[C@H](NCCN1CCNC1=O)c1ccc(C(F)(F)F)cc1	ZINC000343778501	456774011	/nfs/dbraw/zinc/77/40/11/456774011.db2.gz	YIWNBMATAQYSQD-HNNXBMFYSA-N	0	3	341.377	3.328	20	30		EGEDHN
Cc1nnc(NC[C@@H](C(C)C)N2CCc3ccccc3C2)c(C#N)c1C	ZINC000301065249	456789129	/nfs/dbraw/zinc/78/91/29/456789129.db2.gz	CSUXHYQUXBZIPE-FQEVSTJZSA-N	0	3	349.482	3.460	20	30		EGEDHN
C[C@H]1[C@H](NC(=O)c2cccc(CC#N)c2)CCN1Cc1ccccc1	ZINC000291923341	456799679	/nfs/dbraw/zinc/79/96/79/456799679.db2.gz	RXOXOBOKTZRPED-OXJNMPFZSA-N	0	3	333.435	3.145	20	30		EGEDHN
C[C@@H]1[C@@H](NC(=O)c2cccc(CC#N)c2)CCN1Cc1ccccc1	ZINC000291923349	456799847	/nfs/dbraw/zinc/79/98/47/456799847.db2.gz	RXOXOBOKTZRPED-UZLBHIALSA-N	0	3	333.435	3.145	20	30		EGEDHN
O=C(CN1C[C@H](c2ccccc2)[C@@H]2CCC[C@H]21)NC(=O)NC1CC1	ZINC000329039482	456820618	/nfs/dbraw/zinc/82/06/18/456820618.db2.gz	DBTSOTJTODCRNT-GVDBMIGSSA-N	0	3	327.428	3.287	20	30		EGEDHN
C=CC[C@@H](CO)CNCc1c(C)nn(Cc2ccccc2Cl)c1C	ZINC000341258112	456827042	/nfs/dbraw/zinc/82/70/42/456827042.db2.gz	KWWBVHRLLABERG-MRXNPFEDSA-N	0	3	347.890	3.476	20	30		EGEDHN
NC(=O)[C@H]1CCCN(Cc2ccccc2NC(=O)[C@H]2CCC(=O)N2)C1	ZINC000329144705	456842683	/nfs/dbraw/zinc/84/26/83/456842683.db2.gz	NFPMJGTWLDAURQ-DZGCQCFKSA-N	0	3	344.415	3.141	20	30		EGEDHN
C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)CCc1cc2ccccc2[nH]c1=O	ZINC000329193745	456851149	/nfs/dbraw/zinc/85/11/49/456851149.db2.gz	RNHHAYLGFIEIKH-FZKQIMNGSA-N	0	3	339.439	3.312	20	30		EGEDHN
CCCN1CCC[C@H]1CNC(=O)c1cc2cnn(C(C)C)c2nc1C	ZINC000329217574	456854946	/nfs/dbraw/zinc/85/49/46/456854946.db2.gz	QKADJUIVFIJWRJ-INIZCTEOSA-N	0	3	343.475	3.500	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cccnc1C1CC1)C(C)C	ZINC000344781040	456858240	/nfs/dbraw/zinc/85/82/40/456858240.db2.gz	QXDBRADYLGXGFN-GOSISDBHSA-N	0	3	327.472	3.387	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cc(-c2ccco2)on1)C(C)C	ZINC000344786950	456859641	/nfs/dbraw/zinc/85/96/41/456859641.db2.gz	JJNWEUAKBBPINF-INIZCTEOSA-N	0	3	343.427	3.363	20	30		EGEDHN
C=CCc1cc(CN2CC[C@H](COC(F)F)C2)cc(OC)c1O	ZINC000348870372	456884278	/nfs/dbraw/zinc/88/42/78/456884278.db2.gz	SLNBIGSGRYDHJR-LBPRGKRZSA-N	0	3	327.371	3.190	20	30		EGEDHN
C=CCSCCNC(=O)NC(C)(C)CN(C)Cc1ccccc1	ZINC000338982308	456886302	/nfs/dbraw/zinc/88/63/02/456886302.db2.gz	VTOCWHYBROKILM-UHFFFAOYSA-N	0	3	335.517	3.115	20	30		EGEDHN
CC(C#N)C(=O)NCc1nc2c(s1)C[C@@H](c1ccccc1)CC2	ZINC000344986103	456887857	/nfs/dbraw/zinc/88/78/57/456887857.db2.gz	LFTMPEMOXAXEQT-OCCSQVGLSA-N	0	3	325.437	3.191	20	30		EGEDHN
Cc1nnc([C@@H]2CCCN([C@H](C)C(=O)NC3CCC(C)CC3)C2)[nH]1	ZINC000329473508	456896234	/nfs/dbraw/zinc/89/62/34/456896234.db2.gz	OPGNEILSRPZIBU-RIALXRMPSA-N	0	3	333.480	3.216	20	30		EGEDHN
C=CCOc1ccc(CN(C)C[C@H](O)Cc2ccccc2)cc1OC	ZINC000353767030	456898165	/nfs/dbraw/zinc/89/81/65/456898165.db2.gz	KJXPAEOGSRHGCB-LJQANCHMSA-N	0	3	341.451	3.295	20	30		EGEDHN
C[C@H](NC(=O)[C@@H]1CCCC[C@@H]1C(=O)N1CCCC1)C1=CCN(C)CC1	ZINC000329714066	456931046	/nfs/dbraw/zinc/93/10/46/456931046.db2.gz	SLFBWXCEMSIVRH-JQHSSLGASA-N	0	3	347.503	3.022	20	30		EGEDHN
O=C(CN1CCC(=O)Nc2ccccc21)NC1CCN(C2CC2)CC1	ZINC000329816990	456945248	/nfs/dbraw/zinc/94/52/48/456945248.db2.gz	FEBVVTBGBHGVTB-UHFFFAOYSA-N	0	3	342.443	3.068	20	30		EGEDHN
Cc1c(C(=O)N[C@H](C)CN2CCC[C@@H](C)C2)nnn1CC1CCCC1	ZINC000329842627	456949271	/nfs/dbraw/zinc/94/92/71/456949271.db2.gz	KLCATNJMFUDDQT-HUUCEWRRSA-N	0	3	347.507	3.202	20	30		EGEDHN
CC[C@@H]1CCCCN1CCNC(=O)[C@H]1CCO[C@@H]1c1cnn(C)c1C	ZINC000329909201	456959482	/nfs/dbraw/zinc/95/94/82/456959482.db2.gz	UWFLWPJKRPIRRU-RYRKJORJSA-N	0	3	348.491	3.027	20	30		EGEDHN
C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)c1cc(-c2ccc(F)cc2)on1	ZINC000330005536	456973300	/nfs/dbraw/zinc/97/33/00/456973300.db2.gz	BZDYOYZCEBCTAT-BDJLRTHQSA-N	0	3	329.375	3.268	20	30		EGEDHN
C[C@@H]1[C@@H](NC(=O)Nc2cccc(C#Cc3ccccn3)c2)CCCN1C	ZINC000345306732	456974318	/nfs/dbraw/zinc/97/43/18/456974318.db2.gz	YUCPLFPXZYDIHW-UZLBHIALSA-N	0	3	348.450	3.086	20	30		EGEDHN
Cc1ccccc1[C@@H]1CCCN1CC(=O)NCc1ccc(C#N)cc1	ZINC000339210364	456993633	/nfs/dbraw/zinc/99/36/33/456993633.db2.gz	BFUDKJKAXCZVPD-FQEVSTJZSA-N	0	3	333.435	3.320	20	30		EGEDHN
Cc1cc2c(o1)CC(C)(C)C[C@@H]2NC(=O)N[C@H]1CCn2ccnc2C1	ZINC000330189240	456998759	/nfs/dbraw/zinc/99/87/59/456998759.db2.gz	VDIYCMYOGXGNNP-ZFWWWQNUSA-N	0	3	342.443	3.317	20	30		EGEDHN
C=CCC[C@H](NCC(=O)NC(=O)NC1CCCCC1)c1ccccc1	ZINC000341932958	457010084	/nfs/dbraw/zinc/01/00/84/457010084.db2.gz	UNTAOXOVDJPDTB-SFHVURJKSA-N	0	3	343.471	3.442	20	30		EGEDHN
CN(Cc1ccccc1[N+](=O)[O-])C(=O)C(C#N)CCc1ccccc1	ZINC000346144411	457020007	/nfs/dbraw/zinc/02/00/07/457020007.db2.gz	AKTGLZRCXOEAEA-MRXNPFEDSA-N	0	3	337.379	3.326	20	30		EGEDHN
C=C(C)Cn1c(-c2ccc(C)o2)nnc1N1C[C@H](C)N(CC)C[C@H]1C	ZINC000359109427	457057227	/nfs/dbraw/zinc/05/72/27/457057227.db2.gz	OOQDZBCFWRWPOL-LSDHHAIUSA-N	0	3	343.475	3.342	20	30		EGEDHN
C=C(C)Cn1c(C)nnc1N1C[C@H](C)N(Cc2ccccc2)C[C@@H]1C	ZINC000359235622	457066183	/nfs/dbraw/zinc/06/61/83/457066183.db2.gz	VCIOISDLFSVIGV-IRXDYDNUSA-N	0	3	339.487	3.262	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Cc2c(C)oc3ccccc32)CC1	ZINC000342049903	457079503	/nfs/dbraw/zinc/07/95/03/457079503.db2.gz	PJODYPSHXGGPEQ-UHFFFAOYSA-N	0	3	326.440	3.440	20	30		EGEDHN
C[C@@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1F)N1CCC(C)CC1	ZINC000330873942	457098012	/nfs/dbraw/zinc/09/80/12/457098012.db2.gz	YYSJVRXHDXPFRU-LBPRGKRZSA-N	0	3	338.383	3.180	20	30		EGEDHN
C=CC[C@@H](C)N[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21	ZINC000359648912	457103554	/nfs/dbraw/zinc/10/35/54/457103554.db2.gz	XAJAQOSZMDNOIA-ZWNOBZJWSA-N	0	3	344.274	3.222	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1)OCC	ZINC000339437907	457117450	/nfs/dbraw/zinc/11/74/50/457117450.db2.gz	HWDLXLUGIPMQMJ-NEWSRXKRSA-N	0	3	330.472	3.137	20	30		EGEDHN
C[C@@H](CNC(=O)Nc1cc(F)cc([N+](=O)[O-])c1)N1CCC(C)CC1	ZINC000331001637	457117760	/nfs/dbraw/zinc/11/77/60/457117760.db2.gz	WFDSXFHSZIMWJM-LBPRGKRZSA-N	0	3	338.383	3.180	20	30		EGEDHN
CC(C)(C)C[C@H](NCC(=O)NC1(C#N)CCC1)c1ccc(F)cc1	ZINC000346939247	457190250	/nfs/dbraw/zinc/19/02/50/457190250.db2.gz	HLIRDSNDAQGLSR-INIZCTEOSA-N	0	3	331.435	3.455	20	30		EGEDHN
C[C@@H](N[C@H]1CC(C)(C)CCc2ccccc21)C(=O)N(C)CCC#N	ZINC000331485284	457192333	/nfs/dbraw/zinc/19/23/33/457192333.db2.gz	WSJDZMQPWKSPHA-QAPCUYQASA-N	0	3	327.472	3.440	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN(C)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000350808081	457209032	/nfs/dbraw/zinc/20/90/32/457209032.db2.gz	WUUBQAWNPZMEPG-HXUWFJFHSA-N	0	3	343.515	3.007	20	30		EGEDHN
CCO[C@@H]1C[C@H](N(C)CCOc2ccc(C#N)cc2OC)C1(C)C	ZINC000354424901	457214746	/nfs/dbraw/zinc/21/47/46/457214746.db2.gz	HADBTBYXNHOPOS-ZWKOTPCHSA-N	0	3	332.444	3.081	20	30		EGEDHN
N#CC(C(=O)c1ccc(NC(=O)c2ccccc2)cc1)c1ccncn1	ZINC000354471993	457244912	/nfs/dbraw/zinc/24/49/12/457244912.db2.gz	TYWLFVVIUFZXTI-KRWDZBQOSA-N	0	3	342.358	3.219	20	30		EGEDHN
CCN(CCC#N)C(=O)CN1CCC[C@@H](c2ccc(F)cc2)CC1	ZINC000351255200	457247065	/nfs/dbraw/zinc/24/70/65/457247065.db2.gz	QCOSFMKTDMTLEL-MRXNPFEDSA-N	0	3	331.435	3.157	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@@H]1CN1CCCCC1)c1cccc(C#N)c1	ZINC000360157733	457280238	/nfs/dbraw/zinc/28/02/38/457280238.db2.gz	VXBJTRAHJQUULI-VQIMIIECSA-N	0	3	325.456	3.139	20	30		EGEDHN
CC(C)n1cc(CN[C@H]2CCCN(c3ccc(C#N)cc3F)C2)cn1	ZINC000363399608	457312024	/nfs/dbraw/zinc/31/20/24/457312024.db2.gz	AOWIQBIQBSELHN-KRWDZBQOSA-N	0	3	341.434	3.233	20	30		EGEDHN
C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)CN1[C@@H](C)CC[C@@H]1C	ZINC000342455166	457312939	/nfs/dbraw/zinc/31/29/39/457312939.db2.gz	CXYLTLODRRDEMH-IRXDYDNUSA-N	0	3	332.492	3.242	20	30		EGEDHN
COc1ccc2nc(C)cc(C(=O)C(C#N)c3cc(C)nc(C)n3)c2c1	ZINC000354938964	457330418	/nfs/dbraw/zinc/33/04/18/457330418.db2.gz	HTFVAQPCOBQHIH-KRWDZBQOSA-N	0	3	346.390	3.449	20	30		EGEDHN
CCOC(=O)c1ccc(C(=O)C(C#N)c2nc3ccccc3[nH]2)cc1	ZINC000355111177	457342388	/nfs/dbraw/zinc/34/23/88/457342388.db2.gz	DQEXPPQEDYGTFB-CQSZACIVSA-N	0	3	333.347	3.230	20	30		EGEDHN
N#Cc1cccc(CN[C@H]2CC(=O)N(c3ccccc3Cl)C2)c1	ZINC000363618068	457384552	/nfs/dbraw/zinc/38/45/52/457384552.db2.gz	PGNQPSNXKXOYJI-HNNXBMFYSA-N	0	3	325.799	3.107	20	30		EGEDHN
C#CC[C@H](NC(=O)N1CCC[C@H]1CN1CCCCC1)c1ccccc1	ZINC000378277610	457387250	/nfs/dbraw/zinc/38/72/50/457387250.db2.gz	OIGPWMHNYYAHHT-PMACEKPBSA-N	0	3	339.483	3.411	20	30		EGEDHN
C[C@H](NCc1cccc(-n2cncn2)c1)c1ccc(OCC#N)cc1	ZINC000378460265	457401212	/nfs/dbraw/zinc/40/12/12/457401212.db2.gz	VKOFZAJELDZFRQ-HNNXBMFYSA-N	0	3	333.395	3.020	20	30		EGEDHN
C[C@@H](C#N)Oc1ccccc1NC(=O)N1CCCC12CCN(C)CC2	ZINC000378545765	457408313	/nfs/dbraw/zinc/40/83/13/457408313.db2.gz	CRZKGAUGMFJGRY-HNNXBMFYSA-N	0	3	342.443	3.070	20	30		EGEDHN
CCC(C#N)(CC)C(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000379717606	457417502	/nfs/dbraw/zinc/41/75/02/457417502.db2.gz	OPPWKICQLITOKT-WMZOPIPTSA-N	0	3	327.472	3.486	20	30		EGEDHN
N#CC1(C(=O)N2CC[C@@]3(C2)CCCN(Cc2ccccc2)C3)CCC1	ZINC000363699120	457420585	/nfs/dbraw/zinc/42/05/85/457420585.db2.gz	PUJDFGRBHIKYJX-FQEVSTJZSA-N	0	3	337.467	3.195	20	30		EGEDHN
C=CCN1CCC(NC(=O)C2(Cc3ccc(Cl)cc3)CC2)CC1	ZINC000356022639	457440616	/nfs/dbraw/zinc/44/06/16/457440616.db2.gz	RUUBEGLHLDJUCY-UHFFFAOYSA-N	0	3	332.875	3.429	20	30		EGEDHN
Cc1ccc(NC(=O)[C@@H]2CCCN(Cc3ccc(CC#N)cc3)C2)nc1	ZINC000342719276	457477494	/nfs/dbraw/zinc/47/74/94/457477494.db2.gz	FLFHYBSAGJKURZ-LJQANCHMSA-N	0	3	348.450	3.307	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C2CC(OCc3ccccc3)C2)CC1	ZINC000369977808	457484498	/nfs/dbraw/zinc/48/44/98/457484498.db2.gz	RQFLHWVMRIWURU-UHFFFAOYSA-N	0	3	342.483	3.139	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@H](N(C)Cc3ccccc3)C2)cc1C#N	ZINC000370018070	457505318	/nfs/dbraw/zinc/50/53/18/457505318.db2.gz	HXUDCRODQCCKMM-FQEVSTJZSA-N	0	3	333.435	3.213	20	30		EGEDHN
N#CCc1ccc(CN2CCCN(Cc3ccc(C#N)cc3)CC2)cc1	ZINC000342764456	457510267	/nfs/dbraw/zinc/51/02/67/457510267.db2.gz	HVVOKBGVAQFLKG-UHFFFAOYSA-N	0	3	344.462	3.332	20	30		EGEDHN
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NCc3ccc(C#N)o3)C[C@H]2C1	ZINC000401121702	457524506	/nfs/dbraw/zinc/52/45/06/457524506.db2.gz	OOAPMHJYJPMWIF-KKUMJFAQSA-N	0	3	345.443	3.276	20	30		EGEDHN
C=C[C@@H](CO)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1	ZINC000356241242	457549335	/nfs/dbraw/zinc/54/93/35/457549335.db2.gz	TVQRMZPETCIFDB-SFHVURJKSA-N	0	3	337.398	3.315	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)CCC(=O)Nc1ccccc1C#N	ZINC000425532261	457587138	/nfs/dbraw/zinc/58/71/38/457587138.db2.gz	IWRQKCQSSYKQLC-OAHLLOKOSA-N	0	3	332.407	3.452	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N(C)CCC(=O)Nc1ccc(C#N)cc1	ZINC000425537209	457590114	/nfs/dbraw/zinc/59/01/14/457590114.db2.gz	QAEPMRVJRCFVQL-HNNXBMFYSA-N	0	3	332.407	3.452	20	30		EGEDHN
C=CCC[C@H](C(=O)NC1CCN([C@@H]2CCOC2)CC1)c1ccccc1	ZINC000364462470	457613490	/nfs/dbraw/zinc/61/34/90/457613490.db2.gz	PQJSKJIMGCCZMQ-UXHICEINSA-N	0	3	342.483	3.106	20	30		EGEDHN
COc1ccc(C(=O)C(C#N)c2ccncn2)c(OCCC(C)C)c1	ZINC000361354060	457703848	/nfs/dbraw/zinc/70/38/48/457703848.db2.gz	CMYZBDAAJANARL-MRXNPFEDSA-N	0	3	339.395	3.400	20	30		EGEDHN
COc1ccc(OC)c(CNC(=O)C(C#N)CCc2ccccc2)c1	ZINC000433222064	457782496	/nfs/dbraw/zinc/78/24/96/457782496.db2.gz	WXSDRJRMIKSGGK-INIZCTEOSA-N	0	3	338.407	3.093	20	30		EGEDHN
Cc1c(F)cccc1NC(=O)CCN(C)Cc1cccc(C#N)c1	ZINC000433270270	457796132	/nfs/dbraw/zinc/79/61/32/457796132.db2.gz	CZSCGVDZYCTILA-UHFFFAOYSA-N	0	3	325.387	3.466	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CCC[C@@H](NCc2ccccc2)C1)OCC	ZINC000371120968	457797302	/nfs/dbraw/zinc/79/73/02/457797302.db2.gz	YUWFYQMKDFCGKW-MOPGFXCFSA-N	0	3	330.472	3.139	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NC[C@H](CCO)c1ccccc1	ZINC000433384453	457825766	/nfs/dbraw/zinc/82/57/66/457825766.db2.gz	KFDBWHSRPUAUNI-PMACEKPBSA-N	0	3	336.435	3.041	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N[C@H](CCO)C1CCCCC1	ZINC000433382359	457826269	/nfs/dbraw/zinc/82/62/69/457826269.db2.gz	CVOURNQTVZJOGL-RTBURBONSA-N	0	3	328.456	3.206	20	30		EGEDHN
COc1cc(CCNC(=O)C(C#N)CCc2ccccc2)ccc1C	ZINC000433485320	457840587	/nfs/dbraw/zinc/84/05/87/457840587.db2.gz	YWSLQYWLAAHDHZ-LJQANCHMSA-N	0	3	336.435	3.435	20	30		EGEDHN
C[C@H](CCCc1cccnc1)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000457900755	457863479	/nfs/dbraw/zinc/86/34/79/457863479.db2.gz	CILCZINXJKPKRM-UZLBHIALSA-N	0	3	346.434	3.163	20	30		EGEDHN
C=CCC[C@@H](NCCNS(=O)(=O)c1ccccc1)c1ccccc1	ZINC000358220754	457868747	/nfs/dbraw/zinc/86/87/47/457868747.db2.gz	KUCLAEGUBZTXHG-LJQANCHMSA-N	0	3	344.480	3.262	20	30		EGEDHN
C#C[C@H](NC(=O)NC[C@H]1CCCN(C)[C@@H]1c1cccs1)C(C)C	ZINC000366999664	457919193	/nfs/dbraw/zinc/91/91/93/457919193.db2.gz	XUWFEFSTTRRJTJ-VYDXJSESSA-N	0	3	333.501	3.088	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)N(C)CC(C)(C)C#N)N2CCCC2)cc1	ZINC000458123560	457938455	/nfs/dbraw/zinc/93/84/55/457938455.db2.gz	AYFHDPLIZOZOBI-SFHVURJKSA-N	0	3	342.487	3.323	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)NCC(C)(C)CC#N)N2CCCC2)cc1	ZINC000458143642	457944657	/nfs/dbraw/zinc/94/46/57/457944657.db2.gz	MKSJFARFAMQQQS-SFHVURJKSA-N	0	3	342.487	3.371	20	30		EGEDHN
Cc1nsc(N2C[C@@H]3CCN(Cc4ccccc4)C[C@H]3C2)c1C#N	ZINC000368185114	458017021	/nfs/dbraw/zinc/01/70/21/458017021.db2.gz	QBFVMPDXIPBEEI-IRXDYDNUSA-N	0	3	338.480	3.282	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)N(C)CC(C)(C)C#N	ZINC000458523569	458081284	/nfs/dbraw/zinc/08/12/84/458081284.db2.gz	YSTSOUCSMUCIAA-SJLPKXTDSA-N	0	3	342.487	3.088	20	30		EGEDHN
C[C@@H]([NH2+]C1CCN(c2ccc(C#N)cn2)CC1)c1cc(F)ccc1[O-]	ZINC000371876769	458105992	/nfs/dbraw/zinc/10/59/92/458105992.db2.gz	PDTZSPMTDOCNAD-CYBMUJFWSA-N	0	3	340.402	3.118	20	30		EGEDHN
CC(C)Oc1ccc(NC(=O)NCCN2CCC(C)CC2)cc1C#N	ZINC000435567581	458163634	/nfs/dbraw/zinc/16/36/34/458163634.db2.gz	QTQSSMKMFZYNKG-UHFFFAOYSA-N	0	3	344.459	3.199	20	30		EGEDHN
COC(=O)[C@@]1(c2ccccc2)CCN(Cc2ccc(C#N)c(F)c2)C1	ZINC000428788825	458211513	/nfs/dbraw/zinc/21/15/13/458211513.db2.gz	SHVISLYDJULICF-FQEVSTJZSA-N	0	3	338.382	3.014	20	30		EGEDHN
COc1ccccc1CCCN1CC[C@@H](Oc2ccc(C#N)cn2)C1	ZINC000428797390	458214528	/nfs/dbraw/zinc/21/45/28/458214528.db2.gz	PVPVJVSZQNIXDU-GOSISDBHSA-N	0	3	337.423	3.048	20	30		EGEDHN
COC(=O)[C@@]1(c2ccccc2)CCN([C@@H](C)c2cccc(C#N)c2)C1	ZINC000428802735	458215467	/nfs/dbraw/zinc/21/54/67/458215467.db2.gz	HQWPIPJHKXFPCH-KKSFZXQISA-N	0	3	334.419	3.436	20	30		EGEDHN
C=CC(C)(C)CNC(=O)N(Cc1ccncc1)C[C@H]1CCCN1CC	ZINC000458989041	458237182	/nfs/dbraw/zinc/23/71/82/458237182.db2.gz	OVVXRWGTSRWMMO-GOSISDBHSA-N	0	3	344.503	3.290	20	30		EGEDHN
C=CCC[C@@H](C)N[C@@H]1CCN(c2cccc(Br)c2)C1=O	ZINC000447065678	458259117	/nfs/dbraw/zinc/25/91/17/458259117.db2.gz	IEOBHGKDXYMOLG-IUODEOHRSA-N	0	3	337.261	3.499	20	30		EGEDHN
CC(C)CCO[C@@H]1CCCC[C@H]1NCC(=O)NC1(C#N)CCCCC1	ZINC000436259093	458278046	/nfs/dbraw/zinc/27/80/46/458278046.db2.gz	CWJZLIVCAHORBD-QZTJIDSGSA-N	0	3	349.519	3.293	20	30		EGEDHN
CC(C)CCO[C@@H]1CCCC[C@H]1NCC(=O)N[C@](C)(C#N)C(C)C	ZINC000436265644	458279493	/nfs/dbraw/zinc/27/94/93/458279493.db2.gz	ZXDRWEVXLOKDEV-ZHALLVOQSA-N	0	3	337.508	3.004	20	30		EGEDHN
C=CCC[C@H](O)CN1CCN(c2cccc3cnccc32)C[C@@H]1C	ZINC000447380756	458289720	/nfs/dbraw/zinc/28/97/20/458289720.db2.gz	FXCKHPLZUPEDQB-WMZOPIPTSA-N	0	3	325.456	3.072	20	30		EGEDHN
N#Cc1cnc(N2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)c(F)c1	ZINC000413279415	458296877	/nfs/dbraw/zinc/29/68/77/458296877.db2.gz	IBXLDORXJLEHMS-HXUWFJFHSA-N	0	3	336.414	3.195	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NC(=O)N1CC[C@H](N2CCCCC2)C1	ZINC000413822512	458307553	/nfs/dbraw/zinc/30/75/53/458307553.db2.gz	LACZSZJVMJDQSA-UXHICEINSA-N	0	3	341.499	3.444	20	30		EGEDHN
CN(C)CCOc1ccc(NC(=O)c2cccc(CC#N)c2)c(F)c1	ZINC000413897576	458312049	/nfs/dbraw/zinc/31/20/49/458312049.db2.gz	FDSCERQXEZOFSJ-UHFFFAOYSA-N	0	3	341.386	3.084	20	30		EGEDHN
C[C@H]1CN(C2CCOCC2)CCN1Cc1ccccc1C(C)(C)C#N	ZINC000369693190	458318492	/nfs/dbraw/zinc/31/84/92/458318492.db2.gz	QPSBCFNMXAFZBK-KRWDZBQOSA-N	0	3	341.499	3.173	20	30		EGEDHN
CC[C@@](CNCc1ccc(C#N)cc1F)(C(=O)OC)c1ccccc1	ZINC000414583151	458324727	/nfs/dbraw/zinc/32/47/27/458324727.db2.gz	HNTPZXNVRHOHKT-FQEVSTJZSA-N	0	3	340.398	3.308	20	30		EGEDHN
CC(C)(C)c1ccc([C@@H](C#N)NC(=O)C23CCCN2CCC3)cc1	ZINC000415378364	458331958	/nfs/dbraw/zinc/33/19/58/458331958.db2.gz	NGTBFOMSAYPAIP-QGZVFWFLSA-N	0	3	325.456	3.293	20	30		EGEDHN
C=CCSCCNC(=O)Nc1cc(CN)cc(C(F)(F)F)c1	ZINC000415956964	458335553	/nfs/dbraw/zinc/33/55/53/458335553.db2.gz	SKIORTUEAORUKD-UHFFFAOYSA-N	0	3	333.379	3.205	20	30		EGEDHN
C=CCN(C)CCN(CC)CC(=O)Nc1c(C)cccc1C(C)C	ZINC000429709004	458360789	/nfs/dbraw/zinc/36/07/89/458360789.db2.gz	OIFVFESMXQJZMJ-UHFFFAOYSA-N	0	3	331.504	3.497	20	30		EGEDHN
CCN1C[C@H](C)N(CC#Cc2ccc(OC(F)(F)F)cc2)[C@@H](C)C1	ZINC000459460506	458378765	/nfs/dbraw/zinc/37/87/65/458378765.db2.gz	INDXCWOEKVLAEU-GJZGRUSLSA-N	0	3	340.389	3.351	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CCC(OC2CCC2)CC1	ZINC000419279716	458380354	/nfs/dbraw/zinc/38/03/54/458380354.db2.gz	DAZZYMBTSZCPTP-GOSISDBHSA-N	0	3	345.483	3.188	20	30		EGEDHN
C=CCC[C@@H]1NC(=O)N(C2CCN([C@H](C)c3ccccc3)CC2)C1=O	ZINC000420006296	458395402	/nfs/dbraw/zinc/39/54/02/458395402.db2.gz	XVNFEYNTGAXNNE-QAPCUYQASA-N	0	3	341.455	3.099	20	30		EGEDHN
OCC[C@@H]1CCCN(CC#Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000421017308	458405316	/nfs/dbraw/zinc/40/53/16/458405316.db2.gz	NEZXAZJTZLKFEW-MRXNPFEDSA-N	0	3	341.373	3.421	20	30		EGEDHN
N#Cc1cccc(C2(NCc3ccc(CN4CCOCC4)cc3)CC2)c1	ZINC000420953999	458406327	/nfs/dbraw/zinc/40/63/27/458406327.db2.gz	VOWQXIDIWYKCKH-UHFFFAOYSA-N	0	3	347.462	3.169	20	30		EGEDHN
C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)C[C@@H]1CCCN1C	ZINC000421061167	458407160	/nfs/dbraw/zinc/40/71/60/458407160.db2.gz	LMICKHKYHBDTFQ-GJZGRUSLSA-N	0	3	346.500	3.496	20	30		EGEDHN
COc1cccc(N2CC[C@@H](NCc3ccc(C#N)c(F)c3)C2)c1	ZINC000421322073	458410683	/nfs/dbraw/zinc/41/06/83/458410683.db2.gz	FOGWRIYMERWOFY-MRXNPFEDSA-N	0	3	325.387	3.074	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)NCC(C)(C)CCC#N)CN1Cc1ccccc1	ZINC000376916678	458421274	/nfs/dbraw/zinc/42/12/74/458421274.db2.gz	IMQPQZWFQPXIMV-AEFFLSMTSA-N	0	3	342.487	3.279	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCc1ccc(OCc2csc(C)n2)cc1	ZINC000449522331	458426433	/nfs/dbraw/zinc/42/64/33/458426433.db2.gz	VHGMCNSQKTZCPY-MSOLQXFVSA-N	0	3	330.453	3.464	20	30		EGEDHN
C=CCC[C@H](CO)N[C@@H](C)c1ccc(OC)cc1Br	ZINC000449696340	458429411	/nfs/dbraw/zinc/42/94/11/458429411.db2.gz	HUVYVUQHGRXNJW-NWDGAFQWSA-N	0	3	328.250	3.435	20	30		EGEDHN
COCCN(Cc1ccc(C#N)cc1)C[C@H](O)[C@@H](C)c1ccccc1	ZINC000450312949	458445478	/nfs/dbraw/zinc/44/54/78/458445478.db2.gz	JFULNAAISGXNKG-UWJYYQICSA-N	0	3	338.451	3.171	20	30		EGEDHN
CC(C)(C)[C@H](CN1CCc2ccccc2C1)Nc1nccc(C#N)n1	ZINC000450380133	458445876	/nfs/dbraw/zinc/44/58/76/458445876.db2.gz	QXWKEKZEMIFLCO-SFHVURJKSA-N	0	3	335.455	3.233	20	30		EGEDHN
C=CCC1(C(=O)NCc2ccccc2CN2CC[C@H](O)C2)CCCC1	ZINC000450516333	458451255	/nfs/dbraw/zinc/45/12/55/458451255.db2.gz	BAKXLDHMRCJCDD-IBGZPJMESA-N	0	3	342.483	3.006	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN[C@@H]1CCc2c1cccc2O	ZINC000451177809	458468789	/nfs/dbraw/zinc/46/87/89/458468789.db2.gz	XMPXRIKAFXSDNH-VQIMIIECSA-N	0	3	339.435	3.138	20	30		EGEDHN
CC(C)O[C@H]1C[C@H](NCC(=O)Nc2cc(Cl)ccc2C#N)C1(C)C	ZINC000451496881	458478410	/nfs/dbraw/zinc/47/84/10/458478410.db2.gz	KUMIIKNFUKJVOQ-HOTGVXAUSA-N	0	3	349.862	3.332	20	30		EGEDHN
Cc1sc(NC(=O)CN[C@H]2C[C@H](OC(C)C)C2(C)C)c(C#N)c1C	ZINC000451509646	458479702	/nfs/dbraw/zinc/47/97/02/458479702.db2.gz	YKWGGJYTPHLCII-GJZGRUSLSA-N	0	3	349.500	3.357	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCC[S@@](=O)c1cc(Cl)ccc1Cl	ZINC000451610799	458483267	/nfs/dbraw/zinc/48/32/67/458483267.db2.gz	ZTWROHYVOPTWKB-MTJIALIYSA-N	0	3	334.268	3.034	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1N[C@@H](C)C(=O)Nc1ccc(Cl)c(Cl)c1	ZINC000451607892	458483386	/nfs/dbraw/zinc/48/33/86/458483386.db2.gz	QXORGKLWSIXWKX-FZZIBODNSA-N	0	3	329.227	3.254	20	30		EGEDHN
CO[C@@H]1CCC[C@H]1NCC(=O)Nc1ccccc1SC[C@@H](C)C#N	ZINC000451633249	458484174	/nfs/dbraw/zinc/48/41/74/458484174.db2.gz	QQCDQLVSNLURLW-SQWLQELKSA-N	0	3	347.484	3.034	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC(=O)N1CC[C@H](C)Sc2ccccc21	ZINC000451685395	458485462	/nfs/dbraw/zinc/48/54/62/458485462.db2.gz	ZOPRCBIGLNQAKH-UXLLHSPISA-N	0	3	346.496	3.227	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CCC[C@@]2(CCSC2)C1	ZINC000451970826	458491752	/nfs/dbraw/zinc/49/17/52/458491752.db2.gz	YXESZKVFONVAFG-UYAOXDASSA-N	0	3	347.524	3.374	20	30		EGEDHN
C=CCN(CC=C)[C@H](CN1C(=O)N(C)C2(CCCCC2)C1=O)C(C)C	ZINC000430902189	458502702	/nfs/dbraw/zinc/50/27/02/458502702.db2.gz	XJSGMUFFYPAQAB-QGZVFWFLSA-N	0	3	347.503	3.282	20	30		EGEDHN
CCC(C)(C)OCCNCc1cn(CCC#N)nc1-c1ccncc1	ZINC000453613348	458539310	/nfs/dbraw/zinc/53/93/10/458539310.db2.gz	LGQIGOGPWVNWMO-UHFFFAOYSA-N	0	3	341.459	3.154	20	30		EGEDHN
C[C@H](NC(=O)[C@@H](N)CCCC#N)c1cc(F)c(Cl)cc1Cl	ZINC000424061431	458548259	/nfs/dbraw/zinc/54/82/59/458548259.db2.gz	FFPASULBBDAPHI-SDBXPKJASA-N	0	3	332.206	3.331	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1cccc(COc2cccc(F)c2)c1	ZINC000424099685	458557957	/nfs/dbraw/zinc/55/79/57/458557957.db2.gz	VRAJBAGHVFOMTL-SFHVURJKSA-N	0	3	341.386	3.364	20	30		EGEDHN
CC(C)(CNC(=O)[C@@H](N)CCCC#N)c1cccc(C(F)(F)F)c1	ZINC000424111437	458561049	/nfs/dbraw/zinc/56/10/49/458561049.db2.gz	GPBSZFNWONVNNP-AWEZNQCLSA-N	0	3	341.377	3.120	20	30		EGEDHN
Cc1ccc(CNC(=O)[C@@H](N)CCCC#N)c(Oc2ccccc2)c1	ZINC000424125298	458564524	/nfs/dbraw/zinc/56/45/24/458564524.db2.gz	NRGKGWRFWRZCRB-SFHVURJKSA-N	0	3	337.423	3.425	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)NC1(c2cccc(C(F)(F)F)c2)CCC1	ZINC000424123435	458564713	/nfs/dbraw/zinc/56/47/13/458564713.db2.gz	KLHTZNCEQZIJQC-CQSZACIVSA-N	0	3	339.361	3.222	20	30		EGEDHN
C[C@H](NC(=O)[C@H](N)CCCC#N)c1nc(-c2ccccc2)cs1	ZINC000424137474	458567318	/nfs/dbraw/zinc/56/73/18/458567318.db2.gz	LVZCXKVQQYOZCX-GXTWGEPZSA-N	0	3	328.441	3.008	20	30		EGEDHN
CN(Cc1ccccc1)[C@H]1CCN(C(=O)Nc2cccc(C#N)c2)C1	ZINC000377919028	458572039	/nfs/dbraw/zinc/57/20/39/458572039.db2.gz	VEBVYSGUBWHBBL-IBGZPJMESA-N	0	3	334.423	3.296	20	30		EGEDHN
C=CCC1(CNC(=O)N2CCN(C3CCOCC3)C[C@@H]2C)CCCC1	ZINC000455481605	458601233	/nfs/dbraw/zinc/60/12/33/458601233.db2.gz	RWTQOWVNLRHUSL-KRWDZBQOSA-N	0	3	349.519	3.018	20	30		EGEDHN
C[C@H]1C[C@@H](CNC(=O)OC(C)(C)C)CN1Cc1cccc(C#N)c1	ZINC000493988829	458611220	/nfs/dbraw/zinc/61/12/20/458611220.db2.gz	LOYVTGZAZQBDDI-YOEHRIQHSA-N	0	3	329.444	3.293	20	30		EGEDHN
N#CCc1ccc(NC(=O)NC2CCN(C3CC3)CC2)c(Cl)c1	ZINC000455750172	458611317	/nfs/dbraw/zinc/61/13/17/458611317.db2.gz	LIMUJNFLARXCFS-UHFFFAOYSA-N	0	3	332.835	3.154	20	30		EGEDHN
C[C@H](NC(=O)[C@@H](C)c1cccc(C#N)c1)[C@@H](c1ccccc1)N(C)C	ZINC000462494967	458625713	/nfs/dbraw/zinc/62/57/13/458625713.db2.gz	BWQDBLAZVMXEBD-FTRWYGJKSA-N	0	3	335.451	3.469	20	30		EGEDHN
C[C@H](C#N)CSc1ccccc1NC(=O)CN[C@]1(C)CCO[C@@H]1C	ZINC000494246502	458647199	/nfs/dbraw/zinc/64/71/99/458647199.db2.gz	BLYVUOVYWYNRBQ-HBUWYVDXSA-N	0	3	347.484	3.034	20	30		EGEDHN
C#CC[C@H](C)N[C@@H](C)c1ccc(CNC(=O)OC(C)(C)C)nc1C	ZINC000494556681	458698020	/nfs/dbraw/zinc/69/80/20/458698020.db2.gz	XXXQRRGMMXQRHN-KBPBESRZSA-N	0	3	331.460	3.477	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)NC[C@@H](C)N1CCCC[C@@H]1C	ZINC000463503762	458706928	/nfs/dbraw/zinc/70/69/28/458706928.db2.gz	YJUFTMGKWCAYPQ-JKSUJKDBSA-N	0	3	346.471	3.253	20	30		EGEDHN
C[C@H](C(=O)N1C[C@H](N(C)C)Cc2ccccc21)c1cccc(C#N)c1	ZINC000463778632	458718992	/nfs/dbraw/zinc/71/89/92/458718992.db2.gz	ZGNBUMFRVYVZEF-HNAYVOBHSA-N	0	3	333.435	3.181	20	30		EGEDHN
C=C[C@H]1CCCCN1C(=O)NCCCN1CCc2ccccc2C1	ZINC000494662856	458724953	/nfs/dbraw/zinc/72/49/53/458724953.db2.gz	TXMARWAATVZPHR-IBGZPJMESA-N	0	3	327.472	3.185	20	30		EGEDHN
C=CCn1c(-c2sccc2C)nnc1N1CCN(CC2CC2)CC1	ZINC000508504769	458760819	/nfs/dbraw/zinc/76/08/19/458760819.db2.gz	ANEBDXPPBJHMMR-UHFFFAOYSA-N	0	3	343.500	3.033	20	30		EGEDHN
C=CCn1c(C(C)C)nnc1N1CCN(CC2CCCCC2)CC1	ZINC000508827729	458764187	/nfs/dbraw/zinc/76/41/87/458764187.db2.gz	NBVSVBKAXRDYCO-UHFFFAOYSA-N	0	3	331.508	3.290	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NC[C@H](CO)C1CCCCC1	ZINC000509887823	458773265	/nfs/dbraw/zinc/77/32/65/458773265.db2.gz	ZCTYBZPXZDRVSQ-RTBURBONSA-N	0	3	328.456	3.064	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CCC([C@H]2NC(=O)C2(C)C)CC1	ZINC000515970870	458814751	/nfs/dbraw/zinc/81/47/51/458814751.db2.gz	YOYGXWAEKQZJTH-GOSISDBHSA-N	0	3	339.483	3.224	20	30		EGEDHN
CCCN(CC(=O)N[C@@](C)(C#N)C(C)C)[C@H]1CCc2ccccc2C1	ZINC000516737906	458821185	/nfs/dbraw/zinc/82/11/85/458821185.db2.gz	QTSXGKHNBMEFGO-FPOVZHCZSA-N	0	3	341.499	3.310	20	30		EGEDHN
CC(C)(C)N1C[C@@H](C(=O)Nc2sccc2C#N)[C@H](C(F)(F)F)C1	ZINC000517221494	458827466	/nfs/dbraw/zinc/82/74/66/458827466.db2.gz	WMAOASKPFSWFBH-GHMZBOCLSA-N	0	3	345.390	3.467	20	30		EGEDHN
COc1cc(CNC[C@]2(O)CCC[C@H](C(F)(F)F)C2)ccc1C#N	ZINC000440638723	458836578	/nfs/dbraw/zinc/83/65/78/458836578.db2.gz	OQVSIFNTAGEJLY-HOCLYGCPSA-N	0	3	342.361	3.140	20	30		EGEDHN
COc1cc(CNCc2cc(N(C)C)nc3ccccc23)ccc1C#N	ZINC000440815808	458856569	/nfs/dbraw/zinc/85/65/69/458856569.db2.gz	AIXPWMKLFSIIBR-UHFFFAOYSA-N	0	3	346.434	3.471	20	30		EGEDHN
CC1(C(=O)Nc2cc(CC#N)ccn2)CCN(Cc2ccccc2)CC1	ZINC000548514794	458872602	/nfs/dbraw/zinc/87/26/02/458872602.db2.gz	HUDCPSMKPSUHLY-UHFFFAOYSA-N	0	3	348.450	3.388	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@H]2CCc3ccc(F)cc32)cc1	ZINC000548753812	458873266	/nfs/dbraw/zinc/87/32/66/458873266.db2.gz	TWTRTYBXFRQNLJ-APWZRJJASA-N	0	3	333.366	3.183	20	30		EGEDHN
C=CCNC(=O)NC(=O)CN(Cc1cccs1)C(C)(C)CCC	ZINC000549079303	458877768	/nfs/dbraw/zinc/87/77/68/458877768.db2.gz	HOZRZEIZBUWXHV-UHFFFAOYSA-N	0	3	337.489	3.141	20	30		EGEDHN
C[C@H](c1ccccc1F)N1CCC[C@H](N[C@H]2CC[C@H](C#N)C2)C1=O	ZINC000551242626	458888205	/nfs/dbraw/zinc/88/82/05/458888205.db2.gz	UPSFQHQFFUBQCQ-LLDVTBCESA-N	0	3	329.419	3.160	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)c1ccc(C2CC2)cn1	ZINC000531266090	458895418	/nfs/dbraw/zinc/89/54/18/458895418.db2.gz	QYWCLGBHZJRDKQ-UHFFFAOYSA-N	0	3	348.450	3.035	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)C2(C#N)CCC2)N(CC)CC)cc1	ZINC000554220398	458898279	/nfs/dbraw/zinc/89/82/79/458898279.db2.gz	QZKHLUORLBUTJO-SFHVURJKSA-N	0	3	327.472	3.442	20	30		EGEDHN
CN(C)CC(C)(C)NC(=O)c1cn(CCCC#N)c2ccccc12	ZINC000457216680	458900579	/nfs/dbraw/zinc/90/05/79/458900579.db2.gz	DJOUAHDNJYWNIU-UHFFFAOYSA-N	0	3	326.444	3.015	20	30		EGEDHN
CO[C@]1(C)C[C@@H](N(C)C(=O)C(C#N)CCc2ccccc2)C1(C)C	ZINC000555556507	458906556	/nfs/dbraw/zinc/90/65/56/458906556.db2.gz	VHPXFWBUQGUVME-SQGPQFPESA-N	0	3	328.456	3.421	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N(C)Cc1ccoc1C)C(C)C	ZINC000519015225	458908105	/nfs/dbraw/zinc/90/81/05/458908105.db2.gz	APFRQXKRVQDHIP-SFHVURJKSA-N	0	3	333.476	3.428	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)N1CCC[C@@H]1c1cccc(N(C)C)c1	ZINC000441347500	458924621	/nfs/dbraw/zinc/92/46/21/458924621.db2.gz	ALJNTDTTYJCICI-FXAWDEMLSA-N	0	3	341.499	3.479	20	30		EGEDHN
CC#CCN(C)C(=O)NC[C@H](c1cccs1)N1CCC(C)CC1	ZINC000457491804	458976561	/nfs/dbraw/zinc/97/65/61/458976561.db2.gz	VTEJFRUGAPKNQX-MRXNPFEDSA-N	0	3	333.501	3.186	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1CCC[C@@H]1NCC1(C#N)CC1	ZINC000495957356	459018330	/nfs/dbraw/zinc/01/83/30/459018330.db2.gz	NHXGMAIEAVDBLJ-OWCLPIDISA-N	0	3	333.476	3.448	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](NCc3ccc(C4CC4)cc3)C2=O)cc1	ZINC000566900784	459019063	/nfs/dbraw/zinc/01/90/63/459019063.db2.gz	ATJIBCOLZFJZIT-NRFANRHFSA-N	0	3	345.446	3.326	20	30		EGEDHN
CCCN(CC(=O)N[C@](C)(C#N)C(C)C)[C@H]1CCc2ccccc21	ZINC000519906548	459020759	/nfs/dbraw/zinc/02/07/59/459020759.db2.gz	JMBPAUWXIPZGLJ-AZUAARDMSA-N	0	3	327.472	3.440	20	30		EGEDHN
C=CCC[C@@H](CC)[NH2+]CC[N-]S(=O)(=O)c1ccc(Cl)cc1F	ZINC000442868249	459047348	/nfs/dbraw/zinc/04/73/48/459047348.db2.gz	NJZMINTWIIKCGW-CYBMUJFWSA-N	0	3	348.871	3.092	20	30		EGEDHN
CC1(C)CN(CCC(=O)Nc2ccc(C#N)c(Cl)c2)CC(C)(C)O1	ZINC000442879627	459050129	/nfs/dbraw/zinc/05/01/29/459050129.db2.gz	JJBCZLLQXQLEFA-UHFFFAOYSA-N	0	3	349.862	3.430	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CCN(C(=O)Cc2cccc(C#N)c2)C1	ZINC000567131882	459052761	/nfs/dbraw/zinc/05/27/61/459052761.db2.gz	VRQIGJXXAKVBCS-SFHVURJKSA-N	0	3	347.462	3.081	20	30		EGEDHN
COc1cc(CN(C)CCOCc2ccc(C#N)cc2)cc(OC)c1	ZINC000567201491	459062828	/nfs/dbraw/zinc/06/28/28/459062828.db2.gz	YFDPSZGDKVKJAN-UHFFFAOYSA-N	0	3	340.423	3.224	20	30		EGEDHN
Cc1nn(-c2ccccc2Br)cc1CNCCCC#N	ZINC000594501406	459065240	/nfs/dbraw/zinc/06/52/40/459065240.db2.gz	UVCCOTMCDMTWRM-UHFFFAOYSA-N	0	3	333.233	3.337	20	30		EGEDHN
Cn1cc([C@H]2OCCC[C@@H]2NCc2ccc(C(C)(C)C#N)cc2)cn1	ZINC000594503667	459065468	/nfs/dbraw/zinc/06/54/68/459065468.db2.gz	GPBLQMCBJDHFST-RBUKOAKNSA-N	0	3	338.455	3.231	20	30		EGEDHN
CCN(C[C@H]1CCN(Cc2ccccc2)C1)C(=O)C1(C#N)CC(C)C1	ZINC000532319857	459065549	/nfs/dbraw/zinc/06/55/49/459065549.db2.gz	XGTDUBFQCFQQRB-BIXGBWIQSA-N	0	3	339.483	3.297	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(CCOC)C[C@@H]2CC=CCC2)CC1	ZINC000478623651	459100717	/nfs/dbraw/zinc/10/07/17/459100717.db2.gz	PJUJJZKWUQFPMW-GOSISDBHSA-N	0	3	349.519	3.041	20	30		EGEDHN
Cc1cccc2c1CC[C@@H]2NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000567464344	459110979	/nfs/dbraw/zinc/11/09/79/459110979.db2.gz	OZMZBNUZCRCSQX-UTKZUKDTSA-N	0	3	336.435	3.078	20	30		EGEDHN
C[C@H](O)CN(Cc1cccc(OCc2cccc(C#N)c2)c1)C1CC1	ZINC000594614478	459115091	/nfs/dbraw/zinc/11/50/91/459115091.db2.gz	HNWLUOJZMCWMNW-INIZCTEOSA-N	0	3	336.435	3.482	20	30		EGEDHN
CC1(C)Cc2ccsc2CN1C[C@H](O)COc1ccc(C#N)cc1	ZINC000577938600	459119372	/nfs/dbraw/zinc/11/93/72/459119372.db2.gz	ADAGRZIXTQUBIG-INIZCTEOSA-N	0	3	342.464	3.196	20	30		EGEDHN
CC(C)(C)OC(=O)N1C[C@H]2CN(Cc3ccc(CC#N)cc3)C[C@H]2C1	ZINC000496240425	459120130	/nfs/dbraw/zinc/12/01/30/459120130.db2.gz	VZHSMXYNTHPTNY-HDICACEKSA-N	0	3	341.455	3.051	20	30		EGEDHN
N#Cc1cccc(CCNC(=O)[C@H]2CCCCN2C2CCCC2)c1	ZINC000578027495	459135461	/nfs/dbraw/zinc/13/54/61/459135461.db2.gz	MCCNXKMDCITQND-LJQANCHMSA-N	0	3	325.456	3.014	20	30		EGEDHN
N#Cc1ccc(CN(CCc2cn[nH]n2)Cc2cccc(F)c2)cc1	ZINC000590603934	459160086	/nfs/dbraw/zinc/16/00/86/459160086.db2.gz	SLBSNYOVUXLJJC-UHFFFAOYSA-N	0	3	335.386	3.060	20	30		EGEDHN
N#Cc1ccc(CN(CCc2c[nH]nn2)Cc2cccc(F)c2)cc1	ZINC000590603934	459160089	/nfs/dbraw/zinc/16/00/89/459160089.db2.gz	SLBSNYOVUXLJJC-UHFFFAOYSA-N	0	3	335.386	3.060	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1SCC1(CC#N)CC1	ZINC000594882088	459164934	/nfs/dbraw/zinc/16/49/34/459164934.db2.gz	ONQIEPMEWFLLLK-UHFFFAOYSA-N	0	3	345.516	3.278	20	30		EGEDHN
N#Cc1ccc(N2CCC(NCc3ccc(F)c(F)c3F)CC2)nc1	ZINC000594927002	459178889	/nfs/dbraw/zinc/17/88/89/459178889.db2.gz	QGGHGHPWVWAFLE-UHFFFAOYSA-N	0	3	346.356	3.129	20	30		EGEDHN
Cc1c(C#N)c(N2CCN(c3ccncc3)CC2)nc2ccccc12	ZINC000590684747	459181376	/nfs/dbraw/zinc/18/13/76/459181376.db2.gz	SGSXQUNJUMGPKX-UHFFFAOYSA-N	0	3	329.407	3.137	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CCC[C@@H]1C(F)F)C(C)C	ZINC000480544046	459203420	/nfs/dbraw/zinc/20/34/20/459203420.db2.gz	UGXAJBLKIDSVRY-HUUCEWRRSA-N	0	3	329.435	3.124	20	30		EGEDHN
C[C@@H](NC(=O)N1CCC(CCC#N)CC1)[C@H](c1ccccc1)N(C)C	ZINC000578502327	459211147	/nfs/dbraw/zinc/21/11/47/459211147.db2.gz	MGFVFMYUNRZZDC-VQIMIIECSA-N	0	3	342.487	3.403	20	30		EGEDHN
C[C@H](NC(=O)N1CCC(CCC#N)CC1)[C@H](c1ccccc1)N(C)C	ZINC000578502326	459211836	/nfs/dbraw/zinc/21/18/36/459211836.db2.gz	MGFVFMYUNRZZDC-QFBILLFUSA-N	0	3	342.487	3.403	20	30		EGEDHN
CNC(=O)CC1(CN[C@@H](C)c2ccc(C#N)cc2F)CCCCC1	ZINC000595099224	459244642	/nfs/dbraw/zinc/24/46/42/459244642.db2.gz	FVNRHXUHBHLWJS-AWEZNQCLSA-N	0	3	331.435	3.435	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](C)c2nc3c(s2)CCC3)CC1	ZINC000579563196	459247987	/nfs/dbraw/zinc/24/79/87/459247987.db2.gz	XTHJQTMAZRLQGN-CYBMUJFWSA-N	0	3	348.516	3.033	20	30		EGEDHN
CC#CCN(C)C[C@H](O)CO[C@@H](c1ccccc1)c1ccc(C)cc1	ZINC000559458940	459261658	/nfs/dbraw/zinc/26/16/58/459261658.db2.gz	QFROLZYMNUFDGO-VXKWHMMOSA-N	0	3	337.463	3.417	20	30		EGEDHN
OC[C@@H](NCC#Cc1ccc(OC(F)(F)F)cc1)C1CCCC1	ZINC000580803460	459264670	/nfs/dbraw/zinc/26/46/70/459264670.db2.gz	QRDOILVNVOMBQA-MRXNPFEDSA-N	0	3	327.346	3.077	20	30		EGEDHN
N#Cc1ccnc(N2CCN(CC[C@@H]3CCc4ccccc43)CC2)c1	ZINC000595289971	459267263	/nfs/dbraw/zinc/26/72/63/459267263.db2.gz	ILAKXJFXHOGWGC-IBGZPJMESA-N	0	3	332.451	3.195	20	30		EGEDHN
CC(C)CC1(CNCCS(=O)(=O)c2ccc(C#N)cc2)CCC1	ZINC000581998055	459288684	/nfs/dbraw/zinc/28/86/84/459288684.db2.gz	RZNXVXLWUCDJKG-UHFFFAOYSA-N	0	3	334.485	3.138	20	30		EGEDHN
CC(C)(NCCc1ccc(C#N)cc1)C(=O)NCC1CCCCC1	ZINC000595406399	459293092	/nfs/dbraw/zinc/29/30/92/459293092.db2.gz	IUZRLISHUFNQQY-UHFFFAOYSA-N	0	3	327.472	3.165	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1ccnn1C1CCCC1)C(C)C	ZINC000482159874	459295014	/nfs/dbraw/zinc/29/50/14/459295014.db2.gz	XUCNWYQOSPRXSY-IBGZPJMESA-N	0	3	344.503	3.427	20	30		EGEDHN
C[C@@]1(C#N)CCCN(C(=O)c2cccc(CN3CCCCC3)c2)C1	ZINC000591075799	459306315	/nfs/dbraw/zinc/30/63/15/459306315.db2.gz	JTAHZBIVRRNWGA-FQEVSTJZSA-N	0	3	325.456	3.438	20	30		EGEDHN
C=CCCCCN1CCCN(c2nnc(C(F)(F)F)s2)CC1	ZINC000560227320	459314182	/nfs/dbraw/zinc/31/41/82/459314182.db2.gz	DBQSILSKLVKZKX-UHFFFAOYSA-N	0	3	334.411	3.425	20	30		EGEDHN
C[C@@H](NC1CCN(CC#N)CC1)c1csc(-c2ccccc2)n1	ZINC000591239044	459338643	/nfs/dbraw/zinc/33/86/43/459338643.db2.gz	MGZLVTVKUFYVAL-CQSZACIVSA-N	0	3	326.469	3.449	20	30		EGEDHN
N#CC[C@H]1CCCN(CCC(=O)Nc2ccc(C#N)c(Cl)c2)C1	ZINC000595613927	459368717	/nfs/dbraw/zinc/36/87/17/459368717.db2.gz	FUVZGIVNSSVXGK-CYBMUJFWSA-N	0	3	330.819	3.166	20	30		EGEDHN
N#CC[C@H]1CCCN(C[C@@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000595621532	459373476	/nfs/dbraw/zinc/37/34/76/459373476.db2.gz	WBRGQNXUDMQVDL-ZBFHGGJFSA-N	0	3	326.362	3.234	20	30		EGEDHN
Cc1ccccc1[C@H]1C[C@@H](C)N(CC(=O)NCc2cccc(C#N)c2)C1	ZINC000524593496	459373951	/nfs/dbraw/zinc/37/39/51/459373951.db2.gz	CLNBSHDVMLTMQJ-XLIONFOSSA-N	0	3	347.462	3.361	20	30		EGEDHN
Cc1n[nH]cc1C1CCN(C(=O)C(C#N)CCc2ccccc2)CC1	ZINC000560807757	459397421	/nfs/dbraw/zinc/39/74/21/459397421.db2.gz	AAMQECLIKHIYGB-SFHVURJKSA-N	0	3	336.439	3.197	20	30		EGEDHN
C[C@@H]1CN(c2ccccc2CN2CCC(CCC#N)CC2)CCO1	ZINC000569123226	459401625	/nfs/dbraw/zinc/40/16/25/459401625.db2.gz	KAAHCZQRBGPIOF-QGZVFWFLSA-N	0	3	327.472	3.427	20	30		EGEDHN
C/C=C\c1ccc(OC[C@@H](O)CN2CCC(CC#N)CC2)c(OC)c1	ZINC000541022928	459419491	/nfs/dbraw/zinc/41/94/91/459419491.db2.gz	OMUKJQSCSPUXJH-JXCVUKRWSA-N	0	3	344.455	3.094	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](O)COCc2ccc(Cl)cc2)c(F)c1	ZINC000591733715	459427084	/nfs/dbraw/zinc/42/70/84/459427084.db2.gz	GIGDFRNJUULVAA-QGZVFWFLSA-N	0	3	348.805	3.018	20	30		EGEDHN
CC(C)(C)OC(=O)NCc1ccc(CN[C@H]2CC[C@H](C#N)C2)cc1	ZINC000497137796	459456010	/nfs/dbraw/zinc/45/60/10/459456010.db2.gz	ZOBOUXLGNITMOI-IRXDYDNUSA-N	0	3	329.444	3.493	20	30		EGEDHN
C=CCn1c(-c2ccccc2)nnc1N1C[C@H](C)N(CC)C[C@H]1C	ZINC000569511424	459464626	/nfs/dbraw/zinc/46/46/26/459464626.db2.gz	ZDTQXFMQKVUWSW-JKSUJKDBSA-N	0	3	325.460	3.050	20	30		EGEDHN
CCN1CCN(Cc2ccc(CNc3nc(C#N)ccc3C)cc2)CC1	ZINC000596077321	459511238	/nfs/dbraw/zinc/51/12/38/459511238.db2.gz	SZLHACVSCAJVPI-UHFFFAOYSA-N	0	3	349.482	3.011	20	30		EGEDHN
N#CC1(NC(=O)CN2C[C@H](c3ccccc3)[C@@H]3CCCC[C@@H]32)CCC1	ZINC000525886120	459511607	/nfs/dbraw/zinc/51/16/07/459511607.db2.gz	CGUMTUHLPVVXMA-OTWHNJEPSA-N	0	3	337.467	3.207	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2[nH]c(-c3ccccc3)nc2C)CC1	ZINC000592075715	459520443	/nfs/dbraw/zinc/52/04/43/459520443.db2.gz	ATXHJOMNFFBQPX-UHFFFAOYSA-N	0	3	338.455	3.155	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CCC[C@H](CC#N)C1)C(C)C	ZINC000596139349	459535247	/nfs/dbraw/zinc/53/52/47/459535247.db2.gz	ROESGNOMLXLMTP-QZTJIDSGSA-N	0	3	332.492	3.020	20	30		EGEDHN
Cc1nc(NC[C@H]2CCCN(Cc3cccs3)C2)ccc1C#N	ZINC000488093060	459538384	/nfs/dbraw/zinc/53/83/84/459538384.db2.gz	FYDBFSRAWYXBKQ-OAHLLOKOSA-N	0	3	326.469	3.069	20	30		EGEDHN
CCCN(C)[C@H](CNC(=O)NC[C@H](C)C#N)c1ccc(Cl)cc1	ZINC000570069921	459551476	/nfs/dbraw/zinc/55/14/76/459551476.db2.gz	SWOUFLBDUBTRNK-CZUORRHYSA-N	0	3	336.867	3.182	20	30		EGEDHN
C[C@@H]1C[C@H](Nc2c(C#N)cnc3ccc(Cl)cc32)CN1C1CC1	ZINC000583845063	459604929	/nfs/dbraw/zinc/60/49/29/459604929.db2.gz	ULHLZHRURMHCJD-RISCZKNCSA-N	0	3	326.831	3.219	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(OCC)c(OCC)c2)CC1	ZINC000592526082	459625758	/nfs/dbraw/zinc/62/57/58/459625758.db2.gz	BMUODMZVKYHLRW-UHFFFAOYSA-N	0	3	347.459	3.256	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN1CCC[C@@H](c2ccncc2)C1	ZINC000562705645	459628284	/nfs/dbraw/zinc/62/82/84/459628284.db2.gz	ABDPDOZBOFREBF-MRXNPFEDSA-N	0	3	340.452	3.223	20	30		EGEDHN
CN(C)C/C=C\C(=O)N[C@H](C#N)c1ccc(OCc2ccccc2)cc1	ZINC000491875082	459683383	/nfs/dbraw/zinc/68/33/83/459683383.db2.gz	YAGVTJDCOIYCAY-QKWWCAPFSA-N	0	3	349.434	3.064	20	30		EGEDHN
CN(C)C/C=C\C(=O)Nc1ccccc1COc1ccc(CC#N)cc1	ZINC000491875484	459683402	/nfs/dbraw/zinc/68/34/02/459683402.db2.gz	YSHOLTLCXSIKBN-YVMONPNESA-N	0	3	349.434	3.388	20	30		EGEDHN
C#CCCN1CCC(NC(=O)/C=C/c2ccc(F)c(Cl)c2)CC1	ZINC000492080721	459690743	/nfs/dbraw/zinc/69/07/43/459690743.db2.gz	DIVMIJCFLIMGRC-FNORWQNLSA-N	0	3	334.822	3.096	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)/C=C\c2cc(F)c(F)c(F)c2)CC1	ZINC000492587849	459711258	/nfs/dbraw/zinc/71/12/58/459711258.db2.gz	BVQODCPMXWCASQ-ARJAWSKDSA-N	0	3	338.373	3.274	20	30		EGEDHN
C[C@@H](NC(=O)OC(C)(C)C)[C@H](Cc1ccccc1)NCCCC#N	ZINC000492791629	459721448	/nfs/dbraw/zinc/72/14/48/459721448.db2.gz	NROKCLMEFTZVJX-WBVHZDCISA-N	0	3	331.460	3.404	20	30		EGEDHN
Cc1ccc(C(=O)C(C#N)c2nc3cc(F)ccc3s2)c(=O)[nH]1	ZINC000592973623	459726377	/nfs/dbraw/zinc/72/63/77/459726377.db2.gz	CKSDHCQHXFLAMY-NSHDSACASA-N	0	3	327.340	3.335	20	30		EGEDHN
CC(C#N)C(=O)NCc1ccc([C@@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000493445331	459745608	/nfs/dbraw/zinc/74/56/08/459745608.db2.gz	RROMEQXPZULFEZ-CHWSQXEVSA-N	0	3	331.416	3.048	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CC[C@H](Oc2ccccc2)C1	ZINC000584471531	459748238	/nfs/dbraw/zinc/74/82/38/459748238.db2.gz	KJPMFQMVMSLFKB-ICSRJNTNSA-N	0	3	334.419	3.439	20	30		EGEDHN
CN(C(=O)C(C[C@H]1CCCO1)C(F)(F)F)c1ccc(C#N)cc1	ZINC000593073074	459764930	/nfs/dbraw/zinc/76/49/30/459764930.db2.gz	OTYSSIJCCDAILL-ZIAGYGMSSA-N	0	3	326.318	3.269	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CCC(OC2CCC2)CC1	ZINC000563517196	459765839	/nfs/dbraw/zinc/76/58/39/459765839.db2.gz	GEJCCBSAJUIGJP-KRWDZBQOSA-N	0	3	326.440	3.319	20	30		EGEDHN
N#CCCC1CCN(C(=O)[C@H]2CCCN2Cc2ccccc2)CC1	ZINC000565020084	459780464	/nfs/dbraw/zinc/78/04/64/459780464.db2.gz	UUZJKAWCLAYIAE-LJQANCHMSA-N	0	3	325.456	3.193	20	30		EGEDHN
COc1cc(C#N)ccc1NC(=O)C(C[C@@H]1CCCO1)C(F)(F)F	ZINC000593129317	459782625	/nfs/dbraw/zinc/78/26/25/459782625.db2.gz	UOFITIAXVAXRAE-NWDGAFQWSA-N	0	3	342.317	3.253	20	30		EGEDHN
N#CCc1cccc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)c1	ZINC000593169792	459794929	/nfs/dbraw/zinc/79/49/29/459794929.db2.gz	NPGACRZSKVLWKB-ZIAGYGMSSA-N	0	3	326.318	3.439	20	30		EGEDHN
C[C@H]1C[C@@H](c2ccccc2)CCN1Cc1cnc2c(C#N)cnn2c1	ZINC000584840285	459811826	/nfs/dbraw/zinc/81/18/26/459811826.db2.gz	VFIVEMQJGWHWKA-YJBOKZPZSA-N	0	3	331.423	3.369	20	30		EGEDHN
N#CCc1ccc(NC(=O)NC[C@H]2CCN2C2CCCCC2)cc1	ZINC000528884616	459816137	/nfs/dbraw/zinc/81/61/37/459816137.db2.gz	CYUORVXDBBVKMC-GOSISDBHSA-N	0	3	326.444	3.281	20	30		EGEDHN
COCc1ccc(NC(=O)NCC(C)(C)N2CCCCC2)cc1C#N	ZINC000529218931	459826344	/nfs/dbraw/zinc/82/63/44/459826344.db2.gz	UAVOTKLUMVQDAE-UHFFFAOYSA-N	0	3	344.459	3.091	20	30		EGEDHN
C=C(C)[C@@H](Cc1nc(-c2ccc(OCCN(C)C)cc2)no1)OCC	ZINC000546295952	459908462	/nfs/dbraw/zinc/90/84/62/459908462.db2.gz	PAQRLQDNRYWDGU-QGZVFWFLSA-N	0	3	345.443	3.201	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000598512018	459928036	/nfs/dbraw/zinc/92/80/36/459928036.db2.gz	VZKAONRASCWXGL-SFTDATJTSA-N	0	3	347.462	3.150	20	30		EGEDHN
C[C@H](CCC#N)CN1CCCN(C(=O)CCc2ccccc2)CC1	ZINC000602450984	459945411	/nfs/dbraw/zinc/94/54/11/459945411.db2.gz	MYJLDTDFWDMGPE-GOSISDBHSA-N	0	3	327.472	3.093	20	30		EGEDHN
COc1cc(CN(C)C[C@H](O)CC(C)(C)C#N)ccc1OC(F)F	ZINC000598589427	459956206	/nfs/dbraw/zinc/95/62/06/459956206.db2.gz	NBBLYIROSCSAMF-CYBMUJFWSA-N	0	3	342.386	3.029	20	30		EGEDHN
Cc1ccccc1[C@@H]([C@@H](C)NC(=O)N1CCC(CC#N)CC1)N(C)C	ZINC000588722076	459975646	/nfs/dbraw/zinc/97/56/46/459975646.db2.gz	VOZPHFKTOXZWTE-VQIMIIECSA-N	0	3	342.487	3.322	20	30		EGEDHN
C[C@H](CC1(C#N)CCOCC1)NCc1ccccc1Cn1ccnc1	ZINC000602511201	459976630	/nfs/dbraw/zinc/97/66/30/459976630.db2.gz	NDEOLLNUYBDCSA-QGZVFWFLSA-N	0	3	338.455	3.120	20	30		EGEDHN
N#Cc1cccc(CN[C@@H]2CCCN(c3ccccc3Cl)C2)n1	ZINC000602549846	459992479	/nfs/dbraw/zinc/99/24/79/459992479.db2.gz	GDVIQZSFBZWZEL-MRXNPFEDSA-N	0	3	326.831	3.365	20	30		EGEDHN
COc1ncccc1NC(=O)C(C#N)c1nc2cc(F)ccc2s1	ZINC000609627399	459998443	/nfs/dbraw/zinc/99/84/43/459998443.db2.gz	LTAUCKAHSVEHSU-JTQLQIEISA-N	0	3	342.355	3.085	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CNCc1ccc(Br)cc1Cl	ZINC000598719826	460005055	/nfs/dbraw/zinc/00/50/55/460005055.db2.gz	JLGHCXLXRMRHGT-GFCCVEGCSA-N	0	3	345.668	3.493	20	30		EGEDHN
COCCOCc1ccc(CN[C@H]2CCc3cc(C#N)ccc32)cc1	ZINC000588926074	460005830	/nfs/dbraw/zinc/00/58/30/460005830.db2.gz	YSDSBHPZOHSQFS-NRFANRHFSA-N	0	3	336.435	3.498	20	30		EGEDHN
CC1CCC(Oc2cc(CNC[C@H](O)CC(C)(C)C#N)ccn2)CC1	ZINC000598720650	460005799	/nfs/dbraw/zinc/00/57/99/460005799.db2.gz	QQDLCSCAISTWMH-IIIMJFFVSA-N	0	3	345.487	3.429	20	30		EGEDHN
Cc1ccc(Br)cc1CNC[C@H](O)CC(C)(C)C#N	ZINC000598723745	460006787	/nfs/dbraw/zinc/00/67/87/460006787.db2.gz	JZOCBLAXRRIXLF-CQSZACIVSA-N	0	3	325.250	3.148	20	30		EGEDHN
CC(C)[C@](C)(Cc1ccc(Cl)cc1)NC(=O)[C@H](N)CCCC#N	ZINC000602586796	460011800	/nfs/dbraw/zinc/01/18/00/460011800.db2.gz	VSSZICJVSBTLHQ-AEFFLSMTSA-N	0	3	335.879	3.435	20	30		EGEDHN
Cc1cc(Br)cn2cc(CNC[C@H](C)CCC#N)nc12	ZINC000602612624	460022752	/nfs/dbraw/zinc/02/27/52/460022752.db2.gz	IBGRPJSZPWXMMI-LLVKDONJSA-N	0	3	335.249	3.435	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)C(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000593949119	460023558	/nfs/dbraw/zinc/02/35/58/460023558.db2.gz	WCHQSTPDNWPRII-DYESRHJHSA-N	0	3	347.462	3.128	20	30		EGEDHN
N#Cc1cccc(CN[C@@H]2CCN(c3ccccc3C(F)(F)F)C2)n1	ZINC000602623680	460027534	/nfs/dbraw/zinc/02/75/34/460027534.db2.gz	YVMSDSRWWKHSQP-OAHLLOKOSA-N	0	3	346.356	3.341	20	30		EGEDHN
CC1(c2ccccc2)CN(C(=O)C(C#N)Cc2ccc(C#N)cc2)C1	ZINC000598781696	460032322	/nfs/dbraw/zinc/03/23/22/460032322.db2.gz	RISFAGGMYWMVAZ-GOSISDBHSA-N	0	3	329.403	3.041	20	30		EGEDHN
CSC1CCN(Cc2cn(C)nc2-c2ccc(C#N)cc2)CC1	ZINC000602725774	460088135	/nfs/dbraw/zinc/08/81/35/460088135.db2.gz	NIUVHCXHWJESLA-UHFFFAOYSA-N	0	3	326.469	3.286	20	30		EGEDHN
CN(C[C@@H](O)COc1ccc(C(F)(F)F)cc1)CC1(CC#N)CC1	ZINC000602782895	460122526	/nfs/dbraw/zinc/12/25/26/460122526.db2.gz	JVNDFXUNWHYJQX-CQSZACIVSA-N	0	3	342.361	3.071	20	30		EGEDHN
C[C@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(C#N)c1	ZINC000610357253	460133666	/nfs/dbraw/zinc/13/36/66/460133666.db2.gz	JNYAYSPJPRGQDE-OXJNMPFZSA-N	0	3	348.450	3.193	20	30		EGEDHN
C[C@@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)C1)c1cccc(C#N)c1	ZINC000610357255	460134097	/nfs/dbraw/zinc/13/40/97/460134097.db2.gz	JNYAYSPJPRGQDE-UZLBHIALSA-N	0	3	348.450	3.193	20	30		EGEDHN
C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)N[C@@H](C)c1cccc(C#N)c1	ZINC000610401126	460142711	/nfs/dbraw/zinc/14/27/11/460142711.db2.gz	SDJVEDRKCSUZLN-PMPSAXMXSA-N	0	3	328.460	3.039	20	30		EGEDHN
CC(C)(C#N)c1ccc(C(=O)N[C@@H]2CCCN3CCCC[C@H]23)cc1	ZINC000594196808	460143278	/nfs/dbraw/zinc/14/32/78/460143278.db2.gz	NGMMVLCAHHBPQA-QZTJIDSGSA-N	0	3	325.456	3.234	20	30		EGEDHN
CC(C)(C(=O)N[C@H]1CCCN2CCCC[C@H]12)c1cc(F)cc(C#N)c1	ZINC000594196801	460143568	/nfs/dbraw/zinc/14/35/68/460143568.db2.gz	MUPFVQHQLOBGCM-ZWKOTPCHSA-N	0	3	343.446	3.108	20	30		EGEDHN
N#Cc1ccc(CN[C@H]([C@H]2CCCO2)C2(CO)CCC2)c(Cl)c1	ZINC000602889871	460173428	/nfs/dbraw/zinc/17/34/28/460173428.db2.gz	FLOUXZVXFRUKCX-IAGOWNOFSA-N	0	3	334.847	3.011	20	30		EGEDHN
CN(CCc1ccccc1)[C@@H]1CCN(C(=O)CCCCCC#N)C1	ZINC000598195808	460200839	/nfs/dbraw/zinc/20/08/39/460200839.db2.gz	SWKNSPPYEMUVCD-LJQANCHMSA-N	0	3	327.472	3.236	20	30		EGEDHN
N#CCCCC[C@H](N)C(=O)N[C@H]1CCSc2ccc(Cl)cc21	ZINC000594430082	460216752	/nfs/dbraw/zinc/21/67/52/460216752.db2.gz	VRBHOIYKOFTIHD-KBPBESRZSA-N	0	3	337.876	3.404	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CN[C@H](c1cccs1)C1CC1	ZINC000599348763	460234414	/nfs/dbraw/zinc/23/44/14/460234414.db2.gz	LNEXIXGLANLRPF-YJBOKZPZSA-N	0	3	328.437	3.100	20	30		EGEDHN
Cc1ccccc1CN1CCC(NC(=O)Nc2ccnc(C#N)c2)CC1	ZINC000603137407	460251145	/nfs/dbraw/zinc/25/11/45/460251145.db2.gz	GSXUASFQPJTUIP-UHFFFAOYSA-N	0	3	349.438	3.048	20	30		EGEDHN
N#Cc1ccc(N2CCC(NCc3cscc3Cl)CC2)nc1	ZINC000610930782	460262299	/nfs/dbraw/zinc/26/22/99/460262299.db2.gz	UTOPUINGMINELJ-UHFFFAOYSA-N	0	3	332.860	3.427	20	30		EGEDHN
N#CCc1ccc(OC[C@@H](O)CNC2(c3ccccc3)CCC2)cc1	ZINC000610967519	460267723	/nfs/dbraw/zinc/26/77/23/460267723.db2.gz	ZCXJPULWINGZMP-IBGZPJMESA-N	0	3	336.435	3.161	20	30		EGEDHN
CC(C)(C#N)c1ccccc1Cn1cc(CCN2CCCCC2)nn1	ZINC000603250172	460272204	/nfs/dbraw/zinc/27/22/04/460272204.db2.gz	KIIVQDQAKPGIAR-UHFFFAOYSA-N	0	3	337.471	3.156	20	30		EGEDHN
CN(C)C1(CN(C)C(=O)c2c(Cl)cc(C#N)cc2Cl)CCC1	ZINC000615144978	460283611	/nfs/dbraw/zinc/28/36/11/460283611.db2.gz	OAEQKIBQAKFCMG-UHFFFAOYSA-N	0	3	340.254	3.421	20	30		EGEDHN
CCC(C)(C)N1CCN(c2ccc(C#N)cc2COCCOC)CC1	ZINC000603402596	460297509	/nfs/dbraw/zinc/29/75/09/460297509.db2.gz	KFQWXHMMGCMWEM-UHFFFAOYSA-N	0	3	345.487	3.032	20	30		EGEDHN
CC#CC[C@@H](CO)NCc1ccc(-c2ccccc2[N+](=O)[O-])s1	ZINC000603430540	460303441	/nfs/dbraw/zinc/30/34/41/460303441.db2.gz	BDHZHLHHZLCVML-ZDUSSCGKSA-N	0	3	330.409	3.187	20	30		EGEDHN
CC#CC[C@H](CO)NCc1cccc(OCc2cccc(C#N)c2)c1	ZINC000603432653	460304421	/nfs/dbraw/zinc/30/44/21/460304421.db2.gz	ODVUBUCBTNPVAK-HXUWFJFHSA-N	0	3	334.419	3.001	20	30		EGEDHN
CCN(CCC#N)C(=O)c1ccccc1OCCN1CCCC[C@@H]1C	ZINC000611211667	460309461	/nfs/dbraw/zinc/30/94/61/460309461.db2.gz	IZENSMIHTKIDSR-KRWDZBQOSA-N	0	3	343.471	3.316	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2N[C@@H]1CCN(C2CCCCC2)C1=O	ZINC000611394569	460354531	/nfs/dbraw/zinc/35/45/31/460354531.db2.gz	QEJRVFQREGNRSZ-VQTJNVASSA-N	0	3	337.467	3.459	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2N[C@@H]1CCN(C2CCCCC2)C1=O	ZINC000611394570	460354618	/nfs/dbraw/zinc/35/46/18/460354618.db2.gz	QEJRVFQREGNRSZ-WOJBJXKFSA-N	0	3	337.467	3.459	20	30		EGEDHN
C[C@@]1(C#N)CCCN(C(=O)NCCN2CCC3(CCCCC3)CC2)C1	ZINC000619661115	460406284	/nfs/dbraw/zinc/40/62/84/460406284.db2.gz	FZHMTSOMNYKIKS-IBGZPJMESA-N	0	3	346.519	3.368	20	30		EGEDHN
C=CCSCCNC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000604487962	460432898	/nfs/dbraw/zinc/43/28/98/460432898.db2.gz	DMTVWHXFNPQJKR-SFHVURJKSA-N	0	3	347.528	3.117	20	30		EGEDHN
Cc1ccc(C(C)(C)CNC(=O)C(C#N)Cc2ccc(C#N)cc2)nc1	ZINC000600309136	460470124	/nfs/dbraw/zinc/47/01/24/460470124.db2.gz	WNYMMMKMDNQTBQ-GOSISDBHSA-N	0	3	346.434	3.038	20	30		EGEDHN
C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)c1ccc(C#Cc2ccccc2)cc1	ZINC000607515874	460857533	/nfs/dbraw/zinc/85/75/33/460857533.db2.gz	ZLXJUAKRRRJAPM-XMSQKQJNSA-N	0	3	346.474	3.499	20	30		EGEDHN
N#Cc1cc(F)cc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)c1	ZINC000601714185	460881186	/nfs/dbraw/zinc/88/11/86/460881186.db2.gz	SVYMEAIEYIAQGN-OLZOCXBDSA-N	0	3	330.281	3.383	20	30		EGEDHN
C=CCCNC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1	ZINC000617615273	460928305	/nfs/dbraw/zinc/92/83/05/460928305.db2.gz	FOVJXWKBRPNUFH-MRXNPFEDSA-N	0	3	326.362	3.133	20	30		EGEDHN
C=CCCNC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1	ZINC000665947131	461364303	/nfs/dbraw/zinc/36/43/03/461364303.db2.gz	FGNPFBPOEJTSGI-UHFFFAOYSA-N	0	3	343.393	3.355	20	30		EGEDHN
C[C@@H](CNC(=O)Nc1cccc(C#Cc2cccs2)c1)N(C)C	ZINC000642480196	461516635	/nfs/dbraw/zinc/51/66/35/461516635.db2.gz	ATQLIWZNDPTXSW-AWEZNQCLSA-N	0	3	327.453	3.220	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCOc3ccccc3[C@@H]2C)CC1	ZINC000660596304	461872377	/nfs/dbraw/zinc/87/23/77/461872377.db2.gz	DLMLUTLXANNVBI-INIZCTEOSA-N	0	3	343.471	3.192	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCCc2ccc(C)c(C)c2)CC1	ZINC000660597494	461872430	/nfs/dbraw/zinc/87/24/30/461872430.db2.gz	PVJLLKNNPXSLGH-UHFFFAOYSA-N	0	3	329.488	3.186	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCc2cc3cc(C)ccc3o2)CC1	ZINC000660704085	461929397	/nfs/dbraw/zinc/92/93/97/461929397.db2.gz	JLAJAKITLPWNGM-UHFFFAOYSA-N	0	3	327.428	3.191	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)[C@@H](C)CSc2ccccc2)CC1	ZINC000650852608	461983227	/nfs/dbraw/zinc/98/32/27/461983227.db2.gz	KZHRRHDOXQRPMN-INIZCTEOSA-N	0	3	347.528	3.459	20	30		EGEDHN
C=CCC1(C(=O)Nc2ccc(C(=O)NCCN(C)C)cc2)CCCC1	ZINC000648759944	462265103	/nfs/dbraw/zinc/26/51/03/462265103.db2.gz	JWAJJGCREUYINR-UHFFFAOYSA-N	0	3	343.471	3.053	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)N[C@H]1CCCN2CCCC[C@@H]12	ZINC000654726625	462355075	/nfs/dbraw/zinc/35/50/75/462355075.db2.gz	XFWWNZYXWVMLIM-IRXDYDNUSA-N	0	3	333.501	3.463	20	30		EGEDHN
C[C@H](NCC(=O)Nc1cccc(C#N)c1)c1cccc(N2CCCC2)c1	ZINC000181856500	533829644	/nfs/dbraw/zinc/82/96/44/533829644.db2.gz	OODFRQDGUUCYCH-INIZCTEOSA-N	0	3	348.450	3.448	20	30		EGEDHN
Cc1ccc(C#N)cc1NC(=O)N1CCN(C2CCCCC2)CC1	ZINC000169068259	534256395	/nfs/dbraw/zinc/25/63/95/534256395.db2.gz	YBFGGXKMDNGJFA-UHFFFAOYSA-N	0	3	326.444	3.349	20	30		EGEDHN
N#Cc1ccccc1N1CCCN(Cc2ccc3c[nH]nc3c2)CC1	ZINC000179678384	534816251	/nfs/dbraw/zinc/81/62/51/534816251.db2.gz	NMVSINHZADHFIG-UHFFFAOYSA-N	0	3	331.423	3.147	20	30		EGEDHN
C=CCOCCCC(=O)N1CCC(N2CCc3ccccc3C2)CC1	ZINC000266312170	534871942	/nfs/dbraw/zinc/87/19/42/534871942.db2.gz	XAZLEGPDBMZPMI-UHFFFAOYSA-N	0	3	342.483	3.019	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@H]2c2cccc(F)c2)CC1	ZINC000171737682	526427470	/nfs/dbraw/zinc/42/74/70/526427470.db2.gz	DMYIYHOPUPNVTH-SFHVURJKSA-N	0	3	331.435	3.323	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](c2ccc(OC)cc2)C(C)C)CC1	ZINC000171704281	526437318	/nfs/dbraw/zinc/43/73/18/526437318.db2.gz	XLCMNTYYTXGZNY-LJQANCHMSA-N	0	3	345.487	3.342	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H]2CCc3c2cccc3Cl)CC1	ZINC000171723932	526438067	/nfs/dbraw/zinc/43/80/67/526438067.db2.gz	FPYDGNYNIXNAKQ-QGZVFWFLSA-N	0	3	333.863	3.277	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](C)c2cccc(OCC)c2)CC1	ZINC000171728015	526438402	/nfs/dbraw/zinc/43/84/02/526438402.db2.gz	BGWXLHMHHYVVCL-OAHLLOKOSA-N	0	3	331.460	3.096	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cccc(OCC(=C)C)c2)CC1	ZINC000171640294	526441707	/nfs/dbraw/zinc/44/17/07/526441707.db2.gz	HNAYLWURVNYTED-UHFFFAOYSA-N	0	3	329.444	3.413	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(C(F)(F)F)cc2)CC1	ZINC000171680134	526442105	/nfs/dbraw/zinc/44/21/05/526442105.db2.gz	RTRUGWQHRURWNE-UHFFFAOYSA-N	0	3	327.350	3.477	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(N(CC)CCC)cc2)CC1	ZINC000171714551	526448341	/nfs/dbraw/zinc/44/83/41/526448341.db2.gz	CWPWDFQTHVUWFP-UHFFFAOYSA-N	0	3	329.488	3.303	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(Br)cc2C)CC1	ZINC000171717805	526448393	/nfs/dbraw/zinc/44/83/93/526448393.db2.gz	OWQSOFOLNOTCIA-UHFFFAOYSA-N	0	3	337.261	3.138	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cnc(-c3ccccc3)s2)CC1	ZINC000171718470	526449822	/nfs/dbraw/zinc/44/98/22/526449822.db2.gz	GBUMUUPFZCHJNF-UHFFFAOYSA-N	0	3	327.453	3.190	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccnn2[C@@H](C)C2CC2)CC1	ZINC000156421546	526595976	/nfs/dbraw/zinc/59/59/76/526595976.db2.gz	XOMBZKHHQIPNLK-AWEZNQCLSA-N	0	3	331.464	3.016	20	30		EGEDHN
C=CCNc1ncc(C(=O)Nc2cc(C)cc(CN(C)C)c2)s1	ZINC000130244126	526682921	/nfs/dbraw/zinc/68/29/21/526682921.db2.gz	ULLFZWTYQRHSTF-UHFFFAOYSA-N	0	3	330.457	3.363	20	30		EGEDHN
C=CCN(C)Cc1ccc(OCc2ccc(C(=O)OC)o2)c(OC)c1	ZINC000154758237	527574588	/nfs/dbraw/zinc/57/45/88/527574588.db2.gz	NQBUPDHJXNPVRU-UHFFFAOYSA-N	0	3	345.395	3.272	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCC2(O)CCCCC2)C1	ZINC000329034978	547489910	/nfs/dbraw/zinc/48/99/10/547489910.db2.gz	CBYVQJHACVZQAN-AEFFLSMTSA-N	0	3	345.487	3.021	20	30		EGEDHN
O=C(CN1CCC[C@@H](C2CC2)C1)NC(=O)Nc1ccc2c(c1)OCO2	ZINC000329630140	547502991	/nfs/dbraw/zinc/50/29/91/547502991.db2.gz	HTNQKAAZOLDWKC-CYBMUJFWSA-N	0	3	345.399	3.039	20	30		EGEDHN
C=C(C)COc1cc(CN[C@@H]2CCCC(F)(F)[C@H]2O)ccc1OC	ZINC000414543570	547859463	/nfs/dbraw/zinc/85/94/63/547859463.db2.gz	ZXDCYLJDXTWZIX-PBHICJAKSA-N	0	3	341.398	3.288	20	30		EGEDHN
CN(C[C@@H]1CCCN(C)C1)C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000455701601	547938221	/nfs/dbraw/zinc/93/82/21/547938221.db2.gz	JXWYTTBQQMAULC-CQSZACIVSA-N	0	3	334.851	3.212	20	30		EGEDHN
CCN(CC#Cc1ccc(OC(F)(F)F)cc1)C[C@@H]1CCOC1	ZINC000676557163	549109014	/nfs/dbraw/zinc/10/90/14/549109014.db2.gz	KQUHVLZKVGRQLT-HNNXBMFYSA-N	0	3	327.346	3.295	20	30		EGEDHN
CCC#C[C@@H](C)N(C)C[C@H](O)COc1ccccc1C(F)(F)F	ZINC000677479677	549277549	/nfs/dbraw/zinc/27/75/49/549277549.db2.gz	LOLQUQJGSXKKKT-KGLIPLIRSA-N	0	3	329.362	3.179	20	30		EGEDHN
C=C[C@@H](CC(=O)N1CCCN(C[C@@H]2CCCO2)CC1)c1ccccc1	ZINC000677528385	549286401	/nfs/dbraw/zinc/28/64/01/549286401.db2.gz	VTIBOMAABJWSBQ-ICSRJNTNSA-N	0	3	342.483	3.060	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)Cc1ccccc1-n1cncn1	ZINC000678195232	549422553	/nfs/dbraw/zinc/42/25/53/549422553.db2.gz	CRODDLLBTRBZPP-UHFFFAOYSA-N	0	3	334.423	3.464	20	30		EGEDHN
C=CCCOCC(=O)Nc1cc(C)cc(N2CCN(C(C)C)CC2)c1	ZINC000682959009	550169160	/nfs/dbraw/zinc/16/91/60/550169160.db2.gz	NSWHHBMMCXTEEG-UHFFFAOYSA-N	0	3	345.487	3.057	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN[C@H](C)c2ccc3c(c2)CC(=O)N3C)cc1	ZINC000728714827	574767734	/nfs/dbraw/zinc/76/77/34/574767734.db2.gz	ABHPTUXUBYHSBQ-HUUCEWRRSA-N	0	3	349.434	3.347	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CNC[C@H](c2ccsc2)N(C)C)cc1	ZINC000728712893	574767763	/nfs/dbraw/zinc/76/77/63/574767763.db2.gz	CAZXIDCGUVRCLB-KBXCAEBGSA-N	0	3	329.469	3.431	20	30		EGEDHN
CN1CCC(N(C(=O)COc2cccc(C#N)c2)c2ccccc2)CC1	ZINC000732732767	575285353	/nfs/dbraw/zinc/28/53/53/575285353.db2.gz	KUWFKHYWQYQVOG-UHFFFAOYSA-N	0	3	349.434	3.064	20	30		EGEDHN
Cc1nc(Cl)cc(N=NC(C)c2cccc(OCCN(C)C)c2)n1	ZINC000741767464	575379615	/nfs/dbraw/zinc/37/96/15/575379615.db2.gz	VXPPDTCVYCXUBN-UHFFFAOYSA-N	0	3	347.850	3.215	20	30		EGEDHN
CCOCCC[N@@H+]1CC[C@H](/N=C\c2ccc(OCC)cc2[O-])[C@@H](C)C1	ZINC000734366172	575474507	/nfs/dbraw/zinc/47/45/07/575474507.db2.gz	HAYACCHDYICEGX-YXQGDLBPSA-N	0	3	348.487	3.347	20	30		EGEDHN
CCOCCC[N@H+]1CC[C@H](/N=C\c2ccc(OCC)cc2[O-])[C@@H](C)C1	ZINC000734366172	575474509	/nfs/dbraw/zinc/47/45/09/575474509.db2.gz	HAYACCHDYICEGX-YXQGDLBPSA-N	0	3	348.487	3.347	20	30		EGEDHN
C#CCOc1ccc(C(=O)N(CCN(C)C)C2CCCCC2)cc1	ZINC000741545715	576699451	/nfs/dbraw/zinc/69/94/51/576699451.db2.gz	OQANOSPIASWWJP-UHFFFAOYSA-N	0	3	328.456	3.035	20	30		EGEDHN
C#CCOc1cc(F)ccc1NCc1ccc(OCCN(C)C)cc1	ZINC000742376374	576775907	/nfs/dbraw/zinc/77/59/07/576775907.db2.gz	QNURSHURMLDZMD-UHFFFAOYSA-N	0	3	342.414	3.390	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2ccc(Cl)c3cccnc23)CC1	ZINC000743493095	576810381	/nfs/dbraw/zinc/81/03/81/576810381.db2.gz	HIDKRWDWXIWDDY-UHFFFAOYSA-N	0	3	341.842	3.106	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)[C@H](C)c1ccco1	ZINC000744031442	576819314	/nfs/dbraw/zinc/81/93/14/576819314.db2.gz	XIHWAECJOIZJBW-OLZOCXBDSA-N	0	3	326.352	3.129	20	30		EGEDHN
Cc1cc(Br)cc(C)c1NC(=O)[C@H](N)CCCCC#N	ZINC000691554136	1298133999	/nfs/dbraw/zinc/13/39/99/1298133999.db2.gz	MSBOPEYSNSSMHP-CYBMUJFWSA-N	0	3	338.249	3.416	20	30		EGEDHN
C[C@H](CC(=O)C(C#N)c1nc2ccccc2o1)NC(=O)c1ccccc1	ZINC000041542776	1291418233	/nfs/dbraw/zinc/41/82/33/1291418233.db2.gz	OTBNVGKFKGQANB-UKRRQHHQSA-N	0	3	347.374	3.213	20	30		EGEDHN
COc1ccc(CNC(=O)C(C#N)C(=O)CCC2CCCCC2)cc1	ZINC000051619665	1291681282	/nfs/dbraw/zinc/68/12/82/1291681282.db2.gz	XNABPWIPRVMURA-SFHVURJKSA-N	0	3	342.439	3.381	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/CCCN2CCCCCC2=O)c([O-])c1	ZINC000060804688	1291943730	/nfs/dbraw/zinc/94/37/30/1291943730.db2.gz	BSEJROYDNCMHCE-LTGZKZEYSA-N	0	3	345.487	3.450	20	30		EGEDHN
C#CCCN(CCOC)Cc1cc(Cl)c(OC)c(OCC)c1	ZINC000827818256	1292382247	/nfs/dbraw/zinc/38/22/47/1292382247.db2.gz	PRTUERFZSAXIAF-UHFFFAOYSA-N	0	3	325.836	3.219	20	30		EGEDHN
CN(c1ccc(CNC(=O)[C@@H](N)CCCC#N)cc1)C1CCCCC1	ZINC000827821350	1292382285	/nfs/dbraw/zinc/38/22/85/1292382285.db2.gz	WDYHRMHFAQKVMH-IBGZPJMESA-N	0	3	342.487	3.093	20	30		EGEDHN
Cc1cccc2c(CCC(=O)C(C#N)C(=O)NC3CCCC3)c[nH]c21	ZINC000076839167	1292445542	/nfs/dbraw/zinc/44/55/42/1292445542.db2.gz	ZYNTXCSRJLQFID-QGZVFWFLSA-N	0	3	337.423	3.177	20	30		EGEDHN
CN(Cc1ccc(F)c(C#N)c1)C1CC(NC(=O)OC(C)(C)C)C1	ZINC000831236740	1292832769	/nfs/dbraw/zinc/83/27/69/1292832769.db2.gz	CSWVHDFXGTXHHT-UHFFFAOYSA-N	0	3	333.407	3.185	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)CC[C@H]1CCCCO1	ZINC000111945175	1293113660	/nfs/dbraw/zinc/11/36/60/1293113660.db2.gz	YDJYBIPZDPKQII-HUUCEWRRSA-N	0	3	344.411	3.082	20	30		EGEDHN
C=C(CC)CN[C@@H](C)c1ccc(S(=O)(=O)C(F)F)c(OC)c1	ZINC000834902001	1293170409	/nfs/dbraw/zinc/17/04/09/1293170409.db2.gz	CRVRLFUHZUBREA-NSHDSACASA-N	0	3	333.400	3.308	20	30		EGEDHN
Cc1cccc(CNC(=O)C(C#N)C(=O)CCCC(=O)C(C)(C)C)c1	ZINC000835338697	1293267299	/nfs/dbraw/zinc/26/72/99/1293267299.db2.gz	BOXFSSJVHKCPFH-MRXNPFEDSA-N	0	3	342.439	3.106	20	30		EGEDHN
Cc1cc2cc(C([O-])=C(C#N)C(=O)Nc3ccccn3)oc2cc1C	ZINC000123466096	1293444431	/nfs/dbraw/zinc/44/44/31/1293444431.db2.gz	DLSNJKFYBUOKJF-AWEZNQCLSA-N	0	3	333.347	3.406	20	30		EGEDHN
Cc1cc2cc(C(=O)C(C#N)C(=O)Nc3ccccn3)oc2cc1C	ZINC000123466096	1293444436	/nfs/dbraw/zinc/44/44/36/1293444436.db2.gz	DLSNJKFYBUOKJF-AWEZNQCLSA-N	0	3	333.347	3.406	20	30		EGEDHN
C[C@@H](SCc1ccccc1)C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000125220660	1293500369	/nfs/dbraw/zinc/50/03/69/1293500369.db2.gz	TUJBZDZRBZWMAZ-UKRRQHHQSA-N	0	3	339.420	3.051	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)CCCc2cccs2)c1	ZINC000127046886	1293551418	/nfs/dbraw/zinc/55/14/18/1293551418.db2.gz	UDKYYZLJMPQXHD-INIZCTEOSA-N	0	3	342.420	3.427	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)Cc1ccccc1F	ZINC000128916023	1293608224	/nfs/dbraw/zinc/60/82/24/1293608224.db2.gz	CDIKJQUFEZEZIM-CQSZACIVSA-N	0	3	340.354	3.114	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)CCC2CCCC2)cc1OC	ZINC000130029450	1293642677	/nfs/dbraw/zinc/64/26/77/1293642677.db2.gz	KZGAXGYPPFNUOF-HNNXBMFYSA-N	0	3	344.411	3.322	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)CCc1ccc(-c2ccccc2F)o1	ZINC000130735000	1293666591	/nfs/dbraw/zinc/66/65/91/1293666591.db2.gz	WBTGZGATRNAFQR-HNNXBMFYSA-N	0	3	342.370	3.252	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)CCCc2cccs2)cc1	ZINC000131664911	1293697167	/nfs/dbraw/zinc/69/71/67/1293697167.db2.gz	OYBMAVGOEIHVEK-INIZCTEOSA-N	0	3	342.420	3.427	20	30		EGEDHN
CCc1ncsc1C(=O)C(C#N)C(=O)Nc1ccc(CC)cc1	ZINC000160166046	1294260890	/nfs/dbraw/zinc/26/08/90/1294260890.db2.gz	YRJAZJPDWXTXIG-CYBMUJFWSA-N	0	3	327.409	3.229	20	30		EGEDHN
C[C@H](OC1CCCCCC1)C(=O)C(C#N)C(=O)NCc1ccccc1	ZINC000162392651	1294315003	/nfs/dbraw/zinc/31/50/03/1294315003.db2.gz	AVNJWXRFOJIYJM-MAUKXSAKSA-N	0	3	342.439	3.140	20	30		EGEDHN
C[C@H](OC1CCCCCC1)C(=O)C(C#N)C(=O)Nc1ccccc1	ZINC000162419000	1294315071	/nfs/dbraw/zinc/31/50/71/1294315071.db2.gz	KXWOERJDYZDZKA-YOEHRIQHSA-N	0	3	328.412	3.462	20	30		EGEDHN
C[C@H](NCc1ccc([S@@](C)=O)cc1)c1ccc(OCC#N)cc1	ZINC000175992540	1294584044	/nfs/dbraw/zinc/58/40/44/1294584044.db2.gz	JVQYHRGKSRQUSI-LFVRLGFBSA-N	0	3	328.437	3.177	20	30		EGEDHN
CC[C@@H](NC(C)=O)C(=O)C(C#N)c1nc2cc(Cl)ccc2s1	ZINC000870161094	1295711375	/nfs/dbraw/zinc/71/13/75/1295711375.db2.gz	WXDKMGOZBWZRBP-WDEREUQCSA-N	0	3	335.816	3.041	20	30		EGEDHN
N#CC(C(=O)COC1CCCCC1)C(=O)Nc1ccc(Cl)cc1	ZINC000193402770	1295862491	/nfs/dbraw/zinc/86/24/91/1295862491.db2.gz	NYCDDZBWGPNQMY-HNNXBMFYSA-N	0	3	334.803	3.337	20	30		EGEDHN
CCNC(=O)c1ccc(CNCc2ccc(O[C@H](C)C#N)cc2)cc1	ZINC000236960292	1296213599	/nfs/dbraw/zinc/21/35/99/1296213599.db2.gz	MXYFGHWXHKJJMD-OAHLLOKOSA-N	0	3	337.423	3.017	20	30		EGEDHN
COc1ccc(CNCc2ccc(O[C@@H](C)C#N)cc2)cc1OC	ZINC000237236182	1296229623	/nfs/dbraw/zinc/22/96/23/1296229623.db2.gz	UWQCZQVCQRUJMC-AWEZNQCLSA-N	0	3	326.396	3.284	20	30		EGEDHN
N#CC(C(=O)NC1CC1)C(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl	ZINC000245897394	1296329503	/nfs/dbraw/zinc/32/95/03/1296329503.db2.gz	FCKKEHDVOBSJED-AGIUHOORSA-N	0	3	337.206	3.084	20	30		EGEDHN
N#CC(C(=O)C=Cc1ccc(Cl)s1)C(=O)Nc1ccccn1	ZINC000255494320	1296538250	/nfs/dbraw/zinc/53/82/50/1296538250.db2.gz	OGYKGNHZEJDNMQ-VLWUPBBWSA-N	0	3	331.784	3.157	20	30		EGEDHN
CC(C)(C)OC(=O)N1[C@@H]2CC[C@H]1C[C@@H](CNC[C@H](C#N)CCC#N)C2	ZINC000872233114	1296833665	/nfs/dbraw/zinc/83/36/65/1296833665.db2.gz	NFCNUGIKIPMQQW-NXOAAHMSSA-N	0	3	346.475	3.198	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)C1CCC=CCC1	ZINC000873498776	1297544862	/nfs/dbraw/zinc/54/48/62/1297544862.db2.gz	YDUQEMREZJPSHB-HNNXBMFYSA-N	0	3	326.396	3.479	20	30		EGEDHN
C=C[C@H](COC)N[C@H](C)c1ccc(I)cc1	ZINC000390507296	1297627058	/nfs/dbraw/zinc/62/70/58/1297627058.db2.gz	XTASAPYJYRNCSB-ZWNOBZJWSA-N	0	3	331.197	3.143	20	30		EGEDHN
CC1(C)CN(C[C@@H](O)c2cccc(C#N)c2)CCN1Cc1ccccc1	ZINC000402409562	1297745078	/nfs/dbraw/zinc/74/50/78/1297745078.db2.gz	XZWZKCLLFBLFRQ-OAQYLSRUSA-N	0	3	349.478	3.188	20	30		EGEDHN
Cc1nc(C#N)cc(N2C[C@H](C)N(Cc3ccccc3)[C@H](C)[C@@H]2C)n1	ZINC000404416887	1297752153	/nfs/dbraw/zinc/75/21/53/1297752153.db2.gz	GOYXQKLVIHDMDB-XHSDSOJGSA-N	0	3	335.455	3.144	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC000404701723	1297760035	/nfs/dbraw/zinc/76/00/35/1297760035.db2.gz	YZUOSZUQIRMFPP-HNNXBMFYSA-N	0	3	333.407	3.186	20	30		EGEDHN
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)c1ccc(C#N)cn1	ZINC000719961464	1298324871	/nfs/dbraw/zinc/32/48/71/1298324871.db2.gz	JQHGSSUFTHWDTD-LJQANCHMSA-N	0	3	348.450	3.080	20	30		EGEDHN
Cc1ccc2c(CCC(=O)C(C#N)C(=O)Nc3ccccn3)c[nH]c2c1	ZINC000745949690	1298503434	/nfs/dbraw/zinc/50/34/34/1298503434.db2.gz	UCYMKNLAENOBML-INIZCTEOSA-N	0	3	346.390	3.152	20	30		EGEDHN
CC(C)c1cc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)nn1C	ZINC000747108755	1298727824	/nfs/dbraw/zinc/72/78/24/1298727824.db2.gz	RLZDQCYJDRSHMW-LLVKDONJSA-N	0	3	344.802	3.158	20	30		EGEDHN
COc1csc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)c1	ZINC000747108408	1298728034	/nfs/dbraw/zinc/72/80/34/1298728034.db2.gz	OQYRCTSERKAQAG-JTQLQIEISA-N	0	3	334.784	3.371	20	30		EGEDHN
N#Cc1csc(CNC[C@H](O)c2ccccc2C(F)(F)F)c1	ZINC000748099493	1298929843	/nfs/dbraw/zinc/92/98/43/1298929843.db2.gz	RJHBPRFONQBURP-AWEZNQCLSA-N	0	3	326.343	3.462	20	30		EGEDHN
CC(=O)[C@](C#N)(CCN(C)CCC1CCOCC1)c1ccccc1	ZINC000878186906	1299802935	/nfs/dbraw/zinc/80/29/35/1299802935.db2.gz	PCPAPBJBLBBEFQ-HXUWFJFHSA-N	0	3	328.456	3.176	20	30		EGEDHN
CC(=O)[C@](C#N)(CCN1CCC([C@H]2CCCO2)CC1)c1ccccc1	ZINC000878483073	1300028403	/nfs/dbraw/zinc/02/84/03/1300028403.db2.gz	GCBLYSMWULXOEK-NHCUHLMSSA-N	0	3	340.467	3.318	20	30		EGEDHN
N#CCC1(CN2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)CC1	ZINC000878538682	1300060131	/nfs/dbraw/zinc/06/01/31/1300060131.db2.gz	PVFZVZIBXYBJSW-SFHVURJKSA-N	0	3	341.455	3.319	20	30		EGEDHN
C[C@H](C(=O)N(CCC#N)c1ccc(F)cc1)N1C[C@@H]2CC=CC[C@@H]2C1	ZINC000879528551	1300582782	/nfs/dbraw/zinc/58/27/82/1300582782.db2.gz	GQOWVDMTRCOGEK-ZACQAIPSSA-N	0	3	341.430	3.359	20	30		EGEDHN
C[C@H](c1ccccc1)N1CCN(CCCC2(C#N)CCOCC2)CC1	ZINC000880250799	1301004102	/nfs/dbraw/zinc/00/41/02/1301004102.db2.gz	NGQZSVROYGAEIS-LJQANCHMSA-N	0	3	341.499	3.466	20	30		EGEDHN
CN(C)Cc1c2ccccc2oc1C(=O)Nc1ncc(C#N)s1	ZINC000759633415	1301133798	/nfs/dbraw/zinc/13/37/98/1301133798.db2.gz	ZPVZRZBGCMQZHQ-UHFFFAOYSA-N	0	3	326.381	3.075	20	30		EGEDHN
C#CCCN[C@@H](c1ccc(CC)cc1)c1cccc(S(C)(=O)=O)c1	ZINC000760296700	1301248759	/nfs/dbraw/zinc/24/87/59/1301248759.db2.gz	RWPMNIXVYXPDSP-FQEVSTJZSA-N	0	3	341.476	3.355	20	30		EGEDHN
CCO[C@@H](CC(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1)C(C)C	ZINC000761037278	1301385259	/nfs/dbraw/zinc/38/52/59/1301385259.db2.gz	FBEMJMJPYZMTER-HOCLYGCPSA-N	0	3	336.819	3.439	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)C[C@@H](OCC)C(C)C	ZINC000761038198	1301386746	/nfs/dbraw/zinc/38/67/46/1301386746.db2.gz	ROOVNDYMAIVVBX-RDTXWAMCSA-N	0	3	346.427	3.184	20	30		EGEDHN
N#CCc1ccccc1CC(=O)O[C@@H]1CCN(Cc2ccccc2)C1	ZINC000761104313	1301403115	/nfs/dbraw/zinc/40/31/15/1301403115.db2.gz	KJIYTCDLGVXNIL-HXUWFJFHSA-N	0	3	334.419	3.113	20	30		EGEDHN
CC[C@H](C)N1CCN(c2nccc(Oc3cccc(C#N)c3)n2)CC1	ZINC000882428384	1301959932	/nfs/dbraw/zinc/95/99/32/1301959932.db2.gz	RFBNVUSXRAWPCL-HNNXBMFYSA-N	0	3	337.427	3.061	20	30		EGEDHN
C#CCOc1ccccc1CNC[C@](C)(O)c1ccccc1Cl	ZINC000764984435	1302181965	/nfs/dbraw/zinc/18/19/65/1302181965.db2.gz	VVSQKJWKRZTCPD-IBGZPJMESA-N	0	3	329.827	3.349	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)cc1)c1ccc(N2CCOCC2)c(F)c1	ZINC000765013224	1302184955	/nfs/dbraw/zinc/18/49/55/1302184955.db2.gz	RXQPWZQLMMSQJW-HNNXBMFYSA-N	0	3	339.414	3.385	20	30		EGEDHN
Cc1cc(CNCc2ccc(N3CCOCC3)c(F)c2)ccc1C#N	ZINC000767679516	1302744552	/nfs/dbraw/zinc/74/45/52/1302744552.db2.gz	AEUZJWBPAYVTHK-UHFFFAOYSA-N	0	3	339.414	3.132	20	30		EGEDHN
C=CCNC(=O)[C@@H](C)N1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1	ZINC000767875148	1302777588	/nfs/dbraw/zinc/77/75/88/1302777588.db2.gz	JSBKLYODOPCCMP-TZMCWYRMSA-N	0	3	326.362	3.185	20	30		EGEDHN
COc1cc(Cl)c(C)cc1NC(=O)C(C#N)C(=O)C=CSC	ZINC000771581993	1303423184	/nfs/dbraw/zinc/42/31/84/1303423184.db2.gz	IDLYYPLFVKOSCD-UMCURTJPSA-N	0	3	338.816	3.181	20	30		EGEDHN
C=CCC1(O)CCN(CCOc2ccc(C(F)(F)F)cc2)CC1	ZINC000886763760	1303589408	/nfs/dbraw/zinc/58/94/08/1303589408.db2.gz	DJKDKGINWCRHNW-UHFFFAOYSA-N	0	3	329.362	3.487	20	30		EGEDHN
Cc1csc(CCC(=O)C(C#N)C(=O)Nc2ccccc2Cl)n1	ZINC000774056774	1303769608	/nfs/dbraw/zinc/76/96/08/1303769608.db2.gz	YQNVKKXUIDAIOT-LLVKDONJSA-N	0	3	347.827	3.385	20	30		EGEDHN
C#C[C@@H](NCc1ccc(OCc2ccccc2)cc1O)[C@H]1CCCO1	ZINC000775998193	1304077419	/nfs/dbraw/zinc/07/74/19/1304077419.db2.gz	DTBZVLDYANQFRV-TZIWHRDSSA-N	0	3	337.419	3.242	20	30		EGEDHN
C#C[C@@H]([NH2+]Cc1ccc(OCc2ccccc2)cc1[O-])[C@H]1CCCO1	ZINC000775998193	1304077423	/nfs/dbraw/zinc/07/74/23/1304077423.db2.gz	DTBZVLDYANQFRV-TZIWHRDSSA-N	0	3	337.419	3.242	20	30		EGEDHN
C[C@@H](N[C@@H]1CCN(C2CCCCC2)C1=O)c1ccc(OCC#N)cc1	ZINC000776168316	1304106342	/nfs/dbraw/zinc/10/63/42/1304106342.db2.gz	IOQRXLQUZBQFSF-DNVCBOLYSA-N	0	3	341.455	3.173	20	30		EGEDHN
C=CCc1cc(OCC)cc(CN2CCC(O)(C(F)F)CC2)c1O	ZINC000777573306	1304320730	/nfs/dbraw/zinc/32/07/30/1304320730.db2.gz	LTCPBVSDWHYNCQ-UHFFFAOYSA-N	0	3	341.398	3.111	20	30		EGEDHN
C#C[C@H]([NH2+][C@H](C)c1cc(Br)cc(C)c1[O-])[C@H]1CCCO1	ZINC000779052385	1304523043	/nfs/dbraw/zinc/52/30/43/1304523043.db2.gz	PKJMUEWJVGWLPG-BYCMXARLSA-N	0	3	338.245	3.295	20	30		EGEDHN
N#CCOc1ccc(CN2CC[C@H](Oc3cccc(F)c3)C2)cc1	ZINC000784484506	1305250308	/nfs/dbraw/zinc/25/03/08/1305250308.db2.gz	LOGHWNWPBZAYNU-IBGZPJMESA-N	0	3	326.371	3.381	20	30		EGEDHN
C#CCOc1ccccc1CNC[C@@H](O)c1cc(F)cc(Cl)c1	ZINC000785611617	1305393479	/nfs/dbraw/zinc/39/34/79/1305393479.db2.gz	ZJSGIRUOYDJDQF-QGZVFWFLSA-N	0	3	333.790	3.314	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1Cl)C(=O)[C@@H]1CCOC2(CCC2)C1	ZINC000892489450	1305401027	/nfs/dbraw/zinc/40/10/27/1305401027.db2.gz	KIZINFJAEGWMNG-OLZOCXBDSA-N	0	3	346.814	3.337	20	30		EGEDHN
C=C1CCC(C(=O)C(C#N)C(=O)Nc2ccccc2OCC)CC1	ZINC000892497797	1305408427	/nfs/dbraw/zinc/40/84/27/1305408427.db2.gz	XWLPWJMUBPHOKZ-OAHLLOKOSA-N	0	3	326.396	3.479	20	30		EGEDHN
CS[C@H](C)CCC(=O)C(C#N)C(=O)NCc1cccc(Cl)c1	ZINC000786531288	1305591507	/nfs/dbraw/zinc/59/15/07/1305591507.db2.gz	OEBCLTLJFHHPBV-BXUZGUMPSA-N	0	3	338.860	3.197	20	30		EGEDHN
CC(C)n1cc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)cn1	ZINC000786931305	1305660938	/nfs/dbraw/zinc/66/09/38/1305660938.db2.gz	WOBJSPSCUYDZDR-LBPRGKRZSA-N	0	3	330.775	3.079	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=S)Nc1ccsc1	ZINC000790305793	1306295070	/nfs/dbraw/zinc/29/50/70/1306295070.db2.gz	FNVUWAUPEHEXLL-UHFFFAOYSA-N	0	3	344.509	3.380	20	30		EGEDHN
Cc1nc(CNC2CCN(Cc3cccc(C#N)c3)CC2)sc1C	ZINC000895187864	1309229361	/nfs/dbraw/zinc/22/93/61/1309229361.db2.gz	IOOZGTGOMVDRQQ-UHFFFAOYSA-N	0	3	340.496	3.386	20	30		EGEDHN
COc1ccc(C[NH2+]Cc2ccc(N(C)CCC#N)cc2)c([O-])c1	ZINC000793388007	1309361681	/nfs/dbraw/zinc/36/16/81/1309361681.db2.gz	DVOYHTMEDVYCEF-UHFFFAOYSA-N	0	3	325.412	3.040	20	30		EGEDHN
Cc1ccc2c(c1)CC[C@@H](C(=O)C(C#N)C(=O)Nc1ccccc1)O2	ZINC000796633780	1310052088	/nfs/dbraw/zinc/05/20/88/1310052088.db2.gz	OYLQKVPFXHOBJJ-AEFFLSMTSA-N	0	3	334.375	3.036	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCCC[C@H]1COC(=O)NC(C)C	ZINC000796719369	1310072329	/nfs/dbraw/zinc/07/23/29/1310072329.db2.gz	ZWGPSMODZBELIC-SFHVURJKSA-N	0	3	329.444	3.356	20	30		EGEDHN
N#CC(C(=O)NCc1cccc(Cl)c1)C(=O)[C@@H]1CCC(F)(F)C1	ZINC000796883829	1310105085	/nfs/dbraw/zinc/10/50/85/1310105085.db2.gz	FXJMRIHDJLCXRO-DGCLKSJQSA-N	0	3	340.757	3.100	20	30		EGEDHN
Cc1sc(=O)n(CC(=O)C(C#N)c2ncc(C(C)(C)C)s2)c1C	ZINC000797566466	1310212849	/nfs/dbraw/zinc/21/28/49/1310212849.db2.gz	KUFBNJVIXKRJHR-NSHDSACASA-N	0	3	349.481	3.157	20	30		EGEDHN
N#Cc1ccc(C2CCN(Cc3ccc4c(c3)NC(=O)CO4)CC2)cc1	ZINC000897588484	1310395503	/nfs/dbraw/zinc/39/55/03/1310395503.db2.gz	DCJITQLXUXRAPH-UHFFFAOYSA-N	0	3	347.418	3.269	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)CCCC1CCOCC1	ZINC000798814086	1310446035	/nfs/dbraw/zinc/44/60/35/1310446035.db2.gz	PVPUAIIPCXQIAI-HNNXBMFYSA-N	0	3	325.412	3.346	20	30		EGEDHN
C[C@@H](C(=O)C(C#N)c1ncc(C(C)(C)C)s1)N(C)CC(F)(F)F	ZINC000798865002	1310451598	/nfs/dbraw/zinc/45/15/98/1310451598.db2.gz	QAESETOVXHSRFO-VHSXEESVSA-N	0	3	347.406	3.499	20	30		EGEDHN
N#C[C@@H]1CC[C@H]([NH2+][C@@H]2CCCN(Cc3cc(Cl)ccc3[O-])C2)C1	ZINC000799718042	1310605206	/nfs/dbraw/zinc/60/52/06/1310605206.db2.gz	ZJHBLONDNNOVLK-XOKHGSTOSA-N	0	3	333.863	3.292	20	30		EGEDHN
Cc1cccc(CNC(=O)C(C#N)C(=O)[C@H]2CCCC(F)(F)C2)c1	ZINC000800409210	1310750393	/nfs/dbraw/zinc/75/03/93/1310750393.db2.gz	KEELYUYVEMUWSL-LSDHHAIUSA-N	0	3	334.366	3.146	20	30		EGEDHN
CC#CC(=O)Nc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000801182968	1310876793	/nfs/dbraw/zinc/87/67/93/1310876793.db2.gz	UIJHKBVMDFFFNT-UHFFFAOYSA-N	0	3	347.462	3.013	20	30		EGEDHN
COc1cc(Br)cc(C[NH2+]CC(C)(C)CC#N)c1[O-]	ZINC000839162958	1320882923	/nfs/dbraw/zinc/88/29/23/1320882923.db2.gz	FSQUDPBCUUWIHL-UHFFFAOYSA-N	0	3	327.222	3.193	20	30		EGEDHN
C[C@@H](C#N)OCCN(Cc1ccccc1)C[C@H](O)c1ccsc1	ZINC000801927062	1316966892	/nfs/dbraw/zinc/96/68/92/1316966892.db2.gz	HXBRKCYSTZKDBF-YJBOKZPZSA-N	0	3	330.453	3.212	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2CC[C@H](NCc3ccsc3)C2)cc1	ZINC001019054869	1317027895	/nfs/dbraw/zinc/02/78/95/1317027895.db2.gz	GRDACQHPQIGVIF-KRWDZBQOSA-N	0	3	342.464	3.317	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](NCc2ccccc2OC(C)C)C1	ZINC001019238045	1317116735	/nfs/dbraw/zinc/11/67/35/1317116735.db2.gz	KAQTVJACHKECOX-KRWDZBQOSA-N	0	3	330.472	3.377	20	30		EGEDHN
CCc1ccccc1C(=O)N1CC[C@H](NCc2ccc(C#N)s2)C1	ZINC001019301950	1317154372	/nfs/dbraw/zinc/15/43/72/1317154372.db2.gz	KMEKPWNBYNOUCN-HNNXBMFYSA-N	0	3	339.464	3.186	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)[C@@H]3CC4CCC3CC4)C2)s1	ZINC001019833172	1317442503	/nfs/dbraw/zinc/44/25/03/1317442503.db2.gz	IFEFDSFPFCVJLC-ZUBZBLCWSA-N	0	3	343.496	3.137	20	30		EGEDHN
CCN(Cc1ccccc1C#N)CC1CCN(C(=O)[C@@H]2C[C@@H]2C)CC1	ZINC000957670485	1317541875	/nfs/dbraw/zinc/54/18/75/1317541875.db2.gz	UWNYFCGNOPLQKI-OXJNMPFZSA-N	0	3	339.483	3.275	20	30		EGEDHN
C#CCOc1ccc(C(=O)NC[C@H](N[C@@H](C)CC)c2ccco2)cc1	ZINC000807680097	1317577657	/nfs/dbraw/zinc/57/76/57/1317577657.db2.gz	LRRZDYYIXNJDNL-YJBOKZPZSA-N	0	3	340.423	3.151	20	30		EGEDHN
C#C[C@H](NC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F)C(C)(C)C	ZINC000807879131	1317597644	/nfs/dbraw/zinc/59/76/44/1317597644.db2.gz	OJYVZSPEURQQFA-SJORKVTESA-N	0	3	348.437	3.308	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC(CN(CC)Cc2cc(C)no2)CC1	ZINC000957737487	1317601358	/nfs/dbraw/zinc/60/13/58/1317601358.db2.gz	KGYRSMSDEGGDOE-UHFFFAOYSA-N	0	3	333.476	3.256	20	30		EGEDHN
CC[C@@H]1CCC1=NNC(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000807949073	1317603858	/nfs/dbraw/zinc/60/38/58/1317603858.db2.gz	UYRZFSVWKWSAER-MRXNPFEDSA-N	0	3	344.528	3.291	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H]2CCCC[C@@H]2C(F)(F)F)C1	ZINC001020295320	1317631673	/nfs/dbraw/zinc/63/16/73/1317631673.db2.gz	SCBOLYGCNSBUBA-LPWJVIDDSA-N	0	3	338.801	3.344	20	30		EGEDHN
C#C[C@H](NC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1)C(C)(C)C	ZINC000808243806	1317649754	/nfs/dbraw/zinc/64/97/54/1317649754.db2.gz	PPASRAYBUIJHMV-JQHSSLGASA-N	0	3	327.472	3.169	20	30		EGEDHN
COc1ccc(CN[C@H](C)c2cccc(COC(C)=O)c2)cc1C#N	ZINC000903127481	1317659033	/nfs/dbraw/zinc/65/90/33/1317659033.db2.gz	ZADQXBYWITZLMN-CQSZACIVSA-N	0	3	338.407	3.481	20	30		EGEDHN
CC1(C)CCC[C@@H]1C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001020478440	1317713848	/nfs/dbraw/zinc/71/38/48/1317713848.db2.gz	MSTNGAKBZSVAFK-BRWVUGGUSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)Cc2ccc(F)c(Cl)c2)C1	ZINC001020623801	1317807681	/nfs/dbraw/zinc/80/76/81/1317807681.db2.gz	CLODEKPCCHZKDC-HAQNSBGRSA-N	0	3	331.218	3.011	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccccc2O[C@H](C)CC)C1	ZINC001020649828	1317833147	/nfs/dbraw/zinc/83/31/47/1317833147.db2.gz	MJGUGFFLIPNPHZ-RBSFLKMASA-N	0	3	336.863	3.467	20	30		EGEDHN
C#Cc1ccc(CNc2ccc(CN3CCN(CC)CC3)cc2)cc1	ZINC000809596995	1317839873	/nfs/dbraw/zinc/83/98/73/1317839873.db2.gz	WYIIYEFGJZQZOZ-UHFFFAOYSA-N	0	3	333.479	3.418	20	30		EGEDHN
C#Cc1ccc(CNCc2ccc(N3CCC(O)CC3)c(F)c2)cc1	ZINC000809609361	1317844610	/nfs/dbraw/zinc/84/46/10/1317844610.db2.gz	HQNBMPKKSJEEPB-UHFFFAOYSA-N	0	3	338.426	3.058	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2csc(-c3ccoc3)n2)C1	ZINC001020769059	1317916045	/nfs/dbraw/zinc/91/60/45/1317916045.db2.gz	RRLQETQZLDHRHL-HAQNSBGRSA-N	0	3	337.832	3.006	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCCC[C@H]1COC(=O)NC1CC1	ZINC000810040871	1317941309	/nfs/dbraw/zinc/94/13/09/1317941309.db2.gz	YIBASIZMXDQPMI-SFHVURJKSA-N	0	3	327.428	3.110	20	30		EGEDHN
COc1cc(C#N)ccc1C(=O)N1c2ccccc2CC[C@@H]1CN(C)C	ZINC000905729908	1317986261	/nfs/dbraw/zinc/98/62/61/1317986261.db2.gz	WAKPRHBXSOECDY-QGZVFWFLSA-N	0	3	349.434	3.090	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000810464411	1318011532	/nfs/dbraw/zinc/01/15/32/1318011532.db2.gz	BCUUELDEAPYKAW-QFIPXVFZSA-N	0	3	346.474	3.333	20	30		EGEDHN
C#CC[C@H](CCOC)NCc1ccc(-c2ccccc2[N+](=O)[O-])o1	ZINC000858333245	1328739261	/nfs/dbraw/zinc/73/92/61/1328739261.db2.gz	ACFFWWQNPMUGCK-CQSZACIVSA-N	0	3	328.368	3.373	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)c2cccc(C3CC3)c2)C1	ZINC001021104827	1318085591	/nfs/dbraw/zinc/08/55/91/1318085591.db2.gz	JYCCWWVUPTVIAQ-WKILWMFISA-N	0	3	349.272	3.323	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc(C(C)(F)F)cc2)C1	ZINC001021152624	1318115018	/nfs/dbraw/zinc/11/50/18/1318115018.db2.gz	SGXWBOOVODACGE-HDJSIYSDSA-N	0	3	328.790	3.401	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)c2ccsc2C#N)CN1Cc1ccccc1	ZINC000906971161	1318169812	/nfs/dbraw/zinc/16/98/12/1318169812.db2.gz	HESAXRWXZUWCIP-DZGCQCFKSA-N	0	3	325.437	3.013	20	30		EGEDHN
CO[C@H](C)[C@@H](C)N[C@H](C)C(=O)/C=C1\N(C)c2ccccc2C1(C)C	ZINC000811637668	1318216822	/nfs/dbraw/zinc/21/68/22/1318216822.db2.gz	HHDQVZGFZNGGHX-WQTSANLJSA-N	0	3	330.472	3.269	20	30		EGEDHN
C[C@H](C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)s1)C1CC1	ZINC000959942551	1318278236	/nfs/dbraw/zinc/27/82/36/1318278236.db2.gz	KXFPUJOIAAQYRQ-ZFWWWQNUSA-N	0	3	331.485	3.137	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@@H](CCCN3C(=O)C3CCC3)C2)cc1	ZINC001021494051	1318295843	/nfs/dbraw/zinc/29/58/43/1318295843.db2.gz	YGMZTJQMVDJYKU-VQTJNVASSA-N	0	3	337.467	3.171	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)cc1F	ZINC000960154586	1318388057	/nfs/dbraw/zinc/38/80/57/1318388057.db2.gz	UJDKQDPRZGLZST-YJBOKZPZSA-N	0	3	345.462	3.460	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC[C@@H]2CN(Cc3cccc(C#N)c3)CC[C@H]21	ZINC001021552502	1318394815	/nfs/dbraw/zinc/39/48/15/1318394815.db2.gz	BLOXXIKHKYNIQP-VHMBZRNASA-N	0	3	337.467	3.337	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@@H](CCCN3C(=O)C=C3CCC3)C2)cc1	ZINC001021558664	1318407005	/nfs/dbraw/zinc/40/70/05/1318407005.db2.gz	KZBFWRQOOHVALI-LEWJYISDSA-N	0	3	349.478	3.481	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc(C(F)F)nc1	ZINC000960271583	1318437286	/nfs/dbraw/zinc/43/72/86/1318437286.db2.gz	QADDZSGDISBAMH-IAGOWNOFSA-N	0	3	343.377	3.191	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc(F)c(F)c1	ZINC000960270704	1318437462	/nfs/dbraw/zinc/43/74/62/1318437462.db2.gz	IOBGCFOYTADGLV-QZTJIDSGSA-N	0	3	328.362	3.136	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc2occc2[nH]1	ZINC000960273048	1318438416	/nfs/dbraw/zinc/43/84/16/1318438416.db2.gz	LTNRIZPTWJJDKA-VQIMIIECSA-N	0	3	335.407	3.322	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc3nccc(C)c3c2)C1	ZINC001021595519	1318441564	/nfs/dbraw/zinc/44/15/64/1318441564.db2.gz	ZICFRCISXSRAAS-RXVVDRJESA-N	0	3	347.462	3.103	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc2c[nH]ccc-2n1	ZINC000960279683	1318442010	/nfs/dbraw/zinc/44/20/10/1318442010.db2.gz	WXORDDYNXRAEJU-UYAOXDASSA-N	0	3	346.434	3.124	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2csc(C)c2C)C1	ZINC001021598452	1318442383	/nfs/dbraw/zinc/44/23/83/1318442383.db2.gz	VCTKJPXHZMJEQT-AEFFLSMTSA-N	0	3	330.497	3.315	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc3c(o2)CCCC3)C1	ZINC001021603482	1318447129	/nfs/dbraw/zinc/44/71/29/1318447129.db2.gz	PTKUXCUNILVWET-MSOLQXFVSA-N	0	3	340.467	3.108	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cscc2Cl)C1	ZINC001021612123	1318459441	/nfs/dbraw/zinc/45/94/41/1318459441.db2.gz	XAEKQMTXVAVMNI-XJKSGUPXSA-N	0	3	336.888	3.351	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(C)c3ccccc3n2)C1	ZINC001021614033	1318461756	/nfs/dbraw/zinc/46/17/56/1318461756.db2.gz	NYQHGRFKHRSIIT-DYESRHJHSA-N	0	3	347.462	3.103	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc(Cl)cn1	ZINC000960326630	1318462371	/nfs/dbraw/zinc/46/23/71/1318462371.db2.gz	YORHOVTXUAOOEM-QZTJIDSGSA-N	0	3	341.842	3.297	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc(OCC)cc1	ZINC000960331703	1318465563	/nfs/dbraw/zinc/46/55/63/1318465563.db2.gz	YCVZLCCVPDSPCY-WOJBJXKFSA-N	0	3	336.435	3.257	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2csc3ccccc23)C1	ZINC001021642718	1318499495	/nfs/dbraw/zinc/49/94/95/1318499495.db2.gz	RWWMXVRDQUEOFG-QAPCUYQASA-N	0	3	338.476	3.461	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc3cc(C)ccc3[nH]2)C1	ZINC001021646883	1318503679	/nfs/dbraw/zinc/50/36/79/1318503679.db2.gz	SXWYOMHDTVCTNB-JXFKEZNVSA-N	0	3	335.451	3.036	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)c1ccsc1	ZINC000960411314	1318535114	/nfs/dbraw/zinc/53/51/14/1318535114.db2.gz	VMFGOOCBDQRVST-GOSISDBHSA-N	0	3	339.464	3.356	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(Cl)c(F)c2)C1	ZINC001021677845	1318548217	/nfs/dbraw/zinc/54/82/17/1318548217.db2.gz	SSZLLHJKKXRNBA-PBHICJAKSA-N	0	3	334.822	3.039	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)C2CCC(F)(F)CC2)C1	ZINC001021679077	1318548817	/nfs/dbraw/zinc/54/88/17/1318548817.db2.gz	LXUNQGVSAYCVMR-SJORKVTESA-N	0	3	338.442	3.148	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cccc(Cl)c2)C1	ZINC001021716101	1318596020	/nfs/dbraw/zinc/59/60/20/1318596020.db2.gz	BWZFPWSYMLTCBW-WMZOPIPTSA-N	0	3	330.859	3.290	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cccc(C(F)F)c2)C1	ZINC001021716674	1318597994	/nfs/dbraw/zinc/59/79/94/1318597994.db2.gz	FOYNNIUWYZRAAF-IAGOWNOFSA-N	0	3	332.394	3.184	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2sccc2C(F)F)C1	ZINC001021723210	1318610396	/nfs/dbraw/zinc/61/03/96/1318610396.db2.gz	SBKLTDUKTNLZRN-JSGCOSHPSA-N	0	3	338.423	3.245	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(C)n(C(C)C)c2C)C1	ZINC001021731576	1318634291	/nfs/dbraw/zinc/63/42/91/1318634291.db2.gz	WMTDUBRMDXMAGM-QUCCMNQESA-N	0	3	341.499	3.246	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)CC1CCC1	ZINC000960523305	1318635790	/nfs/dbraw/zinc/63/57/90/1318635790.db2.gz	BOJXMUZFMHOTPG-IBGZPJMESA-N	0	3	325.456	3.171	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2sc(C(C)C)nc2C)C1	ZINC001021733436	1318639395	/nfs/dbraw/zinc/63/93/95/1318639395.db2.gz	MUHNFUXYCIYERH-HOTGVXAUSA-N	0	3	345.512	3.135	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc3cccc(C)c3o2)C1	ZINC001021740883	1318651018	/nfs/dbraw/zinc/65/10/18/1318651018.db2.gz	WZVFFPYPEFXGSN-ZWKOTPCHSA-N	0	3	336.435	3.301	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)C1CC(F)(F)C1	ZINC000960536197	1318657958	/nfs/dbraw/zinc/65/79/58/1318657958.db2.gz	QKVFBUXGWPMTCW-QGZVFWFLSA-N	0	3	347.409	3.026	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)CCc2ccc(C)s2)C1	ZINC001021751704	1318666403	/nfs/dbraw/zinc/66/64/03/1318666403.db2.gz	LCJBRZHFMMAZIV-MJGOQNOKSA-N	0	3	344.524	3.325	20	30		EGEDHN
Cc1ccsc1C(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001021779286	1318677972	/nfs/dbraw/zinc/67/79/72/1318677972.db2.gz	CRKXDBCYJKANKD-GASCZTMLSA-N	0	3	343.427	3.118	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)CC2=CCCCC2)C1	ZINC001021901104	1318725980	/nfs/dbraw/zinc/72/59/80/1318725980.db2.gz	IYZPVTFLNFTEJQ-OKILXGFUSA-N	0	3	327.266	3.022	20	30		EGEDHN
Cc1cc(Cl)ccc1CN(C)C[C@@H]1CCCN1C(=O)C#CC1CC1	ZINC000960627855	1318753503	/nfs/dbraw/zinc/75/35/03/1318753503.db2.gz	SILZOESHBLWXDE-IBGZPJMESA-N	0	3	344.886	3.485	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)c2ccc3occc3c2)C1	ZINC001022126785	1318806759	/nfs/dbraw/zinc/80/67/59/1318806759.db2.gz	NKCFHCMNQCNXSD-OKILXGFUSA-N	0	3	349.228	3.192	20	30		EGEDHN
CCC(C)(C)C(=O)N1CCC[C@@H]1CN(C)Cc1ccc(C#N)cc1	ZINC000960840373	1318974598	/nfs/dbraw/zinc/97/45/98/1318974598.db2.gz	NGCPOAFDPWYPNV-GOSISDBHSA-N	0	3	327.472	3.417	20	30		EGEDHN
C[C@@H]1CCCC[C@@H]1C(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001022620405	1319020444	/nfs/dbraw/zinc/02/04/44/1319020444.db2.gz	NHRIOOLMCJNISU-ZSGPHXLJSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@@H](NCc3ccncc3Cl)C2)CC1	ZINC001022648904	1319040594	/nfs/dbraw/zinc/04/05/94/1319040594.db2.gz	RUNSSQYHRKDOAJ-IYBDPMFKSA-N	0	3	333.863	3.218	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CCC[C@@H]1CN(C)Cc1cccc(C#N)c1	ZINC000960904503	1319045409	/nfs/dbraw/zinc/04/54/09/1319045409.db2.gz	HBQWUMSPJUDKKY-VQIMIIECSA-N	0	3	327.472	3.273	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)Cc2c[nH]c3cc(C)ccc23)C1	ZINC001022846724	1319135237	/nfs/dbraw/zinc/13/52/37/1319135237.db2.gz	POUYWIHHXUCXIB-GASCZTMLSA-N	0	3	331.847	3.008	20	30		EGEDHN
C[C@@H](NC[C@H](O)CC#N)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000930210255	1328812583	/nfs/dbraw/zinc/81/25/83/1328812583.db2.gz	FXZCUKOXUIQFBA-FZKQIMNGSA-N	0	3	341.386	3.003	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2c[nH]nc2C2CCCCC2)C1	ZINC001022957315	1319186952	/nfs/dbraw/zinc/18/69/52/1319186952.db2.gz	RVJOIRFIGHBOKX-OKILXGFUSA-N	0	3	336.867	3.060	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H](CNC(=O)C3CCCCC3)C2)cc1	ZINC001023205300	1319342367	/nfs/dbraw/zinc/34/23/67/1319342367.db2.gz	RHYJNAMBJYHJQX-LJQANCHMSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]([C@@H]2CCN(Cc3cnoc3C)C2)C1	ZINC000961229628	1319359263	/nfs/dbraw/zinc/35/92/63/1319359263.db2.gz	NCCJBTIUVPRSMI-IAGOWNOFSA-N	0	3	345.487	3.256	20	30		EGEDHN
CC1(C)CC(C(=O)NC[C@@H]2CCCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001023351485	1319465996	/nfs/dbraw/zinc/46/59/96/1319465996.db2.gz	WVDNGKCHPLBRDF-SFHVURJKSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](C2CCN(C(=O)c3cccnc3)CC2)C1	ZINC000961320296	1319477475	/nfs/dbraw/zinc/47/74/75/1319477475.db2.gz	LEVFTOHNXLFZFX-GOSISDBHSA-N	0	3	347.890	3.398	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cscc2C(F)F)C1	ZINC001023372307	1319484258	/nfs/dbraw/zinc/48/42/58/1319484258.db2.gz	QUFRMEPOXBDWFM-GFCCVEGCSA-N	0	3	326.412	3.151	20	30		EGEDHN
[NH3+]CC[C@H]([N-]C(=O)[C@H](F)c1ccc(C(F)(F)F)cc1)C(F)(F)F	ZINC000817995034	1319486967	/nfs/dbraw/zinc/48/69/67/1319486967.db2.gz	SPSCIYAHFTWHPX-VHSXEESVSA-N	0	3	346.246	3.112	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc3ccccc3nc2C)C1	ZINC001023402015	1319510727	/nfs/dbraw/zinc/51/07/27/1319510727.db2.gz	DBHODAZYUIGZNT-KRWDZBQOSA-N	0	3	335.451	3.008	20	30		EGEDHN
C#CCN1CCC[C@@H](CNC(=O)c2cc(Cl)sc2Cl)C1	ZINC001023416316	1319521669	/nfs/dbraw/zinc/52/16/69/1319521669.db2.gz	XBRMAZYOFFBRCK-JTQLQIEISA-N	0	3	331.268	3.130	20	30		EGEDHN
C#CCN(C)CCCNC(=O)[C@@H](C)Cc1ccc(Cl)cc1Cl	ZINC000818599509	1319567085	/nfs/dbraw/zinc/56/70/85/1319567085.db2.gz	UYXZILDFJJMHSA-ZDUSSCGKSA-N	0	3	341.282	3.243	20	30		EGEDHN
C#CCN(C)CCCNC(=O)CC(c1ccccc1)c1ccccc1	ZINC000818609098	1319569265	/nfs/dbraw/zinc/56/92/65/1319569265.db2.gz	KNJWCZJZTIZOGF-UHFFFAOYSA-N	0	3	334.463	3.280	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN[C@H](c2ccc(F)cc2)[C@@H]2CCCO2)cc1	ZINC000818968347	1319595103	/nfs/dbraw/zinc/59/51/03/1319595103.db2.gz	RLMJZHRILJZWAG-HSALFYBXSA-N	0	3	340.398	3.241	20	30		EGEDHN
Cc1cscc1C(=O)NC1CC(CNCc2ccccc2C#N)C1	ZINC000961679353	1319693008	/nfs/dbraw/zinc/69/30/08/1319693008.db2.gz	OTRQEWSFJUMLQQ-UHFFFAOYSA-N	0	3	339.464	3.226	20	30		EGEDHN
N#CC(C(=O)COc1ccc(F)cc1)C(=O)Nc1ccc(Cl)cc1	ZINC000916882746	1319720056	/nfs/dbraw/zinc/72/00/56/1319720056.db2.gz	JRYWZPGWAZILRY-HNNXBMFYSA-N	0	3	346.745	3.205	20	30		EGEDHN
COc1cc(Cl)c(C)cc1NC(=O)C(C#N)C(=O)c1cccnc1	ZINC000916901345	1319723907	/nfs/dbraw/zinc/72/39/07/1319723907.db2.gz	FSWYWOCGBHOSEN-GFCCVEGCSA-N	0	3	343.770	3.013	20	30		EGEDHN
C=CCNC(=O)C(C#N)C(=O)CSc1cc(Cl)ccc1Cl	ZINC000916917758	1319725210	/nfs/dbraw/zinc/72/52/10/1319725210.db2.gz	NCONOIVMEVYFHS-JTQLQIEISA-N	0	3	343.235	3.097	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)CCn1c2ccccc2c2ccccc21	ZINC000916951605	1319727100	/nfs/dbraw/zinc/72/71/00/1319727100.db2.gz	LMBPMYFGVLCKNW-KRWDZBQOSA-N	0	3	347.418	3.418	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](CC)c2cc(F)ccc2OC)CC1	ZINC000917137445	1319761287	/nfs/dbraw/zinc/76/12/87/1319761287.db2.gz	PJYWEMBKJNXYSN-QGZVFWFLSA-N	0	3	349.450	3.235	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc(C(F)F)cc2F)C1	ZINC001023670160	1319782286	/nfs/dbraw/zinc/78/22/86/1319782286.db2.gz	MGFYTGBPZGLLMR-CYBMUJFWSA-N	0	3	338.373	3.228	20	30		EGEDHN
CC[C@@H](Cc1ccccc1C)C(=O)C(C#N)C(=O)NC1CCCC1	ZINC000819947560	1319808266	/nfs/dbraw/zinc/80/82/66/1319808266.db2.gz	HHQHQGFYXAQMSX-MAUKXSAKSA-N	0	3	326.440	3.331	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc(O[C@H](C)CC)cc2)C1	ZINC001023691467	1319808795	/nfs/dbraw/zinc/80/87/95/1319808795.db2.gz	KPCQCGZLJNYCTG-QZTJIDSGSA-N	0	3	342.483	3.329	20	30		EGEDHN
Cc1oc(-c2ccccc2)nc1C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000917508905	1319824600	/nfs/dbraw/zinc/82/46/00/1319824600.db2.gz	HWXQRDRNVXSDHA-CQSZACIVSA-N	0	3	346.346	3.006	20	30		EGEDHN
CC1(C(=O)NC2CC(CNCc3ccccc3C#N)C2)CCCC1	ZINC000962143063	1319834758	/nfs/dbraw/zinc/83/47/58/1319834758.db2.gz	OONUPOUFHJIUPF-UHFFFAOYSA-N	0	3	325.456	3.123	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC001023718605	1319855821	/nfs/dbraw/zinc/85/58/21/1319855821.db2.gz	ZDGXCXRXBMDZOH-CQSZACIVSA-N	0	3	338.373	3.171	20	30		EGEDHN
CC(C)(C)CCN1CCN(C(=O)/C=C\c2ccccc2C#N)CC1	ZINC000917880784	1319885556	/nfs/dbraw/zinc/88/55/56/1319885556.db2.gz	NXCFLMTYCWBQDO-HJWRWDBZSA-N	0	3	325.456	3.152	20	30		EGEDHN
N#Cc1ccccc1CNCC1CC(NC(=O)c2c[nH]cc2C2CC2)C1	ZINC000962481658	1319976979	/nfs/dbraw/zinc/97/69/79/1319976979.db2.gz	GJCOAYAIVKQGAT-UHFFFAOYSA-N	0	3	348.450	3.062	20	30		EGEDHN
C#CC[C@@H](CO)NCc1cn(-c2ccccc2)nc1-c1ccccc1	ZINC000821207652	1320003277	/nfs/dbraw/zinc/00/32/77/1320003277.db2.gz	WSLJNBROITUKBM-IBGZPJMESA-N	0	3	331.419	3.013	20	30		EGEDHN
C#C[C@H](NC(=O)NC[C@H](N[C@@H](C)CC)c1ccco1)c1ccccc1	ZINC000827067706	1320424398	/nfs/dbraw/zinc/42/43/98/1320424398.db2.gz	QTJFIACWYJQYOX-SZMVWBNQSA-N	0	3	339.439	3.383	20	30		EGEDHN
C#CC1CCN(C(=O)NC[C@@H](c2ccc(SC)cc2)N(C)C)CC1	ZINC000827114951	1320428287	/nfs/dbraw/zinc/42/82/87/1320428287.db2.gz	SBEFPQBKMVGJTK-SFHVURJKSA-N	0	3	345.512	3.066	20	30		EGEDHN
C=CCc1cc(OCC)cc(CN2CCCc3c(cnn3C)C2)c1O	ZINC000840172559	1321043049	/nfs/dbraw/zinc/04/30/49/1321043049.db2.gz	BGNHPZLSRRXPMM-UHFFFAOYSA-N	0	3	341.455	3.201	20	30		EGEDHN
CCCCCCCCCNC(=O)C(=O)Nc1ccc2c(c1)CNC2	ZINC000841002941	1321197292	/nfs/dbraw/zinc/19/72/92/1321197292.db2.gz	JRPPEJQQUNTLBT-UHFFFAOYSA-N	0	3	331.460	3.095	20	30		EGEDHN
C[C@H]1[C@@H](C)N(CC(=O)C(C#N)c2nc3ccccc3s2)C[C@H]1C	ZINC000842166256	1321356516	/nfs/dbraw/zinc/35/65/16/1321356516.db2.gz	JVWBDPYOHFJDFU-SYQHCUMBSA-N	0	3	327.453	3.449	20	30		EGEDHN
C=CCC[C@@H]1NC(=O)N(C[C@@H]2CCCN(C)[C@@H]2c2cccs2)C1=O	ZINC000842243675	1321364296	/nfs/dbraw/zinc/36/42/96/1321364296.db2.gz	IJOUTYLILMCIJW-DZKIICNBSA-N	0	3	347.484	3.018	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C(C)C)[C@H]2CCN(Cc3ccccc3)C2)cn1	ZINC000843696205	1321536696	/nfs/dbraw/zinc/53/66/96/1321536696.db2.gz	RNYCPNJCNUWNEK-NRFANRHFSA-N	0	3	347.462	3.188	20	30		EGEDHN
CN1CCN(CCCOc2ccc(C#N)cc2)[C@H](Cc2ccccc2)C1	ZINC000844424360	1321605260	/nfs/dbraw/zinc/60/52/60/1321605260.db2.gz	FFLJTBTZBFFUNL-OAQYLSRUSA-N	0	3	349.478	3.186	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)C(=O)N1C[C@H](N(C)C)Cc2ccccc21	ZINC000846865046	1321818285	/nfs/dbraw/zinc/81/82/85/1321818285.db2.gz	HOQZLTLPEWXQGM-OXJNMPFZSA-N	0	3	347.462	3.256	20	30		EGEDHN
C#CCOc1ccc([C@H](C)N[C@@H]2CCc3ccccc3NC2=O)cc1	ZINC000848557307	1321975862	/nfs/dbraw/zinc/97/58/62/1321975862.db2.gz	DTUOCNRQWRKXEY-MGPUTAFESA-N	0	3	334.419	3.303	20	30		EGEDHN
CN(CCC#N)c1ccc(CN[C@H]2CCc3ccccc3NC2=O)cc1	ZINC000848560332	1321976222	/nfs/dbraw/zinc/97/62/22/1321976222.db2.gz	CPNHGPJJAMYSHG-FQEVSTJZSA-N	0	3	348.450	3.080	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccccc2OCC#N)C1	ZINC000919821292	1322109213	/nfs/dbraw/zinc/10/92/13/1322109213.db2.gz	AFLABAQHJACVKV-FUHWJXTLSA-N	0	3	349.434	3.154	20	30		EGEDHN
COC[C@@H](C)Oc1ccc(CNCc2ccc(OCC#N)cc2)cc1	ZINC000850121259	1322195062	/nfs/dbraw/zinc/19/50/62/1322195062.db2.gz	PRECPLKMBCPFRU-MRXNPFEDSA-N	0	3	340.423	3.292	20	30		EGEDHN
C#CCNC(=O)NC[C@@H](c1ccc(C(F)(F)F)cc1)N(CC)CC	ZINC000920919404	1322236656	/nfs/dbraw/zinc/23/66/56/1322236656.db2.gz	NIFUFUGYLVOLMU-HNNXBMFYSA-N	0	3	341.377	3.021	20	30		EGEDHN
N#CC(C(=O)[C@@H]1CC(=O)N[C@@H]2CCCC[C@H]21)c1ccc2ccccc2n1	ZINC000850740910	1322281099	/nfs/dbraw/zinc/28/10/99/1322281099.db2.gz	ATKHFZRWHGHGOP-UIBIWLFHSA-N	0	3	347.418	3.106	20	30		EGEDHN
CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)N1CCC[C@H](C#N)C1	ZINC000922021177	1322441328	/nfs/dbraw/zinc/44/13/28/1322441328.db2.gz	MSGAGIPSUAFJLM-MOPGFXCFSA-N	0	3	342.487	3.088	20	30		EGEDHN
CC[C@@H](NCc1cc(C#N)ccc1Br)[C@H](O)C(C)C	ZINC000922186115	1322474503	/nfs/dbraw/zinc/47/45/03/1322474503.db2.gz	SXQXKARTTVEWSJ-HUUCEWRRSA-N	0	3	325.250	3.206	20	30		EGEDHN
CC#CCCN1CC[C@@H](C(F)(F)F)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000859605360	1329032981	/nfs/dbraw/zinc/03/29/81/1329032981.db2.gz	CFCYJRQWJAJLMZ-ZIAGYGMSSA-N	0	3	348.409	3.425	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CCC[C@H](CNCc2ccccc2C#N)C1	ZINC001023929679	1323035421	/nfs/dbraw/zinc/03/54/21/1323035421.db2.gz	DPBXMGJQXBCMJF-OAHLLOKOSA-N	0	3	329.419	3.150	20	30		EGEDHN
CC1(C)CC(C(=O)N2CCC[C@@H](CNCc3ccccc3C#N)C2)C1	ZINC001023970128	1323056019	/nfs/dbraw/zinc/05/60/19/1323056019.db2.gz	UINSBAUPTJTGHM-INIZCTEOSA-N	0	3	339.483	3.323	20	30		EGEDHN
CC1(CC(=O)N2CCC[C@@H](CNCc3ccccc3C#N)C2)CC1	ZINC001024067349	1323107779	/nfs/dbraw/zinc/10/77/79/1323107779.db2.gz	HDJCSFDZEGRQCG-INIZCTEOSA-N	0	3	325.456	3.077	20	30		EGEDHN
CC1(C)CC[C@H]1C(=O)N1CCC[C@H](CNCc2ccccc2C#N)C1	ZINC001024111225	1323144596	/nfs/dbraw/zinc/14/45/96/1323144596.db2.gz	IVMKWWKKFZHWQW-APWZRJJASA-N	0	3	339.483	3.323	20	30		EGEDHN
CCC(C)(C)C(=O)N1CCC[C@@H](CNCc2ccccc2C#N)C1	ZINC001024129152	1323154178	/nfs/dbraw/zinc/15/41/78/1323154178.db2.gz	LQLPKQMUGWTIOK-INIZCTEOSA-N	0	3	327.472	3.323	20	30		EGEDHN
CN(C(=O)C(C)(C)F)C1CCC(NCc2ccccc2C#N)CC1	ZINC000962967412	1323176400	/nfs/dbraw/zinc/17/64/00/1323176400.db2.gz	INJKBHPJUXXGLZ-UHFFFAOYSA-N	0	3	331.435	3.166	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1cc(C)c2ccccc2n1	ZINC001024511457	1323459754	/nfs/dbraw/zinc/45/97/54/1323459754.db2.gz	FXIQZPRPDWCWSI-QGZVFWFLSA-N	0	3	335.451	3.151	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccc(-n2cccc2)cc1	ZINC001024534725	1323476462	/nfs/dbraw/zinc/47/64/62/1323476462.db2.gz	KDHCIDDDFRGQQQ-FQEVSTJZSA-N	0	3	335.451	3.085	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@@H]1COc2ccc(Cl)cc21	ZINC001024555813	1323495571	/nfs/dbraw/zinc/49/55/71/1323495571.db2.gz	ZPJNOGRJXUZFQX-DOTOQJQBSA-N	0	3	348.874	3.363	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccc(C)c2cccnc12	ZINC001024560339	1323500226	/nfs/dbraw/zinc/50/02/26/1323500226.db2.gz	DOWDSRDETGRAQE-QGZVFWFLSA-N	0	3	335.451	3.151	20	30		EGEDHN
C=CCCN1CCCC[C@H]1CNC(=O)c1cnc(CC2CC2)s1	ZINC001024568720	1323506795	/nfs/dbraw/zinc/50/67/95/1323506795.db2.gz	VEFYYEVJDDTCEZ-HNNXBMFYSA-N	0	3	333.501	3.256	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccc(C(F)F)c(F)c1	ZINC001024648147	1323574109	/nfs/dbraw/zinc/57/41/09/1323574109.db2.gz	YQSKYJNSGZMDON-AWEZNQCLSA-N	0	3	338.373	3.371	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1cc(C(C)(C)C)oc1C	ZINC001024684442	1323600578	/nfs/dbraw/zinc/60/05/78/1323600578.db2.gz	WSXYRXZMDNLTNI-MRXNPFEDSA-N	0	3	330.472	3.493	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1c(C)nn(CCC)c1C	ZINC001024746603	1323646201	/nfs/dbraw/zinc/64/62/01/1323646201.db2.gz	GUCFOUFQYHRFKA-KRWDZBQOSA-N	0	3	332.492	3.070	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccnc(OC(C)C)c1	ZINC001024753983	1323655622	/nfs/dbraw/zinc/65/56/22/1323655622.db2.gz	KVOGNNOREYDIEA-KRWDZBQOSA-N	0	3	331.460	3.029	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)C12CC(C(F)(F)F)(C1)C2	ZINC001024813922	1323715371	/nfs/dbraw/zinc/71/53/71/1323715371.db2.gz	JNEMMZUOWZMXMD-IUDNXUCKSA-N	0	3	330.394	3.266	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@@H]1C[C@H]1c1ccc(F)cc1	ZINC001024817428	1323721487	/nfs/dbraw/zinc/72/14/87/1323721487.db2.gz	ZPCNWJYQKPBJOB-GBESFXJTSA-N	0	3	330.447	3.476	20	30		EGEDHN
Cc1cc[nH]c1C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)s1	ZINC001024946629	1323794924	/nfs/dbraw/zinc/79/49/24/1323794924.db2.gz	VSBQFFUEEYTMLO-CQSZACIVSA-N	0	3	342.468	3.041	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCCC[C@@H]2CNCc2cncc(C)c2)cc1	ZINC001025037456	1323840258	/nfs/dbraw/zinc/84/02/58/1323840258.db2.gz	FIXBQZKMRKEZTI-OAQYLSRUSA-N	0	3	347.462	3.156	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCCC[C@@H]1CN[C@@H](C)c1n[nH]c(CC)n1	ZINC001025039689	1323841250	/nfs/dbraw/zinc/84/12/50/1323841250.db2.gz	UYRNZTRDQKYHIX-LSDHHAIUSA-N	0	3	347.507	3.001	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@@H]1CNCc1cccc(OCC)n1	ZINC001025040697	1323843444	/nfs/dbraw/zinc/84/34/44/1323843444.db2.gz	JLVPKVXMQBZMOQ-QGZVFWFLSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCCC[C@@H]2CNCc2scnc2C)C1	ZINC001025074990	1323876741	/nfs/dbraw/zinc/87/67/41/1323876741.db2.gz	VLPJXDQXXZOODK-OAHLLOKOSA-N	0	3	333.501	3.279	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cccc(F)c1	ZINC001025195984	1323977225	/nfs/dbraw/zinc/97/72/25/1323977225.db2.gz	PHTAODFGSDIYML-OALUTQOASA-N	0	3	328.431	3.308	20	30		EGEDHN
C=C(C)C[N@@H+]1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccccc1[O-]	ZINC001025200624	1323984832	/nfs/dbraw/zinc/98/48/32/1323984832.db2.gz	FOYKYIPEVURVCK-MSOLQXFVSA-N	0	3	328.456	3.427	20	30		EGEDHN
C=C(C)C[N@H+]1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccccc1[O-]	ZINC001025200624	1323984838	/nfs/dbraw/zinc/98/48/38/1323984838.db2.gz	FOYKYIPEVURVCK-MSOLQXFVSA-N	0	3	328.456	3.427	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cnc(C)s1	ZINC001025209446	1323998048	/nfs/dbraw/zinc/99/80/48/1323998048.db2.gz	LTRWYNJVEHSLLH-CVEARBPZSA-N	0	3	333.501	3.487	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(OC)ns1	ZINC001025234109	1324021718	/nfs/dbraw/zinc/02/17/18/1324021718.db2.gz	FOFFPQLLGYEEQB-HUUCEWRRSA-N	0	3	349.500	3.187	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1nc(C)sc1C	ZINC001025239343	1324031685	/nfs/dbraw/zinc/03/16/85/1324031685.db2.gz	DDPAFBLGYDCXBV-JKSUJKDBSA-N	0	3	333.501	3.405	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cnc(C2CC2)o1	ZINC001025240092	1324032838	/nfs/dbraw/zinc/03/28/38/1324032838.db2.gz	LBYKLIMPVDTUEL-CVEARBPZSA-N	0	3	329.444	3.197	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc(F)c(F)c1	ZINC001025241040	1324036815	/nfs/dbraw/zinc/03/68/15/1324036815.db2.gz	SVYMYFUCIOYDEC-RBUKOAKNSA-N	0	3	346.421	3.447	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1c[nH]nc1C(C)C	ZINC001025245484	1324043582	/nfs/dbraw/zinc/04/35/82/1324043582.db2.gz	NDICJTJRMURLKM-ROUUACIJSA-N	0	3	342.487	3.016	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(F)ccc1CC	ZINC001025247847	1324049269	/nfs/dbraw/zinc/04/92/69/1324049269.db2.gz	RHLUSZAEWIRDHZ-PMACEKPBSA-N	0	3	342.458	3.480	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1nc2c(s1)CCC2	ZINC001025251613	1324056365	/nfs/dbraw/zinc/05/63/65/1324056365.db2.gz	JYQCTYXVZJFIFK-JKSUJKDBSA-N	0	3	345.512	3.277	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1occ2c1CCC2	ZINC001025255945	1324063360	/nfs/dbraw/zinc/06/33/60/1324063360.db2.gz	UBUYRYQULFTJRN-RBUKOAKNSA-N	0	3	340.467	3.251	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cccc(F)c1F	ZINC001025258815	1324067563	/nfs/dbraw/zinc/06/75/63/1324067563.db2.gz	JFNSGWJUOAFZRM-MSOLQXFVSA-N	0	3	346.421	3.447	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc[nH]c1C(C)C	ZINC001025262910	1324073791	/nfs/dbraw/zinc/07/37/91/1324073791.db2.gz	GYISMTRHOJMBBQ-QZTJIDSGSA-N	0	3	327.472	3.230	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc(Cl)[nH]1	ZINC001025268690	1324081248	/nfs/dbraw/zinc/08/12/48/1324081248.db2.gz	FBMYZMLAXLNYHV-CVEARBPZSA-N	0	3	333.863	3.151	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cnoc1C(C)C	ZINC001025288179	1324110677	/nfs/dbraw/zinc/11/06/77/1324110677.db2.gz	STEHFIXZYSQFGE-SJORKVTESA-N	0	3	331.460	3.443	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(Cl)no1	ZINC001025289579	1324113404	/nfs/dbraw/zinc/11/34/04/1324113404.db2.gz	QVLWLYIYBWXWPY-KGLIPLIRSA-N	0	3	337.851	3.363	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccccc1OC	ZINC001025291570	1324115850	/nfs/dbraw/zinc/11/58/50/1324115850.db2.gz	AXJHIYAFAFPOTF-RBUKOAKNSA-N	0	3	340.467	3.178	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc(C)cc1OC	ZINC001025292438	1324116905	/nfs/dbraw/zinc/11/69/05/1324116905.db2.gz	INZIFBJGHORHOF-RTBURBONSA-N	0	3	340.467	3.096	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cccc(OC)c1	ZINC001025292955	1324119833	/nfs/dbraw/zinc/11/98/33/1324119833.db2.gz	NOLMJADFDNQMJI-UXHICEINSA-N	0	3	340.467	3.178	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc(C2CC2)cn1	ZINC001025296312	1324126982	/nfs/dbraw/zinc/12/69/82/1324126982.db2.gz	JJTUNUWHAZIGLH-PMACEKPBSA-N	0	3	337.467	3.051	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cncc2ccccc21	ZINC001025301871	1324134795	/nfs/dbraw/zinc/13/47/95/1324134795.db2.gz	QHZLZCQNZWZOQP-LEWJYISDSA-N	0	3	347.462	3.327	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc(C)nc1C	ZINC001025302783	1324135990	/nfs/dbraw/zinc/13/59/90/1324135990.db2.gz	XTVJVKGJQXMHPL-UXHICEINSA-N	0	3	339.483	3.181	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(C(F)F)ccc2F)C1	ZINC001025423421	1324256762	/nfs/dbraw/zinc/25/67/62/1324256762.db2.gz	RSRLALQQNPMVJS-OCCSQVGLSA-N	0	3	338.373	3.227	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc3ccccc3nc2C)C1	ZINC001025434623	1324273569	/nfs/dbraw/zinc/27/35/69/1324273569.db2.gz	XGEAMQMWWHLALL-VQIMIIECSA-N	0	3	349.478	3.397	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(C(C)C)nc2)C1	ZINC001025443765	1324285159	/nfs/dbraw/zinc/28/51/59/1324285159.db2.gz	UHXDXEGKMQHHMG-FUHWJXTLSA-N	0	3	327.472	3.059	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cnc3ccccc3c2C)C1	ZINC001025489386	1324340847	/nfs/dbraw/zinc/34/08/47/1324340847.db2.gz	OZDRHLBZXKJONR-DLBZAZTESA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cccc(Cl)c2F)C1	ZINC001025519047	1324362790	/nfs/dbraw/zinc/36/27/90/1324362790.db2.gz	JLBMBCJSZHOXRX-KBPBESRZSA-N	0	3	336.838	3.333	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](C)[C@@H]2CCCN(Cc3ocnc3C)C2)CC1	ZINC001025523027	1324368006	/nfs/dbraw/zinc/36/80/06/1324368006.db2.gz	LFJIYEFRRZBSGA-MAUKXSAKSA-N	0	3	345.487	3.446	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(C(F)F)c(F)c2)C1	ZINC001025527894	1324372929	/nfs/dbraw/zinc/37/29/29/1324372929.db2.gz	NIIPDCJSHBYMBT-OCCSQVGLSA-N	0	3	338.373	3.227	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc3sccc3c2)C1	ZINC001025582182	1324423356	/nfs/dbraw/zinc/42/33/56/1324423356.db2.gz	PHQQOPAKXBJEFJ-YOEHRIQHSA-N	0	3	326.465	3.365	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cccc(-c3ccoc3)c2)C1	ZINC001025590894	1324436652	/nfs/dbraw/zinc/43/66/52/1324436652.db2.gz	UKZUMOKFCYFDEW-VQIMIIECSA-N	0	3	336.435	3.410	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2c(C)cc(C)cc2C)C1	ZINC001025611572	1324462940	/nfs/dbraw/zinc/46/29/40/1324462940.db2.gz	MLLIXDGEWYUHGS-RTBURBONSA-N	0	3	326.484	3.465	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc3c(s2)CCCCC3)C1	ZINC001025613748	1324465047	/nfs/dbraw/zinc/46/50/47/1324465047.db2.gz	ZWUORDQKGNIUJO-DOTOQJQBSA-N	0	3	344.524	3.481	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(F)cc2Cl)C1	ZINC001025613721	1324465898	/nfs/dbraw/zinc/46/58/98/1324465898.db2.gz	ZPWRFHQCIWZOCX-KGLIPLIRSA-N	0	3	336.838	3.333	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(C)c(CC)s2)C1	ZINC001025613977	1324466350	/nfs/dbraw/zinc/46/63/50/1324466350.db2.gz	DQVJSJSBBLQWPX-HOTGVXAUSA-N	0	3	332.513	3.473	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(C)c(CC)s2)C1	ZINC001025613978	1324466855	/nfs/dbraw/zinc/46/68/55/1324466855.db2.gz	DQVJSJSBBLQWPX-HZPDHXFCSA-N	0	3	332.513	3.473	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc3c(s2)CCCC3)C1	ZINC001025614671	1324468095	/nfs/dbraw/zinc/46/80/95/1324468095.db2.gz	NSIGEURVUGFHRF-RDJZCZTQSA-N	0	3	344.524	3.481	20	30		EGEDHN
CC1(C(=O)N2C[C@@H]3CC[C@H](NCc4ccccc4C#N)[C@H]3C2)CC=CC1	ZINC001026348262	1324744206	/nfs/dbraw/zinc/74/42/06/1324744206.db2.gz	DSQSIACDOBDKOK-UFYCRDLUSA-N	0	3	349.478	3.241	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC1CCC(NC(=O)CC2CC2)CC1	ZINC001026441312	1324803642	/nfs/dbraw/zinc/80/36/42/1324803642.db2.gz	LRQFJHDGMAOIOB-UHFFFAOYSA-N	0	3	329.419	3.014	20	30		EGEDHN
C=C1CCC(C(=O)NC2CCC(NCc3snnc3C)CC2)CC1	ZINC001026554202	1324890634	/nfs/dbraw/zinc/89/06/34/1324890634.db2.gz	OTTWQDBWBIVKHI-UHFFFAOYSA-N	0	3	348.516	3.110	20	30		EGEDHN
C=C1CC(C)(C(=O)NC2CCC(NCc3nc(C)cs3)CC2)C1	ZINC001026555160	1324892033	/nfs/dbraw/zinc/89/20/33/1324892033.db2.gz	MYWNFPDPGXIWBD-UHFFFAOYSA-N	0	3	333.501	3.325	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)C2(C)CC(=C)C2)CC1	ZINC001026555344	1324892314	/nfs/dbraw/zinc/89/23/14/1324892314.db2.gz	VXONKMCFKZZRPX-UHFFFAOYSA-N	0	3	341.293	3.268	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)c2ccn(C)c2)C1	ZINC000963285372	1325068437	/nfs/dbraw/zinc/06/84/37/1325068437.db2.gz	GGNARZDURCVKGT-WBVHZDCISA-N	0	3	335.879	3.094	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)c2ccncc2C)C1	ZINC000963291091	1325078487	/nfs/dbraw/zinc/07/84/87/1325078487.db2.gz	SCOQYGYLPXGKIV-AEFFLSMTSA-N	0	3	347.890	3.459	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)c2conc2C)C1	ZINC000963356808	1325152136	/nfs/dbraw/zinc/15/21/36/1325152136.db2.gz	GWRSCOCBURIBLI-HOCLYGCPSA-N	0	3	337.851	3.052	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)C2(CF)CC2)C1	ZINC000963365832	1325168131	/nfs/dbraw/zinc/16/81/31/1325168131.db2.gz	QYUWGVPXIQSLSC-GJZGRUSLSA-N	0	3	328.859	3.192	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](CNCc2cc(C3CC3)no2)C1	ZINC001027041104	1325175656	/nfs/dbraw/zinc/17/56/56/1325175656.db2.gz	PGBAYVCQEZXOOM-IFXJQAMLSA-N	0	3	331.460	3.092	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](CNCc3csc(CCC)n3)C2)C1	ZINC001027051054	1325190529	/nfs/dbraw/zinc/19/05/29/1325190529.db2.gz	PRDATZUUUMGWGW-HNNXBMFYSA-N	0	3	347.528	3.390	20	30		EGEDHN
N#Cc1ccccc1CNC1CC2(C1)CC(NC(=O)[C@H]1CC=CCC1)C2	ZINC000963544691	1325307601	/nfs/dbraw/zinc/30/76/01/1325307601.db2.gz	MYJSILFOESXEES-JWIWNDOOSA-N	0	3	349.478	3.432	20	30		EGEDHN
C[C@]1(NC(=O)c2cc(C#N)ccc2F)CCN(Cc2ccccc2)C1	ZINC000855031328	1325336562	/nfs/dbraw/zinc/33/65/62/1325336562.db2.gz	IVNWTSZYYSXFKD-FQEVSTJZSA-N	0	3	337.398	3.092	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)C[C@@H]2C=CCC2)C1	ZINC001027290357	1325424622	/nfs/dbraw/zinc/42/46/22/1325424622.db2.gz	UFBODKLTNDGUPB-YLJYHZDGSA-N	0	3	337.467	3.337	20	30		EGEDHN
C[N@H+](Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)c2ccccc2[O-])C1	ZINC001027307851	1325454497	/nfs/dbraw/zinc/45/44/97/1325454497.db2.gz	YUNQOOVZYAOTJW-SFHVURJKSA-N	0	3	349.434	3.000	20	30		EGEDHN
C[N@@H+](Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)c2ccccc2[O-])C1	ZINC001027307851	1325454498	/nfs/dbraw/zinc/45/44/98/1325454498.db2.gz	YUNQOOVZYAOTJW-SFHVURJKSA-N	0	3	349.434	3.000	20	30		EGEDHN
C[N@H+](Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)c2ccccc2[O-])C1	ZINC001027308787	1325456507	/nfs/dbraw/zinc/45/65/07/1325456507.db2.gz	RXGZYWBTRZHZSZ-SFHVURJKSA-N	0	3	349.434	3.000	20	30		EGEDHN
C[N@@H+](Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)c2ccccc2[O-])C1	ZINC001027308787	1325456514	/nfs/dbraw/zinc/45/65/14/1325456514.db2.gz	RXGZYWBTRZHZSZ-SFHVURJKSA-N	0	3	349.434	3.000	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1cccnc1C1CC1)C2	ZINC000964211233	1325488285	/nfs/dbraw/zinc/48/82/85/1325488285.db2.gz	DOHLBZPXZZCYCU-UHFFFAOYSA-N	0	3	345.874	3.342	20	30		EGEDHN
CC(C)Oc1cccc(CN(C)[C@H]2CCCN(C(=O)[C@@H](C)C#N)C2)c1	ZINC001027337182	1325497139	/nfs/dbraw/zinc/49/71/39/1325497139.db2.gz	ZMCXHVCSNZURSU-WMZOPIPTSA-N	0	3	343.471	3.056	20	30		EGEDHN
CN(Cc1ccc(C#N)c(F)c1)[C@@H]1CCCN(C(=O)/C=C\C2CC2)C1	ZINC001027340130	1325500045	/nfs/dbraw/zinc/50/00/45/1325500045.db2.gz	APOXSIDMEQZAQF-YPLUBFQTSA-N	0	3	341.430	3.086	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H](N(C)Cc2cccc(C#N)c2)C1)C1CC1	ZINC001027350326	1325515609	/nfs/dbraw/zinc/51/56/09/1325515609.db2.gz	AOBFCVYBSQKVDX-KXBFYZLASA-N	0	3	325.456	3.027	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)[C@@H]2CC2(C)C)C1	ZINC001027375661	1325572999	/nfs/dbraw/zinc/57/29/99/1325572999.db2.gz	WYKQANWGFOOERR-ROUUACIJSA-N	0	3	325.456	3.027	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)[C@@H]2CC2(C)C)C1	ZINC001027375660	1325573832	/nfs/dbraw/zinc/57/38/32/1325573832.db2.gz	WYKQANWGFOOERR-MSOLQXFVSA-N	0	3	325.456	3.027	20	30		EGEDHN
CCO[C@@H](C(=O)C(C#N)C(=O)Nc1c(CC)cccc1CC)C1CC1	ZINC000860470125	1329321359	/nfs/dbraw/zinc/32/13/59/1329321359.db2.gz	NKEGYQNGUAOTBN-QFBILLFUSA-N	0	3	342.439	3.274	20	30		EGEDHN
C[C@@H](c1ccc(F)c(F)c1)N(C)[C@@H]1CCCN(C(=O)C#CC2CC2)C1	ZINC001027402735	1327624619	/nfs/dbraw/zinc/62/46/19/1327624619.db2.gz	RJONVTJCCDBRFM-WMLDXEAASA-N	0	3	346.421	3.362	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001027522065	1327793625	/nfs/dbraw/zinc/79/36/25/1327793625.db2.gz	QPZMTUQBUXVUKL-GOSISDBHSA-N	0	3	325.456	3.193	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](N(C)Cc2ccc(OC)c(F)c2)C1	ZINC001027521437	1327794072	/nfs/dbraw/zinc/79/40/72/1327794072.db2.gz	CSXVRUZZZVDZBO-INIZCTEOSA-N	0	3	348.462	3.469	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](N(C)Cc2ccc3c(c2)COC3)C1	ZINC001027522272	1327795375	/nfs/dbraw/zinc/79/53/75/1327795375.db2.gz	VNLPGILNELYNLS-LJQANCHMSA-N	0	3	342.483	3.352	20	30		EGEDHN
C=C1CC(C)(C(=O)NC2CC3(CC(NCc4conc4CC)C3)C2)C1	ZINC000964961686	1327796862	/nfs/dbraw/zinc/79/68/62/1327796862.db2.gz	VVIQFKJKFCAKPF-UHFFFAOYSA-N	0	3	343.471	3.110	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)c(F)c2)C1	ZINC001027522629	1327796844	/nfs/dbraw/zinc/79/68/44/1327796844.db2.gz	YIIGAVSCYLXZLU-KRWDZBQOSA-N	0	3	343.446	3.332	20	30		EGEDHN
Cc1cocc1C(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001027528756	1327808913	/nfs/dbraw/zinc/80/89/13/1327808913.db2.gz	BXFLTNDZJIOMRX-SFHVURJKSA-N	0	3	337.423	3.196	20	30		EGEDHN
CCC(C)(C)C(=O)N1CCC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001027550048	1327856968	/nfs/dbraw/zinc/85/69/68/1327856968.db2.gz	PXSWGZJMKXIVSV-GOSISDBHSA-N	0	3	327.472	3.417	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@H](N(C)CCc3ccns3)C2)CC1	ZINC001027559368	1327871393	/nfs/dbraw/zinc/87/13/93/1327871393.db2.gz	WHRBNVVAEHIZHA-KRWDZBQOSA-N	0	3	347.528	3.355	20	30		EGEDHN
C[C@H]1C[C@H]([NH2+]CCNc2ccc(C#N)cn2)c2c1c(F)ccc2[O-]	ZINC000927164828	1327902415	/nfs/dbraw/zinc/90/24/15/1327902415.db2.gz	PIETXEALHWWQFF-FZMZJTMJSA-N	0	3	326.375	3.048	20	30		EGEDHN
COc1ccc([C@@H](C)NCCNc2ccc(C#N)cn2)c(Cl)c1	ZINC000927168176	1327904161	/nfs/dbraw/zinc/90/41/61/1327904161.db2.gz	QBDQJGPGTRLPEX-GFCCVEGCSA-N	0	3	330.819	3.378	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)[C@H](C)Cc2ccccc2Cl)C1	ZINC001027598786	1327950032	/nfs/dbraw/zinc/95/00/32/1327950032.db2.gz	USGJSWFZVVOJGZ-NVXWUHKLSA-N	0	3	332.875	3.075	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1ccc3c(c1)COC3)C2	ZINC000965424705	1327992565	/nfs/dbraw/zinc/99/25/65/1327992565.db2.gz	OVANGLYKIWKGIK-UHFFFAOYSA-N	0	3	346.858	3.100	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)C(C)(C)c2ccc(CC)cc2)C1	ZINC001027643145	1328017715	/nfs/dbraw/zinc/01/77/15/1328017715.db2.gz	GPKFRDNDEZCMCP-LJQANCHMSA-N	0	3	326.484	3.083	20	30		EGEDHN
C[C@@H](CC(=O)N1CCC[C@@H](N(C)Cc2cccc(C#N)c2)C1)C1CC1	ZINC001027695605	1328102236	/nfs/dbraw/zinc/10/22/36/1328102236.db2.gz	HRAMXDQMIHHFME-OXJNMPFZSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)[C@H]1[C@H]3[C@@H]1[C@@H]1CC[C@H]3C1)C2	ZINC000965943500	1328121872	/nfs/dbraw/zinc/12/18/72/1328121872.db2.gz	QTXXKJYEFZMGAO-AXXKJCIESA-N	0	3	334.891	3.048	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2cccc3scnc32)C1	ZINC000966077639	1328170893	/nfs/dbraw/zinc/17/08/93/1328170893.db2.gz	QORHBGYSARDEPD-UKRRQHHQSA-N	0	3	329.469	3.313	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2cccc(NC(=O)CC)c2)C1	ZINC000966456386	1328302789	/nfs/dbraw/zinc/30/27/89/1328302789.db2.gz	ONQFQHHLDKCQRM-YJBOKZPZSA-N	0	3	343.471	3.051	20	30		EGEDHN
C#CCCN1CCC[C@H]1CNC(=O)c1oc2ccc(F)cc2c1C	ZINC001027933500	1328412630	/nfs/dbraw/zinc/41/26/30/1328412630.db2.gz	XNVUVINPZXQASC-HNNXBMFYSA-N	0	3	328.387	3.098	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN(C)C[C@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000862541258	1329494830	/nfs/dbraw/zinc/49/48/30/1329494830.db2.gz	RKPOBMDKKGOLNJ-GJZGRUSLSA-N	0	3	347.459	3.322	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ncc(C(F)(F)F)cc2Cl)CC1	ZINC000932141388	1329788280	/nfs/dbraw/zinc/78/82/80/1329788280.db2.gz	XRHNMJYGTGTITH-UHFFFAOYSA-N	0	3	347.768	3.134	20	30		EGEDHN
C[C@H](c1ccccc1)[C@H]1CCCN1CC(=O)N[C@@](C)(C#N)C1CC1	ZINC000932279658	1329803130	/nfs/dbraw/zinc/80/31/30/1329803130.db2.gz	RVYFVQYCFHZUIO-ZTNFWEORSA-N	0	3	325.456	3.063	20	30		EGEDHN
CC(C)(C)OC(=O)NCC[C@H]1CCN(CC#Cc2ccc(F)cc2)C1	ZINC000932697247	1329834554	/nfs/dbraw/zinc/83/45/54/1329834554.db2.gz	PBOSFLDYXJBSMI-KRWDZBQOSA-N	0	3	346.446	3.414	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cncc(-c3ccccc3)c2)[C@H](C)C1	ZINC000942105711	1331832132	/nfs/dbraw/zinc/83/21/32/1331832132.db2.gz	IVYUXCKBMXOCCS-OXQOHEQNSA-N	0	3	335.451	3.375	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccc3c2CCCCC3)[C@@H](C)C1	ZINC000942157361	1331851347	/nfs/dbraw/zinc/85/13/47/1331851347.db2.gz	QJXNYJSCGWETEK-LAUBAEHRSA-N	0	3	338.495	3.419	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)cc2)CC[C@H]1NC(=O)Cc1ccccc1	ZINC000942189657	1331869901	/nfs/dbraw/zinc/86/99/01/1331869901.db2.gz	UVUNWCOAKJKYQI-DYESRHJHSA-N	0	3	347.462	3.128	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3ccccc3s2)[C@H](C)C1	ZINC000942315195	1331901762	/nfs/dbraw/zinc/90/17/62/1331901762.db2.gz	SPTOENFJAXXKLW-GDBMZVCRSA-N	0	3	326.465	3.365	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(C3CCC3)cc2)[C@H](C)C1	ZINC000942535591	1331961482	/nfs/dbraw/zinc/96/14/82/1331961482.db2.gz	LHXVVSQOHZBVPS-UTKZUKDTSA-N	0	3	338.495	3.347	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3c(cc(C)cc3C)[nH]2)[C@H](C)C1	ZINC000942538624	1331963997	/nfs/dbraw/zinc/96/39/97/1331963997.db2.gz	TUHVGUCCUXVBPK-SJLPKXTDSA-N	0	3	337.467	3.248	20	30		EGEDHN
C[C@@H]1CN(Cc2cccc(C#N)c2)CC[C@@H]1NC(=O)C1(C)CCCC1	ZINC000942540208	1331964966	/nfs/dbraw/zinc/96/49/66/1331964966.db2.gz	HWGLMLXJVCVEQY-APWZRJJASA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2csc3ccccc23)[C@@H](C)C1	ZINC000942541204	1331965492	/nfs/dbraw/zinc/96/54/92/1331965492.db2.gz	WXCVYFCBDIXMSU-WMLDXEAASA-N	0	3	326.465	3.365	20	30		EGEDHN
Cc1cocc1C(=O)N[C@H]1CCN(Cc2cccc(C#N)c2)C[C@@H]1C	ZINC000942558450	1331972955	/nfs/dbraw/zinc/97/29/55/1331972955.db2.gz	WPBOCMSTMZILAI-LIRRHRJNSA-N	0	3	337.423	3.100	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3scnc3C)C[C@@H]2C)C1	ZINC000942602643	1332000361	/nfs/dbraw/zinc/00/03/61/1332000361.db2.gz	LUXRURDFFYCQJK-DZGCQCFKSA-N	0	3	333.501	3.134	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3ccc(C)nc3C)C[C@H]2C)C1	ZINC000942603433	1332001498	/nfs/dbraw/zinc/00/14/98/1332001498.db2.gz	XNOGVLUSORTOGE-BEFAXECRSA-N	0	3	341.499	3.381	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3sc(C)nc3C)C[C@@H]2C)C1	ZINC000942603341	1332001655	/nfs/dbraw/zinc/00/16/55/1332001655.db2.gz	VXNLSWBDCBVIBF-BBRMVZONSA-N	0	3	347.528	3.443	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccc(C(F)F)c(F)c2)[C@@H](C)C1	ZINC000942822407	1332042769	/nfs/dbraw/zinc/04/27/69/1332042769.db2.gz	KJSVYGUPOGYWRQ-XHDPSFHLSA-N	0	3	326.362	3.390	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc(C(C)(C)C)cc2)[C@@H](C)C1	ZINC000942959032	1332066598	/nfs/dbraw/zinc/06/65/98/1332066598.db2.gz	JELXYLJTCJSIFN-FXAWDEMLSA-N	0	3	340.511	3.377	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)oc2C(F)(F)F)[C@@H](C)C1	ZINC000943207285	1332120746	/nfs/dbraw/zinc/12/07/46/1332120746.db2.gz	FYUKXRHAEFNUMK-FZMZJTMJSA-N	0	3	342.361	3.070	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2c[nH]nc2C2CCCCC2)[C@H](C)C1	ZINC000944081211	1332323241	/nfs/dbraw/zinc/32/32/41/1332323241.db2.gz	RAHLGVHMBKSBAU-PBHICJAKSA-N	0	3	330.476	3.084	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C(C)(C)c2ccccc2Cl)[C@@H](C)C1	ZINC000944215823	1332347454	/nfs/dbraw/zinc/34/74/54/1332347454.db2.gz	VSSZSSFCOQLNQA-YOEHRIQHSA-N	0	3	332.875	3.077	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)c(F)cc2Cl)[C@H](C)C1	ZINC000944345301	1332379882	/nfs/dbraw/zinc/37/98/82/1332379882.db2.gz	FLLGDWLLDQMYCV-DYVFJYSZSA-N	0	3	336.838	3.251	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2sc(C(C)(C)C)nc2C)[C@H](C)C1	ZINC000945809947	1332678919	/nfs/dbraw/zinc/67/89/19/1332678919.db2.gz	WIQSLWHXRRCYCS-HIFRSBDPSA-N	0	3	347.528	3.213	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C(C)(F)F)cc2)[C@H](C)C1	ZINC000946310295	1332783983	/nfs/dbraw/zinc/78/39/83/1332783983.db2.gz	DURXIZRKHJXEHS-RHSMWYFYSA-N	0	3	334.410	3.262	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3cc[nH]c3C3CC3)CC[C@@H]2C1	ZINC000946743210	1332889863	/nfs/dbraw/zinc/88/98/63/1332889863.db2.gz	PMDHGWMEKJISML-IYBDPMFKSA-N	0	3	347.890	3.429	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)Cc3ccccc3C)CC[C@@H]2C1	ZINC000946884783	1332924645	/nfs/dbraw/zinc/92/46/45/1332924645.db2.gz	NNCZJPBGIFPHHR-KDURUIRLSA-N	0	3	346.902	3.460	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)c2cccs2)CCN1Cc1ccc(C#N)cc1	ZINC000947018626	1332976702	/nfs/dbraw/zinc/97/67/02/1332976702.db2.gz	ZZCMEFJUUWTDPG-WMLDXEAASA-N	0	3	339.464	3.403	20	30		EGEDHN
Cc1ccoc1C(=O)N[C@H]1CCN(Cc2cccc(C#N)c2)[C@H](C)C1	ZINC000947057325	1332994298	/nfs/dbraw/zinc/99/42/98/1332994298.db2.gz	QNMJBVYPAXNOIO-QAPCUYQASA-N	0	3	337.423	3.243	20	30		EGEDHN
Cc1cnccc1C(=O)N[C@@H]1CCN(Cc2ccc(C#N)cc2)[C@@H](C)C1	ZINC000947282265	1333076322	/nfs/dbraw/zinc/07/63/22/1333076322.db2.gz	NVXSGPGQHMBKFK-QFBILLFUSA-N	0	3	348.450	3.045	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2coc3c2cccc3OC)C[C@H]1C	ZINC000947314053	1333085368	/nfs/dbraw/zinc/08/53/68/1333085368.db2.gz	DLGGPVYWRJLVCQ-ZIAGYGMSSA-N	0	3	328.412	3.210	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2c(C)nn(C(C)(C)C)c2C)C[C@@H]1C	ZINC000947369190	1333106489	/nfs/dbraw/zinc/10/64/89/1333106489.db2.gz	HSJSFGBIIUDWAZ-XJKSGUPXSA-N	0	3	332.492	3.024	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccnc(-c3ccco3)c2)C[C@H]1C	ZINC000947429284	1333124822	/nfs/dbraw/zinc/12/48/22/1333124822.db2.gz	GXOUWHAOZSLUIS-GDBMZVCRSA-N	0	3	325.412	3.110	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc(C)c(Cl)c2)C[C@@H]1C	ZINC000947441657	1333129315	/nfs/dbraw/zinc/12/93/15/1333129315.db2.gz	KAPWLOGPNYBVBH-DOTOQJQBSA-N	0	3	332.875	3.183	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc3c(C)c(C)[nH]c32)C[C@H]1C	ZINC000947454167	1333133942	/nfs/dbraw/zinc/13/39/42/1333133942.db2.gz	FSEDOFPBWZGIOS-PBHICJAKSA-N	0	3	337.467	3.391	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](NC(=O)c2n[nH]c3ccc(C)cc32)C[C@H]1C	ZINC000947492988	1333146037	/nfs/dbraw/zinc/14/60/37/1333146037.db2.gz	OINVWZPELQPVNY-ZIAGYGMSSA-N	0	3	346.862	3.207	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2ccc(CCCC)cc2)C[C@H]1C	ZINC000947509889	1333150377	/nfs/dbraw/zinc/15/03/77/1333150377.db2.gz	HZFDEHKIXZIAPC-XLIONFOSSA-N	0	3	326.484	3.174	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(-c3cccs3)on2)C[C@@H]1C	ZINC000947584897	1333183039	/nfs/dbraw/zinc/18/30/39/1333183039.db2.gz	OFTVYDBDGVSCRH-STQMWFEESA-N	0	3	331.441	3.172	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)C2(C)CCC2)CCN1Cc1cccc(C#N)c1	ZINC000947612721	1333192462	/nfs/dbraw/zinc/19/24/62/1333192462.db2.gz	XNFIITHCSRZECQ-YJBOKZPZSA-N	0	3	325.456	3.218	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc(F)cc2Cl)C[C@@H]1C	ZINC000947690419	1333224769	/nfs/dbraw/zinc/22/47/69/1333224769.db2.gz	WMQNDEQXEBYYHW-XJKSGUPXSA-N	0	3	336.838	3.014	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3ncccc3C)[C@H](C)C2)C1	ZINC000947703165	1333233760	/nfs/dbraw/zinc/23/37/60/1333233760.db2.gz	VYBMYPWXUWSFIL-IAGOWNOFSA-N	0	3	327.472	3.215	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3ncccc3C)[C@@H](C)C2)C1	ZINC000947703168	1333233773	/nfs/dbraw/zinc/23/37/73/1333233773.db2.gz	VYBMYPWXUWSFIL-IRXDYDNUSA-N	0	3	327.472	3.215	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C(C)C)nc2CC)C[C@H]1C	ZINC000947725596	1333241317	/nfs/dbraw/zinc/24/13/17/1333241317.db2.gz	BJEAYXMRZXDDCX-SJORKVTESA-N	0	3	341.499	3.373	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2c(F)ccc(F)c2Cl)C[C@@H]1C	ZINC000947734577	1333244727	/nfs/dbraw/zinc/24/47/27/1333244727.db2.gz	BJEAXQWSUVVINN-WDEREUQCSA-N	0	3	328.790	3.387	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(Cl)c(F)c2)C[C@H]1C	ZINC000947750083	1333249998	/nfs/dbraw/zinc/24/99/98/1333249998.db2.gz	LOGOCHHVQNOUDU-HIFRSBDPSA-N	0	3	336.838	3.014	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(F)c3ncccc3c2)C[C@@H]1C	ZINC000947809403	1333267199	/nfs/dbraw/zinc/26/71/99/1333267199.db2.gz	BZCSFDYILBNGCD-BBRMVZONSA-N	0	3	327.403	3.143	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnc3ccc(F)cc3c2)C[C@H]1C	ZINC000947895639	1333296034	/nfs/dbraw/zinc/29/60/34/1333296034.db2.gz	PQVZNNGXVQUSFZ-CXAGYDPISA-N	0	3	327.403	3.143	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C(C)(C)c2ccc(F)cc2)C[C@H]1C	ZINC000947943178	1333313853	/nfs/dbraw/zinc/31/38/53/1333313853.db2.gz	JADFFGXRJIKRHH-CRAIPNDOSA-N	0	3	330.447	3.096	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)C(C)(C)C)CCN1Cc1ccc(OCC#N)cc1	ZINC000947957550	1333319918	/nfs/dbraw/zinc/31/99/18/1333319918.db2.gz	LBSGENBHHSGZKV-DOTOQJQBSA-N	0	3	343.471	3.104	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)c(F)cc2Cl)C[C@H]1C	ZINC000947975301	1333329825	/nfs/dbraw/zinc/32/98/25/1333329825.db2.gz	LZJSQGUFGANLEC-KGLIPLIRSA-N	0	3	336.838	3.394	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccsc2C(F)F)C[C@H]1C	ZINC000947983495	1333331086	/nfs/dbraw/zinc/33/10/86/1333331086.db2.gz	BDKRVQFBQHOQJF-NEPJUHHUSA-N	0	3	326.412	3.292	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc3ccccc3c2)C[C@@H]1C	ZINC000948017771	1333343765	/nfs/dbraw/zinc/34/37/65/1333343765.db2.gz	XCPCLJGUMSVCQJ-UWJYYQICSA-N	0	3	334.463	3.375	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3cc(C)cc(C)c3)CC2)C[C@H]1C	ZINC000948044381	1333351994	/nfs/dbraw/zinc/35/19/94/1333351994.db2.gz	QKGXNQQGGRJWIJ-QUCCMNQESA-N	0	3	338.495	3.327	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)CC2C3CC4CC(C3)CC2C4)C[C@@H]1C	ZINC000948057745	1333358359	/nfs/dbraw/zinc/35/83/59/1333358359.db2.gz	YXCLHVZRHPLMNN-XVSCRIFDSA-N	0	3	328.500	3.051	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2c[nH]c3c2cccc3CC)C[C@@H]1C	ZINC000948071411	1333364564	/nfs/dbraw/zinc/36/45/64/1333364564.db2.gz	XXNLDVKDBJTVMR-GOEBONIOSA-N	0	3	325.456	3.499	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)Cc2coc3ccc(C)cc23)CC1	ZINC000948412766	1333515861	/nfs/dbraw/zinc/51/58/61/1333515861.db2.gz	YXEIRSYWNFTVAT-SFHVURJKSA-N	0	3	338.451	3.230	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2ccccc2-c2ccncc2)CC1	ZINC000948546819	1333567480	/nfs/dbraw/zinc/56/74/80/1333567480.db2.gz	IPZXXFDPBNBDMV-LJQANCHMSA-N	0	3	347.462	3.308	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cc(C)c3ccccc3n2)CC1	ZINC000948547202	1333568366	/nfs/dbraw/zinc/56/83/66/1333568366.db2.gz	SRSXUVWLQCUBLG-GOSISDBHSA-N	0	3	349.478	3.493	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2cc(C3CC3)[nH]c2C2CC2)CC1	ZINC000948547294	1333568431	/nfs/dbraw/zinc/56/84/31/1333568431.db2.gz	WGGVIBJTRWGNME-KRWDZBQOSA-N	0	3	339.483	3.329	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N(C)[C@H]1CCCN(CC#CC)CC1	ZINC000948562043	1333577179	/nfs/dbraw/zinc/57/71/79/1333577179.db2.gz	PLOUVUDGFZNKNF-SFHVURJKSA-N	0	3	340.467	3.201	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2scnc2C2CCCC2)CC1	ZINC000948589587	1333586854	/nfs/dbraw/zinc/58/68/54/1333586854.db2.gz	CVHSQUHCMQROGO-MRXNPFEDSA-N	0	3	345.512	3.360	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cc(C)n(CC)c2C)CC1	ZINC000948594143	1333588634	/nfs/dbraw/zinc/58/86/34/1333588634.db2.gz	KZIVVCGBXMFHPY-GOSISDBHSA-N	0	3	329.488	3.075	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2ccc(C)c3cccnc23)CC1	ZINC000948626051	1333602144	/nfs/dbraw/zinc/60/21/44/1333602144.db2.gz	XEDHGPYKGCYFDG-GOSISDBHSA-N	0	3	349.478	3.493	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)C2(c3cccc(F)c3)CC2)CC1	ZINC000948820604	1333697568	/nfs/dbraw/zinc/69/75/68/1333697568.db2.gz	NILAXLAKKHFYGA-LJQANCHMSA-N	0	3	342.458	3.194	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2ccccc2O[C@@H](C)CC)CC1	ZINC000948820897	1333698154	/nfs/dbraw/zinc/69/81/54/1333698154.db2.gz	UQCBOJBUQJERLH-ROUUACIJSA-N	0	3	342.483	3.424	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccc(C)s2)CC1	ZINC000948844706	1333706705	/nfs/dbraw/zinc/70/67/05/1333706705.db2.gz	GXQFLBYXVMTRAZ-RCCFBDPRSA-N	0	3	344.524	3.496	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@H]1CNC(=O)C1CC(F)(F)C1	ZINC000948906658	1333728949	/nfs/dbraw/zinc/72/89/49/1333728949.db2.gz	PVDQNVXYCSQKKW-QGZVFWFLSA-N	0	3	334.410	3.323	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NC[C@@H]1c2ccccc2CCN1CCC	ZINC000948969368	1333750915	/nfs/dbraw/zinc/75/09/15/1333750915.db2.gz	HHJFOHHNEFNJHX-ZCNNSNEGSA-N	0	3	342.483	3.093	20	30		EGEDHN
CC#CCN1CCC2(CC1)CN(C(=O)CC1CCCCCC1)CCO2	ZINC000949202634	1333795340	/nfs/dbraw/zinc/79/53/40/1333795340.db2.gz	PXGREMPCZKKDQC-UHFFFAOYSA-N	0	3	346.515	3.064	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)c3cc(C)c(C)o3)CC2)C1	ZINC000949340556	1333826858	/nfs/dbraw/zinc/82/68/58/1333826858.db2.gz	SQOVZZRTHCEWAR-UHFFFAOYSA-N	0	3	346.471	3.170	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C(F)=C3CCCC3)CC2)C1	ZINC000949340583	1333827194	/nfs/dbraw/zinc/82/71/94/1333827194.db2.gz	UQVWQUUTKKNSIS-UHFFFAOYSA-N	0	3	336.451	3.054	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C[C@@H]3CCC[C@H]3C)CC2)C1	ZINC000949365841	1333831225	/nfs/dbraw/zinc/83/12/25/1333831225.db2.gz	ITDKQZCDQCNVGJ-MOPGFXCFSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@H]3CCCC[C@H]3C)CC2)C1	ZINC000949450747	1333851044	/nfs/dbraw/zinc/85/10/44/1333851044.db2.gz	ITBJPMDCXWPHLX-MOPGFXCFSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC3(CC2)CN(CCCC)CCO3)CC1	ZINC000949454625	1333851540	/nfs/dbraw/zinc/85/15/40/1333851540.db2.gz	LPGOMZNPHYMVTF-UHFFFAOYSA-N	0	3	334.504	3.226	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@@H]3C[C@H]3CCC)CC2)C1	ZINC000949468603	1333856610	/nfs/dbraw/zinc/85/66/10/1333856610.db2.gz	JAABVJGKOXVHIM-QZTJIDSGSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@@H]3C[C@]3(C)CC)CC2)C1	ZINC000949504373	1333861921	/nfs/dbraw/zinc/86/19/21/1333861921.db2.gz	RAPKNILZEKQKCM-HKUYNNGSSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N1CCN(CC2CCC(C)CC2)CC1	ZINC000951595117	1334276257	/nfs/dbraw/zinc/27/62/57/1334276257.db2.gz	WDHAYBGXELUELN-GUMHCPJTSA-N	0	3	348.531	3.328	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2cc(F)cc3ccoc32)C1	ZINC000967061246	1335652318	/nfs/dbraw/zinc/65/23/18/1335652318.db2.gz	MMPVWSKTLGEIMW-GUYCJALGSA-N	0	3	328.387	3.035	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)Cc2ccc(CCCC)cc2)C1	ZINC000967252452	1335678813	/nfs/dbraw/zinc/67/88/13/1335678813.db2.gz	DPRPIAFNTPQVRT-RXVVDRJESA-N	0	3	340.511	3.422	20	30		EGEDHN
C=C(C)CCN1CC[C@H](C)[C@@H](NC(=O)c2ncc(Cl)s2)C1	ZINC000967355578	1335711888	/nfs/dbraw/zinc/71/18/88/1335711888.db2.gz	HOSOBSXSZSAOKU-RYUDHWBXSA-N	0	3	327.881	3.203	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)C2(c3cccc(F)c3)CCC2)C1	ZINC000967654425	1335801150	/nfs/dbraw/zinc/80/11/50/1335801150.db2.gz	GIEFXQVYGPUQLD-APWZRJJASA-N	0	3	342.458	3.097	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(C(=O)CC3=CCCCC3)C2)cc1F	ZINC000967751927	1335812432	/nfs/dbraw/zinc/81/24/32/1335812432.db2.gz	ZAVKOSGGUUSSHI-GOSISDBHSA-N	0	3	341.430	3.278	20	30		EGEDHN
CC1(C)C(C(=O)N2CC[C@@H](NCc3ccc(F)c(C#N)c3)C2)C1(C)C	ZINC000968337772	1335893979	/nfs/dbraw/zinc/89/39/79/1335893979.db2.gz	GLAJNNLVHJOGCH-OAHLLOKOSA-N	0	3	343.446	3.070	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2ccc(C3CC3)nc2C)C1	ZINC000968341707	1335895011	/nfs/dbraw/zinc/89/50/11/1335895011.db2.gz	YINAOZNHFYJZPQ-AUUYWEPGSA-N	0	3	327.472	3.284	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)Cc2ccccc2OC(C)C)C1	ZINC000968413946	1335924042	/nfs/dbraw/zinc/92/40/42/1335924042.db2.gz	NREHSRVDDVOTGJ-HKUYNNGSSA-N	0	3	344.499	3.419	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2cc3cccnc3s2)C1	ZINC000968501702	1335944157	/nfs/dbraw/zinc/94/41/57/1335944157.db2.gz	ZEKYYHJRXLZFMY-ZFWWWQNUSA-N	0	3	329.469	3.313	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2cc(Cl)ccc2Cl)C1	ZINC000968584062	1335972866	/nfs/dbraw/zinc/97/28/66/1335972866.db2.gz	RWBICIQIVQGYNO-LRDDRELGSA-N	0	3	339.266	3.457	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cc(C)c(F)cc2Cl)C1	ZINC000968592491	1335976024	/nfs/dbraw/zinc/97/60/24/1335976024.db2.gz	NHPRWSDQIDZHLT-PXAZEXFGSA-N	0	3	336.838	3.251	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2ccc(OC3CCC3)cc2)C1	ZINC000968669768	1336004113	/nfs/dbraw/zinc/00/41/13/1336004113.db2.gz	STXQGMOOCJXNSV-OXJNMPFZSA-N	0	3	340.467	3.081	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)Cc2cccc(OC(C)C)c2)C1	ZINC000968687983	1336011465	/nfs/dbraw/zinc/01/14/65/1336011465.db2.gz	ITNJPNVBNVEFGV-YLJYHZDGSA-N	0	3	344.499	3.419	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2csc(CC(C)C)n2)C1	ZINC000968694842	1336014214	/nfs/dbraw/zinc/01/42/14/1336014214.db2.gz	BIWQUNSRHPPCRQ-CABCVRRESA-N	0	3	335.517	3.358	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccccc2CC(C)C)C1	ZINC000968692557	1336014425	/nfs/dbraw/zinc/01/44/25/1336014425.db2.gz	OBJLQQRLMJDHDQ-PXNSSMCTSA-N	0	3	326.484	3.349	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ncn2cc(Cl)ccc12	ZINC000968864600	1336072166	/nfs/dbraw/zinc/07/21/66/1336072166.db2.gz	YKUMHWAUCMFQMM-OAHLLOKOSA-N	0	3	346.862	3.148	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1[nH]nc2ccc(C)cc21	ZINC000968931121	1336093885	/nfs/dbraw/zinc/09/38/85/1336093885.db2.gz	GUCIFBYWBFKYTQ-OAHLLOKOSA-N	0	3	326.444	3.032	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1ccncc1OC(C)C	ZINC000968965838	1336103918	/nfs/dbraw/zinc/10/39/18/1336103918.db2.gz	ZRTBKQGUXSSMFS-KRWDZBQOSA-N	0	3	345.487	3.419	20	30		EGEDHN
C#CCCN1CCCCC[C@H]1CNC(=O)c1cc([C@H](C)CC)no1	ZINC000969061573	1336134380	/nfs/dbraw/zinc/13/43/80/1336134380.db2.gz	BYRGLXBFQHZDKJ-CVEARBPZSA-N	0	3	331.460	3.186	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1noc2c1C[C@H](C)CC2	ZINC000969097447	1336141375	/nfs/dbraw/zinc/14/13/75/1336141375.db2.gz	LPJWKYFYJXEPPR-CVEARBPZSA-N	0	3	345.487	3.350	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccc2ccn(C)c2c1	ZINC000969097688	1336142008	/nfs/dbraw/zinc/14/20/08/1336142008.db2.gz	OGGHNDVTXSDYOF-SFHVURJKSA-N	0	3	325.456	3.339	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1ccc2cnccc2c1	ZINC000969105732	1336146045	/nfs/dbraw/zinc/14/60/45/1336146045.db2.gz	MVCJNOMJXTUKMX-FQEVSTJZSA-N	0	3	335.451	3.233	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1oc(CCC)nc1C	ZINC000969111561	1336147984	/nfs/dbraw/zinc/14/79/84/1336147984.db2.gz	REXZGHDJCDZWOK-INIZCTEOSA-N	0	3	333.476	3.486	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)[C@H]1CCCc2sc(C)nc21	ZINC000969114273	1336149047	/nfs/dbraw/zinc/14/90/47/1336149047.db2.gz	DXQJFDLPWHUIOA-CVEARBPZSA-N	0	3	347.528	3.418	20	30		EGEDHN
CC(C)(C)[C@@H]1C[C@H]1C(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC000969307420	1336197480	/nfs/dbraw/zinc/19/74/80/1336197480.db2.gz	MGDFNPNOXJZSIG-BRWVUGGUSA-N	0	3	343.446	3.070	20	30		EGEDHN
CC(C)(C(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C1)C1CCC1	ZINC000969481988	1336217064	/nfs/dbraw/zinc/21/70/64/1336217064.db2.gz	FRNURYWUWCOWQA-CQSZACIVSA-N	0	3	331.485	3.137	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)c2coc3c2cccc3OC)C1	ZINC000969680074	1336236530	/nfs/dbraw/zinc/23/65/30/1336236530.db2.gz	JKXDZXQGZWKVBJ-ZDUSSCGKSA-N	0	3	328.412	3.068	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)[C@@H]2CCCC[C@H]2C(F)(F)F)C1	ZINC000969881420	1336256781	/nfs/dbraw/zinc/25/67/81/1336256781.db2.gz	TYVXKPDRSHLQSZ-NWANDNLSSA-N	0	3	332.410	3.368	20	30		EGEDHN
C=Cc1ccc(C(=O)N2CC[C@@H](NCc3ccc(F)c(C#N)c3)C2)cc1	ZINC000970050725	1336273890	/nfs/dbraw/zinc/27/38/90/1336273890.db2.gz	WLFRKZHOWGRPKS-LJQANCHMSA-N	0	3	349.409	3.345	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)c2ccc(F)c(Cl)c2F)C1	ZINC000970374521	1336299351	/nfs/dbraw/zinc/29/93/51/1336299351.db2.gz	PRBOQVZDKBJFCM-SNVBAGLBSA-N	0	3	328.790	3.244	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)c2ccc(C(C)C)nc2CC)C1	ZINC000970431508	1336307648	/nfs/dbraw/zinc/30/76/48/1336307648.db2.gz	NZYMKBNVVZYAFS-OAHLLOKOSA-N	0	3	329.488	3.394	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)c2ccc(O[C@@H](C)CC)cc2)C1	ZINC000970708571	1336334630	/nfs/dbraw/zinc/33/46/30/1336334630.db2.gz	NRARPWHMEOUHFR-HOTGVXAUSA-N	0	3	330.472	3.490	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cn(C)c3ccccc23)CC1	ZINC001005677434	1336391045	/nfs/dbraw/zinc/39/10/45/1336391045.db2.gz	WYCRHBVAFJTRRV-UHFFFAOYSA-N	0	3	325.456	3.291	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cccc3c2O[C@H](C)C3)CC1	ZINC001005732295	1336397963	/nfs/dbraw/zinc/39/79/63/1336397963.db2.gz	RNTXACLHUBSZCN-OAHLLOKOSA-N	0	3	328.456	3.123	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cc3ncccc3s2)CC1	ZINC001005814919	1336404219	/nfs/dbraw/zinc/40/42/19/1336404219.db2.gz	NDRQCDZNZJEVGX-UHFFFAOYSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)C(C)(C)c2ccc(OC)cc2)CC1	ZINC001006434697	1336505127	/nfs/dbraw/zinc/50/51/27/1336505127.db2.gz	LJDWDCQRDSDXES-UHFFFAOYSA-N	0	3	330.472	3.082	20	30		EGEDHN
C#CCCN1CCC[C@@H](NC(=O)Cc2ccc(CC(C)C)cc2)C1	ZINC001007845063	1336715675	/nfs/dbraw/zinc/71/56/75/1336715675.db2.gz	NLUPKHVYYQCWNX-HXUWFJFHSA-N	0	3	326.484	3.032	20	30		EGEDHN
C=C(C)CCN1CCC[C@H](NC(=O)c2c(F)cc(OC)cc2F)C1	ZINC001008628638	1336898205	/nfs/dbraw/zinc/89/82/05/1336898205.db2.gz	JRRRPJUIOPEWHJ-ZDUSSCGKSA-N	0	3	338.398	3.134	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN([C@H](C)c3cccc(C)c3)C2)cn1	ZINC001009273180	1336994889	/nfs/dbraw/zinc/99/48/89/1336994889.db2.gz	DNBSFKLEAWOYGK-DYESRHJHSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(Cc3ccc(C)c(C)c3)C2)cc1	ZINC001015481698	1338155653	/nfs/dbraw/zinc/15/56/53/1338155653.db2.gz	GPPGRBBCJKBINJ-OAQYLSRUSA-N	0	3	332.447	3.289	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@@H]1CCN(Cc2cc(C)ccc2C)C1	ZINC001016113684	1338467303	/nfs/dbraw/zinc/46/73/03/1338467303.db2.gz	LQNZEHJQCYZEHF-JOCHJYFZSA-N	0	3	346.474	3.218	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CC12CCN(C[C@H](F)CC)CC2	ZINC001016660688	1338681431	/nfs/dbraw/zinc/68/14/31/1338681431.db2.gz	ALCXIEMKHDUSSN-NVXWUHKLSA-N	0	3	333.451	3.007	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2nc(C(C)(C)C)cs2)CC1	ZINC001016666049	1338685294	/nfs/dbraw/zinc/68/52/94/1338685294.db2.gz	CQDAVDSUBSULAR-AWEZNQCLSA-N	0	3	345.512	3.048	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)C2(c3ccccc3)CCC2)CC1	ZINC001016718875	1338701378	/nfs/dbraw/zinc/70/13/78/1338701378.db2.gz	HJYWFSNFYTXRAZ-IBGZPJMESA-N	0	3	336.479	3.102	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)Cc2cccc(C3CC3)c2)CC1	ZINC001016744503	1338710075	/nfs/dbraw/zinc/71/00/75/1338710075.db2.gz	HKCAUXSWUGXQQR-HXUWFJFHSA-N	0	3	336.479	3.101	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccccc2-n2cccc2)CC1	ZINC001016808912	1338733283	/nfs/dbraw/zinc/73/32/83/1338733283.db2.gz	SRGKIGGJJZXCHX-HXUWFJFHSA-N	0	3	347.462	3.085	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2c(C)cccc2Cl)CC1	ZINC001016810520	1338734097	/nfs/dbraw/zinc/73/40/97/1338734097.db2.gz	LJRCKUFWTWSPOI-INIZCTEOSA-N	0	3	330.859	3.256	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(C(C)C)nc2C)CC1	ZINC001016831863	1338740327	/nfs/dbraw/zinc/74/03/27/1338740327.db2.gz	FVKUVWMAGXEDFP-IBGZPJMESA-N	0	3	339.483	3.121	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)[C@@H]2C[C@H]2c2ccc(C)c(C)c2)CC1	ZINC001016871611	1338754171	/nfs/dbraw/zinc/75/41/71/1338754171.db2.gz	YBDFDSJVXYVTFR-XUVXKRRUSA-N	0	3	336.479	3.011	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2[nH]ccc2-c2ccccc2)CC1	ZINC001016928387	1338773456	/nfs/dbraw/zinc/77/34/56/1338773456.db2.gz	XEPIUUNWOWVNJB-LJQANCHMSA-N	0	3	347.462	3.289	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)C(C)(C)c2ccc(C)cc2)CC1	ZINC001016940250	1338776994	/nfs/dbraw/zinc/77/69/94/1338776994.db2.gz	JSJYADWMSSNCKY-LJQANCHMSA-N	0	3	338.495	3.267	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2c[nH]cc2-c2ccccc2)CC1	ZINC001016969637	1338787480	/nfs/dbraw/zinc/78/74/80/1338787480.db2.gz	NEVKAFZTHZPMGJ-HXUWFJFHSA-N	0	3	347.462	3.289	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(C)c3c2CCC3)CC1	ZINC001016991097	1338795994	/nfs/dbraw/zinc/79/59/94/1338795994.db2.gz	XQBAYRPBPWTBCI-FQEVSTJZSA-N	0	3	336.479	3.091	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(C(C)C)s2)CC1	ZINC001016991121	1338796055	/nfs/dbraw/zinc/79/60/55/1338796055.db2.gz	YAXZPUUHAUDBFU-KRWDZBQOSA-N	0	3	330.497	3.479	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)C2CC(c3ccccc3)C2)CC1	ZINC001016997979	1338798563	/nfs/dbraw/zinc/79/85/63/1338798563.db2.gz	OCMBKTFLAWCHFP-SOAGJPPSSA-N	0	3	336.479	3.174	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001017032722	1338823767	/nfs/dbraw/zinc/82/37/67/1338823767.db2.gz	YKEMGPMALIFJJQ-HNNXBMFYSA-N	0	3	331.485	3.256	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H](CN(C)Cc3scnc3C)C2)C1	ZINC001017208486	1338955139	/nfs/dbraw/zinc/95/51/39/1338955139.db2.gz	SFCGYLKOGMGZOQ-MRXNPFEDSA-N	0	3	347.528	3.478	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cn(C)c2ccc(F)cc12	ZINC001017623555	1339378406	/nfs/dbraw/zinc/37/84/06/1339378406.db2.gz	XGRZERYPTFDNKV-IYBDPMFKSA-N	0	3	341.430	3.182	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1noc2ccccc21	ZINC001017717974	1339400060	/nfs/dbraw/zinc/40/00/60/1339400060.db2.gz	YFBLBJFKUZIRKV-IYBDPMFKSA-N	0	3	339.439	3.012	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C(C)(C)c1c(C)noc1C	ZINC001017834474	1339428304	/nfs/dbraw/zinc/42/83/04/1339428304.db2.gz	PVQCFNJYNZEDET-CALCHBBNSA-N	0	3	345.487	3.210	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)CCc1cc(C)cc(C)c1	ZINC001018143546	1339513070	/nfs/dbraw/zinc/51/30/70/1339513070.db2.gz	GUHREAFZJKRVBM-BGYRXZFFSA-N	0	3	326.484	3.487	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C1CCC(C(F)F)CC1	ZINC001018227371	1339540443	/nfs/dbraw/zinc/54/04/43/1339540443.db2.gz	GXYGDHRUXPCDJT-STONLHKKSA-N	0	3	326.431	3.309	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)Oc1cccc(C)c1	ZINC001018247301	1339548839	/nfs/dbraw/zinc/54/88/39/1339548839.db2.gz	XGAZOSKPIRWLSF-GBESFXJTSA-N	0	3	342.483	3.404	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)Oc1cccc(C)c1	ZINC001018247302	1339548959	/nfs/dbraw/zinc/54/89/59/1339548959.db2.gz	XGAZOSKPIRWLSF-QRVBRYPASA-N	0	3	342.483	3.404	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)n1c(C)ccc1C	ZINC001018303895	1339569718	/nfs/dbraw/zinc/56/97/18/1339569718.db2.gz	QONWJRMZLHJOJH-GBESFXJTSA-N	0	3	329.488	3.307	20	30		EGEDHN
C[C@@H](N[C@H]1CCN(C(=O)c2cc(C#N)c[nH]2)C1)c1ccccc1Cl	ZINC001018679595	1339699404	/nfs/dbraw/zinc/69/94/04/1339699404.db2.gz	NTRALBNLRXXOQR-OCCSQVGLSA-N	0	3	342.830	3.105	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001018910199	1339750531	/nfs/dbraw/zinc/75/05/31/1339750531.db2.gz	NLRXRMJEKRAWKF-HNNXBMFYSA-N	0	3	349.837	3.167	20	30		EGEDHN
C#CCCN1CCC[C@H]1CNC(=O)c1cc2cc(Cl)ccc2[nH]1	ZINC001028065251	1340405408	/nfs/dbraw/zinc/40/54/08/1340405408.db2.gz	BIJYYBMJRWNRLK-HNNXBMFYSA-N	0	3	329.831	3.039	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCCN2Cc2ccccc2CC)cn1	ZINC001028271331	1340524528	/nfs/dbraw/zinc/52/45/28/1340524528.db2.gz	FKGPNEIYRBOBGH-OAQYLSRUSA-N	0	3	347.462	3.020	20	30		EGEDHN
C#CCCN1CCC[C@@H]1CNC(=O)c1cc(Cl)cc(Cl)c1	ZINC001028283639	1340539035	/nfs/dbraw/zinc/53/90/35/1340539035.db2.gz	LXFLTIOSSMLTKA-OAHLLOKOSA-N	0	3	325.239	3.211	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](CNC(=O)C3CCCCCC3)C2)cc1	ZINC001028443230	1340644080	/nfs/dbraw/zinc/64/40/80/1340644080.db2.gz	OIEFWVSXYVWJLA-LJQANCHMSA-N	0	3	339.483	3.467	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H](CNC(=O)C3=CCCCCC3)C2)c1	ZINC001028501315	1340674183	/nfs/dbraw/zinc/67/41/83/1340674183.db2.gz	FLPWZSRGZKVWHM-IBGZPJMESA-N	0	3	337.467	3.387	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CCN(Cc3cncc(C)c3)C2)CC1	ZINC001028780706	1340812903	/nfs/dbraw/zinc/81/29/03/1340812903.db2.gz	MPMSEIGACHLIGG-KRWDZBQOSA-N	0	3	327.472	3.075	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@@H]2CCN(Cc3cccc(C#N)c3)C2)c(C)c1	ZINC001028966030	1340894983	/nfs/dbraw/zinc/89/49/83/1340894983.db2.gz	RONMEFLWLHDHMT-FQEVSTJZSA-N	0	3	347.462	3.427	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)c2cc3cc(F)ccc3s2)C1	ZINC001028979010	1340899679	/nfs/dbraw/zinc/89/96/79/1340899679.db2.gz	NHRADIIMICJCKB-ZDUSSCGKSA-N	0	3	330.428	3.115	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC([C@@H](C)NCc2cc(C)no2)CC1	ZINC001029136612	1340939805	/nfs/dbraw/zinc/93/98/05/1340939805.db2.gz	JLTQKRSKPSTPED-BEFAXECRSA-N	0	3	333.476	3.302	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2C[C@H]3CC[C@@H](C2)N3CCCC)cc1	ZINC001029364659	1340978096	/nfs/dbraw/zinc/97/80/96/1340978096.db2.gz	GAHDBYZFPRORMJ-HDICACEKSA-N	0	3	328.456	3.340	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CC[C@@H](C1)N2C[C@H](OC)C1CCCC1	ZINC001029456994	1340994612	/nfs/dbraw/zinc/99/46/12/1340994612.db2.gz	WAKOWYUSNOPOOG-YOUFYPILSA-N	0	3	348.531	3.469	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H]3CC[C@@H](C2)N3C[C@H](OC)C2CCC2)CC1	ZINC001029457697	1340994636	/nfs/dbraw/zinc/99/46/36/1340994636.db2.gz	QVRKZBWZOVLHQK-ZCNNSNEGSA-N	0	3	346.515	3.223	20	30		EGEDHN
CN(Cc1ccc(Cl)s1)C[C@H]1CCN(C(=O)C#CC2CC2)C1	ZINC001029734373	1341058186	/nfs/dbraw/zinc/05/81/86/1341058186.db2.gz	VZQXUHQGTHMWHD-CQSZACIVSA-N	0	3	336.888	3.095	20	30		EGEDHN
Cc1cocc1C(=O)N1CC[C@@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001029808385	1341081256	/nfs/dbraw/zinc/08/12/56/1341081256.db2.gz	OQGJAVGKLNIAMW-AWEZNQCLSA-N	0	3	343.452	3.115	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H](CN(C)Cc2cncc(F)c2)C1	ZINC001029825509	1341086920	/nfs/dbraw/zinc/08/69/20/1341086920.db2.gz	FMLRQMWFFGFYJR-BEFAXECRSA-N	0	3	333.451	3.103	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H](CN(C)Cc2oc(C)nc2C)C1	ZINC001029828907	1341088725	/nfs/dbraw/zinc/08/87/25/1341088725.db2.gz	OCJJPRPWVSKXLM-APWZRJJASA-N	0	3	333.476	3.174	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](CN(C)Cc3cccc(Cl)n3)C2)C1	ZINC001029836793	1341092518	/nfs/dbraw/zinc/09/25/18/1341092518.db2.gz	VEQKWAYVWKOBTF-HNNXBMFYSA-N	0	3	347.890	3.372	20	30		EGEDHN
C#CCCN1CCC[C@@H](N(Cc2ccccc2)C(=O)c2ccncc2)C1	ZINC001029919113	1341118872	/nfs/dbraw/zinc/11/88/72/1341118872.db2.gz	PFCGEDDVCOZAFY-OAQYLSRUSA-N	0	3	347.462	3.212	20	30		EGEDHN
C[C@@H]1C[C@@H]1C(=O)N1CCC(CN(C)Cc2cc(C#N)ccc2F)CC1	ZINC001029931222	1341125323	/nfs/dbraw/zinc/12/53/23/1341125323.db2.gz	NOSNEKNFIQGHCZ-KDOFPFPSSA-N	0	3	343.446	3.024	20	30		EGEDHN
CC1(C)CCC(CN2C[C@@H]3C[C@H]2CN3C(=O)c2ccc(C#N)[nH]2)CC1	ZINC001032362631	1341502447	/nfs/dbraw/zinc/50/24/47/1341502447.db2.gz	LJUICAPYBSCZGZ-IRXDYDNUSA-N	0	3	340.471	3.001	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc2nccc(C)c2c1	ZINC001032423192	1341509048	/nfs/dbraw/zinc/50/90/48/1341509048.db2.gz	ZKPJZVQVCLLVQA-ROUUACIJSA-N	0	3	335.451	3.408	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H](CC)c1ccc(OC)cc1	ZINC001032795944	1341615994	/nfs/dbraw/zinc/61/59/94/1341615994.db2.gz	RRMVUOWXJFPYBX-CMKODMSKSA-N	0	3	342.483	3.440	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H](C)Cc1ccccc1C	ZINC001032807990	1341621248	/nfs/dbraw/zinc/62/12/48/1341621248.db2.gz	GQNWDWFLJZOSER-IHPCNDPISA-N	0	3	326.484	3.425	20	30		EGEDHN
C=C(C)CCN1CC[C@H](N(C)C(=O)c2sc(C3CC3)nc2C)C1	ZINC001033071029	1341715516	/nfs/dbraw/zinc/71/55/16/1341715516.db2.gz	VZJLQTWRONURMR-HNNXBMFYSA-N	0	3	333.501	3.441	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2nsc3ccc(C)cc32)C1	ZINC001033329854	1341783555	/nfs/dbraw/zinc/78/35/55/1341783555.db2.gz	WQTXATIFWQMSQD-AWEZNQCLSA-N	0	3	329.469	3.327	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2cnn(C3CCCC3)c2C)C1	ZINC001033568369	1341877134	/nfs/dbraw/zinc/87/71/34/1341877134.db2.gz	IUVHMRCGWTZLOT-QGZVFWFLSA-N	0	3	330.476	3.029	20	30		EGEDHN
C#CCCN1CC[C@H](N(C)C(=O)c2ccc(Cl)c(CCC)c2)C1	ZINC001033580813	1341881858	/nfs/dbraw/zinc/88/18/58/1341881858.db2.gz	GMMKSUAMSLDXQP-KRWDZBQOSA-N	0	3	332.875	3.462	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@H]2CCN(Cc3cc(C)ccc3C)C2)cn1	ZINC001033598374	1341890760	/nfs/dbraw/zinc/89/07/60/1341890760.db2.gz	JSSSEPSVBWQHFX-NRFANRHFSA-N	0	3	347.462	3.026	20	30		EGEDHN
C=CCCN1CC[C@@H](N(C)C(=O)c2ccc(C(F)(F)F)s2)C1	ZINC001033702140	1341967967	/nfs/dbraw/zinc/96/79/67/1341967967.db2.gz	NXCFTCVJMBELNC-LLVKDONJSA-N	0	3	332.391	3.489	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2coc3c2cccc3OC)C1	ZINC001033832222	1342033266	/nfs/dbraw/zinc/03/32/66/1342033266.db2.gz	DUJGKCMDXBQZBH-HNNXBMFYSA-N	0	3	340.423	3.001	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](N(CC)C(=O)c2nc3cccnc3s2)C1	ZINC001033857195	1342046824	/nfs/dbraw/zinc/04/68/24/1342046824.db2.gz	BFEUXCNDRQQJNA-CQSZACIVSA-N	0	3	344.484	3.194	20	30		EGEDHN
C=C(C)CCN1CC[C@H](N(CC)C(=O)c2cn3cc(C)nc3s2)C1	ZINC001033856422	1342047125	/nfs/dbraw/zinc/04/71/25/1342047125.db2.gz	SKDINUIMAPLRDE-HNNXBMFYSA-N	0	3	346.500	3.207	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2cc(C3CC3)[nH]c2C2CC2)C1	ZINC001033878441	1342055560	/nfs/dbraw/zinc/05/55/60/1342055560.db2.gz	LDBGWRKYEMOQSC-KRWDZBQOSA-N	0	3	339.483	3.329	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)[C@@H](c1ccc(OC)cc1)C(C)C	ZINC001182994929	1387253637	/nfs/dbraw/zinc/25/36/37/1387253637.db2.gz	ZILYIGXXIQPAPI-PKOBYXMFSA-N	0	3	330.472	3.201	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2ccc(C)c3cccnc23)C1	ZINC001033907513	1342079779	/nfs/dbraw/zinc/07/97/79/1342079779.db2.gz	UNJMPQHTXFIFAG-QGZVFWFLSA-N	0	3	335.451	3.103	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cc(F)c(F)c(F)c2)C1	ZINC001033970117	1342120755	/nfs/dbraw/zinc/12/07/55/1342120755.db2.gz	ZAEBBLUDWGVQFV-CYBMUJFWSA-N	0	3	326.362	3.216	20	30		EGEDHN
C=CCCN1CC[C@H](N(CC)C(=O)c2occc2Br)C1	ZINC001033988570	1342132906	/nfs/dbraw/zinc/13/29/06/1342132906.db2.gz	MLHWKPJLLLWDOS-LBPRGKRZSA-N	0	3	341.249	3.155	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@@H]2C[C@H]2c2ccccc2OC)C1	ZINC001033983716	1342129362	/nfs/dbraw/zinc/12/93/62/1342129362.db2.gz	GJVUKNGAGOQWOA-YTQUADARSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccc3scnc3c2)C1	ZINC001034009346	1342147082	/nfs/dbraw/zinc/14/70/82/1342147082.db2.gz	JTEVZHNBYYLPJT-HNNXBMFYSA-N	0	3	329.469	3.409	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2cc(F)c(F)cc2Cl)C1	ZINC001034031708	1342170794	/nfs/dbraw/zinc/17/07/94/1342170794.db2.gz	FNRYVVQYRFFOBT-GFCCVEGCSA-N	0	3	340.801	3.178	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cccc3oc(C)nc32)C1	ZINC001034050201	1342190974	/nfs/dbraw/zinc/19/09/74/1342190974.db2.gz	GRLMHKGJHPXIGI-OAHLLOKOSA-N	0	3	327.428	3.249	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cc4c([nH]3)c(F)ccc4C)[C@@H]2C1	ZINC001075971441	1356459205	/nfs/dbraw/zinc/45/92/05/1356459205.db2.gz	ZKLFRGUNVASKHT-KBXCAEBGSA-N	0	3	341.430	3.338	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ncn3cc(Cl)ccc23)C1	ZINC001034219317	1342324732	/nfs/dbraw/zinc/32/47/32/1342324732.db2.gz	MIBMPFMDVOIENZ-OAHLLOKOSA-N	0	3	346.862	3.148	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@H]2CCCN2c2ccccc2)C1	ZINC001034239694	1342339933	/nfs/dbraw/zinc/33/99/33/1342339933.db2.gz	AFQKCDXDXDKTJW-UYAOXDASSA-N	0	3	341.499	3.202	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cncn2-c2ccccc2)C1	ZINC001034247554	1342345096	/nfs/dbraw/zinc/34/50/96/1342345096.db2.gz	PZXCILJNGKLQHQ-KRWDZBQOSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)C[C@@H]2C[C@H]2c2ccc(OC)cc2)C1	ZINC001034249704	1342346793	/nfs/dbraw/zinc/34/67/93/1342346793.db2.gz	MBVIEBHGYRJCJZ-BJLQDIEVSA-N	0	3	342.483	3.346	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2coc3cc(F)ccc23)C1	ZINC001034281224	1342370648	/nfs/dbraw/zinc/37/06/48/1342370648.db2.gz	HVBWWHXZSJKQKC-HNNXBMFYSA-N	0	3	328.387	3.180	20	30		EGEDHN
C=C(C)CCN1CCCC[C@H](NC(=O)c2ncc(Cl)s2)C1	ZINC001034307818	1342390658	/nfs/dbraw/zinc/39/06/58/1342390658.db2.gz	OGMXTTYVMWBRRR-LBPRGKRZSA-N	0	3	327.881	3.347	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cnn(C(C)C)c2Cl)C1	ZINC001034330139	1342404604	/nfs/dbraw/zinc/40/46/04/1342404604.db2.gz	IXTJASPKUFCYLB-AWEZNQCLSA-N	0	3	338.883	3.278	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@@H]2COc3cc(C)c(C)cc32)C1	ZINC001034330096	1342404778	/nfs/dbraw/zinc/40/47/78/1342404778.db2.gz	KRFKXVPABHSMOW-IEBWSBKVSA-N	0	3	342.483	3.326	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)c2ncoc2-c2cccs2)C1	ZINC001034447575	1342507995	/nfs/dbraw/zinc/50/79/95/1342507995.db2.gz	ILSNMSTYXPLRLW-CYBMUJFWSA-N	0	3	331.441	3.173	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cccc(-n3ccnc3)c2)C1	ZINC001034467661	1342522946	/nfs/dbraw/zinc/52/29/46/1342522946.db2.gz	MSWIPVOVKVXICQ-GOSISDBHSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cn(CCCC)nc2C)C1	ZINC001034483987	1342541539	/nfs/dbraw/zinc/54/15/39/1342541539.db2.gz	PKANQJDJQXZPQK-KRWDZBQOSA-N	0	3	332.492	3.152	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@@]2(c3ccccc3)CCCO2)C1	ZINC001034501705	1342559343	/nfs/dbraw/zinc/55/93/43/1342559343.db2.gz	ZJIFKRATIJCVHV-FPOVZHCZSA-N	0	3	342.483	3.239	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2cc(C)c(F)cc2Cl)C1	ZINC001034508123	1342567201	/nfs/dbraw/zinc/56/72/01/1342567201.db2.gz	ZTSATLNKVIDMAO-CQSZACIVSA-N	0	3	336.838	3.395	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cccc3oc(C)nc32)C1	ZINC001034545388	1342607592	/nfs/dbraw/zinc/60/75/92/1342607592.db2.gz	VFGVVVXPQSUZRW-OAHLLOKOSA-N	0	3	327.428	3.297	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)C[C@H]2C=CCC2)c(F)c1	ZINC001034853738	1342805040	/nfs/dbraw/zinc/80/50/40/1342805040.db2.gz	IVYKGJUGCXYUMC-MAUKXSAKSA-N	0	3	341.430	3.134	20	30		EGEDHN
C[C@]1(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)cc2F)C=CCC1	ZINC001035017636	1342878233	/nfs/dbraw/zinc/87/82/33/1342878233.db2.gz	YRGJKVOQEDZCKP-XLIONFOSSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H]1CNCc1ccnc(Cl)c1	ZINC001035034895	1342888671	/nfs/dbraw/zinc/88/86/71/1342888671.db2.gz	ASOKKTQNDBYNCI-CRAIPNDOSA-N	0	3	335.879	3.418	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001035067271	1342908598	/nfs/dbraw/zinc/90/85/98/1342908598.db2.gz	LNVFGHQZQPUARR-RHSMWYFYSA-N	0	3	331.435	3.070	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)[C@@H]2CC23CCCC3)s1	ZINC001035096179	1342923739	/nfs/dbraw/zinc/92/37/39/1342923739.db2.gz	PTVHRJNLGKBCII-PBHICJAKSA-N	0	3	343.496	3.281	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1coc(C(C)(C)C)n1)CC2	ZINC001035706719	1343144553	/nfs/dbraw/zinc/14/45/53/1343144553.db2.gz	NSIGYXJXJRVOFD-UHFFFAOYSA-N	0	3	331.460	3.086	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@H](C)Oc1ccccc1F)CC2	ZINC001035709425	1343145035	/nfs/dbraw/zinc/14/50/35/1343145035.db2.gz	FMWVCOQPBZRVFA-INIZCTEOSA-N	0	3	346.446	3.094	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)CC1(c3ccccc3)CC1)CC2	ZINC001035719023	1343151124	/nfs/dbraw/zinc/15/11/24/1343151124.db2.gz	SNWPVEMLKMLMHG-UHFFFAOYSA-N	0	3	336.479	3.056	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccnc(CCC)c1)CC2	ZINC001035727120	1343154986	/nfs/dbraw/zinc/15/49/86/1343154986.db2.gz	CTHOKDMTJRXUTK-UHFFFAOYSA-N	0	3	327.472	3.148	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cccc3ccc(C)nc31)CC2	ZINC001035731416	1343157514	/nfs/dbraw/zinc/15/75/14/1343157514.db2.gz	OBDSOOOEGDJIIR-UHFFFAOYSA-N	0	3	347.462	3.105	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccccc1C1(C)CC1)CC2	ZINC001035793922	1343202703	/nfs/dbraw/zinc/20/27/03/1343202703.db2.gz	GYBSDCDWZXRVRQ-UHFFFAOYSA-N	0	3	336.479	3.299	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cc1cccc(F)c1F)CC2	ZINC001035803836	1343206260	/nfs/dbraw/zinc/20/62/60/1343206260.db2.gz	HDFXIFHBHMZBMK-UHFFFAOYSA-N	0	3	334.410	3.008	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)C[C@@H](C)c1ccccc1F)CC2	ZINC001035818327	1343213981	/nfs/dbraw/zinc/21/39/81/1343213981.db2.gz	RUVLYFKREFIEAW-QGZVFWFLSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cccc3ccsc31)CC2	ZINC001035828552	1343217560	/nfs/dbraw/zinc/21/75/60/1343217560.db2.gz	RAYIUDNKFOVAKE-UHFFFAOYSA-N	0	3	338.476	3.463	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1oc3ccccc3c1C)CC2	ZINC001035848341	1343228390	/nfs/dbraw/zinc/22/83/90/1343228390.db2.gz	TWDPWIBALLLNMX-UHFFFAOYSA-N	0	3	336.435	3.303	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1c[nH]cc1-c1ccccc1)CC2	ZINC001035852058	1343230334	/nfs/dbraw/zinc/23/03/34/1343230334.db2.gz	PNCOAFFMFQINLJ-UHFFFAOYSA-N	0	3	347.462	3.243	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccc(C(C)C)s1)CC2	ZINC001035860316	1343236558	/nfs/dbraw/zinc/23/65/58/1343236558.db2.gz	IZZWPJDLKUBBNS-UHFFFAOYSA-N	0	3	330.497	3.433	20	30		EGEDHN
C[C@H]1CN(C(=O)CC2CCCC2)CC[C@H]1NCc1ccccc1C#N	ZINC001035919918	1343272246	/nfs/dbraw/zinc/27/22/46/1343272246.db2.gz	XHBGYQUEXCHZHK-OXJNMPFZSA-N	0	3	339.483	3.465	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@@H](NCc2cc(F)ccc2C#N)[C@H](C)C1	ZINC001035920043	1343272943	/nfs/dbraw/zinc/27/29/43/1343272943.db2.gz	NEZFWLRQVMASOG-AUUYWEPGSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](NCc2nc(C)oc2C)[C@@H](C)C1	ZINC001036139434	1343324130	/nfs/dbraw/zinc/32/41/30/1343324130.db2.gz	ZHXFEKFPAXDJJO-BBRMVZONSA-N	0	3	333.476	3.220	20	30		EGEDHN
C[C@H]1CN(C(=O)C(C)(C)C2CC2)CC[C@@H]1NCc1ccccc1C#N	ZINC001036143297	1343326293	/nfs/dbraw/zinc/32/62/93/1343326293.db2.gz	BOJFHINWFCCBKS-KXBFYZLASA-N	0	3	339.483	3.321	20	30		EGEDHN
CCC1(C(=O)N2CC[C@@H](NCc3ccccc3C#N)[C@@H](C)C2)CC1	ZINC001036189374	1343354008	/nfs/dbraw/zinc/35/40/08/1343354008.db2.gz	YHQUHDUGURUBCR-MAUKXSAKSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@H]1CN(C(=O)C(C)(C)C)CC[C@H]1NCc1cc(F)ccc1C#N	ZINC001036274382	1343391134	/nfs/dbraw/zinc/39/11/34/1343391134.db2.gz	WOTMFQHQHUOOFQ-SUMWQHHRSA-N	0	3	331.435	3.070	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC[C@H]([C@H](C)NCc2ccccc2C#N)C1	ZINC001036394988	1343463044	/nfs/dbraw/zinc/46/30/44/1343463044.db2.gz	SIVYTQPIUQUZIE-LITPMCFQSA-N	0	3	325.456	3.241	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]([C@@H](C)NCc2ccccc2C#N)C1	ZINC001036429124	1343482015	/nfs/dbraw/zinc/48/20/15/1343482015.db2.gz	SUBILBSNNLGTOL-VQIMIIECSA-N	0	3	339.483	3.487	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H]([C@H](C)NCc2cnc(C)o2)C1	ZINC001036440535	1343489193	/nfs/dbraw/zinc/48/91/93/1343489193.db2.gz	OBQSGKFHOMRHCT-HOCLYGCPSA-N	0	3	333.476	3.302	20	30		EGEDHN
C[C@H]1CCCN(C(=O)C(C)(C)F)[C@H]1CNCc1ccc(C#N)cc1F	ZINC001036503861	1343522021	/nfs/dbraw/zinc/52/20/21/1343522021.db2.gz	WQWWCLCQCXLLEI-GUYCJALGSA-N	0	3	349.425	3.162	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@@H]2CN(C(=O)c3ccccc3)CC[C@H]21	ZINC001036627000	1343584427	/nfs/dbraw/zinc/58/44/27/1343584427.db2.gz	GGFIKOCDCVVKGP-NHCUHLMSSA-N	0	3	345.446	3.295	20	30		EGEDHN
O=C(CCC1CC1)N1CC[C@H]2[C@@H](CCN2CC#Cc2ccccc2)C1	ZINC001036670582	1343613437	/nfs/dbraw/zinc/61/34/37/1343613437.db2.gz	WWOUDSPXJYUGBM-SFTDATJTSA-N	0	3	336.479	3.151	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3CN(C(=O)C4CC=CC4)CC[C@H]32)s1	ZINC001036674580	1343615839	/nfs/dbraw/zinc/61/58/39/1343615839.db2.gz	IBYHLEHQBVQIKP-MAUKXSAKSA-N	0	3	341.480	3.009	20	30		EGEDHN
O=C(N1CC[C@H]2[C@@H](CCN2CC#Cc2ccccc2)C1)C1(C2CC2)CC1	ZINC001036745100	1343670097	/nfs/dbraw/zinc/67/00/97/1343670097.db2.gz	SUZNQPXUQOSNCA-FPOVZHCZSA-N	0	3	348.490	3.151	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@H]2CN(C(=O)C3(C4CC4)CC3)CC[C@H]21	ZINC001036745019	1343670325	/nfs/dbraw/zinc/67/03/25/1343670325.db2.gz	RYKOTNNGSGQYKO-AZUAARDMSA-N	0	3	349.478	3.171	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2[C@H](CCN2CC#Cc2ccccc2)C1	ZINC001036792010	1343722905	/nfs/dbraw/zinc/72/29/05/1343722905.db2.gz	IVEDLTUHRODLNT-WOJBJXKFSA-N	0	3	336.479	3.173	20	30		EGEDHN
CC(F)(F)CC(=O)N1CC[C@H]2[C@H](CCN2Cc2ccccc2C#N)C1	ZINC001036811126	1343746364	/nfs/dbraw/zinc/74/63/64/1343746364.db2.gz	LWQASZHFHOJXGB-SJORKVTESA-N	0	3	347.409	3.026	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@H]2[C@H](CCN2Cc2ccccc2C#N)C1	ZINC001036875491	1343813802	/nfs/dbraw/zinc/81/38/02/1343813802.db2.gz	BJZBVYCVAZSSIF-MSOLQXFVSA-N	0	3	325.456	3.027	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCC[C@H]1NC(=O)CC1CC1	ZINC001037148968	1344000104	/nfs/dbraw/zinc/00/01/04/1344000104.db2.gz	MDEWOGXAMXPWNM-RBUKOAKNSA-N	0	3	325.456	3.123	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCCC[C@H]2CNCc2nccs2)C1	ZINC001037237115	1344059897	/nfs/dbraw/zinc/05/98/97/1344059897.db2.gz	UGQKXZFJNVIGJI-GJZGRUSLSA-N	0	3	333.501	3.264	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCCC[C@@H]2CNCc2ocnc2C)CC1	ZINC001037237622	1344060645	/nfs/dbraw/zinc/06/06/45/1344060645.db2.gz	VQUSVSUOBYHGOC-MSOLQXFVSA-N	0	3	345.487	3.494	20	30		EGEDHN
CC(C)(C)C(=O)N[C@H]1CCCC[C@H]1CNCc1ccccc1C#N	ZINC001037265764	1344069923	/nfs/dbraw/zinc/06/99/23/1344069923.db2.gz	SNHWPJQFASRASJ-ROUUACIJSA-N	0	3	327.472	3.369	20	30		EGEDHN
N#Cc1cc(C(=O)NC[C@@H]2CCN2CCC2CCCCCC2)c[nH]1	ZINC001038175222	1344311495	/nfs/dbraw/zinc/31/14/95/1344311495.db2.gz	MZSKCECHIWEZAF-SFHVURJKSA-N	0	3	328.460	3.051	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CCN2C[C@@H]2CCC(F)(F)C2)CC1	ZINC001038668330	1344531862	/nfs/dbraw/zinc/53/18/62/1344531862.db2.gz	UEXJTOXDIWGEOQ-GDBMZVCRSA-N	0	3	326.431	3.359	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)[C@@H]1CCCc2sc(C)nc21	ZINC001038910054	1344647378	/nfs/dbraw/zinc/64/73/78/1344647378.db2.gz	KSFIJOBFMJREIC-LSDHHAIUSA-N	0	3	333.501	3.028	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1ccc(N(C)C(C)C)cc1	ZINC001039073298	1344754901	/nfs/dbraw/zinc/75/49/01/1344754901.db2.gz	LSIMRCGIBIJOTR-IBGZPJMESA-N	0	3	329.488	3.302	20	30		EGEDHN
CCC(=O)N1CCCC[C@H]1[C@H]1CCN(Cc2ccc(F)c(C#N)c2)C1	ZINC001039181177	1344878503	/nfs/dbraw/zinc/87/85/03/1344878503.db2.gz	SBXACWIOMZNROY-LPHOPBHVSA-N	0	3	343.446	3.310	20	30		EGEDHN
CC(=O)N1CCCC[C@@H]1[C@@H]1CCN(CC#Cc2cccc(Cl)c2)C1	ZINC001039188382	1344889874	/nfs/dbraw/zinc/88/98/74/1344889874.db2.gz	KRQZEPVLNFVQGO-UYAOXDASSA-N	0	3	344.886	3.414	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc3occc3c2)C1	ZINC001039209239	1344922046	/nfs/dbraw/zinc/92/20/46/1344922046.db2.gz	IQPWETUUCSCZNO-MOPGFXCFSA-N	0	3	336.435	3.383	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cn(C)c3ccccc23)C1	ZINC001039217263	1344934366	/nfs/dbraw/zinc/93/43/66/1344934366.db2.gz	GVMOIJPKCHNCMH-FXAWDEMLSA-N	0	3	349.478	3.128	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccn(C(C)C)c2C)C1	ZINC001039225453	1344944018	/nfs/dbraw/zinc/94/40/18/1344944018.db2.gz	OHNLKGZHTBDLOM-QUCCMNQESA-N	0	3	341.499	3.327	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2csc(C(C)C)n2)C1	ZINC001039232425	1344952632	/nfs/dbraw/zinc/95/26/32/1344952632.db2.gz	WDYCZVDUSNMYDE-RDJZCZTQSA-N	0	3	345.512	3.216	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc(F)ccc2Cl)C1	ZINC001039236428	1344958288	/nfs/dbraw/zinc/95/82/88/1344958288.db2.gz	BXPREALPDDGSPG-KBXCAEBGSA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2oc(C(C)C)nc2C)C1	ZINC001039236213	1344958330	/nfs/dbraw/zinc/95/83/30/1344958330.db2.gz	XNGMMMBTSJQJFZ-IAGOWNOFSA-N	0	3	343.471	3.056	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccc3c(c2)CCC3)C1	ZINC001039238415	1344962345	/nfs/dbraw/zinc/96/23/45/1344962345.db2.gz	IDLSTICVYVHRIV-NHCUHLMSSA-N	0	3	336.479	3.125	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc(C)ccc2F)C1	ZINC001039238412	1344962670	/nfs/dbraw/zinc/96/26/70/1344962670.db2.gz	NOFAMNOYTXBWGX-YLJYHZDGSA-N	0	3	342.458	3.474	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cccc(F)c2F)C1	ZINC001039242118	1344968078	/nfs/dbraw/zinc/96/80/78/1344968078.db2.gz	AEMNMLWWAMWWJD-YJBOKZPZSA-N	0	3	346.421	3.305	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cccc(Cl)c2)C1	ZINC001039244371	1344972258	/nfs/dbraw/zinc/97/22/58/1344972258.db2.gz	IIHPLLPIMYIRSQ-AEFFLSMTSA-N	0	3	330.859	3.290	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc3c(s2)CCC3)C1	ZINC001039249238	1344979638	/nfs/dbraw/zinc/97/96/38/1344979638.db2.gz	HGYBKWUEMISLKJ-SJORKVTESA-N	0	3	342.508	3.187	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(Cl)s2)C1	ZINC001039251642	1344982930	/nfs/dbraw/zinc/98/29/30/1344982930.db2.gz	WFYZQBPUWXMVTE-ZIAGYGMSSA-N	0	3	336.888	3.351	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cn(C(C)(C)C)nc1C	ZINC001039373547	1345032302	/nfs/dbraw/zinc/03/23/02/1345032302.db2.gz	ZOWWOUJFKNBEGK-SJORKVTESA-N	0	3	344.503	3.202	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C1(Cc2ccccc2)CC1	ZINC001039388029	1345040348	/nfs/dbraw/zinc/04/03/48/1345040348.db2.gz	WQANULQWIOVSCJ-UXHICEINSA-N	0	3	336.479	3.098	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(-c2cnco2)cc1	ZINC001039394330	1345043280	/nfs/dbraw/zinc/04/32/80/1345043280.db2.gz	RKMZPOPBLXBQIZ-MOPGFXCFSA-N	0	3	349.434	3.044	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CCCCC1(F)F	ZINC001039410329	1345053065	/nfs/dbraw/zinc/05/30/65/1345053065.db2.gz	DVBAWHWOPQAOQF-PMPSAXMXSA-N	0	3	326.431	3.453	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(C)c(Cl)c1F	ZINC001039409757	1345053209	/nfs/dbraw/zinc/05/32/09/1345053209.db2.gz	HFIQTVQMZRGQKV-CABCVRRESA-N	0	3	348.849	3.490	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1c(C)cc(F)cc1C	ZINC001039415617	1345056737	/nfs/dbraw/zinc/05/67/37/1345056737.db2.gz	MPRWZXMJHQZJFI-MSOLQXFVSA-N	0	3	328.431	3.145	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)c1ccc(CC)cc1	ZINC001039452490	1345075117	/nfs/dbraw/zinc/07/51/17/1345075117.db2.gz	YRXINYBGOKQFKQ-WMQCIHAUSA-N	0	3	338.495	3.441	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccn1C1CCCC1	ZINC001039455833	1345077034	/nfs/dbraw/zinc/07/70/34/1345077034.db2.gz	UKTIGBKGVZINPQ-MOPGFXCFSA-N	0	3	339.483	3.305	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccc(COC)c1	ZINC001039459887	1345078892	/nfs/dbraw/zinc/07/88/92/1345078892.db2.gz	OMCUKSLSBZSOBJ-UXHICEINSA-N	0	3	342.483	3.017	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(C)c(F)cc1Cl	ZINC001039463734	1345081621	/nfs/dbraw/zinc/08/16/21/1345081621.db2.gz	FALVHKUTOYHTJJ-CABCVRRESA-N	0	3	348.849	3.490	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(OC(C)C)cc1	ZINC001039465894	1345083382	/nfs/dbraw/zinc/08/33/82/1345083382.db2.gz	GBKJOLQXSJINQS-MOPGFXCFSA-N	0	3	340.467	3.176	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)CCc1ccc(OC)cc1	ZINC001039467321	1345085393	/nfs/dbraw/zinc/08/53/93/1345085393.db2.gz	DOUHAHGFAMDTFH-MOPGFXCFSA-N	0	3	342.483	3.269	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc2c(c1)CCC2	ZINC001039469491	1345086806	/nfs/dbraw/zinc/08/68/06/1345086806.db2.gz	LCKPQGKSJDXMPW-RTWAWAEBSA-N	0	3	338.495	3.359	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CCC[C@@H](C2)N3C[C@@H]2CCO[C@@H](C)C2)C1	ZINC001039906204	1345243737	/nfs/dbraw/zinc/24/37/37/1345243737.db2.gz	JBEPRSZZLLEWKD-ZSYWTGECSA-N	0	3	346.515	3.223	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1C[C@H]2CCC[C@@H](C1)N2CCC(=C)C	ZINC001039984393	1345279944	/nfs/dbraw/zinc/27/99/44/1345279944.db2.gz	YKTAKEUSFBMDSY-OYRHEFFESA-N	0	3	336.479	3.242	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ccc(C(C)C)nc3)C2)C1	ZINC001040239927	1345390086	/nfs/dbraw/zinc/39/00/86/1345390086.db2.gz	AZUXLYCILGEBQA-NRFANRHFSA-N	0	3	339.483	3.156	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cccnc3C(F)F)C2)C1	ZINC001040292160	1345416146	/nfs/dbraw/zinc/41/61/46/1345416146.db2.gz	RGGQTLZBSFFWKN-GOSISDBHSA-N	0	3	335.398	3.133	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CC[C@@]2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001040327800	1345434348	/nfs/dbraw/zinc/43/43/48/1345434348.db2.gz	IFDSTDDTQVEXMO-QUCCMNQESA-N	0	3	343.446	3.121	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@@H](C)c3cccs3)C2)C1	ZINC001040390191	1345471786	/nfs/dbraw/zinc/47/17/86/1345471786.db2.gz	HMBGPQFMWCYYQW-LPHOPBHVSA-N	0	3	330.497	3.189	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@@H]3C[C@H]3c3ccccc3C)C2)C1	ZINC001040443667	1345503305	/nfs/dbraw/zinc/50/33/05/1345503305.db2.gz	KMNYXGAYHOBZCS-TUNNFDKTSA-N	0	3	336.479	3.046	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3scnc3C(C)C)C2)C1	ZINC001040444974	1345503447	/nfs/dbraw/zinc/50/34/47/1345503447.db2.gz	ZSUXMGNCJKFIKB-GOSISDBHSA-N	0	3	333.501	3.381	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3ccc4nc(C)ccc4c3)C2)C1	ZINC001040461014	1345509695	/nfs/dbraw/zinc/50/96/95/1345509695.db2.gz	UTVYGHHJBRJIOM-JOCHJYFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3cccn3C3CCCC3)C2)C1	ZINC001040464695	1345510482	/nfs/dbraw/zinc/51/04/82/1345510482.db2.gz	OXNJADUNPUSIFR-OAQYLSRUSA-N	0	3	339.483	3.165	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3c(C)nn(CCC)c3C)C2)C1	ZINC001040484821	1345516158	/nfs/dbraw/zinc/51/61/58/1345516158.db2.gz	RULQOBKCDPPBEC-HXUWFJFHSA-N	0	3	344.503	3.024	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3oc(CC)cc3C)C2)C1	ZINC001040493618	1345520011	/nfs/dbraw/zinc/52/00/11/1345520011.db2.gz	OVYWBVFWXSOLKY-FQEVSTJZSA-N	0	3	328.456	3.102	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cccc(Cl)c3)C2)C1	ZINC001040503503	1345523145	/nfs/dbraw/zinc/52/31/45/1345523145.db2.gz	UPLQFTIZPAZBEW-IBGZPJMESA-N	0	3	330.859	3.291	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)C(C)(C)C(C)(F)F)C2)C1	ZINC001040513486	1345527568	/nfs/dbraw/zinc/52/75/68/1345527568.db2.gz	NBCKCJMIFDKYTL-SFHVURJKSA-N	0	3	326.431	3.006	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)C[C@H](C)c3ccc(F)cc3)C2)C1	ZINC001040538586	1345536863	/nfs/dbraw/zinc/53/68/63/1345536863.db2.gz	KDXVVQWTKKYUNQ-UWJYYQICSA-N	0	3	342.458	3.267	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001040612313	1345555626	/nfs/dbraw/zinc/55/56/26/1345555626.db2.gz	ALUPFLVGEAQAFW-KRWDZBQOSA-N	0	3	339.483	3.419	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC2(C1)CCN(Cc1cnoc1C)CC2	ZINC001040800291	1345579377	/nfs/dbraw/zinc/57/93/77/1345579377.db2.gz	GYBDDNQKZIJEMO-UHFFFAOYSA-N	0	3	331.460	3.010	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@H](C)c3ccsc3)C2)CC1	ZINC001040847649	1345587618	/nfs/dbraw/zinc/58/76/18/1345587618.db2.gz	UXASXSVCIWFWCX-MRXNPFEDSA-N	0	3	330.497	3.189	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3sc(C)cc3OC)C2)CC1	ZINC001040874437	1345592088	/nfs/dbraw/zinc/59/20/88/1345592088.db2.gz	GQUSCVUODOHZCN-UHFFFAOYSA-N	0	3	346.496	3.017	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccc4ccccc4n3)C2)CC1	ZINC001040920284	1345600424	/nfs/dbraw/zinc/60/04/24/1345600424.db2.gz	LSKWSKQCAWDPNK-UHFFFAOYSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)C3CCC(C(F)F)CC3)C2)CC1	ZINC001040924014	1345601354	/nfs/dbraw/zinc/60/13/54/1345601354.db2.gz	HHOBAYPQLLBELG-UHFFFAOYSA-N	0	3	338.442	3.006	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3c(F)cccc3Cl)C2)CC1	ZINC001040923394	1345601752	/nfs/dbraw/zinc/60/17/52/1345601752.db2.gz	NHWACGQMAPEEKF-UHFFFAOYSA-N	0	3	348.849	3.431	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cccc4c3CCC4)C2)CC1	ZINC001040951183	1345608293	/nfs/dbraw/zinc/60/82/93/1345608293.db2.gz	FPTYCPZGYWHDKA-UHFFFAOYSA-N	0	3	336.479	3.127	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)C3C4CC5CC(C4)CC3C5)C2)C1	ZINC001041361606	1345709640	/nfs/dbraw/zinc/70/96/40/1345709640.db2.gz	AYSNDSKQSLFXSR-DSVYFTGISA-N	0	3	340.511	3.006	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3coc4c3cccc4C)C2)C1	ZINC001041363711	1345709979	/nfs/dbraw/zinc/70/99/79/1345709979.db2.gz	VIQTWVSAMSPQLB-NRFANRHFSA-N	0	3	336.435	3.303	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@]3(CCN(C(=O)C4(C5CC5)CC4)C3)C2)cc1	ZINC001041385861	1345713067	/nfs/dbraw/zinc/71/30/67/1345713067.db2.gz	GRSAFXCIVNCUGJ-NRFANRHFSA-N	0	3	349.478	3.173	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)Cc3ccc(C)c(Cl)c3)C2)C1	ZINC001041401705	1345718145	/nfs/dbraw/zinc/71/81/45/1345718145.db2.gz	DMMPNNAFZQQKPH-HXUWFJFHSA-N	0	3	344.886	3.139	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)[C@@H](c3ccccc3)C3CC3)C2)C1	ZINC001041463630	1345734956	/nfs/dbraw/zinc/73/49/56/1345734956.db2.gz	IEKXVLWIWDMQJO-RBBKRZOGSA-N	0	3	336.479	3.128	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3nc4ccccc4cc3C)C2)C1	ZINC001041488821	1345742946	/nfs/dbraw/zinc/74/29/46/1345742946.db2.gz	LCBGJYUSZDKLQU-QFIPXVFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@]2(CCN(Cc3cnc(C)s3)C2)C1	ZINC001041536828	1345755274	/nfs/dbraw/zinc/75/52/74/1345755274.db2.gz	RPPASMCBCZWUEQ-LJQANCHMSA-N	0	3	347.528	3.478	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@]2(CCN(Cc3ncccc3C)C2)C1	ZINC001041542381	1345757457	/nfs/dbraw/zinc/75/74/57/1345757457.db2.gz	CEDONLNJGYWKOY-HXUWFJFHSA-N	0	3	327.472	3.027	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3ccc(-c4ccccc4)o3)C2)C1	ZINC001041706897	1345824821	/nfs/dbraw/zinc/82/48/21/1345824821.db2.gz	GHAPFQADIDTCNM-NRFANRHFSA-N	0	3	334.419	3.118	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cccc(F)c3Cl)C2)C1	ZINC001041710224	1345826243	/nfs/dbraw/zinc/82/62/43/1345826243.db2.gz	LJQICWPNJQHTBB-GOSISDBHSA-N	0	3	334.822	3.040	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)[C@H](c3ccccc3)C(C)C)C2)C1	ZINC001041711791	1345826844	/nfs/dbraw/zinc/82/68/44/1345826844.db2.gz	ILCWIQXBSZITJD-RBBKRZOGSA-N	0	3	338.495	3.374	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001041720940	1345831983	/nfs/dbraw/zinc/83/19/83/1345831983.db2.gz	YMDFRTRMQRILOA-DYESRHJHSA-N	0	3	339.483	3.275	20	30		EGEDHN
C=CCN1CC[C@@]2(CCN(C(=O)c3ncoc3-c3cccs3)C2)C1	ZINC001041744713	1345838871	/nfs/dbraw/zinc/83/88/71/1345838871.db2.gz	JFIXZLXSCAHZSH-GOSISDBHSA-N	0	3	343.452	3.127	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3ccc(-c4ccco4)s3)C2)C1	ZINC001041766734	1345843301	/nfs/dbraw/zinc/84/33/01/1345843301.db2.gz	AERZGBRHVXWQSX-IBGZPJMESA-N	0	3	340.448	3.179	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)[C@@H](C)c3cc4ccccc4o3)C2)C1	ZINC001041780630	1345847538	/nfs/dbraw/zinc/84/75/38/1345847538.db2.gz	CGZQJTKTPOQTNJ-KKSFZXQISA-N	0	3	336.435	3.094	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccc(F)cc3Cl)C2)C1	ZINC001041813884	1345860181	/nfs/dbraw/zinc/86/01/81/1345860181.db2.gz	IGDGAWBBWBXYJW-GOSISDBHSA-N	0	3	334.822	3.040	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccc(OC(C)C)cc3)C2)C1	ZINC001041816880	1345861451	/nfs/dbraw/zinc/86/14/51/1345861451.db2.gz	RBXFFAZOTUBZFG-OAQYLSRUSA-N	0	3	340.467	3.035	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3sccc3C(C)C)C2)C1	ZINC001041842677	1345869897	/nfs/dbraw/zinc/86/98/97/1345869897.db2.gz	AFFBMGOYFFPLKN-LJQANCHMSA-N	0	3	330.497	3.433	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3CCN(C(=O)CCC4CC4)C[C@H]32)c1	ZINC001041984983	1345913516	/nfs/dbraw/zinc/91/35/16/1345913516.db2.gz	LNUVEAXRHPMICN-VQTJNVASSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3c(F)ccc4ccncc43)C[C@H]21	ZINC001042067603	1345935008	/nfs/dbraw/zinc/93/50/08/1345935008.db2.gz	RDNBVHZPOUUJDE-CRAIPNDOSA-N	0	3	339.414	3.096	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3nccc4ccsc43)C[C@H]21	ZINC001042101712	1345944350	/nfs/dbraw/zinc/94/43/50/1345944350.db2.gz	XQIAYNTXZYMUNP-DZGCQCFKSA-N	0	3	327.453	3.019	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3CCN(C(=O)C4(C5CC5)CC4)C[C@H]32)c1	ZINC001042107510	1345945619	/nfs/dbraw/zinc/94/56/19/1345945619.db2.gz	RKXJGNVQESPXLQ-AZUAARDMSA-N	0	3	349.478	3.171	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3CCN(C(=O)C4(C5CC5)CC4)C[C@H]32)cc1	ZINC001042106389	1345945688	/nfs/dbraw/zinc/94/56/88/1345945688.db2.gz	BWPQBYMMVYBUKT-AZUAARDMSA-N	0	3	349.478	3.171	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)Cc3c(C)cccc3Cl)C[C@H]21	ZINC001042136639	1345953194	/nfs/dbraw/zinc/95/31/94/1345953194.db2.gz	VTDGIFIXPRJYRG-QFBILLFUSA-N	0	3	344.886	3.137	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cnc4c(F)cccc4c3)C[C@@H]21	ZINC001042153502	1345957581	/nfs/dbraw/zinc/95/75/81/1345957581.db2.gz	SUGOZBVMSGQWKZ-KDOFPFPSSA-N	0	3	339.414	3.096	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)CCc3cccc(Cl)c3)C[C@H]21	ZINC001042168278	1345963924	/nfs/dbraw/zinc/96/39/24/1345963924.db2.gz	UOAPFGCVKKEXKQ-PKOBYXMFSA-N	0	3	344.886	3.219	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3cncc(C)c3)[C@@H]2C1	ZINC001042182040	1345969968	/nfs/dbraw/zinc/96/99/68/1345969968.db2.gz	BNGGXNYRAQTKGQ-RBUKOAKNSA-N	0	3	341.499	3.415	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]2CCN(CCC(F)(F)F)[C@@H]2C1	ZINC001042183752	1345971475	/nfs/dbraw/zinc/97/14/75/1345971475.db2.gz	MGZGLHJNEVGQEA-UONOGXRCSA-N	0	3	332.410	3.464	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3c(C)cc(F)cc3C)C[C@@H]21	ZINC001042184000	1345971770	/nfs/dbraw/zinc/97/17/70/1345971770.db2.gz	SHMLDWVVTYMLEM-AEFFLSMTSA-N	0	3	328.431	3.002	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3cnccc3C)[C@@H]2C1	ZINC001042186837	1345974346	/nfs/dbraw/zinc/97/43/46/1345974346.db2.gz	JVPPKDRPMFGQAE-SJLPKXTDSA-N	0	3	327.472	3.025	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)Cc3c(C)cc(C)cc3C)C[C@@H]21	ZINC001042212297	1345987384	/nfs/dbraw/zinc/98/73/84/1345987384.db2.gz	BBFVQQDJWLADBK-FPOVZHCZSA-N	0	3	338.495	3.100	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]3CCN(CCC(F)(F)F)[C@@H]3C2)C1	ZINC001042224610	1345995085	/nfs/dbraw/zinc/99/50/85/1345995085.db2.gz	PUNMXSBQTYNEHZ-UONOGXRCSA-N	0	3	330.394	3.218	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]3CCN(CCC(F)(F)F)[C@H]3C2)C1	ZINC001042224609	1345995491	/nfs/dbraw/zinc/99/54/91/1345995491.db2.gz	PUNMXSBQTYNEHZ-KGLIPLIRSA-N	0	3	330.394	3.218	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3CCN(C(=O)C4CC5(CC5)C4)C[C@@H]32)cc1	ZINC001042232059	1345998136	/nfs/dbraw/zinc/99/81/36/1345998136.db2.gz	IQYIMNZVCUVOSW-ICSRJNTNSA-N	0	3	349.478	3.171	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(C(C)C)nc3C)C[C@H]21	ZINC001042238318	1346000150	/nfs/dbraw/zinc/00/01/50/1346000150.db2.gz	RSEAYRFEBBRANY-QFBILLFUSA-N	0	3	327.472	3.236	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc4cc(F)ccc4o3)C[C@H]21	ZINC001042251755	1346006220	/nfs/dbraw/zinc/00/62/20/1346006220.db2.gz	GPGAADIUYPNTSZ-XJKSGUPXSA-N	0	3	328.387	3.294	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(Cl)c(OC)c3)C[C@@H]21	ZINC001042257764	1346008324	/nfs/dbraw/zinc/00/83/24/1346008324.db2.gz	LSGGWEORRNUSTO-CJNGLKHVSA-N	0	3	334.847	3.071	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3cnc(C(C)C)nc3C)C[C@@H]21	ZINC001042259163	1346009179	/nfs/dbraw/zinc/00/91/79/1346009179.db2.gz	FUZRBPHMTJCXGO-AEFFLSMTSA-N	0	3	342.487	3.021	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C34CCC(CC3)C4(C)C)C[C@H]21	ZINC001042262912	1346010267	/nfs/dbraw/zinc/01/02/67/1346010267.db2.gz	QIEMNLBMSFGTJG-BXAPWLEFSA-N	0	3	328.500	3.149	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)Cn3cc(C)c4ccccc43)C[C@@H]21	ZINC001042262087	1346010509	/nfs/dbraw/zinc/01/05/09/1346010509.db2.gz	FREFOZSKRWDGEK-PXNSSMCTSA-N	0	3	337.467	3.059	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C(C)(C)c3ccc(F)cc3)C[C@H]21	ZINC001042317108	1346030607	/nfs/dbraw/zinc/03/06/07/1346030607.db2.gz	WENBHSXCLMHWEO-MAUKXSAKSA-N	0	3	330.447	3.212	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccsc3C(F)F)C[C@H]21	ZINC001042334547	1346041381	/nfs/dbraw/zinc/04/13/81/1346041381.db2.gz	GJQRMONTUKXXRJ-DGCLKSJQSA-N	0	3	326.412	3.408	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccccc3OCC3CC3)C[C@@H]21	ZINC001042367833	1346059552	/nfs/dbraw/zinc/05/95/52/1346059552.db2.gz	MBOISDIVMHMWEL-HKUYNNGSSA-N	0	3	340.467	3.198	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@H](NCc2cc(F)ccc2C#N)C[C@@H]1C	ZINC001044433951	1346329682	/nfs/dbraw/zinc/32/96/82/1346329682.db2.gz	VPQJRPCYXFMZDR-KSSFIOAISA-N	0	3	329.419	3.133	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)c1cccs1	ZINC001044442358	1346333523	/nfs/dbraw/zinc/33/35/23/1346333523.db2.gz	KRLIYFYHXZZYGX-PBHICJAKSA-N	0	3	339.464	3.403	20	30		EGEDHN
Cc1ccoc1C(=O)N1CC[C@@H](NCc2ccccc2C#N)C[C@@H]1C	ZINC001044468673	1346342012	/nfs/dbraw/zinc/34/20/12/1346342012.db2.gz	SAKMPWZUWLDUJJ-MAUKXSAKSA-N	0	3	337.423	3.243	20	30		EGEDHN
Cc1ccoc1C(=O)N1CC[C@@H](NCc2ccccc2C#N)C[C@H]1C	ZINC001044468672	1346342095	/nfs/dbraw/zinc/34/20/95/1346342095.db2.gz	SAKMPWZUWLDUJJ-CRAIPNDOSA-N	0	3	337.423	3.243	20	30		EGEDHN
C[C@H]1C[C@H]([NH2+]Cc2ccc(C#N)cc2)CCN1C(=O)c1ccccc1[O-]	ZINC001044477225	1346344032	/nfs/dbraw/zinc/34/40/32/1346344032.db2.gz	ZXNACIYOXXQECJ-MAUKXSAKSA-N	0	3	349.434	3.047	20	30		EGEDHN
C[C@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)CC1(C)CC1	ZINC001044690789	1346404365	/nfs/dbraw/zinc/40/43/65/1346404365.db2.gz	XRZWCVJRVLRQIR-YJBOKZPZSA-N	0	3	325.456	3.218	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)CC2CCCC2)s1	ZINC001044905795	1346459957	/nfs/dbraw/zinc/45/99/57/1346459957.db2.gz	XZJAYIGPKIRLNV-HNNXBMFYSA-N	0	3	331.485	3.281	20	30		EGEDHN
CCC(CC)C(=O)N1CCC[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC001044929415	1346465023	/nfs/dbraw/zinc/46/50/23/1346465023.db2.gz	YJMVAUUIBIUCNM-KRWDZBQOSA-N	0	3	331.435	3.214	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC[C@H]1CNCc1ccc(Cl)cc1Cl	ZINC001044959714	1346470114	/nfs/dbraw/zinc/47/01/14/1346470114.db2.gz	CKTCLAQBFBUWFT-FZMZJTMJSA-N	0	3	340.254	3.234	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)c2sccc2F)s1	ZINC001045021312	1346481572	/nfs/dbraw/zinc/48/15/72/1346481572.db2.gz	UJOBXLYXCLXKOP-NSHDSACASA-N	0	3	349.456	3.215	20	30		EGEDHN
C[C@@H](NC[C@@H]1CCCN1C(=O)C#CC1CC1)c1ccc(F)cc1F	ZINC001045028680	1346483442	/nfs/dbraw/zinc/48/34/42/1346483442.db2.gz	HDKIORFHKXLTGX-CJNGLKHVSA-N	0	3	332.394	3.020	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)[C@@H]2CCCC23CC3)s1	ZINC001045091267	1346493042	/nfs/dbraw/zinc/49/30/42/1346493042.db2.gz	SETCNLVJRDEWSM-YOEHRIQHSA-N	0	3	343.496	3.281	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC001045149300	1346506694	/nfs/dbraw/zinc/50/66/94/1346506694.db2.gz	YUPVHVYAXPZJEP-KRWDZBQOSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]2CNCc2cc(F)cc(F)c2)C1	ZINC001045190454	1346524421	/nfs/dbraw/zinc/52/44/21/1346524421.db2.gz	DKNZGILXDKSLBG-KRWDZBQOSA-N	0	3	334.410	3.402	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]2CNCc2cnn(C(C)(C)C)c2)C1	ZINC001045190450	1346524468	/nfs/dbraw/zinc/52/44/68/1346524468.db2.gz	DGRLFFYSILUJQR-KRWDZBQOSA-N	0	3	344.503	3.075	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)[C@H]2C[C@@H]2c2cc(F)ccc2F)CC1	ZINC001045644502	1346657143	/nfs/dbraw/zinc/65/71/43/1346657143.db2.gz	KKBMOQHIRKYOAH-WBVHZDCISA-N	0	3	346.421	3.062	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)C[C@@H]1C=CCCC1)C2	ZINC001045947942	1346783408	/nfs/dbraw/zinc/78/34/08/1346783408.db2.gz	QCUPNACVAUCZHE-CTNGQTDRSA-N	0	3	328.500	3.461	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc(C)cc(C)n1)C2	ZINC001045948815	1346783968	/nfs/dbraw/zinc/78/39/68/1346783968.db2.gz	RSSZNYYSHWZSLO-OAQYLSRUSA-N	0	3	339.483	3.040	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc(CC)s1)C2	ZINC001045951103	1346786297	/nfs/dbraw/zinc/78/62/97/1346786297.db2.gz	UFHRGWLKTPMROP-IBGZPJMESA-N	0	3	330.497	3.262	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc(C(C)C)on1)C2	ZINC001045954671	1346789244	/nfs/dbraw/zinc/78/92/44/1346789244.db2.gz	GNWNELGGDCDHTH-FQEVSTJZSA-N	0	3	343.471	3.140	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc(F)c(Cl)c1)C2	ZINC001045960096	1346794937	/nfs/dbraw/zinc/79/49/37/1346794937.db2.gz	FWAXUYWSOXZYJS-LJQANCHMSA-N	0	3	348.849	3.431	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1occc1Cl)C2	ZINC001045964229	1346799816	/nfs/dbraw/zinc/79/98/16/1346799816.db2.gz	DEHCMJATZIWJLU-GOSISDBHSA-N	0	3	334.847	3.275	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)CCc1cccs1)C2	ZINC001045983917	1346824629	/nfs/dbraw/zinc/82/46/29/1346824629.db2.gz	SHVAYFAUIRWZKV-FQEVSTJZSA-N	0	3	344.524	3.409	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)CCc1cccs1)C2	ZINC001045983919	1346824671	/nfs/dbraw/zinc/82/46/71/1346824671.db2.gz	SHVAYFAUIRWZKV-HXUWFJFHSA-N	0	3	344.524	3.409	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1coc3ccccc13)C2	ZINC001045987301	1346829097	/nfs/dbraw/zinc/82/90/97/1346829097.db2.gz	NIQUGQCFHDNHMQ-NRFANRHFSA-N	0	3	336.435	3.384	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)[C@@H]2CC[C@H](c3ccccc3)O2)C1	ZINC001046326474	1346935575	/nfs/dbraw/zinc/93/55/75/1346935575.db2.gz	NUZNSPGYAZFMHK-WSTZPKSXSA-N	0	3	328.456	3.063	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2cc(C)n(C(CC)CC)n2)C1	ZINC001046435336	1346974936	/nfs/dbraw/zinc/97/49/36/1346974936.db2.gz	CEGFFZNOVHEEFN-LJQANCHMSA-N	0	3	332.492	3.323	20	30		EGEDHN
C#CCCN1CC[C@@](C)(NC(=O)c2cc3cc(Cl)ccc3[nH]2)C1	ZINC001046530111	1347006176	/nfs/dbraw/zinc/00/61/76/1347006176.db2.gz	DWZZBFRMUQWMIK-GOSISDBHSA-N	0	3	329.831	3.039	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2cc(F)c(Cl)cc2F)C1	ZINC001046586676	1347027085	/nfs/dbraw/zinc/02/70/85/1347027085.db2.gz	SYDSDXMWTQQCTE-MRXNPFEDSA-N	0	3	328.790	3.389	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@]2(C)CCN([C@@H](C)c3ccccc3)C2)c1	ZINC001046605714	1347036364	/nfs/dbraw/zinc/03/63/64/1347036364.db2.gz	XADMKRQJDSOTEA-HRAATJIYSA-N	0	3	333.435	3.018	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2ccc(COC(C)C)cc2)C1	ZINC001046826602	1347120904	/nfs/dbraw/zinc/12/09/04/1347120904.db2.gz	DWEIBDKEEBEHFF-HXUWFJFHSA-N	0	3	330.472	3.382	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2cc(Cl)cc3c2OCC3)C1	ZINC001046859895	1347133915	/nfs/dbraw/zinc/13/39/15/1347133915.db2.gz	YQDOOSNCPBTVHY-GOSISDBHSA-N	0	3	334.847	3.045	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2ccc3cc[nH]c3c2)C1	ZINC001046978771	1347174758	/nfs/dbraw/zinc/17/47/58/1347174758.db2.gz	SGIYMSSCRRFQHQ-INIZCTEOSA-N	0	3	347.409	3.431	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)N(Cc2cncs2)C3)CC1	ZINC001047138995	1347217560	/nfs/dbraw/zinc/21/75/60/1347217560.db2.gz	IURIEUAXWCVGMY-UAGQMJEPSA-N	0	3	345.512	3.359	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)c3occc3C)C2)CC1	ZINC001047224017	1347254033	/nfs/dbraw/zinc/25/40/33/1347254033.db2.gz	ULHNOBIROAOIPR-GOSISDBHSA-N	0	3	328.456	3.176	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3c(C)oc(C)c3C)C2)CC1	ZINC001047250910	1347275647	/nfs/dbraw/zinc/27/56/47/1347275647.db2.gz	LACTWPWZMVRMOU-IBGZPJMESA-N	0	3	342.483	3.402	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)[C@H](C)c3ccco3)C2)CC1	ZINC001047254706	1347278794	/nfs/dbraw/zinc/27/87/94/1347278794.db2.gz	QXUCPGWKWLQWAR-MJGOQNOKSA-N	0	3	342.483	3.357	20	30		EGEDHN
C[C@H](NCc1cc(F)ccc1C#N)[C@H]1CCN(C(=O)C2CCCC2)C1	ZINC001047668972	1347322959	/nfs/dbraw/zinc/32/29/59/1347322959.db2.gz	YEELEUYXPSCJPT-YOEHRIQHSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)CC(C)(C)C)C1	ZINC001047717629	1347347541	/nfs/dbraw/zinc/34/75/41/1347347541.db2.gz	XWNAPJRBTZDETP-CRAIPNDOSA-N	0	3	327.472	3.321	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]([C@@H](C)NCc2cc(C3CC3)no2)C1	ZINC001047924103	1347411186	/nfs/dbraw/zinc/41/11/86/1347411186.db2.gz	LLXOEHZARAEZAG-GDBMZVCRSA-N	0	3	345.487	3.481	20	30		EGEDHN
CCC1(C(=O)N2CC[C@H]([C@H](C)NCc3ccccc3C#N)C2)CCC1	ZINC001047935807	1347416016	/nfs/dbraw/zinc/41/60/16/1347416016.db2.gz	JGZKSMJEGRPYRN-LPHOPBHVSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H]([C@@H](C)NCc3cc(C)no3)C2)CC1	ZINC001047960597	1347425172	/nfs/dbraw/zinc/42/51/72/1347425172.db2.gz	UNXRFYWWYUHEAT-WBVHZDCISA-N	0	3	331.460	3.056	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccccc2)C[C@@H]1CNCc1ccccc1C#N	ZINC001048111773	1347470239	/nfs/dbraw/zinc/47/02/39/1347470239.db2.gz	FJVZSTNFKZJHIT-UZLBHIALSA-N	0	3	333.435	3.056	20	30		EGEDHN
Cc1ccccc1C(=O)N1C[C@@H](C)[C@@H](CNCc2ccccc2C#N)C1	ZINC001048116186	1347472007	/nfs/dbraw/zinc/47/20/07/1347472007.db2.gz	DUCPTQPMTLQUKG-XLIONFOSSA-N	0	3	347.462	3.365	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CCCCC2)C[C@H]1CNCc1ccccc1C#N	ZINC001048118676	1347472636	/nfs/dbraw/zinc/47/26/36/1347472636.db2.gz	QGGUMCLQBPTVFV-OXQOHEQNSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@@H](CNCc2ncc(C)s2)C1	ZINC001048337487	1347521946	/nfs/dbraw/zinc/52/19/46/1347521946.db2.gz	DDLOPKYFECDDBJ-HIFRSBDPSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=C(C)CN1CCC(N(Cc2ccccn2)C(=O)C2CC(C)C2)CC1	ZINC001048625632	1347623920	/nfs/dbraw/zinc/62/39/20/1347623920.db2.gz	JAPUBPKRRQTOER-UHFFFAOYSA-N	0	3	341.499	3.497	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)[C@H]2CC23CCC3)CC1	ZINC001048626466	1347624550	/nfs/dbraw/zinc/62/45/50/1347624550.db2.gz	PHKABJKWVPBALR-LJQANCHMSA-N	0	3	339.483	3.251	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc4cc(C)ccc4s3)C[C@@H]2C1	ZINC001049147364	1347734114	/nfs/dbraw/zinc/73/41/14/1347734114.db2.gz	UTTLNZBWVVLZBL-CALCHBBNSA-N	0	3	338.476	3.237	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1c(C)noc1CCC	ZINC001049469218	1347864312	/nfs/dbraw/zinc/86/43/12/1347864312.db2.gz	AKMULBIXDRZHRU-HOTGVXAUSA-N	0	3	331.460	3.191	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(C(C)(C)C)cn1	ZINC001049488627	1347872299	/nfs/dbraw/zinc/87/22/99/1347872299.db2.gz	YYDHOAJHYZNQLZ-MSOLQXFVSA-N	0	3	327.472	3.244	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1scc(C)c1Cl	ZINC001049495180	1347876581	/nfs/dbraw/zinc/87/65/81/1347876581.db2.gz	OGQDRMCDBNJRCT-KGLIPLIRSA-N	0	3	336.888	3.412	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc2oc(C)nc2c1	ZINC001049542137	1347899666	/nfs/dbraw/zinc/89/96/66/1347899666.db2.gz	UKKJZGKVWWTPDP-DLBZAZTESA-N	0	3	325.412	3.001	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(C)n([C@@H](C)CC)n1	ZINC001049566056	1347912799	/nfs/dbraw/zinc/91/27/99/1347912799.db2.gz	ZMSDQRVGQDPGST-KFKAGJAMSA-N	0	3	344.503	3.418	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cn(CC)c2ccccc12	ZINC001049582977	1347921708	/nfs/dbraw/zinc/92/17/08/1347921708.db2.gz	RXAZOPQGWAHJGW-RTWAWAEBSA-N	0	3	349.478	3.363	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)CCc1cc2ccccc2o1	ZINC001049584453	1347922678	/nfs/dbraw/zinc/92/26/78/1347922678.db2.gz	RWFBBXICOBMMGS-OALUTQOASA-N	0	3	336.435	3.064	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(C)c2cccnc12	ZINC001049597943	1347929909	/nfs/dbraw/zinc/92/99/09/1347929909.db2.gz	HPXJOROIVFCCNZ-RBUKOAKNSA-N	0	3	335.451	3.408	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1csc(-c2ccco2)n1	ZINC001049677118	1347968055	/nfs/dbraw/zinc/96/80/55/1347968055.db2.gz	RSZNZLMXLVKKFT-CABCVRRESA-N	0	3	343.452	3.268	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]3[C@H]2CCN3Cc2cnccc2C)C1	ZINC001049706752	1347983464	/nfs/dbraw/zinc/98/34/64/1347983464.db2.gz	KEZLMWJQNPEHJC-RTBURBONSA-N	0	3	339.483	3.312	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]3[C@H]2CCN3Cc2cccc(C#N)c2)C1	ZINC001049708185	1347984532	/nfs/dbraw/zinc/98/45/32/1347984532.db2.gz	OQFYQNTYBOOVIQ-VQTJNVASSA-N	0	3	349.478	3.480	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(F)c(F)c(F)c1	ZINC001049743601	1347996721	/nfs/dbraw/zinc/99/67/21/1347996721.db2.gz	QOGWDPJHLMIYQI-CVEARBPZSA-N	0	3	338.373	3.359	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(OCC)c(C)c1	ZINC001049762432	1348007240	/nfs/dbraw/zinc/00/72/40/1348007240.db2.gz	OWTRWJCOTQERGL-RTBURBONSA-N	0	3	340.467	3.096	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1scnc1C(C)(C)C	ZINC001049772395	1348014007	/nfs/dbraw/zinc/01/40/07/1348014007.db2.gz	GTPYEYTZTQPZQD-LSDHHAIUSA-N	0	3	345.512	3.143	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C[C@H](C)c1ccccc1F	ZINC001049788938	1348022582	/nfs/dbraw/zinc/02/25/82/1348022582.db2.gz	SMBLGTPLIZQQES-FFZOFVMBSA-N	0	3	342.458	3.408	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)C(C)(C)c1ccccc1F	ZINC001049788819	1348022858	/nfs/dbraw/zinc/02/28/58/1348022858.db2.gz	RIDVDPGINXUBDU-ROUUACIJSA-N	0	3	330.447	3.355	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cccc(N2CCCC2)c1	ZINC001049805648	1348028372	/nfs/dbraw/zinc/02/83/72/1348028372.db2.gz	KRHJXPQALJLKAK-UXHICEINSA-N	0	3	339.483	3.152	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(C)nc1OCCC	ZINC001049810635	1348031567	/nfs/dbraw/zinc/03/15/67/1348031567.db2.gz	BYVQUXLXLJMSHB-QZTJIDSGSA-N	0	3	343.471	3.044	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1c[nH]c2cccc(C)c12	ZINC001049846817	1348055858	/nfs/dbraw/zinc/05/58/58/1348055858.db2.gz	NFQTUFJJZWHSAT-PMACEKPBSA-N	0	3	349.478	3.107	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)C1CCC(C(F)F)CC1	ZINC001049869437	1348074927	/nfs/dbraw/zinc/07/49/27/1348074927.db2.gz	GXUODFVDQYKJMU-CKUJCDMFSA-N	0	3	326.431	3.309	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(CC)c(C)s1	ZINC001049880491	1348085286	/nfs/dbraw/zinc/08/52/86/1348085286.db2.gz	BNIKTACCGCGFSE-IAGOWNOFSA-N	0	3	330.497	3.321	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)CCc1ccc(Cl)s1	ZINC001049892091	1348095597	/nfs/dbraw/zinc/09/55/97/1348095597.db2.gz	ZKBLJWBJCQODLE-GJZGRUSLSA-N	0	3	336.888	3.033	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1nsc2ccccc21	ZINC001049907704	1348105500	/nfs/dbraw/zinc/10/55/00/1348105500.db2.gz	FBDXXWJMPIIPRY-SJORKVTESA-N	0	3	341.480	3.090	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc2cccc(C)c2o1	ZINC001049918394	1348111822	/nfs/dbraw/zinc/11/18/22/1348111822.db2.gz	HMZNGZMVBPTJLG-QZTJIDSGSA-N	0	3	336.435	3.443	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)CCc1cc(C)sc1C	ZINC001049922929	1348114570	/nfs/dbraw/zinc/11/45/70/1348114570.db2.gz	JBIIUINKXXYAMU-RTBURBONSA-N	0	3	344.524	3.386	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)C1CC(c2ccccc2)C1	ZINC001049928043	1348118442	/nfs/dbraw/zinc/11/84/42/1348118442.db2.gz	ZYAHTIJQFFXDHG-JSRAGOMMSA-N	0	3	336.479	3.269	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@H]2CN(Cc3cccc(C#N)c3)C[C@H]21	ZINC001049958490	1348132495	/nfs/dbraw/zinc/13/24/95/1348132495.db2.gz	MLFHUTDULHUQSP-RBUKOAKNSA-N	0	3	325.456	3.027	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CCCN(C(=O)C4=CCCC4)[C@@H]3C2)c1	ZINC001050018634	1348156786	/nfs/dbraw/zinc/15/67/86/1348156786.db2.gz	LGKGHVDWICOSJB-VQTJNVASSA-N	0	3	335.451	3.091	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)CCc3ccc(Cl)cc3)[C@@H]2C1	ZINC001050104736	1348184738	/nfs/dbraw/zinc/18/47/38/1348184738.db2.gz	RUWSJKNIDRHIBO-FUHWJXTLSA-N	0	3	332.875	3.381	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)Cc3c(C)[nH]c4ccccc43)[C@@H]2C1	ZINC001050128007	1348190535	/nfs/dbraw/zinc/19/05/35/1348190535.db2.gz	DNDZDUKJJYKHTC-OXJNMPFZSA-N	0	3	337.467	3.128	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)Cc3ccc(F)cc3Cl)[C@@H]2C1	ZINC001050130963	1348191987	/nfs/dbraw/zinc/19/19/87/1348191987.db2.gz	MZANLHQLCLLTRM-WMLDXEAASA-N	0	3	336.838	3.130	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3ccc(OCC(C)C)cc3)[C@@H]2C1	ZINC001050197184	1348208276	/nfs/dbraw/zinc/20/82/76/1348208276.db2.gz	VPHWKCQKHWCTMF-AZUAARDMSA-N	0	3	342.483	3.444	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cccc4c3OCC4(C)C)[C@@H]2C1	ZINC001050214756	1348212818	/nfs/dbraw/zinc/21/28/18/1348212818.db2.gz	LJOQACMPCYHIOR-MAUKXSAKSA-N	0	3	340.467	3.079	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC[C@H](CN[C@H](C)c3ncccn3)CC2)C1	ZINC001050363210	1348239396	/nfs/dbraw/zinc/23/93/96/1348239396.db2.gz	QHJZVWJDRATOHX-BRWVUGGUSA-N	0	3	342.487	3.159	20	30		EGEDHN
C[C@H](c1ccc(Cl)cc1)N1CCC2(CN(C(=O)[C@@H](C)C#N)C2)CC1	ZINC001050458996	1348271024	/nfs/dbraw/zinc/27/10/24/1348271024.db2.gz	GQFHKYXOGRRSIQ-LSDHHAIUSA-N	0	3	345.874	3.485	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc(CCC)s3)C2)CC1	ZINC001050534941	1348285485	/nfs/dbraw/zinc/28/54/85/1348285485.db2.gz	VVQHKQVNBOFWTH-UHFFFAOYSA-N	0	3	330.497	3.262	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC2(C1)CCN(Cc1cccnc1)CC2	ZINC001050614238	1348303119	/nfs/dbraw/zinc/30/31/19/1348303119.db2.gz	SNXGCHJHALNDDA-UHFFFAOYSA-N	0	3	327.472	3.108	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC2(C1)CCN(Cc1cccnc1C)CC2	ZINC001050616519	1348303794	/nfs/dbraw/zinc/30/37/94/1348303794.db2.gz	BWEBJZLUPPHCBO-UHFFFAOYSA-N	0	3	327.472	3.027	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc(Cl)c(C)c3)C2)CC1	ZINC001050643463	1348313094	/nfs/dbraw/zinc/31/30/94/1348313094.db2.gz	COUAULHWEAQZMC-UHFFFAOYSA-N	0	3	330.859	3.210	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccsc3C(F)F)C2)CC1	ZINC001050740843	1348344952	/nfs/dbraw/zinc/34/49/52/1348344952.db2.gz	WJORCUFPVSBDNX-UHFFFAOYSA-N	0	3	338.423	3.247	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3sccc3C3CC3)C2)CC1	ZINC001050745588	1348346919	/nfs/dbraw/zinc/34/69/19/1348346919.db2.gz	YSJAKQQYSKCSNQ-UHFFFAOYSA-N	0	3	328.481	3.187	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C[C@@H](C)c3ccc(F)cc3)C2)CC1	ZINC001050762875	1348351387	/nfs/dbraw/zinc/35/13/87/1348351387.db2.gz	LBTDOPAVQINVEN-QGZVFWFLSA-N	0	3	342.458	3.267	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cnc(C(C)(C)C)s3)C2)CC1	ZINC001050768174	1348353234	/nfs/dbraw/zinc/35/32/34/1348353234.db2.gz	ZXVCSXHDNGXMNX-UHFFFAOYSA-N	0	3	345.512	3.002	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3ccncc3F)cccc2C1	ZINC001051284423	1348417959	/nfs/dbraw/zinc/41/79/59/1348417959.db2.gz	SJZLUXMSTQSTIK-UHFFFAOYSA-N	0	3	339.414	3.085	20	30		EGEDHN
C=C(C)CCN1CCN([C@@H]2CCN(C(=O)C(C)=C3CCCC3)C2)CC1	ZINC001052011781	1348496787	/nfs/dbraw/zinc/49/67/87/1348496787.db2.gz	YVETUSFEOYFNBJ-HXUWFJFHSA-N	0	3	345.531	3.062	20	30		EGEDHN
C=CCCN1CCN([C@H]2CCN(C(=O)C3(C)CCCCCC3)C2)CC1	ZINC001052037482	1348499073	/nfs/dbraw/zinc/49/90/73/1348499073.db2.gz	MGQUXYYXOAPJRB-IBGZPJMESA-N	0	3	347.547	3.142	20	30		EGEDHN
C=C(C)CCN1CCN([C@@H]2CCN(C(=O)C3(C)CCCCC3)C2)CC1	ZINC001052074494	1348501332	/nfs/dbraw/zinc/50/13/32/1348501332.db2.gz	FLJJNOHWZBRQPS-LJQANCHMSA-N	0	3	347.547	3.142	20	30		EGEDHN
N#Cc1ccc(C[N@H+]2CCC[C@H](NC(=O)c3ccccc3[O-])CC2)cc1	ZINC001052212459	1348513110	/nfs/dbraw/zinc/51/31/10/1348513110.db2.gz	SRMVUHOGOVARLF-SFHVURJKSA-N	0	3	349.434	3.048	20	30		EGEDHN
N#Cc1ccc(C[N@@H+]2CCC[C@H](NC(=O)c3ccccc3[O-])CC2)cc1	ZINC001052212459	1348513115	/nfs/dbraw/zinc/51/31/15/1348513115.db2.gz	SRMVUHOGOVARLF-SFHVURJKSA-N	0	3	349.434	3.048	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H](NC(=O)[C@@H]3CCC3(F)F)CC2)cc1	ZINC001052480907	1348551500	/nfs/dbraw/zinc/55/15/00/1348551500.db2.gz	FZAKTFMFWBCEPO-IRXDYDNUSA-N	0	3	347.409	3.074	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H](NC(=O)[C@H]3CCC3(F)F)CC2)cc1	ZINC001052480906	1348551635	/nfs/dbraw/zinc/55/16/35/1348551635.db2.gz	FZAKTFMFWBCEPO-IAGOWNOFSA-N	0	3	347.409	3.074	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@H](NC(=O)[C@H]3CCC3(F)F)CC2)c1	ZINC001052481581	1348551790	/nfs/dbraw/zinc/55/17/90/1348551790.db2.gz	PUOSIJNQWBWASJ-DLBZAZTESA-N	0	3	347.409	3.074	20	30		EGEDHN
C[C@H](C(=O)N[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1)C1CCC1	ZINC001052484732	1348553234	/nfs/dbraw/zinc/55/32/34/1348553234.db2.gz	RYJRFZUJUFWDAU-OXJNMPFZSA-N	0	3	339.483	3.465	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)Cc2ccc(CC(C)C)cc2)CC1	ZINC001052540214	1348571906	/nfs/dbraw/zinc/57/19/06/1348571906.db2.gz	ZFYMUXJSDLIZML-FQEVSTJZSA-N	0	3	326.484	3.032	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@H](NC(=O)[C@H]3C[C@H]4C[C@H]4C3)CC2)c1	ZINC001052643872	1348609344	/nfs/dbraw/zinc/60/93/44/1348609344.db2.gz	OHFPMXXPWXVNQC-FUMNGEBKSA-N	0	3	337.467	3.075	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)Cc2c(C)[nH]c3ccccc32)CC1	ZINC001052672747	1348624059	/nfs/dbraw/zinc/62/40/59/1348624059.db2.gz	YJCLXMPCMWUOCE-QGZVFWFLSA-N	0	3	337.467	3.013	20	30		EGEDHN
CC(=O)N1CCC[C@H]([C@H]2CCCN(Cc3ccc(C#N)cc3F)C2)C1	ZINC001052997535	1348794093	/nfs/dbraw/zinc/79/40/93/1348794093.db2.gz	RMCSOEFGLGCGNU-ROUUACIJSA-N	0	3	343.446	3.168	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCC[C@H]([C@H]2CCCN(CCF)C2)C1	ZINC001053029171	1348828635	/nfs/dbraw/zinc/82/86/35/1348828635.db2.gz	QFTWTGSZYZJQAG-ROUUACIJSA-N	0	3	347.478	3.208	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cccs2)C1	ZINC001053062912	1348874121	/nfs/dbraw/zinc/87/41/21/1348874121.db2.gz	FCMPCZNSKCKMON-DLBZAZTESA-N	0	3	330.497	3.478	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccoc2C)C1	ZINC001053065059	1348878123	/nfs/dbraw/zinc/87/81/23/1348878123.db2.gz	BOUZLZZDTAEPLR-PKOBYXMFSA-N	0	3	328.456	3.318	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2c(C)ccn2C)C1	ZINC001053084486	1348906369	/nfs/dbraw/zinc/90/63/69/1348906369.db2.gz	RMBKNHNWXCSPQH-RTBURBONSA-N	0	3	341.499	3.064	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)C2C=CC=CC=C2)C1	ZINC001053085131	1348906414	/nfs/dbraw/zinc/90/64/14/1348906414.db2.gz	CCROATSZKKZKFA-SFTDATJTSA-N	0	3	338.495	3.401	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(C)c(C)n2)C1	ZINC001053091560	1348917620	/nfs/dbraw/zinc/91/76/20/1348917620.db2.gz	NEIJKMAJOFMQHX-ICSRJNTNSA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(C)c(C)cn2)C1	ZINC001053092292	1348919453	/nfs/dbraw/zinc/91/94/53/1348919453.db2.gz	QSLFXZOADOTGCB-QUCCMNQESA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2occc2Cl)C1	ZINC001053096913	1348927446	/nfs/dbraw/zinc/92/74/46/1348927446.db2.gz	BFABDFPRSMDYOO-GOEBONIOSA-N	0	3	334.847	3.273	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(C)ccc2F)C1	ZINC001053097562	1348928372	/nfs/dbraw/zinc/92/83/72/1348928372.db2.gz	GQARYQICTPHEQW-XLIONFOSSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)Cc2ccsc2C)C1	ZINC001053100788	1348934372	/nfs/dbraw/zinc/93/43/72/1348934372.db2.gz	IVSVSXGQLALWRM-OALUTQOASA-N	0	3	344.524	3.325	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2c[nH]cc2C)C1	ZINC001053107414	1348946192	/nfs/dbraw/zinc/94/61/92/1348946192.db2.gz	HMFSWUJJXUJFPW-PKOBYXMFSA-N	0	3	327.472	3.053	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H](c1ccccc1)C1CC1)C2	ZINC001054163938	1349166416	/nfs/dbraw/zinc/16/64/16/1349166416.db2.gz	UVILWJMTCOPABJ-UNMCSNQZSA-N	0	3	336.479	3.128	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@H](c1ccccc1)C1CC1)C2	ZINC001054163935	1349166646	/nfs/dbraw/zinc/16/66/46/1349166646.db2.gz	UVILWJMTCOPABJ-IFMALSPDSA-N	0	3	336.479	3.128	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)CCc1cccc(C)c1)C2	ZINC001054172058	1349173242	/nfs/dbraw/zinc/17/32/42/1349173242.db2.gz	FSNIVGKBDGMXRN-QFIPXVFZSA-N	0	3	338.495	3.265	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@]2(CCN(CCC(F)(F)F)C2)C1	ZINC001054174950	1349176362	/nfs/dbraw/zinc/17/63/62/1349176362.db2.gz	DQSZMLZCLJNXQE-MRXNPFEDSA-N	0	3	332.410	3.466	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cccc(Cl)c1F)C2	ZINC001054185615	1349188652	/nfs/dbraw/zinc/18/86/52/1349188652.db2.gz	GJOBDGQBTDPFBL-IBGZPJMESA-N	0	3	348.849	3.431	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)C(C1CCC1)C1CCC1)C2	ZINC001054186397	1349189443	/nfs/dbraw/zinc/18/94/43/1349189443.db2.gz	RJCGVLYXPPLGOB-OAQYLSRUSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@H](C)c1ccc(C)s1)C2	ZINC001054227113	1349220660	/nfs/dbraw/zinc/22/06/60/1349220660.db2.gz	IEWCGQLMVGDMIT-YLJYHZDGSA-N	0	3	344.524	3.498	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(F)cc1Cl)C2	ZINC001054235913	1349228405	/nfs/dbraw/zinc/22/84/05/1349228405.db2.gz	DNMHUJJWXQDAAB-IBGZPJMESA-N	0	3	348.849	3.431	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@H](C)Cc1ccccc1)C2	ZINC001054243431	1349236544	/nfs/dbraw/zinc/23/65/44/1349236544.db2.gz	HMBMQUZZGIVVOJ-KNQAVFIVSA-N	0	3	338.495	3.203	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(C)c3c1CCC3)C2	ZINC001054245758	1349239719	/nfs/dbraw/zinc/23/97/19/1349239719.db2.gz	BBPGODPYACFWGH-QFIPXVFZSA-N	0	3	336.479	3.045	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)CC(C1CC1)C1CC1)C2	ZINC001054246052	1349240204	/nfs/dbraw/zinc/24/02/04/1349240204.db2.gz	LSJFDLYTJANLFA-OAQYLSRUSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@]1(C)CCC(C)=C(C)C1)C2	ZINC001054246860	1349242062	/nfs/dbraw/zinc/24/20/62/1349242062.db2.gz	KWEXHCRCXFCZHM-SFTDATJTSA-N	0	3	328.500	3.461	20	30		EGEDHN
C#Cc1ccc(C(=O)NCc2ccc3c(c2)CN(CCCC)C3)cn1	ZINC001054290683	1349295285	/nfs/dbraw/zinc/29/52/85/1349295285.db2.gz	SRQBOWBNPKXFDP-UHFFFAOYSA-N	0	3	333.435	3.109	20	30		EGEDHN
CCC(CC)C(=O)N1C[C@H](NCc2ccc(C#N)c(F)c2)[C@@H](C)C1	ZINC001054410461	1349353238	/nfs/dbraw/zinc/35/32/38/1349353238.db2.gz	JFNQJIVSQAMMFE-UGSOOPFHSA-N	0	3	331.435	3.070	20	30		EGEDHN
Cc1cscc1C(=O)N1C[C@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001054536656	1349388845	/nfs/dbraw/zinc/38/88/45/1349388845.db2.gz	FDTXPQJSDLBYCR-MEDUHNTESA-N	0	3	345.493	3.240	20	30		EGEDHN
C[C@@H]1CN(C(=O)C23CCC(CC2)C3)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054800680	1349466901	/nfs/dbraw/zinc/46/69/01/1349466901.db2.gz	AQTLTUDUWICGIR-LRVIOQCDSA-N	0	3	343.496	3.137	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@H](NCc2ccc(Cl)nc2)C1	ZINC001054970978	1349532143	/nfs/dbraw/zinc/53/21/43/1349532143.db2.gz	KQJKCTRJSLIABW-UKRRQHHQSA-N	0	3	335.879	3.274	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)CCC1CCCC1)C[C@@H](C)O2	ZINC001071126327	1354466242	/nfs/dbraw/zinc/46/62/42/1354466242.db2.gz	BIHCAYUGTPWQBF-XLIONFOSSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1cccc(F)c1C)C[C@@H](C)O2	ZINC001071171418	1354487011	/nfs/dbraw/zinc/48/70/11/1354487011.db2.gz	MWYHBUGOMIPQRA-QRWLVFNGSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C1CCC3(CC3)CC1)C[C@@H](C)O2	ZINC001071189741	1354495041	/nfs/dbraw/zinc/49/50/41/1354495041.db2.gz	OWTSWMNOHVSWTJ-UTKZUKDTSA-N	0	3	346.515	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1ccc(C)cc1C)C[C@H](C)O2	ZINC001071236291	1354520672	/nfs/dbraw/zinc/52/06/72/1354520672.db2.gz	SOIXBNUCRAQBSI-RXVVDRJESA-N	0	3	342.483	3.185	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)Cc2coc3cc(F)ccc23)CC[C@H]1C	ZINC001071498000	1354728728	/nfs/dbraw/zinc/72/87/28/1354728728.db2.gz	PMLAZQIYOOZFPU-CJNGLKHVSA-N	0	3	330.403	3.270	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cnn(CC(C)C)c2CC)CC[C@H]1C	ZINC001071501218	1354730421	/nfs/dbraw/zinc/73/04/21/1354730421.db2.gz	LQRBFMUISFNVFZ-SJORKVTESA-N	0	3	346.519	3.260	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cn(-c3ccccc3)cn2)CC[C@H]1C	ZINC001071527550	1354748060	/nfs/dbraw/zinc/74/80/60/1354748060.db2.gz	FSBLVJFYINAYLF-SJORKVTESA-N	0	3	338.455	3.031	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cncc(-c3ccccc3)c2)CC[C@@H]1C	ZINC001071548688	1354760658	/nfs/dbraw/zinc/76/06/58/1354760658.db2.gz	KHZZKGBVLXPPNM-LAUBAEHRSA-N	0	3	347.462	3.355	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cn(C)c3ccc(F)cc23)CC[C@@H]1C	ZINC001071571196	1354770549	/nfs/dbraw/zinc/77/05/49/1354770549.db2.gz	AOTQJSKSHMAEII-GOEBONIOSA-N	0	3	343.446	3.476	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2cncc3ccccc32)CC[C@@H]1C	ZINC001071584631	1354779204	/nfs/dbraw/zinc/77/92/04/1354779204.db2.gz	RLMQYNXZZHITOM-LPHOPBHVSA-N	0	3	337.467	3.323	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2ccc(-c3cc[nH]n3)s2)CC[C@H]1C	ZINC001071594406	1354783634	/nfs/dbraw/zinc/78/36/34/1354783634.db2.gz	QGFJRQZBVPMYAC-ZIAGYGMSSA-N	0	3	344.484	3.297	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccnc(-n3cccc3)c2)CC[C@@H]1C	ZINC001071594672	1354784851	/nfs/dbraw/zinc/78/48/51/1354784851.db2.gz	WIXNWZNPVRVUPU-FUHWJXTLSA-N	0	3	338.455	3.031	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cn(C)c3ccccc23)CC[C@@H]1C	ZINC001071657592	1354830359	/nfs/dbraw/zinc/83/03/59/1354830359.db2.gz	AIBJWLZMXCQSMO-HOTGVXAUSA-N	0	3	325.456	3.337	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc(-c3ccccc3)n[nH]2)CC[C@H]1C	ZINC001071663524	1354834918	/nfs/dbraw/zinc/83/49/18/1354834918.db2.gz	OOVSUFZOLRLCHO-NVXWUHKLSA-N	0	3	338.455	3.236	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2cc(C)ccc2OC)CC[C@@H]1C	ZINC001071664178	1354835947	/nfs/dbraw/zinc/83/59/47/1354835947.db2.gz	ZMVLUXOOCCMHMI-WMZOPIPTSA-N	0	3	330.472	3.091	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2c[nH]nc2-c2ccccc2)CC[C@H]1C	ZINC001071716664	1354874677	/nfs/dbraw/zinc/87/46/77/1354874677.db2.gz	YVJUUCDIFRQKPT-NVXWUHKLSA-N	0	3	338.455	3.236	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(C(F)(F)F)nc2)CC[C@H]1C	ZINC001071721429	1354879716	/nfs/dbraw/zinc/87/97/16/1354879716.db2.gz	QNABWHROQVIBJF-OCCSQVGLSA-N	0	3	341.377	3.259	20	30		EGEDHN
CC(C)CC1(C(=O)N2CC[C@@H](NCc3ccc(C#N)c(F)c3)C2)CC1	ZINC001183163395	1387270656	/nfs/dbraw/zinc/27/06/56/1387270656.db2.gz	YFLRFJBHDQUOQG-QGZVFWFLSA-N	0	3	343.446	3.214	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2(c3cccc(F)c3)CCC2)CC[C@@H]1C	ZINC001071728264	1354883569	/nfs/dbraw/zinc/88/35/69/1354883569.db2.gz	KANCJDLSIONSBF-LPHOPBHVSA-N	0	3	342.458	3.240	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2nc(Cl)cs2)CC[C@@H]1C	ZINC001071769417	1354914869	/nfs/dbraw/zinc/91/48/69/1354914869.db2.gz	QNABGZJWZZJRPZ-RYUDHWBXSA-N	0	3	327.881	3.345	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C(C)(C)c2c(C)noc2C)CC[C@@H]1C	ZINC001071761499	1354908482	/nfs/dbraw/zinc/90/84/82/1354908482.db2.gz	YXJTXJWCXFOVAU-BBRMVZONSA-N	0	3	333.476	3.114	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccccc2-n2cccc2)CC[C@@H]1C	ZINC001071793162	1354939064	/nfs/dbraw/zinc/93/90/64/1354939064.db2.gz	WASUABFYDCHBHX-ZWKOTPCHSA-N	0	3	335.451	3.083	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CC[C@H](C)N(CCOC3CCC3)C2)CC1	ZINC001071794420	1354939461	/nfs/dbraw/zinc/93/94/61/1354939461.db2.gz	CDEBZVORUMBDPT-FUHWJXTLSA-N	0	3	334.504	3.271	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC[C@H](C)N(CCc3scnc3C)C2)C1	ZINC001071808246	1354951346	/nfs/dbraw/zinc/95/13/46/1354951346.db2.gz	YIDWMHNBFIDJMX-HOCLYGCPSA-N	0	3	347.528	3.319	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC[C@H](C)N(Cc3ccc(CO)cc3)C2)C1	ZINC001071807364	1354951911	/nfs/dbraw/zinc/95/19/11/1354951911.db2.gz	QZYBXLLECGLJIW-LPHOPBHVSA-N	0	3	342.483	3.004	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cccc3c2OCCCO3)CC[C@@H]1C	ZINC001071934682	1355033351	/nfs/dbraw/zinc/03/33/51/1355033351.db2.gz	QQHACSYMKUCZAC-JKSUJKDBSA-N	0	3	344.455	3.007	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cnn(CCC)c2C2CC2)CC[C@H]1C	ZINC001071976580	1355055067	/nfs/dbraw/zinc/05/50/67/1355055067.db2.gz	FGVAVHOFVHMNBO-NVXWUHKLSA-N	0	3	344.503	3.329	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccsc2C(F)(F)F)CC[C@H]1C	ZINC001072026103	1355087820	/nfs/dbraw/zinc/08/78/20/1355087820.db2.gz	CMWDBEGYLYIEAF-NEPJUHHUSA-N	0	3	344.402	3.373	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2c(Cl)nc3ccccn32)CC[C@H]1C	ZINC001072048471	1355102795	/nfs/dbraw/zinc/10/27/95/1355102795.db2.gz	KMRIWIKIEFPFTE-KGLIPLIRSA-N	0	3	346.862	3.147	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(CC(C)C)cc2)CC[C@@H]1C	ZINC001072064209	1355109276	/nfs/dbraw/zinc/10/92/76/1355109276.db2.gz	XROISAWBTGOFDL-PXNSSMCTSA-N	0	3	326.484	3.491	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(COC(C)C)cc2)CC[C@@H]1C	ZINC001072063599	1355109413	/nfs/dbraw/zinc/10/94/13/1355109413.db2.gz	VJOJRYWBGCRWIA-PXNSSMCTSA-N	0	3	342.483	3.218	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(OCC3CC3)cc2)CC[C@H]1C	ZINC001072088270	1355121451	/nfs/dbraw/zinc/12/14/51/1355121451.db2.gz	IRDJWJKCNPYJGA-VQIMIIECSA-N	0	3	340.467	3.081	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2cccc(OCC)c2)CC[C@H]1C	ZINC001072101460	1355130613	/nfs/dbraw/zinc/13/06/13/1355130613.db2.gz	HBHGQCDRPFRERQ-AEFFLSMTSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(N(C)CC)cc2)CC[C@H]1C	ZINC001072112575	1355137702	/nfs/dbraw/zinc/13/77/02/1355137702.db2.gz	BZNBWNDYSASUMR-AEFFLSMTSA-N	0	3	329.488	3.302	20	30		EGEDHN
C=CCN1CCC[C@H](N(Cc2ccccn2)C(=O)c2ccco2)CC1	ZINC001072126836	1355143551	/nfs/dbraw/zinc/14/35/51/1355143551.db2.gz	NXKLTKCTYMTYRB-SFHVURJKSA-N	0	3	339.439	3.358	20	30		EGEDHN
C=CCN1CC[C@H](CN(Cc2scnc2C)C(=O)c2ccoc2)C1	ZINC001072134199	1355148116	/nfs/dbraw/zinc/14/81/16/1355148116.db2.gz	HLCCKKFSIUGACT-HNNXBMFYSA-N	0	3	345.468	3.195	20	30		EGEDHN
C[C@@H]1CCN(C(=O)C2CCCC2)C[C@H]1CNCc1ccccc1C#N	ZINC001072155948	1355157174	/nfs/dbraw/zinc/15/71/74/1355157174.db2.gz	JOMZITXZPKYDGX-OXQOHEQNSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3csc(C(F)(F)F)c3)C2)C1	ZINC001072896267	1355486960	/nfs/dbraw/zinc/48/69/60/1355486960.db2.gz	FMUPHFWZGVGREZ-UHFFFAOYSA-N	0	3	330.375	3.101	20	30		EGEDHN
CC(C)C1(C(=O)N2CC3(C2)CCN(Cc2ccc(C#N)cc2)C3)CC1	ZINC001072965646	1355527763	/nfs/dbraw/zinc/52/77/63/1355527763.db2.gz	YODWJNLDQKBVMP-UHFFFAOYSA-N	0	3	337.467	3.029	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@@H]3C[C@H]3c3ccc(Cl)cc3)C2)C1	ZINC001073050118	1355568552	/nfs/dbraw/zinc/56/85/52/1355568552.db2.gz	KDMFAPBPFNGEKZ-DLBZAZTESA-N	0	3	330.859	3.164	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc(O[C@H](C)CC)cc3)C2)C1	ZINC001073106088	1355600599	/nfs/dbraw/zinc/60/05/99/1355600599.db2.gz	NYCDNZNNOAVOAI-QGZVFWFLSA-N	0	3	340.467	3.035	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3cccc(Cl)c3Cl)C2)C1	ZINC001073147580	1355625923	/nfs/dbraw/zinc/62/59/23/1355625923.db2.gz	CSJCOZUQAUPKCW-UHFFFAOYSA-N	0	3	325.239	3.327	20	30		EGEDHN
CCC(C)(CC)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001073441485	1355779296	/nfs/dbraw/zinc/77/92/96/1355779296.db2.gz	LXXWYMRHKRTWSR-UHFFFAOYSA-N	0	3	339.483	3.419	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCCN1C(=O)C(C)(F)F	ZINC001073925457	1355958946	/nfs/dbraw/zinc/95/89/46/1355958946.db2.gz	BWPJFRJYIRZFRQ-MRXNPFEDSA-N	0	3	335.398	3.026	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCCN1C(=O)CC(C)(F)F	ZINC001074060430	1356059847	/nfs/dbraw/zinc/05/98/47/1356059847.db2.gz	PICOKWOCQIVNNA-QGZVFWFLSA-N	0	3	349.425	3.416	20	30		EGEDHN
C[C@H]1[C@@H](NCc2ccc(C#N)s2)CCN1C(=O)[C@H]1CCCC12CC2	ZINC001074709722	1356228151	/nfs/dbraw/zinc/22/81/51/1356228151.db2.gz	NVJLFGFZOGAHRG-XKQJLSEDSA-N	0	3	343.496	3.279	20	30		EGEDHN
C=C[C@@H](C(=O)N1CC[C@H](NCc2ncccc2C)[C@@H]1C)c1ccccc1	ZINC001075125301	1356319657	/nfs/dbraw/zinc/31/96/57/1356319657.db2.gz	XEGWAOURPQSPNE-SXLOBPIMSA-N	0	3	349.478	3.439	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cc(C)c4ccccc4n3)[C@@H]2C1	ZINC001075954375	1356455332	/nfs/dbraw/zinc/45/53/32/1356455332.db2.gz	PSPLZUHZVXRGPZ-OXJNMPFZSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@@H]3CCc4c3cccc4Cl)[C@@H]2C1	ZINC001076053221	1356475804	/nfs/dbraw/zinc/47/58/04/1356475804.db2.gz	VMLWEGWWXPRLEI-POZUXBRTSA-N	0	3	344.886	3.479	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3c3ccccc3F)[C@@H]2C1	ZINC001076341586	1356552559	/nfs/dbraw/zinc/55/25/59/1356552559.db2.gz	XXHBCUCPNNUKOI-ITQYTPKQSA-N	0	3	328.431	3.038	20	30		EGEDHN
C=CCCN1C[C@@H]2CCN(C(=O)c3sccc3C(F)F)[C@@H]2C1	ZINC001076512519	1356600223	/nfs/dbraw/zinc/60/02/23/1356600223.db2.gz	ADRKYCWMNPMXAE-WCQYABFASA-N	0	3	326.412	3.408	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccc(OC4CCC4)cc3)[C@@H]2C1	ZINC001076593524	1356625970	/nfs/dbraw/zinc/62/59/70/1356625970.db2.gz	PTFKHYDIVCNUJZ-FXAWDEMLSA-N	0	3	340.467	3.340	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cn(CC)c3ccccc23)C1	ZINC001098932462	1363527240	/nfs/dbraw/zinc/52/72/40/1363527240.db2.gz	ULFOQYWRRJUWSY-JTSKRJEESA-N	0	3	349.478	3.269	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)C2[C@@H]3CCCCCC[C@@H]23)C[C@H]1C(F)(F)F	ZINC001099314411	1363745766	/nfs/dbraw/zinc/74/57/66/1363745766.db2.gz	MUBJTQWDLQRIJG-KBUPBQIOSA-N	0	3	344.421	3.368	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCCO[C@H](CNCc2ccsc2)C1	ZINC001078460278	1356977648	/nfs/dbraw/zinc/97/76/48/1356977648.db2.gz	PFVNKAXLUTVAFF-AEFFLSMTSA-N	0	3	336.501	3.058	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2cc(C)nc(C)c2)C12CCC2	ZINC001078637576	1357046438	/nfs/dbraw/zinc/04/64/38/1357046438.db2.gz	RDJGVUGAZIUTFH-CVEARBPZSA-N	0	3	333.863	3.082	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc(C)ccc2OC)C12CCC2	ZINC001078676630	1357050686	/nfs/dbraw/zinc/05/06/86/1357050686.db2.gz	ZOYCWMUOXSGFLR-IRXDYDNUSA-N	0	3	348.874	3.387	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2C[C@@H](NCc3cnc(C)o3)C23CCC3)CC1	ZINC001078716834	1357062890	/nfs/dbraw/zinc/06/28/90/1357062890.db2.gz	ZHNKXKUNDRUEIF-QZTJIDSGSA-N	0	3	343.471	3.246	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2C[C@H](NCc3cncs3)C23CCC3)C1	ZINC001078720485	1357065066	/nfs/dbraw/zinc/06/50/66/1357065066.db2.gz	LTQSHLGFVBEBJX-LSDHHAIUSA-N	0	3	331.485	3.016	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2C[C@@H](NCc3conc3CC)C23CCC3)C1	ZINC001078720843	1357065541	/nfs/dbraw/zinc/06/55/41/1357065541.db2.gz	RLFWTBJKTXAGDO-IAGOWNOFSA-N	0	3	343.471	3.110	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2coc(CC3CC3)n2)C12CCC2	ZINC001078766452	1357073063	/nfs/dbraw/zinc/07/30/63/1357073063.db2.gz	DPKHBKFBVQLYMS-LSDHHAIUSA-N	0	3	349.862	3.010	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2csc(Cl)n2)C12CCC2	ZINC001078773173	1357078147	/nfs/dbraw/zinc/07/81/47/1357078147.db2.gz	CBAHHCFWRRYFFI-GHMZBOCLSA-N	0	3	346.283	3.180	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2cccc(C(C)C)n2)C[C@H]1c1ccccc1	ZINC001081141452	1357844842	/nfs/dbraw/zinc/84/48/42/1357844842.db2.gz	QDTJOZLIBLHCIG-GHTZIAJQSA-N	0	3	347.462	3.036	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H]2CC3CCC2CC3)C[C@H]1c1ccccc1	ZINC001081231538	1357852093	/nfs/dbraw/zinc/85/20/93/1357852093.db2.gz	KFMWIYFPQPWCDV-RKQRZCICSA-N	0	3	336.479	3.030	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2ccc(Cl)cc2C)[C@H](OC)C1	ZINC001082094065	1357942505	/nfs/dbraw/zinc/94/25/05/1357942505.db2.gz	ZKJPZEJUAAQWGI-IAGOWNOFSA-N	0	3	336.863	3.044	20	30		EGEDHN
CC[C@H](C)N[C@@H](CNC(=O)c1ccc(C#N)cc1F)c1ccco1	ZINC001183433586	1387308317	/nfs/dbraw/zinc/30/83/17/1387308317.db2.gz	URHXQICRRXMNKB-LRDDRELGSA-N	0	3	329.375	3.150	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@@H]2CCC(C)(C)C2)C[C@H]1NCc1ccc(C#N)s1	ZINC001082726525	1358081739	/nfs/dbraw/zinc/08/17/39/1358081739.db2.gz	JAXBETDKRDGHGJ-CKEIUWERSA-N	0	3	345.512	3.383	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)c3ccc(CCCC)cc3)[C@H]2C1	ZINC001083136674	1358120396	/nfs/dbraw/zinc/12/03/96/1358120396.db2.gz	KTDGGCKGWWGFPP-VQTJNVASSA-N	0	3	342.483	3.131	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)C[C@@H]3CCCCC3(C)C)[C@H]2C1	ZINC001083293000	1358128935	/nfs/dbraw/zinc/12/89/35/1358128935.db2.gz	IPJOJIBEXNJEDQ-OKZBNKHCSA-N	0	3	334.504	3.081	20	30		EGEDHN
Cc1ccc(C)c([C@@H](C)N2CC[C@@H]3CN(C(=O)C#CC4CC4)[C@@H]3C2)c1	ZINC001084334859	1358195028	/nfs/dbraw/zinc/19/50/28/1358195028.db2.gz	NGDSMOSTODLQLS-YFVAEKQCSA-N	0	3	336.479	3.311	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3conc3C3CCCC3)[C@@H]2C1	ZINC001084399680	1358207553	/nfs/dbraw/zinc/20/75/53/1358207553.db2.gz	YIEKWTXWQLRQMR-SJLPKXTDSA-N	0	3	343.471	3.445	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)c3cccc4ccc(C)nc43)[C@@H]2C1	ZINC001084438976	1358212856	/nfs/dbraw/zinc/21/28/56/1358212856.db2.gz	KATTWTSNAYTTDR-IEBWSBKVSA-N	0	3	335.451	3.266	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)C3(CC)CCC(F)(F)CC3)[C@@H]2C1	ZINC001084461036	1358219489	/nfs/dbraw/zinc/21/94/89/1358219489.db2.gz	PSFIKAGNSRJXFY-HZPDHXFCSA-N	0	3	338.442	3.148	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3csc(C(F)(F)F)c3)[C@@H]2C1	ZINC001084484525	1358222756	/nfs/dbraw/zinc/22/27/56/1358222756.db2.gz	ZZTXOCKCTLHLGG-DGCLKSJQSA-N	0	3	344.402	3.489	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3cc4cccnc4s3)[C@@H]2C1	ZINC001084755355	1358301718	/nfs/dbraw/zinc/30/17/18/1358301718.db2.gz	KPUJAOZNXSPJHA-HZPDHXFCSA-N	0	3	341.480	3.409	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)c3ccc(Cl)c(Cl)c3)[C@@H]2C1	ZINC001084792323	1358312173	/nfs/dbraw/zinc/31/21/73/1358312173.db2.gz	WKBUQCDBNSEZIZ-CZUORRHYSA-N	0	3	337.250	3.163	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)CCc3c[nH]c4ccccc34)[C@@H]2C1	ZINC001084812559	1358317361	/nfs/dbraw/zinc/31/73/61/1358317361.db2.gz	MMHSQGCBOFNWBI-YLJYHZDGSA-N	0	3	337.467	3.209	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@@H]3Cc4c3cccc4Cl)[C@@H]2C1	ZINC001084861100	1358333147	/nfs/dbraw/zinc/33/31/47/1358333147.db2.gz	VOXBBVXBFRFBOY-MZMPZRCHSA-N	0	3	330.859	3.089	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CCN(C(=O)C[C@@H]4C=CCC4)C[C@@H]32)c1	ZINC001084886944	1358340104	/nfs/dbraw/zinc/34/01/04/1358340104.db2.gz	KXSOXHXQSVZHFK-UIFIKXQLSA-N	0	3	349.478	3.337	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3cc([C@@H](C)CC)no3)C[C@@H]21	ZINC001085051431	1358379222	/nfs/dbraw/zinc/37/92/22/1358379222.db2.gz	NEAIXXFVLQNIRJ-UXLLHSPISA-N	0	3	331.460	3.301	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1coc(C(C)(C)C)n1	ZINC001085197456	1358431107	/nfs/dbraw/zinc/43/11/07/1358431107.db2.gz	URMGTLXVLVFOCY-CHWSQXEVSA-N	0	3	339.867	3.355	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccsc1COC	ZINC001085245170	1358443022	/nfs/dbraw/zinc/44/30/22/1358443022.db2.gz	NPDSPJSHWWGLKE-ZIAGYGMSSA-N	0	3	342.892	3.278	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccnc(C2CC2)c1	ZINC001085261076	1358445732	/nfs/dbraw/zinc/44/57/32/1358445732.db2.gz	VEMRHSSDPUVXBL-HZPDHXFCSA-N	0	3	333.863	3.342	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H]1CCCO[C@H]1C(=C)C	ZINC001085357934	1358477966	/nfs/dbraw/zinc/47/79/66/1358477966.db2.gz	ZDLUBRORKFILAB-HZMVEIRTSA-N	0	3	340.895	3.127	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1c[nH]nc1C(C)(C)C	ZINC001085390187	1358486481	/nfs/dbraw/zinc/48/64/81/1358486481.db2.gz	PRLQIALOYGGOQF-ZIAGYGMSSA-N	0	3	338.883	3.090	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1ccn(C2CCCCC2)n1	ZINC001085595874	1358622454	/nfs/dbraw/zinc/62/24/54/1358622454.db2.gz	PDKMXCBPVFTQLE-KRWDZBQOSA-N	0	3	330.476	3.111	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1nsc2ccccc21	ZINC001085615357	1358636142	/nfs/dbraw/zinc/63/61/42/1358636142.db2.gz	KDRRHALUEMFSDW-CQSZACIVSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1ncoc1-c1ccccc1	ZINC001085630130	1358647907	/nfs/dbraw/zinc/64/79/07/1358647907.db2.gz	MKCKESOSQXPLIH-MRXNPFEDSA-N	0	3	325.412	3.064	20	30		EGEDHN
C=CCOc1ccc(C(=O)N(C)C[C@H]2CCN2CC[C@@H](C)F)cc1	ZINC001085679006	1358683173	/nfs/dbraw/zinc/68/31/73/1358683173.db2.gz	YGSZYROAQWOWBQ-NVXWUHKLSA-N	0	3	334.435	3.146	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)C1CCc2ccccc2CC1	ZINC001085684930	1358687062	/nfs/dbraw/zinc/68/70/62/1358687062.db2.gz	FKKZARRUVBWARA-HXUWFJFHSA-N	0	3	326.484	3.290	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1noc2c1CC(C)(C)CC2	ZINC001085737436	1358722872	/nfs/dbraw/zinc/72/28/72/1358722872.db2.gz	NIIZGUWOQLOUBC-OAHLLOKOSA-N	0	3	345.487	3.302	20	30		EGEDHN
CCC(CC)[C@H](C)C(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C1	ZINC001183817636	1387353660	/nfs/dbraw/zinc/35/36/60/1387353660.db2.gz	QJTYVZOQUIUPNL-DZGCQCFKSA-N	0	3	333.501	3.383	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc(F)c(F)c(F)c1	ZINC001085834654	1358800767	/nfs/dbraw/zinc/80/07/67/1358800767.db2.gz	PYEGTOXVNSNDSJ-CYBMUJFWSA-N	0	3	326.362	3.216	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1c[nH]c(-c2ccccc2)n1	ZINC001085846728	1358814390	/nfs/dbraw/zinc/81/43/90/1358814390.db2.gz	PRXOOGRBSHAMQN-KRWDZBQOSA-N	0	3	338.455	3.189	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1cc(F)cc2cccnc21	ZINC001085853316	1358820395	/nfs/dbraw/zinc/82/03/95/1358820395.db2.gz	UJDCDMHUEWEPNZ-INIZCTEOSA-N	0	3	327.403	3.096	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cccc(C(F)(F)F)n1	ZINC001085887045	1358845937	/nfs/dbraw/zinc/84/59/37/1358845937.db2.gz	ODMLHFLOXVNTEK-ZDUSSCGKSA-N	0	3	341.377	3.213	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccnc(O[C@@H](C)CC)c1	ZINC001085915454	1358874845	/nfs/dbraw/zinc/87/48/45/1358874845.db2.gz	BGELRTWSBIOQKP-WMZOPIPTSA-N	0	3	345.487	3.371	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1c(C)nn(CCC)c1C	ZINC001085916377	1358876468	/nfs/dbraw/zinc/87/64/68/1358876468.db2.gz	YHIDEHDQXOKTMQ-KRWDZBQOSA-N	0	3	332.492	3.022	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C[C@H]2CCN2CCC2=CCCCC2)cn1	ZINC001085933319	1358888589	/nfs/dbraw/zinc/88/85/89/1358888589.db2.gz	WISPLJGTZFJBOX-HXUWFJFHSA-N	0	3	337.467	3.100	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C[C@H]2CCN2[C@@H](CC)c2ccccc2)cn1	ZINC001085933934	1358889569	/nfs/dbraw/zinc/88/95/69/1358889569.db2.gz	NNVNNCHJURBMNV-RTWAWAEBSA-N	0	3	347.462	3.361	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc(N(C)C)c(F)c1	ZINC001085989519	1358941225	/nfs/dbraw/zinc/94/12/25/1358941225.db2.gz	SJUMQSZCVUYWCQ-INIZCTEOSA-N	0	3	333.451	3.004	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@@H](CNC(=O)[C@H]3CC=CCC3)C2)c1	ZINC001086027354	1358971671	/nfs/dbraw/zinc/97/16/71/1358971671.db2.gz	QGYBFQNUUKHJJV-XYJFISCASA-N	0	3	341.430	3.038	20	30		EGEDHN
CCCCC(=O)N1CC[C@H](CNCc2ccccc2C#N)[C@@H](C)C1	ZINC001183913524	1387370032	/nfs/dbraw/zinc/37/00/32/1387370032.db2.gz	SBKJQZCHHSIMFR-FUHWJXTLSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cccc3ccc(C)nc32)C1	ZINC001086117788	1359001221	/nfs/dbraw/zinc/00/12/21/1359001221.db2.gz	BZYVGFQXOSQRMW-FZNQNYSPSA-N	0	3	343.858	3.394	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2C[C@@H](NCc3ccccc3F)C2)cc1	ZINC001086165098	1359012672	/nfs/dbraw/zinc/01/26/72/1359012672.db2.gz	WCCZFWJRHJYJNW-UWUNEBHHSA-N	0	3	336.410	3.105	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)[C@H]2CCCC[C@H]2C)C1	ZINC001086182242	1359018469	/nfs/dbraw/zinc/01/84/69/1359018469.db2.gz	WECFHFYUOAPDIL-RZFFKMDDSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@@H]2Cc3ccc(Cl)cc32)C1	ZINC001086264888	1359047261	/nfs/dbraw/zinc/04/72/61/1359047261.db2.gz	DXVFJSAKWRIHHA-DIOULYMOSA-N	0	3	339.266	3.217	20	30		EGEDHN
CC1(C)CC(C(=O)NC[C@H]2C[C@H](NCc3ccc(C#N)cc3F)C2)C1	ZINC001086358180	1359076399	/nfs/dbraw/zinc/07/63/99/1359076399.db2.gz	UUZFGPKDXRNSLE-CZIWCDLHSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ncoc2-c2ccccc2)C1	ZINC001086382025	1359083568	/nfs/dbraw/zinc/08/35/68/1359083568.db2.gz	PODSYVQQLJCONQ-CTYIDZIISA-N	0	3	345.830	3.192	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3cscc3C)C2)CC1	ZINC001086914781	1359242712	/nfs/dbraw/zinc/24/27/12/1359242712.db2.gz	SRLQXODBRDEZEL-INIZCTEOSA-N	0	3	330.497	3.396	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)[C@H]3CCCC34CC4)C2)CC1	ZINC001086929775	1359254056	/nfs/dbraw/zinc/25/40/56/1359254056.db2.gz	QETYKHOTMJVTEY-ZWKOTPCHSA-N	0	3	328.500	3.293	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc(OC)cs3)C2)CC1	ZINC001086936179	1359259466	/nfs/dbraw/zinc/25/94/66/1359259466.db2.gz	KJIQGAGAHGAVKY-OAHLLOKOSA-N	0	3	346.496	3.097	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc4[nH]ccc4c3)C2)CC1	ZINC001086939096	1359261520	/nfs/dbraw/zinc/26/15/20/1359261520.db2.gz	IFNYOROZCWMJIS-MRXNPFEDSA-N	0	3	335.451	3.118	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H](C)c3ccco3)C2)CC1	ZINC001086942494	1359264223	/nfs/dbraw/zinc/26/42/23/1359264223.db2.gz	SUBBVXFDMXELAF-IRXDYDNUSA-N	0	3	328.456	3.109	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)CCc3ccccc3F)C2)CC1	ZINC001086956180	1359277304	/nfs/dbraw/zinc/27/73/04/1359277304.db2.gz	HBZMWPIBEOOXDL-QGZVFWFLSA-N	0	3	342.458	3.095	20	30		EGEDHN
CCCC(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccc(C#N)cc1F	ZINC001087110631	1359289380	/nfs/dbraw/zinc/28/93/80/1359289380.db2.gz	WIUKFAVFBQRVHZ-PBHICJAKSA-N	0	3	331.435	3.214	20	30		EGEDHN
CC[C@H](F)C(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccc(C#N)cc1F	ZINC001087200461	1359319005	/nfs/dbraw/zinc/31/90/05/1359319005.db2.gz	YBEWZTPGRQBXES-COXVUDFISA-N	0	3	349.425	3.162	20	30		EGEDHN
CC1(C)[C@H](NC(=O)C2CC2)[C@@H]2CCCN(Cc3ccc(C#N)cc3)[C@@H]21	ZINC001087266789	1359338357	/nfs/dbraw/zinc/33/83/57/1359338357.db2.gz	QIZGVZJXOOMWEN-OTWHNJEPSA-N	0	3	337.467	3.073	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cccc(F)c1	ZINC001087270191	1359343049	/nfs/dbraw/zinc/34/30/49/1359343049.db2.gz	WIRHQPJBVVVXKR-FGTMMUONSA-N	0	3	328.431	3.068	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc(C)oc1C	ZINC001087271179	1359343990	/nfs/dbraw/zinc/34/39/90/1359343990.db2.gz	NLBKKIVSXGWLHP-BPQIPLTHSA-N	0	3	328.456	3.139	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)C3C(C)(C)C3(C)C)C(C)(C)[C@H]21	ZINC001087280057	1359357900	/nfs/dbraw/zinc/35/79/00/1359357900.db2.gz	IXQRZUMYOSXQNC-PVAVHDDUSA-N	0	3	330.516	3.297	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccoc3Cl)C(C)(C)[C@@H]21	ZINC001087282122	1359361396	/nfs/dbraw/zinc/36/13/96/1359361396.db2.gz	RWUYJNPNYPLYTC-BPLDGKMQSA-N	0	3	334.847	3.175	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(C(C)C)nc3)C(C)(C)[C@H]21	ZINC001087290495	1359369213	/nfs/dbraw/zinc/36/92/13/1359369213.db2.gz	CVRUVHYTPKXXAZ-QRQLOZEOSA-N	0	3	339.483	3.057	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3c(C)oc(C)c3C)C(C)(C)[C@H]21	ZINC001087295409	1359376231	/nfs/dbraw/zinc/37/62/31/1359376231.db2.gz	JALMGVKNUSLRGD-NEWSRXKRSA-N	0	3	342.483	3.447	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc4cc(C)ccc4[nH]3)C(C)(C)[C@H]21	ZINC001087299667	1359381298	/nfs/dbraw/zinc/38/12/98/1359381298.db2.gz	ZVZOVPXLVFNGBI-UXPWSPDFSA-N	0	3	349.478	3.328	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(F)c(Cl)c3)C(C)(C)[C@H]21	ZINC001087300293	1359382846	/nfs/dbraw/zinc/38/28/46/1359382846.db2.gz	IYDVGFPUYDRAOQ-XYPHTWIQSA-N	0	3	348.849	3.331	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccoc3C3CC3)C(C)(C)[C@H]21	ZINC001087300899	1359384401	/nfs/dbraw/zinc/38/44/01/1359384401.db2.gz	SHRGYZNFVOAEGQ-NEWSRXKRSA-N	0	3	340.467	3.399	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccccc1CC	ZINC001087301572	1359384956	/nfs/dbraw/zinc/38/49/56/1359384956.db2.gz	FHPZJRLECOPPQT-HSALFYBXSA-N	0	3	338.495	3.491	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)Cc3cc(C)ccc3C)C(C)(C)[C@H]21	ZINC001087301686	1359385084	/nfs/dbraw/zinc/38/50/84/1359385084.db2.gz	HCDUIDXCTOVLCJ-GIVPXCGWSA-N	0	3	338.495	3.084	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)CC3CC(C)(C)C3)C(C)(C)[C@H]21	ZINC001087301949	1359385473	/nfs/dbraw/zinc/38/54/73/1359385473.db2.gz	LGPDBYPOBLOLMS-QRQLOZEOSA-N	0	3	330.516	3.441	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1csc(Cl)c1	ZINC001087306878	1359393580	/nfs/dbraw/zinc/39/35/80/1359393580.db2.gz	PXQFEMACTFLATR-VHDGCEQUSA-N	0	3	336.888	3.254	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cnc4ccccc4c3)C(C)(C)[C@H]21	ZINC001087307100	1359393800	/nfs/dbraw/zinc/39/38/00/1359393800.db2.gz	UBAQARWLFRFVFO-HOJAQTOUSA-N	0	3	347.462	3.087	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3csc(C(C)C)n3)C(C)(C)[C@H]21	ZINC001087307637	1359394651	/nfs/dbraw/zinc/39/46/51/1359394651.db2.gz	DEISHGRBLBCYNT-BMFZPTHFSA-N	0	3	345.512	3.119	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc4ccncc43)C(C)(C)[C@H]21	ZINC001087311151	1359399237	/nfs/dbraw/zinc/39/92/37/1359399237.db2.gz	JRYOLOZFBZBZFL-RLLQIKCJSA-N	0	3	347.462	3.087	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccoc1CCC	ZINC001087312166	1359399538	/nfs/dbraw/zinc/39/95/38/1359399538.db2.gz	AAEKSPQHGIBLJB-BPQIPLTHSA-N	0	3	328.456	3.084	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc2c(c1)CCC=C2	ZINC001087314590	1359404557	/nfs/dbraw/zinc/40/45/57/1359404557.db2.gz	NPXVUHPMPQBGBL-QHAWAJNXSA-N	0	3	348.490	3.498	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3occ4c3CCCC4)C(C)(C)[C@H]21	ZINC001087316664	1359407202	/nfs/dbraw/zinc/40/72/02/1359407202.db2.gz	VXJYYWJFOSQESN-QRQLOZEOSA-N	0	3	340.467	3.010	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3sccc3CC)C(C)(C)[C@H]21	ZINC001087317684	1359409341	/nfs/dbraw/zinc/40/93/41/1359409341.db2.gz	LIUFIUWPZNJFDS-OIISXLGYSA-N	0	3	330.497	3.163	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc4ccccc4[nH]3)C(C)(C)[C@@H]21	ZINC001087317968	1359410153	/nfs/dbraw/zinc/41/01/53/1359410153.db2.gz	PFXZOQRXYYTMRX-NSISKUIASA-N	0	3	349.478	3.410	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(CF)cc3)C(C)(C)[C@H]21	ZINC001087319431	1359411594	/nfs/dbraw/zinc/41/15/94/1359411594.db2.gz	NOMSITHMRHMCJR-KURKYZTESA-N	0	3	328.431	3.008	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3cccn3C(C)C)C(C)(C)[C@H]21	ZINC001087319659	1359412022	/nfs/dbraw/zinc/41/20/22/1359412022.db2.gz	ROGXCSPYUBLWRI-NEWSRXKRSA-N	0	3	341.499	3.311	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)C[C@@H]2C=CCC2)CCN1Cc1ccc(C#N)cc1	ZINC001087497049	1359497469	/nfs/dbraw/zinc/49/74/69/1359497469.db2.gz	VDMPNXFRMBJYKJ-LSTHTHJFSA-N	0	3	337.467	3.384	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2oc3ccc(F)cc3c2C)[C@H]1CC	ZINC001087602188	1359551192	/nfs/dbraw/zinc/55/11/92/1359551192.db2.gz	CYTJTZHDSGBLDN-DLBZAZTESA-N	0	3	342.414	3.486	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccc3nc(C)oc3c2)[C@H]1CC	ZINC001087610710	1359553991	/nfs/dbraw/zinc/55/39/91/1359553991.db2.gz	YTHYJJQHTUPVEK-DOTOQJQBSA-N	0	3	327.428	3.295	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccc(C(F)(F)F)nc2)[C@H]1CC	ZINC001087679988	1359586400	/nfs/dbraw/zinc/58/64/00/1359586400.db2.gz	SWXVLZCHUBAXOL-UONOGXRCSA-N	0	3	341.377	3.259	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccncc2C(F)(F)F)[C@H]1CC	ZINC001087780566	1359639599	/nfs/dbraw/zinc/63/95/99/1359639599.db2.gz	MUMQKYJURKGSEV-LSDHHAIUSA-N	0	3	341.377	3.259	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cnn(CC(C)C)c2C)[C@H]1CC	ZINC001087812983	1359660164	/nfs/dbraw/zinc/66/01/64/1359660164.db2.gz	QUVMAVXPYVKKDH-ZWKOTPCHSA-N	0	3	332.492	3.006	20	30		EGEDHN
Cc1ccc(CN2CC[C@@H]3CN(C(=O)[C@@H](C)C#N)C[C@@H]3C2)c(Cl)c1	ZINC001087911694	1359704838	/nfs/dbraw/zinc/70/48/38/1359704838.db2.gz	GDAVETMOXVCUTA-UXLLHSPISA-N	0	3	345.874	3.088	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CN(C(=O)CC4CCC4)C[C@@H]3C2)cc1	ZINC001087921338	1359708126	/nfs/dbraw/zinc/70/81/26/1359708126.db2.gz	YYHBADXVOSVXHB-UXHICEINSA-N	0	3	337.467	3.029	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3cccc(Cl)c3C)C[C@@H]2C1	ZINC001087974724	1359723600	/nfs/dbraw/zinc/72/36/00/1359723600.db2.gz	LXHNWFYEZKHNPK-CVEARBPZSA-N	0	3	330.859	3.066	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)[C@]3(C)CC[C@H](C)C3(C)C)C[C@@H]2C1	ZINC001088129192	1359767064	/nfs/dbraw/zinc/76/70/64/1359767064.db2.gz	ARBOSLRVXTVTMP-NYUBLWNDSA-N	0	3	330.516	3.252	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)C[C@@H](C)c3ccccc3F)C[C@@H]2C1	ZINC001088142044	1359772434	/nfs/dbraw/zinc/77/24/34/1359772434.db2.gz	PMMPGXYLXZVPFG-KURKYZTESA-N	0	3	342.458	3.123	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3ccc(C)c(C)c3Cl)C[C@@H]2C1	ZINC001088170165	1359779830	/nfs/dbraw/zinc/77/98/30/1359779830.db2.gz	HIQCDBKUCHPISA-SJORKVTESA-N	0	3	344.886	3.374	20	30		EGEDHN
C=CCN1CC[C@H](OCC2CCN(C(=O)c3cc(C)oc3C)CC2)C1	ZINC001088228031	1359806900	/nfs/dbraw/zinc/80/69/00/1359806900.db2.gz	GEVBKTNIZVJRFA-SFHVURJKSA-N	0	3	346.471	3.026	20	30		EGEDHN
C=CCN1CC[C@H](OCC2CCN(C(=O)C3CCCCCC3)CC2)C1	ZINC001088230740	1359808611	/nfs/dbraw/zinc/80/86/11/1359808611.db2.gz	YIFSXZAYOBXLMK-FQEVSTJZSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCN1CC[C@@H](OCC2CCN(C(=O)[C@H]3CC[C@H](C)CC3)CC2)C1	ZINC001088240194	1359812029	/nfs/dbraw/zinc/81/20/29/1359812029.db2.gz	RHBZCQLXUVMLDC-MISYRCLQSA-N	0	3	348.531	3.328	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2cc(OC)cs2)C1	ZINC001088357451	1359841731	/nfs/dbraw/zinc/84/17/31/1359841731.db2.gz	BUUGGNYAOZHXSZ-CYBMUJFWSA-N	0	3	342.892	3.484	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCCCC[C@@H](NCc2cnc(C)nc2)C1	ZINC001088374495	1359856027	/nfs/dbraw/zinc/85/60/27/1359856027.db2.gz	IRFDHDLTPSIFGE-QUCCMNQESA-N	0	3	344.503	3.248	20	30		EGEDHN
Cc1ccc(CC2CCN([C@@H](C)C(=O)N(C)CCC#N)CC2)cc1	ZINC001323681026	1387422064	/nfs/dbraw/zinc/42/20/64/1387422064.db2.gz	JYIBHMJVLPIRMT-KRWDZBQOSA-N	0	3	327.472	3.010	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2cccc(N(C)C)c2)C1	ZINC001088418524	1359888758	/nfs/dbraw/zinc/88/87/58/1359888758.db2.gz	QZPIBTCJQMOGOD-QGZVFWFLSA-N	0	3	349.906	3.480	20	30		EGEDHN
C[C@@H]1[C@@H](NC(=O)c2cc(C#N)c[nH]2)CCN1Cc1ccccc1C1CC1	ZINC001088511560	1359948478	/nfs/dbraw/zinc/94/84/78/1359948478.db2.gz	SPOKWUFUFZEEFX-KUHUBIRLSA-N	0	3	348.450	3.157	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](CNC/C(Cl)=C\Cl)[C@H](C)C1	ZINC001184311592	1387426581	/nfs/dbraw/zinc/42/65/81/1387426581.db2.gz	KDJWRDZDDQAHIQ-OMZQKGCKSA-N	0	3	331.287	3.183	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)[C@H]2C3CCC(CC3)[C@@H]2C(F)(F)F)[C@H]1C	ZINC001088575853	1359977770	/nfs/dbraw/zinc/97/77/70/1359977770.db2.gz	KQQSPGDOPNQOLG-IVDIRJAZSA-N	0	3	344.421	3.366	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)C[C@@H]2CCOc3ccccc32)[C@H]1C	ZINC001088794260	1360047434	/nfs/dbraw/zinc/04/74/34/1360047434.db2.gz	UFSYFMARQNGEPY-RYRKJORJSA-N	0	3	328.456	3.098	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N[C@H]1CCN(Cc2ccc(C)cc2)[C@@H]1C	ZINC001088914158	1360102061	/nfs/dbraw/zinc/10/20/61/1360102061.db2.gz	MVBOCFHBXSIQPI-GTAWCEEGSA-N	0	3	342.483	3.055	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2cccc(Cl)c2Cl)[C@H]1C	ZINC001089001697	1360132871	/nfs/dbraw/zinc/13/28/71/1360132871.db2.gz	WSIDSGJHHBYOJW-RISCZKNCSA-N	0	3	325.239	3.209	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCCN1C(=O)[C@@H]1CC1(C)C	ZINC001089160616	1360216762	/nfs/dbraw/zinc/21/67/62/1360216762.db2.gz	ITJBSRKCJUZDPP-OALUTQOASA-N	0	3	339.483	3.417	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCCN1C(=O)[C@@H]1CC1(F)F	ZINC001089174352	1360228055	/nfs/dbraw/zinc/22/80/55/1360228055.db2.gz	ZGJCIEJKTJYGGH-IRXDYDNUSA-N	0	3	347.409	3.026	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)N1CCCC[C@H]1CN(C)Cc1cccc(C#N)c1	ZINC001089214359	1360259631	/nfs/dbraw/zinc/25/96/31/1360259631.db2.gz	XZVFPMTZMRSHEF-RBUKOAKNSA-N	0	3	345.462	3.365	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2c(C)cccc2C)CC(C)(C)C1	ZINC001089398972	1360399217	/nfs/dbraw/zinc/39/92/17/1360399217.db2.gz	QRPLIWFIZAGVIT-SFHVURJKSA-N	0	3	326.484	3.086	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc3cc(C)cn3c2)CC(C)(C)C1	ZINC001089402396	1360402094	/nfs/dbraw/zinc/40/20/94/1360402094.db2.gz	FYUHAPUUAGVSJV-GOSISDBHSA-N	0	3	337.467	3.101	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(OCC=C)cc2)CC(C)(C)C1	ZINC001089423756	1360417549	/nfs/dbraw/zinc/41/75/49/1360417549.db2.gz	NSAVLNBFLGQNIF-SFHVURJKSA-N	0	3	340.467	3.105	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2c(C)cccc2Cl)CC(C)(C)C1	ZINC001089430512	1360422421	/nfs/dbraw/zinc/42/24/21/1360422421.db2.gz	NQXHHHAXRFKXJK-MRXNPFEDSA-N	0	3	346.902	3.431	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@H](C)c2cccc(C)c2)CC(C)(C)C1	ZINC001089505373	1360477768	/nfs/dbraw/zinc/47/77/68/1360477768.db2.gz	FWIDFVXHVLKLSR-IEBWSBKVSA-N	0	3	326.484	3.339	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2ccc(Cl)s2)CC(C)(C)C1	ZINC001089510274	1360481657	/nfs/dbraw/zinc/48/16/57/1360481657.db2.gz	PXWUVSQTWDOPCH-ZDUSSCGKSA-N	0	3	338.904	3.184	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2oc(C(C)C)nc2C)CC(C)(C)C1	ZINC001089515787	1360486217	/nfs/dbraw/zinc/48/62/17/1360486217.db2.gz	ZSOCKFDBMDTDKW-MRXNPFEDSA-N	0	3	345.487	3.350	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2c(F)cccc2Cl)CC(C)(C)C1	ZINC001089544889	1360500709	/nfs/dbraw/zinc/50/07/09/1360500709.db2.gz	BNGTZNQPVHKHPM-ZDUSSCGKSA-N	0	3	336.838	3.333	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc3ncsc3c2)CC(C)(C)C1	ZINC001089553182	1360504100	/nfs/dbraw/zinc/50/41/00/1360504100.db2.gz	USAJMYXFPWYJQT-HNNXBMFYSA-N	0	3	341.480	3.150	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@H](C)c2ccc(F)c(F)c2)CC(C)(C)C1	ZINC001089561299	1360508873	/nfs/dbraw/zinc/50/88/73/1360508873.db2.gz	ONIHSMWLDXLANL-ZBFHGGJFSA-N	0	3	348.437	3.308	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cnn(C2CCC2)c1	ZINC001089642021	1360555341	/nfs/dbraw/zinc/55/53/41/1360555341.db2.gz	ZHARTGVQJFBJHI-GOSISDBHSA-N	0	3	344.503	3.405	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ncc(C)cc1OC	ZINC001089651736	1360564357	/nfs/dbraw/zinc/56/43/57/1360564357.db2.gz	LSGMJDXMJFZYPU-INIZCTEOSA-N	0	3	345.487	3.195	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(=O)[nH]c(C2CC2)c1	ZINC001089651396	1360564598	/nfs/dbraw/zinc/56/45/98/1360564598.db2.gz	BSROMRMVCKWSTA-MRXNPFEDSA-N	0	3	343.471	3.071	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cccc(CC)n1	ZINC001089652106	1360564859	/nfs/dbraw/zinc/56/48/59/1360564859.db2.gz	WVRUWWJOUUPYKD-KRWDZBQOSA-N	0	3	329.488	3.441	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc2ncccc2o1	ZINC001089669185	1360579630	/nfs/dbraw/zinc/57/96/30/1360579630.db2.gz	IIRZCCCHRSJIEE-OAHLLOKOSA-N	0	3	339.439	3.072	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(C(C)C)no1	ZINC001089705776	1360608132	/nfs/dbraw/zinc/60/81/32/1360608132.db2.gz	AAKAYJKCBWNRCP-OAHLLOKOSA-N	0	3	331.460	3.042	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cccc2nccnc21	ZINC001089716272	1360617477	/nfs/dbraw/zinc/61/74/77/1360617477.db2.gz	DJMDFKJNLAREMC-OAHLLOKOSA-N	0	3	338.455	3.036	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cn(CCC)nc1C	ZINC001089716301	1360617878	/nfs/dbraw/zinc/61/78/78/1360617878.db2.gz	FHSOLGUGJASVIP-KRWDZBQOSA-N	0	3	346.519	3.398	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1sccc1OC	ZINC001089723506	1360626435	/nfs/dbraw/zinc/62/64/35/1360626435.db2.gz	KWZWACFLUAGJNA-CQSZACIVSA-N	0	3	334.485	3.000	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(NC(C)=O)cc1	ZINC001089725628	1360628438	/nfs/dbraw/zinc/62/84/38/1360628438.db2.gz	GERXTXAJNVVJQZ-GOSISDBHSA-N	0	3	343.471	3.051	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cnn(C)c1C1CC1	ZINC001089735565	1360640322	/nfs/dbraw/zinc/64/03/22/1360640322.db2.gz	DYVWCQAQCICIBT-MRXNPFEDSA-N	0	3	344.503	3.094	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1(C)CC=CC1	ZINC001089860433	1360704943	/nfs/dbraw/zinc/70/49/43/1360704943.db2.gz	WTHJKBHLTAKUGG-NXOAAHMSSA-N	0	3	334.891	3.264	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C2(C3CC3)CCC2)CC2(CCOCC2)C1	ZINC001089950387	1360760561	/nfs/dbraw/zinc/76/05/61/1360760561.db2.gz	TYSGRRKFTDTHKX-GOSISDBHSA-N	0	3	346.515	3.130	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)[C@]23C[C@H]2CCCC3)CC2(CCOCC2)C1	ZINC001089959917	1360767189	/nfs/dbraw/zinc/76/71/89/1360767189.db2.gz	UKQBBZDJUSJBQC-DBXWQHBBSA-N	0	3	346.515	3.130	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(C)cc2)CC2(CCOCC2)C1	ZINC001089968194	1360771519	/nfs/dbraw/zinc/77/15/19/1360771519.db2.gz	LBEOMFZKHVCNMO-LJQANCHMSA-N	0	3	342.483	3.172	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@H]2CCc3cc(F)ccc32)C1	ZINC001091145935	1360997607	/nfs/dbraw/zinc/99/76/07/1360997607.db2.gz	MFMSMDRJKYTSAL-QOJXUVEWSA-N	0	3	336.838	3.092	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc(Cl)c(Cl)[nH]2)C1	ZINC001091168722	1361000487	/nfs/dbraw/zinc/00/04/87/1361000487.db2.gz	JTURMFAAYBNEHS-UHFFFAOYSA-N	0	3	336.650	3.172	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)[C@@H]2CCCC2(C)C)C1	ZINC001091187628	1361001870	/nfs/dbraw/zinc/00/18/70/1361001870.db2.gz	JHFORYLRUFXZFK-RUXDESIVSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C1CCC(C(=O)NCC2CC(NCc3oc(CC)nc3C)C2)CC1	ZINC001091215332	1361009774	/nfs/dbraw/zinc/00/97/74/1361009774.db2.gz	ALYQYLOZTBRICT-UHFFFAOYSA-N	0	3	345.487	3.276	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H]2C[C@H]2c2ccccc2C)C1	ZINC001091277211	1361029541	/nfs/dbraw/zinc/02/95/41/1361029541.db2.gz	IVLZCIFFBCLDGU-MUDYYLEHSA-N	0	3	332.875	3.335	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cscc3C(F)F)C[C@]2(C)C1	ZINC001091676332	1361177381	/nfs/dbraw/zinc/17/73/81/1361177381.db2.gz	NXMIHTCJLUIRAE-PXAZEXFGSA-N	0	3	338.423	3.103	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3coc4c3cccc4C)C[C@]2(C)C1	ZINC001091743262	1361205405	/nfs/dbraw/zinc/20/54/05/1361205405.db2.gz	ORVGWXQUNHPSTN-IERDGZPVSA-N	0	3	336.435	3.158	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3c(C)c(F)ccc3Cl)C[C@]2(C)C1	ZINC001091800622	1361223635	/nfs/dbraw/zinc/22/36/35/1361223635.db2.gz	PYFVHLSEEYHSGO-KUHUBIRLSA-N	0	3	348.849	3.205	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CN(Cc4cccc(F)c4)C[C@@]3(C)C2)C1	ZINC001091996085	1361270046	/nfs/dbraw/zinc/27/00/46/1361270046.db2.gz	PLOJTYZNQFQORA-UTKZUKDTSA-N	0	3	342.458	3.462	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C[C@@H](C)c3cccc(F)c3)C[C@]2(C)C1	ZINC001091999558	1361270720	/nfs/dbraw/zinc/27/07/20/1361270720.db2.gz	UQDSOOPQGNDTJM-BLIXFSHQSA-N	0	3	342.458	3.123	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc(-c4ccccc4)o3)C[C@]2(C)C1	ZINC001092037469	1361278702	/nfs/dbraw/zinc/27/87/02/1361278702.db2.gz	OTDYEPDNNROUBZ-GCJKJVERSA-N	0	3	348.446	3.364	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@H](c3ccccc3)C(C)C)C[C@]2(C)C1	ZINC001092047641	1361282629	/nfs/dbraw/zinc/28/26/29/1361282629.db2.gz	JBNPMNQVDDKVPG-URVUXULASA-N	0	3	338.495	3.230	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@H](C)CC3CCCCC3)C[C@]2(C)C1	ZINC001092065731	1361286744	/nfs/dbraw/zinc/28/67/44/1361286744.db2.gz	SJPUFRAFXZZQPE-QFUCXCTJSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cccc(C4CCC4)c3)C[C@]2(C)C1	ZINC001092199931	1361321383	/nfs/dbraw/zinc/32/13/83/1361321383.db2.gz	WPLAQCQCVMRWQY-IRLDBZIGSA-N	0	3	336.479	3.371	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C34CC5CC(CC(C5)C3)C4)C[C@]2(C)C1	ZINC001092223241	1361329778	/nfs/dbraw/zinc/32/97/78/1361329778.db2.gz	GCSMMZDDTONYFB-PUMJYOEESA-N	0	3	340.511	3.006	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3ccc(-c4ccccc4)cc3)C[C@]2(C)C1	ZINC001092242492	1361338246	/nfs/dbraw/zinc/33/82/46/1361338246.db2.gz	MTNHINLIYYVQHL-GGAORHGYSA-N	0	3	344.458	3.381	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3cc(CCC)c(C)s3)C[C@]2(C)C1	ZINC001092260156	1361347048	/nfs/dbraw/zinc/34/70/48/1361347048.db2.gz	NYDZIUMUDIPCCD-APWZRJJASA-N	0	3	330.497	3.036	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3oc4c(cccc4C)c3C)C[C@]2(C)C1	ZINC001092302999	1361358912	/nfs/dbraw/zinc/35/89/12/1361358912.db2.gz	MSLAVLKUJIEOHW-IERDGZPVSA-N	0	3	336.435	3.077	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)CC(C)(C)c3ccccc3)C[C@]2(C)C1	ZINC001092302991	1361359135	/nfs/dbraw/zinc/35/91/35/1361359135.db2.gz	MHFRJKSHPGDBKA-KNQAVFIVSA-N	0	3	338.495	3.158	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1CNC(=O)C1CCCC1	ZINC001092423939	1361378385	/nfs/dbraw/zinc/37/83/85/1361378385.db2.gz	IZCFGWMQHWGYNR-VQIMIIECSA-N	0	3	342.458	3.052	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CNC(=O)c1ccccc1	ZINC001092438692	1361384352	/nfs/dbraw/zinc/38/43/52/1361384352.db2.gz	XTWWCGHYHCSGPJ-GDBMZVCRSA-N	0	3	339.464	3.118	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@@H]2CN(C/C=C\Cl)C[C@H]2C)cc1	ZINC001092739818	1361451278	/nfs/dbraw/zinc/45/12/78/1361451278.db2.gz	DRPUCMUIGBUAKK-PSQXPXBKSA-N	0	3	348.874	3.302	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)c2ccc(C)s2)CC1	ZINC001093351604	1361565345	/nfs/dbraw/zinc/56/53/45/1361565345.db2.gz	CRJFVGMLNPBKJT-GOSISDBHSA-N	0	3	342.508	3.396	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)c2cccc(F)c2)CC1	ZINC001093353049	1361567713	/nfs/dbraw/zinc/56/77/13/1361567713.db2.gz	PSVPWDZOPQBKEW-LJQANCHMSA-N	0	3	340.442	3.166	20	30		EGEDHN
CC[C@H](F)CN1CC2(CCC2)[C@H]1C1CCN(C(=O)C#CC2CC2)CC1	ZINC001093370754	1361579852	/nfs/dbraw/zinc/57/98/52/1361579852.db2.gz	YWWKKUZNUNUMBO-AZUAARDMSA-N	0	3	346.490	3.241	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@H](C)C2CCC2)CC1	ZINC001093373505	1361582994	/nfs/dbraw/zinc/58/29/94/1361582994.db2.gz	NTZCENCNVUZSIZ-APWZRJJASA-N	0	3	328.500	3.149	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H](CNCc2ccn(C(C)C)n2)[C@H](C)C1	ZINC001094018202	1361725228	/nfs/dbraw/zinc/72/52/28/1361725228.db2.gz	KZOLMZJWEKERHK-MBOZVWFJSA-N	0	3	346.519	3.250	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3ccc(C(C)C)s3)CCC[C@@H]12	ZINC001094586110	1361872321	/nfs/dbraw/zinc/87/23/21/1361872321.db2.gz	FLFCTNJLYYJROW-IEBWSBKVSA-N	0	3	330.497	3.479	20	30		EGEDHN
C[C@H]1CN(C(=O)CCC(F)F)CC[C@H]1CNCc1ccccc1C#N	ZINC001184831863	1387546343	/nfs/dbraw/zinc/54/63/43/1387546343.db2.gz	NJVBDZHCJPFBNQ-HOCLYGCPSA-N	0	3	349.425	3.178	20	30		EGEDHN
Cc1cccc([C@@H](C)N2[C@@H]3CC[C@H]2[C@@H](NC(=O)c2cc(C#N)c[nH]2)C3)c1	ZINC001095285207	1362083534	/nfs/dbraw/zinc/08/35/34/1362083534.db2.gz	IHZYFHXDAUAHQG-QKUWSGOFSA-N	0	3	348.450	3.291	20	30		EGEDHN
Cc1cccc([C@@H](C)N2[C@@H]3CC[C@H]2[C@@H](NC(=O)c2ccc(C#N)[nH]2)C3)c1	ZINC001095329681	1362103484	/nfs/dbraw/zinc/10/34/84/1362103484.db2.gz	XHMFHCSSKAEIIZ-JBCDFXQESA-N	0	3	348.450	3.291	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](NCc2ccc(F)c(F)c2)C1	ZINC001184889854	1387555235	/nfs/dbraw/zinc/55/52/35/1387555235.db2.gz	BWNOEAXMBFUOOB-MRXNPFEDSA-N	0	3	334.410	3.239	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1[nH]c3ccccc3c1Cl)C2	ZINC001095683447	1362201082	/nfs/dbraw/zinc/20/10/82/1362201082.db2.gz	KASNHDOSSGCAOX-KCXAZCMYSA-N	0	3	341.842	3.180	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(C)c3cccnc13)C2	ZINC001095779265	1362226520	/nfs/dbraw/zinc/22/65/20/1362226520.db2.gz	TXAPSRKJASTNDV-MNEFBYGVSA-N	0	3	335.451	3.454	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@@H]1CCOc3ccccc31)C2	ZINC001095868458	1362260627	/nfs/dbraw/zinc/26/06/27/1362260627.db2.gz	PDBIQYVHEMMMAX-NBMJBFSESA-N	0	3	340.467	3.240	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccccc1OCC(C)C)C2	ZINC001096193412	1362424019	/nfs/dbraw/zinc/42/40/19/1362424019.db2.gz	IQMKMGNYEYTRPV-NEWSRXKRSA-N	0	3	340.467	3.080	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1cccc(OCCC)c1)C2	ZINC001096301175	1362456842	/nfs/dbraw/zinc/45/68/42/1362456842.db2.gz	SJOPTSBSSIATNF-HOJAQTOUSA-N	0	3	342.483	3.316	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H]1CCCc3sc(C)nc31)C2	ZINC001096328679	1362464168	/nfs/dbraw/zinc/46/41/68/1362464168.db2.gz	HWEPVECRHYNFQA-WCVJEAGWSA-N	0	3	345.512	3.169	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1c[nH]c3cccc(C)c13)C2	ZINC001096365551	1362474986	/nfs/dbraw/zinc/47/49/86/1362474986.db2.gz	NCSYUTOCMCATML-NEWSRXKRSA-N	0	3	337.467	3.316	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](CNCc2ncc(C)s2)[C@@H](C)C1	ZINC001184970167	1387576616	/nfs/dbraw/zinc/57/66/16/1387576616.db2.gz	UEQSEWIVPXBFAS-DOTOQJQBSA-N	0	3	347.528	3.219	20	30		EGEDHN
CCCC1(C(=O)N2CC[C@@H](NCc3ccc(F)c(C#N)c3)C2)CCC1	ZINC001185007456	1387588975	/nfs/dbraw/zinc/58/89/75/1387588975.db2.gz	SXBVXQOLFWKTJZ-QGZVFWFLSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1cncc3ccccc31)C2	ZINC001097255639	1362904369	/nfs/dbraw/zinc/90/43/69/1362904369.db2.gz	ITHHVZIATIHEQT-RLLQIKCJSA-N	0	3	335.451	3.075	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](CNCc2oc(CC)nc2C)[C@H](C)C1	ZINC001185061766	1387604584	/nfs/dbraw/zinc/60/45/84/1387604584.db2.gz	PLBPKIKPSYSZOR-WBVHZDCISA-N	0	3	347.503	3.476	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](CNCc2ccn(C(C)C)n2)[C@H](C)C1	ZINC001185062245	1387605235	/nfs/dbraw/zinc/60/52/35/1387605235.db2.gz	RSEZUFHRTHHEOE-MSOLQXFVSA-N	0	3	346.519	3.395	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@@H]1CCC3(CCC3)CO1)C2	ZINC001098258252	1363274101	/nfs/dbraw/zinc/27/41/01/1363274101.db2.gz	VIJROPMFRPBXMU-XDNAFOTISA-N	0	3	332.488	3.023	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cccc(C(F)(F)F)c1)C2	ZINC001098266755	1363278986	/nfs/dbraw/zinc/27/89/86/1363278986.db2.gz	MCQUTHAHMXUTPJ-OAGGEKHMSA-N	0	3	336.357	3.064	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(-c3ccccc3)[nH]1)C2	ZINC001098489767	1363341463	/nfs/dbraw/zinc/34/14/63/1363341463.db2.gz	KNEKLUVKDCQIGC-AHRSYUTCSA-N	0	3	333.435	3.040	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1cc(F)ccc1C)C[C@H](C)O2	ZINC001098623400	1363403499	/nfs/dbraw/zinc/40/34/99/1363403499.db2.gz	FJEGVERQURSTJG-INIZCTEOSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](n2cc(CNCCCCCCC)nn2)C1	ZINC001098633839	1363408821	/nfs/dbraw/zinc/40/88/21/1363408821.db2.gz	NCKOYSUCJDJYPO-SFHVURJKSA-N	0	3	347.507	3.078	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H](C)c1cccs1)C[C@@H](C)O2	ZINC001098635200	1363409372	/nfs/dbraw/zinc/40/93/72/1363409372.db2.gz	DWJDHVOZNRIJGA-HZPDHXFCSA-N	0	3	348.512	3.120	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H](C)C1CCCC1)C[C@@H](C)O2	ZINC001098652417	1363418620	/nfs/dbraw/zinc/41/86/20/1363418620.db2.gz	CZEWSHWEPLKPFB-IAGOWNOFSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H](C)c1ccccc1)C[C@@H](C)O2	ZINC001098655030	1363420473	/nfs/dbraw/zinc/42/04/73/1363420473.db2.gz	ILHWKRVYRCDGAB-MSOLQXFVSA-N	0	3	342.483	3.058	20	30		EGEDHN
CC1CC(C(=O)N[C@]23CCC[C@H]2CN(Cc2cccc(C#N)c2)C3)C1	ZINC001098783615	1363466758	/nfs/dbraw/zinc/46/67/58/1363466758.db2.gz	KODQQKAKMXRGKL-SKRQAFIBSA-N	0	3	337.467	3.075	20	30		EGEDHN
C#CCCN1C[C@@H]2CCC[C@]2(NC(=O)c2nc(C(C)(C)C)cs2)C1	ZINC001098885716	1363505089	/nfs/dbraw/zinc/50/50/89/1363505089.db2.gz	KBPLHYRPBDZXLV-LIRRHRJNSA-N	0	3	345.512	3.048	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccoc1C	ZINC001098887878	1363505215	/nfs/dbraw/zinc/50/52/15/1363505215.db2.gz	ILCQSGJUMSJFOI-MRXNPFEDSA-N	0	3	334.460	3.011	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(C)c3cccnc23)C1	ZINC001098950736	1363537143	/nfs/dbraw/zinc/53/71/43/1363537143.db2.gz	ONAFTRQNGYEDNI-JTSKRJEESA-N	0	3	347.462	3.151	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(Cl)cc2C)C1	ZINC001099005793	1363567621	/nfs/dbraw/zinc/56/76/21/1363567621.db2.gz	DFYKMOHLJIBGOW-KXBFYZLASA-N	0	3	330.859	3.256	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H]2C[C@H]2c2ccc(C)s2)C1	ZINC001099070605	1363607518	/nfs/dbraw/zinc/60/75/18/1363607518.db2.gz	KWSMRDPNEZJHFJ-MKSNKDDYSA-N	0	3	330.497	3.317	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)C1(CCOCC)CCC1	ZINC001099075186	1363609343	/nfs/dbraw/zinc/60/93/43/1363609343.db2.gz	VZLWNMUWSOMJHH-GOSISDBHSA-N	0	3	348.531	3.213	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H]2C[C@H]2c2cccc(C)c2)C1	ZINC001099075076	1363609399	/nfs/dbraw/zinc/60/93/99/1363609399.db2.gz	GTRMBAZXZXOCLE-KEZQHZCBSA-N	0	3	336.479	3.093	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NC[C@H]1CCC(C)(C)CN1CC(=C)C	ZINC001099157989	1363662087	/nfs/dbraw/zinc/66/20/87/1363662087.db2.gz	CAECSGODBZFRMU-XLIONFOSSA-N	0	3	336.520	3.398	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H](C)c2cccc(Cl)c2)C1	ZINC001099172075	1363669736	/nfs/dbraw/zinc/66/97/36/1363669736.db2.gz	QSXKKNQOWLGBRG-SYNHAJSKSA-N	0	3	344.886	3.438	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)c1occc1CC	ZINC001099221116	1363699274	/nfs/dbraw/zinc/69/92/74/1363699274.db2.gz	XZDSJYLKUUDMOP-KRWDZBQOSA-N	0	3	348.487	3.265	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)C[C@H](C)c1cccnc1	ZINC001099258489	1363719257	/nfs/dbraw/zinc/71/92/57/1363719257.db2.gz	RIERBVFRISMCOY-WMZOPIPTSA-N	0	3	329.488	3.368	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)CCN(C)c1ccccc1	ZINC001099269763	1363724379	/nfs/dbraw/zinc/72/43/79/1363724379.db2.gz	DNUVPZIRNZNJJR-LJQANCHMSA-N	0	3	343.515	3.306	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)C[C@H]2CC=CCC2)C[C@H]1C(F)(F)F	ZINC001099293505	1363735839	/nfs/dbraw/zinc/73/58/39/1363735839.db2.gz	PPSNNDJAGHEKHR-RRFJBIMHSA-N	0	3	330.394	3.288	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2ccc(Cl)c(C)c2)C[C@H]1C(F)(F)F	ZINC001099301153	1363738670	/nfs/dbraw/zinc/73/86/70/1363738670.db2.gz	CDOXFMGVQYYPDD-TZMCWYRMSA-N	0	3	346.780	3.427	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)CCc1ccc(OC)cc1	ZINC001099328432	1363752760	/nfs/dbraw/zinc/75/27/60/1363752760.db2.gz	DNLRICJNZZOSRG-SFHVURJKSA-N	0	3	344.499	3.421	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2sccc2CC)C[C@H]1C(F)(F)F	ZINC001099345514	1363763347	/nfs/dbraw/zinc/76/33/47/1363763347.db2.gz	FCPNMKDCHAZJDP-CHWSQXEVSA-N	0	3	346.418	3.479	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H](OC)c1ccc(F)cc1	ZINC001099357927	1363771155	/nfs/dbraw/zinc/77/11/55/1363771155.db2.gz	BTFSYXURNPAHLC-ROUUACIJSA-N	0	3	348.462	3.306	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)CC1CCC(OC)CC1	ZINC001099379910	1363781662	/nfs/dbraw/zinc/78/16/62/1363781662.db2.gz	OITKAWIVLYGEJQ-ADKAHSJRSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2ocnc2C)C1	ZINC001099488772	1363817077	/nfs/dbraw/zinc/81/70/77/1363817077.db2.gz	ANNCFEUATRXGRN-DBVUQKKJSA-N	0	3	345.487	3.304	20	30		EGEDHN
CC#CCCCC(=O)N[C@H]1CN(CC=C(C)C)CC2(CCOCC2)C1	ZINC001099588480	1363870764	/nfs/dbraw/zinc/87/07/64/1363870764.db2.gz	BZYWOGAZQHTEJE-LJQANCHMSA-N	0	3	346.515	3.134	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CC[C@H](C)CC)CC2(CCOCC2)C1	ZINC001099595172	1363878097	/nfs/dbraw/zinc/87/80/97/1363878097.db2.gz	UXENTWFOAAMFHO-QZTJIDSGSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCC(C)(C)C)CC2(CCOCC2)C1	ZINC001099595139	1363878320	/nfs/dbraw/zinc/87/83/20/1363878320.db2.gz	UGLVXJGMBPZCAU-KRWDZBQOSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCCCC(C)C)CC2(CCOCC2)C1	ZINC001099595348	1363878473	/nfs/dbraw/zinc/87/84/73/1363878473.db2.gz	ZFYAFXMNRCFGHH-SFHVURJKSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CCN(Cc2ccc(C(C)C)cc2)C[C@@H]1O	ZINC001099944622	1363989036	/nfs/dbraw/zinc/98/90/36/1363989036.db2.gz	OXFMDZOGQBNBTF-MOPGFXCFSA-N	0	3	344.499	3.074	20	30		EGEDHN
CCCCCCCCC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1O	ZINC001100085464	1364012430	/nfs/dbraw/zinc/01/24/30/1364012430.db2.gz	LRELGHFIENOTDR-WOJBJXKFSA-N	0	3	346.515	3.489	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CCN(CC3=CCCCC3)C[C@H]2O)CCCC1	ZINC001100145530	1364025365	/nfs/dbraw/zinc/02/53/65/1364025365.db2.gz	MGYKCDRYCVPJEL-RTBURBONSA-N	0	3	346.515	3.175	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C[C@H](C)CC)C[C@H]1c1ccc(OC)cc1	ZINC001100159800	1364031454	/nfs/dbraw/zinc/03/14/54/1364031454.db2.gz	NUMVURYJASEZIB-LSTHTHJFSA-N	0	3	342.483	3.039	20	30		EGEDHN
CC(C)[C@@H](C)CC(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1	ZINC001100178743	1364037716	/nfs/dbraw/zinc/03/77/16/1364037716.db2.gz	WVRKFDACWNGNRC-NXVRBGIVSA-N	0	3	345.462	3.364	20	30		EGEDHN
C/C=C(\C)C(=O)NCC1CC(NCC#Cc2cccc(Cl)c2)C1	ZINC001100231009	1364051223	/nfs/dbraw/zinc/05/12/23/1364051223.db2.gz	JVLFXESMASFTMX-LZWSPWQCSA-N	0	3	330.859	3.142	20	30		EGEDHN
C/C=C(/C)C(=O)NCC1CC(NCC#Cc2cccc(Cl)c2)C1	ZINC001100231008	1364051332	/nfs/dbraw/zinc/05/13/32/1364051332.db2.gz	JVLFXESMASFTMX-BNNQUZSASA-N	0	3	330.859	3.142	20	30		EGEDHN
Cc1ccc(F)c(CNC2CC(CNC(=O)C#CC(C)(C)C)C2)c1	ZINC001100317162	1364078481	/nfs/dbraw/zinc/07/84/81/1364078481.db2.gz	HKIUBAPDLGWZNC-UHFFFAOYSA-N	0	3	330.447	3.168	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NCC1CC(NCc2c(C)noc2C)C1	ZINC001100362045	1364091938	/nfs/dbraw/zinc/09/19/38/1364091938.db2.gz	NOPDYWMNRUYLNC-UHFFFAOYSA-N	0	3	339.867	3.055	20	30		EGEDHN
C[C@@H](C(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1)C1CCC1	ZINC001100436596	1364113545	/nfs/dbraw/zinc/11/35/45/1364113545.db2.gz	DMCVJOVDZUFKJI-MJJDPTRDSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC1CC(NCc2cccc(Cl)n2)C1	ZINC001100560034	1364162659	/nfs/dbraw/zinc/16/26/59/1364162659.db2.gz	SMNQSZXFMCVGLD-UHFFFAOYSA-N	0	3	335.879	3.322	20	30		EGEDHN
CC(C)=C(C)CC(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1	ZINC001100575986	1364170619	/nfs/dbraw/zinc/17/06/19/1364170619.db2.gz	HBFWZECDHPBDEW-UHFFFAOYSA-N	0	3	343.446	3.428	20	30		EGEDHN
C[C@]1(C(=O)NCC2CC(NCc3cc(C#N)ccc3F)C2)C=CCC1	ZINC001100584317	1364174454	/nfs/dbraw/zinc/17/44/54/1364174454.db2.gz	DDJGVUNTTJUAHK-LAGYLCCXSA-N	0	3	341.430	3.038	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCC1CC(NCc2c(C)onc2CC)C1	ZINC001100587526	1364176491	/nfs/dbraw/zinc/17/64/91/1364176491.db2.gz	SLDSSGRRVOOGQX-JEYLPNPQSA-N	0	3	333.476	3.132	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1	ZINC001100594832	1364180004	/nfs/dbraw/zinc/18/00/04/1364180004.db2.gz	GYAXRVLKQLOPRO-MXWWQKGMSA-N	0	3	343.446	3.284	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCC1CC(NCc2oc(CC)nc2C)C1	ZINC001100597432	1364181518	/nfs/dbraw/zinc/18/15/18/1364181518.db2.gz	VFXZPHAVJCVTHM-FHERZECASA-N	0	3	333.476	3.132	20	30		EGEDHN
C[C@@H](CC(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1)C1CC1	ZINC001101042925	1364387847	/nfs/dbraw/zinc/38/78/47/1364387847.db2.gz	SPBHOJLKJPNNKC-UQHVZDHRSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=CCN1CC[C@H](Oc2ccnc(CNC(=O)[C@H](C)CCCC)c2)C1	ZINC001101093934	1364411194	/nfs/dbraw/zinc/41/11/94/1364411194.db2.gz	NCOHMAVLKRRAFF-APWZRJJASA-N	0	3	345.487	3.163	20	30		EGEDHN
C=CCN1CC[C@H](Oc2ccnc(CNC(=O)CCCCCC)c2)C1	ZINC001101097507	1364412882	/nfs/dbraw/zinc/41/28/82/1364412882.db2.gz	ULMUUPSRZZLTDI-IBGZPJMESA-N	0	3	345.487	3.307	20	30		EGEDHN
C=CCCC(=O)N1C[C@H]2CN(Cc3cc(C)ccc3F)C[C@@]2(C)C1	ZINC001101167649	1364442921	/nfs/dbraw/zinc/44/29/21/1364442921.db2.gz	NOFFKAUJFSOVOD-XLIONFOSSA-N	0	3	330.447	3.381	20	30		EGEDHN
CC/C(C)=C/C(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@@]2(C)C1	ZINC001101225638	1364473370	/nfs/dbraw/zinc/47/33/70/1364473370.db2.gz	QAKBIQZOBNWNTQ-HRBSKJBBSA-N	0	3	337.467	3.195	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@H]2CN(Cc3oc(C)nc3C)C[C@@]2(C)C1	ZINC001101338118	1364516610	/nfs/dbraw/zinc/51/66/10/1364516610.db2.gz	XQDXZICSKICWIK-QKLQHJQFSA-N	0	3	345.487	3.174	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)[C@H](CC(C)C)c3ccccc3)C[C@]2(C)C1	ZINC001101386982	1364540306	/nfs/dbraw/zinc/54/03/06/1364540306.db2.gz	JRAODUSOXMCYSW-SJBKTWHCSA-N	0	3	338.495	3.230	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C/C=C/c3ccc(C)cc3)C[C@]2(C)C1	ZINC001101496003	1364581446	/nfs/dbraw/zinc/58/14/46/1364581446.db2.gz	AXJDKWHYKWNIJG-GYBAZJMSSA-N	0	3	336.479	3.202	20	30		EGEDHN
C=CCC[C@@H](C)N1CC2(C1)C[C@H](NC(=O)C(C)(C)C=C)c1nccn12	ZINC001101637374	1364664102	/nfs/dbraw/zinc/66/41/02/1364664102.db2.gz	KQSFNIHYACIEMQ-CVEARBPZSA-N	0	3	342.487	3.022	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CC2(CN(CC3CCCC3)C2)n2ccnc21	ZINC001101640402	1364666498	/nfs/dbraw/zinc/66/64/98/1364666498.db2.gz	AATWAFFHBUBNHL-QGZVFWFLSA-N	0	3	342.487	3.002	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CC2(CN(C[C@H](C)CC)C2)n2ccnc21	ZINC001101646676	1364669519	/nfs/dbraw/zinc/66/95/19/1364669519.db2.gz	UKLMRSUNWFFSAG-HZPDHXFCSA-N	0	3	344.503	3.103	20	30		EGEDHN
C=CC[C@@H]1NC(=O)N(C[C@H](c2cccs2)N2CCC(C)CC2)C1=O	ZINC001324607274	1387695510	/nfs/dbraw/zinc/69/55/10/1387695510.db2.gz	HAKJOAJRFTZQTO-LSDHHAIUSA-N	0	3	347.484	3.018	20	30		EGEDHN
CC/C(C)=C/C(=O)NC[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1C	ZINC001101940501	1364782595	/nfs/dbraw/zinc/78/25/95/1364782595.db2.gz	GYMHSQCGPHENNM-KFSLYVPWSA-N	0	3	342.458	3.218	20	30		EGEDHN
CC(C(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C)=C1CCC1	ZINC001101944301	1364785379	/nfs/dbraw/zinc/78/53/79/1364785379.db2.gz	MCFKEQRDFIWSML-CZUORRHYSA-N	0	3	343.496	3.304	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H]1CN(Cc2oc(CC)nc2C)C[C@H]1C	ZINC001102011791	1364811638	/nfs/dbraw/zinc/81/16/38/1364811638.db2.gz	QLQJKYWLHNKQTC-GDBMZVCRSA-N	0	3	333.476	3.086	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@@H]1CN(Cc2c(C)noc2C)C[C@H]1C	ZINC001102263024	1364975591	/nfs/dbraw/zinc/97/55/91/1364975591.db2.gz	SDYXABXEAUUZOY-KBRIMQKVSA-N	0	3	333.476	3.078	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](NCc3ccnc(Cl)c3)C2)CC1	ZINC001185439134	1387717675	/nfs/dbraw/zinc/71/76/75/1387717675.db2.gz	MJSCZQXMADPDCU-OAHLLOKOSA-N	0	3	333.863	3.172	20	30		EGEDHN
C=C[C@@H](C(=O)NC[C@@H]1CN(C/C=C\Cl)C[C@H]1C)c1ccccc1	ZINC001102592020	1365128017	/nfs/dbraw/zinc/12/80/17/1365128017.db2.gz	JENAJJZKUUSMBB-NIMPBHAVSA-N	0	3	332.875	3.393	20	30		EGEDHN
C[C@@H](CC(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C)C1CC1	ZINC001102604142	1365132443	/nfs/dbraw/zinc/13/24/43/1365132443.db2.gz	KKLZVUWLWJEVSY-WAOWUJCRSA-N	0	3	338.495	3.158	20	30		EGEDHN
C#CCC1(C(=O)NC[C@@H]2CN(C/C=C/Cl)C[C@H]2C)CCCCC1	ZINC001102607587	1365135092	/nfs/dbraw/zinc/13/50/92/1365135092.db2.gz	LQRFJTZGVJRKBU-FRFGOACMSA-N	0	3	336.907	3.397	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCC[C@@H]1CN(Cc2cnc(C)o2)C[C@H]1C	ZINC001103022120	1365341310	/nfs/dbraw/zinc/34/13/10/1365341310.db2.gz	ZXRJABURWZJKDG-CRAIPNDOSA-N	0	3	345.487	3.326	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)C[C@@H](OCC)C(C)C)C1	ZINC001103082658	1365370212	/nfs/dbraw/zinc/37/02/12/1365370212.db2.gz	XWATZGMMRVCQIW-DJIMGWMZSA-N	0	3	344.927	3.264	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cnoc2C(C)C)C1	ZINC001103601553	1365667405	/nfs/dbraw/zinc/66/74/05/1365667405.db2.gz	XVZYQFQBKVHIPS-TZMCWYRMSA-N	0	3	339.867	3.238	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2cccc(Cl)n2)C1	ZINC001104124538	1365918554	/nfs/dbraw/zinc/91/85/54/1365918554.db2.gz	MIXFSBBRLGSKCD-HZPDHXFCSA-N	0	3	347.890	3.113	20	30		EGEDHN
CC/C(C)=C/C(=O)N1C[C@@H](C)[C@H](CCNCc2ccccc2C#N)C1	ZINC001104160532	1365931183	/nfs/dbraw/zinc/93/11/83/1365931183.db2.gz	XHNMTZZXOOMRJQ-XVPIGVPKSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)CCc2cncc(C)c2)C[C@H]1C	ZINC001104405719	1366008267	/nfs/dbraw/zinc/00/82/67/1366008267.db2.gz	INPOBJYEZIOAKF-CRAIPNDOSA-N	0	3	349.906	3.149	20	30		EGEDHN
C#CCCCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2cc(C)no2)C1	ZINC001104493915	1366047756	/nfs/dbraw/zinc/04/77/56/1366047756.db2.gz	SJWZWVQOZHUKJN-SJLPKXTDSA-N	0	3	345.487	3.141	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@@H](C)[C@H](CCNCc2conc2CC)C1	ZINC001104563015	1366077631	/nfs/dbraw/zinc/07/76/31/1366077631.db2.gz	HIJYBWBDJJXPDO-BRWVUGGUSA-N	0	3	347.503	3.414	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H](C)[C@H](CCNCc2conc2C)C1	ZINC001104631476	1366110262	/nfs/dbraw/zinc/11/02/62/1366110262.db2.gz	OSWKYWSBROEZFD-IDHHARJASA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)CC[C@@H]2CCCCO2)C[C@H]1C	ZINC001104744303	1366154229	/nfs/dbraw/zinc/15/42/29/1366154229.db2.gz	GIGJTMCXLOEQDA-OIISXLGYSA-N	0	3	342.911	3.162	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)[C@@H](C)Cc2ccco2)C[C@H]1C	ZINC001104782537	1366170285	/nfs/dbraw/zinc/17/02/85/1366170285.db2.gz	HGQINUVIYSIEFS-SQWLQELKSA-N	0	3	338.879	3.285	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)CC[C@@H]2CCCOC2)C[C@H]1C	ZINC001104850760	1366199603	/nfs/dbraw/zinc/19/96/03/1366199603.db2.gz	LZIJBOWDRPHLJE-HYVNUMGLSA-N	0	3	342.911	3.020	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)[C@@H](C)CC(F)F)CC1	ZINC001105394245	1366443261	/nfs/dbraw/zinc/44/32/61/1366443261.db2.gz	RNSPUTQMSGZJHL-WMLDXEAASA-N	0	3	338.442	3.004	20	30		EGEDHN
C=CCCC(=O)N1CCCC[C@@H]1C1(CNCc2ccn(C)n2)CCC1	ZINC001105522801	1366507825	/nfs/dbraw/zinc/50/78/25/1366507825.db2.gz	ONJVBALIOSZYEN-GOSISDBHSA-N	0	3	344.503	3.027	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](CNCc2ccn(C(CC)CC)n2)[C@H](C)C1	ZINC001105929002	1366599585	/nfs/dbraw/zinc/59/95/85/1366599585.db2.gz	CPZDSCNEOHBVNP-IAGOWNOFSA-N	0	3	346.519	3.395	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@@H](CNCc2cc(C3CC3)no2)[C@H](C)C1	ZINC001106567759	1366739775	/nfs/dbraw/zinc/73/97/75/1366739775.db2.gz	RVIJADNEBODVCF-HLLBOEOZSA-N	0	3	345.487	3.338	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@]12CCC[C@H]1N(Cc1c(C)noc1C)CC2	ZINC001107495284	1366994428	/nfs/dbraw/zinc/99/44/28/1366994428.db2.gz	NBJBOUOSIOYXMQ-YLJYHZDGSA-N	0	3	345.487	3.364	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2[C@@H](C)c1cccc(OC)c1	ZINC001109204255	1367000755	/nfs/dbraw/zinc/00/07/55/1367000755.db2.gz	JAPPHILPWITCCS-RKOGWWSCSA-N	0	3	340.467	3.281	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCN(C(=O)/C=C/C(C)(C)C)C1	ZINC001189437745	1367021676	/nfs/dbraw/zinc/02/16/76/1367021676.db2.gz	HWTZHOKCZOCGEK-CKDFRHGISA-N	0	3	325.456	3.193	20	30		EGEDHN
O=C(C#CC1CC1)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccccc1C1CC1	ZINC001109257727	1367028640	/nfs/dbraw/zinc/02/86/40/1367028640.db2.gz	KPKDEERJTLXMBC-GIVPXCGWSA-N	0	3	334.463	3.199	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1c(C)noc1CCC)C2	ZINC001109273155	1367036856	/nfs/dbraw/zinc/03/68/56/1367036856.db2.gz	YUEGXZOWPPIVNK-PMPSAXMXSA-N	0	3	331.460	3.237	20	30		EGEDHN
CC[C@@H](CC(=O)NC[C@]12CCC[C@H]1N(CC#CCOC)CC2)C(C)C	ZINC001107611884	1367071890	/nfs/dbraw/zinc/07/18/90/1367071890.db2.gz	IKPUUMQBGPONKH-QKNQBKEWSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCOc1ccc(C)c(C)c1)C2	ZINC001109373636	1367092582	/nfs/dbraw/zinc/09/25/82/1367092582.db2.gz	NQHRYHBUMAXUQQ-HOJAQTOUSA-N	0	3	342.483	3.370	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](N(C)CCOc2ccc(C)cc2)C1	ZINC001189751916	1367102691	/nfs/dbraw/zinc/10/26/91/1367102691.db2.gz	KKWTUDKCXCEQQR-IBGZPJMESA-N	0	3	342.483	3.100	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2sccc2C)C1	ZINC001107698345	1367107290	/nfs/dbraw/zinc/10/72/90/1367107290.db2.gz	OPBBYACYSVIRDY-QAPCUYQASA-N	0	3	336.501	3.232	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2cccc(F)c2)C1	ZINC001107706187	1367112137	/nfs/dbraw/zinc/11/21/37/1367112137.db2.gz	IHRKEIYLAGGOEG-BEFAXECRSA-N	0	3	334.435	3.001	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](N(C)[C@H]2CCc3c2cc(F)cc3F)C1	ZINC001189911280	1367130757	/nfs/dbraw/zinc/13/07/57/1367130757.db2.gz	ZUZIQKJBZQFHSK-KXBFYZLASA-N	0	3	346.421	3.288	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](N(C)CCOc2cc(C)ccc2C)C1	ZINC001189925663	1367132025	/nfs/dbraw/zinc/13/20/25/1367132025.db2.gz	DSSUKGDNVBWWHG-LJQANCHMSA-N	0	3	342.483	3.018	20	30		EGEDHN
C[C@H](c1cccc(F)c1)N(C)[C@H]1CCN(C(=O)C#CC(C)(C)C)C1	ZINC001190084604	1367168500	/nfs/dbraw/zinc/16/85/00/1367168500.db2.gz	QAQVLNTTXDYGHK-QAPCUYQASA-N	0	3	330.447	3.469	20	30		EGEDHN
COc1cccc(CN(C)[C@@H]2CCN(C(=O)C#CC(C)(C)C)C2)c1C	ZINC001190084037	1367168825	/nfs/dbraw/zinc/16/88/25/1367168825.db2.gz	JSKKXGHFZZHISH-GOSISDBHSA-N	0	3	342.483	3.086	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)C2C(C)(C)C2(C)C)C1	ZINC001107846204	1367172118	/nfs/dbraw/zinc/17/21/18/1367172118.db2.gz	QNFWJNFPUWZZRA-FOIQADDNSA-N	0	3	336.520	3.230	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)C(C)=C2CCCC2)C1	ZINC001107859893	1367179182	/nfs/dbraw/zinc/17/91/82/1367179182.db2.gz	GKSBHPSQXDKUKV-OXJNMPFZSA-N	0	3	334.504	3.439	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NC[C@@]1(C)CN(C[C@@H](C)CC)CCO1	ZINC001107971458	1367224402	/nfs/dbraw/zinc/22/44/02/1367224402.db2.gz	SPIHSDVXIGLWIQ-GUYCJALGSA-N	0	3	330.900	3.018	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCc1ccc(OC)cc1	ZINC001109605759	1367228086	/nfs/dbraw/zinc/22/80/86/1367228086.db2.gz	PSWJEJMABFKCLV-NEWSRXKRSA-N	0	3	342.483	3.171	20	30		EGEDHN
C#CCC1(C(=O)NC[C@]2(C)CN(C[C@H](C)CC(C)C)CCO2)CCC1	ZINC001107990925	1367231733	/nfs/dbraw/zinc/23/17/33/1367231733.db2.gz	QWIGGBHFMJIRJT-UYAOXDASSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001190387162	1367247693	/nfs/dbraw/zinc/24/76/93/1367247693.db2.gz	AEEUYVFEWDNUHR-SFHVURJKSA-N	0	3	325.456	3.193	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2ccc(CCC)s2)C1	ZINC001190388154	1367248398	/nfs/dbraw/zinc/24/83/98/1367248398.db2.gz	KZDBGGGRERPRLK-OAHLLOKOSA-N	0	3	336.501	3.050	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)C23CCC(CC2)C3)C1	ZINC001108030144	1367249857	/nfs/dbraw/zinc/24/98/57/1367249857.db2.gz	BBGQZTVWCOFSQJ-AILXTGBUSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](N(C)Cc2cccc(OC)c2)C1	ZINC001190398196	1367253722	/nfs/dbraw/zinc/25/37/22/1367253722.db2.gz	RYQYNHLNEOMZQO-QGZVFWFLSA-N	0	3	330.472	3.330	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CC(C1CCC1)C1CCC1)C2	ZINC001109726273	1367294033	/nfs/dbraw/zinc/29/40/33/1367294033.db2.gz	NSGVSKLHTWWITC-HOJAQTOUSA-N	0	3	328.500	3.338	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](C)CC1CCCC1)C2	ZINC001109795082	1367327232	/nfs/dbraw/zinc/32/72/32/1367327232.db2.gz	VCWAEOMMLGAIGR-NQYYFHDYSA-N	0	3	334.504	3.127	20	30		EGEDHN
C=CCC[C@H](C)N1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1snnc1C(C)C)C2	ZINC001109872658	1367373070	/nfs/dbraw/zinc/37/30/70/1367373070.db2.gz	YMUKJBBRMUXBBD-XGUBFFRZSA-N	0	3	348.516	3.351	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2csc(C)c2)C1	ZINC001108280705	1367377833	/nfs/dbraw/zinc/37/78/33/1367377833.db2.gz	XPXMIARJGVGPCO-KDOFPFPSSA-N	0	3	336.501	3.232	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCCOc1cccc(C)c1)C2	ZINC001110064417	1367489629	/nfs/dbraw/zinc/48/96/29/1367489629.db2.gz	KOOSZVUGVPQAEU-HOJAQTOUSA-N	0	3	342.483	3.452	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](CC)c1ccc(OC)cc1)C2	ZINC001110137050	1367519730	/nfs/dbraw/zinc/51/97/30/1367519730.db2.gz	YTJQCQIVURILAJ-GTAWCEEGSA-N	0	3	342.483	3.486	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](N(C)CCOc2cc(C)cc(C)c2)C1	ZINC001191727658	1367571294	/nfs/dbraw/zinc/57/12/94/1367571294.db2.gz	PBPYKYOHSQVYTB-SFHVURJKSA-N	0	3	344.499	3.427	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](N(C)C[C@@H](OC)c2ccccc2)C1	ZINC001191859917	1367616447	/nfs/dbraw/zinc/61/64/47/1367616447.db2.gz	SVJUNGXXMLDFGR-WOJBJXKFSA-N	0	3	342.483	3.100	20	30		EGEDHN
Cc1cccc([C@@H](C)N2[C@@H]3CC[C@H]2[C@@H](NC(=O)CSCC#N)C3)c1	ZINC001108952404	1367680010	/nfs/dbraw/zinc/68/00/10/1367680010.db2.gz	YPUYZJUXGDVGDL-BGTYHANMSA-N	0	3	343.496	3.034	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](N(C)Cc2ccccc2N(C)C)C1	ZINC001192073756	1367682049	/nfs/dbraw/zinc/68/20/49/1367682049.db2.gz	WJNLDEKHYMDQDS-SFHVURJKSA-N	0	3	329.488	3.142	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](N(C)Cc3ccc(OC)cc3)C2)CC1	ZINC001192181574	1367709423	/nfs/dbraw/zinc/70/94/23/1367709423.db2.gz	VZUCWAHSPKCQLO-GOSISDBHSA-N	0	3	342.483	3.474	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)C[C@H](C)CCC=C(C)C)C1	ZINC001192472027	1367792105	/nfs/dbraw/zinc/79/21/05/1367792105.db2.gz	JIIHHBZNETVOGJ-RTBURBONSA-N	0	3	336.520	3.494	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCCc1ccccc1Cl)C2	ZINC001110639601	1367885223	/nfs/dbraw/zinc/88/52/23/1367885223.db2.gz	PKNFBZITLSSUQJ-QRQLOZEOSA-N	0	3	344.886	3.408	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](C)CCc1ccc(F)cc1)C2	ZINC001110645824	1367888840	/nfs/dbraw/zinc/88/88/40/1367888840.db2.gz	OAGBIWKMMMNSPK-XLNTUCKNSA-N	0	3	342.458	3.139	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2cccc(C(C)(C)C)c2)C1	ZINC001192998592	1367919576	/nfs/dbraw/zinc/91/95/76/1367919576.db2.gz	LYHHMUUUMGGZRG-IBGZPJMESA-N	0	3	344.499	3.333	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CN([C@@H](C)c2cc(C)ccc2C)C[C@H]1O	ZINC001193345597	1368004078	/nfs/dbraw/zinc/00/40/78/1368004078.db2.gz	RHNWKONJHPELQC-QXAKKESOSA-N	0	3	344.499	3.128	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCCOc1ccccc1	ZINC001110898512	1368072590	/nfs/dbraw/zinc/07/25/90/1368072590.db2.gz	ILGJSLXHDZIRPK-QRQLOZEOSA-N	0	3	342.483	3.389	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2cc3c(cccc3C)o2)C1	ZINC001194346112	1368239188	/nfs/dbraw/zinc/23/91/88/1368239188.db2.gz	PRTZQFCMQOHYLP-MRXNPFEDSA-N	0	3	342.439	3.090	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1sccc1COC)C2	ZINC001111273113	1368239878	/nfs/dbraw/zinc/23/98/78/1368239878.db2.gz	ADDDHFWRBPRNOT-OAGGEKHMSA-N	0	3	334.485	3.196	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](C)CCC(C)(C)C)C2	ZINC001111279893	1368247905	/nfs/dbraw/zinc/24/79/05/1368247905.db2.gz	KUSNDAGOKRJLGB-TVFCKZIOSA-N	0	3	336.520	3.373	20	30		EGEDHN
C=CCCOCC(=O)N1CC[C@H](N(C)Cc2cc3ccccc3o2)C1	ZINC001194382454	1368249774	/nfs/dbraw/zinc/24/97/74/1368249774.db2.gz	ZYKIQUAGYHKAGT-KRWDZBQOSA-N	0	3	342.439	3.058	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N1CC[C@@H](N(C)Cc2cc3ccccc3o2)C1	ZINC001194397202	1368252096	/nfs/dbraw/zinc/25/20/96/1368252096.db2.gz	QONNYDUYXCJGBX-NVXWUHKLSA-N	0	3	342.439	3.057	20	30		EGEDHN
C=CCC[C@H](C(=O)N1CC[C@@H](N(C)CCOCC)C1)c1ccccc1	ZINC001194555062	1368285006	/nfs/dbraw/zinc/28/50/06/1368285006.db2.gz	ICKORAGXECDOIL-UXHICEINSA-N	0	3	344.499	3.306	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](N(C)C[C@@H]3CC(C)(C)CO3)C2)CCCC1	ZINC001194565789	1368287781	/nfs/dbraw/zinc/28/77/81/1368287781.db2.gz	ADJWCCITHKODHO-MSOLQXFVSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccccc1CC	ZINC001111489928	1368319398	/nfs/dbraw/zinc/31/93/98/1368319398.db2.gz	OHQMBULTFDMWMJ-XLNTUCKNSA-N	0	3	342.483	3.062	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)C[C@@H](NC(=O)/C(C)=C/C)c1ccccc1O2	ZINC001111529811	1368329236	/nfs/dbraw/zinc/32/92/36/1368329236.db2.gz	QBNAJOOJOGTSQO-NGPXOYCESA-N	0	3	338.451	3.060	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)C[C@H](NC(=O)/C(C)=C\C)c1ccccc1O2	ZINC001111529813	1368329380	/nfs/dbraw/zinc/32/93/80/1368329380.db2.gz	QBNAJOOJOGTSQO-XKMARKQASA-N	0	3	338.451	3.060	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CCCN(Cc2cc(C)ccc2C)CC1	ZINC001195174725	1368393054	/nfs/dbraw/zinc/39/30/54/1368393054.db2.gz	RVLWSXJTXBEKFK-IBGZPJMESA-N	0	3	344.499	3.319	20	30		EGEDHN
C=CCCC(=O)N1CCCN(CCCOc2ccc(F)cc2)CC1	ZINC001195182678	1368396127	/nfs/dbraw/zinc/39/61/27/1368396127.db2.gz	TVQRZCNOFLDTJT-UHFFFAOYSA-N	0	3	334.435	3.095	20	30		EGEDHN
C=CCCC(=O)N[C@]12CCC[C@H]1CN(Cc1ccc3c(c1)COC3)C2	ZINC001111648502	1368410926	/nfs/dbraw/zinc/41/09/26/1368410926.db2.gz	BCMIRCJUUIVUMC-FPOVZHCZSA-N	0	3	340.467	3.154	20	30		EGEDHN
C#CCCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1cccc(C#N)c1)C2	ZINC001111711236	1368427168	/nfs/dbraw/zinc/42/71/68/1368427168.db2.gz	JDUBEOPZCQVSHJ-UNMCSNQZSA-N	0	3	349.478	3.223	20	30		EGEDHN
C#CCCCCC(=O)N[C@]12CCC[C@H]1CN(CCC(F)(F)F)C2	ZINC001111713156	1368428895	/nfs/dbraw/zinc/42/88/95/1368428895.db2.gz	XCXMUBLNDZSUHE-HOCLYGCPSA-N	0	3	330.394	3.103	20	30		EGEDHN
C#CCN1C[C@@H]2CCC[C@]2(NC(=O)CCCc2ccccc2Cl)C1	ZINC001111772743	1368454654	/nfs/dbraw/zinc/45/46/54/1368454654.db2.gz	PJDCDCBLHZEOAE-PXNSSMCTSA-N	0	3	344.886	3.267	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)COCCCCCCCC)C1	ZINC001111778267	1368457482	/nfs/dbraw/zinc/45/74/82/1368457482.db2.gz	RJRHKTYIZNZUED-FPOVZHCZSA-N	0	3	348.531	3.358	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)C/C=C/c2ccccc2F)C1	ZINC001111788918	1368462857	/nfs/dbraw/zinc/46/28/57/1368462857.db2.gz	OXDQPWFTTNSSGE-PAHIGIFOSA-N	0	3	340.442	3.223	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CCC[C@]3(NC(=O)CCC(F)F)C2)c1	ZINC001111809532	1368474633	/nfs/dbraw/zinc/47/46/33/1368474633.db2.gz	CGDGHPMTSHTDIA-LPHOPBHVSA-N	0	3	347.409	3.074	20	30		EGEDHN
CC(C)C#CC(=O)N1CCCN(CC2CCC(F)(F)CC2)CC1	ZINC001195774889	1368487453	/nfs/dbraw/zinc/48/74/53/1368487453.db2.gz	GLYGDFSDSWDWJP-UHFFFAOYSA-N	0	3	326.431	3.006	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@]12CCC[C@H]1CN(CCc1ccns1)C2	ZINC001111846968	1368500985	/nfs/dbraw/zinc/50/09/85/1368500985.db2.gz	GEEOXMUMYONMBJ-BXWFABGCSA-N	0	3	347.528	3.259	20	30		EGEDHN
C=CCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1c(C)noc1CC)C2	ZINC001111859037	1368509495	/nfs/dbraw/zinc/50/94/95/1368509495.db2.gz	KWBJXEUITUDOID-JXFKEZNVSA-N	0	3	345.487	3.372	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)CCCCc2ccccc2)C1	ZINC001111860211	1368510327	/nfs/dbraw/zinc/51/03/27/1368510327.db2.gz	VVCSDGJJZZTOMT-UNMCSNQZSA-N	0	3	338.495	3.393	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCCN(CCC[C@H]2CCOC2)CC1	ZINC001195966549	1368524754	/nfs/dbraw/zinc/52/47/54/1368524754.db2.gz	KWEMKGDFOKXIBP-SFHVURJKSA-N	0	3	334.504	3.106	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2conc2C2CCCC2)CC1	ZINC001196107485	1368550314	/nfs/dbraw/zinc/55/03/14/1368550314.db2.gz	OLJZUQYXSPXPJJ-UHFFFAOYSA-N	0	3	331.460	3.446	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cnn(C)c2CCC)CC1	ZINC001196409136	1368608778	/nfs/dbraw/zinc/60/87/78/1368608778.db2.gz	OFKUADCGRGPEAR-UHFFFAOYSA-N	0	3	346.519	3.267	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)CC2CCCCCC2)C1	ZINC001196437333	1368614845	/nfs/dbraw/zinc/61/48/45/1368614845.db2.gz	UTGOYLGUPOVWIF-RTBURBONSA-N	0	3	336.520	3.255	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H](C)Cc2ccc(C)cc2)C1	ZINC001112013752	1368618340	/nfs/dbraw/zinc/61/83/40/1368618340.db2.gz	FAFLFHJMPXQNAQ-CUWPLCDZSA-N	0	3	326.484	3.330	20	30		EGEDHN
C=CCC[C@@H](C)N1CCCN(C(=O)c2nc3cnccc3s2)CC1	ZINC001196480929	1368624379	/nfs/dbraw/zinc/62/43/79/1368624379.db2.gz	SGXXOPLUVHAFKN-CQSZACIVSA-N	0	3	344.484	3.194	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C(F)(F)F)[C@H](NCCC(F)(F)F)C1	ZINC001112143049	1368679188	/nfs/dbraw/zinc/67/91/88/1368679188.db2.gz	GJBDGMKLPAHFBM-NXEZZACHSA-N	0	3	346.315	3.130	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCCN(CCc2ccc(OC)cc2)CC1	ZINC001196900998	1368710187	/nfs/dbraw/zinc/71/01/87/1368710187.db2.gz	JSUQSOJULBBTIA-GOSISDBHSA-N	0	3	344.499	3.374	20	30		EGEDHN
C=C(C)CN1CCCN(C(=O)CCCOCc2ccccc2)CC1	ZINC001196984666	1368725963	/nfs/dbraw/zinc/72/59/63/1368725963.db2.gz	KDOMHYFSKJWXRY-UHFFFAOYSA-N	0	3	330.472	3.094	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)C2(CC=C)CCCC2)C[C@H]1C(F)(F)F	ZINC001112220165	1368728902	/nfs/dbraw/zinc/72/89/02/1368728902.db2.gz	OYAQIGLDNWEHKD-HUUCEWRRSA-N	0	3	342.405	3.125	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2nc(CC)oc2C)CC1	ZINC001197411452	1368808540	/nfs/dbraw/zinc/80/85/40/1368808540.db2.gz	RXFSVILPCRCDIY-UHFFFAOYSA-N	0	3	333.476	3.440	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)c2cccc(C(C)C)c2)C1	ZINC001197441974	1368815972	/nfs/dbraw/zinc/81/59/72/1368815972.db2.gz	PAFPUJXBPBCYMJ-WOJBJXKFSA-N	0	3	344.499	3.331	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2cc3cccnc3s2)CC1	ZINC001197677111	1368871789	/nfs/dbraw/zinc/87/17/89/1368871789.db2.gz	WXNYHZWBLKTMQO-UHFFFAOYSA-N	0	3	329.469	3.410	20	30		EGEDHN
C=CCC1(C(=O)N2CCCN(CC3=CCCCC3)CC2)CCOCC1	ZINC001197994648	1368938735	/nfs/dbraw/zinc/93/87/35/1368938735.db2.gz	BLQRSBBHRUVNKU-UHFFFAOYSA-N	0	3	346.515	3.394	20	30		EGEDHN
CC(C)C[C@H]1CN(C)CCN1Cc1ccc(C#N)cc1OC(F)F	ZINC001198084349	1368956633	/nfs/dbraw/zinc/95/66/33/1368956633.db2.gz	GVLFBNWFPKWTHC-INIZCTEOSA-N	0	3	337.414	3.322	20	30		EGEDHN
CCCCCCCC[C@H](C)C(=O)N1CCCN(C[C@@H](C)O)CC1	ZINC001198197576	1368978899	/nfs/dbraw/zinc/97/88/99/1368978899.db2.gz	PZLPRRJYENZNDZ-ZWKOTPCHSA-N	0	3	326.525	3.288	20	30		EGEDHN
C=C[C@H](CC(=O)N1CCCN(CCC[C@@H](C)O)CC1)c1ccccc1	ZINC001198214640	1368982429	/nfs/dbraw/zinc/98/24/29/1368982429.db2.gz	UNIQGBUAQYEHPG-RTBURBONSA-N	0	3	344.499	3.042	20	30		EGEDHN
C=CCC1(C(=O)N2CCCN(CCCCOC)CC2)CCCCC1	ZINC001198222328	1368983674	/nfs/dbraw/zinc/98/36/74/1368983674.db2.gz	XVXQBDLAFICQJF-UHFFFAOYSA-N	0	3	336.520	3.474	20	30		EGEDHN
C=CCC[C@@H](C)N[C@H](CNC(=O)CCOCC)c1ccccc1OC	ZINC001198606276	1369072075	/nfs/dbraw/zinc/07/20/75/1369072075.db2.gz	PSGSTMBJMFFZAI-SJLPKXTDSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)CC[C@H](C)OC)c1ccccc1OC	ZINC001198676788	1369088571	/nfs/dbraw/zinc/08/85/71/1369088571.db2.gz	CYYSBEUEGYTVOO-FUHWJXTLSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)Cc1ccoc1)c1ccccc1OC	ZINC001198685710	1369090986	/nfs/dbraw/zinc/09/09/86/1369090986.db2.gz	DEEGASYVGITNHP-SFHVURJKSA-N	0	3	342.439	3.244	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)c1ccoc1CC)c1ccccc1OC	ZINC001198705935	1369095002	/nfs/dbraw/zinc/09/50/02/1369095002.db2.gz	TXYMYNOLSMOAJB-QGZVFWFLSA-N	0	3	342.439	3.487	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)C1(C(F)F)CC1)c1ccccc1OC	ZINC001198723696	1369100014	/nfs/dbraw/zinc/10/00/14/1369100014.db2.gz	IMHVIJLYWJJEHG-AWEZNQCLSA-N	0	3	338.398	3.064	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)CCC(F)F)c1ccccc1OC	ZINC001198795300	1369116314	/nfs/dbraw/zinc/11/63/14/1369116314.db2.gz	CLPOQCXFIQKKMJ-HNNXBMFYSA-N	0	3	340.414	3.454	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)C(C)(C)COC)c1ccccc1OC	ZINC001198796048	1369116888	/nfs/dbraw/zinc/11/68/88/1369116888.db2.gz	IOQPIMCNRBGRMZ-QGZVFWFLSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)C1(CCF)CC1)c1ccccc1OC	ZINC001198805496	1369118529	/nfs/dbraw/zinc/11/85/29/1369118529.db2.gz	AAPVZNQMPSXDOG-MRXNPFEDSA-N	0	3	334.435	3.158	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H](NCCCCOC)c1ccccc1OC	ZINC001198876338	1369137376	/nfs/dbraw/zinc/13/73/76/1369137376.db2.gz	RCUDFMSRGVAQKD-GOSISDBHSA-N	0	3	348.487	3.225	20	30		EGEDHN
CCCCCCCC[C@H](C)C(=O)N[C@@H]1CN(CCC2CC2)C[C@H]1O	ZINC001198904652	1369145012	/nfs/dbraw/zinc/14/50/12/1369145012.db2.gz	IXPKJJXXPJJVLS-QXAKKESOSA-N	0	3	338.536	3.335	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)[C@@H]1CC12CC2)c1ccccc1OC	ZINC001198916734	1369148767	/nfs/dbraw/zinc/14/87/67/1369148767.db2.gz	SJGBXOMYKNIIRZ-DLBZAZTESA-N	0	3	328.456	3.208	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@@H]1C[C@H]1C1CC1)c1ccccc1OC	ZINC001198932638	1369151862	/nfs/dbraw/zinc/15/18/62/1369151862.db2.gz	QXNYPAFSUGYKNB-KSZLIROESA-N	0	3	328.456	3.064	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@H](C)c2ccccc2C)C1	ZINC001198940952	1369153324	/nfs/dbraw/zinc/15/33/24/1369153324.db2.gz	WQTVAJVRLLKJKJ-MISYRCLQSA-N	0	3	344.499	3.006	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CC/C=C/CC)C[C@H]2O)CCCCC1	ZINC001198944864	1369154135	/nfs/dbraw/zinc/15/41/35/1369154135.db2.gz	PGVZSALXBWPHBX-PJHKVULZSA-N	0	3	334.504	3.031	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)c2ccc(F)c3ccncc23)CC1	ZINC001113246240	1369288979	/nfs/dbraw/zinc/28/89/79/1369288979.db2.gz	JYHYEIDBXOAGAM-OAHLLOKOSA-N	0	3	341.430	3.486	20	30		EGEDHN
C=CCCC(=O)N1CCCO[C@@H](CNCc2ccccc2Cl)C1	ZINC001200083631	1369313662	/nfs/dbraw/zinc/31/36/62/1369313662.db2.gz	MKTLVOSWYKRSFL-INIZCTEOSA-N	0	3	336.863	3.013	20	30		EGEDHN
C#CCCCC(=O)N1CCC(NCc2c(F)cccc2Cl)CC1	ZINC001200317633	1369347148	/nfs/dbraw/zinc/34/71/48/1369347148.db2.gz	YOQIGMZCSUDIDS-UHFFFAOYSA-N	0	3	336.838	3.363	20	30		EGEDHN
C#CCCCC(=O)N1CCC(N[C@@H](C)c2nc3ccccc3o2)CC1	ZINC001200325147	1369349100	/nfs/dbraw/zinc/34/91/00/1369349100.db2.gz	PGTYEDGEVLQFJM-HNNXBMFYSA-N	0	3	339.439	3.273	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCCO[C@H](CNCc2ccsc2)C1	ZINC001200591430	1369397081	/nfs/dbraw/zinc/39/70/81/1369397081.db2.gz	YTXFAPDNZXFIJO-GOSISDBHSA-N	0	3	348.512	3.224	20	30		EGEDHN
C=CCc1c(F)c(F)c(C(=O)N(C)CCN2CCCC2)c(F)c1F	ZINC001186722895	1388000276	/nfs/dbraw/zinc/00/02/76/1388000276.db2.gz	IZDZAZJAJZRTMG-UHFFFAOYSA-N	0	3	344.352	3.139	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC(NCc2ccn(C(C)C)n2)CC1	ZINC001200747991	1369422771	/nfs/dbraw/zinc/42/27/71/1369422771.db2.gz	RREXLVQNZYPZBB-UHFFFAOYSA-N	0	3	344.503	3.313	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)c2c[nH]c3ccc(F)cc23)CC1	ZINC001113735197	1369595197	/nfs/dbraw/zinc/59/51/97/1369595197.db2.gz	JJPRLEOMUCUZCU-CQSZACIVSA-N	0	3	329.419	3.420	20	30		EGEDHN
CCCCCCCCN1C[C@H]2C[C@@H](C(=O)NCc3ccco3)[C@@H](C1)O2	ZINC001201826032	1369629816	/nfs/dbraw/zinc/62/98/16/1369629816.db2.gz	LAECREJQOMTOJC-GUDVDZBRSA-N	0	3	348.487	3.346	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001202085778	1369685069	/nfs/dbraw/zinc/68/50/69/1369685069.db2.gz	ZMSRHEMMIIWVDL-HZPDHXFCSA-N	0	3	325.456	3.097	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)N1CCC(NCc2ccncc2Cl)CC1	ZINC001202092791	1369686298	/nfs/dbraw/zinc/68/62/98/1369686298.db2.gz	RHHOCOSVJANOAZ-ZIAGYGMSSA-N	0	3	335.879	3.274	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC(NCc2oc(CC)nc2C)CC1	ZINC001202122461	1369691755	/nfs/dbraw/zinc/69/17/55/1369691755.db2.gz	BRVQRDASFDKFHY-CQSZACIVSA-N	0	3	333.476	3.228	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(NCc3conc3CC)CC2)CCC1	ZINC001202365275	1369751634	/nfs/dbraw/zinc/75/16/34/1369751634.db2.gz	MADACTKJAGAXOA-UHFFFAOYSA-N	0	3	331.460	3.064	20	30		EGEDHN
CCCC1(C(=O)N2CCC(NCc3ccccc3C#N)CC2)CC1	ZINC001202397978	1369760208	/nfs/dbraw/zinc/76/02/08/1369760208.db2.gz	ISPFUHZHUZRNIK-UHFFFAOYSA-N	0	3	325.456	3.219	20	30		EGEDHN
CC(C)CCC(=O)N[C@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202448533	1369775504	/nfs/dbraw/zinc/77/55/04/1369775504.db2.gz	RICCTUCDSMQMEF-PMACEKPBSA-N	0	3	338.495	3.491	20	30		EGEDHN
CC(C)(C)CC(=O)N[C@@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202502500	1369793122	/nfs/dbraw/zinc/79/31/22/1369793122.db2.gz	UYRUZFUJRKKPSB-RBUKOAKNSA-N	0	3	338.495	3.491	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@H](NCc2cc(C#N)ccc2F)C12CCC2	ZINC001202600397	1369819247	/nfs/dbraw/zinc/81/92/47/1369819247.db2.gz	UAWHAPGKFROLCZ-ZWKOTPCHSA-N	0	3	341.430	3.181	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@H](NCc2c(C)noc2CC)C12CCC2	ZINC001202618030	1369825730	/nfs/dbraw/zinc/82/57/30/1369825730.db2.gz	RPQCBLNYHRVQLO-DLBZAZTESA-N	0	3	331.460	3.029	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@@H](NCc2cc(F)ccc2OC)C12CCC2	ZINC001202625993	1369829941	/nfs/dbraw/zinc/82/99/41/1369829941.db2.gz	RCJYMPMKBRZFAV-MSOLQXFVSA-N	0	3	346.446	3.318	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1[C@H]2CN([C@@H](C)c3cccc(OC)c3)C[C@H]21	ZINC001114353699	1369907898	/nfs/dbraw/zinc/90/78/98/1369907898.db2.gz	YEQXPYGPSAKLMZ-FEUVXWNVSA-N	0	3	328.456	3.159	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1[C@H]2CN(CCc3ccccc3Cl)C[C@H]21	ZINC001114352848	1369907909	/nfs/dbraw/zinc/90/79/09/1369907909.db2.gz	IFCRATZAEJKIFM-MNZLEMJZSA-N	0	3	332.875	3.285	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1C[C@@H](NCc2cnoc2C)C12CCC2	ZINC001202952643	1369935131	/nfs/dbraw/zinc/93/51/31/1369935131.db2.gz	YFKUGMUYDDTECC-MSOLQXFVSA-N	0	3	343.471	3.268	20	30		EGEDHN
CC(C)C[C@@H](C)CC(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C1	ZINC001187004175	1388038550	/nfs/dbraw/zinc/03/85/50/1388038550.db2.gz	KNZHUFGIISIWPQ-HUUCEWRRSA-N	0	3	333.501	3.383	20	30		EGEDHN
CC(C)C[C@H](C)CC(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C1	ZINC001187004176	1388038942	/nfs/dbraw/zinc/03/89/42/1388038942.db2.gz	KNZHUFGIISIWPQ-LSDHHAIUSA-N	0	3	333.501	3.383	20	30		EGEDHN
O=C(N[C@@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2)C1(C2CC2)CC1	ZINC001203050911	1369966914	/nfs/dbraw/zinc/96/69/14/1369966914.db2.gz	HFBSBJYFLHCWGA-VQTJNVASSA-N	0	3	348.490	3.245	20	30		EGEDHN
N#Cc1ccccc1O[C@H]1CCCN(Cc2cccc3nonc32)C1	ZINC001203141290	1369997208	/nfs/dbraw/zinc/99/72/08/1369997208.db2.gz	ZRYLIYFUOMOWJV-INIZCTEOSA-N	0	3	334.379	3.138	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2[C@H]3CN(Cc4ccc(CF)cc4)C[C@H]32)CC1	ZINC001114794767	1370084898	/nfs/dbraw/zinc/08/48/98/1370084898.db2.gz	PFTXOJDCIQMASD-BWTSREIZSA-N	0	3	342.458	3.449	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1C[C@H](NCc2c(C)noc2CC)C12CCC2	ZINC001203339722	1370089020	/nfs/dbraw/zinc/08/90/20/1370089020.db2.gz	JJGRVNPQWJIUCZ-ZWKOTPCHSA-N	0	3	345.487	3.419	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1C[C@H](NCC(=C)Br)C12CCC2	ZINC001203339179	1370089124	/nfs/dbraw/zinc/08/91/24/1370089124.db2.gz	FYUKZHZGBANYOS-KBPBESRZSA-N	0	3	341.293	3.268	20	30		EGEDHN
O=C1C=C2CN(Cc3c(F)c(F)c(F)c(F)c3F)CCC2S1	ZINC001203364361	1370099315	/nfs/dbraw/zinc/09/93/15/1370099315.db2.gz	LGYUYCJFOSONBT-QMMMGPOBSA-N	0	3	335.297	3.156	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1C[C@@H](NCc2conc2CC)C12CCC2	ZINC001203450852	1370130616	/nfs/dbraw/zinc/13/06/16/1370130616.db2.gz	FPXGLWIMAHPYAC-IAGOWNOFSA-N	0	3	345.487	3.356	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1[C@H]2CN(CC[C@@H]3CC3(Cl)Cl)C[C@H]21	ZINC001114897512	1370136508	/nfs/dbraw/zinc/13/65/08/1370136508.db2.gz	ZSUYEKFUAMYTQM-MQYQWHSLSA-N	0	3	345.314	3.219	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)COc2ccccc2C)C12CCC2	ZINC001203679250	1370214959	/nfs/dbraw/zinc/21/49/59/1370214959.db2.gz	TXTBDODWGTUIQU-IAGOWNOFSA-N	0	3	348.874	3.143	20	30		EGEDHN
CC(C)CC(C)(C)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001115094833	1370275475	/nfs/dbraw/zinc/27/54/75/1370275475.db2.gz	ALHQTBKUULXNMX-BWTSREIZSA-N	0	3	339.483	3.177	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CC2)C(=O)N[C@H]3c2ccccc2)cc1	ZINC001203903680	1370307898	/nfs/dbraw/zinc/30/78/98/1370307898.db2.gz	LJIRLOATXDLIAZ-IBGZPJMESA-N	0	3	331.419	3.012	20	30		EGEDHN
C#CCC1(C(=O)N2CCC(NCc3conc3C)CC2)CCCCC1	ZINC001204008043	1370345106	/nfs/dbraw/zinc/34/51/06/1370345106.db2.gz	QKYUNFYCZVCHML-UHFFFAOYSA-N	0	3	343.471	3.037	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(NCc3nccs3)CC2)CCCC1	ZINC001204140425	1370388047	/nfs/dbraw/zinc/38/80/47/1370388047.db2.gz	QJJVSZLDLWTZQX-UHFFFAOYSA-N	0	3	333.501	3.360	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2[C@H]3CN(CCOCCC(C)C)C[C@H]32)CCCC1	ZINC001115365180	1370410545	/nfs/dbraw/zinc/41/05/45/1370410545.db2.gz	RSBNEVIFWNDQBJ-BWTSREIZSA-N	0	3	348.531	3.232	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@H]2[C@H](CCN2Cc2nccs2)C1	ZINC001204370737	1370457003	/nfs/dbraw/zinc/45/70/03/1370457003.db2.gz	JXJHFMVDYADNSS-MSOLQXFVSA-N	0	3	338.480	3.111	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)C[C@H]2CCCCO2)CCCCC1	ZINC001115476731	1370482936	/nfs/dbraw/zinc/48/29/36/1370482936.db2.gz	AKKKHYVQEQZJMB-OAHLLOKOSA-N	0	3	328.884	3.107	20	30		EGEDHN
CC[C@H](F)C(=O)NCC1(NCc2cc(C#N)ccc2F)CCCCC1	ZINC001115671467	1370652799	/nfs/dbraw/zinc/65/27/99/1370652799.db2.gz	ZLBJVOHLDZZCNZ-INIZCTEOSA-N	0	3	349.425	3.354	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCC1(NCc2cnoc2C)CCCCC1	ZINC001115680227	1370663566	/nfs/dbraw/zinc/66/35/66/1370663566.db2.gz	WBMNRRAUUKMWOZ-HUUCEWRRSA-N	0	3	333.476	3.350	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N(Cc1ccccc1)[C@@H]1CN(C(C)C)C[C@H]1O	ZINC001205175000	1370669981	/nfs/dbraw/zinc/66/99/81/1370669981.db2.gz	GKYNQWIVSQSILX-MISYRCLQSA-N	0	3	344.499	3.071	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N(Cc1ccccc1)[C@@H]1CN(CCC)C[C@H]1O	ZINC001205175249	1370670283	/nfs/dbraw/zinc/67/02/83/1370670283.db2.gz	RRMZRQQYHUZWHS-DFQSSKMNSA-N	0	3	344.499	3.073	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N(Cc1ccccc1)[C@@H]1CN(CCC)C[C@H]1O	ZINC001205181697	1370672070	/nfs/dbraw/zinc/67/20/70/1370672070.db2.gz	GXZVSTUPONERRU-SFHLNBCPSA-N	0	3	344.499	3.073	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2nccc3[nH]ccc32)CCCCC1	ZINC001115735060	1370717800	/nfs/dbraw/zinc/71/78/00/1370717800.db2.gz	NMZXJDMNWSRKPB-UHFFFAOYSA-N	0	3	346.862	3.338	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@@H](c2cccc(F)c2)[C@H](NC/C=C/Cl)C1	ZINC001205407885	1370746905	/nfs/dbraw/zinc/74/69/05/1370746905.db2.gz	JJTZXDSEVWBARV-LHSROVBZSA-N	0	3	348.849	3.122	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@H](C)C(C)C)C[C@H]1c1cccc(F)c1	ZINC001205439789	1370755747	/nfs/dbraw/zinc/75/57/47/1370755747.db2.gz	KUSPPPYUQHILQY-AYOQOUSVSA-N	0	3	330.447	3.025	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cnn3ccccc23)CCCCC1	ZINC001115776147	1370759646	/nfs/dbraw/zinc/75/96/46/1370759646.db2.gz	KURHYGZOCPJOQB-UHFFFAOYSA-N	0	3	346.862	3.109	20	30		EGEDHN
N#Cc1cc(CN2CCC3(CC2)C(=O)Nc2ccccc23)ccc1F	ZINC001205459552	1370762894	/nfs/dbraw/zinc/76/28/94/1370762894.db2.gz	ZKKONWIKNRELGG-UHFFFAOYSA-N	0	3	335.382	3.183	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)C[C@H](C)CC(C)C)[C@@H]3COC[C@@H]32)CC1	ZINC001205516743	1370778069	/nfs/dbraw/zinc/77/80/69/1370778069.db2.gz	SKDORDYPXTZYKJ-CEXWTWQISA-N	0	3	348.531	3.184	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC(CN[C@@H](C)c2cnc(C)cn2)CC1	ZINC001205988682	1370930783	/nfs/dbraw/zinc/93/07/83/1370930783.db2.gz	JWVJGUAKSBYUHL-DLBZAZTESA-N	0	3	344.503	3.277	20	30		EGEDHN
C=CCCCC(=O)N1CCC(CNCc2ccncc2Cl)CC1	ZINC001206106060	1370961173	/nfs/dbraw/zinc/96/11/73/1370961173.db2.gz	UIDBYPTYEIRGFP-UHFFFAOYSA-N	0	3	335.879	3.420	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(CN[C@H](C)c3cnccn3)CC2)CCC1	ZINC001206181686	1370983069	/nfs/dbraw/zinc/98/30/69/1370983069.db2.gz	NJCSNDGTZRGRKN-MRXNPFEDSA-N	0	3	342.487	3.112	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2csc(C#N)c2)C1	ZINC001117780751	1371082540	/nfs/dbraw/zinc/08/25/40/1371082540.db2.gz	YUPUSJUFTYJIQR-CZUORRHYSA-N	0	3	325.437	3.185	20	30		EGEDHN
C=C[C@@H](COC)NC[C@@](C)(O)c1ccc(Br)cc1Cl	ZINC001326157149	1388120205	/nfs/dbraw/zinc/12/02/05/1388120205.db2.gz	VPSJWGBNJRSGMX-SMDDNHRTSA-N	0	3	348.668	3.101	20	30		EGEDHN
CCCCCCC(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001187572581	1388126829	/nfs/dbraw/zinc/12/68/29/1388126829.db2.gz	GYKRCADZMOUDMK-QGZVFWFLSA-N	0	3	331.435	3.358	20	30		EGEDHN
CCN(Cc1cc(C#N)n(C)c1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC001207108506	1371295927	/nfs/dbraw/zinc/29/59/27/1371295927.db2.gz	DNZPZHVFMXPAHB-MRXNPFEDSA-N	0	3	346.475	3.118	20	30		EGEDHN
Cn1cc(CN2CCC(COc3ccc(F)cc3)CC2)cc1C#N	ZINC001207109808	1371296801	/nfs/dbraw/zinc/29/68/01/1371296801.db2.gz	UFBXVMGZUNFKOH-UHFFFAOYSA-N	0	3	327.403	3.327	20	30		EGEDHN
Cn1cc(CN2CCC(c3nc4ccccc4n3C)CC2)cc1C#N	ZINC001207109484	1371297160	/nfs/dbraw/zinc/29/71/60/1371297160.db2.gz	MAPMNWSOOGWYFZ-UHFFFAOYSA-N	0	3	333.439	3.163	20	30		EGEDHN
C=CCOC(=O)N1CCCC2(CCN(Cc3cccnc3C)CC2)C1	ZINC001207147608	1371310334	/nfs/dbraw/zinc/31/03/34/1371310334.db2.gz	KDULCMNNEZNUCC-UHFFFAOYSA-N	0	3	343.471	3.391	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001207151258	1371311882	/nfs/dbraw/zinc/31/18/82/1371311882.db2.gz	LPLBOENOPMKGTR-KRWDZBQOSA-N	0	3	330.859	3.238	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)CCOc2cccc(C)c2C)C1	ZINC001207351508	1371369386	/nfs/dbraw/zinc/36/93/86/1371369386.db2.gz	SHZOUOBWEYEUGT-SJLPKXTDSA-N	0	3	330.472	3.085	20	30		EGEDHN
O=C(C(F)=C1CCCC1)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001207801534	1371509062	/nfs/dbraw/zinc/50/90/62/1371509062.db2.gz	SUERBIWVGLAYIK-IBGZPJMESA-N	0	3	340.442	3.416	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H](NCc2ccccc2OC(C)C)C1	ZINC001207944523	1371546046	/nfs/dbraw/zinc/54/60/46/1371546046.db2.gz	PKHLCMHMHNYUHO-IBGZPJMESA-N	0	3	342.483	3.358	20	30		EGEDHN
CCCC[C@@H](C)C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001207979906	1371559056	/nfs/dbraw/zinc/55/90/56/1371559056.db2.gz	PRZUUEWIVMJTHK-QUCCMNQESA-N	0	3	326.484	3.445	20	30		EGEDHN
C=CCCOCC(=O)N1CCC[C@H]([C@H]2CCCN2CC(=C)Cl)C1	ZINC001120467753	1371587432	/nfs/dbraw/zinc/58/74/32/1371587432.db2.gz	BJKUNBBXUWPABF-DLBZAZTESA-N	0	3	340.895	3.035	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CN(Cc2ccccc2N(C)C)C[C@H]1C	ZINC001208388935	1371748357	/nfs/dbraw/zinc/74/83/57/1371748357.db2.gz	TZFOAKMJFOQDJQ-ZHALLVOQSA-N	0	3	343.515	3.291	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1CN(Cc2ccc3c(c2)COC3)C[C@H]1C	ZINC001208393273	1371751258	/nfs/dbraw/zinc/75/12/58/1371751258.db2.gz	MUWGIQHFXGWNDK-JXXFODFXSA-N	0	3	342.483	3.256	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN(Cc2ccc3cc[nH]c3c2)C[C@H]1C	ZINC001208458285	1371774352	/nfs/dbraw/zinc/77/43/52/1371774352.db2.gz	BUBPDWQIANMDIF-DNVCBOLYSA-N	0	3	325.456	3.461	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)CC/C=C/c2ccccc2)C1	ZINC001208583717	1371827857	/nfs/dbraw/zinc/82/78/57/1371827857.db2.gz	BVSDVEHRUOPBRJ-ZPPSIVDRSA-N	0	3	342.483	3.119	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC1CC2(CC(NCc3nccn3CC)C2)C1	ZINC001121163606	1371872873	/nfs/dbraw/zinc/87/28/73/1371872873.db2.gz	QNQYIPGOWWDHOC-UHFFFAOYSA-N	0	3	344.503	3.022	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC1CC2(CC(NCc3cnc(C)o3)C2)C1	ZINC001121176468	1371879462	/nfs/dbraw/zinc/87/94/62/1371879462.db2.gz	ZRSPAYWLJRXZPR-UHFFFAOYSA-N	0	3	331.460	3.102	20	30		EGEDHN
COc1ccc(CN2CCN(CCCc3ccc(C#N)cc3)CC2)cc1	ZINC001208858138	1371921329	/nfs/dbraw/zinc/92/13/29/1371921329.db2.gz	IUKYKMIGBRIKDX-UHFFFAOYSA-N	0	3	349.478	3.317	20	30		EGEDHN
COc1cccnc1O[C@H]1CCCN(CCc2ccc(C#N)cc2)C1	ZINC001208928391	1371948100	/nfs/dbraw/zinc/94/81/00/1371948100.db2.gz	GWZCOIJOCHGUEN-SFHVURJKSA-N	0	3	337.423	3.048	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC[C@H](NCc2scnc2C)C1	ZINC001209002919	1371971839	/nfs/dbraw/zinc/97/18/39/1371971839.db2.gz	DWODFAFCMHREMV-INIZCTEOSA-N	0	3	333.501	3.116	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CC2(CC(NCc3ncc(C)s3)C2)C1	ZINC001121534899	1372003095	/nfs/dbraw/zinc/00/30/95/1372003095.db2.gz	YXKQCORHWVXJBY-UHFFFAOYSA-N	0	3	333.501	3.181	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCCN(C(=O)CCCC3CC3)C2)s1	ZINC001209145956	1372013859	/nfs/dbraw/zinc/01/38/59/1372013859.db2.gz	JWXYGUPYQFLMAF-HNNXBMFYSA-N	0	3	331.485	3.281	20	30		EGEDHN
CCCc1[nH]ccc1C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001209168184	1372021890	/nfs/dbraw/zinc/02/18/90/1372021890.db2.gz	CAAZCXSVNSDTHU-IBGZPJMESA-N	0	3	349.478	3.213	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001209182184	1372027143	/nfs/dbraw/zinc/02/71/43/1372027143.db2.gz	ATTMCHCDMXZJAS-QAPCUYQASA-N	0	3	343.446	3.380	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC1CC2(CC(NCc3oc(C)nc3C)C2)C1	ZINC001121617195	1372027605	/nfs/dbraw/zinc/02/76/05/1372027605.db2.gz	UDBCSYCLVGIDQR-KSMRAORZSA-N	0	3	345.487	3.411	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC[C@H](NCc2cnn(C(C)(C)C)c2)C1	ZINC001209185761	1372030520	/nfs/dbraw/zinc/03/05/20/1372030520.db2.gz	XJBBEQHIIVVKAF-WMZOPIPTSA-N	0	3	346.519	3.321	20	30		EGEDHN
C#CC[C@H](CC)c1nnc(N2CCN(C(C)(C)CC)CC2)n1CC	ZINC001121647685	1372035576	/nfs/dbraw/zinc/03/55/76/1372035576.db2.gz	BQIFLFPFJBJTFH-INIZCTEOSA-N	0	3	331.508	3.126	20	30		EGEDHN
C=CCCCCN1CCO[C@@H]2[C@H](COCc3nccs3)CC[C@@H]21	ZINC001209204133	1372036742	/nfs/dbraw/zinc/03/67/42/1372036742.db2.gz	ZOPPXBXGTGWVML-XYJFISCASA-N	0	3	336.501	3.495	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)CC(F)(F)C(F)F)C2	ZINC001121779213	1372078653	/nfs/dbraw/zinc/07/86/53/1372078653.db2.gz	UNMKMPFBUQFLJX-UHFFFAOYSA-N	0	3	342.764	3.046	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC1CC2(CC(NCc3cnoc3C)C2)C1	ZINC001121842203	1372099175	/nfs/dbraw/zinc/09/91/75/1372099175.db2.gz	ZEGOUUMUDNNANR-UHFFFAOYSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC[C@H](NCc3cc(C)ns3)C2)CC1	ZINC001209492671	1372119886	/nfs/dbraw/zinc/11/98/86/1372119886.db2.gz	FGBUYWJUNVXCKV-HNNXBMFYSA-N	0	3	333.501	3.279	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N[C@H](Cc1ccc(C)cc1)c1ccccn1	ZINC001121923698	1372123505	/nfs/dbraw/zinc/12/35/05/1372123505.db2.gz	RDEPPBIHPWMOMU-UYAOXDASSA-N	0	3	337.467	3.474	20	30		EGEDHN
CCCC1(C(=O)N2CCC[C@@H](NCc3ccc(F)c(C#N)c3)C2)CC1	ZINC001209535570	1372130545	/nfs/dbraw/zinc/13/05/45/1372130545.db2.gz	JGZAXFZFUQCNGC-QGZVFWFLSA-N	0	3	343.446	3.358	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1)c1ccco1	ZINC001209601762	1372148187	/nfs/dbraw/zinc/14/81/87/1372148187.db2.gz	PVGVCBMYKMBZOM-IEBWSBKVSA-N	0	3	336.435	3.015	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3c[nH]c4cc(F)ccc34)C2)C1=O	ZINC001209687836	1372170340	/nfs/dbraw/zinc/17/03/40/1372170340.db2.gz	YTOWDPPSDPCYDS-FQEVSTJZSA-N	0	3	341.430	3.308	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001209707319	1372175210	/nfs/dbraw/zinc/17/52/10/1372175210.db2.gz	FWEJNQVAODHRPF-NZSAHSFTSA-N	0	3	344.886	3.318	20	30		EGEDHN
N#Cc1ccc(OC2CCN(Cc3cnccc3N)CC2)cc1Cl	ZINC001209737968	1372180472	/nfs/dbraw/zinc/18/04/72/1372180472.db2.gz	UWEPOIYMIOYBJK-UHFFFAOYSA-N	0	3	342.830	3.063	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)CCOc1ccccc1)C2	ZINC001122185852	1372195815	/nfs/dbraw/zinc/19/58/15/1372195815.db2.gz	BXVBRWQELMEZQB-UHFFFAOYSA-N	0	3	348.874	3.225	20	30		EGEDHN
C=C(C)Cn1c([C@H](C)CCC#N)nnc1N1CCN(CC(C)C)CC1	ZINC001122525241	1372267184	/nfs/dbraw/zinc/26/71/84/1372267184.db2.gz	FSMXMDJWHNKQES-QGZVFWFLSA-N	0	3	344.507	3.039	20	30		EGEDHN
CC[C@@H](C)c1ccc(NC(=O)C(C#N)C(=O)c2ccc(C)nn2)cc1	ZINC001122547412	1372272121	/nfs/dbraw/zinc/27/21/21/1372272121.db2.gz	RHIYBJQFYQZFBQ-MLGOLLRUSA-N	0	3	336.395	3.260	20	30		EGEDHN
CC[C@H](C)c1ccc(NC(=O)C(C#N)C(=O)c2ccc(C)nn2)cc1	ZINC001122547410	1372272176	/nfs/dbraw/zinc/27/21/76/1372272176.db2.gz	RHIYBJQFYQZFBQ-LRDDRELGSA-N	0	3	336.395	3.260	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)[C@H](CCCCC)C(C)C)C1	ZINC001210111575	1372273445	/nfs/dbraw/zinc/27/34/45/1372273445.db2.gz	MGVCTRWRZRMJTL-GUDVDZBRSA-N	0	3	338.536	3.478	20	30		EGEDHN
CCN1CCN(Cc2ccc(Nc3cnc(C#N)c(C)c3)cc2)CC1	ZINC001210204457	1372293833	/nfs/dbraw/zinc/29/38/33/1372293833.db2.gz	YZIABKKAPKVLGN-UHFFFAOYSA-N	0	3	335.455	3.143	20	30		EGEDHN
N#CC(C(=O)c1cc(C2CC2)[nH]n1)c1nc2c(cccc2Cl)[nH]1	ZINC001123247113	1372406828	/nfs/dbraw/zinc/40/68/28/1372406828.db2.gz	HKAREKDVNQPXKL-SECBINFHSA-N	0	3	325.759	3.307	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCc1cccc(OC(F)F)c1	ZINC001123336359	1372430937	/nfs/dbraw/zinc/43/09/37/1372430937.db2.gz	HFIHMPKNUPXLAM-CQSZACIVSA-N	0	3	333.338	3.313	20	30		EGEDHN
CCCCCCCCCC(=O)N1CCC[C@H](NCc2n[nH]c(C)n2)C1	ZINC001210823957	1372433780	/nfs/dbraw/zinc/43/37/80/1372433780.db2.gz	HAINKFVUSMKKAF-KRWDZBQOSA-N	0	3	349.523	3.334	20	30		EGEDHN
Cc1ccccc1CC(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001211014689	1372470785	/nfs/dbraw/zinc/47/07/85/1372470785.db2.gz	LUDYCVSMIMPSBS-QFIPXVFZSA-N	0	3	346.474	3.170	20	30		EGEDHN
CC(C)n1cccc1C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001211098792	1372485108	/nfs/dbraw/zinc/48/51/08/1372485108.db2.gz	UFIRZPISFXHVOG-FQEVSTJZSA-N	0	3	349.478	3.315	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C(C)(C)CCC)C[C@H]1c1ccccc1	ZINC001211662088	1372598876	/nfs/dbraw/zinc/59/88/76/1372598876.db2.gz	RGHSLVXSWCWRKW-RBUKOAKNSA-N	0	3	326.484	3.420	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@@]23C[C@@H]2CCCC3)C[C@H]1c1ccccc1	ZINC001211671133	1372600579	/nfs/dbraw/zinc/60/05/79/1372600579.db2.gz	ZTPCMBYRNDIQTC-KEZQHZCBSA-N	0	3	336.479	3.174	20	30		EGEDHN
C=CC[C@@H](C(=O)N1CC[C@@H](NCc2ncccc2C)C1)c1ccccc1	ZINC001188002906	1388210839	/nfs/dbraw/zinc/21/08/39/1388210839.db2.gz	YZQJCCAMUISTOC-WOJBJXKFSA-N	0	3	349.478	3.440	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@@H]2C[C@@H]3C=C[C@H]2CC3)[C@H](OC)C1	ZINC001212301501	1372683920	/nfs/dbraw/zinc/68/39/20/1372683920.db2.gz	WWFZWPIHWZQDGB-USYVTKNRSA-N	0	3	346.515	3.151	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN([C@@H](CC)c2ccccc2)C[C@H]1OC	ZINC001212345046	1372691776	/nfs/dbraw/zinc/69/17/76/1372691776.db2.gz	YIFJBKVEMPWUGV-CEXWTWQISA-N	0	3	330.472	3.309	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NCCNCc1cc(C(C)C)ccc1OC	ZINC001124489397	1372706165	/nfs/dbraw/zinc/70/61/65/1372706165.db2.gz	ZMNMHTHZAFFZSU-INIZCTEOSA-N	0	3	348.487	3.006	20	30		EGEDHN
Cc1cc(N2CCN(C)CC2)ccc1Nc1ccccc1OCC#N	ZINC001212600626	1372735949	/nfs/dbraw/zinc/73/59/49/1372735949.db2.gz	DFIDGDVSNRCCBT-UHFFFAOYSA-N	0	3	336.439	3.393	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1CN(CC/C=C\CCC)C[C@H]1OC	ZINC001213269213	1372871990	/nfs/dbraw/zinc/87/19/90/1372871990.db2.gz	FDJWAHRENCGMQK-HYDLDTBVSA-N	0	3	334.504	3.132	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H](NC(=O)c2coc(C(F)F)c2)[C@H](OC)C1	ZINC001213333686	1372886292	/nfs/dbraw/zinc/88/62/92/1372886292.db2.gz	MEQWUVYPNHHRST-NJZAAPMLSA-N	0	3	342.386	3.001	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)[C@H](CC)CC2CCCC2)[C@H](OC)C1	ZINC001213524520	1372918501	/nfs/dbraw/zinc/91/85/01/1372918501.db2.gz	HWEJXYHLEYJWNH-GUDVDZBRSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)CC(C)(C)C2CCCCC2)[C@H](OC)C1	ZINC001213721187	1372951108	/nfs/dbraw/zinc/95/11/08/1372951108.db2.gz	DUIYRVCMVFHZBB-QZTJIDSGSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)[C@@H](F)CCCCCC)[C@H](OC)C1	ZINC001213723463	1372952783	/nfs/dbraw/zinc/95/27/83/1372952783.db2.gz	JQEUFHJDUKIPCP-GVDBMIGSSA-N	0	3	328.472	3.077	20	30		EGEDHN
C=C[C@H](C(=O)N[C@@H]1CN(CCCCCC)C[C@H]1OC)c1ccccc1	ZINC001213900328	1372977775	/nfs/dbraw/zinc/97/77/75/1372977775.db2.gz	XCFZZSVGXJBWGE-XUVXKRRUSA-N	0	3	344.499	3.352	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CC[C@@H](C)F)C[C@H]2OC)CCCCC1	ZINC001213903274	1372978568	/nfs/dbraw/zinc/97/85/68/1372978568.db2.gz	OGQIEGYWAOGVSM-BRWVUGGUSA-N	0	3	340.483	3.077	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2cc3cc(C)ccc3o2)[C@H](OC)C1	ZINC001213918589	1372980834	/nfs/dbraw/zinc/98/08/34/1372980834.db2.gz	XWVMCFFQSRHDBJ-VQIMIIECSA-N	0	3	342.439	3.136	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)CC(C2CC2)C2CC2)[C@H](OC)C1	ZINC001213940688	1372984118	/nfs/dbraw/zinc/98/41/18/1372984118.db2.gz	NXXYWQVITZEHTD-WOJBJXKFSA-N	0	3	348.531	3.375	20	30		EGEDHN
CCC(=CC(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1)CC	ZINC001214436060	1373060724	/nfs/dbraw/zinc/06/07/24/1373060724.db2.gz	ZUUCSBHWXYSORA-AUUYWEPGSA-N	0	3	343.446	3.380	20	30		EGEDHN
CC[C@@H](CC(F)F)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2)C1	ZINC001214833786	1373127544	/nfs/dbraw/zinc/12/75/44/1373127544.db2.gz	HIJZJFLKQINAAC-BPQIPLTHSA-N	0	3	348.437	3.156	20	30		EGEDHN
CC(C)CCCC(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001215634181	1373221345	/nfs/dbraw/zinc/22/13/45/1373221345.db2.gz	NVIPLAQFJRURCE-RHSMWYFYSA-N	0	3	333.501	3.383	20	30		EGEDHN
CCCCCCCCC(=O)N[C@@H]1CN(CCCC)C[C@@H]1n1ccnn1	ZINC001129400432	1373380267	/nfs/dbraw/zinc/38/02/67/1373380267.db2.gz	OADPHKHLNIARBT-MSOLQXFVSA-N	0	3	349.523	3.170	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](C)[C@H](NCc3ccns3)C2)CCCC1	ZINC001217116706	1373389755	/nfs/dbraw/zinc/38/97/55/1373389755.db2.gz	BWAXAMUDSUIFBH-GDBMZVCRSA-N	0	3	333.501	3.216	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)c3ccc(F)cc3)[C@H]2C1	ZINC001217191576	1373402611	/nfs/dbraw/zinc/40/26/11/1373402611.db2.gz	ZVZCYNXFZGYRMQ-RBUKOAKNSA-N	0	3	348.462	3.321	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)/C=C/c3ccco3)[C@H]2C1	ZINC001217196346	1373403982	/nfs/dbraw/zinc/40/39/82/1373403982.db2.gz	MFDCSHVMFQVMRT-NDUHVBCRSA-N	0	3	346.471	3.175	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)C/C=C/c2ccccc2F)s1	ZINC001130170017	1373469421	/nfs/dbraw/zinc/46/94/21/1373469421.db2.gz	NFJKKWNVZUTMHQ-HWKANZROSA-N	0	3	343.427	3.068	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)[C@@H]2CC[C@@H](c3ccccc3)C2)c1	ZINC001130180545	1373471570	/nfs/dbraw/zinc/47/15/70/1373471570.db2.gz	RUOIOWRJCNODML-NHCUHLMSSA-N	0	3	347.462	3.348	20	30		EGEDHN
CC[C@@H]1CCC[C@]1(C)C(=O)NCCNCc1ccc(C#N)c(F)c1	ZINC001130259046	1373479786	/nfs/dbraw/zinc/47/97/86/1373479786.db2.gz	VCNBDWBDRAGIFO-APWZRJJASA-N	0	3	331.435	3.120	20	30		EGEDHN
CC[C@@H]1CCC[C@@]1(C)C(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001130258933	1373479855	/nfs/dbraw/zinc/47/98/55/1373479855.db2.gz	SKQWCQZAEBCFKC-VQIMIIECSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=C(C)CN1CC[C@H](Oc2cnccc2CNC(=O)CCC(C)C)C1	ZINC001130310633	1373489009	/nfs/dbraw/zinc/48/90/09/1373489009.db2.gz	RQSIYOMNYAWUKQ-SFHVURJKSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=C(C)CN1CC[C@H](Oc2cnccc2CNC(=O)C[C@@H](C)CC)C1	ZINC001130317278	1373491281	/nfs/dbraw/zinc/49/12/81/1373491281.db2.gz	OHCSAWHHNLKJLL-WMZOPIPTSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2OCCN(C(=O)c3csc(C)c3C)[C@H]2C1	ZINC001217975975	1373523146	/nfs/dbraw/zinc/52/31/46/1373523146.db2.gz	IIGDKEJPLTUHND-JEBQAFNWSA-N	0	3	348.512	3.245	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCO[C@@H]2CN(CCC3CCCC3)C[C@@H]21	ZINC001217987004	1373527160	/nfs/dbraw/zinc/52/71/60/1373527160.db2.gz	MKNQCJCURLEPHZ-VQTJNVASSA-N	0	3	346.515	3.247	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)[C@H](C)CC2CCCC2)C1	ZINC001130430972	1373536829	/nfs/dbraw/zinc/53/68/29/1373536829.db2.gz	NLTRCCVXMAIETB-WBVHZDCISA-N	0	3	344.503	3.218	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)CCCCCCCC)C[C@H]1c1cn(C)cn1	ZINC001130719440	1373584045	/nfs/dbraw/zinc/58/40/45/1373584045.db2.gz	QVPKWYBNFOBCHM-PKOBYXMFSA-N	0	3	346.519	3.241	20	30		EGEDHN
CC(C)=C[C@@H]1[C@H](C(=O)NCCNCc2cccc(C#N)c2)C1(C)C	ZINC001131070749	1373637323	/nfs/dbraw/zinc/63/73/23/1373637323.db2.gz	HDZJJZJTBYHUEO-QZTJIDSGSA-N	0	3	325.456	3.002	20	30		EGEDHN
CC(C)=C[C@@H]1[C@@H](C(=O)NCCNCc2ccc(C#N)cc2)C1(C)C	ZINC001131088198	1373641431	/nfs/dbraw/zinc/64/14/31/1373641431.db2.gz	MCIVHBSUTDHFAK-MSOLQXFVSA-N	0	3	325.456	3.002	20	30		EGEDHN
N#Cc1cc(NC(=O)C[C@@H]([NH3+])Cc2ccc3ccccc3c2)ccc1[O-]	ZINC001218954467	1373670664	/nfs/dbraw/zinc/67/06/64/1373670664.db2.gz	MWOVGRYNAOTXQS-SFHVURJKSA-N	0	3	345.402	3.316	20	30		EGEDHN
COc1ccc(C#N)cc1NC(=O)[C@H](N)C12CC3CC(CC(C3)C1)C2	ZINC001218978686	1373673642	/nfs/dbraw/zinc/67/36/42/1373673642.db2.gz	BNVHYBHQXIQWSI-ITOSSNOYSA-N	0	3	339.439	3.049	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@H]2CCC(C)=C(C)C2)[C@@H](O)C1	ZINC001219684943	1373725463	/nfs/dbraw/zinc/72/54/63/1373725463.db2.gz	WYQDKZSGTDIGFP-OTWHNJEPSA-N	0	3	334.504	3.031	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)CCCC(C)(C)C)C[C@@H](C)O2	ZINC001131642565	1373740763	/nfs/dbraw/zinc/74/07/63/1373740763.db2.gz	RRKRLKYBWAXZLN-XLIONFOSSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H](C)O[C@]2(CCN(CC=C(C)C)C2)C1	ZINC001131661276	1373748928	/nfs/dbraw/zinc/74/89/28/1373748928.db2.gz	LZDFIGNIRHDFHI-NQIIRXRSSA-N	0	3	346.515	3.413	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)C(C)(C)C(C)(C)C)[C@@H](O)C1	ZINC001220151536	1373753249	/nfs/dbraw/zinc/75/32/49/1373753249.db2.gz	WEANJIOVYFHIGR-CVEARBPZSA-N	0	3	326.525	3.190	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@H](C)O[C@@]3(CCN(CC=C(C)C)C3)C2)CCC1	ZINC001131681625	1373759951	/nfs/dbraw/zinc/75/99/51/1373759951.db2.gz	FRXXCDCCPDBQSD-GHTZIAJQSA-N	0	3	346.515	3.391	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)Cc2cccc(C)c2Cl)CC1	ZINC001223800442	1375043473	/nfs/dbraw/zinc/04/34/73/1375043473.db2.gz	VPBSIMLOFRMMOJ-UHFFFAOYSA-N	0	3	332.875	3.042	20	30		EGEDHN
C=CCOCCCC(=O)N[C@@H]1CC[C@H](C)N(Cc2ccccc2)C1	ZINC001131939254	1375057188	/nfs/dbraw/zinc/05/71/88/1375057188.db2.gz	PAUFFIGMYWCDDJ-PKOBYXMFSA-N	0	3	330.472	3.139	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCC1CCN(Cc2cccc(C#N)c2)CC1	ZINC001224165099	1375057990	/nfs/dbraw/zinc/05/79/90/1375057990.db2.gz	GIARQYJBFWAPHE-SJORKVTESA-N	0	3	339.483	3.345	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)CCCc2ccc(C)cc2)CC1	ZINC001224326534	1375064836	/nfs/dbraw/zinc/06/48/36/1375064836.db2.gz	QPGXBNQNAOIPHG-UHFFFAOYSA-N	0	3	326.484	3.169	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@@H](C)N(CCCc2ccsc2)C1	ZINC001132002312	1375092404	/nfs/dbraw/zinc/09/24/04/1375092404.db2.gz	IKVBBRDRXRYBTD-SJLPKXTDSA-N	0	3	332.513	3.453	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1CC[C@@H](C)N(Cc2ccc3ncccc3c2)C1	ZINC001132016476	1375099492	/nfs/dbraw/zinc/09/94/92/1375099492.db2.gz	HHBKOCRZPAJQJS-YLJYHZDGSA-N	0	3	349.478	3.363	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H]1CC[C@@H](C)N(CCCc2ccsc2)C1	ZINC001132022145	1375103728	/nfs/dbraw/zinc/10/37/28/1375103728.db2.gz	VOQDELFBVYZGSF-AEFFLSMTSA-N	0	3	332.513	3.309	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COc2cc(C)ccc2F)CC[C@@H]1C	ZINC001132041752	1375112623	/nfs/dbraw/zinc/11/26/23/1375112623.db2.gz	KEZOVIIDHFIXSN-HOTGVXAUSA-N	0	3	334.435	3.058	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N[C@@H]2CC[C@@H](C)N(CCCF)C2)cc1	ZINC001132041761	1375112961	/nfs/dbraw/zinc/11/29/61/1375112961.db2.gz	KIEIXUFKNPODMZ-SJLPKXTDSA-N	0	3	346.446	3.031	20	30		EGEDHN
C[C@@H]1CC[C@H](NC(=O)C#CC2CC2)CN1CCc1ccc(Cl)cc1	ZINC001132046051	1375114923	/nfs/dbraw/zinc/11/49/23/1375114923.db2.gz	MAWMTTCGTVLFTP-BEFAXECRSA-N	0	3	344.886	3.265	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)COc2cccc(C(C)C)c2)CC[C@@H]1C	ZINC001132054057	1375119346	/nfs/dbraw/zinc/11/93/46/1375119346.db2.gz	JOLPLQCOJQKVFA-HKUYNNGSSA-N	0	3	342.483	3.181	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)CCc2cc(C)sc2C)CC1	ZINC001225604056	1375131366	/nfs/dbraw/zinc/13/13/66/1375131366.db2.gz	SFBFRCWVZXSHGN-UHFFFAOYSA-N	0	3	332.513	3.149	20	30		EGEDHN
C#CCN1CCC(CNC(=O)CCC(C)(C)c2ccccc2)CC1	ZINC001225653075	1375139349	/nfs/dbraw/zinc/13/93/49/1375139349.db2.gz	QKVXAKZWNZEVHQ-UHFFFAOYSA-N	0	3	326.484	3.206	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCOc2cccc(F)c2)CC[C@H]1C	ZINC001132097415	1375146371	/nfs/dbraw/zinc/14/63/71/1375146371.db2.gz	JKXWXEXQNQYJOG-NVXWUHKLSA-N	0	3	334.435	3.140	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CC[C@@H](C)N(CCOCCCC)C1	ZINC001132106171	1375151227	/nfs/dbraw/zinc/15/12/27/1375151227.db2.gz	QSVXLORQENPKBI-QZTJIDSGSA-N	0	3	347.503	3.074	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2cc(C)sc2C)CC[C@@H]1C	ZINC001132157925	1375175951	/nfs/dbraw/zinc/17/59/51/1375175951.db2.gz	UXXJFTSMVBXEBD-BBRMVZONSA-N	0	3	336.501	3.150	20	30		EGEDHN
C=CCCCN1C[C@H](NC(=O)c2nc(Cl)cs2)CC[C@H]1C	ZINC001132238267	1375233955	/nfs/dbraw/zinc/23/39/55/1375233955.db2.gz	QMPBWOKKMKLNRP-VXGBXAGGSA-N	0	3	327.881	3.345	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1CC[C@H](C)N(CCOCC2CCC2)C1	ZINC001132241578	1375237861	/nfs/dbraw/zinc/23/78/61/1375237861.db2.gz	VZPFQLASSVVVNU-ICSRJNTNSA-N	0	3	348.531	3.356	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1CC[C@H](C)N(CCOCC2CCC2)C1	ZINC001132241576	1375238034	/nfs/dbraw/zinc/23/80/34/1375238034.db2.gz	VZPFQLASSVVVNU-AZUAARDMSA-N	0	3	348.531	3.356	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCc2ccc(F)cc2F)CC[C@@H]1C	ZINC001132392342	1375347492	/nfs/dbraw/zinc/34/74/92/1375347492.db2.gz	IMCXBYKAFILZEP-WMLDXEAASA-N	0	3	336.426	3.443	20	30		EGEDHN
C#CCCCCCC(=O)NCCNCc1ccccc1C(F)(F)F	ZINC001132403854	1375355395	/nfs/dbraw/zinc/35/53/95/1375355395.db2.gz	INGGMSNREJGLEQ-UHFFFAOYSA-N	0	3	340.389	3.495	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCOc2ccccc2CC)CC[C@@H]1C	ZINC001132414809	1375362891	/nfs/dbraw/zinc/36/28/91/1375362891.db2.gz	XIJFJUQWGXXYLK-WMZOPIPTSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=C[C@@](C)(O)CC(=O)NC1CCN(Cc2ccc(CCC)cc2)CC1	ZINC001227123297	1375393842	/nfs/dbraw/zinc/39/38/42/1375393842.db2.gz	BIDYUKPYOBNYDY-OAQYLSRUSA-N	0	3	344.499	3.047	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)NC1CCN([C@H](CC)c2ccc(F)cc2)CC1	ZINC001227124592	1375394183	/nfs/dbraw/zinc/39/41/83/1375394183.db2.gz	VONILTMKLSPIEV-QUCCMNQESA-N	0	3	348.462	3.185	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2ccc(C)cc2C)CC[C@@H]1C	ZINC001132458186	1375401235	/nfs/dbraw/zinc/40/12/35/1375401235.db2.gz	QXZFZINJAVNJKE-ROUUACIJSA-N	0	3	330.472	3.089	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COc2c(C)cccc2C)CC[C@@H]1C	ZINC001132467025	1375408703	/nfs/dbraw/zinc/40/87/03/1375408703.db2.gz	ARXHZVDEAOMDKQ-ROUUACIJSA-N	0	3	330.472	3.227	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)COC1CCCCC1	ZINC001227233050	1375409479	/nfs/dbraw/zinc/40/94/79/1375409479.db2.gz	ORAHCVMSFGVMMV-HZPDHXFCSA-N	0	3	328.884	3.105	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCn2ccc3ccccc32)CC[C@H]1C	ZINC001132469957	1375412352	/nfs/dbraw/zinc/41/23/52/1375412352.db2.gz	ZGHUMKDGPCBZEO-AEFFLSMTSA-N	0	3	325.456	3.187	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2cc(C)c(F)c(C)c2)CC[C@H]1C	ZINC001132490672	1375422496	/nfs/dbraw/zinc/42/24/96/1375422496.db2.gz	XBWGRXGROZTHTR-SJLPKXTDSA-N	0	3	348.462	3.228	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCCOc2ccccc2F)CC[C@H]1C	ZINC001132504475	1375429495	/nfs/dbraw/zinc/42/94/95/1375429495.db2.gz	JKCXVLCEMLJYCG-CVEARBPZSA-N	0	3	334.435	3.140	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCc2c(C)noc2Cl)CC[C@H]1C	ZINC001132529596	1375444055	/nfs/dbraw/zinc/44/40/55/1375444055.db2.gz	OPYPWNCYQRCKSE-TZMCWYRMSA-N	0	3	339.867	3.114	20	30		EGEDHN
C=C(C)CCC(=O)NC1CCN(CCOc2ccccc2C)CC1	ZINC001227606998	1375452606	/nfs/dbraw/zinc/45/26/06/1375452606.db2.gz	HDUZAXFVMKOUCY-UHFFFAOYSA-N	0	3	330.472	3.311	20	30		EGEDHN
C#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)C(CC)CC)CC1	ZINC001132551552	1375457881	/nfs/dbraw/zinc/45/78/81/1375457881.db2.gz	JJXQXEXZRGHBTP-FQEVSTJZSA-N	0	3	341.499	3.334	20	30		EGEDHN
C#CCN1CC[C@H](CN(Cc2scnc2C)C(=O)CC(C)(C)C)C1	ZINC001132559548	1375467546	/nfs/dbraw/zinc/46/75/46/1375467546.db2.gz	XGEHPMIHCLOYGG-INIZCTEOSA-N	0	3	347.528	3.171	20	30		EGEDHN
C#CCN1CC[C@H](CN(Cc2scnc2C)C(=O)CCCC=C)C1	ZINC001132563578	1375469567	/nfs/dbraw/zinc/46/95/67/1375469567.db2.gz	SYHVXIRRCHVMKB-KRWDZBQOSA-N	0	3	345.512	3.092	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCNCc1cccc(C(F)(F)F)c1	ZINC001132575965	1375472494	/nfs/dbraw/zinc/47/24/94/1375472494.db2.gz	FORCFIUFHLZRMJ-QWHCGFSZSA-N	0	3	328.378	3.369	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](C)[C@H](CNCc2ccn(C(C)C)n2)C1	ZINC001132700251	1375520904	/nfs/dbraw/zinc/52/09/04/1375520904.db2.gz	FGPZRSJKLHLORG-IAGOWNOFSA-N	0	3	332.492	3.004	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)C(C)(C)CC	ZINC001228295551	1375543898	/nfs/dbraw/zinc/54/38/98/1375543898.db2.gz	JKXAPKHHOKNKTA-CHWSQXEVSA-N	0	3	331.298	3.348	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](C)[C@@H](CNCc2cscn2)C1	ZINC001132851584	1375602372	/nfs/dbraw/zinc/60/23/72/1375602372.db2.gz	WHVBIZKZASAZFR-RDJZCZTQSA-N	0	3	347.528	3.486	20	30		EGEDHN
CSc1ncc(C#N)c(OC2CCN(Cc3ccccc3)CC2)n1	ZINC001228684028	1375640393	/nfs/dbraw/zinc/64/03/93/1375640393.db2.gz	YVNFLSAMCZNARB-UHFFFAOYSA-N	0	3	340.452	3.114	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NC1CCN(Cc2cccc(COC)c2)CC1	ZINC001228750426	1375664384	/nfs/dbraw/zinc/66/43/84/1375664384.db2.gz	YPUOWMXGMFCODH-IRXDYDNUSA-N	0	3	344.499	3.372	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NC1CCN(Cc2ccccc2N(C)C)CC1	ZINC001228760581	1375667773	/nfs/dbraw/zinc/66/77/73/1375667773.db2.gz	MTTWLSMWMRJEBE-DLBZAZTESA-N	0	3	343.515	3.291	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](C)[C@@H](CNCc2nc(C)cs2)C1	ZINC001133090737	1375769563	/nfs/dbraw/zinc/76/95/63/1375769563.db2.gz	KWCXHIMLCQWOLU-HOCLYGCPSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](C)[C@@H](CNCc2nccs2)C1	ZINC001133142220	1375803471	/nfs/dbraw/zinc/80/34/71/1375803471.db2.gz	MHQAPDVSHRGJLJ-CABCVRRESA-N	0	3	335.517	3.320	20	30		EGEDHN
Oc1ccccc1/C=N/N=C/c1ccccc1O[C@H]1CN2CCC1CC2	ZINC001229294458	1375804687	/nfs/dbraw/zinc/80/46/87/1375804687.db2.gz	PDXAJMWIHKGNLY-QUKGUNJMSA-N	0	3	349.434	3.318	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H](C)C1CC1	ZINC001133390785	1375974140	/nfs/dbraw/zinc/97/41/40/1375974140.db2.gz	JEAJPJGUWPCHEJ-HNNXBMFYSA-N	0	3	332.875	3.328	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1oc(C)cc1C	ZINC001133390976	1375975887	/nfs/dbraw/zinc/97/58/87/1375975887.db2.gz	ROOPIZRCSJWJHK-UHFFFAOYSA-N	0	3	344.842	3.415	20	30		EGEDHN
C=CCCOCC(=O)NC1CCN([C@H](C)c2ccc(F)cc2)CC1	ZINC001230406772	1376021337	/nfs/dbraw/zinc/02/13/37/1376021337.db2.gz	CSIOKDGMMQGPKY-OAHLLOKOSA-N	0	3	334.435	3.060	20	30		EGEDHN
C=CCC1(C(=O)NC2CCN(CCOC3CCC3)CC2)CCCC1	ZINC001230476008	1376035282	/nfs/dbraw/zinc/03/52/82/1376035282.db2.gz	ZIQFWHVIDLLTOR-UHFFFAOYSA-N	0	3	334.504	3.273	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)c1ccc(C)s1	ZINC001133536195	1376068647	/nfs/dbraw/zinc/06/86/47/1376068647.db2.gz	RTBZRBLXGCVCFR-GHMZBOCLSA-N	0	3	345.306	3.452	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCNCc2cccc(C(F)(F)F)c2)C1	ZINC001133566288	1376093281	/nfs/dbraw/zinc/09/32/81/1376093281.db2.gz	ZGKIVCUSKSBSJN-UHFFFAOYSA-N	0	3	326.362	3.268	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](C)C[C@H](C)NCc2ccccc2C#N)c(C)o1	ZINC001133641557	1376132452	/nfs/dbraw/zinc/13/24/52/1376132452.db2.gz	UJBKJAASPIUBFT-UONOGXRCSA-N	0	3	339.439	3.455	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)C#CC(C)(C)C)Cc1cccnc1	ZINC001230756705	1376140239	/nfs/dbraw/zinc/14/02/39/1376140239.db2.gz	FUVQDPSHLJZEJS-UHFFFAOYSA-N	0	3	327.472	3.016	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCCN(CCCF)Cc1cccnc1	ZINC001230812113	1376155423	/nfs/dbraw/zinc/15/54/23/1376155423.db2.gz	VRASIGDFIFQZAO-UHFFFAOYSA-N	0	3	335.467	3.352	20	30		EGEDHN
C#CCCN(CCCNC(=O)[C@@H]1C[C@]1(C)C(C)C)Cc1cccnc1	ZINC001230882325	1376176194	/nfs/dbraw/zinc/17/61/94/1376176194.db2.gz	OTRFHGZUULXFIF-PZJWPPBQSA-N	0	3	341.499	3.095	20	30		EGEDHN
C#CCCN(CCCNC(=O)[C@H](C)[C@H](C)CC)Cc1cccnc1	ZINC001230883558	1376177119	/nfs/dbraw/zinc/17/71/19/1376177119.db2.gz	XKGZXWGIPAGHCV-QZTJIDSGSA-N	0	3	329.488	3.095	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N(C)C[C@@H]1CCN1CCC1=CCCCC1	ZINC001231093740	1376202035	/nfs/dbraw/zinc/20/20/35/1376202035.db2.gz	BWFXTWMXDAXGOC-HKUYNNGSSA-N	0	3	334.504	3.391	20	30		EGEDHN
Cc1c(C)c(C)c(CN2CC[C@@H]2CN(C)C(=O)[C@@H](C)C#N)c(C)c1C	ZINC001231284866	1376220718	/nfs/dbraw/zinc/22/07/18/1376220718.db2.gz	WVEJXQIDYTYFOD-ORAYPTAESA-N	0	3	341.499	3.421	20	30		EGEDHN
CC(=O)N(C)[C@H]1CCN(Cc2ccccc2C#Cc2ccccc2)C1	ZINC001231579058	1376270090	/nfs/dbraw/zinc/27/00/90/1376270090.db2.gz	YIYNSUPWEBPLDJ-QFIPXVFZSA-N	0	3	332.447	3.139	20	30		EGEDHN
C=CCOc1cccc(CN2CCCN(Cc3ccncc3)CC2)c1	ZINC001231621271	1376283383	/nfs/dbraw/zinc/28/33/83/1376283383.db2.gz	WJIXWIWPRVRWNB-UHFFFAOYSA-N	0	3	337.467	3.354	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@H]1CCN(Cc1ccc(OCC)nc1)C2	ZINC001231653416	1376293770	/nfs/dbraw/zinc/29/37/70/1376293770.db2.gz	HURYYKKQEMACMS-ICSRJNTNSA-N	0	3	346.471	3.054	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1cc(F)ccc1C#N)NC(=O)CC1CCC1	ZINC001134027131	1376317814	/nfs/dbraw/zinc/31/78/14/1376317814.db2.gz	ZCFQBXLYZJZEKM-UONOGXRCSA-N	0	3	331.435	3.260	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3cc(F)c(C)c(F)c3)C2)C1=O	ZINC001232421904	1376459088	/nfs/dbraw/zinc/45/90/88/1376459088.db2.gz	ROIGLBUAWGSNFY-IBGZPJMESA-N	0	3	334.410	3.274	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H](C)C[C@H](C)NCc1nc(C(C)(C)C)cs1	ZINC001134316852	1376471268	/nfs/dbraw/zinc/47/12/68/1376471268.db2.gz	BWOTZFFZAKIEQP-LSDHHAIUSA-N	0	3	349.544	3.473	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)C#CC1CC1)NCc1cccc(F)c1Cl	ZINC001134321661	1376475510	/nfs/dbraw/zinc/47/55/10/1376475510.db2.gz	KPCBGDXWRSYXDM-OLZOCXBDSA-N	0	3	336.838	3.265	20	30		EGEDHN
Cc1nc(C(C)C)oc1CN[C@H](C)C[C@H](C)NC(=O)C#CC(C)C	ZINC001134341136	1376484529	/nfs/dbraw/zinc/48/45/29/1376484529.db2.gz	KIVJAEWWTPKDHW-CABCVRRESA-N	0	3	333.476	3.139	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3c(C)cccc3OC)C2)C1=O	ZINC001232619581	1376490244	/nfs/dbraw/zinc/49/02/44/1376490244.db2.gz	CHEOPLYPGMYFST-FQEVSTJZSA-N	0	3	328.456	3.004	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H](C)C[C@H](C)NCc1cc(F)ccc1C#N	ZINC001134470784	1376555389	/nfs/dbraw/zinc/55/53/89/1376555389.db2.gz	SFFVGNNEZDJKTJ-LSDHHAIUSA-N	0	3	331.435	3.427	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCC(Oc2ccc(C(N)=O)cc2)CC1	ZINC001233082547	1376568116	/nfs/dbraw/zinc/56/81/16/1376568116.db2.gz	QQIYANMCXCNBFC-UHFFFAOYSA-N	0	3	349.434	3.009	20	30		EGEDHN
COc1ccc(O[C@H]2CCCN(Cc3ccc(C#N)cc3C)C2)nc1	ZINC001233083352	1376568317	/nfs/dbraw/zinc/56/83/17/1376568317.db2.gz	HAACWGWGRWMMMW-IBGZPJMESA-N	0	3	337.423	3.314	20	30		EGEDHN
CC[C@H](Cc1ccccc1)C(=O)NCCNCc1cccc(C#N)c1	ZINC001134586083	1376610127	/nfs/dbraw/zinc/61/01/27/1376610127.db2.gz	QKYRZEBVINQFCA-HXUWFJFHSA-N	0	3	335.451	3.033	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2ccccc2C#N)CCC1	ZINC001134593467	1376615199	/nfs/dbraw/zinc/61/51/99/1376615199.db2.gz	NHEJKKBINJSJDF-IRXDYDNUSA-N	0	3	337.467	3.125	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)C[C@H](C)NCc2ncc(C)s2)CCC1	ZINC001134594184	1376617002	/nfs/dbraw/zinc/61/70/02/1376617002.db2.gz	YBASVZNXTUPOPV-UONOGXRCSA-N	0	3	333.501	3.018	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)c1ccc(CC)o1	ZINC001134749198	1376698295	/nfs/dbraw/zinc/69/82/95/1376698295.db2.gz	QPKPVJPRCCNVIH-VXGBXAGGSA-N	0	3	343.265	3.237	20	30		EGEDHN
C=CCCCCCN1CC[C@H]1CN(C)C(=O)[C@@H]1CCCc2n[nH]cc21	ZINC001234322859	1376808957	/nfs/dbraw/zinc/80/89/57/1376808957.db2.gz	LWVMPLCINKHYKH-DLBZAZTESA-N	0	3	344.503	3.109	20	30		EGEDHN
C=CCCCCCN1CC[C@@H]1CN(C)C(=O)[C@H]1CCCc2cn[nH]c21	ZINC001234324125	1376810985	/nfs/dbraw/zinc/81/09/85/1376810985.db2.gz	YKNQQEBOJLDQIS-MSOLQXFVSA-N	0	3	344.503	3.109	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H](C)C[C@H](C)NCc1ccn(C(C)C)n1	ZINC001135182192	1376954038	/nfs/dbraw/zinc/95/40/38/1376954038.db2.gz	ZGYGSNNXWSAAGT-JKSUJKDBSA-N	0	3	334.508	3.439	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H](C)C[C@@H](C)NC/C(Cl)=C/Cl)cc1	ZINC001135184900	1376958016	/nfs/dbraw/zinc/95/80/16/1376958016.db2.gz	QRIYGONXCFIKDW-BPWNKSKLSA-N	0	3	339.266	3.473	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H](C)C[C@@H](C)NCc1nccn1C(F)F	ZINC001135185504	1376959930	/nfs/dbraw/zinc/95/99/30/1376959930.db2.gz	YYXSLMUPHCKOAX-CHWSQXEVSA-N	0	3	342.434	3.253	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H](C)C[C@H](C)NCc1cc(C2CC2)no1	ZINC001135230833	1376989780	/nfs/dbraw/zinc/98/97/80/1376989780.db2.gz	SGAQZWMBSKTVPV-GJZGRUSLSA-N	0	3	331.460	3.119	20	30		EGEDHN
CC#CCCCC(=O)N[C@H](C)C[C@H](C)NCc1cc(C2CC2)no1	ZINC001135230835	1376990071	/nfs/dbraw/zinc/99/00/71/1376990071.db2.gz	SGAQZWMBSKTVPV-LSDHHAIUSA-N	0	3	331.460	3.119	20	30		EGEDHN
CCN1CC[C@@]2(CCCN(Cc3ccc(C#N)cc3Cl)C2)C1=O	ZINC001238084397	1376994131	/nfs/dbraw/zinc/99/41/31/1376994131.db2.gz	QLXMGNNEWJZEDH-GOSISDBHSA-N	0	3	331.847	3.046	20	30		EGEDHN
CCc1cc(CN2CCc3ncnc(C4CC4)c3CC2)ccc1C#N	ZINC001238776008	1377001125	/nfs/dbraw/zinc/00/11/25/1377001125.db2.gz	RKHBQDOXTSLKOE-UHFFFAOYSA-N	0	3	332.451	3.389	20	30		EGEDHN
C=CCCCC(=O)N[C@@H](C)C[C@@H](C)NCc1nccn1C(F)F	ZINC001135353203	1377049238	/nfs/dbraw/zinc/04/92/38/1377049238.db2.gz	DDIJYQWNNYOOSY-OLZOCXBDSA-N	0	3	328.407	3.007	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2ccc(C(F)F)cc2)c1	ZINC001135380962	1377065435	/nfs/dbraw/zinc/06/54/35/1377065435.db2.gz	HGZFXVBJTFNCDJ-UHFFFAOYSA-N	0	3	329.350	3.015	20	30		EGEDHN
N#Cc1ccc(N2CCCN(Cc3ccc(F)c4cc[nH]c43)CC2)nc1	ZINC001248818045	1377070664	/nfs/dbraw/zinc/07/06/64/1377070664.db2.gz	VTKRNQVXHKGKJX-UHFFFAOYSA-N	0	3	349.413	3.286	20	30		EGEDHN
Cc1ccc(Cl)cc1C(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001135500954	1377120773	/nfs/dbraw/zinc/12/07/73/1377120773.db2.gz	FIZKWSPGYMZJRI-UHFFFAOYSA-N	0	3	345.805	3.179	20	30		EGEDHN
CCCC(C)(C)C(=O)N1CC[C@@H](CNCc2ccccc2C#N)C1	ZINC001266012979	1377175747	/nfs/dbraw/zinc/17/57/47/1377175747.db2.gz	OMFHVKMCSLFPOA-INIZCTEOSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1cnc2c(F)cccc2c1	ZINC001266161480	1377212309	/nfs/dbraw/zinc/21/23/09/1377212309.db2.gz	XAEWPYSCBWAQON-LBPRGKRZSA-N	0	3	335.810	3.224	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)C(C1CC1)C1CC1	ZINC001135902805	1377255603	/nfs/dbraw/zinc/25/56/03/1377255603.db2.gz	ZDWYPLZEHSGEBH-VXGBXAGGSA-N	0	3	343.309	3.204	20	30		EGEDHN
C=CCN1C(=O)CCC[C@]12CCCN(Cc1ccc3c(c1)COC3)C2	ZINC001137023587	1377459914	/nfs/dbraw/zinc/45/99/14/1377459914.db2.gz	WIPNTCRHXKVNOX-OAQYLSRUSA-N	0	3	340.467	3.250	20	30		EGEDHN
CCCCC(=O)N1CC[C@H]2[C@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001268260881	1377503567	/nfs/dbraw/zinc/50/35/67/1377503567.db2.gz	AIQHDJSGBJEBKU-PBHICJAKSA-N	0	3	331.485	3.233	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3cc(OC)ccc3Cl)C2)C1=O	ZINC001137261523	1377505705	/nfs/dbraw/zinc/50/57/05/1377505705.db2.gz	QGGNHPPJWXVOEP-LJQANCHMSA-N	0	3	348.874	3.349	20	30		EGEDHN
N#Cc1ccc(N2CCCN(Cc3cnc4ccccc4c3)CC2)nc1	ZINC001137283077	1377510024	/nfs/dbraw/zinc/51/00/24/1377510024.db2.gz	UDLAMKWUUQLJGF-UHFFFAOYSA-N	0	3	343.434	3.214	20	30		EGEDHN
CC(=O)NC1CCN(Cc2ccc(C#Cc3ccccc3)cc2)CC1	ZINC001138333563	1377704166	/nfs/dbraw/zinc/70/41/66/1377704166.db2.gz	IEDRDRFSOKZZHW-UHFFFAOYSA-N	0	3	332.447	3.187	20	30		EGEDHN
C#CCOc1ccc(CN(C)CCOc2ccccc2)cc1OC	ZINC001138345916	1377706382	/nfs/dbraw/zinc/70/63/82/1377706382.db2.gz	RWLSWFYASSEFFG-UHFFFAOYSA-N	0	3	325.408	3.218	20	30		EGEDHN
C#CCOc1ccc(CN2CC[C@H](Oc3ccccc3)C2)cc1OC	ZINC001138346225	1377706455	/nfs/dbraw/zinc/70/64/55/1377706455.db2.gz	YURBQQZAOWRHII-IBGZPJMESA-N	0	3	337.419	3.361	20	30		EGEDHN
C#CCOc1ccc(CN2CCC[C@H](Oc3cc(C)ccn3)C2)cc1	ZINC001138560705	1377743091	/nfs/dbraw/zinc/74/30/91/1377743091.db2.gz	IJYZIWKDPKFGPS-FQEVSTJZSA-N	0	3	336.435	3.445	20	30		EGEDHN
O=C1C=C2CN(Cc3cccc(Oc4ncccn4)c3)CCC2S1	ZINC001138619433	1377754620	/nfs/dbraw/zinc/75/46/20/1377754620.db2.gz	GWLHIDFMWFTKMA-MRXNPFEDSA-N	0	3	339.420	3.043	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2Cc3ccccc3[C@@H](C(=O)OC)C2)c1[O-]	ZINC001138630100	1377757446	/nfs/dbraw/zinc/75/74/46/1377757446.db2.gz	QYJHTLADGOIKHS-IBGZPJMESA-N	0	3	337.419	3.393	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2Cc3ccccc3[C@@H](C(=O)OC)C2)c1[O-]	ZINC001138630100	1377757449	/nfs/dbraw/zinc/75/74/49/1377757449.db2.gz	QYJHTLADGOIKHS-IBGZPJMESA-N	0	3	337.419	3.393	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@H](Oc3ncccc3OC)C2)c1[O-]	ZINC001138631057	1377757826	/nfs/dbraw/zinc/75/78/26/1377757826.db2.gz	IYXOOCJGZOQBMG-KRWDZBQOSA-N	0	3	340.423	3.178	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@H](Oc3ncccc3OC)C2)c1[O-]	ZINC001138631057	1377757830	/nfs/dbraw/zinc/75/78/30/1377757830.db2.gz	IYXOOCJGZOQBMG-KRWDZBQOSA-N	0	3	340.423	3.178	20	30		EGEDHN
C=CCOc1ccccc1CN1CC[C@]2(C[C@H](OCC3CC3)CO2)C1	ZINC001139032358	1377820389	/nfs/dbraw/zinc/82/03/89/1377820389.db2.gz	LMXYTBXOYRBKJN-FPOVZHCZSA-N	0	3	343.467	3.411	20	30		EGEDHN
C=CCOc1ccccc1CN1CC[C@H]2[C@@H](CCN2C(=O)C(C)C)C1	ZINC001139032585	1377820425	/nfs/dbraw/zinc/82/04/25/1377820425.db2.gz	PWYDKMSEZVDITA-HKUYNNGSSA-N	0	3	342.483	3.330	20	30		EGEDHN
N#Cc1ccc(Oc2ccc(CN3CC[C@@H]4COC[C@@H]4C3)cn2)cc1	ZINC001139427089	1377882272	/nfs/dbraw/zinc/88/22/72/1377882272.db2.gz	UBMMODBTCGLYCZ-MSOLQXFVSA-N	0	3	335.407	3.214	20	30		EGEDHN
C[C@H]1CCCN(Cc2ccc(Oc3ccc(C#N)cc3)nc2)[C@@H]1CO	ZINC001139427231	1377882337	/nfs/dbraw/zinc/88/23/37/1377882337.db2.gz	ZFHCFKJVCRDDFL-HNAYVOBHSA-N	0	3	337.423	3.338	20	30		EGEDHN
CC(C)(C)OC(=O)[C@H]1CCN(Cc2c[nH]c3c2cccc3C#N)C1	ZINC001139703853	1377937643	/nfs/dbraw/zinc/93/76/43/1377937643.db2.gz	VSEVLJUJEYCKAL-AWEZNQCLSA-N	0	3	325.412	3.203	20	30		EGEDHN
N#Cc1cccc(O[C@@H]2CCC[N@@H+](Cc3cc(F)ccc3[O-])C2)c1	ZINC001140058934	1377998113	/nfs/dbraw/zinc/99/81/13/1377998113.db2.gz	PSKPMVZBJDKTFC-GOSISDBHSA-N	0	3	326.371	3.446	20	30		EGEDHN
N#Cc1cccc(O[C@@H]2CCC[N@H+](Cc3cc(F)ccc3[O-])C2)c1	ZINC001140058934	1377998120	/nfs/dbraw/zinc/99/81/20/1377998120.db2.gz	PSKPMVZBJDKTFC-GOSISDBHSA-N	0	3	326.371	3.446	20	30		EGEDHN
N#Cc1ccc2[nH]cc(CN3CC[C@@H](N4CCCCC4)[C@@H](F)C3)c2c1	ZINC001140118371	1378012869	/nfs/dbraw/zinc/01/28/69/1378012869.db2.gz	GDYTTZXALMCZPC-AZUAARDMSA-N	0	3	340.446	3.438	20	30		EGEDHN
C=CCO[C@H]1CO[C@@]2(C1)CCCN(Cc1c[nH]c3cccc(O)c13)C2	ZINC001140233835	1378035249	/nfs/dbraw/zinc/03/52/49/1378035249.db2.gz	VQMDERJRRHLSDO-OXQOHEQNSA-N	0	3	342.439	3.200	20	30		EGEDHN
N#Cc1cccc(O[C@@H]2CCCN(Cc3ccc4n[nH]cc4c3)C2)c1	ZINC001140388022	1378056074	/nfs/dbraw/zinc/05/60/74/1378056074.db2.gz	FSOYTXGBHZHOCX-LJQANCHMSA-N	0	3	332.407	3.478	20	30		EGEDHN
C=CCN1c2ccccc2[C@]2(CC[N@@H+](Cc3ccccc3[O-])C2)C1=O	ZINC001272619074	1378076317	/nfs/dbraw/zinc/07/63/17/1378076317.db2.gz	RFJGDSUXEZBHHE-OAQYLSRUSA-N	0	3	334.419	3.069	20	30		EGEDHN
C=CCN1c2ccccc2[C@]2(CC[N@H+](Cc3ccccc3[O-])C2)C1=O	ZINC001272619074	1378076320	/nfs/dbraw/zinc/07/63/20/1378076320.db2.gz	RFJGDSUXEZBHHE-OAQYLSRUSA-N	0	3	334.419	3.069	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@]3(CCN(CC(F)F)C3=O)CC2)c1	ZINC001272651853	1378077138	/nfs/dbraw/zinc/07/71/38/1378077138.db2.gz	YFKWDRYGFRWJBW-IBGZPJMESA-N	0	3	347.409	3.028	20	30		EGEDHN
N#Cc1ccc(CN2C[C@H]3CCC[C@@]3(COCc3ccncc3)C2)cn1	ZINC001140543166	1378081395	/nfs/dbraw/zinc/08/13/95/1378081395.db2.gz	LJRYSCFGVPCHRZ-CTNGQTDRSA-N	0	3	348.450	3.167	20	30		EGEDHN
COC(=O)[C@H](c1ccccc1)[C@H]1CCCCN1Cc1ccc(C#N)nc1	ZINC001140545942	1378083037	/nfs/dbraw/zinc/08/30/37/1378083037.db2.gz	QNNUXBGEKNPCQW-WOJBJXKFSA-N	0	3	349.434	3.265	20	30		EGEDHN
C=C(C)CN1C[C@]2(CC1=O)CCCC[N@@H+]2Cc1cc(F)ccc1[O-]	ZINC001273284416	1378094412	/nfs/dbraw/zinc/09/44/12/1378094412.db2.gz	HYBFJNZKFZSONK-LJQANCHMSA-N	0	3	332.419	3.064	20	30		EGEDHN
C=C(C)CN1C[C@]2(CC1=O)CCCC[N@H+]2Cc1cc(F)ccc1[O-]	ZINC001273284416	1378094415	/nfs/dbraw/zinc/09/44/15/1378094415.db2.gz	HYBFJNZKFZSONK-LJQANCHMSA-N	0	3	332.419	3.064	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@@H]3[C@H]2CCC(=O)N3[C@H](C)CC)c1[O-]	ZINC001273360467	1378098841	/nfs/dbraw/zinc/09/88/41/1378098841.db2.gz	OGOZCWMBTGOYKJ-ATZDWAIDSA-N	0	3	342.483	3.485	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@@H]3[C@H]2CCC(=O)N3[C@H](C)CC)c1[O-]	ZINC001273360467	1378098843	/nfs/dbraw/zinc/09/88/43/1378098843.db2.gz	OGOZCWMBTGOYKJ-ATZDWAIDSA-N	0	3	342.483	3.485	20	30		EGEDHN
C=CCOC[C@H]1CCC[C@@]12CN(Cc1cnc3cc[nH]cc1-3)CCO2	ZINC001140803479	1378141628	/nfs/dbraw/zinc/14/16/28/1378141628.db2.gz	QNNNTEPICLZABL-YLJYHZDGSA-N	0	3	341.455	3.137	20	30		EGEDHN
C=CCOC[C@H]1CCC[C@@]12CN(Cc1c[nH]c3ccncc13)CCO2	ZINC001140803479	1378141629	/nfs/dbraw/zinc/14/16/29/1378141629.db2.gz	QNNNTEPICLZABL-YLJYHZDGSA-N	0	3	341.455	3.137	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCC[N@@H+](Cc1ccc(C)cc1[O-])CC2	ZINC001140949437	1378190111	/nfs/dbraw/zinc/19/01/11/1378190111.db2.gz	BPVXHBSIVDTMKM-FQEVSTJZSA-N	0	3	328.456	3.234	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCC[N@H+](Cc1ccc(C)cc1[O-])CC2	ZINC001140949437	1378190114	/nfs/dbraw/zinc/19/01/14/1378190114.db2.gz	BPVXHBSIVDTMKM-FQEVSTJZSA-N	0	3	328.456	3.234	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@H]1CCN(Cc1cnc(CCCC)[nH]1)C2	ZINC001141068222	1378227257	/nfs/dbraw/zinc/22/72/57/1378227257.db2.gz	BCELKKSZYGYOKB-AZUAARDMSA-N	0	3	347.503	3.326	20	30		EGEDHN
C=CCN(C)Cc1cn(S(=O)(=O)c2ccccc2)c2ccccc12	ZINC001141967024	1378399270	/nfs/dbraw/zinc/39/92/70/1378399270.db2.gz	OKRRFTSSRDQZIV-UHFFFAOYSA-N	0	3	340.448	3.496	20	30		EGEDHN
C[C@H]1CN(Cc2c[nH]c3cc(C#N)ccc23)CC[C@@]1(O)C(F)(F)F	ZINC001142911743	1378507927	/nfs/dbraw/zinc/50/79/27/1378507927.db2.gz	HTCKJRCZHVKWBY-ZBEGNZNMSA-N	0	3	337.345	3.175	20	30		EGEDHN
Cc1cncnc1O[C@H]1CCCN(Cc2c[nH]c3cc(C#N)ccc23)C1	ZINC001142931157	1378511265	/nfs/dbraw/zinc/51/12/65/1378511265.db2.gz	OWBHASMVZNDCCZ-KRWDZBQOSA-N	0	3	347.422	3.181	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCCN(Cc3ccc4cc[nH]c4n3)C2)cc1	ZINC001144186937	1378695029	/nfs/dbraw/zinc/69/50/29/1378695029.db2.gz	OHBWPBFRHDEYDO-IBGZPJMESA-N	0	3	332.407	3.478	20	30		EGEDHN
C#Cc1ccc(CN2CCC3(CC2)C(=O)N[C@H]3c2ccccc2)cc1	ZINC001144573594	1378746959	/nfs/dbraw/zinc/74/69/59/1378746959.db2.gz	MJEWQLXOKWQJHX-FQEVSTJZSA-N	0	3	330.431	3.121	20	30		EGEDHN
N#C[C@@H]1CCCN(Cc2c[nH]c3cc(Br)cnc23)CC1	ZINC001144703838	1378761906	/nfs/dbraw/zinc/76/19/06/1378761906.db2.gz	MUZVHQMANCQKTH-LLVKDONJSA-N	0	3	333.233	3.451	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2ocnc2C)CCCCC1	ZINC001146702704	1378903069	/nfs/dbraw/zinc/90/30/69/1378903069.db2.gz	ZQBMZPKPAHCELB-HZPDHXFCSA-N	0	3	345.487	3.330	20	30		EGEDHN
Cc1cc(C)cc(CCC(=O)NCCNCc2ccc(C#N)cc2)c1	ZINC001146753530	1378913650	/nfs/dbraw/zinc/91/36/50/1378913650.db2.gz	LVUXUUPAKCHEON-UHFFFAOYSA-N	0	3	335.451	3.014	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2ccn(CC)n2)CCCC1	ZINC001146823443	1378928897	/nfs/dbraw/zinc/92/88/97/1378928897.db2.gz	ZZEOKMKXXUCSLL-IAGOWNOFSA-N	0	3	346.519	3.412	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2conc2C)CCCC1	ZINC001146823387	1378928923	/nfs/dbraw/zinc/92/89/23/1378928923.db2.gz	ZAXYFOLPFBUAAG-GJZGRUSLSA-N	0	3	333.476	3.492	20	30		EGEDHN
C=CCCC(=O)N1CC2(C1)CCN(Cc1ccccc1OC(C)C)C2	ZINC001147158643	1378978237	/nfs/dbraw/zinc/97/82/37/1378978237.db2.gz	FFXJDIYMYHFRTF-UHFFFAOYSA-N	0	3	342.483	3.474	20	30		EGEDHN
CC[C@@H](C)CC(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001147449801	1379022973	/nfs/dbraw/zinc/02/29/73/1379022973.db2.gz	CMZKTMFYROEVMO-MRXNPFEDSA-N	0	3	325.456	3.029	20	30		EGEDHN
C[C@@H](CN(C)C(=O)C(C)(C)C1CCC1)NCc1ccc(F)c(C#N)c1	ZINC001283649190	1379080189	/nfs/dbraw/zinc/08/01/89/1379080189.db2.gz	NDWICOPKHHXEJG-AWEZNQCLSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001148129562	1379122165	/nfs/dbraw/zinc/12/21/65/1379122165.db2.gz	GLQKXEUXCGJEMY-KRWDZBQOSA-N	0	3	337.467	3.195	20	30		EGEDHN
CC[C@@H](C)[C@H](C)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001148500599	1379192031	/nfs/dbraw/zinc/19/20/31/1379192031.db2.gz	JLZYGSLVBJJEHW-SJORKVTESA-N	0	3	339.483	3.275	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@@H](C)CCc3cccc(F)c3)C2)C1	ZINC001148797010	1379270044	/nfs/dbraw/zinc/27/00/44/1379270044.db2.gz	BLUNYFOVBDDGAW-INIZCTEOSA-N	0	3	330.447	3.115	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cc(Cl)ccc2Cl)cc1	ZINC001148905037	1379295633	/nfs/dbraw/zinc/29/56/33/1379295633.db2.gz	WLYDYYOHYKWIPJ-UHFFFAOYSA-N	0	3	348.233	3.385	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2cc(Cl)cc(Cl)c2)c1	ZINC001148910663	1379297022	/nfs/dbraw/zinc/29/70/22/1379297022.db2.gz	YKQKKLPMWWCAHX-UHFFFAOYSA-N	0	3	348.233	3.385	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CCCO[C@H](CNC(=O)C#CC(C)(C)C)C1	ZINC001149686658	1379428413	/nfs/dbraw/zinc/42/84/13/1379428413.db2.gz	FYDTUXPECPXQAV-PKOBYXMFSA-N	0	3	342.483	3.004	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@@H]1CN(Cc2cccc(C)c2)CCCO1	ZINC001149772003	1379442551	/nfs/dbraw/zinc/44/25/51/1379442551.db2.gz	LECRGGWNSOIOLZ-LJQANCHMSA-N	0	3	344.499	3.304	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2csc3c2CCCC3)s1	ZINC001150301288	1379529318	/nfs/dbraw/zinc/52/93/18/1379529318.db2.gz	CUSNWNOKNPXUFM-UHFFFAOYSA-N	0	3	345.493	3.080	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)[C@H](CC)CC2CCCC2)C1	ZINC001150402100	1379546793	/nfs/dbraw/zinc/54/67/93/1379546793.db2.gz	ABFICEUQTDOJKJ-RTBURBONSA-N	0	3	336.520	3.376	20	30		EGEDHN
Cc1[nH]c2ccc(C(=O)NCCNCc3ccc(C#N)cc3)cc2c1C	ZINC001150646385	1379588929	/nfs/dbraw/zinc/58/89/29/1379588929.db2.gz	DBWZPMDQODJZNT-UHFFFAOYSA-N	0	3	346.434	3.176	20	30		EGEDHN
Cc1cc(C)cc(C2(C(=O)NCCNCc3ccc(C#N)cc3)CC2)c1	ZINC001151250900	1379687962	/nfs/dbraw/zinc/68/79/62/1379687962.db2.gz	KSFSNKWQSKQCHD-UHFFFAOYSA-N	0	3	347.462	3.113	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)C2[C@H]3CCCCCC[C@H]23)CC1	ZINC001151339832	1379701706	/nfs/dbraw/zinc/70/17/06/1379701706.db2.gz	MHLYJZDIIGJZMP-ROUUACIJSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@@H](C)c2ccc(C)o2)CC1	ZINC001151346568	1379703162	/nfs/dbraw/zinc/70/31/62/1379703162.db2.gz	ZXGPNFTWGZTQQO-KRWDZBQOSA-N	0	3	348.487	3.255	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@H]2C[C@]2(CC)C(C)C)CC1	ZINC001151381336	1379708365	/nfs/dbraw/zinc/70/83/65/1379708365.db2.gz	NNJKBABXHNLBDZ-YLJYHZDGSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@@H](F)CCCCCC)CC1	ZINC001151392613	1379709985	/nfs/dbraw/zinc/70/99/85/1379709985.db2.gz	NLBKIMKMMXSMAC-KRWDZBQOSA-N	0	3	342.499	3.468	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc(F)c3occc32)s1	ZINC001151593625	1379742593	/nfs/dbraw/zinc/74/25/93/1379742593.db2.gz	KXHIFJUVVXOIPW-UHFFFAOYSA-N	0	3	343.383	3.025	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)c1occc1C	ZINC001151892789	1379812282	/nfs/dbraw/zinc/81/22/82/1379812282.db2.gz	BEIBHGOPCOYOGJ-CQSZACIVSA-N	0	3	343.402	3.239	20	30		EGEDHN
C=C[C@H](C(=O)NCCNCc1cc(C)ccc1OC)c1ccccc1	ZINC001152003958	1379836365	/nfs/dbraw/zinc/83/63/65/1379836365.db2.gz	YFMNAQOEXGGTCX-IBGZPJMESA-N	0	3	338.451	3.179	20	30		EGEDHN
C[C@@H](CC(=O)NCCNCc1ccc(C#N)s1)c1ccc(F)cc1	ZINC001152115196	1379864590	/nfs/dbraw/zinc/86/45/90/1379864590.db2.gz	GPBVLUASENRBEJ-ZDUSSCGKSA-N	0	3	345.443	3.158	20	30		EGEDHN
CC/C=C(/C)C(=O)NC[C@@H](C)N(CC)Cc1ccc(OC)c(C#N)c1	ZINC001152189655	1379881978	/nfs/dbraw/zinc/88/19/78/1379881978.db2.gz	UTZSDDLHTKKLQH-MVMZHWFQSA-N	0	3	343.471	3.250	20	30		EGEDHN
CC(C)(CC(=O)NCCNCc1ccc(C#N)s1)c1ccccc1	ZINC001152451783	1379935472	/nfs/dbraw/zinc/93/54/72/1379935472.db2.gz	HHJANNRYYBIOJN-UHFFFAOYSA-N	0	3	341.480	3.193	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)c1coc(C)c1	ZINC001152955366	1379999087	/nfs/dbraw/zinc/99/90/87/1379999087.db2.gz	OVZDCSIEEWMNSG-CQSZACIVSA-N	0	3	325.412	3.100	20	30		EGEDHN
CC(C)(C)[C@@H](CNCc1ccc(C#N)s1)NC(=O)c1cc(F)c[nH]1	ZINC001284607886	1380007485	/nfs/dbraw/zinc/00/74/85/1380007485.db2.gz	GFXVZZHKIDKAQU-OAHLLOKOSA-N	0	3	348.447	3.021	20	30		EGEDHN
C#CCCCC(=O)NC[C@@H](C)N(CC)C[C@@H](OC)c1ccccc1	ZINC001153025396	1380010593	/nfs/dbraw/zinc/01/05/93/1380010593.db2.gz	UUDXCYIDMLIIDF-IEBWSBKVSA-N	0	3	330.472	3.004	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)C1CC(C)(C)C1	ZINC001153096042	1380020094	/nfs/dbraw/zinc/02/00/94/1380020094.db2.gz	CGROPSFRWCPUED-CQSZACIVSA-N	0	3	345.462	3.460	20	30		EGEDHN
CCN(Cc1cccc(OC(C)C)c1)[C@H](C)CNC(=O)C#CC1CC1	ZINC001153232316	1380041051	/nfs/dbraw/zinc/04/10/51/1380041051.db2.gz	BSUXYXIKKQYZQS-QGZVFWFLSA-N	0	3	342.483	3.214	20	30		EGEDHN
CCN(CCOc1ccccc1F)[C@H](C)CNC(=O)C#CC(C)(C)C	ZINC001153266062	1380046589	/nfs/dbraw/zinc/04/65/89/1380046589.db2.gz	JAJYUSVHKQOCQF-MRXNPFEDSA-N	0	3	348.462	3.081	20	30		EGEDHN
C=CCC[C@H](C(=O)NCCNCc1cnccc1C)c1ccccc1	ZINC001153817904	1380135680	/nfs/dbraw/zinc/13/56/80/1380135680.db2.gz	UDUXEVSFKJSBOE-FQEVSTJZSA-N	0	3	337.467	3.346	20	30		EGEDHN
CCc1ccc(C(=O)NCCNCc2cccc(C#N)c2)cc1CC	ZINC001154012448	1380178778	/nfs/dbraw/zinc/17/87/78/1380178778.db2.gz	AHUPXDSQNLJLAG-UHFFFAOYSA-N	0	3	335.451	3.203	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)CC1CC(F)(F)C1	ZINC001154073867	1380199082	/nfs/dbraw/zinc/19/90/82/1380199082.db2.gz	CNIPMUNESZFJLS-CQSZACIVSA-N	0	3	349.425	3.320	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1cc2ccccc2cc1F	ZINC001154269844	1380243587	/nfs/dbraw/zinc/24/35/87/1380243587.db2.gz	XWEUCDWPTUNZNC-OAHLLOKOSA-N	0	3	326.415	3.442	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)[C@@H](C)CC(F)F	ZINC001154359627	1380263881	/nfs/dbraw/zinc/26/38/81/1380263881.db2.gz	DKCLCJUPIWOXMZ-UONOGXRCSA-N	0	3	337.414	3.176	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)[C@H]1CCC1(C)C	ZINC001154735572	1380342769	/nfs/dbraw/zinc/34/27/69/1380342769.db2.gz	HNAFCUGWJSPUJW-CRAIPNDOSA-N	0	3	327.472	3.321	20	30		EGEDHN
CCC[C@H](OCC)C(=O)NC[C@@H](C)N(CC)Cc1cccc(C#N)c1	ZINC001154756532	1380346784	/nfs/dbraw/zinc/34/67/84/1380346784.db2.gz	BWXOVORYCOZDLP-APWZRJJASA-N	0	3	345.487	3.090	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H](C)N(CC)C[C@H](O)c1ccc(F)cc1	ZINC001154927248	1380377344	/nfs/dbraw/zinc/37/73/44/1380377344.db2.gz	KIXNTBZVHKLZNV-QAPCUYQASA-N	0	3	336.451	3.042	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H](C)N(CC)C[C@@H](O)c2ccccc2)CCC1	ZINC001155061774	1380400918	/nfs/dbraw/zinc/40/09/18/1380400918.db2.gz	HLMWWJTUSDDNRZ-IEBWSBKVSA-N	0	3	344.499	3.293	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@@H](C)N(CC)Cc1ccnc(N(C)C)c1	ZINC001155066891	1380402519	/nfs/dbraw/zinc/40/25/19/1380402519.db2.gz	QIGFLFLHHWQBHF-OXQOHEQNSA-N	0	3	346.519	3.077	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)[C@]12C[C@H]1CCCC2	ZINC001155120386	1380412339	/nfs/dbraw/zinc/41/23/39/1380412339.db2.gz	QTTABBZFGPZUME-OZOXKJRCSA-N	0	3	339.483	3.465	20	30		EGEDHN
CCN(CC#CCOC)[C@H](C)CNC(=O)C[C@@H](C)CCC=C(C)C	ZINC001155407224	1380447451	/nfs/dbraw/zinc/44/74/51/1380447451.db2.gz	UVYXYLHSTAERDT-RBUKOAKNSA-N	0	3	336.520	3.235	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@@H]1C[C@H]1c1ccc(C)c(C)c1	ZINC001155710536	1380485987	/nfs/dbraw/zinc/48/59/87/1380485987.db2.gz	LJXLCVVUBIWNOL-YZGWKJHDSA-N	0	3	326.484	3.257	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1ccc(O[C@@H](C)CC)cc1	ZINC001156218566	1380544451	/nfs/dbraw/zinc/54/44/51/1380544451.db2.gz	SIKLZUWJEJAJNL-SJORKVTESA-N	0	3	330.472	3.327	20	30		EGEDHN
N#Cc1cc2c(nc1-n1cncc1CNCc1ccccc1)CCCC2	ZINC001156509089	1380585687	/nfs/dbraw/zinc/58/56/87/1380585687.db2.gz	PBBMHKRGFDTTQO-UHFFFAOYSA-N	0	3	343.434	3.308	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@H](c1ccc(F)cc1)C(C)C	ZINC001157172874	1380795473	/nfs/dbraw/zinc/79/54/73/1380795473.db2.gz	ZPFRMQPOIBZLHT-APWZRJJASA-N	0	3	332.463	3.415	20	30		EGEDHN
C=CCCOCC(=O)NC[C@@H](C)N(CC)Cc1cccc(Cl)c1	ZINC001157203569	1380809015	/nfs/dbraw/zinc/80/90/15/1380809015.db2.gz	VIPKQXUUTVRKKI-OAHLLOKOSA-N	0	3	338.879	3.259	20	30		EGEDHN
C=CCOCC(=O)N1CCCC[C@@H]1CN(C)[C@H](C)c1cccc(F)c1	ZINC001157686802	1381001931	/nfs/dbraw/zinc/00/19/31/1381001931.db2.gz	LFRYOAZOECOYSA-VQIMIIECSA-N	0	3	348.462	3.402	20	30		EGEDHN
C=CCCC(=O)N1CCCC[C@@H]1CN(C)CCOCc1ccccc1	ZINC001157711350	1381011097	/nfs/dbraw/zinc/01/10/97/1381011097.db2.gz	ROAHCRFXFBFGAZ-HXUWFJFHSA-N	0	3	344.499	3.482	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)C1C(C)(C)C1(C)C	ZINC001157754099	1381022489	/nfs/dbraw/zinc/02/24/89/1381022489.db2.gz	BNWCUFCBXAQUJW-MRXNPFEDSA-N	0	3	336.520	3.184	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1ccc(C)c(F)c1	ZINC001158195392	1381156254	/nfs/dbraw/zinc/15/62/54/1381156254.db2.gz	XRZJXOHGIKNWON-GOSISDBHSA-N	0	3	348.462	3.263	20	30		EGEDHN
CN1CCC(N(Cc2ccc(F)cc2)c2ncc(C#N)cc2C#N)CC1	ZINC001158446610	1381247988	/nfs/dbraw/zinc/24/79/88/1381247988.db2.gz	WZGUSMOOUPMEAU-UHFFFAOYSA-N	0	3	349.413	3.065	20	30		EGEDHN
C=C(Cl)CN(C)C[C@H]1CCCCN1C(=O)c1cc(C(F)F)[nH]n1	ZINC001158467222	1381254903	/nfs/dbraw/zinc/25/49/03/1381254903.db2.gz	CMXOSTSPRFXKQL-LLVKDONJSA-N	0	3	346.809	3.026	20	30		EGEDHN
C[Si](C)(C)C#Cc1ccnc(N2CCCc3ccc(CN)nc32)c1	ZINC001158656001	1381339450	/nfs/dbraw/zinc/33/94/50/1381339450.db2.gz	QXXDRSAEOJCOKC-UHFFFAOYSA-N	0	3	336.515	3.249	20	30		EGEDHN
C[C@]1(C(=O)NCCCNCc2ccc(C#N)cc2F)CC=CCC1	ZINC001158761244	1381386854	/nfs/dbraw/zinc/38/68/54/1381386854.db2.gz	HNHSWDLETLBEAI-IBGZPJMESA-N	0	3	329.419	3.040	20	30		EGEDHN
C=C[C@H](CC(=O)N1CCCC[C@@H]1CN(C)CCOC)c1ccccc1	ZINC001158900378	1381454854	/nfs/dbraw/zinc/45/48/54/1381454854.db2.gz	BKCVSVCBOKMVDQ-UYAOXDASSA-N	0	3	344.499	3.306	20	30		EGEDHN
CC(C)(C(=O)NCCCNCc1ccccc1C#N)C1CCCC1	ZINC001160075215	1381990513	/nfs/dbraw/zinc/99/05/13/1381990513.db2.gz	GTBCRSKRYATEJE-UHFFFAOYSA-N	0	3	327.472	3.371	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1cscc1Cl	ZINC001160534825	1382134273	/nfs/dbraw/zinc/13/42/73/1382134273.db2.gz	PUIDLMSXGKHVAS-UHFFFAOYSA-N	0	3	333.844	3.183	20	30		EGEDHN
N#C[C@H]1CCCCN1C(=O)C[C@@H](N)c1ccc(Cl)cc1Cl	ZINC001160637118	1382158427	/nfs/dbraw/zinc/15/84/27/1382158427.db2.gz	KPGLVVQTZICGHW-BXUZGUMPSA-N	0	3	326.227	3.288	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H](C)c2c(F)cccc2F)CC1	ZINC001160699940	1382174608	/nfs/dbraw/zinc/17/46/08/1382174608.db2.gz	NRSZUJGIBBTWTD-HNNXBMFYSA-N	0	3	346.421	3.230	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H]2COc3cc(C)c(C)cc32)CC1	ZINC001160778848	1382193645	/nfs/dbraw/zinc/19/36/45/1382193645.db2.gz	QYESMPCDZOYJAR-LJQANCHMSA-N	0	3	340.467	3.104	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)C[C@H]2C=CCCC2)c(F)c1	ZINC001160802944	1382201379	/nfs/dbraw/zinc/20/13/79/1382201379.db2.gz	FLLYMYWVDJKAGL-HNNXBMFYSA-N	0	3	329.419	3.040	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCC1=CCN(Cc2cccnc2C)CC1	ZINC001160882188	1382222982	/nfs/dbraw/zinc/22/29/82/1382222982.db2.gz	GKIBGERTLMZILO-UHFFFAOYSA-N	0	3	327.472	3.241	20	30		EGEDHN
C=CCN1CCC[C@H]1CNc1nccc(Oc2cccc(F)c2)n1	ZINC001160953757	1382249728	/nfs/dbraw/zinc/24/97/28/1382249728.db2.gz	JGVOMMDKMCBXRS-HNNXBMFYSA-N	0	3	328.391	3.470	20	30		EGEDHN
C=CCCCC(=O)NCCC1=CCN(Cc2cccnc2C)CC1	ZINC001161056659	1382285187	/nfs/dbraw/zinc/28/51/87/1382285187.db2.gz	NBSFAPDQTSJJPC-UHFFFAOYSA-N	0	3	327.472	3.385	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CCCOCc2ccccc2)CC1	ZINC001161061907	1382287500	/nfs/dbraw/zinc/28/75/00/1382287500.db2.gz	GOKOHNZVAGWBKB-UHFFFAOYSA-N	0	3	342.483	3.308	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NCCCNCc1ccccc1C#N	ZINC001161174387	1382325379	/nfs/dbraw/zinc/32/53/79/1382325379.db2.gz	PAZCBBMNXFFFAB-UHFFFAOYSA-N	0	3	349.434	3.033	20	30		EGEDHN
C=CCN(C(=O)[C@H](COCc1ccccc1)NC)C1CCCCC1	ZINC001161248284	1382354052	/nfs/dbraw/zinc/35/40/52/1382354052.db2.gz	XDEYXWQMUGREDN-IBGZPJMESA-N	0	3	330.472	3.139	20	30		EGEDHN
N#Cc1cc2nc(NCC3CCN(Cc4ccccn4)CC3)ccc2[nH]1	ZINC001161246716	1382354057	/nfs/dbraw/zinc/35/40/57/1382354057.db2.gz	YSOOPNZWSJYKPZ-UHFFFAOYSA-N	0	3	346.438	3.154	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H](CC)Oc2ccccc2C)CC1	ZINC001161356233	1382380521	/nfs/dbraw/zinc/38/05/21/1382380521.db2.gz	GWYQPQRNNABDTD-IBGZPJMESA-N	0	3	342.483	3.477	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H](C)Cc2cccs2)CC1	ZINC001161382875	1382390696	/nfs/dbraw/zinc/39/06/96/1382390696.db2.gz	CPSYCRHTMVLNMP-INIZCTEOSA-N	0	3	330.497	3.088	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc(Cl)c(OC)c2)CC1	ZINC001161422003	1382404721	/nfs/dbraw/zinc/40/47/21/1382404721.db2.gz	CQVZEPNCHMQMGG-UHFFFAOYSA-N	0	3	334.847	3.287	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)Cc2coc3ccccc23)CC1	ZINC001161585886	1382447963	/nfs/dbraw/zinc/44/79/63/1382447963.db2.gz	ZWNSXPRHMKLJKY-UHFFFAOYSA-N	0	3	336.435	3.137	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cnc3ccc(F)cc3c2)CC1	ZINC001161639893	1382467072	/nfs/dbraw/zinc/46/70/72/1382467072.db2.gz	IKKHLKKPKLEAMX-UHFFFAOYSA-N	0	3	339.414	3.312	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H]2CCCc3sc(C)nc32)CC1	ZINC001161678992	1382478465	/nfs/dbraw/zinc/47/84/65/1382478465.db2.gz	RRROPLRVBCQWCN-MRXNPFEDSA-N	0	3	345.512	3.196	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C(C)(C)c2ccc(C)cc2)CC1	ZINC001161729452	1382490871	/nfs/dbraw/zinc/49/08/71/1382490871.db2.gz	VABFVYISXBHFJM-UHFFFAOYSA-N	0	3	338.495	3.434	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C[C@@H]2OCCc3ccsc32)CC1	ZINC001161734368	1382492629	/nfs/dbraw/zinc/49/26/29/1382492629.db2.gz	ZJGPSKJTEPEAQG-KRWDZBQOSA-N	0	3	346.496	3.076	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc3[nH]ccc3s2)CC1	ZINC001161779703	1382504375	/nfs/dbraw/zinc/50/43/75/1382504375.db2.gz	OXEGDOIOUJDWNC-UHFFFAOYSA-N	0	3	327.453	3.005	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H](C)c2ccc(F)cc2F)CC1	ZINC001161904037	1382545337	/nfs/dbraw/zinc/54/53/37/1382545337.db2.gz	AJFQDAKVAJNXJC-CQSZACIVSA-N	0	3	334.410	3.393	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc3cccc(F)c3o2)CC1	ZINC001161909339	1382548329	/nfs/dbraw/zinc/54/83/29/1382548329.db2.gz	YQGBZAFKQYLJGC-UHFFFAOYSA-N	0	3	340.398	3.347	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)C1CCC2(CC2)CC1	ZINC001162684773	1382833418	/nfs/dbraw/zinc/83/34/18/1382833418.db2.gz	CYDAVMXUWRUKEJ-UHFFFAOYSA-N	0	3	325.456	3.125	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@]1(C)CCC[C@@H]1C	ZINC001162918650	1382916050	/nfs/dbraw/zinc/91/60/50/1382916050.db2.gz	FWAQKQSTKJRDRG-RXVVDRJESA-N	0	3	326.484	3.107	20	30		EGEDHN
C=CCC1(C(=O)N(CCNCC#CC)CCc2ccccc2)CCC1	ZINC001162919611	1382916646	/nfs/dbraw/zinc/91/66/46/1382916646.db2.gz	WSCHDMCJLOQCGS-UHFFFAOYSA-N	0	3	338.495	3.417	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N(CCNCC#CC)CCc1ccccc1	ZINC001162919305	1382916875	/nfs/dbraw/zinc/91/68/75/1382916875.db2.gz	PBXRWEHZGLGEHL-OAQYLSRUSA-N	0	3	326.484	3.273	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@]1(C)CCC[C@@H]1C	ZINC001162918966	1382917049	/nfs/dbraw/zinc/91/70/49/1382917049.db2.gz	JLFRXDSXRCEHHI-SIKLNZKXSA-N	0	3	340.511	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1cc(C)cc(C)c1	ZINC001162992392	1382940671	/nfs/dbraw/zinc/94/06/71/1382940671.db2.gz	NCHUSPNVVGUTTG-UHFFFAOYSA-N	0	3	334.463	3.211	20	30		EGEDHN
CCCCCCCN1CCN(Cc2ccc(CNC(C)=O)cc2)CC1	ZINC001163013341	1382948632	/nfs/dbraw/zinc/94/86/32/1382948632.db2.gz	LPEJYEHJCTZSEN-UHFFFAOYSA-N	0	3	345.531	3.411	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)[C@@H]2C[C@@H]3CCCC[C@H]23)c(F)c1	ZINC001163057417	1382956518	/nfs/dbraw/zinc/95/65/18/1382956518.db2.gz	MBUZOUWKHGVQSW-RYQLBKOJSA-N	0	3	343.446	3.120	20	30		EGEDHN
N#Cc1ccccc1CNCC1(CCNC(=O)/C=C\c2ccco2)CC1	ZINC001163202471	1382992168	/nfs/dbraw/zinc/99/21/68/1382992168.db2.gz	SYHHPEJWRXSHCC-FPLPWBNLSA-N	0	3	349.434	3.241	20	30		EGEDHN
C[C@@H]1C[C@@H]1C(=O)NCCC1(CNCC#Cc2ccccc2Cl)CC1	ZINC001163238534	1383002326	/nfs/dbraw/zinc/00/23/26/1383002326.db2.gz	YYSMZMQIPUQGJI-WBVHZDCISA-N	0	3	344.886	3.224	20	30		EGEDHN
COCCN(C)[C@H](CNc1ccc(C#N)cn1)c1ccc(Cl)cc1	ZINC001163385181	1383037573	/nfs/dbraw/zinc/03/75/73/1383037573.db2.gz	IILRQJWPGYZFRL-QGZVFWFLSA-N	0	3	344.846	3.338	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)C1(C2CCC2)CCC1	ZINC001163456507	1383055278	/nfs/dbraw/zinc/05/52/78/1383055278.db2.gz	YLCXCUOYBFEWET-UHFFFAOYSA-N	0	3	325.456	3.125	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCCN[C@@H](C)c2c(F)cccc2F)cc1	ZINC001163757775	1383118655	/nfs/dbraw/zinc/11/86/55/1383118655.db2.gz	ISPBETFXGMQTTH-AWEZNQCLSA-N	0	3	342.389	3.417	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCCCNCc1nsc2ccccc21	ZINC001164360791	1383181131	/nfs/dbraw/zinc/18/11/31/1383181131.db2.gz	UADNNHBKSLEWCN-AWEZNQCLSA-N	0	3	331.485	3.495	20	30		EGEDHN
N#Cc1ccc(C(F)(F)N2CCN[C@@H](c3ccccc3)C2)nc1Cl	ZINC001165195479	1383244575	/nfs/dbraw/zinc/24/45/75/1383244575.db2.gz	YOHOBCPSJBGZML-CQSZACIVSA-N	0	3	348.784	3.302	20	30		EGEDHN
Cc1ccc([C@@H](C#N)c2ccc(N3CCN(C(C)C)[C@H](C)C3)nn2)cc1	ZINC001165199178	1383245699	/nfs/dbraw/zinc/24/56/99/1383245699.db2.gz	VSXXVZUQTAVQRP-IEBWSBKVSA-N	0	3	349.482	3.359	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C[C@@H](C)c2ccncc2)CC1	ZINC001165718726	1383331284	/nfs/dbraw/zinc/33/12/84/1383331284.db2.gz	PFZKUSNWJYNWGT-CQSZACIVSA-N	0	3	335.879	3.204	20	30		EGEDHN
C[C@@H]1CCC[C@]1(C)C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001166053420	1383382869	/nfs/dbraw/zinc/38/28/69/1383382869.db2.gz	CLYBGGKTFFMGHA-KUHUBIRLSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cc3ncccc3o2)CC1	ZINC001166211336	1383402708	/nfs/dbraw/zinc/40/27/08/1383402708.db2.gz	OSEZUHZCPVUUAN-UHFFFAOYSA-N	0	3	333.819	3.070	20	30		EGEDHN
C=C/C(C)=C/CC(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001166679534	1383459053	/nfs/dbraw/zinc/45/90/53/1383459053.db2.gz	XKHHKPJSXMPKAI-CAOOACKPSA-N	0	3	337.467	3.457	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCC1(CNCc2nc(C)cs2)CC1	ZINC001166692129	1383461736	/nfs/dbraw/zinc/46/17/36/1383461736.db2.gz	AZWWWDXMHUKQLO-UKRRQHHQSA-N	0	3	335.517	3.286	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCC1(CNCc2cc(C3CC3)no2)CC1	ZINC001166704509	1383464264	/nfs/dbraw/zinc/46/42/64/1383464264.db2.gz	RCXHRWMZEQUUBW-HUUCEWRRSA-N	0	3	345.487	3.386	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@H](c2ccncc2)C(C)C)CC1	ZINC001166837084	1383485373	/nfs/dbraw/zinc/48/53/73/1383485373.db2.gz	WYEGXOXHUZUIHC-KRWDZBQOSA-N	0	3	349.906	3.450	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCC1(CN[C@@H](C)c2cnccn2)CC1	ZINC001167018092	1383519769	/nfs/dbraw/zinc/51/97/69/1383519769.db2.gz	ARSFECAPEJGZDU-MAUKXSAKSA-N	0	3	330.476	3.016	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCC1(CNCc2oc(C)nc2C)CC1	ZINC001167018129	1383520146	/nfs/dbraw/zinc/52/01/46/1383520146.db2.gz	CAPIQDUQOPZWEQ-SFHVURJKSA-N	0	3	333.476	3.270	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCC2(CN[C@@H](C)c3cnc(C)cn3)CC2)C1	ZINC001167129840	1383546944	/nfs/dbraw/zinc/54/69/44/1383546944.db2.gz	DRBNRYBDQLUFCZ-INIZCTEOSA-N	0	3	342.487	3.078	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@H]2CCCC(F)(F)C2)CC1	ZINC001167188612	1383561682	/nfs/dbraw/zinc/56/16/82/1383561682.db2.gz	VRDPOVYNDLASED-ZDUSSCGKSA-N	0	3	334.838	3.441	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cccc3cnccc32)CC1	ZINC001168146388	1383827266	/nfs/dbraw/zinc/82/72/66/1383827266.db2.gz	GUHWRSQILNUGEA-UHFFFAOYSA-N	0	3	343.858	3.477	20	30		EGEDHN
C[C@H]([C@H](C)C(=O)NCCCNCc1ccccc1C#N)C(C)(C)C	ZINC001168163762	1383830466	/nfs/dbraw/zinc/83/04/66/1383830466.db2.gz	BJOYHZSLCRCCPM-JKSUJKDBSA-N	0	3	329.488	3.472	20	30		EGEDHN
C=CCOC(=O)N[C@H]1CCCN([C@H]2CCc3cc(F)ccc3C2)C1	ZINC001168447667	1383908871	/nfs/dbraw/zinc/90/88/71/1383908871.db2.gz	GEBNTCZHGQXXJO-ROUUACIJSA-N	0	3	332.419	3.060	20	30		EGEDHN
CN(C)/C=N/c1ccc(NCCc2cn3ccccc3n2)cc1C#N	ZINC001169009146	1384087647	/nfs/dbraw/zinc/08/76/47/1384087647.db2.gz	MMZOIEAKQUKTKA-HYARGMPZSA-N	0	3	332.411	3.082	20	30		EGEDHN
CC(C)C[C@H]1CN(C)CCN1Cc1cc(Cl)ccc1OCC#N	ZINC001308101015	1384093302	/nfs/dbraw/zinc/09/33/02/1384093302.db2.gz	UFKZJOHFZFRFTH-KRWDZBQOSA-N	0	3	335.879	3.404	20	30		EGEDHN
CC(C)SCC(=O)N[C@@H](C)CCCCNCc1ccccc1C#N	ZINC001169266520	1384129736	/nfs/dbraw/zinc/12/97/36/1384129736.db2.gz	HTIKXCKLKQKFOL-INIZCTEOSA-N	0	3	347.528	3.464	20	30		EGEDHN
N#CC1(c2cccc(N3CCCc4ccc(CN)nc43)c2)CCOCC1	ZINC001169590738	1384162819	/nfs/dbraw/zinc/16/28/19/1384162819.db2.gz	MFSROOCAWCGPRO-UHFFFAOYSA-N	0	3	348.450	3.196	20	30		EGEDHN
CC[C@]1(C(C)C)C[C@H]1C(=O)NCCCNCc1ccccc1C#N	ZINC001169730407	1384179692	/nfs/dbraw/zinc/17/96/92/1384179692.db2.gz	SUKDXRQDDTZHHP-AZUAARDMSA-N	0	3	327.472	3.226	20	30		EGEDHN
CC[C@@]1(C(C)C)C[C@H]1C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001169730047	1384179888	/nfs/dbraw/zinc/17/98/88/1384179888.db2.gz	QXYUBYMTXROBFI-PXNSSMCTSA-N	0	3	345.462	3.366	20	30		EGEDHN
N#Cc1cc(CN[C@@H]2CCCN(C(=O)c3ccccc3)C2)cs1	ZINC001169750657	1384182635	/nfs/dbraw/zinc/18/26/35/1384182635.db2.gz	LYFXGWWBFHWBSS-MRXNPFEDSA-N	0	3	325.437	3.014	20	30		EGEDHN
C=CC(=NCOC)NC[C@@H](c1ccc(Cl)cc1Cl)N(C)C	ZINC001170586748	1384346351	/nfs/dbraw/zinc/34/63/51/1384346351.db2.gz	WZCSTKUTTCSAEI-AWEZNQCLSA-N	0	3	330.259	3.374	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H](C)CCCCN[C@@H](C)c1nnc(CC)[nH]1	ZINC001170997964	1384427144	/nfs/dbraw/zinc/42/71/44/1384427144.db2.gz	NCGSCLCDNADHRL-GJZGRUSLSA-N	0	3	349.523	3.295	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H](C)CCCCN[C@@H](C)c1nnc(CC)[nH]1	ZINC001170997963	1384427281	/nfs/dbraw/zinc/42/72/81/1384427281.db2.gz	NCGSCLCDNADHRL-CABCVRRESA-N	0	3	349.523	3.295	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)NCc1ccncc1Br	ZINC001171191967	1384464977	/nfs/dbraw/zinc/46/49/77/1384464977.db2.gz	JCXDXNRLIXBTIK-GFCCVEGCSA-N	0	3	330.229	3.437	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1CC[C@H](NC(=O)OC(C)(C)C)C1	ZINC001171209825	1384469766	/nfs/dbraw/zinc/46/97/66/1384469766.db2.gz	MWRHHXCSJQYFQA-PBHICJAKSA-N	0	3	329.444	3.088	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1CCC[C@@]1(C)Cc1ccc(F)cc1	ZINC001171307084	1384490711	/nfs/dbraw/zinc/49/07/11/1384490711.db2.gz	KPVHSVJEHILQKS-UZLBHIALSA-N	0	3	345.462	3.231	20	30		EGEDHN
CC[C@H](CC(=O)NCCCNCc1ccc(C#N)cc1F)C(C)C	ZINC001171560722	1384562934	/nfs/dbraw/zinc/56/29/34/1384562934.db2.gz	HOMXPSMQMILXMO-MRXNPFEDSA-N	0	3	333.451	3.366	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)c2ccc(Cl)cc2)c(F)c1	ZINC001171818459	1384649968	/nfs/dbraw/zinc/64/99/68/1384649968.db2.gz	LZHJUZSDNBDTTE-UHFFFAOYSA-N	0	3	345.805	3.260	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1cccc(Cl)c1	ZINC001171844929	1384659012	/nfs/dbraw/zinc/65/90/12/1384659012.db2.gz	XVXZXHRQWZOLNB-UHFFFAOYSA-N	0	3	327.815	3.121	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)N1CCN(Cc2ccc(F)cc2)CC1	ZINC001172309690	1384765632	/nfs/dbraw/zinc/76/56/32/1384765632.db2.gz	VZFLFKYVNORYPF-KRWDZBQOSA-N	0	3	337.442	3.446	20	30		EGEDHN
CCn1c2ccccc2nc1N1CCN([C@H](C)CCCC#N)CC1	ZINC001172508449	1384807489	/nfs/dbraw/zinc/80/74/89/1384807489.db2.gz	DDUXHORMWSSFKU-MRXNPFEDSA-N	0	3	325.460	3.261	20	30		EGEDHN
CCOC(=O)C1(C#N)CCN([C@H]2CC[C@@H](c3ccccc3)C2)CC1	ZINC001172568418	1384812548	/nfs/dbraw/zinc/81/25/48/1384812548.db2.gz	LZDGIGKQGGHNRJ-MSOLQXFVSA-N	0	3	326.440	3.492	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@H](CC)Oc2ccccc2C)C1	ZINC001317087536	1384849470	/nfs/dbraw/zinc/84/94/70/1384849470.db2.gz	KDVSNQKZUBLNQZ-JYJNAYRXSA-N	0	3	336.863	3.142	20	30		EGEDHN
C[C@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C#N)C1)c1cccnc1	ZINC001172969562	1384892751	/nfs/dbraw/zinc/89/27/51/1384892751.db2.gz	YPSHBGXAVKXQKC-IMJJTQAJSA-N	0	3	330.432	3.024	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H](NCc2ccc(C#N)s2)C[C@H]1C#N	ZINC001172985111	1384895237	/nfs/dbraw/zinc/89/52/37/1384895237.db2.gz	OCMHEODSTUSQHU-STQMWFEESA-N	0	3	346.456	3.001	20	30		EGEDHN
CCc1ccc(C[C@@H](C)N2CCN(c3cc(C#N)ccn3)CC2)cc1	ZINC001173242119	1384943745	/nfs/dbraw/zinc/94/37/45/1384943745.db2.gz	DOMTXHKYWWTKLF-QGZVFWFLSA-N	0	3	334.467	3.269	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@H]1CN(C2CCC(C)(C#N)CC2)CC[C@H]1F	ZINC001173597677	1384984423	/nfs/dbraw/zinc/98/44/23/1384984423.db2.gz	DIXBRTYYZSUUHD-DGSCNEQVSA-N	0	3	339.455	3.396	20	30		EGEDHN
C[C@H](CNC(=O)c1ccccc1Cl)NCc1ccc(C#N)s1	ZINC001317280582	1385051095	/nfs/dbraw/zinc/05/10/95/1385051095.db2.gz	SPQOUCNFLYRGLK-LLVKDONJSA-N	0	3	333.844	3.181	20	30		EGEDHN
C=C(Br)CN[C@@H](C)CCNC(=O)c1cccc(C)c1C	ZINC001317411367	1385122437	/nfs/dbraw/zinc/12/24/37/1385122437.db2.gz	CEEYOUCTUDELTN-ZDUSSCGKSA-N	0	3	339.277	3.310	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)Cc1ccc2c(c1)CCCC2	ZINC001317413764	1385124232	/nfs/dbraw/zinc/12/42/32/1385124232.db2.gz	DXSQTVQQOYZPPE-HNNXBMFYSA-N	0	3	334.891	3.345	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H](C)CCCCNCc2ocnc2C)cc1	ZINC001174644014	1385129326	/nfs/dbraw/zinc/12/93/26/1385129326.db2.gz	YKHACMCTCFRQRV-HNNXBMFYSA-N	0	3	339.439	3.043	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H](C)CCCCNCc1ccn(CC)n1	ZINC001174673225	1385132467	/nfs/dbraw/zinc/13/24/67/1385132467.db2.gz	VREBUTKMSYGAPW-MRXNPFEDSA-N	0	3	334.508	3.270	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H](C)CCCCNCc1cc2n(n1)CCC2	ZINC001174849726	1385159892	/nfs/dbraw/zinc/15/98/92/1385159892.db2.gz	PNDKAKKQWXNWJN-IRXDYDNUSA-N	0	3	346.519	3.196	20	30		EGEDHN
CCN(CCNC(=O)[C@H]1CCCC(F)(F)C1)Cc1cccc(C#N)c1	ZINC001317487455	1385186079	/nfs/dbraw/zinc/18/60/79/1385186079.db2.gz	LRLXBQNWQKXNGY-KRWDZBQOSA-N	0	3	349.425	3.322	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@H](C)CCCCNCc1nnc(C(C)C)[nH]1	ZINC001175082497	1385191891	/nfs/dbraw/zinc/19/18/91/1385191891.db2.gz	ORFOJBPEPDJKBA-DNVCBOLYSA-N	0	3	349.523	3.295	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1c(C)cc(C)cc1C	ZINC001175440103	1385289437	/nfs/dbraw/zinc/28/94/37/1385289437.db2.gz	UMHPMNSHAOEMPQ-UHFFFAOYSA-N	0	3	339.277	3.230	20	30		EGEDHN
CC(C)(C)CC(=O)NCC[C@@H]1CCN(Cc2ccc(F)c(C#N)c2)C1	ZINC001317773392	1385465276	/nfs/dbraw/zinc/46/52/76/1385465276.db2.gz	BKFUGTFBPBROBX-OAHLLOKOSA-N	0	3	345.462	3.462	20	30		EGEDHN
C=C[C@H](CC(=O)NCCCNCc1oc(C)nc1C)c1ccccc1	ZINC001176762577	1385687664	/nfs/dbraw/zinc/68/76/64/1385687664.db2.gz	GTFFYGJTPZQRII-QGZVFWFLSA-N	0	3	341.455	3.247	20	30		EGEDHN
C=C[C@@H](C(=O)NCCCNCc1cnc(Cl)s1)c1ccccc1	ZINC001176779332	1385693163	/nfs/dbraw/zinc/69/31/63/1385693163.db2.gz	ZXBMZAJBQHZNBB-OAHLLOKOSA-N	0	3	349.887	3.362	20	30		EGEDHN
CC[C@@H](CNC(=O)C1(C)CCCC1)NCc1cc(C#N)ccc1OC	ZINC001318559347	1385756002	/nfs/dbraw/zinc/75/60/02/1385756002.db2.gz	VKCBMAGTGCUJGY-KRWDZBQOSA-N	0	3	343.471	3.132	20	30		EGEDHN
N#Cc1ccc(F)c(CNCC2(NC(=O)CC3CC3)CCCC2)c1	ZINC001318615371	1385797439	/nfs/dbraw/zinc/79/74/39/1385797439.db2.gz	ZHLBALBDRVMRTM-UHFFFAOYSA-N	0	3	329.419	3.016	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)c1cccn1C	ZINC001177218224	1385870094	/nfs/dbraw/zinc/87/00/94/1385870094.db2.gz	MVJIBJBZLFYHPT-UHFFFAOYSA-N	0	3	337.895	3.390	20	30		EGEDHN
C=CCCOCC(=O)NCCCNCc1ccc(Cl)cc1Cl	ZINC001177260892	1385888242	/nfs/dbraw/zinc/88/82/42/1385888242.db2.gz	ZFRQGPIVZGGMPA-UHFFFAOYSA-N	0	3	345.270	3.182	20	30		EGEDHN
C#CCCCC(=O)N(CCCNCc1cnoc1C)CC1CCCC1	ZINC001177304935	1385905343	/nfs/dbraw/zinc/90/53/43/1385905343.db2.gz	PGELWXFPDQLFGD-UHFFFAOYSA-N	0	3	345.487	3.285	20	30		EGEDHN
CC1(C)C(C)(C)C1(C)C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001177539912	1385989687	/nfs/dbraw/zinc/98/96/87/1385989687.db2.gz	FZYTTZPXHQIHON-UHFFFAOYSA-N	0	3	345.462	3.366	20	30		EGEDHN
C=CCC1(C(=O)NCCCNCc2nc(C)c(C)s2)CCCC1	ZINC001177548104	1385993260	/nfs/dbraw/zinc/99/32/60/1385993260.db2.gz	PRJNQGMIHWEHNJ-UHFFFAOYSA-N	0	3	335.517	3.492	20	30		EGEDHN
C=CCC[C@@H](C(=O)NCCCNCc1ocnc1C)c1ccccc1	ZINC001177552490	1385994931	/nfs/dbraw/zinc/99/49/31/1385994931.db2.gz	IDASUIQYNXFCFX-GOSISDBHSA-N	0	3	341.455	3.329	20	30		EGEDHN
CCc1ccsc1C(=O)NC[C@H](C)CNCc1ccccc1C#N	ZINC001319284183	1386042036	/nfs/dbraw/zinc/04/20/36/1386042036.db2.gz	FMNSNNQPJVZARB-CQSZACIVSA-N	0	3	341.480	3.338	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)NCCCCCCNCc1cc(F)ccc1C#N	ZINC001177819801	1386056384	/nfs/dbraw/zinc/05/63/84/1386056384.db2.gz	QYBYSZKJFMCZAH-RDTXWAMCSA-N	0	3	331.435	3.120	20	30		EGEDHN
CC(C)(C)n1cc(C#N)cc1NC(=O)C(C#N)Cc1cccs1	ZINC001177903111	1386078638	/nfs/dbraw/zinc/07/86/38/1386078638.db2.gz	FBUHKHIGHOSXIR-ZDUSSCGKSA-N	0	3	326.425	3.497	20	30		EGEDHN
N#CC(Cc1cccs1)C(=O)Nc1c(Cl)cnnc1Cl	ZINC001177903922	1386079583	/nfs/dbraw/zinc/07/95/83/1386079583.db2.gz	LOEHAPIWJSOCJI-SSDOTTSWSA-N	0	3	327.196	3.166	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCCCCCN[C@@H](C)c1nc2ccccc2o1	ZINC001178053486	1386118071	/nfs/dbraw/zinc/11/80/71/1386118071.db2.gz	SRCJCAPEHSTUPE-GJZGRUSLSA-N	0	3	342.443	3.315	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccc(F)cc2)CCN1C(=O)[C@@H]1CC=CCC1	ZINC001178099235	1386127781	/nfs/dbraw/zinc/12/77/81/1386127781.db2.gz	KFEPEKZDGNSBMS-HQRMLTQVSA-N	0	3	340.442	3.113	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](NCC#Cc2cccc(Cl)c2)[C@@H]1C	ZINC001178324774	1386189130	/nfs/dbraw/zinc/18/91/30/1386189130.db2.gz	ZOILQGCTSUMYRB-YJBOKZPZSA-N	0	3	330.859	3.237	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@H](NCC#Cc2ccc(Cl)cc2)[C@@H]1C)C1CC1	ZINC001178437396	1386217609	/nfs/dbraw/zinc/21/76/09/1386217609.db2.gz	FGBBHUVISHPIBX-DOXZYTNZSA-N	0	3	344.886	3.317	20	30		EGEDHN
CC1CC(C(=O)N2CC[C@H](NCC#Cc3ccc(Cl)cc3)[C@@H]2C)C1	ZINC001178456071	1386223652	/nfs/dbraw/zinc/22/36/52/1386223652.db2.gz	QWKXOTVIAGANII-ULGDZEHDSA-N	0	3	344.886	3.317	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](NCc2c(C)nsc2C)[C@@H]1C	ZINC001178503760	1386238069	/nfs/dbraw/zinc/23/80/69/1386238069.db2.gz	OZFIYVIHWVYGBY-YOEHRIQHSA-N	0	3	333.501	3.033	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)c1sccc1F	ZINC001178632386	1386265172	/nfs/dbraw/zinc/26/51/72/1386265172.db2.gz	QAMICSKSBYUVKO-YOEHRIQHSA-N	0	3	342.439	3.132	20	30		EGEDHN
C#CCCCCCC(=O)NCCCCCCNCc1nccs1	ZINC001179235670	1386429163	/nfs/dbraw/zinc/42/91/63/1386429163.db2.gz	ZKKRQKJCHASRGB-UHFFFAOYSA-N	0	3	335.517	3.493	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCCCCCNCc1nnc(C(C)C)[nH]1	ZINC001179306621	1386445135	/nfs/dbraw/zinc/44/51/35/1386445135.db2.gz	JKIAOBBYXUNXCQ-HZPDHXFCSA-N	0	3	349.523	3.153	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccc(Cl)cc2)CCN1C(=O)CCCF	ZINC001179332122	1386452859	/nfs/dbraw/zinc/45/28/59/1386452859.db2.gz	DNXPWYNGEBRMIH-YOEHRIQHSA-N	0	3	336.838	3.020	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1cc2ccccn2c1)C1CC1	ZINC001698649557	1406298706	/nfs/dbraw/zinc/29/87/06/1406298706.db2.gz	RNCFHXSJBPSDSZ-GOSISDBHSA-N	0	3	331.847	3.180	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCCCCCNCc1cc(C)n(C)n1	ZINC001179481778	1386494396	/nfs/dbraw/zinc/49/43/96/1386494396.db2.gz	LGTKBMKLAZUFDD-IBGZPJMESA-N	0	3	334.508	3.097	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCCCCCNCc1ccn(CC)n1	ZINC001179692158	1386555130	/nfs/dbraw/zinc/55/51/30/1386555130.db2.gz	FHWNBUUJHRWSBX-UHFFFAOYSA-N	0	3	334.508	3.272	20	30		EGEDHN
CC(C)C[C@@H](C)C(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C	ZINC001179794950	1386589485	/nfs/dbraw/zinc/58/94/85/1386589485.db2.gz	XGPIDCCZPVYCAA-HBFSDRIKSA-N	0	3	326.484	3.299	20	30		EGEDHN
COc1ccc2c(c1)[C@H](N[C@H](C)CC1(C#N)CCOCC1)CCO2	ZINC001180586773	1386842540	/nfs/dbraw/zinc/84/25/40/1386842540.db2.gz	YDLBXQZPZQGKCG-RHSMWYFYSA-N	0	3	330.428	3.207	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2ccn(C(C)C)n2)C1	ZINC001180852997	1386884179	/nfs/dbraw/zinc/88/41/79/1386884179.db2.gz	QDULHBQQVWPRSV-VQIMIIECSA-N	0	3	332.492	3.004	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](N[C@H](C)c2ccc(F)c(F)c2)C1	ZINC001182112841	1387107009	/nfs/dbraw/zinc/10/70/09/1387107009.db2.gz	HHSRNSBWNYFLMR-GDBMZVCRSA-N	0	3	334.410	3.410	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2ccn(C(C)C)n2)C1	ZINC001182465342	1387171124	/nfs/dbraw/zinc/17/11/24/1387171124.db2.gz	VRZMISSMZFNQAG-YLJYHZDGSA-N	0	3	346.519	3.395	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(CCc2ccccc2)C(C)C)CC1	ZINC001322552297	1387204978	/nfs/dbraw/zinc/20/49/78/1387204978.db2.gz	BRNISEJLLPIZGY-UHFFFAOYSA-N	0	3	329.488	3.300	20	30		EGEDHN
CC#CCCCCCCCC(=O)N(CCOC)C1CCN(C)CC1	ZINC001182769055	1387221294	/nfs/dbraw/zinc/22/12/94/1387221294.db2.gz	QUAITTDGFHLXBJ-UHFFFAOYSA-N	0	3	336.520	3.310	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001182841043	1387233190	/nfs/dbraw/zinc/23/31/90/1387233190.db2.gz	FJVCKXRCTBAKNP-GOSISDBHSA-N	0	3	341.430	3.156	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1c(C)noc1C1CC1	ZINC001329317445	1389060216	/nfs/dbraw/zinc/06/02/16/1389060216.db2.gz	SQLVIGWFHIAQOI-UHFFFAOYSA-N	0	3	339.867	3.301	20	30		EGEDHN
CC(C)CN1CCC[C@H]1C(=O)Nc1cccc(OCCCC#N)c1	ZINC001337026280	1389239754	/nfs/dbraw/zinc/23/97/54/1389239754.db2.gz	WBNQJNMWQMNOSV-SFHVURJKSA-N	0	3	329.444	3.428	20	30		EGEDHN
CC(C)CCC(=O)N(C)[C@@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001331253050	1389668485	/nfs/dbraw/zinc/66/84/85/1389668485.db2.gz	FHUNBEYAQPUCMS-IBGZPJMESA-N	0	3	345.462	3.460	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@H](CC(F)F)CN1CCC(CC#N)CC1	ZINC001331995673	1389939819	/nfs/dbraw/zinc/93/98/19/1389939819.db2.gz	SBVBTYYIARSKJO-ZDUSSCGKSA-N	0	3	331.407	3.161	20	30		EGEDHN
CN(C)C[C@H]1CCc2ccccc2N1C(=O)c1csc(C#N)c1	ZINC001332012949	1389945850	/nfs/dbraw/zinc/94/58/50/1389945850.db2.gz	VJHDKDUWDHSDGO-OAHLLOKOSA-N	0	3	325.437	3.143	20	30		EGEDHN
CN(C(=O)CC(C)(C)C)C1CC(NCc2cc(C#N)ccc2F)C1	ZINC001333035755	1390240490	/nfs/dbraw/zinc/24/04/90/1390240490.db2.gz	MSBODJDZGUDABS-UHFFFAOYSA-N	0	3	331.435	3.213	20	30		EGEDHN
C=CCC[C@@H]1CCCN1c1nnc([C@H]2CCCN(C)C2)n1CC=C	ZINC001340207080	1390250436	/nfs/dbraw/zinc/25/04/36/1390250436.db2.gz	JMOGEIJHJMGYAO-DLBZAZTESA-N	0	3	329.492	3.208	20	30		EGEDHN
C[C@@]1(Cc2ccc(F)cc2)CCCN1C(=O)[C@@H](N)CCCCC#N	ZINC001333276611	1390275111	/nfs/dbraw/zinc/27/51/11/1390275111.db2.gz	KZXIDMYIEQGECY-HKUYNNGSSA-N	0	3	331.435	3.161	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1cc(Cl)ccc1O[C@@H](C)COC	ZINC001340383187	1390280304	/nfs/dbraw/zinc/28/03/04/1390280304.db2.gz	OBYDOTPLEOGFPR-JSGCOSHPSA-N	0	3	340.851	3.376	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)N1CCc2nc(C3CC3)ncc2C1	ZINC001340707779	1390350603	/nfs/dbraw/zinc/35/06/03/1390350603.db2.gz	FKCCWRPADOZINA-KRWDZBQOSA-N	0	3	344.503	3.317	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N[C@H](C)c1nc(-c2ccc(CC)cc2)no1	ZINC001341513747	1390496571	/nfs/dbraw/zinc/49/65/71/1390496571.db2.gz	CZJOVQFDIRFIIC-CJNGLKHVSA-N	0	3	342.443	3.160	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N(CCc1ccccc1)Cc1cccnc1	ZINC001341805035	1390531274	/nfs/dbraw/zinc/53/12/74/1390531274.db2.gz	HMDIQVPKMYVOTI-FQEVSTJZSA-N	0	3	337.467	3.337	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)N1CCn2nc(C3CC3)cc2C1	ZINC001341839850	1390535624	/nfs/dbraw/zinc/53/56/24/1390535624.db2.gz	UEDDQCANLMNKAN-QGZVFWFLSA-N	0	3	332.492	3.181	20	30		EGEDHN
N#CC(C(=O)c1ccsc1C(F)F)c1nnc2n1CCCCC2	ZINC001342157810	1390579530	/nfs/dbraw/zinc/57/95/30/1390579530.db2.gz	SLXQMASDQVVGQD-JTQLQIEISA-N	0	3	336.367	3.494	20	30		EGEDHN
CCOCOc1ccc(CNCc2cccc(OCC#N)c2)cc1	ZINC001342159758	1390580082	/nfs/dbraw/zinc/58/00/82/1390580082.db2.gz	DCIPNHVASMJHPJ-UHFFFAOYSA-N	0	3	326.396	3.252	20	30		EGEDHN
COC(=O)C[C@](C)(NCCCCC1(C#N)CCC1)c1ccccn1	ZINC001334798822	1390591533	/nfs/dbraw/zinc/59/15/33/1390591533.db2.gz	NTVNIMMNIFWTAD-SFHVURJKSA-N	0	3	329.444	3.314	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCCOc1ccc(F)cc1F	ZINC001344875163	1390821190	/nfs/dbraw/zinc/82/11/90/1390821190.db2.gz	NCSRKQDARGZYFC-CYBMUJFWSA-N	0	3	333.338	3.217	20	30		EGEDHN
CC(C)Oc1ccccc1CNCCC(=O)Nc1cccc(C#N)c1	ZINC001345604503	1390868368	/nfs/dbraw/zinc/86/83/68/1390868368.db2.gz	AUMYEXOOEUQZQH-UHFFFAOYSA-N	0	3	337.423	3.464	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CNCc1cc(Cl)ccc1Br	ZINC001346289082	1390919982	/nfs/dbraw/zinc/91/99/82/1390919982.db2.gz	SAZJJYVHNIUJJF-GFCCVEGCSA-N	0	3	345.668	3.493	20	30		EGEDHN
CCn1nc(C)c(C(=O)C(C#N)c2nccn2Cc2ccccc2)c1C	ZINC001346537133	1390950705	/nfs/dbraw/zinc/95/07/05/1390950705.db2.gz	GLZGLDNWIBUQEJ-QGZVFWFLSA-N	0	3	347.422	3.255	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N1CC[C@H]2CCCC[C@@H]2C1	ZINC001351542929	1391650351	/nfs/dbraw/zinc/65/03/51/1391650351.db2.gz	ABGFQWQBQJOVDK-KURKYZTESA-N	0	3	343.519	3.290	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)CCOc2cccc(C)c2C)C1	ZINC001480140644	1392599355	/nfs/dbraw/zinc/59/93/55/1392599355.db2.gz	BJHQABHJRGFYSB-WKILWMFISA-N	0	3	336.863	3.062	20	30		EGEDHN
CC(C)C[C@@H](CNCc1ccc(F)c(C#N)c1)NC(=O)CC1CC1	ZINC001698867744	1406584354	/nfs/dbraw/zinc/58/43/54/1406584354.db2.gz	ZKHHVBYLFQPJBL-KRWDZBQOSA-N	0	3	331.435	3.118	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@@H](C)NCc2ccc(F)c(C#N)c2)cc1F	ZINC001480499045	1392770272	/nfs/dbraw/zinc/77/02/72/1392770272.db2.gz	KHMUWNSSXCHGBR-CYBMUJFWSA-N	0	3	343.377	3.053	20	30		EGEDHN
C=C(Br)CN[C@@H](C)CCNC(=O)C1(C)CCCCC1	ZINC001480789110	1392933802	/nfs/dbraw/zinc/93/38/02/1392933802.db2.gz	AKOFVFWGAIWWFM-ZDUSSCGKSA-N	0	3	331.298	3.350	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)C1(C)CCCCC1	ZINC001480789108	1392933708	/nfs/dbraw/zinc/93/37/08/1392933708.db2.gz	AKOFVFWGAIWWFM-CYBMUJFWSA-N	0	3	331.298	3.350	20	30		EGEDHN
CC[C@@H](C)C(=O)NC1(CNCc2ccc(C#N)cc2F)CCCC1	ZINC001481889274	1394580462	/nfs/dbraw/zinc/58/04/62/1394580462.db2.gz	HHYWCKXEGFOXDH-CQSZACIVSA-N	0	3	331.435	3.262	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)NC1(CNCc2cc(C#N)ccc2F)CCCC1	ZINC001481893897	1394582831	/nfs/dbraw/zinc/58/28/31/1394582831.db2.gz	BFYJWACHEIBAFL-MRXNPFEDSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2oncc2C)CCCC[C@H]1C	ZINC001481959850	1394621066	/nfs/dbraw/zinc/62/10/66/1394621066.db2.gz	CTNZZUNBNUUVOE-MLGOLLRUSA-N	0	3	325.840	3.004	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)C2(CC)CCC2)CCCC1	ZINC001482227014	1394820803	/nfs/dbraw/zinc/82/08/03/1394820803.db2.gz	DDHHIICARSMGMS-UHFFFAOYSA-N	0	3	343.309	3.494	20	30		EGEDHN
COc1ccc(C#N)cc1CNC[C@H](C)N(C)C(=O)CCC1CCC1	ZINC001482270385	1394858324	/nfs/dbraw/zinc/85/83/24/1394858324.db2.gz	YWXUROIINJPRSY-HNNXBMFYSA-N	0	3	343.471	3.084	20	30		EGEDHN
CC(C)C[C@@H](CNCc1ccc(C#N)s1)NC(=O)c1ccsn1	ZINC001482388053	1394949268	/nfs/dbraw/zinc/94/92/68/1394949268.db2.gz	RSKGHPSXXWAGGZ-LBPRGKRZSA-N	0	3	348.497	3.011	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)Cc1cc(C)ccc1F)C(C)C	ZINC001698979724	1406754325	/nfs/dbraw/zinc/75/43/25/1406754325.db2.gz	UYSNFRNFDBQSDP-MRXNPFEDSA-N	0	3	326.843	3.160	20	30		EGEDHN
C[C@H](C(=O)N(C)CCN(C)Cc1ccc(OCC#N)cc1)C(C)(C)C	ZINC001698991425	1406781888	/nfs/dbraw/zinc/78/18/88/1406781888.db2.gz	WFROWUVPARNFCL-MRXNPFEDSA-N	0	3	345.487	3.161	20	30		EGEDHN
Cc1ccc(F)c(C(=O)N(C)C[C@H](C)NCc2ccc(C#N)s2)c1	ZINC001485928802	1396170010	/nfs/dbraw/zinc/17/00/10/1396170010.db2.gz	ZMGSJRBTEPQVCJ-ZDUSSCGKSA-N	0	3	345.443	3.318	20	30		EGEDHN
C[C@@H](CCNC(=O)[C@@H]1CC[C@@H](C)CC1)NCc1ccccc1C#N	ZINC001492114475	1396305372	/nfs/dbraw/zinc/30/53/72/1396305372.db2.gz	BOSOONCNPIXYOH-ULQDDVLXSA-N	0	3	327.472	3.369	20	30		EGEDHN
CCc1ccc(C(=O)N[C@@H](C)CN(C)Cc2ccc(C#N)cc2)cc1	ZINC001498443450	1396996642	/nfs/dbraw/zinc/99/66/42/1396996642.db2.gz	IGEHOLFFRSZPKH-INIZCTEOSA-N	0	3	335.451	3.371	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1csnc1C	ZINC001689899867	1404194588	/nfs/dbraw/zinc/19/45/88/1404194588.db2.gz	VIFRJFDOAXPMLQ-OCCSQVGLSA-N	0	3	327.881	3.177	20	30		EGEDHN
CCCC1(C(=O)N2CC[C@H](CNCc3ccccc3C#N)C2)CCC1	ZINC001690730004	1404699839	/nfs/dbraw/zinc/69/98/39/1404699839.db2.gz	HWKFADORPORKGC-QGZVFWFLSA-N	0	3	339.483	3.467	20	30		EGEDHN
Cc1cscc1C(=O)NCC[C@@H](C)NCc1ccccc1C#N	ZINC001690837725	1404769904	/nfs/dbraw/zinc/76/99/04/1404769904.db2.gz	QBJFOOZAPUAWAZ-CQSZACIVSA-N	0	3	327.453	3.226	20	30		EGEDHN
CCc1ccccc1C(=O)NCC[C@@H](C)NCc1ccccc1C#N	ZINC001690859526	1404780608	/nfs/dbraw/zinc/78/06/08/1404780608.db2.gz	GQTGSLVGRFLOOA-MRXNPFEDSA-N	0	3	335.451	3.419	20	30		EGEDHN
CCN(CCNC(=O)Cc1ccc(C)cc1)Cc1cccc(C#N)c1	ZINC001691031353	1404939977	/nfs/dbraw/zinc/93/99/77/1404939977.db2.gz	ATNRDGOJNPUWFP-UHFFFAOYSA-N	0	3	335.451	3.048	20	30		EGEDHN
CCCN(CCNC(=O)c1ccc(F)cc1)Cc1ccc(C#N)cc1	ZINC001691174580	1405110369	/nfs/dbraw/zinc/11/03/69/1405110369.db2.gz	ZIZBQIGIAPNPKT-UHFFFAOYSA-N	0	3	339.414	3.339	20	30		EGEDHN
C[C@H](C(=O)NC[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1)C(C)(C)C	ZINC001691506296	1405309526	/nfs/dbraw/zinc/30/95/26/1405309526.db2.gz	MFGFNIPDNBUGBN-FRFSOERESA-N	0	3	345.462	3.364	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1F)CC1CCN(C(=O)CCCF)CC1	ZINC001732087914	1428349706	/nfs/dbraw/zinc/34/97/06/1428349706.db2.gz	XAJZEDLMLYCTAU-UHFFFAOYSA-N	0	3	349.425	3.117	20	30		EGEDHN
C=C(Br)CNCC1(NC(=O)[C@H](C)C2CCC2)CCCC1	ZINC001732231983	1428478570	/nfs/dbraw/zinc/47/85/70/1428478570.db2.gz	XDGPHOZXNUOFDR-CYBMUJFWSA-N	0	3	343.309	3.350	20	30		EGEDHN
O=C(c1cc2occc2[nH]1)N1CCC[C@@H]1CNCC#Cc1ccccc1	ZINC001732327074	1428535331	/nfs/dbraw/zinc/53/53/31/1428535331.db2.gz	PZUWSIGPYOFOKC-QGZVFWFLSA-N	0	3	347.418	3.007	20	30		EGEDHN
C[C@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)CC(C)(C)C1CC1	ZINC001732414992	1428572105	/nfs/dbraw/zinc/57/21/05/1428572105.db2.gz	CHLAUCVGDLHJKX-CQSZACIVSA-N	0	3	345.462	3.460	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)c3cccc(C4CC4)c3)CC2)cc1	ZINC001699675235	1413068599	/nfs/dbraw/zinc/06/85/99/1413068599.db2.gz	DPBOVJDIDKZRPJ-UHFFFAOYSA-N	0	3	345.446	3.488	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1ccn(C(C)C)c1C)C(C)C	ZINC001732564251	1428754827	/nfs/dbraw/zinc/75/48/27/1428754827.db2.gz	FBUYYYFBZZQBGH-INIZCTEOSA-N	0	3	325.884	3.474	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1c(F)cc(OC)cc1F)C(C)C	ZINC001732569773	1428764310	/nfs/dbraw/zinc/76/43/10/1428764310.db2.gz	OUKSQAARFJDNGI-AWEZNQCLSA-N	0	3	346.805	3.070	20	30		EGEDHN
CN(CC(C)(C)CNCc1ccccc1C#N)C(=O)C1(F)CCCC1	ZINC001700442583	1414015276	/nfs/dbraw/zinc/01/52/76/1414015276.db2.gz	GWPKZXYGXFOCGW-UHFFFAOYSA-N	0	3	345.462	3.415	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)cc1F)[C@H]1CCCCN1C(=O)CCCF	ZINC001707433734	1417338121	/nfs/dbraw/zinc/33/81/21/1417338121.db2.gz	CNMKTSXBRCMNEY-RDTXWAMCSA-N	0	3	349.425	3.306	20	30		EGEDHN
N#Cc1ccc(CN[C@@H](CNC(=O)C2(F)CCCCC2)C2CC2)s1	ZINC001713122927	1417689793	/nfs/dbraw/zinc/68/97/93/1417689793.db2.gz	JTLJSIABYBJSHM-INIZCTEOSA-N	0	3	349.475	3.277	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)COc2cccc(C(C)C)c2)C1	ZINC001713161166	1417736757	/nfs/dbraw/zinc/73/67/57/1417736757.db2.gz	LDQWDBWXGXZSDV-WKILWMFISA-N	0	3	336.863	3.178	20	30		EGEDHN
CCCN(CCNC(=O)C1CC2(CC2)C1)Cc1ccc(F)c(C#N)c1	ZINC001713550875	1418331302	/nfs/dbraw/zinc/33/13/02/1418331302.db2.gz	QQFRILKQQPRLLE-UHFFFAOYSA-N	0	3	343.446	3.216	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](NC(=O)C2CCCCC2)C2CC2)c(F)c1	ZINC001733162616	1429265084	/nfs/dbraw/zinc/26/50/84/1429265084.db2.gz	IQBVOWRLMDYAKQ-LJQANCHMSA-N	0	3	343.446	3.262	20	30		EGEDHN
CCC[C@@H](C)CC(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001713943496	1418731946	/nfs/dbraw/zinc/73/19/46/1418731946.db2.gz	CQRILYUMSMWIKI-KBRIMQKVSA-N	0	3	331.435	3.260	20	30		EGEDHN
CC(C)SCC(=O)NC[C@@H]1CCCN(Cc2ccc(C#N)cc2)C1	ZINC001714026356	1418811433	/nfs/dbraw/zinc/81/14/33/1418811433.db2.gz	RMYXYWRWSRFZDE-SFHVURJKSA-N	0	3	345.512	3.028	20	30		EGEDHN
Cc1ccc(F)c(C(=O)NC[C@@H](C)CNCc2ccccc2C#N)c1	ZINC001714434535	1419167449	/nfs/dbraw/zinc/16/74/49/1419167449.db2.gz	RQBHXBNBJHUPGU-HNNXBMFYSA-N	0	3	339.414	3.162	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)Cc2ccc3c(c2)COC3)CCCC1	ZINC001714510338	1419238054	/nfs/dbraw/zinc/23/80/54/1419238054.db2.gz	JIVIITSKERQINR-UHFFFAOYSA-N	0	3	348.874	3.030	20	30		EGEDHN
CC[C@H](CNC(=O)C1(CC)CCC1)NCc1cc(C#N)ccc1OC	ZINC001715067931	1419803929	/nfs/dbraw/zinc/80/39/29/1419803929.db2.gz	HWPBHXOBPBIIBG-QGZVFWFLSA-N	0	3	343.471	3.132	20	30		EGEDHN
Cc1cc(CNCc2ccc(CNC(=O)[C@@H](C)C#N)cc2)c(C)s1	ZINC001715196526	1419928210	/nfs/dbraw/zinc/92/82/10/1419928210.db2.gz	ZSPOKDFUKXRNML-ZDUSSCGKSA-N	0	3	341.480	3.431	20	30		EGEDHN
CC(C)C[C@@H](CNCc1ccc(F)c(C#N)c1)NC(=O)C(C)(C)C	ZINC001715393672	1420090850	/nfs/dbraw/zinc/09/08/50/1420090850.db2.gz	PQCORBUZUOPAFE-INIZCTEOSA-N	0	3	333.451	3.364	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cc(C(C)C)nn1CC)C(C)C	ZINC001715495236	1420176721	/nfs/dbraw/zinc/17/67/21/1420176721.db2.gz	ITXACRINSOFMBB-OAHLLOKOSA-N	0	3	340.899	3.123	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cccc(C(F)(F)F)n1)C(C)C	ZINC001715510091	1420193944	/nfs/dbraw/zinc/19/39/44/1420193944.db2.gz	WVEITFAPFPWASA-LBPRGKRZSA-N	0	3	349.784	3.197	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1c[nH]c2ccc(F)cc12)C(C)C	ZINC001715511469	1420195965	/nfs/dbraw/zinc/19/59/65/1420195965.db2.gz	LFGJFXNMXQEJAZ-MRXNPFEDSA-N	0	3	337.826	3.404	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1coc(-c2ccccc2)n1)C(C)C	ZINC001715688677	1420294984	/nfs/dbraw/zinc/29/49/84/1420294984.db2.gz	BEMGVPAQKFVNAQ-HNNXBMFYSA-N	0	3	347.846	3.438	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)NC(=O)c1ccc(Cl)s1	ZINC001715959673	1420426142	/nfs/dbraw/zinc/42/61/42/1420426142.db2.gz	CUTZPOZEPXVQMC-SECBINFHSA-N	0	3	339.873	3.243	20	30		EGEDHN
N#Cc1cc(CNC2(CNC(=O)[C@@H]3CC34CCCC4)CC2)ccc1F	ZINC001733261210	1429414925	/nfs/dbraw/zinc/41/49/25/1429414925.db2.gz	UHOCBKXMHPNAIE-INIZCTEOSA-N	0	3	341.430	3.016	20	30		EGEDHN
C[C@@H](CN(C)Cc1cccc(C#N)c1)NC(=O)C1(C)CCCCC1	ZINC001716037042	1420497267	/nfs/dbraw/zinc/49/72/67/1420497267.db2.gz	ASIAPNZOWYOKGY-INIZCTEOSA-N	0	3	327.472	3.465	20	30		EGEDHN
CCOc1ccccc1C(=O)NCC1(NCc2cccc(C#N)c2)CC1	ZINC001733262648	1429418229	/nfs/dbraw/zinc/41/82/29/1429418229.db2.gz	XNGPFIZLIUWQHJ-UHFFFAOYSA-N	0	3	349.434	3.009	20	30		EGEDHN
Cc1cccc(C)c1C(=O)N[C@H](C)CN(C)Cc1ccc(C#N)cc1	ZINC001716494880	1420718306	/nfs/dbraw/zinc/71/83/06/1420718306.db2.gz	LNQRJPHZGYUKBJ-QGZVFWFLSA-N	0	3	335.451	3.425	20	30		EGEDHN
C=C(Cl)CN(CC1CC1)C1CCN(C(=O)C[C@H]2CCCO2)CC1	ZINC001716714408	1420869032	/nfs/dbraw/zinc/86/90/32/1420869032.db2.gz	JISZNXJYXHFAIP-QGZVFWFLSA-N	0	3	340.895	3.011	20	30		EGEDHN
C[C@]1(CNCc2ccccc2C#N)CCN(C(=O)c2ccccc2)C1	ZINC001716854976	1420986972	/nfs/dbraw/zinc/98/69/72/1420986972.db2.gz	GFRANGOUTODUFM-OAQYLSRUSA-N	0	3	333.435	3.200	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)CCOC(C)C)CC1	ZINC001717355024	1421289287	/nfs/dbraw/zinc/28/92/87/1421289287.db2.gz	VMJNUAQTEPZJAV-UHFFFAOYSA-N	0	3	330.900	3.115	20	30		EGEDHN
Cc1cccc(CNCc2ccc(CNC(=O)[C@H](C)C#N)c(F)c2)c1	ZINC001718034871	1421786660	/nfs/dbraw/zinc/78/66/60/1421786660.db2.gz	QAIGPICHLWZOAX-OAHLLOKOSA-N	0	3	339.414	3.200	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](NC(=O)c2ccsc2)C2CC2)c(F)c1	ZINC001723274856	1424328012	/nfs/dbraw/zinc/32/80/12/1424328012.db2.gz	XKRHHGPSLDQRSU-KRWDZBQOSA-N	0	3	343.427	3.057	20	30		EGEDHN
C[C@@H](C(=O)NCC1(NCc2ccc(C#N)cc2)CC1)c1ccccc1	ZINC001723580348	1424473735	/nfs/dbraw/zinc/47/37/35/1424473735.db2.gz	BIOYZDHFZFKPGS-MRXNPFEDSA-N	0	3	333.435	3.100	20	30		EGEDHN
C[C@H](C#N)C(=O)NC1(C)CCN([C@H]2CCc3c2cccc3Cl)CC1	ZINC001723999065	1424622054	/nfs/dbraw/zinc/62/20/54/1424622054.db2.gz	XJTLYVOXCVSBGV-DYVFJYSZSA-N	0	3	345.874	3.458	20	30		EGEDHN
CCC1(C(=O)N[C@@H]2CCCN(Cc3ccc(C#N)cc3)CC2)CC1	ZINC001724845324	1425196600	/nfs/dbraw/zinc/19/66/00/1425196600.db2.gz	SUKDNIBAJVROBO-GOSISDBHSA-N	0	3	325.456	3.219	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)CCC2CC2)CCN1Cc1cccc(C#N)c1	ZINC001724988168	1425387895	/nfs/dbraw/zinc/38/78/95/1425387895.db2.gz	FNKNLCKQPAMWAK-HNAYVOBHSA-N	0	3	325.456	3.218	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1cc(OC)cs1	ZINC001725150291	1425634951	/nfs/dbraw/zinc/63/49/51/1425634951.db2.gz	XXLTYSKGEQXFQP-UHFFFAOYSA-N	0	3	330.881	3.197	20	30		EGEDHN
Cc1cc(F)ccc1C(=O)NC[C@@H](C)N(C)Cc1cccc(C#N)c1	ZINC001725188942	1425728165	/nfs/dbraw/zinc/72/81/65/1425728165.db2.gz	KYMWQKOMYDGASA-OAHLLOKOSA-N	0	3	339.414	3.256	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1csc(-c2ccoc2)n1	ZINC001731736392	1427817864	/nfs/dbraw/zinc/81/78/64/1427817864.db2.gz	GGBHXJAONGKVSW-LLVKDONJSA-N	0	3	339.848	3.254	20	30		EGEDHN
CCN(CCNC(=O)Cc1ccc(C)c(C)c1)Cc1cccc(C#N)c1	ZINC001731816392	1428012287	/nfs/dbraw/zinc/01/22/87/1428012287.db2.gz	YDKDJLGZKLNDEF-UHFFFAOYSA-N	0	3	349.478	3.356	20	30		EGEDHN
CC(C)(C)CC(=O)NC[C@H]1CCCN1Cc1ccc(OCC#N)cc1	ZINC001731822768	1428026148	/nfs/dbraw/zinc/02/61/48/1428026148.db2.gz	MKSKMUBCOPFEKN-QGZVFWFLSA-N	0	3	343.471	3.106	20	30		EGEDHN
CCCCC(=O)N[C@H]1CCN(Cc2ccc(OCC#N)cc2)[C@H](C)C1	ZINC001733897203	1437715109	/nfs/dbraw/zinc/71/51/09/1437715109.db2.gz	ZUQURBPRDDSWTQ-AEFFLSMTSA-N	0	3	343.471	3.248	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@@H](C)N(C)Cc2ccc(C#N)cc2)s1	ZINC001734026616	1437814227	/nfs/dbraw/zinc/81/42/27/1437814227.db2.gz	UMRGRIUJJBBKFK-CYBMUJFWSA-N	0	3	327.453	3.179	20	30		EGEDHN
Cc1cc(C(=O)NC[C@H](C)N(C)Cc2ccc(C#N)cc2)c(C)s1	ZINC001734045510	1437834378	/nfs/dbraw/zinc/83/43/78/1437834378.db2.gz	VTLWEOPCYPJWOY-ZDUSSCGKSA-N	0	3	341.480	3.487	20	30		EGEDHN
CN(CCCNC(=O)C[C@@H]1C=CCCC1)Cc1ccc(C#N)c(F)c1	ZINC001751997075	1440131701	/nfs/dbraw/zinc/13/17/01/1440131701.db2.gz	CQQUMDQMHBSMLY-MRXNPFEDSA-N	0	3	343.446	3.382	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)CCc1ccccn1	ZINC001752146250	1440145988	/nfs/dbraw/zinc/14/59/88/1440145988.db2.gz	ZFZIMGKWGZERAV-NVXWUHKLSA-N	0	3	335.879	3.126	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1cccc2nc[nH]c21	ZINC001752156524	1440147344	/nfs/dbraw/zinc/14/73/44/1440147344.db2.gz	HLECUACPRJDFHU-CZUORRHYSA-N	0	3	346.862	3.288	20	30		EGEDHN
CCCc1ccc(CN2CCC(N(C)C(=O)C#CC3CC3)CC2)cc1	ZINC001752300255	1440167599	/nfs/dbraw/zinc/16/75/99/1440167599.db2.gz	YBXLUHQYHINZSO-UHFFFAOYSA-N	0	3	338.495	3.475	20	30		EGEDHN
C=CCOCCN1CCC(N(C)C(=O)[C@]2(C)CC=C(C)CC2)CC1	ZINC001752310190	1440169677	/nfs/dbraw/zinc/16/96/77/1440169677.db2.gz	IKHRLUWEPLYSSI-HXUWFJFHSA-N	0	3	334.504	3.248	20	30		EGEDHN
C=C1CCC(C(=O)NCCCN2CCN(CC/C=C/CC)CC2)CC1	ZINC001752352383	1440171973	/nfs/dbraw/zinc/17/19/73/1440171973.db2.gz	MJRJSTGXMRTGHM-SNAWJCMRSA-N	0	3	347.547	3.213	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCN1CCN(CCCC2CCCC2)CC1	ZINC001752370116	1440172551	/nfs/dbraw/zinc/17/25/51/1440172551.db2.gz	GQGWVRINHPONJO-UHFFFAOYSA-N	0	3	349.563	3.293	20	30		EGEDHN
Cc1ccccc1CCCN1CC[C@H](NC(=O)C#CC(C)(C)C)C1	ZINC001752386867	1440173216	/nfs/dbraw/zinc/17/32/16/1440173216.db2.gz	WNTIHUYGODSIFE-IBGZPJMESA-N	0	3	326.484	3.168	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@@H]1CC12CCN(Cc1cccc(C(F)F)c1)CC2	ZINC001752424187	1440176505	/nfs/dbraw/zinc/17/65/05/1440176505.db2.gz	SSQIBNXNKWKQGX-CZUORRHYSA-N	0	3	347.409	3.255	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1CC12CCN(Cc1cncc(C)c1)CC2	ZINC001752426257	1440177325	/nfs/dbraw/zinc/17/73/25/1440177325.db2.gz	IIGCZTXYUKUIIO-SFHVURJKSA-N	0	3	327.472	3.217	20	30		EGEDHN
CCC[C@H](C)C(=O)NC[C@@H](NCc1ccc(C#N)cc1F)C1CC1	ZINC001752452661	1440182665	/nfs/dbraw/zinc/18/26/65/1440182665.db2.gz	WFLMTMNMTLZSMT-SCLBCKFNSA-N	0	3	331.435	3.118	20	30		EGEDHN
CC1(C)CC(C(=O)NC[C@H](NCc2ccc(C#N)s2)C2CC2)C1	ZINC001752458544	1440183461	/nfs/dbraw/zinc/18/34/61/1440183461.db2.gz	NFTFGKQNOQZQCY-INIZCTEOSA-N	0	3	331.485	3.040	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H](NCc1cnc(Cl)s1)C1CC1	ZINC001752461669	1440183829	/nfs/dbraw/zinc/18/38/29/1440183829.db2.gz	ZFCUJIAUMXDKIC-CYBMUJFWSA-N	0	3	327.881	3.137	20	30		EGEDHN
CC(C)c1[nH]ccc1C(=O)NC[C@H](NCC#Cc1ccccc1)C1CC1	ZINC001752478728	1440185227	/nfs/dbraw/zinc/18/52/27/1440185227.db2.gz	AKLLKENELQJNGE-FQEVSTJZSA-N	0	3	349.478	3.288	20	30		EGEDHN
CC1(C)CC[C@H](C(=O)NC[C@@H](NCC#Cc2ccccc2)C2CC2)C1	ZINC001752483316	1440186042	/nfs/dbraw/zinc/18/60/42/1440186042.db2.gz	YBNNDIZZVBATFJ-VQTJNVASSA-N	0	3	338.495	3.349	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)c1cnn(CCC)c1C	ZINC001752542927	1440194674	/nfs/dbraw/zinc/19/46/74/1440194674.db2.gz	HZQHDYBLHQTDNF-RYQLBKOJSA-N	0	3	344.503	3.245	20	30		EGEDHN
CCC(CC)C(=O)N[C@H]1C[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001752614133	1440196388	/nfs/dbraw/zinc/19/63/88/1440196388.db2.gz	QXRGAYPFSWHCQW-QAQDUYKDSA-N	0	3	332.875	3.365	20	30		EGEDHN
CCCC[C@@H](C)C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001752651137	1440197985	/nfs/dbraw/zinc/19/79/85/1440197985.db2.gz	IEASBNFETWFUDC-KBRIMQKVSA-N	0	3	331.435	3.260	20	30		EGEDHN
CC#CCCCC(=O)N[C@H]1C[C@H](NCc2cc(OC)ccc2Cl)C1	ZINC001752654602	1440198156	/nfs/dbraw/zinc/19/81/56/1440198156.db2.gz	ADRGOTFSRJSHEQ-WKILWMFISA-N	0	3	348.874	3.279	20	30		EGEDHN
C[C@@H]1CC(C(=O)N[C@H]2C[C@H](NCC#Cc3ccccc3)C2)C[C@@H](C)C1	ZINC001752687185	1440199959	/nfs/dbraw/zinc/19/99/59/1440199959.db2.gz	ITNJVUVGDLGOQY-USNOLKROSA-N	0	3	338.495	3.347	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H](NCc3oc(CC)nc3C)C2)CCCC1	ZINC001752692175	1440200759	/nfs/dbraw/zinc/20/07/59/1440200759.db2.gz	RTFPVEYYEWULJW-WKILWMFISA-N	0	3	345.487	3.419	20	30		EGEDHN
C=CCOCCCC(=O)N1CCC[C@@H]2CN(C/C=C\Cl)CC[C@@H]21	ZINC001752704287	1440202148	/nfs/dbraw/zinc/20/21/48/1440202148.db2.gz	CXADECYBTDTAPH-BRLJPEOMSA-N	0	3	340.895	3.035	20	30		EGEDHN
CC[C@@H](C)[C@@H](C)C(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001752771011	1440206104	/nfs/dbraw/zinc/20/61/04/1440206104.db2.gz	BOZOQUAIGIHXRD-KFZJALRRSA-N	0	3	331.435	3.116	20	30		EGEDHN
CCCCCC(=O)NC[C@@H]1CCCN(Cc2ccc(C#N)cc2)C1	ZINC001752776973	1440207118	/nfs/dbraw/zinc/20/71/18/1440207118.db2.gz	HKYOSKKUOUZOBA-IBGZPJMESA-N	0	3	327.472	3.467	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@H]1CCCN(Cc2c(C)noc2CC)C1	ZINC001752782824	1440209652	/nfs/dbraw/zinc/20/96/52/1440209652.db2.gz	BHAGYGIZKZYSCQ-MRXNPFEDSA-N	0	3	347.503	3.476	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001752786010	1440211283	/nfs/dbraw/zinc/21/12/83/1440211283.db2.gz	IRPAPBQZNRXYJK-YLJYHZDGSA-N	0	3	339.483	3.489	20	30		EGEDHN
C[C@@H](C(=O)NC[C@H]1CCCN(Cc2ccc(C#N)cc2)C1)C(C)(F)F	ZINC001752786943	1440211665	/nfs/dbraw/zinc/21/16/65/1440211665.db2.gz	CMDKLIGCWGUXEL-WMLDXEAASA-N	0	3	349.425	3.178	20	30		EGEDHN
C=CCCOCC(=O)NC[C@H]1CCCN([C@@H](C)c2cccc(F)c2)C1	ZINC001752789990	1440213324	/nfs/dbraw/zinc/21/33/24/1440213324.db2.gz	PENJGHOSHCXWTE-DLBZAZTESA-N	0	3	348.462	3.308	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CCC[C@H](CNC/C(Cl)=C\Cl)C1	ZINC001752794975	1440214168	/nfs/dbraw/zinc/21/41/68/1440214168.db2.gz	VPSFONPBZTVTJY-OMZQKGCKSA-N	0	3	349.302	3.115	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)[C@]1(C)CCCc2ccccc21	ZINC001752823479	1440222293	/nfs/dbraw/zinc/22/22/93/1440222293.db2.gz	CMBDDJXSGINQBB-SIKLNZKXSA-N	0	3	338.495	3.275	20	30		EGEDHN
C=CCN1CCCC[C@@H]1CNC(=O)CCCOc1ccc(F)cc1	ZINC001752828229	1440224533	/nfs/dbraw/zinc/22/45/33/1440224533.db2.gz	SLOSROAROZYAFA-QGZVFWFLSA-N	0	3	334.435	3.141	20	30		EGEDHN
C[C@H](CNC(=O)[C@H]1CC[C@@H]2C[C@@H]2CC1)NCc1ccc(C#N)s1	ZINC001752889358	1440240421	/nfs/dbraw/zinc/24/04/21/1440240421.db2.gz	PMCAVQLAXCUCLZ-APIJFGDWSA-N	0	3	331.485	3.040	20	30		EGEDHN
Cc1cc(F)ccc1C(=O)NC[C@H](C)NCc1ccc(F)c(C#N)c1	ZINC001752914639	1440246509	/nfs/dbraw/zinc/24/65/09/1440246509.db2.gz	RWJLVOGNTVGYJD-ZDUSSCGKSA-N	0	3	343.377	3.053	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCN(C)[C@@H](CC)c2ccc(F)cc2)cn1	ZINC001753071165	1440288477	/nfs/dbraw/zinc/28/84/77/1440288477.db2.gz	BLMJBRSYXRVUOI-IBGZPJMESA-N	0	3	339.414	3.015	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H]1CCCN1Cc1ccc(OCC#N)cc1	ZINC001753106648	1440306507	/nfs/dbraw/zinc/30/65/07/1440306507.db2.gz	QYKPYGAAIYKCJK-SFHVURJKSA-N	0	3	341.455	3.026	20	30		EGEDHN
C=CCOCC(=O)N(C)CCN[C@@H](C)c1ccc(Cl)c(Cl)c1	ZINC001753176647	1440336665	/nfs/dbraw/zinc/33/66/65/1440336665.db2.gz	WXKNCMDVTCNACE-LBPRGKRZSA-N	0	3	345.270	3.305	20	30		EGEDHN
CN(CCNCc1ccc(F)c(C#N)c1)C(=O)C(C)(C)C1CCCC1	ZINC001753198475	1440338214	/nfs/dbraw/zinc/33/82/14/1440338214.db2.gz	BJJIBYARIPECLP-UHFFFAOYSA-N	0	3	345.462	3.462	20	30		EGEDHN
C[C@H]1CCCC[C@H]1C(=O)N(C)CCNCc1ccc(C#N)c(F)c1	ZINC001753223992	1440340326	/nfs/dbraw/zinc/34/03/26/1440340326.db2.gz	TYSJEURPOAPLOC-WMLDXEAASA-N	0	3	331.435	3.072	20	30		EGEDHN
C=CC1(CC(=O)N(C)CCNCc2cncc(F)c2)CCCCC1	ZINC001753240877	1440342124	/nfs/dbraw/zinc/34/21/24/1440342124.db2.gz	FWMBOFUZKVNKHV-UHFFFAOYSA-N	0	3	333.451	3.295	20	30		EGEDHN
CC[C@@H](F)C(=O)NCCCN(CC#Cc1ccc(F)cc1)C(C)C	ZINC001753290318	1440350132	/nfs/dbraw/zinc/35/01/32/1440350132.db2.gz	RZLFSODIAHNNEF-GOSISDBHSA-N	0	3	336.426	3.142	20	30		EGEDHN
C=C(C)CN[C@H](CNC(=O)c1c(F)cccc1OC)c1ccccc1	ZINC001753298330	1440353139	/nfs/dbraw/zinc/35/31/39/1440353139.db2.gz	DJZRMXAEELNYPB-QGZVFWFLSA-N	0	3	342.414	3.471	20	30		EGEDHN
C#CCCN[C@@H](CNC(=O)c1ccc2ncsc2c1)c1ccccc1	ZINC001753302742	1440354551	/nfs/dbraw/zinc/35/45/51/1440354551.db2.gz	IYARNJMUYYCQOQ-SFHVURJKSA-N	0	3	349.459	3.380	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CCC)C(=O)[C@H](C)Cc2ccccc2F)C1	ZINC001753329221	1440368289	/nfs/dbraw/zinc/36/82/89/1440368289.db2.gz	XHRKGNDEHLZYIB-IEBWSBKVSA-N	0	3	344.474	3.341	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@@H](CN(C)[C@H](C)c2ccc(F)cc2F)C1	ZINC001753349539	1440377225	/nfs/dbraw/zinc/37/72/25/1440377225.db2.gz	RBWLJQSTHGSEJT-CVEARBPZSA-N	0	3	348.437	3.466	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](CN(C)Cc2cnc(C)s2)C1	ZINC001753356674	1440380394	/nfs/dbraw/zinc/38/03/94/1440380394.db2.gz	UPZHTDZQXPZLGL-HNNXBMFYSA-N	0	3	335.517	3.334	20	30		EGEDHN
C=CC[C@H](C(=O)NCC1CN(CC2CC(F)(F)C2)C1)c1ccccc1	ZINC001753416748	1440394691	/nfs/dbraw/zinc/39/46/91/1440394691.db2.gz	FYYONBATHMWRAX-SFHVURJKSA-N	0	3	348.437	3.440	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H]2C[C@H]1CN2C(=O)c1cccc(F)c1OCC	ZINC001753425361	1440396687	/nfs/dbraw/zinc/39/66/87/1440396687.db2.gz	NXEYZETZOKFDLR-PMPSAXMXSA-N	0	3	346.446	3.478	20	30		EGEDHN
C#CCC1(C(=O)N(C)[C@@H]2CCN(C[C@H]3CCCCO3)C2)CCCCC1	ZINC001753449423	1440405476	/nfs/dbraw/zinc/40/54/76/1440405476.db2.gz	FXFZPOORIPHCSE-RTBURBONSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=C[C@H](CC(=O)N(C)[C@H]1CCN(CCOC(C)C)C1)c1ccccc1	ZINC001753450864	1440405799	/nfs/dbraw/zinc/40/57/99/1440405799.db2.gz	XLEVFOIRAFLQBV-QUCCMNQESA-N	0	3	344.499	3.304	20	30		EGEDHN
CCN(C(=O)C#CC(C)C)[C@H]1CCN(CCCOc2ccccc2)C1	ZINC001753454696	1440407769	/nfs/dbraw/zinc/40/77/69/1440407769.db2.gz	BBVYBGRULFVFND-IBGZPJMESA-N	0	3	342.483	3.038	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)CCOc2ccc(C)c(C)c2)C1	ZINC001753457350	1440408761	/nfs/dbraw/zinc/40/87/61/1440408761.db2.gz	OJGPABPAIUNOPD-IBGZPJMESA-N	0	3	342.483	3.018	20	30		EGEDHN
CC[C@H](CNC(=O)CCC1CCCC1)NCC#Cc1ccccc1	ZINC001753463145	1440411941	/nfs/dbraw/zinc/41/19/41/1440411941.db2.gz	AIRKHGQDPMCZFS-HXUWFJFHSA-N	0	3	326.484	3.493	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@H](CC)N[C@@H](C)C(=O)Nc1ccccc1	ZINC001753481562	1440416826	/nfs/dbraw/zinc/41/68/26/1440416826.db2.gz	SRJXVKMVKGKNBK-HOTGVXAUSA-N	0	3	345.487	3.100	20	30		EGEDHN
CC(C)C(=O)NC1(CNCC#Cc2ccc(Cl)cc2)CCCC1	ZINC001753500053	1440423052	/nfs/dbraw/zinc/42/30/52/1440423052.db2.gz	QYWQYRUACVKDSJ-UHFFFAOYSA-N	0	3	332.875	3.366	20	30		EGEDHN
CC(C)C#CC(=O)N[C@](C)(CNCc1cccc(C(C)C)n1)C1CC1	ZINC001753516915	1440427570	/nfs/dbraw/zinc/42/75/70/1440427570.db2.gz	UAXZSMQYFVRINE-OAQYLSRUSA-N	0	3	341.499	3.239	20	30		EGEDHN
Cc1nc(CNCC[C@H]2CCCN(C(=O)C#CC(C)C)C2)sc1C	ZINC001753546153	1440434285	/nfs/dbraw/zinc/43/42/85/1440434285.db2.gz	FUDAPQLUPQMGLF-QGZVFWFLSA-N	0	3	347.528	3.138	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCCN(C(=O)c2coc(C3CC3)n2)C1	ZINC001753557511	1440436204	/nfs/dbraw/zinc/43/62/04/1440436204.db2.gz	MZXZTILGWJQMKW-ZDUSSCGKSA-N	0	3	337.851	3.136	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC(CCNCc2c(F)cccc2F)CC1	ZINC001753567157	1440437856	/nfs/dbraw/zinc/43/78/56/1440437856.db2.gz	CXVMJBSKIIZXJM-UHFFFAOYSA-N	0	3	348.437	3.343	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1CC[C@H](NCc2oc(CC)nc2C)CC1	ZINC001753581768	1440440318	/nfs/dbraw/zinc/44/03/18/1440440318.db2.gz	AIGLNBSNAMRYFB-WKILWMFISA-N	0	3	333.476	3.419	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1CC[C@H](NCc2nc(C)c(C)s2)CC1	ZINC001753583336	1440440706	/nfs/dbraw/zinc/44/07/06/1440440706.db2.gz	GTBIVDRCCVNMIG-SHTZXODSSA-N	0	3	335.517	3.489	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1CC[C@H](N[C@H](C)c2cnccn2)CC1	ZINC001753585240	1440441154	/nfs/dbraw/zinc/44/11/54/1440441154.db2.gz	ZCSVZOCGVLKXAJ-BZUAXINKSA-N	0	3	330.476	3.157	20	30		EGEDHN
Cc1cc(C)cc(CC(=O)NC[C@@H](C)CNCc2ccccc2C#N)c1	ZINC001753628671	1440451726	/nfs/dbraw/zinc/45/17/26/1440451726.db2.gz	KKPAVVHGUOZSNT-SFHVURJKSA-N	0	3	349.478	3.260	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cc(CCC)on2)CCCC1	ZINC001753671510	1440462366	/nfs/dbraw/zinc/46/23/66/1440462366.db2.gz	QYLOETQZKSBERM-UHFFFAOYSA-N	0	3	325.840	3.012	20	30		EGEDHN
C=CCOCCN1CC2(C1)CCN(C(=O)[C@@H](CCC)C(C)C)CC2	ZINC001753675153	1440463196	/nfs/dbraw/zinc/46/31/96/1440463196.db2.gz	UAXYLODNHKCBJJ-SFHVURJKSA-N	0	3	336.520	3.186	20	30		EGEDHN
Cc1ccsc1C(=O)N(C)[C@H](C)CNCc1ccc(C#N)c(F)c1	ZINC001753676675	1440463410	/nfs/dbraw/zinc/46/34/10/1440463410.db2.gz	GELQBCNLGSRSIK-CYBMUJFWSA-N	0	3	345.443	3.318	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)N(C)C(=O)[C@@H]1C[C@@H]2CCCC[C@H]12	ZINC001753705284	1440469423	/nfs/dbraw/zinc/46/94/23/1440469423.db2.gz	VJFJQZNDZSWVJS-IDCJVQTKSA-N	0	3	345.512	3.383	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@@H](C)CNCC=C(Cl)Cl)cc1	ZINC001753708142	1440469913	/nfs/dbraw/zinc/46/99/13/1440469913.db2.gz	ZNIRHVQUYMHZKF-LBPRGKRZSA-N	0	3	325.239	3.037	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H](CNCC#Cc2ccccc2)CC(C)C)cn1	ZINC001753731840	1440476221	/nfs/dbraw/zinc/47/62/21/1440476221.db2.gz	BKUBTFJATRBFSJ-NRFANRHFSA-N	0	3	349.478	3.176	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](CNCc2cn(C)nc2C)CC(C)C)CC1	ZINC001753742318	1440479551	/nfs/dbraw/zinc/47/95/51/1440479551.db2.gz	PZDSUAIWSVPXGI-IBGZPJMESA-N	0	3	346.519	3.095	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCCCN1C(=O)c1cccn2nccc12	ZINC001753781828	1440487315	/nfs/dbraw/zinc/48/73/15/1440487315.db2.gz	SUQWWPOLAAEPDU-HNNXBMFYSA-N	0	3	346.862	3.061	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCCC[C@@H]1CCNCc1ccccc1C#N	ZINC001753795921	1440489759	/nfs/dbraw/zinc/48/97/59/1440489759.db2.gz	IDSHCXVWHFULBJ-NSISKUIASA-N	0	3	339.483	3.465	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@@H](C)[C@@H]1CNCc1cncs1	ZINC001753819168	1440495197	/nfs/dbraw/zinc/49/51/97/1440495197.db2.gz	PGUPGHVGOUDDDP-ZBFHGGJFSA-N	0	3	335.517	3.462	20	30		EGEDHN
C=C(Br)CN[C@H](CNC(=O)C1CC(C)(C)C1)C(C)C	ZINC001753828263	1440498867	/nfs/dbraw/zinc/49/88/67/1440498867.db2.gz	GGOSYRCSWJKPNX-CYBMUJFWSA-N	0	3	331.298	3.062	20	30		EGEDHN
CC/C(C)=C/C(=O)NC[C@H](NCc1cc(C#N)ccc1F)C(C)C	ZINC001753828516	1440498993	/nfs/dbraw/zinc/49/89/93/1440498993.db2.gz	HYCREDZJFMFVNI-QKAYDNCFSA-N	0	3	331.435	3.284	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1ccc2cc(C)cn2c1)C(C)C	ZINC001753829931	1440499359	/nfs/dbraw/zinc/49/93/59/1440499359.db2.gz	DKNAJFXBFQHCHF-KRWDZBQOSA-N	0	3	333.863	3.344	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H]1CCC[C@@H]1CNCc1csc(C2CC2)n1	ZINC001753883932	1440520902	/nfs/dbraw/zinc/52/09/02/1440520902.db2.gz	BYODOHOJXWPBGJ-WBVHZDCISA-N	0	3	345.512	3.054	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@H](C)CNCc1cnn(-c2ccccc2)c1	ZINC001754241061	1440555775	/nfs/dbraw/zinc/55/57/75/1440555775.db2.gz	BCYDBLDQAWUNBX-OXQOHEQNSA-N	0	3	340.471	3.069	20	30		EGEDHN
C[C@@H](CNCC#Cc1cccc(Cl)c1)NC(=O)C[C@H]1C=CCC1	ZINC001754259437	1440559858	/nfs/dbraw/zinc/55/98/58/1440559858.db2.gz	SJOBBCUFHRKPGR-RDJZCZTQSA-N	0	3	330.859	3.142	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H](C)CNCc2ccc(C#N)c(F)c2)ccc1F	ZINC001754281127	1440563137	/nfs/dbraw/zinc/56/31/37/1440563137.db2.gz	XWEMYJKOVVZPOB-ZDUSSCGKSA-N	0	3	343.377	3.053	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H](C)CN(C)Cc1cccc(C(F)(F)F)c1	ZINC001754311753	1440573386	/nfs/dbraw/zinc/57/33/86/1440573386.db2.gz	RXJBDJRGCNDYAN-AWEZNQCLSA-N	0	3	340.389	3.301	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)c1c(F)cccc1F	ZINC001754343680	1440589276	/nfs/dbraw/zinc/58/92/76/1440589276.db2.gz	ZVHCHYOJOJDZRK-ZDUSSCGKSA-N	0	3	343.377	3.087	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1CCCC[C@H]1CNCc1ocnc1C	ZINC001754344480	1440589429	/nfs/dbraw/zinc/58/94/29/1440589429.db2.gz	DRSQNEYJUNDAFN-HOTGVXAUSA-N	0	3	333.476	3.350	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H](CNCc1c(C)nsc1C)C1CC1	ZINC001754450138	1440600970	/nfs/dbraw/zinc/60/09/70/1440600970.db2.gz	HJIHPEODRFREDU-WMZOPIPTSA-N	0	3	335.517	3.347	20	30		EGEDHN
C=CCCCCCN1CC[C@@H]1CNC(=O)c1cncc2[nH]ccc21	ZINC001754488894	1440609524	/nfs/dbraw/zinc/60/95/24/1440609524.db2.gz	LXZLPJRUILGNDA-OAHLLOKOSA-N	0	3	326.444	3.113	20	30		EGEDHN
C=CCC[C@@H](C)N1CC[C@H]1CNC(=O)c1cnccc1C(F)(F)F	ZINC001754494930	1440611786	/nfs/dbraw/zinc/61/17/86/1440611786.db2.gz	AYLKIXPWCGPIDC-OLZOCXBDSA-N	0	3	341.377	3.259	20	30		EGEDHN
O=C(CC#Cc1ccccc1)NC[C@H]1CCN1CC1CC2(CCC2)C1	ZINC001754504220	1440615734	/nfs/dbraw/zinc/61/57/34/1440615734.db2.gz	DFKIXRGFPJNHFM-HXUWFJFHSA-N	0	3	336.479	3.199	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@@]2(CCN(Cc3cccnc3)C2)C1	ZINC001754565480	1440635303	/nfs/dbraw/zinc/63/53/03/1440635303.db2.gz	KKXQYTDHPQUQEC-FXAWDEMLSA-N	0	3	327.472	3.108	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](NCc2ccncc2Cl)C[C@@H]1C	ZINC001754592582	1440641013	/nfs/dbraw/zinc/64/10/13/1440641013.db2.gz	DKFVLCIOVDMVIS-GOEBONIOSA-N	0	3	333.863	3.008	20	30		EGEDHN
C[C@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)CCC(C)(F)F	ZINC001754596295	1440641548	/nfs/dbraw/zinc/64/15/48/1440641548.db2.gz	DVZUBVUCTLSWRR-WMLDXEAASA-N	0	3	349.425	3.463	20	30		EGEDHN
C[C@@H](C(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1)C(C)(F)F	ZINC001754629104	1440647220	/nfs/dbraw/zinc/64/72/20/1440647220.db2.gz	RAOMOPBPHFUMSH-AWEZNQCLSA-N	0	3	349.425	3.320	20	30		EGEDHN
C#CCNC[C@@H](NC(=O)CCn1cccc1)c1ccc2ccccc2c1	ZINC001754643522	1440649399	/nfs/dbraw/zinc/64/93/99/1440649399.db2.gz	AMVOQWAORAYKTO-OAQYLSRUSA-N	0	3	345.446	3.112	20	30		EGEDHN
C#CCNC[C@@H](NC(=O)[C@H]1CC12CCC2)c1ccc2ccccc2c1	ZINC001754644849	1440649914	/nfs/dbraw/zinc/64/99/14/1440649914.db2.gz	YFLNKXQUICHLHK-WOJBJXKFSA-N	0	3	332.447	3.410	20	30		EGEDHN
C#CCNC[C@H](NC(=O)COC(C)(C)C)c1ccc2ccccc2c1	ZINC001754644801	1440649926	/nfs/dbraw/zinc/64/99/26/1440649926.db2.gz	XMSDMSSDKJVJNF-IBGZPJMESA-N	0	3	338.451	3.035	20	30		EGEDHN
C#CCCCCC(=O)N[C@@]1(C)CCN(Cc2cccc(OC)c2C)C1	ZINC001754671094	1440657829	/nfs/dbraw/zinc/65/78/29/1440657829.db2.gz	BCVBQSLSXLADOW-NRFANRHFSA-N	0	3	342.483	3.278	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@](C)(CNCc2oc(CC)nc2C)C1	ZINC001754694767	1440666829	/nfs/dbraw/zinc/66/68/29/1440666829.db2.gz	HDDATOZROIDLCO-FQEVSTJZSA-N	0	3	347.503	3.476	20	30		EGEDHN
C=CCCC(=O)NC[C@@]1(C)CCCN(Cc2ccc(C#N)cc2)C1	ZINC001754724932	1440675526	/nfs/dbraw/zinc/67/55/26/1440675526.db2.gz	WBHDNKZNQIGFHD-HXUWFJFHSA-N	0	3	325.456	3.243	20	30		EGEDHN
C=CCN1CCC[C@@](C)(CNC(=O)c2ccoc2Br)C1	ZINC001754732283	1440680234	/nfs/dbraw/zinc/68/02/34/1440680234.db2.gz	QYTIYHWMBNVAAA-HNNXBMFYSA-N	0	3	341.249	3.060	20	30		EGEDHN
C=C(C)CN1CC[C@@](O)(CNC(=O)C[C@@H](CC)c2ccc(C)cc2)C1	ZINC001754757328	1440685173	/nfs/dbraw/zinc/68/51/73/1440685173.db2.gz	IVBMRVFVISRYME-WIYYLYMNSA-N	0	3	344.499	3.008	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@H](C)[C@@H](CNCc2nc(C)sc2C)C1	ZINC001754809932	1440691806	/nfs/dbraw/zinc/69/18/06/1440691806.db2.gz	AGQWGKRIZDYULE-YOEHRIQHSA-N	0	3	347.528	3.138	20	30		EGEDHN
Cc1cc(F)ccc1CN1CC[C@@H]2[C@H]1CCCN2C(=O)C#CC(C)C	ZINC001754865399	1440702703	/nfs/dbraw/zinc/70/27/03/1440702703.db2.gz	LMKLAOTZGOPKFT-WOJBJXKFSA-N	0	3	342.458	3.359	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](CCNCc2cccnc2OC)C1	ZINC001754926927	1440709980	/nfs/dbraw/zinc/70/99/80/1440709980.db2.gz	WSQPVYIWBXDWPA-MRXNPFEDSA-N	0	3	345.487	3.021	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCN(C(=O)c2sc(C)cc2OC)C1	ZINC001754935178	1440711085	/nfs/dbraw/zinc/71/10/85/1440711085.db2.gz	WXGRGSFINJHDLC-CYBMUJFWSA-N	0	3	342.892	3.259	20	30		EGEDHN
CC#CCN[C@@H](C)c1ccc(CNC(=O)[C@@H]2C[C@H]2c2ccncc2)cc1	ZINC001754947434	1440713638	/nfs/dbraw/zinc/71/36/38/1440713638.db2.gz	MBFRTJJJFIJRTG-ORYQWCPZSA-N	0	3	347.462	3.175	20	30		EGEDHN
C=CCCCCCN1CCN([C@@H]2CCN(C(=O)C3=CCCC3)C2)CC1	ZINC001755017009	1440726260	/nfs/dbraw/zinc/72/62/60/1440726260.db2.gz	JOTFWHFWUSIIHA-HXUWFJFHSA-N	0	3	345.531	3.062	20	30		EGEDHN
CC#CCN(C)CCCN(C)C(=O)c1ccc(C(C)C)nc1CC	ZINC001755043476	1440738885	/nfs/dbraw/zinc/73/88/85/1440738885.db2.gz	YLUHJDSHHXLIQF-UHFFFAOYSA-N	0	3	329.488	3.185	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCCCCC1CCN(Cc2ccccn2)CC1	ZINC001755075051	1440748130	/nfs/dbraw/zinc/74/81/30/1440748130.db2.gz	WARSPVMIGPSUJM-KRWDZBQOSA-N	0	3	342.487	3.130	20	30		EGEDHN
C=CCCCN1Cc2ccc(CNC(=O)c3cc(CC)on3)cc2C1	ZINC001755101688	1440752785	/nfs/dbraw/zinc/75/27/85/1440752785.db2.gz	YQLGDORZJLXDBM-UHFFFAOYSA-N	0	3	339.439	3.449	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC(C)(NCc2cnc(C)o2)CC1	ZINC001755131184	1440757220	/nfs/dbraw/zinc/75/72/20/1440757220.db2.gz	DQRJHBYGEAWPCQ-UHFFFAOYSA-N	0	3	331.460	3.037	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@H]1CNC(=O)COCC1CC1	ZINC001755171985	1440769478	/nfs/dbraw/zinc/76/94/78/1440769478.db2.gz	HYDYFIXKZOEMSU-HXUWFJFHSA-N	0	3	342.483	3.095	20	30		EGEDHN
C=CCN1CCN(CCCCCNC(=O)c2csc(C)c2C)CC1	ZINC001755172937	1440769959	/nfs/dbraw/zinc/76/99/59/1440769959.db2.gz	BEHQBBSSGSRNMM-UHFFFAOYSA-N	0	3	349.544	3.069	20	30		EGEDHN
CC#CCN1CCC2(CC1)CN(C(=O)C(C)(C)CC(C)(C)C)CCO2	ZINC001755174921	1440770599	/nfs/dbraw/zinc/77/05/99/1440770599.db2.gz	ZTAZEKQDFBWMRP-UHFFFAOYSA-N	0	3	348.531	3.166	20	30		EGEDHN
C=CCN1CCN(CCCCCNC(=O)c2ccc(Cl)cc2)CC1	ZINC001755175335	1440770714	/nfs/dbraw/zinc/77/07/14/1440770714.db2.gz	PRFWUZFLURDXDQ-UHFFFAOYSA-N	0	3	349.906	3.044	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H]1CN(C)Cc1cccc2nsnc21	ZINC001755188353	1440773995	/nfs/dbraw/zinc/77/39/95/1440773995.db2.gz	DFBLNARUKZEWBW-OAHLLOKOSA-N	0	3	344.484	3.080	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCN1C(=O)c1cc(C)sc1C	ZINC001755193555	1440775712	/nfs/dbraw/zinc/77/57/12/1440775712.db2.gz	BLYBDCYRHLTOLW-MRXNPFEDSA-N	0	3	336.501	3.104	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)CCC(F)F	ZINC001755197105	1440777396	/nfs/dbraw/zinc/77/73/96/1440777396.db2.gz	UMEXBEVASAEEPP-MRXNPFEDSA-N	0	3	335.398	3.026	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]2CN(C)CCc2scnc2C)C1	ZINC001755199467	1440778750	/nfs/dbraw/zinc/77/87/50/1440778750.db2.gz	WZGYVGMIJGOYKZ-MRXNPFEDSA-N	0	3	347.528	3.273	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H]([C@@H]2CCN(Cc3cncs3)C2)C1	ZINC001755203186	1440781006	/nfs/dbraw/zinc/78/10/06/1440781006.db2.gz	SCUKXAOEFILDTN-HZPDHXFCSA-N	0	3	333.501	3.170	20	30		EGEDHN
CC#CCCCC(=O)N[C@H](C)[C@H](C)NCc1cccc(C(C)C)n1	ZINC001755247508	1440790973	/nfs/dbraw/zinc/79/09/73/1440790973.db2.gz	BHVLGNPRAAUAFQ-DLBZAZTESA-N	0	3	329.488	3.381	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H](C)[C@@H](C)NCc2sccc2Cl)c1	ZINC001755253012	1440792394	/nfs/dbraw/zinc/79/23/94/1440792394.db2.gz	NYXASIRTVJRKFE-NEPJUHHUSA-N	0	3	347.871	3.074	20	30		EGEDHN
C[C@H](NCC#Cc1ccc(F)cc1)[C@H](C)NC(=O)C(C1CC1)C1CC1	ZINC001755264373	1440795739	/nfs/dbraw/zinc/79/57/39/1440795739.db2.gz	WCXNBQDVUFQUHX-GJZGRUSLSA-N	0	3	342.458	3.096	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)C[C@H](C)C(F)(F)F	ZINC001755284738	1440801666	/nfs/dbraw/zinc/80/16/66/1440801666.db2.gz	CQXWHXAXGCQAKC-JTQLQIEISA-N	0	3	328.806	3.402	20	30		EGEDHN
Cc1ccc(CCC(=O)NC[C@@H](C)N(C)Cc2cccc(C#N)c2)cc1	ZINC001755308409	1440812075	/nfs/dbraw/zinc/81/20/75/1440812075.db2.gz	VMINLJPYMFLGAC-GOSISDBHSA-N	0	3	349.478	3.436	20	30		EGEDHN
C[C@@H](CNC(=O)C1(C)CCCC1)N(C)Cc1ccc(OCC#N)cc1	ZINC001755309591	1440812918	/nfs/dbraw/zinc/81/29/18/1440812918.db2.gz	DYNPCWGZLIKIPI-INIZCTEOSA-N	0	3	343.471	3.106	20	30		EGEDHN
C=CCCC(=O)NC1(CNCc2ccccc2[N+](=O)[O-])CCCCC1	ZINC001755349953	1440827579	/nfs/dbraw/zinc/82/75/79/1440827579.db2.gz	VQQOEPQDJCARDT-UHFFFAOYSA-N	0	3	345.443	3.470	20	30		EGEDHN
C=CCCC(=O)NC[C@H]1CCCCCN1Cc1cccc(C#N)c1	ZINC001755363403	1440832926	/nfs/dbraw/zinc/83/29/26/1440832926.db2.gz	ABRJXMXUFCXFSV-LJQANCHMSA-N	0	3	325.456	3.385	20	30		EGEDHN
N#Cc1cccc(CN2CCCCC[C@H]2CNC(=O)CCC(F)F)c1	ZINC001755366875	1440835239	/nfs/dbraw/zinc/83/52/39/1440835239.db2.gz	ZSKSYMJODFTCOZ-KRWDZBQOSA-N	0	3	349.425	3.464	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CN(CCOc2cc(C)cc(C)c2)CC1(C)C	ZINC001755404974	1440843835	/nfs/dbraw/zinc/84/38/35/1440843835.db2.gz	CLDQYTORWQNKKO-IBGZPJMESA-N	0	3	344.499	3.475	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CN(Cc2ccc(CF)cc2)CC1(C)C	ZINC001755409009	1440845237	/nfs/dbraw/zinc/84/52/37/1440845237.db2.gz	YGUILZMIMCZOJI-SFHVURJKSA-N	0	3	330.447	3.286	20	30		EGEDHN
CC#CCN1C[C@]2(C)CN(C(=O)[C@H](C)OCCCCCC)C[C@]2(C)C1	ZINC001755461636	1440857618	/nfs/dbraw/zinc/85/76/18/1440857618.db2.gz	BIKSDKZNVIMVLI-SESVDKBCSA-N	0	3	348.531	3.166	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1C[C@H](CNCc2cc(O)ccc2Cl)C1	ZINC001755476699	1440859563	/nfs/dbraw/zinc/85/95/63/1440859563.db2.gz	URZNJNODKUALAQ-MQMHXKEQSA-N	0	3	336.863	3.242	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H](CNCc3cc(C)no3)C2)CCCC1	ZINC001755484107	1440860574	/nfs/dbraw/zinc/86/05/74/1440860574.db2.gz	IINVLHSJJGMPSX-WKILWMFISA-N	0	3	331.460	3.104	20	30		EGEDHN
C[C@H](CN(C)C(=O)[C@H]1CCCC1(C)C)NCc1ccc(F)c(C#N)c1	ZINC001755601364	1440884199	/nfs/dbraw/zinc/88/41/99/1440884199.db2.gz	LKGRHNOKJBCSDZ-RHSMWYFYSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N(C)C[C@H](C)NCc1ccc(C#N)c(F)c1	ZINC001755605004	1440885129	/nfs/dbraw/zinc/88/51/29/1440885129.db2.gz	GJJJPLLQMOBXNO-LIRRHRJNSA-N	0	3	331.435	3.236	20	30		EGEDHN
Cc1cccc(C(=O)N2CC[C@H](NCC#Cc3ccccc3)[C@H]2C)c1	ZINC001755648626	1440891205	/nfs/dbraw/zinc/89/12/05/1440891205.db2.gz	HDHMNVSVWSKMEE-NQIIRXRSSA-N	0	3	332.447	3.239	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H](CO)N[C@@H](C)c2ccccc2C)CCCC1	ZINC001755649428	1440891226	/nfs/dbraw/zinc/89/12/26/1440891226.db2.gz	UVNFRBLJKHMLEP-ROUUACIJSA-N	0	3	344.499	3.259	20	30		EGEDHN
C[C@@H]1[C@H](NCC#Cc2ccc(F)cc2)CCN1C(=O)CCCC1CC1	ZINC001755659315	1440892560	/nfs/dbraw/zinc/89/25/60/1440892560.db2.gz	QPCYBTWXFRHVCM-OXQOHEQNSA-N	0	3	342.458	3.337	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CCCN(CCn2nc(C)cc2C)[C@@H]1C	ZINC001755720024	1440906782	/nfs/dbraw/zinc/90/67/82/1440906782.db2.gz	CDDLAHCCSJAKHA-QZTJIDSGSA-N	0	3	346.519	3.071	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@H](NCc2cncc(C)c2)C(C)(C)C1	ZINC001755772577	1440917017	/nfs/dbraw/zinc/91/70/17/1440917017.db2.gz	DOTYCNYXVTVURO-AEFFLSMTSA-N	0	3	329.488	3.319	20	30		EGEDHN
CC1(C)CN(C(=O)CCCC2CC2)C[C@H]1NCC#Cc1ccccc1	ZINC001755775754	1440917225	/nfs/dbraw/zinc/91/72/25/1440917225.db2.gz	QPXBHBFHHALFSP-HXUWFJFHSA-N	0	3	338.495	3.445	20	30		EGEDHN
C=C(C)CN(C)CCN(C(=O)c1ccc(-c2ncon2)cc1)C(C)C	ZINC001755817778	1440924645	/nfs/dbraw/zinc/92/46/45/1440924645.db2.gz	YRBDLQBAZBGMAJ-UHFFFAOYSA-N	0	3	342.443	3.095	20	30		EGEDHN
C=CCCC(=O)N[C@H](CNCc1cc(F)ccc1OC)C(C)(C)C	ZINC001755820544	1440925531	/nfs/dbraw/zinc/92/55/31/1440925531.db2.gz	KQXWWSQRNABDFV-QGZVFWFLSA-N	0	3	336.451	3.421	20	30		EGEDHN
C[C@@H](C(=O)N[C@H](CNCC#Cc1ccccc1)C(C)(C)C)C1CC1	ZINC001755820956	1440925680	/nfs/dbraw/zinc/92/56/80/1440925680.db2.gz	VYRRSFGWCFNPCZ-VQIMIIECSA-N	0	3	326.484	3.205	20	30		EGEDHN
C=C(Cl)CNC[C@@H](NC(=O)c1nncc2ccccc21)C(C)(C)C	ZINC001755826920	1440927553	/nfs/dbraw/zinc/92/75/53/1440927553.db2.gz	AFIKSLMMVJUPHX-OAHLLOKOSA-N	0	3	346.862	3.116	20	30		EGEDHN
CC#CCN1CCC([C@@H](C)NC(=O)CCCc2csc(C)n2)CC1	ZINC001755843364	1440932317	/nfs/dbraw/zinc/93/23/17/1440932317.db2.gz	FBDAXNYWWIWZIZ-OAHLLOKOSA-N	0	3	347.528	3.014	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@H](C)C1CCN(Cc2cccnc2)CC1	ZINC001755845143	1440933020	/nfs/dbraw/zinc/93/30/20/1440933020.db2.gz	YDMNXLGSURUDSP-UZLBHIALSA-N	0	3	329.488	3.401	20	30		EGEDHN
CC#CCN1CCC([C@@H](C)NC(=O)C[C@H]2CCc3ccccc32)CC1	ZINC001755845911	1440933308	/nfs/dbraw/zinc/93/33/08/1440933308.db2.gz	DTWABRZNCJHPGE-YLJYHZDGSA-N	0	3	338.495	3.347	20	30		EGEDHN
C#CCCCC(=O)NC1(C2CCN(Cc3cnccc3C)CC2)CC1	ZINC001755868600	1440938364	/nfs/dbraw/zinc/93/83/64/1440938364.db2.gz	ZZVLMRPRMIJLDL-UHFFFAOYSA-N	0	3	339.483	3.054	20	30		EGEDHN
CC#CCN1CCC(C2(NC(=O)[C@@H](CC)OC3CCCC3)CC2)CC1	ZINC001755869458	1440938724	/nfs/dbraw/zinc/93/87/24/1440938724.db2.gz	GVHBZCMEFATXTD-LJQANCHMSA-N	0	3	346.515	3.108	20	30		EGEDHN
C[C@H](C#N)C(=O)NCC1=CCN(Cc2ccc(C(C)(C)C)cc2)CC1	ZINC001755883815	1440939993	/nfs/dbraw/zinc/93/99/93/1440939993.db2.gz	BKUUHIJAWHENFN-MRXNPFEDSA-N	0	3	339.483	3.392	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC1=CCN(CCc2scnc2C)CC1	ZINC001755890396	1440941403	/nfs/dbraw/zinc/94/14/03/1440941403.db2.gz	GFOAVJOREYWCIE-UHFFFAOYSA-N	0	3	347.528	3.345	20	30		EGEDHN
COC[C@@H](NC[C@@H](O)c1ccc(C#N)cc1)c1ccc(Cl)cc1	ZINC000193668990	240258139	/nfs/dbraw/zinc/25/81/39/240258139.db2.gz	KCFYXRWPXGNUSI-QZTJIDSGSA-N	0	3	330.815	3.222	20	30		EGEDHN
COc1cccc(N2C[C@H](N[C@@H](C)c3cccc(C#N)c3)CC2=O)c1	ZINC000378452269	169123479	/nfs/dbraw/zinc/12/34/79/169123479.db2.gz	LEELLPYXWATOBO-WMLDXEAASA-N	0	3	335.407	3.023	20	30		EGEDHN
CCOCCN(C)CCC(=O)Nc1sc2c(c1C#N)CC[C@@H](C)C2	ZINC000093312047	218212952	/nfs/dbraw/zinc/21/29/52/218212952.db2.gz	IDZZSUKUYVNVNW-CYBMUJFWSA-N	0	3	349.500	3.041	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cnccc2-c2cccc(F)c2)CC1	ZINC000267803513	251363122	/nfs/dbraw/zinc/36/31/22/251363122.db2.gz	QARXJWVWVSILJB-UHFFFAOYSA-N	0	3	337.398	3.171	20	30		EGEDHN
COc1cc(CN(C)C[C@@H](O)c2ccc(C#N)cc2)ccc1SC	ZINC000268641271	252094631	/nfs/dbraw/zinc/09/46/31/252094631.db2.gz	DNXJUGNTKITELH-QGZVFWFLSA-N	0	3	342.464	3.454	20	30		EGEDHN
CC(C)(C)OC(=O)C1CCN(CCCOc2cccc(C#N)c2)CC1	ZINC000268630037	252083613	/nfs/dbraw/zinc/08/36/13/252083613.db2.gz	BLIOPYPVXIEMLL-UHFFFAOYSA-N	0	3	344.455	3.381	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H](c2ccc(F)cc2)C2CCC2)CC1	ZINC000264256749	533148230	/nfs/dbraw/zinc/14/82/30/533148230.db2.gz	PNZHUJMPCCTNON-LJQANCHMSA-N	0	3	328.431	3.128	20	30		EGEDHN
N#CC(C(=O)c1cccc2c1OCCO2)c1ccc(C(F)(F)F)cn1	ZINC000119535783	221341692	/nfs/dbraw/zinc/34/16/92/221341692.db2.gz	BYQZBELDWSRIIT-GFCCVEGCSA-N	0	3	348.280	3.362	20	30		EGEDHN
C[C@@H](NC[C@@H]1CN(Cc2ccccc2)CCCO1)c1ccc(C#N)cc1	ZINC000191835271	533423108	/nfs/dbraw/zinc/42/31/08/533423108.db2.gz	BOTCRRNDKUIODM-XMSQKQJNSA-N	0	3	349.478	3.500	20	30		EGEDHN
C[C@@H](CNC(=O)Nc1cc(C#N)cn1C(C)(C)C)N1CCCC[C@@H]1C	ZINC000337863005	141068608	/nfs/dbraw/zinc/06/86/08/141068608.db2.gz	NMEJQYRYLIBVLU-GJZGRUSLSA-N	0	3	345.491	3.499	20	30		EGEDHN
N#Cc1ccc([C@H](NCC2(c3ccccc3)CCCC2)C(N)=O)cc1	ZINC000115596009	152019632	/nfs/dbraw/zinc/01/96/32/152019632.db2.gz	UIUXOXRRYUBSAA-IBGZPJMESA-N	0	3	333.435	3.186	20	30		EGEDHN
CC(C)CO[C@H]1CCN(CCC(=O)Nc2ccc(C#N)c(Cl)c2)C1	ZINC000120052456	152246684	/nfs/dbraw/zinc/24/66/84/152246684.db2.gz	QQFVWTUKUFFZFY-INIZCTEOSA-N	0	3	349.862	3.287	20	30		EGEDHN
C[C@H](CN1CCCCCC1)NC(=O)CSCc1ccc(C#N)cc1	ZINC000186285563	153005399	/nfs/dbraw/zinc/00/53/99/153005399.db2.gz	JDBDSCQHUSUOLK-MRXNPFEDSA-N	0	3	345.512	3.172	20	30		EGEDHN
COc1cccc([C@H](CNc2cccc(C#N)c2[N+](=O)[O-])N(C)C)c1	ZINC000336893997	154232452	/nfs/dbraw/zinc/23/24/52/154232452.db2.gz	VMPJAPGBMADYEW-KRWDZBQOSA-N	0	3	340.383	3.190	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN2CC[C@@H](c3c(F)cccc3F)C2)cc1	ZINC000249051271	163052970	/nfs/dbraw/zinc/05/29/70/163052970.db2.gz	WVTDBZUQYQAUTR-CRAIPNDOSA-N	0	3	328.362	3.359	20	30		EGEDHN
COc1cc(CNC[C@@H](CO)c2ccccc2Cl)ccc1C#N	ZINC000342309033	163844696	/nfs/dbraw/zinc/84/46/96/163844696.db2.gz	SRIMIIZADCIHAQ-HNNXBMFYSA-N	0	3	330.815	3.086	20	30		EGEDHN
COC(=O)[C@@H]1CN(Cc2cc(C#N)cs2)C[C@H]1c1ccccc1	ZINC000343636573	164000567	/nfs/dbraw/zinc/00/05/67/164000567.db2.gz	IZXHYSZKGWOLDX-DLBZAZTESA-N	0	3	326.421	3.008	20	30		EGEDHN
CNC(=O)[C@@H](Cc1c[nH]c2ccccc12)N[C@H](C)c1ccc(C#N)cc1	ZINC000344092030	164101380	/nfs/dbraw/zinc/10/13/80/164101380.db2.gz	CPUHGUPWEQKWFU-JLTOFOAXSA-N	0	3	346.434	3.047	20	30		EGEDHN
CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(C#N)cc1	ZINC000346129358	164345245	/nfs/dbraw/zinc/34/52/45/164345245.db2.gz	XUBWLCMKAAKUKF-HXUWFJFHSA-N	0	3	335.451	3.445	20	30		EGEDHN
CC(C)(C)OCCCCN1CCN(Cc2ccc(C#N)cc2)CC1	ZINC000354874405	166053500	/nfs/dbraw/zinc/05/35/00/166053500.db2.gz	FIVFCXBHBMNHSQ-UHFFFAOYSA-N	0	3	329.488	3.271	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@@H](NCc3ccc(Cl)cc3)C2=O)cc1	ZINC000351916665	165148503	/nfs/dbraw/zinc/14/85/03/165148503.db2.gz	FOYRMYCRLQLVCD-GOSISDBHSA-N	0	3	339.826	3.497	20	30		EGEDHN
CCC1(CC)[C@H](N[C@@H](C)C(=O)Nc2cccc(C#N)c2)C[C@H]1OC	ZINC000359421337	167151058	/nfs/dbraw/zinc/15/10/58/167151058.db2.gz	KKBTTYSUWJXFHY-IAOVAPTHSA-N	0	3	329.444	3.069	20	30		EGEDHN
CC[C@@H](C)N[C@H](CNC(=O)CCc1ccc(C#N)cc1)c1ccco1	ZINC000359540566	167185904	/nfs/dbraw/zinc/18/59/04/167185904.db2.gz	CJIYGCKWGWZZSW-CRAIPNDOSA-N	0	3	339.439	3.329	20	30		EGEDHN
C[C@H](NCCN1C(=O)CCC1=O)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000359886987	167258640	/nfs/dbraw/zinc/25/86/40/167258640.db2.gz	UGTLCNOEAQRALT-HNNXBMFYSA-N	0	3	347.418	3.025	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C1CCN(CCc2ccccn2)CC1	ZINC000122360601	222071103	/nfs/dbraw/zinc/07/11/03/222071103.db2.gz	IPIZDYJMAPRFQK-UHFFFAOYSA-N	0	3	340.496	3.154	20	30		EGEDHN
Cc1ccc(SCCNC(=O)C(C#N)Cc2ccc(C#N)cc2)cc1	ZINC000279718821	269919122	/nfs/dbraw/zinc/91/91/22/269919122.db2.gz	MDPMVSCAWCIODJ-SFHVURJKSA-N	0	3	349.459	3.457	20	30		EGEDHN
CC[C@H](C)[C@H](CNCc1cn(C)nc1-c1ccc(C#N)cc1)OC	ZINC000294915656	270042378	/nfs/dbraw/zinc/04/23/78/270042378.db2.gz	YHYWDEBZADFEOG-KSSFIOAISA-N	0	3	326.444	3.109	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)c2ccc(C#N)s2)N(C)C)cc1	ZINC000486827476	270056341	/nfs/dbraw/zinc/05/63/41/270056341.db2.gz	SFAINOOUSRNRMP-INIZCTEOSA-N	0	3	327.453	3.215	20	30		EGEDHN
Cc1ccc([C@H]2C[C@H](C)N(CC(=O)NCc3cccc(C#N)c3)C2)cc1	ZINC000490101034	270056550	/nfs/dbraw/zinc/05/65/50/270056550.db2.gz	QSJVIUKNKNHCSA-UWJYYQICSA-N	0	3	347.462	3.361	20	30		EGEDHN
N#Cc1ccccc1OCCN1CCC(N2CCc3ccccc32)CC1	ZINC000503432754	270059006	/nfs/dbraw/zinc/05/90/06/270059006.db2.gz	OPFUKWGHMOATDJ-UHFFFAOYSA-N	0	3	347.462	3.464	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)c1cc(C#N)cs1)c1ccccc1	ZINC000176867528	266119867	/nfs/dbraw/zinc/11/98/67/266119867.db2.gz	SQFIENORTRFZJU-MRXNPFEDSA-N	0	3	327.453	3.433	20	30		EGEDHN
C[C@@H](C(=O)NCCSCc1ccccc1C#N)N1[C@H](C)CC[C@H]1C	ZINC000195526806	266186704	/nfs/dbraw/zinc/18/67/04/266186704.db2.gz	VGZYKYDZKDNPNE-OAGGEKHMSA-N	0	3	345.512	3.169	20	30		EGEDHN
CCOCCCN1CC[C@@H](Nc2nc(Cl)c(C#N)s2)[C@H](C)C1	ZINC000287263810	266274121	/nfs/dbraw/zinc/27/41/21/266274121.db2.gz	KWSZDWMHUTXQQZ-VXGBXAGGSA-N	0	3	342.896	3.217	20	30		EGEDHN
CCS[C@@H]1CCC[C@H]1N[C@H](C)C(=O)Nc1oc(C)c(C)c1C#N	ZINC000286013092	266346087	/nfs/dbraw/zinc/34/60/87/266346087.db2.gz	GYEBOVMFBBLANA-KCPJHIHWSA-N	0	3	335.473	3.359	20	30		EGEDHN
COC(=O)c1ccccc1OCCNC1(c2cccc(C#N)c2)CC1	ZINC000272935151	266944629	/nfs/dbraw/zinc/94/46/29/266944629.db2.gz	KKFFFIXNKWAQSG-UHFFFAOYSA-N	0	3	336.391	3.003	20	30		EGEDHN
C[C@@H](c1ccc(C#N)c(F)c1)N1CCC[C@H](CC(C)(C)C(N)=O)C1	ZINC000296259385	267000070	/nfs/dbraw/zinc/00/00/70/267000070.db2.gz	DEEKLWAGTJTKNX-UONOGXRCSA-N	0	3	331.435	3.372	20	30		EGEDHN
C[C@@H](c1ccncc1)N1CCC(NCc2ccc(C#N)cc2F)CC1	ZINC000269634820	267005527	/nfs/dbraw/zinc/00/55/27/267005527.db2.gz	VNWOVHKRILJGKJ-HNNXBMFYSA-N	0	3	338.430	3.408	20	30		EGEDHN
CCN(CC)[C@H](CNc1ccc(C#N)c(C)n1)c1cccc(OC)c1	ZINC000487938655	267061779	/nfs/dbraw/zinc/06/17/79/267061779.db2.gz	JPKLQFZEHLMCOL-LJQANCHMSA-N	0	3	338.455	3.187	20	30		EGEDHN
CCN(CCN1CCCCCC1)[C@H](C)C(=O)Nc1ccccc1C#N	ZINC000411735460	267064056	/nfs/dbraw/zinc/06/40/56/267064056.db2.gz	WKDUPQQLLOGZDD-QGZVFWFLSA-N	0	3	342.487	3.083	20	30		EGEDHN
C[C@@H]1Oc2cc(F)ccc2[C@@H]1NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000360325032	267101864	/nfs/dbraw/zinc/10/18/64/267101864.db2.gz	MNFGBUXIYQGUTL-IOHHAYIISA-N	0	3	349.365	3.018	20	30		EGEDHN
CCOC(=O)N1CCC([C@H](C)NCc2cccc(C#N)c2F)CC1	ZINC000495575429	267123028	/nfs/dbraw/zinc/12/30/28/267123028.db2.gz	RKXQTQHRZUNAIU-ZDUSSCGKSA-N	0	3	333.407	3.044	20	30		EGEDHN
CCO[C@@H]1CCCC[C@H]1N[C@H](C)C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000452036694	267146553	/nfs/dbraw/zinc/14/65/53/267146553.db2.gz	RXKFJNBCNHWKBW-CSMYWGQOSA-N	0	3	349.862	3.476	20	30		EGEDHN
C[C@H](CCc1ccc(O)cc1)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000350476203	267153060	/nfs/dbraw/zinc/15/30/60/267153060.db2.gz	JLCAFYXZFFQTFG-BEFAXECRSA-N	0	3	347.418	3.084	20	30		EGEDHN
C[C@H](CCc1ccco1)N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000272534754	267154057	/nfs/dbraw/zinc/15/40/57/267154057.db2.gz	JUJHXBIRBCDNOC-DNVCBOLYSA-N	0	3	337.423	3.258	20	30		EGEDHN
CCS(=O)(=O)Nc1ccc([C@@H](C)NCc2ccc(C#N)s2)cc1	ZINC000421885381	267178767	/nfs/dbraw/zinc/17/87/67/267178767.db2.gz	RKVRLVJBPITJFH-GFCCVEGCSA-N	0	3	349.481	3.232	20	30		EGEDHN
CC[C@H](CN[C@H]1CCc2ccc(C#N)cc21)NC(=O)OC(C)(C)C	ZINC000495925494	267212362	/nfs/dbraw/zinc/21/23/62/267212362.db2.gz	XYEWKSAWEJPVQR-WBVHZDCISA-N	0	3	329.444	3.438	20	30		EGEDHN
C[C@H]1CN(C(=O)C(C#N)Cc2ccc(C#N)cc2)Cc2ccccc2O1	ZINC000293962357	267225388	/nfs/dbraw/zinc/22/53/88/267225388.db2.gz	TYFSWVZBVOKFPO-KXBFYZLASA-N	0	3	345.402	3.050	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CC[C@H]1Nc1nccc(C#N)c1Cl	ZINC000398014155	267235254	/nfs/dbraw/zinc/23/52/54/267235254.db2.gz	FIVHHSGKHSFXAE-WMLDXEAASA-N	0	3	340.858	3.351	20	30		EGEDHN
C[C@]1(CCCO)CCCN1Cc1ccc(C#N)cc1Br	ZINC000272530974	267261257	/nfs/dbraw/zinc/26/12/57/267261257.db2.gz	MLVXXYVNUOKQIO-MRXNPFEDSA-N	0	3	337.261	3.448	20	30		EGEDHN
CN(C)CC(C)(C)NC(=O)c1cccc(Oc2ccc(C#N)cc2)c1	ZINC000457213822	267279492	/nfs/dbraw/zinc/27/94/92/267279492.db2.gz	VEONJLKYRKUNRY-UHFFFAOYSA-N	0	3	337.423	3.421	20	30		EGEDHN
CN(C)C[C@@H]1CCc2ccccc2N1C(=O)Cc1ccc(C#N)cc1	ZINC000425628092	267282726	/nfs/dbraw/zinc/28/27/26/267282726.db2.gz	PIQRLRBUUOJRFT-IBGZPJMESA-N	0	3	333.435	3.010	20	30		EGEDHN
CN(C)Cc1cccc(C(=O)N[C@@H]2CCCc3cc(C#N)ccc32)c1	ZINC000416339451	267283579	/nfs/dbraw/zinc/28/35/79/267283579.db2.gz	HHPWVOOHRRLBHV-HXUWFJFHSA-N	0	3	333.435	3.427	20	30		EGEDHN
CN(C)[C@]1(CNc2c(C#N)cnc3c(F)cc(F)cc32)CCSC1	ZINC000530882764	267290707	/nfs/dbraw/zinc/29/07/07/267290707.db2.gz	JSQOMLUAZORPPC-KRWDZBQOSA-N	0	3	348.422	3.234	20	30		EGEDHN
Cc1nc(N(C)CCC2CCN(c3ccncc3)CC2)ccc1C#N	ZINC000292094931	267605123	/nfs/dbraw/zinc/60/51/23/267605123.db2.gz	YWMDATNLSSGSLI-UHFFFAOYSA-N	0	3	335.455	3.400	20	30		EGEDHN
C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NCc1ccc(C#N)cc1F	ZINC000277740896	267857638	/nfs/dbraw/zinc/85/76/38/267857638.db2.gz	KDDUURGTFRYALG-SUMWQHHRSA-N	0	3	347.434	3.432	20	30		EGEDHN
Cc1cc(CNc2cccc(CN3CCN(C)CC3)c2)ccc1C#N	ZINC000443974406	268001543	/nfs/dbraw/zinc/00/15/43/268001543.db2.gz	UJFGOIUGVFEPSM-UHFFFAOYSA-N	0	3	334.467	3.226	20	30		EGEDHN
Cc1cc(NC(=O)Nc2cccc(C#N)c2)ccc1OCCN(C)C	ZINC000414399424	268010743	/nfs/dbraw/zinc/01/07/43/268010743.db2.gz	LIIIHLNPHPDQHA-UHFFFAOYSA-N	0	3	338.411	3.451	20	30		EGEDHN
COc1cccc([C@H](CNc2nc(Cl)c(C#N)s2)N(C)C)c1	ZINC000278471737	268020224	/nfs/dbraw/zinc/02/02/24/268020224.db2.gz	CYZMKWBEPODNNW-LBPRGKRZSA-N	0	3	336.848	3.392	20	30		EGEDHN
N#Cc1ccc(-c2nnc(CN[C@@H]3CCCC34CCOCC4)o2)cc1	ZINC000282209752	268028841	/nfs/dbraw/zinc/02/88/41/268028841.db2.gz	XVUZSSBIYJEFRJ-MRXNPFEDSA-N	0	3	338.411	3.047	20	30		EGEDHN
Cc1ccc(CCNC(=O)C(C#N)Cc2ccc(C#N)cc2)c(C)c1	ZINC000470831856	268035224	/nfs/dbraw/zinc/03/52/24/268035224.db2.gz	NLZAFDIYRJOAJT-HXUWFJFHSA-N	0	3	331.419	3.216	20	30		EGEDHN
Cc1n[nH]c(C)c1[C@@H]1CCCN1CCC(=O)Nc1cccc(C#N)c1	ZINC000411413851	268072143	/nfs/dbraw/zinc/07/21/43/268072143.db2.gz	ASWQYKPGEDVERM-KRWDZBQOSA-N	0	3	337.427	3.064	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(c3cccc(Br)c3)C2)o1	ZINC000278669224	268076544	/nfs/dbraw/zinc/07/65/44/268076544.db2.gz	HDBSQHHMHHLDOE-ZDUSSCGKSA-N	0	3	346.228	3.282	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N(Cc2ccccc2)C2CC2)cc1	ZINC000280323658	268083529	/nfs/dbraw/zinc/08/35/29/268083529.db2.gz	GWBOTVKLFQEBMN-IBGZPJMESA-N	0	3	329.403	3.432	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCC2(c3ccccc3)CC2)cc1	ZINC000279703373	268084788	/nfs/dbraw/zinc/08/47/88/268084788.db2.gz	JVRILMALRGMLQC-SFHVURJKSA-N	0	3	329.403	3.089	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@@H]2C[C@H]2c2ccc(F)cc2)cc1	ZINC000279875873	268086690	/nfs/dbraw/zinc/08/66/90/268086690.db2.gz	CFTZNEOVOKPFTR-YTQUADARSA-N	0	3	333.366	3.052	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CC[C@H](c3ccccc3F)C2)cc1	ZINC000280214662	268089730	/nfs/dbraw/zinc/08/97/30/268089730.db2.gz	AIIDTSBTZMMABR-ZWKOTPCHSA-N	0	3	347.393	3.396	20	30		EGEDHN
N#Cc1ccc(N(CCN2CCCC2)Cc2ccc(Cl)cc2)nn1	ZINC000301963856	268105361	/nfs/dbraw/zinc/10/53/61/268105361.db2.gz	NOKXFMZTCFNASJ-UHFFFAOYSA-N	0	3	341.846	3.104	20	30		EGEDHN
N#Cc1ccc(NC(=O)CN[C@@H]2CCCC23CCOCC3)cc1Cl	ZINC000282111970	268141406	/nfs/dbraw/zinc/14/14/06/268141406.db2.gz	QALIKPMLVKROLI-MRXNPFEDSA-N	0	3	347.846	3.089	20	30		EGEDHN
N#Cc1ccc(N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)nn1	ZINC000302001924	268163064	/nfs/dbraw/zinc/16/30/64/268163064.db2.gz	QTSSRDVEGATODV-OAHLLOKOSA-N	0	3	347.344	3.053	20	30		EGEDHN
N#Cc1ccc(CNC(=O)N2CCN(CC3CCCCC3)CC2)s1	ZINC000422221178	268227035	/nfs/dbraw/zinc/22/70/35/268227035.db2.gz	XLCILRNOMLIKAQ-UHFFFAOYSA-N	0	3	346.500	3.027	20	30		EGEDHN
N#Cc1cccc(C2(NC[C@@H](O)COc3cccc4[nH]ccc43)CC2)c1	ZINC000271792398	268241198	/nfs/dbraw/zinc/24/11/98/268241198.db2.gz	NNSSWDVVRIWUBM-QGZVFWFLSA-N	0	3	347.418	3.058	20	30		EGEDHN
N#Cc1cccc(CN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1	ZINC000299603031	268247867	/nfs/dbraw/zinc/24/78/67/268247867.db2.gz	GHVVGKYGWLNTNH-UHFFFAOYSA-N	0	3	344.418	3.281	20	30		EGEDHN
N#Cc1cccc([N+](=O)[O-])c1N1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1	ZINC000425280851	268293299	/nfs/dbraw/zinc/29/32/99/268293299.db2.gz	YJCOCDMKLGZOSG-PKOBYXMFSA-N	0	3	348.406	3.177	20	30		EGEDHN
N#Cc1nc(NCCCN2CCc3ccccc3C2)ccc1Cl	ZINC000301190986	268325227	/nfs/dbraw/zinc/32/52/27/268325227.db2.gz	YZYVQYJRPFJCJE-UHFFFAOYSA-N	0	3	326.831	3.467	20	30		EGEDHN
N#Cc1cccc(CNC(=O)N[C@H](CN2CCCC2)c2ccccc2)c1	ZINC000077789862	279533237	/nfs/dbraw/zinc/53/32/37/279533237.db2.gz	JCVQDIJHRSPWNA-HXUWFJFHSA-N	0	3	348.450	3.195	20	30		EGEDHN
C[C@@H](NCCN1CCN(c2ccccc2)CC1)c1ccc(C#N)cc1	ZINC000537296999	314172917	/nfs/dbraw/zinc/17/29/17/314172917.db2.gz	JHTMKSASUNTNSV-GOSISDBHSA-N	0	3	334.467	3.031	20	30		EGEDHN
C[C@@H](N[C@@H](C)c1cccc(C#N)c1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000537293997	314173052	/nfs/dbraw/zinc/17/30/52/314173052.db2.gz	POVZINNLPJRJBO-SVMVAKDDSA-N	0	3	349.478	3.498	20	30		EGEDHN
C[C@]1(NC[C@H](O)COc2ccc(C#N)cc2)CCCc2ccccc21	ZINC000537605236	314195234	/nfs/dbraw/zinc/19/52/34/314195234.db2.gz	LFMLBUYZLQFTQY-RXVVDRJESA-N	0	3	336.435	3.139	20	30		EGEDHN
COc1ccc([C@H](C)CN2CCN(Cc3ccc(C#N)cc3)CC2)cc1	ZINC000538308279	314239476	/nfs/dbraw/zinc/23/94/76/314239476.db2.gz	SVHKNJZBZABVHP-GOSISDBHSA-N	0	3	349.478	3.488	20	30		EGEDHN
CCc1ccc(C(C)(C)NCC(=O)NCc2cccc(C#N)c2)cc1	ZINC000540458685	314381758	/nfs/dbraw/zinc/38/17/58/314381758.db2.gz	JZCPVKPDTSGXMM-UHFFFAOYSA-N	0	3	335.451	3.262	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CNC2(c3ccc(Cl)cc3)CC2)cc1	ZINC000553338176	315258730	/nfs/dbraw/zinc/25/87/30/315258730.db2.gz	ZTHRXZFVQGHIAB-QGZVFWFLSA-N	0	3	342.826	3.230	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN1CCC[C@@H]1c1cccnc1	ZINC000553890161	315287201	/nfs/dbraw/zinc/28/72/01/315287201.db2.gz	HGWUNVVXFMVPCD-OAHLLOKOSA-N	0	3	326.425	3.180	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN[C@@H]2C[C@H]2c2cccc(Cl)c2)cc1	ZINC000564863428	316221640	/nfs/dbraw/zinc/22/16/40/316221640.db2.gz	GYPHMCWQCWQKGW-NZSAHSFTSA-N	0	3	342.826	3.097	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000570524960	317069396	/nfs/dbraw/zinc/06/93/96/317069396.db2.gz	COOAXVWRNKAMDM-SFHVURJKSA-N	0	3	349.434	3.418	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)Cc1cccc(F)c1F	ZINC000573726245	317522340	/nfs/dbraw/zinc/52/23/40/317522340.db2.gz	RQZOQZMBYXNOJY-UHFFFAOYSA-N	0	3	329.394	3.400	20	30		EGEDHN
CN(Cc1ccccc1)C1(CNC(=O)c2cccc(C#N)c2)CCC1	ZINC000386712087	324268691	/nfs/dbraw/zinc/26/86/91/324268691.db2.gz	XHLPINTUZFUIPW-UHFFFAOYSA-N	0	3	333.435	3.343	20	30		EGEDHN
CCN1CCC(N(C)c2cc(Br)c(C#N)cc2F)CC1	ZINC000312610381	456593673	/nfs/dbraw/zinc/59/36/73/456593673.db2.gz	OIEQYHZZWDJGEC-UHFFFAOYSA-N	0	3	340.240	3.380	20	30		EGEDHN
CN(C)CCN(Cc1ccsc1)C(=O)c1ccc(C#N)c(Cl)c1	ZINC000579805823	325161406	/nfs/dbraw/zinc/16/14/06/325161406.db2.gz	KMMCQFFJQHYGET-UHFFFAOYSA-N	0	3	347.871	3.477	20	30		EGEDHN
COc1ccc(CN(C)C)cc1NCc1ccc(C#N)c(OC)c1	ZINC000580151703	325208907	/nfs/dbraw/zinc/20/89/07/325208907.db2.gz	SJZFNQBFEYBKFI-UHFFFAOYSA-N	0	3	325.412	3.249	20	30		EGEDHN
CCc1cccc(CN[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)c1	ZINC000581015994	325321103	/nfs/dbraw/zinc/32/11/03/325321103.db2.gz	RJSMDGOGCZZVQV-HXUWFJFHSA-N	0	3	333.435	3.011	20	30		EGEDHN
CN(C)[C@@]1(CNc2cccc(Br)c2C#N)CCSC1	ZINC000357497121	457566052	/nfs/dbraw/zinc/56/60/52/457566052.db2.gz	ACMBYYHUDKYGBT-CQSZACIVSA-N	0	3	340.290	3.170	20	30		EGEDHN
CC(C)(C)C[C@@H]1CCN(CC(=O)N(CCC#N)CCC#N)C1(C)C	ZINC000412029023	458053623	/nfs/dbraw/zinc/05/36/23/458053623.db2.gz	CDUQLUYCNXOSEZ-INIZCTEOSA-N	0	3	332.492	3.179	20	30		EGEDHN
C=CCn1cc(CNC[C@@H](C)c2cccc(Br)c2)nn1	ZINC000424173311	458577169	/nfs/dbraw/zinc/57/71/69/458577169.db2.gz	PGZNJGMTOBCHTH-GFCCVEGCSA-N	0	3	335.249	3.120	20	30		EGEDHN
CCSc1cccc(CNC[C@@H](O)COc2ccccc2C#N)c1	ZINC000600739227	460585806	/nfs/dbraw/zinc/58/58/06/460585806.db2.gz	OPRBQUJYLUXUFD-QGZVFWFLSA-N	0	3	342.464	3.200	20	30		EGEDHN
CN(C)Cc1c2ccccc2oc1C(=O)N1CCC[C@@](C)(C#N)C1	ZINC000612366876	460606714	/nfs/dbraw/zinc/60/67/14/460606714.db2.gz	YJCNSFYHEQHPJC-IBGZPJMESA-N	0	3	325.412	3.260	20	30		EGEDHN
COc1ccc(CN(C)CCOc2ccc(C#N)cc2)cc1OC	ZINC000015298067	453566602	/nfs/dbraw/zinc/56/66/02/453566602.db2.gz	MUCVRVSPCXIHFC-UHFFFAOYSA-N	0	3	326.396	3.086	20	30		EGEDHN
CC[C@@H](NC[C@@H](O)COc1ccc(C#N)cc1)c1ccc(OC)cc1	ZINC000024590866	453739478	/nfs/dbraw/zinc/73/94/78/453739478.db2.gz	MDHVSUBUBBFZAD-YLJYHZDGSA-N	0	3	340.423	3.047	20	30		EGEDHN
CCCNC(=O)c1cccc(CN[C@H](C)CC2(C#N)CCOCC2)c1	ZINC000600848829	460620850	/nfs/dbraw/zinc/62/08/50/460620850.db2.gz	KICWGTWREFQWDT-MRXNPFEDSA-N	0	3	343.471	3.015	20	30		EGEDHN
C[C@@H](NC[C@H](O)COc1ccc(CC#N)cc1)c1ccc(Cl)cc1	ZINC000025867555	453788078	/nfs/dbraw/zinc/78/80/78/453788078.db2.gz	AMFBRMZMAJNPHG-KDOFPFPSSA-N	0	3	344.842	3.497	20	30		EGEDHN
CN(CCOc1ccc(F)cc1)CCC(=O)Nc1cccc(C#N)c1	ZINC000026336806	453797085	/nfs/dbraw/zinc/79/70/85/453797085.db2.gz	UNWYPUFDWYZGEF-UHFFFAOYSA-N	0	3	341.386	3.037	20	30		EGEDHN
N#Cc1ccc(CCC(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1	ZINC000029179092	453826994	/nfs/dbraw/zinc/82/69/94/453826994.db2.gz	LPXYJYCQEUPGRD-OAQYLSRUSA-N	0	3	347.462	3.444	20	30		EGEDHN
CN(C[C@H](O)COc1ccc(CC#N)cc1)[C@@H]1CCc2ccccc21	ZINC000029339448	453828294	/nfs/dbraw/zinc/82/82/94/453828294.db2.gz	FSPYLORDWVMIOP-GHTZIAJQSA-N	0	3	336.435	3.112	20	30		EGEDHN
N#CCC[C@H](C#N)CNCC1(c2cccc(Cl)c2)CCOCC1	ZINC000066483778	453848413	/nfs/dbraw/zinc/84/84/13/453848413.db2.gz	ZYVRTIBJMSPVSW-OAHLLOKOSA-N	0	3	331.847	3.421	20	30		EGEDHN
C[C@@H](c1cccs1)N(C)C[C@H](O)COc1ccc(CC#N)cc1	ZINC000053430040	453878670	/nfs/dbraw/zinc/87/86/70/453878670.db2.gz	LEEJJUHRURJSRH-HOCLYGCPSA-N	0	3	330.453	3.247	20	30		EGEDHN
C[C@@H](C(=O)N(C)CCC#N)N1CCC(CCc2ccccc2)CC1	ZINC000054148522	453913158	/nfs/dbraw/zinc/91/31/58/453913158.db2.gz	IECFQGPTIXWYFF-KRWDZBQOSA-N	0	3	327.472	3.092	20	30		EGEDHN
COCCN(Cc1ccc(C#N)cc1)C[C@@H](O)c1cccc(Cl)c1	ZINC000075674684	453916865	/nfs/dbraw/zinc/91/68/65/453916865.db2.gz	CQTXGPNFKBWMLN-LJQANCHMSA-N	0	3	344.842	3.394	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Nc1ccnn1C(C)C)C(C)C	ZINC000076031423	453951030	/nfs/dbraw/zinc/95/10/30/453951030.db2.gz	MWRJSTKZZUDLRO-INIZCTEOSA-N	0	3	333.480	3.284	20	30		EGEDHN
N#CCc1ccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000076085128	453960813	/nfs/dbraw/zinc/96/08/13/453960813.db2.gz	KLEUCSLOYRMZLU-LJQANCHMSA-N	0	3	334.423	3.149	20	30		EGEDHN
CN(C)[C@H](CNC(=O)Nc1ccc(CC#N)cc1)Cc1ccccc1	ZINC000076085167	453960835	/nfs/dbraw/zinc/96/08/35/453960835.db2.gz	OMOBVKVSCMKPEI-IBGZPJMESA-N	0	3	336.439	3.047	20	30		EGEDHN
N#CC(C(=O)c1cnn(Cc2ccccc2)c1)c1nc2ccccc2[nH]1	ZINC000041495948	453969250	/nfs/dbraw/zinc/96/92/50/453969250.db2.gz	DTESNJLCVPXSAZ-MRXNPFEDSA-N	0	3	341.374	3.298	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)c2ccc(NC(=O)C3CC3)cc2)n1	ZINC000041520846	453970303	/nfs/dbraw/zinc/97/03/03/453970303.db2.gz	CJTPBROKHYQLLV-AWEZNQCLSA-N	0	3	325.393	3.290	20	30		EGEDHN
N#CC(C(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(C(F)(F)F)cn1	ZINC000041555628	453971496	/nfs/dbraw/zinc/97/14/96/453971496.db2.gz	SNBKLHIWGPGVNH-GFCCVEGCSA-N	0	3	335.241	3.499	20	30		EGEDHN
COC(=O)c1ccc(C(=O)C(C#N)c2ccc(C(F)(F)F)cn2)cc1	ZINC000041556419	453971632	/nfs/dbraw/zinc/97/16/32/453971632.db2.gz	BYXQEZPKKRNQID-ZDUSSCGKSA-N	0	3	348.280	3.377	20	30		EGEDHN
C=CCNC(=O)[C@@H](C)NCC1(c2ccc(OC)cc2)CCCCC1	ZINC000067986209	453986263	/nfs/dbraw/zinc/98/62/63/453986263.db2.gz	GUJABCMVXHNJCR-MRXNPFEDSA-N	0	3	330.472	3.177	20	30		EGEDHN
N#CCc1cccc(C(=O)NC[C@H](c2cccs2)N2CCCC2)c1	ZINC000042378912	454008546	/nfs/dbraw/zinc/00/85/46/454008546.db2.gz	MAUZLFHFFYIAEN-QGZVFWFLSA-N	0	3	339.464	3.381	20	30		EGEDHN
CCN(Cc1cc(=O)n2cc(C)ccc2n1)[C@@H](C)c1ccc(C#N)cc1	ZINC000042741090	454022905	/nfs/dbraw/zinc/02/29/05/454022905.db2.gz	LXHSKPDALKVPDL-INIZCTEOSA-N	0	3	346.434	3.458	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN2CC[C@H](Nc3ccccc3)C2)c1	ZINC000076757188	454033830	/nfs/dbraw/zinc/03/38/30/454033830.db2.gz	HKRIYVDRGUIBDN-IBGZPJMESA-N	0	3	334.423	3.073	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2c[nH]nc2-c2cccc(Cl)c2)CC1	ZINC000087318080	454076968	/nfs/dbraw/zinc/07/69/68/454076968.db2.gz	VXDULYQWNZEAMQ-UHFFFAOYSA-N	0	3	344.846	3.110	20	30		EGEDHN
Cc1ccc(C#N)cc1NC(=O)N(CCN(C)C)Cc1ccccc1	ZINC000069607212	454123660	/nfs/dbraw/zinc/12/36/60/454123660.db2.gz	KQLUAPYEIQXYIQ-UHFFFAOYSA-N	0	3	336.439	3.462	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Cc1ccc(C)c(O)c1)C(C)C	ZINC000089435979	454149192	/nfs/dbraw/zinc/14/91/92/454149192.db2.gz	SFZMFXLLECKNGG-SFHVURJKSA-N	0	3	330.472	3.058	20	30		EGEDHN
N#Cc1ccc(Cl)cc1NC[C@H]1C[C@H](O)CN1Cc1ccccc1	ZINC000089644905	454173646	/nfs/dbraw/zinc/17/36/46/454173646.db2.gz	OSHKAZVEQCYVAP-MSOLQXFVSA-N	0	3	341.842	3.259	20	30		EGEDHN
CC(C)(C)OC(=O)NCC1CCN(Cc2ccc(C#N)cc2)CC1	ZINC000058279165	454177756	/nfs/dbraw/zinc/17/77/56/454177756.db2.gz	BXTHMKMPYUXPHT-UHFFFAOYSA-N	0	3	329.444	3.295	20	30		EGEDHN
Cc1ccc2nc(CN(Cc3ccc(C#N)cc3)C(C)C)cc(=O)n2c1	ZINC000058289252	454179601	/nfs/dbraw/zinc/17/96/01/454179601.db2.gz	GIWSITPHLVFMEL-UHFFFAOYSA-N	0	3	346.434	3.285	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H](C)CC(C)(C)c2ccccc2)CC1	ZINC000070884816	454181526	/nfs/dbraw/zinc/18/15/26/454181526.db2.gz	QREJTVQYARCGMQ-QGZVFWFLSA-N	0	3	326.484	3.204	20	30		EGEDHN
C=CCN(Cc1ccccc1)C[C@@H](O)COc1ccc(CC#N)cc1	ZINC000045821987	454185995	/nfs/dbraw/zinc/18/59/95/454185995.db2.gz	NZLBQWPRAINCFG-HXUWFJFHSA-N	0	3	336.435	3.181	20	30		EGEDHN
N#Cc1ccccc1N1CCCN(CCOc2ccc(F)cc2)CC1	ZINC000058580572	454218624	/nfs/dbraw/zinc/21/86/24/454218624.db2.gz	IMJXOSTVTXRIQN-UHFFFAOYSA-N	0	3	339.414	3.288	20	30		EGEDHN
CCCCN1CCCC[C@@H]1CNC(=O)c1c(F)cc(C#N)cc1F	ZINC000131402619	454251337	/nfs/dbraw/zinc/25/13/37/454251337.db2.gz	VNZCNWUJZNWIDY-CQSZACIVSA-N	0	3	335.398	3.221	20	30		EGEDHN
CC[C@H](c1ccccc1)[C@@H]1CCCN1CC(=O)N[C@@](C)(C#N)C1CC1	ZINC000120092299	454256956	/nfs/dbraw/zinc/25/69/56/454256956.db2.gz	DECMFDLUVBZDCK-DYXWJJEUSA-N	0	3	339.483	3.453	20	30		EGEDHN
N#Cc1cccc(CNCc2ccc(NC(=O)c3cccnc3)cc2)c1	ZINC000131489772	454258096	/nfs/dbraw/zinc/25/80/96/454258096.db2.gz	KLPHUTMMCQKIMJ-UHFFFAOYSA-N	0	3	342.402	3.495	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)CCC1	ZINC000191045048	455431984	/nfs/dbraw/zinc/43/19/84/455431984.db2.gz	ZPKXPBKINMYMQW-IRXDYDNUSA-N	0	3	334.504	3.081	20	30		EGEDHN
CCN(CCOc1ccccc1C#N)Cc1ccc(OC)c(OC)c1	ZINC000060466840	454292383	/nfs/dbraw/zinc/29/23/83/454292383.db2.gz	AQWQHZMATWPRFA-UHFFFAOYSA-N	0	3	340.423	3.476	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)CCc1ccccc1	ZINC000047010792	454318816	/nfs/dbraw/zinc/31/88/16/454318816.db2.gz	XNNLJTMCYWGRLB-UHFFFAOYSA-N	0	3	335.451	3.081	20	30		EGEDHN
C[C@H](C(=O)N(C)C1(C#N)CCC(C)CC1)N(C)CCC1CCOCC1	ZINC000120669604	454332811	/nfs/dbraw/zinc/33/28/11/454332811.db2.gz	ZJYIYSRZXREFNW-OHTSDLOESA-N	0	3	349.519	3.054	20	30		EGEDHN
C=C(C)COc1cccc(NC(=O)N2CC[C@H]3CC[C@@H](C2)N3C)c1	ZINC000072944243	454367606	/nfs/dbraw/zinc/36/76/06/454367606.db2.gz	GPGYXOUFOUDWGL-SJORKVTESA-N	0	3	329.444	3.342	20	30		EGEDHN
C[C@@H](c1ccc(F)cc1)N(C)C[C@H](O)COc1ccc(CC#N)cc1	ZINC000073022550	454383442	/nfs/dbraw/zinc/38/34/42/454383442.db2.gz	SOEWMZBSQXOARZ-KXBFYZLASA-N	0	3	342.414	3.324	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Cc1noc2ccccc12)C(C)C	ZINC000047633856	454392980	/nfs/dbraw/zinc/39/29/80/454392980.db2.gz	PARIRQXYCQGLOM-GOSISDBHSA-N	0	3	341.455	3.185	20	30		EGEDHN
C=CCN(C)CCC(=O)Nc1c(C#N)c(C)c(C)n1Cc1ccco1	ZINC000121177437	454402547	/nfs/dbraw/zinc/40/25/47/454402547.db2.gz	RDMKZOMHJLDUQD-UHFFFAOYSA-N	0	3	340.427	3.064	20	30		EGEDHN
C[C@@H](C(=O)N(CCC#N)c1ccc(F)cc1)N1C[C@H](C)C[C@@H](C)C1	ZINC000073601252	454455611	/nfs/dbraw/zinc/45/56/11/454455611.db2.gz	OBPDZLYQEOFRFK-OAGGEKHMSA-N	0	3	331.435	3.439	20	30		EGEDHN
N#Cc1ccc(OCCN2CCN(CC3CCCCC3)CC2)cc1	ZINC000064129799	454466876	/nfs/dbraw/zinc/46/68/76/454466876.db2.gz	HWBPQBHOSGVBQE-UHFFFAOYSA-N	0	3	327.472	3.135	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)n1	ZINC000121705551	454468047	/nfs/dbraw/zinc/46/80/47/454468047.db2.gz	JXWYACAMEQDVTB-VIFPVBQESA-N	0	3	336.760	3.259	20	30		EGEDHN
CC(C)(C)c1n[nH]cc1CN1CCCN(c2ccccc2C#N)CC1	ZINC000091792487	454471699	/nfs/dbraw/zinc/47/16/99/454471699.db2.gz	PLGXIKREYMSUMB-UHFFFAOYSA-N	0	3	337.471	3.291	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CCCN(CCCc2ccccc2)CC1	ZINC000101531514	454473365	/nfs/dbraw/zinc/47/33/65/454473365.db2.gz	ZJHWXMYJMPBBGV-LJQANCHMSA-N	0	3	344.499	3.135	20	30		EGEDHN
C=CCOc1ccc(CN2CCC[C@H](c3nc(C)no3)C2)cc1OC	ZINC000091832855	454478161	/nfs/dbraw/zinc/47/81/61/454478161.db2.gz	IIJOULKTFVOXNX-INIZCTEOSA-N	0	3	343.427	3.331	20	30		EGEDHN
C=CCOCCCC(=O)N[C@H](CN1CCCCC1)c1ccccc1	ZINC000079959021	454505915	/nfs/dbraw/zinc/50/59/15/454505915.db2.gz	YJAWXXNJEYQEJA-LJQANCHMSA-N	0	3	330.472	3.313	20	30		EGEDHN
C[C@H]1CN(Cc2ccc(CNCc3ccc(C#N)cc3)cc2)C[C@H](C)O1	ZINC000048710001	454509520	/nfs/dbraw/zinc/50/95/20/454509520.db2.gz	YVYMFYUFTIMUJE-ROUUACIJSA-N	0	3	349.478	3.457	20	30		EGEDHN
CCCc1c(C(=O)C(C#N)c2nc(C)cs2)[nH]c(C)c1C(=O)OC	ZINC000048789511	454516118	/nfs/dbraw/zinc/51/61/18/454516118.db2.gz	VMOVAZNCJBJRFQ-LBPRGKRZSA-N	0	3	345.424	3.317	20	30		EGEDHN
CCN(CC)[C@@H](C/N=C/c1ccc(O)c(O)c1O)c1ccsc1	ZINC000122565641	454548459	/nfs/dbraw/zinc/54/84/59/454548459.db2.gz	AEAGUZCAPORYKG-RMNBPEERSA-N	0	3	334.441	3.367	20	30		EGEDHN
CC(C)c1cc(C(=O)C(C#N)c2ccc(C(F)(F)F)cn2)n(C)n1	ZINC000080252849	454556970	/nfs/dbraw/zinc/55/69/70/454556970.db2.gz	RJYVFRBEHNSVPT-NSHDSACASA-N	0	3	336.317	3.447	20	30		EGEDHN
C[C@H](CC(=O)C(C#N)C(=O)Nc1ccccn1)c1ccc(F)cc1	ZINC000103717471	454564860	/nfs/dbraw/zinc/56/48/60/454564860.db2.gz	PNMKKOHWQDTUTQ-DOMZBBRYSA-N	0	3	325.343	3.062	20	30		EGEDHN
N#CC(C(=O)C=Cc1ccc(Cl)cc1)C(=O)Nc1ccccn1	ZINC000104055971	454574219	/nfs/dbraw/zinc/57/42/19/454574219.db2.gz	AXRVNIRPJJZWDQ-VIIAAUOXSA-N	0	3	325.755	3.096	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC=C(c3cccc(C)c3)CC2)CC1	ZINC000092497596	454575292	/nfs/dbraw/zinc/57/52/92/454575292.db2.gz	OCOQPOQISVITBV-UHFFFAOYSA-N	0	3	339.483	3.444	20	30		EGEDHN
N#Cc1cccc(OC2CCN(CCCOCC(F)(F)F)CC2)c1	ZINC000104716244	454598625	/nfs/dbraw/zinc/59/86/25/454598625.db2.gz	WGTPAFSWAQBEMA-UHFFFAOYSA-N	0	3	342.361	3.370	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)CCc2ccc(C#N)cc2)CN1Cc1ccccc1	ZINC000134887944	454603329	/nfs/dbraw/zinc/60/33/29/454603329.db2.gz	LSDSLNAZGJFORA-LAUBAEHRSA-N	0	3	347.462	3.270	20	30		EGEDHN
CC(=O)NC1CCN(Cc2ccc(-c3ccccc3C#N)cc2)CC1	ZINC000050991252	454604103	/nfs/dbraw/zinc/60/41/03/454604103.db2.gz	HRPXHTBFCQQEQN-UHFFFAOYSA-N	0	3	333.435	3.326	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)CN1CCC[C@@H]1CCc1ccccc1	ZINC000052105971	454654341	/nfs/dbraw/zinc/65/43/41/454654341.db2.gz	WBNGMIYFYUUQTI-QUCCMNQESA-N	0	3	327.472	3.138	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCCc2ccc(OC)cc2)CC1	ZINC000106035649	454674958	/nfs/dbraw/zinc/67/49/58/454674958.db2.gz	FYWMFEQGLGFJRX-UHFFFAOYSA-N	0	3	330.472	3.175	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Cc2ccccc2C(F)(F)F)CC1	ZINC000106035107	454675067	/nfs/dbraw/zinc/67/50/67/454675067.db2.gz	FRKQMHGCPNQXIQ-UHFFFAOYSA-N	0	3	340.389	3.405	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CSc2nc3ccccc3o2)CC1	ZINC000106037917	454676145	/nfs/dbraw/zinc/67/61/45/454676145.db2.gz	JGZIMJOYDUAGMG-UHFFFAOYSA-N	0	3	345.468	3.077	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CSCc2cccc(C)c2)CC1	ZINC000106040799	454676176	/nfs/dbraw/zinc/67/61/76/454676176.db2.gz	UTPLTVSSBVFFTM-UHFFFAOYSA-N	0	3	332.513	3.385	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCOc2ccc(C)c(C)c2)CC1	ZINC000106040806	454676189	/nfs/dbraw/zinc/67/61/89/454676189.db2.gz	PMNXFUWGSXKWMK-UHFFFAOYSA-N	0	3	330.472	3.229	20	30		EGEDHN
COC[C@H]1CCCN(CC#Cc2ccc(OC(F)(F)F)cc2)C1	ZINC000152632194	454703383	/nfs/dbraw/zinc/70/33/83/454703383.db2.gz	PUNKMMXJVWGEKR-HNNXBMFYSA-N	0	3	327.346	3.295	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC[C@H](CC)Oc2ccccc2C)CC1	ZINC000176159226	454706442	/nfs/dbraw/zinc/70/64/42/454706442.db2.gz	DJZQQZXCMMNXDS-SFHVURJKSA-N	0	3	345.487	3.102	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NCC1CCN(Cc2ccc(C)cc2)CC1	ZINC000106829194	454721592	/nfs/dbraw/zinc/72/15/92/454721592.db2.gz	UJSRPGJOBDCHFD-SFHVURJKSA-N	0	3	344.499	3.304	20	30		EGEDHN
Cc1cc(C#N)ccc1Oc1ccc(C(=O)NCCN2CCCC2)cc1	ZINC000176337602	454732421	/nfs/dbraw/zinc/73/24/21/454732421.db2.gz	QLYRKLJFBWLIIL-UHFFFAOYSA-N	0	3	349.434	3.485	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NCC1CCN(Cc2ccccc2F)CC1	ZINC000107267266	454748598	/nfs/dbraw/zinc/74/85/98/454748598.db2.gz	VYRLMVZRSGFUSD-MRXNPFEDSA-N	0	3	348.462	3.135	20	30		EGEDHN
C=CCOc1cccc(NC(=O)N2CCC(N3CC=CC3)CC2)c1	ZINC000136787788	454756590	/nfs/dbraw/zinc/75/65/90/454756590.db2.gz	GMWUGPWRSWTSND-UHFFFAOYSA-N	0	3	327.428	3.120	20	30		EGEDHN
CC(C(=O)N(CCN(C)C)Cc1cccc(C#N)c1)=C1CCCC1	ZINC000176588855	454761503	/nfs/dbraw/zinc/76/15/03/454761503.db2.gz	HVROYLBZXJKPNF-UHFFFAOYSA-N	0	3	325.456	3.339	20	30		EGEDHN
Cc1cccc([C@@H]2CCCN2CCC(=O)Nc2ccccc2C#N)n1	ZINC000140301165	454818852	/nfs/dbraw/zinc/81/88/52/454818852.db2.gz	QLRBOUNYAZLDAC-IBGZPJMESA-N	0	3	334.423	3.427	20	30		EGEDHN
C[C@@H]1CN(C[C@H](O)COc2ccc(CC#N)cc2)[C@@H]1c1ccccc1	ZINC000177073621	454819963	/nfs/dbraw/zinc/81/99/63/454819963.db2.gz	UGHWGKNRVUZVSU-PBEJRMEISA-N	0	3	336.435	3.185	20	30		EGEDHN
CC(C)(CCc1ccccc1)NCC(=O)NC1(C#N)CCCCC1	ZINC000177185208	454834177	/nfs/dbraw/zinc/83/41/77/454834177.db2.gz	AAPFYVLILSNKLO-UHFFFAOYSA-N	0	3	327.472	3.330	20	30		EGEDHN
C=CC1CCN([C@@H](C)C(=O)NCCc2c[nH]c3ccccc23)CC1	ZINC000111259542	454859873	/nfs/dbraw/zinc/85/98/73/454859873.db2.gz	ZGADBDYHLKOKEO-HNNXBMFYSA-N	0	3	325.456	3.113	20	30		EGEDHN
CCN(CCc1ccccc1)[C@@H](C)C(=O)NC1(C#N)CCCCC1	ZINC000154075593	454863187	/nfs/dbraw/zinc/86/31/87/454863187.db2.gz	XIRGTSPZSKWGID-KRWDZBQOSA-N	0	3	327.472	3.282	20	30		EGEDHN
C[C@H](C(=O)N(CCC#N)c1ccccc1)N1C[C@@H]2CCCC[C@@H]2C1	ZINC000177534303	454874197	/nfs/dbraw/zinc/87/41/97/454874197.db2.gz	GHGPCQSJTAHTNT-KURKYZTESA-N	0	3	325.456	3.444	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)C(=O)NC[C@@H]1CCCCN1CC	ZINC000111883748	454877527	/nfs/dbraw/zinc/87/75/27/454877527.db2.gz	FLRSOFCFOHFHAO-SFHVURJKSA-N	0	3	345.487	3.267	20	30		EGEDHN
COc1cccc(OCCN2CCN(CCCC(C)(C)C#N)CC2)c1	ZINC000164492621	454883286	/nfs/dbraw/zinc/88/32/86/454883286.db2.gz	LPTPBNXYUGWKES-UHFFFAOYSA-N	0	3	345.487	3.022	20	30		EGEDHN
CN(CCC#N)c1ccc(CNCCC(=O)Nc2ccccc2)cc1	ZINC000113346403	454924125	/nfs/dbraw/zinc/92/41/25/454924125.db2.gz	OZQGUSKVDOMQMF-UHFFFAOYSA-N	0	3	336.439	3.155	20	30		EGEDHN
C=CCc1cc(CNC[C@](C)(O)c2ccccc2)cc(OC)c1O	ZINC000114508666	454958817	/nfs/dbraw/zinc/95/88/17/454958817.db2.gz	IZLLCBANYBJGBM-FQEVSTJZSA-N	0	3	327.424	3.127	20	30		EGEDHN
CC(C)(NCCOc1ccc(C#N)cc1)C(=O)NCC1CCCCC1	ZINC000155311988	454985973	/nfs/dbraw/zinc/98/59/73/454985973.db2.gz	DKGALQIULQVOOS-UHFFFAOYSA-N	0	3	343.471	3.002	20	30		EGEDHN
CN(CCc1ccccn1)Cc1cn(C)nc1-c1ccc(C#N)cc1	ZINC000182368922	455499045	/nfs/dbraw/zinc/49/90/45/455499045.db2.gz	XMBCVBQJXGOTCB-UHFFFAOYSA-N	0	3	331.423	3.028	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000155412172	454999103	/nfs/dbraw/zinc/99/91/03/454999103.db2.gz	FYCIOAZZNMFEBY-QGZVFWFLSA-N	0	3	346.471	3.471	20	30		EGEDHN
C=CCN1CCC(NC(=O)Cc2cccc3ccc(OC)cc32)CC1	ZINC000179248260	455024872	/nfs/dbraw/zinc/02/48/72/455024872.db2.gz	RENYBLRYFKOBDI-UHFFFAOYSA-N	0	3	338.451	3.158	20	30		EGEDHN
C[C@@H](CNC(=O)Nc1cc(C#N)cn1C(C)(C)C)N1CCC[C@H](C)C1	ZINC000171146863	455036930	/nfs/dbraw/zinc/03/69/30/455036930.db2.gz	VVTVVHJWEGERMD-GJZGRUSLSA-N	0	3	345.491	3.357	20	30		EGEDHN
C[C@H](C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1)c1ccsc1	ZINC000152091502	455071251	/nfs/dbraw/zinc/07/12/51/455071251.db2.gz	QKCRTQXDERQTRH-HNNXBMFYSA-N	0	3	341.480	3.314	20	30		EGEDHN
CCCCNC(=O)[C@H]1CC[C@H](C)N(CC#Cc2ccc(F)cc2)C1	ZINC000156357818	455108915	/nfs/dbraw/zinc/10/89/15/455108915.db2.gz	WESXCWKXEJHAEL-WMZOPIPTSA-N	0	3	330.447	3.194	20	30		EGEDHN
CCCCNC(=O)[C@H]1CC[C@@H](C)N(CC#Cc2ccc(F)cc2)C1	ZINC000156358061	455109435	/nfs/dbraw/zinc/10/94/35/455109435.db2.gz	WESXCWKXEJHAEL-AEFFLSMTSA-N	0	3	330.447	3.194	20	30		EGEDHN
C[C@H](O)c1ccc(CNCc2cn(C)nc2-c2ccc(C#N)cc2)cc1	ZINC000180119778	455135680	/nfs/dbraw/zinc/13/56/80/455135680.db2.gz	JWOPAGALYSEICF-HNNXBMFYSA-N	0	3	346.434	3.302	20	30		EGEDHN
CC[C@@H]1CN(Cc2cn(C)nc2-c2ccc(C#N)cc2)CCS1	ZINC000180172313	455144573	/nfs/dbraw/zinc/14/45/73/455144573.db2.gz	PPOXIQBLCNOZHT-QGZVFWFLSA-N	0	3	326.469	3.286	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H]2CCC[C@@H]2Cc2ccccc2)CC1	ZINC000172384101	455150394	/nfs/dbraw/zinc/15/03/94/455150394.db2.gz	IROADYXAFMMBQV-UYAOXDASSA-N	0	3	341.499	3.347	20	30		EGEDHN
N#CCCN(Cc1ccco1)C(=O)c1ccc(CN2CCCC2)cc1	ZINC000264125249	455192370	/nfs/dbraw/zinc/19/23/70/455192370.db2.gz	CMEOIUJLFATWNU-UHFFFAOYSA-N	0	3	337.423	3.431	20	30		EGEDHN
C[C@H](CC(=O)Nc1ccc(F)cc1)NCc1ccc(OCC#N)cc1	ZINC000180556036	455195984	/nfs/dbraw/zinc/19/59/84/455195984.db2.gz	UWIWJIZEIQMPTF-CQSZACIVSA-N	0	3	341.386	3.235	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(CCOC)[C@@H](C)c2ccccc2)CC1	ZINC000264375218	455201089	/nfs/dbraw/zinc/20/10/89/455201089.db2.gz	SIFIFJDLWHCBTI-KRWDZBQOSA-N	0	3	345.487	3.056	20	30		EGEDHN
N#Cc1ccc(F)c(CN2CCC(CCCN3CCOCC3)CC2)c1	ZINC000182976459	455203031	/nfs/dbraw/zinc/20/30/31/455203031.db2.gz	BJLXDZKOJWUNOA-UHFFFAOYSA-N	0	3	345.462	3.022	20	30		EGEDHN
CN(C)[C@H](CNc1ccc([N+](=O)[O-])c(C#N)c1)c1cccc(F)c1	ZINC000157544316	455205622	/nfs/dbraw/zinc/20/56/22/455205622.db2.gz	BYZRWPQLWDPNNI-QGZVFWFLSA-N	0	3	328.347	3.320	20	30		EGEDHN
C[C@@H](NCCNC(=O)C1N=CC=CC1=O)c1ccc(C(C)(C)C)cc1	ZINC000173415188	455279854	/nfs/dbraw/zinc/27/98/54/455279854.db2.gz	WESOIRNLFAAZEZ-ORIGZDJFSA-N	0	3	341.455	3.161	20	30		EGEDHN
C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000245912875	455397124	/nfs/dbraw/zinc/39/71/24/455397124.db2.gz	DUPRUFSMFQFBQG-AOIWGVFYSA-N	0	3	342.487	3.451	20	30		EGEDHN
CC(C)(C#N)CCCN1CCN(c2ncnc3sccc32)CC1	ZINC000174815641	455415309	/nfs/dbraw/zinc/41/53/09/455415309.db2.gz	SGZYXDTZNFUYEN-UHFFFAOYSA-N	0	3	329.473	3.143	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2Cc3ccccc3C[C@@H]2CC)CC1	ZINC000184868856	455463787	/nfs/dbraw/zinc/46/37/87/455463787.db2.gz	AVHQKMJETRVNLK-IBGZPJMESA-N	0	3	327.472	3.183	20	30		EGEDHN
C=CCN(Cc1ccccc1F)C(=O)N[C@@H]1C[C@H](C)N(C2CC2)C1	ZINC000175612311	455471153	/nfs/dbraw/zinc/47/11/53/455471153.db2.gz	VEYPTFKGCZGIEA-GOEBONIOSA-N	0	3	331.435	3.149	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC[C@@H](Cc3ccccc3)[C@H]2C)CC1	ZINC000266916843	455474661	/nfs/dbraw/zinc/47/46/61/455474661.db2.gz	BDXNUCVYERLMBX-MJGOQNOKSA-N	0	3	341.499	3.300	20	30		EGEDHN
CCN(C[C@@H](O)COc1ccc(C#N)cc1)[C@H](C)c1cccc(O)c1	ZINC000266921532	455475214	/nfs/dbraw/zinc/47/52/14/455475214.db2.gz	MEJCUXKACUMAJP-DNVCBOLYSA-N	0	3	340.423	3.087	20	30		EGEDHN
N#CCSc1cccc(C(=O)N2CCC[C@@H]2CN2CCCCC2)c1	ZINC000176041412	455532265	/nfs/dbraw/zinc/53/22/65/455532265.db2.gz	UMKIVVNNFVUUNV-QGZVFWFLSA-N	0	3	343.496	3.393	20	30		EGEDHN
Cc1ccc[n+](C(C(=O)c2ccc(F)c(C)c2)C(=S)[N-]C2CC2)c1	ZINC000267325524	455539346	/nfs/dbraw/zinc/53/93/46/455539346.db2.gz	DRWQYBXRPTVUKI-UHFFFAOYSA-O	0	3	343.447	3.421	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN[C@H]2CCO[C@@H]2c2ccc(Cl)cc2)cc1	ZINC000192041488	455547733	/nfs/dbraw/zinc/54/77/33/455547733.db2.gz	WPDLKPQFHHCBSP-IPMKNSEASA-N	0	3	342.826	3.365	20	30		EGEDHN
COc1cc(C#N)ccc1CN[C@@H]1CCO[C@@H]1c1ccc(F)c(F)c1	ZINC000192131749	455561608	/nfs/dbraw/zinc/56/16/08/455561608.db2.gz	PWCWQWGTFPJVTJ-IEBWSBKVSA-N	0	3	344.361	3.465	20	30		EGEDHN
C=CCN(Cc1ccccc1F)C(=O)N[C@H]1CN(C2CC2)C[C@@H]1C	ZINC000268116770	455594376	/nfs/dbraw/zinc/59/43/76/455594376.db2.gz	DWYNJFAQBSCTQA-KSSFIOAISA-N	0	3	331.435	3.006	20	30		EGEDHN
C=CCN(Cc1ccccc1F)C(=O)N[C@@H]1CN(C2CC2)C[C@H]1C	ZINC000268116774	455594456	/nfs/dbraw/zinc/59/44/56/455594456.db2.gz	DWYNJFAQBSCTQA-RDTXWAMCSA-N	0	3	331.435	3.006	20	30		EGEDHN
N#Cc1csc(CNC[C@H]2CN(Cc3ccccc3)CCCO2)c1	ZINC000192357606	455597580	/nfs/dbraw/zinc/59/75/80/455597580.db2.gz	SYWOZOWDGZJZQH-SFHVURJKSA-N	0	3	341.480	3.000	20	30		EGEDHN
CCC[C@@H](N[C@@H]1CCC[C@H](C#N)C1)C(=O)N1CCc2sccc2C1	ZINC000185810599	455626975	/nfs/dbraw/zinc/62/69/75/455626975.db2.gz	FKWLEUNNHXKCFP-USXIJHARSA-N	0	3	345.512	3.473	20	30		EGEDHN
C=CCN(C(=O)NC1CCN(Cc2ccccc2C)CC1)C1CC1	ZINC000271486035	455655695	/nfs/dbraw/zinc/65/56/95/455655695.db2.gz	TYOJXUOTNWWDSN-UHFFFAOYSA-N	0	3	327.472	3.319	20	30		EGEDHN
CCN(CCC#N)C(=O)CN[C@H](C)C1(c2ccccc2)CCCC1	ZINC000185949325	455659999	/nfs/dbraw/zinc/65/99/99/455659999.db2.gz	DKJWRQCUIPVEDI-QGZVFWFLSA-N	0	3	327.472	3.239	20	30		EGEDHN
C=CCn1c(=O)c2ccsc2nc1SCCN1CCCCC1	ZINC000248004682	455669117	/nfs/dbraw/zinc/66/91/17/455669117.db2.gz	PCYKESQAPGUENH-UHFFFAOYSA-N	0	3	335.498	3.222	20	30		EGEDHN
N#C[C@@H]1CC[C@H]([NH+]2CCC(C(=O)Nc3cc(Cl)ccc3[O-])CC2)C1	ZINC000292668541	455727160	/nfs/dbraw/zinc/72/71/60/455727160.db2.gz	AYIIBXIQSBVYFL-DOMZBBRYSA-N	0	3	347.846	3.388	20	30		EGEDHN
CC(C)C[C@@H]1OCCC[C@H]1NCC(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000186386565	455758001	/nfs/dbraw/zinc/75/80/01/455758001.db2.gz	GHXIJMFXDAFPQH-SJORKVTESA-N	0	3	349.862	3.333	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1csc([N+](=O)[O-])c1)C(C)C	ZINC000193467553	455759857	/nfs/dbraw/zinc/75/98/57/455759857.db2.gz	APIFTHMFMIPYFI-AWEZNQCLSA-N	0	3	337.445	3.085	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1csc([N+](=O)[O-])c1)C(C)C	ZINC000193467541	455760538	/nfs/dbraw/zinc/76/05/38/455760538.db2.gz	APIFTHMFMIPYFI-CQSZACIVSA-N	0	3	337.445	3.085	20	30		EGEDHN
Cn1c2ccccc2nc1C(C)(C)NCCOc1ccc(C#N)cc1	ZINC000186573131	455797491	/nfs/dbraw/zinc/79/74/91/455797491.db2.gz	NECBAJRIKFKUNL-UHFFFAOYSA-N	0	3	334.423	3.349	20	30		EGEDHN
CC[C@H](NC[C@H](O)CN1CCc2ccccc2C1)c1ccc(C#N)cc1	ZINC000278281623	455804835	/nfs/dbraw/zinc/80/48/35/455804835.db2.gz	QCRMQZYSWMSVIX-VXKWHMMOSA-N	0	3	349.478	3.018	20	30		EGEDHN
Cc1csc(C(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)c1	ZINC000294265760	455809512	/nfs/dbraw/zinc/80/95/12/455809512.db2.gz	AOQVZMLYQUCRQI-UHFFFAOYSA-N	0	3	327.453	3.132	20	30		EGEDHN
COc1ccc2c(c1)OC[C@H](N[C@@H](C)c1ccc(C#N)c(F)c1)C2	ZINC000271977217	455810300	/nfs/dbraw/zinc/81/03/00/455810300.db2.gz	VVXAIJMFWCOPBW-BLLLJJGKSA-N	0	3	326.371	3.360	20	30		EGEDHN
COC(=O)COc1cccc(CN[C@@H](C)c2ccc(C#N)c(F)c2)c1	ZINC000271992209	455814840	/nfs/dbraw/zinc/81/48/40/455814840.db2.gz	ZOFGXZGTPIOTRX-ZDUSSCGKSA-N	0	3	342.370	3.100	20	30		EGEDHN
C=CCOCCN1CCC2(C[C@@H]2N(Cc2ccsc2)C(C)=O)CC1	ZINC000294770250	455826116	/nfs/dbraw/zinc/82/61/16/455826116.db2.gz	ZDOAWVLEDVCJFD-SFHVURJKSA-N	0	3	348.512	3.154	20	30		EGEDHN
CO[C@@H]1CCN(Cc2cn(C)nc2-c2ccc(C#N)cc2)CC1(C)C	ZINC000294925837	455832261	/nfs/dbraw/zinc/83/22/61/455832261.db2.gz	FWNQQOOPJXDGRX-GOSISDBHSA-N	0	3	338.455	3.206	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1C(=O)NCC1CCN(Cc2cccs2)CC1	ZINC000278396461	455835178	/nfs/dbraw/zinc/83/51/78/455835178.db2.gz	BBTNIAHWIZBFEP-QZTJIDSGSA-N	0	3	348.512	3.058	20	30		EGEDHN
CC[C@H](NC[C@@H](O)c1cc(OC)cc(OC)c1)c1ccc(C#N)cc1	ZINC000278668013	455844314	/nfs/dbraw/zinc/84/43/14/455844314.db2.gz	JBGBIELILPRZTP-VQTJNVASSA-N	0	3	340.423	3.350	20	30		EGEDHN
CN1CCN(Cc2cccc(NCc3ccc(C#N)cc3F)c2)CC1	ZINC000269446511	455848113	/nfs/dbraw/zinc/84/81/13/455848113.db2.gz	USWLDLBLHJDODD-UHFFFAOYSA-N	0	3	338.430	3.057	20	30		EGEDHN
COc1ccc(CN[C@H](CO)CC(C)(C)C)cc1OCCCC#N	ZINC000269511837	455849473	/nfs/dbraw/zinc/84/94/73/455849473.db2.gz	OUTSGDGXJZWWLB-INIZCTEOSA-N	0	3	334.460	3.264	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N2CCN(C3CCC3)C[C@H](C)C2)cc1	ZINC000295557230	455853272	/nfs/dbraw/zinc/85/32/72/455853272.db2.gz	ZGGPOCRXOVGIPR-KRWDZBQOSA-N	0	3	340.467	3.035	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N(CC)Cc1ccc(CN(C)C)cc1)OCC	ZINC000270047550	455865617	/nfs/dbraw/zinc/86/56/17/455865617.db2.gz	LOYSZSCLDKEYIN-LJQANCHMSA-N	0	3	332.488	3.468	20	30		EGEDHN
C=CCSCCNC(=O)N[C@H](CN1CCCC1)c1ccccc1	ZINC000194628037	455866137	/nfs/dbraw/zinc/86/61/37/455866137.db2.gz	FKGYUNJFEHHKNZ-QGZVFWFLSA-N	0	3	333.501	3.042	20	30		EGEDHN
Cc1oc(NC(=O)[C@H](C)N[C@@H]2C[C@@H](OC(C)C)C2(C)C)c(C#N)c1C	ZINC000296047512	455867794	/nfs/dbraw/zinc/86/77/94/455867794.db2.gz	FNRGNTKENVESRF-APHBMKBZSA-N	0	3	347.459	3.277	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NC1CCN([C@H](C)c2ccncc2)CC1)OCC	ZINC000270166868	455892934	/nfs/dbraw/zinc/89/29/34/455892934.db2.gz	BSCHACROSRNBRE-APWZRJJASA-N	0	3	345.487	3.095	20	30		EGEDHN
C[C@H](CNC(=O)c1ccc(C(C)(C)C#N)cc1)N1CCC[C@H](C)C1	ZINC000280124764	455898034	/nfs/dbraw/zinc/89/80/34/455898034.db2.gz	CTCVOIOCOFTMIB-JKSUJKDBSA-N	0	3	327.472	3.338	20	30		EGEDHN
CN(C)CCN(CC1CCCCC1)C(=O)c1ccc(CC#N)cc1	ZINC000270260567	455914940	/nfs/dbraw/zinc/91/49/40/455914940.db2.gz	ICPLZWRHIJHGKX-UHFFFAOYSA-N	0	3	327.472	3.337	20	30		EGEDHN
C=C(C)COc1cc(CN(C)CCOCCCOC)ccc1OC	ZINC000272329730	455915221	/nfs/dbraw/zinc/91/52/21/455915221.db2.gz	DFVOCHZRQCJBLI-UHFFFAOYSA-N	0	3	337.460	3.135	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1C[C@H]2CCCN2Cc2ccccc21)OCC	ZINC000270372850	455941162	/nfs/dbraw/zinc/94/11/62/455941162.db2.gz	ULTUPLRVOWGVBP-IEBWSBKVSA-N	0	3	328.456	3.369	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@@H]1CNCc1c(C)nn(-c2ccccn2)c1Cl	ZINC000285932089	455944997	/nfs/dbraw/zinc/94/49/97/455944997.db2.gz	LUHARMLSYPNHRZ-RHSMWYFYSA-N	0	3	346.862	3.300	20	30		EGEDHN
C[C@@H](O)[C@@H]1CCN(Cc2cccc(OCc3cccc(C#N)c3)c2)C1	ZINC000272470350	455960745	/nfs/dbraw/zinc/96/07/45/455960745.db2.gz	AEUBJMVHIULWLC-OXQOHEQNSA-N	0	3	336.435	3.340	20	30		EGEDHN
CCOC[C@H](NCC(=O)N(CCC#N)c1cccc(C)c1C)C(C)C	ZINC000286086057	455974785	/nfs/dbraw/zinc/97/47/85/455974785.db2.gz	KISPMPRODQILPU-SFHVURJKSA-N	0	3	345.487	3.201	20	30		EGEDHN
C=CCC[C@@H](NCc1ccnc(OCCN(C)C)c1)c1ccco1	ZINC000286166303	455991962	/nfs/dbraw/zinc/99/19/62/455991962.db2.gz	PPDQNOMWWXTVPO-QGZVFWFLSA-N	0	3	329.444	3.412	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](C)c2cc3ccccc3o2)CC1	ZINC000188092820	455995367	/nfs/dbraw/zinc/99/53/67/455995367.db2.gz	ZMGYGSWLNZVUHM-CQSZACIVSA-N	0	3	327.428	3.443	20	30		EGEDHN
C[C@@H]1C[C@H](c2ccccc2)[C@H](C)N1CC(=O)N[C@](C)(C#N)C1CC1	ZINC000296660049	456003809	/nfs/dbraw/zinc/00/38/09/456003809.db2.gz	JVQTUTDWHPSLMD-HCCHORAYSA-N	0	3	325.456	3.061	20	30		EGEDHN
CC(C)(C#N)c1ccc(C(=O)N2CC[C@H](N3CCCCC3)C2)cc1	ZINC000280635069	456018779	/nfs/dbraw/zinc/01/87/79/456018779.db2.gz	XSXYONHZRPVRKX-SFHVURJKSA-N	0	3	325.456	3.188	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1CN[C@@H](C)c1nnn(-c2ccc(F)cc2)c1C	ZINC000280928455	456085421	/nfs/dbraw/zinc/08/54/21/456085421.db2.gz	UWKNGJIVCLRUEC-OHNRDTAOSA-N	0	3	344.434	3.347	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H]2C[C@H](c3cccc(F)c3)C2)CC1	ZINC000280979752	456099510	/nfs/dbraw/zinc/09/95/10/456099510.db2.gz	MHZGKRLKNQLFIA-RZDIXWSQSA-N	0	3	331.435	3.021	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N(C)Cc1conc1CC)C(C)C	ZINC000297079277	456112132	/nfs/dbraw/zinc/11/21/32/456112132.db2.gz	LZFGZRRNYJLXGE-GOSISDBHSA-N	0	3	348.491	3.077	20	30		EGEDHN
COc1cccc(C[NH2+]Cc2ccc(N(C)CCC#N)cc2)c1[O-]	ZINC000289385129	456123117	/nfs/dbraw/zinc/12/31/17/456123117.db2.gz	DCBPOCVWDLNXQO-UHFFFAOYSA-N	0	3	325.412	3.040	20	30		EGEDHN
C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NCC#Cc1ccccc1	ZINC000289438675	456125986	/nfs/dbraw/zinc/12/59/86/456125986.db2.gz	WISPTLRUQPPSEC-WMZOPIPTSA-N	0	3	328.456	3.273	20	30		EGEDHN
C=C[C@H](CO)N[C@@H](C)c1cccc(OCc2cn3ccccc3n2)c1	ZINC000289703122	456137482	/nfs/dbraw/zinc/13/74/82/456137482.db2.gz	ISESDPCHQVZTOE-DOTOQJQBSA-N	0	3	337.423	3.111	20	30		EGEDHN
CCc1nnc(NC[C@@H](c2cccc(F)c2)N(C)C)c(C#N)c1CC	ZINC000301634435	456169240	/nfs/dbraw/zinc/16/92/40/456169240.db2.gz	VTONUYJLQSCPEM-SFHVURJKSA-N	0	3	341.434	3.327	20	30		EGEDHN
Cc1ccccc1C[C@H](CO)NCc1cccc(OCCCC#N)c1	ZINC000188935300	456176737	/nfs/dbraw/zinc/17/67/37/456176737.db2.gz	NALITXCLLOHQKZ-HXUWFJFHSA-N	0	3	338.451	3.371	20	30		EGEDHN
C=C[C@@H](CO)N[C@H]1CCCc2c3cc(Br)ccc3[nH]c21	ZINC000289991917	456209075	/nfs/dbraw/zinc/20/90/75/456209075.db2.gz	YNFJUYOGLXQXDY-NHYWBVRUSA-N	0	3	335.245	3.444	20	30		EGEDHN
C=CCOCCCc1nc(-c2ccc3c(c2)C(SC)C(=O)N3)no1	ZINC000273912163	456247645	/nfs/dbraw/zinc/24/76/45/456247645.db2.gz	QRTTUFYQIQDNTK-OAHLLOKOSA-N	0	3	345.424	3.228	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000189192934	456251300	/nfs/dbraw/zinc/25/13/00/456251300.db2.gz	SQHPZXMLNOWXBP-PZJWPPBQSA-N	0	3	344.499	3.338	20	30		EGEDHN
C#C[C@@H](N[C@@H](C)CC(=O)Nc1cc(OC)ccc1OC)C(C)(C)C	ZINC000290157242	456255440	/nfs/dbraw/zinc/25/54/40/456255440.db2.gz	LPDRWYGINRRNAE-SUMWQHHRSA-N	0	3	332.444	3.058	20	30		EGEDHN
CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@H]2CC[C@H](C#N)C2)cc1	ZINC000274593884	456262036	/nfs/dbraw/zinc/26/20/36/456262036.db2.gz	FURHFENVGFQVOM-ZOBUZTSGSA-N	0	3	349.500	3.060	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N1CC[C@H]2CCN(C)C[C@H]21)c1ccc(F)c(F)c1	ZINC000274846648	456265649	/nfs/dbraw/zinc/26/56/49/456265649.db2.gz	AAWCAXFLBHASHF-XWIAVFTESA-N	0	3	349.425	3.318	20	30		EGEDHN
C=C(C)[C@H](NC(=O)NCC1=CCN(C)CC1)c1ccc(F)c(F)c1	ZINC000274852868	456266102	/nfs/dbraw/zinc/26/61/02/456266102.db2.gz	BHKXAOIERNVWAD-KRWDZBQOSA-N	0	3	335.398	3.143	20	30		EGEDHN
C=CCOc1cccc(CN2CCC[C@H]2CN2C[C@@H](C)O[C@@H](C)C2)c1	ZINC000352766057	456287106	/nfs/dbraw/zinc/28/71/06/456287106.db2.gz	UZKHOUQSPNCPMZ-NSHGMRRFSA-N	0	3	344.499	3.325	20	30		EGEDHN
COc1cc(CNCc2ccc(NC(=O)C(C)C)cc2)ccc1C#N	ZINC000281681571	456292966	/nfs/dbraw/zinc/29/29/66/456292966.db2.gz	MHQSNOZMVZFOSI-UHFFFAOYSA-N	0	3	337.423	3.451	20	30		EGEDHN
CCc1ccc(CN2CCCN(Cc3ccc(C#N)cc3)CC2)cn1	ZINC000347690301	456307629	/nfs/dbraw/zinc/30/76/29/456307629.db2.gz	XTVQKBTZQROSPQ-UHFFFAOYSA-N	0	3	334.467	3.224	20	30		EGEDHN
C=CCOCCCC(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000290381618	456312164	/nfs/dbraw/zinc/31/21/64/456312164.db2.gz	HMHOPMFIOMVTMB-LJQANCHMSA-N	0	3	348.487	3.176	20	30		EGEDHN
C[C@H](CC#N)Sc1ccccc1NC(=O)CN[C@@H]1CSC[C@@H]1C	ZINC000352814288	456331984	/nfs/dbraw/zinc/33/19/84/456331984.db2.gz	FYHANKUZZGRCMY-GZBFAFLISA-N	0	3	349.525	3.360	20	30		EGEDHN
COc1cc(C(=O)C(C#N)c2ccc(C(F)(F)F)cn2)cc(C)n1	ZINC000337346270	456348649	/nfs/dbraw/zinc/34/86/49/456348649.db2.gz	MAKCRXMUCCSJPT-LBPRGKRZSA-N	0	3	335.285	3.303	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CCC2(CC(OCC)C2)C1	ZINC000353032023	456449796	/nfs/dbraw/zinc/44/97/96/456449796.db2.gz	WCPOGYBPRCLATM-LWEYNCJUSA-N	0	3	345.483	3.046	20	30		EGEDHN
C=CCC(C)(C)C(=O)N(C)C[C@H]1CCCN(CC)[C@H]1c1cnn(C)c1	ZINC000348067628	456452370	/nfs/dbraw/zinc/45/23/70/456452370.db2.gz	DKOMKXWCESBKNJ-SJLPKXTDSA-N	0	3	346.519	3.254	20	30		EGEDHN
C=CCN(Cc1ccccc1F)C(=O)NC[C@@H]1CCCCN1CC	ZINC000303516024	456465489	/nfs/dbraw/zinc/46/54/89/456465489.db2.gz	XXGVOQNIWZCOGK-KRWDZBQOSA-N	0	3	333.451	3.398	20	30		EGEDHN
C#CCOc1ccc(CNCc2ccc(COCCOC)cc2)cc1	ZINC000291079082	456521143	/nfs/dbraw/zinc/52/11/43/456521143.db2.gz	UKWJDIQIFMIHLY-UHFFFAOYSA-N	0	3	339.435	3.151	20	30		EGEDHN
CCN(Cc1cn(CCC#N)nc1-c1ccccc1)C[C@H](C)OC	ZINC000291095548	456526557	/nfs/dbraw/zinc/52/65/57/456526557.db2.gz	QGCDSMKVZHBRKD-INIZCTEOSA-N	0	3	326.444	3.321	20	30		EGEDHN
C#CC[C@H](NCCC(=O)N1CCc2sccc2C1)c1ccccc1	ZINC000298917814	456568655	/nfs/dbraw/zinc/56/86/55/456568655.db2.gz	NJHJWKGSODFGSN-SFHVURJKSA-N	0	3	338.476	3.377	20	30		EGEDHN
CN(CC(C)(C)C#N)C(=O)C1(C)CCN(Cc2ccccc2)CC1	ZINC000353282019	456607688	/nfs/dbraw/zinc/60/76/88/456607688.db2.gz	BJJDYGCCRHZBSF-UHFFFAOYSA-N	0	3	327.472	3.297	20	30		EGEDHN
C[C@@H](C#N)CN(C)C(=O)N[C@H]1CCN(Cc2ccccc2)CC1(C)C	ZINC000282759245	456616299	/nfs/dbraw/zinc/61/62/99/456616299.db2.gz	BVYJZAWINXMTRH-WMZOPIPTSA-N	0	3	342.487	3.088	20	30		EGEDHN
O=C(N[C@@H](CN1CCCC1)c1ccccc1)c1cn2c(n1)CCCC2	ZINC000328690352	456738107	/nfs/dbraw/zinc/73/81/07/456738107.db2.gz	DKJVXFFENAHVSF-KRWDZBQOSA-N	0	3	338.455	3.361	20	30		EGEDHN
C[C@H](N[C@@H]1CCC(=O)NC12CCC2)C(=O)NC1(C#N)CCCCC1	ZINC000328720127	456743275	/nfs/dbraw/zinc/74/32/75/456743275.db2.gz	VXSFXOUZLSEUTF-UONOGXRCSA-N	0	3	332.448	3.189	20	30		EGEDHN
COc1ccc([C@H](CN(C)C)N[C@@H]2CCc3ccc(C#N)cc32)cc1	ZINC000353592662	456790202	/nfs/dbraw/zinc/79/02/02/456790202.db2.gz	AXJUWVPMBNQBGU-RTWAWAEBSA-N	0	3	335.451	3.447	20	30		EGEDHN
C[C@@H]1CCCCN1CCNC(=O)Cc1cc(F)cc2c1OCOC2	ZINC000328940087	456796365	/nfs/dbraw/zinc/79/63/65/456796365.db2.gz	DXYZTFZVSIKTNJ-CYBMUJFWSA-N	0	3	336.407	3.066	20	30		EGEDHN
C[C@@H](NC(=O)c1cccc2c1CCC2)C(=O)NCCN1CCCCC1	ZINC000329013808	456813780	/nfs/dbraw/zinc/81/37/80/456813780.db2.gz	PLPQRXOYKGUJNH-OAHLLOKOSA-N	0	3	343.471	3.311	20	30		EGEDHN
CC(C)n1nccc1[C@H]1OCC[C@@H]1NC(=O)[C@@H](C1CC1)N1CCCC1	ZINC000329067935	456827162	/nfs/dbraw/zinc/82/71/62/456827162.db2.gz	XHQKTVALYMNUPZ-JQHSSLGASA-N	0	3	346.475	3.125	20	30		EGEDHN
C=CCSCCNC(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1	ZINC000338466513	456829213	/nfs/dbraw/zinc/82/92/13/456829213.db2.gz	SZIBXMXVSJRRDH-WBVHZDCISA-N	0	3	333.501	3.040	20	30		EGEDHN
C=CCSCCNC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1	ZINC000338581053	456842346	/nfs/dbraw/zinc/84/23/46/456842346.db2.gz	PCIHKNPEMDJWPO-HNNXBMFYSA-N	0	3	341.908	3.161	20	30		EGEDHN
C[C@@H]1CN(C(=O)C[C@H](CC#N)c2ccccc2)CCN(C2CCC2)C1	ZINC000344721990	456852554	/nfs/dbraw/zinc/85/25/54/456852554.db2.gz	IQDVMJNCNLAWQU-HKUYNNGSSA-N	0	3	339.483	3.407	20	30		EGEDHN
C=CCc1cc(CNCc2ccc3c(c2)COC3)cc(OC)c1O	ZINC000344959445	456877971	/nfs/dbraw/zinc/87/79/71/456877971.db2.gz	SNBWTECCIVAGIU-UHFFFAOYSA-N	0	3	325.408	3.449	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C	ZINC000341578223	456878289	/nfs/dbraw/zinc/87/82/89/456878289.db2.gz	VMNMMOAYJJROEQ-GOSISDBHSA-N	0	3	343.496	3.429	20	30		EGEDHN
CCN1CCCC[C@H]1CNC(=O)c1cnc2c(cnn2CC(C)C)c1	ZINC000329388402	456883077	/nfs/dbraw/zinc/88/30/77/456883077.db2.gz	TZTBHZJXEZMYFL-KRWDZBQOSA-N	0	3	343.475	3.266	20	30		EGEDHN
CCN1CCCC[C@H]1CNC(=O)N1CCC(c2ccc(O)cc2)CC1	ZINC000329428886	456888496	/nfs/dbraw/zinc/88/84/96/456888496.db2.gz	HECJKWYXHMROBI-SFHVURJKSA-N	0	3	345.487	3.360	20	30		EGEDHN
CCO[C@@H]1C[C@@H](NCC(=O)NC2(C#N)CCCCC2)C12CCCC2	ZINC000329611433	456915444	/nfs/dbraw/zinc/91/54/44/456915444.db2.gz	RJDRNUCXKIJWSH-HZPDHXFCSA-N	0	3	333.476	3.497	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)N[C@@H](C)CN2CCC[C@@H](C)C2)cc1	ZINC000345070861	456915779	/nfs/dbraw/zinc/91/57/79/456915779.db2.gz	DCVJRZGZDVVTGG-SJORKVTESA-N	0	3	345.487	3.171	20	30		EGEDHN
N#Cc1ccc([C@H](N[C@@H]2CC=C(c3ccc(F)cc3)CC2)C(N)=O)cc1	ZINC000349221941	456916500	/nfs/dbraw/zinc/91/65/00/456916500.db2.gz	FKJFHLIPORPOIP-UXHICEINSA-N	0	3	349.409	3.449	20	30		EGEDHN
C[C@H](C(=O)Nc1ccc2c(c1)OCO2)N1CCC2(CCOCC2)[C@@H]1C	ZINC000329666871	456924489	/nfs/dbraw/zinc/92/44/89/456924489.db2.gz	LBYVXODMAWJPAV-KGLIPLIRSA-N	0	3	346.427	3.283	20	30		EGEDHN
CC1(C)CN(CCC(=O)Nc2cccc(C#N)c2)[C@H]1[C@H]1CCCO1	ZINC000329791275	456941002	/nfs/dbraw/zinc/94/10/02/456941002.db2.gz	UKKDZUXHRKHUJE-AEFFLSMTSA-N	0	3	327.428	3.426	20	30		EGEDHN
O=C(NCc1nnc(C2CC2)n1C1CC1)[C@@H]1CCCN1C1CCCC1	ZINC000329824158	456946421	/nfs/dbraw/zinc/94/64/21/456946421.db2.gz	BJBZXUDHOYOBDZ-INIZCTEOSA-N	0	3	343.475	3.354	20	30		EGEDHN
C[C@H]1CCN(Cc2cccc(OCc3ccccc3C#N)c2)C[C@H]1O	ZINC000349408309	456964539	/nfs/dbraw/zinc/96/45/39/456964539.db2.gz	PDXBSHRGRQUBNJ-HRAATJIYSA-N	0	3	336.435	3.340	20	30		EGEDHN
C=CCN(Cc1ccccc1)C(=O)CC1(N2CCOCC2)CCCC1	ZINC000345750928	456991277	/nfs/dbraw/zinc/99/12/77/456991277.db2.gz	NBTJLSYLGVKAJT-UHFFFAOYSA-N	0	3	342.483	3.236	20	30		EGEDHN
CN(CCN1CCCC1)C(=O)c1cn(CCCC#N)c2ccccc12	ZINC000345816063	456999693	/nfs/dbraw/zinc/99/96/93/456999693.db2.gz	MJECMNDBOYLXRP-UHFFFAOYSA-N	0	3	338.455	3.113	20	30		EGEDHN
C[C@H]1CN(C2CCOCC2)CCN1C(=O)Nc1ccc2ccoc2c1	ZINC000330195734	457000092	/nfs/dbraw/zinc/00/00/92/457000092.db2.gz	PJYWAORJSFZKPO-AWEZNQCLSA-N	0	3	343.427	3.163	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N1CCCN(Cc2ccccc2)C[C@H]1C	ZINC000362607408	457002295	/nfs/dbraw/zinc/00/22/95/457002295.db2.gz	DCNMCALRNWFXLE-HOJAQTOUSA-N	0	3	342.483	3.091	20	30		EGEDHN
C[C@@H]1CCN(C)CCN1C(=O)c1cn(CCCC#N)c2ccccc12	ZINC000345939558	457007866	/nfs/dbraw/zinc/00/78/66/457007866.db2.gz	GOQWELBQDZYCFL-MRXNPFEDSA-N	0	3	338.455	3.111	20	30		EGEDHN
CCn1ccnc1[C@@H]1CCCCN1C(=O)NCCN1CCC[C@H](C)C1	ZINC000330243919	457010782	/nfs/dbraw/zinc/01/07/82/457010782.db2.gz	CWROGDSMAJZJCG-IRXDYDNUSA-N	0	3	347.507	3.076	20	30		EGEDHN
CCc1nocc1CN[C@H]1CCCN(c2ccc(C#N)cc2F)C1	ZINC000339246097	457015113	/nfs/dbraw/zinc/01/51/13/457015113.db2.gz	BECLQYRCBULIKN-HNNXBMFYSA-N	0	3	328.391	3.006	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)c2cn(CCCC#N)c3ccccc23)CCN1C	ZINC000346104316	457017298	/nfs/dbraw/zinc/01/72/98/457017298.db2.gz	WOYZITDTBVYARL-JKSUJKDBSA-N	0	3	338.455	3.158	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN1C[C@H](C)N(CC)C[C@H]1C	ZINC000346220229	457024499	/nfs/dbraw/zinc/02/44/99/457024499.db2.gz	WGVOERXGGDQHOX-JKSUJKDBSA-N	0	3	347.528	3.318	20	30		EGEDHN
[O-]C(=[NH+][C@@H]1CCc2nc[nH]c2C1)N1CC2(CCC2)[C@@H]1c1ccccc1	ZINC000330346568	457033058	/nfs/dbraw/zinc/03/30/58/457033058.db2.gz	GSUBRQWBPYTRLM-QAPCUYQASA-N	0	3	336.439	3.408	20	30		EGEDHN
[O-]C(=[NH+][C@@H]1CCc2[nH]cnc2C1)N1CC2(CCC2)[C@@H]1c1ccccc1	ZINC000330346568	457033065	/nfs/dbraw/zinc/03/30/65/457033065.db2.gz	GSUBRQWBPYTRLM-QAPCUYQASA-N	0	3	336.439	3.408	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1c1nc(-c2cccc(OCCN(C)C)c2)no1	ZINC000346529719	457049166	/nfs/dbraw/zinc/04/91/66/457049166.db2.gz	JELMIGXZZAGCAE-SJORKVTESA-N	0	3	343.427	3.126	20	30		EGEDHN
C=C(C)Cn1c(C)nnc1N1C[C@@H](C)N(Cc2ccccc2)C[C@@H]1C	ZINC000359235624	457066323	/nfs/dbraw/zinc/06/63/23/457066323.db2.gz	VCIOISDLFSVIGV-SJORKVTESA-N	0	3	339.487	3.262	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1c1nc(-c2ccc(OCCN(C)C)cc2)no1	ZINC000349985150	457133187	/nfs/dbraw/zinc/13/31/87/457133187.db2.gz	ZNTKGUDFXPEQNR-IAGOWNOFSA-N	0	3	343.427	3.126	20	30		EGEDHN
CCc1nc([C@H](C)NC(=O)NC[C@H]2N(C)CCCC2(C)C)cs1	ZINC000331338544	457169718	/nfs/dbraw/zinc/16/97/18/457169718.db2.gz	VYKYETONLYMWAM-GXTWGEPZSA-N	0	3	338.521	3.391	20	30		EGEDHN
Cc1cc(CN2CCCN(c3ccccc3C#N)CC2)ccc1C#N	ZINC000362962700	457176391	/nfs/dbraw/zinc/17/63/91/457176391.db2.gz	FWKOSWBALHPARE-UHFFFAOYSA-N	0	3	330.435	3.451	20	30		EGEDHN
CC[C@@H](c1ccccc1)[C@H]1CCCN1CC(=O)N(CC)CCC#N	ZINC000350634090	457195110	/nfs/dbraw/zinc/19/51/10/457195110.db2.gz	RYYFUHWCUMVNGV-RBUKOAKNSA-N	0	3	327.472	3.407	20	30		EGEDHN
Cn1cc(CN2CCC(c3cn[nH]c3)CC2)c(-c2ccc(C#N)cc2)n1	ZINC000360012483	457203458	/nfs/dbraw/zinc/20/34/58/457203458.db2.gz	BYVLJDXULVLEER-UHFFFAOYSA-N	0	3	346.438	3.061	20	30		EGEDHN
N#CC1(CCCN2C[C@H](O)C[C@@H]2c2ccc(F)cc2)CCOCC1	ZINC000331579215	457211168	/nfs/dbraw/zinc/21/11/68/457211168.db2.gz	LJSCSEMLXYZJGQ-QZTJIDSGSA-N	0	3	332.419	3.034	20	30		EGEDHN
CC1(C)CN(CC(=O)N(CCC#N)c2ccccc2)[C@@H]2CCC[C@H]21	ZINC000339715263	457229703	/nfs/dbraw/zinc/22/97/03/457229703.db2.gz	FXPJDVXGKIWYRN-QZTJIDSGSA-N	0	3	325.456	3.444	20	30		EGEDHN
Cc1nc(NCCCCN2C[C@@H](C)O[C@H](C)C2)c(Cl)cc1C#N	ZINC000360068972	457235682	/nfs/dbraw/zinc/23/56/82/457235682.db2.gz	BYDOMKAYBVUISC-CHWSQXEVSA-N	0	3	336.867	3.216	20	30		EGEDHN
CC(C#N)C(=O)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000347139671	457251495	/nfs/dbraw/zinc/25/14/95/457251495.db2.gz	SJPYTCYIOOHPNM-DGCLKSJQSA-N	0	3	344.802	3.256	20	30		EGEDHN
C[C@@H](c1ccc(N2CCCS2(=O)=O)cc1)N(C)CCC(C)(C)C#N	ZINC000347242989	457306598	/nfs/dbraw/zinc/30/65/98/457306598.db2.gz	YFBJRUBNAMANPD-HNNXBMFYSA-N	0	3	349.500	3.159	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCC(C)(C)CCC#N)C1	ZINC000351825772	457319151	/nfs/dbraw/zinc/31/91/51/457319151.db2.gz	ALTMVHDCOANFMG-SJLPKXTDSA-N	0	3	342.487	3.451	20	30		EGEDHN
CCN(CCC1CC1)[C@H](C)C(=O)N(CCC#N)c1ccccc1OC	ZINC000355040988	457338158	/nfs/dbraw/zinc/33/81/58/457338158.db2.gz	UYAAYNOFYFXGHB-MRXNPFEDSA-N	0	3	343.471	3.452	20	30		EGEDHN
C=CCNC(=O)NC(=O)[C@@H](C)N[C@@H](C)c1ccc(F)c2ccccc21	ZINC000352277429	457353440	/nfs/dbraw/zinc/35/34/40/457353440.db2.gz	BXGYZWGEQWBNDL-QWHCGFSZSA-N	0	3	343.402	3.030	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H]1CCN(C(=O)Nc2ccc(C#N)cc2)C1	ZINC000363570773	457369061	/nfs/dbraw/zinc/36/90/61/457369061.db2.gz	BGLUOWWNGQUEDX-LJQANCHMSA-N	0	3	334.423	3.296	20	30		EGEDHN
C[C@@H]1C[C@@H](Nc2nccc(C#N)c2Cl)CCN1Cc1ccccc1	ZINC000342566799	457369095	/nfs/dbraw/zinc/36/90/95/457369095.db2.gz	LTVLNQWVJRTJNC-PBHICJAKSA-N	0	3	340.858	3.494	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2cncc(-c3cccc(C)c3)c2)CC1	ZINC000378173966	457381309	/nfs/dbraw/zinc/38/13/09/457381309.db2.gz	HOMZRMMYJPXWDU-UHFFFAOYSA-N	0	3	347.462	3.275	20	30		EGEDHN
N#C[C@]1(C(=O)N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)CC12CCCC2	ZINC000425002559	457401077	/nfs/dbraw/zinc/40/10/77/457401077.db2.gz	GBUIUNAFPVCBNK-JQVVWYNYSA-N	0	3	349.478	3.193	20	30		EGEDHN
C[C@H](NC(=O)NCC(C)(C)CCC#N)[C@H](c1ccccc1)N(C)C	ZINC000357278862	457416398	/nfs/dbraw/zinc/41/63/98/457416398.db2.gz	FFSXJGKJVOQUJV-DOTOQJQBSA-N	0	3	330.476	3.307	20	30		EGEDHN
CCC(C#N)(CC)C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000379717604	457418034	/nfs/dbraw/zinc/41/80/34/457418034.db2.gz	OPPWKICQLITOKT-FUHWJXTLSA-N	0	3	327.472	3.486	20	30		EGEDHN
C=CCCC1(C(=O)N(C)C[C@@H]2CCN(C)[C@@H]2c2cccnc2)CC1	ZINC000356088782	457446877	/nfs/dbraw/zinc/44/68/77/457446877.db2.gz	JPIHQTBCJMNXTL-ZWKOTPCHSA-N	0	3	327.472	3.279	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN2CCC[C@@H](c3ccccc3)C2)cc1	ZINC000433048521	457653697	/nfs/dbraw/zinc/65/36/97/457653697.db2.gz	XJRITWKRKWCLGS-WOJBJXKFSA-N	0	3	336.435	3.178	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2cccc(OC(F)(F)F)c2)nc(C)n1	ZINC000357814893	457700170	/nfs/dbraw/zinc/70/01/70/457700170.db2.gz	USUMFTKHBBBODY-CYBMUJFWSA-N	0	3	335.285	3.482	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN2CCOC3(C2)CCCCCC3)c1	ZINC000357961568	457733619	/nfs/dbraw/zinc/73/36/19/457733619.db2.gz	FZUAPBXOIVUOHB-UHFFFAOYSA-N	0	3	341.455	3.312	20	30		EGEDHN
CC(C)C1CCC(N(C)CC(=O)NCc2ccc(C#N)cc2)CC1	ZINC000433141958	457764740	/nfs/dbraw/zinc/76/47/40/457764740.db2.gz	BUTHAAVCRKTOPB-UHFFFAOYSA-N	0	3	327.472	3.321	20	30		EGEDHN
CN(CCCNC(=O)C(C#N)CCc1ccccc1)c1ccccc1	ZINC000433169145	457768853	/nfs/dbraw/zinc/76/88/53/457768853.db2.gz	PYFZLNCXZOVTAL-IBGZPJMESA-N	0	3	335.451	3.402	20	30		EGEDHN
Cn1c2ccccc2cc(CN[C@H]2CCc3ccc(C#N)cc32)c1=O	ZINC000426302506	457802532	/nfs/dbraw/zinc/80/25/32/457802532.db2.gz	SANXLPYXGRWEQM-IBGZPJMESA-N	0	3	329.403	3.187	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)[C@@H](C#N)CCc2ccccc2)N(C)C)cc1	ZINC000433305245	457804381	/nfs/dbraw/zinc/80/43/81/457804381.db2.gz	PKFXKGUUXLWKKV-RTWAWAEBSA-N	0	3	349.478	3.487	20	30		EGEDHN
C[C@@H]1Cc2ccccc2N1CCNC(=O)C(C#N)CCc1ccccc1	ZINC000433307185	457805297	/nfs/dbraw/zinc/80/52/97/457805297.db2.gz	UDEQCNJMOFZXKI-YLJYHZDGSA-N	0	3	347.462	3.326	20	30		EGEDHN
C=C[C@H](CC(=O)N1C[C@H](SC)[C@@H](N2CCCC2)C1)c1ccccc1	ZINC000361625755	457809449	/nfs/dbraw/zinc/80/94/49/457809449.db2.gz	VRZBSPZIJJNLHB-NEWSRXKRSA-N	0	3	344.524	3.385	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)c1ccnn1-c1ccccc1	ZINC000361655080	457812211	/nfs/dbraw/zinc/81/22/11/457812211.db2.gz	NQAIAAUOGADTNS-OAHLLOKOSA-N	0	3	341.374	3.249	20	30		EGEDHN
Cc1nc2ccc(C(=O)C(C#N)c3nc4ccccc4[nH]3)cc2n1C	ZINC000361654862	457812785	/nfs/dbraw/zinc/81/27/85/457812785.db2.gz	MOTOYIDEDZILNP-CYBMUJFWSA-N	0	3	329.363	3.248	20	30		EGEDHN
CC(C)(C#N)c1ccc(C(=O)C(C#N)c2nnc3n2CCCCC3)cc1	ZINC000361676407	457817569	/nfs/dbraw/zinc/81/75/69/457817569.db2.gz	XRHXICVQSJDKAF-INIZCTEOSA-N	0	3	347.422	3.296	20	30		EGEDHN
COc1cc(OC)cc(OCCNCc2ccc(C#N)c(C)c2)c1	ZINC000443993650	457836788	/nfs/dbraw/zinc/83/67/88/457836788.db2.gz	MUQKMJBYVXATLF-UHFFFAOYSA-N	0	3	326.396	3.053	20	30		EGEDHN
Cc1cc(CN[C@@H](Cc2ccccc2)[C@@H](O)C(F)F)ccc1C#N	ZINC000443997519	457838102	/nfs/dbraw/zinc/83/81/02/457838102.db2.gz	MGBOAPTVEIRVKL-ZWKOTPCHSA-N	0	3	330.378	3.194	20	30		EGEDHN
O=C(NCC#Cc1ccccc1)c1cccc(CN2CCCCC2)c1	ZINC000411237174	457838348	/nfs/dbraw/zinc/83/83/48/457838348.db2.gz	AKLSGTIWWWKBNU-UHFFFAOYSA-N	0	3	332.447	3.454	20	30		EGEDHN
Cc1cc(C)cc(N(CCC#N)C(=O)CN2CC[C@@H]3CCC[C@H]32)c1	ZINC000426479267	457838478	/nfs/dbraw/zinc/83/84/78/457838478.db2.gz	IJZOGLCKZODSFT-PKOBYXMFSA-N	0	3	325.456	3.425	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NC1CCN(Cc2cccc(C)c2)CC1)OCC	ZINC000366845519	457902362	/nfs/dbraw/zinc/90/23/62/457902362.db2.gz	UGUKYUGTBZFUJH-FQEVSTJZSA-N	0	3	344.499	3.447	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1)OCC	ZINC000366823100	457902657	/nfs/dbraw/zinc/90/26/57/457902657.db2.gz	DJPPQUIBJJCTSE-UXHICEINSA-N	0	3	344.499	3.386	20	30		EGEDHN
CC(C)(CC#N)CNC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F	ZINC000458047592	457914891	/nfs/dbraw/zinc/91/48/91/457914891.db2.gz	YEBNXIZPWAGINL-MRXNPFEDSA-N	0	3	349.425	3.200	20	30		EGEDHN
C=CC[C@@H]1N(C(=O)c2ccnc(OCCN(C)C)c2)CCCC1(C)C	ZINC000444633257	457924320	/nfs/dbraw/zinc/92/43/20/457924320.db2.gz	RVEXTDXAPJVCCH-KRWDZBQOSA-N	0	3	345.487	3.229	20	30		EGEDHN
C=CCC[C@@H](C(=O)NC[C@]1(N(C)C)CCSC1)c1ccccc1	ZINC000427251261	457968388	/nfs/dbraw/zinc/96/83/88/457968388.db2.gz	RWXDLUVOPCXRNH-IEBWSBKVSA-N	0	3	332.513	3.290	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)Nc1ccc(OCCN(C)C)c(C)c1	ZINC000458220105	457975499	/nfs/dbraw/zinc/97/54/99/457975499.db2.gz	SIJCAANDIVTHIM-LJQANCHMSA-N	0	3	334.460	3.103	20	30		EGEDHN
COC(=O)C(C)(C)CCN1CCC(Oc2ccc(C#N)cc2F)CC1	ZINC000375745866	458046005	/nfs/dbraw/zinc/04/60/05/458046005.db2.gz	WSWRGUDTRDAZCR-UHFFFAOYSA-N	0	3	348.418	3.130	20	30		EGEDHN
COC1([C@H](C)NCC(=O)N(CCC#N)c2cccc(C)c2C)CCC1	ZINC000412017598	458047049	/nfs/dbraw/zinc/04/70/49/458047049.db2.gz	AGJGJENSVOMSMA-KRWDZBQOSA-N	0	3	343.471	3.097	20	30		EGEDHN
C=CCN(CCC(=O)Nc1cccc(C#N)c1)Cc1cccc(C#N)c1	ZINC000434831645	458055907	/nfs/dbraw/zinc/05/59/07/458055907.db2.gz	XZZCUFFUJXIKNK-UHFFFAOYSA-N	0	3	344.418	3.447	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1SCc1cnoc1C	ZINC000445605309	458068485	/nfs/dbraw/zinc/06/84/85/458068485.db2.gz	QICSLDQBLSNBEG-UHFFFAOYSA-N	0	3	347.488	3.081	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)c1ccc(C2CC2)cn1	ZINC000445812738	458093939	/nfs/dbraw/zinc/09/39/39/458093939.db2.gz	ZTJDBIYDMGRKGA-UHFFFAOYSA-N	0	3	348.450	3.035	20	30		EGEDHN
CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)N(C)CC(C)(C)C#N	ZINC000458633148	458118263	/nfs/dbraw/zinc/11/82/63/458118263.db2.gz	BSALLLPDROCUHN-GOSISDBHSA-N	0	3	344.503	3.334	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H]([C@H](C)CC)C(F)(F)F)CC1	ZINC000446291775	458172778	/nfs/dbraw/zinc/17/27/78/458172778.db2.gz	BZEQDNMQSPYXIF-TZMCWYRMSA-N	0	3	335.414	3.303	20	30		EGEDHN
CC(C)CCO[C@@H]1CCCC[C@H]1NCC(=O)Nc1ccc(C#N)cc1	ZINC000436271973	458279509	/nfs/dbraw/zinc/27/95/09/458279509.db2.gz	RIGDPZPGBFXBCT-RTBURBONSA-N	0	3	343.471	3.460	20	30		EGEDHN
C=CCn1c(=O)[n-]nc1SCc1ccc(C[NH+]2CCCCC2)cc1	ZINC000412996450	458290694	/nfs/dbraw/zinc/29/06/94/458290694.db2.gz	GAYDKGNGZPDDNZ-UHFFFAOYSA-N	0	3	344.484	3.448	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)NCC(C)(C)CC#N	ZINC000459262627	458306874	/nfs/dbraw/zinc/30/68/74/458306874.db2.gz	VKRATHPEUCMVSX-QGZVFWFLSA-N	0	3	342.487	3.232	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NC(=O)N1CCCN(C(C)C)CC1	ZINC000413828436	458307925	/nfs/dbraw/zinc/30/79/25/458307925.db2.gz	UVHQUDJGTIIXMR-LJQANCHMSA-N	0	3	329.488	3.300	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NC(=O)N(C)CC1(N(C)C)CCC1	ZINC000413840809	458310886	/nfs/dbraw/zinc/31/08/86/458310886.db2.gz	WBQBFNBCVCEONZ-GOSISDBHSA-N	0	3	329.488	3.300	20	30		EGEDHN
CO[C@H]1c2ccccc2C[C@H]1NC(=O)C(C#N)CCc1ccccc1	ZINC000413877822	458312103	/nfs/dbraw/zinc/31/21/03/458312103.db2.gz	HMIXWLYQALRJSE-RLLQIKCJSA-N	0	3	334.419	3.188	20	30		EGEDHN
CC(C)(CCN[C@H]1CCCCc2cc(C#N)ccc21)S(C)(=O)=O	ZINC000414268414	458317086	/nfs/dbraw/zinc/31/70/86/458317086.db2.gz	UKRMRFCRVALCKO-KRWDZBQOSA-N	0	3	334.485	3.129	20	30		EGEDHN
CCO[C@@H]1C[C@H](N[C@H](C)C(=O)N[C@@](C)(C#N)C(C)C)C1(CC)CC	ZINC000429342821	458318496	/nfs/dbraw/zinc/31/84/96/458318496.db2.gz	COVFWPWTLMMSCA-HPFXQQBRSA-N	0	3	337.508	3.003	20	30		EGEDHN
C[C@@H](CC#N)Sc1ccccc1NC(=O)N1C[C@@H](C)NC[C@@H]1C	ZINC000415161578	458329757	/nfs/dbraw/zinc/32/97/57/458329757.db2.gz	MSFXGFYIQAHQJW-RDBSUJKOSA-N	0	3	332.473	3.295	20	30		EGEDHN
N#CCC[C@H](NC(=O)Nc1ccc2c(c1)CNCC2)c1ccccc1	ZINC000415901925	458335622	/nfs/dbraw/zinc/33/56/22/458335622.db2.gz	VGHAZRCUNJVBTI-IBGZPJMESA-N	0	3	334.423	3.499	20	30		EGEDHN
C=CCNC(=O)[C@@H](C)N1CCC(c2c[nH]c3ccc(F)cc32)CC1	ZINC000376833417	458401569	/nfs/dbraw/zinc/40/15/69/458401569.db2.gz	ILSPTJJQFXKHPE-CYBMUJFWSA-N	0	3	329.419	3.177	20	30		EGEDHN
C[C@H](C#N)CSc1ccccc1NC(=O)N(C)C[C@@H]1CCCN1C	ZINC000421061164	458406946	/nfs/dbraw/zinc/40/69/46/458406946.db2.gz	LMICKHKYHBDTFQ-CABCVRRESA-N	0	3	346.500	3.496	20	30		EGEDHN
COc1cccc(NC(=O)C[C@@H](C)NCc2ccc(C#N)s2)c1	ZINC000421349600	458411429	/nfs/dbraw/zinc/41/14/29/458411429.db2.gz	IQYHHBQUODZEQH-GFCCVEGCSA-N	0	3	329.425	3.135	20	30		EGEDHN
COc1ccc(CN[C@H]2CCO[C@@H]2C2CC2)cc1OCCCC#N	ZINC000373179425	458419775	/nfs/dbraw/zinc/41/97/75/458419775.db2.gz	ZCQNULAVSXRNIB-QFBILLFUSA-N	0	3	330.428	3.035	20	30		EGEDHN
CC(C)(C)[C@@H]([NH2+]C1CCC(C)(C#N)CC1)c1nc(-c2nc[n-]n2)no1	ZINC000449198277	458420516	/nfs/dbraw/zinc/42/05/16/458420516.db2.gz	AYZLWDVEDCKJOP-JKGQDXBKSA-N	0	3	343.435	3.004	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2coc(-c3c(F)cccc3F)n2)CC1	ZINC000421769125	458422100	/nfs/dbraw/zinc/42/21/00/458422100.db2.gz	QVEJMMCWWMGYSX-UHFFFAOYSA-N	0	3	347.365	3.000	20	30		EGEDHN
CN(C[C@H]1CCCN1C)C(=O)c1cn(CCCC#N)c2ccccc12	ZINC000422046510	458425338	/nfs/dbraw/zinc/42/53/38/458425338.db2.gz	ZXEJZWCJLCANKO-MRXNPFEDSA-N	0	3	338.455	3.111	20	30		EGEDHN
CC(C)(CCC#N)CNC(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000376986773	458434697	/nfs/dbraw/zinc/43/46/97/458434697.db2.gz	FEIOPHJZISYARI-GOSISDBHSA-N	0	3	342.487	3.138	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1CNC(=O)c1ccc(CN(CC)C2CC2)cc1	ZINC000437519982	458461666	/nfs/dbraw/zinc/46/16/66/458461666.db2.gz	WYCIBUOPDBKRNY-QUCCMNQESA-N	0	3	342.483	3.382	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@H]1C[C@@H](OC)C12CCC2	ZINC000459745816	458466499	/nfs/dbraw/zinc/46/64/99/458466499.db2.gz	FIKGGUIZYKKJFT-DLBZAZTESA-N	0	3	346.496	3.450	20	30		EGEDHN
C[C@@H](Cc1cccc(F)c1)N(C)C[C@@H](O)COc1ccc(C#N)cc1	ZINC000459758372	458471121	/nfs/dbraw/zinc/47/11/21/458471121.db2.gz	QCUSKYULNJUGTR-HNAYVOBHSA-N	0	3	342.414	3.000	20	30		EGEDHN
N#Cc1ccc(CN[C@H]([C@H](CO)C2CC2)C2CC2)c(OC(F)F)c1	ZINC000451604176	458482456	/nfs/dbraw/zinc/48/24/56/458482456.db2.gz	KDHMCWBVJRNDIY-WBVHZDCISA-N	0	3	336.382	3.046	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1N[C@H](C)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000451607754	458483424	/nfs/dbraw/zinc/48/34/24/458483424.db2.gz	QKLWREWRGFMXLP-FZQKWOKYSA-N	0	3	329.227	3.254	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CCC[C@]2(CCSC2)C1	ZINC000451970824	458491300	/nfs/dbraw/zinc/49/13/00/458491300.db2.gz	YXESZKVFONVAFG-ICSRJNTNSA-N	0	3	347.524	3.374	20	30		EGEDHN
Cc1cccc(N(CCC#N)C(=O)CN2CCC[C@@H]2C2CC2)c1C	ZINC000377534737	458503743	/nfs/dbraw/zinc/50/37/43/458503743.db2.gz	XBBFCLMNPDRDSI-LJQANCHMSA-N	0	3	325.456	3.425	20	30		EGEDHN
CO[C@@H](CNC(=O)C(C#N)CCc1ccccc1)Cc1ccccc1	ZINC000452816781	458511341	/nfs/dbraw/zinc/51/13/41/458511341.db2.gz	MXBUINGNPPUZJA-WOJBJXKFSA-N	0	3	336.435	3.133	20	30		EGEDHN
CCOC(=O)[C@H](C)[C@@H](C)NCC#Cc1ccc(C(F)(F)F)cc1	ZINC000460352115	458512059	/nfs/dbraw/zinc/51/20/59/458512059.db2.gz	VPGIKJZZAINUBC-CHWSQXEVSA-N	0	3	327.346	3.234	20	30		EGEDHN
C=CC(C)(C)CNC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000454257737	458555816	/nfs/dbraw/zinc/55/58/16/458555816.db2.gz	DMVSJFSLEAXXRZ-UHFFFAOYSA-N	0	3	329.488	3.205	20	30		EGEDHN
Cc1ccc(Cc2cnc(NC(=O)[C@H](N)CCCC#N)s2)cc1C	ZINC000424095592	458556996	/nfs/dbraw/zinc/55/69/96/458556996.db2.gz	XJNYNUSWYKZGND-MRXNPFEDSA-N	0	3	342.468	3.310	20	30		EGEDHN
Cc1ccccc1Oc1ccccc1CNC(=O)[C@@H](N)CCCC#N	ZINC000424120925	458563522	/nfs/dbraw/zinc/56/35/22/458563522.db2.gz	FJXVDCQOLVJPFQ-KRWDZBQOSA-N	0	3	337.423	3.425	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N(Cc1c(F)cccc1F)C1CCCC1	ZINC000424118660	458563609	/nfs/dbraw/zinc/56/36/09/458563609.db2.gz	CBJLDRHYBYSAIR-KRWDZBQOSA-N	0	3	335.398	3.257	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N1Cc2ccccc2C[C@@H]1c1ccccc1	ZINC000424124191	458564030	/nfs/dbraw/zinc/56/40/30/458564030.db2.gz	MAHNLXUKAJEHEL-VQTJNVASSA-N	0	3	333.435	3.334	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N[C@@H](c1ccccc1)c1cccc(F)c1	ZINC000424126136	458565197	/nfs/dbraw/zinc/56/51/97/458565197.db2.gz	SHYYKWJUYINBIU-ROUUACIJSA-N	0	3	325.387	3.052	20	30		EGEDHN
Cc1csc(Nc2ccc(NC(=O)[C@H](N)CCCC#N)cc2)n1	ZINC000424140249	458568880	/nfs/dbraw/zinc/56/88/80/458568880.db2.gz	NVVLQTIZCXPKBQ-CQSZACIVSA-N	0	3	329.429	3.155	20	30		EGEDHN
Cc1ccc(Oc2ccccc2CNC(=O)[C@@H](N)CCCC#N)cc1	ZINC000424146828	458570737	/nfs/dbraw/zinc/57/07/37/458570737.db2.gz	XKXXKQKOPRSTLF-SFHVURJKSA-N	0	3	337.423	3.425	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N1CCCC[C@H]1CCCc1ccccc1	ZINC000424167640	458575263	/nfs/dbraw/zinc/57/52/63/458575263.db2.gz	FEKHTDUUBJQVMX-RBUKOAKNSA-N	0	3	327.472	3.412	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)NCc1cnc(-c2ccc(Cl)cc2)s1	ZINC000424165992	458575373	/nfs/dbraw/zinc/57/53/73/458575373.db2.gz	FSMIWKPFSHIZTN-AWEZNQCLSA-N	0	3	348.859	3.101	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1ccc(F)cc1OCCC(F)(F)F	ZINC000424176016	458577451	/nfs/dbraw/zinc/57/74/51/458577451.db2.gz	RLGJJCAQIIOJIF-LLVKDONJSA-N	0	3	347.312	3.117	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N1CC[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000424177063	458577670	/nfs/dbraw/zinc/57/76/70/458577670.db2.gz	TYIPJFZIWDPSLF-HIFRSBDPSA-N	0	3	339.361	3.042	20	30		EGEDHN
C=C(C)CCNC(=O)NC[C@@H](c1ccc(OC)cc1)N1CCCC1	ZINC000455304696	458592722	/nfs/dbraw/zinc/59/27/22/458592722.db2.gz	CMUYFFPEDMHDSR-SFHVURJKSA-N	0	3	331.460	3.098	20	30		EGEDHN
CC(C)N1C[C@H](NC(=O)Nc2ccc(CC#N)cc2Cl)[C@@H](C)C1	ZINC000455706719	458608110	/nfs/dbraw/zinc/60/81/10/458608110.db2.gz	QPTSDOQLEZUHRJ-LRDDRELGSA-N	0	3	334.851	3.256	20	30		EGEDHN
N#CCc1cccc(NC(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000455908022	458620209	/nfs/dbraw/zinc/62/02/09/458620209.db2.gz	QLYAAHXILQKXOM-IBGZPJMESA-N	0	3	348.450	3.396	20	30		EGEDHN
C[C@@H]1[C@@H](NC(=O)c2ccc(F)c(C#N)c2)CCN1Cc1ccccc1	ZINC000494052236	458620718	/nfs/dbraw/zinc/62/07/18/458620718.db2.gz	WYFHOJRHDDLXDB-KUHUBIRLSA-N	0	3	337.398	3.090	20	30		EGEDHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@H](C)c1cccc(C#N)c1	ZINC000462472575	458622889	/nfs/dbraw/zinc/62/28/89/458622889.db2.gz	GLBZXMJZENMQQH-IAGOWNOFSA-N	0	3	335.451	3.298	20	30		EGEDHN
N#CCc1cccc(NC(=O)N2CCN(CC3CCCCC3)CC2)c1	ZINC000455924549	458623164	/nfs/dbraw/zinc/62/31/64/458623164.db2.gz	WCEFHWVHKXJKRY-UHFFFAOYSA-N	0	3	340.471	3.482	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000424499852	458650289	/nfs/dbraw/zinc/65/02/89/458650289.db2.gz	GTWPLAMTOKLDSH-UXHICEINSA-N	0	3	342.483	3.057	20	30		EGEDHN
Cc1cc(C)cc(N(CCC#N)C(=O)[C@H](C)N[C@]2(C)CCO[C@H]2C)c1	ZINC000494277157	458652637	/nfs/dbraw/zinc/65/26/37/458652637.db2.gz	OQRVZFNSKRXAFN-ABSDTBQOSA-N	0	3	343.471	3.096	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F	ZINC000504579128	458739062	/nfs/dbraw/zinc/73/90/62/458739062.db2.gz	KHYZVNHFTUTNCC-KRWDZBQOSA-N	0	3	334.410	3.344	20	30		EGEDHN
CCCN(CCN1CCCCC1)C(=O)NCC#Cc1cccc(F)c1	ZINC000504449155	458739233	/nfs/dbraw/zinc/73/92/33/458739233.db2.gz	DPLKFDJKTCJUSO-UHFFFAOYSA-N	0	3	345.462	3.085	20	30		EGEDHN
C[C@H](C(=O)NC1(C#N)CCC1)N1CCC[C@H](c2ccccc2)CC1	ZINC000530336215	458750020	/nfs/dbraw/zinc/75/00/20/458750020.db2.gz	TXHWQEZWQFJWKL-AEFFLSMTSA-N	0	3	325.456	3.207	20	30		EGEDHN
CCN(C[C@H]1CCCN1CC)C(=O)C(C)(C)Oc1ccc(C#N)cc1	ZINC000547798114	458795341	/nfs/dbraw/zinc/79/53/41/458795341.db2.gz	KPRYFNXYGALGSJ-QGZVFWFLSA-N	0	3	343.471	3.048	20	30		EGEDHN
CCC(CC)Nc1ccncc1NC(=O)c1ncc(C#N)cc1Cl	ZINC000514951134	458803385	/nfs/dbraw/zinc/80/33/85/458803385.db2.gz	SOAYARKNTLDDTL-UHFFFAOYSA-N	0	3	343.818	3.276	20	30		EGEDHN
CCC(CC)Nc1cc[nH+]cc1[N-]C(=O)c1ncc(C#N)cc1Cl	ZINC000514951134	458803395	/nfs/dbraw/zinc/80/33/95/458803395.db2.gz	SOAYARKNTLDDTL-UHFFFAOYSA-N	0	3	343.818	3.276	20	30		EGEDHN
C=CCc1ccc(OC[C@@H](O)CN2CC(C)(C)[C@H]2C2CC2)c(OC)c1	ZINC000515100583	458805876	/nfs/dbraw/zinc/80/58/76/458805876.db2.gz	FNJCFHGACUITAO-FXAWDEMLSA-N	0	3	345.483	3.284	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)CN1CCC[C@H]1CCc1ccccc1	ZINC000515554318	458810610	/nfs/dbraw/zinc/81/06/10/458810610.db2.gz	WBNGMIYFYUUQTI-ICSRJNTNSA-N	0	3	327.472	3.138	20	30		EGEDHN
CN(C[C@@H](O)CNc1ccc(Oc2ccccc2C#N)cc1)C1CC1	ZINC000516965778	458824323	/nfs/dbraw/zinc/82/43/23/458824323.db2.gz	LOQUCJPABKSHLA-SFHVURJKSA-N	0	3	337.423	3.218	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)[C@@H](C)c2c(F)cccc2F)CC1	ZINC000517341161	458828690	/nfs/dbraw/zinc/82/86/90/458828690.db2.gz	GPCSGCPRABZPOO-ZDUSSCGKSA-N	0	3	337.414	3.318	20	30		EGEDHN
COc1cc(CNCCc2ccc(Cl)cc2[N+](=O)[O-])ccc1C#N	ZINC000440607748	458832450	/nfs/dbraw/zinc/83/24/50/458832450.db2.gz	CKCJAIQYPAWUBQ-UHFFFAOYSA-N	0	3	345.786	3.461	20	30		EGEDHN
COC(=O)N1CCC[C@H]([C@H](C)N[C@H](C)c2ccc(C#N)cc2F)C1	ZINC000495509107	458870868	/nfs/dbraw/zinc/87/08/68/458870868.db2.gz	DIEIZQMZRZDTGH-GUTXKFCHSA-N	0	3	333.407	3.215	20	30		EGEDHN
C=CCN1CCC(NC(=O)CO[C@@H]2C[C@@H](C)CC[C@@H]2C(C)C)CC1	ZINC000518501464	458873731	/nfs/dbraw/zinc/87/37/31/458873731.db2.gz	AZWXSCIFLGDBET-QXAKKESOSA-N	0	3	336.520	3.230	20	30		EGEDHN
C[C@H](c1ccccc1F)N1CCC[C@H](N[C@@H]2CC[C@H](C#N)C2)C1=O	ZINC000551242625	458888038	/nfs/dbraw/zinc/88/80/38/458888038.db2.gz	UPSFQHQFFUBQCQ-FSZRXZPDSA-N	0	3	329.419	3.160	20	30		EGEDHN
C=CCSCCN[C@H](C)c1cnccc1NC(=O)OC(C)(C)C	ZINC000495615783	458897837	/nfs/dbraw/zinc/89/78/37/458897837.db2.gz	CENTXOHMUNPDPA-CYBMUJFWSA-N	0	3	337.489	3.420	20	30		EGEDHN
CCN(CCC#N)C(=O)CN(C)[C@@H]1CCC[C@@H]1c1ccc(C)cc1	ZINC000441339773	458922957	/nfs/dbraw/zinc/92/29/57/458922957.db2.gz	IEJLQFIFQJTLIO-RTBURBONSA-N	0	3	327.472	3.325	20	30		EGEDHN
CC(C)Oc1ccc([C@H](CNC(=O)C2(C#N)CC(C)C2)N(C)C)cc1	ZINC000577093455	458979004	/nfs/dbraw/zinc/97/90/04/458979004.db2.gz	MZLGWRUQUNIUEA-VDUSKEEQSA-N	0	3	343.471	3.133	20	30		EGEDHN
CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(CNCc2ccc(C#N)c(F)c2)C1	ZINC000495863755	458982468	/nfs/dbraw/zinc/98/24/68/458982468.db2.gz	FHZWEXUFIXHJBI-DNVCBOLYSA-N	0	3	345.418	3.044	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N[C@]1(C)CCN(Cc2ccccc2)C1)OCC	ZINC000519757554	459001395	/nfs/dbraw/zinc/00/13/95/459001395.db2.gz	IMCBKOKNWDLWBY-UYAOXDASSA-N	0	3	330.472	3.139	20	30		EGEDHN
CC[C@H](CNCc1ccc(O[C@H](C)C#N)cc1)NC(=O)OC(C)(C)C	ZINC000495916259	459004297	/nfs/dbraw/zinc/00/42/97/459004297.db2.gz	UUIWFPPICNQUGJ-GDBMZVCRSA-N	0	3	347.459	3.370	20	30		EGEDHN
C=CCC[C@@H](O)CN1CCC(F)(c2cc(OC)cc(OC)c2)CC1	ZINC000566925682	459022682	/nfs/dbraw/zinc/02/26/82/459022682.db2.gz	HCLAECXDNPUSSZ-MRXNPFEDSA-N	0	3	337.435	3.292	20	30		EGEDHN
N#C[C@@H]1CC[C@@H](NCc2ccc(OCCOc3ccccc3)nc2)C1	ZINC000442721777	459026786	/nfs/dbraw/zinc/02/67/86/459026786.db2.gz	ULVLFPSPBNHCFO-SJLPKXTDSA-N	0	3	337.423	3.321	20	30		EGEDHN
C=CCN(CCc1ccccc1)C(=O)N[C@H](C)CN1CCCCC1	ZINC000520130481	459032363	/nfs/dbraw/zinc/03/23/63/459032363.db2.gz	HGHGAGLUPXRVET-GOSISDBHSA-N	0	3	329.488	3.301	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@@H]1NC[C@@H](C#N)CCC#N	ZINC000496043337	459048216	/nfs/dbraw/zinc/04/82/16/459048216.db2.gz	JPGMNXBECFQBLE-PMPSAXMXSA-N	0	3	334.464	3.103	20	30		EGEDHN
COc1cc(CN(CCO)[C@H]2CCCc3ccccc32)ccc1C#N	ZINC000442884263	459052488	/nfs/dbraw/zinc/05/24/88/459052488.db2.gz	XMYCAOMGARUETP-FQEVSTJZSA-N	0	3	336.435	3.439	20	30		EGEDHN
N#CCCCN1CCC([C@H]2C[C@H]2NC(=O)OCc2ccccc2)CC1	ZINC000496128008	459078164	/nfs/dbraw/zinc/07/81/64/459078164.db2.gz	JOLVZKFLTUHYOD-RTBURBONSA-N	0	3	341.455	3.317	20	30		EGEDHN
CC(C#N)C(=O)NCc1cccc2c1CCCN2C(=O)OC(C)(C)C	ZINC000496140947	459084665	/nfs/dbraw/zinc/08/46/65/459084665.db2.gz	JVJAKOMULNMICB-CYBMUJFWSA-N	0	3	343.427	3.150	20	30		EGEDHN
Cc1ccc(C[C@H]2CCCN2Cc2cnc3c(C#N)cnn3c2)cc1	ZINC000577730981	459085157	/nfs/dbraw/zinc/08/51/57/459085157.db2.gz	OHOLTDBUXOBYMJ-LJQANCHMSA-N	0	3	331.423	3.117	20	30		EGEDHN
Cc1cc(C#N)cnc1C(=O)N[C@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000590294904	459110003	/nfs/dbraw/zinc/11/00/03/459110003.db2.gz	TVXZVLOWRINPED-APWZRJJASA-N	0	3	348.450	3.045	20	30		EGEDHN
CCN(CC(=O)NCC#Cc1cccc(C(F)(F)F)c1)C1CCC1	ZINC000532587042	459113433	/nfs/dbraw/zinc/11/34/33/459113433.db2.gz	YZMNKIWKLLRWCW-UHFFFAOYSA-N	0	3	338.373	3.048	20	30		EGEDHN
CC(C)(C)N1C[C@@H](C(=O)N2CCC[C@@](C)(C#N)C2)[C@H](C(F)(F)F)C1	ZINC000590326615	459116798	/nfs/dbraw/zinc/11/67/98/459116798.db2.gz	ANEFXWNMMBJYNQ-IOASZLSFSA-N	0	3	345.409	3.047	20	30		EGEDHN
C[C@H]1C[C@@H]1N1CCN(C(=O)c2ccc(C#N)c(Cl)c2)C[C@@H](C)C1	ZINC000558023225	459125753	/nfs/dbraw/zinc/12/57/53/459125753.db2.gz	IMOGADHUMIAZCE-DCGLDWPTSA-N	0	3	331.847	3.014	20	30		EGEDHN
CN(CCCCc1ccccc1)CC(=O)NCc1ccc(C#N)cc1	ZINC000521813980	459178053	/nfs/dbraw/zinc/17/80/53/459178053.db2.gz	FCKGODMOUIASPD-UHFFFAOYSA-N	0	3	335.451	3.129	20	30		EGEDHN
N#Cc1ccc2c(c1)CC[C@@H]2NC(=O)[C@@H]1CCCCN1C1CCCC1	ZINC000590748490	459203915	/nfs/dbraw/zinc/20/39/15/459203915.db2.gz	BPDCELXOJITIJL-PMACEKPBSA-N	0	3	337.467	3.459	20	30		EGEDHN
N#Cc1ccc(CCN2CCC(C(=O)Nc3ccccc3)CC2)cc1	ZINC000595287165	459266487	/nfs/dbraw/zinc/26/64/87/459266487.db2.gz	LXCXZSFEYTYJBS-UHFFFAOYSA-N	0	3	333.435	3.451	20	30		EGEDHN
N#Cc1ccnc(N2CCN(CC[C@H]3CCc4ccccc43)CC2)c1	ZINC000595289972	459267543	/nfs/dbraw/zinc/26/75/43/459267543.db2.gz	ILAKXJFXHOGWGC-LJQANCHMSA-N	0	3	332.451	3.195	20	30		EGEDHN
CSc1ccc(OC[C@H](O)CN[C@@H](C)c2cccc(C#N)c2)cc1	ZINC000591023127	459295977	/nfs/dbraw/zinc/29/59/77/459295977.db2.gz	XOIDBZJDQKIHBZ-WMLDXEAASA-N	0	3	342.464	3.371	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CCC[C@H](CC#N)C2)C1	ZINC000595467020	459312427	/nfs/dbraw/zinc/31/24/27/459312427.db2.gz	WRYSBFJCUWRVBK-ZHALLVOQSA-N	0	3	340.471	3.157	20	30		EGEDHN
CC#CCCNC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1	ZINC000482626232	459317738	/nfs/dbraw/zinc/31/77/38/459317738.db2.gz	DJTOURUULJHDOH-INIZCTEOSA-N	0	3	333.501	3.234	20	30		EGEDHN
C=C(C)[C@@H](NC(=O)N1CCN(C)CC[C@@H]1C)c1ccc(F)c(F)c1	ZINC000483300125	459358027	/nfs/dbraw/zinc/35/80/27/459358027.db2.gz	YVVADLYDZLUBEC-SUMWQHHRSA-N	0	3	337.414	3.318	20	30		EGEDHN
CC(C)(CC#N)CNC[C@@H](O)COc1cc(Cl)ccc1Cl	ZINC000568873021	459358831	/nfs/dbraw/zinc/35/88/31/459358831.db2.gz	HQAPIRUQMNLJPN-GFCCVEGCSA-N	0	3	331.243	3.263	20	30		EGEDHN
CC(C)N1CCN(c2cccc(NC(=O)C3(C#N)CC(C)C3)c2)CC1	ZINC000536621444	459361394	/nfs/dbraw/zinc/36/13/94/459361394.db2.gz	WQAQVZAQHKCNOD-UHFFFAOYSA-N	0	3	340.471	3.095	20	30		EGEDHN
C=CCCC[C@@H](C)NC(=O)CCN1CCN(c2ccccc2)CC1	ZINC000538332547	459370806	/nfs/dbraw/zinc/37/08/06/459370806.db2.gz	HIIABGUWKREEBN-GOSISDBHSA-N	0	3	329.488	3.060	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H]2CN(Cc3ccc(C#N)s3)C[C@@H]2C1	ZINC000496941297	459379037	/nfs/dbraw/zinc/37/90/37/459379037.db2.gz	UVPFQJZKXPOQFX-ZIAGYGMSSA-N	0	3	347.484	3.309	20	30		EGEDHN
C=CCCC[C@@H](C)NC(=O)NCC1(N(C)C)Cc2ccccc2C1	ZINC000540488089	459382550	/nfs/dbraw/zinc/38/25/50/459382550.db2.gz	RGQIDGLIFKQHBA-MRXNPFEDSA-N	0	3	329.488	3.130	20	30		EGEDHN
Cc1ccc([C@@H](CNC(=O)N2CCC(CCC#N)CC2)N(C)C)cc1	ZINC000582543700	459382955	/nfs/dbraw/zinc/38/29/55/459382955.db2.gz	PMVODKWTRWPNQI-LJQANCHMSA-N	0	3	342.487	3.323	20	30		EGEDHN
C=CC[C@@H](CC)NC(=O)NC[C@@H](c1ccc(OC)cc1)N1CCCC1	ZINC000540699511	459383319	/nfs/dbraw/zinc/38/33/19/459383319.db2.gz	CBFXWUPLGIANSV-MJGOQNOKSA-N	0	3	345.487	3.486	20	30		EGEDHN
C[C@@]1(NCC(=O)NCc2cccc(C#N)c2)CCCc2ccccc21	ZINC000540907091	459401713	/nfs/dbraw/zinc/40/17/13/459401713.db2.gz	BEJNAMPVFORJKA-OAQYLSRUSA-N	0	3	333.435	3.016	20	30		EGEDHN
Cc1cccc(C)c1OC[C@@H](O)CN[C@H]1CCc2cc(C#N)ccc21	ZINC000591763767	459429950	/nfs/dbraw/zinc/42/99/50/459429950.db2.gz	IFJPTNKSCNDDRC-ICSRJNTNSA-N	0	3	336.435	3.192	20	30		EGEDHN
C[C@@H]1CCN(CCNC(=O)c2ccccc2-c2ccccc2C#N)C1	ZINC000525293422	459444302	/nfs/dbraw/zinc/44/43/02/459444302.db2.gz	YHBXTABSLKEVPX-MRXNPFEDSA-N	0	3	333.435	3.297	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N1CCC(C(F)F)CC1)C(C)C	ZINC000485565068	459460395	/nfs/dbraw/zinc/46/03/95/459460395.db2.gz	RUOMQQQNINYVDA-INIZCTEOSA-N	0	3	343.462	3.372	20	30		EGEDHN
CC[C@@H](CN1CCCC1)NC(=O)N(C)[C@@H](C)c1cccc(C#N)c1	ZINC000591869615	459460359	/nfs/dbraw/zinc/46/03/59/459460359.db2.gz	DRZXBZBMFJLNMO-YJBOKZPZSA-N	0	3	328.460	3.135	20	30		EGEDHN
N#Cc1ccc2c(c1)CCCC[C@H]2NCc1ccc2c(c1)C(=O)NCC2	ZINC000569541959	459466941	/nfs/dbraw/zinc/46/69/41/459466941.db2.gz	PSRNMEZCCWVVDE-OAQYLSRUSA-N	0	3	345.446	3.401	20	30		EGEDHN
COc1ccccc1[C@H](CNc1ccnc(C#N)c1)N1CCCCC1	ZINC000583160809	459494084	/nfs/dbraw/zinc/49/40/84/459494084.db2.gz	RKQNAKILXKSATM-IBGZPJMESA-N	0	3	336.439	3.023	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)c2ccc(C#N)[nH]2)N(CC)CC)cc1	ZINC000562189690	459517577	/nfs/dbraw/zinc/51/75/77/459517577.db2.gz	IGOBBUDHEAISIW-IBGZPJMESA-N	0	3	338.455	3.262	20	30		EGEDHN
N#CC[C@H]1CCCN(C(=O)NC[C@H](c2cccs2)N2CCCC2)C1	ZINC000596092005	459517597	/nfs/dbraw/zinc/51/75/97/459517597.db2.gz	HFWMQKOICCJDJO-HZPDHXFCSA-N	0	3	346.500	3.220	20	30		EGEDHN
C[C@@H](C(=O)N(C)CC(C)(C)C#N)N1CCC(Cc2ccccc2)CC1	ZINC000497406974	459532982	/nfs/dbraw/zinc/53/29/82/459532982.db2.gz	IYKCJDZUSJATBZ-KRWDZBQOSA-N	0	3	341.499	3.338	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1Nc1nc(C#N)c(Cl)s1	ZINC000596151841	459538808	/nfs/dbraw/zinc/53/88/08/459538808.db2.gz	BLDOBBWSOZHBMS-JSGCOSHPSA-N	0	3	346.887	3.413	20	30		EGEDHN
Cc1cc(CN2CC[C@H](C(=O)NCc3ccccc3)C2)ccc1C#N	ZINC000592156287	459539251	/nfs/dbraw/zinc/53/92/51/459539251.db2.gz	WZYONLUQZSSVTC-FQEVSTJZSA-N	0	3	333.435	3.005	20	30		EGEDHN
N#Cc1cccc(OCCCN[C@H](CCO)c2ccccc2F)c1	ZINC000592162230	459541370	/nfs/dbraw/zinc/54/13/70/459541370.db2.gz	VRKYZKVOSPXVPA-LJQANCHMSA-N	0	3	328.387	3.180	20	30		EGEDHN
C[C@H]1C[C@@H](Nc2nc(C#N)c(Cl)s2)CN1Cc1ccccc1	ZINC000596160879	459543696	/nfs/dbraw/zinc/54/36/96/459543696.db2.gz	JFKWFHBHXQNEJF-WCQYABFASA-N	0	3	332.860	3.165	20	30		EGEDHN
C=CCn1cccc1C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000488899958	459555619	/nfs/dbraw/zinc/55/56/19/459555619.db2.gz	IMBJWBJJQJXSKY-LJQANCHMSA-N	0	3	337.467	3.411	20	30		EGEDHN
CN(C)[C@@H](CNc1c(C#N)cnn1C)c1cccc(C(F)(F)F)c1	ZINC000596196325	459557480	/nfs/dbraw/zinc/55/74/80/459557480.db2.gz	SCWXIIOEZQPAFG-AWEZNQCLSA-N	0	3	337.349	3.025	20	30		EGEDHN
C=C[C@H]1CCCCN1C[C@H](O)COc1ccc(Br)cc1	ZINC000489487469	459565879	/nfs/dbraw/zinc/56/58/79/459565879.db2.gz	VNHNOYWDCWSTRY-GJZGRUSLSA-N	0	3	340.261	3.229	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN2CCC[C@@H]2[C@H]2CCCOC2)c1C	ZINC000571795405	459573121	/nfs/dbraw/zinc/57/31/21/459573121.db2.gz	WZGBYKALZSBLJG-PKOBYXMFSA-N	0	3	330.472	3.365	20	30		EGEDHN
C[C@@H](NC(C)(C)CNC(=O)N1CCC(CC#N)CC1)c1ccccc1	ZINC000542896186	459607847	/nfs/dbraw/zinc/60/78/47/459607847.db2.gz	LXSGUAKSPJFLJT-MRXNPFEDSA-N	0	3	342.487	3.451	20	30		EGEDHN
C#C[C@@H](NC1CCN(CCCC(=O)OC)CC1)c1ccc(Cl)cc1	ZINC000491309402	459615200	/nfs/dbraw/zinc/61/52/00/459615200.db2.gz	ZEACDWDLUMSIAY-GOSISDBHSA-N	0	3	348.874	3.022	20	30		EGEDHN
C#C[C@H](NC1CCN(CCCC(=O)OC)CC1)c1ccc(Cl)cc1	ZINC000491309409	459616507	/nfs/dbraw/zinc/61/65/07/459616507.db2.gz	ZEACDWDLUMSIAY-SFHVURJKSA-N	0	3	348.874	3.022	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)[C@@]2(C#N)CC23CCCC3)N(C)C)cc1	ZINC000573069584	459619548	/nfs/dbraw/zinc/61/95/48/459619548.db2.gz	ORFADVKFGAAKRR-NQIIRXRSSA-N	0	3	339.483	3.442	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC2(c3ccc(F)cc3)CCC2)CC1	ZINC000592521789	459623781	/nfs/dbraw/zinc/62/37/81/459623781.db2.gz	MUUGMBJRRLOXIV-UHFFFAOYSA-N	0	3	331.435	3.155	20	30		EGEDHN
N#Cc1cnc(NCC2(N3CCSCC3)CCCCC2)c(F)c1	ZINC000562720329	459632102	/nfs/dbraw/zinc/63/21/02/459632102.db2.gz	WOUDYOWYTLEWJZ-UHFFFAOYSA-N	0	3	334.464	3.256	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H]2CC[C@@H](c3ccc(Cl)cc3)C2)CC1	ZINC000491556769	459637406	/nfs/dbraw/zinc/63/74/06/459637406.db2.gz	YYVDUZWCKNZTOR-MJGOQNOKSA-N	0	3	344.886	3.438	20	30		EGEDHN
C=CCN1CC[C@H](N[C@@H]2CCCC[C@H]2Oc2ccccc2C)C1=O	ZINC000499647633	459644229	/nfs/dbraw/zinc/64/42/29/459644229.db2.gz	QPDWKCYCINGDHE-ZIFCJYIRSA-N	0	3	328.456	3.062	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H]2CC[C@H](c3cccc(Cl)c3)C2)CC1	ZINC000491752466	459667928	/nfs/dbraw/zinc/66/79/28/459667928.db2.gz	MHJMSWQUFGCUPU-HKUYNNGSSA-N	0	3	344.886	3.438	20	30		EGEDHN
C[C@H](OC[C@@H](O)CNCC#Cc1ccccc1)c1ccc(Cl)cc1	ZINC000562987049	459686676	/nfs/dbraw/zinc/68/66/76/459686676.db2.gz	UWACKCLAKWUQGZ-JXFKEZNVSA-N	0	3	343.854	3.420	20	30		EGEDHN
C#CCCN1CCC(NC(=O)/C=C/c2ccc(OC(C)C)cc2)CC1	ZINC000492087632	459690989	/nfs/dbraw/zinc/69/09/89/459690989.db2.gz	KAZPMNDVJUMAPB-DHZHZOJOSA-N	0	3	340.467	3.091	20	30		EGEDHN
N#CCCCNC[C@@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000563014485	459695321	/nfs/dbraw/zinc/69/53/21/459695321.db2.gz	XARYMIVYVKGSFT-MRXNPFEDSA-N	0	3	326.396	3.112	20	30		EGEDHN
CN(C)CCN(CC1CCCCC1)C(=O)CCc1ccc(C#N)cc1	ZINC000501235323	459717598	/nfs/dbraw/zinc/71/75/98/459717598.db2.gz	CTTCFJHYNMQWHE-UHFFFAOYSA-N	0	3	341.499	3.461	20	30		EGEDHN
CCCCCC(=O)NC1CCN(Cc2ccc(CC#N)cc2)CC1	ZINC000544060691	459723628	/nfs/dbraw/zinc/72/36/28/459723628.db2.gz	UIQKTVHCYYOEIH-UHFFFAOYSA-N	0	3	327.472	3.414	20	30		EGEDHN
C=CCN1CCC(NC(=O)/C=C\Sc2cc(F)ccc2F)CC1	ZINC000492955234	459727317	/nfs/dbraw/zinc/72/73/17/459727317.db2.gz	POSSAXUVUQTTHJ-XFFZJAGNSA-N	0	3	338.423	3.337	20	30		EGEDHN
C=CCc1cc(CNCc2ccc3cn(C)nc3c2)cc(OC)c1O	ZINC000527764535	459728803	/nfs/dbraw/zinc/72/88/03/459728803.db2.gz	VPBJVGUEQHASEX-UHFFFAOYSA-N	0	3	337.423	3.306	20	30		EGEDHN
N#CC1(CC(=O)NCC2(N3CCSCC3)CCCC2)CCCCC1	ZINC000596795868	459764697	/nfs/dbraw/zinc/76/46/97/459764697.db2.gz	YHFGUZQETFKRMU-UHFFFAOYSA-N	0	3	349.544	3.328	20	30		EGEDHN
N#CCc1ccnc(NC(=O)c2ccc(CN3CCCCC3)cc2)c1	ZINC000563802975	459768098	/nfs/dbraw/zinc/76/80/98/459768098.db2.gz	QGDDNJVUFRFDFX-UHFFFAOYSA-N	0	3	334.423	3.386	20	30		EGEDHN
C[C@@H]1CCCc2ccccc2[C@@H]1NCc1cnc2c(C#N)cnn2c1	ZINC000574205796	459791047	/nfs/dbraw/zinc/79/10/47/459791047.db2.gz	LHLPLSJWRAMNSK-AUUYWEPGSA-N	0	3	331.423	3.404	20	30		EGEDHN
C=CCOc1ccc(CNC[C@H](O)COc2ccccc2Cl)cc1	ZINC000566131283	459811362	/nfs/dbraw/zinc/81/13/62/459811362.db2.gz	YLJMTEMMGQFPRN-INIZCTEOSA-N	0	3	347.842	3.434	20	30		EGEDHN
COc1ccc(C#N)cc1NC(=O)NC[C@@H]1CCN1C1CCCCC1	ZINC000528950210	459819047	/nfs/dbraw/zinc/81/90/47/459819047.db2.gz	ALYBDOJJICBMRI-INIZCTEOSA-N	0	3	342.443	3.095	20	30		EGEDHN
COCc1ccc(NC(=O)NC[C@@H](C)N2CCCC[C@@H]2C)cc1C#N	ZINC000529211936	459825601	/nfs/dbraw/zinc/82/56/01/459825601.db2.gz	QCEUYVKXGOAGTO-LSDHHAIUSA-N	0	3	344.459	3.089	20	30		EGEDHN
C=C(C)Cn1c(N2CCN(C3CCCC3)CC2)nnc1C(C)(C)C	ZINC000574527630	459830593	/nfs/dbraw/zinc/83/05/93/459830593.db2.gz	JZODJEDXCAQWHO-UHFFFAOYSA-N	0	3	331.508	3.216	20	30		EGEDHN
CC(C)C[C@@H](C#N)NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000608822120	459887066	/nfs/dbraw/zinc/88/70/66/459887066.db2.gz	GOTIEZHRNDIJHH-AEFFLSMTSA-N	0	3	331.435	3.092	20	30		EGEDHN
Cc1ccc(N[C@@H](C)CC2(C#N)CCOCC2)c(OCCN(C)C)c1	ZINC000602496171	459968626	/nfs/dbraw/zinc/96/86/26/459968626.db2.gz	BORBIMUEQXVGOW-KRWDZBQOSA-N	0	3	345.487	3.446	20	30		EGEDHN
C[C@H](c1ccncc1)N1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000609487787	459970139	/nfs/dbraw/zinc/97/01/39/459970139.db2.gz	XLKZIMWJPBMFAK-OAHLLOKOSA-N	0	3	334.423	3.365	20	30		EGEDHN
CCOc1cncc(CNCCSCc2ccccc2C#N)c1	ZINC000598632563	459970789	/nfs/dbraw/zinc/97/07/89/459970789.db2.gz	ZLYXUOXRAXFTCY-UHFFFAOYSA-N	0	3	327.453	3.375	20	30		EGEDHN
C[C@H](NC(=O)N1CCC[C@@](C)(C#N)C1)[C@H](c1ccccc1)N(C)C	ZINC000588721190	459975244	/nfs/dbraw/zinc/97/52/44/459975244.db2.gz	XXJRRPSLRIYVEP-WDYCEAGBSA-N	0	3	328.460	3.013	20	30		EGEDHN
CC(C)(C)N1C[C@@H](C(=O)NCC2(C#N)CCCC2)[C@H](C(F)(F)F)C1	ZINC000593775470	459982129	/nfs/dbraw/zinc/98/21/29/459982129.db2.gz	MIJILEBJTVPTAZ-CHWSQXEVSA-N	0	3	345.409	3.095	20	30		EGEDHN
CCOc1cc(CN[C@H](C)CC2(C#N)CCOCC2)ccc1OC	ZINC000602548425	459992582	/nfs/dbraw/zinc/99/25/82/459992582.db2.gz	ZCALPXMUHHXTLX-OAHLLOKOSA-N	0	3	332.444	3.282	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CNCc1ccc(Oc2cccnc2)c(F)c1	ZINC000598701632	460000045	/nfs/dbraw/zinc/00/00/45/460000045.db2.gz	YBXMRINRNLPRPD-OAHLLOKOSA-N	0	3	343.402	3.403	20	30		EGEDHN
N#Cc1cccc(CN[C@H](Cc2ccccc2)[C@H](O)C(F)(F)F)c1	ZINC000609707817	460009792	/nfs/dbraw/zinc/00/97/92/460009792.db2.gz	YYZNPLXLPGQNEX-SJORKVTESA-N	0	3	334.341	3.182	20	30		EGEDHN
C[C@@H](CCC#N)CN[C@H](CO)c1ccc(Br)c(F)c1	ZINC000602671821	460057420	/nfs/dbraw/zinc/05/74/20/460057420.db2.gz	JYYZPYHSGOQPLE-IINYFYTJSA-N	0	3	329.213	3.151	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN(Cc1ccccn1)C(C)C	ZINC000610132768	460068514	/nfs/dbraw/zinc/06/85/14/460068514.db2.gz	CDCHVCYBVZCENN-UHFFFAOYSA-N	0	3	325.412	3.251	20	30		EGEDHN
C[C@H](CC1(C#N)CCOCC1)NCc1cccc2c1OC(F)(F)O2	ZINC000602720873	460084532	/nfs/dbraw/zinc/08/45/32/460084532.db2.gz	FIZSJGLFHKDEGI-GFCCVEGCSA-N	0	3	338.354	3.197	20	30		EGEDHN
C=CCOc1c(Cl)cc(CNCC(C)(C)C(=O)OC)cc1OC	ZINC000598968942	460109064	/nfs/dbraw/zinc/10/90/64/460109064.db2.gz	PRCMEEVZVIHFND-UHFFFAOYSA-N	0	3	341.835	3.202	20	30		EGEDHN
N#Cc1ccc(N2CCC(NCc3scnc3C3CC3)CC2)nc1	ZINC000618723775	460142645	/nfs/dbraw/zinc/14/26/45/460142645.db2.gz	PUVYAOACENQBHV-UHFFFAOYSA-N	0	3	339.468	3.046	20	30		EGEDHN
C[C@@H](NC(=O)N1CCCN(C(C)(C)C)CC1)c1cccc(C#N)c1	ZINC000610406892	460145040	/nfs/dbraw/zinc/14/50/40/460145040.db2.gz	IOIUYZDJORUIGC-OAHLLOKOSA-N	0	3	328.460	3.135	20	30		EGEDHN
C[C@H](C#N)CSc1ccccc1NC(=O)NCC1(N(C)C)CC1	ZINC000602834830	460151979	/nfs/dbraw/zinc/15/19/79/460151979.db2.gz	DWHRATKPCQOYFE-CYBMUJFWSA-N	0	3	332.473	3.154	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)C(=O)NC[C@@H](Cc1ccccc1)N(C)C	ZINC000594227020	460160761	/nfs/dbraw/zinc/16/07/61/460160761.db2.gz	QSNGQPRXSOBESQ-LAUBAEHRSA-N	0	3	349.478	3.026	20	30		EGEDHN
CC[C@@H]1CCCCN1CCNC(=O)[C@@H](C)Cc1ccc(C#N)cc1	ZINC000594297371	460183784	/nfs/dbraw/zinc/18/37/84/460183784.db2.gz	WSIXLYFBKUMQNW-QFBILLFUSA-N	0	3	327.472	3.118	20	30		EGEDHN
C[S@](=O)c1ccc(CNCc2cccc(OCCCC#N)c2)cc1	ZINC000610575028	460186087	/nfs/dbraw/zinc/18/60/87/460186087.db2.gz	ZAMKPLOFXLAZFO-DEOSSOPVSA-N	0	3	342.464	3.396	20	30		EGEDHN
Cc1cccc([C@@H](NC(=O)[C@H](N)CCCCC#N)C(F)(F)F)c1	ZINC000594435805	460219915	/nfs/dbraw/zinc/21/99/15/460219915.db2.gz	DYBZWZCTCKZFGV-ZIAGYGMSSA-N	0	3	327.350	3.126	20	30		EGEDHN
Cc1ccccc1[C@H]([C@H](C)NC(=O)Nc1ccnc(C#N)c1)N(C)C	ZINC000603125815	460247809	/nfs/dbraw/zinc/24/78/09/460247809.db2.gz	LWOBGWVIHKKARU-KSSFIOAISA-N	0	3	337.427	3.075	20	30		EGEDHN
C[C@H](NC(C)(C)CNC(=O)Nc1ccnc(C#N)c1)c1ccccc1	ZINC000603127436	460248864	/nfs/dbraw/zinc/24/88/64/460248864.db2.gz	DUPHEVOTXNZPFP-AWEZNQCLSA-N	0	3	337.427	3.204	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)Nc2ccnc(C#N)c2)CCN1Cc1ccccc1	ZINC000603132905	460249946	/nfs/dbraw/zinc/24/99/46/460249946.db2.gz	ZVMKHNXDTBUWJZ-QAPCUYQASA-N	0	3	349.438	3.128	20	30		EGEDHN
Cc1cc(Cl)cc2c1OCCC[C@@H]2NC1CCN(CC#N)CC1	ZINC000610898277	460258372	/nfs/dbraw/zinc/25/83/72/460258372.db2.gz	IHMRQOXCUJTYKK-KRWDZBQOSA-N	0	3	333.863	3.440	20	30		EGEDHN
COCc1cc(C#N)ccc1NC1CCN(CCOC(C)C)CC1	ZINC000603304547	460281083	/nfs/dbraw/zinc/28/10/83/460281083.db2.gz	MOOMRTXCXUVARZ-UHFFFAOYSA-N	0	3	331.460	3.006	20	30		EGEDHN
C[C@H](NC[C@@H](O)COc1ccc(Cl)cc1)c1cccc(C#N)c1	ZINC000611387283	460351145	/nfs/dbraw/zinc/35/11/45/460351145.db2.gz	JFPMNWMHSMTUJN-SUMWQHHRSA-N	0	3	330.815	3.302	20	30		EGEDHN
CCOc1ccc(OC[C@H](O)CN[C@H](C)c2cccc(C#N)c2)cc1	ZINC000611388963	460351183	/nfs/dbraw/zinc/35/11/83/460351183.db2.gz	OLXFECDRLKKEHG-CRAIPNDOSA-N	0	3	340.423	3.047	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2NCCC(=O)NC1CCCCC1	ZINC000611391094	460352681	/nfs/dbraw/zinc/35/26/81/460352681.db2.gz	SBRWTQBRSJUGTD-LJQANCHMSA-N	0	3	325.456	3.364	20	30		EGEDHN
CCOC(=O)CC[C@H]1CCCN(Cc2ccc(C#N)c(OC)c2)C1	ZINC000619674556	460408830	/nfs/dbraw/zinc/40/88/30/460408830.db2.gz	XKUYXSNKTCUXAM-OAHLLOKOSA-N	0	3	330.428	3.122	20	30		EGEDHN
CCN(Cc1ccc(C)cc1)C[C@H](O)COc1ccc(CC#N)cc1	ZINC000604501433	460435970	/nfs/dbraw/zinc/43/59/70/460435970.db2.gz	QJCBGXAQNUWXNR-FQEVSTJZSA-N	0	3	338.451	3.323	20	30		EGEDHN
CC(C)[C@H](C(=O)NCc1ccc(C#N)c(Cl)c1)N1CCCCC1	ZINC000619780780	460442382	/nfs/dbraw/zinc/44/23/82/460442382.db2.gz	BNHZWAYIOCNXCS-QGZVFWFLSA-N	0	3	333.863	3.338	20	30		EGEDHN
CC(C)(NC(=O)C(C#N)CCc1ccccc1)C(=O)Nc1ccccc1	ZINC000600225778	460448775	/nfs/dbraw/zinc/44/87/75/460448775.db2.gz	AEEAGQSIWVWNNT-QGZVFWFLSA-N	0	3	349.434	3.292	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1c(F)cccc1[N+](=O)[O-])C(C)C	ZINC000601164926	460737726	/nfs/dbraw/zinc/73/77/26/460737726.db2.gz	INZPWACKFGKBTC-INIZCTEOSA-N	0	3	349.406	3.162	20	30		EGEDHN
COc1cc(CN(C)C)ccc1NC(=O)CCc1ccc(C#N)cc1	ZINC000601623184	460849301	/nfs/dbraw/zinc/84/93/01/460849301.db2.gz	YQQXWXOMAXTBFI-UHFFFAOYSA-N	0	3	337.423	3.200	20	30		EGEDHN
C=CCC[C@@H](CO)NCc1cc(Cl)ccc1OC[C@H]1CCCO1	ZINC000641759586	461356093	/nfs/dbraw/zinc/35/60/93/461356093.db2.gz	GVFJSYNDRBKQCM-DLBZAZTESA-N	0	3	339.863	3.315	20	30		EGEDHN
C=CCN(C(=O)NC[C@H](N)c1ccc(C(C)C)cc1)[C@H](C)COC	ZINC000659510903	461369687	/nfs/dbraw/zinc/36/96/87/461369687.db2.gz	CMHXRLWGMPIOPH-QAPCUYQASA-N	0	3	333.476	3.042	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)NCC#Cc2ccccc2)N(C)C)cc1	ZINC000642637618	461541802	/nfs/dbraw/zinc/54/18/02/461541802.db2.gz	FWXAATOVHGKOMQ-OAQYLSRUSA-N	0	3	349.478	3.203	20	30		EGEDHN
C=CCCC(C)(C)NC(=O)Nc1cc(C)nn1C1CCN(C)CC1	ZINC000666283418	461547153	/nfs/dbraw/zinc/54/71/53/461547153.db2.gz	RWYZVUNLCUXMBY-UHFFFAOYSA-N	0	3	333.480	3.325	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCC[C@@H]([C@@H]3CCCCO3)C2)CC1	ZINC000660597453	461871098	/nfs/dbraw/zinc/87/10/98/461871098.db2.gz	PKNQLVOKTVGGGY-MJGOQNOKSA-N	0	3	349.519	3.018	20	30		EGEDHN
C=CC[C@H]1N(C(=O)NC2CCN([C@@H]3CCOC3)CC2)CCCC1(C)C	ZINC000666977158	461896107	/nfs/dbraw/zinc/89/61/07/461896107.db2.gz	XJMIWFQTZUCOBG-QZTJIDSGSA-N	0	3	349.519	3.016	20	30		EGEDHN
C=CCCn1cc(CNC[C@H]2CCCN(C)[C@H]2c2cccs2)nn1	ZINC000657374869	462081053	/nfs/dbraw/zinc/08/10/53/462081053.db2.gz	TZQSZNONMNTDAM-CRAIPNDOSA-N	0	3	345.516	3.088	20	30		EGEDHN
C=CC[C@H]1CCCN(CC(=O)N2CCc3[nH]c4ccccc4c3C2)C1	ZINC000661381424	462224448	/nfs/dbraw/zinc/22/44/48/462224448.db2.gz	KMKABZYPMQDZAJ-INIZCTEOSA-N	0	3	337.467	3.341	20	30		EGEDHN
CC(C)(C#N)c1ccc(NC(=O)N2CCC(N3CC=CC3)CC2)cc1	ZINC000102316825	518506513	/nfs/dbraw/zinc/50/65/13/518506513.db2.gz	UEHVVXDKYRRICQ-UHFFFAOYSA-N	0	3	338.455	3.356	20	30		EGEDHN
Cc1sc(NC(=O)CN[C@H](CCO)C2CCCCC2)c(C#N)c1C	ZINC000181496105	534613258	/nfs/dbraw/zinc/61/32/58/534613258.db2.gz	DFHXTDVHTLACMH-MRXNPFEDSA-N	0	3	349.500	3.096	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](CC)c2ccccc2OCC)CC1	ZINC000171731240	526437783	/nfs/dbraw/zinc/43/77/83/526437783.db2.gz	RNLBBSLAJORTFB-SFHVURJKSA-N	0	3	345.487	3.486	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(C3CC3)nc3ccccc32)CC1	ZINC000171723670	526446323	/nfs/dbraw/zinc/44/63/23/526446323.db2.gz	MNKWHXMDUVRBOR-UHFFFAOYSA-N	0	3	335.451	3.492	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cccnc2SC(F)(F)F)CC1	ZINC000171714757	526448967	/nfs/dbraw/zinc/44/89/67/526448967.db2.gz	VELMGMFZUQIKLJ-UHFFFAOYSA-N	0	3	345.390	3.074	20	30		EGEDHN
N#CCc1ccc(OC[C@H](O)CN2CCC[C@@H]2c2ccccc2)cc1	ZINC000025305929	526485885	/nfs/dbraw/zinc/48/58/85/526485885.db2.gz	SIMVSEIQFYZBSC-TZIWHRDSSA-N	0	3	336.435	3.329	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(Cl)c(N)c(Cl)c2)CC1	ZINC000153115160	526599445	/nfs/dbraw/zinc/59/94/45/526599445.db2.gz	QRLVHKQYYWZMOI-UHFFFAOYSA-N	0	3	342.270	3.346	20	30		EGEDHN
C#CCCCCC(=O)NC[C@H](c1cccc(OC)c1)N1CCCC1	ZINC000179644735	526688209	/nfs/dbraw/zinc/68/82/09/526688209.db2.gz	XVJWUOAGQTXYLB-LJQANCHMSA-N	0	3	328.456	3.142	20	30		EGEDHN
CCN1CCCC[C@@H]1CNC(=O)[C@@H]1CCCC[C@@H]1C(=O)N1CCCC1	ZINC000329237629	547492800	/nfs/dbraw/zinc/49/28/00/547492800.db2.gz	KLFMIRUQWGTEHN-KURKYZTESA-N	0	3	349.519	3.246	20	30		EGEDHN
C#CCCCCC(=O)NCC1CCN(Cc2ccccc2F)CC1	ZINC000378406008	547819944	/nfs/dbraw/zinc/81/99/44/547819944.db2.gz	RUZFKHUBWIKUKE-UHFFFAOYSA-N	0	3	330.447	3.348	20	30		EGEDHN
CCN(CCO)c1ccc(C=NNCCCc2ccccc2)c(C)c1	ZINC000729145925	574818390	/nfs/dbraw/zinc/81/83/90/574818390.db2.gz	HODSPLONGHPAMQ-UHFFFAOYSA-N	0	3	339.483	3.370	20	30		EGEDHN
CCCCNC(=O)[C@H]1CC[C@H](C)N(Cc2ccc(OCC#N)cc2)C1	ZINC000729268188	574834497	/nfs/dbraw/zinc/83/44/97/574834497.db2.gz	PPPXQBHMJLNGGK-WMZOPIPTSA-N	0	3	343.471	3.106	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)C[N@H+](Cc1ccccc1[O-])C1CCCC1	ZINC000732204724	575244559	/nfs/dbraw/zinc/24/45/59/575244559.db2.gz	QLUVTAJOAWTXST-MRXNPFEDSA-N	0	3	343.471	3.145	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)C[N@@H+](Cc1ccccc1[O-])C1CCCC1	ZINC000732204724	575244562	/nfs/dbraw/zinc/24/45/62/575244562.db2.gz	QLUVTAJOAWTXST-MRXNPFEDSA-N	0	3	343.471	3.145	20	30		EGEDHN
Clc1nccnc1N=NC1CCN(CCc2ccccc2)CC1	ZINC000733080280	575306189	/nfs/dbraw/zinc/30/61/89/575306189.db2.gz	IQSIRLGFMAMZRY-UHFFFAOYSA-N	0	3	329.835	3.236	20	30		EGEDHN
C#CCOc1ccc(CNCCN(CC)C(=O)OC(C)(C)C)cc1	ZINC000733327219	575327876	/nfs/dbraw/zinc/32/78/76/575327876.db2.gz	PWWNXZVKQJKMFV-UHFFFAOYSA-N	0	3	332.444	3.045	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)[C@H]3COc4ccccc4C3)nc21	ZINC000735792353	575715044	/nfs/dbraw/zinc/71/50/44/575715044.db2.gz	KVZYWBBNHUPUPK-CABCVRRESA-N	0	3	331.375	3.299	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2[nH]c3ccccc3c2Cl)CC1	ZINC000740737432	576621757	/nfs/dbraw/zinc/62/17/57/576621757.db2.gz	CZZNPSVRLOIBAW-UHFFFAOYSA-N	0	3	329.831	3.039	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2cc3ccc(Cl)cc3[nH]2)CC1	ZINC000740737257	576621785	/nfs/dbraw/zinc/62/17/85/576621785.db2.gz	HVLZKXDMKQJPDM-UHFFFAOYSA-N	0	3	329.831	3.039	20	30		EGEDHN
C#CCCN1CCC(NC(=O)C2(c3cccc(F)c3)CCCC2)CC1	ZINC000740736549	576621790	/nfs/dbraw/zinc/62/17/90/576621790.db2.gz	ZIXGYYIEXKTYHO-UHFFFAOYSA-N	0	3	342.458	3.241	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2ccc(SC(F)F)cc2)CC1	ZINC000740737661	576622111	/nfs/dbraw/zinc/62/21/11/576622111.db2.gz	HUELSFNSBYNWNG-UHFFFAOYSA-N	0	3	338.423	3.219	20	30		EGEDHN
C#CCOc1cc(F)ccc1NC(=O)NC[C@H](C)N1CCC(C)CC1	ZINC000743195449	576803012	/nfs/dbraw/zinc/80/30/12/576803012.db2.gz	XLJCUKRUCIQJAT-HNNXBMFYSA-N	0	3	347.434	3.080	20	30		EGEDHN
C#CCOc1ccc(F)cc1NC(=O)NCCN1CCCC[C@@H]1CC	ZINC000743203466	576803411	/nfs/dbraw/zinc/80/34/11/576803411.db2.gz	JDTZRGBYODEWGX-INIZCTEOSA-N	0	3	347.434	3.224	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)[C@@H](C)c1ccc(C)o1	ZINC000744031119	576819156	/nfs/dbraw/zinc/81/91/56/576819156.db2.gz	QUMVYFGWPFPSDU-KBPBESRZSA-N	0	3	340.379	3.438	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N[C@@H]1CC[C@@H](SC)C1)C(C)C	ZINC000745537858	576849505	/nfs/dbraw/zinc/84/95/05/576849505.db2.gz	WEKFNVRLLDXPFN-BRWVUGGUSA-N	0	3	339.549	3.268	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)CCc1cc(F)ccc1F	ZINC000066506070	1292119732	/nfs/dbraw/zinc/11/97/32/1292119732.db2.gz	ZXDTUHDERSSOGI-HNNXBMFYSA-N	0	3	336.382	3.303	20	30		EGEDHN
C#CC[C@H](NC[C@H]1CN(C2CCCCC2)C(=O)O1)c1ccccc1	ZINC000828154982	1292436912	/nfs/dbraw/zinc/43/69/12/1292436912.db2.gz	IASBCSJWSHYAIU-OALUTQOASA-N	0	3	326.440	3.494	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@@H](C)CCc1cccc(F)c1	ZINC000076818803	1292444269	/nfs/dbraw/zinc/44/42/69/1292444269.db2.gz	KPZMTTVDEQRWFK-WMLDXEAASA-N	0	3	332.419	3.410	20	30		EGEDHN
C#CCN1CCC(C(=O)NC[C@@H]2CCC(C)(C)c3ccccc32)CC1	ZINC000091803696	1292843521	/nfs/dbraw/zinc/84/35/21/1292843521.db2.gz	GGTFHYOLJPGFHC-SFHVURJKSA-N	0	3	338.495	3.303	20	30		EGEDHN
CCCC(=O)NC[C@H]1CCCN(Cc2ccc(O[C@@H](C)C#N)cc2)C1	ZINC000092707637	1292885970	/nfs/dbraw/zinc/88/59/70/1292885970.db2.gz	QVHWOSDGPHQIBL-FUHWJXTLSA-N	0	3	343.471	3.106	20	30		EGEDHN
C#CCOc1ccccc1CN1CCC[C@H](CNC(=O)C(C)(C)C)C1	ZINC000093281825	1292914212	/nfs/dbraw/zinc/91/42/12/1292914212.db2.gz	OEOLVYTVXDABSE-QGZVFWFLSA-N	0	3	342.483	3.073	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)CCC(=O)c1ccccc1	ZINC000097261755	1292959435	/nfs/dbraw/zinc/95/94/35/1292959435.db2.gz	CMQVNOZCYBQAIS-HNNXBMFYSA-N	0	3	331.375	3.413	20	30		EGEDHN
COc1cc(Cl)c(C)cc1NC(=O)C(C#N)C(=O)[C@@H](C)SC	ZINC000103330092	1293002621	/nfs/dbraw/zinc/00/26/21/1293002621.db2.gz	PXOVDBUITBSDCY-ZJUUUORDSA-N	0	3	340.832	3.056	20	30		EGEDHN
C=CCSCCNCc1cc(OC)c(OC)cc1Br	ZINC000105462615	1293039684	/nfs/dbraw/zinc/03/96/84/1293039684.db2.gz	STVDTAVJHLPGOX-UHFFFAOYSA-N	0	3	346.290	3.475	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)CCCC(=O)C(C)(C)C)c1	ZINC000835060878	1293195924	/nfs/dbraw/zinc/19/59/24/1293195924.db2.gz	GQHFOWSOHHLZTP-HNNXBMFYSA-N	0	3	344.411	3.128	20	30		EGEDHN
N#CC(C(=O)CCCC(=O)C1CC1)C(=O)Nc1ccccc1Cl	ZINC000835063203	1293196499	/nfs/dbraw/zinc/19/64/99/1293196499.db2.gz	IJQYSYNFVUFLDN-LBPRGKRZSA-N	0	3	332.787	3.137	20	30		EGEDHN
CN(C)Cc1cccc(C(=O)OC[C@@H](C#N)Cc2cccs2)c1	ZINC000835261667	1293247158	/nfs/dbraw/zinc/24/71/58/1293247158.db2.gz	WWQTWAAZPRZQRQ-OAHLLOKOSA-N	0	3	328.437	3.349	20	30		EGEDHN
CC(C)(C)c1ccc(C([O-])=C(C#N)C(=O)Nc2ccccn2)s1	ZINC000122124463	1293402306	/nfs/dbraw/zinc/40/23/06/1293402306.db2.gz	RFABHZQSQIXOAB-NSHDSACASA-N	0	3	327.409	3.402	20	30		EGEDHN
CC(C)(C)c1ccc(C(=O)C(C#N)C(=O)Nc2ccccn2)s1	ZINC000122124463	1293402309	/nfs/dbraw/zinc/40/23/09/1293402309.db2.gz	RFABHZQSQIXOAB-NSHDSACASA-N	0	3	327.409	3.402	20	30		EGEDHN
CC(C)N1CCN(c2cccc(NC(=O)c3cccc(C#N)c3)c2)CC1	ZINC000122449172	1293412824	/nfs/dbraw/zinc/41/28/24/1293412824.db2.gz	UESJOPMMBVQZLV-UHFFFAOYSA-N	0	3	348.450	3.341	20	30		EGEDHN
N#CC(C(=O)CCc1ccc(Cl)cc1)C(=O)Nc1ccccn1	ZINC000125052318	1293493604	/nfs/dbraw/zinc/49/36/04/1293493604.db2.gz	WWKWIBXXCBTVAL-AWEZNQCLSA-N	0	3	327.771	3.015	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)COc2ccc(C)cc2C)c1	ZINC000127544148	1293567080	/nfs/dbraw/zinc/56/70/80/1293567080.db2.gz	YJOQFPPALMPBHP-KRWDZBQOSA-N	0	3	336.391	3.338	20	30		EGEDHN
N#CC(C(=O)CCCOCc1ccccc1)C(=O)Nc1ccccc1	ZINC000127656202	1293570259	/nfs/dbraw/zinc/57/02/59/1293570259.db2.gz	CKGSVLFELUNTKN-SFHVURJKSA-N	0	3	336.391	3.331	20	30		EGEDHN
C=CCOc1ccc(CN2CCC[C@H]2CC(=O)OCC)cc1OC	ZINC000130518668	1293660441	/nfs/dbraw/zinc/66/04/41/1293660441.db2.gz	CZTMPZLIBLMDRR-INIZCTEOSA-N	0	3	333.428	3.178	20	30		EGEDHN
C#CCCOc1ccc(CNC(C)(C)C(=O)NCC2CCCC2)cc1	ZINC000136024195	1293806974	/nfs/dbraw/zinc/80/69/74/1293806974.db2.gz	OSJMDWPDTNCOMZ-UHFFFAOYSA-N	0	3	342.483	3.263	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)C[C@H](C)c1ccccc1C(F)(F)F	ZINC000173983827	1294475395	/nfs/dbraw/zinc/47/53/95/1294475395.db2.gz	UGBBGRIKUPDGLK-WCQYABFASA-N	0	3	340.345	3.432	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)C[C@H](C)c1ccccc1C(F)(F)F	ZINC000173983816	1294475525	/nfs/dbraw/zinc/47/55/25/1294475525.db2.gz	UGBBGRIKUPDGLK-AAEUAGOBSA-N	0	3	340.345	3.432	20	30		EGEDHN
COc1csc(C(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)c1	ZINC000177596490	1294679050	/nfs/dbraw/zinc/67/90/50/1294679050.db2.gz	YTRQWPPFQZJEEG-LBPRGKRZSA-N	0	3	334.784	3.371	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)C[C@@H](C)C(=O)c1cccc(F)c1	ZINC000177594907	1294679621	/nfs/dbraw/zinc/67/96/21/1294679621.db2.gz	XXQLPRVCPLMYKK-CJNGLKHVSA-N	0	3	346.402	3.050	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)c2cc(OC)cs2)cc1	ZINC000177599437	1294679994	/nfs/dbraw/zinc/67/99/94/1294679994.db2.gz	CAVYYHGWJHEVGQ-AWEZNQCLSA-N	0	3	328.393	3.280	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCCCCCCSC)CC1	ZINC000182518433	1295055161	/nfs/dbraw/zinc/05/51/61/1295055161.db2.gz	GQGWNNDYDZXFCX-UHFFFAOYSA-N	0	3	327.538	3.250	20	30		EGEDHN
C[C@@H](CNC(=O)/C=C\c1ccccc1C#N)N(C)Cc1ccccc1	ZINC000255125601	1296502175	/nfs/dbraw/zinc/50/21/75/1296502175.db2.gz	HKTMYVYMTBFSPV-QOHRORDFSA-N	0	3	333.435	3.208	20	30		EGEDHN
N#CC(C(=O)C=Cc1nc2ccccc2s1)C(=O)Nc1ccccn1	ZINC000255863588	1296571965	/nfs/dbraw/zinc/57/19/65/1296571965.db2.gz	GKRUUAVTQSIGQN-LAUAKBEESA-N	0	3	348.387	3.052	20	30		EGEDHN
C#CCOc1ccccc1CNCCN(C(=O)OC(C)(C)C)C1CC1	ZINC000381017540	1297549576	/nfs/dbraw/zinc/54/95/76/1297549576.db2.gz	VSQPSCIBUJRJJX-UHFFFAOYSA-N	0	3	344.455	3.188	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2c(C)occ2C(F)(F)F)CC1	ZINC000874436369	1297887709	/nfs/dbraw/zinc/88/77/09/1297887709.db2.gz	DHJZPXPWADIBIS-UHFFFAOYSA-N	0	3	330.350	3.377	20	30		EGEDHN
CC[C@@](C)(C#N)C(=O)N(C)C[C@H]1CCCCN1Cc1ccccc1	ZINC000719963900	1298324729	/nfs/dbraw/zinc/32/47/29/1298324729.db2.gz	VICIZUGSBZCYHF-QUCCMNQESA-N	0	3	327.472	3.439	20	30		EGEDHN
COCCN(CCC(=O)OC(C)(C)C)[C@H](C)c1ccc(C#N)cc1	ZINC000746660785	1298636546	/nfs/dbraw/zinc/63/65/46/1298636546.db2.gz	ZXGWNFNAMYLUFX-OAHLLOKOSA-N	0	3	332.444	3.299	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)[C@@H](C)c1ccc(Cl)c(Cl)c1	ZINC000747108832	1298728118	/nfs/dbraw/zinc/72/81/18/1298728118.db2.gz	KEZKOHMITNAONW-ONGXEEELSA-N	0	3	327.211	3.330	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@H]2C[C@H](O)c2ccc(F)cc2)n1	ZINC000876808997	1299003008	/nfs/dbraw/zinc/00/30/08/1299003008.db2.gz	OQONPGILVLFZQK-MOPGFXCFSA-N	0	3	325.387	3.180	20	30		EGEDHN
COCC1(C)CCN(CC[C@@](C#N)(C(C)=O)c2ccccc2)CC1	ZINC000878343942	1299931703	/nfs/dbraw/zinc/93/17/03/1299931703.db2.gz	NMPARZRRFYJSFX-HXUWFJFHSA-N	0	3	328.456	3.176	20	30		EGEDHN
CCC(C)(C)N1CCN(CC[C@](C#N)(C(C)=O)c2ccccc2)CC1	ZINC000878846426	1300223868	/nfs/dbraw/zinc/22/38/68/1300223868.db2.gz	VJKGJOOJDYCKEM-NRFANRHFSA-N	0	3	341.499	3.233	20	30		EGEDHN
CN(C1CCCC1)C(C)(C)C(=O)OCCOc1cccc(C#N)c1	ZINC000754874394	1300236549	/nfs/dbraw/zinc/23/65/49/1300236549.db2.gz	SUGQVFNRDJMBPZ-UHFFFAOYSA-N	0	3	330.428	3.133	20	30		EGEDHN
C=CCc1cc(C(=O)OCCN2CCCCC2)cc(OC)c1OC	ZINC000755413324	1300337311	/nfs/dbraw/zinc/33/73/11/1300337311.db2.gz	LTYYLGNPYYMEFV-UHFFFAOYSA-N	0	3	333.428	3.075	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc1	ZINC000758200912	1300811121	/nfs/dbraw/zinc/81/11/21/1300811121.db2.gz	FXSAARNELMUZOZ-XLIONFOSSA-N	0	3	348.446	3.091	20	30		EGEDHN
CCCCCCCC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CO	ZINC000762111403	1301616591	/nfs/dbraw/zinc/61/65/91/1301616591.db2.gz	KFJLTHXRNABONI-WOJBJXKFSA-N	0	3	346.515	3.346	20	30		EGEDHN
COc1cc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)ccc1F	ZINC000763478939	1301911712	/nfs/dbraw/zinc/91/17/12/1301911712.db2.gz	RKERSGJRGQPELR-NSHDSACASA-N	0	3	346.745	3.449	20	30		EGEDHN
N#Cc1ccc(NC(=O)NC[C@@H]2CCCCN2C2CC2)cc1Cl	ZINC000765663828	1302300285	/nfs/dbraw/zinc/30/02/85/1302300285.db2.gz	RKHHWCWALKVCSV-HNNXBMFYSA-N	0	3	332.835	3.350	20	30		EGEDHN
C[C@@H]1CCN(CC(=O)C(C#N)c2nc3ccccc3s2)C[C@@H]1C	ZINC000766984824	1302558465	/nfs/dbraw/zinc/55/84/65/1302558465.db2.gz	MTZYHFVTYOSSKP-RDBSUJKOSA-N	0	3	327.453	3.450	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN2CCC(N(C)CC(F)F)CC2)cc1	ZINC000769509118	1303131843	/nfs/dbraw/zinc/13/18/43/1303131843.db2.gz	HZGZVHUDVQLUSD-AWEZNQCLSA-N	0	3	337.414	3.139	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN2CCC(N(C)CC(F)F)CC2)cc1	ZINC000769509125	1303132014	/nfs/dbraw/zinc/13/20/14/1303132014.db2.gz	HZGZVHUDVQLUSD-CQSZACIVSA-N	0	3	337.414	3.139	20	30		EGEDHN
COC(=O)CCCN1CCC(N=Nc2c(F)cccc2Cl)CC1	ZINC000769829014	1303182350	/nfs/dbraw/zinc/18/23/50/1303182350.db2.gz	LJNWFSCOILFOID-UHFFFAOYSA-N	0	3	341.814	3.296	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1C[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C1	ZINC000769883312	1303187800	/nfs/dbraw/zinc/18/78/00/1303187800.db2.gz	IUVLXQCQCUZZCT-RHSMWYFYSA-N	0	3	329.444	3.212	20	30		EGEDHN
C=CCN(C(=S)NC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000771543820	1303418304	/nfs/dbraw/zinc/41/83/04/1303418304.db2.gz	NTBNRCBACZWQMU-UHFFFAOYSA-N	0	3	329.513	3.176	20	30		EGEDHN
N#Cc1csc(C(=O)OCC2CCN(Cc3ccco3)CC2)c1	ZINC000772685418	1303563877	/nfs/dbraw/zinc/56/38/77/1303563877.db2.gz	NXTCPJJJYLWQPA-UHFFFAOYSA-N	0	3	330.409	3.282	20	30		EGEDHN
C=CCC1(O)CCN(C[C@H](O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000886762392	1303589196	/nfs/dbraw/zinc/58/91/96/1303589196.db2.gz	YCZTWTYKBKJXSV-HNNXBMFYSA-N	0	3	329.362	3.142	20	30		EGEDHN
CN(CC(=O)C(C#N)c1nc2cc(F)ccc2s1)[C@H]1CCSC1	ZINC000774073141	1303771448	/nfs/dbraw/zinc/77/14/48/1303771448.db2.gz	SCFOZKRNQSXMIW-RYUDHWBXSA-N	0	3	349.456	3.049	20	30		EGEDHN
CC(C)C[C@@H](NCC(=O)NCCC#N)c1cccc(C(F)(F)F)c1	ZINC000775322842	1303939559	/nfs/dbraw/zinc/93/95/59/1303939559.db2.gz	ASHMBHZZAVYHEZ-OAHLLOKOSA-N	0	3	341.377	3.412	20	30		EGEDHN
Cc1cccc(C)c1OC[C@H](O)CNC1(c2cccc(C#N)c2)CC1	ZINC000775432029	1303962526	/nfs/dbraw/zinc/96/25/26/1303962526.db2.gz	WSKVJGUYDZQVHQ-LJQANCHMSA-N	0	3	336.435	3.194	20	30		EGEDHN
C#C[C@H](N[C@@H](C)CC(=O)Nc1ccc(C)cc1Cl)[C@@H]1CCCO1	ZINC000775572027	1303987625	/nfs/dbraw/zinc/98/76/25/1303987625.db2.gz	NWRFAJBKGIRNIB-QRTARXTBSA-N	0	3	334.847	3.136	20	30		EGEDHN
C#C[C@H](NCc1ccc(OCc2ccccc2)cc1O)[C@@H]1CCCO1	ZINC000775998189	1304077242	/nfs/dbraw/zinc/07/72/42/1304077242.db2.gz	DTBZVLDYANQFRV-FPOVZHCZSA-N	0	3	337.419	3.242	20	30		EGEDHN
C#C[C@H]([NH2+]Cc1ccc(OCc2ccccc2)cc1[O-])[C@@H]1CCCO1	ZINC000775998189	1304077244	/nfs/dbraw/zinc/07/72/44/1304077244.db2.gz	DTBZVLDYANQFRV-FPOVZHCZSA-N	0	3	337.419	3.242	20	30		EGEDHN
N#CC(C(=O)NC1CCCC1)C(=O)[C@@H]1CCc2c1cccc2Cl	ZINC000776079449	1304091637	/nfs/dbraw/zinc/09/16/37/1304091637.db2.gz	DEEOWESMRIMCFZ-CABCVRRESA-N	0	3	330.815	3.137	20	30		EGEDHN
C[C@H](NCc1ccc(N2CCOCC2)cc1)c1ccc(C#N)c(F)c1	ZINC000776731279	1304189722	/nfs/dbraw/zinc/18/97/22/1304189722.db2.gz	WONBWYNJPYBLRB-HNNXBMFYSA-N	0	3	339.414	3.385	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)Cc2ccccc2CC#N)N(C)C)cc1	ZINC000777283219	1304279646	/nfs/dbraw/zinc/27/96/46/1304279646.db2.gz	FSXXWOZKIJJLES-OAQYLSRUSA-N	0	3	349.478	3.277	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CN1CCC2(C[C@H]2C(=O)OC)CC1	ZINC000779157888	1304536913	/nfs/dbraw/zinc/53/69/13/1304536913.db2.gz	JMKOLJZRYRZFRD-HNNXBMFYSA-N	0	3	347.842	3.127	20	30		EGEDHN
CCC(CCc1ccc(Br)cc1)=NNC1=N[C@H](C)CN1	ZINC000779792412	1304606687	/nfs/dbraw/zinc/60/66/87/1304606687.db2.gz	RGGDKFINBSVSSY-LLVKDONJSA-N	0	3	337.265	3.085	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc3sc(C)nc3c2)CC1	ZINC000781500193	1304837073	/nfs/dbraw/zinc/83/70/73/1304837073.db2.gz	LZSZHZQOVDTEJP-UHFFFAOYSA-N	0	3	330.457	3.377	20	30		EGEDHN
CC(C)c1csc(C(C#N)C(=O)c2c3c(nn2C)CCCC3)n1	ZINC000892803601	1305558728	/nfs/dbraw/zinc/55/87/28/1305558728.db2.gz	USUCDGIOAPTDBY-GFCCVEGCSA-N	0	3	328.441	3.369	20	30		EGEDHN
CN1CCN(CCCOc2ccc(C#N)cc2)C[C@H]1Cc1ccccc1	ZINC000792944132	1309268335	/nfs/dbraw/zinc/26/83/35/1309268335.db2.gz	VZGCZCKCXGKOCB-OAQYLSRUSA-N	0	3	349.478	3.186	20	30		EGEDHN
C[C@H]1CCSCCN1CC(=O)C(C#N)c1nc2ccccc2s1	ZINC000794570493	1309548561	/nfs/dbraw/zinc/54/85/61/1309548561.db2.gz	KBCVPNZPESVOEA-STQMWFEESA-N	0	3	345.493	3.300	20	30		EGEDHN
CC(C)N(C)c1ccc(C=NNCc2ccccc2N(C)C)cn1	ZINC000794957980	1309631678	/nfs/dbraw/zinc/63/16/78/1309631678.db2.gz	UJNXGQNYIQQVDL-UHFFFAOYSA-N	0	3	325.460	3.116	20	30		EGEDHN
CCC#C[C@H](C)N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000796466086	1310008015	/nfs/dbraw/zinc/00/80/15/1310008015.db2.gz	PLOXRGRTJLMWKO-PKOBYXMFSA-N	0	3	328.456	3.427	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@H]1CCc2cc(C)ccc2O1	ZINC000796634387	1310052890	/nfs/dbraw/zinc/05/28/90/1310052890.db2.gz	YOEDGGIRSGOPAS-SJLPKXTDSA-N	0	3	342.439	3.094	20	30		EGEDHN
C=CCN1CC[C@@H](N2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)C1=O	ZINC000799164513	1310497194	/nfs/dbraw/zinc/49/71/94/1310497194.db2.gz	KSRMSOYSXZRIET-GOEBONIOSA-N	0	3	338.373	3.282	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cc1C#N	ZINC000799319838	1310523452	/nfs/dbraw/zinc/52/34/52/1310523452.db2.gz	RQOVOBDHLLCVIP-OXJNMPFZSA-N	0	3	333.435	3.432	20	30		EGEDHN
COc1cc(CNC[C@@H]2COC3(CCCCCC3)O2)ccc1C#N	ZINC000799340840	1310529950	/nfs/dbraw/zinc/52/99/50/1310529950.db2.gz	KMNQEUSWKCYMJY-QGZVFWFLSA-N	0	3	330.428	3.122	20	30		EGEDHN
CCCCCCCS(=O)(=O)NCc1ccccc1CN(C)C	ZINC000799748975	1310612219	/nfs/dbraw/zinc/61/22/19/1310612219.db2.gz	HHVMVKBDMIBSDA-UHFFFAOYSA-N	0	3	326.506	3.138	20	30		EGEDHN
COc1cc(C)cc(CN2CCC(C#N)(c3ccccn3)CC2)c1O	ZINC000799943771	1310641550	/nfs/dbraw/zinc/64/15/50/1310641550.db2.gz	UUCSCFJKQBDNFM-UHFFFAOYSA-N	0	3	337.423	3.162	20	30		EGEDHN
Cn1cc(-c2ccc(CNCc3ccc(OCC#N)cc3)s2)cn1	ZINC000800887059	1310828453	/nfs/dbraw/zinc/82/84/53/1310828453.db2.gz	MZCQSCPOJLIHDZ-UHFFFAOYSA-N	0	3	338.436	3.341	20	30		EGEDHN
CC[C@H](C)N[C@@H](CNC(=O)c1ccc(C#N)cc1OC)c1ccco1	ZINC000899080357	1310927846	/nfs/dbraw/zinc/92/78/46/1310927846.db2.gz	UHQBUEDLLDJRBZ-BBRMVZONSA-N	0	3	341.411	3.019	20	30		EGEDHN
CC[C@@H](C)N[C@@H](CNC(=O)c1ccc(C#N)cc1OC)c1ccco1	ZINC000899080358	1310928948	/nfs/dbraw/zinc/92/89/48/1310928948.db2.gz	UHQBUEDLLDJRBZ-CJNGLKHVSA-N	0	3	341.411	3.019	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CC[C@H](n2cc(C3CC3)nn2)C1	ZINC000826679150	1320397432	/nfs/dbraw/zinc/39/74/32/1320397432.db2.gz	FCGDTBZSUOARID-KRWDZBQOSA-N	0	3	335.455	3.404	20	30		EGEDHN
CCC(C)(C)OCC(=O)C(C#N)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000838786925	1320816198	/nfs/dbraw/zinc/81/61/98/1320816198.db2.gz	LHYFPNHLYMYUIS-NSHDSACASA-N	0	3	340.782	3.332	20	30		EGEDHN
C[C@@H](C#N)OCCN[C@@H](COc1ccccc1F)c1ccccc1	ZINC000801937572	1316969947	/nfs/dbraw/zinc/96/99/47/1316969947.db2.gz	PZVZEXRBFBVWPV-YJBOKZPZSA-N	0	3	328.387	3.464	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)c1ccc(Cl)nc1	ZINC000802040660	1316975570	/nfs/dbraw/zinc/97/55/70/1316975570.db2.gz	JAWVSQTWCLPOEI-GFCCVEGCSA-N	0	3	343.770	3.095	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](N[C@@H]2CCc3c2cc(F)cc3F)C1	ZINC001019237923	1317117136	/nfs/dbraw/zinc/11/71/36/1317117136.db2.gz	DJNQMZQYGLJNGE-SUMWQHHRSA-N	0	3	334.410	3.355	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3ccc(F)c(C#N)c3)C2)CC1	ZINC001019330951	1317172104	/nfs/dbraw/zinc/17/21/04/1317172104.db2.gz	FOCIGZDBPCIADN-SFHVURJKSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](NCc3ccccc3OC3CC3)C2)C1	ZINC001019353299	1317189486	/nfs/dbraw/zinc/18/94/86/1317189486.db2.gz	BUCRCHBRSRLSHB-KRWDZBQOSA-N	0	3	340.467	3.275	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1CCN(CC2CCCCCC2)CC1	ZINC000957467605	1317383859	/nfs/dbraw/zinc/38/38/59/1317383859.db2.gz	XOXOHZBVYNAQLL-UHFFFAOYSA-N	0	3	338.495	3.325	20	30		EGEDHN
CCC(=O)N1CCC2(CCN(Cc3ccc(C#N)c(F)c3)CC2)CC1	ZINC000957481741	1317389545	/nfs/dbraw/zinc/38/95/45/1317389545.db2.gz	NSAGECAURMPBGC-UHFFFAOYSA-N	0	3	343.446	3.312	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)[C@H]3CC4CCC3CC4)C2)s1	ZINC001019833171	1317442143	/nfs/dbraw/zinc/44/21/43/1317442143.db2.gz	IFEFDSFPFCVJLC-GULCKSEBSA-N	0	3	343.496	3.137	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC2(CCN(Cc3cc(C)no3)CC2)CC1	ZINC000957587815	1317480240	/nfs/dbraw/zinc/48/02/40/1317480240.db2.gz	CQHIXELDSPAVLU-UHFFFAOYSA-N	0	3	345.487	3.400	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)CC2=CCCCC2)C1	ZINC001020026993	1317507474	/nfs/dbraw/zinc/50/74/74/1317507474.db2.gz	IYZPVTFLNFTEJQ-HDJSIYSDSA-N	0	3	327.266	3.022	20	30		EGEDHN
C[C@@H]1CCC[C@H]1CC(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001020186385	1317581500	/nfs/dbraw/zinc/58/15/00/1317581500.db2.gz	OPYRCVDDEAQRDA-AETAKHFUSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=CCn1c(C2CC2)nn(CN2CCN(C)C[C@H]2CC(C)C)c1=S	ZINC000902541908	1317591505	/nfs/dbraw/zinc/59/15/05/1317591505.db2.gz	JLKXESROFPLKTR-MRXNPFEDSA-N	0	3	349.548	3.097	20	30		EGEDHN
CC[C@@H](NCc1ccccc1CS(C)(=O)=O)c1cccc(C#N)c1	ZINC000902833189	1317622424	/nfs/dbraw/zinc/62/24/24/1317622424.db2.gz	XLCMTAMTBMQRRR-LJQANCHMSA-N	0	3	342.464	3.344	20	30		EGEDHN
C=CCOc1ccc(CN[C@H]2COc3ccccc3[C@H]2O)cc1Cl	ZINC000808454247	1317679879	/nfs/dbraw/zinc/67/98/79/1317679879.db2.gz	NOKRIGIQANWNBL-QFBILLFUSA-N	0	3	345.826	3.489	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@H]2CC[C@@H]2c2ccc(F)cc2)C1	ZINC001020428326	1317691769	/nfs/dbraw/zinc/69/17/69/1317691769.db2.gz	DQJXHUPMIYOJOF-VQHPVUNQSA-N	0	3	336.838	3.309	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@H](NCc3cccc(F)c3F)C2)CC1	ZINC001020550103	1317761182	/nfs/dbraw/zinc/76/11/82/1317761182.db2.gz	IAMYWJQOPKJLKZ-WKILWMFISA-N	0	3	334.410	3.448	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@H](NCc3c(C)noc3CC)C2)CC1	ZINC001020550125	1317761805	/nfs/dbraw/zinc/76/18/05/1317761805.db2.gz	IOHRWYJGXGIUDX-WKILWMFISA-N	0	3	331.460	3.029	20	30		EGEDHN
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001020555980	1317769624	/nfs/dbraw/zinc/76/96/24/1317769624.db2.gz	XGFQJNNEQUEYSD-AEVYOOLXSA-N	0	3	343.446	3.260	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@H](NC(=O)[C@]34C[C@H]3CCCC4)C2)c(F)c1	ZINC001020567065	1317778836	/nfs/dbraw/zinc/77/88/36/1317778836.db2.gz	XYJZXTDVRVDYSX-WOCWXWTJSA-N	0	3	341.430	3.014	20	30		EGEDHN
C#Cc1ccc(CN2CC[C@@H](NC(=O)OC(C)(C)C)[C@H](C)C2)cc1	ZINC000809575402	1317834706	/nfs/dbraw/zinc/83/47/06/1317834706.db2.gz	BRRCMLAGQHSVFU-CRAIPNDOSA-N	0	3	328.456	3.403	20	30		EGEDHN
CC1/C(=C/c2ccc(N(C)C)cc2C(F)(F)F)C(=O)c2ncnn21	ZINC000905087388	1317921696	/nfs/dbraw/zinc/92/16/96/1317921696.db2.gz	XUDDYZRPNKKQLS-DKBJHAQFSA-N	0	3	336.317	3.204	20	30		EGEDHN
CC1/C(=C\c2ccc(C(=O)OC(C)(C)C)cc2)C(=O)c2ncnn21	ZINC000905087248	1317922336	/nfs/dbraw/zinc/92/23/36/1317922336.db2.gz	WSZVNHQFXFXXBE-LUHPIMIVSA-N	0	3	325.368	3.074	20	30		EGEDHN
C[C@H]1CN(CC(=O)C(C#N)c2nc3ccccc3s2)CCC1(F)F	ZINC000810045878	1317943446	/nfs/dbraw/zinc/94/34/46/1317943446.db2.gz	IZLIQQVETSNIBQ-RYUDHWBXSA-N	0	3	349.406	3.450	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@H](NCc1ccc(N3CCCC3=O)cc1)CC2	ZINC000810207341	1317975958	/nfs/dbraw/zinc/97/59/58/1317975958.db2.gz	JTNUZRADDIBDRU-HXUWFJFHSA-N	0	3	331.419	3.462	20	30		EGEDHN
C[C@@H](N[C@@H]1CCc2ccc(C#N)cc21)c1ccc2c(c1)CC(=O)N2C	ZINC000810216568	1317979135	/nfs/dbraw/zinc/97/91/35/1317979135.db2.gz	XMQAJFLQQCLLSQ-BFUOFWGJSA-N	0	3	331.419	3.415	20	30		EGEDHN
C[C@H](COCC1CCCCC1)N[C@H](C)C(=O)Nc1ccccc1C#N	ZINC000905857839	1318009459	/nfs/dbraw/zinc/00/94/59/1318009459.db2.gz	IEVVGXIBLITEJH-HZPDHXFCSA-N	0	3	343.471	3.460	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)c1ccc(C(C)C)cn1	ZINC000810532462	1318019550	/nfs/dbraw/zinc/01/95/50/1318019550.db2.gz	TXLRQCDGIIZZLJ-AWEZNQCLSA-N	0	3	337.379	3.175	20	30		EGEDHN
C[C@@]1(COC(=O)c2cccc(C#N)n2)CCCN1Cc1ccccc1	ZINC000810601814	1318029971	/nfs/dbraw/zinc/02/99/71/1318029971.db2.gz	AARPECMPQUOEDJ-FQEVSTJZSA-N	0	3	335.407	3.165	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N(CCN(C)C)Cc1cccc(C)c1	ZINC000810615264	1318031850	/nfs/dbraw/zinc/03/18/50/1318031850.db2.gz	KDNLODPMRBNASP-UHFFFAOYSA-N	0	3	334.463	3.109	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)c1ccsc1C#N)c1ccsc1	ZINC000906127651	1318044570	/nfs/dbraw/zinc/04/45/70/1318044570.db2.gz	DWKSJGNREFRRIR-AWEZNQCLSA-N	0	3	333.482	3.494	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C2CC(C(C)(C)C)C2)C1	ZINC001021115338	1318098508	/nfs/dbraw/zinc/09/85/08/1318098508.db2.gz	LUFCHLIQCBISNG-XTWLIDDBSA-N	0	3	343.309	3.204	20	30		EGEDHN
CCCC(=O)N1CCC[C@@H]2CN(Cc3cccc(C#N)c3)CC[C@H]21	ZINC001021495343	1318299555	/nfs/dbraw/zinc/29/95/55/1318299555.db2.gz	CGHHBJIEOFBJFV-RTBURBONSA-N	0	3	325.456	3.171	20	30		EGEDHN
O=C(C#CC1CC1)N1CCCC[C@H]1CNCc1ccc(Cl)cc1F	ZINC000960003368	1318308335	/nfs/dbraw/zinc/30/83/35/1318308335.db2.gz	MFNOLIBLJSWGSW-KRWDZBQOSA-N	0	3	348.849	3.363	20	30		EGEDHN
CC(F)(F)C(=O)N1CCC[C@@H]2CN(Cc3cccc(C#N)c3)CC[C@@H]21	ZINC001021500598	1318312378	/nfs/dbraw/zinc/31/23/78/1318312378.db2.gz	ZMHYVQOQQOGSAD-SJORKVTESA-N	0	3	347.409	3.026	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@@H]2CN(Cc3cccc(C#N)c3)CC[C@@H]21	ZINC001021512096	1318334220	/nfs/dbraw/zinc/33/42/20/1318334220.db2.gz	USIHKMYCUJFRGN-UXHICEINSA-N	0	3	337.467	3.337	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@@H](CCCN3C(=O)c3ccoc3)C2)cc1	ZINC001021520370	1318346842	/nfs/dbraw/zinc/34/68/42/1318346842.db2.gz	WIVQKYQKMRKWAD-AZUAARDMSA-N	0	3	349.434	3.278	20	30		EGEDHN
C=CCCC(=O)[C@@H]1CCCN1C(=O)C[C@H](c1ccccc1)N(C)C	ZINC000908658707	1318383474	/nfs/dbraw/zinc/38/34/74/1318383474.db2.gz	FKJPETGJGZYTOV-ZWKOTPCHSA-N	0	3	328.456	3.206	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cccc(C)c2F)C1	ZINC001021590952	1318436897	/nfs/dbraw/zinc/43/68/97/1318436897.db2.gz	FYNDIVRDCGNIJW-AEFFLSMTSA-N	0	3	328.431	3.084	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccn2c1CCCC2	ZINC000960277222	1318439946	/nfs/dbraw/zinc/43/99/46/1318439946.db2.gz	AVSWNZUAEMZVCC-TZIWHRDSSA-N	0	3	349.478	3.386	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cncc(Cl)c1C	ZINC000960278735	1318440974	/nfs/dbraw/zinc/44/09/74/1318440974.db2.gz	NDEOELFYHPBICT-QZTJIDSGSA-N	0	3	341.842	3.215	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cccc(F)c1F	ZINC000960299273	1318450258	/nfs/dbraw/zinc/45/02/58/1318450258.db2.gz	IAPGFSLCEYDUTR-SJLPKXTDSA-N	0	3	328.362	3.136	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc(F)c(F)cc1F	ZINC000960299536	1318450489	/nfs/dbraw/zinc/45/04/89/1318450489.db2.gz	QFHHIMBIPWZHSY-QZTJIDSGSA-N	0	3	346.352	3.275	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc(Cl)[nH]1	ZINC000960302771	1318452200	/nfs/dbraw/zinc/45/22/00/1318452200.db2.gz	MOXYLNLBSSUTMK-NVXWUHKLSA-N	0	3	329.831	3.230	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@H]1CCCC(F)(F)C1	ZINC000960306157	1318452580	/nfs/dbraw/zinc/45/25/80/1318452580.db2.gz	IBVRAJJVJOWVDT-USXIJHARSA-N	0	3	334.410	3.370	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc([C@H](C)CC)no1	ZINC000960312899	1318455816	/nfs/dbraw/zinc/45/58/16/1318455816.db2.gz	GKOYWPJOFPHYTG-OMWUSAIZSA-N	0	3	339.439	3.360	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2oc(C(F)F)cc2C)C1	ZINC001021609221	1318457001	/nfs/dbraw/zinc/45/70/01/1318457001.db2.gz	XBMWJHPDKDLIMO-ZIAGYGMSSA-N	0	3	336.382	3.085	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@H](C)c1cccnc1	ZINC000960327208	1318463429	/nfs/dbraw/zinc/46/34/29/1318463429.db2.gz	PSXHZWLOJBLFDB-CDHQVMDDSA-N	0	3	335.451	3.133	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(CC)s2)C1	ZINC001021622266	1318472069	/nfs/dbraw/zinc/47/20/69/1318472069.db2.gz	HUFWAVGQVUHFJE-NVXWUHKLSA-N	0	3	330.497	3.260	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2c[nH]c3ccccc23)C1	ZINC001021628767	1318481956	/nfs/dbraw/zinc/48/19/56/1318481956.db2.gz	XRUMTYHGEHDQHZ-OXQOHEQNSA-N	0	3	335.451	3.118	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cnc3ccccc3c2C)C1	ZINC001021637218	1318493163	/nfs/dbraw/zinc/49/31/63/1318493163.db2.gz	ZHBJDLUKKXYXTM-DYESRHJHSA-N	0	3	347.462	3.103	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(C)c3cccnc23)C1	ZINC001021638933	1318496576	/nfs/dbraw/zinc/49/65/76/1318496576.db2.gz	KZGDKYORDMARSO-PXNSSMCTSA-N	0	3	347.462	3.103	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccoc2C2CC2)C1	ZINC001021659832	1318521762	/nfs/dbraw/zinc/52/17/62/1318521762.db2.gz	VTRWMZUEWMPXOC-FUHWJXTLSA-N	0	3	326.440	3.107	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc3cc[nH]c3c2)C1	ZINC001021679876	1318550445	/nfs/dbraw/zinc/55/04/45/1318550445.db2.gz	UAPUYPUQHOFWJD-AZUAARDMSA-N	0	3	335.451	3.118	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc3cc(F)ccc3o2)C1	ZINC001021682397	1318555666	/nfs/dbraw/zinc/55/56/66/1318555666.db2.gz	QMCXZYDQDPXYGQ-RHSMWYFYSA-N	0	3	340.398	3.132	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(C)c(CC)o2)C1	ZINC001021709571	1318586771	/nfs/dbraw/zinc/58/67/71/1318586771.db2.gz	CFRUWTXSTVTIFV-DLBZAZTESA-N	0	3	328.456	3.100	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(CC(C)C)c[nH]2)C1	ZINC001021718472	1318598847	/nfs/dbraw/zinc/59/88/47/1318598847.db2.gz	YAKWSTHBVOQLMT-UYAOXDASSA-N	0	3	341.499	3.163	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccccc2Cl)C1	ZINC001021720700	1318604178	/nfs/dbraw/zinc/60/41/78/1318604178.db2.gz	YQUQJOPZLAGTEU-QAPCUYQASA-N	0	3	330.859	3.290	20	30		EGEDHN
C#CCCOc1ccc(CNCc2cc3ccccc3n(C)c2=O)cc1	ZINC000813790586	1318632594	/nfs/dbraw/zinc/63/25/94/1318632594.db2.gz	RTEGYFULYMALLT-UHFFFAOYSA-N	0	3	346.430	3.230	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cccc3cnccc32)C1	ZINC001021737353	1318642946	/nfs/dbraw/zinc/64/29/46/1318642946.db2.gz	SXUHYFIDGQYAQO-NQIIRXRSSA-N	0	3	347.462	3.185	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)[C@H]1[C@@H]2CCC[C@@H]21	ZINC000960529160	1318645918	/nfs/dbraw/zinc/64/59/18/1318645918.db2.gz	MWKAULZFUVRBCK-VNTMZGSJSA-N	0	3	337.467	3.027	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cncc3ccccc32)C1	ZINC001021741129	1318653028	/nfs/dbraw/zinc/65/30/28/1318653028.db2.gz	ZCWLUFAYGGIIAD-RXVVDRJESA-N	0	3	347.462	3.185	20	30		EGEDHN
CC1CC(C(=O)N2CCC[C@@H]2CN(C)Cc2cccc(C#N)c2)C1	ZINC000960533760	1318653977	/nfs/dbraw/zinc/65/39/77/1318653977.db2.gz	IRUBJSKKIGJHEN-XUJQIHCRSA-N	0	3	325.456	3.027	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)C1CC(F)(F)C1	ZINC000960536194	1318657691	/nfs/dbraw/zinc/65/76/91/1318657691.db2.gz	QKVFBUXGWPMTCW-KRWDZBQOSA-N	0	3	347.409	3.026	20	30		EGEDHN
Cc1ccsc1C(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001021780029	1318678853	/nfs/dbraw/zinc/67/88/53/1318678853.db2.gz	PXICYNAPVPKVDH-GASCZTMLSA-N	0	3	343.427	3.118	20	30		EGEDHN
CC[C@@H](SC)C(=O)N1CCC[C@@H]1CN(C)Cc1ccc(C#N)cc1	ZINC000960557108	1318687669	/nfs/dbraw/zinc/68/76/69/1318687669.db2.gz	OVXNNQITWLVZMZ-QZTJIDSGSA-N	0	3	345.512	3.123	20	30		EGEDHN
CC1(C)C(C(=O)N[C@H]2C[C@@H](NCc3ccc(C#N)cc3F)C2)C1(C)C	ZINC001021945028	1318740396	/nfs/dbraw/zinc/74/03/96/1318740396.db2.gz	ZGOURBQAWKERMY-GASCZTMLSA-N	0	3	343.446	3.116	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)C1(F)CCCC1	ZINC000960715799	1318824385	/nfs/dbraw/zinc/82/43/85/1318824385.db2.gz	WSWHARPZCKWHDH-SFHVURJKSA-N	0	3	343.446	3.263	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc(Sc2nccn2C)cc1	ZINC000912172242	1318837888	/nfs/dbraw/zinc/83/78/88/1318837888.db2.gz	UHUVZQBHDBPNIS-HNNXBMFYSA-N	0	3	330.457	3.193	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2nc(C(C)(C)C)cs2)C1	ZINC001022234484	1318853108	/nfs/dbraw/zinc/85/31/08/1318853108.db2.gz	DRCXRWCGEKAYAC-PHIMTYICSA-N	0	3	327.881	3.044	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N(C)Cc1ccc(OC(F)(F)F)cc1	ZINC000912343085	1318875210	/nfs/dbraw/zinc/87/52/10/1318875210.db2.gz	NHRSOQTWXSTBHU-CQSZACIVSA-N	0	3	330.350	3.227	20	30		EGEDHN
CC(C)(C)[C@@H]1C[C@H]1C(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001022416416	1318931581	/nfs/dbraw/zinc/93/15/81/1318931581.db2.gz	KQORFYYJHNLQLA-YYIAUSFCSA-N	0	3	343.446	3.116	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H]1CN(C)Cc1cccc(C#N)c1)C(C)(F)F	ZINC000960869618	1319013857	/nfs/dbraw/zinc/01/38/57/1319013857.db2.gz	OWFZGJMNCWSDMW-RHSMWYFYSA-N	0	3	349.425	3.272	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N1CCC[C@@H]1CN(C)Cc1csc(C)c1	ZINC000960881589	1319019200	/nfs/dbraw/zinc/01/92/00/1319019200.db2.gz	GMCYTEUGQIDEHN-KURKYZTESA-N	0	3	348.512	3.070	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@@H](NCc3c(C)nsc3C)C2)CC1	ZINC001022655652	1319045060	/nfs/dbraw/zinc/04/50/60/1319045060.db2.gz	IORRPIMEYZJUDN-IYBDPMFKSA-N	0	3	333.501	3.243	20	30		EGEDHN
C[C@H]1CCC[C@]1(C)C(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001022666781	1319057052	/nfs/dbraw/zinc/05/70/52/1319057052.db2.gz	RGWAZDZRVZWEDY-NYYTWLDWSA-N	0	3	343.446	3.260	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@@H](NC(=O)[C@]34C[C@H]3CCCC4)C2)c(F)c1	ZINC001022683190	1319067249	/nfs/dbraw/zinc/06/72/49/1319067249.db2.gz	XYJZXTDVRVDYSX-PDOICOKGSA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)Cc2cccc(Cl)c2F)C1	ZINC001022768943	1319096216	/nfs/dbraw/zinc/09/62/16/1319096216.db2.gz	CWVPRKLEDKNOCU-TXEJJXNPSA-N	0	3	331.218	3.011	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc(C)c(C)c2)C1	ZINC001022830059	1319129036	/nfs/dbraw/zinc/12/90/36/1319129036.db2.gz	WCSIOGWTPAKNTR-XWTMOSNGSA-N	0	3	332.875	3.396	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@@H](NC(=O)C3(F)CCCCC3)C2)c(F)c1	ZINC001022930805	1319175278	/nfs/dbraw/zinc/17/52/78/1319175278.db2.gz	PTEXDJKHMJCRHA-IYBDPMFKSA-N	0	3	347.409	3.107	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)Cc2cccc(OCCC)c2)C1	ZINC001022949504	1319184543	/nfs/dbraw/zinc/18/45/43/1319184543.db2.gz	JVCDYHHRMFGTQU-IYBDPMFKSA-N	0	3	336.863	3.007	20	30		EGEDHN
CC(=O)N1CCC[C@@H]([C@@H]2CCN(CC#Cc3cccc(Cl)c3)C2)C1	ZINC000961079931	1319192645	/nfs/dbraw/zinc/19/26/45/1319192645.db2.gz	RFUGWFMYMRZZHZ-RTBURBONSA-N	0	3	344.886	3.272	20	30		EGEDHN
C=CCC[N@H+]1CC[C@@H]([C@H]2CCCN(C(=O)c3ccccc3[O-])C2)C1	ZINC000961092922	1319203093	/nfs/dbraw/zinc/20/30/93/1319203093.db2.gz	MHRCBKVQFKISGC-DLBZAZTESA-N	0	3	328.456	3.142	20	30		EGEDHN
C=CCC[N@@H+]1CC[C@@H]([C@H]2CCCN(C(=O)c3ccccc3[O-])C2)C1	ZINC000961092922	1319203099	/nfs/dbraw/zinc/20/30/99/1319203099.db2.gz	MHRCBKVQFKISGC-DLBZAZTESA-N	0	3	328.456	3.142	20	30		EGEDHN
CCC(=O)N1CCC[C@H]([C@@H]2CCN(Cc3ccc(C#N)s3)C2)C1	ZINC000961092665	1319204055	/nfs/dbraw/zinc/20/40/55/1319204055.db2.gz	SNRWKWCBNJHVSQ-LSDHHAIUSA-N	0	3	331.485	3.090	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@H](CNC(=O)C3CCCC3)C2)c1	ZINC001023196161	1319320476	/nfs/dbraw/zinc/32/04/76/1319320476.db2.gz	NQXJXZCGJVPEQC-GOSISDBHSA-N	0	3	325.456	3.077	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]([C@@H]2CCN(Cc3ocnc3C)C2)C1	ZINC000961223223	1319350082	/nfs/dbraw/zinc/35/00/82/1319350082.db2.gz	AHPLVMKQAJRGAC-IAGOWNOFSA-N	0	3	345.487	3.256	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]([C@H]2CCN(Cc3ccns3)C2)C1	ZINC000961233312	1319364924	/nfs/dbraw/zinc/36/49/24/1319364924.db2.gz	VZTSYBQWIIEJBM-HOTGVXAUSA-N	0	3	347.528	3.416	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H](CNC(=O)[C@H]3CC=CCC3)C2)cc1	ZINC001023229649	1319367537	/nfs/dbraw/zinc/36/75/37/1319367537.db2.gz	MBMBJBLJWGCYEV-UXHICEINSA-N	0	3	337.467	3.243	20	30		EGEDHN
CC(=O)N[C@H](C)C(=O)C(C#N)c1nc(-c2ccc(Cl)cc2)cs1	ZINC000915101819	1319423379	/nfs/dbraw/zinc/42/33/79/1319423379.db2.gz	LUOYPVWHPXHDGD-NOZJJQNGSA-N	0	3	347.827	3.164	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2coc3ccc(CC)cc23)C1	ZINC001023368814	1319482384	/nfs/dbraw/zinc/48/23/84/1319482384.db2.gz	WVQLMRRWOGMCCD-KRWDZBQOSA-N	0	3	338.451	3.460	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@H](CNC(=O)C3C=CC=CC=C3)C2)c1	ZINC001023391758	1319499463	/nfs/dbraw/zinc/49/94/63/1319499463.db2.gz	GFEYHTRHGPPECB-HXUWFJFHSA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccccc2-c2ccncc2)C1	ZINC001023444681	1319541997	/nfs/dbraw/zinc/54/19/97/1319541997.db2.gz	SQXFPOOSJNYTLG-GOSISDBHSA-N	0	3	347.462	3.214	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1cc(Cl)cc(C(F)(F)F)c1	ZINC000818609036	1319568214	/nfs/dbraw/zinc/56/82/14/1319568214.db2.gz	HNCPVASYJWWORX-UHFFFAOYSA-N	0	3	332.753	3.044	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](C2CCN(C(=O)[C@H]3CC34CC4)CC2)C1	ZINC000961416155	1319572931	/nfs/dbraw/zinc/57/29/31/1319572931.db2.gz	RNAGAGOEGXZXDV-DLBZAZTESA-N	0	3	336.907	3.490	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@H](CNC(=O)[C@]34C[C@H]3CCC4)C2)c1	ZINC001023501994	1319607413	/nfs/dbraw/zinc/60/74/13/1319607413.db2.gz	NSVVMROYYGHTOE-QKNQBKEWSA-N	0	3	337.467	3.077	20	30		EGEDHN
CC1(C)CC[C@@H]1C(=O)NC[C@@H]1CCCN(Cc2ccc(C#N)cc2)C1	ZINC001023537680	1319643863	/nfs/dbraw/zinc/64/38/63/1319643863.db2.gz	MPEXLWFYZPGGAC-RBUKOAKNSA-N	0	3	339.483	3.323	20	30		EGEDHN
CCOc1ccc2c(c1)[C@@H](NC[C@H](O)c1ccc(C#N)cc1)CCO2	ZINC000819242056	1319678851	/nfs/dbraw/zinc/67/88/51/1319678851.db2.gz	IPHDWXHGLMSLLO-OALUTQOASA-N	0	3	338.407	3.104	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc(F)c(Cl)c2F)C1	ZINC001023569405	1319683560	/nfs/dbraw/zinc/68/35/60/1319683560.db2.gz	IWBJNGADUJMUCR-LBPRGKRZSA-N	0	3	340.801	3.083	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)COc2ccc(F)cc2)cc1	ZINC000916909403	1319723060	/nfs/dbraw/zinc/72/30/60/1319723060.db2.gz	IUIXLGQFACVTPJ-QGZVFWFLSA-N	0	3	340.354	3.114	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)COc2ccc(C)cc2)cc1	ZINC000916910366	1319723327	/nfs/dbraw/zinc/72/33/27/1319723327.db2.gz	PLDCPEDEXZYBAP-GOSISDBHSA-N	0	3	336.391	3.284	20	30		EGEDHN
C=CCNC(=O)C(C#N)C(=O)CCCc1ccc(Cl)c(Cl)c1	ZINC000916920238	1319725271	/nfs/dbraw/zinc/72/52/71/1319725271.db2.gz	BISMQCODKWBBAB-LBPRGKRZSA-N	0	3	339.222	3.327	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc(C(C)(C)C)oc2C)C1	ZINC001023621140	1319741777	/nfs/dbraw/zinc/74/17/77/1319741777.db2.gz	HZQGJHZMOAEZCH-INIZCTEOSA-N	0	3	330.472	3.351	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2sc(C(C)C)nc2C)C1	ZINC001023745677	1319891749	/nfs/dbraw/zinc/89/17/49/1319891749.db2.gz	BLLKMKKNMRXGJG-HNNXBMFYSA-N	0	3	333.501	3.040	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H]1C(=O)NC1CC(CNCc2ccccc2C#N)C1	ZINC000962328956	1319915194	/nfs/dbraw/zinc/91/51/94/1319915194.db2.gz	SLHWROLXMMQXKH-QPJMVOKLSA-N	0	3	339.483	3.225	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc(-c3ccccc3)[nH]2)C1	ZINC001023774878	1319924360	/nfs/dbraw/zinc/92/43/60/1319924360.db2.gz	QFSIDXKALSUFKD-KRWDZBQOSA-N	0	3	335.451	3.147	20	30		EGEDHN
C=C(C)CN(Cc1ccc(CO)o1)C[C@@H]1CCCC[C@@H]1C(=O)OC	ZINC000930455407	1328860416	/nfs/dbraw/zinc/86/04/16/1328860416.db2.gz	NXCRGDUOGIOMOW-YJBOKZPZSA-N	0	3	335.444	3.129	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCN(C(=O)C2CCCCC2)C1	ZINC001023811323	1319954568	/nfs/dbraw/zinc/95/45/68/1319954568.db2.gz	NENDDBXSQRNRHA-QGZVFWFLSA-N	0	3	339.483	3.467	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)C(=O)NC1CCCCC1)c1ccc(F)cc1	ZINC000918486346	1319955555	/nfs/dbraw/zinc/95/55/55/1319955555.db2.gz	ABFYGFACVRGBEC-SUMWQHHRSA-N	0	3	330.403	3.477	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N(CCN(C)C)c2ccccc2)cc1	ZINC000822858010	1320130069	/nfs/dbraw/zinc/13/00/69/1320130069.db2.gz	AKFCQNDROISTMH-UHFFFAOYSA-N	0	3	336.435	3.297	20	30		EGEDHN
CN(C)C[C@H]1CCc2ccccc2N1C(=O)Cc1ccccc1CC#N	ZINC000823897154	1320215516	/nfs/dbraw/zinc/21/55/16/1320215516.db2.gz	DDDHWCUTWIUGMS-HXUWFJFHSA-N	0	3	347.462	3.205	20	30		EGEDHN
COC(=O)C1(C#N)CCN(CC2CCC(C(F)(F)F)CC2)CC1	ZINC000824872566	1320292851	/nfs/dbraw/zinc/29/28/51/1320292851.db2.gz	UPMWNEOMBGEGLS-UHFFFAOYSA-N	0	3	332.366	3.134	20	30		EGEDHN
C#CCOc1ccccc1CN1CCC(OCCOC(C)C)CC1	ZINC000825208132	1320318841	/nfs/dbraw/zinc/31/88/41/1320318841.db2.gz	RTKLKXBLDYYRNA-UHFFFAOYSA-N	0	3	331.456	3.105	20	30		EGEDHN
C#CCN(CCC(=O)N[C@@H](c1cccs1)c1ccccc1)C1CC1	ZINC000839558147	1320938017	/nfs/dbraw/zinc/93/80/17/1320938017.db2.gz	PZBKWFRZAXYKTA-HXUWFJFHSA-N	0	3	338.476	3.441	20	30		EGEDHN
N#CC1(CNCC2CCN(C(=O)OCc3ccccc3)CC2)CCC1	ZINC000841899134	1321328367	/nfs/dbraw/zinc/32/83/67/1321328367.db2.gz	SPJAUHMLMIGGAZ-UHFFFAOYSA-N	0	3	341.455	3.319	20	30		EGEDHN
CCCCCCO[C@@H](C)C(=O)C(C#N)c1nnc2n1CCCCC2	ZINC000842292164	1321368134	/nfs/dbraw/zinc/36/81/34/1321368134.db2.gz	SCHMXXXPMPUTTO-LSDHHAIUSA-N	0	3	332.448	3.166	20	30		EGEDHN
C[C@@H](COCC(=O)C(C#N)C(=O)Nc1ccccc1)c1ccccc1	ZINC000845442171	1321708126	/nfs/dbraw/zinc/70/81/26/1321708126.db2.gz	KKGKWWMJXNDULH-YJBOKZPZSA-N	0	3	336.391	3.154	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN2CCN(C)C[C@@H]2Cc2ccccc2)cc1	ZINC000846066807	1321765768	/nfs/dbraw/zinc/76/57/68/1321765768.db2.gz	GWBQVNWZORBMKU-RXVVDRJESA-N	0	3	349.478	3.336	20	30		EGEDHN
Cc1cccnc1C(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847749498	1321900241	/nfs/dbraw/zinc/90/02/41/1321900241.db2.gz	RUHZEURFDBMMCU-UHFFFAOYSA-N	0	3	349.434	3.353	20	30		EGEDHN
N#CC1(COC(=O)c2cccnc2)CCN(Cc2ccccc2)CC1	ZINC000847745918	1321900357	/nfs/dbraw/zinc/90/03/57/1321900357.db2.gz	RGPNGTPOWFWYTJ-UHFFFAOYSA-N	0	3	335.407	3.044	20	30		EGEDHN
C[C@H](COC(=O)C(C)(C)c1cc(F)cc(C#N)c1)N1CCCCC1	ZINC000847964361	1321917303	/nfs/dbraw/zinc/91/73/03/1321917303.db2.gz	ZOMASBJLOCHTNE-CQSZACIVSA-N	0	3	332.419	3.393	20	30		EGEDHN
C#CCN(CC)C[C@H](O)CO[C@@H](c1ccccc1)c1ccc(C)cc1	ZINC000920096489	1322137196	/nfs/dbraw/zinc/13/71/96/1322137196.db2.gz	XVTXPPWWDLGKFT-VXKWHMMOSA-N	0	3	337.463	3.417	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CNC[C@H]1CC(=O)N(C(C)(C)C)C1	ZINC000850396739	1322237611	/nfs/dbraw/zinc/23/76/11/1322237611.db2.gz	ONIBNOKZUGCRTN-CQSZACIVSA-N	0	3	348.874	3.089	20	30		EGEDHN
Cc1cc(CNCc2ccc(N3CCC(O)CC3)cc2)ccc1C#N	ZINC000850406577	1322240719	/nfs/dbraw/zinc/24/07/19/1322240719.db2.gz	MIAXFRIZUBSROX-UHFFFAOYSA-N	0	3	335.451	3.118	20	30		EGEDHN
C=C(CC)CN1CCC(N(C(=O)C(F)(F)F)c2cccnc2)CC1	ZINC000931000295	1329025114	/nfs/dbraw/zinc/02/51/14/1329025114.db2.gz	DUXGKQIEFHZEID-UHFFFAOYSA-N	0	3	341.377	3.408	20	30		EGEDHN
C[C@H]1CN(Cc2ccc(OCC#N)cc2)CC[C@H]1C(=O)OC(C)(C)C	ZINC000859614827	1329035351	/nfs/dbraw/zinc/03/53/51/1329035351.db2.gz	JVLHAXHQDHARQA-MAUKXSAKSA-N	0	3	344.455	3.389	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@H]1CCCN(C(=O)C2=CCCC2)C1	ZINC001023932357	1323038817	/nfs/dbraw/zinc/03/88/17/1323038817.db2.gz	RRSIFGYZLVQQEH-OAHLLOKOSA-N	0	3	341.430	3.136	20	30		EGEDHN
CC(C(=O)N1CCC[C@@H](CNCc2ccccc2C#N)C1)=C1CCC1	ZINC001023983509	1323064239	/nfs/dbraw/zinc/06/42/39/1323064239.db2.gz	SSJKCYCGJKOCLV-KRWDZBQOSA-N	0	3	337.467	3.387	20	30		EGEDHN
C=CCC[C@@H](c1ccccc1)N1C(=O)N[C@@H](CN2CCCCC2)C1=O	ZINC000924711724	1323126882	/nfs/dbraw/zinc/12/68/82/1323126882.db2.gz	DEXIFAOGCZFHNP-ROUUACIJSA-N	0	3	341.455	3.100	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@@H](CNCc3oc(C)nc3C)C2)CC1	ZINC001024132592	1323155748	/nfs/dbraw/zinc/15/57/48/1323155748.db2.gz	BISFBMPUQXKURZ-KRWDZBQOSA-N	0	3	345.487	3.366	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)c2cccn2C)C1	ZINC000963258081	1323266822	/nfs/dbraw/zinc/26/68/22/1323266822.db2.gz	CAYZLCSEZTUHHK-HZPDHXFCSA-N	0	3	335.879	3.094	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@@H]1CCc2ccc(OC)cc21	ZINC001024484285	1323438228	/nfs/dbraw/zinc/43/82/28/1323438228.db2.gz	PCCKJWDOZQSOCN-PKOBYXMFSA-N	0	3	342.483	3.272	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cn(C)c2ccccc12	ZINC001024537933	1323479161	/nfs/dbraw/zinc/47/91/61/1323479161.db2.gz	KKXLDCCJKQIZJW-MRXNPFEDSA-N	0	3	325.456	3.339	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)[C@H]1CCc2c1cccc2Cl	ZINC001024557350	1323497604	/nfs/dbraw/zinc/49/76/04/1323497604.db2.gz	RUTAUGIFBDENKP-YJBOKZPZSA-N	0	3	344.886	3.364	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccccc1OC1CCC1	ZINC001024640417	1323566194	/nfs/dbraw/zinc/56/61/94/1323566194.db2.gz	VLKZBVLXZVTDRP-QGZVFWFLSA-N	0	3	340.467	3.226	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccccc1NC(=O)CC	ZINC001024716811	1323621641	/nfs/dbraw/zinc/62/16/41/1323621641.db2.gz	IWWMDCOIGGTJSL-MRXNPFEDSA-N	0	3	343.471	3.196	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cccc(OC(C)C)n1	ZINC001024735454	1323635263	/nfs/dbraw/zinc/63/52/63/1323635263.db2.gz	JVCSYEBZDBLPKH-INIZCTEOSA-N	0	3	331.460	3.029	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1c[nH]nc1-c1ccsc1	ZINC001024734722	1323635556	/nfs/dbraw/zinc/63/55/56/1323635556.db2.gz	ZFJUKOJJBIUKIH-OAHLLOKOSA-N	0	3	344.484	3.299	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCCCN2Cc2ccccc2C)cn1	ZINC001024769511	1323668519	/nfs/dbraw/zinc/66/85/19/1323668519.db2.gz	IJMKIRWMSHAVPO-NRFANRHFSA-N	0	3	347.462	3.156	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccc2ncsc2c1	ZINC001024786767	1323690710	/nfs/dbraw/zinc/69/07/10/1323690710.db2.gz	QJJRNNKEOQTOIU-HNNXBMFYSA-N	0	3	329.469	3.457	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1cc(C)nc2ccccc21	ZINC001024790447	1323695979	/nfs/dbraw/zinc/69/59/79/1323695979.db2.gz	JASRMJREAYXWOV-QGZVFWFLSA-N	0	3	335.451	3.151	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccc(F)c2occc21	ZINC001024807356	1323710473	/nfs/dbraw/zinc/71/04/73/1323710473.db2.gz	BPEVSFWSKHOWEY-AWEZNQCLSA-N	0	3	328.387	3.180	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)c(F)c1	ZINC001024877117	1323761406	/nfs/dbraw/zinc/76/14/06/1323761406.db2.gz	ZATBIBJJWJMNPT-WMLDXEAASA-N	0	3	331.435	3.214	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCCC[C@H]1CNCc1cncc(C)c1	ZINC001025037410	1323840942	/nfs/dbraw/zinc/84/09/42/1323840942.db2.gz	CIVGXDUOAULDBB-SFHVURJKSA-N	0	3	329.488	3.463	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(CC)ccn1	ZINC001025231592	1324018470	/nfs/dbraw/zinc/01/84/70/1324018470.db2.gz	IBKZHTUCCVLLBT-WOJBJXKFSA-N	0	3	339.483	3.126	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccn(C(C)(C)C)n1	ZINC001025234844	1324023862	/nfs/dbraw/zinc/02/38/62/1324023862.db2.gz	LJVKZTUKXDFAPE-ZWKOTPCHSA-N	0	3	344.503	3.283	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cccc(CC)n1	ZINC001025239661	1324033037	/nfs/dbraw/zinc/03/30/37/1324033037.db2.gz	HPISSQURVPMAPW-UXHICEINSA-N	0	3	339.483	3.126	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc(F)c(F)c1	ZINC001025239889	1324033073	/nfs/dbraw/zinc/03/30/73/1324033073.db2.gz	JXCDXRVJQHGCPM-QZTJIDSGSA-N	0	3	332.394	3.057	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cccc(CC)n1	ZINC001025241551	1324035837	/nfs/dbraw/zinc/03/58/37/1324035837.db2.gz	YIYHMRFSJHYXBF-OALUTQOASA-N	0	3	327.472	3.289	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc(OC)cc1F	ZINC001025248257	1324049238	/nfs/dbraw/zinc/04/92/38/1324049238.db2.gz	XMODBMISOSKREG-RBUKOAKNSA-N	0	3	346.446	3.479	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccnc2ccccc21	ZINC001025251336	1324054704	/nfs/dbraw/zinc/05/47/04/1324054704.db2.gz	RTWZXVFOHLBADV-NHCUHLMSSA-N	0	3	347.462	3.327	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1c(C)cncc1C	ZINC001025252623	1324057755	/nfs/dbraw/zinc/05/77/55/1324057755.db2.gz	YTOKNUXBVHYANZ-RBUKOAKNSA-N	0	3	339.483	3.181	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1conc1C1CC1	ZINC001025269957	1324084229	/nfs/dbraw/zinc/08/42/29/1324084229.db2.gz	YWUDVEKEAHKVES-IRXDYDNUSA-N	0	3	329.444	3.197	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)Cc1ccc(CC)cc1	ZINC001025275314	1324095789	/nfs/dbraw/zinc/09/57/89/1324095789.db2.gz	WBRKUOQUJXTRAW-LEWJYISDSA-N	0	3	338.495	3.270	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(CC(C)C)c[nH]1	ZINC001025287002	1324108423	/nfs/dbraw/zinc/10/84/23/1324108423.db2.gz	BIJRATUBAKVNEC-VQTJNVASSA-N	0	3	341.499	3.306	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc2c(C)cccn2c1	ZINC001025289215	1324112779	/nfs/dbraw/zinc/11/27/79/1324112779.db2.gz	OKADLTKGTIDRMZ-UXHICEINSA-N	0	3	349.478	3.340	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(Cl)no1	ZINC001025289578	1324113897	/nfs/dbraw/zinc/11/38/97/1324113897.db2.gz	QVLWLYIYBWXWPY-KBPBESRZSA-N	0	3	337.851	3.363	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc(C)cc1OC	ZINC001025292437	1324116868	/nfs/dbraw/zinc/11/68/68/1324116868.db2.gz	INZIFBJGHORHOF-RBUKOAKNSA-N	0	3	340.467	3.096	20	30		EGEDHN
C[C@H](NC(=O)C1CCC1)[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001025316143	1324150968	/nfs/dbraw/zinc/15/09/68/1324150968.db2.gz	ISDYMVFSNJPWLV-KXBFYZLASA-N	0	3	325.456	3.075	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)C2C3CC4CC(C3)CC2C4)C1	ZINC001025442706	1324283385	/nfs/dbraw/zinc/28/33/85/1324283385.db2.gz	NDCPXEWDEVFCDP-OSHUFQDDSA-N	0	3	342.527	3.299	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2nccc3ccsc32)C1	ZINC001025447768	1324290473	/nfs/dbraw/zinc/29/04/73/1324290473.db2.gz	LTGMTMTWTGLSKN-ZBFHGGJFSA-N	0	3	341.480	3.150	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cccc3ccc(C)nc32)C1	ZINC001025458073	1324299296	/nfs/dbraw/zinc/29/92/96/1324299296.db2.gz	YBKQZEZIVQUFPR-MJGOQNOKSA-N	0	3	349.478	3.397	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cccc3c(C)c(C)[nH]c32)C1	ZINC001025459824	1324304833	/nfs/dbraw/zinc/30/48/33/1324304833.db2.gz	SVHHRXQQHXLQMU-IAGOWNOFSA-N	0	3	337.467	3.248	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cccc3cccnc32)C1	ZINC001025473021	1324319636	/nfs/dbraw/zinc/31/96/36/1324319636.db2.gz	YAQNPHAHSHRDEB-WMZOPIPTSA-N	0	3	335.451	3.088	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cccc(-n3cccc3)c2)C1	ZINC001025475149	1324321077	/nfs/dbraw/zinc/32/10/77/1324321077.db2.gz	RSKOVZWTPMQHOF-ICSRJNTNSA-N	0	3	349.478	3.331	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cccc(-n3cccc3)c2)C1	ZINC001025475150	1324321261	/nfs/dbraw/zinc/32/12/61/1324321261.db2.gz	RSKOVZWTPMQHOF-QUCCMNQESA-N	0	3	349.478	3.331	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc3cc(C)ccc3n2)C1	ZINC001025478007	1324323390	/nfs/dbraw/zinc/32/33/90/1324323390.db2.gz	KZGXXLCIJCYVRK-PKOBYXMFSA-N	0	3	349.478	3.397	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cn(C)c3ccccc23)C1	ZINC001025480133	1324325596	/nfs/dbraw/zinc/32/55/96/1324325596.db2.gz	QEZGZLXOTRMXLL-IRXDYDNUSA-N	0	3	337.467	3.032	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc3ccsc3[nH]2)C1	ZINC001025500600	1324349034	/nfs/dbraw/zinc/34/90/34/1324349034.db2.gz	UZTPDCHIYPJBHR-UKRRQHHQSA-N	0	3	329.469	3.083	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2nsc3ccc(C)cc32)C1	ZINC001025504216	1324352884	/nfs/dbraw/zinc/35/28/84/1324352884.db2.gz	ZARMSPMYCFIOGK-CABCVRRESA-N	0	3	341.480	3.068	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(F)c(Cl)c2)C1	ZINC001025522937	1324369041	/nfs/dbraw/zinc/36/90/41/1324369041.db2.gz	JDJDHJDDMQUIQU-ZFWWWQNUSA-N	0	3	336.838	3.333	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccccc2OC2CCC2)C1	ZINC001025532220	1324378400	/nfs/dbraw/zinc/37/84/00/1324378400.db2.gz	WLUDACPDTKBNEH-IRXDYDNUSA-N	0	3	340.467	3.081	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cccc(F)c2Cl)C1	ZINC001025538351	1324384337	/nfs/dbraw/zinc/38/43/37/1324384337.db2.gz	GJSFKZOXAWGXMX-KBPBESRZSA-N	0	3	336.838	3.333	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(CC(C)C)c[nH]2)C1	ZINC001025597247	1324446464	/nfs/dbraw/zinc/44/64/64/1324446464.db2.gz	OXRDIVUVTXJLLB-WMZOPIPTSA-N	0	3	329.488	3.067	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cccc(C(F)F)c2)C1	ZINC001025598315	1324447593	/nfs/dbraw/zinc/44/75/93/1324447593.db2.gz	YJYQUSAUMCOSST-RHSMWYFYSA-N	0	3	334.410	3.478	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccccc2OC(C)C)C1	ZINC001025600968	1324448244	/nfs/dbraw/zinc/44/82/44/1324448244.db2.gz	PLMKWFOEMNYCJV-ZWKOTPCHSA-N	0	3	342.483	3.327	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(OC3CCC3)cc2)C1	ZINC001025626555	1324477088	/nfs/dbraw/zinc/47/70/88/1324477088.db2.gz	DMDQTRNHNDKOKD-FUHWJXTLSA-N	0	3	340.467	3.081	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cncc3ccccc32)C1	ZINC001025627417	1324479450	/nfs/dbraw/zinc/47/94/50/1324479450.db2.gz	JLVPDGCQZQUMHF-AEFFLSMTSA-N	0	3	335.451	3.088	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2coc(C3CCCCC3)n2)C1	ZINC001025633018	1324483986	/nfs/dbraw/zinc/48/39/86/1324483986.db2.gz	RSHMTSMFYRUACT-NVXWUHKLSA-N	0	3	343.471	3.186	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2oc3ccccc3c2CC)C1	ZINC001025633579	1324485402	/nfs/dbraw/zinc/48/54/02/1324485402.db2.gz	WNBQNTKTRVDBSB-CVEARBPZSA-N	0	3	338.451	3.459	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cnc(C(C)C)s2)C1	ZINC001025637353	1324488914	/nfs/dbraw/zinc/48/89/14/1324488914.db2.gz	SGIGZHJDJQPCBH-HUUCEWRRSA-N	0	3	333.501	3.120	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CC[C@H]2CN(C(=O)C3CCCC3)C[C@@H]21	ZINC001026168640	1324636687	/nfs/dbraw/zinc/63/66/87/1324636687.db2.gz	IMBFOVKABVGDHS-SLFFLAALSA-N	0	3	337.467	3.075	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CC[C@@H]2CN(C(=O)c3ccccc3)C[C@H]12	ZINC001026180375	1324647273	/nfs/dbraw/zinc/64/72/73/1324647273.db2.gz	JCADEYRSDFBSHH-QHAWAJNXSA-N	0	3	345.446	3.199	20	30		EGEDHN
CC1(C(=O)N2C[C@@H]3CC[C@@H](NCc4ccccc4C#N)[C@@H]3C2)CCC1	ZINC001026332698	1324732695	/nfs/dbraw/zinc/73/26/95/1324732695.db2.gz	OKSWBFZQQZBMQC-IPMKNSEASA-N	0	3	337.467	3.075	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H]3CC[C@H](NCc4ccccc4C#N)[C@H]3C2)C1	ZINC001026356857	1324749810	/nfs/dbraw/zinc/74/98/10/1324749810.db2.gz	YTTUUCXXGCJRBV-UFYCRDLUSA-N	0	3	349.478	3.241	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)C2CCCC2)CC1	ZINC001026439293	1324802021	/nfs/dbraw/zinc/80/20/21/1324802021.db2.gz	IMRXKEOEFHNPTA-UHFFFAOYSA-N	0	3	329.282	3.102	20	30		EGEDHN
CC1(C)C(C(=O)N2CC[C@H](CNCc3ccccc3C#N)C2)C1(C)C	ZINC001026757689	1325005516	/nfs/dbraw/zinc/00/55/16/1325005516.db2.gz	FBSFNDCNEDXMTE-OAHLLOKOSA-N	0	3	339.483	3.179	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](CNCc2ccccc2C#N)C1	ZINC001026988742	1325128340	/nfs/dbraw/zinc/12/83/40/1325128340.db2.gz	NYUQHNUPVIRPLM-MRXNPFEDSA-N	0	3	325.456	3.099	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)c2cccnc2C)C1	ZINC000963350086	1325142460	/nfs/dbraw/zinc/14/24/60/1325142460.db2.gz	YFBHNNNLKKGEJM-WMZOPIPTSA-N	0	3	347.890	3.459	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](CNCc3oc(CC)nc3C)C2)CC1	ZINC001027040583	1325175559	/nfs/dbraw/zinc/17/55/59/1325175559.db2.gz	GHZRAMFTGSNFHJ-INIZCTEOSA-N	0	3	345.487	3.230	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](CNCc3oc(CC)nc3C)C2)CC1	ZINC001027040584	1325176329	/nfs/dbraw/zinc/17/63/29/1325176329.db2.gz	GHZRAMFTGSNFHJ-MRXNPFEDSA-N	0	3	345.487	3.230	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)C2(F)CCCCC2)C1	ZINC001027155101	1325258485	/nfs/dbraw/zinc/25/84/85/1325258485.db2.gz	HRPMRQHBTDKTQB-INIZCTEOSA-N	0	3	343.446	3.169	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N(C)C1CCC(NCc2ccccc2C#N)CC1	ZINC000963926601	1325444632	/nfs/dbraw/zinc/44/46/32/1325444632.db2.gz	PRNJLWWTQJGMAZ-BTWUCOSQSA-N	0	3	339.483	3.464	20	30		EGEDHN
C#CCCN1CC[C@@H](N(C)C(=O)c2ccc(Cl)cc2Cl)C1	ZINC001033606706	1341897148	/nfs/dbraw/zinc/89/71/48/1341897148.db2.gz	PWNDTASAGBWAIM-CYBMUJFWSA-N	0	3	325.239	3.163	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC001027467763	1327722741	/nfs/dbraw/zinc/72/27/41/1327722741.db2.gz	UHIJDQJQWAGAHC-OAQYLSRUSA-N	0	3	347.462	3.224	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)C2(F)CCCC2)C1	ZINC001027469258	1327724468	/nfs/dbraw/zinc/72/44/68/1327724468.db2.gz	BCCVYMYYFZCBBJ-SFHVURJKSA-N	0	3	343.446	3.263	20	30		EGEDHN
C=C(Cl)CN(C)[C@H]1CCCN(C(=O)c2[nH]nc3ccc(C)cc32)C1	ZINC001027477719	1327733416	/nfs/dbraw/zinc/73/34/16/1327733416.db2.gz	KWRGUKLJGLBACJ-AWEZNQCLSA-N	0	3	346.862	3.160	20	30		EGEDHN
C[C@@H](NC[C@@H]1CCCN1CC(F)(F)F)c1ccc(C#N)cc1F	ZINC000926919442	1327776439	/nfs/dbraw/zinc/77/64/39/1327776439.db2.gz	DBJXTNCHRCJKLV-YPMHNXCESA-N	0	3	329.341	3.375	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H](N(C)CCn2nc(C)cc2C)C1	ZINC001027519604	1327792451	/nfs/dbraw/zinc/79/24/51/1327792451.db2.gz	QZFMLPGQIFVKRY-SFHVURJKSA-N	0	3	346.519	3.025	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](N(C)CCc2csc(C)n2)C1	ZINC001027523321	1327796922	/nfs/dbraw/zinc/79/69/22/1327796922.db2.gz	IAHNURAFLDVAFU-MRXNPFEDSA-N	0	3	335.517	3.129	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@H](N(C)Cc3ccc(F)c(C#N)c3)C2)CC1	ZINC001027562185	1327880377	/nfs/dbraw/zinc/88/03/77/1327880377.db2.gz	JYDQZBVCEHVGAU-KRWDZBQOSA-N	0	3	343.446	3.310	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N1CCC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001027564781	1327889828	/nfs/dbraw/zinc/88/98/28/1327889828.db2.gz	KROIKDURVXZYHK-VAMGGRTRSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)C1(F)CCCCC1)C2	ZINC000965733507	1328026017	/nfs/dbraw/zinc/02/60/17/1328026017.db2.gz	VOZOEAJSGCLEMF-UHFFFAOYSA-N	0	3	328.859	3.428	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2coc3ccc(CC)cc23)C1	ZINC000966129799	1328199797	/nfs/dbraw/zinc/19/97/97/1328199797.db2.gz	FVMQFLRKOVUFAP-BEFAXECRSA-N	0	3	338.451	3.459	20	30		EGEDHN
Cc1ccsc1C(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC000966317631	1328271594	/nfs/dbraw/zinc/27/15/94/1328271594.db2.gz	IORMBGYRMFCYPD-OAHLLOKOSA-N	0	3	343.427	3.072	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2cncc(-c3ccccc3)c2)C1	ZINC000966563457	1328341716	/nfs/dbraw/zinc/34/17/16/1328341716.db2.gz	LKWUEPRUSULSNE-DYESRHJHSA-N	0	3	347.462	3.212	20	30		EGEDHN
C=C(C)CCN1CCC[C@H]1CNC(=O)c1cnc(CC2CC2)s1	ZINC001028047795	1328513185	/nfs/dbraw/zinc/51/31/85/1328513185.db2.gz	IPDZWFABXGXSPR-HNNXBMFYSA-N	0	3	333.501	3.256	20	30		EGEDHN
C#CCNC(=O)[C@H](C)N[C@H](CCCc1ccccc1)c1ccccc1	ZINC000863400198	1329551957	/nfs/dbraw/zinc/55/19/57/1329551957.db2.gz	JDWSZKPSGSQDKA-GHTZIAJQSA-N	0	3	334.463	3.478	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)CN[C@H]1CCc2cccc3cccc1c32	ZINC000931807146	1329762912	/nfs/dbraw/zinc/76/29/12/1329762912.db2.gz	SLBAKJNVICJVFO-RXVVDRJESA-N	0	3	335.451	3.471	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1ccccc1COC(C)(C)C	ZINC000932550025	1329822178	/nfs/dbraw/zinc/82/21/78/1329822178.db2.gz	YETFWSWGRIGQDB-UHFFFAOYSA-N	0	3	331.460	3.078	20	30		EGEDHN
N#Cc1ccc(C2CCN([C@@H]3C[C@@H]4CCCC[C@@H]4NC3=O)CC2)cc1	ZINC000933606286	1329905560	/nfs/dbraw/zinc/90/55/60/1329905560.db2.gz	HONFDZJBXDENIL-SLFFLAALSA-N	0	3	337.467	3.185	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2c(C(C)C)nc3ccccn32)CC1	ZINC000933766762	1329920533	/nfs/dbraw/zinc/92/05/33/1329920533.db2.gz	MFDAJBLBHCXFSG-UHFFFAOYSA-N	0	3	341.459	3.230	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc(C)c(Cl)c2F)CC1	ZINC001052586432	1348587196	/nfs/dbraw/zinc/58/71/96/1348587196.db2.gz	JHNNNNFHBZRUCH-CQSZACIVSA-N	0	3	336.838	3.395	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CNC(C)(C)CSC)cc1	ZINC000934679100	1329999136	/nfs/dbraw/zinc/99/91/36/1329999136.db2.gz	VGXXUNAECOKATM-UHFFFAOYSA-N	0	3	349.500	3.063	20	30		EGEDHN
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)c1cc(C#N)c[nH]1	ZINC000866179665	1330074472	/nfs/dbraw/zinc/07/44/72/1330074472.db2.gz	BMZQTOKJJZSKQH-GOSISDBHSA-N	0	3	336.439	3.013	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccccc2CC(C)(C)C)[C@@H](C)C1	ZINC000942163536	1331855260	/nfs/dbraw/zinc/85/52/60/1331855260.db2.gz	MRHOJYFZQPRJFY-LPHOPBHVSA-N	0	3	326.484	3.349	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cccc(C(C)C)c2)[C@H](C)C1	ZINC000942270869	1331891689	/nfs/dbraw/zinc/89/16/89/1331891689.db2.gz	GRBNLZUDYXTZGJ-XLIONFOSSA-N	0	3	326.484	3.202	20	30		EGEDHN
C[C@H]1CN(Cc2cccc(C#N)c2)CC[C@H]1NC(=O)C1(C)CCC1	ZINC000942560069	1331975181	/nfs/dbraw/zinc/97/51/81/1331975181.db2.gz	KMYRGZAAPCLJFN-MAUKXSAKSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2c(Cl)cncc2Cl)[C@@H](C)C1	ZINC000942593993	1331994706	/nfs/dbraw/zinc/99/47/06/1331994706.db2.gz	BGVLUDCXYJYBBQ-GXFFZTMASA-N	0	3	328.243	3.015	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnc(-c3ccoc3)s2)[C@H](C)C1	ZINC000943333268	1332151325	/nfs/dbraw/zinc/15/13/25/1332151325.db2.gz	HTYOZWSVEWOBRU-TZMCWYRMSA-N	0	3	331.441	3.029	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cccc3sccc32)[C@H](C)C1	ZINC000943335157	1332152112	/nfs/dbraw/zinc/15/21/12/1332152112.db2.gz	QGVOIXNNXWBCKY-QAPCUYQASA-N	0	3	340.492	3.294	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C(F)F)cc2F)[C@H](C)C1	ZINC000943756864	1332255416	/nfs/dbraw/zinc/25/54/16/1332255416.db2.gz	XAKWBORQBOFEML-WBMJQRKESA-N	0	3	338.373	3.227	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnc3ccc(F)cc3c2)[C@H](C)C1	ZINC000943985813	1332303652	/nfs/dbraw/zinc/30/36/52/1332303652.db2.gz	ALYFTGYZQAFBRX-CXAGYDPISA-N	0	3	327.403	3.000	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnn(C3CCCCC3)c2)[C@@H](C)C1	ZINC000944016736	1332308558	/nfs/dbraw/zinc/30/85/58/1332308558.db2.gz	NJNICVPQCQCHOY-MAUKXSAKSA-N	0	3	330.476	3.015	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnn(C(CC)CC)c2C)[C@H](C)C1	ZINC000944063923	1332319630	/nfs/dbraw/zinc/31/96/30/1332319630.db2.gz	WIXSJHWOWAEPQM-KDOFPFPSSA-N	0	3	332.492	3.179	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2c(Cl)cccc2Cl)[C@@H](C)C1	ZINC000944304773	1332368236	/nfs/dbraw/zinc/36/82/36/1332368236.db2.gz	LAOLWAWSIYGDDK-SWLSCSKDSA-N	0	3	339.266	3.457	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(F)c(F)cc2Cl)[C@H](C)C1	ZINC000944617941	1332417735	/nfs/dbraw/zinc/41/77/35/1332417735.db2.gz	ABYLTUQQXYKRER-MEBBXXQBSA-N	0	3	328.790	3.244	20	30		EGEDHN
N#Cc1ccccc1CN1C[C@@H]2CCN(C(=O)C3=CCCC3)CC[C@@H]2C1	ZINC000946552927	1332853857	/nfs/dbraw/zinc/85/38/57/1332853857.db2.gz	SKVXVYNVSIGAKC-OYRHEFFESA-N	0	3	349.478	3.339	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3cc(C)nc(C)c3)CC[C@@H]2C1	ZINC000946608002	1332861901	/nfs/dbraw/zinc/86/19/01/1332861901.db2.gz	RABRASCUXVZSPY-CALCHBBNSA-N	0	3	347.890	3.235	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)C[C@@H]3CC[C@H]4C[C@H]43)CC[C@@H]2C1	ZINC000946651868	1332870901	/nfs/dbraw/zinc/87/09/01/1332870901.db2.gz	GZUCUMAKWQVNTE-NNPSNHGLSA-N	0	3	336.907	3.346	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3cc(C)cc(C)n3)CC[C@@H]2C1	ZINC000946657171	1332871897	/nfs/dbraw/zinc/87/18/97/1332871897.db2.gz	CRASBCLXRZKADV-CALCHBBNSA-N	0	3	347.890	3.235	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)C(C)(C)C(F)F)CC[C@@H]2C1	ZINC000946770031	1332896697	/nfs/dbraw/zinc/89/66/97/1332896697.db2.gz	GZZLRGAJYWQOTM-BETUJISGSA-N	0	3	334.838	3.201	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2ccccc2O)CCN1Cc1cccc(C#N)c1	ZINC000947046079	1332987915	/nfs/dbraw/zinc/98/79/15/1332987915.db2.gz	VZDWRVFOBNIWRP-CRAIPNDOSA-N	0	3	349.434	3.047	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnc(-c3ccccc3)o2)C[C@H]1C	ZINC000947417198	1333120417	/nfs/dbraw/zinc/12/04/17/1333120417.db2.gz	NDUWVWKXNWKOKB-ZBFHGGJFSA-N	0	3	325.412	3.110	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccc(-c3cnco3)cc2)C[C@H]1C	ZINC000947450764	1333133172	/nfs/dbraw/zinc/13/31/72/1333133172.db2.gz	YNXFBCRWWCFHDZ-RHSMWYFYSA-N	0	3	325.412	3.110	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](NC(=O)c2n[nH]c3ccc(C)cc32)C[C@@H]1C	ZINC000947492985	1333145743	/nfs/dbraw/zinc/14/57/43/1333145743.db2.gz	OINVWZPELQPVNY-KBPBESRZSA-N	0	3	346.862	3.207	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(OC)c(C(C)C)c2)C[C@@H]1C	ZINC000947506169	1333149974	/nfs/dbraw/zinc/14/99/74/1333149974.db2.gz	KYGXVPWXCJFXKJ-RDJZCZTQSA-N	0	3	328.456	3.035	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc(-n3cccc3)c2)C[C@H]1C	ZINC000947512045	1333151350	/nfs/dbraw/zinc/15/13/50/1333151350.db2.gz	SQWCMGXRQPJJST-MJGOQNOKSA-N	0	3	335.451	3.083	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2c(C)occ2C(F)(F)F)C[C@H]1C	ZINC000947547673	1333167731	/nfs/dbraw/zinc/16/77/31/1333167731.db2.gz	SWVWVGHPXNIARR-PWSUYJOCSA-N	0	3	330.350	3.376	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)C2(C)CC=CC2)CCN1Cc1ccc(C#N)cc1	ZINC000947693116	1333227543	/nfs/dbraw/zinc/22/75/43/1333227543.db2.gz	HDLKYVQZZVDIOJ-QFBILLFUSA-N	0	3	337.467	3.384	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2csc(-c3ccoc3)n2)C[C@@H]1C	ZINC000947820393	1333270935	/nfs/dbraw/zinc/27/09/35/1333270935.db2.gz	LCTNTUAITFQDRW-GXTWGEPZSA-N	0	3	331.441	3.172	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2c(F)cccc2Cl)C[C@@H]1C	ZINC000947967235	1333325088	/nfs/dbraw/zinc/32/50/88/1333325088.db2.gz	NBODQMZGPVOKRX-UONOGXRCSA-N	0	3	336.838	3.014	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc3c(c2)CCCC3)C[C@@H]1C	ZINC000948015834	1333342612	/nfs/dbraw/zinc/34/26/12/1333342612.db2.gz	IGGPFVDNCQTTMX-UWJYYQICSA-N	0	3	338.495	3.100	20	30		EGEDHN
C[C@@H](C(=O)N(C)[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1)C1CC1	ZINC000948274343	1333457000	/nfs/dbraw/zinc/45/70/00/1333457000.db2.gz	TVXAEMYYDLWNCV-OXQOHEQNSA-N	0	3	339.483	3.417	20	30		EGEDHN
CC1CC(C(=O)N(C)[C@@H]2CCCN(Cc3cccc(C#N)c3)CC2)C1	ZINC000948285857	1333463588	/nfs/dbraw/zinc/46/35/88/1333463588.db2.gz	DZEMXGMCICGLBG-RRWXTXHCSA-N	0	3	339.483	3.417	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2ccc3c4c(cccc42)CC3)CC1	ZINC000948597494	1333590191	/nfs/dbraw/zinc/59/01/91/1333590191.db2.gz	CGOXQBYSJHCBNS-LJQANCHMSA-N	0	3	346.474	3.498	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)C[C@@H]2C[C@H]2Cc2ccccc2)CC1	ZINC000948638506	1333607080	/nfs/dbraw/zinc/60/70/80/1333607080.db2.gz	CEXVCPPOAONWJU-HKBOAZHASA-N	0	3	338.495	3.201	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cccc3ncccc32)CC1	ZINC000948661460	1333617415	/nfs/dbraw/zinc/61/74/15/1333617415.db2.gz	BXMAPFLKOHMOHT-QGZVFWFLSA-N	0	3	335.451	3.185	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCN(CC2CCCCCC2)CC1	ZINC000948772925	1333673064	/nfs/dbraw/zinc/67/30/64/1333673064.db2.gz	QKVANUPNQWVQMT-UHFFFAOYSA-N	0	3	329.488	3.402	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2c(F)ccc(F)c2Cl)CC1	ZINC000948800698	1333684902	/nfs/dbraw/zinc/68/49/02/1333684902.db2.gz	YEHHASZQFIOMBE-LBPRGKRZSA-N	0	3	340.801	3.178	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)[C@H](C)c2cccc(C)c2)CC1	ZINC000948816906	1333695593	/nfs/dbraw/zinc/69/55/93/1333695593.db2.gz	PKPAJDWCCBTCON-QUCCMNQESA-N	0	3	326.484	3.435	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)Cc2ccc(Cl)s2)CC1	ZINC000948833111	1333703133	/nfs/dbraw/zinc/70/31/33/1333703133.db2.gz	JGZLNACYRZIXSY-AWEZNQCLSA-N	0	3	338.904	3.280	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2oc(CC(C)C)nc2C)CC1	ZINC000948841418	1333706349	/nfs/dbraw/zinc/70/63/49/1333706349.db2.gz	WHJPTQGHBBWKAI-QGZVFWFLSA-N	0	3	345.487	3.131	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccccc2F)CC1	ZINC000948845603	1333707535	/nfs/dbraw/zinc/70/75/35/1333707535.db2.gz	VHGMHEMQPPOJFX-NZSAHSFTSA-N	0	3	342.458	3.265	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2)CC1	ZINC000948850073	1333708339	/nfs/dbraw/zinc/70/83/39/1333708339.db2.gz	WLHGMLLFADPXKA-CEXWTWQISA-N	0	3	344.886	3.390	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cccc3c2ccn3C)CC1	ZINC000948855872	1333710952	/nfs/dbraw/zinc/71/09/52/1333710952.db2.gz	BQSRNWRGFSTJEO-QGZVFWFLSA-N	0	3	337.467	3.128	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)C(C)(C)c2ccccc2F)CC1	ZINC000948860209	1333711713	/nfs/dbraw/zinc/71/17/13/1333711713.db2.gz	ATMJGIPBKNOLQG-KRWDZBQOSA-N	0	3	344.474	3.440	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2ccc3nc(C)ccc3c2)CC1	ZINC000948873586	1333716719	/nfs/dbraw/zinc/71/67/19/1333716719.db2.gz	MDVQMUYKIQHHRR-FQEVSTJZSA-N	0	3	349.478	3.493	20	30		EGEDHN
CCCCN1CCc2ccccc2[C@H]1CNC(=O)c1c[nH]c(C#N)c1	ZINC000948906132	1333728201	/nfs/dbraw/zinc/72/82/01/1333728201.db2.gz	JLCHOUPRJAXVQG-LJQANCHMSA-N	0	3	336.439	3.016	20	30		EGEDHN
N#Cc1cc(C(=O)NC[C@H]2c3ccccc3CCN2CCC2CC2)c[nH]1	ZINC000948906477	1333728353	/nfs/dbraw/zinc/72/83/53/1333728353.db2.gz	NHVYZYBZRKKXKZ-FQEVSTJZSA-N	0	3	348.450	3.016	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@@H]1CNC(=O)C1=CCOCC1	ZINC000948909931	1333730008	/nfs/dbraw/zinc/73/00/08/1333730008.db2.gz	DTLSITPVNVGWCN-FQEVSTJZSA-N	0	3	340.467	3.015	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@@H]1CNC(=O)[C@H]1CC1(F)F	ZINC000948915936	1333733224	/nfs/dbraw/zinc/73/32/24/1333733224.db2.gz	IJFANEMWQFUZJL-SJORKVTESA-N	0	3	334.410	3.323	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NC[C@@H]1c2ccccc2CCN1CCC	ZINC000948919932	1333734705	/nfs/dbraw/zinc/73/47/05/1333734705.db2.gz	UEBZWSNBHQKAKW-AQNXPRMDSA-N	0	3	342.483	3.093	20	30		EGEDHN
C=CCC[C@H](C)N1CCCN(C(=O)c2scnc2Cl)CC1	ZINC001198122011	1368963687	/nfs/dbraw/zinc/96/36/87/1368963687.db2.gz	WDIIHLBSESRACM-LBPRGKRZSA-N	0	3	327.881	3.299	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1CCC=CCCC1)CCO2	ZINC000949120809	1333780057	/nfs/dbraw/zinc/78/00/57/1333780057.db2.gz	FZSBUYUGQFQJGY-SFHVURJKSA-N	0	3	332.488	3.002	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)CC1CCCCCC1)CCO2	ZINC000949202238	1333794913	/nfs/dbraw/zinc/79/49/13/1333794913.db2.gz	GMOSZHSQMUTQIQ-UHFFFAOYSA-N	0	3	334.504	3.226	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H](C)c1ccc(C)s1)CCO2	ZINC000949226841	1333798988	/nfs/dbraw/zinc/79/89/88/1333798988.db2.gz	OGPWRIDSOXIQPG-INIZCTEOSA-N	0	3	348.512	3.039	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)c3ccccc3C)CC2)C1	ZINC000949285489	1333815593	/nfs/dbraw/zinc/81/55/93/1333815593.db2.gz	IFGHZNIUDLFKTN-UHFFFAOYSA-N	0	3	342.483	3.268	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@@H]3CCC(C)=C(C)C3)CC2)C1	ZINC000949370319	1333832441	/nfs/dbraw/zinc/83/24/41/1333832441.db2.gz	PGEYXKPBGTXTNM-LJQANCHMSA-N	0	3	346.515	3.392	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@H]3CCCC34CC4)CC2)C1	ZINC000949395052	1333836528	/nfs/dbraw/zinc/83/65/28/1333836528.db2.gz	LVUSCWNKBKOAPK-GOSISDBHSA-N	0	3	346.515	3.226	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@@H](C)c3ccco3)CC2)C1	ZINC000949470546	1333857504	/nfs/dbraw/zinc/85/75/04/1333857504.db2.gz	CVFKZWICANBKOJ-KRWDZBQOSA-N	0	3	346.471	3.043	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C[C@H](C)c3ccco3)CC2)C1	ZINC000949512216	1333863586	/nfs/dbraw/zinc/86/35/86/1333863586.db2.gz	QZXUUHUZEWACAA-KRWDZBQOSA-N	0	3	346.471	3.043	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cc(F)cc3ccoc32)C1	ZINC000967061244	1335652327	/nfs/dbraw/zinc/65/23/27/1335652327.db2.gz	MMPVWSKTLGEIMW-DYVFJYSZSA-N	0	3	328.387	3.035	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2cccc(-n3cccc3)c2)C1	ZINC000967268213	1335681398	/nfs/dbraw/zinc/68/13/98/1335681398.db2.gz	CVZQAXAIDOAIQC-XLIONFOSSA-N	0	3	337.467	3.494	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2ccc3c4c(cccc42)CC3)C1	ZINC000967287048	1335689583	/nfs/dbraw/zinc/68/95/83/1335689583.db2.gz	CRVGEZQXXVCSKH-HRAATJIYSA-N	0	3	346.474	3.402	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2cnn3cccc(Cl)c23)C1	ZINC000967287687	1335690313	/nfs/dbraw/zinc/69/03/13/1335690313.db2.gz	IKGZKEZWZSKCLM-XJKSGUPXSA-N	0	3	346.862	3.004	20	30		EGEDHN
C=C(C)CCN1CC[C@H](C)[C@@H](NC(=O)c2nc3cnccc3s2)C1	ZINC000967315712	1335698865	/nfs/dbraw/zinc/69/88/65/1335698865.db2.gz	RDTAYGOUSWDUEQ-ZFWWWQNUSA-N	0	3	344.484	3.098	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(C(=O)C3CCCCCC3)C2)s1	ZINC000967663803	1335803358	/nfs/dbraw/zinc/80/33/58/1335803358.db2.gz	DCOFMCBSASGZKH-OAHLLOKOSA-N	0	3	331.485	3.281	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2nc(Cl)sc2Cl)C1	ZINC000967720118	1335806761	/nfs/dbraw/zinc/80/67/61/1335806761.db2.gz	IQXXHJVLHUZZKN-NXEZZACHSA-N	0	3	348.299	3.466	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2nsc3ccc(C)cc32)C1	ZINC000967780508	1335816092	/nfs/dbraw/zinc/81/60/92/1335816092.db2.gz	PRSGPEAMVYBFPR-ZBFHGGJFSA-N	0	3	341.480	3.068	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)Cc2ccc(F)cc2Cl)C1	ZINC000968212532	1335872758	/nfs/dbraw/zinc/87/27/58/1335872758.db2.gz	NEPDFQXYPHOAAI-GUYCJALGSA-N	0	3	338.854	3.424	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2ccc(C3CC3)nc2C)C1	ZINC000968341708	1335894987	/nfs/dbraw/zinc/89/49/87/1335894987.db2.gz	YINAOZNHFYJZPQ-IFXJQAMLSA-N	0	3	327.472	3.284	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)Cc2ccc(Cl)c(F)c2)C1	ZINC000968354277	1335899449	/nfs/dbraw/zinc/89/94/49/1335899449.db2.gz	PPUAUTCPLYCOKF-SUMWQHHRSA-N	0	3	338.854	3.424	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2ccc(Cl)c(OC)c2)C1	ZINC000968389895	1335915804	/nfs/dbraw/zinc/91/58/04/1335915804.db2.gz	BWRSVPYRBOYGKO-XJKSGUPXSA-N	0	3	336.863	3.365	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)Cc2c[nH]c3cc(C)ccc23)C1	ZINC000968405699	1335922229	/nfs/dbraw/zinc/92/22/29/1335922229.db2.gz	PMQSERUKTPUVJM-OXQOHEQNSA-N	0	3	339.483	3.422	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cc(-c3ccccc3)ccn2)C1	ZINC000968471347	1335933791	/nfs/dbraw/zinc/93/37/91/1335933791.db2.gz	DHZSRATZJKMHMB-UTKZUKDTSA-N	0	3	347.462	3.212	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2cccc3ccsc32)C1	ZINC000968506376	1335946384	/nfs/dbraw/zinc/94/63/84/1335946384.db2.gz	SMXOOSQARVCZDV-WMLDXEAASA-N	0	3	326.465	3.365	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C)[C@H](NC(=O)c2cccc3nc(C)[nH]c32)C1	ZINC000968508547	1335947234	/nfs/dbraw/zinc/94/72/34/1335947234.db2.gz	AZKBIOQTXNQNAC-BDJLRTHQSA-N	0	3	346.862	3.064	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)C23CC4CC(CC(C4)C2)C3)C1	ZINC000968575381	1335968342	/nfs/dbraw/zinc/96/83/42/1335968342.db2.gz	VWRFPPRVCGVJBS-AGWGEYTISA-N	0	3	328.500	3.053	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)C2(c3ccccc3C)CCC2)C1	ZINC000968592162	1335975743	/nfs/dbraw/zinc/97/57/43/1335975743.db2.gz	LHOBPBYMUNDTCG-UYAOXDASSA-N	0	3	338.495	3.267	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@H]1CN(Cc2ccccc2)CC[C@@H]1C	ZINC000968592091	1335976477	/nfs/dbraw/zinc/97/64/77/1335976477.db2.gz	KKFBPNFCWJSLCF-AVRDEDQJSA-N	0	3	346.474	3.237	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)C2(c3ccc(Cl)cc3)CC2)C1	ZINC000968624810	1335988359	/nfs/dbraw/zinc/98/83/59/1335988359.db2.gz	ZOAWSSYTAPWPKM-MAUKXSAKSA-N	0	3	344.886	3.222	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)Cc2ccc3c(c2)CCC3)C1	ZINC000968631014	1335990503	/nfs/dbraw/zinc/99/05/03/1335990503.db2.gz	FCZFKBHXLFWLRD-OXJNMPFZSA-N	0	3	326.484	3.121	20	30		EGEDHN
C[C@]1(C(=O)N2CC[C@@H](NCc3ccc(F)c(C#N)c3)C2)CC=CCC1	ZINC000968783406	1336049422	/nfs/dbraw/zinc/04/94/22/1336049422.db2.gz	XHZJIRXVEWGYSO-XLIONFOSSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H](NCc2sc(C)nc2C)C1	ZINC000968795455	1336054420	/nfs/dbraw/zinc/05/44/20/1336054420.db2.gz	NSEIDGOWGSRFGH-CYBMUJFWSA-N	0	3	341.908	3.229	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1ccn(C(C)(C)C)n1	ZINC000968881855	1336078347	/nfs/dbraw/zinc/07/83/47/1336078347.db2.gz	ARJTYCPYZAJJRQ-MRXNPFEDSA-N	0	3	332.492	3.189	20	30		EGEDHN
C#CCCN1CCCCC[C@@H]1CNC(=O)c1c(C)noc1C(C)C	ZINC000968895879	1336083474	/nfs/dbraw/zinc/08/34/74/1336083474.db2.gz	HBQNZMJOGVDZHN-MRXNPFEDSA-N	0	3	331.460	3.104	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)[C@H]1CCc2cccc(OC)c21	ZINC000969062171	1336134046	/nfs/dbraw/zinc/13/40/46/1336134046.db2.gz	KWEJMILDFNHEQE-MSOLQXFVSA-N	0	3	342.483	3.272	20	30		EGEDHN
C#CCCN1CCCCC[C@H]1CNC(=O)c1cc([C@@H](C)CC)no1	ZINC000969061574	1336134196	/nfs/dbraw/zinc/13/41/96/1336134196.db2.gz	BYRGLXBFQHZDKJ-HOTGVXAUSA-N	0	3	331.460	3.186	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC000969065382	1336136503	/nfs/dbraw/zinc/13/65/03/1336136503.db2.gz	RLZVCAAFVCFGPV-YZGWKJHDSA-N	0	3	342.483	3.346	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)c2cncc(-c3ccccc3)c2)C1	ZINC000969796734	1336248651	/nfs/dbraw/zinc/24/86/51/1336248651.db2.gz	MUMAJHRHHHUNRO-MRXNPFEDSA-N	0	3	335.451	3.375	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cnn3c2ccc(C)c3C)CC1	ZINC001005531616	1336368528	/nfs/dbraw/zinc/36/85/28/1336368528.db2.gz	YDCOGJOOZUFTAB-UHFFFAOYSA-N	0	3	340.471	3.064	20	30		EGEDHN
CN(C(=O)C1(C2CC2)CC1)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001005554148	1336370656	/nfs/dbraw/zinc/37/06/56/1336370656.db2.gz	KUCIEQLHJZGFEV-UHFFFAOYSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)Cn2c(C)cc3ccccc32)CC1	ZINC001005679128	1336391572	/nfs/dbraw/zinc/39/15/72/1336391572.db2.gz	FAOHEGCYNYBQMH-UHFFFAOYSA-N	0	3	325.456	3.059	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cc3c(C)nn(C)c3s2)CC1	ZINC001005790732	1336401911	/nfs/dbraw/zinc/40/19/11/1336401911.db2.gz	UUWVZCDNJJPASU-UHFFFAOYSA-N	0	3	346.500	3.056	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)[C@@H]2C[C@H]2c2ccccc2CC)CC1	ZINC001005892290	1336417522	/nfs/dbraw/zinc/41/75/22/1336417522.db2.gz	MKQIKPHSSFIVKL-VQTJNVASSA-N	0	3	326.484	3.461	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccc(F)c(COC)c2)CC1	ZINC001005968611	1336431680	/nfs/dbraw/zinc/43/16/80/1336431680.db2.gz	HESPQOQSRNDXEL-UHFFFAOYSA-N	0	3	334.435	3.085	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2ccc(C(F)F)c(F)c2)CC1	ZINC001005984822	1336434679	/nfs/dbraw/zinc/43/46/79/1336434679.db2.gz	BTRPSWPJWBMKBW-UHFFFAOYSA-N	0	3	326.362	3.486	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cnn([C@@H](C)CC)c2C)CC1	ZINC001006275342	1336479979	/nfs/dbraw/zinc/47/99/79/1336479979.db2.gz	OPPDRXBVWOPBKK-HNNXBMFYSA-N	0	3	332.492	3.275	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cc(C)n(C(C)(C)C)n2)CC1	ZINC001006417205	1336502221	/nfs/dbraw/zinc/50/22/21/1336502221.db2.gz	QPUXYTOIBMMPHA-UHFFFAOYSA-N	0	3	332.492	3.059	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2sc(C)nc2CC(C)C)C1	ZINC001007813937	1336705535	/nfs/dbraw/zinc/70/55/35/1336705535.db2.gz	VMMOQYROPPBGON-HNNXBMFYSA-N	0	3	335.517	3.420	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)c2cn(CC)c3ccccc23)C1	ZINC001007846974	1336716275	/nfs/dbraw/zinc/71/62/75/1336716275.db2.gz	SWVHVAPUSKEDQA-INIZCTEOSA-N	0	3	325.456	3.432	20	30		EGEDHN
C#CCCN1CCC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)s2)C1	ZINC001008308227	1336819913	/nfs/dbraw/zinc/81/99/13/1336819913.db2.gz	BCIPYYPKLHEMSF-BFHYXJOUSA-N	0	3	336.888	3.109	20	30		EGEDHN
C=C(C)CCN1CCC[C@H](NC(=O)c2noc3c2CCCCC3)C1	ZINC001008713067	1336915850	/nfs/dbraw/zinc/91/58/50/1336915850.db2.gz	HOUCSDDVGLOWHU-HNNXBMFYSA-N	0	3	331.460	3.104	20	30		EGEDHN
C#CCCN1CCC[C@@H](NC(=O)Cc2cccc3sccc32)C1	ZINC001008746071	1336919123	/nfs/dbraw/zinc/91/91/23/1336919123.db2.gz	HCMLSEQWOHUDCZ-MRXNPFEDSA-N	0	3	326.465	3.048	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N[C@H]2CCCN(CC=C(C)C)C2)cc1	ZINC001009652693	1337054157	/nfs/dbraw/zinc/05/41/57/1337054157.db2.gz	WZESVEKOGBRBQL-IBGZPJMESA-N	0	3	342.483	3.341	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](NC(=O)c2c(F)c(F)cc(F)c2F)C1	ZINC001014533796	1337811616	/nfs/dbraw/zinc/81/16/16/1337811616.db2.gz	SHPOYEQOOMZTHQ-SNVBAGLBSA-N	0	3	330.325	3.013	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CCN([C@H]2CCc3ccccc32)C1	ZINC001014731022	1337890022	/nfs/dbraw/zinc/89/00/22/1337890022.db2.gz	HSOULKZBKOWKID-MJGOQNOKSA-N	0	3	335.451	3.166	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCN(C[C@@H](OC)c3ccccc3)C2)CC1	ZINC001015660298	1338239942	/nfs/dbraw/zinc/23/99/42/1338239942.db2.gz	XBRYONAWEUKWFO-WOJBJXKFSA-N	0	3	342.483	3.311	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)[C@@H]2[C@@H](c3ccccc3)C2(C)C)CC1	ZINC001016625146	1338668678	/nfs/dbraw/zinc/66/86/78/1338668678.db2.gz	DQGUBPURCLMBEV-QRVBRYPASA-N	0	3	336.479	3.030	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2scnc2C2CCCC2)CC1	ZINC001016713356	1338699587	/nfs/dbraw/zinc/69/95/87/1338699587.db2.gz	VPIUCUVVDVPGQB-HNNXBMFYSA-N	0	3	343.496	3.018	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2cc3cc(Cl)ccc3o2)CC1	ZINC001016714821	1338700641	/nfs/dbraw/zinc/70/06/41/1338700641.db2.gz	LBYSMGFTUYBEGR-KRWDZBQOSA-N	0	3	342.826	3.304	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N[C@@H]1CC12CCN(Cc1cccc(C#N)c1)CC2	ZINC001016845157	1338744981	/nfs/dbraw/zinc/74/49/81/1338744981.db2.gz	NYGVGMWGZCQDGP-GUDVDZBRSA-N	0	3	337.467	3.075	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)[C@]2(C)CC[C@H](C)C2(C)C)CC1	ZINC001016862565	1338751356	/nfs/dbraw/zinc/75/13/56/1338751356.db2.gz	GFEPLMSPXCMELY-ZWOKBUDYSA-N	0	3	330.516	3.443	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cc(Cl)ccc2C)CC1	ZINC001016882476	1338758121	/nfs/dbraw/zinc/75/81/21/1338758121.db2.gz	QZPDDHOZTIXPIM-KRWDZBQOSA-N	0	3	330.859	3.256	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2oc3ccccc3c2C)CC1	ZINC001016962203	1338785585	/nfs/dbraw/zinc/78/55/85/1338785585.db2.gz	XMUFPFKKLSQJKW-GOSISDBHSA-N	0	3	336.435	3.349	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)Cc2ccc3ccccc3c2)CC1	ZINC001016965388	1338786286	/nfs/dbraw/zinc/78/62/86/1338786286.db2.gz	PQYWDXPFLOMOPY-NRFANRHFSA-N	0	3	346.474	3.376	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)[C@H](C)c2ccc(F)cc2F)CC1	ZINC001016984801	1338792270	/nfs/dbraw/zinc/79/22/70/1338792270.db2.gz	GPMLMVVVENKWFD-KDOFPFPSSA-N	0	3	346.421	3.062	20	30		EGEDHN
CC1CC(C(=O)N2CCC[C@H](CN(C)Cc3ccc(C#N)s3)C2)C1	ZINC001017096599	1338864584	/nfs/dbraw/zinc/86/45/84/1338864584.db2.gz	IZTMTZDKAZKTLZ-HWOWSKLDSA-N	0	3	345.512	3.336	20	30		EGEDHN
CN(Cc1cc(F)cc(F)c1)C[C@@H]1CCCN(C(=O)C#CC2CC2)C1	ZINC001017122799	1338880707	/nfs/dbraw/zinc/88/07/07/1338880707.db2.gz	AUDSAOKIOZHRMV-INIZCTEOSA-N	0	3	346.421	3.049	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](CN(C)Cc2c(C)noc2C)C1	ZINC001017179586	1338922943	/nfs/dbraw/zinc/92/29/43/1338922943.db2.gz	LBUDHEDHELQMER-MRXNPFEDSA-N	0	3	333.476	3.174	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H](CN(C)Cc2cnc(C)nc2)C1	ZINC001017201884	1338947365	/nfs/dbraw/zinc/94/73/65/1338947365.db2.gz	MYQKBBHHEMEBSY-XLIONFOSSA-N	0	3	344.503	3.058	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccnn1[C@H](C)CC	ZINC001017589919	1339374015	/nfs/dbraw/zinc/37/40/15/1339374015.db2.gz	LAESAPSCAUYPBL-ZACQAIPSSA-N	0	3	330.476	3.109	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2nc(C)oc2c1	ZINC001017638318	1339379900	/nfs/dbraw/zinc/37/99/00/1339379900.db2.gz	VBXKPICJFPYOEZ-CALCHBBNSA-N	0	3	339.439	3.391	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1c(C)cc(C)nc1C	ZINC001017752021	1339411173	/nfs/dbraw/zinc/41/11/73/1339411173.db2.gz	ULPKRLLLUWPFBX-HDICACEKSA-N	0	3	327.472	3.262	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1Cc2ccc(F)cc21	ZINC001017853236	1339430461	/nfs/dbraw/zinc/43/04/61/1339430461.db2.gz	WCLMXRXMMQGXCB-SCTDSRPQSA-N	0	3	328.431	3.107	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1CCc2ccccc2C1	ZINC001017994693	1339477397	/nfs/dbraw/zinc/47/73/97/1339477397.db2.gz	CHHWQUVQNAYAIX-PCCBWWKXSA-N	0	3	338.495	3.433	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CO[C@@H]1CCC[C@@H](C)C1	ZINC001018014546	1339481399	/nfs/dbraw/zinc/48/13/99/1339481399.db2.gz	LQUDVTXAROHLLY-AKHDSKFASA-N	0	3	334.504	3.223	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)CCc1ccc(F)cc1F	ZINC001018133363	1339509962	/nfs/dbraw/zinc/50/99/62/1339509962.db2.gz	VILAYKSISVWTOK-CALCHBBNSA-N	0	3	334.410	3.149	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1CCO[C@H](C(C)C)C1	ZINC001018144859	1339513350	/nfs/dbraw/zinc/51/33/50/1339513350.db2.gz	UVZVDOUWSBGBRP-OKYOBFRVSA-N	0	3	334.504	3.079	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)COc1cccc(C)c1	ZINC001018262912	1339554143	/nfs/dbraw/zinc/55/41/43/1339554143.db2.gz	AMHITFZBMRAJIJ-HDICACEKSA-N	0	3	328.456	3.015	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@H](C)n1nc(C)cc1C	ZINC001018270953	1339556500	/nfs/dbraw/zinc/55/65/00/1339556500.db2.gz	XCJXGQOHOKDJAU-GBESFXJTSA-N	0	3	344.503	3.092	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CC1CCC(OC)CC1	ZINC001018343823	1339585636	/nfs/dbraw/zinc/58/56/36/1339585636.db2.gz	BDWNZOOJKCCBTH-FXSDRFNOSA-N	0	3	334.504	3.223	20	30		EGEDHN
Cc1scc(C(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)c1C	ZINC001018907409	1339749656	/nfs/dbraw/zinc/74/96/56/1339749656.db2.gz	DUDAKKPCMUXKQR-ZDUSSCGKSA-N	0	3	345.493	3.302	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@H](NCc2cc(F)cc(F)c2)C1	ZINC001018909931	1339750731	/nfs/dbraw/zinc/75/07/31/1339750731.db2.gz	FXTLYYLCDUYVEL-HNNXBMFYSA-N	0	3	342.817	3.434	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@@H]2CCCN2Cc2cc(C)cc(C)c2)c1	ZINC001028128007	1340446901	/nfs/dbraw/zinc/44/69/01/1340446901.db2.gz	ZHZISFRMJZLSLC-NRFANRHFSA-N	0	3	347.462	3.074	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1csc(-c2ccoc2)n1	ZINC001028207588	1340485644	/nfs/dbraw/zinc/48/56/44/1340485644.db2.gz	UAALRNZSWWTJOT-AWEZNQCLSA-N	0	3	331.441	3.173	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1cnn(C(CC)CC)c1C	ZINC001028250741	1340511141	/nfs/dbraw/zinc/51/11/41/1340511141.db2.gz	MAXUDTXOBAHMGH-KRWDZBQOSA-N	0	3	332.492	3.323	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@@H]1CCN(Cc2ccc(F)cc2)C1	ZINC001028593609	1340718602	/nfs/dbraw/zinc/71/86/02/1340718602.db2.gz	PFDLSDFWRURNKU-KRWDZBQOSA-N	0	3	341.430	3.065	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](CNC(=O)C34CCC(CC3)C4)C2)cc1	ZINC001028634325	1340736784	/nfs/dbraw/zinc/73/67/84/1340736784.db2.gz	ZVXIJCHEICSXBX-IPFXWSOASA-N	0	3	337.467	3.077	20	30		EGEDHN
CC1(C)CC[C@H](C(=O)NC[C@@H]2CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001028788113	1340818438	/nfs/dbraw/zinc/81/84/38/1340818438.db2.gz	JBVZWQWREXQUKU-OALUTQOASA-N	0	3	339.483	3.323	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)c2ccc(-c3ccco3)s2)C1	ZINC001028901413	1340878820	/nfs/dbraw/zinc/87/88/20/1340878820.db2.gz	BVQALLVZLDEHHU-AWEZNQCLSA-N	0	3	328.437	3.083	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)c2oc3ccccc3c2Cl)C1	ZINC001028922477	1340884946	/nfs/dbraw/zinc/88/49/46/1340884946.db2.gz	MGYOZALUQYSLNP-ZDUSSCGKSA-N	0	3	330.815	3.161	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)NC[C@H]2CCN(Cc3ccc(C#N)cc3)C2)CC1	ZINC001028938262	1340887756	/nfs/dbraw/zinc/88/77/56/1340887756.db2.gz	KTPPXHIMDZJJHA-NSISKUIASA-N	0	3	339.483	3.323	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)c2cc(Cl)ccc2Cl)C1	ZINC001028949955	1340891901	/nfs/dbraw/zinc/89/19/01/1340891901.db2.gz	UBKKXUYLEHMMKU-GFCCVEGCSA-N	0	3	325.239	3.068	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@H]2CCN(Cc3ccc(C#N)cc3)C2)cc1C	ZINC001028966477	1340895612	/nfs/dbraw/zinc/89/56/12/1340895612.db2.gz	CDOXYKGBAPKFJJ-HXUWFJFHSA-N	0	3	347.462	3.427	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)C1CCN(C(=O)C=C2CCC2)CC1	ZINC001029080482	1340926017	/nfs/dbraw/zinc/92/60/17/1340926017.db2.gz	QGNLJONXIKXKMF-INIZCTEOSA-N	0	3	337.467	3.385	20	30		EGEDHN
CC[C@H](F)C(=O)N1CCC([C@@H](C)NCc2cc(F)ccc2C#N)CC1	ZINC001029129622	1340937764	/nfs/dbraw/zinc/93/77/64/1340937764.db2.gz	XVKPHBXGDUYOSV-ACJLOTCBSA-N	0	3	349.425	3.162	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1C[C@H]2CC[C@@H](C1)N2[C@H]1CCc2ccc(Cl)cc21	ZINC001029244781	1340960492	/nfs/dbraw/zinc/96/04/92/1340960492.db2.gz	LPPQPAPCONZVEH-PTOXDTDZSA-N	0	3	343.858	3.162	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CC[C@@H](C1)N2C[C@H](O)C1CCCCC1	ZINC001029454317	1340993825	/nfs/dbraw/zinc/99/38/25/1340993825.db2.gz	YPUNMVJQEUUMIC-JTJHWIPRSA-N	0	3	348.531	3.205	20	30		EGEDHN
C=C[C@H](C(=O)N1C[C@H]2CC[C@@H](C1)N2C[C@@H](CC)OC)c1ccccc1	ZINC001029594649	1341018369	/nfs/dbraw/zinc/01/83/69/1341018369.db2.gz	TUHKFJXKCFKPRP-WCIQWLHISA-N	0	3	342.483	3.056	20	30		EGEDHN
Cc1ccc(CN(C)C[C@H]2CCN(C(=O)[C@@H](C)C#N)C2)c(Cl)c1	ZINC001029677046	1341040484	/nfs/dbraw/zinc/04/04/84/1341040484.db2.gz	IGKYHVUSNZLFOF-LSDHHAIUSA-N	0	3	333.863	3.088	20	30		EGEDHN
CCC1(C(=O)N2CC[C@@H](CN(C)Cc3ccc(C#N)s3)C2)CCC1	ZINC001029811483	1341081772	/nfs/dbraw/zinc/08/17/72/1341081772.db2.gz	GLZLJYRAGGETOY-HNNXBMFYSA-N	0	3	345.512	3.480	20	30		EGEDHN
C#CCCN1CCC[C@H](N(Cc2ccccc2)C(=O)c2ccncc2)C1	ZINC001029919112	1341119056	/nfs/dbraw/zinc/11/90/56/1341119056.db2.gz	PFCGEDDVCOZAFY-NRFANRHFSA-N	0	3	347.462	3.212	20	30		EGEDHN
C#CCCN1CCC[C@@H](N(Cc2ccccc2)C(=O)c2[nH]ccc2C)C1	ZINC001029919776	1341119300	/nfs/dbraw/zinc/11/93/00/1341119300.db2.gz	HWVQAFSTHKMANY-HXUWFJFHSA-N	0	3	349.478	3.453	20	30		EGEDHN
C#CCCN1CCC[C@@H](N(Cc2ccccc2)C(=O)c2c[nH]cc2C)C1	ZINC001029920523	1341119936	/nfs/dbraw/zinc/11/99/36/1341119936.db2.gz	GRCVJXWBFDAYKZ-HXUWFJFHSA-N	0	3	349.478	3.453	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)N1CCC(CN(C)Cc2cc(C#N)ccc2F)CC1	ZINC001029931226	1341125201	/nfs/dbraw/zinc/12/52/01/1341125201.db2.gz	NOSNEKNFIQGHCZ-RDTXWAMCSA-N	0	3	343.446	3.024	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC(CN(C)Cc2cnoc2C)CC1	ZINC001029983033	1341143724	/nfs/dbraw/zinc/14/37/24/1341143724.db2.gz	SUPOXWAZQLRSCL-UHFFFAOYSA-N	0	3	333.476	3.256	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NCC1CN(CC2=CCCCC2)C1	ZINC001031778107	1341400629	/nfs/dbraw/zinc/40/06/29/1341400629.db2.gz	JGCPYXCMDOJSFZ-UHFFFAOYSA-N	0	3	340.467	3.413	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1coc2ccc(OC)cc12	ZINC001032514753	1341527941	/nfs/dbraw/zinc/52/79/41/1341527941.db2.gz	RBTDSYBOBVDTBI-GJZGRUSLSA-N	0	3	340.423	3.306	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(C)c2cccnc12	ZINC001032526021	1341531512	/nfs/dbraw/zinc/53/15/12/1341531512.db2.gz	LPWMOYWLKALDIJ-IRXDYDNUSA-N	0	3	335.451	3.408	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H](CC)c1c(C)noc1C	ZINC001032684218	1341581687	/nfs/dbraw/zinc/58/16/87/1341581687.db2.gz	GNBZKFROTPSUGE-ULQDDVLXSA-N	0	3	331.460	3.036	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H](C)c1cccc(OC)c1	ZINC001032803917	1341619627	/nfs/dbraw/zinc/61/96/27/1341619627.db2.gz	QFAXOOOQNWOBAN-SZMVWBNQSA-N	0	3	328.456	3.050	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)C2(c3cccc(Cl)c3)CC2)C1	ZINC001033127928	1341734349	/nfs/dbraw/zinc/73/43/49/1341734349.db2.gz	YLQOEPFXHSYERP-KRWDZBQOSA-N	0	3	332.875	3.480	20	30		EGEDHN
C=C(C)CCN1CC[C@H](N(C)C(=O)c2cc3ccncc3s2)C1	ZINC001033149065	1341739949	/nfs/dbraw/zinc/73/99/49/1341739949.db2.gz	HMBXUTDWBYKZSI-HNNXBMFYSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)[C@@H]2CCCC[C@H]2C(F)(F)F)C1	ZINC001033160428	1341741573	/nfs/dbraw/zinc/74/15/73/1341741573.db2.gz	HBVUHLHHBZNPGK-RRFJBIMHSA-N	0	3	332.410	3.464	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2ccc(F)c3ccncc23)C1	ZINC001033354365	1341794066	/nfs/dbraw/zinc/79/40/66/1341794066.db2.gz	PADDCLOPPPAQLQ-CQSZACIVSA-N	0	3	327.403	3.096	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@H]2CCN(Cc3ccccc3N(C)C)C2)C1	ZINC001033399303	1341813176	/nfs/dbraw/zinc/81/31/76/1341813176.db2.gz	OGEVGNURXDJEJC-SFHVURJKSA-N	0	3	341.499	3.142	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2cccc(N3CCCC3)c2)C1	ZINC001033525410	1341858868	/nfs/dbraw/zinc/85/88/68/1341858868.db2.gz	OHAHYMQFYZZYES-LJQANCHMSA-N	0	3	327.472	3.009	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2cccc(-c3cnco3)c2)C1	ZINC001033552342	1341868143	/nfs/dbraw/zinc/86/81/43/1341868143.db2.gz	VUOXRFCIHXDOIW-KRWDZBQOSA-N	0	3	325.412	3.064	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2cnn(C3CCCCC3)c2)C1	ZINC001033561723	1341873342	/nfs/dbraw/zinc/87/33/42/1341873342.db2.gz	HGTJAYWIWZDMPK-GOSISDBHSA-N	0	3	330.476	3.111	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@@H]2CCN(Cc3cc(C)cc(C)c3)C2)nc1	ZINC001033592800	1341888692	/nfs/dbraw/zinc/88/86/92/1341888692.db2.gz	JFVLMGDXVYDLFK-HXUWFJFHSA-N	0	3	347.462	3.026	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccc3nc(C)oc3c2)C1	ZINC001033863297	1342050297	/nfs/dbraw/zinc/05/02/97/1342050297.db2.gz	VMCGHFWSPWNEDU-MRXNPFEDSA-N	0	3	327.428	3.249	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@H]2Cc3cc(Cl)ccc3O2)C1	ZINC001033894736	1342067618	/nfs/dbraw/zinc/06/76/18/1342067618.db2.gz	ZTBHJWQHVGOKHC-SJLPKXTDSA-N	0	3	348.874	3.142	20	30		EGEDHN
C#Cc1cncc(C(=O)N(CC)[C@@H]2CCN(CC3=CCCCC3)C2)c1	ZINC001033955460	1342112440	/nfs/dbraw/zinc/11/24/40/1342112440.db2.gz	LHWJPBGEHZIDFG-HXUWFJFHSA-N	0	3	337.467	3.100	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cc(Cl)cc(OC)c2)C1	ZINC001033999874	1342139686	/nfs/dbraw/zinc/13/96/86/1342139686.db2.gz	OOBDWUMUOBDDQT-INIZCTEOSA-N	0	3	336.863	3.461	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cc3c(C)cccn3c2)C1	ZINC001034017146	1342154637	/nfs/dbraw/zinc/15/46/37/1342154637.db2.gz	XVAZEJBEVMYMSF-SFHVURJKSA-N	0	3	325.456	3.360	20	30		EGEDHN
C#Cc1ccc(C(=O)N(CC)[C@@H]2CCN(CC3=CCCCC3)C2)nc1	ZINC001034022047	1342159912	/nfs/dbraw/zinc/15/99/12/1342159912.db2.gz	AVWOAALVFWIOCC-LJQANCHMSA-N	0	3	337.467	3.100	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2c(Cl)nc3ccccn32)C1	ZINC001034034939	1342173650	/nfs/dbraw/zinc/17/36/50/1342173650.db2.gz	HROVPQYAIDPBDV-AWEZNQCLSA-N	0	3	346.862	3.100	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3nsc4ccccc43)[C@@H]2C1	ZINC001075827293	1356429945	/nfs/dbraw/zinc/42/99/45/1356429945.db2.gz	ONNHBVHLOZXILI-DZGCQCFKSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cc(Cl)cc3c2OCC3)C1	ZINC001034047694	1342186969	/nfs/dbraw/zinc/18/69/69/1342186969.db2.gz	KJWUCAOWMKXCBU-MRXNPFEDSA-N	0	3	348.874	3.387	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccc(N(CC)CC)nc2)C1	ZINC001034050967	1342192960	/nfs/dbraw/zinc/19/29/60/1342192960.db2.gz	KEDUHWZAFRVOFG-GOSISDBHSA-N	0	3	344.503	3.040	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)C2CC(c3ccc(F)cc3)C2)C1	ZINC001034054176	1342194624	/nfs/dbraw/zinc/19/46/24/1342194624.db2.gz	FQNFNCQXQWHZKU-AFMYVXGZSA-N	0	3	342.458	3.265	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)C2CC(c3cccc(F)c3)C2)C1	ZINC001034055463	1342195851	/nfs/dbraw/zinc/19/58/51/1342195851.db2.gz	WNBPUGRSZXWFKW-AFMYVXGZSA-N	0	3	342.458	3.265	20	30		EGEDHN
N#Cc1ccc(CN2CCCC[C@@H](NC(=O)C[C@H]3C=CCC3)C2)cc1	ZINC001034092190	1342232024	/nfs/dbraw/zinc/23/20/24/1342232024.db2.gz	URTTUDRHDJTSOG-FXAWDEMLSA-N	0	3	337.467	3.385	20	30		EGEDHN
Cc1cc(CN2CCCC[C@H](NC(=O)c3ccc(C#N)[nH]3)C2)cs1	ZINC001034165562	1342290577	/nfs/dbraw/zinc/29/05/77/1342290577.db2.gz	OCEGRTLUFKKRMJ-INIZCTEOSA-N	0	3	342.468	3.041	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2csc([C@@H]3CCCO3)n2)C1	ZINC001034206975	1342317703	/nfs/dbraw/zinc/31/77/03/1342317703.db2.gz	NSAXAVIWPFZSAU-ZBFHGGJFSA-N	0	3	349.500	3.155	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)c2coc3c2cccc3OC)C1	ZINC001034213417	1342322442	/nfs/dbraw/zinc/32/24/42/1342322442.db2.gz	XYTJMKHJVYKCNT-AWEZNQCLSA-N	0	3	328.412	3.212	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc3cc(C)cn3c2)C1	ZINC001034236332	1342338134	/nfs/dbraw/zinc/33/81/34/1342338134.db2.gz	IWBLSTYMYUDUPF-SFHVURJKSA-N	0	3	325.456	3.408	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cc(Cl)c(Cl)n2C)C1	ZINC001034238902	1342340206	/nfs/dbraw/zinc/34/02/06/1342340206.db2.gz	GVIHOAHQXSCEFZ-GFCCVEGCSA-N	0	3	344.286	3.492	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2cc(C)n(C(CC)CC)n2)C1	ZINC001034283525	1342372108	/nfs/dbraw/zinc/37/21/08/1342372108.db2.gz	WKSFCPZWFZSHRV-QGZVFWFLSA-N	0	3	344.503	3.160	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2[nH]nc3ccc(C)cc32)C1	ZINC001034287603	1342374237	/nfs/dbraw/zinc/37/42/37/1342374237.db2.gz	WNEMXXLBPPIQNA-HNNXBMFYSA-N	0	3	326.444	3.032	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2nc(Cl)sc2C)C1	ZINC001034307280	1342389954	/nfs/dbraw/zinc/38/99/54/1342389954.db2.gz	UPDBUOXZESILDR-GFCCVEGCSA-N	0	3	327.881	3.265	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ncsc2C(F)(F)F)C1	ZINC001034308740	1342391464	/nfs/dbraw/zinc/39/14/64/1342391464.db2.gz	CUCGMJDZRPQZHE-LLVKDONJSA-N	0	3	347.406	3.322	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)C2(c3cccc(F)c3)CC2)C1	ZINC001034429923	1342491193	/nfs/dbraw/zinc/49/11/93/1342491193.db2.gz	XSZKNCJVYBPMMI-GOSISDBHSA-N	0	3	330.447	3.404	20	30		EGEDHN
C=C(Cl)CN1CCCC[C@H](NC(=O)c2cccc3nc(C)[nH]c32)C1	ZINC001034475665	1342530566	/nfs/dbraw/zinc/53/05/66/1342530566.db2.gz	CRMWFXXZBCYRNH-AWEZNQCLSA-N	0	3	346.862	3.208	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccnc(O[C@@H](C)CC)c2)C1	ZINC001034478760	1342535157	/nfs/dbraw/zinc/53/51/57/1342535157.db2.gz	OAFYILJTRBJQJP-FUHWJXTLSA-N	0	3	345.487	3.419	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2coc3ccc(F)cc23)C1	ZINC001034509472	1342567853	/nfs/dbraw/zinc/56/78/53/1342567853.db2.gz	CBGJXJYVUGPZHQ-HNNXBMFYSA-N	0	3	328.387	3.180	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ncccc2OC(C)C)C1	ZINC001034509570	1342568145	/nfs/dbraw/zinc/56/81/45/1342568145.db2.gz	YSTKDKVCRRHNRI-INIZCTEOSA-N	0	3	331.460	3.029	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@@]2(C)CCc3ccccc32)C1	ZINC001034543877	1342604767	/nfs/dbraw/zinc/60/47/67/1342604767.db2.gz	BPZISZGSECFIIY-NQIIRXRSSA-N	0	3	326.484	3.437	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)C(C)(C)c2ccccc2OC)C1	ZINC001034552090	1342614821	/nfs/dbraw/zinc/61/48/21/1342614821.db2.gz	XRYXYBXDBWNNKX-INIZCTEOSA-N	0	3	330.472	3.130	20	30		EGEDHN
CC1CC(C(=O)N[C@H]2CC[C@H](NCc3cc(F)ccc3C#N)CC2)C1	ZINC001034624681	1342657334	/nfs/dbraw/zinc/65/73/34/1342657334.db2.gz	ODNQJBYDMSCOKU-SHAWJESVSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)[C@H]2CC[C@@H](C)C2)CC1	ZINC001034750106	1342737406	/nfs/dbraw/zinc/73/74/06/1342737406.db2.gz	YDLHKDSVDIZZME-FAAHXZRKSA-N	0	3	343.309	3.348	20	30		EGEDHN
N#Cc1cccc(CNCc2ccc(CNC(=O)[C@@H]3CC34CC4)cc2)c1	ZINC001034827368	1342787816	/nfs/dbraw/zinc/78/78/16/1342787816.db2.gz	WYWSGEORMNITRO-FQEVSTJZSA-N	0	3	345.446	3.264	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)CC2CCCC2)c(F)c1	ZINC001034846643	1342799397	/nfs/dbraw/zinc/79/93/97/1342799397.db2.gz	WXPKELSAQZTAMM-GOSISDBHSA-N	0	3	343.446	3.358	20	30		EGEDHN
C[C@H](NC[C@H]1CCCN1C(=O)C#CC1CC1)c1ccccc1Cl	ZINC001034929923	1342840801	/nfs/dbraw/zinc/84/08/01/1342840801.db2.gz	DCJOECVDBFCFKQ-GOEBONIOSA-N	0	3	330.859	3.395	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC[C@@H]1CNCc1cncs1	ZINC001034947447	1342848692	/nfs/dbraw/zinc/84/86/92/1342848692.db2.gz	ROEYPDHHNLUDSX-GFCCVEGCSA-N	0	3	327.881	3.002	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(C2)CCN(C(=O)C2CCC2)CC3)s1	ZINC001035148133	1342959883	/nfs/dbraw/zinc/95/98/83/1342959883.db2.gz	WVURUYBKEUDKIJ-UHFFFAOYSA-N	0	3	343.496	3.234	20	30		EGEDHN
N#Cc1ccccc1CN1CCC2(C1)CCN(C(=O)c1ccco1)CC2	ZINC001035150221	1342963542	/nfs/dbraw/zinc/96/35/42/1342963542.db2.gz	ROZJHXUWCZNAPX-UHFFFAOYSA-N	0	3	349.434	3.280	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC2(CCN(Cc3cc(C)no3)C2)CC1	ZINC001035214016	1343032534	/nfs/dbraw/zinc/03/25/34/1343032534.db2.gz	VATVDPLCQRCCEP-UHFFFAOYSA-N	0	3	345.487	3.400	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CCC2(CCN(Cc3ccc(C#N)s3)C2)CC1	ZINC001035217783	1343037927	/nfs/dbraw/zinc/03/79/27/1343037927.db2.gz	LDMULHGBKSVALE-MRXNPFEDSA-N	0	3	349.475	3.182	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H]1CCC[C@H]1C(F)F)CC2	ZINC001035721265	1343151674	/nfs/dbraw/zinc/15/16/74/1343151674.db2.gz	SUUCIASDMSKWOA-HUUCEWRRSA-N	0	3	326.431	3.168	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C[C@@H]1CCC[C@H](OC)C1)CC2	ZINC001035722757	1343152419	/nfs/dbraw/zinc/15/24/19/1343152419.db2.gz	OCIQDTOGCADKIQ-MSOLQXFVSA-N	0	3	334.504	3.082	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@@H]1CCCc3ccccc31)CC2	ZINC001035732414	1343158650	/nfs/dbraw/zinc/15/86/50/1343158650.db2.gz	CAPASGDRYZRORD-HXUWFJFHSA-N	0	3	336.479	3.054	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H]1C[C@]1(C)c1ccccc1)CC2	ZINC001035752854	1343170758	/nfs/dbraw/zinc/17/07/58/1343170758.db2.gz	HNRJMSCHOVBMNK-PZJWPPBQSA-N	0	3	338.495	3.465	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)CCc1ccc(Cl)cc1)CC2	ZINC001035759343	1343173767	/nfs/dbraw/zinc/17/37/67/1343173767.db2.gz	UCRBHNSUTBPDTF-UHFFFAOYSA-N	0	3	344.886	3.220	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC2(CN(C[C@@H]3CC[C@@H](C)O3)C2)CC1	ZINC001035767727	1343179880	/nfs/dbraw/zinc/17/98/80/1343179880.db2.gz	VOJAVFJOCYELDH-SJORKVTESA-N	0	3	334.504	3.081	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)C(C1CCC1)C1CCC1)CC2	ZINC001035777931	1343188250	/nfs/dbraw/zinc/18/82/50/1343188250.db2.gz	UXPGDLNIABUPLT-UHFFFAOYSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccc(F)c(Cl)c1)CC2	ZINC001035779968	1343190510	/nfs/dbraw/zinc/19/05/10/1343190510.db2.gz	UZQGNMYJFTYAKC-UHFFFAOYSA-N	0	3	334.822	3.040	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cc(C)nc3ccccc31)CC2	ZINC001035846088	1343226848	/nfs/dbraw/zinc/22/68/48/1343226848.db2.gz	YUIRWISHPLLHER-UHFFFAOYSA-N	0	3	347.462	3.105	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cccc3cnccc31)CC2	ZINC001035850644	1343230329	/nfs/dbraw/zinc/23/03/29/1343230329.db2.gz	NWZYFYXBLRTCDY-UHFFFAOYSA-N	0	3	335.451	3.349	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1sccc1C(C)C)CC2	ZINC001035858465	1343234692	/nfs/dbraw/zinc/23/46/92/1343234692.db2.gz	JFWZQYDGSZDLKY-UHFFFAOYSA-N	0	3	330.497	3.433	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)C[C@H](C)c1ccc(F)cc1)CC2	ZINC001035859725	1343235821	/nfs/dbraw/zinc/23/58/21/1343235821.db2.gz	XLFIMAMUGNDUFV-KRWDZBQOSA-N	0	3	342.458	3.267	20	30		EGEDHN
Cc1occc1C(=O)N1CC[C@H](NCc2ccccc2C#N)[C@H](C)C1	ZINC001035908446	1343264786	/nfs/dbraw/zinc/26/47/86/1343264786.db2.gz	HCEKIKLUARMSCJ-KUHUBIRLSA-N	0	3	337.423	3.100	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@@H](NCc2cc(F)ccc2C#N)[C@@H](C)C1	ZINC001035990058	1343304202	/nfs/dbraw/zinc/30/42/02/1343304202.db2.gz	FAPJIUODXKHMOV-SUMWQHHRSA-N	0	3	347.409	3.287	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@@H](NCc2cc(F)ccc2C#N)[C@@H](C)C1	ZINC001036163213	1343338215	/nfs/dbraw/zinc/33/82/15/1343338215.db2.gz	FKJNQQLMNXNANA-KBXCAEBGSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3cnc(C)o3)[C@H](C)C2)CC1	ZINC001036174602	1343346847	/nfs/dbraw/zinc/34/68/47/1343346847.db2.gz	PUNGFIBEEJXEQW-KDOFPFPSSA-N	0	3	331.460	3.056	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]([C@H](C)NCc3cscn3)C2)C1	ZINC001036441769	1343489920	/nfs/dbraw/zinc/48/99/20/1343489920.db2.gz	CWORPFMKSDFZOT-LSDHHAIUSA-N	0	3	333.501	3.216	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)CC2CC2)[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001036492443	1343515380	/nfs/dbraw/zinc/51/53/80/1343515380.db2.gz	CXPMASHUUINJSK-AUUYWEPGSA-N	0	3	343.446	3.214	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC[C@H](C)[C@@H]1CNCc1ccc(C#N)s1	ZINC001036533046	1343540339	/nfs/dbraw/zinc/54/03/39/1343540339.db2.gz	LXUMEYUTTBZZMG-WAFWRPRCSA-N	0	3	331.485	3.303	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC[C@H](C)[C@@H]1CNCc1cc(C#N)ccc1F	ZINC001036533546	1343541068	/nfs/dbraw/zinc/54/10/68/1343541068.db2.gz	SVZMZOVLKDSEQY-QGFYBQKZSA-N	0	3	343.446	3.380	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)C2=CCCC2)[C@@H]1CNCc1ccc(C#N)s1	ZINC001036535582	1343542763	/nfs/dbraw/zinc/54/27/63/1343542763.db2.gz	XJJXSQXZTMKAFA-RDTXWAMCSA-N	0	3	343.496	3.447	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)C#CC2CC2)[C@H]1CNCc1cc(F)cc(F)c1	ZINC001036550565	1343549566	/nfs/dbraw/zinc/54/95/66/1343549566.db2.gz	XQAOMNQEWSXDMW-KUHUBIRLSA-N	0	3	346.421	3.095	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@H]3[C@H](CCN3CC#Cc3ccccc3)C2)o1	ZINC001036637536	1343593431	/nfs/dbraw/zinc/59/34/31/1343593431.db2.gz	PFRUXRUDQGGYOB-UXHICEINSA-N	0	3	348.446	3.176	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@H]2[C@@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001036652786	1343602822	/nfs/dbraw/zinc/60/28/22/1343602822.db2.gz	XZXLTDHDCLHTFN-YJBOKZPZSA-N	0	3	345.512	3.479	20	30		EGEDHN
C/C=C(/C)C(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccc(C#N)c(F)c2)C1	ZINC001036682515	1343623882	/nfs/dbraw/zinc/62/38/82/1343623882.db2.gz	FFFCGOMYSCVWIA-AZDZRYJGSA-N	0	3	341.430	3.086	20	30		EGEDHN
CC(C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccccc2C#N)C1)=C1CCC1	ZINC001036713355	1343646640	/nfs/dbraw/zinc/64/66/40/1343646640.db2.gz	HVLXGYYJKKVFIV-LEWJYISDSA-N	0	3	349.478	3.481	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2[C@H](CCN2Cc2oc(CC)nc2C)C1	ZINC001036789127	1343718266	/nfs/dbraw/zinc/71/82/66/1343718266.db2.gz	MSGGQYQWNHCFEW-CVEARBPZSA-N	0	3	345.487	3.180	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2[C@H](CCN2Cc2oc(C)nc2C)C1	ZINC001036793874	1343726165	/nfs/dbraw/zinc/72/61/65/1343726165.db2.gz	MIMKNKZTKYPMNV-SJORKVTESA-N	0	3	345.487	3.317	20	30		EGEDHN
Cc1coc(C(=O)N2CC[C@H]3[C@@H](CCN3CC#Cc3ccccc3)C2)c1	ZINC001036796747	1343730678	/nfs/dbraw/zinc/73/06/78/1343730678.db2.gz	IHMUQXQMEGKMMC-PMACEKPBSA-N	0	3	348.446	3.176	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@H]2CN(C(=O)[C@H]3C[C@H]4C[C@H]4C3)CC[C@@H]21	ZINC001036798407	1343732577	/nfs/dbraw/zinc/73/25/77/1343732577.db2.gz	KPWWSCPKPWFRNN-AFDCHOCNSA-N	0	3	349.478	3.027	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCC[C@H]2CNCc2cc(C)no2)CC1	ZINC001037070742	1343963598	/nfs/dbraw/zinc/96/35/98/1343963598.db2.gz	WDSHVKNDYMCLAT-WMZOPIPTSA-N	0	3	331.460	3.104	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCC[C@@H]2CNCc2nccn2CC)CC1	ZINC001037070504	1343964238	/nfs/dbraw/zinc/96/42/38/1343964238.db2.gz	SEHUFUOTFJJYNJ-QZTJIDSGSA-N	0	3	344.503	3.024	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCC[C@@H]2CNCc2ccccc2C#N)C1	ZINC001037074822	1343968007	/nfs/dbraw/zinc/96/80/07/1343968007.db2.gz	HGDYLJYZTZIJPG-RTBURBONSA-N	0	3	337.467	3.289	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCC[C@@H]1NC(=O)c1ccncc1	ZINC001037162791	1344011177	/nfs/dbraw/zinc/01/11/77/1344011177.db2.gz	OHNAVAZJMLCSEC-UXHICEINSA-N	0	3	348.450	3.032	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](NCc2cc(C)n(C)n2)[C@H](CC)C1	ZINC001037902775	1344168224	/nfs/dbraw/zinc/16/82/24/1344168224.db2.gz	GXTQSQUPZVSTQE-SJLPKXTDSA-N	0	3	346.519	3.048	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)[C@@H]1CCCO[C@H]1c1ccccc1	ZINC001038353662	1344394708	/nfs/dbraw/zinc/39/47/08/1344394708.db2.gz	HAXOIVFVBBGGTC-ZCNNSNEGSA-N	0	3	342.483	3.311	20	30		EGEDHN
C#CCOc1ccc(C(=O)NC[C@@H]2CCN2CCCC2CCC2)cc1	ZINC001038784194	1344582720	/nfs/dbraw/zinc/58/27/20/1344582720.db2.gz	SRBQFVYVHOZGCE-IBGZPJMESA-N	0	3	340.467	3.083	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@]2(C)C=CCC2)CC[C@H]1c1ccc(F)cc1	ZINC001079157021	1357197752	/nfs/dbraw/zinc/19/77/52/1357197752.db2.gz	UTMFXZRABNETRH-ZVDOUQERSA-N	0	3	340.442	3.089	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2cc(C)cs2)C[C@H]1c1cccc(F)c1	ZINC001079182369	1357202871	/nfs/dbraw/zinc/20/28/71/1357202871.db2.gz	FUHCJAXWCHVKJA-DLBZAZTESA-N	0	3	342.439	3.027	20	30		EGEDHN
CC(=O)N1CCCC[C@@H]1[C@@H]1CCN(CC#Cc2ccc(Cl)cc2)C1	ZINC001039174695	1344866664	/nfs/dbraw/zinc/86/66/64/1344866664.db2.gz	BMYRYTUWNINSOZ-UYAOXDASSA-N	0	3	344.886	3.414	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)CC2CC(F)(F)C2)C1	ZINC001039211978	1344926370	/nfs/dbraw/zinc/92/63/70/1344926370.db2.gz	HRNIJMMXVDNUEG-SJORKVTESA-N	0	3	338.442	3.148	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cscc2Cl)C1	ZINC001039216527	1344933162	/nfs/dbraw/zinc/93/31/62/1344933162.db2.gz	BAFLCUZCDGLZDO-CZUORRHYSA-N	0	3	336.888	3.351	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2scnc2CC)C1	ZINC001039216383	1344933565	/nfs/dbraw/zinc/93/35/65/1344933565.db2.gz	ZWWPVZBIYKRCLN-RDJZCZTQSA-N	0	3	345.512	3.045	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2c[nH]c3ccccc23)C1	ZINC001039217444	1344934435	/nfs/dbraw/zinc/93/44/35/1344934435.db2.gz	HBSQBFYGUQNWOP-JXFKEZNVSA-N	0	3	335.451	3.118	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)Cc2ccc(C)cc2)C1	ZINC001039220405	1344937883	/nfs/dbraw/zinc/93/78/83/1344937883.db2.gz	ZBIKCORBZOWTJY-NHCUHLMSSA-N	0	3	338.495	3.264	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2nccc3ccccc32)C1	ZINC001039224246	1344941731	/nfs/dbraw/zinc/94/17/31/1344941731.db2.gz	DQIZWNQFBJNPBA-UYAOXDASSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc3ncccc3c2)C1	ZINC001039224495	1344942020	/nfs/dbraw/zinc/94/20/20/1344942020.db2.gz	GSEGQPVKWRZBJF-CTNGQTDRSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2oc(CC)cc2C)C1	ZINC001039242292	1344968867	/nfs/dbraw/zinc/96/88/67/1344968867.db2.gz	AOTADEMKXLYTDZ-SJLPKXTDSA-N	0	3	328.456	3.100	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(C)nc2C)C1	ZINC001039242664	1344969135	/nfs/dbraw/zinc/96/91/35/1344969135.db2.gz	QIUJFABVVUFKRI-UYAOXDASSA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(C)c(CC)o2)C1	ZINC001039244190	1344972153	/nfs/dbraw/zinc/97/21/53/1344972153.db2.gz	HPVAAKYBOGXFHB-SJORKVTESA-N	0	3	328.456	3.100	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc(C)c(CC)o2)C1	ZINC001039244186	1344972271	/nfs/dbraw/zinc/97/22/71/1344972271.db2.gz	HPVAAKYBOGXFHB-IAGOWNOFSA-N	0	3	328.456	3.100	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2sccc2CC)C1	ZINC001039244743	1344972679	/nfs/dbraw/zinc/97/26/79/1344972679.db2.gz	YTJCVEQRBREGQM-DLBZAZTESA-N	0	3	330.497	3.260	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2occ3c2CCCC3)C1	ZINC001039247371	1344977226	/nfs/dbraw/zinc/97/72/26/1344977226.db2.gz	VXRJGUKMRMSBIC-APWZRJJASA-N	0	3	340.467	3.108	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc3ccccc3o2)C1	ZINC001039250830	1344982442	/nfs/dbraw/zinc/98/24/42/1344982442.db2.gz	QJBOBARWEWVCSN-QZTJIDSGSA-N	0	3	336.435	3.383	20	30		EGEDHN
Cc1ccc(CN2CC[C@H]3CC[C@@H](C2)N3C(=O)c2ccc(C#N)[nH]2)cc1	ZINC001039362567	1345029054	/nfs/dbraw/zinc/02/90/54/1345029054.db2.gz	CXUABJXXOLKQFM-MOPGFXCFSA-N	0	3	348.450	3.074	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cn(C)c2ccccc12	ZINC001039401118	1345047707	/nfs/dbraw/zinc/04/77/07/1345047707.db2.gz	KBJAZZGHFBXQTG-SJORKVTESA-N	0	3	337.467	3.433	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1cc(C)cc(C)c1	ZINC001039428403	1345063496	/nfs/dbraw/zinc/06/34/96/1345063496.db2.gz	LIXMZJXCGDFWCT-UXHICEINSA-N	0	3	326.484	3.487	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1c[nH]c2ccc(F)cc12	ZINC001039444166	1345070083	/nfs/dbraw/zinc/07/00/83/1345070083.db2.gz	UPUFISLTXZVIIN-SJORKVTESA-N	0	3	341.430	3.101	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)c1ccccc1F	ZINC001039453155	1345075836	/nfs/dbraw/zinc/07/58/36/1345075836.db2.gz	LEAAXJDMOPGMDK-BBWFWOEESA-N	0	3	328.431	3.018	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2nc(C)ccc2c1	ZINC001039456785	1345076802	/nfs/dbraw/zinc/07/68/02/1345076802.db2.gz	NKSQWYVIMFAVOS-UXHICEINSA-N	0	3	347.462	3.245	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)Cc1ccc(F)cc1	ZINC001039477156	1345091819	/nfs/dbraw/zinc/09/18/19/1345091819.db2.gz	KZBMQVYDHHFJQB-AHRSYUTCSA-N	0	3	342.458	3.093	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@]3(CCN(C(=O)CC4CC4)C3)C2)cc1	ZINC001040037840	1345304064	/nfs/dbraw/zinc/30/40/64/1345304064.db2.gz	IWKOGDOAHFRJFZ-OAQYLSRUSA-N	0	3	337.467	3.173	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3sc(C4CC4)nc3C)C2)C1	ZINC001040201654	1345373183	/nfs/dbraw/zinc/37/31/83/1345373183.db2.gz	MKEQCXBIGHYJJK-LJQANCHMSA-N	0	3	345.512	3.443	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@H]3CCCc4ccccc43)C2)C1	ZINC001040264825	1345402479	/nfs/dbraw/zinc/40/24/79/1345402479.db2.gz	SEKWVNNRZMPXEI-RBBKRZOGSA-N	0	3	336.479	3.054	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)CCc3ccc(F)cc3)C2)C1	ZINC001040284934	1345412001	/nfs/dbraw/zinc/41/20/01/1345412001.db2.gz	XOHBHZRSNNLMIG-NRFANRHFSA-N	0	3	342.458	3.096	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3cc4cc(C)ccc4[nH]3)C2)C1	ZINC001040323043	1345431984	/nfs/dbraw/zinc/43/19/84/1345431984.db2.gz	NQXFIDACVMGORE-OAQYLSRUSA-N	0	3	335.451	3.038	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N1CC[C@]2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001040340543	1345442302	/nfs/dbraw/zinc/44/23/02/1345442302.db2.gz	JEYLXJFLNYXBPP-NBHGPNQESA-N	0	3	337.467	3.029	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cccc(Cl)c3F)C2)C1	ZINC001040361214	1345454410	/nfs/dbraw/zinc/45/44/10/1345454410.db2.gz	QSXHECGHENOIQB-LJQANCHMSA-N	0	3	348.849	3.431	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3nccc4ccccc43)C2)C1	ZINC001040361897	1345455330	/nfs/dbraw/zinc/45/53/30/1345455330.db2.gz	XSEWMDIKWVFQAS-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@H](C)c3ccc(Cl)cc3)C2)C1	ZINC001040371991	1345460454	/nfs/dbraw/zinc/46/04/54/1345460454.db2.gz	NOETVHFHLFWQOX-UZLBHIALSA-N	0	3	344.886	3.391	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cc4occc4s3)C2)C1	ZINC001040391908	1345473043	/nfs/dbraw/zinc/47/30/43/1345473043.db2.gz	RMJCYONGKQOKIN-IBGZPJMESA-N	0	3	342.464	3.446	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@@H](C)c3ccsc3)C2)C1	ZINC001040392860	1345473791	/nfs/dbraw/zinc/47/37/91/1345473791.db2.gz	XHHFDCIFROOACP-LPHOPBHVSA-N	0	3	330.497	3.189	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ccsc3Cl)C2)C1	ZINC001040433504	1345496497	/nfs/dbraw/zinc/49/64/97/1345496497.db2.gz	WJRLPYTYLLIUMC-QGZVFWFLSA-N	0	3	336.888	3.353	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)C[C@H](C)c3ccccc3C)C2)C1	ZINC001040433804	1345496945	/nfs/dbraw/zinc/49/69/45/1345496945.db2.gz	ZIMNYQQUJBXTOT-UGKGYDQZSA-N	0	3	338.495	3.436	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ccc4ccn(C)c4c3)C2)C1	ZINC001040478991	1345514068	/nfs/dbraw/zinc/51/40/68/1345514068.db2.gz	NKJKBCCXJFYMFB-QFIPXVFZSA-N	0	3	349.478	3.130	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cnc(C4CC4)s3)C2)C1	ZINC001040500778	1345521814	/nfs/dbraw/zinc/52/18/14/1345521814.db2.gz	QZNFKXOQQQKERV-GOSISDBHSA-N	0	3	331.485	3.135	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@@H](C)n3c(C)ccc3C)C2)C1	ZINC001040543333	1345538560	/nfs/dbraw/zinc/53/85/60/1345538560.db2.gz	OXJICGLPNOFEOW-TZIWHRDSSA-N	0	3	341.499	3.004	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ccc(CF)cc3)C2)C1	ZINC001040546483	1345541038	/nfs/dbraw/zinc/54/10/38/1345541038.db2.gz	DSWNJUGDUHCFKO-FQEVSTJZSA-N	0	3	328.431	3.108	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)C34CC(C(C)(C)C)(C3)C4)C2)C1	ZINC001040551788	1345543670	/nfs/dbraw/zinc/54/36/70/1345543670.db2.gz	RJDOVEPPLOVRCT-MWXLCCTBSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001040612315	1345555643	/nfs/dbraw/zinc/55/56/43/1345555643.db2.gz	ALUPFLVGEAQAFW-QGZVFWFLSA-N	0	3	339.483	3.419	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@@H]3C[C@H]3CC(C)(C)C)C2)CC1	ZINC001040705353	1345568186	/nfs/dbraw/zinc/56/81/86/1345568186.db2.gz	FWEQAAUBTKLQNF-ZWKOTPCHSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)C3(C(F)(F)F)CCC3)C2)CC1	ZINC001040750879	1345574170	/nfs/dbraw/zinc/57/41/70/1345574170.db2.gz	TTYDQMUCUKRZCT-UHFFFAOYSA-N	0	3	342.405	3.057	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)C3(C)CCC(F)(F)CC3)C2)CC1	ZINC001040753173	1345574760	/nfs/dbraw/zinc/57/47/60/1345574760.db2.gz	QLYIQXUDIKFRRC-UHFFFAOYSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cccc(-n4cccc4)c3)C2)CC1	ZINC001040763168	1345576234	/nfs/dbraw/zinc/57/62/34/1345576234.db2.gz	GXFQIVLKHXQMBI-UHFFFAOYSA-N	0	3	347.462	3.039	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC2(C1)CCN(Cc1cccnc1)CC2	ZINC001040797719	1345578997	/nfs/dbraw/zinc/57/89/97/1345578997.db2.gz	FPGBTGRLFISAOR-UHFFFAOYSA-N	0	3	341.499	3.498	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC2(C1)CCN(CCC(F)(F)F)CC2	ZINC001040799757	1345579440	/nfs/dbraw/zinc/57/94/40/1345579440.db2.gz	DVJCWNCZUKIZHH-UHFFFAOYSA-N	0	3	332.410	3.466	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@@H](C)c3cc(C)oc3C)C2)CC1	ZINC001040882482	1345593587	/nfs/dbraw/zinc/59/35/87/1345593587.db2.gz	GJIHIKQEICTBEB-KRWDZBQOSA-N	0	3	342.483	3.338	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccc4sccc4c3)C2)CC1	ZINC001040901299	1345596681	/nfs/dbraw/zinc/59/66/81/1345596681.db2.gz	IXHONJVLFJAYMP-UHFFFAOYSA-N	0	3	338.476	3.463	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cc(C)c(CC)o3)C2)CC1	ZINC001040911930	1345598819	/nfs/dbraw/zinc/59/88/19/1345598819.db2.gz	JKZXYIONGHGMOE-UHFFFAOYSA-N	0	3	328.456	3.102	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@]3(CCN(C(=O)c4ccccc4)C3)C2)c1	ZINC001041028837	1345628570	/nfs/dbraw/zinc/62/85/70/1345628570.db2.gz	WAZYJICHDZJPFB-QFIPXVFZSA-N	0	3	345.446	3.296	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@]3(CCN(C(=O)[C@H]4CC=CCC4)C3)C2)c1	ZINC001041065140	1345641997	/nfs/dbraw/zinc/64/19/97/1345641997.db2.gz	YVRXNYDBFFMQJN-RBBKRZOGSA-N	0	3	349.478	3.339	20	30		EGEDHN
Cc1ccoc1C(=O)N1CC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001041070562	1345643392	/nfs/dbraw/zinc/64/33/92/1345643392.db2.gz	XVBYWKFKHHFRDO-NRFANRHFSA-N	0	3	349.434	3.198	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)[C@@H]3C[C@H]3c3sccc3C)C2)C1	ZINC001041284938	1345694531	/nfs/dbraw/zinc/69/45/31/1345694531.db2.gz	ZQBLNZNAEKTEGE-MBOZVWFJSA-N	0	3	342.508	3.108	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3cc(F)c4ccccc4c3)C2)C1	ZINC001041342295	1345706314	/nfs/dbraw/zinc/70/63/14/1345706314.db2.gz	DIOKZWBIZPBORM-OAQYLSRUSA-N	0	3	336.410	3.150	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3ccc(CC(C)C)s3)C2)C1	ZINC001041364458	1345710947	/nfs/dbraw/zinc/71/09/47/1345710947.db2.gz	LZTXHCJDPJCRFX-LJQANCHMSA-N	0	3	330.497	3.118	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3nc(C(C)(C)C)cs3)C2)C1	ZINC001041377099	1345712117	/nfs/dbraw/zinc/71/21/17/1345712117.db2.gz	BVGQKZSXTVHWGC-IBGZPJMESA-N	0	3	345.512	3.002	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccc(Cl)cc3F)C2)C1	ZINC001041452884	1345732817	/nfs/dbraw/zinc/73/28/17/1345732817.db2.gz	YFOGZYHPPXJCSZ-GOSISDBHSA-N	0	3	334.822	3.040	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccc(C)c(Cl)c3F)C2)C1	ZINC001041503403	1345746092	/nfs/dbraw/zinc/74/60/92/1345746092.db2.gz	PCSXPOCMOZMKQJ-LJQANCHMSA-N	0	3	348.849	3.349	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@]2(CCN(Cc3scnc3C)C2)C1	ZINC001041537477	1345755289	/nfs/dbraw/zinc/75/52/89/1345755289.db2.gz	XQHOTQGBIHTZGM-LJQANCHMSA-N	0	3	347.528	3.478	20	30		EGEDHN
C=CCN1CC[C@@]2(CCN(C(=O)c3nc(Cl)sc3Cl)C2)C1	ZINC001041539467	1345756499	/nfs/dbraw/zinc/75/64/99/1345756499.db2.gz	HDAXODPMBRYBQT-CQSZACIVSA-N	0	3	346.283	3.174	20	30		EGEDHN
C[C@]1(C(=O)N2CC[C@@]3(CCN(Cc4cccc(C#N)c4)C3)C2)C=CCC1	ZINC001041557037	1345767214	/nfs/dbraw/zinc/76/72/14/1345767214.db2.gz	CUDFNGLAUNDKHZ-FCHUYYIVSA-N	0	3	349.478	3.339	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@]3(CCN(Cc4ccc(C#N)cc4)C3)C2)C1	ZINC001041655263	1345812432	/nfs/dbraw/zinc/81/24/32/1345812432.db2.gz	DAXLQEYNWWPNHZ-QFIPXVFZSA-N	0	3	349.478	3.339	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@]3(CCN(Cc4ccc(C#N)cc4)C3)C2)C1	ZINC001041655262	1345812630	/nfs/dbraw/zinc/81/26/30/1345812630.db2.gz	DAXLQEYNWWPNHZ-JOCHJYFZSA-N	0	3	349.478	3.339	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cccc(C)c3Cl)C2)C1	ZINC001041745025	1345838839	/nfs/dbraw/zinc/83/88/39/1345838839.db2.gz	PBEQTVLAEKPELQ-IBGZPJMESA-N	0	3	330.859	3.210	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccc4nc(C)ccc4c3)C2)C1	ZINC001041751634	1345839836	/nfs/dbraw/zinc/83/98/36/1345839836.db2.gz	KOYUMUKURYUJJW-QFIPXVFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cc4c(s3)CCCC4)C2)C1	ZINC001041815503	1345861273	/nfs/dbraw/zinc/86/12/73/1345861273.db2.gz	DFWMOFBAVVPVGR-FQEVSTJZSA-N	0	3	342.508	3.188	20	30		EGEDHN
C=CCN1CC[C@@]2(CCN(C(=O)c3cc(C4CCCC4)no3)C2)C1	ZINC001041837730	1345868082	/nfs/dbraw/zinc/86/80/82/1345868082.db2.gz	MJXCVYCZACDSGI-LJQANCHMSA-N	0	3	329.444	3.056	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)[C@@H](C)c3ccc(F)c(F)c3)C2)C1	ZINC001041838821	1345868290	/nfs/dbraw/zinc/86/82/90/1345868290.db2.gz	CFMSEEFHNQNJMO-YWZLYKJASA-N	0	3	346.421	3.016	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cc4ccccc4n3CC)C2)C1	ZINC001041842537	1345869750	/nfs/dbraw/zinc/86/97/50/1345869750.db2.gz	IBIWQSVNBAEYFK-QFIPXVFZSA-N	0	3	349.478	3.223	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cscc3C(F)F)C[C@H]21	ZINC001042065632	1345934658	/nfs/dbraw/zinc/93/46/58/1345934658.db2.gz	XHVACJPDFOUQBM-SMDDNHRTSA-N	0	3	326.412	3.408	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cccc(OCCC)c3)C[C@H]21	ZINC001042079510	1345939529	/nfs/dbraw/zinc/93/95/29/1345939529.db2.gz	DSBXWZMAWGHXPQ-QFBILLFUSA-N	0	3	328.456	3.198	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccnc(-c4ccco4)c3)C[C@H]21	ZINC001042108874	1345946136	/nfs/dbraw/zinc/94/61/36/1345946136.db2.gz	GEYZUNTWKDUEMF-MAUKXSAKSA-N	0	3	337.423	3.064	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3cc4ccccc4s3)C[C@@H]21	ZINC001042142889	1345955455	/nfs/dbraw/zinc/95/54/55/1345955455.db2.gz	PFIORFWOYNGLKI-WBVHZDCISA-N	0	3	338.476	3.461	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)Cc3ccc(C(F)F)cc3)C[C@@H]21	ZINC001042148353	1345957061	/nfs/dbraw/zinc/95/70/61/1345957061.db2.gz	IZYVGUNSULNWMO-WMZOPIPTSA-N	0	3	346.421	3.113	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cc4c(cc(C)cc4C)[nH]3)C[C@H]21	ZINC001042168260	1345963626	/nfs/dbraw/zinc/96/36/26/1345963626.db2.gz	UKHRSSKCTZMKTF-LAUBAEHRSA-N	0	3	349.478	3.344	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc4cc(F)ccc4[nH]3)C[C@H]21	ZINC001042175941	1345967333	/nfs/dbraw/zinc/96/73/33/1345967333.db2.gz	GXIXGVRZSSYOBX-SCLBCKFNSA-N	0	3	327.403	3.029	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3cnccc3C)[C@@H]2C1	ZINC001042182172	1345970484	/nfs/dbraw/zinc/97/04/84/1345970484.db2.gz	CJEAFHHGXVIGSE-PKOBYXMFSA-N	0	3	341.499	3.415	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2CCN(Cc3cccnc3C)[C@H]2C1	ZINC001042183845	1345971402	/nfs/dbraw/zinc/97/14/02/1345971402.db2.gz	NXGKJKWVPDZZSS-MJGOQNOKSA-N	0	3	341.499	3.415	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3CCN(C(=O)[C@H]4C[C@H]5C[C@H]5C4)C[C@@H]32)cc1	ZINC001042197049	1345979564	/nfs/dbraw/zinc/97/95/64/1345979564.db2.gz	WSYMWPLMGLNIJP-AFDCHOCNSA-N	0	3	349.478	3.027	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C3(c4cccnc4)CCCC3)C[C@H]21	ZINC001042205242	1345983555	/nfs/dbraw/zinc/98/35/55/1345983555.db2.gz	WNMVBADDTSHUFJ-PKOBYXMFSA-N	0	3	339.483	3.002	20	30		EGEDHN
CC1(C(=O)N2CC[C@H]3CCN(Cc4cccc(C#N)c4)[C@@H]3C2)CC=CC1	ZINC001042222734	1345993961	/nfs/dbraw/zinc/99/39/61/1345993961.db2.gz	XUBGQVJWXLHMOA-WOJBJXKFSA-N	0	3	349.478	3.337	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(C(C)C)nc3CC)C[C@@H]21	ZINC001042237969	1345999895	/nfs/dbraw/zinc/99/98/95/1345999895.db2.gz	NZSRTFSVUJTETH-UZLBHIALSA-N	0	3	341.499	3.490	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3csc(C(C)(C)C)n3)C[C@H]21	ZINC001042267333	1346012400	/nfs/dbraw/zinc/01/24/00/1346012400.db2.gz	SZMLBGOUIYUZKE-DZGCQCFKSA-N	0	3	333.501	3.163	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(C(F)F)cc3F)C[C@H]21	ZINC001042285247	1346017385	/nfs/dbraw/zinc/01/73/85/1346017385.db2.gz	MOPHWGKKCFTDMP-BLLLJJGKSA-N	0	3	338.373	3.486	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc4scnc4c3)C[C@@H]21	ZINC001042296740	1346021685	/nfs/dbraw/zinc/02/16/85/1346021685.db2.gz	FJKBWOZYZQDPPG-BBRMVZONSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cccc(-c4cnco4)c3)C[C@H]21	ZINC001042297454	1346022362	/nfs/dbraw/zinc/02/23/62/1346022362.db2.gz	PDIRSSDCVFFWCR-MAUKXSAKSA-N	0	3	337.423	3.064	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cnn(C(CC)CC)c3C)C[C@H]21	ZINC001042305004	1346025775	/nfs/dbraw/zinc/02/57/75/1346025775.db2.gz	VRPGRKXSHFMMIH-QFBILLFUSA-N	0	3	344.503	3.275	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3cc4c(s3)CCC4)C[C@H]21	ZINC001042337943	1346042797	/nfs/dbraw/zinc/04/27/97/1346042797.db2.gz	ICGQJUWALNIQDL-GDBMZVCRSA-N	0	3	330.497	3.349	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3cc4c(s3)CCC4)C[C@@H]21	ZINC001042337945	1346042974	/nfs/dbraw/zinc/04/29/74/1346042974.db2.gz	ICGQJUWALNIQDL-HOCLYGCPSA-N	0	3	330.497	3.349	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cccc4ccccc43)C[C@H]21	ZINC001042339801	1346044996	/nfs/dbraw/zinc/04/49/96/1346044996.db2.gz	BMKOEBGYVBOCOH-GHTZIAJQSA-N	0	3	332.447	3.400	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3cc(CC)c(C)s3)C[C@@H]21	ZINC001042346162	1346048278	/nfs/dbraw/zinc/04/82/78/1346048278.db2.gz	PBVQCIQBAYQGSF-IRXDYDNUSA-N	0	3	330.497	3.179	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3sccc3C(C)C)C[C@H]21	ZINC001042368262	1346059683	/nfs/dbraw/zinc/05/96/83/1346059683.db2.gz	OYNFTUDYWIYMSR-DOTOQJQBSA-N	0	3	330.497	3.431	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@H](NCc2cc(F)ccc2C#N)C[C@H]1C	ZINC001044423471	1346325111	/nfs/dbraw/zinc/32/51/11/1346325111.db2.gz	WNYINTDXSJPGHR-KDOFPFPSSA-N	0	3	331.435	3.213	20	30		EGEDHN
C[C@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)CC(C)(C)C	ZINC001044469606	1346341917	/nfs/dbraw/zinc/34/19/17/1346341917.db2.gz	YDKRQYOBCLRJDO-MAUKXSAKSA-N	0	3	327.472	3.464	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3cc(C)no3)C[C@H]2C)CC1	ZINC001044730906	1346414965	/nfs/dbraw/zinc/41/49/65/1346414965.db2.gz	SBMHAJZZTHCSHB-WBVHZDCISA-N	0	3	331.460	3.199	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)CC2CCCC2)c(F)c1	ZINC001044905712	1346459834	/nfs/dbraw/zinc/45/98/34/1346459834.db2.gz	WXPKELSAQZTAMM-SFHVURJKSA-N	0	3	343.446	3.358	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCC[C@H]1CNCc1ccc(C#N)cc1F	ZINC001045224509	1346534611	/nfs/dbraw/zinc/53/46/11/1346534611.db2.gz	LNVFGHQZQPUARR-YOEHRIQHSA-N	0	3	331.435	3.070	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)[C@@H]2CC23CCCC3)s1	ZINC001045264394	1346543480	/nfs/dbraw/zinc/54/34/80/1346543480.db2.gz	PTVHRJNLGKBCII-YOEHRIQHSA-N	0	3	343.496	3.281	20	30		EGEDHN
C=C[C@H](C(=O)N1CCC[C@H]1CNCc1cncc(C)c1)c1ccccc1	ZINC001045320764	1346559267	/nfs/dbraw/zinc/55/92/67/1346559267.db2.gz	YRUZMZXHGGCXQI-SFTDATJTSA-N	0	3	349.478	3.440	20	30		EGEDHN
C=C[C@@H](C(=O)N1CCC[C@H]1CNCc1cncc(C)c1)c1ccccc1	ZINC001045320761	1346559390	/nfs/dbraw/zinc/55/93/90/1346559390.db2.gz	YRUZMZXHGGCXQI-LEWJYISDSA-N	0	3	349.478	3.440	20	30		EGEDHN
CC1(NC(=O)c2ccsc2)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045358311	1346572274	/nfs/dbraw/zinc/57/22/74/1346572274.db2.gz	NZYZYOQRSZZEHE-UHFFFAOYSA-N	0	3	339.464	3.404	20	30		EGEDHN
CC1(NC(=O)C2C=CC=CC=C2)CCN(Cc2cccc(C#N)c2)CC1	ZINC001045450565	1346596789	/nfs/dbraw/zinc/59/67/89/1346596789.db2.gz	DOGPEGPJHPAMSZ-UHFFFAOYSA-N	0	3	347.462	3.327	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2cc(C)nn2C(CC)CC)CC1	ZINC001045490528	1346607732	/nfs/dbraw/zinc/60/77/32/1346607732.db2.gz	QWNSGGRLFGVXQR-UHFFFAOYSA-N	0	3	344.503	3.160	20	30		EGEDHN
C[C@@H]1CC[C@@H](C(=O)NC2(C)CCN(Cc3cccc(C#N)c3)CC2)C1	ZINC001045577251	1346634665	/nfs/dbraw/zinc/63/46/65/1346634665.db2.gz	LSBPFVFLNSTOGN-VQIMIIECSA-N	0	3	339.483	3.465	20	30		EGEDHN
Cc1c[nH]cc1C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1ccc(C#N)cc1	ZINC001045889754	1346734897	/nfs/dbraw/zinc/73/48/97/1346734897.db2.gz	SPPWSQGBCIXNDM-MOPGFXCFSA-N	0	3	348.450	3.074	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1sccc1F)C2	ZINC001045936017	1346772861	/nfs/dbraw/zinc/77/28/61/1346772861.db2.gz	YUITWJMVRVECRM-SFHVURJKSA-N	0	3	334.460	3.229	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc3occc3c1)C2	ZINC001045940432	1346776476	/nfs/dbraw/zinc/77/64/76/1346776476.db2.gz	YOEDAIBTSYYZHS-OAQYLSRUSA-N	0	3	336.435	3.384	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1sc(C)cc1C)C2	ZINC001045940621	1346776694	/nfs/dbraw/zinc/77/66/94/1346776694.db2.gz	BWTMMPAXZZOXQY-IBGZPJMESA-N	0	3	330.497	3.316	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@H]1CCC(F)(F)C1)C2	ZINC001045944253	1346780284	/nfs/dbraw/zinc/78/02/84/1346780284.db2.gz	IVBYIJZTVBKSAR-FUHWJXTLSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H]1C[C@H]1c1ccsc1)C2	ZINC001045946799	1346782057	/nfs/dbraw/zinc/78/20/57/1346782057.db2.gz	AAUCSLUANLVRGU-NSHGMRRFSA-N	0	3	342.508	3.189	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc(C)n(CC)c1C)C2	ZINC001045950673	1346785225	/nfs/dbraw/zinc/78/52/25/1346785225.db2.gz	IURDEXWVVJOJSN-NRFANRHFSA-N	0	3	341.499	3.076	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cn(C)c3ccccc13)C2	ZINC001045950684	1346785254	/nfs/dbraw/zinc/78/52/54/1346785254.db2.gz	JCDYNKWLPRQNNE-QFIPXVFZSA-N	0	3	349.478	3.130	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc(C)c(F)c1)C2	ZINC001045950579	1346785333	/nfs/dbraw/zinc/78/53/33/1346785333.db2.gz	GIVLXAYMNZNKAV-FQEVSTJZSA-N	0	3	328.431	3.086	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1c[nH]c3ccccc13)C2	ZINC001045950864	1346785693	/nfs/dbraw/zinc/78/56/93/1346785693.db2.gz	NIEKUPQTFLKWIM-OAQYLSRUSA-N	0	3	335.451	3.119	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)C[C@H]1CC=CCC1)C2	ZINC001045956946	1346791773	/nfs/dbraw/zinc/79/17/73/1346791773.db2.gz	PUJALFNLXHDSIK-FPOVZHCZSA-N	0	3	328.500	3.461	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc[nH]c1C(C)C)C2	ZINC001045961834	1346796891	/nfs/dbraw/zinc/79/68/91/1346796891.db2.gz	UBBURJDZQKWVFV-OAQYLSRUSA-N	0	3	341.499	3.480	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)C(C)(C)C(F)F)C2	ZINC001045963676	1346799188	/nfs/dbraw/zinc/79/91/88/1346799188.db2.gz	MUQUASJJIHOHHA-GOSISDBHSA-N	0	3	326.431	3.006	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H]1C[C@H]1c1ccco1)C2	ZINC001045970386	1346805925	/nfs/dbraw/zinc/80/59/25/1346805925.db2.gz	GPNUKRWQVYUXQX-OPYAIIAOSA-N	0	3	340.467	3.111	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@H](CC)OC1CCCC1)C2	ZINC001045971064	1346807096	/nfs/dbraw/zinc/80/70/96/1346807096.db2.gz	MHHCBVJSXQHZRM-FPOVZHCZSA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H](C)c1ccc(C)s1)C2	ZINC001045978963	1346815887	/nfs/dbraw/zinc/81/58/87/1346815887.db2.gz	LYCNDKXTEYAVPJ-PXNSSMCTSA-N	0	3	344.524	3.498	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc(F)cc(F)c1)C2	ZINC001045981392	1346819574	/nfs/dbraw/zinc/81/95/74/1346819574.db2.gz	CJQZVTKEHHLQBM-FQEVSTJZSA-N	0	3	346.421	3.306	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)C1CCC=CCC1)C2	ZINC001045985317	1346826164	/nfs/dbraw/zinc/82/61/64/1346826164.db2.gz	RDRQWJYOIGLKBG-NRFANRHFSA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@H](C=C)c1ccccc1)C2	ZINC001045985494	1346826263	/nfs/dbraw/zinc/82/62/63/1346826263.db2.gz	VOHVUVBTBUHXEG-IRLDBZIGSA-N	0	3	336.479	3.294	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)Cc1ccc(C)s1)C2	ZINC001045986168	1346826653	/nfs/dbraw/zinc/82/66/53/1346826653.db2.gz	JCJDUIIQRZTUQX-HXUWFJFHSA-N	0	3	344.524	3.327	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N[C@@]1(C)CCN(Cc2ccc(C)cc2)C1	ZINC001046318839	1346933773	/nfs/dbraw/zinc/93/37/73/1346933773.db2.gz	GXMWCNYHMRIMBW-DYXWJJEUSA-N	0	3	342.483	3.057	20	30		EGEDHN
C=C(C)CCN1CC[C@](C)(NC(=O)c2sc(Cl)nc2C)C1	ZINC001046343857	1346942635	/nfs/dbraw/zinc/94/26/35/1346942635.db2.gz	FTTSBNBMMGHMLA-HNNXBMFYSA-N	0	3	327.881	3.265	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@H](CNC(=O)[C@@H]2CCCC3(CC3)C2)C1	ZINC001046939165	1347157851	/nfs/dbraw/zinc/15/78/51/1347157851.db2.gz	KJKCRAZTGKFYJM-HZPDHXFCSA-N	0	3	338.442	3.054	20	30		EGEDHN
O=C(CC1CCC1)N[C@@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1ccccc1)C2	ZINC001047043779	1347194686	/nfs/dbraw/zinc/19/46/86/1347194686.db2.gz	CRPAPAPPEOEKIQ-HBMCJLEFSA-N	0	3	336.479	3.197	20	30		EGEDHN
Cc1cocc1C(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1ccccc1)C2	ZINC001047127881	1347214305	/nfs/dbraw/zinc/21/43/05/1347214305.db2.gz	VDODXAYGLFEKRY-UFYCRDLUSA-N	0	3	348.446	3.222	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@H]3C[C@@H](C2)N(Cc2ocnc2C)C3)CC1	ZINC001047139307	1347217926	/nfs/dbraw/zinc/21/79/26/1347217926.db2.gz	PXDKKWBWYDBVAJ-SZMVWBNQSA-N	0	3	343.471	3.199	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)C(F)=C3CCCC3)C2)CC1	ZINC001047235156	1347263138	/nfs/dbraw/zinc/26/31/38/1347263138.db2.gz	VOGKCEICIJHVLJ-SFHVURJKSA-N	0	3	332.463	3.368	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3ccc(F)c(C)c3)C2)CC1	ZINC001047252870	1347277146	/nfs/dbraw/zinc/27/71/46/1347277146.db2.gz	LMMZOBRUWYQVHM-IBGZPJMESA-N	0	3	342.458	3.332	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3c[nH]cc3C3CC3)C2)CC1	ZINC001047261963	1347283481	/nfs/dbraw/zinc/28/34/81/1347283481.db2.gz	KRXAAOPXRPPVCC-GOSISDBHSA-N	0	3	339.483	3.090	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)C3CCC=CCC3)C2)CC1	ZINC001047266076	1347286886	/nfs/dbraw/zinc/28/68/86/1347286886.db2.gz	PPAPLAPPCHKLRI-HXUWFJFHSA-N	0	3	328.500	3.317	20	30		EGEDHN
C=CCCN1C[C@H](O)[C@@H](N(C)C(=O)c2ccccc2C(C)(C)CC)C1	ZINC001047422501	1347301245	/nfs/dbraw/zinc/30/12/45/1347301245.db2.gz	VYMJSLCPAMHWCT-OALUTQOASA-N	0	3	344.499	3.067	20	30		EGEDHN
C=CCCN1C[C@H](O)[C@@H](N(C)C(=O)c2ccc(C3CCCC3)cc2)C1	ZINC001047460479	1347304295	/nfs/dbraw/zinc/30/42/95/1347304295.db2.gz	GTPZALGEIIHHEO-PMACEKPBSA-N	0	3	342.483	3.037	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)c2ccsc2)C1	ZINC001047709476	1347343616	/nfs/dbraw/zinc/34/36/16/1347343616.db2.gz	MPXZSFDXIOEGFP-PBHICJAKSA-N	0	3	339.464	3.260	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H]([C@@H](C)NCc2cc(C)no2)C1	ZINC001047855403	1347390220	/nfs/dbraw/zinc/39/02/20/1347390220.db2.gz	LRAVCCRBLREPTM-TZMCWYRMSA-N	0	3	339.867	3.088	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@H]([C@@H](C)NCc2cnc(C)o2)C1	ZINC001047856061	1347390613	/nfs/dbraw/zinc/39/06/13/1347390613.db2.gz	QNYWNXZNGKCFLK-RISCZKNCSA-N	0	3	339.867	3.088	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]([C@@H](C)NCc2nc(C)cs2)C1	ZINC001047929248	1347413542	/nfs/dbraw/zinc/41/35/42/1347413542.db2.gz	QDHXONKKIXVHGI-HUUCEWRRSA-N	0	3	335.517	3.380	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]([C@@H](C)NCc2csc(CC)n2)C1	ZINC001047932346	1347414748	/nfs/dbraw/zinc/41/47/48/1347414748.db2.gz	PCECDKCBNCJMLU-KGLIPLIRSA-N	0	3	335.517	3.244	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)C(C)(C)C2CC2)C1	ZINC001047942408	1347419244	/nfs/dbraw/zinc/41/92/44/1347419244.db2.gz	XKMYTKQQMGHQPN-QAPCUYQASA-N	0	3	339.483	3.321	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2cccc(C(F)F)c2F)C1	ZINC001079713069	1357354263	/nfs/dbraw/zinc/35/42/63/1357354263.db2.gz	ZQODNLKYZACOAO-BXUZGUMPSA-N	0	3	326.362	3.390	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](CNCc2ncc(C)s2)[C@H](C)C1	ZINC001048337488	1347521829	/nfs/dbraw/zinc/52/18/29/1347521829.db2.gz	DDLOPKYFECDDBJ-UKRRQHHQSA-N	0	3	335.517	3.238	20	30		EGEDHN
CCC(C)(C)C(=O)N1C[C@H](C)[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001048357931	1347529618	/nfs/dbraw/zinc/52/96/18/1347529618.db2.gz	HXWMWGRSHRCSRZ-YOEHRIQHSA-N	0	3	345.462	3.318	20	30		EGEDHN
N#Cc1ccc(CN2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)C2CCC2)C3)s1	ZINC001048495800	1347566356	/nfs/dbraw/zinc/56/63/56/1347566356.db2.gz	WPTXKSPRGBPQNJ-RBVVOMGSSA-N	0	3	343.496	3.279	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccc(C#N)s1	ZINC001048499622	1347569299	/nfs/dbraw/zinc/56/92/99/1347569299.db2.gz	RXBDQMZYHZKHLG-GLRLOKQVSA-N	0	3	343.496	3.135	20	30		EGEDHN
Cc1cccc(C(=O)N2C[C@H]3CN(Cc4cccc(C#N)c4)C[C@H]3C2)c1	ZINC001048663563	1347635986	/nfs/dbraw/zinc/63/59/86/1347635986.db2.gz	YHKKDNOLIBWQET-OYRHEFFESA-N	0	3	345.446	3.071	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccccc3CC(C)(C)C)C[C@@H]2C1	ZINC001048882642	1347675761	/nfs/dbraw/zinc/67/57/61/1347675761.db2.gz	RSZDICNTWDDCFM-KDURUIRLSA-N	0	3	338.495	3.302	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@H]2CCCN3C(=O)C2CCCC2)cc1	ZINC001049280374	1347767824	/nfs/dbraw/zinc/76/78/24/1347767824.db2.gz	ODGVPRHQPDQRNX-UXHICEINSA-N	0	3	337.467	3.314	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC[C@H]2[C@H]1CCN2Cc1cccc(C#N)c1	ZINC001049344077	1347798223	/nfs/dbraw/zinc/79/82/23/1347798223.db2.gz	OGHLDBBNFYYTSK-ZYSHUDEJSA-N	0	3	325.456	3.170	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@H]2CCCN3C(=O)CCC2CC2)c1	ZINC001049385316	1347813159	/nfs/dbraw/zinc/81/31/59/1347813159.db2.gz	BMPBRZBLNKEMRA-UXHICEINSA-N	0	3	337.467	3.314	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@H]2CCCN3C(=O)CC2CCC2)cc1	ZINC001049395417	1347819347	/nfs/dbraw/zinc/81/93/47/1347819347.db2.gz	GEKFVVIHNPRPNL-UXHICEINSA-N	0	3	337.467	3.314	20	30		EGEDHN
Cc1cc[nH]c1C(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1cccc(C#N)c1	ZINC001049459029	1347858932	/nfs/dbraw/zinc/85/89/32/1347858932.db2.gz	SGVMWYMWFWCHHL-OALUTQOASA-N	0	3	348.450	3.074	20	30		EGEDHN
Cc1ccc(F)cc1CN1CC[C@@H]2[C@@H]1CCCN2C(=O)C#CC1CC1	ZINC001049466596	1347862672	/nfs/dbraw/zinc/86/26/72/1347862672.db2.gz	GYYFFKZDHMDXRS-VQTJNVASSA-N	0	3	340.442	3.113	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1c(F)ccc2ccncc21	ZINC001049490134	1347874342	/nfs/dbraw/zinc/87/43/42/1347874342.db2.gz	ICVOHXPGLFXKQK-MSOLQXFVSA-N	0	3	339.414	3.239	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(C2CCCCC2)n[nH]1	ZINC001049522834	1347891035	/nfs/dbraw/zinc/89/10/35/1347891035.db2.gz	JFSVBBMCQUOEIV-RTBURBONSA-N	0	3	342.487	3.322	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1nccc2ccsc21	ZINC001049535822	1347896728	/nfs/dbraw/zinc/89/67/28/1347896728.db2.gz	KDEOTMRNGORJGF-LSDHHAIUSA-N	0	3	327.453	3.161	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)CC1CC(c2ccccc2)C1	ZINC001049558190	1347908981	/nfs/dbraw/zinc/90/89/81/1347908981.db2.gz	NPAKCWXALVTAGF-NLDTVIPQSA-N	0	3	336.479	3.269	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(C)n(C(CC)CC)n1	ZINC001049563141	1347911205	/nfs/dbraw/zinc/91/12/05/1347911205.db2.gz	CIQKDNPDCDDMMT-RTBURBONSA-N	0	3	344.503	3.418	20	30		EGEDHN
C=CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1scnc1C(F)F	ZINC001049590306	1347925279	/nfs/dbraw/zinc/92/52/79/1347925279.db2.gz	ZSWAQEUWIXVTRS-RYUDHWBXSA-N	0	3	341.427	3.336	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H]1C[C@]1(C)c1ccccc1	ZINC001049612639	1347935491	/nfs/dbraw/zinc/93/54/91/1347935491.db2.gz	UXFCTGCCGDPLDL-ITTUMRLJSA-N	0	3	336.479	3.053	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H]1COc2cc(C)c(C)cc21	ZINC001049611256	1347935933	/nfs/dbraw/zinc/93/59/33/1347935933.db2.gz	FXPDWWUVKZEMAD-IPMKNSEASA-N	0	3	340.467	3.031	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(C)nc1C1CC1	ZINC001049627160	1347941372	/nfs/dbraw/zinc/94/13/72/1347941372.db2.gz	PXMVQGWUARNTED-ROUUACIJSA-N	0	3	325.456	3.132	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(Cl)c(Cl)[nH]1	ZINC001049626819	1347941522	/nfs/dbraw/zinc/94/15/22/1347941522.db2.gz	SZXDUECYWCEWPR-OLZOCXBDSA-N	0	3	328.243	3.186	20	30		EGEDHN
CC1(C(=O)N2CCC[C@H]3[C@H]2CCN3Cc2ccc(C#N)cc2)CCC1	ZINC001049644290	1347951353	/nfs/dbraw/zinc/95/13/53/1347951353.db2.gz	ICSOMEKZLFLDDZ-RBUKOAKNSA-N	0	3	337.467	3.314	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@@H]2CCCN3C(=O)[C@H]2C[C@H]3C[C@H]3C2)c1	ZINC001049661588	1347961211	/nfs/dbraw/zinc/96/12/11/1347961211.db2.gz	WMBKTVRSWCYIJA-ZPAWYTMASA-N	0	3	349.478	3.170	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc2c(c1)[C@@H](C)CO2	ZINC001049665190	1347963899	/nfs/dbraw/zinc/96/38/99/1347963899.db2.gz	UJMWOFHKKPAKMN-JCGIZDLHSA-N	0	3	326.440	3.047	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]3[C@@H]2CCN3Cc2cccnc2C)C1	ZINC001049707638	1347984419	/nfs/dbraw/zinc/98/44/19/1347984419.db2.gz	DSHIAWVPBHFSDH-MOPGFXCFSA-N	0	3	339.483	3.312	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)C2CC3(CC3)C2)c1	ZINC001049711825	1347986567	/nfs/dbraw/zinc/98/65/67/1347986567.db2.gz	VSKFYGORRAACDY-VQTJNVASSA-N	0	3	349.478	3.314	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccc(C)s1	ZINC001049783301	1348019753	/nfs/dbraw/zinc/01/97/53/1348019753.db2.gz	SXOKIKQORCIYTM-BRSBDYLESA-N	0	3	342.508	3.249	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)[C@@H]1CCO[C@H]1c1ccccc1	ZINC001049785266	1348021455	/nfs/dbraw/zinc/02/14/55/1348021455.db2.gz	YINQTPDIUPLVRI-FYQPLNBISA-N	0	3	340.467	3.016	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1csc(-c2ccoc2)n1	ZINC001049792706	1348024410	/nfs/dbraw/zinc/02/44/10/1348024410.db2.gz	JNDABXIVFMOTHZ-JKSUJKDBSA-N	0	3	343.452	3.268	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1coc2ccccc12	ZINC001049810423	1348030438	/nfs/dbraw/zinc/03/04/38/1348030438.db2.gz	LMPAIDVCUZUGQU-OALUTQOASA-N	0	3	336.435	3.064	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccnc(O[C@H](C)CC)c1	ZINC001049843212	1348053776	/nfs/dbraw/zinc/05/37/76/1348053776.db2.gz	OEEKGHTWQHUTBV-KBAYOESNSA-N	0	3	343.471	3.124	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1cccc2ccccc21	ZINC001049853082	1348059781	/nfs/dbraw/zinc/05/97/81/1348059781.db2.gz	CABLJABSYNKGOV-YADHBBJMSA-N	0	3	346.474	3.471	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1c(F)cccc1Cl	ZINC001049864988	1348071381	/nfs/dbraw/zinc/07/13/81/1348071381.db2.gz	SQJIRPVJUZYRMP-IAGOWNOFSA-N	0	3	336.838	3.273	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc2c(s1)CCC2	ZINC001049874700	1348079594	/nfs/dbraw/zinc/07/95/94/1348079594.db2.gz	BBZJIYNIJDWTGM-HOTGVXAUSA-N	0	3	330.497	3.492	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc2c(s1)CCCC2	ZINC001049875975	1348080817	/nfs/dbraw/zinc/08/08/17/1348080817.db2.gz	GWUFDSWBLKPWJS-IAGOWNOFSA-N	0	3	342.508	3.329	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(Cl)ccc1OC	ZINC001049878393	1348083658	/nfs/dbraw/zinc/08/36/58/1348083658.db2.gz	TUTFQNCGKJDDQV-HZPDHXFCSA-N	0	3	334.847	3.214	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(COC(C)C)cc1	ZINC001049888819	1348093482	/nfs/dbraw/zinc/09/34/82/1348093482.db2.gz	LCPRRICGCRRKJF-PMACEKPBSA-N	0	3	342.483	3.477	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](C)c1ccc(F)c(F)c1	ZINC001049904817	1348103002	/nfs/dbraw/zinc/10/30/02/1348103002.db2.gz	RWJOYYGNKWDWLY-ZOCIIQOWSA-N	0	3	346.421	3.157	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(F)c2occc21	ZINC001049907892	1348106007	/nfs/dbraw/zinc/10/60/07/1348106007.db2.gz	LBWMHUIHRNIZAU-IAGOWNOFSA-N	0	3	328.387	3.437	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)CC[C@H]1CCc2ccccc21	ZINC001049910855	1348106979	/nfs/dbraw/zinc/10/69/79/1348106979.db2.gz	WJTBKTPZHWWCJN-HMXCVIKNSA-N	0	3	336.479	3.195	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1c(Cl)cccc1OC	ZINC001049914841	1348109642	/nfs/dbraw/zinc/10/96/42/1348109642.db2.gz	RHLNPFZDJFXCRI-CABCVRRESA-N	0	3	334.847	3.214	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)CC(C)(C)c1ccccc1	ZINC001049915981	1348110415	/nfs/dbraw/zinc/11/04/15/1348110415.db2.gz	DJDXMPRBEZEBBX-VQTJNVASSA-N	0	3	338.495	3.443	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1c[nH]c2c1cccc2CC	ZINC001049921711	1348114149	/nfs/dbraw/zinc/11/41/49/1348114149.db2.gz	XRIYIJQQHOCJHG-WOJBJXKFSA-N	0	3	349.478	3.433	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1c[nH]c2ccc(F)cc12	ZINC001049938199	1348123136	/nfs/dbraw/zinc/12/31/36/1348123136.db2.gz	YJOGKCRZNZHQKU-MSOLQXFVSA-N	0	3	327.403	3.172	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)[C@@H]3C[C@H]3c3sccc3C)[C@@H]2C1	ZINC001050046696	1348164671	/nfs/dbraw/zinc/16/46/71/1348164671.db2.gz	GFILDCJLWMGPKW-YLFCFFPRSA-N	0	3	330.497	3.269	20	30		EGEDHN
C#CCCN1C[C@@H]2CCCN(C(=O)c3cc4cc(F)ccc4o3)[C@@H]2C1	ZINC001050153981	1348198658	/nfs/dbraw/zinc/19/86/58/1348198658.db2.gz	IZMXUJBQODQHOJ-WMLDXEAASA-N	0	3	340.398	3.132	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)[C@@H](CC)Oc3ccccc3F)[C@@H]2C1	ZINC001050180795	1348203193	/nfs/dbraw/zinc/20/31/93/1348203193.db2.gz	NVBYINDFGYZRBK-CGTJXYLNSA-N	0	3	346.446	3.092	20	30		EGEDHN
C#CCCN1C[C@@H]2CCCN(C(=O)c3cc(C)c(CC)s3)[C@@H]2C1	ZINC001050198096	1348208771	/nfs/dbraw/zinc/20/87/71/1348208771.db2.gz	XOPOUWPZVYEWHF-JKSUJKDBSA-N	0	3	330.497	3.179	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3coc4c3cccc4C)C2)CC1	ZINC001050548287	1348287848	/nfs/dbraw/zinc/28/78/48/1348287848.db2.gz	QEZPBNWFQKCMNR-UHFFFAOYSA-N	0	3	336.435	3.303	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC3(C2)CCN(Cc2ncccc2C)CC3)C1	ZINC001050657140	1348319258	/nfs/dbraw/zinc/31/92/58/1348319258.db2.gz	LIPLHQXFWVSBFK-UHFFFAOYSA-N	0	3	339.483	3.171	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C(C)(C)Cc3ccccc3)C2)CC1	ZINC001050721587	1348337256	/nfs/dbraw/zinc/33/72/56/1348337256.db2.gz	FSNZJOQDWCOKOB-UHFFFAOYSA-N	0	3	338.495	3.203	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)CC3C4CC5CC(C4)CC3C5)C2)CC1	ZINC001050760511	1348350362	/nfs/dbraw/zinc/35/03/62/1348350362.db2.gz	MXBLCIZMAVMNOV-UHFFFAOYSA-N	0	3	340.511	3.006	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc(-c4ccccc4)[nH]3)C2)CC1	ZINC001050769912	1348354312	/nfs/dbraw/zinc/35/43/12/1348354312.db2.gz	ISUYFXNCMNFGFU-UHFFFAOYSA-N	0	3	347.462	3.243	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc(CC)c(CC)c3)C2)CC1	ZINC001050777896	1348355743	/nfs/dbraw/zinc/35/57/43/1348355743.db2.gz	IDSDRWQYWCNMCA-UHFFFAOYSA-N	0	3	338.495	3.373	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)[C@H]3[C@@H]4CCCC[C@@H]43)cccc2C1	ZINC001051283031	1348416994	/nfs/dbraw/zinc/41/69/94/1348416994.db2.gz	BEVAIXKOQVFBDM-AERCQKQUSA-N	0	3	336.479	3.120	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)[C@H]3CC[C@H](OC)C3)cccc2C1	ZINC001051291794	1348421279	/nfs/dbraw/zinc/42/12/79/1348421279.db2.gz	ATPLPKARZLKJPJ-LPHOPBHVSA-N	0	3	342.483	3.052	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)[C@@H]3CCC3(F)F)cccc2C1	ZINC001051292519	1348421703	/nfs/dbraw/zinc/42/17/03/1348421703.db2.gz	AUBAJLUEBJUXEB-KRWDZBQOSA-N	0	3	334.410	3.282	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3occc3Cl)cccc2C1	ZINC001051299796	1348425015	/nfs/dbraw/zinc/42/50/15/1348425015.db2.gz	OZTVFAKCKLZIBH-UHFFFAOYSA-N	0	3	342.826	3.244	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)[C@H]3C[C@@]3(C)C(C)C)cccc2C1	ZINC001051306259	1348427781	/nfs/dbraw/zinc/42/77/81/1348427781.db2.gz	QFLAGKYURGQVKL-IRLDBZIGSA-N	0	3	338.495	3.366	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)Cc2ccc(CC(C)C)cc2)CC1	ZINC001052539036	1348571177	/nfs/dbraw/zinc/57/11/77/1348571177.db2.gz	CRMDGSVYJHTJOD-OAQYLSRUSA-N	0	3	340.511	3.422	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)C2(c3cccc(F)c3)CCC2)CC1	ZINC001052610234	1348596030	/nfs/dbraw/zinc/59/60/30/1348596030.db2.gz	BVDLTYXZZFCOQT-IBGZPJMESA-N	0	3	342.458	3.241	20	30		EGEDHN
C[C@@]1(C(=O)N[C@@H]2CCCN(Cc3ccc(C#N)cc3)CC2)C=CCC1	ZINC001052629634	1348602058	/nfs/dbraw/zinc/60/20/58/1348602058.db2.gz	ORWMOICCSGOTQW-TZIWHRDSSA-N	0	3	337.467	3.385	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccccc2-n2cccc2)CC1	ZINC001052677681	1348626312	/nfs/dbraw/zinc/62/63/12/1348626312.db2.gz	RBPUNSLTKHSSNB-GOSISDBHSA-N	0	3	335.451	3.085	20	30		EGEDHN
CC1(C(=O)N[C@H]2CCCN(Cc3ccc(C#N)cc3)CC2)CC=CC1	ZINC001052682141	1348628791	/nfs/dbraw/zinc/62/87/91/1348628791.db2.gz	PRRWSDIXTVJORN-IBGZPJMESA-N	0	3	337.467	3.385	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCN(Cc3cncc(C)c3)CC2)C1	ZINC001052690532	1348634529	/nfs/dbraw/zinc/63/45/29/1348634529.db2.gz	NJKIBMPBCUSYFH-GOSISDBHSA-N	0	3	327.472	3.217	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@H](NC(=O)C3CC4(CC4)C3)CC2)c1	ZINC001052698080	1348639286	/nfs/dbraw/zinc/63/92/86/1348639286.db2.gz	DWLMXFHDAAINDW-LJQANCHMSA-N	0	3	337.467	3.219	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cc(C)oc2C(F)(F)F)CC1	ZINC001052754892	1348664954	/nfs/dbraw/zinc/66/49/54/1348664954.db2.gz	RJTKRQOFFIHHAC-ZDUSSCGKSA-N	0	3	342.361	3.214	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@@H]2CCCN(C[C@@H](F)CC)CC2)cc1	ZINC001052771754	1348672578	/nfs/dbraw/zinc/67/25/78/1348672578.db2.gz	OHBTXBDRURLTTA-ZWKOTPCHSA-N	0	3	346.446	3.031	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@]2(C)CCCc3ccccc32)CC1	ZINC001052795811	1348683359	/nfs/dbraw/zinc/68/33/59/1348683359.db2.gz	NLEHDSHUGXEDHQ-SIKLNZKXSA-N	0	3	338.495	3.275	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2sc(CC3CC3)nc2C)CC1	ZINC001052823356	1348690779	/nfs/dbraw/zinc/69/07/79/1348690779.db2.gz	FPXIXYYWVOUERK-INIZCTEOSA-N	0	3	345.512	3.012	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@@H](C)c2ccc(Cl)s2)CC1	ZINC001052850162	1348701675	/nfs/dbraw/zinc/70/16/75/1348701675.db2.gz	NJTNERFEHNSYQY-UONOGXRCSA-N	0	3	338.904	3.499	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)C2(c3ccccc3C)CCC2)CC1	ZINC001052893538	1348730975	/nfs/dbraw/zinc/73/09/75/1348730975.db2.gz	BNEGECUAZSJQEG-LJQANCHMSA-N	0	3	338.495	3.411	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)Cc2ccc3c(c2)CCCC3)CC1	ZINC001052925273	1348751488	/nfs/dbraw/zinc/75/14/88/1348751488.db2.gz	OFERYDHZBCACJI-OAQYLSRUSA-N	0	3	338.495	3.102	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccccc2OCC2CC2)CC1	ZINC001052956009	1348769413	/nfs/dbraw/zinc/76/94/13/1348769413.db2.gz	NHYCEDOAJLKQKD-SFHVURJKSA-N	0	3	340.467	3.083	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc(C(C)(F)F)cc2)CC1	ZINC001052983337	1348787835	/nfs/dbraw/zinc/78/78/35/1348787835.db2.gz	JJJHZCPPRYYBTO-QGZVFWFLSA-N	0	3	334.410	3.406	20	30		EGEDHN
C=CC[N@H+]1CCC[C@@H]([C@@H]2CCCN(C(=O)c3ccccc3[O-])C2)C1	ZINC001053008636	1348807744	/nfs/dbraw/zinc/80/77/44/1348807744.db2.gz	SMXLENYYHZWVKJ-IAGOWNOFSA-N	0	3	328.456	3.142	20	30		EGEDHN
C=CC[N@@H+]1CCC[C@@H]([C@@H]2CCCN(C(=O)c3ccccc3[O-])C2)C1	ZINC001053008636	1348807746	/nfs/dbraw/zinc/80/77/46/1348807746.db2.gz	SMXLENYYHZWVKJ-IAGOWNOFSA-N	0	3	328.456	3.142	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)/C=C/c2ccco2)C1	ZINC001053061066	1348870192	/nfs/dbraw/zinc/87/01/92/1348870192.db2.gz	MJMJXBLZSHUFNR-FKRMPVFOSA-N	0	3	340.467	3.409	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(C)s2)C1	ZINC001053061845	1348871617	/nfs/dbraw/zinc/87/16/17/1348871617.db2.gz	VFFMUNOWOFMTFB-IAGOWNOFSA-N	0	3	330.497	3.396	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ncccc2C)C1	ZINC001053076367	1348894508	/nfs/dbraw/zinc/89/45/08/1348894508.db2.gz	NLYICEIAYMQFIU-RTBURBONSA-N	0	3	339.483	3.120	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccoc2Cl)C1	ZINC001053082107	1348903084	/nfs/dbraw/zinc/90/30/84/1348903084.db2.gz	ZBLFRROOXBYLHQ-GOEBONIOSA-N	0	3	334.847	3.273	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)Cc2ccc(C)cc2)C1	ZINC001053091125	1348917288	/nfs/dbraw/zinc/91/72/88/1348917288.db2.gz	LCDYWRCAMPZLJC-SFTDATJTSA-N	0	3	338.495	3.264	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cccc(F)c2F)C1	ZINC001053093897	1348922375	/nfs/dbraw/zinc/92/23/75/1348922375.db2.gz	ATJWWHZXMWKDCR-YJBOKZPZSA-N	0	3	346.421	3.305	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)C2CCC=CCC2)C1	ZINC001053106222	1348944707	/nfs/dbraw/zinc/94/47/07/1348944707.db2.gz	SRMBERJCLHGSPB-PMACEKPBSA-N	0	3	328.500	3.459	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccc(CF)cc2)C1	ZINC001053107145	1348946367	/nfs/dbraw/zinc/94/63/67/1348946367.db2.gz	ADKHEAVBJNSQSG-VQTJNVASSA-N	0	3	342.458	3.496	20	30		EGEDHN
C=C(C)CCN1Cc2ccccc2C[C@@H]1CNC(=O)[C@@H]1CCCCO1	ZINC001054037330	1349133784	/nfs/dbraw/zinc/13/37/84/1349133784.db2.gz	BWQVOCJFQKWZNL-UXHICEINSA-N	0	3	342.483	3.065	20	30		EGEDHN
C=C(C)CCN1Cc2ccccc2C[C@@H]1CNC(=O)[C@H]1CCCCO1	ZINC001054037332	1349134003	/nfs/dbraw/zinc/13/40/03/1349134003.db2.gz	BWQVOCJFQKWZNL-WOJBJXKFSA-N	0	3	342.483	3.065	20	30		EGEDHN
C=C(C)CCN1Cc2ccccc2C[C@H]1CNC(=O)[C@@H]1CC1(F)F	ZINC001054039751	1349135221	/nfs/dbraw/zinc/13/52/21/1349135221.db2.gz	IJDGLWDPGPTBOS-IRXDYDNUSA-N	0	3	334.410	3.151	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@]3(C2)CCCN(C(=O)c2ccco2)C3)c1	ZINC001054074101	1349146144	/nfs/dbraw/zinc/14/61/44/1349146144.db2.gz	FADUHZIVCREKEP-OAQYLSRUSA-N	0	3	349.434	3.280	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc3cc(C)ccc3n1)C2	ZINC001054162618	1349165173	/nfs/dbraw/zinc/16/51/73/1349165173.db2.gz	MSINJDMHMJUSSQ-JOCHJYFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H](C)c1c(F)cccc1F)C2	ZINC001054164348	1349167233	/nfs/dbraw/zinc/16/72/33/1349167233.db2.gz	HLJKGGJNSVHMQN-YWZLYKJASA-N	0	3	346.421	3.016	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC[C@@]3(CCN(C[C@H](F)CC)C3)C2)cc1	ZINC001054174368	1349175349	/nfs/dbraw/zinc/17/53/49/1349175349.db2.gz	NRUYTEUJSDQQCB-CTNGQTDRSA-N	0	3	342.458	3.344	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC[C@]3(CCN(C/C=C\Cl)C3)C2)cc1	ZINC001054174025	1349175495	/nfs/dbraw/zinc/17/54/95/1349175495.db2.gz	JKIFWRWTJBBANA-SMEINOAPSA-N	0	3	342.870	3.349	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)Cc1cc(C)cc(C)c1)C2	ZINC001054188898	1349191349	/nfs/dbraw/zinc/19/13/49/1349191349.db2.gz	WDULWXFSEGIMDT-JOCHJYFZSA-N	0	3	338.495	3.184	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccccc1-n1cccc1)C2	ZINC001054188286	1349191411	/nfs/dbraw/zinc/19/14/11/1349191411.db2.gz	LGELHBXALJLCCD-QFIPXVFZSA-N	0	3	347.462	3.039	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(Cl)c(C)c1)C2	ZINC001054188209	1349191615	/nfs/dbraw/zinc/19/16/15/1349191615.db2.gz	JEMCHYAWPMKLOX-IBGZPJMESA-N	0	3	330.859	3.210	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)C[C@@H](C)c1cccc(F)c1)C2	ZINC001054194698	1349197491	/nfs/dbraw/zinc/19/74/91/1349197491.db2.gz	UPUUSXHZWJVUET-UTKZUKDTSA-N	0	3	342.458	3.267	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H](C)c1ccsc1)C2	ZINC001054195727	1349198245	/nfs/dbraw/zinc/19/82/45/1349198245.db2.gz	CAHVRNZAZQXWSX-QFBILLFUSA-N	0	3	330.497	3.189	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)[C@H](c1ccccc1)C(C)C)C2	ZINC001054202855	1349204598	/nfs/dbraw/zinc/20/45/98/1349204598.db2.gz	BFAPMNCJQWASAA-UNMCSNQZSA-N	0	3	338.495	3.374	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(Cl)c(F)c1)C2	ZINC001054204031	1349204876	/nfs/dbraw/zinc/20/48/76/1349204876.db2.gz	ZGYXVXLMXQAJSG-GOSISDBHSA-N	0	3	334.822	3.040	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1scnc1C(C)(C)C)C2	ZINC001054210835	1349211447	/nfs/dbraw/zinc/21/14/47/1349211447.db2.gz	WNLDUCHQKPOJEB-LJQANCHMSA-N	0	3	345.512	3.002	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1coc3ccc(F)cc13)C2	ZINC001054233574	1349226111	/nfs/dbraw/zinc/22/61/11/1349226111.db2.gz	NMBIVWCZEKMERK-FQEVSTJZSA-N	0	3	340.398	3.133	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc(CC)c(C)s1)C2	ZINC001054238616	1349232519	/nfs/dbraw/zinc/23/25/19/1349232519.db2.gz	ZSFNTGKXBQMGJL-IBGZPJMESA-N	0	3	330.497	3.180	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccoc1C(C)C)C2	ZINC001054245469	1349239349	/nfs/dbraw/zinc/23/93/49/1349239349.db2.gz	SYPUGLQYTVSWCC-FQEVSTJZSA-N	0	3	328.456	3.354	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H](C)Cc1ccccc1C)C2	ZINC001054247431	1349242477	/nfs/dbraw/zinc/24/24/77/1349242477.db2.gz	WKGBQWUCBNCXHM-SIKLNZKXSA-N	0	3	338.495	3.121	20	30		EGEDHN
CC1CC(CN2Cc3ccc(CNC(=O)c4cc(C#N)c[nH]4)cc3C2)C1	ZINC001054260370	1349257008	/nfs/dbraw/zinc/25/70/08/1349257008.db2.gz	LSDZCBOQQBGUNP-UHFFFAOYSA-N	0	3	348.450	3.178	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NCc1ccc2c(c1)CN(CCCC)C2	ZINC001054285315	1349287343	/nfs/dbraw/zinc/28/73/43/1349287343.db2.gz	CTHTYNIMCRGCPF-PMACEKPBSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3ccc4cccnn43)cc2C1	ZINC001054284940	1349287586	/nfs/dbraw/zinc/28/75/86/1349287586.db2.gz	LTKAXZPJQNBFIN-UHFFFAOYSA-N	0	3	346.434	3.156	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@H]3CCO[C@@H](C)C3)cc2C1	ZINC001054287116	1349289961	/nfs/dbraw/zinc/28/99/61/1349289961.db2.gz	ZMXAXNKAOOGGKO-WMZOPIPTSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cc(Cl)no3)cc2C1	ZINC001054290636	1349295527	/nfs/dbraw/zinc/29/55/27/1349295527.db2.gz	RTRZWYLXMLJCPH-UHFFFAOYSA-N	0	3	331.803	3.150	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cc(C)n(C)c3C)cc2C1	ZINC001054291400	1349297603	/nfs/dbraw/zinc/29/76/03/1349297603.db2.gz	LYRDIOINXIERHN-UHFFFAOYSA-N	0	3	337.467	3.464	20	30		EGEDHN
Cc1coc(C)c1C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001054616393	1349415728	/nfs/dbraw/zinc/41/57/28/1349415728.db2.gz	AXSOVNDUOKYFPT-BDJLRTHQSA-N	0	3	343.452	3.080	20	30		EGEDHN
CC(C(=O)N1C[C@@H](C)[C@@H](NCc2ccc(C#N)s2)C1)=C1CCC1	ZINC001054638891	1349424904	/nfs/dbraw/zinc/42/49/04/1349424904.db2.gz	RDLLMERDGJGAQU-PXAZEXFGSA-N	0	3	329.469	3.057	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001054970825	1349531496	/nfs/dbraw/zinc/53/14/96/1349531496.db2.gz	JAIJNEJEZWNPEE-CZUORRHYSA-N	0	3	331.485	3.159	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2cnc3c(F)cccc3c2)C1	ZINC001080133624	1357495802	/nfs/dbraw/zinc/49/58/02/1357495802.db2.gz	DJRALVVDXVEYGH-CXAGYDPISA-N	0	3	327.403	3.000	20	30		EGEDHN
C=C(C)CCN1C[C@@H](C)[C@H](NC(=O)c2cnc(CC3CC3)s2)C1	ZINC001080188683	1357517583	/nfs/dbraw/zinc/51/75/83/1357517583.db2.gz	PJOKJSJGKOQHQT-UKRRQHHQSA-N	0	3	333.501	3.112	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1F	ZINC001085740476	1358724966	/nfs/dbraw/zinc/72/49/66/1358724966.db2.gz	RWICWADECPKFLA-HYVNUMGLSA-N	0	3	334.410	3.177	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1cc[nH]c1C(C)C)C[C@@H](C)O2	ZINC001071201513	1354502214	/nfs/dbraw/zinc/50/22/14/1354502214.db2.gz	FXGMOTJSGLHISV-OXQOHEQNSA-N	0	3	345.487	3.020	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1ccc(F)cc1C)C[C@@H](C)O2	ZINC001071231140	1354516179	/nfs/dbraw/zinc/51/61/79/1354516179.db2.gz	NOOHLPOBYAVJFK-UZLBHIALSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1cc2ccccc2n1CC	ZINC001085985226	1358937296	/nfs/dbraw/zinc/93/72/96/1358937296.db2.gz	WCFBEQHDVVAEHL-QGZVFWFLSA-N	0	3	325.456	3.384	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2oc(CC3CC3)nc2C)CC[C@@H]1C	ZINC001071504643	1354732913	/nfs/dbraw/zinc/73/29/13/1354732913.db2.gz	IKUYJVVTGZANPV-BBRMVZONSA-N	0	3	331.460	3.094	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccccc2-c2cn[nH]c2)CC[C@H]1C	ZINC001071549006	1354761625	/nfs/dbraw/zinc/76/16/25/1354761625.db2.gz	NEOFAUBUZNFFEB-WBVHZDCISA-N	0	3	338.455	3.236	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCCC[C@H](N[C@@H](C)c2n[nH]c(CC)n2)C1	ZINC001088359542	1359843503	/nfs/dbraw/zinc/84/35/03/1359843503.db2.gz	AWGLXQNATDFVHQ-GJZGRUSLSA-N	0	3	347.507	3.001	20	30		EGEDHN
C=C(C)CCN1C[C@H](NC(=O)c2nc3cccnc3s2)CC[C@@H]1C	ZINC001071571925	1354771260	/nfs/dbraw/zinc/77/12/60/1354771260.db2.gz	NRTVERXYBGAXRF-UONOGXRCSA-N	0	3	344.484	3.240	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2C3CC4CC(C3)CC2C4)CC[C@H]1C	ZINC001071572027	1354771508	/nfs/dbraw/zinc/77/15/08/1354771508.db2.gz	PBKWUBULSLFNGF-NJKWNDLUSA-N	0	3	328.500	3.051	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc3oc(C)nc3c2)CC[C@H]1C	ZINC001071602107	1354788820	/nfs/dbraw/zinc/78/88/20/1354788820.db2.gz	GWOXIWBYZAFMHL-CZUORRHYSA-N	0	3	327.428	3.295	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cccc3c(C)c(C)[nH]c32)CC[C@H]1C	ZINC001071612611	1354797301	/nfs/dbraw/zinc/79/73/01/1354797301.db2.gz	KZFPBNODPWJYPC-PBHICJAKSA-N	0	3	337.467	3.391	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cnoc2-c2ccco2)CC[C@H]1C	ZINC001071623198	1354805035	/nfs/dbraw/zinc/80/50/35/1354805035.db2.gz	SKWABQOUUYDMFH-ZIAGYGMSSA-N	0	3	329.400	3.093	20	30		EGEDHN
C=CCCN1CC[C@H](NC(=O)c2cnc(-c3ccoc3)s2)[C@H]1C	ZINC001088904434	1360100592	/nfs/dbraw/zinc/10/05/92/1360100592.db2.gz	MKJCQBSUAVXTAI-OCCSQVGLSA-N	0	3	331.441	3.172	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2cccc3ncccc23)CC[C@H]1C	ZINC001071677151	1354845044	/nfs/dbraw/zinc/84/50/44/1354845044.db2.gz	RLYFMLGYUCUWTM-AEFFLSMTSA-N	0	3	337.467	3.323	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CC[C@@H](C)N(Cc3cccc(C)c3)C2)c1	ZINC001071813671	1354955825	/nfs/dbraw/zinc/95/58/25/1354955825.db2.gz	CYNWHNMPXRMMDX-DYESRHJHSA-N	0	3	347.462	3.154	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cccc(N3CC=CC3)c2)CC[C@H]1C	ZINC001071854928	1354982901	/nfs/dbraw/zinc/98/29/01/1354982901.db2.gz	IIBLKMSROUHWPV-IEBWSBKVSA-N	0	3	339.483	3.222	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccccc2NC(=O)CC)CC[C@H]1C	ZINC001071908433	1355019385	/nfs/dbraw/zinc/01/93/85/1355019385.db2.gz	VQMNYTXLWKTIHS-HZPDHXFCSA-N	0	3	343.471	3.194	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cnn(CCC(C)C)c2C)CC[C@@H]1C	ZINC001071972826	1355054365	/nfs/dbraw/zinc/05/43/65/1355054365.db2.gz	BPUZIPJHXPSQHH-WMZOPIPTSA-N	0	3	346.519	3.396	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cnn(C3CCCC3)c2C)CC[C@@H]1C	ZINC001071977893	1355057406	/nfs/dbraw/zinc/05/74/06/1355057406.db2.gz	UKQAUBXRMAJESA-RDJZCZTQSA-N	0	3	344.503	3.465	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2c(Cl)nc3ccccn32)CC[C@@H]1C	ZINC001072048465	1355103015	/nfs/dbraw/zinc/10/30/15/1355103015.db2.gz	KMRIWIKIEFPFTE-KBPBESRZSA-N	0	3	346.862	3.147	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2ccc3c(c2)CCC3)CC[C@H]1C	ZINC001072070650	1355111249	/nfs/dbraw/zinc/11/12/49/1355111249.db2.gz	RJTPWAXWQLWCPO-UZLBHIALSA-N	0	3	326.484	3.263	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc(-c3ccc(C)o3)n[nH]2)CC[C@H]1C	ZINC001072072301	1355113180	/nfs/dbraw/zinc/11/31/80/1355113180.db2.gz	IODAHXXDQBVEGX-UKRRQHHQSA-N	0	3	342.443	3.137	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc(OC)c(OC)cc2C)CC[C@@H]1C	ZINC001072091470	1355123538	/nfs/dbraw/zinc/12/35/38/1355123538.db2.gz	BMBLYNDTEDSXQA-JKSUJKDBSA-N	0	3	346.471	3.171	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc3ccccc3n2CC)CC[C@H]1C	ZINC001072092751	1355124914	/nfs/dbraw/zinc/12/49/14/1355124914.db2.gz	WZRRWEHINVHWCX-AEFFLSMTSA-N	0	3	337.467	3.267	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(C(C)(F)F)cc2)CC[C@@H]1C	ZINC001072124213	1355142384	/nfs/dbraw/zinc/14/23/84/1355142384.db2.gz	YOUMUTYGRUWCLH-WMLDXEAASA-N	0	3	334.410	3.404	20	30		EGEDHN
C[C@H]1CCN(C(=O)c2ccccc2)C[C@H]1CNCc1ccccc1C#N	ZINC001072174606	1355169066	/nfs/dbraw/zinc/16/90/66/1355169066.db2.gz	BAMAUPDBRJAZRA-LAUBAEHRSA-N	0	3	347.462	3.446	20	30		EGEDHN
C[C@@H]1CCN(C(=O)C2CC=CC2)C[C@H]1CNCc1ccccc1C#N	ZINC001072237791	1355198583	/nfs/dbraw/zinc/19/85/83/1355198583.db2.gz	AFSJQQXOHMURCZ-OXQOHEQNSA-N	0	3	337.467	3.099	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@H](C)[C@@H](CNCc2ccccc2C#N)C1	ZINC001072252256	1355209161	/nfs/dbraw/zinc/20/91/61/1355209161.db2.gz	RTYGPSLJLXTKDK-YJBOKZPZSA-N	0	3	343.446	3.396	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](C)[C@H](CNCc3nccs3)C2)CC1	ZINC001072356293	1355254460	/nfs/dbraw/zinc/25/44/60/1355254460.db2.gz	JFVCQXXFTWYADI-DOTOQJQBSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](C)[C@@H](CNCc3cscn3)C2)C1	ZINC001072364169	1355258753	/nfs/dbraw/zinc/25/87/53/1355258753.db2.gz	POLOKWOPIWNNQL-CABCVRRESA-N	0	3	333.501	3.074	20	30		EGEDHN
CC(C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2)=C1CCCC1	ZINC001072607682	1355356489	/nfs/dbraw/zinc/35/64/89/1355356489.db2.gz	DTNXVYTUBBQAIY-UHFFFAOYSA-N	0	3	349.478	3.483	20	30		EGEDHN
C[C@@]1(C(=O)N2CC3(C2)CCN(Cc2cccc(C#N)c2)C3)CC=CCC1	ZINC001072774507	1355430732	/nfs/dbraw/zinc/43/07/32/1355430732.db2.gz	WDRFUEGXUKLUEZ-OAQYLSRUSA-N	0	3	349.478	3.339	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1cccc(OC)c1)C2	ZINC001072944502	1355512854	/nfs/dbraw/zinc/51/28/54/1355512854.db2.gz	DRPPYCRJWPEVAB-HXUWFJFHSA-N	0	3	342.483	3.332	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3cc(Cl)cc(Cl)c3)C2)C1	ZINC001073147936	1355625877	/nfs/dbraw/zinc/62/58/77/1355625877.db2.gz	WYOUCKXIWGFRAE-UHFFFAOYSA-N	0	3	325.239	3.327	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2ccc3c(c2)C=CCC3)C1	ZINC001073806937	1355903179	/nfs/dbraw/zinc/90/31/79/1355903179.db2.gz	AJJMSKOVIYOXLN-HXUWFJFHSA-N	0	3	340.467	3.043	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCCN1C(=O)C(C)(F)F	ZINC001073925467	1355959361	/nfs/dbraw/zinc/95/93/61/1355959361.db2.gz	CGDMKCVTGQSXAV-MRXNPFEDSA-N	0	3	335.398	3.026	20	30		EGEDHN
C=C(C)CCN1C[C@@H](C)[C@H](NC(=O)c2cnc(-c3ccco3)s2)C1	ZINC001080818446	1357744078	/nfs/dbraw/zinc/74/40/78/1357744078.db2.gz	KBKOYPIUZNMHRN-ZIAGYGMSSA-N	0	3	345.468	3.419	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCCN1C(=O)c1ccncc1	ZINC001073930459	1355965033	/nfs/dbraw/zinc/96/50/33/1355965033.db2.gz	HRENQIHELFBINQ-HXUWFJFHSA-N	0	3	348.450	3.080	20	30		EGEDHN
CS[C@H](C)C(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(C#N)cc1	ZINC001073954659	1355991481	/nfs/dbraw/zinc/99/14/81/1355991481.db2.gz	ZXYJEWQXLAJDID-CRAIPNDOSA-N	0	3	345.512	3.123	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(Cl)cc1	ZINC001073972898	1356004245	/nfs/dbraw/zinc/00/42/45/1356004245.db2.gz	JGFIKEGPEGDWKW-RHSMWYFYSA-N	0	3	333.863	3.313	20	30		EGEDHN
C=C[C@H](C(=O)N1CC[C@H](NCc2ccccn2)[C@@H]1C)c1ccccc1	ZINC001075124733	1356319771	/nfs/dbraw/zinc/31/97/71/1356319771.db2.gz	IBQDHZYKWFGBQE-VDGAXYAQSA-N	0	3	335.451	3.130	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCO[C@@H]1C1CCN(C(=O)C(C)(C)C)CC1	ZINC001075416088	1356362692	/nfs/dbraw/zinc/36/26/92/1356362692.db2.gz	TWOOTQFSAVLUPM-JKSUJKDBSA-N	0	3	342.911	3.161	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccn(C4CCCCC4)n3)[C@@H]2C1	ZINC001075789186	1356422707	/nfs/dbraw/zinc/42/27/07/1356422707.db2.gz	YAONPQRYBKCJEZ-QFBILLFUSA-N	0	3	342.487	3.111	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cc(C)cc(OC)c3C)[C@@H]2C1	ZINC001075992310	1356463332	/nfs/dbraw/zinc/46/33/32/1356463332.db2.gz	UDYOGLIOYPEZAE-FUHWJXTLSA-N	0	3	328.456	3.034	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@H](C)OC3CCCCCC3)[C@@H]2C1	ZINC001076224265	1356524262	/nfs/dbraw/zinc/52/42/62/1356524262.db2.gz	KPZGUVSIVSWKPD-JENIJYKNSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccc(OC)cc3Cl)[C@@H]2C1	ZINC001076370180	1356561331	/nfs/dbraw/zinc/56/13/31/1356561331.db2.gz	HZLBAJLYZCYOER-SUMWQHHRSA-N	0	3	334.847	3.071	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@@H](C)c3ccc(F)cc3F)[C@@H]2C1	ZINC001076590222	1356625281	/nfs/dbraw/zinc/62/52/81/1356625281.db2.gz	BQGBYXKRYVAOPR-SUNYJGFJSA-N	0	3	334.410	3.177	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cc4ccccc4n3CC)[C@@H]2C1	ZINC001076600622	1356627921	/nfs/dbraw/zinc/62/79/21/1356627921.db2.gz	MTWVZXPYQAXESF-FXAWDEMLSA-N	0	3	337.467	3.384	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(-n3cccc3)cc2)C1	ZINC001098927677	1363524593	/nfs/dbraw/zinc/52/45/93/1363524593.db2.gz	SVWMPHLZWADSAN-UGKGYDQZSA-N	0	3	347.462	3.085	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)CC2CCC2)C12CCC2	ZINC001078585054	1357019503	/nfs/dbraw/zinc/01/95/03/1357019503.db2.gz	AMOMUSQNKMBQJE-KBPBESRZSA-N	0	3	341.293	3.102	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc(C)nc(C)c2)C12CCC2	ZINC001078637577	1357046559	/nfs/dbraw/zinc/04/65/59/1357046559.db2.gz	RDJGVUGAZIUTFH-HOTGVXAUSA-N	0	3	333.863	3.082	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@H](NCc3cncs3)C23CCC3)C1	ZINC001078720483	1357065200	/nfs/dbraw/zinc/06/52/00/1357065200.db2.gz	LTQSHLGFVBEBJX-GJZGRUSLSA-N	0	3	331.485	3.016	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2cc(CCC)on2)C12CCC2	ZINC001078768689	1357074668	/nfs/dbraw/zinc/07/46/68/1357074668.db2.gz	VBSKTDWQNIOSHX-CABCVRRESA-N	0	3	337.851	3.010	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2ccc3[nH]c(C)c(C)c3c2)C1	ZINC001080922750	1357765453	/nfs/dbraw/zinc/76/54/53/1357765453.db2.gz	SMIBLFNXXXKVNC-BFUOFWGJSA-N	0	3	325.456	3.411	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2occc2C(C)C)C[C@H]1c1ccccc1	ZINC001081168429	1357847104	/nfs/dbraw/zinc/84/71/04/1357847104.db2.gz	XLYJCODMWQWQIH-RBUKOAKNSA-N	0	3	336.435	3.234	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H](C)c2ccccc2C)C[C@H]1c1ccccc1	ZINC001081230241	1357851903	/nfs/dbraw/zinc/85/19/03/1357851903.db2.gz	VOVQOVLCHBORNA-YUXAGFNASA-N	0	3	346.474	3.316	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2c(C)cccc2Cl)[C@H](OC)C1	ZINC001082096928	1357943909	/nfs/dbraw/zinc/94/39/09/1357943909.db2.gz	MBCDUOKREZDVMC-HZPDHXFCSA-N	0	3	336.863	3.044	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2csc3c2CCCC3)[C@H](OC)C1	ZINC001082360400	1358022628	/nfs/dbraw/zinc/02/26/28/1358022628.db2.gz	ZMESJPDAJRSCSD-IAGOWNOFSA-N	0	3	348.512	3.022	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H](C)[C@H](NCc2ccnc(Cl)c2)C1	ZINC001082722008	1358080179	/nfs/dbraw/zinc/08/01/79/1358080179.db2.gz	SWFVULBDMJAQQQ-SIIHOXLZSA-N	0	3	335.879	3.274	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)c3ccc(C(C)C)cc3)[C@H]2C1	ZINC001083256586	1358126730	/nfs/dbraw/zinc/12/67/30/1358126730.db2.gz	GPIOQUYNILAHQL-VQTJNVASSA-N	0	3	342.483	3.301	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3c(C)noc3CCC)[C@@H]2C1	ZINC001084339117	1358195460	/nfs/dbraw/zinc/19/54/60/1358195460.db2.gz	PWIQLPKJZHVQLE-HZPDHXFCSA-N	0	3	331.460	3.048	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3c(C)noc3C(F)F)[C@@H]2C1	ZINC001084441658	1358214227	/nfs/dbraw/zinc/21/42/27/1358214227.db2.gz	BJDGNFIOZKCDCW-CHWSQXEVSA-N	0	3	339.386	3.033	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)Cc3c(C)cccc3Cl)[C@@H]2C1	ZINC001084485576	1358222655	/nfs/dbraw/zinc/22/26/55/1358222655.db2.gz	LZEJSNVNLCLMMU-CRAIPNDOSA-N	0	3	332.875	3.300	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)COc3ccc(C(C)C)cc3)[C@@H]2C1	ZINC001084492607	1358225205	/nfs/dbraw/zinc/22/52/05/1358225205.db2.gz	HDZBDRPRFJIRLX-UYAOXDASSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)CCc3ccccc3Cl)[C@@H]2C1	ZINC001084817861	1358319830	/nfs/dbraw/zinc/31/98/30/1358319830.db2.gz	YAHKQWVAAROZTR-SJLPKXTDSA-N	0	3	332.875	3.381	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@@H]3C[C@H]3c3ccc(F)cc3)[C@@H]2C1	ZINC001084861206	1358333410	/nfs/dbraw/zinc/33/34/10/1358333410.db2.gz	BLFOYKOHNCHTBB-QXCFHYIPSA-N	0	3	328.431	3.038	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)c3ccc(N(C)CCC)cc3)[C@@H]2C1	ZINC001084869035	1358335527	/nfs/dbraw/zinc/33/55/27/1358335527.db2.gz	QPXSRLGIQNVIKL-UYAOXDASSA-N	0	3	341.499	3.255	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@H](C)Cc3ccc(F)cc3)C[C@@H]21	ZINC001085105352	1358393598	/nfs/dbraw/zinc/39/35/98/1358393598.db2.gz	YXWHFLBRNJQGCF-SUMDDJOVSA-N	0	3	330.447	3.113	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccnc(CCC)c1	ZINC001085233051	1358439271	/nfs/dbraw/zinc/43/92/71/1358439271.db2.gz	IRXOPFLYWGLDPX-IAGOWNOFSA-N	0	3	335.879	3.417	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1c(C)noc1C(F)F	ZINC001085240452	1358440481	/nfs/dbraw/zinc/44/04/81/1358440481.db2.gz	FVBSAEVOJNQSIU-GHMZBOCLSA-N	0	3	347.793	3.304	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cn(C(C)C)nc1C	ZINC001085391356	1358486988	/nfs/dbraw/zinc/48/69/88/1358486988.db2.gz	AFVYQYIFXKFBAK-HZPDHXFCSA-N	0	3	338.883	3.156	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cc2n(c1)CCCC2	ZINC001085444082	1358501594	/nfs/dbraw/zinc/50/15/94/1358501594.db2.gz	WCQNSIBLMINJHT-IAGOWNOFSA-N	0	3	335.879	3.208	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc2cc(C)cn2c1	ZINC001085634237	1358650388	/nfs/dbraw/zinc/65/03/88/1358650388.db2.gz	LVVYSOLPAOHXMD-IBGZPJMESA-N	0	3	325.456	3.360	20	30		EGEDHN
C=CCOc1ccc(C(=O)N(C)C[C@@H]2CCN2CCC2CC2)cc1	ZINC001085678826	1358683161	/nfs/dbraw/zinc/68/31/61/1358683161.db2.gz	SAEXDEBHEWUEOW-SFHVURJKSA-N	0	3	328.456	3.198	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@H]1Cc2cc(Cl)ccc2O1	ZINC001085707101	1358699448	/nfs/dbraw/zinc/69/94/48/1358699448.db2.gz	CSXZMDCGCDVFSU-FUHWJXTLSA-N	0	3	348.874	3.142	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1ccc2c(c1)C(C)(C)CO2	ZINC001085717306	1358707720	/nfs/dbraw/zinc/70/77/20/1358707720.db2.gz	JKCSDINBFFNMKQ-MRXNPFEDSA-N	0	3	328.456	3.079	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C[C@@H]2CCN2CCCc2ccccc2)cc1	ZINC001085757627	1358736411	/nfs/dbraw/zinc/73/64/11/1358736411.db2.gz	MTSAGUFILOOSEU-QFIPXVFZSA-N	0	3	346.474	3.447	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C[C@H]2CCN2CCc2ccc(C)cc2)cc1	ZINC001085756812	1358737232	/nfs/dbraw/zinc/73/72/32/1358737232.db2.gz	QYVDPFBFGDRVPT-JOCHJYFZSA-N	0	3	346.474	3.365	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cccc(N2CCCC2)c1	ZINC001085888872	1358847735	/nfs/dbraw/zinc/84/77/35/1358847735.db2.gz	KDZJIDTZUPPQNX-FQEVSTJZSA-N	0	3	341.499	3.399	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1cnc2ccc(F)cc2c1	ZINC001085908303	1358866603	/nfs/dbraw/zinc/86/66/03/1358866603.db2.gz	GATCSSRMOMNMJL-KRWDZBQOSA-N	0	3	327.403	3.096	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cccc(NC(C)=O)c1C	ZINC001085925975	1358884496	/nfs/dbraw/zinc/88/44/96/1358884496.db2.gz	KPUKSBOLTRUMLQ-KRWDZBQOSA-N	0	3	343.471	3.066	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc(OC)c(OCC)c1	ZINC001085960777	1358919274	/nfs/dbraw/zinc/91/92/74/1358919274.db2.gz	OBYVRGFYHMOFTK-QGZVFWFLSA-N	0	3	346.471	3.206	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(C(C)(C)C)cn2)C1	ZINC001086089129	1358992999	/nfs/dbraw/zinc/99/29/99/1358992999.db2.gz	IXWQIXKJULNAGE-OTVXOJSOSA-N	0	3	335.879	3.230	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2nsc3ccccc32)C1	ZINC001086095465	1358995333	/nfs/dbraw/zinc/99/53/33/1358995333.db2.gz	DGXNNNLJBXZWCW-TXEJJXNPSA-N	0	3	335.860	3.147	20	30		EGEDHN
CC1(C)CC[C@H]1C(=O)NC[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001086172270	1359014429	/nfs/dbraw/zinc/01/44/29/1359014429.db2.gz	RGZGOGDJWWJVNQ-UAGQMJEPSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc([C@@H](C)CC)no2)C1	ZINC001086219094	1359031236	/nfs/dbraw/zinc/03/12/36/1359031236.db2.gz	LEDGYMFPRJPSHP-WCFLWFBJSA-N	0	3	325.840	3.039	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2coc(-c3ccccc3)n2)C1	ZINC001086255739	1359043727	/nfs/dbraw/zinc/04/37/27/1359043727.db2.gz	QRKFWNPNWYSTHY-OTVXOJSOSA-N	0	3	345.830	3.192	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cccc(OCCC)c2)C1	ZINC001086379880	1359083026	/nfs/dbraw/zinc/08/30/26/1359083026.db2.gz	CSUNKVIZCHOLIJ-KOMQPUFPSA-N	0	3	336.863	3.326	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc(C)n([C@@H](C)CC)n2)C1	ZINC001086412100	1359090987	/nfs/dbraw/zinc/09/09/87/1359090987.db2.gz	JZROEBALWZFHKP-QEJZJMRPSA-N	0	3	338.883	3.013	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)C23CC4CC(CC(C4)C2)C3)C1	ZINC001086540625	1359138164	/nfs/dbraw/zinc/13/81/64/1359138164.db2.gz	ORTRIFQCEXCEPD-MLUUCSJWSA-N	0	3	336.907	3.440	20	30		EGEDHN
C=C(C)CN1C[C@@H](c2ccccc2)[C@H](NC(=O)[C@@H]2CCC2(F)F)C1	ZINC001086594603	1359159323	/nfs/dbraw/zinc/15/93/23/1359159323.db2.gz	JTETTXBVRUGCGP-YESZJQIVSA-N	0	3	334.410	3.192	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)[C@]2(C)C[C@H]3C[C@H]3C2)C1	ZINC001086601106	1359161051	/nfs/dbraw/zinc/16/10/51/1359161051.db2.gz	GRLBGSMIHOVLJA-YWQQVWADSA-N	0	3	336.479	3.030	20	30		EGEDHN
C=C(C)CN1C[C@@H](c2ccccc2)[C@H](NC(=O)Cc2cccnc2C)C1	ZINC001086609778	1359163841	/nfs/dbraw/zinc/16/38/41/1359163841.db2.gz	XBZLQLUXFUSUJN-LEWJYISDSA-N	0	3	349.478	3.093	20	30		EGEDHN
C=CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2cc(Cl)no2)C1	ZINC001086620599	1359166800	/nfs/dbraw/zinc/16/68/00/1359166800.db2.gz	ATVYONJTABNJKL-LSDHHAIUSA-N	0	3	345.830	3.102	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cccc(C(C)C)n2)C1	ZINC001086747345	1359194556	/nfs/dbraw/zinc/19/45/56/1359194556.db2.gz	VJGZKHLNRXHKMP-LSDHHAIUSA-N	0	3	335.879	3.446	20	30		EGEDHN
C[C@@H]1CC2(CN1C(=O)C(F)F)CCN(Cc1cccc(C#N)c1)CC2	ZINC001086895715	1359224796	/nfs/dbraw/zinc/22/47/96/1359224796.db2.gz	RZTPGWZEFKYYSD-CQSZACIVSA-N	0	3	347.409	3.026	20	30		EGEDHN
C=C(C)C[NH+]1CCC2(C[C@@H](C)N(C(=O)c3ccccc3[O-])C2)CC1	ZINC001086904263	1359233819	/nfs/dbraw/zinc/23/38/19/1359233819.db2.gz	ANOADKAGFBHKPB-MRXNPFEDSA-N	0	3	328.456	3.285	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3nc(C(C)C)oc3C)C2)CC1	ZINC001086923710	1359249480	/nfs/dbraw/zinc/24/94/80/1359249480.db2.gz	ZAXFHYOMHSGFHQ-OAHLLOKOSA-N	0	3	343.471	3.056	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3cc(C)nc(C)c3)C2)CC1	ZINC001086925364	1359250685	/nfs/dbraw/zinc/25/06/85/1359250685.db2.gz	UUAHPZARNZIVLB-SFHVURJKSA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cccc(C(C)C)n3)C2)CC1	ZINC001086931550	1359255398	/nfs/dbraw/zinc/25/53/98/1359255398.db2.gz	LMWSOERPZWMMCH-QGZVFWFLSA-N	0	3	339.483	3.155	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H]3CCCCC3(F)F)C2)CC1	ZINC001086934153	1359257867	/nfs/dbraw/zinc/25/78/67/1359257867.db2.gz	INQDMXLYZRRTMG-HOTGVXAUSA-N	0	3	338.442	3.148	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H](C)C(C)(F)F)C2)CC1	ZINC001086943062	1359264012	/nfs/dbraw/zinc/26/40/12/1359264012.db2.gz	IYSQCVYZVOVFGM-LSDHHAIUSA-N	0	3	326.431	3.004	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H]3C[C@H]3CC(C)C)C2)CC1	ZINC001086943673	1359264639	/nfs/dbraw/zinc/26/46/39/1359264639.db2.gz	ASLCLJWYSRWLQZ-IPMKNSEASA-N	0	3	330.516	3.395	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@H]3C[C@@H]3c3ccccc3)C2)CC1	ZINC001086947209	1359268523	/nfs/dbraw/zinc/26/85/23/1359268523.db2.gz	RWMYOVSJCVQZLO-SXLOBPIMSA-N	0	3	336.479	3.126	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H](C)c3ccccc3F)C2)CC1	ZINC001086948718	1359269482	/nfs/dbraw/zinc/26/94/82/1359269482.db2.gz	GKUTVEJOSGFQKU-SJORKVTESA-N	0	3	342.458	3.265	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)C3CCC=CCC3)C2)CC1	ZINC001086957033	1359278232	/nfs/dbraw/zinc/27/82/32/1359278232.db2.gz	CRTIGWRQTJWHBS-SFHVURJKSA-N	0	3	328.500	3.459	20	30		EGEDHN
C[C@@H]1CCN(C(=O)C2=CCCC2)[C@H](CNCc2ccc(C#N)s2)C1	ZINC001087148089	1359307360	/nfs/dbraw/zinc/30/73/60/1359307360.db2.gz	FZHYNKBMSMIUGE-ZBFHGGJFSA-N	0	3	343.496	3.447	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](CNCc2oc(CC)nc2C)[C@H](C)C1	ZINC001184079499	1387389813	/nfs/dbraw/zinc/38/98/13/1387389813.db2.gz	WQDAQCRCQWKRHJ-GDBMZVCRSA-N	0	3	333.476	3.086	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](CNCc2oc(CC)nc2C)[C@@H](C)C1	ZINC001184079500	1387389887	/nfs/dbraw/zinc/38/98/87/1387389887.db2.gz	WQDAQCRCQWKRHJ-GOEBONIOSA-N	0	3	333.476	3.086	20	30		EGEDHN
CC1(C)[C@H](NC(=O)C2CC2)[C@@H]2CCCN(Cc3cccc(C#N)c3)[C@@H]21	ZINC001087266377	1359337277	/nfs/dbraw/zinc/33/72/77/1359337277.db2.gz	KVSFIHGJDZXRAK-OTWHNJEPSA-N	0	3	337.467	3.073	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)CC3CC(F)(F)C3)C(C)(C)[C@H]21	ZINC001087292971	1359373316	/nfs/dbraw/zinc/37/33/16/1359373316.db2.gz	VMETTWUUHDRHCQ-PVAVHDDUSA-N	0	3	338.442	3.050	20	30		EGEDHN
C=CCN1CCC[C@@H]2[C@@H](NC(=O)c3nc(Cl)cs3)C(C)(C)[C@@H]21	ZINC001087300095	1359382144	/nfs/dbraw/zinc/38/21/44/1359382144.db2.gz	GUSSXDWSWDMSAG-RAIGVLPGSA-N	0	3	339.892	3.201	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc[nH]c3C(C)C)C(C)(C)[C@H]21	ZINC001087300227	1359382764	/nfs/dbraw/zinc/38/27/64/1359382764.db2.gz	HYAQBQQQQOBFSE-NEWSRXKRSA-N	0	3	341.499	3.380	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cccc(F)c1Cl	ZINC001087304770	1359389614	/nfs/dbraw/zinc/38/96/14/1359389614.db2.gz	HMINMRRUULFHGJ-XOKHGSTOSA-N	0	3	348.849	3.331	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc(C(C)C)no1	ZINC001087304964	1359389756	/nfs/dbraw/zinc/38/97/56/1359389756.db2.gz	KLCQOEBAFROHHJ-FHLIZLRMSA-N	0	3	343.471	3.040	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc4ccccn4c3)C(C)(C)[C@H]21	ZINC001087305417	1359390597	/nfs/dbraw/zinc/39/05/97/1359390597.db2.gz	SDEYLNAVMPALQK-AQNXPRMDSA-N	0	3	349.478	3.181	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccsc1Cl	ZINC001087306789	1359394124	/nfs/dbraw/zinc/39/41/24/1359394124.db2.gz	OLWCUMKLYNUPOL-KWCYVHTRSA-N	0	3	336.888	3.254	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccoc3CCC)C(C)(C)[C@H]21	ZINC001087312761	1359401400	/nfs/dbraw/zinc/40/14/00/1359401400.db2.gz	JWZBTKBXRMTLKP-QRQLOZEOSA-N	0	3	342.483	3.474	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc(C2CC2)s1	ZINC001087313202	1359401513	/nfs/dbraw/zinc/40/15/13/1359401513.db2.gz	QRDZZCJJZLMCKO-FHLIZLRMSA-N	0	3	342.508	3.478	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(Cl)s3)C(C)(C)[C@H]21	ZINC001087316606	1359407241	/nfs/dbraw/zinc/40/72/41/1359407241.db2.gz	UWKJKNYBQQWLBJ-DFBGVHRSSA-N	0	3	336.888	3.254	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3c(C)nsc3C)C(C)(C)[C@H]21	ZINC001087319581	1359412624	/nfs/dbraw/zinc/41/26/24/1359412624.db2.gz	QBKCBMODBCZDFC-PVAVHDDUSA-N	0	3	345.512	3.002	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)C2C=CC=CC=C2)CCN1Cc1cccc(C#N)c1	ZINC001087589346	1359546050	/nfs/dbraw/zinc/54/60/50/1359546050.db2.gz	XOICHEIAONWJMF-LEWJYISDSA-N	0	3	347.462	3.326	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)C2CCc3ccccc3CC2)[C@H]1CC	ZINC001087634184	1359565009	/nfs/dbraw/zinc/56/50/09/1359565009.db2.gz	QGNIRZHHOMGEGN-VQTJNVASSA-N	0	3	326.484	3.337	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2c(C)[nH]c3ccccc32)[C@H]1CC	ZINC001087709029	1359602833	/nfs/dbraw/zinc/60/28/33/1359602833.db2.gz	BANWXNXGFLQIAO-VQTJNVASSA-N	0	3	337.467	3.011	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)Cn2cc(C)c3ccccc32)[C@H]1CC	ZINC001087759028	1359631832	/nfs/dbraw/zinc/63/18/32/1359631832.db2.gz	ZLGAIGAGXXKOIJ-ZWKOTPCHSA-N	0	3	325.456	3.105	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2cnc(CC(C)(C)C)s2)[C@H]1CC	ZINC001087787506	1359645368	/nfs/dbraw/zinc/64/53/68/1359645368.db2.gz	BOKBNLWMNFWPGZ-LSDHHAIUSA-N	0	3	347.528	3.338	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccccc2C(F)(F)F)[C@H]1CC	ZINC001087806384	1359655432	/nfs/dbraw/zinc/65/54/32/1359655432.db2.gz	BRDXZUHAOYHJMM-LSDHHAIUSA-N	0	3	326.362	3.474	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cc(C)n(C(C)(C)C)n2)[C@H]1CC	ZINC001087831518	1359668620	/nfs/dbraw/zinc/66/86/20/1359668620.db2.gz	PUJWHMNNZMRZGK-DOTOQJQBSA-N	0	3	332.492	3.105	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)[C@H]2CCCCc3ccccc32)[C@H]1CC	ZINC001087843284	1359676267	/nfs/dbraw/zinc/67/62/67/1359676267.db2.gz	OOPIJOJWSFVJLS-PCCBWWKXSA-N	0	3	338.495	3.489	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccc(OC(C)C)cn2)[C@H]1CC	ZINC001087852419	1359680968	/nfs/dbraw/zinc/68/09/68/1359680968.db2.gz	SMQAEDLSVDIYEB-FUHWJXTLSA-N	0	3	331.460	3.028	20	30		EGEDHN
CC(C)=C(F)C(=O)N1C[C@H]2CCN(Cc3cccc(C#N)c3)C[C@H]2C1	ZINC001087932350	1359713355	/nfs/dbraw/zinc/71/33/55/1359713355.db2.gz	UGAWOZRWZRCCKS-MSOLQXFVSA-N	0	3	341.430	3.102	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3ccc(C4CCCC4)cc3)C[C@@H]2C1	ZINC001088042986	1359732378	/nfs/dbraw/zinc/73/23/78/1359732378.db2.gz	RZNIVOLFUSEMAK-RTWAWAEBSA-N	0	3	336.479	3.371	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)C[C@H](C)c3ccccc3F)C[C@@H]2C1	ZINC001088142043	1359771908	/nfs/dbraw/zinc/77/19/08/1359771908.db2.gz	PMMPGXYLXZVPFG-KSZLIROESA-N	0	3	342.458	3.123	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3ccc(Cl)c4occc43)C[C@@H]2C1	ZINC001088168085	1359778634	/nfs/dbraw/zinc/77/86/34/1359778634.db2.gz	IKAUIBRHNKBPAI-KGLIPLIRSA-N	0	3	342.826	3.113	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3oc4c(cccc4C)c3C)C[C@@H]2C1	ZINC001088212559	1359797930	/nfs/dbraw/zinc/79/79/30/1359797930.db2.gz	YRRNODCMSOEUEW-SJORKVTESA-N	0	3	336.435	3.077	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3cc4cccc(C)c4o3)C[C@@H]2C1	ZINC001088214318	1359798440	/nfs/dbraw/zinc/79/84/40/1359798440.db2.gz	GNOWTDQWAAIASM-MSOLQXFVSA-N	0	3	336.435	3.158	20	30		EGEDHN
Cc1ccc(CC2CCN([C@H](C)C(=O)N(C)CCC#N)CC2)cc1	ZINC001323681027	1387422090	/nfs/dbraw/zinc/42/20/90/1387422090.db2.gz	JYIBHMJVLPIRMT-QGZVFWFLSA-N	0	3	327.472	3.010	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2ncccc2Cl)C1	ZINC001088416271	1359886036	/nfs/dbraw/zinc/88/60/36/1359886036.db2.gz	JHCHOLTXELFOGE-CYBMUJFWSA-N	0	3	342.270	3.462	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2sc(C)nc2C)C1	ZINC001088421904	1359891365	/nfs/dbraw/zinc/89/13/65/1359891365.db2.gz	CPGHVSJNDWXYBW-CQSZACIVSA-N	0	3	341.908	3.487	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)[C@H](C)C2CCOCC2)C1	ZINC001088435741	1359903480	/nfs/dbraw/zinc/90/34/80/1359903480.db2.gz	NVILOBSZZZQUSX-WBVHZDCISA-N	0	3	342.911	3.162	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N[C@H]1CCN(Cc2cccc(C)c2)[C@@H]1C	ZINC001088575752	1359977727	/nfs/dbraw/zinc/97/77/27/1359977727.db2.gz	FIBSXYVQKNNVBJ-LMCOJAPRSA-N	0	3	342.483	3.055	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)C2(c3cccnc3)CCCC2)[C@H]1C	ZINC001088822558	1360064433	/nfs/dbraw/zinc/06/44/33/1360064433.db2.gz	YEOVJDKLDHVQGZ-AEFFLSMTSA-N	0	3	327.472	3.049	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCN(C[C@@H]3CC(C)(C)CO3)[C@@H]2C)CC1	ZINC001088838635	1360072393	/nfs/dbraw/zinc/07/23/93/1360072393.db2.gz	UCLCLRXYHPQUFX-NJAFHUGGSA-N	0	3	334.504	3.127	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCCC[C@H]1CN(C)Cc1cc2ccccc2o1	ZINC001089139605	1360196942	/nfs/dbraw/zinc/19/69/42/1360196942.db2.gz	GXXDBUBFKGGXQG-RDJZCZTQSA-N	0	3	339.439	3.405	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCCC[C@H]1CN(C)Cc1cccc(Cl)c1	ZINC001089139639	1360197264	/nfs/dbraw/zinc/19/72/64/1360197264.db2.gz	IFYSXPQXWBGLNA-YOEHRIQHSA-N	0	3	333.863	3.313	20	30		EGEDHN
Cc1csc(CNC[C@H]2CCN(C(=O)C#CC(C)(C)C)C[C@H]2C)n1	ZINC001184385694	1387445505	/nfs/dbraw/zinc/44/55/05/1387445505.db2.gz	DHOMKEYVSDXRMX-GDBMZVCRSA-N	0	3	347.528	3.075	20	30		EGEDHN
N#C[C@@H]1CCCN(C(=O)[C@@H]2CCCN(Cc3ccc(Cl)cc3)C2)C1	ZINC001184401214	1387449161	/nfs/dbraw/zinc/44/91/61/1387449161.db2.gz	HRNWQVMKYDLLKP-DLBZAZTESA-N	0	3	345.874	3.314	20	30		EGEDHN
N#CCCCCNC(=O)[C@H]1CCCN(Cc2ccc(Cl)cc2)C1	ZINC001184406331	1387450048	/nfs/dbraw/zinc/45/00/48/1387450048.db2.gz	OKBBGDYQSAFCRC-INIZCTEOSA-N	0	3	333.863	3.362	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cccc(-n3cccc3)c2)CC(C)(C)C1	ZINC001089432787	1360424281	/nfs/dbraw/zinc/42/42/81/1360424281.db2.gz	DMBBCINUCRKDTQ-LJQANCHMSA-N	0	3	349.478	3.331	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(-n3cccc3)cc2)CC(C)(C)C1	ZINC001089434541	1360425597	/nfs/dbraw/zinc/42/55/97/1360425597.db2.gz	UNNJUZWZTFRWBL-LJQANCHMSA-N	0	3	349.478	3.331	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C(C)(C)C)on2)CC(C)(C)C1	ZINC001089438115	1360428580	/nfs/dbraw/zinc/42/85/80/1360428580.db2.gz	GWCYBHFIPLPXEP-OAHLLOKOSA-N	0	3	345.487	3.216	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C(C)(C)c2cccs2)CC(C)(C)C1	ZINC001089459578	1360445971	/nfs/dbraw/zinc/44/59/71/1360445971.db2.gz	XPEQKDFLJJCDEW-HNNXBMFYSA-N	0	3	332.513	3.266	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2oc(C(C)C)nc2C)CC(C)(C)C1	ZINC001089515786	1360486295	/nfs/dbraw/zinc/48/62/95/1360486295.db2.gz	ZSOCKFDBMDTDKW-INIZCTEOSA-N	0	3	345.487	3.350	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@@H](C)c2ccc(F)c(F)c2)CC(C)(C)C1	ZINC001089561296	1360509096	/nfs/dbraw/zinc/50/90/96/1360509096.db2.gz	ONIHSMWLDXLANL-GOEBONIOSA-N	0	3	348.437	3.308	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ccnn1C1CCC1	ZINC001089641078	1360553860	/nfs/dbraw/zinc/55/38/60/1360553860.db2.gz	KIHPLEGXFKHEMV-KRWDZBQOSA-N	0	3	344.503	3.405	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H]1CCCc2c[nH]nc21	ZINC001089641630	1360554368	/nfs/dbraw/zinc/55/43/68/1360554368.db2.gz	PIXWROWMMNOUET-SJORKVTESA-N	0	3	344.503	3.013	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(F)c(F)c1	ZINC001089651753	1360564520	/nfs/dbraw/zinc/56/45/20/1360564520.db2.gz	MIEQPLWHSWFGPP-OAHLLOKOSA-N	0	3	334.410	3.209	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(OC)cc1F	ZINC001089663409	1360573201	/nfs/dbraw/zinc/57/32/01/1360573201.db2.gz	ODKQPGKJCSJZFL-HNNXBMFYSA-N	0	3	346.446	3.078	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccn2cncc2c1	ZINC001089664545	1360575238	/nfs/dbraw/zinc/57/52/38/1360575238.db2.gz	MKZNLXVQWYWRPK-QGZVFWFLSA-N	0	3	340.471	3.131	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H]1Cc2ccccc2O1	ZINC001089668546	1360578470	/nfs/dbraw/zinc/57/84/70/1360578470.db2.gz	XUFYMYUSPSYETJ-HKUYNNGSSA-N	0	3	342.483	3.173	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc2ccsc2[nH]1	ZINC001089677399	1360585936	/nfs/dbraw/zinc/58/59/36/1360585936.db2.gz	XMCXHKLWDFSMGL-OAHLLOKOSA-N	0	3	343.496	3.473	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc2nonc2c1	ZINC001089687437	1360593428	/nfs/dbraw/zinc/59/34/28/1360593428.db2.gz	JTFKOYMPACWQOL-OAHLLOKOSA-N	0	3	342.443	3.019	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccn(C)c1CC	ZINC001089691718	1360597435	/nfs/dbraw/zinc/59/74/35/1360597435.db2.gz	WLHARWQWQFVNQY-MRXNPFEDSA-N	0	3	331.504	3.384	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ncsc1C1CC1	ZINC001089694680	1360599951	/nfs/dbraw/zinc/59/99/51/1360599951.db2.gz	XGQIGYDDFNXWCR-HNNXBMFYSA-N	0	3	345.512	3.264	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cccc2c1OCC2	ZINC001089696707	1360601232	/nfs/dbraw/zinc/60/12/32/1360601232.db2.gz	HNGYRYXMWHFHEI-QGZVFWFLSA-N	0	3	342.483	3.418	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cccc2[nH]cnc21	ZINC001089715322	1360616733	/nfs/dbraw/zinc/61/67/33/1360616733.db2.gz	UGLJCFXNLMOBAQ-HNNXBMFYSA-N	0	3	340.471	3.359	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(C)nc1C	ZINC001089734446	1360639091	/nfs/dbraw/zinc/63/90/91/1360639091.db2.gz	QKEVOCGTTYUZFI-QGZVFWFLSA-N	0	3	329.488	3.495	20	30		EGEDHN
N#Cc1ccccc1CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1CCC1	ZINC001089751522	1360649014	/nfs/dbraw/zinc/64/90/14/1360649014.db2.gz	UJKSDJHEDDJYQD-BURNTYAHSA-N	0	3	349.478	3.027	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1ccc(F)cc1	ZINC001089760491	1360652865	/nfs/dbraw/zinc/65/28/65/1360652865.db2.gz	LQMJWHFVYPIVFJ-RANZSIQMSA-N	0	3	348.849	3.361	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1c(C)coc1C	ZINC001089809199	1360672804	/nfs/dbraw/zinc/67/28/04/1360672804.db2.gz	NWNISFDUUSFVKB-HZMVEIRTSA-N	0	3	348.874	3.431	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)c2c(C)coc2C)C1	ZINC001089809201	1360673092	/nfs/dbraw/zinc/67/30/92/1360673092.db2.gz	NWNISFDUUSFVKB-QAETUUGQSA-N	0	3	348.874	3.431	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](CNCc2oc(C)nc2C)[C@H](C)C1	ZINC001184471612	1387467613	/nfs/dbraw/zinc/46/76/13/1387467613.db2.gz	GBYIRTSBVWODQI-RHSMWYFYSA-N	0	3	347.503	3.468	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1(C(C)C)CC1	ZINC001089861826	1360706576	/nfs/dbraw/zinc/70/65/76/1360706576.db2.gz	KJQUIZWQHMEANW-HZMVEIRTSA-N	0	3	336.907	3.344	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)[C@@H]2CCC(C)=C(C)C2)CC2(CCOCC2)C1	ZINC001089939317	1360754002	/nfs/dbraw/zinc/75/40/02/1360754002.db2.gz	PXIQQXGGQXUPAZ-MOPGFXCFSA-N	0	3	346.515	3.296	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)[C@H]2CCCC3(CC3)C2)CC2(CCOCC2)C1	ZINC001089939493	1360754960	/nfs/dbraw/zinc/75/49/60/1360754960.db2.gz	SRNHDYADXVBIAM-ZWKOTPCHSA-N	0	3	346.515	3.130	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)[C@H]2CCCC23CC3)CC2(CCOCC2)C1	ZINC001089943878	1360756688	/nfs/dbraw/zinc/75/66/88/1360756688.db2.gz	VJZMVDHKWRRDQT-QZTJIDSGSA-N	0	3	346.515	3.130	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)[C@H]2CCC=CCCC2)CC2(CCOCC2)C1	ZINC001089945009	1360757458	/nfs/dbraw/zinc/75/74/58/1360757458.db2.gz	JFPVHXXWWNMWJI-RBUKOAKNSA-N	0	3	346.515	3.296	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)[C@@H](C)C2CCCC2)CC2(CCOCC2)C1	ZINC001089965110	1360770244	/nfs/dbraw/zinc/77/02/44/1360770244.db2.gz	VCXUXBRSJVLDIP-HKUYNNGSSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)C2=CCCCCC2)C1	ZINC001091000300	1360974143	/nfs/dbraw/zinc/97/41/43/1360974143.db2.gz	QZAAANODPRVEPL-UHFFFAOYSA-N	0	3	341.293	3.270	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(-n3cccc3)cc2)C1	ZINC001091125889	1360995318	/nfs/dbraw/zinc/99/53/18/1360995318.db2.gz	YEMLZCXORPMMIL-UHFFFAOYSA-N	0	3	343.858	3.328	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(-c3ccco3)o2)C1	ZINC001091137408	1360996379	/nfs/dbraw/zinc/99/63/79/1360996379.db2.gz	XGYYPVLRXVSMBC-UHFFFAOYSA-N	0	3	334.803	3.390	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cnc3ccc(F)cc3c2)C1	ZINC001091311279	1361040076	/nfs/dbraw/zinc/04/00/76/1361040076.db2.gz	AGJBVDPWUYDAPQ-UHFFFAOYSA-N	0	3	347.821	3.224	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2coc3ccc(F)cc23)C1	ZINC001091345297	1361053492	/nfs/dbraw/zinc/05/34/92/1361053492.db2.gz	JJEFLQXWYWLNKG-UHFFFAOYSA-N	0	3	336.794	3.422	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@H]2CN(Cc3cccnc3)C[C@@]2(C)C1	ZINC001091702298	1361186017	/nfs/dbraw/zinc/18/60/17/1361186017.db2.gz	VTEZKHYOBGEKJT-APWZRJJASA-N	0	3	347.890	3.141	20	30		EGEDHN
C#CCN(CC1CC1)C(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1	ZINC001323975077	1387502294	/nfs/dbraw/zinc/50/22/94/1387502294.db2.gz	MCHRHQBGPNYZPR-FQEVSTJZSA-N	0	3	339.483	3.187	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc4ccccc4s3)C[C@]2(C)C1	ZINC001091827967	1361230857	/nfs/dbraw/zinc/23/08/57/1361230857.db2.gz	WOPZLTPKKYCESZ-UZLBHIALSA-N	0	3	338.476	3.319	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CN(Cc3cnc(C)s3)C[C@@]2(C)C1	ZINC001091978635	1361265615	/nfs/dbraw/zinc/26/56/15/1361265615.db2.gz	ZBXRLDDIVWQVDR-LZQZEXGQSA-N	0	3	347.528	3.334	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CN(Cc4ccsc4)C[C@@]3(C)C2)C1	ZINC001091995952	1361269862	/nfs/dbraw/zinc/26/98/62/1361269862.db2.gz	NALLXOXIGHLUHR-APWZRJJASA-N	0	3	330.497	3.385	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)[C@H](CC)CC3CCCCC3)C[C@]2(C)C1	ZINC001092066116	1361286907	/nfs/dbraw/zinc/28/69/07/1361286907.db2.gz	ZGZWCGITNMCPMO-SBHAEUEKSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3cc(CC)c(CCC)s3)C[C@]2(C)C1	ZINC001092267005	1361350376	/nfs/dbraw/zinc/35/03/76/1361350376.db2.gz	LYXDAJKXSUJBNA-UZLBHIALSA-N	0	3	344.524	3.290	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3c[nH]cc3-c3ccccc3)C[C@]2(C)C1	ZINC001092273819	1361352079	/nfs/dbraw/zinc/35/20/79/1361352079.db2.gz	SRNZYMJPEGDIBE-GCJKJVERSA-N	0	3	347.462	3.099	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc(-c4ccccc4)[nH]3)C[C@]2(C)C1	ZINC001092317128	1361363769	/nfs/dbraw/zinc/36/37/69/1361363769.db2.gz	BCHBKLIJVPIHJV-GCJKJVERSA-N	0	3	347.462	3.099	20	30		EGEDHN
C=C[C@H](COC)N[C@H]1C[C@H](NC(=O)OC(C)(C)C)c2ccccc21	ZINC001324020745	1387511996	/nfs/dbraw/zinc/51/19/96/1387511996.db2.gz	BCHUSNZMRUYJEI-COXVUDFISA-N	0	3	332.444	3.488	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C2CCCCC2)CC1	ZINC001093352845	1361566976	/nfs/dbraw/zinc/56/69/76/1361566976.db2.gz	MYMYQOGYFRQSBX-IBGZPJMESA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C(C)(C)C(=C)Cl)CC1	ZINC001093372001	1361581087	/nfs/dbraw/zinc/58/10/87/1361581087.db2.gz	XSPBARQOBRKFMN-QGZVFWFLSA-N	0	3	348.918	3.491	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C[C@@H]2C=CCCC2)CC1	ZINC001093372605	1361582105	/nfs/dbraw/zinc/58/21/05/1361582105.db2.gz	FXBLMZLMYZIXRD-NQIIRXRSSA-N	0	3	340.511	3.459	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C2(C3CC3)CCC2)CC1	ZINC001093375556	1361585755	/nfs/dbraw/zinc/58/57/55/1361585755.db2.gz	YWMBTBGWUXXKRM-LJQANCHMSA-N	0	3	340.511	3.293	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@@H]2C[C@H]2C2CCC2)CC1	ZINC001093381709	1361593329	/nfs/dbraw/zinc/59/33/29/1361593329.db2.gz	SIBGDOBZTSHQBN-ZCNNSNEGSA-N	0	3	340.511	3.149	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1C[C@@H](CNCc2cc(F)ccc2C#N)[C@H](C)C1	ZINC001094086217	1361736204	/nfs/dbraw/zinc/73/62/04/1361736204.db2.gz	IOCRXZZFBRMCHB-IIDMSEBBSA-N	0	3	345.462	3.174	20	30		EGEDHN
Cc1ccc(C)c(CN2[C@@H]3CC[C@H]2[C@@H](NC(=O)c2c[nH]c(C#N)c2)C3)c1	ZINC001095329484	1362103767	/nfs/dbraw/zinc/10/37/67/1362103767.db2.gz	NHEKTWLNXVCEEH-AABGKKOBSA-N	0	3	348.450	3.039	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CC1=CCCCC1	ZINC001095432867	1362139413	/nfs/dbraw/zinc/13/94/13/1362139413.db2.gz	KPHBMASGUKEBGC-SLHNCBLASA-N	0	3	344.499	3.190	20	30		EGEDHN
COc1ccc(CN[C@@H]2CCN(C(=O)CC(C)=C(C)C)C2)cc1C#N	ZINC001184916479	1387561744	/nfs/dbraw/zinc/56/17/44/1387561744.db2.gz	AIHHILFTNFCPPZ-GOSISDBHSA-N	0	3	341.455	3.004	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@H]1CCOc3ccccc31)C2	ZINC001095868457	1362260581	/nfs/dbraw/zinc/26/05/81/1362260581.db2.gz	PDBIQYVHEMMMAX-FPAYPSAMSA-N	0	3	340.467	3.240	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCCF)CC[C@@H]1CNCc1cc(F)ccc1C#N	ZINC001184955288	1387571778	/nfs/dbraw/zinc/57/17/78/1387571778.db2.gz	CYSXORLQQGFGMT-GDBMZVCRSA-N	0	3	349.425	3.021	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CC1=CCCCC1	ZINC001096145964	1362405833	/nfs/dbraw/zinc/40/58/33/1362405833.db2.gz	LBFHCJDMRFXWES-DEPCRRQNSA-N	0	3	344.499	3.190	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cccnc1OCC(C)C)C2	ZINC001096374128	1362477961	/nfs/dbraw/zinc/47/79/61/1362477961.db2.gz	PUVPXYRDDJVVIW-NJAFHUGGSA-N	0	3	343.471	3.028	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H]1Cc3ccc(Cl)cc31)C2	ZINC001096460246	1362518467	/nfs/dbraw/zinc/51/84/67/1362518467.db2.gz	SWHGMZFKVWPKKY-BGTYHANMSA-N	0	3	330.859	3.277	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(N(C)C(C)C)cc1)C2	ZINC001096656404	1362618968	/nfs/dbraw/zinc/61/89/68/1362618968.db2.gz	LMCWDSFERRHKSQ-AABGKKOBSA-N	0	3	341.499	3.442	20	30		EGEDHN
Cc1cccc(C)c1CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(C#N)[nH]1)C2	ZINC001096971077	1362798927	/nfs/dbraw/zinc/79/89/27/1362798927.db2.gz	ATHYXZMRDQAXHD-AHRSYUTCSA-N	0	3	348.450	3.039	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1coc3cc(F)ccc13)C2	ZINC001097063406	1362830012	/nfs/dbraw/zinc/83/00/12/1362830012.db2.gz	JWXGRNZAVQJFAO-NXHRZFHOSA-N	0	3	342.414	3.412	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H](NCc2ccccc2N(C)C)C1	ZINC001185049192	1387596898	/nfs/dbraw/zinc/59/68/98/1387596898.db2.gz	JZRGYPDIMSUFLJ-FUHWJXTLSA-N	0	3	329.488	3.045	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](CNCc2ncc(C)s2)[C@@H](C)C1	ZINC001185060138	1387603569	/nfs/dbraw/zinc/60/35/69/1387603569.db2.gz	DRVJCVYWZHJWRI-HOCLYGCPSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccccc1-n1cccc1)C2	ZINC001097776470	1363118374	/nfs/dbraw/zinc/11/83/74/1363118374.db2.gz	ZRELFHIODZKZKJ-POAQFYNOSA-N	0	3	335.451	3.389	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1csc(C(C)(C)C)n1)C2	ZINC001098046714	1363206813	/nfs/dbraw/zinc/20/68/13/1363206813.db2.gz	ZAFJUAOMDQZUCG-OAGGEKHMSA-N	0	3	347.528	3.281	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(C(F)(F)F)cc1)C2	ZINC001098266560	1363278890	/nfs/dbraw/zinc/27/88/90/1363278890.db2.gz	BSXMBXFNVYWHNF-OAGGEKHMSA-N	0	3	336.357	3.064	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cccc(Cl)c1Cl)C2	ZINC001098273569	1363281242	/nfs/dbraw/zinc/28/12/42/1363281242.db2.gz	WJDBDABMLQUHFG-DFBGVHRSSA-N	0	3	337.250	3.352	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc(Cl)ccc1Cl)C2	ZINC001098273478	1363281427	/nfs/dbraw/zinc/28/14/27/1363281427.db2.gz	RDHUGSJOQNSVTB-WQVCFCJDSA-N	0	3	337.250	3.352	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)CC1CCCCC1)C[C@@H](C)O2	ZINC001098560135	1363376770	/nfs/dbraw/zinc/37/67/70/1363376770.db2.gz	QAVJAXAUOWYMEX-QGZVFWFLSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C(F)=C1CCCC1)C[C@@H](C)O2	ZINC001098586191	1363389624	/nfs/dbraw/zinc/38/96/24/1363389624.db2.gz	DTEOVQSBLVKOQE-OAHLLOKOSA-N	0	3	336.451	3.052	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)CC1(C)CCCC1)C[C@H](C)O2	ZINC001098596290	1363392307	/nfs/dbraw/zinc/39/23/07/1363392307.db2.gz	ONRQGDWZCGVLPT-KRWDZBQOSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C(C)(C)C(=C)Cl)C[C@H](C)O2	ZINC001098599892	1363393569	/nfs/dbraw/zinc/39/35/69/1363393569.db2.gz	NUUDSONYCPPDAH-AWEZNQCLSA-N	0	3	340.895	3.033	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1CCCC3(CC3)C1)C[C@@H](C)O2	ZINC001098600348	1363394190	/nfs/dbraw/zinc/39/41/90/1363394190.db2.gz	ZFJQARHLOBKVGQ-MSOLQXFVSA-N	0	3	346.515	3.225	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C(C)(C)C(C)(C)C)C[C@@H](C)O2	ZINC001098619523	1363401955	/nfs/dbraw/zinc/40/19/55/1363401955.db2.gz	GCUABPUQTVLRHJ-MRXNPFEDSA-N	0	3	336.520	3.327	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccc(CC)cc1)C[C@H](C)O2	ZINC001098660526	1363423575	/nfs/dbraw/zinc/42/35/75/1363423575.db2.gz	UYOMXBYRRRNBRD-KRWDZBQOSA-N	0	3	342.483	3.131	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3CCC[C@]3(NC(=O)c3ccccc3)C2)cc1	ZINC001098706789	1363442637	/nfs/dbraw/zinc/44/26/37/1363442637.db2.gz	PNQYABRUVMLZKY-UNMCSNQZSA-N	0	3	345.446	3.343	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccccc1F	ZINC001098849036	1363491576	/nfs/dbraw/zinc/49/15/76/1363491576.db2.gz	IQZMBDYOGNRFKN-INIZCTEOSA-N	0	3	348.462	3.249	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccsc1	ZINC001098867771	1363498204	/nfs/dbraw/zinc/49/82/04/1363498204.db2.gz	JKAVVNXHLJSJRT-INIZCTEOSA-N	0	3	336.501	3.171	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)C[C@H]1C=CCC1	ZINC001098890343	1363507287	/nfs/dbraw/zinc/50/72/87/1363507287.db2.gz	YDLGYJMONXWIBW-ROUUACIJSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(COC)cs2)C1	ZINC001098925904	1363523733	/nfs/dbraw/zinc/52/37/33/1363523733.db2.gz	INMIIGHWZULXGG-YJBOKZPZSA-N	0	3	334.485	3.055	20	30		EGEDHN
C=CCOCC(=O)NC[C@@H]1CCC(C)(C)CN1Cc1ccc(C)cc1	ZINC001098972282	1363548410	/nfs/dbraw/zinc/54/84/10/1363548410.db2.gz	ZAHBBLHWEIDYPY-IBGZPJMESA-N	0	3	344.499	3.304	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)Cc2c(C)[nH]c3ccccc32)C1	ZINC001099006601	1363567783	/nfs/dbraw/zinc/56/77/83/1363567783.db2.gz	MAZOBHOJMPUPON-JTSKRJEESA-N	0	3	349.478	3.013	20	30		EGEDHN
C#CCCCC(=O)NC[C@H]1CCC(C)(C)CN1CCc1ccns1	ZINC001099042831	1363589702	/nfs/dbraw/zinc/58/97/02/1363589702.db2.gz	CKTTVAIMKSZRGJ-MRXNPFEDSA-N	0	3	347.528	3.096	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NC[C@H]1CCC(C)(C)CN1CCOC	ZINC001099092665	1363617912	/nfs/dbraw/zinc/61/79/12/1363617912.db2.gz	ICFAIIXRFFUFST-CQSZACIVSA-N	0	3	330.900	3.018	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cnn(C(CC)CC)c2C)C1	ZINC001099112094	1363630023	/nfs/dbraw/zinc/63/00/23/1363630023.db2.gz	BTKRFNUVHJCUCN-JXFKEZNVSA-N	0	3	344.503	3.323	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)Cc2cccc3ccccc32)C1	ZINC001099131902	1363643926	/nfs/dbraw/zinc/64/39/26/1363643926.db2.gz	QZRVYMDYYTYEMK-REWPJTCUSA-N	0	3	346.474	3.376	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(N(CC)CC)cc2)C1	ZINC001099135367	1363646435	/nfs/dbraw/zinc/64/64/35/1363646435.db2.gz	UOJAHTYBXHAAHR-RXVVDRJESA-N	0	3	341.499	3.303	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H](C)c2ccc(F)cc2F)C1	ZINC001099169413	1363667769	/nfs/dbraw/zinc/66/77/69/1363667769.db2.gz	SUYKQQOCIKEDRV-TYILLQQXSA-N	0	3	334.410	3.225	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2cscc2C)C[C@H]1C(F)(F)F	ZINC001099235626	1363706292	/nfs/dbraw/zinc/70/62/92/1363706292.db2.gz	TUGRKYPHSYWDFS-CHWSQXEVSA-N	0	3	332.391	3.225	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@@H]2CC[C@@H]3C[C@@H]3CC2)C[C@H]1C(F)(F)F	ZINC001099283546	1363731645	/nfs/dbraw/zinc/73/16/45/1363731645.db2.gz	FJXFHEXMEYINSX-IBEHDNSVSA-N	0	3	344.421	3.368	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@]23C[C@H]2CCCC3)C[C@H]1C(F)(F)F	ZINC001099302785	1363739226	/nfs/dbraw/zinc/73/92/26/1363739226.db2.gz	BSNQUSHERRZAEG-IXYNUQLISA-N	0	3	330.394	3.122	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)Cc1ccc(OC)cc1	ZINC001099321414	1363749050	/nfs/dbraw/zinc/74/90/50/1363749050.db2.gz	WDEDHASNAMFMEN-QGZVFWFLSA-N	0	3	330.472	3.031	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)C[C@H]1OCc2ccccc21	ZINC001099321528	1363750026	/nfs/dbraw/zinc/75/00/26/1363750026.db2.gz	YETOTNXQZALHHH-PKOBYXMFSA-N	0	3	342.483	3.441	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)CCOc1ccccc1	ZINC001099339934	1363759787	/nfs/dbraw/zinc/75/97/87/1363759787.db2.gz	MOSOVTAZHNBJBR-KRWDZBQOSA-N	0	3	330.472	3.248	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@@H]2CC3CCC2CC3)C[C@H]1C(F)(F)F	ZINC001099345496	1363763204	/nfs/dbraw/zinc/76/32/04/1363763204.db2.gz	DEFPZMRAQUMOOC-KDQUWOQTSA-N	0	3	344.421	3.368	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)C2CCC(C)(C)CC2)C[C@H]1C(F)(F)F	ZINC001099347870	1363764183	/nfs/dbraw/zinc/76/41/83/1363764183.db2.gz	RCERURFOJOFXNR-ZIAGYGMSSA-N	0	3	332.410	3.368	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)Cc1csc(CC)n1	ZINC001099355056	1363769382	/nfs/dbraw/zinc/76/93/82/1363769382.db2.gz	XDMVOCPONPECEN-OAHLLOKOSA-N	0	3	335.517	3.041	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H](C)C1CCOCC1	ZINC001099379263	1363780459	/nfs/dbraw/zinc/78/04/59/1363780459.db2.gz	ILYQTJYMARWMCM-WMZOPIPTSA-N	0	3	336.520	3.232	20	30		EGEDHN
C/C=C(/C)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2ccccc2C#N)C1	ZINC001099407819	1363788804	/nfs/dbraw/zinc/78/88/04/1363788804.db2.gz	NTJJDLNROZQPQS-RSCPVLQJSA-N	0	3	337.467	3.243	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2cnc(C)o2)C1	ZINC001099488795	1363817465	/nfs/dbraw/zinc/81/74/65/1363817465.db2.gz	BYXXXDBQMAJBOM-DBVUQKKJSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)CCC(C)(F)F)C1	ZINC001099496176	1363821074	/nfs/dbraw/zinc/82/10/74/1363821074.db2.gz	INNIFWQQILUIGP-AJNGGQMLSA-N	0	3	346.849	3.343	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C=C(CC)CC)CC2(CCOCC2)C1	ZINC001099577220	1363860595	/nfs/dbraw/zinc/86/05/95/1363860595.db2.gz	UXUNCDJIMJATQM-SFHVURJKSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@H]1CN(CC(=C)C)CC2(CCOCC2)C1	ZINC001099588892	1363870663	/nfs/dbraw/zinc/87/06/63/1363870663.db2.gz	LKCLOSPDMXJDGO-ZWKOTPCHSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)C[C@@H](CC)C(C)C)CC2(CCOCC2)C1	ZINC001099596416	1363879393	/nfs/dbraw/zinc/87/93/93/1363879393.db2.gz	BKVRUJJECXHHIR-QZTJIDSGSA-N	0	3	336.520	3.232	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C(C)(C)CC(C)C)CC2(CCOCC2)C1	ZINC001099596881	1363879447	/nfs/dbraw/zinc/87/94/47/1363879447.db2.gz	OARQQQIXIPOCLR-GOSISDBHSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)C[C@H](C)CC(C)C)CC2(CCOCC2)C1	ZINC001099597016	1363880051	/nfs/dbraw/zinc/88/00/51/1363880051.db2.gz	QLVYQBGTMJKETE-QZTJIDSGSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CCN(Cc2ccc(CCC)cc2)C[C@@H]1O	ZINC001099858375	1363966190	/nfs/dbraw/zinc/96/61/90/1363966190.db2.gz	KXJPJSNUALWVQC-UXHICEINSA-N	0	3	344.499	3.047	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)CCCCC)C[C@H]1c1ccc(OC)cc1	ZINC001100152086	1364027939	/nfs/dbraw/zinc/02/79/39/1364027939.db2.gz	ZPBCPNVAEDHEQI-VQTJNVASSA-N	0	3	342.483	3.183	20	30		EGEDHN
CC(C)(C)/C=C\C(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1	ZINC001100192617	1364040836	/nfs/dbraw/zinc/04/08/36/1364040836.db2.gz	ILTGXSLNCDBBOA-SREVYHEPSA-N	0	3	343.446	3.284	20	30		EGEDHN
CC(C(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1)=C1CCC1	ZINC001100312506	1364077127	/nfs/dbraw/zinc/07/71/27/1364077127.db2.gz	QUPOUOHFDSGRCS-UHFFFAOYSA-N	0	3	341.430	3.182	20	30		EGEDHN
C[C@H](NC1CC(CNC(=O)C#CC2CC2)C1)c1cccc(Cl)c1F	ZINC001100314769	1364077712	/nfs/dbraw/zinc/07/77/12/1364077712.db2.gz	CUSSVDKVHSKTDS-GRTSSRMGSA-N	0	3	348.849	3.438	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C[C@@H](OCC)C2=CCCC2)C1	ZINC001100331092	1364081791	/nfs/dbraw/zinc/08/17/91/1364081791.db2.gz	VLUURDZLXMIYSR-BDVYOWHSSA-N	0	3	340.895	3.129	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H](CC)OC2CCCCC2)C1	ZINC001100331853	1364081926	/nfs/dbraw/zinc/08/19/26/1364081926.db2.gz	LONSEKNEHZFVPF-VMBOVVBDSA-N	0	3	342.911	3.351	20	30		EGEDHN
C[C@]1(C(=O)NCC2CC(NCC#Cc3ccccc3)C2)CC=CCC1	ZINC001100359734	1364090742	/nfs/dbraw/zinc/09/07/42/1364090742.db2.gz	KGCKKUPTLLSIBH-AOMIVXANSA-N	0	3	336.479	3.269	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1	ZINC001100364596	1364093224	/nfs/dbraw/zinc/09/32/24/1364093224.db2.gz	LHWDEJVRRRSKPL-UHFFFAOYSA-N	0	3	343.446	3.284	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NCC1CC(NCc2ccccc2F)C1	ZINC001100540731	1364152432	/nfs/dbraw/zinc/15/24/32/1364152432.db2.gz	RSMNDIJEONOUIP-MKJPBZQASA-N	0	3	348.462	3.039	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC1CC(NCc2c(C)nsc2C)C1	ZINC001100560894	1364162596	/nfs/dbraw/zinc/16/25/96/1364162596.db2.gz	PEGGWCLVTTVVBC-UHFFFAOYSA-N	0	3	335.517	3.347	20	30		EGEDHN
C=CC(C)(C)C(=O)NCC1CC(NCc2cc(F)ccc2OC)C1	ZINC001100568998	1364166327	/nfs/dbraw/zinc/16/63/27/1364166327.db2.gz	HUFHQICVJUFLHD-UHFFFAOYSA-N	0	3	334.435	3.031	20	30		EGEDHN
CCCC(C)(C)C(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100625499	1364194735	/nfs/dbraw/zinc/19/47/35/1364194735.db2.gz	JYSWRJJCWLXWGD-UHFFFAOYSA-N	0	3	326.484	3.349	20	30		EGEDHN
CCC(C)(C)C(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1	ZINC001100625829	1364194794	/nfs/dbraw/zinc/19/47/94/1364194794.db2.gz	ZBHMMPJCGDJNRJ-UHFFFAOYSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](N[C@H]2CCc3c2cc(F)cc3F)C1	ZINC001185304965	1387675946	/nfs/dbraw/zinc/67/59/46/1387675946.db2.gz	QRWBUZWFHYAVTL-KDOFPFPSSA-N	0	3	334.410	3.499	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@]2(C)CCc3ccccc3C2)C1	ZINC001101084199	1364406423	/nfs/dbraw/zinc/40/64/23/1364406423.db2.gz	LHMFRPOJFZTSLH-PKUWUEBNSA-N	0	3	346.902	3.419	20	30		EGEDHN
C=CCN1CC[C@@H](Oc2ccnc(CNC(=O)C[C@@H](C)CCC)c2)C1	ZINC001101090672	1364408511	/nfs/dbraw/zinc/40/85/11/1364408511.db2.gz	OQUOZEOFECYBQL-QFBILLFUSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=C(C)CN1CC[C@@H](Oc2ccnc(CNC(=O)[C@@H](C)C(C)C)c2)C1	ZINC001101097015	1364413039	/nfs/dbraw/zinc/41/30/39/1364413039.db2.gz	HBQRTMZEFBNJCG-QFBILLFUSA-N	0	3	345.487	3.019	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@H]2CN(Cc3c(C)noc3C)C[C@@]2(C)C1	ZINC001101251960	1364486396	/nfs/dbraw/zinc/48/63/96/1364486396.db2.gz	TYUKRRDRYPXGRS-UZLBHIALSA-N	0	3	345.487	3.174	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@H]2CN(Cc3c(C)noc3CC)C[C@@]2(C)C1	ZINC001101254120	1364487150	/nfs/dbraw/zinc/48/71/50/1364487150.db2.gz	AJEIXIJRMYGFOF-UZLBHIALSA-N	0	3	345.487	3.182	20	30		EGEDHN
C#CCC1(C(=O)N2C[C@H]3CN(Cc4ccsc4)C[C@@]3(C)C2)CCC1	ZINC001101266711	1364492352	/nfs/dbraw/zinc/49/23/52/1364492352.db2.gz	QESUFAFHCPEOQL-MJGOQNOKSA-N	0	3	342.508	3.222	20	30		EGEDHN
C=CCCC1(C(=O)N2C[C@H]3CN(Cc4cccnc4)C[C@@]3(C)C2)CC1	ZINC001101354000	1364524370	/nfs/dbraw/zinc/52/43/70/1364524370.db2.gz	KKRFIDZJZNGHLT-QUCCMNQESA-N	0	3	339.483	3.108	20	30		EGEDHN
CC(C)CCC(=O)NC[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1C	ZINC001101709475	1364698873	/nfs/dbraw/zinc/69/88/73/1364698873.db2.gz	DTCHLWGZPDAVKH-CRAIPNDOSA-N	0	3	345.462	3.318	20	30		EGEDHN
CCCCCC(=O)NC[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1C	ZINC001101723041	1364703858	/nfs/dbraw/zinc/70/38/58/1364703858.db2.gz	JUPCXVKHRYLLGS-CRAIPNDOSA-N	0	3	345.462	3.462	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1CNC(=O)CC(C)(C)C	ZINC001101725240	1364704319	/nfs/dbraw/zinc/70/43/19/1364704319.db2.gz	MYNRTAKVHGHWNM-RHSMWYFYSA-N	0	3	345.462	3.318	20	30		EGEDHN
C#CCCCC(=O)NC[C@@H]1CN(Cc2sccc2Cl)C[C@H]1C	ZINC001101921920	1364775982	/nfs/dbraw/zinc/77/59/82/1364775982.db2.gz	KNGNASONPPKBDV-ZIAGYGMSSA-N	0	3	338.904	3.389	20	30		EGEDHN
C[C@H](c1ccc(Cl)cc1)N1C[C@@H](CNC(=O)C#CC2CC2)[C@H](C)C1	ZINC001101954192	1364789107	/nfs/dbraw/zinc/78/91/07/1364789107.db2.gz	VDYCGPUEVKXMTM-IIDMSEBBSA-N	0	3	344.886	3.499	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H]1CN([C@H](C)c2cnc(C)cn2)C[C@H]1C	ZINC001102219812	1364941224	/nfs/dbraw/zinc/94/12/24/1364941224.db2.gz	XHEZROJIPLLBJC-DJIMGWMZSA-N	0	3	344.503	3.132	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@@H]1CN(Cc2cnc(C)s2)C[C@H]1C	ZINC001102261112	1364974175	/nfs/dbraw/zinc/97/41/75/1364974175.db2.gz	OOVCHYYHZSOKCA-IIAWOOMASA-N	0	3	335.517	3.238	20	30		EGEDHN
C=CCCC1(C(=O)NC[C@@H]2CN(Cc3cncs3)C[C@H]2C)CC1	ZINC001102328546	1365004416	/nfs/dbraw/zinc/00/44/16/1365004416.db2.gz	NOTOXCSOIBJSHI-HUUCEWRRSA-N	0	3	333.501	3.074	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@@H]1CN(Cc2conc2CC)C[C@H]1C	ZINC001102328776	1365004656	/nfs/dbraw/zinc/00/46/56/1365004656.db2.gz	XLXCYNIFTOFTQL-SPYBWZPUSA-N	0	3	333.476	3.023	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@H]2CN(Cc3c(C)nsc3C)C[C@H]2C)C1	ZINC001102347797	1365015302	/nfs/dbraw/zinc/01/53/02/1365015302.db2.gz	BMPLPXDAKVUPJG-CZUORRHYSA-N	0	3	347.528	3.300	20	30		EGEDHN
C[C@H](CC(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C)C1CC1	ZINC001102604141	1365132912	/nfs/dbraw/zinc/13/29/12/1365132912.db2.gz	KKLZVUWLWJEVSY-DBXWQHBBSA-N	0	3	338.495	3.158	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCC[C@@H]1CN(Cc2cc(C)no2)C[C@H]1C	ZINC001103033598	1365348388	/nfs/dbraw/zinc/34/83/88/1365348388.db2.gz	ULORQLDXLKLRST-GDBMZVCRSA-N	0	3	333.476	3.160	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CCNC(=O)CC1(C)CC1	ZINC001103244138	1365452876	/nfs/dbraw/zinc/45/28/76/1365452876.db2.gz	OKUWXHXPRMBJHH-HUUCEWRRSA-N	0	3	345.512	3.384	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2ccn(CC)c2C)C1	ZINC001103355458	1365516196	/nfs/dbraw/zinc/51/61/96/1365516196.db2.gz	ZTZFWMVWWCMRMV-CZUORRHYSA-N	0	3	337.895	3.257	20	30		EGEDHN
C=CCCCC(=O)NCC[C@@H]1CN(Cc2cncc(F)c2)C[C@H]1C	ZINC001103382559	1365526884	/nfs/dbraw/zinc/52/68/84/1365526884.db2.gz	MSINGWMCYDLUQH-NVXWUHKLSA-N	0	3	333.451	3.151	20	30		EGEDHN
C=CCC1(C(=O)NCC[C@@H]2CN(Cc3cncs3)C[C@H]2C)CCC1	ZINC001103404470	1365540109	/nfs/dbraw/zinc/54/01/09/1365540109.db2.gz	HDNCDXBRCQXJHF-HZPDHXFCSA-N	0	3	347.528	3.464	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2CC2)C[C@H]1CCNCc1cc(C#N)ccc1F	ZINC001103814482	1365794668	/nfs/dbraw/zinc/79/46/68/1365794668.db2.gz	BHICRBDPMGKGPU-RHSMWYFYSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](C)[C@H](CCNCc2cc(C)no2)C1	ZINC001104238511	1365965632	/nfs/dbraw/zinc/96/56/32/1365965632.db2.gz	HMVHFNXIBSAHJS-GDBMZVCRSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cc(Cl)cn2C)C[C@H]1C	ZINC001104401280	1366005972	/nfs/dbraw/zinc/00/59/72/1366005972.db2.gz	BUDQLUCHYWYKKE-DGCLKSJQSA-N	0	3	344.286	3.119	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)N1C[C@@H](C)[C@H](CCNCc2ccccc2C#N)C1	ZINC001104521028	1366060114	/nfs/dbraw/zinc/06/01/14/1366060114.db2.gz	PDOBFDDIVRHYFY-ATZDWAIDSA-N	0	3	345.462	3.127	20	30		EGEDHN
CC#CCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2oc(C)nc2C)C1	ZINC001104552837	1366072692	/nfs/dbraw/zinc/07/26/92/1366072692.db2.gz	PWVIYMBYHYAGHH-CRAIPNDOSA-N	0	3	345.487	3.059	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)[C@@H](CCC)OCC)C[C@H]1C	ZINC001104559134	1366074925	/nfs/dbraw/zinc/07/49/25/1366074925.db2.gz	LQRMSWVVDQBAMN-FVQBIDKESA-N	0	3	330.900	3.018	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2ccccc2C#N)C1	ZINC001104606914	1366099117	/nfs/dbraw/zinc/09/91/17/1366099117.db2.gz	GWGKIOZJFHFUIR-YLJYHZDGSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H](C)[C@H](CCNCc2cnoc2C)C1	ZINC001104631180	1366110047	/nfs/dbraw/zinc/11/00/47/1366110047.db2.gz	CXORYGRSVGHMHX-IDHHARJASA-N	0	3	333.476	3.160	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](C)[C@H](CCNCc3ocnc3C)C2)CCC1	ZINC001104639732	1366114925	/nfs/dbraw/zinc/11/49/25/1366114925.db2.gz	SZZYHNRTTJDHKV-NVXWUHKLSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)CC[C@H]2CCCCO2)C[C@H]1C	ZINC001104744302	1366154350	/nfs/dbraw/zinc/15/43/50/1366154350.db2.gz	GIGJTMCXLOEQDA-DJIMGWMZSA-N	0	3	342.911	3.162	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cccc3nc[nH]c32)C[C@H]1C	ZINC001104824673	1366190319	/nfs/dbraw/zinc/19/03/19/1366190319.db2.gz	DOEPPRPKBOYAER-TZMCWYRMSA-N	0	3	346.862	3.003	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)C2(F)CCCCC2)C[C@H]1C	ZINC001104870919	1366205240	/nfs/dbraw/zinc/20/52/40/1366205240.db2.gz	UPRJWTCOUBRTRX-UKRRQHHQSA-N	0	3	330.875	3.486	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2ccc(F)s2)C[C@H]1C	ZINC001105098719	1366327010	/nfs/dbraw/zinc/32/70/10/1366327010.db2.gz	PLRPZNNNVWBHBX-ZYHUDNBSSA-N	0	3	330.856	3.328	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@@H](C)CC(F)F)CC1	ZINC001105394246	1366443475	/nfs/dbraw/zinc/44/34/75/1366443475.db2.gz	RNSPUTQMSGZJHL-YOEHRIQHSA-N	0	3	338.442	3.004	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(c2ccccc2)C[C@H](NC(=O)C(C)(C)F)C1	ZINC001105401280	1366448583	/nfs/dbraw/zinc/44/85/83/1366448583.db2.gz	UDFIMPROMWQCHD-RHNCMZPLSA-N	0	3	338.854	3.293	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1C[C@@](CNCCF)(c2ccccc2)C1	ZINC001105431909	1366465367	/nfs/dbraw/zinc/46/53/67/1366465367.db2.gz	CBJZRHTZILYOOB-TYKWCNGQSA-N	0	3	344.474	3.346	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](CNCc2nc3ccc(F)cc3o2)[C@H](C)C1	ZINC001105923063	1366599377	/nfs/dbraw/zinc/59/93/77/1366599377.db2.gz	KWBCCBLOJDKBJA-ZIAGYGMSSA-N	0	3	345.418	3.117	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](CNCc2csc(C3CC3)n2)[C@H](C)C1	ZINC001106068595	1366609313	/nfs/dbraw/zinc/60/93/13/1366609313.db2.gz	JUGUQFRGXQPSOR-GDBMZVCRSA-N	0	3	345.512	3.008	20	30		EGEDHN
C=CCCCNCc1cn([C@H]2CCCN(C(=O)CCCCC)C2)nn1	ZINC001185872520	1387821764	/nfs/dbraw/zinc/82/17/64/1387821764.db2.gz	IZFQABTYVWGWGG-SFHVURJKSA-N	0	3	347.507	3.078	20	30		EGEDHN
C[C@@]1(CNC(=O)CCC2CC2)CCCN(Cc2cccc(C#N)c2)C1	ZINC001324921214	1387825451	/nfs/dbraw/zinc/82/54/51/1387825451.db2.gz	LVOGWFCJLJHIDB-NRFANRHFSA-N	0	3	339.483	3.467	20	30		EGEDHN
CC#CCCCC(=O)N1C[C@@H](CNCc2csc(CC)n2)[C@H](C)C1	ZINC001106556173	1366734164	/nfs/dbraw/zinc/73/41/64/1366734164.db2.gz	ISICUVYSALQQHR-HZPDHXFCSA-N	0	3	347.528	3.083	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001106567244	1366739238	/nfs/dbraw/zinc/73/92/38/1366739238.db2.gz	AXEORFCLVYOYJW-FUHIMQAGSA-N	0	3	339.483	3.345	20	30		EGEDHN
Cc1cc(N2CCN(C)[C@@H](C)[C@H]2C)n2c3ccccc3nc2c1C#N	ZINC001185967805	1387837893	/nfs/dbraw/zinc/83/78/93/1387837893.db2.gz	CCZWVXYIERNRRV-LSDHHAIUSA-N	0	3	333.439	3.196	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@]12CCC[C@H]1N(Cc1nccnc1C)CC2	ZINC001107424632	1366960320	/nfs/dbraw/zinc/96/03/20/1366960320.db2.gz	YTSDRMFAWMITRU-UYAOXDASSA-N	0	3	342.487	3.002	20	30		EGEDHN
CCC(CC)[C@@H](C)C(=O)NC[C@]12CCC[C@H]1N(CC#CCOC)CC2	ZINC001107458738	1366971295	/nfs/dbraw/zinc/97/12/95/1366971295.db2.gz	JRHDRGUHVWROGB-YFVAEKQCSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@]12CCC[C@H]1N(Cc1conc1C)CC2	ZINC001107515596	1367014129	/nfs/dbraw/zinc/01/41/29/1367014129.db2.gz	ZFDKLVKOXGLNAK-YVWKXTFCSA-N	0	3	345.487	3.446	20	30		EGEDHN
O=C(C#CC1CC1)N[C@H]1C[C@H]2CC[C@@H]1N2CC/C=C\c1ccccc1	ZINC001109257779	1367028889	/nfs/dbraw/zinc/02/88/89/1367028889.db2.gz	MSZNRUUYBHACQM-PTCVFLFUSA-N	0	3	334.463	3.225	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](N(C)Cc2ccc(CF)cc2)C1	ZINC001189707145	1367092231	/nfs/dbraw/zinc/09/22/31/1367092231.db2.gz	RDSAMYWPAQCEFO-LJQANCHMSA-N	0	3	330.447	3.382	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)[C@@H](F)CCCCCC)[C@@H]2C1	ZINC001189794871	1367110015	/nfs/dbraw/zinc/11/00/15/1367110015.db2.gz	ZBOLXGFZABGHQE-OKZBNKHCSA-N	0	3	340.483	3.030	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)COC/C=C/c1ccccc1)C2	ZINC001109440308	1367121702	/nfs/dbraw/zinc/12/17/02/1367121702.db2.gz	OAEVMSZQHUYILI-INRVHYOMSA-N	0	3	340.467	3.014	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3ccc(OCCCC)cc3)[C@@H]2C1	ZINC001190133338	1367180691	/nfs/dbraw/zinc/18/06/91/1367180691.db2.gz	JOPKSOKFGDLPIX-AZUAARDMSA-N	0	3	340.467	3.035	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)C(C)(C)C(=C)Cl)C1	ZINC001107971060	1367224594	/nfs/dbraw/zinc/22/45/94/1367224594.db2.gz	NHYFUDJACUUAMT-KSSFIOAISA-N	0	3	342.911	3.327	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](N(C)CCc2scnc2C)C1	ZINC001190354661	1367237581	/nfs/dbraw/zinc/23/75/81/1367237581.db2.gz	NFIIDUWZEDCPQY-QGZVFWFLSA-N	0	3	347.528	3.295	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](N(C)Cc2cccc(OC)c2)C1	ZINC001190398194	1367254168	/nfs/dbraw/zinc/25/41/68/1367254168.db2.gz	RYQYNHLNEOMZQO-KRWDZBQOSA-N	0	3	330.472	3.330	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccc(CO)cc1	ZINC001109635756	1367255547	/nfs/dbraw/zinc/25/55/47/1367255547.db2.gz	PYMWFUKYAPKSJQ-LDTOTXGLSA-N	0	3	342.483	3.003	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](N(C)C[C@H](O)c2ccc(CC)cc2)C1	ZINC001190429284	1367262942	/nfs/dbraw/zinc/26/29/42/1367262942.db2.gz	ZUKDMDLWIQAADF-PMACEKPBSA-N	0	3	344.499	3.171	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)C[C@H](C)CCc3ccccc3)[C@@H]2C1	ZINC001190440615	1367266415	/nfs/dbraw/zinc/26/64/15/1367266415.db2.gz	KJVYHVZMVXPEGN-YZGWKJHDSA-N	0	3	326.484	3.364	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)C(C)(C)C2CCC2)C1	ZINC001108101234	1367282680	/nfs/dbraw/zinc/28/26/80/1367282680.db2.gz	IWOMYMBVRWNTRM-JXFKEZNVSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2cc(F)ccc2C)C1	ZINC001108106966	1367285623	/nfs/dbraw/zinc/28/56/23/1367285623.db2.gz	MRMGLDQUXOCLQL-OXJNMPFZSA-N	0	3	348.462	3.310	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@@H](C)c1ccc(CC)cc1)C2	ZINC001109716233	1367291353	/nfs/dbraw/zinc/29/13/53/1367291353.db2.gz	YRVBDNVEMPOYKS-DBOLQNLKSA-N	0	3	338.495	3.487	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@H](N(C)C/C=C/c3ccccc3)C2)CCC1	ZINC001190595737	1367302976	/nfs/dbraw/zinc/30/29/76/1367302976.db2.gz	RYNCIDLTMRSJMT-OEMHODTASA-N	0	3	336.479	3.426	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@]2(C)CN(CC3CCCCC3)CCO2)C1	ZINC001108201717	1367341087	/nfs/dbraw/zinc/34/10/87/1367341087.db2.gz	QUACADDRBHZGFY-HXUWFJFHSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=CC1(CC(=O)N[C@H]2C[C@H]3CC[C@@H]2N3CCOCC)CCCCC1	ZINC001109829917	1367344875	/nfs/dbraw/zinc/34/48/75/1367344875.db2.gz	CEIMHCMJJRQSPS-SQNIBIBYSA-N	0	3	334.504	3.271	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2oc(CC)cc2C)C1	ZINC001108344271	1367402109	/nfs/dbraw/zinc/40/21/09/1367402109.db2.gz	KSBPPANCICUKIX-UZLBHIALSA-N	0	3	348.487	3.326	20	30		EGEDHN
C[C@@H](CC(C)(C)C)C(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001186111973	1387873115	/nfs/dbraw/zinc/87/31/15/1387873115.db2.gz	YRPOMOKMVDFPLA-WMLDXEAASA-N	0	3	345.462	3.460	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)C(C)(C)C(C)(F)F)C1	ZINC001108369229	1367418407	/nfs/dbraw/zinc/41/84/07/1367418407.db2.gz	NBHOJPAQYJCDBI-PBHICJAKSA-N	0	3	346.462	3.230	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3[C@@H](C)COC)CCCCC1	ZINC001110135968	1367518206	/nfs/dbraw/zinc/51/82/06/1367518206.db2.gz	YQLOTLMJUFXBTN-MHORFTMASA-N	0	3	334.504	3.269	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](N(C)CCOc2cccc(F)c2)C1	ZINC001191695973	1367563218	/nfs/dbraw/zinc/56/32/18/1367563218.db2.gz	MJCIMSIENYPVEC-KRWDZBQOSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](N(C)CCOC2CCCCCC2)C1	ZINC001191727786	1367571582	/nfs/dbraw/zinc/57/15/82/1367571582.db2.gz	PRVCNLAYAVBGBQ-QGZVFWFLSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](N(C)Cc2ccc3c(c2)COC3)C1	ZINC001191868194	1367620419	/nfs/dbraw/zinc/62/04/19/1367620419.db2.gz	PUWBIMAZDJPQDE-JXFKEZNVSA-N	0	3	342.483	3.352	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@@H](N(C)Cc2cccc(COC)c2)C1	ZINC001191867839	1367620915	/nfs/dbraw/zinc/62/09/15/1367620915.db2.gz	JMXMYZAOYFPFLX-YLJYHZDGSA-N	0	3	344.499	3.468	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@H](N(C)CCOCc2ccccc2)C1	ZINC001191890551	1367627680	/nfs/dbraw/zinc/62/76/80/1367627680.db2.gz	RPUQHYQVBZBHEI-ICSRJNTNSA-N	0	3	344.499	3.338	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H](N(C)CCc2scnc2C)C1	ZINC001191902931	1367630793	/nfs/dbraw/zinc/63/07/93/1367630793.db2.gz	UDQWRHMNIVUVKW-ZBFHGGJFSA-N	0	3	335.517	3.129	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](N(C)CCOc2cccc(F)c2)C1	ZINC001192058749	1367676802	/nfs/dbraw/zinc/67/68/02/1367676802.db2.gz	AFKKCXZLILQMRM-KRWDZBQOSA-N	0	3	334.435	3.094	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](N(C)Cc2cccc3nsnc32)C1	ZINC001192072754	1367679855	/nfs/dbraw/zinc/67/98/55/1367679855.db2.gz	KLEMGPGRFDKOKK-HNNXBMFYSA-N	0	3	344.484	3.080	20	30		EGEDHN
C=CCOCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccc(CCC)cc1	ZINC001110389534	1367684361	/nfs/dbraw/zinc/68/43/61/1367684361.db2.gz	XADJMDHNTWWTFI-AQNXPRMDSA-N	0	3	342.483	3.063	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](N(C)CCOc2ccccc2F)C1	ZINC001192092599	1367684856	/nfs/dbraw/zinc/68/48/56/1367684856.db2.gz	AKKZAASRRCQICV-INIZCTEOSA-N	0	3	334.435	3.094	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](N(C)CCOc2ccccc2F)C1	ZINC001192092601	1367685282	/nfs/dbraw/zinc/68/52/82/1367685282.db2.gz	AKKZAASRRCQICV-MRXNPFEDSA-N	0	3	334.435	3.094	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](N(C)CCOc2ccccc2C)C1	ZINC001192093766	1367686729	/nfs/dbraw/zinc/68/67/29/1367686729.db2.gz	MNGSALNXWMKNLE-GOSISDBHSA-N	0	3	330.472	3.263	20	30		EGEDHN
C=CCOCCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccc(C)cc1	ZINC001110424737	1367709108	/nfs/dbraw/zinc/70/91/08/1367709108.db2.gz	XDMIJOSHJHFNGK-AQNXPRMDSA-N	0	3	342.483	3.199	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](N(C)C[C@@H]3CC(C)(C)CO3)C2)CC1	ZINC001192217705	1367720561	/nfs/dbraw/zinc/72/05/61/1367720561.db2.gz	HYFVAGOFHIXAMF-SJORKVTESA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCCCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ncoc1CC)C2	ZINC001109097436	1367769215	/nfs/dbraw/zinc/76/92/15/1367769215.db2.gz	UIRTXOAWOPWCDZ-PMPSAXMXSA-N	0	3	331.460	3.319	20	30		EGEDHN
O=C(C#CC1CC1)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccc2ccccc2c1	ZINC001110540131	1367819849	/nfs/dbraw/zinc/81/98/49/1367819849.db2.gz	DKJSNSGQXDKNLQ-VSKRKVRLSA-N	0	3	344.458	3.475	20	30		EGEDHN
C=CCC[C@H](C)N1[C@@H]2CC[C@H]1[C@H](NC(=O)c1scnc1CC)C2	ZINC001110634495	1367878659	/nfs/dbraw/zinc/87/86/59/1367878659.db2.gz	JKECTECFRDBFNF-XNISGKROSA-N	0	3	333.501	3.395	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)c2csc(C)c2C)C1	ZINC001193231512	1367972243	/nfs/dbraw/zinc/97/22/43/1367972243.db2.gz	GTIXWXIYOYSXKY-IAGOWNOFSA-N	0	3	338.517	3.110	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2cccc3ccsc32)C1	ZINC001193245289	1367977569	/nfs/dbraw/zinc/97/75/69/1367977569.db2.gz	ZGTSHXAUUSZHEK-INIZCTEOSA-N	0	3	344.480	3.250	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2ccsc2C(F)F)C1	ZINC001193755087	1368108155	/nfs/dbraw/zinc/10/81/55/1368108155.db2.gz	FCPZESJSSOQFEM-GFCCVEGCSA-N	0	3	344.427	3.035	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1cccc(N(C)C)c1	ZINC001110964732	1368126958	/nfs/dbraw/zinc/12/69/58/1368126958.db2.gz	YJHRMKJHFBLHJH-AQNXPRMDSA-N	0	3	341.499	3.330	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CC1CC(F)(F)C1	ZINC001110984407	1368132327	/nfs/dbraw/zinc/13/23/27/1368132327.db2.gz	GMKWJBIZQOIJQI-PNBKFKSVSA-N	0	3	326.431	3.356	20	30		EGEDHN
C=CC[C@H](C(=O)N1CC[C@H](N(C)CCOC(C)C)C1)c1ccccc1	ZINC001194173802	1368198175	/nfs/dbraw/zinc/19/81/75/1368198175.db2.gz	FJWYRRJOSHCOAJ-PMACEKPBSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](N(C)CCOCC3CCC3)C2)CCCC1	ZINC001194555543	1368285795	/nfs/dbraw/zinc/28/57/95/1368285795.db2.gz	NDXZWSBOCBLMBE-LJQANCHMSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](C)Cc1ccc(C)cc1)C2	ZINC001111475915	1368316077	/nfs/dbraw/zinc/31/60/77/1368316077.db2.gz	KFERKKOVCSBAPA-NBYUQASBSA-N	0	3	326.484	3.471	20	30		EGEDHN
C=CCC[C@@H](C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCOC)c1ccccc1	ZINC001111521313	1368324776	/nfs/dbraw/zinc/32/47/76/1368324776.db2.gz	TVVVZAVLHQVCFK-WTGUMLROSA-N	0	3	342.483	3.104	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@](C)(F)CCCC)C[C@H](C)O2	ZINC001111546121	1368339382	/nfs/dbraw/zinc/33/93/82/1368339382.db2.gz	XWWKZHDHLBGSII-FUHWJXTLSA-N	0	3	340.483	3.173	20	30		EGEDHN
C/C(=C/C(=O)N[C@]12CCC[C@H]1CN(Cc1cccc(C#N)c1)C2)C1CC1	ZINC001111625931	1368386695	/nfs/dbraw/zinc/38/66/95/1368386695.db2.gz	KDSJVVIEHQRKJC-TVJXKUOFSA-N	0	3	349.478	3.385	20	30		EGEDHN
CC/C=C(\C)C(=O)N[C@]12CCC[C@H]1CN(Cc1cccc(C#N)c1)C2	ZINC001111632729	1368395190	/nfs/dbraw/zinc/39/51/90/1368395190.db2.gz	XOPRQZKGKGXUTO-YYLCNAHCSA-N	0	3	337.467	3.385	20	30		EGEDHN
C=CCOCCCC(=O)N1CCCN(Cc2ccc(C)c(C)c2)CC1	ZINC001195452080	1368439219	/nfs/dbraw/zinc/43/92/19/1368439219.db2.gz	MMRBTNQTQUUINQ-UHFFFAOYSA-N	0	3	344.499	3.321	20	30		EGEDHN
C=C(C)CCC(=O)N[C@]12CCC[C@H]1CN(Cc1cccnc1C)C2	ZINC001111763695	1368450493	/nfs/dbraw/zinc/45/04/93/1368450493.db2.gz	CQCHGDLSGBXRGM-ICSRJNTNSA-N	0	3	327.472	3.217	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)C/C=C/c2cccc(F)c2)C1	ZINC001111779542	1368457977	/nfs/dbraw/zinc/45/79/77/1368457977.db2.gz	CIJWNVHYCLGNPC-NLOMCHEHSA-N	0	3	340.442	3.223	20	30		EGEDHN
CC#CCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1ncccc1C)C2	ZINC001111846114	1368500027	/nfs/dbraw/zinc/50/00/27/1368500027.db2.gz	QZHKHSCPBLFIIE-RXVVDRJESA-N	0	3	339.483	3.054	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2ccnn2CCC)CC1	ZINC001195974418	1368526413	/nfs/dbraw/zinc/52/64/13/1368526413.db2.gz	IGRYLPIPOQDXJC-UHFFFAOYSA-N	0	3	332.492	3.187	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H](CC)Cc2ccccc2)C1	ZINC001111889152	1368534116	/nfs/dbraw/zinc/53/41/16/1368534116.db2.gz	YPKWXOBNCBCVBI-ONTIZHBOSA-N	0	3	338.495	3.249	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2ncc(F)cc2F)CC1	ZINC001196295754	1368585424	/nfs/dbraw/zinc/58/54/24/1368585424.db2.gz	RCNWGPWSDNTYPG-UHFFFAOYSA-N	0	3	337.414	3.254	20	30		EGEDHN
CC[C@@H](F)CN1C[C@@H]2CCC[C@]2(NC(=O)CC#Cc2ccccc2)C1	ZINC001111999363	1368603708	/nfs/dbraw/zinc/60/37/08/1368603708.db2.gz	FQGIVOAJXOYVQV-ZVDOUQERSA-N	0	3	342.458	3.147	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2ccnc(OC)c2)CC1	ZINC001196394633	1368606449	/nfs/dbraw/zinc/60/64/49/1368606449.db2.gz	FMZZHROQZANWPY-UHFFFAOYSA-N	0	3	333.476	3.209	20	30		EGEDHN
C=CCC[C@@H](C)N1CCCN(C(=O)c2cc(COC)cs2)CC1	ZINC001196423478	1368613068	/nfs/dbraw/zinc/61/30/68/1368613068.db2.gz	LOMBVEHTABYSCI-OAHLLOKOSA-N	0	3	336.501	3.397	20	30		EGEDHN
CC1(C)C[C@@]1(NC[C@H](O)COc1ccccc1C#N)c1ccccc1	ZINC001196460459	1368619886	/nfs/dbraw/zinc/61/98/86/1368619886.db2.gz	ZMESSLMTIWRIFR-GHTZIAJQSA-N	0	3	336.435	3.213	20	30		EGEDHN
C=CCCCN1C[C@@H](O)[C@H](NC(=O)[C@@H](CCC)CC2CCCC2)C1	ZINC001196623318	1368651110	/nfs/dbraw/zinc/65/11/10/1368651110.db2.gz	IJVDSLPXWPFVBS-IPMKNSEASA-N	0	3	336.520	3.111	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2ccc(C(F)(F)F)cn2)CC1	ZINC001196696763	1368665259	/nfs/dbraw/zinc/66/52/59/1368665259.db2.gz	CEGMFPGRNBKJTF-UHFFFAOYSA-N	0	3	341.377	3.215	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)N1CCCN(CCCOc2ccccc2)CC1	ZINC001196829679	1368692938	/nfs/dbraw/zinc/69/29/38/1368692938.db2.gz	HIRIQBXBEXQJSG-OALUTQOASA-N	0	3	344.499	3.448	20	30		EGEDHN
C=CCCC[NH2+]C[C@]12CCC[C@H]1CN(C(=O)c1ccccc1[O-])C2	ZINC001112259429	1368736939	/nfs/dbraw/zinc/73/69/39/1368736939.db2.gz	GHBONAUWTOTWIB-JXFKEZNVSA-N	0	3	328.456	3.190	20	30		EGEDHN
C#CCOc1ccc(C(=O)N2CCCN(CC/C=C/CC)CC2)cc1	ZINC001197369861	1368799539	/nfs/dbraw/zinc/79/95/39/1368799539.db2.gz	MIJKLTJQHJWNIX-AATRIKPKSA-N	0	3	340.467	3.203	20	30		EGEDHN
C=CC1(CC(=O)N2CCCN(CCCOCC)CC2)CCCCC1	ZINC001197418971	1368810460	/nfs/dbraw/zinc/81/04/60/1368810460.db2.gz	YZOWJSBWRURUEX-UHFFFAOYSA-N	0	3	336.520	3.474	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@@H]2CCC[C@]2(CNCc2cscn2)C1	ZINC001112514715	1368909274	/nfs/dbraw/zinc/90/92/74/1368909274.db2.gz	GCSIJENZOBGGKW-BXWFABGCSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2ocnc2C)C1	ZINC001112515360	1368909858	/nfs/dbraw/zinc/90/98/58/1368909858.db2.gz	GHZPSIBNCVGENA-KNBMTAEXSA-N	0	3	345.487	3.304	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)c2cccc(Cl)c2)C1	ZINC001198061271	1368951915	/nfs/dbraw/zinc/95/19/15/1368951915.db2.gz	CBONXCYFAWFMLV-IAGOWNOFSA-N	0	3	338.879	3.085	20	30		EGEDHN
CCCCCCCC[C@@H](C)C(=O)N1CCCN(C[C@@H](C)O)CC1	ZINC001198197570	1368979137	/nfs/dbraw/zinc/97/91/37/1368979137.db2.gz	PZLPRRJYENZNDZ-QZTJIDSGSA-N	0	3	326.525	3.288	20	30		EGEDHN
C=C[C@H](CC(=O)N1CCCN(CCCOCC)CC1)c1ccccc1	ZINC001198214848	1368982146	/nfs/dbraw/zinc/98/21/46/1368982146.db2.gz	VOHSTXKIWZVLGX-LJQANCHMSA-N	0	3	344.499	3.307	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)c1ccsc1)c1ccccc1OC	ZINC001198522492	1369052048	/nfs/dbraw/zinc/05/20/48/1369052048.db2.gz	MEYAVZFSNAGHLY-INIZCTEOSA-N	0	3	330.453	3.394	20	30		EGEDHN
C=CCC[C@@H](C)N[C@@H](CNC(=O)c1ccon1)c1ccccc1OC	ZINC001198577023	1369064162	/nfs/dbraw/zinc/06/41/62/1369064162.db2.gz	HCUPFEMWSPWGLO-PBHICJAKSA-N	0	3	343.427	3.099	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@H](C)CSC)c1ccccc1OC	ZINC001198618281	1369074811	/nfs/dbraw/zinc/07/48/11/1369074811.db2.gz	XQQYXQCDPOLEGX-ZBFHGGJFSA-N	0	3	336.501	3.017	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)[C@@H](C)C1CC1)c1ccccc1OC	ZINC001198647885	1369081666	/nfs/dbraw/zinc/08/16/66/1369081666.db2.gz	RCYYFOZLBYSJDQ-YJBOKZPZSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)COC(C)(C)C)c1ccccc1OC	ZINC001198677790	1369089423	/nfs/dbraw/zinc/08/94/23/1369089423.db2.gz	SVJCKWZARSPUNT-QGZVFWFLSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@H](OCC)C(C)C)c1ccccc1OC	ZINC001198724135	1369100447	/nfs/dbraw/zinc/10/04/47/1369100447.db2.gz	PXFXVWLJMIESFN-PKOBYXMFSA-N	0	3	348.487	3.079	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@@H]1CCC1(F)F)c1ccccc1OC	ZINC001198766651	1369108563	/nfs/dbraw/zinc/10/85/63/1369108563.db2.gz	FNPLFADCHPFQFX-LSDHHAIUSA-N	0	3	338.398	3.064	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)Cc2ccc3cccnc3c2)CC1	ZINC001113001293	1369130794	/nfs/dbraw/zinc/13/07/94/1369130794.db2.gz	QZFMWZRBYOXUIE-QGZVFWFLSA-N	0	3	337.467	3.276	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@H](NCCCOC)c1ccccc1OC	ZINC001198857712	1369132805	/nfs/dbraw/zinc/13/28/05/1369132805.db2.gz	WHALFHHNKFQGMT-WMZOPIPTSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)Cc1occc1C)c1ccccc1OC	ZINC001198895881	1369143186	/nfs/dbraw/zinc/14/31/86/1369143186.db2.gz	XIHBHTXFRQPAFH-KRWDZBQOSA-N	0	3	342.439	3.162	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)[C@@H]1C[C@H]1CC)c1ccccc1OC	ZINC001198908888	1369146910	/nfs/dbraw/zinc/14/69/10/1369146910.db2.gz	PNKKVRYJSLIBQH-KBAYOESNSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H](O)[C@H](NC(=O)c2sccc2C(C)C)C1	ZINC001198990129	1369166626	/nfs/dbraw/zinc/16/66/26/1369166626.db2.gz	PGQDUTLPXCJLMQ-NUEKZKHPSA-N	0	3	336.501	3.001	20	30		EGEDHN
C=CCCOCC(=O)NC[C@@H](NCCC(=C)C)c1ccccc1OC	ZINC001199001251	1369169256	/nfs/dbraw/zinc/16/92/56/1369169256.db2.gz	CMVQKHQQUQYRDG-GOSISDBHSA-N	0	3	346.471	3.001	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H](O)[C@H](NC(=O)c2ccc(C(C)C)s2)C1	ZINC001199211108	1369192172	/nfs/dbraw/zinc/19/21/72/1369192172.db2.gz	UDPNDNZFYBUATP-RRFJBIMHSA-N	0	3	336.501	3.001	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)c2coc3ccccc23)C1	ZINC001199422752	1369223116	/nfs/dbraw/zinc/22/31/16/1369223116.db2.gz	SSTDTDVYFSIBAU-QZTJIDSGSA-N	0	3	344.455	3.178	20	30		EGEDHN
CC(C)C[C@@H](C)C(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001186652723	1387994542	/nfs/dbraw/zinc/99/45/42/1387994542.db2.gz	PPGNSYCELCPBNJ-RHSMWYFYSA-N	0	3	331.435	3.070	20	30		EGEDHN
C=CCCN(Cc1ccccc1)C(=S)NCCN1CCCCC1	ZINC001200425576	1369364706	/nfs/dbraw/zinc/36/47/06/1369364706.db2.gz	IFQSMWHQLRBTOQ-UHFFFAOYSA-N	0	3	331.529	3.425	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)Cc2c[nH]c3ccc(F)cc23)CC1	ZINC001113380115	1369380212	/nfs/dbraw/zinc/38/02/12/1369380212.db2.gz	ATECWUOTYSZREM-HNNXBMFYSA-N	0	3	343.446	3.348	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)Cc2ccc(Cl)s2)CC1	ZINC001113411132	1369408538	/nfs/dbraw/zinc/40/85/38/1369408538.db2.gz	HCHNSMODIAUZKZ-ZDUSSCGKSA-N	0	3	326.893	3.443	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC(NCc2nc3ccccc3n2C)CC1	ZINC001200815495	1369432963	/nfs/dbraw/zinc/43/29/63/1369432963.db2.gz	HPFBRXTYOTYZIL-UHFFFAOYSA-N	0	3	340.471	3.010	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)Cc2c(C)nn(C(C)C)c2C)CC1	ZINC001113519848	1369475159	/nfs/dbraw/zinc/47/51/59/1369475159.db2.gz	ACRHXNYOWYDJGS-MRXNPFEDSA-N	0	3	346.519	3.122	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)C[C@@H]2OCCc3ccsc32)CC1	ZINC001113559524	1369493028	/nfs/dbraw/zinc/49/30/28/1369493028.db2.gz	XLUKDFNBDKCHHC-RDJZCZTQSA-N	0	3	348.512	3.251	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)C[C@@H]2CCC3(CCC3)CO2)CC1	ZINC001113569698	1369497096	/nfs/dbraw/zinc/49/70/96/1369497096.db2.gz	SOWRFKGSMCPQLZ-MSOLQXFVSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)C[C@@H]2OCc3ccccc32)CC1	ZINC001113591938	1369505092	/nfs/dbraw/zinc/50/50/92/1369505092.db2.gz	SGQADCLRQSHGAY-LPHOPBHVSA-N	0	3	328.456	3.147	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)CCOc2ccccc2F)CC1	ZINC001113603494	1369512895	/nfs/dbraw/zinc/51/28/95/1369512895.db2.gz	JKSQCFDTIMTZBO-MRXNPFEDSA-N	0	3	334.435	3.094	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)CCCOc2ccccc2)CC1	ZINC001113606477	1369515588	/nfs/dbraw/zinc/51/55/88/1369515588.db2.gz	OTLYVVQCLDHYMO-GOSISDBHSA-N	0	3	330.472	3.345	20	30		EGEDHN
C#CC[C@H](CC(=O)N1CCN(C[C@H](C)CC)CC1)c1ccccc1	ZINC001113736623	1369595916	/nfs/dbraw/zinc/59/59/16/1369595916.db2.gz	MDTUZBVVFJGOLK-UYAOXDASSA-N	0	3	326.484	3.374	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)N1CCC(NCc2nc3ccccc3o2)CC1	ZINC001202092063	1369685818	/nfs/dbraw/zinc/68/58/18/1369685818.db2.gz	GZXCVHKZIOGKNT-HUUCEWRRSA-N	0	3	341.455	3.367	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1[C@H]2CN(Cc3cccc(OCC(C)C)c3)C[C@H]21	ZINC001114026022	1369690565	/nfs/dbraw/zinc/69/05/65/1369690565.db2.gz	UWDJWPLKGDGWAG-KXTWHKPSSA-N	0	3	342.483	3.234	20	30		EGEDHN
CC#CCNC[C@H]1CN(C(=O)[C@](C)(CC)CCCCC)CCCO1	ZINC001202174121	1369706953	/nfs/dbraw/zinc/70/69/53/1369706953.db2.gz	QNIBWBFYDDWFHD-AZUAARDMSA-N	0	3	336.520	3.213	20	30		EGEDHN
O=C(N[C@@H]1C[C@H](NCC#Cc2ccccc2Cl)C12CCC2)C1CC1	ZINC001202282273	1369729284	/nfs/dbraw/zinc/72/92/84/1369729284.db2.gz	ZVPLXOCGAYEHCV-ZWKOTPCHSA-N	0	3	342.870	3.119	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC(N[C@H](C)c3cnc(C)cn3)CC2)CC1	ZINC001202365223	1369751373	/nfs/dbraw/zinc/75/13/73/1369751373.db2.gz	LBCNPWIRRFSTMI-MRXNPFEDSA-N	0	3	342.487	3.173	20	30		EGEDHN
CCCCC(=O)N[C@H]1C[C@@H](NCC#Cc2ccc(F)cc2)C12CCC2	ZINC001202488084	1369787981	/nfs/dbraw/zinc/78/79/81/1369787981.db2.gz	FCMIFOWKTBBWKC-MOPGFXCFSA-N	0	3	342.458	3.384	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@@H]1[C@H]2CN(Cc3cc4ccccc4o3)C[C@H]21	ZINC001114260416	1369835095	/nfs/dbraw/zinc/83/50/95/1369835095.db2.gz	NFMVFPVIJNRLJS-YRWFTTLQSA-N	0	3	336.435	3.029	20	30		EGEDHN
O=C(N[C@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2)C1CC=CC1	ZINC001202644335	1369836259	/nfs/dbraw/zinc/83/62/59/1369836259.db2.gz	UTWZDFLERLONRX-UXHICEINSA-N	0	3	334.463	3.021	20	30		EGEDHN
CCCC[C@H](CNc1cccc(F)c1C#N)NC(=O)[C@H](CC)N(C)C	ZINC001114272098	1369841789	/nfs/dbraw/zinc/84/17/89/1369841789.db2.gz	JMEVDEQPCBHRKG-KDOFPFPSSA-N	0	3	348.466	3.124	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(CF)cc3)C[C@H]21	ZINC001114319911	1369881546	/nfs/dbraw/zinc/88/15/46/1369881546.db2.gz	PWXDDXFVHLIJQR-PMOLBWCYSA-N	0	3	342.458	3.471	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2[C@H]3CN([C@H](C)c4ccc(F)cc4)C[C@H]32)CCC1	ZINC001114397844	1369932291	/nfs/dbraw/zinc/93/22/91/1369932291.db2.gz	SWSYJLLWWSSWDK-OAOYMFHYSA-N	0	3	340.442	3.127	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1C[C@@H](NCc2oc(C)nc2C)C12CCC2	ZINC001202968140	1369940107	/nfs/dbraw/zinc/94/01/07/1369940107.db2.gz	JHYKKXRPZWHJOU-SJORKVTESA-N	0	3	345.487	3.411	20	30		EGEDHN
CCC(CC)[C@H](C)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001114498859	1369975451	/nfs/dbraw/zinc/97/54/51/1369975451.db2.gz	GQQKEUDSQOUCDR-VVHHDAOASA-N	0	3	339.483	3.177	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1[C@H]2CN(Cc3cc4ccccc4o3)C[C@H]21	ZINC001114711383	1370040218	/nfs/dbraw/zinc/04/02/18/1370040218.db2.gz	UBUUPBNYOABKLR-WGMWDUQUSA-N	0	3	336.435	3.173	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1[C@H]2CN(Cc3cc(C)ccc3OC)C[C@H]21	ZINC001114719616	1370044419	/nfs/dbraw/zinc/04/44/19/1370044419.db2.gz	JDHMSEXHAFFLBW-DZKDUJFISA-N	0	3	342.483	3.152	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1C[C@H](NCc2conc2CC)C12CCC2	ZINC001203259629	1370045679	/nfs/dbraw/zinc/04/56/79/1370045679.db2.gz	XTSSKRMNLNDNPF-DLBZAZTESA-N	0	3	345.487	3.356	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1C[C@H](NCc2c(C)noc2C)C12CCC2	ZINC001203272070	1370053223	/nfs/dbraw/zinc/05/32/23/1370053223.db2.gz	ASMGRLPGTONRPY-HOTGVXAUSA-N	0	3	331.460	3.021	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1C[C@@H](NCc2ccncc2Cl)C12CCC2	ZINC001203273252	1370054136	/nfs/dbraw/zinc/05/41/36/1370054136.db2.gz	HUSGXMSISUJNHH-HZPDHXFCSA-N	0	3	347.890	3.464	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1C[C@@H](NCc2conc2C)C12CCC2	ZINC001203295265	1370067476	/nfs/dbraw/zinc/06/74/76/1370067476.db2.gz	JCXSVHRXQVRAKX-MSOLQXFVSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)CC(F)(F)C(F)F)C12CCC2	ZINC001203418483	1370117770	/nfs/dbraw/zinc/11/77/70/1370117770.db2.gz	HQEULMTXWFIWNA-ZJUUUORDSA-N	0	3	342.764	3.046	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(CF)cc3)C[C@H]21	ZINC001114898937	1370137394	/nfs/dbraw/zinc/13/73/94/1370137394.db2.gz	JGCUWLOXCBAGFL-PIIMJCKOSA-N	0	3	330.447	3.305	20	30		EGEDHN
C=CCO[C@@H]1CO[C@]2(C1)CCCN(Cc1ccccc1OCC)C2	ZINC001203542250	1370162006	/nfs/dbraw/zinc/16/20/06/1370162006.db2.gz	JUWDQASZRBAIJL-ICSRJNTNSA-N	0	3	331.456	3.411	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)CCCCCOCC)C12CCC2	ZINC001203804423	1370271467	/nfs/dbraw/zinc/27/14/67/1370271467.db2.gz	SXQQUUOFPFKULQ-HOTGVXAUSA-N	0	3	342.911	3.353	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CC2)C(=O)NC[C@H]3c2ccccc2)cc1	ZINC001203901466	1370306812	/nfs/dbraw/zinc/30/68/12/1370306812.db2.gz	NIGUXZDYGAPPGT-FQEVSTJZSA-N	0	3	345.446	3.054	20	30		EGEDHN
CCCCCCCCC(=O)N[C@@H]1[C@H]2CN(CCc3ccns3)C[C@H]21	ZINC001115165230	1370323211	/nfs/dbraw/zinc/32/32/11/1370323211.db2.gz	DEGQOIIIHPXMEQ-DZFIZOCASA-N	0	3	349.544	3.483	20	30		EGEDHN
CCCC(=O)NCC1(NCc2ccc(C#N)cc2F)CCCCC1	ZINC001115381630	1370420572	/nfs/dbraw/zinc/42/05/72/1370420572.db2.gz	FQGZXSTUUOTRPP-UHFFFAOYSA-N	0	3	331.435	3.406	20	30		EGEDHN
C=CCOc1ccc(CN2CCCN(Cc3ccncc3)CC2)cc1	ZINC001204297156	1370435463	/nfs/dbraw/zinc/43/54/63/1370435463.db2.gz	DHWFXVYGUSUOJT-UHFFFAOYSA-N	0	3	337.467	3.354	20	30		EGEDHN
C=CCOc1ccc(CN2CC[C@]3(CCCN3C(=O)C(C)C)C2)cc1	ZINC001204300183	1370436647	/nfs/dbraw/zinc/43/66/47/1370436647.db2.gz	MKCYTZPDIZLZTE-OAQYLSRUSA-N	0	3	342.483	3.474	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCC1(NCc2cc(F)ccc2F)CCCCC1	ZINC001115451812	1370459326	/nfs/dbraw/zinc/45/93/26/1370459326.db2.gz	HDNNMAMXSNUZDJ-ZDUSSCGKSA-N	0	3	335.398	3.033	20	30		EGEDHN
Cc1nc(C(C)C)oc1CNC1(CNC(=O)[C@@H](C)C#N)CCCCC1	ZINC001115451862	1370459435	/nfs/dbraw/zinc/45/94/35/1370459435.db2.gz	JIJSBBLEQQBROP-AWEZNQCLSA-N	0	3	346.475	3.175	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CCC(F)(F)F)CCCCC1	ZINC001115463280	1370467301	/nfs/dbraw/zinc/46/73/01/1370467301.db2.gz	ITSSEHUNGLTYOA-UHFFFAOYSA-N	0	3	326.790	3.490	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H]2CN([C@H]3CCc4c3c(F)ccc4F)C[C@H]21	ZINC001187232746	1388077885	/nfs/dbraw/zinc/07/78/85/1388077885.db2.gz	HQYSGEWGJIOPFF-DOPJRALCSA-N	0	3	346.421	3.451	20	30		EGEDHN
CN1CCN(Cc2ccc(Nc3ccc(C#N)c(F)c3F)cc2)CC1	ZINC001204751236	1370565705	/nfs/dbraw/zinc/56/57/05/1370565705.db2.gz	NEUCIWOVUDYIHK-UHFFFAOYSA-N	0	3	342.393	3.327	20	30		EGEDHN
C#CCC1(C(=O)NCC2(NCc3cnoc3C)CCCCC2)CCC1	ZINC001115567494	1370568293	/nfs/dbraw/zinc/56/82/93/1370568293.db2.gz	JSCFZSWLFWGIKI-UHFFFAOYSA-N	0	3	343.471	3.085	20	30		EGEDHN
CC[C@H](F)C(=O)NCC1(NCC#Cc2ccc(F)cc2)CCCCC1	ZINC001115669111	1370650380	/nfs/dbraw/zinc/65/03/80/1370650380.db2.gz	OATAJGIBNKZNDQ-SFHVURJKSA-N	0	3	348.437	3.334	20	30		EGEDHN
CN(C)Cc1ccc(C(=O)Nc2sc3c(c2C#N)CCC3)cc1	ZINC001187277865	1388085888	/nfs/dbraw/zinc/08/58/88/1388085888.db2.gz	OMSYMIAVWQUYHU-UHFFFAOYSA-N	0	3	325.437	3.422	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCC1(NCc2cnc(C)nc2)CCCCC1	ZINC001115679462	1370661675	/nfs/dbraw/zinc/66/16/75/1370661675.db2.gz	FMSDBKKMVFCNBI-CVEARBPZSA-N	0	3	344.503	3.152	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCC1(NCc2nccnc2C)CCCCC1	ZINC001115679621	1370662460	/nfs/dbraw/zinc/66/24/60/1370662460.db2.gz	KMGJUHWZZOHNRS-JKSUJKDBSA-N	0	3	344.503	3.152	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCC1(NCc2conc2C)CCCCC1	ZINC001115684617	1370666872	/nfs/dbraw/zinc/66/68/72/1370666872.db2.gz	BAVXYQKETQIFQR-OAHLLOKOSA-N	0	3	333.476	3.494	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H]2CCC[C@@H](OC)C2)CCCCC1	ZINC001115697502	1370678622	/nfs/dbraw/zinc/67/86/22/1370678622.db2.gz	FLZNURZNXAJWTN-HZPDHXFCSA-N	0	3	342.911	3.353	20	30		EGEDHN
CCCc1nc(CNCC2CCN(C(=O)C#CC(C)C)CC2)cs1	ZINC001205210086	1370681161	/nfs/dbraw/zinc/68/11/61/1370681161.db2.gz	CYJDSOYSTDLSQW-UHFFFAOYSA-N	0	3	347.528	3.083	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC2(NCc3cc(C)ncn3)CCCCC2)C1	ZINC001115723261	1370701749	/nfs/dbraw/zinc/70/17/49/1370701749.db2.gz	HQKGVFNSFAZQFJ-UHFFFAOYSA-N	0	3	342.487	3.050	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC2(NCc3nccnc3C)CCCCC2)C1	ZINC001115723500	1370702594	/nfs/dbraw/zinc/70/25/94/1370702594.db2.gz	VNZGDTNNLHENAA-UHFFFAOYSA-N	0	3	342.487	3.050	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C2(CC)CC2)CC[C@H]1c1ccc(F)cc1	ZINC001205307261	1370716231	/nfs/dbraw/zinc/71/62/31/1370716231.db2.gz	XMEKVJBYBCIQHO-RBUKOAKNSA-N	0	3	342.458	3.313	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)/C=C/C(C)(C)C)C[C@H]1c1cccc(F)c1	ZINC001205387654	1370739895	/nfs/dbraw/zinc/73/98/95/1370739895.db2.gz	IHAJLZDIQAKTCN-VIBWXPCQSA-N	0	3	342.458	3.335	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C2(CCC)CCC2)C[C@H]1c1cccc(F)c1	ZINC001205426131	1370750964	/nfs/dbraw/zinc/75/09/64/1370750964.db2.gz	AKUFLJOOLPGAII-RBUKOAKNSA-N	0	3	342.458	3.313	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H]2CCO[C@H]2C(=C)C)CCCCC1	ZINC001115770079	1370754253	/nfs/dbraw/zinc/75/42/53/1370754253.db2.gz	OJTMBMZHSVIPPF-HOTGVXAUSA-N	0	3	340.895	3.129	20	30		EGEDHN
N#Cc1cc(CN2CCC3(CC2)C(=O)N[C@H]3c2ccccc2)ccc1F	ZINC001205478945	1370767894	/nfs/dbraw/zinc/76/78/94/1370767894.db2.gz	JKWNSIDNBFZURO-IBGZPJMESA-N	0	3	349.409	3.151	20	30		EGEDHN
CC#CCCCC(=O)N1CCC(CNCc2nc(C)sc2C)CC1	ZINC001205970401	1370925918	/nfs/dbraw/zinc/92/59/18/1370925918.db2.gz	QSBKGOCYMMKBED-UHFFFAOYSA-N	0	3	347.528	3.282	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC(CN[C@H](C)c2cnc(C)cn2)CC1	ZINC001205988684	1370930714	/nfs/dbraw/zinc/93/07/14/1370930714.db2.gz	JWVJGUAKSBYUHL-IAGOWNOFSA-N	0	3	344.503	3.277	20	30		EGEDHN
C=CCOCCCC(=O)N[C@@H]1CN(C/C=C\c2ccccc2)C[C@H]1C	ZINC001206778736	1371162295	/nfs/dbraw/zinc/16/22/95/1371162295.db2.gz	ICDRVYYRFJNPAZ-GDSCYZHGSA-N	0	3	342.483	3.119	20	30		EGEDHN
C=C[C@H](COC)NC[C@@H](O)COc1cc(C)c(Cl)cc1C(C)C	ZINC001326156321	1388120305	/nfs/dbraw/zinc/12/03/05/1388120305.db2.gz	OJDRLLQQTYCWLH-HUUCEWRRSA-N	0	3	341.879	3.302	20	30		EGEDHN
C[C@@H]1CN([C@H]2CCCc3ccc(F)cc32)C[C@H]1NC(=O)C#CC1CC1	ZINC001206948479	1371240427	/nfs/dbraw/zinc/24/04/27/1371240427.db2.gz	MLOPPXPGOCXMSG-XMCHAPAWSA-N	0	3	340.442	3.053	20	30		EGEDHN
O=C(CC1CC1)N1CCC[C@@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207046764	1371276642	/nfs/dbraw/zinc/27/66/42/1371276642.db2.gz	GINIKWMLAQARPF-GOSISDBHSA-N	0	3	330.859	3.072	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CCCN(Cc3cnc(C)s3)C2)CC1	ZINC001207058241	1371281716	/nfs/dbraw/zinc/28/17/16/1371281716.db2.gz	FHBUKLOLCZVCLE-UHFFFAOYSA-N	0	3	349.500	3.452	20	30		EGEDHN
CC(C)N(Cc1cc(C#N)n(C)c1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC001207107851	1371295836	/nfs/dbraw/zinc/29/58/36/1371295836.db2.gz	COGAEUJFZSJSPW-MRXNPFEDSA-N	0	3	346.475	3.117	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207116012	1371297834	/nfs/dbraw/zinc/29/78/34/1371297834.db2.gz	HDTHGCCYEOPATQ-GOSISDBHSA-N	0	3	332.875	3.318	20	30		EGEDHN
C=CCCCN1C[C@@H](C)[C@H](NC(=O)c2snc(Cl)c2Cl)C1	ZINC001207138175	1371306017	/nfs/dbraw/zinc/30/60/17/1371306017.db2.gz	BKFUDEWMXKJCOH-NXEZZACHSA-N	0	3	348.299	3.466	20	30		EGEDHN
CC(C)CCC(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207222438	1371333877	/nfs/dbraw/zinc/33/38/77/1371333877.db2.gz	PFHULYUTITTZPL-LJQANCHMSA-N	0	3	330.447	3.194	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207361717	1371373711	/nfs/dbraw/zinc/37/37/11/1371373711.db2.gz	ACQJIGTZZNHOEL-YJBOKZPZSA-N	0	3	332.875	3.318	20	30		EGEDHN
C[C@H](C#N)CSc1ccccc1NC(=O)N(C)[C@@H]1CCCN(C)C1	ZINC001119776011	1371403544	/nfs/dbraw/zinc/40/35/44/1371403544.db2.gz	FNAWMQNNDKULAY-HUUCEWRRSA-N	0	3	346.500	3.496	20	30		EGEDHN
C=CCOCc1nn(C)c2c1CN(CCCc1cccc(F)c1)CC2	ZINC001207601226	1371448354	/nfs/dbraw/zinc/44/83/54/1371448354.db2.gz	GNMAOYFTPNLFNN-UHFFFAOYSA-N	0	3	343.446	3.253	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CCC[C@H](NCc2cc(C)ccc2F)C1	ZINC001207622660	1371454586	/nfs/dbraw/zinc/45/45/86/1371454586.db2.gz	IGEFZAXGUGXCBG-AEFFLSMTSA-N	0	3	348.462	3.196	20	30		EGEDHN
CC(C)[C@H](C)CC(=O)N1CCC[C@H](NCc2ccc(C#N)s2)C1	ZINC001207645406	1371462964	/nfs/dbraw/zinc/46/29/64/1371462964.db2.gz	MROJJXCASRKCPO-CABCVRRESA-N	0	3	333.501	3.383	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H](NCc2ccc(Cl)cc2OC)C1	ZINC001207654139	1371465706	/nfs/dbraw/zinc/46/57/06/1371465706.db2.gz	OGSHZKSLFVBDKZ-INIZCTEOSA-N	0	3	336.863	3.395	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H](N[C@H]2CCc3c2c(F)ccc3F)C1	ZINC001207654692	1371465810	/nfs/dbraw/zinc/46/58/10/1371465810.db2.gz	TVZFTPSPFHONIJ-DYVFJYSZSA-N	0	3	334.410	3.499	20	30		EGEDHN
O=C(C1CC=CC1)N1CCC[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207727352	1371486846	/nfs/dbraw/zinc/48/68/46/1371486846.db2.gz	FYSLELQHTHARCA-IBGZPJMESA-N	0	3	342.870	3.238	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2c(C)noc2CC)CCCCC1	ZINC001120116893	1371488363	/nfs/dbraw/zinc/48/83/63/1371488363.db2.gz	HZOSQPYINDPJNR-UHFFFAOYSA-N	0	3	339.867	3.320	20	30		EGEDHN
O=C(C=C1CCC1)N1CCC[C@@H](NCC#Cc2ccccc2Cl)C1	ZINC001207776158	1371500677	/nfs/dbraw/zinc/50/06/77/1371500677.db2.gz	IHTSPQRZSIWCDM-GOSISDBHSA-N	0	3	342.870	3.382	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cnc(CC)s2)CCCCC1	ZINC001120239676	1371511150	/nfs/dbraw/zinc/51/11/50/1371511150.db2.gz	AUWJYDOOBLCLDU-UHFFFAOYSA-N	0	3	341.908	3.480	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)CCOC(C)C)C1	ZINC001120317884	1371531508	/nfs/dbraw/zinc/53/15/08/1371531508.db2.gz	CPGNRKIAPPXNBI-IAGOWNOFSA-N	0	3	342.911	3.257	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H](N[C@@H](C)c2ccc(F)cc2F)C1	ZINC001207909046	1371535555	/nfs/dbraw/zinc/53/55/55/1371535555.db2.gz	NBKYUXJBJWOZDR-GOEBONIOSA-N	0	3	334.410	3.410	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H](N[C@@H]2CCc3c2c(F)ccc3F)C1	ZINC001207943974	1371545040	/nfs/dbraw/zinc/54/50/40/1371545040.db2.gz	GXHTZWPVBFMULQ-RDTXWAMCSA-N	0	3	346.421	3.336	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC[C@H](N[C@H]2CCc3c2c(F)ccc3F)C1	ZINC001208005230	1371564597	/nfs/dbraw/zinc/56/45/97/1371564597.db2.gz	BAWSSIITHLSBJY-KSSFIOAISA-N	0	3	346.421	3.192	20	30		EGEDHN
C=CCCOCCCCC(=O)N1CCC[C@H](NC[C@H](F)CC)C1	ZINC001208032710	1371574809	/nfs/dbraw/zinc/57/48/09/1371574809.db2.gz	XBWVEBQMAIWGJZ-SJORKVTESA-N	0	3	328.472	3.078	20	30		EGEDHN
CC1(C(=O)N2CCC[C@@H](NCC#Cc3ccc(Cl)cc3)C2)CC1	ZINC001208100897	1371596079	/nfs/dbraw/zinc/59/60/79/1371596079.db2.gz	SBALYYKYKAJBLA-QGZVFWFLSA-N	0	3	330.859	3.072	20	30		EGEDHN
C[C@]1(C(=O)N2CCC[C@H](NCC#Cc3ccccc3)C2)CC=CCC1	ZINC001208165955	1371613985	/nfs/dbraw/zinc/61/39/85/1371613985.db2.gz	NQUZOYROSQNSFW-UNMCSNQZSA-N	0	3	336.479	3.365	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CN(Cc2ccc(OC)cc2)C[C@H]1C	ZINC001208387725	1371748384	/nfs/dbraw/zinc/74/83/84/1371748384.db2.gz	ANJARXOTMHCLCY-GPMSIDNRSA-N	0	3	330.472	3.234	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CN(CCOc2ccccc2)C[C@H]1C	ZINC001208390747	1371749587	/nfs/dbraw/zinc/74/95/87/1371749587.db2.gz	CDQPLKFSFYCHGP-ZHALLVOQSA-N	0	3	330.472	3.104	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1CN(CCOc2ccc(F)cc2)C[C@H]1C	ZINC001208395983	1371753205	/nfs/dbraw/zinc/75/32/05/1371753205.db2.gz	LZYDVBHYWWQCAH-GPMSIDNRSA-N	0	3	348.462	3.243	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN(CCOc2cccc(C)c2)C[C@H]1C	ZINC001208458338	1371774482	/nfs/dbraw/zinc/77/44/82/1371774482.db2.gz	DNCVDJJWSFZEFJ-IEBWSBKVSA-N	0	3	330.472	3.167	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1CN(Cc2ccc(COC)cc2)C[C@H]1C	ZINC001208508624	1371792226	/nfs/dbraw/zinc/79/22/26/1371792226.db2.gz	BOAPWQWSCWBHLY-OZOXKJRCSA-N	0	3	344.499	3.372	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1CN(Cc2ccc(COC)cc2)C[C@H]1C	ZINC001208508623	1371792252	/nfs/dbraw/zinc/79/22/52/1371792252.db2.gz	BOAPWQWSCWBHLY-BSIFCXSSSA-N	0	3	344.499	3.372	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1CN(CCOCc2ccccc2)C[C@H]1C	ZINC001208512038	1371794805	/nfs/dbraw/zinc/79/48/05/1371794805.db2.gz	SRHJCWSBTJNZMS-QFUCXCTJSA-N	0	3	344.499	3.242	20	30		EGEDHN
O=C(CCCF)N1CCC[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001209085301	1371992584	/nfs/dbraw/zinc/99/25/84/1371992584.db2.gz	BJVAMWCONOVXSC-KRWDZBQOSA-N	0	3	336.838	3.022	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC[C@H](NCc2c(C)nsc2C)C1	ZINC001209147138	1372014628	/nfs/dbraw/zinc/01/46/28/1372014628.db2.gz	SUZLUWVKFXQHKQ-BBRMVZONSA-N	0	3	335.517	3.443	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NC1CC2(CC(NCc3nccs3)C2)C1	ZINC001121611490	1372023998	/nfs/dbraw/zinc/02/39/98/1372023998.db2.gz	RQHBHJDGNZNWRV-OWKGEXNCSA-N	0	3	333.501	3.118	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@H](NCc2cc(CO)ccc2F)C1	ZINC001209182230	1372027005	/nfs/dbraw/zinc/02/70/05/1372027005.db2.gz	BHSXORABUNPYTK-QAPCUYQASA-N	0	3	348.462	3.001	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001209182182	1372027184	/nfs/dbraw/zinc/02/71/84/1372027184.db2.gz	ATTMCHCDMXZJAS-CRAIPNDOSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=CCCCCN1CCO[C@@H]2[C@@H](COCc3cccnc3)CC[C@H]21	ZINC001209202692	1372036048	/nfs/dbraw/zinc/03/60/48/1372036048.db2.gz	NJEHLYNDPLQRLN-VAMGGRTRSA-N	0	3	330.472	3.434	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CC[C@H]2CN(Cc3ccc(CF)cc3)C[C@H]21	ZINC001187833433	1388174174	/nfs/dbraw/zinc/17/41/74/1388174174.db2.gz	OJQFDIJZWXLIIZ-RBUKOAKNSA-N	0	3	342.458	3.238	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)C1(C(F)(F)F)CC1)C2	ZINC001121816259	1372090121	/nfs/dbraw/zinc/09/01/21/1372090121.db2.gz	XBXLWTPKYHLTLN-UHFFFAOYSA-N	0	3	336.785	3.098	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC1CC2(CC(NCc3conc3CC)C2)C1	ZINC001121842102	1372099085	/nfs/dbraw/zinc/09/90/85/1372099085.db2.gz	UFOIHVWVSBSAHD-UHFFFAOYSA-N	0	3	345.487	3.356	20	30		EGEDHN
C=CCCCCCN1CCCn2nnc(COc3cccnc3)c2C1	ZINC001209423330	1372102050	/nfs/dbraw/zinc/10/20/50/1372102050.db2.gz	SKVQGYFXHBDHCG-UHFFFAOYSA-N	0	3	341.459	3.204	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC[C@H](NCc3cncc(F)c3)C2)CC1	ZINC001209493652	1372120764	/nfs/dbraw/zinc/12/07/64/1372120764.db2.gz	NROWDQJWQFSAJG-KRWDZBQOSA-N	0	3	331.435	3.048	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N1CCc2cc(Br)ccc2C1	ZINC001121962649	1372135659	/nfs/dbraw/zinc/13/56/59/1372135659.db2.gz	BLVPEDMWNJFIDB-HNNXBMFYSA-N	0	3	337.261	3.017	20	30		EGEDHN
CC[C@H](c1ccc(F)cc1)N1C[C@@H]2CCN(C(=O)C#CC(C)C)[C@@H]2C1	ZINC001187849207	1388177295	/nfs/dbraw/zinc/17/72/95/1388177295.db2.gz	MDEOYUJPDQVVHS-DFQSSKMNSA-N	0	3	342.458	3.469	20	30		EGEDHN
CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1csc(C#N)c1	ZINC001326417366	1388181520	/nfs/dbraw/zinc/18/15/20/1388181520.db2.gz	LLJZSRUIQXYNJU-UHFFFAOYSA-N	0	3	349.406	3.102	20	30		EGEDHN
O=C([C@@H]1CC12CC2)N1CCC[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001209809574	1372205585	/nfs/dbraw/zinc/20/55/85/1372205585.db2.gz	XDXPGIRQCWMGMC-ROUUACIJSA-N	0	3	342.870	3.072	20	30		EGEDHN
O=C([C@@H]1C[C@H]1C1CCC1)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001210051914	1372262882	/nfs/dbraw/zinc/26/28/82/1372262882.db2.gz	LMIJRWGYFFKZEF-PCCBWWKXSA-N	0	3	336.479	3.055	20	30		EGEDHN
CC(C)C[C@@H](C)C(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001210359416	1372332700	/nfs/dbraw/zinc/33/27/00/1372332700.db2.gz	WNWJESCRBJHRGA-YLJYHZDGSA-N	0	3	344.474	3.440	20	30		EGEDHN
CCC[C@H](CC)C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001210378063	1372337405	/nfs/dbraw/zinc/33/74/05/1372337405.db2.gz	QDNHKPCNXQGNJR-VQTJNVASSA-N	0	3	326.484	3.445	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)C[C@@H](C)c2ccccc2OC)C1	ZINC001210412588	1372345889	/nfs/dbraw/zinc/34/58/89/1372345889.db2.gz	TYHLTHGZYDLYJI-JFIYKMOQSA-N	0	3	330.472	3.201	20	30		EGEDHN
CC1(CCC(=O)N2CCC[C@H](NCc3ccc(C#N)s3)C2)CC1	ZINC001210464964	1372360192	/nfs/dbraw/zinc/36/01/92/1372360192.db2.gz	QENGCENJQHYRCK-AWEZNQCLSA-N	0	3	331.485	3.281	20	30		EGEDHN
CCC(C)(CC)C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001211159004	1372491604	/nfs/dbraw/zinc/49/16/04/1372491604.db2.gz	CCWPTIUHNXMMIQ-IBGZPJMESA-N	0	3	326.484	3.445	20	30		EGEDHN
C=C[C@@H](C(=O)N[C@@H]1CN(CCOCCCC)C[C@H]1C)c1ccccc1	ZINC001211241228	1372509788	/nfs/dbraw/zinc/50/97/88/1372509788.db2.gz	GZODXEXAQWJRFY-MISYRCLQSA-N	0	3	344.499	3.209	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@@H]2CCCC2(C)C)C[C@H]1c1ccccc1	ZINC001211650504	1372595686	/nfs/dbraw/zinc/59/56/86/1372595686.db2.gz	KVZISSCDYIOLKI-SLFFLAALSA-N	0	3	338.495	3.420	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@@H]2CC23CCCC3)C[C@H]1c1ccccc1	ZINC001211703048	1372605755	/nfs/dbraw/zinc/60/57/55/1372605755.db2.gz	ROWKMTJRMPVZPK-SLFFLAALSA-N	0	3	336.479	3.174	20	30		EGEDHN
C=CC[C@@H](C(=O)N1CC[C@@H](NCc2cncc(C)c2)C1)c1ccccc1	ZINC001188001727	1388209965	/nfs/dbraw/zinc/20/99/65/1388209965.db2.gz	KGAZVPSGAXYMHH-NHCUHLMSSA-N	0	3	349.478	3.440	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2ccccc2F)[C@H](OC)C1	ZINC001211766344	1372613990	/nfs/dbraw/zinc/61/39/90/1372613990.db2.gz	YFORAZFHZPNHMV-QZTJIDSGSA-N	0	3	334.435	3.001	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)CCC[C@@H](C)CCC)[C@@H]2C1	ZINC001188044000	1388227055	/nfs/dbraw/zinc/22/70/55/1388227055.db2.gz	TWXDZBMHBWQQOD-GBESFXJTSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2ccc(CCC)cc2)[C@H](OC)C1	ZINC001213341995	1372888108	/nfs/dbraw/zinc/88/81/08/1372888108.db2.gz	ACSRVUVKHOYSRD-RTBURBONSA-N	0	3	330.472	3.034	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H](NC(=O)c2cc3occc3s2)[C@H](OC)C1	ZINC001213434794	1372906194	/nfs/dbraw/zinc/90/61/94/1372906194.db2.gz	LIOLHMMWBOHNKZ-UMVBOHGHSA-N	0	3	348.468	3.278	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)[C@@H](CCC)c2ccccc2)[C@H](OC)C1	ZINC001213817950	1372966553	/nfs/dbraw/zinc/96/65/53/1372966553.db2.gz	ISKGSHMBVVJGGM-XUVXKRRUSA-N	0	3	344.499	3.352	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)[C@H](C)CCCc2ccccc2)[C@H](OC)C1	ZINC001213948986	1372985267	/nfs/dbraw/zinc/98/52/67/1372985267.db2.gz	KDXJTYOOGYJSJT-MISYRCLQSA-N	0	3	344.499	3.037	20	30		EGEDHN
N#Cc1cc(Cl)c(-c2noc(-c3ccc(CN)nc3)n2)cc1Cl	ZINC001214113871	1373010169	/nfs/dbraw/zinc/01/01/69/1373010169.db2.gz	WSSGPFYPDADUMS-UHFFFAOYSA-N	0	3	346.177	3.436	20	30		EGEDHN
CC(C)C#CC(=O)NCCNCc1cccc(Oc2ccccc2)c1	ZINC001126834048	1373037910	/nfs/dbraw/zinc/03/79/10/1373037910.db2.gz	IYVUCARHFGSKBB-UHFFFAOYSA-N	0	3	336.435	3.344	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CCCCCC2)C[C@H]1NCC#Cc1ccccc1	ZINC001214290525	1373038824	/nfs/dbraw/zinc/03/88/24/1373038824.db2.gz	SMZPJUTXVQYFIA-WIYYLYMNSA-N	0	3	338.495	3.445	20	30		EGEDHN
C=CCOCCCC(=O)N1C[C@@H](C)[C@H](N[C@H](C)c2ccccc2F)C1	ZINC001214395237	1373053829	/nfs/dbraw/zinc/05/38/29/1373053829.db2.gz	ZAWMXCQDDNJKMW-GPMSIDNRSA-N	0	3	348.462	3.306	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@@H]2CC2(C)C)C[C@H]1NCC#Cc1ccc(Cl)cc1	ZINC001214445863	1373062705	/nfs/dbraw/zinc/06/27/05/1373062705.db2.gz	ONZPJPBKWHOICY-FHLIZLRMSA-N	0	3	344.886	3.174	20	30		EGEDHN
CC[C@H](C)CC(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001214518430	1373072501	/nfs/dbraw/zinc/07/25/01/1373072501.db2.gz	RNPZZWOABSOAKX-PMUMKWKESA-N	0	3	331.435	3.070	20	30		EGEDHN
C[C@@H]1CN(C(=O)C#CC(C)(C)C)C[C@H]1NCc1cc2ccccc2o1	ZINC001214589236	1373085543	/nfs/dbraw/zinc/08/55/43/1373085543.db2.gz	IPRGZVBQCVXTLH-CRAIPNDOSA-N	0	3	338.451	3.419	20	30		EGEDHN
C#Cc1ccc(C(=O)N2C[C@@H](C)[C@H](NCC=C(Cl)Cl)C2)cc1	ZINC001215290350	1373195012	/nfs/dbraw/zinc/19/50/12/1373195012.db2.gz	NQMKJIKWMZSHPL-IUODEOHRSA-N	0	3	337.250	3.037	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCN[C@H]1CCc2c1cc(F)cc2F	ZINC001128085540	1373217290	/nfs/dbraw/zinc/21/72/90/1373217290.db2.gz	VHUAEEPSPOQUGN-SFHVURJKSA-N	0	3	334.410	3.426	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NCCNCc1ccc(Cl)c(F)c1)OCC	ZINC001128528271	1373283680	/nfs/dbraw/zinc/28/36/80/1373283680.db2.gz	KTEIREISPCWOJY-MRXNPFEDSA-N	0	3	342.842	3.056	20	30		EGEDHN
CCCCCCCCC(=O)N1C[C@@H](C)[C@H](NCc2cnc(C)nc2)C1	ZINC001216531365	1373314410	/nfs/dbraw/zinc/31/44/10/1373314410.db2.gz	ZKKPZJOCCROYRI-VQIMIIECSA-N	0	3	346.519	3.472	20	30		EGEDHN
Cc1ccc(C(=O)N2C[C@@H](C)[C@H](NCC#Cc3ccccc3)C2)c(C)c1	ZINC001216636821	1373325104	/nfs/dbraw/zinc/32/51/04/1373325104.db2.gz	WJRQOXFGSOQQRY-DENIHFKCSA-N	0	3	346.474	3.405	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)C/C=C\Cc2ccccc2)s1	ZINC001129884765	1373431885	/nfs/dbraw/zinc/43/18/85/1373431885.db2.gz	LJTMODXUZCMSHZ-PLNGDYQASA-N	0	3	339.464	3.015	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)[C@@H](CC)CCCC)C1	ZINC001130350997	1373500826	/nfs/dbraw/zinc/50/08/26/1373500826.db2.gz	BGQHDUVMJRWTFG-JKSUJKDBSA-N	0	3	332.492	3.218	20	30		EGEDHN
O=C(/C=C/c1ccccc1O[C@@H]1CC[C@@H]2NCCO[C@@H]12)c1ccccc1	ZINC001218127500	1373566418	/nfs/dbraw/zinc/56/64/18/1373566418.db2.gz	RIZYALRMAHRPAZ-FQTYGPBGSA-N	0	3	349.430	3.481	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCO[C@@H]2CN(CCC3CCCCC3)C[C@@H]21	ZINC001218524031	1373629768	/nfs/dbraw/zinc/62/97/68/1373629768.db2.gz	TVZLRLXMEZSXES-YZGWKJHDSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)CC[C@@H](C)c3ccccc3)[C@H]2C1	ZINC001218730223	1373648427	/nfs/dbraw/zinc/64/84/27/1373648427.db2.gz	RYQSHTYDIZHIOQ-YZGWKJHDSA-N	0	3	342.483	3.058	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2OCCN(C(=O)c3cc(C)c(CC)o3)[C@H]2C1	ZINC001218952367	1373670496	/nfs/dbraw/zinc/67/04/96/1373670496.db2.gz	PESFPKKQMALFKS-TXPKVOOTSA-N	0	3	346.471	3.030	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@@H]2CCC=CCCC2)[C@@H](O)C1	ZINC001219862987	1373737467	/nfs/dbraw/zinc/73/74/67/1373737467.db2.gz	WXVHDQCEZRUTJB-QRVBRYPASA-N	0	3	334.504	3.031	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)CCCC(C)(C)C)C[C@H](C)O2	ZINC001131642563	1373740823	/nfs/dbraw/zinc/74/08/23/1373740823.db2.gz	RRKRLKYBWAXZLN-FXAWDEMLSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)O[C@@]2(CCN(Cc3cccc(C)c3)C2)C1	ZINC001131645163	1373740963	/nfs/dbraw/zinc/74/09/63/1373740963.db2.gz	BYNJRWXWRHVMAV-WIYYLYMNSA-N	0	3	342.483	3.153	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C1(CC(C)C)CC1)C[C@@H](C)O2	ZINC001131665706	1373750929	/nfs/dbraw/zinc/75/09/29/1373750929.db2.gz	IRLMOMBQQGCUHI-XLIONFOSSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C1(CC(C)C)CC1)C[C@@H](C)O2	ZINC001131665707	1373751575	/nfs/dbraw/zinc/75/15/75/1373751575.db2.gz	IRLMOMBQQGCUHI-YLJYHZDGSA-N	0	3	334.504	3.081	20	30		EGEDHN
N#C[C@H]1CC[C@H](NC(=O)C[C@@H](N)c2ccc(C(F)(F)F)cc2)CC1	ZINC001220094988	1373751752	/nfs/dbraw/zinc/75/17/52/1373751752.db2.gz	PUGOEXJEYFDFKG-KCPJHIHWSA-N	0	3	339.361	3.294	20	30		EGEDHN
Cc1ccc(C2CC2)c(C(=O)NCCNCc2cccc(C#N)c2)c1	ZINC001131749789	1373784835	/nfs/dbraw/zinc/78/48/35/1373784835.db2.gz	OFTFSWQBLWYIQU-UHFFFAOYSA-N	0	3	333.435	3.264	20	30		EGEDHN
CCCCCCCN1CC[C@@H]2CN(C(=O)c3conc3CC)[C@@H]2C1	ZINC001221798569	1373793291	/nfs/dbraw/zinc/79/32/91/1373793291.db2.gz	DAYGNKHNHARMSZ-CRAIPNDOSA-N	0	3	333.476	3.354	20	30		EGEDHN
C=CCOCCN1CC[C@@H]2CN(C(=O)[C@H](CCCC)C(C)C)[C@@H]2C1	ZINC001222057987	1373814651	/nfs/dbraw/zinc/81/46/51/1373814651.db2.gz	KJRJTABOWRNFLC-GUDVDZBRSA-N	0	3	336.520	3.184	20	30		EGEDHN
N#Cc1ccc(CN2CCC(CNC(=O)CC3CCCC3)CC2)cc1	ZINC001222293902	1373826160	/nfs/dbraw/zinc/82/61/60/1373826160.db2.gz	RRPXIUZWVWQPPM-UHFFFAOYSA-N	0	3	339.483	3.467	20	30		EGEDHN
Cc1ccc(C)c(CN2C[C@H](NC(=O)CSCC#N)CC[C@H]2C)c1	ZINC001131830767	1373827780	/nfs/dbraw/zinc/82/77/80/1373827780.db2.gz	UTUMVSFKNCWWEC-SJLPKXTDSA-N	0	3	345.512	3.029	20	30		EGEDHN
C=CCOCCN1CC[C@@H]2CCN(C(=O)c3sc(C)cc3C)C[C@@H]21	ZINC001222763158	1373872926	/nfs/dbraw/zinc/87/29/26/1373872926.db2.gz	LEZYNVFRXDLBON-SJORKVTESA-N	0	3	348.512	3.104	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@H](C)N(Cc2cccc(COC)c2)C1	ZINC001131899538	1375036101	/nfs/dbraw/zinc/03/61/01/1375036101.db2.gz	NMLJBHVLZPFDJU-QFBILLFUSA-N	0	3	330.472	3.268	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCC1CCN(Cc2cncc(C)c2)CC1	ZINC001224187527	1375060479	/nfs/dbraw/zinc/06/04/79/1375060479.db2.gz	SFZLPXPUKJJUEV-QGZVFWFLSA-N	0	3	329.488	3.321	20	30		EGEDHN
C=CCOCC(=O)N[C@@H]1CC[C@H](C)N(Cc2ccc(C3CC3)cc2)C1	ZINC001131945938	1375061832	/nfs/dbraw/zinc/06/18/32/1375061832.db2.gz	DGBFMYBVJLHLBV-OXJNMPFZSA-N	0	3	342.483	3.236	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@H](C)N(Cc2ccc(CF)cc2)C1	ZINC001132002425	1375092751	/nfs/dbraw/zinc/09/27/51/1375092751.db2.gz	JRLFFZGLJBWUDD-QFBILLFUSA-N	0	3	330.447	3.429	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@H](C)N(CCCc2ccsc2)C1	ZINC001132002310	1375092935	/nfs/dbraw/zinc/09/29/35/1375092935.db2.gz	IKVBBRDRXRYBTD-FUHWJXTLSA-N	0	3	332.513	3.453	20	30		EGEDHN
O=C(N[C@@H]1CCCC[C@H]1NCC#Cc1ccc(F)cc1)C1CC=CC1	ZINC001225477956	1375114644	/nfs/dbraw/zinc/11/46/44/1375114644.db2.gz	MALXSHICQPWQCC-WOJBJXKFSA-N	0	3	340.442	3.160	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@@H](c2ccc(F)cc2)C(C)C)CC1	ZINC001225596201	1375129767	/nfs/dbraw/zinc/12/97/67/1375129767.db2.gz	CCWKKTWUYPTDMH-HXUWFJFHSA-N	0	3	344.474	3.417	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NCC1CCN(Cc2cc(C)ccc2F)CC1	ZINC001225630639	1375135225	/nfs/dbraw/zinc/13/52/25/1375135225.db2.gz	CYPAALMPPHGGDI-INIZCTEOSA-N	0	3	348.462	3.053	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)C2(C(F)(F)F)CCCCC2)CC1	ZINC001225685462	1375144357	/nfs/dbraw/zinc/14/43/57/1375144357.db2.gz	OEGJVUWPWNHOQZ-UHFFFAOYSA-N	0	3	344.421	3.351	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CCCC[C@H]1NCc1c(C)nsc1C	ZINC001225752166	1375152149	/nfs/dbraw/zinc/15/21/49/1375152149.db2.gz	AHYBPVXJDYERQN-QZTJIDSGSA-N	0	3	347.528	3.471	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1CCCC[C@H]1NCc1cccc(F)c1F	ZINC001226080524	1375199996	/nfs/dbraw/zinc/19/99/96/1375199996.db2.gz	SQLBWINNGQDTLP-IAGOWNOFSA-N	0	3	334.410	3.141	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1CC[C@H](C)N(CCOC2CCC2)C1	ZINC001132240222	1375234887	/nfs/dbraw/zinc/23/48/87/1375234887.db2.gz	CYBKRDJQCLYGLX-ROUUACIJSA-N	0	3	334.504	3.108	20	30		EGEDHN
Cc1cc(C(=O)NCCNCc2ccc(C#N)s2)c(C)cc1Cl	ZINC001132268464	1375256631	/nfs/dbraw/zinc/25/66/31/1375256631.db2.gz	IAYKLPDQRUKKGN-UHFFFAOYSA-N	0	3	347.871	3.410	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CC[C@H](C)N(CCOCC(C)C)C2)CC1	ZINC001132292942	1375274315	/nfs/dbraw/zinc/27/43/15/1375274315.db2.gz	WODAJPXKLJXIOJ-PKOBYXMFSA-N	0	3	336.520	3.375	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2CCCC[C@H]2NCc2cc(C)ns2)CCC1	ZINC001226730976	1375319953	/nfs/dbraw/zinc/31/99/53/1375319953.db2.gz	QASVPJVOIMGZJB-IAGOWNOFSA-N	0	3	345.512	3.162	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COc2ccsc2Cl)CC[C@@H]1C	ZINC001132344061	1375322756	/nfs/dbraw/zinc/32/27/56/1375322756.db2.gz	LTACEAGQIRQDCY-STQMWFEESA-N	0	3	342.892	3.326	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc(CCCCC)n[nH]2)CC[C@H]1C	ZINC001132348729	1375325252	/nfs/dbraw/zinc/32/52/52/1375325252.db2.gz	RESHSLKYQHVOAS-WBVHZDCISA-N	0	3	332.492	3.301	20	30		EGEDHN
Cc1ccc2[nH]c(C(=O)NCCNCc3cccc(C#N)c3)cc2c1C	ZINC001132362703	1375328208	/nfs/dbraw/zinc/32/82/08/1375328208.db2.gz	KVKZZSMNQRAWNJ-UHFFFAOYSA-N	0	3	346.434	3.176	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)C[C@@H](OCC)C(C)C	ZINC001226766246	1375329060	/nfs/dbraw/zinc/32/90/60/1375329060.db2.gz	KLXXNTAPLQKHBO-BZUAXINKSA-N	0	3	330.900	3.207	20	30		EGEDHN
C#CCCCCCC(=O)NCCNCc1ccc(OC)c(Cl)c1	ZINC001132402871	1375354844	/nfs/dbraw/zinc/35/48/44/1375354844.db2.gz	ZJZGMISCAGZMRE-UHFFFAOYSA-N	0	3	336.863	3.138	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2cc3sccc3[nH]2)CC[C@@H]1C	ZINC001132403262	1375356034	/nfs/dbraw/zinc/35/60/34/1375356034.db2.gz	UKHRXIKELSTUMI-KBPBESRZSA-N	0	3	347.484	3.015	20	30		EGEDHN
C#CCCCCC(=O)NC1CCN(Cc2ccc3c(c2)CCC3)CC1	ZINC001226951817	1375368080	/nfs/dbraw/zinc/36/80/80/1375368080.db2.gz	JOSBLACSSLVIRV-UHFFFAOYSA-N	0	3	338.495	3.450	20	30		EGEDHN
C#CCCCCC(=O)NC1CCN(Cc2cccc(COC)c2)CC1	ZINC001226951600	1375368409	/nfs/dbraw/zinc/36/84/09/1375368409.db2.gz	FZEZCXRCAJNMLW-UHFFFAOYSA-N	0	3	342.483	3.107	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2ccc(Cl)cc2)CC[C@@H]1C	ZINC001132441333	1375384549	/nfs/dbraw/zinc/38/45/49/1375384549.db2.gz	NOAFXMRENBICQK-WMLDXEAASA-N	0	3	336.863	3.125	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2cc(C)ccc2C)CC[C@H]1C	ZINC001132444723	1375388164	/nfs/dbraw/zinc/38/81/64/1375388164.db2.gz	FEZOHZALHBKFKL-QZTJIDSGSA-N	0	3	330.472	3.089	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COc2cccc(Cl)c2)CC[C@@H]1C	ZINC001132468016	1375409935	/nfs/dbraw/zinc/40/99/35/1375409935.db2.gz	LIAHQHQVVVWAIK-GOEBONIOSA-N	0	3	336.863	3.264	20	30		EGEDHN
CC(C)C#CC(=O)NC1CCN([C@@H]2CCCc3ccc(F)cc32)CC1	ZINC001227243650	1375411068	/nfs/dbraw/zinc/41/10/68/1375411068.db2.gz	BGRBWTUPWGMULH-HXUWFJFHSA-N	0	3	342.458	3.443	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)COc2ccccc2C(C)C)CC[C@@H]1C	ZINC001132469884	1375411458	/nfs/dbraw/zinc/41/14/58/1375411458.db2.gz	YHFBVEVTZQHZIZ-ZWKOTPCHSA-N	0	3	342.483	3.181	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCc2ccccc2OC)CC[C@@H]1C	ZINC001132469968	1375412359	/nfs/dbraw/zinc/41/23/59/1375412359.db2.gz	ZIAICZKXBRVDGG-WMZOPIPTSA-N	0	3	330.472	3.173	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2(C(F)(F)F)CCCC2)CC[C@@H]1C	ZINC001132543613	1375451354	/nfs/dbraw/zinc/45/13/54/1375451354.db2.gz	ZGWVGYNVRJVZQB-KBPBESRZSA-N	0	3	330.394	3.102	20	30		EGEDHN
C#CCN1CC[C@@H](CN(Cc2scnc2C)C(=O)[C@@H](C)CCC)C1	ZINC001132558303	1375465950	/nfs/dbraw/zinc/46/59/50/1375465950.db2.gz	KTCHEANNEXADFH-DOTOQJQBSA-N	0	3	347.528	3.171	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2N(Cc2nccs2)C(=O)CCC)CC1	ZINC001132567425	1375470973	/nfs/dbraw/zinc/47/09/73/1375470973.db2.gz	YSKXGJPTLOCNMG-MRXNPFEDSA-N	0	3	345.512	3.150	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCNCc1ccccc1C(F)(F)F	ZINC001132574298	1375472080	/nfs/dbraw/zinc/47/20/80/1375472080.db2.gz	ZALHGHPIEONDHC-QWHCGFSZSA-N	0	3	328.378	3.369	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](C)[C@@H](CNCc2nc(C)sc2C)C1	ZINC001132697560	1375519574	/nfs/dbraw/zinc/51/95/74/1375519574.db2.gz	RXWDXJRBSRFTSH-CJNGLKHVSA-N	0	3	335.517	3.300	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](C)[C@H](CNCc2ccn(C(C)C)n2)C1	ZINC001132700250	1375520876	/nfs/dbraw/zinc/52/08/76/1375520876.db2.gz	FGPZRSJKLHLORG-DLBZAZTESA-N	0	3	332.492	3.004	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](C)[C@H](CNCc2csc(CC)n2)C1	ZINC001132789572	1375565539	/nfs/dbraw/zinc/56/55/39/1375565539.db2.gz	LSTARPHHVFSFAW-HZPDHXFCSA-N	0	3	347.528	3.083	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](C)[C@@H](CNCc2nccs2)C1	ZINC001132846899	1375599214	/nfs/dbraw/zinc/59/92/14/1375599214.db2.gz	OFNYKORTPHJOIL-CABCVRRESA-N	0	3	335.517	3.320	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CCN(Cc2cccc(COC)c2)CC1	ZINC001228622045	1375618338	/nfs/dbraw/zinc/61/83/38/1375618338.db2.gz	JXUACGXNINTJDP-UHFFFAOYSA-N	0	3	330.472	3.126	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NC1CCN(CCOCc2ccccc2)CC1	ZINC001228748213	1375659946	/nfs/dbraw/zinc/65/99/46/1375659946.db2.gz	KDSRYULOCMWGIS-ZWKOTPCHSA-N	0	3	344.499	3.242	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC1CCN(Cc2cccc(N(C)C)c2)CC1	ZINC001228786882	1375676484	/nfs/dbraw/zinc/67/64/84/1375676484.db2.gz	TUFTZZARGZKALV-KRWDZBQOSA-N	0	3	343.515	3.436	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)C(C2CCC2)C2CCC2)s1	ZINC001132966116	1375680577	/nfs/dbraw/zinc/68/05/77/1375680577.db2.gz	HIPBHTGLKORYRI-UHFFFAOYSA-N	0	3	331.485	3.042	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](C)[C@@H](CNCc2cc(C)no2)C1	ZINC001133039666	1375730598	/nfs/dbraw/zinc/73/05/98/1375730598.db2.gz	UDBKVWDBJOMYBO-WMZOPIPTSA-N	0	3	345.487	3.141	20	30		EGEDHN
C=CCC1(C(=O)NC2CCN(CCOCCC(C)C)CC2)CCC1	ZINC001229024686	1375742729	/nfs/dbraw/zinc/74/27/29/1375742729.db2.gz	NLNSEXWSOXXSDK-UHFFFAOYSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](C)[C@@H](CNCc3nccs3)C2)CCC1	ZINC001133104420	1375776161	/nfs/dbraw/zinc/77/61/61/1375776161.db2.gz	DBMSTPYQLOCXHO-CVEARBPZSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](C)[C@H](CNCc3cscn3)C2)CCC1	ZINC001133105766	1375778731	/nfs/dbraw/zinc/77/87/31/1375778731.db2.gz	XIIAYSBPBNTLSQ-HZPDHXFCSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=CCCCC(=O)NCCNCc1csc(Br)c1	ZINC001133157753	1375813836	/nfs/dbraw/zinc/81/38/36/1375813836.db2.gz	ONXNXFUVUXQINP-UHFFFAOYSA-N	0	3	331.279	3.073	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC1CCN(CCOc2cccc(F)c2)CC1	ZINC001229368954	1375819600	/nfs/dbraw/zinc/81/96/00/1375819600.db2.gz	GBZNHIIQKLWHQS-UHFFFAOYSA-N	0	3	348.462	3.387	20	30		EGEDHN
CC(C)(C)C(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccc(F)cc1	ZINC001229845993	1375903508	/nfs/dbraw/zinc/90/35/08/1375903508.db2.gz	OICGOGQPJWVOJG-QZTJIDSGSA-N	0	3	330.447	3.240	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@H]2CN(Cc3sc(C)nc3C)C[C@H]21	ZINC001188909122	1388408094	/nfs/dbraw/zinc/40/80/94/1388408094.db2.gz	NNYQGQNVFXMCMD-IXDOHACOSA-N	0	3	347.528	3.395	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)C(C)(C)Cc2ccccc2)CC1	ZINC001229926907	1375919736	/nfs/dbraw/zinc/91/97/36/1375919736.db2.gz	QOQCTDUPHQCNEA-UHFFFAOYSA-N	0	3	344.499	3.039	20	30		EGEDHN
CC[C@@H](F)CNCCN(Cc1cccc(Cl)c1)C(=O)[C@H](C)C#N	ZINC001133392652	1375976774	/nfs/dbraw/zinc/97/67/74/1375976774.db2.gz	HLWUACRQECPXDE-CZUORRHYSA-N	0	3	339.842	3.166	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C[C@@H]1C[C@H]1C1CC1	ZINC001133399689	1375984092	/nfs/dbraw/zinc/98/40/92/1375984092.db2.gz	VHZZTFWKLFUMAP-HKUYNNGSSA-N	0	3	344.886	3.328	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@]1(C)C=CCC1	ZINC001133401920	1375986229	/nfs/dbraw/zinc/98/62/29/1375986229.db2.gz	UXTVFPBDDJULNX-LJQANCHMSA-N	0	3	330.859	3.248	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)C2(CC=C)CCCCC2)CC1	ZINC001230332114	1375998846	/nfs/dbraw/zinc/99/88/46/1375998846.db2.gz	SDKSMECVNULSIH-UHFFFAOYSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)CC(F)(F)C(F)(F)F	ZINC001230388236	1376016156	/nfs/dbraw/zinc/01/61/56/1376016156.db2.gz	SVPAZFJOWMJNLR-NXEZZACHSA-N	0	3	348.743	3.344	20	30		EGEDHN
C#C[C@H](COc1cccc(Cl)c1)Oc1ccc2[nH]c(N)nc2c1	ZINC001230518814	1376051963	/nfs/dbraw/zinc/05/19/63/1376051963.db2.gz	UFSYEMYYVVZRGE-GFCCVEGCSA-N	0	3	327.771	3.258	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)c1ccccc1	ZINC001133524625	1376060028	/nfs/dbraw/zinc/06/00/28/1376060028.db2.gz	HUBJJVXIQUNTHY-STQMWFEESA-N	0	3	325.250	3.082	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)c1ccc(F)cc1)NCc1ccccc1C#N	ZINC001133550174	1376080350	/nfs/dbraw/zinc/08/03/50/1376080350.db2.gz	NYGNYUXCWHUMCF-HUUCEWRRSA-N	0	3	339.414	3.384	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1C1CCN(C(=O)CCC(F)F)CC1	ZINC001230581114	1376084364	/nfs/dbraw/zinc/08/43/64/1376084364.db2.gz	VOJNLEXAIUPWNP-AWEZNQCLSA-N	0	3	334.838	3.487	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)c1cccs1	ZINC001133580667	1376104082	/nfs/dbraw/zinc/10/40/82/1376104082.db2.gz	CNNFECZMQPKQEQ-QWRGUYRKSA-N	0	3	331.279	3.143	20	30		EGEDHN
Cc1ccoc1C(=O)N[C@H](C)C[C@@H](C)NCc1cc(F)ccc1C#N	ZINC001133680331	1376150972	/nfs/dbraw/zinc/15/09/72/1376150972.db2.gz	YDZAIXBZCKKNQA-ZIAGYGMSSA-N	0	3	343.402	3.286	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCCN(Cc1cccnc1)C[C@@H](C)OC	ZINC001230812130	1376155037	/nfs/dbraw/zinc/15/50/37/1376155037.db2.gz	WNHAZMBDTZEIDP-QGZVFWFLSA-N	0	3	347.503	3.027	20	30		EGEDHN
C=CCOc1cccc(CN2CCC(NC(=O)CC(C)C)CC2)c1	ZINC001231623599	1376284681	/nfs/dbraw/zinc/28/46/81/1376284681.db2.gz	LEBMWSBGXGJELU-UHFFFAOYSA-N	0	3	330.472	3.378	20	30		EGEDHN
C#Cc1cccc(CN(C)[C@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	ZINC001231658373	1376298019	/nfs/dbraw/zinc/29/80/19/1376298019.db2.gz	VBFLGFFUCDZSFA-SFHVURJKSA-N	0	3	328.456	3.499	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CCN(Cc3ccc(C)nc3C)C2)C1	ZINC001232081786	1376396970	/nfs/dbraw/zinc/39/69/70/1376396970.db2.gz	HDFJSOCVYCUSJD-HXUWFJFHSA-N	0	3	343.471	3.309	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)C1CC(C)(C)C1	ZINC001134255460	1376439032	/nfs/dbraw/zinc/43/90/32/1376439032.db2.gz	BDMCFXUJXFRYRH-NEPJUHHUSA-N	0	3	331.298	3.204	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H](C)C[C@@H](C)NCc1cc(O)ccc1Cl	ZINC001134317653	1376472745	/nfs/dbraw/zinc/47/27/45/1376472745.db2.gz	MDNKDSNJOYYEOG-ZIAGYGMSSA-N	0	3	336.863	3.078	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)c2cccc(F)c2Cl)ccc1F	ZINC001134328173	1376478491	/nfs/dbraw/zinc/47/84/91/1376478491.db2.gz	XPVVDXYFZTVTIR-UHFFFAOYSA-N	0	3	349.768	3.009	20	30		EGEDHN
C=CCO[C@H]1CO[C@@]2(C1)CCCN(Cc1c(C)cccc1OC)C2	ZINC001232622673	1376490816	/nfs/dbraw/zinc/49/08/16/1376490816.db2.gz	TUMLVYDOMZRQNT-YLJYHZDGSA-N	0	3	331.456	3.330	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H](C)C[C@@H](C)NCc1cc(C)no1	ZINC001134457945	1376548812	/nfs/dbraw/zinc/54/88/12/1376548812.db2.gz	WFGYIICVEYOCPY-MNOVXSKESA-N	0	3	327.856	3.135	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H](C)C[C@@H](C)NCc1csnc1OC	ZINC001134457709	1376548843	/nfs/dbraw/zinc/54/88/43/1376548843.db2.gz	SCDDDLZFVHOERC-OLZOCXBDSA-N	0	3	339.505	3.127	20	30		EGEDHN
CC[C@H](CC1CCCC1)C(=O)NCCNCc1cccc(C#N)c1	ZINC001134683468	1376655994	/nfs/dbraw/zinc/65/59/94/1376655994.db2.gz	POZOWJUPJSDPJF-LJQANCHMSA-N	0	3	327.472	3.371	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)C1(C2CC2)CC1)NCc1ccccc1C#N	ZINC001134694419	1376665292	/nfs/dbraw/zinc/66/52/92/1376665292.db2.gz	RKAPBCOKRYNXMF-HUUCEWRRSA-N	0	3	325.456	3.121	20	30		EGEDHN
CC(C)C#CC(=O)N(C)C[C@@H]1CCN1CCCCc1ccccc1	ZINC001234160553	1376780249	/nfs/dbraw/zinc/78/02/49/1376780249.db2.gz	IDSMAWPPPQLEQT-FQEVSTJZSA-N	0	3	326.484	3.201	20	30		EGEDHN
C=CCCCCCN1CC[C@H]1CN(C)C(=O)Cc1ccncc1C	ZINC001234358296	1376818588	/nfs/dbraw/zinc/81/85/88/1376818588.db2.gz	ZMXWDGFBIFXNGC-IBGZPJMESA-N	0	3	329.488	3.212	20	30		EGEDHN
C[C@]1(C(=O)NCCNCc2ccc(C#N)s2)C[C@@H]1c1ccccc1	ZINC001135095859	1376893198	/nfs/dbraw/zinc/89/31/98/1376893198.db2.gz	UBUUMSWHSPQCDJ-MJGOQNOKSA-N	0	3	339.464	3.019	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H](C)C[C@@H](C)NCc1conc1CC	ZINC001135188232	1376961166	/nfs/dbraw/zinc/96/11/66/1376961166.db2.gz	IGJYXHRADBLDMY-CVEARBPZSA-N	0	3	333.476	3.194	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H](C)C[C@H](C)NCc1ncc(C)s1	ZINC001135193346	1376965000	/nfs/dbraw/zinc/96/50/00/1376965000.db2.gz	HSRZDWTTZQKXMS-LSDHHAIUSA-N	0	3	335.517	3.408	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2oc(C)nc2C)CCC1	ZINC001135394349	1377071208	/nfs/dbraw/zinc/07/12/08/1377071208.db2.gz	GJLNCCZAENYAKQ-KBPBESRZSA-N	0	3	333.476	3.411	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H](C)C[C@H](C)NCc2oc(CC)nc2C)C1	ZINC001135426605	1377089547	/nfs/dbraw/zinc/08/95/47/1377089547.db2.gz	FTFGIGPUDZJEIJ-KBPBESRZSA-N	0	3	333.476	3.275	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)C1(C(C)(F)F)CC1)NCc1ccccc1C#N	ZINC001135493272	1377117321	/nfs/dbraw/zinc/11/73/21/1377117321.db2.gz	SGWPVHMNGJUVPY-ZIAGYGMSSA-N	0	3	349.425	3.367	20	30		EGEDHN
Cc1cccc(C(=O)NCCNCc2ccc(C#N)c(F)c2)c1Cl	ZINC001135529443	1377131063	/nfs/dbraw/zinc/13/10/63/1377131063.db2.gz	SIDOMNJVPYOVNH-UHFFFAOYSA-N	0	3	345.805	3.179	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)Cc1ccc(Cl)c(F)c1	ZINC001266175149	1377217030	/nfs/dbraw/zinc/21/70/30/1377217030.db2.gz	FOJSXDFELYKIKQ-LLVKDONJSA-N	0	3	333.234	3.259	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)C(C1CC1)C1CC1)NCc1ccccc1C#N	ZINC001135904289	1377256444	/nfs/dbraw/zinc/25/64/44/1377256444.db2.gz	AMPFCXHABISNGV-CABCVRRESA-N	0	3	339.483	3.367	20	30		EGEDHN
CCCN(CCNC(=O)C1(C)CC(F)(F)C1)Cc1cccc(C#N)c1	ZINC001267319809	1377441041	/nfs/dbraw/zinc/44/10/41/1377441041.db2.gz	QPVOZNRVSMPDIU-UHFFFAOYSA-N	0	3	349.425	3.322	20	30		EGEDHN
Cc1cccc(N2CCCN(Cc3ccc(OCC#N)cc3)CC2)n1	ZINC001137121591	1377482265	/nfs/dbraw/zinc/48/22/65/1377482265.db2.gz	UFXMHRPIUVEZEJ-UHFFFAOYSA-N	0	3	336.439	3.005	20	30		EGEDHN
N#Cc1cccc(O[C@H]2CCCN(Cc3[nH]nc4ccccc43)C2)c1	ZINC001137350700	1377529503	/nfs/dbraw/zinc/52/95/03/1377529503.db2.gz	DKZPDPJJAPDEFT-KRWDZBQOSA-N	0	3	332.407	3.478	20	30		EGEDHN
N#Cc1ccccc1O[C@H]1CCCN(Cc2c[nH]c3ncccc23)C1	ZINC001137404953	1377541963	/nfs/dbraw/zinc/54/19/63/1377541963.db2.gz	XSJXVYJNBZIZEU-KRWDZBQOSA-N	0	3	332.407	3.478	20	30		EGEDHN
N#Cc1ccc(F)c(CNC2(CNC(=O)c3ccco3)CCCC2)c1	ZINC001270708231	1377612718	/nfs/dbraw/zinc/61/27/18/1377612718.db2.gz	XVVXIMWXGLRWKN-UHFFFAOYSA-N	0	3	341.386	3.123	20	30		EGEDHN
C=CCN1C(=O)CCC12CCN(Cc1cccc(OCC)c1)CC2	ZINC001138097427	1377676440	/nfs/dbraw/zinc/67/64/40/1377676440.db2.gz	ULDKITGZVVFVKU-UHFFFAOYSA-N	0	3	328.456	3.228	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CC(CN(C)C(=O)OC(C)(C)C)C2)c1[O-]	ZINC001138625852	1377755965	/nfs/dbraw/zinc/75/59/65/1377755965.db2.gz	VAGISIZSFFSNFV-UHFFFAOYSA-N	0	3	346.471	3.419	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@H](Oc3cc(C)ncn3)C2)c1[O-]	ZINC001138630906	1377757683	/nfs/dbraw/zinc/75/76/83/1377757683.db2.gz	FYIDZUQLQICEHA-SFHVURJKSA-N	0	3	339.439	3.263	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@H](Oc3cc(C)ncn3)C2)c1[O-]	ZINC001138630906	1377757693	/nfs/dbraw/zinc/75/76/93/1377757693.db2.gz	FYIDZUQLQICEHA-SFHVURJKSA-N	0	3	339.439	3.263	20	30		EGEDHN
O=C1C=C2CN(Cc3cc(F)cc(Br)c3)CCC2S1	ZINC001139174578	1377843692	/nfs/dbraw/zinc/84/36/92/1377843692.db2.gz	ZKKAZHOLTGRKSN-ZDUSSCGKSA-N	0	3	342.233	3.362	20	30		EGEDHN
CC(C)N1CCN(Cc2ccc(Oc3ccc(C#N)cc3)nc2)CC1	ZINC001139424601	1377882303	/nfs/dbraw/zinc/88/23/03/1377882303.db2.gz	RRZQZMPCPSSBKV-UHFFFAOYSA-N	0	3	336.439	3.272	20	30		EGEDHN
N#Cc1ccc2[nH]cc(CN3CC[C@H]4[C@@H]3CCC(=O)N4CC3CC3)c2c1	ZINC001140113263	1378010444	/nfs/dbraw/zinc/01/04/44/1378010444.db2.gz	USUXOKCJXQLRIW-PMACEKPBSA-N	0	3	348.450	3.015	20	30		EGEDHN
Cn1cnc2cc(CN3CCC[C@@H](Oc4ccc(C#N)cc4)C3)ccc21	ZINC001140511875	1378076709	/nfs/dbraw/zinc/07/67/09/1378076709.db2.gz	LQSZTUDUHJWBDQ-LJQANCHMSA-N	0	3	346.434	3.488	20	30		EGEDHN
O=C(c1ccccc1)N1CCCC[C@@H]1CNCC#Cc1ccccc1	ZINC001272923108	1378083223	/nfs/dbraw/zinc/08/32/23/1378083223.db2.gz	FAKYQQAGWYSGCQ-OAQYLSRUSA-N	0	3	332.447	3.323	20	30		EGEDHN
N#CCCCN1C[C@@]2(CC1=O)CCCCN2CCc1cccc(F)c1	ZINC001273134294	1378088918	/nfs/dbraw/zinc/08/89/18/1378088918.db2.gz	IZYAJIOPCAQNCO-FQEVSTJZSA-N	0	3	343.446	3.129	20	30		EGEDHN
C=C(C)CN1CC[C@]2(CCN(Cc3cccc(Cl)c3OC)C2)C1=O	ZINC001273285293	1378094823	/nfs/dbraw/zinc/09/48/23/1378094823.db2.gz	PNISSBQJQQNJFI-IBGZPJMESA-N	0	3	348.874	3.349	20	30		EGEDHN
C=C(C)CN1C[C@@]2(CC1=O)CCCC[N@@H+]2Cc1cc(F)ccc1[O-]	ZINC001273284415	1378094873	/nfs/dbraw/zinc/09/48/73/1378094873.db2.gz	HYBFJNZKFZSONK-IBGZPJMESA-N	0	3	332.419	3.064	20	30		EGEDHN
C=C(C)CN1C[C@@]2(CC1=O)CCCC[N@H+]2Cc1cc(F)ccc1[O-]	ZINC001273284415	1378094877	/nfs/dbraw/zinc/09/48/77/1378094877.db2.gz	HYBFJNZKFZSONK-IBGZPJMESA-N	0	3	332.419	3.064	20	30		EGEDHN
Cc1cc(Cl)ccc1CN(C)[C@@H](C)CNC(=O)c1cc(C#N)c[nH]1	ZINC001282365338	1378501888	/nfs/dbraw/zinc/50/18/88/1378501888.db2.gz	DSCYEVGFQNWUJT-ZDUSSCGKSA-N	0	3	344.846	3.099	20	30		EGEDHN
N#Cc1ccc2c(CN3C[C@@H]4C[C@H]3CN4Cc3ccccc3)c[nH]c2c1	ZINC001142921434	1378509441	/nfs/dbraw/zinc/50/94/41/1378509441.db2.gz	MRDNTBBMYBCQCN-PMACEKPBSA-N	0	3	342.446	3.498	20	30		EGEDHN
Cc1cncnc1OC1CCN(Cc2c[nH]c3cc(C#N)ccc23)CC1	ZINC001142930342	1378511380	/nfs/dbraw/zinc/51/13/80/1378511380.db2.gz	JDCDKKZICDIGFL-UHFFFAOYSA-N	0	3	347.422	3.181	20	30		EGEDHN
O=C1C=C2CN(Cc3ccc(F)c(OC(F)(F)F)c3)CCC2S1	ZINC001143443177	1378597507	/nfs/dbraw/zinc/59/75/07/1378597507.db2.gz	XIGUMINTWPIAJY-ZDUSSCGKSA-N	0	3	347.333	3.498	20	30		EGEDHN
C=CCC(C)(C)C(=O)N(C(=N)N)c1cc(C(=O)OCC)ccc1C	ZINC001144076734	1378679636	/nfs/dbraw/zinc/67/96/36/1378679636.db2.gz	LOJYJMYPJFIMDM-UHFFFAOYSA-N	0	3	331.416	3.000	20	30		EGEDHN
N#Cc1cccc(O[C@H]2CCCN(Cc3ccc4cc[nH]c4n3)C2)c1	ZINC001144186507	1378694694	/nfs/dbraw/zinc/69/46/94/1378694694.db2.gz	WWAQFAKBPUARNR-IBGZPJMESA-N	0	3	332.407	3.478	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc3sccc3c2)cc1	ZINC001146316264	1378814436	/nfs/dbraw/zinc/81/44/36/1378814436.db2.gz	FVDZRHABBMEYLJ-UHFFFAOYSA-N	0	3	335.432	3.293	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2ocnc2C)CCCCC1	ZINC001146702703	1378903214	/nfs/dbraw/zinc/90/32/14/1378903214.db2.gz	ZQBMZPKPAHCELB-HOTGVXAUSA-N	0	3	345.487	3.330	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2ocnc2C)CCCC1	ZINC001146819432	1378927000	/nfs/dbraw/zinc/92/70/00/1378927000.db2.gz	AHJVMJXRQNJNFD-CABCVRRESA-N	0	3	333.476	3.492	20	30		EGEDHN
CC(C)CCC(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001146981024	1378950970	/nfs/dbraw/zinc/95/09/70/1378950970.db2.gz	UUSLYQQOWHCDIV-UHFFFAOYSA-N	0	3	325.456	3.029	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CC2(C1)CCN(Cc1csc(C)c1)C2	ZINC001147140913	1378975312	/nfs/dbraw/zinc/97/53/12/1378975312.db2.gz	RUQJUJFTPRVKJS-MRXNPFEDSA-N	0	3	348.512	3.072	20	30		EGEDHN
C=CCCC(=O)N1CC2(C1)CCN(CCc1ccccc1Cl)C2	ZINC001147187747	1378984078	/nfs/dbraw/zinc/98/40/78/1378984078.db2.gz	PNILSKBAUOPNON-UHFFFAOYSA-N	0	3	332.875	3.383	20	30		EGEDHN
C=C(C)CCC(=O)N1CC2(C1)CCN(Cc1ccc3c(c1)COC3)C2	ZINC001147639910	1379054720	/nfs/dbraw/zinc/05/47/20/1379054720.db2.gz	HAPAACWOFXHFHU-UHFFFAOYSA-N	0	3	340.467	3.107	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CC2(C1)CCN(Cc1ccsc1)C2)OCC	ZINC001147652191	1379055854	/nfs/dbraw/zinc/05/58/54/1379055854.db2.gz	DBSGYVRWNRSNDZ-QGZVFWFLSA-N	0	3	348.512	3.154	20	30		EGEDHN
C[C@H](CN(C)C(=O)CCC(C)(F)F)NCc1ccc(F)c(C#N)c1	ZINC001283629572	1379065856	/nfs/dbraw/zinc/06/58/56/1379065856.db2.gz	KIBGULZCDWJMKS-GFCCVEGCSA-N	0	3	341.377	3.069	20	30		EGEDHN
C[C@@H](CN(C)C(=O)C1CC2(CCC2)C1)NCc1ccc(C#N)s1	ZINC001283654230	1379085294	/nfs/dbraw/zinc/08/52/94/1379085294.db2.gz	SKEVKHHPFCUCCS-ZDUSSCGKSA-N	0	3	331.485	3.137	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC2(C1)CCN(Cc1ccc(OC)cc1)C2	ZINC001148147531	1379124644	/nfs/dbraw/zinc/12/46/44/1379124644.db2.gz	VWEQJROKKBDBDX-KRWDZBQOSA-N	0	3	342.483	3.332	20	30		EGEDHN
C=CCCCC(=O)N1CC2(C1)CCN(CC[C@@H]1CC1(Cl)Cl)C2	ZINC001148199671	1379132983	/nfs/dbraw/zinc/13/29/83/1379132983.db2.gz	OYTHMEWXBZOUHE-CQSZACIVSA-N	0	3	345.314	3.461	20	30		EGEDHN
C=C1CCC(C(=O)N2CC3(C2)CCN(CCOCC2CCC2)C3)CC1	ZINC001148226789	1379136912	/nfs/dbraw/zinc/13/69/12/1379136912.db2.gz	SLVOVZZYTYSEFM-UHFFFAOYSA-N	0	3	346.515	3.084	20	30		EGEDHN
C=CCCC1(C(=O)N2CC3(C2)CCN(CCC(F)(F)F)C3)CC1	ZINC001148262198	1379140698	/nfs/dbraw/zinc/14/06/98/1379140698.db2.gz	HGAOYUXRJHYQHR-UHFFFAOYSA-N	0	3	330.394	3.220	20	30		EGEDHN
Cc1ccc([C@H](C)C(=O)NCCNCc2ccc(F)c(C#N)c2)cc1	ZINC001148278787	1379143349	/nfs/dbraw/zinc/14/33/49/1379143349.db2.gz	AWOSOHMHUWFCJB-HNNXBMFYSA-N	0	3	339.414	3.015	20	30		EGEDHN
CC(C)c1ccc(C(=O)NCCNCc2ccc(C#N)c(F)c2)cc1	ZINC001148845498	1379282024	/nfs/dbraw/zinc/28/20/24/1379282024.db2.gz	GUABGKVSQKCRNI-UHFFFAOYSA-N	0	3	339.414	3.340	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@H](C)CCCc3ccccc3)C2)C1	ZINC001148851323	1379284081	/nfs/dbraw/zinc/28/40/81/1379284081.db2.gz	RBHNNDUDDUAAEF-GOSISDBHSA-N	0	3	326.484	3.366	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)C[C@H](C)CCc3ccccc3)C2)C1	ZINC001148874179	1379289016	/nfs/dbraw/zinc/28/90/16/1379289016.db2.gz	LOAMYAGVGLRUQX-GOSISDBHSA-N	0	3	326.484	3.366	20	30		EGEDHN
C=CCC1(C(=O)N2CC3(C2)CCN(CCOCC(C)C)C3)CCCC1	ZINC001148934655	1379299884	/nfs/dbraw/zinc/29/98/84/1379299884.db2.gz	JLTPGWXNMIHYML-UHFFFAOYSA-N	0	3	348.531	3.330	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)C/C=C/c2cccc(F)c2)C1	ZINC001149868341	1379458254	/nfs/dbraw/zinc/45/82/54/1379458254.db2.gz	GPOARPRWPWFWJI-ZLHKHBAESA-N	0	3	346.446	3.012	20	30		EGEDHN
Cc1c2ccccc2oc1C(=O)NCCNCc1ccc(C#N)s1	ZINC001150019360	1379485073	/nfs/dbraw/zinc/48/50/73/1379485073.db2.gz	JLGVCIDEUQXPLS-UHFFFAOYSA-N	0	3	339.420	3.194	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H]1CN(Cc2cccc(C)c2)CCCO1	ZINC001150077806	1379491542	/nfs/dbraw/zinc/49/15/42/1379491542.db2.gz	CAXWGAVFBAXEPH-LJQANCHMSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H]1CN([C@H](C)c2cccc(C)c2)CCCO1	ZINC001150086154	1379492911	/nfs/dbraw/zinc/49/29/11/1379492911.db2.gz	XVHXNZXPVFDJGC-IEBWSBKVSA-N	0	3	344.499	3.475	20	30		EGEDHN
C#CCCN1CCCO[C@@H](CNC(=O)[C@H](CCC)CC2CCCC2)C1	ZINC001150404577	1379549631	/nfs/dbraw/zinc/54/96/31/1379549631.db2.gz	ZMUQDVNIQPOHDW-UXHICEINSA-N	0	3	348.531	3.213	20	30		EGEDHN
CC(C)Cc1ccc(C(=O)NCCNCc2cccc(C#N)c2)cc1	ZINC001150597298	1379577299	/nfs/dbraw/zinc/57/72/99/1379577299.db2.gz	MAKQELIIRPYPGT-UHFFFAOYSA-N	0	3	335.451	3.276	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)C(C)(C)c2ccc(C)cc2)C1	ZINC001150614742	1379580517	/nfs/dbraw/zinc/58/05/17/1379580517.db2.gz	YPYQIJXDNXWCLU-LJQANCHMSA-N	0	3	344.499	3.056	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2ccoc2CC)CC1	ZINC001151100344	1379661888	/nfs/dbraw/zinc/66/18/88/1379661888.db2.gz	SAYSMTLFZIYSDT-UHFFFAOYSA-N	0	3	334.460	3.019	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2ccc(C)cc2C)CC1	ZINC001151405981	1379712395	/nfs/dbraw/zinc/71/23/95/1379712395.db2.gz	RULLRMNQQLLAPS-UHFFFAOYSA-N	0	3	344.499	3.480	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)C2CCC(C3CC3)CC2)CC1	ZINC001151406496	1379712438	/nfs/dbraw/zinc/71/24/38/1379712438.db2.gz	MCDKIACMDMLMRD-UHFFFAOYSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)Cc2ccccc2C)CC1	ZINC001151406689	1379712521	/nfs/dbraw/zinc/71/25/21/1379712521.db2.gz	WSRRZZPEIOMFEQ-UHFFFAOYSA-N	0	3	344.499	3.101	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)C[C@@H]1C=CCC1	ZINC001151806860	1379785721	/nfs/dbraw/zinc/78/57/21/1379785721.db2.gz	OZWZORBVIGVENY-IAGOWNOFSA-N	0	3	325.456	3.241	20	30		EGEDHN
CC(C)(C)CC(C)(C)C(=O)NCCNCc1ccc(C#N)c(F)c1	ZINC001151938954	1379820382	/nfs/dbraw/zinc/82/03/82/1379820382.db2.gz	WLCQXMJSOFAIBT-UHFFFAOYSA-N	0	3	333.451	3.366	20	30		EGEDHN
C=C[C@@H](CC(=O)NCCNCc1sc(C)nc1C)c1ccccc1	ZINC001151942396	1379821446	/nfs/dbraw/zinc/82/14/46/1379821446.db2.gz	HRBFMMRMQSLWTD-INIZCTEOSA-N	0	3	343.496	3.326	20	30		EGEDHN
C=C[C@@H](CC(=O)NCCNCc1cnc(C)s1)c1ccccc1	ZINC001151942364	1379821553	/nfs/dbraw/zinc/82/15/53/1379821553.db2.gz	GQPQUPBGWJPQAO-HNNXBMFYSA-N	0	3	329.469	3.017	20	30		EGEDHN
Cc1ccccc1[C@H](C)C(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001152018695	1379840870	/nfs/dbraw/zinc/84/08/70/1379840870.db2.gz	YWGHTUIMNIYAEZ-HNNXBMFYSA-N	0	3	339.414	3.015	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC[C@@H](C)N(CC)Cc1ccc(C)nc1C	ZINC001152234805	1379891844	/nfs/dbraw/zinc/89/18/44/1379891844.db2.gz	PENMXPSLSQNLLE-SJLPKXTDSA-N	0	3	347.503	3.006	20	30		EGEDHN
CCCCO[C@H](C)C(=O)NC[C@@H](C)N(CC)Cc1cccc(C#N)c1	ZINC001152325687	1379909745	/nfs/dbraw/zinc/90/97/45/1379909745.db2.gz	ABVVPNZPTAQPGQ-IAGOWNOFSA-N	0	3	345.487	3.090	20	30		EGEDHN
CCN(Cc1cc(Cl)cc(Cl)c1)[C@H](C)CNC(=O)[C@H](C)C#N	ZINC001152413223	1379929548	/nfs/dbraw/zinc/92/95/48/1379929548.db2.gz	KKBWKERVTMFANV-VXGBXAGGSA-N	0	3	342.270	3.480	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)[C@@H](C)C1CC1	ZINC001152636038	1379960113	/nfs/dbraw/zinc/96/01/13/1379960113.db2.gz	CBWQJDKFULSNRH-KGLIPLIRSA-N	0	3	331.435	3.070	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)C1CC(C)C1	ZINC001152728800	1379976525	/nfs/dbraw/zinc/97/65/25/1379976525.db2.gz	AESCVFRFKJFRHE-XOYHFGRZSA-N	0	3	331.435	3.070	20	30		EGEDHN
CC1(C)CCC(C(=O)NCCNCc2ccc(F)c(C#N)c2)CC1	ZINC001152843613	1379986358	/nfs/dbraw/zinc/98/63/58/1379986358.db2.gz	TYFYWWPIOBRHMT-UHFFFAOYSA-N	0	3	331.435	3.120	20	30		EGEDHN
C[C@H]1CCCC[C@@H]1CC(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001153255321	1380045921	/nfs/dbraw/zinc/04/59/21/1380045921.db2.gz	ZNCXIDWRVJYREX-GOEBONIOSA-N	0	3	331.435	3.120	20	30		EGEDHN
C#CCC1(C(=O)NC[C@@H](C)N(CC)CCc2csc(C)n2)CCC1	ZINC001153776643	1380126914	/nfs/dbraw/zinc/12/69/14/1380126914.db2.gz	ODEJKGRLECEMQK-OAHLLOKOSA-N	0	3	347.528	3.014	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H](C)N(CC)Cc1ccccc1N(C)C	ZINC001154957952	1380381140	/nfs/dbraw/zinc/38/11/40/1380381140.db2.gz	SJTUDGYJGQKDIK-QGZVFWFLSA-N	0	3	331.504	3.436	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1ccccc1O[C@H](C)CC	ZINC001155513952	1380462993	/nfs/dbraw/zinc/46/29/93/1380462993.db2.gz	FMRGTDBNDFJADE-IAGOWNOFSA-N	0	3	330.472	3.327	20	30		EGEDHN
N#Cc1ncc(Cl)nc1NC[C@H](c1ccccc1)N1CCCC1	ZINC001156530281	1380588757	/nfs/dbraw/zinc/58/87/57/1380588757.db2.gz	INZVRRGPJBRXDN-OAHLLOKOSA-N	0	3	327.819	3.251	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1cc2c(s1)CCCCC2	ZINC001156734320	1380620004	/nfs/dbraw/zinc/62/00/04/1380620004.db2.gz	WLTHTXSNQPBSSZ-OAHLLOKOSA-N	0	3	332.513	3.481	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1c2ccccc2oc1CC	ZINC001157172221	1380794630	/nfs/dbraw/zinc/79/46/30/1380794630.db2.gz	LGXVZYOVGSYXOQ-OAHLLOKOSA-N	0	3	326.440	3.459	20	30		EGEDHN
C=CCCOCC(=O)NC[C@@H](C)N(CC)Cc1cc2ccccc2o1	ZINC001157203458	1380808658	/nfs/dbraw/zinc/80/86/58/1380808658.db2.gz	ORQPXJCZDQMFDA-MRXNPFEDSA-N	0	3	344.455	3.352	20	30		EGEDHN
CC1(CC(=O)NCCCNCc2cc(C#N)ccc2F)CCCC1	ZINC001157462028	1380910390	/nfs/dbraw/zinc/91/03/90/1380910390.db2.gz	OWIRQJZZCCNYCL-UHFFFAOYSA-N	0	3	331.435	3.264	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1ccccc1C	ZINC001157465381	1380917525	/nfs/dbraw/zinc/91/75/25/1380917525.db2.gz	XDHWKFJAXKBBQL-GOSISDBHSA-N	0	3	330.472	3.124	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1cccc(C)c1F	ZINC001157982422	1381093601	/nfs/dbraw/zinc/09/36/01/1381093601.db2.gz	SLMWGFBUACWRJJ-QGZVFWFLSA-N	0	3	348.462	3.263	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H](C)OCc1ccccc1C	ZINC001158283844	1381185314	/nfs/dbraw/zinc/18/53/14/1381185314.db2.gz	UTTRBLSFZPKAJO-AZUAARDMSA-N	0	3	344.499	3.399	20	30		EGEDHN
C#CCCCCCC(=O)N1CCCC[C@@H]1CN(C)CCOC1CCC1	ZINC001158316424	1381197454	/nfs/dbraw/zinc/19/74/54/1381197454.db2.gz	JTDBYYFAIWOSCR-LJQANCHMSA-N	0	3	348.531	3.452	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)CCCOCc1ccccc1	ZINC001158412504	1381237346	/nfs/dbraw/zinc/23/73/46/1381237346.db2.gz	MVPGYDNYSCDNGR-HXUWFJFHSA-N	0	3	344.499	3.482	20	30		EGEDHN
C=C(Cl)CN(C)C[C@H]1CCCCN1C(=O)CN(C)CC(C)(C)C	ZINC001158480572	1381261359	/nfs/dbraw/zinc/26/13/59/1381261359.db2.gz	OFLHRUJXHSMTGT-MRXNPFEDSA-N	0	3	343.943	3.030	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1ccc(C=C)cc1	ZINC001158507688	1381272652	/nfs/dbraw/zinc/27/26/52/1381272652.db2.gz	MTFZYWUDWAMDGB-HXUWFJFHSA-N	0	3	342.483	3.459	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)Cc1csc(C2CC2)n1	ZINC001158571686	1381305719	/nfs/dbraw/zinc/30/57/19/1381305719.db2.gz	WHOOGPZEBMMSBC-MRXNPFEDSA-N	0	3	333.501	3.062	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)CCN(C)c1ccccc1	ZINC001158612170	1381321399	/nfs/dbraw/zinc/32/13/99/1381321399.db2.gz	VNABLXDCBNXPEC-LJQANCHMSA-N	0	3	329.488	3.012	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1cc(C)c(CC)o1	ZINC001158732654	1381373944	/nfs/dbraw/zinc/37/39/44/1381373944.db2.gz	WPTPKMZKFNNKJJ-QGZVFWFLSA-N	0	3	348.487	3.280	20	30		EGEDHN
Cc1csc(C(=O)NCCCNCc2ccccc2C#N)c1Cl	ZINC001158734171	1381374692	/nfs/dbraw/zinc/37/46/92/1381374692.db2.gz	WBRMYQUVFZVTBK-UHFFFAOYSA-N	0	3	347.871	3.491	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1cc(C)ccc1C	ZINC001158787370	1381398383	/nfs/dbraw/zinc/39/83/83/1381398383.db2.gz	RGOHBMKJDZBSBU-LJQANCHMSA-N	0	3	344.499	3.433	20	30		EGEDHN
C=C(C)CCC(=O)N(C)[C@H](CNCc1cnc(Cl)s1)C1CC1	ZINC001755562059	1440874820	/nfs/dbraw/zinc/87/48/20/1440874820.db2.gz	GGXFJLGRNDBEPK-CQSZACIVSA-N	0	3	341.908	3.479	20	30		EGEDHN
C#CCN1CCC([C@H](C)NC(=O)[C@H](C)c2ccc(Cl)s2)CC1	ZINC001755851419	1440935022	/nfs/dbraw/zinc/93/50/22/1440935022.db2.gz	WLUJYWXNHRJFMH-OLZOCXBDSA-N	0	3	338.904	3.355	20	30		EGEDHN
C=CCCC(=O)NCCC1=CCN(CCc2ccccc2F)CC1	ZINC001159543906	1381824057	/nfs/dbraw/zinc/82/40/57/1381824057.db2.gz	FQUJZKQVZSCUID-UHFFFAOYSA-N	0	3	330.447	3.473	20	30		EGEDHN
N#Cc1ccc(CN2CC=C(CCNC(=O)[C@H]3[C@@H]4CCC[C@@H]43)CC2)cc1	ZINC001159732024	1381883346	/nfs/dbraw/zinc/88/33/46/1381883346.db2.gz	JXPKOXVMXMSIIQ-AERCQKQUSA-N	0	3	349.478	3.243	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C2C3CC4CC(C3)CC2C4)CC1	ZINC001160367445	1382085048	/nfs/dbraw/zinc/08/50/48/1382085048.db2.gz	LVDAULGJXBMRDT-UHFFFAOYSA-N	0	3	340.511	3.220	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc(C)n([C@@H](C)C3CC3)n2)CC1	ZINC001160559086	1382141929	/nfs/dbraw/zinc/14/19/29/1382141929.db2.gz	CHSHVQHBAPHWMY-INIZCTEOSA-N	0	3	342.487	3.101	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc(C)n([C@H](C)CC)n2)CC1	ZINC001160580933	1382147834	/nfs/dbraw/zinc/14/78/34/1382147834.db2.gz	YUPOLHTXJWRNKF-OAHLLOKOSA-N	0	3	330.476	3.101	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)Cn2c(C)cc3ccccc32)CC1	ZINC001160622847	1382154875	/nfs/dbraw/zinc/15/48/75/1382154875.db2.gz	GAEIWVUWMUMTJL-UHFFFAOYSA-N	0	3	337.467	3.274	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2coc3ccc(OC)cc32)CC1	ZINC001160641380	1382158786	/nfs/dbraw/zinc/15/87/86/1382158786.db2.gz	RHRFKRHGAVYALX-UHFFFAOYSA-N	0	3	340.423	3.379	20	30		EGEDHN
N#CCCN(Cc1ccc(Cl)cc1)C(=O)[C@@H](N)C1CCCCC1	ZINC001160739826	1382183720	/nfs/dbraw/zinc/18/37/20/1382183720.db2.gz	XMDJDTZRULKTLU-KRWDZBQOSA-N	0	3	333.863	3.490	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H](C)OCc2ccc(C)cc2)CC1	ZINC001160792794	1382196992	/nfs/dbraw/zinc/19/69/92/1382196992.db2.gz	KRTODKBFOFOPMQ-GOSISDBHSA-N	0	3	342.483	3.225	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)Cc2cccc3cccnc32)CC1	ZINC001160821929	1382209096	/nfs/dbraw/zinc/20/90/96/1382209096.db2.gz	SIWBBMBAARRQOZ-UHFFFAOYSA-N	0	3	335.451	3.102	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc3cc(F)ccc3[nH]2)CC1	ZINC001160856757	1382217465	/nfs/dbraw/zinc/21/74/65/1382217465.db2.gz	PAJUIDAUGGMWBI-UHFFFAOYSA-N	0	3	327.403	3.245	20	30		EGEDHN
C=CCN1CCC[C@H]1CNc1ccc(-c2ccc([N+](=O)[O-])cc2)nn1	ZINC001160953493	1382250206	/nfs/dbraw/zinc/25/02/06/1382250206.db2.gz	CBOMZGRGIMGUTM-INIZCTEOSA-N	0	3	339.399	3.114	20	30		EGEDHN
C[C@H](c1ccccc1)N(C(=O)[C@@H](N)CC(F)F)C1=CC(=O)CCC1	ZINC001161508875	1382426841	/nfs/dbraw/zinc/42/68/41/1382426841.db2.gz	IOMNULSSUKBISB-WBMJQRKESA-N	0	3	336.382	3.196	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc3cccnc3c2)CC1	ZINC001161530640	1382432311	/nfs/dbraw/zinc/43/23/11/1382432311.db2.gz	LQGUZCKBNNLHGS-UHFFFAOYSA-N	0	3	333.435	3.010	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cnn(C3CCCCC3)c2)CC1	ZINC001161660575	1382474097	/nfs/dbraw/zinc/47/40/97/1382474097.db2.gz	PLMXPTGOZNWHKQ-UHFFFAOYSA-N	0	3	342.487	3.326	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H]2CCCc3sc(C)nc32)CC1	ZINC001161678991	1382478604	/nfs/dbraw/zinc/47/86/04/1382478604.db2.gz	RRROPLRVBCQWCN-INIZCTEOSA-N	0	3	345.512	3.196	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C(C)(C)c2ccc(OC)cc2)CC1	ZINC001161919903	1382552513	/nfs/dbraw/zinc/55/25/13/1382552513.db2.gz	WVQBROOMNCHCMW-UHFFFAOYSA-N	0	3	342.483	3.297	20	30		EGEDHN
N#Cc1cccc(-c2cc(C(F)(F)F)cnc2-n2nccc2CN)c1	ZINC001162592587	1382802055	/nfs/dbraw/zinc/80/20/55/1382802055.db2.gz	JTGBGGYQZKXLEM-UHFFFAOYSA-N	0	3	343.312	3.283	20	30		EGEDHN
C[C@H](N)c1nc2ccccc2n1-c1ccc(Br)c(C#N)n1	ZINC001162776904	1382869432	/nfs/dbraw/zinc/86/94/32/1382869432.db2.gz	FZZNYMTYLJJYRL-VIFPVBQESA-N	0	3	342.200	3.074	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H](C)CCCC	ZINC001162798598	1382876286	/nfs/dbraw/zinc/87/62/86/1382876286.db2.gz	ZDNMUQZWBCRJAN-IBGZPJMESA-N	0	3	328.500	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CCC[C@@H]1CCC	ZINC001162850707	1382894975	/nfs/dbraw/zinc/89/49/75/1382894975.db2.gz	PRFLPQPCNICEMP-LEWJYISDSA-N	0	3	340.511	3.497	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CCCC[C@@H]1C	ZINC001162906550	1382911520	/nfs/dbraw/zinc/91/15/20/1382911520.db2.gz	NHTICAZDQGDQNH-PZJWPPBQSA-N	0	3	340.511	3.497	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C1CCC(F)CC1	ZINC001162919173	1382917070	/nfs/dbraw/zinc/91/70/70/1382917070.db2.gz	OHVLIOFNCUVVHD-UHFFFAOYSA-N	0	3	344.474	3.199	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)CC[C@@H](C)CC	ZINC001162964075	1382929248	/nfs/dbraw/zinc/92/92/48/1382929248.db2.gz	SFFOQKREYGJVMX-IBGZPJMESA-N	0	3	328.500	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CCCC[C@@H]1CC	ZINC001162970979	1382932950	/nfs/dbraw/zinc/93/29/50/1382932950.db2.gz	RQEOVFKTELWLMU-LEWJYISDSA-N	0	3	340.511	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1ccc(Cl)s1	ZINC001162992037	1382939739	/nfs/dbraw/zinc/93/97/39/1382939739.db2.gz	AZGVIYCDXMQRJD-UHFFFAOYSA-N	0	3	346.883	3.309	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@]1(C)CC=C(C)CC1	ZINC001163001946	1382944253	/nfs/dbraw/zinc/94/42/53/1382944253.db2.gz	RTIFGSNJAHRXSB-QFIPXVFZSA-N	0	3	338.495	3.417	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)c1cc2cc(Cl)ccc2[nH]1	ZINC001163709417	1383111181	/nfs/dbraw/zinc/11/11/81/1383111181.db2.gz	GUHVJTQROPNLQG-UHFFFAOYSA-N	0	3	326.227	3.283	20	30		EGEDHN
C#CCCCCC(=O)NCCC1(CNCc2nc(C)cs2)CC1	ZINC001164165988	1383161838	/nfs/dbraw/zinc/16/18/38/1383161838.db2.gz	IHAOFXDZCNXMPG-UHFFFAOYSA-N	0	3	333.501	3.021	20	30		EGEDHN
COc1cc(N2C[C@H](C)N(Cc3ccccc3)C[C@H]2C)ncc1C#N	ZINC001165201166	1383246766	/nfs/dbraw/zinc/24/67/66/1383246766.db2.gz	LLYFQVBIMYQKBT-JKSUJKDBSA-N	0	3	336.439	3.061	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1ccc2ncccc2c1	ZINC001165764947	1383341509	/nfs/dbraw/zinc/34/15/09/1383341509.db2.gz	MVMIYVHMENKZJV-UHFFFAOYSA-N	0	3	344.418	3.016	20	30		EGEDHN
N#Cc1ccccc1CNCC1(CCNC(=O)C2(F)CCCC2)CC1	ZINC001165899802	1383361064	/nfs/dbraw/zinc/36/10/64/1383361064.db2.gz	LOIZTBXJVLJPOQ-UHFFFAOYSA-N	0	3	343.446	3.217	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCCNCc1ccn(C(CC)CC)n1	ZINC001165929301	1383367001	/nfs/dbraw/zinc/36/70/01/1383367001.db2.gz	KNJQWQPKIVQPOI-LJQANCHMSA-N	0	3	334.508	3.442	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C[C@H]2CCC(C)(C)CO2)CC1	ZINC001166264851	1383407806	/nfs/dbraw/zinc/40/78/06/1383407806.db2.gz	FTCCDNQDGPMIPO-OAHLLOKOSA-N	0	3	342.911	3.210	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCC1(CNCc2ccc(C#N)cc2F)CC1	ZINC001166579196	1383440869	/nfs/dbraw/zinc/44/08/69/1383440869.db2.gz	FPRXOQDCOIQNHP-UHFFFAOYSA-N	0	3	343.446	3.286	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCC1(CNCc2c(C)onc2CC)CC1	ZINC001166696178	1383462787	/nfs/dbraw/zinc/46/27/87/1383462787.db2.gz	XORZVIWTOXIBSB-HUUCEWRRSA-N	0	3	347.503	3.380	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCCC1(CNCc2nc(C)cs2)CC1	ZINC001166746488	1383470390	/nfs/dbraw/zinc/47/03/90/1383470390.db2.gz	GGBFYAHIONLCQX-CQSZACIVSA-N	0	3	335.517	3.430	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCCC1(CNCC(=C)Br)CC1	ZINC001166755562	1383472289	/nfs/dbraw/zinc/47/22/89/1383472289.db2.gz	KVECAAYPOVLFOM-CQSZACIVSA-N	0	3	343.309	3.373	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCCC1(CNCc2conc2CC)CC1	ZINC001166765258	1383474486	/nfs/dbraw/zinc/47/44/86/1383474486.db2.gz	JZCOYWUJRDVCCS-HNNXBMFYSA-N	0	3	333.476	3.215	20	30		EGEDHN
C[C@@H]1C[C@H]1CC(=O)NCCC1(CNCc2cc(C#N)ccc2F)CC1	ZINC001167011068	1383516570	/nfs/dbraw/zinc/51/65/70/1383516570.db2.gz	AAVXSGIQFCBPRY-ZBFHGGJFSA-N	0	3	343.446	3.120	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCC1(CNCc2cccnc2OC)CC1	ZINC001167025902	1383522173	/nfs/dbraw/zinc/52/21/73/1383522173.db2.gz	QJNQRDSUHGURTR-LJQANCHMSA-N	0	3	345.487	3.069	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)[C@@H]2C[C@H]2CCC)CC1	ZINC001167118143	1383543270	/nfs/dbraw/zinc/54/32/70/1383543270.db2.gz	BLRNHWCKHUZDDW-ZIAGYGMSSA-N	0	3	343.309	3.207	20	30		EGEDHN
CC(C)(C(=O)NCCC1(CNCc2ccccc2C#N)CC1)C(F)F	ZINC001167136469	1383549348	/nfs/dbraw/zinc/54/93/48/1383549348.db2.gz	RTFUYNBAGJCIAN-UHFFFAOYSA-N	0	3	349.425	3.226	20	30		EGEDHN
CN1CC[C@H](Nc2nnc(-c3cccc(C#N)c3)cc2C(F)(F)F)C1	ZINC001167275804	1383582252	/nfs/dbraw/zinc/58/22/52/1383582252.db2.gz	ZYJVTVCEWGCGHJ-ZDUSSCGKSA-N	0	3	347.344	3.150	20	30		EGEDHN
N#Cc1ccccc1CNCC1(CCNC(=O)[C@H]2CC23CCC3)CC1	ZINC001167342713	1383603649	/nfs/dbraw/zinc/60/36/49/1383603649.db2.gz	AJORFKUHJIJVLC-GOSISDBHSA-N	0	3	337.467	3.125	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)[C@H]2C[C@@]2(C)CC)CC1	ZINC001167583370	1383678636	/nfs/dbraw/zinc/67/86/36/1383678636.db2.gz	KUCMFCHSCBBARI-UKRRQHHQSA-N	0	3	343.309	3.207	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)Cc1ccc(Cl)s1	ZINC001167816944	1383747156	/nfs/dbraw/zinc/74/71/56/1383747156.db2.gz	FWRREPGJNHDDLO-UHFFFAOYSA-N	0	3	347.871	3.112	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc(C3CC3)cn2)CC1	ZINC001167941155	1383774227	/nfs/dbraw/zinc/77/42/27/1383774227.db2.gz	SHXLSKBSLJPPBN-UHFFFAOYSA-N	0	3	333.863	3.201	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@H](C)[C@@H](C)C(C)(C)C	ZINC001168168756	1383832166	/nfs/dbraw/zinc/83/21/66/1383832166.db2.gz	SZCHLIZDLVTWGJ-CHWSQXEVSA-N	0	3	333.314	3.309	20	30		EGEDHN
C[C@@H](CC#N)N[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C(F)(F)F)C1	ZINC001168531096	1383931291	/nfs/dbraw/zinc/93/12/91/1383931291.db2.gz	UQNRMVWPRPAMNU-QJPTWQEYSA-N	0	3	335.370	3.209	20	30		EGEDHN
CN(C[C@@H]1CCCN1C)c1nc2c(c(C#N)c1C#N)CCCCCC2	ZINC001307145973	1383944937	/nfs/dbraw/zinc/94/49/37/1383944937.db2.gz	RUNZQSBZLUQZIM-HNNXBMFYSA-N	0	3	337.471	3.014	20	30		EGEDHN
C[C@H](CCCCNCc1cc(F)ccc1C#N)NC(=O)C1CCC1	ZINC001168730773	1383984156	/nfs/dbraw/zinc/98/41/56/1383984156.db2.gz	MZDIKEZSQNCEGJ-CQSZACIVSA-N	0	3	331.435	3.262	20	30		EGEDHN
CS[C@H](C)C(=O)N[C@H](C)CCCCNCc1ccccc1C#N	ZINC001169343981	1384138615	/nfs/dbraw/zinc/13/86/15/1384138615.db2.gz	VNVZNPPAAQMIOO-HUUCEWRRSA-N	0	3	333.501	3.074	20	30		EGEDHN
C=CCOc1ccccc1[C@H](C)N[C@@H]1CC[C@@H](C(=O)OCC)OC1	ZINC001169347735	1384138763	/nfs/dbraw/zinc/13/87/63/1384138763.db2.gz	KPFXTJFKOJSDRW-DAYGRLMNSA-N	0	3	333.428	3.013	20	30		EGEDHN
C[C@@H](C#N)C(=O)N[C@@H](C)CCCCNCc1nsc2ccccc12	ZINC001169822187	1384189016	/nfs/dbraw/zinc/18/90/16/1384189016.db2.gz	RRKWCHCQSUGXHP-KBPBESRZSA-N	0	3	344.484	3.221	20	30		EGEDHN
CCCc1nc(CNCCCC[C@@H](C)NC(=O)[C@H](C)C#N)cs1	ZINC001169849063	1384191197	/nfs/dbraw/zinc/19/11/97/1384191197.db2.gz	UBMFNRXGZMBTIO-ZIAGYGMSSA-N	0	3	336.505	3.020	20	30		EGEDHN
C#CCCCCC(=O)N[C@H](C)CCCCNCc1csc(C)n1	ZINC001170283742	1384282597	/nfs/dbraw/zinc/28/25/97/1384282597.db2.gz	YDHZFWBZKZIHLB-OAHLLOKOSA-N	0	3	335.517	3.410	20	30		EGEDHN
C#CCCCC(=O)N[C@@H](C)CCCCNCc1csc(CC)n1	ZINC001170452610	1384322798	/nfs/dbraw/zinc/32/27/98/1384322798.db2.gz	ACXQQSJBCYJIAC-HNNXBMFYSA-N	0	3	335.517	3.274	20	30		EGEDHN
Cc1cc[nH]c1C(=O)N[C@H](C)CCCCNCc1ccccc1C#N	ZINC001170514473	1384332942	/nfs/dbraw/zinc/33/29/42/1384332942.db2.gz	DXFZUKVHQSNOTJ-MRXNPFEDSA-N	0	3	338.455	3.273	20	30		EGEDHN
C=C[C@@H]1C[C@@]1(Nc1ccc([C@@H]2CCCCN2C)cn1)C(=O)OCC	ZINC001170924707	1384412307	/nfs/dbraw/zinc/41/23/07/1384412307.db2.gz	PMFXBZYMHQWIDZ-GJYPPUQNSA-N	0	3	329.444	3.158	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H](C)CCCCNCc1ccn(CC)n1	ZINC001170962113	1384418761	/nfs/dbraw/zinc/41/87/61/1384418761.db2.gz	HJKUAZJBSRCFEB-KRWDZBQOSA-N	0	3	346.519	3.436	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H](C)CCCCNCc1nccn1C(F)F	ZINC001171034712	1384433535	/nfs/dbraw/zinc/43/35/35/1384433535.db2.gz	CPIPUSVOLSXSRP-CQSZACIVSA-N	0	3	342.434	3.399	20	30		EGEDHN
CC(C)C[C@H]([NH2+][C@H]1CCc2cc(Cl)cc(Cl)c2C1)C(=O)N[O-]	ZINC001171073252	1384441870	/nfs/dbraw/zinc/44/18/70/1384441870.db2.gz	CGXPGIVDLVYPEZ-WFASDCNBSA-N	0	3	345.270	3.360	20	30		EGEDHN
C[C@@H](Cc1cccc(C#N)c1)n1nc(C(F)(F)F)c2c1CNCC2	ZINC001171228470	1384474430	/nfs/dbraw/zinc/47/44/30/1384474430.db2.gz	GSRCVCVWGYGBPK-NSHDSACASA-N	0	3	334.345	3.223	20	30		EGEDHN
C[C@@H](Cc1cccc(C#N)c1)N1C[C@@H](NC(=O)OC(C)(C)C)C[C@H]1C	ZINC001171233534	1384476138	/nfs/dbraw/zinc/47/61/38/1384476138.db2.gz	ANQUGLSNBLAHRN-DAYGRLMNSA-N	0	3	343.471	3.477	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1nc(C)oc1C	ZINC001316879196	1384663552	/nfs/dbraw/zinc/66/35/52/1384663552.db2.gz	JREZTPJZDUWLME-FZMZJTMJSA-N	0	3	325.840	3.017	20	30		EGEDHN
CC(C)(C)OC(=O)C1CCC(NC(=N)c2ccc(Cl)cn2)CC1	ZINC001171912054	1384679338	/nfs/dbraw/zinc/67/93/38/1384679338.db2.gz	LQVGROGIQWZACJ-UHFFFAOYSA-N	0	3	337.851	3.341	20	30		EGEDHN
CCc1ccc(CCN2CC[C@@H](NC(=O)C#CC(C)(C)C)C2)cc1	ZINC001316978550	1384737641	/nfs/dbraw/zinc/73/76/41/1384737641.db2.gz	ZIMQAVKWGADPHL-LJQANCHMSA-N	0	3	326.484	3.032	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)NCc1cccnc1Br	ZINC001172300498	1384763909	/nfs/dbraw/zinc/76/39/09/1384763909.db2.gz	WKVHSSRSERNPOW-LBPRGKRZSA-N	0	3	330.229	3.437	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)N1CCN(c2noc3ccccc32)CC1	ZINC001172308604	1384765699	/nfs/dbraw/zinc/76/56/99/1384765699.db2.gz	LLLRBTFUFJAPSS-MRXNPFEDSA-N	0	3	346.434	3.453	20	30		EGEDHN
CC(C)CC(=O)N1CCCN([C@H](C)Cc2ccc(C#N)cc2)CC1	ZINC001172310702	1384766124	/nfs/dbraw/zinc/76/61/24/1384766124.db2.gz	IEHKCSYMOIZFEA-QGZVFWFLSA-N	0	3	327.472	3.070	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)N1C[C@@H]2C[C@]2(NC(=O)OC(C)(C)C)C1	ZINC001172313593	1384767078	/nfs/dbraw/zinc/76/70/78/1384767078.db2.gz	DPWFRZHVPSYOBU-LIVBEALHSA-N	0	3	341.455	3.088	20	30		EGEDHN
CC(C)C[C@H]([NH2+][C@@H](C)CCc1c(F)cc(Cl)cc1F)C(=O)N[O-]	ZINC001172569458	1384813647	/nfs/dbraw/zinc/81/36/47/1384813647.db2.gz	FEWIHIICWSLZCE-BONVTDFDSA-N	0	3	348.821	3.449	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H](C)CCCCNCc1ocnc1C	ZINC001174694406	1385135500	/nfs/dbraw/zinc/13/55/00/1385135500.db2.gz	OAMBRBLCNWDKNB-INIZCTEOSA-N	0	3	333.476	3.331	20	30		EGEDHN
CC[C@H](F)C(=O)N[C@@H](C)CCCCNCc1cc(F)ccc1C#N	ZINC001174725400	1385140522	/nfs/dbraw/zinc/14/05/22/1385140522.db2.gz	OPCZFMXSDHBYAB-GUYCJALGSA-N	0	3	337.414	3.210	20	30		EGEDHN
CC(C)[C@H](F)C(=O)N[C@H](C)CCCCNCc1ccccc1C#N	ZINC001174781327	1385147961	/nfs/dbraw/zinc/14/79/61/1385147961.db2.gz	AWDKPSOPAQAYFR-QAPCUYQASA-N	0	3	333.451	3.317	20	30		EGEDHN
CC(C)[C@H](F)C(=O)N[C@@H](C)CCCCNCc1ccccc1C#N	ZINC001174781328	1385148112	/nfs/dbraw/zinc/14/81/12/1385148112.db2.gz	AWDKPSOPAQAYFR-YJBOKZPZSA-N	0	3	333.451	3.317	20	30		EGEDHN
CC#CCCCC(=O)N[C@H](C)CCCCNCc1ncc(C)s1	ZINC001174797975	1385150023	/nfs/dbraw/zinc/15/00/23/1385150023.db2.gz	DYXIOHGZDZWNSK-OAHLLOKOSA-N	0	3	335.517	3.410	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H](C)CCCCNCc2ocnc2C)CC1	ZINC001175082191	1385191664	/nfs/dbraw/zinc/19/16/64/1385191664.db2.gz	MCMRSDSIMCTVAE-HNNXBMFYSA-N	0	3	333.476	3.494	20	30		EGEDHN
CCN1CCN(c2ccc(Nc3cc(C#N)cc(OC)c3)cc2)CC1	ZINC001175782696	1385404418	/nfs/dbraw/zinc/40/44/18/1385404418.db2.gz	TXPUABFXEHOIKU-UHFFFAOYSA-N	0	3	336.439	3.452	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)C2CCC=CCC2)c1	ZINC001176262027	1385530685	/nfs/dbraw/zinc/53/06/85/1385530685.db2.gz	QRMZZAJTEYIPHY-UHFFFAOYSA-N	0	3	329.419	3.040	20	30		EGEDHN
C=CC[C@H](C(=O)NCCCNCc1conc1CC)c1ccccc1	ZINC001176697621	1385663270	/nfs/dbraw/zinc/66/32/70/1385663270.db2.gz	KZMOAJDOMZYYJG-SFHVURJKSA-N	0	3	341.455	3.193	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)C(=O)NCCCNCc1ocnc1C	ZINC001176746248	1385680764	/nfs/dbraw/zinc/68/07/64/1385680764.db2.gz	XUEVCYNPAZGODI-SFHVURJKSA-N	0	3	341.455	3.014	20	30		EGEDHN
C=C[C@H](C(=O)NCCCNCC=C(Cl)Cl)c1ccccc1	ZINC001176781662	1385694752	/nfs/dbraw/zinc/69/47/52/1385694752.db2.gz	IZPLTULPPBNLPN-AWEZNQCLSA-N	0	3	327.255	3.371	20	30		EGEDHN
C[C@](CNCc1ccc(C#N)cc1F)(NC(=O)C1CCCC1)C1CC1	ZINC001318677123	1385834799	/nfs/dbraw/zinc/83/47/99/1385834799.db2.gz	ZNRNZNMETCRLFI-HXUWFJFHSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)C1CCC(C)(C)CC1	ZINC001177160478	1385839607	/nfs/dbraw/zinc/83/96/07/1385839607.db2.gz	HRCRDPSBYNFCBN-UHFFFAOYSA-N	0	3	331.298	3.207	20	30		EGEDHN
C[C@](CNCc1cc(C#N)ccc1F)(NC(=O)C1=CCCC1)C1CC1	ZINC001318688460	1385841874	/nfs/dbraw/zinc/84/18/74/1385841874.db2.gz	FZJZMECIDCDGGL-HXUWFJFHSA-N	0	3	341.430	3.182	20	30		EGEDHN
CC[C@@H](CNC(=O)[C@H](C)c1ccccc1)NCc1ccc(C#N)s1	ZINC001698618802	1406254062	/nfs/dbraw/zinc/25/40/62/1406254062.db2.gz	LCFUKEUTSAZXQX-ZBFHGGJFSA-N	0	3	341.480	3.408	20	30		EGEDHN
CC1(C)CCCC[C@@H]1C(=O)NCCCNCc1ccccc1C#N	ZINC001177192376	1385854710	/nfs/dbraw/zinc/85/47/10/1385854710.db2.gz	GMFSYYQGZMFNMF-GOSISDBHSA-N	0	3	327.472	3.371	20	30		EGEDHN
C#CCC1(C(=O)NCCCNCc2cccc(Cl)n2)CCCCC1	ZINC001177217862	1385871067	/nfs/dbraw/zinc/87/10/67/1385871067.db2.gz	RKJWEVTTXVGRJM-UHFFFAOYSA-N	0	3	347.890	3.305	20	30		EGEDHN
CC(C)(C)C1CC(C(=O)NCCCNCc2ccc(C#N)cc2F)C1	ZINC001177251659	1385885044	/nfs/dbraw/zinc/88/50/44/1385885044.db2.gz	NYDUFZKICABVEK-UHFFFAOYSA-N	0	3	345.462	3.366	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)C2CCCC2)CCCC1	ZINC001319330612	1386061618	/nfs/dbraw/zinc/06/16/18/1386061618.db2.gz	FFOXBJNLUICJAA-UHFFFAOYSA-N	0	3	329.282	3.104	20	30		EGEDHN
N#Cc1ccccc1CNCCCCCCNC(=O)C1CC=CC1	ZINC001178092514	1386127259	/nfs/dbraw/zinc/12/72/59/1386127259.db2.gz	GUANCCPOMJXGRW-UHFFFAOYSA-N	0	3	325.456	3.291	20	30		EGEDHN
CC[C@H](C)C(=O)N1CC[C@H](NCC#Cc2ccc(Cl)cc2)[C@@H]1C	ZINC001178134416	1386138667	/nfs/dbraw/zinc/13/86/67/1386138667.db2.gz	CWJHMOPQXBAYAO-MPGHIAIKSA-N	0	3	332.875	3.317	20	30		EGEDHN
C/C=C(/C)C(=O)N1CC[C@H](NCC#Cc2ccccc2Cl)[C@@H]1C	ZINC001178442381	1386218749	/nfs/dbraw/zinc/21/87/49/1386218749.db2.gz	JUKBBHFCKXWMID-PIUYJEMPSA-N	0	3	330.859	3.237	20	30		EGEDHN
C=C(Cl)CNC[C@H](NC(=O)c1ccccc1O)C1CCCCC1	ZINC001319645545	1386229395	/nfs/dbraw/zinc/22/93/95/1386229395.db2.gz	AEQOFWNGOIHCDP-INIZCTEOSA-N	0	3	336.863	3.413	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](NCc2cc(Cl)ccc2F)[C@@H]1C	ZINC001178599658	1386259736	/nfs/dbraw/zinc/25/97/36/1386259736.db2.gz	HAHLXZSWPYPZDE-GUYCJALGSA-N	0	3	336.838	3.362	20	30		EGEDHN
C#CCC1(C(=O)NCCCCCCNCc2csc(C)n2)CCC1	ZINC001178666603	1386273211	/nfs/dbraw/zinc/27/32/11/1386273211.db2.gz	GGJBVCSUUXBFLW-UHFFFAOYSA-N	0	3	347.528	3.411	20	30		EGEDHN
C#CCC1(C(=O)NCCCCCCNCc2nc(C)cs2)CCC1	ZINC001178672534	1386274476	/nfs/dbraw/zinc/27/44/76/1386274476.db2.gz	NIBNEAIBBPMDBG-UHFFFAOYSA-N	0	3	347.528	3.411	20	30		EGEDHN
N#Cc1ccccc1CNCCCCCCNC(=O)[C@@H]1CCC1(F)F	ZINC001178792780	1386306572	/nfs/dbraw/zinc/30/65/72/1386306572.db2.gz	IYNGIDVBFORCBH-KRWDZBQOSA-N	0	3	349.425	3.370	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](NCc2ccc(C#N)s2)[C@@H]1C	ZINC001178795078	1386307015	/nfs/dbraw/zinc/30/70/15/1386307015.db2.gz	INHNNIQHQWSFRB-BBRMVZONSA-N	0	3	331.485	3.301	20	30		EGEDHN
C=C(Br)CNC[C@H]1[C@@H](C)CCCN1C(=O)c1ccco1	ZINC001319830864	1386324007	/nfs/dbraw/zinc/32/40/07/1386324007.db2.gz	GWUMSUAIEVUZEM-AAEUAGOBSA-N	0	3	341.249	3.019	20	30		EGEDHN
CC(C)CCC(=O)NC[C@H](NCc1cc(C#N)ccc1F)C(C)C	ZINC001319896977	1386372423	/nfs/dbraw/zinc/37/24/23/1386372423.db2.gz	RGPTXFFITXVHAO-SFHVURJKSA-N	0	3	333.451	3.364	20	30		EGEDHN
Cc1coc(C(=O)NC[C@H](NCc2ccc(C#N)cc2F)C(C)C)c1	ZINC001319934166	1386400788	/nfs/dbraw/zinc/40/07/88/1386400788.db2.gz	ARIQGAFXYRUZEG-KRWDZBQOSA-N	0	3	343.402	3.143	20	30		EGEDHN
CCC[C@H](OC)C(=O)NCCCCCCNCc1ccccc1C#N	ZINC001179220188	1386425823	/nfs/dbraw/zinc/42/58/23/1386425823.db2.gz	QVBISRCOXUOBPS-IBGZPJMESA-N	0	3	345.487	3.140	20	30		EGEDHN
C#CCCCCCC(=O)NCCCCCCNCc1nccn1CC	ZINC001179235148	1386428522	/nfs/dbraw/zinc/42/85/22/1386428522.db2.gz	HNRFVWLRCLJXJQ-UHFFFAOYSA-N	0	3	346.519	3.253	20	30		EGEDHN
N#Cc1ccc(F)cc1CNCCCCCCNC(=O)CCCF	ZINC001179269116	1386435710	/nfs/dbraw/zinc/43/57/10/1386435710.db2.gz	FLTMVYLKOTYDKI-UHFFFAOYSA-N	0	3	337.414	3.213	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCCCCCNCc1ccn(CC)n1	ZINC001179306327	1386445095	/nfs/dbraw/zinc/44/50/95/1386445095.db2.gz	HDJIAEKLMJXEQP-IAGOWNOFSA-N	0	3	334.508	3.127	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCCCCCCNCc1ccn(CC)n1	ZINC001179340124	1386456674	/nfs/dbraw/zinc/45/66/74/1386456674.db2.gz	TYKXUNQMZSLNBO-KRWDZBQOSA-N	0	3	334.508	3.272	20	30		EGEDHN
N#Cc1ccccc1CNCCCCCCNC(=O)[C@H]1C[C@H]2C[C@H]2C1	ZINC001179344095	1386457572	/nfs/dbraw/zinc/45/75/72/1386457572.db2.gz	AQFNZXFZBBAFBO-PMOLBWCYSA-N	0	3	339.483	3.371	20	30		EGEDHN
C=C1CCC(C(=O)NCCCCCCN[C@H](C)c2nnc(C)[nH]2)CC1	ZINC001179481211	1386493718	/nfs/dbraw/zinc/49/37/18/1386493718.db2.gz	AAFZDDHNSSXDHF-OAHLLOKOSA-N	0	3	347.507	3.187	20	30		EGEDHN
CC(F)(F)CC(=O)NCCCCCCNCc1ccccc1C#N	ZINC001179499122	1386499206	/nfs/dbraw/zinc/49/92/06/1386499206.db2.gz	MMFCPLNBTYQERX-UHFFFAOYSA-N	0	3	337.414	3.370	20	30		EGEDHN
C=CC1(CC(=O)N2CC[C@H](NCc3cncn3C)[C@@H]2C)CCCCC1	ZINC001179714584	1386562680	/nfs/dbraw/zinc/56/26/80/1386562680.db2.gz	AVEBUNZRQLUGQJ-WMZOPIPTSA-N	0	3	344.503	3.026	20	30		EGEDHN
COc1ccccc1[C@@H](CNc1cccc(CC#N)n1)N1CCCC1	ZINC001320359766	1386586838	/nfs/dbraw/zinc/58/68/38/1386586838.db2.gz	YWRQAUYFRWYIHT-GOSISDBHSA-N	0	3	336.439	3.405	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CCC2)C[C@@]1(C)CNCc1cc(F)ccc1C#N	ZINC001180356938	1386773231	/nfs/dbraw/zinc/77/32/31/1386773231.db2.gz	YDPQPQMUWYTYID-JLTOFOAXSA-N	0	3	343.446	3.072	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](C)[C@](C)(CNC/C(Cl)=C/Cl)C1	ZINC001181314854	1386975417	/nfs/dbraw/zinc/97/54/17/1386975417.db2.gz	HTQIGGRQAGISPK-HMPIOBDVSA-N	0	3	331.287	3.183	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)c1cccc2[nH]ccc21	ZINC001322246945	1387119041	/nfs/dbraw/zinc/11/90/41/1387119041.db2.gz	BORRGZZHGVPKAP-OAHLLOKOSA-N	0	3	346.434	3.290	20	30		EGEDHN
C[C@H](CN(C)Cc1cccc(C#N)c1)NC(=O)c1cc2ccccc2[nH]1	ZINC001322291409	1387143498	/nfs/dbraw/zinc/14/34/98/1387143498.db2.gz	ANFHTAVUMKPUQR-OAHLLOKOSA-N	0	3	346.434	3.290	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2oc(C)nc2C)C1	ZINC001182306004	1387143798	/nfs/dbraw/zinc/14/37/98/1387143798.db2.gz	SKVPWVYSQBZSRU-BXTJHSDWSA-N	0	3	347.503	3.468	20	30		EGEDHN
Cc1nc(C(C)C)ccc1CN[C@@H]1CCN(C(=O)C#CC(C)(C)C)C1	ZINC001182423274	1387164523	/nfs/dbraw/zinc/16/45/23/1387164523.db2.gz	YUXDXWLFDCIJOM-GOSISDBHSA-N	0	3	341.499	3.253	20	30		EGEDHN
C[C@@H](N[C@@H]1CCN(C(=O)C#CC(C)(C)C)C1)c1ccc(F)c(F)c1	ZINC001182440446	1387166714	/nfs/dbraw/zinc/16/67/14/1387166714.db2.gz	DWAKJYIHWNBHQE-UKRRQHHQSA-N	0	3	334.410	3.266	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccc(N2CCSCC2)c(C)c1	ZINC001340075979	1390221296	/nfs/dbraw/zinc/22/12/96/1390221296.db2.gz	RTJVAGMNOUJDOX-MRXNPFEDSA-N	0	3	333.501	3.170	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N(C)[C@H](C)c1ccco1	ZINC001340207455	1390250423	/nfs/dbraw/zinc/25/04/23/1390250423.db2.gz	QHNFFVJKUHTJIP-CABCVRRESA-N	0	3	329.448	3.064	20	30		EGEDHN
C=C[C@H](COC)NCc1ccc2c(c1)CN(C(=O)OC(C)(C)C)CC2	ZINC001333306317	1390280887	/nfs/dbraw/zinc/28/08/87/1390280887.db2.gz	CLGITHXXZAAZNG-GOSISDBHSA-N	0	3	346.471	3.270	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1cc(F)ccc1OCC(F)(F)F	ZINC001341310928	1390469381	/nfs/dbraw/zinc/46/93/81/1390469381.db2.gz	WUBSDDUJUIUVSJ-NSHDSACASA-N	0	3	334.313	3.389	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccccc1OC[C@H]1CCCCO1	ZINC001341493936	1390494098	/nfs/dbraw/zinc/49/40/98/1390494098.db2.gz	VDNRUUUIDFCEOV-CVEARBPZSA-N	0	3	332.444	3.257	20	30		EGEDHN
CCS[C@@H](C(=O)C(C#N)c1nc(N)c2ccccc2n1)C(C)C	ZINC001342547750	1390624845	/nfs/dbraw/zinc/62/48/45/1390624845.db2.gz	DFLDJYHWKAVRNO-SWLSCSKDSA-N	0	3	328.441	3.166	20	30		EGEDHN
CC1CCN(c2ccc(F)cc2NC(=O)[C@H](N)CCCCC#N)CC1	ZINC001342807928	1390656885	/nfs/dbraw/zinc/65/68/85/1390656885.db2.gz	CXSOKHLDJUFQIO-MRXNPFEDSA-N	0	3	346.450	3.412	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N(C)Cc1csc(Br)c1	ZINC001343181901	1390697821	/nfs/dbraw/zinc/69/78/21/1390697821.db2.gz	UPWYNYQTGUJHQN-NSHDSACASA-N	0	3	331.279	3.153	20	30		EGEDHN
C[C@H](NC(=O)C(C#N)C(=O)[C@@H]1C[C@H]1F)c1ccc(Cl)cc1Cl	ZINC001343442780	1390714199	/nfs/dbraw/zinc/71/41/99/1390714199.db2.gz	SFRIIIDTAKOHDV-CTLRHGHPSA-N	0	3	343.185	3.237	20	30		EGEDHN
N#CC(C(=O)[C@@H]1CCCSC1)c1nccn1Cc1ccccc1	ZINC001343703941	1390732047	/nfs/dbraw/zinc/73/20/47/1390732047.db2.gz	FQVZISDVVWOLOE-HZPDHXFCSA-N	0	3	325.437	3.251	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CCCN(C)C2)nnc1N1CC[C@H](C)[C@@H](C)C1	ZINC001343786603	1390736921	/nfs/dbraw/zinc/73/69/21/1390736921.db2.gz	GGLFCPYMJWILNY-ULQDDVLXSA-N	0	3	331.508	3.146	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N1CCC(c2nc3c(s2)CCC3)CC1	ZINC001344946336	1390827039	/nfs/dbraw/zinc/82/70/39/1390827039.db2.gz	INIOPCBUZJXMFJ-AWEZNQCLSA-N	0	3	333.501	3.021	20	30		EGEDHN
COc1cccc([C@@H]2CCN(C(=O)[C@H](N)CCCCC#N)C2(C)C)c1	ZINC001349848531	1391375607	/nfs/dbraw/zinc/37/56/07/1391375607.db2.gz	CEUWWTILFCJLFD-ZWKOTPCHSA-N	0	3	343.471	3.201	20	30		EGEDHN
C=C(Br)CN[C@H](C)[C@@H]1CCCCN1C(=O)C(C)(C)F	ZINC001479817433	1392408908	/nfs/dbraw/zinc/40/89/08/1392408908.db2.gz	GLQAIQQIIWHZJC-NEPJUHHUSA-N	0	3	335.261	3.002	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1cnc2cc[nH]c2c1	ZINC001479824358	1392413096	/nfs/dbraw/zinc/41/30/96/1392413096.db2.gz	MHXSPDQWYUAHOM-CXAGYDPISA-N	0	3	346.862	3.288	20	30		EGEDHN
C[C@H](CNC(=O)c1ccccc1Cl)NCc1ccc(F)c(C#N)c1	ZINC001480577059	1392798995	/nfs/dbraw/zinc/79/89/95/1392798995.db2.gz	RZMRWTAHQUJCKM-GFCCVEGCSA-N	0	3	345.805	3.259	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1ccc(C)c2cccnc12	ZINC001480781244	1392929843	/nfs/dbraw/zinc/92/98/43/1392929843.db2.gz	PBCYUWDBLBHADW-CQSZACIVSA-N	0	3	331.847	3.394	20	30		EGEDHN
Cc1cc(C(C)(C)C)cc(C)c1CN(C)CCNC(=O)[C@@H](C)C#N	ZINC001480851541	1392982830	/nfs/dbraw/zinc/98/28/30/1392982830.db2.gz	YOCWCZWWYXPHRS-INIZCTEOSA-N	0	3	329.488	3.309	20	30		EGEDHN
CCN(CCNC(=O)c1ccc(Cl)cc1)Cc1cccc(C#N)c1	ZINC001481013395	1393089469	/nfs/dbraw/zinc/08/94/69/1393089469.db2.gz	RDSSGYSADLOHAP-UHFFFAOYSA-N	0	3	341.842	3.464	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2coc(C3CCC3)n2)CCCC1	ZINC001481909943	1394591817	/nfs/dbraw/zinc/59/18/17/1394591817.db2.gz	CZZSYOJKYFFXAU-UHFFFAOYSA-N	0	3	337.851	3.327	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1cn(C(C)C)nc1C)C1CC1	ZINC001481947648	1394612226	/nfs/dbraw/zinc/61/22/26/1394612226.db2.gz	WABOUWYTHQVXBD-KRWDZBQOSA-N	0	3	338.883	3.013	20	30		EGEDHN
Cc1scc(C(=O)NC[C@H](C)CNCc2ccccc2C#N)c1C	ZINC001482104685	1394748892	/nfs/dbraw/zinc/74/88/92/1394748892.db2.gz	ADQPAABJZTXQEI-CYBMUJFWSA-N	0	3	341.480	3.392	20	30		EGEDHN
Cc1ccc(C(=O)N(C)[C@H](C)CNCc2ccc(F)c(C#N)c2)cc1	ZINC001482357294	1394920356	/nfs/dbraw/zinc/92/03/56/1394920356.db2.gz	OIKZBIUIECOWCU-OAHLLOKOSA-N	0	3	339.414	3.256	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cccc2ccncc21)C(C)C	ZINC001698977341	1406748522	/nfs/dbraw/zinc/74/85/22/1406748522.db2.gz	HMBWFICQUDSYBF-KRWDZBQOSA-N	0	3	331.847	3.331	20	30		EGEDHN
CC(C)C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccc(C#N)cc1F	ZINC001484387331	1395352202	/nfs/dbraw/zinc/35/22/02/1395352202.db2.gz	NVPKMRZGWIPIMG-VBUUOAMHSA-N	0	3	343.446	3.213	20	30		EGEDHN
C=C(Cl)CN[C@H](C)c1ccc(CNC(=O)[C@H](CC)N(C)C)cc1	ZINC001484560461	1395443199	/nfs/dbraw/zinc/44/31/99/1395443199.db2.gz	FHXSWLFNSJJHLL-PBHICJAKSA-N	0	3	337.895	3.046	20	30		EGEDHN
Cc1ccc(F)c(C(=O)NC[C@@H](C)N(C)Cc2ccc(C#N)cc2)c1	ZINC001485357290	1395830510	/nfs/dbraw/zinc/83/05/10/1395830510.db2.gz	NBTOKWHYKBMTQW-OAHLLOKOSA-N	0	3	339.414	3.256	20	30		EGEDHN
CCCC[C@@H](CNCc1ccc(C#N)s1)NC(=O)CC(F)(F)F	ZINC001485461820	1395936687	/nfs/dbraw/zinc/93/66/87/1395936687.db2.gz	QZKASJAHJYCNOF-NSHDSACASA-N	0	3	347.406	3.337	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)CC[C@H](C)OC)CC1	ZINC001505395858	1396283660	/nfs/dbraw/zinc/28/36/60/1396283660.db2.gz	ZRELAFFZCOGSSZ-HNNXBMFYSA-N	0	3	330.900	3.115	20	30		EGEDHN
C=C(Br)CN[C@@H](CNC(=O)c1cccc(F)c1)C(C)C	ZINC001496522305	1396712905	/nfs/dbraw/zinc/71/29/05/1396712905.db2.gz	YMGAPRMHONMFMU-AWEZNQCLSA-N	0	3	343.240	3.078	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](C)CN(C)Cc2cccc(C#N)c2)sc1C	ZINC001498442287	1396996527	/nfs/dbraw/zinc/99/65/27/1396996527.db2.gz	APRFLHGHIYLWDC-CQSZACIVSA-N	0	3	341.480	3.487	20	30		EGEDHN
CCC1(C(=O)NC[C@@H](NCc2cc(C#N)ccc2F)C2CC2)CCC1	ZINC001690164806	1404363210	/nfs/dbraw/zinc/36/32/10/1404363210.db2.gz	NKUQDLRLQQOPOZ-GOSISDBHSA-N	0	3	343.446	3.262	20	30		EGEDHN
C[C@H](C(=O)N1CCCC[C@@H]1CNCC#Cc1ccc(F)cc1)C1CC1	ZINC001690464273	1404593697	/nfs/dbraw/zinc/59/36/97/1404593697.db2.gz	VRXYMAWBWMUZPW-OXJNMPFZSA-N	0	3	342.458	3.194	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CCCC[C@H]1CNCc1ccnc(Cl)c1	ZINC001690468632	1404594668	/nfs/dbraw/zinc/59/46/68/1404594668.db2.gz	LSLJYIUYFDIZHK-INIZCTEOSA-N	0	3	347.890	3.255	20	30		EGEDHN
Cc1cc(C(=O)NCC[C@H](C)NCc2ccccc2C#N)oc1C	ZINC001690839347	1404770280	/nfs/dbraw/zinc/77/02/80/1404770280.db2.gz	KRTWGOJAASJQNS-AWEZNQCLSA-N	0	3	325.412	3.066	20	30		EGEDHN
Cc1sccc1CC(=O)NCC[C@@H](C)NCc1ccccc1C#N	ZINC001690867168	1404785628	/nfs/dbraw/zinc/78/56/28/1404785628.db2.gz	MQZDAMRVCUXRRI-CQSZACIVSA-N	0	3	341.480	3.155	20	30		EGEDHN
C[C@H](C#N)C(=O)NC[C@H]1C[C@@H](NCc2cccc(Cl)c2Cl)C1	ZINC001691087425	1405021398	/nfs/dbraw/zinc/02/13/98/1405021398.db2.gz	QBAIXNPUDCUXBW-WZRBSPASSA-N	0	3	340.254	3.137	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@H](C)c2ccc(F)cc2F)C1	ZINC001691831523	1405545123	/nfs/dbraw/zinc/54/51/23/1405545123.db2.gz	PKOQHGHVHFYDCP-YRGRVCCFSA-N	0	3	342.817	3.305	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1cc(F)ccc1F)C1CC1	ZINC001732247616	1428490882	/nfs/dbraw/zinc/49/08/82/1428490882.db2.gz	YRUSSWLQYNHCAB-MRXNPFEDSA-N	0	3	328.790	3.205	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)NC(=O)c1csc(Cl)c1	ZINC001699382359	1412691375	/nfs/dbraw/zinc/69/13/75/1412691375.db2.gz	ZJIGDVNCOOKCKL-SECBINFHSA-N	0	3	339.873	3.243	20	30		EGEDHN
CC(F)(F)CC(=O)NC[C@@]1(C)CCCN(Cc2ccc(C#N)cc2)C1	ZINC001699875639	1413331303	/nfs/dbraw/zinc/33/13/03/1413331303.db2.gz	WETUXOQJYGGCLQ-GOSISDBHSA-N	0	3	349.425	3.322	20	30		EGEDHN
C=C(Br)CN[C@H](CNC(=O)c1ccccc1F)C(C)C	ZINC001732551113	1428733826	/nfs/dbraw/zinc/73/38/26/1428733826.db2.gz	AGQYUUVFRNFMRC-CQSZACIVSA-N	0	3	343.240	3.078	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)[C@@H](CC)SC)CC1	ZINC001700340240	1413818463	/nfs/dbraw/zinc/81/84/63/1413818463.db2.gz	NUYIFDCZHYCORM-OAHLLOKOSA-N	0	3	332.941	3.441	20	30		EGEDHN
C[C@@H](C#N)C(=O)N(C)CCN(C)[C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC001732575977	1428776176	/nfs/dbraw/zinc/77/61/76/1428776176.db2.gz	LCVNGMNYWLHEGT-STQMWFEESA-N	0	3	341.377	3.316	20	30		EGEDHN
CN(C(=O)CC1CCC1)[C@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001700718909	1414378223	/nfs/dbraw/zinc/37/82/23/1414378223.db2.gz	MFDJJKLRNFDPHE-QGZVFWFLSA-N	0	3	331.485	3.137	20	30		EGEDHN
C=C(Cn1c(C)nnc1N1C[C@H](C)N(CC)C[C@H]1C)c1ccccc1	ZINC001705742079	1417133358	/nfs/dbraw/zinc/13/33/58/1417133358.db2.gz	JDWJADBQTLHBBB-DLBZAZTESA-N	0	3	339.487	3.219	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@H](CC)OC2CCCCC2)C1	ZINC001707060496	1417176017	/nfs/dbraw/zinc/17/60/17/1417176017.db2.gz	LONSEKNEHZFVPF-UXLLHSPISA-N	0	3	342.911	3.351	20	30		EGEDHN
C[C@@H](CN(C)Cc1cccc(C#N)c1)NC(=O)c1ccoc1C1CC1	ZINC001733050865	1429188542	/nfs/dbraw/zinc/18/85/42/1429188542.db2.gz	UVUCKSZUIDWRNB-AWEZNQCLSA-N	0	3	337.423	3.279	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1cc(CCC)n[nH]1	ZINC001713001435	1417555010	/nfs/dbraw/zinc/55/50/10/1417555010.db2.gz	ZDSJEZAAVHMQOY-CZUORRHYSA-N	0	3	338.883	3.088	20	30		EGEDHN
CCCCC(=O)N1CCC[C@@H](N(C)Cc2ccc(OC)c(C#N)c2)C1	ZINC001713388467	1417999325	/nfs/dbraw/zinc/99/93/25/1417999325.db2.gz	YQLPBELPSUEJDU-GOSISDBHSA-N	0	3	343.471	3.180	20	30		EGEDHN
CCN(CCNC(=O)c1cc(C#N)c[nH]1)[C@H](C)c1ccc(Cl)cc1	ZINC001713482326	1418170501	/nfs/dbraw/zinc/17/05/01/1418170501.db2.gz	KVFVTLGGWCVTGJ-CYBMUJFWSA-N	0	3	344.846	3.353	20	30		EGEDHN
Cc1coc(C(=O)NCC[C@H]2CCN(Cc3ccc(C#N)s3)C2)c1	ZINC001713733560	1418524176	/nfs/dbraw/zinc/52/41/76/1418524176.db2.gz	FOPPMSMDFDKMJD-AWEZNQCLSA-N	0	3	343.452	3.163	20	30		EGEDHN
CC[C@@H](CC(=O)N1CC[C@H](NCc2ccc(C#N)s2)C1)C(C)C	ZINC001713933986	1418723094	/nfs/dbraw/zinc/72/30/94/1418723094.db2.gz	IOGTVUDPCZEDMB-GJZGRUSLSA-N	0	3	333.501	3.383	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)C[C@H](C)c2ccccc2OC)C1	ZINC001713964536	1418744284	/nfs/dbraw/zinc/74/42/84/1418744284.db2.gz	BKPCSRXNTMXEAP-QEJZJMRPSA-N	0	3	336.863	3.178	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1cc(C(C)(C)C)on1)C1CC1	ZINC001714167738	1418976713	/nfs/dbraw/zinc/97/67/13/1418976713.db2.gz	YAQOCCJGKUURCX-KRWDZBQOSA-N	0	3	339.867	3.213	20	30		EGEDHN
CC(C)c1occc1C(=O)NC[C@@H](C)NCc1ccc(F)c(C#N)c1	ZINC001714311321	1419091450	/nfs/dbraw/zinc/09/14/50/1419091450.db2.gz	ZXARFTNKSXWNRD-CYBMUJFWSA-N	0	3	343.402	3.322	20	30		EGEDHN
CC(F)(F)CC(=O)N[C@H]1CCC[C@H](NCc2ccccc2C#N)C1	ZINC001714410014	1419149575	/nfs/dbraw/zinc/14/95/75/1419149575.db2.gz	CNCSVVBWUGJXFY-HOTGVXAUSA-N	0	3	335.398	3.121	20	30		EGEDHN
C[C@H](CCNC(=O)c1ccc(F)cc1)NCc1cc(C#N)ccc1F	ZINC001714456129	1419188812	/nfs/dbraw/zinc/18/88/12/1419188812.db2.gz	LZBQQKYPRXVWGM-CYBMUJFWSA-N	0	3	343.377	3.135	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)N(C)C(=O)c1ccc(Cl)o1	ZINC001714549863	1419276382	/nfs/dbraw/zinc/27/63/82/1419276382.db2.gz	RGIDRKOBYNRIEN-JTQLQIEISA-N	0	3	337.832	3.116	20	30		EGEDHN
C=C(Br)CNC[C@@](C)(NC(=O)C1CC(C)(C)C1)C1CC1	ZINC001715109804	1419852158	/nfs/dbraw/zinc/85/21/58/1419852158.db2.gz	PYROEBKCEMHACD-MRXNPFEDSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)Cn1ccc2ccccc21)C(C)C	ZINC001715727894	1420313581	/nfs/dbraw/zinc/31/35/81/1420313581.db2.gz	IWXRQHUWTKVIFM-MRXNPFEDSA-N	0	3	333.863	3.124	20	30		EGEDHN
CC(C)c1scnc1C(=O)N[C@H](C)CNCc1ccc(C#N)s1	ZINC001715954116	1420420339	/nfs/dbraw/zinc/42/03/39/1420420339.db2.gz	GDLXXEJPXNHPPU-LLVKDONJSA-N	0	3	348.497	3.108	20	30		EGEDHN
N#Cc1cc(CNC2(CNC(=O)CC3CCCC3)CC2)ccc1F	ZINC001716674662	1420830969	/nfs/dbraw/zinc/83/09/69/1420830969.db2.gz	ITTPUMUNOCHYAN-UHFFFAOYSA-N	0	3	329.419	3.016	20	30		EGEDHN
N#Cc1cccc(CNC2(CNC(=O)C3CCCCCC3)CC2)c1	ZINC001716677281	1420833111	/nfs/dbraw/zinc/83/31/11/1420833111.db2.gz	UEUBXDOTSKGKLY-UHFFFAOYSA-N	0	3	325.456	3.267	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)c2nc(C)oc2C)CC1	ZINC001717357073	1421292570	/nfs/dbraw/zinc/29/25/70/1421292570.db2.gz	WIVZHEYQQYROKP-UHFFFAOYSA-N	0	3	339.867	3.218	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1cc(C(C)C)no1	ZINC001717458205	1421387366	/nfs/dbraw/zinc/38/73/66/1421387366.db2.gz	LBXBCFZUCBWDOZ-UHFFFAOYSA-N	0	3	327.856	3.238	20	30		EGEDHN
C=C(Br)CNC[C@H](NC(=O)C1(CC)CC1)C(C)(C)C	ZINC001717966415	1421738020	/nfs/dbraw/zinc/73/80/20/1421738020.db2.gz	IQVDSAYVBMWVTJ-LBPRGKRZSA-N	0	3	331.298	3.206	20	30		EGEDHN
CCC(CC)C(=O)N1CCC[C@@H]1CNCC#Cc1ccc(F)cc1	ZINC001733333011	1429518045	/nfs/dbraw/zinc/51/80/45/1429518045.db2.gz	OVTBDZJXIBVSGD-LJQANCHMSA-N	0	3	330.447	3.194	20	30		EGEDHN
CC1(C(=O)NC[C@]2(C)CCCN(Cc3cccc(C#N)c3)C2)CCC1	ZINC001733463702	1429693631	/nfs/dbraw/zinc/69/36/31/1429693631.db2.gz	VNUHHZYVIOZYAK-FQEVSTJZSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=C(Cl)CN(CC1CC1)C1CCN(C(=O)C2CC(F)(F)C2)CC1	ZINC001723647538	1424511499	/nfs/dbraw/zinc/51/14/99/1424511499.db2.gz	QHKYSBIVZJMIFJ-UHFFFAOYSA-N	0	3	346.849	3.487	20	30		EGEDHN
CC(C)CCC(=O)N1CCC[C@H]1CN(C)Cc1cccc(C#N)c1	ZINC001725035556	1425457238	/nfs/dbraw/zinc/45/72/38/1425457238.db2.gz	KGNFQDVVXSMVSL-IBGZPJMESA-N	0	3	327.472	3.417	20	30		EGEDHN
CCc1ccc(C(=O)NC[C@H](C)N(C)Cc2cccc(C#N)c2)cc1	ZINC001725195392	1425747711	/nfs/dbraw/zinc/74/77/11/1425747711.db2.gz	MYUDHEGJDHJCPG-INIZCTEOSA-N	0	3	335.451	3.371	20	30		EGEDHN
Cc1cccc(C(=O)NC[C@H](C)NCc2ccc(C#N)s2)c1Cl	ZINC001731626643	1427677291	/nfs/dbraw/zinc/67/72/91/1427677291.db2.gz	CXROAXSTMBWLLT-LBPRGKRZSA-N	0	3	347.871	3.490	20	30		EGEDHN
C[C@@H](CNC(=O)CC(C1CC1)C1CC1)NCc1ccc(C#N)s1	ZINC001731641867	1427701414	/nfs/dbraw/zinc/70/14/14/1427701414.db2.gz	XFXMAWWRSLRXOA-LBPRGKRZSA-N	0	3	331.485	3.040	20	30		EGEDHN
C[C@@H](CCNC(=O)c1ccc(Cl)o1)NCc1cc(C#N)ccc1F	ZINC001731722844	1427795087	/nfs/dbraw/zinc/79/50/87/1427795087.db2.gz	KLKJTQAMYLDJDI-NSHDSACASA-N	0	3	349.793	3.242	20	30		EGEDHN
C=C(Cl)CN[C@H](C)c1ccc(CNC(=O)CCc2c[nH]cn2)cc1	ZINC001733681868	1429892344	/nfs/dbraw/zinc/89/23/44/1429892344.db2.gz	LOFKGSADGLRTJO-CQSZACIVSA-N	0	3	346.862	3.062	20	30		EGEDHN
C=C(Cl)CN[C@H](C)c1ccc(CNC(=O)CCc2cnc[nH]2)cc1	ZINC001733681868	1429892352	/nfs/dbraw/zinc/89/23/52/1429892352.db2.gz	LOFKGSADGLRTJO-CQSZACIVSA-N	0	3	346.862	3.062	20	30		EGEDHN
C=CCCCCCN1CCOC2(CCN(C(=O)[C@@H]3C[C@H]3C)CC2)C1	ZINC001733909844	1437728628	/nfs/dbraw/zinc/72/86/28/1437728628.db2.gz	WPBBTYBMXWKSLU-QZTJIDSGSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(Br)CNC[C@H](C1CC1)N(C)C(=O)C1CCCCC1	ZINC001734292463	1438023015	/nfs/dbraw/zinc/02/30/15/1438023015.db2.gz	ONRCKTJKZAXNAJ-OAHLLOKOSA-N	0	3	343.309	3.302	20	30		EGEDHN
CC(C)(C)[C@H](CNCc1ccc(C#N)cc1F)NC(=O)C1(C)CC1	ZINC001734559934	1438158070	/nfs/dbraw/zinc/15/80/70/1438158070.db2.gz	FNGPKXRJDNTHFF-INIZCTEOSA-N	0	3	331.435	3.118	20	30		EGEDHN
CCN(CC#Cc1ccccc1)CCCNC(=O)[C@H]1C[C@H]1C(C)C	ZINC001752222412	1440156609	/nfs/dbraw/zinc/15/66/09/1440156609.db2.gz	GPBLIJCWSCOLDO-PMACEKPBSA-N	0	3	326.484	3.158	20	30		EGEDHN
CC#CCN(CCCNC(=O)c1ccc2nc(C)sc2c1)C1CC1	ZINC001752283571	1440165123	/nfs/dbraw/zinc/16/51/23/1440165123.db2.gz	UNTJGPJXXWMKTN-UHFFFAOYSA-N	0	3	341.480	3.212	20	30		EGEDHN
C=C(C)CN1CCC(N(CCC)C(=O)CCc2c(C)n[nH]c2C)CC1	ZINC001752441786	1440181579	/nfs/dbraw/zinc/18/15/79/1440181579.db2.gz	MGVZMUAAQXDFQJ-UHFFFAOYSA-N	0	3	346.519	3.238	20	30		EGEDHN
CCC(CC)CC(=O)NC[C@@H](NCC#Cc1ccc(F)cc1)C1CC1	ZINC001752490368	1440186529	/nfs/dbraw/zinc/18/65/29/1440186529.db2.gz	KRQDAPXJVITFFN-HXUWFJFHSA-N	0	3	344.474	3.488	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC[C@H](CN(C)CC#Cc2ccccc2)C1	ZINC001752498312	1440187887	/nfs/dbraw/zinc/18/78/87/1440187887.db2.gz	XYWNXGUYUBTFNY-AZUAARDMSA-N	0	3	326.484	3.255	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001752650933	1440197935	/nfs/dbraw/zinc/19/79/35/1440197935.db2.gz	MCGFEJCSXICAOQ-WKILWMFISA-N	0	3	329.419	3.036	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C(CCC)CCC)C1	ZINC001752661912	1440198438	/nfs/dbraw/zinc/19/84/38/1440198438.db2.gz	SOTCIMFNJITYHR-HDJSIYSDSA-N	0	3	331.298	3.348	20	30		EGEDHN
CC[C@H](C)[C@@H](C)C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001752672943	1440199033	/nfs/dbraw/zinc/19/90/33/1440199033.db2.gz	ITOYGKJCXVMPTF-RMHZUWNSSA-N	0	3	331.435	3.116	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001752750976	1440204945	/nfs/dbraw/zinc/20/49/45/1440204945.db2.gz	MCGFEJCSXICAOQ-IYBDPMFKSA-N	0	3	329.419	3.036	20	30		EGEDHN
CCC1(C(=O)N2CCCC[C@@H]2CNCC#Cc2ccc(F)cc2)CC1	ZINC001752830003	1440225109	/nfs/dbraw/zinc/22/51/09/1440225109.db2.gz	LDHGYCVEQVTCPS-LJQANCHMSA-N	0	3	342.458	3.338	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)Cc2ccc(CC(C)C)cc2)C1	ZINC001752837387	1440228518	/nfs/dbraw/zinc/22/85/18/1440228518.db2.gz	SRFYYFRCHGRCLG-RXVVDRJESA-N	0	3	340.511	3.278	20	30		EGEDHN
C[C@H](CNC(=O)CC(C)(C)C1CC1)NCc1ccc(F)c(C#N)c1	ZINC001752869939	1440236996	/nfs/dbraw/zinc/23/69/96/1440236996.db2.gz	HLGVTSADIOOWIU-CYBMUJFWSA-N	0	3	331.435	3.118	20	30		EGEDHN
Cc1ccc(CCC(=O)NC[C@H](C)NCc2ccc(C#N)s2)cc1	ZINC001752887546	1440240210	/nfs/dbraw/zinc/24/02/10/1440240210.db2.gz	YNLUVINBRWSYGA-HNNXBMFYSA-N	0	3	341.480	3.155	20	30		EGEDHN
CC#CCN(C)[C@H]1CCCN(C(=O)c2ccc(C(F)(F)F)s2)C1	ZINC001752999717	1440263863	/nfs/dbraw/zinc/26/38/63/1440263863.db2.gz	GSFOVTIPKVDAFO-LBPRGKRZSA-N	0	3	344.402	3.327	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1cc2ccccc2nc1C	ZINC001753007407	1440266098	/nfs/dbraw/zinc/26/60/98/1440266098.db2.gz	NEXRELXIXCWMAK-CYBMUJFWSA-N	0	3	331.847	3.394	20	30		EGEDHN
C[C@H](CCNC(=O)[C@@H](C)c1cccs1)NCc1ccccc1C#N	ZINC001753013243	1440267503	/nfs/dbraw/zinc/26/75/03/1440267503.db2.gz	CSQMZQHLNWPGAI-CABCVRRESA-N	0	3	341.480	3.408	20	30		EGEDHN
C[C@H](CCNC(=O)[C@@H](C)c1ccsc1)NCc1ccccc1C#N	ZINC001753013388	1440267703	/nfs/dbraw/zinc/26/77/03/1440267703.db2.gz	JEQGSBVYQNOTQS-CABCVRRESA-N	0	3	341.480	3.408	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1CCCNC(=O)c1cnn2ccccc12	ZINC001753035989	1440274622	/nfs/dbraw/zinc/27/46/22/1440274622.db2.gz	OMRKSELYNYLAHG-HNNXBMFYSA-N	0	3	346.862	3.061	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1CCCNC(=O)[C@H]1[C@H]2[C@@H]1[C@@H]1CC[C@H]2C1	ZINC001753039392	1440275766	/nfs/dbraw/zinc/27/57/66/1440275766.db2.gz	AZPGNQDAJDVPQL-RFSXOUPVSA-N	0	3	336.907	3.392	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCN(C)Cc1cccc2cccnc21	ZINC001753059873	1440282830	/nfs/dbraw/zinc/28/28/30/1440282830.db2.gz	YSYDMHULNSCAFZ-UHFFFAOYSA-N	0	3	325.456	3.385	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCN(C)[C@H](C)c2cccc(Cl)c2)nc1	ZINC001753071498	1440288610	/nfs/dbraw/zinc/28/86/10/1440288610.db2.gz	PWEZTTDROFGGGI-CQSZACIVSA-N	0	3	341.842	3.139	20	30		EGEDHN
C=CCC1(C(=O)NCCN(CC)C[C@H]2CC(C)(C)CO2)CCCC1	ZINC001753095578	1440302412	/nfs/dbraw/zinc/30/24/12/1440302412.db2.gz	BOBXWMHXMOABFD-QGZVFWFLSA-N	0	3	336.520	3.376	20	30		EGEDHN
Cc1ccc(CN2CCC[C@@H]2CNC(=O)C#CC(C)(C)C)cc1C	ZINC001753103414	1440305245	/nfs/dbraw/zinc/30/52/45/1440305245.db2.gz	SUKAMGCHPWKGPQ-LJQANCHMSA-N	0	3	326.484	3.434	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H]1CCCN1Cc1cccc(COC)c1	ZINC001753108349	1440307326	/nfs/dbraw/zinc/30/73/26/1440307326.db2.gz	KTIABGUTOWJDOZ-SFHVURJKSA-N	0	3	330.472	3.126	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@@H]1CCN(Cc2c(C)nsc2C)C1	ZINC001753133343	1440317819	/nfs/dbraw/zinc/31/78/19/1440317819.db2.gz	VRBZUNFQLYNNLV-KRWDZBQOSA-N	0	3	347.528	3.282	20	30		EGEDHN
CCCN(CCNC(=O)C1CC2(CCC2)C1)Cc1ccc(C#N)cc1	ZINC001753146745	1440324649	/nfs/dbraw/zinc/32/46/49/1440324649.db2.gz	GOSCCXVFPZRIKV-UHFFFAOYSA-N	0	3	339.483	3.467	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCN(Cc2c(C)cccc2C)C2CC2)cn1	ZINC001753162081	1440334337	/nfs/dbraw/zinc/33/43/37/1440334337.db2.gz	ARCBPOOTBVPBJW-UHFFFAOYSA-N	0	3	347.462	3.074	20	30		EGEDHN
C=C(C)CN(CCNC(=O)c1cc(F)c(F)cc1Cl)C1CC1	ZINC001753163292	1440335280	/nfs/dbraw/zinc/33/52/80/1440335280.db2.gz	VDPVOBMJLRRVSL-UHFFFAOYSA-N	0	3	328.790	3.389	20	30		EGEDHN
CC(C)[C@H](F)C(=O)NCCCN(CC#Cc1ccccc1)C(C)C	ZINC001753290816	1440350256	/nfs/dbraw/zinc/35/02/56/1440350256.db2.gz	LABMYRSWMMBKSE-IBGZPJMESA-N	0	3	332.463	3.249	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@H]2CC[C@@H](C1)N2CC[C@H]1CCCCO1	ZINC001753310147	1440356361	/nfs/dbraw/zinc/35/63/61/1440356361.db2.gz	MTASIKKDZSIADA-FGTMMUONSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C(C)CN[C@@H](CNC(=O)c1ncoc1C(C)C)c1ccccc1	ZINC001753312522	1440357130	/nfs/dbraw/zinc/35/71/30/1440357130.db2.gz	SVOQRCBNSMTMJY-INIZCTEOSA-N	0	3	327.428	3.435	20	30		EGEDHN
C[C@@H](C(=O)NCC[C@H]1CCN(Cc2ccc(F)c(C#N)c2)C1)C1CC1	ZINC001753325076	1440366165	/nfs/dbraw/zinc/36/61/65/1440366165.db2.gz	PBDCDOWTQYHGPZ-CABCVRRESA-N	0	3	343.446	3.072	20	30		EGEDHN
C#CCCCCCC(=O)NCC1CN(Cc2c(C)cccc2C)C1	ZINC001753407527	1440392403	/nfs/dbraw/zinc/39/24/03/1440392403.db2.gz	NFVUGNHKRJHXOV-UHFFFAOYSA-N	0	3	326.484	3.435	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N(C)[C@@H]1CCN(CCOCc2ccccc2)C1	ZINC001753444386	1440403183	/nfs/dbraw/zinc/40/31/83/1440403183.db2.gz	QBSWUNBJNHYQJD-CTNGQTDRSA-N	0	3	344.499	3.338	20	30		EGEDHN
C#CCC1(C(=O)N(C)[C@H]2CCN(C[C@@H]3CCCCO3)C2)CCCCC1	ZINC001753449419	1440405495	/nfs/dbraw/zinc/40/54/95/1440405495.db2.gz	FXFZPOORIPHCSE-OALUTQOASA-N	0	3	346.515	3.062	20	30		EGEDHN
C=CCC1(C(=O)N(C)[C@@H]2CCN(C[C@H]3CCCCO3)C2)CCCC1	ZINC001753451167	1440405941	/nfs/dbraw/zinc/40/59/41/1440405941.db2.gz	YMQPDQWXRPRIDQ-QZTJIDSGSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)CCc2cccc(OC)c2)C1	ZINC001753461351	1440410847	/nfs/dbraw/zinc/41/08/47/1440410847.db2.gz	KKKFZSQPPOQMLF-SFHVURJKSA-N	0	3	330.472	3.127	20	30		EGEDHN
CC[C@@H](CNC(=O)c1c(C)cccc1C)NCC#Cc1ccccc1	ZINC001753486834	1440418017	/nfs/dbraw/zinc/41/80/17/1440418017.db2.gz	AVRCGZPBHFNMOB-FQEVSTJZSA-N	0	3	334.463	3.453	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@H](CC)NCc2cc(C)ccc2OC)C1	ZINC001753490215	1440419324	/nfs/dbraw/zinc/41/93/24/1440419324.db2.gz	QYAUEBWKJVBNCK-QGZVFWFLSA-N	0	3	330.472	3.344	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H](CCNCc2oc(CC)nc2C)C1	ZINC001753546136	1440434179	/nfs/dbraw/zinc/43/41/79/1440434179.db2.gz	FHNOPUIVNPWCMV-KRWDZBQOSA-N	0	3	345.487	3.067	20	30		EGEDHN
C#CCCCC(=O)N1CCC2(CCN(CC#Cc3ccccc3)C2)CC1	ZINC001753604322	1440447637	/nfs/dbraw/zinc/44/76/37/1440447637.db2.gz	YZQOELPFWMKHDU-UHFFFAOYSA-N	0	3	348.490	3.156	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)c1sccc1Cl	ZINC001753614352	1440449371	/nfs/dbraw/zinc/44/93/71/1440449371.db2.gz	MAOGDJVEKQUYJX-GFCCVEGCSA-N	0	3	347.871	3.429	20	30		EGEDHN
C[C@H](CNCc1cc(F)ccc1C#N)CNC(=O)C12CCC(CC1)C2	ZINC001753621553	1440450526	/nfs/dbraw/zinc/45/05/26/1440450526.db2.gz	PFLSGZDGZPISBT-ZUIJCZDSSA-N	0	3	343.446	3.120	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)C1CCC2(CC2)CC1	ZINC001753625493	1440451240	/nfs/dbraw/zinc/45/12/40/1440451240.db2.gz	LMLAERWLLWWIQF-MRXNPFEDSA-N	0	3	339.483	3.371	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CO[C@H]2CCCC[C@@H]2C)CCCC1	ZINC001753669467	1440461449	/nfs/dbraw/zinc/46/14/49/1440461449.db2.gz	SNJHRVWGFJBLRF-HOCLYGCPSA-N	0	3	342.911	3.353	20	30		EGEDHN
C[C@H](CNCC#Cc1ccc(Cl)cc1)N(C)C(=O)CC(F)(F)F	ZINC001753680658	1440464557	/nfs/dbraw/zinc/46/45/57/1440464557.db2.gz	JTDXTUABKZNZHC-GFCCVEGCSA-N	0	3	346.780	3.080	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccccc1Cl)N(C)C(=O)CCC1CC1	ZINC001753684086	1440465224	/nfs/dbraw/zinc/46/52/24/1440465224.db2.gz	XYZFGZPPPDEIJV-HNNXBMFYSA-N	0	3	332.875	3.318	20	30		EGEDHN
Cc1cc(F)cc(C(=O)N(C)[C@H](C)CNCC#Cc2ccccc2)c1	ZINC001753715048	1440471573	/nfs/dbraw/zinc/47/15/73/1440471573.db2.gz	OOUWALZTDRBDMD-QGZVFWFLSA-N	0	3	338.426	3.236	20	30		EGEDHN
C[C@@H](CNCC=C(Cl)Cl)N(C)C(=O)CC#Cc1ccccc1	ZINC001753730258	1440475671	/nfs/dbraw/zinc/47/56/71/1440475671.db2.gz	XTRALEWIAJDWBV-AWEZNQCLSA-N	0	3	339.266	3.184	20	30		EGEDHN
CC(C)C[C@H](CNCc1ccc(C#N)c(F)c1)NC(=O)c1ccoc1	ZINC001753732977	1440476780	/nfs/dbraw/zinc/47/67/80/1440476780.db2.gz	LPLNGVJMLRQUOY-QGZVFWFLSA-N	0	3	343.402	3.225	20	30		EGEDHN
Cc1occc1C(=O)N[C@H](CNCc1ccc(C#N)s1)CC(C)C	ZINC001753734376	1440477148	/nfs/dbraw/zinc/47/71/48/1440477148.db2.gz	ZURDVRVVCVAXHA-AWEZNQCLSA-N	0	3	345.468	3.456	20	30		EGEDHN
C=C(Cl)CNC[C@H](CC(C)C)NC(=O)c1ccn2c(C)cnc2c1	ZINC001753734888	1440477271	/nfs/dbraw/zinc/47/72/71/1440477271.db2.gz	KZRHKTKWGAAOPD-INIZCTEOSA-N	0	3	348.878	3.129	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](NCc2csc(C)n2)[C@H](C)C1	ZINC001753755722	1440483090	/nfs/dbraw/zinc/48/30/90/1440483090.db2.gz	VUYDOGHLDVAWNC-CZUORRHYSA-N	0	3	335.517	3.380	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@H](C)[C@H]1CNCc1ccc(OC)nc1	ZINC001753808211	1440492169	/nfs/dbraw/zinc/49/21/69/1440492169.db2.gz	CGGYOGHMGWWUOO-FUHWJXTLSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=CCCC(=O)N1CCC(CCN(C)Cc2cnc(C)s2)CC1	ZINC001753818593	1440494831	/nfs/dbraw/zinc/49/48/31/1440494831.db2.gz	WJOHOOJOKMNDQC-UHFFFAOYSA-N	0	3	335.517	3.478	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)Cc1ccc(OC)cc1C)C(C)C	ZINC001753829898	1440499342	/nfs/dbraw/zinc/49/93/42/1440499342.db2.gz	COFLVMSSBYTTRR-QGZVFWFLSA-N	0	3	338.879	3.029	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@@H](NCc1sccc1Cl)C(C)C	ZINC001753830892	1440499643	/nfs/dbraw/zinc/49/96/43/1440499643.db2.gz	ZHJBSTNDFQIJKO-CQSZACIVSA-N	0	3	326.893	3.291	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)[C@H](C)C1CCC1)NCc1ccc(C#N)cc1F	ZINC001753832712	1440500197	/nfs/dbraw/zinc/50/01/97/1440500197.db2.gz	SLRAHVHFEMMNQM-AUUYWEPGSA-N	0	3	345.462	3.364	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)[C@@H](C)Cc1ccccc1F)C(C)C	ZINC001753837596	1440501531	/nfs/dbraw/zinc/50/15/31/1440501531.db2.gz	GRSYXPGLWGBFJQ-SUMWQHHRSA-N	0	3	340.870	3.487	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H]1C(=O)NC[C@@H](NCC#Cc1ccccc1)C(C)C	ZINC001753841359	1440502822	/nfs/dbraw/zinc/50/28/22/1440502822.db2.gz	XVLWZDDBNDRZQX-NJDAHSKKSA-N	0	3	340.511	3.451	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H]2[C@@H](CCN2Cc2oc(C)nc2C)C1	ZINC001753871815	1440517772	/nfs/dbraw/zinc/51/77/72/1440517772.db2.gz	HGSRSDBESFUTKZ-IRXDYDNUSA-N	0	3	331.460	3.071	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H]2[C@H](CCN2Cc2oc(CC)nc2C)C1	ZINC001753873355	1440518192	/nfs/dbraw/zinc/51/81/92/1440518192.db2.gz	SCZYWYPUBNRWGJ-IAGOWNOFSA-N	0	3	345.487	3.325	20	30		EGEDHN
CCCC(C)(C)C(=O)N(CC)CCNCc1ccc(C#N)c(F)c1	ZINC001754063781	1440537086	/nfs/dbraw/zinc/53/70/86/1440537086.db2.gz	HQSGAPLETGIHDS-UHFFFAOYSA-N	0	3	333.451	3.462	20	30		EGEDHN
N#Cc1ccc(CNC/C=C\CNC(=O)c2ccc3[nH]ccc3c2)cc1	ZINC001754163007	1440546194	/nfs/dbraw/zinc/54/61/94/1440546194.db2.gz	AVQAMYQRUXTJRG-UPHRSURJSA-N	0	3	344.418	3.115	20	30		EGEDHN
C[C@H](CNCC#Cc1ccc(F)cc1)NC(=O)CCCC(F)(F)F	ZINC001754246733	1440557019	/nfs/dbraw/zinc/55/70/19/1440557019.db2.gz	OOKZTHGAJNGUGG-CYBMUJFWSA-N	0	3	344.352	3.004	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](C)CN(C)Cc2ccc(OC)cc2)CC1	ZINC001754324099	1440579482	/nfs/dbraw/zinc/57/94/82/1440579482.db2.gz	ZCISWOSGIXYETC-INIZCTEOSA-N	0	3	330.472	3.378	20	30		EGEDHN
C=C(Cl)CNCCCN(C)C(=O)c1cc(-c2ccccc2)on1	ZINC001754383729	1440593563	/nfs/dbraw/zinc/59/35/63/1440593563.db2.gz	ZAGCKPCCFYMPAB-UHFFFAOYSA-N	0	3	333.819	3.146	20	30		EGEDHN
C=CCC(C)(C)C(=O)N(C)CCCNCc1cc(C#N)ccc1F	ZINC001754399539	1440594974	/nfs/dbraw/zinc/59/49/74/1440594974.db2.gz	GAKNVHZSLWFIKW-UHFFFAOYSA-N	0	3	331.435	3.238	20	30		EGEDHN
C#CCC1(C(=O)N(C)CCCNCc2conc2CC)CCCCC1	ZINC001754417567	1440597091	/nfs/dbraw/zinc/59/70/91/1440597091.db2.gz	BUNCHHHUBIBYOP-UHFFFAOYSA-N	0	3	345.487	3.149	20	30		EGEDHN
CC(C)(C)/C=C/C(=O)N[C@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001754434349	1440597741	/nfs/dbraw/zinc/59/77/41/1440597741.db2.gz	ACBTWUQOOXSNPI-GFOMBABLSA-N	0	3	343.446	3.284	20	30		EGEDHN
O=C(N[C@H](CNCC#Cc1ccccc1)C1CC1)C1CCCCCC1	ZINC001754436148	1440598053	/nfs/dbraw/zinc/59/80/53/1440598053.db2.gz	QNHKUCHMEIFPSE-OAQYLSRUSA-N	0	3	338.495	3.493	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](NCc3cnns3)[C@@H](CC)C2)CCC1	ZINC001754471480	1440605610	/nfs/dbraw/zinc/60/56/10/1440605610.db2.gz	ZDFXJNLMLSBTNQ-GOEBONIOSA-N	0	3	348.516	3.001	20	30		EGEDHN
C=CCCCCCN1CC[C@H]1CNC(=O)[C@H]1OCCc2ccccc21	ZINC001754501934	1440614654	/nfs/dbraw/zinc/61/46/54/1440614654.db2.gz	NGQJLWCLXNONFA-ICSRJNTNSA-N	0	3	342.483	3.237	20	30		EGEDHN
C#Cc1ccc(C(=O)NCC2(NCc3ccc(C)c(F)c3)CC2)cc1	ZINC001754521431	1440619793	/nfs/dbraw/zinc/61/97/93/1440619793.db2.gz	GJMKLWQSKWDBKG-UHFFFAOYSA-N	0	3	336.410	3.168	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)CCCC#CC)CC2)C1	ZINC001754536302	1440624699	/nfs/dbraw/zinc/62/46/99/1440624699.db2.gz	UCTADEYUEFWNGQ-GOSISDBHSA-N	0	3	336.907	3.493	20	30		EGEDHN
C=CCCC(=O)N1CCCC[C@H]1[C@@H]1CCN(Cc2cccnc2)C1	ZINC001754539685	1440625822	/nfs/dbraw/zinc/62/58/22/1440625822.db2.gz	UKPFAYLTTLQDSU-MOPGFXCFSA-N	0	3	327.472	3.251	20	30		EGEDHN
C=C(Cl)CN(CC1CC1)C1CCN(C(=O)COC(C)(C)C)CC1	ZINC001754548050	1440628500	/nfs/dbraw/zinc/62/85/00/1440628500.db2.gz	BNWVQBJGSDYNRP-UHFFFAOYSA-N	0	3	342.911	3.257	20	30		EGEDHN
C=CCC[C@H](C)[N@@H+]1CC[C@@]2(CCN(C(=O)c3ccccc3[O-])C2)C1	ZINC001754561843	1440634023	/nfs/dbraw/zinc/63/40/23/1440634023.db2.gz	FDQKNLSMRAAUKO-OXJNMPFZSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=CCC[C@H](C)[N@H+]1CC[C@@]2(CCN(C(=O)c3ccccc3[O-])C2)C1	ZINC001754561843	1440634024	/nfs/dbraw/zinc/63/40/24/1440634024.db2.gz	FDQKNLSMRAAUKO-OXJNMPFZSA-N	0	3	328.456	3.285	20	30		EGEDHN
Cc1nc(CN[C@H]2CCN(C(=O)C#CC(C)(C)C)[C@H](C)C2)sc1C	ZINC001754596814	1440641639	/nfs/dbraw/zinc/64/16/39/1440641639.db2.gz	ZJSULNVLKCVCRP-CJNGLKHVSA-N	0	3	347.528	3.279	20	30		EGEDHN
CC1(CC(=O)N2CCC[C@H]2CNCC#Cc2ccc(Cl)cc2)CC1	ZINC001754614501	1440644165	/nfs/dbraw/zinc/64/41/65/1440644165.db2.gz	AXAJKZWLMSTLAE-SFHVURJKSA-N	0	3	344.886	3.462	20	30		EGEDHN
C#CCCCCC(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1	ZINC001754625147	1440646272	/nfs/dbraw/zinc/64/62/72/1440646272.db2.gz	LPJUSBMFGHCMCT-UHFFFAOYSA-N	0	3	337.467	3.223	20	30		EGEDHN
C#CCCCCC(=O)N[C@@]1(C)CCN(Cc2ccc3cc[nH]c3c2)C1	ZINC001754672963	1440658776	/nfs/dbraw/zinc/65/87/76/1440658776.db2.gz	RPHOPQFUNSEXDN-NRFANRHFSA-N	0	3	337.467	3.442	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@]1(C)CCN(CCc2scnc2C)C1	ZINC001754677826	1440660628	/nfs/dbraw/zinc/66/06/28/1440660628.db2.gz	ASLAPAGVOWZNAM-YJBOKZPZSA-N	0	3	335.517	3.177	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@](C)(CNCc2oc(CC)nc2C)C1	ZINC001754704370	1440668712	/nfs/dbraw/zinc/66/87/12/1440668712.db2.gz	GUFWCRSFHLFURB-UXHICEINSA-N	0	3	347.503	3.476	20	30		EGEDHN
Cc1noc(C)c1CN1CCC(C)(CNC(=O)C#CC(C)(C)C)CC1	ZINC001754716435	1440671691	/nfs/dbraw/zinc/67/16/91/1440671691.db2.gz	RXLZEPRFJIYSTH-UHFFFAOYSA-N	0	3	345.487	3.059	20	30		EGEDHN
C#CCN1CCC(C)(CNC(=O)c2cccc(C(C)(C)C)c2)CC1	ZINC001754721037	1440673205	/nfs/dbraw/zinc/67/32/05/1440673205.db2.gz	ZMVXOTNRJQHWDE-UHFFFAOYSA-N	0	3	326.484	3.449	20	30		EGEDHN
C=CCN1CCC[C@](C)(CNC(=O)c2cc(F)cc3cccnc32)C1	ZINC001754730406	1440678895	/nfs/dbraw/zinc/67/88/95/1440678895.db2.gz	HIVNNOLWMYPBAX-HXUWFJFHSA-N	0	3	341.430	3.392	20	30		EGEDHN
CC#CCN1CCC[C@](C)(CNC(=O)[C@H](C)Cc2ccc(C)cc2)C1	ZINC001754735322	1440681957	/nfs/dbraw/zinc/68/19/57/1440681957.db2.gz	ZEMIWCBVKKWBPL-DENIHFKCSA-N	0	3	340.511	3.415	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@H](CNC(=O)[C@@H](C)c2ccccc2C)C1	ZINC001754744363	1440684016	/nfs/dbraw/zinc/68/40/16/1440684016.db2.gz	GPNLBEBNCGRPFR-DLBZAZTESA-N	0	3	348.437	3.195	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)CCCCCOCC)C2)CC1	ZINC001754785663	1440687630	/nfs/dbraw/zinc/68/76/30/1440687630.db2.gz	OXVNKMHFEQZHSQ-HXUWFJFHSA-N	0	3	348.531	3.167	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@H]1CC[C@H](C[NH2+][C@@H](C)c2nnc(C)[n-]2)CC1	ZINC001754833996	1440696306	/nfs/dbraw/zinc/69/63/06/1440696306.db2.gz	TVGFJHWXYVOJOJ-XIRDDKMYSA-N	0	3	347.507	3.043	20	30		EGEDHN
N#Cc1ccccc1CNCC[C@@H]1CCN(C(=O)C2(F)CCCC2)C1	ZINC001754920409	1440709152	/nfs/dbraw/zinc/70/91/52/1440709152.db2.gz	BCUXOCCLJNTHEY-MRXNPFEDSA-N	0	3	343.446	3.169	20	30		EGEDHN
C=CCCC(=O)NCc1ccccc1CN(C)C[C@@H]1CCCCO1	ZINC001754946207	1440713104	/nfs/dbraw/zinc/71/31/04/1440713104.db2.gz	ZKDDQKPKRINQDK-IBGZPJMESA-N	0	3	330.472	3.270	20	30		EGEDHN
C#CCN[C@H](C)c1ccc(CNC(=O)c2c3c[nH]nc3ccc2C)cc1	ZINC001754947539	1440713881	/nfs/dbraw/zinc/71/38/81/1440713881.db2.gz	OFMVVVOUOHUTQL-OAHLLOKOSA-N	0	3	346.434	3.085	20	30		EGEDHN
CC#CCN[C@H](C)c1ccc(CNC(=O)c2occ3c2CCC3)cc1	ZINC001754948041	1440714056	/nfs/dbraw/zinc/71/40/56/1440714056.db2.gz	FGPCKZGZHZMAIZ-OAHLLOKOSA-N	0	3	336.435	3.372	20	30		EGEDHN
C#CCN[C@@H](C)c1ccc(CNC(=O)CC[C@@H]2CC(C)(C)CO2)cc1	ZINC001754948356	1440714213	/nfs/dbraw/zinc/71/42/13/1440714213.db2.gz	HTKBLUOEXSGRDW-QFBILLFUSA-N	0	3	342.483	3.182	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC[C@H](CNCc2cc(F)ccc2C#N)CC1	ZINC001754949551	1440714555	/nfs/dbraw/zinc/71/45/55/1440714555.db2.gz	IVFPDDXMIALITH-RHDGDCLCSA-N	0	3	343.446	3.428	20	30		EGEDHN
CC#CCN[C@@H](C)c1ccc(CNC(=O)c2scnc2Cl)cc1	ZINC001754951349	1440715094	/nfs/dbraw/zinc/71/50/94/1440715094.db2.gz	QNORGIPHRKEFOE-LBPRGKRZSA-N	0	3	347.871	3.400	20	30		EGEDHN
C=CCN(C)Cc1ccccc1CNC(=O)Cc1csc(CC)n1	ZINC001754953316	1440715682	/nfs/dbraw/zinc/71/56/82/1440715682.db2.gz	JIBLNRDCUITCOV-UHFFFAOYSA-N	0	3	343.496	3.182	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC1(NCc2ccccc2N(C)C)CCC1	ZINC001754986527	1440723009	/nfs/dbraw/zinc/72/30/09/1440723009.db2.gz	JRSKVVJQTICADY-UHFFFAOYSA-N	0	3	343.515	3.483	20	30		EGEDHN
CCC[C@H](C)C(=O)N(C)CCCN(C)Cc1ccc(C#N)c(F)c1	ZINC001755035066	1440733901	/nfs/dbraw/zinc/73/39/01/1440733901.db2.gz	HHFARFAIQXLNRR-HNNXBMFYSA-N	0	3	333.451	3.414	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H]([C@H]2CCCN(C/C=C/Cl)C2)C1	ZINC001755048297	1440742620	/nfs/dbraw/zinc/74/26/20/1440742620.db2.gz	VQPIULDBWXJHSM-UCMWELRRSA-N	0	3	336.907	3.493	20	30		EGEDHN
COCC#CCN1CC[C@]2(C1)CCCN(C(=O)C(C)(C)CC(C)C)C2	ZINC001755079387	1440750220	/nfs/dbraw/zinc/75/02/20/1440750220.db2.gz	IXEDRAHHBWHEME-NRFANRHFSA-N	0	3	348.531	3.023	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)CC(C)(C)C(F)(F)F)C2	ZINC001755079724	1440750640	/nfs/dbraw/zinc/75/06/40/1440750640.db2.gz	PUSVHJLIRJZDJO-QGZVFWFLSA-N	0	3	344.421	3.303	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC[C@](CO)(NCc2ccc(C)cc2)C1	ZINC001755087349	1440750989	/nfs/dbraw/zinc/75/09/89/1440750989.db2.gz	BZNXIQJWDDZQCW-RXVVDRJESA-N	0	3	344.499	3.040	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@H](NCc3ncccc3C)[C@@H](C)C2)CCC1	ZINC001755117101	1440755120	/nfs/dbraw/zinc/75/51/20/1440755120.db2.gz	ZVJVVAQYCHIUQI-WMZOPIPTSA-N	0	3	327.472	3.073	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)[C@H](C)OCc2ccc(F)cc2)C(C)(C)C1	ZINC001755142967	1440761734	/nfs/dbraw/zinc/76/17/34/1440761734.db2.gz	FWXOJURGFCLSIL-MAUKXSAKSA-N	0	3	348.462	3.134	20	30		EGEDHN
C=C(C)CCN1CC(N2CCN(C(=O)[C@H](C)CCC(C)(C)C)CC2)C1	ZINC001755146079	1440762707	/nfs/dbraw/zinc/76/27/07/1440762707.db2.gz	JLOQZQXLGGJFRK-GOSISDBHSA-N	0	3	349.563	3.243	20	30		EGEDHN
COc1cccc(CN2CC[C@@H](NC(=O)C#CC(C)(C)C)C[C@@H]2C)c1	ZINC001755159466	1440764293	/nfs/dbraw/zinc/76/42/93/1440764293.db2.gz	HFPVJRNQUQLTNY-FUHWJXTLSA-N	0	3	342.483	3.214	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@@H]1CNC(=O)COCC1CC1	ZINC001755171984	1440769265	/nfs/dbraw/zinc/76/92/65/1440769265.db2.gz	HYDYFIXKZOEMSU-FQEVSTJZSA-N	0	3	342.483	3.095	20	30		EGEDHN
C=CCCCN1CCc2ccccc2[C@@H]1CNC(=O)C1=CCOCC1	ZINC001755171872	1440769463	/nfs/dbraw/zinc/76/94/63/1440769463.db2.gz	FOJQAQZMYXVKRR-FQEVSTJZSA-N	0	3	340.467	3.015	20	30		EGEDHN
CC[C@H](C)CCC(=O)N1CCC2(CCN(CC#CCOC)CC2)CC1	ZINC001755176055	1440770746	/nfs/dbraw/zinc/77/07/46/1440770746.db2.gz	RMMAUUMWTPLCQA-IBGZPJMESA-N	0	3	348.531	3.167	20	30		EGEDHN
C=C(C)CN1CCC(CO)(NC(=O)C[C@H](C)c2ccccc2C)CC1	ZINC001755181612	1440771269	/nfs/dbraw/zinc/77/12/69/1440771269.db2.gz	UCUGHOWPUQAGJB-SFHVURJKSA-N	0	3	344.499	3.008	20	30		EGEDHN
C=CCN(C)C[C@@H]1CCCN1C(=O)C(C)(C)c1ccc(OC)cc1	ZINC001755201049	1440779561	/nfs/dbraw/zinc/77/95/61/1440779561.db2.gz	OXRQQWRJBBNDDH-KRWDZBQOSA-N	0	3	330.472	3.082	20	30		EGEDHN
C=CCOCCN(C)C[C@@H]1CCCN1C(=O)c1cccc(Cl)c1	ZINC001755202048	1440780494	/nfs/dbraw/zinc/78/04/94/1440780494.db2.gz	YOFNCGFEKMEMDJ-KRWDZBQOSA-N	0	3	336.863	3.079	20	30		EGEDHN
C=CCN(C)C[C@@H]1CCCN1C(=O)C[C@@H](C)c1cccc(OC)c1	ZINC001755202337	1440780552	/nfs/dbraw/zinc/78/05/52/1440780552.db2.gz	DCDAOYZMPCALPK-AEFFLSMTSA-N	0	3	330.472	3.298	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCN1C(=O)Cc1cccc(OC(C)C)c1	ZINC001755202558	1440780797	/nfs/dbraw/zinc/78/07/97/1440780797.db2.gz	HULVNHBAVFITSO-GOSISDBHSA-N	0	3	330.472	3.125	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC1CC(CNCc2nc(C)c(C)s2)C1	ZINC001755215166	1440783961	/nfs/dbraw/zinc/78/39/61/1440783961.db2.gz	GMCMXFMABZQGLR-UHFFFAOYSA-N	0	3	335.517	3.347	20	30		EGEDHN
C[C@H](NCC#Cc1ccc(Cl)cc1)[C@H](C)NC(=O)c1ccoc1	ZINC001755225636	1440785692	/nfs/dbraw/zinc/78/56/92/1440785692.db2.gz	DURAHGTYRUFMBE-KBPBESRZSA-N	0	3	330.815	3.081	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H](C)[C@@H](C)NCc2sccc2Cl)c1	ZINC001755253015	1440792389	/nfs/dbraw/zinc/79/23/89/1440792389.db2.gz	NYXASIRTVJRKFE-VXGBXAGGSA-N	0	3	347.871	3.074	20	30		EGEDHN
C#CCCCC(=O)N(C)C1CCC(NCc2ncc(C)s2)CC1	ZINC001755274279	1440798569	/nfs/dbraw/zinc/79/85/69/1440798569.db2.gz	WNHDOSIJVZRKFG-UHFFFAOYSA-N	0	3	333.501	3.114	20	30		EGEDHN
CC#CCCCC(=O)N(C)C1CCC(NCc2conc2CC)CC1	ZINC001755274967	1440798634	/nfs/dbraw/zinc/79/86/34/1440798634.db2.gz	LPQGFVNEICWYCA-UHFFFAOYSA-N	0	3	345.487	3.290	20	30		EGEDHN
C=CCCOCC(=O)N(C)C1CCC(NC/C(Cl)=C/Cl)CC1	ZINC001755278624	1440799872	/nfs/dbraw/zinc/79/98/72/1440799872.db2.gz	KVCPXRHVDQIHLE-RAXLEYEMSA-N	0	3	349.302	3.257	20	30		EGEDHN
C=C(Br)CNCC(C)(C)CN(C)C(=O)C1(C)CCC1	ZINC001755282914	1440801127	/nfs/dbraw/zinc/80/11/27/1440801127.db2.gz	JIKMCRGRFGHHGM-UHFFFAOYSA-N	0	3	331.298	3.159	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1n[nH]c2ccccc21	ZINC001755287136	1440802344	/nfs/dbraw/zinc/80/23/44/1440802344.db2.gz	OTDGPOOAQJNSLB-UHFFFAOYSA-N	0	3	334.851	3.003	20	30		EGEDHN
CC#CCCCC(=O)NC[C@H](C)N(C)[C@@H]1CCc2c1cccc2F	ZINC001755314991	1440815348	/nfs/dbraw/zinc/81/53/48/1440815348.db2.gz	ZUUHQKCRUJLSJF-HNAYVOBHSA-N	0	3	330.447	3.443	20	30		EGEDHN
CC(C)[C@@H](CCN(C)C(=O)C#CC1CC1)NCc1c(F)cccc1F	ZINC001755340630	1440825010	/nfs/dbraw/zinc/82/50/10/1440825010.db2.gz	ZOWPMHSFWJQYFK-LJQANCHMSA-N	0	3	348.437	3.341	20	30		EGEDHN
O=C(C#CC1CC1)NC1(CNCc2cccc(F)c2F)CCCCC1	ZINC001755350932	1440827806	/nfs/dbraw/zinc/82/78/06/1440827806.db2.gz	MKUKJKVFDWMKQB-UHFFFAOYSA-N	0	3	346.421	3.287	20	30		EGEDHN
C[C@H](NC(=O)C#CC1CC1)C1CN(CCc2ccc3ccccc3c2)C1	ZINC001755373848	1440837811	/nfs/dbraw/zinc/83/78/11/1440837811.db2.gz	LYFSQAJYVONUCM-KRWDZBQOSA-N	0	3	346.474	3.232	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CC[C@H](NC(=O)CCc3ccoc3)C[C@@H]2C1	ZINC001755449166	1440852747	/nfs/dbraw/zinc/85/27/47/1440852747.db2.gz	CNJWAHVZBPLRPM-BBWFWOEESA-N	0	3	336.863	3.181	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H](C)CCCNCc2ccncc2Cl)C1	ZINC001755514236	1440864077	/nfs/dbraw/zinc/86/40/77/1440864077.db2.gz	DWINUEWTKCPNQW-CQSZACIVSA-N	0	3	335.879	3.466	20	30		EGEDHN
C=C(Cl)CNCCC[C@H](C)NC(=O)Cc1cc(F)c(F)cc1F	ZINC001755518058	1440864597	/nfs/dbraw/zinc/86/45/97/1440864597.db2.gz	HONXVQCRGDHYAM-NSHDSACASA-N	0	3	348.796	3.273	20	30		EGEDHN
CN(CC#Cc1ccccc1)C1CCN(C(=O)[C@H]2CC[C@@H](F)C2)CC1	ZINC001755532583	1440868046	/nfs/dbraw/zinc/86/80/46/1440868046.db2.gz	SIILJLBUWIVURW-RBUKOAKNSA-N	0	3	342.458	3.099	20	30		EGEDHN
C=C1CCC(C(=O)NCC[C@@H](NCc2cc(C)on2)C(C)C)CC1	ZINC001755551937	1440872317	/nfs/dbraw/zinc/87/23/17/1440872317.db2.gz	QLVZGBPICAVEJQ-GOSISDBHSA-N	0	3	333.476	3.350	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N(C)[C@@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001755566528	1440875923	/nfs/dbraw/zinc/87/59/23/1440875923.db2.gz	WGDFZARMNJVVHJ-OLMNPRSZSA-N	0	3	345.512	3.383	20	30		EGEDHN
CCC[C@@H](CC)C(=O)N(C)C[C@H](C)NCC#Cc1ccc(F)cc1	ZINC001755611824	1440887316	/nfs/dbraw/zinc/88/73/16/1440887316.db2.gz	VCQPSGYOTQLZOJ-FUHWJXTLSA-N	0	3	332.463	3.440	20	30		EGEDHN
C[C@@H]1[C@@H](NCc2ccc(C#N)s2)CCN1C(=O)/C=C\C(C)(C)C	ZINC001755651637	1440891421	/nfs/dbraw/zinc/89/14/21/1440891421.db2.gz	HZVKWKOAMMITKI-PNTJLJBISA-N	0	3	331.485	3.301	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@]12CCC[C@H]1N(Cc1cccnc1)CC2	ZINC001755703510	1440901427	/nfs/dbraw/zinc/90/14/27/1440901427.db2.gz	YIKRDPQFJOZSNI-YLJYHZDGSA-N	0	3	327.472	3.297	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)COc2cc(C)cc(C)c2)[C@H]1C	ZINC001755720288	1440907137	/nfs/dbraw/zinc/90/71/37/1440907137.db2.gz	HDEKJPXQDNGUQV-IEBWSBKVSA-N	0	3	330.472	3.227	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CCCN(Cc2ccc3c(c2)CCC3)[C@@H]1C	ZINC001755730733	1440910100	/nfs/dbraw/zinc/91/01/00/1440910100.db2.gz	NCZNWCZMCNSOCK-UTKZUKDTSA-N	0	3	338.495	3.448	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1C[C@@H](NCc2ccc(C#N)c(F)c2)C(C)(C)C1	ZINC001755753642	1440913549	/nfs/dbraw/zinc/91/35/49/1440913549.db2.gz	NXGCOXUSNWJKKE-RDTXWAMCSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC1(C)CN(C(=O)[C@]2(C)C=CCC2)C[C@H]1NCC#Cc1ccccc1	ZINC001755773840	1440917122	/nfs/dbraw/zinc/91/71/22/1440917122.db2.gz	JZYSHELKSQZZFG-DENIHFKCSA-N	0	3	336.479	3.221	20	30		EGEDHN
C=C(C)CN(C)CCN(C(=O)c1coc(C(F)(F)F)n1)C(C)C	ZINC001755812196	1440921102	/nfs/dbraw/zinc/92/11/02/1440921102.db2.gz	LKYJDHWDAJFORK-UHFFFAOYSA-N	0	3	333.354	3.052	20	30		EGEDHN
CC(C)(C)[C@H](CNCC#Cc1ccccc1)NC(=O)CC(F)(F)F	ZINC001755821909	1440925892	/nfs/dbraw/zinc/92/58/92/1440925892.db2.gz	QKOQZFKBKMTTGF-HNNXBMFYSA-N	0	3	340.389	3.111	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H](CNCc1cncc(F)c1)C(C)(C)C	ZINC001755831332	1440928826	/nfs/dbraw/zinc/92/88/26/1440928826.db2.gz	XHWGNMPTGVNGHJ-YOEHRIQHSA-N	0	3	335.467	3.444	20	30		EGEDHN
CC(C)(C)[C@H](CNCc1ccc(C#N)s1)NC(=O)[C@H]1CC12CC2	ZINC001755833695	1440929367	/nfs/dbraw/zinc/92/93/67/1440929367.db2.gz	ODKVOIFNCGHPQJ-CABCVRRESA-N	0	3	331.485	3.040	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H](C)C1CCN(Cc2ccccn2)CC1	ZINC001755847669	1440933840	/nfs/dbraw/zinc/93/38/40/1440933840.db2.gz	FRBDLQXEEBVBBT-SFHVURJKSA-N	0	3	341.499	3.382	20	30		EGEDHN
CN(C(=O)C#CC(C)(C)C)C1CC(NCc2cccc(F)c2F)C1	ZINC001755856521	1440935821	/nfs/dbraw/zinc/93/58/21/1440935821.db2.gz	BWOZBMTXNOAJQP-UHFFFAOYSA-N	0	3	334.410	3.093	20	30		EGEDHN
C=C(Cl)CNC1CC(N(C)C(=O)C(C)(C)CC(F)(F)F)C1	ZINC001755863735	1440937229	/nfs/dbraw/zinc/93/72/29/1440937229.db2.gz	JRDITAIAFLJLGE-UHFFFAOYSA-N	0	3	326.790	3.297	20	30		EGEDHN
C=CCNCc1ccc(CNC(=O)[C@H](OC)c2ccccc2)c(F)c1	ZINC001755902571	1440944276	/nfs/dbraw/zinc/94/42/76/1440944276.db2.gz	JSORWCAUKNJNNK-LJQANCHMSA-N	0	3	342.414	3.105	20	30		EGEDHN
C=CCNCc1ccc(CNC(=O)C(C)(C)C(C)(F)F)c(F)c1	ZINC001755902527	1440944278	/nfs/dbraw/zinc/94/42/78/1440944278.db2.gz	IXTUBZXAYQUOFQ-UHFFFAOYSA-N	0	3	328.378	3.399	20	30		EGEDHN
CCN(CC)[C@H](Cn1c(C)nnc1N(C)[C@H](C)CC#N)c1ccco1	ZINC001766597887	1441402824	/nfs/dbraw/zinc/40/28/24/1441402824.db2.gz	HHCDJKWCEOJLRX-GDBMZVCRSA-N	0	3	344.463	3.001	20	30		EGEDHN
C#Cc1ccc(CN[C@@H](Cc2ccccc2)[C@H](O)C(F)(F)F)cc1	ZINC000809619196	1126110757	/nfs/dbraw/zinc/11/07/57/1126110757.db2.gz	VMUAHYOGIQBQES-ROUUACIJSA-N	0	3	333.353	3.292	20	30		EGEDHN
COc1ccccc1C[C@](C)(CO)NCc1ccc(C#N)cc1Cl	ZINC000931605226	1126137110	/nfs/dbraw/zinc/13/71/10/1126137110.db2.gz	JOMOKQRPNZAVQV-LJQANCHMSA-N	0	3	344.842	3.304	20	30		EGEDHN
CN1CCC(Nc2ccccc2NC(=O)Cc2ccc(C#N)cc2)CC1	ZINC000171543731	530050479	/nfs/dbraw/zinc/05/04/79/530050479.db2.gz	YLGNTNMUYPQZPQ-UHFFFAOYSA-N	0	3	348.450	3.246	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN1CCN(CC(C)C)CC1	ZINC000067132519	215115170	/nfs/dbraw/zinc/11/51/70/215115170.db2.gz	CDUYBSPWMBJVPV-UHFFFAOYSA-N	0	3	347.528	3.177	20	30		EGEDHN
N#Cc1cc(CN2CCC[C@H](c3nc(C4CC4)n[nH]3)C2)ccc1F	ZINC000179512712	233118777	/nfs/dbraw/zinc/11/87/77/233118777.db2.gz	PHUZXUSUXHLTGP-AWEZNQCLSA-N	0	3	325.391	3.072	20	30		EGEDHN
N#Cc1cc(CN2CCC[C@H](c3n[nH]c(C4CC4)n3)C2)ccc1F	ZINC000179512712	233118787	/nfs/dbraw/zinc/11/87/87/233118787.db2.gz	PHUZXUSUXHLTGP-AWEZNQCLSA-N	0	3	325.391	3.072	20	30		EGEDHN
Cc1ccc([C@H](CN[C@H](C)c2cccc(C#N)c2)N2CCOCC2)o1	ZINC000181424018	234181894	/nfs/dbraw/zinc/18/18/94/234181894.db2.gz	RABIMJPLMSACHA-APWZRJJASA-N	0	3	339.439	3.184	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CN2CCC(c3ccsc3)CC2)cc1	ZINC000186936133	236070614	/nfs/dbraw/zinc/07/06/14/236070614.db2.gz	XTTVURGXOBHIEC-SFHVURJKSA-N	0	3	342.464	3.239	20	30		EGEDHN
CC[C@H](NCc1ccc(OC)c(C#N)c1)[C@H](O)c1c(F)cccc1F	ZINC000266307993	248238716	/nfs/dbraw/zinc/23/87/16/248238716.db2.gz	OSXAQIAMYHLCRJ-LPHOPBHVSA-N	0	3	346.377	3.447	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N(CC)C[C@@H]1CCN(Cc2ccccc2)C1	ZINC000266527821	248346124	/nfs/dbraw/zinc/34/61/24/248346124.db2.gz	JSPVQQFPUMBYFQ-UYAOXDASSA-N	0	3	344.499	3.338	20	30		EGEDHN
CON(C)C(=O)CCN[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000377547117	169039667	/nfs/dbraw/zinc/03/96/67/169039667.db2.gz	ZULHYIXAWNPGQG-OAHLLOKOSA-N	0	3	337.423	3.286	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CCCN1C[C@H](O)c1ccc(C#N)cc1	ZINC000268676145	252129150	/nfs/dbraw/zinc/12/91/50/252129150.db2.gz	LJDQAGVWDYWBOB-GCJKJVERSA-N	0	3	349.478	3.188	20	30		EGEDHN
C[C@@H](NC(=O)N1CCN(C2CCCCC2)CC1)c1ccc(C#N)cc1	ZINC000268851265	252297894	/nfs/dbraw/zinc/29/78/94/252297894.db2.gz	CTFHHUQNFYZYRN-MRXNPFEDSA-N	0	3	340.471	3.279	20	30		EGEDHN
N#Cc1ccccc1-c1ccc(CN2CCC[C@H]2C(=O)NC2CC2)cc1	ZINC000097258992	219006657	/nfs/dbraw/zinc/00/66/57/219006657.db2.gz	XQORYIOBOTYCNM-NRFANRHFSA-N	0	3	345.446	3.468	20	30		EGEDHN
Cc1cc(C#N)ccc1Oc1ccc(C(=O)NC2CCN(C)CC2)cc1	ZINC000154909739	224325415	/nfs/dbraw/zinc/32/54/15/224325415.db2.gz	QSDJPYPWBNWFHD-UHFFFAOYSA-N	0	3	349.434	3.483	20	30		EGEDHN
N#CCc1ccc(OC[C@@H](O)CN2CCC[C@H]2c2cccs2)cc1	ZINC000040475832	258059676	/nfs/dbraw/zinc/05/96/76/258059676.db2.gz	HCZQTRLDYKKAFJ-WMZOPIPTSA-N	0	3	342.464	3.391	20	30		EGEDHN
C[C@@H](NCCNc1nccc(C(F)(F)F)n1)c1ccc(C#N)cc1	ZINC000181777767	533397643	/nfs/dbraw/zinc/39/76/43/533397643.db2.gz	JMVVTKIEVVSEMD-LLVKDONJSA-N	0	3	335.333	3.130	20	30		EGEDHN
Cc1ccc(NC(=O)C2CCN(Cc3cccc(C#N)c3)CC2)nc1	ZINC000361738838	144357918	/nfs/dbraw/zinc/35/79/18/144357918.db2.gz	DLGWLVKOMWYGCK-UHFFFAOYSA-N	0	3	334.423	3.112	20	30		EGEDHN
CN(C)Cc1ccc(CNC(=O)Nc2ccc(F)cc2C#N)cc1	ZINC000119819849	152231041	/nfs/dbraw/zinc/23/10/41/152231041.db2.gz	ICXKPBVUHAMEPM-UHFFFAOYSA-N	0	3	326.375	3.081	20	30		EGEDHN
C[C@@H]1CC(C)(C)CC[C@@H]1NCCS(=O)(=O)c1ccc(C#N)cc1	ZINC000120833963	152303901	/nfs/dbraw/zinc/30/39/01/152303901.db2.gz	UMPGSBJQEQAHBF-PBHICJAKSA-N	0	3	334.485	3.136	20	30		EGEDHN
CN(c1ccccc1)C1CCN(C[C@@H](O)c2ccc(C#N)cc2)CC1	ZINC000305075077	154080816	/nfs/dbraw/zinc/08/08/16/154080816.db2.gz	NIWICDDEGWTOHH-OAQYLSRUSA-N	0	3	335.451	3.192	20	30		EGEDHN
N#Cc1ccc(C(=O)N2C[C@H]3CCN(Cc4ccccc4)C[C@H]3C2)cc1	ZINC000312071677	154150794	/nfs/dbraw/zinc/15/07/94/154150794.db2.gz	OAHJUZNURAGQPO-RTWAWAEBSA-N	0	3	345.446	3.152	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)N(C)CC1CCN(C)CC1	ZINC000339950203	155047894	/nfs/dbraw/zinc/04/78/94/155047894.db2.gz	YUTSDLYFBIMDHP-UHFFFAOYSA-N	0	3	341.480	3.495	20	30		EGEDHN
N#Cc1cccc(CN[C@@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)c1	ZINC000346817333	156148084	/nfs/dbraw/zinc/14/80/84/156148084.db2.gz	DIKBWPUBFQUACT-CQSZACIVSA-N	0	3	343.789	3.246	20	30		EGEDHN
CCCN(CCN1CCCCC1)C(=O)Nc1cc(C#N)ccc1OC	ZINC000349080933	156345579	/nfs/dbraw/zinc/34/55/79/156345579.db2.gz	MFYIWIOSTWUURC-UHFFFAOYSA-N	0	3	344.459	3.297	20	30		EGEDHN
C[C@H](CN(C)C)NC(=O)Nc1ccc(Oc2ccccc2C#N)cc1	ZINC000349162466	156371150	/nfs/dbraw/zinc/37/11/50/156371150.db2.gz	WNQAHQFOIJBAGB-CQSZACIVSA-N	0	3	338.411	3.422	20	30		EGEDHN
CN(C)CCOc1ccc(CCNc2ncc(C#N)cc2Cl)cc1	ZINC000352643797	156396422	/nfs/dbraw/zinc/39/64/22/156396422.db2.gz	GLEXUGFBMHAACA-UHFFFAOYSA-N	0	3	344.846	3.202	20	30		EGEDHN
Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@H]1N2C(=O)c1cc(C#N)cs1	ZINC000267652801	292355657	/nfs/dbraw/zinc/35/56/57/292355657.db2.gz	VBESFAKUVBVCNP-DOTOQJQBSA-N	0	3	337.448	3.376	20	30		EGEDHN
CCOc1ccccc1CN(C)CCC(=O)Nc1sccc1C#N	ZINC000109015030	162089938	/nfs/dbraw/zinc/08/99/38/162089938.db2.gz	LUOCAZCROPGWNV-UHFFFAOYSA-N	0	3	343.452	3.479	20	30		EGEDHN
CN(C)[C@]1(CNc2cc(C#N)ccc2C(F)(F)F)CCSC1	ZINC000337209100	163162645	/nfs/dbraw/zinc/16/26/45/163162645.db2.gz	AINQCVMOUFJIQV-AWEZNQCLSA-N	0	3	329.391	3.426	20	30		EGEDHN
CN(CCOc1cccc(C#N)c1)CCc1cccc([N+](=O)[O-])c1	ZINC000338354293	163219739	/nfs/dbraw/zinc/21/97/39/163219739.db2.gz	JHVHVRZIGFCMHO-UHFFFAOYSA-N	0	3	325.368	3.020	20	30		EGEDHN
CN(C)C[C@H](NC(=O)c1ccc(C#N)cc1)c1ccc(Cl)cc1	ZINC000338760227	163340880	/nfs/dbraw/zinc/34/08/80/163340880.db2.gz	DRZSSWBHXDIASQ-KRWDZBQOSA-N	0	3	327.815	3.244	20	30		EGEDHN
CC[C@H](NCc1ccncc1OCCN(C)C)c1ccc(C#N)cc1	ZINC000343929775	164068750	/nfs/dbraw/zinc/06/87/50/164068750.db2.gz	LKGPIKVAOSUNJD-IBGZPJMESA-N	0	3	338.455	3.135	20	30		EGEDHN
C[C@@H](c1ccc(C#N)cc1)N1CCC[C@@H](CNC(=O)c2ccco2)C1	ZINC000338375414	287130929	/nfs/dbraw/zinc/13/09/29/287130929.db2.gz	FONINRKNPSUGRO-RDJZCZTQSA-N	0	3	337.423	3.354	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H]1C	ZINC000359832653	167243716	/nfs/dbraw/zinc/24/37/16/167243716.db2.gz	LREULJUOMYMMCA-UZLBHIALSA-N	0	3	333.435	3.260	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1CCC[C@@H](C[C@@H]2CCOC2)C1	ZINC000367403346	168221301	/nfs/dbraw/zinc/22/13/01/168221301.db2.gz	OSTHAHCKFMHKFG-ROUUACIJSA-N	0	3	344.455	3.084	20	30		EGEDHN
C[C@@H](N[C@@H]1CCCC[C@H]1OC(F)F)C(=O)Nc1ccccc1C#N	ZINC000502481831	269845289	/nfs/dbraw/zinc/84/52/89/269845289.db2.gz	ADYSRSOMRVKSBN-KCPJHIHWSA-N	0	3	337.370	3.025	20	30		EGEDHN
CN(C)CCOc1ccccc1CNc1ccc(C#N)cc1[N+](=O)[O-]	ZINC000299301477	270043715	/nfs/dbraw/zinc/04/37/15/270043715.db2.gz	BEUSUJJYFNFCIC-UHFFFAOYSA-N	0	3	340.383	3.019	20	30		EGEDHN
N#Cc1ccc(CN2CCC(C(=O)Nc3ccc(O)cc3)CC2)cc1	ZINC000299520724	270043748	/nfs/dbraw/zinc/04/37/48/270043748.db2.gz	DQRWZNRNXJUSGT-UHFFFAOYSA-N	0	3	335.407	3.115	20	30		EGEDHN
CC(C)n1cncc1CN[C@@H]1CCCN(c2ccc(C#N)cc2F)C1	ZINC000424146690	270049266	/nfs/dbraw/zinc/04/92/66/270049266.db2.gz	QAENCDJYYHHOKW-MRXNPFEDSA-N	0	3	341.434	3.233	20	30		EGEDHN
Cc1ccc2c(c1)[C@H](NC[C@@H](O)COc1ccccc1C#N)CCC2	ZINC000530234780	270060341	/nfs/dbraw/zinc/06/03/41/270060341.db2.gz	UOZVOOHVCSYDHS-UYAOXDASSA-N	0	3	336.435	3.274	20	30		EGEDHN
CC(C)c1nc2n(n1)C[C@@H](N[C@H](C)c1ccc(C#N)cc1F)CC2	ZINC000332690531	265927655	/nfs/dbraw/zinc/92/76/55/265927655.db2.gz	WHOLFOKRMUBUBF-OCCSQVGLSA-N	0	3	327.407	3.078	20	30		EGEDHN
CCOCc1ccccc1CNC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000279784047	266287141	/nfs/dbraw/zinc/28/71/41/266287141.db2.gz	URHJACOJQVBUDT-HXUWFJFHSA-N	0	3	347.418	3.093	20	30		EGEDHN
CCO[C@@H]1C[C@@H](N[C@@H](C)C(=O)Nc2oc(C)c(C)c2C#N)C12CCC2	ZINC000296038481	266294934	/nfs/dbraw/zinc/29/49/34/266294934.db2.gz	FCYGJOKIRJHINY-APHBMKBZSA-N	0	3	345.443	3.032	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)N(CCN(C)C)C1CCCC1	ZINC000177247864	266333081	/nfs/dbraw/zinc/33/30/81/266333081.db2.gz	AOVSPSNRLWRGAF-UHFFFAOYSA-N	0	3	344.459	3.295	20	30		EGEDHN
CCS[C@@H]1CCC[C@H]1N[C@@H](C)C(=O)Nc1oc(C)c(C)c1C#N	ZINC000286013111	266346074	/nfs/dbraw/zinc/34/60/74/266346074.db2.gz	GYEBOVMFBBLANA-NILFDRSVSA-N	0	3	335.473	3.359	20	30		EGEDHN
CCS[C@@H]1CC[C@H](N(C)C(=O)C(C#N)Cc2ccc(C#N)cc2)C1	ZINC000348320654	266347708	/nfs/dbraw/zinc/34/77/08/266347708.db2.gz	NXNSBDTYJADFNV-FGTMMUONSA-N	0	3	341.480	3.373	20	30		EGEDHN
CCCCN1CCCC[C@@H]1CNC(=O)[C@@H](C)Oc1ccc(C#N)cc1	ZINC000523342978	267006800	/nfs/dbraw/zinc/00/68/00/267006800.db2.gz	XMIRSRMHSSKSIY-SJLPKXTDSA-N	0	3	343.471	3.096	20	30		EGEDHN
CCCCN1CCCC[C@@H]1CNC(=O)[C@H](C)Oc1ccc(C#N)cc1	ZINC000523342977	267007372	/nfs/dbraw/zinc/00/73/72/267007372.db2.gz	XMIRSRMHSSKSIY-FUHWJXTLSA-N	0	3	343.471	3.096	20	30		EGEDHN
C[C@@H]1CN(CCC2CCN(c3ccc(C#N)cc3F)CC2)C[C@@H](C)O1	ZINC000301512264	267049040	/nfs/dbraw/zinc/04/90/40/267049040.db2.gz	BAXORMRITDAJHT-HZPDHXFCSA-N	0	3	345.462	3.413	20	30		EGEDHN
CCOC(=O)N1CCC[C@H]([C@H](C)NCc2cc(C#N)ccc2F)C1	ZINC000495521678	267123795	/nfs/dbraw/zinc/12/37/95/267123795.db2.gz	WUMHNDUYGTXZLX-ZFWWWQNUSA-N	0	3	333.407	3.044	20	30		EGEDHN
CCS[C@@H]1CCCC[C@H]1N[C@@H]1CCN(c2ccc(C#N)cc2)C1=O	ZINC000411564010	267181050	/nfs/dbraw/zinc/18/10/50/267181050.db2.gz	VOCOOCKJLDIDRU-KZNAEPCWSA-N	0	3	343.496	3.317	20	30		EGEDHN
C[C@H](NCCCS(=O)(=O)c1ccccc1)c1ccc(C#N)c(F)c1	ZINC000271915608	267181355	/nfs/dbraw/zinc/18/13/55/267181355.db2.gz	CBYMPTIAARUTCY-AWEZNQCLSA-N	0	3	346.427	3.212	20	30		EGEDHN
CC[C@H](CNc1ccccc1)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000452459426	267211788	/nfs/dbraw/zinc/21/17/88/267211788.db2.gz	IWIZEXHBIKGHBI-RBUKOAKNSA-N	0	3	346.434	3.247	20	30		EGEDHN
CCc1cc(N2CCN(c3cc(C#N)ccn3)CC2)c2ccccc2n1	ZINC000443677621	267246834	/nfs/dbraw/zinc/24/68/34/267246834.db2.gz	YIRIRCDQYAWMDK-UHFFFAOYSA-N	0	3	343.434	3.390	20	30		EGEDHN
CN(C)Cc1ccc(NC(=O)C2(c3cccc(C#N)c3)CC2)c(F)c1	ZINC000412562656	267283470	/nfs/dbraw/zinc/28/34/70/267283470.db2.gz	XUSDDWYINCYHIL-UHFFFAOYSA-N	0	3	337.398	3.429	20	30		EGEDHN
CN(CC(=O)NCc1ccc(C#N)cc1)[C@H]1CCC[C@H]1C(C)(C)C	ZINC000419327221	267297303	/nfs/dbraw/zinc/29/73/03/267297303.db2.gz	NMSBQHQHDSEDDQ-MSOLQXFVSA-N	0	3	327.472	3.321	20	30		EGEDHN
CN(CC(=O)NCc1cccc(C#N)c1)[C@H]1CCC[C@H]1C(C)(C)C	ZINC000419328404	267297741	/nfs/dbraw/zinc/29/77/41/267297741.db2.gz	OSTMEFVSJMTQAX-MSOLQXFVSA-N	0	3	327.472	3.321	20	30		EGEDHN
CN(CC(=O)NCc1cccc(C#N)c1)[C@H]1CCC[C@@H]1C(C)(C)C	ZINC000419328408	267297832	/nfs/dbraw/zinc/29/78/32/267297832.db2.gz	OSTMEFVSJMTQAX-ROUUACIJSA-N	0	3	327.472	3.321	20	30		EGEDHN
COC(=O)COc1ccc([C@@H](C)NCc2ccc(C#N)c(C)c2)cc1	ZINC000488337254	267365851	/nfs/dbraw/zinc/36/58/51/267365851.db2.gz	WCVCQLVJQQDTIF-OAHLLOKOSA-N	0	3	338.407	3.269	20	30		EGEDHN
COC(=O)[C@](C)(CNCc1ccc(C#N)cc1F)c1ccc(F)cc1	ZINC000447088980	267393048	/nfs/dbraw/zinc/39/30/48/267393048.db2.gz	UKVYZAYLIDJLQD-LJQANCHMSA-N	0	3	344.361	3.057	20	30		EGEDHN
Cc1cccc([C@@H]2CCCN2C[C@@H](O)COc2ccc(C#N)cc2)c1	ZINC000515508721	268056728	/nfs/dbraw/zinc/05/67/28/268056728.db2.gz	JMIPHTZZUUBNHQ-CTNGQTDRSA-N	0	3	336.435	3.444	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCc2cccc3cccnc32)cc1	ZINC000348181279	268087055	/nfs/dbraw/zinc/08/70/55/268087055.db2.gz	NLNTUZOXDRFLQY-IBGZPJMESA-N	0	3	340.386	3.105	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@@H]2CCOc3c(F)cccc32)cc1	ZINC000348144946	268087306	/nfs/dbraw/zinc/08/73/06/268087306.db2.gz	QSWLUQKFMXYNTJ-MAUKXSAKSA-N	0	3	349.365	3.020	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CC[C@@H](c3cccc(F)c3)C2)cc1	ZINC000279263719	268089428	/nfs/dbraw/zinc/08/94/28/268089428.db2.gz	ILUCCARBIUZFLX-RTBURBONSA-N	0	3	347.393	3.396	20	30		EGEDHN
N#Cc1ccc(Cl)cc1NC(=O)CN[C@H]1CCCC12CCOCC2	ZINC000282004144	268099787	/nfs/dbraw/zinc/09/97/87/268099787.db2.gz	IZWPZJIVMQOXGT-INIZCTEOSA-N	0	3	347.846	3.089	20	30		EGEDHN
N#Cc1ccc(Cl)cc1NC[C@H](O)CN1CCc2ccccc2C1	ZINC000301162102	268101353	/nfs/dbraw/zinc/10/13/53/268101353.db2.gz	CKGIVIBGUCAQCY-SFHVURJKSA-N	0	3	341.842	3.043	20	30		EGEDHN
N#Cc1c(Cl)cccc1NC[C@@H]1C[C@@H](O)CN1Cc1ccccc1	ZINC000450403950	268158931	/nfs/dbraw/zinc/15/89/31/268158931.db2.gz	DRIIVIAFLWFKFC-JKSUJKDBSA-N	0	3	341.842	3.259	20	30		EGEDHN
N#Cc1ccc(OC2CCN(CCc3ccncc3)CC2)c(F)c1	ZINC000285613841	268166322	/nfs/dbraw/zinc/16/63/22/268166322.db2.gz	XOWUKDHVMMWZJT-UHFFFAOYSA-N	0	3	325.387	3.178	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CN1CCC(c2ccccc2)CC1	ZINC000528336611	268299081	/nfs/dbraw/zinc/29/90/81/268299081.db2.gz	CPNDUGQXXLAXSP-HXUWFJFHSA-N	0	3	336.435	3.178	20	30		EGEDHN
Cc1ccccc1[C@@H]([C@@H](C)NC(=O)c1ccc(F)c(C#N)c1)N(C)C	ZINC000341566758	281360753	/nfs/dbraw/zinc/36/07/53/281360753.db2.gz	PJEWBLURQHTZGA-AUUYWEPGSA-N	0	3	339.414	3.427	20	30		EGEDHN
Cc1ccc(C)c(C(=O)N(CCN(C)C)Cc2cccc(C#N)c2)c1	ZINC000068310632	307369541	/nfs/dbraw/zinc/36/95/41/307369541.db2.gz	VGCPNRHKRDORSH-UHFFFAOYSA-N	0	3	335.451	3.379	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCc2cc(Cl)cs2)CC1	ZINC000076593107	454018386	/nfs/dbraw/zinc/01/83/86/454018386.db2.gz	RZWSVHJIFBJOFR-UHFFFAOYSA-N	0	3	326.893	3.491	20	30		EGEDHN
N#Cc1cccc(-c2nnc(CN[C@H]3CCCC34CCOCC4)o2)c1	ZINC000548865166	315056491	/nfs/dbraw/zinc/05/64/91/315056491.db2.gz	MYKBAWAKNRMOFS-INIZCTEOSA-N	0	3	338.411	3.047	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CNCc2cc3c(s2)CCCC3)cc1	ZINC000548928898	315064128	/nfs/dbraw/zinc/06/41/28/315064128.db2.gz	BGZDAKQWCDTQOD-INIZCTEOSA-N	0	3	342.464	3.028	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)N1CC[C@H](N2CCCC2)C1	ZINC000550504590	315129074	/nfs/dbraw/zinc/12/90/74/315129074.db2.gz	LOMGLOGTEATPBF-HNNXBMFYSA-N	0	3	339.464	3.392	20	30		EGEDHN
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NCc1ccc(C#N)cc1F	ZINC000551721733	315165273	/nfs/dbraw/zinc/16/52/73/315165273.db2.gz	GHTHJDYDISDLKE-KSSFIOAISA-N	0	3	340.398	3.207	20	30		EGEDHN
CN(C)C[C@@H](CNC(=O)c1cccc(C#N)c1)c1ccc(Cl)cc1	ZINC000552025150	315189345	/nfs/dbraw/zinc/18/93/45/315189345.db2.gz	ADQYYPMAAIVIBC-QGZVFWFLSA-N	0	3	341.842	3.287	20	30		EGEDHN
N#Cc1ccc2c(c1)CCCC[C@H]2Nc1ccc(N2CCNCC2)cn1	ZINC000564649706	316181775	/nfs/dbraw/zinc/18/17/75/316181775.db2.gz	OTVMTVWKOUUEEX-HXUWFJFHSA-N	0	3	347.466	3.242	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)Nc2cccc(C#N)n2)CCN1Cc1ccccc1	ZINC000564943239	316236092	/nfs/dbraw/zinc/23/60/92/316236092.db2.gz	YCEYMUKUHBHPGS-DOTOQJQBSA-N	0	3	349.438	3.128	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)Nc2cccc(C#N)n2)CCN1Cc1ccccc1	ZINC000564943241	316236561	/nfs/dbraw/zinc/23/65/61/316236561.db2.gz	YCEYMUKUHBHPGS-RDJZCZTQSA-N	0	3	349.438	3.128	20	30		EGEDHN
CC(C)(C)[C@H](CN1CCc2ccccc2C1)Nc1cc(C#N)ncn1	ZINC000565988272	316397929	/nfs/dbraw/zinc/39/79/29/316397929.db2.gz	WZXKTZYAPKNBOL-SFHVURJKSA-N	0	3	335.455	3.233	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(C(=O)Nc3ccccc3)C2)cc1F	ZINC000567342828	316602734	/nfs/dbraw/zinc/60/27/34/316602734.db2.gz	GMOCVUMBSDGBTF-QGZVFWFLSA-N	0	3	338.386	3.093	20	30		EGEDHN
N#Cc1cccc(CNC[C@H](O)Cc2ccc(C(F)(F)F)cc2)c1	ZINC000572992467	317422994	/nfs/dbraw/zinc/42/29/94/317422994.db2.gz	MZRHQOHMSLBJHT-QGZVFWFLSA-N	0	3	334.341	3.270	20	30		EGEDHN
C=CCSCCNC(=O)NC[C@@H](c1cccs1)N1CCCC1	ZINC000194634280	455866874	/nfs/dbraw/zinc/86/68/74/455866874.db2.gz	GZFWPDDUSCLIMJ-AWEZNQCLSA-N	0	3	339.530	3.103	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)o1)Oc1ccccc1Br	ZINC000176990681	323334974	/nfs/dbraw/zinc/33/49/74/323334974.db2.gz	GVPGWXJNVDYGQY-NSHDSACASA-N	0	3	335.201	3.471	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@@H]1Nc1nc2c(cc1C#N)CCC2	ZINC000389796984	324280158	/nfs/dbraw/zinc/28/01/58/324280158.db2.gz	UTWGQGPKXXLYJE-YWZLYKJASA-N	0	3	332.451	3.374	20	30		EGEDHN
C=CCN1CCC(NC(=O)Cc2csc(-c3ccccc3)n2)CC1	ZINC000264514227	455227832	/nfs/dbraw/zinc/22/78/32/455227832.db2.gz	UWYGQYHRYWTYOO-UHFFFAOYSA-N	0	3	341.480	3.119	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCOc2ccc(Cl)cc2)CC1	ZINC000264520505	455229635	/nfs/dbraw/zinc/22/96/35/455229635.db2.gz	WQDJINCSAMKGGV-UHFFFAOYSA-N	0	3	336.863	3.266	20	30		EGEDHN
N#CC(C(=O)c1ccnc(OC2CCC2)c1)c1nc2ccccc2[nH]1	ZINC000180774563	455243476	/nfs/dbraw/zinc/24/34/76/455243476.db2.gz	DPTFLVKATKKESH-AWEZNQCLSA-N	0	3	332.363	3.379	20	30		EGEDHN
COc1cccc([C@@H](CNCc2ccc(C#N)o2)N2CCCC2)c1	ZINC000174242004	533717898	/nfs/dbraw/zinc/71/78/98/533717898.db2.gz	FCRUZMRLLXZAPT-LJQANCHMSA-N	0	3	325.412	3.087	20	30		EGEDHN
C=CC[C@@H](C)N[C@@H](C)c1ccc(S(=O)(=O)C(F)F)c(OC)c1	ZINC000180949501	455267945	/nfs/dbraw/zinc/26/79/45/455267945.db2.gz	UMRYHDDVIMWELX-MNOVXSKESA-N	0	3	333.400	3.307	20	30		EGEDHN
C[C@H](NCCS(=O)(=O)c1ccc(C#N)cc1)[C@@H](C)c1ccccc1	ZINC000181525751	455348750	/nfs/dbraw/zinc/34/87/50/455348750.db2.gz	FMVUDPBECLMNHI-CVEARBPZSA-N	0	3	342.464	3.114	20	30		EGEDHN
Cc1ccc([C@@H](CN2CCOCC2)NCc2cccc(C#N)c2)cc1	ZINC000022817941	453698686	/nfs/dbraw/zinc/69/86/86/453698686.db2.gz	TXCFBYNUTMVJBD-OAQYLSRUSA-N	0	3	335.451	3.030	20	30		EGEDHN
C[C@H](NC[C@H](O)COc1ccc(CC#N)cc1)c1ccc(F)c(F)c1	ZINC000025867600	453788475	/nfs/dbraw/zinc/78/84/75/453788475.db2.gz	OZBQVSOVTVXHIY-BBRMVZONSA-N	0	3	346.377	3.121	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)CN(C)CC12CC3CC(CC(C3)C1)C2	ZINC000027782615	453820537	/nfs/dbraw/zinc/82/05/37/453820537.db2.gz	DFJXRMYENRENMN-DRZUXFPHSA-N	0	3	331.504	3.189	20	30		EGEDHN
C[C@@H](NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(C#N)cc1	ZINC000066989453	453892485	/nfs/dbraw/zinc/89/24/85/453892485.db2.gz	PCOMYLVJLTWIAN-OAHLLOKOSA-N	0	3	339.414	3.385	20	30		EGEDHN
CN1CCC[C@@H](CNC(=O)c2cccc(Nc3ccc(C#N)cc3)c2)C1	ZINC000159512938	455382602	/nfs/dbraw/zinc/38/26/02/455382602.db2.gz	OOMBKWBPNIHUQN-KRWDZBQOSA-N	0	3	348.450	3.373	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)CN(Cc1ccccc1)CC1CCC1	ZINC000067462877	453933428	/nfs/dbraw/zinc/93/34/28/453933428.db2.gz	DNVDMILRDHYDKR-FQEVSTJZSA-N	0	3	327.472	3.343	20	30		EGEDHN
CCc1ncc(CN[C@H]2CCCN(c3ccc(C#N)cc3F)C2)s1	ZINC000084023634	453965351	/nfs/dbraw/zinc/96/53/51/453965351.db2.gz	FPYWFSGXDJPSKV-AWEZNQCLSA-N	0	3	344.459	3.475	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2csc(Br)c2)nc(C)n1	ZINC000041560385	453971983	/nfs/dbraw/zinc/97/19/83/453971983.db2.gz	JMCAECKGTLNWDT-SNVBAGLBSA-N	0	3	336.214	3.408	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2cccc(Nc3ncccn3)c2)nc(C)n1	ZINC000041560433	453972180	/nfs/dbraw/zinc/97/21/80/453972180.db2.gz	GXYZQBHFZDAOBH-MRXNPFEDSA-N	0	3	344.378	3.117	20	30		EGEDHN
CN(C)CCN(Cc1cccs1)C(=O)Nc1ccc(F)c(C#N)c1	ZINC000084321555	453983814	/nfs/dbraw/zinc/98/38/14/453983814.db2.gz	HSBZVELIYBWDQW-UHFFFAOYSA-N	0	3	346.431	3.355	20	30		EGEDHN
N#CCCn1cc(CNCCc2cscn2)c(-c2ccccc2)n1	ZINC000076331648	453989638	/nfs/dbraw/zinc/98/96/38/453989638.db2.gz	QMZVWYDHEDTFJD-UHFFFAOYSA-N	0	3	337.452	3.253	20	30		EGEDHN
N#Cc1nnc2ccccc2c1NCCCN1CCc2ccccc2C1	ZINC000077189061	454073046	/nfs/dbraw/zinc/07/30/46/454073046.db2.gz	XKXWBCYPAVRQLY-UHFFFAOYSA-N	0	3	343.434	3.362	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H]2CCCC[C@@H]2Cc2ccccc2)CC1	ZINC000077309574	454088857	/nfs/dbraw/zinc/08/88/57/454088857.db2.gz	INWMRASZADSSHH-NHCUHLMSSA-N	0	3	338.495	3.249	20	30		EGEDHN
N#CCCN(Cc1cccnc1)C(=O)c1ccc(CN2CCCC2)cc1	ZINC000069485293	454111268	/nfs/dbraw/zinc/11/12/68/454111268.db2.gz	MKDFUTOJLCRBAL-UHFFFAOYSA-N	0	3	348.450	3.233	20	30		EGEDHN
C=C(C)COCCNC(=O)NC1CCN([C@H](C)c2ccccc2)CC1	ZINC000130473474	454200836	/nfs/dbraw/zinc/20/08/36/454200836.db2.gz	YRNSLGSCTGNKQL-QGZVFWFLSA-N	0	3	345.487	3.104	20	30		EGEDHN
N#CC(C(=O)c1cncc(Br)c1)c1nc2ccccc2[nH]1	ZINC000046440765	454252184	/nfs/dbraw/zinc/25/21/84/454252184.db2.gz	AWKDRNSDKYGLLL-LLVKDONJSA-N	0	3	341.168	3.210	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC1CCN([C@@H](C)c2ccccc2)CC1	ZINC000071909307	454252304	/nfs/dbraw/zinc/25/23/04/454252304.db2.gz	MXFZCFWSIZCTPK-IRXDYDNUSA-N	0	3	330.472	3.309	20	30		EGEDHN
C#CCCCCC(=O)N(C)CCC1CCN(c2ccncc2)CC1	ZINC000120077260	454254593	/nfs/dbraw/zinc/25/45/93/454254593.db2.gz	FYYDJSALEDPQCN-UHFFFAOYSA-N	0	3	327.472	3.340	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cnn(C(C)(C)C)c1)C(C)C	ZINC000120086189	454256185	/nfs/dbraw/zinc/25/61/85/454256185.db2.gz	HDDBPUPMUHAJSP-KRWDZBQOSA-N	0	3	332.492	3.067	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCc3ccc(Cl)cc3C2)CC1	ZINC000090561697	454323101	/nfs/dbraw/zinc/32/31/01/454323101.db2.gz	YIVCFQVRUJELTR-UHFFFAOYSA-N	0	3	333.863	3.058	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCc3c2cccc3Cl)CC1	ZINC000120618377	454326950	/nfs/dbraw/zinc/32/69/50/454326950.db2.gz	LRWWYEAYEDMWKD-UHFFFAOYSA-N	0	3	333.863	3.453	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Cc2cccc(OCCC)c2)CC1	ZINC000120895139	454361273	/nfs/dbraw/zinc/36/12/73/454361273.db2.gz	XDMMWERFLVGEBO-UHFFFAOYSA-N	0	3	330.472	3.175	20	30		EGEDHN
CCN1CCCN(C(=O)Nc2ccccc2SC[C@H](C)C#N)CC1	ZINC000091174675	454401074	/nfs/dbraw/zinc/40/10/74/454401074.db2.gz	IMWMDLYFFCQFIO-OAHLLOKOSA-N	0	3	346.500	3.498	20	30		EGEDHN
CCN1CCCN(C(=O)Nc2ccccc2SC[C@@H](C)C#N)CC1	ZINC000091174674	454401635	/nfs/dbraw/zinc/40/16/35/454401635.db2.gz	IMWMDLYFFCQFIO-HNNXBMFYSA-N	0	3	346.500	3.498	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H](O)COc1ccc(Cl)cc1	ZINC000073615749	454458558	/nfs/dbraw/zinc/45/85/58/454458558.db2.gz	YTBJDYDIXWSENI-QGZVFWFLSA-N	0	3	330.815	3.083	20	30		EGEDHN
N#CCOc1cccc(NC(=O)c2cccc(CN3CCCC3)c2)c1	ZINC000064026664	454463923	/nfs/dbraw/zinc/46/39/23/454463923.db2.gz	FFOVTHQYEZYXCR-UHFFFAOYSA-N	0	3	335.407	3.437	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CN[C@@H]1CCC[C@H]1c1ccccc1	ZINC000133754623	454464429	/nfs/dbraw/zinc/46/44/29/454464429.db2.gz	GKLCUJXTSNARDN-JKSUJKDBSA-N	0	3	325.437	3.484	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCCc2c(C)cccc2C)CC1	ZINC000121879545	454488413	/nfs/dbraw/zinc/48/84/13/454488413.db2.gz	CMDUFGWRINRCAT-UHFFFAOYSA-N	0	3	329.488	3.186	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)cc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000048744901	454512976	/nfs/dbraw/zinc/51/29/76/454512976.db2.gz	KVWNLPAQVYUSHM-OAHLLOKOSA-N	0	3	349.434	3.066	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN(Cc1ccccc1)CC1CCC1	ZINC000065161706	454533739	/nfs/dbraw/zinc/53/37/39/454533739.db2.gz	UECLWBXCKUTVBX-KRWDZBQOSA-N	0	3	327.472	3.297	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2c(C)cc(Br)cc2C)CC1	ZINC000122492481	454538472	/nfs/dbraw/zinc/53/84/72/454538472.db2.gz	KNVXGALOSXNQSK-UHFFFAOYSA-N	0	3	349.272	3.350	20	30		EGEDHN
C=C(C)CN1CCC[C@H](C(=O)Nc2ccc(Br)cn2)C1	ZINC000103469087	454559283	/nfs/dbraw/zinc/55/92/83/454559283.db2.gz	VMXQNVPEHYTHAW-LBPRGKRZSA-N	0	3	338.249	3.071	20	30		EGEDHN
CN(CCC1CCN(c2ccncc2)CC1)C(=O)C#Cc1ccccc1	ZINC000092504729	454576468	/nfs/dbraw/zinc/57/64/68/454576468.db2.gz	KIDDKIJCCVJKCY-UHFFFAOYSA-N	0	3	347.462	3.198	20	30		EGEDHN
C[C@@](C#N)(NC(=O)CN[C@@H](c1ccc(F)cc1)C1CCC1)C1CC1	ZINC000104706137	454596491	/nfs/dbraw/zinc/59/64/91/454596491.db2.gz	TXSUTDOGZPUOGA-MOPGFXCFSA-N	0	3	329.419	3.065	20	30		EGEDHN
C=CCN(Cc1cccc(C#N)c1)C(=O)[C@H](C)N1CCCCCC1	ZINC000074534319	454598552	/nfs/dbraw/zinc/59/85/52/454598552.db2.gz	NIGSHYNMYXYOSN-KRWDZBQOSA-N	0	3	325.456	3.337	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)C2(C#N)CCCCC2)CN1Cc1ccccc1	ZINC000134924449	454609354	/nfs/dbraw/zinc/60/93/54/454609354.db2.gz	VKKPRUKWGOQETM-FUHWJXTLSA-N	0	3	325.456	3.240	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CN2CCC[C@H]2c2cccc(F)c2)cc1	ZINC000051472506	454626304	/nfs/dbraw/zinc/62/63/04/454626304.db2.gz	PFBKBXWFIWPVCF-ICSRJNTNSA-N	0	3	340.398	3.274	20	30		EGEDHN
C=CCN(CCc1ccccc1)Cc1cc(=O)n2cc(C)ccc2n1	ZINC000065959831	454644699	/nfs/dbraw/zinc/64/46/99/454644699.db2.gz	XDIHGTJXUJQLRA-UHFFFAOYSA-N	0	3	333.435	3.234	20	30		EGEDHN
CCC[C@@H]1CN(c2ccc3cc(C#N)ccc3n2)CCN1CCOC	ZINC000092940925	454656504	/nfs/dbraw/zinc/65/65/04/454656504.db2.gz	ODSMPJGNZUXUGU-GOSISDBHSA-N	0	3	338.455	3.044	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)/C=C/c2ccccc2OCC)CC1	ZINC000106038043	454675763	/nfs/dbraw/zinc/67/57/63/454675763.db2.gz	ZPVUJIUHVRDJIP-MDZDMXLPSA-N	0	3	328.456	3.255	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC2CCN(CC(=C)C)CC2)cc1OC	ZINC000106040848	454676009	/nfs/dbraw/zinc/67/60/09/454676009.db2.gz	DMMHILWUSQHVFR-UHFFFAOYSA-N	0	3	344.455	3.030	20	30		EGEDHN
C=C(C)CN1CCC([NH2+]Cc2cc(Br)ccc2[O-])CC1	ZINC000106245394	454688042	/nfs/dbraw/zinc/68/80/42/454688042.db2.gz	HMTZAJVDYYFYKC-UHFFFAOYSA-N	0	3	339.277	3.285	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2ccccc2OC(C)C)CC1	ZINC000106262092	454688734	/nfs/dbraw/zinc/68/87/34/454688734.db2.gz	RTABDKRMSBKWQT-UHFFFAOYSA-N	0	3	345.487	3.314	20	30		EGEDHN
CCc1ccc(C2=CCN(CCC(=O)N(C)CCC#N)CC2)cc1	ZINC000093263671	454697073	/nfs/dbraw/zinc/69/70/73/454697073.db2.gz	IWHARFRQSCCBCU-UHFFFAOYSA-N	0	3	325.456	3.100	20	30		EGEDHN
C=CCOc1ccc(CNC[C@@](C)(O)c2ccsc2)cc1OC	ZINC000124084962	454698579	/nfs/dbraw/zinc/69/85/79/454698579.db2.gz	FXXPAEINTGDKNW-GOSISDBHSA-N	0	3	333.453	3.319	20	30		EGEDHN
COC[C@@H]1CCCN(Cc2ccc(OC)c(OCCCC#N)c2)C1	ZINC000093338043	454703739	/nfs/dbraw/zinc/70/37/39/454703739.db2.gz	MDSLLWACAHQNNO-QGZVFWFLSA-N	0	3	332.444	3.236	20	30		EGEDHN
Cc1ccccc1NC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000161668018	454712760	/nfs/dbraw/zinc/71/27/60/454712760.db2.gz	LTWQCZMHHSQNIP-UHFFFAOYSA-N	0	3	336.439	3.462	20	30		EGEDHN
C#CCOc1ccccc1CN1CCC(OC[C@H]2CCCCO2)CC1	ZINC000093842347	454739629	/nfs/dbraw/zinc/73/96/29/454739629.db2.gz	QLMPBNADUOZJIW-HXUWFJFHSA-N	0	3	343.467	3.249	20	30		EGEDHN
CCOc1ccccc1NC(=O)CCN(C)Cc1ccc(C#N)cc1	ZINC000136480626	454743984	/nfs/dbraw/zinc/74/39/84/454743984.db2.gz	MLYZQHRFXXWKBE-UHFFFAOYSA-N	0	3	337.423	3.418	20	30		EGEDHN
CC1CCN([C@@H](CNC(=O)c2ccc(C#N)cn2)c2ccccc2)CC1	ZINC000107565745	454763836	/nfs/dbraw/zinc/76/38/36/454763836.db2.gz	JKSGJDAXNZYKHE-FQEVSTJZSA-N	0	3	348.450	3.156	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H](CCNCc2ccc(C#N)s2)C1	ZINC000176965644	454805345	/nfs/dbraw/zinc/80/53/45/454805345.db2.gz	WNPHYJVQUBOIBY-ZDUSSCGKSA-N	0	3	335.473	3.356	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)[C@H](C)c2cccc(O)c2)CC1	ZINC000109174635	454823256	/nfs/dbraw/zinc/82/32/56/454823256.db2.gz	HHIFDINFGQUWGZ-OAHLLOKOSA-N	0	3	331.460	3.135	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC2(c3cccc(OC)c3)CC2)CC1	ZINC000125607337	454834429	/nfs/dbraw/zinc/83/44/29/454834429.db2.gz	CKVHEEZNOYEXRM-UHFFFAOYSA-N	0	3	343.471	3.024	20	30		EGEDHN
C=CCCOCC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1	ZINC000142824129	454838876	/nfs/dbraw/zinc/83/88/76/454838876.db2.gz	OIELXLNIBDXAOC-INIZCTEOSA-N	0	3	336.501	3.230	20	30		EGEDHN
CN(C)[C@@H](CNC(=O)CSc1cccc(C#N)c1)c1ccccc1	ZINC000177355645	454856042	/nfs/dbraw/zinc/85/60/42/454856042.db2.gz	YEUYIQQHWXZQJS-SFHVURJKSA-N	0	3	339.464	3.069	20	30		EGEDHN
CCN(CCc1ccccc1)[C@H](C)C(=O)NC1(C#N)CCCCC1	ZINC000154075676	454862670	/nfs/dbraw/zinc/86/26/70/454862670.db2.gz	XIRGTSPZSKWGID-QGZVFWFLSA-N	0	3	327.472	3.282	20	30		EGEDHN
C[C@@H](CNC(=O)Nc1ccc(CC#N)cc1)N(C)Cc1ccccc1	ZINC000111715161	454873329	/nfs/dbraw/zinc/87/33/29/454873329.db2.gz	XKQUGZSTTSMHNL-INIZCTEOSA-N	0	3	336.439	3.395	20	30		EGEDHN
C#CCOc1ccc(CNCc2ccccc2CN2CCCC2=O)cc1	ZINC000113320432	454923333	/nfs/dbraw/zinc/92/33/33/454923333.db2.gz	UEHDELWFBVPXNU-UHFFFAOYSA-N	0	3	348.446	3.111	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H](c2cccc(F)c2)C(C)(C)C)CC1	ZINC000178135425	454937039	/nfs/dbraw/zinc/93/70/39/454937039.db2.gz	LHLXETAWZFCVRP-GOSISDBHSA-N	0	3	330.447	3.374	20	30		EGEDHN
COCC(C)(C)NCC(=O)Nc1c(C#N)c(C)c(C)n1C1CCCC1	ZINC000154892547	454940155	/nfs/dbraw/zinc/94/01/55/454940155.db2.gz	JBAPKFGOOLRVJJ-UHFFFAOYSA-N	0	3	346.475	3.045	20	30		EGEDHN
N#Cc1ccsc1NC(=O)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000170700340	454960169	/nfs/dbraw/zinc/96/01/69/454960169.db2.gz	CJVZGGVWSSJIIS-MRXNPFEDSA-N	0	3	325.437	3.470	20	30		EGEDHN
N#Cc1ccc(CCC(=O)NC[C@H]2CCCN2Cc2ccccc2)cc1	ZINC000114642777	454965158	/nfs/dbraw/zinc/96/51/58/454965158.db2.gz	RXOOUMALWOMFRJ-OAQYLSRUSA-N	0	3	347.462	3.272	20	30		EGEDHN
COCCCOc1cccc(CNCc2ccc(OC)c(C#N)c2)c1	ZINC000179086680	455006229	/nfs/dbraw/zinc/00/62/29/455006229.db2.gz	HNOYSEUESSODAE-UHFFFAOYSA-N	0	3	340.423	3.272	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)c1c(F)cccc1F	ZINC000155653339	455027172	/nfs/dbraw/zinc/02/71/72/455027172.db2.gz	HVQYKBGQXOYLSU-UHFFFAOYSA-N	0	3	343.377	3.040	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(Br)c(C)c2)CC1	ZINC000179312696	455031675	/nfs/dbraw/zinc/03/16/75/455031675.db2.gz	JUAUJLYLIIUKMV-UHFFFAOYSA-N	0	3	337.261	3.138	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC(C)(C)c2nc(C)cs2)CC1	ZINC000116547383	455061713	/nfs/dbraw/zinc/06/17/13/455061713.db2.gz	BPFAIUQGNOPEMO-UHFFFAOYSA-N	0	3	336.505	3.026	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCCOC2CCCCCC2)CC1	ZINC000118481723	455106354	/nfs/dbraw/zinc/10/63/54/455106354.db2.gz	GFMLPQHPYFURFJ-UHFFFAOYSA-N	0	3	337.508	3.066	20	30		EGEDHN
C[C@H](N[C@H](c1ccc(Cl)cc1)[C@H]1C[C@H]1C)C(=O)N(C)CCC#N	ZINC000180021947	455117666	/nfs/dbraw/zinc/11/76/66/455117666.db2.gz	RLORCBSTKASKOR-OSRSDYAFSA-N	0	3	333.863	3.387	20	30		EGEDHN
C[C@H](N[C@H](c1ccc(Cl)cc1)[C@@H]1C[C@H]1C)C(=O)N(C)CCC#N	ZINC000180021981	455118056	/nfs/dbraw/zinc/11/80/56/455118056.db2.gz	RLORCBSTKASKOR-DLTLXFJOSA-N	0	3	333.863	3.387	20	30		EGEDHN
N#Cc1cnc(NCC2CCN(c3ccncc3)CC2)c(Cl)c1	ZINC000180046282	455121710	/nfs/dbraw/zinc/12/17/10/455121710.db2.gz	TVLKXBDLLIZTKB-UHFFFAOYSA-N	0	3	327.819	3.330	20	30		EGEDHN
CC(C)(CCC#N)CNc1cccc(CN2CCC(C(N)=O)CC2)c1	ZINC000156499634	455125870	/nfs/dbraw/zinc/12/58/70/455125870.db2.gz	VPFZRUMYJVHWFG-UHFFFAOYSA-N	0	3	342.487	3.126	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2C[C@H](c3ccccc3)C[C@H]2C)CC1	ZINC000172150892	455128397	/nfs/dbraw/zinc/12/83/97/455128397.db2.gz	YGLBZVWQVVFEMV-SJLPKXTDSA-N	0	3	327.472	3.224	20	30		EGEDHN
C=CCSCCNCc1c(Cl)cccc1N1CCN(C)CC1	ZINC000180124231	455135142	/nfs/dbraw/zinc/13/51/42/455135142.db2.gz	GZVHKKBUPHZZOQ-UHFFFAOYSA-N	0	3	339.936	3.101	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)CCc2ccc(Cl)cc2)CC1	ZINC000172264965	455141170	/nfs/dbraw/zinc/14/11/70/455141170.db2.gz	DQOWBNDSBMGOSL-UHFFFAOYSA-N	0	3	335.879	3.174	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN[C@H](C)c1cccc([N+](=O)[O-])c1	ZINC000180454675	455172667	/nfs/dbraw/zinc/17/26/67/455172667.db2.gz	VUVDJWSWRQUBBT-CYBMUJFWSA-N	0	3	341.367	3.205	20	30		EGEDHN
CCS[C@@H]1CCCC[C@@H]1NCC(=O)Nc1oc(C)c(C)c1C#N	ZINC000189512684	455211314	/nfs/dbraw/zinc/21/13/14/455211314.db2.gz	HPRFZNRYBDIKMF-LSDHHAIUSA-N	0	3	335.473	3.361	20	30		EGEDHN
CC[C@@H](NCCOc1ccccc1C#N)c1ccc2c(c1)OCCO2	ZINC000180646546	455217101	/nfs/dbraw/zinc/21/71/01/455217101.db2.gz	WTPKSLAZFZLKGT-QGZVFWFLSA-N	0	3	338.407	3.449	20	30		EGEDHN
Cc1noc([C@@H]2CCCN(Cc3ccc(O[C@H](C)C#N)cc3)C2)n1	ZINC000245537881	455324197	/nfs/dbraw/zinc/32/41/97/455324197.db2.gz	JHYUNCCUFRMUPR-CZUORRHYSA-N	0	3	326.400	3.049	20	30		EGEDHN
CCCn1cc(C(=O)C(C#N)C(=O)Nc2cccc3ccccc32)cn1	ZINC000181516647	455348019	/nfs/dbraw/zinc/34/80/19/455348019.db2.gz	OIWBUAVEFGWMAQ-KRWDZBQOSA-N	0	3	346.390	3.407	20	30		EGEDHN
C[C@@H](NCC(=O)N(C)C1(C#N)CCCCC1)[C@H](C)c1ccccc1	ZINC000181542815	455352480	/nfs/dbraw/zinc/35/24/80/455352480.db2.gz	SQMPFQDHTOWOHI-DLBZAZTESA-N	0	3	327.472	3.453	20	30		EGEDHN
C[C@@H](NCCC(=O)NC1CCCCC1)c1ccc(OCC#N)cc1	ZINC000181546386	455353272	/nfs/dbraw/zinc/35/32/72/455353272.db2.gz	VPWLABMWURVCHX-OAHLLOKOSA-N	0	3	329.444	3.079	20	30		EGEDHN
Cc1ccc(O)c([C@H](C)N[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)c1	ZINC000190618236	455354340	/nfs/dbraw/zinc/35/43/40/455354340.db2.gz	CPFGSMQOIRZAEU-HNAYVOBHSA-N	0	3	349.434	3.024	20	30		EGEDHN
Cc1ccccc1CN1CCCN(C(=O)c2ccccc2CC#N)CC1	ZINC000600996208	460668984	/nfs/dbraw/zinc/66/89/84/460668984.db2.gz	YBQHSXCFMKGJSY-UHFFFAOYSA-N	0	3	347.462	3.409	20	30		EGEDHN
C[C@H](C#N)Oc1ccccc1NC(=O)NC[C@H](C)N1CCC(C)CC1	ZINC000184356568	455373236	/nfs/dbraw/zinc/37/32/36/455373236.db2.gz	LPYFXVJBZKFORK-JKSUJKDBSA-N	0	3	344.459	3.219	20	30		EGEDHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(C#N)c(Cl)c1	ZINC000159934993	455416911	/nfs/dbraw/zinc/41/69/11/455416911.db2.gz	WWNVSAWYNUWXRQ-CQSZACIVSA-N	0	3	341.842	3.462	20	30		EGEDHN
C=CCCC[C@@H](C)N[C@H](C(N)=O)c1ccc(Br)cc1	ZINC000182343716	455493631	/nfs/dbraw/zinc/49/36/31/455493631.db2.gz	IPAGWTQWNAEJPZ-RISCZKNCSA-N	0	3	325.250	3.310	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(Cc3ccc(F)c(C#N)c3)CC2)cc1	ZINC000160627722	455481661	/nfs/dbraw/zinc/48/16/61/455481661.db2.gz	VQNBVACMYTXRSC-UHFFFAOYSA-N	0	3	348.425	3.277	20	30		EGEDHN
C=CCCC[C@H](C)N[C@@H](C(N)=O)c1ccc(Br)cc1	ZINC000182343736	455493661	/nfs/dbraw/zinc/49/36/61/455493661.db2.gz	IPAGWTQWNAEJPZ-SMDDNHRTSA-N	0	3	325.250	3.310	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCc1ccc(CN2CCN(CC)CC2)cc1	ZINC000185167828	455514942	/nfs/dbraw/zinc/51/49/42/455514942.db2.gz	WDJWKEMODHOGSF-GOSISDBHSA-N	0	3	343.515	3.043	20	30		EGEDHN
CCS[C@H]1CCCCN([C@H](C)C(=O)NC2(C#N)CCCCC2)C1	ZINC000246684734	455517256	/nfs/dbraw/zinc/51/72/56/455517256.db2.gz	VUYSQTIKEDCRKV-CVEARBPZSA-N	0	3	337.533	3.325	20	30		EGEDHN
CN(C)CCN(Cc1cccs1)C(=O)Nc1ccc(F)cc1C#N	ZINC000176030135	455530375	/nfs/dbraw/zinc/53/03/75/455530375.db2.gz	QVEAXYPJXHBNRG-UHFFFAOYSA-N	0	3	346.431	3.355	20	30		EGEDHN
N#C[C@H](NC(=O)c1ccc(CN2CCCC2)cc1)C1CCCCC1	ZINC000267282868	455530882	/nfs/dbraw/zinc/53/08/82/455530882.db2.gz	SSBHIKPDCPAHQS-IBGZPJMESA-N	0	3	325.456	3.485	20	30		EGEDHN
C[C@@H]1CN(C)CC[C@H]1N(C)C(=O)N[C@H](CCC#N)c1ccccc1	ZINC000247062103	455553780	/nfs/dbraw/zinc/55/37/80/455553780.db2.gz	ZVHAPLBELRWNNV-KBAYOESNSA-N	0	3	328.460	3.013	20	30		EGEDHN
C[C@@H]1CN(C[C@@H](O)COc2ccc(CC#N)cc2)[C@@H]1c1ccccc1	ZINC000247380836	455593492	/nfs/dbraw/zinc/59/34/92/455593492.db2.gz	UGHWGKNRVUZVSU-BSIFCXSSSA-N	0	3	336.435	3.185	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H]2CN(Cc3ccc(C#N)cc3)CC[C@@H]21	ZINC000292259536	455611346	/nfs/dbraw/zinc/61/13/46/455611346.db2.gz	PJDQCJRGBBSXGO-ROUUACIJSA-N	0	3	341.455	3.390	20	30		EGEDHN
CC[C@H](N[C@@H]1CCC[C@H](C#N)C1)c1ccccc1OCC(=O)N(C)C	ZINC000185786594	455621603	/nfs/dbraw/zinc/62/16/03/455621603.db2.gz	MFJJIZMBPXFHSU-JZXOWHBKSA-N	0	3	343.471	3.277	20	30		EGEDHN
CN(C)CCN(Cc1ccco1)c1nc(C(F)(F)F)ccc1C#N	ZINC000268334355	455654382	/nfs/dbraw/zinc/65/43/82/455654382.db2.gz	QQJSOUJYAKYWQD-UHFFFAOYSA-N	0	3	338.333	3.133	20	30		EGEDHN
CC(C)(CCc1ccccc1)NCC(=O)NCc1ccc(C#N)cc1	ZINC000268337626	455654401	/nfs/dbraw/zinc/65/44/01/455654401.db2.gz	ORNRWNHYWIEOFH-UHFFFAOYSA-N	0	3	335.451	3.175	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C	ZINC000249274243	455747103	/nfs/dbraw/zinc/74/71/03/455747103.db2.gz	LMJQBRVKZSMPOC-RXVVDRJESA-N	0	3	344.499	3.338	20	30		EGEDHN
C#CC[C@H](NC[C@H](O)COCc1ccccc1F)c1ccccc1	ZINC000271762444	455750390	/nfs/dbraw/zinc/75/03/90/455750390.db2.gz	ZWLRWIAAPPLERI-ICSRJNTNSA-N	0	3	327.399	3.057	20	30		EGEDHN
[O-]c1ccc2ccccc2c1/C=N/C1CC[NH+]([C@H]2CCC[C@@H]2O)CC1	ZINC000269035736	455769664	/nfs/dbraw/zinc/76/96/64/455769664.db2.gz	OJAOWAFMOMOJLR-OYGDCGAPSA-N	0	3	338.451	3.342	20	30		EGEDHN
Cn1cc(CN2CCC[C@@H]2[C@@H]2CCCO2)c(-c2ccc(C#N)cc2)n1	ZINC000284989997	455773843	/nfs/dbraw/zinc/77/38/43/455773843.db2.gz	YJRJVWBJKQXBRO-MOPGFXCFSA-N	0	3	336.439	3.102	20	30		EGEDHN
COC(=O)CCCN1CCC(N[C@H](CCC#N)c2ccccc2)CC1	ZINC000271826336	455775740	/nfs/dbraw/zinc/77/57/40/455775740.db2.gz	PWKKHHNRBFESOW-LJQANCHMSA-N	0	3	343.471	3.039	20	30		EGEDHN
COC(=O)[C@@H]1CN([C@@H]2CC[C@@H](C#N)C2)C[C@H]1c1ccc(Cl)cc1	ZINC000293567543	455791094	/nfs/dbraw/zinc/79/10/94/455791094.db2.gz	MROYVYXLOULZCZ-VDNDLQMASA-N	0	3	332.831	3.221	20	30		EGEDHN
COc1cc(OC)cc(OCCN[C@H](C)c2ccc(C#N)c(F)c2)c1	ZINC000271919579	455799687	/nfs/dbraw/zinc/79/96/87/455799687.db2.gz	DGDIPBZOMSXSHV-CYBMUJFWSA-N	0	3	344.386	3.444	20	30		EGEDHN
C=CCN(CCC#N)C(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F	ZINC000293927142	455801087	/nfs/dbraw/zinc/80/10/87/455801087.db2.gz	SZGZYIVGHQZYAU-QGZVFWFLSA-N	0	3	347.409	3.072	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](c2ccccc2)C(F)F)CC1	ZINC000294152602	455806825	/nfs/dbraw/zinc/80/68/25/455806825.db2.gz	HNLXMTAURVLVTE-MRXNPFEDSA-N	0	3	337.414	3.333	20	30		EGEDHN
C=CCOc1ccc(CC(=O)NCc2ccccc2CN(C)C)cc1	ZINC000294572742	455820697	/nfs/dbraw/zinc/82/06/97/455820697.db2.gz	XMTCUIUGVGWBCG-UHFFFAOYSA-N	0	3	338.451	3.172	20	30		EGEDHN
C[C@@H](CNC(=O)C(C)(C)c1cc(F)cc(C#N)c1)N1CCC[C@H](C)C1	ZINC000285315140	455823064	/nfs/dbraw/zinc/82/30/64/455823064.db2.gz	XETHISOQXZYCBH-GJZGRUSLSA-N	0	3	345.462	3.212	20	30		EGEDHN
COc1ccc(CNCC2([C@@H](O)C(C)C)CC2)cc1OCCCC#N	ZINC000272075716	455840691	/nfs/dbraw/zinc/84/06/91/455840691.db2.gz	QHHOJVUKMJKSHF-IBGZPJMESA-N	0	3	346.471	3.264	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CN(Cc2ccccc2)CCCO1	ZINC000278702178	455845135	/nfs/dbraw/zinc/84/51/35/455845135.db2.gz	TVTVCNZTADIGMY-QFIPXVFZSA-N	0	3	349.478	3.281	20	30		EGEDHN
CCN1CCN(c2ccc(F)cc2[C@H](C)N[C@@H]2CC[C@H](C#N)C2)CC1	ZINC000278709249	455845692	/nfs/dbraw/zinc/84/56/92/455845692.db2.gz	UFARPBCVFIQZJZ-XYJFISCASA-N	0	3	344.478	3.310	20	30		EGEDHN
CC(C)N1CCCN(C(=O)N[C@H](CCC#N)c2ccccc2)CC1	ZINC000269629193	455851498	/nfs/dbraw/zinc/85/14/98/455851498.db2.gz	FFOWDONFCDCWAE-GOSISDBHSA-N	0	3	328.460	3.157	20	30		EGEDHN
Cc1ncc(CO)c(/C=N/C2CCC([NH+]3CCC(C)CC3)CC2)c1[O-]	ZINC000269734669	455852585	/nfs/dbraw/zinc/85/25/85/455852585.db2.gz	ZXGBVSMIBJEXRM-WSDLNYQXSA-N	0	3	345.487	3.050	20	30		EGEDHN
CC1(C)CN(Cc2cn(CCC#N)nc2-c2ccncc2)CCS1	ZINC000279345699	455863350	/nfs/dbraw/zinc/86/33/50/455863350.db2.gz	FKMAMCGCJWXTAE-UHFFFAOYSA-N	0	3	341.484	3.186	20	30		EGEDHN
CC[C@H](Cc1ccccc1)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000279436963	455864635	/nfs/dbraw/zinc/86/46/35/455864635.db2.gz	YGPMGGMDFSYSTH-WOJBJXKFSA-N	0	3	331.419	3.378	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H]2CC[C@@H](c3ccc(F)cc3)C2)CC1	ZINC000279395429	455864646	/nfs/dbraw/zinc/86/46/46/455864646.db2.gz	ATSOFGQIVJJWGB-APWZRJJASA-N	0	3	345.462	3.411	20	30		EGEDHN
Cc1ccsc1CN[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000272165213	455864713	/nfs/dbraw/zinc/86/47/13/455864713.db2.gz	FERDBIJKTMNOJM-INIZCTEOSA-N	0	3	325.437	3.213	20	30		EGEDHN
COc1ccc(C)cc1[C@H](C)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000279684084	455870010	/nfs/dbraw/zinc/87/00/10/455870010.db2.gz	HEISEZMLGFSRSM-MAUKXSAKSA-N	0	3	347.418	3.435	20	30		EGEDHN
CC(C)C[C@@H](CN1CCCC1)NC(=O)Nc1ccc(CC#N)cc1	ZINC000296170643	455871309	/nfs/dbraw/zinc/87/13/09/455871309.db2.gz	BKETYXPWNRTZGK-SFHVURJKSA-N	0	3	328.460	3.385	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN2C[C@@H](N3CCCC3)C[C@H]2C)c1C	ZINC000285578532	455875189	/nfs/dbraw/zinc/87/51/89/455875189.db2.gz	OGTUVULSEZGWFI-QAPCUYQASA-N	0	3	329.488	3.032	20	30		EGEDHN
CN(C)Cc1cccc(CNC(=O)c2ccc(C(C)(C)C#N)cc2)c1	ZINC000279977799	455878710	/nfs/dbraw/zinc/87/87/10/455878710.db2.gz	QGQKOZNZRJIWNX-UHFFFAOYSA-N	0	3	335.451	3.479	20	30		EGEDHN
C#Cc1cccc(NC(=O)N[C@@H](CN(C)C)c2ccc(OC)cc2)c1	ZINC000285619463	455882632	/nfs/dbraw/zinc/88/26/32/455882632.db2.gz	VVHSRTIMVCYOJI-IBGZPJMESA-N	0	3	337.423	3.101	20	30		EGEDHN
CCC[C@@]1(NCC(=O)N(CCC#N)c2cccc(Cl)c2)CCOC1	ZINC000285650239	455889564	/nfs/dbraw/zinc/88/95/64/455889564.db2.gz	SJSFLOXNIXHCLX-GOSISDBHSA-N	0	3	349.862	3.135	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@@]1(CCC)CCOC1	ZINC000285666536	455893427	/nfs/dbraw/zinc/89/34/27/455893427.db2.gz	TXZDLMDGVLUZJV-SFHVURJKSA-N	0	3	334.485	3.452	20	30		EGEDHN
C=C(C)[C@@H](N[C@@H](C)C1CCS(=O)(=O)CC1)c1ccc(F)c(F)c1	ZINC000187567739	455926165	/nfs/dbraw/zinc/92/61/65/455926165.db2.gz	JEXGJCWQKKEHED-YVEFUNNKSA-N	0	3	343.439	3.385	20	30		EGEDHN
C=CCC[C@H](NC(=O)N1CC[C@H]2CCN(C)C[C@@H]21)c1ccccc1	ZINC000272633275	456020881	/nfs/dbraw/zinc/02/08/81/456020881.db2.gz	XFXZUHMQEQWMLG-QYZOEREBSA-N	0	3	327.472	3.430	20	30		EGEDHN
CN1CC=C(CNc2nc3c(c(C#N)c2C#N)CCCCCC3)CC1	ZINC000280643121	456021324	/nfs/dbraw/zinc/02/13/24/456021324.db2.gz	DOFGPBZNOHHXMS-UHFFFAOYSA-N	0	3	335.455	3.158	20	30		EGEDHN
C=CCN1CCC(NC(=O)/C=C/Sc2cc(F)ccc2F)CC1	ZINC000280667050	456027000	/nfs/dbraw/zinc/02/70/00/456027000.db2.gz	POSSAXUVUQTTHJ-YRNVUSSQSA-N	0	3	338.423	3.337	20	30		EGEDHN
C=C(C)CN(Cc1ccccc1)C(=O)N[C@H](C)C1=CCN(C)CC1	ZINC000280767833	456048319	/nfs/dbraw/zinc/04/83/19/456048319.db2.gz	DBZFTRNFPFBWCG-QGZVFWFLSA-N	0	3	327.472	3.425	20	30		EGEDHN
CNC(=O)OC[C@H]1CCCCN1Cc1ccccc1C(C)(C)C#N	ZINC000287002594	456059155	/nfs/dbraw/zinc/05/91/55/456059155.db2.gz	QCZUBFSSYIIKSL-MRXNPFEDSA-N	0	3	329.444	3.198	20	30		EGEDHN
C[C@H]1C[C@H](N2CCCC2)CN1C(=O)Nc1ccc(C#N)cc1Cl	ZINC000287292227	456065770	/nfs/dbraw/zinc/06/57/70/456065770.db2.gz	ZAQIRMYRNTYWTP-JSGCOSHPSA-N	0	3	332.835	3.302	20	30		EGEDHN
CN(C)CCN(Cc1cccc(F)c1)c1nc(Cl)c(C#N)s1	ZINC000287851520	456080580	/nfs/dbraw/zinc/08/05/80/456080580.db2.gz	MIFXYWHLQPGLLW-UHFFFAOYSA-N	0	3	338.839	3.375	20	30		EGEDHN
C=CCCN(C)C(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000288129391	456087337	/nfs/dbraw/zinc/08/73/37/456087337.db2.gz	YVVRNPONGNRJFF-SFHVURJKSA-N	0	3	333.476	3.294	20	30		EGEDHN
C=C[C@@](C)(CCOC)c1nc(-c2cccc(OCCN(C)C)c2)no1	ZINC000289064205	456113082	/nfs/dbraw/zinc/11/30/82/456113082.db2.gz	GMQDOZQHLNXGBB-IBGZPJMESA-N	0	3	345.443	3.157	20	30		EGEDHN
C[C@@H](CCCNC(=O)OC(C)(C)C)NCc1ccc(C#N)cc1F	ZINC000289538161	456129796	/nfs/dbraw/zinc/12/97/96/456129796.db2.gz	BLXCHMLMASASMG-ZDUSSCGKSA-N	0	3	335.423	3.480	20	30		EGEDHN
COc1ccc2c(c1)C1(CC1)CN(C[C@H](O)c1ccc(C#N)cc1)C2	ZINC000289661800	456135673	/nfs/dbraw/zinc/13/56/73/456135673.db2.gz	UJBZQCMQLQVSER-FQEVSTJZSA-N	0	3	334.419	3.148	20	30		EGEDHN
C=C[C@H](CO)NCc1ccc(OCc2ccc(F)cc2)c(OC)c1	ZINC000289711517	456137994	/nfs/dbraw/zinc/13/79/94/456137994.db2.gz	FBUGVHQHZMFZDR-QGZVFWFLSA-N	0	3	331.387	3.050	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1F)c1ccc(Cl)c(C#N)n1	ZINC000301616415	456163663	/nfs/dbraw/zinc/16/36/63/456163663.db2.gz	BZEZZCBVDWXEGO-UHFFFAOYSA-N	0	3	332.810	3.314	20	30		EGEDHN
CCc1nnc(N2CCCN(Cc3ccccc3)CC2)c(C#N)c1CC	ZINC000301629687	456167740	/nfs/dbraw/zinc/16/77/40/456167740.db2.gz	SELWSUNWFZIRRR-UHFFFAOYSA-N	0	3	349.482	3.185	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC[C@H](c3cccc(C)c3)C2)CC1	ZINC000273453952	456231771	/nfs/dbraw/zinc/23/17/71/456231771.db2.gz	CYTGAFXYXXANQU-SFHVURJKSA-N	0	3	327.472	3.144	20	30		EGEDHN
Cc1ccc([O-])c([C@H](C)[NH2+][C@H]2CCCN(c3ccc(C#N)cc3)C2=O)c1	ZINC000273495117	456235003	/nfs/dbraw/zinc/23/50/03/456235003.db2.gz	XQJNSHDKANTWPD-KXBFYZLASA-N	0	3	349.434	3.419	20	30		EGEDHN
Cc1ccc(O)c([C@H](C)N[C@H]2CCCN(c3ccc(C#N)cc3)C2=O)c1	ZINC000273495117	456235012	/nfs/dbraw/zinc/23/50/12/456235012.db2.gz	XQJNSHDKANTWPD-KXBFYZLASA-N	0	3	349.434	3.419	20	30		EGEDHN
CO/N=C/c1ccc(C(=O)NC[C@@H](N)c2ccc(C(C)C)cc2)cc1	ZINC000237109708	456235277	/nfs/dbraw/zinc/23/52/77/456235277.db2.gz	OACUZEDHHUKZDK-AOOMUMSASA-N	0	3	339.439	3.220	20	30		EGEDHN
C#CCOc1cc(F)ccc1NC(=O)N(C)[C@H](C)C1CCN(C)CC1	ZINC000273529606	456236156	/nfs/dbraw/zinc/23/61/56/456236156.db2.gz	WAXMCARPRFQRGR-CQSZACIVSA-N	0	3	347.434	3.032	20	30		EGEDHN
CN(C)CCOc1ccccc1-c1noc(-c2cccc(CC#N)c2)n1	ZINC000274004570	456248910	/nfs/dbraw/zinc/24/89/10/456248910.db2.gz	YNPDHQOGXNTVKZ-UHFFFAOYSA-N	0	3	348.406	3.410	20	30		EGEDHN
C=CCc1cc(C(=O)N[C@H]2CCCN(C(C)C)C2)cc(OC)c1OC	ZINC000274412328	456257975	/nfs/dbraw/zinc/25/79/75/456257975.db2.gz	CDTHCVHYFKSKBW-KRWDZBQOSA-N	0	3	346.471	3.035	20	30		EGEDHN
C=C(Cl)COc1ccc([C@H](C)N[C@@H](C)C(=O)N2CCCC2)cc1	ZINC000281560435	456265840	/nfs/dbraw/zinc/26/58/40/456265840.db2.gz	JTQKKWZCPSMTLT-GJZGRUSLSA-N	0	3	336.863	3.479	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NC[C@H](c1ccccc1)N1CCCC1	ZINC000275643683	456278027	/nfs/dbraw/zinc/27/80/27/456278027.db2.gz	AWTKDBRACWNJOS-QUCCMNQESA-N	0	3	330.472	3.169	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NC[C@H](c1cccs1)N1CCCC1	ZINC000275749772	456304046	/nfs/dbraw/zinc/30/40/46/456304046.db2.gz	SDGYLYVUXRWKLK-QAPCUYQASA-N	0	3	336.501	3.230	20	30		EGEDHN
CSc1ccccc1[C@H](C)NC[C@@H](O)COc1ccc(C#N)cc1	ZINC000281761440	456312945	/nfs/dbraw/zinc/31/29/45/456312945.db2.gz	RRIOGZMDDWTKQT-GOEBONIOSA-N	0	3	342.464	3.371	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)s1)[C@@H](c1ccccc1)N1CCOCC1	ZINC000342947661	456332823	/nfs/dbraw/zinc/33/28/23/456332823.db2.gz	SYXYSPVZRIWQGU-BEFAXECRSA-N	0	3	341.480	3.171	20	30		EGEDHN
C=CCCOCCCCC(=O)Nc1cc(C)nn1C1CCN(C)CC1	ZINC000342965568	456337185	/nfs/dbraw/zinc/33/71/85/456337185.db2.gz	KXDFVZNRRCUPJN-UHFFFAOYSA-N	0	3	348.491	3.160	20	30		EGEDHN
C=CC[C@H](CC)NC(=O)NCC1(N2CCSCC2)CCCC1	ZINC000347746952	456347193	/nfs/dbraw/zinc/34/71/93/456347193.db2.gz	PWPYPBQTIMDNSP-HNNXBMFYSA-N	0	3	325.522	3.002	20	30		EGEDHN
C=CCOc1ccc(CN2CC[C@H](C(=O)N3CCCC3)C2)cc1Cl	ZINC000290544934	456359878	/nfs/dbraw/zinc/35/98/78/456359878.db2.gz	RMVLCZTXXZKDPI-INIZCTEOSA-N	0	3	348.874	3.349	20	30		EGEDHN
CN(CCCC1(C#N)CCOCC1)C[C@H]1OCCc2ccccc21	ZINC000281964188	456375175	/nfs/dbraw/zinc/37/51/75/456375175.db2.gz	KRTOFGPHFIBYIK-LJQANCHMSA-N	0	3	328.456	3.333	20	30		EGEDHN
C[C@@H](O)C[C@@H]1CCCCCN1Cc1nnc(-c2cccc(C#N)c2)o1	ZINC000352885295	456389483	/nfs/dbraw/zinc/38/94/83/456389483.db2.gz	DBEWLFLORHIIHA-PBHICJAKSA-N	0	3	340.427	3.124	20	30		EGEDHN
CN1CCN(CCCC2(C#N)CCOCC2)[C@@H](c2ccccc2)C1	ZINC000282024176	456392847	/nfs/dbraw/zinc/39/28/47/456392847.db2.gz	PLUSTFLJSBNZOM-LJQANCHMSA-N	0	3	327.472	3.076	20	30		EGEDHN
COc1ccc(C(=O)C(C#N)c2cnc3ccccc3n2)c(C)c1OC	ZINC000347888852	456424297	/nfs/dbraw/zinc/42/42/97/456424297.db2.gz	QDDOBLHFCOVZLT-AWEZNQCLSA-N	0	3	347.374	3.446	20	30		EGEDHN
CN(CCC(=O)Nc1cccc(C#N)c1)C[C@H]1OCCc2ccccc21	ZINC000337643596	456451155	/nfs/dbraw/zinc/45/11/55/456451155.db2.gz	HDRJMWOOSQLKDV-HXUWFJFHSA-N	0	3	349.434	3.133	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)N[C@H](C)CN1CCC[C@H](C)C1	ZINC000303467154	456461544	/nfs/dbraw/zinc/46/15/44/456461544.db2.gz	MVQFDZFYTUBXHZ-DLBZAZTESA-N	0	3	345.487	3.171	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1C[C@@H](F)CN1Cc1nccs1	ZINC000348080273	456461691	/nfs/dbraw/zinc/46/16/91/456461691.db2.gz	HWHMFKAUUFCKTD-IAGOWNOFSA-N	0	3	344.459	3.059	20	30		EGEDHN
C=CCN(Cc1ccccc1F)C(=O)NC[C@H]1CCCCN1CC	ZINC000303516026	456464791	/nfs/dbraw/zinc/46/47/91/456464791.db2.gz	XXGVOQNIWZCOGK-QGZVFWFLSA-N	0	3	333.451	3.398	20	30		EGEDHN
CC(C)[C@H]1CN(c2c(C#N)cnc3c(F)c(F)c(F)cc32)CCN1C	ZINC000343229323	456469164	/nfs/dbraw/zinc/46/91/64/456469164.db2.gz	RQLNGPZRIKSWOD-CQSZACIVSA-N	0	3	348.372	3.300	20	30		EGEDHN
COc1ccc(CN2CC[C@H](OC)C[C@H]2C)cc1OCCCC#N	ZINC000282307695	456472073	/nfs/dbraw/zinc/47/20/73/456472073.db2.gz	MTWNVMKZRRIFRN-WBVHZDCISA-N	0	3	332.444	3.377	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1C[C@H](F)CN1Cc1nccs1	ZINC000348108641	456486659	/nfs/dbraw/zinc/48/66/59/456486659.db2.gz	ULDFBSWCOOHWRC-IRXDYDNUSA-N	0	3	344.459	3.059	20	30		EGEDHN
COc1ccc(CNC[C@](C)(OC)C2CC2)cc1OCCCC#N	ZINC000291029066	456502295	/nfs/dbraw/zinc/50/22/95/456502295.db2.gz	IKISCFMUFHGJQW-IBGZPJMESA-N	0	3	332.444	3.282	20	30		EGEDHN
C#Cc1ccc(CN[C@@H](C)c2ccc(N3CCCNC3=O)cc2)cc1	ZINC000291044107	456507989	/nfs/dbraw/zinc/50/79/89/456507989.db2.gz	HBVOVBXYIALTEF-INIZCTEOSA-N	0	3	333.435	3.438	20	30		EGEDHN
CCc1nc(C#N)cc(N(C)C2CCN(Cc3ccccc3)CC2)n1	ZINC000308169122	456571632	/nfs/dbraw/zinc/57/16/32/456571632.db2.gz	OEPKVEAALLMTJF-UHFFFAOYSA-N	0	3	335.455	3.011	20	30		EGEDHN
C[C@@H](NCCC(=O)Nc1sc2c(c1C#N)CCC2)c1ccccn1	ZINC000299075970	456599595	/nfs/dbraw/zinc/59/95/95/456599595.db2.gz	TXBAENALIZVHPO-GFCCVEGCSA-N	0	3	340.452	3.183	20	30		EGEDHN
C[C@H](NCCC(=O)Nc1cccc(C#N)c1)c1ccc2n[nH]cc2c1	ZINC000353328615	456642721	/nfs/dbraw/zinc/64/27/21/456642721.db2.gz	MWINZAHKVULHON-ZDUSSCGKSA-N	0	3	333.395	3.114	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)Cc1ccc(Cl)cc1-n1cncn1	ZINC000353387637	456666583	/nfs/dbraw/zinc/66/65/83/456666583.db2.gz	ZEKZZYCUPFEMMK-UHFFFAOYSA-N	0	3	337.814	3.424	20	30		EGEDHN
C=CCC[C@@H](NC1CCN(S(=O)(=O)CCC)CC1)c1ccco1	ZINC000353462252	456701481	/nfs/dbraw/zinc/70/14/81/456701481.db2.gz	OKCWSJLFYGVXMS-MRXNPFEDSA-N	0	3	340.489	3.081	20	30		EGEDHN
C[C@@H](CCCC(F)(F)F)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000348510938	456722828	/nfs/dbraw/zinc/72/28/28/456722828.db2.gz	QOCBQVQEWGTPOF-SWLSCSKDSA-N	0	3	337.345	3.478	20	30		EGEDHN
C[C@H](N[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2)C(=O)NC(=O)NC1CCCCC1	ZINC000328673210	456733211	/nfs/dbraw/zinc/73/32/11/456733211.db2.gz	IWUQXRAADXHRBM-HNKHHVNMSA-N	0	3	349.475	3.125	20	30		EGEDHN
Cc1nc(NC(=O)[C@H](C)N[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)sc1C	ZINC000328676109	456735621	/nfs/dbraw/zinc/73/56/21/456735621.db2.gz	LEOFYWXIHXKRGW-ASEORRQLSA-N	0	3	335.473	3.284	20	30		EGEDHN
CN1CCC(Oc2ccc(NCc3ccc(C#N)cc3F)cn2)CC1	ZINC000338268821	456739840	/nfs/dbraw/zinc/73/98/40/456739840.db2.gz	ZZEIHFMDHMQBPO-UHFFFAOYSA-N	0	3	340.402	3.177	20	30		EGEDHN
Cc1cccc(CN(C)CCC(=O)Nc2ccc(C#N)c(Cl)c2)n1	ZINC000348554310	456763612	/nfs/dbraw/zinc/76/36/12/456763612.db2.gz	QYXGXGPSQNOWAK-UHFFFAOYSA-N	0	3	342.830	3.376	20	30		EGEDHN
Cc1ccc(C)c(NC(=O)[C@H](C)N2CCC[C@@H]2[C@@H]2COCC[C@@H]2O)c1	ZINC000328858321	456778674	/nfs/dbraw/zinc/77/86/74/456778674.db2.gz	YHVVRCGWDKKBJN-DKKFBQAASA-N	0	3	346.471	3.142	20	30		EGEDHN
Cc1noc([C@@H]2CCCCN2C(=O)C(C#N)CCc2ccccc2)n1	ZINC000343951865	456783777	/nfs/dbraw/zinc/78/37/77/456783777.db2.gz	IMQUMJDRZSWUFQ-SJORKVTESA-N	0	3	338.411	3.204	20	30		EGEDHN
Cc1noc([C@H]2CCCCN2C(=O)C(C#N)CCc2ccccc2)n1	ZINC000343951861	456784299	/nfs/dbraw/zinc/78/42/99/456784299.db2.gz	IMQUMJDRZSWUFQ-DLBZAZTESA-N	0	3	338.411	3.204	20	30		EGEDHN
C[C@H](C(=O)N(CCC#N)c1ccccc1)N1CCC[C@H](C2CC2)C1	ZINC000344079391	456794587	/nfs/dbraw/zinc/79/45/87/456794587.db2.gz	YDZSERJWKPMNOK-AEFFLSMTSA-N	0	3	325.456	3.444	20	30		EGEDHN
C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)c1ccc2c(c1)NC(=O)C2(C)C	ZINC000328954281	456800381	/nfs/dbraw/zinc/80/03/81/456800381.db2.gz	YJMBCGWBEPPKFN-BDJLRTHQSA-N	0	3	327.428	3.353	20	30		EGEDHN
CC(C)C(=O)Nc1cc(C(=O)N2CCCC23CCN(C)CC3)ccn1	ZINC000329019331	456815941	/nfs/dbraw/zinc/81/59/41/456815941.db2.gz	LGXNZJYUGDWQGS-UHFFFAOYSA-N	0	3	344.459	3.026	20	30		EGEDHN
C=CC[C@@H](CO)CNCc1cc(Cl)ccc1OC[C@@H]1CCCO1	ZINC000341326942	456849347	/nfs/dbraw/zinc/84/93/47/456849347.db2.gz	ZDCNSWCJQULGGF-PBHICJAKSA-N	0	3	339.863	3.172	20	30		EGEDHN
C[C@@H](N[C@H]1CCCN(C(=O)N2CCCC2)C1)c1ccc(C#N)c(F)c1	ZINC000329178306	456849487	/nfs/dbraw/zinc/84/94/87/456849487.db2.gz	NCDHAGMTAWXSGT-PBHICJAKSA-N	0	3	344.434	3.028	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2CCN(C3CCC3)C[C@@H](C)C2)cc1	ZINC000344728846	456852425	/nfs/dbraw/zinc/85/24/25/456852425.db2.gz	XESNFLYRRHNERF-MRXNPFEDSA-N	0	3	328.456	3.198	20	30		EGEDHN
C=CCNC(=O)CN[C@H]1CCCCc2cc(Br)ccc21	ZINC000338777451	456856799	/nfs/dbraw/zinc/85/67/99/456856799.db2.gz	MVHKOKCJBMVYMB-HNNXBMFYSA-N	0	3	337.261	3.108	20	30		EGEDHN
Cc1cc(=O)c(C(=O)NCCN(C)C2CCCCC2)cn1C1CC1	ZINC000329253264	456861850	/nfs/dbraw/zinc/86/18/50/456861850.db2.gz	VZKKQHBIUGXWAS-UHFFFAOYSA-N	0	3	331.460	3.061	20	30		EGEDHN
O=C(CCNC(=O)C1CCCCC1)N1CC[C@@H](N2CCCCC2)C1	ZINC000329270723	456864290	/nfs/dbraw/zinc/86/42/90/456864290.db2.gz	HEZVCHWDKXBJIY-QGZVFWFLSA-N	0	3	335.492	3.000	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)=C([O-])c1cncc(C(F)(F)F)c1	ZINC000344840021	456868650	/nfs/dbraw/zinc/86/86/50/456868650.db2.gz	FXJOLGNGZQDANZ-LBPRGKRZSA-N	0	3	344.296	3.477	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)c1cncc(C(F)(F)F)c1	ZINC000344840021	456868653	/nfs/dbraw/zinc/86/86/53/456868653.db2.gz	FXJOLGNGZQDANZ-LBPRGKRZSA-N	0	3	344.296	3.477	20	30		EGEDHN
C[C@@H](NCc1ccc(OCC#N)cc1)c1ccc(C(=O)N(C)C)cc1	ZINC000292152891	456869637	/nfs/dbraw/zinc/86/96/37/456869637.db2.gz	NCLDCFJZASFNHL-OAHLLOKOSA-N	0	3	337.423	3.142	20	30		EGEDHN
O=C(Nc1csc(-c2ccccn2)n1)NC1CCN(C2CC2)CC1	ZINC000329307387	456869885	/nfs/dbraw/zinc/86/98/85/456869885.db2.gz	ZBWPTHCFJMALPA-UHFFFAOYSA-N	0	3	343.456	3.158	20	30		EGEDHN
C[C@H](NC(=O)COc1cccc2c1OC(C)(C)C2)C1=CCN(C)CC1	ZINC000329339327	456875820	/nfs/dbraw/zinc/87/58/20/456875820.db2.gz	NPHBFVAJMKWEBP-AWEZNQCLSA-N	0	3	344.455	3.386	20	30		EGEDHN
Cc1nnc([C@@H]2CCCN([C@@H](C)C(=O)NCc3ccccc3C)C2)[nH]1	ZINC000329453236	456892724	/nfs/dbraw/zinc/89/27/24/456892724.db2.gz	NQHQKBRMTKWODK-WMLDXEAASA-N	0	3	341.459	3.146	20	30		EGEDHN
C=CCOCCN1CCC(C(=O)N(Cc2ccccc2)C2CC2)CC1	ZINC000339038291	456909803	/nfs/dbraw/zinc/90/98/03/456909803.db2.gz	IEPGLFCDPLGPHN-UHFFFAOYSA-N	0	3	342.483	3.092	20	30		EGEDHN
O=C(N[C@H](CO)CN1CCCCC1)[C@@H]1C[C@]12CCCc1ccccc12	ZINC000329700247	456928562	/nfs/dbraw/zinc/92/85/62/456928562.db2.gz	ZSOUIWZRHLXOML-CUWPLCDZSA-N	0	3	342.483	3.084	20	30		EGEDHN
CN(C)C[C@H](NC(=O)Nc1ccc(F)c(C#N)c1)c1ccc(F)cc1	ZINC000349278619	456929775	/nfs/dbraw/zinc/92/97/75/456929775.db2.gz	CBXYTGOFGBWWEQ-KRWDZBQOSA-N	0	3	344.365	3.261	20	30		EGEDHN
CN(C(=O)C1CCC(NC(=O)C2CCCC2)CC1)[C@@H]1CCCN(C)C1	ZINC000329741191	456934975	/nfs/dbraw/zinc/93/49/75/456934975.db2.gz	VUQGHCZFYHNBEZ-DAWZGUTISA-N	0	3	349.519	3.245	20	30		EGEDHN
CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)NCc1cccc2cc[nH]c21	ZINC000329810231	456944224	/nfs/dbraw/zinc/94/42/24/456944224.db2.gz	QNJBFAQHMPGEQE-SJORKVTESA-N	0	3	326.444	3.141	20	30		EGEDHN
C[C@@H]1CC[C@H](C)N1CC(=O)N[C@H]1CCc2nc(C(C)(C)C)cn2C1	ZINC000329821808	456946076	/nfs/dbraw/zinc/94/60/76/456946076.db2.gz	APYAFAAHSKEULX-ZNMIVQPWSA-N	0	3	332.492	3.325	20	30		EGEDHN
CN1CCC2(CC1)C[C@H](NC(=O)Cc1ccon1)c1ccccc1O2	ZINC000329883501	456955512	/nfs/dbraw/zinc/95/55/12/456955512.db2.gz	RDTHMZNXEKREAX-INIZCTEOSA-N	0	3	341.411	3.162	20	30		EGEDHN
Cc1nc(CC(C)C)oc1C(=O)NCC1(N2CCCC2)CCOCC1	ZINC000330006316	456973011	/nfs/dbraw/zinc/97/30/11/456973011.db2.gz	DZBCKLVHAHOYKH-UHFFFAOYSA-N	0	3	349.475	3.131	20	30		EGEDHN
C[C@H](C1CCN(C)CC1)N(C)C(=O)C1CCC(NC(=O)C2CC2)CC1	ZINC000330011599	456974106	/nfs/dbraw/zinc/97/41/06/456974106.db2.gz	JEJINMNHOROZPS-RWBZWWBESA-N	0	3	349.519	3.100	20	30		EGEDHN
C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)C1CCC(NC(=O)C2CC2)CC1	ZINC000330019555	456975435	/nfs/dbraw/zinc/97/54/35/456975435.db2.gz	VGHAGWTTWPNNAS-CRELMNQXSA-N	0	3	333.476	3.351	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1C(=O)N1CCCN(Cc2ccccc2)C[C@H]1C	ZINC000362607412	457003371	/nfs/dbraw/zinc/00/33/71/457003371.db2.gz	DCNMCALRNWFXLE-RLLQIKCJSA-N	0	3	342.483	3.091	20	30		EGEDHN
C=CCC[C@H](NCC(=O)NCc1ccc(C#N)cc1)c1ccccc1	ZINC000341934203	457011727	/nfs/dbraw/zinc/01/17/27/457011727.db2.gz	WMQKWCAZCBMNEA-FQEVSTJZSA-N	0	3	333.435	3.472	20	30		EGEDHN
Cc1csc(C2(NCC(=O)NC3CCN(C4CC4)CC3)CCC2)n1	ZINC000330272585	457018336	/nfs/dbraw/zinc/01/83/36/457018336.db2.gz	XTIBIPMFCVCBQI-UHFFFAOYSA-N	0	3	348.516	3.004	20	30		EGEDHN
Cc1nc2c(n1[C@H]1CCN(CC(=O)NC3CCCC3)C1)CCCC2	ZINC000330342547	457031908	/nfs/dbraw/zinc/03/19/08/457031908.db2.gz	BAWGSXSSGSALLT-INIZCTEOSA-N	0	3	330.476	3.216	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](C)c2ccc(SC)cc2)CC1	ZINC000358983469	457044659	/nfs/dbraw/zinc/04/46/59/457044659.db2.gz	BWVWRYTXUSCYJR-AWEZNQCLSA-N	0	3	333.501	3.419	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2cccc(C(=O)OC(C)(C)C)c2)CCN1C	ZINC000330596586	457059806	/nfs/dbraw/zinc/05/98/06/457059806.db2.gz	DAODZXKNOPIWJQ-CZUORRHYSA-N	0	3	332.444	3.429	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Cc2coc3cc(F)ccc23)CC1	ZINC000359170722	457061924	/nfs/dbraw/zinc/06/19/24/457061924.db2.gz	FJPDUOAQOQWWED-UHFFFAOYSA-N	0	3	330.403	3.271	20	30		EGEDHN
Cc1ccccc1CN(C[C@H](O)COc1ccc(C#N)cc1)C1CC1	ZINC000339424393	457107584	/nfs/dbraw/zinc/10/75/84/457107584.db2.gz	ZAUNRFCOCRAJRV-FQEVSTJZSA-N	0	3	336.435	3.271	20	30		EGEDHN
CC(=O)Nc1cccc(C(=O)NCCN2CCCC(C)(C)C2)c1C	ZINC000330992530	457116422	/nfs/dbraw/zinc/11/64/22/457116422.db2.gz	SXUDLAWIMNNTHB-UHFFFAOYSA-N	0	3	331.460	3.380	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N(Cc1ccccc1)C1CCN(C)CC1	ZINC000362859621	457127901	/nfs/dbraw/zinc/12/79/01/457127901.db2.gz	NIQWEJDHXJSZRC-KRWDZBQOSA-N	0	3	330.472	3.091	20	30		EGEDHN
C[C@H](CN1C[C@H](C)C[C@@H](C)C1)NC(=O)c1cc(C#N)ccc1Cl	ZINC000350074203	457162130	/nfs/dbraw/zinc/16/21/30/457162130.db2.gz	KXDXCRFDTXBHBK-MGPQQGTHSA-N	0	3	333.863	3.308	20	30		EGEDHN
CC(C#N)C(=O)N[C@H]1CCCN(c2ccc(Cl)cc2Cl)C1	ZINC000356846755	457181710	/nfs/dbraw/zinc/18/17/10/457181710.db2.gz	PNYOEPCGYLOZMU-PWSUYJOCSA-N	0	3	326.227	3.238	20	30		EGEDHN
C[C@@H](N[C@@H]1CC(C)(C)CCc2ccccc21)C(=O)N(C)CCC#N	ZINC000331485270	457192582	/nfs/dbraw/zinc/19/25/82/457192582.db2.gz	WSJDZMQPWKSPHA-CRAIPNDOSA-N	0	3	327.472	3.440	20	30		EGEDHN
C[C@H](N[C@@H]1CC(C)(C)CCc2ccccc21)C(=O)N(C)CCC#N	ZINC000331485281	457192964	/nfs/dbraw/zinc/19/29/64/457192964.db2.gz	WSJDZMQPWKSPHA-MAUKXSAKSA-N	0	3	327.472	3.440	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN(C)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000350808080	457208405	/nfs/dbraw/zinc/20/84/05/457208405.db2.gz	WUUBQAWNPZMEPG-FQEVSTJZSA-N	0	3	343.515	3.007	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N(C)[C@H]2CC[C@@H](C)C2)cc1	ZINC000350948413	457212941	/nfs/dbraw/zinc/21/29/41/457212941.db2.gz	ICYRSDQYZMAOMH-IPYPFGDCSA-N	0	3	349.456	3.025	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CCC2(CCOCC2)CC1	ZINC000356999252	457266505	/nfs/dbraw/zinc/26/65/05/457266505.db2.gz	BJUCCHGIDLEGEZ-GOSISDBHSA-N	0	3	326.440	3.178	20	30		EGEDHN
Cc1ccc(CNC(=O)C2CCN([C@@H]3CC[C@H](C#N)C3)CC2)cc1	ZINC000331936395	457276121	/nfs/dbraw/zinc/27/61/21/457276121.db2.gz	MDJWNZSUKCUNHK-PKOBYXMFSA-N	0	3	325.456	3.016	20	30		EGEDHN
C[C@H](CNC(=O)C[C@H](CC#N)c1ccccc1)N1CCCC[C@H]1C	ZINC000354559792	457288569	/nfs/dbraw/zinc/28/85/69/457288569.db2.gz	BSBRLDYBVZJPNT-LMMKCTJWSA-N	0	3	327.472	3.453	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN(C)[C@H](C)C2CCC2)cc1	ZINC000357040734	457292896	/nfs/dbraw/zinc/29/28/96/457292896.db2.gz	OJDMJOOJBMQVCN-MRXNPFEDSA-N	0	3	343.471	3.452	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H](C)[C@@H]2OCCc3sccc32)CC1	ZINC000339998580	457319947	/nfs/dbraw/zinc/31/99/47/457319947.db2.gz	GROUECWJAINSGG-KDOFPFPSSA-N	0	3	348.512	3.155	20	30		EGEDHN
C=CCOCC(=O)N(CCC)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000354843122	457322990	/nfs/dbraw/zinc/32/29/90/457322990.db2.gz	QJBXQCDZEMBSIJ-IBGZPJMESA-N	0	3	330.472	3.092	20	30		EGEDHN
CC(C#N)C(=O)N[C@@H](c1ccc(OC(F)(F)F)cc1)C(F)(F)F	ZINC000360800017	457359837	/nfs/dbraw/zinc/35/98/37/457359837.db2.gz	VDFZVXLMZNWAFP-XVKPBYJWSA-N	0	3	340.223	3.464	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N(C)CC[C@H]1CCCO1	ZINC000342596301	457389271	/nfs/dbraw/zinc/38/92/71/457389271.db2.gz	QMPDIUDNHAEIFK-JKSUJKDBSA-N	0	3	336.501	3.152	20	30		EGEDHN
N#CCc1ccc(C(=O)N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)cc1	ZINC000425004872	457402857	/nfs/dbraw/zinc/40/28/57/457402857.db2.gz	KDDQCJSWALLFGG-LEWJYISDSA-N	0	3	345.446	3.099	20	30		EGEDHN
N#Cc1ccc(C(F)(F)F)c(NC2CCN([C@H]3CCOC3)CC2)c1	ZINC000363704965	457421021	/nfs/dbraw/zinc/42/10/21/457421021.db2.gz	VWRARFYJDBCPAY-AWEZNQCLSA-N	0	3	339.361	3.242	20	30		EGEDHN
CSCC[C@H](N[C@@H]1CCCCc2cc(C#N)ccc21)C(=O)N(C)C	ZINC000352505184	457423689	/nfs/dbraw/zinc/42/36/89/457423689.db2.gz	YSRJKQSCQHLBPR-MSOLQXFVSA-N	0	3	345.512	3.125	20	30		EGEDHN
CC(C#N)C(=O)N[C@@H](c1cc(F)cc(Br)c1)C1CC1	ZINC000360970378	457476810	/nfs/dbraw/zinc/47/68/10/457476810.db2.gz	KJXFFFSQOVFWOU-ISVAXAHUSA-N	0	3	325.181	3.315	20	30		EGEDHN
C[C@@H]1[C@H](c2ccccc2)CCN1CC(=O)NCc1ccc(C#N)cc1	ZINC000374202096	457521395	/nfs/dbraw/zinc/52/13/95/457521395.db2.gz	ZBWGRXVSJIHRCP-OXQOHEQNSA-N	0	3	333.435	3.052	20	30		EGEDHN
CCCN(CCN1CCCCC1)C(=O)C1(c2cccc(C#N)c2)CC1	ZINC000342779769	457521604	/nfs/dbraw/zinc/52/16/04/457521604.db2.gz	KORKJMVLVNCILF-UHFFFAOYSA-N	0	3	339.483	3.314	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)N[C@@H]1CC[C@H](C#N)C1)c1ccsc1	ZINC000425402537	457537067	/nfs/dbraw/zinc/53/70/67/457537067.db2.gz	INZHENKNHKKYRQ-IMJJTQAJSA-N	0	3	334.489	3.122	20	30		EGEDHN
Cc1cc(C#N)nc(N2C[C@H](C)N(Cc3ccccc3)[C@H](C)[C@@H]2C)n1	ZINC000404312564	457540565	/nfs/dbraw/zinc/54/05/65/457540565.db2.gz	MFKCKBUQNVFDRS-BBWFWOEESA-N	0	3	335.455	3.144	20	30		EGEDHN
C[C@@H](CCCNC(=O)OC(C)(C)C)NCc1ccc(C#N)c(F)c1	ZINC000404681696	457545795	/nfs/dbraw/zinc/54/57/95/457545795.db2.gz	LFRVWSAGZMSEQH-ZDUSSCGKSA-N	0	3	335.423	3.480	20	30		EGEDHN
CCN(CCC#N)C(=O)CN1C[C@H](c2ccccc2)[C@@H]2CCC[C@@H]21	ZINC000352727104	457563146	/nfs/dbraw/zinc/56/31/46/457563146.db2.gz	SVUXJQZZXIEHCI-OTWHNJEPSA-N	0	3	325.456	3.017	20	30		EGEDHN
C=CCCC1(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)CC1	ZINC000356310205	457567817	/nfs/dbraw/zinc/56/78/17/457567817.db2.gz	YNMHPMFSWAVVLB-UHFFFAOYSA-N	0	3	328.456	3.328	20	30		EGEDHN
CN(C)CCN(Cc1ccco1)C(=O)C[C@H](CC#N)c1ccccc1	ZINC000356313282	457569323	/nfs/dbraw/zinc/56/93/23/457569323.db2.gz	IOFWENDAKDKUSK-SFHVURJKSA-N	0	3	339.439	3.257	20	30		EGEDHN
CCc1cnccc1[C@@H](C)NCCC(=O)Nc1sccc1C#N	ZINC000361132165	457602256	/nfs/dbraw/zinc/60/22/56/457602256.db2.gz	NZGVKBMKFZZAHZ-GFCCVEGCSA-N	0	3	328.441	3.257	20	30		EGEDHN
C=CCN(C(=O)NCc1ccc(OCCN2CCCC2)cc1)C1CC1	ZINC000357579470	457604645	/nfs/dbraw/zinc/60/46/45/457604645.db2.gz	HKJFZCDLNDQYFE-UHFFFAOYSA-N	0	3	343.471	3.021	20	30		EGEDHN
C=C(C)CN1CCC(N[C@H](C)c2nnn(-c3ccccc3)c2C)CC1	ZINC000361215023	457648214	/nfs/dbraw/zinc/64/82/14/457648214.db2.gz	HNOGODSNVNZGIQ-MRXNPFEDSA-N	0	3	339.487	3.267	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2cc(N(C)C)nc3ccccc32)nc(C)n1	ZINC000357770845	457683852	/nfs/dbraw/zinc/68/38/52/457683852.db2.gz	RVOPEQJSLJBJJB-MRXNPFEDSA-N	0	3	345.406	3.198	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@@H](OC2CCCC2)c2ccccc2)CC1	ZINC000357815056	457700140	/nfs/dbraw/zinc/70/01/40/457700140.db2.gz	DGTXSUSAGQVKIP-FQEVSTJZSA-N	0	3	342.483	3.454	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCc1ccc(N2CCCC2)nc1	ZINC000433221178	457782321	/nfs/dbraw/zinc/78/23/21/457782321.db2.gz	SHRVCMOJXZGESJ-LJQANCHMSA-N	0	3	348.450	3.071	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCCCOc1ccc(F)cc1	ZINC000433298369	457802094	/nfs/dbraw/zinc/80/20/94/457802094.db2.gz	OHOFEBZSKRVNPI-QGZVFWFLSA-N	0	3	340.398	3.483	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCCc1ccc([N+](=O)[O-])cc1	ZINC000433309731	457805453	/nfs/dbraw/zinc/80/54/53/457805453.db2.gz	COEXXLCBFUZRIA-QGZVFWFLSA-N	0	3	337.379	3.026	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NC[C@@H](CCO)c1ccccc1	ZINC000433384456	457826516	/nfs/dbraw/zinc/82/65/16/457826516.db2.gz	KFDBWHSRPUAUNI-WOJBJXKFSA-N	0	3	336.435	3.041	20	30		EGEDHN
C[C@H](NC(=O)C(C#N)CCc1ccccc1)[C@H]1COc2ccccc21	ZINC000433389412	457827990	/nfs/dbraw/zinc/82/79/90/457827990.db2.gz	XCTMRYQITQDPQO-KVSKMBFKSA-N	0	3	334.419	3.440	20	30		EGEDHN
CN(CC(C)(C)C#N)C(=O)NCC(C)(C)N1CCc2ccccc2C1	ZINC000457793055	457830651	/nfs/dbraw/zinc/83/06/51/457830651.db2.gz	CHKDHYZRTNAULP-UHFFFAOYSA-N	0	3	342.487	3.014	20	30		EGEDHN
Cc1cc(CN[C@@H]2CCN(C(=O)C3CCCCC3)C2)ccc1C#N	ZINC000443985325	457834373	/nfs/dbraw/zinc/83/43/73/457834373.db2.gz	GHTIAUIHKYJOKK-LJQANCHMSA-N	0	3	325.456	3.138	20	30		EGEDHN
Cc1cc(CN[C@@H]2CC(=O)N(c3c(F)cccc3F)C2)ccc1C#N	ZINC000443994272	457836223	/nfs/dbraw/zinc/83/62/23/457836223.db2.gz	DHNYYRYLBDWVRX-OAHLLOKOSA-N	0	3	341.361	3.040	20	30		EGEDHN
Cc1cc(CN[C@H](Cc2ccccc2)C(=O)N2CCCC2)ccc1C#N	ZINC000443995171	457836499	/nfs/dbraw/zinc/83/64/99/457836499.db2.gz	UYIUXYPKUIHIKE-OAQYLSRUSA-N	0	3	347.462	3.190	20	30		EGEDHN
Cc1cc(CNC[C@@H]2CN(Cc3ccccc3)CCCO2)ccc1C#N	ZINC000443997799	457837535	/nfs/dbraw/zinc/83/75/35/457837535.db2.gz	RUVFUAFHGJLMFP-JOCHJYFZSA-N	0	3	349.478	3.247	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H]2CN(Cc3cccc(C#N)c3)CC[C@H]21	ZINC000366536858	457842095	/nfs/dbraw/zinc/84/20/95/457842095.db2.gz	ZNNDISRFMHLJPN-QZTJIDSGSA-N	0	3	341.455	3.390	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NC[C@]1(CO)C[C@@H]1c1ccccc1	ZINC000426743058	457891633	/nfs/dbraw/zinc/89/16/33/457891633.db2.gz	MQFKUILXOKBABP-VWPQPMDRSA-N	0	3	348.446	3.041	20	30		EGEDHN
C[C@H](NC(=O)NCCN1CCCC(C)(C)C1)c1ccc(C#N)cc1	ZINC000444980119	458002129	/nfs/dbraw/zinc/00/21/29/458002129.db2.gz	AOXJWEYKQVGKSM-HNNXBMFYSA-N	0	3	328.460	3.040	20	30		EGEDHN
C=CCN1CC[C@H](N[C@@H](c2ccccc2)C2(CO)CCCCC2)C1=O	ZINC000412004156	458040901	/nfs/dbraw/zinc/04/09/01/458040901.db2.gz	BRFCADTWHGQSSO-OALUTQOASA-N	0	3	342.483	3.047	20	30		EGEDHN
C=CC[C@H](C(=O)N1C[C@@H](SC)[C@@H](N2CCCC2)C1)c1ccccc1	ZINC000427925739	458053078	/nfs/dbraw/zinc/05/30/78/458053078.db2.gz	VANWBBCBFHAIQA-GBESFXJTSA-N	0	3	344.524	3.385	20	30		EGEDHN
CCN1CCC[C@@H]1CNc1c(C#N)cnc2ccc(OC(F)F)cc21	ZINC000358527655	458056126	/nfs/dbraw/zinc/05/61/26/458056126.db2.gz	HRPCABLXSYKGSX-CYBMUJFWSA-N	0	3	346.381	3.026	20	30		EGEDHN
C[C@H]1CCN(Cc2cn(CCC#N)nc2-c2ccncc2)CCS1	ZINC000434988461	458075503	/nfs/dbraw/zinc/07/55/03/458075503.db2.gz	SIUWOVXLBDYSMY-HNNXBMFYSA-N	0	3	341.484	3.186	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)[C@H](C)N[C@@H]1C[C@H](OC(C)(C)C)C1(C)C	ZINC000412067479	458078656	/nfs/dbraw/zinc/07/86/56/458078656.db2.gz	HFUOCLLHQUPYCK-YGTYGHESSA-N	0	3	337.508	3.001	20	30		EGEDHN
C#CCCOc1ccc(CN2CCC(OC[C@@H]3CCOC3)CC2)cc1	ZINC000371801946	458079562	/nfs/dbraw/zinc/07/95/62/458079562.db2.gz	IPRKDZRJQWRNQA-LJQANCHMSA-N	0	3	343.467	3.106	20	30		EGEDHN
C=CCOc1cccc(CN2CCC(OC[C@@H]3CCOC3)CC2)c1	ZINC000371802189	458081216	/nfs/dbraw/zinc/08/12/16/458081216.db2.gz	JVXSOKMGDJCFAC-GOSISDBHSA-N	0	3	331.456	3.269	20	30		EGEDHN
N#Cc1ccc(OCCN2CCC3(CC2)OCc2ccccc23)cc1	ZINC000371938647	458129477	/nfs/dbraw/zinc/12/94/77/458129477.db2.gz	SJXCFRUIHLVAFM-UHFFFAOYSA-N	0	3	334.419	3.459	20	30		EGEDHN
C#CCCCCNC(=O)N1CCCN(Cc2ccccc2C)CC1	ZINC000371954094	458136874	/nfs/dbraw/zinc/13/68/74/458136874.db2.gz	MHVFLIPRUBFLDM-UHFFFAOYSA-N	0	3	327.472	3.016	20	30		EGEDHN
Cc1ccccc1[C@H]([C@@H](C)NC(=O)N(C)CC(C)(C)C#N)N(C)C	ZINC000458765058	458162645	/nfs/dbraw/zinc/16/26/45/458162645.db2.gz	JTAUKWRGZJPBJQ-WBVHZDCISA-N	0	3	330.476	3.177	20	30		EGEDHN
C=CCc1cc(CN[C@@H]2Cc3cccc(O)c3C2)cc(OC)c1O	ZINC000428559664	458170455	/nfs/dbraw/zinc/17/04/55/458170455.db2.gz	AEFAHIJDZPOUKM-MRXNPFEDSA-N	0	3	325.408	3.092	20	30		EGEDHN
C[C@@H]1CCC[C@@H](CCN2CCN(c3nccnc3C#N)C[C@H]2C)C1	ZINC000362464787	458198087	/nfs/dbraw/zinc/19/80/87/458198087.db2.gz	PIGBMJVALOGTOK-ZACQAIPSSA-N	0	3	327.476	3.075	20	30		EGEDHN
C[S@](=O)Cc1ccc(CNC2CC(C#N)(c3ccccc3)C2)cc1	ZINC000376110280	458198381	/nfs/dbraw/zinc/19/83/81/458198381.db2.gz	DBASWOAVBLWOBE-IMQCZEGASA-N	0	3	338.476	3.279	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC(OC3CCCCC3)CC2)CC1	ZINC000358812537	458233513	/nfs/dbraw/zinc/23/35/13/458233513.db2.gz	CSYIHRHIUHPCKS-UHFFFAOYSA-N	0	3	349.519	3.160	20	30		EGEDHN
C=CC(C)(C)CNC(=O)N1C[C@H]2CN(Cc3ccccc3)CC[C@@H]2C1	ZINC000458993739	458238520	/nfs/dbraw/zinc/23/85/20/458238520.db2.gz	XVYTVBRGSIPPQN-RTBURBONSA-N	0	3	341.499	3.362	20	30		EGEDHN
COC(=O)[C@@](C)(CN[C@@H](C)c1ccc(C#N)cc1)c1ccc(F)cc1	ZINC000447030135	458256565	/nfs/dbraw/zinc/25/65/65/458256565.db2.gz	TZAOJIBUISTFSL-XOBRGWDASA-N	0	3	340.398	3.479	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1CN[C@@H](C)c1nnn(-c2ccccc2)c1C	ZINC000436281023	458283061	/nfs/dbraw/zinc/28/30/61/458283061.db2.gz	CWUXBYNRYBPYIY-GMBSWORKSA-N	0	3	326.444	3.208	20	30		EGEDHN
Cc1cc(NC2CCN(CCOC(C)C)CC2)c(C#N)cc1[N+](=O)[O-]	ZINC000413188648	458294843	/nfs/dbraw/zinc/29/48/43/458294843.db2.gz	XKXXIJIMGUBDMS-UHFFFAOYSA-N	0	3	346.431	3.076	20	30		EGEDHN
CC(C)(NCCOc1ccccc1C#N)c1ccccc1[N+](=O)[O-]	ZINC000429253605	458299054	/nfs/dbraw/zinc/29/90/54/458299054.db2.gz	BNIDGYLRCVVARR-UHFFFAOYSA-N	0	3	325.368	3.370	20	30		EGEDHN
N#CC1(c2ccccc2)CC(N[C@H](CO)Cc2c[nH]c3ccccc23)C1	ZINC000372685022	458317379	/nfs/dbraw/zinc/31/73/79/458317379.db2.gz	RPQIWOAJIZMQTJ-PGFLUOATSA-N	0	3	345.446	3.285	20	30		EGEDHN
N#C[C@H](NC(=O)C12CCCN1CCC2)c1cccc(Cl)c1Cl	ZINC000415374425	458331934	/nfs/dbraw/zinc/33/19/34/458331934.db2.gz	IRIGKBXWZUZBIM-ZDUSSCGKSA-N	0	3	338.238	3.303	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Nc1ccc2c(c1)CCN2)C(C)C	ZINC000415844136	458334464	/nfs/dbraw/zinc/33/44/64/458334464.db2.gz	ITRDPPRPTURIND-LJQANCHMSA-N	0	3	342.487	3.475	20	30		EGEDHN
NCc1cc(NC(=O)NCC(F)(F)C(F)F)cc(C(F)(F)F)c1	ZINC000415967174	458335161	/nfs/dbraw/zinc/33/51/61/458335161.db2.gz	HHYGVRXIXWDNOB-UHFFFAOYSA-N	0	3	347.234	3.186	20	30		EGEDHN
CC(C)(CCC#N)CNC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000376610401	458353640	/nfs/dbraw/zinc/35/36/40/458353640.db2.gz	FBPPJBHKIGXXFF-GOSISDBHSA-N	0	3	342.487	3.280	20	30		EGEDHN
C=CCN(C)CCN(CC)[C@H](C)C(=O)Nc1cc(Cl)ccc1C	ZINC000429716188	458361853	/nfs/dbraw/zinc/36/18/53/458361853.db2.gz	KADPRCJEBDOKNU-OAHLLOKOSA-N	0	3	337.895	3.415	20	30		EGEDHN
N#CCC[C@H](NC(=O)N1C[C@@H](c2ccccc2)[C@H](N)C1)c1ccccc1	ZINC000417917092	458368238	/nfs/dbraw/zinc/36/82/38/458368238.db2.gz	NWKRVVMISRUXGX-ZCNNSNEGSA-N	0	3	348.450	3.168	20	30		EGEDHN
CO[C@H](CNCc1cn(C)nc1-c1ccc(C#N)cc1)CC(C)C	ZINC000418104409	458371128	/nfs/dbraw/zinc/37/11/28/458371128.db2.gz	UUYAQRXTDLMBBX-SFHVURJKSA-N	0	3	326.444	3.109	20	30		EGEDHN
CN1CCCC(C)(C)[C@H]1CNC(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000447962238	458371542	/nfs/dbraw/zinc/37/15/42/458371542.db2.gz	KEBSDYOZVMDAKR-ZWKOTPCHSA-N	0	3	342.487	3.451	20	30		EGEDHN
C=CCN(CCOCC1CCC1)[C@@H](C)c1cccc(-n2cnnn2)c1	ZINC000419210990	458379384	/nfs/dbraw/zinc/37/93/84/458379384.db2.gz	WIPGXAPFPQGLRN-INIZCTEOSA-N	0	3	341.459	3.028	20	30		EGEDHN
CN1CCN(c2cccc(Cl)c2CNCC(C)(C)CC#N)CC1	ZINC000419765679	458391902	/nfs/dbraw/zinc/39/19/02/458391902.db2.gz	CNJZEDYUELENMW-UHFFFAOYSA-N	0	3	334.895	3.121	20	30		EGEDHN
CC(=O)N[C@@H]1CCN(CCC(C#N)(c2ccccc2)c2ccccc2)C1	ZINC000420960114	458405453	/nfs/dbraw/zinc/40/54/53/458405453.db2.gz	RCMQYNTVQZAZTE-OAQYLSRUSA-N	0	3	347.462	3.097	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CN[C@H](CC(F)F)c2ccccc2)cc1	ZINC000420990082	458405922	/nfs/dbraw/zinc/40/59/22/458405922.db2.gz	ZSUNRHILUJMUML-FUHWJXTLSA-N	0	3	346.377	3.284	20	30		EGEDHN
COc1cccc(NC(=O)C[C@H](C)NCc2ccc(C#N)s2)c1	ZINC000421349601	458411456	/nfs/dbraw/zinc/41/14/56/458411456.db2.gz	IQYHHBQUODZEQH-LBPRGKRZSA-N	0	3	329.425	3.135	20	30		EGEDHN
CO[C@@H]1CCN(Cc2cn(CCC#N)nc2-c2ccccc2)C[C@H]1C	ZINC000449502502	458425047	/nfs/dbraw/zinc/42/50/47/458425047.db2.gz	ONUPPWSRAMDMKA-VQIMIIECSA-N	0	3	338.455	3.321	20	30		EGEDHN
C=CCC1(C(=O)NCc2ccccc2OCCN(C)C)CCCC1	ZINC000449816281	458432372	/nfs/dbraw/zinc/43/23/72/458432372.db2.gz	VNURNJYMWVISCZ-UHFFFAOYSA-N	0	3	330.472	3.380	20	30		EGEDHN
C=CCC1(C(=O)NCc2ccnc(OCCN(C)C)c2)CCCCC1	ZINC000450300704	458444283	/nfs/dbraw/zinc/44/42/83/458444283.db2.gz	HGBARFVQYVJZNU-UHFFFAOYSA-N	0	3	345.487	3.165	20	30		EGEDHN
CCCN(CC1(C#N)CCC1)C1CCN(c2cc(C)nc(C)n2)CC1	ZINC000450555377	458452279	/nfs/dbraw/zinc/45/22/79/458452279.db2.gz	FVQIDQQASFFUMB-UHFFFAOYSA-N	0	3	341.503	3.468	20	30		EGEDHN
CC(C)(C)c1cnc(C(C#N)C(=O)c2cccc(NC(N)=O)c2)s1	ZINC000430612506	458471792	/nfs/dbraw/zinc/47/17/92/458471792.db2.gz	SHPVZPYFUJDRLT-LBPRGKRZSA-N	0	3	342.424	3.421	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NC[C@@H](c1ccc(CC)cc1)N(C)C	ZINC000437641913	458478186	/nfs/dbraw/zinc/47/81/86/458478186.db2.gz	SIGUHCASQJLRPD-ICSRJNTNSA-N	0	3	332.488	3.197	20	30		EGEDHN
CC[C@H](C)N[C@H](CNC(=O)[C@]1(C#N)CC12CCCC2)c1ccco1	ZINC000451670463	458484216	/nfs/dbraw/zinc/48/42/16/458484216.db2.gz	CTPMOKHWPAUOFU-QMTMVMCOSA-N	0	3	329.444	3.299	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC(=O)N(Cc1ccco1)c1ccccc1	ZINC000451680134	458485452	/nfs/dbraw/zinc/48/54/52/458485452.db2.gz	LGLWUEPVHZFBRI-MOPGFXCFSA-N	0	3	340.423	3.136	20	30		EGEDHN
COC[C@@]1(CO)CCN(Cc2ccc(-c3ccccc3C#N)cc2)C1	ZINC000451938289	458491263	/nfs/dbraw/zinc/49/12/63/458491263.db2.gz	VEYWPTAFQICPOG-NRFANRHFSA-N	0	3	336.435	3.056	20	30		EGEDHN
C=CCC1(C(=O)NC[C@H](N)c2ccc(C(C)C)cc2)CCOCC1	ZINC000424084967	458554106	/nfs/dbraw/zinc/55/41/06/458554106.db2.gz	YSQWMRNIKWZTEK-SFHVURJKSA-N	0	3	330.472	3.299	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N[C@H](Cc1ccccc1)c1ccccc1F	ZINC000424116485	458562069	/nfs/dbraw/zinc/56/20/69/458562069.db2.gz	BUAAUEQZJONLFN-RBUKOAKNSA-N	0	3	339.414	3.247	20	30		EGEDHN
CC(C)(CNC(=O)[C@@H](N)CCCC#N)c1ccc(Cl)c(Cl)c1	ZINC000424115249	458562295	/nfs/dbraw/zinc/56/22/95/458562295.db2.gz	UQGMALKQPVEOGD-AWEZNQCLSA-N	0	3	342.270	3.408	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC[C@@H]2CSc3ccccc32)CC1	ZINC000454460371	458562422	/nfs/dbraw/zinc/56/24/22/458562422.db2.gz	IIVWEWMKOONNNK-OAHLLOKOSA-N	0	3	345.512	3.216	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)NC[C@@H](Cc1ccccc1)c1ccccc1	ZINC000424127041	458565426	/nfs/dbraw/zinc/56/54/26/458565426.db2.gz	PQRJRGMIHIWAQD-WOJBJXKFSA-N	0	3	335.451	3.150	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC[C@]2(C)C[C@H]2c2ccccc2)CC1	ZINC000454541933	458565844	/nfs/dbraw/zinc/56/58/44/458565844.db2.gz	KRLFCUVZQZTLQO-ICSRJNTNSA-N	0	3	327.472	3.130	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NC[C@@H]1CCOc2ccccc21	ZINC000469644877	458582494	/nfs/dbraw/zinc/58/24/94/458582494.db2.gz	PHDDKRJABMZAGO-MSOLQXFVSA-N	0	3	334.419	3.441	20	30		EGEDHN
C[C@H]1C[C@H](N(C)C(=O)C(C)(C)Cc2ccc(C#N)cc2)CCN1C	ZINC000455734133	458610094	/nfs/dbraw/zinc/61/00/94/458610094.db2.gz	GMLHQKVGYSDCSK-MAUKXSAKSA-N	0	3	327.472	3.068	20	30		EGEDHN
N#CCc1cccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000455956056	458623904	/nfs/dbraw/zinc/62/39/04/458623904.db2.gz	XJHSCYTUJQQXHW-LJQANCHMSA-N	0	3	334.423	3.149	20	30		EGEDHN
Cc1cc(C#N)cc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000456000968	458627021	/nfs/dbraw/zinc/62/70/21/458627021.db2.gz	LPTFVXVWFCBQDX-GOSISDBHSA-N	0	3	334.423	3.263	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@]2(C)CCCc3ccccc32)CC1	ZINC000547312068	458718462	/nfs/dbraw/zinc/71/84/62/458718462.db2.gz	FYCQMESFEJLDOU-HXUWFJFHSA-N	0	3	327.472	3.188	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@@H](NC/C=C\c3ccc(F)cc3)C2=O)cc1	ZINC000503915395	458729730	/nfs/dbraw/zinc/72/97/30/458729730.db2.gz	WCZYIOPKQLMVQN-WPGQCCQLSA-N	0	3	349.409	3.496	20	30		EGEDHN
C=CCOc1ccc(C(=O)N(CC)C[C@H]2CCCN2CC)cc1OC	ZINC000547476361	458747553	/nfs/dbraw/zinc/74/75/53/458747553.db2.gz	ROBKDHJVAWBHLG-QGZVFWFLSA-N	0	3	346.471	3.206	20	30		EGEDHN
C[C@@H](CNC(=O)C(C)(C)c1cc(F)cc(C#N)c1)N1CCCC[C@@H]1C	ZINC000506494435	458751323	/nfs/dbraw/zinc/75/13/23/458751323.db2.gz	DJVNELYBIVTSRJ-GJZGRUSLSA-N	0	3	345.462	3.354	20	30		EGEDHN
CC(C#N)C(=O)N1CCC(C)(c2cccc(Br)c2)CC1	ZINC000509295541	458771069	/nfs/dbraw/zinc/77/10/69/458771069.db2.gz	UUYDTDUGMLMBEN-GFCCVEGCSA-N	0	3	335.245	3.489	20	30		EGEDHN
C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(Cc2cc(C#N)cs2)C1	ZINC000495068371	458793437	/nfs/dbraw/zinc/79/34/37/458793437.db2.gz	RMQJFBOSGJNVFE-GXTWGEPZSA-N	0	3	335.473	3.355	20	30		EGEDHN
CC1(C)[C@@H](c2ccccc2)CCN1Cc1cnc2c(C#N)cnn2c1	ZINC000515384146	458808859	/nfs/dbraw/zinc/80/88/59/458808859.db2.gz	ALYVGSVFCOVENR-GOSISDBHSA-N	0	3	331.423	3.369	20	30		EGEDHN
C=C[C@@H]1CCCCN1C(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000495198428	458809619	/nfs/dbraw/zinc/80/96/19/458809619.db2.gz	BQMZSYHFAAKYPE-MOPGFXCFSA-N	0	3	327.472	3.401	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)[C@@H](C)SCCN(C)Cc1ccccc1	ZINC000433018639	458826603	/nfs/dbraw/zinc/82/66/03/458826603.db2.gz	IIZIEZUUEDBMEZ-APWZRJJASA-N	0	3	347.528	3.295	20	30		EGEDHN
COc1cc(CN[C@H]2CCCN(c3ccccc3F)C2)ccc1C#N	ZINC000440617273	458833921	/nfs/dbraw/zinc/83/39/21/458833921.db2.gz	SVIRIIFTBPLHLI-KRWDZBQOSA-N	0	3	339.414	3.465	20	30		EGEDHN
CCCCN(C)CCNC(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1	ZINC000465914398	458862455	/nfs/dbraw/zinc/86/24/55/458862455.db2.gz	AUQFMJOWQRVCJJ-OALUTQOASA-N	0	3	342.487	3.200	20	30		EGEDHN
C=CCn1c(C2CCCC2)nnc1N1CC[C@@H](N2CCCCC2)C1	ZINC000548837738	458874683	/nfs/dbraw/zinc/87/46/83/458874683.db2.gz	BFWCHGLCGZIHEH-QGZVFWFLSA-N	0	3	329.492	3.186	20	30		EGEDHN
CC1(C)CCCN(C(=O)[C@@H]2CCN(Cc3ccccc3)C2)[C@@H]1C#N	ZINC000553578429	458895797	/nfs/dbraw/zinc/89/57/97/458895797.db2.gz	VUGORMKCOILJLF-QZTJIDSGSA-N	0	3	325.456	3.049	20	30		EGEDHN
CC1CC(C#N)(C(=O)N(C)[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)C1	ZINC000531569174	458937649	/nfs/dbraw/zinc/93/76/49/458937649.db2.gz	UOVSDVFVADWABF-DDUYZKFLSA-N	0	3	339.483	3.438	20	30		EGEDHN
C[C@H]1COCCN1C1CCN(Cc2ccccc2C(C)(C)C#N)CC1	ZINC000576898603	458943190	/nfs/dbraw/zinc/94/31/90/458943190.db2.gz	JSPKUGPCUBXNCC-KRWDZBQOSA-N	0	3	341.499	3.173	20	30		EGEDHN
CCN(CCNCc1ccc(O[C@H](C)C#N)cc1)C(=O)OC(C)(C)C	ZINC000495806144	458961051	/nfs/dbraw/zinc/96/10/51/458961051.db2.gz	AAUGMMYJTNSZBO-OAHLLOKOSA-N	0	3	347.459	3.324	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CCS[C@@H](C(C)C)C1	ZINC000441616054	458963870	/nfs/dbraw/zinc/96/38/70/458963870.db2.gz	VCYPWYWAUGBGJE-PKOBYXMFSA-N	0	3	335.513	3.228	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CCS[C@H](C(C)C)C1	ZINC000441616044	458964801	/nfs/dbraw/zinc/96/48/01/458964801.db2.gz	VCYPWYWAUGBGJE-HKUYNNGSSA-N	0	3	335.513	3.228	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)N(C)CC(C)(C)C#N)c1ccccc1	ZINC000457466326	458967165	/nfs/dbraw/zinc/96/71/65/458967165.db2.gz	XMKIVMIJGWCMIU-QGZVFWFLSA-N	0	3	330.476	3.261	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CC(C)(C)[C@H]1[C@H]1CCCO1	ZINC000577307207	459013651	/nfs/dbraw/zinc/01/36/51/459013651.db2.gz	KDHQFZYFVCQOGP-MISYRCLQSA-N	0	3	345.483	3.044	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1CCC[C@@H]1NCC1(C#N)CC1	ZINC000495957355	459018288	/nfs/dbraw/zinc/01/82/88/459018288.db2.gz	NHXGMAIEAVDBLJ-HRCADAONSA-N	0	3	333.476	3.448	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cn2ccc(C)cc2n1)C(C)C	ZINC000495967818	459022499	/nfs/dbraw/zinc/02/24/99/459022499.db2.gz	XPJPFUVYJILXAA-SFHVURJKSA-N	0	3	340.471	3.071	20	30		EGEDHN
Cc1noc(C)c1C(C)(C)NCCC(=O)Nc1sccc1C#N	ZINC000556881362	459027311	/nfs/dbraw/zinc/02/73/11/459027311.db2.gz	OSEHRJCZDNBXPD-UHFFFAOYSA-N	0	3	332.429	3.078	20	30		EGEDHN
CN(C)CCN(CC#Cc1cccc(Cl)c1)Cc1ccccn1	ZINC000577527351	459046673	/nfs/dbraw/zinc/04/66/73/459046673.db2.gz	VFLSRVFVPWSBIM-UHFFFAOYSA-N	0	3	327.859	3.150	20	30		EGEDHN
CC[C@H](C(=O)NCC#Cc1ccc(C(F)(F)F)cc1)N(CC)CC	ZINC000477529502	459048553	/nfs/dbraw/zinc/04/85/53/459048553.db2.gz	VNBJYHQYQDBQIR-MRXNPFEDSA-N	0	3	340.389	3.294	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)[C@H](C(C)C)N2CCCCC2)cc1	ZINC000557364746	459066204	/nfs/dbraw/zinc/06/62/04/459066204.db2.gz	KODULLUCVBBACT-IBGZPJMESA-N	0	3	330.472	3.378	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)[C@@H](C(C)C)N2CCCCC2)cc1	ZINC000557364747	459066556	/nfs/dbraw/zinc/06/65/56/459066556.db2.gz	KODULLUCVBBACT-LJQANCHMSA-N	0	3	330.472	3.378	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N(C)CCOCCNC(=O)OC(C)(C)C	ZINC000496113663	459071665	/nfs/dbraw/zinc/07/16/65/459071665.db2.gz	GHEZFIQVGLCJAH-HNNXBMFYSA-N	0	3	347.459	3.092	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)Nc3ccccc3)C2)cc1F	ZINC000567342827	459089206	/nfs/dbraw/zinc/08/92/06/459089206.db2.gz	GMOCVUMBSDGBTF-KRWDZBQOSA-N	0	3	338.386	3.093	20	30		EGEDHN
Cc1cc(C#N)cnc1C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000590294906	459109588	/nfs/dbraw/zinc/10/95/88/459109588.db2.gz	TVXZVLOWRINPED-QFBILLFUSA-N	0	3	348.450	3.045	20	30		EGEDHN
CCN(CC)C(=O)[C@@H](NCCc1ccc(C#N)cc1)c1ccccc1	ZINC000594708554	459136262	/nfs/dbraw/zinc/13/62/62/459136262.db2.gz	AXHZWIFWYHVNNV-FQEVSTJZSA-N	0	3	335.451	3.300	20	30		EGEDHN
COc1ccc(N2C[C@H](N[C@H](C)c3ccc(C#N)cc3)CC2=O)cc1	ZINC000594722569	459139685	/nfs/dbraw/zinc/13/96/85/459139685.db2.gz	RVVGBTYHMZVIEV-RHSMWYFYSA-N	0	3	335.407	3.023	20	30		EGEDHN
C=CC[C@H](C)NCc1cc(I)cc([N+](=O)[O-])c1	ZINC000558485546	459165906	/nfs/dbraw/zinc/16/59/06/459165906.db2.gz	DNZGCFATKOOAES-VIFPVBQESA-N	0	3	346.168	3.254	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@]2(CCN([C@H]3CC[C@H](C#N)C3)C2)C1	ZINC000496375909	459169625	/nfs/dbraw/zinc/16/96/25/459169625.db2.gz	AWHRLDCFCCNTJX-TXPKVOOTSA-N	0	3	333.476	3.402	20	30		EGEDHN
Cc1cccc(CN(CC(=O)N[C@](C)(C#N)C2CC2)CC(C)C)c1	ZINC000521821361	459179967	/nfs/dbraw/zinc/17/99/67/459179967.db2.gz	GLEWCUBDCAEHEL-HXUWFJFHSA-N	0	3	327.472	3.262	20	30		EGEDHN
C[C@H](NC(=O)OC(C)(C)C)[C@H](C)N[C@@H]1CCc2ccc(C#N)cc21	ZINC000496559853	459238505	/nfs/dbraw/zinc/23/85/05/459238505.db2.gz	TYQBHBUZKMHIKD-GDZNZVCISA-N	0	3	329.444	3.437	20	30		EGEDHN
CC(C)C[C@]1(CO)CCCN1C(=O)C(C#N)CCc1ccccc1	ZINC000559297419	459250819	/nfs/dbraw/zinc/25/08/19/459250819.db2.gz	GYRNESOLIVQEHM-QUCCMNQESA-N	0	3	328.456	3.159	20	30		EGEDHN
C=C(C)Cn1c(C2CC2)nnc1N1CCN(CC2CCCCC2)CC1	ZINC000581024192	459267811	/nfs/dbraw/zinc/26/78/11/459267811.db2.gz	IESPIASQVQZFRK-UHFFFAOYSA-N	0	3	343.519	3.434	20	30		EGEDHN
N#Cc1ccc(CCN2CCCN(Cc3ccc(C#N)cc3)CC2)cc1	ZINC000595288441	459268154	/nfs/dbraw/zinc/26/81/54/459268154.db2.gz	ISRFKCUXPFXHLZ-UHFFFAOYSA-N	0	3	344.462	3.180	20	30		EGEDHN
N#Cc1ccc(N2CCN(CC[C@@H]3CCc4ccccc43)CC2)nc1	ZINC000595296065	459271298	/nfs/dbraw/zinc/27/12/98/459271298.db2.gz	WZKFOOJXRIXNGS-IBGZPJMESA-N	0	3	332.451	3.195	20	30		EGEDHN
Cc1cc(C#N)ccc1CNC1(CC(=O)OC(C)(C)C)CCOCC1	ZINC000595541227	459339349	/nfs/dbraw/zinc/33/93/49/459339349.db2.gz	UNNQBEXJLQUZAC-UHFFFAOYSA-N	0	3	344.455	3.237	20	30		EGEDHN
CCCOc1ccc(C(C)(C)NCC(=O)N[C@@](C)(C#N)C2CC2)cc1	ZINC000483287246	459356486	/nfs/dbraw/zinc/35/64/86/459356486.db2.gz	ROJUZXJDBGKQRP-FQEVSTJZSA-N	0	3	343.471	3.109	20	30		EGEDHN
C[C@]1(C#N)CCCN(C(=O)N[C@@H](CN)c2ccc3ccccc3c2)C1	ZINC000591360000	459361566	/nfs/dbraw/zinc/36/15/66/459361566.db2.gz	BUTANVHFSXEQJN-AZUAARDMSA-N	0	3	336.439	3.175	20	30		EGEDHN
C=CC1CCN(C(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)CC1	ZINC000524640387	459378024	/nfs/dbraw/zinc/37/80/24/459378024.db2.gz	OLQRMVOVUMCRFS-APWZRJJASA-N	0	3	327.472	3.430	20	30		EGEDHN
COC[C@@H](NCCCOc1cccc(C#N)c1)c1cccc(OC)c1	ZINC000595682593	459394630	/nfs/dbraw/zinc/39/46/30/459394630.db2.gz	BXJXGLOJESQNAL-HXUWFJFHSA-N	0	3	340.423	3.313	20	30		EGEDHN
C[C@H](c1ccc(F)cc1)N1CCC[C@H](N[C@H]2CC[C@@H](C#N)C2)C1=O	ZINC000569108705	459397559	/nfs/dbraw/zinc/39/75/59/459397559.db2.gz	QBKPFOXDXUAJLX-KNCCTNLNSA-N	0	3	329.419	3.160	20	30		EGEDHN
FC(F)(F)Oc1ccc(C#CCN2CC[C@@H]3OCC[C@@H]3C2)cc1	ZINC000582664432	459405734	/nfs/dbraw/zinc/40/57/34/459405734.db2.gz	AVVFLPIHBRKMPI-ZBFHGGJFSA-N	0	3	325.330	3.048	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2NC(=O)[C@H]1CCCN1C1CCCC1	ZINC000561089206	459418674	/nfs/dbraw/zinc/41/86/74/459418674.db2.gz	AACBVRGTXSHSKK-VQTJNVASSA-N	0	3	337.467	3.459	20	30		EGEDHN
C/C=C\c1ccc(OC[C@H](O)CN2CCC(CC#N)CC2)c(OC)c1	ZINC000541022921	459418632	/nfs/dbraw/zinc/41/86/32/459418632.db2.gz	OMUKJQSCSPUXJH-DDKKJVIOSA-N	0	3	344.455	3.094	20	30		EGEDHN
COc1ccc(CN(C)C)cc1NC(=O)N1CCC(CCC#N)CC1	ZINC000582783476	459426797	/nfs/dbraw/zinc/42/67/97/459426797.db2.gz	LZVXBTIXOAAISA-UHFFFAOYSA-N	0	3	344.459	3.304	20	30		EGEDHN
Cc1cc(C#N)cnc1C(=O)NCC(C)(C)N[C@H](C)c1ccccc1	ZINC000582919139	459452541	/nfs/dbraw/zinc/45/25/41/459452541.db2.gz	RWNISXKOSRNLHD-OAHLLOKOSA-N	0	3	336.439	3.121	20	30		EGEDHN
C=C[C@@H]1CCCCN1C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000485592679	459461455	/nfs/dbraw/zinc/46/14/55/459461455.db2.gz	PZHIWMSTPCTUPM-LJQANCHMSA-N	0	3	327.472	3.401	20	30		EGEDHN
N#CC[C@@H]1CCCN(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)C1	ZINC000596089396	459516211	/nfs/dbraw/zinc/51/62/11/459516211.db2.gz	ZOYLKAJQAUBFIM-HKUYNNGSSA-N	0	3	340.471	3.159	20	30		EGEDHN
N#CC[C@]1(O)CCN(CCC(=O)Nc2ccccc2-c2ccccc2)C1	ZINC000592149546	459537289	/nfs/dbraw/zinc/53/72/89/459537289.db2.gz	QUCWGMRCVBKWJH-NRFANRHFSA-N	0	3	349.434	3.033	20	30		EGEDHN
N#CC[C@@]1(O)CCN(CC/C=C/c2ccc(Br)cc2)C1	ZINC000592151177	459537521	/nfs/dbraw/zinc/53/75/21/459537521.db2.gz	NSVCYXGVDBBDGA-BCMPFUBYSA-N	0	3	335.245	3.203	20	30		EGEDHN
CC(C)[C@@H]1C[C@H](N[C@H]2CCCN(c3ccc(C#N)cc3)C2=O)CS1	ZINC000488551058	459545223	/nfs/dbraw/zinc/54/52/23/459545223.db2.gz	ZTUORGNZLPCHCN-SZMVWBNQSA-N	0	3	343.496	3.173	20	30		EGEDHN
C=CCn1cccc1C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000488499325	459545546	/nfs/dbraw/zinc/54/55/46/459545546.db2.gz	NSQJIDYFHRBGLV-UHFFFAOYSA-N	0	3	337.467	3.111	20	30		EGEDHN
C=CCc1ccc(OC[C@H](O)CN2CCCC[C@H]2C=C)c(OC)c1	ZINC000489486437	459565071	/nfs/dbraw/zinc/56/50/71/459565071.db2.gz	YPDRDENQAYSAMO-QZTJIDSGSA-N	0	3	331.456	3.204	20	30		EGEDHN
N#Cc1nc(NC[C@@H]2CCN(Cc3ccccc3)C2)sc1Cl	ZINC000596223187	459565386	/nfs/dbraw/zinc/56/53/86/459565386.db2.gz	NUENRARBHUBEJU-ZDUSSCGKSA-N	0	3	332.860	3.024	20	30		EGEDHN
C=C[C@](C)(CCOC)c1nc(-c2ccc(OCCN(C)C)cc2)no1	ZINC000571362776	459567709	/nfs/dbraw/zinc/56/77/09/459567709.db2.gz	UKXHUIIYSCGGJP-LJQANCHMSA-N	0	3	345.443	3.157	20	30		EGEDHN
CCc1nc(C#N)cc(N2CC[C@]3(CCN(Cc4ccccc4)C3)C2)n1	ZINC000596232824	459569425	/nfs/dbraw/zinc/56/94/25/459569425.db2.gz	SVULIKFVHGAANY-NRFANRHFSA-N	0	3	347.466	3.013	20	30		EGEDHN
CC(C)[C@H](NC(=O)C(C#N)CCc1ccccc1)C1(CO)CCC1	ZINC000571579281	459570632	/nfs/dbraw/zinc/57/06/32/459570632.db2.gz	DEYPJCHWZNDSML-ROUUACIJSA-N	0	3	328.456	3.062	20	30		EGEDHN
C[C@@H](NCC#Cc1ccc(OC(F)(F)F)cc1)[C@H]1CCCOC1	ZINC000542578725	459572567	/nfs/dbraw/zinc/57/25/67/459572567.db2.gz	VSBUKPDXXYCJTM-HIFRSBDPSA-N	0	3	327.346	3.341	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N[C@H](c1cccs1)c1ccc(F)cc1	ZINC000583687814	459580675	/nfs/dbraw/zinc/58/06/75/459580675.db2.gz	YTULPMLUGPMMNP-ZBFHGGJFSA-N	0	3	331.416	3.114	20	30		EGEDHN
CC[C@@H](N[C@@H]1CCc2ccc(C#N)cc21)C(=O)NCc1cccs1	ZINC000592396205	459591499	/nfs/dbraw/zinc/59/14/99/459591499.db2.gz	OYRRUPCGFYTTPT-QZTJIDSGSA-N	0	3	339.464	3.292	20	30		EGEDHN
C#C[C@H](NC(=O)NC1CCN(CC=C)CC1)c1ccc(Cl)cc1F	ZINC000491179801	459602666	/nfs/dbraw/zinc/60/26/66/459602666.db2.gz	HTKAFINOPVAPNH-KRWDZBQOSA-N	0	3	349.837	3.103	20	30		EGEDHN
C#CCNC(=O)C1CCN(Cc2ccc(OCCC(C)C)cc2)CC1	ZINC000491202944	459604659	/nfs/dbraw/zinc/60/46/59/459604659.db2.gz	RIGOMFRLHYZYSQ-UHFFFAOYSA-N	0	3	342.483	3.073	20	30		EGEDHN
C#CCN1CCC(C(=O)NC2CC(F)(c3cccc(Cl)c3)C2)CC1	ZINC000491267928	459611751	/nfs/dbraw/zinc/61/17/51/459611751.db2.gz	WNJKWGNPVZQIKF-UHFFFAOYSA-N	0	3	348.849	3.129	20	30		EGEDHN
C=CCN(CCc1ccco1)C[C@@H](O)COc1cc(C)cc(C)c1	ZINC000491344276	459617782	/nfs/dbraw/zinc/61/77/82/459617782.db2.gz	YLCMPKFQEVGWMN-GOSISDBHSA-N	0	3	329.440	3.367	20	30		EGEDHN
C=CCCCCN1CCN(Cc2cc(OC)c(OC)c(OC)c2)CC1	ZINC000573294417	459654725	/nfs/dbraw/zinc/65/47/25/459654725.db2.gz	UJAOJPINEFLIJS-UHFFFAOYSA-N	0	3	348.487	3.186	20	30		EGEDHN
CN(C)C/C=C/C(=O)N[C@@H](C#N)c1ccc(OCc2ccccc2)cc1	ZINC000491875083	459683477	/nfs/dbraw/zinc/68/34/77/459683477.db2.gz	YAGVTJDCOIYCAY-ZGBFETHSSA-N	0	3	349.434	3.064	20	30		EGEDHN
CCN1C[C@H](C)N(Cc2cc(C#N)ccc2Br)C[C@H]1C	ZINC000492585128	459711702	/nfs/dbraw/zinc/71/17/02/459711702.db2.gz	WPXPNLZNLATEGM-OLZOCXBDSA-N	0	3	336.277	3.235	20	30		EGEDHN
COc1cccc([C@H](CNCc2ccc(C#N)c(OC)c2)OC)c1	ZINC000527739759	459721335	/nfs/dbraw/zinc/72/13/35/459721335.db2.gz	SYGUMXACNNFLKW-IBGZPJMESA-N	0	3	326.396	3.053	20	30		EGEDHN
C=CCN1CC[C@@H](NCC2(c3c(F)cccc3F)CCCC2)C1=O	ZINC000493600425	459755123	/nfs/dbraw/zinc/75/51/23/459755123.db2.gz	CILQPQIRTNIRQX-MRXNPFEDSA-N	0	3	334.410	3.153	20	30		EGEDHN
C=CCn1c(-c2ccccc2F)nnc1N1C[C@H](C)N(CC)C[C@@H]1C	ZINC000564384506	459773802	/nfs/dbraw/zinc/77/38/02/459773802.db2.gz	OTXOWZDIRIUEPW-GJZGRUSLSA-N	0	3	343.450	3.189	20	30		EGEDHN
CN(CCOCc1ccc(C#N)cc1)CCc1ccc2c(c1)CCO2	ZINC000584726411	459792303	/nfs/dbraw/zinc/79/23/03/459792303.db2.gz	ZXVKHONDHOFZCM-UHFFFAOYSA-N	0	3	336.435	3.184	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Cc2coc3ccc(C)cc23)CC1	ZINC000528446510	459807348	/nfs/dbraw/zinc/80/73/48/459807348.db2.gz	AOYXPFOTGRNSIK-UHFFFAOYSA-N	0	3	326.440	3.440	20	30		EGEDHN
N#CC1(C[C@H](O)CN2CCC[C@@H]2c2nc3ccc(Cl)cc3[nH]2)CC1	ZINC000528500499	459809225	/nfs/dbraw/zinc/80/92/25/459809225.db2.gz	BSAFCUKURJPTJQ-XJKSGUPXSA-N	0	3	344.846	3.408	20	30		EGEDHN
Cc1cc(C)cc(N(CCC#N)C(=O)CN[C@H]2CCC[C@@H]3C[C@@H]32)c1	ZINC000584825044	459809579	/nfs/dbraw/zinc/80/95/79/459809579.db2.gz	LHLWPJBACSFODZ-NEWSRXKRSA-N	0	3	325.456	3.328	20	30		EGEDHN
Cc1ccccc1[C@@H]1C[C@H]1NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000593248616	459819112	/nfs/dbraw/zinc/81/91/12/459819112.db2.gz	LTHSZUFPHKCQQL-YSIASYRMSA-N	0	3	329.403	3.221	20	30		EGEDHN
CCC(C#N)(CC)C(=O)N1CC[C@@]2(CCN(Cc3ccccc3)C2)C1	ZINC000529370082	459827874	/nfs/dbraw/zinc/82/78/74/459827874.db2.gz	WLKSJAZEBIEHMV-HXUWFJFHSA-N	0	3	339.483	3.441	20	30		EGEDHN
CN(C)CCOc1cccc(CNC(=O)CC2(C#N)CCCCC2)c1	ZINC000597117204	459842538	/nfs/dbraw/zinc/84/25/38/459842538.db2.gz	JRIRCBWOSREELB-UHFFFAOYSA-N	0	3	343.471	3.107	20	30		EGEDHN
CC(C)(C)CN(CCC#N)C(=O)[C@@H]1CCCN(Cc2cccnc2)C1	ZINC000609192020	459922160	/nfs/dbraw/zinc/92/21/60/459922160.db2.gz	YQRYOTSACFSROU-GOSISDBHSA-N	0	3	342.487	3.082	20	30		EGEDHN
C[C@H](N[C@@H]1CCc2cc(C#N)ccc21)c1cccc(-n2ccnn2)c1	ZINC000588230263	459934891	/nfs/dbraw/zinc/93/48/91/459934891.db2.gz	QFBIZUKFKNSYQY-VBKZILBWSA-N	0	3	329.407	3.477	20	30		EGEDHN
COc1ccc(Cl)cc1CN1CCN(C[C@@H](C)CCC#N)CC1	ZINC000602440959	459938398	/nfs/dbraw/zinc/93/83/98/459938398.db2.gz	KRLBIRUFFKYFOE-HNNXBMFYSA-N	0	3	335.879	3.406	20	30		EGEDHN
N#Cc1ccccc1NC(=O)CCN1CCCc2sccc2C1	ZINC000609323136	459944886	/nfs/dbraw/zinc/94/48/86/459944886.db2.gz	VBUGURMDUGNOOV-UHFFFAOYSA-N	0	3	325.437	3.397	20	30		EGEDHN
C[C@@H](NC1CCN(Cc2cccc(C#N)c2)CC1)c1ccc(F)cn1	ZINC000593719387	459962565	/nfs/dbraw/zinc/96/25/65/459962565.db2.gz	CQDQSECCPFWTGS-OAHLLOKOSA-N	0	3	338.430	3.408	20	30		EGEDHN
CCCN(CCN1CCCC1)C(=O)N[C@@H]1CCc2cc(C#N)ccc21	ZINC000588666957	459962895	/nfs/dbraw/zinc/96/28/95/459962895.db2.gz	YVPRPJARIKKLIT-LJQANCHMSA-N	0	3	340.471	3.063	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CNC1(c2ccc(OC(F)(F)F)cc2)CC1	ZINC000598617801	459965483	/nfs/dbraw/zinc/96/54/83/459965483.db2.gz	LNADWSOSNXDBGV-CYBMUJFWSA-N	0	3	342.361	3.465	20	30		EGEDHN
COC(=O)c1csc(CNCCSCc2ccccc2C#N)c1	ZINC000602515443	459978274	/nfs/dbraw/zinc/97/82/74/459978274.db2.gz	YMWBCFBXCHSINS-UHFFFAOYSA-N	0	3	346.477	3.429	20	30		EGEDHN
CSc1ccc(NC(=O)[C@@H](N)CCCC#N)cc1Br	ZINC000602528399	459985263	/nfs/dbraw/zinc/98/52/63/459985263.db2.gz	ARJVZLDFXGADNA-NSHDSACASA-N	0	3	342.262	3.131	20	30		EGEDHN
COc1ccc2c(c1)OCC[C@@H]2N[C@H](C)CC1(C#N)CCOCC1	ZINC000602557935	459996221	/nfs/dbraw/zinc/99/62/21/459996221.db2.gz	MOBBQHJBZRWDNL-PBHICJAKSA-N	0	3	330.428	3.207	20	30		EGEDHN
COc1ccc(CNC[C@H](O)CC(C)(C)C#N)cc1OC1CCCC1	ZINC000598719460	460004975	/nfs/dbraw/zinc/00/49/75/460004975.db2.gz	INMAOMCBLXMALZ-MRXNPFEDSA-N	0	3	346.471	3.407	20	30		EGEDHN
C=CCCOCCNCc1ccc(I)s1	ZINC000602580355	460007727	/nfs/dbraw/zinc/00/77/27/460007727.db2.gz	MGRFBJCPNFAPPC-UHFFFAOYSA-N	0	3	337.226	3.035	20	30		EGEDHN
N#C[C@H](NC(=O)[C@@H]1CCN(Cc2ccccc2)C1)C1CCCCC1	ZINC000575812603	460008944	/nfs/dbraw/zinc/00/89/44/460008944.db2.gz	NGDGKHYIKLOBEM-MOPGFXCFSA-N	0	3	325.456	3.097	20	30		EGEDHN
C[C@@H](CC1(C#N)CCOCC1)NCc1ccnc(N2CCCCC2)c1	ZINC000602585351	460010215	/nfs/dbraw/zinc/01/02/15/460010215.db2.gz	FXLFAKYHACSKIO-KRWDZBQOSA-N	0	3	342.487	3.260	20	30		EGEDHN
C[C@@H](c1ccc(C#N)cc1)N1CCC(C(N)=O)(c2ccccc2)CC1	ZINC000609823575	460024851	/nfs/dbraw/zinc/02/48/51/460024851.db2.gz	QUOIHMZVHKYKAI-INIZCTEOSA-N	0	3	333.435	3.138	20	30		EGEDHN
CN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(C(C)(C)C#N)cc1)C2	ZINC000597710318	460035163	/nfs/dbraw/zinc/03/51/63/460035163.db2.gz	KDJNKMPGMCGZGF-HXUWFJFHSA-N	0	3	325.456	3.046	20	30		EGEDHN
CN(C)CCN(Cc1nc2ccccc2o1)Cc1ccc(C#N)cc1	ZINC000602659212	460048851	/nfs/dbraw/zinc/04/88/51/460048851.db2.gz	JYWKRYCDXFMLAY-UHFFFAOYSA-N	0	3	334.423	3.263	20	30		EGEDHN
CCCN(CC(=O)Nc1ccc(C#N)cc1)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C	ZINC000610133512	460068313	/nfs/dbraw/zinc/06/83/13/460068313.db2.gz	XZDLXNKJISYGKI-QXAKKESOSA-N	0	3	341.455	3.022	20	30		EGEDHN
C[C@H](NC(=O)N1CCCN(C(C)(C)C)CC1)c1cccc(C#N)c1	ZINC000610406890	460144981	/nfs/dbraw/zinc/14/49/81/460144981.db2.gz	IOIUYZDJORUIGC-HNNXBMFYSA-N	0	3	328.460	3.135	20	30		EGEDHN
N#CCCCCCC(=O)Nc1ccc(CN2CCC(O)CC2)cc1	ZINC000589843978	460149919	/nfs/dbraw/zinc/14/99/19/460149919.db2.gz	DHCMHGFSILVIMM-UHFFFAOYSA-N	0	3	329.444	3.056	20	30		EGEDHN
N#CC[C@@H]1CCCN(C[C@H](O)COc2cc(Cl)cc(Cl)c2)C1	ZINC000602883775	460171601	/nfs/dbraw/zinc/17/16/01/460171601.db2.gz	MGLJBQQFUQECHB-WFASDCNBSA-N	0	3	343.254	3.359	20	30		EGEDHN
C[C@@H](CC(=O)N1CCCCCC1)N[C@H]1CCc2cc(C#N)ccc21	ZINC000618804633	460182777	/nfs/dbraw/zinc/18/27/77/460182777.db2.gz	LKWVLFAICOHWCY-KXBFYZLASA-N	0	3	325.456	3.316	20	30		EGEDHN
Cc1ccccc1CN(C[C@H](O)COc1ccccc1C#N)C1CC1	ZINC000599272989	460213302	/nfs/dbraw/zinc/21/33/02/460213302.db2.gz	UUAKXQORLJUIQT-FQEVSTJZSA-N	0	3	336.435	3.271	20	30		EGEDHN
N#CC1(CCCN2CCN(c3cccc(F)c3)CC2)CCOCC1	ZINC000603016286	460221007	/nfs/dbraw/zinc/22/10/07/460221007.db2.gz	RBLYBSAKZBJOEL-UHFFFAOYSA-N	0	3	331.435	3.048	20	30		EGEDHN
CC(C)(NC[C@@H](O)COc1ccccc1C#N)c1ccc(Cl)cc1	ZINC000599323755	460228434	/nfs/dbraw/zinc/22/84/34/460228434.db2.gz	KXUGZHYSZKAMTM-QGZVFWFLSA-N	0	3	344.842	3.476	20	30		EGEDHN
Cc1nccc([C@H]2CCCN(CCCOc3cccc(C#N)c3)C2)n1	ZINC000610786225	460236562	/nfs/dbraw/zinc/23/65/62/460236562.db2.gz	NMPSWFXVHWBPFS-SFHVURJKSA-N	0	3	336.439	3.305	20	30		EGEDHN
CC[C@@H](NC[C@@H](O)COc1ccccc1C#N)c1ccc(F)cc1F	ZINC000599355915	460236874	/nfs/dbraw/zinc/23/68/74/460236874.db2.gz	KDJDKNVUQPUOMB-CRAIPNDOSA-N	0	3	346.377	3.317	20	30		EGEDHN
N#Cc1ccc(C(=O)N2CC[C@]3(C2)CCCN(Cc2ccccc2)C3)[nH]1	ZINC000611035720	460281041	/nfs/dbraw/zinc/28/10/41/460281041.db2.gz	NUOBVGAPOOFJOL-OAQYLSRUSA-N	0	3	348.450	3.015	20	30		EGEDHN
C=CCC1(NCC(=O)Nc2nnc(-c3ccco3)o2)CCCCC1	ZINC000625935222	460309291	/nfs/dbraw/zinc/30/92/91/460309291.db2.gz	RONQSIXDKALTAM-UHFFFAOYSA-N	0	3	330.388	3.137	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2N[C@H]1CCN(C(=O)C2CCCC2)C1	ZINC000611393769	460353283	/nfs/dbraw/zinc/35/32/83/460353283.db2.gz	WXMDCYVBRXLQNV-ICSRJNTNSA-N	0	3	337.467	3.316	20	30		EGEDHN
COC(=O)[C@@H](C)Oc1ccc(CN[C@@H](C)c2cccc(C#N)c2)cc1	ZINC000611442128	460366467	/nfs/dbraw/zinc/36/64/67/460366467.db2.gz	XHJVEUXYRUNPBY-LSDHHAIUSA-N	0	3	338.407	3.349	20	30		EGEDHN
COC(=O)[C@H](C)Oc1ccc(CN[C@H](C)c2cccc(C#N)c2)cc1	ZINC000611442125	460366819	/nfs/dbraw/zinc/36/68/19/460366819.db2.gz	XHJVEUXYRUNPBY-CABCVRRESA-N	0	3	338.407	3.349	20	30		EGEDHN
COc1cc(CN2CC[C@@H](N(C)Cc3ccccc3)C2)ccc1C#N	ZINC000619674487	460408805	/nfs/dbraw/zinc/40/88/05/460408805.db2.gz	OANVDKRHKVVFSD-HXUWFJFHSA-N	0	3	335.451	3.273	20	30		EGEDHN
Cn1cc(CNCc2ccc(C#N)c(Cl)c2)c(-c2cccnc2)n1	ZINC000619748933	460430567	/nfs/dbraw/zinc/43/05/67/460430567.db2.gz	ZABBDHASZFGZOE-UHFFFAOYSA-N	0	3	337.814	3.297	20	30		EGEDHN
C[C@H](CNC(=O)NCc1ccc(C#N)c(Cl)c1)N1CCCC[C@H]1C	ZINC000619756017	460431830	/nfs/dbraw/zinc/43/18/30/460431830.db2.gz	PTCJCODPTWIXDB-ZIAGYGMSSA-N	0	3	348.878	3.274	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)N1CCC[C@@](C)(C#N)C1)c1ccccc1	ZINC000612094735	460537078	/nfs/dbraw/zinc/53/70/78/460537078.db2.gz	WGCMCPYNBOJJFK-ICSRJNTNSA-N	0	3	342.487	3.405	20	30		EGEDHN
N#CCC[C@H](NC[C@]1(O)CCN(Cc2ccccc2)C1)c1ccccc1	ZINC000601964624	460964412	/nfs/dbraw/zinc/96/44/12/460964412.db2.gz	JMZZYTMMHCEQML-FCHUYYIVSA-N	0	3	349.478	3.258	20	30		EGEDHN
C=CC[C@@H]1CCCN(C(=O)CCN2CCN(c3ccccc3)CC2)C1	ZINC000617782964	460975813	/nfs/dbraw/zinc/97/58/13/460975813.db2.gz	PZFJLVLALBJGAW-LJQANCHMSA-N	0	3	341.499	3.013	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@@H]2CCCN3CCCC[C@@H]23)cc1OC	ZINC000655350091	461200035	/nfs/dbraw/zinc/20/00/35/461200035.db2.gz	WPJMSBRCVUCSQD-SJORKVTESA-N	0	3	344.455	3.007	20	30		EGEDHN
Cc1ccc(NC(=O)[C@H](N)CCCC#N)cc1C(=O)c1ccccc1	ZINC000639002176	461674834	/nfs/dbraw/zinc/67/48/34/461674834.db2.gz	YTEYPDQAZDEMRW-GOSISDBHSA-N	0	3	335.407	3.186	20	30		EGEDHN
C=CCN(C(=O)N[C@@H](CN1CCCC1)c1ccccc1)[C@@H](C)COC	ZINC000663644518	461732286	/nfs/dbraw/zinc/73/22/86/461732286.db2.gz	XMQRYQHKGROPID-HKUYNNGSSA-N	0	3	345.487	3.056	20	30		EGEDHN
N#Cc1ccc(CCN2CC[C@@]3(C2)CC(=O)c2ccccc2O3)cc1	ZINC000660804086	461978366	/nfs/dbraw/zinc/97/83/66/461978366.db2.gz	RCQAETNAZIYLJB-NRFANRHFSA-N	0	3	332.403	3.211	20	30		EGEDHN
C=CCCn1cc(CNC[C@H]2CCCO[C@H]2c2ccc(C)cc2)nn1	ZINC000657385818	462087633	/nfs/dbraw/zinc/08/76/33/462087633.db2.gz	WQVSCJAYNKWSAB-QUCCMNQESA-N	0	3	340.471	3.420	20	30		EGEDHN
C=CC[C@H]1CCCN([C@@H](C)C(=O)Nc2cccc(NC(C)=O)c2)C1	ZINC000661381746	462225833	/nfs/dbraw/zinc/22/58/33/462225833.db2.gz	PBYGEESAKOMZOQ-HOCLYGCPSA-N	0	3	329.444	3.260	20	30		EGEDHN
C=CCN(CC1CCCCC1)C(=O)Nc1cnc2c(c1)CNCC2	ZINC000667795945	462266447	/nfs/dbraw/zinc/26/64/47/462266447.db2.gz	WFCKFSRKBKVKBD-UHFFFAOYSA-N	0	3	328.460	3.328	20	30		EGEDHN
COC(=O)[C@@H](C)Oc1ccc(CN(C)Cc2cccc(C#N)c2)cc1	ZINC000130785965	534231369	/nfs/dbraw/zinc/23/13/69/534231369.db2.gz	OMSINDXRPVZDLD-OAHLLOKOSA-N	0	3	338.407	3.131	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H]2CCc3c2cccc3Cl)CC1	ZINC000171723934	526439660	/nfs/dbraw/zinc/43/96/60/526439660.db2.gz	FPYDGNYNIXNAKQ-KRWDZBQOSA-N	0	3	333.863	3.277	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(OC(F)F)c(F)c2)CC1	ZINC000171736536	526441985	/nfs/dbraw/zinc/44/19/85/526441985.db2.gz	FPULIHDAGOWQIL-UHFFFAOYSA-N	0	3	343.349	3.199	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cccc(NC(=O)C(C)C)c2)CC1	ZINC000171737506	526441994	/nfs/dbraw/zinc/44/19/94/526441994.db2.gz	JDIHGIHBGYTPOS-UHFFFAOYSA-N	0	3	344.459	3.053	20	30		EGEDHN
C#CCSCCNCc1ccc(OC)c(OCc2cccnc2)c1	ZINC000152920271	527151190	/nfs/dbraw/zinc/15/11/90/527151190.db2.gz	UDSNZTGKJQMYHO-UHFFFAOYSA-N	0	3	342.464	3.125	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)cc1)C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000153796992	528938838	/nfs/dbraw/zinc/93/88/38/528938838.db2.gz	BVDNHWATXHEFMY-LJQANCHMSA-N	0	3	339.395	3.410	20	30		EGEDHN
COC1CCC(N(C)CC(=O)Nc2cc(Cl)ccc2C#N)CC1	ZINC000265256759	536732617	/nfs/dbraw/zinc/73/26/17/536732617.db2.gz	XKZLPSJMCPXEHQ-UHFFFAOYSA-N	0	3	335.835	3.040	20	30		EGEDHN
C=C(C)CN1CCC(Nc2ncc(Br)cc2F)CC1	ZINC000681385691	549989580	/nfs/dbraw/zinc/98/95/80/549989580.db2.gz	YSGIXZGWAVBQEF-UHFFFAOYSA-N	0	3	328.229	3.436	20	30		EGEDHN
C=CCC1(C(=O)Nc2ccc(CN3CCC(O)CC3)cc2)CCC1	ZINC000682926213	550164871	/nfs/dbraw/zinc/16/48/71/550164871.db2.gz	AVKTVCVQZBLZBS-UHFFFAOYSA-N	0	3	328.456	3.328	20	30		EGEDHN
C[C@@H]1CCCN(CCNC(=S)Nc2ccc(C#N)c(Cl)c2)C1	ZINC000726463665	574557320	/nfs/dbraw/zinc/55/73/20/574557320.db2.gz	WUUFKFBEVZWFOM-GFCCVEGCSA-N	0	3	336.892	3.230	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=S)Nc1ccc(OC)nc1)C(C)C	ZINC000726899156	574606376	/nfs/dbraw/zinc/60/63/76/574606376.db2.gz	LOCHJOVHVRRAOE-MRXNPFEDSA-N	0	3	348.516	3.075	20	30		EGEDHN
C#Cc1cccc(N(C(=S)NC[C@@H]2CCCN2CC)C(C)C)c1	ZINC000728226306	574730960	/nfs/dbraw/zinc/73/09/60/574730960.db2.gz	AANMYNORIVVEEG-SFHVURJKSA-N	0	3	329.513	3.242	20	30		EGEDHN
COc1ccc(O)c(/C=N\CCc2ccc(OCCN(C)C)cc2)c1	ZINC000729150281	574818981	/nfs/dbraw/zinc/81/89/81/574818981.db2.gz	UJDIHUNWPRUWFC-QNGOZBTKSA-N	0	3	342.439	3.003	20	30		EGEDHN
C=C(C)CN1CCC(NC(=S)NCCSc2ccccc2)CC1	ZINC000729942990	574898040	/nfs/dbraw/zinc/89/80/40/574898040.db2.gz	WHNPFCAKRPWEFE-UHFFFAOYSA-N	0	3	349.569	3.283	20	30		EGEDHN
C=CCN1CCC(Nc2nc(C)nc3c2cnn3-c2ccccc2)CC1	ZINC000730077377	574921283	/nfs/dbraw/zinc/92/12/83/574921283.db2.gz	VKRVHMKJEARARW-UHFFFAOYSA-N	0	3	348.454	3.186	20	30		EGEDHN
COC(=O)NCCC(=O)C(C#N)c1nc(-c2ccc(C)cc2)cs1	ZINC000730921077	575035671	/nfs/dbraw/zinc/03/56/71/575035671.db2.gz	VCFPZMBECPBDDG-ZDUSSCGKSA-N	0	3	343.408	3.041	20	30		EGEDHN
C#CCOc1cccc(NC(=O)N2CCCN(C(C)(C)C)CC2)c1	ZINC000731110822	575054792	/nfs/dbraw/zinc/05/47/92/575054792.db2.gz	FBJHMSXRSMRQMW-UHFFFAOYSA-N	0	3	329.444	3.037	20	30		EGEDHN
C[C@H]1CC(N=Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCN1C	ZINC000741451929	575066953	/nfs/dbraw/zinc/06/69/53/575066953.db2.gz	QRNHFHXIJZNJAK-VIFPVBQESA-N	0	3	330.310	3.496	20	30		EGEDHN
C=CC1CCN(CC(=O)C(C#N)c2nc3ccccc3s2)CC1	ZINC000732206281	575244711	/nfs/dbraw/zinc/24/47/11/575244711.db2.gz	XGYJZYQQEBWMGW-CQSZACIVSA-N	0	3	325.437	3.371	20	30		EGEDHN
N#CC(C(=O)CC[C@H]1CCCCO1)C(=O)Nc1ccccc1Cl	ZINC000732494444	575272267	/nfs/dbraw/zinc/27/22/67/575272267.db2.gz	HGPNCCLGBRLWPH-OLZOCXBDSA-N	0	3	334.803	3.337	20	30		EGEDHN
N#CCC[C@@H](C#N)CNC1CCN(c2ccc(OC(F)F)cc2)CC1	ZINC000732919587	575296259	/nfs/dbraw/zinc/29/62/59/575296259.db2.gz	MTYIWLGHUZOZNS-AWEZNQCLSA-N	0	3	348.397	3.290	20	30		EGEDHN
C#Cc1cccc(NC(=O)NC[C@H]2CCCN2Cc2ccccc2)c1	ZINC000734204073	575457455	/nfs/dbraw/zinc/45/74/55/575457455.db2.gz	BWKYINDIQOLTJD-HXUWFJFHSA-N	0	3	333.435	3.454	20	30		EGEDHN
C=CC[C@@H](NC(=O)N1CCC[C@@H]1CN1CCCCC1)c1ccncc1	ZINC000734684102	575536794	/nfs/dbraw/zinc/53/67/94/575536794.db2.gz	SDTFZFCVWDMNBI-RTBURBONSA-N	0	3	342.487	3.359	20	30		EGEDHN
N#CC(C(=O)CCCn1ccccc1=O)c1ccc2ccccc2n1	ZINC000735203119	575621119	/nfs/dbraw/zinc/62/11/19/575621119.db2.gz	ARENQUQBIYEBGS-MRXNPFEDSA-N	0	3	331.375	3.053	20	30		EGEDHN
C=C(C)CNC(=S)N(C)[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000737458545	576232720	/nfs/dbraw/zinc/23/27/20/576232720.db2.gz	WPBFQXCUCZPDAS-FUHWJXTLSA-N	0	3	331.529	3.422	20	30		EGEDHN
C#CCCN1CCC(NC(=O)Cc2c(Cl)cccc2Cl)CC1	ZINC000740737623	576621640	/nfs/dbraw/zinc/62/16/40/576621640.db2.gz	FNFOQLXQRZCCKC-UHFFFAOYSA-N	0	3	339.266	3.140	20	30		EGEDHN
COc1ccc(CNCCCOc2ccccc2OC)cc1C#N	ZINC000742369394	576774424	/nfs/dbraw/zinc/77/44/24/576774424.db2.gz	DTWNEAACJGHPJS-UHFFFAOYSA-N	0	3	326.396	3.134	20	30		EGEDHN
C=C(C)CNC(=S)N(CC)C[C@H]1CCN(Cc2ccccc2)C1	ZINC000743061694	576800889	/nfs/dbraw/zinc/80/08/89/576800889.db2.gz	RFNFMHPMDSLYPR-SFHVURJKSA-N	0	3	331.529	3.281	20	30		EGEDHN
[O-]c1c(O)ccc(/C=N/C2CC[NH+](CC3CCCCC3)CC2)c1O	ZINC000743537879	576811417	/nfs/dbraw/zinc/81/14/17/576811417.db2.gz	CIWUPMYEYCNZRW-UDWIEESQSA-N	0	3	332.444	3.267	20	30		EGEDHN
C#CCNC(=O)[C@@H](C)N[C@@H](Cc1ccccc1Cl)c1ccccc1	ZINC000745175781	576842987	/nfs/dbraw/zinc/84/29/87/576842987.db2.gz	JNDALKLBHIZMPE-BEFAXECRSA-N	0	3	340.854	3.351	20	30		EGEDHN
N#CC(C(=O)CCC(=O)CCC(=O)c1cccs1)c1ccccn1	ZINC000041481214	1291417343	/nfs/dbraw/zinc/41/73/43/1291417343.db2.gz	MDPVAEFLKATTGB-AWEZNQCLSA-N	0	3	340.404	3.332	20	30		EGEDHN
COc1cc(CNCc2ccc(OCC#N)cc2)ccc1OC(F)F	ZINC000061016313	1291957217	/nfs/dbraw/zinc/95/72/17/1291957217.db2.gz	UAXVZAHWBGJLGS-UHFFFAOYSA-N	0	3	348.349	3.489	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)CCc2ccccc2F)CC1	ZINC000069112096	1292231925	/nfs/dbraw/zinc/23/19/25/1292231925.db2.gz	BMKWLZKSLSOYOF-UHFFFAOYSA-N	0	3	333.451	3.050	20	30		EGEDHN
CS[C@@H](C)C(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000103330228	1293002093	/nfs/dbraw/zinc/00/20/93/1293002093.db2.gz	AAILXGGFDCQSPQ-IONNQARKSA-N	0	3	331.224	3.392	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)c2ccc(-n3cccn3)c(F)c2)n1	ZINC000103795886	1293014216	/nfs/dbraw/zinc/01/42/16/1293014216.db2.gz	KETAPSXZTHMACU-LBPRGKRZSA-N	0	3	326.356	3.266	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)CO[C@H]2CCCC[C@@H]2C)c1	ZINC000113652642	1293154299	/nfs/dbraw/zinc/15/42/99/1293154299.db2.gz	ZQFWGZQCHAJFQC-LESCRADOSA-N	0	3	328.412	3.238	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000835064559	1293197748	/nfs/dbraw/zinc/19/77/48/1293197748.db2.gz	IXLROHCVDNBFLZ-TUAOUCFPSA-N	0	3	339.222	3.330	20	30		EGEDHN
CC(C)(CC(=O)C(C#N)C(=O)NCc1ccccc1)c1ccccc1	ZINC000119583103	1293278299	/nfs/dbraw/zinc/27/82/99/1293278299.db2.gz	DSOHXOYNPKRZAC-GOSISDBHSA-N	0	3	334.419	3.380	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)[C@@H](C)OCC2CC2)cc1	ZINC000120260289	1293313666	/nfs/dbraw/zinc/31/36/66/1293313666.db2.gz	VVRRZGTUNGKWTM-RDTXWAMCSA-N	0	3	342.439	3.492	20	30		EGEDHN
N#CC(C(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)[C@@H]1CCCCO1	ZINC000121996348	1293399651	/nfs/dbraw/zinc/39/96/51/1293399651.db2.gz	GKGGTORSKHAUGC-OLZOCXBDSA-N	0	3	341.194	3.210	20	30		EGEDHN
N#Cc1c2[nH]c3ccccc3n2c(=O)cc1CN1CCC2(CCC2)C1	ZINC000123471134	1293444770	/nfs/dbraw/zinc/44/47/70/1293444770.db2.gz	LFMAPMDDHXOVJB-OAHLLOKOSA-N	0	3	332.407	3.100	20	30		EGEDHN
CCc1ccc(OCC(=O)C(C#N)C(=O)Nc2cccc(C)c2)cc1	ZINC000127496084	1293566163	/nfs/dbraw/zinc/56/61/63/1293566163.db2.gz	XIHFNSBISMLIGM-GOSISDBHSA-N	0	3	336.391	3.284	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)[C@@H](C)Oc2ccccc2)cc1	ZINC000128380771	1293591200	/nfs/dbraw/zinc/59/12/00/1293591200.db2.gz	UNPBCIHCHSPHFL-RDTXWAMCSA-N	0	3	336.391	3.364	20	30		EGEDHN
N#CC(C(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)C1CCOCC1	ZINC000130460744	1293657248	/nfs/dbraw/zinc/65/72/48/1293657248.db2.gz	AMVFZEUEEKEGMI-ZDUSSCGKSA-N	0	3	341.194	3.067	20	30		EGEDHN
CCc1nc(C)c(C(=O)C(C#N)C(=O)Nc2cccc(C)c2)s1	ZINC000140308126	1293850253	/nfs/dbraw/zinc/85/02/53/1293850253.db2.gz	OPICFVJOVGVQEW-CYBMUJFWSA-N	0	3	327.409	3.284	20	30		EGEDHN
CN(CCC#N)c1ccc(CN2CCN(Cc3ccccc3)CC2)cc1	ZINC000154489316	1294057506	/nfs/dbraw/zinc/05/75/06/1294057506.db2.gz	WPIHPIZUWMSIPB-UHFFFAOYSA-N	0	3	348.494	3.354	20	30		EGEDHN
Cc1noc(C)c1[C@@H](C)C(=O)C(C#N)C(=O)Nc1cccc(C)c1	ZINC000159762768	1294246371	/nfs/dbraw/zinc/24/63/71/1294246371.db2.gz	DPBNESZZRZHDOB-ABAIWWIYSA-N	0	3	325.368	3.051	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)Cc1csc(C(C)(C)C)n1	ZINC000170672363	1294376637	/nfs/dbraw/zinc/37/66/37/1294376637.db2.gz	CILSTMZKEFGLSL-AWEZNQCLSA-N	0	3	349.500	3.388	20	30		EGEDHN
C[C@H](CNC(=O)/C=C/c1ccccc1C#N)N(C)Cc1ccccc1	ZINC000171880694	1294421599	/nfs/dbraw/zinc/42/15/99/1294421599.db2.gz	HKTMYVYMTBFSPV-GZKZCVOOSA-N	0	3	333.435	3.208	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)C[C@@H](C)c1ccccc1C(F)(F)F	ZINC000173983805	1294475454	/nfs/dbraw/zinc/47/54/54/1294475454.db2.gz	UGBBGRIKUPDGLK-DGCLKSJQSA-N	0	3	340.345	3.432	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)CCC(F)(F)F)cc1Cl	ZINC000173980522	1294475640	/nfs/dbraw/zinc/47/56/40/1294475640.db2.gz	DHVUTQCNMBRUCK-SECBINFHSA-N	0	3	348.708	3.338	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)C[C@H](C)C(=O)c1cccc(F)c1	ZINC000177594933	1294678561	/nfs/dbraw/zinc/67/85/61/1294678561.db2.gz	XXQLPRVCPLMYKK-BBRMVZONSA-N	0	3	346.402	3.050	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)COc1ccc(C(C)C)cc1	ZINC000193372885	1295858869	/nfs/dbraw/zinc/85/88/69/1295858869.db2.gz	TVXTZVVBOMEHEQ-QGZVFWFLSA-N	0	3	330.428	3.204	20	30		EGEDHN
Cc1cc(C(=O)CON=C(N)C2CCCC2)c(C)n1CC(F)(F)F	ZINC000194253816	1295962416	/nfs/dbraw/zinc/96/24/16/1295962416.db2.gz	AYBQLAOBIIXKAH-UHFFFAOYSA-N	0	3	345.365	3.329	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CNCc2ccc(N3CCCC3=O)cc2)cc1	ZINC000237494358	1296246193	/nfs/dbraw/zinc/24/61/93/1296246193.db2.gz	PWLKRGRMCFLTGE-INIZCTEOSA-N	0	3	349.434	3.394	20	30		EGEDHN
C#CCN(C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CCc2ccccc21	ZINC000246198129	1296341770	/nfs/dbraw/zinc/34/17/70/1296341770.db2.gz	AKHQBGAYHWCTNJ-VQTJNVASSA-N	0	3	336.391	3.251	20	30		EGEDHN
C#CCOc1ccccc1CN[C@@H]1CCC[C@H]1NC(=O)OC(C)(C)C	ZINC000301726745	1296792581	/nfs/dbraw/zinc/79/25/81/1296792581.db2.gz	AJFMLKCAONKTMZ-IAGOWNOFSA-N	0	3	344.455	3.234	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)Nc1cccc2c1CCN(CC(C)(C)O)C2	ZINC000424763589	1297804949	/nfs/dbraw/zinc/80/49/49/1297804949.db2.gz	PHUOMSURIKDBKV-UHFFFAOYSA-N	0	3	330.472	3.356	20	30		EGEDHN
CC(C)OCCN1CCC(Nc2nc3ccccc3cc2C#N)CC1	ZINC000750029771	1299325786	/nfs/dbraw/zinc/32/57/86/1299325786.db2.gz	MKOKTEFAMLKMDN-UHFFFAOYSA-N	0	3	338.455	3.408	20	30		EGEDHN
N#CC(C(=O)CCc1cccc(F)c1F)C(=O)NC1CCCCC1	ZINC000750391452	1299387319	/nfs/dbraw/zinc/38/73/19/1299387319.db2.gz	HSJZTSUDGRLKLH-CQSZACIVSA-N	0	3	334.366	3.055	20	30		EGEDHN
N#Cc1cccc(CN2CCC(NCc3nc(Cl)cs3)CC2)c1	ZINC000877615567	1299433570	/nfs/dbraw/zinc/43/35/70/1299433570.db2.gz	SWFUUVLIRQVDRG-UHFFFAOYSA-N	0	3	346.887	3.422	20	30		EGEDHN
COCC1(C)CCN(CC[C@](C#N)(C(C)=O)c2ccccc2)CC1	ZINC000878343941	1299930875	/nfs/dbraw/zinc/93/08/75/1299930875.db2.gz	NMPARZRRFYJSFX-FQEVSTJZSA-N	0	3	328.456	3.176	20	30		EGEDHN
Cc1ccc2c(c1)CC[C@H]2N[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000754105589	1300087218	/nfs/dbraw/zinc/08/72/18/1300087218.db2.gz	OOQKXQMVBPAMBV-NHCUHLMSSA-N	0	3	345.446	3.245	20	30		EGEDHN
C[C@@H]1CN(C2CC2)C[C@H]1Nc1nccc(Oc2cccc(C#N)c2)n1	ZINC000882083543	1301820099	/nfs/dbraw/zinc/82/00/99/1301820099.db2.gz	BTXJLDICWGALRH-CXAGYDPISA-N	0	3	335.411	3.035	20	30		EGEDHN
C#CCN(C(=O)N[C@H](CN1CCCCC1)c1ccccc1)C1CC1	ZINC000764728078	1302125043	/nfs/dbraw/zinc/12/50/43/1302125043.db2.gz	MYMVWRPQFUMKJA-LJQANCHMSA-N	0	3	325.456	3.021	20	30		EGEDHN
C#Cc1cccc(NC(=S)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)c1	ZINC000764933775	1302169788	/nfs/dbraw/zinc/16/97/88/1302169788.db2.gz	VJZCYRDUQKHOHT-JXFKEZNVSA-N	0	3	349.503	3.475	20	30		EGEDHN
CCN1CCN(c2ccc(NCc3ccc(C#N)s3)cc2)CC1	ZINC000770484939	1303275726	/nfs/dbraw/zinc/27/57/26/1303275726.db2.gz	KVODAVZUQMEVDY-UHFFFAOYSA-N	0	3	326.469	3.374	20	30		EGEDHN
CC1(C(=O)OCc2ccnc(C#N)c2)CCN(Cc2ccccc2)CC1	ZINC000772719564	1303567686	/nfs/dbraw/zinc/56/76/86/1303567686.db2.gz	ULKIETBIZZKKHN-UHFFFAOYSA-N	0	3	349.434	3.299	20	30		EGEDHN
C=CCC1(O)CCN(C[C@@H](O)COc2ccc(C(C)(C)C)cc2)CC1	ZINC000886757493	1303586495	/nfs/dbraw/zinc/58/64/95/1303586495.db2.gz	ISWYHTVRXWPOIW-GOSISDBHSA-N	0	3	347.499	3.127	20	30		EGEDHN
C#CC[C@@H](NC[C@H](O)COc1cccc2[nH]ccc21)c1ccccc1	ZINC000775405080	1303958684	/nfs/dbraw/zinc/95/86/84/1303958684.db2.gz	VDEJPTAQCUXQNP-PKOBYXMFSA-N	0	3	334.419	3.262	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1NCc1cc(C#N)ccc1F	ZINC000775628213	1303998311	/nfs/dbraw/zinc/99/83/11/1303998311.db2.gz	ARJVTEJYKRJNMS-HOTGVXAUSA-N	0	3	333.407	3.233	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H](CNC(=O)OC(C)(C)C)C1CC1	ZINC000775926976	1304061926	/nfs/dbraw/zinc/06/19/26/1304061926.db2.gz	DAVPGBQIJPAYAH-QGZVFWFLSA-N	0	3	329.444	3.293	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CNC[C@@H]1CSCCS1	ZINC000778176472	1304411508	/nfs/dbraw/zinc/41/15/08/1304411508.db2.gz	KHPFHZJBNOLNKQ-GFCCVEGCSA-N	0	3	327.902	3.290	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CN1CCC2(C[C@@H]2C(=O)OC)CC1	ZINC000779157889	1304537096	/nfs/dbraw/zinc/53/70/96/1304537096.db2.gz	JMKOLJZRYRZFRD-OAHLLOKOSA-N	0	3	347.842	3.127	20	30		EGEDHN
C#CCOc1ccccc1CN1CCC[C@@H](C(C)(C)C(=O)OC)C1	ZINC000779603728	1304586848	/nfs/dbraw/zinc/58/68/48/1304586848.db2.gz	AFGLNJSDQVFVII-QGZVFWFLSA-N	0	3	329.440	3.110	20	30		EGEDHN
C=CCCN(OCc1ccccc1)C(=O)N[C@H]1CN(C2CC2)C[C@@H]1C	ZINC000782975557	1305033357	/nfs/dbraw/zinc/03/33/57/1305033357.db2.gz	CGSNFDVDYPBKNH-LPHOPBHVSA-N	0	3	343.471	3.189	20	30		EGEDHN
C=CCS(=O)(=O)CCN[C@H]1CCCCc2ccc(Cl)cc21	ZINC000783532620	1305103863	/nfs/dbraw/zinc/10/38/63/1305103863.db2.gz	SMFGDRRSPFZJNF-INIZCTEOSA-N	0	3	327.877	3.298	20	30		EGEDHN
C[C@]1(C#N)CCCN(CC(=O)C(C#N)c2nc3ccccc3s2)C1	ZINC000784453134	1305245640	/nfs/dbraw/zinc/24/56/40/1305245640.db2.gz	HJXFYAIGEPBSPS-SCLBCKFNSA-N	0	3	338.436	3.098	20	30		EGEDHN
C[C@]1(C#N)CCCN(CC(=O)C(C#N)c2nc3ccccc3s2)C1	ZINC000784453131	1305246202	/nfs/dbraw/zinc/24/62/02/1305246202.db2.gz	HJXFYAIGEPBSPS-FZKQIMNGSA-N	0	3	338.436	3.098	20	30		EGEDHN
C=C1CCC(C(=O)C(C#N)C(=O)Nc2ccc(OC)c(OC)c2)CC1	ZINC000892498474	1305408328	/nfs/dbraw/zinc/40/83/28/1305408328.db2.gz	JKEHVJDDOBGWIL-OAHLLOKOSA-N	0	3	342.395	3.098	20	30		EGEDHN
Cn1nc2c(c1C(=O)C(C#N)c1cc(C(F)(F)F)ccn1)CCCC2	ZINC000893062184	1305684957	/nfs/dbraw/zinc/68/49/57/1305684957.db2.gz	LGOXUKOSUPMERL-LBPRGKRZSA-N	0	3	348.328	3.203	20	30		EGEDHN
C#CCC1(C(=O)Nc2cccc(CN3CC[C@H](O)C3)c2)CCCCC1	ZINC000794569068	1309548053	/nfs/dbraw/zinc/54/80/53/1309548053.db2.gz	RLMLLWPMXFCWIE-IBGZPJMESA-N	0	3	340.467	3.166	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CNCc2ccc(C[S@@](C)=O)cc2)cc1	ZINC000796525436	1310020986	/nfs/dbraw/zinc/02/09/86/1310020986.db2.gz	CPMWDDHCEJJBCE-OYLFLEFRSA-N	0	3	342.464	3.146	20	30		EGEDHN
C[C@H](NC(=O)C1CCCC1)C(=O)C(C#N)c1ncc(C(C)(C)C)s1	ZINC000797568641	1310212259	/nfs/dbraw/zinc/21/22/59/1310212259.db2.gz	KNVALGFPGDKIHT-AAEUAGOBSA-N	0	3	347.484	3.312	20	30		EGEDHN
CCCC(=O)N1CCC[C@@H]1C(=O)C(C#N)c1ncc(C(C)(C)C)s1	ZINC000797569069	1310212703	/nfs/dbraw/zinc/21/27/03/1310212703.db2.gz	AFFUBSJYFIMARO-CHWSQXEVSA-N	0	3	347.484	3.408	20	30		EGEDHN
C#Cc1ccc(C(=O)Nc2cccc(N3CCN(CC)CC3)c2)cc1	ZINC000897422097	1310331755	/nfs/dbraw/zinc/33/17/55/1310331755.db2.gz	YZLNZRKHXNEAOE-UHFFFAOYSA-N	0	3	333.435	3.062	20	30		EGEDHN
C#C[C@H](NC(=O)NC[C@@H](c1cccc(OC)c1)N(CC)CC)C(C)C	ZINC000798510176	1310374046	/nfs/dbraw/zinc/37/40/46/1310374046.db2.gz	LSJHOUFFAYAVAQ-OALUTQOASA-N	0	3	345.487	3.035	20	30		EGEDHN
Cc1noc(C[C@H]2CCCN(Cc3ccc(O[C@H](C)C#N)cc3)C2)n1	ZINC000897579073	1310391860	/nfs/dbraw/zinc/39/18/60/1310391860.db2.gz	NUEDZXQYPJEAEA-RHSMWYFYSA-N	0	3	340.427	3.124	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)cc1C#N	ZINC000799366798	1310537407	/nfs/dbraw/zinc/53/74/07/1310537407.db2.gz	SXZADLFLERUMGV-JXFKEZNVSA-N	0	3	333.435	3.117	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H](NCc2ccc(C#N)c(Cl)c2)C1	ZINC000800895885	1310831345	/nfs/dbraw/zinc/83/13/45/1310831345.db2.gz	OAFUSSNRRIVPRU-CQSZACIVSA-N	0	3	335.835	3.311	20	30		EGEDHN
C#Cc1cccc(NC(=O)N(CCN(C)C)Cc2ccsc2)c1	ZINC000838820987	1320822526	/nfs/dbraw/zinc/82/25/26/1320822526.db2.gz	LSONLVLZCANLAE-UHFFFAOYSA-N	0	3	327.453	3.325	20	30		EGEDHN
C[C@H](C#N)OCCN1CC[C@H](Oc2ccc(Cl)c(Cl)c2)C1	ZINC000801927136	1316966878	/nfs/dbraw/zinc/96/68/78/1316966878.db2.gz	IGQLSGQGCSHNEO-YPMHNXCESA-N	0	3	329.227	3.375	20	30		EGEDHN
C[C@@H](C#N)OCCN(CCc1ccccn1)Cc1ccc(F)cc1	ZINC000801931675	1316968105	/nfs/dbraw/zinc/96/81/05/1316968105.db2.gz	LSQAHCNERSGENR-INIZCTEOSA-N	0	3	327.403	3.194	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@@H]1C[C@H]1c1ccccc1CC	ZINC000802039872	1316975857	/nfs/dbraw/zinc/97/58/57/1316975857.db2.gz	ZTEUUCHBTZMOTH-RCCFBDPRSA-N	0	3	326.440	3.368	20	30		EGEDHN
CC[C@H](C)[C@H](NC(C)=O)C(=O)C(C#N)c1ncc(C(C)(C)C)s1	ZINC000802833223	1317046696	/nfs/dbraw/zinc/04/66/96/1317046696.db2.gz	CPQLGCIJNBIJHM-SUHUHFCYSA-N	0	3	335.473	3.168	20	30		EGEDHN
CC(C)(C(=O)N1CC[C@H](NCc2ccc(F)c(C#N)c2)C1)C1CCC1	ZINC001019197990	1317095564	/nfs/dbraw/zinc/09/55/64/1317095564.db2.gz	FYCHGCJPZUVHAA-KRWDZBQOSA-N	0	3	343.446	3.214	20	30		EGEDHN
CC1(C)CC[C@H](C(=O)N2CC[C@H](NCc3ccc(C#N)c(F)c3)C2)C1	ZINC001019347628	1317183285	/nfs/dbraw/zinc/18/32/85/1317183285.db2.gz	LUSLSTVUADBPAC-RDJZCZTQSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=CCNc1ncc(C(=O)Nc2cc(CN(C)C)ccc2OC)s1	ZINC000900174583	1317245567	/nfs/dbraw/zinc/24/55/67/1317245567.db2.gz	MKSAITVXPXIKCK-UHFFFAOYSA-N	0	3	346.456	3.064	20	30		EGEDHN
C=C[C@@H](C(=O)N1CC[C@H](NCc2cc(C)ns2)C1)c1ccccc1	ZINC001019805204	1317432832	/nfs/dbraw/zinc/43/28/32/1317432832.db2.gz	WMUVYEDHNKKFAU-FUHWJXTLSA-N	0	3	341.480	3.112	20	30		EGEDHN
C#CCOc1ccccc1CN[C@@H](C)c1cccc(-n2ccnn2)c1	ZINC000806146561	1317465519	/nfs/dbraw/zinc/46/55/19/1317465519.db2.gz	PDFHRYYUTZTEOR-INIZCTEOSA-N	0	3	332.407	3.130	20	30		EGEDHN
CC(C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1)=C1CCCC1	ZINC001020064106	1317528212	/nfs/dbraw/zinc/52/82/12/1317528212.db2.gz	BTXAIZILMABGJH-IYARVYRRSA-N	0	3	341.430	3.325	20	30		EGEDHN
C[C@@H](N[C@H]1C[C@H](NC(=O)c2c[nH]c(C#N)c2)C1)c1ccccc1Cl	ZINC001020086017	1317539960	/nfs/dbraw/zinc/53/99/60/1317539960.db2.gz	HCOZFIMEVBZBRB-MRVWCRGKSA-N	0	3	342.830	3.151	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2CC(C)(C)C)C1	ZINC001020173854	1317573407	/nfs/dbraw/zinc/57/34/07/1317573407.db2.gz	IPGCKIPTXRGWAJ-XDQVBPFNSA-N	0	3	343.309	3.204	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@H](NC(=O)C[C@@H]3C=CCCC3)C2)c(F)c1	ZINC001020283400	1317623773	/nfs/dbraw/zinc/62/37/73/1317623773.db2.gz	BFCHJMCIJDDZCD-ZTFGCOKTSA-N	0	3	341.430	3.181	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@H](NC(=O)C[C@@H]3C=CCCC3)C2)c1	ZINC001020284017	1317624577	/nfs/dbraw/zinc/62/45/77/1317624577.db2.gz	QSDIGSWXGLNMRW-ZTFGCOKTSA-N	0	3	341.430	3.181	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)C2CCc3ccccc3CC2)C1	ZINC001020333170	1317649861	/nfs/dbraw/zinc/64/98/61/1317649861.db2.gz	MRSRDUAAPHSRPT-IYARVYRRSA-N	0	3	332.875	3.171	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N2CCN(CC3CCCC3)CC2)cc1	ZINC000957819550	1317652902	/nfs/dbraw/zinc/65/29/02/1317652902.db2.gz	NUJOJSWUQCXEBS-UHFFFAOYSA-N	0	3	342.483	3.128	20	30		EGEDHN
C#C[C@H](NC(=O)N1CCCN(Cc2ccccc2C)CC1)C(C)(C)C	ZINC000808318542	1317660959	/nfs/dbraw/zinc/66/09/59/1317660959.db2.gz	NNASUHSTMLQGBK-IBGZPJMESA-N	0	3	341.499	3.260	20	30		EGEDHN
COc1ccc(CNCc2ccc(OCC#N)cc2)c(C)c1OC	ZINC000808387949	1317669588	/nfs/dbraw/zinc/66/95/88/1317669588.db2.gz	ZAJXGWKXBACVRH-UHFFFAOYSA-N	0	3	326.396	3.204	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)C2(c3ccc(F)cc3)CCC2)C1	ZINC001020451810	1317703735	/nfs/dbraw/zinc/70/37/35/1317703735.db2.gz	JZSPCFNZXRFXGF-WKILWMFISA-N	0	3	336.838	3.237	20	30		EGEDHN
C[C@H]1CCC[C@H](C(=O)N[C@H]2C[C@H](NCc3ccc(C#N)cc3F)C2)C1	ZINC001020524706	1317744378	/nfs/dbraw/zinc/74/43/78/1317744378.db2.gz	XTUJOHJKBMSYQP-IKICRFKJSA-N	0	3	343.446	3.260	20	30		EGEDHN
C[NH+](C)CCN(Cc1ccc(C#N)cc1)Cc1c([O-])cccc1Cl	ZINC000809731809	1317881888	/nfs/dbraw/zinc/88/18/88/1317881888.db2.gz	RUSVYORUMJVFIW-UHFFFAOYSA-N	0	3	343.858	3.481	20	30		EGEDHN
Cc1nn(Cc2ccc(C)cc2)c(C)c1/C=C1\C(=O)c2ncnn2C1C	ZINC000905079707	1317920972	/nfs/dbraw/zinc/92/09/72/1317920972.db2.gz	FOBQCDPKDVCERM-QJVAEYLJSA-N	0	3	347.422	3.289	20	30		EGEDHN
CCCOc1c(/C=C2/C(=O)c3ncnn3C2C)cccc1OCC	ZINC000905081936	1317921778	/nfs/dbraw/zinc/92/17/78/1317921778.db2.gz	UTTJQPPNEIRQKE-HLVNSREUSA-N	0	3	327.384	3.307	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H]2C[C@H](NCc3ccc(C#N)cc3F)C2)cc1	ZINC001020971703	1318022761	/nfs/dbraw/zinc/02/27/61/1318022761.db2.gz	BCEUYQXXVHJWPT-IYARVYRRSA-N	0	3	337.398	3.056	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@@H](CCCN3C(=O)CC3CC3)C2)cc1	ZINC001021497319	1318304472	/nfs/dbraw/zinc/30/44/72/1318304472.db2.gz	XAQOFMBHQSTKOE-PMACEKPBSA-N	0	3	337.467	3.171	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@@H]2CN(Cc3cccc(C#N)c3)CC[C@@H]21	ZINC001021528579	1318365134	/nfs/dbraw/zinc/36/51/34/1318365134.db2.gz	YXSUHATZEKXIGQ-MOPGFXCFSA-N	0	3	325.456	3.027	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@@H]2CN(Cc3ccccc3F)CC[C@@H]21	ZINC001021581710	1318425608	/nfs/dbraw/zinc/42/56/08/1318425608.db2.gz	RBDGUOYTENKSBK-QUCCMNQESA-N	0	3	340.442	3.052	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@@H]2CN(Cc3ccccc3F)CC[C@H]21	ZINC001021581711	1318426050	/nfs/dbraw/zinc/42/60/50/1318426050.db2.gz	RBDGUOYTENKSBK-UYAOXDASSA-N	0	3	340.442	3.052	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cccc3cccnc32)C1	ZINC001021621383	1318470541	/nfs/dbraw/zinc/47/05/41/1318470541.db2.gz	ARZKBORSHYLQEK-QUCCMNQESA-N	0	3	347.462	3.185	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)C1CCCC1	ZINC000960356322	1318479640	/nfs/dbraw/zinc/47/96/40/1318479640.db2.gz	KRJBIGIJQTXLCH-IBGZPJMESA-N	0	3	325.456	3.171	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(-c3ccco3)on2)C1	ZINC001021645796	1318503522	/nfs/dbraw/zinc/50/35/22/1318503522.db2.gz	MWBBCQCUCAPNRS-ZBFHGGJFSA-N	0	3	341.411	3.047	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cccc3cc[nH]c32)C1	ZINC001021672356	1318536660	/nfs/dbraw/zinc/53/66/60/1318536660.db2.gz	BBBUKPKQTDCMBL-PKOBYXMFSA-N	0	3	335.451	3.118	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(Cl)cs2)C1	ZINC001021677522	1318546332	/nfs/dbraw/zinc/54/63/32/1318546332.db2.gz	QPKFBGFTXBDDGJ-UKRRQHHQSA-N	0	3	336.888	3.351	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(C)c(F)cc2Cl)C1	ZINC001021715933	1318595604	/nfs/dbraw/zinc/59/56/04/1318595604.db2.gz	BDGKXFFDHXTJOW-KDOFPFPSSA-N	0	3	348.849	3.347	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(CC(C)C)cc2)C1	ZINC001021729772	1318630437	/nfs/dbraw/zinc/63/04/37/1318630437.db2.gz	HHPYXGOVXXGXBB-NHCUHLMSSA-N	0	3	338.495	3.445	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)CC1CCC1	ZINC000960523309	1318635627	/nfs/dbraw/zinc/63/56/27/1318635627.db2.gz	BOJXMUZFMHOTPG-LJQANCHMSA-N	0	3	325.456	3.171	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)CC1CCC1	ZINC000960526804	1318641521	/nfs/dbraw/zinc/64/15/21/1318641521.db2.gz	KYYGJWSWYSGVDB-LJQANCHMSA-N	0	3	325.456	3.171	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc3ccccc3n2CC)C1	ZINC001021738874	1318646302	/nfs/dbraw/zinc/64/63/02/1318646302.db2.gz	CQAHKRWJUQBUAV-QUCCMNQESA-N	0	3	349.478	3.221	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cnc(C(C)(C)C)s2)C1	ZINC001021739939	1318650285	/nfs/dbraw/zinc/65/02/85/1318650285.db2.gz	PEDHEZGPYXOGMN-GJZGRUSLSA-N	0	3	345.512	3.000	20	30		EGEDHN
N#Cc1ccc(CN2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)[C@@H]2CCC=CCCC2)cc1	ZINC000960531657	1318650971	/nfs/dbraw/zinc/65/09/71/1318650971.db2.gz	AYRZRBDYAFLZTE-CGXNFDGLSA-N	0	3	349.478	3.241	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@@H](NC(=O)CC3CCCCC3)C2)c1	ZINC001021811446	1318694444	/nfs/dbraw/zinc/69/44/44/1318694444.db2.gz	WEVJJKOJPGFAET-HDICACEKSA-N	0	3	343.446	3.405	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)NCc1ccc(NC(C)=O)cc1	ZINC000912197469	1318846897	/nfs/dbraw/zinc/84/68/97/1318846897.db2.gz	RSAIFNIIELGJAQ-GOSISDBHSA-N	0	3	333.476	3.339	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@@H](NC(=O)[C@H]3CCCC34CC4)C2)c1	ZINC001022280529	1318873712	/nfs/dbraw/zinc/87/37/12/1318873712.db2.gz	JRDRAXQVFUIQBB-IXDOHACOSA-N	0	3	341.430	3.014	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)C1(C)CCC1	ZINC000960804688	1318916105	/nfs/dbraw/zinc/91/61/05/1318916105.db2.gz	VCMIPSFHUKRMGL-SFHVURJKSA-N	0	3	325.456	3.171	20	30		EGEDHN
CC1(C)CC(CC(=O)N[C@H]2C[C@@H](NCc3ccc(C#N)cc3F)C2)C1	ZINC001022591310	1319007221	/nfs/dbraw/zinc/00/72/21/1319007221.db2.gz	VRHFQNZXPKAUNU-CALCHBBNSA-N	0	3	343.446	3.260	20	30		EGEDHN
C[C@@H]1CCC[C@]1(C)C(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001022667278	1319056726	/nfs/dbraw/zinc/05/67/26/1319056726.db2.gz	XGFQJNNEQUEYSD-JPUXWFAOSA-N	0	3	343.446	3.260	20	30		EGEDHN
N#CC(C(=O)C1CCC(OC[C@@H]2CCCO2)CC1)c1ccccn1	ZINC000815907236	1319071294	/nfs/dbraw/zinc/07/12/94/1319071294.db2.gz	WHZMRKDOKCLYJA-GQGLESIBSA-N	0	3	328.412	3.012	20	30		EGEDHN
Cc1cc(C#N)cnc1C(=O)OC[C@]1(C)CCCN1Cc1ccccc1	ZINC000815967352	1319081318	/nfs/dbraw/zinc/08/13/18/1319081318.db2.gz	YTBLCERHQOCHDC-NRFANRHFSA-N	0	3	349.434	3.473	20	30		EGEDHN
CCC(=O)N1CCC[C@H]([C@H]2CCN(Cc3cc(C#N)ccc3F)C2)C1	ZINC000961070591	1319183490	/nfs/dbraw/zinc/18/34/90/1319183490.db2.gz	URXDSNANGAUWAW-IRXDYDNUSA-N	0	3	343.446	3.168	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc3c(s2)CC[C@@H](C)C3)C1	ZINC001023075072	1319255087	/nfs/dbraw/zinc/25/50/87/1319255087.db2.gz	VZVIAMQYCYHFSL-HONMWMINSA-N	0	3	338.904	3.476	20	30		EGEDHN
Cc1ccoc1C(=O)NC[C@H]1CCCN(Cc2ccc(C#N)cc2)C1	ZINC001023223635	1319362304	/nfs/dbraw/zinc/36/23/04/1319362304.db2.gz	ROQVMWKJYZFYJG-GOSISDBHSA-N	0	3	337.423	3.102	20	30		EGEDHN
C=CC[C@@H](CO)CN[C@H](c1nc(Br)cs1)C1CC1	ZINC000817581335	1319404864	/nfs/dbraw/zinc/40/48/64/1319404864.db2.gz	QRJKYUYAAZMRKL-SKDRFNHKSA-N	0	3	331.279	3.131	20	30		EGEDHN
N#Cc1cc(C(=O)NC[C@@H]2CCCN(C/C=C\c3ccccc3)C2)c[nH]1	ZINC001023314397	1319438518	/nfs/dbraw/zinc/43/85/18/1319438518.db2.gz	LKFPAAFFRAKTQU-MSEQUDFZSA-N	0	3	348.450	3.042	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](C2CCN(C(=O)c3ccccn3)CC2)C1	ZINC000961311798	1319472306	/nfs/dbraw/zinc/47/23/06/1319472306.db2.gz	FURPBBBOWXGIIH-KRWDZBQOSA-N	0	3	347.890	3.398	20	30		EGEDHN
C#CCOc1ccc(Br)cc1CN[C@@H]1CC[C@H](C#N)C1	ZINC000818230012	1319524031	/nfs/dbraw/zinc/52/40/31/1319524031.db2.gz	LZTOGUFSTQDXJH-SWLSCSKDSA-N	0	3	333.229	3.243	20	30		EGEDHN
C#CCN(C)CCCNC(=O)C[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000818595608	1319565425	/nfs/dbraw/zinc/56/54/25/1319565425.db2.gz	DHKVCXUKVRVMTJ-CQSZACIVSA-N	0	3	340.389	3.270	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2scnc2C2CCCC2)C1	ZINC001023469202	1319567716	/nfs/dbraw/zinc/56/77/16/1319567716.db2.gz	AJCXKPMLXLBHJW-HNNXBMFYSA-N	0	3	345.512	3.266	20	30		EGEDHN
C#CCN1CCC[C@H](CNC(=O)c2ccc3c4c(cccc42)CC3)C1	ZINC001023474529	1319573008	/nfs/dbraw/zinc/57/30/08/1319573008.db2.gz	AIVJRETUCFVTOF-MRXNPFEDSA-N	0	3	332.447	3.013	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cn(CC)c3ccccc23)C1	ZINC001023476676	1319579476	/nfs/dbraw/zinc/57/94/76/1319579476.db2.gz	RXEDKWRROPTEMT-QGZVFWFLSA-N	0	3	337.467	3.126	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN[C@@H]2CCCOc3c(F)cccc32)cc1	ZINC000819214829	1319670226	/nfs/dbraw/zinc/67/02/26/1319670226.db2.gz	UVGIRIYYFSETTQ-QZTJIDSGSA-N	0	3	326.371	3.234	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc(F)c(Cl)cc2F)C1	ZINC001023563115	1319674971	/nfs/dbraw/zinc/67/49/71/1319674971.db2.gz	SYSGLFCJWYBUOZ-LBPRGKRZSA-N	0	3	340.801	3.083	20	30		EGEDHN
CCOc1ccc2c(c1)[C@H](NC[C@H](O)c1ccc(C#N)cc1)CCO2	ZINC000819242055	1319679456	/nfs/dbraw/zinc/67/94/56/1319679456.db2.gz	IPHDWXHGLMSLLO-MOPGFXCFSA-N	0	3	338.407	3.104	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CCCN(Cc3cccnc3C)C2)CC1	ZINC001023573131	1319690995	/nfs/dbraw/zinc/69/09/95/1319690995.db2.gz	SZMIDWUXYAQGRN-SFHVURJKSA-N	0	3	341.499	3.465	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)NC[C@@H]1CCCN(Cc2ccc(C#N)cc2)C1	ZINC001023580932	1319705362	/nfs/dbraw/zinc/70/53/62/1319705362.db2.gz	ZMGZWHCUYBKIFU-XUVXKRRUSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2[C@H]3CN([C@H](C)c4cccc(OC)c4)C[C@H]32)C1	ZINC000961735890	1319718895	/nfs/dbraw/zinc/71/88/95/1319718895.db2.gz	UPAFFGGTXVESQD-OAOYMFHYSA-N	0	3	340.467	3.159	20	30		EGEDHN
C=CCN1CCC[C@H](CNC(=O)c2c(F)ccc(F)c2Cl)C1	ZINC001023608732	1319721851	/nfs/dbraw/zinc/72/18/51/1319721851.db2.gz	FAUNETPVCBCPGE-LLVKDONJSA-N	0	3	328.790	3.246	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)CCC(=O)c1ccc2ccccc2c1	ZINC000916944911	1319727541	/nfs/dbraw/zinc/72/75/41/1319727541.db2.gz	BKIDMWWARKPSGS-QGZVFWFLSA-N	0	3	336.391	3.036	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H](CNC(=O)[C@H]3CC34CCC4)C2)cc1	ZINC001023624836	1319746191	/nfs/dbraw/zinc/74/61/91/1319746191.db2.gz	HKIQGWGPAHTJOC-RTBURBONSA-N	0	3	337.467	3.077	20	30		EGEDHN
C#CCN1CCC[C@H](CNC(=O)c2ccc(-c3ccco3)s2)C1	ZINC001023678356	1319792946	/nfs/dbraw/zinc/79/29/46/1319792946.db2.gz	UUDCQYWRAOFJPZ-CQSZACIVSA-N	0	3	328.437	3.083	20	30		EGEDHN
C=CCN1CCC[C@@H](CNC(=O)c2cnc(CC(C)(C)C)s2)C1	ZINC001023690254	1319810502	/nfs/dbraw/zinc/81/05/02/1319810502.db2.gz	XZWKRGQQTQMUNA-AWEZNQCLSA-N	0	3	335.517	3.360	20	30		EGEDHN
C#CCN1CCC[C@@H](CNC(=O)c2ccc(-c3cccs3)o2)C1	ZINC001023728113	1319866407	/nfs/dbraw/zinc/86/64/07/1319866407.db2.gz	ZPVYTKZRRLWNBM-AWEZNQCLSA-N	0	3	328.437	3.083	20	30		EGEDHN
N#Cc1ccccc1CNCC1CC(NC(=O)c2occc2Cl)C1	ZINC000962267718	1319892846	/nfs/dbraw/zinc/89/28/46/1319892846.db2.gz	IZZFYVNSORNACR-UHFFFAOYSA-N	0	3	343.814	3.103	20	30		EGEDHN
C=CCN1CCC(Nc2cccc(Br)c2[N+](=O)[O-])CC1	ZINC000820657954	1319929289	/nfs/dbraw/zinc/92/92/89/1319929289.db2.gz	HYDVYCALGBIBMZ-UHFFFAOYSA-N	0	3	340.221	3.420	20	30		EGEDHN
CN(C)C[C@H]1CCc2ccccc2N1C(=O)/C=C\c1ccccc1C#N	ZINC000821630884	1320023901	/nfs/dbraw/zinc/02/39/01/1320023901.db2.gz	OQEIZYHYXCCXOH-XYELWLDHSA-N	0	3	345.446	3.481	20	30		EGEDHN
C/C(=C/C(=O)N(CCN(C)C)Cc1cccc(C#N)c1)c1ccco1	ZINC000824368777	1320251822	/nfs/dbraw/zinc/25/18/22/1320251822.db2.gz	UHSUNPIMNUBBTE-VBKFSLOCSA-N	0	3	337.423	3.145	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N(Cc1ccc([C@@H]2C[C@@H]2C)o1)C1CC1	ZINC000838624297	1320796162	/nfs/dbraw/zinc/79/61/62/1320796162.db2.gz	QIOAKCVTPZZNBS-MAUKXSAKSA-N	0	3	343.471	3.032	20	30		EGEDHN
C=CCNC(=S)Nc1cc(Cl)ccc1OC1CCN(C)CC1	ZINC000840822304	1321156390	/nfs/dbraw/zinc/15/63/90/1321156390.db2.gz	KQFPCHLMEJVUIT-UHFFFAOYSA-N	0	3	339.892	3.285	20	30		EGEDHN
CC1(C)OCC[C@@H]1NN=C1CCN(C2CC2)[C@H](c2ccccc2)C1	ZINC000841641850	1321290899	/nfs/dbraw/zinc/29/08/99/1321290899.db2.gz	XGFICTMHDMGVMN-OALUTQOASA-N	0	3	327.472	3.499	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@@H]1C[C@H]1c1ccccc1OC	ZINC000842283639	1321367706	/nfs/dbraw/zinc/36/77/06/1321367706.db2.gz	ASFGUFLESBOTEM-GVDBMIGSSA-N	0	3	342.439	3.204	20	30		EGEDHN
CCN(Cc1ccccc1)c1ccc(C=NN(C)[C@@H](C)CO)cc1	ZINC000842544262	1321401358	/nfs/dbraw/zinc/40/13/58/1321401358.db2.gz	GOBAFWDWJVPYSM-KRWDZBQOSA-N	0	3	325.456	3.360	20	30		EGEDHN
C[C@@H](N[C@H]1CCc2ccc(C#N)cc21)c1ccc(N2CCNC2=O)cc1	ZINC000842903420	1321448425	/nfs/dbraw/zinc/44/84/25/1321448425.db2.gz	ROZSCEYZBBHYQX-VLIAUNLRSA-N	0	3	346.434	3.426	20	30		EGEDHN
C[C@H](NC(=O)c1ccccc1)C(=O)C(C#N)c1nc(C2CC2)cs1	ZINC000842940204	1321451309	/nfs/dbraw/zinc/45/13/09/1321451309.db2.gz	YSBVMALSORQTAX-FZMZJTMJSA-N	0	3	339.420	3.015	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-]	ZINC000845880052	1321750068	/nfs/dbraw/zinc/75/00/68/1321750068.db2.gz	KJHGLYJLJDRXRS-RFAUZJTJSA-N	0	3	332.287	3.162	20	30		EGEDHN
Cc1csc(CNC2CCN(Cc3cccc(C#N)c3)CC2)n1	ZINC000846106450	1321768083	/nfs/dbraw/zinc/76/80/83/1321768083.db2.gz	IEFGCOWHWZKEQM-UHFFFAOYSA-N	0	3	326.469	3.077	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)C(=O)N1C[C@H](N(C)C)Cc2ccccc21	ZINC000846865047	1321817883	/nfs/dbraw/zinc/81/78/83/1321817883.db2.gz	HOQZLTLPEWXQGM-OXQOHEQNSA-N	0	3	347.462	3.256	20	30		EGEDHN
N#CC1(COC(=O)c2cncs2)CCN(Cc2ccccc2)CC1	ZINC000847746964	1321900169	/nfs/dbraw/zinc/90/01/69/1321900169.db2.gz	UBWOBSDZCRWULD-UHFFFAOYSA-N	0	3	341.436	3.106	20	30		EGEDHN
C=CCN(C(=S)NC1CCN(Cc2ccccc2)CC1)C(C)C	ZINC000920311237	1322161468	/nfs/dbraw/zinc/16/14/68/1322161468.db2.gz	SGWZUBOHAMNACD-UHFFFAOYSA-N	0	3	331.529	3.422	20	30		EGEDHN
CCN1CCN(c2ccc(N=Cc3cccc(OC)c3O)cc2)CC1	ZINC000920942569	1322238349	/nfs/dbraw/zinc/23/83/49/1322238349.db2.gz	GGFSRZPNLIYELK-UHFFFAOYSA-N	0	3	339.439	3.293	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@@H]1C[C@H]1c1ccc(C)c(C)c1	ZINC000850752919	1322284938	/nfs/dbraw/zinc/28/49/38/1322284938.db2.gz	UUQHQEBQXYWFTB-KSZLIROESA-N	0	3	326.440	3.422	20	30		EGEDHN
CC[C@H](NCc1cc(C#N)ccc1Br)[C@H](O)C(C)C	ZINC000922186118	1322474565	/nfs/dbraw/zinc/47/45/65/1322474565.db2.gz	SXQXKARTTVEWSJ-LSDHHAIUSA-N	0	3	325.250	3.206	20	30		EGEDHN
C=CCc1cc(CNCc2ccc3c(c2)ncn3C)cc(OC)c1O	ZINC000922481624	1322538810	/nfs/dbraw/zinc/53/88/10/1322538810.db2.gz	NYYNRPYZIWRDNQ-UHFFFAOYSA-N	0	3	337.423	3.306	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@@H](CNCc2c(F)cccc2Cl)C1	ZINC001023978668	1323061642	/nfs/dbraw/zinc/06/16/42/1323061642.db2.gz	BCQDZBBCRCGUKY-HNNXBMFYSA-N	0	3	348.849	3.221	20	30		EGEDHN
N#Cc1ccccc1CNCC1CC(NC(=O)C2CCC=CCC2)C1	ZINC000962743872	1323066599	/nfs/dbraw/zinc/06/65/99/1323066599.db2.gz	CFDJYZYLBMQFLQ-UHFFFAOYSA-N	0	3	337.467	3.289	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC[C@@H](CNCc2cc(C)no2)C1	ZINC001024004265	1323076569	/nfs/dbraw/zinc/07/65/69/1323076569.db2.gz	YYHXIPDYEPFARX-AWEZNQCLSA-N	0	3	339.867	3.090	20	30		EGEDHN
CC(=O)N[C@@H](c1ccccc1F)[C@@H](C)NCc1cccc(C#N)c1	ZINC000924639803	1323089601	/nfs/dbraw/zinc/08/96/01/1323089601.db2.gz	NENRCHNTOMCIEF-BFUOFWGJSA-N	0	3	325.387	3.053	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H](CNCc2oc(CC)nc2C)C1	ZINC001024090678	1323122857	/nfs/dbraw/zinc/12/28/57/1323122857.db2.gz	ODEBARYERGSSNZ-MRXNPFEDSA-N	0	3	347.503	3.476	20	30		EGEDHN
C#C[C@](C)(CC)NCC(=O)N1CCC[C@H]1c1ccc(OCC)cc1	ZINC000852099863	1323146423	/nfs/dbraw/zinc/14/64/23/1323146423.db2.gz	CFBYJSMKKVWVTE-AZUAARDMSA-N	0	3	328.456	3.140	20	30		EGEDHN
C=CCCN1CCCC[C@H]1CNC(=O)c1cc2ccncc2s1	ZINC001024479963	1323433181	/nfs/dbraw/zinc/43/31/81/1323433181.db2.gz	VGONDTSQGGGWHG-HNNXBMFYSA-N	0	3	329.469	3.457	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N(C)C1CCN(CCc2ccccn2)CC1	ZINC000931290078	1329086964	/nfs/dbraw/zinc/08/69/64/1329086964.db2.gz	HLTWPCUQESOSKM-QGZVFWFLSA-N	0	3	329.488	3.149	20	30		EGEDHN
C=C(C)CCN1CCCC[C@H]1CNC(=O)c1ncc(Cl)s1	ZINC001024553126	1323494102	/nfs/dbraw/zinc/49/41/02/1323494102.db2.gz	SGWCLEBSZXVEAV-LBPRGKRZSA-N	0	3	327.881	3.347	20	30		EGEDHN
C=C(C)CCN1CCCC[C@@H]1CNC(=O)c1ocnc1C(F)(F)F	ZINC001024576354	1323513868	/nfs/dbraw/zinc/51/38/68/1323513868.db2.gz	RHTZUUYJIVAHGC-GFCCVEGCSA-N	0	3	345.365	3.244	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccc(-n2ccnc2)cc1	ZINC001024576080	1323514119	/nfs/dbraw/zinc/51/41/19/1323514119.db2.gz	PHQNTIIYXJAVPU-IBGZPJMESA-N	0	3	338.455	3.033	20	30		EGEDHN
C=CCCN1CCCC[C@H]1CNC(=O)c1oc(CC(C)C)nc1C	ZINC001024700049	1323614941	/nfs/dbraw/zinc/61/49/41/1323614941.db2.gz	WANHHIGXFNKYDQ-INIZCTEOSA-N	0	3	333.476	3.342	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@@H]1CCOc2ccccc21	ZINC001024712380	1323618620	/nfs/dbraw/zinc/61/86/20/1323618620.db2.gz	WINMZLVIQZARNS-SJLPKXTDSA-N	0	3	328.456	3.100	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cccc2c1ccn2C	ZINC001024712431	1323621227	/nfs/dbraw/zinc/62/12/27/1323621227.db2.gz	XMTWKKHVIAZYGA-MRXNPFEDSA-N	0	3	325.456	3.339	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccncc1C(F)(F)F	ZINC001024738170	1323636881	/nfs/dbraw/zinc/63/68/81/1323636881.db2.gz	QSSSLGBXVPSNQP-ZDUSSCGKSA-N	0	3	341.377	3.261	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccc(O[C@@H](C)CC)cc1	ZINC001024750053	1323653166	/nfs/dbraw/zinc/65/31/66/1323653166.db2.gz	KPKMEBHEERFGBV-HKUYNNGSSA-N	0	3	342.483	3.472	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccsc1C(F)F	ZINC001024780675	1323683672	/nfs/dbraw/zinc/68/36/72/1323683672.db2.gz	APSNDYTVESBVJX-LBPRGKRZSA-N	0	3	326.412	3.293	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1csc2c1CCCC2	ZINC001024790380	1323696029	/nfs/dbraw/zinc/69/60/29/1323696029.db2.gz	HKLVSMWNQJRWRT-HNNXBMFYSA-N	0	3	330.497	3.235	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCCC[C@@H]1CNCc1ccc(Cl)cc1F	ZINC001024901993	1323771959	/nfs/dbraw/zinc/77/19/59/1323771959.db2.gz	GAIICBZLEDPKGP-IUODEOHRSA-N	0	3	337.826	3.109	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCCC[C@H]1CNCc1ccc(OC)nc1	ZINC001025037374	1323840204	/nfs/dbraw/zinc/84/02/04/1323840204.db2.gz	BJBUQTKAKAGBPC-KRWDZBQOSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCCC[C@@H]1CNCc1cncc(F)c1	ZINC001025037428	1323840857	/nfs/dbraw/zinc/84/08/57/1323840857.db2.gz	DIYINYPCXQWNQN-QGZVFWFLSA-N	0	3	333.451	3.294	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@H]1CNCc1cccc(Cl)n1	ZINC001025040430	1323841361	/nfs/dbraw/zinc/84/13/61/1323841361.db2.gz	CMTXCQNBUQRAOU-HNNXBMFYSA-N	0	3	335.879	3.418	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@H]1CNCc1cnn(C(C)(C)C)c1	ZINC001025040790	1323842681	/nfs/dbraw/zinc/84/26/81/1323842681.db2.gz	LWVWBXAYNWSERG-KRWDZBQOSA-N	0	3	346.519	3.321	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc(Cl)o1	ZINC001025199571	1323982812	/nfs/dbraw/zinc/98/28/12/1323982812.db2.gz	XNSZPHBYTPRZNH-GJZGRUSLSA-N	0	3	334.847	3.415	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cccc(C)c1F	ZINC001025234265	1324021643	/nfs/dbraw/zinc/02/16/43/1324021643.db2.gz	GNNSMVPBGXOUOA-ROUUACIJSA-N	0	3	328.431	3.226	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1c(F)cncc1F	ZINC001025238585	1324029158	/nfs/dbraw/zinc/02/91/58/1324029158.db2.gz	SSOBPCCXEMZPDO-HOTGVXAUSA-N	0	3	335.398	3.005	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ncc(C)cc1OC	ZINC001025241152	1324035384	/nfs/dbraw/zinc/03/53/84/1324035384.db2.gz	VBEHYYZLLHXCCY-IAGOWNOFSA-N	0	3	343.471	3.044	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)COC1CCCCC1	ZINC001025245542	1324042915	/nfs/dbraw/zinc/04/29/15/1324042915.db2.gz	NYFRARDIISRLLQ-PMACEKPBSA-N	0	3	346.515	3.205	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1nc(C)c(C)nc1C	ZINC001025251090	1324054039	/nfs/dbraw/zinc/05/40/39/1324054039.db2.gz	PWORHNJEQLUSTE-ROUUACIJSA-N	0	3	342.487	3.047	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc2ncccc2o1	ZINC001025251756	1324056299	/nfs/dbraw/zinc/05/62/99/1324056299.db2.gz	KLDVHDPPEWMEAK-IRXDYDNUSA-N	0	3	339.439	3.473	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1coc(C2CC2)n1	ZINC001025273926	1324090195	/nfs/dbraw/zinc/09/01/95/1324090195.db2.gz	IKDPQFAQVRWWKD-MSOLQXFVSA-N	0	3	341.455	3.034	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccncc1Cl	ZINC001025273924	1324090517	/nfs/dbraw/zinc/09/05/17/1324090517.db2.gz	SJFRXKUZQJFFJM-QZTJIDSGSA-N	0	3	345.874	3.217	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cncc(Cl)c1	ZINC001025276271	1324098044	/nfs/dbraw/zinc/09/80/44/1324098044.db2.gz	IMUKBBXAMSOHJP-DLBZAZTESA-N	0	3	333.863	3.380	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cncc(Cl)c1	ZINC001025278399	1324099373	/nfs/dbraw/zinc/09/93/73/1324099373.db2.gz	SHJUPUWFLMEZCM-QZTJIDSGSA-N	0	3	345.874	3.217	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc(OC)c(C)c1	ZINC001025278089	1324099919	/nfs/dbraw/zinc/09/99/19/1324099919.db2.gz	QTWRSASBQFYCII-RTBURBONSA-N	0	3	340.467	3.096	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ncoc1C1CC1	ZINC001025284420	1324106788	/nfs/dbraw/zinc/10/67/88/1324106788.db2.gz	HAKABVLUVPSRAF-SJORKVTESA-N	0	3	341.455	3.034	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1coc(CCC)n1	ZINC001025288199	1324110589	/nfs/dbraw/zinc/11/05/89/1324110589.db2.gz	JJNZCUIJGZZHEE-ZWKOTPCHSA-N	0	3	343.471	3.110	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)CCc1cccs1	ZINC001025293560	1324120294	/nfs/dbraw/zinc/12/02/94/1324120294.db2.gz	DOMASLRPNOLPOC-ROUUACIJSA-N	0	3	330.497	3.159	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)Cc1ccc(C)s1	ZINC001025301683	1324134969	/nfs/dbraw/zinc/13/49/69/1324134969.db2.gz	OBNVBLXYQOEJHV-RTBURBONSA-N	0	3	344.524	3.468	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cccc2c1CCC2	ZINC001025301635	1324135474	/nfs/dbraw/zinc/13/54/74/1324135474.db2.gz	NJKKLEGLAUQLAK-SFTDATJTSA-N	0	3	336.479	3.268	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc(C)nc1C	ZINC001025302782	1324136270	/nfs/dbraw/zinc/13/62/70/1324136270.db2.gz	XTVJVKGJQXMHPL-PMACEKPBSA-N	0	3	339.483	3.181	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)[C@H]1[C@H]2[C@@H]1[C@@H]1CC[C@H]2C1	ZINC001025304998	1324139062	/nfs/dbraw/zinc/13/90/62/1324139062.db2.gz	SNYKGKPEUKQACX-WZGFBNHNSA-N	0	3	340.511	3.147	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cncc(-c3ccccc3)c2)C1	ZINC001025432957	1324271751	/nfs/dbraw/zinc/27/17/51/1324271751.db2.gz	KVVDATNTAJKVDH-IEBWSBKVSA-N	0	3	347.462	3.212	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(C)c(F)cc2F)C1	ZINC001025455909	1324295963	/nfs/dbraw/zinc/29/59/63/1324295963.db2.gz	MZXNZWGSXFEIOE-HUUCEWRRSA-N	0	3	334.410	3.127	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cccc(C(C)C)n2)C1	ZINC001025473145	1324319802	/nfs/dbraw/zinc/31/98/02/1324319802.db2.gz	ZPCQJOVVDXMMQM-IRXDYDNUSA-N	0	3	327.472	3.059	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cn(CC)c3ccccc23)C1	ZINC001025478167	1324324055	/nfs/dbraw/zinc/32/40/55/1324324055.db2.gz	KKQCBCDMHSNOSF-IRXDYDNUSA-N	0	3	337.467	3.125	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc3c4c(cccc42)CC3)C1	ZINC001025480159	1324326567	/nfs/dbraw/zinc/32/65/67/1324326567.db2.gz	QOWJPFVVRCGYGG-APWZRJJASA-N	0	3	346.474	3.402	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2c(C)[nH]c3ccccc32)C1	ZINC001025480599	1324327036	/nfs/dbraw/zinc/32/70/36/1324327036.db2.gz	XZKDQWMGFVIBOO-NVXWUHKLSA-N	0	3	337.467	3.330	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(C)c3cccnc23)C1	ZINC001025489058	1324339820	/nfs/dbraw/zinc/33/98/20/1324339820.db2.gz	NSBULCMYBRAZET-IAGOWNOFSA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cncc3sccc32)C1	ZINC001025517916	1324361571	/nfs/dbraw/zinc/36/15/71/1324361571.db2.gz	CBCUBMYMQQWQNK-LSDHHAIUSA-N	0	3	341.480	3.150	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)C2CCC(F)(F)CC2)C1	ZINC001025537670	1324382823	/nfs/dbraw/zinc/38/28/23/1324382823.db2.gz	BAFKCCDHWNETHR-ZBFHGGJFSA-N	0	3	326.431	3.052	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2oc(CC(C)C)nc2C)C1	ZINC001025555258	1324403786	/nfs/dbraw/zinc/40/37/86/1324403786.db2.gz	LCPFYBCXIXKQDN-DOTOQJQBSA-N	0	3	345.487	3.035	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(OC)cc2Cl)C1	ZINC001025565011	1324411997	/nfs/dbraw/zinc/41/19/97/1324411997.db2.gz	OPICYJCLNAUMJO-LSDHHAIUSA-N	0	3	348.874	3.202	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc3ccncc3c2)C1	ZINC001025586744	1324428815	/nfs/dbraw/zinc/42/88/15/1324428815.db2.gz	DMHXZUYXRVQMFF-VQIMIIECSA-N	0	3	335.451	3.088	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc3ccncc3c2)C1	ZINC001025586743	1324429057	/nfs/dbraw/zinc/42/90/57/1324429057.db2.gz	DMHXZUYXRVQMFF-QFBILLFUSA-N	0	3	335.451	3.088	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cccc3ccsc32)C1	ZINC001025588409	1324433023	/nfs/dbraw/zinc/43/30/23/1324433023.db2.gz	VPAJGKBITPDOKC-ZBFHGGJFSA-N	0	3	326.465	3.365	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2[nH]ccc2-c2ccccc2)C1	ZINC001025591487	1324437827	/nfs/dbraw/zinc/43/78/27/1324437827.db2.gz	CIWZLYVHQPBOGH-WMZOPIPTSA-N	0	3	335.451	3.145	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(C)c(C)c2Cl)C1	ZINC001025592627	1324440800	/nfs/dbraw/zinc/44/08/00/1324440800.db2.gz	QLMLDFJIWBPSMJ-HZPDHXFCSA-N	0	3	332.875	3.420	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(Cl)ccc2Cl)C1	ZINC001025610088	1324461235	/nfs/dbraw/zinc/46/12/35/1324461235.db2.gz	RIVKXCFYNZUWBX-OLZOCXBDSA-N	0	3	339.266	3.457	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc3cccc(F)c3o2)C1	ZINC001025627974	1324478280	/nfs/dbraw/zinc/47/82/80/1324478280.db2.gz	MDJXATVKCRVIIO-GDBMZVCRSA-N	0	3	342.414	3.426	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2c(CC)oc3ccccc32)C1	ZINC001025630161	1324482263	/nfs/dbraw/zinc/48/22/63/1324482263.db2.gz	PXRJLISFSALQKD-HZPDHXFCSA-N	0	3	338.451	3.459	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2c[nH]c3ccc(F)cc23)C1	ZINC001025635609	1324487753	/nfs/dbraw/zinc/48/77/53/1324487753.db2.gz	SSFXXNAINQPNQM-LSDHHAIUSA-N	0	3	341.430	3.161	20	30		EGEDHN
CC(C)(C)CC(=O)N1C[C@@H]2CC[C@H](NCc3ccccc3C#N)[C@@H]2C1	ZINC001026200752	1324660499	/nfs/dbraw/zinc/66/04/99/1324660499.db2.gz	LIZHSUZBZLWIQD-OTWHNJEPSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H]3CC[C@@H](NCc4nccs4)[C@@H]3C2)CC1	ZINC001026345740	1324742439	/nfs/dbraw/zinc/74/24/39/1324742439.db2.gz	BVNLYTCKDGDVMT-GVDBMIGSSA-N	0	3	345.512	3.216	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CC[C@H]2CN(C(=O)C3CC4(CC4)C3)C[C@H]21	ZINC001026357837	1324750846	/nfs/dbraw/zinc/75/08/46/1324750846.db2.gz	KMDRBRDZLRAZRC-DFQSSKMNSA-N	0	3	349.478	3.075	20	30		EGEDHN
C=C1CCC(C(=O)NC2CCC(NCc3conc3C)CC2)CC1	ZINC001026554211	1324890303	/nfs/dbraw/zinc/89/03/03/1324890303.db2.gz	PMDKKWNFUPMTRB-UHFFFAOYSA-N	0	3	331.460	3.246	20	30		EGEDHN
C=C1CCC(C(=O)NC2CCC(NCc3cnc(C)o3)CC2)CC1	ZINC001026554340	1324890574	/nfs/dbraw/zinc/89/05/74/1324890574.db2.gz	XSIBGJQTXGVTJI-UHFFFAOYSA-N	0	3	331.460	3.246	20	30		EGEDHN
Cc1csc(C(=O)N2CC[C@@H](CNCc3ccccc3C#N)C2)c1	ZINC001026829918	1325038638	/nfs/dbraw/zinc/03/86/38/1325038638.db2.gz	ZWDFVCMTLZOLCB-HNNXBMFYSA-N	0	3	339.464	3.180	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)c2c(C)ccn2C)C1	ZINC000963291895	1325078518	/nfs/dbraw/zinc/07/85/18/1325078518.db2.gz	AEPKATLNSSWLLZ-DLBZAZTESA-N	0	3	349.906	3.403	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001026988692	1325127600	/nfs/dbraw/zinc/12/76/00/1325127600.db2.gz	MXJKVNNDQVJZFU-OAHLLOKOSA-N	0	3	343.446	3.238	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)c2cccnc2C)C1	ZINC000963350084	1325142170	/nfs/dbraw/zinc/14/21/70/1325142170.db2.gz	YFBHNNNLKKGEJM-SJLPKXTDSA-N	0	3	347.890	3.459	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)CC(C)(F)F)C1	ZINC000963355962	1325150937	/nfs/dbraw/zinc/15/09/37/1325150937.db2.gz	AEYCLJDCUOUKDY-KGLIPLIRSA-N	0	3	334.838	3.487	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCN(C(=O)C2CCC(F)CC2)C1	ZINC001027040598	1325175966	/nfs/dbraw/zinc/17/59/66/1325175966.db2.gz	GSOXDILNWNVLIS-MDCZIUGASA-N	0	3	343.446	3.025	20	30		EGEDHN
CN(Cc1ccc(C#N)c(F)c1)[C@H]1CCCN(C(=O)C2CCCC2)C1	ZINC001027268559	1325369891	/nfs/dbraw/zinc/36/98/91/1325369891.db2.gz	SGKMNWPRHWNRFU-SFHVURJKSA-N	0	3	343.446	3.310	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)CC(C)(C)C)C1	ZINC001027302747	1325445879	/nfs/dbraw/zinc/44/58/79/1325445879.db2.gz	KTPHXYFWYVWENP-GOSISDBHSA-N	0	3	327.472	3.417	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC[C@@H](N(C)Cc2ccc(F)c(C#N)c2)C1	ZINC001027305991	1325451185	/nfs/dbraw/zinc/45/11/85/1325451185.db2.gz	WWMATXJMIGLFQJ-WMLDXEAASA-N	0	3	331.435	3.166	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1ccncc1CC)C2	ZINC000964146043	1325482743	/nfs/dbraw/zinc/48/27/43/1325482743.db2.gz	WIVMUDJTGHOLDZ-UHFFFAOYSA-N	0	3	333.863	3.027	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC[C@@H](N(C)Cc2cc3ccccc3o2)C1	ZINC001027335257	1325494687	/nfs/dbraw/zinc/49/46/87/1325494687.db2.gz	FBEYLKALMCZRCR-GOEBONIOSA-N	0	3	325.412	3.015	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)C2CC(F)(F)C2)C1	ZINC001027358615	1325537929	/nfs/dbraw/zinc/53/79/29/1325537929.db2.gz	JMKUDPCQANHNTP-KRWDZBQOSA-N	0	3	347.409	3.026	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)[C@H]2C[C@H]3C[C@H]3C2)C1	ZINC001027537871	1327833139	/nfs/dbraw/zinc/83/31/39/1327833139.db2.gz	RUWZJZDSXMVQIW-NMLBUPMWSA-N	0	3	337.467	3.027	20	30		EGEDHN
CCC(C)(C)C(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001027551017	1327858485	/nfs/dbraw/zinc/85/84/85/1327858485.db2.gz	GTEMZGHEWFDOSE-SFHVURJKSA-N	0	3	327.472	3.417	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2cccc(OCCC)c2)C1	ZINC000966393169	1328289035	/nfs/dbraw/zinc/28/90/35/1328289035.db2.gz	YGRIAZJXZOISBJ-APWZRJJASA-N	0	3	330.472	3.492	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2cc3ccncc3s2)C1	ZINC000966667302	1328371396	/nfs/dbraw/zinc/37/13/96/1328371396.db2.gz	NPOBEARCNCQYFP-ZFWWWQNUSA-N	0	3	329.469	3.313	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2conc2C2CCCC2)C1	ZINC000966672410	1328374987	/nfs/dbraw/zinc/37/49/87/1328374987.db2.gz	WRFYJOUWEKIZTN-PBHICJAKSA-N	0	3	331.460	3.349	20	30		EGEDHN
C#CCCN1CCC[C@@H]1CNC(=O)c1ccccc1CC(C)(C)C	ZINC001027956815	1328426072	/nfs/dbraw/zinc/42/60/72/1328426072.db2.gz	OSGJNVQXSIICQF-GOSISDBHSA-N	0	3	326.484	3.493	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2ccc(-c3cnco3)cc2)C1	ZINC000966946272	1328489885	/nfs/dbraw/zinc/48/98/85/1328489885.db2.gz	WZJYTBNDFMJWMC-CRAIPNDOSA-N	0	3	339.439	3.358	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)CN[C@@H]1CCc2cccc3cccc1c32	ZINC000931807145	1329763051	/nfs/dbraw/zinc/76/30/51/1329763051.db2.gz	SLBAKJNVICJVFO-NQIIRXRSSA-N	0	3	335.451	3.471	20	30		EGEDHN
CN(C)C[C@@H](NC(=O)Nc1sccc1C#N)c1ccc(F)cc1	ZINC000931838356	1329765254	/nfs/dbraw/zinc/76/52/54/1329765254.db2.gz	WKEOHRKUSJDSCQ-CQSZACIVSA-N	0	3	332.404	3.183	20	30		EGEDHN
CN(Cc1ccc(CC#N)cc1)C[C@H]1CCN1C(=O)OC(C)(C)C	ZINC000933467950	1329891624	/nfs/dbraw/zinc/89/16/24/1329891624.db2.gz	QMVWAOWNPWXAJF-QGZVFWFLSA-N	0	3	329.444	3.194	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](C)[C@H](NCc3cc(F)cc(F)c3)C2)C1	ZINC000939102695	1330376837	/nfs/dbraw/zinc/37/68/37/1330376837.db2.gz	KAISFDMHQYSTCK-CXAGYDPISA-N	0	3	334.410	3.258	20	30		EGEDHN
CC1(C(=O)N[C@@H]2CCN(Cc3cccc(C#N)c3)CC2(C)C)CC1	ZINC000940767438	1331183611	/nfs/dbraw/zinc/18/36/11/1331183611.db2.gz	IDJBZSXUNYWFEB-QGZVFWFLSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc3c(C)c(C)[nH]c32)[C@@H](C)C1	ZINC000942180423	1331862717	/nfs/dbraw/zinc/86/27/17/1331862717.db2.gz	GIEAMIOAXORYNA-LIRRHRJNSA-N	0	3	337.467	3.248	20	30		EGEDHN
C[C@H]1CN(Cc2ccc(C#N)cc2)CC[C@H]1NC(=O)Cc1ccccc1	ZINC000942189658	1331870150	/nfs/dbraw/zinc/87/01/50/1331870150.db2.gz	UVUNWCOAKJKYQI-LAUBAEHRSA-N	0	3	347.462	3.128	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(C)n(C(CC)CC)n2)[C@H](C)C1	ZINC000942207298	1331879937	/nfs/dbraw/zinc/87/99/37/1331879937.db2.gz	KYTFBAUFNBXTCK-RHSMWYFYSA-N	0	3	332.492	3.179	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cccc(C(C)C)c2)[C@@H](C)C1	ZINC000942270868	1331892078	/nfs/dbraw/zinc/89/20/78/1331892078.db2.gz	GRBNLZUDYXTZGJ-PXNSSMCTSA-N	0	3	326.484	3.202	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2ccc(CCCC)cc2)[C@@H](C)C1	ZINC000942274827	1331893647	/nfs/dbraw/zinc/89/36/47/1331893647.db2.gz	YLYJGHWALYLRLV-PXNSSMCTSA-N	0	3	326.484	3.032	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(CCCC)cc2)[C@H](C)C1	ZINC000942391021	1331920541	/nfs/dbraw/zinc/92/05/41/1331920541.db2.gz	DOGUJNSSSYZMOX-XLIONFOSSA-N	0	3	326.484	3.493	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc3c4c(cccc42)CC3)[C@H](C)C1	ZINC000942392006	1331921706	/nfs/dbraw/zinc/92/17/06/1331921706.db2.gz	IIBLJUFGZOXRPH-IERDGZPVSA-N	0	3	346.474	3.402	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc3c4c(cccc42)CC3)[C@@H](C)C1	ZINC000942392008	1331921875	/nfs/dbraw/zinc/92/18/75/1331921875.db2.gz	IIBLJUFGZOXRPH-KKSFZXQISA-N	0	3	346.474	3.402	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cn(CC)c3ccccc23)[C@@H](C)C1	ZINC000942394630	1331924049	/nfs/dbraw/zinc/92/40/49/1331924049.db2.gz	SWBUQRVZQUHIPC-YJBOKZPZSA-N	0	3	325.456	3.287	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3ccccc3cc2F)[C@H](C)C1	ZINC000942442911	1331934596	/nfs/dbraw/zinc/93/45/96/1331934596.db2.gz	BGYRZCHFXQNCJV-FOIQADDNSA-N	0	3	338.426	3.442	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc(C(F)F)cc2)[C@@H](C)C1	ZINC000942468104	1331941112	/nfs/dbraw/zinc/94/11/12/1331941112.db2.gz	VURRETQQVJNYNE-WMLDXEAASA-N	0	3	334.410	3.017	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(F)c(Cl)cc2F)[C@H](C)C1	ZINC000942585391	1331991088	/nfs/dbraw/zinc/99/10/88/1331991088.db2.gz	DSSRSIQRBTYLEY-BMIGLBTASA-N	0	3	328.790	3.244	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C(C)(C)c2ccc(Cl)cc2)[C@@H](C)C1	ZINC000942594769	1331994791	/nfs/dbraw/zinc/99/47/91/1331994791.db2.gz	OBFDHUOSPWTVNK-YJBOKZPZSA-N	0	3	346.902	3.468	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(F)c3ccccc23)[C@H](C)C1	ZINC000942938720	1332063101	/nfs/dbraw/zinc/06/31/01/1332063101.db2.gz	MHVWAFWILKFNRN-FOIQADDNSA-N	0	3	338.426	3.442	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(F)cc3cccnc32)[C@@H](C)C1	ZINC000943210780	1332122636	/nfs/dbraw/zinc/12/26/36/1332122636.db2.gz	VWCFAQYBYNHAQV-SUMWQHHRSA-N	0	3	327.403	3.000	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)CC23CC4CC(CC(C4)C2)C3)[C@@H](C)C1	ZINC000944306505	1332368422	/nfs/dbraw/zinc/36/84/22/1332368422.db2.gz	RUWZUXPELYJFRN-AXMIXWAOSA-N	0	3	342.527	3.443	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)CC23CC4CC(CC(C4)C2)C3)[C@H](C)C1	ZINC000944306506	1332368918	/nfs/dbraw/zinc/36/89/18/1332368918.db2.gz	RUWZUXPELYJFRN-GPABEBMESA-N	0	3	342.527	3.443	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2sc(Cl)nc2Cl)[C@H](C)C1	ZINC000944944983	1332459896	/nfs/dbraw/zinc/45/98/96/1332459896.db2.gz	PRBOYUYFBRPSOM-RKDXNWHRSA-N	0	3	334.272	3.076	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2coc(C3CCCCC3)n2)[C@H](C)C1	ZINC000945334223	1332559339	/nfs/dbraw/zinc/55/93/39/1332559339.db2.gz	MHSKMWMCRDPPCO-GDBMZVCRSA-N	0	3	331.460	3.349	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@H]2CN(Cc3ccccc3C#N)C[C@H]2CC1	ZINC000946454838	1332834513	/nfs/dbraw/zinc/83/45/13/1332834513.db2.gz	ZKZHYTICIDOCHR-BGYRXZFFSA-N	0	3	339.483	3.275	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3ccoc3CC)CC[C@@H]2C1	ZINC000946576352	1332856331	/nfs/dbraw/zinc/85/63/31/1332856331.db2.gz	PGAVHFHOERYSTG-GASCZTMLSA-N	0	3	336.863	3.379	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3[nH]c(C)cc3C)CC[C@@H]2C1	ZINC000946645696	1332870121	/nfs/dbraw/zinc/87/01/21/1332870121.db2.gz	XIXCQKBIVDALEJ-IYBDPMFKSA-N	0	3	335.879	3.168	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)C3(C(F)F)CCC3)CC[C@@H]2C1	ZINC000946735183	1332887745	/nfs/dbraw/zinc/88/77/45/1332887745.db2.gz	HSQIQGOGHRLQNE-OKILXGFUSA-N	0	3	346.849	3.345	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@H]3CC[C@@H](F)C3)CC[C@@H]2C1	ZINC000946740114	1332888315	/nfs/dbraw/zinc/88/83/15/1332888315.db2.gz	PYKQYWINCMKJJF-CAOSSQGBSA-N	0	3	328.859	3.048	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)C(C3CC3)C3CC3)CC[C@@H]2C1	ZINC000946856909	1332917164	/nfs/dbraw/zinc/91/71/64/1332917164.db2.gz	SZMSQWCYWSGQOK-CALCHBBNSA-N	0	3	336.907	3.346	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3ccc(C)nc3C)CC[C@@H]2C1	ZINC000946899805	1332927864	/nfs/dbraw/zinc/92/78/64/1332927864.db2.gz	PXKDFVILBHREKF-CALCHBBNSA-N	0	3	347.890	3.235	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2ccccc2)CCN1Cc1cccc(C#N)c1	ZINC000947006360	1332968075	/nfs/dbraw/zinc/96/80/75/1332968075.db2.gz	ZXAXCZZMMQXWIJ-UZLBHIALSA-N	0	3	333.435	3.341	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H]2CCN(Cc3cccc(C#N)c3)[C@H](C)C2)o1	ZINC000947027733	1332980814	/nfs/dbraw/zinc/98/08/14/1332980814.db2.gz	UMCVKRBDSCZKRL-RDTXWAMCSA-N	0	3	337.423	3.243	20	30		EGEDHN
Cc1ccncc1C(=O)N[C@@H]1CCN(Cc2ccc(C#N)cc2)[C@@H](C)C1	ZINC000947163239	1333030984	/nfs/dbraw/zinc/03/09/84/1333030984.db2.gz	SOKVRWSGBUYDJO-QFBILLFUSA-N	0	3	348.450	3.045	20	30		EGEDHN
Cc1cc(CN2CC[C@@H](NC(=O)c3c[nH]c(C#N)c3)C[C@@H]2C)cs1	ZINC000947205440	1333051939	/nfs/dbraw/zinc/05/19/39/1333051939.db2.gz	QLQSKROTCKVILJ-BLLLJJGKSA-N	0	3	342.468	3.039	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc3nccc(C)c3c2)C[C@H]1C	ZINC000947346857	1333098104	/nfs/dbraw/zinc/09/81/04/1333098104.db2.gz	BNMBDYIQEQCQMH-AEFFLSMTSA-N	0	3	335.451	3.149	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cncc(-c3ccccc3)c2)C[C@@H]1C	ZINC000947371535	1333107191	/nfs/dbraw/zinc/10/71/91/1333107191.db2.gz	ZUJQBTWFLBRPND-LAUBAEHRSA-N	0	3	347.462	3.355	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ocnc2-c2ccccc2)C[C@@H]1C	ZINC000947377400	1333108336	/nfs/dbraw/zinc/10/83/36/1333108336.db2.gz	GVSXBUUOXHVKLT-HOCLYGCPSA-N	0	3	325.412	3.110	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc(C)cc2Cl)C[C@@H]1C	ZINC000947459676	1333136735	/nfs/dbraw/zinc/13/67/35/1333136735.db2.gz	OFJHEQVVZGUHGS-DOTOQJQBSA-N	0	3	332.875	3.183	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)C2(F)CCCC2)CCN1Cc1cccc(C#N)c1	ZINC000947464144	1333138239	/nfs/dbraw/zinc/13/82/39/1333138239.db2.gz	RPOAHLBDVJRTBT-QAPCUYQASA-N	0	3	343.446	3.310	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2sc(C)nc2CC(C)C)C[C@H]1C	ZINC000947506303	1333149412	/nfs/dbraw/zinc/14/94/12/1333149412.db2.gz	NLASSHRBISRVPS-GDBMZVCRSA-N	0	3	347.528	3.256	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2nc3ccccc3cc2C)C[C@H]1C	ZINC000947559123	1333172051	/nfs/dbraw/zinc/17/20/51/1333172051.db2.gz	GPIRRHQBFHJNET-SJLPKXTDSA-N	0	3	335.451	3.149	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc(C3CCC3)cc2)C[C@H]1C	ZINC000947584023	1333181902	/nfs/dbraw/zinc/18/19/02/1333181902.db2.gz	COYXXGBIOUEVHB-DYESRHJHSA-N	0	3	338.495	3.489	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3cccnc3C)[C@@H](C)C2)cc1	ZINC000947611689	1333191969	/nfs/dbraw/zinc/19/19/69/1333191969.db2.gz	OVLVPZMBLRBQFL-KKSFZXQISA-N	0	3	347.462	3.154	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(F)c(Cl)c2F)C[C@H]1C	ZINC000947693661	1333227679	/nfs/dbraw/zinc/22/76/79/1333227679.db2.gz	QAHPCCFPTMVRLQ-VXGBXAGGSA-N	0	3	340.801	3.224	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3cncc(C)c3)[C@@H](C)C2)C1	ZINC000947702608	1333232525	/nfs/dbraw/zinc/23/25/25/1333232525.db2.gz	QFZVPOBMHPOVTC-WMZOPIPTSA-N	0	3	327.472	3.215	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C(F)F)c(F)c2)C[C@@H]1C	ZINC000947720075	1333239918	/nfs/dbraw/zinc/23/99/18/1333239918.db2.gz	XKXHTORKWDUWMD-GXTWGEPZSA-N	0	3	338.373	3.369	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C(C)(C)c2ccccc2F)C[C@H]1C	ZINC000947811365	1333268829	/nfs/dbraw/zinc/26/88/29/1333268829.db2.gz	ZHPHERABDJBABC-CVEARBPZSA-N	0	3	330.447	3.096	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ncc(Cl)cc2Cl)C[C@@H]1C	ZINC000947857163	1333282338	/nfs/dbraw/zinc/28/23/38/1333282338.db2.gz	HPJNPPQDROAGQQ-CMPLNLGQSA-N	0	3	328.243	3.157	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnoc2-c2ccccc2)C[C@H]1C	ZINC000947878023	1333288225	/nfs/dbraw/zinc/28/82/25/1333288225.db2.gz	JJSWMUJCPAXMFL-ZBFHGGJFSA-N	0	3	325.412	3.110	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnn(CCCC)c2CC)C[C@H]1C	ZINC000947908215	1333302336	/nfs/dbraw/zinc/30/23/36/1333302336.db2.gz	QCTARMSTLOASEP-CVEARBPZSA-N	0	3	332.492	3.014	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(F)c(F)cc2Cl)C[C@@H]1C	ZINC000947999008	1333337258	/nfs/dbraw/zinc/33/72/58/1333337258.db2.gz	RZYBESCCUOWXPT-WDEREUQCSA-N	0	3	328.790	3.387	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccc(COC(C)C)cc2)C[C@@H]1C	ZINC000948015637	1333342714	/nfs/dbraw/zinc/34/27/14/1333342714.db2.gz	GBJVOZAELSPASM-QFBILLFUSA-N	0	3	330.472	3.380	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(Cl)cc3c2OCC3)C[C@H]1C	ZINC000948079129	1333368729	/nfs/dbraw/zinc/36/87/29/1333368729.db2.gz	UCRXKVJDYHISEL-DOMZBBRYSA-N	0	3	334.847	3.044	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccccc2CC(C)C)C[C@H]1C	ZINC000948082459	1333369340	/nfs/dbraw/zinc/36/93/40/1333369340.db2.gz	DBMFVGYXEQKKDD-IEBWSBKVSA-N	0	3	326.484	3.491	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2sc(C(C)(C)C)nc2C)C[C@@H]1C	ZINC000948091182	1333372367	/nfs/dbraw/zinc/37/23/67/1333372367.db2.gz	VDLIZTACCIEXJM-ZFWWWQNUSA-N	0	3	347.528	3.355	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2oc(C(F)F)cc2C)CC1	ZINC000948451832	1333531520	/nfs/dbraw/zinc/53/15/20/1333531520.db2.gz	FMYDGQRHNVZGPV-AWEZNQCLSA-N	0	3	338.398	3.475	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cc(F)c(C)cc2F)CC1	ZINC000948456973	1333532989	/nfs/dbraw/zinc/53/29/89/1333532989.db2.gz	QATHDGRYFCRPCV-HNNXBMFYSA-N	0	3	334.410	3.223	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2c(C)occ2C(F)(F)F)CC1	ZINC000948621657	1333600824	/nfs/dbraw/zinc/60/08/24/1333600824.db2.gz	TYNDTYJVXKYHIC-ZDUSSCGKSA-N	0	3	342.361	3.167	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2ccccc2-n2cccc2)CC1	ZINC000948743337	1333655733	/nfs/dbraw/zinc/65/57/33/1333655733.db2.gz	RNHVGFHMTXLKPZ-SFHVURJKSA-N	0	3	335.451	3.037	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)[C@H]2CCCC(F)(F)C2)CC1	ZINC000948766151	1333668897	/nfs/dbraw/zinc/66/88/97/1333668897.db2.gz	HFWYFOYZHUFNJG-HOTGVXAUSA-N	0	3	326.431	3.148	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cc(F)cc(Cl)c2)CC1	ZINC000948805066	1333687648	/nfs/dbraw/zinc/68/76/48/1333687648.db2.gz	VLUCYQXFNDJMSQ-QGZVFWFLSA-N	0	3	336.838	3.429	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cccc(F)c2Cl)CC1	ZINC000948808375	1333690165	/nfs/dbraw/zinc/69/01/65/1333690165.db2.gz	FYFCMUOSQJLFOG-CQSZACIVSA-N	0	3	336.838	3.429	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2ccn(C(CC)CC)n2)CC1	ZINC000948833448	1333703408	/nfs/dbraw/zinc/70/34/08/1333703408.db2.gz	TWOCWEIYRUPIHE-SFHVURJKSA-N	0	3	344.503	3.194	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccc(C)s2)CC1	ZINC000948844705	1333706495	/nfs/dbraw/zinc/70/64/95/1333706495.db2.gz	GXQFLBYXVMTRAZ-KZNAEPCWSA-N	0	3	344.524	3.496	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@H]2c3ccccc3CCN2CC(C)C)c1	ZINC000948959613	1333748782	/nfs/dbraw/zinc/74/87/82/1333748782.db2.gz	ZXMDPERJRJGNHW-NRFANRHFSA-N	0	3	347.462	3.048	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@H]1CNC(=O)c1[nH]cnc1C	ZINC000948990060	1333762488	/nfs/dbraw/zinc/76/24/88/1333762488.db2.gz	YBYXUPNLUYPJMX-GOSISDBHSA-N	0	3	338.455	3.014	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@]1(C)CCC[C@H]1CC)CCO2	ZINC000949124155	1333781145	/nfs/dbraw/zinc/78/11/45/1333781145.db2.gz	RRUNNPOKPVUBMX-MJGOQNOKSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@]1(C)CCC[C@@H]1CC)CCO2	ZINC000949124152	1333781207	/nfs/dbraw/zinc/78/12/07/1333781207.db2.gz	RRUNNPOKPVUBMX-HKUYNNGSSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C[C@@H]3CCC[C@@H]3C)CC2)C1	ZINC000949369939	1333832504	/nfs/dbraw/zinc/83/25/04/1333832504.db2.gz	HPKYCRLJXASIJD-ROUUACIJSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C[C@@H]3CC=CCC3)CC2)C1	ZINC000949437060	1333847248	/nfs/dbraw/zinc/84/72/48/1333847248.db2.gz	RGWKVGMHOYWBPS-GOSISDBHSA-N	0	3	332.488	3.002	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)CC3CC(C)(C)C3)CC2)C1	ZINC000949451234	1333850485	/nfs/dbraw/zinc/85/04/85/1333850485.db2.gz	UZKDJVXDDALRLJ-UHFFFAOYSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@H]3CCC[C@@H](C)C3)CC2)C1	ZINC000949455232	1333851984	/nfs/dbraw/zinc/85/19/84/1333851984.db2.gz	XQEGHNDCOYBUMX-MOPGFXCFSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@@]3(C)CC=C(C)CC3)CC2)C1	ZINC000949529470	1333868263	/nfs/dbraw/zinc/86/82/63/1333868263.db2.gz	VPMFUUIYZFKTQE-FQEVSTJZSA-N	0	3	346.515	3.392	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2cccc(-n3cccc3)c2)C1	ZINC000967268212	1335681656	/nfs/dbraw/zinc/68/16/56/1335681656.db2.gz	CVZQAXAIDOAIQC-PXNSSMCTSA-N	0	3	337.467	3.494	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)Cn2c(C)cc3ccccc32)C1	ZINC000967275141	1335684623	/nfs/dbraw/zinc/68/46/23/1335684623.db2.gz	UTIIATWJWQOPLW-VQIMIIECSA-N	0	3	339.483	3.352	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)Cn2c(C)cc3ccccc32)C1	ZINC000967275140	1335684805	/nfs/dbraw/zinc/68/48/05/1335684805.db2.gz	UTIIATWJWQOPLW-QFBILLFUSA-N	0	3	339.483	3.352	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cc(C3CC3)oc2C2CC2)C1	ZINC000967418539	1335732754	/nfs/dbraw/zinc/73/27/54/1335732754.db2.gz	BCMZQCKRCKTQJJ-KDOFPFPSSA-N	0	3	340.467	3.498	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)C2(c3cccc(C)c3)CCC2)C1	ZINC000967660731	1335802833	/nfs/dbraw/zinc/80/28/33/1335802833.db2.gz	XLFKMNWWXBBBOR-AZUAARDMSA-N	0	3	338.495	3.267	20	30		EGEDHN
C=C(C)CCN1CC[C@H](C)[C@H](NC(=O)c2scnc2C2CC2)C1	ZINC000968399654	1335919278	/nfs/dbraw/zinc/91/92/78/1335919278.db2.gz	GUHXUTIVZCEPRG-DZGCQCFKSA-N	0	3	333.501	3.427	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2oc(CC(C)C)nc2C)C1	ZINC000968401631	1335920989	/nfs/dbraw/zinc/92/09/89/1335920989.db2.gz	ZKFWHBOASUNLAE-ZBFHGGJFSA-N	0	3	333.476	3.198	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)Cc2cccc(OCCC)c2)C1	ZINC000968517008	1335949917	/nfs/dbraw/zinc/94/99/17/1335949917.db2.gz	HLOYYJVXZAXOBV-FXAWDEMLSA-N	0	3	344.499	3.421	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)Cc2c[nH]c3cccc(C)c23)C1	ZINC000968544878	1335958385	/nfs/dbraw/zinc/95/83/85/1335958385.db2.gz	VZIDRSSVZHIJRL-BEFAXECRSA-N	0	3	339.483	3.422	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2cc(Cl)cc(Cl)c2)C1	ZINC000968583923	1335972944	/nfs/dbraw/zinc/97/29/44/1335972944.db2.gz	RBXHVLRUOLHUHF-LRDDRELGSA-N	0	3	339.266	3.457	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)CC23CC4CC(CC(C4)C2)C3)C1	ZINC000968584453	1335973801	/nfs/dbraw/zinc/97/38/01/1335973801.db2.gz	XFSVKFGWQRMVKT-AXMIXWAOSA-N	0	3	342.527	3.443	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC000968584714	1335974425	/nfs/dbraw/zinc/97/44/25/1335974425.db2.gz	ZWDWRYDUDVTKDW-VQIMIIECSA-N	0	3	326.484	3.448	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)Cc2ccc(OCC)cc2)C1	ZINC000968618678	1335984820	/nfs/dbraw/zinc/98/48/20/1335984820.db2.gz	HWLXYJSXEGLNRC-VQIMIIECSA-N	0	3	330.472	3.031	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)Cc2ccc3c(c2)CCC3)C1	ZINC000968631013	1335990323	/nfs/dbraw/zinc/99/03/23/1335990323.db2.gz	FCZFKBHXLFWLRD-JXFKEZNVSA-N	0	3	326.484	3.121	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)Cc2nsc3ccccc32)C1	ZINC000968668150	1336002608	/nfs/dbraw/zinc/00/26/08/1336002608.db2.gz	AEADTNMBGUGZEE-RHSMWYFYSA-N	0	3	343.496	3.242	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)Cc2nsc3ccccc32)C1	ZINC000968668152	1336002745	/nfs/dbraw/zinc/00/27/45/1336002745.db2.gz	AEADTNMBGUGZEE-YOEHRIQHSA-N	0	3	343.496	3.242	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2ccc(CN(CC)CC)o2)C1	ZINC000968688018	1336011670	/nfs/dbraw/zinc/01/16/70/1336011670.db2.gz	JGWYIBYCOWUYGQ-SJLPKXTDSA-N	0	3	347.503	3.138	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2ccc(CN(CC)CC)o2)C1	ZINC000968688017	1336011844	/nfs/dbraw/zinc/01/18/44/1336011844.db2.gz	JGWYIBYCOWUYGQ-FUHWJXTLSA-N	0	3	347.503	3.138	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)C2(c3ccccc3OC)CC2)C1	ZINC000968706588	1336018801	/nfs/dbraw/zinc/01/88/01/1336018801.db2.gz	RNEQXDWUUZLNHA-WMZOPIPTSA-N	0	3	342.483	3.130	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccc(C(C)(F)F)cc2)C1	ZINC000968710644	1336019610	/nfs/dbraw/zinc/01/96/10/1336019610.db2.gz	RWAROMGJJNGYGA-RHSMWYFYSA-N	0	3	334.410	3.262	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1csc([C@H]2CCCO2)n1	ZINC000968856110	1336069841	/nfs/dbraw/zinc/06/98/41/1336069841.db2.gz	DYSSEMBXSUKQFP-GOEBONIOSA-N	0	3	349.500	3.155	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cc(C)c(OC)c(C)c1	ZINC000968869092	1336073045	/nfs/dbraw/zinc/07/30/45/1336073045.db2.gz	IAJZVHVKZOCMDA-SFHVURJKSA-N	0	3	330.472	3.472	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccoc1C(F)(F)F	ZINC000968875375	1336075508	/nfs/dbraw/zinc/07/55/08/1336075508.db2.gz	ZJDQYFHMCIDUNM-GFCCVEGCSA-N	0	3	330.350	3.459	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)[C@H]1CCCN1c1ccccc1	ZINC000968882265	1336078734	/nfs/dbraw/zinc/07/87/34/1336078734.db2.gz	KPAAFCXMBHBQPQ-WOJBJXKFSA-N	0	3	341.499	3.202	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@@H]2CCCCCN2CC#CC)cc1	ZINC000968923182	1336090577	/nfs/dbraw/zinc/09/05/77/1336090577.db2.gz	MUJDEEGUAYRJBF-IBGZPJMESA-N	0	3	340.467	3.249	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccn(C(CC)CC)n1	ZINC000969057033	1336131530	/nfs/dbraw/zinc/13/15/30/1336131530.db2.gz	QKGYUNHBPKCBAT-QGZVFWFLSA-N	0	3	332.492	3.405	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccncc1C(F)(F)F	ZINC000969101264	1336143616	/nfs/dbraw/zinc/14/36/16/1336143616.db2.gz	WPHWCIXMPJMNTP-CYBMUJFWSA-N	0	3	341.377	3.261	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccc2ncsc2c1	ZINC000969133503	1336155370	/nfs/dbraw/zinc/15/53/70/1336155370.db2.gz	NYNBCMWJEDUSOL-HNNXBMFYSA-N	0	3	329.469	3.457	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1cnc(C)nc1C1CC1	ZINC000969137388	1336157951	/nfs/dbraw/zinc/15/79/51/1336157951.db2.gz	ZBIWQJSQPRYILU-KRWDZBQOSA-N	0	3	342.487	3.213	20	30		EGEDHN
Cc1cccc([C@H](C)N2CC([C@H](C)NC(=O)c3cc(C#N)c[nH]3)C2)c1	ZINC000969465770	1336214892	/nfs/dbraw/zinc/21/48/92/1336214892.db2.gz	GYOPQSNHHXGIHC-GJZGRUSLSA-N	0	3	336.439	3.006	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@H](NCc2ccc(OC)c(F)c2)C1	ZINC000969830010	1336251751	/nfs/dbraw/zinc/25/17/51/1336251751.db2.gz	CKDCEONJQCMESP-BEFAXECRSA-N	0	3	334.435	3.127	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H](C)C1CN(Cc2ccc(C)cc2)C1	ZINC000969842150	1336253460	/nfs/dbraw/zinc/25/34/60/1336253460.db2.gz	NXSXKTWLLJLEEL-QGZVFWFLSA-N	0	3	337.467	3.233	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N[C@@H](C)C1CN(CC[C@@H](C)F)C1	ZINC000969990780	1336269854	/nfs/dbraw/zinc/26/98/54/1336269854.db2.gz	ULXMVVUZCCUGIZ-CABCVRRESA-N	0	3	334.435	3.050	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)c2cc3c([nH]2)c(F)ccc3C)C1	ZINC000970004052	1336270980	/nfs/dbraw/zinc/27/09/80/1336270980.db2.gz	HBZHLBZJZKVMNL-ZDUSSCGKSA-N	0	3	329.419	3.242	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2)C1	ZINC000970567003	1336322372	/nfs/dbraw/zinc/32/23/72/1336322372.db2.gz	NFULSLMUFFYVRL-DOPJRALCSA-N	0	3	332.875	3.456	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)c2[nH]c3ccc(C)cc3c2C)C1	ZINC000970674264	1336332291	/nfs/dbraw/zinc/33/22/91/1336332291.db2.gz	XTRAXTUHSQTHLO-OAHLLOKOSA-N	0	3	325.456	3.411	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)c2ccc(N(CC)CC)cc2)C1	ZINC000970794268	1336337875	/nfs/dbraw/zinc/33/78/75/1336337875.db2.gz	DOLSUBGKDGWBMS-MRXNPFEDSA-N	0	3	329.488	3.159	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)[C@H]2CCc3c2cccc3Cl)CC1	ZINC001005723505	1336396952	/nfs/dbraw/zinc/39/69/52/1336396952.db2.gz	RQWQHMOWORFQJX-KRWDZBQOSA-N	0	3	332.875	3.479	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cc(-c3ccco3)on2)CC1	ZINC001005794110	1336402485	/nfs/dbraw/zinc/40/24/85/1336402485.db2.gz	DGAZGXBEOTXTIC-UHFFFAOYSA-N	0	3	329.400	3.047	20	30		EGEDHN
CN(C(=O)[C@@H]1C[C@H]1C1CC1)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001006112750	1336453983	/nfs/dbraw/zinc/45/39/83/1336453983.db2.gz	KOWKPPBWQMDTMA-VQTJNVASSA-N	0	3	337.467	3.027	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)[C@@]2(C)CCCc3ccccc32)CC1	ZINC001006144009	1336458644	/nfs/dbraw/zinc/45/86/44/1336458644.db2.gz	CDCJHYYMTBZNTG-NRFANRHFSA-N	0	3	326.484	3.389	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cnoc2-c2ccccc2)CC1	ZINC001006232648	1336472945	/nfs/dbraw/zinc/47/29/45/1336472945.db2.gz	MNJWLLIXGNLZHW-UHFFFAOYSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cc(C(F)(F)F)ccn2)CC1	ZINC001006236200	1336473790	/nfs/dbraw/zinc/47/37/90/1336473790.db2.gz	FZMWTOYOSKDVCL-UHFFFAOYSA-N	0	3	341.377	3.213	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccnc(C3CCCC3)n2)CC1	ZINC001006235195	1336474043	/nfs/dbraw/zinc/47/40/43/1336474043.db2.gz	LKFSKAFXLJABSU-UHFFFAOYSA-N	0	3	342.487	3.247	20	30		EGEDHN
CC[C@@H](c1ccccc1)N1CCC[C@H](NC(=O)c2cc(C#N)c[nH]2)C1	ZINC001007031027	1336628353	/nfs/dbraw/zinc/62/83/53/1336628353.db2.gz	UOHPBKVXRUBEKP-HKUYNNGSSA-N	0	3	336.439	3.232	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2ccc(-c3ccncc3)o2)C1	ZINC001007494377	1336657082	/nfs/dbraw/zinc/65/70/82/1336657082.db2.gz	XNRKHUZJPKYZHT-INIZCTEOSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=C(C)CCN1CCC[C@H](NC(=O)c2nc(Cl)sc2C)C1	ZINC001007888960	1336726832	/nfs/dbraw/zinc/72/68/32/1336726832.db2.gz	GXQPTDFYACJDOE-LBPRGKRZSA-N	0	3	327.881	3.265	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2cc(F)c(Cl)cc2F)C1	ZINC001008364225	1336834818	/nfs/dbraw/zinc/83/48/18/1336834818.db2.gz	IWRCRNAOQGKLEQ-NSHDSACASA-N	0	3	328.790	3.389	20	30		EGEDHN
C#CCCN1CCC[C@@H](NC(=O)C(C)(C)c2ccc(Cl)cc2)C1	ZINC001008370096	1336836735	/nfs/dbraw/zinc/83/67/35/1336836735.db2.gz	HSPLHPALUMDLFI-QGZVFWFLSA-N	0	3	332.875	3.222	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CCN([C@@H]2CCc3ccccc32)C1	ZINC001014731021	1337890406	/nfs/dbraw/zinc/89/04/06/1337890406.db2.gz	HSOULKZBKOWKID-IEBWSBKVSA-N	0	3	335.451	3.166	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)[C@@H]2C[C@H]2c2sccc2C)CC1	ZINC001016620033	1338667113	/nfs/dbraw/zinc/66/71/13/1338667113.db2.gz	GBSDMNIOFYJNBJ-ZACQAIPSSA-N	0	3	342.508	3.154	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2scc(C)c2Cl)CC1	ZINC001016639983	1338673795	/nfs/dbraw/zinc/67/37/95/1338673795.db2.gz	FIDSFNFUFGNCPE-CYBMUJFWSA-N	0	3	336.888	3.318	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cccc3c(C)c(C)[nH]c32)CC1	ZINC001016690320	1338692080	/nfs/dbraw/zinc/69/20/80/1338692080.db2.gz	IUYCQGKJYAMUMD-LJQANCHMSA-N	0	3	349.478	3.392	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)Cc2ccc(F)cc2Cl)CC1	ZINC001016810153	1338734178	/nfs/dbraw/zinc/73/41/78/1338734178.db2.gz	HXVKBDSKKKHHGU-KRWDZBQOSA-N	0	3	348.849	3.016	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccccc2C2(C)CC2)CC1	ZINC001016821342	1338738920	/nfs/dbraw/zinc/73/89/20/1338738920.db2.gz	ZWOYLPCVEBLGDH-LJQANCHMSA-N	0	3	336.479	3.346	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)[C@H]2[C@@H]3CCCCCC[C@@H]32)CC1	ZINC001016847237	1338746386	/nfs/dbraw/zinc/74/63/86/1338746386.db2.gz	KPMVBIFXQNCIOO-ZSYWTGECSA-N	0	3	328.500	3.197	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2)CC1	ZINC001016866322	1338752520	/nfs/dbraw/zinc/75/25/20/1338752520.db2.gz	FTTPYLAPJZVINP-RCCFBDPRSA-N	0	3	342.870	3.047	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)C[C@H]2CCCc3ccccc32)CC1	ZINC001016940635	1338777385	/nfs/dbraw/zinc/77/73/85/1338777385.db2.gz	SRGRPHRBJWXNCK-QUCCMNQESA-N	0	3	336.479	3.101	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC[C@@H](CN(C)Cc3cccnc3)C2)cc1	ZINC001017174708	1338919175	/nfs/dbraw/zinc/91/91/75/1338919175.db2.gz	BIZBULXEQQRFOG-FQEVSTJZSA-N	0	3	347.462	3.047	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H](CN(C)Cc2ocnc2C)C1	ZINC001017179301	1338923196	/nfs/dbraw/zinc/92/31/96/1338923196.db2.gz	HYXHSWBPCHASBA-INIZCTEOSA-N	0	3	333.476	3.256	20	30		EGEDHN
CC1CCC(CN2C[C@H]3CC[C@@H](C2)N3C(=O)c2c[nH]c(C#N)c2)CC1	ZINC001017489843	1339357050	/nfs/dbraw/zinc/35/70/50/1339357050.db2.gz	KWZXGRLOJIEFQH-GNSZPUGASA-N	0	3	340.471	3.001	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C1(c2ccc(F)cc2)CC1	ZINC001017600514	1339375409	/nfs/dbraw/zinc/37/54/09/1339375409.db2.gz	MQMHLKACXFGBHA-KDURUIRLSA-N	0	3	342.458	3.499	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)CCc1ccccc1OCC	ZINC001017711268	1339398131	/nfs/dbraw/zinc/39/81/31/1339398131.db2.gz	HVSZAHJHEIAWIO-KDURUIRLSA-N	0	3	342.483	3.269	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CCc2cc(F)ccc21	ZINC001017738888	1339407937	/nfs/dbraw/zinc/40/79/37/1339407937.db2.gz	AXAXYABZNLFPLB-WSTZPKSXSA-N	0	3	342.458	3.497	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1CCCC(F)(F)C1	ZINC001017931841	1339457608	/nfs/dbraw/zinc/45/76/08/1339457608.db2.gz	WFZYFXFWWUZRMK-HRCADAONSA-N	0	3	326.431	3.453	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1c[nH]c2ccc(F)cc12	ZINC001017994652	1339477502	/nfs/dbraw/zinc/47/75/02/1339477502.db2.gz	BEKIQRRVGIUNNU-CALCHBBNSA-N	0	3	341.430	3.101	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC[C@H](NCc2sc3ccccc3c2Cl)C1	ZINC001018617141	1339683138	/nfs/dbraw/zinc/68/31/38/1339683138.db2.gz	FLUVWGYXKGPLDD-RYUDHWBXSA-N	0	3	347.871	3.405	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)C3=CCCCCC3)C2)s1	ZINC001018762034	1339720979	/nfs/dbraw/zinc/72/09/79/1339720979.db2.gz	FMUKQAOQHAEMAU-HNNXBMFYSA-N	0	3	329.469	3.201	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@@H]2CCCN2Cc2ccc(C)c(C)c2)c1	ZINC001028127346	1340446199	/nfs/dbraw/zinc/44/61/99/1340446199.db2.gz	VUTLGEJSBZNSSF-NRFANRHFSA-N	0	3	347.462	3.074	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NC[C@@H]1CCCN1Cc1csc(C)c1	ZINC001028195328	1340479137	/nfs/dbraw/zinc/47/91/37/1340479137.db2.gz	NRHKBUDUYDBKDR-BZSNNMDCSA-N	0	3	348.512	3.118	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCCN2Cc2ccccc2CC)cn1	ZINC001028271330	1340524540	/nfs/dbraw/zinc/52/45/40/1340524540.db2.gz	FKGPNEIYRBOBGH-NRFANRHFSA-N	0	3	347.462	3.020	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1cccc(C(F)(F)F)c1	ZINC001028280560	1340534708	/nfs/dbraw/zinc/53/47/08/1340534708.db2.gz	OXOXVANMGKZYRZ-HNNXBMFYSA-N	0	3	326.362	3.476	20	30		EGEDHN
C#CCCN1CCC[C@H]1CNC(=O)c1ccc(Cl)c(Cl)c1	ZINC001028284132	1340538899	/nfs/dbraw/zinc/53/88/99/1340538899.db2.gz	ZCLQFBXLMCPQIT-ZDUSSCGKSA-N	0	3	325.239	3.211	20	30		EGEDHN
Cc1coc(C)c1C(=O)NC[C@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC001028515669	1340680696	/nfs/dbraw/zinc/68/06/96/1340680696.db2.gz	LIPKPSOOIXGMRN-GOSISDBHSA-N	0	3	337.423	3.020	20	30		EGEDHN
Cc1csc(C(=O)NC[C@H]2CCN(Cc3cccc(C#N)c3)C2)c1	ZINC001028528995	1340689523	/nfs/dbraw/zinc/68/95/23/1340689523.db2.gz	TWWCFYMGZXZCHF-QGZVFWFLSA-N	0	3	339.464	3.180	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCN(Cc3ccc(F)cc3)C2)cc1	ZINC001028730495	1340778637	/nfs/dbraw/zinc/77/86/37/1340778637.db2.gz	KCELIEGCXSKLAY-GOSISDBHSA-N	0	3	336.410	3.059	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](CNC(=O)c3cc[nH]c3C3CC3)C2)cc1	ZINC001028764713	1340798755	/nfs/dbraw/zinc/79/87/55/1340798755.db2.gz	LDYYZMUFSLUCCE-KRWDZBQOSA-N	0	3	348.450	3.016	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CCN(Cc3cccc(C#N)c3)C2)CC1	ZINC001028780973	1340812339	/nfs/dbraw/zinc/81/23/39/1340812339.db2.gz	PKGPWAHSYACKRD-LJQANCHMSA-N	0	3	337.467	3.243	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@H]2CCN(Cc3cccc(C#N)c3)C2)cc1	ZINC001028948049	1340890966	/nfs/dbraw/zinc/89/09/66/1340890966.db2.gz	DWRWUUYMMBDENA-LJQANCHMSA-N	0	3	333.435	3.119	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)c2ccccc2-c2ccccc2)C1	ZINC001028968751	1340896707	/nfs/dbraw/zinc/89/67/07/1340896707.db2.gz	ZSYUMOFVUHYXGJ-SFHVURJKSA-N	0	3	332.447	3.429	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H](CNC(=O)C3CCC=CCC3)C2)c1	ZINC001028986757	1340901435	/nfs/dbraw/zinc/90/14/35/1340901435.db2.gz	QFKHZHIKOVMDPN-LJQANCHMSA-N	0	3	337.467	3.243	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC([C@@H](C)NCc2cc(F)ccc2C#N)CC1	ZINC001029054072	1340919974	/nfs/dbraw/zinc/91/99/74/1340919974.db2.gz	OWWQRTPOOCNZJC-HUUCEWRRSA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)C1CCN(C(=O)C2=CCCC2)CC1	ZINC001029082125	1340926703	/nfs/dbraw/zinc/92/67/03/1340926703.db2.gz	ZNCMAEOQURUTLO-INIZCTEOSA-N	0	3	337.467	3.385	20	30		EGEDHN
C[C@H](NCc1cc(F)ccc1C#N)C1CCN(C(=O)[C@H]2C[C@@H]2C)CC1	ZINC001029130310	1340938059	/nfs/dbraw/zinc/93/80/59/1340938059.db2.gz	VMVGXCZWUIAZDB-NJSLBKSFSA-N	0	3	343.446	3.070	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC([C@@H](C)NCc3ocnc3C)CC2)C1	ZINC001029142845	1340941736	/nfs/dbraw/zinc/94/17/36/1340941736.db2.gz	ZDOXBWYBIOTBPL-CQSZACIVSA-N	0	3	331.460	3.056	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)C1CCN(C(=O)C(C)(C)C)CC1	ZINC001029167663	1340947251	/nfs/dbraw/zinc/94/72/51/1340947251.db2.gz	IOVFBDPYBATCOI-OAHLLOKOSA-N	0	3	327.472	3.321	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N1C[C@H]2CC[C@@H](C1)N2CC1=CCCCC1	ZINC001029311758	1340970274	/nfs/dbraw/zinc/97/02/74/1340970274.db2.gz	CJCWXPCHLCLQFN-WCIQWLHISA-N	0	3	344.499	3.143	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CC[C@@H](C1)N2C[C@@H](OC)C1CCCC1	ZINC001029421833	1340986238	/nfs/dbraw/zinc/98/62/38/1340986238.db2.gz	LQCRKRQJCBEUGP-FGTMMUONSA-N	0	3	334.504	3.079	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CC[C@@H](C1)N2C[C@H](OC)C1CCCC1	ZINC001029456990	1340994594	/nfs/dbraw/zinc/99/45/94/1340994594.db2.gz	WAKOWYUSNOPOOG-JTJHWIPRSA-N	0	3	348.531	3.469	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](CN(C)Cc2c(C)noc2CC)C1	ZINC001029800251	1341077097	/nfs/dbraw/zinc/07/70/97/1341077097.db2.gz	NNUBIYTZYLXMJM-MRXNPFEDSA-N	0	3	347.503	3.428	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](CN(C)Cc3c(C)noc3C)C2)CC1	ZINC001029826719	1341087630	/nfs/dbraw/zinc/08/76/30/1341087630.db2.gz	UTGDBGOXWZUDSD-KRWDZBQOSA-N	0	3	345.487	3.318	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](CN(C)Cc3cccc(Cl)n3)C2)C1	ZINC001029836794	1341092666	/nfs/dbraw/zinc/09/26/66/1341092666.db2.gz	VEQKWAYVWKOBTF-OAHLLOKOSA-N	0	3	347.890	3.372	20	30		EGEDHN
C#CCCN1CCC[C@@H](N(Cc2ccccc2)C(=O)c2cccn2C)C1	ZINC001029917077	1341117354	/nfs/dbraw/zinc/11/73/54/1341117354.db2.gz	HULQSGCYXRYJHM-HXUWFJFHSA-N	0	3	349.478	3.155	20	30		EGEDHN
CC(C)=CC(=O)N1CCC(CN(C)Cc2cc(C#N)ccc2F)CC1	ZINC001029929274	1341124362	/nfs/dbraw/zinc/12/43/62/1341124362.db2.gz	QLJVBGMLBZEVPY-UHFFFAOYSA-N	0	3	343.446	3.334	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](NC(=O)c2cccc3nc(C)[nH]c32)CC[C@H]1C	ZINC001071968393	1355050392	/nfs/dbraw/zinc/05/03/92/1355050392.db2.gz	UOLQSAWEXIVDHN-OCCSQVGLSA-N	0	3	346.862	3.207	20	30		EGEDHN
C#Cc1cncc(C(=O)NCC2CN(Cc3ccccc3C(C)C)C2)c1	ZINC001031963736	1341433115	/nfs/dbraw/zinc/43/31/15/1341433115.db2.gz	VQYSSOIPKDXHKR-UHFFFAOYSA-N	0	3	347.462	3.048	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cc(Cl)c(Cl)n1C	ZINC001032433110	1341510980	/nfs/dbraw/zinc/51/09/80/1341510980.db2.gz	KFPKWUAHFKZKGJ-RYUDHWBXSA-N	0	3	342.270	3.197	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1ccc(C)c(Cl)c1	ZINC001032471801	1341516931	/nfs/dbraw/zinc/51/69/31/1341516931.db2.gz	FZUYZDIZLNMPQY-IRXDYDNUSA-N	0	3	332.875	3.442	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1C[C@@H]2C[C@H]1CN2C[C@H](C)CC	ZINC001032483493	1341521062	/nfs/dbraw/zinc/52/10/62/1341521062.db2.gz	DJWVBNVCIMPDNO-IKGGRYGDSA-N	0	3	328.456	3.196	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3ccc(-c4cccs4)o3)C2)C1	ZINC001073158320	1355632053	/nfs/dbraw/zinc/63/20/53/1355632053.db2.gz	UWHIPGZSTFIQHA-UHFFFAOYSA-N	0	3	328.437	3.342	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H](C)Cc1ccccc1F	ZINC001032624720	1341564854	/nfs/dbraw/zinc/56/48/54/1341564854.db2.gz	SUVBTTTUGUIPKI-SZMVWBNQSA-N	0	3	330.447	3.256	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(C(C)C)nc1C	ZINC001032634336	1341565699	/nfs/dbraw/zinc/56/56/99/1341565699.db2.gz	JGBWUCWSMRLUMG-IRXDYDNUSA-N	0	3	327.472	3.378	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H](C)Cc1ccccc1Cl	ZINC001032654762	1341572091	/nfs/dbraw/zinc/57/20/91/1341572091.db2.gz	IYRKQYUDGNYPMS-PVAVHDDUSA-N	0	3	332.875	3.380	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H]1C[C@H]1c1ccc(OC)cc1	ZINC001032672419	1341577680	/nfs/dbraw/zinc/57/76/80/1341577680.db2.gz	YBZAPEMACOLJFN-QGZVKYPTSA-N	0	3	340.467	3.050	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C(C)(C)c1cccc(OC)c1	ZINC001032717985	1341590183	/nfs/dbraw/zinc/59/01/83/1341590183.db2.gz	CBADDDNAEYSVLR-ROUUACIJSA-N	0	3	342.483	3.224	20	30		EGEDHN
Cc1cccc([C@@H](C)N2CC[C@@H](N(C)C(=O)c3cc(C#N)c[nH]3)C2)c1	ZINC001032990717	1341688739	/nfs/dbraw/zinc/68/87/39/1341688739.db2.gz	GFBBUZIJCBJDBO-CRAIPNDOSA-N	0	3	336.439	3.102	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)[C@@H]2CCc3c2cccc3Cl)C1	ZINC001033267176	1341763493	/nfs/dbraw/zinc/76/34/93/1341763493.db2.gz	AQJBCRXKYPGSQK-RHSMWYFYSA-N	0	3	332.875	3.479	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccc(F)cc2F)C1	ZINC001033295251	1341770128	/nfs/dbraw/zinc/77/01/28/1341770128.db2.gz	SDUZWNFZYBGMKN-BHYGNILZSA-N	0	3	334.410	3.177	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@H]2CCN(C[C@@H](OC)c3ccccc3)C2)C1	ZINC001033400070	1341813639	/nfs/dbraw/zinc/81/36/39/1341813639.db2.gz	SMPHEWOCQMMOSK-RBUKOAKNSA-N	0	3	342.483	3.263	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](N(C)C(=O)c2cnc([C@@H]3CCCO3)s2)C1	ZINC001033485086	1341842290	/nfs/dbraw/zinc/84/22/90/1341842290.db2.gz	XCYQLBPHDKSQDH-CABCVRRESA-N	0	3	349.500	3.107	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)Cc2c[nH]c3cc(C)ccc23)C1	ZINC001033494465	1341846177	/nfs/dbraw/zinc/84/61/77/1341846177.db2.gz	LFCAZNUCYRZUGD-KRWDZBQOSA-N	0	3	325.456	3.128	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2ccc(C(F)(F)F)cc2)C1	ZINC001033605078	1341895035	/nfs/dbraw/zinc/89/50/35/1341895035.db2.gz	BWRVYOFCGUDSGV-HNNXBMFYSA-N	0	3	326.362	3.428	20	30		EGEDHN
C#CCCN1CC[C@@H](N(C)C(=O)c2cccc(Cl)c2Cl)C1	ZINC001033611551	1341901847	/nfs/dbraw/zinc/90/18/47/1341901847.db2.gz	WWOIDVRLWSZZPH-GFCCVEGCSA-N	0	3	325.239	3.163	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)C2(c3ccc(Cl)cc3)CC2)C1	ZINC001033637933	1341920217	/nfs/dbraw/zinc/92/02/17/1341920217.db2.gz	AIUOBUHXRKYQLT-KRWDZBQOSA-N	0	3	332.875	3.480	20	30		EGEDHN
C=CCCN1CC[C@H](N(C)C(=O)c2sc(C(C)(C)C)nc2C)C1	ZINC001033709208	1341970003	/nfs/dbraw/zinc/97/00/03/1341970003.db2.gz	FDCUSQJYIWCHRC-AWEZNQCLSA-N	0	3	335.517	3.471	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2cccc3c2OCC3(C)C)C1	ZINC001033717851	1341974892	/nfs/dbraw/zinc/97/48/92/1341974892.db2.gz	GMPOEAPBDIMMOH-HNNXBMFYSA-N	0	3	328.456	3.079	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2cc3ccccc3nc2C)C1	ZINC001033846698	1342041995	/nfs/dbraw/zinc/04/19/95/1342041995.db2.gz	RXBPJLOLLCTGDD-GOSISDBHSA-N	0	3	335.451	3.103	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cn(C)c3ccccc23)C1	ZINC001033891757	1342065416	/nfs/dbraw/zinc/06/54/16/1342065416.db2.gz	GLCDJCABQYUCAS-MRXNPFEDSA-N	0	3	325.456	3.291	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2cc(F)c(Cl)cc2F)C1	ZINC001033936625	1342098949	/nfs/dbraw/zinc/09/89/49/1342098949.db2.gz	SXYJFGWOFFVEJZ-GFCCVEGCSA-N	0	3	340.801	3.178	20	30		EGEDHN
C=CCCN1CC[C@@H](N(CC)C(=O)c2cc(Br)co2)C1	ZINC001033981494	1342128852	/nfs/dbraw/zinc/12/88/52/1342128852.db2.gz	SVQAKQUGYJCXHR-CYBMUJFWSA-N	0	3	341.249	3.155	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@@H]2C[C@H]2c2ccccc2OC)C1	ZINC001033983715	1342129513	/nfs/dbraw/zinc/12/95/13/1342129513.db2.gz	GJVUKNGAGOQWOA-NZSAHSFTSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccc3c(c2)C[C@H](C)O3)C1	ZINC001033991753	1342134239	/nfs/dbraw/zinc/13/42/39/1342134239.db2.gz	LNEFPGRYICKACG-MAUKXSAKSA-N	0	3	328.456	3.123	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2cc(C)nc3ccccc32)C1	ZINC001034032109	1342170576	/nfs/dbraw/zinc/17/05/76/1342170576.db2.gz	LWACFOYMAINRIF-QGZVFWFLSA-N	0	3	335.451	3.103	20	30		EGEDHN
CC(C)(C)C(=O)N[C@@H]1C[C@H](NCc2ccc(C#N)cc2F)C12CCC2	ZINC001078788809	1357084608	/nfs/dbraw/zinc/08/46/08/1357084608.db2.gz	MIUCLNOCZXAXHQ-DLBZAZTESA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(C)CCN1CC[C@H](N(CC)C(=O)c2scnc2Cl)C1	ZINC001034041724	1342182741	/nfs/dbraw/zinc/18/27/41/1342182741.db2.gz	JNCUASKXFJZCTG-LBPRGKRZSA-N	0	3	327.881	3.299	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cccc3c2OCC3(C)C)C1	ZINC001034056940	1342198179	/nfs/dbraw/zinc/19/81/79/1342198179.db2.gz	PALAQIDGHOUPMZ-INIZCTEOSA-N	0	3	342.483	3.469	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccoc2C(F)(F)F)C1	ZINC001034227727	1342331657	/nfs/dbraw/zinc/33/16/57/1342331657.db2.gz	KAGOYYTVESPYQP-GFCCVEGCSA-N	0	3	330.350	3.459	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccoc2C(F)(F)F)C1	ZINC001034227728	1342331820	/nfs/dbraw/zinc/33/18/20/1342331820.db2.gz	KAGOYYTVESPYQP-LBPRGKRZSA-N	0	3	330.350	3.459	20	30		EGEDHN
C=CCCN1CCCC[C@@H](NC(=O)c2sc(Cl)nc2C)C1	ZINC001034228797	1342332717	/nfs/dbraw/zinc/33/27/17/1342332717.db2.gz	BCCQEDAOISAMFC-GFCCVEGCSA-N	0	3	327.881	3.265	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)c2ncoc2-c2ccccc2)C1	ZINC001034230034	1342334881	/nfs/dbraw/zinc/33/48/81/1342334881.db2.gz	ANWRKBIOBJOEIR-MRXNPFEDSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)c2nsc3ccc(C)cc32)C1	ZINC001034346523	1342417255	/nfs/dbraw/zinc/41/72/55/1342417255.db2.gz	STEXQORTGSGAGK-CQSZACIVSA-N	0	3	329.469	3.375	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@H]2CCc3cccc(OC)c32)C1	ZINC001034432005	1342493526	/nfs/dbraw/zinc/49/35/26/1342493526.db2.gz	MZYCNAOGVRBWLL-MSOLQXFVSA-N	0	3	342.483	3.272	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)C1	ZINC001034433963	1342496132	/nfs/dbraw/zinc/49/61/32/1342496132.db2.gz	UZHUZTOVSJATGR-YZGWKJHDSA-N	0	3	342.483	3.346	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc3c(c2)C[C@H](C)O3)C1	ZINC001034444691	1342505356	/nfs/dbraw/zinc/50/53/56/1342505356.db2.gz	JQELENYMTHPYIA-MAUKXSAKSA-N	0	3	328.456	3.170	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2csc(C(C)(C)C)n2)C1	ZINC001034447105	1342508654	/nfs/dbraw/zinc/50/86/54/1342508654.db2.gz	CVMDGKKPTAMRAQ-CQSZACIVSA-N	0	3	333.501	3.048	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2csc(C(F)(F)F)n2)C1	ZINC001034470933	1342525865	/nfs/dbraw/zinc/52/58/65/1342525865.db2.gz	CTGCKTRKUYVANI-NSHDSACASA-N	0	3	347.406	3.322	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@]2(C)CCOc3ccccc32)C1	ZINC001034485590	1342543806	/nfs/dbraw/zinc/54/38/06/1342543806.db2.gz	FJZYHAFGPMGOFS-DYESRHJHSA-N	0	3	342.483	3.274	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)Cc2ccc(OC(C)C)cc2)C1	ZINC001034534729	1342591097	/nfs/dbraw/zinc/59/10/97/1342591097.db2.gz	AMXSNJSFQWNHGM-SFHVURJKSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cc(C)n(C(C)(C)C)n2)C1	ZINC001034537713	1342594989	/nfs/dbraw/zinc/59/49/89/1342594989.db2.gz	KFLJQTBJIXYFBV-MRXNPFEDSA-N	0	3	332.492	3.107	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@@H](C)c2cccc(OC)c2)C1	ZINC001034539672	1342598885	/nfs/dbraw/zinc/59/88/85/1342598885.db2.gz	BFCFRXBPPTWHCL-FUHWJXTLSA-N	0	3	330.472	3.346	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@@H]2Cc3cc(C)c(C)cc3O2)C1	ZINC001034540738	1342599563	/nfs/dbraw/zinc/59/95/63/1342599563.db2.gz	JJFSKWDDVDJLCS-ICSRJNTNSA-N	0	3	342.483	3.154	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc(N(C)C)c(F)c2)C1	ZINC001034542220	1342601970	/nfs/dbraw/zinc/60/19/70/1342601970.db2.gz	VLGXVFSXDPLLEF-MRXNPFEDSA-N	0	3	333.451	3.052	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1CC[C@H](NC(=O)c2ccccc2)CC1	ZINC001034582862	1342629180	/nfs/dbraw/zinc/62/91/80/1342629180.db2.gz	FHXBYAOVRTWZOB-MXVIHJGJSA-N	0	3	333.435	3.389	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CC[C@H](NCc3ccn(CC)n3)CC2)CC1	ZINC001034725119	1342718732	/nfs/dbraw/zinc/71/87/32/1342718732.db2.gz	DHDZEQLZHVETBA-IYARVYRRSA-N	0	3	344.503	3.166	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC[C@H](NCc3ccccc3C#N)CC2)C1	ZINC001034729020	1342723749	/nfs/dbraw/zinc/72/37/49/1342723749.db2.gz	INQQZOBZAZOGJY-WGSAOQKQSA-N	0	3	337.467	3.432	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc(OCC)cc2)C12CCC2	ZINC001078799081	1357090537	/nfs/dbraw/zinc/09/05/37/1357090537.db2.gz	VVJFOGDLIGILGF-DLBZAZTESA-N	0	3	348.874	3.468	20	30		EGEDHN
CC1(C)C(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)s2)C1(C)C	ZINC001034895361	1342825317	/nfs/dbraw/zinc/82/53/17/1342825317.db2.gz	MYOPYWODWGNKAH-CYBMUJFWSA-N	0	3	345.512	3.383	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)CCC2CCC2)cc1F	ZINC001034899683	1342827458	/nfs/dbraw/zinc/82/74/58/1342827458.db2.gz	DNDGIENEWMKJJT-GOSISDBHSA-N	0	3	343.446	3.358	20	30		EGEDHN
Cc1csc(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)s2)c1	ZINC001034933585	1342842249	/nfs/dbraw/zinc/84/22/49/1342842249.db2.gz	OJNCJGSPQHYTNV-CYBMUJFWSA-N	0	3	345.493	3.384	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H]1CNCc1cccc(OCC)n1	ZINC001035035308	1342889101	/nfs/dbraw/zinc/88/91/01/1342889101.db2.gz	IWULYCHAOIGKAE-YLJYHZDGSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H]1CNCc1cccc(Cl)n1	ZINC001035035586	1342889462	/nfs/dbraw/zinc/88/94/62/1342889462.db2.gz	NZVONWFBJHCNEJ-CRAIPNDOSA-N	0	3	335.879	3.418	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)c2ccc(F)s2)s1	ZINC001035140692	1342955487	/nfs/dbraw/zinc/95/54/87/1342955487.db2.gz	ZTPZJWGZXPFLCY-LLVKDONJSA-N	0	3	349.456	3.215	20	30		EGEDHN
CCC(=O)N1CCC2(CCN(CC#Cc3cccc(Cl)c3)C2)CC1	ZINC001035146361	1342958127	/nfs/dbraw/zinc/95/81/27/1342958127.db2.gz	DPEXJKDBKSLRPR-UHFFFAOYSA-N	0	3	344.886	3.416	20	30		EGEDHN
N#Cc1ccccc1CN1CCC2(C1)CCN(C(=O)/C=C/C1CC1)CC2	ZINC001035171818	1342987535	/nfs/dbraw/zinc/98/75/35/1342987535.db2.gz	ILCWDZXYBJQZNM-BQYQJAHWSA-N	0	3	349.478	3.339	20	30		EGEDHN
N#Cc1ccccc1CN1CCC2(C1)CCN(C(=O)[C@@H]1CC13CC3)CC2	ZINC001035232264	1343053290	/nfs/dbraw/zinc/05/32/90/1343053290.db2.gz	ASKJZZIYGVIESJ-IBGZPJMESA-N	0	3	349.478	3.173	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC2(CN(Cc3ccc(C(F)F)cc3)C2)CC1	ZINC001035671709	1343130804	/nfs/dbraw/zinc/13/08/04/1343130804.db2.gz	XIIDWEKJMPVCIY-CQSZACIVSA-N	0	3	347.409	3.208	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cscc1C(F)F)CC2	ZINC001035709034	1343145193	/nfs/dbraw/zinc/14/51/93/1343145193.db2.gz	MJGMDCJVYDFDRO-UHFFFAOYSA-N	0	3	338.423	3.247	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C[C@H](C)c1ccncc1)CC2	ZINC001035732424	1343158684	/nfs/dbraw/zinc/15/86/84/1343158684.db2.gz	ASJZDMAJBAJPND-KRWDZBQOSA-N	0	3	327.472	3.076	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cc(C)c3ccccc3n1)CC2	ZINC001035733879	1343159706	/nfs/dbraw/zinc/15/97/06/1343159706.db2.gz	JWMKLUQGUONRRO-UHFFFAOYSA-N	0	3	347.462	3.105	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C(C)(C)c1c(C)noc1C)CC2	ZINC001035771350	1343184007	/nfs/dbraw/zinc/18/40/07/1343184007.db2.gz	CPQFGVQBXNPSSW-UHFFFAOYSA-N	0	3	345.487	3.070	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@H](CC)Cc1ccccc1)CC2	ZINC001035807013	1343207840	/nfs/dbraw/zinc/20/78/40/1343207840.db2.gz	HURRBICUVFIVPT-HXUWFJFHSA-N	0	3	338.495	3.203	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc(Cl)c(OC)c1)CC2	ZINC001035810466	1343210130	/nfs/dbraw/zinc/21/01/30/1343210130.db2.gz	MJIIBCWCPDXERV-UHFFFAOYSA-N	0	3	348.874	3.463	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N1CCC2(CN(CC=C(C)C)C2)CC1	ZINC001035814968	1343212806	/nfs/dbraw/zinc/21/28/06/1343212806.db2.gz	XCNPKQHFSAHRMP-OALUTQOASA-N	0	3	346.515	3.248	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C(C)(C)CC1CCOCC1)CC2	ZINC001035830238	1343218985	/nfs/dbraw/zinc/21/89/85/1343218985.db2.gz	MZTJWNVYSHPZAT-UHFFFAOYSA-N	0	3	348.531	3.330	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C[C@@H]1CCC3(CCC3)CO1)CC2	ZINC001035841472	1343223704	/nfs/dbraw/zinc/22/37/04/1343223704.db2.gz	NIXGXHOCNZCPAG-SFHVURJKSA-N	0	3	346.515	3.226	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1csc3c1CCCC3)CC2	ZINC001035849081	1343229244	/nfs/dbraw/zinc/22/92/44/1343229244.db2.gz	RMBUPGLVWYULFK-UHFFFAOYSA-N	0	3	342.508	3.188	20	30		EGEDHN
C[C@H]1CN(C(=O)C2CCCCC2)CC[C@@H]1NCc1ccccc1C#N	ZINC001035887177	1343249178	/nfs/dbraw/zinc/24/91/78/1343249178.db2.gz	JYGIEQRUNIZPNH-JXFKEZNVSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](NCc2ccn(C(C)C)n2)[C@H](C)C1	ZINC001036133275	1343320877	/nfs/dbraw/zinc/32/08/77/1343320877.db2.gz	AGHPAKKMEMETOX-AEFFLSMTSA-N	0	3	346.519	3.393	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](NCc2cc(C3CC3)no2)[C@@H](C)C1	ZINC001036137705	1343322919	/nfs/dbraw/zinc/32/29/19/1343322919.db2.gz	OTKSAJRHCOMDPQ-YOEHRIQHSA-N	0	3	345.487	3.481	20	30		EGEDHN
C[C@@H](NCc1cc(F)ccc1C#N)[C@H]1CCCN(C(=O)C2CCC2)C1	ZINC001036340184	1343425851	/nfs/dbraw/zinc/42/58/51/1343425851.db2.gz	PRVCVBZUJKHBKJ-PBHICJAKSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@@H](NCc1cc(F)ccc1C#N)[C@@H]1CCCN(C(=O)CC2CC2)C1	ZINC001036344130	1343430450	/nfs/dbraw/zinc/43/04/50/1343430450.db2.gz	LXFCOAKMDZVXDO-RHSMWYFYSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@@H](NCc1cc(F)ccc1C#N)[C@H]1CCCN(C(=O)C(C)(C)F)C1	ZINC001036357702	1343439889	/nfs/dbraw/zinc/43/98/89/1343439889.db2.gz	OZKGUMCCBRJMOW-HIFRSBDPSA-N	0	3	349.425	3.162	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@H]([C@@H](C)NCc3ccccc3C#N)C2)CC1	ZINC001036439552	1343488638	/nfs/dbraw/zinc/48/86/38/1343488638.db2.gz	PWYNDSCQAOIOJP-APWZRJJASA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]([C@@H](C)NCc3nccs3)C2)C1	ZINC001036444109	1343491433	/nfs/dbraw/zinc/49/14/33/1343491433.db2.gz	IJIAYWSITCHEEK-CABCVRRESA-N	0	3	333.501	3.216	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@H](C)[C@H]1CNCc1ccc(C#N)cc1F	ZINC001036502383	1343520560	/nfs/dbraw/zinc/52/05/60/1343520560.db2.gz	JCHKRXPKFNIMOH-HNAYVOBHSA-N	0	3	343.446	3.380	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@@H](C)[C@@H]1CNCc1cc(C#N)ccc1F	ZINC001036503300	1343521381	/nfs/dbraw/zinc/52/13/81/1343521381.db2.gz	MWLQTSFPLRUFLL-BEFAXECRSA-N	0	3	343.446	3.380	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@@H](C)[C@H]1CNCc1cc(C#N)ccc1F	ZINC001036510752	1343526446	/nfs/dbraw/zinc/52/64/46/1343526446.db2.gz	QRASJHBFSLAGRN-RDTXWAMCSA-N	0	3	331.435	3.070	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC[C@H](C)[C@@H]1CNCc1cc(C#N)ccc1F	ZINC001036533545	1343541164	/nfs/dbraw/zinc/54/11/64/1343541164.db2.gz	SVZMZOVLKDSEQY-OELZBGSDSA-N	0	3	343.446	3.380	20	30		EGEDHN
CCCC(=O)N1CC[C@H]2[C@H](CCN2CC#Cc2ccc(Cl)cc2)C1	ZINC001036624613	1343582720	/nfs/dbraw/zinc/58/27/20/1343582720.db2.gz	TXJXJIFHTPURPK-MJGOQNOKSA-N	0	3	344.886	3.414	20	30		EGEDHN
CC(C)(C)CC(=O)N1CC[C@H]2[C@@H](CCN2Cc2ccccc2C#N)C1	ZINC001036641856	1343595823	/nfs/dbraw/zinc/59/58/23/1343595823.db2.gz	HRDVWSYUDPGONB-OALUTQOASA-N	0	3	339.483	3.417	20	30		EGEDHN
C/C(=C\C(=O)N1CC[C@@H]2[C@H](CCN2CC#Cc2ccccc2)C1)C1CC1	ZINC001036659476	1343606031	/nfs/dbraw/zinc/60/60/31/1343606031.db2.gz	ZSDWERSNUWKANO-LKOSTXTBSA-N	0	3	348.490	3.317	20	30		EGEDHN
O=C(N1CC[C@@H]2[C@@H](CCN2CC#Cc2ccccc2)C1)C1(C2CC2)CC1	ZINC001036745101	1343669786	/nfs/dbraw/zinc/66/97/86/1343669786.db2.gz	SUZNQPXUQOSNCA-PZJWPPBQSA-N	0	3	348.490	3.151	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2[C@@H](CCN2Cc2oc(CC)nc2C)C1	ZINC001036789128	1343718922	/nfs/dbraw/zinc/71/89/22/1343718922.db2.gz	MSGGQYQWNHCFEW-HOTGVXAUSA-N	0	3	345.487	3.180	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2[C@@H](CCN2Cc2cnc(C)s2)C1	ZINC001036792465	1343724012	/nfs/dbraw/zinc/72/40/12/1343724012.db2.gz	PPKINKCEWWTPIX-RDJZCZTQSA-N	0	3	347.528	3.477	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccccc2F)C1	ZINC001036792893	1343724539	/nfs/dbraw/zinc/72/45/39/1343724539.db2.gz	WHYZECVXACPVEU-SJLPKXTDSA-N	0	3	330.447	3.461	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2cc(C)ns2)C1	ZINC001036794183	1343726657	/nfs/dbraw/zinc/72/66/57/1343726657.db2.gz	QUIYFKDRUISZKD-DOTOQJQBSA-N	0	3	347.528	3.477	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@H]2[C@@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001036805290	1343741149	/nfs/dbraw/zinc/74/11/49/1343741149.db2.gz	XLGPSMKGYJEIFR-YOEHRIQHSA-N	0	3	345.512	3.479	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@H]2[C@@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001036875907	1343814620	/nfs/dbraw/zinc/81/46/20/1343814620.db2.gz	IDEMQHKSSFCKDT-BBRMVZONSA-N	0	3	331.485	3.089	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@H]2[C@H](CCN2CC#Cc2ccc(F)cc2)C1	ZINC001036876181	1343815712	/nfs/dbraw/zinc/81/57/12/1343815712.db2.gz	LTHUXBZVTGRLQR-MJGOQNOKSA-N	0	3	342.458	3.146	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@H]2[C@@H](CCN2Cc2ccc(C#N)c(F)c2)C1	ZINC001036876354	1343815889	/nfs/dbraw/zinc/81/58/89/1343815889.db2.gz	OEUKYDUHQICXJG-WMZOPIPTSA-N	0	3	343.446	3.166	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCC[C@H]2CNCc2csc(CC)n2)C1	ZINC001037071432	1343964557	/nfs/dbraw/zinc/96/45/57/1343964557.db2.gz	HCHABRXGSRRJDN-GOEBONIOSA-N	0	3	347.528	3.436	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCC[C@H]2CNCc2cscn2)CC1	ZINC001037070997	1343965058	/nfs/dbraw/zinc/96/50/58/1343965058.db2.gz	ZSKDGSXJNCQWNC-RDJZCZTQSA-N	0	3	333.501	3.264	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCC[C@H]1NC(=O)C1CC2(CC2)C1	ZINC001037075530	1343968454	/nfs/dbraw/zinc/96/84/54/1343968454.db2.gz	QVNPUNBXPPAUOM-PKOBYXMFSA-N	0	3	337.467	3.123	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCC[C@H]1NC(=O)C=C1CCC1	ZINC001037200082	1344037224	/nfs/dbraw/zinc/03/72/24/1344037224.db2.gz	ZCMJOTOAWZGDHR-VQTJNVASSA-N	0	3	337.467	3.433	20	30		EGEDHN
CC[C@H]1CN(C(=O)C=C(C)C)CC[C@H]1NCc1cc(F)ccc1C#N	ZINC001037781546	1344092471	/nfs/dbraw/zinc/09/24/71/1344092471.db2.gz	WBSNOMDQRWDVOM-HNAYVOBHSA-N	0	3	343.446	3.380	20	30		EGEDHN
N#Cc1c[nH]c(C(=O)NC[C@H]2CCN2CCC2CCCCCC2)c1	ZINC001038141903	1344295810	/nfs/dbraw/zinc/29/58/10/1344295810.db2.gz	YYCWXFCGMLFJHV-QGZVFWFLSA-N	0	3	328.460	3.051	20	30		EGEDHN
C=CCCN1CC[C@@H]1CNC(=O)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC001038256141	1344346967	/nfs/dbraw/zinc/34/69/67/1344346967.db2.gz	FPXUHLPFWDIMFY-NCOXYXGASA-N	0	3	344.421	3.368	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@H]1CCN1CC1CC2(CCC2)C1	ZINC001038346637	1344390418	/nfs/dbraw/zinc/39/04/18/1344390418.db2.gz	YOOFONKWSVRZRS-QGZVFWFLSA-N	0	3	327.472	3.059	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCN2C[C@H]2CCCC(F)(F)C2)cc1	ZINC001038582683	1344493064	/nfs/dbraw/zinc/49/30/64/1344493064.db2.gz	QNDGEHCFMXYTPW-WMZOPIPTSA-N	0	3	346.421	3.298	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)NC[C@@H]1CCN1CCC1CCCC1	ZINC001038798681	1344589012	/nfs/dbraw/zinc/58/90/12/1344589012.db2.gz	GLIHQHZQNAYDCU-FHWLQOOXSA-N	0	3	334.504	3.129	20	30		EGEDHN
C#CCCCCC(=O)NCCNCc1cc(Cl)cc(Cl)c1	ZINC001125938768	1372895614	/nfs/dbraw/zinc/89/56/14/1372895614.db2.gz	JKRCHCFFGNFWEZ-UHFFFAOYSA-N	0	3	327.255	3.393	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1cnn(C2CCCCC2)c1	ZINC001038889600	1344634170	/nfs/dbraw/zinc/63/41/70/1344634170.db2.gz	LOQJUEYHZHOEMB-GOSISDBHSA-N	0	3	330.476	3.159	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCN2CCC2CCCCCC2)nc1	ZINC001038931085	1344659037	/nfs/dbraw/zinc/65/90/37/1344659037.db2.gz	KZAHSFUXOUSVQY-IBGZPJMESA-N	0	3	339.483	3.228	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C2(C)CCCC2)CC[C@H]1c1ccc(F)cc1	ZINC001079155629	1357198038	/nfs/dbraw/zinc/19/80/38/1357198038.db2.gz	KLBSSNWTAIKWLS-RBUKOAKNSA-N	0	3	342.458	3.313	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1cccc(OCC(C)C)c1	ZINC001039013395	1344714937	/nfs/dbraw/zinc/71/49/37/1344714937.db2.gz	UHIKKVMHIARZNX-GOSISDBHSA-N	0	3	330.472	3.492	20	30		EGEDHN
CCC(=O)N1CCC([C@H]2CCN(Cc3ccc(C#N)cc3F)C2)CC1	ZINC001039101362	1344773777	/nfs/dbraw/zinc/77/37/77/1344773777.db2.gz	HAPNRDUTPSQNQP-KRWDZBQOSA-N	0	3	343.446	3.168	20	30		EGEDHN
C=C(C)C[N@@H+]1CC[C@@H](C2CCN(C(=O)c3ccccc3[O-])CC2)C1	ZINC001039109314	1344780921	/nfs/dbraw/zinc/78/09/21/1344780921.db2.gz	KDANGLSUOODIHA-QGZVFWFLSA-N	0	3	328.456	3.142	20	30		EGEDHN
C=C(C)C[N@H+]1CC[C@@H](C2CCN(C(=O)c3ccccc3[O-])CC2)C1	ZINC001039109314	1344780924	/nfs/dbraw/zinc/78/09/24/1344780924.db2.gz	KDANGLSUOODIHA-QGZVFWFLSA-N	0	3	328.456	3.142	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)c3cc[nH]c3C)CC2)C1	ZINC001039124570	1344800644	/nfs/dbraw/zinc/80/06/44/1344800644.db2.gz	UALHKAMDQQSSDA-INIZCTEOSA-N	0	3	335.879	3.250	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)c3c(C)ccn3C)CC2)C1	ZINC001039128605	1344806575	/nfs/dbraw/zinc/80/65/75/1344806575.db2.gz	ZIXMINAQALLEPU-KRWDZBQOSA-N	0	3	349.906	3.260	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)[C@@H](F)C(C)C)CC2)C1	ZINC001039150916	1344834505	/nfs/dbraw/zinc/83/45/05/1344834505.db2.gz	CXWZGPLEPIOFNB-CVEARBPZSA-N	0	3	330.875	3.294	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)Cc3ccco3)CC2)C1	ZINC001039162151	1344847600	/nfs/dbraw/zinc/84/76/00/1344847600.db2.gz	PCKANOYINHEOPO-MRXNPFEDSA-N	0	3	336.863	3.135	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc(C)n(CC)c2C)C1	ZINC001039219759	1344937348	/nfs/dbraw/zinc/93/73/48/1344937348.db2.gz	VHROLZXOTLXFCO-ICSRJNTNSA-N	0	3	341.499	3.075	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc(C)sc2C)C1	ZINC001039219952	1344937944	/nfs/dbraw/zinc/93/79/44/1344937944.db2.gz	WNFAJAPJPJTQFW-SJLPKXTDSA-N	0	3	330.497	3.315	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)Cc2ccsc2C)C1	ZINC001039230305	1344950232	/nfs/dbraw/zinc/95/02/32/1344950232.db2.gz	KAMNIIVHEGFAAX-RTBURBONSA-N	0	3	344.524	3.325	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccncc2Cl)C1	ZINC001039240809	1344965356	/nfs/dbraw/zinc/96/53/56/1344965356.db2.gz	YYVQSACMLVDIKG-YJBOKZPZSA-N	0	3	345.874	3.075	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc[nH]c2C2CC2)C1	ZINC001039242786	1344969364	/nfs/dbraw/zinc/96/93/64/1344969364.db2.gz	FFNWZHQABJYNQH-HKUYNNGSSA-N	0	3	339.483	3.232	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCCC[C@H]2[C@@H]2CCN(CC#CC)C2)cc1	ZINC001039246799	1344976142	/nfs/dbraw/zinc/97/61/42/1344976142.db2.gz	UPBVJKHNDREUDJ-RTWAWAEBSA-N	0	3	334.463	3.008	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccccc2Cl)C1	ZINC001039246998	1344976180	/nfs/dbraw/zinc/97/61/80/1344976180.db2.gz	SOAVLCQVGMOKBY-MAUKXSAKSA-N	0	3	330.859	3.290	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)Cc2ccc(Cl)cc2)C1	ZINC001039250045	1344980355	/nfs/dbraw/zinc/98/03/55/1344980355.db2.gz	MLLMTZRPCKKYLX-MJGOQNOKSA-N	0	3	344.886	3.219	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2c[nH]c3ccc(C)cc23)C1	ZINC001039250072	1344981008	/nfs/dbraw/zinc/98/10/08/1344981008.db2.gz	GSVRMHWEVOJHGM-UTKZUKDTSA-N	0	3	349.478	3.426	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1c2c[nH]nc2ccc1C	ZINC001039396271	1345044678	/nfs/dbraw/zinc/04/46/78/1345044678.db2.gz	JBKLYSBZEVKLTA-CVEARBPZSA-N	0	3	338.455	3.126	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccnc1C(F)F	ZINC001039403365	1345048972	/nfs/dbraw/zinc/04/89/72/1345048972.db2.gz	RTAIJWJGYJVLOX-KGLIPLIRSA-N	0	3	335.398	3.274	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc2cc(F)ccc2[nH]1	ZINC001039413893	1345055410	/nfs/dbraw/zinc/05/54/10/1345055410.db2.gz	FEQMNQUHIYEKHV-SJORKVTESA-N	0	3	339.414	3.009	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(F)c(Cl)c1	ZINC001039426007	1345062902	/nfs/dbraw/zinc/06/29/02/1345062902.db2.gz	KAALFQQXXINQJE-CABCVRRESA-N	0	3	334.822	3.181	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C1[C@@H]2CCCCCC[C@@H]12	ZINC001039442636	1345068869	/nfs/dbraw/zinc/06/88/69/1345068869.db2.gz	MESZJOORHIIRDN-FCGDIQPGSA-N	0	3	328.500	3.291	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1cc(C)ccc1F	ZINC001039461003	1345079794	/nfs/dbraw/zinc/07/97/94/1345079794.db2.gz	RECSTGJRYFELHX-MSOLQXFVSA-N	0	3	330.447	3.318	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc(C)c(C)c1	ZINC001039465976	1345083392	/nfs/dbraw/zinc/08/33/92/1345083392.db2.gz	KMNMWLKYZVDLLB-UXHICEINSA-N	0	3	326.484	3.487	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](F)Cc1ccccc1	ZINC001039473278	1345088498	/nfs/dbraw/zinc/08/84/98/1345088498.db2.gz	FHYVMSZAOKZUBW-CEXWTWQISA-N	0	3	330.447	3.209	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC[C@@H]1CCOC1	ZINC001039823365	1345200315	/nfs/dbraw/zinc/20/03/15/1345200315.db2.gz	QRSIXXZJSZEGCD-KURKYZTESA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H]3CCC[C@@H](C2)N3CC[C@H]2CCOC2)CC1	ZINC001039892023	1345235312	/nfs/dbraw/zinc/23/53/12/1345235312.db2.gz	RUBJXBHNSZBJRE-YSIASYRMSA-N	0	3	346.515	3.225	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CCC[C@@H](C1)N2C[C@H]1CCCOC1	ZINC001039896075	1345238997	/nfs/dbraw/zinc/23/89/97/1345238997.db2.gz	DFLUIVRMUALYRM-XSYGEPLQSA-N	0	3	334.504	3.081	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@]3(CCN(C(=O)c4ccc[nH]4)C3)C2)cc1	ZINC001040071133	1345322342	/nfs/dbraw/zinc/32/23/42/1345322342.db2.gz	VBEXTOKZBMGKIM-NRFANRHFSA-N	0	3	348.450	3.015	20	30		EGEDHN
Cc1ccc(F)cc1CN1CCC[C@]2(CCN(C(=O)[C@@H](C)C#N)C2)C1	ZINC001040121591	1345339684	/nfs/dbraw/zinc/33/96/84/1345339684.db2.gz	SOMLCRGPJONBBI-JXFKEZNVSA-N	0	3	343.446	3.108	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@@]2(C1)CCCN(Cc1ccc(F)cc1)C2	ZINC001040197287	1345371699	/nfs/dbraw/zinc/37/16/99/1345371699.db2.gz	LXKRYVPVWLRNDK-NRFANRHFSA-N	0	3	340.442	3.054	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ccc4occc4c3)C2)C1	ZINC001040221612	1345381570	/nfs/dbraw/zinc/38/15/70/1345381570.db2.gz	TZSKIWGQEINEHV-OAQYLSRUSA-N	0	3	336.435	3.384	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)Cc3ccc(C)cc3Cl)C2)C1	ZINC001040265818	1345402902	/nfs/dbraw/zinc/40/29/02/1345402902.db2.gz	FGONTIWKNVEBJO-FQEVSTJZSA-N	0	3	344.886	3.139	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cc(C)n([C@@H](C)CC)n3)C2)C1	ZINC001040271048	1345405380	/nfs/dbraw/zinc/40/53/80/1345405380.db2.gz	QEBNFFMSIARFHX-OXJNMPFZSA-N	0	3	344.503	3.277	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3scnc3C(F)F)C2)C1	ZINC001040291172	1345415139	/nfs/dbraw/zinc/41/51/39/1345415139.db2.gz	LVPAMCDOQWONSL-MRXNPFEDSA-N	0	3	341.427	3.195	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@]2(C1)CCCN(Cc1scnc1C)C2	ZINC001040328044	1345435133	/nfs/dbraw/zinc/43/51/33/1345435133.db2.gz	JKGKSNGKZDPBOQ-LJQANCHMSA-N	0	3	347.528	3.478	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3c(C)cc(F)cc3C)C2)C1	ZINC001040333014	1345437376	/nfs/dbraw/zinc/43/73/76/1345437376.db2.gz	QRWDKLZMHWHPIG-FQEVSTJZSA-N	0	3	328.431	3.004	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N1CC[C@@]2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001040340542	1345442262	/nfs/dbraw/zinc/44/22/62/1345442262.db2.gz	JEYLXJFLNYXBPP-LRQRDZAKSA-N	0	3	337.467	3.029	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3ccc(Cl)cc3C)C2)C1	ZINC001040371619	1345460184	/nfs/dbraw/zinc/46/01/84/1345460184.db2.gz	KDLJOCAWDUXLFW-IBGZPJMESA-N	0	3	330.859	3.210	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@H](C)c3ccc(C)o3)C2)C1	ZINC001040433947	1345497316	/nfs/dbraw/zinc/49/73/16/1345497316.db2.gz	BCQUISVWEDOKLK-XLIONFOSSA-N	0	3	328.456	3.029	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@]2(C1)CCCN(Cc1cccc(C#N)c1)C2	ZINC001040501567	1345522009	/nfs/dbraw/zinc/52/20/09/1345522009.db2.gz	CLHIUEQADPQETB-OAQYLSRUSA-N	0	3	339.483	3.419	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cc4nc(C)ccc4o3)C2)C1	ZINC001040503279	1345523429	/nfs/dbraw/zinc/52/34/29/1345523429.db2.gz	RUWPKMKILJDTCQ-HXUWFJFHSA-N	0	3	339.439	3.250	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(F)cc3Cl)C2)C1	ZINC001040514745	1345528081	/nfs/dbraw/zinc/52/80/81/1345528081.db2.gz	FECVXWHEGVJVNF-GOSISDBHSA-N	0	3	334.822	3.040	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3cc(C)nc4ccccc43)C2)C1	ZINC001040515892	1345528943	/nfs/dbraw/zinc/52/89/43/1345528943.db2.gz	PFUFTNQLSOIZOD-QFIPXVFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3ccc4c(c3)CCCC4)C2)C1	ZINC001040518582	1345529830	/nfs/dbraw/zinc/52/98/30/1345529830.db2.gz	CGQJJOJLSZWNDO-JOCHJYFZSA-N	0	3	336.479	3.127	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)CCc3cccs3)C2)C1	ZINC001040524411	1345532666	/nfs/dbraw/zinc/53/26/66/1345532666.db2.gz	GZVQGPWFKIZAKP-LJQANCHMSA-N	0	3	330.497	3.019	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cccc4c3CCC4)C2)C1	ZINC001040547432	1345542054	/nfs/dbraw/zinc/54/20/54/1345542054.db2.gz	LOLIRVOBHAEUHL-QFIPXVFZSA-N	0	3	336.479	3.127	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3scc(C)c3Cl)C2)CC1	ZINC001040715734	1345569633	/nfs/dbraw/zinc/56/96/33/1345569633.db2.gz	YEBRQKVFHVQWBZ-UHFFFAOYSA-N	0	3	336.888	3.271	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)CC3(c4ccccc4)CC3)C2)CC1	ZINC001040722886	1345571099	/nfs/dbraw/zinc/57/10/99/1345571099.db2.gz	FGLUINZZXIIUET-UHFFFAOYSA-N	0	3	336.479	3.056	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3oc(C(F)F)cc3C)C2)CC1	ZINC001040735751	1345572224	/nfs/dbraw/zinc/57/22/24/1345572224.db2.gz	XBVCYWAWIFWFGZ-UHFFFAOYSA-N	0	3	336.382	3.087	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3c(C)oc(C)c3C)C2)CC1	ZINC001040765923	1345576824	/nfs/dbraw/zinc/57/68/24/1345576824.db2.gz	VYKOYHGOHJTVHF-UHFFFAOYSA-N	0	3	328.456	3.156	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)C[C@@H]3CCCC3(F)F)C2)CC1	ZINC001040821457	1345583044	/nfs/dbraw/zinc/58/30/44/1345583044.db2.gz	HBCYFHHANLRXJT-INIZCTEOSA-N	0	3	338.442	3.150	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC2(C1)CCN(Cc1cnoc1C)CC2	ZINC001040829341	1345583905	/nfs/dbraw/zinc/58/39/05/1345583905.db2.gz	BKAZHJPMCYFRDG-LJQANCHMSA-N	0	3	345.487	3.400	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC3(C2)CCN(Cc2cnoc2C)CC3)C1	ZINC001040839108	1345586219	/nfs/dbraw/zinc/58/62/19/1345586219.db2.gz	AJKHFMVBEWNUBK-UHFFFAOYSA-N	0	3	343.471	3.154	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3csc(C(C)C)n3)C2)CC1	ZINC001040883096	1345593943	/nfs/dbraw/zinc/59/39/43/1345593943.db2.gz	WGFVMXMFCZDHAJ-UHFFFAOYSA-N	0	3	345.512	3.218	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)C3(c4ccccc4)CC3)C2)CC1	ZINC001040931278	1345604005	/nfs/dbraw/zinc/60/40/05/1345604005.db2.gz	KAFJCGCHAKFJOF-UHFFFAOYSA-N	0	3	336.479	3.056	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001041196421	1345674002	/nfs/dbraw/zinc/67/40/02/1345674002.db2.gz	SOLKJTVJCYZGSK-HXUWFJFHSA-N	0	3	341.430	3.246	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@]3(CCN(C(=O)C=C4CCC4)C3)C2)c1	ZINC001041198913	1345675839	/nfs/dbraw/zinc/67/58/39/1345675839.db2.gz	BEWZYSSCLOXGFF-NRFANRHFSA-N	0	3	335.451	3.093	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)[C@@H](C)c3c(F)cccc3F)C2)C1	ZINC001041475117	1345738183	/nfs/dbraw/zinc/73/81/83/1345738183.db2.gz	HWHIARYHVZHQFJ-YWZLYKJASA-N	0	3	346.421	3.016	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccc(C)c4cccnc34)C2)C1	ZINC001041484196	1345741742	/nfs/dbraw/zinc/74/17/42/1345741742.db2.gz	WGOJCZKGYKVMKW-QFIPXVFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)[C@@H](C)OC3CCCCCC3)C2)C1	ZINC001041662011	1345815255	/nfs/dbraw/zinc/81/52/55/1345815255.db2.gz	ZURHJBWQHDFDDC-NQIIRXRSSA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)[C@H](CC3CCCC3)C(C)C)C2)C1	ZINC001041720337	1345830489	/nfs/dbraw/zinc/83/04/89/1345830489.db2.gz	NJOIRKHGMYCBHY-TZIWHRDSSA-N	0	3	330.516	3.397	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@]3(CCN(C(=O)[C@@H]4C[C@H]4C4CC4)C3)C2)cc1	ZINC001041734416	1345835813	/nfs/dbraw/zinc/83/58/13/1345835813.db2.gz	WSNUVSWREZGVPS-VWPQPMDRSA-N	0	3	349.478	3.029	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)[C@@H](CC)Cc3ccccc3C)C2)C1	ZINC001041785020	1345849666	/nfs/dbraw/zinc/84/96/66/1345849666.db2.gz	XFCFAZLMCPHKED-SIKLNZKXSA-N	0	3	338.495	3.121	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3ccc(C)c(C)c3Cl)C2)C1	ZINC001041784939	1345849685	/nfs/dbraw/zinc/84/96/85/1345849685.db2.gz	WGFGJFWHIWVDFG-LJQANCHMSA-N	0	3	330.859	3.128	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)C34CC5CC(CC(C5)C3)C4)C2)C1	ZINC001041800164	1345854580	/nfs/dbraw/zinc/85/45/80/1345854580.db2.gz	KLNBJTYBFJRFKM-OTNIWXAGSA-N	0	3	340.511	3.151	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cc(C)c(F)cc3Cl)C2)C1	ZINC001041804770	1345856867	/nfs/dbraw/zinc/85/68/67/1345856867.db2.gz	DBUAOOWYAPLILN-LJQANCHMSA-N	0	3	348.849	3.349	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccsc3C(F)F)C2)C1	ZINC001041809055	1345858077	/nfs/dbraw/zinc/85/80/77/1345858077.db2.gz	FHEJCKKFXXTVKW-KRWDZBQOSA-N	0	3	338.423	3.247	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)[C@@H](C)c3cccc(Cl)c3)C2)C1	ZINC001041841646	1345869409	/nfs/dbraw/zinc/86/94/09/1345869409.db2.gz	QUPMXXTZHBVPAI-KXBFYZLASA-N	0	3	330.859	3.001	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)C3CC(c4ccccc4)C3)C2)C1	ZINC001041852753	1345873738	/nfs/dbraw/zinc/87/37/38/1345873738.db2.gz	WBUBRCNHPSFQBA-QETWGEEDSA-N	0	3	336.479	3.128	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3ccc(C4=CCCC4)cc3)C2)C1	ZINC001041867489	1345877508	/nfs/dbraw/zinc/87/75/08/1345877508.db2.gz	UEFDTEVSDCAIEF-QFIPXVFZSA-N	0	3	334.463	3.425	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(F)c(C(F)F)c3)C[C@H]21	ZINC001042065585	1345934730	/nfs/dbraw/zinc/93/47/30/1345934730.db2.gz	WMIHKNYHCXXZLR-BLLLJJGKSA-N	0	3	338.373	3.486	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3ccn(C4CCCC4)n3)C[C@H]21	ZINC001042079341	1345939481	/nfs/dbraw/zinc/93/94/81/1345939481.db2.gz	CAXJQMJORGAIAG-QFBILLFUSA-N	0	3	342.487	3.111	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)Cc3ccc(C)cc3Cl)C[C@@H]21	ZINC001042119796	1345949299	/nfs/dbraw/zinc/94/92/99/1345949299.db2.gz	JQIMOUGJRWVXBE-APWZRJJASA-N	0	3	344.886	3.137	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3cccnc3C(F)F)C[C@H]21	ZINC001042146475	1345956877	/nfs/dbraw/zinc/95/68/77/1345956877.db2.gz	QBCUZKXYPYMUGV-DZGCQCFKSA-N	0	3	335.398	3.132	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cnc4ccccc4c3C)C[C@@H]21	ZINC001042155140	1345958070	/nfs/dbraw/zinc/95/80/70/1345958070.db2.gz	HWDFBONFHNVQEE-UZLBHIALSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3c(C)occ3C(F)(F)F)C[C@H]21	ZINC001042156645	1345958867	/nfs/dbraw/zinc/95/88/67/1345958867.db2.gz	JTSGCKNRGCKCHB-TZMCWYRMSA-N	0	3	342.361	3.329	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3c(C)occ3C(F)(F)F)C[C@@H]21	ZINC001042156644	1345958991	/nfs/dbraw/zinc/95/89/91/1345958991.db2.gz	JTSGCKNRGCKCHB-OCCSQVGLSA-N	0	3	342.361	3.329	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cc(C)ccc3C3CC3)C[C@H]21	ZINC001042162502	1345961360	/nfs/dbraw/zinc/96/13/60/1345961360.db2.gz	IXGQYRRKPGWEFJ-GHTZIAJQSA-N	0	3	336.479	3.432	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)CCc3ccc(C)c(Cl)c3)C[C@@H]21	ZINC001042168360	1345964060	/nfs/dbraw/zinc/96/40/60/1345964060.db2.gz	USJIMOKJJJIGHH-MJGOQNOKSA-N	0	3	344.886	3.137	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3sc(C)nc3C)[C@H]2C1	ZINC001042183539	1345971132	/nfs/dbraw/zinc/97/11/32/1345971132.db2.gz	KYHIOFXEWMIWQK-HOTGVXAUSA-N	0	3	347.528	3.395	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3cccnc3C)[C@@H]2C1	ZINC001042183846	1345971135	/nfs/dbraw/zinc/97/11/35/1345971135.db2.gz	NXGKJKWVPDZZSS-PKOBYXMFSA-N	0	3	341.499	3.415	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccccc3-n3cccc3)C[C@@H]21	ZINC001042212314	1345987815	/nfs/dbraw/zinc/98/78/15/1345987815.db2.gz	BFQLWOGMEWINNW-RXVVDRJESA-N	0	3	347.462	3.037	20	30		EGEDHN
CC(F)(F)CC(=O)N1CC[C@H]2CCN(Cc3cccc(C#N)c3)[C@@H]2C1	ZINC001042221856	1345993274	/nfs/dbraw/zinc/99/32/74/1345993274.db2.gz	NMNQUTWNMPBTMN-IAGOWNOFSA-N	0	3	347.409	3.026	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]3CCN(Cc4cnccc4C)[C@@H]3C2)C1	ZINC001042227193	1345995828	/nfs/dbraw/zinc/99/58/28/1345995828.db2.gz	ILSABRUZMFQSCV-PKOBYXMFSA-N	0	3	339.483	3.169	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C(C)(C)c3cccc(F)c3)C[C@H]21	ZINC001042229676	1345997456	/nfs/dbraw/zinc/99/74/56/1345997456.db2.gz	HABLBEQSMYEWFW-MAUKXSAKSA-N	0	3	330.447	3.212	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3noc4c3CCCCC4)C[C@H]21	ZINC001042250818	1346005968	/nfs/dbraw/zinc/00/59/68/1346005968.db2.gz	DVKKHDXJOLNMSH-DOTOQJQBSA-N	0	3	343.471	3.056	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cccn3C3CCCC3)C[C@@H]21	ZINC001042291546	1346019576	/nfs/dbraw/zinc/01/95/76/1346019576.db2.gz	ZBFUHFQHELMWKV-APWZRJJASA-N	0	3	327.472	3.326	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3coc(C4CCC4)n3)C[C@@H]21	ZINC001042304513	1346025109	/nfs/dbraw/zinc/02/51/09/1346025109.db2.gz	ONAQHYUERXJFMI-PBHICJAKSA-N	0	3	329.444	3.055	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C3(c4ccccc4F)CCC3)C[C@@H]21	ZINC001042310183	1346027329	/nfs/dbraw/zinc/02/73/29/1346027329.db2.gz	RMIXMTRQEFMMFA-LPHOPBHVSA-N	0	3	342.458	3.356	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3c[nH]nc3C3CCCCC3)C[C@@H]21	ZINC001042310497	1346027872	/nfs/dbraw/zinc/02/78/72/1346027872.db2.gz	SZYKDZGKRQVGAM-YJBOKZPZSA-N	0	3	342.487	3.180	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@@H]2C1	ZINC001042324995	1346033831	/nfs/dbraw/zinc/03/38/31/1346033831.db2.gz	YHYUCWWDGASKPV-ZWKOTPCHSA-N	0	3	325.456	3.027	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)Cc3ccc4ccccc4c3)C[C@@H]21	ZINC001042349301	1346050094	/nfs/dbraw/zinc/05/00/94/1346050094.db2.gz	PMAFGMYTFFMICD-UNMCSNQZSA-N	0	3	346.474	3.328	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3cc4cccc(C)c4o3)C[C@H]21	ZINC001042370179	1346059931	/nfs/dbraw/zinc/05/99/31/1346059931.db2.gz	CHXPVXDZNKTLHJ-FUHWJXTLSA-N	0	3	336.435	3.301	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3cnc(C(C)(C)C)s3)C[C@H]21	ZINC001042371725	1346061213	/nfs/dbraw/zinc/06/12/13/1346061213.db2.gz	VMMGGOWXPMCRGP-LSDHHAIUSA-N	0	3	345.512	3.000	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)c2ccc(F)cc2)s1	ZINC001044897908	1346456739	/nfs/dbraw/zinc/45/67/39/1346456739.db2.gz	CFRZHDDCHXGGMG-HNNXBMFYSA-N	0	3	343.427	3.153	20	30		EGEDHN
CC1(NC(=O)C2CC(F)(F)C2)CCN(Cc2cccc(C#N)c2)CC1	ZINC001045402690	1346584897	/nfs/dbraw/zinc/58/48/97/1346584897.db2.gz	WDAMUOYNZPKWRH-UHFFFAOYSA-N	0	3	347.409	3.074	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2ccc(-n3cccc3)cc2)CC1	ZINC001045495107	1346608759	/nfs/dbraw/zinc/60/87/59/1346608759.db2.gz	QJLQWQKCLHJIKD-UHFFFAOYSA-N	0	3	335.451	3.085	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2cc3cccc(OC)c3o2)CC1	ZINC001045539664	1346622641	/nfs/dbraw/zinc/62/26/41/1346622641.db2.gz	RSQOTLYOBCSGBN-UHFFFAOYSA-N	0	3	328.412	3.212	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)NC1(C)CCN(Cc2csc(C)c2)CC1	ZINC001045563908	1346629631	/nfs/dbraw/zinc/62/96/31/1346629631.db2.gz	QQUSSIMVLNQBHP-SJORKVTESA-N	0	3	348.512	3.118	20	30		EGEDHN
CC[C@]1(C)C[C@H]1C(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045607261	1346644194	/nfs/dbraw/zinc/64/41/94/1346644194.db2.gz	SECCLGMDPBASCK-AZUAARDMSA-N	0	3	339.483	3.465	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H]1CCC(C)=C(C)C1)C2	ZINC001045940188	1346776780	/nfs/dbraw/zinc/77/67/80/1346776780.db2.gz	RXODLZQPCJDDTC-CTNGQTDRSA-N	0	3	328.500	3.461	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc(F)ccc1F)C2	ZINC001045943362	1346779107	/nfs/dbraw/zinc/77/91/07/1346779107.db2.gz	IMPNFCYSJAKCCY-HXUWFJFHSA-N	0	3	346.421	3.306	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc3cc(C)cn3c1)C2	ZINC001045944268	1346780294	/nfs/dbraw/zinc/78/02/94/1346780294.db2.gz	JAHPADDVHGUODX-JOCHJYFZSA-N	0	3	349.478	3.199	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@]2(CCN(Cc3ccccn3)C2)C1	ZINC001045956658	1346791048	/nfs/dbraw/zinc/79/10/48/1346791048.db2.gz	RUZZJSCYZFWNEI-OAQYLSRUSA-N	0	3	341.499	3.498	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H]1CCCC(F)(F)C1)C2	ZINC001045965364	1346800265	/nfs/dbraw/zinc/80/02/65/1346800265.db2.gz	GNQXSAGRNIVNMW-AEFFLSMTSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc[nH]c1C1CCC1)C2	ZINC001045966389	1346801082	/nfs/dbraw/zinc/80/10/82/1346801082.db2.gz	VFMMIEANFCQXGS-OAQYLSRUSA-N	0	3	339.483	3.234	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)CC[C@H]1CCCCO1)C2	ZINC001045969500	1346804803	/nfs/dbraw/zinc/80/48/03/1346804803.db2.gz	ROVBINTUOBOYQR-CTNGQTDRSA-N	0	3	346.515	3.064	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H](F)c1ccccc1)C2	ZINC001045970217	1346805494	/nfs/dbraw/zinc/80/54/94/1346805494.db2.gz	CSNOOIANLKTDGS-FPOVZHCZSA-N	0	3	342.458	3.425	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cccc3cc[nH]c31)C2	ZINC001045970887	1346806089	/nfs/dbraw/zinc/80/60/89/1346806089.db2.gz	MYPYLEZWKBNOAZ-NRFANRHFSA-N	0	3	335.451	3.119	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)C1(C)CC(F)(F)C1)C2	ZINC001045978977	1346815895	/nfs/dbraw/zinc/81/58/95/1346815895.db2.gz	MCKHROPWDGRWOI-SFHVURJKSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc(Cl)cn1)C2	ZINC001045980664	1346818457	/nfs/dbraw/zinc/81/84/57/1346818457.db2.gz	GEENOIOITCSPBG-LJQANCHMSA-N	0	3	345.874	3.077	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc3ccccc3n1)C2	ZINC001045981687	1346820430	/nfs/dbraw/zinc/82/04/30/1346820430.db2.gz	XYSKSCQOEWROGH-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2cc(F)cc3ccncc32)C1	ZINC001046320276	1346933821	/nfs/dbraw/zinc/93/38/21/1346933821.db2.gz	RJQGNLIHEVHORD-IBGZPJMESA-N	0	3	327.403	3.144	20	30		EGEDHN
C=C(C)CCN1CC[C@@](C)(NC(=O)c2cnc([C@@H]3CCCO3)s2)C1	ZINC001046685983	1347061594	/nfs/dbraw/zinc/06/15/94/1347061594.db2.gz	GKJZOWZULQZUMH-KBXCAEBGSA-N	0	3	349.500	3.155	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@]2(C)CCN(Cc3cc(C)cc(C)c3)C2)cn1	ZINC001046779478	1347096142	/nfs/dbraw/zinc/09/61/42/1347096142.db2.gz	UGAJTDOHXMOMOL-QFIPXVFZSA-N	0	3	347.462	3.074	20	30		EGEDHN
C#CCCN1CC[C@](C)(NC(=O)c2ccc(Cl)c(Cl)c2)C1	ZINC001046795129	1347106913	/nfs/dbraw/zinc/10/69/13/1347106913.db2.gz	MCXIMCAEAFGCAL-INIZCTEOSA-N	0	3	325.239	3.211	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC001046795550	1347107297	/nfs/dbraw/zinc/10/72/97/1347107297.db2.gz	VMIFWIUBIPCROW-MRXNPFEDSA-N	0	3	326.362	3.476	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2cccc3c2OCC3(C)C)C1	ZINC001046881314	1347142900	/nfs/dbraw/zinc/14/29/00/1347142900.db2.gz	QCMVPXXMZACKCC-HXUWFJFHSA-N	0	3	328.456	3.127	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2ccoc2Cl)C1	ZINC001046933575	1347157028	/nfs/dbraw/zinc/15/70/28/1347157028.db2.gz	DMOKSKJKGGHBBY-NSHDSACASA-N	0	3	332.778	3.196	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2cc(C)cs2)C1	ZINC001046938495	1347157995	/nfs/dbraw/zinc/15/79/95/1347157995.db2.gz	UEPDJOZUKXEYQY-ZDUSSCGKSA-N	0	3	328.428	3.320	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2cc3cnccc3o2)C1	ZINC001046954933	1347163408	/nfs/dbraw/zinc/16/34/08/1347163408.db2.gz	WISHHPFOZRKLMP-CQSZACIVSA-N	0	3	349.381	3.091	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2cc(C)cc(F)c2)C1	ZINC001046974664	1347172741	/nfs/dbraw/zinc/17/27/41/1347172741.db2.gz	DYYCXHUXVGULQJ-OAHLLOKOSA-N	0	3	340.389	3.397	20	30		EGEDHN
CC(C)C(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1cccc(Cl)c1)C2	ZINC001047029464	1347191841	/nfs/dbraw/zinc/19/18/41/1347191841.db2.gz	ZKMQPWOSGMRPNC-WDSOQIARSA-N	0	3	344.886	3.317	20	30		EGEDHN
CC1(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)N(Cc2ccc(C#N)s2)C3)CCC1	ZINC001047127039	1347213780	/nfs/dbraw/zinc/21/37/80/1347213780.db2.gz	HDMCXWYFGMJOTL-ZNMIVQPWSA-N	0	3	343.496	3.279	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)C[C@H]3C=CCC3)C2)CC1	ZINC001047224013	1347254143	/nfs/dbraw/zinc/25/41/43/1347254143.db2.gz	UKTZQCXBBXVPNN-AZUAARDMSA-N	0	3	328.500	3.317	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)/C=C(\C)C3CC3)C2)CC1	ZINC001047229588	1347259637	/nfs/dbraw/zinc/25/96/37/1347259637.db2.gz	QBUKMJQVVLZRPN-UQCBTIDJSA-N	0	3	328.500	3.317	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)C3(C)CC(F)(F)C3)C2)CC1	ZINC001047265444	1347286622	/nfs/dbraw/zinc/28/66/22/1347286622.db2.gz	ZTLBFPVLEMURDQ-INIZCTEOSA-N	0	3	338.442	3.006	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)c2ccsc2)C1	ZINC001047709482	1347343640	/nfs/dbraw/zinc/34/36/40/1347343640.db2.gz	MPXZSFDXIOEGFP-WMLDXEAASA-N	0	3	339.464	3.260	20	30		EGEDHN
C[C@@H](NCc1cc(F)ccc1C#N)[C@H]1CCN(C(=O)C=C2CCC2)C1	ZINC001047799987	1347376337	/nfs/dbraw/zinc/37/63/37/1347376337.db2.gz	OLRYTZJOSZPVTD-PBHICJAKSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]([C@H](C)NCc2nc(C)c(C)s2)C1	ZINC001047929887	1347414028	/nfs/dbraw/zinc/41/40/28/1347414028.db2.gz	ABWBSBZPRWVOEC-ZFWWWQNUSA-N	0	3	335.517	3.299	20	30		EGEDHN
CCC1(C(=O)N2CC[C@H]([C@@H](C)NCc3ccccc3C#N)C2)CC1	ZINC001047971022	1347429195	/nfs/dbraw/zinc/42/91/95/1347429195.db2.gz	MLRQAPBKVPBOMO-QAPCUYQASA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@H]1CN(C(=O)c2ccccc2)C[C@H]1CNCc1ccccc1C#N	ZINC001048111771	1347470204	/nfs/dbraw/zinc/47/02/04/1347470204.db2.gz	FJVZSTNFKZJHIT-OXJNMPFZSA-N	0	3	333.435	3.056	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCC2CC2)C[C@H]1CNCc1cc(F)ccc1C#N	ZINC001048181416	1347487404	/nfs/dbraw/zinc/48/74/04/1347487404.db2.gz	DZUAGGBCIYOZNK-RDTXWAMCSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)[C@@H](CNCc2csc(CC)n2)C1	ZINC001048340358	1347523185	/nfs/dbraw/zinc/52/31/85/1347523185.db2.gz	RGRSIUVVGVZTLZ-KGLIPLIRSA-N	0	3	335.517	3.102	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](CNCc2csc(C3CC3)n2)[C@H](C)C1	ZINC001048341881	1347523914	/nfs/dbraw/zinc/52/39/14/1347523914.db2.gz	FPPIEBOTHNRRQE-UKRRQHHQSA-N	0	3	347.528	3.417	20	30		EGEDHN
CCC(C)(C)C(=O)N1C[C@H](C)[C@H](CNCc2ccccc2C#N)C1	ZINC001048361018	1347530861	/nfs/dbraw/zinc/53/08/61/1347530861.db2.gz	YFANZWPNXZHAFU-MAUKXSAKSA-N	0	3	327.472	3.179	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2(C)CC=CC2)C[C@H]1CNCc1ccccc1C#N	ZINC001048374234	1347534831	/nfs/dbraw/zinc/53/48/31/1347534831.db2.gz	OXTILXZYFVNPTD-VQIMIIECSA-N	0	3	337.467	3.099	20	30		EGEDHN
CC(C)C1(C(=O)N2C[C@@H](C)[C@@H](CNCc3ccccc3C#N)C2)CC1	ZINC001048374850	1347535021	/nfs/dbraw/zinc/53/50/21/1347535021.db2.gz	RTCFVSFLUOAPQP-APWZRJJASA-N	0	3	339.483	3.179	20	30		EGEDHN
C=C(Br)CN1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)C1CCC1)C2	ZINC001048495637	1347566566	/nfs/dbraw/zinc/56/65/66/1347566566.db2.gz	VKCBWMLTHQQHSB-YOWGUQMCSA-N	0	3	341.293	3.054	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)[C@@H]2CC2(C)C)CC1	ZINC001048627543	1347624672	/nfs/dbraw/zinc/62/46/72/1347624672.db2.gz	MERXCSFTZFRWAD-SFHVURJKSA-N	0	3	327.472	3.107	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@H]2CCCN3C(=O)CCC2CC2)cc1	ZINC001049386032	1347814008	/nfs/dbraw/zinc/81/40/08/1347814008.db2.gz	JVEZTZAXLLPKTK-UXHICEINSA-N	0	3	337.467	3.314	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)/C=C\C2CC2)cc1	ZINC001049399884	1347822263	/nfs/dbraw/zinc/82/22/63/1347822263.db2.gz	ZQZOADPKNZMWAC-BHGRFLGOSA-N	0	3	335.451	3.090	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)[C@H]2[C@@H]3CCC[C@@H]32)cc1	ZINC001049400849	1347824191	/nfs/dbraw/zinc/82/41/91/1347824191.db2.gz	KBCQOEXXUAXAMG-QGLKVJOYSA-N	0	3	349.478	3.170	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccn(C2CCCC2)n1	ZINC001049506278	1347883154	/nfs/dbraw/zinc/88/31/54/1347883154.db2.gz	WFIBHZRFRCOAGA-RBUKOAKNSA-N	0	3	342.487	3.253	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc2ccccc2nc1C	ZINC001049514194	1347886695	/nfs/dbraw/zinc/88/66/95/1347886695.db2.gz	YHBOWDBOLUQYHY-WOJBJXKFSA-N	0	3	335.451	3.408	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1ccc(C)c(Cl)c1	ZINC001049547490	1347902229	/nfs/dbraw/zinc/90/22/29/1347902229.db2.gz	ZOJUHOTZNMXNKQ-OALUTQOASA-N	0	3	344.886	3.280	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C1(C)CCC(F)(F)CC1	ZINC001049556880	1347907567	/nfs/dbraw/zinc/90/75/67/1347907567.db2.gz	ZWKQNNSKYVQXPO-HUUCEWRRSA-N	0	3	326.431	3.453	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1coc2cc(F)ccc12	ZINC001049565643	1347913190	/nfs/dbraw/zinc/91/31/90/1347913190.db2.gz	VVVQLAKCCYHAOH-IAGOWNOFSA-N	0	3	328.387	3.437	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(OC)cc1F	ZINC001049578211	1347918411	/nfs/dbraw/zinc/91/84/11/1347918411.db2.gz	UYHFUDRHBAGXJL-MSOLQXFVSA-N	0	3	332.419	3.089	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(-c2ccco2)o1	ZINC001049587529	1347923977	/nfs/dbraw/zinc/92/39/77/1347923977.db2.gz	HCJVFWLHVBLCIB-HZPDHXFCSA-N	0	3	338.407	3.242	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cnc2c(F)cccc2c1	ZINC001049596916	1347929260	/nfs/dbraw/zinc/92/92/60/1347929260.db2.gz	ZZAFCYHNJPANCL-ZWKOTPCHSA-N	0	3	339.414	3.239	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1c(C)occ1C(F)(F)F	ZINC001049597594	1347929367	/nfs/dbraw/zinc/92/93/67/1347929367.db2.gz	FENOJGOAFKJKNU-KBPBESRZSA-N	0	3	342.361	3.472	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1nc2ccccc2cc1C	ZINC001049606705	1347933756	/nfs/dbraw/zinc/93/37/56/1347933756.db2.gz	URIMXWJSMHVOEP-RBUKOAKNSA-N	0	3	335.451	3.408	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)CCc1ccc(C)c(Cl)c1	ZINC001049627887	1347942149	/nfs/dbraw/zinc/94/21/49/1347942149.db2.gz	VFOLBGBQUQRXHK-RTBURBONSA-N	0	3	344.886	3.280	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1ccc(OC)cc1	ZINC001049636508	1347946950	/nfs/dbraw/zinc/94/69/50/1347946950.db2.gz	SFMZYJKUBKZVML-OALUTQOASA-N	0	3	342.483	3.473	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1ccc(OC)cc1	ZINC001049636514	1347947014	/nfs/dbraw/zinc/94/70/14/1347947014.db2.gz	SFMZYJKUBKZVML-RTBURBONSA-N	0	3	342.483	3.473	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1cccnc1C	ZINC001049637209	1347947263	/nfs/dbraw/zinc/94/72/63/1347947263.db2.gz	WOKIOGFTXPKOSI-ROUUACIJSA-N	0	3	327.472	3.168	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccn(C(C)C)c1C	ZINC001049658923	1347959277	/nfs/dbraw/zinc/95/92/77/1347959277.db2.gz	GVVPLZRQVAQMBG-RTBURBONSA-N	0	3	327.472	3.080	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1ccc(F)cc1Cl	ZINC001049690057	1347972945	/nfs/dbraw/zinc/97/29/45/1347972945.db2.gz	NNKSGKFGRSZDJD-ROUUACIJSA-N	0	3	348.849	3.110	20	30		EGEDHN
CC(F)(F)CC(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049694051	1347975940	/nfs/dbraw/zinc/97/59/40/1347975940.db2.gz	ANQIPFIMYATGKU-IRXDYDNUSA-N	0	3	347.409	3.169	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(OCC)c(C)c1	ZINC001049761425	1348006486	/nfs/dbraw/zinc/00/64/86/1348006486.db2.gz	JEYIDGRLRDRZJG-ROUUACIJSA-N	0	3	328.456	3.259	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccccc1OC	ZINC001049778853	1348017092	/nfs/dbraw/zinc/01/70/92/1348017092.db2.gz	ZFRMUZWOXOLBOS-ZSYWTGECSA-N	0	3	340.467	3.050	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1coc2ccccc12	ZINC001049810429	1348030826	/nfs/dbraw/zinc/03/08/26/1348030826.db2.gz	LMPAIDVCUZUGQU-RBUKOAKNSA-N	0	3	336.435	3.064	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C(C)(C)CC1CCOCC1	ZINC001049816795	1348035168	/nfs/dbraw/zinc/03/51/68/1348035168.db2.gz	KANWHSZLBPQHPO-ZWKOTPCHSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cccc(-c2cnco2)c1	ZINC001049818902	1348036358	/nfs/dbraw/zinc/03/63/58/1348036358.db2.gz	BGLZPRUWJAHANP-MSOLQXFVSA-N	0	3	337.423	3.207	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1noc2c1C[C@H](C)CC2	ZINC001049824478	1348041022	/nfs/dbraw/zinc/04/10/22/1348041022.db2.gz	WLKNDWXMFUCADT-DJIMGWMZSA-N	0	3	343.471	3.054	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cnc2ccc(F)cc2c1	ZINC001049825023	1348041750	/nfs/dbraw/zinc/04/17/50/1348041750.db2.gz	LPLLGLXNCPGRPK-RBUKOAKNSA-N	0	3	339.414	3.239	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)C1(c2ccccc2F)CCC1	ZINC001049845781	1348054915	/nfs/dbraw/zinc/05/49/15/1348054915.db2.gz	YGQZCCLCGJPMMB-OALUTQOASA-N	0	3	342.458	3.499	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1c[nH]c2cccc(C)c12	ZINC001049846820	1348055836	/nfs/dbraw/zinc/05/58/36/1348055836.db2.gz	NFQTUFJJZWHSAT-WOJBJXKFSA-N	0	3	349.478	3.107	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc2[nH]ccc2s1	ZINC001049867446	1348073279	/nfs/dbraw/zinc/07/32/79/1348073279.db2.gz	NGSYDJJLPBXABE-GJZGRUSLSA-N	0	3	329.469	3.484	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc2c(cccc2OC)[nH]1	ZINC001049892054	1348095977	/nfs/dbraw/zinc/09/59/77/1348095977.db2.gz	YZGXHGUPEVPVJD-MSOLQXFVSA-N	0	3	339.439	3.041	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](C)Cc1ccccc1C	ZINC001049914458	1348109447	/nfs/dbraw/zinc/10/94/47/1348109447.db2.gz	DHOQQUXQWPUWSQ-YSIASYRMSA-N	0	3	326.484	3.425	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1c[nH]c2c1cccc2CC	ZINC001049915967	1348110362	/nfs/dbraw/zinc/11/03/62/1348110362.db2.gz	DIZUVDZRXYLUDU-RBUKOAKNSA-N	0	3	335.451	3.042	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1	ZINC001049924707	1348116455	/nfs/dbraw/zinc/11/64/55/1348116455.db2.gz	SZRBRXPPZPJRPS-ZSYWTGECSA-N	0	3	328.431	3.181	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3CCCN(C(=O)CC4CCC4)[C@@H]3C2)cc1	ZINC001050008830	1348151976	/nfs/dbraw/zinc/15/19/76/1348151976.db2.gz	OGXGWAGPUBPCHI-VQTJNVASSA-N	0	3	337.467	3.171	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@H]2CN(Cc3cc4ccccc4o3)C[C@H]21	ZINC001050044721	1348164262	/nfs/dbraw/zinc/16/42/62/1348164262.db2.gz	NKIWGXXKEWTSDD-AZUAARDMSA-N	0	3	348.446	3.269	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@H]2CN(C/C=C/c3ccccc3)C[C@H]21	ZINC001050044698	1348164304	/nfs/dbraw/zinc/16/43/04/1348164304.db2.gz	MTKWVMVDWHNCLV-KSYVHFBZSA-N	0	3	334.463	3.036	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cc4ccccc4nc3C)[C@@H]2C1	ZINC001050057390	1348168259	/nfs/dbraw/zinc/16/82/59/1348168259.db2.gz	IHUROHUFSAFPCI-FXAWDEMLSA-N	0	3	335.451	3.266	20	30		EGEDHN
CC(F)(F)CC(=O)N1CCC[C@H]2CN(Cc3cccc(C#N)c3)C[C@H]21	ZINC001050135154	1348192893	/nfs/dbraw/zinc/19/28/93/1348192893.db2.gz	LJHLYJJYTNIKRD-DLBZAZTESA-N	0	3	347.409	3.026	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3ccc(C)c(F)c3F)[C@@H]2C1	ZINC001050147391	1348196326	/nfs/dbraw/zinc/19/63/26/1348196326.db2.gz	HFWXPCQEOIAKTQ-GOEBONIOSA-N	0	3	334.410	3.386	20	30		EGEDHN
C#CCCN1C[C@@H]2CCCN(C(=O)c3csc(C(C)(C)C)n3)[C@@H]2C1	ZINC001050162097	1348200209	/nfs/dbraw/zinc/20/02/09/1348200209.db2.gz	MZYHKWAEKZKLAQ-GOEBONIOSA-N	0	3	345.512	3.000	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3oc(CCC)nc3C)[C@@H]2C1	ZINC001050183669	1348205055	/nfs/dbraw/zinc/20/50/55/1348205055.db2.gz	LZMCMKXQETUSCZ-JKSUJKDBSA-N	0	3	331.460	3.048	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)CCc3ccccc3Cl)[C@@H]2C1	ZINC001050197622	1348207980	/nfs/dbraw/zinc/20/79/80/1348207980.db2.gz	XYVOJQBZMHCFTP-PKOBYXMFSA-N	0	3	344.886	3.219	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cc(C)ccc3C3CC3)C2)CC1	ZINC001050604074	1348298867	/nfs/dbraw/zinc/29/88/67/1348298867.db2.gz	LBAMROVTBWGINQ-UHFFFAOYSA-N	0	3	336.479	3.434	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3c(C)cccc3Cl)C2)CC1	ZINC001050644127	1348313323	/nfs/dbraw/zinc/31/33/23/1348313323.db2.gz	AJFNBOOVQPNUNI-UHFFFAOYSA-N	0	3	330.859	3.210	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1cnc(C)s1)CC2	ZINC001050645403	1348313773	/nfs/dbraw/zinc/31/37/73/1348313773.db2.gz	LEODJKYSRMCBEF-SFHVURJKSA-N	0	3	347.528	3.478	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@@H](CC)Cc3ccccc3C)C2)CC1	ZINC001050728439	1348339582	/nfs/dbraw/zinc/33/95/82/1348339582.db2.gz	SDTRVHJGQAEEOO-IBGZPJMESA-N	0	3	338.495	3.121	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3cc4c(s3)CCCCC4)C2)CC1	ZINC001050745503	1348346539	/nfs/dbraw/zinc/34/65/39/1348346539.db2.gz	VJQOFXYHNXSFOM-UHFFFAOYSA-N	0	3	342.508	3.188	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)[C@H]3CC[C@@H](OC)C3)cccc2C1	ZINC001051291795	1348421077	/nfs/dbraw/zinc/42/10/77/1348421077.db2.gz	ATPLPKARZLKJPJ-QFBILLFUSA-N	0	3	342.483	3.052	20	30		EGEDHN
C=C(C)CCN1C[C@@H](C)[C@H](NC(=O)c2scnc2C(F)(F)F)C1	ZINC001079875059	1357410127	/nfs/dbraw/zinc/41/01/27/1357410127.db2.gz	UCEDOBBQANHTAC-GHMZBOCLSA-N	0	3	347.406	3.178	20	30		EGEDHN
C=C(C)CCN1CCN([C@H]2CCN(C(=O)C(C)(C)C(C)(C)C)C2)CC1	ZINC001052060683	1348500217	/nfs/dbraw/zinc/50/02/17/1348500217.db2.gz	JZBCDKKWTGKNBF-SFHVURJKSA-N	0	3	349.563	3.243	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC001052317225	1348520316	/nfs/dbraw/zinc/52/03/16/1348520316.db2.gz	CAQJWJWFCKHFQX-MSOLQXFVSA-N	0	3	325.456	3.075	20	30		EGEDHN
Cc1cnccc1C(=O)N[C@@H]1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC001052362916	1348533647	/nfs/dbraw/zinc/53/36/47/1348533647.db2.gz	RTIMMQKHDWTJRL-LJQANCHMSA-N	0	3	348.450	3.046	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2coc3c2cccc3OC)CC1	ZINC001052379893	1348536328	/nfs/dbraw/zinc/53/63/28/1348536328.db2.gz	SBBRXOPTVRTFQE-OAHLLOKOSA-N	0	3	340.423	3.049	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@@H]2CC=CC[C@H]2C(F)(F)F)CC1	ZINC001052493191	1348557115	/nfs/dbraw/zinc/55/71/15/1348557115.db2.gz	PSLJBJDKTJSVLJ-BZUAXINKSA-N	0	3	342.405	3.125	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)C2(c3cccc(C)c3)CCC2)CC1	ZINC001052614456	1348597262	/nfs/dbraw/zinc/59/72/62/1348597262.db2.gz	RYJLYJZEUADUFR-FQEVSTJZSA-N	0	3	338.495	3.411	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc(C(C)C)nc2C)CC1	ZINC001052719318	1348647442	/nfs/dbraw/zinc/64/74/42/1348647442.db2.gz	RRVSMRSMICKGEP-KRWDZBQOSA-N	0	3	327.472	3.121	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@@H]2CCCN(C[C@H](F)CC)CC2)cc1	ZINC001052771748	1348672546	/nfs/dbraw/zinc/67/25/46/1348672546.db2.gz	OHBTXBDRURLTTA-QZTJIDSGSA-N	0	3	346.446	3.031	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2)CC1	ZINC001052778077	1348675110	/nfs/dbraw/zinc/67/51/10/1348675110.db2.gz	HCFFQNOBYDAUJT-FGTMMUONSA-N	0	3	330.859	3.047	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc(OC(C)C)cc2)CC1	ZINC001052913776	1348745181	/nfs/dbraw/zinc/74/51/81/1348745181.db2.gz	MNVFIVDXVVHTQR-SFHVURJKSA-N	0	3	328.456	3.081	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2c[nH]cc2-c2ccccc2)CC1	ZINC001052934441	1348755001	/nfs/dbraw/zinc/75/50/01/1348755001.db2.gz	KFOOGAOPBSJUQJ-SFHVURJKSA-N	0	3	335.451	3.289	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc(OC3CCC3)cc2)CC1	ZINC001052950755	1348765629	/nfs/dbraw/zinc/76/56/29/1348765629.db2.gz	YICMLYQAEORPDX-GOSISDBHSA-N	0	3	340.467	3.226	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccccc2F)C1	ZINC001053061037	1348869841	/nfs/dbraw/zinc/86/98/41/1348869841.db2.gz	LOQQVZKWFGHKLO-VQIMIIECSA-N	0	3	328.431	3.166	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2coc(C)c2)C1	ZINC001053080551	1348901444	/nfs/dbraw/zinc/90/14/44/1348901444.db2.gz	PZGYUHUKAMVZHR-IEBWSBKVSA-N	0	3	328.456	3.318	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2[nH]ccc2C2CC2)C1	ZINC001053087612	1348912195	/nfs/dbraw/zinc/91/21/95/1348912195.db2.gz	MSAJQTHTDMKCJL-IEBWSBKVSA-N	0	3	339.483	3.232	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2scnc2CC)C1	ZINC001053088623	1348914091	/nfs/dbraw/zinc/91/40/91/1348914091.db2.gz	YFCNSALMHPVXPW-WBVHZDCISA-N	0	3	345.512	3.045	20	30		EGEDHN
C=C(C)CCN1Cc2ccccc2C[C@H]1CNC(=O)c1ccn(C)c1	ZINC001054037573	1349133569	/nfs/dbraw/zinc/13/35/69/1349133569.db2.gz	JXDCYDDJZVYMQO-FQEVSTJZSA-N	0	3	337.467	3.148	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2Cc3ccccc3CN2CCCC)cn1	ZINC001054058786	1349140961	/nfs/dbraw/zinc/14/09/61/1349140961.db2.gz	WYRBVUDYYCUJTP-OAQYLSRUSA-N	0	3	347.462	3.020	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)C[C@H]1CCC(F)(F)C1)C2	ZINC001054143035	1349153284	/nfs/dbraw/zinc/15/32/84/1349153284.db2.gz	MUOYHKYKOFRTSD-AEFFLSMTSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1c(C)[nH]c3ccccc31)C2	ZINC001054161322	1349163502	/nfs/dbraw/zinc/16/35/02/1349163502.db2.gz	BSLPIICJBBHNMM-OAQYLSRUSA-N	0	3	335.451	3.038	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccn(C(C)C)c1C)C2	ZINC001054181844	1349184521	/nfs/dbraw/zinc/18/45/21/1349184521.db2.gz	AAVYXLZXDXFSIP-NRFANRHFSA-N	0	3	341.499	3.329	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@]2(CCN(Cc3ccccn3)C2)C1	ZINC001054192289	1349194092	/nfs/dbraw/zinc/19/40/92/1349194092.db2.gz	TZABTCUCYCHNLZ-RTWAWAEBSA-N	0	3	341.499	3.498	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@]3(CCN(Cc4ccccn4)C3)C2)C1	ZINC001054194904	1349197671	/nfs/dbraw/zinc/19/76/71/1349197671.db2.gz	ZOJFXDYDAMGJGY-OAQYLSRUSA-N	0	3	339.483	3.252	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc3cc[nH]c3c1)C2	ZINC001054205746	1349207518	/nfs/dbraw/zinc/20/75/18/1349207518.db2.gz	WTDRFLGBFBXZHS-NRFANRHFSA-N	0	3	335.451	3.119	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc3sccc3[nH]1)C2	ZINC001054223842	1349219446	/nfs/dbraw/zinc/21/94/46/1349219446.db2.gz	JSTUNRQXDTZCRQ-LJQANCHMSA-N	0	3	341.480	3.181	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@H](F)CC1CCCCC1)C2	ZINC001054227293	1349221807	/nfs/dbraw/zinc/22/18/07/1349221807.db2.gz	GJYVOXXIOSOVIG-UYAOXDASSA-N	0	3	334.479	3.243	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)C(C)(C)C(C)(F)F)C2	ZINC001054233754	1349226023	/nfs/dbraw/zinc/22/60/23/1349226023.db2.gz	RFEOUDJTYJHJTA-SFHVURJKSA-N	0	3	326.431	3.006	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc3c(c1)CCC3)C2	ZINC001054238891	1349232747	/nfs/dbraw/zinc/23/27/47/1349232747.db2.gz	GHGNDKVJTZHWNF-JOCHJYFZSA-N	0	3	336.479	3.127	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)Cc1ccc3ccccc3c1)C2	ZINC001054238388	1349233107	/nfs/dbraw/zinc/23/31/07/1349233107.db2.gz	SORFYAAZCCRKBB-HSZRJFAPSA-N	0	3	346.474	3.330	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@]1(C)CCC(C)=C(C)C1)C2	ZINC001054246857	1349242329	/nfs/dbraw/zinc/24/23/29/1349242329.db2.gz	KWEXHCRCXFCZHM-LEWJYISDSA-N	0	3	328.500	3.461	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cccc(CC)n3)cc2C1	ZINC001054267550	1349264853	/nfs/dbraw/zinc/26/48/53/1349264853.db2.gz	AGNMOZJHWLCEAB-UHFFFAOYSA-N	0	3	335.451	3.466	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@@H]3CCCO[C@@H]3CC)cc2C1	ZINC001054267669	1349265738	/nfs/dbraw/zinc/26/57/38/1349265738.db2.gz	BHPHSCYDFYVJLT-WOJBJXKFSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@@H]3CCO[C@@H]3C(C)C)cc2C1	ZINC001054268775	1349266321	/nfs/dbraw/zinc/26/63/21/1349266321.db2.gz	XGJNDZVAGMLKSD-WOJBJXKFSA-N	0	3	342.483	3.256	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@H]3CC[C@@H](OC)C3)cc2C1	ZINC001054270989	1349269982	/nfs/dbraw/zinc/26/99/82/1349269982.db2.gz	DQFWMCRCXSAPRJ-QFBILLFUSA-N	0	3	328.456	3.010	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@@H]3CCC[C@@H]3OC)cc2C1	ZINC001054271605	1349270763	/nfs/dbraw/zinc/27/07/63/1349270763.db2.gz	SISGOPZZJKCJQO-UXHICEINSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cnc4ccccn34)cc2C1	ZINC001054271683	1349271373	/nfs/dbraw/zinc/27/13/73/1349271373.db2.gz	VKONFIQGIDHKRW-UHFFFAOYSA-N	0	3	346.434	3.156	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@@H]3C[C@@H](C)CO3)cc2C1	ZINC001054274635	1349275401	/nfs/dbraw/zinc/27/54/01/1349275401.db2.gz	NLCJVDVTAQSHQL-BEFAXECRSA-N	0	3	328.456	3.010	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@@H]3CCc4cccnc43)cc2C1	ZINC001054278573	1349278996	/nfs/dbraw/zinc/27/89/96/1349278996.db2.gz	HKCNLVQXRJRGRA-HXUWFJFHSA-N	0	3	347.462	3.320	20	30		EGEDHN
C[C@H]1CN(C(=O)C(F)=C2CCCC2)C[C@H]1NCc1ccc(C#N)s1	ZINC001054572220	1349403462	/nfs/dbraw/zinc/40/34/62/1349403462.db2.gz	WUAWXXYMLHBRRQ-BLLLJJGKSA-N	0	3	347.459	3.354	20	30		EGEDHN
CC(C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1)=C1CCC1	ZINC001054637489	1349424796	/nfs/dbraw/zinc/42/47/96/1349424796.db2.gz	MXISEBLDEDUMGL-BFUOFWGJSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](C)[C@H](NCc2c(C)nsc2C)C1	ZINC001054970798	1349531155	/nfs/dbraw/zinc/53/11/55/1349531155.db2.gz	ISAABGRLPLQRCV-BLLLJJGKSA-N	0	3	335.517	3.299	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3cc([C@H](C)CC)no3)[C@@H]2C1	ZINC001084708204	1358288425	/nfs/dbraw/zinc/28/84/25/1358288425.db2.gz	SMCBLTYVVVFLMW-BFYDXBDKSA-N	0	3	331.460	3.301	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C(C)=C1CCCC1)C[C@@H](C)O2	ZINC001071155218	1354480070	/nfs/dbraw/zinc/48/00/70/1354480070.db2.gz	XNWIVSDHLMUNJF-OXQOHEQNSA-N	0	3	332.488	3.145	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1csc(C)c1C)C[C@@H](C)O2	ZINC001071168416	1354486127	/nfs/dbraw/zinc/48/61/27/1354486127.db2.gz	APGRVFHNWVSZFG-KUHUBIRLSA-N	0	3	348.512	3.246	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C13CCC(CC1)CC3)C[C@H](C)O2	ZINC001071244120	1354524760	/nfs/dbraw/zinc/52/47/60/1354524760.db2.gz	PSAWGUWKRFHQOG-QUWFBVPJSA-N	0	3	346.515	3.225	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)Cc2coc3cc(F)ccc23)CC[C@H]1C	ZINC001071498011	1354728694	/nfs/dbraw/zinc/72/86/94/1354728694.db2.gz	PVHYYQTXZSJUJX-PBHICJAKSA-N	0	3	342.414	3.107	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(C)c(NC(C)=O)c2)CC[C@H]1C	ZINC001071527339	1354746669	/nfs/dbraw/zinc/74/66/69/1354746669.db2.gz	BPAZEABJUNMJHM-CRAIPNDOSA-N	0	3	343.471	3.112	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccccc2-c2cn[nH]c2)CC[C@H]1C	ZINC001071549004	1354761517	/nfs/dbraw/zinc/76/15/17/1354761517.db2.gz	NEOFAUBUZNFFEB-NVXWUHKLSA-N	0	3	338.455	3.236	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc3ccccc3c(=O)[nH]2)CC[C@@H]1C	ZINC001071567745	1354767125	/nfs/dbraw/zinc/76/71/25/1354767125.db2.gz	BVZDGEHCZWWRLS-HOCLYGCPSA-N	0	3	339.439	3.099	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2cc3ccncc3s2)CC[C@H]1C	ZINC001071568544	1354768602	/nfs/dbraw/zinc/76/86/02/1354768602.db2.gz	OSQXCOYMZWCOCI-HIFRSBDPSA-N	0	3	329.469	3.455	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc3nc(C)oc3c2)CC[C@@H]1C	ZINC001071588291	1354780230	/nfs/dbraw/zinc/78/02/30/1354780230.db2.gz	HVOVNGBDZVNXRY-BBRMVZONSA-N	0	3	327.428	3.295	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2ccc3c(c2)CCCO3)CC[C@H]1C	ZINC001071589478	1354780925	/nfs/dbraw/zinc/78/09/25/1354780925.db2.gz	VGLHDKPQSPEWSY-VQIMIIECSA-N	0	3	342.483	3.099	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2c(C)noc2C(F)F)CC[C@@H]1C	ZINC001071601464	1354788747	/nfs/dbraw/zinc/78/87/47/1354788747.db2.gz	AGNOINFAELOSHC-JQWIXIFHSA-N	0	3	327.375	3.079	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc3c(cn2)CCCC3)CC[C@H]1C	ZINC001071665221	1354837975	/nfs/dbraw/zinc/83/79/75/1354837975.db2.gz	BWIQUQBIYDBTBL-QAPCUYQASA-N	0	3	327.472	3.119	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc3[nH]nc(C)c3c2)CC[C@H]1C	ZINC001071676969	1354844034	/nfs/dbraw/zinc/84/40/34/1354844034.db2.gz	QDEGJFFIAPELBA-CZUORRHYSA-N	0	3	326.444	3.030	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2ccc3cnccc3c2)CC[C@H]1C	ZINC001071678034	1354844667	/nfs/dbraw/zinc/84/46/67/1354844667.db2.gz	XYCNGIKCUQOEAK-UZLBHIALSA-N	0	3	337.467	3.323	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc3cc(Cl)ccc3[nH]2)CC[C@H]1C	ZINC001071728880	1354884352	/nfs/dbraw/zinc/88/43/52/1354884352.db2.gz	UYYNAKRCVGUPFE-CJNGLKHVSA-N	0	3	343.858	3.427	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CC[C@@H](C)N(Cc3ccc(C)cc3)C2)c1	ZINC001071816019	1354957474	/nfs/dbraw/zinc/95/74/74/1354957474.db2.gz	TUHUMNHQEGQSQE-DYESRHJHSA-N	0	3	347.462	3.154	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cn(C)nc2C2CCCC2)CC[C@@H]1C	ZINC001071817799	1354957975	/nfs/dbraw/zinc/95/79/75/1354957975.db2.gz	IHULGZYNJVXBHZ-DOTOQJQBSA-N	0	3	344.503	3.237	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccccc2-n2cccn2)CC[C@H]1C	ZINC001071851768	1354979637	/nfs/dbraw/zinc/97/96/37/1354979637.db2.gz	POKLASAEMKWCTG-IAGOWNOFSA-N	0	3	338.455	3.031	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2c(C)noc2C(F)(F)F)CC[C@H]1C	ZINC001071854730	1354982976	/nfs/dbraw/zinc/98/29/76/1354982976.db2.gz	FFWXDIWKBVUDRG-ZYHUDNBSSA-N	0	3	345.365	3.161	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)Cc2c[nH]c3cc(C)ccc23)CC[C@H]1C	ZINC001071886630	1355006568	/nfs/dbraw/zinc/00/65/68/1355006568.db2.gz	HLAJRHJBHDWSIW-WBVHZDCISA-N	0	3	325.456	3.174	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2csc(C(C)(C)C)n2)CC[C@@H]1C	ZINC001071892728	1355010229	/nfs/dbraw/zinc/01/02/29/1355010229.db2.gz	HYWHMJFLXWXSJW-KBPBESRZSA-N	0	3	333.501	3.047	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(OC)c(C3CC3)c2)CC[C@H]1C	ZINC001071946599	1355037706	/nfs/dbraw/zinc/03/77/06/1355037706.db2.gz	LBTDGIYIICDLOO-CRAIPNDOSA-N	0	3	340.467	3.179	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cnn(C(CC)CC)c2C)CC[C@H]1C	ZINC001071976676	1355055575	/nfs/dbraw/zinc/05/55/75/1355055575.db2.gz	GUGCQVXEZDXANV-NVXWUHKLSA-N	0	3	344.503	3.159	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc(C)n(C(C)(C)C)n2)CC[C@@H]1C	ZINC001072076568	1355115709	/nfs/dbraw/zinc/11/57/09/1355115709.db2.gz	RFFPGYYBRXQSLK-GOEBONIOSA-N	0	3	332.492	3.105	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2ccc(P(C)(C)=O)cc2)CC[C@H]1C	ZINC001072087820	1355120919	/nfs/dbraw/zinc/12/09/19/1355120919.db2.gz	BRINKHTWQSVSNV-NVXWUHKLSA-N	0	3	348.427	3.093	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2coc(C3CCCCC3)n2)CC[C@@H]1C	ZINC001072101987	1355131684	/nfs/dbraw/zinc/13/16/84/1355131684.db2.gz	MAUHTEFUGBBGKT-DOTOQJQBSA-N	0	3	343.471	3.328	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(N=NC(N)=O)cc2)CC[C@H]1C	ZINC001072102152	1355131690	/nfs/dbraw/zinc/13/16/90/1355131690.db2.gz	NKHZSHDEOOTEAA-CJNGLKHVSA-N	0	3	343.431	3.008	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2N(Cc2ccsc2)C(=O)[C@H]2C[C@@H]2C)CC1	ZINC001072137561	1355149574	/nfs/dbraw/zinc/14/95/74/1355149574.db2.gz	QEPJFAAGMNMFGZ-RYQLBKOJSA-N	0	3	342.508	3.220	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](C)[C@H](CNCc2ocnc2C)C1	ZINC001072334730	1355244031	/nfs/dbraw/zinc/24/40/31/1355244031.db2.gz	GSPCVRVDAPOVMJ-GOEBONIOSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](C)[C@H](CNCc3ocnc3C)C2)CC1	ZINC001072356065	1355253865	/nfs/dbraw/zinc/25/38/65/1355253865.db2.gz	FQMCRYJVRDIJSW-CRAIPNDOSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](C)[C@@H](CNCc3ocnc3C)C2)CC1	ZINC001072356068	1355254065	/nfs/dbraw/zinc/25/40/65/1355254065.db2.gz	FQMCRYJVRDIJSW-YJBOKZPZSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](C)[C@@H](CNCc3ncc(C)s3)C2)C1	ZINC001072363372	1355258022	/nfs/dbraw/zinc/25/80/22/1355258022.db2.gz	DHSNRGAZCUVTGL-ZBFHGGJFSA-N	0	3	347.528	3.382	20	30		EGEDHN
CC1(C)CC(C(=O)N2CC3(C2)CCN(Cc2ccc(C#N)cc2)C3)C1	ZINC001072690889	1355391053	/nfs/dbraw/zinc/39/10/53/1355391053.db2.gz	PFLVKYKGYGUJER-UHFFFAOYSA-N	0	3	337.467	3.029	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3ccccc3O[C@@H](C)CC)C2)C1	ZINC001073019973	1355551775	/nfs/dbraw/zinc/55/17/75/1355551775.db2.gz	DCUKGYRYKTULJL-INIZCTEOSA-N	0	3	328.456	3.198	20	30		EGEDHN
CC[C@@]1(C)C[C@H]1C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001073091062	1355588366	/nfs/dbraw/zinc/58/83/66/1355588366.db2.gz	DHKTVHFWNSGQHJ-ICSRJNTNSA-N	0	3	337.467	3.029	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@H](C)Cc3cccc(Cl)c3)C2)C1	ZINC001073488652	1355817908	/nfs/dbraw/zinc/81/79/08/1355817908.db2.gz	GDUVMUOIWFWZOH-OAHLLOKOSA-N	0	3	332.875	3.239	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2cccn2C2CCCC2)C1	ZINC001073834806	1355911810	/nfs/dbraw/zinc/91/18/10/1355911810.db2.gz	KOBMTDBWXSJKDU-SFHVURJKSA-N	0	3	345.487	3.000	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCCN1C(=O)C1CCC1	ZINC001073928837	1355964195	/nfs/dbraw/zinc/96/41/95/1355964195.db2.gz	VWFCZVGSJLJGRH-LJQANCHMSA-N	0	3	325.456	3.171	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@H](NCc2ccc(C#N)s2)[C@@H]1C)c1ccco1	ZINC001074874348	1356275933	/nfs/dbraw/zinc/27/59/33/1356275933.db2.gz	URRFUWUNRPOROI-WWGRRREGSA-N	0	3	343.452	3.095	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCO[C@H]1C1CCN(C(=O)/C(C)=C\C)CC1	ZINC001075408977	1356359898	/nfs/dbraw/zinc/35/98/98/1356359898.db2.gz	PPYOFFNBADZYST-DPHCZHQRSA-N	0	3	340.895	3.081	20	30		EGEDHN
C=CCN1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)c2ccco2)C1	ZINC001075419194	1356363984	/nfs/dbraw/zinc/36/39/84/1356363984.db2.gz	WLRLOBYIAPRAKK-SJLPKXTDSA-N	0	3	342.414	3.440	20	30		EGEDHN
C=CCN1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)[C@H]2CC23CC3)C1	ZINC001075423106	1356364835	/nfs/dbraw/zinc/36/48/35/1356364835.db2.gz	JSJZAOKALIGUQV-BHIYHBOVSA-N	0	3	342.458	3.334	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](C2CCN(C(=O)[C@@H](C)OC)CC2)CC1	ZINC001075448095	1356381299	/nfs/dbraw/zinc/38/12/99/1356381299.db2.gz	NOWHVDXYAQHEOK-HZPDHXFCSA-N	0	3	342.911	3.115	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)C3CCc4ccccc4CC3)[C@@H]2C1	ZINC001075974188	1356460458	/nfs/dbraw/zinc/46/04/58/1356460458.db2.gz	WNNBPFLIOAGTIM-LEWJYISDSA-N	0	3	338.495	3.290	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cc(F)c4ncccc4c3)[C@@H]2C1	ZINC001076368089	1356561021	/nfs/dbraw/zinc/56/10/21/1356561021.db2.gz	MHCWSCGYDOZREX-MAUKXSAKSA-N	0	3	339.414	3.096	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cccc(N4CCCC4)c3)[C@@H]2C1	ZINC001076387503	1356564690	/nfs/dbraw/zinc/56/46/90/1356564690.db2.gz	LFEUIUYIMLEDMF-AZUAARDMSA-N	0	3	339.483	3.009	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3cccc(-c4ccoc4)c3)[C@@H]2C1	ZINC001076441328	1356578444	/nfs/dbraw/zinc/57/84/44/1356578444.db2.gz	VTJBBXICQVUOQI-AZUAARDMSA-N	0	3	334.419	3.116	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)[C@H](C)c3cc4ccccc4o3)[C@@H]2C1	ZINC001076445967	1356579785	/nfs/dbraw/zinc/57/97/85/1356579785.db2.gz	UMVJFYIBFMHEOL-BPQIPLTHSA-N	0	3	336.435	3.092	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3csc4c3CCCC4)[C@@H]2C1	ZINC001076544217	1356613806	/nfs/dbraw/zinc/61/38/06/1356613806.db2.gz	VSURYMXDSXZHHD-WMLDXEAASA-N	0	3	330.497	3.349	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3c(CC)oc4ccccc43)[C@@H]2C1	ZINC001076612734	1356631367	/nfs/dbraw/zinc/63/13/67/1356631367.db2.gz	MSHQSGICZQWZKI-DOTOQJQBSA-N	0	3	336.435	3.165	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2ccc3nc(C)sc3c2)C1	ZINC001080717862	1357726740	/nfs/dbraw/zinc/72/67/40/1357726740.db2.gz	SRPYRAZDLOPRDT-MLGOLLRUSA-N	0	3	329.469	3.231	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@H]2CCCCC2(C)C)C[C@H]1C(F)(F)F	ZINC001099347350	1363764286	/nfs/dbraw/zinc/76/42/86/1363764286.db2.gz	FCYOQUYPBIOLGY-MGPQQGTHSA-N	0	3	332.410	3.368	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2C[C@@H](NCc3ccns3)C23CCC3)CC1	ZINC001078716806	1357062980	/nfs/dbraw/zinc/06/29/80/1357062980.db2.gz	YWAQPZAHGAHSJQ-IAGOWNOFSA-N	0	3	345.512	3.407	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2nc(C3CC3)oc2C)C12CCC2	ZINC001078767404	1357073476	/nfs/dbraw/zinc/07/34/76/1357073476.db2.gz	JLVDZFWKVHUIKY-ZIAGYGMSSA-N	0	3	349.862	3.244	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc3c([nH]2)CCCC3)C12CCC2	ZINC001078773861	1357078441	/nfs/dbraw/zinc/07/84/41/1357078441.db2.gz	OZZIYGLUSIEBGP-DLBZAZTESA-N	0	3	347.890	3.277	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2ncoc2C(C)C)C12CCC2	ZINC001078774566	1357078502	/nfs/dbraw/zinc/07/85/02/1357078502.db2.gz	ZFJPMJLOQXKMBF-OLZOCXBDSA-N	0	3	337.851	3.181	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2cc3ccsc3[nH]2)C[C@H]1c1ccccc1	ZINC001081154162	1357845431	/nfs/dbraw/zinc/84/54/31/1357845431.db2.gz	YXDMZPQLTLGKDT-FUHWJXTLSA-N	0	3	349.459	3.060	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C[C@H]2CCCC2(F)F)C[C@H]1c1ccccc1	ZINC001081168240	1357846645	/nfs/dbraw/zinc/84/66/45/1357846645.db2.gz	NVMUIPRYQPKMAQ-FGTMMUONSA-N	0	3	346.421	3.029	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2ccc3ccccc3c2)[C@H](OC)C1	ZINC001082340823	1358020507	/nfs/dbraw/zinc/02/05/07/1358020507.db2.gz	IPCOTWWPAGBQKF-WOJBJXKFSA-N	0	3	338.451	3.235	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1C[C@@H](C)[C@H](NCc2cc(Cl)ccc2Cl)C1	ZINC001082451297	1358039642	/nfs/dbraw/zinc/03/96/42/1358039642.db2.gz	WCYRNFPYNSNAOD-FIXISWKDSA-N	0	3	340.254	3.090	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@@H]2CCC2(C)C)C[C@H]1NCc1ccc(C#N)c(F)c1	ZINC001082695384	1358077057	/nfs/dbraw/zinc/07/70/57/1358077057.db2.gz	ONOYUXVBLCPXSP-RPVQJOFSSA-N	0	3	343.446	3.070	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)[C@@H](C)CC3CCCCC3)[C@H]2C1	ZINC001083212874	1358124858	/nfs/dbraw/zinc/12/48/58/1358124858.db2.gz	FPUHBHLCAGHKSY-YSIASYRMSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)C3CCC(C)(C)CC3)[C@H]2C1	ZINC001083288024	1358129908	/nfs/dbraw/zinc/12/99/08/1358129908.db2.gz	KNTIZIFZYLZTGY-ZWKOTPCHSA-N	0	3	334.504	3.081	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)C(C)(C)c3ccc(Cl)cc3)[C@@H]2C1	ZINC001084627315	1358259159	/nfs/dbraw/zinc/25/91/59/1358259159.db2.gz	SQFHEJAFGCLWDH-CRAIPNDOSA-N	0	3	344.886	3.174	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H]3CCN(C[C@@H]4CC(C)(C)CO4)C[C@H]32)CC1	ZINC001084635026	1358263615	/nfs/dbraw/zinc/26/36/15/1358263615.db2.gz	NHYZNIFPVMWXPD-CEXWTWQISA-N	0	3	346.515	3.081	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@@H]3C[C@H]3c3ccc(C)s3)[C@@H]2C1	ZINC001084710502	1358289041	/nfs/dbraw/zinc/28/90/41/1358289041.db2.gz	IFQHTNVXXXDZON-QBPKDAKJSA-N	0	3	330.497	3.269	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)Cc3ccccc3OC(C)C)[C@@H]2C1	ZINC001084720195	1358291941	/nfs/dbraw/zinc/29/19/41/1358291941.db2.gz	HBGBMXLMXJXPRO-RTBURBONSA-N	0	3	342.483	3.125	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@@H](C)Cc3ccccc3C)[C@@H]2C1	ZINC001084859493	1358332466	/nfs/dbraw/zinc/33/24/66/1358332466.db2.gz	XWLQNEMOXBDKEA-DFQSSKMNSA-N	0	3	326.484	3.282	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3ccc(C(F)(F)F)s3)[C@@H]2C1	ZINC001084863048	1358334112	/nfs/dbraw/zinc/33/41/12/1358334112.db2.gz	RCFIJQZNJBAXFE-VXGBXAGGSA-N	0	3	344.402	3.489	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@H](C)c3cccc(Cl)c3)C[C@@H]21	ZINC001085097572	1358389557	/nfs/dbraw/zinc/38/95/57/1358389557.db2.gz	NOXGFPWYEUPLTD-MDZRGWNJSA-N	0	3	344.886	3.390	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@H](CC)c3ccc(F)cc3)C[C@@H]21	ZINC001085102890	1358392009	/nfs/dbraw/zinc/39/20/09/1358392009.db2.gz	DEARKTFPIKSKOX-NEWSRXKRSA-N	0	3	330.447	3.428	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@@H]2CCCC[C@H]2NC(=O)C2CC=CC2)c1	ZINC001085155563	1358414335	/nfs/dbraw/zinc/41/43/35/1358414335.db2.gz	AGDCJNCXOIQKSC-RTBURBONSA-N	0	3	341.430	3.181	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)C(C)(C)C1CCOCC1	ZINC001085267142	1358447263	/nfs/dbraw/zinc/44/72/63/1358447263.db2.gz	KUSNCSOLSOWCNX-HZPDHXFCSA-N	0	3	342.911	3.209	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cccc2c1CCOC2	ZINC001085270594	1358448434	/nfs/dbraw/zinc/44/84/34/1358448434.db2.gz	MNGUBLYVRBZXQC-QZTJIDSGSA-N	0	3	348.874	3.142	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cc(OC)cs1	ZINC001085294543	1358455045	/nfs/dbraw/zinc/45/50/45/1358455045.db2.gz	QLKYRZMBLGDCBT-CHWSQXEVSA-N	0	3	328.865	3.140	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)Cc1ccc(OC)cc1	ZINC001085404195	1358491281	/nfs/dbraw/zinc/49/12/81/1358491281.db2.gz	ZDDNFAOSWPNQPO-IAGOWNOFSA-N	0	3	336.863	3.007	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)CC1CCC(OC)CC1	ZINC001085440604	1358501247	/nfs/dbraw/zinc/50/12/47/1358501247.db2.gz	DRWWWDIFZJIZPF-BHUNQDJPSA-N	0	3	342.911	3.351	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1conc1C1CCCC1	ZINC001085637659	1358652005	/nfs/dbraw/zinc/65/20/05/1358652005.db2.gz	WDUGASHYPYVCNB-INIZCTEOSA-N	0	3	331.460	3.445	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc(C)n([C@H](C)CC)n1	ZINC001085685214	1358685922	/nfs/dbraw/zinc/68/59/22/1358685922.db2.gz	LYIQRLNUOLJOJP-NVXWUHKLSA-N	0	3	332.492	3.275	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@@H]1CCCc2cccnc21	ZINC001085781337	1358756400	/nfs/dbraw/zinc/75/64/00/1358756400.db2.gz	TXKBPXNRQDRDGE-ZWKOTPCHSA-N	0	3	327.472	3.000	20	30		EGEDHN
C#Cc1cncc(C(=O)N(C)C[C@H]2CCN2CCCC2CCCC2)c1	ZINC001085809895	1358788311	/nfs/dbraw/zinc/78/83/11/1358788311.db2.gz	PWNYIDVGGLTDHL-HXUWFJFHSA-N	0	3	339.483	3.180	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1ccccc1OCC(C)C	ZINC001085878375	1358842975	/nfs/dbraw/zinc/84/29/75/1358842975.db2.gz	ZWHUNYARSKTUGJ-QGZVFWFLSA-N	0	3	330.472	3.444	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc(Cl)cc(OC)c1	ZINC001085888230	1358847264	/nfs/dbraw/zinc/84/72/64/1358847264.db2.gz	UASYPAFCHYGWJM-INIZCTEOSA-N	0	3	336.863	3.461	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1ccc(C(F)(F)F)cc1	ZINC001085940967	1358898396	/nfs/dbraw/zinc/89/83/96/1358898396.db2.gz	URHJFXQUDXTSJR-OAHLLOKOSA-N	0	3	326.362	3.428	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1ccc(OC2CCC2)cc1	ZINC001085981137	1358933900	/nfs/dbraw/zinc/93/39/00/1358933900.db2.gz	GAECVMYLPCKVAW-KRWDZBQOSA-N	0	3	328.456	3.340	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@@H](CNC(=O)c3cccs3)C2)c(F)c1	ZINC001086018243	1358967076	/nfs/dbraw/zinc/96/70/76/1358967076.db2.gz	KINGSCNSVNONRN-OTVXOJSOSA-N	0	3	343.427	3.057	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2coc3c2cccc3OC)C1	ZINC001086087717	1358992730	/nfs/dbraw/zinc/99/27/30/1358992730.db2.gz	MJOCOOHIBUZVCZ-BETUJISGSA-N	0	3	348.830	3.292	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cn(C)c3ccc(F)cc23)C1	ZINC001086108574	1358999668	/nfs/dbraw/zinc/99/96/68/1358999668.db2.gz	BBFMVVYBBWCVMG-XBXGTLAGSA-N	0	3	349.837	3.168	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2nc(C(C)(C)C)cs2)C1	ZINC001086112767	1359000056	/nfs/dbraw/zinc/00/00/56/1359000056.db2.gz	ZZMMPKCASLQNSH-TXEJJXNPSA-N	0	3	341.908	3.291	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc(C)n([C@@H](C)CC)n2)C1	ZINC001086132266	1359005281	/nfs/dbraw/zinc/00/52/81/1359005281.db2.gz	JZROEBALWZFHKP-AEGPPILISA-N	0	3	338.883	3.013	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cccc(Cl)c2F)C1	ZINC001086185908	1359020174	/nfs/dbraw/zinc/02/01/74/1359020174.db2.gz	XOJPCAGTJIMGJH-PHIMTYICSA-N	0	3	331.218	3.330	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc(C(CC)CC)no2)C1	ZINC001086218769	1359031210	/nfs/dbraw/zinc/03/12/10/1359031210.db2.gz	WECUTSPOWKMZRE-XBXGTLAGSA-N	0	3	339.867	3.429	20	30		EGEDHN
CC[C@]1(C)C[C@H]1C(=O)NC[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001086239427	1359037021	/nfs/dbraw/zinc/03/70/21/1359037021.db2.gz	FCAVKWUNBPCAMK-DZIWXPPMSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(Cl)cc2C)C1	ZINC001086466834	1359108011	/nfs/dbraw/zinc/10/80/11/1359108011.db2.gz	XYTNOBPCJLQMLM-MQMHXKEQSA-N	0	3	327.255	3.499	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2c(F)ccc(C)c2F)C1	ZINC001086467236	1359108382	/nfs/dbraw/zinc/10/83/82/1359108382.db2.gz	SAUWNHRGRFLZFX-HAQNSBGRSA-N	0	3	328.790	3.124	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)[C@H]2CCC[C@@H]2CC)C1	ZINC001086469122	1359109722	/nfs/dbraw/zinc/10/97/22/1359109722.db2.gz	CSFUQJBFNBWTKB-AJNGGQMLSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc(C(CC)CC)no2)C1	ZINC001086498142	1359121006	/nfs/dbraw/zinc/12/10/06/1359121006.db2.gz	WECUTSPOWKMZRE-MQMHXKEQSA-N	0	3	339.867	3.429	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cccc(C)c2Cl)C1	ZINC001086507679	1359123491	/nfs/dbraw/zinc/12/34/91/1359123491.db2.gz	HDTWJDLKQXZIOX-JOCQHMNTSA-N	0	3	327.255	3.499	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H](c3ccccc3)[C@H](NC(=O)C3CC3)C2)c1	ZINC001086570224	1359151035	/nfs/dbraw/zinc/15/10/35/1359151035.db2.gz	NPYZNROKGBRDFS-LEWJYISDSA-N	0	3	345.446	3.052	20	30		EGEDHN
C=C(C)CN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2ccn(C)c2C)C1	ZINC001086608399	1359163084	/nfs/dbraw/zinc/16/30/84/1359163084.db2.gz	GAYHQVAQDWEEFC-VQTJNVASSA-N	0	3	337.467	3.107	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](CNCc2nc3ccccc3o2)[C@@H](C)C1	ZINC001184007229	1387380657	/nfs/dbraw/zinc/38/06/57/1387380657.db2.gz	BMFQBQCBYVREMU-JKSUJKDBSA-N	0	3	341.455	3.368	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccc(OCC)cc2)C1	ZINC001086866754	1359217264	/nfs/dbraw/zinc/21/72/64/1359217264.db2.gz	BCNVQACIKXSJPE-GOEBONIOSA-N	0	3	336.863	3.326	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2scnc2Cl)C1	ZINC001086877033	1359219034	/nfs/dbraw/zinc/21/90/34/1359219034.db2.gz	WKFDEYKELMSHCW-VHSXEESVSA-N	0	3	334.272	3.037	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)Cc3ccsc3)C2)CC1	ZINC001086899314	1359229296	/nfs/dbraw/zinc/22/92/96/1359229296.db2.gz	GYDMVFPRACIYBT-INIZCTEOSA-N	0	3	330.497	3.017	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC2(C[C@@H]1C)CCN(Cc1ccccc1F)CC2	ZINC001086910181	1359237766	/nfs/dbraw/zinc/23/77/66/1359237766.db2.gz	NPIFPAMUAOPCJY-CVEARBPZSA-N	0	3	343.446	3.188	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)[C@H]3[C@@H]4CCCC[C@@H]43)C2)CC1	ZINC001086913752	1359241455	/nfs/dbraw/zinc/24/14/55/1359241455.db2.gz	WREAVSGLYBDFAN-INDMIFKZSA-N	0	3	328.500	3.149	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3sccc3F)C2)CC1	ZINC001086920515	1359247723	/nfs/dbraw/zinc/24/77/23/1359247723.db2.gz	RLGKMMYUNPXUTA-CQSZACIVSA-N	0	3	334.460	3.227	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc(C(C)C)nc3)C2)CC1	ZINC001086926871	1359252048	/nfs/dbraw/zinc/25/20/48/1359252048.db2.gz	MQXAYXVFRDDCBC-QGZVFWFLSA-N	0	3	339.483	3.155	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)C[C@H]3C=CCCC3)C2)CC1	ZINC001086929038	1359253815	/nfs/dbraw/zinc/25/38/15/1359253815.db2.gz	VDLPLKCZJHQZPQ-OALUTQOASA-N	0	3	328.500	3.459	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cc(C)sc3C)C2)CC1	ZINC001086931381	1359255364	/nfs/dbraw/zinc/25/53/64/1359255364.db2.gz	HARXICWLMSSHJP-AWEZNQCLSA-N	0	3	330.497	3.315	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H]3CC[C@@H]4C[C@@H]4CC3)C2)CC1	ZINC001086934246	1359257790	/nfs/dbraw/zinc/25/77/90/1359257790.db2.gz	KPIZMZCBTXOINC-MKXGPGLRSA-N	0	3	328.500	3.149	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3occ4c3CCC4)C2)CC1	ZINC001086934760	1359258410	/nfs/dbraw/zinc/25/84/10/1359258410.db2.gz	ZJTTXNPSHKMGFH-INIZCTEOSA-N	0	3	340.467	3.108	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3ccoc3C3CC3)C2)CC1	ZINC001086939753	1359262172	/nfs/dbraw/zinc/26/21/72/1359262172.db2.gz	YYPQUURQWOMANB-HNNXBMFYSA-N	0	3	326.440	3.107	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3occc3Cl)C2)CC1	ZINC001086941046	1359262538	/nfs/dbraw/zinc/26/25/38/1359262538.db2.gz	HSXQNMYRIQJDKW-CQSZACIVSA-N	0	3	334.847	3.273	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3sccc3OC)C2)CC1	ZINC001086953187	1359273373	/nfs/dbraw/zinc/27/33/73/1359273373.db2.gz	AGJPVYPHXMBETJ-OAHLLOKOSA-N	0	3	346.496	3.097	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc(C)nc3C)C2)CC1	ZINC001086958057	1359278629	/nfs/dbraw/zinc/27/86/29/1359278629.db2.gz	CQHLOZCROCTYIO-KRWDZBQOSA-N	0	3	339.483	3.038	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccc(C#N)s1)C1CC1	ZINC001087143031	1359304630	/nfs/dbraw/zinc/30/46/30/1359304630.db2.gz	NXXKEHVAZXQICO-YCPHGPKFSA-N	0	3	345.512	3.383	20	30		EGEDHN
CC(C)C(=O)N[C@@H]1[C@H]2CCCN(Cc3ccc(C#N)cc3)[C@@H]2C1(C)C	ZINC001087274231	1359347724	/nfs/dbraw/zinc/34/77/24/1359347724.db2.gz	MUAOOKGRHDOEHX-QRVBRYPASA-N	0	3	339.483	3.319	20	30		EGEDHN
CC(C)C(=O)N[C@@H]1[C@H]2CCCN(Cc3cccc(C#N)c3)[C@@H]2C1(C)C	ZINC001087273879	1359347988	/nfs/dbraw/zinc/34/79/88/1359347988.db2.gz	HKRWRLNUJULPLS-QRVBRYPASA-N	0	3	339.483	3.319	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3sccc3Cl)C(C)(C)[C@@H]21	ZINC001087287617	1359365694	/nfs/dbraw/zinc/36/56/94/1359365694.db2.gz	KCHREIWIZJNJEP-KCPJHIHWSA-N	0	3	336.888	3.254	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3[nH]ccc3C3CC3)C(C)(C)[C@H]21	ZINC001087289894	1359369025	/nfs/dbraw/zinc/36/90/25/1359369025.db2.gz	UATCIHXURCKDSD-QRQLOZEOSA-N	0	3	339.483	3.134	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)Cc3ccccc3CC)C(C)(C)[C@H]21	ZINC001087290644	1359370159	/nfs/dbraw/zinc/37/01/59/1359370159.db2.gz	GJJJQBISHWJUDI-GIVPXCGWSA-N	0	3	338.495	3.030	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cscc1Cl	ZINC001087291464	1359370750	/nfs/dbraw/zinc/37/07/50/1359370750.db2.gz	VFCQRQGVRUIMTB-BYCMXARLSA-N	0	3	336.888	3.254	20	30		EGEDHN
C=CCN1CCC[C@@H]2[C@@H](NC(=O)c3nc(Cl)cs3)C(C)(C)[C@H]21	ZINC001087300096	1359382334	/nfs/dbraw/zinc/38/23/34/1359382334.db2.gz	GUSSXDWSWDMSAG-RTXFEEFZSA-N	0	3	339.892	3.201	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccn(C(C)C)c3C)C(C)(C)[C@@H]21	ZINC001087300231	1359382810	/nfs/dbraw/zinc/38/28/10/1359382810.db2.gz	HZGCQKKWPWKEBL-GUDVDZBRSA-N	0	3	341.499	3.229	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccoc3C3CC3)C(C)(C)[C@H]21	ZINC001087302153	1359384994	/nfs/dbraw/zinc/38/49/94/1359384994.db2.gz	OGWPSMZEEPWFJA-NXHRZFHOSA-N	0	3	326.440	3.009	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc(C(C)C)cn3)C(C)(C)[C@H]21	ZINC001087305161	1359390371	/nfs/dbraw/zinc/39/03/71/1359390371.db2.gz	OCLKBXXIBUJIMG-NEWSRXKRSA-N	0	3	339.483	3.057	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc(Cl)cs3)C(C)(C)[C@H]21	ZINC001087307089	1359393944	/nfs/dbraw/zinc/39/39/44/1359393944.db2.gz	TVYCYOJULNZHQE-SNPRPXQTSA-N	0	3	336.888	3.254	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1csc(C(C)C)n1	ZINC001087307640	1359394930	/nfs/dbraw/zinc/39/49/30/1359394930.db2.gz	DEISHGRBLBCYNT-VNQPRFMTSA-N	0	3	345.512	3.119	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc(F)cc3C)C(C)(C)[C@H]21	ZINC001087314097	1359402823	/nfs/dbraw/zinc/40/28/23/1359402823.db2.gz	FOUCRMZNTZNQNZ-QYZOEREBSA-N	0	3	342.458	3.376	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)[C@H]3CC[C@H](CC)CC3)C(C)(C)[C@@H]21	ZINC001087314591	1359404093	/nfs/dbraw/zinc/40/40/93/1359404093.db2.gz	NRQDVVUNOGKIFI-FVVUREQNSA-N	0	3	330.516	3.441	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc(C)c(F)c(C)c3)C(C)(C)[C@H]21	ZINC001087318179	1359410199	/nfs/dbraw/zinc/41/01/99/1359410199.db2.gz	SKIDMDOVGWLWDI-NEWSRXKRSA-N	0	3	342.458	3.295	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)C3CCC=CCC3)C(C)(C)[C@H]21	ZINC001087319985	1359412332	/nfs/dbraw/zinc/41/23/32/1359412332.db2.gz	XEKWFNYVNHWLSI-QYZOEREBSA-N	0	3	328.500	3.361	20	30		EGEDHN
C=CCN1CCC[C@@H]2[C@H](NC(=O)c3scnc3Cl)C(C)(C)[C@H]21	ZINC001087320017	1359412991	/nfs/dbraw/zinc/41/29/91/1359412991.db2.gz	XPJPSTGLKBJLLZ-WXHSDQCUSA-N	0	3	339.892	3.201	20	30		EGEDHN
C=CCCN1CC[C@H](c2ccc(F)cc2)[C@H](NC(=O)C2(C)CC2)C1	ZINC001087465315	1359479686	/nfs/dbraw/zinc/47/96/86/1359479686.db2.gz	IFFXOVHMJSJIIN-QZTJIDSGSA-N	0	3	330.447	3.476	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2scnc2C2CCCC2)[C@H]1CC	ZINC001087644688	1359568326	/nfs/dbraw/zinc/56/83/26/1359568326.db2.gz	KIHNAIVYTDLCLI-JKSUJKDBSA-N	0	3	345.512	3.407	20	30		EGEDHN
C=CCCN1CC[C@H](NC(=O)c2cnc([C@@H]3CCCO3)s2)[C@H]1CC	ZINC001087754167	1359629520	/nfs/dbraw/zinc/62/95/20/1359629520.db2.gz	QYKNXEUQJKYVMG-ZNMIVQPWSA-N	0	3	349.500	3.153	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccnc(O[C@@H](C)CC)c2)[C@H]1CC	ZINC001087789289	1359646425	/nfs/dbraw/zinc/64/64/25/1359646425.db2.gz	IRMQSLOEMOYTMP-RYQLBKOJSA-N	0	3	345.487	3.418	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3cc(C)cc(Cl)c3)C[C@@H]2C1	ZINC001088041647	1359731930	/nfs/dbraw/zinc/73/19/30/1359731930.db2.gz	BUVOZSPZPCNHMQ-WBVHZDCISA-N	0	3	330.859	3.066	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1C[C@H]2CCN(Cc3cccc(C#N)c3)C[C@H]2C1	ZINC001088127758	1359766600	/nfs/dbraw/zinc/76/66/00/1359766600.db2.gz	MGEYHYWRBUQOMJ-AHRSYUTCSA-N	0	3	339.483	3.131	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3ccc(C(C)C)s3)C[C@@H]2C1	ZINC001088215268	1359799451	/nfs/dbraw/zinc/79/94/51/1359799451.db2.gz	ANUQESSUDUBRQD-CVEARBPZSA-N	0	3	330.497	3.289	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)C34CC(C(C)(C)C)(C3)C4)C[C@@H]2C1	ZINC001088217219	1359800755	/nfs/dbraw/zinc/80/07/55/1359800755.db2.gz	UCMMFFWZXINTDZ-UUBYJMPYSA-N	0	3	328.500	3.006	20	30		EGEDHN
C=CCN1CC[C@H](OCC2CCN(C(=O)CCC3CCCC3)CC2)C1	ZINC001088228744	1359808165	/nfs/dbraw/zinc/80/81/65/1359808165.db2.gz	ZHVSFGYESCVGCY-FQEVSTJZSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)[C@]23CCC[C@H]2OCC3)C1	ZINC001088346622	1359833778	/nfs/dbraw/zinc/83/37/78/1359833778.db2.gz	UPDQPVQRLNBEDG-NUJGCVRESA-N	0	3	340.895	3.059	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)Cc2cncc(C)c2)C1	ZINC001088353765	1359836886	/nfs/dbraw/zinc/83/68/86/1359836886.db2.gz	HGMPJLPFMPRZID-KRWDZBQOSA-N	0	3	335.879	3.046	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CCCCC[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001088360532	1359844589	/nfs/dbraw/zinc/84/45/89/1359844589.db2.gz	APSKMOJPDDDPBN-IAGOWNOFSA-N	0	3	349.425	3.306	20	30		EGEDHN
C=C1CCC(C(=O)N2CCCCC[C@H](NCc3cncn3C)C2)CC1	ZINC001088373582	1359854742	/nfs/dbraw/zinc/85/47/42/1359854742.db2.gz	IIVGFRBNFYKABF-SFHVURJKSA-N	0	3	344.503	3.027	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCCCC[C@@H](NCc3ccccn3)C2)C1	ZINC001088378481	1359861803	/nfs/dbraw/zinc/86/18/03/1359861803.db2.gz	JDUKGWNOUROJRO-GOSISDBHSA-N	0	3	327.472	3.299	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2c(C)nn(C(C)(C)C)c2C)[C@H]1C	ZINC001088604866	1359988948	/nfs/dbraw/zinc/98/89/48/1359988948.db2.gz	WCXACWOKLRZYJN-ZBFHGGJFSA-N	0	3	332.492	3.024	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3cccc(CC)c3)[C@@H]2C)cn1	ZINC001088990676	1360126703	/nfs/dbraw/zinc/12/67/03/1360126703.db2.gz	JXHDNRODMYUJMA-IERDGZPVSA-N	0	3	347.462	3.018	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cc3ccccc3n2CC)[C@H]1C	ZINC001089056386	1360151650	/nfs/dbraw/zinc/15/16/50/1360151650.db2.gz	CEYPEMJHRBALOA-WBVHZDCISA-N	0	3	325.456	3.430	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@H](CNC/C(Cl)=C/Cl)[C@@H](C)C1	ZINC001184358421	1387439656	/nfs/dbraw/zinc/43/96/56/1387439656.db2.gz	WKEXIFFGZLYUFA-PEEVIANCSA-N	0	3	331.287	3.039	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2sc(C3CC3)nc2C)CC(C)(C)C1	ZINC001089379914	1360382759	/nfs/dbraw/zinc/38/27/59/1360382759.db2.gz	AOOPTDJYQXENQU-HNNXBMFYSA-N	0	3	345.512	3.183	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2c(F)cccc2OC)CC(C)(C)C1	ZINC001089391849	1360392208	/nfs/dbraw/zinc/39/22/08/1360392208.db2.gz	QGARJYBSWKNHIN-HNNXBMFYSA-N	0	3	346.446	3.078	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2cc(F)c(C)cc2F)CC(C)(C)C1	ZINC001089448552	1360437288	/nfs/dbraw/zinc/43/72/88/1360437288.db2.gz	DYBVSBKUMYIJNW-INIZCTEOSA-N	0	3	348.437	3.056	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccoc2C2CC2)CC(C)(C)C1	ZINC001089479259	1360461839	/nfs/dbraw/zinc/46/18/39/1360461839.db2.gz	YEZNELVDORWPMP-MRXNPFEDSA-N	0	3	328.456	3.401	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2csc(C(C)(C)C)n2)CC(C)(C)C1	ZINC001089516352	1360486797	/nfs/dbraw/zinc/48/67/97/1360486797.db2.gz	FJNPWKKHQMRUET-CQSZACIVSA-N	0	3	347.528	3.294	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cccc3c2ccn3C)CC(C)(C)C1	ZINC001089517698	1360487302	/nfs/dbraw/zinc/48/73/02/1360487302.db2.gz	SYDDCODXYUZVMM-MRXNPFEDSA-N	0	3	337.467	3.032	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@@H](C)c2ccccc2F)CC(C)(C)C1	ZINC001089521068	1360488747	/nfs/dbraw/zinc/48/87/47/1360488747.db2.gz	DPVCFLQRSHKSLA-HOTGVXAUSA-N	0	3	330.447	3.169	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2sc(C(C)C)nc2C)CC(C)(C)C1	ZINC001089559470	1360507174	/nfs/dbraw/zinc/50/71/74/1360507174.db2.gz	PFHUNQVFRAFOLS-HNNXBMFYSA-N	0	3	347.528	3.429	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@@H]2Cc3c2cccc3Cl)CC(C)(C)C1	ZINC001089569293	1360514902	/nfs/dbraw/zinc/51/49/02/1360514902.db2.gz	VKWLOAYVJCAYCI-RHSMWYFYSA-N	0	3	344.886	3.220	20	30		EGEDHN
CC(C)=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1c[nH]c(C#N)c1	ZINC001089626307	1360544406	/nfs/dbraw/zinc/54/44/06/1360544406.db2.gz	FPXFEGGWNSQWFY-QGZVFWFLSA-N	0	3	328.460	3.073	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(CC)ccn1	ZINC001089646079	1360558784	/nfs/dbraw/zinc/55/87/84/1360558784.db2.gz	IPEKSDKKMNDXML-QGZVFWFLSA-N	0	3	329.488	3.441	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccnn1[C@H](C)CC	ZINC001089647094	1360559974	/nfs/dbraw/zinc/55/99/74/1360559974.db2.gz	SCSRYANLTDKBOM-IAGOWNOFSA-N	0	3	344.503	3.098	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ncc(F)cc1F	ZINC001089657541	1360569067	/nfs/dbraw/zinc/56/90/67/1360569067.db2.gz	VSNLPCSPZBYYFK-CQSZACIVSA-N	0	3	337.414	3.156	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(C)nnc1CC	ZINC001089661646	1360572813	/nfs/dbraw/zinc/57/28/13/1360572813.db2.gz	XOCVLKZDRYEHMC-MRXNPFEDSA-N	0	3	344.503	3.144	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cnn(CCC)c1C	ZINC001089716165	1360617558	/nfs/dbraw/zinc/61/75/58/1360617558.db2.gz	AXOWAXYVVWYFBI-QGZVFWFLSA-N	0	3	346.519	3.398	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cccc(OC)c1F	ZINC001089716671	1360618518	/nfs/dbraw/zinc/61/85/18/1360618518.db2.gz	OGJYISIVLPRFHD-OAHLLOKOSA-N	0	3	346.446	3.078	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cccc(N(C)C)c1	ZINC001089729511	1360632463	/nfs/dbraw/zinc/63/24/63/1360632463.db2.gz	PXQIIQWGCRRAOJ-GOSISDBHSA-N	0	3	329.488	3.159	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)/C=C\c1ccco1	ZINC001089758510	1360651686	/nfs/dbraw/zinc/65/16/86/1360651686.db2.gz	RQBDNMKTULAWOR-ZQANZJMKSA-N	0	3	346.858	3.214	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1ccoc1CC	ZINC001089804981	1360670957	/nfs/dbraw/zinc/67/09/57/1360670957.db2.gz	YKGCPONIAURZBI-SVGFKBNWSA-N	0	3	348.874	3.377	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](CNCc2nccn2CC)[C@H](C)C1	ZINC001184487591	1387470612	/nfs/dbraw/zinc/47/06/12/1387470612.db2.gz	RLKMRCZTKIIRCU-SJORKVTESA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cccc(F)c2)CC2(CCOCC2)C1	ZINC001089921226	1360745662	/nfs/dbraw/zinc/74/56/62/1360745662.db2.gz	YLLKAVHSYAJILV-GOSISDBHSA-N	0	3	346.446	3.003	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001184496397	1387471956	/nfs/dbraw/zinc/47/19/56/1387471956.db2.gz	CBNYMHUZSDNGIT-MJGOQNOKSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)[C@H]2CCCCC2(C)C)CC2(CCOCC2)C1	ZINC001089969310	1360773075	/nfs/dbraw/zinc/77/30/75/1360773075.db2.gz	IDLXICLVGTTXMB-QZTJIDSGSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc(C)cc(Cl)c2)C1	ZINC001091144670	1360997743	/nfs/dbraw/zinc/99/77/43/1360997743.db2.gz	NPYMJOIUVWUWAZ-UHFFFAOYSA-N	0	3	327.255	3.499	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cnc3ccsc3c2)C1	ZINC001091181893	1361001417	/nfs/dbraw/zinc/00/14/17/1361001417.db2.gz	YXLIQRRFUDEJJD-UHFFFAOYSA-N	0	3	335.860	3.147	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)c2csc(C)c2)C1	ZINC001091282398	1361030508	/nfs/dbraw/zinc/03/05/08/1361030508.db2.gz	KKEJUFUFTDVTQE-UHFFFAOYSA-N	0	3	343.290	3.063	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@H]2Cc3c2cccc3Cl)C1	ZINC001091386025	1361074040	/nfs/dbraw/zinc/07/40/40/1361074040.db2.gz	XWOHLCJQJSXKJW-QOZQQMKHSA-N	0	3	339.266	3.217	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CN(CCC(F)(F)F)C[C@@]2(C)C1	ZINC001091981955	1361266538	/nfs/dbraw/zinc/26/65/38/1361266538.db2.gz	YNHGISAEYCEREG-BMFZPTHFSA-N	0	3	332.410	3.321	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@@]2(C)C1	ZINC001092065048	1361285895	/nfs/dbraw/zinc/28/58/95/1361285895.db2.gz	IBHLIPLCDMKMLO-SCWSEQNSSA-N	0	3	339.483	3.131	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1CNC(=O)C1CC(C)(C)C1	ZINC001092585945	1361417241	/nfs/dbraw/zinc/41/72/41/1361417241.db2.gz	UIALOZRXVCFANL-YLJYHZDGSA-N	0	3	338.495	3.158	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)[C@H]2[C@@H]3CCCC[C@@H]32)CC1	ZINC001093364145	1361575386	/nfs/dbraw/zinc/57/53/86/1361575386.db2.gz	MTAMJSWARFMHRS-FUMNGEBKSA-N	0	3	340.511	3.149	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC([C@H]2N(C/C=C/Cl)CC23CCC3)CC1	ZINC001093370235	1361579447	/nfs/dbraw/zinc/57/94/47/1361579447.db2.gz	QPUCMNASRNVXCS-JBIFEWPQSA-N	0	3	346.902	3.245	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001094015324	1361724376	/nfs/dbraw/zinc/72/43/76/1361724376.db2.gz	DATRJSCOWQQWKU-BSIFCXSSSA-N	0	3	339.483	3.345	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cccc4ccccc43)CCC[C@@H]12	ZINC001094570791	1361864835	/nfs/dbraw/zinc/86/48/35/1361864835.db2.gz	MWDOULBSXNTIPO-IFMALSPDSA-N	0	3	332.447	3.447	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3c[nH]c4c3cccc4CC)CCC[C@@H]12	ZINC001094584933	1361871256	/nfs/dbraw/zinc/87/12/56/1361871256.db2.gz	JQKIKCQOCMEXOZ-DENIHFKCSA-N	0	3	349.478	3.338	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1C[C@H]2C[C@@H](C1)N(C(=O)C1(C3CC3)CC1)C2	ZINC001094943824	1361954483	/nfs/dbraw/zinc/95/44/83/1361954483.db2.gz	KCYKBBWBNGVMHC-BEVDRBHNSA-N	0	3	349.478	3.218	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H]1CC[C@H](C3CCC3)CC1)C2	ZINC001095562326	1362170336	/nfs/dbraw/zinc/17/03/36/1362170336.db2.gz	RDQDQDAXPADDAV-UEDWAMCQSA-N	0	3	328.500	3.338	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(F)c3ccncc13)C2	ZINC001095900966	1362278469	/nfs/dbraw/zinc/27/84/69/1362278469.db2.gz	FDLPQISQQIUKOZ-VMDGZTHMSA-N	0	3	339.414	3.285	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ncc(Cl)cc1Cl)C2	ZINC001096239070	1362448211	/nfs/dbraw/zinc/44/82/11/1362448211.db2.gz	YHRUQJHTQXBFFP-XBFCOCLRSA-N	0	3	340.254	3.300	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C(C)(C)c1cccc(OC)c1)C2	ZINC001096283624	1362453403	/nfs/dbraw/zinc/45/34/03/1362453403.db2.gz	JBBWEFFXFWZSJV-NEWSRXKRSA-N	0	3	342.483	3.270	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(Cl)c(Cl)c1)C2	ZINC001096411064	1362495897	/nfs/dbraw/zinc/49/58/97/1362495897.db2.gz	OLBIMXSDRUSFRV-KCXAZCMYSA-N	0	3	337.250	3.352	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C(C)(C)c1ccc(OC)cc1)C2	ZINC001096593251	1362589790	/nfs/dbraw/zinc/58/97/90/1362589790.db2.gz	LPCUSVDVPYRHMS-NEWSRXKRSA-N	0	3	342.483	3.270	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc(C3CC3)[nH]c1C1CC1)C2	ZINC001097330393	1362936352	/nfs/dbraw/zinc/93/63/52/1362936352.db2.gz	VJGYXDZKNYMBAN-LZQZEXGQSA-N	0	3	337.467	3.128	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3CC[C@H](C)F)cc1	ZINC001097358072	1362950716	/nfs/dbraw/zinc/95/07/16/1362950716.db2.gz	XIYAGSFNDMRSDY-WLWJZTKJSA-N	0	3	346.446	3.335	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@@H](NCc2cn(C(C)C)nc2C)C1	ZINC001185056142	1387601548	/nfs/dbraw/zinc/60/15/48/1387601548.db2.gz	KGISJOWOTPMHEI-FUHWJXTLSA-N	0	3	332.492	3.065	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@@H](NCc2ccc(OC)c(F)c2)C1	ZINC001185063679	1387606256	/nfs/dbraw/zinc/60/62/56/1387606256.db2.gz	GFDRBLKHOYWRJT-GOEBONIOSA-N	0	3	334.435	3.127	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3CC2CC(F)(F)C2)cc1	ZINC001097626417	1363080179	/nfs/dbraw/zinc/08/01/79/1363080179.db2.gz	FSBWPDWBYGHTER-KURKYZTESA-N	0	3	344.405	3.048	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3Cc2ccccc2)cc1	ZINC001097626428	1363080203	/nfs/dbraw/zinc/08/02/03/1363080203.db2.gz	GAPTXSKONGZNGV-NJYVYQBISA-N	0	3	330.431	3.203	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1oc3ccccc3c1OC)C2	ZINC001097638780	1363085958	/nfs/dbraw/zinc/08/59/58/1363085958.db2.gz	KAEGNKWHYSSIFS-BMFZPTHFSA-N	0	3	340.423	3.353	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc3cc(OC)ccc3[nH]1)C2	ZINC001097753446	1363114362	/nfs/dbraw/zinc/11/43/62/1363114362.db2.gz	CYZDGZFKHZLUNX-BJZITVGISA-N	0	3	339.439	3.088	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1sc(C(C)C)nc1C)C2	ZINC001098388650	1363314677	/nfs/dbraw/zinc/31/46/77/1363314677.db2.gz	ZNXDWFIPBLBYBR-KFWWJZLASA-N	0	3	333.501	3.486	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1nsc3ccccc31)C2	ZINC001098450477	1363328994	/nfs/dbraw/zinc/32/89/94/1363328994.db2.gz	XAEIXEMRZZPDMM-XYPHTWIQSA-N	0	3	341.480	3.136	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1CCC(C)=C(C)C1)C[C@H](C)O2	ZINC001098600315	1363394207	/nfs/dbraw/zinc/39/42/07/1363394207.db2.gz	YTBKSKAEIGSWDD-OALUTQOASA-N	0	3	346.515	3.391	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1c(C)cccc1C)C[C@@H](C)O2	ZINC001098638824	1363411213	/nfs/dbraw/zinc/41/12/13/1363411213.db2.gz	CLEXKUTZTWCIEP-GOSISDBHSA-N	0	3	342.483	3.185	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1cc(C)c(C)s1)C[C@@H](C)O2	ZINC001098660695	1363424087	/nfs/dbraw/zinc/42/40/87/1363424087.db2.gz	WNTJVNOCWQGCAK-OAHLLOKOSA-N	0	3	348.512	3.246	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2cc3ccncc3s2)C1	ZINC001098874873	1363501516	/nfs/dbraw/zinc/50/15/16/1363501516.db2.gz	IRJHJVZIMVMMTG-KXBFYZLASA-N	0	3	341.480	3.457	20	30		EGEDHN
CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1csc(C#N)c1	ZINC001324458880	1387629548	/nfs/dbraw/zinc/62/95/48/1387629548.db2.gz	JAHOFHMGYQXZBI-UHFFFAOYSA-N	0	3	347.871	3.477	20	30		EGEDHN
C#CCCN1C[C@@H]2CCC[C@]2(NC(=O)c2oc(C(F)F)cc2C)C1	ZINC001098885849	1363504936	/nfs/dbraw/zinc/50/49/36/1363504936.db2.gz	QEHYDEBKFQBRMD-UGSOOPFHSA-N	0	3	336.382	3.133	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)Cc2cccc(C)c2Cl)C1	ZINC001098940623	1363530278	/nfs/dbraw/zinc/53/02/78/1363530278.db2.gz	AQLHSJBWMYBSRA-PXNSSMCTSA-N	0	3	344.886	3.185	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(-c3ccco3)on2)C1	ZINC001098965564	1363544849	/nfs/dbraw/zinc/54/48/49/1363544849.db2.gz	LLGJGRWSCQNSOY-LIRRHRJNSA-N	0	3	341.411	3.095	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cnc3ccsc3c2)C1	ZINC001098974373	1363549239	/nfs/dbraw/zinc/54/92/39/1363549239.db2.gz	RMLQLEFDGKZAMJ-KSSFIOAISA-N	0	3	327.453	3.067	20	30		EGEDHN
CC(C)(C)C#CC(=O)NC[C@@H]1CCC(C)(C)CN1C[C@@H]1CCCCO1	ZINC001099070323	1363606657	/nfs/dbraw/zinc/60/66/57/1363606657.db2.gz	VUUFLCQGTNUVMP-ROUUACIJSA-N	0	3	348.531	3.212	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)Cc1cc(C2CC2)no1	ZINC001099106443	1363624694	/nfs/dbraw/zinc/62/46/94/1363624694.db2.gz	GEGCQILIWLPXOD-INIZCTEOSA-N	0	3	345.487	3.277	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H](C)C(C)(C)C	ZINC001099121287	1363636136	/nfs/dbraw/zinc/63/61/36/1363636136.db2.gz	JXHJLFJDRDGQHL-SJORKVTESA-N	0	3	338.536	3.478	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC001099132390	1363644621	/nfs/dbraw/zinc/64/46/21/1363644621.db2.gz	KISDPIVPAMMUCZ-RDJZCZTQSA-N	0	3	338.373	3.476	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)Cc1sc(C)nc1C	ZINC001099145226	1363653853	/nfs/dbraw/zinc/65/38/53/1363653853.db2.gz	UTBBNIKMHZGYES-HNNXBMFYSA-N	0	3	335.517	3.095	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2csc3c2CCCC3)C1	ZINC001099150739	1363657115	/nfs/dbraw/zinc/65/71/15/1363657115.db2.gz	XRHLLKWHNRJAOY-LIRRHRJNSA-N	0	3	330.497	3.397	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)C2CC(c3ccc(F)cc3)C2)C1	ZINC001099186444	1363680116	/nfs/dbraw/zinc/68/01/16/1363680116.db2.gz	DJDXGJGNVCLJDN-XVAHUTHZSA-N	0	3	342.458	3.476	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@H]1CCC(C)(C)CN1CCOC1CCC1	ZINC001099189818	1363682869	/nfs/dbraw/zinc/68/28/69/1363682869.db2.gz	XLLNAQVZXVHXJG-SFHVURJKSA-N	0	3	348.531	3.356	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H]1C[C@H]1CCC	ZINC001099220796	1363698668	/nfs/dbraw/zinc/69/86/68/1363698668.db2.gz	SHFAZODKFQVYHY-FGTMMUONSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)C=C2CCCCC2)C[C@H]1C(F)(F)F	ZINC001099222621	1363699329	/nfs/dbraw/zinc/69/93/29/1363699329.db2.gz	VACICMGWPJBEGP-HUUCEWRRSA-N	0	3	330.394	3.432	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2cccc(Cl)c2C)C[C@H]1C(F)(F)F	ZINC001099256334	1363716993	/nfs/dbraw/zinc/71/69/93/1363716993.db2.gz	BUYSQFSTQBWJJZ-TZMCWYRMSA-N	0	3	346.780	3.427	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@@H]2C[C@@H]3C=C[C@H]2CC3)C[C@H]1C(F)(F)F	ZINC001099254951	1363717116	/nfs/dbraw/zinc/71/71/16/1363717116.db2.gz	BVTFWRQRKRGYKQ-YIDVYQOGSA-N	0	3	342.405	3.144	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)CCc2ccsc2)C[C@H]1C(F)(F)F	ZINC001099261962	1363720917	/nfs/dbraw/zinc/72/09/17/1363720917.db2.gz	AUNPPIHUZUHTQS-ZIAGYGMSSA-N	0	3	346.418	3.236	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)Cc1ccccc1COC	ZINC001099263684	1363721312	/nfs/dbraw/zinc/72/13/12/1363721312.db2.gz	IIKCSSURUSJYNN-IBGZPJMESA-N	0	3	344.499	3.168	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H]1C[C@H]1C1CCC1	ZINC001099264189	1363721425	/nfs/dbraw/zinc/72/14/25/1363721425.db2.gz	OWBGSRICDXQYNY-CEXWTWQISA-N	0	3	348.531	3.232	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2ccc(CC)s2)C[C@H]1C(F)(F)F	ZINC001099275150	1363726936	/nfs/dbraw/zinc/72/69/36/1363726936.db2.gz	AWXOYJQNVGNMEZ-CHWSQXEVSA-N	0	3	346.418	3.479	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@@]23C[C@@H]2CCCC3)C[C@H]1C(F)(F)F	ZINC001099302787	1363739333	/nfs/dbraw/zinc/73/93/33/1363739333.db2.gz	BSNQUSHERRZAEG-NHIYQJMISA-N	0	3	330.394	3.122	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(C)cc1	ZINC001099316251	1363746434	/nfs/dbraw/zinc/74/64/34/1363746434.db2.gz	PDJDBPVGBWHGKR-LJQANCHMSA-N	0	3	344.499	3.418	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2cc3sccc3[nH]2)C[C@H]1C(F)(F)F	ZINC001099329649	1363753701	/nfs/dbraw/zinc/75/37/01/1363753701.db2.gz	ZUTOTRHPKVOXGL-BXKDBHETSA-N	0	3	343.374	3.008	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)CCc1ccccc1OC	ZINC001099334474	1363755964	/nfs/dbraw/zinc/75/59/64/1363755964.db2.gz	JPVQESAJCIPQDS-GOSISDBHSA-N	0	3	344.499	3.421	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)COc1cc(C)ccc1C	ZINC001099340349	1363760528	/nfs/dbraw/zinc/76/05/28/1363760528.db2.gz	RZBOEDZIWVNVDT-SFHVURJKSA-N	0	3	344.499	3.475	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H](C)C1CCOCC1	ZINC001099379260	1363780750	/nfs/dbraw/zinc/78/07/50/1363780750.db2.gz	ILYQTJYMARWMCM-FUHWJXTLSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCC2CCCC2)CC2(CCOCC2)C1	ZINC001099559734	1363848611	/nfs/dbraw/zinc/84/86/11/1363848611.db2.gz	HBWZJPLAKDWPRZ-SFHVURJKSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C[C@H](C)C(C)C)CC2(CCOCC2)C1	ZINC001099569419	1363855152	/nfs/dbraw/zinc/85/51/52/1363855152.db2.gz	ANPILADMUSVQCQ-ROUUACIJSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N[C@H]1CN(CC(=C)C)CC2(CCOCC2)C1	ZINC001099586712	1363868647	/nfs/dbraw/zinc/86/86/47/1363868647.db2.gz	GCKABQCEPRWXHE-IZTKXNPESA-N	0	3	332.488	3.072	20	30		EGEDHN
C=C(C)CN1CC[C@@H](NC(=O)CC(C)(C)C2CCCCC2)[C@@H](O)C1	ZINC001100074803	1364009494	/nfs/dbraw/zinc/00/94/94/1364009494.db2.gz	SWDFTSZSJGVLSO-MSOLQXFVSA-N	0	3	336.520	3.111	20	30		EGEDHN
C[C@H](C#N)C(=O)NCC1CC(NCc2cc(Cl)ccc2Cl)C1	ZINC001100196553	1364042267	/nfs/dbraw/zinc/04/22/67/1364042267.db2.gz	MYYSXPAPGBVDLY-CDWSIMAYSA-N	0	3	340.254	3.137	20	30		EGEDHN
N#Cc1ccc(F)c(CNC2CC(CNC(=O)CCC3CCC3)C2)c1	ZINC001100226804	1364050951	/nfs/dbraw/zinc/05/09/51/1364050951.db2.gz	RVTVYHZOIOJXCU-UHFFFAOYSA-N	0	3	343.446	3.262	20	30		EGEDHN
CC(C)(C)C#CC(=O)NCC1CC(NCc2ccccc2Cl)C1	ZINC001100317035	1364078382	/nfs/dbraw/zinc/07/83/82/1364078382.db2.gz	AWRGYVWERIBFCF-UHFFFAOYSA-N	0	3	332.875	3.374	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)CCO[C@H](C)CC(C)C)C1	ZINC001100325999	1364080669	/nfs/dbraw/zinc/08/06/69/1364080669.db2.gz	GQPQOALUGZLJCT-QQFBHYJXSA-N	0	3	330.900	3.065	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@H](CC)OC2CCCCC2)C1	ZINC001100331852	1364081882	/nfs/dbraw/zinc/08/18/82/1364081882.db2.gz	LONSEKNEHZFVPF-DQPZFDDXSA-N	0	3	342.911	3.351	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C[C@H](OCC)C2=CCCC2)C1	ZINC001100331093	1364081974	/nfs/dbraw/zinc/08/19/74/1364081974.db2.gz	VLUURDZLXMIYSR-PREGVCBESA-N	0	3	340.895	3.129	20	30		EGEDHN
O=C(NCC1CC(NCC#Cc2ccccc2)C1)C1(C2CC2)CCC1	ZINC001100539365	1364151370	/nfs/dbraw/zinc/15/13/70/1364151370.db2.gz	HLYQMFAACOBYNA-UHFFFAOYSA-N	0	3	336.479	3.103	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC1CC(NCc2cnc(Cl)s2)C1	ZINC001100559693	1364162140	/nfs/dbraw/zinc/16/21/40/1364162140.db2.gz	HFAFJIDLEVJCHT-UHFFFAOYSA-N	0	3	341.908	3.383	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@H](c2ccncc2)C(C)C)C1	ZINC001100611105	1364187977	/nfs/dbraw/zinc/18/79/77/1364187977.db2.gz	KKVSMRXASLZDSY-PREGVCBESA-N	0	3	335.879	3.058	20	30		EGEDHN
Cc1cccc(CC(=O)NCC2CC(NCC#Cc3ccccc3)C2)c1	ZINC001100630027	1364195975	/nfs/dbraw/zinc/19/59/75/1364195975.db2.gz	PXILTURPDZQLIK-UHFFFAOYSA-N	0	3	346.474	3.074	20	30		EGEDHN
CC1(C(=O)NCC2CC(NCc3ccc(C#N)cc3F)C2)CC=CC1	ZINC001100640560	1364200732	/nfs/dbraw/zinc/20/07/32/1364200732.db2.gz	OOGMJHDVTXSSFT-UHFFFAOYSA-N	0	3	341.430	3.038	20	30		EGEDHN
CC1(C)CC[C@H](C(=O)NCC2CC(NCC#Cc3ccccc3)C2)C1	ZINC001100655662	1364206658	/nfs/dbraw/zinc/20/66/58/1364206658.db2.gz	VCWAVLMQJOZKNF-GPJFCIFZSA-N	0	3	338.495	3.349	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC2CC(NCc3cc(F)ccc3F)C2)C1	ZINC001100661270	1364208392	/nfs/dbraw/zinc/20/83/92/1364208392.db2.gz	KSIVSKCELLDUSG-UHFFFAOYSA-N	0	3	334.410	3.306	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@H](C)Cc2ccccc2F)C1	ZINC001100674100	1364213157	/nfs/dbraw/zinc/21/31/57/1364213157.db2.gz	MKZBTXOVANHBOY-XEBKBJJBSA-N	0	3	338.854	3.241	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H]1C(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100687897	1364219080	/nfs/dbraw/zinc/21/90/80/1364219080.db2.gz	SJSRJDFIZSZFIT-GOLJUSPKSA-N	0	3	338.495	3.205	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)[C@H](C)CC(C)(C)C)C1	ZINC001100734100	1364240563	/nfs/dbraw/zinc/24/05/63/1364240563.db2.gz	MSGICQLWLUTOGJ-LMWSTFAQSA-N	0	3	345.325	3.452	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)Cn2cc(C)c3ccccc32)C1	ZINC001100752723	1364247123	/nfs/dbraw/zinc/24/71/23/1364247123.db2.gz	NMXQVXXHUIMGDD-UHFFFAOYSA-N	0	3	345.874	3.187	20	30		EGEDHN
CC(C)(C)CCC(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100769563	1364253287	/nfs/dbraw/zinc/25/32/87/1364253287.db2.gz	PSWLSFCOFJVTTF-UHFFFAOYSA-N	0	3	326.484	3.349	20	30		EGEDHN
CC(C)(C)CCC(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100769337	1364253372	/nfs/dbraw/zinc/25/33/72/1364253372.db2.gz	FJNAHJYOEFPYFV-UHFFFAOYSA-N	0	3	344.474	3.488	20	30		EGEDHN
CCC1(C(=O)NCC2CC(NCC#Cc3ccccc3)C2)CCCC1	ZINC001100816523	1364276271	/nfs/dbraw/zinc/27/62/71/1364276271.db2.gz	KCGQGNQUPLHEMJ-UHFFFAOYSA-N	0	3	338.495	3.493	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)CCc2ccc(C)s2)C1	ZINC001101076066	1364401599	/nfs/dbraw/zinc/40/15/99/1364401599.db2.gz	TZSPHUHWFNNSKA-UHFFFAOYSA-N	0	3	326.893	3.226	20	30		EGEDHN
C=CCCCC(=O)N1C[C@H]2CN(Cc3cnccc3C)C[C@@]2(C)C1	ZINC001101346769	1364520216	/nfs/dbraw/zinc/52/02/16/1364520216.db2.gz	GLJLZQDVXOSDIV-QUCCMNQESA-N	0	3	327.472	3.027	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@H]2CN(Cc3cncc(C)c3)C[C@@]2(C)C1	ZINC001101378367	1364535914	/nfs/dbraw/zinc/53/59/14/1364535914.db2.gz	WTFNBLAAENBLFD-NQIIRXRSSA-N	0	3	341.499	3.273	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)C[C@H](c3ccccc3)C(C)C)C[C@]2(C)C1	ZINC001101426485	1364558193	/nfs/dbraw/zinc/55/81/93/1364558193.db2.gz	JGINYOZETLKMET-URVUXULASA-N	0	3	338.495	3.230	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)CCCc3sccc3C)C[C@]2(C)C1	ZINC001101447768	1364568313	/nfs/dbraw/zinc/56/83/13/1364568313.db2.gz	LMDZEWSIICIENB-XLIONFOSSA-N	0	3	344.524	3.183	20	30		EGEDHN
CC#CCCCC(=O)N1CCC(C(C)(C)CNCc2ccon2)CC1	ZINC001101565613	1364622128	/nfs/dbraw/zinc/62/21/28/1364622128.db2.gz	APDMQQGKNYDVOV-UHFFFAOYSA-N	0	3	345.487	3.223	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1CC2(CN(C[C@H](C)CC)C2)n2ccnc21	ZINC001101646674	1364669681	/nfs/dbraw/zinc/66/96/81/1364669681.db2.gz	UKLMRSUNWFFSAG-CVEARBPZSA-N	0	3	344.503	3.103	20	30		EGEDHN
CC(C)=C(F)C(=O)NC[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1C	ZINC001101876569	1364761690	/nfs/dbraw/zinc/76/16/90/1364761690.db2.gz	WFNCWTMNKCAWLS-CZUORRHYSA-N	0	3	347.409	3.145	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@@H]1CN([C@H](C)c2cnc(C)cn2)C[C@H]1C	ZINC001102006713	1364809493	/nfs/dbraw/zinc/80/94/93/1364809493.db2.gz	PUOQSQHLNWMPEV-DJIMGWMZSA-N	0	3	344.503	3.132	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H]1CN(Cc2c(C)nsc2C)C[C@H]1C	ZINC001102226368	1364943790	/nfs/dbraw/zinc/94/37/90/1364943790.db2.gz	NAQXFKNRDMBNBL-IUODEOHRSA-N	0	3	335.517	3.156	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1CNC(=O)C1(C)CCC1	ZINC001102233185	1364950238	/nfs/dbraw/zinc/95/02/38/1364950238.db2.gz	NBICGKYMVMOMIL-RHSMWYFYSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@@H]1CN(Cc2c(C)noc2CC)C[C@H]1C	ZINC001102411124	1365043863	/nfs/dbraw/zinc/04/38/63/1365043863.db2.gz	GTXZPJOLLIEKBO-GDBMZVCRSA-N	0	3	347.503	3.332	20	30		EGEDHN
C=CCCC(=O)NCC[C@@H]1CN(Cc2ccncc2Cl)C[C@H]1C	ZINC001102760040	1365205832	/nfs/dbraw/zinc/20/58/32/1365205832.db2.gz	BSRKULDEJPYOBU-HUUCEWRRSA-N	0	3	335.879	3.275	20	30		EGEDHN
CC(C)=C(F)C(=O)NCC[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1C	ZINC001102855272	1365254363	/nfs/dbraw/zinc/25/43/63/1365254363.db2.gz	PCEYLOSYRNOSRB-NVXWUHKLSA-N	0	3	343.446	3.396	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cc(C)nc(C)c2)C1	ZINC001103034283	1365348652	/nfs/dbraw/zinc/34/86/52/1365348652.db2.gz	PZOMFRVBGITFTK-MLGOLLRUSA-N	0	3	335.879	3.139	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)cc2F)C[C@H]1CCNC(=O)CCCF	ZINC001103324183	1365495664	/nfs/dbraw/zinc/49/56/64/1365495664.db2.gz	PEBBPFQPIGVFGF-GDBMZVCRSA-N	0	3	349.425	3.021	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1CCNC(=O)CCCF	ZINC001103324240	1365495813	/nfs/dbraw/zinc/49/58/13/1365495813.db2.gz	RVRKKZDBQFLLQN-RHSMWYFYSA-N	0	3	349.425	3.021	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCC[C@@H]1CN(Cc2cnc(C)o2)C[C@H]1C	ZINC001103344703	1365510695	/nfs/dbraw/zinc/51/06/95/1365510695.db2.gz	PXQFESSACVLBAK-BFYDXBDKSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC[C@@H]1CN(Cc2ccc(F)cn2)C[C@H]1C	ZINC001103402007	1365538079	/nfs/dbraw/zinc/53/80/79/1365538079.db2.gz	XEOYXCUKDSAGLK-QINHECLXSA-N	0	3	347.478	3.397	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2coc(CCC)n2)C1	ZINC001103639628	1365695433	/nfs/dbraw/zinc/69/54/33/1365695433.db2.gz	HQRPPGHLZAEMHJ-TZMCWYRMSA-N	0	3	339.867	3.067	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)cc2F)C[C@H]1CCNC(=O)C(C)(C)C	ZINC001103667936	1365715420	/nfs/dbraw/zinc/71/54/20/1365715420.db2.gz	XEIMTVWEWRHKOF-GDBMZVCRSA-N	0	3	345.462	3.318	20	30		EGEDHN
CC/C=C(\C)C(=O)N1C[C@@H](C)[C@H](CCNCc2ccccc2C#N)C1	ZINC001103948403	1365844247	/nfs/dbraw/zinc/84/42/47/1365844247.db2.gz	PQBIJKHHXKWBRY-HQCIXDDXSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H](C)[C@H](CCNCc2ocnc2C)C1	ZINC001104231563	1365961694	/nfs/dbraw/zinc/96/16/94/1365961694.db2.gz	GMFJQXYSRICMSF-CRAIPNDOSA-N	0	3	345.487	3.326	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cc(C)nc(C)c2)C[C@H]1C	ZINC001104241087	1365966504	/nfs/dbraw/zinc/96/65/04/1365966504.db2.gz	JXVVYJLPMHOYOU-MLGOLLRUSA-N	0	3	335.879	3.139	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2conc2C(C)C)C[C@H]1C	ZINC001104287186	1365976440	/nfs/dbraw/zinc/97/64/40/1365976440.db2.gz	WZCDRKOOAJLZKO-TZMCWYRMSA-N	0	3	339.867	3.238	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)CC2CC(F)(F)C2)C[C@H]1C	ZINC001104364850	1365989038	/nfs/dbraw/zinc/98/90/38/1365989038.db2.gz	IDUGXONRQDGDIP-BXUZGUMPSA-N	0	3	334.838	3.249	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2occ3c2CCC3)C[C@H]1C	ZINC001104453585	1366034258	/nfs/dbraw/zinc/03/42/58/1366034258.db2.gz	IFJBVOQPHFQDOR-TZMCWYRMSA-N	0	3	336.863	3.209	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@H](CCNCc2cnc(C)o2)C1	ZINC001104485820	1366045098	/nfs/dbraw/zinc/04/50/98/1366045098.db2.gz	PKTQMPRIDXCGKT-GDBMZVCRSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H](C)[C@H](CCNCc2ccn(CC)n2)C1	ZINC001104563839	1366078588	/nfs/dbraw/zinc/07/85/88/1366078588.db2.gz	WZGSZSSTLBQXEZ-KZNAEPCWSA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cc(C(C)C)no2)C[C@H]1C	ZINC001104752802	1366157355	/nfs/dbraw/zinc/15/73/55/1366157355.db2.gz	MGBWUPLJMWOOMU-TZMCWYRMSA-N	0	3	339.867	3.238	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](CNCc2nsc3ccccc23)[C@H](C)C1	ZINC001105929006	1366599829	/nfs/dbraw/zinc/59/98/29/1366599829.db2.gz	CQSRRQFAGCTAKG-HUUCEWRRSA-N	0	3	343.496	3.447	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001106193880	1366620908	/nfs/dbraw/zinc/62/09/08/1366620908.db2.gz	WZHGCXSKSQCTHM-VQIMIIECSA-N	0	3	325.456	3.099	20	30		EGEDHN
CC#CCCCC(=O)N1C[C@@H](CNC/C(Cl)=C\Cl)[C@H](C)C1	ZINC001106559479	1366735257	/nfs/dbraw/zinc/73/52/57/1366735257.db2.gz	WMGJNDFOZRISLB-RNRBBCFGSA-N	0	3	331.287	3.183	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](CNCc2nc3ccccc3o2)[C@H](C)C1	ZINC001106607421	1366753558	/nfs/dbraw/zinc/75/35/58/1366753558.db2.gz	XXTWCEOJZNXVST-HZPDHXFCSA-N	0	3	341.455	3.368	20	30		EGEDHN
CCCCCCCCC(=O)N1C[C@@H](CNCc2nccn2C)[C@H](C)C1	ZINC001106912396	1366831071	/nfs/dbraw/zinc/83/10/71/1366831071.db2.gz	ZLRAAXHIHDGXLJ-QZTJIDSGSA-N	0	3	348.535	3.355	20	30		EGEDHN
C#CCCCC(=O)NC[C@]12CCC[C@H]1N(Cc1ccccc1F)CC2	ZINC001107384393	1366948906	/nfs/dbraw/zinc/94/89/06/1366948906.db2.gz	BZNMQWKDLAUMDS-TZIWHRDSSA-N	0	3	342.458	3.490	20	30		EGEDHN
O=C(C#CC1CC1)NC[C@]12CCC[C@H]1N(Cc1cccc(F)c1)CC2	ZINC001107398290	1366952258	/nfs/dbraw/zinc/95/22/58/1366952258.db2.gz	NPIRKOWXNMHRCL-TZIWHRDSSA-N	0	3	340.442	3.100	20	30		EGEDHN
C#CCC1(C(=O)NC[C@]23CCC[C@H]2N(C/C=C/Cl)CC3)CCC1	ZINC001107433726	1366962085	/nfs/dbraw/zinc/96/20/85/1366962085.db2.gz	ADWRUQPMZPWDKE-APKDZRTCSA-N	0	3	334.891	3.293	20	30		EGEDHN
CC(C)[C@@H](C)CC(=O)N1CC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001189326037	1366991311	/nfs/dbraw/zinc/99/13/11/1366991311.db2.gz	CJQCRUUIAQWCDS-QFBILLFUSA-N	0	3	327.472	3.273	20	30		EGEDHN
C=CCCCC(=O)NC[C@]12CCC[C@H]1N(Cc1nccnc1C)CC2	ZINC001107524239	1367017398	/nfs/dbraw/zinc/01/73/98/1367017398.db2.gz	ONJDAAFUYLFBGX-UYAOXDASSA-N	0	3	342.487	3.002	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCN(C(=O)/C=C/C(C)(C)C)C1	ZINC001189437748	1367021577	/nfs/dbraw/zinc/02/15/77/1367021577.db2.gz	HWTZHOKCZOCGEK-SXAWMYDMSA-N	0	3	325.456	3.193	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@]12CCC[C@H]1N(Cc1ocnc1C)CC2	ZINC001107533756	1367024866	/nfs/dbraw/zinc/02/48/66/1367024866.db2.gz	FEETXIZCQMCIHL-YZGWKJHDSA-N	0	3	345.487	3.446	20	30		EGEDHN
CCC[C@H](C)C(=O)N1CC[C@@H](N(C)Cc2ccc(OCC#N)cc2)C1	ZINC001189460336	1367027632	/nfs/dbraw/zinc/02/76/32/1367027632.db2.gz	LKASZWCKFXSCCL-FUHWJXTLSA-N	0	3	343.471	3.058	20	30		EGEDHN
C=CCOCCCC(=O)N1CC[C@@H](N(C)Cc2ccc(CF)cc2)C1	ZINC001189564381	1367055233	/nfs/dbraw/zinc/05/52/33/1367055233.db2.gz	BPOHGWVYXCYERC-LJQANCHMSA-N	0	3	348.462	3.172	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2ccccc2F)C1	ZINC001107701251	1367109723	/nfs/dbraw/zinc/10/97/23/1367109723.db2.gz	YWGKAAJRXDZRMH-BEFAXECRSA-N	0	3	334.435	3.001	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)[C@H](F)CCCCCC)[C@@H]2C1	ZINC001189794872	1367110041	/nfs/dbraw/zinc/11/00/41/1367110041.db2.gz	ZBOLXGFZABGHQE-RCCFBDPRSA-N	0	3	340.483	3.030	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2ccccc2C)C1	ZINC001107706741	1367113185	/nfs/dbraw/zinc/11/31/85/1367113185.db2.gz	XKRKFQMAKQSWGR-PXNSSMCTSA-N	0	3	330.472	3.170	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2cc(C)oc2C)C1	ZINC001107731893	1367120747	/nfs/dbraw/zinc/12/07/47/1367120747.db2.gz	UKRSEAGMXVHABS-LIRRHRJNSA-N	0	3	334.460	3.072	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](N(C)CCOc2ccccc2Cl)C1	ZINC001189926827	1367133930	/nfs/dbraw/zinc/13/39/30/1367133930.db2.gz	SUGGIQPCUCXKKT-MRXNPFEDSA-N	0	3	348.874	3.055	20	30		EGEDHN
C#CCCCC(=O)NC[C@@]1(C)CN(CC2CCC(C)(C)CC2)CCO1	ZINC001107901434	1367196313	/nfs/dbraw/zinc/19/63/13/1367196313.db2.gz	PLNARYRSWVMHDF-NRFANRHFSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCCOc1ccccc1C)C2	ZINC001109586190	1367212318	/nfs/dbraw/zinc/21/23/18/1367212318.db2.gz	MINMHNPUBJYWPA-QYZOEREBSA-N	0	3	342.483	3.452	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1nc(Cl)cs1)C2	ZINC001109640480	1367258836	/nfs/dbraw/zinc/25/88/36/1367258836.db2.gz	IYUXZYPLLHDZEZ-WOPDTQHZSA-N	0	3	325.865	3.098	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3CCCOC(C)C)CCC1	ZINC001109680630	1367278829	/nfs/dbraw/zinc/27/88/29/1367278829.db2.gz	RJWKVCGMOIOQQR-SQNIBIBYSA-N	0	3	334.504	3.269	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3C[C@@H]2CCCCO2)CCC1	ZINC001109680738	1367278940	/nfs/dbraw/zinc/27/89/40/1367278940.db2.gz	WOOXTZBRYPRMSX-OWSLCNJRSA-N	0	3	332.488	3.023	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](CC)c1c(C)noc1C)C2	ZINC001109844791	1367354565	/nfs/dbraw/zinc/35/45/65/1367354565.db2.gz	IKTBIHYPCXBGHV-QZWWFDLISA-N	0	3	331.460	3.083	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2csc(C)c2)C1	ZINC001108280707	1367377394	/nfs/dbraw/zinc/37/73/94/1367377394.db2.gz	XPXMIARJGVGPCO-RDTXWAMCSA-N	0	3	336.501	3.232	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)C2(F)CCCCC2)C1	ZINC001108322626	1367390147	/nfs/dbraw/zinc/39/01/47/1367390147.db2.gz	AGAWDXRPOKLQSS-FUHWJXTLSA-N	0	3	340.483	3.221	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](C)Cc1ccc(F)cc1)C2	ZINC001110189857	1367556363	/nfs/dbraw/zinc/55/63/63/1367556363.db2.gz	SKJWKGCZJQZMON-VLQPXKRTSA-N	0	3	330.447	3.302	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1C[C@H]2C[C@@H](C1)N(C(=O)CCC(F)F)C2	ZINC001108730509	1367562438	/nfs/dbraw/zinc/56/24/38/1367562438.db2.gz	QFRUSHQFBPDKHZ-JQFCIGGWSA-N	0	3	347.409	3.073	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H](N(C)CCOc2cccc(F)c2)C1	ZINC001191911540	1367634509	/nfs/dbraw/zinc/63/45/09/1367634509.db2.gz	HFTWJFSAWLKPFD-AEFFLSMTSA-N	0	3	348.462	3.340	20	30		EGEDHN
CC#CCN1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)C(C)C)C1	ZINC001186179819	1387891629	/nfs/dbraw/zinc/89/16/29/1387891629.db2.gz	GPWMYGHCWUXHLY-IEBWSBKVSA-N	0	3	330.447	3.027	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](N(C)Cc2ccc(COC)cc2)C1	ZINC001192073309	1367680569	/nfs/dbraw/zinc/68/05/69/1367680569.db2.gz	SEWDDWGYGRVAMA-LJQANCHMSA-N	0	3	330.472	3.222	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2[C@H](C)c1cccc(OC)c1	ZINC001109058728	1367744288	/nfs/dbraw/zinc/74/42/88/1367744288.db2.gz	IXCIOFKOQDNLLO-JZGRTCEGSA-N	0	3	328.456	3.444	20	30		EGEDHN
C=CCOCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccc(C(C)C)cc1	ZINC001109073041	1367751500	/nfs/dbraw/zinc/75/15/00/1367751500.db2.gz	WMLGLVFABQEJLJ-AABGKKOBSA-N	0	3	342.483	3.234	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccc2ccccc2c1	ZINC001109089207	1367761290	/nfs/dbraw/zinc/76/12/90/1367761290.db2.gz	ZLVCTHIQAQBIPQ-FCDRMGDPSA-N	0	3	333.435	3.221	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCc1ccc(Cl)cc1	ZINC001110494137	1367780771	/nfs/dbraw/zinc/78/07/71/1367780771.db2.gz	JEUCPBIMWOHHOA-QRVBRYPASA-N	0	3	344.886	3.408	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)[C@H](C)CC2CCCCC2)C1	ZINC001192641576	1367840945	/nfs/dbraw/zinc/84/09/45/1367840945.db2.gz	LNHHEFPPJXRPTO-IEBWSBKVSA-N	0	3	336.520	3.328	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCN(C(=O)CCC(C)(C)C)C1	ZINC001192947097	1367909252	/nfs/dbraw/zinc/90/92/52/1367909252.db2.gz	HRJXIUUFGRBKGL-SFHVURJKSA-N	0	3	327.472	3.417	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@@H](C)c1c(C)noc1C)C2	ZINC001110736938	1367953933	/nfs/dbraw/zinc/95/39/33/1367953933.db2.gz	SZESIJUGNVGAOT-YYQUZTFQSA-N	0	3	331.460	3.083	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2cc(C(C)C)oc2C)C1	ZINC001193205364	1367966100	/nfs/dbraw/zinc/96/61/00/1367966100.db2.gz	SNNCWLCNUFYKKX-INIZCTEOSA-N	0	3	334.460	3.060	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C1CCCCCCC1)C2	ZINC001110791077	1367990933	/nfs/dbraw/zinc/99/09/33/1367990933.db2.gz	FYPIQEQDPIJLKG-QRVBRYPASA-N	0	3	334.504	3.271	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1c(C)noc1C1CC1)C2	ZINC001110826248	1368011560	/nfs/dbraw/zinc/01/15/60/1368011560.db2.gz	BEABLJOHMNCJNU-OAGGEKHMSA-N	0	3	329.444	3.162	20	30		EGEDHN
C=CC1(CC(=O)N2CC[C@@H](NCc3cnc(C)nc3)C2)CCCCC1	ZINC001186281276	1387914702	/nfs/dbraw/zinc/91/47/02/1387914702.db2.gz	XTVLGQIXEILFNU-GOSISDBHSA-N	0	3	342.487	3.002	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CC1CC(F)(F)C1	ZINC001110900701	1368074269	/nfs/dbraw/zinc/07/42/69/1368074269.db2.gz	MFYPIEDTZJFVAJ-ZACQAIPSSA-N	0	3	338.442	3.337	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCOCc1ccccc1	ZINC001110967127	1368127766	/nfs/dbraw/zinc/12/77/66/1368127766.db2.gz	SZZOBZGICMCUJF-AQNXPRMDSA-N	0	3	342.483	3.281	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C1(CCOCC)CCCC1)C2	ZINC001111187507	1368183243	/nfs/dbraw/zinc/18/32/43/1368183243.db2.gz	VZZKQMREJAQNEE-KURKYZTESA-N	0	3	334.504	3.271	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@@H](N(C)C[C@H]3CCCCO3)C2)CCCCC1	ZINC001194367323	1368244458	/nfs/dbraw/zinc/24/44/58/1368244458.db2.gz	FAWUEXPWZSBRLK-RTBURBONSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](C)c1ccc(C)cc1)C2	ZINC001111288939	1368254769	/nfs/dbraw/zinc/25/47/69/1368254769.db2.gz	ZYQHCAYRASODCM-NBYUQASBSA-N	0	3	342.483	3.023	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)C(C)(C)c2ccccc2C)C1	ZINC001194502346	1368275016	/nfs/dbraw/zinc/27/50/16/1368275016.db2.gz	MANZQIFUAKVLCT-GOSISDBHSA-N	0	3	344.499	3.008	20	30		EGEDHN
C=CCC[C@H](C)N1[C@@H]2CC[C@H]1[C@H](NC(=O)c1scnc1Cl)C2	ZINC001111410380	1368303077	/nfs/dbraw/zinc/30/30/77/1368303077.db2.gz	DLRCCHAIYICVJU-LOWDOPEQSA-N	0	3	339.892	3.486	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCc1cccc(OCC)c1)C2	ZINC001111479179	1368316989	/nfs/dbraw/zinc/31/69/89/1368316989.db2.gz	JSUGZZXUEMPPLJ-RLLQIKCJSA-N	0	3	342.483	3.316	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H](CC)CCCC)C[C@@H](C)O2	ZINC001111535884	1368334462	/nfs/dbraw/zinc/33/44/62/1368334462.db2.gz	SSCFFLVKGRSYRU-MSOLQXFVSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N[C@]12CCC[C@H]1CN(Cc1ccsc1)C2	ZINC001111643131	1368405323	/nfs/dbraw/zinc/40/53/23/1368405323.db2.gz	XKOVIZFWJXOXLV-IEZWGBDMSA-N	0	3	348.512	3.200	20	30		EGEDHN
N#Cc1c[nH]c(C(=O)N2CCCN(CC/C=C\c3ccccc3)CC2)c1	ZINC001195434891	1368436373	/nfs/dbraw/zinc/43/63/73/1368436373.db2.gz	UNXVHEWKQQABTI-WTKPLQERSA-N	0	3	348.450	3.138	20	30		EGEDHN
Cc1ccc(F)cc1CN1C[C@@H]2CCC[C@]2(NC(=O)C#CC2CC2)C1	ZINC001111740589	1368437837	/nfs/dbraw/zinc/43/78/37/1368437837.db2.gz	FJJRIJSYXRWVDI-RXVVDRJESA-N	0	3	340.442	3.018	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)COc2cccc(C(C)C)c2)C1	ZINC001111758928	1368446623	/nfs/dbraw/zinc/44/66/23/1368446623.db2.gz	RDLRSFOWVUHODG-RXVVDRJESA-N	0	3	342.483	3.346	20	30		EGEDHN
C#CCN1C[C@@H]2CCC[C@]2(NC(=O)CC(C)(C)c2ccc(F)cc2)C1	ZINC001111778266	1368457725	/nfs/dbraw/zinc/45/77/25/1368457725.db2.gz	RJNALLBAIVBPMT-UWJYYQICSA-N	0	3	342.458	3.097	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3CCC[C@]3(NC(=O)CCC(F)F)C2)cc1	ZINC001111809922	1368474382	/nfs/dbraw/zinc/47/43/82/1368474382.db2.gz	YTSZSTJJDBAJPR-LPHOPBHVSA-N	0	3	347.409	3.074	20	30		EGEDHN
C=CCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(C#N)cc1)C2	ZINC001111859286	1368510399	/nfs/dbraw/zinc/51/03/99/1368510399.db2.gz	YINPWIVGHKQSGQ-FPOVZHCZSA-N	0	3	337.467	3.385	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1CN(CCC2CCCCCC2)C[C@H]1O	ZINC001195923501	1368517933	/nfs/dbraw/zinc/51/79/33/1368517933.db2.gz	DINDVXLTGVLXQU-GGPKGHCWSA-N	0	3	336.520	3.111	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(C#N)cc1)C2	ZINC001111887874	1368532050	/nfs/dbraw/zinc/53/20/50/1368532050.db2.gz	DPHNRXNDZZVDQX-LRQRDZAKSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=CCC[C@H](C)N1CCCN(C(=O)c2ncoc2C(F)(F)F)CC1	ZINC001196357239	1368596179	/nfs/dbraw/zinc/59/61/79/1368596179.db2.gz	CHUSKGKHYFHEBF-LBPRGKRZSA-N	0	3	345.365	3.196	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2ccc(COC)o2)CC1	ZINC001196454941	1368618948	/nfs/dbraw/zinc/61/89/48/1368618948.db2.gz	QUBZQJJFZLMLIN-UHFFFAOYSA-N	0	3	334.460	3.320	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)C[C@@H](C)C(F)(F)F)C[C@H]1C(F)(F)F	ZINC001112157788	1368688687	/nfs/dbraw/zinc/68/86/87/1368688687.db2.gz	CKJYTJOGGWCSGE-GMTAPVOTSA-N	0	3	346.315	3.130	20	30		EGEDHN
C=CCCC1(C(=O)N2CCCN(C[C@H](OC)C3CCC3)CC2)CC1	ZINC001197062483	1368737959	/nfs/dbraw/zinc/73/79/59/1368737959.db2.gz	RMJJHFOYAYEZRE-SFHVURJKSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H]2CCC[C@]2(CNC/C(Cl)=C/Cl)C1	ZINC001112281911	1368747104	/nfs/dbraw/zinc/74/71/04/1368747104.db2.gz	AEQYCQKFHWUAIC-CMTCILLRSA-N	0	3	331.287	3.490	20	30		EGEDHN
C#CCCN1CCCN(C(=O)C[C@@H](CC)c2ccc(C)cc2)CC1	ZINC001197149610	1368755452	/nfs/dbraw/zinc/75/54/52/1368755452.db2.gz	DAQRNDWCJNIRCZ-LJQANCHMSA-N	0	3	326.484	3.436	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=S)Nc1c(F)c(F)cc(F)c1F	ZINC001197423660	1368810364	/nfs/dbraw/zinc/81/03/64/1368810364.db2.gz	RRTHTKXVNQQSGJ-VIFPVBQESA-N	0	3	347.381	3.180	20	30		EGEDHN
C=CC1(CC(=O)N2CCCN(C[C@@H](CC)OC)CC2)CCCCC1	ZINC001197440822	1368814839	/nfs/dbraw/zinc/81/48/39/1368814839.db2.gz	NSIQQSDUYCMMLW-GOSISDBHSA-N	0	3	336.520	3.472	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)C[C@H](CC)C(C)(C)C)C1	ZINC001197744171	1368887815	/nfs/dbraw/zinc/88/78/15/1368887815.db2.gz	SIENMLQYARUFRN-RCCFBDPRSA-N	0	3	338.536	3.357	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2ncccc2OC)CC1	ZINC001197950532	1368930705	/nfs/dbraw/zinc/93/07/05/1368930705.db2.gz	FZLKVFAACXMFQP-UHFFFAOYSA-N	0	3	333.476	3.209	20	30		EGEDHN
C#CCCCCC(=O)N1CCN(C[C@@H]2CCc3ccccc3C2)CC1	ZINC001112774434	1368994833	/nfs/dbraw/zinc/99/48/33/1368994833.db2.gz	XBPMBDFHKFCLCW-LJQANCHMSA-N	0	3	338.495	3.129	20	30		EGEDHN
C#CCCN1CCCN(C(=O)[C@H](C)CCCc2ccccc2)CC1	ZINC001198303745	1369001980	/nfs/dbraw/zinc/00/19/80/1369001980.db2.gz	IENLMCREVXGNEQ-LJQANCHMSA-N	0	3	326.484	3.203	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)CCC2CCCCC2)C1	ZINC001198337476	1369010872	/nfs/dbraw/zinc/01/08/72/1369010872.db2.gz	LTTALLZYDJBKDA-RTBURBONSA-N	0	3	336.520	3.255	20	30		EGEDHN
C=CCCCCCN[C@@H](CNC(=O)CCOC)c1ccccc1OC	ZINC001198463617	1369037774	/nfs/dbraw/zinc/03/77/74/1369037774.db2.gz	PILWJADHDBLJOC-SFHVURJKSA-N	0	3	348.487	3.225	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)c1cccc(F)c1)c1ccccc1OC	ZINC001198509112	1369049258	/nfs/dbraw/zinc/04/92/58/1369049258.db2.gz	RNIBNKOLQRFZAV-SFHVURJKSA-N	0	3	342.414	3.471	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)c1cc(C)on1)c1ccccc1OC	ZINC001198515009	1369050227	/nfs/dbraw/zinc/05/02/27/1369050227.db2.gz	JDEYDYUILZCYJO-KRWDZBQOSA-N	0	3	343.427	3.019	20	30		EGEDHN
C=CCC[C@H](C)N[C@H](CNC(=O)c1ccc[nH]1)c1ccccc1OC	ZINC001198523394	1369052122	/nfs/dbraw/zinc/05/21/22/1369052122.db2.gz	XMJMPKWUXVHYMC-MAUKXSAKSA-N	0	3	341.455	3.439	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)[C@@H](C)SC)c1ccccc1OC	ZINC001198551630	1369059055	/nfs/dbraw/zinc/05/90/55/1369059055.db2.gz	AMKXLFHPDWAIPR-ZBFHGGJFSA-N	0	3	336.501	3.160	20	30		EGEDHN
C=CCC[C@H](C)N[C@@H](CNC(=O)CCCOC)c1ccccc1OC	ZINC001198567243	1369062073	/nfs/dbraw/zinc/06/20/73/1369062073.db2.gz	NWOQVDFUJJZLBQ-WMZOPIPTSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCC[C@H](C)N[C@H](CNC(=O)CCOCC)c1ccccc1OC	ZINC001198606274	1369072228	/nfs/dbraw/zinc/07/22/28/1369072228.db2.gz	PSGSTMBJMFFZAI-FUHWJXTLSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)C(=O)C(C)(C)C)c1ccccc1OC	ZINC001198617605	1369074803	/nfs/dbraw/zinc/07/48/03/1369074803.db2.gz	OYGOKELYRFSWHI-INIZCTEOSA-N	0	3	346.471	3.024	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)[C@H]1[C@@H]2CCC[C@@H]21)c1ccccc1OC	ZINC001198645656	1369080958	/nfs/dbraw/zinc/08/09/58/1369080958.db2.gz	AUUDLGJTTAAIRD-HNAWSFBYSA-N	0	3	342.483	3.454	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)c1coc(C)c1)c1ccccc1OC	ZINC001198686508	1369090904	/nfs/dbraw/zinc/09/09/04/1369090904.db2.gz	POWUQROTBJDNMO-QGZVFWFLSA-N	0	3	328.412	3.233	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)[C@H]1CC1(F)F)c1ccccc1OC	ZINC001198712764	1369096839	/nfs/dbraw/zinc/09/68/39/1369096839.db2.gz	GLDMDCCLLKIWND-HUUCEWRRSA-N	0	3	338.398	3.064	20	30		EGEDHN
COc1ccccc1[C@H](CNC(=O)C#CC(C)C)NCCCCCF	ZINC001198713093	1369097279	/nfs/dbraw/zinc/09/72/79/1369097279.db2.gz	MABARYNMWLUDLM-SFHVURJKSA-N	0	3	348.462	3.241	20	30		EGEDHN
C=CCC[C@@H](C)N[C@H](CNC(=O)C#CC(C)C)c1ccccc1OC	ZINC001198714331	1369098112	/nfs/dbraw/zinc/09/81/12/1369098112.db2.gz	XIFLTEYGDPWPHH-IEBWSBKVSA-N	0	3	342.483	3.456	20	30		EGEDHN
COc1ccccc1[C@@H](CNC(=O)C#CC(C)(C)C)NCCC1CC1	ZINC001198723903	1369099424	/nfs/dbraw/zinc/09/94/24/1369099424.db2.gz	MFQVWFVBHDYWJW-GOSISDBHSA-N	0	3	342.483	3.292	20	30		EGEDHN
COc1ccccc1[C@@H](CNC(=O)C#CC(C)(C)C)NCC[C@H](C)F	ZINC001198723740	1369099678	/nfs/dbraw/zinc/09/96/78/1369099678.db2.gz	JUEHIIJHFJCTIE-DOTOQJQBSA-N	0	3	348.462	3.240	20	30		EGEDHN
CCCCCCCN1CCN(C(=O)c2n[nH]cc2C(F)(F)F)CC1	ZINC001112942467	1369099761	/nfs/dbraw/zinc/09/97/61/1369099761.db2.gz	ZUFPSLYACJSNCW-UHFFFAOYSA-N	0	3	346.397	3.157	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@H](C)C(F)(F)F)c1ccccc1OC	ZINC001198834779	1369125800	/nfs/dbraw/zinc/12/58/00/1369125800.db2.gz	NYGDAQNKVKXVFB-GXTWGEPZSA-N	0	3	344.377	3.217	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@H](NCCCOC)c1ccccc1OC	ZINC001198857257	1369131724	/nfs/dbraw/zinc/13/17/24/1369131724.db2.gz	NYRDLPXSSXETME-WMZOPIPTSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@H](NCCCF)c2ccccc2OC)C1	ZINC001198895623	1369143005	/nfs/dbraw/zinc/14/30/05/1369143005.db2.gz	URVJSXAWAILTHG-MRXNPFEDSA-N	0	3	334.435	3.158	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)Cc1ccco1)c1ccccc1OC	ZINC001198938661	1369152981	/nfs/dbraw/zinc/15/29/81/1369152981.db2.gz	CSHHVORZMJUPQS-GOSISDBHSA-N	0	3	342.439	3.244	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)C[C@H](C)COC)c1ccccc1OC	ZINC001198952908	1369156738	/nfs/dbraw/zinc/15/67/38/1369156738.db2.gz	DJKRIRKIZJJKMU-FUHWJXTLSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)c1c[nH]cc1C)c1ccccc1OC	ZINC001198985096	1369166558	/nfs/dbraw/zinc/16/65/58/1369166558.db2.gz	WAWMZTJVZDBXMI-GOSISDBHSA-N	0	3	341.455	3.359	20	30		EGEDHN
CCCCCCCN1CCN(C(=O)c2ccn3cncc3c2)CC1	ZINC001113071869	1369180633	/nfs/dbraw/zinc/18/06/33/1369180633.db2.gz	ZKHIVKZGCTUQFY-UHFFFAOYSA-N	0	3	328.460	3.063	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)C2CCC(C)(C)CC2)C1	ZINC001199216530	1369192365	/nfs/dbraw/zinc/19/23/65/1369192365.db2.gz	IMNURLSXZMQAEU-QZTJIDSGSA-N	0	3	336.520	3.111	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)CCc2cccc(OC)c2)CC1	ZINC001113094437	1369198287	/nfs/dbraw/zinc/19/82/87/1369198287.db2.gz	VGPIXPUIDHUWTE-QGZVFWFLSA-N	0	3	330.472	3.127	20	30		EGEDHN
N#Cc1cc(F)c(NC(=S)NCCN2CCCCC2)c(Cl)c1	ZINC001200432473	1369366876	/nfs/dbraw/zinc/36/68/76/1369366876.db2.gz	NTBGIGUHDVAZRG-UHFFFAOYSA-N	0	3	340.855	3.123	20	30		EGEDHN
C=C(C)CCC(=O)N1CCCO[C@H](CN[C@@H](C)c2ccccc2F)C1	ZINC001200621462	1369401366	/nfs/dbraw/zinc/40/13/66/1369401366.db2.gz	JAISOEZWSCSBLY-DLBZAZTESA-N	0	3	348.462	3.450	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)Cc2ccc(OCC)cc2)CC1	ZINC001113607712	1369518403	/nfs/dbraw/zinc/51/84/03/1369518403.db2.gz	QLAJEZPATOTNSV-KRWDZBQOSA-N	0	3	330.472	3.127	20	30		EGEDHN
CCCCCCCCCC(=O)N1CCCO[C@H](CNCCF)C1	ZINC001201936773	1369646850	/nfs/dbraw/zinc/64/68/50/1369646850.db2.gz	KOLHWLRVEUJRGT-QGZVFWFLSA-N	0	3	330.488	3.304	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC(NCc2nc(C)c(C)s2)CC1	ZINC001202131469	1369696586	/nfs/dbraw/zinc/69/65/86/1369696586.db2.gz	YONBCHZXJYWRNH-OAHLLOKOSA-N	0	3	335.517	3.443	20	30		EGEDHN
O=C(N[C@@H]1C[C@H](NCC#Cc2cccc(Cl)c2)C12CCC2)C1CC1	ZINC001202281799	1369728483	/nfs/dbraw/zinc/72/84/83/1369728483.db2.gz	UBLARZMSBMKIOK-ZWKOTPCHSA-N	0	3	342.870	3.119	20	30		EGEDHN
CC(C)CC(=O)N[C@H]1C[C@@H](NCC#Cc2ccc(F)cc2)C12CCC2	ZINC001202341038	1369743250	/nfs/dbraw/zinc/74/32/50/1369743250.db2.gz	MAFAIWPFVBQPMF-MOPGFXCFSA-N	0	3	342.458	3.240	20	30		EGEDHN
CC(C)C(=O)N[C@H]1C[C@@H](NCC#Cc2ccc(Cl)cc2)C12CCC2	ZINC001202460550	1369778476	/nfs/dbraw/zinc/77/84/76/1369778476.db2.gz	VYVWWXYSGXDYJB-MSOLQXFVSA-N	0	3	344.886	3.365	20	30		EGEDHN
O=C(C=C1CCC1)N[C@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202711626	1369860530	/nfs/dbraw/zinc/86/05/30/1369860530.db2.gz	BIOMPFKJNHMCQI-UXHICEINSA-N	0	3	334.463	3.165	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1C[C@H](NCc2cccc(F)c2F)C12CCC2	ZINC001202844974	1369905883	/nfs/dbraw/zinc/90/58/83/1369905883.db2.gz	AULLEUBSUPBHQC-DLBZAZTESA-N	0	3	346.421	3.285	20	30		EGEDHN
CCC(CC)[C@@H](C)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001114498856	1369975562	/nfs/dbraw/zinc/97/55/62/1369975562.db2.gz	GQQKEUDSQOUCDR-FCDRMGDPSA-N	0	3	339.483	3.177	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1[C@H]2CN(Cc3ccc(CF)cc3)C[C@H]21	ZINC001114726469	1370048486	/nfs/dbraw/zinc/04/84/86/1370048486.db2.gz	MGYCRRHLEMAFAO-FEUVXWNVSA-N	0	3	330.447	3.305	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2[C@H]3CN(Cc4ccc(CF)cc4)C[C@H]32)CCC1	ZINC001114785932	1370079382	/nfs/dbraw/zinc/07/93/82/1370079382.db2.gz	XUAFUSPRADZDKE-BWTSREIZSA-N	0	3	342.458	3.449	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1C[C@H](NCc2ccc(F)cn2)C12CCC2	ZINC001203339680	1370089172	/nfs/dbraw/zinc/08/91/72/1370089172.db2.gz	IWZBTFOHAXFNOH-IRXDYDNUSA-N	0	3	331.435	3.094	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@H](NCC#Cc3ccccc3)C23CCC3)C1	ZINC001203375083	1370104251	/nfs/dbraw/zinc/10/42/51/1370104251.db2.gz	OCUZESXVMDFBBV-PMACEKPBSA-N	0	3	348.490	3.411	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1C[C@@H](NCc2conc2C)C12CCC2	ZINC001203453027	1370132408	/nfs/dbraw/zinc/13/24/08/1370132408.db2.gz	QWYPZNDCSVRXSW-CVEARBPZSA-N	0	3	331.460	3.102	20	30		EGEDHN
CCOc1cc(C)ccc1CNCCC(=O)Nc1cccc(C#N)c1	ZINC001325844456	1388054718	/nfs/dbraw/zinc/05/47/18/1388054718.db2.gz	USLDXTBUIACUDL-UHFFFAOYSA-N	0	3	337.423	3.384	20	30		EGEDHN
CC[C@H](CC(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1)C(C)C	ZINC001187208205	1388071542	/nfs/dbraw/zinc/07/15/42/1388071542.db2.gz	NLNKKQBXEKYSLY-SJLPKXTDSA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)NCC1(NCc2ccc(C#N)cc2F)CCCCC1	ZINC001115389184	1370425905	/nfs/dbraw/zinc/42/59/05/1370425905.db2.gz	KGGIVIAYRCTVQC-YOEHRIQHSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H]2CN(Cc3ccc4ncccc4c3)C[C@H]21	ZINC001187192099	1388068137	/nfs/dbraw/zinc/06/81/37/1388068137.db2.gz	VTPJMEFYZWZFJW-AZUAARDMSA-N	0	3	335.451	3.234	20	30		EGEDHN
C[C@H](C#N)C(=O)NCC1(NCc2cc(F)ccc2F)CCCCC1	ZINC001115451811	1370459150	/nfs/dbraw/zinc/45/91/50/1370459150.db2.gz	HDNNMAMXSNUZDJ-CYBMUJFWSA-N	0	3	335.398	3.033	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)C2=CCCC2)CCCCC1	ZINC001115480775	1370486229	/nfs/dbraw/zinc/48/62/29/1370486229.db2.gz	RKHMRBWBQQNJRT-UHFFFAOYSA-N	0	3	341.293	3.414	20	30		EGEDHN
CCCCCC(=O)N1CCC(CNCc2ccccc2C#N)CC1	ZINC001204501305	1370494663	/nfs/dbraw/zinc/49/46/63/1370494663.db2.gz	LZNFMBDTEVMYFY-UHFFFAOYSA-N	0	3	327.472	3.467	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cnc(C3CC3)o2)CCCCC1	ZINC001115576250	1370578696	/nfs/dbraw/zinc/57/86/96/1370578696.db2.gz	HYHVWIQFIDAZPU-UHFFFAOYSA-N	0	3	337.851	3.327	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)C[C@@H]2CC(C)(C)CO2)CCCCC1	ZINC001115626035	1370619761	/nfs/dbraw/zinc/61/97/61/1370619761.db2.gz	CQZDJBUPDOAZIM-OAHLLOKOSA-N	0	3	342.911	3.353	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cc(CCC)n[nH]2)CCCCC1	ZINC001115659383	1370644311	/nfs/dbraw/zinc/64/43/11/1370644311.db2.gz	SSVBMANYLNVWOB-UHFFFAOYSA-N	0	3	338.883	3.137	20	30		EGEDHN
CC[C@@H](C)CC(=O)N1CCC(CNCc2ccccc2C#N)CC1	ZINC001205105467	1370652304	/nfs/dbraw/zinc/65/23/04/1370652304.db2.gz	CODQAVYUFXBGST-MRXNPFEDSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)[C@@H](F)C(C)C)CCCCC1	ZINC001115678160	1370660305	/nfs/dbraw/zinc/66/03/05/1370660305.db2.gz	CVTUPAAIURLZGU-ZDUSSCGKSA-N	0	3	349.288	3.298	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCC1(NCc2cnc(C)nc2)CCCCC1	ZINC001115679463	1370661783	/nfs/dbraw/zinc/66/17/83/1370661783.db2.gz	FMSDBKKMVFCNBI-HOTGVXAUSA-N	0	3	344.503	3.152	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCC1(NCc2cnoc2C)CCCCC1	ZINC001115684760	1370667610	/nfs/dbraw/zinc/66/76/10/1370667610.db2.gz	HGDCHWCJYVHITH-HNNXBMFYSA-N	0	3	333.476	3.494	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N(Cc1ccccc1)[C@@H]1CN(C(C)C)C[C@H]1O	ZINC001205181792	1370672147	/nfs/dbraw/zinc/67/21/47/1370672147.db2.gz	KXPIXOPWVLFMIU-SBHAEUEKSA-N	0	3	344.499	3.071	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)CCC2CC2)CC[C@H]1c1ccc(F)cc1	ZINC001205257682	1370697676	/nfs/dbraw/zinc/69/76/76/1370697676.db2.gz	VPZMHTXWFSPBIU-VQTJNVASSA-N	0	3	342.458	3.313	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)/C=C(\C)CC)CC[C@H]1c1ccc(F)cc1	ZINC001205282550	1370705527	/nfs/dbraw/zinc/70/55/27/1370705527.db2.gz	CCWQDTSWOSRZFQ-JQTHLGOZSA-N	0	3	342.458	3.479	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CC[C@@H](c2ccc(F)cc2)[C@H](NCCF)C1	ZINC001205282655	1370705915	/nfs/dbraw/zinc/70/59/15/1370705915.db2.gz	IGLNUYPMBSBOJO-ZWKOTPCHSA-N	0	3	348.437	3.119	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@H](CCC)C(C)C)[C@@H]3COC[C@@H]32)CC1	ZINC001205512217	1370776440	/nfs/dbraw/zinc/77/64/40/1370776440.db2.gz	RHAVBCAXVDXDBY-CEXWTWQISA-N	0	3	348.531	3.184	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2oc(CC)nc2C)CCCCC1	ZINC001115805533	1370788798	/nfs/dbraw/zinc/78/87/98/1370788798.db2.gz	OYMBOTZBUOJKML-UHFFFAOYSA-N	0	3	339.867	3.320	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)N1CCC(CNCc2ncc(C)s2)CC1	ZINC001205954551	1370922604	/nfs/dbraw/zinc/92/26/04/1370922604.db2.gz	HMILXJKAGKAFHF-DZGCQCFKSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(CNCc3oc(C)nc3C)CC2)CCC1	ZINC001206188725	1370986659	/nfs/dbraw/zinc/98/66/59/1370986659.db2.gz	ZXPMVXWSBVOWRS-UHFFFAOYSA-N	0	3	345.487	3.366	20	30		EGEDHN
C#CCN(CC1CC1)C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C	ZINC001117863934	1371104543	/nfs/dbraw/zinc/10/45/43/1371104543.db2.gz	DQHDZKSVCAOSMH-GOSISDBHSA-N	0	3	345.512	3.066	20	30		EGEDHN
C=CCOCCCC(=O)N[C@@H]1CN(Cc2ccc(CC)cc2)C[C@H]1C	ZINC001206782459	1371164919	/nfs/dbraw/zinc/16/49/19/1371164919.db2.gz	PNQSGTGGNBTPCX-YLJYHZDGSA-N	0	3	344.499	3.168	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CN(Cc2cccc(OCCC)c2)C[C@H]1C	ZINC001206913233	1371222373	/nfs/dbraw/zinc/22/23/73/1371222373.db2.gz	CCAHBUJBKSRPNX-YLJYHZDGSA-N	0	3	342.483	3.215	20	30		EGEDHN
CC(C)(F)C(=O)N1CCC[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001207047080	1371276947	/nfs/dbraw/zinc/27/69/47/1371276947.db2.gz	KBPDHIDADVTBLR-HNNXBMFYSA-N	0	3	336.838	3.020	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)COc2cccc(C(C)C)c2)C1	ZINC001207056166	1371279786	/nfs/dbraw/zinc/27/97/86/1371279786.db2.gz	BEQHOACHQCIFPV-VQIMIIECSA-N	0	3	330.472	3.201	20	30		EGEDHN
O=C1C=C2CN(Cc3c(F)cccc3OC(F)F)CCC2S1	ZINC001207113720	1371298089	/nfs/dbraw/zinc/29/80/89/1371298089.db2.gz	CNRRDXVHQAXBNG-CYBMUJFWSA-N	0	3	329.343	3.201	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CCN(Cc3cccnc3C)C2)C1	ZINC001207147319	1371310910	/nfs/dbraw/zinc/31/09/10/1371310910.db2.gz	BQTNALMMPMQSEF-LJQANCHMSA-N	0	3	329.444	3.001	20	30		EGEDHN
C=CCOC(=O)N1CCCC2(CCN(Cc3cncc(C)c3)CC2)C1	ZINC001207153870	1371313139	/nfs/dbraw/zinc/31/31/39/1371313139.db2.gz	IGUNRJMOOVERDH-UHFFFAOYSA-N	0	3	343.471	3.391	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CN(CCOc2cccc(C)c2)C[C@H]1C	ZINC001207158052	1371314642	/nfs/dbraw/zinc/31/46/42/1371314642.db2.gz	DKYACKOYVFRKTJ-IEBWSBKVSA-N	0	3	344.499	3.413	20	30		EGEDHN
O=C(C[C@H]1C=CCC1)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207232054	1371336194	/nfs/dbraw/zinc/33/61/94/1371336194.db2.gz	IAHCQOKQGXPFIR-ICSRJNTNSA-N	0	3	340.442	3.114	20	30		EGEDHN
CC(C)(C)CC(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207335585	1371364123	/nfs/dbraw/zinc/36/41/23/1371364123.db2.gz	NCALLKKGTKUTNG-SFHVURJKSA-N	0	3	330.447	3.194	20	30		EGEDHN
CC(C)(C)/C=C/C(=O)N1CCC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001207711030	1371482640	/nfs/dbraw/zinc/48/26/40/1371482640.db2.gz	WDNCRYRMOBPWQG-IJDCCNJMSA-N	0	3	343.446	3.380	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1CCC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001207718469	1371485437	/nfs/dbraw/zinc/48/54/37/1371485437.db2.gz	QNGXJGVXJGSHAR-RHSMWYFYSA-N	0	3	331.435	3.214	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001207764418	1371497806	/nfs/dbraw/zinc/49/78/06/1371497806.db2.gz	OUKDDPARBCHOJO-DUPDZRFXSA-N	0	3	330.859	3.238	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N1CCC[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207818955	1371512540	/nfs/dbraw/zinc/51/25/40/1371512540.db2.gz	CTHGZBOUUGNBJP-ZWKOTPCHSA-N	0	3	344.886	3.318	20	30		EGEDHN
C#CCCCCC(=O)N1CCC[C@H](NCc2cc(C)ccc2OC)C1	ZINC001207863795	1371523337	/nfs/dbraw/zinc/52/33/37/1371523337.db2.gz	XZJUVLFIBVOJJR-IBGZPJMESA-N	0	3	342.483	3.278	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CN(CCCc3ccc(C)o3)C2)CC1	ZINC001207937460	1371543989	/nfs/dbraw/zinc/54/39/89/1371543989.db2.gz	KGOSPNPZNSWAFP-UHFFFAOYSA-N	0	3	332.444	3.241	20	30		EGEDHN
CC1(C(=O)N2CCC[C@H](NCC#Cc3ccccc3Cl)C2)CC1	ZINC001208101883	1371595818	/nfs/dbraw/zinc/59/58/18/1371595818.db2.gz	YTPDXXWRRZTGKY-INIZCTEOSA-N	0	3	330.859	3.072	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001208213503	1371655107	/nfs/dbraw/zinc/65/51/07/1371655107.db2.gz	QWDKPFUCIWXRBZ-IBGZPJMESA-N	0	3	344.474	3.440	20	30		EGEDHN
CC[C@@H](C)C(=O)NC1CC2(CC(NCc3cc(F)ccc3C#N)C2)C1	ZINC001120650216	1371683870	/nfs/dbraw/zinc/68/38/70/1371683870.db2.gz	AYYRJGWSGZBUGK-NOMVZPGFSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC[C@H](NCc2cn(C(C)C)nc2C)C1	ZINC001208258552	1371687407	/nfs/dbraw/zinc/68/74/07/1371687407.db2.gz	LSNBQFHOHWEQIL-SFHVURJKSA-N	0	3	332.492	3.209	20	30		EGEDHN
C#CCC1(C(=O)N2CCC[C@@H](NCc3cc(C)ccc3F)C2)CCC1	ZINC001208318750	1371715876	/nfs/dbraw/zinc/71/58/76/1371715876.db2.gz	HFDRBVTWMFIPPU-GOSISDBHSA-N	0	3	342.458	3.408	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CN(CCOc2ccc(F)cc2)C[C@H]1C	ZINC001208391631	1371749917	/nfs/dbraw/zinc/74/99/17/1371749917.db2.gz	RFWXBIXRVSYXIC-FRQCXROJSA-N	0	3	348.462	3.243	20	30		EGEDHN
O=C(C[C@H]1C=CCCC1)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001208403808	1371755806	/nfs/dbraw/zinc/75/58/06/1371755806.db2.gz	MWZJZZJFSFXDPW-SFTDATJTSA-N	0	3	336.479	3.365	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1CN(CCOc2ccccc2C)C[C@H]1C	ZINC001208511919	1371794296	/nfs/dbraw/zinc/79/42/96/1371794296.db2.gz	OGKUYFKHHSSRFI-DBXWQHBBSA-N	0	3	344.499	3.413	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)CC(C2CCC2)C2CCC2)C1	ZINC001208667995	1371857271	/nfs/dbraw/zinc/85/72/71/1371857271.db2.gz	IOXCOYXRYKKBKN-OXQOHEQNSA-N	0	3	348.531	3.232	20	30		EGEDHN
N#Cc1ccc(CCCN2CCN(Cc3ccc(F)cc3)CC2)cc1	ZINC001208860844	1371921618	/nfs/dbraw/zinc/92/16/18/1371921618.db2.gz	UIDXQALWOKTVPY-UHFFFAOYSA-N	0	3	337.442	3.448	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@H]1CCCCN1CCc1ccc(C#N)cc1	ZINC001208920338	1371945071	/nfs/dbraw/zinc/94/50/71/1371945071.db2.gz	FZFMHQFYGOVXQN-SFHVURJKSA-N	0	3	343.471	3.480	20	30		EGEDHN
C=CCN(CCN1CC[C@@H](c2cccc(OC)c2)C1)C(=O)OCC	ZINC001209025073	1371976968	/nfs/dbraw/zinc/97/69/68/1371976968.db2.gz	ZSPZKIPHPFOXFK-QGZVFWFLSA-N	0	3	332.444	3.129	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)[C@]2(C)CC[C@H](C)C2(C)C)C1	ZINC001209150515	1372015744	/nfs/dbraw/zinc/01/57/44/1372015744.db2.gz	QRFRMBAQVLPUSB-YZLZLFLDSA-N	0	3	336.520	3.088	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NC1CC2(CC(NCc3conc3CC)C2)C1	ZINC001121610727	1372024118	/nfs/dbraw/zinc/02/41/18/1372024118.db2.gz	MEWRALSDFMMAPL-BPSKNPOXSA-N	0	3	345.487	3.212	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC[C@@H](NCc2c(C)nsc2C)C1	ZINC001209193111	1372033151	/nfs/dbraw/zinc/03/31/51/1372033151.db2.gz	GGCIXJCDFCJURR-JKSUJKDBSA-N	0	3	335.517	3.443	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001209192545	1372033397	/nfs/dbraw/zinc/03/33/97/1372033397.db2.gz	ARUSNSGYHVFEGP-YJBOKZPZSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=CCCCCN1Cc2cncn2C[C@@H](COCc2ccccn2)C1	ZINC001209204067	1372036892	/nfs/dbraw/zinc/03/68/92/1372036892.db2.gz	YJPINTHMQUQAOA-SFHVURJKSA-N	0	3	340.471	3.283	20	30		EGEDHN
O=C(N1CCC[C@H](NCC#Cc2ccccc2)C1)C1(C(F)F)CCC1	ZINC001209223116	1372042366	/nfs/dbraw/zinc/04/23/66/1372042366.db2.gz	QBXSRHWOMNPZKV-KRWDZBQOSA-N	0	3	346.421	3.054	20	30		EGEDHN
C#CCCN1C[C@@H](C)[C@H](NC(=O)[C@H](CC)Cc2cccc(C)c2)C1	ZINC001209226229	1372044101	/nfs/dbraw/zinc/04/41/01/1372044101.db2.gz	SDFJILIGAZTWCP-MISYRCLQSA-N	0	3	326.484	3.024	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@H]2CN(CCc3ccc(Cl)cc3)C[C@H]21	ZINC001187841298	1388174984	/nfs/dbraw/zinc/17/49/84/1388174984.db2.gz	VXBLXVCTBHHSQB-PKOBYXMFSA-N	0	3	344.886	3.075	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CC[C@H]2CN(Cc3ccc4cc[nH]c4c3)C[C@H]21	ZINC001187857932	1388179207	/nfs/dbraw/zinc/17/92/07/1388179207.db2.gz	VFVWFQASOYIQOT-AZUAARDMSA-N	0	3	349.478	3.250	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC[C@H](NCc3cnc(C)s3)C2)CC1	ZINC001209464119	1372112982	/nfs/dbraw/zinc/11/29/82/1372112982.db2.gz	BCPJYWVUKXNQMB-HNNXBMFYSA-N	0	3	333.501	3.279	20	30		EGEDHN
CC1(C)CC[C@@H](C(=O)N2CCC[C@H](NCC#Cc3ccccc3)C2)C1	ZINC001209523057	1372127372	/nfs/dbraw/zinc/12/73/72/1372127372.db2.gz	FVPXNRXOAVDQLG-UXHICEINSA-N	0	3	338.495	3.445	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccc(Oc2ncccn2)cc1C	ZINC001121938682	1372127769	/nfs/dbraw/zinc/12/77/69/1372127769.db2.gz	QCMNFDDNJIIBMV-OAHLLOKOSA-N	0	3	326.400	3.199	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)[C@@H](C)Oc1ccccc1)C2	ZINC001122140381	1372185441	/nfs/dbraw/zinc/18/54/41/1372185441.db2.gz	CJOZDBLEZYTTBH-XYLATYTLSA-N	0	3	348.874	3.223	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)N1CCC(c2cncn2C)CC1	ZINC001122602282	1372282246	/nfs/dbraw/zinc/28/22/46/1372282246.db2.gz	OPWNGCLAGAAAJK-QGZVFWFLSA-N	0	3	334.508	3.204	20	30		EGEDHN
C#CCC(C)(C)c1nnc(N2CCN(C(C)(C)C)CC2)n1CC(=C)C	ZINC001122629549	1372287190	/nfs/dbraw/zinc/28/71/90/1372287190.db2.gz	LHYFSVGWLSQTRS-UHFFFAOYSA-N	0	3	343.519	3.076	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)C[C@H](CC)c2ccccc2)C1	ZINC001210243739	1372303525	/nfs/dbraw/zinc/30/35/25/1372303525.db2.gz	OVEUQAWOQVVAFT-WSTZPKSXSA-N	0	3	344.499	3.209	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)[C@@H]1CCOC(C)(C)C1)c1ccccc1	ZINC001122898324	1372338317	/nfs/dbraw/zinc/33/83/17/1372338317.db2.gz	UTIKOSLXLHYXPZ-IKGGRYGDSA-N	0	3	342.439	3.168	20	30		EGEDHN
O=C(c1c[nH]cc1C1CC1)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001210402564	1372343610	/nfs/dbraw/zinc/34/36/10/1372343610.db2.gz	JXHCBKUVMSHOAI-LJQANCHMSA-N	0	3	347.462	3.138	20	30		EGEDHN
C[NH+]1CCC(n2cc([N-]c3onc(C(C)(C)C)c3C#N)cn2)CC1	ZINC001210754428	1372419622	/nfs/dbraw/zinc/41/96/22/1372419622.db2.gz	DAHDUUUYULGGNA-UHFFFAOYSA-N	0	3	328.420	3.051	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)C[C@H](C)C(=O)c1cccc(F)c1	ZINC001123338039	1372431500	/nfs/dbraw/zinc/43/15/00/1372431500.db2.gz	RKZDMNSSGWICLT-WFASDCNBSA-N	0	3	327.359	3.127	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)CCc2ccc(Cl)s2)C1	ZINC001211020367	1372471859	/nfs/dbraw/zinc/47/18/59/1372471859.db2.gz	ABMJZRAPWKNWKU-TZMCWYRMSA-N	0	3	326.893	3.347	20	30		EGEDHN
C#CCC1(C(=O)N2CCC[C@H](NCc3ccns3)C2)CCCCC1	ZINC001211348157	1372537754	/nfs/dbraw/zinc/53/77/54/1372537754.db2.gz	YXTKCDTVAZNPSX-INIZCTEOSA-N	0	3	345.512	3.198	20	30		EGEDHN
C=C(CN1CCCCC1)c1nc(-c2cccc3c(C)n(C)nc32)no1	ZINC001211436599	1372558989	/nfs/dbraw/zinc/55/89/89/1372558989.db2.gz	QZNQWKNQENGLKT-UHFFFAOYSA-N	0	3	337.427	3.431	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)CC2CC(F)(F)C2)C[C@H]1c1ccccc1	ZINC001211625342	1372592352	/nfs/dbraw/zinc/59/23/52/1372592352.db2.gz	AKIGEADFBRJOMX-ZWKOTPCHSA-N	0	3	346.421	3.029	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)Cc2ccccc2)[C@H](OC)C1	ZINC001212472151	1372712073	/nfs/dbraw/zinc/71/20/73/1372712073.db2.gz	MAPUQXBEKXAAEL-RTBURBONSA-N	0	3	332.488	3.015	20	30		EGEDHN
CC[C@H](NCCNC(=O)[C@H](C)C#N)c1ccc(Cl)cc1Cl	ZINC001124895536	1372738283	/nfs/dbraw/zinc/73/82/83/1372738283.db2.gz	HNXUVFMUUMFGIY-YGRLFVJLSA-N	0	3	328.243	3.310	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN(Cc2c(C)cc(C)cc2C)C[C@H]1OC	ZINC001213266613	1372870957	/nfs/dbraw/zinc/87/09/57/1372870957.db2.gz	BOLGEXPWAOYPBW-RTBURBONSA-N	0	3	344.499	3.139	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1CN(CCCCCC=C)C[C@H]1OC	ZINC001213269193	1372872002	/nfs/dbraw/zinc/87/20/02/1372872002.db2.gz	DHGHLXHRMNHLMI-RTBURBONSA-N	0	3	334.504	3.132	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CN([C@H](C)c2cccc(C)c2)C[C@H]1OC	ZINC001213310102	1372881438	/nfs/dbraw/zinc/88/14/38/1372881438.db2.gz	CYLQRJCEIRPPNU-MISYRCLQSA-N	0	3	342.483	3.065	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2cc[nH]c2CCC)[C@H](OC)C1	ZINC001213312366	1372881804	/nfs/dbraw/zinc/88/18/04/1372881804.db2.gz	FOJPJNILMHZGEI-RTBURBONSA-N	0	3	349.519	3.367	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1CN(CCCC2CCCC2)C[C@H]1OC	ZINC001213322420	1372884513	/nfs/dbraw/zinc/88/45/13/1372884513.db2.gz	IUCDBXIWKUOULV-BHIYHBOVSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CC1(CC(=O)N[C@@H]2CN(CC[C@@H](C)F)C[C@H]2OC)CCCCC1	ZINC001213567286	1372927261	/nfs/dbraw/zinc/92/72/61/1372927261.db2.gz	SGMCOVSQGLIDOL-BRWVUGGUSA-N	0	3	340.483	3.077	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H](NC(=O)c2cc(CC)c(CC)o2)[C@H](OC)C1	ZINC001213725858	1372952295	/nfs/dbraw/zinc/95/22/95/1372952295.db2.gz	LFFRCXLWWVYTRW-ZSZQSSIHSA-N	0	3	348.487	3.188	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)C2(C3CCCCC3)CC2)[C@H](OC)C1	ZINC001213781579	1372960955	/nfs/dbraw/zinc/96/09/55/1372960955.db2.gz	RDKZDTICANLLOP-QZTJIDSGSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H](NC(=O)c2cc3[nH]ccc3s2)[C@H](OC)C1	ZINC001213783977	1372962025	/nfs/dbraw/zinc/96/20/25/1372962025.db2.gz	YFITXMCSGUUFGN-BPLDGKMQSA-N	0	3	347.484	3.013	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)C(C)(C)C(C)(F)F)[C@H](OC)C1	ZINC001213790725	1372962305	/nfs/dbraw/zinc/96/23/05/1372962305.db2.gz	SANXSPANEYUAPS-HUUCEWRRSA-N	0	3	346.462	3.230	20	30		EGEDHN
C=CCCOCCCCC(=O)NCCNCc1cc(F)ccc1C	ZINC001127125498	1373091731	/nfs/dbraw/zinc/09/17/31/1373091731.db2.gz	YUOHLIPRKWCKIA-UHFFFAOYSA-N	0	3	336.451	3.103	20	30		EGEDHN
C=CCOc1ccc(-c2nc(-c3ccc4c(n3)CCNC4)no2)cc1	ZINC001215293471	1373195150	/nfs/dbraw/zinc/19/51/50/1373195150.db2.gz	DSFXEGVUNLYVOB-UHFFFAOYSA-N	0	3	334.379	3.009	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001215586210	1373214356	/nfs/dbraw/zinc/21/43/56/1373214356.db2.gz	XNSWHVLVMBHTTI-YCEFEEMOSA-N	0	3	344.886	3.174	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCNCc1ccc(C(C)C)nc1C	ZINC001128085320	1373216553	/nfs/dbraw/zinc/21/65/53/1373216553.db2.gz	SOTSDKXLBPNRJD-UHFFFAOYSA-N	0	3	329.488	3.488	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NCCN[C@H](C)c1ccc(F)c(F)c1)OCC	ZINC001128539811	1373286276	/nfs/dbraw/zinc/28/62/76/1373286276.db2.gz	LAXBGPILXZOXHF-CXAGYDPISA-N	0	3	340.414	3.103	20	30		EGEDHN
CCCCCCCCC(=O)N1C[C@@H](C)[C@H](N[C@@H](C)c2n[nH]c(C)n2)C1	ZINC001216531000	1373314753	/nfs/dbraw/zinc/31/47/53/1373314753.db2.gz	PXGLOGAEBLFMEE-HLLBOEOZSA-N	0	3	349.523	3.361	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)c3ccccc3C)[C@H]2C1	ZINC001217200253	1373404470	/nfs/dbraw/zinc/40/44/70/1373404470.db2.gz	CKNXMRMYIJWJCS-VQTJNVASSA-N	0	3	342.483	3.267	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)C/C=C/c2ccc(F)cc2)c1	ZINC001130171883	1373469978	/nfs/dbraw/zinc/46/99/78/1373469978.db2.gz	XOBKOZBFYZPYRT-NSCUHMNNSA-N	0	3	337.398	3.007	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)C(CC)(CC)CC)C1	ZINC001130438418	1373539228	/nfs/dbraw/zinc/53/92/28/1373539228.db2.gz	LBPVJQZAOFLGTE-OAHLLOKOSA-N	0	3	332.492	3.218	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)[C@](C)(CC)CCC)C1	ZINC001130438623	1373539277	/nfs/dbraw/zinc/53/92/77/1373539277.db2.gz	NARKWCYMCMITBS-HNAYVOBHSA-N	0	3	332.492	3.218	20	30		EGEDHN
Fc1c(F)c(C(F)(F)F)c(F)c(F)c1O[C@@H]1CCNC[C@@H]1F	ZINC001218064608	1373551158	/nfs/dbraw/zinc/55/11/58/1373551158.db2.gz	NPDGKSYDJDCJKS-CRCLSJGQSA-N	0	3	335.194	3.341	20	30		EGEDHN
CCC[C@H]1CCC[C@@H]1C(=O)NCCNCc1ccc(C#N)c(F)c1	ZINC001130566744	1373561571	/nfs/dbraw/zinc/56/15/71/1373561571.db2.gz	KFFKTTVWHXPKOX-RDJZCZTQSA-N	0	3	331.435	3.120	20	30		EGEDHN
CC(C)c1cccc(CC(=O)NCCNCc2ccc(C#N)cc2)c1	ZINC001130827427	1373596233	/nfs/dbraw/zinc/59/62/33/1373596233.db2.gz	DYQUSXYIUQNYHD-UHFFFAOYSA-N	0	3	335.451	3.130	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)[C@@H](C)CC(=C)C)[C@H]2C1	ZINC001218523929	1373630306	/nfs/dbraw/zinc/63/03/06/1373630306.db2.gz	RCJQNYQPSCSSLK-GBESFXJTSA-N	0	3	334.504	3.247	20	30		EGEDHN
C=CCCCC(=O)N1CCO[C@@H]2CN(CCCC3CCCC3)C[C@@H]21	ZINC001218566046	1373633533	/nfs/dbraw/zinc/63/35/33/1373633533.db2.gz	HPTQTAQBHUCLBM-RBUKOAKNSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C1CCC(C(=O)N2CCO[C@@H]3CN(CC/C=C/CCC)C[C@@H]32)CC1	ZINC001218590699	1373634986	/nfs/dbraw/zinc/63/49/86/1373634986.db2.gz	KZLQNGNYHWTWIU-MNVMYWNISA-N	0	3	346.515	3.391	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2OCCN(C(=O)c3cc(C)cc(F)c3)[C@H]2C1	ZINC001218672422	1373642982	/nfs/dbraw/zinc/64/29/82/1373642982.db2.gz	MFTIGRGYWPECQA-ZYSHUDEJSA-N	0	3	346.446	3.014	20	30		EGEDHN
C=CC1(CC(=O)N2CCO[C@@H]3CN(CCC(=C)C)C[C@@H]32)CCCCC1	ZINC001218776417	1373653486	/nfs/dbraw/zinc/65/34/86/1373653486.db2.gz	QWFBWYATRYGEQB-RBUKOAKNSA-N	0	3	346.515	3.391	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2OCCN(C(=O)c3oc(CC)cc3C)[C@H]2C1	ZINC001218965815	1373671395	/nfs/dbraw/zinc/67/13/95/1373671395.db2.gz	URFGYHADRYHSLU-RYQLBKOJSA-N	0	3	346.471	3.030	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)[C@H](F)CCCCCC)[C@H]2C1	ZINC001218976119	1373673242	/nfs/dbraw/zinc/67/32/42/1373673242.db2.gz	LCSYCTZYMDRCEB-FGTMMUONSA-N	0	3	340.483	3.173	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)[C@@H](F)CCCCCC)[C@H]2C1	ZINC001218976120	1373673431	/nfs/dbraw/zinc/67/34/31/1373673431.db2.gz	LCSYCTZYMDRCEB-OKZBNKHCSA-N	0	3	340.483	3.173	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)C3CCC=CCC3)[C@H]2C1	ZINC001219035118	1373682550	/nfs/dbraw/zinc/68/25/50/1373682550.db2.gz	IVUUECLIOIATGL-VQTJNVASSA-N	0	3	346.515	3.391	20	30		EGEDHN
Cc1cc(Cl)cc(C(=O)NCCNCc2ccc(C#N)c(F)c2)c1	ZINC001131362439	1373684083	/nfs/dbraw/zinc/68/40/83/1373684083.db2.gz	CEKLSHNKSHZFRN-UHFFFAOYSA-N	0	3	345.805	3.179	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)[C@H]3CCCCC3(C)C)[C@H]2C1	ZINC001219058795	1373684090	/nfs/dbraw/zinc/68/40/90/1373684090.db2.gz	LWAYNFTXMKLVII-FGTMMUONSA-N	0	3	334.504	3.081	20	30		EGEDHN
C[Si](C)(C)C#Cc1cccc(NC(=O)C[C@H]2CCNC[C@@H]2F)c1	ZINC001219311155	1373700040	/nfs/dbraw/zinc/70/00/40/1373700040.db2.gz	TXVHWTDASLQWHG-WBVHZDCISA-N	0	3	332.495	3.192	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCO[C@H]1C1CCN(C(=O)/C=C(/C)CC)CC1	ZINC001131493698	1373710445	/nfs/dbraw/zinc/71/04/45/1373710445.db2.gz	NNOYTPCFZMARNN-HMCWCCSVSA-N	0	3	340.895	3.081	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCO[C@H]1C1CCN(C(=O)C[C@@H](C)CC)CC1	ZINC001131495773	1373711512	/nfs/dbraw/zinc/71/15/12/1373711512.db2.gz	DNKPUJOYKUNSFE-XCRHUMRWSA-N	0	3	342.911	3.161	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)C[C@H](OCC)C3=CCCC3)[C@@H]2C1	ZINC001221553196	1373780932	/nfs/dbraw/zinc/78/09/32/1373780932.db2.gz	WQQFLGWIUMDRKK-QRVBRYPASA-N	0	3	332.488	3.001	20	30		EGEDHN
CCCCCCCCCCC(=O)N1C[C@H]2CCN(CCCO)C[C@H]21	ZINC001221974028	1373810785	/nfs/dbraw/zinc/81/07/85/1373810785.db2.gz	WVMXSPZRDYUFFL-RTBURBONSA-N	0	3	338.536	3.432	20	30		EGEDHN
C=CCOCCN1CC[C@@H]2CN(C(=O)[C@H](CC)CCCCC)[C@@H]2C1	ZINC001222038158	1373812952	/nfs/dbraw/zinc/81/29/52/1373812952.db2.gz	OISYJKPEDQIHOK-GUDVDZBRSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCOCCN1CC[C@@H]2CN(C(=O)[C@@H](CCCC)C(C)C)[C@@H]2C1	ZINC001222057986	1373814694	/nfs/dbraw/zinc/81/46/94/1373814694.db2.gz	KJRJTABOWRNFLC-CEXWTWQISA-N	0	3	336.520	3.184	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CC[C@H]2CCN(Cc3ccsc3)[C@H]2C1	ZINC001222397823	1373835676	/nfs/dbraw/zinc/83/56/76/1373835676.db2.gz	LFQLJXIWPXTSFO-NXHRZFHOSA-N	0	3	348.512	3.152	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](NCc3scnc3C)C2)CCCC1	ZINC001188489598	1388317047	/nfs/dbraw/zinc/31/70/47/1388317047.db2.gz	BEHKJKUINHIWDU-OAHLLOKOSA-N	0	3	333.501	3.279	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)C[C@H](CC)CCCC)[C@@H]2C1	ZINC001188617933	1388344954	/nfs/dbraw/zinc/34/49/54/1388344954.db2.gz	OBHNDHITYHOGDE-CEXWTWQISA-N	0	3	336.520	3.328	20	30		EGEDHN
CC#CCCCC(=O)NCC1CCN(Cc2c(C)onc2CC)CC1	ZINC001224158709	1375058198	/nfs/dbraw/zinc/05/81/98/1375058198.db2.gz	YRTGEUIQBKJYEO-UHFFFAOYSA-N	0	3	345.487	3.067	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C/C=C\c3ccc(C)cc3)C[C@@H]21	ZINC001224394830	1375066786	/nfs/dbraw/zinc/06/67/86/1375066786.db2.gz	MPRMDSNFARPJEA-BQMJKSTESA-N	0	3	336.479	3.344	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)CCc2cccc(Cl)c2)cc1	ZINC001131991554	1375084364	/nfs/dbraw/zinc/08/43/64/1375084364.db2.gz	UYXKSCBAZULJDZ-UHFFFAOYSA-N	0	3	341.842	3.050	20	30		EGEDHN
C#CCN1CCC(CNC(=O)C[C@@H](c2ccccc2)C(C)C)CC1	ZINC001225138587	1375093460	/nfs/dbraw/zinc/09/34/60/1375093460.db2.gz	RCCGSRDVYDNMDJ-HXUWFJFHSA-N	0	3	326.484	3.278	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1CC[C@H](C)N(Cc2ccc3c(c2)CCC3)C1	ZINC001132017146	1375100718	/nfs/dbraw/zinc/10/07/18/1375100718.db2.gz	MIKPLWQLYPKECA-LAUBAEHRSA-N	0	3	338.495	3.304	20	30		EGEDHN
CCc1cccc(CN2C[C@H](NC(=O)C#CC(C)C)CC[C@H]2C)c1	ZINC001132018286	1375101789	/nfs/dbraw/zinc/10/17/89/1375101789.db2.gz	WFRQUNAISYIIAW-YLJYHZDGSA-N	0	3	326.484	3.378	20	30		EGEDHN
C[C@@H]1CC[C@@H](NC(=O)C#CC(C)(C)C)CN1CCc1ccccc1	ZINC001132033743	1375108917	/nfs/dbraw/zinc/10/89/17/1375108917.db2.gz	KQLHRNMJRJXGFR-IEBWSBKVSA-N	0	3	326.484	3.248	20	30		EGEDHN
C[C@@H]1CC[C@@H](NC(=O)C#CC2CC2)CN1CCCc1cccc(F)c1	ZINC001132046703	1375115679	/nfs/dbraw/zinc/11/56/79/1375115679.db2.gz	QPGGDILOTWGESA-OXQOHEQNSA-N	0	3	342.458	3.141	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CC[C@H](C)N(Cc2ccc(CO)cc2)C1	ZINC001132073359	1375134293	/nfs/dbraw/zinc/13/42/93/1375134293.db2.gz	VHKJINGNYJHUMH-QFBILLFUSA-N	0	3	330.472	3.004	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)C(C)(C)c2ccccc2C)CC1	ZINC001225684554	1375144393	/nfs/dbraw/zinc/14/43/93/1375144393.db2.gz	JUMBFIFDMSZLCI-UHFFFAOYSA-N	0	3	326.484	3.124	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CCCC[C@H]1NCC(=C)Br	ZINC001225752606	1375152314	/nfs/dbraw/zinc/15/23/14/1375152314.db2.gz	LTSWPRFDFRWMLV-HUUCEWRRSA-N	0	3	341.293	3.106	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCc2ccc(OCC)cc2)CC[C@@H]1C	ZINC001132150549	1375171544	/nfs/dbraw/zinc/17/15/44/1375171544.db2.gz	RZPXEMRMHMCISN-FUHWJXTLSA-N	0	3	330.472	3.173	20	30		EGEDHN
CC#CCCCC(=O)N[C@H]1CC[C@H](C)N(CCOc2ccccc2)C1	ZINC001132223378	1375220879	/nfs/dbraw/zinc/22/08/79/1375220879.db2.gz	CLZQBGZCHZPEFL-OALUTQOASA-N	0	3	342.483	3.228	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1CC[C@H](C)N(CCc2scnc2C)C1	ZINC001132228166	1375224969	/nfs/dbraw/zinc/22/49/69/1375224969.db2.gz	NJBZJWJYZIRZAI-ZFWWWQNUSA-N	0	3	335.517	3.175	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2ccc(CCC)cc2)CC[C@H]1C	ZINC001132246330	1375241026	/nfs/dbraw/zinc/24/10/26/1375241026.db2.gz	SALCOMQOFWEYTC-YLJYHZDGSA-N	0	3	344.499	3.424	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC1CCN([C@H](C)c2ccc(F)cc2)CC1	ZINC001226446898	1375260164	/nfs/dbraw/zinc/26/01/64/1375260164.db2.gz	HRNUDJGIZXEEQI-HZPDHXFCSA-N	0	3	348.462	3.449	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1CC[C@H](C)N(CCn2nc(C)cc2C)C1	ZINC001132332537	1375313654	/nfs/dbraw/zinc/31/36/54/1375313654.db2.gz	VJNQRAIILDPHDN-WMZOPIPTSA-N	0	3	346.519	3.071	20	30		EGEDHN
C#CCCCCCC(=O)NCCNCc1ccccc1OC(C)C	ZINC001132398971	1375354138	/nfs/dbraw/zinc/35/41/38/1375354138.db2.gz	WSBMZZMGFQDKRM-UHFFFAOYSA-N	0	3	330.472	3.263	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2ccc(C)c(C)c2)CC[C@@H]1C	ZINC001132458843	1375402500	/nfs/dbraw/zinc/40/25/00/1375402500.db2.gz	YBBRTKQAKIBYIL-PKOBYXMFSA-N	0	3	330.472	3.089	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCc2ccccc2OC)CC[C@H]1C	ZINC001132469967	1375412187	/nfs/dbraw/zinc/41/21/87/1375412187.db2.gz	ZIAICZKXBRVDGG-SJLPKXTDSA-N	0	3	330.472	3.173	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(OCCCC)cc2)CC[C@@H]1C	ZINC001132487048	1375421254	/nfs/dbraw/zinc/42/12/54/1375421254.db2.gz	QXIMJHDQLQIGGW-HKUYNNGSSA-N	0	3	342.483	3.472	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCOc2ccccc2C)CC[C@H]1C	ZINC001132501590	1375427937	/nfs/dbraw/zinc/42/79/37/1375427937.db2.gz	ZFKZWXGMKOWSNJ-QZTJIDSGSA-N	0	3	330.472	3.309	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCc2cccc(OCC)c2)CC[C@H]1C	ZINC001132525189	1375441996	/nfs/dbraw/zinc/44/19/96/1375441996.db2.gz	ORIJETFRVOFSAD-SJLPKXTDSA-N	0	3	330.472	3.173	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H]2CN(CCOCCC(C)C)C[C@H]21	ZINC001188793400	1388378720	/nfs/dbraw/zinc/37/87/20/1388378720.db2.gz	HGMFGEVWWQQLSK-VQTJNVASSA-N	0	3	348.531	3.166	20	30		EGEDHN
C#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)CCCCC)CC1	ZINC001132552315	1375458737	/nfs/dbraw/zinc/45/87/37/1375458737.db2.gz	SMRVXRAYIURZEY-FQEVSTJZSA-N	0	3	341.499	3.478	20	30		EGEDHN
C#CCN1CC[C@H](CN(Cc2scnc2C)C(=O)C[C@H](C)CC)C1	ZINC001132557811	1375464671	/nfs/dbraw/zinc/46/46/71/1375464671.db2.gz	DOIUTUYEJAQMIK-WBVHZDCISA-N	0	3	347.528	3.171	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2N(Cc2nccs2)C(=O)C(C)C)CC1	ZINC001132567445	1375471089	/nfs/dbraw/zinc/47/10/89/1375471089.db2.gz	YYBVTBITFFVDPG-MRXNPFEDSA-N	0	3	345.512	3.006	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1CCCC[C@H]1NCc1cncs1	ZINC001227973265	1375496995	/nfs/dbraw/zinc/49/69/95/1375496995.db2.gz	OOYZWEHIYMWQOX-IAGOWNOFSA-N	0	3	333.501	3.244	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](C)[C@@H](CNCc2csc(CC)n2)C1	ZINC001132701547	1375523219	/nfs/dbraw/zinc/52/32/19/1375523219.db2.gz	TZELHRJRVVTIQP-GJZGRUSLSA-N	0	3	335.517	3.246	20	30		EGEDHN
C=CCc1cc(OC)c(O[C@H]2CCN(C(C)C)C2)c(C(=O)OC)c1	ZINC001228244682	1375532892	/nfs/dbraw/zinc/53/28/92/1375532892.db2.gz	KADZSBFULRTIEO-HNNXBMFYSA-N	0	3	333.428	3.072	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](C)[C@@H](CNCc2ccn(C(C)C)n2)C1	ZINC001132864696	1375608298	/nfs/dbraw/zinc/60/82/98/1375608298.db2.gz	AIZQFTLCDLLNFS-MSOLQXFVSA-N	0	3	346.519	3.395	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NC1CCN(Cc2ccc(COC)cc2)CC1	ZINC001228748930	1375661433	/nfs/dbraw/zinc/66/14/33/1375661433.db2.gz	OMTXUABMOMSMCS-IAGOWNOFSA-N	0	3	344.499	3.372	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NC1CCN(Cc2sc(C)nc2C)CC1	ZINC001228759720	1375666396	/nfs/dbraw/zinc/66/63/96/1375666396.db2.gz	CCNCBDSNRARGGU-STQMWFEESA-N	0	3	335.517	3.299	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC1CCN(CCOCc2ccccc2)CC1	ZINC001228809255	1375683368	/nfs/dbraw/zinc/68/33/68/1375683368.db2.gz	GVWNZRNOJMGNIA-SFHVURJKSA-N	0	3	344.499	3.386	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H](CC)OC1CCCC1	ZINC001228877918	1375701996	/nfs/dbraw/zinc/70/19/96/1375701996.db2.gz	PALYBSOFYWOYPH-ZACQAIPSSA-N	0	3	342.911	3.494	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](C)[C@@H](CNCc2nc(C)cs2)C1	ZINC001133069897	1375757145	/nfs/dbraw/zinc/75/71/45/1375757145.db2.gz	YYXPYLQTMDOOJT-WBVHZDCISA-N	0	3	347.528	3.219	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)CC(C2CCC2)C2CCC2)CC1	ZINC001229215312	1375788819	/nfs/dbraw/zinc/78/88/19/1375788819.db2.gz	PKAJKIKLIFJJBB-UHFFFAOYSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)[C@@H](c2ccccc2)C(C)C)CC1	ZINC001229363561	1375817618	/nfs/dbraw/zinc/81/76/18/1375817618.db2.gz	NGYXRSRDHLPEBX-HXUWFJFHSA-N	0	3	344.499	3.209	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)/C=C(/C)C1CC1	ZINC001133385220	1375967838	/nfs/dbraw/zinc/96/78/38/1375967838.db2.gz	CWOJUKIKOTZENO-QINSGFPZSA-N	0	3	330.859	3.248	20	30		EGEDHN
C=CCC1(C(=O)NCCNCc2ccc(OC)c(Cl)c2)CCC1	ZINC001133392466	1375977645	/nfs/dbraw/zinc/97/76/45/1375977645.db2.gz	YNNISVIALJVVGB-UHFFFAOYSA-N	0	3	336.863	3.301	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C[C@@H]1CC[C@@H]2C[C@@H]21	ZINC001133399381	1375984275	/nfs/dbraw/zinc/98/42/75/1375984275.db2.gz	LOWHAIQFJYOODQ-AOIWGVFYSA-N	0	3	344.886	3.328	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)c1cccs1)NCc1ccccc1C#N	ZINC001133576502	1376101345	/nfs/dbraw/zinc/10/13/45/1376101345.db2.gz	HWIHDLXJQYRUKI-ZIAGYGMSSA-N	0	3	327.453	3.306	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1cc(F)ccc1C#N)NC(=O)c1ccsc1	ZINC001133633923	1376130231	/nfs/dbraw/zinc/13/02/31/1376130231.db2.gz	ZTEOADYTOWRQBB-QWHCGFSZSA-N	0	3	345.443	3.446	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H](C)C[C@H](C)NCc2ccccc2C#N)o1	ZINC001133653624	1376139448	/nfs/dbraw/zinc/13/94/48/1376139448.db2.gz	TWBBAYIQFYXOLT-UONOGXRCSA-N	0	3	325.412	3.146	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)c1cc[nH]c1CC)Cc1cccnc1	ZINC001230748491	1376139568	/nfs/dbraw/zinc/13/95/68/1376139568.db2.gz	ORXSKZHZPJKKFC-UHFFFAOYSA-N	0	3	340.471	3.170	20	30		EGEDHN
C#CCCN(CCCNC(=O)c1ccsc1C)Cc1cccnc1	ZINC001230756999	1376140002	/nfs/dbraw/zinc/14/00/02/1376140002.db2.gz	XGAVYYZQXQZLIB-UHFFFAOYSA-N	0	3	341.480	3.097	20	30		EGEDHN
CC1(c2ccccc2C(=O)NCCNCc2ccc(C#N)s2)CC1	ZINC001133717043	1376172207	/nfs/dbraw/zinc/17/22/07/1376172207.db2.gz	ZBUAZAGUIZKWHU-UHFFFAOYSA-N	0	3	339.464	3.191	20	30		EGEDHN
C#CCCN(CCCNC(=O)c1ccc(CC)cc1)Cc1cccnc1	ZINC001230911753	1376182974	/nfs/dbraw/zinc/18/29/74/1376182974.db2.gz	PCJNSVFJVCTHOC-UHFFFAOYSA-N	0	3	349.478	3.289	20	30		EGEDHN
CN(CCCNC(=O)c1ccc(F)cc1)Cc1ccc(F)c(C#N)c1	ZINC001231217956	1376214143	/nfs/dbraw/zinc/21/41/43/1376214143.db2.gz	VCIPBCQRMXDFAI-UHFFFAOYSA-N	0	3	343.377	3.088	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)C1CC=CC1)NCc1cc(F)ccc1C#N	ZINC001133980156	1376295368	/nfs/dbraw/zinc/29/53/68/1376295368.db2.gz	UDEJAHKHEZNMJA-ZIAGYGMSSA-N	0	3	329.419	3.036	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)C1CC(C)(C)C1)NCc1ccccc1C#N	ZINC001134252854	1376437810	/nfs/dbraw/zinc/43/78/10/1376437810.db2.gz	WAEJHOFYHIRODC-GJZGRUSLSA-N	0	3	327.472	3.367	20	30		EGEDHN
N#Cc1ccnc(CN2C[C@H]3CCC[C@@]3(COCc3ccncc3)C2)c1	ZINC001232478702	1376466698	/nfs/dbraw/zinc/46/66/98/1376466698.db2.gz	OQAJJQKLJZQXQL-CTNGQTDRSA-N	0	3	348.450	3.167	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H](C)C[C@@H](C)NCc1cc(O)ccc1Cl	ZINC001134317651	1376472355	/nfs/dbraw/zinc/47/23/55/1376472355.db2.gz	MDNKDSNJOYYEOG-KGLIPLIRSA-N	0	3	336.863	3.078	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)C#CC1CC1)NCc1nsc2ccccc21	ZINC001134321431	1376475308	/nfs/dbraw/zinc/47/53/08/1376475308.db2.gz	HEHNNELVKKKLTP-ZIAGYGMSSA-N	0	3	341.480	3.083	20	30		EGEDHN
CC(C)[C@@H](C(=O)NCCNCc1ccc(C#N)cc1)c1ccccc1	ZINC001134416754	1376522328	/nfs/dbraw/zinc/52/23/28/1376522328.db2.gz	KYTAXYPNQJTKTF-HXUWFJFHSA-N	0	3	335.451	3.204	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCNCc1ccc(Br)s1	ZINC001134428205	1376529289	/nfs/dbraw/zinc/52/92/89/1376529289.db2.gz	CTTOJPBCZSHVEK-UHFFFAOYSA-N	0	3	345.306	3.319	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@H](C)C[C@@H](C)NCc1cc(C)no1	ZINC001134457944	1376548639	/nfs/dbraw/zinc/54/86/39/1376548639.db2.gz	WFGYIICVEYOCPY-GHMZBOCLSA-N	0	3	327.856	3.135	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)C1(F)CCCC1	ZINC001134792143	1376725789	/nfs/dbraw/zinc/72/57/89/1376725789.db2.gz	ZAEPCCNZLZKIJV-VXGBXAGGSA-N	0	3	335.261	3.050	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)[C@H](C)CCc3ccccc3F)[C@@H]2C1	ZINC001189102214	1388459351	/nfs/dbraw/zinc/45/93/51/1388459351.db2.gz	SZWIPQKSXSTVGZ-HHXXYDBFSA-N	0	3	330.447	3.113	20	30		EGEDHN
Cc1cccc(C)c1CN1CC[C@H]1CN(C)C(=O)C#CC(C)(C)C	ZINC001234195033	1376784491	/nfs/dbraw/zinc/78/44/91/1376784491.db2.gz	HVHHRWDXKNAIMF-SFHVURJKSA-N	0	3	326.484	3.386	20	30		EGEDHN
C=CCCCN1CC[C@@H]1CN(C)C(=O)COc1cc(C)ccc1F	ZINC001234331542	1376812151	/nfs/dbraw/zinc/81/21/51/1376812151.db2.gz	BFBJPWIMAUBNSS-MRXNPFEDSA-N	0	3	334.435	3.012	20	30		EGEDHN
C=CC1(CC(=O)NCCNCc2ccc(C#N)s2)CCCCC1	ZINC001135190800	1376963135	/nfs/dbraw/zinc/96/31/35/1376963135.db2.gz	ODWLEUWMZCYGBK-UHFFFAOYSA-N	0	3	331.485	3.352	20	30		EGEDHN
CC#CCCCC(=O)N[C@H](C)C[C@@H](C)NCc1nc(C)c(C)s1	ZINC001135224291	1376984324	/nfs/dbraw/zinc/98/43/24/1376984324.db2.gz	APXFUIIZBTUKOS-ZIAGYGMSSA-N	0	3	335.517	3.326	20	30		EGEDHN
CC#CCCCC(=O)N[C@H](C)C[C@H](C)NCc1oc(CC)nc1C	ZINC001135224639	1376985651	/nfs/dbraw/zinc/98/56/51/1376985651.db2.gz	GSZNVBYGHADOKS-LSDHHAIUSA-N	0	3	333.476	3.112	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)C(C)(C)C1CC1	ZINC001135252389	1377003145	/nfs/dbraw/zinc/00/31/45/1377003145.db2.gz	RSLZGKXRTPQBMJ-NEPJUHHUSA-N	0	3	331.298	3.204	20	30		EGEDHN
CCc1ccc([C@H](C)C(=O)NCCNCc2ccc(C#N)cc2)cc1	ZINC001135368877	1377059333	/nfs/dbraw/zinc/05/93/33/1377059333.db2.gz	JLSGGKRDGPMWKQ-INIZCTEOSA-N	0	3	335.451	3.130	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2conc2CC)CC1	ZINC001135383801	1377065765	/nfs/dbraw/zinc/06/57/65/1377065765.db2.gz	WMUUACOXOWLYOC-CABCVRRESA-N	0	3	333.476	3.356	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)c1occc1Cl	ZINC001135399035	1377073593	/nfs/dbraw/zinc/07/35/93/1377073593.db2.gz	PEEUZUSNDKAAFL-VHSXEESVSA-N	0	3	349.656	3.328	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)C1(CCC)CC1	ZINC001135401829	1377075486	/nfs/dbraw/zinc/07/54/86/1377075486.db2.gz	JVKGOWBIGWQETF-QWHCGFSZSA-N	0	3	331.298	3.348	20	30		EGEDHN
CCC1(C(=O)N[C@@H]2CCC[C@@H](NCc3ccccc3C#N)C2)CC1	ZINC001266066679	1377180944	/nfs/dbraw/zinc/18/09/44/1377180944.db2.gz	FAZHGOOIDLJYMI-QZTJIDSGSA-N	0	3	325.456	3.265	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)c1csc(C)c1	ZINC001135690710	1377185055	/nfs/dbraw/zinc/18/50/55/1377185055.db2.gz	KEIMTICSWAEMJD-GHMZBOCLSA-N	0	3	345.306	3.452	20	30		EGEDHN
Cc1ccc(CC(=O)NCC[C@@H](C)NCc2ccccc2C#N)cc1	ZINC001266158500	1377210805	/nfs/dbraw/zinc/21/08/05/1377210805.db2.gz	PHTQBNOMZQANOB-QGZVFWFLSA-N	0	3	335.451	3.094	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)C1(C)CC(F)(F)C1)NCc1ccccc1C#N	ZINC001135906452	1377258040	/nfs/dbraw/zinc/25/80/40/1377258040.db2.gz	CHMZUSKRQWGGQA-ZIAGYGMSSA-N	0	3	349.425	3.367	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3c[nH]c4c3cccc4F)C2)C1=O	ZINC001137053101	1377468110	/nfs/dbraw/zinc/46/81/10/1377468110.db2.gz	YCIXHKGGXJAPJN-FQEVSTJZSA-N	0	3	341.430	3.308	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3cnc4ccccc4c3)C2)C1=O	ZINC001137279061	1377509489	/nfs/dbraw/zinc/50/94/89/1377509489.db2.gz	BDHBLXXOVVOCMA-NRFANRHFSA-N	0	3	335.451	3.235	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@@H](F)[C@](O)(C(F)(F)F)CC2)c1[O-]	ZINC001138625920	1377756186	/nfs/dbraw/zinc/75/61/86/1377756186.db2.gz	WYJQASJOCTTXQU-ZBFHGGJFSA-N	0	3	347.352	3.348	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@@H](F)[C@](O)(C(F)(F)F)CC2)c1[O-]	ZINC001138625920	1377756187	/nfs/dbraw/zinc/75/61/87/1377756187.db2.gz	WYJQASJOCTTXQU-ZBFHGGJFSA-N	0	3	347.352	3.348	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@@H](Oc3ccc(OC)cn3)C2)c1[O-]	ZINC001138631387	1377757341	/nfs/dbraw/zinc/75/73/41/1377757341.db2.gz	RHYXIDNQSONDIO-GOSISDBHSA-N	0	3	340.423	3.178	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@@H](Oc3ccc(OC)cn3)C2)c1[O-]	ZINC001138631387	1377757345	/nfs/dbraw/zinc/75/73/45/1377757345.db2.gz	RHYXIDNQSONDIO-GOSISDBHSA-N	0	3	340.423	3.178	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@@H]1CCN(Cc1cnn(CCC)c1C)C2	ZINC001138636559	1377758694	/nfs/dbraw/zinc/75/86/94/1377758694.db2.gz	UULCPKJHTXMGOJ-UXHICEINSA-N	0	3	347.503	3.175	20	30		EGEDHN
C=C(C)COc1ccccc1CN1CCN(CCCCOC)CC1	ZINC001138666273	1377765277	/nfs/dbraw/zinc/76/52/77/1377765277.db2.gz	ORBFCZMAQIWCBE-UHFFFAOYSA-N	0	3	332.488	3.186	20	30		EGEDHN
C=CCOc1ccccc1CN1CCC2(CCC(=O)N2CC=C)CC1	ZINC001139028255	1377819644	/nfs/dbraw/zinc/81/96/44/1377819644.db2.gz	QXPNYTMMIHHKHG-UHFFFAOYSA-N	0	3	340.467	3.394	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cnn(CCC)c1)[C@@H]2CC	ZINC001139038586	1377820941	/nfs/dbraw/zinc/82/09/41/1377820941.db2.gz	FXGYQGAEJBIIKR-QUCCMNQESA-N	0	3	344.503	3.215	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CCN(Cc3c(C)n[nH]c3C)CC2)CC1	ZINC001139094394	1377828303	/nfs/dbraw/zinc/82/83/03/1377828303.db2.gz	GLAVSTOJTSOMGG-UHFFFAOYSA-N	0	3	346.475	3.027	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3c[nH]c4cccc(C)c34)C2)C1=O	ZINC001139195233	1377848691	/nfs/dbraw/zinc/84/86/91/1377848691.db2.gz	RSOWVDSSWOWDAW-OAQYLSRUSA-N	0	3	337.467	3.477	20	30		EGEDHN
CN(Cc1ccc(N2CCC(O)CC2)s1)Cc1ccc(C#N)cc1	ZINC001139293945	1377863498	/nfs/dbraw/zinc/86/34/98/1377863498.db2.gz	HULZEDFLLHOZDR-UHFFFAOYSA-N	0	3	341.480	3.213	20	30		EGEDHN
O=C1C=C2CN(Cc3cscc3Br)CCC2S1	ZINC001139347839	1377872451	/nfs/dbraw/zinc/87/24/51/1377872451.db2.gz	RJVRCVRRODECQC-NSHDSACASA-N	0	3	330.272	3.285	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(Oc3ccc(C#N)cc3)nc2)CCC[C@H]1O	ZINC001139426642	1377882284	/nfs/dbraw/zinc/88/22/84/1377882284.db2.gz	HRIRSLMVRBMBIU-DNVCBOLYSA-N	0	3	337.423	3.338	20	30		EGEDHN
CCN1CCN(Cc2ccc(Oc3ccc(C#N)cc3)nc2)[C@H](C)C1	ZINC001139428565	1377883664	/nfs/dbraw/zinc/88/36/64/1377883664.db2.gz	HBWMQCYIYFLZKS-MRXNPFEDSA-N	0	3	336.439	3.272	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3ccc(Cl)c(OC)c3)C2)C1=O	ZINC001139613498	1377918318	/nfs/dbraw/zinc/91/83/18/1377918318.db2.gz	WBQRXLGTIOWMMM-IBGZPJMESA-N	0	3	348.874	3.349	20	30		EGEDHN
Cc1ccc(CN2CCC3(C[C@H]3C(=O)NC3CCC3)CC2)cc1C#N	ZINC001139725285	1377941959	/nfs/dbraw/zinc/94/19/59/1377941959.db2.gz	JWLBSAHOPFITQS-IBGZPJMESA-N	0	3	337.467	3.138	20	30		EGEDHN
C=CCN(CC=C)CCN1CCN(Cc2ccccc2C(F)F)CC1	ZINC001139801792	1377952042	/nfs/dbraw/zinc/95/20/42/1377952042.db2.gz	DSNTXZSLACHNOM-UHFFFAOYSA-N	0	3	349.469	3.416	20	30		EGEDHN
N#Cc1cc(F)cc(CN2CCC3(CC2)C(=O)Nc2ccccc23)c1	ZINC001139877493	1377970137	/nfs/dbraw/zinc/97/01/37/1377970137.db2.gz	LOFWEEKNISEJSA-UHFFFAOYSA-N	0	3	335.382	3.183	20	30		EGEDHN
N#Cc1ccc2[nH]cc(CN3CCCN(c4ccc(F)cn4)CC3)c2c1	ZINC001140111302	1378010406	/nfs/dbraw/zinc/01/04/06/1378010406.db2.gz	IRXSABJYDKLYRD-UHFFFAOYSA-N	0	3	349.413	3.286	20	30		EGEDHN
C=C(C)CNC(=O)[C@@H]1CC12CCN(Cc1cc(F)ccc1C)CC2	ZINC001272617231	1378076788	/nfs/dbraw/zinc/07/67/88/1378076788.db2.gz	UGYZWSHNCKHLBT-SFHVURJKSA-N	0	3	330.447	3.429	20	30		EGEDHN
CCCN(Cc1cc(C#N)ccc1Cl)C1CCN(C(C)=O)CC1	ZINC001140603093	1378095382	/nfs/dbraw/zinc/09/53/82/1378095382.db2.gz	ZYZTXASSKXBBJN-UHFFFAOYSA-N	0	3	333.863	3.435	20	30		EGEDHN
C=CCN1CCC2(CCN(Cc3cc4cc(C)ccc4[nH]3)CC2)C1=O	ZINC001273326306	1378098055	/nfs/dbraw/zinc/09/80/55/1378098055.db2.gz	ADLDDPPFGXXSPT-UHFFFAOYSA-N	0	3	337.467	3.477	20	30		EGEDHN
Cn1cnc2ccc(CN3CCC[C@@H](Oc4ccccc4C#N)C3)cc21	ZINC001140739020	1378128128	/nfs/dbraw/zinc/12/81/28/1378128128.db2.gz	ZKOXYDFTKDGQRA-GOSISDBHSA-N	0	3	346.434	3.488	20	30		EGEDHN
CC[C@@H](C)N1CC[C@@]2(CCN(Cc3ccc(C#N)c(Cl)c3)C2)C1=O	ZINC001274492931	1378128539	/nfs/dbraw/zinc/12/85/39/1378128539.db2.gz	XHTNMHWWYGMOEP-AUUYWEPGSA-N	0	3	345.874	3.435	20	30		EGEDHN
CN(CCN(C)Cc1cc(F)c(C#N)c(F)c1)Cc1ccccc1	ZINC001140756945	1378131503	/nfs/dbraw/zinc/13/15/03/1378131503.db2.gz	VBTDAEUIEGNWLI-UHFFFAOYSA-N	0	3	329.394	3.400	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1cccc(-c2cnco2)c1	ZINC001274809992	1378133581	/nfs/dbraw/zinc/13/35/81/1378133581.db2.gz	XQIKJFXLMMZQSL-ZDUSSCGKSA-N	0	3	333.819	3.192	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H](O)[C@@H]2Cc2ccccc2)c1Cl	ZINC001140813694	1378148815	/nfs/dbraw/zinc/14/88/15/1378148815.db2.gz	QYCJEKSWZLBEIA-ZWKOTPCHSA-N	0	3	326.827	3.390	20	30		EGEDHN
Cc1nc(C(F)(F)F)ccc1CN1CCC2SC(=O)C=C2C1	ZINC001141426342	1378323614	/nfs/dbraw/zinc/32/36/14/1378323614.db2.gz	ACUHEDMTOKXTIX-GFCCVEGCSA-N	0	3	328.359	3.183	20	30		EGEDHN
CCN1CCN(Cc2cc(Br)ccc2C#N)C(C)(C)C1	ZINC001141907902	1378392895	/nfs/dbraw/zinc/39/28/95/1378392895.db2.gz	SQKSVSKTKRJKGK-UHFFFAOYSA-N	0	3	336.277	3.237	20	30		EGEDHN
C[C@@H](CCNC(=O)c1cc(F)ccc1F)NCc1ccccc1C#N	ZINC001281721861	1378452817	/nfs/dbraw/zinc/45/28/17/1378452817.db2.gz	HXYGFFDHISFFDB-ZDUSSCGKSA-N	0	3	343.377	3.135	20	30		EGEDHN
O=C1C=C2CN(Cc3cc(F)cc(OC(F)(F)F)c3)CCC2S1	ZINC001143256718	1378570947	/nfs/dbraw/zinc/57/09/47/1378570947.db2.gz	RRGCPSMIVQBZBY-ZDUSSCGKSA-N	0	3	347.333	3.498	20	30		EGEDHN
C=CCCC(=O)N1CC2(C1)CCN([C@H]1CCc3c1cccc3F)C2	ZINC001147188384	1378983859	/nfs/dbraw/zinc/98/38/59/1378983859.db2.gz	YDTWEQVWZAQOHC-SFHVURJKSA-N	0	3	328.431	3.314	20	30		EGEDHN
C=CCCC(=O)N1CC2(C1)CCN(CCO[C@@H]1CCCC[C@@H]1C)C2	ZINC001147186830	1378984223	/nfs/dbraw/zinc/98/42/23/1378984223.db2.gz	CVMRDADNIKFUMD-ZWKOTPCHSA-N	0	3	334.504	3.082	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc(C3CC3)s2)s1	ZINC001147732606	1379068893	/nfs/dbraw/zinc/06/88/93/1379068893.db2.gz	IIHFIJJFPUPLJW-UHFFFAOYSA-N	0	3	331.466	3.078	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc(C3CC3)s2)cc1	ZINC001147732317	1379068885	/nfs/dbraw/zinc/06/88/85/1379068885.db2.gz	DUQPLFBOHSMQGN-UHFFFAOYSA-N	0	3	325.437	3.017	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)N1CC2(C1)CCN(Cc1ccc(C)nc1C)C2	ZINC001148086930	1379113731	/nfs/dbraw/zinc/11/37/31/1379113731.db2.gz	AZTJNXSANSSDPV-NVXWUHKLSA-N	0	3	341.499	3.191	20	30		EGEDHN
C=CCCCC(=O)N1CC2(C1)CCN(CCO[C@H]1CCCC[C@@H]1C)C2	ZINC001148180866	1379129166	/nfs/dbraw/zinc/12/91/66/1379129166.db2.gz	FQBIJPNVTPJPIS-OALUTQOASA-N	0	3	348.531	3.472	20	30		EGEDHN
CC[C@H](C)CCC(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001148485883	1379185764	/nfs/dbraw/zinc/18/57/64/1379185764.db2.gz	UUHCRYSXXJSMGL-KRWDZBQOSA-N	0	3	339.483	3.419	20	30		EGEDHN
CC[C@@H](C)[C@@H](C)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001148500594	1379192450	/nfs/dbraw/zinc/19/24/50/1379192450.db2.gz	JLZYGSLVBJJEHW-IAGOWNOFSA-N	0	3	339.483	3.275	20	30		EGEDHN
CCCCCCCCCC(=O)NCCN[C@@H](C)C(=O)N[C@H](C)CC	ZINC001148825870	1379277621	/nfs/dbraw/zinc/27/76/21/1379277621.db2.gz	NEGPNDWAZRJAFI-SJORKVTESA-N	0	3	341.540	3.136	20	30		EGEDHN
C=CCCC(=O)NC[C@H]1CN(Cc2ccc(C3CC3)cc2)CCCO1	ZINC001149361248	1379369162	/nfs/dbraw/zinc/36/91/62/1379369162.db2.gz	HNPXJOYXASRLLP-FQEVSTJZSA-N	0	3	342.483	3.237	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccsc2C(F)F)s1	ZINC001149397316	1379375613	/nfs/dbraw/zinc/37/56/13/1379375613.db2.gz	WVCIGXSAUIJDOU-UHFFFAOYSA-N	0	3	341.408	3.138	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H]1CN(Cc2cccc(C)c2)CCCO1	ZINC001149789637	1379446905	/nfs/dbraw/zinc/44/69/05/1379446905.db2.gz	PYWLMZADRHKOGD-LJQANCHMSA-N	0	3	330.472	3.058	20	30		EGEDHN
C#CCCN1CCCO[C@@H](CNC(=O)[C@H](CC)CCCCCC)C1	ZINC001150100413	1379495095	/nfs/dbraw/zinc/49/50/95/1379495095.db2.gz	POMZUVKOXZIQRX-MOPGFXCFSA-N	0	3	336.520	3.213	20	30		EGEDHN
CC#CCCCC(=O)NC[C@H]1CN([C@H](C)c2ccccc2)CCCO1	ZINC001150165482	1379507816	/nfs/dbraw/zinc/50/78/16/1379507816.db2.gz	LQRKLQWVAGZUMS-QUCCMNQESA-N	0	3	342.483	3.148	20	30		EGEDHN
C=CCCCC(=O)NC[C@H]1CN(Cc2ccc(CC)cc2)CCCO1	ZINC001150213155	1379516924	/nfs/dbraw/zinc/51/69/24/1379516924.db2.gz	WIHUEWHWTNUEOG-FQEVSTJZSA-N	0	3	344.499	3.312	20	30		EGEDHN
C#CCCN1CCCO[C@@H](CNC(=O)[C@H](CC2CCCC2)C(C)C)C1	ZINC001150404309	1379549669	/nfs/dbraw/zinc/54/96/69/1379549669.db2.gz	XVGPCBVQOJRIEO-VQTJNVASSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)[C@]2(C)CC[C@H](C)C2(C)C)C1	ZINC001150417897	1379551376	/nfs/dbraw/zinc/55/13/76/1379551376.db2.gz	UEPZSLYJLHFLED-QKLQHJQFSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)C(C)(C)c2ccccc2C)C1	ZINC001150830100	1379620333	/nfs/dbraw/zinc/62/03/33/1379620333.db2.gz	CNRJUUHIZSMYOL-GOSISDBHSA-N	0	3	344.499	3.056	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)C/C=C\c2ccc(C)cc2)C1	ZINC001150848068	1379621378	/nfs/dbraw/zinc/62/13/78/1379621378.db2.gz	DFHANTUMPOBWEZ-MNBNYPOFSA-N	0	3	342.483	3.182	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)C2=CCCCCC2)CC1	ZINC001151091259	1379660775	/nfs/dbraw/zinc/66/07/75/1379660775.db2.gz	VMFUAKDAGBTTPN-UHFFFAOYSA-N	0	3	334.504	3.440	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@H]2CCCC23CC3)CC1	ZINC001151174943	1379671906	/nfs/dbraw/zinc/67/19/06/1379671906.db2.gz	PTPGEUIBBMOWCH-QGZVFWFLSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2cc(C)sc2C)CC1	ZINC001151199372	1379675661	/nfs/dbraw/zinc/67/56/61/1379675661.db2.gz	RAALJHNYXNIHJJ-UHFFFAOYSA-N	0	3	336.501	3.152	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@@H]2[C@@H](C=C(C)C)C2(C)C)CC1	ZINC001151209026	1379677280	/nfs/dbraw/zinc/67/72/80/1379677280.db2.gz	DAZSDXDKSCHLCE-MSOLQXFVSA-N	0	3	348.531	3.398	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)C2CCC3(CC3)CC2)CC1	ZINC001151216232	1379678747	/nfs/dbraw/zinc/67/87/47/1379678747.db2.gz	FMOKHHQRLOOMOR-UHFFFAOYSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@@H](C)c2cc(C)oc2C)CC1	ZINC001151356932	1379705066	/nfs/dbraw/zinc/70/50/66/1379705066.db2.gz	JWNMVGYBCYRSRJ-INIZCTEOSA-N	0	3	348.487	3.173	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@H]2CC[C@H](CC)CC2)CC1	ZINC001151402478	1379711608	/nfs/dbraw/zinc/71/16/08/1379711608.db2.gz	HBPAIVSKOFGVSF-IYARVYRRSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2ccc(C)c(C)c2)CC1	ZINC001151405890	1379712264	/nfs/dbraw/zinc/71/22/64/1379712264.db2.gz	NDJOFESHJPBRLV-UHFFFAOYSA-N	0	3	330.472	3.090	20	30		EGEDHN
C[C@@H](C(=O)NCCNCc1cccc(C#N)c1)c1cccc(Cl)c1	ZINC001151641483	1379754046	/nfs/dbraw/zinc/75/40/46/1379754046.db2.gz	OCGCCLPKYNKBAE-CQSZACIVSA-N	0	3	341.842	3.221	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)c1cccs1	ZINC001151664001	1379760816	/nfs/dbraw/zinc/76/08/16/1379760816.db2.gz	OCCKDJKIFMMXPR-CYBMUJFWSA-N	0	3	345.443	3.399	20	30		EGEDHN
C=CC[C@H](C(=O)NCCNCc1sc(C)nc1C)c1ccccc1	ZINC001151838146	1379793823	/nfs/dbraw/zinc/79/38/23/1379793823.db2.gz	KNXIGWSKBVFQRX-KRWDZBQOSA-N	0	3	343.496	3.326	20	30		EGEDHN
CCCCCCCC[C@@H](C)C(=O)NCCN[C@@H](CCCC)C(N)=O	ZINC001151847911	1379799194	/nfs/dbraw/zinc/79/91/94/1379799194.db2.gz	BZULRJORWTZTQT-SJORKVTESA-N	0	3	341.540	3.123	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)c1occc1C	ZINC001151892942	1379812323	/nfs/dbraw/zinc/81/23/23/1379812323.db2.gz	JVGBRRYGLAEGJF-CQSZACIVSA-N	0	3	343.402	3.239	20	30		EGEDHN
C=CCC1(C(=O)NCCNCc2ccccc2N(C)C)CCCCC1	ZINC001152011186	1379838629	/nfs/dbraw/zinc/83/86/29/1379838629.db2.gz	ZRTKFUPJNAKHQL-UHFFFAOYSA-N	0	3	343.515	3.485	20	30		EGEDHN
CCSCCC(=O)NC[C@@H](C)N(CC)Cc1cccc(C#N)c1	ZINC001152071229	1379857015	/nfs/dbraw/zinc/85/70/15/1379857015.db2.gz	DRXUEYSAZIIQGU-OAHLLOKOSA-N	0	3	333.501	3.028	20	30		EGEDHN
CC[C@@H](C)CC(=O)NC[C@@H](C)N(CC)Cc1ccc(OC)c(C#N)c1	ZINC001153013023	1380008268	/nfs/dbraw/zinc/00/82/68/1380008268.db2.gz	YCJPNPVRDSSLJF-HZPDHXFCSA-N	0	3	345.487	3.330	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)C1CC(C)(C)C1	ZINC001153096566	1380019785	/nfs/dbraw/zinc/01/97/85/1380019785.db2.gz	LHSDMYOJVSMCCM-OAHLLOKOSA-N	0	3	327.472	3.321	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)C1CC(C)(C)C1	ZINC001153096952	1380019837	/nfs/dbraw/zinc/01/98/37/1380019837.db2.gz	VTANWIKBSRQEGI-OAHLLOKOSA-N	0	3	327.472	3.321	20	30		EGEDHN
C[C@@H](CCc1ccccc1)CC(=O)NCCNCc1ccc(C#N)cc1	ZINC001153214496	1380037657	/nfs/dbraw/zinc/03/76/57/1380037657.db2.gz	MTJVTOJGSIJXAG-SFHVURJKSA-N	0	3	349.478	3.423	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@H](C)N(CC)Cc1cccc(OC)c1	ZINC001154719427	1380339738	/nfs/dbraw/zinc/33/97/38/1380339738.db2.gz	BOPPKXFFSGMJTK-QGZVFWFLSA-N	0	3	330.472	3.215	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)[C@@H]1CCC1(C)C	ZINC001154735921	1380342826	/nfs/dbraw/zinc/34/28/26/1380342826.db2.gz	HNAFCUGWJSPUJW-QAPCUYQASA-N	0	3	327.472	3.321	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)[C@@H]1CCC1(C)C	ZINC001154757235	1380346705	/nfs/dbraw/zinc/34/67/05/1380346705.db2.gz	MKKBPGJOCOUEEM-PBHICJAKSA-N	0	3	345.462	3.460	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)[C@H]1C[C@H]2C[C@H]2C1	ZINC001154768710	1380347997	/nfs/dbraw/zinc/34/79/97/1380347997.db2.gz	WNZXJQQEEAWZEQ-ZSGPHXLJSA-N	0	3	343.446	3.070	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1	ZINC001155718422	1380486121	/nfs/dbraw/zinc/48/61/21/1380486121.db2.gz	MLFUFYBHIZROEZ-FHLIZLRMSA-N	0	3	332.875	3.293	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NC[C@@H](C)N(CC)Cc1cccc(F)c1	ZINC001155757551	1380489482	/nfs/dbraw/zinc/48/94/82/1380489482.db2.gz	VRWOODFQTPJHKU-MNEFBYGVSA-N	0	3	348.462	3.134	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@@]1(C)CCCc2ccccc21	ZINC001155838683	1380497956	/nfs/dbraw/zinc/49/79/56/1380497956.db2.gz	AOKKLLNSQSESBQ-UTKZUKDTSA-N	0	3	326.484	3.131	20	30		EGEDHN
C[C@H]1CCN(Cc2ccccc2)C[C@@H]1N(C)c1nccc(C#N)c1F	ZINC001156342113	1380561443	/nfs/dbraw/zinc/56/14/43/1380561443.db2.gz	XDYCHIXFCNCNCF-YJBOKZPZSA-N	0	3	338.430	3.439	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1cc2c(s1)CC[C@H](C)C2	ZINC001156858249	1380703278	/nfs/dbraw/zinc/70/32/78/1380703278.db2.gz	OHVZPYMDDVXKLQ-LSDHHAIUSA-N	0	3	332.513	3.336	20	30		EGEDHN
N#Cc1cc(Cl)ncc1C(F)(F)N1CCN[C@H](c2ccccc2)C1	ZINC001157764780	1381027391	/nfs/dbraw/zinc/02/73/91/1381027391.db2.gz	FRTWVZSOOKMCGZ-HNNXBMFYSA-N	0	3	348.784	3.302	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)C1=CCCCCC1	ZINC001157871809	1381055070	/nfs/dbraw/zinc/05/50/70/1381055070.db2.gz	SAIOIWZOLMGBIU-LJQANCHMSA-N	0	3	334.504	3.392	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1csc([C@@H]2CCCO2)n1	ZINC001157957891	1381081380	/nfs/dbraw/zinc/08/13/80/1381081380.db2.gz	JYSHWXLIIYUCOI-ZBFHGGJFSA-N	0	3	349.500	3.107	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc2nc(C)oc2c1	ZINC001158096366	1381126859	/nfs/dbraw/zinc/12/68/59/1381126859.db2.gz	FDIADEZRAARJTD-MRXNPFEDSA-N	0	3	327.428	3.249	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H]1Cc2cc(Cl)ccc2O1	ZINC001158199967	1381157710	/nfs/dbraw/zinc/15/77/10/1381157710.db2.gz	OFPNKFKDCZHBJH-SJLPKXTDSA-N	0	3	348.874	3.142	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@@H]1C[C@H]1CC(C)(C)C	ZINC001158389381	1381228744	/nfs/dbraw/zinc/22/87/44/1381228744.db2.gz	BUKYDVZWBYBHOA-QWHCGFSZSA-N	0	3	331.298	3.063	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)Cc1cccc(C)c1	ZINC001158419462	1381240415	/nfs/dbraw/zinc/24/04/15/1381240415.db2.gz	QQQGDDRQESBPIK-HXUWFJFHSA-N	0	3	344.499	3.053	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1cc(C)cc(F)c1	ZINC001158519129	1381278820	/nfs/dbraw/zinc/27/88/20/1381278820.db2.gz	VCBUPXRYZHZVEI-LJQANCHMSA-N	0	3	348.462	3.263	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cnc([C@H]2CCCO2)s1	ZINC001158565639	1381303071	/nfs/dbraw/zinc/30/30/71/1381303071.db2.gz	VUBTUDZJKJPKTG-HUUCEWRRSA-N	0	3	349.500	3.107	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1ccc(CC)cc1	ZINC001158818117	1381413128	/nfs/dbraw/zinc/41/31/28/1381413128.db2.gz	AORFOCNNFGRVJK-HXUWFJFHSA-N	0	3	344.499	3.378	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1ccc(C)c(C)c1	ZINC001158824881	1381418527	/nfs/dbraw/zinc/41/85/27/1381418527.db2.gz	AYLVCLLFLSCUGO-HXUWFJFHSA-N	0	3	344.499	3.433	20	30		EGEDHN
N#Cc1ccc(CN2CC=C(CCNC(=O)C3=CCCC3)CC2)cc1	ZINC001159781500	1381897863	/nfs/dbraw/zinc/89/78/63/1381897863.db2.gz	WQBXACIASDKBGB-UHFFFAOYSA-N	0	3	335.451	3.307	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ncoc2-c2ccccc2)CC1	ZINC001160286449	1382062229	/nfs/dbraw/zinc/06/22/29/1382062229.db2.gz	QFSMTSVOZNCRJI-UHFFFAOYSA-N	0	3	349.434	3.117	20	30		EGEDHN
COc1ccc(C#Cc2ccccc2Nc2ccncc2CN)cc1	ZINC001160358045	1382082350	/nfs/dbraw/zinc/08/23/50/1382082350.db2.gz	CRQKKOKXYWLHLX-UHFFFAOYSA-N	0	3	329.403	3.114	20	30		EGEDHN
N#Cc1ccc(CN2CC=C(CCNC(=O)[C@]34C[C@H]3CCC4)CC2)cc1	ZINC001160754301	1382187258	/nfs/dbraw/zinc/18/72/58/1382187258.db2.gz	IJKKUZYTHPNBPF-IFMALSPDSA-N	0	3	349.478	3.387	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)[C@H]1CCC=CCCC1	ZINC001160820709	1382208260	/nfs/dbraw/zinc/20/82/60/1382208260.db2.gz	RYMSGJFFZOTUCT-KRWDZBQOSA-N	0	3	325.456	3.291	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)[C@H]2CCC=CCCC2)c1	ZINC001160820530	1382208773	/nfs/dbraw/zinc/20/87/73/1382208773.db2.gz	MFMRDTGCRGSGAK-KRWDZBQOSA-N	0	3	343.446	3.430	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCC1=CCN(CCc2ccns2)CC1	ZINC001160940876	1382243550	/nfs/dbraw/zinc/24/35/50/1382243550.db2.gz	HFGXRTUVNIGGEJ-JKSUJKDBSA-N	0	3	347.528	3.282	20	30		EGEDHN
CCCC[C@@](C)(F)C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001161287815	1382361250	/nfs/dbraw/zinc/36/12/50/1382361250.db2.gz	ALFGMVGWZCLIKL-GOSISDBHSA-N	0	3	337.414	3.212	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc3c(c2)C=CCC3)CC1	ZINC001161452797	1382415768	/nfs/dbraw/zinc/41/57/68/1382415768.db2.gz	ZDAXLNBZBJXJBU-UHFFFAOYSA-N	0	3	334.463	3.421	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C2(c3ccccc3F)CC2)CC1	ZINC001161622543	1382462185	/nfs/dbraw/zinc/46/21/85/1382462185.db2.gz	PAQLILPZNTUMEW-UHFFFAOYSA-N	0	3	328.431	3.182	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccnc(O[C@H](C)CC)c2)CC1	ZINC001161668413	1382475120	/nfs/dbraw/zinc/47/51/20/1382475120.db2.gz	AFADAZRKYDJWDD-MRXNPFEDSA-N	0	3	343.471	3.197	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc(CC)c(C)s2)CC1	ZINC001161834413	1382524978	/nfs/dbraw/zinc/52/49/78/1382524978.db2.gz	IKBRWBIVSWJANZ-UHFFFAOYSA-N	0	3	330.497	3.394	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H]2C[C@@H]2c2cc(F)ccc2F)CC1	ZINC001161904171	1382545905	/nfs/dbraw/zinc/54/59/05/1382545905.db2.gz	HTJHGONLXBGQOI-SJLPKXTDSA-N	0	3	346.421	3.393	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H](C)Cc2ccc(OC)cc2)CC1	ZINC001161919233	1382552246	/nfs/dbraw/zinc/55/22/46/1382552246.db2.gz	MIGNNVZKFWIHBI-QGZVFWFLSA-N	0	3	342.483	3.198	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)Cc2cc3ccccc3n2C)CC1	ZINC001161968289	1382575970	/nfs/dbraw/zinc/57/59/70/1382575970.db2.gz	NPOIYMKEQMDFNE-UHFFFAOYSA-N	0	3	337.467	3.045	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)CCCC(C)(C)C)(COC)CC1	ZINC001162165127	1382645806	/nfs/dbraw/zinc/64/58/06/1382645806.db2.gz	FEDMVUCJZVXMND-UHFFFAOYSA-N	0	3	336.520	3.071	20	30		EGEDHN
Cc1ccc(CCC(=O)NCCCNCc2ccccc2C#N)cc1	ZINC001162172010	1382647897	/nfs/dbraw/zinc/64/78/97/1382647897.db2.gz	IAMGDKWEAFYNJM-UHFFFAOYSA-N	0	3	335.451	3.095	20	30		EGEDHN
C#CCN1CCC(CNC(=O)CCC[C@@H](C)CCC)(COC)CC1	ZINC001162283161	1382720554	/nfs/dbraw/zinc/72/05/54/1382720554.db2.gz	NUKRZOMLNBTKIU-SFHVURJKSA-N	0	3	336.520	3.071	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@@]2(C)CCC[C@H]2CC)(COC)CC1	ZINC001162327056	1382730595	/nfs/dbraw/zinc/73/05/95/1382730595.db2.gz	OFKYUIKZDNKQRW-QUCCMNQESA-N	0	3	348.531	3.071	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@H]2CCC[C@H]2CCC)(COC)CC1	ZINC001162335270	1382732497	/nfs/dbraw/zinc/73/24/97/1382732497.db2.gz	HPVPEBKQXUGHAX-MOPGFXCFSA-N	0	3	348.531	3.071	20	30		EGEDHN
C[C@@H](N)c1nc2ccccc2n1-c1ccc(Br)c(C#N)n1	ZINC001162776903	1382869456	/nfs/dbraw/zinc/86/94/56/1382869456.db2.gz	FZZNYMTYLJJYRL-SECBINFHSA-N	0	3	342.200	3.074	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@]1(C)CC=CCC1	ZINC001162822228	1382886078	/nfs/dbraw/zinc/88/60/78/1382886078.db2.gz	JZXASQGCXLBJJC-QFIPXVFZSA-N	0	3	338.495	3.417	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C[C@@H]1CC[C@H]2C[C@H]21	ZINC001162847726	1382893491	/nfs/dbraw/zinc/89/34/91/1382893491.db2.gz	AJSBTINRLMJXGC-PCCBWWKXSA-N	0	3	338.495	3.107	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1ccc(C)c(F)c1	ZINC001162856740	1382897370	/nfs/dbraw/zinc/89/73/70/1382897370.db2.gz	NIHIJROHFWVSEE-UHFFFAOYSA-N	0	3	338.426	3.042	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H](C)CC(C)(C)C	ZINC001162952351	1382925822	/nfs/dbraw/zinc/92/58/22/1382925822.db2.gz	MSAIHIBKUZQFHR-GOSISDBHSA-N	0	3	328.500	3.353	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)Cc1ccc(C)c(C)c1	ZINC001162992191	1382940221	/nfs/dbraw/zinc/94/02/21/1382940221.db2.gz	GYWQMVBJTBJHLE-UHFFFAOYSA-N	0	3	348.490	3.140	20	30		EGEDHN
CCCCC(=O)NCCC1(CNCc2cc(C#N)ccc2OC)CC1	ZINC001163464479	1383057669	/nfs/dbraw/zinc/05/76/69/1383057669.db2.gz	LSMOQWAWFGIOCF-UHFFFAOYSA-N	0	3	343.471	3.133	20	30		EGEDHN
CC/C=C(/C)C(=O)NCCC1(CNCc2ccc(C#N)cc2F)CC1	ZINC001163676543	1383103397	/nfs/dbraw/zinc/10/33/97/1383103397.db2.gz	BGGPBNWCBXCXCQ-TVPGTPATSA-N	0	3	343.446	3.430	20	30		EGEDHN
CN(C)C(=O)Cc1ccc(NC(=N)c2ccc(C(F)(F)F)cc2)cc1	ZINC001163680915	1383104808	/nfs/dbraw/zinc/10/48/08/1383104808.db2.gz	YVPLAKURFAPJEQ-UHFFFAOYSA-N	0	3	349.356	3.373	20	30		EGEDHN
C#CCCCCCC(=O)NCCCNCc1oc(CCC)nc1C	ZINC001163969820	1383141468	/nfs/dbraw/zinc/14/14/68/1383141468.db2.gz	TWTOGSXLMIRTPN-UHFFFAOYSA-N	0	3	333.476	3.115	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)C[C@H]2CC=CCC2)c(F)c1	ZINC001164001697	1383145053	/nfs/dbraw/zinc/14/50/53/1383145053.db2.gz	SWANBSSJYSJBRD-HNNXBMFYSA-N	0	3	329.419	3.040	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCCNCc1ccn(C2CCCC2)n1	ZINC001164221929	1383167755	/nfs/dbraw/zinc/16/77/55/1383167755.db2.gz	GTFRUCPYORPUIW-JKSUJKDBSA-N	0	3	332.492	3.052	20	30		EGEDHN
CCCC1(C(=O)NCCCNCc2ccc(C#N)cc2F)CCC1	ZINC001164233385	1383169165	/nfs/dbraw/zinc/16/91/65/1383169165.db2.gz	FPRVEJNIITXYCL-UHFFFAOYSA-N	0	3	331.435	3.264	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C2(CCOCC)CCC2)CC1	ZINC001164540671	1383197710	/nfs/dbraw/zinc/19/77/10/1383197710.db2.gz	NEEOZHXMJCEUBA-UHFFFAOYSA-N	0	3	342.911	3.212	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCC1(CNCc2ccns2)CC1	ZINC001164647726	1383213831	/nfs/dbraw/zinc/21/38/31/1383213831.db2.gz	GUNMYOPWQNSYSO-UHFFFAOYSA-N	0	3	333.501	3.288	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C[C@@H]2Cc3ccccc3O2)CC1	ZINC001164669061	1383216091	/nfs/dbraw/zinc/21/60/91/1383216091.db2.gz	GEOAATPHGHDSRS-INIZCTEOSA-N	0	3	348.874	3.009	20	30		EGEDHN
CC(C)(C)N1CCN(c2c(C#N)cnc3cnc(Cl)cc32)CC1	ZINC001165089127	1383226329	/nfs/dbraw/zinc/22/63/29/1383226329.db2.gz	WURBUDZMVABWNE-UHFFFAOYSA-N	0	3	329.835	3.075	20	30		EGEDHN
C=C(C)CCC(=O)NCCC1(CN[C@@H](C)c2cnc(C)cn2)CC1	ZINC001165258919	1383259915	/nfs/dbraw/zinc/25/99/15/1383259915.db2.gz	WJZTWTWSPKSZDV-INIZCTEOSA-N	0	3	330.476	3.078	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc3cc(C)cn3c2)CC1	ZINC001165373266	1383282578	/nfs/dbraw/zinc/28/25/78/1383282578.db2.gz	GAKJVDYQWYREAQ-UHFFFAOYSA-N	0	3	345.874	3.490	20	30		EGEDHN
C=CCCCC(=O)NCCCNCC(=O)Nc1cccc(C(C)C)c1	ZINC001165530074	1383307136	/nfs/dbraw/zinc/30/71/36/1383307136.db2.gz	DHHKRNAKCRTZAQ-UHFFFAOYSA-N	0	3	345.487	3.201	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc3nc(C)oc3c2)CC1	ZINC001165609619	1383315185	/nfs/dbraw/zinc/31/51/85/1383315185.db2.gz	JYYPNWGLUDHMOG-UHFFFAOYSA-N	0	3	347.846	3.378	20	30		EGEDHN
CC1(CC(=O)NCCC2(CNCc3ccccc3C#N)CC2)CC1	ZINC001166216651	1383402969	/nfs/dbraw/zinc/40/29/69/1383402969.db2.gz	GNAXGRKDCJLWNQ-UHFFFAOYSA-N	0	3	325.456	3.125	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)[C@@H](C)CCc1ccccc1F	ZINC001166469178	1383424924	/nfs/dbraw/zinc/42/49/24/1383424924.db2.gz	DGSLVTGSGSVKFE-ZDUSSCGKSA-N	0	3	326.843	3.243	20	30		EGEDHN
C[C@@H](C(=O)NCCCNCc1ccc(C#N)cc1F)c1ccsc1	ZINC001166497477	1383429706	/nfs/dbraw/zinc/42/97/06/1383429706.db2.gz	NIPZCIZMOWLFGD-CYBMUJFWSA-N	0	3	345.443	3.158	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCCC1(CN[C@H](C)c2cnc(C)cn2)CC1	ZINC001166765695	1383474370	/nfs/dbraw/zinc/47/43/70/1383474370.db2.gz	VTZWLFMVRONVCV-SJORKVTESA-N	0	3	344.503	3.324	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C2(C(F)F)CCCC2)CC1	ZINC001166808986	1383480612	/nfs/dbraw/zinc/48/06/12/1383480612.db2.gz	NPHUOICPZRNRMK-UHFFFAOYSA-N	0	3	334.838	3.441	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@@H]2Cc3ccc(F)cc32)CC1	ZINC001166835965	1383484997	/nfs/dbraw/zinc/48/49/97/1383484997.db2.gz	CISXGZXZUVDLII-MRXNPFEDSA-N	0	3	336.838	3.094	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCC1(CNCC(=C)Br)CC1	ZINC001167339537	1383602967	/nfs/dbraw/zinc/60/29/67/1383602967.db2.gz	GILKQHFHSKNCEK-UHFFFAOYSA-N	0	3	343.309	3.373	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)CO[C@H]2CCCC[C@@H]2C)CC1	ZINC001167370030	1383612637	/nfs/dbraw/zinc/61/26/37/1383612637.db2.gz	DHTNWCZBMGRDGI-HOCLYGCPSA-N	0	3	342.911	3.210	20	30		EGEDHN
C[C@@H]1CC[C@H](C(=O)NCCC2(CNCc3ccccc3C#N)CC2)C1	ZINC001167382408	1383617457	/nfs/dbraw/zinc/61/74/57/1383617457.db2.gz	UUIPZHGZQCJPBC-SJORKVTESA-N	0	3	339.483	3.371	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cc(C(C)C)no2)CC1	ZINC001167385900	1383619897	/nfs/dbraw/zinc/61/98/97/1383619897.db2.gz	YBTCRSBJVQXDQK-UHFFFAOYSA-N	0	3	325.840	3.040	20	30		EGEDHN
CC[C@@]1(C)C[C@H]1C(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001167583029	1383679098	/nfs/dbraw/zinc/67/90/98/1383679098.db2.gz	FDCQFEACQVQBHV-ICSRJNTNSA-N	0	3	339.483	3.371	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C[C@H]2CCO[C@@H](CC)C2)CC1	ZINC001167657983	1383701204	/nfs/dbraw/zinc/70/12/04/1383701204.db2.gz	KFFJWTSUXOUDHD-HOTGVXAUSA-N	0	3	342.911	3.210	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C[C@H]2OCc3ccccc32)CC1	ZINC001167915265	1383769237	/nfs/dbraw/zinc/76/92/37/1383769237.db2.gz	BMRPOOMUNVULAU-QGZVFWFLSA-N	0	3	348.874	3.277	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)CCc2cccs2)CC1	ZINC001168057950	1383805664	/nfs/dbraw/zinc/80/56/64/1383805664.db2.gz	KUBLPRNUUGHNME-UHFFFAOYSA-N	0	3	326.893	3.309	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2ccc(C#N)c(F)c2)CN1C(=O)OC(C)(C)C	ZINC001168821575	1384019148	/nfs/dbraw/zinc/01/91/48/1384019148.db2.gz	FBBJXRGWECBKLM-DOMZBBRYSA-N	0	3	333.407	3.185	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)C=C1CCC1	ZINC001170143761	1384248074	/nfs/dbraw/zinc/24/80/74/1384248074.db2.gz	XGCJCKITTRZCKC-INIZCTEOSA-N	0	3	325.456	3.433	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1ccc2ccncc2c1	ZINC001170303318	1384285911	/nfs/dbraw/zinc/28/59/11/1384285911.db2.gz	DOLIMZDDQHNCLV-UHFFFAOYSA-N	0	3	344.418	3.016	20	30		EGEDHN
C[C@H](CCCCNCc1cc(O)ccc1Cl)NC(=O)C#CC1CC1	ZINC001170673927	1384361584	/nfs/dbraw/zinc/36/15/84/1384361584.db2.gz	JJPVNSFDYBFYKX-CQSZACIVSA-N	0	3	348.874	3.224	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H](C)CCCCN[C@@H](C)c1nnc(C)[nH]1	ZINC001170963528	1384419468	/nfs/dbraw/zinc/41/94/68/1384419468.db2.gz	QCDQORHPZMCBAB-CABCVRRESA-N	0	3	347.507	3.207	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H](C)CCCCNCc1nccn1CC	ZINC001170974715	1384421427	/nfs/dbraw/zinc/42/14/27/1384421427.db2.gz	UDZWLLUJCLNTCJ-QGZVFWFLSA-N	0	3	346.519	3.436	20	30		EGEDHN
C=CCOC(=O)[C@@H](N)CCCCNc1ccc2cnc(C)cc2c1	ZINC001171074646	1384441609	/nfs/dbraw/zinc/44/16/09/1384441609.db2.gz	FIUXNRQWWYJSLA-SFHVURJKSA-N	0	3	327.428	3.182	20	30		EGEDHN
CC[C@H](C)[C@H]([NH2+][C@@H]1CCc2cc(Cl)cc(Cl)c2C1)C(=O)N[O-]	ZINC001171074943	1384441815	/nfs/dbraw/zinc/44/18/15/1384441815.db2.gz	WDWNJUAEPLOXJO-UAKXVISKSA-N	0	3	345.270	3.360	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)CCCCNCc2nc(C)cs2)CCC1	ZINC001171196427	1384466483	/nfs/dbraw/zinc/46/64/83/1384466483.db2.gz	NVBPIRQIYJAYPS-OAHLLOKOSA-N	0	3	347.528	3.410	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1CCCC[C@@](O)(C(F)(F)F)C1	ZINC001171208549	1384469159	/nfs/dbraw/zinc/46/91/59/1384469159.db2.gz	DEXKYRMYYNGVHF-CJNGLKHVSA-N	0	3	326.362	3.269	20	30		EGEDHN
CN(C)Cc1ccc(NC2(C#N)CCN(Cc3ccccc3)CC2)nc1	ZINC001171274892	1384483381	/nfs/dbraw/zinc/48/33/81/1384483381.db2.gz	JSEYLXHXCDVMCC-UHFFFAOYSA-N	0	3	349.482	3.113	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)CC(CC)CC)C1	ZINC001316639955	1384499765	/nfs/dbraw/zinc/49/97/65/1384499765.db2.gz	QQHCKBPQCUYNHC-HDJSIYSDSA-N	0	3	331.298	3.206	20	30		EGEDHN
N=C(N[C@H]1CCc2cc(F)c(F)c(F)c2C1)c1ccc(Cl)cn1	ZINC001171510737	1384547501	/nfs/dbraw/zinc/54/75/01/1384547501.db2.gz	DGERNXYMLDKLBX-JTQLQIEISA-N	0	3	339.748	3.415	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1cnc(C)s1	ZINC001316874812	1384660118	/nfs/dbraw/zinc/66/01/18/1384660118.db2.gz	UJSOYQFVUQAOFY-AAEUAGOBSA-N	0	3	327.881	3.177	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)n1nc(C(F)(F)F)c2c1CCNC2	ZINC001172310973	1384765927	/nfs/dbraw/zinc/76/59/27/1384765927.db2.gz	MRRXXANQIAFYQB-NSHDSACASA-N	0	3	334.345	3.223	20	30		EGEDHN
CCOC(=O)c1ccc(N2CCN([C@@H](C)CCCC#N)CC2)cc1	ZINC001172497420	1384804772	/nfs/dbraw/zinc/80/47/72/1384804772.db2.gz	BTEQQDRTBJHLHP-INIZCTEOSA-N	0	3	329.444	3.068	20	30		EGEDHN
C[C@@H](CCCC#N)N1CCC(c2ccc(S(C)(=O)=O)cc2)CC1	ZINC001172506548	1384807025	/nfs/dbraw/zinc/80/70/25/1384807025.db2.gz	WANMMWREPBRBCT-HNNXBMFYSA-N	0	3	334.485	3.352	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@H](NC(=O)CCC3CCCC3)C2)c1	ZINC001317070055	1384838811	/nfs/dbraw/zinc/83/88/11/1384838811.db2.gz	CLZFPNWEZRDJII-IYARVYRRSA-N	0	3	343.446	3.405	20	30		EGEDHN
C=CCOC1CCC(N2CCN(C(=O)OC(C)(C)C)[C@@H](C)C2)CC1	ZINC001173320398	1384957764	/nfs/dbraw/zinc/95/77/64/1384957764.db2.gz	HPLRSOBIYQNQMT-GTPINHCMSA-N	0	3	338.492	3.441	20	30		EGEDHN
C=CCOC1CCC(N2CCN(c3cccc(OCC)n3)CC2)CC1	ZINC001173326810	1384959200	/nfs/dbraw/zinc/95/92/00/1384959200.db2.gz	RWDJKMVEULBPJW-UHFFFAOYSA-N	0	3	345.487	3.116	20	30		EGEDHN
C=CCOC1CCC(N2CCN(c3ccc(Cl)cn3)CC2)CC1	ZINC001173326408	1384959324	/nfs/dbraw/zinc/95/93/24/1384959324.db2.gz	GTZJRUKWJGMGMH-UHFFFAOYSA-N	0	3	335.879	3.371	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@]1(F)CCN(C2CCC(C)(C#N)CC2)C1	ZINC001173601521	1384985898	/nfs/dbraw/zinc/98/58/98/1384985898.db2.gz	UXFNQJTYMLFIFD-UYJHFMRCSA-N	0	3	339.455	3.398	20	30		EGEDHN
C[C@H](NC(=O)C1(C)CCC1)[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001317211300	1384991049	/nfs/dbraw/zinc/99/10/49/1384991049.db2.gz	XYUIZVMQHRRAFX-LPHOPBHVSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC[C@@H](F)C(=O)N[C@H](C)CCCCNCc1cc(F)ccc1C#N	ZINC001174725398	1385140735	/nfs/dbraw/zinc/14/07/35/1385140735.db2.gz	OPCZFMXSDHBYAB-CXAGYDPISA-N	0	3	337.414	3.210	20	30		EGEDHN
CCN(CCNC(=O)[C@@H]1CC12CCCC2)Cc1cccc(C#N)c1	ZINC001317488498	1385187114	/nfs/dbraw/zinc/18/71/14/1385187114.db2.gz	HCTNMYGRNSFMFU-SFHVURJKSA-N	0	3	325.456	3.077	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H](C)CCCCNCc2cc(OC)no2)CC1	ZINC001175081971	1385191642	/nfs/dbraw/zinc/19/16/42/1385191642.db2.gz	LNNXOWXVBTXETF-OAHLLOKOSA-N	0	3	349.475	3.194	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H](C)CCCCNCc1nnc(C(C)C)[nH]1	ZINC001175082499	1385192050	/nfs/dbraw/zinc/19/20/50/1385192050.db2.gz	ORFOJBPEPDJKBA-HNAYVOBHSA-N	0	3	349.523	3.295	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)CCCCNCc2cc(OC)no2)CCC1	ZINC001175097754	1385194444	/nfs/dbraw/zinc/19/44/44/1385194444.db2.gz	KSPMGFHVCZIAEL-HNNXBMFYSA-N	0	3	349.475	3.194	20	30		EGEDHN
CCCN(CCNC(=O)C1(C)CCCC1)Cc1ccc(C#N)cc1	ZINC001317542622	1385282957	/nfs/dbraw/zinc/28/29/57/1385282957.db2.gz	FTCSEKPWRCWKKK-UHFFFAOYSA-N	0	3	327.472	3.467	20	30		EGEDHN
Cc1ccc2[nH]ncc2c1Nc1ccc(N2CCN(C)CC2)c(C#N)c1	ZINC001175526807	1385320380	/nfs/dbraw/zinc/32/03/80/1385320380.db2.gz	VKUFGAKVFLEIBY-UHFFFAOYSA-N	0	3	346.438	3.238	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@@H](C)c1ccccc1C	ZINC001176790399	1385699468	/nfs/dbraw/zinc/69/94/68/1385699468.db2.gz	LWKZTKJXJNMLNY-AWEZNQCLSA-N	0	3	339.277	3.103	20	30		EGEDHN
C=C(Br)CNC[C@]1(NC(=O)C(C)C)CCCC[C@@H]1C	ZINC001318739254	1385847609	/nfs/dbraw/zinc/84/76/09/1385847609.db2.gz	BKONEDSBXXFBIW-SWLSCSKDSA-N	0	3	331.298	3.206	20	30		EGEDHN
C=C(Br)CNC[C@@]1(NC(=O)C(C)C)CCCC[C@@H]1C	ZINC001318739256	1385847709	/nfs/dbraw/zinc/84/77/09/1385847709.db2.gz	BKONEDSBXXFBIW-WFASDCNBSA-N	0	3	331.298	3.206	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)c1ccon1	ZINC001177235863	1385879265	/nfs/dbraw/zinc/87/92/65/1385879265.db2.gz	NZJQULQLADOXMT-UHFFFAOYSA-N	0	3	325.840	3.039	20	30		EGEDHN
C=CCCC(=O)N(CCCNCc1cnoc1C)CC1CCCC1	ZINC001177245992	1385882748	/nfs/dbraw/zinc/88/27/48/1385882748.db2.gz	SZKPQNBXNGDONG-UHFFFAOYSA-N	0	3	333.476	3.448	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)c1ocnc1C	ZINC001177279169	1385894933	/nfs/dbraw/zinc/89/49/33/1385894933.db2.gz	STBXLJKPSFCEQI-UHFFFAOYSA-N	0	3	339.867	3.348	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)c1ccc(C#N)[nH]1	ZINC001177285902	1385898038	/nfs/dbraw/zinc/89/80/38/1385898038.db2.gz	JNIIUAWPVDCAAF-UHFFFAOYSA-N	0	3	348.878	3.251	20	30		EGEDHN
CCc1ccccc1C(=O)NC[C@H](C)CNCc1ccccc1C#N	ZINC001319230924	1386015735	/nfs/dbraw/zinc/01/57/35/1386015735.db2.gz	DIIVGPNKYYULIU-MRXNPFEDSA-N	0	3	335.451	3.276	20	30		EGEDHN
COC(=O)c1c(C)scc1NC(=O)C(C#N)Cc1cccs1	ZINC001177905069	1386079181	/nfs/dbraw/zinc/07/91/81/1386079181.db2.gz	VVDPFHCUOWFWBK-SNVBAGLBSA-N	0	3	334.422	3.226	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2scnc2Cl)CCCC1	ZINC001698636826	1406283228	/nfs/dbraw/zinc/28/32/28/1406283228.db2.gz	WSUFEFBNHYPROE-UHFFFAOYSA-N	0	3	334.272	3.181	20	30		EGEDHN
N#Cc1ccccc1CNCCCCCCNC(=O)CCC(F)F	ZINC001179029178	1386381664	/nfs/dbraw/zinc/38/16/64/1386381664.db2.gz	CPADPVMBDCCGMD-UHFFFAOYSA-N	0	3	337.414	3.370	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2cccc(Cl)c2)CCN1C(=O)CC1(C)CC1	ZINC001179165398	1386415650	/nfs/dbraw/zinc/41/56/50/1386415650.db2.gz	WDZWVNJGXJOLOF-YJBOKZPZSA-N	0	3	344.886	3.461	20	30		EGEDHN
C#CCCCCCC(=O)NCCCCCCN[C@@H](C)c1nnc(C)[nH]1	ZINC001179239888	1386429803	/nfs/dbraw/zinc/42/98/03/1386429803.db2.gz	OVHCJTWJHIPTHO-INIZCTEOSA-N	0	3	347.507	3.024	20	30		EGEDHN
C[C@H]1C[C@@H]1CC(=O)NCCCCCCNCc1ccccc1C#N	ZINC001179474226	1386491900	/nfs/dbraw/zinc/49/19/00/1386491900.db2.gz	CVNIDVDLCONNIE-QFBILLFUSA-N	0	3	327.472	3.371	20	30		EGEDHN
CCCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2ccccc2C#N)C1	ZINC001180625986	1386851338	/nfs/dbraw/zinc/85/13/38/1386851338.db2.gz	ZAGFVDAVIYEUJO-OXQOHEQNSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2nc3ccccc3o2)C1	ZINC001180846384	1386883414	/nfs/dbraw/zinc/88/34/14/1386883414.db2.gz	KLCNAMUOLCAUKW-FOIQADDNSA-N	0	3	341.455	3.368	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2CCC2)C[C@@]1(C)CNCc1ccccc1C#N	ZINC001181019578	1386916988	/nfs/dbraw/zinc/91/69/88/1386916988.db2.gz	HRVMMZPKLRHTMS-IIBYNOLFSA-N	0	3	339.483	3.323	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@@H](C)[C@](C)(CNCc2c(F)cccc2F)C1	ZINC001181460232	1386997766	/nfs/dbraw/zinc/99/77/66/1386997766.db2.gz	HQCVONGGXQYPCF-FOIQADDNSA-N	0	3	348.437	3.198	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)C12CCC(CC1)CC2	ZINC001322299705	1387149919	/nfs/dbraw/zinc/14/99/19/1387149919.db2.gz	WOPIMZRBGFOVJY-BQJIDLTASA-N	0	3	339.483	3.465	20	30		EGEDHN
CN1CCC(N(C(=O)CCc2cccc(C#N)c2)C2CCCC2)CC1	ZINC001182340303	1387152474	/nfs/dbraw/zinc/15/24/74/1387152474.db2.gz	KEUXGJZMUNJXNZ-UHFFFAOYSA-N	0	3	339.483	3.356	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@@H](N[C@@H](C)c2ccc(F)c(Cl)c2)C1	ZINC001182414172	1387163198	/nfs/dbraw/zinc/16/31/98/1387163198.db2.gz	FDLIEHDTDCUXTQ-DZGCQCFKSA-N	0	3	336.838	3.390	20	30		EGEDHN
CCC(C)(C)CC(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001182848798	1387234887	/nfs/dbraw/zinc/23/48/87/1387234887.db2.gz	UTPNGFYMQYXGPW-MRXNPFEDSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N1CCC(C(C)C)CC1	ZINC001338694319	1389734706	/nfs/dbraw/zinc/73/47/06/1389734706.db2.gz	VLHRZOAUALPHEI-KRWDZBQOSA-N	0	3	331.508	3.146	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@H](CC(F)F)CN1CCC(CC#N)CC1	ZINC001331995671	1389939790	/nfs/dbraw/zinc/93/97/90/1389939790.db2.gz	SBVBTYYIARSKJO-CYBMUJFWSA-N	0	3	331.407	3.161	20	30		EGEDHN
Cc1cccc(C)c1C(=O)NC[C@@H](C)CNCc1ccccc1C#N	ZINC001698763167	1406417843	/nfs/dbraw/zinc/41/78/43/1406417843.db2.gz	PBGGCLGNSLRROC-HNNXBMFYSA-N	0	3	335.451	3.331	20	30		EGEDHN
C=CCn1c([C@H](C)OC(C)(C)C)nnc1N1CCN([C@@H](C)CC)CC1	ZINC001339775578	1390139307	/nfs/dbraw/zinc/13/93/07/1390139307.db2.gz	WMBVYYXXZOXDJH-HOTGVXAUSA-N	0	3	349.523	3.261	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc(-n2nc(C)cc2C)c(F)c1	ZINC001339839000	1390168147	/nfs/dbraw/zinc/16/81/47/1390168147.db2.gz	PIZRYHCEVYNSAI-INIZCTEOSA-N	0	3	330.407	3.250	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N1CCC[C@H](CC)CC1	ZINC001340207109	1390250220	/nfs/dbraw/zinc/25/02/20/1390250220.db2.gz	KDRRNYHZLNHAKQ-IRXDYDNUSA-N	0	3	331.508	3.290	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)NCCc1nc(-c2ccccc2)c(C)s1	ZINC001340232640	1390255092	/nfs/dbraw/zinc/25/50/92/1390255092.db2.gz	GVQAOUXUCFZZDG-INIZCTEOSA-N	0	3	343.496	3.461	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1cc(Cl)ccc1O[C@H](C)COC	ZINC001340383189	1390280330	/nfs/dbraw/zinc/28/03/30/1390280330.db2.gz	OBYDOTPLEOGFPR-TZMCWYRMSA-N	0	3	340.851	3.376	20	30		EGEDHN
C[C@@H](CNCc1ccccc1C#N)CNC(=O)[C@@H](C)c1ccccc1	ZINC001698771761	1406432432	/nfs/dbraw/zinc/43/24/32/1406432432.db2.gz	PXUWYDUCRPOMAJ-IRXDYDNUSA-N	0	3	335.451	3.204	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)NC[C@H]1CCN(c2cc(Cl)ccc2C)C1	ZINC001340847567	1390383479	/nfs/dbraw/zinc/38/34/79/1390383479.db2.gz	ZTVSDLRPUNIBLU-NVXWUHKLSA-N	0	3	349.906	3.275	20	30		EGEDHN
CC[C@@]1(CCc2ccccc2)CCCN1C(=O)[C@H](N)CCCC#N	ZINC001333729613	1390386493	/nfs/dbraw/zinc/38/64/93/1390386493.db2.gz	AUISBBFDRLWTTI-QUCCMNQESA-N	0	3	327.472	3.412	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1cccc2c1CN(c1ccccn1)C2	ZINC001341890294	1390545377	/nfs/dbraw/zinc/54/53/77/1390545377.db2.gz	XQLMQNLSNMSTGV-KRWDZBQOSA-N	0	3	336.439	3.224	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N1CCC[C@H](c2cncn2C(C)(C)C)C1	ZINC001342754948	1390650098	/nfs/dbraw/zinc/65/00/98/1390650098.db2.gz	NFTFLHOATYNHEY-HOTGVXAUSA-N	0	3	332.492	3.028	20	30		EGEDHN
C=C(C)Cn1c([C@H](C)CCC#N)nnc1N1C[C@@H](C)N(CC)C[C@@H]1C	ZINC001342964450	1390678480	/nfs/dbraw/zinc/67/84/80/1390678480.db2.gz	SFFROBXYRVEREV-ZACQAIPSSA-N	0	3	344.507	3.180	20	30		EGEDHN
N#CC(C(=O)CCc1cnn(-c2ccccc2)c1)c1cccc(F)n1	ZINC001343312023	1390706662	/nfs/dbraw/zinc/70/66/62/1390706662.db2.gz	JVZMQUFKQCVJIR-MRXNPFEDSA-N	0	3	334.354	3.215	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)NCc1ccc(Oc2ccccc2)nc1	ZINC001343408675	1390711917	/nfs/dbraw/zinc/71/19/17/1390711917.db2.gz	DHBXEGMVIGZVNP-KRWDZBQOSA-N	0	3	325.412	3.174	20	30		EGEDHN
N#CC(C(=O)CCCc1ccccn1)C(=O)Nc1ccccc1Cl	ZINC001343457106	1390715315	/nfs/dbraw/zinc/71/53/15/1390715315.db2.gz	YHBZIJAHUDNRMP-CQSZACIVSA-N	0	3	341.798	3.405	20	30		EGEDHN
CC[C@H](C)N1CCN(c2nnc([C@H](C)CCC#N)n2CC(C)C)CC1	ZINC001343482419	1390716750	/nfs/dbraw/zinc/71/67/50/1390716750.db2.gz	LUOBRACSMBLJGN-SJORKVTESA-N	0	3	346.523	3.262	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CC(C)(C)CNC(=O)OC(C)(C)C	ZINC001344322467	1390782073	/nfs/dbraw/zinc/78/20/73/1390782073.db2.gz	PHXKTENJWIJTPV-ZDUSSCGKSA-N	0	3	348.447	3.020	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N(C)Cc1ccccc1C	ZINC001351543910	1391650040	/nfs/dbraw/zinc/65/00/40/1391650040.db2.gz	JWXOGPNIZAYSSG-SFHVURJKSA-N	0	3	339.487	3.218	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc(CN(C(C)=O)C(C)C)cc1	ZINC001353361047	1391996339	/nfs/dbraw/zinc/99/63/39/1391996339.db2.gz	VZZIZOQEZBTZMW-SFHVURJKSA-N	0	3	331.460	3.066	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccc(CN(C(C)=O)C(C)C)cc1	ZINC001353361046	1391996530	/nfs/dbraw/zinc/99/65/30/1391996530.db2.gz	VZZIZOQEZBTZMW-GOSISDBHSA-N	0	3	331.460	3.066	20	30		EGEDHN
CCC[C@@H](C(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)C1)C(C)C	ZINC001480117908	1392593013	/nfs/dbraw/zinc/59/30/13/1392593013.db2.gz	LXCUZCIFZNSJMZ-ZWKOTPCHSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C2(CC(C)C)CCC2)C1	ZINC001480148929	1392601786	/nfs/dbraw/zinc/60/17/86/1392601786.db2.gz	KDHLUCYMLDZKIX-HDJSIYSDSA-N	0	3	343.309	3.348	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H](CNC(=O)CC3CCC3)C2)cc1	ZINC001480250215	1392637360	/nfs/dbraw/zinc/63/73/60/1392637360.db2.gz	QCOULPAPTIWIHK-LJQANCHMSA-N	0	3	325.456	3.077	20	30		EGEDHN
C[C@@H](C#N)C(=O)N(C)C1CCN(C/C=C/c2ccc(Cl)cc2)CC1	ZINC001490401486	1394215299	/nfs/dbraw/zinc/21/52/99/1394215299.db2.gz	AQWBTVRSQTYFOI-BWPKMQGJSA-N	0	3	345.874	3.436	20	30		EGEDHN
Cc1cc(C(C)(C)C)cc(C)c1CN1CC(CNC(=O)[C@H](C)C#N)C1	ZINC001481617943	1394422270	/nfs/dbraw/zinc/42/22/70/1394422270.db2.gz	UTKFKSWLVNPJAB-MRXNPFEDSA-N	0	3	341.499	3.309	20	30		EGEDHN
C=C(Br)CN[C@H](CNC(=O)c1ccc(C)s1)C(C)C	ZINC001698957166	1406707980	/nfs/dbraw/zinc/70/79/80/1406707980.db2.gz	NZOAUIPVBRDJOG-GFCCVEGCSA-N	0	3	345.306	3.309	20	30		EGEDHN
C=C(Br)CN[C@H](CNC(=O)C1C(C)(C)C1(C)C)C(C)C	ZINC001698958221	1406709213	/nfs/dbraw/zinc/70/92/13/1406709213.db2.gz	GEJAGNRFBAEDQR-GFCCVEGCSA-N	0	3	345.325	3.308	20	30		EGEDHN
Cc1ccc(CNCc2ccc(CNC(=O)[C@H](C)C#N)cc2)cc1F	ZINC001482029612	1394688889	/nfs/dbraw/zinc/68/88/89/1394688889.db2.gz	HPXOECWLFJJOEY-OAHLLOKOSA-N	0	3	339.414	3.200	20	30		EGEDHN
CCC(CC)C(=O)NC[C@@H](NCc1cc(C#N)ccc1F)C(C)C	ZINC001698964519	1406720667	/nfs/dbraw/zinc/72/06/67/1406720667.db2.gz	XUZKOAOGQYCPLT-GOSISDBHSA-N	0	3	333.451	3.364	20	30		EGEDHN
CC(C)C[C@@H](CNCc1ccc(C#N)s1)NC(=O)[C@H]1CC1(C)C	ZINC001482382688	1394943245	/nfs/dbraw/zinc/94/32/45/1394943245.db2.gz	VAJWKCBYYFLTJW-XJKSGUPXSA-N	0	3	333.501	3.286	20	30		EGEDHN
C=CCCC(=O)N1CCCC[C@@H]1CNCc1cc(C#N)ccc1OC	ZINC001484614111	1395451138	/nfs/dbraw/zinc/45/11/38/1395451138.db2.gz	HAQQEPNLXDUWPM-GOSISDBHSA-N	0	3	341.455	3.004	20	30		EGEDHN
Cc1csc(C(=O)NCC[C@H](C)NCc2ccccc2C#N)c1	ZINC001484991800	1395636564	/nfs/dbraw/zinc/63/65/64/1395636564.db2.gz	UUHFRLCQSNWAMN-AWEZNQCLSA-N	0	3	327.453	3.226	20	30		EGEDHN
CCC1(C(=O)N[C@@H]2CC[C@H](CNCc3ccccc3C#N)C2)CC1	ZINC001486211741	1396183238	/nfs/dbraw/zinc/18/32/38/1396183238.db2.gz	DNGCQVUESOWXOQ-MAUKXSAKSA-N	0	3	325.456	3.123	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2ncccc2F)CCCC[C@H]1C	ZINC001495325061	1396533274	/nfs/dbraw/zinc/53/32/74/1396533274.db2.gz	LDZQONURXLKHOL-SJKOYZFVSA-N	0	3	339.842	3.242	20	30		EGEDHN
CCc1ccc(C(=O)N[C@H](C)CN(C)Cc2ccc(C#N)cc2)cc1	ZINC001498443451	1396996109	/nfs/dbraw/zinc/99/61/09/1396996109.db2.gz	IGEHOLFFRSZPKH-MRXNPFEDSA-N	0	3	335.451	3.371	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)CCc1cccnc1	ZINC001689904828	1404197842	/nfs/dbraw/zinc/19/78/42/1404197842.db2.gz	DCROOWHEMVLGSC-DOTOQJQBSA-N	0	3	335.879	3.126	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N[C@@H]1CCCN(Cc2cc(C)ccc2C)C1	ZINC001690033864	1404271710	/nfs/dbraw/zinc/27/17/10/1404271710.db2.gz	MYYLBNZTKAPNGO-AZUAARDMSA-N	0	3	344.499	3.365	20	30		EGEDHN
CCC1(C(=O)N[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)CCCC1	ZINC001690293698	1404454375	/nfs/dbraw/zinc/45/43/75/1404454375.db2.gz	DNRLOWJFOOIFQA-QAQDUYKDSA-N	0	3	343.446	3.405	20	30		EGEDHN
COc1ccc(CN[C@@H](C)CNC(=O)CCC2CCCC2)cc1C#N	ZINC001690549516	1404629933	/nfs/dbraw/zinc/62/99/33/1404629933.db2.gz	HBBICWNMNMWGRJ-HNNXBMFYSA-N	0	3	343.471	3.132	20	30		EGEDHN
CC(C)C(C)(C)C(=O)NC[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001691444849	1405272592	/nfs/dbraw/zinc/27/25/92/1405272592.db2.gz	YPYZLSBMPYLXRO-WOVMCDHWSA-N	0	3	345.462	3.364	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@H](C)OC2CCCCCC2)C1	ZINC001691520383	1405318321	/nfs/dbraw/zinc/31/83/21/1405318321.db2.gz	IMJHTJDSMXLFSK-JYJNAYRXSA-N	0	3	342.911	3.351	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)CCC(C)C)CC1	ZINC001732304653	1428520866	/nfs/dbraw/zinc/52/08/66/1428520866.db2.gz	JZESEVKXWYLTLY-HDJSIYSDSA-N	0	3	331.298	3.348	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)C1CCC(F)(F)CC1	ZINC001732363777	1428549246	/nfs/dbraw/zinc/54/92/46/1428549246.db2.gz	JHMDJQULMJFSSK-CQSZACIVSA-N	0	3	349.425	3.226	20	30		EGEDHN
C=C(Br)CNC[C@H]1[C@@H](C)CCCN1C(=O)CCCC	ZINC001732535435	1428655923	/nfs/dbraw/zinc/65/59/23/1428655923.db2.gz	XODSIMWMYZMIKS-JSGCOSHPSA-N	0	3	331.298	3.302	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1csc(C(C)(C)C)n1	ZINC001700326805	1413797218	/nfs/dbraw/zinc/79/72/18/1413797218.db2.gz	OWDKQCDLNAVPEZ-NSHDSACASA-N	0	3	329.897	3.291	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1c(F)cc(OC)cc1F)C(C)C	ZINC001732569774	1428764228	/nfs/dbraw/zinc/76/42/28/1428764228.db2.gz	OUKSQAARFJDNGI-CQSZACIVSA-N	0	3	346.805	3.070	20	30		EGEDHN
Cc1cccc(CCC(=O)NC[C@@H](C)N(C)Cc2ccc(C#N)cc2)c1	ZINC001700470561	1414086770	/nfs/dbraw/zinc/08/67/70/1414086770.db2.gz	PKJJLCDFDBRWRI-GOSISDBHSA-N	0	3	349.478	3.436	20	30		EGEDHN
CCC1(C(=O)N(C)[C@@H](CNCc2ccc(C#N)s2)C2CC2)CC1	ZINC001700730128	1414393206	/nfs/dbraw/zinc/39/32/06/1414393206.db2.gz	MQFGGFARZLUSIU-INIZCTEOSA-N	0	3	331.485	3.137	20	30		EGEDHN
Cc1cocc1C(=O)N[C@@H](CNCc1ccc(C#N)s1)C(C)(C)C	ZINC001700992790	1414637701	/nfs/dbraw/zinc/63/77/01/1414637701.db2.gz	APQPWBPKJQQBBT-INIZCTEOSA-N	0	3	345.468	3.456	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)NC(=O)C1CCC(F)(F)CC1	ZINC001732972820	1429098913	/nfs/dbraw/zinc/09/89/13/1429098913.db2.gz	TVUHLPHFOOLQKN-LLVKDONJSA-N	0	3	341.427	3.040	20	30		EGEDHN
CC(C)Cc1c[nH]c(C(=O)N[C@H](C)CNCc2ccc(C#N)s2)c1	ZINC001732978523	1429104725	/nfs/dbraw/zinc/10/47/25/1429104725.db2.gz	UYCMQKLZXDOREV-CYBMUJFWSA-N	0	3	344.484	3.054	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H](CNC(=O)CCC3CC3)C2)cc1	ZINC001713213112	1417785636	/nfs/dbraw/zinc/78/56/36/1417785636.db2.gz	FEZOKUBHIHJYRU-LJQANCHMSA-N	0	3	325.456	3.077	20	30		EGEDHN
CCCCC(=O)NCC[C@@H]1CCN(Cc2ccc(OC)c(C#N)c2)C1	ZINC001713725121	1418503281	/nfs/dbraw/zinc/50/32/81/1418503281.db2.gz	WUWSPCMJMYSHNL-MRXNPFEDSA-N	0	3	343.471	3.085	20	30		EGEDHN
CC1(CC(=O)NCC[C@@H]2CCN(Cc3ccccc3C#N)C2)CC1	ZINC001713732949	1418522655	/nfs/dbraw/zinc/52/26/55/1418522655.db2.gz	RGYWYWIAYRYAIE-MRXNPFEDSA-N	0	3	325.456	3.077	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)NC[C@H](NCc2ccc(C#N)s2)C2CC2)CC1	ZINC001713882247	1418678937	/nfs/dbraw/zinc/67/89/37/1418678937.db2.gz	UXNDBNJHJJITLO-YEWWUXTCSA-N	0	3	345.512	3.430	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@H]1CCN(Cc2ccc(-c3ccccc3)cc2)C1	ZINC001713947148	1418733005	/nfs/dbraw/zinc/73/30/05/1418733005.db2.gz	IFKQBQWVFNFFMQ-UZLBHIALSA-N	0	3	333.435	3.204	20	30		EGEDHN
CC[C@H](CNC(=O)c1cc(C#N)c[nH]1)N[C@H](C)c1ccccc1Cl	ZINC001714065345	1418861749	/nfs/dbraw/zinc/86/17/49/1418861749.db2.gz	MEWIFJJAJXOGID-TZMCWYRMSA-N	0	3	344.846	3.399	20	30		EGEDHN
C[C@H](CCNC(=O)c1cccnc1C1CC1)NCc1ccccc1C#N	ZINC001714476610	1419199989	/nfs/dbraw/zinc/19/99/89/1419199989.db2.gz	NFIGMERQHJYILG-OAHLLOKOSA-N	0	3	348.450	3.129	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cnn3ccc(C)cc23)CCCC1	ZINC001714496472	1419220765	/nfs/dbraw/zinc/22/07/65/1419220765.db2.gz	RDABBTFUOPDQOE-UHFFFAOYSA-N	0	3	346.862	3.027	20	30		EGEDHN
Cc1cscc1C(=O)N(C)[C@H](C)CNCc1ccc(F)c(C#N)c1	ZINC001714573923	1419308542	/nfs/dbraw/zinc/30/85/42/1419308542.db2.gz	AJVHRPKWXXKRCQ-CYBMUJFWSA-N	0	3	345.443	3.318	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](CNC(=O)CCC3CCCC3)C2)cc1	ZINC001714627614	1419398009	/nfs/dbraw/zinc/39/80/09/1419398009.db2.gz	VDPXODFTBBUKDZ-FQEVSTJZSA-N	0	3	339.483	3.467	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)[C@@H]1CCC(C)(C)C1	ZINC001715254398	1419977710	/nfs/dbraw/zinc/97/77/10/1419977710.db2.gz	YOKJOMHDNJORGP-HZPDHXFCSA-N	0	3	327.472	3.226	20	30		EGEDHN
CC(C)C[C@H](CNCc1ccc(F)c(C#N)c1)NC(=O)C1=CCCC1	ZINC001715380351	1420076789	/nfs/dbraw/zinc/07/67/89/1420076789.db2.gz	FHEUFWRSCNVLCS-GOSISDBHSA-N	0	3	343.446	3.428	20	30		EGEDHN
C=C(Br)CN[C@H](CNC(=O)c1cccs1)C(C)C	ZINC001715515648	1420200919	/nfs/dbraw/zinc/20/09/19/1420200919.db2.gz	LMHYGNHJBZZPTE-LLVKDONJSA-N	0	3	331.279	3.001	20	30		EGEDHN
CC(C)SCC(=O)N[C@@H]1CCC[C@@H]1CNCc1ccccc1C#N	ZINC001715546436	1420243404	/nfs/dbraw/zinc/24/34/04/1420243404.db2.gz	IEOZZBPMOOQKPZ-QZTJIDSGSA-N	0	3	345.512	3.074	20	30		EGEDHN
CCC(CC)[C@@H](C)C(=O)NCC1(NCc2cccc(C#N)c2)CC1	ZINC001716686968	1420840026	/nfs/dbraw/zinc/84/00/26/1420840026.db2.gz	MXSAOLTWSJCTPQ-OAHLLOKOSA-N	0	3	327.472	3.369	20	30		EGEDHN
Cc1cccc(CCC(=O)NCC2(NCc3ccc(C#N)cc3)CC2)c1	ZINC001716688451	1420841402	/nfs/dbraw/zinc/84/14/02/1420841402.db2.gz	FAPBFYLRLYNIPF-UHFFFAOYSA-N	0	3	347.462	3.238	20	30		EGEDHN
C=C(Br)CNCC(C)(C)CN(C)C(=O)C1CCCC1	ZINC001717448910	1421378965	/nfs/dbraw/zinc/37/89/65/1421378965.db2.gz	IFXCQRARQJJQDE-UHFFFAOYSA-N	0	3	331.298	3.159	20	30		EGEDHN
CN(CC(C)(C)CNCc1ccccc1C#N)C(=O)C1=CCCC1	ZINC001717452136	1421382050	/nfs/dbraw/zinc/38/20/50/1421382050.db2.gz	RWJBSRROPQNLNG-UHFFFAOYSA-N	0	3	325.456	3.243	20	30		EGEDHN
CN(C(=O)C(C)(C)C1CC1)[C@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001717734782	1421599578	/nfs/dbraw/zinc/59/95/78/1421599578.db2.gz	JUXYOWZUAFLIBT-QGZVFWFLSA-N	0	3	345.512	3.383	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](NC(=O)c2cccs2)C2CC2)c(F)c1	ZINC001723272395	1424326312	/nfs/dbraw/zinc/32/63/12/1424326312.db2.gz	MRBFZFBTRSUEQY-INIZCTEOSA-N	0	3	343.427	3.057	20	30		EGEDHN
CC(C)(F)C(=O)NC[C@@]1(C)CCCN(Cc2ccc(C#N)cc2)C1	ZINC001724312087	1424796100	/nfs/dbraw/zinc/79/61/00/1424796100.db2.gz	RZNPUEHBICMWSM-LJQANCHMSA-N	0	3	331.435	3.025	20	30		EGEDHN
C=C(Br)CN[C@@H](C)CCNC(=O)CCc1ccsc1	ZINC001725004935	1425419270	/nfs/dbraw/zinc/41/92/70/1425419270.db2.gz	GIEBNBXEZZCLDP-LBPRGKRZSA-N	0	3	345.306	3.074	20	30		EGEDHN
C[C@@H](CNC(=O)c1cccc(Cl)c1)N(C)Cc1cccc(C#N)c1	ZINC001725191518	1425737182	/nfs/dbraw/zinc/73/71/82/1425737182.db2.gz	WAFGEARJPLUSFW-AWEZNQCLSA-N	0	3	341.842	3.462	20	30		EGEDHN
CC(C)CC(=O)NC[C@H]1CCCCCN1Cc1cccc(C#N)c1	ZINC001725240243	1425840929	/nfs/dbraw/zinc/84/09/29/1425840929.db2.gz	DQRRYZWEWCUHPG-LJQANCHMSA-N	0	3	327.472	3.465	20	30		EGEDHN
Cc1cc(C(=O)N(C)C[C@@H](C)NCc2ccc(C#N)s2)oc1C	ZINC001725483669	1426159854	/nfs/dbraw/zinc/15/98/54/1426159854.db2.gz	LMSKCKXVQMBLHA-GFCCVEGCSA-N	0	3	331.441	3.080	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1cnc(CC(C)C)s1	ZINC001731741279	1427829463	/nfs/dbraw/zinc/82/94/63/1427829463.db2.gz	OYKXQVWRBDAADE-GFCCVEGCSA-N	0	3	329.897	3.192	20	30		EGEDHN
CC(C)(CC(=O)NC[C@@H]1CCN(Cc2ccc(C#N)cc2)C1)C1CC1	ZINC001731848577	1428075093	/nfs/dbraw/zinc/07/50/93/1428075093.db2.gz	ZWNXAXIOWRYPBF-SFHVURJKSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)CC[C@H]2CCCO2)CC1	ZINC001733918620	1437732228	/nfs/dbraw/zinc/73/22/28/1437732228.db2.gz	LYDFVAYDEFXAIV-QGZVFWFLSA-N	0	3	342.911	3.259	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1ccc2cccnc2n1	ZINC001734018351	1437808196	/nfs/dbraw/zinc/80/81/96/1437808196.db2.gz	OWEYONHLVGYWJS-UHFFFAOYSA-N	0	3	346.862	3.070	20	30		EGEDHN
CC1(C(=O)NC[C@H]2CCCCCN2Cc2ccc(C#N)cc2)CC1	ZINC001734098993	1437883244	/nfs/dbraw/zinc/88/32/44/1437883244.db2.gz	GDMRTBXOROQRHJ-GOSISDBHSA-N	0	3	325.456	3.219	20	30		EGEDHN
CCCC(C)(C)C(=O)NCCCN(C)Cc1ccc(C#N)c(F)c1	ZINC001752054458	1440136008	/nfs/dbraw/zinc/13/60/08/1440136008.db2.gz	PMINPVRCVABBGC-UHFFFAOYSA-N	0	3	333.451	3.462	20	30		EGEDHN
C=C(Br)CN[C@@H](C)[C@H]1CCCCN1C(=O)C=C1CCC1	ZINC001752138724	1440144191	/nfs/dbraw/zinc/14/41/91/1440144191.db2.gz	DZSZJLVCJAQZLC-DZGCQCFKSA-N	0	3	341.293	3.365	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1cc(C(F)F)n[nH]1	ZINC001752156588	1440147375	/nfs/dbraw/zinc/14/73/75/1440147375.db2.gz	HRTQXDIWQBLFRU-GXFFZTMASA-N	0	3	346.809	3.073	20	30		EGEDHN
CC#CCN(CCCNC(=O)[C@H](C)Cc1ccc(C)cc1)C1CC1	ZINC001752290748	1440165843	/nfs/dbraw/zinc/16/58/43/1440165843.db2.gz	UISZIMDYXUBGOJ-GOSISDBHSA-N	0	3	326.484	3.168	20	30		EGEDHN
C=C(C)CCC(=O)N(C)C1CCN(Cc2ccc(OC)cc2)CC1	ZINC001752301307	1440167750	/nfs/dbraw/zinc/16/77/50/1440167750.db2.gz	IFXSGZOKBXQEQR-UHFFFAOYSA-N	0	3	330.472	3.474	20	30		EGEDHN
C=CCC(C)(C)C(=O)N(C)C1CCN(Cc2ccc(CO)cc2)CC1	ZINC001752309089	1440169533	/nfs/dbraw/zinc/16/95/33/1440169533.db2.gz	SMGQTFMGMVWQED-UHFFFAOYSA-N	0	3	344.499	3.204	20	30		EGEDHN
CCCN(C(=O)[C@@H](C)C#N)C1CCN(Cc2ccc(F)cc2C)CC1	ZINC001752431570	1440178389	/nfs/dbraw/zinc/17/83/89/1440178389.db2.gz	KEMQVNMZDKZBLE-INIZCTEOSA-N	0	3	345.462	3.497	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1CC12CCN(Cc1ncccc1C)CC2	ZINC001752436144	1440180350	/nfs/dbraw/zinc/18/03/50/1440180350.db2.gz	VDIZDKUOCPEEPS-SFHVURJKSA-N	0	3	341.499	3.463	20	30		EGEDHN
C=C(C)CN1CCC(N(CCC)C(=O)c2ccnn2CC(C)C)CC1	ZINC001752440339	1440181231	/nfs/dbraw/zinc/18/12/31/1440181231.db2.gz	UEVMYJACBVWODL-UHFFFAOYSA-N	0	3	346.519	3.432	20	30		EGEDHN
C=C/C(C)=C/CC(=O)NC[C@@H](NCc1ccc(C#N)cc1F)C1CC1	ZINC001752478961	1440185200	/nfs/dbraw/zinc/18/52/00/1440185200.db2.gz	CTARTDMCLSYLJR-KNERYOEYSA-N	0	3	341.430	3.204	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC[C@H](CN(C)Cc2ccccn2)C1	ZINC001752515920	1440191176	/nfs/dbraw/zinc/19/11/76/1440191176.db2.gz	CENCCIHNYBBYIS-LJQANCHMSA-N	0	3	341.499	3.336	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@@H](CN(C)Cc2cn(C)nc2C)C1	ZINC001752515658	1440191195	/nfs/dbraw/zinc/19/11/95/1440191195.db2.gz	BQKKSGLGAAHTMZ-KRWDZBQOSA-N	0	3	346.519	3.001	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)c1cccc(COC)c1	ZINC001752539015	1440194455	/nfs/dbraw/zinc/19/44/55/1440194455.db2.gz	WHAFBGYYTNVFHK-FFZOFVMBSA-N	0	3	342.483	3.477	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1C[C@H](NCc2cc(OC)ccc2Cl)C1	ZINC001752626490	1440196922	/nfs/dbraw/zinc/19/69/22/1440196922.db2.gz	RRXAPHGZDFOYTL-WKILWMFISA-N	0	3	348.874	3.279	20	30		EGEDHN
O=C(N[C@H]1C[C@H](NCC#Cc2ccccc2)C1)c1ccc(C(F)F)o1	ZINC001752679707	1440199399	/nfs/dbraw/zinc/19/93/99/1440199399.db2.gz	DTWTYZKGUFNTBH-SHTZXODSSA-N	0	3	344.361	3.119	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H]2CN(Cc3ccsc3)CC[C@H]21	ZINC001752706789	1440202788	/nfs/dbraw/zinc/20/27/88/1440202788.db2.gz	ROPCUGFASPYPLM-QZTJIDSGSA-N	0	3	330.497	3.365	20	30		EGEDHN
Cc1occc1C(=O)N[C@H]1C[C@@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001752712389	1440203477	/nfs/dbraw/zinc/20/34/77/1440203477.db2.gz	HFKHPQAVNKRTMT-CALCHBBNSA-N	0	3	342.826	3.144	20	30		EGEDHN
CC[C@H]1CCC[C@@]1(C)C(=O)N[C@H]1C[C@@H](NCC#Cc2ccccc2)C1	ZINC001752738552	1440204518	/nfs/dbraw/zinc/20/45/18/1440204518.db2.gz	ZEJCRSOFUSZSHI-ITTUMRLJSA-N	0	3	338.495	3.491	20	30		EGEDHN
CC[C@H](C)[C@@H](C)C(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001752771013	1440206037	/nfs/dbraw/zinc/20/60/37/1440206037.db2.gz	BOZOQUAIGIHXRD-UWWPHRKUSA-N	0	3	331.435	3.116	20	30		EGEDHN
CCCCCC(=O)NC[C@H]1CCCN(Cc2ccc(C#N)cc2)C1	ZINC001752776974	1440207243	/nfs/dbraw/zinc/20/72/43/1440207243.db2.gz	HKYOSKKUOUZOBA-LJQANCHMSA-N	0	3	327.472	3.467	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@H]1CCCN(CC[C@@H]2CC2(Cl)Cl)C1	ZINC001752780709	1440208596	/nfs/dbraw/zinc/20/85/96/1440208596.db2.gz	DPWZSIIWAUUWDD-HUUCEWRRSA-N	0	3	345.314	3.058	20	30		EGEDHN
C[C@@H](C(=O)NC[C@@H]1CCCN(Cc2cccc(C#N)c2)C1)C1CCC1	ZINC001752781935	1440209110	/nfs/dbraw/zinc/20/91/10/1440209110.db2.gz	BBHLCLNJNDLSHV-APWZRJJASA-N	0	3	339.483	3.323	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@H]1CCCN(CCOc2cccc(F)c2)C1	ZINC001752785072	1440211012	/nfs/dbraw/zinc/21/10/12/1440211012.db2.gz	OTXMXJLNROCRFR-MRXNPFEDSA-N	0	3	348.462	3.245	20	30		EGEDHN
C#CCN1CCC[C@H](CNC(=O)C(C)(C)c2cccc(Cl)c2)C1	ZINC001752786958	1440211810	/nfs/dbraw/zinc/21/18/10/1440211810.db2.gz	CQBNUOCUJZIVBL-OAHLLOKOSA-N	0	3	332.875	3.079	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@@H](CNCc2ncc(C)s2)C1	ZINC001752798476	1440214649	/nfs/dbraw/zinc/21/46/49/1440214649.db2.gz	AQYOYINCUFGKOC-HNNXBMFYSA-N	0	3	335.517	3.382	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)CCc2ccc(C)cc2C)C1	ZINC001752842557	1440231480	/nfs/dbraw/zinc/23/14/80/1440231480.db2.gz	XZOJBBSKYTZCCW-PZJWPPBQSA-N	0	3	340.511	3.476	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CCC(NCc2oc(CC)nc2C)CC1	ZINC001752852459	1440233825	/nfs/dbraw/zinc/23/38/25/1440233825.db2.gz	TXIBSWGCFYUGBI-UHFFFAOYSA-N	0	3	333.476	3.275	20	30		EGEDHN
C[C@@H](CNC(=O)C1(C)C(C)(C)C1(C)C)NCc1ccc(C#N)c(F)c1	ZINC001752923340	1440249445	/nfs/dbraw/zinc/24/94/45/1440249445.db2.gz	CWZRIYHWNASKBN-ZDUSSCGKSA-N	0	3	345.462	3.364	20	30		EGEDHN
CCC[C@H](C)C(=O)N1CC[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001752937034	1440250421	/nfs/dbraw/zinc/25/04/21/1440250421.db2.gz	YBVILWKXGTYOQJ-LSDHHAIUSA-N	0	3	331.435	3.072	20	30		EGEDHN
Cc1nc(C(C)C)oc1CN[C@H]1CCC[C@H](NC(=O)C#CC(C)C)C1	ZINC001752967589	1440254318	/nfs/dbraw/zinc/25/43/18/1440254318.db2.gz	GPGCAFBVGQMEQX-IRXDYDNUSA-N	0	3	345.487	3.283	20	30		EGEDHN
Cc1nc(C(C)C)oc1CN[C@@H]1CCC[C@@H](NC(=O)C#CC(C)C)C1	ZINC001752967588	1440254355	/nfs/dbraw/zinc/25/43/55/1440254355.db2.gz	GPGCAFBVGQMEQX-IAGOWNOFSA-N	0	3	345.487	3.283	20	30		EGEDHN
CC#CCN(C)[C@@H]1CCCN(C(=O)[C@H](CC)c2ccc(OC)cc2)C1	ZINC001752999619	1440264035	/nfs/dbraw/zinc/26/40/35/1440264035.db2.gz	DSGXNCKMXUWCFS-UYAOXDASSA-N	0	3	342.483	3.135	20	30		EGEDHN
C=CC1(CC(=O)NCC[C@@H](C)NCc2cnc(C)cn2)CCCCC1	ZINC001753015573	1440268277	/nfs/dbraw/zinc/26/82/77/1440268277.db2.gz	ORUBVSNOVJDLCY-MRXNPFEDSA-N	0	3	344.503	3.296	20	30		EGEDHN
C=CCC1(C(=O)NCC[C@H](C)NCc2ocnc2C)CCCCC1	ZINC001753020431	1440269706	/nfs/dbraw/zinc/26/97/06/1440269706.db2.gz	NTFXBDQDWPXPHT-HNNXBMFYSA-N	0	3	333.476	3.494	20	30		EGEDHN
C=CCC1(C(=O)NCC[C@@H](C)NCc2ocnc2C)CCCCC1	ZINC001753020432	1440269746	/nfs/dbraw/zinc/26/97/46/1440269746.db2.gz	NTFXBDQDWPXPHT-OAHLLOKOSA-N	0	3	333.476	3.494	20	30		EGEDHN
CC(C)C(=O)NCCC[C@@H]1CCCN1CC#Cc1ccc(F)cc1	ZINC001753024288	1440270901	/nfs/dbraw/zinc/27/09/01/1440270901.db2.gz	ZDSAVFHMUMYWCI-LJQANCHMSA-N	0	3	330.447	3.194	20	30		EGEDHN
N#Cc1ccccc1CN1CCC[C@H]1CCCNC(=O)CCC(F)F	ZINC001753030606	1440272658	/nfs/dbraw/zinc/27/26/58/1440272658.db2.gz	AINVCHOTBKAXJO-QGZVFWFLSA-N	0	3	349.425	3.464	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)NCCC[C@H]1CCCN1Cc1ccc(C#N)cc1F	ZINC001753032003	1440273086	/nfs/dbraw/zinc/27/30/86/1440273086.db2.gz	HLQLVGDAVBKRKF-FHLIZLRMSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C1CCC(C(=O)NCCN(CC)C[C@H](O)c2ccc(F)cc2)CC1	ZINC001753087142	1440296964	/nfs/dbraw/zinc/29/69/64/1440296964.db2.gz	UTIHDDUZWMQPTR-IBGZPJMESA-N	0	3	348.462	3.044	20	30		EGEDHN
C=C1CCC(C(=O)NCCN(CC)C[C@@H](O)c2ccc(F)cc2)CC1	ZINC001753087143	1440297077	/nfs/dbraw/zinc/29/70/77/1440297077.db2.gz	UTIHDDUZWMQPTR-LJQANCHMSA-N	0	3	348.462	3.044	20	30		EGEDHN
CCN(CCNC(=O)CCc1ccccc1C)Cc1ccc(C#N)cc1	ZINC001753089925	1440298242	/nfs/dbraw/zinc/29/82/42/1440298242.db2.gz	BWPLDILGUJOEGU-UHFFFAOYSA-N	0	3	349.478	3.438	20	30		EGEDHN
CCC[C@@H](C)CC(=O)NC[C@H]1CCN(Cc2ccc(C#N)cc2)C1	ZINC001753122781	1440314131	/nfs/dbraw/zinc/31/41/31/1440314131.db2.gz	MTGPYHGIEZVKMY-VQIMIIECSA-N	0	3	327.472	3.323	20	30		EGEDHN
CC[C@H](CC1CCCCC1)C(=O)NC[C@@H]1CCN(CC#CCOC)C1	ZINC001753135254	1440318381	/nfs/dbraw/zinc/31/83/81/1440318381.db2.gz	JEDAZXKMXGSVAZ-VQTJNVASSA-N	0	3	348.531	3.071	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCN(CCOc2cccc(F)c2)C2CC2)C1	ZINC001753158844	1440332457	/nfs/dbraw/zinc/33/24/57/1440332457.db2.gz	IGILUAWTILVOMR-UHFFFAOYSA-N	0	3	346.446	3.141	20	30		EGEDHN
C[C@H]1CCCC[C@@H]1C(=O)N(C)CCNCc1ccc(C#N)c(F)c1	ZINC001753223993	1440340359	/nfs/dbraw/zinc/34/03/59/1440340359.db2.gz	TYSJEURPOAPLOC-YOEHRIQHSA-N	0	3	331.435	3.072	20	30		EGEDHN
CC1=CC[C@@](C)(C(=O)N(C)CCNCc2ccc(C#N)cc2)CC1	ZINC001753272043	1440345619	/nfs/dbraw/zinc/34/56/19/1440345619.db2.gz	ISOICPVKJGBCOU-HXUWFJFHSA-N	0	3	325.456	3.243	20	30		EGEDHN
C=C(C)CN[C@@H](CNC(=O)c1cn[nH]c1)c1ccc(C(C)C)cc1	ZINC001753294397	1440351654	/nfs/dbraw/zinc/35/16/54/1440351654.db2.gz	MDWBQONNBAMWHB-SFHVURJKSA-N	0	3	326.444	3.170	20	30		EGEDHN
C=C(C)CN[C@H](CNC(=O)[C@@H]1Cc2ccccc2O1)c1ccccc1	ZINC001753300407	1440353796	/nfs/dbraw/zinc/35/37/96/1440353796.db2.gz	RXKXZNHUXFDKNB-QUCCMNQESA-N	0	3	336.435	3.013	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CCC)C(=O)[C@H]2CCc3ccccc3O2)C1	ZINC001753319885	1440362650	/nfs/dbraw/zinc/36/26/50/1440362650.db2.gz	OQESQSYTPPIAIO-UYAOXDASSA-N	0	3	342.483	3.269	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CCC)C(=O)[C@H](OC)C2CCCCC2)C1	ZINC001753324229	1440365636	/nfs/dbraw/zinc/36/56/36/1440365636.db2.gz	ZWSFAJWLGLEUHY-RTBURBONSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](CN(C)Cc2c(C)onc2CC)C1	ZINC001753355324	1440379671	/nfs/dbraw/zinc/37/96/71/1440379671.db2.gz	PPWFUGUIZLFCGL-INIZCTEOSA-N	0	3	333.476	3.182	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@@H]2C[C@H]1CN2CCCCC1CCOCC1	ZINC001753420266	1440394961	/nfs/dbraw/zinc/39/49/61/1440394961.db2.gz	QSROPMGWYHZNHY-PMACEKPBSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N1C[C@@H]2C[C@H]1CN2CCCC1CCCC1	ZINC001753422948	1440395902	/nfs/dbraw/zinc/39/59/02/1440395902.db2.gz	QMVOCELXDUKGPG-IRFCIJBXSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=CCOCCN1CC[C@H](N(C)C(=O)c2cc(C)n(C(C)C)c2C)C1	ZINC001753448909	1440405240	/nfs/dbraw/zinc/40/52/40/1440405240.db2.gz	DGJBOYJAFWQIFH-SFHVURJKSA-N	0	3	347.503	3.035	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)[C@H](CC)OC2CCCCC2)C1	ZINC001753455373	1440407934	/nfs/dbraw/zinc/40/79/34/1440407934.db2.gz	JHDSNQPFOVHNAA-HKUYNNGSSA-N	0	3	334.504	3.060	20	30		EGEDHN
CC[C@@H](CNC(=O)c1ccc(C)o1)NCC#Cc1cccc(Cl)c1	ZINC001753464971	1440412470	/nfs/dbraw/zinc/41/24/70/1440412470.db2.gz	VLLVYTVLCLIZMD-KRWDZBQOSA-N	0	3	344.842	3.391	20	30		EGEDHN
CC[C@@H](CNC(=O)[C@H]1CC=CCC1)NCc1ccc(C#N)c(F)c1	ZINC001753466428	1440412858	/nfs/dbraw/zinc/41/28/58/1440412858.db2.gz	KQBIGHIVCFDWAR-RDJZCZTQSA-N	0	3	329.419	3.038	20	30		EGEDHN
CC[C@@H](CNC(=O)c1cc(C)oc1C)NCC#Cc1ccc(F)cc1	ZINC001753467201	1440413046	/nfs/dbraw/zinc/41/30/46/1440413046.db2.gz	UDKJFUZXPAEIQN-SFHVURJKSA-N	0	3	342.414	3.185	20	30		EGEDHN
CCCC1(C(=O)NC[C@@H](CC)NCC#Cc2ccc(F)cc2)CC1	ZINC001753488262	1440418515	/nfs/dbraw/zinc/41/85/15/1440418515.db2.gz	CTECXIMDFGAMOM-GOSISDBHSA-N	0	3	330.447	3.242	20	30		EGEDHN
C=C[C@@H](C(=O)NC[C@H](CC)NCc1cncc(F)c1)c1ccccc1	ZINC001753496444	1440421699	/nfs/dbraw/zinc/42/16/99/1440421699.db2.gz	DPBNCLFXESPUPZ-RBUKOAKNSA-N	0	3	341.430	3.175	20	30		EGEDHN
C[C@H](NCC1(NC(=O)CSCC#N)CCCC1)c1ccccc1F	ZINC001753499650	1440423003	/nfs/dbraw/zinc/42/30/03/1440423003.db2.gz	DPIMEHQBJIYKQK-AWEZNQCLSA-N	0	3	349.475	3.162	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@](C)(CN[C@H](C)c1cnc(C)cn1)C1CC1	ZINC001753518804	1440427999	/nfs/dbraw/zinc/42/79/99/1440427999.db2.gz	QEEZDWDOYJDXSV-BEFAXECRSA-N	0	3	330.476	3.077	20	30		EGEDHN
C=CCCC(=O)N[C@@]1(CNCc2cccc(OC)n2)CCCC[C@@H]1C	ZINC001753531427	1440431134	/nfs/dbraw/zinc/43/11/34/1440431134.db2.gz	HWIPJNFATSXDOQ-OXJNMPFZSA-N	0	3	345.487	3.211	20	30		EGEDHN
C=CCCC(=O)N[C@]1(CNCc2oc(C)nc2C)CCCC[C@@H]1C	ZINC001753532085	1440431256	/nfs/dbraw/zinc/43/12/56/1440431256.db2.gz	QSBNFMWAQLVFJI-LIRRHRJNSA-N	0	3	333.476	3.412	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC[C@@H](CCNCc2oc(C)nc2C)C1	ZINC001753547458	1440434453	/nfs/dbraw/zinc/43/44/53/1440434453.db2.gz	DPJYBUKRZOIOLS-KRWDZBQOSA-N	0	3	333.476	3.366	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)[C@@H](C)CCC)CC1	ZINC001753579933	1440439955	/nfs/dbraw/zinc/43/99/55/1440439955.db2.gz	XJILGOZFWTVSGX-UBHSHLNASA-N	0	3	331.298	3.348	20	30		EGEDHN
CC#CCCCC(=O)N1CCC2(CCN(Cc3cncs3)C2)CC1	ZINC001753603408	1440447303	/nfs/dbraw/zinc/44/73/03/1440447303.db2.gz	YGUQSDWEAJWCLD-UHFFFAOYSA-N	0	3	345.512	3.151	20	30		EGEDHN
C[C@@H](CNCc1ccccc1C#N)CNC(=O)c1ccsc1Cl	ZINC001753632449	1440452478	/nfs/dbraw/zinc/45/24/78/1440452478.db2.gz	OITDOJDCZQIQSY-LBPRGKRZSA-N	0	3	347.871	3.429	20	30		EGEDHN
C=CCOCC(=O)NCC1(NCc2sccc2Cl)CCCC1	ZINC001753661406	1440458767	/nfs/dbraw/zinc/45/87/67/1440458767.db2.gz	JINFOKWPYKRMNY-UHFFFAOYSA-N	0	3	342.892	3.123	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC2(CN(CCOCC3CCC3)C2)CC1	ZINC001753675242	1440463224	/nfs/dbraw/zinc/46/32/24/1440463224.db2.gz	XBVFXYXJDYMWOC-UHFFFAOYSA-N	0	3	348.531	3.330	20	30		EGEDHN
C=CCCOCC(=O)N1CCC2(CN(Cc3cccc(C)c3)C2)CC1	ZINC001753676207	1440463287	/nfs/dbraw/zinc/46/32/87/1440463287.db2.gz	VWDRODTYOUCUSS-UHFFFAOYSA-N	0	3	342.483	3.012	20	30		EGEDHN
C=CCOCCN1CC2(C1)CCN(C(=O)c1cccc(C)c1C)CC2	ZINC001753676637	1440463469	/nfs/dbraw/zinc/46/34/69/1440463469.db2.gz	AQALSWQMWRIMOQ-UHFFFAOYSA-N	0	3	342.483	3.044	20	30		EGEDHN
CCCC(C)(C)C(=O)N(C)[C@@H](C)CNCC#Cc1ccc(F)cc1	ZINC001753711151	1440470575	/nfs/dbraw/zinc/47/05/75/1440470575.db2.gz	VVHZDJBSXNHKLN-INIZCTEOSA-N	0	3	332.463	3.440	20	30		EGEDHN
N#Cc1ccccc1CNCC[C@@H]1CCCCN1C(=O)c1ccco1	ZINC001753765411	1440484637	/nfs/dbraw/zinc/48/46/37/1440484637.db2.gz	GZDGWSDQCWRCKX-SFHVURJKSA-N	0	3	337.423	3.326	20	30		EGEDHN
CC[C@@H](C)C(=O)NC[C@@H](NCC#Cc1cccc(Cl)c1)C(C)C	ZINC001753825289	1440498041	/nfs/dbraw/zinc/49/80/41/1440498041.db2.gz	VCDZEBVKMLTFJF-CRAIPNDOSA-N	0	3	334.891	3.468	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1ccc(-c2cnco2)cc1)C(C)C	ZINC001753831777	1440499898	/nfs/dbraw/zinc/49/98/98/1440499898.db2.gz	AIKIXJXYTBHHTA-MRXNPFEDSA-N	0	3	347.846	3.438	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)[C@@H]1CCOc2ccccc21)C(C)C	ZINC001753839873	1440502227	/nfs/dbraw/zinc/50/22/27/1440502227.db2.gz	RHLWFBOHQRDYOM-CVEARBPZSA-N	0	3	336.863	3.036	20	30		EGEDHN
CCN(CCNCc1cccc(C#N)c1)C(=O)[C@]1(C)CCC[C@H]1C	ZINC001754066100	1440537497	/nfs/dbraw/zinc/53/74/97/1440537497.db2.gz	YBMMRZOEZOINEX-OXQOHEQNSA-N	0	3	327.472	3.323	20	30		EGEDHN
C[C@@H]1CC[C@@H](CC(=O)NC/C=C\CNCc2cccc(C#N)c2)C1	ZINC001754159031	1440545810	/nfs/dbraw/zinc/54/58/10/1440545810.db2.gz	LEQFUTADLUMENZ-KWWITBOBSA-N	0	3	325.456	3.147	20	30		EGEDHN
C/C(=C/C(=O)N[C@H](C)CNCC#Cc1cccc(Cl)c1)C1CC1	ZINC001754219958	1440552579	/nfs/dbraw/zinc/55/25/79/1440552579.db2.gz	GZIFTBGAJNEILB-QKXCFHHRSA-N	0	3	330.859	3.142	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H](C)CN(C)C/C=C\c2ccccc2)cc1	ZINC001754320454	1440577628	/nfs/dbraw/zinc/57/76/28/1440577628.db2.gz	WXAKBMBUOYJSHN-IBWPDUFMSA-N	0	3	332.447	3.431	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)C(C)(C)c1ccccc1	ZINC001754333748	1440585662	/nfs/dbraw/zinc/58/56/62/1440585662.db2.gz	QUJLTLPPJRTRTJ-QGZVFWFLSA-N	0	3	349.478	3.473	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CCCC[C@@H]1CNCc1ncc(C)s1	ZINC001754339470	1440587932	/nfs/dbraw/zinc/58/79/32/1440587932.db2.gz	FIDNIWYNAFACDB-IAGOWNOFSA-N	0	3	347.528	3.410	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CCCC[C@@H]1CNCc1ocnc1C	ZINC001754344481	1440589417	/nfs/dbraw/zinc/58/94/17/1440589417.db2.gz	DRSQNEYJUNDAFN-HZPDHXFCSA-N	0	3	333.476	3.350	20	30		EGEDHN
CC(C)(C)/C=C/C(=O)N[C@@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001754434347	1440597715	/nfs/dbraw/zinc/59/77/15/1440597715.db2.gz	ACBTWUQOOXSNPI-BLGFXRMMSA-N	0	3	343.446	3.284	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](NCc3cnns3)[C@H](CC)C2)CCC1	ZINC001754471479	1440605573	/nfs/dbraw/zinc/60/55/73/1440605573.db2.gz	ZDFXJNLMLSBTNQ-GDBMZVCRSA-N	0	3	348.516	3.001	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)CCc1ccc2[nH]ccc2c1	ZINC001754489301	1440609819	/nfs/dbraw/zinc/60/98/19/1440609819.db2.gz	UVZIGUNOTYEMIT-GOSISDBHSA-N	0	3	325.456	3.257	20	30		EGEDHN
C=CCC[C@H](C)N1CC[C@H]1CNC(=O)c1occc1Br	ZINC001754498195	1440613091	/nfs/dbraw/zinc/61/30/91/1440613091.db2.gz	UVYBJSHECMCYJS-RYUDHWBXSA-N	0	3	341.249	3.201	20	30		EGEDHN
C=CCC[C@@H](C)N1CC[C@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1	ZINC001754504200	1440615737	/nfs/dbraw/zinc/61/57/37/1440615737.db2.gz	GSSYUDLIZFXXLW-CJNGLKHVSA-N	0	3	343.431	3.008	20	30		EGEDHN
CC(C)[C@@]1(C)C[C@@H]1C(=O)NCC1(NCc2ccc(F)c(C#N)c2)CC1	ZINC001754530570	1440622380	/nfs/dbraw/zinc/62/23/80/1440622380.db2.gz	WNDDRIFMXXVHNB-VQIMIIECSA-N	0	3	343.446	3.118	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)CC2(C(F)(F)F)CC2)C1	ZINC001754537755	1440625253	/nfs/dbraw/zinc/62/52/53/1440625253.db2.gz	CYPWJKBORVGGEO-GJZGRUSLSA-N	0	3	342.405	3.055	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](NCc2ccncc2Cl)C[C@@H]1C	ZINC001754592583	1440641057	/nfs/dbraw/zinc/64/10/57/1440641057.db2.gz	DKFVLCIOVDMVIS-HOCLYGCPSA-N	0	3	333.863	3.008	20	30		EGEDHN
CC/C(C)=C/C(=O)N1CC[C@H](NCc2ccccc2C#N)C[C@H]1C	ZINC001754593839	1440641112	/nfs/dbraw/zinc/64/11/12/1440641112.db2.gz	UJCMUJFBFYGONK-RZQYTQJMSA-N	0	3	325.456	3.384	20	30		EGEDHN
CC#CCNC[C@H](NC(=O)[C@H]1CC12CC2)c1ccc2ccccc2c1	ZINC001754643964	1440649554	/nfs/dbraw/zinc/64/95/54/1440649554.db2.gz	LGFXHKBGGRHXFD-UXHICEINSA-N	0	3	332.447	3.410	20	30		EGEDHN
CC#CCNC[C@@H](NC(=O)[C@@H]1CC12CC2)c1ccc2ccccc2c1	ZINC001754643965	1440649607	/nfs/dbraw/zinc/64/96/07/1440649607.db2.gz	LGFXHKBGGRHXFD-VQTJNVASSA-N	0	3	332.447	3.410	20	30		EGEDHN
C#CCN1CCC(C)(CNC(=O)c2cc3ccccc3s2)CC1	ZINC001754719347	1440672573	/nfs/dbraw/zinc/67/25/73/1440672573.db2.gz	JBADYQLTSUHEKA-UHFFFAOYSA-N	0	3	326.465	3.366	20	30		EGEDHN
CC#CCN1CCC[C@](C)(CNC(=O)c2cccc3cccnc32)C1	ZINC001754736833	1440682528	/nfs/dbraw/zinc/68/25/28/1440682528.db2.gz	UEQRREBHTRGEGN-OAQYLSRUSA-N	0	3	335.451	3.090	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@H](CNC(=O)C2(CC)CCCCC2)C1	ZINC001754744938	1440684486	/nfs/dbraw/zinc/68/44/86/1440684486.db2.gz	QHYLALIUJFVWRF-MRXNPFEDSA-N	0	3	340.458	3.444	20	30		EGEDHN
C#CCC[NH2+][C@H](CNC(=O)c1ccccc1[O-])c1ccccc1CC	ZINC001754786343	1440687972	/nfs/dbraw/zinc/68/79/72/1440687972.db2.gz	XNLBMYXVAIHJQE-LJQANCHMSA-N	0	3	336.435	3.039	20	30		EGEDHN
CC/C(C)=C/C(=O)N1CC[C@H]([C@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001754793588	1440688913	/nfs/dbraw/zinc/68/89/13/1440688913.db2.gz	YOWGKAXMKGQDRY-XHWWCQAGSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H](C)[C@H](CNC/C(Cl)=C/Cl)C2)C1	ZINC001754822663	1440693105	/nfs/dbraw/zinc/69/31/05/1440693105.db2.gz	NRQOWVWWZWBALU-IUBKPTGXSA-N	0	3	331.287	3.346	20	30		EGEDHN
C=C1CCC(C(=O)N[C@]2(CO)CCCN(CC/C=C/CCC)C2)CC1	ZINC001754857725	1440700393	/nfs/dbraw/zinc/70/03/93/1440700393.db2.gz	NCBDQARIVFOTLQ-YAQIIAKESA-N	0	3	348.531	3.422	20	30		EGEDHN
C/C(=C\C(=O)N[C@H]1CCCN(Cc2cccc(C#N)c2)CC1)C1CC1	ZINC001755022080	1440727278	/nfs/dbraw/zinc/72/72/78/1440727278.db2.gz	YNZOVSRGEMXNON-GRFAERAESA-N	0	3	337.467	3.385	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1CCCN(Cc2ncccc2C)CC1	ZINC001755025130	1440728545	/nfs/dbraw/zinc/72/85/45/1440728545.db2.gz	OYVZNGAUALDHBT-KRWDZBQOSA-N	0	3	329.488	3.463	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1CCCN(Cc2c(C)onc2CC)CC1	ZINC001755027564	1440729578	/nfs/dbraw/zinc/72/95/78/1440729578.db2.gz	BYYKDKIAHFFCQW-INIZCTEOSA-N	0	3	333.476	3.372	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)CCC(F)(F)F)C1	ZINC001755047829	1440742297	/nfs/dbraw/zinc/74/22/97/1440742297.db2.gz	RBVQGOSSBCKOGC-HUUCEWRRSA-N	0	3	330.394	3.055	20	30		EGEDHN
C#CCCCC(=O)N1CCC(CC)(NCc2nc(C)sc2C)CC1	ZINC001755068587	1440745757	/nfs/dbraw/zinc/74/57/57/1440745757.db2.gz	KUFOAWMLYVKPPT-UHFFFAOYSA-N	0	3	347.528	3.424	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CC=CC2)C[C@@H]1NCC#Cc1ccccc1Cl	ZINC001755107060	1440753797	/nfs/dbraw/zinc/75/37/97/1440753797.db2.gz	HLZAMTAKZZHYQI-BEFAXECRSA-N	0	3	342.870	3.094	20	30		EGEDHN
Cc1csc(C(=O)N2C[C@H](C)[C@H](NCC#Cc3ccccc3)C2)c1	ZINC001755108389	1440753941	/nfs/dbraw/zinc/75/39/41/1440753941.db2.gz	DYDDPOWLGKVESS-FUHWJXTLSA-N	0	3	338.476	3.158	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)[C@H](CC)Oc2ccccc2F)C(C)(C)C1	ZINC001755143944	1440762276	/nfs/dbraw/zinc/76/22/76/1440762276.db2.gz	SKEGAGTWDBMGCR-WMZOPIPTSA-N	0	3	348.462	3.386	20	30		EGEDHN
C=CCCCN1CC(N2CCN(C(=O)CCC3CCCCC3)CC2)C1	ZINC001755146432	1440762715	/nfs/dbraw/zinc/76/27/15/1440762715.db2.gz	QGLPEZWYHZNOQU-UHFFFAOYSA-N	0	3	347.547	3.142	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1CCN(Cc2cccc(F)c2)[C@@H](C)C1	ZINC001755168743	1440767939	/nfs/dbraw/zinc/76/79/39/1440767939.db2.gz	GOEPTFCUWBEHAL-LPHOPBHVSA-N	0	3	330.447	3.488	20	30		EGEDHN
CC(C)CN1CCc2ccccc2[C@@H]1CNC(=O)C#CC(C)(C)C	ZINC001755172798	1440769895	/nfs/dbraw/zinc/76/98/95/1440769895.db2.gz	YAKGRMQVZMKGHX-IBGZPJMESA-N	0	3	326.484	3.408	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)C#CC(C)(C)C	ZINC001755192525	1440775270	/nfs/dbraw/zinc/77/52/70/1440775270.db2.gz	HEBCJWDELDURSU-LJQANCHMSA-N	0	3	337.467	3.031	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H]([C@@H]2CCN(Cc3conc3C)C2)C1	ZINC001755203344	1440781256	/nfs/dbraw/zinc/78/12/56/1440781256.db2.gz	VALVTHXADZPZSS-IAGOWNOFSA-N	0	3	331.460	3.010	20	30		EGEDHN
C[C@@H](NCC#Cc1ccc(Cl)cc1)[C@@H](C)NC(=O)c1ccco1	ZINC001755223281	1440785069	/nfs/dbraw/zinc/78/50/69/1440785069.db2.gz	KVJFCZYZEXAZMX-ZIAGYGMSSA-N	0	3	330.815	3.081	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)c(F)c1)[C@H](C)NC(=O)c1ccoc1Cl	ZINC001755235138	1440788052	/nfs/dbraw/zinc/78/80/52/1440788052.db2.gz	YTWMHMHSLJYGDK-QWRGUYRKSA-N	0	3	349.793	3.240	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H](C)[C@@H](C)NCc2ccc(C#N)s2)cc1F	ZINC001755242584	1440789880	/nfs/dbraw/zinc/78/98/80/1440789880.db2.gz	CTZWSDKEMNFNRT-CHWSQXEVSA-N	0	3	345.443	3.364	20	30		EGEDHN
CCCc1[nH]ccc1C(=O)N[C@H](C)[C@@H](C)NCC#Cc1ccccc1	ZINC001755251121	1440792008	/nfs/dbraw/zinc/79/20/08/1440792008.db2.gz	WFTKJYIITVMTSM-IAGOWNOFSA-N	0	3	337.467	3.115	20	30		EGEDHN
Cc1cc(C)c(C(=O)NC[C@H](C)N(C)Cc2cccc(C#N)c2)o1	ZINC001755298458	1440807366	/nfs/dbraw/zinc/80/73/66/1440807366.db2.gz	RPTOFQPRGBLFNA-AWEZNQCLSA-N	0	3	325.412	3.018	20	30		EGEDHN
Cc1ccc(C)c(CC(=O)NC[C@H](C)N(C)Cc2ccc(C#N)cc2)c1	ZINC001755313958	1440814763	/nfs/dbraw/zinc/81/47/63/1440814763.db2.gz	QNQSPRVELBVQTO-SFHVURJKSA-N	0	3	349.478	3.354	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@H](C)N(C)Cc1cccc2nsnc21	ZINC001755313900	1440814869	/nfs/dbraw/zinc/81/48/69/1440814869.db2.gz	AOABABLKTYXPQY-UGSOOPFHSA-N	0	3	346.500	3.230	20	30		EGEDHN
C[C@@H](CNC(=O)[C@@H]1CCC(C)(C)C1)N(C)Cc1ccc(C#N)cc1	ZINC001755314304	1440814900	/nfs/dbraw/zinc/81/49/00/1440814900.db2.gz	FFVUGFOKNRTIRP-MAUKXSAKSA-N	0	3	327.472	3.321	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H](C)N(C)CCOc2cccc(F)c2)CC1	ZINC001755314906	1440815304	/nfs/dbraw/zinc/81/53/04/1440815304.db2.gz	IXRIULAXQUAREF-MRXNPFEDSA-N	0	3	348.462	3.387	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@H](C)N(C)Cc2ccc3cc[nH]c3c2)C1	ZINC001755315236	1440815418	/nfs/dbraw/zinc/81/54/18/1440815418.db2.gz	MDLKUJVWQZUHIO-OAHLLOKOSA-N	0	3	325.456	3.461	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@@H](C)N(C)Cc2ccccc2C2CC2)c1	ZINC001755315564	1440815519	/nfs/dbraw/zinc/81/55/19/1440815519.db2.gz	SCGFUVPDRJEXAE-MRXNPFEDSA-N	0	3	347.462	3.191	20	30		EGEDHN
CCCC[C@H](CNCC#Cc1ccc(Cl)cc1)NC(=O)C1CC1	ZINC001755356761	1440829790	/nfs/dbraw/zinc/82/97/90/1440829790.db2.gz	WLQISVFJHVCGSV-GOSISDBHSA-N	0	3	332.875	3.366	20	30		EGEDHN
CCCC[C@@H](CNCC#Cc1ccccc1)NC(=O)[C@@H]1CCC1(F)F	ZINC001755357362	1440830160	/nfs/dbraw/zinc/83/01/60/1440830160.db2.gz	DUWMEWBJAXYNAI-ROUUACIJSA-N	0	3	348.437	3.348	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@]2(CCN(C(=O)c3cc(C)c(C)o3)C2)C1	ZINC001755400124	1440842703	/nfs/dbraw/zinc/84/27/03/1440842703.db2.gz	CGQJFYLQXJPZHD-OXJNMPFZSA-N	0	3	346.471	3.168	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCc2ncc(C(C)(C)C)o2)C(C)(C)C1	ZINC001755412663	1440846941	/nfs/dbraw/zinc/84/69/41/1440846941.db2.gz	PMOSFZWNULVDHS-OAHLLOKOSA-N	0	3	347.503	3.307	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CC[C@@H](NC(=O)C(C)(C)C(F)F)C[C@@H]2C1	ZINC001755454213	1440854901	/nfs/dbraw/zinc/85/49/01/1440854901.db2.gz	YJTFWRGLGFGLIM-YNEHKIRRSA-N	0	3	334.838	3.247	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H]1C[C@H](CNCc2nc(C(C)(C)C)cs2)C1	ZINC001755471061	1440858783	/nfs/dbraw/zinc/85/87/83/1440858783.db2.gz	NGMMHSJEYGYJHE-SHTZXODSSA-N	0	3	347.528	3.084	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H](C)CCCNCc2ccncc2Cl)C1	ZINC001755514235	1440864003	/nfs/dbraw/zinc/86/40/03/1440864003.db2.gz	DWINUEWTKCPNQW-AWEZNQCLSA-N	0	3	335.879	3.466	20	30		EGEDHN
C/C=C(\C)C(=O)N(C)[C@H](CNCC#Cc1ccc(Cl)cc1)C1CC1	ZINC001755559032	1440874080	/nfs/dbraw/zinc/87/40/80/1440874080.db2.gz	UJQWVQCJWBPWLN-YZGOOUTISA-N	0	3	344.886	3.484	20	30		EGEDHN
C=CC(C)(C)C(=O)N(C)[C@@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001755563626	1440875227	/nfs/dbraw/zinc/87/52/27/1440875227.db2.gz	CEWXRXIQWWLUKL-INIZCTEOSA-N	0	3	331.485	3.159	20	30		EGEDHN
COc1ccc(CN[C@@H](C)CN(C)C(=O)/C=C\C(C)(C)C)cc1C#N	ZINC001755581458	1440879506	/nfs/dbraw/zinc/87/95/06/1440879506.db2.gz	HNVNRVHNDQZRNW-KVPUOBJLSA-N	0	3	343.471	3.106	20	30		EGEDHN
CCCC[C@H](C)C(=O)N(C)C[C@@H](C)NCc1ccc(F)c(C#N)c1	ZINC001755585768	1440880464	/nfs/dbraw/zinc/88/04/64/1440880464.db2.gz	USNJBYDMFWFIIK-LSDHHAIUSA-N	0	3	333.451	3.460	20	30		EGEDHN
Cc1cc(C)c(C(=O)N(C)C[C@@H](C)NCC#Cc2ccccc2)s1	ZINC001755588582	1440880875	/nfs/dbraw/zinc/88/08/75/1440880875.db2.gz	BQPKLWXPUMIPFC-MRXNPFEDSA-N	0	3	340.492	3.467	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N(C)C[C@@H](C)NCc1ccc(OC)c(C#N)c1	ZINC001755602068	1440884324	/nfs/dbraw/zinc/88/43/24/1440884324.db2.gz	PRIRTLNHNBKSQN-NXADEVLQSA-N	0	3	341.455	3.026	20	30		EGEDHN
C[C@@H](CN(C)C(=O)C1CCC=CCC1)NCC#Cc1ccc(F)cc1	ZINC001755618851	1440889807	/nfs/dbraw/zinc/88/98/07/1440889807.db2.gz	ZVLFUYSEVZXSQG-KRWDZBQOSA-N	0	3	342.458	3.360	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)[C@@H]1C	ZINC001755655377	1440891898	/nfs/dbraw/zinc/89/18/98/1440891898.db2.gz	VWCNCVKJYKMEQY-KBXCAEBGSA-N	0	3	329.419	3.133	20	30		EGEDHN
C[C@H]1[C@H](NCC#Cc2ccccc2)CCN1C(=O)CC1CC(F)(F)C1	ZINC001755655909	1440891941	/nfs/dbraw/zinc/89/19/41/1440891941.db2.gz	DSNFQYQJJZBQGW-MAUKXSAKSA-N	0	3	346.421	3.053	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@H](NCc2ccc(C)nc2C)C[C@H]1C	ZINC001755674815	1440894436	/nfs/dbraw/zinc/89/44/36/1440894436.db2.gz	HNBGAMDSVGIIEP-CRAIPNDOSA-N	0	3	329.488	3.380	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2cc(F)cc(F)c2)CN1C(=O)C#CC(C)(C)C	ZINC001755677988	1440894847	/nfs/dbraw/zinc/89/48/47/1440894847.db2.gz	FBQQERNUZWKYRA-DYVFJYSZSA-N	0	3	334.410	3.093	20	30		EGEDHN
CC#CCN[C@@H]1C[C@H](C)N(C(=O)c2cc3c(s2)CCCCC3)C1	ZINC001755688392	1440896366	/nfs/dbraw/zinc/89/63/66/1440896366.db2.gz	IIQALJGKGDMCLS-GOEBONIOSA-N	0	3	330.497	3.233	20	30		EGEDHN
C#CCN1CC[C@@]2(NC(=O)CCc3ccc(Cl)cc3)CCC[C@H]12	ZINC001755703295	1440901122	/nfs/dbraw/zinc/90/11/22/1440901122.db2.gz	WSLYTKZJXYFIFW-HKUYNNGSSA-N	0	3	330.859	3.019	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@@H](NCc2ccnc(Cl)c2)C(C)(C)C1	ZINC001755756008	1440913862	/nfs/dbraw/zinc/91/38/62/1440913862.db2.gz	YWNGAYRPDWNIGS-MRXNPFEDSA-N	0	3	347.890	3.255	20	30		EGEDHN
CC1(C)CN(C(=O)CC#Cc2ccccc2)C[C@H]1NC/C=C/Cl	ZINC001755767607	1440916556	/nfs/dbraw/zinc/91/65/56/1440916556.db2.gz	ZRAPDXWYLVZJPX-SNQZOLJRSA-N	0	3	330.859	3.007	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@H](NCc2cncc(C)c2)C(C)(C)C1	ZINC001755772580	1440917006	/nfs/dbraw/zinc/91/70/06/1440917006.db2.gz	DOTYCNYXVTVURO-WMZOPIPTSA-N	0	3	329.488	3.319	20	30		EGEDHN
C#Cc1ccc(C(=O)N(CCN(C)Cc2ccc(C)cc2)C(C)C)nc1	ZINC001755817527	1440924369	/nfs/dbraw/zinc/92/43/69/1440924369.db2.gz	PCPLGFHAWHTOEI-UHFFFAOYSA-N	0	3	349.478	3.354	20	30		EGEDHN
C#CCCN(C)CCN(C(=O)c1ccsc1C(F)F)C(C)C	ZINC001755817800	1440924590	/nfs/dbraw/zinc/92/45/90/1440924590.db2.gz	ZPEHFMNZJWPATG-UHFFFAOYSA-N	0	3	328.428	3.491	20	30		EGEDHN
C=C(Br)CNC[C@H](NC(=O)[C@@]1(C)C=CCC1)C(C)(C)C	ZINC001755829519	1440928241	/nfs/dbraw/zinc/92/82/41/1440928241.db2.gz	DIKQCALQONULOR-BBRMVZONSA-N	0	3	343.309	3.372	20	30		EGEDHN
C=C(C)CN(CCNC(=O)c1ccc(Cl)c(Cl)c1)CCOC	ZINC001755841786	1440931993	/nfs/dbraw/zinc/93/19/93/1440931993.db2.gz	YNCHGEHYHKYCNP-UHFFFAOYSA-N	0	3	345.270	3.248	20	30		EGEDHN
CC#CCN1CCC([C@@H](C)NC(=O)C(C)(C)CC(F)(F)F)CC1	ZINC001755845961	1440933346	/nfs/dbraw/zinc/93/33/46/1440933346.db2.gz	GOAGQNVRHVCBBT-CYBMUJFWSA-N	0	3	332.410	3.205	20	30		EGEDHN
C=CCCC(=O)N[C@@H](C)C1CCN(C[C@H](O)c2ccccc2F)CC1	ZINC001755847346	1440933717	/nfs/dbraw/zinc/93/37/17/1440933717.db2.gz	HWLGPGAMDDTKQW-KXBFYZLASA-N	0	3	348.462	3.042	20	30		EGEDHN
C/C=C(/C)C(=O)N(C)C1CC(NCC#Cc2cccc(Cl)c2)C1	ZINC001755855565	1440935731	/nfs/dbraw/zinc/93/57/31/1440935731.db2.gz	UPUQSOZSHIIGGT-CPSFFCFKSA-N	0	3	330.859	3.237	20	30		EGEDHN
C[C@@H](CC(=O)N(C)C1CC(NCc2cc(C#N)ccc2F)C1)C1CC1	ZINC001755865491	1440937685	/nfs/dbraw/zinc/93/76/85/1440937685.db2.gz	GGLACKJBVWKIDK-TZYSRNFLSA-N	0	3	343.446	3.213	20	30		EGEDHN
C=CCC[C@H]1CCC[N@H+]1Cc1ccc(-c2nnn[n-]2)cc1OC(F)F	ZINC001573333694	947439866	/nfs/dbraw/zinc/43/98/66/947439866.db2.gz	CUIZOERKRHFMAJ-AWEZNQCLSA-N	0	3	349.385	3.399	20	30		EGEDHN
C=CCC[C@H]1CCC[N@@H+]1Cc1ccc(-c2nnn[n-]2)cc1OC(F)F	ZINC001573333694	947439872	/nfs/dbraw/zinc/43/98/72/947439872.db2.gz	CUIZOERKRHFMAJ-AWEZNQCLSA-N	0	3	349.385	3.399	20	30		EGEDHN
C=CCC[C@H]1CCC[N@H+]1Cc1ccc(-c2nn[n-]n2)cc1OC(F)F	ZINC001573333694	947439879	/nfs/dbraw/zinc/43/98/79/947439879.db2.gz	CUIZOERKRHFMAJ-AWEZNQCLSA-N	0	3	349.385	3.399	20	30		EGEDHN
C=CCC[C@H]1CCC[N@@H+]1Cc1ccc(-c2nn[n-]n2)cc1OC(F)F	ZINC001573333694	947439887	/nfs/dbraw/zinc/43/98/87/947439887.db2.gz	CUIZOERKRHFMAJ-AWEZNQCLSA-N	0	3	349.385	3.399	20	30		EGEDHN
N#Cc1ccc(N2CCC(NCc3ccccc3Cl)CC2)nc1	ZINC000067011060	215104104	/nfs/dbraw/zinc/10/41/04/215104104.db2.gz	YOQUCJIFCAIAPR-UHFFFAOYSA-N	0	3	326.831	3.365	20	30		EGEDHN
C=CCN(C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C)C1CC1	ZINC000297475295	202113968	/nfs/dbraw/zinc/11/39/68/202113968.db2.gz	LXIGJIPBCIKWGK-KRWDZBQOSA-N	0	3	333.501	3.371	20	30		EGEDHN
CN(CCC(=O)Nc1sc2c(c1C#N)CCC2)CCC(F)(F)F	ZINC000063562315	201049260	/nfs/dbraw/zinc/04/92/60/201049260.db2.gz	KMTZZIBUTYWRSU-UHFFFAOYSA-N	0	3	345.390	3.321	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2nc3ccc(OC)cc3s2)CC1	ZINC000264342280	201210303	/nfs/dbraw/zinc/21/03/03/201210303.db2.gz	ITTZCZDECHFEDW-UHFFFAOYSA-N	0	3	346.456	3.077	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2oc3ccccc3c2COC)CC1	ZINC000264346382	201210485	/nfs/dbraw/zinc/21/04/85/201210485.db2.gz	AOUMKPXJXLAZQI-UHFFFAOYSA-N	0	3	342.439	3.350	20	30		EGEDHN
C=CCSCCN[C@@H](C)c1ccc(S(=O)(=O)C(F)F)cc1	ZINC000271499397	201242827	/nfs/dbraw/zinc/24/28/27/201242827.db2.gz	QJYKFCCGNLIIKA-NSHDSACASA-N	0	3	335.441	3.253	20	30		EGEDHN
C#CC[C@H](N[C@@H](C)c1ccc(S(=O)(=O)NC)cc1)c1ccccc1	ZINC000271593416	201244196	/nfs/dbraw/zinc/24/41/96/201244196.db2.gz	YOUWSBRXSWERJY-KXBFYZLASA-N	0	3	342.464	3.010	20	30		EGEDHN
C=CCOc1cccc(CN[C@H]2CCO[C@@H]2c2c(C)nn(C)c2C)c1	ZINC000275278750	201279769	/nfs/dbraw/zinc/27/97/69/201279769.db2.gz	KFKZQOMJZPNTHX-ICSRJNTNSA-N	0	3	341.455	3.222	20	30		EGEDHN
C=CC[C@H](C(=O)NCCCCN1C[C@@H](C)O[C@H](C)C1)c1ccccc1	ZINC000275099897	201275734	/nfs/dbraw/zinc/27/57/34/201275734.db2.gz	CTPUPESAEPFOOW-GGPKGHCWSA-N	0	3	344.499	3.352	20	30		EGEDHN
C=CC[C@H]1N(Cc2nn3c(nc(C)cc3=O)s2)CCCC1(C)C	ZINC000277655470	201303907	/nfs/dbraw/zinc/30/39/07/201303907.db2.gz	DFXDOOLHTXFLSH-CYBMUJFWSA-N	0	3	332.473	3.026	20	30		EGEDHN
C=CCc1cc(CNC[C@H](O)c2ccc(F)cc2)cc(OC)c1O	ZINC000277775549	201304074	/nfs/dbraw/zinc/30/40/74/201304074.db2.gz	UMCFXJQDWMLSKZ-KRWDZBQOSA-N	0	3	331.387	3.092	20	30		EGEDHN
Cc1ccc([C@H](CNCc2cccc(C#N)c2)N2CCOCC2)s1	ZINC000075603931	203319102	/nfs/dbraw/zinc/31/91/02/203319102.db2.gz	VTPXRPRTMJIYQN-SFHVURJKSA-N	0	3	341.480	3.091	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H](CC)CSc2ccccc2)CC1	ZINC000156362520	205076034	/nfs/dbraw/zinc/07/60/34/205076034.db2.gz	WTQVBPXRRDGXTK-KRWDZBQOSA-N	0	3	330.497	3.019	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)o1)Oc1ccc(Br)cc1	ZINC000266141069	248125672	/nfs/dbraw/zinc/12/56/72/248125672.db2.gz	HFEJMNDLRCKMLF-NSHDSACASA-N	0	3	335.201	3.471	20	30		EGEDHN
Cc1ccc([C@H](O)CN2CCC(Oc3cccc(C#N)c3)CC2)cc1	ZINC000266533002	248349202	/nfs/dbraw/zinc/34/92/02/248349202.db2.gz	MUGRSFDHXCXFQS-OAQYLSRUSA-N	0	3	336.435	3.444	20	30		EGEDHN
C[C@@H](c1ccccn1)N1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000267384735	251006496	/nfs/dbraw/zinc/00/64/96/251006496.db2.gz	NKLZVXZBCGWJHR-HNNXBMFYSA-N	0	3	334.423	3.365	20	30		EGEDHN
CN1CCC(N(Cc2ccccc2)C(=O)Cc2ccc(C#N)cc2)CC1	ZINC000175703227	207151608	/nfs/dbraw/zinc/15/16/08/207151608.db2.gz	HJKMGNMGICOUBU-UHFFFAOYSA-N	0	3	347.462	3.224	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN2CCC(OC3CCCCC3)CC2)cc1	ZINC000268702360	252153168	/nfs/dbraw/zinc/15/31/68/252153168.db2.gz	RONHDGIUMYCGHF-HXUWFJFHSA-N	0	3	328.456	3.405	20	30		EGEDHN
C[C@@H](NCC(=O)Nc1cccc(C#N)c1)c1cccc(N2CCCC2)c1	ZINC000181856519	533350168	/nfs/dbraw/zinc/35/01/68/533350168.db2.gz	OODFRQDGUUCYCH-MRXNPFEDSA-N	0	3	348.450	3.448	20	30		EGEDHN
Cn1nnc2cc(CN3CC=C(c4ccc(C#N)cc4)CC3)ccc21	ZINC000347974574	141226628	/nfs/dbraw/zinc/22/66/28/141226628.db2.gz	QLGHSBIALVJGTK-UHFFFAOYSA-N	0	3	329.407	3.129	20	30		EGEDHN
C[C@@H]1CCC[C@@H](C(=O)N(CCN(C)C)Cc2cccc(C#N)c2)C1	ZINC000172849761	144030223	/nfs/dbraw/zinc/03/02/23/144030223.db2.gz	FAWGGKNPNOBCCT-VQIMIIECSA-N	0	3	327.472	3.275	20	30		EGEDHN
CCN(C(=O)c1ccc(C#N)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000186295627	153005052	/nfs/dbraw/zinc/00/50/52/153005052.db2.gz	VYLSCGWBNAFWKO-FQEVSTJZSA-N	0	3	333.435	3.295	20	30		EGEDHN
CCCCNC(=O)[C@@H]1CC[C@H](C)N(Cc2ccc(C#N)c(F)c2)C1	ZINC000191964362	153235891	/nfs/dbraw/zinc/23/58/91/153235891.db2.gz	UGXXDWGTUONKLS-WMLDXEAASA-N	0	3	331.435	3.214	20	30		EGEDHN
C[C@@H](NC[C@H]1CC[C@@H](c2nc(C3CC3)no2)O1)c1cccc(C#N)c1	ZINC000372621312	157368627	/nfs/dbraw/zinc/36/86/27/157368627.db2.gz	RRHAKQFHISFKAV-JLZZUVOBSA-N	0	3	338.411	3.390	20	30		EGEDHN
C[C@@H]1C[C@H]1c1ccc(CNC2CCN(c3ccc(C#N)cn3)CC2)o1	ZINC000067011022	161588004	/nfs/dbraw/zinc/58/80/04/161588004.db2.gz	CWOMLGRSMVEOKJ-RDTXWAMCSA-N	0	3	336.439	3.428	20	30		EGEDHN
N#Cc1ccccc1COc1cccc(CNCCn2cccn2)c1	ZINC000109015422	162090997	/nfs/dbraw/zinc/09/09/97/162090997.db2.gz	PBFZDPSCMOJFBV-UHFFFAOYSA-N	0	3	332.407	3.124	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1cccc(C#N)c1	ZINC000248399916	163000132	/nfs/dbraw/zinc/00/01/32/163000132.db2.gz	WPFCHBIHIBLVQI-DNVCBOLYSA-N	0	3	334.423	3.200	20	30		EGEDHN
CN(C)C[C@@H](NC(=O)c1cccc(C#N)c1)c1ccc(Cl)cc1	ZINC000338754855	163338798	/nfs/dbraw/zinc/33/87/98/163338798.db2.gz	OXNQUCCAWMZUOV-QGZVFWFLSA-N	0	3	327.815	3.244	20	30		EGEDHN
CC[C@@H](C)N[C@H](CNC(=O)NCc1cccc(C#N)c1)c1ccco1	ZINC000350394918	165040357	/nfs/dbraw/zinc/04/03/57/165040357.db2.gz	BNUZMPYTROUAMM-RHSMWYFYSA-N	0	3	340.427	3.080	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)NC[C@H](C)N1CCC[C@@H](C)C1	ZINC000352394922	165380461	/nfs/dbraw/zinc/38/04/61/165380461.db2.gz	WTVNQYCLGCVNNS-CABCVRRESA-N	0	3	344.459	3.199	20	30		EGEDHN
CCN(CCN[C@@H]1CCc2ccc(C#N)cc21)CCC(F)(F)F	ZINC000353598364	165823879	/nfs/dbraw/zinc/82/38/79/165823879.db2.gz	SZSXEDGCSDKWHE-MRXNPFEDSA-N	0	3	325.378	3.409	20	30		EGEDHN
C[C@H]1COc2ccccc2CN1CCC(=O)Nc1ccc(C#N)cc1	ZINC000359891423	167259130	/nfs/dbraw/zinc/25/91/30/167259130.db2.gz	BNZKCGOHUGFKLE-HNNXBMFYSA-N	0	3	335.407	3.170	20	30		EGEDHN
COC[C@@H](NC1CCN(c2ccc(C#N)cc2)CC1)c1ccco1	ZINC000367638823	168253678	/nfs/dbraw/zinc/25/36/78/168253678.db2.gz	QWXXTAJQTFJADS-GOSISDBHSA-N	0	3	325.412	3.097	20	30		EGEDHN
CCc1cc(N(C)CCCc2[nH]nc(N)c2C#N)c2ccccc2n1	ZINC000123140233	222222718	/nfs/dbraw/zinc/22/27/18/222222718.db2.gz	KVDVWLAIHGTHCH-UHFFFAOYSA-N	0	3	334.427	3.043	20	30		EGEDHN
N#Cc1cc(Br)cnc1N1CCC[C@H]1CN1CCCCC1	ZINC000294931316	269950535	/nfs/dbraw/zinc/95/05/35/269950535.db2.gz	JBNPBUHNJBQLGR-HNNXBMFYSA-N	0	3	349.276	3.170	20	30		EGEDHN
Cc1cccc(OCCN(C)C(=O)C(C#N)Cc2ccc(C#N)cc2)c1	ZINC000279750470	270039595	/nfs/dbraw/zinc/03/95/95/270039595.db2.gz	QGNALXPBJUKXKG-IBGZPJMESA-N	0	3	347.418	3.086	20	30		EGEDHN
CSCCCCCCNC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000280003795	270039708	/nfs/dbraw/zinc/03/97/08/270039708.db2.gz	LJQVSNJFPFBTKY-QGZVFWFLSA-N	0	3	329.469	3.280	20	30		EGEDHN
N#Cc1ccc(Oc2ccc(NC(=O)N3CCCNCC3)cc2)cc1	ZINC000415040940	270047769	/nfs/dbraw/zinc/04/77/69/270047769.db2.gz	OTYFLOBYZYIFEF-UHFFFAOYSA-N	0	3	336.395	3.178	20	30		EGEDHN
CC(C)n1cncc1CN[C@H]1CCCN(c2ccc(C#N)cc2F)C1	ZINC000424146689	270049426	/nfs/dbraw/zinc/04/94/26/270049426.db2.gz	QAENCDJYYHHOKW-INIZCTEOSA-N	0	3	341.434	3.233	20	30		EGEDHN
Cc1ccc(-c2ccc([C@@H](C)N3CCN(CCO)CC3)cc2)c(C#N)c1	ZINC000527588169	270059657	/nfs/dbraw/zinc/05/96/57/270059657.db2.gz	OPTIQRPOYUVRCU-GOSISDBHSA-N	0	3	349.478	3.205	20	30		EGEDHN
Cc1ccc2c(c1)[C@@H](NC[C@H](O)COc1ccccc1C#N)CCC2	ZINC000530235064	270060360	/nfs/dbraw/zinc/06/03/60/270060360.db2.gz	UOZVOOHVCSYDHS-ICSRJNTNSA-N	0	3	336.435	3.274	20	30		EGEDHN
CC(=O)c1ccc(C#N)c(NCC2CCN(c3ccncc3)CC2)c1	ZINC000302119229	265668011	/nfs/dbraw/zinc/66/80/11/265668011.db2.gz	FHYDLPBOFUDOLC-UHFFFAOYSA-N	0	3	334.423	3.484	20	30		EGEDHN
CCN(CC(=O)Nc1cc(Cl)ccc1C#N)[C@@H]1CCOC(C)(C)C1	ZINC000289647763	266105277	/nfs/dbraw/zinc/10/52/77/266105277.db2.gz	DNKKYSPBQBTRDC-OAHLLOKOSA-N	0	3	349.862	3.430	20	30		EGEDHN
CCOC(=O)N1CCC([C@@H](C)NCc2ccc(F)cc2C#N)CC1	ZINC000186435172	266258685	/nfs/dbraw/zinc/25/86/85/266258685.db2.gz	ONPXTCONBPZGDT-CYBMUJFWSA-N	0	3	333.407	3.044	20	30		EGEDHN
CCS[C@H]1CCCCN(C(=O)C(C#N)Cc2ccc(C#N)cc2)C1	ZINC000280498090	266347802	/nfs/dbraw/zinc/34/78/02/266347802.db2.gz	QQEYRSTWISZVJR-MSOLQXFVSA-N	0	3	341.480	3.375	20	30		EGEDHN
CC(C)[C@@H]1CN(c2c(C#N)cnc3c(F)cc(F)cc32)CCN1C	ZINC000487105393	266945144	/nfs/dbraw/zinc/94/51/44/266945144.db2.gz	UTJJMWBGMKEZCG-INIZCTEOSA-N	0	3	330.382	3.161	20	30		EGEDHN
C[C@@H]1CCC[C@@H]1CC(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000185908187	267015517	/nfs/dbraw/zinc/01/55/17/267015517.db2.gz	ITKGGIBGHPMLQY-VQIMIIECSA-N	0	3	327.472	3.275	20	30		EGEDHN
CCC[C@]1(COC)CCCN1Cc1nnc(-c2cccc(C#N)c2)o1	ZINC000447398941	267040782	/nfs/dbraw/zinc/04/07/82/267040782.db2.gz	UCIDFBXLPVMBGE-LJQANCHMSA-N	0	3	340.427	3.389	20	30		EGEDHN
C[C@@H]1C[C@@H](Nc2nc3ccccn3c2C#N)CN1Cc1ccccc1	ZINC000302147720	267081293	/nfs/dbraw/zinc/08/12/93/267081293.db2.gz	GXKZOYVCEXYOFV-NVXWUHKLSA-N	0	3	331.423	3.281	20	30		EGEDHN
C[C@H](C1CCN(C)CC1)N(C)C(=O)Nc1ccc(C#N)cc1Cl	ZINC000273449297	267144165	/nfs/dbraw/zinc/14/41/65/267144165.db2.gz	OHTINMOJPJISQQ-GFCCVEGCSA-N	0	3	334.851	3.406	20	30		EGEDHN
CCO[C@@H]1C[C@@H](NCc2ccc(C#N)c(F)c2)[C@@H]1Oc1ccccc1	ZINC000453367869	267150592	/nfs/dbraw/zinc/15/05/92/267150592.db2.gz	DTSUHVZIBLUSBR-AQNXPRMDSA-N	0	3	340.398	3.412	20	30		EGEDHN
CCS[C@@H]1CCCC[C@H]1NCc1cccc(C(=O)OC)c1C#N	ZINC000527298737	267180397	/nfs/dbraw/zinc/18/03/97/267180397.db2.gz	ZTAJIPDPTBFNCC-IAGOWNOFSA-N	0	3	332.469	3.499	20	30		EGEDHN
C[C@H](NCCOc1cccc(C#N)c1)c1ccc([S@@](C)=O)cc1	ZINC000271764899	267183733	/nfs/dbraw/zinc/18/37/33/267183733.db2.gz	CZRBVOJWINPGQU-LFVRLGFBSA-N	0	3	328.437	3.025	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC000274210983	267199358	/nfs/dbraw/zinc/19/93/58/267199358.db2.gz	WMTLUWXGUYZBFY-HXUWFJFHSA-N	0	3	341.455	3.391	20	30		EGEDHN
C[C@H](c1ccc(C#N)c(F)c1)N1CCC[C@H](CC(C)(C)C(N)=O)C1	ZINC000296259387	267207183	/nfs/dbraw/zinc/20/71/83/267207183.db2.gz	DEEKLWAGTJTKNX-ZIAGYGMSSA-N	0	3	331.435	3.372	20	30		EGEDHN
CCc1cc(OC)ccc1CN1CC[C@H](Oc2ccc(C#N)cn2)C1	ZINC000430176277	267245929	/nfs/dbraw/zinc/24/59/29/267245929.db2.gz	HNNCFUBTMQNZNP-IBGZPJMESA-N	0	3	337.423	3.178	20	30		EGEDHN
CN(CC(=O)NCc1ccc(C#N)cc1)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000459667449	267297025	/nfs/dbraw/zinc/29/70/25/267297025.db2.gz	ARJMGSLJTRIIJS-LEWJYISDSA-N	0	3	347.462	3.443	20	30		EGEDHN
CN(Cc1ccccc1C#N)C1CCN(CCC(F)(F)F)CC1	ZINC000449786653	267320604	/nfs/dbraw/zinc/32/06/04/267320604.db2.gz	PETDJUDCNHZHCW-UHFFFAOYSA-N	0	3	325.378	3.407	20	30		EGEDHN
Cc1cc([C@@H](C)NC[C@H](O)COc2ccc(C#N)cc2)ccc1F	ZINC000271825024	267360707	/nfs/dbraw/zinc/36/07/07/267360707.db2.gz	VJYNUYQMITXOBV-PBHICJAKSA-N	0	3	328.387	3.096	20	30		EGEDHN
COC(=O)N1CCC([C@@H](C)N[C@H](C)c2ccc(C#N)cc2F)CC1	ZINC000492554203	267376395	/nfs/dbraw/zinc/37/63/95/267376395.db2.gz	YWJGHPNQLDTDQD-CHWSQXEVSA-N	0	3	333.407	3.215	20	30		EGEDHN
Cc1ccc(C2(CN[C@@H](C(N)=O)c3ccc(C#N)cc3)CCC2)cc1C	ZINC000432499053	268033832	/nfs/dbraw/zinc/03/38/32/268033832.db2.gz	DMQQLKYTSTZHSY-HXUWFJFHSA-N	0	3	347.462	3.413	20	30		EGEDHN
Cc1ccc(NC(=O)C2CCN(Cc3ccc(C#N)c(C)c3)CC2)nc1	ZINC000488234027	268038527	/nfs/dbraw/zinc/03/85/27/268038527.db2.gz	QYWIXJNYIWBCFI-UHFFFAOYSA-N	0	3	348.450	3.421	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@@H]2CCCc3ccccc32)cc1	ZINC000279468776	268086631	/nfs/dbraw/zinc/08/66/31/268086631.db2.gz	MRUXSJYGZRMNTB-AZUAARDMSA-N	0	3	329.403	3.434	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@H]2CCOc3c(F)cccc32)cc1	ZINC000280075878	268087046	/nfs/dbraw/zinc/08/70/46/268087046.db2.gz	QSWLUQKFMXYNTJ-YJBOKZPZSA-N	0	3	349.365	3.020	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@H](N3CCCC3)C2)c(Br)c1	ZINC000301991518	268113715	/nfs/dbraw/zinc/11/37/15/268113715.db2.gz	PTZLGYAOHPUTQS-AWEZNQCLSA-N	0	3	334.261	3.385	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN2CCC(N3CCc4ccccc43)CC2)cc1	ZINC000282040624	268212763	/nfs/dbraw/zinc/21/27/63/268212763.db2.gz	LLWQTIJULJOBPZ-QFIPXVFZSA-N	0	3	347.462	3.119	20	30		EGEDHN
N#Cc1cccc(NC(=O)C2CCN(Cc3cccc(O)c3)CC2)c1	ZINC000271161757	268265084	/nfs/dbraw/zinc/26/50/84/268265084.db2.gz	JABMIFHSGYNWFO-UHFFFAOYSA-N	0	3	335.407	3.115	20	30		EGEDHN
N#Cc1ccccc1Oc1ccccc1C(=O)NCCN1CCCC1	ZINC000181179024	268284582	/nfs/dbraw/zinc/28/45/82/268284582.db2.gz	QIGZGAAIIAVKIJ-UHFFFAOYSA-N	0	3	335.407	3.176	20	30		EGEDHN
N#Cc1cccc([N+](=O)[O-])c1NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000425252187	268293251	/nfs/dbraw/zinc/29/32/51/268293251.db2.gz	AGGLVYBTJFAIKN-INIZCTEOSA-N	0	3	336.395	3.400	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CN[C@@H]1C[C@H]1c1ccc(Cl)cc1	ZINC000530235473	268298477	/nfs/dbraw/zinc/29/84/77/268298477.db2.gz	YOCOWSTXMDBAPK-OKZBNKHCSA-N	0	3	342.826	3.097	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CN1CCC[C@@H](c2ccccc2)C1	ZINC000528513464	268300416	/nfs/dbraw/zinc/30/04/16/268300416.db2.gz	UCLRACDKOGSRIA-WOJBJXKFSA-N	0	3	336.435	3.178	20	30		EGEDHN
CCO[C@H]1C[C@H](NCC(=O)Nc2ccc(C#N)cc2)C1(CC)CC	ZINC000429338319	269671961	/nfs/dbraw/zinc/67/19/61/269671961.db2.gz	MGENFQKHEKDLDF-IRXDYDNUSA-N	0	3	329.444	3.070	20	30		EGEDHN
Cn1cc(CN[C@@H]2CCc3c2cccc3Br)cc1C#N	ZINC000190966776	274892383	/nfs/dbraw/zinc/89/23/83/274892383.db2.gz	INMHCRLPJVMHQW-MRXNPFEDSA-N	0	3	330.229	3.436	20	30		EGEDHN
CCN(CCn1cnc2ccccc2c1=O)[C@@H](C)c1ccc(C#N)cc1	ZINC000172244550	276350592	/nfs/dbraw/zinc/35/05/92/276350592.db2.gz	NTYUALPZBUFRHH-INIZCTEOSA-N	0	3	346.434	3.351	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NC[C@@H](c1cccs1)N1CCCC1	ZINC000275749766	277918139	/nfs/dbraw/zinc/91/81/39/277918139.db2.gz	SDGYLYVUXRWKLK-MAUKXSAKSA-N	0	3	336.501	3.230	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)N1CC[C@]2(CCN(C)C2)C1	ZINC000346314472	280261258	/nfs/dbraw/zinc/26/12/58/280261258.db2.gz	HNDULCGUXOLEGW-IBGZPJMESA-N	0	3	339.464	3.249	20	30		EGEDHN
CC[C@H](C)C[C@H](C)NC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000074788178	307395902	/nfs/dbraw/zinc/39/59/02/307395902.db2.gz	ATPNZMFISQZPRS-IRXDYDNUSA-N	0	3	344.503	3.456	20	30		EGEDHN
COCc1ccc(CN[C@H]2CCCN(c3ccc(C#N)cc3F)C2)o1	ZINC000127614664	307587426	/nfs/dbraw/zinc/58/74/26/307587426.db2.gz	OSBBVUDVBSWAGY-HNNXBMFYSA-N	0	3	343.402	3.195	20	30		EGEDHN
CN1CC[C@H](NC(=O)C2(c3cccc(C#N)c3)CC2)[C@@H]1c1ccccc1	ZINC000536262644	314103761	/nfs/dbraw/zinc/10/37/61/314103761.db2.gz	IRCMXQICQDRXLK-PMACEKPBSA-N	0	3	345.446	3.151	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@H](N3CCc4ccccc4CC3)C2=O)cc1	ZINC000537604643	314194935	/nfs/dbraw/zinc/19/49/35/314194935.db2.gz	ABTNXWXCRPGYLF-NRFANRHFSA-N	0	3	345.446	3.154	20	30		EGEDHN
CC[C@@H](CN1CCN(c2nccnc2C#N)C[C@@H]1C)c1ccccc1	ZINC000537704752	314204417	/nfs/dbraw/zinc/20/44/17/314204417.db2.gz	CDYAGAUDIXTRFK-IRXDYDNUSA-N	0	3	335.455	3.053	20	30		EGEDHN
CCc1ccc(C(C)(C)NC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000538260247	314235540	/nfs/dbraw/zinc/23/55/40/314235540.db2.gz	YTFNFMUMXAKLKF-LJQANCHMSA-N	0	3	338.451	3.385	20	30		EGEDHN
C[C@@H](N[C@@H](C)c1ccc(C#N)cc1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000538396245	314244686	/nfs/dbraw/zinc/24/46/86/314244686.db2.gz	XLMVQZHIBNPHSB-SVMVAKDDSA-N	0	3	349.478	3.498	20	30		EGEDHN
Cc1cc(NCC2(N3CCSCC3)CCCCC2)cc(C#N)n1	ZINC000553377326	315260746	/nfs/dbraw/zinc/26/07/46/315260746.db2.gz	CAFYILDNFMCSPW-UHFFFAOYSA-N	0	3	330.501	3.425	20	30		EGEDHN
N#Cc1cnn2c1NC[C@@H](CN[C@@H](CC(F)(F)F)c1ccccc1)C2	ZINC000561220744	315749581	/nfs/dbraw/zinc/74/95/81/315749581.db2.gz	BKYVIUIEKMAQBD-DOMZBBRYSA-N	0	3	349.360	3.080	20	30		EGEDHN
CN(C)C[C@H](CNC(=O)c1ccc(C#N)s1)c1ccc(Cl)cc1	ZINC000565088388	316262680	/nfs/dbraw/zinc/26/26/80/316262680.db2.gz	CNCUCGKPNNDCAK-ZDUSSCGKSA-N	0	3	347.871	3.348	20	30		EGEDHN
C[C@H](N[C@@H](C)c1ccc(C(F)(F)F)cc1)C(=O)N(C)CCC#N	ZINC000112523193	454889299	/nfs/dbraw/zinc/88/92/99/454889299.db2.gz	JBAVKFMAXCHWJX-RYUDHWBXSA-N	0	3	327.350	3.117	20	30		EGEDHN
N#Cc1cccc(CNCc2cccc(I)c2)c1	ZINC000385388093	324262842	/nfs/dbraw/zinc/26/28/42/324262842.db2.gz	YOJPCZZLMNTVIK-UHFFFAOYSA-N	0	3	348.187	3.453	20	30		EGEDHN
CN(C)[C@@H]1CCOc2c(Nc3nccc(C#N)c3Cl)cccc21	ZINC000583254559	325508452	/nfs/dbraw/zinc/50/84/52/325508452.db2.gz	IQERUXGOKVCVMW-CQSZACIVSA-N	0	3	328.803	3.157	20	30		EGEDHN
CCCN(C)[C@H](CNC(=O)CSCC#N)c1ccc(Cl)cc1	ZINC000358923043	457037665	/nfs/dbraw/zinc/03/76/65/457037665.db2.gz	VZQJRRWXNHNYGP-OAHLLOKOSA-N	0	3	339.892	3.096	20	30		EGEDHN
CC(C)(C#N)CCN1CCC(C(=O)Nc2ccc(Cl)cn2)CC1	ZINC000157725565	455224794	/nfs/dbraw/zinc/22/47/94/455224794.db2.gz	HLRBRQULUWJZBG-UHFFFAOYSA-N	0	3	334.851	3.325	20	30		EGEDHN
CCC[C@H](C)NC(=O)[C@@H]1CCCN(Cc2ccc(OCC#N)cc2)C1	ZINC000264520532	455229653	/nfs/dbraw/zinc/22/96/53/455229653.db2.gz	ABKHCONBMJBJMM-FUHWJXTLSA-N	0	3	343.471	3.106	20	30		EGEDHN
N#CCSCCCN1CCCC[C@H]1COC(=O)N1CCCCC1	ZINC000368606753	458049801	/nfs/dbraw/zinc/04/98/01/458049801.db2.gz	FRPGHNDOUCFWKY-INIZCTEOSA-N	0	3	339.505	3.110	20	30		EGEDHN
Cc1cccc([C@@H](NCC(=O)N[C@](C)(C#N)C2CC2)C(C)(C)C)c1	ZINC000180789106	455244908	/nfs/dbraw/zinc/24/49/08/455244908.db2.gz	ZRHOYTSWVHSOOZ-UYAOXDASSA-N	0	3	327.472	3.480	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC[C@@H](C)Sc2ccccc2)CC1	ZINC000173198768	455245773	/nfs/dbraw/zinc/24/57/73/455245773.db2.gz	RDRRMTFYQVTNHD-OAHLLOKOSA-N	0	3	333.501	3.117	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)[C@@H](CC)Cc2ccccc2)CC1	ZINC000173196779	455246189	/nfs/dbraw/zinc/24/61/89/455246189.db2.gz	CWWLGFBZRYSAEX-IBGZPJMESA-N	0	3	329.488	3.300	20	30		EGEDHN
N#CCCCOc1cccc(CN[C@H]2CC(=O)N(c3ccccc3)C2)c1	ZINC000238112102	455254795	/nfs/dbraw/zinc/25/47/95/455254795.db2.gz	UFLBYWWCPUMUMP-SFHVURJKSA-N	0	3	349.434	3.264	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN[C@@H](C[C@@H]1CCOC1)c1ccccc1	ZINC000181203890	455301756	/nfs/dbraw/zinc/30/17/56/455301756.db2.gz	NUFRKGPWBBRABS-HKUYNNGSSA-N	0	3	330.472	3.169	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H](CC(C)C)c2ccccc2OC)CC1	ZINC000173582055	455309941	/nfs/dbraw/zinc/30/99/41/455309941.db2.gz	UMJKMOJQMNPXMM-IBGZPJMESA-N	0	3	342.483	3.244	20	30		EGEDHN
C=CCOCCCC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000173647779	455323114	/nfs/dbraw/zinc/32/31/14/455323114.db2.gz	BUQNHXPYGKJHOV-UYAOXDASSA-N	0	3	344.499	3.481	20	30		EGEDHN
C=CCOc1c(Cl)cc(CNCCC2(O)CCC2)cc1OC	ZINC000623517828	460592546	/nfs/dbraw/zinc/59/25/46/460592546.db2.gz	VQCPHMBYPSJRSP-UHFFFAOYSA-N	0	3	325.836	3.308	20	30		EGEDHN
C=CCOc1c(Cl)cc(CNC[C@@H](CO)C(C)C)cc1OC	ZINC000623525023	460596603	/nfs/dbraw/zinc/59/66/03/460596603.db2.gz	SSTIJPCBRVLKEX-AWEZNQCLSA-N	0	3	327.852	3.268	20	30		EGEDHN
C[C@]1(C#N)CCCN(C(=O)NC[C@H](c2ccccc2)N2CCCC2)C1	ZINC000612354995	460603501	/nfs/dbraw/zinc/60/35/01/460603501.db2.gz	DMUPQNLPZIHHLF-UYAOXDASSA-N	0	3	340.471	3.159	20	30		EGEDHN
COc1ccc([C@H](C/N=C/c2cccc(O)c2O)N2CCCC2)cc1	ZINC000022768425	453697985	/nfs/dbraw/zinc/69/79/85/453697985.db2.gz	CUJWIHYITPVIPB-LANLRWRYSA-N	0	3	340.423	3.362	20	30		EGEDHN
C[C@H](NC[C@H](O)COc1ccc(C#N)cc1)c1ccc(Cl)cc1	ZINC000023410144	453710275	/nfs/dbraw/zinc/71/02/75/453710275.db2.gz	WZRTZXXLUFGPCL-GUYCJALGSA-N	0	3	330.815	3.302	20	30		EGEDHN
C[C@@H](C#N)CN(C)C(=O)NC[C@@H](c1ccccc1)N1CCC(C)CC1	ZINC000052582227	453838297	/nfs/dbraw/zinc/83/82/97/453838297.db2.gz	AOGPFJFDBSQPMP-HKUYNNGSSA-N	0	3	342.487	3.261	20	30		EGEDHN
CCC[C@@H](C)N(C)CC(=O)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000075703510	453919649	/nfs/dbraw/zinc/91/96/49/453919649.db2.gz	FYOXXPUORVWKNV-CQSZACIVSA-N	0	3	340.389	3.294	20	30		EGEDHN
Cc1nnc(NC[C@H]2CCCN(Cc3ccccc3)C2)c(C#N)c1C	ZINC000067384781	453927458	/nfs/dbraw/zinc/92/74/58/453927458.db2.gz	FEAIUGBQSXKFPO-GOSISDBHSA-N	0	3	335.455	3.289	20	30		EGEDHN
CCN(C[C@H](C#N)CCC#N)CC1CCN(c2ccccn2)CC1	ZINC000076108684	453964759	/nfs/dbraw/zinc/96/47/59/453964759.db2.gz	BOVCMJWEAAKHLJ-SFHVURJKSA-N	0	3	325.460	3.063	20	30		EGEDHN
C[C@H](CN1CCC[C@H](C)C1)NC(=O)CSCc1ccc(C#N)cc1	ZINC000055406258	453982282	/nfs/dbraw/zinc/98/22/82/453982282.db2.gz	VSPABBGRAKEQCJ-JKSUJKDBSA-N	0	3	345.512	3.028	20	30		EGEDHN
N#CCc1cccc(C(=O)NC[C@H](c2ccccc2)N2CCCC2)c1	ZINC000042378865	454008637	/nfs/dbraw/zinc/00/86/37/454008637.db2.gz	ROBDBGAMUKYWLL-HXUWFJFHSA-N	0	3	333.435	3.320	20	30		EGEDHN
C[C@]1(C#N)CCCN(Cc2ccc(OCCN3CCCC3)cc2)C1	ZINC000612406890	460622227	/nfs/dbraw/zinc/62/22/27/460622227.db2.gz	WDAOCRDAPNKOEN-HXUWFJFHSA-N	0	3	327.472	3.287	20	30		EGEDHN
C[C@@]1(C#N)CCCN(Cc2ccc(OCCN3CCCC3)cc2)C1	ZINC000612406889	460622301	/nfs/dbraw/zinc/62/23/01/460622301.db2.gz	WDAOCRDAPNKOEN-FQEVSTJZSA-N	0	3	327.472	3.287	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N(C)[C@@H](C)c1cccnc1)C(C)C	ZINC000068583890	454039913	/nfs/dbraw/zinc/03/99/13/454039913.db2.gz	HCKAVNZJPISEMP-PKOBYXMFSA-N	0	3	344.503	3.483	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cccc(OC3CCCC3)c2)CC1	ZINC000057155193	454107687	/nfs/dbraw/zinc/10/76/87/454107687.db2.gz	HTRLEZKZHYYUBM-UHFFFAOYSA-N	0	3	326.440	3.292	20	30		EGEDHN
N#Cc1ccc(NC2CCN([C@@H]3CCOC3)CC2)c(C(F)(F)F)c1	ZINC000089603113	454167171	/nfs/dbraw/zinc/16/71/71/454167171.db2.gz	WRRVOPAPUHDYKB-CQSZACIVSA-N	0	3	339.361	3.242	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)C(=O)N[C@@H]1C[C@H](C)N(C2CC2)C1	ZINC000130564131	454206329	/nfs/dbraw/zinc/20/63/29/454206329.db2.gz	ZEDPBLZKUDJYOA-DOTOQJQBSA-N	0	3	343.471	3.018	20	30		EGEDHN
C=CCOc1cccc(CN2CCC[C@H](c3nnc4n3CCC4)C2)c1	ZINC000119835727	454225975	/nfs/dbraw/zinc/22/59/75/454225975.db2.gz	GVSJGDUPBCRJIJ-KRWDZBQOSA-N	0	3	338.455	3.169	20	30		EGEDHN
CC[C@H](NC[C@H](O)c1ccc(C#N)cc1)c1ccc2c(c1)OCCO2	ZINC000095984560	454250215	/nfs/dbraw/zinc/25/02/15/454250215.db2.gz	LNMLDUQBCZYEMI-ROUUACIJSA-N	0	3	338.407	3.104	20	30		EGEDHN
CCCCN1CCCC[C@H]1CNC(=O)c1c(F)cc(C#N)cc1F	ZINC000131402846	454251136	/nfs/dbraw/zinc/25/11/36/454251136.db2.gz	VNZCNWUJZNWIDY-AWEZNQCLSA-N	0	3	335.398	3.221	20	30		EGEDHN
N#Cc1ccc(CCC(=O)N2CCCN(Cc3ccccc3)CC2)cc1	ZINC000046642450	454271078	/nfs/dbraw/zinc/27/10/78/454271078.db2.gz	UWIMATWWYDLWLE-UHFFFAOYSA-N	0	3	347.462	3.225	20	30		EGEDHN
CCc1ccc([C@@H](C)NC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000120229785	454275023	/nfs/dbraw/zinc/27/50/23/454275023.db2.gz	NTPUKCAYVDYHGL-UZLBHIALSA-N	0	3	338.451	3.406	20	30		EGEDHN
CN(C)CCN(C)C(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1	ZINC000078579857	454279428	/nfs/dbraw/zinc/27/94/28/454279428.db2.gz	ZHYAMEJNYYEJHT-UHFFFAOYSA-N	0	3	338.411	3.376	20	30		EGEDHN
CCn1cc([C@H](C)N[C@H]2CCCN(c3ccc(C#N)cc3F)C2)cn1	ZINC000160170133	455433724	/nfs/dbraw/zinc/43/37/24/455433724.db2.gz	UZFHKKQXDGEUBR-YOEHRIQHSA-N	0	3	341.434	3.233	20	30		EGEDHN
Cc1cccc([C@@H]2CCCN2CCC(=O)Nc2sccc2C#N)n1	ZINC000160162462	455434252	/nfs/dbraw/zinc/43/42/52/455434252.db2.gz	JDEYZJKOMLRCPT-INIZCTEOSA-N	0	3	340.452	3.489	20	30		EGEDHN
C=CCCS(=O)(=O)NCc1ccccc1CN1CCCCCC1	ZINC000120568048	454321035	/nfs/dbraw/zinc/32/10/35/454321035.db2.gz	ZQESZMHGPMRXPC-UHFFFAOYSA-N	0	3	336.501	3.058	20	30		EGEDHN
C=CCOc1ccc(CNC[C@@H](c2ccco2)N(C)C)cc1OC	ZINC000072670307	454326093	/nfs/dbraw/zinc/32/60/93/454326093.db2.gz	QIZYQTWKEMXMJJ-INIZCTEOSA-N	0	3	330.428	3.246	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000079097704	454368454	/nfs/dbraw/zinc/36/84/54/454368454.db2.gz	TUFVOULELLVNSB-IBGZPJMESA-N	0	3	336.435	3.256	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N[C@@H](C)c1cccnc1)C(C)C	ZINC000079268991	454389723	/nfs/dbraw/zinc/38/97/23/454389723.db2.gz	WXNKZCMVAXORHI-FUHWJXTLSA-N	0	3	330.476	3.140	20	30		EGEDHN
C[C@@H]1CN(CC2CCN(c3c(F)cc(C#N)cc3F)CC2)C[C@H](C)O1	ZINC000091478103	454439965	/nfs/dbraw/zinc/43/99/65/454439965.db2.gz	JPADWSTVOZAKCL-OKILXGFUSA-N	0	3	349.425	3.162	20	30		EGEDHN
C[C@H](CN1CCC[C@@H](C)C1)NC(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000133862756	454476995	/nfs/dbraw/zinc/47/69/95/454476995.db2.gz	DUPRUFSMFQFBQG-LMMKCTJWSA-N	0	3	342.487	3.451	20	30		EGEDHN
C[C@H](CNC(=O)N[C@@H](CCC#N)c1ccccc1)N1CCC(C)CC1	ZINC000133882619	454478989	/nfs/dbraw/zinc/47/89/89/454478989.db2.gz	NWXLYURQQGCRDC-MJGOQNOKSA-N	0	3	342.487	3.451	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)C[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000102401459	454503128	/nfs/dbraw/zinc/50/31/28/454503128.db2.gz	MZUCKFFHRHGRJA-FZMZJTMJSA-N	0	3	340.345	3.432	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC(C)(C)c2ncc(C)s2)CC1	ZINC000080119899	454536926	/nfs/dbraw/zinc/53/69/26/454536926.db2.gz	TVHPMBVLQOFAFL-UHFFFAOYSA-N	0	3	336.505	3.026	20	30		EGEDHN
C#CCCCCNC(=O)NC[C@@H]1CCCN(Cc2cccs2)C1	ZINC000122606546	454551328	/nfs/dbraw/zinc/55/13/28/454551328.db2.gz	JJLDISCOWIARKY-INIZCTEOSA-N	0	3	333.501	3.063	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N(C)CCC1CCN(c2ccncc2)CC1	ZINC000092503421	454576482	/nfs/dbraw/zinc/57/64/82/454576482.db2.gz	SVDFCEXVPOHQOX-QGZVFWFLSA-N	0	3	345.487	3.128	20	30		EGEDHN
CCc1oc2ccccc2c1CN(C)CCC(=O)N(C)CCC#N	ZINC000092792367	454633054	/nfs/dbraw/zinc/63/30/54/454633054.db2.gz	RGXSXLFPRWESTB-UHFFFAOYSA-N	0	3	327.428	3.189	20	30		EGEDHN
COCCN(CCOc1ccc(OC)cc1)Cc1ccc(C#N)cc1	ZINC000123426125	454636900	/nfs/dbraw/zinc/63/69/00/454636900.db2.gz	WWVABJPCTIOQRJ-UHFFFAOYSA-N	0	3	340.423	3.094	20	30		EGEDHN
COc1ccc(CN(CCO)[C@H]2CCCc3ccccc32)cc1C#N	ZINC000135190647	454644578	/nfs/dbraw/zinc/64/45/78/454644578.db2.gz	GGHVBPGOWOUPES-FQEVSTJZSA-N	0	3	336.435	3.439	20	30		EGEDHN
CCc1nc(CNC2CCC(Oc3ccc(C#N)cn3)CC2)cs1	ZINC000092853963	454645909	/nfs/dbraw/zinc/64/59/09/454645909.db2.gz	NMRURFSKYUQCJV-UHFFFAOYSA-N	0	3	342.468	3.452	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H](C)SCc2ccccc2)CC1	ZINC000106036010	454674923	/nfs/dbraw/zinc/67/49/23/454674923.db2.gz	XFMVYQWDGNHFQM-MRXNPFEDSA-N	0	3	332.513	3.465	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(-c3ccccc3)on2)CC1	ZINC000106038202	454675925	/nfs/dbraw/zinc/67/59/25/454675925.db2.gz	JWYLSQPZLVAANZ-UHFFFAOYSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCn2ccc3ccccc32)CC1	ZINC000106038815	454676201	/nfs/dbraw/zinc/67/62/01/454676201.db2.gz	IRNVCTPSRGWLLL-UHFFFAOYSA-N	0	3	325.456	3.188	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](C)c2cc(F)ccc2OC)CC1	ZINC000106261327	454688936	/nfs/dbraw/zinc/68/89/36/454688936.db2.gz	GFKVALRTLXHCBG-CQSZACIVSA-N	0	3	349.450	3.235	20	30		EGEDHN
CN(Cc1ccccc1)[C@H]1CCN(C(=O)/C=C/c2ccccc2C#N)C1	ZINC000081124036	454689443	/nfs/dbraw/zinc/68/94/43/454689443.db2.gz	WWVAKVGLTXAPHD-VIOKTNGOSA-N	0	3	345.446	3.304	20	30		EGEDHN
CC[C@]1(NCC(=O)N(CCC#N)c2ccc(Cl)c(C)c2)CCOC1	ZINC000616865317	460648790	/nfs/dbraw/zinc/64/87/90/460648790.db2.gz	KFTOEDVCKICTAV-SFHVURJKSA-N	0	3	349.862	3.054	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Nc1ccc(CC#N)cc1	ZINC000161566947	454703692	/nfs/dbraw/zinc/70/36/92/454703692.db2.gz	XOQOGTGHZGLISK-JXFKEZNVSA-N	0	3	348.450	3.395	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C[C@@H](C)c2ccc(OC)cc2)CC1	ZINC000176285812	454722673	/nfs/dbraw/zinc/72/26/73/454722673.db2.gz	NIIBCZYMQZNENH-MRXNPFEDSA-N	0	3	330.472	3.346	20	30		EGEDHN
C#CCOc1ccccc1CN1CCC(OC[C@@H]2CCCCO2)CC1	ZINC000093842346	454739093	/nfs/dbraw/zinc/73/90/93/454739093.db2.gz	QLMPBNADUOZJIW-FQEVSTJZSA-N	0	3	343.467	3.249	20	30		EGEDHN
C=C(Cl)COc1ccc([C@H](C)N[C@H]2CCc3nc(C)nn3C2)cc1	ZINC000160565737	455475097	/nfs/dbraw/zinc/47/50/97/455475097.db2.gz	CSXBJEWEKXVAKP-BBRMVZONSA-N	0	3	346.862	3.383	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1CCS[C@H]2CCCC[C@@H]21	ZINC000177184620	454833631	/nfs/dbraw/zinc/83/36/31/454833631.db2.gz	CKAKUFMGANSKRU-YJBOKZPZSA-N	0	3	332.469	3.306	20	30		EGEDHN
C[C@@](C#N)(NC(=O)CN(Cc1ccccc1)CC1CCC1)C1CC1	ZINC000144866924	454851461	/nfs/dbraw/zinc/85/14/61/454851461.db2.gz	UAJDAYNAJCENAT-FQEVSTJZSA-N	0	3	325.456	3.097	20	30		EGEDHN
CN(C)[C@H](CNC(=O)CSc1cccc(C#N)c1)c1ccccc1	ZINC000177355659	454856014	/nfs/dbraw/zinc/85/60/14/454856014.db2.gz	YEUYIQQHWXZQJS-GOSISDBHSA-N	0	3	339.464	3.069	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)C(=O)NC[C@@H]1CCCCN1CC	ZINC000111512411	454867663	/nfs/dbraw/zinc/86/76/63/454867663.db2.gz	PYEFOVFNYKTAAF-IBGZPJMESA-N	0	3	342.487	3.354	20	30		EGEDHN
CC(C)c1csc(C(C#N)C(=O)c2ccc(-n3cnnc3)cc2)n1	ZINC000177745910	454898552	/nfs/dbraw/zinc/89/85/52/454898552.db2.gz	PRBNRBGJWGYMQG-AWEZNQCLSA-N	0	3	337.408	3.337	20	30		EGEDHN
N#CC1(NC(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)CCCCC1	ZINC000126507410	454899201	/nfs/dbraw/zinc/89/92/01/454899201.db2.gz	XSMBSQQKIBMACP-KRWDZBQOSA-N	0	3	343.446	3.380	20	30		EGEDHN
CC[C@H](NCC(=O)N(CCC#N)c1cccc(C)c1C)[C@H]1CCCO1	ZINC000182329749	455489887	/nfs/dbraw/zinc/48/98/87/455489887.db2.gz	CVGQIRIDEKZCOX-PKOBYXMFSA-N	0	3	343.471	3.097	20	30		EGEDHN
C[C@@H](NC(C)(C)CNC(=O)N1CCC(C#N)CC1)c1ccccc1	ZINC000113625916	454932258	/nfs/dbraw/zinc/93/22/58/454932258.db2.gz	LDVISPSRPMWXKG-OAHLLOKOSA-N	0	3	328.460	3.061	20	30		EGEDHN
CN(C[C@@H]1CCCN(C)C1)C(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000160705448	455489953	/nfs/dbraw/zinc/48/99/53/455489953.db2.gz	SXXMZKLYMXDDAY-AEFFLSMTSA-N	0	3	328.460	3.015	20	30		EGEDHN
COCCC[NH+]1CCC(/N=C/c2c([O-])ccc3ccccc32)CC1	ZINC000170696298	454959277	/nfs/dbraw/zinc/95/92/77/454959277.db2.gz	WIPZTMSESAQXJF-RCCKNPSSSA-N	0	3	326.440	3.465	20	30		EGEDHN
CN(C[C@H]1CCN(Cc2cccc(C#N)c2)C1)C(=O)OC(C)(C)C	ZINC000170918153	454999679	/nfs/dbraw/zinc/99/96/79/454999679.db2.gz	CGNUVAAJFNWOSK-QGZVFWFLSA-N	0	3	329.444	3.247	20	30		EGEDHN
N#CCCCOc1cccc(CN2CCS[C@H]3COCC[C@H]32)c1	ZINC000246463143	455494572	/nfs/dbraw/zinc/49/45/72/455494572.db2.gz	OEFOBKUGOKIYIL-MSOLQXFVSA-N	0	3	332.469	3.075	20	30		EGEDHN
C#CCN(Cc1cc(=O)n2c3ccccc3[nH]c2c1C#N)C1CCCC1	ZINC000155735470	455038447	/nfs/dbraw/zinc/03/84/47/455038447.db2.gz	QLZYPHJEHCYPBT-KRWDZBQOSA-N	0	3	344.418	3.101	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000128281757	455042009	/nfs/dbraw/zinc/04/20/09/455042009.db2.gz	LHZQKSNNGVNFCW-QAPCUYQASA-N	0	3	330.428	3.143	20	30		EGEDHN
COCCN(CCCOc1cccc(C#N)c1)Cc1ccc(C#N)cc1	ZINC000155856054	455053925	/nfs/dbraw/zinc/05/39/25/455053925.db2.gz	UXPRFHWDBFRATE-UHFFFAOYSA-N	0	3	349.434	3.347	20	30		EGEDHN
N#CC(=C([O-])c1ccc(OCC(F)F)nc1)c1nc2ccccc2[nH]1	ZINC000155863774	455054917	/nfs/dbraw/zinc/05/49/17/455054917.db2.gz	VWMFFPFMXAGROL-LLVKDONJSA-N	0	3	342.305	3.092	20	30		EGEDHN
N#CC(C(=O)c1ccc(OCC(F)F)nc1)c1nc2ccccc2[nH]1	ZINC000155863774	455054919	/nfs/dbraw/zinc/05/49/19/455054919.db2.gz	VWMFFPFMXAGROL-LLVKDONJSA-N	0	3	342.305	3.092	20	30		EGEDHN
C[C@H]1CN(CC2CCN(Cc3cc(C#N)ccc3F)CC2)C[C@H](C)O1	ZINC000171306897	455060715	/nfs/dbraw/zinc/06/07/15/455060715.db2.gz	JPBSFKDGHYITFZ-HOTGVXAUSA-N	0	3	345.462	3.019	20	30		EGEDHN
N#CC(C(=O)c1ccccc1COC1CCOCC1)c1ccccn1	ZINC000128699146	455077954	/nfs/dbraw/zinc/07/79/54/455077954.db2.gz	NHCCJBLURRNUQT-SFHVURJKSA-N	0	3	336.391	3.267	20	30		EGEDHN
N#Cc1ccc(F)c(CN2CCC[C@@H](c3nc(C4CC4)n[nH]3)C2)c1	ZINC000152210636	455087822	/nfs/dbraw/zinc/08/78/22/455087822.db2.gz	PQTHBNDWYHJHGN-CQSZACIVSA-N	0	3	325.391	3.072	20	30		EGEDHN
N#Cc1ccc(F)c(CN2CCC[C@@H](c3n[nH]c(C4CC4)n3)C2)c1	ZINC000152210636	455087827	/nfs/dbraw/zinc/08/78/27/455087827.db2.gz	PQTHBNDWYHJHGN-CQSZACIVSA-N	0	3	325.391	3.072	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](C)COc2c(C)cccc2C)CC1	ZINC000171724353	455089391	/nfs/dbraw/zinc/08/93/91/455089391.db2.gz	ZWWMVIZVITWUMI-QGZVFWFLSA-N	0	3	345.487	3.020	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCCc3ccccc3C2)CC1	ZINC000171735968	455090556	/nfs/dbraw/zinc/09/05/56/455090556.db2.gz	IBBSQZSWIYGHLG-UHFFFAOYSA-N	0	3	327.472	3.185	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C[C@H]2CCOc3ccccc32)CC1	ZINC000117793468	455094338	/nfs/dbraw/zinc/09/43/38/455094338.db2.gz	BAEGEUHBXMSZRX-MRXNPFEDSA-N	0	3	328.456	3.100	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN2CCC[C@@H](N3CCCC3)C2)c1C	ZINC000118829882	455114321	/nfs/dbraw/zinc/11/43/21/455114321.db2.gz	BTPDBEOJFZISKW-GOSISDBHSA-N	0	3	329.488	3.034	20	30		EGEDHN
Cc1ccccc1[C@@H](NCC(=O)N(CCC#N)CCC#N)C(C)(C)C	ZINC000180094201	455131080	/nfs/dbraw/zinc/13/10/80/455131080.db2.gz	SVQPIMLELXEQPD-LJQANCHMSA-N	0	3	340.471	3.328	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(C)c(OC(F)F)c2)CC1	ZINC000172218020	455135169	/nfs/dbraw/zinc/13/51/69/455135169.db2.gz	YFZAGJRITQKSSR-UHFFFAOYSA-N	0	3	339.386	3.368	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CCC(NC(=O)Cc2ccc(C#N)cc2)CC1	ZINC000172246993	455139210	/nfs/dbraw/zinc/13/92/10/455139210.db2.gz	FJWDURPQPQFGCL-KRWDZBQOSA-N	0	3	347.462	3.443	20	30		EGEDHN
N#Cc1ccccc1-c1ccc(CN2CCC[C@H](OCCO)C2)cc1	ZINC000172303272	455144465	/nfs/dbraw/zinc/14/44/65/455144465.db2.gz	ZWSHFAWAQJTDII-FQEVSTJZSA-N	0	3	336.435	3.199	20	30		EGEDHN
C[C@](C#N)(NC(=O)CN[C@@H](c1ccc(F)cc1)C1CCCC1)C1CC1	ZINC000180282998	455154703	/nfs/dbraw/zinc/15/47/03/455154703.db2.gz	XOZOGUICUFMWKB-WOJBJXKFSA-N	0	3	343.446	3.455	20	30		EGEDHN
C[C@H](NCCC(=O)Nc1cccc(C#N)c1)c1cccc([N+](=O)[O-])c1	ZINC000180448188	455171650	/nfs/dbraw/zinc/17/16/50/455171650.db2.gz	RRLRLMGIZKJRBV-ZDUSSCGKSA-N	0	3	338.367	3.146	20	30		EGEDHN
CN(CCNC(=O)c1cccc(Oc2ccc(C#N)cc2)c1)C1CC1	ZINC000264047288	455188600	/nfs/dbraw/zinc/18/86/00/455188600.db2.gz	AHUXQCUVZFVMKS-UHFFFAOYSA-N	0	3	335.407	3.175	20	30		EGEDHN
CN1CC[C@@H]2[C@H](CCCN2C(=O)N[C@@H](CCC#N)c2ccccc2)C1	ZINC000183360478	455282211	/nfs/dbraw/zinc/28/22/11/455282211.db2.gz	SIZJSKBQYUGZPM-CEXWTWQISA-N	0	3	340.471	3.157	20	30		EGEDHN
C=CCNC(=O)CN[C@@H](Cc1ccc(F)cc1)c1ccc(OC)cc1	ZINC000181136953	455293423	/nfs/dbraw/zinc/29/34/23/455293423.db2.gz	SEIOCOBTUOGNAL-IBGZPJMESA-N	0	3	342.414	3.010	20	30		EGEDHN
N#Cc1ccc(CN2CCC(NCc3ccc(Cl)nc3)CC2)cc1	ZINC000181535183	455350917	/nfs/dbraw/zinc/35/09/17/455350917.db2.gz	WFHYELPLNBUXAE-UHFFFAOYSA-N	0	3	340.858	3.361	20	30		EGEDHN
C[C@H](N[C@@H]1CN(Cc2ccccc2)CC[C@H]1CO)c1cccc(C#N)c1	ZINC000245885470	455392340	/nfs/dbraw/zinc/39/23/40/455392340.db2.gz	LJUZYHQDSZUATK-BULFRSBZSA-N	0	3	349.478	3.092	20	30		EGEDHN
C[C@H](NCCOc1ccc(Cl)cn1)c1ccc(OCC#N)cc1	ZINC000182016931	455416666	/nfs/dbraw/zinc/41/66/66/455416666.db2.gz	YEDXMBBVJOQXJG-ZDUSSCGKSA-N	0	3	331.803	3.367	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N[C@@H](CC)[C@H]1CCCO1	ZINC000182300215	455483560	/nfs/dbraw/zinc/48/35/60/455483560.db2.gz	VDVAVZIEQBBOJH-BHYGNILZSA-N	0	3	336.501	3.198	20	30		EGEDHN
COc1ccc([C@@H](CCO)NCCCOc2cccc(C#N)c2)cc1	ZINC000182399593	455505679	/nfs/dbraw/zinc/50/56/79/455505679.db2.gz	OGOWXFZCBQVAGB-HXUWFJFHSA-N	0	3	340.423	3.049	20	30		EGEDHN
C#CCC(C)(C)C(=O)Nc1cccc(N2CCN(CC3CC3)CC2)c1	ZINC000185284442	455533698	/nfs/dbraw/zinc/53/36/98/455533698.db2.gz	ORNIYETZEYJKKT-UHFFFAOYSA-N	0	3	339.483	3.207	20	30		EGEDHN
N#Cc1ccc(CN2CCC(Nc3ccc4c(c3)OCO4)CC2)cc1	ZINC000182634790	455556952	/nfs/dbraw/zinc/55/69/52/455556952.db2.gz	NIYVYGIGVJJSMX-UHFFFAOYSA-N	0	3	335.407	3.363	20	30		EGEDHN
N#Cc1cccc(OCCN[C@H]2CCO[C@@H]2c2ccc(F)c(F)c2)c1	ZINC000192138695	455563393	/nfs/dbraw/zinc/56/33/93/455563393.db2.gz	UWENXAAKNGUWCA-RBUKOAKNSA-N	0	3	344.361	3.335	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC[C@H]1CN(Cc2ccccc2)CCCO1	ZINC000192214352	455574560	/nfs/dbraw/zinc/57/45/60/455574560.db2.gz	PJKRQKMSYLRUNY-FQEVSTJZSA-N	0	3	342.483	3.162	20	30		EGEDHN
Cc1cccc(CN[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)c1C	ZINC000192242156	455580420	/nfs/dbraw/zinc/58/04/20/455580420.db2.gz	VZCFHGOYINRNIU-HXUWFJFHSA-N	0	3	333.435	3.066	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCC(c3ccncc3)CC2)CC1	ZINC000192385995	455604147	/nfs/dbraw/zinc/60/41/47/455604147.db2.gz	DTEIVHAHZDEPTI-UHFFFAOYSA-N	0	3	342.487	3.011	20	30		EGEDHN
CC(C)N(CC(=O)N(CCC#N)CCC#N)[C@@H](C)c1ccccc1	ZINC000292248591	455608447	/nfs/dbraw/zinc/60/84/47/455608447.db2.gz	QSCYWEGEVRCPJK-KRWDZBQOSA-N	0	3	326.444	3.114	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H]2CN(Cc3ccc(C#N)cc3)CC[C@H]21	ZINC000292259533	455611104	/nfs/dbraw/zinc/61/11/04/455611104.db2.gz	PJDQCJRGBBSXGO-QZTJIDSGSA-N	0	3	341.455	3.390	20	30		EGEDHN
N#C[C@H]1CCC[C@@H](N[C@@H]2CCN(c3ccc(F)c(Cl)c3)C2=O)C1	ZINC000185879762	455640769	/nfs/dbraw/zinc/64/07/69/455640769.db2.gz	XIFJLEHDFIBMFW-HWWQOWPSSA-N	0	3	335.810	3.256	20	30		EGEDHN
N#CCc1ccc(OC[C@H](O)CN2CCC[C@H]2c2ccsc2)cc1	ZINC000247716091	455641162	/nfs/dbraw/zinc/64/11/62/455641162.db2.gz	NJIYNNWZBCJOOY-MJGOQNOKSA-N	0	3	342.464	3.391	20	30		EGEDHN
CSC[C@H]1CCCN([C@H]2CCCN(c3ccc(C#N)cc3)C2=O)C1	ZINC000292449229	455665648	/nfs/dbraw/zinc/66/56/48/455665648.db2.gz	PFOKTYDQDURTCU-WMZOPIPTSA-N	0	3	343.496	3.129	20	30		EGEDHN
COc1cc(C#N)ccc1CN[C@H](C)[C@H]1OCCc2sccc21	ZINC000292556053	455696553	/nfs/dbraw/zinc/69/65/53/455696553.db2.gz	YYPPTZZJLLLQPW-KZULUSFZSA-N	0	3	328.437	3.420	20	30		EGEDHN
CCCN(CCC(=O)N(C)CCC#N)[C@@H](C)c1ccccc1OC	ZINC000271609048	455700419	/nfs/dbraw/zinc/70/04/19/455700419.db2.gz	VOCLTFQDRZHDRL-INIZCTEOSA-N	0	3	331.460	3.230	20	30		EGEDHN
COc1cccc([C@H](C)NCCOc2ccc(C#N)cc2OC)c1	ZINC000271614838	455701105	/nfs/dbraw/zinc/70/11/05/455701105.db2.gz	CEUQJAPBDOUXBW-AWEZNQCLSA-N	0	3	326.396	3.305	20	30		EGEDHN
CC[C@H](N[C@@H]1CCC[C@@H](C#N)C1)c1ccccc1OCC(=O)N(C)C	ZINC000248828386	455732869	/nfs/dbraw/zinc/73/28/69/455732869.db2.gz	MFJJIZMBPXFHSU-NUJGCVRESA-N	0	3	343.471	3.277	20	30		EGEDHN
C[C@H](N[C@@H]1CCC[C@@H](C#N)C1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000249043192	455742264	/nfs/dbraw/zinc/74/22/64/455742264.db2.gz	VHQJTRJBYFWQRU-HDMKZQKVSA-N	0	3	341.455	3.077	20	30		EGEDHN
C[C@@H](NCCOc1cccc(C#N)c1)c1ccc([S@@](C)=O)cc1	ZINC000271764906	455752158	/nfs/dbraw/zinc/75/21/58/455752158.db2.gz	CZRBVOJWINPGQU-QKFKETGDSA-N	0	3	328.437	3.025	20	30		EGEDHN
CCS[C@@H]1CCCC[C@H]1N[C@H](C)C(=O)NC1(C#N)CCCCC1	ZINC000249499852	455758438	/nfs/dbraw/zinc/75/84/38/455758438.db2.gz	IFJNGMNWEKVIQA-BZUAXINKSA-N	0	3	337.533	3.371	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@@H](C)N[C@@H](CC)c1ccc(OC)c(OC)c1	ZINC000285036757	455780389	/nfs/dbraw/zinc/78/03/89/455780389.db2.gz	HZWGSBMNPBHRIJ-WBVHZDCISA-N	0	3	346.471	3.334	20	30		EGEDHN
N#CCCN(CCC#N)C(=O)CN1CCCCC[C@H]1c1ccccc1	ZINC000193971630	455788835	/nfs/dbraw/zinc/78/88/35/455788835.db2.gz	LMTYDRRYXTYFFD-IBGZPJMESA-N	0	3	338.455	3.260	20	30		EGEDHN
Cn1c2ccccc2nc1C(C)(C)NCCOc1ccccc1C#N	ZINC000186561195	455793446	/nfs/dbraw/zinc/79/34/46/455793446.db2.gz	LFQKTLJHGMTJFP-UHFFFAOYSA-N	0	3	334.423	3.349	20	30		EGEDHN
COc1ccc(OC)c([C@@H](O)CN[C@@H](C)c2ccc(C#N)c(F)c2)c1	ZINC000271939606	455799679	/nfs/dbraw/zinc/79/96/79/455799679.db2.gz	OKWQQAPOJDRVNC-SGTLLEGYSA-N	0	3	344.386	3.099	20	30		EGEDHN
C[C@@H](CNC(=O)[C@]1(C#N)CC12CCCC2)N(C)Cc1ccccc1	ZINC000294774339	455827169	/nfs/dbraw/zinc/82/71/69/455827169.db2.gz	ZHTZTVULZZVJKF-OXJNMPFZSA-N	0	3	325.456	3.097	20	30		EGEDHN
C=CCN(C)CCN(CC)CC(=O)Nc1cc(Cl)ccc1Cl	ZINC000253418854	455843525	/nfs/dbraw/zinc/84/35/25/455843525.db2.gz	BJRMDZVRJHGBKZ-UHFFFAOYSA-N	0	3	344.286	3.372	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N[C@H]2CCC[C@@H](C)C2)cc1	ZINC000278680839	455844613	/nfs/dbraw/zinc/84/46/13/455844613.db2.gz	ROPZVTQIHQRYHG-IPYPFGDCSA-N	0	3	349.456	3.073	20	30		EGEDHN
CC[C@@H](C)[C@H](C)NC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000194474208	455847283	/nfs/dbraw/zinc/84/72/83/455847283.db2.gz	ASDYDPDGVZPOTR-CVEARBPZSA-N	0	3	330.476	3.066	20	30		EGEDHN
N#CCc1ccc(OC[C@H](O)CN2CC(C3CCCCC3)C2)cc1	ZINC000295815832	455861004	/nfs/dbraw/zinc/86/10/04/455861004.db2.gz	BVOILVCSLKOPDB-LJQANCHMSA-N	0	3	328.456	3.004	20	30		EGEDHN
C#CCO[C@H](C)c1nc(-c2cccc(CN3CCCCC3)c2)no1	ZINC000295906553	455862719	/nfs/dbraw/zinc/86/27/19/455862719.db2.gz	LWECJPUMHXFAJH-OAHLLOKOSA-N	0	3	325.412	3.433	20	30		EGEDHN
C=CCN1CCC(NC(=O)/C=C\c2cc(Cl)ccc2OC)CC1	ZINC000255326703	455864230	/nfs/dbraw/zinc/86/42/30/455864230.db2.gz	FUOMKCHSRLJLFQ-DAXSKMNVSA-N	0	3	334.847	3.128	20	30		EGEDHN
CC[C@H]1CN(Cc2cn(CCC#N)nc2-c2ccncc2)CCS1	ZINC000279500272	455866869	/nfs/dbraw/zinc/86/68/69/455866869.db2.gz	ZFPVTVSEPYTZGP-KRWDZBQOSA-N	0	3	341.484	3.186	20	30		EGEDHN
CCCCCCCCNC(=O)C(=O)Nc1cccc(CN(C)C)c1	ZINC000270160192	455892043	/nfs/dbraw/zinc/89/20/43/455892043.db2.gz	SHSRPPJYBAXFKM-UHFFFAOYSA-N	0	3	333.476	3.163	20	30		EGEDHN
C[C@H](CCN[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O)c1ccccc1	ZINC000194891875	455897423	/nfs/dbraw/zinc/89/74/23/455897423.db2.gz	JPCAPQYSOJADSX-UTKZUKDTSA-N	0	3	347.462	3.443	20	30		EGEDHN
CC[C@H]1c2ccccc2CCN1C[C@@H](O)COc1ccc(C#N)cc1	ZINC000261480635	455906976	/nfs/dbraw/zinc/90/69/76/455906976.db2.gz	MGEXGWRRAWQXFH-NQIIRXRSSA-N	0	3	336.435	3.307	20	30		EGEDHN
C[C@@H](c1ccncc1)N1CCC(NC(=O)c2ccc(CC#N)cc2)CC1	ZINC000270448443	455956967	/nfs/dbraw/zinc/95/69/67/455956967.db2.gz	DUSBJQQJCDGHLT-INIZCTEOSA-N	0	3	348.450	3.103	20	30		EGEDHN
CS[C@@H]1CCC[C@H](NC(=O)C(C#N)Cc2ccc(C#N)cc2)C1	ZINC000280463940	455976392	/nfs/dbraw/zinc/97/63/92/455976392.db2.gz	ONWCKRGOKVKTLN-IXDOHACOSA-N	0	3	327.453	3.031	20	30		EGEDHN
CS[C@@H]1CCC[C@@H](NC(=O)C(C#N)Cc2ccc(C#N)cc2)C1	ZINC000280463937	455976486	/nfs/dbraw/zinc/97/64/86/455976486.db2.gz	ONWCKRGOKVKTLN-BRWVUGGUSA-N	0	3	327.453	3.031	20	30		EGEDHN
CCc1noc(CC)c1CNC1CCN(c2ccc(C#N)cc2)CC1	ZINC000286204884	455999244	/nfs/dbraw/zinc/99/92/44/455999244.db2.gz	RUDNYHHTNUQWMW-UHFFFAOYSA-N	0	3	338.455	3.430	20	30		EGEDHN
CC(C)[C@@H](NCC(=O)NC1(C#N)CCCCC1)c1ccc(F)cc1	ZINC000198437765	456007022	/nfs/dbraw/zinc/00/70/22/456007022.db2.gz	SNPZEZKDVPZPTL-GOSISDBHSA-N	0	3	331.435	3.455	20	30		EGEDHN
CC1(c2ccccc2)CC(NC(=O)C(C#N)Cc2ccc(C#N)cc2)C1	ZINC000280632649	456017706	/nfs/dbraw/zinc/01/77/06/456017706.db2.gz	YXRCBLUXGAEPSG-HOHBBMLPSA-N	0	3	343.430	3.477	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)NCC(C)(C)N[C@@H](C)c1ccccc1	ZINC000280652146	456022871	/nfs/dbraw/zinc/02/28/71/456022871.db2.gz	OHWUZLSMENFHBH-ZDUSSCGKSA-N	0	3	325.412	3.319	20	30		EGEDHN
COCC[C@H](NC1CCN(c2ccc(C#N)cc2)CC1)c1ccco1	ZINC000286349637	456030217	/nfs/dbraw/zinc/03/02/17/456030217.db2.gz	ZELYMROVAUHXGJ-IBGZPJMESA-N	0	3	339.439	3.487	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)NCC2CCCCC2)cc1	ZINC000286972221	456058173	/nfs/dbraw/zinc/05/81/73/456058173.db2.gz	BKYGGDCUSBZJRO-CYBMUJFWSA-N	0	3	349.456	3.074	20	30		EGEDHN
C[C@H](N[C@H]1CCO[C@@H](c2cncn2C)C1)c1ccc(C#N)cc1F	ZINC000332429648	456074964	/nfs/dbraw/zinc/07/49/64/456074964.db2.gz	PTJVNLVFEIXGCV-XAYKYTGQSA-N	0	3	328.391	3.002	20	30		EGEDHN
CC(C)(C)Nc1nc(NCCCCC#N)nc(NCCCCC#N)n1	ZINC000287781714	456077155	/nfs/dbraw/zinc/07/71/55/456077155.db2.gz	ILWXUKQWOOSIPF-UHFFFAOYSA-N	0	3	344.467	3.294	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H]2CC[C@H](c3cccc(F)c3)C2)CC1	ZINC000281005014	456106758	/nfs/dbraw/zinc/10/67/58/456106758.db2.gz	WFFJKUXIVFACOM-LPHOPBHVSA-N	0	3	345.462	3.411	20	30		EGEDHN
C=C[C@](C)(CC)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1	ZINC000289022228	456111942	/nfs/dbraw/zinc/11/19/42/456111942.db2.gz	VSRVTYWAOOSQHU-LJQANCHMSA-N	0	3	341.459	3.127	20	30		EGEDHN
CC(C)c1nnc2n1C[C@H](N[C@H](C)c1ccc(C#N)cc1F)CC2	ZINC000332696967	456112539	/nfs/dbraw/zinc/11/25/39/456112539.db2.gz	XIRDFIORZPEJRF-TZMCWYRMSA-N	0	3	327.407	3.078	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1c1nc(-c2ccccc2OCCN(C)C)no1	ZINC000289164092	456116386	/nfs/dbraw/zinc/11/63/86/456116386.db2.gz	UTLQMRFDQQGHDA-NVXWUHKLSA-N	0	3	343.427	3.126	20	30		EGEDHN
CC1CCN([C@@H](CNC(=O)NCCCC#N)c2ccccc2)CC1	ZINC000273019164	456147476	/nfs/dbraw/zinc/14/74/76/456147476.db2.gz	BTTQDTPJUQMTLY-SFHVURJKSA-N	0	3	328.460	3.063	20	30		EGEDHN
COc1ccc(CN2CCN(C3CCC3)CC2)cc1OCCCC#N	ZINC000271169579	456152282	/nfs/dbraw/zinc/15/22/82/456152282.db2.gz	IMVPEHUPKJPXPS-UHFFFAOYSA-N	0	3	343.471	3.048	20	30		EGEDHN
CCc1nnc(N2CCN(C3CCC(C)CC3)CC2)c(C#N)c1CC	ZINC000301620946	456165234	/nfs/dbraw/zinc/16/52/34/456165234.db2.gz	MXNVNPJTDXXBFY-UHFFFAOYSA-N	0	3	341.503	3.174	20	30		EGEDHN
Cc1cccc2ncnc(N(CCN(C)C)Cc3ccc(C#N)cc3)c12	ZINC000301652143	456174014	/nfs/dbraw/zinc/17/40/14/456174014.db2.gz	QMTZNQLDUYVGQU-UHFFFAOYSA-N	0	3	345.450	3.378	20	30		EGEDHN
COc1ccc(NC(=O)CCNC2(c3cccc(C#N)c3)CC2)cc1	ZINC000273116878	456182903	/nfs/dbraw/zinc/18/29/03/456182903.db2.gz	HAJNXAOHIYGJMW-UHFFFAOYSA-N	0	3	335.407	3.174	20	30		EGEDHN
C[C@H](C1CCN(C)CC1)N(C)C(=O)N[C@H](CCC#N)c1ccccc1	ZINC000273404289	456228307	/nfs/dbraw/zinc/22/83/07/456228307.db2.gz	HIZNWFNECUUBSM-VQIMIIECSA-N	0	3	342.487	3.403	20	30		EGEDHN
CCO[C@@H]1C[C@H](/[NH+]=C/c2ccc(N(CC)CC)cc2[O-])[C@]12CCCO2	ZINC000273538222	456237579	/nfs/dbraw/zinc/23/75/79/456237579.db2.gz	SNUWWJNMXYMJNP-YSHNSTAQSA-N	0	3	346.471	3.384	20	30		EGEDHN
COc1ccc(CNCCc2csc(C)n2)cc1OCCCC#N	ZINC000237163587	456240364	/nfs/dbraw/zinc/24/03/64/456240364.db2.gz	CTSFJFOSUPZGLR-UHFFFAOYSA-N	0	3	345.468	3.475	20	30		EGEDHN
Cc1ccc(/N=C/c2cccc([O-])c2O)cc1NC(=O)CC[NH+](C)C	ZINC000274351664	456255821	/nfs/dbraw/zinc/25/58/21/456255821.db2.gz	SOKGSMDEXCAAQU-UDWIEESQSA-N	0	3	341.411	3.047	20	30		EGEDHN
Cn1cc(CN2CCC[C@@H](CCNC(=O)OC(C)(C)C)C2)cc1C#N	ZINC000281674046	456289643	/nfs/dbraw/zinc/28/96/43/456289643.db2.gz	DRJYSFGKDOSVQA-HNNXBMFYSA-N	0	3	346.475	3.024	20	30		EGEDHN
C=CCCN1CCN(Cc2cc(Br)ccc2F)CC1	ZINC000337217616	456338643	/nfs/dbraw/zinc/33/86/43/456338643.db2.gz	BEJZXXVDCASQRQ-UHFFFAOYSA-N	0	3	327.241	3.282	20	30		EGEDHN
COc1cc(CNC[C@@H](O)c2ccc(OC(C)C)cc2)ccc1C#N	ZINC000281770096	456315959	/nfs/dbraw/zinc/31/59/59/456315959.db2.gz	SGQFPVDNKCMAIC-LJQANCHMSA-N	0	3	340.423	3.177	20	30		EGEDHN
C=C(C)CN(CCc1ccccc1C(=O)OC)Cc1ccc(CO)o1	ZINC000352795586	456316311	/nfs/dbraw/zinc/31/63/11/456316311.db2.gz	DQZCHDXGGQGDAL-UHFFFAOYSA-N	0	3	343.423	3.179	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1nc2cccnc2s1)C(C)C	ZINC000337159279	456332062	/nfs/dbraw/zinc/33/20/62/456332062.db2.gz	ROJCOZYLRGNDIO-OAHLLOKOSA-N	0	3	344.484	3.120	20	30		EGEDHN
COC(=O)c1cccc(NC2CCN(Cc3cccc(C#N)c3)CC2)c1	ZINC000290498660	456344357	/nfs/dbraw/zinc/34/43/57/456344357.db2.gz	OZCBKHZSFDEDNB-UHFFFAOYSA-N	0	3	349.434	3.421	20	30		EGEDHN
C[C@@H]1CC[C@H](C)N1CC(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1	ZINC000347751341	456349723	/nfs/dbraw/zinc/34/97/23/456349723.db2.gz	FJPDAHSNTTVURB-NBMJBFSESA-N	0	3	325.456	3.158	20	30		EGEDHN
CCCN(CCN1CCCC1)Cc1ccc(C#N)cc1OC(F)F	ZINC000352887244	456390531	/nfs/dbraw/zinc/39/05/31/456390531.db2.gz	RXVHWEKQRFRLBG-UHFFFAOYSA-N	0	3	337.414	3.467	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2cccc(Oc3cnccn3)c2)nc(C)n1	ZINC000347969819	456432139	/nfs/dbraw/zinc/43/21/39/456432139.db2.gz	WGXDUTJCMWTJAH-MRXNPFEDSA-N	0	3	345.362	3.166	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1	ZINC000353036466	456453292	/nfs/dbraw/zinc/45/32/92/456453292.db2.gz	ZDBAFIGPHZOTJW-WIYYLYMNSA-N	0	3	344.499	3.338	20	30		EGEDHN
N#CCCCOc1cccc(CN[C@]2(CO)CCc3ccccc32)c1	ZINC000305183485	456534525	/nfs/dbraw/zinc/53/45/25/456534525.db2.gz	SSZRQOGIJKNDFT-NRFANRHFSA-N	0	3	336.435	3.293	20	30		EGEDHN
C[C@@H](CNCc1cc(C#N)n(C)c1)Oc1cccc(Br)c1	ZINC000276726857	456562478	/nfs/dbraw/zinc/56/24/78/456562478.db2.gz	CHJGKTIBXKLBGZ-LBPRGKRZSA-N	0	3	348.244	3.216	20	30		EGEDHN
C=CCn1c(C2CCC2)nnc1N1CCN(CC2CCCCC2)CC1	ZINC000337819885	456565857	/nfs/dbraw/zinc/56/58/57/456565857.db2.gz	RAAFQTTWGKTDPM-UHFFFAOYSA-N	0	3	343.519	3.434	20	30		EGEDHN
CCc1nc(C#N)cc(N[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)n1	ZINC000308170306	456571684	/nfs/dbraw/zinc/57/16/84/456571684.db2.gz	QEUJBZVRTUBYQO-WBVHZDCISA-N	0	3	335.455	3.376	20	30		EGEDHN
CN(C)C[C@H](NC(=O)c1cc(C#N)cs1)c1ccc(Cl)cc1	ZINC000282803877	456630521	/nfs/dbraw/zinc/63/05/21/456630521.db2.gz	HIAYTNSADGZUDA-AWEZNQCLSA-N	0	3	333.844	3.306	20	30		EGEDHN
C=CCN1CCC(NC(=O)C[C@@H](c2cccs2)n2cccc2)CC1	ZINC000353315103	456631545	/nfs/dbraw/zinc/63/15/45/456631545.db2.gz	OAYCLTSOMCDKPV-KRWDZBQOSA-N	0	3	343.496	3.296	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc3nc(SC)sc3c2)CC1	ZINC000299295996	456651556	/nfs/dbraw/zinc/65/15/56/456651556.db2.gz	NNKRRDSMQDHCJW-UHFFFAOYSA-N	0	3	345.493	3.302	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1	ZINC000283016744	456690660	/nfs/dbraw/zinc/69/06/60/456690660.db2.gz	SLSNPJMLYJKTKW-INIZCTEOSA-N	0	3	331.803	3.146	20	30		EGEDHN
CCCN(CC(=O)N[C@@](C)(C#N)C1CC1)[C@@H]1CCc2ccccc21	ZINC000299450267	456696644	/nfs/dbraw/zinc/69/66/44/456696644.db2.gz	ZHCGFEWZPPTGNX-QUCCMNQESA-N	0	3	325.456	3.194	20	30		EGEDHN
C=CCC[C@H](NC1CCN(S(=O)(=O)CCC)CC1)c1ccco1	ZINC000353462251	456700425	/nfs/dbraw/zinc/70/04/25/456700425.db2.gz	OKCWSJLFYGVXMS-INIZCTEOSA-N	0	3	340.489	3.081	20	30		EGEDHN
O=C(NCC#Cc1cccc(F)c1)c1cccc(CN2CCCC2)c1	ZINC000338236152	456724354	/nfs/dbraw/zinc/72/43/54/456724354.db2.gz	HJZZCVRNOCXURQ-UHFFFAOYSA-N	0	3	336.410	3.203	20	30		EGEDHN
CC(C)(Cc1nc2ccccc2[nH]1)C(=O)N[C@H]1CCN(C2CC2)C1	ZINC000328671439	456732984	/nfs/dbraw/zinc/73/29/84/456732984.db2.gz	NIZPZTNXUCGNMD-ZDUSSCGKSA-N	0	3	326.444	3.325	20	30		EGEDHN
C[C@H](N[C@@H]1[C@@H]2CCO[C@H]2C12CCC2)C(=O)NC(=O)NC1CCCCC1	ZINC000328673209	456733909	/nfs/dbraw/zinc/73/39/09/456733909.db2.gz	IWUQXRAADXHRBM-ARLBYUKCSA-N	0	3	349.475	3.125	20	30		EGEDHN
Cc1cc(C)cc(NC(=O)[C@H](C)N2CCC[C@@H]2[C@H]2COCC[C@@H]2O)c1	ZINC000328693855	456737533	/nfs/dbraw/zinc/73/75/33/456737533.db2.gz	CSMTWECORMUIFB-AITUJVMLSA-N	0	3	346.471	3.142	20	30		EGEDHN
CC(C)N1CCN(c2cccc(NC(=O)[C@H]3CCCC(=O)N3)c2)CC1	ZINC000328783247	456759977	/nfs/dbraw/zinc/75/99/77/456759977.db2.gz	HWLZPRHBPQCZBH-QGZVFWFLSA-N	0	3	344.459	3.314	20	30		EGEDHN
CCN(Cc1ccc(C(=O)N(C[C@@H](C)C#N)C2CC2)cc1)C1CC1	ZINC000338346585	456779084	/nfs/dbraw/zinc/77/90/84/456779084.db2.gz	FGBMBOURCAOASG-HNNXBMFYSA-N	0	3	325.456	3.435	20	30		EGEDHN
CC(C)(C)c1cc(NC(=O)CN[C@@H]2CCC(=O)N[C@H]2C2CC2)on1	ZINC000328913075	456789838	/nfs/dbraw/zinc/78/98/38/456789838.db2.gz	PHZBBVOSHWSSFP-BZNIZROVSA-N	0	3	334.420	3.047	20	30		EGEDHN
C=CCCN(C)C(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1	ZINC000344262602	456811403	/nfs/dbraw/zinc/81/14/03/456811403.db2.gz	JBIIRPZLNHIFRY-QGZVFWFLSA-N	0	3	340.389	3.476	20	30		EGEDHN
CN1CCC2(CCCN2C(=O)NCc2cc3ccccc3[nH]2)CC1	ZINC000329029504	456818668	/nfs/dbraw/zinc/81/86/68/456818668.db2.gz	AQEFUFKYDXFSPC-UHFFFAOYSA-N	0	3	326.444	3.142	20	30		EGEDHN
CC[C@@](C)(C#N)C(=O)N1CC[C@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000353647086	456828584	/nfs/dbraw/zinc/82/85/84/456828584.db2.gz	GDJBMGGQSUFAAJ-LEWJYISDSA-N	0	3	339.483	3.441	20	30		EGEDHN
CN(C)Cc1ccccc1CNC(=O)C[C@H](CC#N)c1ccccc1	ZINC000353656151	456834778	/nfs/dbraw/zinc/83/47/78/456834778.db2.gz	KMHUQPIVRCCKBM-SFHVURJKSA-N	0	3	335.451	3.452	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2cccc(SCC#N)c2)CCN(C2CCC2)C1	ZINC000344713308	456851705	/nfs/dbraw/zinc/85/17/05/456851705.db2.gz	CNYHLTXYHTVCCW-HNNXBMFYSA-N	0	3	343.496	3.249	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cc(-c2ccco2)n[nH]1)C(C)C	ZINC000344787101	456859260	/nfs/dbraw/zinc/85/92/60/456859260.db2.gz	JTODNIPQMXIYFO-QGZVFWFLSA-N	0	3	342.443	3.098	20	30		EGEDHN
Cn1ccc(C(=O)C(C#N)c2nnc3n2CCCCC3)c1C1CCC1	ZINC000344924373	456871467	/nfs/dbraw/zinc/87/14/67/456871467.db2.gz	XEIVEYZIBCJHRK-HNNXBMFYSA-N	0	3	337.427	3.101	20	30		EGEDHN
C[C@H](NC(=O)N[C@@H]1CCOC2(CCCCC2)C1)C1=CCN(C)CC1	ZINC000329357589	456878455	/nfs/dbraw/zinc/87/84/55/456878455.db2.gz	WQQLCFYQNSKQQF-DOTOQJQBSA-N	0	3	335.492	3.022	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2C[C@@H]2c2c(F)cccc2F)CC1	ZINC000341596693	456879465	/nfs/dbraw/zinc/87/94/65/456879465.db2.gz	DJMJUBRWYNZXPT-WMLDXEAASA-N	0	3	349.425	3.160	20	30		EGEDHN
CCCN1CCC[C@H]1C(=O)N1CCC(NC(=O)C2CCCCC2)CC1	ZINC000329507717	456902729	/nfs/dbraw/zinc/90/27/29/456902729.db2.gz	LXELUCBUPCYUEG-SFHVURJKSA-N	0	3	349.519	3.389	20	30		EGEDHN
CC[C@@H]1C[C@@H](C(=O)NCC2CCN(c3ccncc3)CC2)CC(=O)N1	ZINC000329623617	456917785	/nfs/dbraw/zinc/91/77/85/456917785.db2.gz	UWCUTXCVXNJINJ-HZPDHXFCSA-N	0	3	344.459	3.400	20	30		EGEDHN
COc1ccc([C@H](CNC(=O)[C@@H]2C[C@]23CCOC3)N2CCCC2)cc1	ZINC000329645120	456920623	/nfs/dbraw/zinc/92/06/23/456920623.db2.gz	IPPCINQZHMAPSN-BJLQDIEVSA-N	0	3	344.455	3.215	20	30		EGEDHN
Cc1cc(NCCCN2CCN(C)C[C@H]2c2ccccc2)cc(C#N)n1	ZINC000341747396	456926206	/nfs/dbraw/zinc/92/62/06/456926206.db2.gz	ZUNLNHNJQPKBES-NRFANRHFSA-N	0	3	349.482	3.052	20	30		EGEDHN
CCc1nccn1[C@@H]1CCCN(C([O-])=[NH+]C[C@H]2CCCSC2)C1	ZINC000329705911	456930245	/nfs/dbraw/zinc/93/02/45/456930245.db2.gz	KRPHIYYDWDZUHD-HUUCEWRRSA-N	0	3	336.505	3.140	20	30		EGEDHN
Cc1cccc([C@H](C)NC([O-])=[NH+]C[C@H]2CCc3nccn3C2)c1C	ZINC000329924640	456961289	/nfs/dbraw/zinc/96/12/89/456961289.db2.gz	VBGSKLAMFPIXBW-JKSUJKDBSA-N	0	3	326.444	3.327	20	30		EGEDHN
COc1ccc(CC[C@H]2CCCCN2C(=O)C(C)C#N)cc1OC	ZINC000345224197	456971713	/nfs/dbraw/zinc/97/17/13/456971713.db2.gz	CHKNTRYOIDWMDM-GDBMZVCRSA-N	0	3	330.428	3.177	20	30		EGEDHN
C=CC[C@H](CO)CN[C@@H]1CCc2c1c(Br)ccc2F	ZINC000341869945	456979534	/nfs/dbraw/zinc/97/95/34/456979534.db2.gz	AKHARSQKXXXRJI-IINYFYTJSA-N	0	3	328.225	3.350	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NCC(C)(C)N1CCc2ccccc2C1)OCC	ZINC000339199842	456988360	/nfs/dbraw/zinc/98/83/60/456988360.db2.gz	CYDIEXLIEVQEKS-IBGZPJMESA-N	0	3	344.499	3.311	20	30		EGEDHN
CC[C@H](C)n1ncc(NC(=O)N2CC[C@H](N3CCCCC3)C2)c1C	ZINC000330133108	456989793	/nfs/dbraw/zinc/98/97/93/456989793.db2.gz	QWWJVNRXSMTYON-HOCLYGCPSA-N	0	3	333.480	3.268	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@@H]([NH2+]Cc3cc([O-])cc(F)c3)C2)c(F)c1	ZINC000349651181	457006893	/nfs/dbraw/zinc/00/68/93/457006893.db2.gz	BVTKJYACLSINJD-MRXNPFEDSA-N	0	3	343.377	3.301	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)[C@H]1CCC(C)(C)C1	ZINC000358886481	457023644	/nfs/dbraw/zinc/02/36/44/457023644.db2.gz	LXKSLAOWBVTZOT-SFHVURJKSA-N	0	3	327.472	3.275	20	30		EGEDHN
CCN(CCCNC1(c2cccc(C#N)c2)CC1)CC(F)(F)F	ZINC000341960606	457026655	/nfs/dbraw/zinc/02/66/55/457026655.db2.gz	XLOUTTMSEVDEKV-UHFFFAOYSA-N	0	3	325.378	3.411	20	30		EGEDHN
C[C@H](Sc1ccccc1C(=O)N[C@@H]1CCN(C)[C@@H](C)C1)C(N)=O	ZINC000330397459	457037569	/nfs/dbraw/zinc/03/75/69/457037569.db2.gz	OYUFHMHBEVZMJM-RWMBFGLXSA-N	0	3	335.473	3.490	20	30		EGEDHN
CCN1CCC[C@@H]1CNC(=O)c1cnn(C(C)(C)C)c1C(F)(F)F	ZINC000330528362	457053113	/nfs/dbraw/zinc/05/31/13/457053113.db2.gz	NBFBLPAIBDQHGF-LLVKDONJSA-N	0	3	346.397	3.446	20	30		EGEDHN
C[C@H](C#N)CN(C)C(=O)NC1CCN([C@@H](C)c2ccccc2)CC1	ZINC000342001573	457053591	/nfs/dbraw/zinc/05/35/91/457053591.db2.gz	IXUZQBGMSXEVLB-CVEARBPZSA-N	0	3	328.460	3.013	20	30		EGEDHN
CC(=O)Nc1cccc(NC(=O)N(C)[C@H](C)C2CCN(C)CC2)c1C	ZINC000330705267	457073082	/nfs/dbraw/zinc/07/30/82/457073082.db2.gz	KOUQXORRKMHUEC-CQSZACIVSA-N	0	3	346.475	3.161	20	30		EGEDHN
C=CCN(CCC#N)C(=O)[C@@H](C)N1CCC(Cc2ccccc2)CC1	ZINC000359435314	457083396	/nfs/dbraw/zinc/08/33/96/457083396.db2.gz	KJVIBGDPSFHXQQ-GOSISDBHSA-N	0	3	339.483	3.258	20	30		EGEDHN
CCCN(CCN1CCCCCC1)C(=O)c1ncc(C#N)cc1Cl	ZINC000356637508	457095255	/nfs/dbraw/zinc/09/52/55/457095255.db2.gz	DYOLTQWSXXPQPD-UHFFFAOYSA-N	0	3	348.878	3.335	20	30		EGEDHN
CC(C)NC(=O)Nc1cccc(C(=O)N[C@@H]2CCN(C)[C@H](C)C2)c1	ZINC000330920388	457103900	/nfs/dbraw/zinc/10/39/00/457103900.db2.gz	ZPIYEJFJEKZQJM-CZUORRHYSA-N	0	3	332.448	3.208	20	30		EGEDHN
COc1c(C(=O)N[C@H](C)CN2C[C@H](C)C[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000331070489	457127983	/nfs/dbraw/zinc/12/79/83/457127983.db2.gz	SOCVJWNJVULUGZ-HZSPNIEDSA-N	0	3	349.431	3.274	20	30		EGEDHN
C=CCOc1cccnc1C(=O)Nc1ccccc1CCN(C)C	ZINC000354206473	457129996	/nfs/dbraw/zinc/12/99/96/457129996.db2.gz	CLMCDDVCMXBPIQ-UHFFFAOYSA-N	0	3	325.412	3.003	20	30		EGEDHN
CC(C)C[C@H](C)n1nccc1NC(=O)N[C@H](C)C1=CCN(C)CC1	ZINC000331132136	457136365	/nfs/dbraw/zinc/13/63/65/457136365.db2.gz	QMMQDEKQBMUHDU-LSDHHAIUSA-N	0	3	333.480	3.467	20	30		EGEDHN
C[C@@H](C(=O)N(C)CCC#N)N1CCC[C@@H](c2ccc(F)cc2)CC1	ZINC000351198695	457239143	/nfs/dbraw/zinc/23/91/43/457239143.db2.gz	GRPUCSBTXLONES-JKSUJKDBSA-N	0	3	331.435	3.156	20	30		EGEDHN
N#CC(C(=O)c1ccc(Cl)c(Br)c1)c1ccncn1	ZINC000354475092	457247618	/nfs/dbraw/zinc/24/76/18/457247618.db2.gz	ZQEIHAQGXAZBNE-SECBINFHSA-N	0	3	336.576	3.383	20	30		EGEDHN
N#CC(C(=O)c1cc(C2CC2)nn1-c1ccccc1)c1ccncn1	ZINC000354479182	457249226	/nfs/dbraw/zinc/24/92/26/457249226.db2.gz	WFGRIRWEIKLRQN-OAHLLOKOSA-N	0	3	329.363	3.030	20	30		EGEDHN
N#Cc1ccc2c(c1)N(C(=O)[C@@H]1CCCN(Cc3ccccc3)C1)CC2	ZINC000339810357	457282240	/nfs/dbraw/zinc/28/22/40/457282240.db2.gz	DMAAPVNBIBDHST-HXUWFJFHSA-N	0	3	345.446	3.360	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@@H](C)N1CCC(Cc2cccnc2)CC1	ZINC000357043735	457294302	/nfs/dbraw/zinc/29/43/02/457294302.db2.gz	RKJCFAPSHXWJEW-QGZVFWFLSA-N	0	3	329.488	3.149	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N[C@H]1CCN(C2CC2)C1)c1ccc(F)c(F)c1	ZINC000357066561	457306719	/nfs/dbraw/zinc/30/67/19/457306719.db2.gz	CJMOZUBSLPHMGI-GUYCJALGSA-N	0	3	335.398	3.118	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1)OCC	ZINC000354733613	457316166	/nfs/dbraw/zinc/31/61/66/457316166.db2.gz	DEFADNKEAALKBV-UXHICEINSA-N	0	3	344.499	3.481	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]([C@H]3CCOC3)C2)c(Br)c1	ZINC000360757900	457339819	/nfs/dbraw/zinc/33/98/19/457339819.db2.gz	VNUTWBKDPVLVLB-ZFWWWQNUSA-N	0	3	335.245	3.179	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]([C@@H]3CCOC3)C2)c(Br)c1	ZINC000360757895	457340078	/nfs/dbraw/zinc/34/00/78/457340078.db2.gz	VNUTWBKDPVLVLB-DZGCQCFKSA-N	0	3	335.245	3.179	20	30		EGEDHN
COc1ccc(CN2CC[C@@](CO)(C(C)C)C2)cc1OCCCC#N	ZINC000378132173	457379706	/nfs/dbraw/zinc/37/97/06/457379706.db2.gz	PQHZIZXBWPBKIP-HXUWFJFHSA-N	0	3	346.471	3.218	20	30		EGEDHN
Cn1nccc1[C@H]1CCCN(Cc2cccc(OCCCC#N)c2)C1	ZINC000378334922	457389432	/nfs/dbraw/zinc/38/94/32/457389432.db2.gz	NZVJBVDBHPSPKX-SFHVURJKSA-N	0	3	338.455	3.482	20	30		EGEDHN
C[C@@H](NC(=O)NCC(C)(C)CCC#N)[C@H](c1ccccc1)N(C)C	ZINC000357278863	457416835	/nfs/dbraw/zinc/41/68/35/457416835.db2.gz	FFSXJGKJVOQUJV-NVXWUHKLSA-N	0	3	330.476	3.307	20	30		EGEDHN
CC[C@@H](C(=O)N(Cc1cccc(C(F)(F)F)c1)[C@@H](C)C#N)N(C)C	ZINC000425091062	457435193	/nfs/dbraw/zinc/43/51/93/457435193.db2.gz	WJSHEZPQMBCDFW-WFASDCNBSA-N	0	3	341.377	3.286	20	30		EGEDHN
N#Cc1ccc(NCC2(N3CCSCC3)CCCC2)cc1[N+](=O)[O-]	ZINC000357310258	457439239	/nfs/dbraw/zinc/43/92/39/457439239.db2.gz	ZATMABFETYRJFY-UHFFFAOYSA-N	0	3	346.456	3.240	20	30		EGEDHN
Cc1cc(NC[C@@H](c2ccc(OC(C)C)cc2)N(C)C)c(C#N)cn1	ZINC000425271514	457478322	/nfs/dbraw/zinc/47/83/22/457478322.db2.gz	VDOSOXXOPBMTDZ-FQEVSTJZSA-N	0	3	338.455	3.186	20	30		EGEDHN
N#CCc1ccc(CN2CCC[C@H](c3nnc4ccccn43)C2)cc1	ZINC000342736794	457488811	/nfs/dbraw/zinc/48/88/11/457488811.db2.gz	QTCDLOIHTVAEMS-SFHVURJKSA-N	0	3	331.423	3.175	20	30		EGEDHN
N#CCc1ccc(CN2CCC(C(=O)Nc3ccc(O)cc3)CC2)cc1	ZINC000342751517	457499608	/nfs/dbraw/zinc/49/96/08/457499608.db2.gz	GLUUPDZSGDCYGH-UHFFFAOYSA-N	0	3	349.434	3.309	20	30		EGEDHN
COc1cc(OC)cc(Oc2ccc(CNC(=O)C(C)C#N)cc2)c1	ZINC000356168579	457503652	/nfs/dbraw/zinc/50/36/52/457503652.db2.gz	UPSHKCPADJGHTD-CYBMUJFWSA-N	0	3	340.379	3.272	20	30		EGEDHN
CCN(Cc1cc(C(=O)OC)n(C)c1)[C@@H](C)c1ccc(C#N)cc1	ZINC000347603435	457544077	/nfs/dbraw/zinc/54/40/77/457544077.db2.gz	CQLAGABXMJOFDP-AWEZNQCLSA-N	0	3	325.412	3.266	20	30		EGEDHN
C=CCOc1cccnc1C(=O)N[C@@H](C)[C@H](c1ccccc1)N(C)C	ZINC000356260240	457553033	/nfs/dbraw/zinc/55/30/33/457553033.db2.gz	VAMZLBSDRFZHHX-HNAYVOBHSA-N	0	3	339.439	3.068	20	30		EGEDHN
CCCCN(C)CCNC(=O)Nc1cc(C#N)ccc1OC(C)C	ZINC000352722023	457558878	/nfs/dbraw/zinc/55/88/78/457558878.db2.gz	NEYJLWRUBBCYOI-UHFFFAOYSA-N	0	3	332.448	3.199	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)N[C@@H]2CC[C@H](C#N)C2)CCN1Cc1ccccc1	ZINC000425497014	457577339	/nfs/dbraw/zinc/57/73/39/457577339.db2.gz	WEZXTLIVBQHFMQ-LULLPPNCSA-N	0	3	340.471	3.031	20	30		EGEDHN
CC[C@H](C)N[C@H](CNC(=O)NCC(C)(C)CCC#N)c1ccco1	ZINC000357549287	457589419	/nfs/dbraw/zinc/58/94/19/457589419.db2.gz	USLGMINIMAUWPO-LSDHHAIUSA-N	0	3	334.464	3.338	20	30		EGEDHN
CCCN(CC)c1ccc(C(=O)C(C#N)c2cc(C)nc(C)n2)cn1	ZINC000357802689	457695506	/nfs/dbraw/zinc/69/55/06/457695506.db2.gz	VWFVOXZSJYVYOS-INIZCTEOSA-N	0	3	337.427	3.215	20	30		EGEDHN
N#Cc1ccc(CN2CCC(c3nc(-c4ccccn4)no3)CC2)cc1	ZINC000361331952	457696646	/nfs/dbraw/zinc/69/66/46/457696646.db2.gz	VOVTZQCNRVTHPZ-UHFFFAOYSA-N	0	3	345.406	3.383	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(N(CC)C(C)C)cc2)CC1	ZINC000357815984	457700463	/nfs/dbraw/zinc/70/04/63/457700463.db2.gz	GEABRDDKMKXWLX-UHFFFAOYSA-N	0	3	329.488	3.302	20	30		EGEDHN
C=CCN(Cc1cnc(-c2cnn(C)c2)nc1)CC1CCCCC1	ZINC000365405374	457757021	/nfs/dbraw/zinc/75/70/21/457757021.db2.gz	VUESVIWOYSGPOT-UHFFFAOYSA-N	0	3	325.460	3.445	20	30		EGEDHN
C[C@@H](NCCCC#N)c1ccc(Br)cc1OCCCO	ZINC000361518770	457766647	/nfs/dbraw/zinc/76/66/47/457766647.db2.gz	KEDOMMVGWHPSMM-GFCCVEGCSA-N	0	3	341.249	3.165	20	30		EGEDHN
CN(Cc1nccn1C(F)F)C(=O)C(C#N)CCc1ccccc1	ZINC000433223975	457783482	/nfs/dbraw/zinc/78/34/82/457783482.db2.gz	VNFLANTZBZWJLG-CQSZACIVSA-N	0	3	332.354	3.009	20	30		EGEDHN
CCC[C@@H]1CN(Cc2cc(C#N)n(C)c2)CCN1Cc1ccccc1	ZINC000361544388	457785695	/nfs/dbraw/zinc/78/56/95/457785695.db2.gz	UPOOJSSBRJNUPK-HXUWFJFHSA-N	0	3	336.483	3.383	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)N(C)CC(C)(C)C#N)c1ccsc1	ZINC000457684523	457790826	/nfs/dbraw/zinc/79/08/26/457790826.db2.gz	JMWQUPDSYKQRHG-HNNXBMFYSA-N	0	3	336.505	3.322	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)NCC(C)(C)CC#N)c1ccsc1	ZINC000457693274	457794064	/nfs/dbraw/zinc/79/40/64/457794064.db2.gz	RVCRHZABWNLNSL-HNNXBMFYSA-N	0	3	336.505	3.370	20	30		EGEDHN
C[C@@H](CNCc1cn(CCC#N)nc1-c1ccncc1)C(F)(F)F	ZINC000433335773	457813624	/nfs/dbraw/zinc/81/36/24/457813624.db2.gz	MUDDYQRHIFJKFY-LBPRGKRZSA-N	0	3	337.349	3.147	20	30		EGEDHN
N#CCCN(C(=O)CN1CC[C@@H]2CCC[C@H]21)c1cccc(Cl)c1	ZINC000426474831	457838691	/nfs/dbraw/zinc/83/86/91/457838691.db2.gz	VWZAOGKROBSKHK-WMLDXEAASA-N	0	3	331.847	3.461	20	30		EGEDHN
N#CC1(CCN2CC[C@@H]3[C@H](CCC(=O)N3C3CC3)C2)CCCCC1	ZINC000411398485	457874066	/nfs/dbraw/zinc/87/40/66/457874066.db2.gz	OSTGPRUXBFSPND-SJLPKXTDSA-N	0	3	329.488	3.326	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)NC[C@@H]1CCCCN1C1CC1	ZINC000433920662	457912085	/nfs/dbraw/zinc/91/20/85/457912085.db2.gz	QTNNOGDLHXNKJE-SFHVURJKSA-N	0	3	343.471	3.068	20	30		EGEDHN
C#C[C@H](NC(=O)NC[C@@H]1CCCN(C)[C@H]1c1cccs1)C(C)C	ZINC000366999665	457919318	/nfs/dbraw/zinc/91/93/18/457919318.db2.gz	XUWFEFSTTRRJTJ-YQQAZPJKSA-N	0	3	333.501	3.088	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CC[C@@H](CC(F)(F)F)C1	ZINC000444696269	457943030	/nfs/dbraw/zinc/94/30/30/457943030.db2.gz	VNTSEUDVUCZRDH-HOCLYGCPSA-N	0	3	343.389	3.429	20	30		EGEDHN
C[C@@H](CCCc1cccnc1)N[C@H]1CCN(c2ccc(C#N)cc2)C1=O	ZINC000411826788	457987549	/nfs/dbraw/zinc/98/75/49/457987549.db2.gz	SVZNLTCRFSNGTD-JXFKEZNVSA-N	0	3	348.450	3.060	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2C[C@H]2c2ccccc2F)CC1	ZINC000458311450	458008626	/nfs/dbraw/zinc/00/86/26/458008626.db2.gz	AGYGNJKBFXIIFC-FUHWJXTLSA-N	0	3	331.435	3.021	20	30		EGEDHN
C=CCC[C@H](C(=O)N1C[C@@H](SC)[C@@H](N(C)C)C1)c1ccccc1	ZINC000427629479	458009963	/nfs/dbraw/zinc/00/99/63/458009963.db2.gz	NDJQLHRWXILQIC-OKZBNKHCSA-N	0	3	332.513	3.240	20	30		EGEDHN
C=C(CC)CNC(=O)NCC1(N[C@@H](C)c2ccccc2)CCOCC1	ZINC000458377045	458029341	/nfs/dbraw/zinc/02/93/41/458029341.db2.gz	QSKQWOKNSATFNL-KRWDZBQOSA-N	0	3	345.487	3.152	20	30		EGEDHN
C[C@H](CN(C)C(=O)C(C#N)CCc1ccccc1)C(=O)OC(C)(C)C	ZINC000458390383	458032690	/nfs/dbraw/zinc/03/26/90/458032690.db2.gz	MWUMBCBEACLOQW-NVXWUHKLSA-N	0	3	344.455	3.195	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN(C)[C@@H]2CCN(CC)[C@H](C)C2)c1C	ZINC000362252379	458056540	/nfs/dbraw/zinc/05/65/40/458056540.db2.gz	PLAVQZTYVFQJJP-CRAIPNDOSA-N	0	3	331.504	3.278	20	30		EGEDHN
C=CCOc1ccc(CNCc2cn(C)nc2-c2cccnc2)cc1	ZINC000375768416	458057819	/nfs/dbraw/zinc/05/78/19/458057819.db2.gz	NLFWJDATZGMYRO-UHFFFAOYSA-N	0	3	334.423	3.337	20	30		EGEDHN
C=CCN1CCC(NC(=O)CCc2ccc(Cl)c(OC)c2)CC1	ZINC000435017886	458078379	/nfs/dbraw/zinc/07/83/79/458078379.db2.gz	YCPMPMXHUBOMTI-UHFFFAOYSA-N	0	3	336.863	3.048	20	30		EGEDHN
C=CCC[C@@H](NC(=O)NC[C@@]1(N(C)C)CCSC1)c1ccccc1	ZINC000435111933	458095252	/nfs/dbraw/zinc/09/52/52/458095252.db2.gz	UDGIDAKYPNOTOA-MJGOQNOKSA-N	0	3	347.528	3.430	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Cc1cccc(F)c1F)C(C)C	ZINC000446114456	458149860	/nfs/dbraw/zinc/14/98/60/458149860.db2.gz	RXICPHGKQTWGFU-QGZVFWFLSA-N	0	3	336.426	3.322	20	30		EGEDHN
CC(=O)N1CC[C@H](NCc2ccc(OCC#N)cc2)c2ccccc2C1	ZINC000376176477	458223673	/nfs/dbraw/zinc/22/36/73/458223673.db2.gz	BJEUMLFLHIHRPH-NRFANRHFSA-N	0	3	349.434	3.172	20	30		EGEDHN
C=CC(C)(C)CNC(=O)N(C)CC1CCN(c2ccncc2)CC1	ZINC000458993486	458238193	/nfs/dbraw/zinc/23/81/93/458238193.db2.gz	XPEVNMRVWIMNME-UHFFFAOYSA-N	0	3	330.476	3.152	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN2CCN([C@@H]3C[C@H]3C)C[C@@H](C)C2)c1C	ZINC000429033526	458262362	/nfs/dbraw/zinc/26/23/62/458262362.db2.gz	ZLKDQRMGHGBHCB-RZQQEMMASA-N	0	3	343.515	3.136	20	30		EGEDHN
CC(C)CCN(CCC#N)C(=O)Nc1cccc(OCCN(C)C)c1	ZINC000429112683	458272884	/nfs/dbraw/zinc/27/28/84/458272884.db2.gz	VYGFHSLVRGHYNV-UHFFFAOYSA-N	0	3	346.475	3.421	20	30		EGEDHN
CC(C)CCO[C@@H]1CCCC[C@H]1NCC(=O)Nc1cccc(C#N)c1	ZINC000436257107	458278404	/nfs/dbraw/zinc/27/84/04/458278404.db2.gz	COFLNFNPWZEOBS-RTBURBONSA-N	0	3	343.471	3.460	20	30		EGEDHN
C#C[C@@H](NC(=O)NC1CCN([C@H](C)c2ccccc2)CC1)C(C)C	ZINC000369617641	458291312	/nfs/dbraw/zinc/29/13/12/458291312.db2.gz	PPROTKNHEIPLLE-VQIMIIECSA-N	0	3	327.472	3.169	20	30		EGEDHN
CCN(C(=O)NCC(C)(C)CC#N)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000459238748	458299063	/nfs/dbraw/zinc/29/90/63/458299063.db2.gz	OJUGJBMSZDJSEB-GOSISDBHSA-N	0	3	342.487	3.232	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NC(=O)N[C@@H]1C[C@H](C)N(C2CC2)C1	ZINC000413388422	458299718	/nfs/dbraw/zinc/29/97/18/458299718.db2.gz	WZOSTKOQEOFTRN-CGTJXYLNSA-N	0	3	327.472	3.098	20	30		EGEDHN
CN(C(=O)NCC(C)(C)CC#N)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000459263077	458306443	/nfs/dbraw/zinc/30/64/43/458306443.db2.gz	WRVSOBOYHRYPLJ-SFHVURJKSA-N	0	3	342.487	3.232	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1CNC(=O)NC[C@H](N)c1ccc(C(C)C)cc1	ZINC000418130944	458371223	/nfs/dbraw/zinc/37/12/23/458371223.db2.gz	GYAYQKAOFIRFEU-FHWLQOOXSA-N	0	3	345.487	3.090	20	30		EGEDHN
C=CCN(CCOCC1CCC1)[C@H](C)c1cccc(-n2cnnn2)c1	ZINC000419210991	458379354	/nfs/dbraw/zinc/37/93/54/458379354.db2.gz	WIPGXAPFPQGLRN-MRXNPFEDSA-N	0	3	341.459	3.028	20	30		EGEDHN
CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)NCC1(C#N)CCC1	ZINC000419478404	458383890	/nfs/dbraw/zinc/38/38/90/458383890.db2.gz	JOIDXVJWGZEWNL-SFHVURJKSA-N	0	3	342.487	3.136	20	30		EGEDHN
CSc1ccc([C@H](CNC(=O)NCC2(C#N)CCC2)N(C)C)cc1	ZINC000419501752	458384833	/nfs/dbraw/zinc/38/48/33/458384833.db2.gz	BSMUHUBZOJZQFM-INIZCTEOSA-N	0	3	346.500	3.004	20	30		EGEDHN
C=CC(C)(C)C(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000448817283	458411870	/nfs/dbraw/zinc/41/18/70/458411870.db2.gz	CXEMSUVQSHJCCP-UHFFFAOYSA-N	0	3	330.472	3.236	20	30		EGEDHN
COc1ccc(CN2CCC[C@@H](CCO)CC2)cc1OCCCC#N	ZINC000421397069	458412860	/nfs/dbraw/zinc/41/28/60/458412860.db2.gz	LCEPNTXQKRECDE-QGZVFWFLSA-N	0	3	346.471	3.362	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CCC[C@H](CC(F)(F)F)C2)cc1	ZINC000421970715	458423983	/nfs/dbraw/zinc/42/39/83/458423983.db2.gz	SWTLFWRLLJLURT-HZPDHXFCSA-N	0	3	349.356	3.432	20	30		EGEDHN
C=CCC[C@@H](NC1CCN(Cc2ccccc2)CC1)C(=O)OCC	ZINC000449661462	458428684	/nfs/dbraw/zinc/42/86/84/458428684.db2.gz	ZYFFENDTBRWTPY-LJQANCHMSA-N	0	3	330.472	3.139	20	30		EGEDHN
C=CCC[C@H](CO)NCc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1	ZINC000449698844	458430030	/nfs/dbraw/zinc/43/00/30/458430030.db2.gz	PGSPPSCBPWWMHW-CYBMUJFWSA-N	0	3	346.383	3.280	20	30		EGEDHN
C=CCN1CC[C@H](N(C)c2ccnc3ccc(OC(C)C)cc32)C1=O	ZINC000450501834	458449727	/nfs/dbraw/zinc/44/97/27/458449727.db2.gz	QXCSFWCVEMXFGF-IBGZPJMESA-N	0	3	339.439	3.245	20	30		EGEDHN
CN(CCN1CCC[C@@]2(CCCCO2)[C@H]1C#N)Cc1ccccc1	ZINC000450883146	458459235	/nfs/dbraw/zinc/45/92/35/458459235.db2.gz	PCPLCGVHJFWMNE-UXHICEINSA-N	0	3	327.472	3.046	20	30		EGEDHN
C[C@H]1CN(Cc2ccc(Br)cc2C#N)CCN(C2CC2)C1	ZINC000451096620	458465525	/nfs/dbraw/zinc/46/55/25/458465525.db2.gz	XLAFPWKQPQJTMD-ZDUSSCGKSA-N	0	3	348.288	3.237	20	30		EGEDHN
CO[C@H](C)c1nc(CN2CCCN(CCCCC#N)CC2)cs1	ZINC000437542724	458466009	/nfs/dbraw/zinc/46/60/09/458466009.db2.gz	UUYBHIYZXCLGTE-OAHLLOKOSA-N	0	3	336.505	3.052	20	30		EGEDHN
N#Cc1csc(C(=O)NC[C@@H]2CCCN2CC2CCCCC2)c1	ZINC000437562005	458466580	/nfs/dbraw/zinc/46/65/80/458466580.db2.gz	WGEAVCUCKDBGMR-INIZCTEOSA-N	0	3	331.485	3.394	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@@H]1C[C@H](OC)C1(C)C	ZINC000451490504	458479007	/nfs/dbraw/zinc/47/90/07/458479007.db2.gz	IDAOWFWJCVSTFQ-CVEARBPZSA-N	0	3	334.485	3.306	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCC(=O)N(Cc1ccc(C(C)C)cc1)C1CC1	ZINC000451606073	458483238	/nfs/dbraw/zinc/48/32/38/458483238.db2.gz	GNOFYZNWGYJDSM-UXHICEINSA-N	0	3	342.483	3.234	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1N[C@@H]1CCN(c2ccc(Cl)c(Cl)c2)C1=O	ZINC000451607900	458483347	/nfs/dbraw/zinc/48/33/47/458483347.db2.gz	LYPFGRRCBFAZDM-KFWWJZLASA-N	0	3	341.238	3.032	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCC(=O)N1c2ccccc2CCc2ccccc21	ZINC000451609353	458483571	/nfs/dbraw/zinc/48/35/71/458483571.db2.gz	DADVLVWHKQPNSY-NQIIRXRSSA-N	0	3	348.446	3.383	20	30		EGEDHN
C[C@H](NCCS(=O)(=O)c1ccc(C#N)cc1)[C@H]1CCC[C@@H](C)C1	ZINC000452073290	458494409	/nfs/dbraw/zinc/49/44/09/458494409.db2.gz	VCBDESYOWLHCCB-VYDXJSESSA-N	0	3	334.485	3.136	20	30		EGEDHN
C=CCC1(C(=O)Nc2cccc(CN3CC[C@@H](O)C3)c2)CCCC1	ZINC000452197728	458496796	/nfs/dbraw/zinc/49/67/96/458496796.db2.gz	SZEGKLYITPGAFE-GOSISDBHSA-N	0	3	328.456	3.328	20	30		EGEDHN
CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)NCC1(CC#N)CC1	ZINC000430904263	458503016	/nfs/dbraw/zinc/50/30/16/458503016.db2.gz	PZKDWPNCMVRHJB-GOSISDBHSA-N	0	3	342.487	3.136	20	30		EGEDHN
CCCN(CCN1CCCCCC1)C(=O)NCc1cccc(C#N)c1	ZINC000460163618	458503434	/nfs/dbraw/zinc/50/34/34/458503434.db2.gz	DEPSTWCTQJZJGI-UHFFFAOYSA-N	0	3	342.487	3.356	20	30		EGEDHN
CO[C@@H](CNC(=O)C(C#N)CCc1ccccc1)Cc1ccccc1	ZINC000452816779	458511640	/nfs/dbraw/zinc/51/16/40/458511640.db2.gz	MXBUINGNPPUZJA-VQTJNVASSA-N	0	3	336.435	3.133	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCc1cccc(C(F)(F)F)n1	ZINC000452895531	458513078	/nfs/dbraw/zinc/51/30/78/458513078.db2.gz	QOBAGIQXFITBOU-CQSZACIVSA-N	0	3	347.340	3.489	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1N[C@@H](C)c1ccc(I)cc1	ZINC000453355384	458525230	/nfs/dbraw/zinc/52/52/30/458525230.db2.gz	LKMXBRAJKMSRIL-GDLCADMTSA-N	0	3	343.208	3.285	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1C(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1	ZINC000468822240	458538616	/nfs/dbraw/zinc/53/86/16/458538616.db2.gz	DBDDHZDDUBNQFE-VAMGGRTRSA-N	0	3	342.483	3.229	20	30		EGEDHN
C[C@H](NC(=O)[C@H](N)CCCC#N)c1cc(F)c(Cl)cc1Cl	ZINC000424061427	458547626	/nfs/dbraw/zinc/54/76/26/458547626.db2.gz	FFPASULBBDAPHI-ISVAXAHUSA-N	0	3	332.206	3.331	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N[C@H](CCc1ccccc1)c1ccccc1	ZINC000424086315	458555668	/nfs/dbraw/zinc/55/56/68/458555668.db2.gz	BUNPJXGQHVELQF-VQTJNVASSA-N	0	3	335.451	3.498	20	30		EGEDHN
CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)[C@H](N)CCCC#N	ZINC000424097092	458557293	/nfs/dbraw/zinc/55/72/93/458557293.db2.gz	DRXZNYOCTLDPFM-CQSZACIVSA-N	0	3	328.243	3.363	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N(Cc1ccc(C(F)(F)F)cc1)C1CC1	ZINC000424106197	458559807	/nfs/dbraw/zinc/55/98/07/458559807.db2.gz	XCKAMLUFTQQKIV-HNNXBMFYSA-N	0	3	339.361	3.218	20	30		EGEDHN
N#Cc1ccc(CN2CCC(Nc3cccc4c3COC4=O)CC2)cc1	ZINC000377881918	458561136	/nfs/dbraw/zinc/56/11/36/458561136.db2.gz	BAIVFYXAHREONU-UHFFFAOYSA-N	0	3	347.418	3.305	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1nc2ccccc2n1C1CCCC1	ZINC000424122089	458563167	/nfs/dbraw/zinc/56/31/67/458563167.db2.gz	IXFMKVLRMPPEDM-CQSZACIVSA-N	0	3	325.416	3.111	20	30		EGEDHN
CCN(C(=O)[C@@H](N)CCCC#N)[C@H](Cc1ccc(F)cc1)C(C)C	ZINC000424122267	458563207	/nfs/dbraw/zinc/56/32/07/458563207.db2.gz	IRCFCHICOIWQEV-ZWKOTPCHSA-N	0	3	333.451	3.262	20	30		EGEDHN
C[C@H]1c2cc(Cl)cc(Cl)c2CCN1C(=O)[C@H](N)CCCC#N	ZINC000424130476	458566531	/nfs/dbraw/zinc/56/65/31/458566531.db2.gz	FJNQSBAGILWCPP-ZUZCIYMTSA-N	0	3	340.254	3.460	20	30		EGEDHN
CC(C)c1nccn1Cc1cccc(NC(=O)[C@H](N)CCCC#N)c1	ZINC000424141103	458569537	/nfs/dbraw/zinc/56/95/37/458569537.db2.gz	WTTHKRFGTJUQQA-QGZVFWFLSA-N	0	3	339.443	3.014	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)NCc1ccccc1Sc1ccccc1	ZINC000424147187	458570644	/nfs/dbraw/zinc/57/06/44/458570644.db2.gz	YAMDMOPJXSHDOF-QGZVFWFLSA-N	0	3	339.464	3.475	20	30		EGEDHN
C[C@H](CNC(=O)C(C)(C)Cc1ccc(C#N)cc1)N1CCC[C@H](C)C1	ZINC000454726590	458573417	/nfs/dbraw/zinc/57/34/17/458573417.db2.gz	BPYCJTOXBXRUGW-DLBZAZTESA-N	0	3	341.499	3.364	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1cc(Cl)ccc1OCC1CCC1	ZINC000424176491	458578001	/nfs/dbraw/zinc/57/80/01/458578001.db2.gz	SCMWDGFLMYPXKN-AWEZNQCLSA-N	0	3	335.835	3.479	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H](N(CCCSCC#N)C2CC2)C1	ZINC000493909120	458598510	/nfs/dbraw/zinc/59/85/10/458598510.db2.gz	ULIUXSJRDJDRLV-HNNXBMFYSA-N	0	3	339.505	3.107	20	30		EGEDHN
C[C@H](C(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1)c1cccc(C#N)c1	ZINC000462197862	458603158	/nfs/dbraw/zinc/60/31/58/458603158.db2.gz	HQIRFTISPOQJSM-WWMYMODYSA-N	0	3	347.462	3.441	20	30		EGEDHN
C=CCC[C@@H](C(=O)NCCCN1CCCO[C@H](C)C1)c1ccccc1	ZINC000470095429	458611988	/nfs/dbraw/zinc/61/19/88/458611988.db2.gz	ZHKBTTDPZMFYNO-UYAOXDASSA-N	0	3	344.499	3.354	20	30		EGEDHN
N#CCCC[C@@H](N)c1nc(-c2cccc(CN3CCCCC3)c2)no1	ZINC000424337041	458619090	/nfs/dbraw/zinc/61/90/90/458619090.db2.gz	KMHQSPOBQAXXGK-QGZVFWFLSA-N	0	3	339.443	3.416	20	30		EGEDHN
CCCN(CCN1CCCCC1)C(=O)[C@H](C)c1cccc(C#N)c1	ZINC000462448787	458621705	/nfs/dbraw/zinc/62/17/05/458621705.db2.gz	BBFBPDOCNQMTQH-QGZVFWFLSA-N	0	3	327.472	3.386	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CCN(C(=O)c2cccc(CC#N)c2)C1	ZINC000456330967	458637414	/nfs/dbraw/zinc/63/74/14/458637414.db2.gz	JSWBCCVJFHGXEY-GOSISDBHSA-N	0	3	347.462	3.347	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CCN(Cc2ccccc2)C[C@H](C)C1)OCC	ZINC000456338923	458638013	/nfs/dbraw/zinc/63/80/13/458638013.db2.gz	OPBXRBZQIYDERG-AZUAARDMSA-N	0	3	344.499	3.338	20	30		EGEDHN
Cc1cc(C)c(CNC(=O)C(C#N)Cc2ccc(C#N)cc2)c(C)c1	ZINC000470797365	458652074	/nfs/dbraw/zinc/65/20/74/458652074.db2.gz	SDZBJOGYRFLEGY-LJQANCHMSA-N	0	3	331.419	3.482	20	30		EGEDHN
Cc1ccccc1OC[C@@H](O)CN1CC=C(c2ccc(C#N)cc2)CC1	ZINC000502527202	458655329	/nfs/dbraw/zinc/65/53/29/458655329.db2.gz	FPIDJXPXWGGMCM-NRFANRHFSA-N	0	3	348.446	3.396	20	30		EGEDHN
C=C(C)CN(CCn1cnc2ccccc2c1=O)Cc1ccccc1	ZINC000470910993	458661622	/nfs/dbraw/zinc/66/16/22/458661622.db2.gz	NWTVFOSWSDBMQO-UHFFFAOYSA-N	0	3	333.435	3.475	20	30		EGEDHN
C=C(C)CN[C@@H](C)c1ccc(Br)cc1OCCCO	ZINC000463361991	458691741	/nfs/dbraw/zinc/69/17/41/458691741.db2.gz	QWWZTVWVRGEDLG-LBPRGKRZSA-N	0	3	328.250	3.437	20	30		EGEDHN
C=CCCCNC(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000503361841	458704143	/nfs/dbraw/zinc/70/41/43/458704143.db2.gz	NQSWSFNACCYYLG-SFHVURJKSA-N	0	3	333.476	3.342	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@H](C)N1CC[C@@H](COc2ccccc2)C1	ZINC000505862814	458748888	/nfs/dbraw/zinc/74/88/88/458748888.db2.gz	ONYNWISVUZMAGN-ZWKOTPCHSA-N	0	3	330.472	3.200	20	30		EGEDHN
C[C@@H](N[C@H](C)c1ccc(-c2ccncc2)cc1)C(=O)NC1(C#N)CCC1	ZINC000530337200	458749729	/nfs/dbraw/zinc/74/97/29/458749729.db2.gz	UNWFDOGZSKIQCY-HZPDHXFCSA-N	0	3	348.450	3.350	20	30		EGEDHN
CC(C)C(=O)NC1CCN(Cc2cccc(OCCCC#N)c2)CC1	ZINC000507144191	458752149	/nfs/dbraw/zinc/75/21/49/458752149.db2.gz	ONEXAYFBJLRJKO-UHFFFAOYSA-N	0	3	343.471	3.106	20	30		EGEDHN
C=C(C)CN(Cc1ccccc1)C(=O)N[C@@H]1CN(C2CC2)C[C@@H]1C	ZINC000472046305	458763499	/nfs/dbraw/zinc/76/34/99/458763499.db2.gz	BTGUHXWKANDLIW-QFBILLFUSA-N	0	3	327.472	3.257	20	30		EGEDHN
C=C[C@@H](C)NC(=O)N1CC[C@@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000464751908	458768784	/nfs/dbraw/zinc/76/87/84/458768784.db2.gz	MZSXEUFMYFKYMG-XLIONFOSSA-N	0	3	327.472	3.259	20	30		EGEDHN
C[C@@]1(CO)CCCN1Cc1cccc(OCc2ccccc2C#N)c1	ZINC000530443064	458769077	/nfs/dbraw/zinc/76/90/77/458769077.db2.gz	QIDPBLPXSMJLOK-NRFANRHFSA-N	0	3	336.435	3.484	20	30		EGEDHN
C=CCN(Cc1ccccc1N1CCN(CC)CC1)CC(F)(F)F	ZINC000511912630	458780719	/nfs/dbraw/zinc/78/07/19/458780719.db2.gz	QSNLDMQDLSLIJA-UHFFFAOYSA-N	0	3	341.421	3.379	20	30		EGEDHN
CN(CCN(C)C1CC1)c1nc2c(c(C#N)c1C#N)CCCCCC2	ZINC000530539762	458786133	/nfs/dbraw/zinc/78/61/33/458786133.db2.gz	JSRUFEANDGHKOA-UHFFFAOYSA-N	0	3	337.471	3.014	20	30		EGEDHN
C=C(CNC(=O)N[C@H](CN(C)C)c1ccc(F)cc1)c1ccccc1	ZINC000512677089	458787721	/nfs/dbraw/zinc/78/77/21/458787721.db2.gz	HLEMOZVLZDYLMB-LJQANCHMSA-N	0	3	341.430	3.441	20	30		EGEDHN
C[C@@H]1[C@H](Cc2ccccc2)CCN1CC(=O)NCc1ccc(C#N)cc1	ZINC000472349977	458789379	/nfs/dbraw/zinc/78/93/79/458789379.db2.gz	PHLCBJDNRIXULU-UTKZUKDTSA-N	0	3	347.462	3.128	20	30		EGEDHN
CS(=O)(=O)c1ccc(CN[C@@H]2CCCc3cc(C#N)ccc32)cc1	ZINC000516592137	458819801	/nfs/dbraw/zinc/81/98/01/458819801.db2.gz	WTRMYBQSIBRTCN-LJQANCHMSA-N	0	3	340.448	3.129	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1SC[C@H](F)CC	ZINC000440573448	458827720	/nfs/dbraw/zinc/82/77/20/458827720.db2.gz	GVMHJQAZGQMIBJ-CQSZACIVSA-N	0	3	326.485	3.333	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN1CCC(CCc2ccc(O)cc2)CC1	ZINC000517816771	458831976	/nfs/dbraw/zinc/83/19/76/458831976.db2.gz	AYXJRDBIRVGLSP-UHFFFAOYSA-N	0	3	342.483	3.237	20	30		EGEDHN
CCN(CCC#N)C(=O)CN[C@H]1CC(C)(C)CCc2ccccc21	ZINC000440619814	458833532	/nfs/dbraw/zinc/83/35/32/458833532.db2.gz	CKLMHIXEEKQHPJ-SFHVURJKSA-N	0	3	327.472	3.442	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](c2ccccc2)C(F)(F)F)CC1	ZINC000518024229	458838278	/nfs/dbraw/zinc/83/82/78/458838278.db2.gz	ZPHLFDSRTWPBAQ-HNNXBMFYSA-N	0	3	341.377	3.240	20	30		EGEDHN
COc1cc(CNC[C@@H](c2ccco2)N2CCCC2)ccc1C#N	ZINC000440810183	458856309	/nfs/dbraw/zinc/85/63/09/458856309.db2.gz	OIYMUGGKSWFKGH-KRWDZBQOSA-N	0	3	325.412	3.087	20	30		EGEDHN
C=C(C)Cn1c([C@H](C)CC)nnc1N1CC[C@H](N2CCCCC2)C1	ZINC000549693018	458883669	/nfs/dbraw/zinc/88/36/69/458883669.db2.gz	LQDACGJKWLFRSS-SJORKVTESA-N	0	3	331.508	3.432	20	30		EGEDHN
C=CC1CCN(C(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)CC1	ZINC000466523321	458903668	/nfs/dbraw/zinc/90/36/68/458903668.db2.gz	VYRDLFDBOHOKBT-APWZRJJASA-N	0	3	327.472	3.257	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@H]1CCCC[C@H]1NCc1ccc(C#N)cn1	ZINC000495707014	458925303	/nfs/dbraw/zinc/92/53/03/458925303.db2.gz	FNOPYKIQKUHLCE-NVXWUHKLSA-N	0	3	344.459	3.126	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)NCC(C)(C)CC#N)N(C)C)cc1	ZINC000457470258	458968435	/nfs/dbraw/zinc/96/84/35/458968435.db2.gz	GBVHRMKXZUCLQY-KRWDZBQOSA-N	0	3	330.476	3.091	20	30		EGEDHN
COC(=O)c1ccc(Cl)c(CNCCc2cccc(C#N)c2)c1	ZINC000467541933	458979339	/nfs/dbraw/zinc/97/93/39/458979339.db2.gz	HRHXIXWAZBRFFD-UHFFFAOYSA-N	0	3	328.799	3.331	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1	ZINC000467842091	458989376	/nfs/dbraw/zinc/98/93/76/458989376.db2.gz	PNKVTJOYGDUFRT-PZJWPPBQSA-N	0	3	344.499	3.477	20	30		EGEDHN
C=CC1CCN(C(=O)NC[C@H](c2ccc(CC)cc2)N(C)C)CC1	ZINC000476623877	459011643	/nfs/dbraw/zinc/01/16/43/459011643.db2.gz	IDXLDEZBXAHYDJ-LJQANCHMSA-N	0	3	329.488	3.459	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N[C@@H]1CN(C2CC2)C[C@@H]1C)c1ccc(F)c(F)c1	ZINC000477227247	459036648	/nfs/dbraw/zinc/03/66/48/459036648.db2.gz	YQBXDYUMNYSQMR-RZAIGCCYSA-N	0	3	349.425	3.364	20	30		EGEDHN
Cc1ccc([C@@H]2C[C@H](C)N([C@@H](C)C(=O)NC3(C#N)CCC3)C2)cc1	ZINC000567049873	459040490	/nfs/dbraw/zinc/04/04/90/459040490.db2.gz	CELFGAWMVKMTRC-XYJFISCASA-N	0	3	325.456	3.124	20	30		EGEDHN
N#CC1(NC(=O)CN[C@@H](Cc2ccccc2)c2cccs2)CCC1	ZINC000567301128	459081054	/nfs/dbraw/zinc/08/10/54/459081054.db2.gz	OGFIKXKMVXHCTH-INIZCTEOSA-N	0	3	339.464	3.184	20	30		EGEDHN
C#CC[C@H](CC(F)(F)F)N[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000496208295	459108810	/nfs/dbraw/zinc/10/88/10/459108810.db2.gz	URIAGXPQSCVTSI-CHWSQXEVSA-N	0	3	334.382	3.320	20	30		EGEDHN
CN1CCC[C@H](CNC(=O)c2cn(CCCC#N)c3ccccc23)C1	ZINC000577927204	459117662	/nfs/dbraw/zinc/11/76/62/459117662.db2.gz	JMSUWPDWQYANTL-MRXNPFEDSA-N	0	3	338.455	3.017	20	30		EGEDHN
C[C@H](CNC(=O)NC1(c2cccc(C#N)c2)CC1)N1CCCC[C@H]1C	ZINC000479387244	459137477	/nfs/dbraw/zinc/13/74/77/459137477.db2.gz	NPGCHCALTIYMOO-HZPDHXFCSA-N	0	3	340.471	3.109	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN(C(=O)C(C)(C)C)C1	ZINC000590603383	459159596	/nfs/dbraw/zinc/15/95/96/459159596.db2.gz	UIIHMRJZXFUUOA-GOSISDBHSA-N	0	3	327.472	3.275	20	30		EGEDHN
Cn1cc(CN2CCC(CCC#N)CC2)c(-c2ccc(C#N)cc2)n1	ZINC000567791283	459169397	/nfs/dbraw/zinc/16/93/97/459169397.db2.gz	MHHBTXPSYIPZLO-UHFFFAOYSA-N	0	3	333.439	3.475	20	30		EGEDHN
C=CCCSCCNCc1c[nH]nc1-c1ccc2c(c1)OCO2	ZINC000594959917	459193477	/nfs/dbraw/zinc/19/34/77/459193477.db2.gz	FYFQSBNNXCITOE-UHFFFAOYSA-N	0	3	331.441	3.204	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H]2CCC[C@@H]([S@](C)=O)C2)cc1OC	ZINC000594969486	459199514	/nfs/dbraw/zinc/19/95/14/459199514.db2.gz	ZTBZRXIVDHJEKJ-LNPFQXMTSA-N	0	3	337.485	3.039	20	30		EGEDHN
N#CCc1ccc(OC[C@@H](O)CN[C@@H](c2cccs2)C2CC2)cc1	ZINC000578538096	459220031	/nfs/dbraw/zinc/22/00/31/459220031.db2.gz	LNYNYQRNAIOIOE-QFBILLFUSA-N	0	3	342.464	3.295	20	30		EGEDHN
C=CCCS(=O)(=O)NCC(CC)(CC)N[C@@H](C)c1ccccc1	ZINC000480979379	459226205	/nfs/dbraw/zinc/22/62/05/459226205.db2.gz	MBHWDPPIXNCXKQ-INIZCTEOSA-N	0	3	338.517	3.392	20	30		EGEDHN
C=CCCS(=O)(=O)NCC1(N[C@@H](C)c2ccccc2)CCCC1	ZINC000481016313	459228467	/nfs/dbraw/zinc/22/84/67/459228467.db2.gz	STZOURRRZRSMNJ-INIZCTEOSA-N	0	3	336.501	3.146	20	30		EGEDHN
Cc1cc(C(C)(C)C)cc(C)c1CCNC(=O)[C@@H](N)CCCC#N	ZINC000580768262	459264488	/nfs/dbraw/zinc/26/44/88/459264488.db2.gz	HYXICQLQLURBSE-SFHVURJKSA-N	0	3	329.488	3.281	20	30		EGEDHN
C=CCc1ccc(OC[C@@H](O)CN2CC(C3CCCC3)C2)c(OC)c1	ZINC000481720391	459271356	/nfs/dbraw/zinc/27/13/56/459271356.db2.gz	SQVGPIPAZWMZDZ-IBGZPJMESA-N	0	3	345.483	3.285	20	30		EGEDHN
CCCCCC(=O)NC1CCN(CCc2ccc(C#N)cc2)CC1	ZINC000595298216	459271373	/nfs/dbraw/zinc/27/13/73/459271373.db2.gz	PAEQRTRTTBWJFG-UHFFFAOYSA-N	0	3	327.472	3.262	20	30		EGEDHN
C=CCCCCN1CC[C@@H](OC)C[C@@H]1CNC(=O)OC(C)(C)C	ZINC000496676021	459282371	/nfs/dbraw/zinc/28/23/71/459282371.db2.gz	BAYZXTHDRSTWBQ-HZPDHXFCSA-N	0	3	326.481	3.347	20	30		EGEDHN
C[C@@H](CCC#N)N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000496700136	459292542	/nfs/dbraw/zinc/29/25/42/459292542.db2.gz	JYANKIDXQCFVQY-FUHWJXTLSA-N	0	3	329.444	3.317	20	30		EGEDHN
CN(C)C(=O)OC1CCN(Cc2ccccc2C(C)(C)C#N)CC1	ZINC000496723829	459300907	/nfs/dbraw/zinc/30/09/07/459300907.db2.gz	VFEIHBNJCHPHTH-UHFFFAOYSA-N	0	3	329.444	3.150	20	30		EGEDHN
N#Cc1cc(Br)cnc1N[C@H]1CCN(C2CCCC2)C1	ZINC000560201414	459310308	/nfs/dbraw/zinc/31/03/08/459310308.db2.gz	BIYACRKEQIGBTP-ZDUSSCGKSA-N	0	3	335.249	3.145	20	30		EGEDHN
CC(C)(C)OC(=O)CC1(NCC#Cc2ccc(F)cc2)CCOCC1	ZINC000595540240	459339252	/nfs/dbraw/zinc/33/92/52/459339252.db2.gz	HYHPUMFNHKIQIT-UHFFFAOYSA-N	0	3	347.430	3.048	20	30		EGEDHN
N#C[C@@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cccc(CN)c1	ZINC000591309992	459350111	/nfs/dbraw/zinc/35/01/11/459350111.db2.gz	XVADPWPZDFUHQW-RBUKOAKNSA-N	0	3	334.423	3.449	20	30		EGEDHN
N#Cc1ccc2c(c1)CCN2C(=O)C1CCN(Cc2ccccc2)CC1	ZINC000591312464	459351329	/nfs/dbraw/zinc/35/13/29/459351329.db2.gz	UEPFBQOHUKKSGH-UHFFFAOYSA-N	0	3	345.446	3.360	20	30		EGEDHN
C[C@H](c1ccccc1)[C@H](CO)NC(=O)C(C#N)CCc1ccccc1	ZINC000591320259	459354416	/nfs/dbraw/zinc/35/44/16/459354416.db2.gz	YJSMRISYTGRTMQ-UXPWSPDFSA-N	0	3	336.435	3.040	20	30		EGEDHN
C[C@@]1(C#N)CCCN(C(=O)N[C@H](CN)c2ccc3ccccc3c2)C1	ZINC000591360002	459361621	/nfs/dbraw/zinc/36/16/21/459361621.db2.gz	BUTANVHFSXEQJN-QUCCMNQESA-N	0	3	336.439	3.175	20	30		EGEDHN
N#CCC[C@H](NC[C@@H](O)COc1ccccc1F)c1ccccc1	ZINC000561189942	459429298	/nfs/dbraw/zinc/42/92/98/459429298.db2.gz	BDHGYAJDSSJMGV-AEFFLSMTSA-N	0	3	328.387	3.200	20	30		EGEDHN
N#Cc1cc(N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)ccn1	ZINC000561228583	459432962	/nfs/dbraw/zinc/43/29/62/459432962.db2.gz	DGFRAHDZJJWMIG-INIZCTEOSA-N	0	3	346.356	3.080	20	30		EGEDHN
N#C[C@@H]1CC[C@H](N2CCC(CNC(=O)OCc3ccccc3)CC2)C1	ZINC000497101119	459438721	/nfs/dbraw/zinc/43/87/21/459438721.db2.gz	TZADVBRXBMZPTI-MOPGFXCFSA-N	0	3	341.455	3.317	20	30		EGEDHN
N#CC(C(=O)c1cnc2ccsc2c1)c1nnc2n1CCCCC2	ZINC000525284058	459441285	/nfs/dbraw/zinc/44/12/85/459441285.db2.gz	PGAGOVSREWQUHK-GFCCVEGCSA-N	0	3	337.408	3.104	20	30		EGEDHN
C=CCC[C@@H](C)Nc1ccc2nc(CCN3CCOCC3)[nH]c2c1	ZINC000541760324	459488106	/nfs/dbraw/zinc/48/81/06/459488106.db2.gz	HADFNJXBOQSDSB-OAHLLOKOSA-N	0	3	328.460	3.204	20	30		EGEDHN
C=CCCCCCN(C)CC(=O)N1CCO[C@@H](c2ccc(F)cc2)C1	ZINC000525787190	459492697	/nfs/dbraw/zinc/49/26/97/459492697.db2.gz	XIIDDVPCPYDQSX-LJQANCHMSA-N	0	3	348.462	3.404	20	30		EGEDHN
CN1CCC(CC(=O)N[C@@H](C#N)c2ccc(C(C)(C)C)cc2)CC1	ZINC000486237279	459493870	/nfs/dbraw/zinc/49/38/70/459493870.db2.gz	VUWDTPBTSRAKOR-SFHVURJKSA-N	0	3	327.472	3.397	20	30		EGEDHN
CN1CC[C@H](NC(=O)N2CCC(CCC#N)CC2)[C@H]1c1ccccc1	ZINC000591959959	459498289	/nfs/dbraw/zinc/49/82/89/459498289.db2.gz	KYNLPFSCLLYJCU-RBUKOAKNSA-N	0	3	340.471	3.157	20	30		EGEDHN
N#Cc1nc(NC[C@H](c2ccccc2)N2CCCC2)sc1Cl	ZINC000596052693	459502698	/nfs/dbraw/zinc/50/26/98/459502698.db2.gz	HFLIHFVBLZCEFO-CQSZACIVSA-N	0	3	332.860	3.339	20	30		EGEDHN
N#CC1(NC(=O)CNC2(c3cccc(Cl)c3)CCCC2)CCC1	ZINC000525885702	459511498	/nfs/dbraw/zinc/51/14/98/459511498.db2.gz	FKRVFMSXBDRYMJ-UHFFFAOYSA-N	0	3	331.847	3.261	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@@H](c1cccs1)N1CCCC1	ZINC000488561494	459547473	/nfs/dbraw/zinc/54/74/73/459547473.db2.gz	MISOGMLUNSHWEW-INIZCTEOSA-N	0	3	329.469	3.303	20	30		EGEDHN
CCc1nc(C#N)cc(N2C[C@H](C)N(Cc3ccccc3)C[C@H]2C)n1	ZINC000596176268	459549445	/nfs/dbraw/zinc/54/94/45/459549445.db2.gz	BWCUSRAXNHEZOQ-JKSUJKDBSA-N	0	3	335.455	3.010	20	30		EGEDHN
N#Cc1ccc([C@H](N[C@H]2CC[C@@H](Cc3ccccc3)C2)C(N)=O)cc1	ZINC000526121176	459551599	/nfs/dbraw/zinc/55/15/99/459551599.db2.gz	JWWCTKDKWIFAJQ-IHPCNDPISA-N	0	3	333.435	3.086	20	30		EGEDHN
Cc1cc(CNC[C@@H](O)COc2ccc(CC#N)cc2)ccc1Cl	ZINC000570157136	459552352	/nfs/dbraw/zinc/55/23/52/459552352.db2.gz	YXULYPWQCGHLCI-QGZVFWFLSA-N	0	3	344.842	3.244	20	30		EGEDHN
CCc1nc(C#N)cc(N2CCN(Cc3ccccc3)[C@@H](CC)C2)n1	ZINC000596191801	459556606	/nfs/dbraw/zinc/55/66/06/459556606.db2.gz	GJOANTFXPGIYRX-SFHVURJKSA-N	0	3	335.455	3.011	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1CN[C@H](C)c1ccc(Br)cn1	ZINC000562439550	459562008	/nfs/dbraw/zinc/56/20/08/459562008.db2.gz	UDDQKMUZCCGMMG-JMSVASOKSA-N	0	3	325.250	3.476	20	30		EGEDHN
C=CCc1ccc(OC[C@H](O)CN2CCCC[C@@H]2C=C)c(OC)c1	ZINC000489486442	459566330	/nfs/dbraw/zinc/56/63/30/459566330.db2.gz	YPDRDENQAYSAMO-ZWKOTPCHSA-N	0	3	331.456	3.204	20	30		EGEDHN
C=CCn1cccc1C(=O)NC(C)(C)CN(C)Cc1ccccc1	ZINC000489974998	459573670	/nfs/dbraw/zinc/57/36/70/459573670.db2.gz	ARTUQMMQURWFHH-UHFFFAOYSA-N	0	3	325.456	3.315	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Nc1cnn(C(C)C)c1)C(C)C	ZINC000572665657	459582124	/nfs/dbraw/zinc/58/21/24/459582124.db2.gz	XJMRZSJDZRVJTO-KRWDZBQOSA-N	0	3	333.480	3.284	20	30		EGEDHN
Cc1nc(OCCCN2CCCCC2)c(Br)cc1C#N	ZINC000596284643	459583545	/nfs/dbraw/zinc/58/35/45/459583545.db2.gz	DNEDQQRUINRRAQ-UHFFFAOYSA-N	0	3	338.249	3.279	20	30		EGEDHN
CC[C@H](N[C@H](C)c1cccc(C#N)c1)C(=O)NCc1cccs1	ZINC000592393962	459589954	/nfs/dbraw/zinc/58/99/54/459589954.db2.gz	LXGRPEHGBWYPOH-DYVFJYSZSA-N	0	3	327.453	3.365	20	30		EGEDHN
N#CC1(NC(=O)CN[C@@H](c2cccc(F)c2)C2CCCC2)CCC1	ZINC000527377913	459638498	/nfs/dbraw/zinc/63/84/98/459638498.db2.gz	FXZHNMLKUKKRSX-GOSISDBHSA-N	0	3	329.419	3.209	20	30		EGEDHN
CC(C)n1cc([C@@H](C)NCCC(=O)Nc2sccc2C#N)cn1	ZINC000543502936	459664493	/nfs/dbraw/zinc/66/44/93/459664493.db2.gz	BLZBSHJAGVHMDI-GFCCVEGCSA-N	0	3	331.445	3.077	20	30		EGEDHN
C#CCCN1CCC(NC(=O)/C=C/c2ccc(OCCC)cc2)CC1	ZINC000491905142	459684503	/nfs/dbraw/zinc/68/45/03/459684503.db2.gz	LUTWMPMBTPSSAI-DHZHZOJOSA-N	0	3	340.467	3.093	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)NCCN1CCCC[C@@H]1CC	ZINC000500864688	459699544	/nfs/dbraw/zinc/69/95/44/459699544.db2.gz	KMJPVMVIHUTPQN-SFHVURJKSA-N	0	3	345.487	3.315	20	30		EGEDHN
COC(=O)N1CCC[C@@H]([C@H](C)NCc2ccc(C#N)cc2Cl)C1	ZINC000492392068	459702477	/nfs/dbraw/zinc/70/24/77/459702477.db2.gz	RRBVJWXMLUEYSM-SWLSCSKDSA-N	0	3	335.835	3.168	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N[C@@H](CCO)c1ccccc1F	ZINC000592879437	459710521	/nfs/dbraw/zinc/71/05/21/459710521.db2.gz	AWXVOLKZTIUMPN-APWZRJJASA-N	0	3	340.398	3.138	20	30		EGEDHN
N#Cc1cccc(CCN[C@H](C(=O)N2CCCCC2)c2ccccc2)c1	ZINC000584369636	459720840	/nfs/dbraw/zinc/72/08/40/459720840.db2.gz	LHRPYTVHTRUDPU-NRFANRHFSA-N	0	3	347.462	3.444	20	30		EGEDHN
C[C@@H](NC[C@@H](O)COc1ccc(CC#N)cc1)c1ccccc1Cl	ZINC000573751496	459728896	/nfs/dbraw/zinc/72/88/96/459728896.db2.gz	LRKNCYDRFIKYOD-GDBMZVCRSA-N	0	3	344.842	3.497	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)/C=C\C1CCCC1	ZINC000493424815	459744915	/nfs/dbraw/zinc/74/49/15/459744915.db2.gz	SIWHHGWYWVLBJH-KHPPLWFESA-N	0	3	325.456	3.195	20	30		EGEDHN
N#Cc1ccc([C@H](N[C@@H]2CCC[C@@H]2Cc2ccccc2)C(N)=O)cc1	ZINC000493494762	459747342	/nfs/dbraw/zinc/74/73/42/459747342.db2.gz	AJQIALSSDGRKFT-AQNXPRMDSA-N	0	3	333.435	3.086	20	30		EGEDHN
CC(C)O[C@H]1CCCN(CCC(=O)Nc2ccc(C#N)c(Cl)c2)C1	ZINC000593055569	459758379	/nfs/dbraw/zinc/75/83/79/459758379.db2.gz	LXJJKTOZEVRQKY-INIZCTEOSA-N	0	3	349.862	3.430	20	30		EGEDHN
N#CC(C(=O)c1cnc2n1CCCC2)c1cc(C(F)(F)F)ccn1	ZINC000563937644	459769457	/nfs/dbraw/zinc/76/94/57/459769457.db2.gz	VXASLEQSIIUIKM-LLVKDONJSA-N	0	3	334.301	3.123	20	30		EGEDHN
C=C(C)CN1CCC(Nc2cc(COC)nc3ccc(F)cc32)CC1	ZINC000564558122	459774328	/nfs/dbraw/zinc/77/43/28/459774328.db2.gz	FJVSAXJKFMKELD-UHFFFAOYSA-N	0	3	343.446	3.395	20	30		EGEDHN
O[C@H](CNCC#Cc1ccccc1)CO[C@@H]1CCCc2ccccc21	ZINC000565475846	459784516	/nfs/dbraw/zinc/78/45/16/459784516.db2.gz	GUHULEGWVLWJBZ-IFMALSPDSA-N	0	3	335.447	3.083	20	30		EGEDHN
CCCN1CC[C@H](NC(=O)Nc2ccc(OC(C)(C)C)c(C#N)c2)C1	ZINC000596927587	459797468	/nfs/dbraw/zinc/79/74/68/459797468.db2.gz	JVHJKRHBLLVSRS-INIZCTEOSA-N	0	3	344.459	3.341	20	30		EGEDHN
N#Cc1ccc([C@H](N[C@@H]2CCC[C@@H](c3ccccc3)C2)C(N)=O)cc1	ZINC000574738979	459863379	/nfs/dbraw/zinc/86/33/79/459863379.db2.gz	GUVDXMXROXRJNH-AQNXPRMDSA-N	0	3	333.435	3.401	20	30		EGEDHN
CC1(C)CCC(O)(CNC(=O)C(C#N)CCc2ccccc2)CC1	ZINC000598338971	459870832	/nfs/dbraw/zinc/87/08/32/459870832.db2.gz	QSQMYTLUZXDPMD-QGZVFWFLSA-N	0	3	328.456	3.206	20	30		EGEDHN
CCCN1CC[C@@H](NC(=O)c2ccccc2-c2ccccc2C#N)C1	ZINC000598343762	459873437	/nfs/dbraw/zinc/87/34/37/459873437.db2.gz	XDDFLAQPIRISPW-QGZVFWFLSA-N	0	3	333.435	3.439	20	30		EGEDHN
C[C@@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccccc1-n1ccnn1	ZINC000586793827	459874939	/nfs/dbraw/zinc/87/49/39/459874939.db2.gz	CNRVHXLETHYSEV-KUHUBIRLSA-N	0	3	329.407	3.477	20	30		EGEDHN
C=CCC1(NC(=O)c2cccc(CN3CCCC3)c2)CCOCC1	ZINC000618247147	459938552	/nfs/dbraw/zinc/93/85/52/459938552.db2.gz	LLSFASNCYRFHAW-UHFFFAOYSA-N	0	3	328.456	3.138	20	30		EGEDHN
N#CCN1CCC(NCc2cc(Cl)ccc2OC(F)F)CC1	ZINC000609335158	459946004	/nfs/dbraw/zinc/94/60/04/459946004.db2.gz	WWIMMBVZMINKQL-UHFFFAOYSA-N	0	3	329.778	3.019	20	30		EGEDHN
CC(C)c1ccc(C(C)(C)NCC(=O)N[C@@](C)(C#N)C2CC2)cc1	ZINC000609358182	459949935	/nfs/dbraw/zinc/94/99/35/459949935.db2.gz	PAAGWGGMCYARIE-FQEVSTJZSA-N	0	3	327.472	3.443	20	30		EGEDHN
CN(CCCc1[nH]nc(N)c1C#N)Cc1c(Cl)oc2ccccc21	ZINC000598600599	459959323	/nfs/dbraw/zinc/95/93/23/459959323.db2.gz	VDSNJRZNZMHGLQ-UHFFFAOYSA-N	0	3	343.818	3.158	20	30		EGEDHN
Cc1c([C@H](C)NC[C@@H](O)CC(C)(C)C#N)cnn1-c1ccc(F)cc1	ZINC000598602071	459960725	/nfs/dbraw/zinc/96/07/25/459960725.db2.gz	KWDHRECJGYEKSN-GUYCJALGSA-N	0	3	344.434	3.271	20	30		EGEDHN
C[C@H](c1ccncc1)N1CCC(NC(=O)CCCCCC#N)CC1	ZINC000588654221	459961832	/nfs/dbraw/zinc/96/18/32/459961832.db2.gz	JKZZOIXDFXNZHU-MRXNPFEDSA-N	0	3	328.460	3.197	20	30		EGEDHN
CC(C)(C)OC(=O)CC[C@@H]1CCCCN1C[C@H](O)CC(C)(C)C#N	ZINC000598622133	459967159	/nfs/dbraw/zinc/96/71/59/459967159.db2.gz	LQKHBQYSWIFSQZ-JKSUJKDBSA-N	0	3	338.492	3.264	20	30		EGEDHN
C[C@H](CC1(C#N)CCOCC1)NC[C@@H](c1ccco1)N1CCCCC1	ZINC000602500308	459971730	/nfs/dbraw/zinc/97/17/30/459971730.db2.gz	YUVPDDCBVILHMO-MSOLQXFVSA-N	0	3	345.487	3.495	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1cc(Cl)c(Br)cc1F	ZINC000602526337	459983989	/nfs/dbraw/zinc/98/39/89/459983989.db2.gz	JSQFKGFVMODZOY-JTQLQIEISA-N	0	3	348.603	3.201	20	30		EGEDHN
C[C@@H](CNCc1cccc(C#N)n1)Oc1cccc(Br)c1	ZINC000602561572	459997346	/nfs/dbraw/zinc/99/73/46/459997346.db2.gz	SQJOSPHNSPSITF-LBPRGKRZSA-N	0	3	346.228	3.273	20	30		EGEDHN
N#Cc1cccc(CN[C@@H]2CCN(c3ccc(Cl)c(F)c3)C2)n1	ZINC000602575761	460004263	/nfs/dbraw/zinc/00/42/63/460004263.db2.gz	JLTGCIGYEIHONA-CQSZACIVSA-N	0	3	330.794	3.114	20	30		EGEDHN
C[C@H](CC1(C#N)CCOCC1)N[C@H](C)c1ccc([S@](C)=O)cc1	ZINC000602575152	460004464	/nfs/dbraw/zinc/00/44/64/460004464.db2.gz	CBDGJGWNANHKIO-WBPRFABPSA-N	0	3	334.485	3.174	20	30		EGEDHN
CC(C)C[C@H](C)Oc1cc(CNC[C@H](O)CC(C)(C)C#N)ccn1	ZINC000598720614	460005938	/nfs/dbraw/zinc/00/59/38/460005938.db2.gz	PXXGLYQVCWNYDM-DOTOQJQBSA-N	0	3	333.476	3.285	20	30		EGEDHN
CCOc1cccc(CNC[C@H](O)CC(C)(C)C#N)c1OC(F)F	ZINC000598724225	460007708	/nfs/dbraw/zinc/00/77/08/460007708.db2.gz	JPTOKKJJVBXSJS-CYBMUJFWSA-N	0	3	342.386	3.077	20	30		EGEDHN
Cc1ccc([C@H](CN[C@@H](C)CC2(C#N)CCOCC2)N2CCCC2)o1	ZINC000602585034	460010296	/nfs/dbraw/zinc/01/02/96/460010296.db2.gz	BNDJBLCMJXZWOT-WMZOPIPTSA-N	0	3	345.487	3.414	20	30		EGEDHN
C=CCn1c(CC)nnc1N(C)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000575908161	460030892	/nfs/dbraw/zinc/03/08/92/460030892.db2.gz	JXDUSPXFSHHNOG-GOSISDBHSA-N	0	3	339.487	3.127	20	30		EGEDHN
CN(Cc1cccc(OCc2ccccc2C#N)c1)C[C@@H](O)C1CC1	ZINC000589198212	460053090	/nfs/dbraw/zinc/05/30/90/460053090.db2.gz	SGTJQNQGURFGRM-OAQYLSRUSA-N	0	3	336.435	3.340	20	30		EGEDHN
N#CCCn1cc(CN2CC(c3ccccc3)C2)c(-c2ccncc2)n1	ZINC000602728810	460091548	/nfs/dbraw/zinc/09/15/48/460091548.db2.gz	PUXYVIPNQWADGO-UHFFFAOYSA-N	0	3	343.434	3.458	20	30		EGEDHN
CN(C)Cc1cccc(NC(=O)N[C@H]2CCc3cc(C#N)ccc32)c1	ZINC000618667682	460119361	/nfs/dbraw/zinc/11/93/61/460119361.db2.gz	HIQLTDBFWJKKJS-IBGZPJMESA-N	0	3	334.423	3.429	20	30		EGEDHN
CCOC(=O)c1sc(NC(=O)C(C)C(F)(F)F)c(C#N)c1C	ZINC000610387739	460139203	/nfs/dbraw/zinc/13/92/03/460139203.db2.gz	HJGVCEBLXRZTJC-ZETCQYMHSA-N	0	3	334.319	3.242	20	30		EGEDHN
C[C@@](CO)(NCCCSCC#N)c1cccc(C(F)(F)F)c1	ZINC000610409939	460145074	/nfs/dbraw/zinc/14/50/74/460145074.db2.gz	YJDSCTSMBOHGTN-AWEZNQCLSA-N	0	3	332.391	3.149	20	30		EGEDHN
C[C@@H](NC(=O)N1CCN(C2CCC2)C[C@@H](C)C1)c1cccc(C#N)c1	ZINC000589893153	460156961	/nfs/dbraw/zinc/15/69/61/460156961.db2.gz	LJHQUNVWAOZYIQ-HZPDHXFCSA-N	0	3	340.471	3.135	20	30		EGEDHN
C[C@@H](NC(=O)[C@@H](N)CCCCC#N)c1nc(-c2ccccc2)cs1	ZINC000594434794	460218122	/nfs/dbraw/zinc/21/81/22/460218122.db2.gz	TVAMQNMLIBIWOH-HIFRSBDPSA-N	0	3	342.468	3.399	20	30		EGEDHN
Cc1nc(C)c([C@H](C)N(C)C[C@@H](O)COc2ccccc2C#N)s1	ZINC000599295214	460220093	/nfs/dbraw/zinc/22/00/93/460220093.db2.gz	HNPYLGXHIRIGBD-XJKSGUPXSA-N	0	3	345.468	3.064	20	30		EGEDHN
COc1ccc2c(c1)C[C@@H](C(C)C)CN2C(=O)[C@@H](N)CCCCC#N	ZINC000594449809	460224965	/nfs/dbraw/zinc/22/49/65/460224965.db2.gz	OMSAVJSAZXAXEK-AEFFLSMTSA-N	0	3	343.471	3.268	20	30		EGEDHN
C[C@@H](NC[C@@H](O)CC1(C#N)CCOCC1)c1cc2ccccc2o1	ZINC000599358133	460237898	/nfs/dbraw/zinc/23/78/98/460237898.db2.gz	FABQCHHOBCIJEA-ZBFHGGJFSA-N	0	3	328.412	3.155	20	30		EGEDHN
C[C@H]1CCN(C(=O)Nc2ccnc(C#N)c2)CCN1Cc1ccccc1	ZINC000603131608	460249599	/nfs/dbraw/zinc/24/95/99/460249599.db2.gz	UMHAYHXARZNPMI-INIZCTEOSA-N	0	3	349.438	3.082	20	30		EGEDHN
Cc1ccc(CN2CC[C@@H](CN(C)c3cccc(C#N)n3)C2)s1	ZINC000603398877	460296600	/nfs/dbraw/zinc/29/66/00/460296600.db2.gz	CVTILWBPTGMBLR-HNNXBMFYSA-N	0	3	326.469	3.282	20	30		EGEDHN
Cc1ccc(CN2CC[C@H](CN(C)c3ccncc3C#N)C2)s1	ZINC000603400077	460298067	/nfs/dbraw/zinc/29/80/67/460298067.db2.gz	IXGSFAKINNSJQT-OAHLLOKOSA-N	0	3	326.469	3.282	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCCCCc2ccccc2)cc1	ZINC000619273083	460320114	/nfs/dbraw/zinc/32/01/14/460320114.db2.gz	ORIYWNFKYFPLEP-FQEVSTJZSA-N	0	3	331.419	3.380	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Nc1cccc(C#N)c1)C(C)C	ZINC000603645322	460330947	/nfs/dbraw/zinc/33/09/47/460330947.db2.gz	KBZIEEVWVQSDPI-SFHVURJKSA-N	0	3	326.444	3.378	20	30		EGEDHN
COc1cc(NC(=O)NC[C@H](C)N2CCCC[C@H]2C)c(F)cc1C#N	ZINC000599818713	460340971	/nfs/dbraw/zinc/34/09/71/460340971.db2.gz	ZDWMLMWOOWRHKH-OLZOCXBDSA-N	0	3	348.422	3.090	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2NCCNC(=O)c1ccccc1F	ZINC000611390898	460352286	/nfs/dbraw/zinc/35/22/86/460352286.db2.gz	JUXJEVGRFGRNIZ-IBGZPJMESA-N	0	3	337.398	3.094	20	30		EGEDHN
C[C@@H](C(=O)N(C)CCC#N)N1CCC[C@@H](c2cc3ccccc3[nH]2)C1	ZINC000603890044	460355454	/nfs/dbraw/zinc/35/54/54/460355454.db2.gz	MKHLCCQMPPOKEG-DOTOQJQBSA-N	0	3	338.455	3.108	20	30		EGEDHN
COc1cccc2c1OC[C@H](N[C@H](C)c1ccc(C#N)c(F)c1)C2	ZINC000611465651	460370454	/nfs/dbraw/zinc/37/04/54/460370454.db2.gz	YVTGMCWSSCZRHY-MLGOLLRUSA-N	0	3	326.371	3.360	20	30		EGEDHN
C[C@]1(C#N)CCCN(C(=O)NCCN2CCC3(CCCCC3)CC2)C1	ZINC000619661116	460406969	/nfs/dbraw/zinc/40/69/69/460406969.db2.gz	FZHMTSOMNYKIKS-LJQANCHMSA-N	0	3	346.519	3.368	20	30		EGEDHN
CCOC(=O)CC[C@@H]1CCCN(Cc2ccc(C#N)c(OC)c2)C1	ZINC000619674555	460409869	/nfs/dbraw/zinc/40/98/69/460409869.db2.gz	XKUYXSNKTCUXAM-HNNXBMFYSA-N	0	3	330.428	3.122	20	30		EGEDHN
Cc1ccccc1CN1CCCN(c2nc3ccccn3c2C#N)CC1	ZINC000611744304	460447689	/nfs/dbraw/zinc/44/76/89/460447689.db2.gz	AFXWFCXKQDOCOD-UHFFFAOYSA-N	0	3	345.450	3.227	20	30		EGEDHN
C[C@@]1(C#N)CCCN(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)C1	ZINC000612099460	460539519	/nfs/dbraw/zinc/53/95/19/460539519.db2.gz	XAGOUZHWKOITHC-ICSRJNTNSA-N	0	3	340.471	3.159	20	30		EGEDHN
N#CCc1ccccc1C(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000601179190	460741682	/nfs/dbraw/zinc/74/16/82/460741682.db2.gz	OIBLSRSSLGMUQD-LJQANCHMSA-N	0	3	333.435	3.147	20	30		EGEDHN
Cc1ccccc1[C@H]([C@@H](C)NC(=O)c1ccccc1CC#N)N(C)C	ZINC000601521823	460824265	/nfs/dbraw/zinc/82/42/65/460824265.db2.gz	XYYRUNUYDRYCPK-UZLBHIALSA-N	0	3	335.451	3.482	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N[C@@H]1CCO[C@H]1c1ccccc1	ZINC000601687881	460869746	/nfs/dbraw/zinc/86/97/46/460869746.db2.gz	BNEWMIAGMIERDW-ZCNNSNEGSA-N	0	3	334.419	3.405	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN(C)CCc1ccccc1	ZINC000613372092	460925821	/nfs/dbraw/zinc/92/58/21/460925821.db2.gz	IOSACQSCWPMMIF-HXUWFJFHSA-N	0	3	325.452	3.329	20	30		EGEDHN
OC[C@H]1CCCCCN1CC#Cc1ccc(OC(F)(F)F)cc1	ZINC000653783626	461857355	/nfs/dbraw/zinc/85/73/55/461857355.db2.gz	MUAUSKHRHMIITC-OAHLLOKOSA-N	0	3	327.346	3.174	20	30		EGEDHN
C=CCCn1cc(CNC[C@@H]2CCCN(C)[C@H]2c2cccs2)nn1	ZINC000657374870	462081363	/nfs/dbraw/zinc/08/13/63/462081363.db2.gz	TZQSZNONMNTDAM-MAUKXSAKSA-N	0	3	345.516	3.088	20	30		EGEDHN
C=CC[C@H]1CCCN([C@@H](C)C(=O)Nc2ccc(OC)c(OC)c2)C1	ZINC000661379968	462224826	/nfs/dbraw/zinc/22/48/26/462224826.db2.gz	KBYFYEVCJBGCOB-GJZGRUSLSA-N	0	3	332.444	3.319	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NC(=O)N(CCC)[C@H]1CCN(C)C1	ZINC000645550707	462370727	/nfs/dbraw/zinc/37/07/27/462370727.db2.gz	VIVKBQSXZZGWNG-MOPGFXCFSA-N	0	3	329.488	3.300	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1ccc(C(F)F)nc1)C(C)C	ZINC000654781579	462381283	/nfs/dbraw/zinc/38/12/83/462381283.db2.gz	IZNHTDLQGDHNCV-INIZCTEOSA-N	0	3	337.414	3.448	20	30		EGEDHN
C=CC(C)(C)CNC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000652232512	462483263	/nfs/dbraw/zinc/48/32/63/462483263.db2.gz	DWFXYSOKVAWZRU-GOSISDBHSA-N	0	3	329.488	3.410	20	30		EGEDHN
Cc1cc(NC(=O)N[C@@H](C)[C@H](c2ccccc2)N(C)C)ncc1C#N	ZINC000603113539	469269091	/nfs/dbraw/zinc/26/90/91/469269091.db2.gz	PNYHEEFHPJMCLT-KBXCAEBGSA-N	0	3	337.427	3.075	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCC(C)(C)c2ccc(F)cc2)CC1	ZINC000171733929	526432328	/nfs/dbraw/zinc/43/23/28/526432328.db2.gz	SVCXWPYBYOSEFG-UHFFFAOYSA-N	0	3	333.451	3.053	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](C)c2cccc(OC(C)C)c2)CC1	ZINC000171712319	526437269	/nfs/dbraw/zinc/43/72/69/526437269.db2.gz	ZPKUVCMJORTECB-INIZCTEOSA-N	0	3	345.487	3.484	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H]2CCOc3c(Cl)cccc32)CC1	ZINC000171723163	526438259	/nfs/dbraw/zinc/43/82/59/526438259.db2.gz	IEFMALMSCHLWAI-MRXNPFEDSA-N	0	3	349.862	3.113	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](CC)c2ccccc2OCC)CC1	ZINC000171731242	526439023	/nfs/dbraw/zinc/43/90/23/526439023.db2.gz	RNLBBSLAJORTFB-GOSISDBHSA-N	0	3	345.487	3.486	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(-c3cccc(Cl)c3)on2)CC1	ZINC000171721320	526446465	/nfs/dbraw/zinc/44/64/65/526446465.db2.gz	QPSZABXJTQLYEP-UHFFFAOYSA-N	0	3	345.830	3.375	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)CC1	ZINC000171720523	526447946	/nfs/dbraw/zinc/44/79/46/526447946.db2.gz	SOVBYMVJKHIIKL-UHFFFAOYSA-N	0	3	345.443	3.273	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@@H](C)N[C@@H](C)c1ccc(-n2cccn2)cc1	ZINC000174370459	526537958	/nfs/dbraw/zinc/53/79/58/526537958.db2.gz	UGJFIQOVRQAXRJ-DLBZAZTESA-N	0	3	340.471	3.336	20	30		EGEDHN
C[C@@H](NCCOc1ccc(C#N)cc1)c1ccc([S@](C)=O)cc1	ZINC000090107612	546653105	/nfs/dbraw/zinc/65/31/05/546653105.db2.gz	NKHOGFCOSPWDQP-QKFKETGDSA-N	0	3	328.437	3.025	20	30		EGEDHN
C=C[C@H](C)NCc1ccc(OCC(=O)N2CCCCC2)c(OCC)c1	ZINC000153691053	546882865	/nfs/dbraw/zinc/88/28/65/546882865.db2.gz	MUPSKZMGQWTCRO-INIZCTEOSA-N	0	3	346.471	3.141	20	30		EGEDHN
N#C[C@@H]1CCC[C@@H](N[C@@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)C1	ZINC000329574614	547501319	/nfs/dbraw/zinc/50/13/19/547501319.db2.gz	ASLSDXNCHDDJFD-JHJVBQTASA-N	0	3	335.810	3.256	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2C[C@@H](C(F)(F)F)CC[C@H]2C)CC1	ZINC000679490746	549719901	/nfs/dbraw/zinc/71/99/01/549719901.db2.gz	UZYTWMFNLCRDOZ-OLZOCXBDSA-N	0	3	333.398	3.009	20	30		EGEDHN
C=CCN1CC[C@@H](N(C)CCCc2ccc(C(F)(F)F)cc2)C1=O	ZINC000685004195	550392987	/nfs/dbraw/zinc/39/29/87/550392987.db2.gz	JRQOBXHLHSJTGK-MRXNPFEDSA-N	0	3	340.389	3.357	20	30		EGEDHN
C=CCCOC(=O)C1CCN(c2cc(Cl)ccc2Cl)C1=O	ZINC000729074383	574811099	/nfs/dbraw/zinc/81/10/99/574811099.db2.gz	WUSCLAHIWOQMJK-NSHDSACASA-N	0	3	328.195	3.466	20	30		EGEDHN
C#CCCN1CCC(NC(=O)CC23CC4CC(CC(C4)C2)C3)CC1	ZINC000740737720	574812030	/nfs/dbraw/zinc/81/20/30/574812030.db2.gz	UMITYMJWHQDZHI-UHFFFAOYSA-N	0	3	328.500	3.197	20	30		EGEDHN
C=CCc1cc(CNCc2c(O)cccc2OC)cc(OC)c1OC	ZINC000729683454	574878876	/nfs/dbraw/zinc/87/88/76/574878876.db2.gz	PRFGWAVMTRADJG-UHFFFAOYSA-N	0	3	343.423	3.436	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H](C)c2csc3ccccc32)CC1	ZINC000729961701	574898879	/nfs/dbraw/zinc/89/88/79/574898879.db2.gz	QXRPIGVZFDFTQM-CQSZACIVSA-N	0	3	326.465	3.424	20	30		EGEDHN
C#CCOc1ccccc1CNC[C@@H](O)c1c(F)cccc1Cl	ZINC000741254715	575010100	/nfs/dbraw/zinc/01/01/00/575010100.db2.gz	CYOQHQWCYHQVBA-MRXNPFEDSA-N	0	3	333.790	3.314	20	30		EGEDHN
N#CCSc1ccccc1C(=O)N1CC[C@@H](N2CCCCC2)C1	ZINC000730795126	575021133	/nfs/dbraw/zinc/02/11/33/575021133.db2.gz	FXJIURBTYHTOCW-OAHLLOKOSA-N	0	3	329.469	3.003	20	30		EGEDHN
CN(C)CCNC(=S)Nc1ccc(Oc2cccc(C#N)c2)cc1	ZINC000731317506	575065257	/nfs/dbraw/zinc/06/52/57/575065257.db2.gz	GTVVFCYNJMJWMM-UHFFFAOYSA-N	0	3	340.452	3.199	20	30		EGEDHN
CC[C@@H](C#N)Oc1cccc(CNCc2c(O)cccc2OC)c1	ZINC000733800372	575397991	/nfs/dbraw/zinc/39/79/91/575397991.db2.gz	OGWWLAPUEHTZRF-HNNXBMFYSA-N	0	3	326.396	3.372	20	30		EGEDHN
C=CC[C@@H](NC(=O)NCCN1CCCC[C@H]1CC)c1ccncc1	ZINC000734678857	575541004	/nfs/dbraw/zinc/54/10/04/575541004.db2.gz	JGYDGFWPFOVKIR-QZTJIDSGSA-N	0	3	330.476	3.263	20	30		EGEDHN
COc1ccc(C(C)N=Nc2cccnn2)cc1CN1CCCCC1	ZINC000735977236	575746338	/nfs/dbraw/zinc/74/63/38/575746338.db2.gz	WAJBBHQZVCIPDD-UHFFFAOYSA-N	0	3	339.443	3.307	20	30		EGEDHN
CC[C@@H](C#N)Oc1cccc(CNC(=O)[C@H](CC)N(CC)CC)c1	ZINC000736018430	575752152	/nfs/dbraw/zinc/75/21/52/575752152.db2.gz	BXADCNRQMFPYTG-WMZOPIPTSA-N	0	3	331.460	3.104	20	30		EGEDHN
N#Cc1cccc(OCC(=O)N(CCN2CCCC2)c2ccccc2)c1	ZINC000739648121	576438256	/nfs/dbraw/zinc/43/82/56/576438256.db2.gz	BOFLBSHBZUCYPJ-UHFFFAOYSA-N	0	3	349.434	3.066	20	30		EGEDHN
C=CCCCCCN(C)C(=O)NC1CCN(C[C@H]2CCCO2)CC1	ZINC000740480722	576587099	/nfs/dbraw/zinc/58/70/99/576587099.db2.gz	DUKQAPMDXIVGHI-GOSISDBHSA-N	0	3	337.508	3.018	20	30		EGEDHN
C#CCOc1ccc(C(=O)Nc2cc(CN(C)C)ccc2OC)cc1	ZINC000741535509	576697798	/nfs/dbraw/zinc/69/77/98/576697798.db2.gz	WKCRWLTVJRMRCQ-UHFFFAOYSA-N	0	3	338.407	3.021	20	30		EGEDHN
C[C@@H]1CCCN(Cc2cc(=O)n3c4ccccc4[nH]c3c2C#N)[C@@H]1C	ZINC000741790092	576721980	/nfs/dbraw/zinc/72/19/80/576721980.db2.gz	BFNMHFNSWOOBDO-FMKPAKJESA-N	0	3	334.423	3.344	20	30		EGEDHN
C[C@@H]1CCCN1CCNC(=O)c1ccccc1-c1ccccc1C#N	ZINC000742239010	576761009	/nfs/dbraw/zinc/76/10/09/576761009.db2.gz	CIGRADWHXKMBRJ-MRXNPFEDSA-N	0	3	333.435	3.439	20	30		EGEDHN
C#CCOc1ccc(CNCc2cnc(C)n2-c2ccccc2)cc1	ZINC000742709922	576793827	/nfs/dbraw/zinc/79/38/27/576793827.db2.gz	WJNIVJRIHQOHID-UHFFFAOYSA-N	0	3	331.419	3.483	20	30		EGEDHN
N#Cc1cccc([C@H](NCc2ccc(C[NH+]3CCCC3)cc2)C(=O)[O-])c1	ZINC000833076159	601298790	/nfs/dbraw/zinc/29/87/90/601298790.db2.gz	RBTLECQMQOPABH-FQEVSTJZSA-N	0	3	349.434	3.070	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@@H](C)SCc1ccccc1	ZINC000049252951	1291624949	/nfs/dbraw/zinc/62/49/49/1291624949.db2.gz	NNIHSWOGCGFHOE-GDBMZVCRSA-N	0	3	332.469	3.324	20	30		EGEDHN
C#Cc1cccc(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)c1	ZINC000062383536	1291987845	/nfs/dbraw/zinc/98/78/45/1291987845.db2.gz	MOTKBUDHODFSLF-UHFFFAOYSA-N	0	3	339.414	3.403	20	30		EGEDHN
CC(C)(C)C(=O)NCC(=O)C(C#N)c1nc2cc(Cl)ccc2s1	ZINC000076606958	1292433329	/nfs/dbraw/zinc/43/33/29/1292433329.db2.gz	JDUBZKPHXLUVSY-SNVBAGLBSA-N	0	3	349.843	3.288	20	30		EGEDHN
Cc1cc(CN[C@@H](C)c2ccc(N3CCNC3=O)cc2)ccc1C#N	ZINC000829750793	1292614143	/nfs/dbraw/zinc/61/41/43/1292614143.db2.gz	DMVAAINNEOGOEU-HNNXBMFYSA-N	0	3	334.423	3.247	20	30		EGEDHN
C#Cc1cncc(C(=O)N(C)C[C@H]2CCCCN2Cc2ccccc2)c1	ZINC000830969936	1292791696	/nfs/dbraw/zinc/79/16/96/1292791696.db2.gz	KDQGGIPPMGXITA-OAQYLSRUSA-N	0	3	347.462	3.190	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)CCCC(=O)C2CC2)cc1	ZINC000835062520	1293196592	/nfs/dbraw/zinc/19/65/92/1293196592.db2.gz	PICXGTHBHHWNPT-MRXNPFEDSA-N	0	3	326.396	3.046	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)[C@H](C)OCC2CC2)cc1	ZINC000120260449	1293313193	/nfs/dbraw/zinc/31/31/93/1293313193.db2.gz	VVRRZGTUNGKWTM-KSSFIOAISA-N	0	3	342.439	3.492	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)C[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000121770042	1293388911	/nfs/dbraw/zinc/38/89/11/1293388911.db2.gz	MMFCVFSWYCGTRM-BXUZGUMPSA-N	0	3	340.345	3.432	20	30		EGEDHN
COc1ccc(Cl)cc1CC(=O)C(C#N)C(=O)NC1CCCCC1	ZINC000127323590	1293559695	/nfs/dbraw/zinc/55/96/95/1293559695.db2.gz	ORMQMVDVPBRXJB-HNNXBMFYSA-N	0	3	348.830	3.049	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)c2sc(C)nc2C)cc1	ZINC000128414182	1293591970	/nfs/dbraw/zinc/59/19/70/1293591970.db2.gz	QJUWEPMLEZJLLT-AWEZNQCLSA-N	0	3	327.409	3.284	20	30		EGEDHN
Cc1ccsc1CCCC(=O)C(C#N)C(=O)NCc1ccccc1	ZINC000129408727	1293623438	/nfs/dbraw/zinc/62/34/38/1293623438.db2.gz	RWAMFDCIBHCTTK-MRXNPFEDSA-N	0	3	340.448	3.405	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)CCCc1cccs1	ZINC000129842899	1293635966	/nfs/dbraw/zinc/63/59/66/1293635966.db2.gz	BETPFRUXGQVTFV-CQSZACIVSA-N	0	3	342.420	3.427	20	30		EGEDHN
C[C@H](CC(=O)C(C#N)C(=O)Nc1ccccn1)c1ccc(F)cc1F	ZINC000152703953	1293981880	/nfs/dbraw/zinc/98/18/80/1293981880.db2.gz	FMKFWKIFMYHKQN-RISCZKNCSA-N	0	3	343.333	3.201	20	30		EGEDHN
C#CCOc1ccc(Br)cc1CNCC(C)(C)OCC	ZINC000159297926	1294231889	/nfs/dbraw/zinc/23/18/89/1294231889.db2.gz	ONGXLBUIZOIYEU-UHFFFAOYSA-N	0	3	340.261	3.366	20	30		EGEDHN
CCOCCC(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000176094012	1294590446	/nfs/dbraw/zinc/59/04/46/1294590446.db2.gz	GFYBCNNUPDBHNC-SNVBAGLBSA-N	0	3	329.183	3.067	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)C(=O)N1CCCC1)Cc1ccc(Cl)cc1	ZINC000179787930	1294827728	/nfs/dbraw/zinc/82/77/28/1294827728.db2.gz	NHLLIZXKHNIZQP-CJNGLKHVSA-N	0	3	332.831	3.240	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)C[C@H]2CCCO2)cc1	ZINC000193451797	1295870454	/nfs/dbraw/zinc/87/04/54/1295870454.db2.gz	AYBGQSLYQGATBO-IAGOWNOFSA-N	0	3	328.412	3.246	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(Cl)cc1Cl)C(=O)c1cccnc1	ZINC000193465239	1295873133	/nfs/dbraw/zinc/87/31/33/1295873133.db2.gz	MZTMXGAJOWVRJD-NSHDSACASA-N	0	3	334.162	3.350	20	30		EGEDHN
CCNC(=O)c1ccc(CNCc2ccc(O[C@@H](C)C#N)cc2)cc1	ZINC000236960259	1296213858	/nfs/dbraw/zinc/21/38/58/1296213858.db2.gz	MXYFGHWXHKJJMD-HNNXBMFYSA-N	0	3	337.423	3.017	20	30		EGEDHN
COCCOc1ccc(CNCc2ccc(O[C@@H](C)C#N)cc2)cc1	ZINC000237151605	1296222809	/nfs/dbraw/zinc/22/28/09/1296222809.db2.gz	FLOVMISWEGBDNG-INIZCTEOSA-N	0	3	340.423	3.292	20	30		EGEDHN
Fc1ccc(CCN2CCC(=NOCc3cccnc3)CC2)cc1	ZINC000746585815	1298619182	/nfs/dbraw/zinc/61/91/82/1298619182.db2.gz	LMFSUFYXNXHUQN-UHFFFAOYSA-N	0	3	327.403	3.432	20	30		EGEDHN
N#Cc1csc(CNC[C@@H](O)c2ccccc2C(F)(F)F)c1	ZINC000748099494	1298929604	/nfs/dbraw/zinc/92/96/04/1298929604.db2.gz	RJHBPRFONQBURP-CQSZACIVSA-N	0	3	326.343	3.462	20	30		EGEDHN
C=C(Cl)C[C@H](N)C(=O)N1CCC[C@@H]1c1nc2cc(C)ccc2[nH]1	ZINC000876875801	1299046384	/nfs/dbraw/zinc/04/63/84/1299046384.db2.gz	AZGYFAFCQXNTAZ-SWLSCSKDSA-N	0	3	332.835	3.005	20	30		EGEDHN
CC[C@H](C#N)Oc1cc(CNCc2ccc(CO)cc2)ccc1OC	ZINC000877029542	1299119622	/nfs/dbraw/zinc/11/96/22/1299119622.db2.gz	GSBKWULRFMJNFI-GOSISDBHSA-N	0	3	340.423	3.158	20	30		EGEDHN
CCCN(Cc1ccnc(C#N)c1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000749513364	1299229246	/nfs/dbraw/zinc/22/92/46/1299229246.db2.gz	CKJDEPOXNUXLAR-QGZVFWFLSA-N	0	3	344.459	3.175	20	30		EGEDHN
CC1(C)CN(CC(=O)C(C#N)c2nc3ccccc3s2)CCS1	ZINC000751494844	1299557354	/nfs/dbraw/zinc/55/73/54/1299557354.db2.gz	RCOCTQORRSHRLL-LBPRGKRZSA-N	0	3	345.493	3.300	20	30		EGEDHN
CO[C@@H]1C[C@@H](N[C@H](C)C(=O)N(CCC#N)c2ccc(C)cc2)C1(C)C	ZINC000753159066	1299885866	/nfs/dbraw/zinc/88/58/66/1299885866.db2.gz	WUBDAANOQIZNCN-KBAYOESNSA-N	0	3	343.471	3.033	20	30		EGEDHN
CC(=O)[C@@](C#N)(CCN1CCC([C@@H]2CCOC2)CC1)c1ccccc1	ZINC000878403152	1299976308	/nfs/dbraw/zinc/97/63/08/1299976308.db2.gz	VTPSOBHHXUSQHO-CTNGQTDRSA-N	0	3	340.467	3.176	20	30		EGEDHN
C[C@@H]([NH2+][C@H](C)c1ccccc1[O-])C(=O)N(CCC#N)c1ccccc1	ZINC000879648357	1300648001	/nfs/dbraw/zinc/64/80/01/1300648001.db2.gz	LJMDKVYHJCYXEL-HZPDHXFCSA-N	0	3	337.423	3.378	20	30		EGEDHN
CC[C@@H]1CC[C@H](C(=O)C(C#N)C(=O)Nc2cccc3ccccc32)O1	ZINC000757307770	1300664794	/nfs/dbraw/zinc/66/47/94/1300664794.db2.gz	XZRWCCRFRHIKDH-QGPMSJSTSA-N	0	3	336.391	3.445	20	30		EGEDHN
C#CC[C@H](NC(=O)N1CCN(C2CCCCC2)CC1)c1ccccc1	ZINC000757766648	1300726827	/nfs/dbraw/zinc/72/68/27/1300726827.db2.gz	CGFRYUVZFFAGNU-FQEVSTJZSA-N	0	3	339.483	3.411	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cccc(O[C@H](C)CC)n2)CC1	ZINC000880895148	1301319647	/nfs/dbraw/zinc/31/96/47/1301319647.db2.gz	UXJIYCTVPQPDRX-CQSZACIVSA-N	0	3	332.448	3.031	20	30		EGEDHN
C#C[C@H](NC1CC(c2cccc(Br)c2)C1)[C@H]1CCCO1	ZINC000762619694	1301714918	/nfs/dbraw/zinc/71/49/18/1301714918.db2.gz	CIFRABJJEJXCJW-MHVXSEJMSA-N	0	3	334.257	3.466	20	30		EGEDHN
C[C@H]1C[C@@H](Nc2nccc(Oc3cccc(C#N)c3)n2)CN1C1CC1	ZINC000882073738	1301815519	/nfs/dbraw/zinc/81/55/19/1301815519.db2.gz	UGQMJUQASYRHEX-DZGCQCFKSA-N	0	3	335.411	3.178	20	30		EGEDHN
C=CCOc1cccc(CNCc2ccc(N3CCNC3=O)cc2)c1	ZINC000883282536	1302360076	/nfs/dbraw/zinc/36/00/76/1302360076.db2.gz	WRMRPWLJZDADPA-UHFFFAOYSA-N	0	3	337.423	3.071	20	30		EGEDHN
N#C[C@@H]1CNCC12CC(C(=O)N1CCC[C@H]1CC1CCCCC1)C2	ZINC000884110469	1302738233	/nfs/dbraw/zinc/73/82/33/1302738233.db2.gz	LERQDXWVWJKIIW-NNVNDSJASA-N	0	3	329.488	3.087	20	30		EGEDHN
CSC[C@H]1CCCN1CC(=O)C(C#N)c1nc2ccccc2s1	ZINC000767905495	1302780985	/nfs/dbraw/zinc/78/09/85/1302780985.db2.gz	HJXKHEDSDRKHDU-CHWSQXEVSA-N	0	3	345.493	3.300	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)[C@H](F)c1ccccc1	ZINC000769285454	1303084922	/nfs/dbraw/zinc/08/49/22/1303084922.db2.gz	ZUUBGFAUJWBWLS-XJKSGUPXSA-N	0	3	326.327	3.053	20	30		EGEDHN
C#C[C@H](C)N(C)C[C@H](O)CO[C@@H](c1ccccc1)c1ccc(C)cc1	ZINC000769962187	1303198712	/nfs/dbraw/zinc/19/87/12/1303198712.db2.gz	BZRYUILZZACUQG-NYVOZVTQSA-N	0	3	337.463	3.415	20	30		EGEDHN
COc1cc(Cl)c(C)cc1NC(=O)C(C#N)C(=O)C=CSC	ZINC000771581989	1303422965	/nfs/dbraw/zinc/42/29/65/1303422965.db2.gz	IDLYYPLFVKOSCD-LWTINBJPSA-N	0	3	338.816	3.181	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](O)c2cccc(Br)c2)c(F)c1	ZINC000772929757	1303596772	/nfs/dbraw/zinc/59/67/72/1303596772.db2.gz	VYWNVNNKEGAOLQ-MRXNPFEDSA-N	0	3	349.203	3.283	20	30		EGEDHN
C=C(Cl)COc1ccc([C@H](C)N[C@H]2CC(=O)N(C(C)C)C2)cc1	ZINC000773008629	1303606341	/nfs/dbraw/zinc/60/63/41/1303606341.db2.gz	WNCYHUDSMHXHCF-HOCLYGCPSA-N	0	3	336.863	3.478	20	30		EGEDHN
C#CC[C@H](N[C@H](C)c1cccc(NS(C)(=O)=O)c1)c1ccccc1	ZINC000773117745	1303628300	/nfs/dbraw/zinc/62/83/00/1303628300.db2.gz	VZPAMPWXCFALSP-BEFAXECRSA-N	0	3	342.464	3.473	20	30		EGEDHN
COc1cc2c(cc1O)CCN(CCCOc1ccc(C#N)cc1)C2	ZINC000887105145	1303678170	/nfs/dbraw/zinc/67/81/70/1303678170.db2.gz	IODOMBGSKXPHFR-UHFFFAOYSA-N	0	3	338.407	3.100	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(C[NH2+]Cc2nnc(-c3ccccc3)[n-]2)cc1	ZINC000774816222	1303862213	/nfs/dbraw/zinc/86/22/13/1303862213.db2.gz	VLRLDTJLOKUKKS-AWEZNQCLSA-N	0	3	333.395	3.052	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2NCc1ccc(-n2ccnc2)nc1	ZINC000775365877	1303947450	/nfs/dbraw/zinc/94/74/50/1303947450.db2.gz	ZMKYWZIAUMCTBJ-LJQANCHMSA-N	0	3	329.407	3.306	20	30		EGEDHN
CC(C)[C@H](NCC(=O)NCCC#N)c1ccc(C(F)(F)F)cc1	ZINC000775537716	1303981036	/nfs/dbraw/zinc/98/10/36/1303981036.db2.gz	CZFVXQFJLZLMLZ-HNNXBMFYSA-N	0	3	327.350	3.022	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN1CCC(c2ccc(N(C)C)cc2)CC1	ZINC000775883792	1304055619	/nfs/dbraw/zinc/05/56/19/1304055619.db2.gz	XJWAUFVPEBPOBF-UHFFFAOYSA-N	0	3	341.499	3.133	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CNCCCOC[C@@H]1CCCO1	ZINC000778150696	1304403025	/nfs/dbraw/zinc/40/30/25/1304403025.db2.gz	BCEGQNVJDKYQAD-HNNXBMFYSA-N	0	3	337.847	3.027	20	30		EGEDHN
C=CC[C@H](CO)C[NH2+][C@@H](C)c1cc(Br)cc(C)c1[O-]	ZINC000779040725	1304521816	/nfs/dbraw/zinc/52/18/16/1304521816.db2.gz	KNRPOGGGOMLAKF-RYUDHWBXSA-N	0	3	328.250	3.298	20	30		EGEDHN
C[C@H](CN(Cc1ccc(C#N)cc1)C1CC1)NC(=O)OC(C)(C)C	ZINC000785445322	1305351625	/nfs/dbraw/zinc/35/16/25/1305351625.db2.gz	PTPTYNNYBFPPQB-CQSZACIVSA-N	0	3	329.444	3.436	20	30		EGEDHN
CCCCCCCCCN1CCC[C@@H](N2CCCS2(=O)=O)C1	ZINC000789374377	1306149664	/nfs/dbraw/zinc/14/96/64/1306149664.db2.gz	LYECIEPMXTUPCA-QGZVFWFLSA-N	0	3	330.538	3.237	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)c2ccc(C)c(C)c2)C1	ZINC001021007257	1318041471	/nfs/dbraw/zinc/04/14/71/1318041471.db2.gz	LRWTUMOJGKPYGP-SHTZXODSSA-N	0	3	337.261	3.062	20	30		EGEDHN
COc1ccc(C2=NO[C@H](CN[C@@H](C)CC(C)(C)C#N)C2)cc1F	ZINC000895977429	1309623715	/nfs/dbraw/zinc/62/37/15/1309623715.db2.gz	NVYCRSCNOFARNY-JSGCOSHPSA-N	0	3	333.407	3.245	20	30		EGEDHN
C[C@H](CC(C)(C)C#N)NC[C@@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000895980292	1309627459	/nfs/dbraw/zinc/62/74/59/1309627459.db2.gz	SWWGLSFZOADBFG-CJNGLKHVSA-N	0	3	327.428	3.032	20	30		EGEDHN
N#Cc1ccc2c(c1)CCCC[C@@H]2NCC(=O)NCc1ccccc1	ZINC000795784259	1309833235	/nfs/dbraw/zinc/83/32/35/1309833235.db2.gz	MBORBQLGUVSRTL-FQEVSTJZSA-N	0	3	333.435	3.232	20	30		EGEDHN
N#CC(C(=O)CCSCc1ccccc1)C(=O)Nc1ccccn1	ZINC000796656418	1310057885	/nfs/dbraw/zinc/05/78/85/1310057885.db2.gz	WEBPAIQFHLJFLO-HNNXBMFYSA-N	0	3	339.420	3.052	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)C1CC(c2ccc(F)cc2)C1	ZINC000796739728	1310076481	/nfs/dbraw/zinc/07/64/81/1310076481.db2.gz	FDDHFGSKPMATIG-DQPZFDDXSA-N	0	3	330.403	3.335	20	30		EGEDHN
N#Cc1ccc(NCCNCc2cc(C(F)(F)F)ccc2F)nc1	ZINC000897398616	1310321225	/nfs/dbraw/zinc/32/12/25/1310321225.db2.gz	KEXGXDWQSCUMST-UHFFFAOYSA-N	0	3	338.308	3.313	20	30		EGEDHN
C=CCN1CC[C@H](N2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)C1=O	ZINC000799164515	1310496911	/nfs/dbraw/zinc/49/69/11/1310496911.db2.gz	KSRMSOYSXZRIET-ZBFHGGJFSA-N	0	3	338.373	3.282	20	30		EGEDHN
Cc1ccc(C(=O)N(CCN(C)C)Cc2ccc(F)cc2)cc1C#N	ZINC000799338241	1310529244	/nfs/dbraw/zinc/52/92/44/1310529244.db2.gz	ZFQNADMNVKQPJX-UHFFFAOYSA-N	0	3	339.414	3.210	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc1C#N	ZINC000799686029	1310600300	/nfs/dbraw/zinc/60/03/00/1310600300.db2.gz	NPXLINVTKZHODO-OXQOHEQNSA-N	0	3	333.435	3.260	20	30		EGEDHN
CCOC(=O)Oc1ccc(C(=O)C(C#N)c2cc(C)nc(C)n2)cc1	ZINC000800384942	1310747722	/nfs/dbraw/zinc/74/77/22/1310747722.db2.gz	NJSQGUSQHJKASF-OAHLLOKOSA-N	0	3	339.351	3.119	20	30		EGEDHN
CC#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)OC(C)(C)C)C1	ZINC000800485389	1310768761	/nfs/dbraw/zinc/76/87/61/1310768761.db2.gz	IROCPOMUHJCYAA-ZWKOTPCHSA-N	0	3	328.456	3.393	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H](NCc2ccc(C#N)c(Cl)c2)C1	ZINC000800895884	1310830637	/nfs/dbraw/zinc/83/06/37/1310830637.db2.gz	OAFUSSNRRIVPRU-AWEZNQCLSA-N	0	3	335.835	3.311	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2c(Cl)cccc2Cl)C1	ZINC001023719987	1319857414	/nfs/dbraw/zinc/85/74/14/1319857414.db2.gz	KAEMTPCNEYGWJZ-ZDUSSCGKSA-N	0	3	339.266	3.459	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N(CC)[C@@H](C)c1cc2ccccc2o1	ZINC000836487214	1320493838	/nfs/dbraw/zinc/49/38/38/1320493838.db2.gz	BFPWISPXULXQQJ-INIZCTEOSA-N	0	3	341.455	3.480	20	30		EGEDHN
Cc1cccc([C@H](O)CN2CCC(Oc3cccc(C#N)c3)CC2)c1	ZINC000929523957	1328626186	/nfs/dbraw/zinc/62/61/86/1328626186.db2.gz	INMSYZZAJFYIGP-OAQYLSRUSA-N	0	3	336.435	3.444	20	30		EGEDHN
C#C[C@@H](CCC)NC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F	ZINC000803191248	1317090047	/nfs/dbraw/zinc/09/00/47/1317090047.db2.gz	WKILNIZRVOSUFC-DLBZAZTESA-N	0	3	334.410	3.062	20	30		EGEDHN
CC(C)(C)C(C)(C)C(=O)N1CC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001019235903	1317115577	/nfs/dbraw/zinc/11/55/77/1317115577.db2.gz	RUFGRLIRHQSYPJ-INIZCTEOSA-N	0	3	345.462	3.460	20	30		EGEDHN
CCc1oc(C(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)cc1C	ZINC001019642175	1317315091	/nfs/dbraw/zinc/31/50/91/1317315091.db2.gz	CWECCLIPZMVVSF-ZDUSSCGKSA-N	0	3	343.452	3.088	20	30		EGEDHN
CC(C)C(=O)N1CCC2(CCN(Cc3ccccc3C#N)CC2)CC1	ZINC000957501702	1317409309	/nfs/dbraw/zinc/40/93/09/1317409309.db2.gz	LJSYGHLCOGACTB-UHFFFAOYSA-N	0	3	339.483	3.419	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@H](NC(=O)CC3=CCCCC3)C2)c(F)c1	ZINC001020026922	1317507201	/nfs/dbraw/zinc/50/72/01/1317507201.db2.gz	FPPCRWXQBAMCDE-IYARVYRRSA-N	0	3	341.430	3.325	20	30		EGEDHN
C[C@H]1[C@H](NC(=O)Cc2ccccc2CC#N)CCN1Cc1ccccc1	ZINC000807738865	1317581843	/nfs/dbraw/zinc/58/18/43/1317581843.db2.gz	HVBIFQHDTCMPSE-LAUBAEHRSA-N	0	3	347.462	3.074	20	30		EGEDHN
CC[C@@H](N[C@@H]1CCN(Cc2ccccc2)C1=O)c1cccc(C#N)c1	ZINC000902853080	1317624502	/nfs/dbraw/zinc/62/45/02/1317624502.db2.gz	JBXCYARCSREIIV-WOJBJXKFSA-N	0	3	333.435	3.400	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)[C@H]2CCC[C@H]2CCC)C1	ZINC001020326354	1317645090	/nfs/dbraw/zinc/64/50/90/1317645090.db2.gz	NWWJDFILMLUFTK-TUVASFSCSA-N	0	3	343.309	3.348	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)cc1F)C1(NC(=O)OC(C)(C)C)CC1	ZINC000903091687	1317650649	/nfs/dbraw/zinc/65/06/49/1317650649.db2.gz	YPJCGYKPZSBVBP-LBPRGKRZSA-N	0	3	333.407	3.233	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)C2(c3cccc(F)c3)CCC2)C1	ZINC001020452143	1317703573	/nfs/dbraw/zinc/70/35/73/1317703573.db2.gz	VOCLBATYJGAFTJ-WKILWMFISA-N	0	3	336.838	3.237	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)c2ccccc2CC)C1	ZINC001020518738	1317739924	/nfs/dbraw/zinc/73/99/24/1317739924.db2.gz	SOYZHJXGZDSXNU-HDJSIYSDSA-N	0	3	337.261	3.008	20	30		EGEDHN
CC[C@@H]1CCC[C@@H]1C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001020554092	1317766040	/nfs/dbraw/zinc/76/60/40/1317766040.db2.gz	KTTKABXABKQFDC-DDBAPUKQSA-N	0	3	343.446	3.260	20	30		EGEDHN
CC[C@H]1CCC[C@H]1C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001020554167	1317767651	/nfs/dbraw/zinc/76/76/51/1317767651.db2.gz	LWIBKEWZPXYWBJ-LEUOFYLZSA-N	0	3	343.446	3.260	20	30		EGEDHN
C#Cc1ccc(CN2CCC(N(C)C(=O)OC(C)(C)C)CC2)cc1	ZINC000809573781	1317834623	/nfs/dbraw/zinc/83/46/23/1317834623.db2.gz	XXYCHEJNRUVCLM-UHFFFAOYSA-N	0	3	328.456	3.499	20	30		EGEDHN
CCCCOc1cc(/C=C2/C(=O)c3ncnn3C2C)ccc1OC	ZINC000905081215	1317922361	/nfs/dbraw/zinc/92/23/61/1317922361.db2.gz	PYJHZKFEQOHTGN-ZMTLZGASSA-N	0	3	327.384	3.307	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCCC[C@@H]1COC(=O)NC1CC1	ZINC000810040869	1317941771	/nfs/dbraw/zinc/94/17/71/1317941771.db2.gz	YIBASIZMXDQPMI-GOSISDBHSA-N	0	3	327.428	3.110	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@H]1CCN([C@H](C)c2ccccc2)C1	ZINC000810192181	1317972793	/nfs/dbraw/zinc/97/27/93/1317972793.db2.gz	LIGXYPDRRBSHNJ-UTKZUKDTSA-N	0	3	332.447	3.162	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc(OC3CCC3)cc2)C1	ZINC001021077303	1318069441	/nfs/dbraw/zinc/06/94/41/1318069441.db2.gz	KZSASFNNYUWMIW-SHTZXODSSA-N	0	3	334.847	3.221	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)C2CC(c3cccc(F)c3)C2)C1	ZINC001021137061	1318110721	/nfs/dbraw/zinc/11/07/21/1318110721.db2.gz	SOLCCJSAEKYPNV-UNUDIURISA-N	0	3	336.838	3.309	20	30		EGEDHN
C#Cc1ccc(C(=O)NC2C[C@H]3CC[C@@H](C2)N3C[C@@H](F)CC)cc1	ZINC001021342131	1318197369	/nfs/dbraw/zinc/19/73/69/1318197369.db2.gz	JKCUUGGCTSTAJR-QBUWPKIASA-N	0	3	328.431	3.141	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NC1C[C@H]2CC[C@@H](C1)N2C/C=C/Cl	ZINC001021447283	1318257226	/nfs/dbraw/zinc/25/72/26/1318257226.db2.gz	HJVKRAZZDAJDBB-WXQUDACHSA-N	0	3	342.870	3.075	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)/C=C\C2CC2)cc1F	ZINC000959938125	1318276362	/nfs/dbraw/zinc/27/63/62/1318276362.db2.gz	RGRQUJINFFDUDQ-CNRGFGOASA-N	0	3	341.430	3.134	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC000959955335	1318287228	/nfs/dbraw/zinc/28/72/28/1318287228.db2.gz	RLESKFTYEXPESK-YQMISUSPSA-N	0	3	329.419	3.134	20	30		EGEDHN
C#C[C@@H](NC(=O)NC[C@H]1CCCCN1C1CC1)c1ccc(Cl)cc1	ZINC000811911466	1318289570	/nfs/dbraw/zinc/28/95/70/1318289570.db2.gz	PPOKIJDYWXKERK-QZTJIDSGSA-N	0	3	345.874	3.330	20	30		EGEDHN
C#C[C@H](C)N(C)C(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1	ZINC000812010147	1318308172	/nfs/dbraw/zinc/30/81/72/1318308172.db2.gz	GESBDSSGISRFOC-PKOBYXMFSA-N	0	3	327.472	3.123	20	30		EGEDHN
CN(CCCCC1(C#N)CCC1)[C@H]1CCCC[C@H]1S(C)(=O)=O	ZINC000930000035	1328760884	/nfs/dbraw/zinc/76/08/84/1328760884.db2.gz	LUQCARNVQMIMEG-JKSUJKDBSA-N	0	3	326.506	3.138	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@H](CCCN3C(=O)/C=C/C3CC3)C2)c1	ZINC001021542568	1318381345	/nfs/dbraw/zinc/38/13/45/1318381345.db2.gz	UYQSLQJMCSVPLD-OBDVNYBASA-N	0	3	349.478	3.337	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@H](CCCN3C(=O)C=C3CCC3)C2)cc1	ZINC001021558666	1318406990	/nfs/dbraw/zinc/40/69/90/1318406990.db2.gz	KZBFWRQOOHVALI-RTWAWAEBSA-N	0	3	349.478	3.481	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cccc(C)c2F)C1	ZINC001021590958	1318436690	/nfs/dbraw/zinc/43/66/90/1318436690.db2.gz	FYNDIVRDCGNIJW-SJLPKXTDSA-N	0	3	328.431	3.084	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc(-c2ccco2)on1	ZINC000960292249	1318446810	/nfs/dbraw/zinc/44/68/10/1318446810.db2.gz	AVJZUKFMGROZBS-DNVCBOLYSA-N	0	3	349.390	3.106	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc2c(c1)[C@@H](C)CO2	ZINC000960296739	1318449412	/nfs/dbraw/zinc/44/94/12/1318449412.db2.gz	RVLUQYBYSJWEEO-UQIDSAAFSA-N	0	3	348.446	3.354	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@H]1CCCCC1(F)F	ZINC000960296414	1318449776	/nfs/dbraw/zinc/44/97/76/1318449776.db2.gz	OJOBLCMOHCFODD-BRWVUGGUSA-N	0	3	334.410	3.370	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1c(F)ccc(F)c1F	ZINC000960298904	1318451040	/nfs/dbraw/zinc/45/10/40/1318451040.db2.gz	HJVRPRCTTSBIHQ-CRAIPNDOSA-N	0	3	346.352	3.275	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@@H]1C[C@H]1c1ccco1	ZINC000960316264	1318457693	/nfs/dbraw/zinc/45/76/93/1318457693.db2.gz	XBXHABTVDHUQDZ-SOAMZJECSA-N	0	3	336.435	3.331	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cscc2Cl)C1	ZINC001021612122	1318459249	/nfs/dbraw/zinc/45/92/49/1318459249.db2.gz	XAEKQMTXVAVMNI-CZUORRHYSA-N	0	3	336.888	3.351	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cccc3cccnc32)C1	ZINC001021621385	1318469694	/nfs/dbraw/zinc/46/96/94/1318469694.db2.gz	ARZKBORSHYLQEK-UYAOXDASSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)CCc2cccc(Cl)c2)C1	ZINC001021642403	1318500260	/nfs/dbraw/zinc/50/02/60/1318500260.db2.gz	QDVCRHGHWVWIIE-HKUYNNGSSA-N	0	3	344.886	3.219	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)C[C@H]1C=CCC1	ZINC000960401786	1318530486	/nfs/dbraw/zinc/53/04/86/1318530486.db2.gz	ZGECNQMAJFQIKN-PXNSSMCTSA-N	0	3	337.467	3.337	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(F)cc(Cl)c2)C1	ZINC001021677148	1318545732	/nfs/dbraw/zinc/54/57/32/1318545732.db2.gz	ORPWBDSKCCNGIO-KDOFPFPSSA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(C(C)(C)C)oc2C)C1	ZINC001021679911	1318551653	/nfs/dbraw/zinc/55/16/53/1318551653.db2.gz	USELUGOLCJBDFQ-WMZOPIPTSA-N	0	3	342.483	3.445	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@H]1CN(C)Cc1ccc(C(F)F)cc1	ZINC000960503154	1318610949	/nfs/dbraw/zinc/61/09/49/1318610949.db2.gz	PMDSHJMIIGHBFH-CJNGLKHVSA-N	0	3	335.398	3.207	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2c[nH]c3ccccc23)C1	ZINC001021722505	1318610988	/nfs/dbraw/zinc/61/09/88/1318610988.db2.gz	OICMMVQHLVWDCU-LAUBAEHRSA-N	0	3	349.478	3.047	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2occ3c2CCCC3)C1	ZINC001021723460	1318612222	/nfs/dbraw/zinc/61/22/22/1318612222.db2.gz	UVXBWQXDRXOAAH-APWZRJJASA-N	0	3	340.467	3.108	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2ccccc2Cl)C1	ZINC001021726322	1318619404	/nfs/dbraw/zinc/61/94/04/1318619404.db2.gz	BCNFJRDQASRSLD-PKOBYXMFSA-N	0	3	344.886	3.219	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc3c(s2)CCCC3)C1	ZINC001021729503	1318630497	/nfs/dbraw/zinc/63/04/97/1318630497.db2.gz	ZYPBTPDRUYTRHZ-IRXDYDNUSA-N	0	3	342.508	3.187	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(CC(C)C)cc2)C1	ZINC001021729777	1318630736	/nfs/dbraw/zinc/63/07/36/1318630736.db2.gz	HHPYXGOVXXGXBB-SFTDATJTSA-N	0	3	338.495	3.445	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(C3CCCC3)no2)C1	ZINC001021742433	1318654303	/nfs/dbraw/zinc/65/43/03/1318654303.db2.gz	LDORJROINKAUFV-SJLPKXTDSA-N	0	3	343.471	3.445	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc3c(cccc3C)o2)C1	ZINC001021746993	1318664356	/nfs/dbraw/zinc/66/43/56/1318664356.db2.gz	RUROEXGFXHDCES-SJLPKXTDSA-N	0	3	336.435	3.301	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)/C=C/c1ccc[nH]1	ZINC000960589700	1318719001	/nfs/dbraw/zinc/71/90/01/1318719001.db2.gz	LDFVQRJDCYLHEN-XTXLJPNXSA-N	0	3	348.450	3.023	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)C1CC(C)(C)C1	ZINC000960607591	1318731859	/nfs/dbraw/zinc/73/18/59/1318731859.db2.gz	KPOCCLIFSQTNDP-IBGZPJMESA-N	0	3	339.483	3.417	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCC[C@H]1CN(C)Cc1ccccc1	ZINC000960667815	1318783811	/nfs/dbraw/zinc/78/38/11/1318783811.db2.gz	KWJBWSHOTCNHEY-IBGZPJMESA-N	0	3	337.467	3.411	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)[C@H]2CCCC3(CC3)C2)C1	ZINC001022075983	1318790333	/nfs/dbraw/zinc/79/03/33/1318790333.db2.gz	UMIOFMUPMSHHTA-MELADBBJSA-N	0	3	341.293	3.102	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@@H]2CCCO[C@H]2c2ccccc2)C1	ZINC001022221747	1318849691	/nfs/dbraw/zinc/84/96/91/1318849691.db2.gz	NKUODQBMELVTBK-XDNAFOTISA-N	0	3	348.874	3.144	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)Nc1ccccc1C(=O)N(C)C	ZINC000912359928	1318877751	/nfs/dbraw/zinc/87/77/51/1318877751.db2.gz	LSRZGRDQEYWSPJ-MRXNPFEDSA-N	0	3	333.476	3.405	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@@H](NC(=O)C34CCC(CC3)C4)C2)c1	ZINC001022288947	1318878833	/nfs/dbraw/zinc/87/88/33/1318878833.db2.gz	PCUMPUPYFYUPMV-FOELVNDASA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc(C)c3ccccc3n2)C1	ZINC001022300845	1318884580	/nfs/dbraw/zinc/88/45/80/1318884580.db2.gz	ATKOQVAFJNYCND-OKILXGFUSA-N	0	3	329.831	3.146	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)C2(c3ccc(F)cc3)CCC2)C1	ZINC001022521106	1318975717	/nfs/dbraw/zinc/97/57/17/1318975717.db2.gz	JZSPCFNZXRFXGF-IYBDPMFKSA-N	0	3	336.838	3.237	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@@H](NCc3oc(CCC)nc3C)C2)CC1	ZINC001022655330	1319044643	/nfs/dbraw/zinc/04/46/43/1319044643.db2.gz	DCMONSVQWHUZCC-CALCHBBNSA-N	0	3	345.487	3.419	20	30		EGEDHN
CC[C@H]1CCC[C@@H]1C(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001022661364	1319050500	/nfs/dbraw/zinc/05/05/00/1319050500.db2.gz	LWIBKEWZPXYWBJ-OWLYRPNTSA-N	0	3	343.446	3.260	20	30		EGEDHN
Cc1nc(C(=O)C(C#N)C(=O)Nc2cccc3ccccc32)c(C)o1	ZINC000815908618	1319072817	/nfs/dbraw/zinc/07/28/17/1319072817.db2.gz	GASQQYJCKKZIMV-OAHLLOKOSA-N	0	3	333.347	3.406	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC001023012355	1319219536	/nfs/dbraw/zinc/21/95/36/1319219536.db2.gz	KUUFWFUBGXHTOK-BETUJISGSA-N	0	3	332.753	3.308	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@@H]([C@@H]2CCN(Cc3ccc(C#N)s3)C2)C1	ZINC000961139015	1319257458	/nfs/dbraw/zinc/25/74/58/1319257458.db2.gz	LOJOVEHMTJIRNK-HZPDHXFCSA-N	0	3	345.512	3.336	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)[C@H]2C[C@H](C)C[C@H](C)C2)C1	ZINC001023137522	1319280091	/nfs/dbraw/zinc/28/00/91/1319280091.db2.gz	KYEFGSRAWAURSF-ZHDOCJEPSA-N	0	3	343.309	3.204	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc(C(F)(F)F)s2)C1	ZINC001023154167	1319298645	/nfs/dbraw/zinc/29/86/45/1319298645.db2.gz	PMQGOQROMIXEQC-DTORHVGOSA-N	0	3	338.782	3.370	20	30		EGEDHN
C[C@@H]1C[C@H](C(=O)OC(C)(C)C)CN(Cc2ccc(OCC#N)cc2)C1	ZINC000817289315	1319313936	/nfs/dbraw/zinc/31/39/36/1319313936.db2.gz	WXMDWVFMEVBUMG-WBVHZDCISA-N	0	3	344.455	3.389	20	30		EGEDHN
N#Cc1c[nH]c(C(=O)NC[C@@H]2CCCN(C/C=C/c3ccccc3)C2)c1	ZINC001023296499	1319423028	/nfs/dbraw/zinc/42/30/28/1319423028.db2.gz	YQRGLZBSPDNOGI-PYJQOMOHSA-N	0	3	348.450	3.042	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)[C@@H]2[C@@H](c3ccccc3)C2(C)C)C1	ZINC001023369683	1319482569	/nfs/dbraw/zinc/48/25/69/1319482569.db2.gz	GQDFVPALMSHNEW-RLLQIKCJSA-N	0	3	338.495	3.278	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@H](CNC(=O)C3C=CC=CC=C3)C2)c1	ZINC001023391755	1319499190	/nfs/dbraw/zinc/49/91/90/1319499190.db2.gz	GFEYHTRHGPPECB-FQEVSTJZSA-N	0	3	347.462	3.185	20	30		EGEDHN
C[C@@H](NCc1ccc(OCC#N)cc1)c1ccc2c(c1)CCC(=O)N2	ZINC000915683745	1319519878	/nfs/dbraw/zinc/51/98/78/1319519878.db2.gz	ZWTXPICGMRDYBF-CQSZACIVSA-N	0	3	335.407	3.324	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2[nH]c3ccccc3c2Cl)C1	ZINC001023465435	1319563909	/nfs/dbraw/zinc/56/39/09/1319563909.db2.gz	RRAYBHRANXYZQF-CQSZACIVSA-N	0	3	343.858	3.286	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2sc(C)nc2CC(C)C)C1	ZINC001023470409	1319570432	/nfs/dbraw/zinc/57/04/32/1319570432.db2.gz	WNMGZGKHWUVSCG-MRXNPFEDSA-N	0	3	347.528	3.115	20	30		EGEDHN
Cc1cc(C(=O)NC2CC(CNCc3ccccc3C#N)C2)c(C)o1	ZINC000961539888	1319642695	/nfs/dbraw/zinc/64/26/95/1319642695.db2.gz	SWXIUAWOZLGHIP-UHFFFAOYSA-N	0	3	337.423	3.066	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CCCN(CCc3ccns3)C2)CC1	ZINC001023572385	1319688842	/nfs/dbraw/zinc/68/88/42/1319688842.db2.gz	BHFCJVUCBQVQJJ-INIZCTEOSA-N	0	3	347.528	3.260	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)c2ccc(C(F)(F)F)cn2)c1	ZINC000916896635	1319722012	/nfs/dbraw/zinc/72/20/12/1319722012.db2.gz	MYWRHURGECCMOP-CYBMUJFWSA-N	0	3	347.296	3.370	20	30		EGEDHN
N#CC(C(=O)Cc1ccccc1F)C(=O)Nc1ccccc1Cl	ZINC000916905927	1319723244	/nfs/dbraw/zinc/72/32/44/1319723244.db2.gz	OLEUFZMZHWBSIE-LBPRGKRZSA-N	0	3	330.746	3.369	20	30		EGEDHN
CC(C)c1cc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)n[nH]1	ZINC000916909443	1319723346	/nfs/dbraw/zinc/72/33/46/1319723346.db2.gz	BNNLSWCKINEJDM-JTQLQIEISA-N	0	3	330.775	3.148	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)COc2ccccc2C)cc1	ZINC000916909577	1319723415	/nfs/dbraw/zinc/72/34/15/1319723415.db2.gz	LEHDWJIUJODVQY-QGZVFWFLSA-N	0	3	336.391	3.284	20	30		EGEDHN
N#CC(C(=O)COCC1CC1)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000916931682	1319725764	/nfs/dbraw/zinc/72/57/64/1319725764.db2.gz	MGJIKMXAOSTXAI-NSHDSACASA-N	0	3	341.194	3.067	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)CCC(C)(F)F)cc1Cl	ZINC000916938585	1319726084	/nfs/dbraw/zinc/72/60/84/1319726084.db2.gz	BQUFDTBJJLZTCX-JTQLQIEISA-N	0	3	344.745	3.431	20	30		EGEDHN
N#CC(C(=O)CCn1c2ccccc2c2ccccc21)C(=O)NC1CC1	ZINC000916931134	1319726565	/nfs/dbraw/zinc/72/65/65/1319726565.db2.gz	NHLQAISVWBDSRH-QGZVFWFLSA-N	0	3	345.402	3.172	20	30		EGEDHN
N#Cc1ccccc1CNCC1CC(NC(=O)[C@@H]2C[C@@H]3C=C[C@H]2CC3)C1	ZINC000961861216	1319750194	/nfs/dbraw/zinc/75/01/94/1319750194.db2.gz	CQULQZRKLOSMGP-KUCPDBALSA-N	0	3	349.478	3.145	20	30		EGEDHN
CC1(C)CC[C@@H]1C(=O)NC1CC(CNCc2cc(C#N)ccc2F)C1	ZINC000962205270	1319858881	/nfs/dbraw/zinc/85/88/81/1319858881.db2.gz	XUQDKKOYIIBDAX-BDVYOWHSSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C1CC(C)(C(=O)NC2CC(CNCc3cccc(F)c3F)C2)C1	ZINC000962283546	1319900503	/nfs/dbraw/zinc/90/05/03/1319900503.db2.gz	UFOLXKMMOHRKSX-UHFFFAOYSA-N	0	3	334.410	3.306	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc(F)c3occc32)C1	ZINC001023758614	1319904497	/nfs/dbraw/zinc/90/44/97/1319904497.db2.gz	YJTVVAGZWILHBZ-CQSZACIVSA-N	0	3	328.387	3.037	20	30		EGEDHN
CN(C)CCN(Cc1ccsc1)C(=O)/C=C\c1ccccc1C#N	ZINC000838185189	1320742305	/nfs/dbraw/zinc/74/23/05/1320742305.db2.gz	VMWIQJNVFZBPJN-FPLPWBNLSA-N	0	3	339.464	3.223	20	30		EGEDHN
C=CCONC(=O)N(CCC)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000838702736	1320806619	/nfs/dbraw/zinc/80/66/19/1320806619.db2.gz	BYRFFRIBCDNLIC-SFHVURJKSA-N	0	3	331.460	3.190	20	30		EGEDHN
c1ccc([C@H]2CC(N=Nc3nc4ccccn4n3)CCN2C2CC2)cc1	ZINC000841635287	1321289810	/nfs/dbraw/zinc/28/98/10/1321289810.db2.gz	IVDBGMFDZUFCKE-GOSISDBHSA-N	0	3	346.438	3.497	20	30		EGEDHN
C=CCC[C@@H]1NC(=O)N(C[C@@H]2CCCN(C)[C@H]2c2cccs2)C1=O	ZINC000842243691	1321364638	/nfs/dbraw/zinc/36/46/38/1321364638.db2.gz	IJOUTYLILMCIJW-OFQRWUPVSA-N	0	3	347.484	3.018	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1	ZINC000842284453	1321367653	/nfs/dbraw/zinc/36/76/53/1321367653.db2.gz	KRXZBEWNUIDVPD-KSZLIROESA-N	0	3	337.423	3.067	20	30		EGEDHN
CCCc1ccc(CCCC(=O)C(C#N)C(=O)N2CCCC2)cc1	ZINC000842680816	1321417367	/nfs/dbraw/zinc/41/73/67/1321417367.db2.gz	AEIIOTRDXWBJES-SFHVURJKSA-N	0	3	326.440	3.293	20	30		EGEDHN
CSc1ccc(CCCC(=O)C(C#N)C(=O)N2CCCC2)cc1	ZINC000842682060	1321418150	/nfs/dbraw/zinc/41/81/50/1321418150.db2.gz	YIVXGPREELSTDW-MRXNPFEDSA-N	0	3	330.453	3.062	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc3nc(CC)sc3c2)CC1	ZINC000843686127	1321536291	/nfs/dbraw/zinc/53/62/91/1321536291.db2.gz	DPUOUANIHUEGCI-UHFFFAOYSA-N	0	3	327.453	3.142	20	30		EGEDHN
N#CC1(COC(=O)c2cscn2)CCN(Cc2ccccc2)CC1	ZINC000847749577	1321900294	/nfs/dbraw/zinc/90/02/94/1321900294.db2.gz	VEAYZIPVTQSOIR-UHFFFAOYSA-N	0	3	341.436	3.106	20	30		EGEDHN
CCC(CC)Nc1ccncc1NC(=O)Cc1ccccc1CC#N	ZINC000848108520	1321932943	/nfs/dbraw/zinc/93/29/43/1321932943.db2.gz	NJJMUCFOMFCPKS-UHFFFAOYSA-N	0	3	336.439	3.351	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN[C@@H]2CCc3ccccc3NC2=O)cc1	ZINC000848561037	1321975854	/nfs/dbraw/zinc/97/58/54/1321975854.db2.gz	OKARNAXLSKZWLF-IFXJQAMLSA-N	0	3	335.407	3.021	20	30		EGEDHN
CCO[C@@H](CC)C(=O)C(C#N)C(=O)Nc1c(CC)cccc1CC	ZINC000920109253	1322137923	/nfs/dbraw/zinc/13/79/23/1322137923.db2.gz	NDARZBCKCZJIQM-CVEARBPZSA-N	0	3	330.428	3.274	20	30		EGEDHN
CCC[C@H](CCO)CNCc1cc(C#N)ccc1Br	ZINC000921804087	1322400866	/nfs/dbraw/zinc/40/08/66/1322400866.db2.gz	LQOQMHYNBOMENT-GFCCVEGCSA-N	0	3	325.250	3.209	20	30		EGEDHN
Cc1cc(C[C@H](C)NCc2cc(C#N)ccc2Br)[nH]n1	ZINC000921861754	1322414086	/nfs/dbraw/zinc/41/40/86/1322414086.db2.gz	YTFJBEPCCSAYGD-JTQLQIEISA-N	0	3	333.233	3.073	20	30		EGEDHN
Cc1cc(C[C@H](C)NCc2cc(C#N)ccc2Br)n[nH]1	ZINC000921861754	1322414090	/nfs/dbraw/zinc/41/40/90/1322414090.db2.gz	YTFJBEPCCSAYGD-JTQLQIEISA-N	0	3	333.233	3.073	20	30		EGEDHN
CC(C)[C@@H](NCc1ccc(N(C)CCC#N)cc1)c1cnn(C)c1	ZINC000922894082	1322643148	/nfs/dbraw/zinc/64/31/48/1322643148.db2.gz	XOPNIZFCENUOSD-LJQANCHMSA-N	0	3	325.460	3.257	20	30		EGEDHN
CC(C)NC(=O)OC[C@@H]1CCCCN1CCc1ccc(C#N)cc1	ZINC000852047216	1323138880	/nfs/dbraw/zinc/13/88/80/1323138880.db2.gz	YJCUEAQUOAMBMB-SFHVURJKSA-N	0	3	329.444	3.090	20	30		EGEDHN
C#C[C@](C)(CC)NCC(=O)NCc1ccccc1OC1CCCC1	ZINC000852102743	1323147397	/nfs/dbraw/zinc/14/73/97/1323147397.db2.gz	PECCVUSSLROWKF-HXUWFJFHSA-N	0	3	328.456	3.016	20	30		EGEDHN
C[C@H](CC(C)(C)C#N)NCc1cccc(C(=O)NC[C@H]2CCCO2)c1	ZINC000924787729	1323163595	/nfs/dbraw/zinc/16/35/95/1323163595.db2.gz	ZVSYPTTUKWVVBN-CRAIPNDOSA-N	0	3	343.471	3.013	20	30		EGEDHN
CC(C)C1(C(=O)N2CCC[C@@H](CNCc3ccccc3C#N)C2)CC1	ZINC001024142921	1323166783	/nfs/dbraw/zinc/16/67/83/1323166783.db2.gz	BQFCQKAGXKWUKR-KRWDZBQOSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)c2cscn2)C1	ZINC000963262060	1323276831	/nfs/dbraw/zinc/27/68/31/1323276831.db2.gz	DGIQLOJFAVEBQG-UKRRQHHQSA-N	0	3	339.892	3.212	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)C2=COCCC2)C1	ZINC000963262037	1323277564	/nfs/dbraw/zinc/27/75/64/1323277564.db2.gz	DFCQHVDMFDNXNQ-WBVHZDCISA-N	0	3	338.879	3.136	20	30		EGEDHN
C=CCCN1CCCC[C@@H]1CNC(=O)c1sc(C2CC2)nc1C	ZINC001024434746	1323394415	/nfs/dbraw/zinc/39/44/15/1323394415.db2.gz	GTRNAPSFOMFNRE-OAHLLOKOSA-N	0	3	333.501	3.489	20	30		EGEDHN
C=CCCN1CCCC[C@@H]1CNC(=O)c1sc(Cl)nc1C	ZINC001024458429	1323415019	/nfs/dbraw/zinc/41/50/19/1323415019.db2.gz	FHSXDJOINNPKPJ-GFCCVEGCSA-N	0	3	327.881	3.265	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1cccc2ccc(C)nc21	ZINC001024502412	1323451697	/nfs/dbraw/zinc/45/16/97/1323451697.db2.gz	NJIIJKKJTUBWJI-SFHVURJKSA-N	0	3	335.451	3.151	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccc(-n2cccc2)cc1	ZINC001024534726	1323477162	/nfs/dbraw/zinc/47/71/62/1323477162.db2.gz	KDHCIDDDFRGQQQ-HXUWFJFHSA-N	0	3	335.451	3.085	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1cc2cc(Cl)ccc2[nH]1	ZINC001024593514	1323527734	/nfs/dbraw/zinc/52/77/34/1323527734.db2.gz	PCNWCGGJNQMWTF-MRXNPFEDSA-N	0	3	343.858	3.429	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@@H]2CCCCN2Cc2ccc(C)cc2)c1	ZINC001024644257	1323568685	/nfs/dbraw/zinc/56/86/85/1323568685.db2.gz	OBYMKKUZDWTRCC-NRFANRHFSA-N	0	3	347.462	3.156	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@@H]2CCCCN2Cc2cccc(C)c2)c1	ZINC001024644330	1323569268	/nfs/dbraw/zinc/56/92/68/1323569268.db2.gz	OVGLEZZJCYZTLB-NRFANRHFSA-N	0	3	347.462	3.156	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1c(F)ccc(F)c1Cl	ZINC001024672891	1323585771	/nfs/dbraw/zinc/58/57/71/1323585771.db2.gz	GATKGMOPIXUTGP-GFCCVEGCSA-N	0	3	340.801	3.226	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cnc(-c2ccccc2)[nH]1	ZINC001024685658	1323600838	/nfs/dbraw/zinc/60/08/38/1323600838.db2.gz	LDHDHWPOSVXXHG-QGZVFWFLSA-N	0	3	338.455	3.237	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cnc(C)nc1C(C)C	ZINC001024689268	1323603759	/nfs/dbraw/zinc/60/37/59/1323603759.db2.gz	CGUQAFPYNNBVPE-MRXNPFEDSA-N	0	3	330.476	3.069	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccn(C(CC)CC)n1	ZINC001024691644	1323607443	/nfs/dbraw/zinc/60/74/43/1323607443.db2.gz	YIJIIDFVNGVEMF-KRWDZBQOSA-N	0	3	332.492	3.405	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1csc(-c2ccoc2)n1	ZINC001024713416	1323621097	/nfs/dbraw/zinc/62/10/97/1323621097.db2.gz	JDOXFZNDLMYYGN-HNNXBMFYSA-N	0	3	343.452	3.011	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccc(C(C)(F)F)cc1	ZINC001024829481	1323732030	/nfs/dbraw/zinc/73/20/30/1323732030.db2.gz	CRGXCESGJCXKLM-KRWDZBQOSA-N	0	3	334.410	3.406	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)c(F)c1	ZINC001024932992	1323790161	/nfs/dbraw/zinc/79/01/61/1323790161.db2.gz	JXXCFHVJOAHMRO-SJORKVTESA-N	0	3	343.446	3.214	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(Cl)c[nH]1	ZINC001025198629	1323981699	/nfs/dbraw/zinc/98/16/99/1323981699.db2.gz	QPTLOQKXCZLZKL-SJORKVTESA-N	0	3	333.863	3.151	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccoc1Cl	ZINC001025223998	1324011597	/nfs/dbraw/zinc/01/15/97/1324011597.db2.gz	KEVVVVPACLVSIF-HOTGVXAUSA-N	0	3	334.847	3.415	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(C(C)C)n(C)n1	ZINC001025229422	1324015069	/nfs/dbraw/zinc/01/50/69/1324015069.db2.gz	JNTSBUOBSGCRNY-ZWKOTPCHSA-N	0	3	344.503	3.189	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1c(C)coc1C	ZINC001025230653	1324016765	/nfs/dbraw/zinc/01/67/65/1324016765.db2.gz	YMUIJQUNNBZGAT-MSOLQXFVSA-N	0	3	328.456	3.379	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(CC)ccn1	ZINC001025232029	1324018277	/nfs/dbraw/zinc/01/82/77/1324018277.db2.gz	JZKLQNNDYHIPAV-OALUTQOASA-N	0	3	327.472	3.289	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(CC)ccn1	ZINC001025232028	1324019188	/nfs/dbraw/zinc/01/91/88/1324019188.db2.gz	JZKLQNNDYHIPAV-MOPGFXCFSA-N	0	3	327.472	3.289	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(OC)ns1	ZINC001025234107	1324021818	/nfs/dbraw/zinc/02/18/18/1324021818.db2.gz	FOFFPQLLGYEEQB-CABCVRRESA-N	0	3	349.500	3.187	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc2occc2[nH]1	ZINC001025238626	1324029171	/nfs/dbraw/zinc/02/91/71/1324029171.db2.gz	UFMBTVLVTQNPIA-ROUUACIJSA-N	0	3	339.439	3.243	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc(C(C)C)nc1	ZINC001025239725	1324032080	/nfs/dbraw/zinc/03/20/80/1324032080.db2.gz	IPLVNUUAGVDZBJ-VQTJNVASSA-N	0	3	339.483	3.297	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cnc(C2CC2)o1	ZINC001025240094	1324032670	/nfs/dbraw/zinc/03/26/70/1324032670.db2.gz	LBYKLIMPVDTUEL-HZPDHXFCSA-N	0	3	329.444	3.197	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)CC1CC(F)(F)C1	ZINC001025243188	1324038691	/nfs/dbraw/zinc/03/86/91/1324038691.db2.gz	AOUDWOVAGUCYIT-IRXDYDNUSA-N	0	3	338.442	3.291	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cn(C)c2ccccc12	ZINC001025247438	1324047793	/nfs/dbraw/zinc/04/77/93/1324047793.db2.gz	KYZLIMFHUWKWGT-LEWJYISDSA-N	0	3	349.478	3.271	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1c[nH]c2ccccc12	ZINC001025248403	1324048675	/nfs/dbraw/zinc/04/86/75/1324048675.db2.gz	ZLCJXSDGYHWRQO-PMACEKPBSA-N	0	3	335.451	3.260	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccn2ccccc12	ZINC001025249340	1324049893	/nfs/dbraw/zinc/04/98/93/1324049893.db2.gz	BHKZLXLVYXHUQN-LEWJYISDSA-N	0	3	349.478	3.422	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)C1CCC2(CC2)CC1	ZINC001025252687	1324058331	/nfs/dbraw/zinc/05/83/31/1324058331.db2.gz	PZHDPTVQFGXUMX-RBUKOAKNSA-N	0	3	328.500	3.436	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)CCc1cccc(C)c1	ZINC001025254922	1324061234	/nfs/dbraw/zinc/06/12/34/1324061234.db2.gz	NFDKFZMAJLUWQM-SFTDATJTSA-N	0	3	338.495	3.406	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(C(C)C)on1	ZINC001025254909	1324061781	/nfs/dbraw/zinc/06/17/81/1324061781.db2.gz	NBNWNWUNAHHJAW-ROUUACIJSA-N	0	3	343.471	3.280	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1occc1CC	ZINC001025266439	1324077390	/nfs/dbraw/zinc/07/73/90/1324077390.db2.gz	JSVLWGPXAZGXPQ-MSOLQXFVSA-N	0	3	328.456	3.324	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ocnc1C(F)F	ZINC001025265974	1324077563	/nfs/dbraw/zinc/07/75/63/1324077563.db2.gz	HKKHLHFDXGWVRN-QWHCGFSZSA-N	0	3	339.386	3.257	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1occc1CC	ZINC001025266442	1324078338	/nfs/dbraw/zinc/07/83/38/1324078338.db2.gz	JSVLWGPXAZGXPQ-ZWKOTPCHSA-N	0	3	328.456	3.324	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc2cc[nH]c2c1	ZINC001025270539	1324084321	/nfs/dbraw/zinc/08/43/21/1324084321.db2.gz	DHNXQTXSQWSVRL-WOJBJXKFSA-N	0	3	335.451	3.260	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cnc2ccccc2c1	ZINC001025270570	1324084338	/nfs/dbraw/zinc/08/43/38/1324084338.db2.gz	DUNUUARRDDBEKE-LEWJYISDSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(C)cc(F)c1	ZINC001025272137	1324087512	/nfs/dbraw/zinc/08/75/12/1324087512.db2.gz	KJMXJEGEMFGIDD-MOPGFXCFSA-N	0	3	328.431	3.226	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(C(C)C)no1	ZINC001025273894	1324090469	/nfs/dbraw/zinc/09/04/69/1324090469.db2.gz	IATDDNADDLYSQG-IRXDYDNUSA-N	0	3	331.460	3.443	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)CCC1CCOCC1	ZINC001025274858	1324094001	/nfs/dbraw/zinc/09/40/01/1324094001.db2.gz	PHLWHRUQPVMGRB-PMACEKPBSA-N	0	3	346.515	3.062	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)C(C1CC1)C1CC1	ZINC001025287526	1324110029	/nfs/dbraw/zinc/11/00/29/1324110029.db2.gz	ONOKEVUPPUQJEG-OALUTQOASA-N	0	3	328.500	3.291	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cnoc1C(C)C	ZINC001025288177	1324110764	/nfs/dbraw/zinc/11/07/64/1324110764.db2.gz	STEHFIXZYSQFGE-IAGOWNOFSA-N	0	3	331.460	3.443	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)C(C)(C)C(F)(F)F	ZINC001025291909	1324115645	/nfs/dbraw/zinc/11/56/45/1324115645.db2.gz	CTDBGDWEQPTQJV-LSDHHAIUSA-N	0	3	344.421	3.444	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)C(C)(C)C(C)(F)F	ZINC001025293464	1324120083	/nfs/dbraw/zinc/12/00/83/1324120083.db2.gz	RVAHDLTXKPBLEU-HUUCEWRRSA-N	0	3	326.431	3.147	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)Cc1ccc(Cl)cc1	ZINC001025297010	1324128887	/nfs/dbraw/zinc/12/88/87/1324128887.db2.gz	NCWOUQLOVPEWOK-OALUTQOASA-N	0	3	344.886	3.361	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cccn1C(C)C	ZINC001025297623	1324130434	/nfs/dbraw/zinc/13/04/34/1324130434.db2.gz	ZCRZXZWZLDGXOQ-QZTJIDSGSA-N	0	3	327.472	3.161	20	30		EGEDHN
C[C@H](NC(=O)C1CC=CC1)[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001025373682	1324212977	/nfs/dbraw/zinc/21/29/77/1324212977.db2.gz	UZISGORCJYTIGA-JXFKEZNVSA-N	0	3	337.467	3.241	20	30		EGEDHN
C[C@H](NC(=O)C1=CCCC1)[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001025375337	1324216592	/nfs/dbraw/zinc/21/65/92/1324216592.db2.gz	MKGGQUDFANGIOK-OXJNMPFZSA-N	0	3	337.467	3.385	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cccc3c2CCCC3)C1	ZINC001025425943	1324260977	/nfs/dbraw/zinc/26/09/77/1324260977.db2.gz	TWSKWACAHYRMHG-HKUYNNGSSA-N	0	3	338.495	3.419	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc3cc(C)cn3c2)C1	ZINC001025437033	1324276768	/nfs/dbraw/zinc/27/67/68/1324276768.db2.gz	RQNGBCWBNLFWQD-ROUUACIJSA-N	0	3	337.467	3.101	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)C2C3CC4CC(C3)CC2C4)C1	ZINC001025442705	1324283474	/nfs/dbraw/zinc/28/34/74/1324283474.db2.gz	NDCPXEWDEVFCDP-LYHYJAKASA-N	0	3	342.527	3.299	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2coc3cc(F)ccc23)C1	ZINC001025461932	1324307912	/nfs/dbraw/zinc/30/79/12/1324307912.db2.gz	YMNDLJBLDUEFAY-CABCVRRESA-N	0	3	342.414	3.426	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(Cl)ccc2F)C1	ZINC001025480226	1324328031	/nfs/dbraw/zinc/32/80/31/1324328031.db2.gz	RJEGOZAGKBWCSD-UONOGXRCSA-N	0	3	336.838	3.333	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc3ccsc3[nH]2)C1	ZINC001025500598	1324348444	/nfs/dbraw/zinc/34/84/44/1324348444.db2.gz	UZTPDCHIYPJBHR-DZGCQCFKSA-N	0	3	329.469	3.083	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc3ccsc3[nH]2)C1	ZINC001025500599	1324348955	/nfs/dbraw/zinc/34/89/55/1324348955.db2.gz	UZTPDCHIYPJBHR-HIFRSBDPSA-N	0	3	329.469	3.083	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H](C)[C@@H]2CCCN(C/C=C\Cl)C2)cc1	ZINC001025501655	1324350983	/nfs/dbraw/zinc/35/09/83/1324350983.db2.gz	IVUXWNGTWPFHES-QRJBTWOVSA-N	0	3	330.859	3.251	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc3cc(F)ccc3[nH]2)C1	ZINC001025503256	1324351975	/nfs/dbraw/zinc/35/19/75/1324351975.db2.gz	PSAZZPNSCPHZJI-GJZGRUSLSA-N	0	3	341.430	3.161	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](C)[C@@H]2CCCN(Cc3cnoc3C)C2)CC1	ZINC001025523312	1324368775	/nfs/dbraw/zinc/36/87/75/1324368775.db2.gz	OOXKREDASSAMKD-MAUKXSAKSA-N	0	3	345.487	3.446	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(F)c(Cl)c2F)C1	ZINC001025524131	1324369372	/nfs/dbraw/zinc/36/93/72/1324369372.db2.gz	SKKUXYIWRKFCSA-NEPJUHHUSA-N	0	3	340.801	3.082	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc3ncccc3c2)C1	ZINC001025524526	1324370053	/nfs/dbraw/zinc/37/00/53/1324370053.db2.gz	UQGUWJJRSKWQIQ-VQIMIIECSA-N	0	3	335.451	3.088	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc3occc3s2)C1	ZINC001025534921	1324381305	/nfs/dbraw/zinc/38/13/05/1324381305.db2.gz	RDIVXGUCVSIVAF-UONOGXRCSA-N	0	3	330.453	3.348	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(C(CC)CC)no2)C1	ZINC001025553808	1324402179	/nfs/dbraw/zinc/40/21/79/1324402179.db2.gz	AVMJNVHBARNVMQ-HOCLYGCPSA-N	0	3	331.460	3.042	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2scnc2C(C)(C)C)C1	ZINC001025556229	1324405384	/nfs/dbraw/zinc/40/53/84/1324405384.db2.gz	SXTKBFKTJIYITR-CABCVRRESA-N	0	3	347.528	3.294	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(Cl)cc(OC)c2)C1	ZINC001025578566	1324418542	/nfs/dbraw/zinc/41/85/42/1324418542.db2.gz	YBSLLWBVVVYDTB-GJZGRUSLSA-N	0	3	348.874	3.202	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc3cccnc3s2)C1	ZINC001025586790	1324429006	/nfs/dbraw/zinc/42/90/06/1324429006.db2.gz	FLMBOOQQSXEBOR-GOEBONIOSA-N	0	3	341.480	3.150	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(C3CC3)s2)C1	ZINC001025593247	1324440356	/nfs/dbraw/zinc/44/03/56/1324440356.db2.gz	AGKHVKIWWLLERB-HOCLYGCPSA-N	0	3	330.497	3.479	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ncsc2C(C)C)C1	ZINC001025595677	1324443870	/nfs/dbraw/zinc/44/38/70/1324443870.db2.gz	QOXPIOVCQBDEDI-HUUCEWRRSA-N	0	3	333.501	3.120	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccsc2C(F)F)C1	ZINC001025607889	1324458563	/nfs/dbraw/zinc/45/85/63/1324458563.db2.gz	YDJBMOMKDQQFLQ-VXGBXAGGSA-N	0	3	326.412	3.149	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc3c(s2)CCCC3)C1	ZINC001025614607	1324468250	/nfs/dbraw/zinc/46/82/50/1324468250.db2.gz	MNJJEVWMDJLOIX-HOCLYGCPSA-N	0	3	330.497	3.090	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(F)c3occc32)C1	ZINC001025623578	1324473503	/nfs/dbraw/zinc/47/35/03/1324473503.db2.gz	FRHMJWKBIOFZTM-HUUCEWRRSA-N	0	3	342.414	3.426	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccccc2CC(C)C)C1	ZINC001025630407	1324481790	/nfs/dbraw/zinc/48/17/90/1324481790.db2.gz	SOGKUEPJPQPTBF-HKUYNNGSSA-N	0	3	326.484	3.349	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1[C@H]2CN(C/C=C/c3ccccc3)C[C@H]21	ZINC001025813564	1324513102	/nfs/dbraw/zinc/51/31/02/1324513102.db2.gz	QAFUWAYNIWQXJI-YLNUVFIUSA-N	0	3	347.462	3.048	20	30		EGEDHN
Cc1cocc1C(=O)N1C[C@@H]2CC[C@@H](NCc3ccccc3C#N)[C@@H]2C1	ZINC001026331167	1324730850	/nfs/dbraw/zinc/73/08/50/1324730850.db2.gz	QAYNXIUYHMUCNY-NLWGTHIKSA-N	0	3	349.434	3.100	20	30		EGEDHN
C=C1CCC(C(=O)NC2CCC(NCc3nccs3)CC2)CC1	ZINC001026553972	1324890458	/nfs/dbraw/zinc/89/04/58/1324890458.db2.gz	AFKRZVVZNCNLCV-UHFFFAOYSA-N	0	3	333.501	3.407	20	30		EGEDHN
N#Cc1ccccc1CNC1CCC(NC(=O)C2CC3(CC3)C2)CC1	ZINC001026557654	1324894647	/nfs/dbraw/zinc/89/46/47/1324894647.db2.gz	GWYQELNPKXLHMD-UHFFFAOYSA-N	0	3	337.467	3.265	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@@H](CNCc3ccccc3C#N)C2)s1	ZINC001026650709	1324950843	/nfs/dbraw/zinc/95/08/43/1324950843.db2.gz	QBTLLDBRGZJYFT-HNNXBMFYSA-N	0	3	339.464	3.180	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@H]1CCN(C(=O)c2cccs2)C1	ZINC001026658734	1324957174	/nfs/dbraw/zinc/95/71/74/1324957174.db2.gz	IEIYPAQJBUUIFG-CYBMUJFWSA-N	0	3	343.427	3.011	20	30		EGEDHN
Cc1cccc(C(=O)N2CC[C@@H](CNCc3ccccc3C#N)C2)c1	ZINC001026661546	1324959949	/nfs/dbraw/zinc/95/99/49/1324959949.db2.gz	LGAYEZHEEMQTNI-KRWDZBQOSA-N	0	3	333.435	3.119	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)CCC2CCC2)C1	ZINC001026760492	1325007584	/nfs/dbraw/zinc/00/75/84/1325007584.db2.gz	BNCOXJVRNRUAOL-KRWDZBQOSA-N	0	3	325.456	3.077	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)c2[nH]ccc2C)C1	ZINC000963293258	1325079234	/nfs/dbraw/zinc/07/92/34/1325079234.db2.gz	LJBXRPQSMPOYOX-HOTGVXAUSA-N	0	3	335.879	3.392	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCN(C(=O)[C@@H]2CCCC23CC3)C1	ZINC001026918046	1325080650	/nfs/dbraw/zinc/08/06/50/1325080650.db2.gz	MPRKZLVTLSSEQS-APWZRJJASA-N	0	3	337.467	3.077	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)c2cc(F)c[nH]2)C1	ZINC000963338545	1325129021	/nfs/dbraw/zinc/12/90/21/1325129021.db2.gz	WBPCERJUTRRHKR-BBRMVZONSA-N	0	3	339.842	3.223	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)C2(CF)CC2)C1	ZINC000963365831	1325169005	/nfs/dbraw/zinc/16/90/05/1325169005.db2.gz	QYUWGVPXIQSLSC-CABCVRRESA-N	0	3	328.859	3.192	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@H](CNCc2ccccc2C#N)C1	ZINC001027038060	1325172296	/nfs/dbraw/zinc/17/22/96/1325172296.db2.gz	HDYQXWFAONIPIU-JXFKEZNVSA-N	0	3	325.456	3.099	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](CNCc3oc(C(C)C)nc3C)C2)C1	ZINC001027050612	1325189343	/nfs/dbraw/zinc/18/93/43/1325189343.db2.gz	HBGJRKDUDXAWMF-INIZCTEOSA-N	0	3	345.487	3.401	20	30		EGEDHN
CC(F)(F)C(C)(C)C(=O)N1CC[C@@H](CNCc2ccccc2C#N)C1	ZINC001027193107	1325293709	/nfs/dbraw/zinc/29/37/09/1325293709.db2.gz	WQLGWBPPQDUBEO-AWEZNQCLSA-N	0	3	349.425	3.178	20	30		EGEDHN
CCC(C)(CC)C(=O)N1CC[C@@H](CNCc2ccccc2C#N)C1	ZINC001027226960	1325319585	/nfs/dbraw/zinc/31/95/85/1325319585.db2.gz	PNOSGCZIHDDCLC-INIZCTEOSA-N	0	3	327.472	3.323	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)c(F)c2)C1	ZINC001027276397	1325390788	/nfs/dbraw/zinc/39/07/88/1325390788.db2.gz	ITCAYEXPIHHYQG-KRWDZBQOSA-N	0	3	331.435	3.166	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)c2ccccc2)C1	ZINC001027277778	1325395973	/nfs/dbraw/zinc/39/59/73/1325395973.db2.gz	LSDNLTBQNAGEFL-FQEVSTJZSA-N	0	3	333.435	3.295	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)CC(C)(C)C)C1	ZINC001027303414	1325448224	/nfs/dbraw/zinc/44/82/24/1325448224.db2.gz	VNZDPGQWBBHVTA-GOSISDBHSA-N	0	3	327.472	3.417	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1cc(C)ccc1OC)C2	ZINC000964251626	1325492021	/nfs/dbraw/zinc/49/20/21/1325492021.db2.gz	YNSDAFKFZJDSLA-UHFFFAOYSA-N	0	3	348.874	3.387	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC[C@H](N(C)Cc2ccc(F)c(C#N)c2)C1	ZINC001027361031	1325543172	/nfs/dbraw/zinc/54/31/72/1325543172.db2.gz	XHKYIPLPWMFPOG-MYRMFFISSA-N	0	3	329.419	3.086	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)C[C@H](C)c1ccco1	ZINC000860473112	1329321907	/nfs/dbraw/zinc/32/19/07/1329321907.db2.gz	IJSXKUHAKPGFMS-QWHCGFSZSA-N	0	3	326.352	3.129	20	30		EGEDHN
CC(=O)N[C@@H](c1ccccc1F)[C@@H](C)NCc1ccc(C#N)c(F)c1	ZINC000926549757	1327612557	/nfs/dbraw/zinc/61/25/57/1327612557.db2.gz	IIIPODXLNHLWQX-CWTRNNRKSA-N	0	3	343.377	3.192	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)c2oc3c(cccc3F)c2C)C1	ZINC001027444252	1327683865	/nfs/dbraw/zinc/68/38/65/1327683865.db2.gz	QKDVZVUWYJDWIE-CQSZACIVSA-N	0	3	328.387	3.050	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)cc2)C1)C1CCC1	ZINC001027461017	1327707520	/nfs/dbraw/zinc/70/75/20/1327707520.db2.gz	SVFMKMZRHUAEBE-JXFKEZNVSA-N	0	3	339.483	3.417	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC001027467507	1327722226	/nfs/dbraw/zinc/72/22/26/1327722226.db2.gz	MNAIKCDIAFERBY-OAQYLSRUSA-N	0	3	347.462	3.224	20	30		EGEDHN
CN(Cc1ccc(F)c(C#N)c1)[C@H]1CCCN(C(=O)CC2(C)CC2)C1	ZINC001027496885	1327761209	/nfs/dbraw/zinc/76/12/09/1327761209.db2.gz	ZIIAAJRBZWXQHM-KRWDZBQOSA-N	0	3	343.446	3.310	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001027521700	1327794967	/nfs/dbraw/zinc/79/49/67/1327794967.db2.gz	JWNXQKMJFGXBMG-SFHVURJKSA-N	0	3	325.456	3.193	20	30		EGEDHN
CCC(C)(C)C(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001027551016	1327858402	/nfs/dbraw/zinc/85/84/02/1327858402.db2.gz	GTEMZGHEWFDOSE-GOSISDBHSA-N	0	3	327.472	3.417	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H](N(C)Cc2cccc(C#N)c2)C1)C(C)(F)F	ZINC001027580519	1327917230	/nfs/dbraw/zinc/91/72/30/1327917230.db2.gz	XGTVRWZNGUXTAM-RHSMWYFYSA-N	0	3	349.425	3.272	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)[C@H]2CC23CCC3)C1	ZINC001027597023	1327948593	/nfs/dbraw/zinc/94/85/93/1327948593.db2.gz	FWMPZZBFEBPNNZ-RBUKOAKNSA-N	0	3	337.467	3.171	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)c2ccc(Cl)c(CCC)c2)C1	ZINC001027648855	1328028809	/nfs/dbraw/zinc/02/88/09/1328028809.db2.gz	WUJAVLGWWWAGGF-QGZVFWFLSA-N	0	3	332.875	3.462	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)[C@@H](CC)Cc2ccccc2C)C1	ZINC001027650078	1328030288	/nfs/dbraw/zinc/03/02/88/1328030288.db2.gz	AKTNTOGKXOOZAS-ICSRJNTNSA-N	0	3	326.484	3.120	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2coc3c2cccc3OC)C1	ZINC000966136392	1328202360	/nfs/dbraw/zinc/20/23/60/1328202360.db2.gz	TUGIVDXIXAMARN-PBHICJAKSA-N	0	3	342.439	3.458	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2coc3c2cccc3OC)C1	ZINC000966136393	1328202700	/nfs/dbraw/zinc/20/27/00/1328202700.db2.gz	TUGIVDXIXAMARN-RHSMWYFYSA-N	0	3	342.439	3.458	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)C2(c3cccc(Cl)c3)CC2)C1	ZINC000966567437	1328344083	/nfs/dbraw/zinc/34/40/83/1328344083.db2.gz	RZPKITLZNWGGIK-YJBOKZPZSA-N	0	3	344.886	3.222	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2ccccc2-c2cn[nH]c2)C1	ZINC000966637860	1328363926	/nfs/dbraw/zinc/36/39/26/1328363926.db2.gz	ZFUWSHLINXFGSR-KXBFYZLASA-N	0	3	338.455	3.093	20	30		EGEDHN
C=CCCN1CCC[C@H]1CNC(=O)c1snc(Cl)c1Cl	ZINC001027908306	1328381222	/nfs/dbraw/zinc/38/12/22/1328381222.db2.gz	CDNXLSFYBDKPEA-VIFPVBQESA-N	0	3	334.272	3.220	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@H]1CCCN1Cc1ccc(C)cc1	ZINC001027931192	1328410567	/nfs/dbraw/zinc/41/05/67/1328410567.db2.gz	AEKMUCQKZJJYSZ-LJQANCHMSA-N	0	3	337.467	3.377	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2nccc3ccsc32)C1	ZINC000966846031	1328436481	/nfs/dbraw/zinc/43/64/81/1328436481.db2.gz	OOQFXMSEWMQUKO-HIFRSBDPSA-N	0	3	329.469	3.313	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1coc2ccc(OC)cc12	ZINC001028016209	1328478404	/nfs/dbraw/zinc/47/84/04/1328478404.db2.gz	FDDRGLHLGHQKDW-AWEZNQCLSA-N	0	3	328.412	3.212	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(O[C@@H](C)C#N)cc1)NC(=O)OC(C)(C)C	ZINC000862541257	1329494860	/nfs/dbraw/zinc/49/48/60/1329494860.db2.gz	RKPOBMDKKGOLNJ-CABCVRRESA-N	0	3	347.459	3.322	20	30		EGEDHN
C[C@H](NC(=O)Nc1sccc1C#N)[C@H](c1ccccc1)N(C)C	ZINC000931836783	1329765201	/nfs/dbraw/zinc/76/52/01/1329765201.db2.gz	AOXQSNQDMDGSLT-SWLSCSKDSA-N	0	3	328.441	3.433	20	30		EGEDHN
C#Cc1ccc(NC(=O)N[C@@H](CN(C)C)c2ccc(OC)cc2)cc1	ZINC000934926092	1330018033	/nfs/dbraw/zinc/01/80/33/1330018033.db2.gz	FVUABAKMUPRCIA-IBGZPJMESA-N	0	3	337.423	3.101	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](C)[C@H](NCc3ccc(Cl)nc3)C2)C1	ZINC000939103809	1330377211	/nfs/dbraw/zinc/37/72/11/1330377211.db2.gz	YRJDUFZABVTLLN-UKRRQHHQSA-N	0	3	333.863	3.028	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccccc2C(C)(C)C)[C@H](C)C1	ZINC000942164440	1331855285	/nfs/dbraw/zinc/85/52/85/1331855285.db2.gz	RUKWBUYUVRVXFH-APWZRJJASA-N	0	3	326.484	3.448	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(C)c(Cl)c2)[C@@H](C)C1	ZINC000942175676	1331861315	/nfs/dbraw/zinc/86/13/15/1331861315.db2.gz	JGZNBHOVLMYSEL-YJBOKZPZSA-N	0	3	332.875	3.041	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2c(C)c(F)ccc2Cl)[C@@H](C)C1	ZINC000942194165	1331873859	/nfs/dbraw/zinc/87/38/59/1331873859.db2.gz	ZSTVMXCLWYBMOI-BLLLJJGKSA-N	0	3	336.838	3.251	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2sc(C)nc2CC(C)C)[C@H](C)C1	ZINC000942312892	1331900325	/nfs/dbraw/zinc/90/03/25/1331900325.db2.gz	CRKXCIRUZSHBMT-ZBFHGGJFSA-N	0	3	347.528	3.114	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C3CC3)oc2C2CC2)[C@H](C)C1	ZINC000942525591	1331956203	/nfs/dbraw/zinc/95/62/03/1331956203.db2.gz	RPUUZFTZVTWONP-KDOFPFPSSA-N	0	3	340.467	3.498	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2nsc3ccc(C)cc32)[C@@H](C)C1	ZINC000942561929	1331975826	/nfs/dbraw/zinc/97/58/26/1331975826.db2.gz	DYFUJDMUBQIMJO-GOEBONIOSA-N	0	3	341.480	3.068	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C(C)(C)c2ccc(Cl)cc2)[C@H](C)C1	ZINC000942594768	1331994630	/nfs/dbraw/zinc/99/46/30/1331994630.db2.gz	OBFDHUOSPWTVNK-QAPCUYQASA-N	0	3	346.902	3.468	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccc(F)c(Cl)c2F)[C@H](C)C1	ZINC000942602934	1332000220	/nfs/dbraw/zinc/00/02/20/1332000220.db2.gz	PQUFYGVZYNWBAC-ZWNOBZJWSA-N	0	3	328.790	3.244	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccccc2OC2CCC2)[C@@H](C)C1	ZINC000942703331	1332023701	/nfs/dbraw/zinc/02/37/01/1332023701.db2.gz	XTWLUKPRFDQDQQ-MAUKXSAKSA-N	0	3	328.456	3.244	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(C(C)(C)C)cc2)[C@H](C)C1	ZINC000942959036	1332067260	/nfs/dbraw/zinc/06/72/60/1332067260.db2.gz	JELXYLJTCJSIFN-XLIONFOSSA-N	0	3	340.511	3.377	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(C)oc2C(F)(F)F)[C@H](C)C1	ZINC000943209075	1332121608	/nfs/dbraw/zinc/12/16/08/1332121608.db2.gz	ODSKNWOVOSRGOR-MFKMUULPSA-N	0	3	330.350	3.233	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnc(-c3ccoc3)s2)[C@H](C)C1	ZINC000943333267	1332151047	/nfs/dbraw/zinc/15/10/47/1332151047.db2.gz	HTYOZWSVEWOBRU-OCCSQVGLSA-N	0	3	331.441	3.029	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccccc2OCC(C)C)[C@H](C)C1	ZINC000943690507	1332239309	/nfs/dbraw/zinc/23/93/09/1332239309.db2.gz	SWSKFRRSFCEKLO-AEFFLSMTSA-N	0	3	330.472	3.348	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cnc(CC(C)(C)C)s2)[C@@H](C)C1	ZINC000944031769	1332311929	/nfs/dbraw/zinc/31/19/29/1332311929.db2.gz	DFYYNFPUUDGFTD-GJZGRUSLSA-N	0	3	347.528	3.195	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C(C)(C)c2ccc(CC)cc2)[C@@H](C)C1	ZINC000944080851	1332323633	/nfs/dbraw/zinc/32/36/33/1332323633.db2.gz	OWHFVOAYGGAZDQ-PXNSSMCTSA-N	0	3	340.511	3.377	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccccc2C(F)(F)F)[C@H](C)C1	ZINC000944266209	1332358232	/nfs/dbraw/zinc/35/82/32/1332358232.db2.gz	XRGXWWCEDBFCGB-CZUORRHYSA-N	0	3	338.373	3.169	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc(Cl)c2Cl)[C@@H](C)C1	ZINC000944303075	1332366922	/nfs/dbraw/zinc/36/69/22/1332366922.db2.gz	AETIIHMUDNLOTR-WFASDCNBSA-N	0	3	339.266	3.457	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@H](C)C1	ZINC000944303109	1332367426	/nfs/dbraw/zinc/36/74/26/1332367426.db2.gz	AWOUACGNAOYJPN-CJNGLKHVSA-N	0	3	338.373	3.169	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)CC23CC4CC(CC(C4)C2)C3)[C@@H](C)C1	ZINC000944307283	1332369647	/nfs/dbraw/zinc/36/96/47/1332369647.db2.gz	XENPYXRRMPSAFD-GZKSLDRRSA-N	0	3	328.500	3.053	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(-c3ccccc3)cc2)[C@@H](C)C1	ZINC000944530797	1332414344	/nfs/dbraw/zinc/41/43/44/1332414344.db2.gz	GWBWRVDKZQCRAN-UWJYYQICSA-N	0	3	332.447	3.427	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2sc(C(C)C)nc2C)[C@@H](C)C1	ZINC000944905670	1332450412	/nfs/dbraw/zinc/45/04/12/1332450412.db2.gz	DNMWTBQZQPZMDF-DZGCQCFKSA-N	0	3	333.501	3.038	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3cc(C)c(C)o3)CC[C@@H]2C1	ZINC000946552442	1332853398	/nfs/dbraw/zinc/85/33/98/1332853398.db2.gz	BCNCLOACMKWTNG-IYBDPMFKSA-N	0	3	336.863	3.433	20	30		EGEDHN
Cc1ccncc1C(=O)N[C@H]1CCN(Cc2ccc(C#N)cc2)[C@H](C)C1	ZINC000947163237	1333030807	/nfs/dbraw/zinc/03/08/07/1333030807.db2.gz	SOKVRWSGBUYDJO-APWZRJJASA-N	0	3	348.450	3.045	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)C2CC(C)(C)C2)CCN1Cc1ccc(C#N)cc1	ZINC000947278183	1333075418	/nfs/dbraw/zinc/07/54/18/1333075418.db2.gz	XJBLOPQNYWEQEF-KXBFYZLASA-N	0	3	339.483	3.464	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)C2C=CC=CC=C2)CCN1Cc1ccc(C#N)cc1	ZINC000947362079	1333103978	/nfs/dbraw/zinc/10/39/78/1333103978.db2.gz	USYVIPKKQVNGBC-LAUBAEHRSA-N	0	3	347.462	3.326	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C3CCCCC3)n[nH]2)C[C@H]1C	ZINC000947403857	1333116618	/nfs/dbraw/zinc/11/66/18/1333116618.db2.gz	HVCQXZPDPSZIQH-NVXWUHKLSA-N	0	3	342.487	3.063	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)Cc2ccccc2)CCN1Cc1ccc(C#N)cc1	ZINC000947455610	1333135422	/nfs/dbraw/zinc/13/54/22/1333135422.db2.gz	UVKHQHWESHGKBO-UWJYYQICSA-N	0	3	347.462	3.270	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)nn2C(CC)CC)C[C@@H]1C	ZINC000947471387	1333141771	/nfs/dbraw/zinc/14/17/71/1333141771.db2.gz	BNJDMXDNJKVMNZ-IRXDYDNUSA-N	0	3	344.503	3.159	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2oc3ccccc3c2OC)C[C@H]1C	ZINC000947611887	1333192748	/nfs/dbraw/zinc/19/27/48/1333192748.db2.gz	ROOWLWSQAWLIAO-HUUCEWRRSA-N	0	3	340.423	3.047	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc(F)c(Cl)c2F)C[C@H]1C	ZINC000947692743	1333226257	/nfs/dbraw/zinc/22/62/57/1333226257.db2.gz	AJKJGIQAIXEWKH-MNOVXSKESA-N	0	3	328.790	3.387	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C(C)(C)c2cccc(F)c2)C[C@H]1C	ZINC000947718813	1333239703	/nfs/dbraw/zinc/23/97/03/1333239703.db2.gz	CGRDWURVTQXTOL-CRAIPNDOSA-N	0	3	330.447	3.096	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C(C)(C)c2cccc(Cl)c2)C[C@@H]1C	ZINC000947758249	1333253508	/nfs/dbraw/zinc/25/35/08/1333253508.db2.gz	KSEJTODGCQOPOD-YOEHRIQHSA-N	0	3	332.875	3.220	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2csc(-c3ccoc3)n2)C[C@H]1C	ZINC000947820395	1333270819	/nfs/dbraw/zinc/27/08/19/1333270819.db2.gz	LCTNTUAITFQDRW-OCCSQVGLSA-N	0	3	331.441	3.172	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2sc(CC3CC3)nc2C)C[C@H]1C	ZINC000947862048	1333284545	/nfs/dbraw/zinc/28/45/45/1333284545.db2.gz	RLZQOMRGXDEGTE-DOMZBBRYSA-N	0	3	333.501	3.173	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnoc2-c2ccccc2)C[C@@H]1C	ZINC000947878022	1333288179	/nfs/dbraw/zinc/28/81/79/1333288179.db2.gz	JJSWMUJCPAXMFL-HOCLYGCPSA-N	0	3	325.412	3.110	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cnc(CC(C)(C)C)s2)C[C@@H]1C	ZINC000947903008	1333299470	/nfs/dbraw/zinc/29/94/70/1333299470.db2.gz	BCXSCMHEXMCFLL-GJZGRUSLSA-N	0	3	347.528	3.338	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C(C)(C)c2ccccc2Cl)C[C@H]1C	ZINC000947948409	1333315658	/nfs/dbraw/zinc/31/56/58/1333315658.db2.gz	NKAPCTSULDQCOS-CABCVRRESA-N	0	3	332.875	3.220	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2)C[C@@H]1C	ZINC000947963065	1333322873	/nfs/dbraw/zinc/32/28/73/1333322873.db2.gz	QVKPYDUAIZDBGV-XJKSGUPXSA-N	0	3	338.373	3.311	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C23CC4CC(CC(C4)C2)C3)C[C@H]1C	ZINC000947966435	1333323504	/nfs/dbraw/zinc/32/35/04/1333323504.db2.gz	ASNZERARSDUTPH-CYSNLQCGSA-N	0	3	328.500	3.195	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)[C@@]2(c3ccccc3)C[C@H](F)C2)C[C@H]1C	ZINC000947980974	1333331078	/nfs/dbraw/zinc/33/10/78/1333331078.db2.gz	SLLWDUZAEZGOCX-XLBJILASSA-N	0	3	342.458	3.049	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc3[nH]c(C)c(C)c3c2)C[C@H]1C	ZINC000948025304	1333344994	/nfs/dbraw/zinc/34/49/94/1333344994.db2.gz	GCRRCBOISTZLNW-RDTXWAMCSA-N	0	3	337.467	3.391	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(CC)c(CC)c2)C[C@@H]1C	ZINC000948105301	1333375774	/nfs/dbraw/zinc/37/57/74/1333375774.db2.gz	UNUAGZRQCIZUBJ-JXFKEZNVSA-N	0	3	326.484	3.417	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)C2(c3ccc(F)cc3)CC2)CC1	ZINC000948421592	1333519280	/nfs/dbraw/zinc/51/92/80/1333519280.db2.gz	WKRFAKRHEDXAGP-LJQANCHMSA-N	0	3	342.458	3.194	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2cncc(-c3ccccc3)c2)CC1	ZINC000948426117	1333520795	/nfs/dbraw/zinc/52/07/95/1333520795.db2.gz	VPLMYDNNJAPQBJ-NRFANRHFSA-N	0	3	347.462	3.308	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2cc(C)c3ccccc3n2)CC1	ZINC000948546975	1333567284	/nfs/dbraw/zinc/56/72/84/1333567284.db2.gz	NSDDHWOVCIDYKC-QGZVFWFLSA-N	0	3	335.451	3.103	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2cccc3c(C)c(C)[nH]c32)CC1	ZINC000948546860	1333567416	/nfs/dbraw/zinc/56/74/16/1333567416.db2.gz	JTZGLLBLZBMADZ-KRWDZBQOSA-N	0	3	337.467	3.344	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2ccc3cc(C)ccc3n2)CC1	ZINC000948605439	1333593688	/nfs/dbraw/zinc/59/36/88/1333593688.db2.gz	QBCKNFFBDSNEIN-GOSISDBHSA-N	0	3	335.451	3.103	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cc(F)c(F)cc2F)CC1	ZINC000948730294	1333650541	/nfs/dbraw/zinc/65/05/41/1333650541.db2.gz	VJTDWLYGDXJVQM-ZDUSSCGKSA-N	0	3	338.373	3.054	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2c(F)ccc(C)c2F)CC1	ZINC000948746750	1333656533	/nfs/dbraw/zinc/65/65/33/1333656533.db2.gz	JBYDVIIKTXEATQ-HNNXBMFYSA-N	0	3	334.410	3.223	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2ccc(OC)cc2Cl)CC1	ZINC000948865389	1333714754	/nfs/dbraw/zinc/71/47/54/1333714754.db2.gz	QJZXWCQHCXOKIJ-HNNXBMFYSA-N	0	3	348.874	3.298	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@]1(C)CCC[C@@H]1CC)CCO2	ZINC000949124156	1333781186	/nfs/dbraw/zinc/78/11/86/1333781186.db2.gz	RRUNNPOKPVUBMX-PKOBYXMFSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H]1[C@@H](C=C(C)C)C1(C)C)CCO2	ZINC000949135069	1333782972	/nfs/dbraw/zinc/78/29/72/1333782972.db2.gz	CBRYMYPVBUUSOS-MSOLQXFVSA-N	0	3	346.515	3.104	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@@H](C)C1CCCCC1)CCO2	ZINC000949207038	1333795988	/nfs/dbraw/zinc/79/59/88/1333795988.db2.gz	IAQQDCYFLORXPF-GOSISDBHSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@@H]1CCCCC1(C)C)CCO2	ZINC000949258296	1333805376	/nfs/dbraw/zinc/80/53/76/1333805376.db2.gz	VPBRVRZCVJRWMF-SFHVURJKSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3cc[nH]c3C(C)C)CC2)C1	ZINC000949447160	1333849490	/nfs/dbraw/zinc/84/94/90/1333849490.db2.gz	LJORZPBWHLGEFK-UHFFFAOYSA-N	0	3	345.487	3.021	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC3(CC2)CN(CCC(C)C)CCO3)CC1	ZINC000949458784	1333852644	/nfs/dbraw/zinc/85/26/44/1333852644.db2.gz	UXSGHQOALPEHCQ-UHFFFAOYSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@]3(C)CCC[C@@H]3C)CC2)C1	ZINC000949463129	1333854322	/nfs/dbraw/zinc/85/43/22/1333854322.db2.gz	KGEMQOPQRREAKF-PKOBYXMFSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@H]3CCC[C@@H]3CC)CC2)C1	ZINC000949466993	1333855678	/nfs/dbraw/zinc/85/56/78/1333855678.db2.gz	YHNSWWPATFWDCC-OALUTQOASA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@H]3C[C@H](C)C[C@H](C)C3)CC2)C1	ZINC000949533676	1333869649	/nfs/dbraw/zinc/86/96/49/1333869649.db2.gz	CVACVOLCKWFJAU-BWTSREIZSA-N	0	3	348.531	3.328	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccc3c4c(cccc42)CC3)C1	ZINC000967287049	1335689948	/nfs/dbraw/zinc/68/99/48/1335689948.db2.gz	CRVGEZQXXVCSKH-IERDGZPVSA-N	0	3	346.474	3.402	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2cnc(CC3CC3)s2)C1	ZINC000967402219	1335727283	/nfs/dbraw/zinc/72/72/83/1335727283.db2.gz	ONOVCNNFTIIUIY-DZGCQCFKSA-N	0	3	333.501	3.112	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2cc3ccc(OC)cc3[nH]2)C1	ZINC000967655006	1335800926	/nfs/dbraw/zinc/80/09/26/1335800926.db2.gz	GYESVGQFSDXJCZ-LIRRHRJNSA-N	0	3	341.455	3.193	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)Cc2cn(C)c3ccccc23)C1	ZINC000968104606	1335857632	/nfs/dbraw/zinc/85/76/32/1335857632.db2.gz	GMYSYPJJNRMGDK-LPHOPBHVSA-N	0	3	339.483	3.124	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)Cc2ccc(F)cc2Cl)C1	ZINC000968212528	1335873116	/nfs/dbraw/zinc/87/31/16/1335873116.db2.gz	NEPDFQXYPHOAAI-DYVFJYSZSA-N	0	3	338.854	3.424	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)Cc2cccc(Cl)c2F)C1	ZINC000968354151	1335899621	/nfs/dbraw/zinc/89/96/21/1335899621.db2.gz	NQPCNAWPUXCPLX-CJNGLKHVSA-N	0	3	338.854	3.424	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2ccc(OC(C)C)cc2)C1	ZINC000968611516	1335984539	/nfs/dbraw/zinc/98/45/39/1335984539.db2.gz	XCMDCXPQZBJOQP-VQIMIIECSA-N	0	3	330.472	3.490	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccc(OCC(C)C)cc2)C1	ZINC000968620324	1335986282	/nfs/dbraw/zinc/98/62/82/1335986282.db2.gz	STPKBNYCLLEUGQ-PXNSSMCTSA-N	0	3	342.483	3.185	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2sc(CCC)nc2C)C1	ZINC000968643413	1335993967	/nfs/dbraw/zinc/99/39/67/1335993967.db2.gz	LTPATPXISAXOKM-ZFWWWQNUSA-N	0	3	335.517	3.420	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)C2(c3cc(C)cc(C)c3)CC2)C1	ZINC000968652181	1335997100	/nfs/dbraw/zinc/99/71/00/1335997100.db2.gz	PZOTZFPSHYBEPE-UYAOXDASSA-N	0	3	338.495	3.185	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(N(C)CC)cc2)C1	ZINC000968701294	1336017175	/nfs/dbraw/zinc/01/71/75/1336017175.db2.gz	FOYQDBJJPANGFG-APWZRJJASA-N	0	3	329.488	3.159	20	30		EGEDHN
N#Cc1ccc(CN2CCCCC[C@H]2CNC(=O)C2CC=CC2)cc1	ZINC000968790708	1336051500	/nfs/dbraw/zinc/05/15/00/1336051500.db2.gz	GVUCMOFORZUUJN-FQEVSTJZSA-N	0	3	337.467	3.385	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1cccc2scnc21	ZINC000968859042	1336070491	/nfs/dbraw/zinc/07/04/91/1336070491.db2.gz	KZZRGDVDBRNOQH-HNNXBMFYSA-N	0	3	341.480	3.294	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1c(Cl)n[nH]c1C1CC1	ZINC000968891047	1336082314	/nfs/dbraw/zinc/08/23/14/1336082314.db2.gz	RTBCYJZICKBAFJ-CYBMUJFWSA-N	0	3	336.867	3.101	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)[C@H]1CCN(C)c2ccccc21	ZINC000968893850	1336083109	/nfs/dbraw/zinc/08/31/09/1336083109.db2.gz	SAASIMWWERTFSX-MJGOQNOKSA-N	0	3	341.499	3.157	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cnoc1-c1ccco1	ZINC000968916693	1336088274	/nfs/dbraw/zinc/08/82/74/1336088274.db2.gz	GUCIOHRYORMLDA-AWEZNQCLSA-N	0	3	329.400	3.095	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cnn(-c2ccccc2)c1	ZINC000968938839	1336096990	/nfs/dbraw/zinc/09/69/90/1336096990.db2.gz	UGGGISDSTDSZPZ-LJQANCHMSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1ncoc1[C@@H]1CCCO1	ZINC000968972950	1336105859	/nfs/dbraw/zinc/10/58/59/1336105859.db2.gz	BJCDOYADOKBWLL-CVEARBPZSA-N	0	3	347.459	3.077	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1ccc(OCC)c(C)c1	ZINC000969056722	1336131706	/nfs/dbraw/zinc/13/17/06/1336131706.db2.gz	LFWPLUHYTRMKBU-LJQANCHMSA-N	0	3	342.483	3.391	20	30		EGEDHN
C#CCCN1CCCCC[C@@H]1CNC(=O)c1oc(C(C)C)nc1C	ZINC000969061845	1336134490	/nfs/dbraw/zinc/13/44/90/1336134490.db2.gz	FFZIIMNKHFTFSR-MRXNPFEDSA-N	0	3	331.460	3.104	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccc(-c2c[nH]cn2)cc1	ZINC000969100797	1336143665	/nfs/dbraw/zinc/14/36/65/1336143665.db2.gz	IKQWKCWSMFFXKS-SFHVURJKSA-N	0	3	338.455	3.237	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cc(C(F)(F)F)ccn1	ZINC000969103585	1336144983	/nfs/dbraw/zinc/14/49/83/1336144983.db2.gz	YXLAAJHOURBEGK-AWEZNQCLSA-N	0	3	341.377	3.261	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1cc2c(s1)CCOC2	ZINC000969118536	1336149849	/nfs/dbraw/zinc/14/98/49/1336149849.db2.gz	RGSJPPLCFGUIGJ-INIZCTEOSA-N	0	3	348.512	3.371	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cc2c(cccc2OC)[nH]1	ZINC000969142181	1336160220	/nfs/dbraw/zinc/16/02/20/1336160220.db2.gz	XSUFCWDGFHXVQH-HNNXBMFYSA-N	0	3	341.455	3.337	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@H](C)C2CN(CC=C(C)C)C2)cc1	ZINC000969989424	1336269337	/nfs/dbraw/zinc/26/93/37/1336269337.db2.gz	OKFPHWZDAWSPOK-MRXNPFEDSA-N	0	3	328.456	3.268	20	30		EGEDHN
CN(C(=O)[C@H]1CCC1(F)F)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001005561099	1336371659	/nfs/dbraw/zinc/37/16/59/1336371659.db2.gz	ZEKWIDATRQEZEM-QGZVFWFLSA-N	0	3	347.409	3.026	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cnoc2-c2ccco2)CC1	ZINC001005600102	1336378436	/nfs/dbraw/zinc/37/84/36/1336378436.db2.gz	RNLFFWJCVZDERK-UHFFFAOYSA-N	0	3	329.400	3.047	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cc(C)cc(OC)c2C)CC1	ZINC001005665945	1336389304	/nfs/dbraw/zinc/38/93/04/1336389304.db2.gz	DOCQYKWEPMKUMS-UHFFFAOYSA-N	0	3	330.472	3.425	20	30		EGEDHN
C=C1CCC(C(=O)N(C)C2CCN(CCc3ccns3)CC2)CC1	ZINC001005938613	1336426393	/nfs/dbraw/zinc/42/63/93/1336426393.db2.gz	TYRNYBBDIRGNID-UHFFFAOYSA-N	0	3	347.528	3.355	20	30		EGEDHN
CN(C(=O)[C@@H]1CC12CCC2)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001006069808	1336446388	/nfs/dbraw/zinc/44/63/88/1336446388.db2.gz	HYFRCHNDSHBDBD-IBGZPJMESA-N	0	3	337.467	3.171	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cnn(C3CCCC3)c2C)CC1	ZINC001006268432	1336479026	/nfs/dbraw/zinc/47/90/26/1336479026.db2.gz	XIZPHGMUQXHQLP-UHFFFAOYSA-N	0	3	330.476	3.029	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2ccc(-c3ccncc3)o2)C1	ZINC001007494378	1336657360	/nfs/dbraw/zinc/65/73/60/1336657360.db2.gz	XNRKHUZJPKYZHT-MRXNPFEDSA-N	0	3	325.412	3.112	20	30		EGEDHN
C#CCCN1CCC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2)C1	ZINC001008830712	1336932353	/nfs/dbraw/zinc/93/23/53/1336932353.db2.gz	ZXNOCESRLABXIZ-FGTMMUONSA-N	0	3	330.859	3.047	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN([C@H](C)c3ccccc3C)C2)nc1	ZINC001009254384	1336991380	/nfs/dbraw/zinc/99/13/80/1336991380.db2.gz	QZHHLPMBSAMFRK-IEBWSBKVSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCN([C@@H](C)c3cccc(C)c3)C2)cn1	ZINC001009273197	1336994749	/nfs/dbraw/zinc/99/47/49/1336994749.db2.gz	DNBSFKLEAWOYGK-UWJYYQICSA-N	0	3	347.462	3.327	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)Cc2ccc3c(c2)CCCC3)C1	ZINC001009472744	1337028556	/nfs/dbraw/zinc/02/85/56/1337028556.db2.gz	VWVDAJKWCPYDQG-HXUWFJFHSA-N	0	3	326.484	3.265	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(CCCc3cccc(OC)c3)C2)C1	ZINC001015671945	1338248914	/nfs/dbraw/zinc/24/89/14/1338248914.db2.gz	IQOYUEVZHDJZIN-SFHVURJKSA-N	0	3	342.483	3.175	20	30		EGEDHN
Cc1occc1C(=O)N[C@H]1CC12CCN(Cc1cccc(C#N)c1)CC2	ZINC001016493579	1338624308	/nfs/dbraw/zinc/62/43/08/1338624308.db2.gz	DAWZSWKYBXLASO-IBGZPJMESA-N	0	3	349.434	3.244	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@H]3NC(=O)C=C3CCC3)CC2)c1	ZINC001016564651	1338647700	/nfs/dbraw/zinc/64/77/00/1338647700.db2.gz	QXLGJMVGJBCNQS-LJQANCHMSA-N	0	3	335.451	3.139	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2oc3c(cccc3F)c2C)CC1	ZINC001016664924	1338684694	/nfs/dbraw/zinc/68/46/94/1338684694.db2.gz	ZXBGYTSZHVCHIY-INIZCTEOSA-N	0	3	340.398	3.098	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2coc3cc(F)ccc32)CC1	ZINC001016703330	1338696664	/nfs/dbraw/zinc/69/66/64/1338696664.db2.gz	WYJZAYHUYXWKQH-GOSISDBHSA-N	0	3	340.398	3.180	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)Cc2ccc(CC(C)C)cc2)CC1	ZINC001016715542	1338700970	/nfs/dbraw/zinc/70/09/70/1338700970.db2.gz	NDKXPUKMJSOYFY-HXUWFJFHSA-N	0	3	338.495	3.032	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2sc3ccccc3c2C)CC1	ZINC001016719263	1338702092	/nfs/dbraw/zinc/70/20/92/1338702092.db2.gz	MKKMVMMRJCGZBN-KRWDZBQOSA-N	0	3	338.476	3.427	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccc(C)c3cccnc23)CC1	ZINC001016734868	1338706434	/nfs/dbraw/zinc/70/64/34/1338706434.db2.gz	YSIFFBWHPJRKNV-LJQANCHMSA-N	0	3	347.462	3.151	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)[C@@H](C)c2ccc(Cl)cc2)CC1	ZINC001016809628	1338733693	/nfs/dbraw/zinc/73/36/93/1338733693.db2.gz	ZQTJKENNYBHLFQ-WMLDXEAASA-N	0	3	330.859	3.047	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2c(F)cccc2Cl)CC1	ZINC001016940010	1338777035	/nfs/dbraw/zinc/77/70/35/1338777035.db2.gz	LPWVAKXSADUPTP-OAHLLOKOSA-N	0	3	334.822	3.087	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)C[C@@H]2CCCc3ccccc32)CC1	ZINC001016940632	1338777433	/nfs/dbraw/zinc/77/74/33/1338777433.db2.gz	SRGRPHRBJWXNCK-AZUAARDMSA-N	0	3	336.479	3.101	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2csc3c2CC[C@@H](C)C3)CC1	ZINC001016957045	1338783760	/nfs/dbraw/zinc/78/37/60/1338783760.db2.gz	WCDQCOSADYRLAL-RDTXWAMCSA-N	0	3	342.508	3.090	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2cc3c(s2)CC[C@@H](C)C3)CC1	ZINC001016964146	1338786614	/nfs/dbraw/zinc/78/66/14/1338786614.db2.gz	YYTYTRLCEKTZBC-KDOFPFPSSA-N	0	3	342.508	3.090	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2sc(CCC)nc2C)CC1	ZINC001016976233	1338789402	/nfs/dbraw/zinc/78/94/02/1338789402.db2.gz	VUYLBROAPBTRJV-HNNXBMFYSA-N	0	3	345.512	3.012	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCCN(C(=O)/C=C\C2CC2)C1	ZINC001017089874	1338857611	/nfs/dbraw/zinc/85/76/11/1338857611.db2.gz	YRTWZGODNOIHIC-HWYHOQROSA-N	0	3	343.496	3.256	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CCC[C@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001017183111	1338927876	/nfs/dbraw/zinc/92/78/76/1338927876.db2.gz	BIZVISXTEUURER-CZUORRHYSA-N	0	3	337.464	3.038	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccc2ncccc12	ZINC001017729358	1339405662	/nfs/dbraw/zinc/40/56/62/1339405662.db2.gz	ARYKURZZSZWOMP-KDURUIRLSA-N	0	3	349.478	3.419	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CCc1nc(C)cs1	ZINC001017739368	1339408196	/nfs/dbraw/zinc/40/81/96/1339408196.db2.gz	JEMXGCFQHGFHCU-IYBDPMFKSA-N	0	3	333.501	3.026	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)c1c(C)noc1C	ZINC001018061499	1339492904	/nfs/dbraw/zinc/49/29/04/1339492904.db2.gz	OBGRABRANWRHQK-XYPHTWIQSA-N	0	3	331.460	3.036	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@H]1CCO[C@H](C(C)C)C1	ZINC001018157286	1339517836	/nfs/dbraw/zinc/51/78/36/1339517836.db2.gz	ODYACOGDVGQLNK-OKYOBFRVSA-N	0	3	334.504	3.079	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cnn(CCCC)c1C	ZINC001018157968	1339518293	/nfs/dbraw/zinc/51/82/93/1339518293.db2.gz	RDIJLQURDFEQNO-HDICACEKSA-N	0	3	344.503	3.247	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cc(CC(C)C)c[nH]1	ZINC001018177635	1339522887	/nfs/dbraw/zinc/52/28/87/1339522887.db2.gz	DJODXIJXGBHIKK-HDICACEKSA-N	0	3	329.488	3.468	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1cc(C)ccc1F	ZINC001018199908	1339529615	/nfs/dbraw/zinc/52/96/15/1339529615.db2.gz	RXVWKJXABQLSNY-HDICACEKSA-N	0	3	330.447	3.318	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc(OC(C)C)cc1	ZINC001018301857	1339568723	/nfs/dbraw/zinc/56/87/23/1339568723.db2.gz	LTURGGAZHKMVAD-KDURUIRLSA-N	0	3	342.483	3.268	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](OC)C1CCCCC1	ZINC001018355612	1339588520	/nfs/dbraw/zinc/58/85/20/1339588520.db2.gz	QMKDBSXUDFPPLI-CEXWTWQISA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1ccc(OCC2CC2)cc1	ZINC001028324948	1340565571	/nfs/dbraw/zinc/56/55/71/1340565571.db2.gz	FRJPSBRJVDBCJM-GOSISDBHSA-N	0	3	328.456	3.246	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1cccc2c1OCC2(C)C	ZINC001028354052	1340589994	/nfs/dbraw/zinc/58/99/94/1340589994.db2.gz	ITAZMJQJILQZAL-OAHLLOKOSA-N	0	3	328.456	3.127	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)c2cc(Cl)sc2Cl)C1	ZINC001028594115	1340719060	/nfs/dbraw/zinc/71/90/60/1340719060.db2.gz	BQDLABQXDXRUJS-JTQLQIEISA-N	0	3	331.268	3.130	20	30		EGEDHN
CC(C)(C)[C@@H]1C[C@H]1C(=O)NC[C@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC001028683841	1340756242	/nfs/dbraw/zinc/75/62/42/1340756242.db2.gz	HDNYWZYNCHULHP-GUDVDZBRSA-N	0	3	339.483	3.179	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H]1C(=O)NC[C@H]1CCN(Cc2ccc(C#N)cc2)C1	ZINC001028812727	1340830997	/nfs/dbraw/zinc/83/09/97/1340830997.db2.gz	MFBRAKRUCQUGTN-VAMGGRTRSA-N	0	3	339.483	3.179	20	30		EGEDHN
C#CCN1CC[C@@H](CNC(=O)[C@@H]2C[C@H]2c2ccc3ccccc3c2)C1	ZINC001028873988	1340873412	/nfs/dbraw/zinc/87/34/12/1340873412.db2.gz	NDNVZJKFDLBCQR-ORYQWCPZSA-N	0	3	332.447	3.015	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)NC[C@@H]2CCN(Cc3cccc(C#N)c3)C2)CC1	ZINC001028938448	1340887582	/nfs/dbraw/zinc/88/75/82/1340887582.db2.gz	PJZMAIITDCVUHL-VDGAXYAQSA-N	0	3	339.483	3.323	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)c2ccc(-c3ccccc3)cc2)C1	ZINC001028960731	1340893634	/nfs/dbraw/zinc/89/36/34/1340893634.db2.gz	JZJNONMNYDNSRC-GOSISDBHSA-N	0	3	332.447	3.429	20	30		EGEDHN
CC(C)=CC(=O)N1CCC([C@@H](C)NCc2cc(F)ccc2C#N)CC1	ZINC001029039252	1340914595	/nfs/dbraw/zinc/91/45/95/1340914595.db2.gz	QVCIVIPWXOPVKM-OAHLLOKOSA-N	0	3	343.446	3.380	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)C1CCN(C(=O)CC2CCC2)CC1	ZINC001029078793	1340925443	/nfs/dbraw/zinc/92/54/43/1340925443.db2.gz	SRUVLWKPDDJKRC-MRXNPFEDSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)C1CCN(C(=O)[C@@H]2CC2(C)C)CC1	ZINC001029084218	1340927142	/nfs/dbraw/zinc/92/71/42/1340927142.db2.gz	QSIKZXKLPBJFLX-BEFAXECRSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC([C@@H](C)NCc2cc(C3CC3)no2)CC1	ZINC001029124858	1340935923	/nfs/dbraw/zinc/93/59/23/1340935923.db2.gz	CLAPTPSMOHVMFD-CQSZACIVSA-N	0	3	345.487	3.481	20	30		EGEDHN
CC(C)[C@H](F)C(=O)N1CCC([C@@H](C)NCc2ccccc2C#N)CC1	ZINC001029132015	1340938768	/nfs/dbraw/zinc/93/87/68/1340938768.db2.gz	YXXGXUZZCMAZLZ-BEFAXECRSA-N	0	3	345.462	3.269	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CC[C@@H](C1)N2CCC1CCOCC1	ZINC001029454205	1340993728	/nfs/dbraw/zinc/99/37/28/1340993728.db2.gz	VJGGHHZNBIUZOK-NSHGMRRFSA-N	0	3	334.504	3.081	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@H](CN(C)Cc2ccc(C#N)s2)C1)C1CCC1	ZINC001029766414	1341066408	/nfs/dbraw/zinc/06/64/08/1341066408.db2.gz	AKLUGNNKMCWGCX-HUUCEWRRSA-N	0	3	345.512	3.336	20	30		EGEDHN
C#Cc1cncc(C(=O)N(Cc2ccccc2)[C@H]2CCCN(CC)C2)c1	ZINC001029922290	1341120804	/nfs/dbraw/zinc/12/08/04/1341120804.db2.gz	YTGQUZPUOAMRCS-NRFANRHFSA-N	0	3	347.462	3.190	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC(CN(C)Cc2cnoc2C)CC1	ZINC001029990747	1341148279	/nfs/dbraw/zinc/14/82/79/1341148279.db2.gz	QFXAYHCAJLNCDR-IBGZPJMESA-N	0	3	333.476	3.256	20	30		EGEDHN
CCC(CC)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001072479863	1355305873	/nfs/dbraw/zinc/30/58/73/1355305873.db2.gz	JHLRKQLTBXJETH-UHFFFAOYSA-N	0	3	325.456	3.029	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H]2C[C@H]1CN2CCCC1CCOCC1	ZINC001032557976	1341539684	/nfs/dbraw/zinc/53/96/84/1341539684.db2.gz	ZRRKGJFLMCTJPA-ROUUACIJSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H]2C[C@H]1CN2C[C@H]1CCCC(F)(F)C1	ZINC001032562347	1341540930	/nfs/dbraw/zinc/54/09/30/1341540930.db2.gz	QLRLHLNOSCGWTP-KKUMJFAQSA-N	0	3	326.431	3.309	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1c[nH]c2ccc(F)cc12	ZINC001032649347	1341570090	/nfs/dbraw/zinc/57/00/90/1341570090.db2.gz	KCXUHYUJROFRFV-IRXDYDNUSA-N	0	3	341.430	3.101	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ncoc1-c1cccs1	ZINC001032688675	1341582326	/nfs/dbraw/zinc/58/23/26/1341582326.db2.gz	HLPUZWUGFGREJB-KBPBESRZSA-N	0	3	343.452	3.268	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)C[C@H](C)c1ccc(OC)cc1	ZINC001032793334	1341615235	/nfs/dbraw/zinc/61/52/35/1341615235.db2.gz	ABRFNKIEGNFJSA-SZMVWBNQSA-N	0	3	328.456	3.050	20	30		EGEDHN
C=C(C)CCN1CC[C@H](N(C)C(=O)c2cnc(CC3CC3)s2)C1	ZINC001033295273	1341769885	/nfs/dbraw/zinc/76/98/85/1341769885.db2.gz	JSLADYXIDRMUFH-HNNXBMFYSA-N	0	3	333.501	3.208	20	30		EGEDHN
C=C1CCC(C(=O)N(C)[C@H]2CCN(CCc3scnc3C)C2)CC1	ZINC001033388893	1341807992	/nfs/dbraw/zinc/80/79/92/1341807992.db2.gz	GJLKBWLCQDZUMH-KRWDZBQOSA-N	0	3	347.528	3.273	20	30		EGEDHN
C#Cc1cncc(C(=O)N(C)[C@H]2CCN(Cc3cc(C)cc(C)c3)C2)c1	ZINC001033404645	1341816576	/nfs/dbraw/zinc/81/65/76/1341816576.db2.gz	DLMUJQJEJLSQMN-NRFANRHFSA-N	0	3	347.462	3.026	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)Cc2csc(C(C)(C)C)n2)C1	ZINC001033515794	1341855010	/nfs/dbraw/zinc/85/50/10/1341855010.db2.gz	YRPHSDXTCTVHFH-OAHLLOKOSA-N	0	3	335.517	3.092	20	30		EGEDHN
C#CCCN1CC[C@H](N(C)C(=O)C(C)(C)c2ccc(CC)cc2)C1	ZINC001033566848	1341875735	/nfs/dbraw/zinc/87/57/35/1341875735.db2.gz	UCWZYOCRLIZEMM-IBGZPJMESA-N	0	3	326.484	3.083	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2ccccc2C(F)(F)F)C1	ZINC001033607122	1341897553	/nfs/dbraw/zinc/89/75/53/1341897553.db2.gz	NCGVGYBCXAZOBH-ZDUSSCGKSA-N	0	3	326.362	3.428	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2ccc(N(CC)CC)cc2)C1	ZINC001033615215	1341903380	/nfs/dbraw/zinc/90/33/80/1341903380.db2.gz	ZTMCUBLXADBHRA-LJQANCHMSA-N	0	3	329.488	3.255	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2c[nH]c3c2cccc3CC)C1	ZINC001033689972	1341953275	/nfs/dbraw/zinc/95/32/75/1341953275.db2.gz	OAAOPOGLCUOTNB-INIZCTEOSA-N	0	3	325.456	3.453	20	30		EGEDHN
C[C@H]1[C@@H](NCc2ccc(C#N)s2)CCN1C(=O)C[C@@H]1C[C@H]1C1CC1	ZINC001074755531	1356232117	/nfs/dbraw/zinc/23/21/17/1356232117.db2.gz	JNPDZPWYCCJQFI-ZUXXIDCJSA-N	0	3	343.496	3.135	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cccc([C@@H]3CCOC3)c2)C1	ZINC001033875263	1342053681	/nfs/dbraw/zinc/05/36/81/1342053681.db2.gz	DALPIYZZRKSPGC-WOJBJXKFSA-N	0	3	342.483	3.303	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccc(-c3cnco3)cc2)C1	ZINC001033877556	1342055798	/nfs/dbraw/zinc/05/57/98/1342055798.db2.gz	CNSYKCKQWQUBFG-GOSISDBHSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=CCN1CC[C@@H](N(CC)C(=O)c2cn(CC)c3ccccc23)C1	ZINC001033891222	1342064935	/nfs/dbraw/zinc/06/49/35/1342064935.db2.gz	ZKXNEOKDSIUIRX-MRXNPFEDSA-N	0	3	325.456	3.384	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cc3c(cn2)CCCC3)C1	ZINC001033893750	1342065830	/nfs/dbraw/zinc/06/58/30/1342065830.db2.gz	RCMBRGUZDYAZLW-SFHVURJKSA-N	0	3	327.472	3.073	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@H]2CCc3cc(C)ccc3O2)C1	ZINC001033900950	1342074231	/nfs/dbraw/zinc/07/42/31/1342074231.db2.gz	NMHYNQOUHZKUPK-AZUAARDMSA-N	0	3	342.483	3.188	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccc(C(C)C)[nH]c2=O)C1	ZINC001033981779	1342128571	/nfs/dbraw/zinc/12/85/71/1342128571.db2.gz	XIJFRXOAXARKBN-OAHLLOKOSA-N	0	3	331.460	3.023	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2)C1	ZINC001033983352	1342129588	/nfs/dbraw/zinc/12/95/88/1342129588.db2.gz	PZBKDDBDJGRQHO-GBESFXJTSA-N	0	3	344.886	3.390	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@@H]2CCOc3ccccc32)C1	ZINC001033992756	1342135626	/nfs/dbraw/zinc/13/56/26/1342135626.db2.gz	XDWMOHRWFNTJQT-SJLPKXTDSA-N	0	3	328.456	3.052	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2ccc(-c3ccccc3)nc2)C1	ZINC001033995222	1342136711	/nfs/dbraw/zinc/13/67/11/1342136711.db2.gz	BNLUKYHQLNDSJI-FQEVSTJZSA-N	0	3	347.462	3.308	20	30		EGEDHN
C#Cc1ccc(C(=O)N(CC)[C@H]2CCN(CC3=CCCCC3)C2)cn1	ZINC001034022086	1342159850	/nfs/dbraw/zinc/15/98/50/1342159850.db2.gz	CCECMLVKSWOTLA-FQEVSTJZSA-N	0	3	337.467	3.100	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)[C@@H]2C[C@H]2c2cccc(F)c2F)C1	ZINC001034048397	1342188944	/nfs/dbraw/zinc/18/89/44/1342188944.db2.gz	NWXXVYCEOGVVRA-HYVNUMGLSA-N	0	3	346.421	3.014	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cc(NC(C)=O)ccc2C)C1	ZINC001034053706	1342194738	/nfs/dbraw/zinc/19/47/38/1342194738.db2.gz	FMGOJBDKUAJKMC-SFHVURJKSA-N	0	3	343.471	3.066	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2csc([C@@H]3CCCO3)n2)C1	ZINC001034206974	1342317188	/nfs/dbraw/zinc/31/71/88/1342317188.db2.gz	NSAXAVIWPFZSAU-HOCLYGCPSA-N	0	3	349.500	3.155	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ncn3cc(Cl)ccc23)C1	ZINC001034219315	1342325093	/nfs/dbraw/zinc/32/50/93/1342325093.db2.gz	MIBMPFMDVOIENZ-HNNXBMFYSA-N	0	3	346.862	3.148	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccnn2C2CCCC2)C1	ZINC001034229745	1342333501	/nfs/dbraw/zinc/33/35/01/1342333501.db2.gz	VWVHTOYFTBNVBS-INIZCTEOSA-N	0	3	330.476	3.159	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2n[nH]c(C3CC3)c2Cl)C1	ZINC001034289735	1342375773	/nfs/dbraw/zinc/37/57/73/1342375773.db2.gz	BSERMZFFJIMPCQ-ZDUSSCGKSA-N	0	3	336.867	3.101	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)Cn2c(C)cc3ccccc32)C1	ZINC001034304231	1342386254	/nfs/dbraw/zinc/38/62/54/1342386254.db2.gz	PVHZCAMIRNGRLT-IBGZPJMESA-N	0	3	339.483	3.497	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)Cn2c(C)cc3ccccc32)C1	ZINC001034304234	1342386999	/nfs/dbraw/zinc/38/69/99/1342386999.db2.gz	PVHZCAMIRNGRLT-LJQANCHMSA-N	0	3	339.483	3.497	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2noc3c2CC(C)(C)CC3)C1	ZINC001034323248	1342399382	/nfs/dbraw/zinc/39/93/82/1342399382.db2.gz	MHVJRIJDMJAWMR-OAHLLOKOSA-N	0	3	345.487	3.350	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCCN(CCOc3ccccc3)C2)C1	ZINC001034387953	1342456617	/nfs/dbraw/zinc/45/66/17/1342456617.db2.gz	ZCIVXWXRADKWPO-GOSISDBHSA-N	0	3	342.483	3.392	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CCCCN(Cc3cccc(C)c3)C2)c1	ZINC001034393463	1342462211	/nfs/dbraw/zinc/46/22/11/1342462211.db2.gz	TVZDHEICZSRQNM-OAQYLSRUSA-N	0	3	347.462	3.156	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2ccc(C(F)F)c(F)c2)C1	ZINC001034397065	1342464427	/nfs/dbraw/zinc/46/44/27/1342464427.db2.gz	HUUIRKBDJKIHGE-AWEZNQCLSA-N	0	3	338.373	3.371	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2cc(C(CC)CC)no2)C1	ZINC001034428205	1342490641	/nfs/dbraw/zinc/49/06/41/1342490641.db2.gz	KLSGLDHIDBKTOU-MRXNPFEDSA-N	0	3	331.460	3.186	20	30		EGEDHN
C=C(Cl)CN1CCCC[C@@H](NC(=O)c2cccc3nc(C)[nH]c32)C1	ZINC001034475666	1342530268	/nfs/dbraw/zinc/53/02/68/1342530268.db2.gz	CRMWFXXZBCYRNH-CQSZACIVSA-N	0	3	346.862	3.208	20	30		EGEDHN
C=CCOc1cccnc1C(=O)N[C@@H]1CCCCN(CC=C(C)C)C1	ZINC001034483289	1342541150	/nfs/dbraw/zinc/54/11/50/1342541150.db2.gz	JXMMBCZOUDNJDL-QGZVFWFLSA-N	0	3	343.471	3.197	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)[C@@]2(c3ccccc3)C[C@H](F)C2)C1	ZINC001034508902	1342568183	/nfs/dbraw/zinc/56/81/83/1342568183.db2.gz	RSWMQJNSERNIJQ-BJLQDIEVSA-N	0	3	330.447	3.213	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)c2ccc(N(C)CCC)cc2)C1	ZINC001034555205	1342616963	/nfs/dbraw/zinc/61/69/63/1342616963.db2.gz	XUWZWZSTIVSBQI-SFHVURJKSA-N	0	3	329.488	3.303	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CC[C@H](NCc3nccnc3C)CC2)CC1	ZINC001034728877	1342723556	/nfs/dbraw/zinc/72/35/56/1342723556.db2.gz	JMXUSJBTXCPGEG-IYARVYRRSA-N	0	3	342.487	3.048	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)c2ccc(F)cc2)s1	ZINC001034842878	1342796971	/nfs/dbraw/zinc/79/69/71/1342796971.db2.gz	CFRZHDDCHXGGMG-OAHLLOKOSA-N	0	3	343.427	3.153	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)C[C@H]2C=CCC2)s1	ZINC001034853756	1342805279	/nfs/dbraw/zinc/80/52/79/1342805279.db2.gz	JGKPEGYHXVAPLO-LSDHHAIUSA-N	0	3	329.469	3.057	20	30		EGEDHN
COc1ccc(C(C)C)cc1CNC[C@H]1CCCN1C(=O)[C@@H](C)C#N	ZINC001034886249	1342821399	/nfs/dbraw/zinc/82/13/99/1342821399.db2.gz	HSAIBJFNSOOBNA-MAUKXSAKSA-N	0	3	343.471	3.059	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc(OCC)cc2)C12CCC2	ZINC001078799083	1357090556	/nfs/dbraw/zinc/09/05/56/1357090556.db2.gz	VVJFOGDLIGILGF-IRXDYDNUSA-N	0	3	348.874	3.468	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)Cc2cccc(F)c2)C12CCC2	ZINC001078799567	1357091154	/nfs/dbraw/zinc/09/11/54/1357091154.db2.gz	CWJOLDRWBVSSIR-HZPDHXFCSA-N	0	3	336.838	3.138	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)C[C@H]2C=CCCC2)s1	ZINC001034974239	1342860505	/nfs/dbraw/zinc/86/05/05/1342860505.db2.gz	SVCWKCJZWNAUPF-JKSUJKDBSA-N	0	3	343.496	3.447	20	30		EGEDHN
C[C@H](CC(=O)N1CCC[C@@H]1CNCc1ccc(C#N)c(F)c1)C1CC1	ZINC001035136302	1342952117	/nfs/dbraw/zinc/95/21/17/1342952117.db2.gz	XGHFVHGXOHGHPK-RDTXWAMCSA-N	0	3	343.446	3.214	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC2(CCN(CC#Cc3ccccc3)C2)CC1	ZINC001035173045	1342989449	/nfs/dbraw/zinc/98/94/49/1342989449.db2.gz	SYSLBWHVWDKKFQ-OQOIWIOPSA-N	0	3	336.479	3.319	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC2(CCN(Cc3conc3C)C2)CC1	ZINC001035213792	1343032374	/nfs/dbraw/zinc/03/23/74/1343032374.db2.gz	PDGIQPYJBXSMRQ-UHFFFAOYSA-N	0	3	345.487	3.400	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1scc(C)c1Cl)CC2	ZINC001035715431	1343149006	/nfs/dbraw/zinc/14/90/06/1343149006.db2.gz	YLADPEQJODNUJZ-UHFFFAOYSA-N	0	3	336.888	3.271	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)Cc1ccc(C)cc1Cl)CC2	ZINC001035735451	1343161250	/nfs/dbraw/zinc/16/12/50/1343161250.db2.gz	XKSPRQDPHMPBKA-UHFFFAOYSA-N	0	3	344.886	3.139	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccc(C)c3cccnc13)CC2	ZINC001035753174	1343171194	/nfs/dbraw/zinc/17/11/94/1343171194.db2.gz	NYCJKLAAVHFKGB-UHFFFAOYSA-N	0	3	347.462	3.105	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccc3c(c1)C=CCC3)CC2	ZINC001035815486	1343212867	/nfs/dbraw/zinc/21/28/67/1343212867.db2.gz	LYVKISCLTSNBRI-UHFFFAOYSA-N	0	3	334.463	3.207	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1coc(C3CCCC3)n1)CC2	ZINC001035830398	1343218613	/nfs/dbraw/zinc/21/86/13/1343218613.db2.gz	OEBYPFOGHJJHIF-UHFFFAOYSA-N	0	3	343.471	3.446	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@](C)(OC)c1ccccc1)CC2	ZINC001035838670	1343221432	/nfs/dbraw/zinc/22/14/32/1343221432.db2.gz	YWRVSVXWWVSDRY-FQEVSTJZSA-N	0	3	342.483	3.049	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@H]1Oc3ccccc3[C@@H]1C)CC2	ZINC001035867157	1343239707	/nfs/dbraw/zinc/23/97/07/1343239707.db2.gz	YDAPPOPDPYYLDO-LPHOPBHVSA-N	0	3	340.467	3.052	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@H](NCc3ccccc3C#N)[C@H](C)C2)o1	ZINC001035897024	1343256931	/nfs/dbraw/zinc/25/69/31/1343256931.db2.gz	OKNSJVAXSFGBMG-KDOFPFPSSA-N	0	3	337.423	3.100	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC(C)(C)C)CC[C@H]1NCc1ccccc1C#N	ZINC001035907901	1343263927	/nfs/dbraw/zinc/26/39/27/1343263927.db2.gz	FIGUCNOHVLQEKM-CRAIPNDOSA-N	0	3	327.472	3.321	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCC2CCC2)CC[C@@H]1NCc1ccccc1C#N	ZINC001035975159	1343295670	/nfs/dbraw/zinc/29/56/70/1343295670.db2.gz	TZXLUHAFHCVNHA-UZLBHIALSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](NCc2ncc(C)s2)[C@H](C)C1	ZINC001036138144	1343323265	/nfs/dbraw/zinc/32/32/65/1343323265.db2.gz	REYORLYSHFZCAG-UKRRQHHQSA-N	0	3	335.517	3.380	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3cc(C)no3)[C@@H](C)C2)CC1	ZINC001036172809	1343345753	/nfs/dbraw/zinc/34/57/53/1343345753.db2.gz	KNXYEXUMBOHQNV-KBXCAEBGSA-N	0	3	331.460	3.056	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@@H]([C@H](C)NCc2ccccc2C#N)C1	ZINC001036339161	1343425000	/nfs/dbraw/zinc/42/50/00/1343425000.db2.gz	DOOKOMFZRXPLLI-QFBILLFUSA-N	0	3	325.456	3.241	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC[C@@H](C)[C@H]2CNCc2ccccn2)cc1	ZINC001036567803	1343557398	/nfs/dbraw/zinc/55/73/98/1343557398.db2.gz	MZFWIWGITQXRGE-DYESRHJHSA-N	0	3	347.462	3.093	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@@H]2[C@@H](CCN2Cc2sccc2Cl)C1	ZINC001036714036	1343646742	/nfs/dbraw/zinc/64/67/42/1343646742.db2.gz	RWEMMJIKSZWNIJ-GOEBONIOSA-N	0	3	348.899	3.238	20	30		EGEDHN
CC1(CC(=O)N2CC[C@@H]3[C@@H](CCN3CC#Cc3ccccc3)C2)CC1	ZINC001036774917	1343703500	/nfs/dbraw/zinc/70/35/00/1343703500.db2.gz	MNVMRHLULDYSAT-VQTJNVASSA-N	0	3	336.479	3.151	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2cc(C3CC3)no2)C1	ZINC001036788644	1343718944	/nfs/dbraw/zinc/71/89/44/1343718944.db2.gz	FATUYOXBGXOFTG-MAUKXSAKSA-N	0	3	343.471	3.187	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@H]2[C@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001036805287	1343741446	/nfs/dbraw/zinc/74/14/46/1343741446.db2.gz	XLGPSMKGYJEIFR-PBHICJAKSA-N	0	3	345.512	3.479	20	30		EGEDHN
O=C(C1CC2(CC2)C1)N1CC[C@@H]2[C@H](CCN2CC#Cc2ccccc2)C1	ZINC001036818542	1343756391	/nfs/dbraw/zinc/75/63/91/1343756391.db2.gz	CVVFUZZDYBEQRU-TZIWHRDSSA-N	0	3	348.490	3.151	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCC[C@@H]1NC(=O)c1ccsc1	ZINC001036939111	1343882627	/nfs/dbraw/zinc/88/26/27/1343882627.db2.gz	FRGZQAKQUIJJMN-AEFFLSMTSA-N	0	3	339.464	3.308	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCC[C@@H]1NC(=O)CC1CC1	ZINC001037148965	1344000007	/nfs/dbraw/zinc/00/00/07/1344000007.db2.gz	MDEWOGXAMXPWNM-MOPGFXCFSA-N	0	3	325.456	3.123	20	30		EGEDHN
CC(C)(C)C(=O)N[C@@H]1CCCC[C@@H]1CNCc1ccccc1C#N	ZINC001037265763	1344069758	/nfs/dbraw/zinc/06/97/58/1344069758.db2.gz	SNHWPJQFASRASJ-QZTJIDSGSA-N	0	3	327.472	3.369	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCN2CCCc2ccccc2)cc1	ZINC001038582853	1344493025	/nfs/dbraw/zinc/49/30/25/1344493025.db2.gz	QWGGBEWENGPRTB-OAQYLSRUSA-N	0	3	332.447	3.105	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)NC[C@@H]1CCN1CCC1=CCCCC1	ZINC001038801499	1344589620	/nfs/dbraw/zinc/58/96/20/1344589620.db2.gz	ZGNHGJKXBVNXEK-UFYCRDLUSA-N	0	3	346.515	3.439	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1ccnc(O[C@@H](C)CC)c1	ZINC001038895406	1344638523	/nfs/dbraw/zinc/63/85/23/1344638523.db2.gz	VJMSIDPQRFMWFH-RDJZCZTQSA-N	0	3	331.460	3.029	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C2(C)CC(=C)C2)CC[C@H]1c1ccc(F)cc1	ZINC001079158032	1357198281	/nfs/dbraw/zinc/19/82/81/1357198281.db2.gz	OJCACYCLZJDPOL-RBUKOAKNSA-N	0	3	340.442	3.089	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1ccc(N(C)CCC)cc1	ZINC001039078496	1344759275	/nfs/dbraw/zinc/75/92/75/1344759275.db2.gz	MDDYNBKRGXUIBE-LJQANCHMSA-N	0	3	329.488	3.303	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)C1CC(c2ccc(F)cc2)C1	ZINC001039083660	1344760268	/nfs/dbraw/zinc/76/02/68/1344760268.db2.gz	BGUHCJALYHYZKG-TVPLGVNVSA-N	0	3	330.447	3.476	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)[C@H]3C[C@H]4C[C@H]4C3)CC2)C1	ZINC001039151986	1344835140	/nfs/dbraw/zinc/83/51/40/1344835140.db2.gz	QBGHEBBRDCMLFE-BDXSIMOUSA-N	0	3	336.907	3.346	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)[C@@H]3C[C@H]3C3CC3)CC2)C1	ZINC001039160006	1344844958	/nfs/dbraw/zinc/84/49/58/1344844958.db2.gz	DKEVEUMCDICUQG-FGTMMUONSA-N	0	3	336.907	3.346	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc(C)oc2C)C1	ZINC001039191763	1344896001	/nfs/dbraw/zinc/89/60/01/1344896001.db2.gz	ALQKPZKGMLIFEM-HKUYNNGSSA-N	0	3	328.456	3.236	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc(C)cs2)C1	ZINC001039200771	1344910627	/nfs/dbraw/zinc/91/06/27/1344910627.db2.gz	RFYZPBBDGSEYTR-DLBZAZTESA-N	0	3	330.497	3.396	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccn3ccccc23)C1	ZINC001039215620	1344931313	/nfs/dbraw/zinc/93/13/13/1344931313.db2.gz	LLPNXMOUPKCQQM-UYAOXDASSA-N	0	3	349.478	3.279	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2c(C)oc(C)c2C)C1	ZINC001039216472	1344933328	/nfs/dbraw/zinc/93/33/28/1344933328.db2.gz	PGDHBEFWWVUWQI-MSOLQXFVSA-N	0	3	328.456	3.155	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc(C)cc(F)c2)C1	ZINC001039228684	1344948589	/nfs/dbraw/zinc/94/85/89/1344948589.db2.gz	HDQHLURCZLGANC-FXAWDEMLSA-N	0	3	342.458	3.474	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2csc(C)c2)C1	ZINC001039232230	1344952719	/nfs/dbraw/zinc/95/27/19/1344952719.db2.gz	URZLRMYTDPYUEM-AEFFLSMTSA-N	0	3	330.497	3.396	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc(Cl)cs2)C1	ZINC001039233278	1344953501	/nfs/dbraw/zinc/95/35/01/1344953501.db2.gz	AGJYRSMSCBOIFG-UKRRQHHQSA-N	0	3	336.888	3.351	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc(Cl)cs2)C1	ZINC001039233275	1344953626	/nfs/dbraw/zinc/95/36/26/1344953626.db2.gz	AGJYRSMSCBOIFG-DZGCQCFKSA-N	0	3	336.888	3.351	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2oc(CC)cc2C)C1	ZINC001039242291	1344968799	/nfs/dbraw/zinc/96/87/99/1344968799.db2.gz	AOTADEMKXLYTDZ-FUHWJXTLSA-N	0	3	328.456	3.100	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc(C)c(CC)o2)C1	ZINC001039242981	1344969804	/nfs/dbraw/zinc/96/98/04/1344969804.db2.gz	DYQBTASYHKLESV-QZTJIDSGSA-N	0	3	342.483	3.490	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2c[nH]c3ccc(C)cc23)C1	ZINC001039250073	1344981434	/nfs/dbraw/zinc/98/14/34/1344981434.db2.gz	GSVRMHWEVOJHGM-UWJYYQICSA-N	0	3	349.478	3.426	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(Cl)s2)C1	ZINC001039251639	1344983151	/nfs/dbraw/zinc/98/31/51/1344983151.db2.gz	WFYZQBPUWXMVTE-KGLIPLIRSA-N	0	3	336.888	3.351	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccc(Cl)cn2)C1	ZINC001039258693	1344986641	/nfs/dbraw/zinc/98/66/41/1344986641.db2.gz	ZCTOPPYZSRSXLV-MAUKXSAKSA-N	0	3	345.874	3.075	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@H](C)n1ccnc1CC	ZINC001039377373	1345034358	/nfs/dbraw/zinc/03/43/58/1345034358.db2.gz	UOQRTTWDAFNDOC-KSZLIROESA-N	0	3	344.503	3.038	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)CCc1ccc(F)cc1	ZINC001039400632	1345047042	/nfs/dbraw/zinc/04/70/42/1345047042.db2.gz	MHIAJTROJGJFCL-MOPGFXCFSA-N	0	3	330.447	3.400	20	30		EGEDHN
C=CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(COC)cs1	ZINC001039401490	1345047655	/nfs/dbraw/zinc/04/76/55/1345047655.db2.gz	HBVUTKCPRZPYQW-CVEARBPZSA-N	0	3	334.485	3.150	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)CCc1cccc(OC)c1	ZINC001039403601	1345049626	/nfs/dbraw/zinc/04/96/26/1345049626.db2.gz	FANBAEHYKUQPRV-MOPGFXCFSA-N	0	3	342.483	3.269	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](c1ccncc1)C(C)C	ZINC001039424626	1345061887	/nfs/dbraw/zinc/06/18/87/1345061887.db2.gz	AHUYDNPTXBBWRH-HSALFYBXSA-N	0	3	341.499	3.463	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccccc1-n1cccc1	ZINC001039428554	1345063613	/nfs/dbraw/zinc/06/36/13/1345063613.db2.gz	RMCZECOIGKAXSG-MSOLQXFVSA-N	0	3	335.451	3.342	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1C[C@H]1c1ccccc1F	ZINC001039448529	1345073116	/nfs/dbraw/zinc/07/31/16/1345073116.db2.gz	UAILXLZEEUPRPR-KCITZHQASA-N	0	3	340.442	3.018	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](c1cccnc1)C(C)C	ZINC001039455774	1345076903	/nfs/dbraw/zinc/07/69/03/1345076903.db2.gz	QKYCTQHHVHAMSP-HSALFYBXSA-N	0	3	341.499	3.463	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)c1ccc(F)cc1F	ZINC001039471994	1345087588	/nfs/dbraw/zinc/08/75/88/1345087588.db2.gz	XMBIVGZRVJCXCU-UAGQMJEPSA-N	0	3	346.421	3.157	20	30		EGEDHN
C=CCn1cccc1C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC1CC(C)C1	ZINC001039644529	1345152284	/nfs/dbraw/zinc/15/22/84/1345152284.db2.gz	HKQNCFZVKRUYNC-YHFFBGSDSA-N	0	3	341.499	3.399	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC[C@H]1CCCCO1	ZINC001039821569	1345199108	/nfs/dbraw/zinc/19/91/08/1345199108.db2.gz	TZQCWWHQYSCXNM-FGTMMUONSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CCC[C@@H](C1)N2C[C@H]1CCO[C@H](C)C1	ZINC001039820632	1345199438	/nfs/dbraw/zinc/19/94/38/1345199438.db2.gz	KEIZOOBQLLMVCW-XDNAFOTISA-N	0	3	334.504	3.079	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@]3(CCN(C(=O)c4ccc[nH]4)C3)C2)c1	ZINC001040071570	1345322313	/nfs/dbraw/zinc/32/23/13/1345322313.db2.gz	XWGOTYZZXVTQNN-NRFANRHFSA-N	0	3	348.450	3.015	20	30		EGEDHN
CC[C@H](C)C(=O)N1CC[C@]2(C1)CCCN(Cc1cccc(C#N)c1)C2	ZINC001040085583	1345330144	/nfs/dbraw/zinc/33/01/44/1345330144.db2.gz	ZKSUBRNCFSPVNL-LAUBAEHRSA-N	0	3	339.483	3.419	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@@H]3CCC(C)=C(C)C3)C2)C1	ZINC001040217057	1345378627	/nfs/dbraw/zinc/37/86/27/1345378627.db2.gz	RUMJCFZSZWAMCA-TZIWHRDSSA-N	0	3	328.500	3.461	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cc4c(o3)CCCC4)C2)C1	ZINC001040237154	1345389320	/nfs/dbraw/zinc/38/93/20/1345389320.db2.gz	RGQMXWLYZYJRAA-NRFANRHFSA-N	0	3	340.467	3.110	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)C3(C(F)(F)F)CCC3)C2)C1	ZINC001040264279	1345402543	/nfs/dbraw/zinc/40/25/43/1345402543.db2.gz	NLOFOKZYSVJAJW-MRXNPFEDSA-N	0	3	342.405	3.057	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cc(C)n([C@@H](C)CC)n3)C2)C1	ZINC001040271044	1345405893	/nfs/dbraw/zinc/40/58/93/1345405893.db2.gz	QEBNFFMSIARFHX-JXFKEZNVSA-N	0	3	344.503	3.277	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cccnc3C3CC3)C2)C1	ZINC001040279838	1345408847	/nfs/dbraw/zinc/40/88/47/1345408847.db2.gz	AVLDTNLXFWWSFV-FQEVSTJZSA-N	0	3	325.456	3.073	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)CCc3ccc(C)cc3)C2)C1	ZINC001040288459	1345413001	/nfs/dbraw/zinc/41/30/01/1345413001.db2.gz	FCWFKUMMSBPLDO-QFIPXVFZSA-N	0	3	338.495	3.265	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3nc(Cl)sc3C)C2)C1	ZINC001040288992	1345413509	/nfs/dbraw/zinc/41/35/09/1345413509.db2.gz	AMPLSSGEXFVUFN-MRXNPFEDSA-N	0	3	339.892	3.219	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@@H](C)c3c(F)cccc3F)C2)C1	ZINC001040292069	1345416088	/nfs/dbraw/zinc/41/60/88/1345416088.db2.gz	KQZMFCCBNNYYLB-MGPUTAFESA-N	0	3	346.421	3.016	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)C3CCC4(CC4)CC3)C2)C1	ZINC001040293325	1345416997	/nfs/dbraw/zinc/41/69/97/1345416997.db2.gz	VEFYHPLQZBYZAD-NRFANRHFSA-N	0	3	328.500	3.295	20	30		EGEDHN
CC[C@H](F)C(=O)N1CC[C@@]2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001040327798	1345433955	/nfs/dbraw/zinc/43/39/55/1345433955.db2.gz	IFDSTDDTQVEXMO-ICSRJNTNSA-N	0	3	343.446	3.121	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(C)cc3Cl)C2)C1	ZINC001040407096	1345480386	/nfs/dbraw/zinc/48/03/86/1345480386.db2.gz	FYOGFFCSTXBKLD-LJQANCHMSA-N	0	3	330.859	3.210	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cccc4cc[nH]c43)C2)C1	ZINC001040410023	1345481578	/nfs/dbraw/zinc/48/15/78/1345481578.db2.gz	CDKJGFQBTUAHJW-OAQYLSRUSA-N	0	3	335.451	3.119	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3ccc4c(c3)C=CCC4)C2)C1	ZINC001040436171	1345499560	/nfs/dbraw/zinc/49/95/60/1345499560.db2.gz	SITFKYQROSAHHF-JOCHJYFZSA-N	0	3	334.463	3.207	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cc4sccc4[nH]3)C2)C1	ZINC001040477848	1345513067	/nfs/dbraw/zinc/51/30/67/1345513067.db2.gz	AFCPHHKABPORLJ-LJQANCHMSA-N	0	3	341.480	3.181	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cnn(CCCC)c3C)C2)C1	ZINC001040491700	1345517315	/nfs/dbraw/zinc/51/73/15/1345517315.db2.gz	JWKLFXIIOJZUDL-FQEVSTJZSA-N	0	3	344.503	3.106	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)C[C@H](C)c3ccco3)C2)C1	ZINC001040493458	1345519201	/nfs/dbraw/zinc/51/92/01/1345519201.db2.gz	LIPJJSBHBYYXLN-FXAWDEMLSA-N	0	3	328.456	3.111	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ccc4ccccc4n3)C2)C1	ZINC001040504247	1345524112	/nfs/dbraw/zinc/52/41/12/1345524112.db2.gz	XURFVUCGOSHJCO-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cc(C)c(C)s3)C2)C1	ZINC001040523509	1345532783	/nfs/dbraw/zinc/53/27/83/1345532783.db2.gz	XTWPGDQHOVHWRG-LJQANCHMSA-N	0	3	330.497	3.316	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@@H](C)c3ccc(F)c(F)c3)C2)C1	ZINC001040540802	1345537778	/nfs/dbraw/zinc/53/77/78/1345537778.db2.gz	WOMLZGGPRRKFLE-YWZLYKJASA-N	0	3	346.421	3.016	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)CC(C)(C)c3ccccc3)C2)C1	ZINC001040542448	1345538588	/nfs/dbraw/zinc/53/85/88/1345538588.db2.gz	IRZCSWGDVYIXRV-QFIPXVFZSA-N	0	3	338.495	3.302	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(C)c4c3CCC4)C2)C1	ZINC001040545587	1345539757	/nfs/dbraw/zinc/53/97/57/1345539757.db2.gz	RKQLPGOEZIALRG-JOCHJYFZSA-N	0	3	336.479	3.045	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)CCc3ccc(C)s3)C2)C1	ZINC001040551942	1345543634	/nfs/dbraw/zinc/54/36/34/1345543634.db2.gz	SUMYNRIJQVKSAW-FQEVSTJZSA-N	0	3	344.524	3.327	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)CCc3ccc(C)cc3)C2)CC1	ZINC001040765741	1345576755	/nfs/dbraw/zinc/57/67/55/1345576755.db2.gz	QFZCXWZEIUTWRX-UHFFFAOYSA-N	0	3	338.495	3.265	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccc(Cl)c(C)c3)C2)CC1	ZINC001040831433	1345584734	/nfs/dbraw/zinc/58/47/34/1345584734.db2.gz	TXGIZKSOSCUMQK-UHFFFAOYSA-N	0	3	330.859	3.210	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@@H](C)Cc3cccs3)C2)CC1	ZINC001040869783	1345590668	/nfs/dbraw/zinc/59/06/68/1345590668.db2.gz	PNTPFASHVIPAFO-KRWDZBQOSA-N	0	3	344.524	3.265	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cc(Cl)ccc3C)C2)CC1	ZINC001040884875	1345594528	/nfs/dbraw/zinc/59/45/28/1345594528.db2.gz	BFOOKFHBISATMU-UHFFFAOYSA-N	0	3	330.859	3.210	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)CCc3cc(C)cc(C)c3)C2)CC1	ZINC001040908765	1345598557	/nfs/dbraw/zinc/59/85/57/1345598557.db2.gz	WNPYNHBPMLUGCO-UHFFFAOYSA-N	0	3	338.495	3.184	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@@H](C)Cc3ccccc3)C2)CC1	ZINC001040946162	1345606188	/nfs/dbraw/zinc/60/61/88/1345606188.db2.gz	FAXWFEYFVFVUOR-IBGZPJMESA-N	0	3	338.495	3.203	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cc(C)c(F)c(C)c3)C2)CC1	ZINC001040946606	1345606221	/nfs/dbraw/zinc/60/62/21/1345606221.db2.gz	XOXZMSZDRACPOE-UHFFFAOYSA-N	0	3	342.458	3.394	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cc4ccccc4n3CC)C2)CC1	ZINC001040947335	1345606872	/nfs/dbraw/zinc/60/68/72/1345606872.db2.gz	VFYDLMVYMRNFLT-UHFFFAOYSA-N	0	3	349.478	3.223	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@]3(CCN(Cc4cccc(C#N)c4)C3)C2)o1	ZINC001041042194	1345633739	/nfs/dbraw/zinc/63/37/39/1345633739.db2.gz	LTWJWNLKNCODFI-NRFANRHFSA-N	0	3	349.434	3.198	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@]3(CCN(C(=O)[C@@H]4CC=CCC4)C3)C2)cc1	ZINC001041064243	1345640980	/nfs/dbraw/zinc/64/09/80/1345640980.db2.gz	QBDUAWGASLJTQO-IRLDBZIGSA-N	0	3	349.478	3.339	20	30		EGEDHN
CC(C)(C)CC(=O)N1CC[C@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001041071985	1345644710	/nfs/dbraw/zinc/64/47/10/1345644710.db2.gz	GFBZEYGYTUWKBT-NRFANRHFSA-N	0	3	339.483	3.419	20	30		EGEDHN
C/C(=C/C(=O)N1CC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1)C1CC1	ZINC001041096413	1345652239	/nfs/dbraw/zinc/65/22/39/1345652239.db2.gz	DGKLOBXRFNEMIX-CJBPROBKSA-N	0	3	349.478	3.339	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3c(C)oc4ccccc43)C2)C1	ZINC001041315404	1345699632	/nfs/dbraw/zinc/69/96/32/1345699632.db2.gz	AOOTZHYBZFAPJL-NRFANRHFSA-N	0	3	336.435	3.303	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cc(C)c4ccccc4n3)C2)C1	ZINC001041413938	1345722670	/nfs/dbraw/zinc/72/26/70/1345722670.db2.gz	XWMAKJQPVBLAFG-JOCHJYFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)C3(C)CCC(F)(F)CC3)C2)C1	ZINC001041414816	1345723373	/nfs/dbraw/zinc/72/33/73/1345723373.db2.gz	MIBBDAMVAWPQPN-SFHVURJKSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3ccc4c5c(cccc53)CC4)C2)C1	ZINC001041459409	1345734193	/nfs/dbraw/zinc/73/41/93/1345734193.db2.gz	YTGDMLQOVXFGOP-QHCPKHFHSA-N	0	3	344.458	3.110	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)[C@H](C)c3c(F)cccc3F)C2)C1	ZINC001041475110	1345738517	/nfs/dbraw/zinc/73/85/17/1345738517.db2.gz	HWHIARYHVZHQFJ-FOIQADDNSA-N	0	3	346.421	3.016	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3cc4cscc4s3)C2)C1	ZINC001041483735	1345742263	/nfs/dbraw/zinc/74/22/63/1345742263.db2.gz	SYLRREBOFBHIPT-KRWDZBQOSA-N	0	3	330.478	3.134	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cc4c(ccc(C)c4C)[nH]3)C2)C1	ZINC001041532650	1345754342	/nfs/dbraw/zinc/75/43/42/1345754342.db2.gz	VVKOTDXSEPIROF-JOCHJYFZSA-N	0	3	349.478	3.346	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccc(F)c(Cl)c3)C2)C1	ZINC001041609030	1345791889	/nfs/dbraw/zinc/79/18/89/1345791889.db2.gz	BGGDFUOQCZTVQO-SFHVURJKSA-N	0	3	334.822	3.040	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@]2(CCN(Cc3cnccc3C)C2)C1	ZINC001041625704	1345800376	/nfs/dbraw/zinc/80/03/76/1345800376.db2.gz	KKWIUZRNPHJRCU-NHCUHLMSSA-N	0	3	341.499	3.417	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3ccc(F)c4ccccc34)C2)C1	ZINC001041705064	1345823943	/nfs/dbraw/zinc/82/39/43/1345823943.db2.gz	LBESRWATIDZSMT-NRFANRHFSA-N	0	3	336.410	3.150	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3ccc(-c4ccccc4)o3)C2)C1	ZINC001041706900	1345824754	/nfs/dbraw/zinc/82/47/54/1345824754.db2.gz	GHAPFQADIDTCNM-OAQYLSRUSA-N	0	3	334.419	3.118	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@]3(CCN(C(=O)[C@@H]4CC45CCC5)C3)C2)c1	ZINC001041715996	1345828989	/nfs/dbraw/zinc/82/89/89/1345828989.db2.gz	YPUMXMMZEOMFEV-PZJWPPBQSA-N	0	3	349.478	3.173	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3ccccc3O[C@H](C)CC)C2)C1	ZINC001041718161	1345829195	/nfs/dbraw/zinc/82/91/95/1345829195.db2.gz	WYSCPHPVPWCLRS-UTKZUKDTSA-N	0	3	340.467	3.035	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@]3(CCN(C(=O)[C@@H]4C[C@H]4C4CC4)C3)C2)cc1	ZINC001041734415	1345835883	/nfs/dbraw/zinc/83/58/83/1345835883.db2.gz	WSNUVSWREZGVPS-TUNNFDKTSA-N	0	3	349.478	3.029	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)[C@@H](C)c3ccc(CC)cc3)C2)C1	ZINC001041742264	1345838460	/nfs/dbraw/zinc/83/84/60/1345838460.db2.gz	YZWAWEZTQXTRAP-PGRDOPGGSA-N	0	3	338.495	3.300	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3[nH]c4ccc(C)cc4c3C)C2)C1	ZINC001041766222	1345842702	/nfs/dbraw/zinc/84/27/02/1345842702.db2.gz	BWWSUAFGQHFUOM-JOCHJYFZSA-N	0	3	349.478	3.346	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CCN(C(=O)c4ccccc4)C[C@@H]32)c1	ZINC001041909996	1345893000	/nfs/dbraw/zinc/89/30/00/1345893000.db2.gz	LIQPXURCBLFEKZ-CTNGQTDRSA-N	0	3	345.446	3.295	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cccc4c3CCCC4)C[C@@H]21	ZINC001042077614	1345939115	/nfs/dbraw/zinc/93/91/15/1345939115.db2.gz	MLIDANYDPPDACD-NQIIRXRSSA-N	0	3	336.479	3.125	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(C4CCCCC4)n[nH]3)C[C@@H]21	ZINC001042099251	1345943366	/nfs/dbraw/zinc/94/33/66/1345943366.db2.gz	YXYSZYCBSCMLBK-LPHOPBHVSA-N	0	3	342.487	3.180	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3cc(COC)cs3)C[C@@H]21	ZINC001042134963	1345952822	/nfs/dbraw/zinc/95/28/22/1345952822.db2.gz	RMAVPOBAZCYUNM-HOTGVXAUSA-N	0	3	334.485	3.007	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)Cc3cccc(C(C)C)c3)C[C@@H]21	ZINC001042136292	1345952958	/nfs/dbraw/zinc/95/29/58/1345952958.db2.gz	UDXUDUGUGFNQPH-FPOVZHCZSA-N	0	3	338.495	3.299	20	30		EGEDHN
C#CCN1CC[C@H]2CCN(C(=O)Cc3ccc(CCCC)cc3)C[C@@H]21	ZINC001042138682	1345953850	/nfs/dbraw/zinc/95/38/50/1345953850.db2.gz	RHNXQRIEARDRTH-SFTDATJTSA-N	0	3	338.495	3.128	20	30		EGEDHN
C#CCN1CC[C@H]2CCN(C(=O)c3ccc4c5c(cccc53)CC4)C[C@H]21	ZINC001042146319	1345956788	/nfs/dbraw/zinc/95/67/88/1345956788.db2.gz	NOXDVWBUXFOPMS-HRAATJIYSA-N	0	3	344.458	3.108	20	30		EGEDHN
CC1(CC(=O)N2CC[C@@H]3CCN(Cc4ccc(C#N)cc4)[C@@H]3C2)CC1	ZINC001042160013	1345959775	/nfs/dbraw/zinc/95/97/75/1345959775.db2.gz	JWLWRUYTYOCBRF-RBUKOAKNSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(C)nc3C(C)C)C[C@@H]21	ZINC001042167741	1345964122	/nfs/dbraw/zinc/96/41/22/1345964122.db2.gz	NIBINKYOEZHXHB-WMZOPIPTSA-N	0	3	327.472	3.236	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)CCc3ccc(C)cc3C)C[C@H]21	ZINC001042175045	1345966456	/nfs/dbraw/zinc/96/64/56/1345966456.db2.gz	ZFBIDJBXHARESA-NHCUHLMSSA-N	0	3	338.495	3.182	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)CCc3ccc(C)cc3C)C[C@H]21	ZINC001042175043	1345966616	/nfs/dbraw/zinc/96/66/16/1345966616.db2.gz	ZFBIDJBXHARESA-LEWJYISDSA-N	0	3	338.495	3.182	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3cccc(C#N)c3)[C@H]2C1	ZINC001042185774	1345973502	/nfs/dbraw/zinc/97/35/02/1345973502.db2.gz	XMFQQKCWPXCTOZ-MOPGFXCFSA-N	0	3	337.467	3.193	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc(Cl)c(C)c3)C[C@@H]21	ZINC001042214973	1345988903	/nfs/dbraw/zinc/98/89/03/1345988903.db2.gz	WSDCNBZBKROQHH-QAPCUYQASA-N	0	3	330.859	3.208	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc(Cl)cc3C)C[C@H]21	ZINC001042216699	1345989676	/nfs/dbraw/zinc/98/96/76/1345989676.db2.gz	QTLRCKOXKDIPSM-MAUKXSAKSA-N	0	3	330.859	3.208	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3sc(CC)nc3C)C[C@H]21	ZINC001042264638	1346011359	/nfs/dbraw/zinc/01/13/59/1346011359.db2.gz	CJDWUVPZDYNIIG-LSDHHAIUSA-N	0	3	333.501	3.126	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3sc(CC)nc3C)C[C@@H]21	ZINC001042264636	1346011420	/nfs/dbraw/zinc/01/14/20/1346011420.db2.gz	CJDWUVPZDYNIIG-GJZGRUSLSA-N	0	3	333.501	3.126	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)Cc3csc(C(C)(C)C)n3)C[C@@H]21	ZINC001042265196	1346011998	/nfs/dbraw/zinc/01/19/98/1346011998.db2.gz	DEDFHCFSOGNVTG-ZBFHGGJFSA-N	0	3	347.528	3.092	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc4sccc4c3)C[C@H]21	ZINC001042296949	1346021648	/nfs/dbraw/zinc/02/16/48/1346021648.db2.gz	JOCLAHQYWYATNA-MAUKXSAKSA-N	0	3	338.476	3.461	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc4nc(C)sc4c3)C[C@H]21	ZINC001042297128	1346021768	/nfs/dbraw/zinc/02/17/68/1346021768.db2.gz	AISDQHMIINZHBT-RHSMWYFYSA-N	0	3	341.480	3.327	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cnn(C4CCCC4)c3C)C[C@@H]21	ZINC001042306330	1346026061	/nfs/dbraw/zinc/02/60/61/1346026061.db2.gz	FZMHSNMYQKLKIS-LPHOPBHVSA-N	0	3	342.487	3.029	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc(CC(C)C)cc3)C[C@H]21	ZINC001042347652	1346049018	/nfs/dbraw/zinc/04/90/18/1346049018.db2.gz	ATXTVWQTHQVKBO-TZIWHRDSSA-N	0	3	338.495	3.445	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(OC)c(Cl)c3)C[C@H]21	ZINC001042349749	1346050381	/nfs/dbraw/zinc/05/03/81/1346050381.db2.gz	TUMRWPFYKGDVTA-CZUORRHYSA-N	0	3	334.847	3.071	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3cc(C)n(C(C)(C)C)n3)C[C@H]21	ZINC001042360984	1346055916	/nfs/dbraw/zinc/05/59/16/1346055916.db2.gz	ZKZRGCITLLDOII-FUHWJXTLSA-N	0	3	344.503	3.059	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3cc4c(cccc4C)o3)C[C@H]21	ZINC001042373920	1346062277	/nfs/dbraw/zinc/06/22/77/1346062277.db2.gz	DZEMHWFFTSEELV-SJLPKXTDSA-N	0	3	336.435	3.301	20	30		EGEDHN
C[C@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)c1ccccc1	ZINC001044424952	1346325859	/nfs/dbraw/zinc/32/58/59/1346325859.db2.gz	HPYRCORPQVAIBP-JXFKEZNVSA-N	0	3	333.435	3.341	20	30		EGEDHN
C[C@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)c1cccs1	ZINC001044442370	1346333605	/nfs/dbraw/zinc/33/36/05/1346333605.db2.gz	KRLIYFYHXZZYGX-WMLDXEAASA-N	0	3	339.464	3.403	20	30		EGEDHN
C[C@@H]1C[C@H]([NH2+]Cc2ccc(C#N)cc2)CCN1C(=O)c1ccccc1[O-]	ZINC001044477224	1346344156	/nfs/dbraw/zinc/34/41/56/1346344156.db2.gz	ZXNACIYOXXQECJ-CRAIPNDOSA-N	0	3	349.434	3.047	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C3CC3)cc2)C[C@H]1NC(=O)c1cc(C#N)c[nH]1	ZINC001079537958	1357293653	/nfs/dbraw/zinc/29/36/53/1357293653.db2.gz	MJUTXELECGGHNL-JLTOFOAXSA-N	0	3	348.450	3.014	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@@H](NCc3ccccc3C#N)C[C@@H]2C)co1	ZINC001044570737	1346371501	/nfs/dbraw/zinc/37/15/01/1346371501.db2.gz	HZCVFGHAHRJRMW-IFXJQAMLSA-N	0	3	337.423	3.243	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)CC(C)(F)F	ZINC001044732643	1346415800	/nfs/dbraw/zinc/41/58/00/1346415800.db2.gz	DSVIOCWBCGGSAC-CZUORRHYSA-N	0	3	335.398	3.073	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1CCC[C@H]1CNCc1ccc(C#N)s1	ZINC001045049131	1346486394	/nfs/dbraw/zinc/48/63/94/1346486394.db2.gz	AUECTFUHYQXPDW-AWEZNQCLSA-N	0	3	333.501	3.383	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H]1CNCc1ccc(C#N)s1)C1CCC1	ZINC001045087421	1346491721	/nfs/dbraw/zinc/49/17/21/1346491721.db2.gz	GFLGONFSUMMOJR-ZFWWWQNUSA-N	0	3	331.485	3.137	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H]1CNCc1ccc(C#N)cc1F)C1CCC1	ZINC001045087633	1346492199	/nfs/dbraw/zinc/49/21/99/1346492199.db2.gz	NYPFYLYDBZSFAJ-KSSFIOAISA-N	0	3	343.446	3.214	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)s2)CCC1	ZINC001045162068	1346511358	/nfs/dbraw/zinc/51/13/58/1346511358.db2.gz	TUEYFPSNKQDCGV-AWEZNQCLSA-N	0	3	331.485	3.281	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H]1CNCc1cnc(Cl)s1	ZINC001045181256	1346517263	/nfs/dbraw/zinc/51/72/63/1346517263.db2.gz	AAJMSYQXYIHXPH-LRDDRELGSA-N	0	3	341.908	3.479	20	30		EGEDHN
CC1(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)cc2F)CC=CC1	ZINC001045183132	1346519763	/nfs/dbraw/zinc/51/97/63/1346519763.db2.gz	GRLGIMQTQPALNR-KRWDZBQOSA-N	0	3	341.430	3.134	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)[C@@H]2CCC[C@H](C(F)(F)F)C2)CC1	ZINC001045482524	1346605206	/nfs/dbraw/zinc/60/52/06/1346605206.db2.gz	NHAMIQBHZCGUOI-CABCVRRESA-N	0	3	344.421	3.349	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2cc3c([nH]2)c(F)ccc3C)CC1	ZINC001045482045	1346605265	/nfs/dbraw/zinc/60/52/65/1346605265.db2.gz	ARBOHTWVRQMZEN-UHFFFAOYSA-N	0	3	329.419	3.386	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2sc(CC3CC3)nc2C)CC1	ZINC001045602389	1346641790	/nfs/dbraw/zinc/64/17/90/1346641790.db2.gz	ILVNSSYASXQICH-UHFFFAOYSA-N	0	3	333.501	3.174	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2cc(Cl)cc3c2OCC3)CC1	ZINC001045647374	1346658116	/nfs/dbraw/zinc/65/81/16/1346658116.db2.gz	COUXEFFDVOSMOM-UHFFFAOYSA-N	0	3	334.847	3.045	20	30		EGEDHN
Cc1[nH]ccc1C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1ccc(C#N)cc1	ZINC001045749052	1346688164	/nfs/dbraw/zinc/68/81/64/1346688164.db2.gz	QCXROMAFFFLOOI-MOPGFXCFSA-N	0	3	348.450	3.074	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1ccc(C#N)cc1	ZINC001045758037	1346691268	/nfs/dbraw/zinc/69/12/68/1346691268.db2.gz	SVOQXNCSTXQCCW-QYZOEREBSA-N	0	3	337.467	3.170	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H]1C[C@H]1CC(C)(C)C)C2	ZINC001045938470	1346774225	/nfs/dbraw/zinc/77/42/25/1346774225.db2.gz	BXOLQSBRFJDBMJ-UEXGIBASSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc(F)c(C)cc1F)C2	ZINC001045946028	1346781849	/nfs/dbraw/zinc/78/18/49/1346781849.db2.gz	GVNIDOBPUIOSFB-FQEVSTJZSA-N	0	3	346.421	3.225	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)CC1CC(F)(F)C1)C2	ZINC001045948504	1346783700	/nfs/dbraw/zinc/78/37/00/1346783700.db2.gz	LCTRQLXMQIKXCW-SFHVURJKSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc(C)c(C)cn1)C2	ZINC001045953570	1346788774	/nfs/dbraw/zinc/78/87/74/1346788774.db2.gz	FFPATIQWCNUDGO-OAQYLSRUSA-N	0	3	339.483	3.040	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)C[C@@H]1CC=CCC1)C2	ZINC001045956945	1346791955	/nfs/dbraw/zinc/79/19/55/1346791955.db2.gz	PUJALFNLXHDSIK-CTNGQTDRSA-N	0	3	328.500	3.461	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc[nH]c1C1CC1)C2	ZINC001045960618	1346795863	/nfs/dbraw/zinc/79/58/63/1346795863.db2.gz	OLBRVSGPPNDELE-NRFANRHFSA-N	0	3	339.483	3.234	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ncsc1C(C)C)C2	ZINC001045978885	1346816012	/nfs/dbraw/zinc/81/60/12/1346816012.db2.gz	KJULDNGNTGVQTC-LJQANCHMSA-N	0	3	345.512	3.218	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@]1(C)CC=C(C)CC1)C2	ZINC001045985563	1346826349	/nfs/dbraw/zinc/82/63/49/1346826349.db2.gz	WXLMPWLZJMJGKQ-LEWJYISDSA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1coc3ccccc13)C2	ZINC001045987302	1346829122	/nfs/dbraw/zinc/82/91/22/1346829122.db2.gz	NIQUGQCFHDNHMQ-OAQYLSRUSA-N	0	3	336.435	3.384	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2coc3c2cccc3OC)C1	ZINC001046319074	1346933637	/nfs/dbraw/zinc/93/36/37/1346933637.db2.gz	PAIMMJJTMLUUIZ-IBGZPJMESA-N	0	3	328.412	3.212	20	30		EGEDHN
C#CCCN1CC[C@@](C)(NC(=O)c2oc3ccc(F)cc3c2C)C1	ZINC001046374829	1346953724	/nfs/dbraw/zinc/95/37/24/1346953724.db2.gz	SGWORSSLNMCQBO-LJQANCHMSA-N	0	3	328.387	3.098	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@]2(C)CCN(Cc3cccc(C)c3)C2)cc1	ZINC001046532575	1347007178	/nfs/dbraw/zinc/00/71/78/1347007178.db2.gz	XGRAXYOUUFPZNC-QFIPXVFZSA-N	0	3	332.447	3.371	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2nsc3ccc(C)cc32)C1	ZINC001046537137	1347007740	/nfs/dbraw/zinc/00/77/40/1347007740.db2.gz	IMQKEKPYHIRGDZ-GOSISDBHSA-N	0	3	329.469	3.375	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@]2(C)CCN(Cc3cc(C)ccc3C)C2)nc1	ZINC001046780809	1347097603	/nfs/dbraw/zinc/09/76/03/1347097603.db2.gz	ASKREJICNPUTCI-JOCHJYFZSA-N	0	3	347.462	3.074	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2ccc(N(C)C(C)C)cc2)C1	ZINC001046870946	1347140940	/nfs/dbraw/zinc/14/09/40/1347140940.db2.gz	SRNFKBWGHMXGHM-HXUWFJFHSA-N	0	3	329.488	3.302	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@H](CNC(=O)[C@H]2CCC=CCCC2)C1	ZINC001046951826	1347161423	/nfs/dbraw/zinc/16/14/23/1347161423.db2.gz	OLZZTLZDMULKJP-DLBZAZTESA-N	0	3	338.442	3.220	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2c(C)oc(C)c2C)C1	ZINC001046955516	1347164284	/nfs/dbraw/zinc/16/42/84/1347164284.db2.gz	BVQSHOXFYDPLDB-OAHLLOKOSA-N	0	3	340.414	3.468	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@@H](CNC(=O)[C@H]2CCCCC2(C)C)C1	ZINC001046995575	1347178372	/nfs/dbraw/zinc/17/83/72/1347178372.db2.gz	PNAPBXZJOKJYGF-JKSUJKDBSA-N	0	3	340.458	3.300	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@@H](CNC(=O)C2CC(C(C)(C)C)C2)C1	ZINC001046996842	1347179265	/nfs/dbraw/zinc/17/92/65/1347179265.db2.gz	YGNGQIJIPXGHFE-GPANFISMSA-N	0	3	340.458	3.155	20	30		EGEDHN
Cc1occc1C(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1ccccc1)C2	ZINC001047021695	1347189809	/nfs/dbraw/zinc/18/98/09/1347189809.db2.gz	ZVZGJJGPPPDCJA-ZCNNSNEGSA-N	0	3	348.446	3.222	20	30		EGEDHN
CC(C)C(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1ccc(Cl)cc1)C2	ZINC001047027892	1347191621	/nfs/dbraw/zinc/19/16/21/1347191621.db2.gz	AFVKFQKTNLOBDL-UHOSZYNNSA-N	0	3	344.886	3.317	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)[C@H]3[C@@H]4CCCC[C@@H]43)C2)CC1	ZINC001047232883	1347261562	/nfs/dbraw/zinc/26/15/62/1347261562.db2.gz	QGSYFAJUZHDDSW-UWHLTILDSA-N	0	3	342.527	3.397	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)[C@@H]3CCC3(C)C)C2)CC1	ZINC001047247099	1347272174	/nfs/dbraw/zinc/27/21/74/1347272174.db2.gz	AYXUCGGYUJDRQH-OALUTQOASA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)C3(C(C)(F)F)CC3)C2)CC1	ZINC001047255744	1347279668	/nfs/dbraw/zinc/27/96/68/1347279668.db2.gz	CXTBZJAYFQTBOX-INIZCTEOSA-N	0	3	338.442	3.006	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@H]3CC34CCCC4)C2)CC1	ZINC001047262511	1347283620	/nfs/dbraw/zinc/28/36/20/1347283620.db2.gz	QXRSVDZYAMBTGQ-RTBURBONSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3ccc(CC)cc3)C2)CC1	ZINC001047263794	1347285159	/nfs/dbraw/zinc/28/51/59/1347285159.db2.gz	CSWHTDXOQHIYOZ-NRFANRHFSA-N	0	3	338.495	3.446	20	30		EGEDHN
C[C@@H](NCc1cc(F)ccc1C#N)[C@H]1CCN(C(=O)CCC2CC2)C1	ZINC001047766978	1347364949	/nfs/dbraw/zinc/36/49/49/1347364949.db2.gz	XZVIZVJVLGFOLD-PBHICJAKSA-N	0	3	343.446	3.214	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@H]([C@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001047791345	1347373522	/nfs/dbraw/zinc/37/35/22/1347373522.db2.gz	URQSTSWVOIGUCI-ZFWWWQNUSA-N	0	3	347.409	3.287	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)CC2(C)CC2)C1	ZINC001047909877	1347406058	/nfs/dbraw/zinc/40/60/58/1347406058.db2.gz	ONOBAOMLVXZNHY-YJBOKZPZSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]([C@H](C)NCc2ccn(C(C)C)n2)C1	ZINC001047924856	1347411701	/nfs/dbraw/zinc/41/17/01/1347411701.db2.gz	QZIRSZQTKWEDSG-DLBZAZTESA-N	0	3	346.519	3.393	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]([C@H](C)NCc2ncc(C)s2)C1	ZINC001047928872	1347413390	/nfs/dbraw/zinc/41/33/90/1347413390.db2.gz	OVOKTADZEZTFFC-LSDHHAIUSA-N	0	3	335.517	3.380	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]([C@H](C)NCc2ccn(C(C)C)n2)C1	ZINC001047930653	1347414071	/nfs/dbraw/zinc/41/40/71/1347414071.db2.gz	GBGHSVUWPSBZGK-JKSUJKDBSA-N	0	3	332.492	3.003	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H]([C@@H](C)NCc3nccs3)C2)CC1	ZINC001047958152	1347423831	/nfs/dbraw/zinc/42/38/31/1347423831.db2.gz	GUPFWMUHPWHZBT-GDBMZVCRSA-N	0	3	333.501	3.216	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@H](C)[C@H](CNCc2nccs2)C1	ZINC001048264783	1347505822	/nfs/dbraw/zinc/50/58/22/1347505822.db2.gz	DAQBPYVDJSPWBN-WCQYABFASA-N	0	3	341.908	3.106	20	30		EGEDHN
O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)N2CC#Cc1ccccc1)[C@H]1CC12CC2	ZINC001048568591	1347597356	/nfs/dbraw/zinc/59/73/56/1347597356.db2.gz	FATGNEGORJIZPQ-PLACYPQZSA-N	0	3	348.490	3.197	20	30		EGEDHN
C=C(C)CN1CCC(N(Cc2ccccn2)C(=O)[C@@H]2C[C@H]2C)CC1	ZINC001048625098	1347623448	/nfs/dbraw/zinc/62/34/48/1347623448.db2.gz	LGXNKUQCJRPKFR-VQIMIIECSA-N	0	3	327.472	3.107	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)[C@H]2CC2(C)C)CC1	ZINC001048627542	1347624698	/nfs/dbraw/zinc/62/46/98/1347624698.db2.gz	MERXCSFTZFRWAD-GOSISDBHSA-N	0	3	327.472	3.107	20	30		EGEDHN
C=C(C)CN1CCC(N(Cc2ccccn2)C(=O)[C@@H]2CC23CC3)CC1	ZINC001048629385	1347625288	/nfs/dbraw/zinc/62/52/88/1347625288.db2.gz	WGYCAONKJLJYEV-IBGZPJMESA-N	0	3	339.483	3.251	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC[C@H]2[C@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049344863	1347799010	/nfs/dbraw/zinc/79/90/10/1347799010.db2.gz	RDAMEYWQOHYKAP-ZYSHUDEJSA-N	0	3	325.456	3.170	20	30		EGEDHN
Cc1[nH]ccc1C(=O)N1CCC[C@H]2[C@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049406841	1347830418	/nfs/dbraw/zinc/83/04/18/1347830418.db2.gz	NQMQGLLPPYPZFH-VQTJNVASSA-N	0	3	348.450	3.074	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccn(C2CCCCC2)n1	ZINC001049476138	1347867400	/nfs/dbraw/zinc/86/74/00/1347867400.db2.gz	WNWIEICNPJZPBW-RBUKOAKNSA-N	0	3	342.487	3.253	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1c(F)cccc1OC	ZINC001049492056	1347875465	/nfs/dbraw/zinc/87/54/65/1347875465.db2.gz	WNSNMHKONBFYBH-HOTGVXAUSA-N	0	3	332.419	3.089	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc2nccc(C)c2c1	ZINC001049506121	1347882944	/nfs/dbraw/zinc/88/29/44/1347882944.db2.gz	UJHLTONLRSAIFO-VQTJNVASSA-N	0	3	335.451	3.408	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(C(F)F)nc1	ZINC001049511824	1347885629	/nfs/dbraw/zinc/88/56/29/1347885629.db2.gz	PXLQMNXFHIANKA-CVEARBPZSA-N	0	3	335.398	3.274	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1c(C)noc1C(C)C	ZINC001049531247	1347894435	/nfs/dbraw/zinc/89/44/35/1347894435.db2.gz	IWILCAYKLPMIQO-HZPDHXFCSA-N	0	3	331.460	3.361	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1ccc(C)c(Cl)c1	ZINC001049547489	1347902173	/nfs/dbraw/zinc/90/21/73/1347902173.db2.gz	ZOJUHOTZNMXNKQ-MOPGFXCFSA-N	0	3	344.886	3.280	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc2c([nH]1)c(F)ccc2C	ZINC001049562504	1347910872	/nfs/dbraw/zinc/91/08/72/1347910872.db2.gz	WFXIEEQDSOWBEJ-MSOLQXFVSA-N	0	3	341.430	3.480	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C1CCc2ccccc2CC1	ZINC001049562296	1347911176	/nfs/dbraw/zinc/91/11/76/1347911176.db2.gz	VOLDZMGTBPOMBI-NHCUHLMSSA-N	0	3	338.495	3.433	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)COc1ccc(C(C)C)cc1	ZINC001049577348	1347918379	/nfs/dbraw/zinc/91/83/79/1347918379.db2.gz	PFNDDQPDPGZSOT-WOJBJXKFSA-N	0	3	342.483	3.440	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1ccc(CCCC)cc1	ZINC001049578871	1347918666	/nfs/dbraw/zinc/91/86/66/1347918666.db2.gz	GBGUTEWZLNSHMT-NHCUHLMSSA-N	0	3	338.495	3.270	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(-c2ccccc2)on1	ZINC001049584889	1347922830	/nfs/dbraw/zinc/92/28/30/1347922830.db2.gz	XGOAXNQFPIHXJI-RTBURBONSA-N	0	3	349.434	3.044	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(-c2ccco2)o1	ZINC001049587527	1347923787	/nfs/dbraw/zinc/92/37/87/1347923787.db2.gz	HCJVFWLHVBLCIB-CVEARBPZSA-N	0	3	338.407	3.242	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]3[C@@H]2CCN3CCc2ccns2)C1	ZINC001049704414	1347982183	/nfs/dbraw/zinc/98/21/83/1347982183.db2.gz	XZLAFMOWZFJSLZ-IRXDYDNUSA-N	0	3	345.512	3.107	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]3[C@H]2CCN3Cc2cccc(C#N)c2)C1	ZINC001049708197	1347985005	/nfs/dbraw/zinc/98/50/05/1347985005.db2.gz	OQFYQNTYBOOVIQ-WOJBJXKFSA-N	0	3	349.478	3.480	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C[C@H](C)c1ccc(CC)cc1	ZINC001049716161	1347988907	/nfs/dbraw/zinc/98/89/07/1347988907.db2.gz	ZQZDOGZRSGNRIG-DZFGPLHGSA-N	0	3	338.495	3.441	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)[C@H]2CC23CCC3)cc1	ZINC001049753911	1348002177	/nfs/dbraw/zinc/00/21/77/1348002177.db2.gz	LYBBJUDRRZTWRU-HSALFYBXSA-N	0	3	349.478	3.314	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(C)c(OCC)c1	ZINC001049763567	1348008744	/nfs/dbraw/zinc/00/87/44/1348008744.db2.gz	WUVZLUNUOJUIOU-QZTJIDSGSA-N	0	3	328.456	3.259	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccn(C(CC)CC)n1	ZINC001049768513	1348011636	/nfs/dbraw/zinc/01/16/36/1348011636.db2.gz	WRBZNJVXXCZSHP-ROUUACIJSA-N	0	3	330.476	3.109	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1cccc(C)c1	ZINC001049784842	1348020731	/nfs/dbraw/zinc/02/07/31/1348020731.db2.gz	XNZOZJFFEMHGFT-WOZUAGRISA-N	0	3	336.479	3.187	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cccn1C1CCCC1	ZINC001049812734	1348032696	/nfs/dbraw/zinc/03/26/96/1348032696.db2.gz	XNKJAPBTDQYZGE-ROUUACIJSA-N	0	3	327.472	3.468	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1[nH]c2ccc(C)cc2c1C	ZINC001049821694	1348038620	/nfs/dbraw/zinc/03/86/20/1348038620.db2.gz	HSGUKDSRAZKJFI-PMACEKPBSA-N	0	3	349.478	3.487	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc2nc(C)sc2c1	ZINC001049823314	1348039842	/nfs/dbraw/zinc/03/98/42/1348039842.db2.gz	AFPMOPPGQCVEEX-IRXDYDNUSA-N	0	3	341.480	3.470	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1nc(C2CC2)oc1C	ZINC001049829379	1348043898	/nfs/dbraw/zinc/04/38/98/1348043898.db2.gz	SSDMXEGHBIJRMD-HZPDHXFCSA-N	0	3	329.444	3.115	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1sccc1COC	ZINC001049838793	1348050975	/nfs/dbraw/zinc/05/09/75/1348050975.db2.gz	FNOKRFVDLCAXKR-CVEARBPZSA-N	0	3	334.485	3.150	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc2c(c1)CCCC2	ZINC001049878824	1348083489	/nfs/dbraw/zinc/08/34/89/1348083489.db2.gz	VQKPPTODMUKNTB-NHCUHLMSSA-N	0	3	336.479	3.268	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H]1CCCN2C(=O)CC1C2CC3CC(C2)CC1C3	ZINC001049902448	1348102278	/nfs/dbraw/zinc/10/22/78/1348102278.db2.gz	AONRQELAWYJVQR-VWNUNYOYSA-N	0	3	340.511	3.147	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)CC1C2CC3CC(C2)CC1C3	ZINC001049902446	1348102291	/nfs/dbraw/zinc/10/22/91/1348102291.db2.gz	AONRQELAWYJVQR-GHKDSYFESA-N	0	3	340.511	3.147	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc2cccc(C)c2o1	ZINC001049918396	1348111533	/nfs/dbraw/zinc/11/15/33/1348111533.db2.gz	HMZNGZMVBPTJLG-ROUUACIJSA-N	0	3	336.435	3.443	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1c[nH]c2ccc(C)cc12	ZINC001049919141	1348112094	/nfs/dbraw/zinc/11/20/94/1348112094.db2.gz	ULNDHBUSYYZWLS-PMACEKPBSA-N	0	3	335.451	3.179	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001049979849	1348143310	/nfs/dbraw/zinc/14/33/10/1348143310.db2.gz	TYQPLUFAVYMHQM-ZYSHUDEJSA-N	0	3	325.456	3.027	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)Cc3cccc(C(C)C)c3)[C@@H]2C1	ZINC001050085499	1348177173	/nfs/dbraw/zinc/17/71/73/1348177173.db2.gz	GBTQJZFSDSSGMD-LEWJYISDSA-N	0	3	338.495	3.299	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3ccc(-n4cccc4)cc3)[C@@H]2C1	ZINC001050089506	1348179346	/nfs/dbraw/zinc/17/93/46/1348179346.db2.gz	KSZISIQIESGPKK-AZUAARDMSA-N	0	3	335.451	3.200	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)Cc3cccc4ccccc43)[C@@H]2C1	ZINC001050188844	1348205394	/nfs/dbraw/zinc/20/53/94/1348205394.db2.gz	MZHGPOUNBQMHCA-RBBKRZOGSA-N	0	3	346.474	3.328	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3cc4[nH]ccc4s3)[C@@H]2C1	ZINC001050191915	1348206924	/nfs/dbraw/zinc/20/69/24/1348206924.db2.gz	PDPBXINFYFOSTH-DZGCQCFKSA-N	0	3	329.469	3.342	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3ccc(OC)c(Cl)c3)[C@@H]2C1	ZINC001050198317	1348208991	/nfs/dbraw/zinc/20/89/91/1348208991.db2.gz	LJDNNMKNHKRHGR-GOEBONIOSA-N	0	3	334.847	3.071	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)[C@H]4CC=CCC4)C3)CC2)c1	ZINC001050429879	1348263791	/nfs/dbraw/zinc/26/37/91/1348263791.db2.gz	MZIBPFOYJFWXCE-FQEVSTJZSA-N	0	3	349.478	3.339	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)C4=CCCC4)C3)CC2)c1	ZINC001050487908	1348278383	/nfs/dbraw/zinc/27/83/83/1348278383.db2.gz	LZMOAWOYTRKEBU-UHFFFAOYSA-N	0	3	335.451	3.093	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3cc(Cl)sc3Cl)C2)CC1	ZINC001050544743	1348287266	/nfs/dbraw/zinc/28/72/66/1348287266.db2.gz	VPPUALDKZBHNRR-UHFFFAOYSA-N	0	3	343.279	3.226	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)Cc3cccc(C(C)C)c3)C2)CC1	ZINC001050581092	1348293303	/nfs/dbraw/zinc/29/33/03/1348293303.db2.gz	XIXYEAQQRVNENK-UHFFFAOYSA-N	0	3	338.495	3.300	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H](C)c3c(F)cccc3F)C2)CC1	ZINC001050591218	1348295639	/nfs/dbraw/zinc/29/56/39/1348295639.db2.gz	BKOCVCJOQFTDLI-HNNXBMFYSA-N	0	3	346.421	3.016	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3c(C)cc(F)cc3C)C2)CC1	ZINC001050614253	1348303112	/nfs/dbraw/zinc/30/31/12/1348303112.db2.gz	UDQKLXDHLRKZRN-UHFFFAOYSA-N	0	3	328.431	3.004	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC2(C1)CCN(Cc1cnc(C)s1)CC2	ZINC001050613961	1348303124	/nfs/dbraw/zinc/30/31/24/1348303124.db2.gz	GQZBDFSJAVQFBN-UHFFFAOYSA-N	0	3	347.528	3.478	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C3[C@@H]4CCCCCC[C@@H]34)C2)CC1	ZINC001050678241	1348324066	/nfs/dbraw/zinc/32/40/66/1348324066.db2.gz	KSHGMWKVNAHYSV-QZTJIDSGSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)C(C)(C)c3cccc(Cl)c3)C2)CC1	ZINC001050683040	1348325546	/nfs/dbraw/zinc/32/55/46/1348325546.db2.gz	WFVQWRBYEBUGEI-UHFFFAOYSA-N	0	3	344.886	3.175	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)C3CCC(C(C)(C)C)CC3)C2)CC1	ZINC001050745455	1348346321	/nfs/dbraw/zinc/34/63/21/1348346321.db2.gz	SPAARAFVJAYEGV-UHFFFAOYSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3cc(CCC)c(C)s3)C2)CC1	ZINC001050748761	1348347588	/nfs/dbraw/zinc/34/75/88/1348347588.db2.gz	VNVWTVXIJHIUAS-UHFFFAOYSA-N	0	3	330.497	3.180	20	30		EGEDHN
N#Cc1cccc(C[N@H+]2CCC[C@H](NC(=O)c3ccccc3[O-])CC2)c1	ZINC001052212622	1348512971	/nfs/dbraw/zinc/51/29/71/1348512971.db2.gz	XASWZWNQNDEHBO-SFHVURJKSA-N	0	3	349.434	3.048	20	30		EGEDHN
N#Cc1cccc(C[N@@H+]2CCC[C@H](NC(=O)c3ccccc3[O-])CC2)c1	ZINC001052212622	1348512972	/nfs/dbraw/zinc/51/29/72/1348512972.db2.gz	XASWZWNQNDEHBO-SFHVURJKSA-N	0	3	349.434	3.048	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N[C@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC001052317226	1348520679	/nfs/dbraw/zinc/52/06/79/1348520679.db2.gz	CAQJWJWFCKHFQX-ROUUACIJSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2nc(C(C)(C)C)cs2)CC1	ZINC001052465525	1348547909	/nfs/dbraw/zinc/54/79/09/1348547909.db2.gz	MQWWQWFVGXCPJO-AWEZNQCLSA-N	0	3	333.501	3.048	20	30		EGEDHN
CC1(C(=O)N[C@@H]2CCCN(Cc3cccc(C#N)c3)CC2)CCC1	ZINC001052627322	1348600480	/nfs/dbraw/zinc/60/04/80/1348600480.db2.gz	MKOCWUKWNFNSGV-GOSISDBHSA-N	0	3	325.456	3.219	20	30		EGEDHN
C[C@]1(C(=O)N[C@@H]2CCCN(Cc3ccc(C#N)cc3)CC2)C=CCC1	ZINC001052629631	1348602468	/nfs/dbraw/zinc/60/24/68/1348602468.db2.gz	ORWMOICCSGOTQW-CTNGQTDRSA-N	0	3	337.467	3.385	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCCN(Cc3oc(C)nc3C)CC2)C1	ZINC001052693278	1348636821	/nfs/dbraw/zinc/63/68/21/1348636821.db2.gz	QZLRDCBTUHFHEA-INIZCTEOSA-N	0	3	331.460	3.118	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cnc(-c3ccoc3)s2)CC1	ZINC001052774332	1348673829	/nfs/dbraw/zinc/67/38/29/1348673829.db2.gz	YATRYHICMZGDRE-HNNXBMFYSA-N	0	3	343.452	3.011	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)Cc2ccccc2OC(C)C)CC1	ZINC001052790535	1348680460	/nfs/dbraw/zinc/68/04/60/1348680460.db2.gz	MVVNNVZRCIBRKI-IBGZPJMESA-N	0	3	342.483	3.010	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cnc(CC(C)(C)C)s2)CC1	ZINC001052849016	1348700766	/nfs/dbraw/zinc/70/07/66/1348700766.db2.gz	KFWHCABGDJWBJS-HNNXBMFYSA-N	0	3	347.528	3.339	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccccc2C(F)(F)F)CC1	ZINC001052887301	1348724117	/nfs/dbraw/zinc/72/41/17/1348724117.db2.gz	XIKJOCDXTNFGMB-CQSZACIVSA-N	0	3	338.373	3.313	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)CC23CC4CC(CC(C4)C2)C3)CC1	ZINC001052890939	1348726843	/nfs/dbraw/zinc/72/68/43/1348726843.db2.gz	FHPGSIGYOQBDDP-TWJKGYNYSA-N	0	3	328.500	3.197	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2csc3c2CC[C@@H](C)C3)CC1	ZINC001052911642	1348743506	/nfs/dbraw/zinc/74/35/06/1348743506.db2.gz	LULROTTYEKSHBY-HZPDHXFCSA-N	0	3	344.524	3.481	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)CC2C3CC4CC(C3)CC2C4)CC1	ZINC001052947058	1348763036	/nfs/dbraw/zinc/76/30/36/1348763036.db2.gz	HMFZCPCXILJKKG-XIWZRWORSA-N	0	3	342.527	3.443	20	30		EGEDHN
CC(=O)N1CCC[C@@H]([C@H]2CCCN(Cc3ccccc3C#N)C2)C1	ZINC001052998147	1348795344	/nfs/dbraw/zinc/79/53/44/1348795344.db2.gz	VJZWLKXOPAIWTC-VQTJNVASSA-N	0	3	325.456	3.029	20	30		EGEDHN
CC#CC[N@@H+]1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001053065532	1348878808	/nfs/dbraw/zinc/87/88/08/1348878808.db2.gz	HGLAPQQXZUKDEW-IEBWSBKVSA-N	0	3	340.467	3.122	20	30		EGEDHN
CC#CC[N@H+]1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001053065532	1348878812	/nfs/dbraw/zinc/87/88/12/1348878812.db2.gz	HGLAPQQXZUKDEW-IEBWSBKVSA-N	0	3	340.467	3.122	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cccc(C)n2)C1	ZINC001053072017	1348888873	/nfs/dbraw/zinc/88/88/73/1348888873.db2.gz	OSTXXTKFALUWKB-AZUAARDMSA-N	0	3	339.483	3.120	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cc(C)sn2)C1	ZINC001053080109	1348901552	/nfs/dbraw/zinc/90/15/52/1348901552.db2.gz	AKMIIKAPAMZZLU-SJLPKXTDSA-N	0	3	345.512	3.182	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2sccc2F)C1	ZINC001053080179	1348901627	/nfs/dbraw/zinc/90/16/27/1348901627.db2.gz	BCDQXEIHAZXSKO-ZBFHGGJFSA-N	0	3	334.460	3.227	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2c(C)ccn2C)C1	ZINC001053084483	1348906055	/nfs/dbraw/zinc/90/60/55/1348906055.db2.gz	RMBKNHNWXCSPQH-MOPGFXCFSA-N	0	3	341.499	3.064	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cc(OC)cs2)C1	ZINC001053092423	1348918973	/nfs/dbraw/zinc/91/89/73/1348918973.db2.gz	GXOKQSHBPWALCC-RDJZCZTQSA-N	0	3	346.496	3.097	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)C2CCC(=C)CC2)C1	ZINC001053093943	1348922469	/nfs/dbraw/zinc/92/24/69/1348922469.db2.gz	AYWZQTWUNXHPRJ-WOJBJXKFSA-N	0	3	328.500	3.459	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccn(C)c2C)C1	ZINC001053096811	1348926833	/nfs/dbraw/zinc/92/68/33/1348926833.db2.gz	ZUIYNLWJMCETNG-UYAOXDASSA-N	0	3	341.499	3.064	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cc(C(C)C)no2)C1	ZINC001053102752	1348936543	/nfs/dbraw/zinc/93/65/43/1348936543.db2.gz	UWYBIOGHXHDVAB-FUHWJXTLSA-N	0	3	343.471	3.138	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(Cl)cn2)C1	ZINC001053103546	1348937165	/nfs/dbraw/zinc/93/71/65/1348937165.db2.gz	HXUMDNYSPPBVMQ-QAPCUYQASA-N	0	3	345.874	3.075	20	30		EGEDHN
C=CCCN1Cc2ccccc2C[C@@H]1CNC(=O)c1cc[nH]c1CC	ZINC001054039033	1349134497	/nfs/dbraw/zinc/13/44/97/1349134497.db2.gz	SIIOFDQPYHMHQC-GOSISDBHSA-N	0	3	337.467	3.310	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)[C@H]1CCCc3ccccc31)C2	ZINC001054153371	1349156037	/nfs/dbraw/zinc/15/60/37/1349156037.db2.gz	PWJJBWDZDZABAT-UNMCSNQZSA-N	0	3	336.479	3.054	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(CC)s1)C2	ZINC001054161212	1349163825	/nfs/dbraw/zinc/16/38/25/1349163825.db2.gz	ZSJWPRHEYZPRMY-IBGZPJMESA-N	0	3	330.497	3.262	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1cn(CC)c3ccccc13)C2	ZINC001054161708	1349164432	/nfs/dbraw/zinc/16/44/32/1349164432.db2.gz	NEIIQWQXYSUUSN-QFIPXVFZSA-N	0	3	349.478	3.223	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc(C(C)(C)C)oc1C)C2	ZINC001054204648	1349206441	/nfs/dbraw/zinc/20/64/41/1349206441.db2.gz	ZWATYFSBQWCOPC-OAQYLSRUSA-N	0	3	342.483	3.447	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)C[C@@H](C)c1ccccc1F)C2	ZINC001054215211	1349214586	/nfs/dbraw/zinc/21/45/86/1349214586.db2.gz	PHHKHIHLZCTZHQ-UTKZUKDTSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc(C)n(C(C)C)c1C)C2	ZINC001054238279	1349231594	/nfs/dbraw/zinc/23/15/94/1349231594.db2.gz	OVEMPYPVKRRWIA-OAQYLSRUSA-N	0	3	341.499	3.247	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1c[nH]cc1-c1ccccc1)C2	ZINC001054240723	1349234191	/nfs/dbraw/zinc/23/41/91/1349234191.db2.gz	ZWPKITRFXHVPCE-JOCHJYFZSA-N	0	3	347.462	3.243	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cccn1C(C)C)C2	ZINC001054243178	1349236584	/nfs/dbraw/zinc/23/65/84/1349236584.db2.gz	YCNXSWGILSIMSV-HXUWFJFHSA-N	0	3	327.472	3.020	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccoc1C(C)C)C2	ZINC001054245470	1349239447	/nfs/dbraw/zinc/23/94/47/1349239447.db2.gz	SYPUGLQYTVSWCC-HXUWFJFHSA-N	0	3	328.456	3.354	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)C(C)(C)c1ccccc1C)C2	ZINC001054248423	1349243776	/nfs/dbraw/zinc/24/37/76/1349243776.db2.gz	SSQVJZOEGXXLTE-JOCHJYFZSA-N	0	3	338.495	3.220	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cnc(C)s3)cc2C1	ZINC001054258004	1349253381	/nfs/dbraw/zinc/25/33/81/1349253381.db2.gz	FXLPRFAIQCFLNO-UHFFFAOYSA-N	0	3	327.453	3.273	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3coc(CC)n3)cc2C1	ZINC001054262378	1349260115	/nfs/dbraw/zinc/26/01/15/1349260115.db2.gz	ZQSVTZSDLUFPER-UHFFFAOYSA-N	0	3	325.412	3.059	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3conc3CC)cc2C1	ZINC001054280141	1349281165	/nfs/dbraw/zinc/28/11/65/1349281165.db2.gz	ATLSPWWNXLZUIL-UHFFFAOYSA-N	0	3	325.412	3.059	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cnn(CCC)c3)cc2C1	ZINC001054284189	1349285740	/nfs/dbraw/zinc/28/57/40/1349285740.db2.gz	ICOJTGQRYKANTP-UHFFFAOYSA-N	0	3	338.455	3.115	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@H]3C[C@]34CCOC4)cc2C1	ZINC001054288961	1349293267	/nfs/dbraw/zinc/29/32/67/1349293267.db2.gz	PLRCDPOWRIRHJK-CTNGQTDRSA-N	0	3	340.467	3.011	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@@H]3Cc4cccnc4C3)cc2C1	ZINC001054290483	1349295455	/nfs/dbraw/zinc/29/54/55/1349295455.db2.gz	CONRGYCZDPRABW-LJQANCHMSA-N	0	3	347.462	3.005	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3[nH]nc4ccccc43)cc2C1	ZINC001054291227	1349296187	/nfs/dbraw/zinc/29/61/87/1349296187.db2.gz	BWSMIZBONRTSRK-UHFFFAOYSA-N	0	3	346.434	3.385	20	30		EGEDHN
Cc1cc(C)c(C(=O)N2C[C@@H](C)[C@H](NCc3ccc(C#N)s3)C2)o1	ZINC001054524961	1349384256	/nfs/dbraw/zinc/38/42/56/1349384256.db2.gz	MHBKYDZLRJUDAJ-MLGOLLRUSA-N	0	3	343.452	3.080	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCC2CCC2)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054525239	1349384843	/nfs/dbraw/zinc/38/48/43/1349384843.db2.gz	NPRBQNPRNKKAAZ-DYVFJYSZSA-N	0	3	331.485	3.137	20	30		EGEDHN
C[C@H]1CN(C(=O)C(F)=C2CCCC2)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054572258	1349403388	/nfs/dbraw/zinc/40/33/88/1349403388.db2.gz	WUAWXXYMLHBRRQ-LRDDRELGSA-N	0	3	347.459	3.354	20	30		EGEDHN
CC(C(=O)N1C[C@H](NCc2ccc(C#N)c(F)c2)[C@@H](C)C1)=C1CCC1	ZINC001054637491	1349425124	/nfs/dbraw/zinc/42/51/24/1349425124.db2.gz	MXISEBLDEDUMGL-DJJJIMSYSA-N	0	3	341.430	3.134	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2(C)CCCC2)C[C@H]1NCc1ccc(C#N)c(F)c1	ZINC001054942826	1349523076	/nfs/dbraw/zinc/52/30/76/1349523076.db2.gz	AVLHZBKMFFCSLW-RDTXWAMCSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@H]1CN(C(=O)C2(C)CCCC2)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054944768	1349524659	/nfs/dbraw/zinc/52/46/59/1349524659.db2.gz	SWCOUVLEERDENC-BBRMVZONSA-N	0	3	331.485	3.137	20	30		EGEDHN
C#Cc1ccc(C(=O)N2C[C@H](C)[C@H](NCc3ccccc3F)C2)cc1	ZINC001054960850	1349528635	/nfs/dbraw/zinc/52/86/35/1349528635.db2.gz	FPTQFEIYPZZCMV-MGPUTAFESA-N	0	3	336.410	3.057	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H](C)[C@H](NCc2cccc(C(C)C)n2)C1	ZINC001054976002	1349534062	/nfs/dbraw/zinc/53/40/62/1349534062.db2.gz	HRNILGSEEMJEOA-MAUKXSAKSA-N	0	3	329.488	3.354	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)[C@H](NCc2ccccc2OC2CC2)C1	ZINC001054976887	1349534775	/nfs/dbraw/zinc/53/47/75/1349534775.db2.gz	QLMDZJJFTYAUHC-CRAIPNDOSA-N	0	3	342.483	3.377	20	30		EGEDHN
C=CCCN1C[C@@H](C)[C@H](NC(=O)c2scnc2C2CCCC2)C1	ZINC001080056515	1357469857	/nfs/dbraw/zinc/46/98/57/1357469857.db2.gz	UJIFYAUTTHQPNY-UKRRQHHQSA-N	0	3	333.501	3.427	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CN(CCOc3cccc(C)c3)C[C@H]2C)C1	ZINC001080404509	1357608228	/nfs/dbraw/zinc/60/82/28/1357608228.db2.gz	LHCOAPIIKVXOGN-IEBWSBKVSA-N	0	3	342.483	3.167	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)[C@H]2CCCC(C)(C)C2)C1	ZINC001070435354	1354348384	/nfs/dbraw/zinc/34/83/84/1354348384.db2.gz	DOHJGHCBQUPDHG-JKSUJKDBSA-N	0	3	344.503	3.218	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)CN(C(=O)C1(C)CCCCCC1)C[C@@H](C)O2	ZINC001071178257	1354488432	/nfs/dbraw/zinc/48/84/32/1354488432.db2.gz	MMBGVVKEPXSGJF-WIYYLYMNSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H](C)O[C@@]2(CCN(Cc3ccccc3)C2)C1	ZINC001071197487	1354499117	/nfs/dbraw/zinc/49/91/17/1354499117.db2.gz	UBQJNIZUWNVDLO-LAUBAEHRSA-N	0	3	342.483	3.091	20	30		EGEDHN
C=Cc1ccc(C(=O)N2C[C@@H](C)O[C@]3(CCN(CC(=C)C)C3)C2)cc1	ZINC001071209402	1354505954	/nfs/dbraw/zinc/50/59/54/1354505954.db2.gz	JIUADVGEWOSQOJ-UTKZUKDTSA-N	0	3	340.467	3.211	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1cc(C)cc(F)c1)C[C@@H](C)O2	ZINC001071213232	1354508613	/nfs/dbraw/zinc/50/86/13/1354508613.db2.gz	BDLHOIQGJJKHCP-UZLBHIALSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1ccc(CF)cc1)C[C@H](C)O2	ZINC001071245837	1354525873	/nfs/dbraw/zinc/52/58/73/1354525873.db2.gz	KERRGWCDXZBWQR-OXJNMPFZSA-N	0	3	346.446	3.038	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H]3CCC(C)=C(C)C3)C2)CC1	ZINC001086924460	1359249966	/nfs/dbraw/zinc/24/99/66/1359249966.db2.gz	SXBYOCPCDIAUKQ-RTBURBONSA-N	0	3	328.500	3.459	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)C2(c3ccccc3F)CCC2)C1	ZINC001080764375	1357734713	/nfs/dbraw/zinc/73/47/13/1357734713.db2.gz	QAMWLPZNKVXRQE-CRAIPNDOSA-N	0	3	330.447	3.260	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2sc(Cl)nc2C)CC[C@H]1C	ZINC001071533643	1354750948	/nfs/dbraw/zinc/75/09/48/1354750948.db2.gz	IZOLKCRGUOUELN-ZYHUDNBSSA-N	0	3	327.881	3.264	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccnc(-n3cccc3)c2)CC[C@H]1C	ZINC001071594673	1354785042	/nfs/dbraw/zinc/78/50/42/1354785042.db2.gz	WIXNWZNPVRVUPU-SJLPKXTDSA-N	0	3	338.455	3.031	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc3c(cn2)CCCC3)CC[C@H]1C	ZINC001071665219	1354837585	/nfs/dbraw/zinc/83/75/85/1354837585.db2.gz	BWIQUQBIYDBTBL-CRAIPNDOSA-N	0	3	327.472	3.119	20	30		EGEDHN
C=C(C)CCN1C[C@H](NC(=O)c2nc3cnccc3s2)CC[C@@H]1C	ZINC001071672257	1354841469	/nfs/dbraw/zinc/84/14/69/1354841469.db2.gz	ADZPOHNHSSFJJP-UONOGXRCSA-N	0	3	344.484	3.240	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc3ccc(OC)cc3[nH]2)CC[C@@H]1C	ZINC001071728472	1354883478	/nfs/dbraw/zinc/88/34/78/1354883478.db2.gz	NGPKOCBQBRCFEL-GOEBONIOSA-N	0	3	341.455	3.335	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CC[C@@H](C)N(Cc3ccccc3)C2)cc1	ZINC001071731853	1354886130	/nfs/dbraw/zinc/88/61/30/1354886130.db2.gz	LAXRTGLCSUSHLS-UTKZUKDTSA-N	0	3	332.447	3.451	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc3nc(C)n(C)c3c2)CC[C@@H]1C	ZINC001071738477	1354889093	/nfs/dbraw/zinc/88/90/93/1354889093.db2.gz	CWAHCQUCHQYDIZ-WMLDXEAASA-N	0	3	340.471	3.041	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(N3CC=CC3)cc2)CC[C@H]1C	ZINC001071821863	1354962213	/nfs/dbraw/zinc/96/22/13/1354962213.db2.gz	SYOUQQHMYUVRNN-IEBWSBKVSA-N	0	3	339.483	3.222	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(C(F)F)c(F)c2)CC[C@H]1C	ZINC001071822614	1354963039	/nfs/dbraw/zinc/96/30/39/1354963039.db2.gz	ZELARKXMEOWXHU-TZMCWYRMSA-N	0	3	338.373	3.369	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C2(c3cccc(F)c3)CC2)CC[C@@H]1C	ZINC001071855488	1354983554	/nfs/dbraw/zinc/98/35/54/1354983554.db2.gz	QJUSSUQQLYIGSF-MAUKXSAKSA-N	0	3	330.447	3.403	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc(C)oc2C(F)(F)F)CC[C@H]1C	ZINC001071859032	1354987413	/nfs/dbraw/zinc/98/74/13/1354987413.db2.gz	XMGXMGXXKFEPHM-DGCLKSJQSA-N	0	3	342.361	3.213	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc(C)oc2C(F)(F)F)CC[C@@H]1C	ZINC001071859033	1354987562	/nfs/dbraw/zinc/98/75/62/1354987562.db2.gz	XMGXMGXXKFEPHM-WCQYABFASA-N	0	3	342.361	3.213	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)Cc2cccc(OCCC)c2)CC[C@@H]1C	ZINC001071969686	1355051522	/nfs/dbraw/zinc/05/15/22/1355051522.db2.gz	AUHDYPVJPROULQ-WMZOPIPTSA-N	0	3	330.472	3.173	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CC[C@@H](C)N(Cc3ccc(C)cc3)C2)nc1	ZINC001071998277	1355066299	/nfs/dbraw/zinc/06/62/99/1355066299.db2.gz	IEUFMYJQRDNXAB-XLIONFOSSA-N	0	3	347.462	3.154	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CC[C@H](C)N(Cc3ccc(C)cc3)C2)cn1	ZINC001072002958	1355068323	/nfs/dbraw/zinc/06/83/23/1355068323.db2.gz	PZFCLSUZQQIQTP-UWJYYQICSA-N	0	3	347.462	3.154	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccccc2OC(C)C)CC[C@@H]1C	ZINC001072008259	1355072769	/nfs/dbraw/zinc/07/27/69/1355072769.db2.gz	CVXDZYZHBRRAER-DLBZAZTESA-N	0	3	328.456	3.080	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2cc3nc(C)ccc3o2)CC[C@@H]1C	ZINC001072012774	1355077033	/nfs/dbraw/zinc/07/70/33/1355077033.db2.gz	SCPIMUCFZWJDRO-LSDHHAIUSA-N	0	3	327.428	3.295	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2c[nH]c3ccccc23)CC[C@H]1C	ZINC001072012950	1355077714	/nfs/dbraw/zinc/07/77/14/1355077714.db2.gz	VQRXEYJZYBAGJC-WBVHZDCISA-N	0	3	325.456	3.256	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)Cc2coc3cc(C)ccc23)CC[C@@H]1C	ZINC001072048392	1355102968	/nfs/dbraw/zinc/10/29/68/1355102968.db2.gz	JYIVZWXWRGSLMC-FUHWJXTLSA-N	0	3	338.451	3.276	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)Cc2coc3cc(C)ccc23)CC[C@H]1C	ZINC001072050276	1355104386	/nfs/dbraw/zinc/10/43/86/1355104386.db2.gz	UQKZNYLZMUFNOF-NVXWUHKLSA-N	0	3	326.440	3.439	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(F)c3occc32)CC[C@H]1C	ZINC001072089046	1355122202	/nfs/dbraw/zinc/12/22/02/1355122202.db2.gz	VEALTQHCDCQVES-ZIAGYGMSSA-N	0	3	328.387	3.178	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(OCC3CC3)nc2)CC[C@H]1C	ZINC001072098699	1355128070	/nfs/dbraw/zinc/12/80/70/1355128070.db2.gz	FAEVQUZLHUCNOM-CRAIPNDOSA-N	0	3	343.471	3.029	20	30		EGEDHN
C[C@@H]1CCN(C(=O)c2ccoc2)C[C@@H]1CNCc1ccccc1C#N	ZINC001072194137	1355182162	/nfs/dbraw/zinc/18/21/62/1355182162.db2.gz	FXQSEHAXLGUHDW-BEFAXECRSA-N	0	3	337.423	3.039	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](C)[C@H](CNCc2csc(C)n2)C1	ZINC001072334927	1355243683	/nfs/dbraw/zinc/24/36/83/1355243683.db2.gz	JULJUIQVCUAAKO-UKRRQHHQSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](C)[C@@H](CNCc3cnc(C)o3)C2)CC1	ZINC001072356159	1355254342	/nfs/dbraw/zinc/25/43/42/1355254342.db2.gz	HIGKXZVBWGXRNO-QAPCUYQASA-N	0	3	345.487	3.304	20	30		EGEDHN
Cc1ccccc1C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001072414022	1355279110	/nfs/dbraw/zinc/27/91/10/1355279110.db2.gz	MKMWEMYKCIFFJL-UHFFFAOYSA-N	0	3	345.446	3.215	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC2(C1)CCN([C@@H](C)c1cccc(Cl)c1)C2	ZINC001072544285	1355326439	/nfs/dbraw/zinc/32/64/39/1355326439.db2.gz	HKUZYMXGXBKUDJ-KBPBESRZSA-N	0	3	331.847	3.095	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC2(C1)CCN([C@H]1CCc3c1cccc3Cl)C2	ZINC001072552090	1355331074	/nfs/dbraw/zinc/33/10/74/1355331074.db2.gz	MNQFUSVVPJRNHT-DYVFJYSZSA-N	0	3	343.858	3.021	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H](C)Cc3ccccc3Cl)C2)C1	ZINC001073021644	1355552639	/nfs/dbraw/zinc/55/26/39/1355552639.db2.gz	JSKDOAZXKFJNMT-MRXNPFEDSA-N	0	3	344.886	3.076	20	30		EGEDHN
CC[C@@]1(C)C[C@@H]1C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001073091063	1355588733	/nfs/dbraw/zinc/58/87/33/1355588733.db2.gz	DHKTVHFWNSGQHJ-QUCCMNQESA-N	0	3	337.467	3.029	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)C(C)(C)c3ccc(CC)cc3)C2)C1	ZINC001073116576	1355605440	/nfs/dbraw/zinc/60/54/40/1355605440.db2.gz	VITDGOPCKSUMHZ-UHFFFAOYSA-N	0	3	326.484	3.247	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H](C)c3cccc(Cl)c3)C2)C1	ZINC001073447589	1355783823	/nfs/dbraw/zinc/78/38/23/1355783823.db2.gz	ZDJZGKFKCVNPJP-HNNXBMFYSA-N	0	3	330.859	3.001	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2ccccc2CCC)C1	ZINC001073689967	1355866936	/nfs/dbraw/zinc/86/69/36/1355866936.db2.gz	IZPPVQVUARTDJW-SFHVURJKSA-N	0	3	330.472	3.036	20	30		EGEDHN
C#CCCN1CCCO[C@H](CNC(=O)C2CC(C)(C)CC(C)(C)C2)C1	ZINC001073709631	1355872610	/nfs/dbraw/zinc/87/26/10/1355872610.db2.gz	BSUGHBUPQOPYKM-GOSISDBHSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2ccc3c(c2)C=CCC3)C1	ZINC001073806936	1355903859	/nfs/dbraw/zinc/90/38/59/1355903859.db2.gz	AJJMSKOVIYOXLN-FQEVSTJZSA-N	0	3	340.467	3.043	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2cccc(C(C)C)c2)C1	ZINC001073839950	1355913489	/nfs/dbraw/zinc/91/34/89/1355913489.db2.gz	PZEDLDAUNJRERZ-LJQANCHMSA-N	0	3	330.472	3.207	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc3[nH]c(C)c(C)c3c1)C2	ZINC001098374677	1363310072	/nfs/dbraw/zinc/31/00/72/1363310072.db2.gz	XASZFOKFOURWPO-AHRSYUTCSA-N	0	3	335.451	3.143	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3csc(-c4ccoc4)n3)[C@@H]2C1	ZINC001076370245	1356561706	/nfs/dbraw/zinc/56/17/06/1356561706.db2.gz	MDDZOAYHNOCRIY-XJKSGUPXSA-N	0	3	343.452	3.126	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2cc[nH]c2C2CCC2)C[C@H]1C(F)(F)F	ZINC001099306474	1363741102	/nfs/dbraw/zinc/74/11/02/1363741102.db2.gz	GQGQEYIDNNDSPV-ZIAGYGMSSA-N	0	3	341.377	3.061	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)CCOCc1ccccc1	ZINC001099344162	1363762601	/nfs/dbraw/zinc/76/26/01/1363762601.db2.gz	HIWCHZPQKWUAQT-IBGZPJMESA-N	0	3	344.499	3.386	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H](F)Cc1ccccc1	ZINC001099349671	1363766509	/nfs/dbraw/zinc/76/65/09/1363766509.db2.gz	RJPCXDKTLGNWPP-OALUTQOASA-N	0	3	344.474	3.197	20	30		EGEDHN
C#CCCN1C[C@@H](C)[C@H](NC(=O)c2c(Cl)cccc2Cl)C1	ZINC001080839011	1357749672	/nfs/dbraw/zinc/74/96/72/1357749672.db2.gz	RNERDNYWKDJEEC-BXUZGUMPSA-N	0	3	325.239	3.067	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc[nH]c2CCC)C12CCC2	ZINC001078704733	1357062464	/nfs/dbraw/zinc/06/24/64/1357062464.db2.gz	BRQBMHSQXCHUNM-JKSUJKDBSA-N	0	3	335.879	3.350	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2cncc(Cl)c2)C12CCC2	ZINC001078746169	1357070313	/nfs/dbraw/zinc/07/03/13/1357070313.db2.gz	ILBUEINAHNFPPH-KGLIPLIRSA-N	0	3	340.254	3.118	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H]2CCC=CCCC2)C[C@H]1c1ccccc1	ZINC001081132033	1357843870	/nfs/dbraw/zinc/84/38/70/1357843870.db2.gz	DHFOCLKJOUHRDF-QHAWAJNXSA-N	0	3	336.479	3.340	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H]2CCCCC2(F)F)C[C@H]1c1ccccc1	ZINC001081151543	1357845304	/nfs/dbraw/zinc/84/53/04/1357845304.db2.gz	MOEJUPUTBZRDRB-RCCFBDPRSA-N	0	3	346.421	3.029	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H](C)c2cccc(C)c2)C[C@H]1c1ccccc1	ZINC001081189218	1357848526	/nfs/dbraw/zinc/84/85/26/1357848526.db2.gz	PCDCWJHBQHUKRZ-BVYCBKJFSA-N	0	3	346.474	3.316	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C(C)(C)c2ccccc2)C[C@H]1c1ccccc1	ZINC001081222243	1357851336	/nfs/dbraw/zinc/85/13/36/1357851336.db2.gz	UAKMMJOVORUHGY-LEWJYISDSA-N	0	3	346.474	3.182	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2cccc3c2CCC3)C[C@H]1c1ccccc1	ZINC001081233214	1357852217	/nfs/dbraw/zinc/85/22/17/1357852217.db2.gz	WVNPHIQTONWKCB-FCHUYYIVSA-N	0	3	344.458	3.006	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2cc(C(C)C)oc2C)[C@H](OC)C1	ZINC001082289117	1358007115	/nfs/dbraw/zinc/00/71/15/1358007115.db2.gz	PGUYHHIMEYIVOD-SJLPKXTDSA-N	0	3	334.460	3.107	20	30		EGEDHN
COc1ccc([C@H](NC(C)C)C(=O)N2CCCC(C)(C)[C@@H]2C#N)cc1	ZINC001183389803	1387305973	/nfs/dbraw/zinc/30/59/73/1387305973.db2.gz	SGGHPDUHMZYTDB-ROUUACIJSA-N	0	3	343.471	3.275	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2ccc(CC(C)C)cc2)[C@H](OC)C1	ZINC001082364086	1358023161	/nfs/dbraw/zinc/02/31/61/1358023161.db2.gz	MDXTWJMPMGSOMX-WOJBJXKFSA-N	0	3	344.499	3.280	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@@]2(C)CC=CCC2)C[C@H]1NCc1ccc(C#N)s1	ZINC001082530811	1358055358	/nfs/dbraw/zinc/05/53/58/1358055358.db2.gz	MFFDGNBXZGEMCJ-BJZITVGISA-N	0	3	343.496	3.303	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@@H]2CC23CCCC3)C[C@H]1NCc1ccc(C#N)s1	ZINC001082842261	1358096948	/nfs/dbraw/zinc/09/69/48/1358096948.db2.gz	DEZLXRYOXOZYSI-XOKHGSTOSA-N	0	3	343.496	3.137	20	30		EGEDHN
C=C[C@@H](C(=O)N1C[C@@H](C)[C@H](NCc2ccns2)C1)c1ccccc1	ZINC001082937295	1358106171	/nfs/dbraw/zinc/10/61/71/1358106171.db2.gz	RBXFBWKDWAKMPY-ZTFGCOKTSA-N	0	3	341.480	3.049	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)C[C@@H](C)C3CCCCC3)[C@H]2C1	ZINC001083222392	1358123869	/nfs/dbraw/zinc/12/38/69/1358123869.db2.gz	QZAZQYKKGKUBFQ-YZGWKJHDSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3cc4nc(C)ccc4o3)[C@@H]2C1	ZINC001084788226	1358309388	/nfs/dbraw/zinc/30/93/88/1358309388.db2.gz	MCQTZEZDVGFNHL-NVXWUHKLSA-N	0	3	339.439	3.249	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)CC34CC5CC(CC(C5)C3)C4)[C@@H]2C1	ZINC001084793588	1358311887	/nfs/dbraw/zinc/31/18/87/1358311887.db2.gz	IOURFCPXUOLMHZ-PHMMFBKASA-N	0	3	340.511	3.149	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3cc4c(s3)CCCC4)[C@@H]2C1	ZINC001084812364	1358317037	/nfs/dbraw/zinc/31/70/37/1358317037.db2.gz	BKDUSWGJZCBQOV-HZPDHXFCSA-N	0	3	330.497	3.349	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@@H](C)c3ccc(F)c(F)c3)[C@@H]2C1	ZINC001084842631	1358325963	/nfs/dbraw/zinc/32/59/63/1358325963.db2.gz	XEZVWOFSTRGDJA-JCKWVBRZSA-N	0	3	334.410	3.177	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CCN(C(=O)[C@H]4CC=CCC4)C[C@@H]32)c1	ZINC001084887896	1358340147	/nfs/dbraw/zinc/34/01/47/1358340147.db2.gz	IKVBMXJYFDIUDA-HKBOAZHASA-N	0	3	349.478	3.337	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C[C@H](C)c3ccccc3F)C[C@@H]21	ZINC001085058111	1358380699	/nfs/dbraw/zinc/38/06/99/1358380699.db2.gz	UMHQBSAKRXRGEX-QKLQHJQFSA-N	0	3	342.458	3.265	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@H](C)Cc3ccccc3C)C[C@@H]21	ZINC001085103330	1358392025	/nfs/dbraw/zinc/39/20/25/1358392025.db2.gz	KOHGTJMMFPPOEL-SBHAEUEKSA-N	0	3	338.495	3.120	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N[C@@H]1CCCC[C@H]1NCc1ccc(C#N)cc1F	ZINC001085173929	1358423986	/nfs/dbraw/zinc/42/39/86/1358423986.db2.gz	OSRHWLWBJMBIBB-CGTJXYLNSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccnn1[C@H](C)CC	ZINC001085214839	1358435911	/nfs/dbraw/zinc/43/59/11/1358435911.db2.gz	SYUIMEHDHCGIBW-RBSFLKMASA-N	0	3	338.883	3.237	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cc(C(C)C)no1	ZINC001085352717	1358476550	/nfs/dbraw/zinc/47/65/50/1358476550.db2.gz	UALIXXUTEPBBOB-CHWSQXEVSA-N	0	3	325.840	3.181	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1sc(CC)nc1C	ZINC001085361205	1358478481	/nfs/dbraw/zinc/47/84/81/1358478481.db2.gz	RKEVYJDGECLQOM-CHWSQXEVSA-N	0	3	341.908	3.397	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)Cc1ccc2c(c1)COC2	ZINC001085405193	1358491761	/nfs/dbraw/zinc/49/17/61/1358491761.db2.gz	YQBSSCXRZBPZOY-QZTJIDSGSA-N	0	3	348.874	3.029	20	30		EGEDHN
CN(C[C@H]1CCN1CCC1CCCCCC1)C(=O)c1ccc(C#N)[nH]1	ZINC001085553572	1358589365	/nfs/dbraw/zinc/58/93/65/1358589365.db2.gz	OZHPQYJFLFETAC-GOSISDBHSA-N	0	3	342.487	3.393	20	30		EGEDHN
CN(C[C@H]1CCN1[C@@H]1CCCc2ccccc21)C(=O)c1c[nH]c(C#N)c1	ZINC001085556747	1358592278	/nfs/dbraw/zinc/59/22/78/1358592278.db2.gz	YURJRPTZLDLRJW-UYAOXDASSA-N	0	3	348.450	3.110	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1csc([C@@H]2CCCO2)n1	ZINC001085594466	1358621711	/nfs/dbraw/zinc/62/17/11/1358621711.db2.gz	HJRNWETUASZXKQ-HOCLYGCPSA-N	0	3	349.500	3.107	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc(C)c(NC(C)=O)c1	ZINC001085614030	1358635320	/nfs/dbraw/zinc/63/53/20/1358635320.db2.gz	DFSGQXBBONRJBP-GOSISDBHSA-N	0	3	343.471	3.066	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cnoc1-c1ccco1	ZINC001085677504	1358682051	/nfs/dbraw/zinc/68/20/51/1358682051.db2.gz	OAMOJSGYHASTAX-CQSZACIVSA-N	0	3	329.400	3.047	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1cc2c([nH]1)c(F)ccc2C	ZINC001085684169	1358685587	/nfs/dbraw/zinc/68/55/87/1358685587.db2.gz	LJQVTRKZQULJRE-AWEZNQCLSA-N	0	3	329.419	3.338	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cccc2c1O[C@@H](C)C2	ZINC001085729735	1358718687	/nfs/dbraw/zinc/71/86/87/1358718687.db2.gz	FRXOALXSRJVUDE-RDJZCZTQSA-N	0	3	328.456	3.123	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cccc(N2CC=CC2)c1	ZINC001085846758	1358815148	/nfs/dbraw/zinc/81/51/48/1358815148.db2.gz	QOEGHKJKBKAJPU-FQEVSTJZSA-N	0	3	339.483	3.175	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC001085865967	1358831586	/nfs/dbraw/zinc/83/15/86/1358831586.db2.gz	SNURDZQKPUWKIY-YZGWKJHDSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccnc(C(F)(F)F)c1	ZINC001085907907	1358867346	/nfs/dbraw/zinc/86/73/46/1358867346.db2.gz	RCAOXEJEEZTGJV-AWEZNQCLSA-N	0	3	341.377	3.213	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C[C@H]2CCN2[C@H](C)c2ccccc2C)cn1	ZINC001085932917	1358887977	/nfs/dbraw/zinc/88/79/77/1358887977.db2.gz	LTSQIYNRDXGDJS-YLJYHZDGSA-N	0	3	347.462	3.279	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C[C@@H]2CCN2[C@@H](CC)c2ccccc2)nc1	ZINC001085934077	1358889150	/nfs/dbraw/zinc/88/91/50/1358889150.db2.gz	RCJAKRSSYUEIAJ-FPOVZHCZSA-N	0	3	347.462	3.361	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1cccc(C(F)(F)F)c1	ZINC001085942091	1358899774	/nfs/dbraw/zinc/89/97/74/1358899774.db2.gz	XZBBXOOUGRNFNV-OAHLLOKOSA-N	0	3	326.362	3.428	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)C12CC(C(F)(F)F)(C1)C2	ZINC001085988626	1358940015	/nfs/dbraw/zinc/94/00/15/1358940015.db2.gz	RXHJUNKWKBMOSO-JEYLPNPQSA-N	0	3	330.394	3.218	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)C2C(C)(C)C2(C)C)C1	ZINC001086053873	1358980098	/nfs/dbraw/zinc/98/00/98/1358980098.db2.gz	CNKZYBGEUKNWHD-TXEJJXNPSA-N	0	3	343.309	3.062	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc(C)c(OC)c(C)c2)C1	ZINC001086094179	1358994416	/nfs/dbraw/zinc/99/44/16/1358994416.db2.gz	ZSXIQZHHDNDMBC-FZNQNYSPSA-N	0	3	336.863	3.163	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc(F)cc3ccoc32)C1	ZINC001086131919	1359005559	/nfs/dbraw/zinc/00/55/59/1359005559.db2.gz	SFOPURSYHFFMCE-VDISTLRHSA-N	0	3	336.794	3.422	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2coc3ccc(OC)cc23)C1	ZINC001086144768	1359008090	/nfs/dbraw/zinc/00/80/90/1359008090.db2.gz	FSMLXWAHPGOAKS-BETUJISGSA-N	0	3	348.830	3.292	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)[C@@H]2CCC[C@@H](C)C2)C1	ZINC001086182894	1359019231	/nfs/dbraw/zinc/01/92/31/1359019231.db2.gz	MSTFKFBRQCYLDE-NGFQHRJXSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc3cc(OC)ccc3[nH]2)C1	ZINC001086183791	1359019758	/nfs/dbraw/zinc/01/97/58/1359019758.db2.gz	UNOMACBWESPMNU-XBXGTLAGSA-N	0	3	347.846	3.027	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc3cc(F)ccc3o2)C1	ZINC001086214181	1359028980	/nfs/dbraw/zinc/02/89/80/1359028980.db2.gz	MTSIRGFOILKFNE-VDISTLRHSA-N	0	3	336.794	3.422	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(OC)cc2Cl)C1	ZINC001086226938	1359032944	/nfs/dbraw/zinc/03/29/44/1359032944.db2.gz	TZJYBEACESCGBO-TXEJJXNPSA-N	0	3	343.254	3.199	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2c(Cl)cccc2OC)C1	ZINC001086277966	1359051418	/nfs/dbraw/zinc/05/14/18/1359051418.db2.gz	BRVMSTRDQMCIOI-TXEJJXNPSA-N	0	3	343.254	3.199	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2c(C)[nH]c3ccccc32)C1	ZINC001086422483	1359092991	/nfs/dbraw/zinc/09/29/91/1359092991.db2.gz	IBJDKZOLLFUILJ-HDJSIYSDSA-N	0	3	331.847	3.327	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2oc3ccccc3c2OC)C1	ZINC001086445680	1359098733	/nfs/dbraw/zinc/09/87/33/1359098733.db2.gz	JTQUXWPMRIRBNV-JOCQHMNTSA-N	0	3	348.830	3.292	20	30		EGEDHN
CCC(=O)N[C@@H]1CN(Cc2ccc(C#N)cc2)C[C@H]1c1ccccc1	ZINC001086568130	1359150490	/nfs/dbraw/zinc/15/04/90/1359150490.db2.gz	OULPYHCKADGBQS-VQTJNVASSA-N	0	3	333.435	3.052	20	30		EGEDHN
C=C(C)CN1C[C@@H](c2ccccc2)[C@H](NC(=O)Cc2ccsc2)C1	ZINC001086573184	1359152048	/nfs/dbraw/zinc/15/20/48/1359152048.db2.gz	HZGXSVBCCVZHSR-RBUKOAKNSA-N	0	3	340.492	3.451	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2sc(Cl)nc2C)C1	ZINC001086706640	1359189831	/nfs/dbraw/zinc/18/98/31/1359189831.db2.gz	JUVYCDFQDHPWCM-WDEREUQCSA-N	0	3	348.299	3.346	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cc(F)ccc2OC)C1	ZINC001086771658	1359197971	/nfs/dbraw/zinc/19/79/71/1359197971.db2.gz	WXAFLUYQJKLYHU-GXTWGEPZSA-N	0	3	340.826	3.075	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2scnc2C2CC2)C1	ZINC001086823431	1359208597	/nfs/dbraw/zinc/20/85/97/1359208597.db2.gz	DSHOGEQSLZMZMX-WCQYABFASA-N	0	3	339.892	3.261	20	30		EGEDHN
CC(C)C(=O)N1CC2(C[C@H]1C)CCN(Cc1cccc(C#N)c1)CC2	ZINC001086904146	1359233877	/nfs/dbraw/zinc/23/38/77/1359233877.db2.gz	YHDWHQITLGCOMR-QGZVFWFLSA-N	0	3	339.483	3.417	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc(C)c(F)c3)C2)CC1	ZINC001086931153	1359255077	/nfs/dbraw/zinc/25/50/77/1359255077.db2.gz	AUTLVEYBOHQBRQ-INIZCTEOSA-N	0	3	328.431	3.084	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cccc4cccnc43)C2)CC1	ZINC001086931340	1359255426	/nfs/dbraw/zinc/25/54/26/1359255426.db2.gz	GFSOALYCRJDCDB-QGZVFWFLSA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3ncc(C)cc3C)C2)CC1	ZINC001086934600	1359257729	/nfs/dbraw/zinc/25/77/29/1359257729.db2.gz	VAAKPOASCFECCB-GOSISDBHSA-N	0	3	339.483	3.038	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3occc3CC)C2)CC1	ZINC001086941584	1359263315	/nfs/dbraw/zinc/26/33/15/1359263315.db2.gz	XZLKORQROHHQJY-MRXNPFEDSA-N	0	3	328.456	3.182	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc4ccncc4c3)C2)CC1	ZINC001086951425	1359271664	/nfs/dbraw/zinc/27/16/64/1359271664.db2.gz	DMNAARGFJOWNQY-QGZVFWFLSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc(F)cc3Cl)C2)CC1	ZINC001086955432	1359276025	/nfs/dbraw/zinc/27/60/25/1359276025.db2.gz	NDCADFBLCNUJIJ-CQSZACIVSA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@H](C)Cc3ccccc3)C2)CC1	ZINC001086957125	1359278014	/nfs/dbraw/zinc/27/80/14/1359278014.db2.gz	FNGGZUNODOZEKL-RTBURBONSA-N	0	3	338.495	3.201	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)Cc3ccc(C)cc3)C(C)(C)[C@@H]21	ZINC001087294762	1359374878	/nfs/dbraw/zinc/37/48/78/1359374878.db2.gz	XXBKNCNMKDCAHE-HMXCVIKNSA-N	0	3	338.495	3.166	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc(CC)s1	ZINC001087294605	1359375485	/nfs/dbraw/zinc/37/54/85/1359375485.db2.gz	VZBUPBPYXMARCZ-HYVNUMGLSA-N	0	3	330.497	3.163	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc2cc(C)ccc2[nH]1	ZINC001087299665	1359381577	/nfs/dbraw/zinc/38/15/77/1359381577.db2.gz	ZVZOVPXLVFNGBI-LSTHTHJFSA-N	0	3	349.478	3.328	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccn(CC)c3C)C(C)(C)[C@H]21	ZINC001087299845	1359382755	/nfs/dbraw/zinc/38/27/55/1359382755.db2.gz	CHYOKYYEZBFQIW-QYZOEREBSA-N	0	3	341.499	3.059	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccoc3C3CC3)C(C)(C)[C@H]21	ZINC001087302152	1359384781	/nfs/dbraw/zinc/38/47/81/1359384781.db2.gz	OGWPSMZEEPWFJA-NJAFHUGGSA-N	0	3	326.440	3.009	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2[C@@H]3CCCN(CC#CC)[C@H]3C2(C)C)CC1	ZINC001087303365	1359386804	/nfs/dbraw/zinc/38/68/04/1359386804.db2.gz	KMTADJDUQSOHJL-IPMKNSEASA-N	0	3	328.500	3.361	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc(C)c(F)c3F)C(C)(C)[C@H]21	ZINC001087304297	1359387466	/nfs/dbraw/zinc/38/74/66/1359387466.db2.gz	AHNGYMHTJUEEQL-JLSDUUJJSA-N	0	3	346.421	3.125	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc4ccncc4c3)C(C)(C)[C@H]21	ZINC001087312147	1359399699	/nfs/dbraw/zinc/39/96/99/1359399699.db2.gz	ZTUAEUOTCMVQRT-AQNXPRMDSA-N	0	3	347.462	3.087	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc4ccccc4o3)C(C)(C)[C@H]21	ZINC001087315747	1359405931	/nfs/dbraw/zinc/40/59/31/1359405931.db2.gz	HPGSVXMSSNRKNQ-LZQZEXGQSA-N	0	3	336.435	3.285	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)Cc3ccc(C)c(C)c3)C(C)(C)[C@H]21	ZINC001087316424	1359406540	/nfs/dbraw/zinc/40/65/40/1359406540.db2.gz	RHBFRJIOHJXOEW-NRSPTQNISA-N	0	3	338.495	3.084	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc2c(c1)CCC2	ZINC001087317119	1359408294	/nfs/dbraw/zinc/40/82/94/1359408294.db2.gz	CVMZBCSIXWHWNY-HSALFYBXSA-N	0	3	336.479	3.027	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3sccc3CC)C(C)(C)[C@H]21	ZINC001087317685	1359408949	/nfs/dbraw/zinc/40/89/49/1359408949.db2.gz	LIUFIUWPZNJFDS-PVAVHDDUSA-N	0	3	330.497	3.163	20	30		EGEDHN
CCCC(=O)N1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(Cc2ccc(C#N)s2)C1	ZINC001087329615	1359419398	/nfs/dbraw/zinc/41/93/98/1359419398.db2.gz	RPDXBCKACJXPMI-MGHWNKPDSA-N	0	3	343.496	3.089	20	30		EGEDHN
CC1(C(=O)N2C[C@H]3[C@H](C2)[C@@H]2CC[C@H]3CN2CC#Cc2ccccc2)CC1	ZINC001087360489	1359433602	/nfs/dbraw/zinc/43/36/02/1359433602.db2.gz	MIADDHRDLYCLOU-WOZUAGRISA-N	0	3	348.490	3.007	20	30		EGEDHN
C=CCCN1CC[C@H](c2cccc(F)c2)[C@H](NC(=O)c2ccc[nH]2)C1	ZINC001087452544	1359473262	/nfs/dbraw/zinc/47/32/62/1359473262.db2.gz	YUIGMCAHWVAEJJ-IEBWSBKVSA-N	0	3	341.430	3.318	20	30		EGEDHN
C=CCCN1CC[C@H](c2ccc(F)cc2)[C@H](NC(=O)c2cc[nH]c2)C1	ZINC001087464990	1359479601	/nfs/dbraw/zinc/47/96/01/1359479601.db2.gz	POCOIVUXTKWGFE-RTBURBONSA-N	0	3	341.430	3.318	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2c(C)nn(C(C)(C)C)c2C)[C@H]1CC	ZINC001087593130	1359546671	/nfs/dbraw/zinc/54/66/71/1359546671.db2.gz	PZBCUNOOCKVBGY-JKSUJKDBSA-N	0	3	332.492	3.024	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cnc3ccsc3c2)[C@H]1CC	ZINC001087684864	1359588265	/nfs/dbraw/zinc/58/82/65/1359588265.db2.gz	SPNFYDMRHWQORZ-GOEBONIOSA-N	0	3	329.469	3.455	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cccc3c2OCCCO3)[C@H]1CC	ZINC001087773729	1359637009	/nfs/dbraw/zinc/63/70/09/1359637009.db2.gz	DDRFKDZTCSDCRD-DLBZAZTESA-N	0	3	344.455	3.007	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)C(C)(C)c2cccc(OC)c2)[C@H]1CC	ZINC001087785314	1359642938	/nfs/dbraw/zinc/64/29/38/1359642938.db2.gz	BRKFIPHZLKUANQ-ZWKOTPCHSA-N	0	3	330.472	3.128	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2sc(C(C)(C)C)nc2C)[C@H]1CC	ZINC001087849472	1359680427	/nfs/dbraw/zinc/68/04/27/1359680427.db2.gz	BKCQVOCWKKWCCA-LSDHHAIUSA-N	0	3	347.528	3.355	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CCN(Cc4ccccc4F)C[C@H]3C2)C1	ZINC001088097898	1359754749	/nfs/dbraw/zinc/75/47/49/1359754749.db2.gz	NLLGYLKSOZBUJN-AEFFLSMTSA-N	0	3	342.458	3.462	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)[C@H](F)CC3CCCCC3)C[C@@H]2C1	ZINC001088171546	1359779823	/nfs/dbraw/zinc/77/98/23/1359779823.db2.gz	UXGYLTCYSMYLJD-CEXWTWQISA-N	0	3	334.479	3.099	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)[C@H](CC)c3ccc(F)cc3)C[C@@H]2C1	ZINC001088215679	1359799104	/nfs/dbraw/zinc/79/91/04/1359799104.db2.gz	VWFYOJIPEXOLBH-WSTZPKSXSA-N	0	3	342.458	3.123	20	30		EGEDHN
C=CCN1CC[C@H](OCC2CCN(C(=O)c3sccc3C)CC2)C1	ZINC001088225585	1359803635	/nfs/dbraw/zinc/80/36/35/1359803635.db2.gz	QWNMXOSJVHJUDS-KRWDZBQOSA-N	0	3	348.512	3.186	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCCCN(C(=O)C=C(C)C)C1	ZINC001088253636	1359818680	/nfs/dbraw/zinc/81/86/80/1359818680.db2.gz	WDOVHVMYTVVWIT-CQSZACIVSA-N	0	3	329.282	3.222	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](CNCc2csc(C)n2)[C@H](C)C1	ZINC001184232789	1387417999	/nfs/dbraw/zinc/41/79/99/1387417999.db2.gz	XRUSVSTZWDMNQQ-NVXWUHKLSA-N	0	3	347.528	3.219	20	30		EGEDHN
C=C1CCC(C(=O)N2CCCCC[C@H](NCc3ccnn3C)C2)CC1	ZINC001088374140	1359855359	/nfs/dbraw/zinc/85/53/59/1359855359.db2.gz	ZDFHNLPPFCZBEI-SFHVURJKSA-N	0	3	344.503	3.027	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1CCCCC[C@H](NCC(=C)Cl)C1	ZINC001088418513	1359888635	/nfs/dbraw/zinc/88/86/35/1359888635.db2.gz	QRXCABDAQNFILF-IBGZPJMESA-N	0	3	344.886	3.324	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2ccc(N(C)C)cc2)C1	ZINC001088418812	1359889364	/nfs/dbraw/zinc/88/93/64/1359889364.db2.gz	ZPOKHLJDLMPVFP-KRWDZBQOSA-N	0	3	349.906	3.480	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](CNC/C(Cl)=C/Cl)[C@H](C)C1	ZINC001184311591	1387426971	/nfs/dbraw/zinc/42/69/71/1387426971.db2.gz	KDJWRDZDDQAHIQ-OFGWCQOXSA-N	0	3	331.287	3.183	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@H](CNC/C(Cl)=C/Cl)[C@H](C)C1	ZINC001184358423	1387439634	/nfs/dbraw/zinc/43/96/34/1387439634.db2.gz	WKEXIFFGZLYUFA-XPWVWULPSA-N	0	3	331.287	3.039	20	30		EGEDHN
CC(C)C(=O)N[C@H]1CCN(CC#Cc2ccccc2)CC(C)(C)C1	ZINC001089320638	1360339422	/nfs/dbraw/zinc/33/94/22/1360339422.db2.gz	LKHKHCDDTPGRBD-IBGZPJMESA-N	0	3	326.484	3.301	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cccc(OCCC)c2)CC(C)(C)C1	ZINC001089399116	1360399206	/nfs/dbraw/zinc/39/92/06/1360399206.db2.gz	VKYWLGIYHSEPJM-SFHVURJKSA-N	0	3	342.483	3.329	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc3ccccc3nc2C)CC(C)(C)C1	ZINC001089399453	1360399383	/nfs/dbraw/zinc/39/93/83/1360399383.db2.gz	ZADFVXYWKQINGA-SFHVURJKSA-N	0	3	349.478	3.397	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2cccc(C)c2Cl)CC(C)(C)C1	ZINC001089438524	1360429186	/nfs/dbraw/zinc/42/91/86/1360429186.db2.gz	JHMHHLQOZUUWBC-KRWDZBQOSA-N	0	3	346.902	3.431	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2nc3ccccc3cc2C)CC(C)(C)C1	ZINC001089441338	1360431381	/nfs/dbraw/zinc/43/13/81/1360431381.db2.gz	XUVQILDPCWYIKR-SFHVURJKSA-N	0	3	349.478	3.397	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2c(C)cc(F)cc2C)CC(C)(C)C1	ZINC001089459047	1360445256	/nfs/dbraw/zinc/44/52/56/1360445256.db2.gz	REGCIHKEQDCKNG-QGZVFWFLSA-N	0	3	330.447	3.296	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc3ncccc3c2)CC(C)(C)C1	ZINC001089479019	1360461157	/nfs/dbraw/zinc/46/11/57/1360461157.db2.gz	CDBBOHAHFNZCLM-GOSISDBHSA-N	0	3	335.451	3.088	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2cccc(Cl)c2)CC(C)(C)C1	ZINC001089480036	1360462273	/nfs/dbraw/zinc/46/22/73/1360462273.db2.gz	MYKRXIZGZBHNRF-QGZVFWFLSA-N	0	3	332.875	3.123	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(C(C)C)cn2)CC(C)(C)C1	ZINC001089492627	1360470044	/nfs/dbraw/zinc/47/00/44/1360470044.db2.gz	LSHLTLFQUJMSRN-QGZVFWFLSA-N	0	3	327.472	3.059	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cccc(F)c2Cl)CC(C)(C)C1	ZINC001089501182	1360475164	/nfs/dbraw/zinc/47/51/64/1360475164.db2.gz	BSOAIUSBHQFAJG-ZDUSSCGKSA-N	0	3	336.838	3.333	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@H]2CCc3ccccc3C2)CC(C)(C)C1	ZINC001089501796	1360475651	/nfs/dbraw/zinc/47/56/51/1360475651.db2.gz	HDSGPFWLHSDJFK-PMACEKPBSA-N	0	3	338.495	3.032	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@H]2CCc3ccccc3C2)CC(C)(C)C1	ZINC001089501798	1360475716	/nfs/dbraw/zinc/47/57/16/1360475716.db2.gz	HDSGPFWLHSDJFK-VQTJNVASSA-N	0	3	338.495	3.032	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@@H]2Cc3ccc(Cl)cc32)CC(C)(C)C1	ZINC001089553574	1360504883	/nfs/dbraw/zinc/50/48/83/1360504883.db2.gz	WQBZRZJEPYKRRV-FUHWJXTLSA-N	0	3	344.886	3.220	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@@H](C)c2cccc(OC)c2)CC(C)(C)C1	ZINC001089567133	1360513628	/nfs/dbraw/zinc/51/36/28/1360513628.db2.gz	WKWWQKHTSZTWRZ-WMZOPIPTSA-N	0	3	342.483	3.039	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cncc(Cl)c1C	ZINC001089652475	1360565246	/nfs/dbraw/zinc/56/52/46/1360565246.db2.gz	FJVRIMWHKMCVHG-HNNXBMFYSA-N	0	3	347.890	3.287	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1[nH]nc2ccc(C)cc21	ZINC001089663823	1360573925	/nfs/dbraw/zinc/57/39/25/1360573925.db2.gz	WAMPAANFODWHRI-HNNXBMFYSA-N	0	3	340.471	3.278	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1c[nH]nc1CCC	ZINC001089664098	1360574563	/nfs/dbraw/zinc/57/45/63/1360574563.db2.gz	ZNQNGMVDGLEHBV-HNNXBMFYSA-N	0	3	332.492	3.159	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cccc(C(C)C)n1	ZINC001089666001	1360575633	/nfs/dbraw/zinc/57/56/33/1360575633.db2.gz	JDDZMWKRVYVTMS-KRWDZBQOSA-N	0	3	341.499	3.449	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ccn2ccnc2c1	ZINC001089668364	1360577995	/nfs/dbraw/zinc/57/79/95/1360577995.db2.gz	VQBYZSCPWRURSE-KRWDZBQOSA-N	0	3	340.471	3.131	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H]1Cc2ccccc2O1	ZINC001089668548	1360578619	/nfs/dbraw/zinc/57/86/19/1360578619.db2.gz	XUFYMYUSPSYETJ-MJGOQNOKSA-N	0	3	342.483	3.173	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(C2CC2)on1	ZINC001089676847	1360584847	/nfs/dbraw/zinc/58/48/47/1360584847.db2.gz	QJJGQQCASNNEQE-OAHLLOKOSA-N	0	3	331.460	3.349	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cccc2n[nH]cc21	ZINC001089678267	1360586612	/nfs/dbraw/zinc/58/66/12/1360586612.db2.gz	NZILUJBZUZBUJU-OAHLLOKOSA-N	0	3	340.471	3.359	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1occc1CN(C)C	ZINC001089687075	1360593190	/nfs/dbraw/zinc/59/31/90/1360593190.db2.gz	DWLFVHWNHPWCSD-KRWDZBQOSA-N	0	3	347.503	3.138	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ncsc1C1CC1	ZINC001089694681	1360600048	/nfs/dbraw/zinc/60/00/48/1360600048.db2.gz	XGQIGYDDFNXWCR-OAHLLOKOSA-N	0	3	345.512	3.264	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cccc(OC)c1C	ZINC001089703659	1360606627	/nfs/dbraw/zinc/60/66/27/1360606627.db2.gz	NNJUSRSXUSNPJH-MRXNPFEDSA-N	0	3	330.472	3.410	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccn(C(C)C)n1	ZINC001089706362	1360608940	/nfs/dbraw/zinc/60/89/40/1360608940.db2.gz	RLZUFHYWJYSMQQ-MRXNPFEDSA-N	0	3	332.492	3.261	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cnn2ccccc12	ZINC001089711547	1360614871	/nfs/dbraw/zinc/61/48/71/1360614871.db2.gz	XGDQSYUFUKVSNH-MRXNPFEDSA-N	0	3	340.471	3.131	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1coc(CC2CC2)n1	ZINC001089718190	1360620041	/nfs/dbraw/zinc/62/00/41/1360620041.db2.gz	LYUWFBABAHSKIT-INIZCTEOSA-N	0	3	345.487	3.424	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1coc(CC2CC2)n1	ZINC001089718191	1360620429	/nfs/dbraw/zinc/62/04/29/1360620429.db2.gz	LYUWFBABAHSKIT-MRXNPFEDSA-N	0	3	345.487	3.424	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1c(C)[nH]nc1C(C)C	ZINC001089720952	1360623262	/nfs/dbraw/zinc/62/32/62/1360623262.db2.gz	AINFVOBXRGEQOY-OAHLLOKOSA-N	0	3	332.492	3.248	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1c(C)n[nH]c1C(C)C	ZINC001089720952	1360623265	/nfs/dbraw/zinc/62/32/65/1360623265.db2.gz	AINFVOBXRGEQOY-OAHLLOKOSA-N	0	3	332.492	3.248	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)/C=C(\C)C1CC1	ZINC001089775683	1360658910	/nfs/dbraw/zinc/65/89/10/1360658910.db2.gz	AALJEXFUVQBFPG-DBEHSVCCSA-N	0	3	334.891	3.264	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C(F)=C(C)C	ZINC001089789843	1360664406	/nfs/dbraw/zinc/66/44/06/1360664406.db2.gz	OSWXMPYAHKPYAY-YJNKXOJESA-N	0	3	326.843	3.171	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](CNCc2ccn(CC)n2)[C@H](C)C1	ZINC001184473848	1387468340	/nfs/dbraw/zinc/46/83/40/1387468340.db2.gz	RXCRATOYNJSELP-SJORKVTESA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2c(C)coc2C)CC2(CCOCC2)C1	ZINC001089939627	1360755066	/nfs/dbraw/zinc/75/50/66/1360755066.db2.gz	VLMBNSMRZAYNLH-KRWDZBQOSA-N	0	3	346.471	3.073	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](CNCc2csc(C)n2)[C@@H](C)C1	ZINC001184512413	1387480156	/nfs/dbraw/zinc/48/01/56/1387480156.db2.gz	LQLYDEJXYPIACB-GOEBONIOSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccc(C(C)(C)CC)cc2)[C@@H](O)C1	ZINC001090346879	1360893778	/nfs/dbraw/zinc/89/37/78/1360893778.db2.gz	HXMWSTNJBFDQTJ-OALUTQOASA-N	0	3	344.499	3.115	20	30		EGEDHN
N#Cc1ccc(CNC2CC(CNC(=O)C3CCCCC3)C2)c(F)c1	ZINC001090905545	1360950743	/nfs/dbraw/zinc/95/07/43/1360950743.db2.gz	APNADLCXBIYAMD-UHFFFAOYSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2c(F)ccc3ccncc32)C1	ZINC001091039677	1360984572	/nfs/dbraw/zinc/98/45/72/1360984572.db2.gz	GTRNYYPUAZPWPG-UHFFFAOYSA-N	0	3	347.821	3.224	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccoc2C(F)(F)F)C1	ZINC001091049384	1360986330	/nfs/dbraw/zinc/98/63/30/1360986330.db2.gz	WZOLSQRJOWKXTG-UHFFFAOYSA-N	0	3	336.741	3.149	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc3cc(C)cn3c2)C1	ZINC001091063566	1360988265	/nfs/dbraw/zinc/98/82/65/1360988265.db2.gz	NMJWTWYNPAYCGQ-UHFFFAOYSA-N	0	3	331.847	3.098	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc(C)n([C@H](C)CC)n2)C1	ZINC001091110028	1360993715	/nfs/dbraw/zinc/99/37/15/1360993715.db2.gz	JZROEBALWZFHKP-LRVUVFPRSA-N	0	3	338.883	3.013	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc3c(c2)C(C)(C)CO3)C1	ZINC001091139158	1360997199	/nfs/dbraw/zinc/99/71/99/1360997199.db2.gz	ZLAACQZBIXTGFF-UHFFFAOYSA-N	0	3	348.874	3.207	20	30		EGEDHN
CCC(C)(C)C(=O)N1C[C@H]2CN(Cc3ccc(C#N)cc3)C[C@@]2(C)C1	ZINC001091964007	1361261197	/nfs/dbraw/zinc/26/11/97/1361261197.db2.gz	NICZWTPRGYRHOC-NQIIRXRSSA-N	0	3	339.483	3.275	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CN(Cc3oc(C)nc3C)C[C@@]2(C)C1	ZINC001091980995	1361265569	/nfs/dbraw/zinc/26/55/69/1361265569.db2.gz	IWQBSTACUNEBNO-UXPWSPDFSA-N	0	3	345.487	3.174	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C3[C@H]4CCCCCC[C@H]34)C[C@]2(C)C1	ZINC001092045569	1361281415	/nfs/dbraw/zinc/28/14/15/1361281415.db2.gz	OJVASGWLBUHWLZ-WKRCXCSHSA-N	0	3	328.500	3.006	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cccc(C(F)F)c3)C[C@]2(C)C1	ZINC001092213987	1361325083	/nfs/dbraw/zinc/32/50/83/1361325083.db2.gz	AZPQWEXONKMJEX-APWZRJJASA-N	0	3	332.394	3.041	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)Cc3cccc4ccccc43)C[C@]2(C)C1	ZINC001092220783	1361328991	/nfs/dbraw/zinc/32/89/91/1361328991.db2.gz	NQGIPHPHZZYSFM-OFNKIYASSA-N	0	3	346.474	3.186	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C	ZINC001092947804	1361493781	/nfs/dbraw/zinc/49/37/81/1361493781.db2.gz	ZLZIMODCEPHDIS-CWJKEVGVSA-N	0	3	338.495	3.158	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)c2ccc(C#C)cc2)CC1	ZINC001093374881	1361585127	/nfs/dbraw/zinc/58/51/27/1361585127.db2.gz	MYAZQCKLUYMXBJ-NRFANRHFSA-N	0	3	346.474	3.008	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)[C@]2(C)C[C@H]3C[C@H]3C2)CC1	ZINC001093375310	1361585555	/nfs/dbraw/zinc/58/55/55/1361585555.db2.gz	RZDPCCMCANVYNY-RCLSDMTESA-N	0	3	340.511	3.149	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@@H]2Cc3ccccc32)CC1	ZINC001093377090	1361587651	/nfs/dbraw/zinc/58/76/51/1361587651.db2.gz	PXBCGUARFHJUKY-RTWAWAEBSA-N	0	3	348.490	3.053	20	30		EGEDHN
C[C@H]1CN(C(=O)Nc2ccc(C#N)cc2)CCN1C1CCCCC1	ZINC001184749550	1387527724	/nfs/dbraw/zinc/52/77/24/1387527724.db2.gz	LFGYQBDCMKVHFH-HNNXBMFYSA-N	0	3	326.444	3.429	20	30		EGEDHN
C[C@H](C(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1)C(C)(C)C	ZINC001093862117	1361707798	/nfs/dbraw/zinc/70/77/98/1361707798.db2.gz	GJEOCJWDIYLWSZ-GPMSIDNRSA-N	0	3	341.499	3.425	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cc(CC)c(CC)o3)CCC[C@@H]12	ZINC001094559699	1361860172	/nfs/dbraw/zinc/86/01/72/1361860172.db2.gz	DQIPYMSNTOMOIA-UYAOXDASSA-N	0	3	328.456	3.012	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cc4c(cccc4C)o3)CCC[C@@H]12	ZINC001094586789	1361871880	/nfs/dbraw/zinc/87/18/80/1361871880.db2.gz	TYQDCSYIWYKBDW-TZIWHRDSSA-N	0	3	336.435	3.349	20	30		EGEDHN
Cc1cccc(C)c1CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc(C#N)c[nH]1)C2	ZINC001095281939	1362082103	/nfs/dbraw/zinc/08/21/03/1362082103.db2.gz	KFLPZVSHHNUFNQ-KPFFTGBYSA-N	0	3	348.450	3.039	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc(C)c(C)cc1Cl)C2	ZINC001095866569	1362259764	/nfs/dbraw/zinc/25/97/64/1362259764.db2.gz	GVMUEBGXCRSXMF-JLSDUUJJSA-N	0	3	330.859	3.315	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C(C)(C)c1ccc(Cl)cc1)C2	ZINC001095957861	1362307475	/nfs/dbraw/zinc/30/74/75/1362307475.db2.gz	HWZMHSDEYNKUPB-SQNIBIBYSA-N	0	3	344.886	3.362	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc3cc(F)ccc3o1)C2	ZINC001096092470	1362379126	/nfs/dbraw/zinc/37/91/26/1362379126.db2.gz	IORUBWQOZNENKQ-PMPSAXMXSA-N	0	3	328.387	3.483	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@]1(c3ccccc3)CC1(C)C)C2	ZINC001096226027	1362441719	/nfs/dbraw/zinc/44/17/19/1362441719.db2.gz	UEHTYFUEPLADLK-GHDARCQNSA-N	0	3	336.479	3.099	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cccc(C(F)(F)F)c1)C2	ZINC001096410177	1362495769	/nfs/dbraw/zinc/49/57/69/1362495769.db2.gz	MCQUTHAHMXUTPJ-PMPSAXMXSA-N	0	3	336.357	3.064	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1ccc3ccccc3c1)C2	ZINC001096512383	1362544714	/nfs/dbraw/zinc/54/47/14/1362544714.db2.gz	IYDGLQYVHMLPBP-HKBOAZHASA-N	0	3	332.447	3.127	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](C)c1ccc(F)cc1F)C2	ZINC001096577971	1362585753	/nfs/dbraw/zinc/58/57/53/1362585753.db2.gz	IRWQPJDWVLWSDQ-NMVRNDPTSA-N	0	3	334.410	3.366	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C1([C@H]3CCCCO3)CCC1)C2	ZINC001097521649	1363037357	/nfs/dbraw/zinc/03/73/57/1363037357.db2.gz	ASCNAJVLSBGYKF-ZJPYXAASSA-N	0	3	332.488	3.023	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](C)c1cc3ccccc3o1)C2	ZINC001098180823	1363246370	/nfs/dbraw/zinc/24/63/70/1363246370.db2.gz	OMZVBJSVLYKGJX-DDBAPUKQSA-N	0	3	336.435	3.281	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc3nc(C)ccc3o1)C2	ZINC001098255362	1363273116	/nfs/dbraw/zinc/27/31/16/1363273116.db2.gz	IAUVFYDBQOXAOB-FMKPAKJESA-N	0	3	325.412	3.047	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)C[C@@H](NC(=O)C1CC1)c1ccccc1O2	ZINC001098542117	1363364176	/nfs/dbraw/zinc/36/41/76/1363364176.db2.gz	VZVNBIVXRXPFJV-YLJYHZDGSA-N	0	3	326.440	3.057	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1CCCC1(C)C)C[C@H](C)O2	ZINC001098627110	1363405995	/nfs/dbraw/zinc/40/59/95/1363405995.db2.gz	JHRYERFWZSTFDZ-DLBZAZTESA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H](C)c1ccsc1)C[C@@H](C)O2	ZINC001098635226	1363409264	/nfs/dbraw/zinc/40/92/64/1363409264.db2.gz	FJAGJIHIQOPYIC-HZPDHXFCSA-N	0	3	348.512	3.120	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1cc(C)c(CC)o1)C[C@@H](C)O2	ZINC001098653955	1363419790	/nfs/dbraw/zinc/41/97/90/1363419790.db2.gz	RXATXSRYFAICJU-MRXNPFEDSA-N	0	3	346.471	3.032	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1CC[C@H](CC)CC1)C[C@H](C)O2	ZINC001098657140	1363422040	/nfs/dbraw/zinc/42/20/40/1363422040.db2.gz	XLDCTIWLOOVFEC-FHWLQOOXSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc3ccccc3nc2C)C1	ZINC001098858797	1363494965	/nfs/dbraw/zinc/49/49/65/1363494965.db2.gz	HZDWTUKHQHSCPZ-UWJYYQICSA-N	0	3	335.451	3.314	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CCC[C@]3(NC(=O)C3CC4(CC4)C3)C2)c1	ZINC001099022063	1363579868	/nfs/dbraw/zinc/57/98/68/1363579868.db2.gz	BMJQRXCDUDGOHQ-UGKGYDQZSA-N	0	3	349.478	3.219	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc[nH]c1CC	ZINC001099042722	1363589418	/nfs/dbraw/zinc/58/94/18/1363589418.db2.gz	AIJXIJYYHJCTOW-INIZCTEOSA-N	0	3	347.503	3.000	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H]2C[C@H]2c2ccccc2F)C1	ZINC001099072628	1363607983	/nfs/dbraw/zinc/60/79/83/1363607983.db2.gz	VMDAKZCVQNWCLW-REGYPHIPSA-N	0	3	328.431	3.086	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2sc(CC)nc2C)C1	ZINC001099075453	1363610657	/nfs/dbraw/zinc/61/06/57/1363610657.db2.gz	MZKIZIQQNFUVOB-KSSFIOAISA-N	0	3	333.501	3.174	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc3nc(C)ccc3c2)C1	ZINC001099089883	1363616996	/nfs/dbraw/zinc/61/69/96/1363616996.db2.gz	SFMYFGUXBCOOPG-UGKGYDQZSA-N	0	3	347.462	3.151	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)C(C)(C)C(C)C	ZINC001099092330	1363617829	/nfs/dbraw/zinc/61/78/29/1363617829.db2.gz	COHSNMUIHIFMBM-QGZVFWFLSA-N	0	3	338.536	3.478	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H](C)c2ccc(F)c(F)c2)C1	ZINC001099171732	1363669258	/nfs/dbraw/zinc/66/92/58/1363669258.db2.gz	OCEHWEZBUXQYGO-IIMJZQEZSA-N	0	3	346.421	3.062	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)COc1ccc(F)cc1	ZINC001099335235	1363756923	/nfs/dbraw/zinc/75/69/23/1363756923.db2.gz	SSXIQAVANFJAGI-QGZVFWFLSA-N	0	3	348.462	3.387	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2ccc(F)cc2F)C[C@H]1C(F)(F)F	ZINC001099336203	1363757570	/nfs/dbraw/zinc/75/75/70/1363757570.db2.gz	LLVBCBGMZMSKEM-TZMCWYRMSA-N	0	3	348.315	3.133	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)/C=C\C(C)(C)C)CC2(CCOCC2)C1	ZINC001099572236	1363857058	/nfs/dbraw/zinc/85/70/58/1363857058.db2.gz	SMOJLXCXHZPRAU-TUYSUELWSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C2(CC(C)C)CC2)CC2(CCOCC2)C1	ZINC001099582883	1363864377	/nfs/dbraw/zinc/86/43/77/1363864377.db2.gz	DQBRTIFXLCKXAB-GOSISDBHSA-N	0	3	348.531	3.376	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1CN(CC(=C)C)CC2(CCOCC2)C1	ZINC001099587122	1363868452	/nfs/dbraw/zinc/86/84/52/1363868452.db2.gz	QHFLIGXZVGENHQ-LJQANCHMSA-N	0	3	346.515	3.134	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CC(C)=C(C)C)CC2(CCOCC2)C1	ZINC001099589139	1363871524	/nfs/dbraw/zinc/87/15/24/1363871524.db2.gz	QRCQXBNIMZXXAD-GOSISDBHSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2CN(CC(=C)C)CC3(CCOCC3)C2)CC1	ZINC001099590432	1363872255	/nfs/dbraw/zinc/87/22/55/1363872255.db2.gz	AJMFJPDAUOPPNB-SFHVURJKSA-N	0	3	346.515	3.296	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)C[C@H](C)CC(C)C)CC2(CCOCC2)C1	ZINC001099597015	1363880453	/nfs/dbraw/zinc/88/04/53/1363880453.db2.gz	QLVYQBGTMJKETE-MSOLQXFVSA-N	0	3	336.520	3.232	20	30		EGEDHN
CC(C)(C)/C=C/C(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100192963	1364040625	/nfs/dbraw/zinc/04/06/25/1364040625.db2.gz	QYWDWMHPZZRBOR-ZHACJKMWSA-N	0	3	342.458	3.264	20	30		EGEDHN
CC[C@@H](NC1CC(CNC(=O)C#CC2CC2)C1)c1ccc(F)cc1F	ZINC001100315120	1364077786	/nfs/dbraw/zinc/07/77/86/1364077786.db2.gz	UORPXSQNBPRYEI-GSQSYGFSSA-N	0	3	346.421	3.314	20	30		EGEDHN
C#CCC1(C(=O)NCC2CC(NCc3cc(F)ccc3F)C2)CCC1	ZINC001100396899	1364101888	/nfs/dbraw/zinc/10/18/88/1364101888.db2.gz	ZIQQSDCOIOBOST-UHFFFAOYSA-N	0	3	346.421	3.143	20	30		EGEDHN
C[C@@H](C(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1)C(C)(C)C	ZINC001100448029	1364118806	/nfs/dbraw/zinc/11/88/06/1364118806.db2.gz	FPVSFXGOJFJXKR-DMKPSLHHSA-N	0	3	344.474	3.344	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C[C@H](C)c2c(C)noc2C)C1	ZINC001100458297	1364121093	/nfs/dbraw/zinc/12/10/93/1364121093.db2.gz	VWCOCPMHNFPFMN-ISAOAKOHSA-N	0	3	339.867	3.022	20	30		EGEDHN
C=C/C(C)=C/CC(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100583713	1364174707	/nfs/dbraw/zinc/17/47/07/1364174707.db2.gz	ZZWDPFKOMGZBCO-OMCISZLKSA-N	0	3	340.442	3.184	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCC1CC(NCc2cccc(OCC)n2)C1	ZINC001100595912	1364181146	/nfs/dbraw/zinc/18/11/46/1364181146.db2.gz	IQIHDWXLYBRHDT-HJOIGYKYSA-N	0	3	345.487	3.067	20	30		EGEDHN
CCCCC1(C(=O)NCC2CC(NCC#Cc3ccccc3)C2)CC1	ZINC001100642789	1364201198	/nfs/dbraw/zinc/20/11/98/1364201198.db2.gz	OIKAZACKULSLEA-UHFFFAOYSA-N	0	3	338.495	3.493	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC2CC(NCC#Cc3ccc(F)cc3)C2)C1	ZINC001100661491	1364208244	/nfs/dbraw/zinc/20/82/44/1364208244.db2.gz	XAPBXMPHKUBVDL-UHFFFAOYSA-N	0	3	340.442	3.018	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC2CC(NCc3ccc(F)cc3F)C2)C1	ZINC001100661536	1364208726	/nfs/dbraw/zinc/20/87/26/1364208726.db2.gz	ZKOKRWADEFJOPO-UHFFFAOYSA-N	0	3	334.410	3.306	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC1CC(NCc2c(C)noc2CC)C1	ZINC001100711500	1364230895	/nfs/dbraw/zinc/23/08/95/1364230895.db2.gz	SIDOBAYIGOEAGM-UHFFFAOYSA-N	0	3	333.476	3.132	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H](C)Cc2cccs2)C1	ZINC001100716747	1364233392	/nfs/dbraw/zinc/23/33/92/1364233392.db2.gz	OSKAAEHLDVSUTC-XGNXJENSSA-N	0	3	326.893	3.164	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)C[C@@H](C)C(C)(C)C)C1	ZINC001100915972	1364330044	/nfs/dbraw/zinc/33/00/44/1364330044.db2.gz	OQLRNPFUTDEERZ-LMWSTFAQSA-N	0	3	345.325	3.452	20	30		EGEDHN
C=C[C@H](C(=O)NCC1CC(NCc2ccns2)C1)c1ccccc1	ZINC001101016853	1364375179	/nfs/dbraw/zinc/37/51/79/1364375179.db2.gz	JAGORBVMDADRDC-PVARCSIZSA-N	0	3	341.480	3.097	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H](C)Cc2ccc(C)cc2)C1	ZINC001101047887	1364391301	/nfs/dbraw/zinc/39/13/01/1364391301.db2.gz	PWAFPCQEUIXGRO-NNGSBXSVSA-N	0	3	334.891	3.411	20	30		EGEDHN
C=C(C)CN1CC[C@H](Oc2ccnc(CNC(=O)[C@H](C)CCC)c2)C1	ZINC001101092793	1364409540	/nfs/dbraw/zinc/40/95/40/1364409540.db2.gz	XTIWTAPOOWPLAF-APWZRJJASA-N	0	3	345.487	3.163	20	30		EGEDHN
C=CCN1CC[C@H](Oc2ccnc(CNC(=O)CC(C)=C(C)C)c2)C1	ZINC001101095955	1364411438	/nfs/dbraw/zinc/41/14/38/1364411438.db2.gz	UWDQAFHGILFBRO-IBGZPJMESA-N	0	3	343.471	3.083	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@H]2CN(Cc3ccc(F)cc3)C[C@@]2(C)C1	ZINC001101203518	1364461669	/nfs/dbraw/zinc/46/16/69/1364461669.db2.gz	ZKKGCDCWMRDSDJ-NQIIRXRSSA-N	0	3	342.458	3.300	20	30		EGEDHN
CC[C@@H](C)CC(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@@]2(C)C1	ZINC001101215033	1364466559	/nfs/dbraw/zinc/46/65/59/1364466559.db2.gz	GLIPKFLWWJIRLS-BSIFCXSSSA-N	0	3	339.483	3.275	20	30		EGEDHN
C#CCCCC(=O)N1C[C@H]2CN(Cc3ccc(Cl)cc3)C[C@@]2(C)C1	ZINC001101216461	1364467278	/nfs/dbraw/zinc/46/72/78/1364467278.db2.gz	DMTONKCDJHDQIX-XLIONFOSSA-N	0	3	344.886	3.424	20	30		EGEDHN
COCC#CCN1C[C@@H]2CN(C(=O)CCCCCC(C)C)C[C@]2(C)C1	ZINC001101384928	1364539760	/nfs/dbraw/zinc/53/97/60/1364539760.db2.gz	YJPRYGPPGUVHIK-CTNGQTDRSA-N	0	3	348.531	3.023	20	30		EGEDHN
C#CCCCC(=O)N1CCC(C(C)(C)CNCc2cscn2)CC1	ZINC001101534261	1364603752	/nfs/dbraw/zinc/60/37/52/1364603752.db2.gz	CRNICMHEQCWFAE-UHFFFAOYSA-N	0	3	347.528	3.301	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1CC2(CN(CCC(C)C)C2)n2ccnc21	ZINC001101635547	1364663840	/nfs/dbraw/zinc/66/38/40/1364663840.db2.gz	LXAHBBMCAVAKBK-INIZCTEOSA-N	0	3	344.503	3.103	20	30		EGEDHN
CC(C)CCC(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001101710115	1364699555	/nfs/dbraw/zinc/69/95/55/1364699555.db2.gz	UFLJADXEGNMWIL-HUUCEWRRSA-N	0	3	333.501	3.240	20	30		EGEDHN
CC/C=C(\C)C(=O)NC[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1C	ZINC001101777803	1364722975	/nfs/dbraw/zinc/72/29/75/1364722975.db2.gz	OTYGTWHWMDAPBJ-ISXDEVHMSA-N	0	3	343.446	3.238	20	30		EGEDHN
CC/C=C(/C)C(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001101777963	1364723229	/nfs/dbraw/zinc/72/32/29/1364723229.db2.gz	VMGVIYCQIAWXEL-RZAHBXAWSA-N	0	3	331.485	3.160	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1CNC(=O)CCC1CCC1	ZINC001101860735	1364753846	/nfs/dbraw/zinc/75/38/46/1364753846.db2.gz	QLXJDTPWVMUFRS-WIYYLYMNSA-N	0	3	338.495	3.303	20	30		EGEDHN
C=CCCOCCCCC(=O)NC[C@@H]1CN(C/C=C\Cl)C[C@H]1C	ZINC001101969140	1364793377	/nfs/dbraw/zinc/79/33/77/1364793377.db2.gz	HZMBLPBXOHWCDF-KIUVSXKZSA-N	0	3	342.911	3.186	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@@H]1CN([C@@H](C)c2cnc(C)cn2)C[C@H]1C	ZINC001102006714	1364809175	/nfs/dbraw/zinc/80/91/75/1364809175.db2.gz	PUOQSQHLNWMPEV-HYVNUMGLSA-N	0	3	344.503	3.132	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1CNC(=O)C1(F)CCCC1	ZINC001102112867	1364864661	/nfs/dbraw/zinc/86/46/61/1364864661.db2.gz	KMRSANKBPYABCN-IEBWSBKVSA-N	0	3	342.458	3.005	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@@H]1CN(Cc2c(C)noc2CC)C[C@H]1C	ZINC001102261476	1364973780	/nfs/dbraw/zinc/97/37/80/1364973780.db2.gz	ZTSOGEHVLSUUSJ-BFYDXBDKSA-N	0	3	347.503	3.332	20	30		EGEDHN
CCC1(C(=O)NC[C@@H]2CN(Cc3ccc(F)c(C#N)c3)C[C@H]2C)CC1	ZINC001102331721	1365005966	/nfs/dbraw/zinc/00/59/66/1365005966.db2.gz	PKVAZOHAAGGYLT-RHSMWYFYSA-N	0	3	343.446	3.072	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)NC[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1C	ZINC001102423048	1365047474	/nfs/dbraw/zinc/04/74/74/1365047474.db2.gz	KUCPUFNDEWNAFC-ZHALLVOQSA-N	0	3	344.474	3.153	20	30		EGEDHN
C=C[C@H](C(=O)NC[C@@H]1CN(C/C=C/Cl)C[C@H]1C)c1ccccc1	ZINC001102592022	1365128497	/nfs/dbraw/zinc/12/84/97/1365128497.db2.gz	JENAJJZKUUSMBB-WYUXJBACSA-N	0	3	332.875	3.393	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2cccc(Cl)c2)C[C@H]1CCNC(=O)C1CC1	ZINC001102630860	1365143066	/nfs/dbraw/zinc/14/30/66/1365143066.db2.gz	BAOJPPHTRLIFPF-CRAIPNDOSA-N	0	3	344.886	3.176	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)cc2F)C[C@H]1CCNC(=O)C(C)(C)F	ZINC001102634841	1365146620	/nfs/dbraw/zinc/14/66/20/1365146620.db2.gz	HEWKIICBZKJJAV-UKRRQHHQSA-N	0	3	349.425	3.020	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](NCc3cnn(C(C)(C)C)c3)C2)CCC1	ZINC001185469380	1387723262	/nfs/dbraw/zinc/72/32/62/1387723262.db2.gz	UOHSWRSKNXGUFQ-QGZVFWFLSA-N	0	3	344.503	3.075	20	30		EGEDHN
C=CCCC(=O)NCC[C@@H]1CN(Cc2cc(C3CC3)no2)C[C@H]1C	ZINC001102762628	1365207360	/nfs/dbraw/zinc/20/73/60/1365207360.db2.gz	IUQBFJSQMHFULR-GDBMZVCRSA-N	0	3	331.460	3.092	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)COCC2CCCC2)C1	ZINC001103097521	1365378109	/nfs/dbraw/zinc/37/81/09/1365378109.db2.gz	PEZUVXFCXVLKND-RHSMWYFYSA-N	0	3	342.911	3.020	20	30		EGEDHN
C=CCCCC(=O)NCC[C@@H]1CN([C@@H](C)c2ncc(C)o2)C[C@H]1C	ZINC001103382567	1365526806	/nfs/dbraw/zinc/52/68/06/1365526806.db2.gz	MSUUMXQHHWXCPA-HYVNUMGLSA-N	0	3	333.476	3.475	20	30		EGEDHN
C=CCCCC(=O)NCC[C@@H]1CN(Cc2cccc(OC)n2)C[C@H]1C	ZINC001103385108	1365528415	/nfs/dbraw/zinc/52/84/15/1365528415.db2.gz	DCYRJXHZBQZFCQ-IAGOWNOFSA-N	0	3	345.487	3.021	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)C(=O)NCC[C@@H]1CN(CCF)C[C@H]1C	ZINC001103744882	1365760501	/nfs/dbraw/zinc/76/05/01/1365760501.db2.gz	XNYHVDBXKDNLST-YZGWKJHDSA-N	0	3	346.490	3.465	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)[C@@H](C)OCCC(C)C)C1	ZINC001103770803	1365775236	/nfs/dbraw/zinc/77/52/36/1365775236.db2.gz	OXUUGMYMTZXSBQ-DJIMGWMZSA-N	0	3	344.927	3.264	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2CCC2)C[C@H]1CCNCc1ccccc1C#N	ZINC001104036936	1365884442	/nfs/dbraw/zinc/88/44/42/1365884442.db2.gz	JESBOBOYTHSGSU-OXQOHEQNSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cc(C)cc(C)n2)C[C@H]1C	ZINC001104373388	1365993152	/nfs/dbraw/zinc/99/31/52/1365993152.db2.gz	MJDKMQAHKQILIR-CZUORRHYSA-N	0	3	335.879	3.139	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cncc(CC)c2)C[C@H]1C	ZINC001104421096	1366017574	/nfs/dbraw/zinc/01/75/74/1366017574.db2.gz	BLZZGXDFEIFKQD-CZUORRHYSA-N	0	3	335.879	3.084	20	30		EGEDHN
CC[C@H](F)C(=O)N1C[C@@H](C)[C@H](CCNCc2ccc(C#N)cc2F)C1	ZINC001104500429	1366051098	/nfs/dbraw/zinc/05/10/98/1366051098.db2.gz	QBMGPERPTKXWJY-XYPHTWIQSA-N	0	3	349.425	3.020	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)[C@H](CCC)OCC)C[C@H]1C	ZINC001104559129	1366074787	/nfs/dbraw/zinc/07/47/87/1366074787.db2.gz	LQRMSWVVDQBAMN-BMFZPTHFSA-N	0	3	330.900	3.018	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cc[nH]c2C2CC2)C[C@H]1C	ZINC001104593543	1366093554	/nfs/dbraw/zinc/09/35/54/1366093554.db2.gz	CVLIVVWARKUJPQ-IUODEOHRSA-N	0	3	335.879	3.332	20	30		EGEDHN
CCC1(C(=O)N2C[C@@H](C)[C@H](CCNCc3ccccc3C#N)C2)CC1	ZINC001104635936	1366113261	/nfs/dbraw/zinc/11/32/61/1366113261.db2.gz	JSGFPOMQRYUPAO-VQIMIIECSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)[C@@H]2C[C@H]2CC(C)C)C[C@H]1C	ZINC001104700231	1366136145	/nfs/dbraw/zinc/13/61/45/1366136145.db2.gz	YOXBOVVWBAEPEV-MWQQHZPXSA-N	0	3	326.912	3.495	20	30		EGEDHN
COc1ccc(CN[C@@H]2CCN(C(=O)CCCC(C)C)C2)cc1C#N	ZINC001185834002	1387810124	/nfs/dbraw/zinc/81/01/24/1387810124.db2.gz	OZDHSTOAXACVKO-GOSISDBHSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(c2ccccc2)C[C@H](NC(=O)CC2CC2)C1	ZINC001105400703	1366447891	/nfs/dbraw/zinc/44/78/91/1366447891.db2.gz	DKLXTJCJUSNUKA-IZAXUBKRSA-N	0	3	332.875	3.345	20	30		EGEDHN
CC(=O)N1CCCC[C@H]1C1(CNCc2cc(F)ccc2C#N)CCC1	ZINC001105491606	1366491090	/nfs/dbraw/zinc/49/10/90/1366491090.db2.gz	MFYRDIVKWVDRIG-IBGZPJMESA-N	0	3	343.446	3.358	20	30		EGEDHN
O=C(/C=C\C1CC1)NC[C@]12CCC[C@H]1N(CC#Cc1ccccc1)CC2	ZINC001107351906	1366938011	/nfs/dbraw/zinc/93/80/11/1366938011.db2.gz	ASCBWWDCSSFARK-BBIBPOGFSA-N	0	3	348.490	3.365	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)[C@@H](C)CC3CCCCC3)[C@@H]2C1	ZINC001189317546	1366986910	/nfs/dbraw/zinc/98/69/10/1366986910.db2.gz	PYKGQPWHCSWITO-YSIASYRMSA-N	0	3	348.531	3.328	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCc1ccc(Cl)cc1	ZINC001109208990	1367003949	/nfs/dbraw/zinc/00/39/49/1367003949.db2.gz	JEUCPBIMWOHHOA-QYZOEREBSA-N	0	3	344.886	3.408	20	30		EGEDHN
CC#CCCCC(=O)NC[C@]12CCC[C@H]1N(Cc1conc1C)CC2	ZINC001107513281	1367012495	/nfs/dbraw/zinc/01/24/95/1367012495.db2.gz	XYCAKKZJFAZFQN-UYAOXDASSA-N	0	3	343.471	3.037	20	30		EGEDHN
C=CCCCC(=O)NC[C@]12CCC[C@H]1N(Cc1cnc(C)o1)CC2	ZINC001107524376	1367018622	/nfs/dbraw/zinc/01/86/22/1367018622.db2.gz	WUZLWOINRPOFPY-IEBWSBKVSA-N	0	3	331.460	3.200	20	30		EGEDHN
C[C@H](c1ccc2c(c1)CCC2)N1[C@@H]2CC[C@H]1[C@@H](NC(=O)C#CC1CC1)C2	ZINC001109257730	1367029040	/nfs/dbraw/zinc/02/90/40/1367029040.db2.gz	KRBQRQACBRCIBK-JAPHVTHTSA-N	0	3	348.490	3.371	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)COc1cccc(C(C)C)c1)C2	ZINC001109320713	1367051600	/nfs/dbraw/zinc/05/16/00/1367051600.db2.gz	IXGFDEUUEAJMBV-HOJAQTOUSA-N	0	3	342.483	3.486	20	30		EGEDHN
CC[C@@H](CC(C)C)C(=O)NC[C@]12CCC[C@H]1N(CC#CCOC)CC2	ZINC001107601050	1367065948	/nfs/dbraw/zinc/06/59/48/1367065948.db2.gz	KOKGAJIDOVKIQT-QKNQBKEWSA-N	0	3	348.531	3.069	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](N(C)CCOc2ccc(C)cc2)C1	ZINC001189751917	1367102449	/nfs/dbraw/zinc/10/24/49/1367102449.db2.gz	KKWTUDKCXCEQQR-LJQANCHMSA-N	0	3	342.483	3.100	20	30		EGEDHN
CN(CCN1CCCC1)C(=O)c1cc(F)c(Cl)c(C#N)c1Cl	ZINC001189838135	1367117576	/nfs/dbraw/zinc/11/75/76/1367117576.db2.gz	BGBGFSVCCPYOKE-UHFFFAOYSA-N	0	3	344.217	3.172	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](N(C)Cc2ccc(OC)c(Cl)c2)C1	ZINC001189909961	1367129220	/nfs/dbraw/zinc/12/92/20/1367129220.db2.gz	JXVVTLSZMDJCMN-INIZCTEOSA-N	0	3	348.874	3.185	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](N(C)CCc2scnc2C)C1	ZINC001190354660	1367236511	/nfs/dbraw/zinc/23/65/11/1367236511.db2.gz	NFIIDUWZEDCPQY-KRWDZBQOSA-N	0	3	347.528	3.295	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)C23CCC(CC2)C3)C1	ZINC001108030147	1367249880	/nfs/dbraw/zinc/24/98/80/1367249880.db2.gz	BBGQZTVWCOFSQJ-BXXUTWAOSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CC1CC(F)(F)C1	ZINC001109677041	1367276788	/nfs/dbraw/zinc/27/67/88/1367276788.db2.gz	GMKWJBIZQOIJQI-AESZEHBQSA-N	0	3	326.431	3.356	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)C(C)(C)C2CCC2)C1	ZINC001108101237	1367282483	/nfs/dbraw/zinc/28/24/83/1367282483.db2.gz	IWOMYMBVRWNTRM-UZLBHIALSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](C)Cc1ccccc1F)C2	ZINC001109718422	1367291908	/nfs/dbraw/zinc/29/19/08/1367291908.db2.gz	HBLITCVNPGAPJL-FXECBMLZSA-N	0	3	330.447	3.302	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C1[C@@H]3CCCCCC[C@@H]13)C2	ZINC001109759004	1367304946	/nfs/dbraw/zinc/30/49/46/1367304946.db2.gz	JJLBFTHWHVNGRV-QQXKLLMISA-N	0	3	346.515	3.127	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2cc[nH]c2CCC)C1	ZINC001108154932	1367314327	/nfs/dbraw/zinc/31/43/27/1367314327.db2.gz	KGELVYKDNTVPMW-UZLBHIALSA-N	0	3	347.503	3.143	20	30		EGEDHN
CCCCCCCCNC(=O)Nc1cnccc1N1CCN(C)CC1	ZINC001191053052	1367412763	/nfs/dbraw/zinc/41/27/63/1367412763.db2.gz	ZCMMELBOTXTRGJ-UHFFFAOYSA-N	0	3	347.507	3.315	20	30		EGEDHN
CCCCCCCNC(=O)N1C[C@@H]2CN(Cc3cccnc3)C[C@H]2C1	ZINC001191091888	1367422160	/nfs/dbraw/zinc/42/21/60/1367422160.db2.gz	VVDAYXUXLXIOFT-OALUTQOASA-N	0	3	344.503	3.125	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)CC(C2CC2)C2CC2)C1	ZINC001108422146	1367446881	/nfs/dbraw/zinc/44/68/81/1367446881.db2.gz	IXSJBWLAXXZDBU-IERDGZPVSA-N	0	3	348.531	3.375	20	30		EGEDHN
C=C[C@H](CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCOCC)c1ccccc1	ZINC001110134983	1367518006	/nfs/dbraw/zinc/51/80/06/1367518006.db2.gz	GUXJJTHDXUNGAU-LMCOJAPRSA-N	0	3	342.483	3.104	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](N(C)Cc2cccc(OC)c2C)C1	ZINC001191867796	1367620073	/nfs/dbraw/zinc/62/00/73/1367620073.db2.gz	ITDNEPVGJZAAMD-IBGZPJMESA-N	0	3	342.483	3.230	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@@H](N(C)CCOCc2ccccc2)C1	ZINC001191890550	1367627190	/nfs/dbraw/zinc/62/71/90/1367627190.db2.gz	RPUQHYQVBZBHEI-AZUAARDMSA-N	0	3	344.499	3.338	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@@H](N(C)CCOc2ccccc2F)C1	ZINC001191889747	1367627642	/nfs/dbraw/zinc/62/76/42/1367627642.db2.gz	JRZHOLKQGTXOHQ-DLBZAZTESA-N	0	3	348.462	3.340	20	30		EGEDHN
CCCC(C)(C)C(=O)N1CC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001192082121	1367682742	/nfs/dbraw/zinc/68/27/42/1367682742.db2.gz	CINFCOWMCJHXLZ-SFHVURJKSA-N	0	3	327.472	3.417	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)[C@H](c2ccccc2)C(C)C)C1	ZINC001192560640	1367816918	/nfs/dbraw/zinc/81/69/18/1367816918.db2.gz	RRECQFMVFITLDT-PMACEKPBSA-N	0	3	344.499	3.162	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)[C@@H](C)CC2CCCCC2)C1	ZINC001192641579	1367840410	/nfs/dbraw/zinc/84/04/10/1367840410.db2.gz	LNHHEFPPJXRPTO-PKOBYXMFSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCCCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1c(F)cncc1F)C2	ZINC001110603517	1367864890	/nfs/dbraw/zinc/86/48/90/1367864890.db2.gz	HQTYUGPKRWFGIA-XYPHTWIQSA-N	0	3	349.425	3.441	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCOc1ccc(C)c(C)c1)C2	ZINC001110627698	1367874497	/nfs/dbraw/zinc/87/44/97/1367874497.db2.gz	NQHRYHBUMAXUQQ-RLLQIKCJSA-N	0	3	342.483	3.370	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)COC/C=C/c1ccccc1)C2	ZINC001110709835	1367941714	/nfs/dbraw/zinc/94/17/14/1367941714.db2.gz	OAEVMSZQHUYILI-CUTNJZCYSA-N	0	3	340.467	3.014	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)COC/C=C\c1ccccc1)C2	ZINC001110709836	1367941891	/nfs/dbraw/zinc/94/18/91/1367941891.db2.gz	OAEVMSZQHUYILI-DTNCNXICSA-N	0	3	340.467	3.014	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)[C@@H](F)CC2CCCCC2)C1	ZINC001193468835	1368037988	/nfs/dbraw/zinc/03/79/88/1368037988.db2.gz	IUYKVDAHFRFZKY-ROUUACIJSA-N	0	3	340.483	3.030	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)CCCC2CCCCC2)C1	ZINC001193874656	1368136506	/nfs/dbraw/zinc/13/65/06/1368136506.db2.gz	YMCCXPKMDYWFHJ-LJQANCHMSA-N	0	3	336.520	3.472	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@@H](C)c1cccc(F)c1)C2	ZINC001111010175	1368141846	/nfs/dbraw/zinc/14/18/46/1368141846.db2.gz	XENNWHRFZZGVMH-AXUOBQJMSA-N	0	3	328.431	3.064	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)[C@H](CC=C)c2ccccc2)C1	ZINC001194174365	1368198590	/nfs/dbraw/zinc/19/85/90/1368198590.db2.gz	RWPHVIFXGLEZSN-WOJBJXKFSA-N	0	3	342.483	3.082	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cnc(C3CC3)s1)C2	ZINC001111302974	1368260606	/nfs/dbraw/zinc/26/06/06/1368260606.db2.gz	MHEMRWWEYHRPCH-KFWWJZLASA-N	0	3	331.485	3.322	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2ccc(CC)c(CC)c2)C1	ZINC001194598432	1368294259	/nfs/dbraw/zinc/29/42/59/1368294259.db2.gz	XGBNDPAQFGUEGU-FQEVSTJZSA-N	0	3	344.499	3.160	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)C2(CC(C)C)CCC2)C1	ZINC001194605177	1368294807	/nfs/dbraw/zinc/29/48/07/1368294807.db2.gz	YVOOGOKUBNJDGC-QZTJIDSGSA-N	0	3	336.520	3.111	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)CC(C)(C)CC(F)F)C1	ZINC001194865712	1368338088	/nfs/dbraw/zinc/33/80/88/1368338088.db2.gz	PONJUVRGOSEKEN-HUUCEWRRSA-N	0	3	348.478	3.190	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1(CC(C)C)CC1)C[C@@H](C)O2	ZINC001111545599	1368338574	/nfs/dbraw/zinc/33/85/74/1368338574.db2.gz	KYFKOTDOSMZHIW-QGZVFWFLSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1(CCC)CCC1)C[C@@H](C)O2	ZINC001111547192	1368339614	/nfs/dbraw/zinc/33/96/14/1368339614.db2.gz	KDVIMNHQIZRZDZ-QGZVFWFLSA-N	0	3	334.504	3.225	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)CCc2cccc(C)c2)C1	ZINC001195081094	1368373964	/nfs/dbraw/zinc/37/39/64/1368373964.db2.gz	NFNJYJYPAQDCAO-WOJBJXKFSA-N	0	3	346.515	3.059	20	30		EGEDHN
C#CCCCC(=O)N1CCCN(CCc2ccc(Cl)cc2)CC1	ZINC001195675270	1368469996	/nfs/dbraw/zinc/46/99/96/1368469996.db2.gz	VLEUJKUZGLHSNT-UHFFFAOYSA-N	0	3	332.875	3.220	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H](C)OCc2cccc(C)c2)C1	ZINC001111824095	1368483354	/nfs/dbraw/zinc/48/33/54/1368483354.db2.gz	UWSJDJIGHJWPPB-CUWPLCDZSA-N	0	3	342.483	3.057	20	30		EGEDHN
C=CCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1cccnc1C)C2	ZINC001111859207	1368509667	/nfs/dbraw/zinc/50/96/67/1368509667.db2.gz	UNMVRRFYOGGDHJ-ICSRJNTNSA-N	0	3	327.472	3.217	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2c(F)cncc2F)CC1	ZINC001195982392	1368528687	/nfs/dbraw/zinc/52/86/87/1368528687.db2.gz	ULAYFJDSHDYCQF-UHFFFAOYSA-N	0	3	339.430	3.478	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)C[C@H](C)c2ccccc2F)C1	ZINC001111903970	1368547749	/nfs/dbraw/zinc/54/77/49/1368547749.db2.gz	ZVIZDNSZWYFYBX-FIKGOQFSSA-N	0	3	342.458	3.313	20	30		EGEDHN
C#CCC1(C(=O)N2CCCN(CCCc3ccsc3)CC2)CCC1	ZINC001196139283	1368556271	/nfs/dbraw/zinc/55/62/71/1368556271.db2.gz	WBNWRQAIZFHZOR-UHFFFAOYSA-N	0	3	344.524	3.409	20	30		EGEDHN
C=C(C)CCN1C[C@@H](O)[C@H](NC(=O)C[C@@H](CC)c2ccc(C)cc2)C1	ZINC001196177013	1368563464	/nfs/dbraw/zinc/56/34/64/1368563464.db2.gz	QAGNKWARFYPLAJ-MISYRCLQSA-N	0	3	344.499	3.006	20	30		EGEDHN
C=CCC[C@@H](C)N1CCCN(C(=O)c2nc(Cl)cs2)CC1	ZINC001196908972	1368712018	/nfs/dbraw/zinc/71/20/18/1368712018.db2.gz	AJRFPRMNMNRWFT-GFCCVEGCSA-N	0	3	327.881	3.299	20	30		EGEDHN
C=CCCCC(=O)N1CCCN(CCCOCc2ccccc2)CC1	ZINC001197000197	1368729088	/nfs/dbraw/zinc/72/90/88/1368729088.db2.gz	LNLTVYWXCZTYDP-UHFFFAOYSA-N	0	3	344.499	3.484	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N1CCCN(CCCCCF)CC1	ZINC001197396797	1368805603	/nfs/dbraw/zinc/80/56/03/1368805603.db2.gz	OYKQGCXBZUDSGO-ROUUACIJSA-N	0	3	340.483	3.032	20	30		EGEDHN
C=CCOc1cccnc1C(=O)N1CCCN(CC/C=C\CC)CC1	ZINC001197768469	1368892709	/nfs/dbraw/zinc/89/27/09/1368892709.db2.gz	NZEYKVHZLDNTKW-WAYWQWQTSA-N	0	3	343.471	3.151	20	30		EGEDHN
CCCCCCCCCCC(=O)N[C@@H]1CN(CC[C@@H](C)F)C[C@H]1O	ZINC001198068543	1368953459	/nfs/dbraw/zinc/95/34/59/1368953459.db2.gz	HFEMOBSMMZUFGZ-KZNAEPCWSA-N	0	3	344.515	3.427	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)C2(C3CCCCC3)CC2)C1	ZINC001198134712	1368965586	/nfs/dbraw/zinc/96/55/86/1368965586.db2.gz	ZYDTYSOVVTVQDD-RTBURBONSA-N	0	3	348.531	3.255	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)c1ccccn1)c1ccccc1OC	ZINC001198491645	1369043919	/nfs/dbraw/zinc/04/39/19/1369043919.db2.gz	KJZQNUFQMJXRJR-GOSISDBHSA-N	0	3	339.439	3.117	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)c1ccncc1)c1ccccc1OC	ZINC001198493214	1369045106	/nfs/dbraw/zinc/04/51/06/1369045106.db2.gz	YRDBTMWLVCQZRM-SFHVURJKSA-N	0	3	339.439	3.117	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)CCc1ccco1)c1ccccc1OC	ZINC001198521949	1369051403	/nfs/dbraw/zinc/05/14/03/1369051403.db2.gz	FZZMKCIVSGRXBP-GOSISDBHSA-N	0	3	342.439	3.244	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)[C@H](CC)OCC)c1ccccc1OC	ZINC001198584130	1369066437	/nfs/dbraw/zinc/06/64/37/1369066437.db2.gz	BGZQNAHDDVBYPO-MSOLQXFVSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCOCC(=O)NC[C@@H](NCCCC(C)C)c1ccccc1OC	ZINC001198606548	1369071891	/nfs/dbraw/zinc/07/18/91/1369071891.db2.gz	UCAQZZRKDAUPJJ-GOSISDBHSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@@H](C)CSC)c1ccccc1OC	ZINC001198618278	1369074772	/nfs/dbraw/zinc/07/47/72/1369074772.db2.gz	XQQYXQCDPOLEGX-GOEBONIOSA-N	0	3	336.501	3.017	20	30		EGEDHN
COc1ccccc1[C@H](CNC(=O)[C@H](C)C#N)NCCC1CCCC1	ZINC001198618101	1369074796	/nfs/dbraw/zinc/07/47/96/1369074796.db2.gz	WPLLHRJHWKJVDY-QAPCUYQASA-N	0	3	343.471	3.182	20	30		EGEDHN
C#CCCCCC(=O)NC[C@H](NCCC1CC1)c1ccccc1OC	ZINC001198676955	1369088681	/nfs/dbraw/zinc/08/86/81/1369088681.db2.gz	FRVARBSOZKAMBN-IBGZPJMESA-N	0	3	342.483	3.436	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)COC(C)(C)C)c1ccccc1OC	ZINC001198676915	1369089067	/nfs/dbraw/zinc/08/90/67/1369089067.db2.gz	DQQMNLQVNVIEMU-KRWDZBQOSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)/C=C/c1ccc[nH]1)c1ccccc1OC	ZINC001198686148	1369091365	/nfs/dbraw/zinc/09/13/65/1369091365.db2.gz	LEUBYKRUYMNLMQ-IENJSVCTSA-N	0	3	339.439	3.060	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)C#CC(C)(C)C)c1ccccc1OC	ZINC001198724030	1369100525	/nfs/dbraw/zinc/10/05/25/1369100525.db2.gz	OQHRPWKWDDRQHW-KRWDZBQOSA-N	0	3	328.456	3.068	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)c1ccns1)c1ccccc1OC	ZINC001198750744	1369104641	/nfs/dbraw/zinc/10/46/41/1369104641.db2.gz	AVCOCISZEQTAHF-OAHLLOKOSA-N	0	3	345.468	3.179	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)c1cocc1C)c1ccccc1OC	ZINC001198842271	1369127546	/nfs/dbraw/zinc/12/75/46/1369127546.db2.gz	GLBJAVRFEQXGIU-KRWDZBQOSA-N	0	3	328.412	3.233	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)C(C)(C)C1CC1)c1ccccc1OC	ZINC001198857247	1369131378	/nfs/dbraw/zinc/13/13/78/1369131378.db2.gz	NUORAPSUFCJCEB-QGZVFWFLSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)[C@H](OC)C(C)C)c1ccccc1OC	ZINC001198876293	1369137320	/nfs/dbraw/zinc/13/73/20/1369137320.db2.gz	QHQDZVUYODVTSV-PKOBYXMFSA-N	0	3	348.487	3.079	20	30		EGEDHN
CCC(CC)CC(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001186622517	1387988022	/nfs/dbraw/zinc/98/80/22/1387988022.db2.gz	NITOXFKOCPUXDI-QGZVFWFLSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=CCC[C@@H](C(=O)N[C@@H]1CN(CCCCC)C[C@H]1O)c1ccccc1	ZINC001199567521	1369238365	/nfs/dbraw/zinc/23/83/65/1369238365.db2.gz	RYUFRLNCAFOXHJ-VAMGGRTRSA-N	0	3	344.499	3.088	20	30		EGEDHN
C=CCCC(=O)N1CCC(N[C@@H](C)c2nc3ccccc3o2)CC1	ZINC001199725897	1369262108	/nfs/dbraw/zinc/26/21/08/1369262108.db2.gz	FVMJSWUAGOIHLK-AWEZNQCLSA-N	0	3	327.428	3.436	20	30		EGEDHN
C=CCCC(=O)N1CCC(N[C@H](C)c2nc3ccccc3o2)CC1	ZINC001199725898	1369262121	/nfs/dbraw/zinc/26/21/21/1369262121.db2.gz	FVMJSWUAGOIHLK-CQSZACIVSA-N	0	3	327.428	3.436	20	30		EGEDHN
C=C(Br)CNC1CCN(C(=O)/C=C/C(C)(C)C)CC1	ZINC001199848040	1369280750	/nfs/dbraw/zinc/28/07/50/1369280750.db2.gz	SVHKRWVKXJYRJR-VMPITWQZSA-N	0	3	329.282	3.078	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC(N[C@@H](C)c2c(F)cccc2F)CC1	ZINC001200414439	1369362775	/nfs/dbraw/zinc/36/27/75/1369362775.db2.gz	HGZKIVRLRUGWHD-AWEZNQCLSA-N	0	3	334.410	3.266	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCCO[C@@H](CNCc2cccc(F)c2)C1	ZINC001200605177	1369399181	/nfs/dbraw/zinc/39/91/81/1369399181.db2.gz	DNEZBRSGBDREGW-SFHVURJKSA-N	0	3	348.462	3.135	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)c2cccc3c2ccn3C)CC1	ZINC001113434473	1369424894	/nfs/dbraw/zinc/42/48/94/1369424894.db2.gz	JXGVXHUGXAEONX-MRXNPFEDSA-N	0	3	325.456	3.291	20	30		EGEDHN
CC#CCNC[C@H]1CN(C(=O)C2CC(C)(C)CC(C)(C)C2)CCCO1	ZINC001201089757	1369478811	/nfs/dbraw/zinc/47/88/11/1369478811.db2.gz	RUEQDCWOPZPACB-SFHVURJKSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=CCC1(C(=O)N2CCN(CC3CCCCCC3)CC2)CCOCC1	ZINC001113593608	1369505598	/nfs/dbraw/zinc/50/55/98/1369505598.db2.gz	LJDSBTYLPFZKTL-UHFFFAOYSA-N	0	3	348.531	3.474	20	30		EGEDHN
CC#CCNC[C@@H]1CN(C(=O)[C@@H](CC)CC2CCCCC2)CCCO1	ZINC001201547095	1369571726	/nfs/dbraw/zinc/57/17/26/1369571726.db2.gz	PPHIKFSIOHJSSX-VQTJNVASSA-N	0	3	348.531	3.213	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2cccnc2)[C@@H]2OCCC[C@@H]21	ZINC001201762731	1369619070	/nfs/dbraw/zinc/61/90/70/1369619070.db2.gz	SBFURGDPIRWGIQ-QYZOEREBSA-N	0	3	345.487	3.014	20	30		EGEDHN
CCCCCCCCCCS(=O)(=O)N1CC[C@]2(CCN(C)C2)C1	ZINC001201836782	1369631713	/nfs/dbraw/zinc/63/17/13/1369631713.db2.gz	PPPDWSIJKJROQD-SFHVURJKSA-N	0	3	344.565	3.485	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N1CCC(NC/C(Cl)=C/Cl)CC1	ZINC001201845794	1369633077	/nfs/dbraw/zinc/63/30/77/1369633077.db2.gz	OEYBPTRCFIVNTC-DVFVSVACSA-N	0	3	349.302	3.115	20	30		EGEDHN
C=CCCCCC[N@H+]1C[C@@H]2CCN(C(=O)c3ccccc3[O-])[C@@H]2C1	ZINC001186867345	1388017954	/nfs/dbraw/zinc/01/79/54/1388017954.db2.gz	VUIROGRCALQQLD-FUHWJXTLSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=CCCCCC[N@@H+]1C[C@@H]2CCN(C(=O)c3ccccc3[O-])[C@@H]2C1	ZINC001186867345	1388017958	/nfs/dbraw/zinc/01/79/58/1388017958.db2.gz	VUIROGRCALQQLD-FUHWJXTLSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001202053410	1369677074	/nfs/dbraw/zinc/67/70/74/1369677074.db2.gz	CIORXZJMSQSHJA-TVPGTPATSA-N	0	3	341.430	3.300	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)N1CCC(NCc2ccncc2Cl)CC1	ZINC001202092786	1369686682	/nfs/dbraw/zinc/68/66/82/1369686682.db2.gz	RHHOCOSVJANOAZ-KGLIPLIRSA-N	0	3	335.879	3.274	20	30		EGEDHN
CC(C)CC(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C12CCC2	ZINC001202340110	1369743236	/nfs/dbraw/zinc/74/32/36/1369743236.db2.gz	JTGONYRKYHQSCN-ROUUACIJSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC(NCc3ncc(C)s3)CC2)CC1	ZINC001202365776	1369751669	/nfs/dbraw/zinc/75/16/69/1369751669.db2.gz	UZZFVTSQUVHHRH-UHFFFAOYSA-N	0	3	333.501	3.279	20	30		EGEDHN
CC[C@H](CC(C)C)C(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C1	ZINC001186894789	1388023505	/nfs/dbraw/zinc/02/35/05/1388023505.db2.gz	DLXUHPFJHXTDNK-HUUCEWRRSA-N	0	3	333.501	3.383	20	30		EGEDHN
CC(C)=CC(=O)N[C@@H]1C[C@@H](NCc2ccc(C#N)cc2F)C12CCC2	ZINC001202385060	1369757553	/nfs/dbraw/zinc/75/75/53/1369757553.db2.gz	WYUJUGJYCKBFHY-QZTJIDSGSA-N	0	3	341.430	3.181	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)CCCCC)C12CCC2	ZINC001202470227	1369781229	/nfs/dbraw/zinc/78/12/29/1369781229.db2.gz	PGCMYHLELAKANJ-UONOGXRCSA-N	0	3	343.309	3.492	20	30		EGEDHN
CCC(CC)C(=O)N[C@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202522944	1369799050	/nfs/dbraw/zinc/79/90/50/1369799050.db2.gz	RLAXPCPVYKCKAV-PMACEKPBSA-N	0	3	338.495	3.491	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@H](NCc2cc(F)ccc2F)C12CCC2	ZINC001202592503	1369816758	/nfs/dbraw/zinc/81/67/58/1369816758.db2.gz	UDPJFXYGYGSVDS-IRXDYDNUSA-N	0	3	334.410	3.448	20	30		EGEDHN
O=C(N[C@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2)C1CC=CC1	ZINC001202644334	1369836357	/nfs/dbraw/zinc/83/63/57/1369836357.db2.gz	UTWZDFLERLONRX-PMACEKPBSA-N	0	3	334.463	3.021	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC(N[C@@H](C)c2cnc(C)cn2)CC1	ZINC001202694027	1369853966	/nfs/dbraw/zinc/85/39/66/1369853966.db2.gz	IPUPCWHBQWIYOX-HNNXBMFYSA-N	0	3	330.476	3.029	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1C[C@@H](NCc2conc2C)C12CCC2	ZINC001202959895	1369937183	/nfs/dbraw/zinc/93/71/83/1369937183.db2.gz	IAVWKQBBGIIZRT-CVEARBPZSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1C[C@H](NCc2cnc(C)o2)C12CCC2	ZINC001202967794	1369939399	/nfs/dbraw/zinc/93/93/99/1369939399.db2.gz	GSTHEZOTGAJHLU-HOTGVXAUSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C(Br)CNC1CCN(C(=O)CC(CC)CC)CC1	ZINC001203085313	1369977224	/nfs/dbraw/zinc/97/72/24/1369977224.db2.gz	HNVKMQCIQDHPHR-UHFFFAOYSA-N	0	3	331.298	3.302	20	30		EGEDHN
CC[C@@H](C)[C@H](C)C(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001203091724	1369979686	/nfs/dbraw/zinc/97/96/86/1369979686.db2.gz	FKAXTUNHLMIGRI-CVEARBPZSA-N	0	3	327.472	3.321	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@H](NC(=O)CC2(C)CC2)C12CCC2	ZINC001203204486	1370023988	/nfs/dbraw/zinc/02/39/88/1370023988.db2.gz	VILNPQJBIYGCNR-OLZOCXBDSA-N	0	3	341.293	3.102	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1C[C@@H](NCc2ocnc2C)C12CCC2	ZINC001203258602	1370045756	/nfs/dbraw/zinc/04/57/56/1370045756.db2.gz	SPOWMCNYIHLTMP-CVEARBPZSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1[C@H]2CN(CCOc3ccc(C)cc3)C[C@H]21	ZINC001114780350	1370076410	/nfs/dbraw/zinc/07/64/10/1370076410.db2.gz	HXHAIEFOIGPLGA-PXCRPINLSA-N	0	3	342.483	3.023	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2C[C@@H](NCc3cnc(C)o3)C23CCC3)CC1	ZINC001203374059	1370103487	/nfs/dbraw/zinc/10/34/87/1370103487.db2.gz	JTZFAARGGPUZJD-IAGOWNOFSA-N	0	3	343.471	3.246	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2C[C@H](NCc3cncs3)C23CCC3)CC1	ZINC001203375614	1370104989	/nfs/dbraw/zinc/10/49/89/1370104989.db2.gz	RKACOEMMLJBPIU-JKSUJKDBSA-N	0	3	345.512	3.407	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1[C@H]2CN([C@@H](C)c3cccc(OC)c3)C[C@H]21	ZINC001114897293	1370136606	/nfs/dbraw/zinc/13/66/06/1370136606.db2.gz	XYETVXGHMJGBNB-WQANXHIZSA-N	0	3	342.483	3.405	20	30		EGEDHN
CC(C)(C)C(=O)N[C@H]1C[C@@H](NCC#Cc2ccc(F)cc2)C12CCC2	ZINC001203629662	1370192855	/nfs/dbraw/zinc/19/28/55/1370192855.db2.gz	BKXMZSGSFKYWQW-MSOLQXFVSA-N	0	3	342.458	3.240	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)COc2ccccc2C)C12CCC2	ZINC001203679252	1370214479	/nfs/dbraw/zinc/21/44/79/1370214479.db2.gz	TXTBDODWGTUIQU-SJORKVTESA-N	0	3	348.874	3.143	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CC2)C(=O)N[C@@H]3c2ccccc2)c1	ZINC001203760239	1370252568	/nfs/dbraw/zinc/25/25/68/1370252568.db2.gz	FXXJHTSQOVSOPO-LJQANCHMSA-N	0	3	331.419	3.012	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(c4cccc(F)c4)C3=O)CC2)c1	ZINC001203760911	1370254037	/nfs/dbraw/zinc/25/40/37/1370254037.db2.gz	SMMXBSLAGQNSQZ-UHFFFAOYSA-N	0	3	349.409	3.326	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(NCc3nccn3C)CC2)CCCCC1	ZINC001203846306	1370288201	/nfs/dbraw/zinc/28/82/01/1370288201.db2.gz	ASLSUYPFVAHZNK-UHFFFAOYSA-N	0	3	344.503	3.027	20	30		EGEDHN
C=CCOc1ccc(CN2CC[C@H]3[C@@H]2CCC(=O)N3CC2CC2)cc1	ZINC001204301092	1370436764	/nfs/dbraw/zinc/43/67/64/1370436764.db2.gz	NBCBQWLWIRAHOK-PMACEKPBSA-N	0	3	340.467	3.227	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NCC1(NCC(=C)Cl)CCCCC1	ZINC001115438194	1370452887	/nfs/dbraw/zinc/45/28/87/1370452887.db2.gz	WJDWIFZJCCAYGC-HNNXBMFYSA-N	0	3	328.884	3.129	20	30		EGEDHN
C#CCCCC(=O)NCC1(NCC(=C)Br)CCCCC1	ZINC001115507235	1370507221	/nfs/dbraw/zinc/50/72/21/1370507221.db2.gz	IDLOWMKTNKVPAF-UHFFFAOYSA-N	0	3	341.293	3.107	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1ccc(F)c(OC)c1)CC2	ZINC001204558671	1370514455	/nfs/dbraw/zinc/51/44/55/1370514455.db2.gz	DWOACACLUBOVRL-FQEVSTJZSA-N	0	3	346.446	3.367	20	30		EGEDHN
O=C(C#CC1CC1)NCC1(NCc2ccncc2Cl)CCCCC1	ZINC001115527514	1370526487	/nfs/dbraw/zinc/52/64/87/1370526487.db2.gz	YLYVAAQCHDHPED-UHFFFAOYSA-N	0	3	345.874	3.057	20	30		EGEDHN
C=C(C)CCC(=O)NCC1(NCc2ccc(F)cn2)CCCCC1	ZINC001115556889	1370555043	/nfs/dbraw/zinc/55/50/43/1370555043.db2.gz	HDHZOXJXTNBKPW-UHFFFAOYSA-N	0	3	333.451	3.486	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H](OC)[C@H](C)CC)CCCCC1	ZINC001115606445	1370605103	/nfs/dbraw/zinc/60/51/03/1370605103.db2.gz	GJIUSUZHULAEMQ-UKRRQHHQSA-N	0	3	330.900	3.209	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2c[nH]nc2C(C)C)CCCCC1	ZINC001115612567	1370611286	/nfs/dbraw/zinc/61/12/86/1370611286.db2.gz	HZJPHQHSSJCCFC-UHFFFAOYSA-N	0	3	338.883	3.308	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NCC1(NCC(=C)Cl)CCCCC1	ZINC001115650308	1370638220	/nfs/dbraw/zinc/63/82/20/1370638220.db2.gz	SUEIZUJDAFMXII-QGZVFWFLSA-N	0	3	342.911	3.376	20	30		EGEDHN
Cc1ncc(C#N)cc1Nc1ccc(C2(N3CCN(C)CC3)CC2)cc1	ZINC001205101996	1370650472	/nfs/dbraw/zinc/65/04/72/1370650472.db2.gz	CAOIBTDKEOFIKF-UHFFFAOYSA-N	0	3	347.466	3.242	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)[C@H](F)C(C)C)CCCCC1	ZINC001115678159	1370660208	/nfs/dbraw/zinc/66/02/08/1370660208.db2.gz	CVTUPAAIURLZGU-CYBMUJFWSA-N	0	3	349.288	3.298	20	30		EGEDHN
N#Cc1cc(Cl)c(-c2noc([C@@H]3CCNC[C@@H]3F)n2)cc1Cl	ZINC001205220618	1370685222	/nfs/dbraw/zinc/68/52/22/1370685222.db2.gz	ZDQHOXMLKCHWIA-PELKAZGASA-N	0	3	341.173	3.330	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)C[C@@H]2C[C@@H]2C)CCCCC1	ZINC001115710286	1370689056	/nfs/dbraw/zinc/68/90/56/1370689056.db2.gz	HLHBXJBMGLVMBP-JSGCOSHPSA-N	0	3	343.309	3.350	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC2(NCc3cnoc3C)CCCCC2)C1	ZINC001115723287	1370701715	/nfs/dbraw/zinc/70/17/15/1370701715.db2.gz	JDJOYTBDTADFNK-UHFFFAOYSA-N	0	3	331.460	3.248	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC2(NCc3conc3C)CCCCC2)C1	ZINC001115723400	1370702453	/nfs/dbraw/zinc/70/24/53/1370702453.db2.gz	OQTRVSXELYMELS-UHFFFAOYSA-N	0	3	331.460	3.248	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)C2(C(F)(F)F)CC2)CCCCC1	ZINC001115744003	1370723903	/nfs/dbraw/zinc/72/39/03/1370723903.db2.gz	JMCISNNGHNIYIO-UHFFFAOYSA-N	0	3	338.801	3.490	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](c2cccc(F)c2)[C@H](NC/C=C\Cl)C1	ZINC001205386479	1370738440	/nfs/dbraw/zinc/73/84/40/1370738440.db2.gz	RQYJWAQMNNUSCS-APDXYKNESA-N	0	3	336.838	3.428	20	30		EGEDHN
CC[C@H](F)CN[C@@H]1CN(C(=O)C#CC(C)C)C[C@H]1c1cccc(F)c1	ZINC001205407879	1370746983	/nfs/dbraw/zinc/74/69/83/1370746983.db2.gz	JGTCWPHMQLVGGG-YTQUADARSA-N	0	3	348.437	3.117	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C[C@@H](C)CC(C)C)C[C@H]1c1cccc(F)c1	ZINC001205449416	1370758962	/nfs/dbraw/zinc/75/89/62/1370758962.db2.gz	UPIPPZDIVDFFSR-FFZOFVMBSA-N	0	3	344.474	3.415	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)C2(CC)CCOCC2)CCCCC1	ZINC001115797038	1370778991	/nfs/dbraw/zinc/77/89/91/1370778991.db2.gz	YZRSXGOCVQQPQZ-UHFFFAOYSA-N	0	3	342.911	3.354	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC(CNCc2nc(C)cs2)CC1	ZINC001205885155	1370899909	/nfs/dbraw/zinc/89/99/09/1370899909.db2.gz	HXXPPLNNMOQMAW-UHFFFAOYSA-N	0	3	347.528	3.363	20	30		EGEDHN
C[C@H](CC(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1)C(C)(C)C	ZINC001187412807	1388103753	/nfs/dbraw/zinc/10/37/53/1388103753.db2.gz	FJKZMUOSPLZULE-RHSMWYFYSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)N1CCC(CNCc2ccn(C(C)C)n2)CC1	ZINC001205955300	1370922293	/nfs/dbraw/zinc/92/22/93/1370922293.db2.gz	OXMFOMICQXABKE-IRXDYDNUSA-N	0	3	346.519	3.250	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)N1CCC(CNCc2cc(C3CC3)no2)CC1	ZINC001205955325	1370922454	/nfs/dbraw/zinc/92/24/54/1370922454.db2.gz	PRUIFWUSEXYBTQ-GJZGRUSLSA-N	0	3	345.487	3.338	20	30		EGEDHN
C=C(CN1CCCC1)c1nc(-c2cc(F)c(F)c(F)c2F)no1	ZINC001206094389	1370959456	/nfs/dbraw/zinc/95/94/56/1370959456.db2.gz	KSDQMVOUZMPTCR-UHFFFAOYSA-N	0	3	327.281	3.402	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CN(CCOc2c(C)cccc2C)C[C@H]1C	ZINC001206503093	1371075988	/nfs/dbraw/zinc/07/59/88/1371075988.db2.gz	UHHVOEVRMJXBBE-QZTJIDSGSA-N	0	3	330.472	3.085	20	30		EGEDHN
C=CCO[C@@H]1CO[C@@]2(C1)CCCN(Cc1ccc(C)cc1OC)C2	ZINC001206762654	1371156999	/nfs/dbraw/zinc/15/69/99/1371156999.db2.gz	OJECNWDTIBUFQJ-AZUAARDMSA-N	0	3	331.456	3.330	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)N[C@@H]1CN(Cc2ccc(C(C)C)cc2)C[C@H]1C	ZINC001206915500	1371224203	/nfs/dbraw/zinc/22/42/03/1371224203.db2.gz	ARZLOOZKRZRNCL-BSIFCXSSSA-N	0	3	344.499	3.074	20	30		EGEDHN
O=C(c1ccc(F)cc1)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001207055602	1371279752	/nfs/dbraw/zinc/27/97/52/1371279752.db2.gz	MQENBJXBXSLEPD-HXUWFJFHSA-N	0	3	336.410	3.072	20	30		EGEDHN
CC/C=C(\C)C(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207566823	1371437403	/nfs/dbraw/zinc/43/74/03/1371437403.db2.gz	VIWRWOADSBDPAK-HIZIYNLSSA-N	0	3	328.431	3.114	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H](NCc2cc(Cl)ccc2OC)C1	ZINC001207656633	1371466848	/nfs/dbraw/zinc/46/68/48/1371466848.db2.gz	KIRHMTFHVFBXML-INIZCTEOSA-N	0	3	336.863	3.395	20	30		EGEDHN
O=C(/C=C\C1CC1)N1CCC[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001207742622	1371491053	/nfs/dbraw/zinc/49/10/53/1371491053.db2.gz	VZIOJUQKVXMJQP-JYBLJSLWSA-N	0	3	342.870	3.238	20	30		EGEDHN
C[C@@]1(C(=O)N2CCC[C@H](NCC#Cc3ccccc3)C2)CC=CCC1	ZINC001208165954	1371614942	/nfs/dbraw/zinc/61/49/42/1371614942.db2.gz	NQUZOYROSQNSFW-RBBKRZOGSA-N	0	3	336.479	3.365	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001208213504	1371654234	/nfs/dbraw/zinc/65/42/34/1371654234.db2.gz	QWDKPFUCIWXRBZ-LJQANCHMSA-N	0	3	344.474	3.440	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN(C[C@H](OC)c2ccccc2)C[C@H]1C	ZINC001208312954	1371712022	/nfs/dbraw/zinc/71/20/22/1371712022.db2.gz	UKARZUSXQIJSPF-NXHRZFHOSA-N	0	3	330.472	3.023	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN(CCOc2cccc(C)c2)C[C@H]1C	ZINC001208318203	1371715163	/nfs/dbraw/zinc/71/51/63/1371715163.db2.gz	OJLBALFPDRBERC-SJLPKXTDSA-N	0	3	330.472	3.023	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1CN(CCOc2ccccc2)C[C@H]1C	ZINC001208321551	1371717228	/nfs/dbraw/zinc/71/72/28/1371717228.db2.gz	YGBJJAROXRHGSN-UYAOXDASSA-N	0	3	342.483	3.086	20	30		EGEDHN
C=C(Br)CNC1CC2(C1)CC(NC(=O)/C(C)=C\CC)C2	ZINC001120746902	1371738734	/nfs/dbraw/zinc/73/87/34/1371738734.db2.gz	GFQOBOSQVCWEQT-WZUFQYTHSA-N	0	3	341.293	3.268	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CN(CC[C@H]2CC2(Cl)Cl)C[C@H]1C	ZINC001208374158	1371741912	/nfs/dbraw/zinc/74/19/12/1371741912.db2.gz	AVCWTMYFARSWJP-QLFBSQMISA-N	0	3	345.314	3.200	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1CN(Cc2ccc3c(c2)COC3)C[C@H]1C	ZINC001208393272	1371751067	/nfs/dbraw/zinc/75/10/67/1371751067.db2.gz	MUWGIQHFXGWNDK-GQIGUUNPSA-N	0	3	342.483	3.256	20	30		EGEDHN
O=C(C[C@@H]1C=CCCC1)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001208403806	1371755743	/nfs/dbraw/zinc/75/57/43/1371755743.db2.gz	MWZJZZJFSFXDPW-NHCUHLMSSA-N	0	3	336.479	3.365	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN(Cc2cccc(OC)c2C)C[C@H]1C	ZINC001208458598	1371774492	/nfs/dbraw/zinc/77/44/92/1371774492.db2.gz	PVTXWHZESJIDDC-CRAIPNDOSA-N	0	3	330.472	3.296	20	30		EGEDHN
C=CCOCc1nn(C)c2c1CN(CCc1ccc(Cl)cc1)CC2	ZINC001208740031	1371880053	/nfs/dbraw/zinc/88/00/53/1371880053.db2.gz	HEXIOFORRSUVFS-UHFFFAOYSA-N	0	3	345.874	3.377	20	30		EGEDHN
COc1ccc(N2CCN(CCCc3cccc(C#N)c3)CC2)cc1	ZINC001208844227	1371915424	/nfs/dbraw/zinc/91/54/24/1371915424.db2.gz	GJACJAPTVUFHPY-UHFFFAOYSA-N	0	3	335.451	3.322	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC[C@@H](NCC=C(Cl)Cl)C1	ZINC001209017011	1371974989	/nfs/dbraw/zinc/97/49/89/1371974989.db2.gz	JSIRSVVXFQVYHO-CQSZACIVSA-N	0	3	331.287	3.470	20	30		EGEDHN
CC[C@H](F)C(=O)N1CCC[C@@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001209015437	1371975034	/nfs/dbraw/zinc/97/50/34/1371975034.db2.gz	BBZUYHADMCRQRI-SJORKVTESA-N	0	3	336.838	3.020	20	30		EGEDHN
C=CCN(CCN1CCC(c2cccc(O)c2)CC1)C(=O)OCC	ZINC001209025081	1371976916	/nfs/dbraw/zinc/97/69/16/1371976916.db2.gz	ZZYVDIUOQYDJLJ-UHFFFAOYSA-N	0	3	332.444	3.216	20	30		EGEDHN
C=CCN(CCN1CCN([C@@H](C)c2ccccc2)CC1)C(=O)OCC	ZINC001209021654	1371976981	/nfs/dbraw/zinc/97/69/81/1371976981.db2.gz	BHIYOJRVTDGDEE-SFHVURJKSA-N	0	3	345.487	3.010	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N1CCC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001209054141	1371984868	/nfs/dbraw/zinc/98/48/68/1371984868.db2.gz	YGVWWGBRVDUSER-WCLIJEPQSA-N	0	3	341.430	3.300	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC1CC2(CC(NCc3cnoc3C)C2)C1	ZINC001121528147	1372000156	/nfs/dbraw/zinc/00/01/56/1372000156.db2.gz	LZKJFLFVKMOJBJ-UHFFFAOYSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC1CC2(CC(NCc3conc3C)C2)C1	ZINC001121616180	1372025819	/nfs/dbraw/zinc/02/58/19/1372025819.db2.gz	CGVKUKCSSXTDIV-HKYFHIHASA-N	0	3	331.460	3.102	20	30		EGEDHN
C=CCCCCN1CCOC2(CCN(C(=O)OC(C)(C)C)CC2)C1	ZINC001209201414	1372036042	/nfs/dbraw/zinc/03/60/42/1372036042.db2.gz	LBPYIHVZQRQNAI-UHFFFAOYSA-N	0	3	338.492	3.445	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC1CC2(CC(NCc3oc(C)nc3C)C2)C1	ZINC001121713540	1372055988	/nfs/dbraw/zinc/05/59/88/1372055988.db2.gz	JNXQNLAAQCFDIE-VYJHHOQDSA-N	0	3	345.487	3.411	20	30		EGEDHN
CCC(C)(C)C(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001209334357	1372070964	/nfs/dbraw/zinc/07/09/64/1372070964.db2.gz	CORPUPZJTBQVLX-GOSISDBHSA-N	0	3	330.447	3.194	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@@H](NCc2cn(C(C)C)nc2C)C1	ZINC001209373853	1372081117	/nfs/dbraw/zinc/08/11/17/1372081117.db2.gz	GLARZQSMZBDGKN-GOSISDBHSA-N	0	3	332.492	3.209	20	30		EGEDHN
C=CCCCCCCCN1C[C@@H](O)[C@@H](NC(=O)OC(C)(C)C)C1	ZINC001209441288	1372107047	/nfs/dbraw/zinc/10/70/47/1372107047.db2.gz	GTOXKAUDISPXKW-JKSUJKDBSA-N	0	3	326.481	3.083	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@@H](NCC#Cc3ccccc3Cl)C2)CC1	ZINC001209473662	1372116104	/nfs/dbraw/zinc/11/61/04/1372116104.db2.gz	BHBXQYVELODFJM-QGZVFWFLSA-N	0	3	344.886	3.462	20	30		EGEDHN
C=CCC1(C(=O)N2CCC[C@@H](NCc3cc(C)ns3)C2)CCC1	ZINC001209504549	1372123633	/nfs/dbraw/zinc/12/36/33/1372123633.db2.gz	SIKHDZQMULIOBQ-OAHLLOKOSA-N	0	3	333.501	3.279	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)NCc1csc(CCc2ccccc2)n1	ZINC001121926391	1372124866	/nfs/dbraw/zinc/12/48/66/1372124866.db2.gz	NEXKJURETCTFQU-KRWDZBQOSA-N	0	3	343.496	3.228	20	30		EGEDHN
Cn1cc(CN2CCC(Oc3ccccc3C#N)CC2)c2cccnc21	ZINC001209751092	1372183962	/nfs/dbraw/zinc/18/39/62/1372183962.db2.gz	ZOCCETAWPWLMBV-UHFFFAOYSA-N	0	3	346.434	3.488	20	30		EGEDHN
CC(C)n1ccc(CC(=O)C(C#N)C(=O)Nc2ccccc2Cl)n1	ZINC001122498141	1372260510	/nfs/dbraw/zinc/26/05/10/1372260510.db2.gz	KRFXWVGJQOJPFZ-CYBMUJFWSA-N	0	3	344.802	3.007	20	30		EGEDHN
N#CC(C(=O)c1ccc2ncccc2c1)c1nc(N)c2ccccc2n1	ZINC001122499238	1372260581	/nfs/dbraw/zinc/26/05/81/1372260581.db2.gz	GAYFCSDEXPTKIB-HNNXBMFYSA-N	0	3	339.358	3.250	20	30		EGEDHN
COc1ccc(Cl)cc1NC(=O)N1CCC2SC(=O)C=C2C1	ZINC001187913654	1388189260	/nfs/dbraw/zinc/18/92/60/1388189260.db2.gz	INAHQXSJLXXCMF-CYBMUJFWSA-N	0	3	338.816	3.155	20	30		EGEDHN
N#CC(C(=O)CC1c2ccccc2Oc2ccccc21)C(=O)NC1CC1	ZINC001122624413	1372286624	/nfs/dbraw/zinc/28/66/24/1372286624.db2.gz	BLKMYVPAOJZMKQ-QGZVFWFLSA-N	0	3	346.386	3.302	20	30		EGEDHN
N#CC(C(=O)c1cccnc1OCC(F)(F)F)c1cccc(F)n1	ZINC001122717544	1372304986	/nfs/dbraw/zinc/30/49/86/1372304986.db2.gz	KCIDYJOJHIXYHM-SNVBAGLBSA-N	0	3	339.248	3.047	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)C[C@H]2CCCC(C)(C)C2)C1	ZINC001210277890	1372313456	/nfs/dbraw/zinc/31/34/56/1372313456.db2.gz	XIENZTMMDGXKRV-KZNAEPCWSA-N	0	3	336.520	3.232	20	30		EGEDHN
CCN1C[C@@H](C)N(c2nnc(C(C)(C)CC#N)n2CC(C)C)C[C@@H]1C	ZINC001122782743	1372319847	/nfs/dbraw/zinc/31/98/47/1372319847.db2.gz	GJPYIRISYKRERW-JKSUJKDBSA-N	0	3	346.523	3.044	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)Cc1cccc(C)c1Br	ZINC001123233106	1372403227	/nfs/dbraw/zinc/40/32/27/1372403227.db2.gz	FZEUPOYEXRNPKF-ZDUSSCGKSA-N	0	3	346.228	3.393	20	30		EGEDHN
CCCCCCCC[C@@H](C)C(=O)N[C@@H]1CN(CCOC)C[C@H]1C	ZINC001211206067	1372501718	/nfs/dbraw/zinc/50/17/18/1372501718.db2.gz	ATLTUKUQSLQOEV-KZNAEPCWSA-N	0	3	326.525	3.456	20	30		EGEDHN
CCCCCCCc1ccc(-c2noc(CN(C)C(=O)CN)n2)cc1	ZINC001211361530	1372540266	/nfs/dbraw/zinc/54/02/66/1372540266.db2.gz	JBGIBGZKSWCKAA-UHFFFAOYSA-N	0	3	344.459	3.167	20	30		EGEDHN
CCCCCCCc1ccc(-c2noc([C@H](C)NC(=O)CN)n2)cc1	ZINC001212020733	1372647983	/nfs/dbraw/zinc/64/79/83/1372647983.db2.gz	WOBCYSZANGOBOY-AWEZNQCLSA-N	0	3	344.459	3.385	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2cscc2C)[C@H](OC)C1	ZINC001212081607	1372654147	/nfs/dbraw/zinc/65/41/47/1372654147.db2.gz	PQFCZTNHTLVQTR-IAGOWNOFSA-N	0	3	336.501	3.232	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2cccc(C)c2F)[C@H](OC)C1	ZINC001212303510	1372684425	/nfs/dbraw/zinc/68/44/25/1372684425.db2.gz	GXSSLADEMIOUDM-QZTJIDSGSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H](NC(=O)c2sccc2Cl)[C@H](OC)C1	ZINC001212303713	1372684451	/nfs/dbraw/zinc/68/44/51/1372684451.db2.gz	LAHBILRMCSULPQ-IACUBPJLSA-N	0	3	342.892	3.185	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)C23CCC(CC2)C3)[C@H](OC)C1	ZINC001212465738	1372710604	/nfs/dbraw/zinc/71/06/04/1372710604.db2.gz	UGOMZQYMFGJZHU-SFANZJOMSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCOCCCC(=O)NCCNCc1cc(C(C)C)ccc1OC	ZINC001125252312	1372763853	/nfs/dbraw/zinc/76/38/53/1372763853.db2.gz	ADBJJEACLABSJM-UHFFFAOYSA-N	0	3	348.487	3.007	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@H](C)CC(F)F)[C@H](OC)C1	ZINC001213190566	1372856788	/nfs/dbraw/zinc/85/67/88/1372856788.db2.gz	ZLJJTFUCPSHZTQ-RBSFLKMASA-N	0	3	334.451	3.064	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@]2(C)C[C@H]3C[C@H]3C2)[C@H](OC)C1	ZINC001213202883	1372859264	/nfs/dbraw/zinc/85/92/64/1372859264.db2.gz	GWVXCLGFVLUXSK-KWXDATOUSA-N	0	3	336.520	3.208	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CN([C@H](CC)c2ccccc2)C[C@H]1OC	ZINC001213295507	1372877377	/nfs/dbraw/zinc/87/73/77/1372877377.db2.gz	YBDMGBLLMXABSK-VAMGGRTRSA-N	0	3	342.483	3.147	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2occc2CC)[C@H](OC)C1	ZINC001213377137	1372895899	/nfs/dbraw/zinc/89/58/99/1372895899.db2.gz	ZSKIRLYFJRLSLP-IAGOWNOFSA-N	0	3	334.460	3.017	20	30		EGEDHN
CSc1ccc([C@@H](CNC(=O)c2csc(C#N)c2)N(C)C)cc1	ZINC001326528452	1388230136	/nfs/dbraw/zinc/23/01/36/1388230136.db2.gz	DLLPYZAXHSRSEY-MRXNPFEDSA-N	0	3	345.493	3.374	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)[C@H](C)c2ccc(CC)cc2)[C@H](OC)C1	ZINC001213576851	1372928799	/nfs/dbraw/zinc/92/87/99/1372928799.db2.gz	YRRBQYAMZNBOJC-NSISKUIASA-N	0	3	344.499	3.134	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H](NC(=O)c2cc(C(C)C)oc2C)[C@H](OC)C1	ZINC001213655153	1372940896	/nfs/dbraw/zinc/94/08/96/1372940896.db2.gz	FDMSDFIABRVHSM-LSBZLQRGSA-N	0	3	348.487	3.495	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)C[C@@H](c2ccccc2)C(C)C)[C@H](OC)C1	ZINC001213706356	1372948124	/nfs/dbraw/zinc/94/81/24/1372948124.db2.gz	CBFXJGXMRSEJEZ-VAMGGRTRSA-N	0	3	344.499	3.208	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)[C@@H](F)CCCCCC)[C@H](OC)C1	ZINC001213723289	1372951884	/nfs/dbraw/zinc/95/18/84/1372951884.db2.gz	CIMBDFSJCUEDTI-GVDBMIGSSA-N	0	3	328.472	3.077	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2csc3c2CCCC3)[C@H](OC)C1	ZINC001213823253	1372966419	/nfs/dbraw/zinc/96/64/19/1372966419.db2.gz	PCCVQHBTVKESEZ-IAGOWNOFSA-N	0	3	348.512	3.022	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2CN(CCCCCC)C[C@H]2OC)CCCCC1	ZINC001213953311	1372985751	/nfs/dbraw/zinc/98/57/51/1372985751.db2.gz	BSNFDLUZVAPEAZ-RTBURBONSA-N	0	3	348.531	3.356	20	30		EGEDHN
CC(C)C#CC(=O)NCCN[C@H]1CCc2c1cc(Cl)cc2Cl	ZINC001126810774	1373031735	/nfs/dbraw/zinc/03/17/35/1373031735.db2.gz	KPHYWTYQYIZHHJ-INIZCTEOSA-N	0	3	339.266	3.346	20	30		EGEDHN
CC1CC(C(=O)N2C[C@@H](C)[C@H](NCC#Cc3cccc(Cl)c3)C2)C1	ZINC001214425051	1373058887	/nfs/dbraw/zinc/05/88/87/1373058887.db2.gz	RKWYDFIINWQUQM-ZSVMCUKPSA-N	0	3	344.886	3.174	20	30		EGEDHN
Cc1sccc1C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2)C1	ZINC001214579941	1373084387	/nfs/dbraw/zinc/08/43/87/1373084387.db2.gz	QFMLNJZDZBQPQJ-DNVCBOLYSA-N	0	3	338.476	3.158	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](C)[C@H](NCc2cccc(Cl)n2)C1	ZINC001214727598	1373110337	/nfs/dbraw/zinc/11/03/37/1373110337.db2.gz	IZKDMQQGCHQKLS-UKRRQHHQSA-N	0	3	335.879	3.274	20	30		EGEDHN
C=C(C)CNCc1ccncc1O[C@H]1CCN(C(=O)[C@@H](C)CCC)C1	ZINC001127878483	1373194409	/nfs/dbraw/zinc/19/44/09/1373194409.db2.gz	PBMBVXYADLETJZ-WMZOPIPTSA-N	0	3	345.487	3.163	20	30		EGEDHN
CC(C)=C(C)CC(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001215331852	1373198568	/nfs/dbraw/zinc/19/85/68/1373198568.db2.gz	NTKPYKWZXOQATB-RHSMWYFYSA-N	0	3	331.485	3.303	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCCC2CC2)C[C@H]1NCc1ccc(C#N)c(F)c1	ZINC001215367081	1373203877	/nfs/dbraw/zinc/20/38/77/1373203877.db2.gz	CUKDXLKHHXGXQC-AUUYWEPGSA-N	0	3	343.446	3.214	20	30		EGEDHN
CC(C)CCCC(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001215633461	1373221401	/nfs/dbraw/zinc/22/14/01/1373221401.db2.gz	BIPDKDCZVJYZFX-YLJYHZDGSA-N	0	3	344.474	3.440	20	30		EGEDHN
CC(C)C[C@@H](C)C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001216099097	1373262442	/nfs/dbraw/zinc/26/24/42/1373262442.db2.gz	HMKOGHMBJTVIOV-SPYBWZPUSA-N	0	3	345.462	3.316	20	30		EGEDHN
CCCCCCCCC(=O)N[C@@H]1CN(CC(C)C)C[C@@H]1n1ccnn1	ZINC001129400437	1373380088	/nfs/dbraw/zinc/38/00/88/1373380088.db2.gz	OKUWTCHYGGMIQE-MSOLQXFVSA-N	0	3	349.523	3.026	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)[C@@H]2CCC=CCCC2)ccc1F	ZINC001130159333	1373464711	/nfs/dbraw/zinc/46/47/11/1373464711.db2.gz	AMDAUTVYDWCIDR-MRXNPFEDSA-N	0	3	329.419	3.040	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)[C@H]2CCC=CCCC2)ccc1F	ZINC001130159332	1373464824	/nfs/dbraw/zinc/46/48/24/1373464824.db2.gz	AMDAUTVYDWCIDR-INIZCTEOSA-N	0	3	329.419	3.040	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)C/C=C/c2ccc(F)cc2)cc1	ZINC001130171510	1373469659	/nfs/dbraw/zinc/46/96/59/1373469659.db2.gz	RWGLGKFHLHUJAL-OWOJBTEDSA-N	0	3	337.398	3.007	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)C/C=C\c2ccc(F)cc2)c1	ZINC001130171882	1373470058	/nfs/dbraw/zinc/47/00/58/1373470058.db2.gz	XOBKOZBFYZPYRT-IHWYPQMZSA-N	0	3	337.398	3.007	20	30		EGEDHN
CCC1(C(=O)NCCNCc2ccc(C#N)cc2)CCC(F)(F)CC1	ZINC001130416637	1373529519	/nfs/dbraw/zinc/52/95/19/1373529519.db2.gz	XSOSNXSCWNRQTD-UHFFFAOYSA-N	0	3	349.425	3.370	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)C(C)(C)CC(C)C)C1	ZINC001130439611	1373540565	/nfs/dbraw/zinc/54/05/65/1373540565.db2.gz	TUMMCLNUGRLIAO-HNNXBMFYSA-N	0	3	332.492	3.074	20	30		EGEDHN
Cc1nc(O[C@H]2CNCc3ccccc32)c(C#N)cc1Br	ZINC001218489035	1373624775	/nfs/dbraw/zinc/62/47/75/1373624775.db2.gz	SSYJAPYEPMCJNQ-HNNXBMFYSA-N	0	3	344.212	3.248	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)CCCC3CC3)[C@H]2C1	ZINC001218503899	1373626922	/nfs/dbraw/zinc/62/69/22/1373626922.db2.gz	OOCOAFTXIAYXRF-RBUKOAKNSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCO[C@@H]2CN(CC3CC4(CCC4)C3)C[C@@H]21	ZINC001218518768	1373628974	/nfs/dbraw/zinc/62/89/74/1373628974.db2.gz	ZJWRPMCRNVUYMR-NZSAHSFTSA-N	0	3	346.515	3.081	20	30		EGEDHN
CC(C)=C[C@H]1[C@H](C(=O)NCCNCc2ccc(C#N)cc2)C1(C)C	ZINC001131088201	1373640928	/nfs/dbraw/zinc/64/09/28/1373640928.db2.gz	MCIVHBSUTDHFAK-ZWKOTPCHSA-N	0	3	325.456	3.002	20	30		EGEDHN
CC(C)=C[C@@H]1[C@H](C(=O)NCCNCc2ccc(C#N)c(F)c2)C1(C)C	ZINC001131089065	1373642129	/nfs/dbraw/zinc/64/21/29/1373642129.db2.gz	WGMACXJDMKBKIU-SJLPKXTDSA-N	0	3	343.446	3.142	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2OCCN(C(=O)c3ccc(CC)cc3)[C@H]2C1	ZINC001219014547	1373679727	/nfs/dbraw/zinc/67/97/27/1373679727.db2.gz	GGBKTYMPYZNKMF-FFZOFVMBSA-N	0	3	342.483	3.129	20	30		EGEDHN
CN[C@@H](Cc1ccc(Cl)cc1)C(=O)Nc1c(F)c(F)ccc1C#N	ZINC001219317400	1373700199	/nfs/dbraw/zinc/70/01/99/1373700199.db2.gz	YXHBEUVJZSOVDE-AWEZNQCLSA-N	0	3	349.768	3.259	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CN([C@@H](C)c2ccc3ccccc3c2)C[C@@H]1O	ZINC001219326234	1373701204	/nfs/dbraw/zinc/70/12/04/1373701204.db2.gz	NCRFLNZHVBBKEV-BEVDRBHNSA-N	0	3	338.451	3.028	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)Nc1ccc2c(c1)CC[C@H]2C(=O)OC	ZINC001219425795	1373708967	/nfs/dbraw/zinc/70/89/67/1373708967.db2.gz	VDAVPFCHFVBEKU-MSOLQXFVSA-N	0	3	344.455	3.292	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@@H]2CCCC3(CC3)C2)[C@@H](O)C1	ZINC001219626098	1373720648	/nfs/dbraw/zinc/72/06/48/1373720648.db2.gz	CNSWUGOLXAIXNP-KURKYZTESA-N	0	3	336.520	3.089	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@@H](NCc3cncc(C)c3)C2)CCCCC1	ZINC001188265545	1388278022	/nfs/dbraw/zinc/27/80/22/1388278022.db2.gz	JPMFZKNCJNVPEG-LJQANCHMSA-N	0	3	339.483	3.054	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@@H](NCc3scnc3C)C2)CCCCC1	ZINC001188265146	1388278380	/nfs/dbraw/zinc/27/83/80/1388278380.db2.gz	CLWYAJOFUADWBQ-MRXNPFEDSA-N	0	3	345.512	3.116	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)O[C@]2(CCN(Cc3ccccc3)C2)C1	ZINC001131666765	1373751844	/nfs/dbraw/zinc/75/18/44/1373751844.db2.gz	RQNOMGXRHFFNKP-NQIIRXRSSA-N	0	3	342.483	3.235	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)[C@@H]2CCCC[C@H]2C2CC2)cc1F	ZINC001131741958	1373780359	/nfs/dbraw/zinc/78/03/59/1373780359.db2.gz	NYOZREQSPRZLBA-ZWKOTPCHSA-N	0	3	343.446	3.120	20	30		EGEDHN
C=CCOCCN1CC[C@@H]2CN(C(=O)C[C@@H](CC)CCCC)[C@@H]2C1	ZINC001221701662	1373790840	/nfs/dbraw/zinc/79/08/40/1373790840.db2.gz	ZBKXZXVCRUVHOG-IPMKNSEASA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@H]3CCN(C[C@H](CC)OC)C[C@H]32)CCCC1	ZINC001222152583	1373818063	/nfs/dbraw/zinc/81/80/63/1373818063.db2.gz	WJHFWYXPNRQSFS-FGTMMUONSA-N	0	3	334.504	3.081	20	30		EGEDHN
CC[C@@H](SC)C(=O)NCC1CCN(Cc2cccc(C#N)c2)CC1	ZINC001222856099	1373889198	/nfs/dbraw/zinc/88/91/98/1373889198.db2.gz	DABQGSSUWNVDCS-GOSISDBHSA-N	0	3	345.512	3.028	20	30		EGEDHN
N#Cc1cc(CNC2(CNC(=O)C3CCCC3)CCC2)ccc1F	ZINC001326772957	1388305518	/nfs/dbraw/zinc/30/55/18/1388305518.db2.gz	LTCLXNQWMDRZLX-UHFFFAOYSA-N	0	3	329.419	3.016	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](NCc3cccnc3C)C2)CCCC1	ZINC001188490549	1388317871	/nfs/dbraw/zinc/31/78/71/1388317871.db2.gz	RJOQBQPZZISVQV-GOSISDBHSA-N	0	3	327.472	3.217	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC[C@H](C)N(CCCOc2ccccc2)C1	ZINC001131894841	1375032385	/nfs/dbraw/zinc/03/23/85/1375032385.db2.gz	CBKDNALEONOVRZ-ROUUACIJSA-N	0	3	330.472	3.391	20	30		EGEDHN
CCC1(C(=O)NCC2CCN(Cc3cccc(C#N)c3)CC2)CCC1	ZINC001224173603	1375059130	/nfs/dbraw/zinc/05/91/30/1375059130.db2.gz	AKZGQEQSRSBKFI-UHFFFAOYSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=CCOCC(=O)N[C@H]1CC[C@H](C)N(Cc2ccc(C3CC3)cc2)C1	ZINC001131945937	1375061987	/nfs/dbraw/zinc/06/19/87/1375061987.db2.gz	DGBFMYBVJLHLBV-JXFKEZNVSA-N	0	3	342.483	3.236	20	30		EGEDHN
C=CCOCC(=O)N[C@@H]1CC[C@H](C)N(Cc2ccc(C(C)C)cc2)C1	ZINC001131947881	1375062695	/nfs/dbraw/zinc/06/26/95/1375062695.db2.gz	YVCPGVVHKBTHLQ-FXAWDEMLSA-N	0	3	344.499	3.482	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CC[C@@H](C)N(CCOc2ccccc2)C1	ZINC001131975536	1375078301	/nfs/dbraw/zinc/07/83/01/1375078301.db2.gz	BCKHZHCJQPEOGJ-RTBURBONSA-N	0	3	342.483	3.228	20	30		EGEDHN
Cc1cccc(C(=O)N[C@@H]2CCCC[C@H]2NCC#Cc2ccccc2)n1	ZINC001224827052	1375079931	/nfs/dbraw/zinc/07/99/31/1375079931.db2.gz	VSBFRDBJDQGFAG-WOJBJXKFSA-N	0	3	347.462	3.072	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CC[C@H](C)N(CCCCC(F)(F)F)C1	ZINC001132002341	1375092282	/nfs/dbraw/zinc/09/22/82/1375092282.db2.gz	ISZXFJZDAUCKNP-GJZGRUSLSA-N	0	3	332.410	3.492	20	30		EGEDHN
Cc1cc(CN2C[C@H](NC(=O)C#CC(C)C)CC[C@H]2C)c(C)s1	ZINC001132025848	1375105793	/nfs/dbraw/zinc/10/57/93/1375105793.db2.gz	WLPVSHRXVKINFO-RDTXWAMCSA-N	0	3	332.513	3.493	20	30		EGEDHN
C[C@H]1CC[C@H](NC(=O)C#CC2CC2)CN1CCCc1ccsc1	ZINC001132045154	1375114741	/nfs/dbraw/zinc/11/47/41/1375114741.db2.gz	AUEGXYAROJOZKP-YJBOKZPZSA-N	0	3	330.497	3.063	20	30		EGEDHN
C[C@@H]1CC[C@H](NC(=O)C#CC2CC2)CN1Cc1ccc2ncccc2c1	ZINC001132047300	1375116005	/nfs/dbraw/zinc/11/60/05/1375116005.db2.gz	WFEKIHUOVXDWHF-UZLBHIALSA-N	0	3	347.462	3.117	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NCC1CCN([C@@H](C)c2ccccc2F)CC1	ZINC001225632131	1375135966	/nfs/dbraw/zinc/13/59/66/1375135966.db2.gz	YBFRSLZJZDMQJS-HOTGVXAUSA-N	0	3	348.462	3.306	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2cc(OCC)no2)CC[C@H]1C	ZINC001132174397	1375188241	/nfs/dbraw/zinc/18/82/41/1375188241.db2.gz	UWBRVTNSUCJPQG-CVEARBPZSA-N	0	3	349.475	3.402	20	30		EGEDHN
CCc1noc(C)c1CN[C@@H]1CCCC[C@H]1NC(=O)C#CC(C)(C)C	ZINC001226133671	1375209078	/nfs/dbraw/zinc/20/90/78/1375209078.db2.gz	HGWNZUQBZNNWLM-QZTJIDSGSA-N	0	3	345.487	3.112	20	30		EGEDHN
C[C@H](N[C@@H]1CCCC[C@H]1NC(=O)C#CC1CC1)c1cc(F)ccc1F	ZINC001226133383	1375209103	/nfs/dbraw/zinc/20/91/03/1375209103.db2.gz	BGXQQQBNGMVOKN-MJXNMMHHSA-N	0	3	346.421	3.456	20	30		EGEDHN
CC#CCCCC(=O)N[C@H]1CC[C@H](C)N(CCOCCC(C)C)C1	ZINC001132223041	1375219072	/nfs/dbraw/zinc/21/90/72/1375219072.db2.gz	AXVTYUJDQAQKND-OALUTQOASA-N	0	3	336.520	3.212	20	30		EGEDHN
CC#CCCCC(=O)N[C@H]1CC[C@@H](C)N(CCOCCC(C)C)C1	ZINC001132223039	1375219207	/nfs/dbraw/zinc/21/92/07/1375219207.db2.gz	AXVTYUJDQAQKND-MOPGFXCFSA-N	0	3	336.520	3.212	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CC[C@H](C)N(CCOC3CCC3)C2)CCC1	ZINC001132283008	1375265554	/nfs/dbraw/zinc/26/55/54/1375265554.db2.gz	PTLMEYVFFYYLAP-DLBZAZTESA-N	0	3	334.504	3.271	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2snnc2C(C)C)CC[C@H]1C	ZINC001132367948	1375331864	/nfs/dbraw/zinc/33/18/64/1375331864.db2.gz	GWGRXUINCNLCCB-KGLIPLIRSA-N	0	3	336.505	3.210	20	30		EGEDHN
C#CCCCCCC(=O)NCCNCc1ccccc1OC1CC1	ZINC001132404282	1375355583	/nfs/dbraw/zinc/35/55/83/1375355583.db2.gz	YYRHGBXDQSSFNH-UHFFFAOYSA-N	0	3	328.456	3.017	20	30		EGEDHN
CCCCCCCCCCC(=O)N[C@@H]1CC[C@H](C)N(CCO)C1	ZINC001132435984	1375380918	/nfs/dbraw/zinc/38/09/18/1375380918.db2.gz	IJNMCQCVXVIZLU-ZWKOTPCHSA-N	0	3	326.525	3.479	20	30		EGEDHN
C#CCCCC(=O)NC1CCN(CCc2ccccc2Cl)CC1	ZINC001227108484	1375391599	/nfs/dbraw/zinc/39/15/99/1375391599.db2.gz	RRQCSTIMUBRZIZ-UHFFFAOYSA-N	0	3	332.875	3.267	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCCOc2ccccc2)CC[C@@H]1C	ZINC001132464368	1375407467	/nfs/dbraw/zinc/40/74/67/1375407467.db2.gz	RSFSLYRZQXPQII-ROUUACIJSA-N	0	3	330.472	3.391	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCOc2ccccc2OC)CC[C@H]1C	ZINC001132472530	1375413689	/nfs/dbraw/zinc/41/36/89/1375413689.db2.gz	IJQBFBFFIZTUHS-SJORKVTESA-N	0	3	346.471	3.009	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)C2CCC(C)(C)CC2)CC[C@H]1C	ZINC001132522932	1375439687	/nfs/dbraw/zinc/43/96/87/1375439687.db2.gz	VEAMUESQJAQADK-SJLPKXTDSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1CC[C@H](C)N(Cc2ccc(C)cc2)C1	ZINC001132528296	1375442698	/nfs/dbraw/zinc/44/26/98/1375442698.db2.gz	BHKURXGVVJCGKQ-HKUYNNGSSA-N	0	3	330.472	3.057	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1CC[C@@H](C)N(Cc2cc(C)cc(C)c2)C1	ZINC001132528259	1375442768	/nfs/dbraw/zinc/44/27/68/1375442768.db2.gz	AWJLTRQHYIYGGR-UYAOXDASSA-N	0	3	344.499	3.365	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2(C(F)(F)F)CCCCC2)CC[C@H]1C	ZINC001132543447	1375450651	/nfs/dbraw/zinc/45/06/51/1375450651.db2.gz	YIJYVEBAAOCOBH-HUUCEWRRSA-N	0	3	344.421	3.492	20	30		EGEDHN
C=C(C)CCC(=O)NC1CCN(Cc2ccc(OC)c(C)c2)CC1	ZINC001227607538	1375452836	/nfs/dbraw/zinc/45/28/36/1375452836.db2.gz	UDBDGWAGSCZSHR-UHFFFAOYSA-N	0	3	330.472	3.441	20	30		EGEDHN
C#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)CC2(C)CC2)CC1	ZINC001132554002	1375459884	/nfs/dbraw/zinc/45/98/84/1375459884.db2.gz	AGGDFARVTYRDPW-LJQANCHMSA-N	0	3	339.483	3.088	20	30		EGEDHN
C#CCN1CC[C@H](CN(Cc2scnc2C)C(=O)C[C@@H](C)CC)C1	ZINC001132557809	1375464513	/nfs/dbraw/zinc/46/45/13/1375464513.db2.gz	DOIUTUYEJAQMIK-RDJZCZTQSA-N	0	3	347.528	3.171	20	30		EGEDHN
C#CCN1CC[C@@H](CN(Cc2scnc2C)C(=O)/C(C)=C\CC)C1	ZINC001132558273	1375466022	/nfs/dbraw/zinc/46/60/22/1375466022.db2.gz	KDZJEPKDAWVNNY-IJZIWBRISA-N	0	3	345.512	3.092	20	30		EGEDHN
C#CCN1CC[C@@H](CN(Cc2scnc2C)C(=O)/C=C(/C)CC)C1	ZINC001132563267	1375469247	/nfs/dbraw/zinc/46/92/47/1375469247.db2.gz	QBQGDBCWWDNDOO-XBNGYDHASA-N	0	3	345.512	3.092	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCNCc1cc(C(C)C)ccc1OC	ZINC001132573503	1375471712	/nfs/dbraw/zinc/47/17/12/1375471712.db2.gz	OMFWMBLDWUWUCB-HZPDHXFCSA-N	0	3	332.488	3.483	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CCCC[C@H]1N[C@H](C)c1cnc(C)cn1	ZINC001227973545	1375496736	/nfs/dbraw/zinc/49/67/36/1375496736.db2.gz	SJTXMUBGDLJIGG-BZUAXINKSA-N	0	3	330.476	3.075	20	30		EGEDHN
CCCCC(=O)N1CC[C@H](C)[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001132670621	1375507053	/nfs/dbraw/zinc/50/70/53/1375507053.db2.gz	VKILFRUPNHVGFC-MAUKXSAKSA-N	0	3	345.462	3.462	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CCCC[C@H]1N[C@@H](C)c1cnc(C)cn1	ZINC001228090359	1375517330	/nfs/dbraw/zinc/51/73/30/1375517330.db2.gz	YHPBFFORFVSMCB-RCCFBDPRSA-N	0	3	342.487	3.057	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CCCC[C@H]1NCc1n[nH]c(C(C)C)n1	ZINC001228112806	1375519115	/nfs/dbraw/zinc/51/91/15/1375519115.db2.gz	ODWOBLMSBFGEBF-BZUAXINKSA-N	0	3	347.507	3.047	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CCCC[C@H]2NCc2cncs2)CCC1	ZINC001228406377	1375567376	/nfs/dbraw/zinc/56/73/76/1375567376.db2.gz	DVOJSZFCXHUCFS-HZPDHXFCSA-N	0	3	333.501	3.407	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CCCC[C@H]2NCc2cnc(C)nc2)CCC1	ZINC001228406814	1375567591	/nfs/dbraw/zinc/56/75/91/1375567591.db2.gz	SSXWHLSCRSVVGT-QZTJIDSGSA-N	0	3	342.487	3.048	20	30		EGEDHN
CC(F)(F)CC(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1	ZINC001228435639	1375572205	/nfs/dbraw/zinc/57/22/05/1375572205.db2.gz	PPKPPTOPURQFHT-IAGOWNOFSA-N	0	3	334.410	3.100	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CCN(CC[C@@H]2CC2(Cl)Cl)CC1	ZINC001228631978	1375621743	/nfs/dbraw/zinc/62/17/43/1375621743.db2.gz	ZBHSAGHGGMJNAZ-GFCCVEGCSA-N	0	3	333.303	3.363	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CCN(C[C@@H](OC)c2ccccc2)CC1	ZINC001228631127	1375622562	/nfs/dbraw/zinc/62/25/62/1375622562.db2.gz	DIQYFQAOSJBCDU-GOSISDBHSA-N	0	3	330.472	3.167	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC001228747449	1375660518	/nfs/dbraw/zinc/66/05/18/1375660518.db2.gz	AYMAXCXVQXFFAT-HOTGVXAUSA-N	0	3	348.462	3.243	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NC1CCN(Cc2ccc(OC)cc2)CC1	ZINC001228750229	1375664295	/nfs/dbraw/zinc/66/42/95/1375664295.db2.gz	YAEPAFCAXKOBHD-CVEARBPZSA-N	0	3	330.472	3.234	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC1CCN(Cc2ccc3c(c2)COC3)CC1	ZINC001228786402	1375675199	/nfs/dbraw/zinc/67/51/99/1375675199.db2.gz	ISXGFBDFTRGYKV-INIZCTEOSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC1CCN(Cc2ccc3c(c2)COC3)CC1	ZINC001228809133	1375684016	/nfs/dbraw/zinc/68/40/16/1375684016.db2.gz	FJMNNYKEZHKGSP-INIZCTEOSA-N	0	3	342.483	3.400	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](C)[C@@H](CNCc2csc(C)n2)C1	ZINC001133059313	1375750285	/nfs/dbraw/zinc/75/02/85/1375750285.db2.gz	OHBSLNYRCKLUCT-WBVHZDCISA-N	0	3	347.528	3.219	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](C)[C@@H](CNCc2cc(C3CC3)no2)C1	ZINC001133072886	1375759540	/nfs/dbraw/zinc/75/95/40/1375759540.db2.gz	MEITYQXBWCSONP-RDJZCZTQSA-N	0	3	345.487	3.483	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](C)[C@H](CNCc2cnc(C)o2)C1	ZINC001133143713	1375804708	/nfs/dbraw/zinc/80/47/08/1375804708.db2.gz	WZEAEICIRPMJRE-GDBMZVCRSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](C)[C@@H](CNCc2cscn2)C1	ZINC001133143706	1375804949	/nfs/dbraw/zinc/80/49/49/1375804949.db2.gz	WTQJXVLKTPQXIM-GJZGRUSLSA-N	0	3	335.517	3.320	20	30		EGEDHN
C[C@@H](C(=O)NCCNCc1ccc(C#N)cc1)c1ccc(Cl)cc1	ZINC001133244721	1375864755	/nfs/dbraw/zinc/86/47/55/1375864755.db2.gz	MKEBSTHHFLYAPH-CQSZACIVSA-N	0	3	341.842	3.221	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)/C=C\c1ccco1	ZINC001133377489	1375958092	/nfs/dbraw/zinc/95/80/92/1375958092.db2.gz	VBRYBHOLLVCJKI-HJWRWDBZSA-N	0	3	342.826	3.198	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@H]1[C@@H]2CCC[C@@H]21	ZINC001133390814	1375974293	/nfs/dbraw/zinc/97/42/93/1375974293.db2.gz	KOTRDUWMYZQNCU-BWTSREIZSA-N	0	3	344.886	3.328	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@H](C)CC(=C)C	ZINC001133401334	1375984742	/nfs/dbraw/zinc/98/47/42/1375984742.db2.gz	AKMDAZRSQYXSSD-MRXNPFEDSA-N	0	3	332.875	3.494	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@H]1CC[C@@H](F)C1	ZINC001133401526	1375985319	/nfs/dbraw/zinc/98/53/19/1375985319.db2.gz	FTGGFBZGVIMYMI-DOTOQJQBSA-N	0	3	336.838	3.030	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1cc(C)[nH]c1C	ZINC001133405827	1375990660	/nfs/dbraw/zinc/99/06/60/1375990660.db2.gz	SJSNXQFGSAJRBD-UHFFFAOYSA-N	0	3	343.858	3.150	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)CCCCCOCC	ZINC001230310009	1375992047	/nfs/dbraw/zinc/99/20/47/1375992047.db2.gz	JYNACKZYJKPWCB-HZPDHXFCSA-N	0	3	330.900	3.353	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NC1CCN(Cc2cc(C)sc2C)CC1	ZINC001230415670	1376024454	/nfs/dbraw/zinc/02/44/54/1376024454.db2.gz	WHJXFRGUIQBQOQ-AWEZNQCLSA-N	0	3	336.501	3.037	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)[C@H]1C[C@@H]1C(C)C)Cc1cccnc1	ZINC001230882056	1376175842	/nfs/dbraw/zinc/17/58/42/1376175842.db2.gz	MGJNQPGQNRBAFU-MOPGFXCFSA-N	0	3	329.488	3.258	20	30		EGEDHN
N#Cc1ccccc1O[C@@H]1CCCN(Cc2c[nH]c3cnccc23)C1	ZINC001231520712	1376256566	/nfs/dbraw/zinc/25/65/66/1376256566.db2.gz	CKOJIIQFAHYDRQ-QGZVFWFLSA-N	0	3	332.407	3.478	20	30		EGEDHN
C=CCOCC(=O)N[C@@H](C)C[C@@H](C)NCc1cc(F)ccc1Cl	ZINC001133909043	1376259970	/nfs/dbraw/zinc/25/99/70/1376259970.db2.gz	GJESWFHDUFSDJA-OLZOCXBDSA-N	0	3	342.842	3.055	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CCN(Cc3ccc(CC)cn3)C2)C1	ZINC001231637277	1376288524	/nfs/dbraw/zinc/28/85/24/1376288524.db2.gz	FEQIOYHXHRNUQO-HXUWFJFHSA-N	0	3	343.471	3.255	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@H]1CCN(Cc1ccc(OCC)nc1)C2	ZINC001231653415	1376294037	/nfs/dbraw/zinc/29/40/37/1376294037.db2.gz	HURYYKKQEMACMS-AZUAARDMSA-N	0	3	346.471	3.054	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@@H]1CCN(Cc1ccc(OCC)nc1)C2	ZINC001231653419	1376294231	/nfs/dbraw/zinc/29/42/31/1376294231.db2.gz	HURYYKKQEMACMS-UYAOXDASSA-N	0	3	346.471	3.054	20	30		EGEDHN
C#Cc1cccc(CN2CCC3(C[C@H](c4ccccc4)C(=O)N3)CC2)c1	ZINC001231657483	1376295812	/nfs/dbraw/zinc/29/58/12/1376295812.db2.gz	QXCQDILGNQHAIW-OAQYLSRUSA-N	0	3	344.458	3.306	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3ccc(C#N)c(Cl)c3)C2)C1=O	ZINC001232113395	1376400501	/nfs/dbraw/zinc/40/05/01/1376400501.db2.gz	UIUWEXXQIRWFFA-IBGZPJMESA-N	0	3	343.858	3.212	20	30		EGEDHN
C#CCCCC(=O)N[C@@H](C)C[C@H](C)NCc1cc(O)ccc1Cl	ZINC001134206413	1376417899	/nfs/dbraw/zinc/41/78/99/1376417899.db2.gz	UNPOSWXYODBKJF-KBPBESRZSA-N	0	3	336.863	3.222	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@@H]1CCN(Cc1cccc(CF)n1)C2	ZINC001232534571	1376477513	/nfs/dbraw/zinc/47/75/13/1376477513.db2.gz	RWXJKFWJZJHGNG-MOPGFXCFSA-N	0	3	334.435	3.125	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H](C)C[C@@H](C)NCc1oc(C)nc1C	ZINC001134419237	1376524044	/nfs/dbraw/zinc/52/40/44/1376524044.db2.gz	UYYMUURDZBYEBZ-KGLIPLIRSA-N	0	3	333.476	3.433	20	30		EGEDHN
COc1cc2c(cc1OC)[C@@H](CN(C)Cc1ccc(C#N)s1)C2	ZINC001232847292	1376524193	/nfs/dbraw/zinc/52/41/93/1376524193.db2.gz	UYPLLBGZCHYWPC-CYBMUJFWSA-N	0	3	328.437	3.409	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CC[C@]2(C[C@@H](OCC3CC3)CO2)C1	ZINC001233080704	1376567215	/nfs/dbraw/zinc/56/72/15/1376567215.db2.gz	AJTBAXXTIKUZJV-UXHICEINSA-N	0	3	326.440	3.027	20	30		EGEDHN
N#Cc1nc2cc(O[C@H]3CC[C@@H](N4CCOCC4)CC3)ccc2s1	ZINC001233706258	1376699724	/nfs/dbraw/zinc/69/97/24/1376699724.db2.gz	QJIUWVJGBGWZHE-OKILXGFUSA-N	0	3	343.452	3.190	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)C1(F)CCCC1)NCc1ccccc1C#N	ZINC001134790756	1376724674	/nfs/dbraw/zinc/72/46/74/1376724674.db2.gz	HTAOEGIYUVNALD-HUUCEWRRSA-N	0	3	331.435	3.213	20	30		EGEDHN
Cc1ccc(CCCN2CC[C@@H]2CN(C)C(=O)C#CC(C)C)cc1	ZINC001234162593	1376781954	/nfs/dbraw/zinc/78/19/54/1376781954.db2.gz	UFNMNRPMNNJUHZ-HXUWFJFHSA-N	0	3	326.484	3.120	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](C)C[C@H](C)NCc1cc2n(n1)CCCC2	ZINC001135181674	1376955118	/nfs/dbraw/zinc/95/51/18/1376955118.db2.gz	SVUOCCQAMYBQMZ-HOTGVXAUSA-N	0	3	346.519	3.195	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2ccc3c(c2)C=CCC3)c1	ZINC001135196722	1376968678	/nfs/dbraw/zinc/96/86/78/1376968678.db2.gz	FZLSOGYMGXIOPZ-UHFFFAOYSA-N	0	3	331.419	3.037	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H](C)C[C@H](C)NCc1oc(CC)nc1C	ZINC001135224637	1376984928	/nfs/dbraw/zinc/98/49/28/1376984928.db2.gz	GSZNVBYGHADOKS-GJZGRUSLSA-N	0	3	333.476	3.112	20	30		EGEDHN
CCOc1cc(F)c(F)cc1CN1CCC2SC(=O)C=C2C1	ZINC001238657141	1376999869	/nfs/dbraw/zinc/99/98/69/1376999869.db2.gz	WPNDNMCHPXYYCG-OAHLLOKOSA-N	0	3	325.380	3.138	20	30		EGEDHN
CCc1cc(CN2CCC(C)(C(=O)N3CCCC3)CC2)ccc1C#N	ZINC001238778575	1377001385	/nfs/dbraw/zinc/00/13/85/1377001385.db2.gz	OUYFIGRUXUXRDL-UHFFFAOYSA-N	0	3	339.483	3.345	20	30		EGEDHN
C=CCCCC(=O)N[C@@H](C)C[C@@H](C)NCc1cc(F)ccc1C#N	ZINC001135358366	1377051528	/nfs/dbraw/zinc/05/15/28/1377051528.db2.gz	QYSUUDNBEUHNDU-CABCVRRESA-N	0	3	331.435	3.427	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)C1(C)CC=CC1)NCc1cc(F)ccc1C#N	ZINC001135411168	1377080316	/nfs/dbraw/zinc/08/03/16/1377080316.db2.gz	LROCGJXJPMFWRS-GJZGRUSLSA-N	0	3	343.446	3.427	20	30		EGEDHN
CC(C)CC1(C(=O)NCCNCc2ccc(C#N)s2)CCCC1	ZINC001135414044	1377081458	/nfs/dbraw/zinc/08/14/58/1377081458.db2.gz	HKNICWCVQGXGSZ-UHFFFAOYSA-N	0	3	333.501	3.432	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H](C)C[C@@H](C)NCc1nccn1C(F)F	ZINC001135562373	1377146065	/nfs/dbraw/zinc/14/60/65/1377146065.db2.gz	YIDUKPONMZNCRT-OLZOCXBDSA-N	0	3	342.434	3.253	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)C[C@H](C)CCC=C(C)C)[C@@H]2C1	ZINC001189212920	1388485768	/nfs/dbraw/zinc/48/57/68/1388485768.db2.gz	QLONTWUYAVDOAU-HSALFYBXSA-N	0	3	348.531	3.494	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)c1ccc(C)cc1	ZINC001136006164	1377296723	/nfs/dbraw/zinc/29/67/23/1377296723.db2.gz	JCCAEGLRMKMEPV-KGLIPLIRSA-N	0	3	339.277	3.390	20	30		EGEDHN
C=CCCCC(=O)N1CCCC[C@H]1CNCc1c(C)onc1CC	ZINC001266877583	1377398840	/nfs/dbraw/zinc/39/88/40/1377398840.db2.gz	TZZTTZXYHVLURU-INIZCTEOSA-N	0	3	333.476	3.372	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](N(C)[C@@H]2CCc3c2cc(F)cc3F)C1	ZINC001189278752	1388505974	/nfs/dbraw/zinc/50/59/74/1388505974.db2.gz	BJVLRTQPVNBTOP-RDTXWAMCSA-N	0	3	334.410	3.451	20	30		EGEDHN
C=CCOC(=O)N1CC2(C1)CCN(Cc1cccc(C)c1F)CC2	ZINC001137672481	1377586861	/nfs/dbraw/zinc/58/68/61/1377586861.db2.gz	JCHIHOVYUXHPGC-UHFFFAOYSA-N	0	3	332.419	3.355	20	30		EGEDHN
C=CCN1C(=O)CC[C@@]12CCCN(Cc1cc(OC)ccc1F)CC2	ZINC001137993236	1377659988	/nfs/dbraw/zinc/65/99/88/1377659988.db2.gz	HAAMITLIRXORJS-HXUWFJFHSA-N	0	3	346.446	3.367	20	30		EGEDHN
C=CCOC(=O)N[C@@H]1CCCN(Cc2ccc(O)c3ccccc23)C1	ZINC001138064141	1377673164	/nfs/dbraw/zinc/67/31/64/1377673164.db2.gz	WPOXGIMEPINROT-MRXNPFEDSA-N	0	3	340.423	3.422	20	30		EGEDHN
C#CCOc1ccc(CN2CCC[C@H](c3ccccn3)C2)cc1OC	ZINC001138346122	1377706194	/nfs/dbraw/zinc/70/61/94/1377706194.db2.gz	YFJPECQSKCKGRZ-SFHVURJKSA-N	0	3	336.435	3.482	20	30		EGEDHN
C#CCOc1ccc(CN2CCN3CCc4ccccc4[C@H]3C2)cc1	ZINC001138560378	1377741899	/nfs/dbraw/zinc/74/18/99/1377741899.db2.gz	UPDNUQQHUKWWLU-JOCHJYFZSA-N	0	3	332.447	3.114	20	30		EGEDHN
C#CCOc1ccc(CN(CC)CCN(C)C(=O)OC(C)(C)C)cc1	ZINC001138559687	1377742151	/nfs/dbraw/zinc/74/21/51/1377742151.db2.gz	AFBPOEIHMCOGAV-UHFFFAOYSA-N	0	3	346.471	3.387	20	30		EGEDHN
C#CCOc1ccc(CN2CC[C@@H](Oc3cccc(F)c3)C2)cc1	ZINC001138560798	1377742762	/nfs/dbraw/zinc/74/27/62/1377742762.db2.gz	OJJFZUXOMBCBOH-HXUWFJFHSA-N	0	3	325.383	3.491	20	30		EGEDHN
C#CCOc1ccc(CN2CCC[C@@H](Oc3cc(C)ccn3)C2)cc1	ZINC001138560706	1377743064	/nfs/dbraw/zinc/74/30/64/1377743064.db2.gz	IJYZIWKDPKFGPS-HXUWFJFHSA-N	0	3	336.435	3.445	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@@]3(CCN(CC=C)C3=O)C2)c1[O-]	ZINC001138626830	1377756240	/nfs/dbraw/zinc/75/62/40/1377756240.db2.gz	PXJBGIDBPUHKJO-OAQYLSRUSA-N	0	3	340.467	3.121	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@@]3(CCN(CC=C)C3=O)C2)c1[O-]	ZINC001138626830	1377756241	/nfs/dbraw/zinc/75/62/41/1377756241.db2.gz	PXJBGIDBPUHKJO-OAQYLSRUSA-N	0	3	340.467	3.121	20	30		EGEDHN
C=CCc1cccc(C[N@@H+](C)C2CCN(C(=O)OCC)CC2)c1[O-]	ZINC001138627607	1377756575	/nfs/dbraw/zinc/75/65/75/1377756575.db2.gz	BUYWEPFORCAMEQ-UHFFFAOYSA-N	0	3	332.444	3.173	20	30		EGEDHN
C=CCc1cccc(C[N@H+](C)C2CCN(C(=O)OCC)CC2)c1[O-]	ZINC001138627607	1377756576	/nfs/dbraw/zinc/75/65/76/1377756576.db2.gz	BUYWEPFORCAMEQ-UHFFFAOYSA-N	0	3	332.444	3.173	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@H]3[C@H](CCN3C(=O)C(C)C)C2)c1[O-]	ZINC001138627243	1377756781	/nfs/dbraw/zinc/75/67/81/1377756781.db2.gz	AJZPDRDBDYJZSI-MJGOQNOKSA-N	0	3	342.483	3.200	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@H]3[C@H](CCN3C(=O)C(C)C)C2)c1[O-]	ZINC001138627243	1377756782	/nfs/dbraw/zinc/75/67/82/1377756782.db2.gz	AJZPDRDBDYJZSI-MJGOQNOKSA-N	0	3	342.483	3.200	20	30		EGEDHN
C=CCN1C(=O)CCC[C@@]12CCCN(Cc1cnn(CCC)c1C)C2	ZINC001138635846	1377758672	/nfs/dbraw/zinc/75/86/72/1377758672.db2.gz	XEFNHNFUIAORHV-FQEVSTJZSA-N	0	3	344.503	3.135	20	30		EGEDHN
C=C(C)COc1ccccc1CN1CC[C@H]2[C@H](CCC(=O)N2C)C1	ZINC001138666176	1377765209	/nfs/dbraw/zinc/76/52/09/1377765209.db2.gz	LAPFPAOFECHZEL-AEFFLSMTSA-N	0	3	328.456	3.084	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CCN(Cc3cccnc3F)CC2)CC1	ZINC001138785983	1377785103	/nfs/dbraw/zinc/78/51/03/1377785103.db2.gz	ZDZQFVDVGIYTRH-UHFFFAOYSA-N	0	3	347.434	3.221	20	30		EGEDHN
C(#CC1CC[NH+](Cc2ccc(-c3nnn[n-]3)cc2)CC1)c1ccccc1	ZINC001139095725	1377828773	/nfs/dbraw/zinc/82/87/73/1377828773.db2.gz	FDPDNRPPIGTLLW-UHFFFAOYSA-N	0	3	343.434	3.130	20	30		EGEDHN
C(#CC1CC[NH+](Cc2ccc(-c3nn[n-]n3)cc2)CC1)c1ccccc1	ZINC001139095725	1377828776	/nfs/dbraw/zinc/82/87/76/1377828776.db2.gz	FDPDNRPPIGTLLW-UHFFFAOYSA-N	0	3	343.434	3.130	20	30		EGEDHN
COC(=O)C1CCN(Cc2ccc(-c3cc(C#N)ccn3)cc2)CC1	ZINC001139401749	1377878867	/nfs/dbraw/zinc/87/88/67/1377878867.db2.gz	GNZGZWGUVKHGKL-UHFFFAOYSA-N	0	3	335.407	3.005	20	30		EGEDHN
Cc1nccnc1O[C@H]1CCCN(Cc2c[nH]c3c2cccc3C#N)C1	ZINC001139706899	1377938086	/nfs/dbraw/zinc/93/80/86/1377938086.db2.gz	BZKZKAUWTIRIGT-KRWDZBQOSA-N	0	3	347.422	3.181	20	30		EGEDHN
COc1cccnc1O[C@H]1CCN(Cc2c[nH]c3c2cccc3C#N)C1	ZINC001139707453	1377938184	/nfs/dbraw/zinc/93/81/84/1377938184.db2.gz	GCQMFKJHMRXAHH-INIZCTEOSA-N	0	3	348.406	3.096	20	30		EGEDHN
Cc1cc(OC2CCN(Cc3c[nH]c4c3cccc4C#N)CC2)ncn1	ZINC001139707861	1377939332	/nfs/dbraw/zinc/93/93/32/1377939332.db2.gz	WEEQTLMNNVXAIZ-UHFFFAOYSA-N	0	3	347.422	3.181	20	30		EGEDHN
C=CCn1cc(CN2C[C@H]3CCC[C@@]3(COc3ccccn3)C2)cn1	ZINC001139769906	1377948316	/nfs/dbraw/zinc/94/83/16/1377948316.db2.gz	UPSSHEBVMGDPRM-QUCCMNQESA-N	0	3	338.455	3.145	20	30		EGEDHN
Cc1ccc(CN2CC[C@@H]3[C@@H]2CCN3Cc2cc(F)cc(C#N)c2)o1	ZINC001139877421	1377970125	/nfs/dbraw/zinc/97/01/25/1377970125.db2.gz	JNGPVZIYUJVKPA-UXHICEINSA-N	0	3	339.414	3.448	20	30		EGEDHN
Cn1ncc2ccc(CN3CCC[C@H](Oc4cccc(C#N)c4)C3)cc21	ZINC001139907028	1377975242	/nfs/dbraw/zinc/97/52/42/1377975242.db2.gz	BPFUOFGOSWPWQT-FQEVSTJZSA-N	0	3	346.434	3.488	20	30		EGEDHN
CC(C)(C)OC(=O)[C@H]1CCN(Cc2c[nH]c3ccc(C#N)cc23)C1	ZINC001140114417	1378010762	/nfs/dbraw/zinc/01/07/62/1378010762.db2.gz	OZNBOLRIANGULB-AWEZNQCLSA-N	0	3	325.412	3.203	20	30		EGEDHN
COc1cc(O[C@H]2CCN(Cc3c[nH]c4ccc(C#N)cc34)C2)ccn1	ZINC001140116858	1378012007	/nfs/dbraw/zinc/01/20/07/1378012007.db2.gz	IFGKPDBCHWFMFH-KRWDZBQOSA-N	0	3	348.406	3.096	20	30		EGEDHN
C=C(C)CN1CC[C@]2(CCCN2Cc2ccc3cccnc3c2)C1=O	ZINC001273008252	1378084976	/nfs/dbraw/zinc/08/49/76/1378084976.db2.gz	HZRGHOIILAXCNX-OAQYLSRUSA-N	0	3	335.451	3.378	20	30		EGEDHN
C=C(C)CN1CC2(CCC1=O)CCN(Cc1cc(F)ccc1N)CC2	ZINC001274597540	1378129287	/nfs/dbraw/zinc/12/92/87/1378129287.db2.gz	IFDZSLDAIKEVEM-UHFFFAOYSA-N	0	3	345.462	3.189	20	30		EGEDHN
C=CCOC[C@@H]1CCC[C@@]12CN(Cc1ccc(C)cc1O)CCO2	ZINC001140949749	1378189707	/nfs/dbraw/zinc/18/97/07/1378189707.db2.gz	HPCDMZOILWSMAF-AZUAARDMSA-N	0	3	331.456	3.274	20	30		EGEDHN
C=CCCCCN1CC[C@@H]2C[C@@]21C(=O)N1CCC[C@H]1c1cc(C)on1	ZINC001276886128	1378191437	/nfs/dbraw/zinc/19/14/37/1378191437.db2.gz	WAKCGXKAXIVVBJ-KPFFTGBYSA-N	0	3	343.471	3.467	20	30		EGEDHN
N#Cc1ccccc1N1CCC[C@@]2(C1)CN(C1CCCC1)CCO2	ZINC001276953603	1378196584	/nfs/dbraw/zinc/19/65/84/1378196584.db2.gz	MYNQVWZCCZHAJZ-FQEVSTJZSA-N	0	3	325.456	3.172	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)c3ccc(Cl)o3)CCC2)s1	ZINC001280468672	1378349173	/nfs/dbraw/zinc/34/91/73/1378349173.db2.gz	ABDDVBAHYPBPDY-UHFFFAOYSA-N	0	3	349.843	3.308	20	30		EGEDHN
CN(CCN(C)Cc1c(F)ccc(C#N)c1F)Cc1ccccc1	ZINC001143176160	1378554409	/nfs/dbraw/zinc/55/44/09/1378554409.db2.gz	SZQRCGIVMCGTHI-UHFFFAOYSA-N	0	3	329.394	3.400	20	30		EGEDHN
O=C1C=C2CN(Cc3cc(OC(F)(F)F)ccc3F)CCC2S1	ZINC001143542807	1378613122	/nfs/dbraw/zinc/61/31/22/1378613122.db2.gz	YJADMRQSPUWZOK-CYBMUJFWSA-N	0	3	347.333	3.498	20	30		EGEDHN
CN(Cc1ccc(C#N)cn1)C[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC001144163750	1378689186	/nfs/dbraw/zinc/68/91/86/1378689186.db2.gz	UHMPKAXUQHAPRA-MRXNPFEDSA-N	0	3	344.459	3.032	20	30		EGEDHN
Cc1c[nH]cc1C(=O)N[C@@H](C)C[C@@H](C)NCc1cc(F)ccc1C#N	ZINC001146374868	1378830007	/nfs/dbraw/zinc/83/00/07/1378830007.db2.gz	RTHFFTLRZLPOJH-KGLIPLIRSA-N	0	3	342.418	3.021	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2cc(C)no2)CCCCC1	ZINC001146664757	1378893678	/nfs/dbraw/zinc/89/36/78/1378893678.db2.gz	SZTMFMTWYQHTNK-CVEARBPZSA-N	0	3	345.487	3.330	20	30		EGEDHN
CCC[C@H](C)CC(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001147165175	1378981589	/nfs/dbraw/zinc/98/15/89/1378981589.db2.gz	DBIJKXANIFQVER-KRWDZBQOSA-N	0	3	339.483	3.419	20	30		EGEDHN
C#CCCCCC(=O)N1CC2(C1)CCN(Cc1csc(C)c1)C2	ZINC001147381946	1379012521	/nfs/dbraw/zinc/01/25/21/1379012521.db2.gz	YGWNTRJTDGDMSH-UHFFFAOYSA-N	0	3	330.497	3.284	20	30		EGEDHN
C#CCCCC(=O)N1CC2(C1)CCN([C@H]1CCc3c1cccc3F)C2	ZINC001147435583	1379021835	/nfs/dbraw/zinc/02/18/35/1379021835.db2.gz	VVJPRNIXZAVCDO-IBGZPJMESA-N	0	3	340.442	3.151	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CC2(C1)CCN(CCCCC(F)(F)F)C2	ZINC001147541687	1379039312	/nfs/dbraw/zinc/03/93/12/1379039312.db2.gz	WXJKZIPHGDVNEO-UHFFFAOYSA-N	0	3	344.421	3.303	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)N1CC2(C1)CCN(CCc1ccccc1F)C2	ZINC001148095596	1379117003	/nfs/dbraw/zinc/11/70/03/1379117003.db2.gz	MMMHHRUOIKPECG-IAGOWNOFSA-N	0	3	344.474	3.361	20	30		EGEDHN
CC#CCCCC(=O)N1CC2(C1)CCN(Cc1ccc(F)cc1C)C2	ZINC001148111246	1379120404	/nfs/dbraw/zinc/12/04/04/1379120404.db2.gz	SNVWBWYCCZVGKP-UHFFFAOYSA-N	0	3	342.458	3.362	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC2(C1)CCN(CCOc1ccccc1)C2	ZINC001148126247	1379121933	/nfs/dbraw/zinc/12/19/33/1379121933.db2.gz	UNLAYMISRWCFFX-GOSISDBHSA-N	0	3	342.483	3.202	20	30		EGEDHN
C=CCCCC(=O)N1CC2(C1)CCN(Cc1sc(C)nc1C)C2	ZINC001148193658	1379131301	/nfs/dbraw/zinc/13/13/01/1379131301.db2.gz	BWIPOWBADOXEPH-UHFFFAOYSA-N	0	3	333.501	3.151	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cccc(C(F)F)c2)cc1	ZINC001148572850	1379215164	/nfs/dbraw/zinc/21/51/64/1379215164.db2.gz	NKKXJDAKGQSNJS-UHFFFAOYSA-N	0	3	329.350	3.015	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)C[C@H]2CCCc3ccccc32)c1	ZINC001148654838	1379234517	/nfs/dbraw/zinc/23/45/17/1379234517.db2.gz	BSEYSUUIMJTXBM-HXUWFJFHSA-N	0	3	347.462	3.274	20	30		EGEDHN
CCCCCCCCC(=O)NCCNCC(=O)N(CCC)CCC	ZINC001148727717	1379254741	/nfs/dbraw/zinc/25/47/41/1379254741.db2.gz	HTYRMFIWRAMCKK-UHFFFAOYSA-N	0	3	341.540	3.091	20	30		EGEDHN
CCCCCCCCCC(=O)NCCNCc1cccc(C(N)=O)c1	ZINC001148820209	1379275559	/nfs/dbraw/zinc/27/55/59/1379275559.db2.gz	FKLPTIRKYWELIZ-UHFFFAOYSA-N	0	3	347.503	3.132	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H](C)CCCc3ccccc3)C2)C1	ZINC001148851923	1379283942	/nfs/dbraw/zinc/28/39/42/1379283942.db2.gz	VYRXYNJEWBSTLF-IBGZPJMESA-N	0	3	338.495	3.203	20	30		EGEDHN
CN1CCC[C@](C)(NC(=O)c2ccc(C(C)(C)CCC#N)cc2)C1	ZINC001148912427	1379297640	/nfs/dbraw/zinc/29/76/40/1379297640.db2.gz	OAGDDYYOTHYYCW-FQEVSTJZSA-N	0	3	327.472	3.482	20	30		EGEDHN
Cc1ccsc1CCCC(=O)NCCNCc1ccc(C#N)cc1	ZINC001149231486	1379352644	/nfs/dbraw/zinc/35/26/44/1379352644.db2.gz	UOZJPZDOJBDUSW-UHFFFAOYSA-N	0	3	341.480	3.157	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2sccc2C(F)F)s1	ZINC001149377327	1379372453	/nfs/dbraw/zinc/37/24/53/1379372453.db2.gz	MAXVKRPMEKFSKJ-UHFFFAOYSA-N	0	3	341.408	3.138	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@H]1CN(CC2=CCCCC2)CCCO1	ZINC001150138766	1379501062	/nfs/dbraw/zinc/50/10/62/1379501062.db2.gz	DVABAEWKYCDENF-HKUYNNGSSA-N	0	3	334.504	3.296	20	30		EGEDHN
C[C@H]1CCN(Cc2ccccc2)C[C@@H]1NC(=O)Cc1cccc(C#N)c1	ZINC001150143987	1379502510	/nfs/dbraw/zinc/50/25/10/1379502510.db2.gz	WAAAUGCPFYIWRY-UWJYYQICSA-N	0	3	347.462	3.128	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)C[C@@H](C)c2cccc(F)c2)C1	ZINC001150282678	1379528850	/nfs/dbraw/zinc/52/88/50/1379528850.db2.gz	PHXGUXHKBHPZBR-VQIMIIECSA-N	0	3	348.462	3.103	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)C(C)=C2CCCC2)CC1	ZINC001151057147	1379656064	/nfs/dbraw/zinc/65/60/64/1379656064.db2.gz	LVBZZRXYZYGLEA-UHFFFAOYSA-N	0	3	334.504	3.440	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@@H]2CCC[C@H]2CCC)CC1	ZINC001151210248	1379677030	/nfs/dbraw/zinc/67/70/30/1379677030.db2.gz	RWCVCDRYQSAJJU-QZTJIDSGSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@H]2CC[C@@H]3C[C@@H]3CC2)CC1	ZINC001151225910	1379681319	/nfs/dbraw/zinc/68/13/19/1379681319.db2.gz	XWOKPNVBAFMNSH-REPLKXPHSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2ccc(C3CC3)s2)CC1	ZINC001151392375	1379710379	/nfs/dbraw/zinc/71/03/79/1379710379.db2.gz	IIZBGOOUURMNOG-UHFFFAOYSA-N	0	3	348.512	3.412	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@H]2CCCC(C)(C)C2)CC1	ZINC001151412680	1379714794	/nfs/dbraw/zinc/71/47/94/1379714794.db2.gz	JVZJIOWHYNLQCI-KRWDZBQOSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@@H](C)c2cccc(F)c2)CC1	ZINC001151413313	1379714855	/nfs/dbraw/zinc/71/48/55/1379714855.db2.gz	UYIMEXCNWPFYKJ-INIZCTEOSA-N	0	3	348.462	3.103	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)CC[C@H]2CCc3ccccc32)c1	ZINC001152041536	1379848833	/nfs/dbraw/zinc/84/88/33/1379848833.db2.gz	ORRCEPBAAJDUMW-HXUWFJFHSA-N	0	3	347.462	3.274	20	30		EGEDHN
CCCSCC(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)cc1	ZINC001152120038	1379866069	/nfs/dbraw/zinc/86/60/69/1379866069.db2.gz	XGQPUXWQIAFUBU-OAHLLOKOSA-N	0	3	333.501	3.028	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC[C@@H](C)N(CC)Cc1cccc(OC)c1	ZINC001152233806	1379892307	/nfs/dbraw/zinc/89/23/07/1379892307.db2.gz	BFOZRLSFMFYZIK-SJORKVTESA-N	0	3	348.487	3.003	20	30		EGEDHN
C=CCCC(=O)NC[C@@H](C)N(CC)C[C@H](O)c1ccc(CC)cc1	ZINC001152312785	1379905498	/nfs/dbraw/zinc/90/54/98/1379905498.db2.gz	BHPPKKWZROHXSV-APWZRJJASA-N	0	3	332.488	3.075	20	30		EGEDHN
Cc1ccc(CN2CC[C@H](NC(=O)[C@H](CC#N)c3ccccc3)C2)cc1	ZINC001152420583	1379931127	/nfs/dbraw/zinc/93/11/27/1379931127.db2.gz	ZLRHJYKYQHCUED-LEWJYISDSA-N	0	3	347.462	3.383	20	30		EGEDHN
CCc1oc2ccccc2c1C(=O)NCCNCc1cccc(C#N)c1	ZINC001152626421	1379958696	/nfs/dbraw/zinc/95/86/96/1379958696.db2.gz	IVAOVLFDJZUVRZ-UHFFFAOYSA-N	0	3	347.418	3.386	20	30		EGEDHN
CCN(C/C=C/c1ccccc1)[C@H](C)CNC(=O)c1ccc(C#N)[nH]1	ZINC001152775332	1379980604	/nfs/dbraw/zinc/98/06/04/1379980604.db2.gz	RGBNXCZSVXQHBD-OJXHRBAXSA-N	0	3	336.439	3.040	20	30		EGEDHN
CCN(Cc1cc(C)sc1C)[C@H](C)CNC(=O)c1ccc(C#N)[nH]1	ZINC001152794328	1379981936	/nfs/dbraw/zinc/98/19/36/1379981936.db2.gz	QSXYZBGURVYISC-GFCCVEGCSA-N	0	3	344.484	3.205	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H](C)N(CC)Cc1ccc(OC)c(F)c1	ZINC001152867051	1379988101	/nfs/dbraw/zinc/98/81/01/1379988101.db2.gz	FSSBCGLTCDJURF-MRXNPFEDSA-N	0	3	348.462	3.355	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H](C)N(CC)C[C@H](OC)c1ccccc1	ZINC001152873703	1379989080	/nfs/dbraw/zinc/98/90/80/1379989080.db2.gz	ROLLMMLETBFNRC-QUCCMNQESA-N	0	3	344.499	3.394	20	30		EGEDHN
C#CCCCC(=O)NC[C@@H](C)N(CC)C[C@H](OC)c1ccccc1	ZINC001153025397	1380010410	/nfs/dbraw/zinc/01/04/10/1380010410.db2.gz	UUDXCYIDMLIIDF-MJGOQNOKSA-N	0	3	330.472	3.004	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)[C@@H]1CCC(F)(F)C1	ZINC001153748866	1380121906	/nfs/dbraw/zinc/12/19/06/1380121906.db2.gz	HSMDEEDBFYCALR-RHSMWYFYSA-N	0	3	349.425	3.320	20	30		EGEDHN
CC1(C)CCCC[C@@H]1CC(=O)NCCNCc1ccc(C#N)s1	ZINC001153836653	1380140694	/nfs/dbraw/zinc/14/06/94/1380140694.db2.gz	DCEBIUZDYBVUIR-CQSZACIVSA-N	0	3	333.501	3.432	20	30		EGEDHN
CCc1ccc(C(=O)NCCNCc2ccc(C#N)cc2)cc1CC	ZINC001154013469	1380179880	/nfs/dbraw/zinc/17/98/80/1380179880.db2.gz	MFHZYOUIALRGAW-UHFFFAOYSA-N	0	3	335.451	3.203	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1cccc2c(C)c(C)[nH]c21	ZINC001154059212	1380193330	/nfs/dbraw/zinc/19/33/30/1380193330.db2.gz	OQEZAMHYBWAORX-CQSZACIVSA-N	0	3	325.456	3.248	20	30		EGEDHN
CCCCCC[C@@H](CC)C(=O)NC[C@@H](C)N(CC)CC#CCOC	ZINC001154626154	1380320235	/nfs/dbraw/zinc/32/02/35/1380320235.db2.gz	SHWSQOJBTSADBM-RTBURBONSA-N	0	3	338.536	3.459	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)[C@@H](C)C(F)(F)F	ZINC001154648591	1380323473	/nfs/dbraw/zinc/32/34/73/1380323473.db2.gz	HHLQJRGHQAWSFE-CHWSQXEVSA-N	0	3	341.377	3.083	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@@H](C)N(CC)C[C@@H](O)c1ccccc1	ZINC001154751187	1380345916	/nfs/dbraw/zinc/34/59/16/1380345916.db2.gz	QIZIKZIBWLHFGK-ZHALLVOQSA-N	0	3	332.488	3.149	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H](C)N(CC)C[C@@H](O)c1ccc(CC)cc1	ZINC001154957584	1380381148	/nfs/dbraw/zinc/38/11/48/1380381148.db2.gz	IQEGNCPKHBZEHI-YLJYHZDGSA-N	0	3	346.515	3.465	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)[C@H]1CC12CCC2	ZINC001155502755	1380461628	/nfs/dbraw/zinc/46/16/28/1380461628.db2.gz	CHXXLGGJQLAXMR-RHSMWYFYSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=CCCC(=O)NCCCNCc1ccc(F)cc1Br	ZINC001155586667	1380470783	/nfs/dbraw/zinc/47/07/83/1380470783.db2.gz	DUEBEEFQFWPRHK-UHFFFAOYSA-N	0	3	343.240	3.150	20	30		EGEDHN
C=CCCC(=O)NCCCNCc1sccc1Br	ZINC001155601905	1380472352	/nfs/dbraw/zinc/47/23/52/1380472352.db2.gz	DJMQDDRWDUSOFS-UHFFFAOYSA-N	0	3	331.279	3.073	20	30		EGEDHN
N#Cc1cc(C(F)(F)n2nc(CN)c3ccccc32)cnc1Cl	ZINC001156856289	1380696927	/nfs/dbraw/zinc/69/69/27/1380696927.db2.gz	ZZHKJUKJHMBMDG-UHFFFAOYSA-N	0	3	333.729	3.013	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1ccc(OC2CCC2)cc1	ZINC001157013518	1380751295	/nfs/dbraw/zinc/75/12/95/1380751295.db2.gz	KLDPZEGSVMUQMW-MRXNPFEDSA-N	0	3	328.456	3.081	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@]1(C)CCc2ccccc2C1	ZINC001157395225	1380867137	/nfs/dbraw/zinc/86/71/37/1380867137.db2.gz	NHMFARZVCQPFMW-DYESRHJHSA-N	0	3	326.484	3.032	20	30		EGEDHN
CC(C)C#CC(=O)NCCCNCc1cccc(Cl)c1Cl	ZINC001157639029	1380988176	/nfs/dbraw/zinc/98/81/76/1380988176.db2.gz	VOCAMJVLFATSCT-UHFFFAOYSA-N	0	3	327.255	3.249	20	30		EGEDHN
O=C(C#CC1CC1)NCCCNCc1c(Cl)oc2ccccc21	ZINC001157682839	1381000583	/nfs/dbraw/zinc/00/05/83/1381000583.db2.gz	RYKGMWDKTDHYIM-UHFFFAOYSA-N	0	3	330.815	3.096	20	30		EGEDHN
C=CCCC(=O)N1CCCC[C@@H]1CN(C)CCc1csc(C)n1	ZINC001157705974	1381009299	/nfs/dbraw/zinc/00/92/99/1381009299.db2.gz	PXYFJYQZNTWGSP-QGZVFWFLSA-N	0	3	335.517	3.273	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1ccc([C@@H]2C[C@@H]2C)o1	ZINC001157912794	1381068695	/nfs/dbraw/zinc/06/86/95/1381068695.db2.gz	YLGSJNRNWQLFPK-CMPLNLGQSA-N	0	3	341.249	3.021	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)Cc1ccc2cccnc2c1	ZINC001158118159	1381133347	/nfs/dbraw/zinc/13/33/47/1381133347.db2.gz	UEDIMSDCOHOBIY-LJQANCHMSA-N	0	3	337.467	3.276	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)C[C@H](C)c1c(C)noc1C	ZINC001158149120	1381142506	/nfs/dbraw/zinc/14/25/06/1381142506.db2.gz	VIAYATRUZOWEFQ-WMLDXEAASA-N	0	3	333.476	3.284	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc(-c2ccccc2)no1	ZINC001158180358	1381150177	/nfs/dbraw/zinc/15/01/77/1381150177.db2.gz	JHDATAIBFFSTJE-QGZVFWFLSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCCC[C@@H]1CN(C)CCOCC1CC1	ZINC001158370189	1381221126	/nfs/dbraw/zinc/22/11/26/1381221126.db2.gz	QVPRAWDNEJZZRN-IEBWSBKVSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)C1CCC(F)CC1	ZINC001158438021	1381247466	/nfs/dbraw/zinc/24/74/66/1381247466.db2.gz	MJAFCBBFBHORJR-DAWZGUTISA-N	0	3	340.483	3.030	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc(C2CC2)nc1C	ZINC001158491118	1381266373	/nfs/dbraw/zinc/26/63/73/1381266373.db2.gz	JZMOHHTXCGZJPL-QGZVFWFLSA-N	0	3	327.472	3.380	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cccc(N2CCCC2)c1	ZINC001158645928	1381335308	/nfs/dbraw/zinc/33/53/08/1381335308.db2.gz	DNRMLNKDQPMERB-HXUWFJFHSA-N	0	3	341.499	3.399	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H](C)Oc1ccc(F)cc1	ZINC001158836777	1381423394	/nfs/dbraw/zinc/42/33/94/1381423394.db2.gz	CJSUMNKSWFKZCX-DOTOQJQBSA-N	0	3	334.435	3.092	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H](C)c1cccc(OC)c1	ZINC001158914974	1381463008	/nfs/dbraw/zinc/46/30/08/1381463008.db2.gz	XKZQHWUAKGINSY-FUHWJXTLSA-N	0	3	330.472	3.298	20	30		EGEDHN
C=CCCOCC(=O)N1CCCC[C@@H]1CN(C)Cc1ccccc1	ZINC001158943232	1381477396	/nfs/dbraw/zinc/47/73/96/1381477396.db2.gz	SICVXDQXLYXSRB-LJQANCHMSA-N	0	3	330.472	3.092	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NCCC1=CCN(Cc2ccsc2)CC1	ZINC001159488969	1381806744	/nfs/dbraw/zinc/80/67/44/1381806744.db2.gz	XINGGXMJPKXYIG-MRXNPFEDSA-N	0	3	348.512	3.368	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCC1=CCN(CCCCC(F)(F)F)CC1	ZINC001159587289	1381836844	/nfs/dbraw/zinc/83/68/44/1381836844.db2.gz	MUCTTWFRIJZQNE-CYBMUJFWSA-N	0	3	331.382	3.017	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)CO[C@@H]2CCCC[C@H]2CC)CC1	ZINC001160107344	1381999276	/nfs/dbraw/zinc/99/92/76/1381999276.db2.gz	NMQUMBHPBBBIBI-WOJBJXKFSA-N	0	3	346.515	3.134	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H]2CC[C@H](c3ccccc3)O2)CC1	ZINC001160163062	1382021097	/nfs/dbraw/zinc/02/10/97/1382021097.db2.gz	MHTNFCMDZSNXRO-UXHICEINSA-N	0	3	340.467	3.231	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2nc(C(C)(C)C)cs2)CC1	ZINC001160415694	1382097985	/nfs/dbraw/zinc/09/79/85/1382097985.db2.gz	BRKIVOVPRJHZAZ-UHFFFAOYSA-N	0	3	333.501	3.379	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc(-c3ccccc3)n[nH]2)CC1	ZINC001160628641	1382156471	/nfs/dbraw/zinc/15/64/71/1382156471.db2.gz	RQNHTLOQDYVPAM-UHFFFAOYSA-N	0	3	336.439	3.015	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cccc3ncccc32)CC1	ZINC001160815803	1382206349	/nfs/dbraw/zinc/20/63/49/1382206349.db2.gz	DDIRZIGPQSDFLA-UHFFFAOYSA-N	0	3	333.435	3.010	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc(C(F)(F)F)nc2)CC1	ZINC001160845654	1382214877	/nfs/dbraw/zinc/21/48/77/1382214877.db2.gz	PEGDIWAZQNVLEP-UHFFFAOYSA-N	0	3	339.361	3.038	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCC1=CCN(C[C@@H](O)c2ccccc2)CC1	ZINC001160888368	1382225838	/nfs/dbraw/zinc/22/58/38/1382225838.db2.gz	RYZJYKABVVBMLL-LJQANCHMSA-N	0	3	342.483	3.071	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCC1=CCN(CCOCC2CCC2)CC1	ZINC001160940711	1382243217	/nfs/dbraw/zinc/24/32/17/1382243217.db2.gz	FXBYDBYPQQKWMD-QZTJIDSGSA-N	0	3	348.531	3.400	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCC1=CCN(Cc2cnccc2C)CC1	ZINC001160941845	1382244192	/nfs/dbraw/zinc/24/41/92/1382244192.db2.gz	RQJLPMMMSJXOTJ-AEFFLSMTSA-N	0	3	341.499	3.487	20	30		EGEDHN
C=CCN1CCC[C@H]1CNc1nc(Cl)nc2[nH]cc(Cl)c21	ZINC001160951603	1382249086	/nfs/dbraw/zinc/24/90/86/1382249086.db2.gz	JNKPJSJUTDHIOJ-VIFPVBQESA-N	0	3	326.231	3.279	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)[C@@H]1CCCC[C@@H]1C(F)(F)F	ZINC001160996624	1382266938	/nfs/dbraw/zinc/26/69/38/1382266938.db2.gz	MNDKYBIKFCXMGI-NEPJUHHUSA-N	0	3	326.790	3.204	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc(C)cc2Cl)CC1	ZINC001161291438	1382361539	/nfs/dbraw/zinc/36/15/39/1382361539.db2.gz	GMBGIMKJRAGQRQ-UHFFFAOYSA-N	0	3	330.859	3.424	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc3cc(F)ccc3o2)CC1	ZINC001161363712	1382384119	/nfs/dbraw/zinc/38/41/19/1382384119.db2.gz	KXPIHDDXSIRJAO-UHFFFAOYSA-N	0	3	340.398	3.347	20	30		EGEDHN
CCC(CC)[C@@H](C)C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001161426534	1382405796	/nfs/dbraw/zinc/40/57/96/1382405796.db2.gz	IMGPDGFSUSJXIG-CQSZACIVSA-N	0	3	333.451	3.366	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C[C@H]2OCCc3ccsc32)CC1	ZINC001161734369	1382492223	/nfs/dbraw/zinc/49/22/23/1382492223.db2.gz	ZJGPSKJTEPEAQG-QGZVFWFLSA-N	0	3	346.496	3.076	20	30		EGEDHN
CC(C)(C)C(=O)NCCC1=CCN(Cc2ccc(C#N)cc2)CC1	ZINC001161755388	1382495684	/nfs/dbraw/zinc/49/56/84/1382495684.db2.gz	VKARKHGRORNNQP-UHFFFAOYSA-N	0	3	325.456	3.243	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)c1csc(C(F)(F)F)c1	ZINC001161788996	1382506328	/nfs/dbraw/zinc/50/63/28/1382506328.db2.gz	DFNVOSQEPIVHMS-UHFFFAOYSA-N	0	3	326.771	3.229	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)Cc2ccc(OC(C)C)cc2)CC1	ZINC001161925079	1382555465	/nfs/dbraw/zinc/55/54/65/1382555465.db2.gz	WQZXEADAPQORAH-UHFFFAOYSA-N	0	3	342.483	3.341	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@@H](CC)CCCC)(COC)CC1	ZINC001162142125	1382637605	/nfs/dbraw/zinc/63/76/05/1382637605.db2.gz	GQKHEPWWAPBHGI-SFHVURJKSA-N	0	3	336.520	3.071	20	30		EGEDHN
CC(C)CC1(C(=O)NCCCNCc2ccccc2C#N)CCC1	ZINC001162245572	1382670503	/nfs/dbraw/zinc/67/05/03/1382670503.db2.gz	ANNLQBQQBLZTNA-UHFFFAOYSA-N	0	3	327.472	3.371	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@@]2(C)CCC[C@@H]2CC)(COC)CC1	ZINC001162327054	1382730694	/nfs/dbraw/zinc/73/06/94/1382730694.db2.gz	OFKYUIKZDNKQRW-ICSRJNTNSA-N	0	3	348.531	3.071	20	30		EGEDHN
C#CCN1CCC(CNC(=O)[C@@H](C)CC2CCCCC2)(COC)CC1	ZINC001162513258	1382778409	/nfs/dbraw/zinc/77/84/09/1382778409.db2.gz	JNWSIKGRUXSCCI-SFHVURJKSA-N	0	3	348.531	3.071	20	30		EGEDHN
C#CCN1CCC(CNC(=O)C[C@H](C)C2CCCCC2)(COC)CC1	ZINC001162528018	1382781887	/nfs/dbraw/zinc/78/18/87/1382781887.db2.gz	PKHVKTYYDVWLBV-SFHVURJKSA-N	0	3	348.531	3.071	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@H]2CCCC[C@H]2CC)(COC)CC1	ZINC001162558793	1382789486	/nfs/dbraw/zinc/78/94/86/1382789486.db2.gz	RSLKIULWJZBMNQ-MOPGFXCFSA-N	0	3	348.531	3.071	20	30		EGEDHN
C#CCN1CCC(CNC(=O)CC2CCC(C)(C)CC2)(COC)CC1	ZINC001162632430	1382816082	/nfs/dbraw/zinc/81/60/82/1382816082.db2.gz	BKZFECIMBOURRF-UHFFFAOYSA-N	0	3	348.531	3.071	20	30		EGEDHN
C[C@@H](N)c1nc2ccccc2n1-c1ccc(C#N)c(C(F)(F)F)n1	ZINC001162758296	1382860904	/nfs/dbraw/zinc/86/09/04/1382860904.db2.gz	HWLXJBYVBXFKPH-SECBINFHSA-N	0	3	331.301	3.331	20	30		EGEDHN
C[C@H](N)c1nc2ccccc2n1-c1nc(C(F)(F)F)ccc1C#N	ZINC001162759953	1382862090	/nfs/dbraw/zinc/86/20/90/1382862090.db2.gz	KFQCDJIZVCZKBG-VIFPVBQESA-N	0	3	331.301	3.331	20	30		EGEDHN
C[C@@H](N)c1nc2ccccc2n1-c1cnc(C#N)c(C(F)(F)F)c1	ZINC001162765783	1382865871	/nfs/dbraw/zinc/86/58/71/1382865871.db2.gz	KCYZSDIDCZQIFK-SECBINFHSA-N	0	3	331.301	3.331	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C1CC2(CCC2)C1	ZINC001162892566	1382907848	/nfs/dbraw/zinc/90/78/48/1382907848.db2.gz	PXZGZTBEJHWNLX-UHFFFAOYSA-N	0	3	338.495	3.251	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CCC[C@H](C)C1	ZINC001162906301	1382911721	/nfs/dbraw/zinc/91/17/21/1382911721.db2.gz	JDOGZOCSKHNCGJ-ICSRJNTNSA-N	0	3	326.484	3.107	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@H]1C[C@@]1(C)CC	ZINC001162971165	1382932920	/nfs/dbraw/zinc/93/29/20/1382932920.db2.gz	ZIROAZUOUUTCSK-TZIWHRDSSA-N	0	3	326.484	3.107	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H](CC)CC(C)C	ZINC001162977011	1382934240	/nfs/dbraw/zinc/93/42/40/1382934240.db2.gz	AZPLIINNFYVCAQ-FQEVSTJZSA-N	0	3	328.500	3.353	20	30		EGEDHN
N#Cc1cnc2nc(Cl)ccc2c1N[C@@H]1CNCc2ccsc21	ZINC001163221723	1382996260	/nfs/dbraw/zinc/99/62/60/1382996260.db2.gz	XMDDGFTWBOMGEH-GFCCVEGCSA-N	0	3	341.827	3.473	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)NCCC1(CNCC#Cc2ccccc2Cl)CC1	ZINC001163238530	1383002856	/nfs/dbraw/zinc/00/28/56/1383002856.db2.gz	YYSMZMQIPUQGJI-NVXWUHKLSA-N	0	3	344.886	3.224	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)C[C@H]2C=CCC2)CC1	ZINC001163369101	1383034221	/nfs/dbraw/zinc/03/42/21/1383034221.db2.gz	FNZDVKIVDYPYMI-AWEZNQCLSA-N	0	3	341.293	3.127	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCC1(CN[C@H](C)c2cc(F)ccc2F)CC1	ZINC001163842388	1383128340	/nfs/dbraw/zinc/12/83/40/1383128340.db2.gz	YRZZJIXZNZEZDS-CHWSQXEVSA-N	0	3	335.398	3.062	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCCNCc1nc2cc(C)ccc2s1	ZINC001163953039	1383139075	/nfs/dbraw/zinc/13/90/75/1383139075.db2.gz	FQOVTGUCNVGLSO-UHFFFAOYSA-N	0	3	331.485	3.413	20	30		EGEDHN
N#Cc1ccc(F)c(CNCC2(CCNC(=O)C=C3CCC3)CC2)c1	ZINC001164037408	1383149090	/nfs/dbraw/zinc/14/90/90/1383149090.db2.gz	VRMRTKVMJHRAOR-UHFFFAOYSA-N	0	3	341.430	3.184	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)C(F)=C(C)C)CC1	ZINC001164069774	1383152805	/nfs/dbraw/zinc/15/28/05/1383152805.db2.gz	CVUUMXQEKSVQMS-UHFFFAOYSA-N	0	3	333.245	3.035	20	30		EGEDHN
C#CCCCCC(=O)NCCC1(CNCc2c(C)onc2CC)CC1	ZINC001164166184	1383161979	/nfs/dbraw/zinc/16/19/79/1383161979.db2.gz	QONKKFIMKMYBKI-UHFFFAOYSA-N	0	3	345.487	3.115	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCCNCc1cnc(-c2ccccc2)o1	ZINC001164223880	1383168077	/nfs/dbraw/zinc/16/80/77/1383168077.db2.gz	XFUAISUQZSUESN-HOTGVXAUSA-N	0	3	341.455	3.396	20	30		EGEDHN
CC(C)(C)C#CC(=O)NCCC1(CNCc2ccc(F)cc2F)CC1	ZINC001164483081	1383191429	/nfs/dbraw/zinc/19/14/29/1383191429.db2.gz	ZDFQZZDECYWIHB-UHFFFAOYSA-N	0	3	348.437	3.390	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccnn2[C@@H](C)CC)CC1	ZINC001165244382	1383256394	/nfs/dbraw/zinc/25/63/94/1383256394.db2.gz	DXZMUGWPYDGEKO-AWEZNQCLSA-N	0	3	338.883	3.096	20	30		EGEDHN
C=C(C)CCC(=O)NCCC1(CNCc2oc(CC)nc2C)CC1	ZINC001165258720	1383259495	/nfs/dbraw/zinc/25/94/95/1383259495.db2.gz	NHMQLUSSQVTKHM-UHFFFAOYSA-N	0	3	333.476	3.278	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C[C@H]2CCC[C@H](OC)C2)CC1	ZINC001165440522	1383297124	/nfs/dbraw/zinc/29/71/24/1383297124.db2.gz	ILXBUZVKSQTZLZ-HOTGVXAUSA-N	0	3	342.911	3.210	20	30		EGEDHN
C=CCCCC(=O)NCCCNCc1ccccc1Br	ZINC001165535676	1383308064	/nfs/dbraw/zinc/30/80/64/1383308064.db2.gz	VPBGABSEHUHONC-UHFFFAOYSA-N	0	3	339.277	3.401	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1ccc(Cl)cc1C	ZINC001165722161	1383332663	/nfs/dbraw/zinc/33/26/63/1383332663.db2.gz	UEMAXZGCOYOMQY-UHFFFAOYSA-N	0	3	345.668	3.267	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCC1(CNCc2cccc(OC)n2)CC1	ZINC001166544737	1383436358	/nfs/dbraw/zinc/43/63/58/1383436358.db2.gz	GSSBXXJLXIXJNR-UHFFFAOYSA-N	0	3	345.487	3.069	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1cc[nH]c1C1CCC1	ZINC001166620869	1383448899	/nfs/dbraw/zinc/44/88/99/1383448899.db2.gz	QMMDJCYWUSSEKZ-UHFFFAOYSA-N	0	3	336.439	3.064	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001166696169	1383462828	/nfs/dbraw/zinc/46/28/28/1383462828.db2.gz	XJNNQXKNSGPQGW-DLBZAZTESA-N	0	3	339.483	3.393	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCC1(CNCc2oc(CC)nc2C)CC1	ZINC001166703975	1383463853	/nfs/dbraw/zinc/46/38/53/1383463853.db2.gz	LUEBDYQJTLZXCQ-GJZGRUSLSA-N	0	3	347.503	3.380	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCCC1(CNCc2cccc(OC)n2)CC1	ZINC001166748351	1383470868	/nfs/dbraw/zinc/47/08/68/1383470868.db2.gz	ZSZCOIYREBMAMQ-INIZCTEOSA-N	0	3	345.487	3.069	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCC2(CNCc3nc(C)c(C)s3)CC2)C1	ZINC001167130254	1383547548	/nfs/dbraw/zinc/54/75/48/1383547548.db2.gz	NKGXASLLJXPGFJ-UHFFFAOYSA-N	0	3	347.528	3.492	20	30		EGEDHN
Cc1ccc(C(=O)NCCCNCc2ccccc2C#N)c(Cl)c1	ZINC001167170809	1383557962	/nfs/dbraw/zinc/55/79/62/1383557962.db2.gz	IJOKEFQLXKUWCH-UHFFFAOYSA-N	0	3	341.842	3.430	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)CCCC(F)(F)F)CC1	ZINC001167311756	1383593129	/nfs/dbraw/zinc/59/31/29/1383593129.db2.gz	BFBWQUDXYUASKP-UHFFFAOYSA-N	0	3	326.790	3.348	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCC1(CNCc2c(C)noc2C)CC1	ZINC001167339787	1383602815	/nfs/dbraw/zinc/60/28/15/1383602815.db2.gz	MFCWZXBEHNLVTN-UHFFFAOYSA-N	0	3	333.476	3.270	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc(F)cc2F)CC1	ZINC001167946595	1383776325	/nfs/dbraw/zinc/77/63/25/1383776325.db2.gz	QSRGAWVEXBGJLW-UHFFFAOYSA-N	0	3	328.790	3.207	20	30		EGEDHN
C=CC1(CC(=O)NCCCNCc2cc(OC)ccn2)CCCCC1	ZINC001168182611	1383836488	/nfs/dbraw/zinc/83/64/88/1383836488.db2.gz	HSPACVFEBNMOAL-UHFFFAOYSA-N	0	3	345.487	3.213	20	30		EGEDHN
CC(C)N1CCN(Cc2ccc(NCCCCC#N)c(F)c2)CC1	ZINC001168436713	1383905949	/nfs/dbraw/zinc/90/59/49/1383905949.db2.gz	SAYSIRMUXJTJDI-UHFFFAOYSA-N	0	3	332.467	3.457	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@H](OC)C2CCCCC2)CC1	ZINC001168700058	1383972156	/nfs/dbraw/zinc/97/21/56/1383972156.db2.gz	FWICNVWJEVOPJV-MRXNPFEDSA-N	0	3	342.911	3.210	20	30		EGEDHN
CC[C@H]1CN(CC)CCN1Cc1cc(C#N)ccc1Br	ZINC001307765748	1384028659	/nfs/dbraw/zinc/02/86/59/1384028659.db2.gz	JTMBEHGECLDWLO-HNNXBMFYSA-N	0	3	336.277	3.237	20	30		EGEDHN
CC(=O)CCCC(=O)N[C@@H](C)CCCCNCc1ccccc1C#N	ZINC001169133098	1384112018	/nfs/dbraw/zinc/11/20/18/1384112018.db2.gz	RRWWFJRBJUUYMJ-INIZCTEOSA-N	0	3	343.471	3.082	20	30		EGEDHN
CCOC(=O)[C@@H]1CC[C@H](N(CCC#N)C2CCCCCCC2)CO1	ZINC001169394249	1384143298	/nfs/dbraw/zinc/14/32/98/1384143298.db2.gz	WKMDNQRGCGQRLE-ROUUACIJSA-N	0	3	336.476	3.426	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@H]1CCCC[C@H]1CC	ZINC001169720864	1384178234	/nfs/dbraw/zinc/17/82/34/1384178234.db2.gz	WJUGNVSKCURBSJ-KGLIPLIRSA-N	0	3	331.298	3.207	20	30		EGEDHN
N#Cc1csc(CN[C@H]2CCCN(C(=O)c3ccccc3)C2)c1	ZINC001169757156	1384183247	/nfs/dbraw/zinc/18/32/47/1384183247.db2.gz	OIXKEVOANPYAOI-INIZCTEOSA-N	0	3	325.437	3.014	20	30		EGEDHN
Cc1[nH]ccc1C(=O)N[C@H](C)CCCCNCc1ccccc1C#N	ZINC001170069964	1384228720	/nfs/dbraw/zinc/22/87/20/1384228720.db2.gz	ZDHGFSNRNABUMO-OAHLLOKOSA-N	0	3	338.455	3.273	20	30		EGEDHN
Cc1cc(NC(=O)N[C@H]2C[C@H](C)N(Cc3ccccc3)C2)ncc1C#N	ZINC001311069913	1384255491	/nfs/dbraw/zinc/25/54/91/1384255491.db2.gz	BYVDDMPABOYTCT-YJBOKZPZSA-N	0	3	349.438	3.046	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H](C)CCCCNCc1cc2n(n1)CCC2	ZINC001170998083	1384427125	/nfs/dbraw/zinc/42/71/25/1384427125.db2.gz	ONGUGGYPGGRKFU-MRXNPFEDSA-N	0	3	346.519	3.196	20	30		EGEDHN
CC(C)C[C@H]([NH2+][C@@H]1CCc2cc(Cl)cc(Cl)c2C1)C(=O)N[O-]	ZINC001171073250	1384441242	/nfs/dbraw/zinc/44/12/42/1384441242.db2.gz	CGXPGIVDLVYPEZ-DOMZBBRYSA-N	0	3	345.270	3.360	20	30		EGEDHN
CC[C@H](C)[C@H]([NH2+][C@H]1CCc2cc(Cl)cc(Cl)c2C1)C(=O)N[O-]	ZINC001171074941	1384441831	/nfs/dbraw/zinc/44/18/31/1384441831.db2.gz	WDWNJUAEPLOXJO-FMSQNYNMSA-N	0	3	345.270	3.360	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1CCN(CCc2cccs2)CC1	ZINC001171221764	1384471883	/nfs/dbraw/zinc/47/18/83/1384471883.db2.gz	UJZHFGWQDLOPRA-QGZVFWFLSA-N	0	3	339.508	3.411	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1C[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C1	ZINC001171227800	1384474230	/nfs/dbraw/zinc/47/42/30/1384474230.db2.gz	AKECPYPEHBLMQO-RKVPGOIHSA-N	0	3	343.471	3.334	20	30		EGEDHN
COC(=O)c1ccc(C2CN([C@@H](C)Cc3cccc(C#N)c3)C2)cc1	ZINC001171232043	1384475649	/nfs/dbraw/zinc/47/56/49/1384475649.db2.gz	PDBUNOZSHBTKEH-HNNXBMFYSA-N	0	3	334.419	3.375	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)[C@H]1CCC1(F)F	ZINC001171446261	1384526508	/nfs/dbraw/zinc/52/65/08/1384526508.db2.gz	YNHRTOKMKNNIFM-RHSMWYFYSA-N	0	3	349.425	3.368	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1coc(C2CC2)n1	ZINC001316883754	1384667005	/nfs/dbraw/zinc/66/70/05/1384667005.db2.gz	YTCGNKXDSOIFOE-WFASDCNBSA-N	0	3	337.851	3.277	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1coc(C2CC2)n1	ZINC001316883751	1384667282	/nfs/dbraw/zinc/66/72/82/1384667282.db2.gz	YTCGNKXDSOIFOE-DOMZBBRYSA-N	0	3	337.851	3.277	20	30		EGEDHN
CC[C@@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C#N)C1)c1cccnc1	ZINC001172973692	1384893896	/nfs/dbraw/zinc/89/38/96/1384893896.db2.gz	GVBXYIZNGPMTTI-IXDOHACOSA-N	0	3	344.459	3.414	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H](N2CCCC(F)(F)CC2)C[C@H]1C#N	ZINC001172979946	1384894478	/nfs/dbraw/zinc/89/44/78/1384894478.db2.gz	IXPMQOMFXBJEMX-KBPBESRZSA-N	0	3	343.418	3.399	20	30		EGEDHN
N#CCC1CCC(N2CC[C@@H](n3cc(Br)cn3)C2)CC1	ZINC001173341487	1384962247	/nfs/dbraw/zinc/96/22/47/1384962247.db2.gz	XALZCWBZKOLUPW-PESDSKBTSA-N	0	3	337.265	3.365	20	30		EGEDHN
CC1(C#N)CCC(N2CCN(CCOc3ccccc3)CC2)CC1	ZINC001173596526	1384984360	/nfs/dbraw/zinc/98/43/60/1384984360.db2.gz	ZNSSZOWXKBBMAQ-UHFFFAOYSA-N	0	3	327.472	3.155	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)C2(CC)CCC2)CC1	ZINC001317218247	1384998243	/nfs/dbraw/zinc/99/82/43/1384998243.db2.gz	AXJMTRJMWMDBON-UHFFFAOYSA-N	0	3	343.309	3.492	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1c(C)nn(C(C)(C)C)c1C	ZINC001317394100	1385112340	/nfs/dbraw/zinc/11/23/40/1385112340.db2.gz	FWNMGHBFWGQCKF-GFCCVEGCSA-N	0	3	340.899	3.105	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H](C)CCCCN[C@H](C)c1nnc(C)[nH]1	ZINC001174673494	1385132536	/nfs/dbraw/zinc/13/25/36/1385132536.db2.gz	XSVLDFJXUXXXFA-ZIAGYGMSSA-N	0	3	335.496	3.041	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H](C)CCCCN[C@H](C)c1nnc(C)[nH]1	ZINC001174694412	1385135583	/nfs/dbraw/zinc/13/55/83/1385135583.db2.gz	ODJXRADIKHDHQY-HZPDHXFCSA-N	0	3	347.507	3.022	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H](C)CCCCNCc1nccn1CC	ZINC001174848716	1385159341	/nfs/dbraw/zinc/15/93/41/1385159341.db2.gz	GQRXCYCDBGDNBU-IRXDYDNUSA-N	0	3	334.508	3.270	20	30		EGEDHN
C=CCCCC(=O)N[C@H](C)CCCCNCc1nnc(C(C)C)[nH]1	ZINC001174988178	1385179945	/nfs/dbraw/zinc/17/99/45/1385179945.db2.gz	VJXLBMQQTYKMGD-OAHLLOKOSA-N	0	3	335.496	3.049	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1sccc1C1CC1	ZINC001175339631	1385257400	/nfs/dbraw/zinc/25/74/00/1385257400.db2.gz	MWZFDAWOXJIDQZ-UHFFFAOYSA-N	0	3	343.290	3.244	20	30		EGEDHN
CCN1CCN(c2ccc(Nc3ccc(C#N)c(OC)c3)cc2)CC1	ZINC001175781462	1385403744	/nfs/dbraw/zinc/40/37/44/1385403744.db2.gz	IICOSFSNAGSTMM-UHFFFAOYSA-N	0	3	336.439	3.452	20	30		EGEDHN
C=CC[C@@H](C(=O)NCCCNCc1ncc(C)s1)c1ccccc1	ZINC001176697268	1385662215	/nfs/dbraw/zinc/66/22/15/1385662215.db2.gz	IFNOAGSPKIDVIX-QGZVFWFLSA-N	0	3	343.496	3.407	20	30		EGEDHN
C=CCC1(C(=O)NCCCNCc2cccc(OC)n2)CCCCC1	ZINC001176785857	1385696669	/nfs/dbraw/zinc/69/66/69/1385696669.db2.gz	PWXLTVPAWWUYDQ-UHFFFAOYSA-N	0	3	345.487	3.213	20	30		EGEDHN
N#Cc1ccc(F)c(CNCC2(NC(=O)C3CCC3)CCCC2)c1	ZINC001318612317	1385794799	/nfs/dbraw/zinc/79/47/99/1385794799.db2.gz	BNNIJHNFUNLMHY-UHFFFAOYSA-N	0	3	329.419	3.016	20	30		EGEDHN
CC(C)c1occc1C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001177234312	1385878777	/nfs/dbraw/zinc/87/87/77/1385878777.db2.gz	IETIBJURSXRRKQ-UHFFFAOYSA-N	0	3	343.402	3.323	20	30		EGEDHN
CC(C)(C)C1CC(C(=O)NCCCNCc2ccccc2C#N)C1	ZINC001177251672	1385884878	/nfs/dbraw/zinc/88/48/78/1385884878.db2.gz	OWFVHCQJHKSJHA-UHFFFAOYSA-N	0	3	327.472	3.226	20	30		EGEDHN
CCCc1nc(CNCCCCCCNC(=O)[C@H](C)C#N)cs1	ZINC001178053303	1386117839	/nfs/dbraw/zinc/11/78/39/1386117839.db2.gz	PRGPRPPSRNCMCL-CQSZACIVSA-N	0	3	336.505	3.021	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccc(F)cc2)CCN1C(=O)CC(C)(C)C	ZINC001178130651	1386138077	/nfs/dbraw/zinc/13/80/77/1386138077.db2.gz	GSZJBKDHYWRRIY-YJBOKZPZSA-N	0	3	330.447	3.192	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@H](NCC#Cc2ccccc2Cl)[C@@H]1C)C1CC1	ZINC001178426772	1386214070	/nfs/dbraw/zinc/21/40/70/1386214070.db2.gz	HVSNBMJDYFBTEP-VCBZYWHSSA-N	0	3	344.886	3.317	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](NCC#Cc2ccccc2Cl)[C@@H]1C	ZINC001178577298	1386254937	/nfs/dbraw/zinc/25/49/37/1386254937.db2.gz	XCZMCMAJYXNEPO-LPHOPBHVSA-N	0	3	342.870	3.074	20	30		EGEDHN
Cc1nn(CCO)c(C)c1CN(Cc1ccc(C#N)cc1)CC(C)C	ZINC001319695787	1386256401	/nfs/dbraw/zinc/25/64/01/1386256401.db2.gz	VPLWVJOHDIAABE-UHFFFAOYSA-N	0	3	340.471	3.022	20	30		EGEDHN
C=C(C)CCC(=O)NCCCCCCNCc1csnc1OC	ZINC001178599010	1386259789	/nfs/dbraw/zinc/25/97/89/1386259789.db2.gz	QFVUCEOHUJLVGW-UHFFFAOYSA-N	0	3	339.505	3.274	20	30		EGEDHN
CC/C(C)=C\C(=O)N1CC[C@H](NCc2cc(C#N)ccc2OC)[C@@H]1C	ZINC001178637239	1386265953	/nfs/dbraw/zinc/26/59/53/1386265953.db2.gz	MABBUBPZWXMGMD-IWJGPTOESA-N	0	3	341.455	3.002	20	30		EGEDHN
C#CCN(Cc1ccc(N2CCCCC2)c([N+](=O)[O-])c1)CC1CC1	ZINC001319730514	1386272848	/nfs/dbraw/zinc/27/28/48/1386272848.db2.gz	ZHRQFNJRRWCYEJ-UHFFFAOYSA-N	0	3	327.428	3.430	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](NCc2scnc2C)[C@@H]1C	ZINC001178773938	1386300597	/nfs/dbraw/zinc/30/05/97/1386300597.db2.gz	UWYHLBOQYQZWSM-HOCLYGCPSA-N	0	3	333.501	3.299	20	30		EGEDHN
C#CCCCCCC(=O)NCCCCCCNCc1ccn(CC)n1	ZINC001179239566	1386429095	/nfs/dbraw/zinc/42/90/95/1386429095.db2.gz	IFENMCDHWFINLQ-UHFFFAOYSA-N	0	3	346.519	3.253	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCCCCCNCc1cc2n(n1)CCC2	ZINC001179306815	1386446087	/nfs/dbraw/zinc/44/60/87/1386446087.db2.gz	MSIDTKDYICHZQS-SJORKVTESA-N	0	3	346.519	3.054	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2Cl)CCN1C(=O)CCCF	ZINC001179337775	1386455804	/nfs/dbraw/zinc/45/58/04/1386455804.db2.gz	XHNYJSYKGDFDBF-YOEHRIQHSA-N	0	3	336.838	3.020	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@@H]1C	ZINC001179451784	1386484439	/nfs/dbraw/zinc/48/44/39/1386484439.db2.gz	IACJOHMDEQZALG-LPHOPBHVSA-N	0	3	328.431	3.113	20	30		EGEDHN
C=CCCC1(C(=O)NCCCCCCNCc2ocnc2C)CC1	ZINC001179481692	1386494363	/nfs/dbraw/zinc/49/43/63/1386494363.db2.gz	IQVXCPUFPKGDEG-UHFFFAOYSA-N	0	3	333.476	3.496	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)CCc1ccccc1F)C1CC1	ZINC001698653631	1406303652	/nfs/dbraw/zinc/30/36/52/1406303652.db2.gz	QLFSVPVRHDYEOS-SFHVURJKSA-N	0	3	338.854	3.385	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1ccc2ccn(C)c2c1)C1CC1	ZINC001698653840	1406303789	/nfs/dbraw/zinc/30/37/89/1406303789.db2.gz	WKBSFWDXKCENHM-LJQANCHMSA-N	0	3	345.874	3.419	20	30		EGEDHN
CC(C)C[C@@H](C)C(=O)N1CC[C@H](NCc2ccc(C#N)s2)[C@@H]1C	ZINC001179795049	1386589428	/nfs/dbraw/zinc/58/94/28/1386589428.db2.gz	YIJONVCOCAVDPE-KEYYUXOJSA-N	0	3	333.501	3.381	20	30		EGEDHN
CC(C)=C(F)C(=O)N1C[C@@H](C)[C@](C)(CNCc2ccccc2C#N)C1	ZINC001181119470	1386939453	/nfs/dbraw/zinc/93/94/53/1386939453.db2.gz	GRRVJWCZOWEAKO-FOIQADDNSA-N	0	3	343.446	3.396	20	30		EGEDHN
CC(C)c1occc1C(=O)N[C@H](C)CNCc1ccc(C#N)s1	ZINC001321759489	1386977664	/nfs/dbraw/zinc/97/76/64/1386977664.db2.gz	DIXACJXOIVULPL-GFCCVEGCSA-N	0	3	331.441	3.244	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@@H](C)[C@](C)(CNCc2cc(C)no2)C1	ZINC001182305780	1387143769	/nfs/dbraw/zinc/14/37/69/1387143769.db2.gz	OURBVWLURNPPJF-IDHHARJASA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H](C)[C@](C)(CNCc2nccs2)C1	ZINC001182516609	1387180967	/nfs/dbraw/zinc/18/09/67/1387180967.db2.gz	KTYPKMZIFQRRLK-ZTFGCOKTSA-N	0	3	335.517	3.320	20	30		EGEDHN
O[C@@H](CNCC#Cc1ccc(C(F)(F)F)cc1)Cc1ccccc1	ZINC001336801674	1389172067	/nfs/dbraw/zinc/17/20/67/1389172067.db2.gz	ZJOBLECTYGJACZ-GOSISDBHSA-N	0	3	333.353	3.250	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC[C@@H]1CNCc1ccnc(Cl)c1	ZINC001698731965	1406381002	/nfs/dbraw/zinc/38/10/02/1406381002.db2.gz	YBWMAPWLNKJDJI-GDBMZVCRSA-N	0	3	335.879	3.418	20	30		EGEDHN
C[C@@H](CN(C)C(=O)C1CC(C)(C)C1)NCc1ccc(F)c(C#N)c1	ZINC001331441539	1389750315	/nfs/dbraw/zinc/75/03/15/1389750315.db2.gz	NGSAYFNFBHOSCF-ZDUSSCGKSA-N	0	3	331.435	3.070	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N[C@H](c1nc2ccccc2[nH]1)[C@@H](C)CC	ZINC001340043919	1390214663	/nfs/dbraw/zinc/21/46/63/1390214663.db2.gz	CUHVAYVSCBGKEO-ZQIUZPCESA-N	0	3	328.460	3.450	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1cc(OC)ccc1Br	ZINC001340634737	1390333729	/nfs/dbraw/zinc/33/37/29/1390333729.db2.gz	KUBWEZBLHPHWMI-GFCCVEGCSA-N	0	3	327.222	3.080	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1cc(OC)ccc1Br	ZINC001340634740	1390333931	/nfs/dbraw/zinc/33/39/31/1390333931.db2.gz	KUBWEZBLHPHWMI-LBPRGKRZSA-N	0	3	327.222	3.080	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N[C@@H](C)c1ccc(-n2nc(C)cc2C)cc1	ZINC001340880398	1390392802	/nfs/dbraw/zinc/39/28/02/1390392802.db2.gz	NGBFMKPVSSWYOJ-LPHOPBHVSA-N	0	3	340.471	3.350	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1cnn(-c2cc(C)ccc2C)c1C	ZINC001341018507	1390426119	/nfs/dbraw/zinc/42/61/19/1390426119.db2.gz	BKAGVSQVXXSNME-MRXNPFEDSA-N	0	3	326.444	3.420	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N[C@H](CC(C)C)c1nc2ccccc2[nH]1	ZINC001341540724	1390499654	/nfs/dbraw/zinc/49/96/54/1390499654.db2.gz	RVKYSMPSZJBHCT-RHSMWYFYSA-N	0	3	328.460	3.450	20	30		EGEDHN
C[C@@H](C(=O)C(C#N)C(=O)NC1CCCCC1)c1ccc(F)cc1F	ZINC001341899791	1390546900	/nfs/dbraw/zinc/54/69/00/1390546900.db2.gz	UDCUIVFGWLOJHH-IAQYHMDHSA-N	0	3	334.366	3.226	20	30		EGEDHN
C=C(C)Cn1c(CCCCC#N)nnc1N1C[C@H](C)N(CC)C[C@H]1C	ZINC001341940756	1390552442	/nfs/dbraw/zinc/55/24/42/1390552442.db2.gz	SFENYDQBQWXUQP-DLBZAZTESA-N	0	3	344.507	3.009	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)NC[C@@H](Cc1ccccc1)c1ccccn1	ZINC001343459759	1390715621	/nfs/dbraw/zinc/71/56/21/1390715621.db2.gz	PWOJCSZEHMPZKN-MOPGFXCFSA-N	0	3	337.467	3.208	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)N1CCC[C@@H](Cc2nccn2C)C1	ZINC001343556757	1390722400	/nfs/dbraw/zinc/72/24/00/1390722400.db2.gz	FYEXRVKTOPQNDH-ZWKOTPCHSA-N	0	3	348.535	3.279	20	30		EGEDHN
CC(C)n1ccc(CC(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)n1	ZINC001346040356	1390902470	/nfs/dbraw/zinc/90/24/70/1390902470.db2.gz	SYLFOFULGSXUQV-OAHLLOKOSA-N	0	3	344.802	3.007	20	30		EGEDHN
CCN1C[C@H](C)N(c2nnc([C@H](C)CCC#N)n2CC2CC2)C[C@H]1C	ZINC001346901822	1390985745	/nfs/dbraw/zinc/98/57/45/1390985745.db2.gz	SFNUWLWGZDERTD-OAGGEKHMSA-N	0	3	344.507	3.014	20	30		EGEDHN
CCc1ccc(CC(=O)C(C#N)C(=O)N[C@@H](CC)c2ccccc2)nc1	ZINC001348268634	1391196416	/nfs/dbraw/zinc/19/64/16/1391196416.db2.gz	BCICXRJIPWBFOB-OALUTQOASA-N	0	3	349.434	3.163	20	30		EGEDHN
N#CCOc1ccc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)cc1	ZINC001349499274	1391335751	/nfs/dbraw/zinc/33/57/51/1391335751.db2.gz	SWYGJGGEVABFDB-ZIAGYGMSSA-N	0	3	342.317	3.275	20	30		EGEDHN
CC(C)O[C@@H](C(=O)C(C#N)c1ncc(Cl)n1C)c1ccccc1	ZINC001349703284	1391355884	/nfs/dbraw/zinc/35/58/84/1391355884.db2.gz	WGKXCWPHENJXMO-CZUORRHYSA-N	0	3	331.803	3.416	20	30		EGEDHN
CCCC1(C(=O)NC[C@@H](NCc2ccc(C#N)cc2F)C2CC2)CC1	ZINC001480045497	1392549400	/nfs/dbraw/zinc/54/94/00/1392549400.db2.gz	YADUKFOAHUJCPE-GOSISDBHSA-N	0	3	343.446	3.262	20	30		EGEDHN
C[C@@H](C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1)C(C)(C)C	ZINC001480147622	1392601097	/nfs/dbraw/zinc/60/10/97/1392601097.db2.gz	UVQJXVVHEAMEEV-RCBQFDQVSA-N	0	3	331.435	3.116	20	30		EGEDHN
C[C@H](NC(=O)C(C)(C)C)[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001480388660	1392733945	/nfs/dbraw/zinc/73/39/45/1392733945.db2.gz	ZKKAAYGFXXUNMW-MAUKXSAKSA-N	0	3	327.472	3.321	20	30		EGEDHN
C[C@H](CNC(=O)c1ccc2c(c1)CCC2)NCc1ccc(C#N)s1	ZINC001480588338	1392807444	/nfs/dbraw/zinc/80/74/44/1392807444.db2.gz	OBXKJJRTCGUHDK-CYBMUJFWSA-N	0	3	339.464	3.017	20	30		EGEDHN
C=C(Cl)CNCc1ccc(CNC(=O)[C@H]2CCCCN2CC)cc1	ZINC001482035515	1394696455	/nfs/dbraw/zinc/69/64/55/1394696455.db2.gz	CPVSZBDFJOVBIG-GOSISDBHSA-N	0	3	349.906	3.019	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1c(F)ccc2ccncc21)C(C)C	ZINC001698962314	1406716919	/nfs/dbraw/zinc/71/69/19/1406716919.db2.gz	PWFRERAHDNACOF-MRXNPFEDSA-N	0	3	349.837	3.470	20	30		EGEDHN
Cc1cc(C(=O)N(C)[C@H](C)CNCc2ccc(F)c(C#N)c2)c(C)o1	ZINC001482256127	1394851351	/nfs/dbraw/zinc/85/13/51/1394851351.db2.gz	WHLZCJQSJSWKCD-GFCCVEGCSA-N	0	3	343.402	3.158	20	30		EGEDHN
CC1(C(=O)N2CCC[C@@H]2CNCC#Cc2ccc(F)cc2)CCCC1	ZINC001483940568	1395154274	/nfs/dbraw/zinc/15/42/74/1395154274.db2.gz	YHVKRXLTQPRIFR-LJQANCHMSA-N	0	3	342.458	3.338	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1scnc1C(F)(F)F	ZINC001484993773	1395638537	/nfs/dbraw/zinc/63/85/37/1395638537.db2.gz	HIAKHYVTRHJGRS-QMMMGPOBSA-N	0	3	341.786	3.012	20	30		EGEDHN
N#Cc1cccc(CN2CCCCC[C@H]2CNC(=O)CC2CC2)c1	ZINC001485473689	1395950341	/nfs/dbraw/zinc/95/03/41/1395950341.db2.gz	WWAILJGGYQMZNS-IBGZPJMESA-N	0	3	325.456	3.219	20	30		EGEDHN
Cc1csc(C(=O)N(C)C[C@H](C)NCc2ccc(C#N)s2)c1	ZINC001485870028	1396160306	/nfs/dbraw/zinc/16/03/06/1396160306.db2.gz	CTSPGENLZULOCU-LBPRGKRZSA-N	0	3	333.482	3.240	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)C(C)(C)C(F)F)CCN1Cc1ccc(C#N)cc1	ZINC001502989859	1396238520	/nfs/dbraw/zinc/23/85/20/1396238520.db2.gz	QNYUYQTVJPKWLM-CZUORRHYSA-N	0	3	349.425	3.319	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)Cc1ccc(F)c(Cl)c1	ZINC001503483463	1396256293	/nfs/dbraw/zinc/25/62/93/1396256293.db2.gz	MFIWTMWJVCFQNO-NSHDSACASA-N	0	3	333.234	3.259	20	30		EGEDHN
C[C@H](CCNC(=O)CCC1CCC1)NCc1cc(C#N)ccc1F	ZINC001492000809	1396302174	/nfs/dbraw/zinc/30/21/74/1396302174.db2.gz	NKDFHXAUFHWMKB-CQSZACIVSA-N	0	3	331.435	3.262	20	30		EGEDHN
C[C@H](CCNC(=O)C(C1CC1)C1CC1)NCc1cc(C#N)ccc1F	ZINC001492109209	1396305046	/nfs/dbraw/zinc/30/50/46/1396305046.db2.gz	RKGLYUZBEHVVTB-CYBMUJFWSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Br)CN[C@H](CNC(=O)C1CCCCC1)C(C)C	ZINC001496523637	1396713378	/nfs/dbraw/zinc/71/33/78/1396713378.db2.gz	VUXNDLDMWYCMPN-CQSZACIVSA-N	0	3	331.298	3.206	20	30		EGEDHN
Cc1coc(C)c1C(=O)N[C@H](C)CN(C)Cc1cccc(C#N)c1	ZINC001498270958	1396953645	/nfs/dbraw/zinc/95/36/45/1396953645.db2.gz	XQUDMGLZKFCXMI-CQSZACIVSA-N	0	3	325.412	3.018	20	30		EGEDHN
CC[C@H](C)CC(=O)N(C)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001690021903	1404260985	/nfs/dbraw/zinc/26/09/85/1404260985.db2.gz	NAVMKXGWKSEOIY-INIZCTEOSA-N	0	3	327.472	3.417	20	30		EGEDHN
CC1(C(=O)NC[C@H]2CCCN(Cc3ccc(C#N)cc3)C2)CCC1	ZINC001690387704	1404522501	/nfs/dbraw/zinc/52/25/01/1404522501.db2.gz	VCFLQXCSNZNBRY-GOSISDBHSA-N	0	3	325.456	3.077	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)C[C@H](C)CC(C)C)C1	ZINC001691750555	1405469893	/nfs/dbraw/zinc/46/98/93/1405469893.db2.gz	SMQGPURINRQKLE-YUELXQCFSA-N	0	3	345.325	3.452	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@H](C)Cc2ccccc2C)C1	ZINC001691757362	1405474504	/nfs/dbraw/zinc/47/45/04/1405474504.db2.gz	HFMVFXLIUWBFPR-KYJSFNMBSA-N	0	3	334.891	3.411	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CCCN(CCCc2ccccc2OC)C1	ZINC001732090387	1428355633	/nfs/dbraw/zinc/35/56/33/1428355633.db2.gz	GPYVZWOHPNAAMB-GOSISDBHSA-N	0	3	344.499	3.421	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cc(Cl)cn2C)CCCC1	ZINC001732393492	1428561824	/nfs/dbraw/zinc/56/18/24/1428561824.db2.gz	RODRVCDKLAUQHM-UHFFFAOYSA-N	0	3	330.259	3.063	20	30		EGEDHN
Cc1ccc(F)cc1C(=O)N[C@@H](C)CNCc1ccc(F)c(C#N)c1	ZINC001699415574	1412729706	/nfs/dbraw/zinc/72/97/06/1412729706.db2.gz	ZLTJUJOVVWPGRA-ZDUSSCGKSA-N	0	3	343.377	3.053	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)C1(C(F)F)CCCC1	ZINC001699462219	1412818525	/nfs/dbraw/zinc/81/85/25/1412818525.db2.gz	RCTXWUADTPXBSE-CQSZACIVSA-N	0	3	349.425	3.320	20	30		EGEDHN
C[C@H](CC(=O)NCC1(NCc2ccc(C#N)cc2)CC1)c1ccccc1	ZINC001699672313	1413062948	/nfs/dbraw/zinc/06/29/48/1413062948.db2.gz	WZRPEPQGCOJGGD-QGZVFWFLSA-N	0	3	347.462	3.490	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1ccc(-c2c[nH]cn2)cc1)C(C)C	ZINC001732574296	1428773264	/nfs/dbraw/zinc/77/32/64/1428773264.db2.gz	MXKIUAWGOXVZNP-MRXNPFEDSA-N	0	3	346.862	3.173	20	30		EGEDHN
CN(C(=O)C1(F)CCCC1)[C@@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001700724974	1414386577	/nfs/dbraw/zinc/38/65/77/1414386577.db2.gz	OAAXNYXMAHCJDU-INIZCTEOSA-N	0	3	349.475	3.229	20	30		EGEDHN
C=C(Cl)CNC[C@H](C1CC1)N(C)C(=O)c1cc(C)cc2cn[nH]c21	ZINC001700732123	1414396112	/nfs/dbraw/zinc/39/61/12/1414396112.db2.gz	DRCUBKXWUHEUHD-MRXNPFEDSA-N	0	3	346.862	3.064	20	30		EGEDHN
C=C(Cl)CNC[C@H](C1CC1)N(C)C(=O)c1cc(C)cc2c[nH]nc21	ZINC001700732123	1414396116	/nfs/dbraw/zinc/39/61/16/1414396116.db2.gz	DRCUBKXWUHEUHD-MRXNPFEDSA-N	0	3	346.862	3.064	20	30		EGEDHN
C[C@@H](NCc1ccc(CNC(=O)[C@@H](C)C#N)c(F)c1)c1ccccc1	ZINC001701063559	1414720781	/nfs/dbraw/zinc/72/07/81/1414720781.db2.gz	NALUVMKXOTVBBM-LSDHHAIUSA-N	0	3	339.414	3.452	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1ccc2c(c1)CCO2	ZINC001712998957	1417550757	/nfs/dbraw/zinc/55/07/57/1417550757.db2.gz	ISCYMPNQHZXXGR-PBHICJAKSA-N	0	3	348.874	3.347	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)CCc1ccccc1	ZINC001733061095	1429209324	/nfs/dbraw/zinc/20/93/24/1429209324.db2.gz	GWNLKDGCTHIPHK-KRWDZBQOSA-N	0	3	335.451	3.128	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)CCc1ccccc1	ZINC001733061096	1429209603	/nfs/dbraw/zinc/20/96/03/1429209603.db2.gz	GWNLKDGCTHIPHK-QGZVFWFLSA-N	0	3	335.451	3.128	20	30		EGEDHN
CC(C)n1cccc1C(=O)N[C@H](C)CN(C)Cc1ccc(C#N)cc1	ZINC001733067696	1429222629	/nfs/dbraw/zinc/22/26/29/1429222629.db2.gz	NTJCNVPTFBENSJ-MRXNPFEDSA-N	0	3	338.455	3.191	20	30		EGEDHN
C[C@H](CNC(=O)C1(C)CCCCC1)NCc1ccc(F)c(C#N)c1	ZINC001713335771	1417959761	/nfs/dbraw/zinc/95/97/61/1417959761.db2.gz	VRXWZJZRTSWWAM-CQSZACIVSA-N	0	3	331.435	3.262	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1ccc(OC)cc1Cl	ZINC001713418149	1418042087	/nfs/dbraw/zinc/04/20/87/1418042087.db2.gz	ORQGQTVPTGXZBH-LLVKDONJSA-N	0	3	331.243	3.199	20	30		EGEDHN
CCC1(C(=O)NCC[C@@H]2CCN(Cc3ccc(F)c(C#N)c3)C2)CC1	ZINC001713734734	1418526789	/nfs/dbraw/zinc/52/67/89/1418526789.db2.gz	LDJPEOMZPOTZEL-OAHLLOKOSA-N	0	3	343.446	3.216	20	30		EGEDHN
CCC(CC)CC(=O)N1CC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001713932780	1418722682	/nfs/dbraw/zinc/72/26/82/1418722682.db2.gz	NITOXFKOCPUXDI-KRWDZBQOSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=C(Br)CNCC1(NC(=O)C2CCCCC2)CCCC1	ZINC001714128249	1418932207	/nfs/dbraw/zinc/93/22/07/1418932207.db2.gz	PQMPIFBHOLDKLH-UHFFFAOYSA-N	0	3	343.309	3.494	20	30		EGEDHN
CC[C@H](C)C(=O)NC1(CNCc2cc(C#N)ccc2F)CCCC1	ZINC001714128595	1418932419	/nfs/dbraw/zinc/93/24/19/1418932419.db2.gz	GKGMUTOYSTTYMW-AWEZNQCLSA-N	0	3	331.435	3.262	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2[nH]c(C)nc2C)CCCC[C@H]1C	ZINC001714185755	1418993006	/nfs/dbraw/zinc/99/30/06/1418993006.db2.gz	CQYZFTRJVWAFFS-PIGZYNQJSA-N	0	3	338.883	3.047	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2cc(F)c[nH]2)CCCC[C@H]1C	ZINC001714189023	1418995979	/nfs/dbraw/zinc/99/59/79/1418995979.db2.gz	POQRFNLBEBWXOO-BDJLRTHQSA-N	0	3	327.831	3.175	20	30		EGEDHN
Cc1ccc(F)cc1C(=O)NC[C@@H](C)NCc1ccc(F)c(C#N)c1	ZINC001714258133	1419042202	/nfs/dbraw/zinc/04/22/02/1419042202.db2.gz	MHXHZCFWFOJHRW-CYBMUJFWSA-N	0	3	343.377	3.053	20	30		EGEDHN
O=C(CCCC1CC1)N1CCC[C@@H]1CNCC#Cc1ccc(F)cc1	ZINC001714345603	1419116567	/nfs/dbraw/zinc/11/65/67/1419116567.db2.gz	BBDAAZNLZIIXQK-HXUWFJFHSA-N	0	3	342.458	3.338	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1cccc2ccc(C)nc21	ZINC001714476189	1419199578	/nfs/dbraw/zinc/19/95/78/1419199578.db2.gz	ZINKHHVPPIOFBW-ZDUSSCGKSA-N	0	3	331.847	3.394	20	30		EGEDHN
CCN(CCNC(=O)c1cccn1C(C)C)Cc1cccc(C#N)c1	ZINC001714598889	1419353839	/nfs/dbraw/zinc/35/38/39/1419353839.db2.gz	IRLNVVSKBKIQSM-UHFFFAOYSA-N	0	3	338.455	3.193	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H]2OCCc3ccccc32)CCCC1	ZINC001715301408	1420009215	/nfs/dbraw/zinc/00/92/15/1420009215.db2.gz	ODJMUQLPSWZLCR-QGZVFWFLSA-N	0	3	348.874	3.072	20	30		EGEDHN
CCC(CC)C(=O)N[C@@H]1CCC[C@H]1CNCc1ccccc1C#N	ZINC001715544911	1420241813	/nfs/dbraw/zinc/24/18/13/1420241813.db2.gz	GWHNLSALDZHZIW-RBUKOAKNSA-N	0	3	327.472	3.369	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC1(C)CCN(C/C=C/c2ccc(Cl)cc2)CC1	ZINC001716794577	1420927402	/nfs/dbraw/zinc/92/74/02/1420927402.db2.gz	ODZVLBKBTKOREF-BWPKMQGJSA-N	0	3	345.874	3.484	20	30		EGEDHN
CC(C)C(=O)N[C@H](CNCc1ccc(C#N)cc1F)C1CCCC1	ZINC001716813228	1420939197	/nfs/dbraw/zinc/93/91/97/1420939197.db2.gz	CRTYRIWRNJEBFX-GOSISDBHSA-N	0	3	331.435	3.118	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)[C@@H]3C[C@H]3C3CCC3)CCC2)s1	ZINC001717159567	1421149388	/nfs/dbraw/zinc/14/93/88/1421149388.db2.gz	KQVHKCSNGNAXEP-DLBZAZTESA-N	0	3	343.496	3.184	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1cn2ccc(C)cc2n1	ZINC001717454716	1421384406	/nfs/dbraw/zinc/38/44/06/1421384406.db2.gz	LTUONLBSQHBRSJ-UHFFFAOYSA-N	0	3	348.878	3.083	20	30		EGEDHN
C=C(Br)CNC[C@H](NC(=O)c1ccccc1)C(C)(C)C	ZINC001717955597	1421727424	/nfs/dbraw/zinc/72/74/24/1421727424.db2.gz	KPRUANFUVRGYNH-AWEZNQCLSA-N	0	3	339.277	3.329	20	30		EGEDHN
C[C@@H](CC(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1)C1CC1	ZINC001724025019	1424633415	/nfs/dbraw/zinc/63/34/15/1424633415.db2.gz	BNCPKQYAVCBNJJ-INIZCTEOSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)N(C)CC(C)(C)CNCc1ccccc1C#N	ZINC001725147339	1425630013	/nfs/dbraw/zinc/63/00/13/1425630013.db2.gz	IRMKHKWJQGOVNU-QGZVFWFLSA-N	0	3	333.451	3.127	20	30		EGEDHN
CN(C(=O)C1(C)CCC1)[C@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001725465210	1426132078	/nfs/dbraw/zinc/13/20/78/1426132078.db2.gz	YZEGVOYKYFBVNL-MRXNPFEDSA-N	0	3	331.485	3.137	20	30		EGEDHN
CCC[C@H](C)CC(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001731442080	1427421120	/nfs/dbraw/zinc/42/11/20/1427421120.db2.gz	KSZSVUKPIWDRNB-JQFCIGGWSA-N	0	3	331.435	3.260	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@H](CC)Oc2cccc(C)c2)C1	ZINC001731455160	1427431487	/nfs/dbraw/zinc/43/14/87/1427431487.db2.gz	BODCZEVLPMRMQX-ZOBUZTSGSA-N	0	3	336.863	3.142	20	30		EGEDHN
Cc1cccc(C(=O)NC[C@@H](C)NCc2ccc(F)c(C#N)c2)c1F	ZINC001731594095	1427635775	/nfs/dbraw/zinc/63/57/75/1427635775.db2.gz	LJMNUXPVJHUUJY-CYBMUJFWSA-N	0	3	343.377	3.053	20	30		EGEDHN
C=C(Br)CNC1CCC(N(C)C(=O)CCCF)CC1	ZINC001734011063	1437802616	/nfs/dbraw/zinc/80/26/16/1437802616.db2.gz	CDCIRZJDEKTGHO-UHFFFAOYSA-N	0	3	335.261	3.004	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)CC[C@H]1CCCCO1	ZINC001734021051	1437810116	/nfs/dbraw/zinc/81/01/16/1437810116.db2.gz	ZKVCIVCLRRDOCD-OAHLLOKOSA-N	0	3	330.900	3.162	20	30		EGEDHN
Cc1cscc1C(=O)NC[C@@H](C)N(C)Cc1cccc(C#N)c1	ZINC001734030946	1437818989	/nfs/dbraw/zinc/81/89/89/1437818989.db2.gz	CAHCPOKKXYWUCO-CQSZACIVSA-N	0	3	327.453	3.179	20	30		EGEDHN
C[C@H](CN(C)C(=O)CCc1ccsc1)NCc1ccc(C#N)s1	ZINC001734328121	1438052730	/nfs/dbraw/zinc/05/27/30/1438052730.db2.gz	HLSXDONBLWXHBW-CYBMUJFWSA-N	0	3	347.509	3.251	20	30		EGEDHN
C=C(Cl)CNC[C@H](NC(=O)c1ccn2c(C)cnc2c1)C(C)(C)C	ZINC001734559590	1438157766	/nfs/dbraw/zinc/15/77/66/1438157766.db2.gz	CYPQEBXQWSMLRZ-HNNXBMFYSA-N	0	3	348.878	3.129	20	30		EGEDHN
CCC(C)(C)C(=O)N(C)C1CC(NCc2ccc(C#N)cc2F)C1	ZINC001734599217	1438181989	/nfs/dbraw/zinc/18/19/89/1438181989.db2.gz	TVGUNSFGBRZZQA-UHFFFAOYSA-N	0	3	331.435	3.213	20	30		EGEDHN
C[C@@H](NCC#Cc1ccccc1)[C@H]1CCCCN1C(=O)CCCF	ZINC001752144528	1440145367	/nfs/dbraw/zinc/14/53/67/1440145367.db2.gz	QRHNVLFTWQIBRX-IEBWSBKVSA-N	0	3	330.447	3.147	20	30		EGEDHN
C=C(C)CCC(=O)N1CCCC[C@@H]1[C@@H](C)NCc1cccnc1OC	ZINC001752146103	1440146007	/nfs/dbraw/zinc/14/60/07/1440146007.db2.gz	IXDWOJKQBWHWMC-SJLPKXTDSA-N	0	3	345.487	3.306	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1cnc2[nH]ccc2c1	ZINC001752148405	1440146538	/nfs/dbraw/zinc/14/65/38/1440146538.db2.gz	YZTGZXLOQNBZAR-BBRMVZONSA-N	0	3	346.862	3.240	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1cc(C(F)F)n[nH]1	ZINC001752156573	1440147280	/nfs/dbraw/zinc/14/72/80/1440147280.db2.gz	HRTQXDIWQBLFRU-GWCFXTLKSA-N	0	3	346.809	3.073	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)CCc1cscn1	ZINC001752159264	1440148492	/nfs/dbraw/zinc/14/84/92/1440148492.db2.gz	ZEZLABUOSFIKMT-ZFWWWQNUSA-N	0	3	341.908	3.187	20	30		EGEDHN
CC#CCN(CCCNC(=O)C[C@@H]1CCCc2ccccc21)C1CC1	ZINC001752284992	1440165265	/nfs/dbraw/zinc/16/52/65/1440165265.db2.gz	OYIJYWAKIMAUIY-IBGZPJMESA-N	0	3	338.495	3.491	20	30		EGEDHN
C=CCCC(=O)N(C)C1CCN(Cc2ccc(COC)cc2)CC1	ZINC001752294735	1440166890	/nfs/dbraw/zinc/16/68/90/1440166890.db2.gz	HNHWHGHQMDQJHQ-UHFFFAOYSA-N	0	3	330.472	3.222	20	30		EGEDHN
C=C(C)CN1CCN(CCCNC(=O)c2cccc(C(C)C)c2)CC1	ZINC001752354678	1440172122	/nfs/dbraw/zinc/17/21/22/1440172122.db2.gz	AVTZBVVAPOZDNI-UHFFFAOYSA-N	0	3	343.515	3.124	20	30		EGEDHN
C=C(C)CN1CCN(CCCNC(=O)C[C@H]2CCCCC2(C)C)CC1	ZINC001752361008	1440172204	/nfs/dbraw/zinc/17/22/04/1440172204.db2.gz	RPQJBLTZOFVIQH-LJQANCHMSA-N	0	3	349.563	3.293	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1CCN(CCCOc2ccccc2C)C1	ZINC001752395569	1440173634	/nfs/dbraw/zinc/17/36/34/1440173634.db2.gz	PGXABUCRUJMLMX-KRWDZBQOSA-N	0	3	330.472	3.167	20	30		EGEDHN
CC(C)CC(=O)N[C@@H]1CC12CCN(Cc1cccc(C#N)c1)CC2	ZINC001752414963	1440174737	/nfs/dbraw/zinc/17/47/37/1440174737.db2.gz	FHZWPDSBVMVSEI-GOSISDBHSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1CC12CCN(Cc1ccccn1)CC2	ZINC001752436830	1440180538	/nfs/dbraw/zinc/18/05/38/1440180538.db2.gz	ZCMGVSNCUZORJO-KRWDZBQOSA-N	0	3	327.472	3.155	20	30		EGEDHN
C=CCN1CCC(N(CCC)C(=O)c2cccc3nsnc32)CC1	ZINC001752441742	1440181453	/nfs/dbraw/zinc/18/14/53/1440181453.db2.gz	LKBZPECCNWGBHE-UHFFFAOYSA-N	0	3	344.484	3.194	20	30		EGEDHN
CC1(C)CC(C(=O)NC[C@@H](NCc2ccc(C#N)s2)C2CC2)C1	ZINC001752458545	1440183516	/nfs/dbraw/zinc/18/35/16/1440183516.db2.gz	NFTFGKQNOQZQCY-MRXNPFEDSA-N	0	3	331.485	3.040	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)CCCc2ccsc2)C1	ZINC001752704977	1440202322	/nfs/dbraw/zinc/20/23/22/1440202322.db2.gz	IKXWCNDUHHBNFO-OALUTQOASA-N	0	3	344.524	3.407	20	30		EGEDHN
COc1ccc(CN2CCC[C@@H](CNC(=O)C#CC(C)(C)C)C2)cc1	ZINC001752780758	1440208575	/nfs/dbraw/zinc/20/85/75/1440208575.db2.gz	FMUHBNHEASNFHK-SFHVURJKSA-N	0	3	342.483	3.073	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)[C@@H](C)CCc2ccc(F)cc2)C1	ZINC001752783821	1440210213	/nfs/dbraw/zinc/21/02/13/1440210213.db2.gz	PVKKKWXNCCFTBO-HKUYNNGSSA-N	0	3	344.474	3.246	20	30		EGEDHN
CCC1(C(=O)NC[C@@H]2CCCN(Cc3cccc(C#N)c3)C2)CC1	ZINC001752786454	1440211342	/nfs/dbraw/zinc/21/13/42/1440211342.db2.gz	SFZGVUGPMZPAPJ-SFHVURJKSA-N	0	3	325.456	3.077	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)C(C)(C)c1ccc(C)cc1	ZINC001752824124	1440222383	/nfs/dbraw/zinc/22/23/83/1440222383.db2.gz	PTOVCGCAYNYIKS-LJQANCHMSA-N	0	3	326.484	3.267	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC[C@H](C)NCc1sc2ccccc2c1Cl	ZINC001752863546	1440236102	/nfs/dbraw/zinc/23/61/02/1440236102.db2.gz	AMDRNFXXLRMNIO-QWRGUYRKSA-N	0	3	335.860	3.309	20	30		EGEDHN
CCCCC1(C(=O)NC[C@@H](C)NCc2ccc(C#N)c(F)c2)CC1	ZINC001752899532	1440242565	/nfs/dbraw/zinc/24/25/65/1440242565.db2.gz	RCJFSOAWCMIMGS-CQSZACIVSA-N	0	3	331.435	3.262	20	30		EGEDHN
C[C@@H](CNC(=O)c1csc(Cl)c1)NCc1ccc(C#N)s1	ZINC001752902873	1440243393	/nfs/dbraw/zinc/24/33/93/1440243393.db2.gz	IYCXKLFTZOJWLS-VIFPVBQESA-N	0	3	339.873	3.243	20	30		EGEDHN
C=C(Cl)CNCCc1ccc(CNC(=O)C2CC(F)(F)C2)cc1	ZINC001752982175	1440257312	/nfs/dbraw/zinc/25/73/12/1440257312.db2.gz	HKMFWMDFFJCFCW-UHFFFAOYSA-N	0	3	342.817	3.233	20	30		EGEDHN
CCN(CCNC(=O)[C@H](C)C#N)Cc1ccc(-c2ccccc2)cc1	ZINC001753079353	1440292899	/nfs/dbraw/zinc/29/28/99/1440292899.db2.gz	JKPNKMITEZWDJF-QGZVFWFLSA-N	0	3	335.451	3.451	20	30		EGEDHN
CCN(CCNC(=O)C1(C2CCC2)CCC1)Cc1cccc(C#N)c1	ZINC001753086546	1440296539	/nfs/dbraw/zinc/29/65/39/1440296539.db2.gz	WWXHHYQDJFXTEO-UHFFFAOYSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC[C@H]1CCCN1Cc1ccc(C)cc1	ZINC001753099916	1440303902	/nfs/dbraw/zinc/30/39/02/1440303902.db2.gz	YZTUQTWZGOBDKG-IEBWSBKVSA-N	0	3	330.472	3.057	20	30		EGEDHN
CC[C@@H](CC1CCCCC1)C(=O)NC[C@@H]1CCN(CC#CCOC)C1	ZINC001753135252	1440318547	/nfs/dbraw/zinc/31/85/47/1440318547.db2.gz	JEDAZXKMXGSVAZ-PMACEKPBSA-N	0	3	348.531	3.071	20	30		EGEDHN
N#Cc1c[nH]c(C(=O)NCCN(Cc2ccccc2C2CC2)C2CC2)c1	ZINC001753152268	1440328800	/nfs/dbraw/zinc/32/88/00/1440328800.db2.gz	CWHMAURWQDIRFT-UHFFFAOYSA-N	0	3	348.450	3.158	20	30		EGEDHN
CC[C@@H]1CCC[C@H]1C(=O)N(C)CCNCc1ccc(F)c(C#N)c1	ZINC001753227975	1440340766	/nfs/dbraw/zinc/34/07/66/1440340766.db2.gz	HBKNLURAMUCRBT-NVXWUHKLSA-N	0	3	331.435	3.072	20	30		EGEDHN
Cc1ccc(C[C@H](C)C(=O)N(C)CCNCc2cccc(C#N)c2)cc1	ZINC001753265503	1440344811	/nfs/dbraw/zinc/34/48/11/1440344811.db2.gz	ZNKJMSYHWURNHF-SFHVURJKSA-N	0	3	349.478	3.294	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@H]2CC[C@@H](C1)N2CCc1ccc(OC)cc1	ZINC001753307548	1440355767	/nfs/dbraw/zinc/35/57/67/1440355767.db2.gz	YBSPEZWRBWLPJH-KDURUIRLSA-N	0	3	342.483	3.269	20	30		EGEDHN
C=CCCCC(=O)N1C[C@H]2CC[C@@H](C1)N2C[C@H](OC)C1CCCC1	ZINC001753311014	1440356636	/nfs/dbraw/zinc/35/66/36/1440356636.db2.gz	ZOBZNKUZZUQJDM-OTWHNJEPSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C[C@@](C)(O)CC(=O)N(CCC)[C@H]1CCN(Cc2cccc(C)c2)C1	ZINC001753316300	1440359882	/nfs/dbraw/zinc/35/98/82/1440359882.db2.gz	PEDQXZMOJATQFC-PZJWPPBQSA-N	0	3	344.499	3.135	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CCC)C(=O)[C@H](CC(C)C)n2ccnc2)C1	ZINC001753317757	1440360835	/nfs/dbraw/zinc/36/08/35/1440360835.db2.gz	VLWFJCPLZHVIHO-OALUTQOASA-N	0	3	346.519	3.359	20	30		EGEDHN
CC(F)(F)CCC(=O)NCC[C@H]1CCN(Cc2ccccc2C#N)C1	ZINC001753330430	1440369030	/nfs/dbraw/zinc/36/90/30/1440369030.db2.gz	JEYVSJFHDHCEON-HNNXBMFYSA-N	0	3	349.425	3.322	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC[C@@H]1CCN(CC#Cc2ccccc2)C1	ZINC001753333097	1440370734	/nfs/dbraw/zinc/37/07/34/1440370734.db2.gz	BPFBNNFHPFUMRJ-HXUWFJFHSA-N	0	3	338.495	3.469	20	30		EGEDHN
C=CC(C)(C)C(=O)N(C)CCN1CCN([C@H](C)c2ccccc2)CC1	ZINC001753342121	1440375635	/nfs/dbraw/zinc/37/56/35/1440375635.db2.gz	LHRSCSIWBAXCJF-GOSISDBHSA-N	0	3	343.515	3.036	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC(CN(C)Cc2conc2C)CC1	ZINC001753363835	1440384214	/nfs/dbraw/zinc/38/42/14/1440384214.db2.gz	GEIZJRFWOYONPZ-UHFFFAOYSA-N	0	3	333.476	3.256	20	30		EGEDHN
C=CCOCCN1CC[C@@H](N(C)C(=O)c2coc3c2cccc3C)C1	ZINC001753440583	1440401461	/nfs/dbraw/zinc/40/14/61/1440401461.db2.gz	ZXUMUHSECJWVGR-MRXNPFEDSA-N	0	3	342.439	3.090	20	30		EGEDHN
C#CCCN1CC[C@H](N(C)C(=O)C[C@@H](C)c2ccc(CC)cc2)C1	ZINC001753444452	1440402976	/nfs/dbraw/zinc/40/29/76/1440402976.db2.gz	RCVLXKSCJSZUQV-XLIONFOSSA-N	0	3	326.484	3.299	20	30		EGEDHN
C#CCCCC(=O)N(CC)[C@@H]1CCN([C@H](C)c2cccc(OC)c2)C1	ZINC001753456043	1440408328	/nfs/dbraw/zinc/40/83/28/1440408328.db2.gz	QXNLNKMJEDIFDR-IEBWSBKVSA-N	0	3	342.483	3.483	20	30		EGEDHN
CC[C@@H](CNC(=O)C(C)C)NCC#Cc1ccc(C(F)(F)F)cc1	ZINC001753465510	1440412641	/nfs/dbraw/zinc/41/26/41/1440412641.db2.gz	BFVVFEAOTKZISI-INIZCTEOSA-N	0	3	340.389	3.197	20	30		EGEDHN
N#Cc1ccc(F)cc1CN[C@H]1CC[C@H](NC(=O)CCC2CC2)CC1	ZINC001753578889	1440439903	/nfs/dbraw/zinc/43/99/03/1440439903.db2.gz	JEDJQYQKPNFAKF-WGSAOQKQSA-N	0	3	343.446	3.405	20	30		EGEDHN
C#CCNCc1ccc(CNC(=O)Cc2cccc(Cl)c2F)cc1	ZINC001753590590	1440442676	/nfs/dbraw/zinc/44/26/76/1440442676.db2.gz	LDAASLMKCXNMPW-UHFFFAOYSA-N	0	3	344.817	3.061	20	30		EGEDHN
C#CCCCC(=O)NCc1ccc(CNCCC(F)(F)F)cc1	ZINC001753591460	1440443009	/nfs/dbraw/zinc/44/30/09/1440443009.db2.gz	ZPRZKCAPAFCRRK-UHFFFAOYSA-N	0	3	326.362	3.148	20	30		EGEDHN
C=C(C)CCC(=O)NCCC1CCN(Cc2conc2CC)CC1	ZINC001753594779	1440444251	/nfs/dbraw/zinc/44/42/51/1440444251.db2.gz	KTGUIPQSFIQKIV-UHFFFAOYSA-N	0	3	333.476	3.312	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cnc3ccccc3n2)CCCC1	ZINC001753663487	1440459431	/nfs/dbraw/zinc/45/94/31/1440459431.db2.gz	AHUSAKFGENVWNT-UHFFFAOYSA-N	0	3	344.846	3.015	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)N(C)C(=O)C[C@@H]1CC=CCC1	ZINC001753706405	1440469698	/nfs/dbraw/zinc/46/96/98/1440469698.db2.gz	NEQOGAXNCSLDFR-LSDHHAIUSA-N	0	3	331.485	3.303	20	30		EGEDHN
C[C@H](CNCC#Cc1ccccc1)N(C)C(=O)[C@@H]1CCC(C)(C)C1	ZINC001753710694	1440470646	/nfs/dbraw/zinc/47/06/46/1440470646.db2.gz	HBZGKHHFEJCITO-IEBWSBKVSA-N	0	3	326.484	3.301	20	30		EGEDHN
Cc1[nH]ccc1C(=O)N[C@@H](CNCC#Cc1ccccc1)CC(C)C	ZINC001753732193	1440476467	/nfs/dbraw/zinc/47/64/67/1440476467.db2.gz	CTBUASBOORHAKB-LJQANCHMSA-N	0	3	337.467	3.109	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCCC[C@H]1CCNCc1cc(C)ncn1	ZINC001753776113	1440486565	/nfs/dbraw/zinc/48/65/65/1440486565.db2.gz	AEULCQUWCLHWQF-SFHVURJKSA-N	0	3	344.503	3.248	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H](C)[C@H]1CNCc1c(C)noc1CC	ZINC001753820691	1440495666	/nfs/dbraw/zinc/49/56/66/1440495666.db2.gz	ZYJDASOANDXXMN-MAUKXSAKSA-N	0	3	345.487	3.066	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)c1cccs1)NCc1ccc(C#N)cc1F	ZINC001753822157	1440496780	/nfs/dbraw/zinc/49/67/80/1440496780.db2.gz	CNOHLOWDBBOGHA-MRXNPFEDSA-N	0	3	345.443	3.303	20	30		EGEDHN
CC(C)[C@H](CNC(=O)c1ccccc1)NCc1ccc(C#N)cc1F	ZINC001753822568	1440496892	/nfs/dbraw/zinc/49/68/92/1440496892.db2.gz	MHGIHUPCZSEBCM-IBGZPJMESA-N	0	3	339.414	3.242	20	30		EGEDHN
C=CCCC(=O)NC[C@@H](NCC#Cc1ccccc1Cl)C(C)C	ZINC001753826219	1440498330	/nfs/dbraw/zinc/49/83/30/1440498330.db2.gz	QXEFYXIVKGLXQH-GOSISDBHSA-N	0	3	332.875	3.388	20	30		EGEDHN
CC(C)[C@H](CNC(=O)C=C1CCC1)NCc1cc(C#N)ccc1F	ZINC001753827456	1440498788	/nfs/dbraw/zinc/49/87/88/1440498788.db2.gz	QETXKTZAYRCEBR-SFHVURJKSA-N	0	3	329.419	3.038	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cnoc1-c1ccco1)C(C)C	ZINC001753834446	1440500566	/nfs/dbraw/zinc/50/05/66/1440500566.db2.gz	MFHDUUUQPKGYAX-CYBMUJFWSA-N	0	3	337.807	3.031	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)C1(C(C)(F)F)CC1)NCC#Cc1ccccc1	ZINC001753840770	1440502536	/nfs/dbraw/zinc/50/25/36/1440502536.db2.gz	LRPQXMOKZBQHSB-QGZVFWFLSA-N	0	3	348.437	3.204	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)CCN(C)Cc2cccc3cccnc32)C1	ZINC001753863085	1440512821	/nfs/dbraw/zinc/51/28/21/1440512821.db2.gz	OWEKGYDCWQTKGB-UHFFFAOYSA-N	0	3	337.467	3.481	20	30		EGEDHN
CCCCC(=O)N1CC[C@H]2[C@@H](CCN2CC#Cc2ccc(F)cc2)C1	ZINC001753886292	1440521389	/nfs/dbraw/zinc/52/13/89/1440521389.db2.gz	UXLATHXMIKMKMC-ICSRJNTNSA-N	0	3	342.458	3.290	20	30		EGEDHN
C=C(Cl)CNCC[C@H](C)NC(=O)Cc1coc2cc(F)ccc12	ZINC001753965144	1440526486	/nfs/dbraw/zinc/52/64/86/1440526486.db2.gz	VPPOOFMHRZXIJX-LBPRGKRZSA-N	0	3	338.810	3.351	20	30		EGEDHN
C=C(Cl)CNCC[C@H](C)NC(=O)[C@H](C)Cc1cccc(F)c1	ZINC001754026875	1440533223	/nfs/dbraw/zinc/53/32/23/1440533223.db2.gz	NYXSEACAYYAQGB-OCCSQVGLSA-N	0	3	326.843	3.241	20	30		EGEDHN
C=CCC1(C(=O)N(CC)CCNCc2cnn(C(C)(C)C)c2)CCC1	ZINC001754065768	1440537376	/nfs/dbraw/zinc/53/73/76/1440537376.db2.gz	PHXQHJURXBHHLR-UHFFFAOYSA-N	0	3	346.519	3.323	20	30		EGEDHN
C[C@H]1CC(C(=O)NC/C=C\CNCc2ccc(C#N)cc2)C[C@H](C)C1	ZINC001754213962	1440551660	/nfs/dbraw/zinc/55/16/60/1440551660.db2.gz	OUKSKLSBZIAOFC-NMBNSIPYSA-N	0	3	339.483	3.393	20	30		EGEDHN
C[C@H](CNCC#Cc1cccc(Cl)c1)NC(=O)[C@H](C)C(C)(F)F	ZINC001754242044	1440556043	/nfs/dbraw/zinc/55/60/43/1440556043.db2.gz	GYSZYBQRFUFYID-OLZOCXBDSA-N	0	3	342.817	3.077	20	30		EGEDHN
CCC[C@H](C(=O)N[C@H](C)CNCc1ccc(C#N)c(F)c1)C(C)C	ZINC001754243177	1440556236	/nfs/dbraw/zinc/55/62/36/1440556236.db2.gz	CIHGPXUYHVIUHR-PBHICJAKSA-N	0	3	333.451	3.364	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccc(Cl)cc1)NC(=O)C[C@@H]1C=CCC1	ZINC001754258429	1440559613	/nfs/dbraw/zinc/55/96/13/1440559613.db2.gz	BACUBTUFYMCAAP-DOTOQJQBSA-N	0	3	330.859	3.142	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc2cc[nH]c2c1)NC(=O)C#CC(C)(C)C	ZINC001754309989	1440572749	/nfs/dbraw/zinc/57/27/49/1440572749.db2.gz	FAXIPNKQAAZKLD-OAHLLOKOSA-N	0	3	325.456	3.154	20	30		EGEDHN
C=CCOCCN(C)C[C@@H](C)NC(=O)c1cc2sccc2s1	ZINC001754314466	1440574647	/nfs/dbraw/zinc/57/46/47/1440574647.db2.gz	CQKAZMVEWYIZKQ-GFCCVEGCSA-N	0	3	338.498	3.216	20	30		EGEDHN
CC#CCCCC(=O)N[C@H](C)CN(C)Cc1ccc2c(c1)CCC2	ZINC001754322028	1440578459	/nfs/dbraw/zinc/57/84/59/1440578459.db2.gz	XJEFQHZJIZASSC-QGZVFWFLSA-N	0	3	326.484	3.305	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H](C)CN(C)Cc2ccccc2N(C)C)C1	ZINC001754323567	1440579375	/nfs/dbraw/zinc/57/93/75/1440579375.db2.gz	RZWSDNYZNKLXMK-INIZCTEOSA-N	0	3	329.488	3.045	20	30		EGEDHN
CN(CCCNCc1ccccc1C#N)C(=O)[C@H]1CCCC1(C)C	ZINC001754390380	1440594163	/nfs/dbraw/zinc/59/41/63/1440594163.db2.gz	QQKUKLLNSMBEAV-GOSISDBHSA-N	0	3	327.472	3.323	20	30		EGEDHN
C[C@@H]1CCCC[C@@H]1C(=O)N(C)CCCNCc1ccccc1C#N	ZINC001754397063	1440594712	/nfs/dbraw/zinc/59/47/12/1440594712.db2.gz	IVCCGWKPMBXZPC-APWZRJJASA-N	0	3	327.472	3.323	20	30		EGEDHN
CCCCCCCN1CC[C@@H]1CNC(=O)c1nncc2ccccc21	ZINC001754488410	1440609358	/nfs/dbraw/zinc/60/93/58/1440609358.db2.gz	CBDCXYDBRVNWIV-QGZVFWFLSA-N	0	3	340.471	3.404	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC([C@H]2CCN(Cc3nocc3C)C2)CC1	ZINC001754535903	1440624368	/nfs/dbraw/zinc/62/43/68/1440624368.db2.gz	OMFMYNCMMSJONM-SFHVURJKSA-N	0	3	345.487	3.400	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)CCOc1cccc(F)c1	ZINC001754543233	1440626579	/nfs/dbraw/zinc/62/65/79/1440626579.db2.gz	XHMDOHQZJPNWBZ-MSOLQXFVSA-N	0	3	346.446	3.236	20	30		EGEDHN
C=C[C@@](C)(O)CC(=O)N1C[C@H]2CCC[C@@H](C1)N2CCCCCCC	ZINC001754551803	1440630213	/nfs/dbraw/zinc/63/02/13/1440630213.db2.gz	QHGWUXAPKHYAIX-WSTZPKSXSA-N	0	3	336.520	3.349	20	30		EGEDHN
C#CCCCC(=O)N1CCC2(C1)CCN(CCC(F)(F)F)CC2	ZINC001754559082	1440633114	/nfs/dbraw/zinc/63/31/14/1440633114.db2.gz	BAJDJAJVLFSWOW-UHFFFAOYSA-N	0	3	330.394	3.057	20	30		EGEDHN
C=CCC[C@H](C)[N@@H+]1CC[C@]2(CCN(C(=O)c3ccccc3[O-])C2)C1	ZINC001754561842	1440633938	/nfs/dbraw/zinc/63/39/38/1440633938.db2.gz	FDQKNLSMRAAUKO-JXFKEZNVSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=CCC[C@H](C)[N@H+]1CC[C@]2(CCN(C(=O)c3ccccc3[O-])C2)C1	ZINC001754561842	1440633939	/nfs/dbraw/zinc/63/39/39/1440633939.db2.gz	FDQKNLSMRAAUKO-JXFKEZNVSA-N	0	3	328.456	3.285	20	30		EGEDHN
C#CCCCCC(=O)NC1(C)CCN(Cc2sc(C)nc2C)CC1	ZINC001754625064	1440646232	/nfs/dbraw/zinc/64/62/32/1440646232.db2.gz	INGSBRZXKWEDQJ-UHFFFAOYSA-N	0	3	347.528	3.424	20	30		EGEDHN
C#CCN(C(=O)CC)C1CCN(CCOc2c(C)cccc2C)CC1	ZINC001754632320	1440648237	/nfs/dbraw/zinc/64/82/37/1440648237.db2.gz	OSGRPHBENACOFR-UHFFFAOYSA-N	0	3	342.483	3.018	20	30		EGEDHN
C#CCN(C(C)=O)C1CCN([C@@H]2CCc3ccc(Cl)cc32)CC1	ZINC001754634140	1440648317	/nfs/dbraw/zinc/64/83/17/1440648317.db2.gz	PDVNIKIBTXBFTQ-LJQANCHMSA-N	0	3	330.859	3.273	20	30		EGEDHN
C#CCN(C(=O)/C(C)=C/C)C1CCN(Cc2sc(C)nc2C)CC1	ZINC001754636898	1440648651	/nfs/dbraw/zinc/64/86/51/1440648651.db2.gz	QPIHTQAZNSLJQL-VGOFMYFVSA-N	0	3	345.512	3.152	20	30		EGEDHN
C#CCN(C(=O)C[C@H]1CC[C@H](C)C1)C1CCN(CCOC(C)C)CC1	ZINC001754639773	1440649040	/nfs/dbraw/zinc/64/90/40/1440649040.db2.gz	VZTICUDCMCAXJQ-OALUTQOASA-N	0	3	348.531	3.164	20	30		EGEDHN
C#CCN(C(=O)C[C@@H]1CC[C@H](C)C1)C1CCN(CCOC(C)C)CC1	ZINC001754639774	1440649070	/nfs/dbraw/zinc/64/90/70/1440649070.db2.gz	VZTICUDCMCAXJQ-RBUKOAKNSA-N	0	3	348.531	3.164	20	30		EGEDHN
C#CCN(C(=O)[C@H]1CC[C@H](C)C1)C1CCN(CCOCC(C)C)CC1	ZINC001754640964	1440649128	/nfs/dbraw/zinc/64/91/28/1440649128.db2.gz	KURHNNMDVKFACE-OALUTQOASA-N	0	3	348.531	3.021	20	30		EGEDHN
CCC(C)(C)CC(=O)N1CCCC[C@@]2(CCN(CC#CCOC)C2)C1	ZINC001754662429	1440655299	/nfs/dbraw/zinc/65/52/99/1440655299.db2.gz	YZLDKWBOXQGABA-NRFANRHFSA-N	0	3	348.531	3.167	20	30		EGEDHN
C[C@]1(NC(=O)C#CC2CC2)CCN(Cc2ccc3ccccc3c2)C1	ZINC001754670231	1440657823	/nfs/dbraw/zinc/65/78/23/1440657823.db2.gz	LPDMNVLWPUKQAX-QFIPXVFZSA-N	0	3	332.447	3.334	20	30		EGEDHN
CC#CCN1CCC[C@@](C)(CNC(=O)[C@H](C)c2ccc(F)c(F)c2)C1	ZINC001754734415	1440681501	/nfs/dbraw/zinc/68/15/01/1440681501.db2.gz	VKSRCHGFSQJFIA-QRWLVFNGSA-N	0	3	348.437	3.310	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@H](CNC(=O)C2(CC(C)C)CCC2)C1	ZINC001754743788	1440683860	/nfs/dbraw/zinc/68/38/60/1440683860.db2.gz	RUMBIQFDPOJWKC-MRXNPFEDSA-N	0	3	340.458	3.300	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)C[C@H](OCC)C(C)C)C2)CC1	ZINC001754784338	1440687213	/nfs/dbraw/zinc/68/72/13/1440687213.db2.gz	UYECASLIVOBGBJ-PMACEKPBSA-N	0	3	348.531	3.021	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@]1(CO)CCCN(Cc2ccccc2C)C1	ZINC001754858154	1440700482	/nfs/dbraw/zinc/70/04/82/1440700482.db2.gz	VNDBPEOSOXHYKQ-GHTZIAJQSA-N	0	3	344.499	3.040	20	30		EGEDHN
C=C1CCC(C(=O)N[C@]2(CO)CCCN(CC/C=C\CC)C2)CC1	ZINC001754858390	1440700571	/nfs/dbraw/zinc/70/05/71/1440700571.db2.gz	ZJGXJHQHLMPFMP-BBIZLLLXSA-N	0	3	334.504	3.032	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC[C@H]2[C@H]1CCN2CCCCC(F)(F)F	ZINC001754864831	1440702499	/nfs/dbraw/zinc/70/24/99/1440702499.db2.gz	DTSHLBUIHFVLGH-JKSUJKDBSA-N	0	3	344.421	3.444	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@@H](CCNCc2ncc(C)s2)C1	ZINC001754928409	1440710243	/nfs/dbraw/zinc/71/02/43/1440710243.db2.gz	PHNLQMZHDHKOPQ-JKSUJKDBSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCN(C(=O)Cc2ccsc2C)C1	ZINC001754934796	1440711102	/nfs/dbraw/zinc/71/11/02/1440711102.db2.gz	SCFLQHQYFQWGFY-AWEZNQCLSA-N	0	3	326.893	3.180	20	30		EGEDHN
C#CCCN(C)Cc1ccccc1CNC(=O)c1ccsc1C	ZINC001754945926	1440712791	/nfs/dbraw/zinc/71/27/91/1440712791.db2.gz	NRFGFZXLXBLURG-UHFFFAOYSA-N	0	3	326.465	3.442	20	30		EGEDHN
COCC#CCN[C@@H](C)c1ccc(CNC(=O)CCC2CCC2)cc1	ZINC001754948088	1440714038	/nfs/dbraw/zinc/71/40/38/1440714038.db2.gz	VVWRMJXWZQTNSU-KRWDZBQOSA-N	0	3	342.483	3.184	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)CC(C)(C)CC(F)F)C2)CC1	ZINC001754960342	1440717373	/nfs/dbraw/zinc/71/73/73/1440717373.db2.gz	GLNSKGYGIDGYRY-UHFFFAOYSA-N	0	3	326.431	3.006	20	30		EGEDHN
CC1(C(=O)NCC2(NCc3ccc(C#N)s3)CCC2)CC=CC1	ZINC001754986148	1440722895	/nfs/dbraw/zinc/72/28/95/1440722895.db2.gz	TWIRTTWZHTUJIK-UHFFFAOYSA-N	0	3	329.469	3.105	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CCCN(C[C@H](O)c2ccccc2F)CC1	ZINC001755028806	1440730335	/nfs/dbraw/zinc/73/03/35/1440730335.db2.gz	PUYMLXBRVMYEIE-QAPCUYQASA-N	0	3	348.462	3.042	20	30		EGEDHN
C#CCCCCC(=O)N1CCC[C@@]2(CCN(CCC(F)(F)F)C2)C1	ZINC001755078211	1440749863	/nfs/dbraw/zinc/74/98/63/1440749863.db2.gz	KTKSNAVMCOVROL-KRWDZBQOSA-N	0	3	344.421	3.447	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC[C@@](CO)(NCc2ccc(C)cc2)C1	ZINC001755087350	1440751079	/nfs/dbraw/zinc/75/10/79/1440751079.db2.gz	BZNXIQJWDDZQCW-WIYYLYMNSA-N	0	3	344.499	3.040	20	30		EGEDHN
C#CCCCC(=O)N1CCC(C)(NCc2csc(C3CC3)n2)CC1	ZINC001755127300	1440756457	/nfs/dbraw/zinc/75/64/57/1440756457.db2.gz	JCZYMWVXEWBXTE-UHFFFAOYSA-N	0	3	345.512	3.295	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCN(C2CN(C[C@H](C)CC(C)C)C2)CC1	ZINC001755145676	1440762810	/nfs/dbraw/zinc/76/28/10/1440762810.db2.gz	XFWHAEXDFWAAHD-GOSISDBHSA-N	0	3	349.563	3.099	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCN1C(=O)[C@@H](C)CCOc1ccccc1	ZINC001755203582	1440781308	/nfs/dbraw/zinc/78/13/08/1440781308.db2.gz	YXZIVPHQEZNHCE-ZWKOTPCHSA-N	0	3	330.472	3.200	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H](C)[C@@H](C)NCc2ccc(C#N)s2)s1	ZINC001755222378	1440784993	/nfs/dbraw/zinc/78/49/93/1440784993.db2.gz	CNKLXWXWXXOBLR-NEPJUHHUSA-N	0	3	333.482	3.286	20	30		EGEDHN
C[C@@H](NC(=O)c1ccco1)[C@H](C)NCC#Cc1ccc(Cl)cc1	ZINC001755223280	1440785142	/nfs/dbraw/zinc/78/51/42/1440785142.db2.gz	KVJFCZYZEXAZMX-UONOGXRCSA-N	0	3	330.815	3.081	20	30		EGEDHN
C[C@@H](NCC#Cc1ccc(Cl)cc1)[C@@H](C)NC(=O)c1ccoc1	ZINC001755225639	1440785768	/nfs/dbraw/zinc/78/57/68/1440785768.db2.gz	DURAHGTYRUFMBE-ZIAGYGMSSA-N	0	3	330.815	3.081	20	30		EGEDHN
CC(C)c1cccc(CN[C@H](C)[C@@H](C)NC(=O)C#CC(C)(C)C)n1	ZINC001755251598	1440791976	/nfs/dbraw/zinc/79/19/76/1440791976.db2.gz	FPFYWMZEDWRIGU-HZPDHXFCSA-N	0	3	329.488	3.237	20	30		EGEDHN
C[C@@H](NCC#Cc1ccccc1)[C@@H](C)NC(=O)c1cccc2cc[nH]c21	ZINC001755258781	1440793930	/nfs/dbraw/zinc/79/39/30/1440793930.db2.gz	VSYNKUZCKRDPOI-IAGOWNOFSA-N	0	3	345.446	3.316	20	30		EGEDHN
C[C@@H](NC(=O)C(C)(C)C(F)(F)F)[C@H](C)NCC#Cc1ccccc1	ZINC001755262702	1440795059	/nfs/dbraw/zinc/79/50/59/1440795059.db2.gz	HOFNAGBHNNLZKA-UONOGXRCSA-N	0	3	340.389	3.109	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)C[C@@H](C)c1ccncc1	ZINC001755281719	1440800809	/nfs/dbraw/zinc/80/08/09/1440800809.db2.gz	SJJAMJLMNNOSKK-CQSZACIVSA-N	0	3	337.895	3.402	20	30		EGEDHN
C[C@H](c1ccc(F)c(Cl)c1)N(C)[C@@H](C)CNC(=O)C#CC1CC1	ZINC001755299891	1440808082	/nfs/dbraw/zinc/80/80/82/1440808082.db2.gz	IFFZIUTTYKVURI-QWHCGFSZSA-N	0	3	336.838	3.390	20	30		EGEDHN
C[C@@H](CNC(=O)C#CC1CC1)N(C)[C@@H](C)c1ccc(F)c(Cl)c1	ZINC001755299892	1440808137	/nfs/dbraw/zinc/80/81/37/1440808137.db2.gz	IFFZIUTTYKVURI-STQMWFEESA-N	0	3	336.838	3.390	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H](C)N(C)Cc2cccc(C#N)c2)CCC1	ZINC001755315778	1440815500	/nfs/dbraw/zinc/81/55/00/1440815500.db2.gz	WPABZKRSFILLTC-MRXNPFEDSA-N	0	3	325.456	3.241	20	30		EGEDHN
Cc1ccccc1CC(=O)NC[C@H](C)N(C)Cc1cccc(C#N)c1	ZINC001755326519	1440821967	/nfs/dbraw/zinc/82/19/67/1440821967.db2.gz	SAOSGTDAHGKGEZ-KRWDZBQOSA-N	0	3	335.451	3.046	20	30		EGEDHN
CC(C)[C@@H](CCN(C)C(=O)[C@@H]1C[C@H]1C)NCc1cc(F)ccc1C#N	ZINC001755341385	1440825449	/nfs/dbraw/zinc/82/54/49/1440825449.db2.gz	GUJDOXSFTPVEGY-NIKGAXFTSA-N	0	3	345.462	3.316	20	30		EGEDHN
C=C(Cl)CNCCCOC1CCN(C(=O)/C=C(\C)C2CC2)CC1	ZINC001755344327	1440826133	/nfs/dbraw/zinc/82/61/33/1440826133.db2.gz	UOWZUTHWUABQDT-WYMLVPIESA-N	0	3	340.895	3.083	20	30		EGEDHN
CCCC[C@@H](CNCc1ccc(C#N)s1)NC(=O)C1=CCCC1	ZINC001755358378	1440830632	/nfs/dbraw/zinc/83/06/32/1440830632.db2.gz	RBLVDPXNBZCRQE-HNNXBMFYSA-N	0	3	331.485	3.495	20	30		EGEDHN
CCCC[C@@H](CNCC#Cc1ccccc1)NC(=O)Cc1ccoc1	ZINC001755358786	1440830724	/nfs/dbraw/zinc/83/07/24/1440830724.db2.gz	VRGPGSWNFHMYIL-FQEVSTJZSA-N	0	3	338.451	3.138	20	30		EGEDHN
C=CCOCCN1CCCCC[C@H]1CNC(=O)c1cccc(C)c1F	ZINC001755363312	1440832902	/nfs/dbraw/zinc/83/29/02/1440832902.db2.gz	HIHYTPCWWYUMMF-KRWDZBQOSA-N	0	3	348.462	3.311	20	30		EGEDHN
C#CCCCCC(=O)N[C@H](C)C1CN(Cc2ccc3ncccc3c2)C1	ZINC001755374906	1440837896	/nfs/dbraw/zinc/83/78/96/1440837896.db2.gz	SZWBYQKKYWJSDI-QGZVFWFLSA-N	0	3	349.478	3.365	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCCOc2ccc(F)cc2)C(C)(C)C1	ZINC001755410130	1440845905	/nfs/dbraw/zinc/84/59/05/1440845905.db2.gz	LRGYJEVYMOKRND-GOSISDBHSA-N	0	3	348.462	3.387	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)[C@H](CC)Cc2cccc(C)c2)C(C)(C)C1	ZINC001755412763	1440847096	/nfs/dbraw/zinc/84/70/96/1440847096.db2.gz	XMUUKQLDCMEVTL-UXHICEINSA-N	0	3	340.511	3.414	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)CCCc2sccc2C)C(C)(C)C1	ZINC001755416210	1440848772	/nfs/dbraw/zinc/84/87/72/1440848772.db2.gz	PMVAWCBSKHCAEA-KRWDZBQOSA-N	0	3	332.513	3.229	20	30		EGEDHN
C#CCN1C[C@@H]2[C@@H](CNC(=O)[C@@H](CC3CCCCC3)C(C)C)[C@@H]2C1	ZINC001755429627	1440850974	/nfs/dbraw/zinc/85/09/74/1440850974.db2.gz	JFCFSFLSULYXCH-LWYYNNOASA-N	0	3	330.516	3.156	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC2(C1)CCCN(CCOC1CCC1)C2	ZINC001755456385	1440855652	/nfs/dbraw/zinc/85/56/52/1440855652.db2.gz	UMKWXBXYZDZMOV-UHFFFAOYSA-N	0	3	346.515	3.248	20	30		EGEDHN
CC(F)(F)C(C)(C)C(=O)N[C@H]1C[C@H](CNCc2ccccc2C#N)C1	ZINC001755482295	1440860386	/nfs/dbraw/zinc/86/03/86/1440860386.db2.gz	QDCDSESZOMUPNY-SAZUREKKSA-N	0	3	349.425	3.224	20	30		EGEDHN
C[C@@H](CCCNCc1ccc(C#N)cc1F)NC(=O)c1cccs1	ZINC001755489308	1440861350	/nfs/dbraw/zinc/86/13/50/1440861350.db2.gz	WIWAUAFZSOVUSR-ZDUSSCGKSA-N	0	3	345.443	3.447	20	30		EGEDHN
C[C@H](CCCNCc1cc(C#N)ccc1F)NC(=O)[C@@]1(C)C=CCC1	ZINC001755510855	1440863520	/nfs/dbraw/zinc/86/35/20/1440863520.db2.gz	JCONUKXSPJGGJQ-QRWLVFNGSA-N	0	3	343.446	3.428	20	30		EGEDHN
C[C@H](CCCNCc1ccccc1C#N)NC(=O)[C@@H]1CCC1(C)C	ZINC001755513877	1440863836	/nfs/dbraw/zinc/86/38/36/1440863836.db2.gz	XASQQQYIQRQAGO-QAPCUYQASA-N	0	3	327.472	3.369	20	30		EGEDHN
C=C(Cl)CNCCC[C@H](C)NC(=O)C[C@H]1OCc2ccccc21	ZINC001755523321	1440865287	/nfs/dbraw/zinc/86/52/87/1440865287.db2.gz	UKBKTLYHEVWCBT-WMLDXEAASA-N	0	3	336.863	3.275	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1CCC(N(C)Cc2ccc(C#N)s2)CC1	ZINC001755528450	1440866302	/nfs/dbraw/zinc/86/63/02/1440866302.db2.gz	MLENUMOBDHHKJK-CQSZACIVSA-N	0	3	333.501	3.479	20	30		EGEDHN
C=C(Br)CNC[C@H](C1CC1)N(C)C(=O)[C@H](C)C(C)(C)C	ZINC001755559894	1440874205	/nfs/dbraw/zinc/87/42/05/1440874205.db2.gz	LUBPCNZOUWPALK-GXTWGEPZSA-N	0	3	345.325	3.404	20	30		EGEDHN
C[C@H](NC[C@H](C1CC1)N(C)C(=O)C#CC1CC1)c1ccccc1F	ZINC001755572918	1440877523	/nfs/dbraw/zinc/87/75/23/1440877523.db2.gz	SENRYMRWQKGHIP-IFXJQAMLSA-N	0	3	328.431	3.127	20	30		EGEDHN
C[C@H](CN(C)C(=O)c1sccc1F)NCc1ccc(C#N)c(F)c1	ZINC001755584885	1440880245	/nfs/dbraw/zinc/88/02/45/1440880245.db2.gz	GDRUNSYFZSFMAO-LLVKDONJSA-N	0	3	349.406	3.148	20	30		EGEDHN
C[C@H](CN(C)C(=O)C(C)(C)C1CC1)NCc1ccc(C#N)c(F)c1	ZINC001755601853	1440884395	/nfs/dbraw/zinc/88/43/95/1440884395.db2.gz	OCMVBBCDFUJPHI-CYBMUJFWSA-N	0	3	331.435	3.070	20	30		EGEDHN
CC#CCCCC(=O)N(C)C[C@@H](C)NCc1cc(C)ccc1OC	ZINC001755602970	1440884571	/nfs/dbraw/zinc/88/45/71/1440884571.db2.gz	XXMPHZUAPRHOLY-QGZVFWFLSA-N	0	3	330.472	3.134	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@H](NCc2ccc(C#N)s2)C[C@@H]1C	ZINC001755675586	1440894410	/nfs/dbraw/zinc/89/44/10/1440894410.db2.gz	KRGBAPPWQAHPNZ-GOEBONIOSA-N	0	3	343.496	3.467	20	30		EGEDHN
C#CCN1CC[C@@]2(NC(=O)CCc3ccc(Cl)cc3)CCC[C@@H]12	ZINC001755703297	1440901187	/nfs/dbraw/zinc/90/11/87/1440901187.db2.gz	WSLYTKZJXYFIFW-MJGOQNOKSA-N	0	3	330.859	3.019	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)COc2c(C)cccc2C)[C@H]1C	ZINC001755722144	1440907983	/nfs/dbraw/zinc/90/79/83/1440907983.db2.gz	QUDWKSJYQSOSIH-QZTJIDSGSA-N	0	3	330.472	3.227	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H](CNCC#Cc2ccccc2)C(C)(C)C)cn1	ZINC001755818078	1440924843	/nfs/dbraw/zinc/92/48/43/1440924843.db2.gz	FZWKROWJYJNNDS-HXUWFJFHSA-N	0	3	349.478	3.176	20	30		EGEDHN
C=C(Cl)CNC[C@@H](NC(=O)c1c(Cl)n[nH]c1CC)C(C)(C)C	ZINC001755824727	1440926745	/nfs/dbraw/zinc/92/67/45/1440926745.db2.gz	GWYDEZKVNMQNJQ-LLVKDONJSA-N	0	3	347.290	3.112	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H](CNCc1cccc(OC)n1)C(C)(C)C	ZINC001755824648	1440926743	/nfs/dbraw/zinc/92/67/43/1440926743.db2.gz	FILQSXOQIHOFPC-MRXNPFEDSA-N	0	3	347.503	3.313	20	30		EGEDHN
CC(C)(C)[C@H](CNCC#Cc1ccccc1)NC(=O)[C@]12C[C@H]1CCC2	ZINC001755828702	1440927941	/nfs/dbraw/zinc/92/79/41/1440927941.db2.gz	NUIKMRAYZXJBNI-XQBPLPMBSA-N	0	3	338.495	3.349	20	30		EGEDHN
C=C(Br)CNC[C@@H](NC(=O)[C@@H]1C[C@H]1CCC)C(C)(C)C	ZINC001755832224	1440928976	/nfs/dbraw/zinc/92/89/76/1440928976.db2.gz	ITODVGCUTKVAOP-MGPQQGTHSA-N	0	3	345.325	3.452	20	30		EGEDHN
C=C(Br)CNC1CC(N(C)C(=O)[C@](C)(F)CCCC)C1	ZINC001755858420	1440936228	/nfs/dbraw/zinc/93/62/28/1440936228.db2.gz	BYOLIIQCHPCXSL-SSDMNJCBSA-N	0	3	349.288	3.392	20	30		EGEDHN
C#CCCCCC(=O)N(C)C1CC(NCc2oc(C(C)C)nc2C)C1	ZINC001755855167	1440935755	/nfs/dbraw/zinc/93/57/55/1440935755.db2.gz	HMWBFYDOPXASIJ-UHFFFAOYSA-N	0	3	345.487	3.379	20	30		EGEDHN
C#CCCCC(=O)N(C)C1CC(N[C@H](C)c2ccc(F)cc2F)C1	ZINC001755856255	1440935927	/nfs/dbraw/zinc/93/59/27/1440935927.db2.gz	RMYWCSCYTGOSJC-IUDNXUCKSA-N	0	3	334.410	3.408	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N(C)C1CC(NCc2ccc(C#N)cc2F)C1	ZINC001755859845	1440936535	/nfs/dbraw/zinc/93/65/35/1440936535.db2.gz	ISXADJJBQLRJNC-NNGSBXSVSA-N	0	3	343.446	3.379	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N(C)C1CC(NCc2cccc(Cl)n2)C1	ZINC001755861509	1440936848	/nfs/dbraw/zinc/93/68/48/1440936848.db2.gz	XZEDWUQUAGNDRU-JTTJXQCZSA-N	0	3	335.879	3.416	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC1=CCN(C[C@@H]2CC(C)(C)CO2)CC1	ZINC001755894528	1440942311	/nfs/dbraw/zinc/94/23/11/1440942311.db2.gz	SDRWFFSBHRSADL-KRWDZBQOSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=CCC1(C(=O)NCC2=CCN(C[C@@H]3CCCCO3)CC2)CCCC1	ZINC001755899149	1440943462	/nfs/dbraw/zinc/94/34/62/1440943462.db2.gz	JIDDMQUQXVEEEY-IBGZPJMESA-N	0	3	346.515	3.440	20	30		EGEDHN
Cc1cc(C#N)ccc1CN[C@H](Cc1ccccc1)[C@H](O)C(F)(F)F	ZINC001648156197	1126250169	/nfs/dbraw/zinc/25/01/69/1126250169.db2.gz	RHOVQLZYRFMZAV-MSOLQXFVSA-N	0	3	348.368	3.491	20	30		EGEDHN
CCc1ccc([C@H](CN2CCOCC2)NCc2cccc(C#N)c2)cc1	ZINC000183343816	529722907	/nfs/dbraw/zinc/72/29/07/529722907.db2.gz	WGUCRQXDRJAEHJ-QFIPXVFZSA-N	0	3	349.478	3.284	20	30		EGEDHN
C#CCN1CCC(C(=O)NC(C)(C)Cc2ccccc2Cl)CC1	ZINC000264107234	201210362	/nfs/dbraw/zinc/21/03/62/201210362.db2.gz	LNYIWAKXHHWOGY-UHFFFAOYSA-N	0	3	332.875	3.123	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)Cc2ccc(F)cc2F)CC1	ZINC000264369319	201211219	/nfs/dbraw/zinc/21/12/19/201211219.db2.gz	IPYOBDHCZGFPRD-UHFFFAOYSA-N	0	3	337.414	3.147	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(Oc3ccccn3)cc2)CC1	ZINC000265040362	201213595	/nfs/dbraw/zinc/21/35/95/201213595.db2.gz	DFXGLWFPQOPXRJ-UHFFFAOYSA-N	0	3	335.407	3.158	20	30		EGEDHN
C=CCN1CCC(Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1	ZINC000266317041	201218268	/nfs/dbraw/zinc/21/82/68/201218268.db2.gz	FDSQAWKATVEETC-UHFFFAOYSA-N	0	3	327.331	3.259	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN(C)C2CCN(C(C)C)CC2)c1C	ZINC000267267527	201221437	/nfs/dbraw/zinc/22/14/37/201221437.db2.gz	ROTHVRMDDOSABJ-UHFFFAOYSA-N	0	3	331.504	3.278	20	30		EGEDHN
Cc1nnc(N[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)c(C#N)c1C	ZINC000267538679	201223611	/nfs/dbraw/zinc/22/36/11/201223611.db2.gz	ZXJKOQPIYLCZMP-KBXCAEBGSA-N	0	3	335.455	3.430	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H](c1cccc(OC)c1)N(CC)CC	ZINC000271338430	201243413	/nfs/dbraw/zinc/24/34/13/201243413.db2.gz	CFZOBCXWJHZZIT-IBGZPJMESA-N	0	3	330.472	3.388	20	30		EGEDHN
C=CCN(C(=O)NC[C@H]1CCCN(Cc2cccs2)C1)C1CC1	ZINC000271598165	201244008	/nfs/dbraw/zinc/24/40/08/201244008.db2.gz	UXFCCSPQMJKVJM-OAHLLOKOSA-N	0	3	333.501	3.320	20	30		EGEDHN
C#CCOc1ccc(CNCc2cccc(OCCCOC)c2)cc1	ZINC000269765783	201233051	/nfs/dbraw/zinc/23/30/51/201233051.db2.gz	FJFURWMGPBQDAR-UHFFFAOYSA-N	0	3	339.435	3.404	20	30		EGEDHN
C=CCCOCCNCc1ccc(OCc2ccncc2)c(OC)c1	ZINC000270242967	201237826	/nfs/dbraw/zinc/23/78/26/201237826.db2.gz	SIEJRDKEHLGDDO-UHFFFAOYSA-N	0	3	342.439	3.352	20	30		EGEDHN
C=CCOc1ccccc1CNC1CCN(c2nccs2)CC1	ZINC000272853493	201257737	/nfs/dbraw/zinc/25/77/37/201257737.db2.gz	JWBVWKRQGVIXRT-UHFFFAOYSA-N	0	3	329.469	3.467	20	30		EGEDHN
C=CCN1CCC(N[C@@H](C)c2cc(Br)ncc2F)CC1	ZINC000273838972	201263024	/nfs/dbraw/zinc/26/30/24/201263024.db2.gz	HMFPZIVFEMFODH-NSHDSACASA-N	0	3	342.256	3.284	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](CN(C)Cc2scnc2C)C1	ZINC000275941870	201287928	/nfs/dbraw/zinc/28/79/28/201287928.db2.gz	DZEZWUWQSBXVMW-MAUKXSAKSA-N	0	3	335.517	3.334	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cnn(CCC(C)C)c2CC)CC1	ZINC000277179945	201300062	/nfs/dbraw/zinc/30/00/62/201300062.db2.gz	CBWCRQZLWHBGBI-UHFFFAOYSA-N	0	3	347.507	3.264	20	30		EGEDHN
C#CCN1CCC(C(=O)NCc2ccc(-c3ccco3)cc2F)CC1	ZINC000279262491	201315686	/nfs/dbraw/zinc/31/56/86/201315686.db2.gz	UEKACLOFPBZKBY-UHFFFAOYSA-N	0	3	340.398	3.047	20	30		EGEDHN
Cc1ccc(CN2CCCC2)cc1NC(=O)COc1ccc(C#N)cc1	ZINC000128663363	205156436	/nfs/dbraw/zinc/15/64/36/205156436.db2.gz	VNYXCWWCUJFAQX-UHFFFAOYSA-N	0	3	349.434	3.480	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(COC3CCCC3)cc2)CC1	ZINC000157705321	205240023	/nfs/dbraw/zinc/24/00/23/205240023.db2.gz	QFHALRFJEBTRBV-UHFFFAOYSA-N	0	3	340.467	3.430	20	30		EGEDHN
N#Cc1ccc(CNCc2cccc(CN3CCCC3=O)c2)s1	ZINC000176947134	207277466	/nfs/dbraw/zinc/27/74/66/207277466.db2.gz	CZNLECHYQYPIGF-UHFFFAOYSA-N	0	3	325.437	3.032	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN2CCC([C@@H](O)c3ccccc3)CC2)cc1	ZINC000268736561	252185623	/nfs/dbraw/zinc/18/56/23/252185623.db2.gz	YMKGQWZRRJVXKO-SFTDATJTSA-N	0	3	336.435	3.037	20	30		EGEDHN
CCN(C(=O)c1cccc(C#N)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000186323465	144130163	/nfs/dbraw/zinc/13/01/63/144130163.db2.gz	GJYYBJHCHOLGAH-FQEVSTJZSA-N	0	3	333.435	3.295	20	30		EGEDHN
N#Cc1ccc(CNCCCc2ccc3c(c2)OCCO3)c(F)c1	ZINC000344785981	144224688	/nfs/dbraw/zinc/22/46/88/144224688.db2.gz	CKTIDKMTYIIXBQ-UHFFFAOYSA-N	0	3	326.371	3.191	20	30		EGEDHN
N#Cc1ccc(OC2CCN(CCCO[C@@H]3CCCCO3)CC2)cc1	ZINC000374882031	144560780	/nfs/dbraw/zinc/56/07/80/144560780.db2.gz	VINNRNSUNOZVNB-HXUWFJFHSA-N	0	3	344.455	3.335	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccc(F)c(C#N)c2)C1	ZINC000341101263	155157309	/nfs/dbraw/zinc/15/73/09/155157309.db2.gz	DRRBSGHPBOYSDT-KDOFPFPSSA-N	0	3	337.398	3.263	20	30		EGEDHN
COc1ccccc1-n1nccc1CNCCc1cccc(C#N)c1	ZINC000341493861	155324110	/nfs/dbraw/zinc/32/41/10/155324110.db2.gz	XAZHGELITACGNK-UHFFFAOYSA-N	0	3	332.407	3.085	20	30		EGEDHN
CCCCNC(=O)[C@H]1CC[C@@H](C)N(Cc2ccc(C#N)cc2OC)C1	ZINC000120711117	152295865	/nfs/dbraw/zinc/29/58/65/152295865.db2.gz	HSQIUZQYLHGHEE-QAPCUYQASA-N	0	3	343.471	3.084	20	30		EGEDHN
CC(C)C[C@@]1(CO)CCCN1CC(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000191664146	153215218	/nfs/dbraw/zinc/21/52/18/153215218.db2.gz	JCEIIMRNDQJQEU-GOSISDBHSA-N	0	3	349.862	3.023	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCNC2(c3cccc(C#N)c3)CC2)cc1	ZINC000271863371	154001533	/nfs/dbraw/zinc/00/15/33/154001533.db2.gz	ZWKZFHCTLKYNGD-UHFFFAOYSA-N	0	3	330.391	3.037	20	30		EGEDHN
N#Cc1ccc(C(=O)N2C[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C2)cc1	ZINC000312071674	154151403	/nfs/dbraw/zinc/15/14/03/154151403.db2.gz	OAHJUZNURAGQPO-LEWJYISDSA-N	0	3	345.446	3.152	20	30		EGEDHN
Cc1nc2ccccn2c1CN(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000348896889	156278954	/nfs/dbraw/zinc/27/89/54/156278954.db2.gz	UVOIPWNURANUQW-UHFFFAOYSA-N	0	3	347.466	3.078	20	30		EGEDHN
N#Cc1ccc(CN(CCC(=O)Nc2cccc(C#N)c2)C2CC2)cc1	ZINC000344107262	164104381	/nfs/dbraw/zinc/10/43/81/164104381.db2.gz	JETOOFTYGJMIPE-UHFFFAOYSA-N	0	3	344.418	3.423	20	30		EGEDHN
COc1cccc(N2C[C@@H](N[C@H](C)c3ccc(C#N)cc3)CC2=O)c1	ZINC000344171377	164119984	/nfs/dbraw/zinc/11/99/84/164119984.db2.gz	OCFJPHLMACRRNF-PBHICJAKSA-N	0	3	335.407	3.023	20	30		EGEDHN
Cc1cc(CN2CCC[C@H](c3nnc4ccccn43)C2)ccc1C#N	ZINC000488105419	269913535	/nfs/dbraw/zinc/91/35/35/269913535.db2.gz	VJJWGRAYGOYQDX-SFHVURJKSA-N	0	3	331.423	3.289	20	30		EGEDHN
COc1ccc(CN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)cc1	ZINC000299654076	270043432	/nfs/dbraw/zinc/04/34/32/270043432.db2.gz	QEJKNPNPORKDBN-UHFFFAOYSA-N	0	3	349.434	3.418	20	30		EGEDHN
N#Cc1ccc(Oc2cccc(NC(=O)N3CCCNCC3)c2)cc1	ZINC000415147660	270047789	/nfs/dbraw/zinc/04/77/89/270047789.db2.gz	IGJDXGANEGJRGY-UHFFFAOYSA-N	0	3	336.395	3.178	20	30		EGEDHN
C[C@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1ccc(-n2cnnn2)cc1	ZINC000417360048	270048238	/nfs/dbraw/zinc/04/82/38/270048238.db2.gz	HKZXVLCUIAQMRZ-VBKZILBWSA-N	0	3	344.422	3.262	20	30		EGEDHN
N#Cc1cccc(N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)c1[N+](=O)[O-]	ZINC000425275236	270049066	/nfs/dbraw/zinc/04/90/66/270049066.db2.gz	NIKKXPUYQZPCJR-PKOBYXMFSA-N	0	3	348.406	3.177	20	30		EGEDHN
Cc1cccc(OC[C@@H](O)CN2CC=C(c3ccc(C#N)cc3)CC2)c1	ZINC000502505963	270058819	/nfs/dbraw/zinc/05/88/19/270058819.db2.gz	IQPMMCMSHWBDAM-NRFANRHFSA-N	0	3	348.446	3.396	20	30		EGEDHN
C[C@H](N[C@@H](C)c1ccc2n[nH]cc2c1)C(=O)Nc1cccc(C#N)c1	ZINC000507267256	270058835	/nfs/dbraw/zinc/05/88/35/270058835.db2.gz	WWYKWFWEKJJNNP-STQMWFEESA-N	0	3	333.395	3.112	20	30		EGEDHN
CCC[C@H](C)NC(=O)[C@H]1CCCN(Cc2ccc(C#N)c(OC)c2)C1	ZINC000282482385	266077098	/nfs/dbraw/zinc/07/70/98/266077098.db2.gz	WXLVCFOENVUGGF-YJBOKZPZSA-N	0	3	343.471	3.084	20	30		EGEDHN
CC(=O)NCCCN(Cc1ccc(C#N)cc1)Cc1cccc(F)c1	ZINC000194291959	266105481	/nfs/dbraw/zinc/10/54/81/266105481.db2.gz	SLYKZEBBXKOMMZ-UHFFFAOYSA-N	0	3	339.414	3.226	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)c1cc(C#N)oc1C)c1ccccc1	ZINC000280529939	266119899	/nfs/dbraw/zinc/11/98/99/266119899.db2.gz	GUFRAUIRGYRKHL-SFHVURJKSA-N	0	3	325.412	3.273	20	30		EGEDHN
CCN(CC)[C@H](CNCc1ccc(C#N)c(OC)c1)c1ccco1	ZINC000281469681	266120101	/nfs/dbraw/zinc/12/01/01/266120101.db2.gz	BKPBPAOXGQBKIF-QGZVFWFLSA-N	0	3	327.428	3.333	20	30		EGEDHN
CCO[C@H](CNC(=O)C(C#N)Cc1ccc(C#N)cc1)c1ccccc1	ZINC000279912268	266300462	/nfs/dbraw/zinc/30/04/62/266300462.db2.gz	FJPNEHGMAXOHRB-WOJBJXKFSA-N	0	3	347.418	3.135	20	30		EGEDHN
CCS[C@@H]1CCC[C@@H]1N[C@H](C)C(=O)Nc1oc(C)c(C)c1C#N	ZINC000286013071	266346222	/nfs/dbraw/zinc/34/62/22/266346222.db2.gz	GYEBOVMFBBLANA-BYCMXARLSA-N	0	3	335.473	3.359	20	30		EGEDHN
Cc1cc(CN(C)C)cc(NC(=O)[C@H](C)Oc2ccc(C#N)cc2)c1	ZINC000270404587	266507469	/nfs/dbraw/zinc/50/74/69/266507469.db2.gz	XPDFCKFFCUXMDZ-HNNXBMFYSA-N	0	3	337.423	3.334	20	30		EGEDHN
CCCCN(C)CCNC(=O)N(Cc1ccc(C#N)cc1)CC(C)C	ZINC000491060165	267005893	/nfs/dbraw/zinc/00/58/93/267005893.db2.gz	NBQKPFZQWGCWGC-UHFFFAOYSA-N	0	3	344.503	3.458	20	30		EGEDHN
CCOC(=O)C(C)(C)C1CCN(CCOc2cccc(C#N)c2)CC1	ZINC000510075979	267112652	/nfs/dbraw/zinc/11/26/52/267112652.db2.gz	YTAHQNLUYBTNLY-UHFFFAOYSA-N	0	3	344.455	3.238	20	30		EGEDHN
CCOC(=O)N1CCC[C@@H]([C@@H](C)NCc2cc(C#N)ccc2F)C1	ZINC000495521677	267122129	/nfs/dbraw/zinc/12/21/29/267122129.db2.gz	WUMHNDUYGTXZLX-UKRRQHHQSA-N	0	3	333.407	3.044	20	30		EGEDHN
CCOC(=O)Nc1ccc(NCc2cnccc2N(C)C)cc1C#N	ZINC000496143364	267129737	/nfs/dbraw/zinc/12/97/37/267129737.db2.gz	WEPLODYXCHCHHE-UHFFFAOYSA-N	0	3	339.399	3.200	20	30		EGEDHN
C[C@H](NC(=O)NCc1cccc(C#N)c1)[C@@H](c1ccccc1)N(C)C	ZINC000286944747	267174527	/nfs/dbraw/zinc/17/45/27/267174527.db2.gz	CPKOBGBQWACXFR-KXBFYZLASA-N	0	3	336.439	3.049	20	30		EGEDHN
CC[C@@H](NC[C@H]1CN(Cc2ccccc2)CCO1)c1ccc(C#N)cc1	ZINC000447511407	267194637	/nfs/dbraw/zinc/19/46/37/267194637.db2.gz	UDCFUEUMABKKQK-FCHUYYIVSA-N	0	3	349.478	3.500	20	30		EGEDHN
CC[C@]1(O)CCN(Cc2cccc(OCc3cccc(C#N)c3)c2)C1	ZINC000428449027	267241631	/nfs/dbraw/zinc/24/16/31/267241631.db2.gz	QOJNHDDPOYHVDU-NRFANRHFSA-N	0	3	336.435	3.484	20	30		EGEDHN
CN(C(=O)[C@H]1CCN(Cc2cc(C#N)cs2)C1)c1ccccc1	ZINC000430875620	267277063	/nfs/dbraw/zinc/27/70/63/267277063.db2.gz	AJOYPCQMLQMAMC-HNNXBMFYSA-N	0	3	325.437	3.105	20	30		EGEDHN
COc1cc(CN2C[C@@H](C)NCc3ccc(F)cc32)ccc1C#N	ZINC000414874296	267584283	/nfs/dbraw/zinc/58/42/83/267584283.db2.gz	SGBIALXPJFFGBJ-CYBMUJFWSA-N	0	3	325.387	3.204	20	30		EGEDHN
Cc1cccc(C2=CCN(C[C@H](O)COc3ccccc3C#N)CC2)c1	ZINC000528428935	268051056	/nfs/dbraw/zinc/05/10/56/268051056.db2.gz	DAGIOYPDQUVNJF-NRFANRHFSA-N	0	3	348.446	3.396	20	30		EGEDHN
N#Cc1ccc(CNC(=O)CN[C@@H]2CCC[C@@H]2c2ccccc2)cc1	ZINC000275674571	268068053	/nfs/dbraw/zinc/06/80/53/268068053.db2.gz	XUICREGDSVWLNM-WOJBJXKFSA-N	0	3	333.435	3.100	20	30		EGEDHN
N#Cc1ccc(CNC[C@@]2(Cc3ccc(F)cc3)CCC[C@H]2O)o1	ZINC000277423339	268074441	/nfs/dbraw/zinc/07/44/41/268074441.db2.gz	GVLMGXXZAPWHRS-MOPGFXCFSA-N	0	3	328.387	3.154	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CCc3c(Cl)cccc3C2)cc1	ZINC000348298642	268083679	/nfs/dbraw/zinc/08/36/79/268083679.db2.gz	RZNIAINTNGDVJX-KRWDZBQOSA-N	0	3	349.821	3.479	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CC[C@H](c3ccccc3F)C2)cc1	ZINC000280214657	268083909	/nfs/dbraw/zinc/08/39/09/268083909.db2.gz	AIIDTSBTZMMABR-ROUUACIJSA-N	0	3	347.393	3.396	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCC2(C(F)(F)F)CCC2)cc1	ZINC000343196571	268089833	/nfs/dbraw/zinc/08/98/33/268089833.db2.gz	METGLQPLZLDIKY-CQSZACIVSA-N	0	3	335.329	3.089	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CCc3c(Cl)cccc3C2)cc1	ZINC000348298643	268089995	/nfs/dbraw/zinc/08/99/95/268089995.db2.gz	RZNIAINTNGDVJX-QGZVFWFLSA-N	0	3	349.821	3.479	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCCCc2ccccc2F)cc1	ZINC000280317842	268090942	/nfs/dbraw/zinc/09/09/42/268090942.db2.gz	UQUDFXNLKWFPEF-GOSISDBHSA-N	0	3	335.382	3.129	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@@H]2CCCc3c(O)cccc32)cc1	ZINC000352084423	268092395	/nfs/dbraw/zinc/09/23/95/268092395.db2.gz	KSYTUWPFIYFAFJ-VQIMIIECSA-N	0	3	345.402	3.140	20	30		EGEDHN
Cn1cc(CN2CC[C@H](c3cccnc3)C2)c(-c2ccc(C#N)cc2)n1	ZINC000515379487	268127188	/nfs/dbraw/zinc/12/71/88/268127188.db2.gz	CACZFFCTDLFTIR-IBGZPJMESA-N	0	3	343.434	3.343	20	30		EGEDHN
N#Cc1cccc(OCCN[C@@H](c2ccccc2)C2(CO)CCC2)c1	ZINC000433318272	268285384	/nfs/dbraw/zinc/28/53/84/268285384.db2.gz	KZCYYULDUSPDRS-FQEVSTJZSA-N	0	3	336.435	3.431	20	30		EGEDHN
CCN1CCC(n2nccc2NC(=O)/C=C\c2ccc(C#N)cc2)CC1	ZINC000491465955	269654462	/nfs/dbraw/zinc/65/44/62/269654462.db2.gz	ULKUDZBURSQXBV-FPLPWBNLSA-N	0	3	349.438	3.063	20	30		EGEDHN
COc1ccc(CN2CCCN3c4ccccc4C[C@@H]3C2)cc1C#N	ZINC000352006876	274108921	/nfs/dbraw/zinc/10/89/21/274108921.db2.gz	KLZDAZOGSWRESJ-LJQANCHMSA-N	0	3	333.435	3.204	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)C[C@H](O)COc1ccc(F)cc1	ZINC000047740003	275143282	/nfs/dbraw/zinc/14/32/82/275143282.db2.gz	IEPKYSBPRCERHK-IBGZPJMESA-N	0	3	342.414	3.349	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NC[C@@H](c1ccccc1)N1CCCC1)OCC	ZINC000270155458	275418657	/nfs/dbraw/zinc/41/86/57/275418657.db2.gz	XGBYDRZOTGRDAM-RBUKOAKNSA-N	0	3	330.472	3.311	20	30		EGEDHN
CC(C)(C)N1C[C@@H](N[C@H]2CCCCc3cc(C#N)ccc32)CC1=O	ZINC000360664321	275513906	/nfs/dbraw/zinc/51/39/06/275513906.db2.gz	PAQBXWRXSYBUTA-WMZOPIPTSA-N	0	3	325.456	3.315	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)c1cc2ccccn2c1	ZINC000074223391	307391783	/nfs/dbraw/zinc/39/17/83/307391783.db2.gz	OTDZUIUHQLEXBL-UHFFFAOYSA-N	0	3	346.434	3.015	20	30		EGEDHN
C=CCC[C@@H](O)CN(C)Cc1cc(OC)c(OC)cc1SC	ZINC000130804360	454218797	/nfs/dbraw/zinc/21/87/97/454218797.db2.gz	ULXIRORXMXRQIV-CQSZACIVSA-N	0	3	325.474	3.185	20	30		EGEDHN
CC[C@H](CN1CCN(c2nccnc2C#N)C[C@H]1C)c1ccccc1	ZINC000537704749	314203987	/nfs/dbraw/zinc/20/39/87/314203987.db2.gz	CDYAGAUDIXTRFK-IAGOWNOFSA-N	0	3	335.455	3.053	20	30		EGEDHN
N#Cc1cccc(CNC(=O)CNC2(c3ccccc3)CCCC2)c1	ZINC000539298113	314305472	/nfs/dbraw/zinc/30/54/72/314305472.db2.gz	OWEPYLMNJLBCID-UHFFFAOYSA-N	0	3	333.435	3.234	20	30		EGEDHN
C[C@@H]1CSC[C@@H]1NCC(=O)Nc1sc2c(c1C#N)CCCCC2	ZINC000552006364	315187609	/nfs/dbraw/zinc/18/76/09/315187609.db2.gz	LLKZEDYGHPOUKD-RISCZKNCSA-N	0	3	349.525	3.168	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@H](N[C@H]1CCCN(C3CCCCC3)C1=O)CC2	ZINC000555002990	315361324	/nfs/dbraw/zinc/36/13/24/315361324.db2.gz	MQECROHOUUXEDX-UXHICEINSA-N	0	3	337.467	3.459	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2NC[C@@H](O)COCc1ccccc1	ZINC000564857435	316219699	/nfs/dbraw/zinc/21/96/99/316219699.db2.gz	MILNNMHDYINJTC-TZIWHRDSSA-N	0	3	336.435	3.103	20	30		EGEDHN
C[C@H]1CN(Cc2cnc3c(C#N)cnn3c2)CC[C@@H]1c1ccccc1	ZINC000564989634	316242980	/nfs/dbraw/zinc/24/29/80/316242980.db2.gz	VHEJTZMEJSPTAM-KXBFYZLASA-N	0	3	331.423	3.227	20	30		EGEDHN
C[C@@H]1CN(Cc2cnc3c(C#N)cnn3c2)CC[C@@H]1c1ccccc1	ZINC000564989631	316243016	/nfs/dbraw/zinc/24/30/16/316243016.db2.gz	VHEJTZMEJSPTAM-BEFAXECRSA-N	0	3	331.423	3.227	20	30		EGEDHN
C[C@@H]1CCCC[C@@H]1CCNCCS(=O)(=O)c1ccc(C#N)cc1	ZINC000568502089	316783810	/nfs/dbraw/zinc/78/38/10/316783810.db2.gz	FHCXGDFKZGYPSC-NVXWUHKLSA-N	0	3	334.485	3.138	20	30		EGEDHN
Cc1cc(CN[C@H]2CCN(C(=O)Nc3ccccc3)C2)ccc1C#N	ZINC000572061647	317285539	/nfs/dbraw/zinc/28/55/39/317285539.db2.gz	VPKKJTBHOPIWAC-IBGZPJMESA-N	0	3	334.423	3.263	20	30		EGEDHN
CC[C@H](CSc1ccccc1)NCc1cnc2c(C#N)cnn2c1	ZINC000572722089	317381576	/nfs/dbraw/zinc/38/15/76/317381576.db2.gz	POKKTJFQJVHTIX-MRXNPFEDSA-N	0	3	337.452	3.261	20	30		EGEDHN
COc1cc(OC)cc(N2CC[C@H](NCc3cc(C#N)cs3)C2)c1	ZINC000174930873	323313177	/nfs/dbraw/zinc/31/31/77/323313177.db2.gz	FFWTVBLHFSKRLN-AWEZNQCLSA-N	0	3	343.452	3.005	20	30		EGEDHN
N#Cc1ccc(N2CCC(N[C@H]3COc4ccc(F)cc43)CC2)cc1	ZINC000578213007	324936122	/nfs/dbraw/zinc/93/61/22/324936122.db2.gz	SZCITDBUCJYPTI-IBGZPJMESA-N	0	3	337.398	3.389	20	30		EGEDHN
C[C@@H](CCc1cccc(F)c1)N1CCN(c2cnccc2C#N)CC1	ZINC000579187319	325072479	/nfs/dbraw/zinc/07/24/79/325072479.db2.gz	PMHNMGXZXVEYCZ-INIZCTEOSA-N	0	3	338.430	3.236	20	30		EGEDHN
CC(C)[C@@H]1CCC[C@H](NCCS(=O)(=O)c2ccc(C#N)cc2)C1	ZINC000580947695	325312738	/nfs/dbraw/zinc/31/27/38/325312738.db2.gz	YMEIDZJFKMHKLC-SJORKVTESA-N	0	3	334.485	3.136	20	30		EGEDHN
N#Cc1cnn2cc(CN3CCC[C@@H](Cc4ccccc4)C3)cnc12	ZINC000581311264	325351042	/nfs/dbraw/zinc/35/10/42/325351042.db2.gz	STGBDOZXYQWBOZ-KRWDZBQOSA-N	0	3	331.423	3.056	20	30		EGEDHN
C[C@H](N[C@H]1CCO[C@H](c2ccnn2C)C1)c1ccc(C#N)cc1F	ZINC000583363933	325517174	/nfs/dbraw/zinc/51/71/74/325517174.db2.gz	PUNCTZCVERWBIA-YEWDVWPNSA-N	0	3	328.391	3.002	20	30		EGEDHN
N#Cc1ccc([C@H](N[C@H]2CC[C@@H](c3cccc(F)c3)C2)C(N)=O)cc1	ZINC000583969650	325565533	/nfs/dbraw/zinc/56/55/33/325565533.db2.gz	SPJWWXSOWVVDIR-NEWSRXKRSA-N	0	3	337.398	3.150	20	30		EGEDHN
N#Cc1ccc([C@H](N[C@@H]2CC[C@@H](c3cccc(F)c3)C2)C(N)=O)cc1	ZINC000583969651	325565677	/nfs/dbraw/zinc/56/56/77/325565677.db2.gz	SPJWWXSOWVVDIR-QRQLOZEOSA-N	0	3	337.398	3.150	20	30		EGEDHN
CCCN(CC(F)(F)F)C(=O)[C@H]1CCCN([C@H](C)CCC#N)C1	ZINC000411287814	457849135	/nfs/dbraw/zinc/84/91/35/457849135.db2.gz	BGMTWSGMMKAYEP-KGLIPLIRSA-N	0	3	333.398	3.192	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@H]1NC[C@@H](C#N)CCC#N	ZINC000496043336	459047844	/nfs/dbraw/zinc/04/78/44/459047844.db2.gz	JPGMNXBECFQBLE-OWCLPIDISA-N	0	3	334.464	3.103	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@@H](C)N[C@H](C)c1cccc(-n2cccn2)c1	ZINC000173202798	455247022	/nfs/dbraw/zinc/24/70/22/455247022.db2.gz	SFBCQWGXJUEZOS-IAGOWNOFSA-N	0	3	338.455	3.112	20	30		EGEDHN
C=CCCSCCN[C@@H](C)c1cccc(NS(C)(=O)=O)c1	ZINC000595061041	459231626	/nfs/dbraw/zinc/23/16/26/459231626.db2.gz	XIQOYVSYCAPFRY-ZDUSSCGKSA-N	0	3	328.503	3.018	20	30		EGEDHN
C#CCCCNC(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000173318369	455265010	/nfs/dbraw/zinc/26/50/10/455265010.db2.gz	FMIURECGSYJRGX-HKUYNNGSSA-N	0	3	327.472	3.094	20	30		EGEDHN
C=CC[C@@H](CC)NCCS(=O)(=O)c1cccc(Br)c1	ZINC000572394799	459579547	/nfs/dbraw/zinc/57/95/47/459579547.db2.gz	VJGNGUVCQKJGJE-CYBMUJFWSA-N	0	3	346.290	3.167	20	30		EGEDHN
C[C@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccc(OCC#N)cc1	ZINC000183317564	455276437	/nfs/dbraw/zinc/27/64/37/455276437.db2.gz	XTVQICWMAHDDGL-GOEBONIOSA-N	0	3	345.443	3.249	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN[C@@H](C[C@H]1CCOC1)c1ccccc1	ZINC000181203926	455302240	/nfs/dbraw/zinc/30/22/40/455302240.db2.gz	NUFRKGPWBBRABS-MJGOQNOKSA-N	0	3	330.472	3.169	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ncoc2-c2ccc(C)cc2)CC1	ZINC000173580225	455310169	/nfs/dbraw/zinc/31/01/69/455310169.db2.gz	CUDHBSVWULBOAN-UHFFFAOYSA-N	0	3	339.439	3.420	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CNCc1cc2c(s1)CCCC2	ZINC000600715167	460576651	/nfs/dbraw/zinc/57/66/51/460576651.db2.gz	GCSRYYREWJDNQC-INIZCTEOSA-N	0	3	342.464	3.028	20	30		EGEDHN
Cc1ccc([C@@H](C)N[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)s1	ZINC000190603981	455350680	/nfs/dbraw/zinc/35/06/80/455350680.db2.gz	KBHHPFUKBYJFQC-RHSMWYFYSA-N	0	3	339.464	3.380	20	30		EGEDHN
C=CCOc1c(Cl)cc(CNC[C@@H](O)C2CCC2)cc1OC	ZINC000623542482	460603830	/nfs/dbraw/zinc/60/38/30/460603830.db2.gz	CFXVYHLSDYMYKX-OAHLLOKOSA-N	0	3	325.836	3.164	20	30		EGEDHN
CCc1ccc(CN(C)C[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000025866946	453788399	/nfs/dbraw/zinc/78/83/99/453788399.db2.gz	IGFXZQNJYGCBSS-FQEVSTJZSA-N	0	3	338.451	3.187	20	30		EGEDHN
CCc1ccccc1CC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000190721180	455374369	/nfs/dbraw/zinc/37/43/69/455374369.db2.gz	GYYRMRDTEANULT-UHFFFAOYSA-N	0	3	349.478	3.254	20	30		EGEDHN
CCN(Cc1ccc(CN(C)C)cc1)C(=O)c1cccc(CC#N)c1	ZINC000066726095	453867969	/nfs/dbraw/zinc/86/79/69/453867969.db2.gz	TZLWSJKJNQXXPI-UHFFFAOYSA-N	0	3	335.451	3.477	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@H](C)N2CCC(C)CC2)cc1OC	ZINC000067271569	453916629	/nfs/dbraw/zinc/91/66/29/453916629.db2.gz	ZCTJEZOMKUIUQZ-INIZCTEOSA-N	0	3	346.471	3.110	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)CCc2ccc(C#N)cc2)C1	ZINC000054224540	453917462	/nfs/dbraw/zinc/91/74/62/453917462.db2.gz	ZOIBNRCGNRKDJX-UTKZUKDTSA-N	0	3	347.462	3.443	20	30		EGEDHN
CC1(C)CN(CCC(=O)Nc2sc3c(c2C#N)CCC3)CCS1	ZINC000083417071	453948716	/nfs/dbraw/zinc/94/87/16/453948716.db2.gz	GJHNIYQIPSHIIB-UHFFFAOYSA-N	0	3	349.525	3.264	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Nc1ccnn1C(C)C)C(C)C	ZINC000076031421	453951099	/nfs/dbraw/zinc/95/10/99/453951099.db2.gz	MWRJSTKZZUDLRO-MRXNPFEDSA-N	0	3	333.480	3.284	20	30		EGEDHN
Cc1ccc([C@@H](CNC(=O)Nc2ccc(CC#N)cc2)N(C)C)cc1	ZINC000067663168	453954617	/nfs/dbraw/zinc/95/46/17/453954617.db2.gz	WCRTWZMZAQRPLI-LJQANCHMSA-N	0	3	336.439	3.486	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC(C)(C)c2ccc(CC)cc2)CC1	ZINC000083720970	453958101	/nfs/dbraw/zinc/95/81/01/453958101.db2.gz	QDIUYWQMOYWXCX-UHFFFAOYSA-N	0	3	329.488	3.434	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN[C@H](C)c1cccc(N2CCCC2)c1	ZINC000181868910	455391394	/nfs/dbraw/zinc/39/13/94/455391394.db2.gz	GOEBSSDDXPUDRL-QGZVFWFLSA-N	0	3	329.488	3.362	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cccc(NC(=O)CCC)c2C)CC1	ZINC000067858633	453973762	/nfs/dbraw/zinc/97/37/62/453973762.db2.gz	PVQGZPOLICHOGV-UHFFFAOYSA-N	0	3	341.455	3.017	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)C=C(C1CC1)C1CC1	ZINC000055388374	453980732	/nfs/dbraw/zinc/98/07/32/453980732.db2.gz	AIQQHYKSXXRIQU-UHFFFAOYSA-N	0	3	337.467	3.195	20	30		EGEDHN
C[C@H]1CCCC[C@@H]1NC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000043045886	454037951	/nfs/dbraw/zinc/03/79/51/454037951.db2.gz	XHHISRMLLGNMGO-LPHOPBHVSA-N	0	3	342.487	3.210	20	30		EGEDHN
N#Cc1csc(CNc2ccccc2CN2CCC(CO)CC2)c1	ZINC000086257828	454046337	/nfs/dbraw/zinc/04/63/37/454046337.db2.gz	ISZPOSUBXUNUMP-UHFFFAOYSA-N	0	3	341.480	3.436	20	30		EGEDHN
N#Cc1cccc(CN[C@@H]2CCCN(c3ccc(C#N)cc3F)C2)c1	ZINC000068991206	454071061	/nfs/dbraw/zinc/07/10/61/454071061.db2.gz	URXAPAYCZKPLLV-GOSISDBHSA-N	0	3	334.398	3.328	20	30		EGEDHN
N#CC1(C(=O)NC2CCN(Cc3ccccc3)CC2)CCCCC1	ZINC000057385581	454124089	/nfs/dbraw/zinc/12/40/89/454124089.db2.gz	YNJUPHVRCZLXLY-UHFFFAOYSA-N	0	3	325.456	3.241	20	30		EGEDHN
Cc1nnc(NCC2CCN(Cc3cccs3)CC2)c(C#N)c1C	ZINC000057854753	454152526	/nfs/dbraw/zinc/15/25/26/454152526.db2.gz	QTHWSXDKQXQIRF-UHFFFAOYSA-N	0	3	341.484	3.351	20	30		EGEDHN
C[C@H](C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1)c1cccs1	ZINC000078069930	454185497	/nfs/dbraw/zinc/18/54/97/454185497.db2.gz	UZFPQKAWQVSRQI-HNNXBMFYSA-N	0	3	341.480	3.314	20	30		EGEDHN
C=CCN(Cc1ccccc1)C[C@H](O)COCc1ccccc1F	ZINC000045821994	454186416	/nfs/dbraw/zinc/18/64/16/454186416.db2.gz	MNDUYSDJQTZHMG-IBGZPJMESA-N	0	3	329.415	3.391	20	30		EGEDHN
FC(F)(F)c1ccc(C#CCN2CCC[C@H](Cn3ccnn3)C2)cc1	ZINC000119625390	454208632	/nfs/dbraw/zinc/20/86/32/454208632.db2.gz	SJPDYSFQYFREAD-INIZCTEOSA-N	0	3	348.372	3.061	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H](C)Cc2ccc(OC)cc2)CC1	ZINC000130894875	454224022	/nfs/dbraw/zinc/22/40/22/454224022.db2.gz	RKNFPXDXZKYTBS-INIZCTEOSA-N	0	3	330.472	3.031	20	30		EGEDHN
CN(CCC(=O)N(C)CCC#N)Cc1ccc(Cl)c(Cl)c1	ZINC000131058904	454233429	/nfs/dbraw/zinc/23/34/29/454233429.db2.gz	QBEQZUSEXCBDFK-UHFFFAOYSA-N	0	3	328.243	3.187	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNc1nnnn1-c1ccc(C)cc1)C(C)C	ZINC000071964279	454263084	/nfs/dbraw/zinc/26/30/84/454263084.db2.gz	CQRKBCZDMCJVFC-GOSISDBHSA-N	0	3	340.475	3.081	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)C1(C#N)CCCC1	ZINC000131981661	454304083	/nfs/dbraw/zinc/30/40/83/454304083.db2.gz	VYLQUKXGSONZQO-QGZVFWFLSA-N	0	3	325.456	3.193	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1SCc1cc(C)no1	ZINC000072966933	454371768	/nfs/dbraw/zinc/37/17/68/454371768.db2.gz	PMHVCLUODYIKET-UHFFFAOYSA-N	0	3	347.488	3.081	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)c2cccc(C#N)c2)N2CCCC2)cc1	ZINC000096694076	454376754	/nfs/dbraw/zinc/37/67/54/454376754.db2.gz	CGCNFTCFQHHCIW-FQEVSTJZSA-N	0	3	333.435	3.434	20	30		EGEDHN
Cc1n[nH]c(C)c1[C@H]1CCCN1CCC(=O)Nc1sccc1C#N	ZINC000091081626	454379160	/nfs/dbraw/zinc/37/91/60/454379160.db2.gz	QWAKRLVBLRICID-CQSZACIVSA-N	0	3	343.456	3.125	20	30		EGEDHN
C[C@H](C#N)CN(C)C(=O)NC[C@H](c1cccs1)N1CCC(C)CC1	ZINC000079220268	454383451	/nfs/dbraw/zinc/38/34/51/454383451.db2.gz	KNABULMRUBDGBQ-HZPDHXFCSA-N	0	3	348.516	3.322	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N[C@@H](C)c1c(C)noc1C)C(C)C	ZINC000073202760	454407054	/nfs/dbraw/zinc/40/70/54/454407054.db2.gz	WYMUASLLKSQYOV-YOEHRIQHSA-N	0	3	348.491	3.350	20	30		EGEDHN
Cc1ccc([C@@H](CNCc2cccc(C#N)c2)N2CCOCC2)cc1	ZINC000048779391	454514977	/nfs/dbraw/zinc/51/49/77/454514977.db2.gz	YVUDRJBRMPCYTE-OAQYLSRUSA-N	0	3	335.451	3.030	20	30		EGEDHN
C[C@@H]1CCCN(C(C)(C)CNC(=O)CSc2ccc(C#N)cc2)C1	ZINC000103073877	454535333	/nfs/dbraw/zinc/53/53/33/454535333.db2.gz	JRIBFNHGPNAMIQ-OAHLLOKOSA-N	0	3	345.512	3.277	20	30		EGEDHN
Cc1nnc(NC[C@@H]2CCCN(Cc3ccccc3)C2)c(C#N)c1C	ZINC000065202128	454538203	/nfs/dbraw/zinc/53/82/03/454538203.db2.gz	FEAIUGBQSXKFPO-SFHVURJKSA-N	0	3	335.455	3.289	20	30		EGEDHN
Cc1c(C(=O)C(C#N)c2cc(C)nc(C)n2)cnn1-c1ccccc1C	ZINC000049407078	454547290	/nfs/dbraw/zinc/54/72/90/454547290.db2.gz	MYJHDMUHWXHNPH-INIZCTEOSA-N	0	3	345.406	3.386	20	30		EGEDHN
Cc1c(C(=O)C(C#N)c2cc(C)nc(C)n2)cnn1-c1ccccc1	ZINC000049405436	454547489	/nfs/dbraw/zinc/54/74/89/454547489.db2.gz	FQOJNABCDITHCC-MRXNPFEDSA-N	0	3	331.379	3.078	20	30		EGEDHN
CN(C)[C@H](CNC(=O)c1ccc(C#N)c(Cl)c1)Cc1ccccc1	ZINC000122583770	454548893	/nfs/dbraw/zinc/54/88/93/454548893.db2.gz	CATMYBDLSZIACG-KRWDZBQOSA-N	0	3	341.842	3.114	20	30		EGEDHN
CCOC(=O)[C@H]1CCCN(Cc2cccc(OCCCC#N)c2)C1	ZINC000092456507	454568161	/nfs/dbraw/zinc/56/81/61/454568161.db2.gz	WHSBWLZWJBTKDH-KRWDZBQOSA-N	0	3	330.428	3.144	20	30		EGEDHN
Cc1cccc(C2(NCC(=O)N(CCC#N)CCC#N)CCCC2)c1	ZINC000104076812	454573691	/nfs/dbraw/zinc/57/36/91/454573691.db2.gz	CTKNMLRZPRWBRM-UHFFFAOYSA-N	0	3	338.455	3.010	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(-c3nc(C)cs3)cc2)CC1	ZINC000065592705	454598837	/nfs/dbraw/zinc/59/88/37/454598837.db2.gz	WQJPVYFICFYXRZ-UHFFFAOYSA-N	0	3	339.464	3.402	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN2CCC(OC[C@H]3CCCO3)CC2)cc1	ZINC000092661700	454605371	/nfs/dbraw/zinc/60/53/71/454605371.db2.gz	SKOFNOISIRGTAG-OXQOHEQNSA-N	0	3	344.455	3.137	20	30		EGEDHN
COc1ccc(CN2CCC[C@@H]2C[C@H](O)c2ccco2)cc1C#N	ZINC000135148239	454638941	/nfs/dbraw/zinc/63/89/41/454638941.db2.gz	UOQFSTNRLBHAGF-SJORKVTESA-N	0	3	326.396	3.248	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)Nc1ccc(C#N)cc1	ZINC000065987091	454647916	/nfs/dbraw/zinc/64/79/16/454647916.db2.gz	ZOMGYQOSJORKCR-UHFFFAOYSA-N	0	3	347.422	3.026	20	30		EGEDHN
COc1ccccc1CN(CCCSCC#N)C[C@H]1CCCO1	ZINC000074981645	454669057	/nfs/dbraw/zinc/66/90/57/454669057.db2.gz	ZUQPHLHUVCSGPM-QGZVFWFLSA-N	0	3	334.485	3.323	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2ccc(OCCC)cc2)CC1	ZINC000106263082	454688627	/nfs/dbraw/zinc/68/86/27/454688627.db2.gz	SZTOQOCSEGLPBY-UHFFFAOYSA-N	0	3	345.487	3.315	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Nc1ccc(CC#N)cc1	ZINC000161566780	454703571	/nfs/dbraw/zinc/70/35/71/454703571.db2.gz	XOQOGTGHZGLISK-UZLBHIALSA-N	0	3	348.450	3.395	20	30		EGEDHN
COC[C@H]1CCCN(Cc2ccc(OC)c(OCCCC#N)c2)C1	ZINC000093338044	454703606	/nfs/dbraw/zinc/70/36/06/454703606.db2.gz	MDSLLWACAHQNNO-KRWDZBQOSA-N	0	3	332.444	3.236	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN(Cc1ccncc1)C1CC1	ZINC000153307765	454780902	/nfs/dbraw/zinc/78/09/02/454780902.db2.gz	OLOXUEUDBZKUIP-UHFFFAOYSA-N	0	3	326.425	3.008	20	30		EGEDHN
C=C(C)COc1cccc(NC(=O)N[C@H]2CCN(CC3CC3)C2)c1	ZINC000108514067	454801582	/nfs/dbraw/zinc/80/15/82/454801582.db2.gz	WVEYTTIKKNGGJB-KRWDZBQOSA-N	0	3	329.444	3.247	20	30		EGEDHN
C=C(Cl)COc1ccc([C@H](C)N[C@@H]2CCc3nc(C)nn3C2)cc1	ZINC000160565629	455474979	/nfs/dbraw/zinc/47/49/79/455474979.db2.gz	CSXBJEWEKXVAKP-XJKSGUPXSA-N	0	3	346.862	3.383	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/CC2(C(=O)N(C)C)CCCC2)c([O-])c1	ZINC000113006287	454910931	/nfs/dbraw/zinc/91/09/31/454910931.db2.gz	AFLMOIWTDQOHHM-KGENOOAVSA-N	0	3	345.487	3.306	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N(C)C1CCN(Cc2ccccc2)CC1	ZINC000113094486	454913396	/nfs/dbraw/zinc/91/33/96/454913396.db2.gz	OYVIDCZIXUNREK-KRWDZBQOSA-N	0	3	330.472	3.091	20	30		EGEDHN
C#CCOc1ccc([C@@H](C)NCc2cccnc2-n2cccn2)cc1	ZINC000177904231	454917907	/nfs/dbraw/zinc/91/79/07/454917907.db2.gz	VCSQPVPXBKTSIO-MRXNPFEDSA-N	0	3	332.407	3.130	20	30		EGEDHN
C#CCCOc1ccc(CNCc2ccc(N3CCCC3)nc2)cc1	ZINC000113320222	454921979	/nfs/dbraw/zinc/92/19/79/454921979.db2.gz	DACPWHJACHEUOO-UHFFFAOYSA-N	0	3	335.451	3.374	20	30		EGEDHN
C#CCOc1ccc([C@@H](C)N[C@@H]2CCN(c3ncccc3F)C2)cc1	ZINC000168152871	454925170	/nfs/dbraw/zinc/92/51/70/454925170.db2.gz	XEGGNQYSYBOWLZ-NVXWUHKLSA-N	0	3	339.414	3.162	20	30		EGEDHN
CC(C)CN(CCN(C)C)C(=O)Nc1cc(C#N)cn1C(C)(C)C	ZINC000170704015	454960788	/nfs/dbraw/zinc/96/07/88/454960788.db2.gz	NTZOKAMTWGVZRP-UHFFFAOYSA-N	0	3	333.480	3.166	20	30		EGEDHN
CN(CC1CCN(C)CC1)C(=O)N[C@H](CCC#N)c1ccccc1	ZINC000151380767	454976977	/nfs/dbraw/zinc/97/69/77/454976977.db2.gz	YHSAVWCMWGIHPP-GOSISDBHSA-N	0	3	328.460	3.015	20	30		EGEDHN
CN(Cc1ccccc1)CC(C)(C)NC(=O)c1cc(C#N)cs1	ZINC000178920451	454990223	/nfs/dbraw/zinc/99/02/23/454990223.db2.gz	OBZZJTJYSRKTEB-UHFFFAOYSA-N	0	3	327.453	3.260	20	30		EGEDHN
CN(C[C@@H]1CCN(Cc2ccc(C#N)cc2)C1)C(=O)OC(C)(C)C	ZINC000170918960	454999249	/nfs/dbraw/zinc/99/92/49/454999249.db2.gz	LZPFBLALOYHFDW-KRWDZBQOSA-N	0	3	329.444	3.247	20	30		EGEDHN
N#Cc1cc(F)ccc1CN1CCC[C@H](c2n[nH]c(C3CC3)n2)C1	ZINC000179506673	455054209	/nfs/dbraw/zinc/05/42/09/455054209.db2.gz	XFFZPQCDRBJSQH-AWEZNQCLSA-N	0	3	325.391	3.072	20	30		EGEDHN
Cc1cccc(C[N@@H+]2CCCN(Cc3ccc(C#N)cc3)CC2)c1[O-]	ZINC000179639094	455063293	/nfs/dbraw/zinc/06/32/93/455063293.db2.gz	OJONTWGJSSVQMN-UHFFFAOYSA-N	0	3	335.451	3.280	20	30		EGEDHN
Cc1cccc(C[N@H+]2CCCN(Cc3ccc(C#N)cc3)CC2)c1[O-]	ZINC000179639094	455063297	/nfs/dbraw/zinc/06/32/97/455063297.db2.gz	OJONTWGJSSVQMN-UHFFFAOYSA-N	0	3	335.451	3.280	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1c(F)cc(C#N)cc1F)C(C)C	ZINC000152067729	455069002	/nfs/dbraw/zinc/06/90/02/455069002.db2.gz	YQMFWDIHSFWVDT-KRWDZBQOSA-N	0	3	347.409	3.265	20	30		EGEDHN
CN(C)CCOc1ccc(NC(=O)C2(C#N)CCCC2)cc1Cl	ZINC000116816694	455071711	/nfs/dbraw/zinc/07/17/11/455071711.db2.gz	SJVZSGNZKZSDTK-UHFFFAOYSA-N	0	3	335.835	3.303	20	30		EGEDHN
C=CC[C@H](C)NC(=O)NC[C@H](c1cccc(OC)c1)N(CC)CC	ZINC000116938358	455075289	/nfs/dbraw/zinc/07/52/89/455075289.db2.gz	DSYKKUHLPOXCBR-MAUKXSAKSA-N	0	3	333.476	3.342	20	30		EGEDHN
C=CCN1CCC(NC(=O)Cc2c(C)nc3ccccc3c2C)CC1	ZINC000171714496	455088497	/nfs/dbraw/zinc/08/84/97/455088497.db2.gz	GXTRUQAJRLHGPF-UHFFFAOYSA-N	0	3	337.467	3.161	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(OCCCC)c(OC)c2)CC1	ZINC000171726072	455089620	/nfs/dbraw/zinc/08/96/20/455089620.db2.gz	UNAXCUTZBSYCOO-UHFFFAOYSA-N	0	3	346.471	3.254	20	30		EGEDHN
C[C@@H]1C[C@H]1[C@H](NCC(=O)N[C@@](C)(C#N)C1CC1)c1ccc(Cl)cc1	ZINC000180025255	455118869	/nfs/dbraw/zinc/11/88/69/455118869.db2.gz	JZURBRWCTHFZNH-WTMJQUOKSA-N	0	3	345.874	3.435	20	30		EGEDHN
CC(C)(C)C[C@H](O)CNCc1cn(CCC#N)nc1-c1ccccc1	ZINC000172269487	455141208	/nfs/dbraw/zinc/14/12/08/455141208.db2.gz	VTBMWCKINXZRAR-SFHVURJKSA-N	0	3	340.471	3.350	20	30		EGEDHN
CC(C)CO[C@@H]1CCN(Cc2cn(C)nc2-c2ccc(C#N)cc2)C1	ZINC000180274007	455154305	/nfs/dbraw/zinc/15/43/05/455154305.db2.gz	XQRCBQRGLBUHOI-LJQANCHMSA-N	0	3	338.455	3.206	20	30		EGEDHN
Cc1ccc(NC(=O)c2cccc(CC#N)c2)c(OCCN(C)C)c1	ZINC000172529900	455160423	/nfs/dbraw/zinc/16/04/23/455160423.db2.gz	NYQFJJFCGAZEOW-UHFFFAOYSA-N	0	3	337.423	3.254	20	30		EGEDHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccc(CC#N)cc1	ZINC000182842238	455176023	/nfs/dbraw/zinc/17/60/23/455176023.db2.gz	LJMFAHSSNOBHTC-MRXNPFEDSA-N	0	3	336.439	3.395	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC[C@@H](Cc2ccccc2)C(C)C)CC1	ZINC000189405473	455191074	/nfs/dbraw/zinc/19/10/74/455191074.db2.gz	IEWFUFPNDIPIDX-LJQANCHMSA-N	0	3	343.515	3.451	20	30		EGEDHN
COCCc1nc(C)c([C@@H](C)NCc2ccc(OCC#N)cc2)s1	ZINC000180560434	455196933	/nfs/dbraw/zinc/19/69/33/455196933.db2.gz	PUYWRXXDZDGAJV-CYBMUJFWSA-N	0	3	345.468	3.394	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](c2ccc(C)cc2)C2CC2)CC1	ZINC000264425747	455209996	/nfs/dbraw/zinc/20/99/96/455209996.db2.gz	SKBKHAYERKIUPU-IBGZPJMESA-N	0	3	327.472	3.396	20	30		EGEDHN
C=C(C)CN(C)Cc1ccc(OCCN2CCOCC2)c(Cl)c1	ZINC000181049585	455280320	/nfs/dbraw/zinc/28/03/20/455280320.db2.gz	IYVQJYQMTDHQMJ-UHFFFAOYSA-N	0	3	338.879	3.059	20	30		EGEDHN
N#CCOc1ccc(CN(CCCO)[C@H]2CCc3ccccc32)cc1	ZINC000265225774	455303577	/nfs/dbraw/zinc/30/35/77/455303577.db2.gz	OJPHVYDRLZCJMR-NRFANRHFSA-N	0	3	336.435	3.461	20	30		EGEDHN
Cc1csc(CNC2CCN(Cc3ccc(C#N)cc3)CC2)n1	ZINC000181445831	455336154	/nfs/dbraw/zinc/33/61/54/455336154.db2.gz	XIYFCEFFZFEZCV-UHFFFAOYSA-N	0	3	326.469	3.077	20	30		EGEDHN
C=CCN(CC1CCCCC1)C(=O)Nc1ccn(CCN(C)C)n1	ZINC000173954986	455344896	/nfs/dbraw/zinc/34/48/96/455344896.db2.gz	PUECKVARSGAIFG-UHFFFAOYSA-N	0	3	333.480	3.045	20	30		EGEDHN
C[C@@H](NCCCS(=O)(=O)c1ccccc1)c1ccc(C#N)cc1	ZINC000174009657	455350143	/nfs/dbraw/zinc/35/01/43/455350143.db2.gz	SRIMXBXWRPDPCV-OAHLLOKOSA-N	0	3	328.437	3.073	20	30		EGEDHN
CC[C@H](N[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O)c1ccccc1	ZINC000190615898	455354534	/nfs/dbraw/zinc/35/45/34/455354534.db2.gz	GRICTZMHZMBZSX-PMACEKPBSA-N	0	3	333.435	3.400	20	30		EGEDHN
CC(C)[C@H](NCc1cc(C#N)n(C)c1)c1ccc2c(c1)OCCO2	ZINC000190699076	455369048	/nfs/dbraw/zinc/36/90/48/455369048.db2.gz	BLHRLQGLCNBDEA-IBGZPJMESA-N	0	3	325.412	3.155	20	30		EGEDHN
C[C@@H](NCc1ccc(N2CCO[C@@H](C)C2)nc1)c1cccc(C#N)c1	ZINC000245843763	455385314	/nfs/dbraw/zinc/38/53/14/455385314.db2.gz	FCYXQPWOVHEPTN-JKSUJKDBSA-N	0	3	336.439	3.029	20	30		EGEDHN
C[C@@H]1CN(Cc2cccc(C#N)c2)CC[C@H]1NC(=O)OC(C)(C)C	ZINC000265849983	455392621	/nfs/dbraw/zinc/39/26/21/455392621.db2.gz	PQVBXHGQDCQOJJ-RHSMWYFYSA-N	0	3	329.444	3.293	20	30		EGEDHN
CCCN(CCc1cccs1)CC(=O)NC1(C#N)CCCCC1	ZINC000184511077	455394187	/nfs/dbraw/zinc/39/41/87/455394187.db2.gz	SOQQINFNTMCQOM-UHFFFAOYSA-N	0	3	333.501	3.345	20	30		EGEDHN
C[C@@H](N[C@H]1CCN(C(=O)C2CCCCC2)C1)c1cccc(C#N)c1	ZINC000181900133	455397029	/nfs/dbraw/zinc/39/70/29/455397029.db2.gz	YEQNRYMMURMNOC-BEFAXECRSA-N	0	3	325.456	3.390	20	30		EGEDHN
COc1ccc([C@H](CCO)N[C@@H](C)c2ccc(OCC#N)cc2)cc1	ZINC000181911499	455399113	/nfs/dbraw/zinc/39/91/13/455399113.db2.gz	RELYYPIBWOGUJT-YWZLYKJASA-N	0	3	340.423	3.372	20	30		EGEDHN
COc1ccc(C(=O)C(C#N)c2cnc3ccccc3n2)c(OC)c1	ZINC000190953802	455413962	/nfs/dbraw/zinc/41/39/62/455413962.db2.gz	ZPYRRPQOBDYZLC-AWEZNQCLSA-N	0	3	333.347	3.137	20	30		EGEDHN
C[C@@H]1C[C@H](N(C)C(=O)Nc2ccc(C(C)(C)C#N)cc2)CCN1C	ZINC000174904517	455417942	/nfs/dbraw/zinc/41/79/42/455417942.db2.gz	WQXDLCOQJXKFFU-RHSMWYFYSA-N	0	3	328.460	3.434	20	30		EGEDHN
C=CCn1c(SC[C@H]2CCN(C)C2)nnc1-c1ccccc1F	ZINC000190986579	455419628	/nfs/dbraw/zinc/41/96/28/455419628.db2.gz	ACNNPVJLRSUDJM-ZDUSSCGKSA-N	0	3	332.448	3.314	20	30		EGEDHN
C[C@@H](O)[C@@H]1CCCCN1CC#Cc1ccc(OC(F)(F)F)cc1	ZINC000160056042	455425154	/nfs/dbraw/zinc/42/51/54/455425154.db2.gz	OBZNRXZDWYJIDX-CJNGLKHVSA-N	0	3	327.346	3.172	20	30		EGEDHN
COc1cc(NCCN[C@@H](C)c2cccc(C#N)c2)cc(OC)c1	ZINC000182056837	455426091	/nfs/dbraw/zinc/42/60/91/455426091.db2.gz	RKFAYQZUYZWNRU-AWEZNQCLSA-N	0	3	325.412	3.338	20	30		EGEDHN
C=C(C)[C@H](NC(=O)NC[C@H](C)N(C)C1CC1)c1ccc(F)c(F)c1	ZINC000184705971	455432372	/nfs/dbraw/zinc/43/23/72/455432372.db2.gz	DDZRZPUCWTVDLY-SJCJKPOMSA-N	0	3	337.414	3.364	20	30		EGEDHN
Cc1cc(F)ccc1N1CCC[C@H](NCc2cc(C#N)n(C)c2)C1	ZINC000191107628	455444168	/nfs/dbraw/zinc/44/41/68/455444168.db2.gz	BRLLSKMDVCFWSP-KRWDZBQOSA-N	0	3	326.419	3.103	20	30		EGEDHN
CN(C)C(=O)CC1CCN(Cc2ccccc2C(C)(C)C#N)CC1	ZINC000182169041	455452051	/nfs/dbraw/zinc/45/20/51/455452051.db2.gz	XUOCAISCIKLBME-UHFFFAOYSA-N	0	3	327.472	3.178	20	30		EGEDHN
CN1CCC[C@H](CNC(=O)N2CCC(C#N)CC2)[C@@H]1c1cccs1	ZINC000175519843	455457270	/nfs/dbraw/zinc/45/72/70/455457270.db2.gz	FKXGMIBIDKKUAP-NVXWUHKLSA-N	0	3	346.500	3.076	20	30		EGEDHN
CCC(CC)CNC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000160571455	455475654	/nfs/dbraw/zinc/47/56/54/455475654.db2.gz	UPVZIRVDXWXZBC-UHFFFAOYSA-N	0	3	330.476	3.068	20	30		EGEDHN
CN(Cc1ccc(N2CCOCC2)cc1)Cc1ccc(F)c(C#N)c1	ZINC000160589379	455477472	/nfs/dbraw/zinc/47/74/72/455477472.db2.gz	QLTYNASRYNQWLS-UHFFFAOYSA-N	0	3	339.414	3.166	20	30		EGEDHN
Cc1ccc(C#N)c(NCCCCN2CCN(c3ccccc3)CC2)n1	ZINC000160691171	455488523	/nfs/dbraw/zinc/48/85/23/455488523.db2.gz	KYPPZBQWJZNVMZ-UHFFFAOYSA-N	0	3	349.482	3.276	20	30		EGEDHN
Cc1cc[n+](C(C(=O)c2ccc(F)c(C)c2)C(=S)[N-]C2CC2)cc1	ZINC000267412184	455550524	/nfs/dbraw/zinc/55/05/24/455550524.db2.gz	JBBVAXZPAUSZCT-UHFFFAOYSA-O	0	3	343.447	3.421	20	30		EGEDHN
CN(CC#Cc1ccc(OC(F)(F)F)cc1)C[C@@H]1CCC[C@H]1O	ZINC000247191820	455571488	/nfs/dbraw/zinc/57/14/88/455571488.db2.gz	YINARAFSTUNFJK-GOEBONIOSA-N	0	3	327.346	3.030	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCc2cccc(SCC)c2)CC1	ZINC000292228558	455601941	/nfs/dbraw/zinc/60/19/41/455601941.db2.gz	IRZHYRQHJLVVRH-UHFFFAOYSA-N	0	3	333.501	3.248	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccc(C(C)(C)C#N)cc2)CCN(C2CCC2)C1	ZINC000292264832	455612904	/nfs/dbraw/zinc/61/29/04/455612904.db2.gz	FRWSPUFHVQRUKK-INIZCTEOSA-N	0	3	339.483	3.434	20	30		EGEDHN
N#Cc1cccc(OCCN2CCC[C@H]2C[C@@H](O)c2ccco2)c1	ZINC000268247705	455630014	/nfs/dbraw/zinc/63/00/14/455630014.db2.gz	ILQJDHSDHSMXRN-FUHWJXTLSA-N	0	3	326.396	3.118	20	30		EGEDHN
C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCN2CCC[C@H]2C1	ZINC000247658809	455635359	/nfs/dbraw/zinc/63/53/59/455635359.db2.gz	ZEVWGLBGKJECMR-GJZGRUSLSA-N	0	3	344.484	3.250	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCc2ccc(C(C)(F)F)cc2)CC1	ZINC000292658586	455724511	/nfs/dbraw/zinc/72/45/11/455724511.db2.gz	AELCQOSDMUWECW-UHFFFAOYSA-N	0	3	337.414	3.248	20	30		EGEDHN
COc1ccc(OCCN[C@@H](C)c2ccc(C#N)cc2)c([N+](=O)[O-])c1	ZINC000271712094	455729814	/nfs/dbraw/zinc/72/98/14/455729814.db2.gz	VZLWSXLOUNTZDU-ZDUSSCGKSA-N	0	3	341.367	3.205	20	30		EGEDHN
CN1CCC(C(=O)Nc2ccc(Oc3ccnc(C#N)c3)cc2)CC1	ZINC000292686516	455731497	/nfs/dbraw/zinc/73/14/97/455731497.db2.gz	MXGYOQWDHYDGMD-UHFFFAOYSA-N	0	3	336.395	3.026	20	30		EGEDHN
CCN1CCO[C@@H](CN[C@H]2CCC[C@@H](C#N)C2)[C@@H]1c1ccccc1	ZINC000284750067	455735893	/nfs/dbraw/zinc/73/58/93/455735893.db2.gz	YVKPIZMJKYKVQM-GTAWCEEGSA-N	0	3	327.472	3.120	20	30		EGEDHN
N#C[C@@H]1CC[C@@H](N2CCC(NC(=O)Nc3ccc(F)cc3)CC2)C1	ZINC000292711985	455737870	/nfs/dbraw/zinc/73/78/70/455737870.db2.gz	FFORPEOBIVXQAK-CXAGYDPISA-N	0	3	330.407	3.104	20	30		EGEDHN
CC(C)(NC[C@H](O)COc1ccc(C#N)cc1)c1ccc(F)c(F)c1	ZINC000271739501	455740619	/nfs/dbraw/zinc/74/06/19/455740619.db2.gz	VIUWPMOWGPOKPY-HNNXBMFYSA-N	0	3	346.377	3.101	20	30		EGEDHN
CCN(C(=O)c1cccc(CC#N)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000186332384	455745335	/nfs/dbraw/zinc/74/53/35/455745335.db2.gz	PCRCZPZGALNDCK-NRFANRHFSA-N	0	3	347.462	3.489	20	30		EGEDHN
C#CC[C@@H](NC(=O)N1CCN(C2CCC2)C[C@@H](C)C1)c1ccccc1	ZINC000292778979	455755610	/nfs/dbraw/zinc/75/56/10/455755610.db2.gz	XVKSCDZGUIZTEE-YLJYHZDGSA-N	0	3	339.483	3.267	20	30		EGEDHN
COC(=O)N1CCC([C@@H](C)NCC#Cc2cccc(Cl)c2)CC1	ZINC000186389739	455758863	/nfs/dbraw/zinc/75/88/63/455758863.db2.gz	YHKIAUNZBJBJRW-CQSZACIVSA-N	0	3	334.847	3.148	20	30		EGEDHN
CCOC1CC(CON=C(N)c2ccccc2CN2CCCCC2)C1	ZINC000285035400	455780881	/nfs/dbraw/zinc/78/08/81/455780881.db2.gz	FOBDQEGXPRVKKT-UHFFFAOYSA-N	0	3	345.487	3.125	20	30		EGEDHN
CCOCC(C)(C)NCC(=O)Nc1ccccc1S[C@@H](C)CC#N	ZINC000293347104	455783428	/nfs/dbraw/zinc/78/34/28/455783428.db2.gz	SUARVGKAZOWUCQ-AWEZNQCLSA-N	0	3	349.500	3.424	20	30		EGEDHN
Cc1ccc(CNC(=O)C2CCN([C@@H]3CC[C@H](C#N)C3)CC2)cc1F	ZINC000293389341	455784499	/nfs/dbraw/zinc/78/44/99/455784499.db2.gz	GUAUGIATMPTGAV-MAUKXSAKSA-N	0	3	343.446	3.155	20	30		EGEDHN
CC[C@@H](NCc1ccc(Cn2cncn2)cc1)c1ccc(C#N)cc1	ZINC000278323797	455817707	/nfs/dbraw/zinc/81/77/07/455817707.db2.gz	VKSQUWGFUVWBRT-HXUWFJFHSA-N	0	3	331.423	3.439	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CC2(CCN(C)CC2)Oc2ccccc21	ZINC000294513939	455818071	/nfs/dbraw/zinc/81/80/71/455818071.db2.gz	ONAVZKKJBZOSEF-MRXNPFEDSA-N	0	3	328.456	3.303	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)CC1	ZINC000295321965	455846385	/nfs/dbraw/zinc/84/63/85/455846385.db2.gz	SRDUWDAMWKPWRV-UHFFFAOYSA-N	0	3	337.807	3.019	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@@]1(C#N)CC12CCCC2	ZINC000295330989	455846435	/nfs/dbraw/zinc/84/64/35/455846435.db2.gz	MIVMKUCBNKEMEJ-MMOPVJDHSA-N	0	3	337.467	3.097	20	30		EGEDHN
CN(C)Cc1cccc(CNC(=O)NC2(c3cccc(C#N)c3)CC2)c1	ZINC000269695371	455852480	/nfs/dbraw/zinc/85/24/80/455852480.db2.gz	OUTSJDIEPBPFBP-UHFFFAOYSA-N	0	3	348.450	3.108	20	30		EGEDHN
Cc1cccc(C)c1OCCNC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000279296679	455862249	/nfs/dbraw/zinc/86/22/49/455862249.db2.gz	LPMFCFNFVUGJAQ-IBGZPJMESA-N	0	3	347.418	3.053	20	30		EGEDHN
COc1ccc(C)cc1[C@@H](C)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000279684080	455870271	/nfs/dbraw/zinc/87/02/71/455870271.db2.gz	HEISEZMLGFSRSM-CRAIPNDOSA-N	0	3	347.418	3.435	20	30		EGEDHN
CN(C)CCN(C(=O)CCc1ccc(C#N)cc1)C1CCCCC1	ZINC000194704673	455874782	/nfs/dbraw/zinc/87/47/82/455874782.db2.gz	FQGHLOHKIDRPKI-UHFFFAOYSA-N	0	3	327.472	3.214	20	30		EGEDHN
Cc1cccc(C)c1CCNC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000279912789	455876332	/nfs/dbraw/zinc/87/63/32/455876332.db2.gz	FABVFQWCUQSQME-LJQANCHMSA-N	0	3	331.419	3.216	20	30		EGEDHN
N#Cc1ccc(CN(CCc2nc3ccccc3c(=O)[nH]2)C2CC2)cc1	ZINC000194957290	455906029	/nfs/dbraw/zinc/90/60/29/455906029.db2.gz	KLHDUDJQURBXRR-UHFFFAOYSA-N	0	3	344.418	3.002	20	30		EGEDHN
CN(C(=O)c1ccc(CC#N)cc1)C1CCN(Cc2ccccc2)CC1	ZINC000270416718	455950763	/nfs/dbraw/zinc/95/07/63/455950763.db2.gz	JSKCCFYSOADBBQ-UHFFFAOYSA-N	0	3	347.462	3.489	20	30		EGEDHN
C=C(C)[C@@H](NC[C@H](O)COCc1ccco1)c1ccc(F)c(F)c1	ZINC000187786054	455952627	/nfs/dbraw/zinc/95/26/27/455952627.db2.gz	QWBHUIQLBSZREC-KBXCAEBGSA-N	0	3	337.366	3.342	20	30		EGEDHN
CS[C@H]1CCN(CCC(=O)Nc2sc3c(c2C#N)CCCC3)C1	ZINC000296501383	455956673	/nfs/dbraw/zinc/95/66/73/455956673.db2.gz	ZIAYQUCJIDWFST-LBPRGKRZSA-N	0	3	349.525	3.264	20	30		EGEDHN
CN1CCC[C@]2(CCN(C(=O)Nc3ccc(C#N)c(Cl)c3)C2)C1	ZINC000296526094	455963318	/nfs/dbraw/zinc/96/33/18/455963318.db2.gz	HXANRKJIEWUXNQ-KRWDZBQOSA-N	0	3	332.835	3.161	20	30		EGEDHN
C=CCOc1ccc(CN2CCNC[C@@H]2c2ccncc2)cc1Cl	ZINC000261930101	455972810	/nfs/dbraw/zinc/97/28/10/455972810.db2.gz	CQLXJSYSIHYFKL-GOSISDBHSA-N	0	3	343.858	3.446	20	30		EGEDHN
COc1ccc(CN2CCC[C@@](C)(OC)C2)cc1OCCCC#N	ZINC000280531192	455991137	/nfs/dbraw/zinc/99/11/37/455991137.db2.gz	IKZHIBDJHUZDLH-LJQANCHMSA-N	0	3	332.444	3.379	20	30		EGEDHN
COC[C@H](NC1CCN(c2ccc(C#N)cc2)CC1)c1ccc(C)o1	ZINC000286297189	456018471	/nfs/dbraw/zinc/01/84/71/456018471.db2.gz	WLRDPXRHACWYSV-IBGZPJMESA-N	0	3	339.439	3.406	20	30		EGEDHN
OCC[C@H]1CCC[C@@H]1NCC#Cc1ccc(OC(F)(F)F)cc1	ZINC000286305885	456020238	/nfs/dbraw/zinc/02/02/38/456020238.db2.gz	VVLKBPHPQAGECM-ZBFHGGJFSA-N	0	3	327.346	3.077	20	30		EGEDHN
C=CCOc1ccc(CNCC2([S@@](C)=O)CCC2)cc1Cl	ZINC000280720602	456038210	/nfs/dbraw/zinc/03/82/10/456038210.db2.gz	UWHCRDSRUHJNGG-OAQYLSRUSA-N	0	3	327.877	3.296	20	30		EGEDHN
CC[C@](C)(C#N)C(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000286507657	456048626	/nfs/dbraw/zinc/04/86/26/456048626.db2.gz	QBTPDARSFKKBDZ-IMFGXOCKSA-N	0	3	327.472	3.438	20	30		EGEDHN
C=CC[C@H](C)NC(=O)N1CC[C@]2(CCN(Cc3ccccc3)C2)C1	ZINC000286874570	456056079	/nfs/dbraw/zinc/05/60/79/456056079.db2.gz	YXZSOCORTOEKAW-PXNSSMCTSA-N	0	3	327.472	3.259	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)N1c2ccc(C)cc2[C@H]2CN(C)CC[C@@H]21	ZINC000280821331	456060049	/nfs/dbraw/zinc/06/00/49/456060049.db2.gz	DXNYIEKPUQWIBQ-MJGOQNOKSA-N	0	3	335.407	3.216	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1CNCc1c(Cl)n(C)nc1C(F)(F)F	ZINC000280839835	456063516	/nfs/dbraw/zinc/06/35/16/456063516.db2.gz	YBWLKXJTOMRLPC-GXSJLCMTSA-N	0	3	337.773	3.163	20	30		EGEDHN
C[C@H]1C[C@@H](N2CCCC2)CN1C(=O)Nc1ccc(C#N)cc1Cl	ZINC000287292223	456065267	/nfs/dbraw/zinc/06/52/67/456065267.db2.gz	ZAQIRMYRNTYWTP-GXTWGEPZSA-N	0	3	332.835	3.302	20	30		EGEDHN
C=C(C)CN1CCC(Nc2nc(-c3ccccn3)nc3c2CCC3)CC1	ZINC000301262568	456073937	/nfs/dbraw/zinc/07/39/37/456073937.db2.gz	BUHPKABCRPEOKT-UHFFFAOYSA-N	0	3	349.482	3.480	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H]2C[C@H]2c2ccc(Cl)cc2)CC1	ZINC000281024624	456112006	/nfs/dbraw/zinc/11/20/06/456112006.db2.gz	PWFSFHTUGXYPSD-DLBZAZTESA-N	0	3	333.863	3.146	20	30		EGEDHN
C=CCn1c(C)nnc1N(C)[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000289667299	456135104	/nfs/dbraw/zinc/13/51/04/456135104.db2.gz	MNBTXODCZVLBJR-QFBILLFUSA-N	0	3	339.487	3.262	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H](CO)Cc2ccccc2C)cc1OC	ZINC000188941448	456177166	/nfs/dbraw/zinc/17/71/66/456177166.db2.gz	PNSISFFEFFQXJC-LJQANCHMSA-N	0	3	341.451	3.262	20	30		EGEDHN
COC1CCN(CCNc2ccc(C(F)(F)F)cc2C#N)CC1	ZINC000301664644	456178530	/nfs/dbraw/zinc/17/85/30/456178530.db2.gz	ZIZXLZZMQHIMNC-UHFFFAOYSA-N	0	3	327.350	3.100	20	30		EGEDHN
CC[C@@H](CC#N)NCC1CCN(C(=O)OCc2ccccc2)CC1	ZINC000289924300	456183102	/nfs/dbraw/zinc/18/31/02/456183102.db2.gz	YQMOGUYNQVVELW-SFHVURJKSA-N	0	3	329.444	3.317	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N1CCC(c2nnc3n2CCCC3)CC1	ZINC000275725802	456297753	/nfs/dbraw/zinc/29/77/53/456297753.db2.gz	SZDWXCFOASBEHI-OAHLLOKOSA-N	0	3	335.455	3.427	20	30		EGEDHN
N#Cc1cccc(CN2CCN(c3ccnc4ccccc43)CC2)c1	ZINC000347690116	456308520	/nfs/dbraw/zinc/30/85/20/456308520.db2.gz	MJPHADIQWLYFRW-UHFFFAOYSA-N	0	3	328.419	3.429	20	30		EGEDHN
Cc1nc2sccn2c1CN(C)CCCC1(C#N)CCOCC1	ZINC000282041417	456396572	/nfs/dbraw/zinc/39/65/72/456396572.db2.gz	QYBDAVFZRUDYCP-UHFFFAOYSA-N	0	3	332.473	3.237	20	30		EGEDHN
Cc1cc(CN(C)C)cc(NC(=O)c2ncc(C#N)cc2Cl)c1	ZINC000340336875	456399657	/nfs/dbraw/zinc/39/96/57/456399657.db2.gz	ONNCGFAGQYFHBR-UHFFFAOYSA-N	0	3	328.803	3.229	20	30		EGEDHN
C=CCOCCCN(C)[C@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O	ZINC000347962009	456432064	/nfs/dbraw/zinc/43/20/64/456432064.db2.gz	HMSSUGZDQUJAOG-CVEARBPZSA-N	0	3	330.255	3.476	20	30		EGEDHN
C=CCC(C)(C)C(=O)N(C)C[C@@H]1CCCN(CC)[C@@H]1c1cnn(C)c1	ZINC000348067630	456452602	/nfs/dbraw/zinc/45/26/02/456452602.db2.gz	DKOMKXWCESBKNJ-WMZOPIPTSA-N	0	3	346.519	3.254	20	30		EGEDHN
CCCN(CCCCCS(=O)(=O)CC)Cc1ccc(C#N)cc1	ZINC000276442225	456483033	/nfs/dbraw/zinc/48/30/33/456483033.db2.gz	IYCJQZMSEZVWJU-UHFFFAOYSA-N	0	3	336.501	3.375	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000337755719	456526326	/nfs/dbraw/zinc/52/63/26/456526326.db2.gz	BHGNXEYCUIROAC-YWZLYKJASA-N	0	3	333.435	3.117	20	30		EGEDHN
COc1ccc(CN(C)CCc2cccc([N+](=O)[O-])c2)cc1C#N	ZINC000282526537	456540301	/nfs/dbraw/zinc/54/03/01/456540301.db2.gz	UMUYXPMGNNYGNE-UHFFFAOYSA-N	0	3	325.368	3.150	20	30		EGEDHN
N#CCCn1cc(CNCCOC(F)(F)F)c(-c2ccccc2)n1	ZINC000353209847	456561975	/nfs/dbraw/zinc/56/19/75/456561975.db2.gz	NZFVMFBGLANRBK-UHFFFAOYSA-N	0	3	338.333	3.090	20	30		EGEDHN
CCc1nc(C#N)cc(N2CCCN(Cc3ccccc3)C[C@H]2C)n1	ZINC000308168220	456572038	/nfs/dbraw/zinc/57/20/38/456572038.db2.gz	MBYBTNMWXPDABK-MRXNPFEDSA-N	0	3	335.455	3.011	20	30		EGEDHN
Cc1ccc(CN[C@@H]2CCc3ccc(C#N)cc32)c(N2CCOCC2)c1	ZINC000353248021	456584304	/nfs/dbraw/zinc/58/43/04/456584304.db2.gz	ADSOMJSDJWFAKJ-OAQYLSRUSA-N	0	3	347.462	3.480	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)CC1(C)C	ZINC000282673404	456588992	/nfs/dbraw/zinc/58/89/92/456588992.db2.gz	HFMDMTWXCTXDQY-HKUYNNGSSA-N	0	3	344.499	3.385	20	30		EGEDHN
CC(C)(C)[C@H](NCC(=O)N(CCC#N)CCC#N)c1ccc(F)cc1	ZINC000299110504	456608847	/nfs/dbraw/zinc/60/88/47/456608847.db2.gz	ZYHYYXXTFBWIDO-GOSISDBHSA-N	0	3	344.434	3.158	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Nc1ccn2ccnc2c1)C(C)C	ZINC000353337301	456644024	/nfs/dbraw/zinc/64/40/24/456644024.db2.gz	LUIAPNGFIYXNET-QGZVFWFLSA-N	0	3	341.459	3.154	20	30		EGEDHN
CC1(C)CN(Cc2cn(CCC#N)nc2-c2ccncc2)[C@H]1C1CC1	ZINC000291481407	456655384	/nfs/dbraw/zinc/65/53/84/456655384.db2.gz	FWHBIFAVTSTOEL-IBGZPJMESA-N	0	3	335.455	3.479	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)c1ccc(C(F)(F)F)cn1	ZINC000338187125	456692435	/nfs/dbraw/zinc/69/24/35/456692435.db2.gz	HANVKMIXPZNBCD-LLVKDONJSA-N	0	3	344.296	3.477	20	30		EGEDHN
C[C@H](CNC(=O)Nc1ccc(C#N)c(F)c1)N(C)Cc1ccccc1	ZINC000353534566	456740069	/nfs/dbraw/zinc/74/00/69/456740069.db2.gz	VUISMOQNFILPPL-CQSZACIVSA-N	0	3	340.402	3.339	20	30		EGEDHN
N#Cc1ccc(C(=O)Nc2cccc(CN3CCC(CO)CC3)c2)cc1	ZINC000299664261	456758694	/nfs/dbraw/zinc/75/86/94/456758694.db2.gz	PQUNMQRYKRVHHS-UHFFFAOYSA-N	0	3	349.434	3.015	20	30		EGEDHN
CN1CCN(CCNC(=O)c2coc(C3CCCCC3)n2)CC1(C)C	ZINC000328773617	456759007	/nfs/dbraw/zinc/75/90/07/456759007.db2.gz	RWAPOQLLUAIGQU-UHFFFAOYSA-N	0	3	348.491	3.053	20	30		EGEDHN
CC(C#N)C(=O)N1C[C@@H](C)O[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000343963916	456785485	/nfs/dbraw/zinc/78/54/85/456785485.db2.gz	GMQSARKXYRZICJ-JTNHKYCSSA-N	0	3	326.318	3.153	20	30		EGEDHN
CN1CCC(Oc2ccc(CNC(=O)[C@]3(C)CCOC3)cc2)CC1	ZINC000328926607	456792556	/nfs/dbraw/zinc/79/25/56/456792556.db2.gz	WNIXITIRZKRCRB-LJQANCHMSA-N	0	3	332.444	3.043	20	30		EGEDHN
CC[C@@H]1CCCCN1CCNC(=O)[C@@H]1CCCO[C@H]1c1ccnn1C	ZINC000329000383	456809775	/nfs/dbraw/zinc/80/97/75/456809775.db2.gz	GQISHMNDABQMMF-JFIYKMOQSA-N	0	3	348.491	3.109	20	30		EGEDHN
C=CCNC(=O)Nc1ccc(NC(=O)[C@@H](CC)N(CC)CC)cc1	ZINC000344366761	456821421	/nfs/dbraw/zinc/82/14/21/456821421.db2.gz	MSSAEPPRJJZWSB-MRXNPFEDSA-N	0	3	332.448	3.053	20	30		EGEDHN
C=CCSCCNC(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1	ZINC000338493286	456833127	/nfs/dbraw/zinc/83/31/27/456833127.db2.gz	CHSDQTPZFIPJPH-GOSISDBHSA-N	0	3	347.528	3.350	20	30		EGEDHN
C=CC[C@H](CO)CNCc1ccc(Br)cc1SC	ZINC000341305424	456838854	/nfs/dbraw/zinc/83/88/54/456838854.db2.gz	VFTDNTFNGINYQH-NSHDSACASA-N	0	3	330.291	3.445	20	30		EGEDHN
COc1ccc(CN[C@@H]2C[C@H](OC)C2(C)C)cc1OCCCC#N	ZINC000344700560	456849041	/nfs/dbraw/zinc/84/90/41/456849041.db2.gz	QSYFWCULIMBVIG-MSOLQXFVSA-N	0	3	332.444	3.281	20	30		EGEDHN
CCc1cnccc1[C@H](C)NC(=O)[C@H]1CCCN1C1CCOCC1	ZINC000329184979	456849918	/nfs/dbraw/zinc/84/99/18/456849918.db2.gz	PZVTYIYGQHZYMR-KBXCAEBGSA-N	0	3	331.460	3.305	20	30		EGEDHN
C[C@@H]1CN(C(=O)C[C@@H](CC#N)c2ccccc2)CCN(C2CCC2)C1	ZINC000344722001	456852759	/nfs/dbraw/zinc/85/27/59/456852759.db2.gz	IQDVMJNCNLAWQU-PKOBYXMFSA-N	0	3	339.483	3.407	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1ccnc(SC)c1)C(C)C	ZINC000344786389	456859323	/nfs/dbraw/zinc/85/93/23/456859323.db2.gz	HRMGYHGAAIZGBZ-MRXNPFEDSA-N	0	3	333.501	3.232	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)NC[C@@H](C)N2CCC[C@@H](C)C2)cc1	ZINC000344909205	456870669	/nfs/dbraw/zinc/87/06/69/456870669.db2.gz	ZTZYOHYKTBVXLU-IAGOWNOFSA-N	0	3	345.487	3.171	20	30		EGEDHN
C[C@@H]1C[C@H](C(=O)NC[C@@H]2CCCN2Cc2ccccc2)CC(=O)N1	ZINC000329432076	456889640	/nfs/dbraw/zinc/88/96/40/456889640.db2.gz	KTULVIZNESJTDD-PVAVHDDUSA-N	0	3	329.444	3.363	20	30		EGEDHN
CN(C[C@H](O)COc1ccc(C(F)(F)F)cc1)[C@H]1CC[C@H](C#N)C1	ZINC000338994513	456891675	/nfs/dbraw/zinc/89/16/75/456891675.db2.gz	WWMICRFVQVHSBK-QEJZJMRPSA-N	0	3	342.361	3.069	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)N[C@H](C)CN2CCC[C@@H](C)C2)cc1	ZINC000345070859	456915376	/nfs/dbraw/zinc/91/53/76/456915376.db2.gz	DCVJRZGZDVVTGG-IAGOWNOFSA-N	0	3	345.487	3.171	20	30		EGEDHN
C[C@@H]1N(CC(=O)N[C@@H]2CCOc3ccccc32)CCC12CCOCC2	ZINC000329658276	456922467	/nfs/dbraw/zinc/92/24/67/456922467.db2.gz	HEJUJQVAJUPDTI-DOTOQJQBSA-N	0	3	344.455	3.358	20	30		EGEDHN
O=C(N[C@H](CO)CN1CCCCC1)[C@@H]1C[C@@]12CCCc1ccccc12	ZINC000329700307	456929674	/nfs/dbraw/zinc/92/96/74/456929674.db2.gz	ZSOUIWZRHLXOML-HFSMHLIXSA-N	0	3	342.483	3.084	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H](C)c2ccc3c(c2)OCC(=O)N3)cc1	ZINC000353861474	456939895	/nfs/dbraw/zinc/93/98/95/456939895.db2.gz	ASTLTIOTHBVKMI-AWEZNQCLSA-N	0	3	338.407	3.433	20	30		EGEDHN
C=CCOCCN1CCC(c2nc(-c3ccccc3OC)no2)CC1	ZINC000339126966	456952618	/nfs/dbraw/zinc/95/26/18/456952618.db2.gz	NZFWPVMCDMOURO-UHFFFAOYSA-N	0	3	343.427	3.127	20	30		EGEDHN
CN1CCC(Nc2ccccc2NC(=O)[C@@H]2CCNC(=O)C2)CC1	ZINC000329923329	456961481	/nfs/dbraw/zinc/96/14/81/456961481.db2.gz	GWWFSZDMODSXAN-CYBMUJFWSA-N	0	3	330.432	3.147	20	30		EGEDHN
CC(C)(C)C(=O)N1CCC[C@H](C(=O)NC[C@@H]2CCCCN2C2CC2)C1	ZINC000329958335	456966653	/nfs/dbraw/zinc/96/66/53/456966653.db2.gz	QANYMVQUCLMAOM-RDJZCZTQSA-N	0	3	349.519	3.245	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1)OCC	ZINC000339203947	456990670	/nfs/dbraw/zinc/99/06/70/456990670.db2.gz	NODXLAXMZCZNRR-QRQLOZEOSA-N	0	3	330.472	3.309	20	30		EGEDHN
CCN1CCC(NC(=O)CSc2ccc(C(F)(F)F)nn2)CC1	ZINC000330169774	456995015	/nfs/dbraw/zinc/99/50/15/456995015.db2.gz	BMTMBWBSNCXGTK-UHFFFAOYSA-N	0	3	348.394	3.028	20	30		EGEDHN
COc1cccc([C@H](NC(=O)C(C)C#N)c2cc(F)ccc2OC)c1	ZINC000349612486	456995350	/nfs/dbraw/zinc/99/53/50/456995350.db2.gz	QXHNKUBTFJPWME-XIKOKIGWSA-N	0	3	342.370	3.208	20	30		EGEDHN
CC[C@@H](C(=O)Nc1nc(C)c(SCC#N)s1)N(CC)CC	ZINC000345982405	457009119	/nfs/dbraw/zinc/00/91/19/457009119.db2.gz	JCVJTXPQULFLCS-NSHDSACASA-N	0	3	326.491	3.126	20	30		EGEDHN
CCn1cc([C@H]2OCCC[C@@H]2NC(=O)[C@@H](C)N2CCCCCC2)cn1	ZINC000330318627	457026157	/nfs/dbraw/zinc/02/61/57/457026157.db2.gz	CNGNYJJFDPLCSN-BPQIPLTHSA-N	0	3	348.491	3.344	20	30		EGEDHN
C=CCNC(=O)CN[C@H](CC(C)C)c1cccc(Br)c1	ZINC000358989086	457044354	/nfs/dbraw/zinc/04/43/54/457044354.db2.gz	MSRYOPMDVLNLKS-OAHLLOKOSA-N	0	3	339.277	3.428	20	30		EGEDHN
O=C(N[C@H](CO)CN1CCCCC1)c1ccc(Cl)c(Cl)c1	ZINC000330600236	457059719	/nfs/dbraw/zinc/05/97/19/457059719.db2.gz	FUBXXJSNHRZVKK-LBPRGKRZSA-N	0	3	331.243	3.145	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C)OCC	ZINC000339359257	457066517	/nfs/dbraw/zinc/06/65/17/457066517.db2.gz	OFTHJUBLJISMHO-UYAOXDASSA-N	0	3	344.499	3.481	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1)OCC	ZINC000339374011	457074076	/nfs/dbraw/zinc/07/40/76/457074076.db2.gz	DEXGHRMOEKERHI-RTBURBONSA-N	0	3	330.472	3.139	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1)OCC	ZINC000339383558	457082301	/nfs/dbraw/zinc/08/23/01/457082301.db2.gz	WEZMQJIJXMZKMB-PMACEKPBSA-N	0	3	344.499	3.481	20	30		EGEDHN
C=CC[C@H](C)N[C@H]1CCS(=O)(=O)c2ccc(Br)cc21	ZINC000359648909	457104092	/nfs/dbraw/zinc/10/40/92/457104092.db2.gz	XAJAQOSZMDNOIA-GWCFXTLKSA-N	0	3	344.274	3.222	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N[C@@H](CN1CCCC1)c1ccccc1)OCC	ZINC000339426226	457108768	/nfs/dbraw/zinc/10/87/68/457108768.db2.gz	RXRQICVJCSFTLZ-RBUKOAKNSA-N	0	3	330.472	3.311	20	30		EGEDHN
CCN1CCC(NC(=O)Nc2ccc(OC(C)C)c(OC)c2)CC1	ZINC000331015917	457119877	/nfs/dbraw/zinc/11/98/77/457119877.db2.gz	YBFLZRBUROCDFE-UHFFFAOYSA-N	0	3	335.448	3.293	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCCN(Cc1ccccc1)Cc1ccccc1	ZINC000359766522	457128609	/nfs/dbraw/zinc/12/86/09/457128609.db2.gz	NUQLLBYVRFXUCT-GOSISDBHSA-N	0	3	335.451	3.355	20	30		EGEDHN
Cc1ccc(C#N)c(NCCCN2CCN(C)C[C@@H]2c2ccccc2)n1	ZINC000346855403	457185569	/nfs/dbraw/zinc/18/55/69/457185569.db2.gz	UMXWXAIYRRHFCN-HXUWFJFHSA-N	0	3	349.482	3.052	20	30		EGEDHN
CC[C@@H](c1ccccc1)[C@@H]1CCCN1CC(=O)N(CC)CCC#N	ZINC000350634089	457194672	/nfs/dbraw/zinc/19/46/72/457194672.db2.gz	RYYFUHWCUMVNGV-OALUTQOASA-N	0	3	327.472	3.407	20	30		EGEDHN
COc1cc(CN(C)C(=O)C(C)C#N)ccc1OCc1ccccc1	ZINC000347061260	457210230	/nfs/dbraw/zinc/21/02/30/457210230.db2.gz	DXJPVWWRBNIXKT-OAHLLOKOSA-N	0	3	338.407	3.392	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)Cc2ccc(C#N)cc2)C1	ZINC000347074621	457217569	/nfs/dbraw/zinc/21/75/69/457217569.db2.gz	KKMXFWFCEVNEFU-JXFKEZNVSA-N	0	3	333.435	3.052	20	30		EGEDHN
CC(C)Cc1ccc([C@@H](CNCc2cc(C#N)n(C)c2)N(C)C)cc1	ZINC000342305436	457226560	/nfs/dbraw/zinc/22/65/60/457226560.db2.gz	VSBVXPSYHSUROH-OAQYLSRUSA-N	0	3	338.499	3.488	20	30		EGEDHN
CC(C#N)C(=O)NC[C@@H](C)Sc1ccc(Br)cc1	ZINC000347102738	457229226	/nfs/dbraw/zinc/22/92/26/457229226.db2.gz	HZPZJJBKUOWYBZ-NXEZZACHSA-N	0	3	327.247	3.206	20	30		EGEDHN
COc1cc(C(=O)C(C#N)c2ccncn2)cc(OC)c1C(C)C	ZINC000354459556	457237059	/nfs/dbraw/zinc/23/70/59/457237059.db2.gz	DZNDHLKMGYOMPJ-ZDUSSCGKSA-N	0	3	325.368	3.107	20	30		EGEDHN
N#CC(C(=O)c1ccccc1NC(=O)c1ccsc1)c1ccncn1	ZINC000354460854	457238707	/nfs/dbraw/zinc/23/87/07/457238707.db2.gz	AJOILDIRKCLHTJ-CQSZACIVSA-N	0	3	348.387	3.280	20	30		EGEDHN
C=C(C)CCN1CCc2cc(OC)c(OC)cc2[C@H]1CC(=O)OC	ZINC000351855932	457321326	/nfs/dbraw/zinc/32/13/26/457321326.db2.gz	QPGIONGANZZLPY-MRXNPFEDSA-N	0	3	333.428	3.132	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN2CCCC[C@@H](C)C2)cc1	ZINC000360604662	457321775	/nfs/dbraw/zinc/32/17/75/457321775.db2.gz	MEJLUKNOAFNAHO-QGZVFWFLSA-N	0	3	343.471	3.454	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CN[C@H](c2cccs2)C2CC2)cc1	ZINC000342513978	457344993	/nfs/dbraw/zinc/34/49/93/457344993.db2.gz	RHYOWMSSXOQKCZ-YJBOKZPZSA-N	0	3	328.437	3.100	20	30		EGEDHN
C[C@H](N[C@@H](C)c1ccc(F)c2ccccc21)C(=O)N(C)CCC#N	ZINC000352249010	457352370	/nfs/dbraw/zinc/35/23/70/457352370.db2.gz	FTGFHXJDKQQFIR-KBPBESRZSA-N	0	3	327.403	3.390	20	30		EGEDHN
CC(C)CN1CCO[C@H](CN[C@@H]2CCCCc3cc(C#N)ccc32)C1	ZINC000360838323	457377108	/nfs/dbraw/zinc/37/71/08/457377108.db2.gz	UBTQOPOLFYCMER-TZIWHRDSSA-N	0	3	341.499	3.272	20	30		EGEDHN
CCC(C#N)(CC)C(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C	ZINC000383086769	457423878	/nfs/dbraw/zinc/42/38/78/457423878.db2.gz	MDVPHJVNDRVGRV-KRWDZBQOSA-N	0	3	327.472	3.439	20	30		EGEDHN
Cc1cc(NC[C@H]2CCCN(Cc3cccs3)C2)c(C#N)cn1	ZINC000425227651	457465703	/nfs/dbraw/zinc/46/57/03/457465703.db2.gz	RVQVLWIMXLHSRN-OAHLLOKOSA-N	0	3	326.469	3.069	20	30		EGEDHN
N#Cc1nc(N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)ccc1Cl	ZINC000425273419	457477101	/nfs/dbraw/zinc/47/71/01/457477101.db2.gz	JDMVHAGNURUSIX-MAUKXSAKSA-N	0	3	338.842	3.317	20	30		EGEDHN
CC(C)(C#N)C(=O)N1CC[C@@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000374107687	457479151	/nfs/dbraw/zinc/47/91/51/457479151.db2.gz	LLJFLJPGPWMBQT-FQEVSTJZSA-N	0	3	325.456	3.051	20	30		EGEDHN
C[C@H](NCCN1CCCC1=O)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000369984349	457487579	/nfs/dbraw/zinc/48/75/79/457487579.db2.gz	LAEYNUHAJSLTFB-INIZCTEOSA-N	0	3	333.435	3.498	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NC[C@@]1(C)CCN(Cc2ccccc2)C1)OCC	ZINC000374254046	457544901	/nfs/dbraw/zinc/54/49/01/457544901.db2.gz	CIHPUJXKCOCJBB-TZIWHRDSSA-N	0	3	344.499	3.386	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)NC[C@]1(C)CCN(Cc2ccccc2)C1	ZINC000374279495	457563947	/nfs/dbraw/zinc/56/39/47/457563947.db2.gz	KQYVRMHIFFVTGI-FQEVSTJZSA-N	0	3	337.423	3.102	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)c2ccnc(C3CC3)c2)cc1	ZINC000408513972	457572413	/nfs/dbraw/zinc/57/24/13/457572413.db2.gz	IOBPKWLZCXGZQY-QGZVFWFLSA-N	0	3	333.391	3.483	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)c2ccnc(C3CC3)c2)cc1	ZINC000408513971	457572595	/nfs/dbraw/zinc/57/25/95/457572595.db2.gz	IOBPKWLZCXGZQY-KRWDZBQOSA-N	0	3	333.391	3.483	20	30		EGEDHN
CCCCCCCCC(=O)N1CC[C@H](N2CCN(C)CC2)[C@H](C)C1	ZINC000374316847	457582040	/nfs/dbraw/zinc/58/20/40/457582040.db2.gz	JABABJDAKFWBIU-MOPGFXCFSA-N	0	3	337.552	3.221	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N(C)CCC(=O)Nc1cc(N)ccc1F	ZINC000425537636	457590192	/nfs/dbraw/zinc/59/01/92/457590192.db2.gz	QMRWWYITKMNDCZ-ZDUSSCGKSA-N	0	3	340.402	3.301	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN[C@H](C)c1ccncc1CC	ZINC000361130718	457601203	/nfs/dbraw/zinc/60/12/03/457601203.db2.gz	HATSZDWVKCZAFI-VQIMIIECSA-N	0	3	340.467	3.463	20	30		EGEDHN
CCc1cnccc1[C@@H](C)NCCOc1ccc(C#N)cc1OC	ZINC000361135648	457604988	/nfs/dbraw/zinc/60/49/88/457604988.db2.gz	MXOYZFIKQUMBKM-CQSZACIVSA-N	0	3	325.412	3.254	20	30		EGEDHN
C=CCC[C@H](C(=O)NC1CCN([C@H]2CCOC2)CC1)c1ccccc1	ZINC000364462469	457613850	/nfs/dbraw/zinc/61/38/50/457613850.db2.gz	PQJSKJIMGCCZMQ-PMACEKPBSA-N	0	3	342.483	3.106	20	30		EGEDHN
C=CC[C@@H](CC)NC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1	ZINC000410125055	457629999	/nfs/dbraw/zinc/62/99/99/457629999.db2.gz	YFWYVSNHCLMFPT-GOSISDBHSA-N	0	3	329.488	3.302	20	30		EGEDHN
Cc1nc(N2CCCN(Cc3ccc(C#N)cc3)CC2)sc1C	ZINC000357666684	457647925	/nfs/dbraw/zinc/64/79/25/457647925.db2.gz	ZYXWLRLFMVSNEU-UHFFFAOYSA-N	0	3	326.469	3.344	20	30		EGEDHN
CC(C)(O)CN1CCc2c(cccc2NCc2cccc(C#N)c2)C1	ZINC000374603445	457670587	/nfs/dbraw/zinc/67/05/87/457670587.db2.gz	KMOFYMIROOZNSX-UHFFFAOYSA-N	0	3	335.451	3.299	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@@H](C)N1CCC[C@H](OC)CC1	ZINC000374681970	457686656	/nfs/dbraw/zinc/68/66/56/457686656.db2.gz	XQOCHXQILSTFPB-CVEARBPZSA-N	0	3	336.501	3.152	20	30		EGEDHN
FC(F)(F)Oc1ccc(C#CCN[C@@H]2CCO[C@H]2C2CC2)cc1	ZINC000364779145	457691630	/nfs/dbraw/zinc/69/16/30/457691630.db2.gz	FQIAGRHFVULNOH-CVEARBPZSA-N	0	3	325.330	3.094	20	30		EGEDHN
CC(C#N)C(=O)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1	ZINC000357793832	457692640	/nfs/dbraw/zinc/69/26/40/457692640.db2.gz	IZFMQDCZDILYJE-AWEZNQCLSA-N	0	3	348.381	3.454	20	30		EGEDHN
Cc1cccc(C)c1NC(=O)CNC(=O)C(C#N)CCc1ccccc1	ZINC000433228465	457785778	/nfs/dbraw/zinc/78/57/78/457785778.db2.gz	WRBNYWLLKSIRGU-SFHVURJKSA-N	0	3	349.434	3.131	20	30		EGEDHN
Cn1c2ccccc2cc(CN[C@@H]2CCc3ccc(C#N)cc32)c1=O	ZINC000426302507	457802384	/nfs/dbraw/zinc/80/23/84/457802384.db2.gz	SANXLPYXGRWEQM-LJQANCHMSA-N	0	3	329.403	3.187	20	30		EGEDHN
COC[C@H](NC(=O)C(C#N)CCc1ccccc1)c1ccc(C)o1	ZINC000433389105	457827043	/nfs/dbraw/zinc/82/70/43/457827043.db2.gz	WFVPYGHIXVVBFP-SJORKVTESA-N	0	3	326.396	3.164	20	30		EGEDHN
Cc1cccc(N(CCC#N)C(=O)CN2CC[C@H]3CCC[C@H]32)c1C	ZINC000426476729	457838113	/nfs/dbraw/zinc/83/81/13/457838113.db2.gz	VVIJWZXLAKACRX-IEBWSBKVSA-N	0	3	325.456	3.425	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN[C@@H]2CCN(c3ccccc3F)C2)cc1	ZINC000366589264	457862496	/nfs/dbraw/zinc/86/24/96/457862496.db2.gz	FBMCYSYZABEKAN-NVXWUHKLSA-N	0	3	339.414	3.485	20	30		EGEDHN
N#CC1(CCCN2CCC(F)(c3cccnc3)CC2)CCOCC1	ZINC000375332586	457885042	/nfs/dbraw/zinc/88/50/42/457885042.db2.gz	CRKFNDQFUUYWOL-UHFFFAOYSA-N	0	3	331.435	3.443	20	30		EGEDHN
C=CCN(C)CCN(CC)Cc1nc(-c2ccc(F)c(C)c2)no1	ZINC000411636372	457935759	/nfs/dbraw/zinc/93/57/59/457935759.db2.gz	DHDREZHPPFMFDV-UHFFFAOYSA-N	0	3	332.423	3.124	20	30		EGEDHN
C=CCN(C)CCN(CC)[C@H](C)c1nc(Cc2ccc(F)cc2)no1	ZINC000411639304	457936035	/nfs/dbraw/zinc/93/60/35/457936035.db2.gz	IVJVSFUWHOBQLV-OAHLLOKOSA-N	0	3	346.450	3.300	20	30		EGEDHN
C=CCN(C)CCN(CC)CC(=O)Nc1cccc(Cl)c1Cl	ZINC000411638051	457937201	/nfs/dbraw/zinc/93/72/01/457937201.db2.gz	GWLZQOSXSIDRKA-UHFFFAOYSA-N	0	3	344.286	3.372	20	30		EGEDHN
C=CCC1(NC(=O)NC2CCN(CCCOC)CC2)CCCCC1	ZINC000458237316	457982074	/nfs/dbraw/zinc/98/20/74/457982074.db2.gz	LKBHERKZSBUBBU-UHFFFAOYSA-N	0	3	337.508	3.066	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N[C@@H](C)c1cccc(O)c1)C(C)C	ZINC000444854462	457989170	/nfs/dbraw/zinc/98/91/70/457989170.db2.gz	WWKGPXRPOXNDRG-LPHOPBHVSA-N	0	3	345.487	3.451	20	30		EGEDHN
C=CCCCNC(=O)N1C[C@H]2CN(Cc3ccccc3)CC[C@@H]2C1	ZINC000367906947	457995071	/nfs/dbraw/zinc/99/50/71/457995071.db2.gz	LZWNMQSLHOJNEE-RTBURBONSA-N	0	3	327.472	3.116	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CC(c3cccc(Cl)c3)C2)CC1	ZINC000458318293	458011076	/nfs/dbraw/zinc/01/10/76/458011076.db2.gz	JDBKLJYSFORIPT-UHFFFAOYSA-N	0	3	347.890	3.489	20	30		EGEDHN
N#CCSCCCN1CCCC[C@@H]1COC(=O)N1CCCCC1	ZINC000368606754	458048804	/nfs/dbraw/zinc/04/88/04/458048804.db2.gz	FRPGHNDOUCFWKY-MRXNPFEDSA-N	0	3	339.505	3.110	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@@H](NCc3cccc4nccn43)C2)c(F)c1	ZINC000362336994	458113450	/nfs/dbraw/zinc/11/34/50/458113450.db2.gz	RXSPTHXKUJHXOQ-MRXNPFEDSA-N	0	3	349.413	3.104	20	30		EGEDHN
CC[C@@]1(O)CCN(Cc2cccc(OCc3ccccc3C#N)c2)C1	ZINC000428424384	458139215	/nfs/dbraw/zinc/13/92/15/458139215.db2.gz	TVMMPWLXKGTGJE-OAQYLSRUSA-N	0	3	336.435	3.484	20	30		EGEDHN
C=CCC1(NC(=O)NCC2(SC)CCN(C)CC2)CCCCC1	ZINC000458792411	458173275	/nfs/dbraw/zinc/17/32/75/458173275.db2.gz	RHSCJONEUJHRBD-UHFFFAOYSA-N	0	3	339.549	3.392	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN(C)[C@H]1C[C@](C)(OC)C1(C)C	ZINC000362439864	458177258	/nfs/dbraw/zinc/17/72/58/458177258.db2.gz	PUMXXSJXVMNMDI-HKUYNNGSSA-N	0	3	332.444	3.081	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1CN[C@@H](C(=O)N1CCCCC1)c1ccccc1	ZINC000435674733	458182373	/nfs/dbraw/zinc/18/23/73/458182373.db2.gz	RRUNQDBPWJUOGH-AQNXPRMDSA-N	0	3	342.483	3.311	20	30		EGEDHN
CN(C)CCN(Cc1ccc(F)cc1)C(=O)NCC(C)(C)CCC#N	ZINC000358743568	458185827	/nfs/dbraw/zinc/18/58/27/458185827.db2.gz	VOTBEVBELBFMGR-UHFFFAOYSA-N	0	3	348.466	3.229	20	30		EGEDHN
Cc1ccc(CC2CCN([C@@H](C)C(=O)N(C)CCC#N)CC2)cc1C	ZINC000428721755	458199996	/nfs/dbraw/zinc/19/99/96/458199996.db2.gz	FLAFPRAHSHPBAG-SFHVURJKSA-N	0	3	341.499	3.319	20	30		EGEDHN
CSc1ccc([C@H](CNC(=O)N(C)CC(C)(C)C#N)N(C)C)cc1	ZINC000458886259	458205645	/nfs/dbraw/zinc/20/56/45/458205645.db2.gz	HNCXCKJWRWSFOO-INIZCTEOSA-N	0	3	348.516	3.202	20	30		EGEDHN
COc1cccc(CCCN2CC[C@H](Oc3ccc(C#N)cn3)C2)c1	ZINC000428810133	458214878	/nfs/dbraw/zinc/21/48/78/458214878.db2.gz	XOMFXQHPVMEBEF-IBGZPJMESA-N	0	3	337.423	3.048	20	30		EGEDHN
CCN(CCC#N)C(=O)CN1C[C@H](c2ccccc2)[C@H]2CCCC[C@H]21	ZINC000362585073	458285413	/nfs/dbraw/zinc/28/54/13/458285413.db2.gz	BLBVSRNCYPHOIC-VAMGGRTRSA-N	0	3	339.483	3.407	20	30		EGEDHN
Cn1c(CC#N)nnc1SCc1cccc(CN2CCCCC2)c1	ZINC000413006843	458290036	/nfs/dbraw/zinc/29/00/36/458290036.db2.gz	QINHGRFPHCVRRS-UHFFFAOYSA-N	0	3	341.484	3.159	20	30		EGEDHN
Cc1cc(NCCCCN2C[C@@H](C)O[C@@H](C)C2)c(C#N)cc1[N+](=O)[O-]	ZINC000413180620	458293853	/nfs/dbraw/zinc/29/38/53/458293853.db2.gz	DKGHUGGBJDQNIJ-GASCZTMLSA-N	0	3	346.431	3.076	20	30		EGEDHN
CN(C)CCN(CCCc1ccccc1)c1ncc(C#N)cc1F	ZINC000413169380	458294309	/nfs/dbraw/zinc/29/43/09/458294309.db2.gz	AHXIXTMTIQKSGR-UHFFFAOYSA-N	0	3	326.419	3.093	20	30		EGEDHN
CC(C)(NCCOc1ccc(C#N)cc1)c1ccccc1[N+](=O)[O-]	ZINC000429262602	458302063	/nfs/dbraw/zinc/30/20/63/458302063.db2.gz	UXJMWUGSEQHQHN-UHFFFAOYSA-N	0	3	325.368	3.370	20	30		EGEDHN
C[C@@H]1C[C@H](O)CN(Cc2cccc(OCc3ccccc3C#N)c2)C1	ZINC000414530060	458322073	/nfs/dbraw/zinc/32/20/73/458322073.db2.gz	WPZBQLINOUHNKP-UZLBHIALSA-N	0	3	336.435	3.340	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)Nc2ccc3c(c2)CNCC3)cc1	ZINC000415892752	458335197	/nfs/dbraw/zinc/33/51/97/458335197.db2.gz	JKSRIEDXWJKWKH-UHFFFAOYSA-N	0	3	337.423	3.219	20	30		EGEDHN
CN(C)C1(CNC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)CC1	ZINC000416302153	458341991	/nfs/dbraw/zinc/34/19/91/458341991.db2.gz	NNQNHHARUBXPIC-UHFFFAOYSA-N	0	3	335.407	3.175	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)NCc1cc(C)cc(N)c1)C(C)C	ZINC000417065783	458359558	/nfs/dbraw/zinc/35/95/58/458359558.db2.gz	PWWVITGVFUUTLA-LJQANCHMSA-N	0	3	344.503	3.075	20	30		EGEDHN
C[C@@](C#N)(NC(=O)CN1CC[C@@H](c2ccccc2)C1(C)C)C1CC1	ZINC000421013198	458405786	/nfs/dbraw/zinc/40/57/86/458405786.db2.gz	FYXBHRVKWMCOPN-PXNSSMCTSA-N	0	3	325.456	3.063	20	30		EGEDHN
C[C@H](C#N)CSc1ccccc1NC(=O)N(C)C[C@H]1CCCN1C	ZINC000421061170	458407400	/nfs/dbraw/zinc/40/74/00/458407400.db2.gz	LMICKHKYHBDTFQ-HUUCEWRRSA-N	0	3	346.500	3.496	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000449909202	458434292	/nfs/dbraw/zinc/43/42/92/458434292.db2.gz	YYHCYCAMOVLRLA-MDNKFWRPSA-N	0	3	342.483	3.089	20	30		EGEDHN
CCOC[C@@H]1CCCCN1Cc1cn(C)nc1-c1ccc(C#N)cc1	ZINC000459682516	458446064	/nfs/dbraw/zinc/44/60/64/458446064.db2.gz	YWDODIFYYOFCRI-IBGZPJMESA-N	0	3	338.455	3.350	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1SCC1(C#N)CCC1	ZINC000450743217	458456184	/nfs/dbraw/zinc/45/61/84/458456184.db2.gz	GESISZHELFTQRR-UHFFFAOYSA-N	0	3	345.516	3.278	20	30		EGEDHN
CN(CCOc1ccccc1C#N)[C@@H](CO)c1ccc(Cl)cc1	ZINC000451321567	458472830	/nfs/dbraw/zinc/47/28/30/458472830.db2.gz	CTLBWACKCCHJRP-KRWDZBQOSA-N	0	3	330.815	3.256	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC(=O)N[C@@H](c1cccs1)C(C)(C)C	ZINC000451675167	458485487	/nfs/dbraw/zinc/48/54/87/458485487.db2.gz	OXVLXCCUXXOIEJ-KEYYUXOJSA-N	0	3	336.501	3.275	20	30		EGEDHN
CC[C@@H]1CN(CC)CCN1CC#Cc1ccc(OC(F)(F)F)cc1	ZINC000451743288	458486028	/nfs/dbraw/zinc/48/60/28/458486028.db2.gz	TVTXSHDORICLKH-MRXNPFEDSA-N	0	3	340.389	3.353	20	30		EGEDHN
C=CC(C)(C)CNC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1	ZINC000452774524	458509574	/nfs/dbraw/zinc/50/95/74/458509574.db2.gz	FIKBEZVMASNOKD-UHFFFAOYSA-N	0	3	329.488	3.159	20	30		EGEDHN
COC1([C@@H](C)NCC#Cc2ccc(C(F)(F)F)cc2)CCOCC1	ZINC000453143365	458520260	/nfs/dbraw/zinc/52/02/60/458520260.db2.gz	DXLZCLSEYDPMEN-CQSZACIVSA-N	0	3	341.373	3.231	20	30		EGEDHN
CC(C)(C[C@H]1CCCN([C@@H]2CCc3ccc(C#N)cc32)C1)C(N)=O	ZINC000453271991	458523308	/nfs/dbraw/zinc/52/33/08/458523308.db2.gz	DODPQMHXFGQYOS-CRAIPNDOSA-N	0	3	325.456	3.159	20	30		EGEDHN
C[C@H](c1ccc(C#N)cc1F)N1CCC[C@H](CC(C)(C)C(N)=O)C1	ZINC000453271978	458523381	/nfs/dbraw/zinc/52/33/81/458523381.db2.gz	DJTUSDBIBQHSAO-UKRRQHHQSA-N	0	3	331.435	3.372	20	30		EGEDHN
CN1C[C@@H](NC(=O)c2ccc(C(C)(C)C#N)cc2)[C@@H](c2ccccc2)C1	ZINC000373538342	458523726	/nfs/dbraw/zinc/52/37/26/458523726.db2.gz	UYGZIVOFBHXSMQ-WOJBJXKFSA-N	0	3	347.462	3.315	20	30		EGEDHN
C=CCC[C@H](CO)N[C@H]1CCc2c1c(Br)ccc2F	ZINC000453339040	458525185	/nfs/dbraw/zinc/52/51/85/458525185.db2.gz	CTFLNNOGTDECBI-YGRLFVJLSA-N	0	3	328.225	3.492	20	30		EGEDHN
C=CCC[C@H](CO)N[C@@H]1CCc2c1c(Br)ccc2F	ZINC000453339006	458525257	/nfs/dbraw/zinc/52/52/57/458525257.db2.gz	CTFLNNOGTDECBI-QMTHXVAHSA-N	0	3	328.225	3.492	20	30		EGEDHN
C=C(C)Cn1c([C@@H]2CC[C@H](C)O2)nnc1N1CCCN(C(C)C)CC1	ZINC000453468235	458534588	/nfs/dbraw/zinc/53/45/88/458534588.db2.gz	XPGRXBMAUOAAEY-IRXDYDNUSA-N	0	3	347.507	3.015	20	30		EGEDHN
COc1cccc(Oc2ccc(NC(=O)[C@H](N)CCCC#N)cc2)c1	ZINC000424086531	458555696	/nfs/dbraw/zinc/55/56/96/458555696.db2.gz	CGJPZYDKOBXFRN-GOSISDBHSA-N	0	3	339.395	3.447	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)NCC1(c2cccc(Cl)c2)CCCC1	ZINC000424107411	458559995	/nfs/dbraw/zinc/55/99/95/458559995.db2.gz	UOQBPGCZTOUEFT-INIZCTEOSA-N	0	3	333.863	3.289	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCC[C@@H]2CCc3ccccc32)CC1	ZINC000454464974	458563450	/nfs/dbraw/zinc/56/34/50/458563450.db2.gz	OHKRBCUIYFOOMO-SFHVURJKSA-N	0	3	341.499	3.446	20	30		EGEDHN
C[C@H]1c2cc(Cl)cc(Cl)c2CCN1C(=O)[C@@H](N)CCCC#N	ZINC000424130471	458566835	/nfs/dbraw/zinc/56/68/35/458566835.db2.gz	FJNQSBAGILWCPP-BONVTDFDSA-N	0	3	340.254	3.460	20	30		EGEDHN
Cn1c2ccccc2nc1-c1cccc(NC(=O)[C@H](N)CCCC#N)c1	ZINC000424135914	458567456	/nfs/dbraw/zinc/56/74/56/458567456.db2.gz	PTGMYDSDNWJVHN-MRXNPFEDSA-N	0	3	347.422	3.200	20	30		EGEDHN
C[C@H](CN1CCCCC1)NC(=O)C(C)(C)Cc1ccc(C#N)cc1	ZINC000454676359	458570532	/nfs/dbraw/zinc/57/05/32/458570532.db2.gz	DSIMTQQODVFBEH-MRXNPFEDSA-N	0	3	327.472	3.118	20	30		EGEDHN
C[C@@H](C#N)CSc1ccccc1NC(=O)NC(C)(C)CN(C)C	ZINC000454743853	458573375	/nfs/dbraw/zinc/57/33/75/458573375.db2.gz	DPJRNICDYJZNEG-ZDUSSCGKSA-N	0	3	334.489	3.400	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NC(=O)N(CC)Cc1ccc(CN(C)C)cc1	ZINC000455435595	458598577	/nfs/dbraw/zinc/59/85/77/458598577.db2.gz	QGCCKOUOQOQZOH-MOPGFXCFSA-N	0	3	345.487	3.013	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)NCc1cnc(C)cc1C)C(C)C	ZINC000455560981	458604053	/nfs/dbraw/zinc/60/40/53/458604053.db2.gz	QCHROPNIFMIUJK-LJQANCHMSA-N	0	3	344.503	3.196	20	30		EGEDHN
CCN1CCCC[C@H]1CNC(=O)C(C)(C)Cc1ccc(C#N)cc1	ZINC000455620646	458604534	/nfs/dbraw/zinc/60/45/34/458604534.db2.gz	KUFRXURTGZJLHX-SFHVURJKSA-N	0	3	327.472	3.118	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cc(C(C)(C)C)nn1C)C(C)C	ZINC000494018253	458616737	/nfs/dbraw/zinc/61/67/37/458616737.db2.gz	ZLHBLQQECCVZKV-KRWDZBQOSA-N	0	3	346.519	3.146	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC000494080030	458625504	/nfs/dbraw/zinc/62/55/04/458625504.db2.gz	YABPFHXIINDGJC-MRXNPFEDSA-N	0	3	333.407	3.090	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCc1ccnc(C(F)(F)F)c1	ZINC000456045644	458629546	/nfs/dbraw/zinc/62/95/46/458629546.db2.gz	OGEGQYFRPPGVBK-HNNXBMFYSA-N	0	3	347.340	3.489	20	30		EGEDHN
CC(C)N1CCC[C@H](NC(=O)C(C)(C)Cc2ccc(C#N)cc2)C1	ZINC000456067143	458630698	/nfs/dbraw/zinc/63/06/98/458630698.db2.gz	MZYCXEKKFQIUNV-SFHVURJKSA-N	0	3	327.472	3.116	20	30		EGEDHN
COc1cccc([C@@H]2C[C@H]2NC(=O)C(C#N)CCc2ccccc2)c1	ZINC000456541887	458708916	/nfs/dbraw/zinc/70/89/16/458708916.db2.gz	XLFMZPKJPUXTLU-YSIASYRMSA-N	0	3	334.419	3.440	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)NC[C@@H](C)N1CCC(C)CC1	ZINC000463534463	458709667	/nfs/dbraw/zinc/70/96/67/458709667.db2.gz	VOHHJQCWIJOKTK-MRXNPFEDSA-N	0	3	346.471	3.110	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)NCCN1CCCC[C@H]1CC	ZINC000463763213	458718847	/nfs/dbraw/zinc/71/88/47/458718847.db2.gz	CLBHNEAECFAXIL-MRXNPFEDSA-N	0	3	346.471	3.254	20	30		EGEDHN
C=C[C@H]1CCCCN1C(=O)NCC1(N2CCSCC2)CCCC1	ZINC000494680930	458728110	/nfs/dbraw/zinc/72/81/10/458728110.db2.gz	JLBSKAWVNQNVPH-INIZCTEOSA-N	0	3	337.533	3.098	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N[C@H]1C[C@@H](OC)C1(C)C	ZINC000439626759	458734012	/nfs/dbraw/zinc/73/40/12/458734012.db2.gz	YRQPRJIBWUMGRJ-CWRNSKLLSA-N	0	3	336.501	3.054	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1ccc(OC)cc1F)C(C)C	ZINC000503981354	458734541	/nfs/dbraw/zinc/73/45/41/458734541.db2.gz	RSEOBLPYXBTJEJ-SFHVURJKSA-N	0	3	334.435	3.263	20	30		EGEDHN
C[C@@H](CNC(=O)C(C)(C)c1cc(F)cc(C#N)c1)N1CCCC[C@H]1C	ZINC000506494434	458751509	/nfs/dbraw/zinc/75/15/09/458751509.db2.gz	DJVNELYBIVTSRJ-CABCVRRESA-N	0	3	345.462	3.354	20	30		EGEDHN
C=CCn1c(CC(C)(C)C)nnc1N1CCN(C2CCCC2)CC1	ZINC000508937720	458768233	/nfs/dbraw/zinc/76/82/33/458768233.db2.gz	ZNJIGNTYYZMJEQ-UHFFFAOYSA-N	0	3	331.508	3.117	20	30		EGEDHN
C[C@H]1C[C@H](c2ccccc2)N(CC(=O)NCc2cccc(C#N)c2)C1	ZINC000513271454	458794487	/nfs/dbraw/zinc/79/44/87/458794487.db2.gz	KRDRCXYGEWUQGN-OXJNMPFZSA-N	0	3	333.435	3.258	20	30		EGEDHN
Cc1cccc([C@@H](C)NC[C@@H](O)COc2ccc(CC#N)cc2)c1C	ZINC000515319729	458807217	/nfs/dbraw/zinc/80/72/17/458807217.db2.gz	RNJGRSCGMIMKOD-IEBWSBKVSA-N	0	3	338.451	3.460	20	30		EGEDHN
C=CCC[C@@H](O)CN(C)CCOc1ccc(Br)cc1	ZINC000472751559	458807970	/nfs/dbraw/zinc/80/79/70/458807970.db2.gz	OFGSVVKYMVUFNV-CQSZACIVSA-N	0	3	328.250	3.087	20	30		EGEDHN
C=CCCCCNC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000472832407	458810468	/nfs/dbraw/zinc/81/04/68/458810468.db2.gz	IAPFABYUPSGMAK-UHFFFAOYSA-N	0	3	329.488	3.349	20	30		EGEDHN
C=CCc1ccc(OC[C@@H](O)CNCc2cscc2C)c(OC)c1	ZINC000518171162	458846665	/nfs/dbraw/zinc/84/66/65/458846665.db2.gz	RIJINPCQHXTGEF-KRWDZBQOSA-N	0	3	347.480	3.323	20	30		EGEDHN
COc1cc(CNCc2cccc(Cn3cccn3)c2)ccc1C#N	ZINC000440813375	458856842	/nfs/dbraw/zinc/85/68/42/458856842.db2.gz	ARVBTKVTTBWMCS-UHFFFAOYSA-N	0	3	332.407	3.101	20	30		EGEDHN
COc1cc(CNCCc2nccn2Cc2ccccc2)ccc1C#N	ZINC000440812940	458857033	/nfs/dbraw/zinc/85/70/33/458857033.db2.gz	LLZUPPAKWZKZJR-UHFFFAOYSA-N	0	3	346.434	3.144	20	30		EGEDHN
N#C[C@@H]1CC[C@@H](N2CCC[C@@H](CNC(=O)OCc3ccccc3)C2)C1	ZINC000495592093	458890727	/nfs/dbraw/zinc/89/07/27/458890727.db2.gz	HTHDLXRXTJUFHS-CEXWTWQISA-N	0	3	341.455	3.317	20	30		EGEDHN
Cc1cc(C#N)cnc1C(=O)NCCN1CCC2(CCCCC2)CC1	ZINC000518805122	458895240	/nfs/dbraw/zinc/89/52/40/458895240.db2.gz	QKOUKPODHRTEMW-UHFFFAOYSA-N	0	3	340.471	3.038	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)NCC(C)(C)CCC#N)N(C)C)cc1	ZINC000554217203	458897177	/nfs/dbraw/zinc/89/71/77/458897177.db2.gz	XSDWACLQMFNJMZ-SFHVURJKSA-N	0	3	344.503	3.481	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN2C[C@H](C)C[C@@H]2CC)cc1	ZINC000466929092	458937151	/nfs/dbraw/zinc/93/71/51/458937151.db2.gz	NHYZLXRPTZSVPD-SJORKVTESA-N	0	3	343.471	3.452	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N1CCC[C@@H](c2nc3ccccc3s2)C1	ZINC000519391524	458942518	/nfs/dbraw/zinc/94/25/18/458942518.db2.gz	DXKSCSHMIRXQAW-KGLIPLIRSA-N	0	3	342.468	3.023	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1ccc(N(C)C)cc1)C(C)C	ZINC000441869284	458979381	/nfs/dbraw/zinc/97/93/81/458979381.db2.gz	JOFXFRBGPPXSQB-LJQANCHMSA-N	0	3	329.488	3.181	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](O)Cc2ccccc2C(F)(F)F)s1	ZINC000566674035	458980732	/nfs/dbraw/zinc/98/07/32/458980732.db2.gz	NKAALYBSKGIZDE-GFCCVEGCSA-N	0	3	340.370	3.332	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2CN[C@@H]2CC[C@@H](C#N)C2)C[C@H](C)O1	ZINC000442781588	459035923	/nfs/dbraw/zinc/03/59/23/459035923.db2.gz	JKUQNASMLAFRIN-AXVVYFOYSA-N	0	3	327.472	3.078	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H]2CN(Cc3cccc(C#N)c3)C[C@@H]2C1	ZINC000496027728	459042117	/nfs/dbraw/zinc/04/21/17/459042117.db2.gz	IXIOBKYTPBOIRV-QZTJIDSGSA-N	0	3	341.455	3.247	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@H]1CC[C@H](CNC[C@H](C#N)CCC#N)CC1	ZINC000496075350	459056856	/nfs/dbraw/zinc/05/68/56/459056856.db2.gz	GEICOFAIBHTHKG-ULQDDVLXSA-N	0	3	348.491	3.351	20	30		EGEDHN
C[C@@H]1CN(C(=O)Nc2cccc(CC#N)c2)CCN(C2CCC2)C1	ZINC000567229309	459070071	/nfs/dbraw/zinc/07/00/71/459070071.db2.gz	WUVOUZYYUWNITO-HNNXBMFYSA-N	0	3	326.444	3.091	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N(C)C[C@@H]1CN(c2ccccc2)CCO1	ZINC000577765646	459091168	/nfs/dbraw/zinc/09/11/68/459091168.db2.gz	HSRXPTSQSPIHQX-LAUBAEHRSA-N	0	3	335.451	3.456	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC=C(CNCc2ccc(C#N)c(F)c2)CC1	ZINC000496156688	459091575	/nfs/dbraw/zinc/09/15/75/459091575.db2.gz	AIBWRPOIYYYOPF-UHFFFAOYSA-N	0	3	345.418	3.354	20	30		EGEDHN
CC1CC(C#N)(C(=O)N(C)c2ccc(OCCN3CCCC3)cc2)C1	ZINC000532480172	459096223	/nfs/dbraw/zinc/09/62/23/459096223.db2.gz	ILNPKXPLBKXYEY-UHFFFAOYSA-N	0	3	341.455	3.064	20	30		EGEDHN
Cc1cc(C#N)cnc1C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000590294907	459110255	/nfs/dbraw/zinc/11/02/55/459110255.db2.gz	TVXZVLOWRINPED-VQIMIIECSA-N	0	3	348.450	3.045	20	30		EGEDHN
CC(C)(C)OC(=O)NCC1(CNCc2ccc(C#N)c(F)c2)CC1	ZINC000496304913	459144036	/nfs/dbraw/zinc/14/40/36/459144036.db2.gz	ISMRSGSRMBPUIA-UHFFFAOYSA-N	0	3	333.407	3.092	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN(C(=O)C(C)(C)C)C1	ZINC000590603375	459160036	/nfs/dbraw/zinc/16/00/36/459160036.db2.gz	SYNNEJTYFPGZEP-SFHVURJKSA-N	0	3	327.472	3.275	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCCC[C@H]2NC(=O)c2ccccc2)s1	ZINC000594993669	459209019	/nfs/dbraw/zinc/20/90/19/459209019.db2.gz	GRRMCOIBAZTLJV-QZTJIDSGSA-N	0	3	339.464	3.451	20	30		EGEDHN
CC(C)(C)OC(=O)NC1(CNCc2ccc(C#N)o2)CCCCC1	ZINC000496510203	459222071	/nfs/dbraw/zinc/22/20/71/459222071.db2.gz	BURZOUZRWJXSTG-UHFFFAOYSA-N	0	3	333.432	3.468	20	30		EGEDHN
C=C(C)Cn1c(C2CCCC2)nnc1N1CCN(CC(C)C)CC1	ZINC000558988719	459228777	/nfs/dbraw/zinc/22/87/77/459228777.db2.gz	UOUCGTKAMWJWCB-UHFFFAOYSA-N	0	3	331.508	3.290	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC(C)(CNC[C@H](C#N)CCC#N)CC1	ZINC000496637756	459269216	/nfs/dbraw/zinc/26/92/16/459269216.db2.gz	XSYXNSACKAAWLX-HNNXBMFYSA-N	0	3	334.464	3.057	20	30		EGEDHN
N#Cc1ccc(CCN2CCCN(C(=O)CC3CCCC3)CC2)cc1	ZINC000595294816	459269307	/nfs/dbraw/zinc/26/93/07/459269307.db2.gz	GPMLGJJFHWWGIL-UHFFFAOYSA-N	0	3	339.483	3.215	20	30		EGEDHN
C=CCN(CC1CCCCC1)C(=O)NC[C@]1(N(C)C)CCSC1	ZINC000481789853	459273557	/nfs/dbraw/zinc/27/35/57/459273557.db2.gz	QOPFJWFJSYGRET-GOSISDBHSA-N	0	3	339.549	3.202	20	30		EGEDHN
C=C[C@H](CC(=O)N1C[C@@H](c2ccccc2F)[C@H](N)C1)c1ccccc1	ZINC000581551370	459274045	/nfs/dbraw/zinc/27/40/45/459274045.db2.gz	LMKOHNIXHMFSJZ-MOXGXCLJSA-N	0	3	338.426	3.439	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@@H](C)N1CC[C@@H](Cc2ccc(F)cc2)C1	ZINC000523011142	459276793	/nfs/dbraw/zinc/27/67/93/459276793.db2.gz	FFRDLRKMKGIZGX-AEFFLSMTSA-N	0	3	330.447	3.279	20	30		EGEDHN
N#Cc1cnn2cc(CN3CCCC[C@H]3Cc3ccc(F)cc3)cnc12	ZINC000568395048	459280359	/nfs/dbraw/zinc/28/03/59/459280359.db2.gz	MUHAJMGDFNNQBT-IBGZPJMESA-N	0	3	349.413	3.337	20	30		EGEDHN
C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1CN[C@@H]1CC[C@@H](C#N)C1	ZINC000496716513	459297428	/nfs/dbraw/zinc/29/74/28/459297428.db2.gz	MZXNIHKAXGYQSV-GBJTYRQASA-N	0	3	337.464	3.029	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CCC[C@@H](CC#N)C2)C1	ZINC000595467021	459312650	/nfs/dbraw/zinc/31/26/50/459312650.db2.gz	WRYSBFJCUWRVBK-ZIFCJYIRSA-N	0	3	340.471	3.157	20	30		EGEDHN
C=CCN(C(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1)C1CC1	ZINC000536800150	459361122	/nfs/dbraw/zinc/36/11/22/459361122.db2.gz	FBMKRFJCHYZYDV-LJQANCHMSA-N	0	3	327.472	3.492	20	30		EGEDHN
C=CCNC(=O)NC(=O)CN[C@H](c1ccc(Cl)cc1)C1CCCC1	ZINC000538206825	459368784	/nfs/dbraw/zinc/36/87/84/459368784.db2.gz	YWSGBBIOQYKPKI-KRWDZBQOSA-N	0	3	349.862	3.173	20	30		EGEDHN
COc1cc(C#N)ccc1CN1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000595747930	459424356	/nfs/dbraw/zinc/42/43/56/459424356.db2.gz	PWPUGFBDMNZRMH-VQTJNVASSA-N	0	3	336.435	3.165	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)s1)[C@@H]1CCCN1C(=O)OC(C)(C)C	ZINC000497081102	459431196	/nfs/dbraw/zinc/43/11/96/459431196.db2.gz	MAANJSUUFZKAFF-DOMZBBRYSA-N	0	3	335.473	3.497	20	30		EGEDHN
C=CCC1(NCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])CCCC1	ZINC000595780215	459437092	/nfs/dbraw/zinc/43/70/92/459437092.db2.gz	KUXPNQPAFZCGQM-UHFFFAOYSA-N	0	3	333.388	3.020	20	30		EGEDHN
COc1ccccc1[C@@H](CNc1ccnc(C#N)c1)N1CCCCC1	ZINC000583160810	459494044	/nfs/dbraw/zinc/49/40/44/459494044.db2.gz	RKQNAKILXKSATM-LJQANCHMSA-N	0	3	336.439	3.023	20	30		EGEDHN
COCCN(CC(=O)Nc1cc(Cl)ccc1C#N)[C@H]1CCC[C@@H]1C	ZINC000487948767	459535371	/nfs/dbraw/zinc/53/53/71/459535371.db2.gz	ARCBTPVSLPNYNA-GUYCJALGSA-N	0	3	349.862	3.287	20	30		EGEDHN
COCCN(CC(=O)Nc1ccc(C#N)c(Cl)c1)[C@H]1CCC[C@@H]1C	ZINC000487964051	459537107	/nfs/dbraw/zinc/53/71/07/459537107.db2.gz	OMAGSNDANRIKDX-GUYCJALGSA-N	0	3	349.862	3.287	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@H](c1ccccc1)N(CC)CC	ZINC000488544845	459545250	/nfs/dbraw/zinc/54/52/50/459545250.db2.gz	ATTSXDUEWQLNNH-LJQANCHMSA-N	0	3	325.456	3.487	20	30		EGEDHN
N#CCCN(C(=O)CN[C@H]1CCC[C@@H]2C[C@@H]21)c1cccc(Cl)c1	ZINC000583485560	459547708	/nfs/dbraw/zinc/54/77/08/459547708.db2.gz	LRFAFZYOXAMPFL-COXVUDFISA-N	0	3	331.847	3.365	20	30		EGEDHN
C[C@H]1C[C@H]1N1CCN(c2nc3cc(Cl)ccn3c2C#N)C[C@@H](C)C1	ZINC000488735815	459550410	/nfs/dbraw/zinc/55/04/10/459550410.db2.gz	PLMBUIKKJMCUEY-KCQAQPDRSA-N	0	3	343.862	3.026	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC[C@@H]2CCCCC(F)(F)C2)CC1	ZINC000488821307	459552374	/nfs/dbraw/zinc/55/23/74/459552374.db2.gz	VMGSRFSWSBORSF-CQSZACIVSA-N	0	3	329.435	3.152	20	30		EGEDHN
C[C@]1(NC(=O)c2cccc(CC#N)c2)CCN(Cc2ccccc2)C1	ZINC000570519221	459557442	/nfs/dbraw/zinc/55/74/42/459557442.db2.gz	QYTWZDBMOYMIDJ-NRFANRHFSA-N	0	3	333.435	3.147	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CC[C@H]2Cc2ccccc2)cc1	ZINC000526928269	459560374	/nfs/dbraw/zinc/56/03/74/459560374.db2.gz	UDTBYQAQTDLWSP-PMACEKPBSA-N	0	3	329.403	3.084	20	30		EGEDHN
C[C@]1(NC(=O)c2ccc(CC#N)cc2)CCN(Cc2ccccc2)C1	ZINC000571527610	459569213	/nfs/dbraw/zinc/56/92/13/459569213.db2.gz	LYCDMTYOYJUKRU-NRFANRHFSA-N	0	3	333.435	3.147	20	30		EGEDHN
N#C[C@H]1CC[C@@H](NCCNc2ncc(C(F)(F)F)cc2Cl)C1	ZINC000571743658	459572060	/nfs/dbraw/zinc/57/20/60/459572060.db2.gz	BOBUOVBECLIFAG-GXSJLCMTSA-N	0	3	332.757	3.448	20	30		EGEDHN
C=CCn1c(CC2CCCCC2)nnc1N1CCCN(CC)CC1	ZINC000572206832	459577195	/nfs/dbraw/zinc/57/71/95/459577195.db2.gz	GUAGIUMOLBHRID-UHFFFAOYSA-N	0	3	331.508	3.119	20	30		EGEDHN
CN(C)Cc1cccc(CNC(=O)c2ccc(Cl)c(C#N)c2)c1	ZINC000542706162	459584507	/nfs/dbraw/zinc/58/45/07/459584507.db2.gz	QYFUPGJHHRBORT-UHFFFAOYSA-N	0	3	327.815	3.203	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1c[nH]nc1-c1ccoc1)C(C)C	ZINC000562592048	459595717	/nfs/dbraw/zinc/59/57/17/459595717.db2.gz	IJONTVRGWWWWAC-QGZVFWFLSA-N	0	3	342.443	3.098	20	30		EGEDHN
CC(C)(C)N1CCCN(C(=O)C[C@@H](CC#N)c2ccccc2)CC1	ZINC000527241129	459615288	/nfs/dbraw/zinc/61/52/88/459615288.db2.gz	KHYDFUSNKVAPHK-GOSISDBHSA-N	0	3	327.472	3.407	20	30		EGEDHN
N#Cc1cc(C(=O)N2CCCN(CC3CCC3)CC2)ccc1Cl	ZINC000562708751	459627803	/nfs/dbraw/zinc/62/78/03/459627803.db2.gz	VEDRBBYJWZRCFT-UHFFFAOYSA-N	0	3	331.847	3.160	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)/C=C\c1ccsc1	ZINC000491577788	459638838	/nfs/dbraw/zinc/63/88/38/459638838.db2.gz	ZZMWAONDXRLKOK-SREVYHEPSA-N	0	3	339.464	3.223	20	30		EGEDHN
CN(CCc1ccccc1)[C@H]1CCN(C(=O)Nc2ccc(C#N)cc2)C1	ZINC000596470762	459648420	/nfs/dbraw/zinc/64/84/20/459648420.db2.gz	HCCSLTBJWCDXIZ-FQEVSTJZSA-N	0	3	348.450	3.339	20	30		EGEDHN
CC(C)N(C(=O)CC(C)(C)C#N)[C@H]1CCN(Cc2ccccc2)C1	ZINC000592693942	459668881	/nfs/dbraw/zinc/66/88/81/459668881.db2.gz	CSFJQGXNZAECQZ-SFHVURJKSA-N	0	3	327.472	3.438	20	30		EGEDHN
CN(Cc1ccccc1)C1(CNC(=O)N[C@@H]2CC[C@H](C#N)C2)CCC1	ZINC000563023796	459698708	/nfs/dbraw/zinc/69/87/08/459698708.db2.gz	PLRGKVHJOMWBGL-ZWKOTPCHSA-N	0	3	340.471	3.033	20	30		EGEDHN
COc1ccc(CN[C@@H]2C[C@]2(C)OC(C)C)cc1OCCCC#N	ZINC000527797216	459739711	/nfs/dbraw/zinc/73/97/11/459739711.db2.gz	AJUZNTXWJCOXNP-MOPGFXCFSA-N	0	3	332.444	3.423	20	30		EGEDHN
N#CCc1ccc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)cc1	ZINC000593014666	459740179	/nfs/dbraw/zinc/74/01/79/459740179.db2.gz	CGCAPMNYRLOFIK-ZIAGYGMSSA-N	0	3	326.318	3.439	20	30		EGEDHN
Cc1ccc(NC(=O)N2CCC[C@@H](CC#N)C2)c(OCCN(C)C)c1	ZINC000596748141	459751182	/nfs/dbraw/zinc/75/11/82/459751182.db2.gz	CKXZBQBEVJYHND-INIZCTEOSA-N	0	3	344.459	3.093	20	30		EGEDHN
C[C@@H](CN1CCC(C)CC1)NC(=O)Nc1ccc(C#N)cc1Cl	ZINC000596802213	459766298	/nfs/dbraw/zinc/76/62/98/459766298.db2.gz	RMUFPVFEKHXQHQ-ZDUSSCGKSA-N	0	3	334.851	3.454	20	30		EGEDHN
N#Cc1cc(C(=O)N2CCCN(C3CCCC3)CC2)ccc1Cl	ZINC000544617499	459772815	/nfs/dbraw/zinc/77/28/15/459772815.db2.gz	ZBRYIDITGMRHTL-UHFFFAOYSA-N	0	3	331.847	3.302	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CCC[C@@H]1[C@@H]1CCCOC1	ZINC000565021261	459780378	/nfs/dbraw/zinc/78/03/78/459780378.db2.gz	SAAXGUYJDPSZKR-IPMKNSEASA-N	0	3	326.440	3.177	20	30		EGEDHN
Cc1csc(C(C#N)=C([O-])c2ccc(O[C@@H]3CCOC3)cc2)n1	ZINC000584697934	459784135	/nfs/dbraw/zinc/78/41/35/459784135.db2.gz	HKPVDJIMGQBZFT-CABCVRRESA-N	0	3	328.393	3.109	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)c2ccc(O[C@@H]3CCOC3)cc2)n1	ZINC000584697934	459784138	/nfs/dbraw/zinc/78/41/38/459784138.db2.gz	HKPVDJIMGQBZFT-CABCVRRESA-N	0	3	328.393	3.109	20	30		EGEDHN
N#Cc1ccc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)cc1F	ZINC000593158152	459791473	/nfs/dbraw/zinc/79/14/73/459791473.db2.gz	SJLOWSYIDHSDOX-NEPJUHHUSA-N	0	3	330.281	3.383	20	30		EGEDHN
Cc1oc(C)c(C(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)c1C	ZINC000585697139	459835031	/nfs/dbraw/zinc/83/50/31/459835031.db2.gz	OEVHIAJZQUPDCZ-UHFFFAOYSA-N	0	3	339.439	3.281	20	30		EGEDHN
COCc1ccc(NC(=O)[C@H](C(C)C)N2CCCCC2)cc1C#N	ZINC000529814834	459849426	/nfs/dbraw/zinc/84/94/26/459849426.db2.gz	AKRZVSJYIKOSGS-SFHVURJKSA-N	0	3	329.444	3.154	20	30		EGEDHN
CCC(C#N)C(=O)N[C@H](CC(=O)OC)c1ccc(C(C)(C)C)cc1	ZINC000593481996	459902977	/nfs/dbraw/zinc/90/29/77/459902977.db2.gz	UXDUVOWTTPRPRF-CZUORRHYSA-N	0	3	330.428	3.254	20	30		EGEDHN
N#CCc1ccc(OC[C@@H](O)CNCc2ccc(F)c(Cl)c2)cc1	ZINC000575052887	459916810	/nfs/dbraw/zinc/91/68/10/459916810.db2.gz	QOQLMWZSAIHPJM-HNNXBMFYSA-N	0	3	348.805	3.075	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NC[C@@H]1CCN1Cc1ccccc1	ZINC000598512015	459927645	/nfs/dbraw/zinc/92/76/45/459927645.db2.gz	VZKAONRASCWXGL-RTWAWAEBSA-N	0	3	347.462	3.150	20	30		EGEDHN
C[C@@H](N[C@@H]1CCc2cc(C#N)ccc21)c1cccc(-n2ccnn2)c1	ZINC000588230262	459934916	/nfs/dbraw/zinc/93/49/16/459934916.db2.gz	QFBIZUKFKNSYQY-JLTOFOAXSA-N	0	3	329.407	3.477	20	30		EGEDHN
CN(C)C[C@@H]1CN(C(=O)CC2(C#N)CCCCC2)c2ccccc2O1	ZINC000597384077	459935370	/nfs/dbraw/zinc/93/53/70/459935370.db2.gz	BJOTVAOWSHMFTH-MRXNPFEDSA-N	0	3	341.455	3.206	20	30		EGEDHN
CC(C)[C@@H]1CN(C(=O)c2cccc(Oc3ccc(C#N)cc3)c2)CCN1	ZINC000598571137	459943194	/nfs/dbraw/zinc/94/31/94/459943194.db2.gz	GTEMPOIHFMPHKJ-FQEVSTJZSA-N	0	3	349.434	3.421	20	30		EGEDHN
CNc1ccc(C#N)cc1NC(=O)C(C[C@@H]1CCCO1)C(F)(F)F	ZINC000593678969	459947915	/nfs/dbraw/zinc/94/79/15/459947915.db2.gz	SUSSBTHUJUUTKJ-NWDGAFQWSA-N	0	3	341.333	3.286	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN1CCCN(Cc2ccc(Cl)cc2)CC1	ZINC000598585985	459953420	/nfs/dbraw/zinc/95/34/20/459953420.db2.gz	CIIKFVXUSJPTOA-SFHVURJKSA-N	0	3	349.906	3.148	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN1CCC[C@H](c2nc3ccccc3o2)C1	ZINC000598594924	459957787	/nfs/dbraw/zinc/95/77/87/459957787.db2.gz	ODOHDYPUCIKODW-LSDHHAIUSA-N	0	3	327.428	3.308	20	30		EGEDHN
C[C@H](CC1(C#N)CCOCC1)Nc1cccc(OCCN(C)C)c1	ZINC000602493649	459967881	/nfs/dbraw/zinc/96/78/81/459967881.db2.gz	YQTUOVDHWPRGDW-MRXNPFEDSA-N	0	3	331.460	3.138	20	30		EGEDHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)CC1(C#N)CCCCC1	ZINC000597480880	459969398	/nfs/dbraw/zinc/96/93/98/459969398.db2.gz	OHDYHHFRKFAUNV-QGZVFWFLSA-N	0	3	327.472	3.487	20	30		EGEDHN
COC(=O)c1cc(CN[C@H]2CCc3cc(C#N)ccc32)n2c1CCCC2	ZINC000598636992	459971544	/nfs/dbraw/zinc/97/15/44/459971544.db2.gz	JVNDHRMXHJZQHM-IBGZPJMESA-N	0	3	349.434	3.260	20	30		EGEDHN
C[C@H](CCC#N)CNCc1nnc2c(Cl)cc(C(F)(F)F)cn12	ZINC000602509939	459973917	/nfs/dbraw/zinc/97/39/17/459973917.db2.gz	IEECGZHZQVLOLU-SECBINFHSA-N	0	3	345.756	3.431	20	30		EGEDHN
CCOc1ccc(CN[C@@H](C)CC2(C#N)CCOCC2)cc1OC	ZINC000602508292	459974691	/nfs/dbraw/zinc/97/46/91/459974691.db2.gz	AXEFAMGUBVGFAM-HNNXBMFYSA-N	0	3	332.444	3.282	20	30		EGEDHN
C[C@@H](CC1(C#N)CCOCC1)NCc1ccc(N2CCCCC2)nc1	ZINC000602513765	459977405	/nfs/dbraw/zinc/97/74/05/459977405.db2.gz	IMHHHVPXKMEBBE-KRWDZBQOSA-N	0	3	342.487	3.260	20	30		EGEDHN
COc1ccc2c(c1)OCC[C@H]2N[C@@H](C)CC1(C#N)CCOCC1	ZINC000602557940	459995876	/nfs/dbraw/zinc/99/58/76/459995876.db2.gz	MOBBQHJBZRWDNL-WMLDXEAASA-N	0	3	330.428	3.207	20	30		EGEDHN
COc1ccc2c(c1)OCC[C@@H]2N[C@@H](C)CC1(C#N)CCOCC1	ZINC000602557942	459996100	/nfs/dbraw/zinc/99/61/00/459996100.db2.gz	MOBBQHJBZRWDNL-YOEHRIQHSA-N	0	3	330.428	3.207	20	30		EGEDHN
CC[C@@H](C)C(=O)Nc1cccc(CNC[C@@H](O)CC(C)(C)C#N)c1	ZINC000598700406	459998103	/nfs/dbraw/zinc/99/81/03/459998103.db2.gz	NEGXWFPAHAZYQR-PBHICJAKSA-N	0	3	331.460	3.062	20	30		EGEDHN
C[C@@H](CC1(C#N)CCOCC1)NCc1cccc2c1OCCCO2	ZINC000602578660	460006398	/nfs/dbraw/zinc/00/63/98/460006398.db2.gz	ZKSZXVWZEWSWHX-HNNXBMFYSA-N	0	3	330.428	3.036	20	30		EGEDHN
CC(C)CC(=O)Nc1cccc(CNC[C@H](O)CC(C)(C)C#N)c1	ZINC000598720701	460006511	/nfs/dbraw/zinc/00/65/11/460006511.db2.gz	PRNUWPFZTNKHQN-QGZVFWFLSA-N	0	3	331.460	3.062	20	30		EGEDHN
N#Cc1ccc(CN[C@@H](Cc2ccccc2)[C@H](O)C(F)(F)F)cc1	ZINC000609707684	460009805	/nfs/dbraw/zinc/00/98/05/460009805.db2.gz	RXMXNHWOWWDVBC-IRXDYDNUSA-N	0	3	334.341	3.182	20	30		EGEDHN
Cc1ccc(CN[C@@H](C)CC2(C#N)CCOCC2)c(N2CCCC2)n1	ZINC000602596699	460016016	/nfs/dbraw/zinc/01/60/16/460016016.db2.gz	MZDMNPIRMZFFRD-KRWDZBQOSA-N	0	3	342.487	3.179	20	30		EGEDHN
Cc1cc(CNCc2cccc(OCc3ccccc3C#N)c2)n[nH]1	ZINC000610010156	460050307	/nfs/dbraw/zinc/05/03/07/460050307.db2.gz	ZDVQSLQXIWYLOT-UHFFFAOYSA-N	0	3	332.407	3.459	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)cn1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000594015093	460057245	/nfs/dbraw/zinc/05/72/45/460057245.db2.gz	FAFAZRLYCFIGOW-OAQYLSRUSA-N	0	3	334.467	3.438	20	30		EGEDHN
C[C@@H]1c2ccccc2OCCN1C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000598894082	460087744	/nfs/dbraw/zinc/08/77/44/460087744.db2.gz	QMKYNLAHBCCPGX-CRAIPNDOSA-N	0	3	345.402	3.223	20	30		EGEDHN
Cc1ncc([C@H](C)NC2(c3ccc(C#N)cc3)CCOCC2)c(C)n1	ZINC000602726169	460088089	/nfs/dbraw/zinc/08/80/89/460088089.db2.gz	VPRPDIOPZNAUET-HNNXBMFYSA-N	0	3	336.439	3.322	20	30		EGEDHN
C[C@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)C1)c1cccc(C#N)c1	ZINC000610357252	460133865	/nfs/dbraw/zinc/13/38/65/460133865.db2.gz	JNYAYSPJPRGQDE-JXFKEZNVSA-N	0	3	348.450	3.193	20	30		EGEDHN
Cc1ccc([C@@H]2CCC[C@@H]2N(C)CC(=O)N[C@](C)(C#N)C2CC2)cc1	ZINC000610370273	460138452	/nfs/dbraw/zinc/13/84/52/460138452.db2.gz	CQTFVQJFBRCBRW-IRFCIJBXSA-N	0	3	339.483	3.371	20	30		EGEDHN
CC(C)(C(=O)N[C@@H]1CCCN2CCCC[C@@H]12)c1cc(F)cc(C#N)c1	ZINC000594196798	460143910	/nfs/dbraw/zinc/14/39/10/460143910.db2.gz	MUPFVQHQLOBGCM-MSOLQXFVSA-N	0	3	343.446	3.108	20	30		EGEDHN
C[C@@H](NCC[C@@H](O)COCc1ccccc1)c1ccc(C#N)c(F)c1	ZINC000599088613	460158074	/nfs/dbraw/zinc/15/80/74/460158074.db2.gz	IZPSTTSKASZFBZ-DNVCBOLYSA-N	0	3	342.414	3.316	20	30		EGEDHN
CC(C)(C)N1C[C@@H](C(=O)N[C@H]2CCCC[C@@H]2C#N)[C@H](C(F)(F)F)C1	ZINC000598094132	460171294	/nfs/dbraw/zinc/17/12/94/460171294.db2.gz	COZVDPRRHAMLAA-SYQHCUMBSA-N	0	3	345.409	3.094	20	30		EGEDHN
CN(C)Cc1cccc(CNC(=O)N[C@@H]2CCc3cc(C#N)ccc32)c1	ZINC000618798582	460180498	/nfs/dbraw/zinc/18/04/98/460180498.db2.gz	UEIJWXITBAFPDM-HXUWFJFHSA-N	0	3	348.450	3.107	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N[C@H]1COc2cc(F)ccc2C1	ZINC000598222349	460211482	/nfs/dbraw/zinc/21/14/82/460211482.db2.gz	XDWFUHFLQZFVRH-SJLPKXTDSA-N	0	3	338.382	3.018	20	30		EGEDHN
N#CCCCC[C@H](N)C(=O)N[C@@H]1CCSc2ccc(Cl)cc21	ZINC000594430099	460216770	/nfs/dbraw/zinc/21/67/70/460216770.db2.gz	VRBHOIYKOFTIHD-UONOGXRCSA-N	0	3	337.876	3.404	20	30		EGEDHN
N#CCCCC[C@H](N)C(=O)N[C@@H]1CCCC[C@@H]1Cc1ccccc1	ZINC000594436417	460220276	/nfs/dbraw/zinc/22/02/76/460220276.db2.gz	IZMXBWFBMXGWIX-CEXWTWQISA-N	0	3	327.472	3.315	20	30		EGEDHN
N#CCCCC[C@H](N)C(=O)Nc1ccc2c(c1)ncn2-c1ccccc1	ZINC000594445819	460223152	/nfs/dbraw/zinc/22/31/52/460223152.db2.gz	KJTGIRXLNHALSM-KRWDZBQOSA-N	0	3	347.422	3.375	20	30		EGEDHN
CC(C)(NC(=O)[C@H](N)CCCCC#N)c1cccc(Cl)c1F	ZINC000594446994	460223561	/nfs/dbraw/zinc/22/35/61/460223561.db2.gz	CWCDERDAFDQHCX-CYBMUJFWSA-N	0	3	325.815	3.242	20	30		EGEDHN
COc1ccc(CN(C)CCCOc2cccc(C#N)c2)cc1OC	ZINC000610786143	460236694	/nfs/dbraw/zinc/23/66/94/460236694.db2.gz	ZILOCNQFPKAGJV-UHFFFAOYSA-N	0	3	340.423	3.476	20	30		EGEDHN
C[C@H](NC1CCN(CC#N)CC1)c1ccccc1OC(F)(F)F	ZINC000610812959	460241163	/nfs/dbraw/zinc/24/11/63/460241163.db2.gz	QQASKMIFHBZCJV-LBPRGKRZSA-N	0	3	327.350	3.224	20	30		EGEDHN
N#Cc1ccc(CCN[C@H](Cc2ccccc2)[C@H](O)C(F)(F)F)cc1	ZINC000603146899	460253887	/nfs/dbraw/zinc/25/38/87/460253887.db2.gz	VQDBCNQIIFSIAN-MSOLQXFVSA-N	0	3	348.368	3.225	20	30		EGEDHN
COc1ccc(C#N)cc1CN1C[C@@H]2CN(c3ccccc3)C[C@H]2C1	ZINC000610952843	460265526	/nfs/dbraw/zinc/26/55/26/460265526.db2.gz	KZZMORBJARDYAU-RTBURBONSA-N	0	3	333.435	3.135	20	30		EGEDHN
C[C@H]1CN(CCOc2ccc(C#N)cc2)CC[C@H]1C(=O)OC(C)(C)C	ZINC000599597328	460284855	/nfs/dbraw/zinc/28/48/55/460284855.db2.gz	SJKHIOIZHGQUHW-MAUKXSAKSA-N	0	3	344.455	3.237	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN[C@@H](CCO)c1cc(Cl)cc(Cl)c1	ZINC000599676278	460306445	/nfs/dbraw/zinc/30/64/45/460306445.db2.gz	DFGZKKXDSIGQNH-CABCVRRESA-N	0	3	345.270	3.307	20	30		EGEDHN
CN1CCCC(C)(C)[C@@H]1CNC(=O)c1cc2ccccc2n1CC#N	ZINC000619232730	460306793	/nfs/dbraw/zinc/30/67/93/460306793.db2.gz	VPJDBUOCTVZADZ-SFHVURJKSA-N	0	3	338.455	3.015	20	30		EGEDHN
N#Cc1ccc(CN2CCN(C[C@@H]3CCOc4ccccc43)CC2)cc1	ZINC000611252809	460317323	/nfs/dbraw/zinc/31/73/23/460317323.db2.gz	PVJPDHHQQNAIEQ-FQEVSTJZSA-N	0	3	347.462	3.242	20	30		EGEDHN
N#CCC[C@H](NC[C@H](O)COc1ccc(F)cc1)c1ccccc1	ZINC000611406929	460357148	/nfs/dbraw/zinc/35/71/48/460357148.db2.gz	CLKHUFPQMWKFRK-HKUYNNGSSA-N	0	3	328.387	3.200	20	30		EGEDHN
C[C@H](N[C@H]1CCN(C(=O)C2CCCC2)C1)c1ccc(C#N)c(F)c1	ZINC000611466029	460370466	/nfs/dbraw/zinc/37/04/66/460370466.db2.gz	OHUCDOKMFAWAHH-GUYCJALGSA-N	0	3	329.419	3.139	20	30		EGEDHN
N#Cc1ccc(OC2CCC(NCc3cnc(C4CC4)o3)CC2)nc1	ZINC000600142464	460403850	/nfs/dbraw/zinc/40/38/50/460403850.db2.gz	NWEAIOKWVPQREF-UHFFFAOYSA-N	0	3	338.411	3.298	20	30		EGEDHN
C=CCOc1c(Cl)cc(CNC[C@](C)(O)C2CC2)cc1OC	ZINC000623415346	460535737	/nfs/dbraw/zinc/53/57/37/460535737.db2.gz	IVOREFQXPGRGIP-KRWDZBQOSA-N	0	3	325.836	3.164	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N2CCC[C@@](C)(C#N)C2)C1	ZINC000612114443	460544731	/nfs/dbraw/zinc/54/47/31/460544731.db2.gz	GKRVLUAATNYQQD-KPFFTGBYSA-N	0	3	340.471	3.157	20	30		EGEDHN
CN1CCC[C@H](CNc2cc(C#N)nc(C3CC3)n2)[C@H]1c1ccccc1	ZINC000601163380	460737286	/nfs/dbraw/zinc/73/72/86/460737286.db2.gz	HGCNUMMAFGQGEA-YLJYHZDGSA-N	0	3	347.466	3.143	20	30		EGEDHN
N#CC(C(=O)c1cccc2c1OCCO2)c1ccc2ccccc2n1	ZINC000620847302	460807410	/nfs/dbraw/zinc/80/74/10/460807410.db2.gz	NSKISJFMTWMILF-OAHLLOKOSA-N	0	3	330.343	3.496	20	30		EGEDHN
CN(C)CCOc1ccc(NC(=O)c2ccccc2CC#N)cc1F	ZINC000601633514	460852789	/nfs/dbraw/zinc/85/27/89/460852789.db2.gz	OORBSGVXHABKTG-UHFFFAOYSA-N	0	3	341.386	3.084	20	30		EGEDHN
C=CCN(C(=O)c1cccc(CN2CCCCC2)c1)[C@@H](C)COC	ZINC000617584528	460919234	/nfs/dbraw/zinc/91/92/34/460919234.db2.gz	FGFSMVLXIOPHET-KRWDZBQOSA-N	0	3	330.472	3.336	20	30		EGEDHN
CCC1(CC)CN(C[C@H](O)COc2ccc(CC#N)cc2)CCS1	ZINC000613388497	460932046	/nfs/dbraw/zinc/93/20/46/460932046.db2.gz	AQZJWLPTJNLTOE-KRWDZBQOSA-N	0	3	348.512	3.100	20	30		EGEDHN
C=CC[C@H]1CCCN(C(=O)[C@@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000617785278	460976683	/nfs/dbraw/zinc/97/66/83/460976683.db2.gz	IGCSLAQHZYMWGX-PKOBYXMFSA-N	0	3	327.472	3.108	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN(C)C[C@H]2CCOC2)cc1OC	ZINC000628187023	461039694	/nfs/dbraw/zinc/03/96/94/461039694.db2.gz	CBJWVNMIJOPNCP-CYBMUJFWSA-N	0	3	325.836	3.382	20	30		EGEDHN
C=CC[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(OCc2ccccc2)cc1	ZINC000662465361	461255086	/nfs/dbraw/zinc/25/50/86/461255086.db2.gz	PEYJTMHSGXZRIK-UZLBHIALSA-N	0	3	338.451	3.216	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@@H]2CCC[C@H]2Cc2ccccc2)CC1	ZINC000668369114	461257649	/nfs/dbraw/zinc/25/76/49/461257649.db2.gz	OQMGKMDLMCHBPJ-AZUAARDMSA-N	0	3	326.484	3.412	20	30		EGEDHN
CC#CC[C@H](CO)NCc1cc(Cl)c(OCCC)c(OC)c1	ZINC000641769724	461361168	/nfs/dbraw/zinc/36/11/68/461361168.db2.gz	YVCOTPZQJXHGKC-CQSZACIVSA-N	0	3	325.836	3.001	20	30		EGEDHN
CC#CC[C@@H](CO)NCc1ccc(Br)cc1SC	ZINC000641767072	461362081	/nfs/dbraw/zinc/36/20/81/461362081.db2.gz	GLTXOZJDLCLOIG-ZDUSSCGKSA-N	0	3	328.275	3.035	20	30		EGEDHN
CC#CC[C@H](CO)NCC1=Cc2cc(Cl)cc(Cl)c2OC1	ZINC000641769653	461362228	/nfs/dbraw/zinc/36/22/28/461362228.db2.gz	XKSWGHNVOPWRLT-CQSZACIVSA-N	0	3	326.223	3.133	20	30		EGEDHN
N#CC(C(=O)c1ccc(Cn2cncn2)cc1)c1nc(C2CC2)cs1	ZINC000647373334	461663642	/nfs/dbraw/zinc/66/36/42/461663642.db2.gz	GIGXYWPKSFELEK-HNNXBMFYSA-N	0	3	349.419	3.150	20	30		EGEDHN
C=C(C)CN1CCC(Nc2ccnc(-c3ccc(OC)cc3)n2)CC1	ZINC000663568521	461707211	/nfs/dbraw/zinc/70/72/11/461707211.db2.gz	WOTSCAGVCZLBTP-UHFFFAOYSA-N	0	3	338.455	3.027	20	30		EGEDHN
C=CC[C@H]1CCCN(CC(=O)NCCc2nc3ccccc3s2)C1	ZINC000661380834	462225350	/nfs/dbraw/zinc/22/53/50/462225350.db2.gz	QLBOCSZAONAISX-HNNXBMFYSA-N	0	3	343.496	3.243	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)Nc2cccc3c2CCNC3)cc1	ZINC000667749982	462244978	/nfs/dbraw/zinc/24/49/78/462244978.db2.gz	MLFSOGYYYPYSHB-UHFFFAOYSA-N	0	3	337.423	3.219	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC2(c3ccccc3Cl)CC2)CC1	ZINC000645266322	462261234	/nfs/dbraw/zinc/26/12/34/462261234.db2.gz	PZYBZJRLRRPEIP-UHFFFAOYSA-N	0	3	333.863	3.279	20	30		EGEDHN
C=CCN(CCc1ccccc1)C(=O)N[C@H]1CCN(C(C)(C)C)C1	ZINC000661505782	462278481	/nfs/dbraw/zinc/27/84/81/462278481.db2.gz	CZZXRFAXRWPCMM-SFHVURJKSA-N	0	3	329.488	3.300	20	30		EGEDHN
C=CCn1cc(CN[C@@H](CC)Cc2ccc(Br)cc2)nn1	ZINC000658038733	462354215	/nfs/dbraw/zinc/35/42/15/462354215.db2.gz	QNXISFYQBIOIEP-HNNXBMFYSA-N	0	3	349.276	3.338	20	30		EGEDHN
C=CCN1CCC(NC(=O)CCCOc2ccccc2Cl)CC1	ZINC000171716996	526419996	/nfs/dbraw/zinc/41/99/96/526419996.db2.gz	QXEZNSYKHDEFSM-UHFFFAOYSA-N	0	3	336.863	3.266	20	30		EGEDHN
C=CCN1CCC(NC(=O)Cc2coc3cc4c(cc23)CCC4)CC1	ZINC000171726686	526423730	/nfs/dbraw/zinc/42/37/30/526423730.db2.gz	BEUNWSHLACAYDT-UHFFFAOYSA-N	0	3	338.451	3.231	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCCCO[C@@H](C)c2ccccc2)CC1	ZINC000171704379	526432343	/nfs/dbraw/zinc/43/23/43/526432343.db2.gz	DVXMPFPCDRXIRO-KRWDZBQOSA-N	0	3	345.487	3.104	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(COC(C)C)cc2)CC1	ZINC000171741071	526441081	/nfs/dbraw/zinc/44/10/81/526441081.db2.gz	GSEKVBCKKYKHAV-UHFFFAOYSA-N	0	3	331.460	3.384	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cnc(-c3ccccc3F)s2)CC1	ZINC000171714929	526449426	/nfs/dbraw/zinc/44/94/26/526449426.db2.gz	AUTKVBDDUHCFEK-UHFFFAOYSA-N	0	3	345.443	3.329	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC(CN2C[C@@H](C)O[C@@H](C)C2)CC1	ZINC000130007755	527022598	/nfs/dbraw/zinc/02/25/98/527022598.db2.gz	GUWNKYYGZQAONA-CALCHBBNSA-N	0	3	334.504	3.103	20	30		EGEDHN
CCOC(=O)[C@](C)(CNCc1ccc(C#N)s1)c1ccccc1	ZINC000191632691	528097376	/nfs/dbraw/zinc/09/73/76/528097376.db2.gz	KSXMGPRJRKRIJP-GOSISDBHSA-N	0	3	328.437	3.230	20	30		EGEDHN
CCN(C(=O)Cc1ccc(C#N)cc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000186297067	535670078	/nfs/dbraw/zinc/67/00/78/535670078.db2.gz	RLDDJASNVASTDT-NRFANRHFSA-N	0	3	347.462	3.224	20	30		EGEDHN
CC(C)N1CCN(c2cccc(NC(=O)C3(C#N)CCCC3)c2)CC1	ZINC000118965784	546701304	/nfs/dbraw/zinc/70/13/04/546701304.db2.gz	UIDISIUCWRXFJT-UHFFFAOYSA-N	0	3	340.471	3.239	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CCCN(Cc2ccccc2C)CC1)OCC	ZINC000677299301	549244463	/nfs/dbraw/zinc/24/44/63/549244463.db2.gz	FVIVTYLOBUXBQP-HXUWFJFHSA-N	0	3	344.499	3.401	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N1CCC2(CCOC2)CC1	ZINC000677719148	549317061	/nfs/dbraw/zinc/31/70/61/549317061.db2.gz	BSHBISGLSZIDNO-INIZCTEOSA-N	0	3	348.512	3.154	20	30		EGEDHN
C=CCN(CCc1ccccc1)Cc1cccc(NS(C)(=O)=O)c1	ZINC000678215438	549427349	/nfs/dbraw/zinc/42/73/49/549427349.db2.gz	YSSYBIGXNDDBED-UHFFFAOYSA-N	0	3	344.480	3.289	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cc(C)nc3ccccc32)CC1	ZINC000678222302	549429597	/nfs/dbraw/zinc/42/95/97/549429597.db2.gz	MCSXZIDGJQLVDR-UHFFFAOYSA-N	0	3	338.455	3.127	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)[C@@H]1Cc2ccc(F)cc21)C(C)C	ZINC000684441366	550330802	/nfs/dbraw/zinc/33/08/02/550330802.db2.gz	DWLRZWVXBSQIAP-MOPGFXCFSA-N	0	3	330.447	3.280	20	30		EGEDHN
C=CCn1c(-c2ccccc2C)nnc1N1C[C@H](C)N(CC)C[C@@H]1C	ZINC000685543378	550427521	/nfs/dbraw/zinc/42/75/21/550427521.db2.gz	FRZQAORDVABOJK-IRXDYDNUSA-N	0	3	339.487	3.358	20	30		EGEDHN
N#CC(C(=O)CCNC(=O)C1CCCCC1)c1ccc2ccccc2n1	ZINC000726318558	574548591	/nfs/dbraw/zinc/54/85/91/574548591.db2.gz	NAUMMOGGMDIELJ-KRWDZBQOSA-N	0	3	349.434	3.498	20	30		EGEDHN
COc1cccc(-c2n[nH]cc2CNCc2ccc(OCC#N)cc2)c1	ZINC000729685304	574878928	/nfs/dbraw/zinc/87/89/28/574878928.db2.gz	GJCALWARDDRTEE-UHFFFAOYSA-N	0	3	348.406	3.277	20	30		EGEDHN
Cc1noc(C)c1CC(=O)C(C#N)c1nc2cc(F)ccc2s1	ZINC000730417155	574984695	/nfs/dbraw/zinc/98/46/95/574984695.db2.gz	LLTKBGCTSQKGJR-GFCCVEGCSA-N	0	3	329.356	3.459	20	30		EGEDHN
CC(C)(C)CC(=O)NCC(=O)C(C#N)c1nc2cc(F)ccc2s1	ZINC000730420367	574985935	/nfs/dbraw/zinc/98/59/35/574985935.db2.gz	COEASDNLDPRKCP-LLVKDONJSA-N	0	3	347.415	3.164	20	30		EGEDHN
N#CCOc1ccc(CN2CCN(CC3CCCCC3)CC2)cc1	ZINC000731212190	575060630	/nfs/dbraw/zinc/06/06/30/575060630.db2.gz	YFXFDZFUEVDGOJ-UHFFFAOYSA-N	0	3	327.472	3.287	20	30		EGEDHN
CC(C)Oc1ccc(NC(=S)NN=C2CCN(C)[C@@H](C)C2)cc1	ZINC000741463373	575073032	/nfs/dbraw/zinc/07/30/32/575073032.db2.gz	FIYDERMBYRTHHR-ZDUSSCGKSA-N	0	3	334.489	3.230	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)C[N@H+](Cc1ccccc1[O-])C1CCCC1	ZINC000731848136	575212265	/nfs/dbraw/zinc/21/22/65/575212265.db2.gz	UEIIRMRARJAQFO-FQEVSTJZSA-N	0	3	343.471	3.191	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)C[N@@H+](Cc1ccccc1[O-])C1CCCC1	ZINC000731848136	575212267	/nfs/dbraw/zinc/21/22/67/575212267.db2.gz	UEIIRMRARJAQFO-FQEVSTJZSA-N	0	3	343.471	3.191	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)CO[C@H]2CCC[C@@H](C)C2)cc1	ZINC000733053652	575303799	/nfs/dbraw/zinc/30/37/99/575303799.db2.gz	QAVOMLDMLVKOCE-FHLIZLRMSA-N	0	3	342.439	3.492	20	30		EGEDHN
C[C@@H]1CCCC[C@@H]1OCC(=O)C(C#N)c1nc2ccccc2n1C	ZINC000733676621	575380777	/nfs/dbraw/zinc/38/07/77/575380777.db2.gz	CWIWIJCURPATNM-GLJUWKHASA-N	0	3	325.412	3.345	20	30		EGEDHN
C=CC[C@@H](NC(=O)NCCN1CCCC[C@@H]1CC)c1ccncc1	ZINC000734678859	575540968	/nfs/dbraw/zinc/54/09/68/575540968.db2.gz	JGYDGFWPFOVKIR-ZWKOTPCHSA-N	0	3	330.476	3.263	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)Cc3ccc4c(c3)OCCO4)nc21	ZINC000735788887	575713519	/nfs/dbraw/zinc/71/35/19/575713519.db2.gz	IDZWHCHHYURXKK-AWEZNQCLSA-N	0	3	347.374	3.062	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2ccnc(Oc3ccccc3)c2)CC1	ZINC000740735770	576621373	/nfs/dbraw/zinc/62/13/73/576621373.db2.gz	OQWMTVDJKMMVDB-UHFFFAOYSA-N	0	3	349.434	3.091	20	30		EGEDHN
C[C@@H](NCc1ccc(N(C)CCC#N)cc1)c1ccc2[nH]c(=O)[nH]c2c1	ZINC000740898056	576635113	/nfs/dbraw/zinc/63/51/13/576635113.db2.gz	MIRPODJLXASDKV-CQSZACIVSA-N	0	3	349.438	3.469	20	30		EGEDHN
C=C(Br)COC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000741330513	576677006	/nfs/dbraw/zinc/67/70/06/576677006.db2.gz	QKMMUAIOSISGIL-UHFFFAOYSA-N	0	3	338.245	3.350	20	30		EGEDHN
C[C@@H]1CCCN(Cc2cc(=O)n3c4ccccc4[nH]c3c2C#N)[C@H]1C	ZINC000741790094	576722130	/nfs/dbraw/zinc/72/21/30/576722130.db2.gz	BFNMHFNSWOOBDO-IJEWVQPXSA-N	0	3	334.423	3.344	20	30		EGEDHN
C[C@@H](C(=O)C(C#N)C(=O)NCc1ccccc1)c1cccc(Cl)c1	ZINC000744027270	576819112	/nfs/dbraw/zinc/81/91/12/576819112.db2.gz	OMOVOLDAGZQQJR-DYVFJYSZSA-N	0	3	340.810	3.469	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)[C@H](C)c2ccco2)cc1Cl	ZINC000744031935	576819326	/nfs/dbraw/zinc/81/93/26/576819326.db2.gz	DHCGLTSCXCETKV-PWSUYJOCSA-N	0	3	346.770	3.393	20	30		EGEDHN
CC(=CC(=O)C(C#N)C(=O)Nc1ccc2c(c1)OCCO2)C(C)(C)C	ZINC000744032640	576819329	/nfs/dbraw/zinc/81/93/29/576819329.db2.gz	UYGZZYFUPJFEGW-FWLQQBITSA-N	0	3	342.395	3.098	20	30		EGEDHN
C#CCCC[N@H+](Cc1ccc(-c2nnn[n-]2)cc1)Cc1cccc(F)c1	ZINC000823841944	608370005	/nfs/dbraw/zinc/37/00/05/608370005.db2.gz	WDHRGENLBPDYBL-UHFFFAOYSA-N	0	3	349.413	3.421	20	30		EGEDHN
C#CCCC[N@@H+](Cc1ccc(-c2nnn[n-]2)cc1)Cc1cccc(F)c1	ZINC000823841944	608370007	/nfs/dbraw/zinc/37/00/07/608370007.db2.gz	WDHRGENLBPDYBL-UHFFFAOYSA-N	0	3	349.413	3.421	20	30		EGEDHN
C#CCCC[N@H+](Cc1ccc(-c2nn[n-]n2)cc1)Cc1cccc(F)c1	ZINC000823841944	608370009	/nfs/dbraw/zinc/37/00/09/608370009.db2.gz	WDHRGENLBPDYBL-UHFFFAOYSA-N	0	3	349.413	3.421	20	30		EGEDHN
C#CCCC[N@@H+](Cc1ccc(-c2nn[n-]n2)cc1)Cc1cccc(F)c1	ZINC000823841944	608370011	/nfs/dbraw/zinc/37/00/11/608370011.db2.gz	WDHRGENLBPDYBL-UHFFFAOYSA-N	0	3	349.413	3.421	20	30		EGEDHN
C[C@@H]([NH2+][C@@H]1CCCc2cc(C#N)ccc21)c1cccc(-c2nnn[n-]2)c1	ZINC000824547592	608514099	/nfs/dbraw/zinc/51/40/99/608514099.db2.gz	QIUILYXNTDKJKN-BFUOFWGJSA-N	0	3	344.422	3.467	20	30		EGEDHN
C[C@@H]([NH2+][C@@H]1CCCc2cc(C#N)ccc21)c1cccc(-c2nn[n-]n2)c1	ZINC000824547592	608514101	/nfs/dbraw/zinc/51/41/01/608514101.db2.gz	QIUILYXNTDKJKN-BFUOFWGJSA-N	0	3	344.422	3.467	20	30		EGEDHN
C[C@H](NCC#Cc1ccc(F)cc1)c1ccc(N2CCNC2=O)cc1	ZINC000829745456	1292612958	/nfs/dbraw/zinc/61/29/58/1292612958.db2.gz	LZDIVMCEGFFJDS-HNNXBMFYSA-N	0	3	337.398	3.058	20	30		EGEDHN
CCN(CC)Cc1ccc(C(=O)Oc2ccc(C#N)cc2OC)o1	ZINC000832530142	1293020950	/nfs/dbraw/zinc/02/09/50/1293020950.db2.gz	AMFSIPWVJWAUJX-UHFFFAOYSA-N	0	3	328.368	3.221	20	30		EGEDHN
C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)C(C#N)C(=O)NC1CC1	ZINC000107409271	1293066797	/nfs/dbraw/zinc/06/67/97/1293066797.db2.gz	WBFLJTFCQXCPEH-TVQRCGJNSA-N	0	3	339.222	3.159	20	30		EGEDHN
C=CC1CCN(Cc2cc(=O)n3c4ccccc4[nH]c3c2C#N)CC1	ZINC000111258063	1293102210	/nfs/dbraw/zinc/10/22/10/1293102210.db2.gz	NUQTVVCYRPZHFD-INIZCTEOSA-N	0	3	332.407	3.122	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)CC[C@H]1CCCCO1	ZINC000111945174	1293113253	/nfs/dbraw/zinc/11/32/53/1293113253.db2.gz	YDJYBIPZDPKQII-CABCVRRESA-N	0	3	344.411	3.082	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1N[C@H](C)c1ccc(N2CCOCC2)cc1Cl	ZINC000834888807	1293164668	/nfs/dbraw/zinc/16/46/68/1293164668.db2.gz	QAHPUKUOJYFCQY-XWIAVFTESA-N	0	3	336.863	3.171	20	30		EGEDHN
COc1ccc(CNC(=O)C(C#N)C(=O)[C@@H](C)CC2CCCC2)cc1	ZINC000114618459	1293173623	/nfs/dbraw/zinc/17/36/23/1293173623.db2.gz	QQYKADAHLMXYGZ-KSSFIOAISA-N	0	3	342.439	3.237	20	30		EGEDHN
CCC[C@@H](OC)C(=O)C(C#N)C(=O)Nc1c(CC)cccc1CC	ZINC000835062934	1293196675	/nfs/dbraw/zinc/19/66/75/1293196675.db2.gz	GRNGWMURQJNVOS-JKSUJKDBSA-N	0	3	330.428	3.274	20	30		EGEDHN
N#CC(C(=O)CSC(F)F)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000835065354	1293197783	/nfs/dbraw/zinc/19/77/83/1293197783.db2.gz	LQAZWSPTQZRPNT-SSDOTTSWSA-N	0	3	336.722	3.082	20	30		EGEDHN
C[C@H](Oc1ccccn1)C(=O)C(C#N)c1cc(C(F)(F)F)ccn1	ZINC000835454238	1293294385	/nfs/dbraw/zinc/29/43/85/1293294385.db2.gz	GGWVOIRRVLXVAF-CMPLNLGQSA-N	0	3	335.285	3.139	20	30		EGEDHN
C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)C(C#N)C(=O)N1CCCC1	ZINC000124736415	1293484589	/nfs/dbraw/zinc/48/45/89/1293484589.db2.gz	BPHSFEGCUZQDCH-PBHICJAKSA-N	0	3	342.439	3.083	20	30		EGEDHN
N#CC(C(=O)Nc1ccccn1)C(=O)c1ccc(-c2ccccc2F)o1	ZINC000125090939	1293494648	/nfs/dbraw/zinc/49/46/48/1293494648.db2.gz	XPAFGFOZRVOZQU-ZDUSSCGKSA-N	0	3	349.321	3.442	20	30		EGEDHN
C[C@@H](SCc1ccccc1)C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000125220990	1293500028	/nfs/dbraw/zinc/50/00/28/1293500028.db2.gz	TUJBZDZRBZWMAZ-HIFRSBDPSA-N	0	3	339.420	3.051	20	30		EGEDHN
CNC(=O)C(C#N)C(=O)CSc1cccc2cccc(Cl)c21	ZINC000133381631	1293742940	/nfs/dbraw/zinc/74/29/40/1293742940.db2.gz	XYEMQKMADVLQPN-NSHDSACASA-N	0	3	332.812	3.040	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)CO[C@H](C)CC)cc1	ZINC000152323876	1293964179	/nfs/dbraw/zinc/96/41/79/1293964179.db2.gz	BGXZVNWSLGZDAS-RHSMWYFYSA-N	0	3	330.428	3.492	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)C(=O)Nc1ccccn1)c1ccc(F)cc1F	ZINC000152703864	1293982202	/nfs/dbraw/zinc/98/22/02/1293982202.db2.gz	FMKFWKIFMYHKQN-FZMZJTMJSA-N	0	3	343.333	3.201	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@@H](C)c1c(F)cccc1F	ZINC000153195565	1294002543	/nfs/dbraw/zinc/00/25/43/1294002543.db2.gz	CVGBHUNQOIWENK-STQMWFEESA-N	0	3	336.382	3.474	20	30		EGEDHN
CC[C@H](C)c1ccc(NC(=O)C(C#N)C(=O)[C@@H]2CCCOC2)cc1	ZINC000171037358	1294391527	/nfs/dbraw/zinc/39/15/27/1294391527.db2.gz	IZUBECNOLRJXNN-LXZKKBNFSA-N	0	3	328.412	3.274	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(Cl)cc1Cl)C(=O)[C@@H]1CCCOC1	ZINC000171036689	1294391628	/nfs/dbraw/zinc/39/16/28/1294391628.db2.gz	RQAKUCCKIHXMHH-MWLCHTKSSA-N	0	3	341.194	3.067	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)C[C@@H](C)c1ccccc1OC	ZINC000171401911	1294405903	/nfs/dbraw/zinc/40/59/03/1294405903.db2.gz	FGZYERNZARYHIB-GDBMZVCRSA-N	0	3	330.428	3.204	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(-n3c(C)ccc3C)cc2)CC1	ZINC000171727062	1294415928	/nfs/dbraw/zinc/41/59/28/1294415928.db2.gz	WJEYKEIWWMNJTG-UHFFFAOYSA-N	0	3	337.467	3.474	20	30		EGEDHN
COc1ccc(CN(C)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1C#N	ZINC000179225847	1294780633	/nfs/dbraw/zinc/78/06/33/1294780633.db2.gz	XKFHTBLLSLPVHZ-MRXNPFEDSA-N	0	3	345.443	3.008	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)COCc2ccccc2)cc1	ZINC000193448942	1295870505	/nfs/dbraw/zinc/87/05/05/1295870505.db2.gz	XIKRIRUBHZLUHH-GOSISDBHSA-N	0	3	336.391	3.113	20	30		EGEDHN
N#CC(C(=O)Nc1ccccn1)C(=O)[C@H]1C[C@]12CCCc1ccccc12	ZINC000246461987	1296354663	/nfs/dbraw/zinc/35/46/63/1296354663.db2.gz	ADWBJJKHNAJVAJ-XPIZARPCSA-N	0	3	345.402	3.023	20	30		EGEDHN
Cc1ccsc1[C@@H]1C[C@H]1C(=O)C(C#N)C(=O)NC1CCCCC1	ZINC000246574367	1296360868	/nfs/dbraw/zinc/36/08/68/1296360868.db2.gz	LPAHDRRIQSSJMW-KFWWJZLASA-N	0	3	330.453	3.318	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1)C(=O)/C=C\c1ccccc1C#N	ZINC000255505341	1296539334	/nfs/dbraw/zinc/53/93/34/1296539334.db2.gz	ZCLJSEGIDSOOOE-SEYXRHQNSA-N	0	3	333.435	3.162	20	30		EGEDHN
C[C@@H](NC1CCN(c2ccc(C#N)cn2)CC1)c1cc(O)ccc1F	ZINC000872032480	1296681452	/nfs/dbraw/zinc/68/14/52/1296681452.db2.gz	UXFGQWAKRSTILU-CYBMUJFWSA-N	0	3	340.402	3.118	20	30		EGEDHN
C[C@@H](CNC(=O)OC(C)(C)C)NC1CC(C#N)(c2ccccc2)C1	ZINC000302127133	1296799349	/nfs/dbraw/zinc/79/93/49/1296799349.db2.gz	XOQXOPQIFMTOGQ-ASFAAARLSA-N	0	3	329.444	3.113	20	30		EGEDHN
N#CC(C(=O)NCc1ccc(F)cc1F)C(=O)C1CCC=CCC1	ZINC000873522493	1297560217	/nfs/dbraw/zinc/56/02/17/1297560217.db2.gz	AFVPKWSOQLJXOU-OAHLLOKOSA-N	0	3	332.350	3.036	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]\[C@@H]2CCN(CC(F)(F)F)C2)c([O-])c1	ZINC000747032970	1298712562	/nfs/dbraw/zinc/71/25/62/1298712562.db2.gz	LEZKQEHEMUSDDZ-YYLUKMIBSA-N	0	3	343.393	3.294	20	30		EGEDHN
CN(Cc1ccc(N2CCC(O)CC2)cc1)Cc1cccc(C#N)c1	ZINC000876572835	1298839584	/nfs/dbraw/zinc/83/95/84/1298839584.db2.gz	QEPPPGLXQBGSIA-UHFFFAOYSA-N	0	3	335.451	3.151	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](O)c2ccccc2C(F)(F)F)s1	ZINC000749110314	1299143612	/nfs/dbraw/zinc/14/36/12/1299143612.db2.gz	DABWIIXUEHEMBL-CQSZACIVSA-N	0	3	326.343	3.462	20	30		EGEDHN
CC(=O)[C@](C#N)(CCN1CCCC2(CCOCC2)C1)c1ccccc1	ZINC000878132366	1299768159	/nfs/dbraw/zinc/76/81/59/1299768159.db2.gz	SSCWHFXWFFVNKY-OAQYLSRUSA-N	0	3	340.467	3.320	20	30		EGEDHN
CC(=O)[C@](C#N)(CCN1CC[C@H](c2cccnc2)C1)c1ccccc1	ZINC000878761178	1300178556	/nfs/dbraw/zinc/17/85/56/1300178556.db2.gz	UMOLNWNYXMNWHA-PZJWPPBQSA-N	0	3	333.435	3.312	20	30		EGEDHN
C=CC[C@@H](NC(=O)N(CCN(C)C)Cc1ccco1)c1ccncc1	ZINC000756037841	1300429274	/nfs/dbraw/zinc/42/92/74/1300429274.db2.gz	NFNAQRMMCZNIKJ-GOSISDBHSA-N	0	3	342.443	3.065	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)OC(C)(C)C)CN1Cc1ccc(CC#N)cc1	ZINC000879226487	1300438250	/nfs/dbraw/zinc/43/82/50/1300438250.db2.gz	PJIGCFPUYQNXST-WMLDXEAASA-N	0	3	329.444	3.240	20	30		EGEDHN
COc1ccc([C@@H]2CN(Cc3ccc(C#N)cc3Cl)CCN2)cc1	ZINC000879520560	1300577661	/nfs/dbraw/zinc/57/76/61/1300577661.db2.gz	BQWKMHNLNDVXMB-IBGZPJMESA-N	0	3	341.842	3.367	20	30		EGEDHN
COC(=O)[C@H](C)[C@H](NCc1ccc(OCC#N)cc1)c1ccccc1	ZINC000756893369	1300584329	/nfs/dbraw/zinc/58/43/29/1300584329.db2.gz	YDJAOXODYPGIFS-BEFAXECRSA-N	0	3	338.407	3.229	20	30		EGEDHN
C[C@@H]([NH2+][C@@H](C)C(=O)N(C)C1(C#N)CCC(C)CC1)c1ccccc1[O-]	ZINC000879648352	1300647757	/nfs/dbraw/zinc/64/77/57/1300647757.db2.gz	LBPGTLZUTIUHJC-SIRSKZSMSA-N	0	3	343.471	3.362	20	30		EGEDHN
C=CCc1cc(CNCc2cnccc2N(C)C)cc(OC)c1OC	ZINC000759157184	1301027903	/nfs/dbraw/zinc/02/79/03/1301027903.db2.gz	MNZVQTLLNIQOFY-UHFFFAOYSA-N	0	3	341.455	3.183	20	30		EGEDHN
C=CCN1CC[C@H](NC(C)(C)c2ccc(C(F)(F)F)cc2)C1=O	ZINC000880385833	1301098330	/nfs/dbraw/zinc/09/83/30/1301098330.db2.gz	WLBWDRODNTXBOL-AWEZNQCLSA-N	0	3	326.362	3.317	20	30		EGEDHN
N#CC(C(=O)c1cc[n+]([O-])cc1)c1nc2cc(Cl)ccc2s1	ZINC000763273963	1301862127	/nfs/dbraw/zinc/86/21/27/1301862127.db2.gz	DYSQJWGCEOECBD-NSHDSACASA-N	0	3	329.768	3.073	20	30		EGEDHN
C=C(C)COc1cc(CN[C@H]2CCCC23OCCO3)ccc1OC	ZINC000883179705	1302289398	/nfs/dbraw/zinc/28/93/98/1302289398.db2.gz	GPABZLLMPYSMGY-SFHVURJKSA-N	0	3	333.428	3.035	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)NC[C@@H]1CCCCN1C1CC1	ZINC000765663687	1302300174	/nfs/dbraw/zinc/30/01/74/1302300174.db2.gz	PUJURGYWPZNHDX-INIZCTEOSA-N	0	3	342.443	3.095	20	30		EGEDHN
C#CCC(C)(C)C(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1	ZINC000767102964	1302583178	/nfs/dbraw/zinc/58/31/78/1302583178.db2.gz	PIHKBCQKGBIEHE-UHFFFAOYSA-N	0	3	327.472	3.205	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)[C@@H](F)c1ccccc1	ZINC000769285452	1303085229	/nfs/dbraw/zinc/08/52/29/1303085229.db2.gz	ZUUBGFAUJWBWLS-CJNGLKHVSA-N	0	3	326.327	3.053	20	30		EGEDHN
C=CCSc1nc2ccccc2n1CN(C)CCc1cnccn1	ZINC000770669959	1303302907	/nfs/dbraw/zinc/30/29/07/1303302907.db2.gz	XARDCUJZVOZEOF-UHFFFAOYSA-N	0	3	339.468	3.236	20	30		EGEDHN
C=CC[C@H](CO)CNCc1c(C)nn(Cc2ccccc2)c1Cl	ZINC000774825518	1303863918	/nfs/dbraw/zinc/86/39/18/1303863918.db2.gz	DCNONKGJPUNKFL-INIZCTEOSA-N	0	3	333.863	3.167	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/CCc2ccc(CO)cc2)c([O-])c1	ZINC000775629381	1303997965	/nfs/dbraw/zinc/99/79/65/1303997965.db2.gz	FOKZLPUVKFPRJR-KGENOOAVSA-N	0	3	326.440	3.392	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Cc2ccccc2CC#N)C1	ZINC000776842253	1304209298	/nfs/dbraw/zinc/20/92/98/1304209298.db2.gz	UEOQVNHTUQKNNM-UTKZUKDTSA-N	0	3	347.462	3.247	20	30		EGEDHN
COC[C@H](C)NN=C(C)c1ccc(OC)c(CN2CCCCC2)c1	ZINC000777902062	1304363187	/nfs/dbraw/zinc/36/31/87/1304363187.db2.gz	NIAIDRZYXZMVPB-HNNXBMFYSA-N	0	3	333.476	3.030	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CNCCc1ccc(CO)cc1	ZINC000778177384	1304410918	/nfs/dbraw/zinc/41/09/18/1304410918.db2.gz	ARZHPXXHTNCDEZ-UHFFFAOYSA-N	0	3	329.827	3.177	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccc(C#N)cn1	ZINC000889226769	1304419054	/nfs/dbraw/zinc/41/90/54/1304419054.db2.gz	OGEBYPJDXBARTH-INIZCTEOSA-N	0	3	349.438	3.082	20	30		EGEDHN
CCN(CC)C(=O)[C@@H](Cc1ccccc1)NCc1cccc(C#N)c1	ZINC000779007488	1304517393	/nfs/dbraw/zinc/51/73/93/1304517393.db2.gz	FJOSRBBZRLXICT-HXUWFJFHSA-N	0	3	335.451	3.128	20	30		EGEDHN
C#CCSCC[NH2+][C@H](C)c1cc(Br)cc(C)c1[O-]	ZINC000779031561	1304520615	/nfs/dbraw/zinc/52/06/15/1304520615.db2.gz	JUJMCUYVJKFJFN-LLVKDONJSA-N	0	3	328.275	3.480	20	30		EGEDHN
C#CCOc1ccccc1CN1CCC[C@H](C(C)(C)C(=O)OC)C1	ZINC000779603727	1304587013	/nfs/dbraw/zinc/58/70/13/1304587013.db2.gz	AFGLNJSDQVFVII-KRWDZBQOSA-N	0	3	329.440	3.110	20	30		EGEDHN
C=CCCN(OCc1ccccc1)C(=O)N[C@@H]1CN(C2CC2)C[C@@H]1C	ZINC000782975558	1305032997	/nfs/dbraw/zinc/03/29/97/1305032997.db2.gz	CGSNFDVDYPBKNH-QFBILLFUSA-N	0	3	343.471	3.189	20	30		EGEDHN
CN1c2ccc(CN[C@H]3CCc4cc(C#N)ccc43)cc2CCC1=O	ZINC000785617800	1305394933	/nfs/dbraw/zinc/39/49/33/1305394933.db2.gz	UROGERQUUSJJEM-IBGZPJMESA-N	0	3	331.419	3.244	20	30		EGEDHN
C#CCCCCCC(=O)C(C#N)C(=O)NCc1cccc(Cl)c1	ZINC000786529329	1305590321	/nfs/dbraw/zinc/59/03/21/1305590321.db2.gz	URSRRIHYUKENCV-INIZCTEOSA-N	0	3	330.815	3.249	20	30		EGEDHN
C[C@@H](N[C@@H](C)c1ccc(N2CCNC2=O)cc1)c1cccc(C#N)c1	ZINC000786835879	1305640238	/nfs/dbraw/zinc/64/02/38/1305640238.db2.gz	JZMAVICQNDWXBF-LSDHHAIUSA-N	0	3	334.423	3.500	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)CC[C@H](C)SC)c1ccccc1	ZINC000787042549	1305683112	/nfs/dbraw/zinc/68/31/12/1305683112.db2.gz	WZNOFTGMCKWGJZ-IMJJTQAJSA-N	0	3	332.469	3.494	20	30		EGEDHN
CC(C)[C@@H](CNCc1cc(C#N)cs1)ONC(=O)OC(C)(C)C	ZINC000895026020	1309162115	/nfs/dbraw/zinc/16/21/15/1309162115.db2.gz	MUDQDAIIDCLVGC-CQSZACIVSA-N	0	3	339.461	3.190	20	30		EGEDHN
C=C1CCN(C(=O)NC[C@H](c2ccc(SC)cc2)N(C)C)CC1	ZINC000895059743	1309173025	/nfs/dbraw/zinc/17/30/25/1309173025.db2.gz	WVFMZQLFUXKBOW-QGZVFWFLSA-N	0	3	333.501	3.373	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2CC(C)(C)C)C1	ZINC001022105519	1318795518	/nfs/dbraw/zinc/79/55/18/1318795518.db2.gz	IPGCKIPTXRGWAJ-IGQOVBAYSA-N	0	3	343.309	3.204	20	30		EGEDHN
C#CCC1(C(=O)Nc2cccc(CN3CC[C@@H](O)C3)c2)CCCCC1	ZINC000794569070	1309547766	/nfs/dbraw/zinc/54/77/66/1309547766.db2.gz	RLMLLWPMXFCWIE-LJQANCHMSA-N	0	3	340.467	3.166	20	30		EGEDHN
COc1ccc(C2=NO[C@H](CN[C@@H](C)CC(C)(C)C#N)C2)cc1C	ZINC000895976766	1309623733	/nfs/dbraw/zinc/62/37/33/1309623733.db2.gz	JSTULYVMTBYIML-HOCLYGCPSA-N	0	3	329.444	3.415	20	30		EGEDHN
C#CCN1CCC[C@H](NCc2nc(-c3cccc(OC)c3)cs2)C1	ZINC000896044142	1309670596	/nfs/dbraw/zinc/67/05/96/1309670596.db2.gz	YDUFDZXKTSHXQF-INIZCTEOSA-N	0	3	341.480	3.006	20	30		EGEDHN
C#CCN1CCC[C@@H](NCc2nc(-c3cccc(OC)c3)cs2)C1	ZINC000896044143	1309671119	/nfs/dbraw/zinc/67/11/19/1309671119.db2.gz	YDUFDZXKTSHXQF-MRXNPFEDSA-N	0	3	341.480	3.006	20	30		EGEDHN
C[C@@H](NC(=O)C1CCCC1)C(=O)C(C#N)c1ncc(C(C)(C)C)s1	ZINC000797568642	1310212728	/nfs/dbraw/zinc/21/27/28/1310212728.db2.gz	KNVALGFPGDKIHT-DGCLKSJQSA-N	0	3	347.484	3.312	20	30		EGEDHN
COc1cc(CNC[C@H](O)c2cc(F)cc(Cl)c2)ccc1C#N	ZINC000799342490	1310531185	/nfs/dbraw/zinc/53/11/85/1310531185.db2.gz	SACCZSAUJHEZHG-INIZCTEOSA-N	0	3	334.778	3.183	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N(CCC)[C@@H]1CCc2ccccc21	ZINC000836489071	1320493966	/nfs/dbraw/zinc/49/39/66/1320493966.db2.gz	UNRNFJAEAABTMK-LJQANCHMSA-N	0	3	327.472	3.051	20	30		EGEDHN
C[C@H](N[C@@H]1CCc2ccccc2NC1=O)c1ccc(OCC#N)cc1	ZINC000839539406	1320935240	/nfs/dbraw/zinc/93/52/40/1320935240.db2.gz	MRKCHWRYVWTBCV-IFXJQAMLSA-N	0	3	335.407	3.193	20	30		EGEDHN
C#C[C@H](NCCC(=O)Nc1c(Cl)cccc1Cl)[C@H]1CCCO1	ZINC000839562589	1320938464	/nfs/dbraw/zinc/93/84/64/1320938464.db2.gz	APTULKCJFIJVIB-UONOGXRCSA-N	0	3	341.238	3.092	20	30		EGEDHN
C[C@@H](C#N)OCCN(Cc1ccccc1)C[C@@H](O)c1ccsc1	ZINC000801927060	1316966618	/nfs/dbraw/zinc/96/66/18/1316966618.db2.gz	HXBRKCYSTZKDBF-MAUKXSAKSA-N	0	3	330.453	3.212	20	30		EGEDHN
CC1(C(=O)N2CC[C@H](NCc3ccc(F)c(C#N)c3)C2)CCCCC1	ZINC001019324157	1317169561	/nfs/dbraw/zinc/16/95/61/1317169561.db2.gz	VDSVOCURBIHDDZ-KRWDZBQOSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3cn(C(C)C)nc3C)C2)CC1	ZINC001019331161	1317171765	/nfs/dbraw/zinc/17/17/65/1317171765.db2.gz	KXJYJPNJLWFOBD-IBGZPJMESA-N	0	3	344.503	3.209	20	30		EGEDHN
C/C(=C(/F)C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1)C1CC1	ZINC000900248617	1317259072	/nfs/dbraw/zinc/25/90/72/1317259072.db2.gz	MPTVKWPIXBBPTR-JXAWBTAJSA-N	0	3	329.419	3.102	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@H](NCc2ccc(C#N)s2)C1)c1ccccc1	ZINC001019668131	1317323538	/nfs/dbraw/zinc/32/35/38/1317323538.db2.gz	KKFUUVZYXJQTHU-HOCLYGCPSA-N	0	3	339.464	3.114	20	30		EGEDHN
C=C(C)C[NH+]1CCC2(CCN(C(=O)c3ccccc3[O-])CC2)CC1	ZINC000957504985	1317413085	/nfs/dbraw/zinc/41/30/85/1317413085.db2.gz	OKUHHDZLQQRLSH-UHFFFAOYSA-N	0	3	328.456	3.287	20	30		EGEDHN
C=C[C@H](C(=O)N1CC[C@H](NCc2cnc(C)s2)C1)c1ccccc1	ZINC001019804935	1317432717	/nfs/dbraw/zinc/43/27/17/1317432717.db2.gz	MZSXMJRYAHFZBB-WMZOPIPTSA-N	0	3	341.480	3.112	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H]2C[C@H](NCc3ccc(C#N)cc3F)C2)s1	ZINC001019943977	1317469767	/nfs/dbraw/zinc/46/97/67/1317469767.db2.gz	HSAZHKZRZJSBHG-SHTZXODSSA-N	0	3	343.427	3.118	20	30		EGEDHN
C=CCOc1ccc(CN[C@H]2COc3ccccc3[C@@H]2O)cc1Cl	ZINC000808454245	1317680185	/nfs/dbraw/zinc/68/01/85/1317680185.db2.gz	NOKRIGIQANWNBL-LPHOPBHVSA-N	0	3	345.826	3.489	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2nsc3ccc(C)cc32)C1	ZINC001020466160	1317708010	/nfs/dbraw/zinc/70/80/10/1317708010.db2.gz	HTPVJBMYLMVOQU-HAQNSBGRSA-N	0	3	335.860	3.208	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@H](NC(=O)C[C@H]3CC=CCC3)C2)c(F)c1	ZINC001020473264	1317710480	/nfs/dbraw/zinc/71/04/80/1317710480.db2.gz	VBWKZACKECCXSD-WBAXXEDZSA-N	0	3	341.430	3.181	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@H](NCc3cc(OC)ccc3Cl)C2)C1	ZINC001020562974	1317774866	/nfs/dbraw/zinc/77/48/66/1317774866.db2.gz	YCUAYNISYKKJAS-SHTZXODSSA-N	0	3	348.874	3.442	20	30		EGEDHN
C#Cc1ccc(CN[C@H](CN2CCOCC2)c2ccc(C)cc2)cc1	ZINC000809602962	1317841075	/nfs/dbraw/zinc/84/10/75/1317841075.db2.gz	FLBCHQWVVWFEGF-JOCHJYFZSA-N	0	3	334.463	3.139	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc(C(CC)CC)no2)C1	ZINC001020699264	1317875762	/nfs/dbraw/zinc/87/57/62/1317875762.db2.gz	PSOQIZHCMHUEDR-JOCQHMNTSA-N	0	3	325.840	3.181	20	30		EGEDHN
N#Cc1ccc(CN2CCC(Nc3ccc4c(c3)C(=O)OC4)CC2)cc1	ZINC000809787879	1317901855	/nfs/dbraw/zinc/90/18/55/1317901855.db2.gz	FCBOUYYYXWWFKN-UHFFFAOYSA-N	0	3	347.418	3.305	20	30		EGEDHN
Cc1nn(-c2ccccc2C)c(C)c1/C=C1\C(=O)c2ncnn2C1C	ZINC000905083792	1317922156	/nfs/dbraw/zinc/92/21/56/1317922156.db2.gz	FGXRELJHWGREMQ-SLVCOGOPSA-N	0	3	333.395	3.230	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(F)c(Cl)c1)C(=O)[C@H]1CCCSC1	ZINC000810531209	1318017987	/nfs/dbraw/zinc/01/79/87/1318017987.db2.gz	KDFAQAJPKHGKPM-ONGXEEELSA-N	0	3	340.807	3.270	20	30		EGEDHN
Cc1cc(C(=O)NC2C[C@H]3CC[C@@H](C2)N3Cc2cccc(C#N)c2)co1	ZINC001021240008	1318153214	/nfs/dbraw/zinc/15/32/14/1318153214.db2.gz	FEIKBPXGOHTTPT-IHWFROFDSA-N	0	3	349.434	3.385	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)/C=C\C2CC2)c(F)c1	ZINC000959938078	1318274963	/nfs/dbraw/zinc/27/49/63/1318274963.db2.gz	QOAKQHYDRXCZGA-CNRGFGOASA-N	0	3	341.430	3.134	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@H]2CN(Cc3ccc(F)cc3)CC[C@H]21	ZINC001021582705	1318427901	/nfs/dbraw/zinc/42/79/01/1318427901.db2.gz	YRNYVZJOHZZVFV-AZUAARDMSA-N	0	3	340.442	3.052	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)C(C)(C)[C@H]1CCCCO1	ZINC000960266880	1318435919	/nfs/dbraw/zinc/43/59/19/1318435919.db2.gz	FSCVRAFUDHDARO-GUDVDZBRSA-N	0	3	342.483	3.140	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc(Cl)cn1C	ZINC000960279285	1318441133	/nfs/dbraw/zinc/44/11/33/1318441133.db2.gz	DQFYFNVLYUMPTM-SJLPKXTDSA-N	0	3	343.858	3.240	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccn(C(C)C)n1	ZINC000960309597	1318454904	/nfs/dbraw/zinc/45/49/04/1318454904.db2.gz	CLXFZGUSZGXBMR-RTBURBONSA-N	0	3	338.455	3.026	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1scnc1C(C)C	ZINC000960314305	1318457115	/nfs/dbraw/zinc/45/71/15/1318457115.db2.gz	PANOQBAISPMZBT-NVXWUHKLSA-N	0	3	341.480	3.438	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1c(F)cccc1F	ZINC000960325629	1318462608	/nfs/dbraw/zinc/46/26/08/1318462608.db2.gz	PGUYKFLEQLYNMG-SJLPKXTDSA-N	0	3	328.362	3.136	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc(C)cc1OC	ZINC000960327174	1318463536	/nfs/dbraw/zinc/46/35/36/1318463536.db2.gz	OKCMYROBDJHFKA-UYAOXDASSA-N	0	3	336.435	3.175	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccccc1N(C)C	ZINC000960331727	1318466176	/nfs/dbraw/zinc/46/61/76/1318466176.db2.gz	BNYYLIORTSUFGX-TZIWHRDSSA-N	0	3	349.478	3.314	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(C)c(F)c2)C1	ZINC001021627682	1318480100	/nfs/dbraw/zinc/48/01/00/1318480100.db2.gz	OTLQSQCVRVSKIZ-HKUYNNGSSA-N	0	3	328.431	3.084	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2nc3ccccc3cc2C)C1	ZINC001021635623	1318489895	/nfs/dbraw/zinc/48/98/95/1318489895.db2.gz	LFNRDAVIVFQUSU-UYAOXDASSA-N	0	3	347.462	3.103	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)Cc2cccc(C3CC3)c2)C1	ZINC001021635296	1318490086	/nfs/dbraw/zinc/49/00/86/1318490086.db2.gz	JMWRXDNBGPHQRS-RTWAWAEBSA-N	0	3	336.479	3.053	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc3ccc(C)cc3[nH]2)C1	ZINC001021637788	1318493779	/nfs/dbraw/zinc/49/37/79/1318493779.db2.gz	AFPVLKMJAZBXBC-PXNSSMCTSA-N	0	3	335.451	3.036	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc3ccc(C)cc3[nH]2)C1	ZINC001021642057	1318499861	/nfs/dbraw/zinc/49/98/61/1318499861.db2.gz	NUYJDTKJIOJWGD-RXVVDRJESA-N	0	3	349.478	3.426	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)c1cccs1	ZINC000960377784	1318502613	/nfs/dbraw/zinc/50/26/13/1318502613.db2.gz	LMPAZJIKDAFRMX-KRWDZBQOSA-N	0	3	339.464	3.356	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(Cl)cc2C)C1	ZINC001021663703	1318525569	/nfs/dbraw/zinc/52/55/69/1318525569.db2.gz	DIGLFZLMRNJAEK-CRAIPNDOSA-N	0	3	330.859	3.208	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(F)ccc2Cl)C1	ZINC001021674603	1318539462	/nfs/dbraw/zinc/53/94/62/1318539462.db2.gz	BVEGITCNIHXWPA-GUYCJALGSA-N	0	3	334.822	3.039	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)Cc2ccc(CC)cc2)C1	ZINC001021674302	1318540833	/nfs/dbraw/zinc/54/08/33/1318540833.db2.gz	AKMKCSSGVVAVJW-SFTDATJTSA-N	0	3	338.495	3.128	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)CCc2ccccc2C)C1	ZINC001021678407	1318547586	/nfs/dbraw/zinc/54/75/86/1318547586.db2.gz	YCUBOUSNIKARNP-RTWAWAEBSA-N	0	3	338.495	3.264	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(C(C)(C)C)oc2C)C1	ZINC001021679909	1318551308	/nfs/dbraw/zinc/55/13/08/1318551308.db2.gz	USELUGOLCJBDFQ-FUHWJXTLSA-N	0	3	342.483	3.445	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(Cl)ccc2C)C1	ZINC001021694589	1318569383	/nfs/dbraw/zinc/56/93/83/1318569383.db2.gz	XICVBPNPMDHOKA-QAPCUYQASA-N	0	3	330.859	3.208	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc3sccc3[nH]2)C1	ZINC001021706309	1318577759	/nfs/dbraw/zinc/57/77/59/1318577759.db2.gz	KJSWWBFIUZQRQF-YOEHRIQHSA-N	0	3	341.480	3.179	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc3sccc3c2)C1	ZINC001021706627	1318581271	/nfs/dbraw/zinc/58/12/71/1318581271.db2.gz	MSNYJKIBEUNCRX-ZWKOTPCHSA-N	0	3	338.476	3.461	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cccc3ccsc32)C1	ZINC001021708332	1318583522	/nfs/dbraw/zinc/58/35/22/1318583522.db2.gz	CRSMMLAKGDVOFU-WMZOPIPTSA-N	0	3	338.476	3.461	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc3c(c2)CCC=C3)C1	ZINC001021715687	1318594207	/nfs/dbraw/zinc/59/42/07/1318594207.db2.gz	IDDXTHPNJUVLCB-SFTDATJTSA-N	0	3	334.463	3.206	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2ccc(Cl)cc2)C1	ZINC001021725105	1318616607	/nfs/dbraw/zinc/61/66/07/1318616607.db2.gz	POQYBHZMQJSWPS-PKOBYXMFSA-N	0	3	344.886	3.219	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(CC)c(C)s2)C1	ZINC001021728374	1318624982	/nfs/dbraw/zinc/62/49/82/1318624982.db2.gz	SURRQENFRRARKS-SJORKVTESA-N	0	3	330.497	3.179	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(Cl)s2)C1	ZINC001021728118	1318626201	/nfs/dbraw/zinc/62/62/01/1318626201.db2.gz	RKSQRFPNZWNYAD-KBPBESRZSA-N	0	3	336.888	3.351	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc3ccccc3n2CC)C1	ZINC001021738875	1318645206	/nfs/dbraw/zinc/64/52/06/1318645206.db2.gz	CQAHKRWJUQBUAV-UYAOXDASSA-N	0	3	349.478	3.221	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(C(C)C)s2)C1	ZINC001021743687	1318656447	/nfs/dbraw/zinc/65/64/47/1318656447.db2.gz	QVQFAKRKVPNBHW-CVEARBPZSA-N	0	3	330.497	3.431	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2coc3ccccc23)C1	ZINC001021749663	1318666206	/nfs/dbraw/zinc/66/62/06/1318666206.db2.gz	GVWZNZLKHKKSJR-APWZRJJASA-N	0	3	336.435	3.383	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)C=C2CCCCC2)C1	ZINC001021880168	1318717317	/nfs/dbraw/zinc/71/73/17/1318717317.db2.gz	IZJUAHUVRRHUJW-OKILXGFUSA-N	0	3	327.266	3.022	20	30		EGEDHN
C[C@@H](c1cccc(F)c1)N(C)C[C@@H]1CCCN1C(=O)C#CC1CC1	ZINC000960624898	1318750531	/nfs/dbraw/zinc/75/05/31/1318750531.db2.gz	ROIJZMMXNGUWPB-KXBFYZLASA-N	0	3	328.431	3.223	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC[C@H]1CN(C)C[C@@H]1CCCCO1	ZINC000960645554	1318765833	/nfs/dbraw/zinc/76/58/33/1318765833.db2.gz	ACWCXXWBOKHATA-HOTGVXAUSA-N	0	3	342.911	3.257	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1C[C@@H](N[C@H](C)c2ccccc2F)C1	ZINC001022206126	1318842778	/nfs/dbraw/zinc/84/27/78/1318842778.db2.gz	NWHMNDBIHQMDJZ-OAGGEKHMSA-N	0	3	341.430	3.425	20	30		EGEDHN
C=CCC(F)(F)C(=O)N(CCN(C)C)Cc1cccc(Cl)c1	ZINC000815138544	1318909173	/nfs/dbraw/zinc/90/91/73/1318909173.db2.gz	VVWWZBVDFBNUJV-UHFFFAOYSA-N	0	3	330.806	3.442	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]2CN(C)Cc2ccc(OC)cc2)C1	ZINC000960847577	1318987095	/nfs/dbraw/zinc/98/70/95/1318987095.db2.gz	QBTIFHCXZUULGZ-SFHVURJKSA-N	0	3	342.483	3.474	20	30		EGEDHN
C[C@H]1CCCC[C@@H]1C(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001022620883	1319019656	/nfs/dbraw/zinc/01/96/56/1319019656.db2.gz	SNSQTFSMLQKESA-RUGDWHBFSA-N	0	3	343.446	3.260	20	30		EGEDHN
C#CCN(C)CCC[NH2+][C@H](C)c1cc(Br)cc(C)c1[O-]	ZINC000815652554	1319038454	/nfs/dbraw/zinc/03/84/54/1319038454.db2.gz	HXFKQRWKSMNQRO-CYBMUJFWSA-N	0	3	339.277	3.069	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@@]2(C)CCCc3ccccc32)C1	ZINC001022854566	1319137411	/nfs/dbraw/zinc/13/74/11/1319137411.db2.gz	DAGGAMVEWXUUGC-FCEWJHQRSA-N	0	3	332.875	3.270	20	30		EGEDHN
CC(=O)N1CCC[C@@H]([C@@H]2CCN(CC#Cc3ccc(Cl)cc3)C2)C1	ZINC000961095026	1319208183	/nfs/dbraw/zinc/20/81/83/1319208183.db2.gz	XSORVCDFBBFCLR-RTBURBONSA-N	0	3	344.886	3.272	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)Cc2ccc(OC(C)C)cc2)C1	ZINC001023118132	1319269661	/nfs/dbraw/zinc/26/96/61/1319269661.db2.gz	PAJFTSCJNIHGNK-IYBDPMFKSA-N	0	3	336.863	3.006	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]([C@H]2CCN(Cc3cc(C)no3)C2)C1	ZINC000961232668	1319363360	/nfs/dbraw/zinc/36/33/60/1319363360.db2.gz	UGCOSISZTWPNAP-SJORKVTESA-N	0	3	345.487	3.256	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]([C@H]2CCN(Cc3ccns3)C2)C1	ZINC000961233310	1319365517	/nfs/dbraw/zinc/36/55/17/1319365517.db2.gz	VZTSYBQWIIEJBM-CVEARBPZSA-N	0	3	347.528	3.416	20	30		EGEDHN
Clc1cnc(N=NCc2cnc(N3CCCC3)nc2)c(Cl)c1	ZINC000914771751	1319375694	/nfs/dbraw/zinc/37/56/94/1319375694.db2.gz	DAWQEGNBZPXXNQ-UHFFFAOYSA-N	0	3	337.214	3.225	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]\C[C@H](O)COc2ccccc2)c([O-])c1	ZINC000915113160	1319423937	/nfs/dbraw/zinc/42/39/37/1319423937.db2.gz	PIPKMHIPWIPDKH-PKIWBCANSA-N	0	3	342.439	3.097	20	30		EGEDHN
CC[C@@H]1CCCN(Cc2cc(=O)n3c4ccccc4[nH]c3c2C#N)C1	ZINC000915218521	1319447255	/nfs/dbraw/zinc/44/72/55/1319447255.db2.gz	FBFPWEMGFFFPDA-ZBFHGGJFSA-N	0	3	334.423	3.346	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cscc2C(F)F)C1	ZINC001023372308	1319483640	/nfs/dbraw/zinc/48/36/40/1319483640.db2.gz	QUFRMEPOXBDWFM-LBPRGKRZSA-N	0	3	326.412	3.151	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1ccccc1Oc1ccccc1C#N	ZINC000818599422	1319566789	/nfs/dbraw/zinc/56/67/89/1319566789.db2.gz	QDVZCPWWRMDSIT-UHFFFAOYSA-N	0	3	347.418	3.035	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1sc(-c2ccccc2C)nc1C	ZINC000818615157	1319570308	/nfs/dbraw/zinc/57/03/08/1319570308.db2.gz	BWLPPILGZZSKOV-UHFFFAOYSA-N	0	3	341.480	3.112	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1ccc2[nH]c3c(c2c1)CCCCC3	ZINC000818609321	1319570527	/nfs/dbraw/zinc/57/05/27/1319570527.db2.gz	QOZOPSWOYFEPHN-UHFFFAOYSA-N	0	3	337.467	3.122	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc(C)c3cccnc23)C1	ZINC001023494667	1319602262	/nfs/dbraw/zinc/60/22/62/1319602262.db2.gz	OUFUAJALVLMNHB-QGZVFWFLSA-N	0	3	335.451	3.008	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2nc3ccccc3cc2C)C1	ZINC001023497689	1319607384	/nfs/dbraw/zinc/60/73/84/1319607384.db2.gz	IWNWSHARKPXQJO-KRWDZBQOSA-N	0	3	335.451	3.008	20	30		EGEDHN
CC[C@H](C#N)Oc1cccc(CNC[C@H](O)c2c(F)cccc2F)c1	ZINC000819067467	1319626387	/nfs/dbraw/zinc/62/63/87/1319626387.db2.gz	LFISQURPCMWMDI-KDOFPFPSSA-N	0	3	346.377	3.469	20	30		EGEDHN
COc1ccc(OC)c([C@@H](O)CNCc2ccc(C#N)c(Cl)c2)c1	ZINC000819294684	1319691406	/nfs/dbraw/zinc/69/14/06/1319691406.db2.gz	ILIVBDYHBVAPLM-KRWDZBQOSA-N	0	3	346.814	3.052	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H](CNC(=O)C3CC4(CC4)C3)C2)cc1	ZINC001023579453	1319696949	/nfs/dbraw/zinc/69/69/49/1319696949.db2.gz	GMVDUZFUPNWXFB-SFHVURJKSA-N	0	3	337.467	3.077	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccccc2OC2CCC2)C1	ZINC001023582788	1319706011	/nfs/dbraw/zinc/70/60/11/1319706011.db2.gz	QLXVRTYHJDEJSL-KRWDZBQOSA-N	0	3	340.467	3.083	20	30		EGEDHN
CCOCC(=O)C(C#N)C(=O)Nc1ccccc1Oc1ccccc1	ZINC000916904363	1319722477	/nfs/dbraw/zinc/72/24/77/1319722477.db2.gz	BFOZJJUSJJWWJA-HNNXBMFYSA-N	0	3	338.363	3.163	20	30		EGEDHN
C[C@@H](Oc1ccc2c(c1)CCC2)C(=O)C(C#N)C(=O)Nc1ccccc1	ZINC000916900861	1319722543	/nfs/dbraw/zinc/72/25/43/1319722543.db2.gz	YAQIAEUVZQDEEZ-AUUYWEPGSA-N	0	3	348.402	3.290	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc(F)c3ccccc23)C1	ZINC001023609863	1319724497	/nfs/dbraw/zinc/72/44/97/1319724497.db2.gz	VRXYNDIZNIWMAR-MRXNPFEDSA-N	0	3	338.426	3.444	20	30		EGEDHN
CCc1cccc(CC)c1NC(=O)C(C#N)C(=O)COC1CCCC1	ZINC000916910978	1319724682	/nfs/dbraw/zinc/72/46/82/1319724682.db2.gz	YVOSKKDCXMGOMR-QGZVFWFLSA-N	0	3	342.439	3.418	20	30		EGEDHN
CCc1occc1C(=O)NC1CC(CNCc2ccccc2C#N)C1	ZINC000961785790	1319732333	/nfs/dbraw/zinc/73/23/33/1319732333.db2.gz	HSSRZMNIQQXBJD-UHFFFAOYSA-N	0	3	337.423	3.012	20	30		EGEDHN
C=CCN1CCC[C@H](CNC(=O)c2cnc(-c3ccoc3)s2)C1	ZINC001023635826	1319755503	/nfs/dbraw/zinc/75/55/03/1319755503.db2.gz	HXZZXVARWFHZDY-CYBMUJFWSA-N	0	3	331.441	3.031	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc(C(F)F)cc2F)C1	ZINC001023670161	1319785382	/nfs/dbraw/zinc/78/53/82/1319785382.db2.gz	MGFYTGBPZGLLMR-ZDUSSCGKSA-N	0	3	338.373	3.228	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc(-c3ccco3)s2)C1	ZINC001023677707	1319791393	/nfs/dbraw/zinc/79/13/93/1319791393.db2.gz	NCXBKXPNECECOW-HNNXBMFYSA-N	0	3	342.464	3.473	20	30		EGEDHN
C[C@@]1(C(=O)NC2CC(CNCc3cc(C#N)ccc3F)C2)C=CCC1	ZINC000962183792	1319847613	/nfs/dbraw/zinc/84/76/13/1319847613.db2.gz	COXVDGGQBZXNQU-MKJPBZQASA-N	0	3	341.430	3.038	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc3[nH]c(C)c(C)c3c2)C1	ZINC001023742108	1319886366	/nfs/dbraw/zinc/88/63/66/1319886366.db2.gz	CMTOUZHEVKPZLV-KRWDZBQOSA-N	0	3	337.467	3.250	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cscc2C(F)(F)F)C1	ZINC001023788401	1319936591	/nfs/dbraw/zinc/93/65/91/1319936591.db2.gz	YEQRJQKJEWIQGL-LBPRGKRZSA-N	0	3	344.402	3.232	20	30		EGEDHN
N#CCOc1ccc(CNCc2ccc3c(c2)OCCCCO3)cc1	ZINC000823831173	1320209716	/nfs/dbraw/zinc/20/97/16/1320209716.db2.gz	RYOSSKNZXUHYAL-UHFFFAOYSA-N	0	3	338.407	3.430	20	30		EGEDHN
CC(C)OCCOC1CCN(Cc2ccc(O[C@@H](C)C#N)cc2)CC1	ZINC000825207116	1320318361	/nfs/dbraw/zinc/31/83/61/1320318361.db2.gz	DTEZYRITBYWKEB-KRWDZBQOSA-N	0	3	346.471	3.383	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1ccc(N2CCCCC2)c(Cl)c1	ZINC000827589901	1320461488	/nfs/dbraw/zinc/46/14/88/1320461488.db2.gz	HDJANSQDKYQUNX-HNNXBMFYSA-N	0	3	334.851	3.290	20	30		EGEDHN
C[C@@H]1CC(C)(C)CN1Cc1cc(=O)n2c3ccccc3[nH]c2c1C#N	ZINC000839658407	1320954465	/nfs/dbraw/zinc/95/44/65/1320954465.db2.gz	MSOSFXMIMSPGQP-UKRRQHHQSA-N	0	3	334.423	3.344	20	30		EGEDHN
CCCCCCCOc1ccc(CN2CC[C@@H](O)[C@H](CO)C2)cc1	ZINC000840976966	1321192539	/nfs/dbraw/zinc/19/25/39/1321192539.db2.gz	ZWJHQIICEMWRAL-AZUAARDMSA-N	0	3	335.488	3.211	20	30		EGEDHN
CC[C@@H](OC1CCCC1)C(=O)C(C#N)C(=O)Nc1ccc(OC)cc1	ZINC000842290478	1321368320	/nfs/dbraw/zinc/36/83/20/1321368320.db2.gz	ZFJCMDMNLBRELS-IAGOWNOFSA-N	0	3	344.411	3.080	20	30		EGEDHN
CCN(CC)c1ccc(/C=N/[C@@H]2CCN(C(C)(C)C)C2=O)c(O)c1	ZINC000843265607	1321495833	/nfs/dbraw/zinc/49/58/33/1321495833.db2.gz	HFXMJIFAPAVMTL-RBYWHNRPSA-N	0	3	331.460	3.057	20	30		EGEDHN
N#CCOc1cccc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)c1	ZINC000844339034	1321591027	/nfs/dbraw/zinc/59/10/27/1321591027.db2.gz	WILGKTKQFIGZGV-KBPBESRZSA-N	0	3	342.317	3.275	20	30		EGEDHN
C#Cc1cccc(NC(=O)N[C@]2(C)CCN(Cc3ccccc3)C2)c1	ZINC000844497954	1321613499	/nfs/dbraw/zinc/61/34/99/1321613499.db2.gz	KGVUXCFYDXDZAK-OAQYLSRUSA-N	0	3	333.435	3.454	20	30		EGEDHN
CCO[C@H](CC)C(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847749492	1321900812	/nfs/dbraw/zinc/90/08/12/1321900812.db2.gz	RQMINFKJYPUQPH-GOSISDBHSA-N	0	3	344.455	3.151	20	30		EGEDHN
N#CCSc1ccccc1C(=O)N[C@H]1CCCN2CCCC[C@H]12	ZINC000848349454	1321953212	/nfs/dbraw/zinc/95/32/12/1321953212.db2.gz	IDHJGVLTJXUSNK-JKSUJKDBSA-N	0	3	329.469	3.049	20	30		EGEDHN
CCO[C@H](CC)C(=O)C(C#N)C(=O)Nc1c(CC)cccc1CC	ZINC000920109256	1322138010	/nfs/dbraw/zinc/13/80/10/1322138010.db2.gz	NDARZBCKCZJIQM-JKSUJKDBSA-N	0	3	330.428	3.274	20	30		EGEDHN
CCc1cccc(CC)c1NC(=O)C(C#N)C(=O)[C@@H](C)OCC1CC1	ZINC000920789812	1322222819	/nfs/dbraw/zinc/22/28/19/1322222819.db2.gz	GNAJWDMWJDVBHZ-DYVFJYSZSA-N	0	3	342.439	3.274	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)CCCc1cccnc1)c1ccccc1	ZINC000850978029	1322318521	/nfs/dbraw/zinc/31/85/21/1322318521.db2.gz	KDKUHUMCEFMTBD-MOPGFXCFSA-N	0	3	349.434	3.381	20	30		EGEDHN
C#CCCN1CC[C@H](C(F)(F)F)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000859606241	1329032624	/nfs/dbraw/zinc/03/26/24/1329032624.db2.gz	LZTNNHOELZWDQO-OLZOCXBDSA-N	0	3	334.382	3.035	20	30		EGEDHN
C#CCCN1CC[C@@H](C(F)(F)F)[C@@H](CNC(=O)OC(C)(C)C)C1	ZINC000859606286	1329032668	/nfs/dbraw/zinc/03/26/68/1329032668.db2.gz	LZTNNHOELZWDQO-QWHCGFSZSA-N	0	3	334.382	3.035	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N1CCC[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001023942337	1323045193	/nfs/dbraw/zinc/04/51/93/1323045193.db2.gz	YKJAKKDWICAPFV-KDOFPFPSSA-N	0	3	343.446	3.072	20	30		EGEDHN
CC1=CC[C@](C)(C(=O)N[C@@H]2[C@H]3CN(Cc4ccc(C#N)cc4)C[C@H]32)CC1	ZINC000962713484	1323051021	/nfs/dbraw/zinc/05/10/21/1323051021.db2.gz	GKROXENBTLXHFB-HIUFNZKISA-N	0	3	349.478	3.241	20	30		EGEDHN
C#C[C@](C)(CC)NCC(=O)N[C@@H](C)c1ccc(OC(F)(F)F)cc1	ZINC000852102391	1323147563	/nfs/dbraw/zinc/14/75/63/1323147563.db2.gz	MIOZVBHUXGLBJF-BLLLJJGKSA-N	0	3	342.361	3.154	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)C2=COCCC2)C1	ZINC000963262034	1323277442	/nfs/dbraw/zinc/27/74/42/1323277442.db2.gz	DFCQHVDMFDNXNQ-DOTOQJQBSA-N	0	3	338.879	3.136	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1coc2c1cccc2OC	ZINC001024441122	1323403855	/nfs/dbraw/zinc/40/38/55/1323403855.db2.gz	YMKQLJJUTJCSDB-OAHLLOKOSA-N	0	3	340.423	3.049	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@@H]1CCCN1c1ccccc1	ZINC001024471713	1323426748	/nfs/dbraw/zinc/42/67/48/1323426748.db2.gz	KMJHJBNMIJLCHP-PMACEKPBSA-N	0	3	341.499	3.202	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cccc([C@@H]2CCOC2)c1	ZINC001024515590	1323466306	/nfs/dbraw/zinc/46/63/06/1323466306.db2.gz	WEIAIWROSVZWLU-WOJBJXKFSA-N	0	3	342.483	3.351	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCCCN2Cc2ccccc2)cc1	ZINC001024591165	1323525506	/nfs/dbraw/zinc/52/55/06/1323525506.db2.gz	AMENRFLPFPOHDF-OAQYLSRUSA-N	0	3	332.447	3.452	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccc(C2CC2)nc1C	ZINC001024656716	1323577416	/nfs/dbraw/zinc/57/74/16/1323577416.db2.gz	QHEOTMIIVGCOQN-KRWDZBQOSA-N	0	3	327.472	3.428	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1[nH]ccc1-c1ccccc1	ZINC001024754243	1323654813	/nfs/dbraw/zinc/65/48/13/1323654813.db2.gz	PWTIXYLYBKXGHU-SFHVURJKSA-N	0	3	335.451	3.289	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cc(C)n(C(C)(C)C)n1	ZINC001024802831	1323705546	/nfs/dbraw/zinc/70/55/46/1323705546.db2.gz	ARAAUSPKORJBLF-MRXNPFEDSA-N	0	3	332.492	3.107	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccc(OC2CCC2)cc1	ZINC001024811813	1323713817	/nfs/dbraw/zinc/71/38/17/1323713817.db2.gz	ZXAMLYPROMFTCY-SFHVURJKSA-N	0	3	340.467	3.226	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)C12CC(c3ccccc3)(C1)C2	ZINC001024816251	1323717737	/nfs/dbraw/zinc/71/77/37/1323717737.db2.gz	GJKSSZUZZUMTDF-JSRJAPPDSA-N	0	3	336.479	3.102	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)c2ccoc2)c(F)c1	ZINC001024869631	1323757753	/nfs/dbraw/zinc/75/77/53/1323757753.db2.gz	QTBZKXZCVRLESN-QGZVFWFLSA-N	0	3	341.386	3.075	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001024876275	1323761293	/nfs/dbraw/zinc/76/12/93/1323761293.db2.gz	LFMYDVBNBPTJRH-RHSMWYFYSA-N	0	3	331.435	3.214	20	30		EGEDHN
C[C@@H](NC[C@H]1CCCCN1C(=O)C#CC1CC1)c1cc(F)ccc1F	ZINC001024957569	1323799602	/nfs/dbraw/zinc/79/96/02/1323799602.db2.gz	FSGAJDROBMMUPZ-RHSMWYFYSA-N	0	3	346.421	3.410	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@@H]1CNCc1c(C)nsc1C	ZINC001025040705	1323843455	/nfs/dbraw/zinc/84/34/55/1323843455.db2.gz	JPDSTNPSXIOZEA-OAHLLOKOSA-N	0	3	335.517	3.443	20	30		EGEDHN
C[C@@]1(C(=O)N2CCCC[C@@H]2CNCc2ccc(C#N)s2)C=CCC1	ZINC001025046037	1323850704	/nfs/dbraw/zinc/85/07/04/1323850704.db2.gz	HBEUSKWVPDNJSS-DNVCBOLYSA-N	0	3	343.496	3.447	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1scnc1CC	ZINC001025238484	1324029658	/nfs/dbraw/zinc/02/96/58/1324029658.db2.gz	RVSVDUQPRGNFON-HOTGVXAUSA-N	0	3	333.501	3.351	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cnc(C2CC2)o1	ZINC001025240093	1324032588	/nfs/dbraw/zinc/03/25/88/1324032588.db2.gz	LBYKLIMPVDTUEL-HOTGVXAUSA-N	0	3	329.444	3.197	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCCC[C@@H]1[C@H]1CCCN1CC#CC	ZINC001025240257	1324034025	/nfs/dbraw/zinc/03/40/25/1324034025.db2.gz	MRAZUEWADYRUFA-RTBURBONSA-N	0	3	339.483	3.157	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(C)cc(C)n1	ZINC001025245704	1324044622	/nfs/dbraw/zinc/04/46/22/1324044622.db2.gz	PEGUVVOCJVVOEX-VQTJNVASSA-N	0	3	339.483	3.181	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc2cnccc2o1	ZINC001025248121	1324048220	/nfs/dbraw/zinc/04/82/20/1324048220.db2.gz	VPSOHKZHOZDHKI-IRXDYDNUSA-N	0	3	339.439	3.473	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccnc2ccccc21	ZINC001025251339	1324054867	/nfs/dbraw/zinc/05/48/67/1324054867.db2.gz	RTWZXVFOHLBADV-SFTDATJTSA-N	0	3	347.462	3.327	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)C1(c2cc(C)no2)CC1	ZINC001025259484	1324068868	/nfs/dbraw/zinc/06/88/68/1324068868.db2.gz	NWNVIQFOMYXMKL-IAGOWNOFSA-N	0	3	343.471	3.046	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)Cc1ccsc1C	ZINC001025273617	1324088763	/nfs/dbraw/zinc/08/87/63/1324088763.db2.gz	FUHZVIBLRWMBQA-ROUUACIJSA-N	0	3	330.497	3.078	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1csc(Cl)n1	ZINC001025283987	1324105076	/nfs/dbraw/zinc/10/50/76/1324105076.db2.gz	DBPVWTPWXHVEIU-ZIAGYGMSSA-N	0	3	339.892	3.442	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1c[nH]cc1C1CC1	ZINC001025284835	1324106651	/nfs/dbraw/zinc/10/66/51/1324106651.db2.gz	OHIYZPFYXJRMLL-WOJBJXKFSA-N	0	3	339.483	3.375	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1coc(CCC)n1	ZINC001025288198	1324111232	/nfs/dbraw/zinc/11/12/32/1324111232.db2.gz	JJNZCUIJGZZHEE-ROUUACIJSA-N	0	3	343.471	3.110	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc(F)cc1F	ZINC001025295843	1324126898	/nfs/dbraw/zinc/12/68/98/1324126898.db2.gz	HOCYCWLNNYAQPL-ROUUACIJSA-N	0	3	332.394	3.057	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H](C)[C@@H]1CCCN(C/C=C/Cl)C1	ZINC001025438150	1324278861	/nfs/dbraw/zinc/27/88/61/1324278861.db2.gz	DBRVJRQODRNVGV-HKFHSAMXSA-N	0	3	335.879	3.257	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2oc(C(F)F)cc2C)C1	ZINC001025445399	1324286051	/nfs/dbraw/zinc/28/60/51/1324286051.db2.gz	MYBUTTKKBZGGOQ-KBPBESRZSA-N	0	3	338.398	3.379	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccnn2C(CC)CC)C1	ZINC001025443907	1324286106	/nfs/dbraw/zinc/28/61/06/1324286106.db2.gz	VKUYQIMUCAVQPI-DLBZAZTESA-N	0	3	344.503	3.098	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(C)c(F)cc2F)C1	ZINC001025455907	1324296305	/nfs/dbraw/zinc/29/63/05/1324296305.db2.gz	MZXNZWGSXFEIOE-CABCVRRESA-N	0	3	334.410	3.127	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@@H](C)[C@@H]2CCCN(CC#CC)C2)cc1	ZINC001025461379	1324307438	/nfs/dbraw/zinc/30/74/38/1324307438.db2.gz	TWRYVRUSXVCMQZ-PKOBYXMFSA-N	0	3	340.467	3.105	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@H](C)[C@H]2CCCN(CC#CC)C2)cc1	ZINC001025461378	1324307474	/nfs/dbraw/zinc/30/74/74/1324307474.db2.gz	TWRYVRUSXVCMQZ-MJGOQNOKSA-N	0	3	340.467	3.105	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2occc2-c2ccccc2)C1	ZINC001025480203	1324326659	/nfs/dbraw/zinc/32/66/59/1324326659.db2.gz	RERRRYKVGNFNHC-WMZOPIPTSA-N	0	3	336.435	3.410	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H](C)[C@H]2CCCN(C/C=C/Cl)C2)cc1	ZINC001025501652	1324350062	/nfs/dbraw/zinc/35/00/62/1324350062.db2.gz	IVUXWNGTWPFHES-BUQBUFKHSA-N	0	3	330.859	3.251	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc3cc(Cl)ccc3[nH]2)C1	ZINC001025501707	1324351051	/nfs/dbraw/zinc/35/10/51/1324351051.db2.gz	JKECVWLQGYDOFN-UONOGXRCSA-N	0	3	343.858	3.285	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(C(C)C)cn2)C1	ZINC001025531290	1324378295	/nfs/dbraw/zinc/37/82/95/1324378295.db2.gz	OZTPXBKJOPBWRT-AEFFLSMTSA-N	0	3	327.472	3.059	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(Cl)c(F)c2)C1	ZINC001025544485	1324391467	/nfs/dbraw/zinc/39/14/67/1324391467.db2.gz	WDCUWYNWTGNJRH-HIFRSBDPSA-N	0	3	336.838	3.333	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(C)c(F)c2F)C1	ZINC001025544546	1324391915	/nfs/dbraw/zinc/39/19/15/1324391915.db2.gz	XAZSKBJPWGNGHM-GJZGRUSLSA-N	0	3	334.410	3.127	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cccn2C2CCCC2)C1	ZINC001025574869	1324414236	/nfs/dbraw/zinc/41/42/36/1324414236.db2.gz	WEKFXKNYOIYYAA-MSOLQXFVSA-N	0	3	341.499	3.457	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cccc3ccncc32)C1	ZINC001025583120	1324424033	/nfs/dbraw/zinc/42/40/33/1324424033.db2.gz	XVSJAWLPALCPLJ-WMZOPIPTSA-N	0	3	335.451	3.088	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc3sccc3[nH]2)C1	ZINC001025588774	1324432515	/nfs/dbraw/zinc/43/25/15/1324432515.db2.gz	YIEXIKZNYPXMGO-ZIAGYGMSSA-N	0	3	329.469	3.083	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc3sccc3[nH]2)C1	ZINC001025588771	1324433006	/nfs/dbraw/zinc/43/30/06/1324433006.db2.gz	YIEXIKZNYPXMGO-KBPBESRZSA-N	0	3	329.469	3.083	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc3sccc3[nH]2)C1	ZINC001025588773	1324433260	/nfs/dbraw/zinc/43/32/60/1324433260.db2.gz	YIEXIKZNYPXMGO-UONOGXRCSA-N	0	3	329.469	3.083	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC001025605777	1324454477	/nfs/dbraw/zinc/45/44/77/1324454477.db2.gz	CFSGORHNLDXNBQ-SJLPKXTDSA-N	0	3	326.484	3.448	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(OC)c(Cl)c2)C1	ZINC001025615398	1324467844	/nfs/dbraw/zinc/46/78/44/1324467844.db2.gz	VAHAEHKNBMPTSU-HOCLYGCPSA-N	0	3	348.874	3.202	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(F)c3occc32)C1	ZINC001025624580	1324474780	/nfs/dbraw/zinc/47/47/80/1324474780.db2.gz	NROLOLNQKLLKEN-KBPBESRZSA-N	0	3	328.387	3.035	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2c(Cl)cccc2OC)C1	ZINC001025630098	1324482503	/nfs/dbraw/zinc/48/25/03/1324482503.db2.gz	OWRBSJJDZRVIFO-LSDHHAIUSA-N	0	3	348.874	3.202	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2[C@H]3CN(C/C=C/c4ccccc4)C[C@H]32)cc1	ZINC001025933483	1324561273	/nfs/dbraw/zinc/56/12/73/1324561273.db2.gz	SIKPCHZXUZLNBS-WJMSIXDMSA-N	0	3	342.442	3.041	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CC[C@@H]2CN(C(=O)C3CCCC3)C[C@H]12	ZINC001026168639	1324637197	/nfs/dbraw/zinc/63/71/97/1324637197.db2.gz	IMBFOVKABVGDHS-HSALFYBXSA-N	0	3	337.467	3.075	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CC[C@@H]2CN(C(=O)CC3CCC3)C[C@H]12	ZINC001026229727	1324673150	/nfs/dbraw/zinc/67/31/50/1324673150.db2.gz	QAAYFNZJWZAQIG-HSALFYBXSA-N	0	3	337.467	3.075	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H]2CC[C@H](NCc3ccn(C(C)C)n3)[C@@H]2C1	ZINC001026329591	1324730331	/nfs/dbraw/zinc/73/03/31/1324730331.db2.gz	ZIEVNRPPGJRMNV-JQHSSLGASA-N	0	3	344.503	3.003	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H]2CC[C@H](NCc3csc(C)n3)[C@H]2C1	ZINC001026330844	1324730918	/nfs/dbraw/zinc/73/09/18/1324730918.db2.gz	LZGQLIASCILLKF-XIRDDKMYSA-N	0	3	347.528	3.380	20	30		EGEDHN
Cc1cocc1C(=O)N1C[C@@H]2CC[C@H](NCc3ccccc3C#N)[C@H]2C1	ZINC001026331165	1324731326	/nfs/dbraw/zinc/73/13/26/1324731326.db2.gz	QAYNXIUYHMUCNY-BJLQDIEVSA-N	0	3	349.434	3.100	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC1CCC(NC(=O)c2ccoc2)CC1	ZINC001026453791	1324817663	/nfs/dbraw/zinc/81/76/63/1324817663.db2.gz	JWJSIOAGNLGRAG-UHFFFAOYSA-N	0	3	341.386	3.121	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)NC1CCC(NCc2ccccc2C#N)CC1	ZINC001026479888	1324837568	/nfs/dbraw/zinc/83/75/68/1324837568.db2.gz	QUEXRITYYZTXHN-ABHNRTSZSA-N	0	3	325.456	3.121	20	30		EGEDHN
Cc1ccsc1C(=O)N1CC[C@@H](CNCc2ccccc2C#N)C1	ZINC001026649231	1324948397	/nfs/dbraw/zinc/94/83/97/1324948397.db2.gz	MCBIZFCCRYWLEC-HNNXBMFYSA-N	0	3	339.464	3.180	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCN(C(=O)C2CCCCC2)C1	ZINC001026653938	1324953439	/nfs/dbraw/zinc/95/34/39/1324953439.db2.gz	VCUFFGRTWQYLQR-MRXNPFEDSA-N	0	3	325.456	3.077	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC[C@@H](CNCc2c(Cl)cccc2Cl)C1	ZINC001026728329	1324994034	/nfs/dbraw/zinc/99/40/34/1324994034.db2.gz	FWODYRSHTQLEDI-RYUDHWBXSA-N	0	3	340.254	3.091	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](CNCc3nc4ccccc4o3)C2)C1	ZINC001027050682	1325188673	/nfs/dbraw/zinc/18/86/73/1325188673.db2.gz	IBLCIUNNVYRWJV-HNNXBMFYSA-N	0	3	339.439	3.122	20	30		EGEDHN
CCC1(C(=O)N2CC[C@H](CNCc3ccccc3C#N)C2)CCCC1	ZINC001027149908	1325254107	/nfs/dbraw/zinc/25/41/07/1325254107.db2.gz	NBGVCFSSKPLWEL-QGZVFWFLSA-N	0	3	339.483	3.467	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@H](CNCc2ccccc2C#N)C1)C1CCCC1	ZINC001027163690	1325265059	/nfs/dbraw/zinc/26/50/59/1325265059.db2.gz	IDPXDTFLOQTHHD-DLBZAZTESA-N	0	3	339.483	3.323	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)CC(C)(C)C)C1	ZINC001027302748	1325445423	/nfs/dbraw/zinc/44/54/23/1325445423.db2.gz	KTPHXYFWYVWENP-SFHVURJKSA-N	0	3	327.472	3.417	20	30		EGEDHN
Cc1ccccc1C[C@H](C)C(=O)C(C#N)C(=O)NC1CCCCC1	ZINC000860468028	1329320929	/nfs/dbraw/zinc/32/09/29/1329320929.db2.gz	HWZWGKYEHMQJPC-MAUKXSAKSA-N	0	3	326.440	3.331	20	30		EGEDHN
Cc1ccc(CO[C@H](C)C(=O)C(C#N)C(=O)Nc2ccccc2)cc1	ZINC000860468689	1329321007	/nfs/dbraw/zinc/32/10/07/1329321007.db2.gz	FMCUNCJORJESIS-CRAIPNDOSA-N	0	3	336.391	3.248	20	30		EGEDHN
C[C@@H](CC(C)(C)C#N)N[C@@H]1CC(=O)N(C)[C@H]1c1ccc(F)c(F)c1	ZINC000926879903	1327753867	/nfs/dbraw/zinc/75/38/67/1327753867.db2.gz	YJAVDNNRPQDEPO-CXMBCZLWSA-N	0	3	335.398	3.155	20	30		EGEDHN
CN(Cc1ccc(C#N)c(F)c1)[C@H]1CCCN(C(=O)C2(C)CCC2)C1	ZINC001027528904	1327809814	/nfs/dbraw/zinc/80/98/14/1327809814.db2.gz	CZDHQWUYUPJZQB-KRWDZBQOSA-N	0	3	343.446	3.310	20	30		EGEDHN
CC(C)[C@H](F)C(=O)N1CCC[C@H](N(C)Cc2ccc(F)c(C#N)c2)C1	ZINC001027532917	1327818704	/nfs/dbraw/zinc/81/87/04/1327818704.db2.gz	FNSYSUQAXNSVCD-WMZOPIPTSA-N	0	3	349.425	3.114	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@H](N(C)Cc3ccc(C#N)cc3)C2)CC1	ZINC001027562885	1327881633	/nfs/dbraw/zinc/88/16/33/1327881633.db2.gz	YHBSNWJXXSXOQR-SFHVURJKSA-N	0	3	325.456	3.171	20	30		EGEDHN
CC(C)C1(C(=O)N2CCC[C@@H](N(C)Cc3cccc(C#N)c3)C2)CC1	ZINC001027567154	1327896270	/nfs/dbraw/zinc/89/62/70/1327896270.db2.gz	RIRUSKCGRUYLAQ-LJQANCHMSA-N	0	3	339.483	3.417	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)cc2)C1)C(C)(F)F	ZINC001027580578	1327917119	/nfs/dbraw/zinc/91/71/19/1327917119.db2.gz	XVCAQQUOEBIQAI-RHSMWYFYSA-N	0	3	349.425	3.272	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)cc2)C1)C(C)(F)F	ZINC001027580580	1327917188	/nfs/dbraw/zinc/91/71/88/1327917188.db2.gz	XVCAQQUOEBIQAI-YOEHRIQHSA-N	0	3	349.425	3.272	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)c2ccccc2O[C@@H](C)CC)C1	ZINC001027596648	1327948702	/nfs/dbraw/zinc/94/87/02/1327948702.db2.gz	XZOTYALHCWETDE-DLBZAZTESA-N	0	3	328.456	3.034	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)[C@@H](C)Cc2ccccc2Cl)C1	ZINC001027598785	1327949786	/nfs/dbraw/zinc/94/97/86/1327949786.db2.gz	USGJSWFZVVOJGZ-DOTOQJQBSA-N	0	3	332.875	3.075	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)c2ccc(Cl)c3occc32)C1	ZINC001027646391	1328024304	/nfs/dbraw/zinc/02/43/04/1328024304.db2.gz	VFNBPFDVQWNHQE-CYBMUJFWSA-N	0	3	330.815	3.256	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC001027885030	1328351894	/nfs/dbraw/zinc/35/18/94/1328351894.db2.gz	WQKZPGRCIOJOMB-XJCPWDRGSA-N	0	3	344.421	3.368	20	30		EGEDHN
C#CCCN1CCC[C@@H]1CNC(=O)c1oc2c(cccc2F)c1C	ZINC001027932499	1328411183	/nfs/dbraw/zinc/41/11/83/1328411183.db2.gz	DJGGQFRIYAHYIS-CQSZACIVSA-N	0	3	328.387	3.098	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)[C@H](C)N[C@H](C)COCC1CCCCC1	ZINC000932426811	1329813954	/nfs/dbraw/zinc/81/39/54/1329813954.db2.gz	NGNGVWONGQNPLJ-JTDSTZFVSA-N	0	3	337.508	3.004	20	30		EGEDHN
COC(=O)C[C@H](NCc1cc(Cl)ccc1OCC#N)C(C)(C)C	ZINC000934030230	1329941660	/nfs/dbraw/zinc/94/16/60/1329941660.db2.gz	DEOQLBDQWPJCJR-HNNXBMFYSA-N	0	3	338.835	3.310	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2coc3cc(F)ccc23)[C@@H](C)C1	ZINC000942203920	1331877214	/nfs/dbraw/zinc/87/72/14/1331877214.db2.gz	LOENZKNGRDWEJN-SUMWQHHRSA-N	0	3	328.387	3.035	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)n(C(CC)CC)n2)[C@@H](C)C1	ZINC000942209288	1331879998	/nfs/dbraw/zinc/87/99/98/1331879998.db2.gz	UZDKWLSKAQZRNU-YJBOKZPZSA-N	0	3	344.503	3.016	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2scnc2C2CCCC2)[C@@H](C)C1	ZINC000942301225	1331897933	/nfs/dbraw/zinc/89/79/33/1331897933.db2.gz	CLLFJVMONAAFHA-HOCLYGCPSA-N	0	3	345.512	3.264	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3cccc(F)c3)CCC2)[C@H](C)C1	ZINC000942546832	1331968327	/nfs/dbraw/zinc/96/83/27/1331968327.db2.gz	BGOYOPRFNJCLOQ-APWZRJJASA-N	0	3	342.458	3.097	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(Cc3cccnc3C)C[C@@H]2C)cc1	ZINC000942554161	1331970341	/nfs/dbraw/zinc/97/03/41/1331970341.db2.gz	ZLIITQWVFOLPFU-HRAATJIYSA-N	0	3	347.462	3.012	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3ccc(C)nc3C)C[C@@H]2C)C1	ZINC000942603435	1332001116	/nfs/dbraw/zinc/00/11/16/1332001116.db2.gz	XNOGVLUSORTOGE-HNAYVOBHSA-N	0	3	341.499	3.381	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3cc(F)ccc3o2)[C@H](C)C1	ZINC000943286778	1332138188	/nfs/dbraw/zinc/13/81/88/1332138188.db2.gz	GBSGBYSEUCUTMN-CZUORRHYSA-N	0	3	328.387	3.035	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc(C(F)F)cc2F)[C@@H](C)C1	ZINC000943756167	1332254979	/nfs/dbraw/zinc/25/49/79/1332254979.db2.gz	MCGVFLXURWEFLL-NHYWBVRUSA-N	0	3	326.362	3.390	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2sc(CC3CC3)nc2C)[C@H](C)C1	ZINC000943771124	1332260872	/nfs/dbraw/zinc/26/08/72/1332260872.db2.gz	FDZJBYHVAQREHU-DOMZBBRYSA-N	0	3	333.501	3.030	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccccc2C(F)(F)F)[C@@H](C)C1	ZINC000944266205	1332357941	/nfs/dbraw/zinc/35/79/41/1332357941.db2.gz	XRGXWWCEDBFCGB-BBRMVZONSA-N	0	3	338.373	3.169	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccsc2C(F)F)[C@@H](C)C1	ZINC000944535780	1332416228	/nfs/dbraw/zinc/41/62/28/1332416228.db2.gz	ZBMJFEDGLSGAKW-AAEUAGOBSA-N	0	3	326.412	3.149	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)nc3ccccc32)[C@@H](C)C1	ZINC000944619945	1332419397	/nfs/dbraw/zinc/41/93/97/1332419397.db2.gz	PWWVJVVCHSNVOV-KXBFYZLASA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3ccccc3n2CC)[C@H](C)C1	ZINC000945088041	1332496339	/nfs/dbraw/zinc/49/63/39/1332496339.db2.gz	ADROQLKDTVEQCJ-AEFFLSMTSA-N	0	3	337.467	3.125	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccc(C(F)(F)F)s2)[C@H](C)C1	ZINC000945365317	1332567384	/nfs/dbraw/zinc/56/73/84/1332567384.db2.gz	JSBULHQHIYGETF-GHMZBOCLSA-N	0	3	332.391	3.393	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3occ4c3CCC4)CC[C@@H]2C1	ZINC000946696821	1332879235	/nfs/dbraw/zinc/87/92/35/1332879235.db2.gz	CWUVYVJNKVCGGL-GASCZTMLSA-N	0	3	348.874	3.305	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2cccs2)CCN1Cc1ccc(C#N)cc1	ZINC000947018625	1332976546	/nfs/dbraw/zinc/97/65/46/1332976546.db2.gz	ZZCMEFJUUWTDPG-RHSMWYFYSA-N	0	3	339.464	3.403	20	30		EGEDHN
Cc1occc1C(=O)N[C@@H]1CCN(Cc2ccc(C#N)cc2)[C@@H](C)C1	ZINC000947032545	1332982535	/nfs/dbraw/zinc/98/25/35/1332982535.db2.gz	PPEKEOZUKKKGKV-KBXCAEBGSA-N	0	3	337.423	3.243	20	30		EGEDHN
Cc1cc(CN2CC[C@@H](NC(=O)c3ccc(C#N)[nH]3)C[C@@H]2C)cs1	ZINC000947217219	1333054819	/nfs/dbraw/zinc/05/48/19/1333054819.db2.gz	LEOIASROIMIPLR-SWLSCSKDSA-N	0	3	342.468	3.039	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2coc3c2cccc3OC)C[C@@H]1C	ZINC000947314049	1333085511	/nfs/dbraw/zinc/08/55/11/1333085511.db2.gz	DLGGPVYWRJLVCQ-UONOGXRCSA-N	0	3	328.412	3.210	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C(F)F)ccc2F)C[C@H]1C	ZINC000947319494	1333087557	/nfs/dbraw/zinc/08/75/57/1333087557.db2.gz	RSMAYDRUTMETGL-OCCSQVGLSA-N	0	3	338.373	3.369	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)C2C=CC=CC=C2)CCN1Cc1cccc(C#N)c1	ZINC000947360573	1333102422	/nfs/dbraw/zinc/10/24/22/1333102422.db2.gz	HBVSQQWTSRCGLD-LAUBAEHRSA-N	0	3	347.462	3.326	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2oc3ccc(F)cc3c2C)C[C@H]1C	ZINC000947390788	1333111813	/nfs/dbraw/zinc/11/18/13/1333111813.db2.gz	ABFYTWJQVIOGCL-CJNGLKHVSA-N	0	3	342.414	3.486	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc3c(C)c(C)[nH]c32)C[C@@H]1C	ZINC000947454170	1333134391	/nfs/dbraw/zinc/13/43/91/1333134391.db2.gz	FSEDOFPBWZGIOS-YOEHRIQHSA-N	0	3	337.467	3.391	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)C2(F)CCCC2)CCN1Cc1ccc(C#N)cc1	ZINC000947464607	1333138759	/nfs/dbraw/zinc/13/87/59/1333138759.db2.gz	WPUFDEKQLCTMOH-QAPCUYQASA-N	0	3	343.446	3.310	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2c(C)c(F)ccc2Cl)C[C@@H]1C	ZINC000947467589	1333139820	/nfs/dbraw/zinc/13/98/20/1333139820.db2.gz	CPHMTJYKBBQLIP-GXTWGEPZSA-N	0	3	336.838	3.394	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2ccc(CCCC)cc2)C[C@@H]1C	ZINC000947509887	1333150482	/nfs/dbraw/zinc/15/04/82/1333150482.db2.gz	HZFDEHKIXZIAPC-FXAWDEMLSA-N	0	3	326.484	3.174	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cnc3ccccc3c2C)C[C@@H]1C	ZINC000947556936	1333171066	/nfs/dbraw/zinc/17/10/66/1333171066.db2.gz	UTXCGFANMOMCBI-RDJZCZTQSA-N	0	3	335.451	3.149	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(-c3cccs3)on2)C[C@@H]1C	ZINC000947584896	1333182796	/nfs/dbraw/zinc/18/27/96/1333182796.db2.gz	OFTVYDBDGVSCRH-QWHCGFSZSA-N	0	3	331.441	3.172	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)C(C)(C)C2CC2)CCN1Cc1ccc(C#N)cc1	ZINC000947635575	1333202397	/nfs/dbraw/zinc/20/23/97/1333202397.db2.gz	VWVRLHBNBZFYFX-HNAYVOBHSA-N	0	3	339.483	3.464	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(CCc3csc(C)n3)[C@H](C)C2)C1	ZINC000947702741	1333232655	/nfs/dbraw/zinc/23/26/55/1333232655.db2.gz	RUNQKZIBOBPMDZ-GDBMZVCRSA-N	0	3	347.528	3.319	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3cccnc3C)[C@H](C)C2)C1	ZINC000947703452	1333233719	/nfs/dbraw/zinc/23/37/19/1333233719.db2.gz	YVODJMNEPVCAJL-CRAIPNDOSA-N	0	3	327.472	3.215	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc(F)c(Cl)c2)C[C@H]1C	ZINC000947747344	1333249188	/nfs/dbraw/zinc/24/91/88/1333249188.db2.gz	WLGBFTWJYWNOHI-UKRRQHHQSA-N	0	3	336.838	3.014	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccccc2OC(C)C)C[C@@H]1C	ZINC000947801884	1333265269	/nfs/dbraw/zinc/26/52/69/1333265269.db2.gz	QFPFSHZTFOHSIH-PKOBYXMFSA-N	0	3	342.483	3.009	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnc3ccc(F)cc3c2)C[C@H]1C	ZINC000947895640	1333296058	/nfs/dbraw/zinc/29/60/58/1333296058.db2.gz	PQVZNNGXVQUSFZ-DYVFJYSZSA-N	0	3	327.403	3.143	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnn(C3CCCCC3)c2)C[C@H]1C	ZINC000947899037	1333297129	/nfs/dbraw/zinc/29/71/29/1333297129.db2.gz	DERGNCQINKYKPJ-WBVHZDCISA-N	0	3	330.476	3.157	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2cccc(OCCC)c2)C[C@H]1C	ZINC000947912949	1333303897	/nfs/dbraw/zinc/30/38/97/1333303897.db2.gz	SVILKUMZHYSHCE-IEBWSBKVSA-N	0	3	342.483	3.010	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(OC(C)C)cc2)C[C@@H]1C	ZINC000948055978	1333357976	/nfs/dbraw/zinc/35/79/76/1333357976.db2.gz	GVJZCHPCVFWUFS-HKUYNNGSSA-N	0	3	342.483	3.009	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3cccc(F)c3o2)C[C@@H]1C	ZINC000948064437	1333360711	/nfs/dbraw/zinc/36/07/11/1333360711.db2.gz	CNWIMVNMIAHVBP-ZFWWWQNUSA-N	0	3	328.387	3.178	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(N(C)C(C)C)cc2)C[C@H]1C	ZINC000948087367	1333371841	/nfs/dbraw/zinc/37/18/41/1333371841.db2.gz	ZQRDUOZBWYJOFC-IEBWSBKVSA-N	0	3	341.499	3.137	20	30		EGEDHN
CN(C(=O)c1ccccn1)[C@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948133289	1333385084	/nfs/dbraw/zinc/38/50/84/1333385084.db2.gz	WLXKOSNGXKBYRO-IBGZPJMESA-N	0	3	348.450	3.080	20	30		EGEDHN
CN(C(=O)C1CC=CC1)[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948263030	1333450096	/nfs/dbraw/zinc/45/00/96/1333450096.db2.gz	XIIYUGMWHFZWLZ-HXUWFJFHSA-N	0	3	337.467	3.337	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2cccc(C(F)F)c2F)CC1	ZINC000948378067	1333501852	/nfs/dbraw/zinc/50/18/52/1333501852.db2.gz	PZDVDWBXHBPWGJ-CYBMUJFWSA-N	0	3	338.373	3.323	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2ccc(C(C)(C)C)cn2)CC1	ZINC000948382259	1333503761	/nfs/dbraw/zinc/50/37/61/1333503761.db2.gz	YKJRHURKDAUSAX-SFHVURJKSA-N	0	3	341.499	3.329	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2cc3c([nH]2)c(F)ccc3C)CC1	ZINC000948566551	1333578805	/nfs/dbraw/zinc/57/88/05/1333578805.db2.gz	PBUFZXSQAOTSDY-OAHLLOKOSA-N	0	3	341.430	3.175	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2ccc(Cl)cc2F)CC1	ZINC000948598574	1333590652	/nfs/dbraw/zinc/59/06/52/1333590652.db2.gz	JIUYUYRYKHHFCS-HNNXBMFYSA-N	0	3	336.838	3.429	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)[C@@H]2CCCCC2(F)F)CC1	ZINC000948648778	1333612179	/nfs/dbraw/zinc/61/21/79/1333612179.db2.gz	WAYPJTODLCUBBM-CVEARBPZSA-N	0	3	326.431	3.148	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2ccc(C)nc2C(C)C)CC1	ZINC000948656359	1333616118	/nfs/dbraw/zinc/61/61/18/1333616118.db2.gz	XKVXVQGMWWRIAK-SFHVURJKSA-N	0	3	341.499	3.463	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2c(F)ccc(F)c2F)CC1	ZINC000948730046	1333650021	/nfs/dbraw/zinc/65/00/21/1333650021.db2.gz	RWYMWFUOLKEEOF-CYBMUJFWSA-N	0	3	338.373	3.054	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)[C@H](C)c2ccc(CC)cc2)CC1	ZINC000948861845	1333713157	/nfs/dbraw/zinc/71/31/57/1333713157.db2.gz	UWPAHMXUPFKKGI-XLIONFOSSA-N	0	3	326.484	3.299	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)C(C)(C)c2ccccc2F)CC1	ZINC000948861627	1333713477	/nfs/dbraw/zinc/71/34/77/1333713477.db2.gz	QKWXKHKRALUSQO-INIZCTEOSA-N	0	3	330.447	3.049	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@H]1CNC(=O)C1CC(OCC)C1	ZINC000948912583	1333730952	/nfs/dbraw/zinc/73/09/52/1333730952.db2.gz	HZVVBIRQBBQAQM-AFMYVXGZSA-N	0	3	342.483	3.093	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@H]1c2ccccc2CCN1C(C)C	ZINC000948923718	1333736022	/nfs/dbraw/zinc/73/60/22/1333736022.db2.gz	RDKVVKPTDCODQU-FQEVSTJZSA-N	0	3	337.467	3.412	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)NC[C@@H]1c2ccccc2CCN1CCCC	ZINC000948959334	1333748707	/nfs/dbraw/zinc/74/87/07/1333748707.db2.gz	VUGDUXQKDVHXSF-AQNXPRMDSA-N	0	3	342.483	3.093	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1CCCCCCC1)CCO2	ZINC000949135282	1333783289	/nfs/dbraw/zinc/78/32/89/1333783289.db2.gz	IOKALXCHAHJPOK-UHFFFAOYSA-N	0	3	334.504	3.226	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@H](C)c1ccccc1)CCO2	ZINC000949239300	1333801295	/nfs/dbraw/zinc/80/12/95/1333801295.db2.gz	JGKWLAFQBUXRIQ-SFHVURJKSA-N	0	3	342.483	3.060	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1cc(CC)c(C)s1)CCO2	ZINC000949241593	1333802067	/nfs/dbraw/zinc/80/20/67/1333802067.db2.gz	GZWWVKLECUDOKV-UHFFFAOYSA-N	0	3	348.512	3.112	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C[C@H]3CC[C@@H](C)C3)CC2)C1	ZINC000949444687	1333848266	/nfs/dbraw/zinc/84/82/66/1333848266.db2.gz	KZVXZPFJEHJPTF-MSOLQXFVSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@]34C[C@H]3CCCC4)CC2)C1	ZINC000949469142	1333856732	/nfs/dbraw/zinc/85/67/32/1333856732.db2.gz	SXDUHLPSFQGGPN-WIYYLYMNSA-N	0	3	346.515	3.226	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@H]3CC[C@@H](C)C3)CC2)C1	ZINC000949486816	1333859674	/nfs/dbraw/zinc/85/96/74/1333859674.db2.gz	IFCJOANKTJMKED-MSOLQXFVSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@H](C)CC3CCCC3)CC2)C1	ZINC000949487346	1333859854	/nfs/dbraw/zinc/85/98/54/1333859854.db2.gz	QZSUGYNTOQTHAI-GOSISDBHSA-N	0	3	348.531	3.472	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2[nH]c3ccccc3c2Cl)C1	ZINC000967231588	1335677639	/nfs/dbraw/zinc/67/76/39/1335677639.db2.gz	QPAUMCFDQNMRJJ-CZUORRHYSA-N	0	3	343.858	3.285	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccc(OC)c(C(C)C)c2)C1	ZINC000967264998	1335681122	/nfs/dbraw/zinc/68/11/22/1335681122.db2.gz	RRXJWWWHWTYJBZ-LPHOPBHVSA-N	0	3	342.483	3.282	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2cn(C)c3ccccc23)C1	ZINC000967272355	1335682168	/nfs/dbraw/zinc/68/21/68/1335682168.db2.gz	BBSYRLISYYKICY-QAPCUYQASA-N	0	3	325.456	3.195	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)Cc2ccc3cnccc3c2)C1	ZINC000967293181	1335692499	/nfs/dbraw/zinc/69/24/99/1335692499.db2.gz	VGBRUUFRHHLBBW-JXFKEZNVSA-N	0	3	337.467	3.180	20	30		EGEDHN
C=C(C)CCN1CC[C@H](C)[C@@H](NC(=O)c2conc2C(F)(F)F)C1	ZINC000967397577	1335726342	/nfs/dbraw/zinc/72/63/42/1335726342.db2.gz	QAKHFNBYXOMITP-AAEUAGOBSA-N	0	3	345.365	3.100	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2cc(C)c(C)cc2Cl)C1	ZINC000967779474	1335815895	/nfs/dbraw/zinc/81/58/95/1335815895.db2.gz	NNEJFABIAMDWSY-UGSOOPFHSA-N	0	3	332.875	3.420	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2ccccc2-n2cccc2)C1	ZINC000968193704	1335869346	/nfs/dbraw/zinc/86/93/46/1335869346.db2.gz	WKQUQLYURKZNON-PKOBYXMFSA-N	0	3	337.467	3.494	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)C2(c3ccccc3F)CC2)C1	ZINC000968498052	1335942385	/nfs/dbraw/zinc/94/23/85/1335942385.db2.gz	VVTDDRGHAWLROR-MAUKXSAKSA-N	0	3	330.447	3.260	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccc(Br)o2)C1	ZINC000968584212	1335973574	/nfs/dbraw/zinc/97/35/74/1335973574.db2.gz	VAOXIOQHZKCUED-VXGBXAGGSA-N	0	3	341.249	3.058	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)CC23CC4CC(CC(C4)C2)C3)C1	ZINC000968584456	1335973823	/nfs/dbraw/zinc/97/38/23/1335973823.db2.gz	XFSVKFGWQRMVKT-GPABEBMESA-N	0	3	342.527	3.443	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccc(COC(C)C)cc2)C1	ZINC000968628533	1335990189	/nfs/dbraw/zinc/99/01/89/1335990189.db2.gz	ZZOHYSKNZXZMRA-PXNSSMCTSA-N	0	3	342.483	3.075	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccc3[nH]c(C)c(C)c3c2)C1	ZINC000968634890	1335991122	/nfs/dbraw/zinc/99/11/22/1335991122.db2.gz	BMUCZZUKFMCQRM-VLIAUNLRSA-N	0	3	337.467	3.248	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)Cc2ccc(OC(C)C)cc2)C1	ZINC000968669566	1336004447	/nfs/dbraw/zinc/00/44/47/1336004447.db2.gz	OYAODTOVXYNZTG-YLJYHZDGSA-N	0	3	344.499	3.419	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cnc(C(C)(C)C)s2)C1	ZINC000968681603	1336008439	/nfs/dbraw/zinc/00/84/39/1336008439.db2.gz	KKRQBQMRUICRFS-KGLIPLIRSA-N	0	3	335.517	3.457	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)C2(c3cccc(C)c3)CC2)C1	ZINC000968682165	1336008585	/nfs/dbraw/zinc/00/85/85/1336008585.db2.gz	OXOTWUDGVIXXAW-HKUYNNGSSA-N	0	3	326.484	3.429	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)Cc2cccc(OCC)c2)C1	ZINC000968684977	1336010425	/nfs/dbraw/zinc/01/04/25/1336010425.db2.gz	LIUHRXDVARMSSL-LPHOPBHVSA-N	0	3	330.472	3.031	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cc(C)c(OC)c(C)c1	ZINC000968869091	1336072820	/nfs/dbraw/zinc/07/28/20/1336072820.db2.gz	IAJZVHVKZOCMDA-GOSISDBHSA-N	0	3	330.472	3.472	20	30		EGEDHN
C#CCCN1CCCCC[C@@H]1CNC(=O)c1cnc(CC2CC2)s1	ZINC000968959545	1336102713	/nfs/dbraw/zinc/10/27/13/1336102713.db2.gz	DECJKGDJQKPYOL-MRXNPFEDSA-N	0	3	345.512	3.093	20	30		EGEDHN
C#CCCN1CCCCC[C@H]1CNC(=O)c1cnc(CC2CC2)s1	ZINC000968959543	1336102755	/nfs/dbraw/zinc/10/27/55/1336102755.db2.gz	DECJKGDJQKPYOL-INIZCTEOSA-N	0	3	345.512	3.093	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)NC[C@H]1CCCCCN1Cc1cccc(C#N)c1	ZINC000968982240	1336108387	/nfs/dbraw/zinc/10/83/87/1336108387.db2.gz	DTZXNMCINVKYNM-ATZDWAIDSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cnc(C)nc1C(C)C	ZINC000969057086	1336131555	/nfs/dbraw/zinc/13/15/55/1336131555.db2.gz	RKRVQPGPWVWZJA-INIZCTEOSA-N	0	3	330.476	3.069	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(C(=O)[C@@H]3CCC=CCCC3)C2)s1	ZINC000969066374	1336136839	/nfs/dbraw/zinc/13/68/39/1336136839.db2.gz	UNIMSPRRVAYZPM-HZPDHXFCSA-N	0	3	343.496	3.447	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1ccc(OCC)cc1	ZINC000969134301	1336156026	/nfs/dbraw/zinc/15/60/26/1336156026.db2.gz	YECMOVATHJTTCJ-GOSISDBHSA-N	0	3	328.456	3.083	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1cncnc1C(C)C	ZINC000969144540	1336161177	/nfs/dbraw/zinc/16/11/77/1336161177.db2.gz	OBKUSRQUVYVXNS-INIZCTEOSA-N	0	3	330.476	3.151	20	30		EGEDHN
Cc1cccc([C@H](C)N2CC([C@H](C)NC(=O)c3ccc(C#N)[nH]3)C2)c1	ZINC000969506014	1336220048	/nfs/dbraw/zinc/22/00/48/1336220048.db2.gz	LDQSBEHFPJIEQB-GJZGRUSLSA-N	0	3	336.439	3.006	20	30		EGEDHN
CC(C)c1[nH]ccc1C(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C1	ZINC000969665523	1336234516	/nfs/dbraw/zinc/23/45/16/1336234516.db2.gz	SJKXGUZXDXTFTA-CYBMUJFWSA-N	0	3	342.468	3.076	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000969676921	1336236204	/nfs/dbraw/zinc/23/62/04/1336236204.db2.gz	JWFRQUMZVAYDIT-NSHDSACASA-N	0	3	326.362	3.390	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](NCc2ccc(OC)c(F)c2)C1	ZINC000969830011	1336251934	/nfs/dbraw/zinc/25/19/34/1336251934.db2.gz	CKDCEONJQCMESP-DNVCBOLYSA-N	0	3	334.435	3.127	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3ccnc(Cl)c3)C2)CC1	ZINC000969830410	1336252024	/nfs/dbraw/zinc/25/20/24/1336252024.db2.gz	LGGAJFNZNZLQCX-MRXNPFEDSA-N	0	3	333.863	3.172	20	30		EGEDHN
C#CCCN1CC([C@@H](C)NC(=O)c2ccccc2CC(C)(C)C)C1	ZINC000969925639	1336261776	/nfs/dbraw/zinc/26/17/76/1336261776.db2.gz	CWRCZQJQUQHMLF-MRXNPFEDSA-N	0	3	326.484	3.349	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@@H](NCc3ccc(C#N)s3)C2)c(C)c1	ZINC000970618333	1336328151	/nfs/dbraw/zinc/32/81/51/1336328151.db2.gz	NZAOZBBEOPOVHO-OAHLLOKOSA-N	0	3	339.464	3.241	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)c2ccc(OC)c(C3CC3)c2)C1	ZINC000970657292	1336330383	/nfs/dbraw/zinc/33/03/83/1336330383.db2.gz	MBJXVLRPWBKDFY-AWEZNQCLSA-N	0	3	328.456	3.199	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2snc(Cl)c2Cl)CC1	ZINC001005452974	1336352849	/nfs/dbraw/zinc/35/28/49/1336352849.db2.gz	DEEYHFHXXXJPDI-UHFFFAOYSA-N	0	3	334.272	3.172	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2conc2C2CCCC2)CC1	ZINC001005499001	1336362216	/nfs/dbraw/zinc/36/22/16/1336362216.db2.gz	ZDJARTWGRMVIIK-UHFFFAOYSA-N	0	3	331.460	3.445	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2c(F)ccc(OC)c2F)CC1	ZINC001006319103	1336488265	/nfs/dbraw/zinc/48/82/65/1336488265.db2.gz	IINFBQDXHNAVHH-UHFFFAOYSA-N	0	3	338.398	3.086	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cnc(CC(C)C)s2)CC1	ZINC001006471642	1336513190	/nfs/dbraw/zinc/51/31/90/1336513190.db2.gz	TZSMDRWOBGHTGS-UHFFFAOYSA-N	0	3	335.517	3.454	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)C[C@H]2CCOc3ccccc32)C1	ZINC001008180447	1336785702	/nfs/dbraw/zinc/78/57/02/1336785702.db2.gz	ZZPBKTGMYPPARU-SJORKVTESA-N	0	3	328.456	3.100	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CCCN([C@H](CC)c3ccccc3)C2)c1	ZINC001008465695	1336863588	/nfs/dbraw/zinc/86/35/88/1336863588.db2.gz	ACJSKWKKVDQHLX-NHCUHLMSSA-N	0	3	347.462	3.408	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CCCN([C@H](C)c3cccc(C)c3)C2)c1	ZINC001008466936	1336864287	/nfs/dbraw/zinc/86/42/87/1336864287.db2.gz	ATCYFILDMALURA-DYESRHJHSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@H]1CCCN(Cc2ccc(C)cc2)C1	ZINC001009351296	1337010027	/nfs/dbraw/zinc/01/00/27/1337010027.db2.gz	HZBCNDXHUKHCNW-QFIPXVFZSA-N	0	3	346.474	3.300	20	30		EGEDHN
C#CCCN1CCC[C@H](NC(=O)CC2C3CC4CC(C3)CC2C4)C1	ZINC001009586476	1337041849	/nfs/dbraw/zinc/04/18/49/1337041849.db2.gz	DGUAJOMPNSPGST-BIKXEMDZSA-N	0	3	328.500	3.053	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cccc(-n3cccc3)c2)CC1	ZINC001016713656	1338699592	/nfs/dbraw/zinc/69/95/92/1338699592.db2.gz	ZJVNZMHDGULHML-HXUWFJFHSA-N	0	3	347.462	3.085	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2c(C)cc(F)cc2C)CC1	ZINC001016766980	1338717432	/nfs/dbraw/zinc/71/74/32/1338717432.db2.gz	PLAGCZIYDOAUBB-QGZVFWFLSA-N	0	3	328.431	3.050	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CC23CCN(Cc2cccnc2)CC3)CC1	ZINC001016802872	1338731853	/nfs/dbraw/zinc/73/18/53/1338731853.db2.gz	JQMZJWTVNHQNGG-IBGZPJMESA-N	0	3	339.483	3.299	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CC23CCN(Cc2scnc2C)CC3)C1	ZINC001016812660	1338735358	/nfs/dbraw/zinc/73/53/58/1338735358.db2.gz	QLZDNTUOBZMHSL-MRXNPFEDSA-N	0	3	345.512	3.279	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@H]3NC(=O)C3CC4(CC4)C3)CC2)c1	ZINC001016821693	1338738797	/nfs/dbraw/zinc/73/87/97/1338738797.db2.gz	UEQWNMZMTFZIPO-LJQANCHMSA-N	0	3	349.478	3.219	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccc3nc(C)ccc3c2)CC1	ZINC001016891442	1338760774	/nfs/dbraw/zinc/76/07/74/1338760774.db2.gz	FXVJAGGORGZIBS-HXUWFJFHSA-N	0	3	347.462	3.151	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2ccc(Cl)c3occc32)CC1	ZINC001016927033	1338772631	/nfs/dbraw/zinc/77/26/31/1338772631.db2.gz	PDNBQKYIYOQQGF-MRXNPFEDSA-N	0	3	342.826	3.304	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2c(C)csc2Cl)CC1	ZINC001016946891	1338780288	/nfs/dbraw/zinc/78/02/88/1338780288.db2.gz	HGGQBFHEUQOQMP-ZDUSSCGKSA-N	0	3	336.888	3.318	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2cc(Cl)cc(Cl)c2)CC1	ZINC001016947020	1338780809	/nfs/dbraw/zinc/78/08/09/1338780809.db2.gz	SMIQDVNIOKXODE-OAHLLOKOSA-N	0	3	337.250	3.211	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(CC(C)C)cc2)CC1	ZINC001016968803	1338787112	/nfs/dbraw/zinc/78/71/12/1338787112.db2.gz	PPRNXOUYSUBBOH-FQEVSTJZSA-N	0	3	338.495	3.493	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)C2CC(c3ccccc3)C2)CC1	ZINC001016997977	1338798587	/nfs/dbraw/zinc/79/85/87/1338798587.db2.gz	OCMBKTFLAWCHFP-MHJFOBGBSA-N	0	3	336.479	3.174	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](CN(C)Cc2c(C)onc2CC)C1	ZINC001017181253	1338925921	/nfs/dbraw/zinc/92/59/21/1338925921.db2.gz	YUJMIOLNURNSPU-INIZCTEOSA-N	0	3	347.503	3.428	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H](CN(C)Cc2ocnc2C)C1	ZINC001017201549	1338945733	/nfs/dbraw/zinc/94/57/33/1338945733.db2.gz	KLTJDPTWLRGWAK-APWZRJJASA-N	0	3	333.476	3.256	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H](CN(C)Cc3ocnc3C)C2)C1	ZINC001017209097	1338956103	/nfs/dbraw/zinc/95/61/03/1338956103.db2.gz	YBMBPUWBGPDHJA-MRXNPFEDSA-N	0	3	331.460	3.010	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)Oc1cccc(F)c1	ZINC001017578775	1339371212	/nfs/dbraw/zinc/37/12/12/1339371212.db2.gz	WBAGNXILMKYWCE-NXHRZFHOSA-N	0	3	346.446	3.234	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cccc2ccc(C)nc21	ZINC001017645654	1339381309	/nfs/dbraw/zinc/38/13/09/1339381309.db2.gz	QSWASGGRIAQFLZ-HDICACEKSA-N	0	3	335.451	3.408	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1CCCCC1(F)F	ZINC001017765321	1339413768	/nfs/dbraw/zinc/41/37/68/1339413768.db2.gz	HNOKCADCGUXKQS-OWCLPIDISA-N	0	3	326.431	3.453	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1[C@@H]2Cc3ccccc3[C@@H]21	ZINC001018038937	1339488439	/nfs/dbraw/zinc/48/84/39/1339488439.db2.gz	UMCPYCHTJPHJAE-LXDWIVHCSA-N	0	3	336.479	3.214	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H]1CCO[C@H](C(C)C)C1	ZINC001018161451	1339519371	/nfs/dbraw/zinc/51/93/71/1339519371.db2.gz	ZHTKANVCUURJMP-ZRNYENFQSA-N	0	3	348.531	3.469	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cn1ccc2ccccc21	ZINC001018284252	1339561761	/nfs/dbraw/zinc/56/17/61/1339561761.db2.gz	YCRAGFZCEXIOCI-KDURUIRLSA-N	0	3	337.467	3.283	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)Cc1ccc(OC)cc1	ZINC001018293964	1339566052	/nfs/dbraw/zinc/56/60/52/1339566052.db2.gz	ZBXXOWAPHJRWEA-QRQLOZEOSA-N	0	3	342.483	3.125	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@H](NCc3ccc(F)c(C#N)c3)C2)s1	ZINC001018432808	1339615377	/nfs/dbraw/zinc/61/53/77/1339615377.db2.gz	URGOLTQZWUFNCK-HNNXBMFYSA-N	0	3	343.427	3.072	20	30		EGEDHN
CC(C(=O)N1CC[C@H](NCc2ccc(C#N)s2)C1)=C1CCCC1	ZINC001018699078	1339705273	/nfs/dbraw/zinc/70/52/73/1339705273.db2.gz	HTQYYTHXKINHPY-HNNXBMFYSA-N	0	3	329.469	3.201	20	30		EGEDHN
C#CCCN1CCC[C@H]1CNC(=O)c1c(Cl)oc2ccccc21	ZINC001028093038	1340421887	/nfs/dbraw/zinc/42/18/87/1340421887.db2.gz	BKVLTCZUESATAF-ZDUSSCGKSA-N	0	3	330.815	3.304	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1ccc(F)c(Cl)c1F	ZINC001028114866	1340436208	/nfs/dbraw/zinc/43/62/08/1340436208.db2.gz	RGNUAWHIWOSHAG-LLVKDONJSA-N	0	3	328.790	3.389	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1ccnc(O[C@@H](C)CC)c1	ZINC001028250055	1340510539	/nfs/dbraw/zinc/51/05/39/1340510539.db2.gz	PKKGBROHEYCHJW-DOTOQJQBSA-N	0	3	331.460	3.029	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCCN2Cc2cc(C)cc(C)c2)cn1	ZINC001028270910	1340524964	/nfs/dbraw/zinc/52/49/64/1340524964.db2.gz	VVKLZUSGNDHKSO-NRFANRHFSA-N	0	3	347.462	3.074	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1cc(F)c(F)cc1Cl	ZINC001028297221	1340545948	/nfs/dbraw/zinc/54/59/48/1340545948.db2.gz	IQHLLWQLSIUUDN-LLVKDONJSA-N	0	3	328.790	3.389	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1cc(F)c(F)cc1Cl	ZINC001028297222	1340546347	/nfs/dbraw/zinc/54/63/47/1340546347.db2.gz	IQHLLWQLSIUUDN-NSHDSACASA-N	0	3	328.790	3.389	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)NC[C@H]1CCN(Cc2ccsc2)C1	ZINC001028855397	1340862342	/nfs/dbraw/zinc/86/23/42/1340862342.db2.gz	BCRIJBMSOHGKCO-NJAFHUGGSA-N	0	3	348.512	3.058	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@@H]2CCN(Cc3cccc(C#N)c3)C2)cc1C	ZINC001028966785	1340895704	/nfs/dbraw/zinc/89/57/04/1340895704.db2.gz	JNVVKZCMMOQGBQ-FQEVSTJZSA-N	0	3	347.462	3.427	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC([C@@H](C)NCc2ccn(CC)n2)CC1	ZINC001029140168	1340940895	/nfs/dbraw/zinc/94/08/95/1340940895.db2.gz	RKDRODVQXLCLJY-UZLBHIALSA-N	0	3	346.519	3.222	20	30		EGEDHN
N#Cc1ccc(C(=O)N2C[C@H]3CC[C@@H](C2)N3CCC2=CCCCC2)[nH]1	ZINC001029275473	1340965861	/nfs/dbraw/zinc/96/58/61/1340965861.db2.gz	FMUAJVYRNJRKLI-HDICACEKSA-N	0	3	338.455	3.066	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2C[C@H]3CC[C@@H](C2)N3CC[C@H](C)F)cc1	ZINC001029364566	1340978106	/nfs/dbraw/zinc/97/81/06/1340978106.db2.gz	DIOJXFJCSILTBQ-RYQLBKOJSA-N	0	3	346.446	3.288	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCN(C(=O)CCC2CC2)C1	ZINC001029683742	1341042164	/nfs/dbraw/zinc/04/21/64/1341042164.db2.gz	FEMRQBKUNSIXPX-OAHLLOKOSA-N	0	3	331.485	3.090	20	30		EGEDHN
C[C@@H](c1cc(F)ccc1F)N(C)C[C@H]1CCN(C(=O)C#CC2CC2)C1	ZINC001029734405	1341058157	/nfs/dbraw/zinc/05/81/57/1341058157.db2.gz	WXJMTPQMVYQRPZ-GOEBONIOSA-N	0	3	346.421	3.220	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](CN(C)Cc2oc(CC)nc2C)C1	ZINC001029800307	1341077150	/nfs/dbraw/zinc/07/71/50/1341077150.db2.gz	OVACWNJZDYCYSF-MRXNPFEDSA-N	0	3	347.503	3.428	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](CN(C)Cc2ccnc(Cl)c2)C1	ZINC001029801127	1341077380	/nfs/dbraw/zinc/07/73/80/1341077380.db2.gz	HKWYDDJYDNAJCP-HNNXBMFYSA-N	0	3	335.879	3.228	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCN(C(=O)C2(CF)CCC2)C1	ZINC001029846618	1341093724	/nfs/dbraw/zinc/09/37/24/1341093724.db2.gz	IVKULAUTSJOGAS-CQSZACIVSA-N	0	3	349.475	3.040	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1F)CC1CCN(C(=O)CC2CC2)CC1	ZINC001029925217	1341122056	/nfs/dbraw/zinc/12/20/56/1341122056.db2.gz	JJIIWFLBUGQWKC-UHFFFAOYSA-N	0	3	343.446	3.168	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC(CN(C)Cc2ccccc2Cl)CC1	ZINC001029946701	1341130882	/nfs/dbraw/zinc/13/08/82/1341130882.db2.gz	TUFAAHUYKXBHPK-AWEZNQCLSA-N	0	3	333.863	3.170	20	30		EGEDHN
CC1CC(C(=O)N2CCC(CN(C)Cc3ccc(C#N)s3)CC2)C1	ZINC001029954243	1341133870	/nfs/dbraw/zinc/13/38/70/1341133870.db2.gz	WTSWWLGHABGVHE-UHFFFAOYSA-N	0	3	345.512	3.336	20	30		EGEDHN
C=CCn1cccc1C(=O)N1C[C@@H]2C[C@H]1CN2CC1CC2(CCC2)C1	ZINC001032447700	1341513687	/nfs/dbraw/zinc/51/36/87/1341513687.db2.gz	UKOQVFXXHGFXMG-ROUUACIJSA-N	0	3	339.483	3.153	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1cccc(C(F)F)c1	ZINC001032516007	1341528271	/nfs/dbraw/zinc/52/82/71/1341528271.db2.gz	AOOFQJWFMJOXPL-IRXDYDNUSA-N	0	3	334.410	3.418	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H](C)Cc1ccccc1F	ZINC001032624719	1341564897	/nfs/dbraw/zinc/56/48/97/1341564897.db2.gz	SUVBTTTUGUIPKI-NJAFHUGGSA-N	0	3	330.447	3.256	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cc(F)cc2cccnc21	ZINC001032662504	1341574619	/nfs/dbraw/zinc/57/46/19/1341574619.db2.gz	QHUPUSPXSWSAQM-IRXDYDNUSA-N	0	3	339.414	3.239	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cccc2oc(C)nc21	ZINC001032809488	1341622316	/nfs/dbraw/zinc/62/23/16/1341622316.db2.gz	OQVUDMUMQSBGOF-GJZGRUSLSA-N	0	3	325.412	3.001	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)C[C@@H](C)c1cccc(OC)c1	ZINC001032810229	1341622957	/nfs/dbraw/zinc/62/29/57/1341622957.db2.gz	XHPUOXKIGWRKOO-NJAFHUGGSA-N	0	3	328.456	3.050	20	30		EGEDHN
CN(C(=O)c1cc(C#N)c[nH]1)[C@H]1CCN(Cc2ccc(C3CC3)cc2)C1	ZINC001032984781	1341685685	/nfs/dbraw/zinc/68/56/85/1341685685.db2.gz	DXXMKLWTYUVKHJ-IBGZPJMESA-N	0	3	348.450	3.110	20	30		EGEDHN
CN(C(=O)c1c[nH]c(C#N)c1)[C@@H]1CCN(Cc2ccccc2C2CC2)C1	ZINC001033024360	1341699490	/nfs/dbraw/zinc/69/94/90/1341699490.db2.gz	WPQMKYMUTGGUIS-LJQANCHMSA-N	0	3	348.450	3.110	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2coc3c2cccc3OC)C1	ZINC001033080880	1341718062	/nfs/dbraw/zinc/71/80/62/1341718062.db2.gz	DUFNSYFEHKSKNJ-CQSZACIVSA-N	0	3	328.412	3.164	20	30		EGEDHN
C=CCn1cccc1C(=O)N(C)[C@@H]1CCN(CC2=CCCCC2)C1	ZINC001033146086	1341739885	/nfs/dbraw/zinc/73/98/85/1341739885.db2.gz	MLOGWRFKLRKKKW-GOSISDBHSA-N	0	3	327.472	3.321	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)Cc2ccccc2OC(C)C)C1	ZINC001033504371	1341849863	/nfs/dbraw/zinc/84/98/63/1341849863.db2.gz	HCAPABHXFJYOKR-GOSISDBHSA-N	0	3	330.472	3.125	20	30		EGEDHN
C=C(C)CCN1CC[C@H](N(C)C(=O)c2cc3cccnc3s2)C1	ZINC001033553592	1341869342	/nfs/dbraw/zinc/86/93/42/1341869342.db2.gz	WSBZNJPUXVPASH-HNNXBMFYSA-N	0	3	329.469	3.409	20	30		EGEDHN
C#CCCN1CC[C@H](N(C)C(=O)C(C)(C)c2ccccc2Cl)C1	ZINC001033603855	1341894773	/nfs/dbraw/zinc/89/47/73/1341894773.db2.gz	PGQLDNNGHHCYCJ-HNNXBMFYSA-N	0	3	332.875	3.174	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)[C@@]2(c3ccccc3)C[C@H](F)C2)C1	ZINC001033629865	1341911159	/nfs/dbraw/zinc/91/11/59/1341911159.db2.gz	QYZYPGZETDHZNN-QWFCFKBJSA-N	0	3	330.447	3.165	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@H]2CCN(C)c3ccccc32)C1	ZINC001033861259	1342049754	/nfs/dbraw/zinc/04/97/54/1342049754.db2.gz	FJPJLMDFNRVXRB-MJGOQNOKSA-N	0	3	341.499	3.109	20	30		EGEDHN
C=CCN1CC[C@H](N(CC)C(=O)c2cn(CC)c3ccccc23)C1	ZINC001033891220	1342064729	/nfs/dbraw/zinc/06/47/29/1342064729.db2.gz	ZKXNEOKDSIUIRX-INIZCTEOSA-N	0	3	325.456	3.384	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccc(F)c3ccncc23)C1	ZINC001033932300	1342095974	/nfs/dbraw/zinc/09/59/74/1342095974.db2.gz	KWOHZLDJQTVECQ-OAHLLOKOSA-N	0	3	341.430	3.486	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)[C@@H]2C[C@H]2c2ccc(C)c(C)c2)C1	ZINC001033984011	1342129376	/nfs/dbraw/zinc/12/93/76/1342129376.db2.gz	HOKZVPAANTUXMR-QHAWAJNXSA-N	0	3	338.495	3.353	20	30		EGEDHN
C=CCCN1CC[C@H](N(CC)C(=O)c2cc3cccnc3s2)C1	ZINC001034007678	1342144472	/nfs/dbraw/zinc/14/44/72/1342144472.db2.gz	REHRYLAZKQWJPY-HNNXBMFYSA-N	0	3	329.469	3.409	20	30		EGEDHN
C#Cc1ccc(C(=O)N(CC)[C@@H]2CCN(Cc3cccc(C)c3)C2)nc1	ZINC001034012744	1342149840	/nfs/dbraw/zinc/14/98/40/1342149840.db2.gz	JAYAPICYKGKNAT-HXUWFJFHSA-N	0	3	347.462	3.108	20	30		EGEDHN
C=CCCN1C[C@@H]2CCN(C(=O)c3snc(Cl)c3Cl)[C@@H]2C1	ZINC001075834049	1356431694	/nfs/dbraw/zinc/43/16/94/1356431694.db2.gz	MRKOBWBXCGYHSD-VHSXEESVSA-N	0	3	346.283	3.172	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2ccc(OC(C)C)cc2)C1	ZINC001034035385	1342175141	/nfs/dbraw/zinc/17/51/41/1342175141.db2.gz	KNLVLHLIOUFKLK-SFHVURJKSA-N	0	3	328.456	3.034	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@@H]2Cc3ccc(Cl)cc32)C1	ZINC001034037854	1342176775	/nfs/dbraw/zinc/17/67/75/1342176775.db2.gz	SGTYDNHVIWCHMU-SJLPKXTDSA-N	0	3	332.875	3.479	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@@H]2Cc3c2cccc3Cl)C1	ZINC001034051630	1342193532	/nfs/dbraw/zinc/19/35/32/1342193532.db2.gz	XQORKNQHWACBBQ-RHSMWYFYSA-N	0	3	332.875	3.479	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ncc(Cl)cc3Cl)[C@@H]2C1	ZINC001076398966	1356569572	/nfs/dbraw/zinc/56/95/72/1356569572.db2.gz	POMFMRKLBKQCAJ-SMDDNHRTSA-N	0	3	340.254	3.111	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)[C@@H]2CC[C@H](c3ccccc3)O2)C1	ZINC001034209128	1342319187	/nfs/dbraw/zinc/31/91/87/1342319187.db2.gz	HNGJQWLTDYCHRB-OTWHNJEPSA-N	0	3	328.456	3.063	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cn(-c3ccccc3)cn2)C1	ZINC001034218248	1342323773	/nfs/dbraw/zinc/32/37/73/1342323773.db2.gz	XZVRMVDBWHFGSF-QGZVFWFLSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=C(C)CCN1CCCC[C@H](NC(=O)c2nc3cccnc3s2)C1	ZINC001034251540	1342348206	/nfs/dbraw/zinc/34/82/06/1342348206.db2.gz	USEWPUVXNKJBSN-AWEZNQCLSA-N	0	3	344.484	3.242	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)C2(c3cccnc3)CCCC2)C1	ZINC001034365133	1342435368	/nfs/dbraw/zinc/43/53/68/1342435368.db2.gz	PNRJCZWCEMMVIF-LJQANCHMSA-N	0	3	341.499	3.440	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCCN(Cc3ccc(CO)cc3)C2)C1	ZINC001034390050	1342459286	/nfs/dbraw/zinc/45/92/86/1342459286.db2.gz	WZPCSLQZKPWRLX-LJQANCHMSA-N	0	3	342.483	3.006	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CCCCN(Cc3cccc(C)c3)C2)c1	ZINC001034393462	1342462282	/nfs/dbraw/zinc/46/22/82/1342462282.db2.gz	TVZDHEICZSRQNM-NRFANRHFSA-N	0	3	347.462	3.156	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc(C3CC3)nc2C)C1	ZINC001034407940	1342470778	/nfs/dbraw/zinc/47/07/78/1342470778.db2.gz	WUHPBJBGUZVGKE-QGZVFWFLSA-N	0	3	327.472	3.428	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc(C)nc2OCCC)C1	ZINC001034464834	1342519528	/nfs/dbraw/zinc/51/95/28/1342519528.db2.gz	BQNOEFUOQVUGJR-KRWDZBQOSA-N	0	3	345.487	3.339	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccncc2C(F)(F)F)C1	ZINC001034467342	1342522251	/nfs/dbraw/zinc/52/22/51/1342522251.db2.gz	JHABOGFCGKZQFK-CYBMUJFWSA-N	0	3	341.377	3.261	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2c(F)cccc2F)C12CCC2	ZINC001078791318	1357085480	/nfs/dbraw/zinc/08/54/80/1357085480.db2.gz	HTDIHJLUPDZBHZ-KGLIPLIRSA-N	0	3	340.801	3.348	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2ccsc2C(F)F)C1	ZINC001034506371	1342564633	/nfs/dbraw/zinc/56/46/33/1342564633.db2.gz	OYTJYEFKXRCXJJ-GFCCVEGCSA-N	0	3	326.412	3.293	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)Cc2ccc3c(c2)CCCC3)C1	ZINC001034519771	1342578651	/nfs/dbraw/zinc/57/86/51/1342578651.db2.gz	LTEDOMFAHIWBOI-HXUWFJFHSA-N	0	3	326.484	3.265	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)Cc2c(C)oc3ccccc32)C1	ZINC001034566026	1342619803	/nfs/dbraw/zinc/61/98/03/1342619803.db2.gz	UIEIFFFSMLAEND-MRXNPFEDSA-N	0	3	326.440	3.440	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)c2ccc(C)o2)CC1	ZINC001034587311	1342633069	/nfs/dbraw/zinc/63/30/69/1342633069.db2.gz	DEAGTVDZENZDIY-JOCQHMNTSA-N	0	3	341.249	3.127	20	30		EGEDHN
CC1CC(C(=O)N[C@H]2CC[C@H](NCc3ccccc3C#N)CC2)C1	ZINC001034624646	1342657321	/nfs/dbraw/zinc/65/73/21/1342657321.db2.gz	MHHOAFNGVGYFMV-TZGDQUKYSA-N	0	3	325.456	3.121	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)c2coc(C)c2)CC1	ZINC001034632939	1342662739	/nfs/dbraw/zinc/66/27/39/1342662739.db2.gz	MPULZLBWNNZJAQ-HDJSIYSDSA-N	0	3	341.249	3.127	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)[C@@H]2CC[C@@H](C)C2)CC1	ZINC001034750109	1342737434	/nfs/dbraw/zinc/73/74/34/1342737434.db2.gz	YDLHKDSVDIZZME-NMFUWQPSSA-N	0	3	343.309	3.348	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)[C@@H]2CC=CCC2)c(F)c1	ZINC001034858702	1342808651	/nfs/dbraw/zinc/80/86/51/1342808651.db2.gz	KEVGMXUEMOARSN-SJLPKXTDSA-N	0	3	341.430	3.134	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)cc1F)C1CCC1	ZINC001034973971	1342860746	/nfs/dbraw/zinc/86/07/46/1342860746.db2.gz	NYPFYLYDBZSFAJ-KBXCAEBGSA-N	0	3	343.446	3.214	20	30		EGEDHN
CCC(C)(C)C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001035033503	1342887951	/nfs/dbraw/zinc/88/79/51/1342887951.db2.gz	RSEOIFOUAVKYSS-MRXNPFEDSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H]1CNCc1c(C)onc1CC	ZINC001035035657	1342889745	/nfs/dbraw/zinc/88/97/45/1342889745.db2.gz	PEIUAHHIPBGPCZ-DNVCBOLYSA-N	0	3	333.476	3.228	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)[C@@H]2C[C@H]2C2CCC2)s1	ZINC001035075504	1342914520	/nfs/dbraw/zinc/91/45/20/1342914520.db2.gz	ZHNZCOOZBVXMKL-FHLIZLRMSA-N	0	3	343.496	3.137	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)C(C2CC2)C2CC2)s1	ZINC001035096721	1342924551	/nfs/dbraw/zinc/92/45/51/1342924551.db2.gz	FTVUJRRWUMCJHV-OAHLLOKOSA-N	0	3	343.496	3.137	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC2(CCN(Cc3ccccc3C#N)C2)CC1	ZINC001035159262	1342976171	/nfs/dbraw/zinc/97/61/71/1342976171.db2.gz	CUJJTJORIGQNDS-QGZVFWFLSA-N	0	3	339.483	3.419	20	30		EGEDHN
CC1(C(=O)N2CCC3(CCN(CC#Cc4ccccc4)C3)CC2)CC1	ZINC001035192538	1343006949	/nfs/dbraw/zinc/00/69/49/1343006949.db2.gz	VKEJRKBWBLPWIX-UHFFFAOYSA-N	0	3	336.479	3.153	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC2(CN(Cc3ccc4c(c3)CCC4)C2)CC1	ZINC001035701070	1343142368	/nfs/dbraw/zinc/14/23/68/1343142368.db2.gz	NJMFQZPDAWQEKI-UHFFFAOYSA-N	0	3	348.490	3.013	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C(C)(C)[C@@H]1CCCCO1)CC2	ZINC001035710429	1343146039	/nfs/dbraw/zinc/14/60/39/1343146039.db2.gz	XPZUSFKBJGPJLJ-KRWDZBQOSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C(C)(C)c1cc(C)ccn1)CC2	ZINC001035733047	1343158828	/nfs/dbraw/zinc/15/88/28/1343158828.db2.gz	NADUCSMLUQACEH-UHFFFAOYSA-N	0	3	341.499	3.168	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cccc3c(C)c(C)[nH]c31)CC2	ZINC001035735646	1343161080	/nfs/dbraw/zinc/16/10/80/1343161080.db2.gz	FCCAKNBYGBMYFF-UHFFFAOYSA-N	0	3	349.478	3.346	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cnc(CC3CC3)s1)CC2	ZINC001035759379	1343174542	/nfs/dbraw/zinc/17/45/42/1343174542.db2.gz	DAFVBPXIDGETFC-UHFFFAOYSA-N	0	3	345.512	3.210	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@H]1CCCc3cccnc31)CC2	ZINC001035772516	1343184439	/nfs/dbraw/zinc/18/44/39/1343184439.db2.gz	DPFWHWAVLQDFOF-SFHVURJKSA-N	0	3	339.483	3.002	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@@H](C)OC1CCCCCC1)CC2	ZINC001035790864	1343201796	/nfs/dbraw/zinc/20/17/96/1343201796.db2.gz	WHGBIWBHOIULTK-GOSISDBHSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1noc3c1CCCCC3)CC2	ZINC001035809218	1343209254	/nfs/dbraw/zinc/20/92/54/1343209254.db2.gz	MFISTSCHZHFKGB-UHFFFAOYSA-N	0	3	343.471	3.058	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H](C)Oc1cccc(C)c1)CC2	ZINC001035846995	1343227639	/nfs/dbraw/zinc/22/76/39/1343227639.db2.gz	DMIHLHFWRAIVQK-GOSISDBHSA-N	0	3	342.483	3.263	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cc3cccc(C)c3o1)CC2	ZINC001035858001	1343234667	/nfs/dbraw/zinc/23/46/67/1343234667.db2.gz	BQSFSCMGSBWKHA-UHFFFAOYSA-N	0	3	336.435	3.303	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)CC1CCC(OC)CC1)CC2	ZINC001035863974	1343238352	/nfs/dbraw/zinc/23/83/52/1343238352.db2.gz	OEKQKJYRYGGNEN-UHFFFAOYSA-N	0	3	334.504	3.082	20	30		EGEDHN
C[C@H]1CN(C(=O)c2cccs2)CC[C@H]1NCc1ccccc1C#N	ZINC001035901589	1343258985	/nfs/dbraw/zinc/25/89/85/1343258985.db2.gz	KBAZOXFCINUMPA-WMLDXEAASA-N	0	3	339.464	3.260	20	30		EGEDHN
Cc1ccoc1C(=O)N1CC[C@H](NCc2ccccc2C#N)[C@@H](C)C1	ZINC001035924526	1343275217	/nfs/dbraw/zinc/27/52/17/1343275217.db2.gz	SHRIULCONHRWFW-YJBOKZPZSA-N	0	3	337.423	3.100	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](NCc2nc3ccccc3o2)[C@H](C)C1	ZINC001036145255	1343327683	/nfs/dbraw/zinc/32/76/83/1343327683.db2.gz	XZOPMAHJBNICQV-HUUCEWRRSA-N	0	3	341.455	3.367	20	30		EGEDHN
CC(C)C1(C(=O)N2CC[C@@H](NCc3ccccc3C#N)[C@H](C)C2)CC1	ZINC001036169044	1343341848	/nfs/dbraw/zinc/34/18/48/1343341848.db2.gz	KSUTWWHPSSKNGO-VQIMIIECSA-N	0	3	339.483	3.321	20	30		EGEDHN
CCC1(C(=O)N2CC[C@H](NCc3ccccc3C#N)[C@@H](C)C2)CC1	ZINC001036189376	1343353998	/nfs/dbraw/zinc/35/39/98/1343353998.db2.gz	YHQUHDUGURUBCR-YJBOKZPZSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCCN(C(=O)C2(C)CCC2)C1	ZINC001036428000	1343480687	/nfs/dbraw/zinc/48/06/87/1343480687.db2.gz	OSTCJJNAJHSJFQ-APWZRJJASA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)c2ccco2)[C@H]1CNCc1ccc(C#N)s1	ZINC001036490274	1343513254	/nfs/dbraw/zinc/51/32/54/1343513254.db2.gz	FKBVQACSEYDUGD-CJNGLKHVSA-N	0	3	343.452	3.243	20	30		EGEDHN
CC(C)(C)CC(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001036640337	1343594905	/nfs/dbraw/zinc/59/49/05/1343594905.db2.gz	IPLKBTVJBRJTQD-WMLDXEAASA-N	0	3	345.512	3.479	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CN(C(=O)CCC4CC4)CC[C@H]32)s1	ZINC001036670499	1343613531	/nfs/dbraw/zinc/61/35/31/1343613531.db2.gz	VHIZOHPFLDXGOW-CRAIPNDOSA-N	0	3	343.496	3.233	20	30		EGEDHN
CC(C(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccccc2C#N)C1)=C1CCC1	ZINC001036713356	1343646465	/nfs/dbraw/zinc/64/64/65/1343646465.db2.gz	HVLXGYYJKKVFIV-NHCUHLMSSA-N	0	3	349.478	3.481	20	30		EGEDHN
O=C(N1CC[C@@H]2[C@H](CCN2CC#Cc2ccccc2)C1)C1(C2CC2)CC1	ZINC001036745102	1343670027	/nfs/dbraw/zinc/67/00/27/1343670027.db2.gz	SUZNQPXUQOSNCA-TZIWHRDSSA-N	0	3	348.490	3.151	20	30		EGEDHN
CC1(CC(=O)N2CC[C@@H]3[C@H](CCN3Cc3ccc(C#N)s3)C2)CC1	ZINC001036777048	1343706804	/nfs/dbraw/zinc/70/68/04/1343706804.db2.gz	UQIHZNIIJJNLES-RHSMWYFYSA-N	0	3	343.496	3.233	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@H]2CN(C(=O)[C@H]3C[C@H]4C[C@H]4C3)CC[C@H]21	ZINC001036798410	1343732434	/nfs/dbraw/zinc/73/24/34/1343732434.db2.gz	KPWWSCPKPWFRNN-WRTQPQOASA-N	0	3	349.478	3.027	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H]3[C@@H](CCN3Cc3ocnc3C)C2)CC1	ZINC001036811582	1343747343	/nfs/dbraw/zinc/74/73/43/1343747343.db2.gz	SPXYSWDHDVPOFK-ZWKOTPCHSA-N	0	3	343.471	3.152	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@@H]1CCC[C@@H]1NC(=O)C1=CCCC1	ZINC001036981388	1343908476	/nfs/dbraw/zinc/90/84/76/1343908476.db2.gz	WRTWVAIDLHGGIN-LPHOPBHVSA-N	0	3	341.430	3.182	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCC[C@H]2CNCc2ccn(C(C)C)n2)C1	ZINC001037071720	1343965690	/nfs/dbraw/zinc/96/56/90/1343965690.db2.gz	KZVHMCGMEWEDHS-FUHWJXTLSA-N	0	3	344.503	3.195	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](NCc2cscn2)[C@@H](CC)C1	ZINC001037894427	1344165913	/nfs/dbraw/zinc/16/59/13/1344165913.db2.gz	YZMSRPQBTIZCHJ-GOEBONIOSA-N	0	3	335.517	3.462	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](NCc2nccn2CC)[C@H](CC)C1	ZINC001037908365	1344171690	/nfs/dbraw/zinc/17/16/90/1344171690.db2.gz	XKLUVWFKQTUTTQ-SJORKVTESA-N	0	3	346.519	3.222	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](NCc3nccs3)[C@@H](CC)C2)C1	ZINC001037914288	1344174980	/nfs/dbraw/zinc/17/49/80/1344174980.db2.gz	KMQUSRIRNNGQDI-GJZGRUSLSA-N	0	3	333.501	3.216	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1cc2c([nH]1)c(F)ccc2C	ZINC001038425739	1344423363	/nfs/dbraw/zinc/42/33/63/1344423363.db2.gz	OEOZYLNEQZUGQH-CQSZACIVSA-N	0	3	329.419	3.386	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1ccc(F)cc1F	ZINC001038543182	1344476986	/nfs/dbraw/zinc/47/69/86/1344476986.db2.gz	OECZEOMKEPVHLP-HYVNUMGLSA-N	0	3	334.410	3.225	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)NC[C@@H]1CCN1CCC1CCCCCC1	ZINC001038714265	1344550680	/nfs/dbraw/zinc/55/06/80/1344550680.db2.gz	LPDRBHUNEFHVIM-OTWHNJEPSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1ccc2nc(C)sc2c1	ZINC001038880576	1344626316	/nfs/dbraw/zinc/62/63/16/1344626316.db2.gz	HXNWKWMCHNPPRY-HNNXBMFYSA-N	0	3	329.469	3.375	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1cnn(C(C)C)c1C1CC1	ZINC001038898285	1344639503	/nfs/dbraw/zinc/63/95/03/1344639503.db2.gz	YEMUHGHQBJWCHX-MRXNPFEDSA-N	0	3	330.476	3.112	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1c[nH]nc1C1CCCCC1	ZINC001038900708	1344640694	/nfs/dbraw/zinc/64/06/94/1344640694.db2.gz	IORIAUBDTOMTEX-MRXNPFEDSA-N	0	3	330.476	3.228	20	30		EGEDHN
C=CCC[N@H+]1CC[C@H](C2CCN(C(=O)c3ccccc3[O-])CC2)C1	ZINC001039107785	1344778939	/nfs/dbraw/zinc/77/89/39/1344778939.db2.gz	ADQWTJCOVZLJRB-KRWDZBQOSA-N	0	3	328.456	3.142	20	30		EGEDHN
C=CCC[N@@H+]1CC[C@H](C2CCN(C(=O)c3ccccc3[O-])CC2)C1	ZINC001039107785	1344778944	/nfs/dbraw/zinc/77/89/44/1344778944.db2.gz	ADQWTJCOVZLJRB-KRWDZBQOSA-N	0	3	328.456	3.142	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)[C@H](C)n3cccc3)CC2)C1	ZINC001039125110	1344802119	/nfs/dbraw/zinc/80/21/19/1344802119.db2.gz	PELFCKLCAPYSRR-WMZOPIPTSA-N	0	3	349.906	3.362	20	30		EGEDHN
O=C(C1CC1)N1CCCC[C@@H]1[C@@H]1CCN(CC#Cc2ccccc2)C1	ZINC001039184183	1344883207	/nfs/dbraw/zinc/88/32/07/1344883207.db2.gz	ORLXKJHBNVAVCQ-NHCUHLMSSA-N	0	3	336.479	3.151	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2sccc2F)C1	ZINC001039200151	1344910490	/nfs/dbraw/zinc/91/04/90/1344910490.db2.gz	HCPZLRDYBZJGOD-GDBMZVCRSA-N	0	3	334.460	3.227	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cccc3ncccc32)C1	ZINC001039226902	1344945283	/nfs/dbraw/zinc/94/52/83/1344945283.db2.gz	ZRXAGGIISVXPLL-UWJYYQICSA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2occc2CC)C1	ZINC001039227345	1344946285	/nfs/dbraw/zinc/94/62/85/1344946285.db2.gz	CWWCSWMGGTZMIC-QZTJIDSGSA-N	0	3	328.456	3.182	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)Cc2ccc(C)c(C)c2)C1	ZINC001039237056	1344959852	/nfs/dbraw/zinc/95/98/52/1344959852.db2.gz	ATRVSQOSRFMICF-SFTDATJTSA-N	0	3	338.495	3.182	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)CCc2cccs2)C1	ZINC001039238399	1344962227	/nfs/dbraw/zinc/96/22/27/1344962227.db2.gz	IDHICUKFUDBBOO-PKOBYXMFSA-N	0	3	344.524	3.407	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)CCc2ccccc2F)C1	ZINC001039240493	1344965427	/nfs/dbraw/zinc/96/54/27/1344965427.db2.gz	UWQBAQASGHUNGA-UYAOXDASSA-N	0	3	342.458	3.095	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cccc3c2CCC3)C1	ZINC001039241423	1344966949	/nfs/dbraw/zinc/96/69/49/1344966949.db2.gz	AWXXYIYXYZDLIV-NQIIRXRSSA-N	0	3	336.479	3.125	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cnc(CC)s2)C1	ZINC001039241595	1344967342	/nfs/dbraw/zinc/96/73/42/1344967342.db2.gz	DMEUGNMBKIWKFT-HOTGVXAUSA-N	0	3	345.512	3.045	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(OCC)cc2)C1	ZINC001039249826	1344980204	/nfs/dbraw/zinc/98/02/04/1344980204.db2.gz	KDIZIYBTIYWZEY-UYAOXDASSA-N	0	3	340.467	3.035	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccc(CC)c1	ZINC001039396849	1345045131	/nfs/dbraw/zinc/04/51/31/1345045131.db2.gz	JOEAYRBEOFFECH-UXHICEINSA-N	0	3	326.484	3.433	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc2c(ccc(C)c2C)[nH]1	ZINC001039414597	1345056216	/nfs/dbraw/zinc/05/62/16/1345056216.db2.gz	IOCTWLWHGAYLLT-MSOLQXFVSA-N	0	3	349.478	3.487	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1c(C)[nH]c2ccccc21	ZINC001039426747	1345063266	/nfs/dbraw/zinc/06/32/66/1345063266.db2.gz	QBWHKBOFIRQIJK-SJORKVTESA-N	0	3	337.467	3.270	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1CCCC(F)(F)C1	ZINC001039434418	1345066381	/nfs/dbraw/zinc/06/63/81/1345066381.db2.gz	GCJIBXBUUVLWJF-XHSDSOJGSA-N	0	3	326.431	3.453	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(C)cc1Cl	ZINC001039441357	1345067928	/nfs/dbraw/zinc/06/79/28/1345067928.db2.gz	AKSUCRCSYJYJKK-CVEARBPZSA-N	0	3	330.859	3.351	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc(Cl)s1	ZINC001039449070	1345073969	/nfs/dbraw/zinc/07/39/69/1345073969.db2.gz	KIBDCXIQKLUNRW-KGLIPLIRSA-N	0	3	336.888	3.033	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)c1ccc(CC)cc1	ZINC001039452489	1345075487	/nfs/dbraw/zinc/07/54/87/1345075487.db2.gz	YRXINYBGOKQFKQ-UIFIKXQLSA-N	0	3	338.495	3.441	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CCc2ccccc2O1	ZINC001039452408	1345075495	/nfs/dbraw/zinc/07/54/95/1345075495.db2.gz	UVWXGWAHSFMLOI-HBFSDRIKSA-N	0	3	340.467	3.022	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)Oc1cccc(C)c1	ZINC001039467580	1345085425	/nfs/dbraw/zinc/08/54/25/1345085425.db2.gz	QSGPIZQSGHMPDF-QRVBRYPASA-N	0	3	342.483	3.404	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc2cccc(F)c2o1	ZINC001039471964	1345087519	/nfs/dbraw/zinc/08/75/19/1345087519.db2.gz	WDFSVWKVNMXUFN-CVEARBPZSA-N	0	3	340.398	3.274	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2C[C@H]3CCC[C@@H](C2)N3CC2CC2)cc1	ZINC001039695367	1345162568	/nfs/dbraw/zinc/16/25/68/1345162568.db2.gz	DHXBYMNFWRDOAY-KDURUIRLSA-N	0	3	340.467	3.340	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CCC[C@@H](C1)N2C[C@@H]1CCCOC1	ZINC001039896074	1345238882	/nfs/dbraw/zinc/23/88/82/1345238882.db2.gz	DFLUIVRMUALYRM-PNYFIKQUSA-N	0	3	334.504	3.081	20	30		EGEDHN
CCCC(=O)N1CC[C@@]2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001040037421	1345303027	/nfs/dbraw/zinc/30/30/27/1345303027.db2.gz	XZNLLQFAFHIASX-FQEVSTJZSA-N	0	3	325.456	3.173	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@]3(CCN(C(=O)/C=C\C4CC4)C3)C2)cc1	ZINC001040134435	1345346291	/nfs/dbraw/zinc/34/62/91/1345346291.db2.gz	POGLEYFZEXDJDQ-FMFFHWJCSA-N	0	3	349.478	3.339	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@]3(CCN(C(=O)/C=C\C4CC4)C3)C2)c1	ZINC001040134263	1345346365	/nfs/dbraw/zinc/34/63/65/1345346365.db2.gz	ORXCXJUPVMSOSE-RHVSLNNASA-N	0	3	349.478	3.339	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@]3(CCN(C(=O)C=C4CCC4)C3)C2)c1	ZINC001040153053	1345357238	/nfs/dbraw/zinc/35/72/38/1345357238.db2.gz	MDDHPAWIZLSIPP-QFIPXVFZSA-N	0	3	349.478	3.483	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)C[C@@H]3C[C@H]3c3ccccc3)C2)C1	ZINC001040204963	1345374844	/nfs/dbraw/zinc/37/48/44/1345374844.db2.gz	LHJOYTDVWHOSDV-JAXLGGSGSA-N	0	3	336.479	3.128	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@]3(CCN(C(=O)c4cc[nH]c4)C3)C2)cc1	ZINC001040222463	1345381490	/nfs/dbraw/zinc/38/14/90/1345381490.db2.gz	DSVFFCYEXPDYGF-OAQYLSRUSA-N	0	3	348.450	3.015	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cc4c(o3)CCCC4)C2)C1	ZINC001040235678	1345388844	/nfs/dbraw/zinc/38/88/44/1345388844.db2.gz	FONDYXKJHDYYML-FQEVSTJZSA-N	0	3	328.456	3.273	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3conc3C3CCCC3)C2)C1	ZINC001040236713	1345389348	/nfs/dbraw/zinc/38/93/48/1345389348.db2.gz	OTCVKINYUFNPCS-HXUWFJFHSA-N	0	3	343.471	3.446	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cc(F)c(C)cc3F)C2)C1	ZINC001040250707	1345395012	/nfs/dbraw/zinc/39/50/12/1345395012.db2.gz	SSUNHJIFYXAAMQ-LJQANCHMSA-N	0	3	334.410	3.387	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cccc4cccnc43)C2)C1	ZINC001040284204	1345412357	/nfs/dbraw/zinc/41/23/57/1345412357.db2.gz	UIAJSIOYYJFMLQ-NRFANRHFSA-N	0	3	335.451	3.349	20	30		EGEDHN
CC[C@H](F)C(=O)N1CC[C@]2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001040327795	1345434023	/nfs/dbraw/zinc/43/40/23/1345434023.db2.gz	IFDSTDDTQVEXMO-AZUAARDMSA-N	0	3	343.446	3.121	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@]2(C1)CCCN(Cc1cccnc1C)C2	ZINC001040329495	1345435039	/nfs/dbraw/zinc/43/50/39/1345435039.db2.gz	UYQJTDRKISXWJY-NRFANRHFSA-N	0	3	341.499	3.417	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@@H]3CCCC(F)(F)C3)C2)C1	ZINC001040392046	1345472887	/nfs/dbraw/zinc/47/28/87/1345472887.db2.gz	SPZMINLTCXOOBJ-AEFFLSMTSA-N	0	3	338.442	3.150	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cn(CC)nc3C(C)C)C2)C1	ZINC001040422014	1345488393	/nfs/dbraw/zinc/48/83/93/1345488393.db2.gz	JGPFNKZTKASBTH-FQEVSTJZSA-N	0	3	344.503	3.141	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cnc(C(C)C)nc3C)C2)C1	ZINC001040435172	1345497755	/nfs/dbraw/zinc/49/77/55/1345497755.db2.gz	OEZRBSMIKGIAEU-HXUWFJFHSA-N	0	3	342.487	3.023	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@@H](C)c3cc(C)oc3C)C2)C1	ZINC001040451607	1345507501	/nfs/dbraw/zinc/50/75/01/1345507501.db2.gz	GBJJVYZSHZMWKE-LAUBAEHRSA-N	0	3	342.483	3.338	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cccc4ccncc43)C2)C1	ZINC001040477823	1345513663	/nfs/dbraw/zinc/51/36/63/1345513663.db2.gz	IKVILIWLGJPLBK-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3ncoc3C(C)(C)C)C2)C1	ZINC001040489139	1345516431	/nfs/dbraw/zinc/51/64/31/1345516431.db2.gz	NHQPBCDELUSJPR-LJQANCHMSA-N	0	3	331.460	3.086	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@H](C)c3ccc(C)s3)C2)C1	ZINC001040491996	1345517688	/nfs/dbraw/zinc/51/76/88/1345517688.db2.gz	KTDJPZSWUXLXBC-APWZRJJASA-N	0	3	330.497	3.108	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cn(CCCC)nc3C)C2)C1	ZINC001040492987	1345519218	/nfs/dbraw/zinc/51/92/18/1345519218.db2.gz	WPMOIAYFEMSFBE-FQEVSTJZSA-N	0	3	344.503	3.106	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(OCC)cc3)C2)C1	ZINC001040514400	1345528135	/nfs/dbraw/zinc/52/81/35/1345528135.db2.gz	BUHZGFGWSZYSDS-OAQYLSRUSA-N	0	3	340.467	3.037	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3cccc4ccccc43)C2)C1	ZINC001040516582	1345529326	/nfs/dbraw/zinc/52/93/26/1345529326.db2.gz	WCRMRNZSOBUDPM-QFIPXVFZSA-N	0	3	332.447	3.401	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3cc(CC)c(C)s3)C2)C1	ZINC001040522199	1345531530	/nfs/dbraw/zinc/53/15/30/1345531530.db2.gz	KKTWSXXQJMTAFE-LJQANCHMSA-N	0	3	330.497	3.180	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3csc4c3CCCC4)C2)C1	ZINC001040523552	1345532791	/nfs/dbraw/zinc/53/27/91/1345532791.db2.gz	YVLDUSQHOQVOEC-FQEVSTJZSA-N	0	3	342.508	3.188	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@@H](C)Cc3ccc(C)cc3)C2)C1	ZINC001040542872	1345538337	/nfs/dbraw/zinc/53/83/37/1345538337.db2.gz	MKLJXLVJQQDNRO-UGKGYDQZSA-N	0	3	338.495	3.121	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@H](C)n3c(C)ccc3C)C2)C1	ZINC001040543331	1345538491	/nfs/dbraw/zinc/53/84/91/1345538491.db2.gz	OXJICGLPNOFEOW-FPOVZHCZSA-N	0	3	341.499	3.004	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC2(C1)CCN(Cc1ccccc1Cl)CC2	ZINC001040643239	1345558914	/nfs/dbraw/zinc/55/89/14/1345558914.db2.gz	HASJNTZLTGPRLK-OAHLLOKOSA-N	0	3	345.874	3.314	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC2(C1)CCN(Cc1ccccc1F)CC2	ZINC001040696489	1345566614	/nfs/dbraw/zinc/56/66/14/1345566614.db2.gz	AJVZLOLEKDEXFE-UHFFFAOYSA-N	0	3	340.442	3.054	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cc[nH]c3C(C)C)C2)CC1	ZINC001040816494	1345581986	/nfs/dbraw/zinc/58/19/86/1345581986.db2.gz	ZYFYKOWETQBTPM-UHFFFAOYSA-N	0	3	327.472	3.090	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)C3(C4CCCCC4)CC3)C2)CC1	ZINC001040927271	1345603032	/nfs/dbraw/zinc/60/30/32/1345603032.db2.gz	UPMMFWGAUAGKCS-UHFFFAOYSA-N	0	3	328.500	3.295	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cc(C)n(C(C)C)c3C)C2)CC1	ZINC001040930465	1345603326	/nfs/dbraw/zinc/60/33/26/1345603326.db2.gz	OMOJNPZJXKAPFH-UHFFFAOYSA-N	0	3	341.499	3.247	20	30		EGEDHN
CC1CC(C(=O)N2CC[C@@]3(CCN(Cc4ccc(C#N)cc4)C3)C2)C1	ZINC001041198076	1345675153	/nfs/dbraw/zinc/67/51/53/1345675153.db2.gz	JGFPJXVGOVZYMX-VFIGECHUSA-N	0	3	337.467	3.029	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cccc4c3CCCC4)C2)C1	ZINC001041317972	1345700858	/nfs/dbraw/zinc/70/08/58/1345700858.db2.gz	OZMWKBSPRHXYTM-JOCHJYFZSA-N	0	3	336.479	3.127	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@]2(CCN(Cc3cccnc3)C2)C1	ZINC001041322722	1345703124	/nfs/dbraw/zinc/70/31/24/1345703124.db2.gz	WEEGWIWLRMOJKH-IBGZPJMESA-N	0	3	347.890	3.285	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)CC3(c4ccccc4)CC3)C2)C1	ZINC001041345972	1345707175	/nfs/dbraw/zinc/70/71/75/1345707175.db2.gz	QGHMBUHKKHANSS-NRFANRHFSA-N	0	3	336.479	3.056	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cccc4ccc(C)nc43)C2)C1	ZINC001041395745	1345715237	/nfs/dbraw/zinc/71/52/37/1345715237.db2.gz	MZVNVOWIEOPXMG-QFIPXVFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3cc4cccc(C)c4s3)C2)C1	ZINC001041418428	1345723986	/nfs/dbraw/zinc/72/39/86/1345723986.db2.gz	KIUAIKRUMVJKOV-FQEVSTJZSA-N	0	3	338.476	3.381	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)Cc3ccc(CCCC)cc3)C2)C1	ZINC001041447645	1345730085	/nfs/dbraw/zinc/73/00/85/1345730085.db2.gz	BFBCGKAFTXERGZ-QFIPXVFZSA-N	0	3	338.495	3.129	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cc(Cl)ccc3F)C2)C1	ZINC001041454457	1345732462	/nfs/dbraw/zinc/73/24/62/1345732462.db2.gz	LHXVJTQVJNVCEW-SFHVURJKSA-N	0	3	334.822	3.040	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cc(Cl)ccc3F)C2)C1	ZINC001041454455	1345732844	/nfs/dbraw/zinc/73/28/44/1345732844.db2.gz	LHXVJTQVJNVCEW-GOSISDBHSA-N	0	3	334.822	3.040	20	30		EGEDHN
CC1(CC(=O)N2CC[C@]3(CCN(Cc4ccc(C#N)cc4)C3)C2)CC1	ZINC001041488969	1345743801	/nfs/dbraw/zinc/74/38/01/1345743801.db2.gz	ZWBRIVAQQAYNCT-NRFANRHFSA-N	0	3	337.467	3.173	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)Cc3cccc(C4CC4)c3)C2)C1	ZINC001041503849	1345745478	/nfs/dbraw/zinc/74/54/78/1345745478.db2.gz	URBOWEQLKFAQFF-JOCHJYFZSA-N	0	3	336.479	3.054	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3coc4cc(C)c(C)cc43)C2)C1	ZINC001041510589	1345747386	/nfs/dbraw/zinc/74/73/86/1345747386.db2.gz	ZBWCMNLAYURRRT-OAQYLSRUSA-N	0	3	336.435	3.221	20	30		EGEDHN
CC1(C(=O)N2CC[C@]3(CCN(Cc4cccc(C#N)c4)C3)C2)CC=CC1	ZINC001041633084	1345803539	/nfs/dbraw/zinc/80/35/39/1345803539.db2.gz	PHJPAJZFTCAVNU-QFIPXVFZSA-N	0	3	349.478	3.339	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)C[C@@H]3CCc4ccccc43)C2)C1	ZINC001041750289	1345839893	/nfs/dbraw/zinc/83/98/93/1345839893.db2.gz	TVRVFZSRQJWROW-SIKLNZKXSA-N	0	3	336.479	3.054	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3ccc(O[C@H](C)CC)cc3)C2)C1	ZINC001041774107	1345845193	/nfs/dbraw/zinc/84/51/93/1345845193.db2.gz	RLLNLCSUVUQCAZ-UTKZUKDTSA-N	0	3	340.467	3.035	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3cccc(-c4ccoc4)c3)C2)C1	ZINC001041777142	1345846315	/nfs/dbraw/zinc/84/63/15/1345846315.db2.gz	IKULEHPIFVJRAV-OAQYLSRUSA-N	0	3	334.419	3.118	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3ccc(-c4cccs4)o3)C2)C1	ZINC001041811577	1345859015	/nfs/dbraw/zinc/85/90/15/1345859015.db2.gz	CHLUHKATGGGAGG-IBGZPJMESA-N	0	3	340.448	3.179	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cc(CC)c(C)s3)C2)C1	ZINC001041821630	1345863666	/nfs/dbraw/zinc/86/36/66/1345863666.db2.gz	HBFXSAVSPANGRA-LJQANCHMSA-N	0	3	330.497	3.180	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)[C@H](C)c3ccc(F)c(F)c3)C2)C1	ZINC001041838818	1345868162	/nfs/dbraw/zinc/86/81/62/1345868162.db2.gz	CFMSEEFHNQNJMO-FOIQADDNSA-N	0	3	346.421	3.016	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccc(-c4ccccc4)[nH]3)C2)C1	ZINC001041852358	1345874073	/nfs/dbraw/zinc/87/40/73/1345874073.db2.gz	SFYCANLJWUXQMW-JOCHJYFZSA-N	0	3	347.462	3.243	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3cc(-c4ccccc4)co3)C2)C1	ZINC001041860816	1345876213	/nfs/dbraw/zinc/87/62/13/1345876213.db2.gz	JOADEAUBBVUPEW-NRFANRHFSA-N	0	3	334.419	3.118	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3CCN(C(=O)CC4CCC4)C[C@@H]32)cc1	ZINC001041998253	1345917781	/nfs/dbraw/zinc/91/77/81/1345917781.db2.gz	XFHFKUHRUNQFSX-PMACEKPBSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(C4CC4)[nH]c3C3CC3)C[C@H]21	ZINC001042114331	1345947465	/nfs/dbraw/zinc/94/74/65/1345947465.db2.gz	JWNZQMGSEHRWNB-HNAYVOBHSA-N	0	3	339.483	3.492	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cccc(-n4cccc4)c3)C[C@@H]21	ZINC001042139242	1345953921	/nfs/dbraw/zinc/95/39/21/1345953921.db2.gz	VXLUAOOTGHLFDN-RXVVDRJESA-N	0	3	347.462	3.037	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)Cc3cccc(C4CC4)c3)C[C@@H]21	ZINC001042163362	1345961997	/nfs/dbraw/zinc/96/19/97/1345961997.db2.gz	SITYVZRFPVGGJO-FPOVZHCZSA-N	0	3	336.479	3.053	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2CCN(CCC(F)(F)F)[C@H]2C1	ZINC001042183751	1345971248	/nfs/dbraw/zinc/97/12/48/1345971248.db2.gz	MGZGLHJNEVGQEA-KGLIPLIRSA-N	0	3	332.410	3.464	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cc4cc(C)ccc4[nH]3)C[C@H]21	ZINC001042183986	1345972223	/nfs/dbraw/zinc/97/22/23/1345972223.db2.gz	SDFCZLYXTYGEOX-OXQOHEQNSA-N	0	3	335.451	3.036	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C3(c4cccnc4)CCCC3)C[C@@H]21	ZINC001042205239	1345983404	/nfs/dbraw/zinc/98/34/04/1345983404.db2.gz	WNMVBADDTSHUFJ-HKUYNNGSSA-N	0	3	339.483	3.002	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3c(F)cc(F)cc3F)C[C@H]21	ZINC001042207527	1345985332	/nfs/dbraw/zinc/98/53/32/1345985332.db2.gz	PCPLGQILJZPQOD-MLGOLLRUSA-N	0	3	338.373	3.216	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(F)c(Cl)c3F)C[C@@H]21	ZINC001042218850	1345990657	/nfs/dbraw/zinc/99/06/57/1345990657.db2.gz	MICMVMQJAKUXOS-RISCZKNCSA-N	0	3	340.801	3.341	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CCN(C(=O)C4CC5(CC5)C4)C[C@@H]32)cc1	ZINC001042232063	1345998113	/nfs/dbraw/zinc/99/81/13/1345998113.db2.gz	IQYIMNZVCUVOSW-QUCCMNQESA-N	0	3	349.478	3.171	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3ccn(C(CC)CC)n3)C[C@H]21	ZINC001042257218	1346008148	/nfs/dbraw/zinc/00/81/48/1346008148.db2.gz	FHWOAQSIGODZPL-QFBILLFUSA-N	0	3	344.503	3.357	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc(C(F)F)cc3)C[C@H]21	ZINC001042269193	1346013222	/nfs/dbraw/zinc/01/32/22/1346013222.db2.gz	IROSHRUXEIRNPH-WMLDXEAASA-N	0	3	332.394	3.184	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(OC)cc3Cl)C[C@@H]21	ZINC001042272080	1346014301	/nfs/dbraw/zinc/01/43/01/1346014301.db2.gz	LAIFVJNJEUBZIU-GUYCJALGSA-N	0	3	334.847	3.071	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ncoc3-c3cccs3)C[C@@H]21	ZINC001042271979	1346014371	/nfs/dbraw/zinc/01/43/71/1346014371.db2.gz	JKQBNLCGZZESPM-KGLIPLIRSA-N	0	3	343.452	3.126	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3[nH]c4ccc(C)cc4c3C)C[C@H]21	ZINC001042296607	1346020874	/nfs/dbraw/zinc/02/08/74/1346020874.db2.gz	CMIBUZKQNLHSMC-YLJYHZDGSA-N	0	3	349.478	3.344	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc4c(c3)CCC=C4)C[C@@H]21	ZINC001042315756	1346030276	/nfs/dbraw/zinc/03/02/76/1346030276.db2.gz	BZTBERHGSYFQGV-RXVVDRJESA-N	0	3	334.463	3.206	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3cc4nc(C)ccc4o3)C[C@H]21	ZINC001042324537	1346033582	/nfs/dbraw/zinc/03/35/82/1346033582.db2.gz	WESVGJYTSYYOTR-DOTOQJQBSA-N	0	3	339.439	3.249	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(N(CC)CC)cc3)C[C@@H]21	ZINC001042327489	1346036420	/nfs/dbraw/zinc/03/64/20/1346036420.db2.gz	XSFMOMZVYVXNPX-PXNSSMCTSA-N	0	3	341.499	3.255	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3cc4[nH]ccc4s3)C[C@H]21	ZINC001042327337	1346036644	/nfs/dbraw/zinc/03/66/44/1346036644.db2.gz	WGWFWRPOCJDZAZ-DZGCQCFKSA-N	0	3	329.469	3.342	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3occ4c3CCCC4)C[C@@H]21	ZINC001042330825	1346038805	/nfs/dbraw/zinc/03/88/05/1346038805.db2.gz	HFITWJMJIOQXJF-QAPCUYQASA-N	0	3	328.456	3.271	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)COc3ccccc3C(C)C)C[C@@H]21	ZINC001042342009	1346045970	/nfs/dbraw/zinc/04/59/70/1346045970.db2.gz	SFGBNWGKLMWLGK-MJGOQNOKSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(OC)c(Cl)c3)C[C@H]21	ZINC001042349750	1346050079	/nfs/dbraw/zinc/05/00/79/1346050079.db2.gz	TUMRWPFYKGDVTA-XJKSGUPXSA-N	0	3	334.847	3.071	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3sc(C(C)C)nc3C)C[C@@H]21	ZINC001042355209	1346052974	/nfs/dbraw/zinc/05/29/74/1346052974.db2.gz	WVAWNCBKVHTRAR-HOTGVXAUSA-N	0	3	345.512	3.135	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cc(C)c(F)c(C)c3)C[C@H]21	ZINC001042359627	1346054430	/nfs/dbraw/zinc/05/44/30/1346054430.db2.gz	FSMYIVRABJUAAF-FUHWJXTLSA-N	0	3	328.431	3.002	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@@H](NCc2cc(F)ccc2C#N)C[C@H]1C	ZINC001044433953	1346330111	/nfs/dbraw/zinc/33/01/11/1346330111.db2.gz	VPQJRPCYXFMZDR-RDTXWAMCSA-N	0	3	329.419	3.133	20	30		EGEDHN
C[C@H]1C[C@H]([NH2+]Cc2ccccc2C#N)CCN1C(=O)c1ccccc1[O-]	ZINC001044476184	1346343470	/nfs/dbraw/zinc/34/34/70/1346343470.db2.gz	PLCDQBYMJMWRBU-MAUKXSAKSA-N	0	3	349.434	3.047	20	30		EGEDHN
C[C@H]1C[C@H](NCc2cc(F)ccc2C#N)CCN1C(=O)C1CC=CC1	ZINC001044524214	1346356419	/nfs/dbraw/zinc/35/64/19/1346356419.db2.gz	SUQXQXUDCWLLCO-IFXJQAMLSA-N	0	3	341.430	3.133	20	30		EGEDHN
C[C@H]1C[C@@H](NCc2c(F)cccc2Cl)CCN1C(=O)C#CC1CC1	ZINC001044595068	1346378319	/nfs/dbraw/zinc/37/83/19/1346378319.db2.gz	XCZRTFFUTHEEMA-ZFWWWQNUSA-N	0	3	348.849	3.362	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3nccs3)C[C@@H]2C)CC1	ZINC001044730058	1346414399	/nfs/dbraw/zinc/41/43/99/1346414399.db2.gz	MZZWOYHJAKKEPS-GOEBONIOSA-N	0	3	333.501	3.359	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)c2ccsc2)s1	ZINC001044911506	1346461382	/nfs/dbraw/zinc/46/13/82/1346461382.db2.gz	RGWUJAAPVCZGRT-ZDUSSCGKSA-N	0	3	331.466	3.076	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H]1CNCc1cn(C(C)C)nc1C	ZINC001045185437	1346519964	/nfs/dbraw/zinc/51/99/64/1346519964.db2.gz	COBCNFBDDXHXIV-ICSRJNTNSA-N	0	3	346.519	3.455	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)[C@H]2CC23CCCC3)s1	ZINC001045264393	1346543362	/nfs/dbraw/zinc/54/33/62/1346543362.db2.gz	PTVHRJNLGKBCII-WMLDXEAASA-N	0	3	343.496	3.281	20	30		EGEDHN
Cc1ccc(C(=O)NC2(C)CCN(Cc3ccc(C#N)cc3)CC2)o1	ZINC001045360231	1346573244	/nfs/dbraw/zinc/57/32/44/1346573244.db2.gz	UCFOXBRFQASANH-UHFFFAOYSA-N	0	3	337.423	3.244	20	30		EGEDHN
C#Cc1ccc(C(=O)NC2(C)CCN(Cc3ncccc3C)CC2)cc1	ZINC001045520413	1346615903	/nfs/dbraw/zinc/61/59/03/1346615903.db2.gz	BKZWMHAKATUBMU-UHFFFAOYSA-N	0	3	347.462	3.156	20	30		EGEDHN
CC1(NC(=O)[C@@H]2CC[C@@H](F)C2)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045539751	1346623351	/nfs/dbraw/zinc/62/33/51/1346623351.db2.gz	XIVNXLWNONNWDS-QZTJIDSGSA-N	0	3	343.446	3.167	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2ccc(O[C@H](C)CC)cc2)CC1	ZINC001045616510	1346648734	/nfs/dbraw/zinc/64/87/34/1346648734.db2.gz	BEAOASZZLZIIGX-QGZVFWFLSA-N	0	3	342.483	3.472	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)[C@H]2CCCc3sc(C)nc32)CC1	ZINC001045618749	1346649694	/nfs/dbraw/zinc/64/96/94/1346649694.db2.gz	SEPHDJHSDAKIGF-AWEZNQCLSA-N	0	3	333.501	3.028	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC001045626415	1346651443	/nfs/dbraw/zinc/65/14/43/1346651443.db2.gz	FQVNRPFIAMQZSU-UHFFFAOYSA-N	0	3	338.373	3.313	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)[C@@H]2C[C@H]2c2cccc(F)c2F)CC1	ZINC001045644844	1346657361	/nfs/dbraw/zinc/65/73/61/1346657361.db2.gz	NVXHUBNNYZDSGK-LSDHHAIUSA-N	0	3	334.410	3.225	20	30		EGEDHN
CC[C@H](C)C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1cccc(C#N)c1	ZINC001045717335	1346678062	/nfs/dbraw/zinc/67/80/62/1346678062.db2.gz	ICCSYJIJYPKPAQ-IPELMVKDSA-N	0	3	325.456	3.170	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCCC[C@]2(CCN(Cc3cccc(F)c3)C2)C1	ZINC001045920861	1346757950	/nfs/dbraw/zinc/75/79/50/1346757950.db2.gz	BVVIZYZPZCMBHM-OXJNMPFZSA-N	0	3	343.446	3.190	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccoc1CC)C2	ZINC001045935182	1346772180	/nfs/dbraw/zinc/77/21/80/1346772180.db2.gz	JREDSZRNPAJHOF-FQEVSTJZSA-N	0	3	328.456	3.184	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccsc1C)C2	ZINC001045936868	1346773406	/nfs/dbraw/zinc/77/34/06/1346773406.db2.gz	OEGCPLSKUUMUAQ-LJQANCHMSA-N	0	3	330.497	3.398	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@]1(C)CC=CCC1)C2	ZINC001045940096	1346775548	/nfs/dbraw/zinc/77/55/48/1346775548.db2.gz	PZRNRFJBMDRLIN-SFTDATJTSA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H]1CCCC3(CC3)C1)C2	ZINC001045942597	1346778353	/nfs/dbraw/zinc/77/83/53/1346778353.db2.gz	VTUFHPXAZGEIHR-NQIIRXRSSA-N	0	3	328.500	3.295	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1nc(C)sc1C)C2	ZINC001045946260	1346781876	/nfs/dbraw/zinc/78/18/76/1346781876.db2.gz	MUFYBGIFJNUIJY-LJQANCHMSA-N	0	3	345.512	3.101	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc(F)ccc1C)C2	ZINC001045958659	1346793667	/nfs/dbraw/zinc/79/36/67/1346793667.db2.gz	VRGRHINMHXMKCV-NRFANRHFSA-N	0	3	342.458	3.476	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H](C)c1ccsc1)C2	ZINC001045964803	1346799687	/nfs/dbraw/zinc/79/96/87/1346799687.db2.gz	BRYASWOQYLZWAD-QFBILLFUSA-N	0	3	330.497	3.189	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)C1(C(C)(F)F)CC1)C2	ZINC001045967000	1346802438	/nfs/dbraw/zinc/80/24/38/1346802438.db2.gz	KYTOVOSIDWSVCI-GOSISDBHSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cnc3ccccc3c1)C2	ZINC001045968548	1346803083	/nfs/dbraw/zinc/80/30/83/1346803083.db2.gz	CJMCWYOHCHOEAW-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc(C)cc(F)c1)C2	ZINC001045969026	1346804208	/nfs/dbraw/zinc/80/42/08/1346804208.db2.gz	XNHNAGUJRZSUKN-OAQYLSRUSA-N	0	3	342.458	3.476	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@H](F)c1ccccc1)C2	ZINC001045970221	1346805707	/nfs/dbraw/zinc/80/57/07/1346805707.db2.gz	CSNOOIANLKTDGS-TZIWHRDSSA-N	0	3	342.458	3.425	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@H](C)c1cc(C)oc1C)C2	ZINC001045974920	1346810626	/nfs/dbraw/zinc/81/06/26/1346810626.db2.gz	QEMFTOKDFZBBKB-DYESRHJHSA-N	0	3	342.483	3.338	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@H](C)c1ccc(C)s1)C2	ZINC001045978964	1346816089	/nfs/dbraw/zinc/81/60/89/1346816089.db2.gz	LYCNDKXTEYAVPJ-XLIONFOSSA-N	0	3	344.524	3.498	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)C(C)(C)C(C)(F)F)C2	ZINC001045982141	1346821336	/nfs/dbraw/zinc/82/13/36/1346821336.db2.gz	PEHZFXXWJNTFNY-IBGZPJMESA-N	0	3	340.458	3.396	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc(OCC)cc1)C2	ZINC001045983010	1346822208	/nfs/dbraw/zinc/82/22/08/1346822208.db2.gz	HTTOJYOHBFDZCE-NRFANRHFSA-N	0	3	340.467	3.037	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H](C=C)c1ccccc1)C2	ZINC001045985496	1346825811	/nfs/dbraw/zinc/82/58/11/1346825811.db2.gz	VOHVUVBTBUHXEG-UNMCSNQZSA-N	0	3	336.479	3.294	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)C1CC(C(C)(C)C)C1)C2	ZINC001045986122	1346827116	/nfs/dbraw/zinc/82/71/16/1346827116.db2.gz	HKSOJGNAURZKEG-WIXQSORDSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@H]1CC3CCC1CC3)C2	ZINC001045986410	1346827369	/nfs/dbraw/zinc/82/73/69/1346827369.db2.gz	PTDZDVBDGUJKEV-XSNSTOHYSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc(C)nc1C)C2	ZINC001045986220	1346828044	/nfs/dbraw/zinc/82/80/44/1346828044.db2.gz	KLSUVVNUOASELZ-OAQYLSRUSA-N	0	3	339.483	3.040	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@]1(C)CCN(Cc2ccc(C)cc2)C1	ZINC001046373535	1346953276	/nfs/dbraw/zinc/95/32/76/1346953276.db2.gz	DHSMBQOAPGTTNL-NRFANRHFSA-N	0	3	337.467	3.377	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2cc(C)nn2C(CC)CC)C1	ZINC001046436416	1346975886	/nfs/dbraw/zinc/97/58/86/1346975886.db2.gz	PILMGBGKHOHOFU-IBGZPJMESA-N	0	3	332.492	3.323	20	30		EGEDHN
C#CCCN1CC[C@](C)(NC(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2)C1	ZINC001046692853	1347064719	/nfs/dbraw/zinc/06/47/19/1347064719.db2.gz	JFBMLGPEQTXVNB-SCTDSRPQSA-N	0	3	330.859	3.047	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2ncc(Cl)cc2Cl)C1	ZINC001046727247	1347074585	/nfs/dbraw/zinc/07/45/85/1347074585.db2.gz	BDAQDUSPDHMLEG-OAHLLOKOSA-N	0	3	328.243	3.159	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2ccc(C)s2)C1	ZINC001046910830	1347149991	/nfs/dbraw/zinc/14/99/91/1347149991.db2.gz	RUEPGKIXEQPAER-ZDUSSCGKSA-N	0	3	328.428	3.320	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@@H](CNC(=O)[C@@H]2C[C@H]2CC(C)(C)C)C1	ZINC001046944467	1347159714	/nfs/dbraw/zinc/15/97/14/1347159714.db2.gz	MRWQREDBWRRDKP-HRCADAONSA-N	0	3	340.458	3.155	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3ccccc3F)C2)CC1	ZINC001047219993	1347251849	/nfs/dbraw/zinc/25/18/49/1347251849.db2.gz	RXNGOSFOCAWWOO-QGZVFWFLSA-N	0	3	328.431	3.023	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)C3(C(F)F)CCC3)C2)CC1	ZINC001047248650	1347273518	/nfs/dbraw/zinc/27/35/18/1347273518.db2.gz	OOJDWQUAUFTVIK-MRXNPFEDSA-N	0	3	338.442	3.006	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)[C@H](C)c3ccco3)C2)CC1	ZINC001047254705	1347278856	/nfs/dbraw/zinc/27/88/56/1347278856.db2.gz	QXUCPGWKWLQWAR-IEBWSBKVSA-N	0	3	342.483	3.357	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3cccc4[nH]ccc43)C2)CC1	ZINC001047256125	1347279528	/nfs/dbraw/zinc/27/95/28/1347279528.db2.gz	HOWWQKBPBMRGRL-SFHVURJKSA-N	0	3	349.478	3.365	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)Cc3ccsc3C)C2)CC1	ZINC001047259289	1347282008	/nfs/dbraw/zinc/28/20/08/1347282008.db2.gz	NJJKGSHWEZLRNM-IBGZPJMESA-N	0	3	344.524	3.183	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3ccoc3CCC)C2)CC1	ZINC001047263076	1347284215	/nfs/dbraw/zinc/28/42/15/1347284215.db2.gz	YNYWFMULFZHFSE-GOSISDBHSA-N	0	3	342.483	3.430	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)Cc3ccc(C)s3)C2)CC1	ZINC001047265979	1347286980	/nfs/dbraw/zinc/28/69/80/1347286980.db2.gz	NEPWEIBTMPFIOC-GOSISDBHSA-N	0	3	344.524	3.183	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)C2CCCC2)C1	ZINC001047674544	1347325457	/nfs/dbraw/zinc/32/54/57/1347325457.db2.gz	VRTBHEWNJKQPKD-DNVCBOLYSA-N	0	3	325.456	3.075	20	30		EGEDHN
Cc1occc1C(=O)N1CC[C@H]([C@@H](C)NCc2ccccc2C#N)C1	ZINC001047706277	1347342314	/nfs/dbraw/zinc/34/23/14/1347342314.db2.gz	TXAAIAIUTITLBH-KDOFPFPSSA-N	0	3	337.423	3.100	20	30		EGEDHN
C[C@H](NCc1cc(F)ccc1C#N)[C@@H]1CCN(C(=O)CC2CCC2)C1	ZINC001047774722	1347366985	/nfs/dbraw/zinc/36/69/85/1347366985.db2.gz	OZVHQYUGLNQQOK-WMLDXEAASA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)C2(C3CC3)CC2)C1	ZINC001047878725	1347396529	/nfs/dbraw/zinc/39/65/29/1347396529.db2.gz	CXTAHMYOXGQAKQ-CRAIPNDOSA-N	0	3	337.467	3.075	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H]([C@@H](C)NCc3nc(C)oc3C)C2)CC1	ZINC001047961333	1347425397	/nfs/dbraw/zinc/42/53/97/1347425397.db2.gz	BUFRUPMOKIFFIF-KDOFPFPSSA-N	0	3	345.487	3.364	20	30		EGEDHN
CCC1(C(=O)N2CC[C@H]([C@H](C)NCc3cc(F)ccc3C#N)C2)CC1	ZINC001047969938	1347428965	/nfs/dbraw/zinc/42/89/65/1347428965.db2.gz	ICMSFTPMZOIAOS-HOCLYGCPSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)C2CC3(CC3)C2)C1	ZINC001047970656	1347429328	/nfs/dbraw/zinc/42/93/28/1347429328.db2.gz	XKPDSEGVUGDYEK-QAPCUYQASA-N	0	3	337.467	3.075	20	30		EGEDHN
C[C@H]1CN(C(=O)C2CCCC2)C[C@H]1CNCc1cc(F)ccc1C#N	ZINC001048098473	1347465431	/nfs/dbraw/zinc/46/54/31/1347465431.db2.gz	XJSULAJOULNAHM-KBXCAEBGSA-N	0	3	343.446	3.072	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2CCC2)C[C@@H]1CNCc1cc(F)ccc1C#N	ZINC001048191257	1347488867	/nfs/dbraw/zinc/48/88/67/1347488867.db2.gz	BWCXNLZKGJGDKB-KDOFPFPSSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](CNCc2csc(C)n2)[C@H](C)C1	ZINC001048337710	1347522452	/nfs/dbraw/zinc/52/24/52/1347522452.db2.gz	FJGZWUVYQQFPTE-UKRRQHHQSA-N	0	3	335.517	3.238	20	30		EGEDHN
N#Cc1ccccc1CN1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)c1cc[nH]c1)C2	ZINC001048528559	1347579350	/nfs/dbraw/zinc/57/93/50/1347579350.db2.gz	AVRNYIFYNKHXBO-VVNNIFPWSA-N	0	3	348.450	3.059	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)CC(C)(C)c3ccc(C)cc3)C[C@@H]2C1	ZINC001049204970	1347746585	/nfs/dbraw/zinc/74/65/85/1347746585.db2.gz	AYCQKXLKXRRAGY-KDURUIRLSA-N	0	3	338.495	3.076	20	30		EGEDHN
C/C(=C\C(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1cccc(C#N)c1)C1CC1	ZINC001049337902	1347796608	/nfs/dbraw/zinc/79/66/08/1347796608.db2.gz	CEHHBJQTLLUUNZ-RBSFPSQFSA-N	0	3	349.478	3.480	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1cccc(C#N)c1	ZINC001049414736	1347836452	/nfs/dbraw/zinc/83/64/52/1347836452.db2.gz	FXNCQHKDNPFOEL-QRVBRYPASA-N	0	3	337.467	3.170	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)C=C2CCC2)c1	ZINC001049414654	1347836899	/nfs/dbraw/zinc/83/68/99/1347836899.db2.gz	WOWHFTLPSXBPII-VQTJNVASSA-N	0	3	335.451	3.234	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(C(C)(C)C)cn1	ZINC001049488630	1347872365	/nfs/dbraw/zinc/87/23/65/1347872365.db2.gz	YYDHOAJHYZNQLZ-ZWKOTPCHSA-N	0	3	327.472	3.244	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(C2CC2)n(CC)n1	ZINC001049516669	1347888070	/nfs/dbraw/zinc/88/80/70/1347888070.db2.gz	DZZCHFTXBGONOX-ZWKOTPCHSA-N	0	3	342.487	3.035	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(-c2ccncc2)o1	ZINC001049517289	1347888129	/nfs/dbraw/zinc/88/81/29/1347888129.db2.gz	IHYRLUPDJYUGHK-ZWKOTPCHSA-N	0	3	349.434	3.044	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc2nc(C)oc2c1	ZINC001049530411	1347894656	/nfs/dbraw/zinc/89/46/56/1347894656.db2.gz	CCADJAGHAMRMMF-SJORKVTESA-N	0	3	325.412	3.001	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2CCC[C@H]3[C@@H]2CCN3CC=C)cc1	ZINC001049556847	1347907820	/nfs/dbraw/zinc/90/78/20/1347907820.db2.gz	ZDHVMJNKFGQRPB-OALUTQOASA-N	0	3	326.440	3.116	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1cccc(C(C)C)n1	ZINC001049572838	1347916673	/nfs/dbraw/zinc/91/66/73/1347916673.db2.gz	OYZJVSFYAGPBII-MOPGFXCFSA-N	0	3	327.472	3.460	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(-c2ccccc2)no1	ZINC001049576683	1347917624	/nfs/dbraw/zinc/91/76/24/1347917624.db2.gz	VRNLPZJDCLXLEF-RBUKOAKNSA-N	0	3	349.434	3.044	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cn(CC)c2ccccc12	ZINC001049582974	1347921649	/nfs/dbraw/zinc/92/16/49/1347921649.db2.gz	RXAZOPQGWAHJGW-LEWJYISDSA-N	0	3	349.478	3.363	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1F	ZINC001049611787	1347935469	/nfs/dbraw/zinc/93/54/69/1347935469.db2.gz	KOROLUWPYLLWJC-NBMJBFSESA-N	0	3	346.421	3.320	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(C)nc1C1CC1	ZINC001049627161	1347941439	/nfs/dbraw/zinc/94/14/39/1347941439.db2.gz	PXMVQGWUARNTED-ZWKOTPCHSA-N	0	3	325.456	3.132	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc2ccc(OC)cc2[nH]1	ZINC001049632626	1347944313	/nfs/dbraw/zinc/94/43/13/1347944313.db2.gz	ZLNATUJGDURGRO-OALUTQOASA-N	0	3	339.439	3.041	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H]2[C@H]1CCN2CCc1ccns1	ZINC001049632693	1347944673	/nfs/dbraw/zinc/94/46/73/1347944673.db2.gz	ALKGCFLYGGNNOZ-DLBZAZTESA-N	0	3	347.528	3.353	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cnc2ccsc2c1	ZINC001049638031	1347947724	/nfs/dbraw/zinc/94/77/24/1347947724.db2.gz	JSDLGQCGZDAQHJ-JKSUJKDBSA-N	0	3	327.453	3.161	20	30		EGEDHN
C[C@]1(C(=O)N2CCC[C@@H]3[C@@H]2CCN3Cc2cccc(C#N)c2)C=CCC1	ZINC001049659453	1347959543	/nfs/dbraw/zinc/95/95/43/1347959543.db2.gz	SMMDBAIITQTYAF-URVUXULASA-N	0	3	349.478	3.480	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1c(F)cc(F)cc1F	ZINC001049681465	1347970302	/nfs/dbraw/zinc/97/03/02/1347970302.db2.gz	OZAAJBKXOFIHCQ-CVEARBPZSA-N	0	3	338.373	3.359	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccccc1-n1cccc1	ZINC001049686802	1347972044	/nfs/dbraw/zinc/97/20/44/1347972044.db2.gz	HOEIWEKPHLPPCH-PMACEKPBSA-N	0	3	335.451	3.342	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccccc1OC1CCC1	ZINC001049705098	1347982176	/nfs/dbraw/zinc/98/21/76/1347982176.db2.gz	CUPXSBQZSCVXLQ-RTBURBONSA-N	0	3	340.467	3.483	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc2cc(F)ccc2o1	ZINC001049761200	1348006652	/nfs/dbraw/zinc/00/66/52/1348006652.db2.gz	HZUYZMLMFFGQJT-IAGOWNOFSA-N	0	3	340.398	3.274	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(F)cc2cccnc21	ZINC001049766569	1348009863	/nfs/dbraw/zinc/00/98/63/1348009863.db2.gz	DFCPKZMSEMLQJN-ROUUACIJSA-N	0	3	339.414	3.239	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1ccc(Cl)s1	ZINC001049771059	1348013234	/nfs/dbraw/zinc/01/32/34/1348013234.db2.gz	VQOKCNKCWZVABQ-CABCVRRESA-N	0	3	336.888	3.033	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1oc(C2CC2)nc1C	ZINC001049773989	1348015134	/nfs/dbraw/zinc/01/51/34/1348015134.db2.gz	ULCCHRGQHZYXNL-HZPDHXFCSA-N	0	3	329.444	3.115	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C[C@@H](C)c1ccccc1F	ZINC001049788939	1348022445	/nfs/dbraw/zinc/02/24/45/1348022445.db2.gz	SMBLGTPLIZQQES-LSTHTHJFSA-N	0	3	342.458	3.408	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(Cl)cc(OC)c1	ZINC001049800434	1348026694	/nfs/dbraw/zinc/02/66/94/1348026694.db2.gz	BHSQWQWCKUHFPT-IAGOWNOFSA-N	0	3	334.847	3.214	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cccc(-c2cnco2)c1	ZINC001049818909	1348036076	/nfs/dbraw/zinc/03/60/76/1348036076.db2.gz	BGLZPRUWJAHANP-ZWKOTPCHSA-N	0	3	337.423	3.207	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](C)c1ccc(C)s1	ZINC001049835267	1348048588	/nfs/dbraw/zinc/04/85/88/1348048588.db2.gz	HDGZFOQCOFREME-YESZJQIVSA-N	0	3	330.497	3.249	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cnn(C(CC)CC)c1C	ZINC001049835836	1348048965	/nfs/dbraw/zinc/04/89/65/1348048965.db2.gz	SYZJEPGVHOYECO-MOPGFXCFSA-N	0	3	344.503	3.418	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1coc(C2CCC2)n1	ZINC001049842099	1348053339	/nfs/dbraw/zinc/05/33/39/1348053339.db2.gz	KBTMQKBDHQZJIW-DLBZAZTESA-N	0	3	329.444	3.197	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(C)n(CC2CC2)c1C	ZINC001049848240	1348057191	/nfs/dbraw/zinc/05/71/91/1348057191.db2.gz	KJWPDHFLBUXOBN-VQTJNVASSA-N	0	3	341.499	3.380	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1c(F)cccc1Cl	ZINC001049864990	1348071431	/nfs/dbraw/zinc/07/14/31/1348071431.db2.gz	SQJIRPVJUZYRMP-SJORKVTESA-N	0	3	336.838	3.273	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1c(F)cccc1Cl	ZINC001049864989	1348071596	/nfs/dbraw/zinc/07/15/96/1348071596.db2.gz	SQJIRPVJUZYRMP-IRXDYDNUSA-N	0	3	336.838	3.273	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(C2CC2)cn1	ZINC001049872734	1348078146	/nfs/dbraw/zinc/07/81/46/1348078146.db2.gz	XYRZXEUXKZLSIX-MOPGFXCFSA-N	0	3	325.456	3.214	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(C)c(CC)s1	ZINC001049881903	1348087513	/nfs/dbraw/zinc/08/75/13/1348087513.db2.gz	SVVSXYHYWPJFDX-CVEARBPZSA-N	0	3	330.497	3.321	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(OCC2CC2)cc1	ZINC001049901270	1348101216	/nfs/dbraw/zinc/10/12/16/1348101216.db2.gz	OCQAIWOZGGQLKK-UXHICEINSA-N	0	3	340.467	3.340	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc2cccc(F)c2o1	ZINC001049903923	1348103221	/nfs/dbraw/zinc/10/32/21/1348103221.db2.gz	LMYRYIXLCOFOOV-IRXDYDNUSA-N	0	3	340.398	3.274	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](C)Cc1ccccc1C	ZINC001049914456	1348109734	/nfs/dbraw/zinc/10/97/34/1348109734.db2.gz	DHOQQUXQWPUWSQ-DFQSSKMNSA-N	0	3	326.484	3.425	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)CCc1cc(C)sc1C	ZINC001049922923	1348114633	/nfs/dbraw/zinc/11/46/33/1348114633.db2.gz	JBIIUINKXXYAMU-OALUTQOASA-N	0	3	344.524	3.386	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(N(C)CCC)cc1	ZINC001049924209	1348115640	/nfs/dbraw/zinc/11/56/40/1348115640.db2.gz	CBSRLFLWHYWWTN-PMACEKPBSA-N	0	3	341.499	3.398	20	30		EGEDHN
CCC(CC)C(=O)N1CCC[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001049978132	1348142190	/nfs/dbraw/zinc/14/21/90/1348142190.db2.gz	MXQHCVDSFUXVDU-VQTJNVASSA-N	0	3	339.483	3.417	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC[C@H]2CN(Cc3cccc(C#N)c3)C[C@H]21	ZINC001049979229	1348142872	/nfs/dbraw/zinc/14/28/72/1348142872.db2.gz	KKUQKFLUORVPCG-ZYSHUDEJSA-N	0	3	325.456	3.027	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3ccc(C(C)(C)C)cn3)[C@@H]2C1	ZINC001050048175	1348165469	/nfs/dbraw/zinc/16/54/69/1348165469.db2.gz	IOKZEHIXXBLSPR-QFBILLFUSA-N	0	3	341.499	3.492	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cn(C)c4ccc(F)cc34)[C@@H]2C1	ZINC001050065111	1348170480	/nfs/dbraw/zinc/17/04/80/1348170480.db2.gz	MKVHUSKXISMNON-IFXJQAMLSA-N	0	3	341.430	3.040	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3ccnc(CCC)c3)[C@@H]2C1	ZINC001050069443	1348172239	/nfs/dbraw/zinc/17/22/39/1348172239.db2.gz	HXMFACIRWAZZQL-PKOBYXMFSA-N	0	3	327.472	3.147	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)Cc3ccc(C)cc3Cl)[C@@H]2C1	ZINC001050077693	1348174978	/nfs/dbraw/zinc/17/49/78/1348174978.db2.gz	DGLIHPIJKJLREN-PKOBYXMFSA-N	0	3	344.886	3.137	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3coc4ccc(OC)cc43)[C@@H]2C1	ZINC001050093555	1348181311	/nfs/dbraw/zinc/18/13/11/1348181311.db2.gz	LNDOHVSFGXXFCP-KBXCAEBGSA-N	0	3	340.423	3.164	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cnn(C4CCCCC4)c3)[C@@H]2C1	ZINC001050181303	1348203782	/nfs/dbraw/zinc/20/37/82/1348203782.db2.gz	SHXSHYAIIMDXID-QFBILLFUSA-N	0	3	342.487	3.111	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)[C@@H](C)c3ccc(F)c(F)c3)[C@@H]2C1	ZINC001050205200	1348211185	/nfs/dbraw/zinc/21/11/85/1348211185.db2.gz	CDYMGDBOYMDKKD-URLQWDBASA-N	0	3	346.421	3.014	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC2(C1)CCN([C@@H](C)c1cccc(Cl)c1)CC2	ZINC001050460885	1348271602	/nfs/dbraw/zinc/27/16/02/1348271602.db2.gz	ZRBSHYSLKMZJRY-GJZGRUSLSA-N	0	3	345.874	3.485	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@H](CC)c3ccc(Cl)cc3)C2)CC1	ZINC001050762188	1348351326	/nfs/dbraw/zinc/35/13/26/1348351326.db2.gz	BXYUQYOJMRRYNF-GOSISDBHSA-N	0	3	344.886	3.391	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3cc4cccc(Cl)c4o3)C2)CC1	ZINC001050783479	1348356691	/nfs/dbraw/zinc/35/66/91/1348356691.db2.gz	NCDFGGJRALPWBR-UHFFFAOYSA-N	0	3	342.826	3.257	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3ccc(C)nc3)cccc2C1	ZINC001051279080	1348415867	/nfs/dbraw/zinc/41/58/67/1348415867.db2.gz	RNEKAODLZFUIFB-UHFFFAOYSA-N	0	3	335.451	3.254	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3cc(C)nc(C)c3)cccc2C1	ZINC001051291249	1348421013	/nfs/dbraw/zinc/42/10/13/1348421013.db2.gz	MGUZMKOHASYHGG-UHFFFAOYSA-N	0	3	347.462	3.010	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)[C@@]34C[C@@H]3CCCC4)cccc2C1	ZINC001051299825	1348425061	/nfs/dbraw/zinc/42/50/61/1348425061.db2.gz	PSIFVSWTLZSMSG-UGKGYDQZSA-N	0	3	336.479	3.265	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3cnoc3CC)cccc2C1	ZINC001051302354	1348425914	/nfs/dbraw/zinc/42/59/14/1348425914.db2.gz	MZSBEMUOFSJUGJ-UHFFFAOYSA-N	0	3	339.439	3.101	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)[C@@H]3CC34CCCC4)cccc2C1	ZINC001051306026	1348427519	/nfs/dbraw/zinc/42/75/19/1348427519.db2.gz	ISHATVNLAPYOLU-FQEVSTJZSA-N	0	3	336.479	3.265	20	30		EGEDHN
C=C(C)CCN1CCN([C@@H]2CCN(C(=O)CC3(C)CCCC3)C2)CC1	ZINC001052024806	1348497418	/nfs/dbraw/zinc/49/74/18/1348497418.db2.gz	NPYUWCPNHYUXEX-LJQANCHMSA-N	0	3	347.547	3.142	20	30		EGEDHN
CC1(C)CC(C(=O)N[C@H]2CCCN(Cc3cccc(C#N)c3)CC2)C1	ZINC001052355551	1348532484	/nfs/dbraw/zinc/53/24/84/1348532484.db2.gz	WVQSUHFGRVYVJH-IBGZPJMESA-N	0	3	339.483	3.465	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2cc3ccc(F)cc3s2)CC1	ZINC001052538486	1348570671	/nfs/dbraw/zinc/57/06/71/1348570671.db2.gz	SGNKYXTUNAOWQY-OAHLLOKOSA-N	0	3	330.428	3.258	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H](NC(=O)[C@H]3C[C@H]4C[C@H]4C3)CC2)cc1	ZINC001052643396	1348609384	/nfs/dbraw/zinc/60/93/84/1348609384.db2.gz	IGKGTANWAANXAP-NMLBUPMWSA-N	0	3	337.467	3.075	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2csc(-c3ccco3)n2)CC1	ZINC001052664672	1348619096	/nfs/dbraw/zinc/61/90/96/1348619096.db2.gz	OTTYWCWFWZCTME-AWEZNQCLSA-N	0	3	343.452	3.011	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccccc2OC2CCC2)CC1	ZINC001052692762	1348636029	/nfs/dbraw/zinc/63/60/29/1348636029.db2.gz	AHZRSCNKRFTAJA-KRWDZBQOSA-N	0	3	340.467	3.226	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@H](NC(=O)[C@@H]3CC34CCC4)CC2)c1	ZINC001052755244	1348664894	/nfs/dbraw/zinc/66/48/94/1348664894.db2.gz	SMXVLDJFIUEKNX-MOPGFXCFSA-N	0	3	337.467	3.219	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)C(C)(C)c2ccccc2F)CC1	ZINC001052796669	1348683669	/nfs/dbraw/zinc/68/36/69/1348683669.db2.gz	UFGDEVYFTREMEB-INIZCTEOSA-N	0	3	330.447	3.097	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc3nc(C)ccc3c2)CC1	ZINC001052811935	1348687188	/nfs/dbraw/zinc/68/71/88/1348687188.db2.gz	VCUBRXMMVZADNV-IBGZPJMESA-N	0	3	335.451	3.151	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)C(C)(C)c2ccc(CC)cc2)CC1	ZINC001052850626	1348701783	/nfs/dbraw/zinc/70/17/83/1348701783.db2.gz	RJPLXWKNJSXEMF-IBGZPJMESA-N	0	3	326.484	3.131	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)C23CC4CC(CC(C4)C2)C3)CC1	ZINC001052888926	1348725050	/nfs/dbraw/zinc/72/50/50/1348725050.db2.gz	LMAOEMDINSVXDT-VJJCQHNBSA-N	0	3	328.500	3.197	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2ccc(Cl)c(Cl)c2)CC1	ZINC001052888968	1348725641	/nfs/dbraw/zinc/72/56/41/1348725641.db2.gz	MCVSYIOGQRFTDH-ZDUSSCGKSA-N	0	3	325.239	3.211	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2sc(CCC)nc2C)CC1	ZINC001052929416	1348753016	/nfs/dbraw/zinc/75/30/16/1348753016.db2.gz	BIIDVRDBZOLMAS-OAHLLOKOSA-N	0	3	333.501	3.012	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)Cc2cccc(OC(C)C)c2)CC1	ZINC001052968280	1348779519	/nfs/dbraw/zinc/77/95/19/1348779519.db2.gz	XTKFPJLXFPJTCT-LJQANCHMSA-N	0	3	342.483	3.010	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccccc2F)C1	ZINC001053061036	1348870645	/nfs/dbraw/zinc/87/06/45/1348870645.db2.gz	LOQQVZKWFGHKLO-QFBILLFUSA-N	0	3	328.431	3.166	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccc(C)o2)C1	ZINC001053068777	1348882585	/nfs/dbraw/zinc/88/25/85/1348882585.db2.gz	WABDJFXMUIQFCJ-ZWKOTPCHSA-N	0	3	328.456	3.318	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)C2CC(F)(F)C2)C1	ZINC001053075697	1348893479	/nfs/dbraw/zinc/89/34/79/1348893479.db2.gz	IZZUNTYOPUBYGV-WBVHZDCISA-N	0	3	338.442	3.148	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]([C@@H]2CCCCN2C(=O)C(=O)C(C)(C)C)C1	ZINC001053077444	1348897280	/nfs/dbraw/zinc/89/72/80/1348897280.db2.gz	JTYLRGKGXRNOBT-SJORKVTESA-N	0	3	334.504	3.271	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2c(C)ccn2C)C1	ZINC001053084484	1348905972	/nfs/dbraw/zinc/90/59/72/1348905972.db2.gz	RMBKNHNWXCSPQH-OALUTQOASA-N	0	3	341.499	3.064	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cccn2CC=C)C1	ZINC001053088373	1348913319	/nfs/dbraw/zinc/91/33/19/1348913319.db2.gz	UIEKADDJXTZWRY-OALUTQOASA-N	0	3	339.483	3.014	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)C2CCC(=C)CC2)C1	ZINC001053093935	1348922922	/nfs/dbraw/zinc/92/29/22/1348922922.db2.gz	AYWZQTWUNXHPRJ-PMACEKPBSA-N	0	3	328.500	3.459	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cc(C)[nH]c2C)C1	ZINC001053098090	1348929162	/nfs/dbraw/zinc/92/91/62/1348929162.db2.gz	KBMMSRDGAYWHHX-ICSRJNTNSA-N	0	3	341.499	3.362	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(C(C)C)no2)C1	ZINC001053102751	1348936091	/nfs/dbraw/zinc/93/60/91/1348936091.db2.gz	UWYBIOGHXHDVAB-AEFFLSMTSA-N	0	3	343.471	3.138	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)Cc2ccccc2C)C1	ZINC001053104115	1348939178	/nfs/dbraw/zinc/93/91/78/1348939178.db2.gz	CBWYOZVHLBXUEM-RTWAWAEBSA-N	0	3	338.495	3.264	20	30		EGEDHN
N#C[C@@H]1CCCN(Cc2n[nH]c3cc(Br)ccc32)CC1	ZINC001231617962	1376283810	/nfs/dbraw/zinc/28/38/10/1376283810.db2.gz	UKRCYVXFQDCJNU-LLVKDONJSA-N	0	3	333.233	3.451	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001054111494	1349150793	/nfs/dbraw/zinc/15/07/93/1349150793.db2.gz	XNOGYQXPAASFFF-UZTGNQCKSA-N	0	3	337.467	3.339	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(C)nc1C(C)C)C2	ZINC001054169824	1349171558	/nfs/dbraw/zinc/17/15/58/1349171558.db2.gz	HORVBZHHJFUNEH-NRFANRHFSA-N	0	3	339.483	3.075	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CCC[C@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001054176085	1349177600	/nfs/dbraw/zinc/17/76/00/1349177600.db2.gz	BIMRFNFQHNVOTL-UYAOXDASSA-N	0	3	343.446	3.121	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc3ccccc3n1C)C2	ZINC001054185647	1349188200	/nfs/dbraw/zinc/18/82/00/1349188200.db2.gz	HAMYUMXUNZQBFX-JOCHJYFZSA-N	0	3	349.478	3.130	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(F)c(Cl)c1)C2	ZINC001054187372	1349191001	/nfs/dbraw/zinc/19/10/01/1349191001.db2.gz	PDQQPMPYGNHHSW-LJQANCHMSA-N	0	3	348.849	3.431	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(C)c(Cl)c1)C2	ZINC001054188730	1349191284	/nfs/dbraw/zinc/19/12/84/1349191284.db2.gz	SPUJBNPXEGYAIB-LJQANCHMSA-N	0	3	330.859	3.210	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H](C)c1ccc(Cl)cc1)C2	ZINC001054188682	1349191578	/nfs/dbraw/zinc/19/15/78/1349191578.db2.gz	RCFGDNOXFBKLRW-OXJNMPFZSA-N	0	3	344.886	3.391	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc(F)ccc1Cl)C2	ZINC001054203647	1349204858	/nfs/dbraw/zinc/20/48/58/1349204858.db2.gz	VLTISQADFPTJFR-IBGZPJMESA-N	0	3	348.849	3.431	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@H](C)Cc1cccs1)C2	ZINC001054204835	1349205837	/nfs/dbraw/zinc/20/58/37/1349205837.db2.gz	FDLHGQVMODKAFZ-YLJYHZDGSA-N	0	3	344.524	3.265	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H](C)c1cccc(F)c1)C2	ZINC001054243130	1349236899	/nfs/dbraw/zinc/23/68/99/1349236899.db2.gz	XEQKISDEHVFTSI-LAUBAEHRSA-N	0	3	342.458	3.267	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cccc3c1CCC3)C2	ZINC001054247230	1349241747	/nfs/dbraw/zinc/24/17/47/1349241747.db2.gz	RIWSLYSHELIIBF-QFIPXVFZSA-N	0	3	336.479	3.127	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@H]3CCCOCC3)cc2C1	ZINC001054263667	1349261749	/nfs/dbraw/zinc/26/17/49/1349261749.db2.gz	YLGLMUGZLTUXRL-KRWDZBQOSA-N	0	3	328.456	3.011	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@H]3CCCO[C@H]3CC)cc2C1	ZINC001054267665	1349265544	/nfs/dbraw/zinc/26/55/44/1349265544.db2.gz	BHPHSCYDFYVJLT-PMACEKPBSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@H]3CC[C@H](OC)C3)cc2C1	ZINC001054270988	1349270108	/nfs/dbraw/zinc/27/01/08/1349270108.db2.gz	DQFWMCRCXSAPRJ-LPHOPBHVSA-N	0	3	328.456	3.010	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@@H]3CCC[C@@H]3OC)cc2C1	ZINC001054271311	1349270784	/nfs/dbraw/zinc/27/07/84/1349270784.db2.gz	KWDFMCBXDACMMB-MOPGFXCFSA-N	0	3	328.456	3.010	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@H]3Cc4ccncc4C3)cc2C1	ZINC001054281685	1349283089	/nfs/dbraw/zinc/28/30/89/1349283089.db2.gz	WHQZURDEXVKPOD-IBGZPJMESA-N	0	3	347.462	3.005	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3nccs3)cc2C1	ZINC001054287718	1349290144	/nfs/dbraw/zinc/29/01/44/1349290144.db2.gz	YXWSBIYIKIBSQG-UHFFFAOYSA-N	0	3	327.453	3.355	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3ccc(OC)o3)cc2C1	ZINC001054287454	1349290216	/nfs/dbraw/zinc/29/02/16/1349290216.db2.gz	LZYWHTRBPCXOSS-UHFFFAOYSA-N	0	3	326.396	3.110	20	30		EGEDHN
Cc1ccc(C(=O)N2C[C@@H](C)[C@@H](NCc3ccc(C#N)s3)C2)s1	ZINC001054340671	1349320324	/nfs/dbraw/zinc/32/03/24/1349320324.db2.gz	WIHWNPIUFWZHSZ-ABAIWWIYSA-N	0	3	345.493	3.240	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@@H](C)[C@@H](NCc2cc(C)ns2)C1	ZINC001054678643	1349434884	/nfs/dbraw/zinc/43/48/84/1349434884.db2.gz	IHCCAWGBIJKLJJ-YGRLFVJLSA-N	0	3	341.908	3.167	20	30		EGEDHN
C=CCn1cccc1C(=O)N1C[C@@H](C)[C@H](NCc2ccccc2F)C1	ZINC001054751936	1349453997	/nfs/dbraw/zinc/45/39/97/1349453997.db2.gz	WHNXITGHMPEXJY-CRAIPNDOSA-N	0	3	341.430	3.064	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2cc3c(cc(C)cc3C)[nH]2)C1	ZINC001080211761	1357523078	/nfs/dbraw/zinc/52/30/78/1357523078.db2.gz	ZSDLKIPISNGRKV-DNVCBOLYSA-N	0	3	325.456	3.411	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3cc(C(CC)CC)no3)[C@@H]2C1	ZINC001084708167	1358287696	/nfs/dbraw/zinc/28/76/96/1358287696.db2.gz	RFAWREKLKWBNGR-NVXWUHKLSA-N	0	3	331.460	3.301	20	30		EGEDHN
CN(C)C1(C)CN(C(=O)C[C@H](C#N)c2c(Cl)cccc2Cl)C1	ZINC001183105643	1387263960	/nfs/dbraw/zinc/26/39/60/1387263960.db2.gz	FTKASKDSYAUPGP-LLVKDONJSA-N	0	3	340.254	3.153	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCO[C@H]1C1CCN(C(=O)C(C)(C)CC)CC1	ZINC001071082433	1354450857	/nfs/dbraw/zinc/45/08/57/1354450857.db2.gz	ZUHQZHIIIWMWGD-CVEARBPZSA-N	0	3	342.911	3.161	20	30		EGEDHN
C#CCCN1CC[C@]2(C1)CN(C(=O)C1(C)CCCCCC1)C[C@H](C)O2	ZINC001071178256	1354488824	/nfs/dbraw/zinc/48/88/24/1354488824.db2.gz	MMBGVVKEPXSGJF-RXVVDRJESA-N	0	3	346.515	3.062	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1cc(C)ccc1F)C[C@@H](C)O2	ZINC001071215509	1354510748	/nfs/dbraw/zinc/51/07/48/1354510748.db2.gz	COTWCFUSGYBLDJ-UZLBHIALSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1oc(CC)cc1C)C[C@@H](C)O2	ZINC001071227625	1354514159	/nfs/dbraw/zinc/51/41/59/1354514159.db2.gz	ICPAXTMAMAYGNT-UZLBHIALSA-N	0	3	346.471	3.032	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1cccc(Cl)c1)C[C@H](C)O2	ZINC001071232699	1354515987	/nfs/dbraw/zinc/51/59/87/1354515987.db2.gz	AIQVYONTYHJGBD-HNAYVOBHSA-N	0	3	348.874	3.222	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)[C@H]1CC[C@H](CC)CC1)C[C@H](C)O2	ZINC001071233302	1354517333	/nfs/dbraw/zinc/51/73/33/1354517333.db2.gz	GYGDYIDUCDNOAH-VNYTWHDVSA-N	0	3	348.531	3.471	20	30		EGEDHN
C#CCCN1CC[C@]2(C1)CN(C(=O)CCC1CCCCC1)C[C@@H](C)O2	ZINC001071233529	1354517465	/nfs/dbraw/zinc/51/74/65/1354517465.db2.gz	KGEDCQXJZABGJS-NQIIRXRSSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)Cc2coc3cc(F)ccc23)CC[C@@H]1C	ZINC001071498002	1354728367	/nfs/dbraw/zinc/72/83/67/1354728367.db2.gz	PMLAZQIYOOZFPU-XJKSGUPXSA-N	0	3	330.403	3.270	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cn(C(C)(C)C)nc2C)CC[C@@H]1C	ZINC001071501729	1354731335	/nfs/dbraw/zinc/73/13/35/1354731335.db2.gz	UCGFIIUXEMJEDD-HOCLYGCPSA-N	0	3	332.492	3.105	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cscc2C(F)F)CC[C@@H]1C	ZINC001071512600	1354736609	/nfs/dbraw/zinc/73/66/09/1354736609.db2.gz	ZSWKKBZCLGPXAD-NWDGAFQWSA-N	0	3	326.412	3.292	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2conc2C2CCCC2)CC[C@H]1C	ZINC001071561703	1354765069	/nfs/dbraw/zinc/76/50/69/1354765069.db2.gz	TXISZMHQFLIUIL-GDBMZVCRSA-N	0	3	331.460	3.491	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2c(Cl)n[nH]c2C2CC2)CC[C@@H]1C	ZINC001071561163	1354765288	/nfs/dbraw/zinc/76/52/88/1354765288.db2.gz	JZENTZPXWMHOIT-AAEUAGOBSA-N	0	3	336.867	3.099	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(N(C)C)cc2F)CC[C@@H]1C	ZINC001071567666	1354767110	/nfs/dbraw/zinc/76/71/10/1354767110.db2.gz	AWOJPMWOZVXGQK-LSDHHAIUSA-N	0	3	333.451	3.051	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccccc2-c2ccncc2)CC[C@H]1C	ZINC001071607645	1354792793	/nfs/dbraw/zinc/79/27/93/1354792793.db2.gz	RAGQVDNYXIPSMH-MJGOQNOKSA-N	0	3	347.462	3.355	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2ccc3cccnc3c2)CC[C@@H]1C	ZINC001071607560	1354793229	/nfs/dbraw/zinc/79/32/29/1354793229.db2.gz	PSZCSHJPXKNQCN-LPHOPBHVSA-N	0	3	337.467	3.323	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc(C)nn2C(CC)CC)CC[C@@H]1C	ZINC001071631641	1354813537	/nfs/dbraw/zinc/81/35/37/1354813537.db2.gz	PNYCPURDCFWJKF-IRXDYDNUSA-N	0	3	344.503	3.159	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc(Cl)c(Cl)[nH]2)CC[C@H]1C	ZINC001071714892	1354872806	/nfs/dbraw/zinc/87/28/06/1354872806.db2.gz	BIFBWIJBCHGYKJ-MNOVXSKESA-N	0	3	330.259	3.480	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(C(F)(F)F)nc2)CC[C@@H]1C	ZINC001071721427	1354879823	/nfs/dbraw/zinc/87/98/23/1354879823.db2.gz	QNABWHROQVIBJF-GXTWGEPZSA-N	0	3	341.377	3.259	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc3c(ccc(C)c3C)[nH]2)CC[C@H]1C	ZINC001071739848	1354890389	/nfs/dbraw/zinc/89/03/89/1354890389.db2.gz	ZCJDXGZWZVZKNG-NVXWUHKLSA-N	0	3	337.467	3.391	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C(C)(C)c2c(C)noc2C)CC[C@@H]1C	ZINC001071761502	1354908969	/nfs/dbraw/zinc/90/89/69/1354908969.db2.gz	YXJTXJWCXFOVAU-XJKSGUPXSA-N	0	3	333.476	3.114	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@@H]2CCCc3ccccc32)CC(C)(C)C1	ZINC001089419375	1360413281	/nfs/dbraw/zinc/41/32/81/1360413281.db2.gz	FEFGLVABMXEIBT-UYAOXDASSA-N	0	3	338.495	3.347	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(C3CC3)nc2C)CC[C@@H]1C	ZINC001071831550	1354967553	/nfs/dbraw/zinc/96/75/53/1354967553.db2.gz	IQSSXZBOXXLDQZ-YOEHRIQHSA-N	0	3	327.472	3.426	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2ccc(Cl)s2)CC[C@@H]1C	ZINC001071870521	1354996145	/nfs/dbraw/zinc/99/61/45/1354996145.db2.gz	BBQPIVPLIHIKRM-STQMWFEESA-N	0	3	326.893	3.489	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C(C)(C)c2ccccc2F)CC[C@H]1C	ZINC001071896532	1355011561	/nfs/dbraw/zinc/01/15/61/1355011561.db2.gz	GVQBQWLPJVDNKJ-CVEARBPZSA-N	0	3	330.447	3.096	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cccc(-n3cccn3)c2)CC[C@@H]1C	ZINC001071898190	1355013910	/nfs/dbraw/zinc/01/39/10/1355013910.db2.gz	WZTTZHTUTIGCJX-WMZOPIPTSA-N	0	3	338.455	3.031	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc3ccn(C)c3c2)CC[C@H]1C	ZINC001071962904	1355047444	/nfs/dbraw/zinc/04/74/44/1355047444.db2.gz	CIXAKZUFBFKGCU-CRAIPNDOSA-N	0	3	325.456	3.337	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc(-n3cccc3)ccn2)CC[C@H]1C	ZINC001071966545	1355049209	/nfs/dbraw/zinc/04/92/09/1355049209.db2.gz	FWUZMWRKABAABQ-IAGOWNOFSA-N	0	3	338.455	3.031	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc(C)c(F)cc2Cl)CC[C@H]1C	ZINC001072028796	1355089442	/nfs/dbraw/zinc/08/94/42/1355089442.db2.gz	BWXVNATZJOBFKH-KGLIPLIRSA-N	0	3	336.838	3.394	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc3[nH]c(C)c(C)c3c2)CC[C@H]1C	ZINC001072066714	1355109943	/nfs/dbraw/zinc/10/99/43/1355109943.db2.gz	OBOGYNQJUVAWRG-RDTXWAMCSA-N	0	3	337.467	3.391	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2scnc2Cl)CC[C@H]1C	ZINC001072072351	1355113215	/nfs/dbraw/zinc/11/32/15/1355113215.db2.gz	JALUFZRMHAVITG-NEPJUHHUSA-N	0	3	327.881	3.345	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)Cc2ccc(OC(C)C)cc2)CC[C@@H]1C	ZINC001072088472	1355121540	/nfs/dbraw/zinc/12/15/40/1355121540.db2.gz	MARCKPYWUOGFJU-FUHWJXTLSA-N	0	3	330.472	3.171	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc3ccccc3n2CC)CC[C@H]1C	ZINC001072092753	1355125184	/nfs/dbraw/zinc/12/51/84/1355125184.db2.gz	WZRRWEHINVHWCX-SJLPKXTDSA-N	0	3	337.467	3.267	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccccc2OCC2CC2)CC[C@@H]1C	ZINC001072099082	1355128984	/nfs/dbraw/zinc/12/89/84/1355128984.db2.gz	LGSVTUSEBUODCG-WMZOPIPTSA-N	0	3	340.467	3.081	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C2(c3ccccc3OC)CC2)CC[C@H]1C	ZINC001072115874	1355140741	/nfs/dbraw/zinc/14/07/41/1355140741.db2.gz	DLQTYZGNCXLXDX-SJORKVTESA-N	0	3	342.483	3.272	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(N(C)C(C)C)cc2)CC[C@@H]1C	ZINC001072116227	1355140844	/nfs/dbraw/zinc/14/08/44/1355140844.db2.gz	JYJKYJSUAGDMHP-HKUYNNGSSA-N	0	3	341.499	3.137	20	30		EGEDHN
C#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)C2=CCCC2)CC1	ZINC001072133150	1355147341	/nfs/dbraw/zinc/14/73/41/1355147341.db2.gz	YGXKYFBHOZAQIP-HXUWFJFHSA-N	0	3	337.467	3.008	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2N(Cc2ccsc2)C(=O)[C@@H]2C[C@H]2C)CC1	ZINC001072137560	1355149557	/nfs/dbraw/zinc/14/95/57/1355149557.db2.gz	QEPJFAAGMNMFGZ-NXHRZFHOSA-N	0	3	342.508	3.220	20	30		EGEDHN
CCC1(C(=O)N2CC[C@@H](C)[C@@H](CNCc3ccccc3C#N)C2)CC1	ZINC001072364205	1355258534	/nfs/dbraw/zinc/25/85/34/1355258534.db2.gz	QCTCQSBWLHQTMI-APWZRJJASA-N	0	3	339.483	3.323	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CN(C(=O)C=C4CCCCC4)C3)C2)cc1	ZINC001072526969	1355319853	/nfs/dbraw/zinc/31/98/53/1355319853.db2.gz	DXNLHEWEGGEEAK-UHFFFAOYSA-N	0	3	349.478	3.483	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001072779509	1355434227	/nfs/dbraw/zinc/43/42/27/1355434227.db2.gz	RWEHGOAPYBPPPM-UHFFFAOYSA-N	0	3	339.483	3.275	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)CC(C)(C)c3ccc(F)cc3)C2)C1	ZINC001072817088	1355450102	/nfs/dbraw/zinc/45/01/02/1355450102.db2.gz	PBAPRDUADUMCDV-UHFFFAOYSA-N	0	3	342.458	3.051	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)Cc3ccc(CC(C)C)cc3)C2)C1	ZINC001072903347	1355490329	/nfs/dbraw/zinc/49/03/29/1355490329.db2.gz	ZSUOIZKMJPFFEG-UHFFFAOYSA-N	0	3	326.484	3.148	20	30		EGEDHN
CC[C@@]1(C)C[C@H]1C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001073091449	1355589729	/nfs/dbraw/zinc/58/97/29/1355589729.db2.gz	KEXSKLQLHSWKQN-ICSRJNTNSA-N	0	3	337.467	3.029	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H](C)c3cc4ccccc4o3)C2)C1	ZINC001073114993	1355604444	/nfs/dbraw/zinc/60/44/44/1355604444.db2.gz	NPHUERYXHVCYIO-INIZCTEOSA-N	0	3	336.435	3.094	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C[C@H]3CCCc4ccccc43)C2)C1	ZINC001073141805	1355620397	/nfs/dbraw/zinc/62/03/97/1355620397.db2.gz	XNBPFLWTAUVAFY-LJQANCHMSA-N	0	3	336.479	3.054	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C[C@@H]3CCCc4ccccc43)C2)C1	ZINC001073141804	1355620642	/nfs/dbraw/zinc/62/06/42/1355620642.db2.gz	XNBPFLWTAUVAFY-IBGZPJMESA-N	0	3	336.479	3.054	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3ccc(Cl)cc3Cl)C2)C1	ZINC001073144980	1355623515	/nfs/dbraw/zinc/62/35/15/1355623515.db2.gz	HGZSPKOHNZRUFX-UHFFFAOYSA-N	0	3	325.239	3.327	20	30		EGEDHN
C[C@@H](CC(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2)C1CC1	ZINC001073463709	1355797366	/nfs/dbraw/zinc/79/73/66/1355797366.db2.gz	OCJKMWMWERFICA-INIZCTEOSA-N	0	3	337.467	3.029	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2ccc(C(F)F)cc2)C1	ZINC001073816060	1355907464	/nfs/dbraw/zinc/90/74/64/1355907464.db2.gz	SZYHKUGXLPWSRP-MRXNPFEDSA-N	0	3	338.398	3.021	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2cccc(C(C)C)c2)C1	ZINC001073839949	1355912935	/nfs/dbraw/zinc/91/29/35/1355912935.db2.gz	PZEDLDAUNJRERZ-IBGZPJMESA-N	0	3	330.472	3.207	20	30		EGEDHN
C[C@H]1[C@@H](NCc2ccc(C#N)s2)CCN1C(=O)[C@@H]1CCC1(C)C	ZINC001074816183	1356252705	/nfs/dbraw/zinc/25/27/05/1356252705.db2.gz	WCFLXMZZNBYUCJ-RCBQFDQVSA-N	0	3	331.485	3.135	20	30		EGEDHN
C[C@H]1[C@@H](NCc2ccc(C#N)s2)CCN1C(=O)C1CCC(F)CC1	ZINC001074853704	1356268221	/nfs/dbraw/zinc/26/82/21/1356268221.db2.gz	SZFDBVFNGVGRPM-VWLISTAJSA-N	0	3	349.475	3.227	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](C2CCN(C(=O)[C@H](C)OC)CC2)CC1	ZINC001075448096	1356380738	/nfs/dbraw/zinc/38/07/38/1356380738.db2.gz	NOWHVDXYAQHEOK-JKSUJKDBSA-N	0	3	342.911	3.115	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CC[C@H]2CN(Cc3cccc(C)c3)C[C@H]21	ZINC001075885204	1356439735	/nfs/dbraw/zinc/43/97/35/1356439735.db2.gz	KKBNKLQRDFHJJW-PZJWPPBQSA-N	0	3	349.478	3.329	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3sc4ccccc4c3C)[C@@H]2C1	ZINC001076012807	1356467228	/nfs/dbraw/zinc/46/72/28/1356467228.db2.gz	ZQBVRKWGOQXAKI-DOTOQJQBSA-N	0	3	338.476	3.379	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)[C@@H](CC)Cc3ccccc3C)[C@@H]2C1	ZINC001076460847	1356583464	/nfs/dbraw/zinc/58/34/64/1356583464.db2.gz	FNXHKTUDCAANCH-YSIASYRMSA-N	0	3	326.484	3.282	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@@H]1CCC(C)(C)CN1CCn1cccn1	ZINC001099085233	1363615393	/nfs/dbraw/zinc/61/53/93/1363615393.db2.gz	LRBSRJSZBJITCC-KRWDZBQOSA-N	0	3	346.519	3.092	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@@H]2C[C@H](NC(=O)CC3CC3)C23CCC3)c1	ZINC001078530885	1356998176	/nfs/dbraw/zinc/99/81/76/1356998176.db2.gz	DETQBMDSBXZDOK-MSOLQXFVSA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@H](NCc3cnoc3C)C23CCC3)CC1	ZINC001078716579	1357063001	/nfs/dbraw/zinc/06/30/01/1357063001.db2.gz	VGKTVVHWVBZFBQ-ROUUACIJSA-N	0	3	343.471	3.246	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)C2(F)CCCCC2)C12CCC2	ZINC001078771172	1357076211	/nfs/dbraw/zinc/07/62/11/1357076211.db2.gz	QJTGBOHCAWRFTN-KGLIPLIRSA-N	0	3	328.859	3.428	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ncoc2C(C)C)C12CCC2	ZINC001078774568	1357078345	/nfs/dbraw/zinc/07/83/45/1357078345.db2.gz	ZFJPMJLOQXKMBF-STQMWFEESA-N	0	3	337.851	3.181	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H](C)Cc2ccccc2)C[C@H]1c1ccccc1	ZINC001081230287	1357852327	/nfs/dbraw/zinc/85/23/27/1357852327.db2.gz	XPODALBMJXVBBY-YUXAGFNASA-N	0	3	346.474	3.083	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2ccccc2C(C)(C)C)[C@H](OC)C1	ZINC001081831746	1357869045	/nfs/dbraw/zinc/86/90/45/1357869045.db2.gz	SYOHWRIRGVWWTG-RTBURBONSA-N	0	3	344.499	3.379	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2ccccc2C2(C)CC2)[C@H](OC)C1	ZINC001082125068	1357953215	/nfs/dbraw/zinc/95/32/15/1357953215.db2.gz	HWKFHJXVZKJTCX-RTBURBONSA-N	0	3	342.483	3.133	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2cc(Cl)ccc2C)[C@H](OC)C1	ZINC001082248228	1357992184	/nfs/dbraw/zinc/99/21/84/1357992184.db2.gz	ATYGCKCOECQNNK-IAGOWNOFSA-N	0	3	336.863	3.044	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2cccc(C(F)F)c2)[C@H](OC)C1	ZINC001082336397	1358018599	/nfs/dbraw/zinc/01/85/99/1358018599.db2.gz	LSGBZEDUEDDOPI-HZPDHXFCSA-N	0	3	338.398	3.019	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2c(C)cc(C)cc2C)[C@H](OC)C1	ZINC001082359404	1358023752	/nfs/dbraw/zinc/02/37/52/1358023752.db2.gz	ZLYVMGUPHNLGST-QZTJIDSGSA-N	0	3	330.472	3.007	20	30		EGEDHN
C[C@@H]1CN(C(=O)C[C@@H]2C=CCCC2)C[C@H]1NCc1ccc(C#N)s1	ZINC001082587825	1358060603	/nfs/dbraw/zinc/06/06/03/1358060603.db2.gz	APCWCJFWZIPDMQ-IIDMSEBBSA-N	0	3	343.496	3.303	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)[C@H](C)CC3CCCCC3)[C@H]2C1	ZINC001083212875	1358124408	/nfs/dbraw/zinc/12/44/08/1358124408.db2.gz	FPUHBHLCAGHKSY-YZGWKJHDSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3ccoc3C(F)(F)F)[C@@H]2C1	ZINC001084373991	1358203740	/nfs/dbraw/zinc/20/37/40/1358203740.db2.gz	CZILGECRHYBBLM-TZMCWYRMSA-N	0	3	342.361	3.411	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)CCc3ccc(OCC)cc3)[C@@H]2C1	ZINC001084473278	1358222336	/nfs/dbraw/zinc/22/23/36/1358222336.db2.gz	RMWKMPJCTNUVTC-UYAOXDASSA-N	0	3	342.483	3.127	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CCN(Cc3ccc4cc[nH]c4c3)C[C@H]21	ZINC001084578295	1358242562	/nfs/dbraw/zinc/24/25/62/1358242562.db2.gz	UCHAOLCMQSCOLA-IEBWSBKVSA-N	0	3	337.467	3.413	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CCN(CCc4cccs4)C[C@H]32)C1	ZINC001084645866	1358268633	/nfs/dbraw/zinc/26/86/33/1358268633.db2.gz	HUSSVVMBXFUVLL-NVXWUHKLSA-N	0	3	330.497	3.180	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)c3ccc(F)c4ccccc34)[C@@H]2C1	ZINC001084678182	1358276514	/nfs/dbraw/zinc/27/65/14/1358276514.db2.gz	ATKGKKJORDPUQO-FOIQADDNSA-N	0	3	336.410	3.149	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)c3[nH]ccc3-c3ccccc3)[C@@H]2C1	ZINC001084770149	1358306160	/nfs/dbraw/zinc/30/61/60/1358306160.db2.gz	WNYWREVWASLRJB-IEBWSBKVSA-N	0	3	335.451	3.404	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)Cc3cccc4ccccc43)[C@@H]2C1	ZINC001084788942	1358310387	/nfs/dbraw/zinc/31/03/87/1358310387.db2.gz	KJYUPGHQTAUSPF-TZIWHRDSSA-N	0	3	334.463	3.491	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3cc4[nH]ccc4s3)[C@@H]2C1	ZINC001084798453	1358314192	/nfs/dbraw/zinc/31/41/92/1358314192.db2.gz	OEFUWPNIJJDXLL-UKRRQHHQSA-N	0	3	329.469	3.342	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@H](C)Cc3ccccc3C)[C@@H]2C1	ZINC001084859494	1358332409	/nfs/dbraw/zinc/33/24/09/1358332409.db2.gz	XWLQNEMOXBDKEA-MISYRCLQSA-N	0	3	326.484	3.282	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N1CC[C@H]2CCN(Cc3cccc(C#N)c3)[C@H]2C1	ZINC001084923358	1358349504	/nfs/dbraw/zinc/34/95/04/1358349504.db2.gz	MJGUEUQLUPUAMQ-QYZOEREBSA-N	0	3	337.467	3.027	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)C[C@H](C)c3ccc(CC)cc3)C[C@@H]21	ZINC001085029885	1358372722	/nfs/dbraw/zinc/37/27/22/1358372722.db2.gz	DNBGKQKDFZABJJ-WMQCIHAUSA-N	0	3	338.495	3.299	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@H](C)c3ccc(CC)cc3)C[C@@H]21	ZINC001085057495	1358381233	/nfs/dbraw/zinc/38/12/33/1358381233.db2.gz	GKQZDPBUBWVAFE-UIFIKXQLSA-N	0	3	338.495	3.299	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3c3ccc(F)cc3)C[C@@H]21	ZINC001085104533	1358392997	/nfs/dbraw/zinc/39/29/97/1358392997.db2.gz	MUJAZHMIUZEELT-LULLPPNCSA-N	0	3	328.431	3.038	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1CC=CCC1	ZINC001085131436	1358406304	/nfs/dbraw/zinc/40/63/04/1358406304.db2.gz	MSZNFZWAQDMZCN-RBSFLKMASA-N	0	3	341.293	3.268	20	30		EGEDHN
C[C@@H](C(=O)N[C@@H]1CCCC[C@H]1NCc1ccc(C#N)cc1F)C1CC1	ZINC001085162660	1358417485	/nfs/dbraw/zinc/41/74/85/1358417485.db2.gz	WVMYUJOZRLSTGC-UPRAQXHNSA-N	0	3	343.446	3.260	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@@H]2CCCC[C@H]2NC(=O)C2=CCCC2)c1	ZINC001085168561	1358421532	/nfs/dbraw/zinc/42/15/32/1358421532.db2.gz	TWMSCUWUYIPJCD-RTBURBONSA-N	0	3	341.430	3.325	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)C1CC(C)(C)C1	ZINC001085188288	1358427466	/nfs/dbraw/zinc/42/74/66/1358427466.db2.gz	VBIXCRNXFKXQMT-ZIAGYGMSSA-N	0	3	343.309	3.348	20	30		EGEDHN
CC1(C(=O)N[C@@H]2CCCC[C@H]2NCc2ccc(C#N)cc2F)CC1	ZINC001085205896	1358432822	/nfs/dbraw/zinc/43/28/22/1358432822.db2.gz	PZMMNRMHUKTONQ-IAGOWNOFSA-N	0	3	329.419	3.014	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccc(C)c(OC)c1	ZINC001085265482	1358447566	/nfs/dbraw/zinc/44/75/66/1358447566.db2.gz	CPDIOJBDANBIEE-HZPDHXFCSA-N	0	3	336.863	3.387	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1nc(C)n2ccccc12	ZINC001085273695	1358449088	/nfs/dbraw/zinc/44/90/88/1358449088.db2.gz	QTMHLUPXWXQQDZ-HUUCEWRRSA-N	0	3	346.862	3.026	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCCC[C@H]2NCc2ccns2)CC1	ZINC001085320408	1358464960	/nfs/dbraw/zinc/46/49/60/1358464960.db2.gz	VTPVPXJHTHYTBI-IAGOWNOFSA-N	0	3	333.501	3.407	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCCC[C@H]2NCc2cnoc2C)CC1	ZINC001085321217	1358465622	/nfs/dbraw/zinc/46/56/22/1358465622.db2.gz	MGIIZWKLDFBQTM-QZTJIDSGSA-N	0	3	331.460	3.246	20	30		EGEDHN
Cc1ccccc1[C@H](C)N1CC[C@H]1CN(C)C(=O)c1cc(C#N)c[nH]1	ZINC001085534914	1358571570	/nfs/dbraw/zinc/57/15/70/1358571570.db2.gz	WASKFODKIMXWSD-RDJZCZTQSA-N	0	3	336.439	3.102	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1c(Cl)n[nH]c1C1CC1	ZINC001085637545	1358652045	/nfs/dbraw/zinc/65/20/45/1358652045.db2.gz	RZCPYQYQZIIGES-CYBMUJFWSA-N	0	3	336.867	3.053	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cnc(-c2ccccc2)o1	ZINC001085656911	1358663169	/nfs/dbraw/zinc/66/31/69/1358663169.db2.gz	CIVLYJNWQGZYFO-QGZVFWFLSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc(C)cc(OC)c1C	ZINC001085698800	1358693771	/nfs/dbraw/zinc/69/37/71/1358693771.db2.gz	WWRVDMFDBGSHQH-QGZVFWFLSA-N	0	3	330.472	3.425	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@H]1Cc2cc(Cl)ccc2O1	ZINC001085707102	1358698722	/nfs/dbraw/zinc/69/87/22/1358698722.db2.gz	CSXZMDCGCDVFSU-SJLPKXTDSA-N	0	3	348.874	3.142	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1sccc1-n1cccc1	ZINC001085752174	1358732764	/nfs/dbraw/zinc/73/27/64/1358732764.db2.gz	YJRANVVLZGUYQF-HNNXBMFYSA-N	0	3	329.469	3.261	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc(F)c(F)cc1F	ZINC001085790591	1358765222	/nfs/dbraw/zinc/76/52/22/1358765222.db2.gz	OGLFEQGNYMHBRT-LBPRGKRZSA-N	0	3	326.362	3.216	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc2cc(OC)ccc2[nH]1	ZINC001085792860	1358768645	/nfs/dbraw/zinc/76/86/45/1358768645.db2.gz	VRFJAONAARMRJK-INIZCTEOSA-N	0	3	341.455	3.289	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1cnoc1-c1ccccc1	ZINC001085901734	1358860688	/nfs/dbraw/zinc/86/06/88/1358860688.db2.gz	LLENGNXYIQBFSX-MRXNPFEDSA-N	0	3	325.412	3.064	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cnn(C(C)(C)C)c1CC	ZINC001085975920	1358930724	/nfs/dbraw/zinc/93/07/24/1358930724.db2.gz	JHTQFGJNLFQAHL-INIZCTEOSA-N	0	3	346.519	3.313	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cccc3cccnc32)C1	ZINC001086139937	1359006107	/nfs/dbraw/zinc/00/61/07/1359006107.db2.gz	LFXRIOVTABUOFF-OTVXOJSOSA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(Cl)cc2OC)C1	ZINC001086180592	1359017284	/nfs/dbraw/zinc/01/72/84/1359017284.db2.gz	VTMJBLMPWSWBSL-BJHJDKERSA-N	0	3	343.254	3.199	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2C[C@@H](NCc3oc(C)nc3C)C2)CC1	ZINC001086187056	1359020949	/nfs/dbraw/zinc/02/09/49/1359020949.db2.gz	DAGSDURGUFXKMC-WOVMCDHWSA-N	0	3	331.460	3.022	20	30		EGEDHN
CC[C@@]1(C)C[C@@H]1C(=O)NC[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001086240064	1359037085	/nfs/dbraw/zinc/03/70/85/1359037085.db2.gz	POTZGHVHJQJRBF-ASKNOMKYSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc(Cl)cn2CC)C1	ZINC001086274063	1359050784	/nfs/dbraw/zinc/05/07/84/1359050784.db2.gz	NQTDAPFYDTUWEZ-BJHJDKERSA-N	0	3	330.259	3.012	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@H](CNC(=O)[C@@H]3CC=CCC3)C2)c(F)c1	ZINC001086306806	1359063267	/nfs/dbraw/zinc/06/32/67/1359063267.db2.gz	VKJBKWJYTNUOIP-JFIYKMOQSA-N	0	3	341.430	3.038	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)C2=CCCCCC2)C1	ZINC001086349757	1359074190	/nfs/dbraw/zinc/07/41/90/1359074190.db2.gz	QZAAANODPRVEPL-CTYIDZIISA-N	0	3	341.293	3.270	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc(C)c(OC)c(C)c2)C1	ZINC001086374010	1359080647	/nfs/dbraw/zinc/08/06/47/1359080647.db2.gz	ZSXIQZHHDNDMBC-KOMQPUFPSA-N	0	3	336.863	3.163	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2coc3cc(F)ccc23)C1	ZINC001086412048	1359090911	/nfs/dbraw/zinc/09/09/11/1359090911.db2.gz	HOWNRVVJHUXPDR-AULYBMBSSA-N	0	3	336.794	3.422	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@@H]2C[C@]2(C)c2ccccc2)C1	ZINC001086434468	1359096429	/nfs/dbraw/zinc/09/64/29/1359096429.db2.gz	SDGILEZNRYALJX-PCODUJHASA-N	0	3	332.875	3.201	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)C2CCC(=C)CC2)C1	ZINC001086466411	1359108059	/nfs/dbraw/zinc/10/80/59/1359108059.db2.gz	BPRYLAPNAJOVRT-CTYIDZIISA-N	0	3	341.293	3.126	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(F)c(Cl)c2F)C1	ZINC001086466445	1359108088	/nfs/dbraw/zinc/10/80/88/1359108088.db2.gz	CUZNQSOKBHSZMG-MGCOHNPYSA-N	0	3	349.208	3.469	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cccn2C2CCCC2)C1	ZINC001086516515	1359125824	/nfs/dbraw/zinc/12/58/24/1359125824.db2.gz	SSNFDUGWQVLXQR-SHTZXODSSA-N	0	3	335.879	3.454	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc3cccnc3s2)C1	ZINC001086525518	1359131607	/nfs/dbraw/zinc/13/16/07/1359131607.db2.gz	YHAMTBPWFASAEG-AULYBMBSSA-N	0	3	335.860	3.147	20	30		EGEDHN
CC(C)=CCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2c[nH]c(C#N)c2)C1	ZINC001086584275	1359155670	/nfs/dbraw/zinc/15/56/70/1359155670.db2.gz	NRYSJYBIOPUTHM-VQTJNVASSA-N	0	3	348.450	3.050	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)[C@@]2(C)CC=CCC2)C1	ZINC001086590406	1359157493	/nfs/dbraw/zinc/15/74/93/1359157493.db2.gz	BQVTVPRQZXDEIL-VWPQPMDRSA-N	0	3	336.479	3.340	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cccc3c2O[C@@H](C)C3)C1	ZINC001086761393	1359196336	/nfs/dbraw/zinc/19/63/36/1359196336.db2.gz	CZYAVHYFRUZUOR-OFQRWUPVSA-N	0	3	348.874	3.251	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2nccc3occc32)C1	ZINC001086764854	1359197037	/nfs/dbraw/zinc/19/70/37/1359197037.db2.gz	LBWYRFTUJCVTNK-QWHCGFSZSA-N	0	3	333.819	3.068	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc(Cl)o3)C2)CC1	ZINC001086903828	1359233042	/nfs/dbraw/zinc/23/30/42/1359233042.db2.gz	PBCIGGPBCYGGMO-CQSZACIVSA-N	0	3	334.847	3.273	20	30		EGEDHN
CC(C)C(=O)N1CC2(C[C@@H]1C)CCN(Cc1cccc(C#N)c1)CC2	ZINC001086904145	1359233777	/nfs/dbraw/zinc/23/37/77/1359233777.db2.gz	YHDWHQITLGCOMR-KRWDZBQOSA-N	0	3	339.483	3.417	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)Cc3c(C)cccc3C)C2)CC1	ZINC001086925099	1359250261	/nfs/dbraw/zinc/25/02/61/1359250261.db2.gz	LAKYPYNUTKKERX-IBGZPJMESA-N	0	3	338.495	3.182	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc(CC)o3)C2)CC1	ZINC001086929262	1359253669	/nfs/dbraw/zinc/25/36/69/1359253669.db2.gz	BMDNZAKEQTVMAY-INIZCTEOSA-N	0	3	328.456	3.182	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H](C)c3ccco3)C2)CC1	ZINC001086942495	1359264072	/nfs/dbraw/zinc/26/40/72/1359264072.db2.gz	SUBBVXFDMXELAF-SJORKVTESA-N	0	3	328.456	3.109	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)CC[C@H]3CCCCO3)C2)CC1	ZINC001086945751	1359267005	/nfs/dbraw/zinc/26/70/05/1359267005.db2.gz	ICYLBXNTBCIDBG-RBUKOAKNSA-N	0	3	346.515	3.062	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H]3C[C@H]3C3CCC3)C2)CC1	ZINC001086948468	1359269520	/nfs/dbraw/zinc/26/95/20/1359269520.db2.gz	YXUPTNNZXMARDC-YTQUADARSA-N	0	3	328.500	3.149	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)C[C@@H](C)c3ccco3)C2)CC1	ZINC001086953565	1359273698	/nfs/dbraw/zinc/27/36/98/1359273698.db2.gz	MAHVKIPVXQTMIV-IAGOWNOFSA-N	0	3	328.456	3.109	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cc(CC(C)C)c[nH]3)C2)CC1	ZINC001086953832	1359274058	/nfs/dbraw/zinc/27/40/58/1359274058.db2.gz	UVVHMBYKVSAAPU-KRWDZBQOSA-N	0	3	341.499	3.163	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3cccc(OC)c3)C2)CC1	ZINC001086954409	1359274740	/nfs/dbraw/zinc/27/47/40/1359274740.db2.gz	KRVPZTOONBQAIR-KRWDZBQOSA-N	0	3	340.467	3.035	20	30		EGEDHN
CCC(=O)N[C@@H]1[C@@H]2CCCN(Cc3ccc(C#N)cc3)[C@H]2C1(C)C	ZINC001087262611	1359332410	/nfs/dbraw/zinc/33/24/10/1359332410.db2.gz	GAHXCIADGHXGTG-QXAKKESOSA-N	0	3	325.456	3.073	20	30		EGEDHN
CC1(C)[C@H](NC(=O)C2CC2)[C@H]2CCCN(Cc3cccc(C#N)c3)[C@H]21	ZINC001087266375	1359337145	/nfs/dbraw/zinc/33/71/45/1359337145.db2.gz	KVSFIHGJDZXRAK-GUDVDZBRSA-N	0	3	337.467	3.073	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc4occc4c3)C(C)(C)[C@@H]21	ZINC001087288107	1359367026	/nfs/dbraw/zinc/36/70/26/1359367026.db2.gz	RLBCFFURAAABEP-BHIYHBOVSA-N	0	3	336.435	3.285	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)CC1CC(F)(F)C1	ZINC001087292969	1359373029	/nfs/dbraw/zinc/37/30/29/1359373029.db2.gz	VMETTWUUHDRHCQ-HYVNUMGLSA-N	0	3	338.442	3.050	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)Cc3cc(C)ccc3C)C(C)(C)[C@@H]21	ZINC001087301688	1359385441	/nfs/dbraw/zinc/38/54/41/1359385441.db2.gz	HCDUIDXCTOVLCJ-HMXCVIKNSA-N	0	3	338.495	3.084	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(C)c(F)c3F)C(C)(C)[C@H]21	ZINC001087304298	1359387475	/nfs/dbraw/zinc/38/74/75/1359387475.db2.gz	AHNGYMHTJUEEQL-OLMNPRSZSA-N	0	3	346.421	3.125	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc4ccccn4c3)C(C)(C)[C@H]21	ZINC001087305416	1359390262	/nfs/dbraw/zinc/39/02/62/1359390262.db2.gz	SDEYLNAVMPALQK-AABGKKOBSA-N	0	3	349.478	3.181	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(C)cc3F)C(C)(C)[C@@H]21	ZINC001087305732	1359391078	/nfs/dbraw/zinc/39/10/78/1359391078.db2.gz	XRRNQMWXOHENBM-BHIYHBOVSA-N	0	3	342.458	3.376	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cnc4ccccc4c3)C(C)(C)[C@@H]21	ZINC001087307101	1359394055	/nfs/dbraw/zinc/39/40/55/1359394055.db2.gz	UBAQARWLFRFVFO-MISYRCLQSA-N	0	3	347.462	3.087	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc4c(C)cccn4c3)C(C)(C)[C@@H]21	ZINC001087312415	1359400493	/nfs/dbraw/zinc/40/04/93/1359400493.db2.gz	DZJBSAFAIJZGPY-MISYRCLQSA-N	0	3	349.478	3.100	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)[C@H]3CC[C@H](CC)CC3)C(C)(C)[C@H]21	ZINC001087314593	1359404607	/nfs/dbraw/zinc/40/46/07/1359404607.db2.gz	NRQDVVUNOGKIFI-NNIGNNQHSA-N	0	3	330.516	3.441	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc(C(F)F)o3)C(C)(C)[C@H]21	ZINC001087316420	1359406566	/nfs/dbraw/zinc/40/65/66/1359406566.db2.gz	RFOHYZFBAVZCIB-UGFHNGPFSA-N	0	3	336.382	3.069	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc4ccccc4[nH]3)C(C)(C)[C@H]21	ZINC001087317969	1359410182	/nfs/dbraw/zinc/41/01/82/1359410182.db2.gz	PFXZOQRXYYTMRX-UXPWSPDFSA-N	0	3	349.478	3.410	20	30		EGEDHN
CCCC(=O)N1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1CC#Cc1ccccc1	ZINC001087329685	1359419342	/nfs/dbraw/zinc/41/93/42/1359419342.db2.gz	SKLUWBXFJPULRG-WOZUAGRISA-N	0	3	336.479	3.007	20	30		EGEDHN
CC1(C(=O)N2C[C@H]3[C@@H](C2)[C@@H]2CC[C@H]3CN2CC#Cc2ccccc2)CC1	ZINC001087360486	1359433778	/nfs/dbraw/zinc/43/37/78/1359433778.db2.gz	MIADDHRDLYCLOU-BQJUDKOJSA-N	0	3	348.490	3.007	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)[C@H]2[C@@H]3CCC[C@@H]32)C1	ZINC001087424762	1359459958	/nfs/dbraw/zinc/45/99/58/1359459958.db2.gz	PDNSWASKUVHIKD-ADAARDCZSA-N	0	3	336.479	3.030	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)[C@@H]2CCC2(C)C)C1	ZINC001087435385	1359464611	/nfs/dbraw/zinc/46/46/11/1359464611.db2.gz	MPTICXWYBHAAKF-HSALFYBXSA-N	0	3	338.495	3.420	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2nc(Cl)sc2C)[C@H]1CC	ZINC001087652994	1359573377	/nfs/dbraw/zinc/57/33/77/1359573377.db2.gz	YHWANXOVEAIEKV-NWDGAFQWSA-N	0	3	327.881	3.264	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnc3c(F)cccc3c2)[C@H]1CC	ZINC001087661446	1359577735	/nfs/dbraw/zinc/57/77/35/1359577735.db2.gz	LCHUIOFKRZNLJA-DLBZAZTESA-N	0	3	327.403	3.143	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N[C@H]1CCN(Cc2ccc(C#N)cc2)[C@@H]1CC	ZINC001087717100	1359608861	/nfs/dbraw/zinc/60/88/61/1359608861.db2.gz	RBSQBTBOWLFEBO-YSTOQKLRSA-N	0	3	339.483	3.464	20	30		EGEDHN
C=C(C)CCN1CC[C@H](NC(=O)c2snnc2C(C)C)[C@H]1CC	ZINC001087771221	1359636508	/nfs/dbraw/zinc/63/65/08/1359636508.db2.gz	TUDZKCWUTRLDPD-UONOGXRCSA-N	0	3	336.505	3.210	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cnn(CCC(C)C)c2C)[C@H]1CC	ZINC001087789999	1359646538	/nfs/dbraw/zinc/64/65/38/1359646538.db2.gz	QMYJFFWQCHAXIP-RBUKOAKNSA-N	0	3	346.519	3.396	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)[C@@H](C)c2ccc(F)c(F)c2)[C@H]1CC	ZINC001087835947	1359671189	/nfs/dbraw/zinc/67/11/89/1359671189.db2.gz	YIERAGYQUMJGSY-DOPJRALCSA-N	0	3	334.410	3.061	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)Cc3cccc(C(C)C)c3)C[C@@H]2C1	ZINC001088027225	1359727518	/nfs/dbraw/zinc/72/75/18/1359727518.db2.gz	ZLDWKXPYCABPRN-RTWAWAEBSA-N	0	3	338.495	3.156	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3ccc(C)c(Cl)c3F)C[C@@H]2C1	ZINC001088051185	1359735575	/nfs/dbraw/zinc/73/55/75/1359735575.db2.gz	RQCZEDJWULCYQN-CABCVRRESA-N	0	3	348.849	3.205	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CCN(CCC(F)(F)F)C[C@H]2C1	ZINC001088064588	1359739958	/nfs/dbraw/zinc/73/99/58/1359739958.db2.gz	LZCGYGLYWBHODS-KGLIPLIRSA-N	0	3	332.410	3.321	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)CCc3cc(C)cc(C)c3)C[C@@H]2C1	ZINC001088161644	1359776924	/nfs/dbraw/zinc/77/69/24/1359776924.db2.gz	CFJCBSHBBHIQAC-RTWAWAEBSA-N	0	3	338.495	3.040	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)C34CC5CC(CC(C5)C3)C4)C[C@@H]2C1	ZINC001088179980	1359783892	/nfs/dbraw/zinc/78/38/92/1359783892.db2.gz	JZDFQWNSODVVTG-CHAHAOGTSA-N	0	3	340.511	3.006	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3cc(CCC)c(C)s3)C[C@@H]2C1	ZINC001088193808	1359790895	/nfs/dbraw/zinc/79/08/95/1359790895.db2.gz	XITAMSKIMIPDJW-MSOLQXFVSA-N	0	3	344.524	3.426	20	30		EGEDHN
C=CCN1CC[C@H](OCC2CCN(C(=O)[C@]34C[C@H]3CCCC4)CC2)C1	ZINC001088238631	1359810202	/nfs/dbraw/zinc/81/02/02/1359810202.db2.gz	ZJEVLEVDDJRVBH-SVFBPWRDSA-N	0	3	346.515	3.082	20	30		EGEDHN
C=CCN1CC[C@@H](OCC2CCN(C(=O)[C@H]3CC34CCCC4)CC2)C1	ZINC001088239688	1359810703	/nfs/dbraw/zinc/81/07/03/1359810703.db2.gz	CXJOFFYPKHUNHO-RTBURBONSA-N	0	3	346.515	3.082	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCCCC[C@H](NCc3ccns3)C2)C1	ZINC001088379019	1359862579	/nfs/dbraw/zinc/86/25/79/1359862579.db2.gz	XZOMGUMLWCNSGL-HNNXBMFYSA-N	0	3	333.501	3.360	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2cc(C(F)F)n[nH]2)C1	ZINC001088380825	1359864046	/nfs/dbraw/zinc/86/40/46/1359864046.db2.gz	PZPRBERVARESFF-LLVKDONJSA-N	0	3	346.809	3.074	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2nc(CC)oc2C)C1	ZINC001088396284	1359871953	/nfs/dbraw/zinc/87/19/53/1359871953.db2.gz	CSTIDYXRGNDQRX-CQSZACIVSA-N	0	3	339.867	3.272	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2cccn3ccnc23)C1	ZINC001088397718	1359872988	/nfs/dbraw/zinc/87/29/88/1359872988.db2.gz	PASBHOSYSIAYOR-OAHLLOKOSA-N	0	3	346.862	3.061	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](CNCc2c(F)cccc2F)[C@@H](C)C1	ZINC001184303439	1387424981	/nfs/dbraw/zinc/42/49/81/1387424981.db2.gz	YYXFBCSJNZIYJW-HOTGVXAUSA-N	0	3	348.437	3.343	20	30		EGEDHN
C=C(Cl)CN(CC1CC1)C1CCN(C(=O)c2ncoc2C)CC1	ZINC001323719978	1387429372	/nfs/dbraw/zinc/42/93/72/1387429372.db2.gz	IADYKPCXNUSPRP-UHFFFAOYSA-N	0	3	337.851	3.052	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)C2(c3cccc(F)c3)CCC2)[C@H]1C	ZINC001088785165	1360043403	/nfs/dbraw/zinc/04/34/03/1360043403.db2.gz	ORQRFCYONXDBAS-QAPCUYQASA-N	0	3	330.447	3.403	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)C2(c3ccc(F)cc3)CCC2)[C@H]1C	ZINC001088784839	1360044272	/nfs/dbraw/zinc/04/42/72/1360044272.db2.gz	VSBQSYYREUOLOQ-QAPCUYQASA-N	0	3	330.447	3.403	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3cc(C)ccc3C)[C@@H]2C)nc1	ZINC001088987559	1360125885	/nfs/dbraw/zinc/12/58/85/1360125885.db2.gz	HLDXRZRWBOATSF-XLIONFOSSA-N	0	3	347.462	3.073	20	30		EGEDHN
CCCC(=O)N1CCCC[C@H]1CN(C)Cc1ccc(OCC#N)cc1	ZINC001089102609	1360168392	/nfs/dbraw/zinc/16/83/92/1360168392.db2.gz	CJDUWHOSCAQDPW-SFHVURJKSA-N	0	3	343.471	3.202	20	30		EGEDHN
C[C@H](C(=O)N1CCCC[C@H]1CN(C)Cc1cccc(C#N)c1)C1CC1	ZINC001089148108	1360203412	/nfs/dbraw/zinc/20/34/12/1360203412.db2.gz	LMQRFYVBVKVXHC-JXFKEZNVSA-N	0	3	339.483	3.417	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(F)ccc2F)CC(C)(C)C1	ZINC001089406661	1360405041	/nfs/dbraw/zinc/40/50/41/1360405041.db2.gz	PLCVLAAIKVOKLO-HNNXBMFYSA-N	0	3	334.410	3.209	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C2C3CC4CC(C3)CC2C4)CC(C)(C)C1	ZINC001089406534	1360405065	/nfs/dbraw/zinc/40/50/65/1360405065.db2.gz	NECPLZGUCGPNHW-RDOIFFKNSA-N	0	3	342.527	3.299	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2ccc3cccnc3c2)CC(C)(C)C1	ZINC001089417454	1360411779	/nfs/dbraw/zinc/41/17/79/1360411779.db2.gz	YZZJFQCBRONVNL-LJQANCHMSA-N	0	3	349.478	3.017	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@@H]2C[C@]2(C)c2ccccc2)CC(C)(C)C1	ZINC001089447612	1360436708	/nfs/dbraw/zinc/43/67/08/1360436708.db2.gz	JDAPFNZLRHDHKU-CNNODRBYSA-N	0	3	338.495	3.204	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@H]2CCCCC2(F)F)CC(C)(C)C1	ZINC001089448351	1360437397	/nfs/dbraw/zinc/43/73/97/1360437397.db2.gz	CHPCPWIRATYGMH-LSDHHAIUSA-N	0	3	326.431	3.052	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cnc3ccsc3c2)CC(C)(C)C1	ZINC001089458444	1360444626	/nfs/dbraw/zinc/44/46/26/1360444626.db2.gz	LHKPPBICVGISAV-HNNXBMFYSA-N	0	3	341.480	3.150	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CCN(C[C@H](F)CC)CC(C)(C)C2)c1	ZINC001089487156	1360467454	/nfs/dbraw/zinc/46/74/54/1360467454.db2.gz	IOGKIVWOSWYYCH-MSOLQXFVSA-N	0	3	345.462	3.031	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2sc(CC)nc2C)CC(C)(C)C1	ZINC001089516579	1360486920	/nfs/dbraw/zinc/48/69/20/1360486920.db2.gz	GXMUZAURSLTVAS-HNNXBMFYSA-N	0	3	347.528	3.258	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2csc(C(C)C)n2)CC(C)(C)C1	ZINC001089518818	1360488023	/nfs/dbraw/zinc/48/80/23/1360488023.db2.gz	HJJHYTZODJLSDH-AWEZNQCLSA-N	0	3	333.501	3.120	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccoc2CCC)CC(C)(C)C1	ZINC001089539043	1360496808	/nfs/dbraw/zinc/49/68/08/1360496808.db2.gz	ZPFAMNIBMCEHGV-INIZCTEOSA-N	0	3	330.472	3.476	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(C/C=C\Cl)CC(C)(C)C2)cn1	ZINC001089544615	1360500245	/nfs/dbraw/zinc/50/02/45/1360500245.db2.gz	WETIXQMRUFDOCD-OOYWPUHTSA-N	0	3	345.874	3.036	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1c(C)noc1C(C)C	ZINC001089654168	1360566461	/nfs/dbraw/zinc/56/64/61/1360566461.db2.gz	VEGUPUBOLFKYPB-MRXNPFEDSA-N	0	3	345.487	3.350	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(Cl)cn1C	ZINC001089667365	1360577431	/nfs/dbraw/zinc/57/74/31/1360577431.db2.gz	DWSSKKAVGKNDCC-OAHLLOKOSA-N	0	3	337.895	3.475	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H]1Cc2ccc(F)cc21	ZINC001089687371	1360593609	/nfs/dbraw/zinc/59/36/09/1360593609.db2.gz	IYDFYJRMVDOXRJ-FUHWJXTLSA-N	0	3	330.447	3.258	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(CCC)[nH]c(=O)c1	ZINC001089707152	1360610049	/nfs/dbraw/zinc/61/00/49/1360610049.db2.gz	FOHLRQRFZULQLJ-QGZVFWFLSA-N	0	3	345.487	3.146	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cnn(C(C)C)c1C	ZINC001089722377	1360625188	/nfs/dbraw/zinc/62/51/88/1360625188.db2.gz	YBOYKNYMKSZMJP-KRWDZBQOSA-N	0	3	344.503	3.016	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(F)cc(F)c1	ZINC001089728899	1360632163	/nfs/dbraw/zinc/63/21/63/1360632163.db2.gz	FPRZMNVZYASQFZ-KRWDZBQOSA-N	0	3	334.410	3.209	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)/C=C(\C)C1CC1	ZINC001089775689	1360659330	/nfs/dbraw/zinc/65/93/30/1360659330.db2.gz	AALJEXFUVQBFPG-QLAXJTLPSA-N	0	3	334.891	3.264	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1ccc(CC)o1	ZINC001089826672	1360682644	/nfs/dbraw/zinc/68/26/44/1360682644.db2.gz	JUFZTTWATXDKQX-LLLHUVSDSA-N	0	3	348.874	3.377	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1cc(C)[nH]c1C	ZINC001089868706	1360710944	/nfs/dbraw/zinc/71/09/44/1360710944.db2.gz	FITRGDYRLUKOSQ-RANZSIQMSA-N	0	3	347.890	3.166	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C2=CCCCCC2)CC2(CCOCC2)C1	ZINC001089935457	1360752048	/nfs/dbraw/zinc/75/20/48/1360752048.db2.gz	YMHGCJGBERXORZ-LJQANCHMSA-N	0	3	346.515	3.440	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C2(C)CCCC2)CC2(CCOCC2)C1	ZINC001089950384	1360760474	/nfs/dbraw/zinc/76/04/74/1360760474.db2.gz	TXFUEYKCIYBOHH-KRWDZBQOSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](CNCc2oc(C)nc2C)[C@H](C)C1	ZINC001184499376	1387474970	/nfs/dbraw/zinc/47/49/70/1387474970.db2.gz	ZERSEEVJGIYMIL-PBHICJAKSA-N	0	3	333.476	3.222	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccc(C(C)(C)CC)cc2)[C@H](O)C1	ZINC001090346880	1360893584	/nfs/dbraw/zinc/89/35/84/1360893584.db2.gz	HXMWSTNJBFDQTJ-RBUKOAKNSA-N	0	3	344.499	3.115	20	30		EGEDHN
CC1(C)CC(C(=O)NCC2CC(NCc3cc(C#N)ccc3F)C2)C1	ZINC001091011045	1360977596	/nfs/dbraw/zinc/97/75/96/1360977596.db2.gz	RDJFHARLOVUURY-UHFFFAOYSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc(C)c(OC)c(C)c2)C1	ZINC001091041766	1360984100	/nfs/dbraw/zinc/98/41/00/1360984100.db2.gz	ZSXIQZHHDNDMBC-UHFFFAOYSA-N	0	3	336.863	3.163	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc3ccccc3nc2C)C1	ZINC001091055318	1360987477	/nfs/dbraw/zinc/98/74/77/1360987477.db2.gz	ONHYLKGBMONITR-UHFFFAOYSA-N	0	3	343.858	3.394	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc(C)n([C@@H](C)CC)n2)C1	ZINC001091109881	1360993882	/nfs/dbraw/zinc/99/38/82/1360993882.db2.gz	JZROEBALWZFHKP-GRTSSRMGSA-N	0	3	338.883	3.013	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@H]2CCc3ccccc3C2)C1	ZINC001091257200	1361023652	/nfs/dbraw/zinc/02/36/52/1361023652.db2.gz	GYVWKHILHHVJMH-GMXGEUMGSA-N	0	3	332.875	3.028	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cccc(N3CCCC3)c2)C1	ZINC001091296410	1361035766	/nfs/dbraw/zinc/03/57/66/1361035766.db2.gz	MLQRUYVKQNMPHA-UHFFFAOYSA-N	0	3	347.890	3.137	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(OCC3CC3)cc2)C1	ZINC001091371009	1361065251	/nfs/dbraw/zinc/06/52/51/1361065251.db2.gz	FQIGRWJKYZYZNO-UHFFFAOYSA-N	0	3	348.874	3.326	20	30		EGEDHN
Cc1cccc(Cl)c1CN1C[C@@H]2CN(C(=O)[C@H](C)C#N)C[C@]2(C)C1	ZINC001091544562	1361140919	/nfs/dbraw/zinc/14/09/19/1361140919.db2.gz	BLKGANSOIBVDTK-CLCXKQKWSA-N	0	3	345.874	3.088	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc(C)c(Cl)c3F)C[C@]2(C)C1	ZINC001091879297	1361240149	/nfs/dbraw/zinc/24/01/49/1361240149.db2.gz	VCRRQGVSJWMNBC-KUHUBIRLSA-N	0	3	348.849	3.205	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3ccc(Cl)c(CCC)c3)C[C@]2(C)C1	ZINC001092198101	1361320524	/nfs/dbraw/zinc/32/05/24/1361320524.db2.gz	FIWBBFIOGYPXPU-XLIONFOSSA-N	0	3	344.886	3.320	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C[C@@H](C)c3ccc(F)cc3)C[C@]2(C)C1	ZINC001092296917	1361357586	/nfs/dbraw/zinc/35/75/86/1361357586.db2.gz	MFQUTLSASGWMPW-BLIXFSHQSA-N	0	3	342.458	3.123	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc(CC)c(CC)c3)C[C@]2(C)C1	ZINC001092332210	1361366812	/nfs/dbraw/zinc/36/68/12/1361366812.db2.gz	DRIMRAHPGIFJJS-IRLDBZIGSA-N	0	3	338.495	3.229	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1CNC(=O)C1CCCC1	ZINC001092423706	1361378251	/nfs/dbraw/zinc/37/82/51/1361378251.db2.gz	DHIPEDOLEHPXLI-RDTXWAMCSA-N	0	3	343.446	3.072	20	30		EGEDHN
Cc1cccc(C(=O)NC[C@@H]2CN(CC#Cc3ccccc3)C[C@H]2C)c1	ZINC001092437655	1361383688	/nfs/dbraw/zinc/38/36/88/1361383688.db2.gz	JJNUHZJQXFLIJG-DENIHFKCSA-N	0	3	346.474	3.344	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@@H]2CCCC23CC3)CC1	ZINC001093372508	1361582217	/nfs/dbraw/zinc/58/22/17/1361582217.db2.gz	DYVLHGHZRBQIJO-OALUTQOASA-N	0	3	340.511	3.293	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)[C@H]2CCC2(C)C)CC1	ZINC001093376269	1361586330	/nfs/dbraw/zinc/58/63/30/1361586330.db2.gz	IFQFWNYKVQNSMQ-QZTJIDSGSA-N	0	3	328.500	3.149	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C[C@@H]2CC=CCC2)CC1	ZINC001093376802	1361586997	/nfs/dbraw/zinc/58/69/97/1361586997.db2.gz	OGVUPRHSLVBHOY-WIYYLYMNSA-N	0	3	340.511	3.459	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@H](C)c2ccco2)CC1	ZINC001093378498	1361589088	/nfs/dbraw/zinc/58/90/88/1361589088.db2.gz	PWRFSTYRZJTIHI-APWZRJJASA-N	0	3	340.467	3.109	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C2CCC=CCC2)CC1	ZINC001093383106	1361594730	/nfs/dbraw/zinc/59/47/30/1361594730.db2.gz	IAGLCPUXQNPJKD-HXUWFJFHSA-N	0	3	340.511	3.459	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3nc(C(C)(C)C)cs3)CCC[C@@H]12	ZINC001094439628	1361802061	/nfs/dbraw/zinc/80/20/61/1361802061.db2.gz	NZOMWOVJGWILOJ-DNVCBOLYSA-N	0	3	345.512	3.048	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cc(C)n(C(C)C)c3C)CCC[C@@H]12	ZINC001094575752	1361867166	/nfs/dbraw/zinc/86/71/66/1361867166.db2.gz	DMZULJCCFPVBAG-TZIWHRDSSA-N	0	3	341.499	3.293	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@]1(c3ccccc3)CC1(C)C)C2	ZINC001096226028	1362441798	/nfs/dbraw/zinc/44/17/98/1362441798.db2.gz	UEHTYFUEPLADLK-MDPIYQRISA-N	0	3	336.479	3.099	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ncccc1C(F)(F)F)C2	ZINC001096280905	1362454046	/nfs/dbraw/zinc/45/40/46/1362454046.db2.gz	HDYFTVFLAUBIEK-XBFCOCLRSA-N	0	3	339.361	3.012	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CC1C3CC4CC(C3)CC1C4)C2	ZINC001096586625	1362588184	/nfs/dbraw/zinc/58/81/84/1362588184.db2.gz	HZMIDUFYCIRDIK-REQZVGADSA-N	0	3	340.511	3.194	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H](NCc2ccc(OC)c(F)c2)C1	ZINC001185050084	1387597674	/nfs/dbraw/zinc/59/76/74/1387597674.db2.gz	PPZOGYZXDONZGU-GOEBONIOSA-N	0	3	334.435	3.127	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](CNCc2ncc(C)s2)[C@H](C)C1	ZINC001185060139	1387603130	/nfs/dbraw/zinc/60/31/30/1387603130.db2.gz	DRVJCVYWZHJWRI-ZBFHGGJFSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1OC)C2	ZINC001098004006	1363194146	/nfs/dbraw/zinc/19/41/46/1363194146.db2.gz	OFCUPBSDZVKSIP-QTUASDBPSA-N	0	3	340.467	3.096	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1csc(-c3ccoc3)n1)C2	ZINC001098060080	1363211048	/nfs/dbraw/zinc/21/10/48/1363211048.db2.gz	SBWFXOSBMZEQAL-FMKPAKJESA-N	0	3	343.452	3.314	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc(C(F)(F)F)ccn1)C2	ZINC001098150625	1363236292	/nfs/dbraw/zinc/23/62/92/1363236292.db2.gz	DYZMQRLHQSKHSY-NFAWXSAZSA-N	0	3	339.361	3.012	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cccc(-c3ccoc3)c1)C2	ZINC001098173377	1363243635	/nfs/dbraw/zinc/24/36/35/1363243635.db2.gz	RLSNTRMPRQOXKH-AQNXPRMDSA-N	0	3	334.419	3.305	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc(C)c(F)cc1Cl)C2	ZINC001098293328	1363287193	/nfs/dbraw/zinc/28/71/93/1363287193.db2.gz	IPRDWIBFCZWCDT-JLZZUVOBSA-N	0	3	334.822	3.146	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(OCC3CC3)cc1)C2	ZINC001098432770	1363324776	/nfs/dbraw/zinc/32/47/76/1363324776.db2.gz	WRCOLSBRPUIPRS-RLLQIKCJSA-N	0	3	340.467	3.387	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)C[C@@H](NC(=O)C1(C)CC1)c1ccccc1O2	ZINC001098541696	1363363854	/nfs/dbraw/zinc/36/38/54/1363363854.db2.gz	QNVJRMCPTZDTOM-UTKZUKDTSA-N	0	3	340.467	3.447	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1CCCCCC1)C[C@@H](C)O2	ZINC001098570620	1363382024	/nfs/dbraw/zinc/38/20/24/1363382024.db2.gz	JSHVRQRVCADRLK-QGZVFWFLSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)CC(C)(C)C1CC1)C[C@H](C)O2	ZINC001098592677	1363391160	/nfs/dbraw/zinc/39/11/60/1363391160.db2.gz	PDOSAYBMPLYMCC-INIZCTEOSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@]1(C)CC=CCC1)C[C@H](C)O2	ZINC001098599741	1363393743	/nfs/dbraw/zinc/39/37/43/1363393743.db2.gz	KLOQKUAACMGKFB-PKOBYXMFSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C(C)(C)C1CCCC1)C[C@@H](C)O2	ZINC001098605961	1363396175	/nfs/dbraw/zinc/39/61/75/1363396175.db2.gz	MQOXKMFZVYRWCC-QGZVFWFLSA-N	0	3	348.531	3.471	20	30		EGEDHN
CCCCCCCNCc1cn([C@H]2CCN(C(=O)[C@@H](C)CC)C2)nn1	ZINC001098622443	1363403766	/nfs/dbraw/zinc/40/37/66/1363403766.db2.gz	JAWSVLXKBMXEFZ-WMZOPIPTSA-N	0	3	349.523	3.158	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1cc[nH]c1C(C)C)C[C@@H](C)O2	ZINC001098631361	1363407154	/nfs/dbraw/zinc/40/71/54/1363407154.db2.gz	VRHWSBBJNFYFAZ-MRXNPFEDSA-N	0	3	345.487	3.020	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)CC(C1CC1)C1CC1)C[C@H](C)O2	ZINC001098662742	1363424679	/nfs/dbraw/zinc/42/46/79/1363424679.db2.gz	KZEIEPQFELANES-INIZCTEOSA-N	0	3	346.515	3.081	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc3nccc(C)c3c2)C1	ZINC001098853207	1363492745	/nfs/dbraw/zinc/49/27/45/1363492745.db2.gz	PTFLZBJJMNLLKY-UWJYYQICSA-N	0	3	335.451	3.314	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(F)cc1	ZINC001098863756	1363497226	/nfs/dbraw/zinc/49/72/26/1363497226.db2.gz	VXPQQCQBSPHGPM-GOSISDBHSA-N	0	3	348.462	3.249	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(-c3ccccc3)on2)C1	ZINC001098933712	1363528012	/nfs/dbraw/zinc/52/80/12/1363528012.db2.gz	QBYHNTBYDAVVFJ-JXFKEZNVSA-N	0	3	337.423	3.112	20	30		EGEDHN
Cc1cccc(CN2CC(C)(C)CC[C@H]2CNC(=O)[C@H](C)C#N)c1	ZINC001098976555	1363551629	/nfs/dbraw/zinc/55/16/29/1363551629.db2.gz	VLZPIQGULNPDDE-AEFFLSMTSA-N	0	3	327.472	3.262	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1oc(C)cc1C	ZINC001099011718	1363572315	/nfs/dbraw/zinc/57/23/15/1363572315.db2.gz	BUNSGPGZSKACBI-QGZVFWFLSA-N	0	3	348.487	3.319	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1c(C)coc1C	ZINC001099038648	1363587817	/nfs/dbraw/zinc/58/78/17/1363587817.db2.gz	LKOLOSVRZVSCNP-QGZVFWFLSA-N	0	3	348.487	3.319	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H]2[C@@H]3CCCCCC[C@@H]32)C1	ZINC001099048953	1363594519	/nfs/dbraw/zinc/59/45/19/1363594519.db2.gz	KLZGZWFBUGGCGK-RFBJODPTSA-N	0	3	328.500	3.197	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)Cc1c(CC)noc1CC	ZINC001099110741	1363628312	/nfs/dbraw/zinc/62/83/12/1363628312.db2.gz	IAYSYDVAPRDOAJ-HNNXBMFYSA-N	0	3	347.503	3.135	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)Cc1sc(C)nc1C	ZINC001099145227	1363654006	/nfs/dbraw/zinc/65/40/06/1363654006.db2.gz	UTBBNIKMHZGYES-OAHLLOKOSA-N	0	3	335.517	3.095	20	30		EGEDHN
C#CCCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc3c(cccc3C)o2)C1	ZINC001099178889	1363675810	/nfs/dbraw/zinc/67/58/10/1363675810.db2.gz	AWZFGYRGLUELRR-KKSFZXQISA-N	0	3	336.435	3.349	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@H]1CCC1(C)C	ZINC001099182891	1363678672	/nfs/dbraw/zinc/67/86/72/1363678672.db2.gz	PAOBEOABWPOGDS-DLBZAZTESA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)Cc1ccc(F)c(F)c1	ZINC001099198869	1363687646	/nfs/dbraw/zinc/68/76/46/1363687646.db2.gz	GWJUASMPLWSZQB-HNNXBMFYSA-N	0	3	336.426	3.300	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)C(C)=C2CCCC2)C[C@H]1C(F)(F)F	ZINC001099235856	1363706181	/nfs/dbraw/zinc/70/61/81/1363706181.db2.gz	HLKBIVGVPINCJZ-HUUCEWRRSA-N	0	3	330.394	3.432	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H](F)c1ccccc1	ZINC001099245008	1363711569	/nfs/dbraw/zinc/71/15/69/1363711569.db2.gz	GIRQXPKSNFFOMI-MSOLQXFVSA-N	0	3	330.447	3.327	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2occc2Cl)C[C@H]1C(F)(F)F	ZINC001099302695	1363738550	/nfs/dbraw/zinc/73/85/50/1363738550.db2.gz	ZIMFBCMKURRFAJ-MWLCHTKSSA-N	0	3	336.741	3.102	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)Cc2ccc(Cl)cc2)C[C@H]1C(F)(F)F	ZINC001099336416	1363757812	/nfs/dbraw/zinc/75/78/12/1363757812.db2.gz	REJGNXCXHHEURT-ZIAGYGMSSA-N	0	3	346.780	3.047	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)C23CCC(CC2)CC3)C[C@H]1C(F)(F)F	ZINC001099346510	1363763496	/nfs/dbraw/zinc/76/34/96/1363763496.db2.gz	PWOCMBXJCSGYCB-MYMJJRTCSA-N	0	3	330.394	3.122	20	30		EGEDHN
CCCC(=O)N1C[C@@H]2CCC[C@]2(CNCc2ccccc2C#N)C1	ZINC001099358837	1363771914	/nfs/dbraw/zinc/77/19/14/1363771914.db2.gz	DGTSOZYEFODYJW-ICSRJNTNSA-N	0	3	325.456	3.077	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H](C)OCCC(C)C	ZINC001099360666	1363773210	/nfs/dbraw/zinc/77/32/10/1363773210.db2.gz	ZSWJDMKAHOUCIB-MSOLQXFVSA-N	0	3	336.520	3.068	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2ncc(C)s2)C1	ZINC001099475720	1363811994	/nfs/dbraw/zinc/81/19/94/1363811994.db2.gz	QQKKLSJYISYRNE-KXBFYZLASA-N	0	3	347.528	3.382	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)C[C@@H](C)CC(C)C)CC2(CCOCC2)C1	ZINC001099597018	1363880213	/nfs/dbraw/zinc/88/02/13/1363880213.db2.gz	QLVYQBGTMJKETE-ZWKOTPCHSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1CCN(Cc2ccc(C(C)C)cc2)C[C@H]1O	ZINC001099975783	1363994402	/nfs/dbraw/zinc/99/44/02/1363994402.db2.gz	GXLYLFVDBKMUQR-VQTJNVASSA-N	0	3	344.499	3.218	20	30		EGEDHN
C=C(C)CN1CC[C@@H](NC(=O)CC(C)(C)C2CCCCC2)[C@H](O)C1	ZINC001100074804	1364009805	/nfs/dbraw/zinc/00/98/05/1364009805.db2.gz	SWDFTSZSJGVLSO-QZTJIDSGSA-N	0	3	336.520	3.111	20	30		EGEDHN
CC(C)=C(F)C(=O)NCC1CC(NCC#Cc2ccc(Cl)cc2)C1	ZINC001100236756	1364053603	/nfs/dbraw/zinc/05/36/03/1364053603.db2.gz	DMAZCYQMBIWVQA-UHFFFAOYSA-N	0	3	348.849	3.439	20	30		EGEDHN
C#CCCCC(=O)NCC1CC(NCc2c(C)cccc2Cl)C1	ZINC001100284336	1364067662	/nfs/dbraw/zinc/06/76/62/1364067662.db2.gz	KFGZFTMKJKCEBM-UHFFFAOYSA-N	0	3	332.875	3.436	20	30		EGEDHN
C[C@@H](C(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1)C1CCC1	ZINC001100436814	1364113681	/nfs/dbraw/zinc/11/36/81/1364113681.db2.gz	MDKNZGDDSFWWTM-XRTORIHISA-N	0	3	342.458	3.098	20	30		EGEDHN
CC1(CC(=O)NCC2CC(NCC#Cc3ccc(Cl)cc3)C2)CC1	ZINC001100517854	1364143185	/nfs/dbraw/zinc/14/31/85/1364143185.db2.gz	IGKVOUOAUUZGNQ-UHFFFAOYSA-N	0	3	344.886	3.366	20	30		EGEDHN
C=CC(C)(C)C(=O)NCC1CC(NCC#Cc2cccc(Cl)c2)C1	ZINC001100569041	1364166565	/nfs/dbraw/zinc/16/65/65/1364166565.db2.gz	JRQFSIIKVRBLMR-UHFFFAOYSA-N	0	3	344.886	3.388	20	30		EGEDHN
CC#CCCCC(=O)NCC1CC(NCc2oc(CCC)nc2C)C1	ZINC001100591116	1364177613	/nfs/dbraw/zinc/17/76/13/1364177613.db2.gz	NPFFUJSTPQKNEG-UHFFFAOYSA-N	0	3	345.487	3.114	20	30		EGEDHN
C=CCC1(C(=O)NCC2CC(N[C@@H](C)c3cnc(C)cn3)C2)CCC1	ZINC001100645553	1364202596	/nfs/dbraw/zinc/20/25/96/1364202596.db2.gz	IOCOTXBGXJJKPM-GTPINHCMSA-N	0	3	342.487	3.077	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C(C)(C)CC2CCOCC2)C1	ZINC001100816906	1364276212	/nfs/dbraw/zinc/27/62/12/1364276212.db2.gz	UGQVMKPOIVXQJA-UHFFFAOYSA-N	0	3	342.911	3.066	20	30		EGEDHN
C[C@@H](C(=O)NCC1CC(NCC#Cc2ccccc2)C1)c1ccccc1	ZINC001100894856	1364318296	/nfs/dbraw/zinc/31/82/96/1364318296.db2.gz	PTQKMZWSDGDMIY-HOHBBMLPSA-N	0	3	346.474	3.326	20	30		EGEDHN
Cc1cccc(C(=O)NCC2CC(NCC#Cc3ccccc3)C2)c1C	ZINC001100933066	1364336589	/nfs/dbraw/zinc/33/65/89/1364336589.db2.gz	PFVIPDSNDRFMNB-UHFFFAOYSA-N	0	3	346.474	3.453	20	30		EGEDHN
C=C[C@@H](C(=O)NCC1CC(NCc2ccns2)C1)c1ccccc1	ZINC001101016852	1364375499	/nfs/dbraw/zinc/37/54/99/1364375499.db2.gz	JAGORBVMDADRDC-JFUPDXTOSA-N	0	3	341.480	3.097	20	30		EGEDHN
C=CCC1(C(=O)NCC2CC(NCc3conc3CC)C2)CCCC1	ZINC001101080213	1364403943	/nfs/dbraw/zinc/40/39/43/1364403943.db2.gz	DLMYJZCTRBIHDE-UHFFFAOYSA-N	0	3	345.487	3.358	20	30		EGEDHN
C=C(C)CN1CC[C@@H](Oc2ccnc(CNC(=O)/C(C)=C\CC)c2)C1	ZINC001101092115	1364408900	/nfs/dbraw/zinc/40/89/00/1364408900.db2.gz	MGHMCNLAIWQVTO-QIVUSQLPSA-N	0	3	343.471	3.083	20	30		EGEDHN
C=C(C)CN1CC[C@H](Oc2ccnc(CNC(=O)C[C@H](C)CC)c2)C1	ZINC001101093826	1364410153	/nfs/dbraw/zinc/41/01/53/1364410153.db2.gz	KWMNPTYQMSUCNV-APWZRJJASA-N	0	3	345.487	3.163	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@H]2CN(Cc3ccccc3F)C[C@@]2(C)C1	ZINC001101203091	1364461378	/nfs/dbraw/zinc/46/13/78/1364461378.db2.gz	GQFITFSHUMEHPW-NQIIRXRSSA-N	0	3	342.458	3.300	20	30		EGEDHN
CC#CCCCC(=O)N1C[C@H]2CN(Cc3cccc(F)c3)C[C@@]2(C)C1	ZINC001101333366	1364513613	/nfs/dbraw/zinc/51/36/13/1364513613.db2.gz	RWYIRWSGXUIYCB-NQIIRXRSSA-N	0	3	342.458	3.300	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)CCCc3cc(C)sc3C)C[C@]2(C)C1	ZINC001101478635	1364576975	/nfs/dbraw/zinc/57/69/75/1364576975.db2.gz	XYNIFSFBRGPBBZ-QUCCMNQESA-N	0	3	344.524	3.101	20	30		EGEDHN
C#CCCCC(=O)N1CCC(C(C)(C)CNCc2nocc2C)CC1	ZINC001101534620	1364604054	/nfs/dbraw/zinc/60/40/54/1364604054.db2.gz	OMCWXGLNMWTYBW-UHFFFAOYSA-N	0	3	345.487	3.141	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@H]1CC2(CN(CCC(C)C)C2)n2ccnc21	ZINC001101639723	1364666626	/nfs/dbraw/zinc/66/66/26/1364666626.db2.gz	MCAMAKZVHITFAS-IRXDYDNUSA-N	0	3	344.503	3.103	20	30		EGEDHN
C#CCN(C)CCCNC(=O)CC1c2ccccc2Oc2ccccc21	ZINC001324604134	1387694529	/nfs/dbraw/zinc/69/45/29/1387694529.db2.gz	AWHQCUSDPZOABL-UHFFFAOYSA-N	0	3	348.446	3.386	20	30		EGEDHN
CC/C=C(/C)C(=O)NC[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1C	ZINC001101778002	1364723344	/nfs/dbraw/zinc/72/33/44/1364723344.db2.gz	WQVNLGKITDINLR-QBVNPGAHSA-N	0	3	342.458	3.218	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001102011580	1364811477	/nfs/dbraw/zinc/81/14/77/1364811477.db2.gz	GDQFAXVSPAODFH-HUUCEWRRSA-N	0	3	331.485	3.160	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001102226246	1364943769	/nfs/dbraw/zinc/94/37/69/1364943769.db2.gz	IGRRDJRWSKDVAF-ZIAGYGMSSA-N	0	3	331.485	3.016	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@@H]1CN(Cc2oc(CC)nc2C)C[C@H]1C	ZINC001102262650	1364974530	/nfs/dbraw/zinc/97/45/30/1364974530.db2.gz	HCVQPSLNMJAUNQ-HYVNUMGLSA-N	0	3	347.503	3.332	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@@H]1CN(Cc2oc(CC)nc2C)C[C@H]1C	ZINC001102262649	1364974766	/nfs/dbraw/zinc/97/47/66/1364974766.db2.gz	HCVQPSLNMJAUNQ-DJIMGWMZSA-N	0	3	347.503	3.332	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H]2CN(Cc3cncs3)C[C@H]2C)CCC1	ZINC001102331753	1365005769	/nfs/dbraw/zinc/00/57/69/1365005769.db2.gz	QKYOFGKNXVLEMR-HUUCEWRRSA-N	0	3	333.501	3.074	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H]2CN(Cc3conc3CC)C[C@H]2C)CCC1	ZINC001102331751	1365005939	/nfs/dbraw/zinc/00/59/39/1365005939.db2.gz	QKTYZGGQDZDLMS-HZPDHXFCSA-N	0	3	345.487	3.168	20	30		EGEDHN
CC(C)C[C@H](C)C(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C	ZINC001102485571	1365081950	/nfs/dbraw/zinc/08/19/50/1365081950.db2.gz	WVCZRGNWYYGZDR-QKNQBKEWSA-N	0	3	340.511	3.404	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H]2CN(Cc3ccccn3)C[C@H]2C)CCCC1	ZINC001102620746	1365139311	/nfs/dbraw/zinc/13/93/11/1365139311.db2.gz	SLLFWFISHMDAJY-QZTJIDSGSA-N	0	3	341.499	3.402	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)cc2F)C[C@H]1CCNC(=O)CC1CC1	ZINC001102633818	1365145765	/nfs/dbraw/zinc/14/57/65/1365145765.db2.gz	JBSPKZYGZQOHSF-RHSMWYFYSA-N	0	3	343.446	3.072	20	30		EGEDHN
CC(C)CC(=O)NCC[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1C	ZINC001102642822	1365150753	/nfs/dbraw/zinc/15/07/53/1365150753.db2.gz	SBMHVFHUTZSSIL-IEBWSBKVSA-N	0	3	344.474	3.298	20	30		EGEDHN
CC(C)C(=O)NCC[C@@H]1CN(CC#Cc2cccc(Cl)c2)C[C@H]1C	ZINC001102674507	1365165301	/nfs/dbraw/zinc/16/53/01/1365165301.db2.gz	SKXONPOLXSFKOZ-SJLPKXTDSA-N	0	3	346.902	3.422	20	30		EGEDHN
C=CCC[C@H](C)[N@@H+]1C[C@@H](C)[C@H](CCNC(=O)c2ccccc2[O-])C1	ZINC001102688998	1365171608	/nfs/dbraw/zinc/17/16/08/1365171608.db2.gz	UZYFDTHMTMEZEE-IXDOHACOSA-N	0	3	330.472	3.435	20	30		EGEDHN
C=CCC[C@H](C)[N@H+]1C[C@@H](C)[C@H](CCNC(=O)c2ccccc2[O-])C1	ZINC001102688998	1365171617	/nfs/dbraw/zinc/17/16/17/1365171617.db2.gz	UZYFDTHMTMEZEE-IXDOHACOSA-N	0	3	330.472	3.435	20	30		EGEDHN
C=CCCC(=O)NCC[C@@H]1CN(Cc2cnn(C(C)(C)C)c2)C[C@H]1C	ZINC001102762452	1365207547	/nfs/dbraw/zinc/20/75/47/1365207547.db2.gz	AOOLYRPXIPUPEJ-SJLPKXTDSA-N	0	3	346.519	3.179	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCC[C@@H]1CN(Cc2cncs2)C[C@H]1C	ZINC001103346140	1365511113	/nfs/dbraw/zinc/51/11/13/1365511113.db2.gz	FPPFYKGGXIKSAF-BZUAXINKSA-N	0	3	335.517	3.320	20	30		EGEDHN
CCC1(C(=O)NCC[C@@H]2CN(Cc3ccc(C#N)s3)C[C@H]2C)CC1	ZINC001103406321	1365541683	/nfs/dbraw/zinc/54/16/83/1365541683.db2.gz	ATOCKBLRMNVDOQ-HUUCEWRRSA-N	0	3	345.512	3.384	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2ccn(C)c2CC)C1	ZINC001103434854	1365558287	/nfs/dbraw/zinc/55/82/87/1365558287.db2.gz	APJSQVOFVXJEKD-UKRRQHHQSA-N	0	3	337.895	3.028	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cc(C(C)C)no2)C1	ZINC001103495450	1365597425	/nfs/dbraw/zinc/59/74/25/1365597425.db2.gz	CXEOIIIHQQTMIS-TZMCWYRMSA-N	0	3	339.867	3.238	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)[C@H](C)OCCC(C)C)C1	ZINC001103770804	1365775406	/nfs/dbraw/zinc/77/54/06/1365775406.db2.gz	OXUUGMYMTZXSBQ-HYVNUMGLSA-N	0	3	344.927	3.264	20	30		EGEDHN
CC(C)CC(=O)N1C[C@@H](C)[C@H](CCNCc2cc(C#N)ccc2F)C1	ZINC001103830795	1365803933	/nfs/dbraw/zinc/80/39/33/1365803933.db2.gz	DIFACFXDBICKEA-NVXWUHKLSA-N	0	3	345.462	3.318	20	30		EGEDHN
C/C=C(/C)C(=O)N1C[C@@H](C)[C@H](CCNCc2cc(C#N)ccc2F)C1	ZINC001104054446	1365892048	/nfs/dbraw/zinc/89/20/48/1365892048.db2.gz	XQMZJGPWLCXOID-TUCWUAQRSA-N	0	3	343.446	3.238	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)[C@H](CCNCc2cccc(OC)n2)C1	ZINC001104245557	1365966901	/nfs/dbraw/zinc/96/69/01/1365966901.db2.gz	PFLBSVQMJZLJFC-IAGOWNOFSA-N	0	3	345.487	3.021	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)C[C@H](OCC)C(=C)C)C[C@H]1C	ZINC001104255446	1365969250	/nfs/dbraw/zinc/96/92/50/1365969250.db2.gz	UUMVEJAUYYLCBM-OIISXLGYSA-N	0	3	342.911	3.184	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)[C@H](CCNCc2ncc(C)s2)C1	ZINC001104492064	1366046722	/nfs/dbraw/zinc/04/67/22/1366046722.db2.gz	NIXGNOIPDJLEBR-UKRRQHHQSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)[C@H](CCNCc2ccn(C(C)C)n2)C1	ZINC001104493616	1366047810	/nfs/dbraw/zinc/04/78/10/1366047810.db2.gz	HTQLUMYZLRNZIR-IAGOWNOFSA-N	0	3	346.519	3.250	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H](C)[C@H](CCNCc2cc(C)no2)C1	ZINC001104731487	1366149353	/nfs/dbraw/zinc/14/93/53/1366149353.db2.gz	KVRGHJPYWNHICT-GDBMZVCRSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](CNCc3nccs3)[C@H](C)C2)CCC1	ZINC001106635744	1366761768	/nfs/dbraw/zinc/76/17/68/1366761768.db2.gz	AXZDPDJKNOLRLV-HUUCEWRRSA-N	0	3	333.501	3.074	20	30		EGEDHN
CCCC1(C(=O)N2C[C@@H](CNCc3ccccc3C#N)[C@H](C)C2)CC1	ZINC001106642755	1366764041	/nfs/dbraw/zinc/76/40/41/1366764041.db2.gz	XZYNAMRRGARUIX-VQIMIIECSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC[C@H](n2cc(CNCCCCC)nn2)C1	ZINC001185955359	1387835300	/nfs/dbraw/zinc/83/53/00/1387835300.db2.gz	SCYKQXGUSSQTSN-SFHVURJKSA-N	0	3	347.507	3.078	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](CNCc3nccs3)[C@H](C)C2)CCCC1	ZINC001107099019	1366874405	/nfs/dbraw/zinc/87/44/05/1366874405.db2.gz	RMQCXJLERGWCFK-HZPDHXFCSA-N	0	3	347.528	3.464	20	30		EGEDHN
C#CCC1(C(=O)NC[C@]23CCC[C@H]2N(C/C=C\Cl)CC3)CCC1	ZINC001107433727	1366961884	/nfs/dbraw/zinc/96/18/84/1366961884.db2.gz	ADWRUQPMZPWDKE-VUGBWQGVSA-N	0	3	334.891	3.293	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](N(C)Cc2ccc(Cl)c(OC)c2)C1	ZINC001189319154	1366988601	/nfs/dbraw/zinc/98/86/01/1366988601.db2.gz	UWIVAUNHFBHGSY-HNNXBMFYSA-N	0	3	336.863	3.348	20	30		EGEDHN
C=CCOCCCC(=O)N1CC[C@H](N(C)Cc2ccc(C)c(F)c2)C1	ZINC001189573090	1367057684	/nfs/dbraw/zinc/05/76/84/1367057684.db2.gz	BGVUSNQEOGFBDG-SFHVURJKSA-N	0	3	348.462	3.150	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2C[C@H]1CC(C)(C)CO1	ZINC001109343217	1367070315	/nfs/dbraw/zinc/07/03/15/1367070315.db2.gz	OCGJRTKAVVXRGP-NCOADZHNSA-N	0	3	334.504	3.125	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2ccc(F)cc2)C1	ZINC001107691750	1367105065	/nfs/dbraw/zinc/10/50/65/1367105065.db2.gz	CXWGPVLGKFLVJS-HNAYVOBHSA-N	0	3	334.435	3.001	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2cccc(C)c2)C1	ZINC001107711643	1367114175	/nfs/dbraw/zinc/11/41/75/1367114175.db2.gz	JGVZRYWOEPHXFG-PXNSSMCTSA-N	0	3	330.472	3.170	20	30		EGEDHN
CC[C@@H](C)CC(=O)N1CC[C@H](N(C)Cc2ccc(OC)c(C#N)c2)C1	ZINC001189883867	1367123358	/nfs/dbraw/zinc/12/33/58/1367123358.db2.gz	ZHQFDZRNEOHRIF-QAPCUYQASA-N	0	3	343.471	3.036	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccccc1	ZINC001109563539	1367200017	/nfs/dbraw/zinc/20/00/17/1367200017.db2.gz	YASJEBDHEFZFGO-XODKDNOYSA-N	0	3	342.483	3.137	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2ccsc2C)C1	ZINC001107930040	1367207592	/nfs/dbraw/zinc/20/75/92/1367207592.db2.gz	CKPDXVDWYVZSBJ-KDOFPFPSSA-N	0	3	336.501	3.232	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC[C@]1(C)CN(CC2CC(C)(C)C2)CCO1	ZINC001107966194	1367220774	/nfs/dbraw/zinc/22/07/74/1367220774.db2.gz	BQNQQTKBPRHKAU-OAQYLSRUSA-N	0	3	348.531	3.398	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NC[C@@]1(C)CN(CC(CC)CC)CCO1	ZINC001107971271	1367224290	/nfs/dbraw/zinc/22/42/90/1367224290.db2.gz	QHCVMJXPAODAEK-SFHVURJKSA-N	0	3	344.927	3.408	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCc1ccc(OC)cc1	ZINC001109659078	1367267593	/nfs/dbraw/zinc/26/75/93/1367267593.db2.gz	QUCFAWKJACUUJK-HOJAQTOUSA-N	0	3	342.483	3.316	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@@H](N(C)CCc3ccccc3F)C2)CCC1	ZINC001190603473	1367304594	/nfs/dbraw/zinc/30/45/94/1367304594.db2.gz	CXPSCLOTOQMUFT-GOSISDBHSA-N	0	3	342.458	3.095	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@H](C)CC(C)(C)C)C2	ZINC001109759181	1367305129	/nfs/dbraw/zinc/30/51/29/1367305129.db2.gz	PQYSXUOCXSJXJD-MHORFTMASA-N	0	3	336.520	3.373	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2ccoc2C2CC2)C1	ZINC001108162063	1367316875	/nfs/dbraw/zinc/31/68/75/1367316875.db2.gz	OHKCMRRZFXDHGT-FOIQADDNSA-N	0	3	346.471	3.332	20	30		EGEDHN
C=CCCCC(=O)NC[C@@]1(C)CN(CC2CCC(C)CC2)CCO1	ZINC001108168733	1367319897	/nfs/dbraw/zinc/31/98/97/1367319897.db2.gz	DCPMMKAVKYQXOD-QLOJAFMTSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCCC1(C(=O)NC[C@]2(C)CN(CC3CCCC3)CCO2)CC1	ZINC001108186633	1367329948	/nfs/dbraw/zinc/32/99/48/1367329948.db2.gz	RRIAQPJBEOIJND-LJQANCHMSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=CCC1(S(=O)(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)CC1	ZINC001190822524	1367360506	/nfs/dbraw/zinc/36/05/06/1367360506.db2.gz	YXZDORLQDYQIOP-FUHWJXTLSA-N	0	3	348.512	3.068	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2ccc(F)cc2C)C1	ZINC001108353458	1367407075	/nfs/dbraw/zinc/40/70/75/1367407075.db2.gz	IQZVRVGWYNNCTD-JXFKEZNVSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2ccc(C)cc2)C1	ZINC001108362833	1367412382	/nfs/dbraw/zinc/41/23/82/1367412382.db2.gz	SPESALLVMPMIMU-XLIONFOSSA-N	0	3	330.472	3.170	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@H](C)c1ccccc1OC)C2	ZINC001109997875	1367451534	/nfs/dbraw/zinc/45/15/34/1367451534.db2.gz	GUMGZJWLBQAHDT-NBMJBFSESA-N	0	3	342.483	3.486	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001191867994	1367620367	/nfs/dbraw/zinc/62/03/67/1367620367.db2.gz	MKVKVHMTSUOFHU-QFBILLFUSA-N	0	3	325.456	3.193	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@@H](N(C)Cc2cccc(COC)c2)C1	ZINC001191911806	1367634646	/nfs/dbraw/zinc/63/46/46/1367634646.db2.gz	JTOGZWOKBNXCOO-YLJYHZDGSA-N	0	3	344.499	3.468	20	30		EGEDHN
CN1CCC(N(C(=O)c2c(F)cc(C#N)cc2F)C2CCCC2)CC1	ZINC001191928321	1367642581	/nfs/dbraw/zinc/64/25/81/1367642581.db2.gz	RRCDSMPJTOAZHW-UHFFFAOYSA-N	0	3	347.409	3.315	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](N(C)Cc2cccc(NC(C)=O)c2)C1	ZINC001192059629	1367676333	/nfs/dbraw/zinc/67/63/33/1367676333.db2.gz	IFCIIRCYFUMGBP-IBGZPJMESA-N	0	3	343.471	3.034	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](N(C)Cc2cccc(OC)c2C)C1	ZINC001192092770	1367685333	/nfs/dbraw/zinc/68/53/33/1367685333.db2.gz	CMQVWRUYONAFEU-GOSISDBHSA-N	0	3	330.472	3.393	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](N(C)CCOc2cccc(F)c2)C1	ZINC001192161925	1367704245	/nfs/dbraw/zinc/70/42/45/1367704245.db2.gz	LUPZHQKQGNNRDN-YLJYHZDGSA-N	0	3	348.462	3.340	20	30		EGEDHN
CC#CCN1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)CCCF)C1	ZINC001186196280	1387894474	/nfs/dbraw/zinc/89/44/74/1387894474.db2.gz	GOFRVWGPPZUUAL-IEBWSBKVSA-N	0	3	348.437	3.120	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccc2cc[nH]c2c1	ZINC001110494086	1367781216	/nfs/dbraw/zinc/78/12/16/1367781216.db2.gz	HBZQRFOOBBIKEQ-RLLQIKCJSA-N	0	3	335.451	3.193	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCOc1cccc(C)c1C)C2	ZINC001110627814	1367875181	/nfs/dbraw/zinc/87/51/81/1367875181.db2.gz	UKEWQYFKTGIMDP-QRVBRYPASA-N	0	3	342.483	3.370	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1c(C)noc1C(C)C)C2	ZINC001110687307	1367928684	/nfs/dbraw/zinc/92/86/84/1367928684.db2.gz	HTKLBIQTGOSTHB-OAGGEKHMSA-N	0	3	331.460	3.408	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H]1CCC=CCCC1)C2	ZINC001110705743	1367939736	/nfs/dbraw/zinc/93/97/36/1367939736.db2.gz	GNQZFJRCWICBIO-MANSERQUSA-N	0	3	332.488	3.047	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCc1ccc(OC)c(F)c1)C2	ZINC001110803466	1368000625	/nfs/dbraw/zinc/00/06/25/1368000625.db2.gz	WUDGZSBMEZXIMF-NXHRZFHOSA-N	0	3	346.446	3.065	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCc1ccc(OC)cc1	ZINC001110899783	1368073257	/nfs/dbraw/zinc/07/32/57/1368073257.db2.gz	PSWJEJMABFKCLV-QRQLOZEOSA-N	0	3	342.483	3.171	20	30		EGEDHN
C=CCCCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1nc(C)oc1C)C2	ZINC001111177600	1368181937	/nfs/dbraw/zinc/18/19/37/1368181937.db2.gz	DMRYJZZKBXWCNI-ZACQAIPSSA-N	0	3	331.460	3.373	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C(C)(C)CC1CCOCC1)C2	ZINC001111214923	1368193828	/nfs/dbraw/zinc/19/38/28/1368193828.db2.gz	KYEBNWQOMZCBCN-KURKYZTESA-N	0	3	334.504	3.127	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](C)c1ccc(C)s1)C2	ZINC001111275373	1368241753	/nfs/dbraw/zinc/24/17/53/1368241753.db2.gz	UEGXOTLVALJCOO-VQHPVUNQSA-N	0	3	348.512	3.084	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H](O)[C@H](NC(=O)c2cc3ccccc3s2)C1	ZINC001194442576	1368262756	/nfs/dbraw/zinc/26/27/56/1368262756.db2.gz	DNVREHXZMNEAIK-FVQBIDKESA-N	0	3	344.480	3.031	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3CCCOCC)CCCCC1	ZINC001111483458	1368317972	/nfs/dbraw/zinc/31/79/72/1368317972.db2.gz	FJYLGWMACAEOAE-QRVBRYPASA-N	0	3	346.515	3.108	20	30		EGEDHN
C=CCC[C@H](C)N1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cnc(CC)s1)C2	ZINC001111488544	1368320199	/nfs/dbraw/zinc/32/01/99/1368320199.db2.gz	MXHLZDDEFUGMQA-YJNKXOJESA-N	0	3	333.501	3.395	20	30		EGEDHN
C#CCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1cccc(F)c1)C2	ZINC001111729789	1368431845	/nfs/dbraw/zinc/43/18/45/1368431845.db2.gz	DSPRUTWOQBOPSR-PXNSSMCTSA-N	0	3	328.431	3.100	20	30		EGEDHN
C#CCN1C[C@@H]2CCC[C@]2(NC(=O)CCc2ccc(C)c(Cl)c2)C1	ZINC001111825265	1368484824	/nfs/dbraw/zinc/48/48/24/1368484824.db2.gz	WQBRRTMMTNOLJK-PXNSSMCTSA-N	0	3	344.886	3.185	20	30		EGEDHN
CC#CCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1scnc1C)C2	ZINC001111846245	1368500116	/nfs/dbraw/zinc/50/01/16/1368500116.db2.gz	XNKSUVRZFTZIDM-LPHOPBHVSA-N	0	3	345.512	3.116	20	30		EGEDHN
CC#CCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(F)cc1)C2	ZINC001111845865	1368500305	/nfs/dbraw/zinc/50/03/05/1368500305.db2.gz	DLCXGKXGASSEIQ-RXVVDRJESA-N	0	3	342.458	3.490	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)C[C@@H](C)c2cccc(F)c2)C1	ZINC001111868685	1368516261	/nfs/dbraw/zinc/51/62/61/1368516261.db2.gz	ICROCBGYUOYLIC-MMOPVJDHSA-N	0	3	342.458	3.313	20	30		EGEDHN
C=CCC[C@@H](C)N1CCCN(C(=O)c2nc3cccnc3s2)CC1	ZINC001196171709	1368562441	/nfs/dbraw/zinc/56/24/41/1368562441.db2.gz	QHFGWQAEXGLTHB-CQSZACIVSA-N	0	3	344.484	3.194	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N[C@]12CCC[C@H]1CN(Cc1csc(C)c1)C2	ZINC001112018677	1368621301	/nfs/dbraw/zinc/62/13/01/1368621301.db2.gz	KCEJPZFOXNASNE-AYBZRNKSSA-N	0	3	348.512	3.118	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H](C)Cc2cccc(F)c2)C1	ZINC001112019633	1368622363	/nfs/dbraw/zinc/62/23/63/1368622363.db2.gz	GBULBDILFQBNEC-KNBMTAEXSA-N	0	3	330.447	3.161	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2c(C)nn(C)c2C)CC1	ZINC001196697945	1368665669	/nfs/dbraw/zinc/66/56/69/1368665669.db2.gz	NBIPBQYCVRWNRG-UHFFFAOYSA-N	0	3	334.508	3.155	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)CCCC(F)(F)F)C[C@H]1C(F)(F)F	ZINC001112170390	1368698221	/nfs/dbraw/zinc/69/82/21/1368698221.db2.gz	SYCNVRYBCALNOD-GHMZBOCLSA-N	0	3	346.315	3.274	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)CC2(C=C)CCCCC2)C1	ZINC001196860645	1368701611	/nfs/dbraw/zinc/70/16/11/1368701611.db2.gz	MSUMYPYAOYVMKY-RTBURBONSA-N	0	3	348.531	3.421	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2c(F)ccc(F)c2F)CC1	ZINC001196962361	1368721918	/nfs/dbraw/zinc/72/19/18/1368721918.db2.gz	DNRKSBIEBRMLQR-UHFFFAOYSA-N	0	3	326.362	3.218	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H]2CCC[C@]2(CNCc2ccccc2C#N)C1	ZINC001112333033	1368771139	/nfs/dbraw/zinc/77/11/39/1368771139.db2.gz	SSELTEVDGZQGTA-UNMCSNQZSA-N	0	3	349.478	3.080	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2ocnc2C)C1	ZINC001112515361	1368909523	/nfs/dbraw/zinc/90/95/23/1368909523.db2.gz	GHZPSIBNCVGENA-SYNHAJSKSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2cnc(C)o2)C1	ZINC001112515596	1368909896	/nfs/dbraw/zinc/90/98/96/1368909896.db2.gz	SIWCAELDSFZJLO-KNBMTAEXSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H]2CCC[C@]2(CNCc2cc(C)no2)C1	ZINC001112520640	1368911948	/nfs/dbraw/zinc/91/19/48/1368911948.db2.gz	PQTYSNDMFSUAAD-LPHOPBHVSA-N	0	3	331.460	3.058	20	30		EGEDHN
CCCCCCCCCCC(=O)N1CCCN(CCCO)CC1	ZINC001197928357	1368926249	/nfs/dbraw/zinc/92/62/49/1368926249.db2.gz	FMAJUYGZIWPTNQ-UHFFFAOYSA-N	0	3	326.525	3.434	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2c(C)noc2CC)CC1	ZINC001198071648	1368953232	/nfs/dbraw/zinc/95/32/32/1368953232.db2.gz	WIQNJOVAUZFRFE-UHFFFAOYSA-N	0	3	333.476	3.440	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](C2CCN(C(=O)CCOC)CC2)CC1	ZINC001186569318	1387971172	/nfs/dbraw/zinc/97/11/72/1387971172.db2.gz	JLFKDUZNCLEEFL-MRXNPFEDSA-N	0	3	342.911	3.116	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)CCSC)c1ccccc1OC	ZINC001198515701	1369050800	/nfs/dbraw/zinc/05/08/00/1369050800.db2.gz	OWLJTKWOADVITG-MRXNPFEDSA-N	0	3	336.501	3.161	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)CCCc2csc(C)n2)CC1	ZINC001112858477	1369051349	/nfs/dbraw/zinc/05/13/49/1369051349.db2.gz	FXXVDAPBROQWIU-OAHLLOKOSA-N	0	3	335.517	3.273	20	30		EGEDHN
C=CCCCCCN1CCN(C(=O)C[C@@H](C)n2ccnc2CC)CC1	ZINC001112865037	1369056574	/nfs/dbraw/zinc/05/65/74/1369056574.db2.gz	PTBCLPIFSFBCLM-GOSISDBHSA-N	0	3	346.519	3.287	20	30		EGEDHN
C=CCOCC(=O)NC[C@@H](NCC/C=C/CC)c1ccccc1OC	ZINC001198605879	1369071537	/nfs/dbraw/zinc/07/15/37/1369071537.db2.gz	LCHXRDZAXFTPMM-IPLHWJFFSA-N	0	3	346.471	3.001	20	30		EGEDHN
C=CCC[C@H](C)N[C@@H](CNC(=O)CCOCC)c1ccccc1OC	ZINC001198606278	1369072061	/nfs/dbraw/zinc/07/20/61/1369072061.db2.gz	PSGSTMBJMFFZAI-WMZOPIPTSA-N	0	3	348.487	3.223	20	30		EGEDHN
COc1ccccc1[C@H](CNC(=O)[C@H](C)C#N)NCCCC(C)(C)C	ZINC001198617775	1369074621	/nfs/dbraw/zinc/07/46/21/1369074621.db2.gz	SCTMCJXWKIPJQV-WBVHZDCISA-N	0	3	345.487	3.428	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)c1ocnc1C)c1ccccc1OC	ZINC001198646087	1369080556	/nfs/dbraw/zinc/08/05/56/1369080556.db2.gz	COBWEWNEUFVVNI-MRXNPFEDSA-N	0	3	343.427	3.019	20	30		EGEDHN
C#CCCCCC(=O)NC[C@H](NCC[C@@H](C)F)c1ccccc1OC	ZINC001198677914	1369089032	/nfs/dbraw/zinc/08/90/32/1369089032.db2.gz	VERHSZVPKMFHBA-AEFFLSMTSA-N	0	3	348.462	3.384	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)c1cc[nH]c1CC)c1ccccc1OC	ZINC001198703634	1369094335	/nfs/dbraw/zinc/09/43/35/1369094335.db2.gz	HUOUOXQKCMPXMW-GOSISDBHSA-N	0	3	341.455	3.223	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)C#CC(C)(C)C)c1ccccc1OC	ZINC001198724601	1369100934	/nfs/dbraw/zinc/10/09/34/1369100934.db2.gz	YSNJQCMUHUXNTI-GOSISDBHSA-N	0	3	342.483	3.458	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)c1cc(F)c[nH]1)c1ccccc1OC	ZINC001198795131	1369115945	/nfs/dbraw/zinc/11/59/45/1369115945.db2.gz	AQOMSBKYJDMPRR-KRWDZBQOSA-N	0	3	345.418	3.189	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)[C@H]2CCN(C)c3ccccc32)CC1	ZINC001112977232	1369120920	/nfs/dbraw/zinc/12/09/20/1369120920.db2.gz	SEXJAURQSYKCRN-MJGOQNOKSA-N	0	3	341.499	3.109	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@H](NCC[C@H](C)F)c1ccccc1OC	ZINC001198835051	1369125776	/nfs/dbraw/zinc/12/57/76/1369125776.db2.gz	QVBWEFYYBWYSPH-HOCLYGCPSA-N	0	3	336.451	3.402	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)[C@@H](F)C(C)C)c1ccccc1OC	ZINC001198843997	1369128339	/nfs/dbraw/zinc/12/83/39/1369128339.db2.gz	YWYIFWISDZUZLQ-WMZOPIPTSA-N	0	3	336.451	3.402	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)C(C)(C)C1CC1)c1ccccc1OC	ZINC001198857246	1369131824	/nfs/dbraw/zinc/13/18/24/1369131824.db2.gz	NUORAPSUFCJCEB-KRWDZBQOSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H](NCCCOCC)c1ccccc1OC	ZINC001198875517	1369136087	/nfs/dbraw/zinc/13/60/87/1369136087.db2.gz	BKJMMZGUZHUEDA-GOSISDBHSA-N	0	3	348.487	3.225	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@H](CC(C)C)OC)c1ccccc1OC	ZINC001198885443	1369139204	/nfs/dbraw/zinc/13/92/04/1369139204.db2.gz	HYZUSYJCASDKPE-MJGOQNOKSA-N	0	3	348.487	3.079	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)c1nccs1)c1ccccc1OC	ZINC001198944975	1369154439	/nfs/dbraw/zinc/15/44/39/1369154439.db2.gz	JCJNIUDVTZSKNY-HNNXBMFYSA-N	0	3	345.468	3.179	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)C[C@@H](C)COC)c1ccccc1OC	ZINC001198945724	1369155529	/nfs/dbraw/zinc/15/55/29/1369155529.db2.gz	PRKRBDVZYFNMPG-AEFFLSMTSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)C[C@@H](C)C1CC1)c1ccccc1OC	ZINC001198992520	1369167414	/nfs/dbraw/zinc/16/74/14/1369167414.db2.gz	BVHRTFAQEBDNGK-CRAIPNDOSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@H](CCCC)C(C)C)C1	ZINC001199153217	1369185160	/nfs/dbraw/zinc/18/51/60/1369185160.db2.gz	GGDUNEDBRXWOIS-GUDVDZBRSA-N	0	3	338.536	3.357	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@@]2(C)CCC(C)=C(C)C2)C1	ZINC001199225934	1369194590	/nfs/dbraw/zinc/19/45/90/1369194590.db2.gz	CMLHEZUSBDMFPU-SBHAEUEKSA-N	0	3	348.531	3.421	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N1CCN(CC2CCCCCC2)CC1	ZINC001113164482	1369237584	/nfs/dbraw/zinc/23/75/84/1369237584.db2.gz	PTBYOKRWXGKRDV-FQEVSTJZSA-N	0	3	336.520	3.330	20	30		EGEDHN
C#CCCCCC(=O)N1CCC(NCc2oc(CCC)nc2C)CC1	ZINC001200147869	1369320832	/nfs/dbraw/zinc/32/08/32/1369320832.db2.gz	HLAACJFMSSWWEG-UHFFFAOYSA-N	0	3	345.487	3.210	20	30		EGEDHN
C#CCCCC(=O)N1CCC(NCc2c(Cl)cccc2OC)CC1	ZINC001200325258	1369349185	/nfs/dbraw/zinc/34/91/85/1369349185.db2.gz	QJDBEMSSKSBULJ-UHFFFAOYSA-N	0	3	348.874	3.233	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC(NCc2oc(CCC)nc2C)CC1	ZINC001200816079	1369433693	/nfs/dbraw/zinc/43/36/93/1369433693.db2.gz	OPJAKZFXVQBKQK-UHFFFAOYSA-N	0	3	333.476	3.372	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CCC(NC/C(Cl)=C\Cl)CC1)OCC	ZINC001200850000	1369438870	/nfs/dbraw/zinc/43/88/70/1369438870.db2.gz	DPAJXLDPHLJTSQ-VOMSXAGXSA-N	0	3	349.302	3.257	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)CCCOc2ccccc2F)CC1	ZINC001113674599	1369559901	/nfs/dbraw/zinc/55/99/01/1369559901.db2.gz	AQUUYEWJRBSUNO-KRWDZBQOSA-N	0	3	348.462	3.484	20	30		EGEDHN
CC#CCNC[C@@H]1CN(C(=O)[C@H](CC)CC2CCCCC2)CCCO1	ZINC001201547096	1369571859	/nfs/dbraw/zinc/57/18/59/1369571859.db2.gz	PPHIKFSIOHJSSX-WOJBJXKFSA-N	0	3	348.531	3.213	20	30		EGEDHN
C#CC[C@H](CC(=O)N1CCN(C[C@@H](C)CC)CC1)c1ccccc1	ZINC001113736620	1369596008	/nfs/dbraw/zinc/59/60/08/1369596008.db2.gz	MDTUZBVVFJGOLK-AZUAARDMSA-N	0	3	326.484	3.374	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)Nc1cccc(C(F)(F)F)c1	ZINC001202300603	1369733366	/nfs/dbraw/zinc/73/33/66/1369733366.db2.gz	PFJYMJPNXZVBIP-AWEZNQCLSA-N	0	3	327.350	3.477	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC(NCc3ccn(C(C)C)n3)CC2)CC1	ZINC001202365832	1369751568	/nfs/dbraw/zinc/75/15/68/1369751568.db2.gz	XZGUSKRXJHVAHV-UHFFFAOYSA-N	0	3	344.503	3.291	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)Nc1ccc(C(F)(F)F)cc1	ZINC001202418983	1369767573	/nfs/dbraw/zinc/76/75/73/1369767573.db2.gz	BKHBTYZYYCLLNF-AWEZNQCLSA-N	0	3	327.350	3.477	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)CCCC)C12CCC2	ZINC001202489475	1369788661	/nfs/dbraw/zinc/78/86/61/1369788661.db2.gz	LBMDSBPPDRVJAC-QWHCGFSZSA-N	0	3	329.282	3.102	20	30		EGEDHN
CCC(CC)C(=O)N[C@@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202522950	1369798557	/nfs/dbraw/zinc/79/85/57/1369798557.db2.gz	RLAXPCPVYKCKAV-VQTJNVASSA-N	0	3	338.495	3.491	20	30		EGEDHN
CCCC[C@@H](CNc1cccc(F)c1C#N)NC(=O)[C@@H](CC)N(C)C	ZINC001114272097	1369841872	/nfs/dbraw/zinc/84/18/72/1369841872.db2.gz	JMEVDEQPCBHRKG-KBXCAEBGSA-N	0	3	348.466	3.124	20	30		EGEDHN
O=C(/C=C\C1CC1)N[C@@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202713328	1369862360	/nfs/dbraw/zinc/86/23/60/1369862360.db2.gz	LYWWPNUZEMHJJY-CVLRPEOSSA-N	0	3	334.463	3.021	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202786276	1369891645	/nfs/dbraw/zinc/89/16/45/1369891645.db2.gz	UKKABTSJJXIJPF-RTWAWAEBSA-N	0	3	348.490	3.249	20	30		EGEDHN
N#Cc1cccc(NC(=O)N2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC001202788411	1369892788	/nfs/dbraw/zinc/89/27/88/1369892788.db2.gz	NWQSUEUGKSVNPV-QUCCMNQESA-N	0	3	346.434	3.296	20	30		EGEDHN
CC/C(C)=C\C(=O)N[C@@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202887857	1369918057	/nfs/dbraw/zinc/91/80/57/1369918057.db2.gz	MMZLUJKQVMVDQK-SBCIKOMTSA-N	0	3	336.479	3.411	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1C[C@H](NCc2ocnc2C)C12CCC2	ZINC001202969074	1369940820	/nfs/dbraw/zinc/94/08/20/1369940820.db2.gz	NCCLXCHRRZVJEE-HOTGVXAUSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)C(C)(C)CC(F)F)C12CCC2	ZINC001203035439	1369962358	/nfs/dbraw/zinc/96/23/58/1369962358.db2.gz	BBWKQZSRVBAMIY-NEPJUHHUSA-N	0	3	334.838	3.437	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(CF)cc3)C[C@H]21	ZINC001114722148	1370044830	/nfs/dbraw/zinc/04/48/30/1370044830.db2.gz	CIJORPNQSGSKRQ-OAOYMFHYSA-N	0	3	330.447	3.305	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1C[C@@H](NCC(=C)Br)C12CCC2	ZINC001203275286	1370055924	/nfs/dbraw/zinc/05/59/24/1370055924.db2.gz	SBMHSQHDISEEQL-OLZOCXBDSA-N	0	3	341.293	3.124	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1C[C@@H](NCc2oc(C)nc2C)C12CCC2	ZINC001203280785	1370059253	/nfs/dbraw/zinc/05/92/53/1370059253.db2.gz	JWLTVAAJYLGCAD-QZTJIDSGSA-N	0	3	343.471	3.002	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1[C@H]2CN([C@H](C)c3cccc(OC)c3)C[C@H]21	ZINC001114759049	1370065371	/nfs/dbraw/zinc/06/53/71/1370065371.db2.gz	AYCDDOQEIZOQFK-QKUWSGOFSA-N	0	3	328.456	3.159	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)C(C)(C)CC)C12CCC2	ZINC001203332837	1370086308	/nfs/dbraw/zinc/08/63/08/1370086308.db2.gz	QAEQKRLFYYZYBJ-QWHCGFSZSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2C[C@@H](NCc3cnoc3C)C23CCC3)CC1	ZINC001203372425	1370102601	/nfs/dbraw/zinc/10/26/01/1370102601.db2.gz	FAUACKVFXJUWOY-IAGOWNOFSA-N	0	3	343.471	3.246	20	30		EGEDHN
CCC[C@@H](C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21)C(C)C	ZINC001114904290	1370139643	/nfs/dbraw/zinc/13/96/43/1370139643.db2.gz	RHJMBHOSPLSQTM-ZRNYENFQSA-N	0	3	339.483	3.177	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)CCc2ccccc2)C12CCC2	ZINC001203650560	1370201469	/nfs/dbraw/zinc/20/14/69/1370201469.db2.gz	IIPGGXLKDBAJRL-IRXDYDNUSA-N	0	3	332.875	3.389	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)C(C)(C)C(C)(F)F)C12CCC2	ZINC001203670588	1370210376	/nfs/dbraw/zinc/21/03/76/1370210376.db2.gz	PWWNIDOUNQCQIB-VXGBXAGGSA-N	0	3	334.838	3.437	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CC2)NC(=O)C[C@H]3c2ccccc2)cc1	ZINC001203902237	1370306770	/nfs/dbraw/zinc/30/67/70/1370306770.db2.gz	XQCBSEKVPWLHLY-FQEVSTJZSA-N	0	3	345.446	3.197	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2[C@H]3CN(CCOCCCC)C[C@H]32)CCCCC1	ZINC001115277621	1370356047	/nfs/dbraw/zinc/35/60/47/1370356047.db2.gz	DOGNHUSIIFHBJU-BWTSREIZSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H]2CN([C@@H](C)c3cccc(OC)c3)C[C@H]21	ZINC001187198126	1388069644	/nfs/dbraw/zinc/06/96/44/1388069644.db2.gz	BHEFJEFCCOVGJV-VDZJLULYSA-N	0	3	328.456	3.255	20	30		EGEDHN
N#Cc1ccc(F)c(CNC2(CNC(=O)CC3CC3)CCCCC2)c1	ZINC001115377851	1370416817	/nfs/dbraw/zinc/41/68/17/1370416817.db2.gz	FWIJCFDGXBUVEI-UHFFFAOYSA-N	0	3	343.446	3.406	20	30		EGEDHN
C=CCOc1ccc(CN2CC[C@@H](Oc3cccc(OC)n3)C2)cc1	ZINC001204302937	1370437577	/nfs/dbraw/zinc/43/75/77/1370437577.db2.gz	XAZDXTCESACBAS-GOSISDBHSA-N	0	3	340.423	3.308	20	30		EGEDHN
CS[C@H](C)C(=O)NCC1(NCC#Cc2ccccc2)CCCCC1	ZINC001115419375	1370444194	/nfs/dbraw/zinc/44/41/94/1370444194.db2.gz	PZZRXXUHXQCMGU-QGZVFWFLSA-N	0	3	344.524	3.198	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H](C)OCCCC)CCCCC1	ZINC001115436980	1370452107	/nfs/dbraw/zinc/45/21/07/1370452107.db2.gz	XIJSBRNRAZTYTM-OAHLLOKOSA-N	0	3	330.900	3.353	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCC1(NCc2cccc(F)c2F)CCCCC1	ZINC001115451932	1370459107	/nfs/dbraw/zinc/45/91/07/1370459107.db2.gz	LBHGNEYJQJGLDM-ZDUSSCGKSA-N	0	3	335.398	3.033	20	30		EGEDHN
C=CCN1C(=O)CC[C@@]12CCCN(Cc1ccc(F)c(OC)c1)CC2	ZINC001204558672	1370514840	/nfs/dbraw/zinc/51/48/40/1370514840.db2.gz	DWOACACLUBOVRL-HXUWFJFHSA-N	0	3	346.446	3.367	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCC1(NCc2cnoc2C)CCCCC1	ZINC001115554915	1370552465	/nfs/dbraw/zinc/55/24/65/1370552465.db2.gz	RHOXNQOLQBCSFI-UHFFFAOYSA-N	0	3	333.476	3.494	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CC(C)(C)COC)CCCCC1	ZINC001115645449	1370635124	/nfs/dbraw/zinc/63/51/24/1370635124.db2.gz	LNLBCKXAUFMEON-UHFFFAOYSA-N	0	3	330.900	3.210	20	30		EGEDHN
C=CCCCC(=O)NCC1(NCc2cc(OC)ccn2)CCCCC1	ZINC001115701545	1370682564	/nfs/dbraw/zinc/68/25/64/1370682564.db2.gz	UEAXTDJJWVIGAG-UHFFFAOYSA-N	0	3	345.487	3.355	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)/C(C)=C/CC)CC[C@H]1c1ccc(F)cc1	ZINC001205256229	1370697554	/nfs/dbraw/zinc/69/75/54/1370697554.db2.gz	DECCMEKWFQJLMA-XPWWRUNISA-N	0	3	342.458	3.479	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)/C(C)=C/CC)CC[C@H]1c1ccc(F)cc1	ZINC001205257713	1370697995	/nfs/dbraw/zinc/69/79/95/1370697995.db2.gz	XDWXUMLZBBRRFK-MRGXFPJMSA-N	0	3	328.431	3.089	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)/C=C(/C)CC)CC[C@H]1c1ccc(F)cc1	ZINC001205276392	1370703853	/nfs/dbraw/zinc/70/38/53/1370703853.db2.gz	VRFDXRYGNBLWGO-GCAXBUKTSA-N	0	3	328.431	3.089	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@H](F)C(C)C)CC[C@H]1c1ccc(F)cc1	ZINC001205300765	1370712506	/nfs/dbraw/zinc/71/25/06/1370712506.db2.gz	VYRXLNPALNIRRA-IPMKNSEASA-N	0	3	348.437	3.117	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)/C=C(\C)CC)C[C@H]1c1cccc(F)c1	ZINC001205406940	1370745997	/nfs/dbraw/zinc/74/59/97/1370745997.db2.gz	ZOBGCIANMXFHET-YOYDVCCWSA-N	0	3	328.431	3.089	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H](C)C(CC)CC)C[C@H]1c1cccc(F)c1	ZINC001205417126	1370748320	/nfs/dbraw/zinc/74/83/20/1370748320.db2.gz	PRKSYDCBUKTXKB-RYGJVYDSSA-N	0	3	344.474	3.415	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cnoc2C2CC2)CCCCC1	ZINC001115802340	1370785467	/nfs/dbraw/zinc/78/54/67/1370785467.db2.gz	QOQXHALHKSLUGD-UHFFFAOYSA-N	0	3	337.851	3.327	20	30		EGEDHN
CCCN1CCCC[C@H]1C(=O)NCc1cccc(O[C@@H](C#N)CC)c1	ZINC001116060167	1370829649	/nfs/dbraw/zinc/82/96/49/1370829649.db2.gz	BSMBSBPZGIWNTR-MJGOQNOKSA-N	0	3	343.471	3.248	20	30		EGEDHN
CC#CCCCC(=O)N1CCC(CNCc2csc(CC)n2)CC1	ZINC001205955983	1370922607	/nfs/dbraw/zinc/92/26/07/1370922607.db2.gz	XLMIUNQMHVNEFZ-UHFFFAOYSA-N	0	3	347.528	3.227	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC(CN[C@H](C)c3cnccn3)CC2)CC1	ZINC001206181776	1370983309	/nfs/dbraw/zinc/98/33/09/1370983309.db2.gz	RFPLHIAHUJYFFF-MRXNPFEDSA-N	0	3	342.487	3.112	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N[C@@H]1CN(Cc2ccc(C)c(C)c2)C[C@H]1C	ZINC001206485926	1371069335	/nfs/dbraw/zinc/06/93/35/1371069335.db2.gz	PBZVZFBYRQTFMP-WSTZPKSXSA-N	0	3	344.499	3.221	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N[C@@H]1CN(Cc2ccc(CF)cc2)C[C@H]1C	ZINC001206485335	1371069689	/nfs/dbraw/zinc/06/96/89/1371069689.db2.gz	IEPFNRWYLNLHHG-JTDSTZFVSA-N	0	3	348.462	3.074	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CN(CCOc2cc(C)ccc2C)C[C@H]1C	ZINC001206509492	1371078384	/nfs/dbraw/zinc/07/83/84/1371078384.db2.gz	MVCSRSKMFGVFCP-QZTJIDSGSA-N	0	3	330.472	3.085	20	30		EGEDHN
Cc1ccc(-c2nn(C)cc2CNCc2cccc(OCC#N)c2)o1	ZINC001118237620	1371151370	/nfs/dbraw/zinc/15/13/70/1371151370.db2.gz	FLPPPCSJGMKQJC-UHFFFAOYSA-N	0	3	336.395	3.181	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CN(C[C@@H](OC)c2ccccc2)C[C@H]1C	ZINC001206884950	1371206412	/nfs/dbraw/zinc/20/64/12/1371206412.db2.gz	MTVWDNGMKUMHOD-MISYRCLQSA-N	0	3	342.483	3.004	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1CN([C@H]2CCCc3ccc(F)cc32)C[C@H]1C	ZINC001206946121	1371238882	/nfs/dbraw/zinc/23/88/82/1371238882.db2.gz	LCCOEVYWZPSDRI-YSGRDPCXSA-N	0	3	342.458	3.299	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1CN([C@@H]2CCCc3ccc(F)cc32)C[C@H]1C	ZINC001206946120	1371239096	/nfs/dbraw/zinc/23/90/96/1371239096.db2.gz	LCCOEVYWZPSDRI-CDHQVMDDSA-N	0	3	342.458	3.299	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H]1CN(CCOCCC(C)C)C[C@H]1C	ZINC001207113907	1371297643	/nfs/dbraw/zinc/29/76/43/1371297643.db2.gz	MYXQIMYJGQJHNJ-GDBMZVCRSA-N	0	3	344.927	3.264	20	30		EGEDHN
COCCN(CC[C@@](C#N)(C(C)=O)c1ccccc1)C1CCCC1	ZINC001119305507	1371303299	/nfs/dbraw/zinc/30/32/99/1371303299.db2.gz	BLSWCKMWCLAQKT-HXUWFJFHSA-N	0	3	328.456	3.318	20	30		EGEDHN
CCC(CC)C(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207373949	1371377445	/nfs/dbraw/zinc/37/74/45/1371377445.db2.gz	LOJLNACNFOVQCI-IBGZPJMESA-N	0	3	330.447	3.194	20	30		EGEDHN
CCC(CC)C(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207373950	1371378272	/nfs/dbraw/zinc/37/82/72/1371378272.db2.gz	LOJLNACNFOVQCI-LJQANCHMSA-N	0	3	330.447	3.194	20	30		EGEDHN
CC(C)[C@@H](C)CC(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207645153	1371462700	/nfs/dbraw/zinc/46/27/00/1371462700.db2.gz	KLJCYXZEFARDSK-PXNSSMCTSA-N	0	3	344.474	3.440	20	30		EGEDHN
C[C@H](CCCC(C)(C)O)CCN1CCN(c2cc(C#N)ccn2)CC1	ZINC001207677930	1371472038	/nfs/dbraw/zinc/47/20/38/1371472038.db2.gz	AHCZLYTZWKDPPK-QGZVFWFLSA-N	0	3	344.503	3.043	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1CCC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001207717601	1371484250	/nfs/dbraw/zinc/48/42/50/1371484250.db2.gz	JJTDHMKZHVQCOG-RHSMWYFYSA-N	0	3	331.435	3.214	20	30		EGEDHN
CCC[C@H](C)C(=O)N1CCC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001207717604	1371484709	/nfs/dbraw/zinc/48/47/09/1371484709.db2.gz	JJTDHMKZHVQCOG-YOEHRIQHSA-N	0	3	331.435	3.214	20	30		EGEDHN
O=C([C@H]1[C@@H]2CCCC[C@@H]21)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001207743838	1371491583	/nfs/dbraw/zinc/49/15/83/1371491583.db2.gz	GSAYYOQUAZVKAB-UWHLTILDSA-N	0	3	336.479	3.055	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H](NCC#Cc2cccc(Cl)c2)C1)C1CC1	ZINC001207754747	1371495212	/nfs/dbraw/zinc/49/52/12/1371495212.db2.gz	QXIATMDCANQXNP-HNAYVOBHSA-N	0	3	344.886	3.318	20	30		EGEDHN
O=C(CCC1CCC1)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207758762	1371495843	/nfs/dbraw/zinc/49/58/43/1371495843.db2.gz	GTJDOPQLOUSOMK-FQEVSTJZSA-N	0	3	342.458	3.338	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC[C@@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207763567	1371497603	/nfs/dbraw/zinc/49/76/03/1371497603.db2.gz	FBFOVDGTKWUKQN-TUEGSCMLSA-N	0	3	330.859	3.238	20	30		EGEDHN
O=C(Cc1ccc[nH]1)NCC1(NCC#Cc2ccccc2)CCCCC1	ZINC001120175513	1371499324	/nfs/dbraw/zinc/49/93/24/1371499324.db2.gz	CVHKCPZCXYGWRA-UHFFFAOYSA-N	0	3	349.478	3.018	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N1CCC[C@@H](NCC#Cc2ccccc2Cl)C1	ZINC001207820051	1371513554	/nfs/dbraw/zinc/51/35/54/1371513554.db2.gz	OJTPMLMKTKFANE-SJORKVTESA-N	0	3	344.886	3.318	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)C#CC(C)(C)C)C1	ZINC001120372804	1371551746	/nfs/dbraw/zinc/55/17/46/1371551746.db2.gz	JFKIHEHGEBWYDI-SJORKVTESA-N	0	3	336.907	3.491	20	30		EGEDHN
N#Cc1ccc(C(=O)N[C@H](CN2CCCC2)c2ccccc2)c(F)c1	ZINC001120555390	1371609859	/nfs/dbraw/zinc/60/98/59/1371609859.db2.gz	XXYWEFRHBRKHBH-LJQANCHMSA-N	0	3	337.398	3.264	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC[C@H](NCc2cncc(F)c2)C1	ZINC001208194279	1371634082	/nfs/dbraw/zinc/63/40/82/1371634082.db2.gz	OZTWSLHLLYYBGW-SFHVURJKSA-N	0	3	331.435	3.070	20	30		EGEDHN
O=C([C@@H]1CCC(F)(F)C1)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001208296091	1371705016	/nfs/dbraw/zinc/70/50/16/1371705016.db2.gz	LWWMDXGUEIMYJP-QZTJIDSGSA-N	0	3	346.421	3.054	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN(Cc2ccc3c(c2)CCC3)C[C@H]1C	ZINC001208309794	1371710726	/nfs/dbraw/zinc/71/07/26/1371710726.db2.gz	XLRLEIBYLBWJBJ-DNVCBOLYSA-N	0	3	326.484	3.324	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN(CCOc2cc(C)cc(C)c2)C[C@H]1C	ZINC001208318323	1371715220	/nfs/dbraw/zinc/71/52/20/1371715220.db2.gz	SPDSVDSYKKYLQT-IEBWSBKVSA-N	0	3	344.499	3.331	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CN(CCc2scnc2C)C[C@H]1C	ZINC001208388978	1371747930	/nfs/dbraw/zinc/74/79/30/1371747930.db2.gz	VJDUNDKUWBDRIV-SQWLQELKSA-N	0	3	335.517	3.033	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2CCC[C@@H](NC[C@@H](F)CC)C2)cc1	ZINC001208433223	1371765347	/nfs/dbraw/zinc/76/53/47/1371765347.db2.gz	VNZHCTYXCYXDME-DLBZAZTESA-N	0	3	334.435	3.194	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1CN(CCc2ccccc2F)C[C@H]1C	ZINC001208512098	1371794935	/nfs/dbraw/zinc/79/49/35/1371794935.db2.gz	WHWMETRIMPITIC-XFQXTVEOSA-N	0	3	332.463	3.407	20	30		EGEDHN
CC1(CC(=O)N2CCC[C@@H](NCC#Cc3ccccc3Cl)C2)CC1	ZINC001208595576	1371834219	/nfs/dbraw/zinc/83/42/19/1371834219.db2.gz	SZECVIZANCJIMN-QGZVFWFLSA-N	0	3	344.886	3.462	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N1CCC[C@@H](NCC=C(Cl)Cl)C1	ZINC001208796865	1371899153	/nfs/dbraw/zinc/89/91/53/1371899153.db2.gz	OCXHXRYCRRQUPE-CZUORRHYSA-N	0	3	349.302	3.115	20	30		EGEDHN
N#Cc1ccc(N2CCN(CCCc3cccc(C#N)c3)CC2)cc1	ZINC001208853364	1371918265	/nfs/dbraw/zinc/91/82/65/1371918265.db2.gz	JEFRPIYKLFGPRY-UHFFFAOYSA-N	0	3	330.435	3.185	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@]1(C)CCCN(CCc2ccc(C#N)cc2)C1	ZINC001208920736	1371945052	/nfs/dbraw/zinc/94/50/52/1371945052.db2.gz	NTERSNIHXKOEMB-FQEVSTJZSA-N	0	3	343.471	3.480	20	30		EGEDHN
C[C@H]1CC[C@@H](NC(=O)OC(C)(C)C)CN1CCc1ccc(C#N)cc1	ZINC001208927659	1371948328	/nfs/dbraw/zinc/94/83/28/1371948328.db2.gz	NYGYRWFHKCDUKO-MAUKXSAKSA-N	0	3	343.471	3.478	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CCC[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001209015434	1371974970	/nfs/dbraw/zinc/97/49/70/1371974970.db2.gz	BBZUYHADMCRQRI-DLBZAZTESA-N	0	3	336.838	3.020	20	30		EGEDHN
CC[C@H](F)C(=O)N1CCC[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001209017398	1371975880	/nfs/dbraw/zinc/97/58/80/1371975880.db2.gz	KYOFJMQQUATCMS-RDJZCZTQSA-N	0	3	336.838	3.020	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CC2(CC(NCc3nc(C)c(C)s3)C2)C1	ZINC001121514519	1371995955	/nfs/dbraw/zinc/99/59/55/1371995955.db2.gz	CHSHHTGIPGBZPS-UHFFFAOYSA-N	0	3	347.528	3.489	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@H](NCC#Cc3ccc(F)cc3)C2)CCC1	ZINC001209100263	1371997532	/nfs/dbraw/zinc/99/75/32/1371997532.db2.gz	HPLSHRTVJLQZER-IBGZPJMESA-N	0	3	342.458	3.338	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@H](NCc2ccnc(Cl)c2)C1	ZINC001209145738	1372013803	/nfs/dbraw/zinc/01/38/03/1372013803.db2.gz	HBBFCJIUMACNIZ-GOEBONIOSA-N	0	3	335.879	3.418	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@@H](NCc2c(C)nsc2C)C1	ZINC001209147140	1372015143	/nfs/dbraw/zinc/01/51/43/1372015143.db2.gz	SUZLUWVKFXQHKQ-CZUORRHYSA-N	0	3	335.517	3.443	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC1CC2(CC(NCc3nccs3)C2)C1	ZINC001121610217	1372023743	/nfs/dbraw/zinc/02/37/43/1372023743.db2.gz	JICNZQQSFKGMIF-RWQKBRBCSA-N	0	3	333.501	3.262	20	30		EGEDHN
CC(C)(C(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1)C1CC1	ZINC001209185252	1372030547	/nfs/dbraw/zinc/03/05/47/1372030547.db2.gz	VJTIBXZJVITKRC-LJQANCHMSA-N	0	3	342.458	3.194	20	30		EGEDHN
O=C(N1CCC[C@@H](NCC#Cc2ccccc2)C1)C1(C(F)F)CCC1	ZINC001209223117	1372042434	/nfs/dbraw/zinc/04/24/34/1372042434.db2.gz	QBXSRHWOMNPZKV-QGZVFWFLSA-N	0	3	346.421	3.054	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@H](CC)Oc2cccc(C)c2)C1	ZINC001209379385	1372083109	/nfs/dbraw/zinc/08/31/09/1372083109.db2.gz	ALJZRENTAPUHDW-QRQLOZEOSA-N	0	3	330.472	3.165	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)[C@@H](C)Cc1ccco1)C2	ZINC001121908877	1372120559	/nfs/dbraw/zinc/12/05/59/1372120559.db2.gz	RIEUDIWLAGGYRG-VOZVFBJVSA-N	0	3	336.863	3.228	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)Nc1cc(C2CCOCC2)[nH]n1	ZINC001121968236	1372137814	/nfs/dbraw/zinc/13/78/14/1372137814.db2.gz	UXXMZMIBKTVKCU-OAHLLOKOSA-N	0	3	336.480	3.320	20	30		EGEDHN
COc1c(Cl)ccc(CN2CCC3SC(=O)C=C3C2)c1F	ZINC001209697930	1372173411	/nfs/dbraw/zinc/17/34/11/1372173411.db2.gz	WKEHEHAQMLRNPQ-GFCCVEGCSA-N	0	3	327.808	3.262	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)CC[C@H]1CC[C@@H](C)O1)C2	ZINC001122219482	1372204430	/nfs/dbraw/zinc/20/44/30/1372204430.db2.gz	GVEJCCQLXSZMFJ-ZHIXCNEBSA-N	0	3	340.895	3.104	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)CC#Cc1ccccc1)C2	ZINC001122230990	1372206822	/nfs/dbraw/zinc/20/68/22/1372206822.db2.gz	ANQXERIJOCOFRK-UHFFFAOYSA-N	0	3	342.870	3.198	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001209867417	1372217456	/nfs/dbraw/zinc/21/74/56/1372217456.db2.gz	YQFZCUNWJROYSA-QGZVFWFLSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@@H](NCc2cn(C(C)C)nc2C)C1	ZINC001209875883	1372220660	/nfs/dbraw/zinc/22/06/60/1372220660.db2.gz	VDUOFBYZEIBLFZ-GOSISDBHSA-N	0	3	346.519	3.455	20	30		EGEDHN
CC1(CCC(=O)N2CCC[C@H](NCc3ccc(C#N)c(F)c3)C2)CC1	ZINC001210465665	1372360674	/nfs/dbraw/zinc/36/06/74/1372360674.db2.gz	VMOKGRJYBZQLFW-KRWDZBQOSA-N	0	3	343.446	3.358	20	30		EGEDHN
CCc1c(C(=O)C(C#N)c2ncc(Cl)n2C)cnn1C1CCCC1	ZINC001123338107	1372431903	/nfs/dbraw/zinc/43/19/03/1372431903.db2.gz	YDEYTLBTBDCYEI-LBPRGKRZSA-N	0	3	345.834	3.438	20	30		EGEDHN
C=C(CN1CCCCC1)c1nc(-c2cccc(-n3cccn3)c2)no1	ZINC001211436117	1372558854	/nfs/dbraw/zinc/55/88/54/1372558854.db2.gz	BFZHPJXLZLREGY-UHFFFAOYSA-N	0	3	335.411	3.421	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H](c2ccccc2)[C@H](NCC#CC)C1	ZINC001211607568	1372589777	/nfs/dbraw/zinc/58/97/77/1372589777.db2.gz	JICYWCSHRSGZAH-LEWJYISDSA-N	0	3	336.479	3.362	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CN([C@@H]2CCc3ccccc32)C[C@H]1OC	ZINC001212338446	1372690613	/nfs/dbraw/zinc/69/06/13/1372690613.db2.gz	KYUOPFDRMNHWBT-GUDVDZBRSA-N	0	3	342.483	3.092	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H](NC(=O)c2ccc(CC)s2)[C@H](OC)C1	ZINC001213133698	1372846616	/nfs/dbraw/zinc/84/66/16/1372846616.db2.gz	UTEWALQYZOGUEY-NUEKZKHPSA-N	0	3	336.501	3.094	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CN(CCCc2ccccc2)C[C@H]1OC	ZINC001213263083	1372870703	/nfs/dbraw/zinc/87/07/03/1372870703.db2.gz	VVYPVASBQITSKU-RTBURBONSA-N	0	3	344.499	3.037	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN(CC/C=C/c2ccccc2)C[C@H]1OC	ZINC001213271181	1372871877	/nfs/dbraw/zinc/87/18/77/1372871877.db2.gz	LVJKWJZCAWSFDQ-OBIQQPLYSA-N	0	3	342.483	3.118	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2CN(CC/C=C/CCC)C[C@H]2OC)CC1	ZINC001213395167	1372900154	/nfs/dbraw/zinc/90/01/54/1372900154.db2.gz	PUODFRBIKNTWSC-RKQNLGICSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2cc3cccc(C)c3o2)[C@H](OC)C1	ZINC001213930043	1372981459	/nfs/dbraw/zinc/98/14/59/1372981459.db2.gz	WUUQAXXOXODPLF-SJLPKXTDSA-N	0	3	342.439	3.136	20	30		EGEDHN
CC(C)=CC(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001214080123	1373005886	/nfs/dbraw/zinc/00/58/86/1373005886.db2.gz	IFPMBYQLXNXBJX-CRAIPNDOSA-N	0	3	330.859	3.094	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001214301385	1373040594	/nfs/dbraw/zinc/04/05/94/1373040594.db2.gz	AMAHQLRKGFJVAN-CRAIPNDOSA-N	0	3	330.859	3.094	20	30		EGEDHN
C[C@H](NCCNC(=O)C#CC1CC1)c1ccc(Cl)c(Cl)c1	ZINC001126881510	1373046124	/nfs/dbraw/zinc/04/61/24/1373046124.db2.gz	VPUIONKRFPLRPK-NSHDSACASA-N	0	3	325.239	3.174	20	30		EGEDHN
C[C@@H]1CN(C(=O)/C=C/C(C)(C)C)C[C@H]1NCc1ccc(C#N)s1	ZINC001214355770	1373048527	/nfs/dbraw/zinc/04/85/27/1373048527.db2.gz	HVVGCDJZDLTRNO-WHHBIATBSA-N	0	3	331.485	3.159	20	30		EGEDHN
CC(C)CC1(C(=O)N2C[C@@H](C)[C@H](NCC#Cc3ccccc3)C2)CC1	ZINC001214824373	1373124887	/nfs/dbraw/zinc/12/48/87/1373124887.db2.gz	VYSRHDMDNVKVRP-UYAOXDASSA-N	0	3	338.495	3.301	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NCCNCc1ccccc1OC1CC1	ZINC001128190087	1373232154	/nfs/dbraw/zinc/23/21/54/1373232154.db2.gz	JPAORTHEVCWTCC-UHFFFAOYSA-N	0	3	336.863	3.212	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCC2(C)CC2)C[C@H]1NCc1ccc(C#N)c(F)c1	ZINC001216196974	1373278498	/nfs/dbraw/zinc/27/84/98/1373278498.db2.gz	JNWCEHGRJGPGTC-RDTXWAMCSA-N	0	3	343.446	3.214	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)c3cccc(C)c3)[C@H]2C1	ZINC001217230438	1373408943	/nfs/dbraw/zinc/40/89/43/1373408943.db2.gz	HSXXFJWEVFHVNI-VQTJNVASSA-N	0	3	344.499	3.491	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)C[C@H]3C=CCC3)[C@H]2C1	ZINC001217248229	1373410518	/nfs/dbraw/zinc/41/05/18/1373410518.db2.gz	AKVPTDSGKYFUMS-GBESFXJTSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)[C@@H](C)CCC(C)(C)C)C1	ZINC001130441713	1373540728	/nfs/dbraw/zinc/54/07/28/1373540728.db2.gz	DPMSAYMFDBBAEF-HOTGVXAUSA-N	0	3	346.519	3.464	20	30		EGEDHN
C(=N/N=C/c1ccccc1O[C@H]1CC[C@@H]2NCCO[C@@H]21)\c1ccccc1	ZINC001218119094	1373564340	/nfs/dbraw/zinc/56/43/40/1373564340.db2.gz	IIYUGVPLFAKEEL-YWAVYVIISA-N	0	3	349.434	3.038	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)[C@@H](C)C3CCC3)[C@H]2C1	ZINC001218153456	1373570866	/nfs/dbraw/zinc/57/08/66/1373570866.db2.gz	JRZRMFRFWCZDIK-YTQUADARSA-N	0	3	334.504	3.081	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)C[C@@H]3C[C@H]3C3CC3)[C@H]2C1	ZINC001218325077	1373596152	/nfs/dbraw/zinc/59/61/52/1373596152.db2.gz	HHXRTDONSQTGKU-LWYYNNOASA-N	0	3	348.531	3.305	20	30		EGEDHN
C=C(C)CN1C[C@@H](OC)C[C@H]1Cn1ccc(NC(=O)CCCCC)n1	ZINC001130866474	1373599956	/nfs/dbraw/zinc/59/99/56/1373599956.db2.gz	OHSZLBIXCSCZFJ-IRXDYDNUSA-N	0	3	348.491	3.067	20	30		EGEDHN
C=C[C@@H](CCCCCC)Oc1cc(C[C@H](N)C(=O)N(C)C)ccc1O	ZINC001218355640	1373602239	/nfs/dbraw/zinc/60/22/39/1373602239.db2.gz	TYHBANKMSLZJPB-IRXDYDNUSA-N	0	3	348.487	3.254	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)Nc1cc2cccnc2c(OC)n1	ZINC001218525519	1373629862	/nfs/dbraw/zinc/62/98/62/1373629862.db2.gz	WEKIEYZECIENMY-AWEZNQCLSA-N	0	3	328.416	3.041	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2OCCN(C(=O)c3ccoc3C3CC3)[C@H]2C1	ZINC001218536039	1373631888	/nfs/dbraw/zinc/63/18/88/1373631888.db2.gz	HQMLZJAFFICKDP-JCGIZDLHSA-N	0	3	344.455	3.037	20	30		EGEDHN
C[C@@H]1CCN[C@@H](C(=O)Nc2nc(-c3ccc(C#N)s3)cs2)C1	ZINC001218787940	1373654776	/nfs/dbraw/zinc/65/47/76/1373654776.db2.gz	OIPBDHYICLRCQY-MWLCHTKSSA-N	0	3	332.454	3.070	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)Nc1ccc(N2CCCC2=O)cc1	ZINC001218818286	1373657486	/nfs/dbraw/zinc/65/74/86/1373657486.db2.gz	SZYAPRORQMJPLT-KRWDZBQOSA-N	0	3	329.444	3.216	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)Nc1cccc(Cn2cccn2)c1	ZINC001218846686	1373660619	/nfs/dbraw/zinc/66/06/19/1373660619.db2.gz	BCQZRJPCJZKVGY-SFHVURJKSA-N	0	3	326.444	3.334	20	30		EGEDHN
N#Cc1cc(NC(=O)[C@@H](N)CC2CCC2)ccc1N1CCCCC1	ZINC001218944183	1373670010	/nfs/dbraw/zinc/67/00/10/1373670010.db2.gz	JELSFABOCIUMJF-KRWDZBQOSA-N	0	3	326.444	3.005	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)C(C2CCC2)C2CCC2)[C@@H](O)C1	ZINC001220224442	1373758511	/nfs/dbraw/zinc/75/85/11/1373758511.db2.gz	NRWUPSORTVWFAG-MOPGFXCFSA-N	0	3	348.531	3.111	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)CCCCC(C)C)C[C@@H](C)O2	ZINC001131694204	1373767488	/nfs/dbraw/zinc/76/74/88/1373767488.db2.gz	VYLKSISWFBDQOR-QUCCMNQESA-N	0	3	336.520	3.471	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)CN(C(=O)CCCCCCCC)C[C@H](C)O2	ZINC001131697287	1373768583	/nfs/dbraw/zinc/76/85/83/1373768583.db2.gz	ISOSJEIGSXZZLI-PZJWPPBQSA-N	0	3	348.531	3.452	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)CN(C(=O)C(C)(C)CCCCC)C[C@H](C)O2	ZINC001131701399	1373771831	/nfs/dbraw/zinc/77/18/31/1373771831.db2.gz	TZBZBJLKBPSZCY-GHTZIAJQSA-N	0	3	348.531	3.308	20	30		EGEDHN
Cc1cc(C)cc(CN2C[C@H](NC(=O)CSCC#N)CC[C@@H]2C)c1	ZINC001131831292	1373828997	/nfs/dbraw/zinc/82/89/97/1373828997.db2.gz	ZEOLYFPTHMBVTP-FUHWJXTLSA-N	0	3	345.512	3.029	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC[C@@H](C)N(Cc2cccc(OC)c2C)C1	ZINC001131894917	1375032179	/nfs/dbraw/zinc/03/21/79/1375032179.db2.gz	DAAXRXDEDBSUNL-QAPCUYQASA-N	0	3	330.472	3.439	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@H](C)N(CCc2ccc3c(c2)CCO3)C1	ZINC001131896929	1375033152	/nfs/dbraw/zinc/03/31/52/1375033152.db2.gz	XLWISOBUPMCPHW-QFBILLFUSA-N	0	3	342.483	3.099	20	30		EGEDHN
C=CCOCC(=O)N[C@@H]1CC[C@@H](C)N(Cc2ccc(C(C)C)cc2)C1	ZINC001131947884	1375063416	/nfs/dbraw/zinc/06/34/16/1375063416.db2.gz	YVCPGVVHKBTHLQ-YLJYHZDGSA-N	0	3	344.499	3.482	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1CC[C@@H](C)N(CCOCCC(C)C)C1	ZINC001131975965	1375077939	/nfs/dbraw/zinc/07/79/39/1375077939.db2.gz	GVFONWJVRGBATJ-MOPGFXCFSA-N	0	3	336.520	3.212	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@H](C)N(Cc2ccccc2N(C)C)C1	ZINC001132001597	1375092367	/nfs/dbraw/zinc/09/23/67/1375092367.db2.gz	AZTXEGWXVJRRIA-PKOBYXMFSA-N	0	3	341.499	3.025	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@@H](C)N(CCCCC(F)(F)F)C1	ZINC001132002342	1375092376	/nfs/dbraw/zinc/09/23/76/1375092376.db2.gz	ISZXFJZDAUCKNP-HUUCEWRRSA-N	0	3	332.410	3.492	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CC[C@H](C)N(Cc2cccc(N(C)C)c2)C1	ZINC001132002648	1375094131	/nfs/dbraw/zinc/09/41/31/1375094131.db2.gz	MBVWERWXJIVCDE-HKUYNNGSSA-N	0	3	341.499	3.025	20	30		EGEDHN
C[C@H]1CC[C@@H](NC(=O)C#CC(C)(C)C)CN1CCc1cccs1	ZINC001132039326	1375111609	/nfs/dbraw/zinc/11/16/09/1375111609.db2.gz	YGZMSNKCQFZMTB-JKSUJKDBSA-N	0	3	332.513	3.309	20	30		EGEDHN
Cc1cc(=O)c(C#N)c(O[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C)[nH]1	ZINC001225469035	1375114203	/nfs/dbraw/zinc/11/42/03/1375114203.db2.gz	GIGRBOWBWXVFFU-IFXJQAMLSA-N	0	3	337.423	3.257	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCCc2csc(C)n2)CC[C@H]1C	ZINC001132050672	1375118189	/nfs/dbraw/zinc/11/81/89/1375118189.db2.gz	QULQKMMQRHHHLI-GDBMZVCRSA-N	0	3	335.517	3.319	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)COc2cccc(C(C)C)c2)CC[C@H]1C	ZINC001132054058	1375119441	/nfs/dbraw/zinc/11/94/41/1375119441.db2.gz	JOLPLQCOJQKVFA-IEBWSBKVSA-N	0	3	342.483	3.181	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1CC[C@H](C)N(CCOc2ccccc2)C1	ZINC001132071615	1375133157	/nfs/dbraw/zinc/13/31/57/1375133157.db2.gz	BOVXPXQNMGBDEV-ROUUACIJSA-N	0	3	330.472	3.391	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H](CC)SC	ZINC001225698233	1375146399	/nfs/dbraw/zinc/14/63/99/1375146399.db2.gz	IVDBTBFSKJVVRT-JHJVBQTASA-N	0	3	349.338	3.054	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)C(C)(C)C2CCCC2)CC[C@@H]1C	ZINC001132105050	1375150299	/nfs/dbraw/zinc/15/02/99/1375150299.db2.gz	ALPSEERPUYJLIZ-WMZOPIPTSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CC[C@H](C)N(CCOCCCC)C1	ZINC001132106174	1375151863	/nfs/dbraw/zinc/15/18/63/1375151863.db2.gz	QSVXLORQENPKBI-ZWKOTPCHSA-N	0	3	347.503	3.074	20	30		EGEDHN
Cc1cccc(C2(C(=O)NCCNCc3ccc(C#N)cc3)CCC2)c1	ZINC001132162665	1375179842	/nfs/dbraw/zinc/17/98/42/1375179842.db2.gz	MLMCUAWMQLAGCA-UHFFFAOYSA-N	0	3	347.462	3.194	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@H](C)OCc3cccc(C)c3)[C@@H]2C1	ZINC001188697701	1388362534	/nfs/dbraw/zinc/36/25/34/1388362534.db2.gz	AONPQMOCESQTDA-YSIASYRMSA-N	0	3	342.483	3.009	20	30		EGEDHN
C[C@H](N[C@@H]1CCCC[C@H]1NC(=O)C#CC1CC1)c1ccc(F)cc1F	ZINC001226134124	1375208568	/nfs/dbraw/zinc/20/85/68/1375208568.db2.gz	SKVSONLTIKCNQE-MJXNMMHHSA-N	0	3	346.421	3.456	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2ccn(C(C)C)c2C)CC[C@H]1C	ZINC001132237490	1375233224	/nfs/dbraw/zinc/23/32/24/1375233224.db2.gz	KDSOARQSNZDPHK-SJLPKXTDSA-N	0	3	347.503	3.163	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC1CCN(Cc2ccc(C)cc2)CC1	ZINC001226455667	1375262362	/nfs/dbraw/zinc/26/23/62/1375262362.db2.gz	HICNKZQDDHVFEG-KRWDZBQOSA-N	0	3	330.472	3.057	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CC[C@H](C)N(CCOCCC(C)C)C2)C1	ZINC001132286547	1375268105	/nfs/dbraw/zinc/26/81/05/1375268105.db2.gz	BNBPIGXPAPHCIU-ZWKOTPCHSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCOCC(=O)NC1CCN(Cc2ccc(CC(C)C)cc2)CC1	ZINC001226599535	1375289507	/nfs/dbraw/zinc/28/95/07/1375289507.db2.gz	YEICFLSYSYJTLE-UHFFFAOYSA-N	0	3	344.499	3.168	20	30		EGEDHN
C#CCCCCC(=O)NC1CCN(Cc2sc(C)nc2C)CC1	ZINC001226952363	1375369852	/nfs/dbraw/zinc/36/98/52/1375369852.db2.gz	ZKPNXGMESGMAHS-UHFFFAOYSA-N	0	3	333.501	3.034	20	30		EGEDHN
C[C@@H](c1ccccn1)N1CC[C@@H](Oc2nc3cc(C#N)ccc3[nH]2)C1	ZINC001227217864	1375407783	/nfs/dbraw/zinc/40/77/83/1375407783.db2.gz	DXBHLZJHHZUTCA-DZGCQCFKSA-N	0	3	333.395	3.044	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COc2ccccc2CC)CC[C@@H]1C	ZINC001132472734	1375412963	/nfs/dbraw/zinc/41/29/63/1375412963.db2.gz	LIAPKJSBWMMSHE-WMZOPIPTSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COc2ccccc2Cl)CC[C@H]1C	ZINC001132487318	1375421129	/nfs/dbraw/zinc/42/11/29/1375421129.db2.gz	TUXHEZFUMMNKCY-HUUCEWRRSA-N	0	3	336.863	3.264	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCOCc2ccccc2)CC[C@H]1C	ZINC001132496614	1375425478	/nfs/dbraw/zinc/42/54/78/1375425478.db2.gz	LTFNSEPBWYMRFM-MJGOQNOKSA-N	0	3	330.472	3.139	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COc2ccc(C)c(C)c2)CC[C@H]1C	ZINC001132499822	1375427504	/nfs/dbraw/zinc/42/75/04/1375427504.db2.gz	KTDUTOZAVKFJSN-MSOLQXFVSA-N	0	3	330.472	3.227	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2ccc(C3CC3)cc2)CC[C@@H]1C	ZINC001132505506	1375429709	/nfs/dbraw/zinc/42/97/09/1375429709.db2.gz	SNSSJTSQUXSTGQ-JXFKEZNVSA-N	0	3	342.483	3.349	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC1CCN(C[C@H](O)c2ccc(F)cc2)CC1	ZINC001227570007	1375445958	/nfs/dbraw/zinc/44/59/58/1375445958.db2.gz	GBVOLCUPHRSCIT-SFHVURJKSA-N	0	3	348.462	3.042	20	30		EGEDHN
C=C(C)CCC(=O)NC1CCN(Cc2ccc(OCC#N)cc2)CC1	ZINC001227588706	1375448490	/nfs/dbraw/zinc/44/84/90/1375448490.db2.gz	TWCZWGSDJAJEPO-UHFFFAOYSA-N	0	3	341.455	3.026	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2(C(F)(F)F)CCCC2)CC[C@H]1C	ZINC001132543616	1375451223	/nfs/dbraw/zinc/45/12/23/1375451223.db2.gz	ZGWVGYNVRJVZQB-ZIAGYGMSSA-N	0	3	330.394	3.102	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCc2cccc(F)c2F)CC[C@@H]1C	ZINC001132545348	1375452716	/nfs/dbraw/zinc/45/27/16/1375452716.db2.gz	AGHMBXUCTRKIKV-GOEBONIOSA-N	0	3	336.426	3.443	20	30		EGEDHN
C#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)CCCCC)CC1	ZINC001132552316	1375459031	/nfs/dbraw/zinc/45/90/31/1375459031.db2.gz	SMRVXRAYIURZEY-HXUWFJFHSA-N	0	3	341.499	3.478	20	30		EGEDHN
CC#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)CCCC)CC1	ZINC001132552329	1375459191	/nfs/dbraw/zinc/45/91/91/1375459191.db2.gz	STTJFVBSVLPSNR-FQEVSTJZSA-N	0	3	341.499	3.478	20	30		EGEDHN
C#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)C(F)=C(C)C)CC1	ZINC001132555582	1375462833	/nfs/dbraw/zinc/46/28/33/1375462833.db2.gz	WRCMFASEQDSINI-SFHVURJKSA-N	0	3	343.446	3.161	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2N(Cc2ccsc2)C(=O)C2(C)CC2)CC1	ZINC001132562977	1375469286	/nfs/dbraw/zinc/46/92/86/1375469286.db2.gz	OAJHMHBLXLMYIY-QGZVFWFLSA-N	0	3	342.508	3.365	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](C)[C@@H](CNCc2nc3ccccc3o2)C1	ZINC001132696575	1375518219	/nfs/dbraw/zinc/51/82/19/1375518219.db2.gz	LPUUVDRPXNSNGX-HOTGVXAUSA-N	0	3	341.455	3.368	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](C)[C@H](CNCc2ccccc2C#N)C1	ZINC001132698013	1375520347	/nfs/dbraw/zinc/52/03/47/1375520347.db2.gz	VMJZNBGQDPLGPI-VQIMIIECSA-N	0	3	325.456	3.099	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CCCC[C@H]1NCc1c(C)onc1CC	ZINC001228270502	1375538291	/nfs/dbraw/zinc/53/82/91/1375538291.db2.gz	STBIERDWQMJBLU-QZTJIDSGSA-N	0	3	333.476	3.419	20	30		EGEDHN
Cc1csc(CNC[C@H]2CN(C(=O)C#CC(C)(C)C)CC[C@H]2C)n1	ZINC001132818594	1375581559	/nfs/dbraw/zinc/58/15/59/1375581559.db2.gz	LECSPKKXYXMFDL-ZBFHGGJFSA-N	0	3	347.528	3.075	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](C)[C@@H](CNCc2nccs2)C1	ZINC001132846900	1375598181	/nfs/dbraw/zinc/59/81/81/1375598181.db2.gz	OFNYKORTPHJOIL-GJZGRUSLSA-N	0	3	335.517	3.320	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](C)[C@@H](CNCc2cc(C)no2)C1	ZINC001132847469	1375599930	/nfs/dbraw/zinc/59/99/30/1375599930.db2.gz	YJZAQDPONDMJSX-ZBFHGGJFSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](C)[C@@H](CNCc2cscn2)C1	ZINC001132851585	1375602177	/nfs/dbraw/zinc/60/21/77/1375602177.db2.gz	WHVBIZKZASAZFR-WBVHZDCISA-N	0	3	347.528	3.486	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC1CCN(C[C@@H](O)c2ccc(F)cc2)CC1	ZINC001228596563	1375609768	/nfs/dbraw/zinc/60/97/68/1375609768.db2.gz	JEFPKMKGMPBASX-GOSISDBHSA-N	0	3	348.462	3.042	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC1CCN(C[C@H](O)c2ccc(F)cc2)CC1	ZINC001228810361	1375685008	/nfs/dbraw/zinc/68/50/08/1375685008.db2.gz	TXNCMUUAZYYDIA-KXBFYZLASA-N	0	3	348.462	3.042	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](C)[C@H](CNCc2ccn(C(C)C)n2)C1	ZINC001133072546	1375759018	/nfs/dbraw/zinc/75/90/18/1375759018.db2.gz	ITJWHFOCVYNSAJ-ZWKOTPCHSA-N	0	3	346.519	3.395	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](C)[C@H](CNCc2ncc(C)s2)C1	ZINC001133073382	1375759325	/nfs/dbraw/zinc/75/93/25/1375759325.db2.gz	UHGOQYFKDGPXNS-GOEBONIOSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@H]2CN(CCOc3ccccc3)C[C@H]21	ZINC001188897735	1388403786	/nfs/dbraw/zinc/40/37/86/1388403786.db2.gz	WORKHBJJZOOVPX-CMKODMSKSA-N	0	3	342.483	3.200	20	30		EGEDHN
C=CCC1(C(=O)NCCNCc2ccccc2OC2CC2)CCC1	ZINC001133395640	1375979785	/nfs/dbraw/zinc/97/97/85/1375979785.db2.gz	UQSHLTKVNXBEEW-UHFFFAOYSA-N	0	3	328.456	3.180	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@H]1CC[C@H](F)C1	ZINC001133401528	1375985400	/nfs/dbraw/zinc/98/54/00/1375985400.db2.gz	FTGGFBZGVIMYMI-RDJZCZTQSA-N	0	3	336.838	3.030	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NC1CCN(Cc2ccc(CCC)cc2)CC1	ZINC001230406788	1376020886	/nfs/dbraw/zinc/02/08/86/1376020886.db2.gz	DDJKCCMGAFVRDF-KRWDZBQOSA-N	0	3	344.499	3.311	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NC1CCN([C@H](C)c2ccc(F)cc2)CC1	ZINC001230415815	1376023786	/nfs/dbraw/zinc/02/37/86/1376023786.db2.gz	YXGURTILONJQGC-CABCVRRESA-N	0	3	334.435	3.058	20	30		EGEDHN
C=CCC[C@H](C(=O)NC1CCN(CCOCC)CC1)c1ccccc1	ZINC001230479722	1376036813	/nfs/dbraw/zinc/03/68/13/1376036813.db2.gz	RVGJPUBTMQOFJI-FQEVSTJZSA-N	0	3	344.499	3.354	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)c1ccc(F)cc1	ZINC001133550475	1376079747	/nfs/dbraw/zinc/07/97/47/1376079747.db2.gz	PZNNDXZDIXVVHF-RYUDHWBXSA-N	0	3	343.240	3.221	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)c1cccs1	ZINC001133580666	1376103970	/nfs/dbraw/zinc/10/39/70/1376103970.db2.gz	CNNFECZMQPKQEQ-MNOVXSKESA-N	0	3	331.279	3.143	20	30		EGEDHN
C[C@@H](F)CCN(CCCNC(=O)C#CC(C)(C)C)Cc1cccnc1	ZINC001230756620	1376140438	/nfs/dbraw/zinc/14/04/38/1376140438.db2.gz	ANPCLNKYHHMZCO-QGZVFWFLSA-N	0	3	347.478	3.188	20	30		EGEDHN
C=CCCCC(=O)NCCCN(Cc1cccnc1)C[C@@H](CC)OC	ZINC001230829223	1376162893	/nfs/dbraw/zinc/16/28/93/1376162893.db2.gz	APJKEEGHYZBEAS-LJQANCHMSA-N	0	3	347.503	3.171	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)CC(C)(F)F)Cc1cccnc1	ZINC001230838911	1376164276	/nfs/dbraw/zinc/16/42/76/1376164276.db2.gz	WEPUKNKYNZDECX-UHFFFAOYSA-N	0	3	325.403	3.011	20	30		EGEDHN
C#CCCN(CCCNC(=O)c1cc(C)ccc1C)Cc1cccnc1	ZINC001230911740	1376182352	/nfs/dbraw/zinc/18/23/52/1376182352.db2.gz	OLEVSIZVMRHHLX-UHFFFAOYSA-N	0	3	349.478	3.344	20	30		EGEDHN
CCSCCC(=O)N[C@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001133806983	1376213562	/nfs/dbraw/zinc/21/35/62/1376213562.db2.gz	DWCUYOWVONVNRW-LSDHHAIUSA-N	0	3	333.501	3.074	20	30		EGEDHN
C/C(=C/C(=O)N[C@H](C)C[C@@H](C)NCc1ccccc1C#N)C1CC1	ZINC001133872552	1376245411	/nfs/dbraw/zinc/24/54/11/1376245411.db2.gz	WMIKNJCWDCCMBC-LDXCAOIPSA-N	0	3	325.456	3.287	20	30		EGEDHN
C=CCCC(=O)N[C@H](C)C[C@H](C)NCc1ccn(-c2ccccc2)n1	ZINC001133884155	1376249993	/nfs/dbraw/zinc/24/99/93/1376249993.db2.gz	LZUOORPSRWWOBK-DLBZAZTESA-N	0	3	340.471	3.211	20	30		EGEDHN
C=CCOc1cccc(CN2CC[C@H](Oc3ccnc(OC)c3)C2)c1	ZINC001231624926	1376285321	/nfs/dbraw/zinc/28/53/21/1376285321.db2.gz	NAKXPLIHHSYFFJ-IBGZPJMESA-N	0	3	340.423	3.308	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H]2CN(CCOc3ccc(C)cc3)C[C@H]21	ZINC001189006555	1388435022	/nfs/dbraw/zinc/43/50/22/1388435022.db2.gz	FBHIKACYQMXCHK-AZUAARDMSA-N	0	3	342.483	3.263	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)c1ccoc1CC	ZINC001134248685	1376433058	/nfs/dbraw/zinc/43/30/58/1376433058.db2.gz	SXXXFQZQVYGCRF-NWDGAFQWSA-N	0	3	343.265	3.237	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1ccccc1C#N)NC(=O)c1sccc1F	ZINC001134274389	1376450143	/nfs/dbraw/zinc/45/01/43/1376450143.db2.gz	OSQDJPSQTQDKQW-QWHCGFSZSA-N	0	3	345.443	3.446	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)C2[C@H]3CCCCCC[C@H]23)ccc1F	ZINC001134314192	1376470982	/nfs/dbraw/zinc/47/09/82/1376470982.db2.gz	CDCUNPSGMLVFDO-IRXDYDNUSA-N	0	3	343.446	3.120	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)c1ccsc1C	ZINC001134319429	1376474464	/nfs/dbraw/zinc/47/44/64/1376474464.db2.gz	ZUBNFGHXZRVZJT-WDEREUQCSA-N	0	3	345.306	3.452	20	30		EGEDHN
Cc1oc(C(C)(C)C)cc1C(=O)NCCNCc1ccc(C#N)cc1	ZINC001134425422	1376526920	/nfs/dbraw/zinc/52/69/20/1376526920.db2.gz	DXBHVUBFULKTRV-UHFFFAOYSA-N	0	3	339.439	3.277	20	30		EGEDHN
Cc1oc(C(C)(C)C)cc1C(=O)NCCNCc1ccc(C#N)s1	ZINC001134426568	1376527733	/nfs/dbraw/zinc/52/77/33/1376527733.db2.gz	XRLLFPWNUOGVIN-UHFFFAOYSA-N	0	3	345.468	3.338	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H](C)C[C@@H](C)NCc1nccn1C(F)F	ZINC001134448872	1376543615	/nfs/dbraw/zinc/54/36/15/1376543615.db2.gz	PUGSVXSGLGQCED-OLZOCXBDSA-N	0	3	342.434	3.253	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H](C)C[C@H](C)NCc1c(C)nn(C)c1Cl	ZINC001134471079	1376555674	/nfs/dbraw/zinc/55/56/74/1376555674.db2.gz	UFYGFZAVUBZJGL-QWHCGFSZSA-N	0	3	340.899	3.111	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCC[C@@]2(C[C@H](OCC3CC3)CO2)C1	ZINC001233079518	1376564915	/nfs/dbraw/zinc/56/49/15/1376564915.db2.gz	GLJIDFKVKAKMPT-LEWJYISDSA-N	0	3	340.467	3.417	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CC[C@]2(C[C@H](OCC3CC3)CO2)C1	ZINC001233080700	1376566704	/nfs/dbraw/zinc/56/67/04/1376566704.db2.gz	AJTBAXXTIKUZJV-PMACEKPBSA-N	0	3	326.440	3.027	20	30		EGEDHN
C[C@H](CCC(=O)NCCNCc1ccc(C#N)s1)c1ccccc1	ZINC001134806512	1376735355	/nfs/dbraw/zinc/73/53/55/1376735355.db2.gz	LPNUJCKHXJXLJC-OAHLLOKOSA-N	0	3	341.480	3.409	20	30		EGEDHN
C#CCCCC(=O)N(C)C[C@@H]1CCN1CCCCOc1ccccc1	ZINC001233946968	1376740863	/nfs/dbraw/zinc/74/08/63/1376740863.db2.gz	GPMIZAZDRZRZTM-IBGZPJMESA-N	0	3	342.483	3.182	20	30		EGEDHN
CC(C)C#CC(=O)N(C)C[C@@H]1CCN1CC[C@@H]1CCc2ccccc21	ZINC001234159993	1376780140	/nfs/dbraw/zinc/78/01/40/1376780140.db2.gz	FIYLJPUCFCGKCO-PMACEKPBSA-N	0	3	338.495	3.299	20	30		EGEDHN
CCCCCCCN1CC[C@H]1CN(C)C(=O)CCOCC(F)F	ZINC001234365823	1376820086	/nfs/dbraw/zinc/82/00/86/1376820086.db2.gz	HYPJTJWKWBOASU-HNNXBMFYSA-N	0	3	334.451	3.161	20	30		EGEDHN
Cc1ccc([C@@H]2C[C@H]2C(=O)NCCNCc2ccc(C#N)cc2)cc1C	ZINC001135026052	1376855253	/nfs/dbraw/zinc/85/52/53/1376855253.db2.gz	GPTZJZCURNKUNH-LEWJYISDSA-N	0	3	347.462	3.185	20	30		EGEDHN
C=CCCCN1CC[C@H]1CN(C)C(=O)c1ccc(OC)c(OC)c1C	ZINC001235633985	1376881400	/nfs/dbraw/zinc/88/14/00/1376881400.db2.gz	STBYBNMWYZDDGG-INIZCTEOSA-N	0	3	346.471	3.125	20	30		EGEDHN
CN1CCC[C@H]2CN(C(=O)c3ccc(C#C[Si](C)(C)C)cc3)C[C@H]21	ZINC001189169971	1388472105	/nfs/dbraw/zinc/47/21/05/1388472105.db2.gz	PEBMVFWWMLCISL-RBUKOAKNSA-N	0	3	340.543	3.082	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1ccccc1C#N)NC(=O)C1(C(F)F)CCC1	ZINC001135288730	1377022416	/nfs/dbraw/zinc/02/24/16/1377022416.db2.gz	JKNYQHNXSXTISP-UONOGXRCSA-N	0	3	349.425	3.367	20	30		EGEDHN
Cc1cccc(CC(=O)N[C@H](C)C[C@H](C)NCc2ccccc2C#N)c1	ZINC001135350326	1377048459	/nfs/dbraw/zinc/04/84/59/1377048459.db2.gz	SLRMBLOWACFHLD-ZWKOTPCHSA-N	0	3	349.478	3.482	20	30		EGEDHN
N#Cc1ccc(NC(=S)N[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC001245874984	1377049978	/nfs/dbraw/zinc/04/99/78/1377049978.db2.gz	PZONHPOHIOYUIL-GOSISDBHSA-N	0	3	336.464	3.119	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)C1(C)CC(=C)C1	ZINC001135420717	1377086458	/nfs/dbraw/zinc/08/64/58/1377086458.db2.gz	YVGZGNDJASHYCI-CHWSQXEVSA-N	0	3	329.282	3.124	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H](C)C[C@H](C)NCc2cc(C3CC3)no2)C1	ZINC001135426291	1377089619	/nfs/dbraw/zinc/08/96/19/1377089619.db2.gz	BVHKVBORNNCFRV-UONOGXRCSA-N	0	3	331.460	3.281	20	30		EGEDHN
CC(C)c1noc([C@H]2CCCN(Cc3ccc(OCC#N)cc3)C2)n1	ZINC001137120283	1377481458	/nfs/dbraw/zinc/48/14/58/1377481458.db2.gz	AVHPFRIGILBLKS-INIZCTEOSA-N	0	3	340.427	3.475	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3cc(OC)ccc3Cl)C2)C1=O	ZINC001137261522	1377505661	/nfs/dbraw/zinc/50/56/61/1377505661.db2.gz	QGGNHPPJWXVOEP-IBGZPJMESA-N	0	3	348.874	3.349	20	30		EGEDHN
C=CCO[C@@H]1CO[C@@]2(C1)CCCN(Cc1cc3ccccc3[nH]1)C2	ZINC001137317805	1377517576	/nfs/dbraw/zinc/51/75/76/1377517576.db2.gz	SSVTVLWHELTPIB-AZUAARDMSA-N	0	3	326.440	3.494	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@@H]1CCN(Cc1n[nH]c3ccccc31)C2	ZINC001137346394	1377527627	/nfs/dbraw/zinc/52/76/27/1377527627.db2.gz	VTWIPKWOGKXJMX-UXHICEINSA-N	0	3	341.455	3.137	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H]2CN(CCCC(F)(F)F)C[C@H]21	ZINC001268985138	1377535343	/nfs/dbraw/zinc/53/53/43/1377535343.db2.gz	JBRFOJHCFBKQDD-UONOGXRCSA-N	0	3	332.410	3.464	20	30		EGEDHN
CCC[C@@H](C)CC(=O)N1CC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001189270501	1388503232	/nfs/dbraw/zinc/50/32/32/1388503232.db2.gz	SPTAZMQOXNQQOE-APWZRJJASA-N	0	3	327.472	3.417	20	30		EGEDHN
C[C@@](CNCc1cc(C#N)ccc1F)(NC(=O)CC1(C)CC1)C1CC1	ZINC001269625741	1377560143	/nfs/dbraw/zinc/56/01/43/1377560143.db2.gz	AXPLOIRJYZVVHI-FQEVSTJZSA-N	0	3	343.446	3.262	20	30		EGEDHN
C#CCOc1ccc(CN2CCC[C@H](Oc3cccc(C)n3)C2)cc1	ZINC001138560821	1377743156	/nfs/dbraw/zinc/74/31/56/1377743156.db2.gz	PGTSHIOYGLAMIU-FQEVSTJZSA-N	0	3	336.435	3.445	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CCC3(CCC(=O)N3CC)CC2)c1[O-]	ZINC001138626883	1377756209	/nfs/dbraw/zinc/75/62/09/1377756209.db2.gz	RONOVMPQKMEGLH-UHFFFAOYSA-N	0	3	328.456	3.098	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@H](c3nc(CC)no3)C2)c1[O-]	ZINC001138627632	1377756937	/nfs/dbraw/zinc/75/69/37/1377756937.db2.gz	CVEUJBHRHIVFLR-INIZCTEOSA-N	0	3	327.428	3.446	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@H](c3nc(CC)no3)C2)c1[O-]	ZINC001138627632	1377756938	/nfs/dbraw/zinc/75/69/38/1377756938.db2.gz	CVEUJBHRHIVFLR-INIZCTEOSA-N	0	3	327.428	3.446	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@@H](Oc3ncncc3C)C2)c1[O-]	ZINC001138631094	1377758231	/nfs/dbraw/zinc/75/82/31/1377758231.db2.gz	KPBICMJMORYJFC-GOSISDBHSA-N	0	3	339.439	3.263	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@@H](Oc3ncncc3C)C2)c1[O-]	ZINC001138631094	1377758234	/nfs/dbraw/zinc/75/82/34/1377758234.db2.gz	KPBICMJMORYJFC-GOSISDBHSA-N	0	3	339.439	3.263	20	30		EGEDHN
N#Cc1cccc2c(CN3CCC(Oc4cccnc4)CC3)c[nH]c21	ZINC001139703681	1377937886	/nfs/dbraw/zinc/93/78/86/1377937886.db2.gz	SCQOXPNAURNROK-UHFFFAOYSA-N	0	3	332.407	3.478	20	30		EGEDHN
Cc1ccc(CN2CCC[C@](O)(C(F)(F)F)[C@@H](C)C2)cc1C#N	ZINC001139723186	1377941492	/nfs/dbraw/zinc/94/14/92/1377941492.db2.gz	URUFXAXBEXTZBY-XJKSGUPXSA-N	0	3	326.362	3.392	20	30		EGEDHN
C=CCn1cc(CN2CCC(c3ccc(C(=O)OC)cc3)CC2)cn1	ZINC001139772929	1377948802	/nfs/dbraw/zinc/94/88/02/1377948802.db2.gz	UOSQCRNSOYDJMM-UHFFFAOYSA-N	0	3	339.439	3.235	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CCN(Cc3ccnc(F)c3)CC2)CC1	ZINC001139830571	1377958103	/nfs/dbraw/zinc/95/81/03/1377958103.db2.gz	FGKWWHLKIHUVCX-UHFFFAOYSA-N	0	3	347.434	3.221	20	30		EGEDHN
C=CCN(C)Cc1ccccc1N1CCN(C(=O)OC(C)(C)C)CC1	ZINC001140072349	1378001173	/nfs/dbraw/zinc/00/11/73/1378001173.db2.gz	SNXVIYJYMHNJPK-UHFFFAOYSA-N	0	3	345.487	3.362	20	30		EGEDHN
C=CCN1C(=O)CCC12CCN(Cc1c[nH]c3cccc(O)c13)CC2	ZINC001140233595	1378035259	/nfs/dbraw/zinc/03/52/59/1378035259.db2.gz	HXCDHLMQELATAA-UHFFFAOYSA-N	0	3	339.439	3.017	20	30		EGEDHN
C=C(C)CN1C[C@]2(CC1=O)CCCCN2CCc1ccccc1F	ZINC001273040949	1378085515	/nfs/dbraw/zinc/08/55/15/1378085515.db2.gz	JUPOUVOXNZRYQI-HXUWFJFHSA-N	0	3	330.447	3.401	20	30		EGEDHN
N#Cc1ccc(CN2CCCC3(C[NH+](C4CCCC4)C3)C2)c([O-])c1	ZINC001276493786	1378175942	/nfs/dbraw/zinc/17/59/42/1378175942.db2.gz	NRDARTBLSMBMLX-UHFFFAOYSA-N	0	3	325.456	3.104	20	30		EGEDHN
N#Cc1ccc(C[N@@H+]2CCCC3(CN(C4CCCC4)C3)C2)c([O-])c1	ZINC001276493786	1378175946	/nfs/dbraw/zinc/17/59/46/1378175946.db2.gz	NRDARTBLSMBMLX-UHFFFAOYSA-N	0	3	325.456	3.104	20	30		EGEDHN
N#Cc1ccc(C[N@H+]2CCCC3(CN(C4CCCC4)C3)C2)c([O-])c1	ZINC001276493786	1378175949	/nfs/dbraw/zinc/17/59/49/1378175949.db2.gz	NRDARTBLSMBMLX-UHFFFAOYSA-N	0	3	325.456	3.104	20	30		EGEDHN
CCC(C)(C)CC(=O)NCC1(NCc2ccc(F)c(C#N)c2)CC1	ZINC001277066186	1378204541	/nfs/dbraw/zinc/20/45/41/1378204541.db2.gz	OOQQOWOKLKZVAL-UHFFFAOYSA-N	0	3	331.435	3.262	20	30		EGEDHN
CNC(=O)C1CCN(Cc2ccc(Oc3ccc(C#N)cc3)cc2)CC1	ZINC001141287871	1378291895	/nfs/dbraw/zinc/29/18/95/1378291895.db2.gz	SKYASNDTQJMJLK-UHFFFAOYSA-N	0	3	349.434	3.309	20	30		EGEDHN
COC(=O)[C@@H]1CCN(Cc2ccc(C#Cc3ccccc3)s2)C1	ZINC001141972668	1378400375	/nfs/dbraw/zinc/40/03/75/1378400375.db2.gz	PKHFDYNLGNUYST-MRXNPFEDSA-N	0	3	325.433	3.143	20	30		EGEDHN
N#Cc1ccc2c(CN3CCC[C@@H](Oc4cccnc4)C3)c[nH]c2c1	ZINC001142921690	1378509276	/nfs/dbraw/zinc/50/92/76/1378509276.db2.gz	SQOGJMYYJOLVOW-GOSISDBHSA-N	0	3	332.407	3.478	20	30		EGEDHN
N#Cc1ccc2c(CN3CC4(C3)CN(Cc3ccccc3)C4)c[nH]c2c1	ZINC001142922552	1378509961	/nfs/dbraw/zinc/50/99/61/1378509961.db2.gz	MCYPCMINXHCGTN-UHFFFAOYSA-N	0	3	342.446	3.357	20	30		EGEDHN
COc1cc(O[C@H]2CCN(Cc3c[nH]c4cc(C#N)ccc34)C2)ccn1	ZINC001142929329	1378511577	/nfs/dbraw/zinc/51/15/77/1378511577.db2.gz	CVVCRGZHFMTHLZ-KRWDZBQOSA-N	0	3	348.406	3.096	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCCN(Cc3ccc4nccn4c3)C2)cc1	ZINC001143036003	1378531948	/nfs/dbraw/zinc/53/19/48/1378531948.db2.gz	WKSRYPZVSFFBTM-LJQANCHMSA-N	0	3	332.407	3.249	20	30		EGEDHN
C=CCO[C@H]1CO[C@]2(C1)CCCN(Cc1cc(C)cc(OC)c1)C2	ZINC001143157648	1378549248	/nfs/dbraw/zinc/54/92/48/1378549248.db2.gz	PHIRPNBNZXUFLD-UXHICEINSA-N	0	3	331.456	3.330	20	30		EGEDHN
CN(Cc1ccc(C#N)cn1)C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC001144163749	1378689563	/nfs/dbraw/zinc/68/95/63/1378689563.db2.gz	UHMPKAXUQHAPRA-INIZCTEOSA-N	0	3	344.459	3.032	20	30		EGEDHN
CCN(Cc1ccc(C#N)cn1)C[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC001144166463	1378690621	/nfs/dbraw/zinc/69/06/21/1378690621.db2.gz	HEVUBMDPWMGQCD-MRXNPFEDSA-N	0	3	344.459	3.032	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2cnc(C)cn2)CCCC1	ZINC001146819527	1378926823	/nfs/dbraw/zinc/92/68/23/1378926823.db2.gz	AUJUECGDMNEVSS-HZPDHXFCSA-N	0	3	344.503	3.294	20	30		EGEDHN
CC(C)(C)/C=C/C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001147241733	1378994730	/nfs/dbraw/zinc/99/47/30/1378994730.db2.gz	ZNWRZXCDBXTIEZ-BQYQJAHWSA-N	0	3	337.467	3.195	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001147251567	1378997943	/nfs/dbraw/zinc/99/79/43/1378997943.db2.gz	YURCNAQIHDDLCL-MRXNPFEDSA-N	0	3	325.456	3.029	20	30		EGEDHN
C=C(Br)CNC[C@H](C1CC1)N(C)C(=O)C(C)(C)C1CC1	ZINC001283530086	1379002733	/nfs/dbraw/zinc/00/27/33/1379002733.db2.gz	KGYGIPBWLXELNO-CQSZACIVSA-N	0	3	343.309	3.158	20	30		EGEDHN
C=CCCCC(=O)N1CC2(C1)CCN(CCOc1cccc(C)c1)C2	ZINC001148180795	1379128841	/nfs/dbraw/zinc/12/88/41/1379128841.db2.gz	BEURRQNIHFDDCK-UHFFFAOYSA-N	0	3	342.483	3.264	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H](c3ccccc3)[C@H](C)CC)C2)C1	ZINC001148726430	1379254182	/nfs/dbraw/zinc/25/41/82/1379254182.db2.gz	HZXBEYXWYCAWAK-UYAOXDASSA-N	0	3	338.495	3.374	20	30		EGEDHN
CCCCCCCCC(=O)NCCN[C@@H](C)C(=O)NC(C)(C)CC	ZINC001148727769	1379254797	/nfs/dbraw/zinc/25/47/97/1379254797.db2.gz	KENJDPMANQCCCM-INIZCTEOSA-N	0	3	341.540	3.136	20	30		EGEDHN
CCCCCCCCCCC(=O)NCCN[C@@H](C)C(=O)NCCC	ZINC001148751820	1379260290	/nfs/dbraw/zinc/26/02/90/1379260290.db2.gz	SJFJPGSBLXJALU-KRWDZBQOSA-N	0	3	341.540	3.138	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc(Cl)c(Cl)c2)cc1	ZINC001148796754	1379270386	/nfs/dbraw/zinc/27/03/86/1379270386.db2.gz	ZDJMXBRZBZIQEZ-UHFFFAOYSA-N	0	3	348.233	3.385	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)CCCCc3ccc(C)cc3)C2)C1	ZINC001148873991	1379288742	/nfs/dbraw/zinc/28/87/42/1379288742.db2.gz	DUOAOAYUKKOHGE-UHFFFAOYSA-N	0	3	338.495	3.265	20	30		EGEDHN
C=CCCC(=O)NC[C@H]1CN([C@@H](C)c2cccc(C)c2)CCCO1	ZINC001149376121	1379371895	/nfs/dbraw/zinc/37/18/95/1379371895.db2.gz	VPOXHGYKNVUZDH-HKUYNNGSSA-N	0	3	330.472	3.229	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H]1CN([C@@H](C)c2ccccc2)CCCO1	ZINC001149580823	1379407508	/nfs/dbraw/zinc/40/75/08/1379407508.db2.gz	YJBWXHDBWRZKEP-AZUAARDMSA-N	0	3	342.483	3.148	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H]1CN([C@H](C)c2ccccc2)CCCO1	ZINC001150084763	1379492133	/nfs/dbraw/zinc/49/21/33/1379492133.db2.gz	GYJMSVQOWARYQM-SJLPKXTDSA-N	0	3	330.472	3.167	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@H]1CN(Cc2ccc(C)c(C)c2)CCCO1	ZINC001150084516	1379492137	/nfs/dbraw/zinc/49/21/37/1379492137.db2.gz	FALNXIFAPFWDOK-IBGZPJMESA-N	0	3	344.499	3.223	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H]1CN([C@@H](C)c2cccc(C)c2)CCCO1	ZINC001150086156	1379493150	/nfs/dbraw/zinc/49/31/50/1379493150.db2.gz	XVHXNZXPVFDJGC-PKOBYXMFSA-N	0	3	344.499	3.475	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@H]1CN(Cc2cccc(C)c2)CCCO1	ZINC001150138813	1379500934	/nfs/dbraw/zinc/50/09/34/1379500934.db2.gz	FXRFMYUXUDQLDL-QUCCMNQESA-N	0	3	344.499	3.304	20	30		EGEDHN
CCCc1cc(C(=O)NCCNCc2cccc(C#N)c2)sc1C	ZINC001150350065	1379535739	/nfs/dbraw/zinc/53/57/39/1379535739.db2.gz	USMBHNRDCJFBIV-UHFFFAOYSA-N	0	3	341.480	3.400	20	30		EGEDHN
C#CCCN1CCCO[C@H](CNC(=O)[C@@H](CCC)CC2CCCC2)C1	ZINC001150404578	1379549244	/nfs/dbraw/zinc/54/92/44/1379549244.db2.gz	ZMUQDVNIQPOHDW-VQTJNVASSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)[C@H](CCC)c2ccccc2)C1	ZINC001150686227	1379595578	/nfs/dbraw/zinc/59/55/78/1379595578.db2.gz	XVRLBSYWKSXRTM-VQTJNVASSA-N	0	3	344.499	3.354	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)C[C@H](C)c2ccc(F)cc2)C1	ZINC001150754397	1379607521	/nfs/dbraw/zinc/60/75/21/1379607521.db2.gz	ZOOUEOUQFDIGOQ-LPHOPBHVSA-N	0	3	348.462	3.103	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@H]2CCC[C@H](F)C2)CC1	ZINC001151128014	1379663738	/nfs/dbraw/zinc/66/37/38/1379663738.db2.gz	DGTOFCIFNVWWIQ-IRXDYDNUSA-N	0	3	340.483	3.078	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@@H]2CCCC3(CC3)C2)CC1	ZINC001151128350	1379665150	/nfs/dbraw/zinc/66/51/50/1379665150.db2.gz	KEEAUBCCLRGSTD-QGZVFWFLSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@@H]2CCC(C)=C(C)C2)CC1	ZINC001151144153	1379666939	/nfs/dbraw/zinc/66/69/39/1379666939.db2.gz	CAESXWODFRLXGY-GOSISDBHSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@@H]2C[C@H]2c2ccsc2)CC1	ZINC001151175076	1379672323	/nfs/dbraw/zinc/67/23/23/1379672323.db2.gz	WSPJPNCCYBEAIO-DLBZAZTESA-N	0	3	348.512	3.025	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2ccc(CC)o2)CC1	ZINC001151180623	1379672777	/nfs/dbraw/zinc/67/27/77/1379672777.db2.gz	VUFYOQNCTMYSJM-UHFFFAOYSA-N	0	3	334.460	3.019	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)C[C@@H]2CC=CCC2)CC1	ZINC001151254391	1379688728	/nfs/dbraw/zinc/68/87/28/1379688728.db2.gz	ITBRXUKYCOGFFM-GOSISDBHSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@H]2C[C@H](C)C[C@H](C)C2)CC1	ZINC001151412558	1379715103	/nfs/dbraw/zinc/71/51/03/1379715103.db2.gz	IZLRGZAMLKJILP-PIIMJCKOSA-N	0	3	336.520	3.232	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)CCc1ccco1	ZINC001151836702	1379792657	/nfs/dbraw/zinc/79/26/57/1379792657.db2.gz	SKNLJQPDWYYZBO-MRXNPFEDSA-N	0	3	339.439	3.111	20	30		EGEDHN
C=CC[C@@H](C(=O)NCCNCc1cccc(C#N)c1)c1ccccc1	ZINC001151838500	1379795377	/nfs/dbraw/zinc/79/53/77/1379795377.db2.gz	UNCWCWVKZZGIQY-HXUWFJFHSA-N	0	3	333.435	3.124	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)C(=O)NCCNCc1scnc1C	ZINC001151922495	1379815801	/nfs/dbraw/zinc/81/58/01/1379815801.db2.gz	AGYXVXXGXCOBTN-KRWDZBQOSA-N	0	3	343.496	3.092	20	30		EGEDHN
C=C[C@H](CC(=O)NCCNCc1cnc(C)s1)c1ccccc1	ZINC001151942365	1379821172	/nfs/dbraw/zinc/82/11/72/1379821172.db2.gz	GQPQUPBGWJPQAO-OAHLLOKOSA-N	0	3	329.469	3.017	20	30		EGEDHN
CC(C)(C)c1ccc(C(=O)NCCNCc2ccc(C#N)cc2)s1	ZINC001151946363	1379822480	/nfs/dbraw/zinc/82/24/80/1379822480.db2.gz	HVVHXLJCTOBCME-UHFFFAOYSA-N	0	3	341.480	3.437	20	30		EGEDHN
CC(C)c1ccsc1C(=O)NCCNCc1cccc(C#N)c1	ZINC001152125376	1379866540	/nfs/dbraw/zinc/86/65/40/1379866540.db2.gz	FGYVJANPFSZJBF-UHFFFAOYSA-N	0	3	327.453	3.263	20	30		EGEDHN
CCN(Cc1ccccc1C(F)(F)F)[C@H](C)CNC(=O)[C@H](C)C#N	ZINC001152413979	1379930237	/nfs/dbraw/zinc/93/02/37/1379930237.db2.gz	SWJVUESTVGVJJT-CHWSQXEVSA-N	0	3	341.377	3.192	20	30		EGEDHN
CC(C)(C)[C@@H](CNCc1ccc(C#N)cc1F)NC(=O)C(C)(C)F	ZINC001284562803	1379971871	/nfs/dbraw/zinc/97/18/71/1379971871.db2.gz	RHESWLYUKBZFTF-OAHLLOKOSA-N	0	3	337.414	3.066	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)c2cccc(C3CC3)c2)ccc1F	ZINC001152722156	1379975854	/nfs/dbraw/zinc/97/58/54/1379975854.db2.gz	RMJBLIAULNHLET-UHFFFAOYSA-N	0	3	337.398	3.094	20	30		EGEDHN
C=CCOc1ccc(CC(=O)NCCNCc2csc(C)c2)cc1	ZINC001152770544	1379980295	/nfs/dbraw/zinc/98/02/95/1379980295.db2.gz	RFDZJJNLXBJPNJ-UHFFFAOYSA-N	0	3	344.480	3.070	20	30		EGEDHN
CC[C@@H](C)CC(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)c(F)c1	ZINC001153001126	1380005566	/nfs/dbraw/zinc/00/55/66/1380005566.db2.gz	PDLVYIPIRQIBJH-HUUCEWRRSA-N	0	3	333.451	3.460	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)c1ccoc1Cl	ZINC001153013033	1380008159	/nfs/dbraw/zinc/00/81/59/1380008159.db2.gz	YLWYCTJDIAGOOW-CYBMUJFWSA-N	0	3	345.830	3.445	20	30		EGEDHN
CC[C@H](C)CC(=O)NC[C@@H](C)N(CC)Cc1ccc(OC)c(C#N)c1	ZINC001153013024	1380008574	/nfs/dbraw/zinc/00/85/74/1380008574.db2.gz	YCJPNPVRDSSLJF-JKSUJKDBSA-N	0	3	345.487	3.330	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NC[C@@H](C)N(CC)Cc1cccc(F)c1	ZINC001153441843	1380077115	/nfs/dbraw/zinc/07/71/15/1380077115.db2.gz	NEXJGCMXWSTVCU-LZQZEXGQSA-N	0	3	348.462	3.134	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)CC1CC(c2ccccc2)C1	ZINC001154087281	1380202996	/nfs/dbraw/zinc/20/29/96/1380202996.db2.gz	CEMOKSKWFQMGDN-PGYGNJIDSA-N	0	3	326.484	3.420	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C[C@@H]1C[C@H]1Cc1ccccc1	ZINC001154431474	1380276443	/nfs/dbraw/zinc/27/64/43/1380276443.db2.gz	JHJOSKAFPCTJGX-RLLQIKCJSA-N	0	3	326.484	3.105	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)C1(CF)CCC1	ZINC001155330293	1380437859	/nfs/dbraw/zinc/43/78/59/1380437859.db2.gz	PSQFABFNQPHRTP-OAHLLOKOSA-N	0	3	331.435	3.025	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C1(c2ccc(Cl)cc2)CC1	ZINC001156760503	1380628078	/nfs/dbraw/zinc/62/80/78/1380628078.db2.gz	FHNQOIZBYRCLDY-OAHLLOKOSA-N	0	3	332.875	3.222	20	30		EGEDHN
N#Cc1ccc(-c2cccs2)nc1-n1nc(CN)c2ccccc21	ZINC001156860347	1380701696	/nfs/dbraw/zinc/70/16/96/1380701696.db2.gz	GBDVFHSQNIZLSY-UHFFFAOYSA-N	0	3	331.404	3.479	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1ccc(OCCCC)cc1	ZINC001156857976	1380702639	/nfs/dbraw/zinc/70/26/39/1380702639.db2.gz	IKRIZYNPWYRDMW-QGZVFWFLSA-N	0	3	330.472	3.329	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)C[C@@H]1CCC[C@H](OC)C1	ZINC001755282289	1440800900	/nfs/dbraw/zinc/80/09/00/1440800900.db2.gz	LZSWMIGDMNTISM-CVEARBPZSA-N	0	3	344.927	3.408	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)C[C@H](C)C1CC1	ZINC001157146295	1380786439	/nfs/dbraw/zinc/78/64/39/1380786439.db2.gz	VZCGVBZVPLRWDI-LSDHHAIUSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1sccc1C	ZINC001157458960	1380907458	/nfs/dbraw/zinc/90/74/58/1380907458.db2.gz	QUZJUOAHSPGMNM-MRXNPFEDSA-N	0	3	336.501	3.186	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1oc(C)cc1C	ZINC001157774971	1381029849	/nfs/dbraw/zinc/02/98/49/1381029849.db2.gz	KCQIIJHSLJGLNG-QGZVFWFLSA-N	0	3	334.460	3.026	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc(N(C)C)cc1F	ZINC001158066185	1381118579	/nfs/dbraw/zinc/11/85/79/1381118579.db2.gz	NOUNOWCOEAYOEB-MRXNPFEDSA-N	0	3	333.451	3.004	20	30		EGEDHN
C=C1CCC(C(=O)N2CCCC[C@@H]2CN(C)CCOC(C)C)CC1	ZINC001158434829	1381245190	/nfs/dbraw/zinc/24/51/90/1381245190.db2.gz	NKGGOXOPWVSAEB-LJQANCHMSA-N	0	3	336.520	3.471	20	30		EGEDHN
CC(C)N1CCN(c2c(C#N)cnc3cnc(Cl)cc32)C[C@@H]1C	ZINC001158493926	1381267017	/nfs/dbraw/zinc/26/70/17/1381267017.db2.gz	RXIDOSRYESTPNL-LBPRGKRZSA-N	0	3	329.835	3.074	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cccc2c1ccn2C	ZINC001158616221	1381322051	/nfs/dbraw/zinc/32/20/51/1381322051.db2.gz	IUMQZKZLXXYHHP-MRXNPFEDSA-N	0	3	325.456	3.291	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)C[C@@H](C)c1ccco1	ZINC001158750551	1381382309	/nfs/dbraw/zinc/38/23/09/1381382309.db2.gz	MLHKAQUKSOLGHS-QZTJIDSGSA-N	0	3	348.487	3.289	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)COc1c(C)cc(C)cc1C	ZINC001158825176	1381419187	/nfs/dbraw/zinc/41/91/87/1381419187.db2.gz	NEIIRHBATDPWPE-LJQANCHMSA-N	0	3	344.499	3.490	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCCNCc1ccn(C(CC)CC)n1	ZINC001158887147	1381450403	/nfs/dbraw/zinc/45/04/03/1381450403.db2.gz	PKHMURRBPNSDCF-UHFFFAOYSA-N	0	3	334.508	3.442	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1Cc2cc(C)c(C)cc2O1	ZINC001158893784	1381451354	/nfs/dbraw/zinc/45/13/54/1381451354.db2.gz	CUMAXGQRKMEPMT-QUCCMNQESA-N	0	3	342.483	3.106	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc(N(C)C)c(F)c1	ZINC001158923384	1381465055	/nfs/dbraw/zinc/46/50/55/1381465055.db2.gz	ZLJMPEQFALQBBP-MRXNPFEDSA-N	0	3	333.451	3.004	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)CCc1c(C)noc1Cl	ZINC001158949625	1381481310	/nfs/dbraw/zinc/48/13/10/1381481310.db2.gz	RTEQYVAIMQQEAN-CQSZACIVSA-N	0	3	339.867	3.068	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCC1=CCN([C@H]2CCc3c2cccc3F)CC1	ZINC001159594220	1381840446	/nfs/dbraw/zinc/84/04/46/1381840446.db2.gz	OLTBZCRWOXCCOH-KUHUBIRLSA-N	0	3	341.430	3.111	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCC1=CCN([C@H]2CCc3c2cccc3F)CC1	ZINC001159594221	1381840993	/nfs/dbraw/zinc/84/09/93/1381840993.db2.gz	OLTBZCRWOXCCOH-LIRRHRJNSA-N	0	3	341.430	3.111	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C[C@@H]2C[C@H]2c2ccccc2)CC1	ZINC001160163337	1382021757	/nfs/dbraw/zinc/02/17/57/1382021757.db2.gz	WUDCHGZKMWHBHP-SFTDATJTSA-N	0	3	336.479	3.342	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2conc2C2CCCC2)CC1	ZINC001160337118	1382076526	/nfs/dbraw/zinc/07/65/26/1382076526.db2.gz	ILFHIXZFUMDZMF-UHFFFAOYSA-N	0	3	341.455	3.108	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)N1CCC[C@@H](C(=O)OC(C)(C)C)C1	ZINC001160476722	1382117707	/nfs/dbraw/zinc/11/77/07/1382117707.db2.gz	LHHXBGZHYFHYNX-CVEARBPZSA-N	0	3	338.492	3.031	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@H]2CCCc3ccccc32)CC1	ZINC001160492596	1382122119	/nfs/dbraw/zinc/12/21/19/1382122119.db2.gz	VDQKJVBIUIYWIO-NRFANRHFSA-N	0	3	336.479	3.268	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)COC/C=C\c2ccccc2)CC1	ZINC001160492668	1382122460	/nfs/dbraw/zinc/12/24/60/1382122460.db2.gz	YEDAWQOQIYMNGO-TWGQIWQCSA-N	0	3	340.467	3.041	20	30		EGEDHN
C=CCOc1ccc(C(=O)NCCC2=CCN(CC#CC)CC2)cc1	ZINC001160515115	1382128639	/nfs/dbraw/zinc/12/86/39/1382128639.db2.gz	PEKQEEUWHCDHKN-UHFFFAOYSA-N	0	3	338.451	3.027	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccnc3ccccc32)CC1	ZINC001160617819	1382153923	/nfs/dbraw/zinc/15/39/23/1382153923.db2.gz	VCYCSKBCHZMTSO-UHFFFAOYSA-N	0	3	333.435	3.010	20	30		EGEDHN
N#Cc1cccnc1N[C@H](c1ccccc1O)[C@H]([NH3+])c1ccccc1[O-]	ZINC001160616361	1382154082	/nfs/dbraw/zinc/15/40/82/1382154082.db2.gz	IDIFTNSDHHLESQ-RTBURBONSA-N	0	3	346.390	3.218	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)[C@@H]2CCC=CCCC2)c(F)c1	ZINC001160820635	1382208167	/nfs/dbraw/zinc/20/81/67/1382208167.db2.gz	PPKSBTWPZUZHCS-QGZVFWFLSA-N	0	3	343.446	3.430	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2oc3ccccc3c2OC)CC1	ZINC001160860297	1382218151	/nfs/dbraw/zinc/21/81/51/1382218151.db2.gz	HBVHJZHSSNSZBX-UHFFFAOYSA-N	0	3	340.423	3.379	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCC1=CCN(Cc2cnccc2C)CC1	ZINC001160941848	1382245126	/nfs/dbraw/zinc/24/51/26/1382245126.db2.gz	RQJLPMMMSJXOTJ-WMZOPIPTSA-N	0	3	341.499	3.487	20	30		EGEDHN
C=CCN1CCC[C@H]1CNc1ccc(NC(=O)OC(C)(C)C)cn1	ZINC001160953534	1382250287	/nfs/dbraw/zinc/25/02/87/1382250287.db2.gz	DHBFLEYXCQHRGH-HNNXBMFYSA-N	0	3	332.448	3.491	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCC2=CCN(Cc3cnccc3C)CC2)C1	ZINC001161177941	1382326273	/nfs/dbraw/zinc/32/62/73/1382326273.db2.gz	GFSTVJBFGJVMOS-UHFFFAOYSA-N	0	3	339.483	3.385	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C2(c3cccc(OC)c3)CC2)CC1	ZINC001161356283	1382380657	/nfs/dbraw/zinc/38/06/57/1382380657.db2.gz	IVMHXPUUDBKSJU-UHFFFAOYSA-N	0	3	340.467	3.051	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc(C)c(OCC)c2)CC1	ZINC001161376105	1382389266	/nfs/dbraw/zinc/38/92/66/1382389266.db2.gz	KYRGKNMULGGNNP-UHFFFAOYSA-N	0	3	340.467	3.169	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)Cc2c[nH]c3cc(C)ccc23)CC1	ZINC001161452715	1382415560	/nfs/dbraw/zinc/41/55/60/1382415560.db2.gz	VXICBZPPSTUIBL-UHFFFAOYSA-N	0	3	349.478	3.181	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C2(CCOCC)CCCC2)CC1	ZINC001161559416	1382439500	/nfs/dbraw/zinc/43/95/00/1382439500.db2.gz	DJYYQYZWQQRRNR-UHFFFAOYSA-N	0	3	334.504	3.298	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@H]2C[C@]23CCc2ccccc23)CC1	ZINC001161617810	1382460639	/nfs/dbraw/zinc/46/06/39/1382460639.db2.gz	UDXPDSYOZZBHIN-GGAORHGYSA-N	0	3	348.490	3.052	20	30		EGEDHN
N#C[C@@H](Nc1cccc2cc([C@@H]3CNCCO3)cn21)c1ccccc1	ZINC001161721160	1382488971	/nfs/dbraw/zinc/48/89/71/1382488971.db2.gz	LIXKPLDWOQKJME-MOPGFXCFSA-N	0	3	332.407	3.277	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)CCc2c[nH]c3ccccc23)CC1	ZINC001161817904	1382518870	/nfs/dbraw/zinc/51/88/70/1382518870.db2.gz	GYERGBVLNYKNAS-UHFFFAOYSA-N	0	3	349.478	3.262	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1cccc2cccnc21	ZINC001161923199	1382553451	/nfs/dbraw/zinc/55/34/51/1382553451.db2.gz	AMJRXCSGFLLXNQ-UHFFFAOYSA-N	0	3	344.418	3.016	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@H]2CCC[C@@H]2CCC)(COC)CC1	ZINC001162335271	1382732220	/nfs/dbraw/zinc/73/22/20/1382732220.db2.gz	HPVPEBKQXUGHAX-OALUTQOASA-N	0	3	348.531	3.071	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC1(COC)CCN(C[C@@H](F)CC)CC1	ZINC001162464792	1382764939	/nfs/dbraw/zinc/76/49/39/1382764939.db2.gz	VDPQOBUBLVBNNJ-FUHWJXTLSA-N	0	3	342.499	3.182	20	30		EGEDHN
C#CCN1CCC(CNC(=O)CCCCCCCC)(COC)CC1	ZINC001162590173	1382801167	/nfs/dbraw/zinc/80/11/67/1382801167.db2.gz	GRFQNXGWZASGTD-UHFFFAOYSA-N	0	3	336.520	3.215	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C[C@H](C)CCC	ZINC001162732798	1382850535	/nfs/dbraw/zinc/85/05/35/1382850535.db2.gz	JRKLEZWVSJIOID-LJQANCHMSA-N	0	3	328.500	3.497	20	30		EGEDHN
C=CCC(CC=C)C(=O)N(CCNCC#CC)CCc1ccccc1	ZINC001162822008	1382886020	/nfs/dbraw/zinc/88/60/20/1382886020.db2.gz	CIRLXJYHUDSFHF-UHFFFAOYSA-N	0	3	338.495	3.439	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C1(C2CCC2)CCC1	ZINC001162871156	1382900675	/nfs/dbraw/zinc/90/06/75/1382900675.db2.gz	JSCSBMVYXWEUEV-UHFFFAOYSA-N	0	3	338.495	3.251	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)CCc1cccc(C)c1	ZINC001162877203	1382903128	/nfs/dbraw/zinc/90/31/28/1382903128.db2.gz	WKLXYSZOZJYBTN-UHFFFAOYSA-N	0	3	348.490	3.222	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C[C@H]1CC=CCC1	ZINC001162888185	1382905070	/nfs/dbraw/zinc/90/50/70/1382905070.db2.gz	QTPFUDDSEYFXDR-NRFANRHFSA-N	0	3	338.495	3.417	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@]1(C)CCC[C@H]1C	ZINC001162918651	1382916324	/nfs/dbraw/zinc/91/63/24/1382916324.db2.gz	FWAQKQSTKJRDRG-WIYYLYMNSA-N	0	3	326.484	3.107	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CCC[C@H]1CC	ZINC001162918899	1382917043	/nfs/dbraw/zinc/91/70/43/1382917043.db2.gz	ILQGWWVOLGYQFX-NHCUHLMSSA-N	0	3	340.511	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CCC(C)(C)C1	ZINC001162925038	1382918289	/nfs/dbraw/zinc/91/82/89/1382918289.db2.gz	ZABSPCNLGYVNDI-LJQANCHMSA-N	0	3	326.484	3.107	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CCC(C)(C)C1	ZINC001162924308	1382918328	/nfs/dbraw/zinc/91/83/28/1382918328.db2.gz	MGQABXNUOFBAHI-HXUWFJFHSA-N	0	3	340.511	3.497	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@H]1C[C@@]1(C)C(C)C	ZINC001162970750	1382932029	/nfs/dbraw/zinc/93/20/29/1382932029.db2.gz	JPKFTJVUJUUMGX-IRLDBZIGSA-N	0	3	340.511	3.353	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@H](CC)CCC	ZINC001162971130	1382932857	/nfs/dbraw/zinc/93/28/57/1382932857.db2.gz	YIECXXATGRVZEV-HXUWFJFHSA-N	0	3	328.500	3.497	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)[C@@H]1CCCC[C@@H]1C1CC1	ZINC001163171582	1382982945	/nfs/dbraw/zinc/98/29/45/1382982945.db2.gz	KXITXGVPKDWJDF-WOJBJXKFSA-N	0	3	339.483	3.371	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)[C@@H]2CC=CCC2)CC1	ZINC001163388756	1383038878	/nfs/dbraw/zinc/03/88/78/1383038878.db2.gz	GQFWVTVCINXWSL-CQSZACIVSA-N	0	3	341.293	3.127	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)CC(C)(C)C)CC1	ZINC001163446881	1383052849	/nfs/dbraw/zinc/05/28/49/1383052849.db2.gz	GEVYGVHNRUKGTL-UHFFFAOYSA-N	0	3	331.298	3.207	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1cccc2ncccc21	ZINC001163549087	1383075384	/nfs/dbraw/zinc/07/53/84/1383075384.db2.gz	QEEAJWUZRNKPRN-UHFFFAOYSA-N	0	3	344.418	3.016	20	30		EGEDHN
CC/C=C(\C)C(=O)NCCC1(CNCc2ccc(C#N)cc2F)CC1	ZINC001163676542	1383103636	/nfs/dbraw/zinc/10/36/36/1383103636.db2.gz	BGGPBNWCBXCXCQ-SYZQJQIISA-N	0	3	343.446	3.430	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NCCC1(CNCC=C(Cl)Cl)CC1	ZINC001163707044	1383110420	/nfs/dbraw/zinc/11/04/20/1383110420.db2.gz	NPAXZJHUXIQHEC-ZDUSSCGKSA-N	0	3	349.302	3.163	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCC1(CNCc2cccc(Cl)c2F)CC1	ZINC001163854920	1383129815	/nfs/dbraw/zinc/12/98/15/1383129815.db2.gz	VFUIBVGELURPST-GFCCVEGCSA-N	0	3	337.826	3.015	20	30		EGEDHN
CC#CCCCC(=O)NCCCNCc1nsc2ccccc21	ZINC001164245301	1383170787	/nfs/dbraw/zinc/17/07/87/1383170787.db2.gz	ZYYRTDJYUORRHI-UHFFFAOYSA-N	0	3	329.469	3.086	20	30		EGEDHN
Cc1cnc(N2C[C@@H](C)N(Cc3ccccc3)C[C@@H]2C)c(C=NO)c1	ZINC001165203593	1383248661	/nfs/dbraw/zinc/24/86/61/1383248661.db2.gz	ZEBQGYXYZRWTKZ-SJORKVTESA-N	0	3	338.455	3.297	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C(C)(C)c2cc(C)ccn2)CC1	ZINC001165728725	1383334237	/nfs/dbraw/zinc/33/42/37/1383334237.db2.gz	RQVXKNGIGIEUOI-UHFFFAOYSA-N	0	3	349.906	3.296	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2c3c[nH]nc3ccc2C)CC1	ZINC001165886884	1383357074	/nfs/dbraw/zinc/35/70/74/1383357074.db2.gz	NSFOYMUHHLMGMV-UHFFFAOYSA-N	0	3	346.862	3.114	20	30		EGEDHN
C=C1CCC(C(=O)NCCCNCc2ccn(C3CCCC3)n2)CC1	ZINC001165901334	1383361911	/nfs/dbraw/zinc/36/19/11/1383361911.db2.gz	RZDWBGYNOJMQQH-UHFFFAOYSA-N	0	3	344.503	3.341	20	30		EGEDHN
C=CCCC1(C(=O)NCCCNCc2cnc(Cl)s2)CC1	ZINC001165913936	1383364270	/nfs/dbraw/zinc/36/42/70/1383364270.db2.gz	PEOGAZSCKKQLJV-UHFFFAOYSA-N	0	3	327.881	3.139	20	30		EGEDHN
CC[C@@H]1CCC[C@@H]1C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001166036240	1383380085	/nfs/dbraw/zinc/38/00/85/1383380085.db2.gz	MAHASJHDEXHMSI-WBVHZDCISA-N	0	3	331.435	3.120	20	30		EGEDHN
CC[C@H]1CCC[C@@H]1C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001166035894	1383380126	/nfs/dbraw/zinc/38/01/26/1383380126.db2.gz	HLDGYQZTRAEKCJ-RDJZCZTQSA-N	0	3	331.435	3.120	20	30		EGEDHN
C[C@H](C(=O)NCCCNCc1ccc(C#N)cc1F)c1cccs1	ZINC001166510912	1383431185	/nfs/dbraw/zinc/43/11/85/1383431185.db2.gz	RUUGUHQFFXZQDB-ZDUSSCGKSA-N	0	3	345.443	3.158	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCC1(CNCc2ccc(F)cn2)CC1	ZINC001166696031	1383462559	/nfs/dbraw/zinc/46/25/59/1383462559.db2.gz	VQQABUHXHYXPOZ-LSDHHAIUSA-N	0	3	333.451	3.055	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCC1(CNCc2c(C)noc2CC)CC1	ZINC001166703714	1383463544	/nfs/dbraw/zinc/46/35/44/1383463544.db2.gz	JSYGSPSMZMWDST-LSDHHAIUSA-N	0	3	347.503	3.380	20	30		EGEDHN
CC#CCCCC(=O)NCCC1(CNCc2cc(C3CC3)no2)CC1	ZINC001166710490	1383464671	/nfs/dbraw/zinc/46/46/71/1383464671.db2.gz	ZLQCZOYHKKGRDZ-UHFFFAOYSA-N	0	3	343.471	3.122	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCC1(CNCc2nc(C)cs2)CC1	ZINC001167025750	1383521757	/nfs/dbraw/zinc/52/17/57/1383521757.db2.gz	LCIYTFMBMZGPIO-QGZVFWFLSA-N	0	3	335.517	3.430	20	30		EGEDHN
C=CCCC1(C(=O)NCCC2(CNCc3ccns3)CC2)CC1	ZINC001167026261	1383522475	/nfs/dbraw/zinc/52/24/75/1383522475.db2.gz	XLGCLZYSIMSLFR-UHFFFAOYSA-N	0	3	333.501	3.266	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cc(F)c(F)c(F)c2)CC1	ZINC001167311823	1383592756	/nfs/dbraw/zinc/59/27/56/1383592756.db2.gz	FMFYCJYVJRBLOR-UHFFFAOYSA-N	0	3	346.780	3.346	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCC1(CN[C@H](C)c2cnc(C)cn2)CC1	ZINC001167340325	1383603683	/nfs/dbraw/zinc/60/36/83/1383603683.db2.gz	XXCATMSPTDMONF-MRXNPFEDSA-N	0	3	344.503	3.324	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cc3c(C)cccn3c2)CC1	ZINC001167725032	1383722775	/nfs/dbraw/zinc/72/27/75/1383722775.db2.gz	XWSDYHGLJHYCGT-UHFFFAOYSA-N	0	3	345.874	3.490	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)COC2CCC(C)CC2)CC1	ZINC001168485569	1383919779	/nfs/dbraw/zinc/91/97/79/1383919779.db2.gz	WZLSCDHNBQQUQM-UHFFFAOYSA-N	0	3	342.911	3.210	20	30		EGEDHN
Cc1cccc(C(=O)NCCCNCc2ccccc2C#N)c1Cl	ZINC001168782219	1384003270	/nfs/dbraw/zinc/00/32/70/1384003270.db2.gz	ZBOKMWABROCGNM-UHFFFAOYSA-N	0	3	341.842	3.430	20	30		EGEDHN
C[C@H](CCCCNCc1cc(F)ccc1C#N)NC(=O)c1ccc[nH]1	ZINC001169121545	1384109997	/nfs/dbraw/zinc/10/99/97/1384109997.db2.gz	LZJYOHRFCNSJPJ-CQSZACIVSA-N	0	3	342.418	3.104	20	30		EGEDHN
CCN(CC)C(=O)C[C@H](C)N1CCC(C#N)(c2ccccc2F)CC1	ZINC001169491137	1384154334	/nfs/dbraw/zinc/15/43/34/1384154334.db2.gz	WZWCEGGDDXRGFN-INIZCTEOSA-N	0	3	345.462	3.330	20	30		EGEDHN
CN(C)/C=N/c1ccc(NC(C)(C)C(=O)OC(C)(C)C)cc1C#N	ZINC001169582214	1384161859	/nfs/dbraw/zinc/16/18/59/1384161859.db2.gz	BHEKYLMMUBWDKL-UDWIEESQSA-N	0	3	330.432	3.312	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)C1=COCCC1	ZINC001169697903	1384174757	/nfs/dbraw/zinc/17/47/57/1384174757.db2.gz	TZYBIXOAJXKQBY-INIZCTEOSA-N	0	3	341.455	3.017	20	30		EGEDHN
CCC1(C(=O)NCCCNCc2cc(C#N)ccc2F)CCCC1	ZINC001169862768	1384192646	/nfs/dbraw/zinc/19/26/46/1384192646.db2.gz	NKENEXOZIFDFMB-UHFFFAOYSA-N	0	3	331.435	3.264	20	30		EGEDHN
COC(=O)c1cccnc1CNC1CCC(C#N)(c2ccccc2)CC1	ZINC001170365316	1384302267	/nfs/dbraw/zinc/30/22/67/1384302267.db2.gz	VPYADSNBLYKFIU-UHFFFAOYSA-N	0	3	349.434	3.362	20	30		EGEDHN
CC[C@@H](CC(C)C)C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001170511306	1384331549	/nfs/dbraw/zinc/33/15/49/1384331549.db2.gz	PTFYOFPXEIHCQL-INIZCTEOSA-N	0	3	333.451	3.366	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H](C)CCCCNCc1cnns1	ZINC001170992720	1384426191	/nfs/dbraw/zinc/42/61/91/1384426191.db2.gz	ZNXZQNFQERXWOE-NSHDSACASA-N	0	3	344.912	3.081	20	30		EGEDHN
CN(C)/C=N/c1ccc(N[C@@H]2CCc3ccc(O)cc3C2)cc1C#N	ZINC001171033416	1384433553	/nfs/dbraw/zinc/43/35/53/1384433553.db2.gz	STRCWVTZMOXGGM-NEIHUHTASA-N	0	3	334.423	3.455	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1CC[C@@](O)(C(F)(F)F)[C@@H](C)C1	ZINC001171208839	1384468934	/nfs/dbraw/zinc/46/89/34/1384468934.db2.gz	FRTCZKDKTGJJMN-ZENOOKHLSA-N	0	3	326.362	3.124	20	30		EGEDHN
C[C@@H](Cc1cccc(C#N)c1)N1CCCN(C(=O)c2ccccc2)CC1	ZINC001171231006	1384474989	/nfs/dbraw/zinc/47/49/89/1384474989.db2.gz	ZQRFLXSAZJULJP-SFHVURJKSA-N	0	3	347.462	3.337	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)c1cc(F)c[nH]1	ZINC001171832156	1384654839	/nfs/dbraw/zinc/65/48/39/1384654839.db2.gz	RVLLFIVYGDCVSZ-AWEZNQCLSA-N	0	3	342.418	3.104	20	30		EGEDHN
C=CCOC(=O)N[C@H]1CCCN([C@@H]2CSc3ccccc3C2)C1	ZINC001172207601	1384748662	/nfs/dbraw/zinc/74/86/62/1384748662.db2.gz	HXVFSYUCVQPLKB-HOTGVXAUSA-N	0	3	332.469	3.080	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)N1CCN(c2ccc(C#N)cc2)CC1	ZINC001172306010	1384764611	/nfs/dbraw/zinc/76/46/11/1384764611.db2.gz	HWUTXWUVWPJISD-QGZVFWFLSA-N	0	3	330.435	3.183	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)N1CCN(CCOc2ccccc2)CC1	ZINC001172308030	1384765526	/nfs/dbraw/zinc/76/55/26/1384765526.db2.gz	SNJSUXYYOIZTFH-IBGZPJMESA-N	0	3	349.478	3.186	20	30		EGEDHN
COC(=O)c1ccc(CN[C@@H](C)CCCC#N)c(Br)c1	ZINC001172489750	1384803981	/nfs/dbraw/zinc/80/39/81/1384803981.db2.gz	ZCDFEMPJIVCOIY-NSHDSACASA-N	0	3	339.233	3.408	20	30		EGEDHN
Cc1cc(C)c(C(=O)NC[C@@H](C)NCc2ccc(C#N)s2)s1	ZINC001317243178	1385016637	/nfs/dbraw/zinc/01/66/37/1385016637.db2.gz	XKZODZMBUPZAIJ-LLVKDONJSA-N	0	3	333.482	3.206	20	30		EGEDHN
Cc1cnccc1Nc1cc(C)c(C#N)cc1I	ZINC001174538299	1385117864	/nfs/dbraw/zinc/11/78/64/1385117864.db2.gz	FXXXGYQDYSIDKQ-UHFFFAOYSA-N	0	3	349.175	3.340	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H](C)CCCCNCc1csnc1OC	ZINC001174683645	1385134307	/nfs/dbraw/zinc/13/43/07/1385134307.db2.gz	UVKLYUSVVJVNHM-CYBMUJFWSA-N	0	3	339.505	3.129	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H](C)CCCCNCc1cc2n(n1)CCC2	ZINC001174834041	1385157266	/nfs/dbraw/zinc/15/72/66/1385157266.db2.gz	VDKMWTMUQVJLFP-DLBZAZTESA-N	0	3	346.519	3.196	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@H](C)CCCCNCc1nccn1CC	ZINC001174848717	1385159262	/nfs/dbraw/zinc/15/92/62/1385159262.db2.gz	GQRXCYCDBGDNBU-SJORKVTESA-N	0	3	334.508	3.270	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H](C)CCCCNCc1cc2n(n1)CCC2	ZINC001175081918	1385191628	/nfs/dbraw/zinc/19/16/28/1385191628.db2.gz	KIUXUPUVDZGXSV-OXJNMPFZSA-N	0	3	346.519	3.196	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)CCCCNCc2ocnc2C)CCC1	ZINC001175097839	1385194473	/nfs/dbraw/zinc/19/44/73/1385194473.db2.gz	OLFYTPATFBJLOL-HNNXBMFYSA-N	0	3	333.476	3.494	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1sccc1C1CC1	ZINC001175348473	1385260740	/nfs/dbraw/zinc/26/07/40/1385260740.db2.gz	FHBNQTDWVLLOER-UHFFFAOYSA-N	0	3	339.464	3.407	20	30		EGEDHN
CCCC(C)(C)C(=O)NC[C@H]1CCN(Cc2ccc(C#N)cc2)C1	ZINC001317538185	1385270366	/nfs/dbraw/zinc/27/03/66/1385270366.db2.gz	UPLLEYQENHPQKR-GOSISDBHSA-N	0	3	327.472	3.323	20	30		EGEDHN
CCN1CCN(c2ccc(-n3cc(C#N)c4cc(N)ccc43)cc2)CC1	ZINC001175783138	1385404312	/nfs/dbraw/zinc/40/43/12/1385404312.db2.gz	YNVYFEKSZZTNQP-UHFFFAOYSA-N	0	3	345.450	3.226	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)Cc1ccco1	ZINC001175812320	1385412440	/nfs/dbraw/zinc/41/24/40/1385412440.db2.gz	NCBIURNBYIEZGS-INIZCTEOSA-N	0	3	339.439	3.159	20	30		EGEDHN
N#Cc1cccc(OCCN2CC[C@H](Oc3ccc(F)cc3)C2)c1	ZINC001175925838	1385439355	/nfs/dbraw/zinc/43/93/55/1385439355.db2.gz	NJXOHFPMACXGMI-IBGZPJMESA-N	0	3	326.371	3.229	20	30		EGEDHN
Cc1nc(C(=O)N(c2ccccc2)C2CCN(C)CC2)ccc1C#N	ZINC001318436531	1385688958	/nfs/dbraw/zinc/68/89/58/1385688958.db2.gz	JYASQKWTTCMTQN-UHFFFAOYSA-N	0	3	334.423	3.003	20	30		EGEDHN
C[C@@H]1CCCC[C@@H]1CC(=O)NCCCNCc1ccccc1C#N	ZINC001177309867	1385907761	/nfs/dbraw/zinc/90/77/61/1385907761.db2.gz	JRAFEWZVKIQUTD-IAGOWNOFSA-N	0	3	327.472	3.371	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@@H]1CO[C@@H](C)C1	ZINC001177353379	1385926735	/nfs/dbraw/zinc/92/67/35/1385926735.db2.gz	ZQTGRTNZHVRQRL-RDJZCZTQSA-N	0	3	342.911	3.162	20	30		EGEDHN
C=CCCCC(=O)N(CCCNCc1ccn(C)n1)CC1CCCC1	ZINC001177397801	1385942862	/nfs/dbraw/zinc/94/28/62/1385942862.db2.gz	GAMWIDQJSFVLSF-UHFFFAOYSA-N	0	3	346.519	3.275	20	30		EGEDHN
C=CCC1(C(=O)NCCCNCc2c(C)noc2CC)CCCC1	ZINC001177547826	1385992371	/nfs/dbraw/zinc/99/23/71/1385992371.db2.gz	FMQZKWIJTXNOAG-UHFFFAOYSA-N	0	3	333.476	3.278	20	30		EGEDHN
COCCNc1cccc(F)c1NC(=O)C(C#N)Cc1cccs1	ZINC001177915625	1386082743	/nfs/dbraw/zinc/08/27/43/1386082743.db2.gz	AKCNWAIGTXJQSV-GFCCVEGCSA-N	0	3	347.415	3.266	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccc(Cl)cc2)CCN1C(=O)C1CCC1	ZINC001178025859	1386111366	/nfs/dbraw/zinc/11/13/66/1386111366.db2.gz	FARYSKQQYURQDF-KSSFIOAISA-N	0	3	330.859	3.071	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCCCCCN[C@H](C)c1nc2ccccc2o1	ZINC001178053487	1386117595	/nfs/dbraw/zinc/11/75/95/1386117595.db2.gz	SRCJCAPEHSTUPE-HUUCEWRRSA-N	0	3	342.443	3.315	20	30		EGEDHN
N#Cc1ccccc1CNCCCCCCNC(=O)C1=CCCC1	ZINC001178184703	1386152803	/nfs/dbraw/zinc/15/28/03/1386152803.db2.gz	PNGZFMLEXGNEBD-UHFFFAOYSA-N	0	3	325.456	3.435	20	30		EGEDHN
C[C@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)CCCC1CC1	ZINC001319513826	1386155149	/nfs/dbraw/zinc/15/51/49/1386155149.db2.gz	CWUUSASAYLYCFR-CQSZACIVSA-N	0	3	331.435	3.214	20	30		EGEDHN
C[C@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)C1CC2(CCC2)C1	ZINC001319514288	1386155228	/nfs/dbraw/zinc/15/52/28/1386155228.db2.gz	KHTVOSMFKUEUBI-CQSZACIVSA-N	0	3	343.446	3.214	20	30		EGEDHN
C#CCCCC(=O)NCCCCCCNCc1cc(F)ccc1C#N	ZINC001178327524	1386189233	/nfs/dbraw/zinc/18/92/33/1386189233.db2.gz	HLLXSSJHYTTYHB-UHFFFAOYSA-N	0	3	343.446	3.267	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2cccc(Cl)c2)CCN1C(=O)C1CC=CC1	ZINC001178401251	1386206116	/nfs/dbraw/zinc/20/61/16/1386206116.db2.gz	MLEGFLQVWNUJGG-KXBFYZLASA-N	0	3	342.870	3.237	20	30		EGEDHN
C=C(C)CCC(=O)NCCCCCCN[C@H](C)c1nnc(CC)[nH]1	ZINC001178598323	1386259155	/nfs/dbraw/zinc/25/91/55/1386259155.db2.gz	AIDRBGLJWQAJCW-OAHLLOKOSA-N	0	3	335.496	3.051	20	30		EGEDHN
COc1cc(Cl)ccc1CN[C@H]1CCN(C(=O)C#CC(C)C)[C@H]1C	ZINC001178652722	1386269898	/nfs/dbraw/zinc/26/98/98/1386269898.db2.gz	AJIKDUPTUAKXEE-YOEHRIQHSA-N	0	3	348.874	3.087	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)c1cc2occc2[nH]1	ZINC001178809267	1386314576	/nfs/dbraw/zinc/31/45/76/1386314576.db2.gz	WERHNZWMUOZSJR-RDJZCZTQSA-N	0	3	347.418	3.005	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](NCc2cc(C)ccc2OC)[C@@H]1C	ZINC001179463197	1386487687	/nfs/dbraw/zinc/48/76/87/1386487687.db2.gz	DKBZYPDYGXLHFQ-WMZOPIPTSA-N	0	3	330.472	3.439	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccc(Cl)cc2)CCN1C(=O)[C@@H]1CC12CC2	ZINC001179598415	1386528099	/nfs/dbraw/zinc/52/80/99/1386528099.db2.gz	GHQVYTBRNDUFNK-WBAXXEDZSA-N	0	3	342.870	3.071	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)COc1ccc(C)cc1)C1CC1	ZINC001698653437	1406302877	/nfs/dbraw/zinc/30/28/77/1406302877.db2.gz	PEACJUXSWWJPHX-GOSISDBHSA-N	0	3	336.863	3.001	20	30		EGEDHN
CCC[C@H](CC)C(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C	ZINC001179807027	1386593413	/nfs/dbraw/zinc/59/34/13/1386593413.db2.gz	OKRIITKZPNIHQA-IHPCNDPISA-N	0	3	326.484	3.443	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)Cc2ccc(C)nc2)CCCC[C@H]1C	ZINC001698660647	1406311835	/nfs/dbraw/zinc/31/18/35/1406311835.db2.gz	KVOJXWUQJHJVOI-KUHUBIRLSA-N	0	3	349.906	3.340	20	30		EGEDHN
C[C@@H]1CN(C(=O)C(C)(C)F)C[C@@]1(C)CNCc1cc(F)ccc1C#N	ZINC001180366124	1386775889	/nfs/dbraw/zinc/77/58/89/1386775889.db2.gz	AEJNOLUVNGKRPQ-BFUOFWGJSA-N	0	3	349.425	3.020	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NCCCCCCNC/C(Cl)=C/Cl	ZINC001180433170	1386795169	/nfs/dbraw/zinc/79/51/69/1386795169.db2.gz	CYDZQQIOCXKURP-KECPUOCWSA-N	0	3	337.291	3.163	20	30		EGEDHN
CC1(C)CN(C2(CNc3cccc(CC#N)n3)CCCCC2)CCO1	ZINC001321329179	1386878299	/nfs/dbraw/zinc/87/82/99/1386878299.db2.gz	POFBHWJCEDRUGN-UHFFFAOYSA-N	0	3	342.487	3.373	20	30		EGEDHN
CN1CCC(N(C(=O)Cc2ccc(F)c(C#N)c2)C2CCCC2)CC1	ZINC001181182444	1386953117	/nfs/dbraw/zinc/95/31/17/1386953117.db2.gz	LJDWYEKDIMBLDP-UHFFFAOYSA-N	0	3	343.446	3.105	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@@H](C)[C@](C)(CNCc2nccn2CC)C1	ZINC001182305547	1387142924	/nfs/dbraw/zinc/14/29/24/1387142924.db2.gz	JPSCPJSWFFMAAX-MBOZVWFJSA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H](C)[C@](C)(CNCc2oc(C)nc2C)C1	ZINC001182524189	1387182023	/nfs/dbraw/zinc/18/20/23/1387182023.db2.gz	CHHVPDPQNKQEDL-VOBQZIQPSA-N	0	3	347.503	3.468	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](N[C@@H]2CCc3c2cc(F)cc3F)C1	ZINC001182933993	1387248854	/nfs/dbraw/zinc/24/88/54/1387248854.db2.gz	ZHHNKXNZEGURKQ-RDTXWAMCSA-N	0	3	334.410	3.499	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)Cc1c(C)noc1Cl	ZINC001329342115	1389067993	/nfs/dbraw/zinc/06/79/93/1389067993.db2.gz	QXYFDYSLDLQYDV-UHFFFAOYSA-N	0	3	348.274	3.006	20	30		EGEDHN
C[C@H](c1ccc(Cl)cc1)N(C)[C@@H](C)CNC(=O)c1cc(C#N)c[nH]1	ZINC001329409938	1389100610	/nfs/dbraw/zinc/10/06/10/1389100610.db2.gz	MAGPVYJKGSDJGE-QWHCGFSZSA-N	0	3	344.846	3.351	20	30		EGEDHN
Cc1ccc(CC(=O)NC[C@@H](C)N(C)Cc2cccc(C#N)c2)cc1C	ZINC001329611148	1389184008	/nfs/dbraw/zinc/18/40/08/1389184008.db2.gz	ZPXBKRAPYLMCCF-GOSISDBHSA-N	0	3	349.478	3.354	20	30		EGEDHN
CN(C(=O)C1=CCCC1)[C@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001331273200	1389680005	/nfs/dbraw/zinc/68/00/05/1389680005.db2.gz	CWCUTJQNASGRJY-LJQANCHMSA-N	0	3	341.430	3.134	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)CCc1ccsc1	ZINC001698749534	1406400424	/nfs/dbraw/zinc/40/04/24/1406400424.db2.gz	VXWCUOLTHUBYIS-OAHLLOKOSA-N	0	3	341.480	3.094	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)N1CCC(c2nc(C)no2)CC1	ZINC001339997267	1390205283	/nfs/dbraw/zinc/20/52/83/1390205283.db2.gz	XZCMHOOOIBAEOJ-INIZCTEOSA-N	0	3	336.480	3.162	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccc(OCC2CCOCC2)cc1	ZINC001340078335	1390221801	/nfs/dbraw/zinc/22/18/01/1390221801.db2.gz	ARULBAPGLDNSDX-GOSISDBHSA-N	0	3	332.444	3.114	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc(C)c(C(=O)N(C)C(C)C)c1	ZINC001340254424	1390258853	/nfs/dbraw/zinc/25/88/53/1390258853.db2.gz	SFDNMJFNNZNSKD-KRWDZBQOSA-N	0	3	331.460	3.098	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N[C@H](c1c(F)cccc1F)C(F)(F)F	ZINC001340428015	1390287446	/nfs/dbraw/zinc/28/74/46/1390287446.db2.gz	FCZBKDNONZRHAW-WCQYABFASA-N	0	3	336.304	3.368	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N[C@@H]1CCc2c1cccc2Br	ZINC001341421781	1390485183	/nfs/dbraw/zinc/48/51/83/1390485183.db2.gz	FNCGVCDGGPBXBE-HUUCEWRRSA-N	0	3	337.261	3.236	20	30		EGEDHN
CCCc1c(C(=O)C(C#N)c2nccn2C)cnn1-c1cccc(C)c1	ZINC001342268738	1390593789	/nfs/dbraw/zinc/59/37/89/1390593789.db2.gz	QGIAFFYIMLOLCQ-INIZCTEOSA-N	0	3	347.422	3.357	20	30		EGEDHN
CCc1c(C(=O)C(C#N)c2nccn2CC)cnn1-c1ccc(C)cc1	ZINC001344875133	1390821111	/nfs/dbraw/zinc/82/11/11/1390821111.db2.gz	KSFFTLGISJLJSJ-MRXNPFEDSA-N	0	3	347.422	3.450	20	30		EGEDHN
C[C@H](C#N)C(=O)NCC1(N[C@@H](C)c2cc(F)ccc2F)CCCC1	ZINC001698795536	1406463937	/nfs/dbraw/zinc/46/39/37/1406463937.db2.gz	FSNYVALRIGAYLR-OLZOCXBDSA-N	0	3	335.398	3.204	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)c1cc(C(C)C)nc2onc(C)c21	ZINC001346095781	1390907050	/nfs/dbraw/zinc/90/70/50/1390907050.db2.gz	IZJHIMCVDCZDGR-ZDUSSCGKSA-N	0	3	337.383	3.361	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)Cc2cc(C)ccc2F)CCCC1	ZINC001698806950	1406490044	/nfs/dbraw/zinc/49/00/44/1406490044.db2.gz	UEMVFKRMYBBOKF-UHFFFAOYSA-N	0	3	338.854	3.448	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N(C)C[C@H]1CC=CCC1	ZINC001351544363	1391650588	/nfs/dbraw/zinc/65/05/88/1391650588.db2.gz	OSJDXIWXTBPGSW-IRXDYDNUSA-N	0	3	329.492	3.066	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N1CCC[C@H](c2nc3c(s2)CCC3)C1	ZINC001354842107	1392172285	/nfs/dbraw/zinc/17/22/85/1392172285.db2.gz	RXQCEEALRVDCAX-KBPBESRZSA-N	0	3	333.501	3.021	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](N[C@H]2CCc3c2cc(F)cc3F)C1	ZINC001480615572	1392821533	/nfs/dbraw/zinc/82/15/33/1392821533.db2.gz	ZHHNKXNZEGURKQ-KSSFIOAISA-N	0	3	334.410	3.499	20	30		EGEDHN
C[C@@H](CCNC(=O)c1cc2ccccn2c1)NCc1ccccc1C#N	ZINC001480793973	1392937855	/nfs/dbraw/zinc/93/78/55/1392937855.db2.gz	SCPBIWFKDPYZDR-INIZCTEOSA-N	0	3	346.434	3.109	20	30		EGEDHN
Cc1cc(C(C)(C)C)cc(C)c1CN(C)CCNC(=O)[C@H](C)C#N	ZINC001480851542	1392982819	/nfs/dbraw/zinc/98/28/19/1392982819.db2.gz	YOCWCZWWYXPHRS-MRXNPFEDSA-N	0	3	329.488	3.309	20	30		EGEDHN
CC[C@H](CNC(=O)c1cc(C#N)c[nH]1)N[C@H](C)c1ccc(F)cc1F	ZINC001481801732	1394536706	/nfs/dbraw/zinc/53/67/06/1394536706.db2.gz	WNBXYEYHRIVZTE-BXUZGUMPSA-N	0	3	346.381	3.024	20	30		EGEDHN
CC[C@H](CNC(=O)C1=CCCCCC1)NCc1ccc(C#N)s1	ZINC001481804450	1394538550	/nfs/dbraw/zinc/53/85/50/1394538550.db2.gz	JLOZVDDBPWQWAW-OAHLLOKOSA-N	0	3	331.485	3.495	20	30		EGEDHN
CC[C@@H](CNC(=O)c1cccc(F)c1F)NCc1ccc(C#N)s1	ZINC001481845497	1394556192	/nfs/dbraw/zinc/55/61/92/1394556192.db2.gz	HSHSNZFOLSTZAY-NSHDSACASA-N	0	3	349.406	3.196	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)CC2(C)CC2)CCCC1	ZINC001482225161	1394819578	/nfs/dbraw/zinc/81/95/78/1394819578.db2.gz	LNZZAUDTVNAPAD-UHFFFAOYSA-N	0	3	329.282	3.104	20	30		EGEDHN
C=C(Cl)CNC[C@@H](CC(C)C)NC(=O)c1ccc(N(C)C)cc1	ZINC001482396514	1394958113	/nfs/dbraw/zinc/95/81/13/1394958113.db2.gz	MEDKAKUZAXIAMO-MRXNPFEDSA-N	0	3	337.895	3.239	20	30		EGEDHN
Cc1cc(C(=O)NCC2(NCc3ccc(C#N)s3)CCC2)c(C)o1	ZINC001484624528	1395453600	/nfs/dbraw/zinc/45/36/00/1395453600.db2.gz	WIUHOEFNDOVRKU-UHFFFAOYSA-N	0	3	343.452	3.272	20	30		EGEDHN
Cc1ccsc1C(=O)NC[C@@H](C)N(C)Cc1ccc(C#N)cc1	ZINC001485271872	1395753741	/nfs/dbraw/zinc/75/37/41/1395753741.db2.gz	GOWYWCMLWMKKLM-CQSZACIVSA-N	0	3	327.453	3.179	20	30		EGEDHN
Cc1cc(C)c(C(=O)NC[C@@H](C)N(C)Cc2cccc(C#N)c2)s1	ZINC001485306720	1395784757	/nfs/dbraw/zinc/78/47/57/1395784757.db2.gz	OAVLKXUUVZLANO-CQSZACIVSA-N	0	3	341.480	3.487	20	30		EGEDHN
CCCC[C@H](CNCc1ccc(F)c(C#N)c1)NC(=O)C1CCC1	ZINC001485460276	1395934429	/nfs/dbraw/zinc/93/44/29/1395934429.db2.gz	LNJSGVOKNLVSFQ-QGZVFWFLSA-N	0	3	331.435	3.262	20	30		EGEDHN
C[C@@H](CCNC(=O)c1cccc2c1CCC2)NCc1ccccc1C#N	ZINC001492133738	1396307012	/nfs/dbraw/zinc/30/70/12/1396307012.db2.gz	PZTHLYONJREEGS-INIZCTEOSA-N	0	3	347.462	3.345	20	30		EGEDHN
CCC(CC)C(=O)NC[C@H](NCc1ccc(C#N)cc1F)C(C)C	ZINC001496532321	1396714170	/nfs/dbraw/zinc/71/41/70/1396714170.db2.gz	IUOXDZWABGQAEJ-SFHVURJKSA-N	0	3	333.451	3.364	20	30		EGEDHN
C[C@H](CN(C)Cc1cccc(C#N)c1)NC(=O)c1cccc(F)c1F	ZINC001498369534	1396977362	/nfs/dbraw/zinc/97/73/62/1396977362.db2.gz	NNWHKGAKBGYMDD-CYBMUJFWSA-N	0	3	343.377	3.087	20	30		EGEDHN
C=CCOc1cccnc1C(=O)N[C@@H]1CCCN(CCCCC)C1	ZINC001690049268	1404282141	/nfs/dbraw/zinc/28/21/41/1404282141.db2.gz	JTTCIOOBEIHKSP-MRXNPFEDSA-N	0	3	331.460	3.031	20	30		EGEDHN
CCC1(C(=O)N[C@@H](C)[C@@H]2CCCN(Cc3cccc(C#N)c3)C2)CC1	ZINC001690501234	1404613999	/nfs/dbraw/zinc/61/39/99/1404613999.db2.gz	IGARRYKXGNNAJA-QFBILLFUSA-N	0	3	339.483	3.465	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@H](CCNC(=O)c2ccccc2)C1	ZINC001691869148	1405590654	/nfs/dbraw/zinc/59/06/54/1405590654.db2.gz	AQXYSALOEBWLBR-KRWDZBQOSA-N	0	3	333.435	3.200	20	30		EGEDHN
CC[C@H](CNC(=O)c1cccc(C)c1)NCc1ccc(C#N)s1	ZINC001698591908	1406214947	/nfs/dbraw/zinc/21/49/47/1406214947.db2.gz	UTOKAFOUOSWVRL-OAHLLOKOSA-N	0	3	327.453	3.226	20	30		EGEDHN
C[C@@H](N[C@@H]1CC[C@@H](NC(=O)[C@@H](C)C#N)CC1)c1nc2ccccc2o1	ZINC001732305897	1428521746	/nfs/dbraw/zinc/52/17/46/1428521746.db2.gz	JEQWEUVRBOBFOF-XGUBFFRZSA-N	0	3	340.427	3.065	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@@H]1CC[C@@H](N[C@@H](C)c2c(F)cccc2F)CC1	ZINC001732306072	1428521785	/nfs/dbraw/zinc/52/17/85/1428521785.db2.gz	LGJHXMBJLHQFBC-XJFOESAGSA-N	0	3	335.398	3.202	20	30		EGEDHN
CC(C)C[C@H](CNCc1ccc(C#N)s1)NC(=O)c1ccns1	ZINC001732463741	1428594553	/nfs/dbraw/zinc/59/45/53/1428594553.db2.gz	FUCHYPNRXJGGJY-GFCCVEGCSA-N	0	3	348.497	3.011	20	30		EGEDHN
C[C@H](CNCc1ccc(F)c(C#N)c1)NC(=O)C(C)(C)C1CCC1	ZINC001699372161	1412679510	/nfs/dbraw/zinc/67/95/10/1412679510.db2.gz	CQSFWISDVTVEJS-CYBMUJFWSA-N	0	3	331.435	3.118	20	30		EGEDHN
CCCC[C@H](C)C(=O)NCC1(NCc2ccc(F)c(C#N)c2)CC1	ZINC001699651290	1413033053	/nfs/dbraw/zinc/03/30/53/1413033053.db2.gz	AFCXVHHTVHJYCH-AWEZNQCLSA-N	0	3	331.435	3.262	20	30		EGEDHN
C=C(Cl)CN(CC1CC1)C1CCN(C(=O)C2=COCCC2)CC1	ZINC001699683861	1413079305	/nfs/dbraw/zinc/07/93/05/1413079305.db2.gz	DHGOLTUCSVBQBU-UHFFFAOYSA-N	0	3	338.879	3.136	20	30		EGEDHN
CC(C)(C)C(=O)NC[C@@]1(C)CCCN(Cc2cccc(C#N)c2)C1	ZINC001699877505	1413338503	/nfs/dbraw/zinc/33/85/03/1413338503.db2.gz	ZMTNBTWRHBXVDF-HXUWFJFHSA-N	0	3	327.472	3.323	20	30		EGEDHN
CCC(=O)N1CCC(CCN(C)Cc2cc(C#N)ccc2OC)CC1	ZINC001732545983	1428721734	/nfs/dbraw/zinc/72/17/34/1428721734.db2.gz	UTHDSALIXDSEAC-UHFFFAOYSA-N	0	3	343.471	3.037	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1ccnc2ccccc21)C(C)C	ZINC001732559543	1428748223	/nfs/dbraw/zinc/74/82/23/1428748223.db2.gz	AXIPHYDWJHGTCD-QGZVFWFLSA-N	0	3	331.847	3.331	20	30		EGEDHN
Cc1c(F)cccc1C(=O)NC[C@H](C)N(C)Cc1cccc(C#N)c1	ZINC001700464672	1414068649	/nfs/dbraw/zinc/06/86/49/1414068649.db2.gz	VTXFLPNCEJBHPM-AWEZNQCLSA-N	0	3	339.414	3.256	20	30		EGEDHN
CN(C(=O)c1ccccc1)[C@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001700717462	1414376343	/nfs/dbraw/zinc/37/63/43/1414376343.db2.gz	QYVMIYQFZRATCW-GOSISDBHSA-N	0	3	339.464	3.260	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2ccc(C#N)s2)CN1C(=O)CCCC1CC1	ZINC001700843131	1414492372	/nfs/dbraw/zinc/49/23/72/1414492372.db2.gz	SZTYAFBMCGTJRY-HIFRSBDPSA-N	0	3	331.485	3.279	20	30		EGEDHN
C[C@H](CN(C)[C@H](C)c1ccc(Cl)cc1)NC(=O)c1cc(C#N)c[nH]1	ZINC001733035019	1429158993	/nfs/dbraw/zinc/15/89/93/1429158993.db2.gz	ZONXIUZZIKYHRY-CHWSQXEVSA-N	0	3	344.846	3.351	20	30		EGEDHN
C=C(Cl)Cn1c(C2CCC2)nnc1N1C[C@@H](C)N(CC)C[C@@H]1C	ZINC001705753078	1417133843	/nfs/dbraw/zinc/13/38/43/1417133843.db2.gz	PIOUJBFQDTWXAL-KGLIPLIRSA-N	0	3	337.899	3.217	20	30		EGEDHN
CCCCC(=O)N1C[C@H]2CCN(Cc3cccc(C#N)c3)C[C@H]2C1	ZINC001707210146	1417246287	/nfs/dbraw/zinc/24/62/87/1417246287.db2.gz	BSTOBIUJFYNFJJ-MOPGFXCFSA-N	0	3	325.456	3.029	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1cc(C2CC2)no1	ZINC001707449361	1417353646	/nfs/dbraw/zinc/35/36/46/1417353646.db2.gz	WGXZKGVOQWQRKT-IUODEOHRSA-N	0	3	337.851	3.277	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)C[C@H](C)c2cccc(OC)c2)C1	ZINC001713065638	1417623499	/nfs/dbraw/zinc/62/34/99/1417623499.db2.gz	YEOGJEPYJIUDES-WMZOPIPTSA-N	0	3	330.472	3.346	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@@H](CNC(=O)c2cccs2)C2CC2)c1	ZINC001713102512	1417657760	/nfs/dbraw/zinc/65/77/60/1417657760.db2.gz	BCAKFYJOWPCBRQ-INIZCTEOSA-N	0	3	343.427	3.057	20	30		EGEDHN
Cc1ccccc1C(=O)NC[C@H](NCc1ccc(C#N)s1)C1CC1	ZINC001713104255	1417663442	/nfs/dbraw/zinc/66/34/42/1417663442.db2.gz	ZVJVTHXDUZFLGS-SFHVURJKSA-N	0	3	339.464	3.226	20	30		EGEDHN
CCC1(C(=O)NCC[C@H]2CCN(Cc3ccc(F)c(C#N)c3)C2)CC1	ZINC001713734732	1418527498	/nfs/dbraw/zinc/52/74/98/1418527498.db2.gz	LDJPEOMZPOTZEL-HNNXBMFYSA-N	0	3	343.446	3.216	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](NC(=O)c2cccc(F)c2)C2CC2)s1	ZINC001733165109	1429268074	/nfs/dbraw/zinc/26/80/74/1429268074.db2.gz	YYNHOQYIWFLRFW-QGZVFWFLSA-N	0	3	343.427	3.057	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)[C@H]2CCOc3ccccc32)CCCC1	ZINC001714145638	1418949810	/nfs/dbraw/zinc/94/98/10/1418949810.db2.gz	ZYLVTFSKCUUWLO-INIZCTEOSA-N	0	3	348.874	3.324	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2cncc(C)c2)CCCC[C@H]1C	ZINC001714180550	1418988986	/nfs/dbraw/zinc/98/89/86/1418988986.db2.gz	QCPCWCRHLFOOTR-KDOFPFPSSA-N	0	3	335.879	3.411	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2cc(F)c[nH]2)CCCC[C@H]1C	ZINC001714189024	1418995865	/nfs/dbraw/zinc/99/58/65/1418995865.db2.gz	POQRFNLBEBWXOO-BZNIZROVSA-N	0	3	327.831	3.175	20	30		EGEDHN
C[C@@H](CCNC(=O)C#CC(C)(C)C)NCc1nsc2ccccc21	ZINC001714468801	1419195988	/nfs/dbraw/zinc/19/59/88/1419195988.db2.gz	AMGGMWBENDAAEJ-AWEZNQCLSA-N	0	3	343.496	3.330	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)Cc2ccc(F)cc2F)CCCC1	ZINC001714493560	1419217150	/nfs/dbraw/zinc/21/71/50/1419217150.db2.gz	XOQWAQHOJYXGPA-UHFFFAOYSA-N	0	3	342.817	3.278	20	30		EGEDHN
Cc1cscc1C(=O)N(C)[C@@H](C)CNCc1ccc(F)c(C#N)c1	ZINC001714573924	1419308611	/nfs/dbraw/zinc/30/86/11/1419308611.db2.gz	AJVHRPKWXXKRCQ-ZDUSSCGKSA-N	0	3	345.443	3.318	20	30		EGEDHN
CCC1(C(=O)NCC[C@@H]2CCN(Cc3ccccc3C#N)C2)CCC1	ZINC001714873425	1419606359	/nfs/dbraw/zinc/60/63/59/1419606359.db2.gz	DZZPTBNMYLGXSQ-QGZVFWFLSA-N	0	3	339.483	3.467	20	30		EGEDHN
CCC1(C(=O)N[C@H](CNCc2ccc(C#N)s2)CC(C)C)CC1	ZINC001714925548	1419679192	/nfs/dbraw/zinc/67/91/92/1419679192.db2.gz	MPWHBGBPWJVYCZ-AWEZNQCLSA-N	0	3	333.501	3.430	20	30		EGEDHN
C[C@H](C#N)C(=O)NCC1CN([C@H](C)c2ccc(C(C)(C)C)cc2)C1	ZINC001714962255	1419701329	/nfs/dbraw/zinc/70/13/29/1419701329.db2.gz	XTZYVVKBVPRWLR-HUUCEWRRSA-N	0	3	327.472	3.253	20	30		EGEDHN
CCCC1(C(=O)N2CC[C@@H](NCc3ccccc3C#N)[C@@H](C)C2)CC1	ZINC001715064222	1419801879	/nfs/dbraw/zinc/80/18/79/1419801879.db2.gz	XBWMFENYJIJDSI-QFBILLFUSA-N	0	3	339.483	3.465	20	30		EGEDHN
N#Cc1ccc(F)c(CNCC2(NC(=O)C3=CCCC3)CCCC2)c1	ZINC001715092746	1419833267	/nfs/dbraw/zinc/83/32/67/1419833267.db2.gz	WVCVQYIKAGOPME-UHFFFAOYSA-N	0	3	341.430	3.326	20	30		EGEDHN
CCCC1(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)s2)CC1	ZINC001715212439	1419944727	/nfs/dbraw/zinc/94/47/27/1419944727.db2.gz	MMDOYKBZQMIJEK-CQSZACIVSA-N	0	3	331.485	3.281	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)CC3CC3)CCCC2)c(F)c1	ZINC001715294263	1420001607	/nfs/dbraw/zinc/00/16/07/1420001607.db2.gz	MIMIGCJJPJIUOT-UHFFFAOYSA-N	0	3	329.419	3.016	20	30		EGEDHN
C=C(Br)CNC[C@@H]1[C@H](C)CCCN1C(=O)CCC1CC1	ZINC001715350517	1420051556	/nfs/dbraw/zinc/05/15/56/1420051556.db2.gz	BJEJNSKVRPYBKR-IUODEOHRSA-N	0	3	343.309	3.302	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)CCCF)[C@H]1CNCc1ccc(C#N)cc1F	ZINC001715475168	1420154340	/nfs/dbraw/zinc/15/43/40/1420154340.db2.gz	OEGAOMIUQMZKBR-KDOFPFPSSA-N	0	3	349.425	3.164	20	30		EGEDHN
C=C(Br)CN[C@@H](CNC(=O)c1cccc(C)c1)C(C)C	ZINC001715518076	1420204184	/nfs/dbraw/zinc/20/41/84/1420204184.db2.gz	VFIJGUMUYDMLGU-HNNXBMFYSA-N	0	3	339.277	3.248	20	30		EGEDHN
C=C(Br)CN[C@H](CNC(=O)C(C1CC1)C1CC1)C(C)C	ZINC001715689679	1420296016	/nfs/dbraw/zinc/29/60/16/1420296016.db2.gz	FRGDCGAEAVBJNM-CQSZACIVSA-N	0	3	343.309	3.062	20	30		EGEDHN
C=C(Br)CN[C@@H](CNC(=O)C(C)(CC)CC)C(C)C	ZINC001715731541	1420316076	/nfs/dbraw/zinc/31/60/76/1420316076.db2.gz	UONOSIABMRZZNX-ZDUSSCGKSA-N	0	3	333.314	3.452	20	30		EGEDHN
CCC[C@@H](C(=O)NCC1(NCc2ccc(C#N)cc2)CC1)C(C)C	ZINC001733258809	1429411526	/nfs/dbraw/zinc/41/15/26/1429411526.db2.gz	KNNGBGJVVAIXPI-GOSISDBHSA-N	0	3	327.472	3.369	20	30		EGEDHN
C[C@@H](CNCc1ccc(F)c(C#N)c1)NC(=O)[C@@H]1CC[C@@H](C)CC1	ZINC001716001163	1420454466	/nfs/dbraw/zinc/45/44/66/1420454466.db2.gz	NVGJVRXHYLPWMD-DZKIICNBSA-N	0	3	331.435	3.118	20	30		EGEDHN
Cc1cc(F)ccc1C(=O)NCC1(NCc2cccc(C#N)c2)CC1	ZINC001733262663	1429417954	/nfs/dbraw/zinc/41/79/54/1429417954.db2.gz	XVLNAWXOOYPFRJ-UHFFFAOYSA-N	0	3	337.398	3.058	20	30		EGEDHN
CC(C)CCC(=O)N[C@H]1CCC[C@@H]1CNCc1ccccc1C#N	ZINC001716054854	1420518895	/nfs/dbraw/zinc/51/88/95/1420518895.db2.gz	NHHGQFGKJQDMHW-MOPGFXCFSA-N	0	3	327.472	3.369	20	30		EGEDHN
CC[C@@H](C)CC(=O)NCC1(NCc2ccc(F)c(C#N)c2)CCC1	ZINC001717151287	1421141785	/nfs/dbraw/zinc/14/17/85/1421141785.db2.gz	ZJFPFQHZILLZAF-CQSZACIVSA-N	0	3	331.435	3.262	20	30		EGEDHN
CCCCC(=O)N1CCC[C@H]1CN(C)Cc1ccc(OC)c(C#N)c1	ZINC001717363349	1421297927	/nfs/dbraw/zinc/29/79/27/1421297927.db2.gz	HPWSBLKPLIJLEE-SFHVURJKSA-N	0	3	343.471	3.180	20	30		EGEDHN
C=C(Br)CNCC(C)(C)CN(C)C(=O)C1CC(C)(C)C1	ZINC001717452688	1421382691	/nfs/dbraw/zinc/38/26/91/1421382691.db2.gz	NXMHHYYIPREMPE-UHFFFAOYSA-N	0	3	345.325	3.405	20	30		EGEDHN
CCC1(C(=O)NC[C@H](C)N(C)Cc2ccc(OCC#N)cc2)CCC1	ZINC001717483873	1421419178	/nfs/dbraw/zinc/41/91/78/1421419178.db2.gz	QQCXTWHTQYDFOF-INIZCTEOSA-N	0	3	343.471	3.106	20	30		EGEDHN
CC[C@H](C)CC(=O)N1CC2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001717628444	1421536865	/nfs/dbraw/zinc/53/68/65/1421536865.db2.gz	VVRPLEBFWAOSHD-KRWDZBQOSA-N	0	3	339.483	3.419	20	30		EGEDHN
C=C(Br)CNC[C@H](NC(=O)C(C)(C)C1CC1)C(C)(C)C	ZINC001717965233	1421736958	/nfs/dbraw/zinc/73/69/58/1421736958.db2.gz	LOARLTOLQDVLLD-ZDUSSCGKSA-N	0	3	345.325	3.452	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC[C@@H]1CNCc1cc(C)ns1	ZINC001733342038	1429524763	/nfs/dbraw/zinc/52/47/63/1429524763.db2.gz	YFRSOCFJVJCASK-MRXNPFEDSA-N	0	3	333.501	3.301	20	30		EGEDHN
Cc1cccc(C(=O)N[C@@H](C)CN(C)Cc2ccc(C#N)cc2)c1C	ZINC001722912982	1424242994	/nfs/dbraw/zinc/24/29/94/1424242994.db2.gz	GCUASTQJZRQFMH-INIZCTEOSA-N	0	3	335.451	3.425	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](NC(=O)c2ccsc2)C2CC2)c(F)c1	ZINC001723274857	1424328027	/nfs/dbraw/zinc/32/80/27/1424328027.db2.gz	XKRHHGPSLDQRSU-QGZVFWFLSA-N	0	3	343.427	3.057	20	30		EGEDHN
CC(C)c1cccc(C(=O)NCC2(NCc3cccc(C#N)c3)CC2)n1	ZINC001723531635	1424454594	/nfs/dbraw/zinc/45/45/94/1424454594.db2.gz	KOPHMHNZIQLWEQ-UHFFFAOYSA-N	0	3	348.450	3.129	20	30		EGEDHN
CCC(C)(CC)C(=O)NCC1(NCc2ccc(OC)c(C#N)c2)CC1	ZINC001723594465	1424480755	/nfs/dbraw/zinc/48/07/55/1424480755.db2.gz	BYQWCASTYDQYHB-UHFFFAOYSA-N	0	3	343.471	3.132	20	30		EGEDHN
C#CCCCC(=O)NCC[C@H](C)NCc1nc2cc(C)ccc2s1	ZINC001725000366	1425409739	/nfs/dbraw/zinc/40/97/39/1425409739.db2.gz	YGVDTEVUQSIMQW-HNNXBMFYSA-N	0	3	343.496	3.393	20	30		EGEDHN
C[C@H](CNC(=O)C1CCCCCC1)N(C)Cc1ccc(C#N)cc1	ZINC001725157242	1425648951	/nfs/dbraw/zinc/64/89/51/1425648951.db2.gz	SCHLMIIUYKFWLF-MRXNPFEDSA-N	0	3	327.472	3.465	20	30		EGEDHN
Cc1sccc1CC(=O)NC[C@H](C)N(C)Cc1cccc(C#N)c1	ZINC001725190037	1425732085	/nfs/dbraw/zinc/73/20/85/1425732085.db2.gz	MEXQRHXCRNRVDO-AWEZNQCLSA-N	0	3	341.480	3.107	20	30		EGEDHN
C[C@H](CNC(=O)C(C)(C)C(F)(F)F)N(C)Cc1ccc(C#N)cc1	ZINC001725190297	1425732954	/nfs/dbraw/zinc/73/29/54/1425732954.db2.gz	PFSWKIPIBWZUOD-GFCCVEGCSA-N	0	3	341.377	3.083	20	30		EGEDHN
CCCC(C)(C)C(=O)N(C)C[C@@H](C)NCc1ccc(F)c(C#N)c1	ZINC001725503039	1426183756	/nfs/dbraw/zinc/18/37/56/1426183756.db2.gz	MNLOQFAQHPJOLR-CQSZACIVSA-N	0	3	333.451	3.460	20	30		EGEDHN
C[C@@H](C(=O)N(C)C[C@H](C)NCc1ccc(C#N)s1)c1ccccc1	ZINC001725519987	1426211222	/nfs/dbraw/zinc/21/12/22/1426211222.db2.gz	XBGFOOUKZRKXKR-LSDHHAIUSA-N	0	3	341.480	3.360	20	30		EGEDHN
C[C@@H](CN(C)C(=O)[C@@H](C)c1ccccc1)NCc1ccc(C#N)s1	ZINC001725519981	1426211279	/nfs/dbraw/zinc/21/12/79/1426211279.db2.gz	XBGFOOUKZRKXKR-GJZGRUSLSA-N	0	3	341.480	3.360	20	30		EGEDHN
C=C(Cl)CNC[C@H](NC(=O)CCc1cncc(C)c1)C(C)(C)C	ZINC001725742255	1426418631	/nfs/dbraw/zinc/41/86/31/1426418631.db2.gz	BWENISSMZQHBNL-INIZCTEOSA-N	0	3	337.895	3.196	20	30		EGEDHN
CC1(C(=O)NC[C@@H](NCc2ccc(C#N)cc2F)C2CC2)CCCC1	ZINC001731401646	1427362026	/nfs/dbraw/zinc/36/20/26/1427362026.db2.gz	HGUMOLYYQQDIDG-GOSISDBHSA-N	0	3	343.446	3.262	20	30		EGEDHN
C[C@@H](CNC(=O)C(C)(C)C1CCC1)NCc1ccc(F)c(C#N)c1	ZINC001731607233	1427652463	/nfs/dbraw/zinc/65/24/63/1427652463.db2.gz	DBMPMZHACMQGHI-ZDUSSCGKSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)Cc1c[nH]c2cccc(C)c12	ZINC001731740064	1427827117	/nfs/dbraw/zinc/82/71/17/1427827117.db2.gz	UIDWUCKGUARLAN-CQSZACIVSA-N	0	3	333.863	3.256	20	30		EGEDHN
CCc1ccsc1C(=O)NC[C@H](C)N(C)Cc1ccc(C#N)cc1	ZINC001734067052	1437861909	/nfs/dbraw/zinc/86/19/09/1437861909.db2.gz	ZLGISUOOBKJKCC-AWEZNQCLSA-N	0	3	341.480	3.432	20	30		EGEDHN
CN(CCCNC(=O)C[C@@H]1CC[C@H]2C[C@H]21)Cc1ccc(C#N)c(F)c1	ZINC001752004832	1440131972	/nfs/dbraw/zinc/13/19/72/1440131972.db2.gz	RLHMTUNNBYZHCZ-XYJFISCASA-N	0	3	343.446	3.072	20	30		EGEDHN
CN(CCCNC(=O)C(C)(C)C1CCC1)Cc1ccc(C#N)c(F)c1	ZINC001752035888	1440134263	/nfs/dbraw/zinc/13/42/63/1440134263.db2.gz	MJUPCWDMNVTPBT-UHFFFAOYSA-N	0	3	345.462	3.462	20	30		EGEDHN
CC#CCN(C)CCCNC(=O)[C@@H]1C[C@H]1c1cccc2ccccc21	ZINC001752083985	1440139054	/nfs/dbraw/zinc/13/90/54/1440139054.db2.gz	VWJKJVMBXBPSAH-LEWJYISDSA-N	0	3	334.463	3.405	20	30		EGEDHN
C=C(Br)CN[C@H](C)[C@@H]1CCCCN1C(=O)C=C1CCC1	ZINC001752138725	1440144315	/nfs/dbraw/zinc/14/43/15/1440144315.db2.gz	DZSZJLVCJAQZLC-HIFRSBDPSA-N	0	3	341.293	3.365	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1c(C)nsc1C	ZINC001752156803	1440147275	/nfs/dbraw/zinc/14/72/75/1440147275.db2.gz	MESNISOTYZLBLW-FZMZJTMJSA-N	0	3	341.908	3.485	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1cnn(C(F)F)c1	ZINC001752156870	1440147327	/nfs/dbraw/zinc/14/73/27/1440147327.db2.gz	IDSUETMQNOEANF-AAEUAGOBSA-N	0	3	346.809	3.004	20	30		EGEDHN
C=CCCCC(=O)N1CCCC[C@H]1[C@@H](C)NCc1cccc(OC)n1	ZINC001752157830	1440147736	/nfs/dbraw/zinc/14/77/36/1440147736.db2.gz	LOJPZHACISDLGY-AEFFLSMTSA-N	0	3	345.487	3.306	20	30		EGEDHN
C=CCC[C@@H](C)N1CC[C@H](NC(=O)c2ccc(P(C)(C)=O)cc2)C1	ZINC001752411637	1440174424	/nfs/dbraw/zinc/17/44/24/1440174424.db2.gz	SKTKPCAPYVIRIC-WBVHZDCISA-N	0	3	348.427	3.093	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@H]1CC12CCN(Cc1cccc(F)c1)CC2	ZINC001752419377	1440175474	/nfs/dbraw/zinc/17/54/74/1440175474.db2.gz	GPRIAFFHJBWJMO-SFHVURJKSA-N	0	3	342.458	3.346	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CC12CCN(Cc1c(C)noc1CC)CC2	ZINC001752427432	1440177470	/nfs/dbraw/zinc/17/74/70/1440177470.db2.gz	OVMYNDOEHFMEFO-GOSISDBHSA-N	0	3	345.487	3.372	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1CC12CCN(Cc1ccccn1)CC2	ZINC001752428532	1440177783	/nfs/dbraw/zinc/17/77/83/1440177783.db2.gz	ZXAVOMOBGJJKHF-KRWDZBQOSA-N	0	3	327.472	3.155	20	30		EGEDHN
C=C(C)CN1CCC(N(CCC)C(=O)C[C@H](C)n2ccc(C)n2)CC1	ZINC001752440570	1440181392	/nfs/dbraw/zinc/18/13/92/1440181392.db2.gz	ZSVSBJIXHYINDV-SFHVURJKSA-N	0	3	346.519	3.422	20	30		EGEDHN
C[C@H](C(=O)NC[C@@H](NCc1ccc(C#N)cc1F)C1CC1)C(C)(C)C	ZINC001752468565	1440184114	/nfs/dbraw/zinc/18/41/14/1440184114.db2.gz	JPAVRGUAVFVOKH-FZKQIMNGSA-N	0	3	345.462	3.364	20	30		EGEDHN
CC1(C(=O)NC[C@@H](NCC#Cc2ccc(F)cc2)C2CC2)CCCC1	ZINC001752473825	1440184863	/nfs/dbraw/zinc/18/48/63/1440184863.db2.gz	UHDWEYCEVOBSTI-LJQANCHMSA-N	0	3	342.458	3.242	20	30		EGEDHN
C=C/C(C)=C\CC(=O)NC[C@@H](NCc1ccc(C#N)cc1F)C1CC1	ZINC001752478963	1440185148	/nfs/dbraw/zinc/18/51/48/1440185148.db2.gz	CTARTDMCLSYLJR-LJNMVULZSA-N	0	3	341.430	3.204	20	30		EGEDHN
CCC1(C(=O)NC[C@@H](NCC#Cc2cccc(Cl)c2)C2CC2)CC1	ZINC001752482830	1440185877	/nfs/dbraw/zinc/18/58/77/1440185877.db2.gz	SOYUOLZEIHLAOP-GOSISDBHSA-N	0	3	344.886	3.366	20	30		EGEDHN
N#Cc1ccc(CN[C@H](CNC(=O)[C@@]23C[C@@H]2CCCC3)C2CC2)s1	ZINC001752482825	1440185917	/nfs/dbraw/zinc/18/59/17/1440185917.db2.gz	SLSCSUYYWIRIDB-YJLNNSPDSA-N	0	3	343.496	3.184	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@H](CN(C)Cc2ocnc2C)C1	ZINC001752508426	1440189886	/nfs/dbraw/zinc/18/98/86/1440189886.db2.gz	SZSAWKHDKUPZLY-MRXNPFEDSA-N	0	3	333.476	3.256	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)OCCC(C)C	ZINC001752566711	1440195482	/nfs/dbraw/zinc/19/54/82/1440195482.db2.gz	IJAKFKRFKGBCID-HCXYKTFWSA-N	0	3	336.520	3.468	20	30		EGEDHN
CC(C)[C@H]1C[C@H]1C(=O)N[C@H]1C[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001752673542	1440199088	/nfs/dbraw/zinc/19/90/88/1440199088.db2.gz	GAOXFJHGRGHQKF-BRSBDYLESA-N	0	3	344.886	3.220	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@@H]2CN(Cc3ccccn3)CC[C@@H]21	ZINC001752704254	1440202195	/nfs/dbraw/zinc/20/21/95/1440202195.db2.gz	CPCPZZKMPJWOHP-MJGOQNOKSA-N	0	3	341.499	3.497	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](C)[C@H]1CCCN(Cc2ccccn2)C1	ZINC001752842489	1440231390	/nfs/dbraw/zinc/23/13/90/1440231390.db2.gz	XJCPNUNLHAMMSL-IRXDYDNUSA-N	0	3	329.488	3.401	20	30		EGEDHN
Cc1cc(C(=O)NC[C@H](C)NCc2ccc(C#N)c(F)c2)sc1C	ZINC001752917992	1440247726	/nfs/dbraw/zinc/24/77/26/1440247726.db2.gz	CJTWQVWOGCFZNH-LBPRGKRZSA-N	0	3	345.443	3.284	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@H](CNCc2ccn(C(C)C)n2)C1	ZINC001752949859	1440252025	/nfs/dbraw/zinc/25/20/25/1440252025.db2.gz	OZQQTNXALKFBAM-DLBZAZTESA-N	0	3	332.492	3.004	20	30		EGEDHN
C=C(Cl)CNCCc1ccc(CNC(=O)c2cc[nH]c2C)cc1	ZINC001752982835	1440257411	/nfs/dbraw/zinc/25/74/11/1440257411.db2.gz	RRBMGBBCJUZTJY-UHFFFAOYSA-N	0	3	331.847	3.138	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)CCC(C)(F)F)C1	ZINC001752993722	1440260835	/nfs/dbraw/zinc/26/08/35/1440260835.db2.gz	MIYZFMZCBBIKJI-KRWDZBQOSA-N	0	3	349.425	3.416	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1CCCNC(=O)c1cc(C)n(C)c1C	ZINC001753037510	1440275062	/nfs/dbraw/zinc/27/50/62/1440275062.db2.gz	HLIKNLRLYNZPHC-INIZCTEOSA-N	0	3	337.895	3.369	20	30		EGEDHN
CC#CCN(CCC)CCNC(=O)c1cnc(CC(C)(C)C)s1	ZINC001753148808	1440326250	/nfs/dbraw/zinc/32/62/50/1440326250.db2.gz	NRSNYYLJKPTSDJ-UHFFFAOYSA-N	0	3	335.517	3.197	20	30		EGEDHN
Cc1cocc1C(=O)NCCCN(Cc1ccccc1C#N)C(C)C	ZINC001753289982	1440349833	/nfs/dbraw/zinc/34/98/33/1440349833.db2.gz	DUEUOUOJYUAWGC-UHFFFAOYSA-N	0	3	339.439	3.490	20	30		EGEDHN
C=CCN[C@H](CNC(=O)C[C@@H]1CCCO1)c1ccc(C(C)C)cc1	ZINC001753294776	1440351728	/nfs/dbraw/zinc/35/17/28/1440351728.db2.gz	UYMLRPIJTNLXTO-RBUKOAKNSA-N	0	3	330.472	3.312	20	30		EGEDHN
C#CCCN[C@H](CNC(=O)C[C@@H]1CCC(C)(C)CO1)c1ccccc1	ZINC001753300573	1440353882	/nfs/dbraw/zinc/35/38/82/1440353882.db2.gz	WJXJBEJTQZTDDB-RBUKOAKNSA-N	0	3	342.483	3.052	20	30		EGEDHN
C#CCCN[C@@H](CNC(=O)c1coc(C(F)F)c1)c1ccccc1	ZINC001753301289	1440354059	/nfs/dbraw/zinc/35/40/59/1440354059.db2.gz	FDTMMTSFLUZDJI-HNNXBMFYSA-N	0	3	332.350	3.301	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@H]2CC[C@@H](C1)N2CCc1ccc(C)cc1	ZINC001753305594	1440355316	/nfs/dbraw/zinc/35/53/16/1440355316.db2.gz	URTRHRCMIDVSNP-OYRHEFFESA-N	0	3	338.495	3.406	20	30		EGEDHN
C#CCCN[C@@H](CNC(=O)c1ccc2c(c1)C[C@@H](C)O2)c1ccccc1	ZINC001753309022	1440356081	/nfs/dbraw/zinc/35/60/81/1440356081.db2.gz	AUQANVWPZGXOGY-UZLBHIALSA-N	0	3	348.446	3.094	20	30		EGEDHN
C=C(C)CN[C@H](CNC(=O)c1ncoc1C(C)C)c1ccccc1	ZINC001753312523	1440357090	/nfs/dbraw/zinc/35/70/90/1440357090.db2.gz	SVOQRCBNSMTMJY-MRXNPFEDSA-N	0	3	327.428	3.435	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CCC)C(=O)[C@@H](CC(C)C)n2ccnc2)C1	ZINC001753317759	1440360807	/nfs/dbraw/zinc/36/08/07/1440360807.db2.gz	VLWFJCPLZHVIHO-RTBURBONSA-N	0	3	346.519	3.359	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CCC)C(=O)c2ncn3ccc(C)cc23)C1	ZINC001753317653	1440360841	/nfs/dbraw/zinc/36/08/41/1440360841.db2.gz	SLKFYVOCOXNIMR-QGZVFWFLSA-N	0	3	340.471	3.145	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CCC)C(=O)c2ccc(C(C)C)nc2)C1	ZINC001753317948	1440360848	/nfs/dbraw/zinc/36/08/48/1440360848.db2.gz	ZAWAFCRQLPPAQV-GOSISDBHSA-N	0	3	327.472	3.155	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CCC)C(=O)C[C@H]2CCC(C)(C)CO2)C1	ZINC001753318193	1440361083	/nfs/dbraw/zinc/36/10/83/1440361083.db2.gz	FHSGDOYNLAIYFS-QZTJIDSGSA-N	0	3	336.520	3.471	20	30		EGEDHN
CC/C=C(/C)C(=O)NCC[C@@H]1CCN(Cc2ccc(C#N)s2)C1	ZINC001753321083	1440363498	/nfs/dbraw/zinc/36/34/98/1440363498.db2.gz	BNCZWDKPXMXHEO-PSGIOISBSA-N	0	3	331.485	3.304	20	30		EGEDHN
CCC(CC)C(=O)NCC[C@@H]1CCN(Cc2ccc(C#N)s2)C1	ZINC001753322793	1440364603	/nfs/dbraw/zinc/36/46/03/1440364603.db2.gz	QXQHVSUBWUZSAT-CQSZACIVSA-N	0	3	333.501	3.384	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@H](CN(C)[C@H](C)c2ccc(F)cc2F)C1	ZINC001753349541	1440377169	/nfs/dbraw/zinc/37/71/69/1440377169.db2.gz	RBWLJQSTHGSEJT-HZPDHXFCSA-N	0	3	348.437	3.466	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H]2C[C@H]1CN2C(=O)C(C)(C)C1CCOCC1	ZINC001753423759	1440396057	/nfs/dbraw/zinc/39/60/57/1440396057.db2.gz	XSLZZLXHZSZYHS-NJAFHUGGSA-N	0	3	334.504	3.079	20	30		EGEDHN
CCCCCCCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H]1Cc2cccnc2C1	ZINC001753426899	1440397223	/nfs/dbraw/zinc/39/72/23/1440397223.db2.gz	UYMKRFXFSICIDU-FHWLQOOXSA-N	0	3	341.499	3.052	20	30		EGEDHN
C=C[C@@](C)(O)CC(=O)N(C)[C@@H]1CCN(Cc2ccc(C(C)C)cc2)C1	ZINC001753434173	1440399382	/nfs/dbraw/zinc/39/93/82/1440399382.db2.gz	AZMBATBDGXILPI-TZIWHRDSSA-N	0	3	344.499	3.170	20	30		EGEDHN
CCN(C(=O)[C@H](C)C#N)[C@H]1CCN(CCCc2ccccc2Cl)C1	ZINC001753453819	1440407109	/nfs/dbraw/zinc/40/71/09/1440407109.db2.gz	XWNHLBKRULESBS-WBVHZDCISA-N	0	3	347.890	3.355	20	30		EGEDHN
C[C@H](C(=O)NC1(CNCC#Cc2ccccc2)CCCC1)C(C)(F)F	ZINC001753507945	1440425003	/nfs/dbraw/zinc/42/50/03/1440425003.db2.gz	PUYIULWKNWAGSB-MRXNPFEDSA-N	0	3	348.437	3.348	20	30		EGEDHN
C=C(Br)CNC[C@](C)(NC(=O)c1ccsc1)C1CC1	ZINC001753513202	1440426595	/nfs/dbraw/zinc/42/65/95/1440426595.db2.gz	KJZPBEWLJHLWRW-AWEZNQCLSA-N	0	3	343.290	3.145	20	30		EGEDHN
C=C(C)CCC(=O)N[C@]1(CNCc2conc2C)CCCC[C@@H]1C	ZINC001753534073	1440431863	/nfs/dbraw/zinc/43/18/63/1440431863.db2.gz	PFUNSHZNTLZERK-KXBFYZLASA-N	0	3	333.476	3.494	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCCN(C(=O)C2(C(C)(F)F)CC2)C1	ZINC001753556582	1440436179	/nfs/dbraw/zinc/43/61/79/1440436179.db2.gz	STALFVJBKSCBHV-CYBMUJFWSA-N	0	3	334.838	3.393	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCC1CCN([C@@H](C)c2cnccn2)CC1	ZINC001753597314	1440445122	/nfs/dbraw/zinc/44/51/22/1440445122.db2.gz	TVGVJQRFBGAMLG-OXJNMPFZSA-N	0	3	344.503	3.358	20	30		EGEDHN
O=C(NCc1ccc(CNCC#Cc2ccccc2)cc1)C1CC=CC1	ZINC001753598080	1440445393	/nfs/dbraw/zinc/44/53/93/1440445393.db2.gz	NNSCNNRUMFTZAX-UHFFFAOYSA-N	0	3	344.458	3.410	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H](C)CNCc2ccncc2Cl)CC1	ZINC001753631357	1440452202	/nfs/dbraw/zinc/45/22/02/1440452202.db2.gz	XAUXNMAXETVMTP-CQSZACIVSA-N	0	3	335.879	3.323	20	30		EGEDHN
CCC[C@H](C)CC(=O)N(C)[C@H](C)CNCc1ccc(F)c(C#N)c1	ZINC001753682503	1440464841	/nfs/dbraw/zinc/46/48/41/1440464841.db2.gz	RGGNRZUROOFLOI-LSDHHAIUSA-N	0	3	333.451	3.460	20	30		EGEDHN
Cc1cocc1C(=O)N(C)[C@H](C)CNCC#Cc1ccc(Cl)cc1	ZINC001753707500	1440469887	/nfs/dbraw/zinc/46/98/87/1440469887.db2.gz	YBAXRRUHCDMDRY-OAHLLOKOSA-N	0	3	344.842	3.343	20	30		EGEDHN
C=CCC1(C(=O)N(C)[C@@H](C)CNCc2cc(CO)ccc2F)CCC1	ZINC001753710381	1440470446	/nfs/dbraw/zinc/47/04/46/1440470446.db2.gz	CVPCIVMHDIGYEH-HNNXBMFYSA-N	0	3	348.462	3.001	20	30		EGEDHN
C=CC[C@H](C(=O)N(C)[C@H](C)CNCc1ccccn1)c1ccccc1	ZINC001753729184	1440475191	/nfs/dbraw/zinc/47/51/91/1440475191.db2.gz	HWNKNPSSHXMFEA-XLIONFOSSA-N	0	3	337.467	3.378	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H](CNCc1cnn(C(C)(C)C)c1)CC(C)C	ZINC001753738308	1440478273	/nfs/dbraw/zinc/47/82/73/1440478273.db2.gz	GLEUFVOXNAOMQN-KRWDZBQOSA-N	0	3	348.535	3.471	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](CN[C@H](C)c2n[nH]c(C)n2)CC(C)C)CC1	ZINC001753742356	1440479639	/nfs/dbraw/zinc/47/96/39/1440479639.db2.gz	QQRLJTMHDAUQKJ-PBHICJAKSA-N	0	3	347.507	3.041	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@H](C)[C@@H]1CNCc1ccc(OC)nc1	ZINC001753808213	1440492198	/nfs/dbraw/zinc/49/21/98/1440492198.db2.gz	CGGYOGHMGWWUOO-WMZOPIPTSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)[C@H](C)Cc1ccccc1F)C(C)C	ZINC001753837594	1440501543	/nfs/dbraw/zinc/50/15/43/1440501543.db2.gz	GRSYXPGLWGBFJQ-DYVFJYSZSA-N	0	3	340.870	3.487	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)[C@@H]1CCOc2ccccc21)C(C)C	ZINC001753839875	1440502281	/nfs/dbraw/zinc/50/22/81/1440502281.db2.gz	RHLWFBOHQRDYOM-HZPDHXFCSA-N	0	3	336.863	3.036	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)[C@H](F)Cc1ccccc1)C(C)C	ZINC001753846086	1440504517	/nfs/dbraw/zinc/50/45/17/1440504517.db2.gz	YTIUCRIBULQCBG-HZPDHXFCSA-N	0	3	326.843	3.050	20	30		EGEDHN
CN(CCN(C)C(=O)CC1CCCC1)Cc1ccc(OCC#N)cc1	ZINC001753847859	1440505469	/nfs/dbraw/zinc/50/54/69/1440505469.db2.gz	JRDLUIZJOCLSJU-UHFFFAOYSA-N	0	3	343.471	3.059	20	30		EGEDHN
CCCCCCCCC(=O)N1CC[C@@H]2[C@H](CCN2CC#CCOC)C1	ZINC001753875829	1440519325	/nfs/dbraw/zinc/51/93/25/1440519325.db2.gz	NMTDTJKFQHPYMA-WOJBJXKFSA-N	0	3	348.531	3.310	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CCC[C@H]1CNCc1nc2ccc(F)cc2o1	ZINC001753882608	1440520628	/nfs/dbraw/zinc/52/06/28/1440520628.db2.gz	MESKWDQGSNZRBV-ZFWWWQNUSA-N	0	3	345.418	3.308	20	30		EGEDHN
C=CCCC(=O)NC/C=C/CNCc1ccc(Br)cc1	ZINC001754102063	1440541321	/nfs/dbraw/zinc/54/13/21/1440541321.db2.gz	YPWBSKDLFNLMFW-SNAWJCMRSA-N	0	3	337.261	3.177	20	30		EGEDHN
C=CCC1(C(=O)NC/C=C\CNCc2ccc(F)c(F)c2)CCC1	ZINC001754166656	1440546452	/nfs/dbraw/zinc/54/64/52/1440546452.db2.gz	QELXUFKCSWYHBM-ARJAWSKDSA-N	0	3	334.410	3.473	20	30		EGEDHN
CCOc1cccc(C(=O)NC/C=C\CNCc2ccc(C#N)cc2)c1	ZINC001754175934	1440547564	/nfs/dbraw/zinc/54/75/64/1440547564.db2.gz	VNDMNBBWTDVVAV-ARJAWSKDSA-N	0	3	349.434	3.033	20	30		EGEDHN
CC(C)[C@]1(C)C[C@@H]1C(=O)NC/C=C\CNCc1cccc(C#N)c1	ZINC001754190180	1440548934	/nfs/dbraw/zinc/54/89/34/1440548934.db2.gz	BOEZAJBMQZVCKG-BBCKOWNQSA-N	0	3	325.456	3.002	20	30		EGEDHN
N#Cc1ccc(CNC/C=C\CNC(=O)c2ccc3c(c2)CCC3)cc1	ZINC001754203173	1440550470	/nfs/dbraw/zinc/55/04/70/1440550470.db2.gz	DPSNLSMKQQGNME-UPHRSURJSA-N	0	3	345.446	3.123	20	30		EGEDHN
Cc1cccc(C(=O)N[C@H](C)CNCC#Cc2cccc(Cl)c2)c1	ZINC001754216589	1440551984	/nfs/dbraw/zinc/55/19/84/1440551984.db2.gz	PQNVGWDJBIYMKG-MRXNPFEDSA-N	0	3	340.854	3.408	20	30		EGEDHN
CC1=CC[C@](C)(C(=O)N[C@H](C)CNCc2ccc(C#N)s2)CC1	ZINC001754254851	1440558852	/nfs/dbraw/zinc/55/88/52/1440558852.db2.gz	QHKOXOIMUMRDHV-KDOFPFPSSA-N	0	3	331.485	3.351	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H](C)CNCC#Cc2ccc(Cl)cc2)c(C)o1	ZINC001754263867	1440560394	/nfs/dbraw/zinc/56/03/94/1440560394.db2.gz	YUQFDOQCDHCWJY-ZDUSSCGKSA-N	0	3	344.842	3.309	20	30		EGEDHN
CCCC[C@](C)(F)C(=O)N[C@@H](C)CNCc1ccc(F)c(C#N)c1	ZINC001754273589	1440561882	/nfs/dbraw/zinc/56/18/82/1440561882.db2.gz	XTOFZVBSWSFOMG-UGSOOPFHSA-N	0	3	337.414	3.210	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)NC(=O)Cc1ccc(Cl)cc1	ZINC001754292959	1440565768	/nfs/dbraw/zinc/56/57/68/1440565768.db2.gz	YQMQUGXOAMTCTG-LBPRGKRZSA-N	0	3	347.871	3.110	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)NC(=O)c1cc2c(s1)CCC2	ZINC001754292966	1440565787	/nfs/dbraw/zinc/56/57/87/1440565787.db2.gz	ZBIPBRLUBHNBCD-NSHDSACASA-N	0	3	345.493	3.078	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccc2cc[nH]c2c1)NC(=O)C#CC(C)(C)C	ZINC001754309988	1440572762	/nfs/dbraw/zinc/57/27/62/1440572762.db2.gz	FAXIPNKQAAZKLD-HNNXBMFYSA-N	0	3	325.456	3.154	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](C)CN(C)Cc1ccccc1N(C)C	ZINC001754319772	1440577503	/nfs/dbraw/zinc/57/75/03/1440577503.db2.gz	QQALPQADLMKIBQ-INIZCTEOSA-N	0	3	331.504	3.291	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CCCC[C@@H]1CNCc1ccccc1C#N	ZINC001754339194	1440587910	/nfs/dbraw/zinc/58/79/10/1440587910.db2.gz	DNPRWLHWOYQWES-MOPGFXCFSA-N	0	3	325.456	3.289	20	30		EGEDHN
C=C(Cl)CNCCCN(C)C(=O)c1c[nH]nc1C1CCCCC1	ZINC001754409176	1440596089	/nfs/dbraw/zinc/59/60/89/1440596089.db2.gz	NCEXUERSVZJOLG-UHFFFAOYSA-N	0	3	338.883	3.262	20	30		EGEDHN
CC[C@H](C)CCC(=O)N[C@@H](CNCC#Cc1ccccc1)C1CC1	ZINC001754455182	1440601971	/nfs/dbraw/zinc/60/19/71/1440601971.db2.gz	NLJRBGKNLVBDIR-PXNSSMCTSA-N	0	3	326.484	3.349	20	30		EGEDHN
C=CCC[C@H](C)N1CC[C@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1	ZINC001754504199	1440615648	/nfs/dbraw/zinc/61/56/48/1440615648.db2.gz	GSSYUDLIZFXXLW-BBRMVZONSA-N	0	3	343.431	3.008	20	30		EGEDHN
Cc1ccc([C@H](C)C(=O)NCC2(NCc3ccc(C#N)cc3)CC2)o1	ZINC001754528392	1440621653	/nfs/dbraw/zinc/62/16/53/1440621653.db2.gz	GFZWIWVSCGWHLS-HNNXBMFYSA-N	0	3	337.423	3.002	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)CCC(F)(F)F)C1	ZINC001754537836	1440625140	/nfs/dbraw/zinc/62/51/40/1440625140.db2.gz	DZNDVPRNILAXMQ-HUUCEWRRSA-N	0	3	330.394	3.055	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001754566375	1440635715	/nfs/dbraw/zinc/63/57/15/1440635715.db2.gz	RXIKCMHCDUYTBL-OAQYLSRUSA-N	0	3	337.467	3.339	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CCC[C@H]1CNCc1cc(C)ccc1F	ZINC001754608526	1440643490	/nfs/dbraw/zinc/64/34/90/1440643490.db2.gz	RGRPNRUFEKGELJ-AEFFLSMTSA-N	0	3	348.462	3.196	20	30		EGEDHN
CC1(CC(=O)NC2(C)CCN(Cc3cccc(C#N)c3)CC2)CC1	ZINC001754627618	1440646726	/nfs/dbraw/zinc/64/67/26/1440646726.db2.gz	ROCJUDBYUIEABW-UHFFFAOYSA-N	0	3	325.456	3.219	20	30		EGEDHN
C#CCN(C(=O)c1cc(C)cc(Cl)c1)C1CCN(CC=C)CC1	ZINC001754638094	1440648738	/nfs/dbraw/zinc/64/87/38/1440648738.db2.gz	KWIRZBCGVAQAOV-UHFFFAOYSA-N	0	3	330.859	3.374	20	30		EGEDHN
C#CCN(C(=O)[C@@H](C)c1c(F)cccc1F)C1CCN(CC=C)CC1	ZINC001754638070	1440648807	/nfs/dbraw/zinc/64/88/07/1440648807.db2.gz	JZLGXSMWLPTLTM-HNNXBMFYSA-N	0	3	346.421	3.181	20	30		EGEDHN
C#CCN(C(=O)[C@@H](F)C(C)C)C1CCN(Cc2ccc(C)cc2)CC1	ZINC001754639358	1440648817	/nfs/dbraw/zinc/64/88/17/1440648817.db2.gz	FFZZHLBGTWIFTN-FQEVSTJZSA-N	0	3	344.474	3.415	20	30		EGEDHN
C#CCNC[C@@H](NC(=O)CCOC(C)C)c1ccc2ccccc2c1	ZINC001754643705	1440649507	/nfs/dbraw/zinc/64/95/07/1440649507.db2.gz	FWCMZAROACRWTJ-HXUWFJFHSA-N	0	3	338.451	3.035	20	30		EGEDHN
C#CCNC[C@H](NC(=O)C1(C2CC2)CC1)c1ccc2ccccc2c1	ZINC001754644443	1440649765	/nfs/dbraw/zinc/64/97/65/1440649765.db2.gz	TUSUUKOHOOTSFF-FQEVSTJZSA-N	0	3	332.447	3.410	20	30		EGEDHN
Cc1ccc(F)c(CNC[C@H](NC(=O)[C@@H](C)C#N)C2CCCC2)c1	ZINC001754645311	1440649973	/nfs/dbraw/zinc/64/99/73/1440649973.db2.gz	KIBABDZKMDUUFW-KSSFIOAISA-N	0	3	331.435	3.058	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@]1(C)CCN(Cc2cccc(OC)c2)C1	ZINC001754678383	1440661305	/nfs/dbraw/zinc/66/13/05/1440661305.db2.gz	RSICSJMOSVZLRD-NRFANRHFSA-N	0	3	342.483	3.360	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@](C)(CNCc3oc(C)nc3C)C2)CCC1	ZINC001754705166	1440668880	/nfs/dbraw/zinc/66/88/80/1440668880.db2.gz	XEMHRXCZGQYDMD-LJQANCHMSA-N	0	3	345.487	3.366	20	30		EGEDHN
C=CCN1CCC[C@@](C)(CNC(=O)c2ccc(-c3cn[nH]c3)cc2)C1	ZINC001754732237	1440680097	/nfs/dbraw/zinc/68/00/97/1440680097.db2.gz	QIIKMUNOFOQNAR-FQEVSTJZSA-N	0	3	338.455	3.095	20	30		EGEDHN
CC#CCN1CCC[C@@](C)(CNC(=O)[C@@H](C)c2ccc(F)c(F)c2)C1	ZINC001754734416	1440681561	/nfs/dbraw/zinc/68/15/61/1440681561.db2.gz	VKSRCHGFSQJFIA-YWZLYKJASA-N	0	3	348.437	3.310	20	30		EGEDHN
CC#CCN1CCC[C@@](C)(CNC(=O)Cc2cccc(C(F)F)c2)C1	ZINC001754735886	1440682478	/nfs/dbraw/zinc/68/24/78/1440682478.db2.gz	MVARQNDBMSZEDD-FQEVSTJZSA-N	0	3	348.437	3.408	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@@H](CNC(=O)[C@H](C)c2ccccc2C)C1	ZINC001754744366	1440684116	/nfs/dbraw/zinc/68/41/16/1440684116.db2.gz	GPNLBEBNCGRPFR-SJORKVTESA-N	0	3	348.437	3.195	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(Cc1cc(C)no1)C2	ZINC001754782216	1440686669	/nfs/dbraw/zinc/68/66/69/1440686669.db2.gz	ABNBSDYIAMRHHD-JYJNAYRXSA-N	0	3	331.460	3.054	20	30		EGEDHN
C=C(C)CN[C@H](CNC(=O)c1ccns1)c1ccccc1CC	ZINC001754785661	1440687612	/nfs/dbraw/zinc/68/76/12/1440687612.db2.gz	OXTHSLZCWAHQSV-MRXNPFEDSA-N	0	3	329.469	3.342	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@H](C)[C@H](CNCc2ccccc2C#N)C1	ZINC001754815469	1440692273	/nfs/dbraw/zinc/69/22/73/1440692273.db2.gz	RWOQVZGAVVXJCB-QFBILLFUSA-N	0	3	339.483	3.345	20	30		EGEDHN
C#CCNCCN(Cc1ccccc1)C(=O)c1sccc1Cl	ZINC001754837999	1440697134	/nfs/dbraw/zinc/69/71/34/1440697134.db2.gz	WPHLUECDUJPTLE-UHFFFAOYSA-N	0	3	332.856	3.267	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@@H](c3ccccc3)[C@@H](C)CC)C[C@@H]2C1	ZINC001754847542	1440699574	/nfs/dbraw/zinc/69/95/74/1440699574.db2.gz	FIJPQIPCAIAUJA-MJUUVYJYSA-N	0	3	338.495	3.230	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCN(C(=O)Cc2ccsc2C)C1	ZINC001754934797	1440711105	/nfs/dbraw/zinc/71/11/05/1440711105.db2.gz	SCFLQHQYFQWGFY-CQSZACIVSA-N	0	3	326.893	3.180	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)NCc1ccc([C@H](C)NC/C=C\Cl)cc1	ZINC001754947558	1440713826	/nfs/dbraw/zinc/71/38/26/1440713826.db2.gz	OMGUOFIIDPTVGY-GYYDYCLCSA-N	0	3	336.863	3.033	20	30		EGEDHN
C#CCN[C@@H](C)c1ccc(CNC(=O)c2oc(C(C)C)nc2C)cc1	ZINC001754947858	1440714001	/nfs/dbraw/zinc/71/40/01/1440714001.db2.gz	CRZFPRMCWBUIML-AWEZNQCLSA-N	0	3	339.439	3.320	20	30		EGEDHN
CC#CCN[C@H](C)c1ccc(CNC(=O)c2ccncc2Cl)cc1	ZINC001754948657	1440714262	/nfs/dbraw/zinc/71/42/62/1440714262.db2.gz	MLEDGHCICJCCSC-CQSZACIVSA-N	0	3	341.842	3.339	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NCc1ccccc1CN(C)CC=C	ZINC001754952489	1440715391	/nfs/dbraw/zinc/71/53/91/1440715391.db2.gz	CXSZGVIFQIIXQC-UHFFFAOYSA-N	0	3	332.447	3.145	20	30		EGEDHN
C[C@@]1(C(=O)NCC2(NCc3ccc(C#N)s3)CCC2)CC=CCC1	ZINC001754983572	1440721948	/nfs/dbraw/zinc/72/19/48/1440721948.db2.gz	YRMYGAMXVPWVJQ-GOSISDBHSA-N	0	3	343.496	3.495	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)C3(F)CCCC3)CCC2)s1	ZINC001754991045	1440724320	/nfs/dbraw/zinc/72/43/20/1440724320.db2.gz	WWBLCXAOYOUIEN-UHFFFAOYSA-N	0	3	335.448	3.031	20	30		EGEDHN
CCCCC[C@@H](CC)C(=O)N[C@H]1CCCN(CC#CCOC)CC1	ZINC001755033796	1440733191	/nfs/dbraw/zinc/73/31/91/1440733191.db2.gz	FHEKTGZCULOBMN-MOPGFXCFSA-N	0	3	336.520	3.213	20	30		EGEDHN
CC#CCN(C)CCCN(C)C(=O)c1cc(C2CC2)oc1C1CC1	ZINC001755039360	1440736267	/nfs/dbraw/zinc/73/62/67/1440736267.db2.gz	RUZRPMZEIZBWBE-UHFFFAOYSA-N	0	3	328.456	3.452	20	30		EGEDHN
CC#CCN(C)CCCN(C)C(=O)Cc1ccc(CC(C)C)cc1	ZINC001755040157	1440736653	/nfs/dbraw/zinc/73/66/53/1440736653.db2.gz	LBGMHVXTIUESAC-UHFFFAOYSA-N	0	3	328.500	3.231	20	30		EGEDHN
CC(C)(C)C#CC(=O)NC[C@@H]1Cc2ccccc2CN1CCC1CC1	ZINC001755075505	1440748290	/nfs/dbraw/zinc/74/82/90/1440748290.db2.gz	HWRCFJFJILYYKC-FQEVSTJZSA-N	0	3	338.495	3.379	20	30		EGEDHN
C=CCCCN1Cc2ccccc2C[C@H]1CNC(=O)Cc1ccoc1	ZINC001755075971	1440748545	/nfs/dbraw/zinc/74/85/45/1440748545.db2.gz	QPSXQDGMCFIYJK-FQEVSTJZSA-N	0	3	338.451	3.331	20	30		EGEDHN
C=CCCCN1CCc2ccccc2[C@H]1CNC(=O)c1cc(C)on1	ZINC001755172487	1440769491	/nfs/dbraw/zinc/76/94/91/1440769491.db2.gz	SAYCBCRHSBCNFM-LJQANCHMSA-N	0	3	339.439	3.278	20	30		EGEDHN
C=CCCCN1CCOC2(CCN(C(=O)c3ccsc3)CC2)C1	ZINC001755173867	1440770085	/nfs/dbraw/zinc/77/00/85/1440770085.db2.gz	IEJWUASGDKQAPQ-UHFFFAOYSA-N	0	3	334.485	3.021	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCN1C(=O)CCc1ncc(C(C)(C)C)o1	ZINC001755195705	1440776745	/nfs/dbraw/zinc/77/67/45/1440776745.db2.gz	WRHJMZYJDMPETC-OAHLLOKOSA-N	0	3	333.476	3.014	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)CCC(F)F	ZINC001755197104	1440777536	/nfs/dbraw/zinc/77/75/36/1440777536.db2.gz	UMEXBEVASAEEPP-INIZCTEOSA-N	0	3	335.398	3.026	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](C2CCN(C(=O)C[C@@H](C)OC)CC2)C1	ZINC001755205234	1440782005	/nfs/dbraw/zinc/78/20/05/1440782005.db2.gz	QUVRDOFCGHLSGN-NVXWUHKLSA-N	0	3	342.911	3.115	20	30		EGEDHN
CCCC1(C(=O)NC2CC(CNCc3cc(C#N)ccc3F)C2)CC1	ZINC001755218805	1440784318	/nfs/dbraw/zinc/78/43/18/1440784318.db2.gz	QKYGQXJLASZZED-UHFFFAOYSA-N	0	3	343.446	3.262	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)s1)[C@@H](C)NC(=O)CCc1ccsc1	ZINC001755237572	1440788685	/nfs/dbraw/zinc/78/86/85/1440788685.db2.gz	NPEHHCXVWAOIBQ-CHWSQXEVSA-N	0	3	347.509	3.297	20	30		EGEDHN
CC#CCCCC(=O)N[C@H](C)[C@H](C)NCc1cc(C)ccc1OC	ZINC001755248360	1440791222	/nfs/dbraw/zinc/79/12/22/1440791222.db2.gz	IRRIFWDGHQTKIQ-DLBZAZTESA-N	0	3	330.472	3.180	20	30		EGEDHN
C[C@@H](NCC#Cc1ccc(Cl)cc1)[C@@H](C)NC(=O)C#CC(C)(C)C	ZINC001755254430	1440792821	/nfs/dbraw/zinc/79/28/21/1440792821.db2.gz	QDWYHHQMCDLXSI-HZPDHXFCSA-N	0	3	344.886	3.224	20	30		EGEDHN
C[C@H](NCC#Cc1ccc(Cl)cc1)[C@H](C)NC(=O)C#CC(C)(C)C	ZINC001755254429	1440792860	/nfs/dbraw/zinc/79/28/60/1440792860.db2.gz	QDWYHHQMCDLXSI-HOTGVXAUSA-N	0	3	344.886	3.224	20	30		EGEDHN
Cc1cc(F)cc(C(=O)N[C@H](C)[C@H](C)NCc2ccc(C#N)s2)c1	ZINC001755256450	1440793329	/nfs/dbraw/zinc/79/33/29/1440793329.db2.gz	KCCQTQLDXFTRNZ-QWHCGFSZSA-N	0	3	345.443	3.364	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)[C@H]1Cc2ccc(F)cc21	ZINC001755284354	1440801540	/nfs/dbraw/zinc/80/15/40/1440801540.db2.gz	PFDBFOFZPLUALB-INIZCTEOSA-N	0	3	338.854	3.292	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)[C@@H](C)c1c(C)noc1C	ZINC001755285438	1440801946	/nfs/dbraw/zinc/80/19/46/1440801946.db2.gz	JOYSRGFCOACIQH-LBPRGKRZSA-N	0	3	341.883	3.222	20	30		EGEDHN
C[C@@H](CNC(=O)[C@@H]1CC12CCCC2)N(C)Cc1cccc(C#N)c1	ZINC001755324403	1440820763	/nfs/dbraw/zinc/82/07/63/1440820763.db2.gz	MRXZNKXDKYVZMM-YJBOKZPZSA-N	0	3	325.456	3.075	20	30		EGEDHN
Cc1nsc(C)c1CNCC1(NC(=O)C#CC2CC2)CCCCC1	ZINC001755350809	1440827901	/nfs/dbraw/zinc/82/79/01/1440827901.db2.gz	HNGSKVCKMNWIQT-UHFFFAOYSA-N	0	3	345.512	3.082	20	30		EGEDHN
C[C@H](C(=O)NC[C@H]1CCCCCN1Cc1ccc(C#N)cc1)C1CC1	ZINC001755365011	1440833746	/nfs/dbraw/zinc/83/37/46/1440833746.db2.gz	OEBDJENGVCBIER-OXJNMPFZSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCOc2cc(C)cc(C)c2)C(C)(C)C1	ZINC001755413276	1440847252	/nfs/dbraw/zinc/84/72/52/1440847252.db2.gz	WQGCLGIQCAXJTQ-GOSISDBHSA-N	0	3	330.472	3.085	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CC[C@@H](NC(=O)CCc3ccoc3)C[C@@H]2C1	ZINC001755449167	1440852829	/nfs/dbraw/zinc/85/28/29/1440852829.db2.gz	CNJWAHVZBPLRPM-GVDBMIGSSA-N	0	3	336.863	3.181	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N[C@H](C)CCCNCc1cc(C#N)ccc1F	ZINC001755517367	1440864403	/nfs/dbraw/zinc/86/44/03/1440864403.db2.gz	SKDAWHCAQSVEHW-FRFSOERESA-N	0	3	331.435	3.118	20	30		EGEDHN
CCC[C@H](C)C(=O)N1CCC(N(C)Cc2ccc(C#N)s2)CC1	ZINC001755528449	1440866173	/nfs/dbraw/zinc/86/61/73/1440866173.db2.gz	MLENUMOBDHHKJK-AWEZNQCLSA-N	0	3	333.501	3.479	20	30		EGEDHN
C#CCC[NH2+]CCC[C@H](NC(=O)c1ccccc1[O-])c1ccccc1	ZINC001755547341	1440870925	/nfs/dbraw/zinc/87/09/25/1440870925.db2.gz	PZBHIOGWYDRBHY-IBGZPJMESA-N	0	3	336.435	3.256	20	30		EGEDHN
C=C(C)CCC(=O)N(C)C[C@@H](C)NCC#Cc1ccc(Cl)cc1	ZINC001755589310	1440881166	/nfs/dbraw/zinc/88/11/66/1440881166.db2.gz	RGHZQSZADWLUQE-MRXNPFEDSA-N	0	3	332.875	3.484	20	30		EGEDHN
C=CC(C)(C)C(=O)N(C)C[C@H](C)NCc1ccccc1OC1CC1	ZINC001755600809	1440884053	/nfs/dbraw/zinc/88/40/53/1440884053.db2.gz	STCDFQWGMWCADC-HNNXBMFYSA-N	0	3	330.472	3.377	20	30		EGEDHN
C[C@@H](CN(C)C(=O)CC1CC(C)(C)C1)NCc1ccc(C#N)s1	ZINC001755601308	1440884266	/nfs/dbraw/zinc/88/42/66/1440884266.db2.gz	KBTCQNRLTGXYAU-ZDUSSCGKSA-N	0	3	333.501	3.383	20	30		EGEDHN
C[C@@H]1[C@@H](NCc2ccc(C#N)s2)CCN1C(=O)CCCC1CC1	ZINC001755659582	1440892515	/nfs/dbraw/zinc/89/25/15/1440892515.db2.gz	SSPPGTNCVGOLSM-DYVFJYSZSA-N	0	3	331.485	3.279	20	30		EGEDHN
CCCc1[nH]ccc1C(=O)N1C[C@@H](NCC#Cc2ccccc2)C[C@H]1C	ZINC001755683817	1440895565	/nfs/dbraw/zinc/89/55/65/1440895565.db2.gz	YZFXTDQSNKRXFG-MJGOQNOKSA-N	0	3	349.478	3.212	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)CCOCc2ccccc2)[C@H]1C	ZINC001755719580	1440906899	/nfs/dbraw/zinc/90/68/99/1440906899.db2.gz	AMCULKNQPQAJTA-IEBWSBKVSA-N	0	3	330.472	3.139	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)CCc2ccc(F)cc2F)[C@@H]1C	ZINC001755721357	1440907446	/nfs/dbraw/zinc/90/74/46/1440907446.db2.gz	NJWRSZSCDRTMPZ-KSSFIOAISA-N	0	3	336.426	3.443	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1CC[C@@H](CNCc2nc(C)cs2)C1	ZINC001755726225	1440909370	/nfs/dbraw/zinc/90/93/70/1440909370.db2.gz	FJBATZKIPWZPMW-CVEARBPZSA-N	0	3	333.501	3.020	20	30		EGEDHN
CC/C(C)=C\C(=O)N1C[C@@H](NCc2ccc(F)c(C#N)c2)C(C)(C)C1	ZINC001755759151	1440914614	/nfs/dbraw/zinc/91/46/14/1440914614.db2.gz	LNTUGFOMFWWUJF-DVNIYVAHSA-N	0	3	343.446	3.380	20	30		EGEDHN
C#CCCN(C)CCN(C(=O)c1cc(Cl)c(Cl)n1C)C(C)C	ZINC001755812619	1440921260	/nfs/dbraw/zinc/92/12/60/1440921260.db2.gz	AZDYOCIVWMJHEX-UHFFFAOYSA-N	0	3	344.286	3.138	20	30		EGEDHN
C=CCCC(=O)N[C@@H](CNCc1cnn(C(C)(C)C)c1)C(C)(C)C	ZINC001755821911	1440925922	/nfs/dbraw/zinc/92/59/22/1440925922.db2.gz	QLPYBQVFSZXWHX-INIZCTEOSA-N	0	3	334.508	3.225	20	30		EGEDHN
CCC1(C(=O)N[C@@H](C)C2CCN(Cc3ccc(C#N)cc3)CC2)CC1	ZINC001755850886	1440934821	/nfs/dbraw/zinc/93/48/21/1440934821.db2.gz	QVDPELGSUSASLE-INIZCTEOSA-N	0	3	339.483	3.465	20	30		EGEDHN
C#CCN1CCC([C@H](C)NC(=O)C[C@@H](C)c2cccc(F)c2)CC1	ZINC001755851133	1440934919	/nfs/dbraw/zinc/93/49/19/1440934919.db2.gz	SQBMJDFCWRTUDV-CVEARBPZSA-N	0	3	330.447	3.169	20	30		EGEDHN
CC(C)C#CC(=O)N(C)C1CC(N[C@H](C)c2ccc(F)cc2F)C1	ZINC001755856640	1440935890	/nfs/dbraw/zinc/93/58/90/1440935890.db2.gz	GRIVBRZPZDSDGZ-IUDNXUCKSA-N	0	3	334.410	3.264	20	30		EGEDHN
C=C(Cl)Cn1c(CC)nnc1N1CCN(CCC(C)(C)C)CC1	ZINC001760376499	1441368055	/nfs/dbraw/zinc/36/80/55/1441368055.db2.gz	RUFZVLFXBQVKOO-UHFFFAOYSA-N	0	3	339.915	3.151	20	30		EGEDHN
C=CCN(CC1CCCCC1)C(=O)Nc1ccnn1CCN(C)C	ZINC000297358394	202052104	/nfs/dbraw/zinc/05/21/04/202052104.db2.gz	KNQDRUXUEUODSN-UHFFFAOYSA-N	0	3	333.480	3.045	20	30		EGEDHN
CCN(CCOc1ccc(C#N)cc1)Cc1ccc(OC)c(OC)c1	ZINC000024245565	202114815	/nfs/dbraw/zinc/11/48/15/202114815.db2.gz	BZZLPOSTDDZBQM-UHFFFAOYSA-N	0	3	340.423	3.476	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000189266438	201046691	/nfs/dbraw/zinc/04/66/91/201046691.db2.gz	DFABVVCMKCIQGR-YFVAEKQCSA-N	0	3	344.499	3.385	20	30		EGEDHN
C=CCN1CCC(Nc2nc(-c3ccccn3)nc3c2CCC3)CC1	ZINC000265350533	201215670	/nfs/dbraw/zinc/21/56/70/201215670.db2.gz	SIQAWVDXDAKEBO-UHFFFAOYSA-N	0	3	335.455	3.090	20	30		EGEDHN
C#CCN1CCC(C(=O)NC(C)(c2ccccc2)c2ccccc2)CC1	ZINC000264017279	201208223	/nfs/dbraw/zinc/20/82/23/201208223.db2.gz	FNBVMUSDEJFTKZ-UHFFFAOYSA-N	0	3	346.474	3.412	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](C)c2cccc(OCC)c2)CC1	ZINC000264373529	201209407	/nfs/dbraw/zinc/20/94/07/201209407.db2.gz	JNBCVMIJMOELCL-INIZCTEOSA-N	0	3	345.487	3.486	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@@H]2c2ccc(OC)cc2)CC1	ZINC000264382006	201209800	/nfs/dbraw/zinc/20/98/00/201209800.db2.gz	USTBJTPSMFXCBE-LJQANCHMSA-N	0	3	343.471	3.192	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NC1CCN(CCc2ccccc2)CC1)OCC	ZINC000270069716	201234608	/nfs/dbraw/zinc/23/46/08/201234608.db2.gz	XCDSAWJFRNQOKU-HXUWFJFHSA-N	0	3	344.499	3.181	20	30		EGEDHN
C=CCN(CCc1ccco1)C[C@@H](O)COc1cccc2[nH]ccc21	ZINC000272239063	201248752	/nfs/dbraw/zinc/24/87/52/201248752.db2.gz	GDOLIFOZJOKDLH-MRXNPFEDSA-N	0	3	340.423	3.231	20	30		EGEDHN
C=C[C@@H](CC(=O)NCCCCN1C[C@@H](C)O[C@@H](C)C1)c1ccccc1	ZINC000270379750	201238419	/nfs/dbraw/zinc/23/84/19/201238419.db2.gz	PBWSTGPSTPFZTE-OTWHNJEPSA-N	0	3	344.499	3.352	20	30		EGEDHN
C=CCN(Cc1ccccc1F)C(=O)N[C@H](C)C1=CCN(C)CC1	ZINC000272653814	201251641	/nfs/dbraw/zinc/25/16/41/201251641.db2.gz	AYKZGQWIIOJYNV-OAHLLOKOSA-N	0	3	331.435	3.174	20	30		EGEDHN
C=CCS(=O)(=O)CCNCC(c1ccccc1)c1ccccc1	ZINC000272812916	201259424	/nfs/dbraw/zinc/25/94/24/201259424.db2.gz	HEZSOFPUWFQMFF-UHFFFAOYSA-N	0	3	329.465	3.009	20	30		EGEDHN
C=CCCO[C@H](C)c1nc(-c2ccccc2OCCN(C)C)no1	ZINC000273933842	201263486	/nfs/dbraw/zinc/26/34/86/201263486.db2.gz	RNHVWFIVNOFXLI-CQSZACIVSA-N	0	3	331.416	3.331	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)CCc1ccccc1N)C(C)C	ZINC000279815204	201322794	/nfs/dbraw/zinc/32/27/94/201322794.db2.gz	LLVVAXKCNUEEON-IBGZPJMESA-N	0	3	329.488	3.016	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cnn([C@H](C)CC)c2C2CC2)CC1	ZINC000089819959	201370472	/nfs/dbraw/zinc/37/04/72/201370472.db2.gz	ITLYYDVSQALSQX-CQSZACIVSA-N	0	3	330.476	3.112	20	30		EGEDHN
CC(C)Oc1ccc(NC(=O)N2CC[C@H]3CC[C@@H](C2)N3C)cc1C#N	ZINC000157884612	206161161	/nfs/dbraw/zinc/16/11/61/206161161.db2.gz	TVKUZPOUHSMQBW-SJORKVTESA-N	0	3	342.443	3.046	20	30		EGEDHN
COc1ccc(CNC[C@@H](O)c2ccc(OC(C)C)cc2)cc1C#N	ZINC000266161695	248140519	/nfs/dbraw/zinc/14/05/19/248140519.db2.gz	NQFAOABMXJCWDZ-LJQANCHMSA-N	0	3	340.423	3.177	20	30		EGEDHN
CC[C@@H](N[C@@H]1CCN(c2sccc2C#N)C1=O)c1ccccc1	ZINC000267685177	251253200	/nfs/dbraw/zinc/25/32/00/251253200.db2.gz	MXVLRNMZQCYUEW-HZPDHXFCSA-N	0	3	325.437	3.466	20	30		EGEDHN
CCC[C@@H](NCCS(=O)(=O)c1ccc(C#N)cc1)c1ccccc1	ZINC000176880774	207271392	/nfs/dbraw/zinc/27/13/92/207271392.db2.gz	MIBWPKUXFVSQHD-LJQANCHMSA-N	0	3	342.464	3.463	20	30		EGEDHN
C[C@H](c1ccc([S@](C)=O)cc1)N(C)C[C@H](O)c1ccc(C#N)cc1	ZINC000268729310	252178627	/nfs/dbraw/zinc/17/86/27/252178627.db2.gz	XAXHDLFYAKTBBS-PBPZHQAMSA-N	0	3	342.464	3.022	20	30		EGEDHN
N#Cc1ccc(CNc2ccccc2CN2CCC(CO)CC2)s1	ZINC000119676961	221375004	/nfs/dbraw/zinc/37/50/04/221375004.db2.gz	HIRBFWBWHNOHQE-UHFFFAOYSA-N	0	3	341.480	3.436	20	30		EGEDHN
C[C@@H](N[C@@H]1CCCN(C(=O)Cc2ccccc2)C1)c1cccc(C#N)c1	ZINC000338014241	141073505	/nfs/dbraw/zinc/07/35/05/141073505.db2.gz	FCLMHKQOWDXBNR-DYESRHJHSA-N	0	3	347.462	3.443	20	30		EGEDHN
N#Cc1ccc(CNCCc2nc(-c3ccncc3)cs2)s1	ZINC000344554552	141172612	/nfs/dbraw/zinc/17/26/12/141172612.db2.gz	PTTRVFCFILIRGU-UHFFFAOYSA-N	0	3	326.450	3.471	20	30		EGEDHN
C[C@@H](NC(=O)c1ncc(C#N)cc1Cl)[C@H](c1ccccc1)N(C)C	ZINC000356236016	141325354	/nfs/dbraw/zinc/32/53/54/141325354.db2.gz	UWFHRNXANAHXQU-SJKOYZFVSA-N	0	3	342.830	3.028	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H](CNC(=O)c1ccc(C#N)cc1)C1CC1	ZINC000185324820	144111510	/nfs/dbraw/zinc/11/15/10/144111510.db2.gz	LDBOBIPIRBMYGM-FQEVSTJZSA-N	0	3	333.435	3.199	20	30		EGEDHN
N#Cc1ccccc1NC(=O)CCN1CC[C@@]2(C1)OCc1ccccc12	ZINC000186599850	144138576	/nfs/dbraw/zinc/13/85/76/144138576.db2.gz	HELZZAVHPOJKKO-NRFANRHFSA-N	0	3	347.418	3.018	20	30		EGEDHN
CCCn1cc(CN[C@@H]2CCCN(c3ccc(C#N)cc3F)C2)cn1	ZINC000116917201	152081471	/nfs/dbraw/zinc/08/14/71/152081471.db2.gz	FYJNJXSDGQXXBI-QGZVFWFLSA-N	0	3	341.434	3.062	20	30		EGEDHN
C[C@H]1CC(C)(C)CC[C@@H]1NCCS(=O)(=O)c1ccc(C#N)cc1	ZINC000120834112	152303618	/nfs/dbraw/zinc/30/36/18/152303618.db2.gz	UMPGSBJQEQAHBF-YOEHRIQHSA-N	0	3	334.485	3.136	20	30		EGEDHN
Cn1cc(CN[C@H]2CCN(C)[C@@H]2c2ccc(Cl)cc2)cc1C#N	ZINC000191500551	153202619	/nfs/dbraw/zinc/20/26/19/153202619.db2.gz	BINCBMQJNFZCFW-ZWKOTPCHSA-N	0	3	328.847	3.085	20	30		EGEDHN
COc1cc(CN(CCN(C)C)Cc2cccc(F)c2)ccc1C#N	ZINC000349037073	156328195	/nfs/dbraw/zinc/32/81/95/156328195.db2.gz	QYKWAEDAOWUXOQ-UHFFFAOYSA-N	0	3	341.430	3.270	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1cccc(C#N)c1	ZINC000248399917	163000383	/nfs/dbraw/zinc/00/03/83/163000383.db2.gz	WPFCHBIHIBLVQI-HNAYVOBHSA-N	0	3	334.423	3.200	20	30		EGEDHN
CO[C@H](CN1CCCN(Cc2ccc(C#N)cc2)CC1)c1ccccc1	ZINC000338547223	163268961	/nfs/dbraw/zinc/26/89/61/163268961.db2.gz	UAANUQDELJMDJP-JOCHJYFZSA-N	0	3	349.478	3.454	20	30		EGEDHN
C[C@H](c1cccc(O)c1)N(C)CCC(=O)Nc1sccc1C#N	ZINC000345993933	164312425	/nfs/dbraw/zinc/31/24/25/164312425.db2.gz	KZXOZBCVWDDXFX-GFCCVEGCSA-N	0	3	329.425	3.347	20	30		EGEDHN
CN(Cc1cc(C#N)n(C)c1)C[C@H]1C[C@@H](F)CN1Cc1cccs1	ZINC000354933144	166068130	/nfs/dbraw/zinc/06/81/30/166068130.db2.gz	FZIMFSMJJOKYKV-NVXWUHKLSA-N	0	3	346.475	3.003	20	30		EGEDHN
CC[C@H](C)N[C@@H](CNC(=O)c1ncc(C#N)cc1Cl)c1ccco1	ZINC000359535408	167183424	/nfs/dbraw/zinc/18/34/24/167183424.db2.gz	CTMQTOKHKAJXTR-FZMZJTMJSA-N	0	3	346.818	3.059	20	30		EGEDHN
CC[C@H](C)N[C@H](CNC(=O)CCc1ccc(C#N)cc1)c1ccco1	ZINC000359540567	167185981	/nfs/dbraw/zinc/18/59/81/167185981.db2.gz	CJIYGCKWGWZZSW-MAUKXSAKSA-N	0	3	339.439	3.329	20	30		EGEDHN
C[C@H](C(=O)N1CC=C(c2ccc(C#N)cc2)CC1)N1[C@H](C)CC[C@@H]1C	ZINC000367229005	168196512	/nfs/dbraw/zinc/19/65/12/168196512.db2.gz	NOXXCUCPKWNNGJ-IXDOHACOSA-N	0	3	337.467	3.435	20	30		EGEDHN
C[C@H](CN1CCC[C@@H](C)C1)NC(=O)C(C)(C)Cc1ccc(C#N)cc1	ZINC000454995220	269871963	/nfs/dbraw/zinc/87/19/63/269871963.db2.gz	NJAFJEJCFLKADL-IAGOWNOFSA-N	0	3	341.499	3.364	20	30		EGEDHN
N#Cc1ccc([C@H](N[C@H]2CC[C@H](Cc3ccccc3)C2)C(N)=O)cc1	ZINC000526121175	269969054	/nfs/dbraw/zinc/96/90/54/269969054.db2.gz	JWWCTKDKWIFAJQ-HOJAQTOUSA-N	0	3	333.435	3.086	20	30		EGEDHN
CCCOc1ccc(CNC(=O)C(C#N)Cc2ccc(C#N)cc2)cc1	ZINC000279324205	270039950	/nfs/dbraw/zinc/03/99/50/270039950.db2.gz	OJPKRZNPVRXUFH-IBGZPJMESA-N	0	3	347.418	3.346	20	30		EGEDHN
CSc1ccc([C@H](CNC(=O)c2cc(C#N)oc2C)N(C)C)cc1	ZINC000294273303	270042357	/nfs/dbraw/zinc/04/23/57/270042357.db2.gz	CBHJGEFBXJNBRL-KRWDZBQOSA-N	0	3	343.452	3.214	20	30		EGEDHN
COc1ccc([C@H](CNc2ccc(F)cc2C#N)N(C)C)cc1OC	ZINC000302581727	270044783	/nfs/dbraw/zinc/04/47/83/270044783.db2.gz	UDSIOJBQQWHHCU-KRWDZBQOSA-N	0	3	343.402	3.429	20	30		EGEDHN
N#Cc1ccccc1OCCN[C@H](c1cccs1)C1(CO)CCC1	ZINC000452057290	270053594	/nfs/dbraw/zinc/05/35/94/270053594.db2.gz	GATFPCCRAKDXHF-GOSISDBHSA-N	0	3	342.464	3.492	20	30		EGEDHN
N#Cc1cccc(COc2cccc(CNCC34CC(C3)CO4)c2)c1	ZINC000527787367	270059661	/nfs/dbraw/zinc/05/96/61/270059661.db2.gz	ILZQCUVGWWSTJR-UHFFFAOYSA-N	0	3	334.419	3.406	20	30		EGEDHN
CCCC[C@H]1CCC[C@@H]1NCCS(=O)(=O)c1ccc(C#N)cc1	ZINC000184696642	266039975	/nfs/dbraw/zinc/03/99/75/266039975.db2.gz	BKBZKGRWEHNJHM-WMZOPIPTSA-N	0	3	334.485	3.280	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)Cc1ccc(C#N)cc1)c1ccsc1	ZINC000194858457	266119162	/nfs/dbraw/zinc/11/91/62/266119162.db2.gz	LUFUGXRFQUETAL-GOSISDBHSA-N	0	3	341.480	3.362	20	30		EGEDHN
CCN(Cc1ccc2c(c1)NC(=O)CO2)[C@@H](C)c1ccc(C#N)cc1	ZINC000295427592	266136339	/nfs/dbraw/zinc/13/63/39/266136339.db2.gz	SUPVCYHRNHAOAU-AWEZNQCLSA-N	0	3	335.407	3.472	20	30		EGEDHN
CCN1CCO[C@@H](CNCc2cccc(C#N)c2)[C@@H]1c1ccccc1	ZINC000284787923	266151903	/nfs/dbraw/zinc/15/19/03/266151903.db2.gz	RAUJCNWXBHVCLB-SFTDATJTSA-N	0	3	335.451	3.110	20	30		EGEDHN
Cc1cc(C(=O)N(CCN(C)C)Cc2cccc(C#N)c2)sc1C	ZINC000195142319	266162717	/nfs/dbraw/zinc/16/27/17/266162717.db2.gz	LIUSNQNBJBFPNA-UHFFFAOYSA-N	0	3	341.480	3.441	20	30		EGEDHN
CCS[C@@H]1CCCC[C@@H]1N[C@H]1CCN(c2sccc2C#N)C1=O	ZINC000299204481	266346949	/nfs/dbraw/zinc/34/69/49/266346949.db2.gz	GAVYUZUEVCHAOG-SOUVJXGZSA-N	0	3	349.525	3.379	20	30		EGEDHN
CCCCN1CCCC[C@@H]1CNC(=O)CSc1ccc(C#N)cc1	ZINC000486091473	267007206	/nfs/dbraw/zinc/00/72/06/267007206.db2.gz	BKMDTBQVTUBYHP-QGZVFWFLSA-N	0	3	345.512	3.421	20	30		EGEDHN
C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCN2[C@H](C(N)=O)c2ccc(C#N)cc2)C1	ZINC000331918356	267032190	/nfs/dbraw/zinc/03/21/90/267032190.db2.gz	LKTPIFUBTJCJJQ-WHUJPVCOSA-N	0	3	341.455	3.396	20	30		EGEDHN
C[C@@](CO)(NCC(=O)Nc1cc(Cl)ccc1C#N)C1CCCCC1	ZINC000266847621	267112690	/nfs/dbraw/zinc/11/26/90/267112690.db2.gz	BDENXVRVJDCBHR-SFHVURJKSA-N	0	3	349.862	3.071	20	30		EGEDHN
C[C@H](CNC(=O)C(C#N)Cc1ccc(C#N)cc1)Cc1cccs1	ZINC000280528540	267161375	/nfs/dbraw/zinc/16/13/75/267161375.db2.gz	SFYSCESPQRLLBR-YOEHRIQHSA-N	0	3	337.448	3.297	20	30		EGEDHN
C[C@H](NC(=O)C1C[C@H](c2ccccc2)OC1=O)c1ccc(C#N)cc1	ZINC000289223156	267176958	/nfs/dbraw/zinc/17/69/58/267176958.db2.gz	JLORIFHVLAXIOG-DOPJRALCSA-N	0	3	334.375	3.040	20	30		EGEDHN
CCS[C@@H]1CCCC[C@@H]1N[C@H]1CCN(c2ccc(C#N)cc2)C1=O	ZINC000411564012	267180298	/nfs/dbraw/zinc/18/02/98/267180298.db2.gz	VOCOOCKJLDIDRU-OKZBNKHCSA-N	0	3	343.496	3.317	20	30		EGEDHN
CC[C@@H]1CCC[C@H]1C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000448725304	267201952	/nfs/dbraw/zinc/20/19/52/267201952.db2.gz	KKQDQIKIHYYLDL-RTBURBONSA-N	0	3	327.472	3.275	20	30		EGEDHN
CN(C(=O)[C@@H]1CCN(Cc2cc(C#N)cs2)C1)c1ccccc1	ZINC000430875621	267275913	/nfs/dbraw/zinc/27/59/13/267275913.db2.gz	AJOYPCQMLQMAMC-OAHLLOKOSA-N	0	3	325.437	3.105	20	30		EGEDHN
CN(C)C[C@H]1CCc2ccccc2N1C(=O)CCc1ccc(C#N)cc1	ZINC000425630565	267283020	/nfs/dbraw/zinc/28/30/20/267283020.db2.gz	RZAVXMIKAHUPPI-HXUWFJFHSA-N	0	3	347.462	3.400	20	30		EGEDHN
CN(C)[C@H](CC(=O)NC1(c2cccc(C#N)c2)CC1)c1ccccc1	ZINC000416178089	267288121	/nfs/dbraw/zinc/28/81/21/267288121.db2.gz	KAGFVURTKJPTOD-LJQANCHMSA-N	0	3	333.435	3.357	20	30		EGEDHN
Cc1cc(CN2CC[C@H](Oc3ccc(C#N)cn3)C2)c2ccccc2n1	ZINC000292231411	267323662	/nfs/dbraw/zinc/32/36/62/267323662.db2.gz	POVZWTWVPZDVBM-SFHVURJKSA-N	0	3	344.418	3.463	20	30		EGEDHN
Cc1ccc(S(=O)(=O)CCCN[C@@H](C)c2ccc(C#N)cc2)cc1	ZINC000271642967	267436793	/nfs/dbraw/zinc/43/67/93/267436793.db2.gz	HHRPJBVJMNPHCH-INIZCTEOSA-N	0	3	342.464	3.381	20	30		EGEDHN
Cc1cc(CNc2cccc(CN3CCC(O)CC3)c2)ccc1C#N	ZINC000443984472	268001516	/nfs/dbraw/zinc/00/15/16/268001516.db2.gz	GMDSROCSFCDDLQ-UHFFFAOYSA-N	0	3	335.451	3.436	20	30		EGEDHN
Cc1cnccc1OC1CCN(CCOc2cccc(C#N)c2)CC1	ZINC000278550745	268037711	/nfs/dbraw/zinc/03/77/11/268037711.db2.gz	HHSILMCIVQIGLQ-UHFFFAOYSA-N	0	3	337.423	3.184	20	30		EGEDHN
COCCSCCCN1CCC(Oc2cccc(C#N)c2)CC1	ZINC000278558515	268038717	/nfs/dbraw/zinc/03/87/17/268038717.db2.gz	VDQGVJMRYDFMMX-UHFFFAOYSA-N	0	3	334.485	3.171	20	30		EGEDHN
Cc1cccc([C@@H]2CCN(C[C@@H](O)COc3ccccc3C#N)C2)c1	ZINC000528440827	268057456	/nfs/dbraw/zinc/05/74/56/268057456.db2.gz	GHQHBNYJUNJCTK-WOJBJXKFSA-N	0	3	336.435	3.096	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@@H]2[C@@H]3CCc4ccccc4[C@@H]32)cc1	ZINC000281445170	268092490	/nfs/dbraw/zinc/09/24/90/268092490.db2.gz	FJSXWOHRMDAHKY-AYWYSENESA-N	0	3	341.414	3.085	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@H]([NH2+][C@@H]3CCc4cccc([O-])c43)C2=O)cc1	ZINC000296360880	268115656	/nfs/dbraw/zinc/11/56/56/268115656.db2.gz	IAIQYTLLDWNMCL-MSOLQXFVSA-N	0	3	347.418	3.036	20	30		EGEDHN
Cn1cc(CN2CCCC[C@H]2CCNC(=O)OC(C)(C)C)cc1C#N	ZINC000495852292	268126656	/nfs/dbraw/zinc/12/66/56/268126656.db2.gz	VQRGNDJFBILPQK-INIZCTEOSA-N	0	3	346.475	3.166	20	30		EGEDHN
N#Cc1ccc(NC[C@@H]2C[C@H](O)CN2Cc2ccccc2)cc1Cl	ZINC000301878216	268156358	/nfs/dbraw/zinc/15/63/58/268156358.db2.gz	ODCZFENQNBCERD-ROUUACIJSA-N	0	3	341.842	3.259	20	30		EGEDHN
N#Cc1ccc(OCCN[C@@H](CCO)c2ccc(Cl)cc2)cc1	ZINC000287114630	268176407	/nfs/dbraw/zinc/17/64/07/268176407.db2.gz	YRGUUUZKJRCKBC-SFHVURJKSA-N	0	3	330.815	3.304	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CNC2(c3cccc(Cl)c3)CC2)cc1	ZINC000271766245	268177405	/nfs/dbraw/zinc/17/74/05/268177405.db2.gz	ITXIPCCZWALLSY-KRWDZBQOSA-N	0	3	342.826	3.230	20	30		EGEDHN
N#Cc1cc(CN2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)ccc1F	ZINC000425496899	268180202	/nfs/dbraw/zinc/18/02/02/268180202.db2.gz	BONCGNZFAOFCME-GHTZIAJQSA-N	0	3	335.426	3.404	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)/C=C/c2ccccc2)c(F)c1	ZINC000493718532	268231804	/nfs/dbraw/zinc/23/18/04/268231804.db2.gz	GHHOIIPTVRMIDP-CSKARUKUSA-N	0	3	337.398	3.007	20	30		EGEDHN
N#Cc1cccc(OC2CCN([C@H]3Cc4ccccc4[C@H]3O)CC2)c1	ZINC000272038246	268271161	/nfs/dbraw/zinc/27/11/61/268271161.db2.gz	XQNDPEYQWGUKIB-LEWJYISDSA-N	0	3	334.419	3.060	20	30		EGEDHN
N#Cc1cccc([C@@H]2C[C@H]2C(=O)N2CCC[C@H]2CN2CCCCC2)c1	ZINC000411967031	268288019	/nfs/dbraw/zinc/28/80/19/268288019.db2.gz	CUHHULMGZKTLAI-SLFFLAALSA-N	0	3	337.467	3.139	20	30		EGEDHN
N#Cc1cnc2c(Br)cccc2c1NCCN1CCCC1	ZINC000440642627	268313761	/nfs/dbraw/zinc/31/37/61/268313761.db2.gz	DWDGBUJLSQOVEK-UHFFFAOYSA-N	0	3	345.244	3.377	20	30		EGEDHN
COCC[C@H](c1ccccc1)N1CCN(c2ccccc2C#N)CC1	ZINC000339870218	274040346	/nfs/dbraw/zinc/04/03/46/274040346.db2.gz	ZSEDRWHYOYGJGE-OAQYLSRUSA-N	0	3	335.451	3.458	20	30		EGEDHN
C[C@H](CN1CCCCC1)Nc1c(C#N)cnc2c(F)c(F)c(F)cc21	ZINC000341556532	274484893	/nfs/dbraw/zinc/48/48/93/274484893.db2.gz	ZZQHVBXJMQQSJQ-LLVKDONJSA-N	0	3	348.372	3.232	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC000072037763	307378695	/nfs/dbraw/zinc/37/86/95/307378695.db2.gz	NNCRYOQFSPSIKI-QGZVFWFLSA-N	0	3	329.444	3.295	20	30		EGEDHN
N#Cc1cnn2cc(CNC3(c4ccc(F)cc4)CCCC3)cnc12	ZINC000549550996	315096603	/nfs/dbraw/zinc/09/66/03/315096603.db2.gz	RWRRWBACHYATFP-UHFFFAOYSA-N	0	3	335.386	3.299	20	30		EGEDHN
CSc1ccc([C@@H](CNc2ccc(Cl)c(C#N)n2)N(C)C)cc1	ZINC000549686057	315101032	/nfs/dbraw/zinc/10/10/32/315101032.db2.gz	UHRLLBNXIFQTRK-MRXNPFEDSA-N	0	3	346.887	3.465	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN1CCC[C@H]1c1cccnc1	ZINC000553890156	315287218	/nfs/dbraw/zinc/28/72/18/315287218.db2.gz	HGWUNVVXFMVPCD-HNNXBMFYSA-N	0	3	326.425	3.180	20	30		EGEDHN
CCN(C)C[C@H](O)CSc1nc(-c2ccccc2)ccc1C#N	ZINC000563422539	316019398	/nfs/dbraw/zinc/01/93/98/316019398.db2.gz	GMLMCDKPGXGLSE-INIZCTEOSA-N	0	3	327.453	3.025	20	30		EGEDHN
Cc1cc(CN[C@H](C)[C@H]2CN(Cc3ccccc3)CCO2)ccc1C#N	ZINC000574714076	317628569	/nfs/dbraw/zinc/62/85/69/317628569.db2.gz	YFCOEQAXPGKJJL-XMSQKQJNSA-N	0	3	349.478	3.246	20	30		EGEDHN
CN(C)Cc1cccc(C(=O)N(Cc2ccc(C#N)cc2)C2CC2)c1	ZINC000172614768	323286668	/nfs/dbraw/zinc/28/66/68/323286668.db2.gz	SYZCHQHGLCYQRR-UHFFFAOYSA-N	0	3	333.435	3.425	20	30		EGEDHN
N#Cc1csc(CNCCc2ccn(-c3ccc(F)cc3)n2)c1	ZINC000177707303	323344708	/nfs/dbraw/zinc/34/47/08/323344708.db2.gz	HKKPMJAMCFUPMW-UHFFFAOYSA-N	0	3	326.400	3.277	20	30		EGEDHN
C=CCSCCNCc1cccc(I)c1	ZINC000308917282	456574618	/nfs/dbraw/zinc/57/46/18/456574618.db2.gz	ISAWJNCLVIWLSR-UHFFFAOYSA-N	0	3	333.238	3.300	20	30		EGEDHN
CN1CCC[C@@]2(CCN(c3nc4c(cc3C#N)CCCC4(C)C)C2)C1	ZINC000579499185	325119924	/nfs/dbraw/zinc/11/99/24/325119924.db2.gz	DHHDDODJSIHTCV-OAQYLSRUSA-N	0	3	338.499	3.489	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN(C)C1CCC(C(F)(F)F)CC1	ZINC000344139264	456800299	/nfs/dbraw/zinc/80/02/99/456800299.db2.gz	KWFQVRLIPRDMJF-IYXRBSQSSA-N	0	3	333.398	3.047	20	30		EGEDHN
C=C[C@@](C)(O)CC(=O)NC[C@H](c1ccc(Cl)cc1)N(C)CCC	ZINC000358925619	457037084	/nfs/dbraw/zinc/03/70/84/457037084.db2.gz	DUDCNYZDNJZMBP-SJLPKXTDSA-N	0	3	338.879	3.166	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc3c(C(C)C)nn(C)c3s2)CC1	ZINC000173101610	455232285	/nfs/dbraw/zinc/23/22/85/455232285.db2.gz	UTBQMVFQKOXQCQ-UHFFFAOYSA-N	0	3	346.500	3.138	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/C[C@@H](O)c2cccc(OC)c2)c([O-])c1	ZINC000264664489	455258650	/nfs/dbraw/zinc/25/86/50/455258650.db2.gz	RXBDGEGAAUCMGP-TTYLXTBDSA-N	0	3	342.439	3.400	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H](CC(C)C)c2ccccc2OC)CC1	ZINC000173582072	455310475	/nfs/dbraw/zinc/31/04/75/455310475.db2.gz	UMJKMOJQMNPXMM-LJQANCHMSA-N	0	3	342.483	3.244	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@@H]2CCn3ccnc3C2)cc1OC	ZINC000623497027	460582687	/nfs/dbraw/zinc/58/26/87/460582687.db2.gz	UJNWCLNDTRZHPT-CQSZACIVSA-N	0	3	347.846	3.215	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N1CCC[C@@](C)(C#N)C1)C(C)C	ZINC000612358102	460604459	/nfs/dbraw/zinc/60/44/59/460604459.db2.gz	PYABILOHIADFPI-HKUYNNGSSA-N	0	3	332.492	3.020	20	30		EGEDHN
C[C@]1(C#N)CCCN(C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)C1	ZINC000612364155	460606517	/nfs/dbraw/zinc/60/65/17/460606517.db2.gz	DYMJPLDBKWFJJP-YLJYHZDGSA-N	0	3	343.446	3.190	20	30		EGEDHN
CCOc1ccc(CN(C)CCC(=O)Nc2ccc(C#N)cc2)cc1	ZINC000026223101	453795104	/nfs/dbraw/zinc/79/51/04/453795104.db2.gz	QHOZJWXEAKFGQK-UHFFFAOYSA-N	0	3	337.423	3.418	20	30		EGEDHN
C[C@H](NCC(=O)N[C@@](C)(C#N)C1CC1)c1cc2ccccc2s1	ZINC000184365926	455374408	/nfs/dbraw/zinc/37/44/08/455374408.db2.gz	ITLTWXNYQJJDQP-SGTLLEGYSA-N	0	3	327.453	3.360	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/C[C@@H](O)c2ccc(OC)cc2)c([O-])c1	ZINC000032069241	453862985	/nfs/dbraw/zinc/86/29/85/453862985.db2.gz	NFJNRFXDRUZEJS-TTYLXTBDSA-N	0	3	342.439	3.400	20	30		EGEDHN
CN(C)Cc1cccc(C(=O)N[C@@H](C#N)c2ccccc2Cl)c1	ZINC000081400166	453868796	/nfs/dbraw/zinc/86/87/96/453868796.db2.gz	ZHYPAAXPKOVYCF-KRWDZBQOSA-N	0	3	327.815	3.396	20	30		EGEDHN
N#Cc1ccccc1COc1cccc(CNCCn2ccnc2)c1	ZINC000066904888	453885174	/nfs/dbraw/zinc/88/51/74/453885174.db2.gz	VTKRPSFANYJYQB-UHFFFAOYSA-N	0	3	332.407	3.124	20	30		EGEDHN
Cn1cc(CNCc2cccc(C#N)c2)c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000066971923	453891568	/nfs/dbraw/zinc/89/15/68/453891568.db2.gz	ICOYZZHNGUSFLW-UHFFFAOYSA-N	0	3	347.378	3.157	20	30		EGEDHN
C[C@@H](NCc1cc(C#N)n(C)c1)c1ccc(NC(=O)NC2CC2)cc1	ZINC000190776163	455381153	/nfs/dbraw/zinc/38/11/53/455381153.db2.gz	FPXZCENCUCJLFW-CYBMUJFWSA-N	0	3	337.427	3.031	20	30		EGEDHN
Cc1c(C(=O)C(C#N)c2cc(C)nc(C)n2)cnn1-c1ccccc1F	ZINC000041560766	453972446	/nfs/dbraw/zinc/97/24/46/453972446.db2.gz	MXGSBGWOJHNBBA-CQSZACIVSA-N	0	3	349.369	3.217	20	30		EGEDHN
CN(c1ccccc1CN1CCC[C@](C)(C#N)C1)C1CCN(C)CC1	ZINC000612406470	460621765	/nfs/dbraw/zinc/62/17/65/460621765.db2.gz	MUVWQMBEUUADRO-OAQYLSRUSA-N	0	3	340.515	3.343	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccc(F)c(Br)c2)nc(C)n1	ZINC000076822006	454040484	/nfs/dbraw/zinc/04/04/84/454040484.db2.gz	RNWOHHNJVASQSK-NSHDSACASA-N	0	3	348.175	3.485	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN(Cc1ccccc1)[C@@H](C)C1CC1	ZINC000076944504	454051984	/nfs/dbraw/zinc/05/19/84/454051984.db2.gz	BVONDDCSZAWGRY-IRXDYDNUSA-N	0	3	327.472	3.295	20	30		EGEDHN
C[C@@H]1CCCN(CCNC(=O)N[C@H](CCC#N)c2ccccc2)C1	ZINC000245978522	455409786	/nfs/dbraw/zinc/40/97/86/455409786.db2.gz	XTKBUHQRVLZEDE-SJLPKXTDSA-N	0	3	328.460	3.063	20	30		EGEDHN
CN(CCC(=O)Nc1sccc1C#N)Cc1ccc(F)c(F)c1	ZINC000044381009	454099443	/nfs/dbraw/zinc/09/94/43/454099443.db2.gz	BRYWZDBLUAXYSF-UHFFFAOYSA-N	0	3	335.379	3.359	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)cc2)CC[C@H]1NC(=O)OC(C)(C)C	ZINC000265884944	455399353	/nfs/dbraw/zinc/39/93/53/455399353.db2.gz	ZVFXLQWSSKPAIE-RHSMWYFYSA-N	0	3	329.444	3.293	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H]2CCSc3ccc(Cl)cc32)CC1	ZINC000057138723	454104683	/nfs/dbraw/zinc/10/46/83/454104683.db2.gz	VNYIQNBAIGIGMT-MRXNPFEDSA-N	0	3	348.899	3.338	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C(=O)C1CCN(Cc2ccccc2)CC1	ZINC000057155444	454107443	/nfs/dbraw/zinc/10/74/43/454107443.db2.gz	VSRCICDOWFYZNA-UHFFFAOYSA-N	0	3	347.462	3.429	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)CC1	ZINC000094123149	454187151	/nfs/dbraw/zinc/18/71/51/454187151.db2.gz	MKWBEOZWEYSOIA-UHFFFAOYSA-N	0	3	345.443	3.290	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)NCc1ccc(C#N)cc1)C(C)C	ZINC000046042611	454210567	/nfs/dbraw/zinc/21/05/67/454210567.db2.gz	IJDNGFZRNPXSNF-IBGZPJMESA-N	0	3	340.471	3.056	20	30		EGEDHN
CC[C@H](c1ccccc1)[C@@H]1CCCN1CC(=O)N[C@](C)(C#N)C1CC1	ZINC000058523992	454211880	/nfs/dbraw/zinc/21/18/80/454211880.db2.gz	DECMFDLUVBZDCK-SVFBPWRDSA-N	0	3	339.483	3.453	20	30		EGEDHN
N#Cc1ccccc1N1CCCN(CCOc2cccc(F)c2)CC1	ZINC000058580291	454216692	/nfs/dbraw/zinc/21/66/92/454216692.db2.gz	OMWFLRYUSCHOIC-UHFFFAOYSA-N	0	3	339.414	3.288	20	30		EGEDHN
N#CC(C(=O)c1cccc(OCC(F)F)n1)c1nc2ccccc2[nH]1	ZINC000089964419	454247886	/nfs/dbraw/zinc/24/78/86/454247886.db2.gz	FLPGJLNKZCTNSG-JTQLQIEISA-N	0	3	342.305	3.092	20	30		EGEDHN
C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H](C)CN1CCCCC1	ZINC000120230625	454274948	/nfs/dbraw/zinc/27/49/48/454274948.db2.gz	BGWNGOQVZHJHRS-QGZVFWFLSA-N	0	3	340.471	3.130	20	30		EGEDHN
C[C@H]1CN(CCC(=O)Nc2ccc(C#N)c(Cl)c2)C[C@H](C)S1	ZINC000072768857	454338240	/nfs/dbraw/zinc/33/82/40/454338240.db2.gz	SCMSXTUUBPRRNY-RYUDHWBXSA-N	0	3	337.876	3.366	20	30		EGEDHN
C[C@H]1C[C@H](N(C)C(=O)c2ccc(C#N)cn2)CCN1Cc1ccccc1	ZINC000132446828	454338883	/nfs/dbraw/zinc/33/88/83/454338883.db2.gz	NTXBRRILDUKMPW-QFBILLFUSA-N	0	3	348.450	3.078	20	30		EGEDHN
CC[C@@H]1CCCCN1CCNC(=O)C(C)(C)Oc1ccc(C#N)cc1	ZINC000132724924	454361535	/nfs/dbraw/zinc/36/15/35/454361535.db2.gz	GUOBRPYAGNZGPI-QGZVFWFLSA-N	0	3	343.471	3.096	20	30		EGEDHN
C[C@H](CNC(=O)c1cccc(SCC#N)c1)N1CCC(C)CC1	ZINC000079537086	454433076	/nfs/dbraw/zinc/43/30/76/454433076.db2.gz	NOGJQLDQLDWFPU-OAHLLOKOSA-N	0	3	331.485	3.152	20	30		EGEDHN
N#CCSc1cccc(C(=O)N2CCCN(C3CCCC3)CC2)c1	ZINC000079546235	454435965	/nfs/dbraw/zinc/43/59/65/454435965.db2.gz	QXZSYMIQQVQENB-UHFFFAOYSA-N	0	3	343.496	3.393	20	30		EGEDHN
COc1cc(C#N)ccc1CN1CC[C@H]2[C@H](CCCN2C2CC2)C1	ZINC000121525600	454447491	/nfs/dbraw/zinc/44/74/91/454447491.db2.gz	YCQIXDUQMXRODH-APWZRJJASA-N	0	3	325.456	3.016	20	30		EGEDHN
CCOC1CCN(Cc2ccc(OC)c(OCCCC#N)c2)CC1	ZINC000091679240	454456453	/nfs/dbraw/zinc/45/64/53/454456453.db2.gz	ZBEVFSIKSFTUCT-UHFFFAOYSA-N	0	3	332.444	3.379	20	30		EGEDHN
C[C@@H](CNC(=O)N[C@H](CCC#N)c1ccccc1)N1CCC(C)CC1	ZINC000133882838	454479228	/nfs/dbraw/zinc/47/92/28/454479228.db2.gz	NWXLYURQQGCRDC-PKOBYXMFSA-N	0	3	342.487	3.451	20	30		EGEDHN
COc1ccc(CC(=O)C(C#N)C(=O)Nc2cccc(C)c2)cc1F	ZINC000103504113	454560936	/nfs/dbraw/zinc/56/09/36/454560936.db2.gz	SDGTYBBZYBDPCP-OAHLLOKOSA-N	0	3	340.354	3.033	20	30		EGEDHN
CCC(=O)Nc1cccc(C([O-])=C(C#N)c2nc3ccccc3n2C)c1	ZINC000123001029	454590732	/nfs/dbraw/zinc/59/07/32/454590732.db2.gz	NXZCYULRABJLNY-OAHLLOKOSA-N	0	3	346.390	3.412	20	30		EGEDHN
CCC(=O)Nc1cccc(C(=O)C(C#N)c2nc3ccccc3n2C)c1	ZINC000123001029	454590739	/nfs/dbraw/zinc/59/07/39/454590739.db2.gz	NXZCYULRABJLNY-OAHLLOKOSA-N	0	3	346.390	3.412	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN[C@@H](c1ccc(F)cc1)C1CCC1	ZINC000104702982	454596630	/nfs/dbraw/zinc/59/66/30/454596630.db2.gz	ICWFJMKPAUSDTI-AUUYWEPGSA-N	0	3	331.435	3.265	20	30		EGEDHN
CC(C)c1nsc(N(CCN(C)C)Cc2ccc(C#N)cc2)n1	ZINC000092681712	454609992	/nfs/dbraw/zinc/60/99/92/454609992.db2.gz	FRWHRMPPZOGJHU-UHFFFAOYSA-N	0	3	329.473	3.101	20	30		EGEDHN
Cc1cccc(C2=CCN(C[C@@H](O)COc3ccc(C#N)cc3)CC2)c1	ZINC000092822231	454641284	/nfs/dbraw/zinc/64/12/84/454641284.db2.gz	QQNZIGBFIZSBAN-OAQYLSRUSA-N	0	3	348.446	3.396	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN(C2CC2)[C@H]2CCc3ccccc32)cc1	ZINC000065951615	454643782	/nfs/dbraw/zinc/64/37/82/454643782.db2.gz	NMVDQJGVZGHGCU-KNQAVFIVSA-N	0	3	348.446	3.450	20	30		EGEDHN
C=CCN(CCc1ccccc1)C[C@H](O)COc1ccc(F)cc1	ZINC000065959589	454645259	/nfs/dbraw/zinc/64/52/59/454645259.db2.gz	AIUBSLBNUMVLMP-IBGZPJMESA-N	0	3	329.415	3.296	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CCC[C@@H](c2nnc3n2CCC3)C1	ZINC000135231803	454650543	/nfs/dbraw/zinc/65/05/43/454650543.db2.gz	LOGMEJORMZGTCH-QGZVFWFLSA-N	0	3	349.482	3.405	20	30		EGEDHN
CC1CCN(C(=O)C2CCN(Cc3cccc(C#N)c3)CC2)CC1	ZINC000052157996	454655836	/nfs/dbraw/zinc/65/58/36/454655836.db2.gz	MUDHXUPMDXJWOQ-UHFFFAOYSA-N	0	3	325.456	3.029	20	30		EGEDHN
C=CCCOCC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000606310181	460647066	/nfs/dbraw/zinc/64/70/66/460647066.db2.gz	KYTRLLQYARRAGD-IEBWSBKVSA-N	0	3	330.472	3.091	20	30		EGEDHN
CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)c1cccc(C#N)c1	ZINC000123744789	454671919	/nfs/dbraw/zinc/67/19/19/454671919.db2.gz	GMWAMGCWRORWPT-FQEVSTJZSA-N	0	3	348.450	3.080	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Cc2c[nH]c3cc(F)ccc23)CC1	ZINC000106035488	454674422	/nfs/dbraw/zinc/67/44/22/454674422.db2.gz	UCDPFTWRMPQFDO-UHFFFAOYSA-N	0	3	329.419	3.006	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(Br)cs2)CC1	ZINC000106035636	454674616	/nfs/dbraw/zinc/67/46/16/454674616.db2.gz	HZXHWKPJCRPZFY-UHFFFAOYSA-N	0	3	343.290	3.281	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(N(CC)C(C)C)nc2)CC1	ZINC000106035469	454675117	/nfs/dbraw/zinc/67/51/17/454675117.db2.gz	NAEGKLMVCGHDGE-UHFFFAOYSA-N	0	3	344.503	3.087	20	30		EGEDHN
CN(C)[C@@H](CNc1ccc(C#N)cc1[N+](=O)[O-])c1ccc(F)cc1	ZINC000052486050	454676754	/nfs/dbraw/zinc/67/67/54/454676754.db2.gz	RYGSPTDHRMBENI-KRWDZBQOSA-N	0	3	328.347	3.320	20	30		EGEDHN
CC[C@@H](NCC(=O)NC1(C#N)CCCCC1)c1ccc(OC)cc1	ZINC000124182584	454704097	/nfs/dbraw/zinc/70/40/97/454704097.db2.gz	QRBROUWDECMMSA-QGZVFWFLSA-N	0	3	329.444	3.079	20	30		EGEDHN
C=CCN(C)C(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1	ZINC000161690687	454714312	/nfs/dbraw/zinc/71/43/12/454714312.db2.gz	UONGIGDULPVKSD-MRXNPFEDSA-N	0	3	326.362	3.085	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(Oc3ccccc3)o2)CC1	ZINC000176321677	454728696	/nfs/dbraw/zinc/72/86/96/454728696.db2.gz	IDVRMIYISSHZKH-UHFFFAOYSA-N	0	3	326.396	3.452	20	30		EGEDHN
CC(C)[C@@H](CCO)NCC(=O)Nc1ccccc1S[C@H](C)CC#N	ZINC000161852055	454729259	/nfs/dbraw/zinc/72/92/59/454729259.db2.gz	BUYUMIROCREHNG-HUUCEWRRSA-N	0	3	349.500	3.016	20	30		EGEDHN
C[C@@H](C(=O)N(CCC#N)c1ccc(F)cc1)N1C[C@H]2CCC[C@@H]2C1	ZINC000152848635	454732989	/nfs/dbraw/zinc/73/29/89/454732989.db2.gz	UYCFKZRATWTNNK-ARFHVFGLSA-N	0	3	329.419	3.193	20	30		EGEDHN
N#CCCn1cc(CN2CC[C@@]3(CCOC3)C2)c(-c2ccccc2)n1	ZINC000093820027	454738352	/nfs/dbraw/zinc/73/83/52/454738352.db2.gz	DDZXQEJFYRVUMR-HXUWFJFHSA-N	0	3	336.439	3.076	20	30		EGEDHN
C[C@H]1C[C@H](N(C)C(=O)c2ccc(C#N)[nH]2)CCN1Cc1ccccc1	ZINC000153532058	454803631	/nfs/dbraw/zinc/80/36/31/454803631.db2.gz	IALCATHTUBGMSH-MAUKXSAKSA-N	0	3	336.439	3.011	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCC[C@H](OCCC)CC2)CC1	ZINC000108575872	454804137	/nfs/dbraw/zinc/80/41/37/454804137.db2.gz	IKVNOGVOPYAMLM-SFHVURJKSA-N	0	3	337.508	3.018	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cccc(-c3nc(C)co3)c2)CC1	ZINC000177416580	454861703	/nfs/dbraw/zinc/86/17/03/454861703.db2.gz	JCILYODZCFFQIL-UHFFFAOYSA-N	0	3	340.427	3.422	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1ccccc1[N+](=O)[O-])C(C)C	ZINC000112919960	454906030	/nfs/dbraw/zinc/90/60/30/454906030.db2.gz	XJVCNRCYHOQLKE-QGZVFWFLSA-N	0	3	331.416	3.023	20	30		EGEDHN
C=CCc1cc(CNC[C@@H](c2ccco2)N(C)C)cc(OC)c1O	ZINC000113313127	454921870	/nfs/dbraw/zinc/92/18/70/454921870.db2.gz	LESWGDZISDRTNB-INIZCTEOSA-N	0	3	330.428	3.115	20	30		EGEDHN
C#CCOc1ccc(CNCc2ccc(OCCOC)cc2)cc1	ZINC000113321384	454923047	/nfs/dbraw/zinc/92/30/47/454923047.db2.gz	OHSNOPZAVGMXJI-UHFFFAOYSA-N	0	3	325.408	3.014	20	30		EGEDHN
C#CCOc1ccc(CNCc2ccnc(N3CCCCC3)c2)cc1	ZINC000113323703	454923056	/nfs/dbraw/zinc/92/30/56/454923056.db2.gz	JOTLBSCQYWBZCT-UHFFFAOYSA-N	0	3	335.451	3.374	20	30		EGEDHN
COc1cccc(C2CCN(C[C@@H](O)c3ccc(C#N)cc3)CC2)c1	ZINC000178311664	454947325	/nfs/dbraw/zinc/94/73/25/454947325.db2.gz	XCUIJASXAMAMFD-OAQYLSRUSA-N	0	3	336.435	3.480	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2occc2-c2ccc(F)cc2)CC1	ZINC000178541058	454961342	/nfs/dbraw/zinc/96/13/42/454961342.db2.gz	HJLVHDQISMIVFQ-UHFFFAOYSA-N	0	3	328.387	3.466	20	30		EGEDHN
CCS(=O)(=O)Nc1ccc([C@@H](C)NCc2cccc(C#N)c2)cc1	ZINC000151385011	454977784	/nfs/dbraw/zinc/97/77/84/454977784.db2.gz	DZRNAWJQHHRLSO-CQSZACIVSA-N	0	3	343.452	3.171	20	30		EGEDHN
Cc1c(C(=O)C(C#N)c2nc3ccccc3n2C)cnn1CC(C)C	ZINC000155509571	455010261	/nfs/dbraw/zinc/01/02/61/455010261.db2.gz	WORGPWBTQSMWFB-CQSZACIVSA-N	0	3	335.411	3.224	20	30		EGEDHN
C=CCN1CCC(NC(=O)CCn2ccc3cc(Cl)ccc32)CC1	ZINC000179344286	455036141	/nfs/dbraw/zinc/03/61/41/455036141.db2.gz	VIKFLVRUSFIAEO-UHFFFAOYSA-N	0	3	345.874	3.451	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CNC[C@H]2COC3(CCCCC3)O2)cc1	ZINC000128281479	455041870	/nfs/dbraw/zinc/04/18/70/455041870.db2.gz	LHZQKSNNGVNFCW-YJBOKZPZSA-N	0	3	330.428	3.143	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000128281053	455042082	/nfs/dbraw/zinc/04/20/82/455042082.db2.gz	LHZQKSNNGVNFCW-MAUKXSAKSA-N	0	3	330.428	3.143	20	30		EGEDHN
C[C@@H](N[C@H]1CC(=O)N(c2c(F)cccc2F)C1)c1ccc(C#N)cc1	ZINC000179798602	455080427	/nfs/dbraw/zinc/08/04/27/455080427.db2.gz	DEQDORFHVQRYOU-DOMZBBRYSA-N	0	3	341.361	3.293	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)[C@@H](C)c1c(C)noc1C)C(C)C	ZINC000156179144	455090270	/nfs/dbraw/zinc/09/02/70/455090270.db2.gz	BWZNQHQWAYVQPB-YOEHRIQHSA-N	0	3	333.476	3.210	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)CCCOc2ccccc2C)CC1	ZINC000171737121	455090624	/nfs/dbraw/zinc/09/06/24/455090624.db2.gz	METCLSSIOFMCQJ-UHFFFAOYSA-N	0	3	345.487	3.056	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@H]2CCc2ccccc2)CC1	ZINC000171740421	455091235	/nfs/dbraw/zinc/09/12/35/455091235.db2.gz	JTEQJMASZPOWOK-FQEVSTJZSA-N	0	3	341.499	3.444	20	30		EGEDHN
COc1ccc(F)cc1[C@H](C)NCCOc1ccc(C#N)cc1OC	ZINC000179958250	455106005	/nfs/dbraw/zinc/10/60/05/455106005.db2.gz	WHOLSXQFPLHBTB-ZDUSSCGKSA-N	0	3	344.386	3.444	20	30		EGEDHN
CC[C@H](NCC(=O)N[C@](C)(C#N)C(C)C)C(C)(C)c1ccccc1	ZINC000180011291	455115465	/nfs/dbraw/zinc/11/54/65/455115465.db2.gz	BKPRBGOUGMYZAA-FXAWDEMLSA-N	0	3	329.488	3.387	20	30		EGEDHN
CC[C@@H](NCC(=O)N[C@@](C)(C#N)C(C)C)C(C)(C)c1ccccc1	ZINC000180011273	455115795	/nfs/dbraw/zinc/11/57/95/455115795.db2.gz	BKPRBGOUGMYZAA-XLIONFOSSA-N	0	3	329.488	3.387	20	30		EGEDHN
C=CCC[C@@H](N[C@H]1CCN(CC(F)(F)F)C1=O)c1ccccc1	ZINC000180050489	455122537	/nfs/dbraw/zinc/12/25/37/455122537.db2.gz	YGEUWCJPMXQDDO-CABCVRRESA-N	0	3	326.362	3.447	20	30		EGEDHN
C=CC[C@@H](C)NC(=O)N(C)CCC1CCN(c2ccncc2)CC1	ZINC000180366360	455162097	/nfs/dbraw/zinc/16/20/97/455162097.db2.gz	OEZLSUJQBGSWAC-MRXNPFEDSA-N	0	3	330.476	3.294	20	30		EGEDHN
C[C@H](CNC(=O)Nc1cc(C#N)cn1C(C)(C)C)N1CCC[C@H](C)C1	ZINC000245199379	455279466	/nfs/dbraw/zinc/27/94/66/455279466.db2.gz	VVTVVHJWEGERMD-LSDHHAIUSA-N	0	3	345.491	3.357	20	30		EGEDHN
CCN1CC[C@H]2CC[C@@H](C1)N2Cc1ccc(C#N)cc1Br	ZINC000181142030	455293372	/nfs/dbraw/zinc/29/33/72/455293372.db2.gz	XYYZNYRTZQUSMT-CVEARBPZSA-N	0	3	348.288	3.379	20	30		EGEDHN
C[C@H]1CCN(C(=O)c2ccc(C#N)cc2)CCN1Cc1ccccc1	ZINC000173505060	455297312	/nfs/dbraw/zinc/29/73/12/455297312.db2.gz	QEODBSKVAVCDHB-KRWDZBQOSA-N	0	3	333.435	3.295	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1	ZINC000173507336	455297388	/nfs/dbraw/zinc/29/73/88/455297388.db2.gz	QYNODRJOMZPDCU-ZWKOTPCHSA-N	0	3	330.472	3.091	20	30		EGEDHN
C=CCOCCCC(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000173647815	455322777	/nfs/dbraw/zinc/32/27/77/455322777.db2.gz	BUQNHXPYGKJHOV-ICSRJNTNSA-N	0	3	344.499	3.481	20	30		EGEDHN
C[C@H](NCCOc1ccccc1C#N)c1cccc(N2CCCC2=O)c1	ZINC000181446540	455336062	/nfs/dbraw/zinc/33/60/62/455336062.db2.gz	PRWWNDCFWBNKAA-INIZCTEOSA-N	0	3	349.434	3.415	20	30		EGEDHN
C=C(C)CN(CC)Cc1ccc(OCC(=O)N2CCCC2)c(OC)c1	ZINC000158994191	455344002	/nfs/dbraw/zinc/34/40/02/455344002.db2.gz	YTDGBIJPGVNDOR-UHFFFAOYSA-N	0	3	346.471	3.094	20	30		EGEDHN
Cc1ccccc1[C@@H](C)N[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000190623956	455355227	/nfs/dbraw/zinc/35/52/27/455355227.db2.gz	PYXLGGFPIMCYQH-OXQOHEQNSA-N	0	3	333.435	3.318	20	30		EGEDHN
C[C@H](CN1CCC[C@@H](C)C1)NC(=O)Nc1ccccc1O[C@@H](C)C#N	ZINC000184335865	455371554	/nfs/dbraw/zinc/37/15/54/455371554.db2.gz	URWDXJCSTBUDRK-OAGGEKHMSA-N	0	3	344.459	3.219	20	30		EGEDHN
N#Cc1ccc(NC(=O)[C@@H]2CCCN(Cc3ccccc3)C2)cc1C#N	ZINC000265782415	455379808	/nfs/dbraw/zinc/37/98/08/455379808.db2.gz	MKPSJEOOAJYLFR-GOSISDBHSA-N	0	3	344.418	3.281	20	30		EGEDHN
CCCN(CC(=O)Nc1cccc(C#N)c1)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C	ZINC000265897521	455401094	/nfs/dbraw/zinc/40/10/94/455401094.db2.gz	TZFWKILBRMWJHQ-QXAKKESOSA-N	0	3	341.455	3.022	20	30		EGEDHN
CC(C)(C#N)CCC[NH+]1CCC(C(=O)Nc2ccccc2[O-])CC1	ZINC000174812472	455415434	/nfs/dbraw/zinc/41/54/34/455415434.db2.gz	HLNKONVHXQVXRX-UHFFFAOYSA-N	0	3	329.444	3.373	20	30		EGEDHN
COc1cc(NCCN[C@H](C)c2cccc(C#N)c2)cc(OC)c1	ZINC000182056856	455425960	/nfs/dbraw/zinc/42/59/60/455425960.db2.gz	RKFAYQZUYZWNRU-CQSZACIVSA-N	0	3	325.412	3.338	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN2CCC[C@@H]2C[C@@H](O)c2cccs2)cc1	ZINC000246106156	455428060	/nfs/dbraw/zinc/42/80/60/455428060.db2.gz	WYJQVVLTUPRZKW-KZNAEPCWSA-N	0	3	342.464	3.241	20	30		EGEDHN
CCc1nn(C)c(CC)c1CN[C@H](C)c1ccc(OCC#N)cc1	ZINC000182073439	455429871	/nfs/dbraw/zinc/42/98/71/455429871.db2.gz	QFQUTYZLGWWDBY-CQSZACIVSA-N	0	3	326.444	3.298	20	30		EGEDHN
CN(Cc1ccccc1)[C@H](CNC(=O)c1ccc(C#N)cc1)C1CC1	ZINC000185324840	455539878	/nfs/dbraw/zinc/53/98/78/455539878.db2.gz	LDBOBIPIRBMYGM-HXUWFJFHSA-N	0	3	333.435	3.199	20	30		EGEDHN
C[C@H]1CC/C(=C\C(=O)N(CCN(C)C)Cc2cccc(C#N)c2)C1	ZINC000267854069	455556950	/nfs/dbraw/zinc/55/69/50/455556950.db2.gz	MBTNMJGMGUCADU-YKBBIGDRSA-N	0	3	325.456	3.195	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cc(Cl)c(N)c(Cl)c2)CC1	ZINC000192309128	455590096	/nfs/dbraw/zinc/59/00/96/455590096.db2.gz	VCAJUPWLIXKUMM-UHFFFAOYSA-N	0	3	343.258	3.348	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CC[C@@H](Oc2ccc(C#N)cn2)C1	ZINC000292215757	455598427	/nfs/dbraw/zinc/59/84/27/455598427.db2.gz	ORAVFFUFEKBTBL-GOSISDBHSA-N	0	3	346.434	3.408	20	30		EGEDHN
COc1ccc(OC)c(CN(CCO)CCCCC(C)(C)C#N)c1	ZINC000277682577	455633869	/nfs/dbraw/zinc/63/38/69/455633869.db2.gz	KQABQWAOKBRSHX-UHFFFAOYSA-N	0	3	334.460	3.218	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CC(C)(C)[C@@H]2c2ccncc2)CC1	ZINC000292486755	455677336	/nfs/dbraw/zinc/67/73/36/455677336.db2.gz	BEZASZZDSRXUIL-SFHVURJKSA-N	0	3	342.487	3.215	20	30		EGEDHN
CCc1ccc([C@H](CNc2nccc(C#N)c2[N+](=O)[O-])N(C)C)cc1	ZINC000268481251	455695049	/nfs/dbraw/zinc/69/50/49/455695049.db2.gz	LLKFTQPEINRLPD-INIZCTEOSA-N	0	3	339.399	3.139	20	30		EGEDHN
COc1cc(C#N)ccc1CN[C@@H](C)[C@H]1OCCc2sccc21	ZINC000292556047	455696956	/nfs/dbraw/zinc/69/69/56/455696956.db2.gz	YYPPTZZJLLLQPW-KPZWWZAWSA-N	0	3	328.437	3.420	20	30		EGEDHN
Cn1cnc2cc(CNCCSCc3ccccc3C#N)ccc21	ZINC000271655120	455712808	/nfs/dbraw/zinc/71/28/08/455712808.db2.gz	JZWNITNTOOTNSB-UHFFFAOYSA-N	0	3	336.464	3.468	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN(C)C[C@@H](C)c1nccs1	ZINC000248440673	455715738	/nfs/dbraw/zinc/71/57/38/455715738.db2.gz	DGGRHRRJRPTYPQ-NVXWUHKLSA-N	0	3	346.496	3.347	20	30		EGEDHN
Cc1cc(C#N)ccc1CN[C@H](CN1CCOCC1)c1ccccc1	ZINC000186318427	455743021	/nfs/dbraw/zinc/74/30/21/455743021.db2.gz	BIFSKOCDHDQRSW-OAQYLSRUSA-N	0	3	335.451	3.030	20	30		EGEDHN
COC(=O)[C@@H]1CN([C@H]2CC[C@@H](C#N)C2)C[C@H]1c1ccc(Cl)cc1	ZINC000293567529	455791161	/nfs/dbraw/zinc/79/11/61/455791161.db2.gz	MROYVYXLOULZCZ-ISWURRPUSA-N	0	3	332.831	3.221	20	30		EGEDHN
C=CCOCCN(CCc1ccccn1)Cc1ccc(OC)cc1	ZINC000293952577	455801265	/nfs/dbraw/zinc/80/12/65/455801265.db2.gz	BWPUGWLIVDRSLE-UHFFFAOYSA-N	0	3	326.440	3.338	20	30		EGEDHN
Cc1cc([C@H](NCC(=O)N[C@](C)(C#N)C(C)C)C2CC2)ccc1F	ZINC000272059923	455834993	/nfs/dbraw/zinc/83/49/93/455834993.db2.gz	HPVQXFTYEWKTQD-RTBURBONSA-N	0	3	331.435	3.229	20	30		EGEDHN
C[C@@H](NCC(=O)NCc1ccc(C#N)cc1)c1cccc(C2CC2)c1	ZINC000295296429	455845266	/nfs/dbraw/zinc/84/52/66/455845266.db2.gz	FASGUFXLWFYKQX-OAHLLOKOSA-N	0	3	333.435	3.403	20	30		EGEDHN
CC[C@@H](NCCNC(=O)c1ccc(OC)cc1)c1ccc(C#N)cc1	ZINC000278900840	455852666	/nfs/dbraw/zinc/85/26/66/455852666.db2.gz	ZJBWQZKQDMJIOC-LJQANCHMSA-N	0	3	337.423	3.038	20	30		EGEDHN
CCC(C)(C)[N-]C(=S)C(C(=O)c1c(C)noc1C)[n+]1ccccc1	ZINC000186978313	455858764	/nfs/dbraw/zinc/85/87/64/455858764.db2.gz	RGUBBMATLJRZIE-UHFFFAOYSA-O	0	3	346.476	3.296	20	30		EGEDHN
C=CCN(CC=C)C(=O)Nc1ccc(CCN2CCSCC2)cc1	ZINC000194648953	455868670	/nfs/dbraw/zinc/86/86/70/455868670.db2.gz	BCSWOCUEMMAEEJ-UHFFFAOYSA-N	0	3	345.512	3.484	20	30		EGEDHN
Cc1cc(C)cc(N(CCC#N)C(=O)[C@@H](C)N(C)CCCCCO)c1	ZINC000279741633	455872013	/nfs/dbraw/zinc/87/20/13/455872013.db2.gz	OTZCUDGYLYGKLA-GOSISDBHSA-N	0	3	345.487	3.033	20	30		EGEDHN
COc1ccc(CN2CCC[C@@](C)(O)CC2)cc1OCCCC#N	ZINC000279752907	455872744	/nfs/dbraw/zinc/87/27/44/455872744.db2.gz	YWUKPRUHVVBYCB-LJQANCHMSA-N	0	3	332.444	3.115	20	30		EGEDHN
C#Cc1cccc(NC(=O)N[C@H](CN(C)C)c2ccc(OC)cc2)c1	ZINC000285619466	455882486	/nfs/dbraw/zinc/88/24/86/455882486.db2.gz	VVHSRTIMVCYOJI-LJQANCHMSA-N	0	3	337.423	3.101	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NC[C@H](c1cccs1)N1CCCC1)OCC	ZINC000270136912	455886241	/nfs/dbraw/zinc/88/62/41/455886241.db2.gz	QPBWTQKUZJCLCE-CVEARBPZSA-N	0	3	336.501	3.373	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)c1ccc(CC#N)cc1	ZINC000270381754	455943563	/nfs/dbraw/zinc/94/35/63/455943563.db2.gz	PUCXIGOWDJKCQA-UTKZUKDTSA-N	0	3	347.462	3.393	20	30		EGEDHN
C[C@H]([NH2+][C@@H]1CCCN(c2ccc(C#N)cc2)C1=O)c1ccccc1[O-]	ZINC000272553032	455992104	/nfs/dbraw/zinc/99/21/04/455992104.db2.gz	SUVMSSOUASECJW-KBXCAEBGSA-N	0	3	335.407	3.110	20	30		EGEDHN
N#Cc1ccccc1/C=C/C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000198149039	455999967	/nfs/dbraw/zinc/99/99/67/455999967.db2.gz	DSSOBMWULVZAPZ-ZHACJKMWSA-N	0	3	345.446	3.352	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000280736162	456041325	/nfs/dbraw/zinc/04/13/25/456041325.db2.gz	WJMPYXXSCNJTBF-LIRRHRJNSA-N	0	3	337.423	3.100	20	30		EGEDHN
CSCc1ccc(CNC(=O)C(C#N)Cc2ccc(C#N)cc2)cc1	ZINC000286410217	456043238	/nfs/dbraw/zinc/04/32/38/456043238.db2.gz	KHNOXSXGHNHMJC-IBGZPJMESA-N	0	3	349.459	3.420	20	30		EGEDHN
C=CCNC(=O)[C@H](C)N[C@@H](c1cccc(OC(F)(F)F)c1)C1CC1	ZINC000286746791	456053223	/nfs/dbraw/zinc/05/32/23/456053223.db2.gz	YNLCNEMJDNHSER-XHDPSFHLSA-N	0	3	342.361	3.317	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN2CC[C@@H](N3CCCC3)[C@H]2C)c1C	ZINC000286813615	456054142	/nfs/dbraw/zinc/05/41/42/456054142.db2.gz	JTOWRBLNFTUKLA-IEBWSBKVSA-N	0	3	329.488	3.032	20	30		EGEDHN
CCCN(CCN1CCCCC1)C(=O)Nc1ccc(CC#N)cc1	ZINC000287085353	456061405	/nfs/dbraw/zinc/06/14/05/456061405.db2.gz	PAXCRRSACPFFJG-UHFFFAOYSA-N	0	3	328.460	3.482	20	30		EGEDHN
N#Cc1cnc2ccc(Cl)cc2c1N1CCN(CC2CC2)CC1	ZINC000301380634	456102356	/nfs/dbraw/zinc/10/23/56/456102356.db2.gz	UCXJRUZPTCPUPP-UHFFFAOYSA-N	0	3	326.831	3.292	20	30		EGEDHN
N#Cc1c(NC2CCN(Cc3ccccc3)CC2)nc2ccccn12	ZINC000272902643	456106311	/nfs/dbraw/zinc/10/63/11/456106311.db2.gz	MFYKCEUMFMUKAN-UHFFFAOYSA-N	0	3	331.423	3.282	20	30		EGEDHN
N=C(NCc1ccc(N2CCCC2)cc1)Nc1cc(F)ccc1F	ZINC000288785047	456106409	/nfs/dbraw/zinc/10/64/09/456106409.db2.gz	WSZXAPUBDBYYHN-UHFFFAOYSA-N	0	3	330.382	3.492	20	30		EGEDHN
COc1ccc(CN2CCC(CCCO)CC2)cc1OCCCC#N	ZINC000272937404	456117856	/nfs/dbraw/zinc/11/78/56/456117856.db2.gz	LJELOEXOPCMIGD-UHFFFAOYSA-N	0	3	346.471	3.362	20	30		EGEDHN
C=C[C@@H](CO)NCc1ccc(OCc2ccc(F)cc2)c(OC)c1	ZINC000289711513	456138686	/nfs/dbraw/zinc/13/86/86/456138686.db2.gz	FBUGVHQHZMFZDR-KRWDZBQOSA-N	0	3	331.387	3.050	20	30		EGEDHN
C#C[C@@H](NC(=O)N(CC)C[C@@H]1CCN(Cc2ccccc2)C1)C(C)C	ZINC000281179264	456155218	/nfs/dbraw/zinc/15/52/18/456155218.db2.gz	YMYJWGVSOHWUFV-WOJBJXKFSA-N	0	3	341.499	3.198	20	30		EGEDHN
CCc1nnc(NC[C@@H](c2cccs2)N(C)C)c(C#N)c1CC	ZINC000301608987	456160348	/nfs/dbraw/zinc/16/03/48/456160348.db2.gz	ANSRWVMSCUMRHU-HNNXBMFYSA-N	0	3	329.473	3.249	20	30		EGEDHN
C=CCN(CCOC)C(=O)NC1CCN([C@H](C)c2ccccc2)CC1	ZINC000189027118	456203631	/nfs/dbraw/zinc/20/36/31/456203631.db2.gz	WSEPAQXBSJLZOK-QGZVFWFLSA-N	0	3	345.487	3.056	20	30		EGEDHN
CN(C)CCOc1ccc(CNc2ncc(C#N)cc2Cl)cc1	ZINC000263767137	456218143	/nfs/dbraw/zinc/21/81/43/456218143.db2.gz	JGKYSWAGYGLLCD-UHFFFAOYSA-N	0	3	330.819	3.159	20	30		EGEDHN
C[C@H](C1CCN(C)CC1)N(C)C(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000273404280	456228452	/nfs/dbraw/zinc/22/84/52/456228452.db2.gz	HIZNWFNECUUBSM-APWZRJJASA-N	0	3	342.487	3.403	20	30		EGEDHN
CC[C@@H]1CN(Cc2ccc(OC)c(OCCCC#N)c2)CCCO1	ZINC000281416489	456228595	/nfs/dbraw/zinc/22/85/95/456228595.db2.gz	YRJOJQPELZZFCW-QGZVFWFLSA-N	0	3	332.444	3.379	20	30		EGEDHN
CC1(C)CN(c2nc3ccccn3c2C#N)CCN1Cc1ccccc1	ZINC000302111109	456290158	/nfs/dbraw/zinc/29/01/58/456290158.db2.gz	UGSBVNWWGSDBCB-UHFFFAOYSA-N	0	3	345.450	3.307	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCCc2ccc(SC)cc2)CC1	ZINC000281714420	456299336	/nfs/dbraw/zinc/29/93/36/456299336.db2.gz	JACCZHCHJXSMDW-UHFFFAOYSA-N	0	3	347.528	3.291	20	30		EGEDHN
N#Cc1c(NC(=O)c2ccc(CN3CCCCC3)cc2)n[nH]c1C1CC1	ZINC000290352265	456303108	/nfs/dbraw/zinc/30/31/08/456303108.db2.gz	GBMYNLAFBQWHSS-UHFFFAOYSA-N	0	3	349.438	3.397	20	30		EGEDHN
COc1cc(CN[C@H]2CCO[C@H]2c2ccc(F)c(F)c2)ccc1C#N	ZINC000281797173	456322633	/nfs/dbraw/zinc/32/26/33/456322633.db2.gz	VAKYVFMOXMISIL-HKUYNNGSSA-N	0	3	344.361	3.465	20	30		EGEDHN
C=CCN1CC[C@H](NC(C)(C)c2ccc(Br)cc2)C1=O	ZINC000337130522	456330051	/nfs/dbraw/zinc/33/00/51/456330051.db2.gz	BYWVMOZGSOHVMP-AWEZNQCLSA-N	0	3	337.261	3.061	20	30		EGEDHN
C[C@H](C#N)CSc1ccccc1NC(=O)CN[C@@H]1CSC[C@@H]1C	ZINC000352817792	456332614	/nfs/dbraw/zinc/33/26/14/456332614.db2.gz	RSIMHWHDXNBWQD-VNHYZAJKSA-N	0	3	349.525	3.218	20	30		EGEDHN
COc1cc(CN(Cc2ccco2)C2CCN(C)CC2)ccc1C#N	ZINC000290505067	456348346	/nfs/dbraw/zinc/34/83/46/456348346.db2.gz	PJFCXFPAMLNIQO-UHFFFAOYSA-N	0	3	339.439	3.256	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000290623129	456386026	/nfs/dbraw/zinc/38/60/26/456386026.db2.gz	SGQFZVAMLLMVOW-APWZRJJASA-N	0	3	348.487	3.174	20	30		EGEDHN
COC[C@@H](NCCCC1(C#N)CCOCC1)c1ccc(F)c(F)c1	ZINC000282027861	456394475	/nfs/dbraw/zinc/39/44/75/456394475.db2.gz	PUEJCDQPDPMTIR-QGZVFWFLSA-N	0	3	338.398	3.342	20	30		EGEDHN
CC#CCCCC(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000290668188	456400814	/nfs/dbraw/zinc/40/08/14/456400814.db2.gz	UXYWAGIQGNDICE-LJQANCHMSA-N	0	3	330.472	3.386	20	30		EGEDHN
COC(=O)C[C@H](NCc1cc(C#N)ccc1OC)C1CCCCC1	ZINC000347958391	456430648	/nfs/dbraw/zinc/43/06/48/456430648.db2.gz	KOGGNAUZSKIEOT-KRWDZBQOSA-N	0	3	330.428	3.168	20	30		EGEDHN
C=CCOc1cccc(CNCc2ccc(Cn3cncn3)cc2)c1	ZINC000343155103	456439127	/nfs/dbraw/zinc/43/91/27/456439127.db2.gz	SQOJHAKPWDZEHS-UHFFFAOYSA-N	0	3	334.423	3.181	20	30		EGEDHN
C=CCN(CC(=O)NCCOc1ccccc1)CC1CCCCC1	ZINC000303434869	456460303	/nfs/dbraw/zinc/46/03/03/456460303.db2.gz	FVVRTBBWYLQRGG-UHFFFAOYSA-N	0	3	330.472	3.250	20	30		EGEDHN
N#Cc1ncn(CCNCc2ccc(-c3cccc(Cl)c3)s2)n1	ZINC000353051124	456462447	/nfs/dbraw/zinc/46/24/47/456462447.db2.gz	XMHIGCQEILTZRI-UHFFFAOYSA-N	0	3	343.843	3.321	20	30		EGEDHN
C=CCOCCCN1CCN(c2cccc3cnccc32)C[C@H]1C	ZINC000348191296	456526204	/nfs/dbraw/zinc/52/62/04/456526204.db2.gz	BQBYJXIWFHSCSC-QGZVFWFLSA-N	0	3	325.456	3.338	20	30		EGEDHN
C=CCn1c(-c2ccccc2)nnc1N1CC[C@H](N2CCCCC2)C1	ZINC000282541626	456546418	/nfs/dbraw/zinc/54/64/18/456546418.db2.gz	IBTBQWQSYSVATI-SFHVURJKSA-N	0	3	337.471	3.196	20	30		EGEDHN
C=CCOc1ccc(CN[C@H]2CC(=O)N3CCCC[C@H]23)cc1Cl	ZINC000337847761	456570312	/nfs/dbraw/zinc/57/03/12/456570312.db2.gz	IISLVBWISSZNMI-JKSUJKDBSA-N	0	3	334.847	3.148	20	30		EGEDHN
CCc1nc(C#N)cc(N2CC[C@H](C)N(Cc3ccccc3)CC2)n1	ZINC000308172532	456571983	/nfs/dbraw/zinc/57/19/83/456571983.db2.gz	UZGSVTCEFIHEJJ-INIZCTEOSA-N	0	3	335.455	3.011	20	30		EGEDHN
CN(CC(C)(C)C#N)C(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000353289861	456615773	/nfs/dbraw/zinc/61/57/73/456615773.db2.gz	PKAVMVDYRWOCCC-INIZCTEOSA-N	0	3	331.435	3.046	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1ccc2c(c1)ncn2C)C(C)C	ZINC000338059958	456657928	/nfs/dbraw/zinc/65/79/28/456657928.db2.gz	HICIWNSTYCRWDB-IBGZPJMESA-N	0	3	340.471	3.002	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CCC(N2CCc3ccccc3C2)CC1	ZINC000299332897	456659792	/nfs/dbraw/zinc/65/97/92/456659792.db2.gz	JXYVITHGYJUWPL-KRWDZBQOSA-N	0	3	342.483	3.017	20	30		EGEDHN
N#Cc1cccc(CCN[C@@H](Cc2ccccn2)c2cccnc2)c1	ZINC000343534626	456689587	/nfs/dbraw/zinc/68/95/87/456689587.db2.gz	NFFSTDCOVCGGOE-NRFANRHFSA-N	0	3	328.419	3.464	20	30		EGEDHN
CO[C@]1(C)C[C@H](N[C@@H](C)C(=O)Nc2ccc(C#N)c(Cl)c2)C1(C)C	ZINC000340821066	456702029	/nfs/dbraw/zinc/70/20/29/456702029.db2.gz	LQKFBXKGRNNGPF-GEWABHDNSA-N	0	3	349.862	3.332	20	30		EGEDHN
Cc1c(Cl)cnc(NCC2CCN(c3ccncc3)CC2)c1C#N	ZINC000343580043	456720366	/nfs/dbraw/zinc/72/03/66/456720366.db2.gz	PCUVSZDPOFXYRP-UHFFFAOYSA-N	0	3	341.846	3.061	20	30		EGEDHN
CC#CC(=O)NC[C@H](c1ccc(C(F)(F)F)cc1)N(CC)CC	ZINC000283201272	456736061	/nfs/dbraw/zinc/73/60/61/456736061.db2.gz	MUYUXOZLNOEUHZ-OAHLLOKOSA-N	0	3	326.362	3.228	20	30		EGEDHN
O=C(Nc1cccc(C(=O)N2CCCC2)c1)C1CCN(C2CC2)CC1	ZINC000328705466	456741508	/nfs/dbraw/zinc/74/15/08/456741508.db2.gz	PGWGYJAUFQTIID-UHFFFAOYSA-N	0	3	341.455	3.385	20	30		EGEDHN
Cc1ccccc1CNC(=O)[C@H](C)N[C@@H]1CCC(=O)NC12CCC2	ZINC000328718145	456743821	/nfs/dbraw/zinc/74/38/21/456743821.db2.gz	UWUILRYRTACQLD-GOEBONIOSA-N	0	3	329.444	3.471	20	30		EGEDHN
CC(C)(CNC(=O)[C@H]1CCCC(=O)N1)N1CCc2ccccc2C1	ZINC000328770643	456757251	/nfs/dbraw/zinc/75/72/51/456757251.db2.gz	COKRZTVIFPPSCP-MRXNPFEDSA-N	0	3	329.444	3.289	20	30		EGEDHN
C=CCSCCNC(=O)NC[C@@H](CC)N1CCc2ccccc2C1	ZINC000338304603	456761439	/nfs/dbraw/zinc/76/14/39/456761439.db2.gz	PGMGTMNHEABHMV-GOSISDBHSA-N	0	3	347.528	3.042	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)N1CCC(F)(C#N)CC1)c1ccccc1	ZINC000343821205	456775557	/nfs/dbraw/zinc/77/55/57/456775557.db2.gz	WDCPPCZEYZVAQM-KRWDZBQOSA-N	0	3	346.450	3.107	20	30		EGEDHN
CCN(Cc1ccc(C(=O)N(C[C@H](C)C#N)C2CC2)cc1)C1CC1	ZINC000338346587	456778999	/nfs/dbraw/zinc/77/89/99/456778999.db2.gz	FGBMBOURCAOASG-OAHLLOKOSA-N	0	3	325.456	3.435	20	30		EGEDHN
Cc1noc([C@@H]2CCCCN2C(=O)C(C#N)CCc2ccccc2)n1	ZINC000343951864	456783409	/nfs/dbraw/zinc/78/34/09/456783409.db2.gz	IMQUMJDRZSWUFQ-IRXDYDNUSA-N	0	3	338.411	3.204	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)[C@H]2CCn3cncc3C2)C1	ZINC000328907504	456787454	/nfs/dbraw/zinc/78/74/54/456787454.db2.gz	CEYFENKWSZZVAC-NJAFHUGGSA-N	0	3	338.455	3.238	20	30		EGEDHN
C=CCc1cc(CN[C@@H](C)CC(=O)OC(C)(C)C)cc(OC)c1O	ZINC000344219842	456807761	/nfs/dbraw/zinc/80/77/61/456807761.db2.gz	NFQLABYEQKWOIN-ZDUSSCGKSA-N	0	3	335.444	3.339	20	30		EGEDHN
C[C@H](OC[C@@H]1CCCCO1)C(=O)N[C@@H]1CN(C)C[C@H]1c1ccccc1	ZINC000329018561	456815683	/nfs/dbraw/zinc/81/56/83/456815683.db2.gz	LAVAAQAQAXQRNY-DSLXNQLJSA-N	0	3	346.471	3.015	20	30		EGEDHN
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H]2CC[C@@H](C)O2)cc1	ZINC000329089501	456832154	/nfs/dbraw/zinc/83/21/54/456832154.db2.gz	ILVUSZLIGMWUKE-JLSDUUJJSA-N	0	3	332.444	3.356	20	30		EGEDHN
CO[C@@H]1[C@H](C)[C@@H](NC(=O)CC2(N3CCOCC3)CCCC2)C1(C)C	ZINC000329222142	456856298	/nfs/dbraw/zinc/85/62/98/456856298.db2.gz	VWYMAXZHABQFCK-DJIMGWMZSA-N	0	3	338.492	3.038	20	30		EGEDHN
CC(C)C[C@H](C(=O)N[C@H](C)C1=CCN(C)CC1)N1CCCCC1=O	ZINC000329259857	456862910	/nfs/dbraw/zinc/86/29/10/456862910.db2.gz	AIHJMHAAZLHEDS-NVXWUHKLSA-N	0	3	335.492	3.021	20	30		EGEDHN
C[C@H](NC(=O)CC1CCCCC1)C(=O)N1CC[C@H](N2CCCCC2)C1	ZINC000329294850	456867983	/nfs/dbraw/zinc/86/79/83/456867983.db2.gz	OJFGKOIJPXGLTF-WMZOPIPTSA-N	0	3	349.519	3.389	20	30		EGEDHN
C[C@@H](NC(=O)CSc1nccn1C(C)(C)C)C1=CCN(C)CC1	ZINC000329301336	456869015	/nfs/dbraw/zinc/86/90/15/456869015.db2.gz	MXCDKENXGDCCIK-CYBMUJFWSA-N	0	3	336.505	3.337	20	30		EGEDHN
Cc1nc2ccccc2n1CCC(=O)N[C@@H]1CN(C2CC2)C[C@H]1C	ZINC000329538640	456905399	/nfs/dbraw/zinc/90/53/99/456905399.db2.gz	MMVRZCJYOABJLD-CXAGYDPISA-N	0	3	326.444	3.174	20	30		EGEDHN
C[C@@H](NCc1ccc(C[S@](C)=O)cc1)c1ccc(C#N)c(F)c1	ZINC000353813678	456919156	/nfs/dbraw/zinc/91/91/56/456919156.db2.gz	YXIUSDSGXAAHFE-ZLOXQWCVSA-N	0	3	330.428	3.427	20	30		EGEDHN
C[C@@H]1N(CC(=O)N[C@H]2CCOc3ccccc32)CCC12CCOCC2	ZINC000329658277	456922299	/nfs/dbraw/zinc/92/22/99/456922299.db2.gz	HEJUJQVAJUPDTI-RDJZCZTQSA-N	0	3	344.455	3.358	20	30		EGEDHN
COc1ccc(CN(CCN(C)C)Cc2cccc(C)c2)cc1C#N	ZINC000349311695	456938460	/nfs/dbraw/zinc/93/84/60/456938460.db2.gz	DDCSCOWGGWHRRN-UHFFFAOYSA-N	0	3	337.467	3.439	20	30		EGEDHN
O=C(NCc1cccc2cc[nH]c21)N1CC[C@@H](N2CCCCC2)C1	ZINC000329799472	456942950	/nfs/dbraw/zinc/94/29/50/456942950.db2.gz	HNKCLCAKXDULFY-QGZVFWFLSA-N	0	3	326.444	3.142	20	30		EGEDHN
C[C@H](c1ccncc1)N1CCC(NC(=O)[C@@H]2CCCOCC2)CC1	ZINC000329898213	456957358	/nfs/dbraw/zinc/95/73/58/456957358.db2.gz	LYUIMHBWPHNFPZ-NVXWUHKLSA-N	0	3	331.460	3.380	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N(CCN(C)C)Cc1ccccc1F)OCC	ZINC000339207157	456992387	/nfs/dbraw/zinc/99/23/87/456992387.db2.gz	GXSCEGOAKHQIND-GOSISDBHSA-N	0	3	336.451	3.087	20	30		EGEDHN
C[C@@H](CNC(=O)c1cn(CCCC#N)c2ccccc12)N(C)C1CC1	ZINC000345829823	456999580	/nfs/dbraw/zinc/99/95/80/456999580.db2.gz	MWFUWICYHBABSX-HNNXBMFYSA-N	0	3	338.455	3.158	20	30		EGEDHN
CC1(C)c2cc(C(=O)NC3CCN(C4CC4)CC3)ccc2NC1=O	ZINC000330271997	457018630	/nfs/dbraw/zinc/01/86/30/457018630.db2.gz	WXTAHVHFMOHIBF-UHFFFAOYSA-N	0	3	327.428	3.497	20	30		EGEDHN
C[C@@H]1C[C@H]1N1CCN(C(=O)C[C@H](CC#N)c2ccccc2)C[C@@H](C)C1	ZINC000346133254	457019673	/nfs/dbraw/zinc/01/96/73/457019673.db2.gz	AXMKCEAGQWSOES-KVPLUYHFSA-N	0	3	339.483	3.263	20	30		EGEDHN
N#Cc1cccc(OCCN(Cc2ccccc2)CC2(CO)CC2)c1	ZINC000341956019	457023848	/nfs/dbraw/zinc/02/38/48/457023848.db2.gz	AQZOOFIKYBNAQL-UHFFFAOYSA-N	0	3	336.435	3.212	20	30		EGEDHN
Cc1nc(NC(=O)CCN2CCCC[C@H]2C)sc1SCC#N	ZINC000362691956	457046529	/nfs/dbraw/zinc/04/65/29/457046529.db2.gz	JVIWRXJFLSNTLX-LLVKDONJSA-N	0	3	338.502	3.270	20	30		EGEDHN
CCCN(CC(=O)N(CC)C[C@@H](C)C#N)[C@@H]1CCc2ccccc21	ZINC000346569574	457051526	/nfs/dbraw/zinc/05/15/26/457051526.db2.gz	BOEJPSWONHZULE-QFBILLFUSA-N	0	3	327.472	3.394	20	30		EGEDHN
CC(C)CN(Cc1ccc(C#N)cc1)C(=O)CN1[C@H](C)CC[C@@H]1C	ZINC000342032759	457069749	/nfs/dbraw/zinc/06/97/49/457069749.db2.gz	AMIMWTKQGQJFDQ-CALCHBBNSA-N	0	3	327.472	3.416	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N[C@H]1CCCN(Cc2ccccc2)C1)OCC	ZINC000339374007	457073589	/nfs/dbraw/zinc/07/35/89/457073589.db2.gz	DEXGHRMOEKERHI-OALUTQOASA-N	0	3	330.472	3.139	20	30		EGEDHN
CCCCn1ncc(NC(=O)N(C)[C@@H](C)C2CCN(C)CC2)c1C	ZINC000330884158	457099387	/nfs/dbraw/zinc/09/93/87/457099387.db2.gz	KLMBGMWCYCQRDY-AWEZNQCLSA-N	0	3	335.496	3.199	20	30		EGEDHN
Cc1ccccc1CN(C[C@@H](O)COc1ccc(C#N)cc1)C1CC1	ZINC000339424395	457107911	/nfs/dbraw/zinc/10/79/11/457107911.db2.gz	ZAUNRFCOCRAJRV-HXUWFJFHSA-N	0	3	336.435	3.271	20	30		EGEDHN
COc1c(C(=O)N[C@H](C)CN2C[C@H](C)C[C@@H](C)C2)cccc1[N+](=O)[O-]	ZINC000331070490	457128373	/nfs/dbraw/zinc/12/83/73/457128373.db2.gz	SOCVJWNJVULUGZ-MGPQQGTHSA-N	0	3	349.431	3.274	20	30		EGEDHN
CC(C)(CCC#N)CNC(=O)N[C@H](CN1CCCC1)c1ccccc1	ZINC000350517997	457185244	/nfs/dbraw/zinc/18/52/44/457185244.db2.gz	KLZIIGPFMQLRHP-GOSISDBHSA-N	0	3	342.487	3.453	20	30		EGEDHN
CCCC[C@H](NCC(=O)NC1(C#N)CCC1)c1ccc(OC)cc1	ZINC000346952211	457191763	/nfs/dbraw/zinc/19/17/63/457191763.db2.gz	VXEHWPCYIIZYAJ-KRWDZBQOSA-N	0	3	329.444	3.079	20	30		EGEDHN
CC[C@H](c1ccccc1)[C@H]1CCCN1CC(=O)N(CC)CCC#N	ZINC000350634091	457195135	/nfs/dbraw/zinc/19/51/35/457195135.db2.gz	RYYFUHWCUMVNGV-RTBURBONSA-N	0	3	327.472	3.407	20	30		EGEDHN
CC(C#N)C(=O)NC[C@@H](c1ccccc1)N1CCc2sccc2C1	ZINC000347084717	457221966	/nfs/dbraw/zinc/22/19/66/457221966.db2.gz	ZLPFWSIGTZVJPQ-PBHICJAKSA-N	0	3	339.464	3.123	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN1CCCC[C@@H]1Cc1ccccc1	ZINC000339724623	457233402	/nfs/dbraw/zinc/23/34/02/457233402.db2.gz	ANRDXBLGHCJWQD-PKOBYXMFSA-N	0	3	327.472	3.092	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1CCCC[C@H]1Cc1ccccc1	ZINC000339724622	457234401	/nfs/dbraw/zinc/23/44/01/457234401.db2.gz	ANRDXBLGHCJWQD-MJGOQNOKSA-N	0	3	327.472	3.092	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CC[C@@H](c3cccc(F)c3)C2)CC1	ZINC000363393576	457309595	/nfs/dbraw/zinc/30/95/95/457309595.db2.gz	SNEJJJQTNBJRTF-QGZVFWFLSA-N	0	3	345.462	3.365	20	30		EGEDHN
C=CCCCCCN(C)[C@@H](C)C(=O)NC[C@H]1COc2ccccc2O1	ZINC000351913954	457323066	/nfs/dbraw/zinc/32/30/66/457323066.db2.gz	XOHJLNAZNTZPLL-IRXDYDNUSA-N	0	3	346.471	3.009	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CN[C@@H](c2cccs2)C2CC2)cc1	ZINC000342513969	457345120	/nfs/dbraw/zinc/34/51/20/457345120.db2.gz	RHYOWMSSXOQKCZ-MAUKXSAKSA-N	0	3	328.437	3.100	20	30		EGEDHN
N#CCSc1cccc(C(=O)NC[C@H]2CCCCN2C2CC2)c1	ZINC000347348386	457366854	/nfs/dbraw/zinc/36/68/54/457366854.db2.gz	XKZQNVZNIANBOM-MRXNPFEDSA-N	0	3	329.469	3.049	20	30		EGEDHN
CN(CC#Cc1ccc(OC(F)(F)F)cc1)CC[C@@H]1CCCO1	ZINC000342580625	457377098	/nfs/dbraw/zinc/37/70/98/457377098.db2.gz	FQHMYMYANAMTSQ-HNNXBMFYSA-N	0	3	327.346	3.438	20	30		EGEDHN
CC(C#N)C(=O)N[C@H](c1cc(F)cc(Br)c1)C1CC1	ZINC000360970380	457476668	/nfs/dbraw/zinc/47/66/68/457476668.db2.gz	KJXFFFSQOVFWOU-SDBXPKJASA-N	0	3	325.181	3.315	20	30		EGEDHN
CCC[C@@H](C)NC(=O)[C@@H]1CCCN(Cc2ccc(CC#N)cc2)C1	ZINC000342721299	457479615	/nfs/dbraw/zinc/47/96/15/457479615.db2.gz	ZFQPMSYEXYQACH-VQIMIIECSA-N	0	3	327.472	3.269	20	30		EGEDHN
CCC(C#N)(CC)C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000398187767	457496724	/nfs/dbraw/zinc/49/67/24/457496724.db2.gz	VTBOYKXFCUCOJF-FUHWJXTLSA-N	0	3	327.472	3.343	20	30		EGEDHN
N#Cc1cccc(N2CC[C@@]3(C2)CCCN(Cc2ccccc2)C3)n1	ZINC000374199661	457519153	/nfs/dbraw/zinc/51/91/53/457519153.db2.gz	KDAPPBOLWOVENW-NRFANRHFSA-N	0	3	332.451	3.446	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Nc1ccc(OC)nc1C)C(C)C	ZINC000347583822	457527237	/nfs/dbraw/zinc/52/72/37/457527237.db2.gz	BIOWMLDDGSKKMH-QGZVFWFLSA-N	0	3	346.475	3.219	20	30		EGEDHN
CCCCCCCCC(=O)N1CC[C@@H](N2CCN(C)CC2)[C@@H](C)C1	ZINC000374316849	457582028	/nfs/dbraw/zinc/58/20/28/457582028.db2.gz	JABABJDAKFWBIU-RBUKOAKNSA-N	0	3	337.552	3.221	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N1CCC[C@H](OC)CC1	ZINC000374681971	457686838	/nfs/dbraw/zinc/68/68/38/457686838.db2.gz	XQOCHXQILSTFPB-HOTGVXAUSA-N	0	3	336.501	3.152	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@H](C)N1CC[C@@H](n2ncc3ccccc32)C1	ZINC000357791501	457691910	/nfs/dbraw/zinc/69/19/10/457691910.db2.gz	AGNUWBZGMGHENI-FUHWJXTLSA-N	0	3	340.471	3.096	20	30		EGEDHN
N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)C1CCN(C2CC2)CC1	ZINC000365927859	457784204	/nfs/dbraw/zinc/78/42/04/457784204.db2.gz	BGMIFHSGFDKXPM-PMACEKPBSA-N	0	3	337.467	3.159	20	30		EGEDHN
C#CCOc1ccc(CN[C@H]2CCN(C(C)=O)c3ccccc32)cc1	ZINC000371084363	457784450	/nfs/dbraw/zinc/78/44/50/457784450.db2.gz	DBIUHAKPWPDRGL-FQEVSTJZSA-N	0	3	334.419	3.286	20	30		EGEDHN
CN1CCN(C(=O)C(C#N)CCc2ccccc2)[C@H](c2ccccc2)C1	ZINC000433231284	457785052	/nfs/dbraw/zinc/78/50/52/457785052.db2.gz	XPUIGLUFEVAETQ-SFTDATJTSA-N	0	3	347.462	3.274	20	30		EGEDHN
Cc1ccc([C@H]2COCCN2C(=O)C(C#N)CCc2ccccc2)o1	ZINC000433347062	457817458	/nfs/dbraw/zinc/81/74/58/457817458.db2.gz	KJILMIVZAHCEBE-ZWKOTPCHSA-N	0	3	338.407	3.261	20	30		EGEDHN
CN(Cc1cc(Cl)cn1C)C(=O)C(C#N)CCc1ccccc1	ZINC000433361412	457819625	/nfs/dbraw/zinc/81/96/25/457819625.db2.gz	HUTFHLHVXCJJBE-HNNXBMFYSA-N	0	3	329.831	3.409	20	30		EGEDHN
COc1ccc(CN(C)C(=O)C(C#N)CCc2ccccc2)cc1O	ZINC000433369195	457822611	/nfs/dbraw/zinc/82/26/11/457822611.db2.gz	ZWEBFXDOASAHEJ-QGZVFWFLSA-N	0	3	338.407	3.132	20	30		EGEDHN
N#CCc1ccc(C(=O)NC2CCN(Cc3ccccc3)CC2)cc1	ZINC000371203964	457825619	/nfs/dbraw/zinc/82/56/19/457825619.db2.gz	DTXHGJYKMILEPM-UHFFFAOYSA-N	0	3	333.435	3.147	20	30		EGEDHN
Cc1cc(CNCc2ccc(CN3CCCC3=O)cc2)ccc1C#N	ZINC000443978389	457832545	/nfs/dbraw/zinc/83/25/45/457832545.db2.gz	JRNPDSNEHDXDSC-UHFFFAOYSA-N	0	3	333.435	3.279	20	30		EGEDHN
COc1ccc(CNCCCCC#N)c(OCc2cccnc2)c1	ZINC000443982041	457832913	/nfs/dbraw/zinc/83/29/13/457832913.db2.gz	SUWTYRWQPJYRKE-UHFFFAOYSA-N	0	3	325.412	3.453	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(OC)c(C(C)C)c(OC)c2)CC1	ZINC000358179857	457840697	/nfs/dbraw/zinc/84/06/97/457840697.db2.gz	IJYNPAMMUUGYOG-UHFFFAOYSA-N	0	3	346.471	3.207	20	30		EGEDHN
CCCN(CC(F)(F)F)C(=O)[C@H]1CCCN([C@@H](C)CCC#N)C1	ZINC000411287813	457850174	/nfs/dbraw/zinc/85/01/74/457850174.db2.gz	BGMTWSGMMKAYEP-KBPBESRZSA-N	0	3	333.398	3.192	20	30		EGEDHN
C=CCOc1cccnc1C(=O)Nc1ccc(CN(C)C)c(C)c1	ZINC000458260369	457990886	/nfs/dbraw/zinc/99/08/86/457990886.db2.gz	HUXJQWARZNKWCU-UHFFFAOYSA-N	0	3	325.412	3.269	20	30		EGEDHN
C=CCN1CC[C@@H](N[C@@H](c2ccccc2)C2(CO)CCCCC2)C1=O	ZINC000412004155	458041552	/nfs/dbraw/zinc/04/15/52/458041552.db2.gz	BRFCADTWHGQSSO-MOPGFXCFSA-N	0	3	342.483	3.047	20	30		EGEDHN
C=C(C)COc1cccc(NC(=O)NC[C@@]2(N(C)C)CCSC2)c1	ZINC000362224561	458042374	/nfs/dbraw/zinc/04/23/74/458042374.db2.gz	VITMETJNRIFHKS-SFHVURJKSA-N	0	3	349.500	3.200	20	30		EGEDHN
C=CCC[C@H](N[C@@H]1CCN(c2ccccc2C(N)=O)C1)c1ccco1	ZINC000375789149	458065300	/nfs/dbraw/zinc/06/53/00/458065300.db2.gz	KJARUKQBQDATKQ-WBVHZDCISA-N	0	3	339.439	3.254	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)NCC(C)(C)CC#N)CCN1Cc1ccccc1	ZINC000458513563	458077301	/nfs/dbraw/zinc/07/73/01/458077301.db2.gz	YTYNIMPBKQKORP-SJLPKXTDSA-N	0	3	342.487	3.279	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)NCC(C)(C)CC#N	ZINC000458520933	458079002	/nfs/dbraw/zinc/07/90/02/458079002.db2.gz	WYEXZYADAZVMER-SJLPKXTDSA-N	0	3	342.487	3.136	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)N(C)CC(C)(C)C#N	ZINC000458523570	458080976	/nfs/dbraw/zinc/08/09/76/458080976.db2.gz	YSTSOUCSMUCIAA-WMZOPIPTSA-N	0	3	342.487	3.088	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Cc1ccc(F)cc1F)C(C)C	ZINC000446114974	458150217	/nfs/dbraw/zinc/15/02/17/458150217.db2.gz	XZZHIXTVMYSQID-SFHVURJKSA-N	0	3	336.426	3.322	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)C1(C2CC2)CCOCC1)C(C)C	ZINC000372002429	458157228	/nfs/dbraw/zinc/15/72/28/458157228.db2.gz	GYPKMVHOCSIXCP-SFHVURJKSA-N	0	3	334.504	3.008	20	30		EGEDHN
CC(C)Oc1ccc(NC(=O)NCCN2CCCCCC2)cc1C#N	ZINC000435547743	458161231	/nfs/dbraw/zinc/16/12/31/458161231.db2.gz	JKFQUTOAYOUXMF-UHFFFAOYSA-N	0	3	344.459	3.343	20	30		EGEDHN
Cc1ccccc1[C@@H]([C@H](C)NC(=O)N(C)CC(C)(C)C#N)N(C)C	ZINC000458765053	458163486	/nfs/dbraw/zinc/16/34/86/458163486.db2.gz	JTAUKWRGZJPBJQ-DOTOQJQBSA-N	0	3	330.476	3.177	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN(C)[C@@H]1C[C@@](C)(OC)C1(C)C	ZINC000362439865	458177165	/nfs/dbraw/zinc/17/71/65/458177165.db2.gz	PUMXXSJXVMNMDI-IEBWSBKVSA-N	0	3	332.444	3.081	20	30		EGEDHN
C[C@H]1CCN(C)CCN1C(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000458809056	458179587	/nfs/dbraw/zinc/17/95/87/458179587.db2.gz	ZUIDYDDTSUFROT-WMZOPIPTSA-N	0	3	328.460	3.157	20	30		EGEDHN
CSc1ccc([C@H](CNC(=O)NCC(C)(C)CC#N)N(C)C)cc1	ZINC000458879001	458203049	/nfs/dbraw/zinc/20/30/49/458203049.db2.gz	BZZNSCAYWNNZAO-INIZCTEOSA-N	0	3	348.516	3.250	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NC(=O)N1CCC[C@@H]2CN(C)CC[C@H]21	ZINC000413824180	458308721	/nfs/dbraw/zinc/30/87/21/458308721.db2.gz	CATCXLLWOVOKOS-VAMGGRTRSA-N	0	3	341.499	3.300	20	30		EGEDHN
CC[C@H](NCC(=O)N[C@@H]1CCOc2ccccc21)c1ccc(C#N)cc1	ZINC000376573176	458341928	/nfs/dbraw/zinc/34/19/28/458341928.db2.gz	VCZYNJVRHYJBKC-RBUKOAKNSA-N	0	3	349.434	3.239	20	30		EGEDHN
N#Cc1ccc(N2CCC(N[C@@H]3COCc4ccccc43)CC2)cc1	ZINC000417372105	458362696	/nfs/dbraw/zinc/36/26/96/458362696.db2.gz	WNFXMCLVFMEZOE-OAQYLSRUSA-N	0	3	333.435	3.388	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)N[C@H]1CCN2CCCC[C@@H]12	ZINC000429871931	458378902	/nfs/dbraw/zinc/37/89/02/458378902.db2.gz	WKIYUYAAEBRVTC-HOTGVXAUSA-N	0	3	339.464	3.438	20	30		EGEDHN
N#C[C@@H]1CCC[C@@H](N[C@H](CO)c2ccc(Br)c(F)c2)C1	ZINC000430114434	458403089	/nfs/dbraw/zinc/40/30/89/458403089.db2.gz	CMRRPFAKCJIRDU-IXPVHAAZSA-N	0	3	341.224	3.294	20	30		EGEDHN
COc1ccc(NC(=O)C[C@H](C)NCc2ccc(C#N)s2)cc1	ZINC000421347859	458411505	/nfs/dbraw/zinc/41/15/05/458411505.db2.gz	DLXLADYATXCQFM-LBPRGKRZSA-N	0	3	329.425	3.135	20	30		EGEDHN
COc1cc(OC)c(CCNCc2ccc(C#N)c(F)c2)c(OC)c1	ZINC000421360651	458412103	/nfs/dbraw/zinc/41/21/03/458412103.db2.gz	FGGRTJFAHJIKDM-UHFFFAOYSA-N	0	3	344.386	3.055	20	30		EGEDHN
C[C@@H](O)[C@](C)(CNCc1ccc(C#N)c(F)c1)Cc1ccccc1	ZINC000421402730	458413158	/nfs/dbraw/zinc/41/31/58/458413158.db2.gz	WMZJIDAHZPEJSC-QRWLVFNGSA-N	0	3	326.415	3.417	20	30		EGEDHN
C[C@H](O)[C@@](C)(CNCc1ccc(C#N)c(F)c1)Cc1ccccc1	ZINC000421402729	458413301	/nfs/dbraw/zinc/41/33/01/458413301.db2.gz	WMZJIDAHZPEJSC-MGPUTAFESA-N	0	3	326.415	3.417	20	30		EGEDHN
CC(C)(CC#N)CNCc1ccc(I)cc1	ZINC000459737121	458463764	/nfs/dbraw/zinc/46/37/64/458463764.db2.gz	VRIWEAMNRVQJCC-UHFFFAOYSA-N	0	3	328.197	3.321	20	30		EGEDHN
COc1ccc(CNCc2ccnc(C)c2)cc1OCCCC#N	ZINC000449404075	458423785	/nfs/dbraw/zinc/42/37/85/458423785.db2.gz	TYWWSSHNNSFJSD-UHFFFAOYSA-N	0	3	325.412	3.371	20	30		EGEDHN
COc1cccc(NC(=O)C[C@@H](C)NCc2ccc(C#N)c(F)c2)c1	ZINC000449734289	458429712	/nfs/dbraw/zinc/42/97/12/458429712.db2.gz	BCMVZQVMBFVWJN-CYBMUJFWSA-N	0	3	341.386	3.213	20	30		EGEDHN
CO[C@@H]1C[C@@H](NCc2cc(C#N)ccc2Br)C12CCC2	ZINC000459768662	458472708	/nfs/dbraw/zinc/47/27/08/458472708.db2.gz	QNLKIOKIIAUUKX-HUUCEWRRSA-N	0	3	335.245	3.368	20	30		EGEDHN
CN(CCOc1cccc(C#N)c1)[C@@H](CO)c1ccc(Cl)cc1	ZINC000451324663	458473999	/nfs/dbraw/zinc/47/39/99/458473999.db2.gz	LOYCXCXEGRVCFP-SFHVURJKSA-N	0	3	330.815	3.256	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCc1cc(Br)cc2cccnc21	ZINC000451608667	458483207	/nfs/dbraw/zinc/48/32/07/458483207.db2.gz	SYQUETYABXTSQI-CABCVRRESA-N	0	3	333.229	3.430	20	30		EGEDHN
CCO[C@@H]1CCCC[C@H]1N[C@H](C)C(=O)N(CCC#N)c1ccccc1	ZINC000452037404	458493697	/nfs/dbraw/zinc/49/36/97/458493697.db2.gz	ULQWLSQMQSHDMU-BHIYHBOVSA-N	0	3	343.471	3.259	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CN1C(=O)N(C)C2(CCCCC2)C1=O)C(C)C	ZINC000430902185	458503051	/nfs/dbraw/zinc/50/30/51/458503051.db2.gz	XJSGMUFFYPAQAB-KRWDZBQOSA-N	0	3	347.503	3.282	20	30		EGEDHN
C=CCC[C@@H](CO)N[C@@H]1CCc2c1cc(Br)cc2F	ZINC000453365295	458525137	/nfs/dbraw/zinc/52/51/37/458525137.db2.gz	RKCWYVOENBQPOJ-XHDPSFHLSA-N	0	3	328.225	3.492	20	30		EGEDHN
C=CCn1c(-c2ccccc2F)nnc1N1CCCN(C(C)C)CC1	ZINC000453424410	458527288	/nfs/dbraw/zinc/52/72/88/458527288.db2.gz	JGOYDCAVPRIYGP-UHFFFAOYSA-N	0	3	343.450	3.191	20	30		EGEDHN
C=C(C)Cn1c(C)nnc1N1CCN(Cc2ccccc2)C[C@@H](C)C1	ZINC000453455567	458531665	/nfs/dbraw/zinc/53/16/65/458531665.db2.gz	SSQYIQBSJSMQNQ-QGZVFWFLSA-N	0	3	339.487	3.121	20	30		EGEDHN
Cc1ccccc1C1(CNC(=O)[C@@H](N)CCCC#N)CCCCC1	ZINC000424109662	458560835	/nfs/dbraw/zinc/56/08/35/458560835.db2.gz	AURIRHFOLYPZEE-SFHVURJKSA-N	0	3	327.472	3.334	20	30		EGEDHN
C[C@@H](NC(=O)[C@H](N)CCCC#N)c1nc(-c2ccccc2)cs1	ZINC000424137491	458568213	/nfs/dbraw/zinc/56/82/13/458568213.db2.gz	LVZCXKVQQYOZCX-TZMCWYRMSA-N	0	3	328.441	3.008	20	30		EGEDHN
Cc1cc(N2CCCC[C@@H]2C)ccc1NC(=O)[C@H](N)CCCC#N	ZINC000424150261	458571744	/nfs/dbraw/zinc/57/17/44/458571744.db2.gz	YNERAKUZTLWKFR-DOTOQJQBSA-N	0	3	328.460	3.334	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cn(C)c3ccc(F)cc23)CC1	ZINC000431640389	458599559	/nfs/dbraw/zinc/59/95/59/458599559.db2.gz	QANGDBACRFNKNB-UHFFFAOYSA-N	0	3	329.419	3.088	20	30		EGEDHN
CC(C)(Cc1ccc(C#N)cc1)C(=O)N1CCC[C@H](N2CCCC2)C1	ZINC000455515949	458602621	/nfs/dbraw/zinc/60/26/21/458602621.db2.gz	GZGLBIGLBKYGAA-IBGZPJMESA-N	0	3	339.483	3.214	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cc(OC)c(C)c(OC)c2)CC1	ZINC000455575410	458604483	/nfs/dbraw/zinc/60/44/83/458604483.db2.gz	JLNSGRBGIACHTJ-UHFFFAOYSA-N	0	3	347.459	3.174	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCN(Cc2ccccc2)C[C@@H](C)C1	ZINC000456351419	458641383	/nfs/dbraw/zinc/64/13/83/458641383.db2.gz	WXGIQICGUKQZSX-GOSISDBHSA-N	0	3	337.467	3.268	20	30		EGEDHN
CC1(C)[C@H](O)C[C@@H]1NCc1cccc(OCc2ccccc2C#N)c1	ZINC000494429285	458675009	/nfs/dbraw/zinc/67/50/09/458675009.db2.gz	WSKYDZDNULOXAP-VQTJNVASSA-N	0	3	336.435	3.386	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCC2C3CC4CC(C3)CC2C4)cc1	ZINC000471090829	458679807	/nfs/dbraw/zinc/67/98/07/458679807.db2.gz	NANIBPVCBZRBEA-OPFHRDBUSA-N	0	3	347.462	3.429	20	30		EGEDHN
C=CCCCCNC(=O)NC[C@H](c1ccc(OC)cc1)N1CCCC1	ZINC000471444359	458694908	/nfs/dbraw/zinc/69/49/08/458694908.db2.gz	QJLQPSFGRJTWMW-LJQANCHMSA-N	0	3	345.487	3.488	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)NCC(C)(C)N1CCCCC1	ZINC000463494782	458705362	/nfs/dbraw/zinc/70/53/62/458705362.db2.gz	AYWFNGLDUJCSOG-UHFFFAOYSA-N	0	3	346.471	3.254	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)NCc1ccc(F)cc1)C(C)C	ZINC000503433201	458708463	/nfs/dbraw/zinc/70/84/63/458708463.db2.gz	BJRBJTHIGBGVLN-SFHVURJKSA-N	0	3	333.451	3.324	20	30		EGEDHN
CO[C@@H]1C[C@H](N(C)C(=O)C(C#N)CCc2ccccc2)C12CCC2	ZINC000456590936	458722703	/nfs/dbraw/zinc/72/27/03/458722703.db2.gz	QAQJUVDNGGMPPZ-FGTMMUONSA-N	0	3	326.440	3.175	20	30		EGEDHN
C=C(CNC(=O)N1CCC[C@@H]1CN1CCCCC1)c1ccccc1	ZINC000512668507	458786932	/nfs/dbraw/zinc/78/69/32/458786932.db2.gz	VJQILQNAOKJMGD-LJQANCHMSA-N	0	3	327.472	3.360	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN1CCC[C@H]1Cc1cccc(OC)c1	ZINC000515502703	458810745	/nfs/dbraw/zinc/81/07/45/458810745.db2.gz	JNZCRJDRZVSYSY-SFHVURJKSA-N	0	3	330.472	3.127	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)NCC(C)(C)N1CCCCC1	ZINC000517711464	458831090	/nfs/dbraw/zinc/83/10/90/458831090.db2.gz	KTTDXKIHYMPWMZ-UHFFFAOYSA-N	0	3	345.487	3.315	20	30		EGEDHN
Cc1cc(C#N)cc(NC(=O)N2CCN(C3CCC3)C[C@@H](C)C2)c1	ZINC000518705720	458885956	/nfs/dbraw/zinc/88/59/56/458885956.db2.gz	OJEHRLPCVBHJST-OAHLLOKOSA-N	0	3	326.444	3.205	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1	ZINC000551465000	458889159	/nfs/dbraw/zinc/88/91/59/458889159.db2.gz	RKTNDUSBMOWVQA-IAGOWNOFSA-N	0	3	336.520	3.327	20	30		EGEDHN
Cc1ccc2c(c1)CC[C@H]2NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000552226880	458891015	/nfs/dbraw/zinc/89/10/15/458891015.db2.gz	RMSDZFASQXLUJK-GHTZIAJQSA-N	0	3	336.435	3.078	20	30		EGEDHN
N#C[C@@H]1CC[C@@H](N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)C1	ZINC000495592094	458891173	/nfs/dbraw/zinc/89/11/73/458891173.db2.gz	HTHDLXRXTJUFHS-GUDVDZBRSA-N	0	3	341.455	3.317	20	30		EGEDHN
Cc1cc(C)cc([C@H](C)NC[C@H](O)COc2ccc(CC#N)cc2)c1	ZINC000553300620	458894579	/nfs/dbraw/zinc/89/45/79/458894579.db2.gz	UQIKVNOVLFIDBO-PXNSSMCTSA-N	0	3	338.451	3.460	20	30		EGEDHN
CC1CC(C#N)(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)C1	ZINC000531569177	458937626	/nfs/dbraw/zinc/93/76/26/458937626.db2.gz	UOVSDVFVADWABF-XBPCWFMRSA-N	0	3	339.483	3.438	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)CN(C[C@H]1CCCO1)C1CCC(C)CC1	ZINC000441469148	458949621	/nfs/dbraw/zinc/94/96/21/458949621.db2.gz	XCPJCVPNYNYDOP-ZZVGESKWSA-N	0	3	349.519	3.101	20	30		EGEDHN
C[C@@H](C1CC1)N(Cc1ccccc1)Cc1cnc2c(C#N)cnn2c1	ZINC000576943701	458952417	/nfs/dbraw/zinc/95/24/17/458952417.db2.gz	SRPMPPDEDKHFFK-HNNXBMFYSA-N	0	3	331.423	3.402	20	30		EGEDHN
C=C(CC)CNC(=O)NC[C@H](c1cccc(OC)c1)N1CCCC1	ZINC000457483178	458973204	/nfs/dbraw/zinc/97/32/04/458973204.db2.gz	LWRNCDTYBGUEEI-GOSISDBHSA-N	0	3	331.460	3.098	20	30		EGEDHN
CC(C)(C)OC(=O)N1C[C@@H]2C[C@]2(CNCc2ccc(C#N)c(F)c2)C1	ZINC000495863757	458982262	/nfs/dbraw/zinc/98/22/62/458982262.db2.gz	FHZWEXUFIXHJBI-KXBFYZLASA-N	0	3	345.418	3.044	20	30		EGEDHN
C=C(C)CN1CCC(Nc2ccc([N+](=O)[O-])c(C(=O)OCC)c2)CC1	ZINC000467791383	458987155	/nfs/dbraw/zinc/98/71/55/458987155.db2.gz	ZOBASLMSNHWJLK-UHFFFAOYSA-N	0	3	347.415	3.224	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@H]1CC[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC000495916290	459005410	/nfs/dbraw/zinc/00/54/10/459005410.db2.gz	VAEJZGYJNOCJGH-GDBMZVCRSA-N	0	3	347.434	3.480	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC[C@@H](C(F)(F)F)C2(C)C)CC1	ZINC000468327713	459015065	/nfs/dbraw/zinc/01/50/65/459015065.db2.gz	RTJUHFVQAGOFKB-CYBMUJFWSA-N	0	3	333.398	3.009	20	30		EGEDHN
N#CCCn1cc(CN2CCC(C3CC3)CC2)c(-c2ccncc2)n1	ZINC000590053078	459073333	/nfs/dbraw/zinc/07/33/33/459073333.db2.gz	WSDGEZQNRDYRJD-UHFFFAOYSA-N	0	3	335.455	3.481	20	30		EGEDHN
CC[C@@H]1CCCC[C@@H]1CNCCS(=O)(=O)c1ccc(C#N)cc1	ZINC000577860303	459108768	/nfs/dbraw/zinc/10/87/68/459108768.db2.gz	WCLGGJQMMLUFIR-IAGOWNOFSA-N	0	3	334.485	3.138	20	30		EGEDHN
C=C(C)[C@@H](NC(=O)NCCN1CCCCC1)c1ccc(F)c(F)c1	ZINC000478831940	459111810	/nfs/dbraw/zinc/11/18/10/459111810.db2.gz	CPZQCQMUJMUXHB-QGZVFWFLSA-N	0	3	337.414	3.367	20	30		EGEDHN
CN1CC[C@@]2(CCN(C(=O)c3c(Cl)cc(C#N)cc3Cl)C2)C1	ZINC000590456380	459132942	/nfs/dbraw/zinc/13/29/42/459132942.db2.gz	CCVYQNCKDJRMTN-MRXNPFEDSA-N	0	3	338.238	3.033	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@@H](C#N)CCC#N)C1	ZINC000496276134	459133510	/nfs/dbraw/zinc/13/35/10/459133510.db2.gz	QLVRVGYORLXCQY-QAPCUYQASA-N	0	3	334.464	3.057	20	30		EGEDHN
CC(C)CC(CC(C)C)NCCS(=O)(=O)c1ccc(C#N)cc1	ZINC000567679034	459143918	/nfs/dbraw/zinc/14/39/18/459143918.db2.gz	ISRPWALCZBXKTH-UHFFFAOYSA-N	0	3	336.501	3.382	20	30		EGEDHN
CCCOC1(CNCc2cnc3ccc(C#N)cn23)CCCCC1	ZINC000558417639	459156379	/nfs/dbraw/zinc/15/63/79/459156379.db2.gz	GPMHFFWJTGVOLW-UHFFFAOYSA-N	0	3	326.444	3.425	20	30		EGEDHN
N#Cc1ccc(CNCc2ccc(O[C@@H]3CCOC3)cc2)cc1F	ZINC000594955451	459192654	/nfs/dbraw/zinc/19/26/54/459192654.db2.gz	KUENRWIUMGDXIO-GOSISDBHSA-N	0	3	326.371	3.155	20	30		EGEDHN
CO[C@@](C)(CNCc1ccc(C#N)s1)COCc1ccccc1	ZINC000594975842	459203032	/nfs/dbraw/zinc/20/30/32/459203032.db2.gz	VQGAYNLUERWGOU-SFHVURJKSA-N	0	3	330.453	3.331	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N1CCC[C@@H]1C(F)F)C(C)C	ZINC000480544038	459203824	/nfs/dbraw/zinc/20/38/24/459203824.db2.gz	UGXAJBLKIDSVRY-CABCVRRESA-N	0	3	329.435	3.124	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2	ZINC000558734139	459206402	/nfs/dbraw/zinc/20/64/02/459206402.db2.gz	NFZMMMQXKTZBAL-RSPOEFSDSA-N	0	3	339.483	3.405	20	30		EGEDHN
CNC(=O)CC1(CN[C@H](C)c2ccc(C#N)cc2F)CCCCC1	ZINC000595099225	459244358	/nfs/dbraw/zinc/24/43/58/459244358.db2.gz	FVNRHXUHBHLWJS-CQSZACIVSA-N	0	3	331.435	3.435	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)[C@@H]1C[C@@H]2CCCC[C@@H]2NC1=O	ZINC000595290917	459268132	/nfs/dbraw/zinc/26/81/32/459268132.db2.gz	NODSVYFEMOUOQK-GBESFXJTSA-N	0	3	325.456	3.218	20	30		EGEDHN
C[C@H]1CCN(C(=O)Nc2cccc(C#N)n2)CCN1Cc1ccccc1	ZINC000568509045	459299038	/nfs/dbraw/zinc/29/90/38/459299038.db2.gz	YBCNVNVSYXFQOC-INIZCTEOSA-N	0	3	349.438	3.082	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H](N[C@H]2CCc3ccc(C#N)cc32)C1	ZINC000496776787	459319679	/nfs/dbraw/zinc/31/96/79/459319679.db2.gz	KNFVSBILSVAZMB-RDJZCZTQSA-N	0	3	327.428	3.145	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN(CC)[C@@H](C)CC)cc1	ZINC000595593495	459358289	/nfs/dbraw/zinc/35/82/89/459358289.db2.gz	QOYAKWPQTGSDQW-INIZCTEOSA-N	0	3	331.460	3.452	20	30		EGEDHN
C=CCN1CC[C@H](S[C@H]2CCCN(Cc3ccccc3)C2)C1=O	ZINC000568882798	459361063	/nfs/dbraw/zinc/36/10/63/459361063.db2.gz	DJPDNOLYXKKIDD-ROUUACIJSA-N	0	3	330.497	3.171	20	30		EGEDHN
N#Cc1ccccc1OCCN1CCCN2c3ccccc3C[C@H]2C1	ZINC000568935148	459368574	/nfs/dbraw/zinc/36/85/74/459368574.db2.gz	IZTGNNGNEXQQFH-IBGZPJMESA-N	0	3	333.435	3.074	20	30		EGEDHN
N#CC[C@H]1CCCN(C[C@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000595621529	459373999	/nfs/dbraw/zinc/37/39/99/459373999.db2.gz	WBRGQNXUDMQVDL-GDBMZVCRSA-N	0	3	326.362	3.234	20	30		EGEDHN
Cc1ccc2c(c1)CN(CCC(=O)Nc1sccc1C#N)CC2	ZINC000595657501	459385515	/nfs/dbraw/zinc/38/55/15/459385515.db2.gz	LCKUJEAQMILOOR-UHFFFAOYSA-N	0	3	325.437	3.315	20	30		EGEDHN
C[C@@H]1CCN(CCNC(=O)c2ccc(C#Cc3ccccc3)cc2)C1	ZINC000524776269	459393217	/nfs/dbraw/zinc/39/32/17/459393217.db2.gz	MKADVHFXXMBDLS-GOSISDBHSA-N	0	3	332.447	3.158	20	30		EGEDHN
CN(C)C[C@H](CNC(=O)c1ccc(C#N)cc1)c1ccc(Cl)cc1	ZINC000569131729	459403290	/nfs/dbraw/zinc/40/32/90/459403290.db2.gz	ODKOIQRRZJENCH-KRWDZBQOSA-N	0	3	341.842	3.287	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2NC(=O)[C@@H]1CCCN1C1CCCC1	ZINC000561089205	459418379	/nfs/dbraw/zinc/41/83/79/459418379.db2.gz	AACBVRGTXSHSKK-UXHICEINSA-N	0	3	337.467	3.459	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Nc1ccnn1C(C)(C)C)C(C)C	ZINC000484749271	459429123	/nfs/dbraw/zinc/42/91/23/459429123.db2.gz	HPDXHANRHSPLCT-MRXNPFEDSA-N	0	3	347.507	3.458	20	30		EGEDHN
CCCN1CC[C@H](NC(=O)N(Cc2ccc(C#N)cc2)CC(C)C)C1	ZINC000595808100	459448436	/nfs/dbraw/zinc/44/84/36/459448436.db2.gz	SPQCLJWXXFLHEV-IBGZPJMESA-N	0	3	342.487	3.210	20	30		EGEDHN
N#CCC1CCN(C(=O)c2ccc(CN3CCCCC3)cc2)CC1	ZINC000582924710	459451740	/nfs/dbraw/zinc/45/17/40/459451740.db2.gz	QPULJIZXQIDRGU-UHFFFAOYSA-N	0	3	325.456	3.438	20	30		EGEDHN
C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NCc1cccc(C#N)c1F	ZINC000497172715	459472916	/nfs/dbraw/zinc/47/29/16/459472916.db2.gz	NLGIVBIBPSXEST-CZUORRHYSA-N	0	3	347.434	3.432	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)NCC(C)(C)c1ccc(OC)cc1	ZINC000561881358	459489544	/nfs/dbraw/zinc/48/95/44/459489544.db2.gz	AOJWVXDULIXLGF-INIZCTEOSA-N	0	3	330.472	3.152	20	30		EGEDHN
N#CCC1CCN(CCC(=O)Nc2sc3c(c2C#N)CCC3)CC1	ZINC000541952281	459513988	/nfs/dbraw/zinc/51/39/88/459513988.db2.gz	PJYRVKBZJLPONX-UHFFFAOYSA-N	0	3	342.468	3.063	20	30		EGEDHN
Cc1ccccc1CN1CCC(Nc2nc(C#N)c(Cl)s2)CC1	ZINC000596082890	459514041	/nfs/dbraw/zinc/51/40/41/459514041.db2.gz	PBWFJSUAPGEDRZ-UHFFFAOYSA-N	0	3	346.887	3.475	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2c(C)nn(C(C)(C)C)c2C)CC1	ZINC000592075789	459521118	/nfs/dbraw/zinc/52/11/18/459521118.db2.gz	TYZCQVYBCWTNSW-UHFFFAOYSA-N	0	3	332.492	3.025	20	30		EGEDHN
C=CCCCCCN1CCN(c2ccc(C(=O)OCC)cn2)CC1	ZINC000486808256	459523373	/nfs/dbraw/zinc/52/33/73/459523373.db2.gz	BECXYQFPQKGMQL-UHFFFAOYSA-N	0	3	331.460	3.127	20	30		EGEDHN
Cc1ccccc1C1(NC[C@H](O)COc2ccc(CC#N)cc2)CC1	ZINC000592139861	459534495	/nfs/dbraw/zinc/53/44/95/459534495.db2.gz	KWUQNRMNWOUENS-SFHVURJKSA-N	0	3	336.435	3.080	20	30		EGEDHN
Cc1cc(CN2CC[C@@H](C(=O)NCc3ccccc3)C2)ccc1C#N	ZINC000592156288	459539553	/nfs/dbraw/zinc/53/95/53/459539553.db2.gz	WZYONLUQZSSVTC-HXUWFJFHSA-N	0	3	333.435	3.005	20	30		EGEDHN
C=CCCCCCN1CCC[C@@H](S(=O)(=O)NC2CCCC2)C1	ZINC000488323826	459541983	/nfs/dbraw/zinc/54/19/83/459541983.db2.gz	RHYHUMXZRYWONL-QGZVFWFLSA-N	0	3	328.522	3.059	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCN(Cc3ccnc4ccccc34)C2)nc1	ZINC000562386496	459551796	/nfs/dbraw/zinc/55/17/96/459551796.db2.gz	WXRMQBYILZSYEE-QGZVFWFLSA-N	0	3	330.391	3.155	20	30		EGEDHN
Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2N[C@@H]2CC[C@H](C#N)C2)cc1	ZINC000570624922	459558593	/nfs/dbraw/zinc/55/85/93/459558593.db2.gz	WAFMLCQRVKETBS-QFHJOOASSA-N	0	3	346.496	3.362	20	30		EGEDHN
C=C[C@H]1CCCCN1CCC(=O)Nc1ccc(N2CCCC2=O)cc1	ZINC000489433598	459563783	/nfs/dbraw/zinc/56/37/83/459563783.db2.gz	SAPFWGABPVSWFB-KRWDZBQOSA-N	0	3	341.455	3.183	20	30		EGEDHN
CN(C(=O)Nc1cccc(C#N)n1)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000592267246	459564493	/nfs/dbraw/zinc/56/44/93/459564493.db2.gz	JZSPBJNVGBFOAH-SFHVURJKSA-N	0	3	349.438	3.082	20	30		EGEDHN
C=CCN(CCc1ccco1)C(=O)NC[C@@H](c1ccccc1)N(C)C	ZINC000498111390	459569610	/nfs/dbraw/zinc/56/96/10/459569610.db2.gz	IDNBVXIBVXIFRW-IBGZPJMESA-N	0	3	341.455	3.323	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2ccc([C@H]3C[C@@H]3C)o2)CC1	ZINC000592293638	459572289	/nfs/dbraw/zinc/57/22/89/459572289.db2.gz	DWHFWMLETOLHMZ-YOEHRIQHSA-N	0	3	331.460	3.243	20	30		EGEDHN
C=CCn1cccc1C(=O)Nc1ccc(C)cc1OCCN(C)C	ZINC000490021897	459574921	/nfs/dbraw/zinc/57/49/21/459574921.db2.gz	QTJPFXUSCSYDPK-UHFFFAOYSA-N	0	3	327.428	3.175	20	30		EGEDHN
C#CCNC(=O)C1CCN(Cc2ccc(-c3ccsc3)cc2)CC1	ZINC000491103996	459598214	/nfs/dbraw/zinc/59/82/14/459598214.db2.gz	RBSMVPCKZARHQT-UHFFFAOYSA-N	0	3	338.476	3.377	20	30		EGEDHN
COc1ccc(Cl)cc1NC(=O)CCN1CCC(CC#N)CC1	ZINC000542879268	459606895	/nfs/dbraw/zinc/60/68/95/459606895.db2.gz	PSMLMWXOEAOBJA-UHFFFAOYSA-N	0	3	335.835	3.303	20	30		EGEDHN
C=CCN(CCc1ccco1)C[C@H](O)COc1ccc(Cl)cc1	ZINC000491424646	459626012	/nfs/dbraw/zinc/62/60/12/459626012.db2.gz	VWTFNRUUADXOME-INIZCTEOSA-N	0	3	335.831	3.403	20	30		EGEDHN
C#C[C@@H](CCC)NC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C	ZINC000491430949	459626421	/nfs/dbraw/zinc/62/64/21/459626421.db2.gz	ZWPWCLUGZNAAPR-KRWDZBQOSA-N	0	3	342.487	3.060	20	30		EGEDHN
C[C@H](N[C@@H]1CCCN(C)c2ccccc21)C(=O)Nc1cccc(C#N)c1	ZINC000573177315	459635832	/nfs/dbraw/zinc/63/58/32/459635832.db2.gz	QQHUTRYDUGQWCZ-HNAYVOBHSA-N	0	3	348.450	3.446	20	30		EGEDHN
C[C@@H]1C[C@H]1[C@@H](NCC(=O)NC1(C#N)CCC1)c1ccc(Cl)cc1	ZINC000527385147	459639555	/nfs/dbraw/zinc/63/95/55/459639555.db2.gz	AJVVDQWFSMLVMB-VMGRFDJRSA-N	0	3	331.847	3.189	20	30		EGEDHN
C#C[C@H](C)N(C)C(=O)Nc1cc(Cl)ccc1OC1CCN(C)CC1	ZINC000491772603	459669593	/nfs/dbraw/zinc/66/95/93/459669593.db2.gz	TYULZFGUVPVCMU-ZDUSSCGKSA-N	0	3	349.862	3.298	20	30		EGEDHN
C#C[C@@H](C)N(C)C(=O)Nc1cc(Cl)ccc1OC1CCN(C)CC1	ZINC000491772601	459669951	/nfs/dbraw/zinc/66/99/51/459669951.db2.gz	TYULZFGUVPVCMU-CYBMUJFWSA-N	0	3	349.862	3.298	20	30		EGEDHN
C=CCc1cc(CNCc2ccc3cnn(C)c3c2)cc(OC)c1O	ZINC000573416085	459672241	/nfs/dbraw/zinc/67/22/41/459672241.db2.gz	CRLWYHKBAUBKNH-UHFFFAOYSA-N	0	3	337.423	3.306	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Cc1ccc2c(c1)COC2)C(C)C	ZINC000543586886	459672921	/nfs/dbraw/zinc/67/29/21/459672921.db2.gz	CIMOCMCDMIVTHM-FQEVSTJZSA-N	0	3	342.483	3.074	20	30		EGEDHN
N#CCC[C@H](C#N)CN[C@H]1CCCN(Cc2ccc(F)cc2Cl)C1	ZINC000562993754	459688385	/nfs/dbraw/zinc/68/83/85/459688385.db2.gz	NLHNNIJVPYACQN-PBHICJAKSA-N	0	3	348.853	3.477	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)NCCS(=O)(=O)c1ccc(F)cc1	ZINC000562997060	459689332	/nfs/dbraw/zinc/68/93/32/459689332.db2.gz	IWVUJSHHOYIDBX-SFHVURJKSA-N	0	3	347.455	3.376	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NCCS(=O)(=O)c1ccc(F)cc1	ZINC000562996859	459689417	/nfs/dbraw/zinc/68/94/17/459689417.db2.gz	IWVUJSHHOYIDBX-GOSISDBHSA-N	0	3	347.455	3.376	20	30		EGEDHN
CCc1ccc([C@H]2CCN(Cc3cnc4c(C#N)cnn4c3)C2)cc1	ZINC000563151126	459724609	/nfs/dbraw/zinc/72/46/09/459724609.db2.gz	QFOBSCWDQHDROD-SFHVURJKSA-N	0	3	331.423	3.153	20	30		EGEDHN
N#CCN(C(=O)C(C[C@H]1CCCO1)C(F)(F)F)c1ccccc1	ZINC000593039971	459751160	/nfs/dbraw/zinc/75/11/60/459751160.db2.gz	VZFUNZZCOCXARE-KGLIPLIRSA-N	0	3	326.318	3.291	20	30		EGEDHN
N#Cc1ccc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)cc1C#N	ZINC000593068522	459763342	/nfs/dbraw/zinc/76/33/42/459763342.db2.gz	PNANKQHACSJOFB-UONOGXRCSA-N	0	3	337.301	3.116	20	30		EGEDHN
Cc1cc(C)cc(CC(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)c1	ZINC000596827719	459772994	/nfs/dbraw/zinc/77/29/94/459772994.db2.gz	GTFPZZQGVGWGBZ-UHFFFAOYSA-N	0	3	349.478	3.308	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N[C@@H]1CCO[C@H](c2ccncc2)C1	ZINC000564637053	459775286	/nfs/dbraw/zinc/77/52/86/459775286.db2.gz	DWRHEOOHFYKDPG-ZCNNSNEGSA-N	0	3	349.434	3.190	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)NCCCC2CCC2)cc1	ZINC000596877808	459785422	/nfs/dbraw/zinc/78/54/22/459785422.db2.gz	VTHBSNCJPGTWJF-CYBMUJFWSA-N	0	3	349.456	3.074	20	30		EGEDHN
Cc1cc([C@@H](NCc2cnc3c(C#N)cnn3c2)C2CC2)ccc1F	ZINC000574158650	459786282	/nfs/dbraw/zinc/78/62/82/459786282.db2.gz	QAAMQOGQCAEYTQ-SFHVURJKSA-N	0	3	335.386	3.289	20	30		EGEDHN
Cc1ccccc1[C@@H]1C[C@H]1NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000593248617	459820220	/nfs/dbraw/zinc/82/02/20/459820220.db2.gz	LTHSZUFPHKCQQL-YZGWKJHDSA-N	0	3	329.403	3.221	20	30		EGEDHN
CN(C(=O)c1ccc(CN2CCCCC2)cc1)c1ccc(C#N)nc1	ZINC000593272182	459825536	/nfs/dbraw/zinc/82/55/36/459825536.db2.gz	FRAUCMPKIUEBPI-UHFFFAOYSA-N	0	3	334.423	3.216	20	30		EGEDHN
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NCc1ccc(C#N)cc1C	ZINC000585755345	459841156	/nfs/dbraw/zinc/84/11/56/459841156.db2.gz	HIMGIIYWMOHVCO-UZLBHIALSA-N	0	3	336.435	3.377	20	30		EGEDHN
CCOc1ccc(CN2CC[C@@H](Oc3ccc(C#N)cn3)C2)c(C)c1	ZINC000597128729	459845161	/nfs/dbraw/zinc/84/51/61/459845161.db2.gz	DYIAJZYDMPJTFX-LJQANCHMSA-N	0	3	337.423	3.314	20	30		EGEDHN
N#C[C@H]1CC[C@@H](NC[C@H](O)COc2cc(Cl)ccc2Cl)C1	ZINC000574804060	459874008	/nfs/dbraw/zinc/87/40/08/459874008.db2.gz	PYOWHPUEXAMAJU-UHTWSYAYSA-N	0	3	329.227	3.015	20	30		EGEDHN
C[C@@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccc2c(c1)OCC(=O)N2	ZINC000586793867	459875495	/nfs/dbraw/zinc/87/54/95/459875495.db2.gz	JMHZVYBSBFQYIC-SJKOYZFVSA-N	0	3	333.391	3.227	20	30		EGEDHN
CN(C)C1(CNC(=O)CC2(C#N)CCCCC2)Cc2ccccc2C1	ZINC000597290636	459905530	/nfs/dbraw/zinc/90/55/30/459905530.db2.gz	QTMJIWMHJWNQDI-UHFFFAOYSA-N	0	3	339.483	3.066	20	30		EGEDHN
CC(C)(C)N1CCCN(C(=O)c2cc3ccccc3n2CC#N)CC1	ZINC000609170106	459918336	/nfs/dbraw/zinc/91/83/36/459918336.db2.gz	MGWBIYUFUIXRDG-UHFFFAOYSA-N	0	3	338.455	3.111	20	30		EGEDHN
CC(C)[C@@H]1CN(C(=O)c2cn(CCCC#N)c3ccccc23)CCN1	ZINC000598574440	459944790	/nfs/dbraw/zinc/94/47/90/459944790.db2.gz	RBTQHXZRIZHBEG-SFHVURJKSA-N	0	3	338.455	3.015	20	30		EGEDHN
CCc1csc(CC2CCN(C[C@H](O)CC(C)(C)C#N)CC2)n1	ZINC000598624087	459967383	/nfs/dbraw/zinc/96/73/83/459967383.db2.gz	WSLXOFXGIFIBON-MRXNPFEDSA-N	0	3	335.517	3.261	20	30		EGEDHN
COc1cc(CCCNCc2ccc(C#N)cc2F)cc(OC)c1O	ZINC000598648839	459977870	/nfs/dbraw/zinc/97/78/70/459977870.db2.gz	LJHJKLPONCHLMW-UHFFFAOYSA-N	0	3	344.386	3.143	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N(Cc1ccc(F)cc1Cl)CC1CC1	ZINC000602525188	459983228	/nfs/dbraw/zinc/98/32/28/459983228.db2.gz	SBGPEEGOELJQIZ-MRXNPFEDSA-N	0	3	337.826	3.239	20	30		EGEDHN
N#Cc1cnc2c(F)cc(F)cc2c1NC1CCN(C2CC2)CC1	ZINC000609570834	459985460	/nfs/dbraw/zinc/98/54/60/459985460.db2.gz	PNTIMMNMPVHRIX-UHFFFAOYSA-N	0	3	328.366	3.423	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CNCc1ccc(Oc2cccnc2)c(F)c1	ZINC000598701629	459999641	/nfs/dbraw/zinc/99/96/41/459999641.db2.gz	YBXMRINRNLPRPD-HNNXBMFYSA-N	0	3	343.402	3.403	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)C(=O)NC[C@@H](C)N1CCCC[C@@H]1C	ZINC000593963470	460030995	/nfs/dbraw/zinc/03/09/95/460030995.db2.gz	NNUYBVGOPSBSBZ-IXDOHACOSA-N	0	3	327.472	3.116	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1CCC[C@@H]1c1ccc(O)cc1	ZINC000610132861	460068266	/nfs/dbraw/zinc/06/82/66/460068266.db2.gz	TURXPSAKVFJRMQ-GOSISDBHSA-N	0	3	338.407	3.488	20	30		EGEDHN
N#C[C@@H]1CCC[C@H](N[C@@H](Cc2ccccc2)[C@H](O)C(F)(F)F)C1	ZINC000618573816	460069007	/nfs/dbraw/zinc/06/90/07/460069007.db2.gz	QKYFKGTXMXHHEJ-UGUYLWEFSA-N	0	3	326.362	3.193	20	30		EGEDHN
Cn1ccnc1[C@H]1N(C(=O)C(C#N)CCc2ccccc2)CC1(C)C	ZINC000576198109	460088337	/nfs/dbraw/zinc/08/83/37/460088337.db2.gz	UCMDURZDKLARBF-DLBZAZTESA-N	0	3	336.439	3.102	20	30		EGEDHN
Cc1cccc2c1ncc(C#N)c2NCCN(C)Cc1ccccc1	ZINC000610275711	460103239	/nfs/dbraw/zinc/10/32/39/460103239.db2.gz	QEUODUMSZXFIGG-UHFFFAOYSA-N	0	3	330.435	3.381	20	30		EGEDHN
N#Cc1ccc(N2CCC(N[C@H]3CCCc4scnc43)CC2)nc1	ZINC000599027729	460132351	/nfs/dbraw/zinc/13/23/51/460132351.db2.gz	QLANLYKLEWFCPU-HNNXBMFYSA-N	0	3	339.468	3.046	20	30		EGEDHN
CC(C)(C#N)c1ccc(C(=O)N[C@H]2CCCN3CCCC[C@H]23)cc1	ZINC000594196810	460143155	/nfs/dbraw/zinc/14/31/55/460143155.db2.gz	NGMMVLCAHHBPQA-ZWKOTPCHSA-N	0	3	325.456	3.234	20	30		EGEDHN
CN(CCc1ccccc1)[C@@H]1CCN(C(=O)C2(C#N)CCCCC2)C1	ZINC000598194018	460199410	/nfs/dbraw/zinc/19/94/10/460199410.db2.gz	DDNSQSCQOUQRLK-LJQANCHMSA-N	0	3	339.483	3.236	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N[C@@H]1COc2cc(F)ccc2C1	ZINC000598222350	460210875	/nfs/dbraw/zinc/21/08/75/460210875.db2.gz	XDWFUHFLQZFVRH-WMZOPIPTSA-N	0	3	338.382	3.018	20	30		EGEDHN
CC[C@H](C)[C@H](NC(=O)[C@H](N)CCCCC#N)c1nc2ccccc2[nH]1	ZINC000594441170	460221270	/nfs/dbraw/zinc/22/12/70/460221270.db2.gz	OCMWIAYVZIRUBR-VBQJREDUSA-N	0	3	341.459	3.178	20	30		EGEDHN
CC(C)CN1CCN(c2c(C#N)cnc3c(F)ccc(F)c32)CC1	ZINC000610732841	460227838	/nfs/dbraw/zinc/22/78/38/460227838.db2.gz	NKQMCAIYSDNYSX-UHFFFAOYSA-N	0	3	330.382	3.163	20	30		EGEDHN
C[C@H](NC(=O)N1CCN(C2CCCCC2)CC1)c1cccc(C#N)c1	ZINC000610846907	460246924	/nfs/dbraw/zinc/24/69/24/460246924.db2.gz	WPPOWXXSWKOWER-INIZCTEOSA-N	0	3	340.471	3.279	20	30		EGEDHN
N#CCCn1cc(CN2CC[C@H](c3ccco3)C2)c(-c2ccncc2)n1	ZINC000619073767	460262231	/nfs/dbraw/zinc/26/22/31/460262231.db2.gz	YJVRQZWMOOBGHZ-KRWDZBQOSA-N	0	3	347.422	3.441	20	30		EGEDHN
C[C@H](NC1CCN(CC#N)CC1)c1ccc(Br)cc1F	ZINC000615085838	460272479	/nfs/dbraw/zinc/27/24/79/460272479.db2.gz	KLCMWKGOHQMFRC-NSHDSACASA-N	0	3	340.240	3.227	20	30		EGEDHN
C[C@H]1CN(CCOc2ccc(C#N)cc2)CC[C@@H]1C(=O)OC(C)(C)C	ZINC000599597330	460284618	/nfs/dbraw/zinc/28/46/18/460284618.db2.gz	SJKHIOIZHGQUHW-YJBOKZPZSA-N	0	3	344.455	3.237	20	30		EGEDHN
COc1cc(NC(=O)NCC(C)(C)N2CCCCC2)c(F)cc1C#N	ZINC000599820216	460341340	/nfs/dbraw/zinc/34/13/40/460341340.db2.gz	QMLVQWURDUPTNE-UHFFFAOYSA-N	0	3	348.422	3.092	20	30		EGEDHN
N#Cc1ccc2c(c1)CCCC[C@H]2NC[C@H](O)COc1ccccc1	ZINC000619508172	460371514	/nfs/dbraw/zinc/37/15/14/460371514.db2.gz	FOSQGBVUCCSYDQ-GHTZIAJQSA-N	0	3	336.435	3.355	20	30		EGEDHN
N#Cc1ccccc1OCCN1C[C@H]2CN(c3ccccc3)C[C@@H]2C1	ZINC000604271978	460398792	/nfs/dbraw/zinc/39/87/92/460398792.db2.gz	ZYEKNOKXPBWYOE-OALUTQOASA-N	0	3	333.435	3.005	20	30		EGEDHN
C=CCSCCNC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000604487961	460433172	/nfs/dbraw/zinc/43/31/72/460433172.db2.gz	DMTVWHXFNPQJKR-GOSISDBHSA-N	0	3	347.528	3.117	20	30		EGEDHN
CN(C)CCN(Cc1ccccn1)c1nc(C(C)(C)C)ccc1C#N	ZINC000613428042	460943146	/nfs/dbraw/zinc/94/31/46/460943146.db2.gz	SRILWRUZKQBXJH-UHFFFAOYSA-N	0	3	337.471	3.214	20	30		EGEDHN
C=CCC1(C(=O)NCC2CCN(Cc3ccncc3)CC2)CCC1	ZINC000617974986	461048655	/nfs/dbraw/zinc/04/86/55/461048655.db2.gz	BRTVSAHUWMDAQZ-UHFFFAOYSA-N	0	3	327.472	3.156	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@@H](CO)C(C)(C)C)cc1OC	ZINC000628252596	461062940	/nfs/dbraw/zinc/06/29/40/461062940.db2.gz	ADVMVBJDZYUVJZ-HNNXBMFYSA-N	0	3	327.852	3.410	20	30		EGEDHN
N#CC(C(=O)c1ccc2c(c1)CCC(=O)N2)c1nc(C2CC2)cs1	ZINC000647373883	461666015	/nfs/dbraw/zinc/66/60/15/461666015.db2.gz	QLFGGSBSBCBEGY-CYBMUJFWSA-N	0	3	337.404	3.395	20	30		EGEDHN
C=CCCn1cc(CNC[C@H]2CCCO[C@@H]2c2ccccc2)nn1	ZINC000657329574	462051325	/nfs/dbraw/zinc/05/13/25/462051325.db2.gz	RYHKAGMDXDCRTE-IEBWSBKVSA-N	0	3	326.444	3.112	20	30		EGEDHN
C=C(C)CN1CCC(NCc2conc2Cc2ccccc2)CC1	ZINC000645153914	462205301	/nfs/dbraw/zinc/20/53/01/462205301.db2.gz	SYZJGFBBUIQOMU-UHFFFAOYSA-N	0	3	325.456	3.396	20	30		EGEDHN
C=CC[C@@H]1CCCN(CCCOc2ccc(S(C)(=O)=O)cc2)C1	ZINC000661378301	462223178	/nfs/dbraw/zinc/22/31/78/462223178.db2.gz	CERJWACMRDERHP-MRXNPFEDSA-N	0	3	337.485	3.147	20	30		EGEDHN
C=CC[C@H]1CCCN(CC(=O)N[C@H](C)c2cc(OC)ccc2OC)C1	ZINC000661377758	462223504	/nfs/dbraw/zinc/22/35/04/462223504.db2.gz	UCAJOCXJAUAFBX-CVEARBPZSA-N	0	3	346.471	3.169	20	30		EGEDHN
C=CCN(C(=O)N[C@H](C)[C@H](c1ccccc1C)N(C)C)[C@H](C)COC	ZINC000664870034	462225205	/nfs/dbraw/zinc/22/52/05/462225205.db2.gz	NXQFYYIBSRWNAN-ZHALLVOQSA-N	0	3	347.503	3.219	20	30		EGEDHN
C=CCn1cc(CN[C@H](CC)Cc2ccc(Br)cc2)nn1	ZINC000658038734	462354299	/nfs/dbraw/zinc/35/42/99/462354299.db2.gz	QNXISFYQBIOIEP-OAHLLOKOSA-N	0	3	349.276	3.338	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cccc3c2OC(C)(C)C3)CC1	ZINC000654748426	462370101	/nfs/dbraw/zinc/37/01/01/462370101.db2.gz	CNKARQUICGTAHS-UHFFFAOYSA-N	0	3	328.456	3.170	20	30		EGEDHN
Cc1cc(NC(=O)C2CCN(Cc3ccc(C#N)c(C)c3)CC2)no1	ZINC000488205989	468077048	/nfs/dbraw/zinc/07/70/48/468077048.db2.gz	UWNVXPJELMSGCC-UHFFFAOYSA-N	0	3	338.411	3.014	20	30		EGEDHN
COc1cc(F)c([C@H](C)NCCOc2ccccc2C#N)cc1OC	ZINC000183504818	533990552	/nfs/dbraw/zinc/99/05/52/533990552.db2.gz	DRXJRAZAYWEEHY-ZDUSSCGKSA-N	0	3	344.386	3.444	20	30		EGEDHN
N#Cc1cccc(OCCCN2CCC(O)(c3ccccc3)CC2)c1	ZINC000185493343	534811185	/nfs/dbraw/zinc/81/11/85/534811185.db2.gz	RIICWWMDVPYKEF-UHFFFAOYSA-N	0	3	336.435	3.311	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@H](CNCc2ccc(C#N)cc2F)C1	ZINC000236725695	534825968	/nfs/dbraw/zinc/82/59/68/534825968.db2.gz	CVWFOXOPBCTOPK-OAHLLOKOSA-N	0	3	347.434	3.434	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2sc(C)nc2-c2ccccc2)CC1	ZINC000171723007	526449177	/nfs/dbraw/zinc/44/91/77/526449177.db2.gz	BYHUUDNFILRSJF-UHFFFAOYSA-N	0	3	341.480	3.499	20	30		EGEDHN
CCCn1ccnc1CCCN(C)Cc1ccc(C#N)cc1OC	ZINC000191480926	528866461	/nfs/dbraw/zinc/86/64/61/528866461.db2.gz	RNBTZNMZTOIDCX-UHFFFAOYSA-N	0	3	326.444	3.238	20	30		EGEDHN
CN(C)[C@H](CNc1c(C#N)nnc2ccccc21)c1ccc(F)cc1	ZINC000077192434	546586083	/nfs/dbraw/zinc/58/60/83/546586083.db2.gz	KFWCIORYBWJNNV-GOSISDBHSA-N	0	3	335.386	3.355	20	30		EGEDHN
CC(C)Oc1cccc(C(=O)C(C#N)c2nc3ccccc3n2C)n1	ZINC000162348307	546963404	/nfs/dbraw/zinc/96/34/04/546963404.db2.gz	JQCBPVJOTAJSJG-ZDUSSCGKSA-N	0	3	334.379	3.246	20	30		EGEDHN
CN1CCN(CC2(C)CCN(c3ccc(C#N)c(Cl)c3)CC2)CC1	ZINC000374923382	547814085	/nfs/dbraw/zinc/81/40/85/547814085.db2.gz	DOIAOPXUZPEUFQ-UHFFFAOYSA-N	0	3	346.906	3.066	20	30		EGEDHN
C=CCOc1ccc(CN2CCC[C@@H](n3ccnc3)C2)cc1OC	ZINC000678234874	549435534	/nfs/dbraw/zinc/43/55/34/549435534.db2.gz	MOIKPRQADLBFLL-QGZVFWFLSA-N	0	3	327.428	3.294	20	30		EGEDHN
C=CCCOCCCCC(=O)N1C[C@H](CN(C)C)Oc2ccccc21	ZINC000678857374	549580092	/nfs/dbraw/zinc/58/00/92/549580092.db2.gz	KDDZNXOJIBTXJB-KRWDZBQOSA-N	0	3	346.471	3.105	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2C[C@H](C(F)(F)F)CC[C@H]2C)CC1	ZINC000679487640	549718948	/nfs/dbraw/zinc/71/89/48/549718948.db2.gz	JQNPMTCBBVFCQY-ZIAGYGMSSA-N	0	3	347.425	3.399	20	30		EGEDHN
CC(=O)c1ccc(C#N)c(N2CC[C@H](N(C)Cc3ccccc3)C2)c1	ZINC000680376396	549858268	/nfs/dbraw/zinc/85/82/68/549858268.db2.gz	WDVZBBOTVQALAU-FQEVSTJZSA-N	0	3	333.435	3.472	20	30		EGEDHN
CC(=O)c1ccc(C#N)c(N2CC[C@@H](N(C)Cc3ccccc3)C2)c1	ZINC000680376398	549858369	/nfs/dbraw/zinc/85/83/69/549858369.db2.gz	WDVZBBOTVQALAU-HXUWFJFHSA-N	0	3	333.435	3.472	20	30		EGEDHN
COCC#CCN[C@@H](C)c1sc(-c2ccc(OC)cc2)nc1C	ZINC000680421557	549864600	/nfs/dbraw/zinc/86/46/00/549864600.db2.gz	SNKSDIOCHUOREW-ZDUSSCGKSA-N	0	3	330.453	3.428	20	30		EGEDHN
C=CCOc1ccccc1CN1CC[C@@]2(C1)C(=O)Nc1ccccc12	ZINC000681752026	550032735	/nfs/dbraw/zinc/03/27/35/550032735.db2.gz	BOJDZKIWZOPQCD-NRFANRHFSA-N	0	3	334.419	3.347	20	30		EGEDHN
C=CCn1c(-c2ccccc2C)nnc1N1C[C@H](C)N(CC)C[C@H]1C	ZINC000685543376	550427612	/nfs/dbraw/zinc/42/76/12/550427612.db2.gz	FRZQAORDVABOJK-DLBZAZTESA-N	0	3	339.487	3.358	20	30		EGEDHN
N#CC(C(=O)CCNC(=O)C1CCCCC1)c1ccc2ccccc2n1	ZINC000726318563	574548531	/nfs/dbraw/zinc/54/85/31/574548531.db2.gz	NAUMMOGGMDIELJ-QGZVFWFLSA-N	0	3	349.434	3.498	20	30		EGEDHN
CC1(C)CN(C2(C/N=C/c3cccc(O)c3O)CCCCC2)CCO1	ZINC000731155802	575057646	/nfs/dbraw/zinc/05/76/46/575057646.db2.gz	TXKZVWKXCHBUIZ-FYJGNVAPSA-N	0	3	346.471	3.330	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)[C@@H]3COc4ccccc4C3)nc21	ZINC000735792357	575715144	/nfs/dbraw/zinc/71/51/44/575715144.db2.gz	KVZYWBBNHUPUPK-LSDHHAIUSA-N	0	3	331.375	3.299	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)Cc3ccc4c(c3)OCO4)nc21	ZINC000735793272	575715633	/nfs/dbraw/zinc/71/56/33/575715633.db2.gz	RPOKJUSMFNARQR-ZDUSSCGKSA-N	0	3	333.347	3.019	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)Cc3ccc(OCC#N)cc3)nc21	ZINC000735793049	575715677	/nfs/dbraw/zinc/71/56/77/575715677.db2.gz	PTDFOEGHPLHTTK-MRXNPFEDSA-N	0	3	344.374	3.193	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)Cc3ccc4c(c3)OCO4)nc21	ZINC000735793271	575715724	/nfs/dbraw/zinc/71/57/24/575715724.db2.gz	RPOKJUSMFNARQR-CYBMUJFWSA-N	0	3	333.347	3.019	20	30		EGEDHN
C=C(Cl)CNC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1	ZINC000736240340	575921055	/nfs/dbraw/zinc/92/10/55/575921055.db2.gz	MFBAJKZEOOFISA-OAHLLOKOSA-N	0	3	346.780	3.310	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)CCCc3nc(C4CC4)no3)nc21	ZINC000740562543	576599707	/nfs/dbraw/zinc/59/97/07/576599707.db2.gz	QZBAZXGBXZSRDN-CYBMUJFWSA-N	0	3	349.394	3.331	20	30		EGEDHN
Cc1cccc2nc(C(C#N)C(=O)CCCc3nc(C4CC4)no3)[nH]c21	ZINC000740562543	576599708	/nfs/dbraw/zinc/59/97/08/576599708.db2.gz	QZBAZXGBXZSRDN-CYBMUJFWSA-N	0	3	349.394	3.331	20	30		EGEDHN
C#CCOc1ccc(C(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)cc1	ZINC000741677823	576710488	/nfs/dbraw/zinc/71/04/88/576710488.db2.gz	CCGOLDHCWYRXTD-FQEVSTJZSA-N	0	3	336.435	3.040	20	30		EGEDHN
N#Cc1cc([N+](=O)[O-])cnc1NC[C@H](c1ccccc1)N1CCCC1	ZINC000743144194	576802258	/nfs/dbraw/zinc/80/22/58/576802258.db2.gz	XWROFPHXPKHLEO-QGZVFWFLSA-N	0	3	337.383	3.110	20	30		EGEDHN
C#CCOc1ccc(F)cc1NC(=O)N[C@@H](C)CN1CCC[C@@H](C)C1	ZINC000743201953	576803284	/nfs/dbraw/zinc/80/32/84/576803284.db2.gz	SPRPNHVAGRDZMN-CABCVRRESA-N	0	3	347.434	3.080	20	30		EGEDHN
Cc1ncc(CO)c(/C=N/C2CC[NH+](CC3CCCCC3)CC2)c1[O-]	ZINC000743538853	576811509	/nfs/dbraw/zinc/81/15/09/576811509.db2.gz	QIJPIRGUJIXAAW-WSDLNYQXSA-N	0	3	345.487	3.052	20	30		EGEDHN
C#CCN(CCOc1ccc(OC)cc1[N+](=O)[O-])C1CCCCC1	ZINC000743842107	576816515	/nfs/dbraw/zinc/81/65/15/576816515.db2.gz	CJXFTWOHZUSYAA-UHFFFAOYSA-N	0	3	332.400	3.250	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)CCCOc1cccnc1	ZINC000744010881	576818837	/nfs/dbraw/zinc/81/88/37/576818837.db2.gz	RQKMWANULRPLHB-HNNXBMFYSA-N	0	3	334.379	3.004	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)CCCOc1cccnc1	ZINC000744010882	576818861	/nfs/dbraw/zinc/81/88/61/576818861.db2.gz	RQKMWANULRPLHB-OAHLLOKOSA-N	0	3	334.379	3.004	20	30		EGEDHN
C[C@H](C(=O)C(C#N)C(=O)Nc1ccccn1)c1cccc(Cl)c1	ZINC000744039383	576819391	/nfs/dbraw/zinc/81/93/91/576819391.db2.gz	OGIPDKUNBOFVRF-FZMZJTMJSA-N	0	3	327.771	3.186	20	30		EGEDHN
C=CCN(CCc1ccccc1)C[C@@H](O)c1cc(OC)ccc1OC	ZINC000744211450	576823121	/nfs/dbraw/zinc/82/31/21/576823121.db2.gz	PSMPCTWRGFDSKO-HXUWFJFHSA-N	0	3	341.451	3.468	20	30		EGEDHN
C#CCOc1ccc(Br)cc1CNC[C@H]1CCCCO1	ZINC000042815858	1291446703	/nfs/dbraw/zinc/44/67/03/1291446703.db2.gz	BMWXGSLMOKGAOR-OAHLLOKOSA-N	0	3	338.245	3.120	20	30		EGEDHN
Cc1ccc(C(=O)CCC(=O)C(C#N)C(=O)NC2CCCCC2)cc1	ZINC000050678902	1291654507	/nfs/dbraw/zinc/65/45/07/1291654507.db2.gz	DIBZUFPQVYWKKG-QGZVFWFLSA-N	0	3	340.423	3.116	20	30		EGEDHN
CCCC(=O)N1CCC[C@@H](C(=O)C(C#N)c2nc3ccccc3o2)C1	ZINC000066516607	1292119962	/nfs/dbraw/zinc/11/99/62/1292119962.db2.gz	YFFRTJNRYOPVFP-ZIAGYGMSSA-N	0	3	339.395	3.043	20	30		EGEDHN
N#CC(C(=O)CCc1nc(-c2ccco2)no1)c1nc2ccccc2[nH]1	ZINC000073972111	1292331078	/nfs/dbraw/zinc/33/10/78/1292331078.db2.gz	RLDYXIVUQVBHON-NSHDSACASA-N	0	3	347.334	3.015	20	30		EGEDHN
C[C@@H](NC[C@@H]1CN(C2CCCCC2)C(=O)O1)c1ccc(C#N)cc1	ZINC000828148544	1292437034	/nfs/dbraw/zinc/43/70/34/1292437034.db2.gz	ZCLWNIPNJTUOMG-RDTXWAMCSA-N	0	3	327.428	3.362	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)CO[C@H]2CCCC[C@@H]2C)cc1	ZINC000113652918	1293154004	/nfs/dbraw/zinc/15/40/04/1293154004.db2.gz	MLXAECFQWSBDGH-YJLNNSPDSA-N	0	3	342.439	3.492	20	30		EGEDHN
COc1ccc(C(C)=NN[C@H]2CCOC2(C)C)cc1CN1CCCC1	ZINC000835013995	1293187525	/nfs/dbraw/zinc/18/75/25/1293187525.db2.gz	LWEGEYWQINVQIG-IBGZPJMESA-N	0	3	345.487	3.172	20	30		EGEDHN
Cc1cc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)nn1C(C)C	ZINC000835062946	1293197088	/nfs/dbraw/zinc/19/70/88/1293197088.db2.gz	GTXOGONNYIDDFQ-LBPRGKRZSA-N	0	3	344.802	3.387	20	30		EGEDHN
N#CC(C(=O)CCCOc1cccc(F)c1)C(=O)Nc1ccccc1	ZINC000125525221	1293510059	/nfs/dbraw/zinc/51/00/59/1293510059.db2.gz	UXGOTZNJULKCHU-QGZVFWFLSA-N	0	3	340.354	3.332	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)COc1ccc(C)cc1C	ZINC000125607600	1293511741	/nfs/dbraw/zinc/51/17/41/1293511741.db2.gz	BVFFWPIIDUBDMX-MRXNPFEDSA-N	0	3	330.428	3.088	20	30		EGEDHN
N#CC(C(=O)C=Cc1nc2ccccc2s1)C(=O)Nc1ccccn1	ZINC000126414999	1293534018	/nfs/dbraw/zinc/53/40/18/1293534018.db2.gz	GKRUUAVTQSIGQN-IDVQTMNDSA-N	0	3	348.387	3.052	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H](NC2CC(C#N)(c3ccccc3)C2)C1	ZINC000126889880	1293547206	/nfs/dbraw/zinc/54/72/06/1293547206.db2.gz	IGQXTBMOBRIRIA-VXESANQCSA-N	0	3	341.455	3.209	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000128359866	1293590060	/nfs/dbraw/zinc/59/00/60/1293590060.db2.gz	YVTRHGSXBPALKN-INIZCTEOSA-N	0	3	337.335	3.118	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)CSc2ccncc2)cc1	ZINC000128380320	1293591225	/nfs/dbraw/zinc/59/12/25/1293591225.db2.gz	FWKUNNQJHKMXPK-MRXNPFEDSA-N	0	3	339.420	3.084	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)c1cc(F)cc(F)c1	ZINC000128933495	1293608044	/nfs/dbraw/zinc/60/80/44/1293608044.db2.gz	ZRSVQVZUWVZOIC-AWEZNQCLSA-N	0	3	344.317	3.325	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)c1cc(C)oc1C	ZINC000128919539	1293608154	/nfs/dbraw/zinc/60/81/54/1293608154.db2.gz	LXRYRGXJMAXJLC-AWEZNQCLSA-N	0	3	326.352	3.256	20	30		EGEDHN
Cc1ccsc1CCCC(=O)C(C#N)C(=O)NCc1ccccc1	ZINC000129408927	1293623420	/nfs/dbraw/zinc/62/34/20/1293623420.db2.gz	RWAMFDCIBHCTTK-INIZCTEOSA-N	0	3	340.448	3.405	20	30		EGEDHN
N#CC(C(=O)CCc1ccc(F)cc1F)C(=O)NC1CCCCC1	ZINC000152290446	1293962717	/nfs/dbraw/zinc/96/27/17/1293962717.db2.gz	VTIOMPHNIZQWSJ-HNNXBMFYSA-N	0	3	334.366	3.055	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@H](C)c1c(F)cccc1F	ZINC000153195814	1294002652	/nfs/dbraw/zinc/00/26/52/1294002652.db2.gz	CVGBHUNQOIWENK-OLZOCXBDSA-N	0	3	336.382	3.474	20	30		EGEDHN
C#CCOc1ccc([C@H](C)N[C@@H](C)C(=O)NCc2ccccc2)cc1	ZINC000161190032	1294286756	/nfs/dbraw/zinc/28/67/56/1294286756.db2.gz	MHFIYMKOBRYKAD-IRXDYDNUSA-N	0	3	336.435	3.054	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)[C@@H]2CCCOC2)cc1	ZINC000171036273	1294390762	/nfs/dbraw/zinc/39/07/62/1294390762.db2.gz	NYDSFGYWNAFDNC-NVXWUHKLSA-N	0	3	328.412	3.103	20	30		EGEDHN
C[C@H](CCc1cccc(F)c1)C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000174012076	1294476846	/nfs/dbraw/zinc/47/68/46/1294476846.db2.gz	UFEIKKFEDXMBSQ-CJNGLKHVSA-N	0	3	339.370	3.137	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)C[C@@H](C)c1cccc(OC)c1	ZINC000175940339	1294580871	/nfs/dbraw/zinc/58/08/71/1294580871.db2.gz	BDIHWGDPFZOLBK-RHSMWYFYSA-N	0	3	330.428	3.204	20	30		EGEDHN
CC(C)c1csc(C(C#N)C(=O)c2ccc(N)c([N+](=O)[O-])c2)n1	ZINC000177753024	1294691224	/nfs/dbraw/zinc/69/12/24/1294691224.db2.gz	RYCMJGZLKMWMET-SNVBAGLBSA-N	0	3	330.369	3.247	20	30		EGEDHN
C[C@H](CCc1ccc(F)cc1)C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000870162501	1295712747	/nfs/dbraw/zinc/71/27/47/1295712747.db2.gz	IVOBSVRNTFTXNV-CJNGLKHVSA-N	0	3	339.370	3.137	20	30		EGEDHN
N#CC(C(=O)CSc1ccncc1)C(=O)Nc1ccc(Cl)cc1	ZINC000193392356	1295861925	/nfs/dbraw/zinc/86/19/25/1295861925.db2.gz	WUWDZXAPHTXLDL-AWEZNQCLSA-N	0	3	345.811	3.175	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)CCc1cccs1	ZINC000193470365	1295872427	/nfs/dbraw/zinc/87/24/27/1295872427.db2.gz	OMTXTQFCIOZUEW-CYBMUJFWSA-N	0	3	328.393	3.037	20	30		EGEDHN
N#CC(C(=O)NC1CC1)C(=O)[C@@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1	ZINC000246484408	1296355329	/nfs/dbraw/zinc/35/53/29/1296355329.db2.gz	CUBQFLDMAWAUPT-MCIONIFRSA-N	0	3	337.206	3.084	20	30		EGEDHN
C#CCOc1ccccc1CN[C@H]1CCC[C@H]1NC(=O)OC(C)(C)C	ZINC000301726744	1296793414	/nfs/dbraw/zinc/79/34/14/1296793414.db2.gz	AJFMLKCAONKTMZ-DLBZAZTESA-N	0	3	344.455	3.234	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H](NC[C@@H](C#N)CCC#N)C(C)(C)C1	ZINC000872223228	1296826074	/nfs/dbraw/zinc/82/60/74/1296826074.db2.gz	ONOISKSUGNKFOF-HUUCEWRRSA-N	0	3	334.464	3.055	20	30		EGEDHN
C[C@H](NC1CC(C#N)(c2ccccc2)C1)c1ccc2[nH]c(=O)[nH]c2c1	ZINC000327230449	1297246268	/nfs/dbraw/zinc/24/62/68/1297246268.db2.gz	KTRLBKDISZATFN-CZTOGXCSSA-N	0	3	332.407	3.131	20	30		EGEDHN
C#CCSCCN[C@@H](C)c1ccccc1I	ZINC000381485227	1297550886	/nfs/dbraw/zinc/55/08/86/1297550886.db2.gz	UYJZFXAPAGYPMW-NSHDSACASA-N	0	3	345.249	3.308	20	30		EGEDHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)/C=C\c1ccccc1C#N	ZINC000588385391	1298054208	/nfs/dbraw/zinc/05/42/08/1298054208.db2.gz	ZOJOHFFZQZMKPB-MUSGIIIZSA-N	0	3	333.435	3.208	20	30		EGEDHN
O=C(C#Cc1ccccc1)N[C@H](CN1CCCCC1)c1ccccc1	ZINC000747379336	1298771673	/nfs/dbraw/zinc/77/16/73/1298771673.db2.gz	BXKKTLCJNVSHRY-OAQYLSRUSA-N	0	3	332.447	3.382	20	30		EGEDHN
C=C(Cl)C[C@H](N)C(=O)N1CCC[C@H]1c1nc2cc(C)ccc2[nH]1	ZINC000876875802	1299047139	/nfs/dbraw/zinc/04/71/39/1299047139.db2.gz	AZGYFAFCQXNTAZ-WFASDCNBSA-N	0	3	332.835	3.005	20	30		EGEDHN
C#C[C@@H](CC)NC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1	ZINC000753033855	1299850649	/nfs/dbraw/zinc/85/06/49/1299850649.db2.gz	RXNXTYQHQYDFSH-JKSUJKDBSA-N	0	3	333.501	3.232	20	30		EGEDHN
C=CC[C@@H](CO)C[NH2+]Cc1ccc(OCc2ccccc2)cc1[O-]	ZINC000753572721	1299976413	/nfs/dbraw/zinc/97/64/13/1299976413.db2.gz	WWGUXUOZHFNSCB-QGZVFWFLSA-N	0	3	327.424	3.245	20	30		EGEDHN
C=CCC[C@@H](O)CN[C@@H](COC)c1cccc(Br)c1	ZINC000879662982	1300660320	/nfs/dbraw/zinc/66/03/20/1300660320.db2.gz	RIGKLHYFWXHJAJ-CABCVRRESA-N	0	3	328.250	3.053	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)c2cc(Cl)cs2)c1	ZINC000759432546	1301090740	/nfs/dbraw/zinc/09/07/40/1301090740.db2.gz	XDSZYOWBFOCGJA-GFCCVEGCSA-N	0	3	334.784	3.371	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cc(F)ccc2N(C)C)CC1	ZINC000880933601	1301341888	/nfs/dbraw/zinc/34/18/88/1301341888.db2.gz	OGOYPJPQCCKLIS-UHFFFAOYSA-N	0	3	334.439	3.054	20	30		EGEDHN
COC(=O)N[C@@H](C)C(=O)C(C#N)c1nc(-c2ccc(C)cc2)cs1	ZINC000762026050	1301593684	/nfs/dbraw/zinc/59/36/84/1301593684.db2.gz	HIWMDQIDGPCCMC-AAEUAGOBSA-N	0	3	343.408	3.039	20	30		EGEDHN
C#CC[C@@H](CO)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1	ZINC000883124147	1302261272	/nfs/dbraw/zinc/26/12/72/1302261272.db2.gz	XXBCPBDHXSTSAC-LBPRGKRZSA-N	0	3	325.252	3.198	20	30		EGEDHN
C=CC[C@H](NC(=O)NC[C@H]1CCCCN1C1CC1)c1ccncc1	ZINC000765498884	1302272832	/nfs/dbraw/zinc/27/28/32/1302272832.db2.gz	JVXQEDLXVRXPPS-MSOLQXFVSA-N	0	3	328.460	3.015	20	30		EGEDHN
C#CCN(CC)Cc1sc(N2CCOCC2)nc1-c1ccccc1	ZINC000769111942	1303049316	/nfs/dbraw/zinc/04/93/16/1303049316.db2.gz	UDOHSPOPLZNLGG-UHFFFAOYSA-N	0	3	341.480	3.102	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@@H]1CNCc1ccc(C#N)cc1F	ZINC000772929480	1303596442	/nfs/dbraw/zinc/59/64/42/1303596442.db2.gz	SXHGCZGUTDBOHB-OAHLLOKOSA-N	0	3	333.407	3.186	20	30		EGEDHN
C#CC[C@@H](N[C@H](C)c1cccc(NS(C)(=O)=O)c1)c1ccccc1	ZINC000773117746	1303628580	/nfs/dbraw/zinc/62/85/80/1303628580.db2.gz	VZPAMPWXCFALSP-DNVCBOLYSA-N	0	3	342.464	3.473	20	30		EGEDHN
Cc1cc(CN(C)[C@H]2CCN(C(=O)OC(C)(C)C)C2)ccc1C#N	ZINC000774877662	1303870734	/nfs/dbraw/zinc/87/07/34/1303870734.db2.gz	MECXERMEKZZAMX-KRWDZBQOSA-N	0	3	329.444	3.308	20	30		EGEDHN
C#C[C@H](N[C@H](C)CC(=O)Nc1ccc(C)cc1Cl)[C@H]1CCCO1	ZINC000775572028	1303987639	/nfs/dbraw/zinc/98/76/39/1303987639.db2.gz	NWRFAJBKGIRNIB-UKPHBRMFSA-N	0	3	334.847	3.136	20	30		EGEDHN
C#C[C@H](N[C@H](C)CC(=O)Nc1cc(Cl)ccc1C)[C@H]1CCCO1	ZINC000775574362	1303988618	/nfs/dbraw/zinc/98/86/18/1303988618.db2.gz	PHNWIRIYBSIMRX-UKPHBRMFSA-N	0	3	334.847	3.136	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CNCCCOCC(F)(F)F	ZINC000778155566	1304405073	/nfs/dbraw/zinc/40/50/73/1304405073.db2.gz	DRFOZQRHYVCZHU-UHFFFAOYSA-N	0	3	335.753	3.411	20	30		EGEDHN
CN(C(=O)Nc1ccc(C#N)cn1)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000889226695	1304418998	/nfs/dbraw/zinc/41/89/98/1304418998.db2.gz	MQTZKHVMJQNRBB-SFHVURJKSA-N	0	3	349.438	3.082	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)[C@@H]1CCCCS1	ZINC000783352976	1305083079	/nfs/dbraw/zinc/08/30/79/1305083079.db2.gz	NZKOUKZJOOMTQA-WFASDCNBSA-N	0	3	332.425	3.018	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1Cl)C(=O)[C@H]1CCOC2(CCC2)C1	ZINC000892489451	1305401319	/nfs/dbraw/zinc/40/13/19/1305401319.db2.gz	KIZINFJAEGWMNG-QWHCGFSZSA-N	0	3	346.814	3.337	20	30		EGEDHN
Cc1nc(C)c(CC(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)s1	ZINC000892493972	1305405749	/nfs/dbraw/zinc/40/57/49/1305405749.db2.gz	WKTRYTDOORBHLJ-CYBMUJFWSA-N	0	3	347.827	3.303	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)Cc2nc(C)sc2C)cc1	ZINC000786311675	1305555246	/nfs/dbraw/zinc/55/52/46/1305555246.db2.gz	LQGZTLOLHMAARJ-OAHLLOKOSA-N	0	3	341.436	3.212	20	30		EGEDHN
CCc1cncc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)c1	ZINC000789404399	1306155288	/nfs/dbraw/zinc/15/52/88/1306155288.db2.gz	RRMKYNIOUYBEPC-ZDUSSCGKSA-N	0	3	327.771	3.259	20	30		EGEDHN
COC(=O)c1cc(CNCCSCc2ccccc2C#N)cs1	ZINC000894152774	1306249053	/nfs/dbraw/zinc/24/90/53/1306249053.db2.gz	CNRQTTZWMSWLOB-UHFFFAOYSA-N	0	3	346.477	3.429	20	30		EGEDHN
CN1CCN(c2cccc(Cl)c2C=[NH+][N-]c2ncccc2F)CC1	ZINC000794990350	1309644377	/nfs/dbraw/zinc/64/43/77/1309644377.db2.gz	MADHVDJDCRWASQ-UHFFFAOYSA-N	0	3	347.825	3.072	20	30		EGEDHN
COCCCON=C(C)c1ccc(OC)c(CN2CCCCC2)c1	ZINC000795056304	1309659310	/nfs/dbraw/zinc/65/93/10/1309659310.db2.gz	XLCYSKDDOZYRLT-UHFFFAOYSA-N	0	3	334.460	3.458	20	30		EGEDHN
Cc1ccc2c(c1)CC[C@H](C(=O)C(C#N)C(=O)Nc1ccccc1)O2	ZINC000796633783	1310052926	/nfs/dbraw/zinc/05/29/26/1310052926.db2.gz	OYLQKVPFXHOBJJ-FUHWJXTLSA-N	0	3	334.375	3.036	20	30		EGEDHN
C[C@H](CNC(=O)OC(C)(C)C)C(=O)C(C#N)c1nc2ccccc2o1	ZINC000796819779	1310093160	/nfs/dbraw/zinc/09/31/60/1310093160.db2.gz	SJRIKRYBSAENLD-VXGBXAGGSA-N	0	3	343.383	3.165	20	30		EGEDHN
C#CCN1CCC[C@H](CNC(=O)c2ccc(Cl)cc2Cl)C1	ZINC001023717738	1319852148	/nfs/dbraw/zinc/85/21/48/1319852148.db2.gz	JTGWRVJDMUTHLI-GFCCVEGCSA-N	0	3	325.239	3.068	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1[NH2+]Cc1cc(Br)cc(C)c1[O-]	ZINC000824955676	1320300518	/nfs/dbraw/zinc/30/05/18/1320300518.db2.gz	YHYVKCLJKMPDFD-KGLIPLIRSA-N	0	3	326.234	3.286	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2	ZINC000836490380	1320493873	/nfs/dbraw/zinc/49/38/73/1320493873.db2.gz	YFBUIWRKDHSXRW-ACDBMABISA-N	0	3	339.483	3.062	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N(CC)[C@H](C)c1cc2ccccc2o1	ZINC000836487216	1320493923	/nfs/dbraw/zinc/49/39/23/1320493923.db2.gz	BFPWISPXULXQQJ-MRXNPFEDSA-N	0	3	341.455	3.480	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N1CCC[C@@H]1c1ccc(Cl)cc1	ZINC000836488792	1320494215	/nfs/dbraw/zinc/49/42/15/1320494215.db2.gz	RAEBHBSCXDLZCH-QGZVFWFLSA-N	0	3	333.863	3.142	20	30		EGEDHN
C[C@@H](C#N)OCCN[C@H](COc1ccccc1F)c1ccccc1	ZINC000801937570	1316969558	/nfs/dbraw/zinc/96/95/58/1316969558.db2.gz	PZVZEXRBFBVWPV-MAUKXSAKSA-N	0	3	328.387	3.464	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CC[C@H](N[C@@H](C)c2ccccc2F)C1	ZINC001018968875	1316989673	/nfs/dbraw/zinc/98/96/73/1316989673.db2.gz	AJUWGLNXEVGKPA-HOTGVXAUSA-N	0	3	341.430	3.379	20	30		EGEDHN
COc1cc(O)c(CNCc2ccc(C#N)c(Cl)c2)cc1OC	ZINC000802657033	1317023374	/nfs/dbraw/zinc/02/33/74/1317023374.db2.gz	VNRCBAOWUDPVIV-UHFFFAOYSA-N	0	3	332.787	3.224	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](NCc3cc(C)ccc3OC)C2)C1	ZINC001019352442	1317187471	/nfs/dbraw/zinc/18/74/71/1317187471.db2.gz	ROOZJPGOTNJABH-KRWDZBQOSA-N	0	3	328.456	3.050	20	30		EGEDHN
Cc1ccc([C@H](C)C(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)o1	ZINC001019480833	1317271561	/nfs/dbraw/zinc/27/15/61/1317271561.db2.gz	HIXGUEBOXMVODJ-KBPBESRZSA-N	0	3	343.452	3.015	20	30		EGEDHN
CC1(C)C(C(=O)N[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)C1(C)C	ZINC001020053511	1317520419	/nfs/dbraw/zinc/52/04/19/1317520419.db2.gz	LWFJYTLTXAGVEI-SHTZXODSSA-N	0	3	343.446	3.116	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc(C(F)F)ccc2F)C1	ZINC001020162885	1317569112	/nfs/dbraw/zinc/56/91/12/1317569112.db2.gz	ZIEXEHPGWBZUJZ-XYPYZODXSA-N	0	3	332.753	3.366	20	30		EGEDHN
C#Cc1cccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)[C@H]2C)c1	ZINC000807621251	1317574546	/nfs/dbraw/zinc/57/45/46/1317574546.db2.gz	XMENUWCKZYZEMC-JXFKEZNVSA-N	0	3	333.435	3.452	20	30		EGEDHN
C#CCOc1ccccc1CNC[C@@H](OC)c1cccc(OC)c1	ZINC000858204099	1328710144	/nfs/dbraw/zinc/71/01/44/1328710144.db2.gz	GLLACTAORZKSNV-HXUWFJFHSA-N	0	3	325.408	3.185	20	30		EGEDHN
CC[C@H](NCc1ccc(OCCOC)nc1)c1cccc(C#N)c1	ZINC000902751354	1317613059	/nfs/dbraw/zinc/61/30/59/1317613059.db2.gz	UAGQRRPLEPGJRW-SFHVURJKSA-N	0	3	325.412	3.219	20	30		EGEDHN
C[C@H]1CC[C@@H](CC(=O)N[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)C1	ZINC001020482431	1317716423	/nfs/dbraw/zinc/71/64/23/1317716423.db2.gz	FQXYWGZZLSOJTI-DACLVMHWSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@H](NCc3oc(CCC)nc3C)C2)CC1	ZINC001020550018	1317761624	/nfs/dbraw/zinc/76/16/24/1317761624.db2.gz	DCMONSVQWHUZCC-QAQDUYKDSA-N	0	3	345.487	3.419	20	30		EGEDHN
CC[C@@H]1CCC[C@H]1C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001020554168	1317766919	/nfs/dbraw/zinc/76/69/19/1317766919.db2.gz	LWIBKEWZPXYWBJ-VDHUWJSZSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=Cc1ccc(C(=O)N[C@H]2C[C@H](NCc3ccc(C#N)cc3F)C2)cc1	ZINC001020621192	1317806138	/nfs/dbraw/zinc/80/61/38/1317806138.db2.gz	LPLMECKSIQBSAG-WGSAOQKQSA-N	0	3	349.409	3.391	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NC[C@@H](c1ccsc1)N(CC)CC	ZINC000810115641	1317954058	/nfs/dbraw/zinc/95/40/58/1317954058.db2.gz	MLYGPAVFJMNQQC-IBGZPJMESA-N	0	3	340.492	3.471	20	30		EGEDHN
CC(C)[C@]1(C)C[C@@H]1C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001020860515	1317969090	/nfs/dbraw/zinc/96/90/90/1317969090.db2.gz	QXLFELFJVALJMN-VIPLHTEESA-N	0	3	343.446	3.116	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc(C(F)(F)F)cc2)C1	ZINC001020967182	1318018636	/nfs/dbraw/zinc/01/86/36/1318018636.db2.gz	ZGWUTRQNJFJVOR-JOCQHMNTSA-N	0	3	332.753	3.308	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)c2ccoc2C(C)C)C1	ZINC001021111313	1318094675	/nfs/dbraw/zinc/09/46/75/1318094675.db2.gz	AKMPEPRRWVRVEI-HAQNSBGRSA-N	0	3	341.249	3.162	20	30		EGEDHN
CC(C)(C)C(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1cccc(C#N)c1	ZINC001021444045	1318254768	/nfs/dbraw/zinc/25/47/68/1318254768.db2.gz	ZIQYCSXGEMTQHY-AYHJJNSGSA-N	0	3	325.456	3.216	20	30		EGEDHN
CC(C)Oc1ccccc1CNC[C@@H]1CCCCN1C(=O)[C@@H](C)C#N	ZINC000959918285	1318266350	/nfs/dbraw/zinc/26/63/50/1318266350.db2.gz	DZXIPLZPSJCKHZ-WMZOPIPTSA-N	0	3	343.471	3.104	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCCC[C@H]1CNCc1ccc(F)cc1Cl	ZINC000959924286	1318268559	/nfs/dbraw/zinc/26/85/59/1318268559.db2.gz	IKLISWBNUJJXLA-DOMZBBRYSA-N	0	3	337.826	3.109	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@H]2CN(Cc3ccc(C#N)cc3)CC[C@@H]21	ZINC001021507614	1318323167	/nfs/dbraw/zinc/32/31/67/1318323167.db2.gz	ZTELHIHCZUKIEU-PMACEKPBSA-N	0	3	339.483	3.417	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)s1	ZINC000960152357	1318385170	/nfs/dbraw/zinc/38/51/70/1318385170.db2.gz	HMZOGYIUBKDAGB-CABCVRRESA-N	0	3	333.501	3.383	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ncccc1CC	ZINC000960275520	1318438770	/nfs/dbraw/zinc/43/87/70/1318438770.db2.gz	MJFKAKFNFISJJE-UYAOXDASSA-N	0	3	335.451	3.206	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccn(C)c1CC	ZINC000960304477	1318451550	/nfs/dbraw/zinc/45/15/50/1318451550.db2.gz	OCCCRVOUWGGQRA-UYAOXDASSA-N	0	3	337.467	3.149	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2coc3c2cccc3C)C1	ZINC001021607842	1318454302	/nfs/dbraw/zinc/45/43/02/1318454302.db2.gz	XUBUBPVMHJAZBQ-LPHOPBHVSA-N	0	3	336.435	3.301	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cccc2cc[nH]c21	ZINC000960316354	1318457720	/nfs/dbraw/zinc/45/77/20/1318457720.db2.gz	ZDSUAJUHDOVHRQ-UYAOXDASSA-N	0	3	331.419	3.339	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc2c([nH]1)CCCC2	ZINC000960319040	1318458817	/nfs/dbraw/zinc/45/88/17/1318458817.db2.gz	VRTOHRFRKXXFBM-UYAOXDASSA-N	0	3	335.451	3.065	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@@H]1C[C@H]1c1ccccc1	ZINC000960325856	1318462173	/nfs/dbraw/zinc/46/21/73/1318462173.db2.gz	GERYXOFHUZLQLB-DOIPELPJSA-N	0	3	332.447	3.348	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccccc1OC	ZINC000960326582	1318462585	/nfs/dbraw/zinc/46/25/85/1318462585.db2.gz	WVZBUXRPPFIMJG-UYAOXDASSA-N	0	3	336.435	3.257	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2cccc(CC)c2)C1	ZINC001021617597	1318466163	/nfs/dbraw/zinc/46/61/63/1318466163.db2.gz	WCRJBGAXLFUREJ-LEWJYISDSA-N	0	3	338.495	3.128	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(F)cc3ccoc32)C1	ZINC001021621052	1318470227	/nfs/dbraw/zinc/47/02/27/1318470227.db2.gz	YVLDIBRARFSPOF-CRAIPNDOSA-N	0	3	340.398	3.132	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(F)cc3ccoc32)C1	ZINC001021621054	1318470434	/nfs/dbraw/zinc/47/04/34/1318470434.db2.gz	YVLDIBRARFSPOF-MAUKXSAKSA-N	0	3	340.398	3.132	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cccc(C(C)C)n2)C1	ZINC001021621788	1318471987	/nfs/dbraw/zinc/47/19/87/1318471987.db2.gz	DGIQYLFRUMVEER-YLJYHZDGSA-N	0	3	339.483	3.155	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cccc(C(C)C)n2)C1	ZINC001021621787	1318472638	/nfs/dbraw/zinc/47/26/38/1318472638.db2.gz	DGIQYLFRUMVEER-XLIONFOSSA-N	0	3	339.483	3.155	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)Cc2c(C)cccc2Cl)C1	ZINC001021625381	1318475584	/nfs/dbraw/zinc/47/55/84/1318475584.db2.gz	PMFXIXUAXFHPOF-VQIMIIECSA-N	0	3	344.886	3.137	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@@H]1CN(C)Cc1ccc(OCC#N)cc1	ZINC000960382146	1318509163	/nfs/dbraw/zinc/50/91/63/1318509163.db2.gz	HKGBCKOOBRFIGO-GOSISDBHSA-N	0	3	343.471	3.058	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)Cc2cc(C)ccc2C)C1	ZINC001021661819	1318526012	/nfs/dbraw/zinc/52/60/12/1318526012.db2.gz	RSACPPKUYPEIAC-TZIWHRDSSA-N	0	3	338.495	3.182	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(C)cc2Cl)C1	ZINC001021673889	1318537538	/nfs/dbraw/zinc/53/75/38/1318537538.db2.gz	NDCSKTCPJIFGSK-YJBOKZPZSA-N	0	3	330.859	3.208	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2csc(C(C)(C)C)n2)C1	ZINC001021689745	1318565076	/nfs/dbraw/zinc/56/50/76/1318565076.db2.gz	ZRWFLEFIZJTYHC-ZBFHGGJFSA-N	0	3	345.512	3.000	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(C(F)F)cc2)C1	ZINC001021691760	1318566404	/nfs/dbraw/zinc/56/64/04/1318566404.db2.gz	RQBFOADZYFKQRE-SJORKVTESA-N	0	3	332.394	3.184	20	30		EGEDHN
C[C@](C#N)(NC(=O)C1C[C@H](c2ccccc2)OC1=O)C1CCCCC1	ZINC000813453389	1318567895	/nfs/dbraw/zinc/56/78/95/1318567895.db2.gz	IVYDLTGICYJDKF-SQGPQFPESA-N	0	3	340.423	3.270	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc3nc(C)ccc3c2)C1	ZINC001021697049	1318571562	/nfs/dbraw/zinc/57/15/62/1318571562.db2.gz	NMMDDQOBSYDKHB-PZJWPPBQSA-N	0	3	347.462	3.103	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC[C@H]1CN(C)Cc1cccc(C(F)F)c1	ZINC000960506381	1318615073	/nfs/dbraw/zinc/61/50/73/1318615073.db2.gz	ZDIKVNSBUICWBS-BBRMVZONSA-N	0	3	335.398	3.207	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc3c(s2)CCC3)C1	ZINC001021727893	1318624863	/nfs/dbraw/zinc/62/48/63/1318624863.db2.gz	OZDBBKVYVLQVPE-DLBZAZTESA-N	0	3	342.508	3.187	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cccc3c2CCC3)C1	ZINC001021742071	1318654430	/nfs/dbraw/zinc/65/44/30/1318654430.db2.gz	BTAPRXZOSKIMSP-RXVVDRJESA-N	0	3	336.479	3.125	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc3cc(C)ccc3o2)C1	ZINC001021742357	1318655623	/nfs/dbraw/zinc/65/56/23/1318655623.db2.gz	KGCMPKLJECJCDS-SJLPKXTDSA-N	0	3	336.435	3.301	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2c[nH]c3c2cccc3CC)C1	ZINC001021742990	1318658046	/nfs/dbraw/zinc/65/80/46/1318658046.db2.gz	OJARJLRYHVVCLD-XLIONFOSSA-N	0	3	349.478	3.290	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(F)c3occc32)C1	ZINC001021745063	1318662078	/nfs/dbraw/zinc/66/20/78/1318662078.db2.gz	YMNVZEZJMRSYCO-RDTXWAMCSA-N	0	3	340.398	3.132	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(F)c3occc32)C1	ZINC001021745058	1318662142	/nfs/dbraw/zinc/66/21/42/1318662142.db2.gz	YMNVZEZJMRSYCO-KDOFPFPSSA-N	0	3	340.398	3.132	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)C1CC(C)(C)C1	ZINC000960608691	1318734379	/nfs/dbraw/zinc/73/43/79/1318734379.db2.gz	PUBQPCPQXYNQOX-LJQANCHMSA-N	0	3	339.483	3.417	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)C1(C(F)F)CC1	ZINC000960644858	1318763357	/nfs/dbraw/zinc/76/33/57/1318763357.db2.gz	VKSFRFJYWLZLCG-INIZCTEOSA-N	0	3	347.409	3.026	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N(C)Cc1ccccc1Br	ZINC000911998281	1318793207	/nfs/dbraw/zinc/79/32/07/1318793207.db2.gz	KJUIKAFPIXANLV-CQSZACIVSA-N	0	3	325.250	3.091	20	30		EGEDHN
C[C@]1(C(=O)N[C@H]2C[C@@H](NCc3ccc(C#N)cc3F)C2)CC=CCC1	ZINC001022132564	1318814235	/nfs/dbraw/zinc/81/42/35/1318814235.db2.gz	JIYVMFGWUULALD-QKLQHJQFSA-N	0	3	341.430	3.181	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)C2(c3cccc(Cl)c3)CC2)C1	ZINC001022166293	1318825304	/nfs/dbraw/zinc/82/53/04/1318825304.db2.gz	SFJYFEOZQGXACJ-GASCZTMLSA-N	0	3	339.266	3.361	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1C[C@@H](NCc2ccccc2Cl)C1	ZINC001022202782	1318841143	/nfs/dbraw/zinc/84/11/43/1318841143.db2.gz	KXQPRJSXEINQPY-IYBDPMFKSA-N	0	3	343.858	3.378	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)CC1(C)CC1	ZINC000960746789	1318850046	/nfs/dbraw/zinc/85/00/46/1318850046.db2.gz	DZTBZPPVZYAGDX-GOSISDBHSA-N	0	3	325.456	3.171	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@@H](NC(=O)[C@H]3CCCC34CC4)C2)c(F)c1	ZINC001022280548	1318874546	/nfs/dbraw/zinc/87/45/46/1318874546.db2.gz	KBIOROGPJAUUOF-IXDOHACOSA-N	0	3	341.430	3.014	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@@H](NC(=O)C3(C4CC4)CCC3)C2)c1	ZINC001022502574	1318968185	/nfs/dbraw/zinc/96/81/85/1318968185.db2.gz	USIWUFWQLDZNKH-CALCHBBNSA-N	0	3	341.430	3.014	20	30		EGEDHN
N#CC(C(=O)COc1ccc(Cl)c(F)c1)C(=O)Nc1ccccc1	ZINC000815907460	1319071539	/nfs/dbraw/zinc/07/15/39/1319071539.db2.gz	BAENNJLRXXUQSJ-ZDUSSCGKSA-N	0	3	346.745	3.205	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N1CCC[C@H]1CN(C)Cc1ccccc1	ZINC000960927755	1319071858	/nfs/dbraw/zinc/07/18/58/1319071858.db2.gz	NFTPDKMVZUSJEI-UFYCRDLUSA-N	0	3	342.483	3.091	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001022739750	1319084194	/nfs/dbraw/zinc/08/41/94/1319084194.db2.gz	ZDNITOYXMHORSD-ZJPYXAASSA-N	0	3	343.446	3.116	20	30		EGEDHN
COc1ccc(CN(C)C[C@H]2CCCN2C(=O)C(C)(C)C)cc1C#N	ZINC000960993308	1319124031	/nfs/dbraw/zinc/12/40/31/1319124031.db2.gz	NORAIMMGWIUNAC-QGZVFWFLSA-N	0	3	343.471	3.036	20	30		EGEDHN
COc1ccc(CN(C)C[C@@H]2CCCN2C(=O)C(C)(C)C)cc1C#N	ZINC000960993306	1319124658	/nfs/dbraw/zinc/12/46/58/1319124658.db2.gz	NORAIMMGWIUNAC-KRWDZBQOSA-N	0	3	343.471	3.036	20	30		EGEDHN
C[C@@H](CC(=O)N1CCC[C@@H]1CN(C)Cc1ccc(C#N)cc1)C1CC1	ZINC000961041657	1319166092	/nfs/dbraw/zinc/16/60/92/1319166092.db2.gz	XQBVJJYDZHIHJY-OXJNMPFZSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc3nc(C)sc3c2)C1	ZINC001022931951	1319177014	/nfs/dbraw/zinc/17/70/14/1319177014.db2.gz	SQBSYHFLPFKTRN-BETUJISGSA-N	0	3	335.860	3.208	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@@H](NC(=O)[C@H]3CC34CCCC4)C2)c(F)c1	ZINC001022936350	1319179767	/nfs/dbraw/zinc/17/97/67/1319179767.db2.gz	JALCIBZLLQBYKM-IXDOHACOSA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)c2cc(C)cc(C)c2)C1	ZINC001023020640	1319224791	/nfs/dbraw/zinc/22/47/91/1319224791.db2.gz	HSZKHLZEIXFFMH-GASCZTMLSA-N	0	3	337.261	3.062	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)c2ccc(C3CC3)cc2)C1	ZINC001023115655	1319266193	/nfs/dbraw/zinc/26/61/93/1319266193.db2.gz	RFXXOVVSTPRKCJ-IYBDPMFKSA-N	0	3	349.272	3.323	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)Cc2cccc(OC(C)C)c2)C1	ZINC001023149963	1319294819	/nfs/dbraw/zinc/29/48/19/1319294819.db2.gz	OHVWUGXZSPZQNP-IYBDPMFKSA-N	0	3	336.863	3.006	20	30		EGEDHN
CCN(C(=O)OC(C)(C)C)[C@H](C)CNCc1ccc(C#N)c(F)c1	ZINC000817409410	1319351718	/nfs/dbraw/zinc/35/17/18/1319351718.db2.gz	KPQMUHIFLCMXCA-CYBMUJFWSA-N	0	3	335.423	3.432	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]([C@@H]2CCN(Cc3cnc(C)o3)C2)C1	ZINC000961229638	1319360042	/nfs/dbraw/zinc/36/00/42/1319360042.db2.gz	NCYHDNXEJMQPJI-DLBZAZTESA-N	0	3	345.487	3.256	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc(F)c3ccccc3c2)C1	ZINC001023406179	1319511777	/nfs/dbraw/zinc/51/17/77/1319511777.db2.gz	CNDZTOPPXJMXAF-MRXNPFEDSA-N	0	3	338.426	3.444	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@@H]1CCCN(Cc2ccsc2)C1	ZINC001023416011	1319520650	/nfs/dbraw/zinc/52/06/50/1319520650.db2.gz	RSHPHONJASOOHH-INIZCTEOSA-N	0	3	343.496	3.378	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1cccc(Oc2ccc(C#N)cc2)c1	ZINC000818584109	1319562940	/nfs/dbraw/zinc/56/29/40/1319562940.db2.gz	FKJPVFVWVUDWGH-UHFFFAOYSA-N	0	3	347.418	3.035	20	30		EGEDHN
C#CCN(C)CCCNC(=O)C(Cc1ccccc1)Cc1ccccc1	ZINC000818595680	1319565066	/nfs/dbraw/zinc/56/50/66/1319565066.db2.gz	JLJWJTLYECMUAF-UHFFFAOYSA-N	0	3	348.490	3.159	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCCN(Cc3ccsc3)C2)cc1	ZINC001023527606	1319632747	/nfs/dbraw/zinc/63/27/47/1319632747.db2.gz	YQAFRKQWZAYPBI-QGZVFWFLSA-N	0	3	338.476	3.371	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CCCN(Cc3ccccn3)C2)CC1	ZINC001023572426	1319688875	/nfs/dbraw/zinc/68/88/75/1319688875.db2.gz	CIKSDGBWBLNANO-QGZVFWFLSA-N	0	3	327.472	3.156	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2[C@H]3CN(Cc4sc(C)nc4C)C[C@H]32)CC1	ZINC000961673578	1319690035	/nfs/dbraw/zinc/69/00/35/1319690035.db2.gz	HKUVMNHISUDLHW-VQFNDLOPSA-N	0	3	345.512	3.053	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccccc2O[C@@H](C)CC)C1	ZINC001023620963	1319741795	/nfs/dbraw/zinc/74/17/95/1319741795.db2.gz	CTOBYNABLBXVID-ROUUACIJSA-N	0	3	342.483	3.329	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc(C)oc2C(F)(F)F)C1	ZINC001023623366	1319745725	/nfs/dbraw/zinc/74/57/25/1319745725.db2.gz	OTHXURNYFRAJID-ZDUSSCGKSA-N	0	3	342.361	3.072	20	30		EGEDHN
C=CCN1CCC[C@@H](CNC(=O)c2cc(C)oc2C(F)(F)F)C1	ZINC001023626482	1319748600	/nfs/dbraw/zinc/74/86/00/1319748600.db2.gz	ZYHFOQBJAMITEI-LBPRGKRZSA-N	0	3	330.350	3.235	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc(Cl)cc(Cl)c2)C1	ZINC001023719592	1319853693	/nfs/dbraw/zinc/85/36/93/1319853693.db2.gz	CVGUGVGHGBAKPZ-ZDUSSCGKSA-N	0	3	339.266	3.459	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc(C)nc3ccccc32)C1	ZINC001023735793	1319878201	/nfs/dbraw/zinc/87/82/01/1319878201.db2.gz	RABQJSKUVLWCJD-KRWDZBQOSA-N	0	3	335.451	3.008	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2c[nH]cc2-c2ccccc2)C1	ZINC001023750308	1319894888	/nfs/dbraw/zinc/89/48/88/1319894888.db2.gz	KAGLOQMVTSUTNC-QGZVFWFLSA-N	0	3	335.451	3.147	20	30		EGEDHN
C[C@H](CC(=O)C(C#N)C(=O)NC1CCCCC1)c1ccc(F)cc1	ZINC000918486337	1319955719	/nfs/dbraw/zinc/95/57/19/1319955719.db2.gz	ABFYGFACVRGBEC-CXAGYDPISA-N	0	3	330.403	3.477	20	30		EGEDHN
COc1ccc(CNCc2ccc3c(c2)OCCCCO3)cc1C#N	ZINC000824027554	1320223443	/nfs/dbraw/zinc/22/34/43/1320223443.db2.gz	NLYQOABQUTYGEK-UHFFFAOYSA-N	0	3	338.407	3.408	20	30		EGEDHN
COC(=O)C1(C#N)CCN([C@@H]2CC[C@](C)(c3ccccc3)C2)CC1	ZINC000824871438	1320292948	/nfs/dbraw/zinc/29/29/48/1320292948.db2.gz	GTNIPEONUWWEOC-MJGOQNOKSA-N	0	3	326.440	3.276	20	30		EGEDHN
COc1cc(C#N)ccc1C(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1	ZINC000930508104	1328881695	/nfs/dbraw/zinc/88/16/95/1328881695.db2.gz	NIYMFVSUPUBKGS-CRAIPNDOSA-N	0	3	349.434	3.132	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N[C@@H](C)c1ccc(SCC)cc1	ZINC000836278722	1320468680	/nfs/dbraw/zinc/46/86/80/1320468680.db2.gz	KTJMGXMRAHCNOE-HNNXBMFYSA-N	0	3	333.501	3.114	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N1CC[C@@H](C)C[C@H]1c1ccc(C)o1	ZINC000838622796	1320796222	/nfs/dbraw/zinc/79/62/22/1320796222.db2.gz	NLUCKQKNDZQBPS-WBVHZDCISA-N	0	3	331.460	3.026	20	30		EGEDHN
N#C[C@@H]1CCC[C@@H](OC(=O)C2CCN(c3ccc(Cl)cc3)C2=O)C1	ZINC000839049296	1320857818	/nfs/dbraw/zinc/85/78/18/1320857818.db2.gz	QKRCJORQZZOZRR-DAXOMENPSA-N	0	3	346.814	3.318	20	30		EGEDHN
N#CC(C(=O)NC1CCCC1)C(=O)[C@H]1CCSc2ccccc21	ZINC000842291249	1321367938	/nfs/dbraw/zinc/36/79/38/1321367938.db2.gz	GJWXROBSJCMGFO-LSDHHAIUSA-N	0	3	328.437	3.034	20	30		EGEDHN
CCN(CC(=O)C(C#N)c1nc(C2CC2)cs1)C(=O)OC(C)(C)C	ZINC000842943350	1321451951	/nfs/dbraw/zinc/45/19/51/1321451951.db2.gz	VLFNWWNNGRZUGA-LBPRGKRZSA-N	0	3	349.456	3.454	20	30		EGEDHN
Cc1cncc(C(=O)OCC2(C#N)CCN(Cc3ccccc3)CC2)c1	ZINC000847749029	1321900439	/nfs/dbraw/zinc/90/04/39/1321900439.db2.gz	LZNJXJPPWYEEIZ-UHFFFAOYSA-N	0	3	349.434	3.353	20	30		EGEDHN
C#CCN(CC)C[C@@H](O)CO[C@@H](c1ccccc1)c1ccccc1C	ZINC000920096053	1322136587	/nfs/dbraw/zinc/13/65/87/1322136587.db2.gz	UZNNCQYRBJKKKL-IRLDBZIGSA-N	0	3	337.463	3.417	20	30		EGEDHN
C[C@@H](Cc1ccncc1)NCc1cc(C#N)ccc1Br	ZINC000921819053	1322404654	/nfs/dbraw/zinc/40/46/54/1322404654.db2.gz	USSBKRGXTOMTRK-LBPRGKRZSA-N	0	3	330.229	3.437	20	30		EGEDHN
N#Cc1ccc(Br)c(CN[C@@H]2CCO[C@@H](C3CC3)C2)c1	ZINC000921999696	1322437375	/nfs/dbraw/zinc/43/73/75/1322437375.db2.gz	GPOXDCCDMHTCTA-GDBMZVCRSA-N	0	3	335.245	3.368	20	30		EGEDHN
CC[C@@H](NCc1cc(C#N)ccc1Br)[C@@H](O)C(C)C	ZINC000922186111	1322474616	/nfs/dbraw/zinc/47/46/16/1322474616.db2.gz	SXQXKARTTVEWSJ-CABCVRRESA-N	0	3	325.250	3.206	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCN(C(=O)CC2CCC2)C1	ZINC001023911668	1323018111	/nfs/dbraw/zinc/01/81/11/1323018111.db2.gz	XJYNAHZWEUYBSJ-KRWDZBQOSA-N	0	3	325.456	3.077	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCN(C(=O)CC2CCC2)C1	ZINC001023911669	1323018664	/nfs/dbraw/zinc/01/86/64/1323018664.db2.gz	XJYNAHZWEUYBSJ-QGZVFWFLSA-N	0	3	325.456	3.077	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H](CNCc2cc(F)ccc2C#N)C1)C1CC1	ZINC001023914910	1323021831	/nfs/dbraw/zinc/02/18/31/1323021831.db2.gz	DVKXOONCEIIQGB-GJZGRUSLSA-N	0	3	343.446	3.072	20	30		EGEDHN
N#Cc1ccc(CC[N@@H+](Cc2ccccc2[O-])C[C@@H]2CCCO2)cc1	ZINC000851841139	1323100606	/nfs/dbraw/zinc/10/06/06/1323100606.db2.gz	NHUUQSGXOVKQNF-FQEVSTJZSA-N	0	3	336.435	3.488	20	30		EGEDHN
N#Cc1ccc(CC[N@H+](Cc2ccccc2[O-])C[C@@H]2CCCO2)cc1	ZINC000851841139	1323100609	/nfs/dbraw/zinc/10/06/09/1323100609.db2.gz	NHUUQSGXOVKQNF-FQEVSTJZSA-N	0	3	336.435	3.488	20	30		EGEDHN
C#C[C@@](C)(CC)NCC(=O)NCc1ccccc1OC1CCCC1	ZINC000852102742	1323147534	/nfs/dbraw/zinc/14/75/34/1323147534.db2.gz	PECCVUSSLROWKF-FQEVSTJZSA-N	0	3	328.456	3.016	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H](CNCc2ccccc2C#N)C1	ZINC001024136421	1323161540	/nfs/dbraw/zinc/16/15/40/1323161540.db2.gz	ZXNZDLNKBKPTCZ-UWJYYQICSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H](CNCc3csc(CC)n3)C2)C1	ZINC001024148639	1323173677	/nfs/dbraw/zinc/17/36/77/1323173677.db2.gz	ZHZRVOADBKEIFG-HNNXBMFYSA-N	0	3	347.528	3.390	20	30		EGEDHN
CN(C(=O)C(C)(C)F)C1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC000962976885	1323179504	/nfs/dbraw/zinc/17/95/04/1323179504.db2.gz	UDDFDUFKJOBSRJ-UHFFFAOYSA-N	0	3	349.425	3.305	20	30		EGEDHN
C=C(C)C[N@@H+]1CCC[C@@H]1[C@@H]1CCCN(C(=O)c2ccccc2[O-])C1	ZINC000963248528	1323259754	/nfs/dbraw/zinc/25/97/54/1323259754.db2.gz	CJWMXCIMTODPRX-SJLPKXTDSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=C(C)C[N@H+]1CCC[C@@H]1[C@@H]1CCCN(C(=O)c2ccccc2[O-])C1	ZINC000963248528	1323259764	/nfs/dbraw/zinc/25/97/64/1323259764.db2.gz	CJWMXCIMTODPRX-SJLPKXTDSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)c2ccccc2O)C1	ZINC000963252411	1323263218	/nfs/dbraw/zinc/26/32/18/1323263218.db2.gz	VJJYMBHVEMIEKW-DOTOQJQBSA-N	0	3	348.874	3.461	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1oc2ccc(F)cc2c1C	ZINC001024480669	1323434456	/nfs/dbraw/zinc/43/44/56/1323434456.db2.gz	MJMMKSQOSDBNKH-MRXNPFEDSA-N	0	3	342.414	3.488	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@@H]1CCc2cc(C)ccc2O1	ZINC001024553535	1323494620	/nfs/dbraw/zinc/49/46/20/1323494620.db2.gz	CFVUQBJPISPLAP-QUCCMNQESA-N	0	3	342.483	3.235	20	30		EGEDHN
C=CCCN1CCCC[C@H]1CNC(=O)c1cc2nc(C)ccc2o1	ZINC001024766338	1323665090	/nfs/dbraw/zinc/66/50/90/1323665090.db2.gz	PRRKOTWWFFZFAE-HNNXBMFYSA-N	0	3	327.428	3.297	20	30		EGEDHN
C=CCCN1CCCC[C@@H]1CNC(=O)c1ccc(Br)o1	ZINC001024776319	1323677320	/nfs/dbraw/zinc/67/73/20/1323677320.db2.gz	XJLJWLOANZTRIU-GFCCVEGCSA-N	0	3	341.249	3.203	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccccc1OCC1CC1	ZINC001024813986	1323715081	/nfs/dbraw/zinc/71/50/81/1323715081.db2.gz	LBJLUURFJUVOIJ-SFHVURJKSA-N	0	3	340.467	3.083	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)c(F)c1	ZINC001024919008	1323783077	/nfs/dbraw/zinc/78/30/77/1323783077.db2.gz	RLESKFTYEXPESK-MFWALYKBSA-N	0	3	329.419	3.134	20	30		EGEDHN
O=C(C#CC1CC1)N1CCCC[C@@H]1CNCc1cccc(Cl)c1F	ZINC001024960180	1323801740	/nfs/dbraw/zinc/80/17/40/1323801740.db2.gz	OMOQWVLHRCCUNC-MRXNPFEDSA-N	0	3	348.849	3.363	20	30		EGEDHN
O=C(C#CC1CC1)N1CCCC[C@@H]1CNCc1cc(Cl)ccc1F	ZINC001024959688	1323802094	/nfs/dbraw/zinc/80/20/94/1323802094.db2.gz	FWVBOFWLLPXZBK-QGZVFWFLSA-N	0	3	348.849	3.363	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCCC[C@H]1CNCc1cccc(OC)n1	ZINC001025069907	1323870123	/nfs/dbraw/zinc/87/01/23/1323870123.db2.gz	RQTXTVLQZPBEQC-PXNSSMCTSA-N	0	3	345.487	3.163	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccccc1F	ZINC001025190340	1323967827	/nfs/dbraw/zinc/96/78/27/1323967827.db2.gz	AXFWHBIPRBXMOT-MOPGFXCFSA-N	0	3	328.431	3.308	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)Cc1cccs1	ZINC001025190918	1323969723	/nfs/dbraw/zinc/96/97/23/1323969723.db2.gz	CTPVYQQTKPLKHD-MSOLQXFVSA-N	0	3	330.497	3.159	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(Cl)c[nH]1	ZINC001025198626	1323980976	/nfs/dbraw/zinc/98/09/76/1323980976.db2.gz	QPTLOQKXCZLZKL-DLBZAZTESA-N	0	3	333.863	3.151	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1oc(C)cc1C	ZINC001025215756	1324008316	/nfs/dbraw/zinc/00/83/16/1324008316.db2.gz	CIZYZESWFAFUNP-QZTJIDSGSA-N	0	3	328.456	3.379	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cccc(CC)n1	ZINC001025241552	1324036148	/nfs/dbraw/zinc/03/61/48/1324036148.db2.gz	YIYHMRFSJHYXBF-RBUKOAKNSA-N	0	3	327.472	3.289	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cccc(C(C)C)n1	ZINC001025250287	1324050798	/nfs/dbraw/zinc/05/07/98/1324050798.db2.gz	ILCYFIUDGVKARD-UXHICEINSA-N	0	3	339.483	3.297	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccnc(C2CC2)c1	ZINC001025250779	1324052902	/nfs/dbraw/zinc/05/29/02/1324052902.db2.gz	NJYXZAOWHLRNIG-PMACEKPBSA-N	0	3	337.467	3.051	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1c(C)cc(C)nc1C	ZINC001025253864	1324059613	/nfs/dbraw/zinc/05/96/13/1324059613.db2.gz	XMQAPDUDJQUULN-RTBURBONSA-N	0	3	339.483	3.099	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(C2CC2)on1	ZINC001025254368	1324061832	/nfs/dbraw/zinc/06/18/32/1324061832.db2.gz	IFJRZMJVCZUMBE-ROUUACIJSA-N	0	3	341.455	3.034	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)Cc1cc(C)cc(C)c1	ZINC001025261673	1324072231	/nfs/dbraw/zinc/07/22/31/1324072231.db2.gz	AYTAVEYSGJMZMB-LEWJYISDSA-N	0	3	338.495	3.325	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc[nH]c1CCC	ZINC001025264325	1324076829	/nfs/dbraw/zinc/07/68/29/1324076829.db2.gz	ZLCPFHJRTFUSLZ-WOJBJXKFSA-N	0	3	341.499	3.450	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1nc(CC)oc1C	ZINC001025277067	1324097739	/nfs/dbraw/zinc/09/77/39/1324097739.db2.gz	NAFYDSCNWYTDCL-HZPDHXFCSA-N	0	3	331.460	3.191	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)Cc1ccsc1C	ZINC001025279070	1324100808	/nfs/dbraw/zinc/10/08/08/1324100808.db2.gz	YHGAPNRXCOEVTG-OALUTQOASA-N	0	3	344.524	3.468	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc2ccccc2n1	ZINC001025292655	1324117878	/nfs/dbraw/zinc/11/78/78/1324117878.db2.gz	LCXWYURYMYLLDD-NHCUHLMSSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc2ccccc2[nH]1	ZINC001025297419	1324129232	/nfs/dbraw/zinc/12/92/32/1324129232.db2.gz	PUWIDQROESDNSZ-PMACEKPBSA-N	0	3	335.451	3.260	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cccnc1OCC	ZINC001025298273	1324132108	/nfs/dbraw/zinc/13/21/08/1324132108.db2.gz	VSBNKKNVUWVAPA-ROUUACIJSA-N	0	3	343.471	3.125	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)CCc1ccc(C)s1	ZINC001025306911	1324140224	/nfs/dbraw/zinc/14/02/24/1324140224.db2.gz	KKMUHTQUKRUVOD-RTBURBONSA-N	0	3	344.524	3.468	20	30		EGEDHN
C[C@H](NC(=O)c1ccoc1)[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001025346529	1324192783	/nfs/dbraw/zinc/19/27/83/1324192783.db2.gz	URUAATOFCNJKLV-MAUKXSAKSA-N	0	3	337.423	3.182	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(C)c(OC)c(C)c2)C1	ZINC001025419953	1324253647	/nfs/dbraw/zinc/25/36/47/1324253647.db2.gz	QOXWLXLJKNVBBC-ZWKOTPCHSA-N	0	3	342.483	3.166	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc3ccccc3nc2C)C1	ZINC001025434621	1324273830	/nfs/dbraw/zinc/27/38/30/1324273830.db2.gz	XGEAMQMWWHLALL-LPHOPBHVSA-N	0	3	349.478	3.397	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc3ccccc3nc2C)C1	ZINC001025434622	1324274027	/nfs/dbraw/zinc/27/40/27/1324274027.db2.gz	XGEAMQMWWHLALL-QFBILLFUSA-N	0	3	349.478	3.397	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc3ccncc3s2)C1	ZINC001025438868	1324278943	/nfs/dbraw/zinc/27/89/43/1324278943.db2.gz	JARWVFUDFNGQDT-GOEBONIOSA-N	0	3	341.480	3.150	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2oc3ccc(F)cc3c2C)C1	ZINC001025441391	1324281401	/nfs/dbraw/zinc/28/14/01/1324281401.db2.gz	CUTUUELAQRFRRZ-HUUCEWRRSA-N	0	3	342.414	3.344	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(C3CC3)[nH]c2C2CC2)C1	ZINC001025456915	1324298353	/nfs/dbraw/zinc/29/83/53/1324298353.db2.gz	SWGBIWVNHAKHFW-WMLDXEAASA-N	0	3	339.483	3.233	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(C)c3ccccc3n2)C1	ZINC001025458055	1324299147	/nfs/dbraw/zinc/29/91/47/1324299147.db2.gz	GUALGVMMAXDITH-ROUUACIJSA-N	0	3	349.478	3.397	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N[C@H](C)[C@H]1CCCN(CC#CC)C1	ZINC001025460425	1324303621	/nfs/dbraw/zinc/30/36/21/1324303621.db2.gz	HYBLBCQPEUVZSK-MSOLQXFVSA-N	0	3	340.467	3.105	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc3c([nH]2)c(F)ccc3C)C1	ZINC001025465216	1324311222	/nfs/dbraw/zinc/31/12/22/1324311222.db2.gz	TXMODNKRSNAFAJ-GJZGRUSLSA-N	0	3	341.430	3.079	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(-n3cccc3)cc2)C1	ZINC001025474767	1324320051	/nfs/dbraw/zinc/32/00/51/1324320051.db2.gz	NRDONNRWTMLNDW-ICSRJNTNSA-N	0	3	349.478	3.331	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H](C)[C@H]2CCCN(Cc3ccccn3)C2)cc1	ZINC001025504059	1324353059	/nfs/dbraw/zinc/35/30/59/1324353059.db2.gz	XYARHFIUFGJHEY-PXNSSMCTSA-N	0	3	347.462	3.093	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cnc3ccsc3c2)C1	ZINC001025503871	1324353760	/nfs/dbraw/zinc/35/37/60/1324353760.db2.gz	VWBVGQTUNZWVEJ-LSDHHAIUSA-N	0	3	341.480	3.150	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(Cl)cc2OC)C1	ZINC001025520107	1324363984	/nfs/dbraw/zinc/36/39/84/1324363984.db2.gz	RNAFJGZWDHUDOA-HUUCEWRRSA-N	0	3	348.874	3.202	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2c(F)ccc(C)c2F)C1	ZINC001025524004	1324369531	/nfs/dbraw/zinc/36/95/31/1324369531.db2.gz	RLMNRLRETIVLFW-HUUCEWRRSA-N	0	3	334.410	3.127	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccccc2OC2CCC2)C1	ZINC001025532218	1324377623	/nfs/dbraw/zinc/37/76/23/1324377623.db2.gz	WLUDACPDTKBNEH-DLBZAZTESA-N	0	3	340.467	3.081	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(C3CC3)nc2C)C1	ZINC001025533483	1324378920	/nfs/dbraw/zinc/37/89/20/1324378920.db2.gz	FDKLNTRGVUBBGH-MAUKXSAKSA-N	0	3	339.483	3.121	20	30		EGEDHN
CC(C)(C)[C@@H]1CSCCN1CCC(=O)Nc1sccc1C#N	ZINC000931590233	1329150007	/nfs/dbraw/zinc/15/00/07/1329150007.db2.gz	NNFDZXJGTFCOTM-ZDUSSCGKSA-N	0	3	337.514	3.412	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc3cnccc3c2)C1	ZINC001025587758	1324431091	/nfs/dbraw/zinc/43/10/91/1324431091.db2.gz	PNIYCJNDVVTYNU-OXJNMPFZSA-N	0	3	335.451	3.088	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccsc2C(F)(F)F)C1	ZINC001025603106	1324451895	/nfs/dbraw/zinc/45/18/95/1324451895.db2.gz	QPNCVKSOVHRSIW-VXGBXAGGSA-N	0	3	344.402	3.230	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(-c3cccs3)o2)C1	ZINC001025607148	1324457556	/nfs/dbraw/zinc/45/75/56/1324457556.db2.gz	SGNNXJYEOIEVSY-GJZGRUSLSA-N	0	3	342.464	3.472	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(C)nc3ccccc32)C1	ZINC001025609139	1324460567	/nfs/dbraw/zinc/46/05/67/1324460567.db2.gz	DSSCBNOFLKTNKJ-ZWKOTPCHSA-N	0	3	349.478	3.397	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc3ncsc3c2)C1	ZINC001025609954	1324461281	/nfs/dbraw/zinc/46/12/81/1324461281.db2.gz	IOMNWAUNKCISFA-GOEBONIOSA-N	0	3	341.480	3.150	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(C3CCCC3)no2)C1	ZINC001025624209	1324474342	/nfs/dbraw/zinc/47/43/42/1324474342.db2.gz	BTHDKIOUYZTCIS-RDJZCZTQSA-N	0	3	343.471	3.186	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2csc(CC(C)C)n2)C1	ZINC001025631668	1324483659	/nfs/dbraw/zinc/48/36/59/1324483659.db2.gz	CTBQIWFZLWRUMQ-HOTGVXAUSA-N	0	3	347.528	3.195	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(-c3ccccc3)co2)C1	ZINC001025640383	1324490780	/nfs/dbraw/zinc/49/07/80/1324490780.db2.gz	MLIDOKUYZVUXIO-FUHWJXTLSA-N	0	3	336.435	3.410	20	30		EGEDHN
N#Cc1cccc(C[NH2+]C2CCC(NC(=O)c3ccccc3[O-])CC2)c1	ZINC001026456444	1324819786	/nfs/dbraw/zinc/81/97/86/1324819786.db2.gz	NYLKBCHCYKTGEL-UHFFFAOYSA-N	0	3	349.434	3.095	20	30		EGEDHN
CC(C)(CC(=O)N1CC[C@H](CNCc2ccccc2C#N)C1)C1CC1	ZINC001026827475	1325036593	/nfs/dbraw/zinc/03/65/93/1325036593.db2.gz	DFQLXJGUNTUGSP-MRXNPFEDSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](CNCc2oc(CCC)nc2C)C1	ZINC001026988641	1325127481	/nfs/dbraw/zinc/12/74/81/1325127481.db2.gz	LSFALLXTHANBGA-INIZCTEOSA-N	0	3	347.503	3.476	20	30		EGEDHN
CC1(C)CCC[C@H]1C(=O)N1CC[C@@H](CNCc2ccccc2C#N)C1	ZINC001027003802	1325143668	/nfs/dbraw/zinc/14/36/68/1325143668.db2.gz	ZKJDLXISEYSNGM-LPHOPBHVSA-N	0	3	339.483	3.323	20	30		EGEDHN
Cc1cccc(CC(=O)N2CC[C@@H](CNCc3ccccc3C#N)C2)c1	ZINC001027031160	1325166215	/nfs/dbraw/zinc/16/62/15/1325166215.db2.gz	DVUMDPKCUZNFSY-IBGZPJMESA-N	0	3	347.462	3.048	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](CNCc3nc(C)c(C)s3)C2)C1	ZINC001027050436	1325189329	/nfs/dbraw/zinc/18/93/29/1325189329.db2.gz	BKEWSHGFUCEZQB-OAHLLOKOSA-N	0	3	333.501	3.054	20	30		EGEDHN
C[C@H](CC(C)(C)C#N)N[C@H](Cc1ccccc1)[C@H](O)C(F)(F)F	ZINC000925850244	1325329627	/nfs/dbraw/zinc/32/96/27/1325329627.db2.gz	GYCUHDAOSDVLEY-YUELXQCFSA-N	0	3	328.378	3.439	20	30		EGEDHN
Cc1ccc(C(=O)N2CCC[C@@H](N(C)Cc3cccc(C#N)c3)C2)o1	ZINC001027285937	1325415898	/nfs/dbraw/zinc/41/58/98/1325415898.db2.gz	JHMBRFWYRBVORT-GOSISDBHSA-N	0	3	337.423	3.196	20	30		EGEDHN
Cc1occc1C(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001027290224	1325424529	/nfs/dbraw/zinc/42/45/29/1325424529.db2.gz	RBNXDXQDGCDKJS-GOSISDBHSA-N	0	3	337.423	3.196	20	30		EGEDHN
CCCOc1cccc(CN(C)[C@H]2CCCN(C(=O)[C@H](C)C#N)C2)c1	ZINC001027335065	1325492756	/nfs/dbraw/zinc/49/27/56/1325492756.db2.gz	BKWOSMLKLXZQKC-AEFFLSMTSA-N	0	3	343.471	3.058	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)c(F)c2)C1	ZINC001027355794	1325530969	/nfs/dbraw/zinc/53/09/69/1325530969.db2.gz	AYMOPJJODOYTKQ-ZGKREOHOSA-N	0	3	329.419	3.086	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)[C@H]2CC2(C)C)C1	ZINC001027373999	1325568860	/nfs/dbraw/zinc/56/88/60/1325568860.db2.gz	WYKQANWGFOOERR-ZWKOTPCHSA-N	0	3	325.456	3.027	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)/C=C/c2ccc[nH]2)C1	ZINC001027381779	1325578630	/nfs/dbraw/zinc/57/86/30/1325578630.db2.gz	HKGRLSDJLJIUKO-XTXLJPNXSA-N	0	3	348.450	3.023	20	30		EGEDHN
CC1(C(=O)NC2CC3(CC(NCc4ccccc4C#N)C3)C2)CCC1	ZINC000964613351	1325579145	/nfs/dbraw/zinc/57/91/45/1325579145.db2.gz	VCDHYXRMZRHMBJ-UHFFFAOYSA-N	0	3	337.467	3.265	20	30		EGEDHN
CC(=O)N[C@H](CC(C)C)C(=O)C(C#N)c1ncc(C(C)(C)C)s1	ZINC000860732570	1329349313	/nfs/dbraw/zinc/34/93/13/1329349313.db2.gz	LCFJWMKYSIPVRL-QWHCGFSZSA-N	0	3	335.473	3.168	20	30		EGEDHN
CN(Cc1cccc(Cl)c1)[C@@H]1CCCN(C(=O)C#CC2CC2)C1	ZINC001027405393	1327632672	/nfs/dbraw/zinc/63/26/72/1327632672.db2.gz	GSLQKPQXWVXNLQ-GOSISDBHSA-N	0	3	330.859	3.176	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)c2cc(Cl)sc2Cl)C1	ZINC001027443546	1327684267	/nfs/dbraw/zinc/68/42/67/1327684267.db2.gz	MWBBIBKMRCBJCN-SNVBAGLBSA-N	0	3	331.268	3.225	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)C2(C3CC3)CC2)C1	ZINC001027455957	1327696968	/nfs/dbraw/zinc/69/69/68/1327696968.db2.gz	NBKFZTGLRUYKDW-IBGZPJMESA-N	0	3	337.467	3.171	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)C2(CC)CCC(F)(F)CC2)C1	ZINC001027465948	1327719034	/nfs/dbraw/zinc/71/90/34/1327719034.db2.gz	GLESBWGWAWQRRF-OAHLLOKOSA-N	0	3	326.431	3.148	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)c2cc3c(o2)c(F)ccc3C)C1	ZINC001027504329	1327768385	/nfs/dbraw/zinc/76/83/85/1327768385.db2.gz	FHVQOWGVHVJNME-CQSZACIVSA-N	0	3	328.387	3.050	20	30		EGEDHN
CN(Cc1ccc(C#N)c(F)c1)[C@@H]1CCCN(C(=O)C2(C)CCC2)C1	ZINC001027528906	1327809745	/nfs/dbraw/zinc/80/97/45/1327809745.db2.gz	CZDHQWUYUPJZQB-QGZVFWFLSA-N	0	3	343.446	3.310	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)cc2)C1)C(C)(F)F	ZINC001027580579	1327916160	/nfs/dbraw/zinc/91/61/60/1327916160.db2.gz	XVCAQQUOEBIQAI-WMLDXEAASA-N	0	3	349.425	3.272	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CCC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001027604532	1327959630	/nfs/dbraw/zinc/95/96/30/1327959630.db2.gz	RJCILPZOGJHTGT-APWZRJJASA-N	0	3	327.472	3.273	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)c2ccc(O[C@H](C)CC)cc2)C1	ZINC001027640339	1328013545	/nfs/dbraw/zinc/01/35/45/1328013545.db2.gz	QURIQGSZEXXWMH-SJLPKXTDSA-N	0	3	328.456	3.034	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)c2cc3c(s2)CCCCC3)C1	ZINC001027671023	1328066044	/nfs/dbraw/zinc/06/60/44/1328066044.db2.gz	QWDGQOUAJWELEH-INIZCTEOSA-N	0	3	330.497	3.187	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)CC2C3CC4CC(C3)CC2C4)C1	ZINC001027686873	1328085905	/nfs/dbraw/zinc/08/59/05/1328085905.db2.gz	FWFMQXRCUJPJEK-RDOIFFKNSA-N	0	3	328.500	3.005	20	30		EGEDHN
C=C(Cl)CN(C)[C@H]1CCCN(C(=O)c2cccc(CN(C)C)c2)C1	ZINC001027692349	1328097009	/nfs/dbraw/zinc/09/70/09/1328097009.db2.gz	GPLOXHRNYIDGDK-SFHVURJKSA-N	0	3	349.906	3.037	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cccc(C(F)F)c2F)C1	ZINC000966165358	1328212143	/nfs/dbraw/zinc/21/21/43/1328212143.db2.gz	FTPWNSWKJCLSMS-DOMZBBRYSA-N	0	3	338.373	3.227	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2c(F)c(F)cc(F)c2F)C1	ZINC000966260872	1328240095	/nfs/dbraw/zinc/24/00/95/1328240095.db2.gz	GFAOAQFSHSDTDJ-GWCFXTLKSA-N	0	3	344.352	3.259	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2cccc3c2CCCCC3)C1	ZINC000966888439	1328455034	/nfs/dbraw/zinc/45/50/34/1328455034.db2.gz	RNRJAQLFECHACU-UWJYYQICSA-N	0	3	338.495	3.419	20	30		EGEDHN
C#CCN1CCC(C(=O)NCCCCCCc2ccccc2)CC1	ZINC000862626589	1329499562	/nfs/dbraw/zinc/49/95/62/1329499562.db2.gz	IGRFIRXRAUWKTH-UHFFFAOYSA-N	0	3	326.484	3.251	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)Cc3cccc(C)c3Cl)C2)CC1	ZINC001050591013	1348295537	/nfs/dbraw/zinc/29/55/37/1348295537.db2.gz	RRNYXOHKRPUKBH-UHFFFAOYSA-N	0	3	344.886	3.139	20	30		EGEDHN
C=C(C)c1cccc(NC(=O)NC[C@H]2CCN2C2CCOCC2)c1	ZINC000934886815	1330014955	/nfs/dbraw/zinc/01/49/55/1330014955.db2.gz	MMWMLISPDCMTIX-GOSISDBHSA-N	0	3	329.444	3.095	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccccc2C(C)(C)C)[C@@H](C)C1	ZINC000942164441	1331855629	/nfs/dbraw/zinc/85/56/29/1331855629.db2.gz	RUKWBUYUVRVXFH-LPHOPBHVSA-N	0	3	326.484	3.448	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(C)n(C(CC)CC)n2)[C@@H](C)C1	ZINC000942207302	1331879754	/nfs/dbraw/zinc/87/97/54/1331879754.db2.gz	KYTFBAUFNBXTCK-YOEHRIQHSA-N	0	3	332.492	3.179	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2csc(C(F)(F)F)c2)[C@@H](C)C1	ZINC000942260024	1331890061	/nfs/dbraw/zinc/89/00/61/1331890061.db2.gz	WBGQWGJARNLRNP-CMPLNLGQSA-N	0	3	332.391	3.393	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnc3c(F)cccc3c2)[C@H](C)C1	ZINC000942497699	1331947173	/nfs/dbraw/zinc/94/71/73/1331947173.db2.gz	ULOBPCWDBTUKDB-DYVFJYSZSA-N	0	3	327.403	3.000	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(CCC(F)(F)F)C[C@@H]2C)cc1	ZINC000942553849	1331970352	/nfs/dbraw/zinc/97/03/52/1331970352.db2.gz	UXEKIQOUPLPCHK-BBRMVZONSA-N	0	3	338.373	3.061	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(F)c(Cl)c2F)[C@@H](C)C1	ZINC000942602398	1331999968	/nfs/dbraw/zinc/99/99/68/1331999968.db2.gz	ILNGHNBITKDTJN-SMDDNHRTSA-N	0	3	340.801	3.082	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3cccc(C#N)c3)C[C@H]2C)C1	ZINC000942603018	1332000824	/nfs/dbraw/zinc/00/08/24/1332000824.db2.gz	QUFQUAZPZINCLZ-VQIMIIECSA-N	0	3	337.467	3.241	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3ncccc3C)C[C@H]2C)C1	ZINC000942603122	1332001084	/nfs/dbraw/zinc/00/10/84/1332001084.db2.gz	SGTRTCYWPVSKIE-SJORKVTESA-N	0	3	327.472	3.073	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc(C(F)F)cc2F)[C@H](C)C1	ZINC000943756165	1332254668	/nfs/dbraw/zinc/25/46/68/1332254668.db2.gz	MCGVFLXURWEFLL-ABAIWWIYSA-N	0	3	326.362	3.390	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc3ccsc32)[C@H](C)C1	ZINC000943985877	1332303944	/nfs/dbraw/zinc/30/39/44/1332303944.db2.gz	BJGLZPRDBLXMCB-PBHICJAKSA-N	0	3	326.465	3.365	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(Cl)c3occc32)[C@@H](C)C1	ZINC000944135108	1332333347	/nfs/dbraw/zinc/33/33/47/1332333347.db2.gz	IPGHEAFCWXTXFI-BLLLJJGKSA-N	0	3	330.815	3.160	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cccc(Cl)c2Cl)[C@@H](C)C1	ZINC000944304146	1332367395	/nfs/dbraw/zinc/36/73/95/1332367395.db2.gz	GOLFJGNTTXSEPM-SMDDNHRTSA-N	0	3	325.239	3.067	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(Cl)cc2Cl)[C@@H](C)C1	ZINC000944304848	1332367863	/nfs/dbraw/zinc/36/78/63/1332367863.db2.gz	LQLFZKKYFAKVEL-XHDPSFHLSA-N	0	3	325.239	3.067	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(Cl)c(Cl)c2)[C@@H](C)C1	ZINC000944305997	1332368904	/nfs/dbraw/zinc/36/89/04/1332368904.db2.gz	QFKSUUMMATUPHC-XHDPSFHLSA-N	0	3	325.239	3.067	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(COC(C)C)cc2)[C@H](C)C1	ZINC000944810303	1332426982	/nfs/dbraw/zinc/42/69/82/1332426982.db2.gz	HONHCFGRKWYEHD-XLIONFOSSA-N	0	3	342.483	3.075	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(-c3ccccc3)[nH]2)[C@H](C)C1	ZINC000945806546	1332678676	/nfs/dbraw/zinc/67/86/76/1332678676.db2.gz	DZZJEANXKZTRCT-AEFFLSMTSA-N	0	3	335.451	3.145	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CN(Cc3ccns3)C[C@H]2CC1	ZINC000946707123	1332881128	/nfs/dbraw/zinc/88/11/28/1332881128.db2.gz	HCNFWVVJFVGCIR-GASCZTMLSA-N	0	3	333.501	3.026	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2coc3c2cccc3OC)C[C@@H]1C	ZINC000947314543	1333085738	/nfs/dbraw/zinc/08/57/38/1333085738.db2.gz	GUTZTHLVEGEZSB-LSDHHAIUSA-N	0	3	340.423	3.047	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(F)cc3ccncc32)C[C@H]1C	ZINC000947318228	1333086837	/nfs/dbraw/zinc/08/68/37/1333086837.db2.gz	FVSBVSDILJVYIK-CJNGLKHVSA-N	0	3	327.403	3.143	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)C2(C3CC3)CC2)CCN1Cc1ccc(C#N)cc1	ZINC000947425716	1333122198	/nfs/dbraw/zinc/12/21/98/1333122198.db2.gz	KRZIBGDVGVJDPK-HNAYVOBHSA-N	0	3	337.467	3.218	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)c3ccccc3n2)C[C@H]1C	ZINC000947456276	1333136059	/nfs/dbraw/zinc/13/60/59/1333136059.db2.gz	YXKUOXFVWWLPNJ-IAGOWNOFSA-N	0	3	335.451	3.149	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2coc3cc(F)ccc23)C[C@H]1C	ZINC000947473918	1333142291	/nfs/dbraw/zinc/14/22/91/1333142291.db2.gz	PLTIRPLHTUPVAW-UKRRQHHQSA-N	0	3	328.387	3.178	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2scnc2C2CCCC2)C[C@@H]1C	ZINC000947505997	1333149718	/nfs/dbraw/zinc/14/97/18/1333149718.db2.gz	ICACXLSBBPXWHL-HOCLYGCPSA-N	0	3	345.512	3.407	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2oc3ccccc3c2OC)C[C@@H]1C	ZINC000947611888	1333192449	/nfs/dbraw/zinc/19/24/49/1333192449.db2.gz	ROOWLWSQAWLIAO-LSDHHAIUSA-N	0	3	340.423	3.047	20	30		EGEDHN
Cc1ncccc1C(=O)N[C@@H]1CCN(Cc2cccc(C#N)c2)[C@@H](C)C1	ZINC000947669955	1333216570	/nfs/dbraw/zinc/21/65/70/1333216570.db2.gz	ANHGOVJAWCMIME-HNAYVOBHSA-N	0	3	348.450	3.045	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccccc2OC2CCC2)C[C@@H]1C	ZINC000947712039	1333237030	/nfs/dbraw/zinc/23/70/30/1333237030.db2.gz	ZYFDXKSZHKWTNA-IRXDYDNUSA-N	0	3	340.467	3.224	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(C)oc2C(F)(F)F)C[C@@H]1C	ZINC000947758287	1333253433	/nfs/dbraw/zinc/25/34/33/1333253433.db2.gz	LDQIJKUJXOMCCX-JQWIXIFHSA-N	0	3	330.350	3.376	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnn(CCC(C)C)c2C)C[C@@H]1C	ZINC000947903675	1333300045	/nfs/dbraw/zinc/30/00/45/1333300045.db2.gz	LYSRDBSRVJIIIL-DOTOQJQBSA-N	0	3	332.492	3.006	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccccc2OC(C)C)C[C@@H]1C	ZINC000947948137	1333315424	/nfs/dbraw/zinc/31/54/24/1333315424.db2.gz	KZMSUWPZPFOLKF-DLBZAZTESA-N	0	3	328.456	3.080	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)C[C@H]1C	ZINC000947963259	1333322791	/nfs/dbraw/zinc/32/27/91/1333322791.db2.gz	SJJPGMHEEOIQHN-IUODEOHRSA-N	0	3	326.362	3.474	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3ccccc3)CCCC2)C[C@H]1C	ZINC000948001681	1333338220	/nfs/dbraw/zinc/33/82/20/1333338220.db2.gz	DHALBUYBIZIQSL-UYAOXDASSA-N	0	3	338.495	3.491	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2coc3cc(C)ccc23)C[C@H]1C	ZINC000948002094	1333338919	/nfs/dbraw/zinc/33/89/19/1333338919.db2.gz	KMQJQAGULAUYEN-AEFFLSMTSA-N	0	3	338.451	3.276	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](NC(=O)c2cccc(CN(C)C)c2)C[C@H]1C	ZINC000948057686	1333358570	/nfs/dbraw/zinc/35/85/70/1333358570.db2.gz	XSUUSPKRQIOMKX-QAPCUYQASA-N	0	3	349.906	3.083	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2sc(C(C)(C)C)nc2C)C[C@H]1C	ZINC000948091181	1333372142	/nfs/dbraw/zinc/37/21/42/1333372142.db2.gz	VDLIZTACCIEXJM-UKRRQHHQSA-N	0	3	347.528	3.355	20	30		EGEDHN
CN(C(=O)c1cccnc1)[C@H]1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC000948128069	1333382448	/nfs/dbraw/zinc/38/24/48/1333382448.db2.gz	IJVIHCZRVBOAAW-FQEVSTJZSA-N	0	3	348.450	3.080	20	30		EGEDHN
CN(C(=O)c1ccc[nH]1)[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948180840	1333411154	/nfs/dbraw/zinc/41/11/54/1333411154.db2.gz	FWVRMMGRQDYUQX-GOSISDBHSA-N	0	3	336.439	3.013	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)[C@@H]2C[C@H]2c2sccc2C)CC1	ZINC000948373742	1333500047	/nfs/dbraw/zinc/50/00/47/1333500047.db2.gz	NYKFFNPCUMYFJR-RCCFBDPRSA-N	0	3	344.524	3.496	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2conc2C2CCCC2)CC1	ZINC000948432797	1333522527	/nfs/dbraw/zinc/52/25/27/1333522527.db2.gz	LAMFYXBSSQTJGT-KRWDZBQOSA-N	0	3	343.471	3.282	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2ccc(Cl)cn2)C12CCC2	ZINC001078786436	1357081898	/nfs/dbraw/zinc/08/18/98/1357081898.db2.gz	VQXDSFUILNYKOF-ZIAGYGMSSA-N	0	3	340.254	3.118	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)Cc2cccc(CC)c2)CC1	ZINC000948560635	1333576400	/nfs/dbraw/zinc/57/64/00/1333576400.db2.gz	CYCJDGCVWBHIRW-FQEVSTJZSA-N	0	3	326.484	3.128	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2csc(C(F)(F)F)c2)CC1	ZINC000948586603	1333586123	/nfs/dbraw/zinc/58/61/23/1333586123.db2.gz	KFCVDCNXDIVOCW-CYBMUJFWSA-N	0	3	344.402	3.327	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)Cc2cccc3ncccc23)CC1	ZINC000948613343	1333597394	/nfs/dbraw/zinc/59/73/94/1333597394.db2.gz	XXXSMAJENZKVND-LJQANCHMSA-N	0	3	349.478	3.114	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2cc3c(o2)c(F)ccc3C)CC1	ZINC000948647464	1333611222	/nfs/dbraw/zinc/61/12/22/1333611222.db2.gz	IHQAXUXIFOMJBJ-HNNXBMFYSA-N	0	3	342.414	3.440	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cc3ccc(C)cc3[nH]2)CC1	ZINC000948656070	1333616221	/nfs/dbraw/zinc/61/62/21/1333616221.db2.gz	SWWMAZOQKHCNTP-GOSISDBHSA-N	0	3	337.467	3.426	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@H]2CCCN(Cc3ccccn3)CC2)cc1	ZINC000948665979	1333621948	/nfs/dbraw/zinc/62/19/48/1333621948.db2.gz	XHAOTFYHOWOOEZ-NRFANRHFSA-N	0	3	347.462	3.190	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2ccc3c(c2)[C@@H](C)CO3)CC1	ZINC000948701273	1333638551	/nfs/dbraw/zinc/63/85/51/1333638551.db2.gz	UEEYKDYYUPVCCA-FUHWJXTLSA-N	0	3	340.467	3.132	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2ccc(F)c(F)c2F)CC1	ZINC000948730220	1333650189	/nfs/dbraw/zinc/65/01/89/1333650189.db2.gz	TUMYLEBHXAEFJL-ZDUSSCGKSA-N	0	3	338.373	3.054	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cccc(Cl)c2F)CC1	ZINC000948734431	1333651754	/nfs/dbraw/zinc/65/17/54/1333651754.db2.gz	QWBNPQODPUHXDK-CQSZACIVSA-N	0	3	336.838	3.429	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2c(F)ccc(F)c2Cl)CC1	ZINC000948800697	1333684682	/nfs/dbraw/zinc/68/46/82/1333684682.db2.gz	YEHHASZQFIOMBE-GFCCVEGCSA-N	0	3	340.801	3.178	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2ccccc2OCC(C)C)CC1	ZINC000948864985	1333714325	/nfs/dbraw/zinc/71/43/25/1333714325.db2.gz	LGESGIWJIPRKQZ-GOSISDBHSA-N	0	3	342.483	3.281	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@@H]1CNC(=O)c1coc(C)n1	ZINC000948913211	1333731274	/nfs/dbraw/zinc/73/12/74/1333731274.db2.gz	PZKPBLMQGFBTBI-IBGZPJMESA-N	0	3	339.439	3.278	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NC[C@H]1c2ccccc2CCN1CCC	ZINC000948969367	1333750647	/nfs/dbraw/zinc/75/06/47/1333750647.db2.gz	HHJFOHHNEFNJHX-UFYCRDLUSA-N	0	3	342.483	3.093	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3sc(C)cc3C)CC2)C1	ZINC000949379176	1333834366	/nfs/dbraw/zinc/83/43/66/1333834366.db2.gz	QVYJCRHDCKLTAT-UHFFFAOYSA-N	0	3	348.512	3.248	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@@H](C)C(C)(C)C)CC2)C1	ZINC000949398331	1333837080	/nfs/dbraw/zinc/83/70/80/1333837080.db2.gz	IVOUIUONXJMOLN-QGZVFWFLSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@H]3CCC[C@H]3CCC)CC2)C1	ZINC000949402265	1333838436	/nfs/dbraw/zinc/83/84/36/1333838436.db2.gz	XAGBQBCRAUMBLL-MOPGFXCFSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C3(C4CCC4)CCC3)CC2)C1	ZINC000949427812	1333844842	/nfs/dbraw/zinc/84/48/42/1333844842.db2.gz	ZWMMDMGQBBMMGE-UHFFFAOYSA-N	0	3	346.515	3.226	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C[C@@H]3CC[C@H](C)C3)CC2)C1	ZINC000949445048	1333848926	/nfs/dbraw/zinc/84/89/26/1333848926.db2.gz	SPGZAUVPTSBOFW-RBUKOAKNSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3cc(C)c(CC)o3)CC2)C1	ZINC000949512014	1333863739	/nfs/dbraw/zinc/86/37/39/1333863739.db2.gz	CPQXMGLXYZPPTQ-UHFFFAOYSA-N	0	3	346.471	3.034	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)c3ccc(C)cc3)CC2)C1	ZINC000949517790	1333865631	/nfs/dbraw/zinc/86/56/31/1333865631.db2.gz	DLFDFVHTRMWRNZ-UHFFFAOYSA-N	0	3	342.483	3.268	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C3CCC(C)(C)CC3)CC2)C1	ZINC000949534271	1333870355	/nfs/dbraw/zinc/87/03/55/1333870355.db2.gz	UOZIRYQOZNQUTC-UHFFFAOYSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2sccc2OC)C12CCC2	ZINC001078786304	1357082125	/nfs/dbraw/zinc/08/21/25/1357082125.db2.gz	SLYWDASDMHZQKB-STQMWFEESA-N	0	3	340.876	3.140	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=S)Nc1ccc(F)c(Cl)c1	ZINC001200596443	1369397611	/nfs/dbraw/zinc/39/76/11/1369397611.db2.gz	KHAUOWOQRLVUHB-LBPRGKRZSA-N	0	3	327.856	3.416	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2cncc3sccc32)C1	ZINC000967919650	1335830310	/nfs/dbraw/zinc/83/03/10/1335830310.db2.gz	MANJFTJHIPHUPW-BBRMVZONSA-N	0	3	329.469	3.313	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2c(F)cc(F)cc2F)C1	ZINC000968076291	1335853547	/nfs/dbraw/zinc/85/35/47/1335853547.db2.gz	CVAZDVXMOSIEDE-IAQYHMDHSA-N	0	3	326.362	3.120	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(F)c3ccccc23)C1	ZINC000968346575	1335896071	/nfs/dbraw/zinc/89/60/71/1335896071.db2.gz	XSYLJZXSTWGMTI-QRWLVFNGSA-N	0	3	338.426	3.442	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2c(C)noc2C(F)(F)F)C1	ZINC000968369329	1335907018	/nfs/dbraw/zinc/90/70/18/1335907018.db2.gz	ITLFHWQHXOIWPI-PWSUYJOCSA-N	0	3	345.365	3.018	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)Cc2ccc(Cl)s2)C1	ZINC000968387032	1335914838	/nfs/dbraw/zinc/91/48/38/1335914838.db2.gz	TTWZHLPOLNCJGT-JSGCOSHPSA-N	0	3	326.893	3.347	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@@H]2CN(CC=C(C)C)CC[C@@H]2C)cc1	ZINC000968391424	1335917112	/nfs/dbraw/zinc/91/71/12/1335917112.db2.gz	SBYKLBOYCBKEHF-FXAWDEMLSA-N	0	3	340.467	3.105	20	30		EGEDHN
N#Cc1cc(CN[C@@H]2CCN(C(=O)C(F)=C3CCCC3)C2)ccc1F	ZINC000968403279	1335921071	/nfs/dbraw/zinc/92/10/71/1335921071.db2.gz	LMIUCBLPGUWYAI-MRXNPFEDSA-N	0	3	345.393	3.185	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cccn2C2CCCC2)C1	ZINC000968477579	1335936200	/nfs/dbraw/zinc/93/62/00/1335936200.db2.gz	UMWYJPOSUGSXTL-AEFFLSMTSA-N	0	3	327.472	3.067	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2[nH]c3ccc(C)cc3c2C)C1	ZINC000968488765	1335938985	/nfs/dbraw/zinc/93/89/85/1335938985.db2.gz	LSDXBAWPJOTHEM-BEFAXECRSA-N	0	3	337.467	3.248	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2cnn(C(CC)CC)c2C)C1	ZINC000968518060	1335950822	/nfs/dbraw/zinc/95/08/22/1335950822.db2.gz	XGDDPVCBDYRYFT-HNAYVOBHSA-N	0	3	344.503	3.016	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)C(C)(C)c2ccc(CC)cc2)C1	ZINC000968520487	1335952403	/nfs/dbraw/zinc/95/24/03/1335952403.db2.gz	JPHDPGOEQAVFNS-FXAWDEMLSA-N	0	3	340.511	3.377	20	30		EGEDHN
Cc1csc(C(=O)N2CC[C@@H](NCc3ccc(C#N)c(F)c3)C2)c1	ZINC000968602137	1335980428	/nfs/dbraw/zinc/98/04/28/1335980428.db2.gz	BBWSZNFBIDHSOV-OAHLLOKOSA-N	0	3	343.427	3.072	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1ccsc1COC	ZINC000968916898	1336088110	/nfs/dbraw/zinc/08/81/10/1336088110.db2.gz	KGUFLCBBOGAMBR-HNNXBMFYSA-N	0	3	336.501	3.445	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1cccc2ncccc21	ZINC000968973469	1336106224	/nfs/dbraw/zinc/10/62/24/1336106224.db2.gz	HIBDNHNEBAOQQU-QGZVFWFLSA-N	0	3	335.451	3.233	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1)C(C)(C)C	ZINC000969094461	1336140915	/nfs/dbraw/zinc/14/09/15/1336140915.db2.gz	ASKBKQSELNTZFY-CZUORRHYSA-N	0	3	331.435	3.070	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1csc(C(F)(F)F)n1	ZINC000969100885	1336143588	/nfs/dbraw/zinc/14/35/88/1336143588.db2.gz	LEAWSOQXALZRLC-NSHDSACASA-N	0	3	347.406	3.322	20	30		EGEDHN
C=C(Cl)CN1CCCCC[C@@H]1CNC(=O)c1n[nH]c2ccccc21	ZINC000969137367	1336158044	/nfs/dbraw/zinc/15/80/44/1336158044.db2.gz	YIIYCNIAQDTOTO-CQSZACIVSA-N	0	3	346.862	3.290	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cc(OC)c(OC)cc1C	ZINC000969151202	1336164090	/nfs/dbraw/zinc/16/40/90/1336164090.db2.gz	SOZMXTSGDGDPKD-INIZCTEOSA-N	0	3	346.471	3.173	20	30		EGEDHN
Cc1cccc([C@@H](C)N2CC([C@H](C)NC(=O)c3ccc(C#N)[nH]3)C2)c1	ZINC000969506016	1336219851	/nfs/dbraw/zinc/21/98/51/1336219851.db2.gz	LDQSBEHFPJIEQB-LSDHHAIUSA-N	0	3	336.439	3.006	20	30		EGEDHN
C#CCCN1CC([C@@H](C)NC(=O)c2ccc(C(C)(C)CC)cc2)C1	ZINC000969926846	1336261986	/nfs/dbraw/zinc/26/19/86/1336261986.db2.gz	NPTGGMVOFWZWRX-MRXNPFEDSA-N	0	3	326.484	3.448	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)[C@@H]2CCCC[C@@H]2C(F)(F)F)C1	ZINC000969962468	1336266966	/nfs/dbraw/zinc/26/69/66/1336266966.db2.gz	TYVXKPDRSHLQSZ-YUELXQCFSA-N	0	3	332.410	3.368	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccccc2-c2cn[nH]c2)CC1	ZINC001005482995	1336359150	/nfs/dbraw/zinc/35/91/50/1336359150.db2.gz	VITIHBWTORUGCX-UHFFFAOYSA-N	0	3	338.455	3.189	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccnn2C(CC)CC)CC1	ZINC001005505069	1336363386	/nfs/dbraw/zinc/36/33/86/1336363386.db2.gz	YNINQNGYIBCMQK-UHFFFAOYSA-N	0	3	332.492	3.357	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccc3nc(C)oc3c2)CC1	ZINC001005529047	1336368130	/nfs/dbraw/zinc/36/81/30/1336368130.db2.gz	KBVDSMHGFYKIHC-UHFFFAOYSA-N	0	3	327.428	3.249	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2csc(-c3ccoc3)n2)CC1	ZINC001006151566	1336460600	/nfs/dbraw/zinc/46/06/00/1336460600.db2.gz	RDVOEHZRESHPGW-UHFFFAOYSA-N	0	3	331.441	3.126	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cnn(C3CCCCC3)c2)CC1	ZINC001006254143	1336477785	/nfs/dbraw/zinc/47/77/85/1336477785.db2.gz	FXUZCGPGDCDTTC-UHFFFAOYSA-N	0	3	330.476	3.111	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cccc3c2OCC3(C)C)CC1	ZINC001006484794	1336515649	/nfs/dbraw/zinc/51/56/49/1336515649.db2.gz	FPMUXASOYTWROZ-UHFFFAOYSA-N	0	3	342.483	3.469	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cccc3c2OCC3(C)C)CC1	ZINC001006487167	1336515691	/nfs/dbraw/zinc/51/56/91/1336515691.db2.gz	VMIPFBBJGIVOGS-UHFFFAOYSA-N	0	3	328.456	3.079	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2cc(C)n(C(CC)CC)n2)C1	ZINC001007728719	1336691769	/nfs/dbraw/zinc/69/17/69/1336691769.db2.gz	STTTVGWQULZMNA-INIZCTEOSA-N	0	3	332.492	3.323	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2cnc3c(F)cccc3c2)C1	ZINC001007953081	1336738022	/nfs/dbraw/zinc/73/80/22/1336738022.db2.gz	RLFCFICLSDHSLA-MRXNPFEDSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H](NC(=O)c2cnc(CC3CC3)s2)C1	ZINC001008034028	1336753745	/nfs/dbraw/zinc/75/37/45/1336753745.db2.gz	FXZAKXXROKOXJN-OAHLLOKOSA-N	0	3	333.501	3.256	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)c2ccc(F)c3ccncc23)C1	ZINC001008269883	1336810933	/nfs/dbraw/zinc/81/09/33/1336810933.db2.gz	QRKLCDPQZLDXMN-CQSZACIVSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2cc3cccc(OC)c3o2)C1	ZINC001008350638	1336831087	/nfs/dbraw/zinc/83/10/87/1336831087.db2.gz	RLHJWFQPJQIHEW-HNNXBMFYSA-N	0	3	328.412	3.212	20	30		EGEDHN
C#CCCN1CCC[C@H](NC(=O)Cc2ccc(C(C)(C)C)cc2)C1	ZINC001008667194	1336907683	/nfs/dbraw/zinc/90/76/83/1336907683.db2.gz	RPXQYKNDRNDOTB-IBGZPJMESA-N	0	3	326.484	3.131	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2cc(C)oc2C(F)(F)F)C1	ZINC001008704470	1336914758	/nfs/dbraw/zinc/91/47/58/1336914758.db2.gz	KNIZRFIUFMJSOA-LBPRGKRZSA-N	0	3	330.350	3.377	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H](NC(=O)c2coc(C3CCCC3)n2)C1	ZINC001009039054	1336958542	/nfs/dbraw/zinc/95/85/42/1336958542.db2.gz	XECMDRMVYZHPSW-MRXNPFEDSA-N	0	3	331.460	3.493	20	30		EGEDHN
N#Cc1c[nH]c(C(=O)N[C@@H]2CCN(Cc3ccc4ccccc4c3)C2)c1	ZINC001010480495	1337204258	/nfs/dbraw/zinc/20/42/58/1337204258.db2.gz	STJKRMFULSGIOA-LJQANCHMSA-N	0	3	344.418	3.044	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CCN(CCc2ccc(C)cc2)C1	ZINC001014730272	1337889713	/nfs/dbraw/zinc/88/97/13/1337889713.db2.gz	CAAPITYWERSKEQ-IBGZPJMESA-N	0	3	337.467	3.029	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(CC[C@H]3CCCC3(F)F)C2)cc1	ZINC001015481773	1338155571	/nfs/dbraw/zinc/15/55/71/1338155571.db2.gz	HMIJNAOEFCJYBH-QZTJIDSGSA-N	0	3	346.421	3.298	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(CCc3ccc(CC)cc3)C2)C1	ZINC001015670212	1338246803	/nfs/dbraw/zinc/24/68/03/1338246803.db2.gz	KZNXVNHKBVAVQZ-IBGZPJMESA-N	0	3	326.484	3.338	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(Cc3ccccc3C(C)C)C2)nc1	ZINC001016027861	1338415159	/nfs/dbraw/zinc/41/51/59/1338415159.db2.gz	SWJCHVODWKLTAD-LJQANCHMSA-N	0	3	347.462	3.191	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2c(C)oc3ccccc32)CC1	ZINC001016637319	1338672172	/nfs/dbraw/zinc/67/21/72/1338672172.db2.gz	BFZOZXPMHOWHAH-SFHVURJKSA-N	0	3	336.435	3.349	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)Cc2ccc(C)c(Cl)c2)CC1	ZINC001016687025	1338689905	/nfs/dbraw/zinc/68/99/05/1338689905.db2.gz	CBSBGLTWLYMXAG-SFHVURJKSA-N	0	3	344.886	3.185	20	30		EGEDHN
C[C@]1(C(=O)N[C@@H]2CC23CCN(Cc2cccc(C#N)c2)CC3)C=CCC1	ZINC001016776635	1338722513	/nfs/dbraw/zinc/72/25/13/1338722513.db2.gz	ZQCRFCSGOSJCPG-CTNGQTDRSA-N	0	3	349.478	3.385	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(F)c(Cl)c2)CC1	ZINC001016802651	1338731744	/nfs/dbraw/zinc/73/17/44/1338731744.db2.gz	ICLITAQKHQDEBB-INIZCTEOSA-N	0	3	334.822	3.087	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(C)c(Cl)c2)CC1	ZINC001016805315	1338732417	/nfs/dbraw/zinc/73/24/17/1338732417.db2.gz	WBMXVINFXVQORO-KRWDZBQOSA-N	0	3	330.859	3.256	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)[C@@H](C)c2ccc(Cl)cc2)CC1	ZINC001016809069	1338733678	/nfs/dbraw/zinc/73/36/78/1338733678.db2.gz	UIAOJHYIPVNFIR-YJBOKZPZSA-N	0	3	344.886	3.438	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccc(C)c(OCC)c2)CC1	ZINC001016862333	1338751603	/nfs/dbraw/zinc/75/16/03/1338751603.db2.gz	WIVUBCFLFKTCCW-LJQANCHMSA-N	0	3	340.467	3.001	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)[C@H](C)c2ccc(CC)cc2)CC1	ZINC001016880313	1338757641	/nfs/dbraw/zinc/75/76/41/1338757641.db2.gz	SHUVMRYZVHRLQQ-XLIONFOSSA-N	0	3	338.495	3.347	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)[C@H]2CC[C@H](C(C)C)CC2)CC1	ZINC001016903021	1338764324	/nfs/dbraw/zinc/76/43/24/1338764324.db2.gz	UTLGSAACAUPBHS-FHWLQOOXSA-N	0	3	330.516	3.443	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2ccc(O[C@@H](C)CC)cc2)CC1	ZINC001016912421	1338767506	/nfs/dbraw/zinc/76/75/06/1338767506.db2.gz	BLIGFFDNLOEISQ-QFBILLFUSA-N	0	3	340.467	3.081	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cc(CC)c(CC)o2)CC1	ZINC001016936996	1338775225	/nfs/dbraw/zinc/77/52/25/1338775225.db2.gz	WQNHQMLMXODDBM-GOSISDBHSA-N	0	3	328.456	3.012	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2c(Cl)cccc2Cl)CC1	ZINC001016946129	1338779528	/nfs/dbraw/zinc/77/95/28/1338779528.db2.gz	IOEBGRGCBPHRFV-CQSZACIVSA-N	0	3	337.250	3.211	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2cc3c(s2)CCCCC3)CC1	ZINC001016954557	1338783018	/nfs/dbraw/zinc/78/30/18/1338783018.db2.gz	COWREJPEDSBLAP-GOSISDBHSA-N	0	3	342.508	3.235	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)C2CCC(C(C)(C)C)CC2)CC1	ZINC001016958068	1338784598	/nfs/dbraw/zinc/78/45/98/1338784598.db2.gz	HMUFDAGGFZZDGJ-DAWZGUTISA-N	0	3	330.516	3.443	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2cc3c(cccc3F)s2)CC1	ZINC001016964043	1338786196	/nfs/dbraw/zinc/78/61/96/1338786196.db2.gz	WAQORZBLXLBFIY-KRWDZBQOSA-N	0	3	342.439	3.258	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCCN(C(=O)CC2CCC2)C1	ZINC001017089973	1338858564	/nfs/dbraw/zinc/85/85/64/1338858564.db2.gz	ABIAVUGHKAEOOO-INIZCTEOSA-N	0	3	345.512	3.480	20	30		EGEDHN
CN(Cc1ccccc1Cl)C[C@@H]1CCCN(C(=O)C#CC2CC2)C1	ZINC001017123106	1338880407	/nfs/dbraw/zinc/88/04/07/1338880407.db2.gz	FDACXGNISJUPMU-KRWDZBQOSA-N	0	3	344.886	3.424	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H](CN(C)Cc3ncccc3C)C2)C1	ZINC001017206493	1338952865	/nfs/dbraw/zinc/95/28/65/1338952865.db2.gz	IYKZNQWVSPPAGZ-GOSISDBHSA-N	0	3	341.499	3.417	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H](CN(C)Cc3oc(C)nc3C)C2)C1	ZINC001017206942	1338952971	/nfs/dbraw/zinc/95/29/71/1338952971.db2.gz	KLTNLRIBYOQIIB-QGZVFWFLSA-N	0	3	345.487	3.318	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cnc2n1[C@@H](C)CCC2	ZINC001017573882	1339369506	/nfs/dbraw/zinc/36/95/06/1339369506.db2.gz	WHLFWHHMBCPZBW-YESZJQIVSA-N	0	3	342.487	3.035	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@H](C)c1c(C)noc1C	ZINC001017670884	1339388185	/nfs/dbraw/zinc/38/81/85/1339388185.db2.gz	KWEFSJHTOPOXKQ-RRQGHBQHSA-N	0	3	331.460	3.036	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cc(C(C)C)nn1CC	ZINC001017704395	1339396029	/nfs/dbraw/zinc/39/60/29/1339396029.db2.gz	FQTSOLGZAHAFRS-CALCHBBNSA-N	0	3	344.503	3.281	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C1(C(F)F)CCCC1	ZINC001017845345	1339429784	/nfs/dbraw/zinc/42/97/84/1339429784.db2.gz	ZNQBNSRXKQLHOI-GASCZTMLSA-N	0	3	326.431	3.453	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc(F)c(Cl)c1	ZINC001017989423	1339476032	/nfs/dbraw/zinc/47/60/32/1339476032.db2.gz	HXTAUADVKCZLLB-GASCZTMLSA-N	0	3	336.838	3.273	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc(OC)cc1F	ZINC001018131713	1339508761	/nfs/dbraw/zinc/50/87/61/1339508761.db2.gz	DIRRSQQPNRXKCF-CALCHBBNSA-N	0	3	346.446	3.018	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2ccn(C)c2c1	ZINC001018141505	1339512291	/nfs/dbraw/zinc/51/22/91/1339512291.db2.gz	ANJXSYLGHPQUMX-KDURUIRLSA-N	0	3	337.467	3.433	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)CCc1cccc(F)c1F	ZINC001018341649	1339584568	/nfs/dbraw/zinc/58/45/68/1339584568.db2.gz	BNVLGEMWKFYEGJ-IYBDPMFKSA-N	0	3	334.410	3.149	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC[C@H](NCc2sc3ccccc3c2Cl)C1	ZINC001018617139	1339683506	/nfs/dbraw/zinc/68/35/06/1339683506.db2.gz	FLUVWGYXKGPLDD-NEPJUHHUSA-N	0	3	347.871	3.405	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1csc(-c2ccoc2)n1	ZINC001028207589	1340485505	/nfs/dbraw/zinc/48/55/05/1340485505.db2.gz	UAALRNZSWWTJOT-CQSZACIVSA-N	0	3	331.441	3.173	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1cnn(CCC(C)C)c1C	ZINC001028250958	1340511425	/nfs/dbraw/zinc/51/14/25/1340511425.db2.gz	OXZPFICFAHLAMQ-QGZVFWFLSA-N	0	3	332.492	3.008	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CCN(Cc3ncccc3C)C2)CC1	ZINC001028780679	1340812897	/nfs/dbraw/zinc/81/28/97/1340812897.db2.gz	LYDOTHLKOTZKMJ-QGZVFWFLSA-N	0	3	327.472	3.075	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](CNC(=O)[C@@]34C[C@@H]3CCCC4)C2)cc1	ZINC001028791803	1340823502	/nfs/dbraw/zinc/82/35/02/1340823502.db2.gz	VFJDLGFWOKVHMB-DYXWJJEUSA-N	0	3	337.467	3.077	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H](CNC(=O)[C@]34C[C@H]3CCCC4)C2)c1	ZINC001028791911	1340823984	/nfs/dbraw/zinc/82/39/84/1340823984.db2.gz	XQPYZTRSAKAUCK-SFHLNBCPSA-N	0	3	337.467	3.077	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC([C@@H](C)NCc2cc(C)n(C)n2)CC1	ZINC001029124984	1340936004	/nfs/dbraw/zinc/93/60/04/1340936004.db2.gz	PJJMAQSLPOJOPS-MRXNPFEDSA-N	0	3	346.519	3.048	20	30		EGEDHN
CC[C@H](F)C(=O)N1CCC([C@H](C)NCc2cc(F)ccc2C#N)CC1	ZINC001029129625	1340937729	/nfs/dbraw/zinc/93/77/29/1340937729.db2.gz	XVKPHBXGDUYOSV-UGSOOPFHSA-N	0	3	349.425	3.162	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CCC([C@@H](C)NCc2ccccc2C#N)CC1	ZINC001029129675	1340937777	/nfs/dbraw/zinc/93/77/77/1340937777.db2.gz	YUJPAOLNBDBKBT-RDTXWAMCSA-N	0	3	331.435	3.023	20	30		EGEDHN
C[C@H](C#N)C(=O)N1C[C@H]2CC[C@@H](C1)N2[C@@H]1CCc2c1cccc2Cl	ZINC001029244623	1340960701	/nfs/dbraw/zinc/96/07/01/1340960701.db2.gz	JVBVTBQYXLKORY-ZUMXRPEOSA-N	0	3	343.858	3.162	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@H]2CC[C@@H](C1)N2CC[C@H]1CCCO1	ZINC001029322849	1340972098	/nfs/dbraw/zinc/97/20/98/1340972098.db2.gz	CJPFQOZSJHIOIF-OWCLPIDISA-N	0	3	340.895	3.009	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CC[C@@H](C1)N2C[C@@H](O)C1CCCCC1	ZINC001029419576	1340985985	/nfs/dbraw/zinc/98/59/85/1340985985.db2.gz	GJGKBUHGCNIYGM-CEXWTWQISA-N	0	3	348.531	3.205	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CC[C@@H](C1)N2C[C@H](OC)C1CCCC1	ZINC001029421834	1340986256	/nfs/dbraw/zinc/98/62/56/1340986256.db2.gz	LQCRKRQJCBEUGP-KSZLIROESA-N	0	3	334.504	3.079	20	30		EGEDHN
Cc1ccc(CN(C)C[C@H]2CCN(C(=O)C#CC3CC3)C2)c(Cl)c1	ZINC001029734340	1341057851	/nfs/dbraw/zinc/05/78/51/1341057851.db2.gz	VMRBRSAJFFMFLI-QGZVFWFLSA-N	0	3	344.886	3.342	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](CN(C)Cc2ncccc2C)C1	ZINC001029798993	1341076650	/nfs/dbraw/zinc/07/66/50/1341076650.db2.gz	POYAYKIDLMAIFX-QGZVFWFLSA-N	0	3	329.488	3.273	20	30		EGEDHN
CCC1(C(=O)N2CC[C@@H](CN(C)Cc3ccc(C#N)s3)C2)CC1	ZINC001029829473	1341089153	/nfs/dbraw/zinc/08/91/53/1341089153.db2.gz	GBAPXHGLMSDPQN-AWEZNQCLSA-N	0	3	331.485	3.090	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](CN(C)Cc3ccc(Cl)nc3)C2)C1	ZINC001029836018	1341092063	/nfs/dbraw/zinc/09/20/63/1341092063.db2.gz	LHIUJXVHNCEIPV-MRXNPFEDSA-N	0	3	347.890	3.372	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](N(Cc2ccccc2)C(=O)[C@H]2CCOC2)C1	ZINC001029918031	1341118231	/nfs/dbraw/zinc/11/82/31/1341118231.db2.gz	VHSLETJHUUKSDI-VQTJNVASSA-N	0	3	342.483	3.092	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC(CN(C)Cc2conc2C)CC1	ZINC001029982007	1341143367	/nfs/dbraw/zinc/14/33/67/1341143367.db2.gz	JPPPMENPVWJEQC-UHFFFAOYSA-N	0	3	333.476	3.256	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC(CN(C)[C@H](C)c2cnccn2)CC1	ZINC001029982961	1341143837	/nfs/dbraw/zinc/14/38/37/1341143837.db2.gz	QHFDXFUYTQMNBM-MRXNPFEDSA-N	0	3	344.503	3.310	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](NC(=O)c2cccc3nc(C)[nH]c32)CC[C@@H]1C	ZINC001071968391	1355050516	/nfs/dbraw/zinc/05/05/16/1355050516.db2.gz	UOLQSAWEXIVDHN-JSGCOSHPSA-N	0	3	346.862	3.207	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc2c(c1)[C@@H](C)CO2	ZINC001032580943	1341548749	/nfs/dbraw/zinc/54/87/49/1341548749.db2.gz	DZLBBKJYYCAEEW-XIRDDKMYSA-N	0	3	326.440	3.047	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C[C@H]1OCCc2ccsc21	ZINC001032740939	1341597454	/nfs/dbraw/zinc/59/74/54/1341597454.db2.gz	OSZWXVMARHHKRQ-YESZJQIVSA-N	0	3	346.496	3.003	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H](C)Cc1cccc(Cl)c1	ZINC001032819348	1341626284	/nfs/dbraw/zinc/62/62/84/1341626284.db2.gz	VQSIFRBLFMIXPP-WBAXXEDZSA-N	0	3	332.875	3.380	20	30		EGEDHN
CN(C(=O)c1cc(C#N)c[nH]1)[C@@H]1CCN(Cc2ccc(C3CC3)cc2)C1	ZINC001032984783	1341685137	/nfs/dbraw/zinc/68/51/37/1341685137.db2.gz	DXXMKLWTYUVKHJ-LJQANCHMSA-N	0	3	348.450	3.110	20	30		EGEDHN
C=CCCN1CC[C@H](N(C)C(=O)c2ccc(-c3ccncc3)o2)C1	ZINC001033144059	1341738213	/nfs/dbraw/zinc/73/82/13/1341738213.db2.gz	QKQLESQBGNGNHS-INIZCTEOSA-N	0	3	325.412	3.064	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2ccc(F)c3ccncc23)C1	ZINC001033354364	1341794005	/nfs/dbraw/zinc/79/40/05/1341794005.db2.gz	PADDCLOPPPAQLQ-AWEZNQCLSA-N	0	3	327.403	3.096	20	30		EGEDHN
C#Cc1cncc(C(=O)N(C)[C@@H]2CCN(Cc3cc(C)cc(C)c3)C2)c1	ZINC001033404647	1341816579	/nfs/dbraw/zinc/81/65/79/1341816579.db2.gz	DLMUJQJEJLSQMN-OAQYLSRUSA-N	0	3	347.462	3.026	20	30		EGEDHN
C#Cc1cncc(C(=O)N(C)[C@H]2CCN([C@@H](C)c3cccc(C)c3)C2)c1	ZINC001033405901	1341816903	/nfs/dbraw/zinc/81/69/03/1341816903.db2.gz	PZNBTCSIDGGEQB-UWJYYQICSA-N	0	3	347.462	3.279	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2cnn(C(C)C)c2C2CC2)C1	ZINC001033572608	1341878449	/nfs/dbraw/zinc/87/84/49/1341878449.db2.gz	VXBOGXFPJNXYRC-MRXNPFEDSA-N	0	3	330.476	3.064	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@@H]2CCN([C@H](C)c3cccc(C)c3)C2)nc1	ZINC001033597050	1341889775	/nfs/dbraw/zinc/88/97/75/1341889775.db2.gz	QXVZSDWLUZNLSJ-YLJYHZDGSA-N	0	3	347.462	3.279	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2ccccc2OCC2CC2)C1	ZINC001033684337	1341949860	/nfs/dbraw/zinc/94/98/60/1341949860.db2.gz	MWGKGYRGPKOHII-KRWDZBQOSA-N	0	3	328.456	3.198	20	30		EGEDHN
C=CCCN1CC[C@H](N(C)C(=O)c2ccc(C(F)(F)F)s2)C1	ZINC001033702143	1341967959	/nfs/dbraw/zinc/96/79/59/1341967959.db2.gz	NXCFTCVJMBELNC-NSHDSACASA-N	0	3	332.391	3.489	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2csc([C@@H]3CCCO3)n2)C1	ZINC001033828806	1342029142	/nfs/dbraw/zinc/02/91/42/1342029142.db2.gz	RMGMVOKLPLPBPB-HOCLYGCPSA-N	0	3	349.500	3.107	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2cncc(-c3ccccc3)c2)C1	ZINC001033847484	1342042923	/nfs/dbraw/zinc/04/29/23/1342042923.db2.gz	JGMQURJZABCJGG-NRFANRHFSA-N	0	3	347.462	3.308	20	30		EGEDHN
C=C(C)CCN1CC[C@H](N(CC)C(=O)c2nc3cccnc3s2)C1	ZINC001033857192	1342046923	/nfs/dbraw/zinc/04/69/23/1342046923.db2.gz	BFEUXCNDRQQJNA-AWEZNQCLSA-N	0	3	344.484	3.194	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@H]2CCOc3c(F)cccc32)C1	ZINC001033893028	1342066448	/nfs/dbraw/zinc/06/64/48/1342066448.db2.gz	QPFGQQAFJPYCSY-RDJZCZTQSA-N	0	3	346.446	3.191	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@@H]2Cc3cc(Cl)ccc3O2)C1	ZINC001033894739	1342067102	/nfs/dbraw/zinc/06/71/02/1342067102.db2.gz	ZTBHJWQHVGOKHC-WMZOPIPTSA-N	0	3	348.874	3.142	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)[C@@H]2C[C@H]2c2ccc(F)cc2F)C1	ZINC001033905439	1342078498	/nfs/dbraw/zinc/07/84/98/1342078498.db2.gz	AGRPTABZFSPIKB-BPQIPLTHSA-N	0	3	346.421	3.014	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cc(F)c(F)c(F)c2)C1	ZINC001033970120	1342120876	/nfs/dbraw/zinc/12/08/76/1342120876.db2.gz	ZAEBBLUDWGVQFV-ZDUSSCGKSA-N	0	3	326.362	3.216	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cccc(C(F)(F)F)c3)[C@@H]2C1	ZINC001076491005	1356592473	/nfs/dbraw/zinc/59/24/73/1356592473.db2.gz	LEGRIKUPTYECIS-GOEBONIOSA-N	0	3	338.373	3.428	20	30		EGEDHN
Cc1cc(CN2CCCC[C@@H](NC(=O)c3ccc(C#N)[nH]3)C2)cs1	ZINC001034165564	1342290231	/nfs/dbraw/zinc/29/02/31/1342290231.db2.gz	OCEGRTLUFKKRMJ-MRXNPFEDSA-N	0	3	342.468	3.041	20	30		EGEDHN
C=CCCN1CCCC[C@H](NC(=O)c2cnc([C@@H](C)OC)s2)C1	ZINC001034209989	1342319896	/nfs/dbraw/zinc/31/98/96/1342319896.db2.gz	ILDRPKIWEYGJDB-KGLIPLIRSA-N	0	3	337.489	3.011	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccnc(-n3cccc3)c2)C1	ZINC001034264809	1342356459	/nfs/dbraw/zinc/35/64/59/1342356459.db2.gz	NNQFDHBSCFFAOG-GOSISDBHSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cccc([C@H]3CCOC3)c2)C1	ZINC001034279137	1342369963	/nfs/dbraw/zinc/36/99/63/1342369963.db2.gz	IQRQHZVCDVXLJX-VQTJNVASSA-N	0	3	342.483	3.351	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2cc(C)n(C(CC)CC)n2)C1	ZINC001034283524	1342372085	/nfs/dbraw/zinc/37/20/85/1342372085.db2.gz	WKSFCPZWFZSHRV-KRWDZBQOSA-N	0	3	344.503	3.160	20	30		EGEDHN
C=CCCN1CCCC[C@@H](NC(=O)c2scnc2C(F)F)C1	ZINC001034301302	1342384332	/nfs/dbraw/zinc/38/43/32/1342384332.db2.gz	JFMORHJQVBNUPO-LLVKDONJSA-N	0	3	329.416	3.241	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2ccc(-c3ccco3)o2)C1	ZINC001034305790	1342388187	/nfs/dbraw/zinc/38/81/87/1342388187.db2.gz	MBFYADPGWXIWNT-HNNXBMFYSA-N	0	3	326.396	3.147	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2ccc(C)c(Cl)c2F)C1	ZINC001034326566	1342401860	/nfs/dbraw/zinc/40/18/60/1342401860.db2.gz	KQBUTQVVGAOLQO-CQSZACIVSA-N	0	3	336.838	3.395	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cnn(C(C)C)c2Cl)C1	ZINC001034330142	1342404577	/nfs/dbraw/zinc/40/45/77/1342404577.db2.gz	IXTJASPKUFCYLB-CQSZACIVSA-N	0	3	338.883	3.278	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cc3ccc(OC)cc3[nH]2)C1	ZINC001034335310	1342409887	/nfs/dbraw/zinc/40/98/87/1342409887.db2.gz	DDJGDSQRDPNIKJ-MRXNPFEDSA-N	0	3	341.455	3.337	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)c2ccc(F)c3ccncc23)C1	ZINC001034365290	1342435737	/nfs/dbraw/zinc/43/57/37/1342435737.db2.gz	UKBNUTQCFACNIN-AWEZNQCLSA-N	0	3	327.403	3.144	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CCCCN(Cc3ccc(C)cc3)C2)c1	ZINC001034390556	1342460551	/nfs/dbraw/zinc/46/05/51/1342460551.db2.gz	BKLFABQSIWCWTD-NRFANRHFSA-N	0	3	347.462	3.156	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cc(Br)co2)C1	ZINC001034432640	1342494284	/nfs/dbraw/zinc/49/42/84/1342494284.db2.gz	XILLBALTKGSJNC-CYBMUJFWSA-N	0	3	341.249	3.203	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cc(C)cc3c[nH]nc32)C1	ZINC001034448251	1342508017	/nfs/dbraw/zinc/50/80/17/1342508017.db2.gz	MLPHJFTUEVEMNI-INIZCTEOSA-N	0	3	326.444	3.032	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)Cc2cccc(OCCC)c2)C1	ZINC001034476025	1342531427	/nfs/dbraw/zinc/53/14/27/1342531427.db2.gz	ASFJEBIPBREONO-GOSISDBHSA-N	0	3	330.472	3.175	20	30		EGEDHN
C=CCOc1cccnc1C(=O)N[C@H]1CCCCN(CC=C(C)C)C1	ZINC001034483288	1342540877	/nfs/dbraw/zinc/54/08/77/1342540877.db2.gz	JXMMBCZOUDNJDL-KRWDZBQOSA-N	0	3	343.471	3.197	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2cnn(C(CC)CC)c2C)C1	ZINC001034484892	1342542659	/nfs/dbraw/zinc/54/26/59/1342542659.db2.gz	XLCITSSCJPDZEB-KRWDZBQOSA-N	0	3	344.503	3.160	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2cnn(C(CC)CC)c2C)C1	ZINC001034484893	1342542838	/nfs/dbraw/zinc/54/28/38/1342542838.db2.gz	XLCITSSCJPDZEB-QGZVFWFLSA-N	0	3	344.503	3.160	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCCN(Cc3ccc(C)cc3)C2)cn1	ZINC001034498539	1342554945	/nfs/dbraw/zinc/55/49/45/1342554945.db2.gz	MKVNGJCDQSLUAU-NRFANRHFSA-N	0	3	347.462	3.156	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ncccc2OC(C)C)C1	ZINC001034509571	1342567921	/nfs/dbraw/zinc/56/79/21/1342567921.db2.gz	YSTKDKVCRRHNRI-MRXNPFEDSA-N	0	3	331.460	3.029	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2cc(F)c(F)cc2Cl)C1	ZINC001034518318	1342577847	/nfs/dbraw/zinc/57/78/47/1342577847.db2.gz	JBHMLDYANCLFHN-LBPRGKRZSA-N	0	3	340.801	3.226	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)C(C)(C)c2ccc(OC)cc2)C1	ZINC001034531109	1342586452	/nfs/dbraw/zinc/58/64/52/1342586452.db2.gz	DYBRJCRHHXGEGF-KRWDZBQOSA-N	0	3	330.472	3.130	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)[C@H]2CC[C@H](F)C2)CC1	ZINC001034719763	1342713904	/nfs/dbraw/zinc/71/39/04/1342713904.db2.gz	XOKBNNCAJZWJIP-XUXIUFHCSA-N	0	3	347.272	3.050	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)Cc2ccc(OC)cc2)C12CCC2	ZINC001078793667	1357087917	/nfs/dbraw/zinc/08/79/17/1357087917.db2.gz	ZTJICJHARCUCEQ-DLBZAZTESA-N	0	3	348.874	3.007	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)c2ccccc2)c(F)c1	ZINC001034847288	1342800629	/nfs/dbraw/zinc/80/06/29/1342800629.db2.gz	LVIZHOYWSXKDAP-GOSISDBHSA-N	0	3	337.398	3.092	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)CC2CCCC2)s1	ZINC001034851697	1342803501	/nfs/dbraw/zinc/80/35/01/1342803501.db2.gz	XZJAYIGPKIRLNV-OAHLLOKOSA-N	0	3	331.485	3.281	20	30		EGEDHN
Cc1cc(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)s2)c(C)o1	ZINC001034856809	1342806786	/nfs/dbraw/zinc/80/67/86/1342806786.db2.gz	SYJHPJOHPDPECL-CQSZACIVSA-N	0	3	343.452	3.224	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@@H]1CNCc1cccc(Cl)c1Cl	ZINC001034886450	1342821279	/nfs/dbraw/zinc/82/12/79/1342821279.db2.gz	KWCDXNODQYHOGR-DGCLKSJQSA-N	0	3	340.254	3.234	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc(C3CC3)cn2)C12CCC2	ZINC001078798584	1357090472	/nfs/dbraw/zinc/09/04/72/1357090472.db2.gz	QUFUEGKSTBEHNY-DLBZAZTESA-N	0	3	345.874	3.342	20	30		EGEDHN
Cc1coc(C)c1C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)s1	ZINC001034925110	1342838787	/nfs/dbraw/zinc/83/87/87/1342838787.db2.gz	AAMVVZMYGRBNJH-CQSZACIVSA-N	0	3	343.452	3.224	20	30		EGEDHN
C[C@]1(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)s2)C[C@H]2C[C@H]2C1	ZINC001035003803	1342870815	/nfs/dbraw/zinc/87/08/15/1342870815.db2.gz	WYGBYSUFWQQECL-GJRWTSMGSA-N	0	3	343.496	3.137	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]1CNCc1ccnc(Cl)c1	ZINC001035011728	1342875262	/nfs/dbraw/zinc/87/52/62/1342875262.db2.gz	HXVRXSKUXWDQBP-OAHLLOKOSA-N	0	3	335.879	3.418	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H]1CNCc1c(C)nsc1C	ZINC001035036006	1342889477	/nfs/dbraw/zinc/88/94/77/1342889477.db2.gz	UJNBLBQFMLWMAS-QAPCUYQASA-N	0	3	335.517	3.443	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001035036200	1342889919	/nfs/dbraw/zinc/88/99/19/1342889919.db2.gz	YHKQQUBRWGPQIX-XLIONFOSSA-N	0	3	343.446	3.380	20	30		EGEDHN
C[C@@H](CC(=O)N1CCC[C@@H]1CNCc1ccc(C#N)cc1F)C1CC1	ZINC001035136083	1342950976	/nfs/dbraw/zinc/95/09/76/1342950976.db2.gz	RDNXIMOBXCCSIT-KBXCAEBGSA-N	0	3	343.446	3.214	20	30		EGEDHN
CCCC(=O)N1CCC2(CCN(Cc3ccc(F)c(C#N)c3)C2)CC1	ZINC001035148977	1342960590	/nfs/dbraw/zinc/96/05/90/1342960590.db2.gz	VOLSFTFASAHTNP-UHFFFAOYSA-N	0	3	343.446	3.312	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc(C)nc2C)C12CCC2	ZINC001078819166	1357099456	/nfs/dbraw/zinc/09/94/56/1357099456.db2.gz	JIZOUDGVGLHGCE-HOTGVXAUSA-N	0	3	333.863	3.082	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)Cc2ccc(C)s2)C12CCC2	ZINC001078819574	1357099930	/nfs/dbraw/zinc/09/99/30/1357099930.db2.gz	POUGEGYSSRORNS-GJZGRUSLSA-N	0	3	338.904	3.369	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cc1c(C)cccc1C)CC2	ZINC001035716192	1343149889	/nfs/dbraw/zinc/14/98/89/1343149889.db2.gz	XWSBNQYRQOQDBY-UHFFFAOYSA-N	0	3	326.484	3.346	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccnn1C(CC)CC)CC2	ZINC001035719591	1343150969	/nfs/dbraw/zinc/15/09/69/1343150969.db2.gz	CRAALFVHJHBJMN-UHFFFAOYSA-N	0	3	344.503	3.358	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)C1C3CC4CC(C3)CC1C4)CC2	ZINC001035724161	1343153814	/nfs/dbraw/zinc/15/38/14/1343153814.db2.gz	SECNBYXOWYTMSC-UHFFFAOYSA-N	0	3	340.511	3.006	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)CCc1ccc(C)cc1C)CC2	ZINC001035760885	1343175293	/nfs/dbraw/zinc/17/52/93/1343175293.db2.gz	IBEIQZZNFDFPNL-UHFFFAOYSA-N	0	3	338.495	3.184	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H](CC)OC1CCCC1)CC2	ZINC001035807555	1343208035	/nfs/dbraw/zinc/20/80/35/1343208035.db2.gz	QKSWYJDDNOIXLQ-GOSISDBHSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc(C(C)C)[nH]c1=O)CC2	ZINC001035811680	1343211209	/nfs/dbraw/zinc/21/12/09/1343211209.db2.gz	LHGGPBBALGRCRZ-UHFFFAOYSA-N	0	3	343.471	3.025	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@H]1CCOc3ccccc31)CC2	ZINC001035820443	1343214893	/nfs/dbraw/zinc/21/48/93/1343214893.db2.gz	UYDFDWNGVITXGX-SFHVURJKSA-N	0	3	340.467	3.053	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1sccc1C(F)F)CC2	ZINC001035844229	1343225811	/nfs/dbraw/zinc/22/58/11/1343225811.db2.gz	BQZODHLIWKXNRC-UHFFFAOYSA-N	0	3	338.423	3.247	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@H](OC)C1CCCCC1)CC2	ZINC001035865119	1343239184	/nfs/dbraw/zinc/23/91/84/1343239184.db2.gz	NWWQNVNVHONFBG-GOSISDBHSA-N	0	3	334.504	3.082	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2CCCC2)CC[C@@H]1NCc1ccccc1C#N	ZINC001035919920	1343272264	/nfs/dbraw/zinc/27/22/64/1343272264.db2.gz	XHBGYQUEXCHZHK-UZLBHIALSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@H]1CN(C(=O)C2=CCCC2)CC[C@@H]1NCc1cc(F)ccc1C#N	ZINC001035994804	1343306057	/nfs/dbraw/zinc/30/60/57/1343306057.db2.gz	ZDZLKQZTNXFENQ-LIRRHRJNSA-N	0	3	341.430	3.134	20	30		EGEDHN
C[C@H]1CN(C(=O)CC2(C)CC2)CC[C@H]1NCc1ccccc1C#N	ZINC001036123990	1343317361	/nfs/dbraw/zinc/31/73/61/1343317361.db2.gz	PZZNBOUASLOSHW-MAUKXSAKSA-N	0	3	325.456	3.075	20	30		EGEDHN
Cc1cocc1C(=O)N1CC[C@@H](NCc2ccccc2C#N)[C@@H](C)C1	ZINC001036139790	1343324384	/nfs/dbraw/zinc/32/43/84/1343324384.db2.gz	AOEKPTOKIYCKAQ-IFXJQAMLSA-N	0	3	337.423	3.100	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@H]([C@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001036339582	1343425129	/nfs/dbraw/zinc/42/51/29/1343425129.db2.gz	GHAINXSZQJNCJW-RDJZCZTQSA-N	0	3	343.446	3.380	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCCN(C(=O)CC2(C)CC2)C1	ZINC001036425560	1343479052	/nfs/dbraw/zinc/47/90/52/1343479052.db2.gz	LTLVWSZDACTKPN-LPHOPBHVSA-N	0	3	339.483	3.465	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@H]2CN(C(=O)c3ccccc3)CC[C@H]21	ZINC001036626999	1343584394	/nfs/dbraw/zinc/58/43/94/1343584394.db2.gz	GGFIKOCDCVVKGP-LEWJYISDSA-N	0	3	345.446	3.295	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@H]2[C@@H](CCN2CC#Cc2ccccc2)C1	ZINC001036651806	1343600768	/nfs/dbraw/zinc/60/07/68/1343600768.db2.gz	JTJBZEACDWMVOU-SFTDATJTSA-N	0	3	338.495	3.397	20	30		EGEDHN
C/C=C(\C)C(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccc(F)c(C#N)c2)C1	ZINC001036683465	1343626561	/nfs/dbraw/zinc/62/65/61/1343626561.db2.gz	SVBGGBZWYLDQSS-RAULASJBSA-N	0	3	341.430	3.086	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@H]2[C@H](CCN2Cc2ccc(Cl)cc2)C1	ZINC001036713153	1343645503	/nfs/dbraw/zinc/64/55/03/1343645503.db2.gz	DIIBEFAZXQHMBT-MJGOQNOKSA-N	0	3	342.870	3.176	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H]2[C@@H](CCN2C/C=C\Cl)C1	ZINC001036726494	1343657941	/nfs/dbraw/zinc/65/79/41/1343657941.db2.gz	NDKCUBKEOBVACS-WREBYIDWSA-N	0	3	331.287	3.440	20	30		EGEDHN
CC(F)(F)CC(=O)N1CC[C@H]2[C@H](CCN2CC#Cc2ccccc2)C1	ZINC001036811355	1343747102	/nfs/dbraw/zinc/74/71/02/1343747102.db2.gz	PKXJWTSZSZYWGF-MSOLQXFVSA-N	0	3	346.421	3.006	20	30		EGEDHN
CCC1(C(=O)N2CC[C@H]3[C@H](CCN3CC#Cc3ccccc3)C2)CC1	ZINC001036812340	1343748463	/nfs/dbraw/zinc/74/84/63/1343748463.db2.gz	GAGDKZSHMPZSMQ-UXHICEINSA-N	0	3	336.479	3.151	20	30		EGEDHN
Cc1ccoc1C(=O)N[C@@H]1CCC[C@H]1CNCc1ccccc1C#N	ZINC001036948394	1343888873	/nfs/dbraw/zinc/88/88/73/1343888873.db2.gz	QARNEHOFILFXPK-ZWKOTPCHSA-N	0	3	337.423	3.148	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@@H]1CCCC[C@H]1NC(=O)C1CCC1	ZINC001037139172	1343989014	/nfs/dbraw/zinc/98/90/14/1343989014.db2.gz	MIODYIYHDRABJK-QFBILLFUSA-N	0	3	343.446	3.262	20	30		EGEDHN
CC[C@H]1CN(C(=O)C2CCC2)CC[C@@H]1NCc1cc(F)ccc1C#N	ZINC001037760976	1344075699	/nfs/dbraw/zinc/07/56/99/1344075699.db2.gz	XTOQQVKUXDJBCL-LIRRHRJNSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](NCc3cscn3)[C@H](CC)C2)C1	ZINC001037913956	1344174920	/nfs/dbraw/zinc/17/49/20/1344174920.db2.gz	IQBFEIZJNNHSMU-GDBMZVCRSA-N	0	3	333.501	3.216	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](NCc3nccs3)[C@H](CC)C2)C1	ZINC001037914290	1344175173	/nfs/dbraw/zinc/17/51/73/1344175173.db2.gz	KMQUSRIRNNGQDI-HUUCEWRRSA-N	0	3	333.501	3.216	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](NCc3nc(C)oc3C)[C@@H](CC)C2)C1	ZINC001037914877	1344175581	/nfs/dbraw/zinc/17/55/81/1344175581.db2.gz	NNEAKJHJJLITLP-IRXDYDNUSA-N	0	3	345.487	3.364	20	30		EGEDHN
CC[C@H]1CN(C(=O)C(C)(C)C)CC[C@H]1NCc1cc(F)ccc1C#N	ZINC001037964145	1344207303	/nfs/dbraw/zinc/20/73/03/1344207303.db2.gz	XLJFPZQCWOHMPA-KBXCAEBGSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1sccc1-n1cccc1	ZINC001038577133	1344490673	/nfs/dbraw/zinc/49/06/73/1344490673.db2.gz	YDMAJKKNNALHBE-OAHLLOKOSA-N	0	3	329.469	3.309	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1cc(F)cc2cccnc21	ZINC001038766725	1344574989	/nfs/dbraw/zinc/57/49/89/1344574989.db2.gz	GJEOAPDRYPVHCB-MRXNPFEDSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)[C@H]1CCCc2sc(C)nc21	ZINC001038910046	1344647709	/nfs/dbraw/zinc/64/77/09/1344647709.db2.gz	KSFIJOBFMJREIC-CABCVRRESA-N	0	3	333.501	3.028	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H](C)C(C)C)CC[C@H]1c1ccc(F)cc1	ZINC001079160549	1357198457	/nfs/dbraw/zinc/19/84/57/1357198457.db2.gz	ZVUGKFXGCUKZTE-ZYSHUDEJSA-N	0	3	330.447	3.025	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C[C@H](C)C2CC2)CC[C@H]1c1ccc(F)cc1	ZINC001079162738	1357198546	/nfs/dbraw/zinc/19/85/46/1357198546.db2.gz	YSLJGZPNBVTXIQ-RYGJVYDSSA-N	0	3	342.458	3.169	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)[C@H]3[C@@H]4CCC[C@@H]43)CC2)C1	ZINC001039116731	1344788421	/nfs/dbraw/zinc/78/84/21/1344788421.db2.gz	PPQABHMGXLQGBH-BDXSIMOUSA-N	0	3	336.907	3.346	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)[C@H]3CC34CCC4)CC2)C1	ZINC001039162304	1344847846	/nfs/dbraw/zinc/84/78/46/1344847846.db2.gz	UQYMCINNFJCCJS-DLBZAZTESA-N	0	3	336.907	3.490	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)c3c[nH]cc3C)CC2)C1	ZINC001039173287	1344862844	/nfs/dbraw/zinc/86/28/44/1344862844.db2.gz	SDSJDAFVGXPMPV-MRXNPFEDSA-N	0	3	335.879	3.250	20	30		EGEDHN
CCC(=O)N1CCCC[C@H]1[C@@H]1CCN(Cc2ccc(F)c(C#N)c2)C1	ZINC001039181176	1344877748	/nfs/dbraw/zinc/87/77/48/1344877748.db2.gz	SBXACWIOMZNROY-APWZRJJASA-N	0	3	343.446	3.310	20	30		EGEDHN
O=C(C1CC1)N1CCCC[C@H]1[C@@H]1CCN(CC#Cc2ccccc2)C1	ZINC001039184184	1344882982	/nfs/dbraw/zinc/88/29/82/1344882982.db2.gz	ORLXKJHBNVAVCQ-RTWAWAEBSA-N	0	3	336.479	3.151	20	30		EGEDHN
CC(C)C(=O)N1CCCC[C@@H]1[C@H]1CCN(CC#Cc2ccccc2)C1	ZINC001039185238	1344884790	/nfs/dbraw/zinc/88/47/90/1344884790.db2.gz	DPSSKXQCSUQNCM-LEWJYISDSA-N	0	3	338.495	3.397	20	30		EGEDHN
C=C(C)C[N@@H+]1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001039194294	1344901070	/nfs/dbraw/zinc/90/10/70/1344901070.db2.gz	YJUAAZMQBIRZAO-SJLPKXTDSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=C(C)C[N@H+]1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001039194294	1344901073	/nfs/dbraw/zinc/90/10/73/1344901073.db2.gz	YJUAAZMQBIRZAO-SJLPKXTDSA-N	0	3	328.456	3.285	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)C2CCC3(CC3)CC2)C1	ZINC001039217106	1344934124	/nfs/dbraw/zinc/93/41/24/1344934124.db2.gz	SMBAVSJWBYOJCB-RTBURBONSA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(F)c(C)c2)C1	ZINC001039226704	1344945724	/nfs/dbraw/zinc/94/57/24/1344945724.db2.gz	ZLCZBIWAQUACCJ-IEBWSBKVSA-N	0	3	328.431	3.084	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)Cc2cc(C)ccc2C)C1	ZINC001039228950	1344948852	/nfs/dbraw/zinc/94/88/52/1344948852.db2.gz	KKBMNJLDDCGZTE-FPOVZHCZSA-N	0	3	338.495	3.182	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccncc2Cl)C1	ZINC001039240807	1344965862	/nfs/dbraw/zinc/96/58/62/1344965862.db2.gz	YYVQSACMLVDIKG-MAUKXSAKSA-N	0	3	345.874	3.075	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc3c(C)cccn3c2)C1	ZINC001039242876	1344969886	/nfs/dbraw/zinc/96/98/86/1344969886.db2.gz	CWOCJXNFGXOAST-QUCCMNQESA-N	0	3	349.478	3.198	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2coc(C(F)F)c2)C1	ZINC001039245444	1344974392	/nfs/dbraw/zinc/97/43/92/1344974392.db2.gz	OJQFEEQDOYGEPL-HIFRSBDPSA-N	0	3	336.382	3.167	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc3c(s2)CCC3)C1	ZINC001039249236	1344979866	/nfs/dbraw/zinc/97/98/66/1344979866.db2.gz	HGYBKWUEMISLKJ-IAGOWNOFSA-N	0	3	342.508	3.187	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1CCCO[C@H]1C(C)C	ZINC001039376653	1345033838	/nfs/dbraw/zinc/03/38/38/1345033838.db2.gz	FTYMMAYDLJBFGX-XWSJACJDSA-N	0	3	334.504	3.079	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccnn1C1CCCC1	ZINC001039381949	1345036765	/nfs/dbraw/zinc/03/67/65/1345036765.db2.gz	PKMMBSPYCUDRFG-AEFFLSMTSA-N	0	3	342.487	3.253	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc2cccnc2c1	ZINC001039392910	1345042160	/nfs/dbraw/zinc/04/21/60/1345042160.db2.gz	KDOJQHGVWJNWLH-UXHICEINSA-N	0	3	349.478	3.419	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)CCc1ccc(OCC)cc1	ZINC001039397305	1345044934	/nfs/dbraw/zinc/04/49/34/1345044934.db2.gz	DGOGQBQKJUMPKB-MOPGFXCFSA-N	0	3	342.483	3.269	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccc2ncccc12	ZINC001039403590	1345048769	/nfs/dbraw/zinc/04/87/69/1345048769.db2.gz	DOADTGNLINZCNX-MOPGFXCFSA-N	0	3	349.478	3.419	20	30		EGEDHN
C=CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1scnc1C(F)F	ZINC001039403817	1345049729	/nfs/dbraw/zinc/04/97/29/1345049729.db2.gz	QYWXMTTUGNVEND-NEPJUHHUSA-N	0	3	341.427	3.336	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C1(C(F)F)CCCC1	ZINC001039423819	1345061386	/nfs/dbraw/zinc/06/13/86/1345061386.db2.gz	NPEWTPBEOCXZSV-CABCVRRESA-N	0	3	326.431	3.453	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)Cc1ccccc1F	ZINC001039434173	1345066141	/nfs/dbraw/zinc/06/61/41/1345066141.db2.gz	BVUKWSKBYYOQHK-UHOSZYNNSA-N	0	3	342.458	3.093	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccc(F)c1F	ZINC001039443641	1345069504	/nfs/dbraw/zinc/06/95/04/1345069504.db2.gz	XKKDIISFPMKGQI-CVEARBPZSA-N	0	3	334.410	3.149	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)c1c(C)noc1C	ZINC001039452070	1345074807	/nfs/dbraw/zinc/07/48/07/1345074807.db2.gz	DHEPIJBREHKKFW-XYPHTWIQSA-N	0	3	331.460	3.036	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccc2c1ccn2C	ZINC001039453089	1345075922	/nfs/dbraw/zinc/07/59/22/1345075922.db2.gz	HDFKNQPFHPKVQH-SJORKVTESA-N	0	3	337.467	3.433	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](F)CC1CCCCC1	ZINC001039460485	1345079136	/nfs/dbraw/zinc/07/91/36/1345079136.db2.gz	RTNUSWOJOMQPFK-QYZOEREBSA-N	0	3	334.479	3.384	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@H]1CCc2ccccc2C1	ZINC001039464286	1345082088	/nfs/dbraw/zinc/08/20/88/1345082088.db2.gz	CDIWARZJRWDWOB-WMQCIHAUSA-N	0	3	338.495	3.433	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(N(C)C)cc1	ZINC001039464666	1345082197	/nfs/dbraw/zinc/08/21/97/1345082197.db2.gz	RBRJRNUDXYTFQD-MOPGFXCFSA-N	0	3	327.472	3.008	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)c1ccc(F)cc1F	ZINC001039471993	1345087687	/nfs/dbraw/zinc/08/76/87/1345087687.db2.gz	XMBIVGZRVJCXCU-OIISXLGYSA-N	0	3	346.421	3.157	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1c(Cl)cccc1OC	ZINC001039474359	1345089097	/nfs/dbraw/zinc/08/90/97/1345089097.db2.gz	DBKWTXRWGURUGH-CABCVRRESA-N	0	3	346.858	3.051	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)Cc1ccc(C)cc1	ZINC001039474695	1345089804	/nfs/dbraw/zinc/08/98/04/1345089804.db2.gz	VHBJFEKKLKZNTJ-TYPHKJRUSA-N	0	3	338.495	3.262	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H](C)c1cccc(OC)c1	ZINC001039476238	1345090911	/nfs/dbraw/zinc/09/09/11/1345090911.db2.gz	IRUQNZPTZLVRAD-QRQLOZEOSA-N	0	3	342.483	3.440	20	30		EGEDHN
O=C(C#CC1CC1)N1C[C@H]2CCC[C@@H](C1)N2CC1CC2(CCC2)C1	ZINC001039580080	1345145646	/nfs/dbraw/zinc/14/56/46/1345145646.db2.gz	ZRJCCWRIJJGWLD-KDURUIRLSA-N	0	3	326.484	3.045	20	30		EGEDHN
CC[C@H](C)C(=O)N1CC[C@@]2(C1)CCCN(Cc1cccc(C#N)c1)C2	ZINC001040085589	1345330514	/nfs/dbraw/zinc/33/05/14/1345330514.db2.gz	ZKSUBRNCFSPVNL-UWJYYQICSA-N	0	3	339.483	3.419	20	30		EGEDHN
Cc1ccc(F)cc1CN1CCC[C@@]2(CCN(C(=O)[C@@H](C)C#N)C2)C1	ZINC001040121592	1345340087	/nfs/dbraw/zinc/34/00/87/1345340087.db2.gz	SOMLCRGPJONBBI-OXJNMPFZSA-N	0	3	343.446	3.108	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3nc(C(C)C)oc3C)C2)C1	ZINC001040201200	1345373147	/nfs/dbraw/zinc/37/31/47/1345373147.db2.gz	KRTTYFSBJYVYID-HXUWFJFHSA-N	0	3	343.471	3.058	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3c(C)noc3CCC)C2)C1	ZINC001040203353	1345374276	/nfs/dbraw/zinc/37/42/76/1345374276.db2.gz	XDSYVSPJPHIRMQ-IBGZPJMESA-N	0	3	331.460	3.050	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@@H]3CCCC4(CC4)C3)C2)C1	ZINC001040209101	1345375982	/nfs/dbraw/zinc/37/59/82/1345375982.db2.gz	NXXXRXLRLZLTCE-NQIIRXRSSA-N	0	3	328.500	3.295	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3cc4ccccc4nc3C)C2)C1	ZINC001040229759	1345385182	/nfs/dbraw/zinc/38/51/82/1345385182.db2.gz	WOYPRADWJOKZHM-QFIPXVFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3c(F)cc(C)cc3F)C2)C1	ZINC001040289283	1345413836	/nfs/dbraw/zinc/41/38/36/1345413836.db2.gz	NLSZJIJKZTVFHB-IBGZPJMESA-N	0	3	334.410	3.387	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cnc(CC4CC4)s3)C2)C1	ZINC001040304463	1345422954	/nfs/dbraw/zinc/42/29/54/1345422954.db2.gz	UVKSSALBKVAVNP-IBGZPJMESA-N	0	3	345.512	3.210	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)C(C)(C)c3cccs3)C2)C1	ZINC001040322807	1345431920	/nfs/dbraw/zinc/43/19/20/1345431920.db2.gz	MLXBQDZKOQWODO-HXUWFJFHSA-N	0	3	344.524	3.364	20	30		EGEDHN
CC[C@H](F)C(=O)N1CC[C@@]2(C1)CCCN(Cc1cccc(C#N)c1)C2	ZINC001040337536	1345440157	/nfs/dbraw/zinc/44/01/57/1345440157.db2.gz	NEZJLIGIGDUPRK-ICSRJNTNSA-N	0	3	343.446	3.121	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3scnc3C(C)C)C2)C1	ZINC001040443240	1345502410	/nfs/dbraw/zinc/50/24/10/1345502410.db2.gz	IEDVOZVZWXDKEI-LJQANCHMSA-N	0	3	345.512	3.218	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)C(C)(C)Cc3ccccc3)C2)C1	ZINC001040484394	1345516253	/nfs/dbraw/zinc/51/62/53/1345516253.db2.gz	OEDKQORRNXOTTR-QFIPXVFZSA-N	0	3	338.495	3.203	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3occ4c3CCCC4)C2)C1	ZINC001040506026	1345524606	/nfs/dbraw/zinc/52/46/06/1345524606.db2.gz	KNJWVOJEUHJJRO-HXUWFJFHSA-N	0	3	328.456	3.273	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)Cc3ccccc3Cl)C2)C1	ZINC001040518504	1345529424	/nfs/dbraw/zinc/52/94/24/1345529424.db2.gz	AIKZHALMHONWFR-FQEVSTJZSA-N	0	3	344.886	3.220	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)C3(c4ccccc4)CC3)C2)C1	ZINC001040518532	1345529872	/nfs/dbraw/zinc/52/98/72/1345529872.db2.gz	BEFVJCXEPKDPPQ-NRFANRHFSA-N	0	3	336.479	3.056	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cccc4cnccc43)C2)C1	ZINC001040532323	1345534638	/nfs/dbraw/zinc/53/46/38/1345534638.db2.gz	VWYKJXWXUFONTK-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)CC(C)(C)c3ccccc3)C2)C1	ZINC001040542447	1345537908	/nfs/dbraw/zinc/53/79/08/1345537908.db2.gz	IRZCSWGDVYIXRV-JOCHJYFZSA-N	0	3	338.495	3.302	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3ccc(C)c4c3CCC4)C2)C1	ZINC001040545588	1345539827	/nfs/dbraw/zinc/53/98/27/1345539827.db2.gz	RKQLPGOEZIALRG-QFIPXVFZSA-N	0	3	336.479	3.045	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@H]3CCC(C)=C(C)C3)C2)CC1	ZINC001040714796	1345569225	/nfs/dbraw/zinc/56/92/25/1345569225.db2.gz	NGYAXQIPEMALLT-IBGZPJMESA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccc(CCC)s3)C2)CC1	ZINC001040716897	1345569763	/nfs/dbraw/zinc/56/97/63/1345569763.db2.gz	SBIKEWBJOPMCOT-UHFFFAOYSA-N	0	3	330.497	3.262	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC2(C1)CCN(Cc1ccccn1)CC2	ZINC001040802111	1345579370	/nfs/dbraw/zinc/57/93/70/1345579370.db2.gz	IIVLWGSGMHGSRT-UHFFFAOYSA-N	0	3	327.472	3.108	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@H](C)c3cccc(C)c3)C2)CC1	ZINC001040867386	1345590387	/nfs/dbraw/zinc/59/03/87/1345590387.db2.gz	DOISYCKZXLOINT-LJQANCHMSA-N	0	3	338.495	3.436	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccc4[nH]c(C)c(C)c4c3)C2)CC1	ZINC001040935816	1345605201	/nfs/dbraw/zinc/60/52/01/1345605201.db2.gz	RKJFTHBATCAAQH-UHFFFAOYSA-N	0	3	349.478	3.346	20	30		EGEDHN
Cc1cccc(Cl)c1CN1CC[C@@]2(CCN(C(=O)[C@@H](C)C#N)C2)C1	ZINC001041137493	1345658273	/nfs/dbraw/zinc/65/82/73/1345658273.db2.gz	UBYRFBIJJJLRGJ-HNAYVOBHSA-N	0	3	345.874	3.233	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)CC(C)(C)c3ccc(F)cc3)C2)C1	ZINC001041363726	1345710920	/nfs/dbraw/zinc/71/09/20/1345710920.db2.gz	VQDQKIKUPGMFCT-OAQYLSRUSA-N	0	3	342.458	3.051	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@]2(CCN(Cc3cnccc3C)C2)C1	ZINC001041536391	1345755511	/nfs/dbraw/zinc/75/55/11/1345755511.db2.gz	NICSVZNGAAKCGZ-OAQYLSRUSA-N	0	3	341.499	3.417	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@]3(CCN(C(=O)[C@H]4C[C@H]5C[C@H]5C4)C3)C2)c1	ZINC001041588363	1345784080	/nfs/dbraw/zinc/78/40/80/1345784080.db2.gz	WSQQHCQKIXEWRB-HIUFNZKISA-N	0	3	349.478	3.029	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@]2(CCN(Cc3cncc(C)c3)C2)C1	ZINC001041626475	1345800837	/nfs/dbraw/zinc/80/08/37/1345800837.db2.gz	UKJGIIVFBOGCDO-SFTDATJTSA-N	0	3	341.499	3.417	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@]2(CCN(Cc3cccnc3)C2)C1	ZINC001041627073	1345800859	/nfs/dbraw/zinc/80/08/59/1345800859.db2.gz	ZSYZZKBDGLERTJ-WOJBJXKFSA-N	0	3	327.472	3.108	20	30		EGEDHN
CC1(C(=O)N2CC[C@@]3(CCN(Cc4cccc(C#N)c4)C3)C2)CC=CC1	ZINC001041633082	1345803591	/nfs/dbraw/zinc/80/35/91/1345803591.db2.gz	PHJPAJZFTCAVNU-JOCHJYFZSA-N	0	3	349.478	3.339	20	30		EGEDHN
CC(F)(F)CC(=O)N1CC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001041647571	1345809509	/nfs/dbraw/zinc/80/95/09/1345809509.db2.gz	YJFRGQKODMSGDR-LJQANCHMSA-N	0	3	347.409	3.028	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@]3(CCN(Cc4c(C)noc4C)C3)C2)C1	ZINC001041652618	1345811082	/nfs/dbraw/zinc/81/10/82/1345811082.db2.gz	LWVOZKVJMCKINO-FQEVSTJZSA-N	0	3	343.471	3.072	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@]3(CCN(Cc4oc(C)nc4C)C3)C2)C1	ZINC001041658602	1345813974	/nfs/dbraw/zinc/81/39/74/1345813974.db2.gz	ZHFGSFFLFUYGRO-HXUWFJFHSA-N	0	3	343.471	3.072	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)[C@@H](C)OC3CCCCCC3)C2)C1	ZINC001041662013	1345815330	/nfs/dbraw/zinc/81/53/30/1345815330.db2.gz	ZURHJBWQHDFDDC-WIYYLYMNSA-N	0	3	346.515	3.062	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccc(C(C)C)nc3C)C2)C1	ZINC001041691954	1345820812	/nfs/dbraw/zinc/82/08/12/1345820812.db2.gz	HOXBRQSGTNAUQB-NRFANRHFSA-N	0	3	339.483	3.075	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3cccc(-c4ccoc4)c3)C2)C1	ZINC001041777141	1345846312	/nfs/dbraw/zinc/84/63/12/1345846312.db2.gz	IKULEHPIFVJRAV-NRFANRHFSA-N	0	3	334.419	3.118	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)[C@@H](C)c3ccc(Cl)s3)C2)C1	ZINC001041779896	1345847324	/nfs/dbraw/zinc/84/73/24/1345847324.db2.gz	SCWUUSFJFOIEGW-GUYCJALGSA-N	0	3	336.888	3.063	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)CCc3ccccc3Cl)C2)C1	ZINC001041819200	1345862376	/nfs/dbraw/zinc/86/23/76/1345862376.db2.gz	BSJBWDNJXRDZFC-HXUWFJFHSA-N	0	3	344.886	3.220	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3oc4c(cccc4C)c3C)C2)C1	ZINC001041845507	1345871704	/nfs/dbraw/zinc/87/17/04/1345871704.db2.gz	FZGDTACAMIWPLX-OAQYLSRUSA-N	0	3	336.435	3.221	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccc(CC)c(CC)c3)C2)C1	ZINC001041868025	1345877469	/nfs/dbraw/zinc/87/74/69/1345877469.db2.gz	ZTBLYXCUUGHGNM-JOCHJYFZSA-N	0	3	338.495	3.373	20	30		EGEDHN
CC(C)(C)CC(=O)N1CC[C@H]2CCN(Cc3ccc(C#N)cc3)[C@H]2C1	ZINC001041926795	1345899790	/nfs/dbraw/zinc/89/97/90/1345899790.db2.gz	FENHKJRAYYUJJF-MOPGFXCFSA-N	0	3	339.483	3.417	20	30		EGEDHN
CC(C)(C)CC(=O)N1CC[C@@H]2CCN(Cc3cccc(C#N)c3)[C@H]2C1	ZINC001041929954	1345900628	/nfs/dbraw/zinc/90/06/28/1345900628.db2.gz	VKZKYMCXNJATGH-OALUTQOASA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3c(C)noc3CCC)C[C@H]21	ZINC001042053661	1345932223	/nfs/dbraw/zinc/93/22/23/1345932223.db2.gz	CQDIEOZIDJFXID-JKSUJKDBSA-N	0	3	331.460	3.048	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3oc(CC4CC4)nc3C)C[C@H]21	ZINC001042064813	1345933778	/nfs/dbraw/zinc/93/37/78/1345933778.db2.gz	JUFIIBXNLXEJIS-IAGOWNOFSA-N	0	3	343.471	3.048	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc4ccccc4nc3C)C[C@H]21	ZINC001042085760	1345940503	/nfs/dbraw/zinc/94/05/03/1345940503.db2.gz	QTUMCYJGINHHDE-OXQOHEQNSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3cc4ccncc4s3)C[C@H]21	ZINC001042096432	1345943176	/nfs/dbraw/zinc/94/31/76/1345943176.db2.gz	YCRPTDLONVGCKY-GOEBONIOSA-N	0	3	341.480	3.409	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)Cc3ccc(C)c(Cl)c3)C[C@H]21	ZINC001042114481	1345947647	/nfs/dbraw/zinc/94/76/47/1345947647.db2.gz	KTUTTZDWKKHLQS-PKOBYXMFSA-N	0	3	344.886	3.137	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cn(CC)c4ccccc34)C[C@@H]21	ZINC001042142060	1345955094	/nfs/dbraw/zinc/95/50/94/1345955094.db2.gz	KVOFYNYPZSCQMB-UWJYYQICSA-N	0	3	349.478	3.221	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cnc4ccccc4c3C)C[C@H]21	ZINC001042155138	1345958156	/nfs/dbraw/zinc/95/81/56/1345958156.db2.gz	HWDFBONFHNVQEE-OXJNMPFZSA-N	0	3	335.451	3.266	20	30		EGEDHN
CC1(CC(=O)N2CC[C@H]3CCN(Cc4cccc(C#N)c4)[C@@H]3C2)CC1	ZINC001042157121	1345959425	/nfs/dbraw/zinc/95/94/25/1345959425.db2.gz	ZMWNIRDVNTWQFE-RTBURBONSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2CCN(Cc3ncccc3C)[C@H]2C1	ZINC001042185161	1345972585	/nfs/dbraw/zinc/97/25/85/1345972585.db2.gz	QTZULRUGSIKBKT-MJGOQNOKSA-N	0	3	341.499	3.415	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3cccnc3C)[C@@H]2C1	ZINC001042186643	1345974221	/nfs/dbraw/zinc/97/42/21/1345974221.db2.gz	IWUWPMFLJBYNTH-FUHWJXTLSA-N	0	3	327.472	3.025	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc4cccc(OC)c4o3)C[C@H]21	ZINC001042202183	1345981807	/nfs/dbraw/zinc/98/18/07/1345981807.db2.gz	XGKCOUJQMXSQSD-GOEBONIOSA-N	0	3	340.423	3.164	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cncc4sccc43)C[C@H]21	ZINC001042205583	1345983564	/nfs/dbraw/zinc/98/35/64/1345983564.db2.gz	XUQLEHWFEBTCOQ-XJKSGUPXSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(F)cc4cccnc43)C[C@H]21	ZINC001042254634	1346007098	/nfs/dbraw/zinc/00/70/98/1346007098.db2.gz	MUTPFTHUYZZNTN-KBXCAEBGSA-N	0	3	339.414	3.096	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3csc(C(C)C)n3)C[C@@H]21	ZINC001042265239	1346011806	/nfs/dbraw/zinc/01/18/06/1346011806.db2.gz	DSOZJHRAGIIHQX-HOCLYGCPSA-N	0	3	333.501	3.379	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc4nc(C)ccc4c3)C[C@@H]21	ZINC001042278477	1346015351	/nfs/dbraw/zinc/01/53/51/1346015351.db2.gz	VVTUAAPKLGGNFT-UWJYYQICSA-N	0	3	347.462	3.103	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ncc(Cl)cc3Cl)C[C@H]21	ZINC001042287978	1346017841	/nfs/dbraw/zinc/01/78/41/1346017841.db2.gz	PWKDVPOJJBYENZ-SMDDNHRTSA-N	0	3	340.254	3.111	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)[C@H]3CC[C@H](C(C)C)CC3)C[C@@H]21	ZINC001042288069	1346017984	/nfs/dbraw/zinc/01/79/84/1346017984.db2.gz	ALEPRYQFFMDSEU-MUGJNUQGSA-N	0	3	330.516	3.395	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)C(C)(C)Cc3ccccc3)C[C@H]21	ZINC001042303492	1346024747	/nfs/dbraw/zinc/02/47/47/1346024747.db2.gz	HQJXWRDGQJCRQX-VQTJNVASSA-N	0	3	338.495	3.201	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3ncsc3C(C)C)C[C@@H]21	ZINC001042308973	1346026601	/nfs/dbraw/zinc/02/66/01/1346026601.db2.gz	IQLJUZHAABQKFN-CABCVRRESA-N	0	3	333.501	3.379	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3ncsc3C(C)C)C[C@H]21	ZINC001042308975	1346027641	/nfs/dbraw/zinc/02/76/41/1346027641.db2.gz	IQLJUZHAABQKFN-HUUCEWRRSA-N	0	3	333.501	3.379	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)Cc3cccc4ccccc43)C[C@H]21	ZINC001042323091	1346033100	/nfs/dbraw/zinc/03/31/00/1346033100.db2.gz	RAAWTTNPCLJSNM-DENIHFKCSA-N	0	3	346.474	3.328	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3sccc3C(F)F)C[C@H]21	ZINC001042330871	1346038308	/nfs/dbraw/zinc/03/83/08/1346038308.db2.gz	IFQVRLUAWSKSBV-GXTWGEPZSA-N	0	3	338.423	3.245	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3oc4ccccc4c3C)C[C@@H]21	ZINC001042343461	1346046694	/nfs/dbraw/zinc/04/66/94/1346046694.db2.gz	MQJIXJBSENOKOP-AEFFLSMTSA-N	0	3	336.435	3.301	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)Cc3ccc4ccccc4c3)C[C@H]21	ZINC001042349295	1346050389	/nfs/dbraw/zinc/05/03/89/1346050389.db2.gz	PMAFGMYTFFMICD-IFMALSPDSA-N	0	3	346.474	3.328	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cc(C)c(F)c(C)c3)C[C@@H]21	ZINC001042359629	1346054239	/nfs/dbraw/zinc/05/42/39/1346054239.db2.gz	FSMYIVRABJUAAF-WMZOPIPTSA-N	0	3	328.431	3.002	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc4cccc(F)c4o3)C[C@H]21	ZINC001042366957	1346058790	/nfs/dbraw/zinc/05/87/90/1346058790.db2.gz	YNQLAVZZDNIKJA-CZUORRHYSA-N	0	3	328.387	3.294	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)CCc3cc(C)sc3C)C[C@@H]21	ZINC001042374520	1346062823	/nfs/dbraw/zinc/06/28/23/1346062823.db2.gz	IQTFVYVHAFHNRM-HKUYNNGSSA-N	0	3	344.524	3.244	20	30		EGEDHN
Cc1cccc(C(=O)N2CC[C@@H](NCc3ccccc3C#N)C[C@@H]2C)n1	ZINC001044480470	1346344411	/nfs/dbraw/zinc/34/44/11/1346344411.db2.gz	BOBFMWSULHYNLW-QFBILLFUSA-N	0	3	348.450	3.045	20	30		EGEDHN
C[C@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)CC1(C)CC1	ZINC001044690787	1346404529	/nfs/dbraw/zinc/40/45/29/1346404529.db2.gz	XRZWCVJRVLRQIR-MAUKXSAKSA-N	0	3	325.456	3.218	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3cnc(C)o3)C[C@@H]2C)CC1	ZINC001044729153	1346414105	/nfs/dbraw/zinc/41/41/05/1346414105.db2.gz	FOADQWOAWZFHNI-YOEHRIQHSA-N	0	3	331.460	3.199	20	30		EGEDHN
C[C@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)C1CC2(CC2)C1	ZINC001044738869	1346417362	/nfs/dbraw/zinc/41/73/62/1346417362.db2.gz	GYOHEIDMPFWXRD-KXBFYZLASA-N	0	3	337.467	3.218	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)Cc2cccs2)s1	ZINC001044900022	1346457460	/nfs/dbraw/zinc/45/74/60/1346457460.db2.gz	NBHYKFQPRPODRO-ZDUSSCGKSA-N	0	3	345.493	3.005	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H]1CNCc1c(C)noc1CC	ZINC001045185822	1346522531	/nfs/dbraw/zinc/52/25/31/1346522531.db2.gz	MYRVPJRIJQCBSM-HNAYVOBHSA-N	0	3	333.476	3.228	20	30		EGEDHN
Cc1ccc(C(=O)NC2(C)CCN(Cc3ccc(C#N)cc3)CC2)cn1	ZINC001045368411	1346576497	/nfs/dbraw/zinc/57/64/97/1346576497.db2.gz	LOQDXHGPDVFCEB-UHFFFAOYSA-N	0	3	348.450	3.046	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2cc(C3CC3)[nH]c2C2CC2)CC1	ZINC001045476228	1346603211	/nfs/dbraw/zinc/60/32/11/1346603211.db2.gz	FVDNVIBMTMBDDS-UHFFFAOYSA-N	0	3	339.483	3.377	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2ccc(OC)c(C(C)C)c2)CC1	ZINC001045495405	1346608780	/nfs/dbraw/zinc/60/87/80/1346608780.db2.gz	GWKGKNIEZYMNPK-UHFFFAOYSA-N	0	3	342.483	3.426	20	30		EGEDHN
CC1(C)CC[C@H]1C(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045527386	1346617221	/nfs/dbraw/zinc/61/72/21/1346617221.db2.gz	MTLDNAQZIQMPBT-SFHVURJKSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2csc(-c3ccco3)n2)CC1	ZINC001045536764	1346621056	/nfs/dbraw/zinc/62/10/56/1346621056.db2.gz	DKOVLYSGWHUCRH-UHFFFAOYSA-N	0	3	331.441	3.173	20	30		EGEDHN
CC[C@@]1(C)C[C@@H]1C(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045607263	1346644197	/nfs/dbraw/zinc/64/41/97/1346644197.db2.gz	SECCLGMDPBASCK-QUCCMNQESA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@]1(C(=O)N2CC[C@H]3CC[C@@H](C2)N3Cc2cccc(C#N)c2)C=CCC1	ZINC001045829430	1346712250	/nfs/dbraw/zinc/71/22/50/1346712250.db2.gz	AAOFSJFGVKZWEA-URVUXULASA-N	0	3	349.478	3.480	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1ccc(C#N)cc1	ZINC001045858218	1346723173	/nfs/dbraw/zinc/72/31/73/1346723173.db2.gz	WYHNVABVVIMHKH-DBVUQKKJSA-N	0	3	339.483	3.416	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1sccc1C)C2	ZINC001045908697	1346745655	/nfs/dbraw/zinc/74/56/55/1346745655.db2.gz	JONMXNUUQSMDEW-IBGZPJMESA-N	0	3	330.497	3.398	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H]1CCC=CCCC1)C2	ZINC001045947998	1346783309	/nfs/dbraw/zinc/78/33/09/1346783309.db2.gz	RPWHRSDDVASHGP-TZIWHRDSSA-N	0	3	328.500	3.461	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H]1CC[C@@H](C)N(CCOCC2CC2)C1	ZINC001132077942	1375135586	/nfs/dbraw/zinc/13/55/86/1375135586.db2.gz	JLQAAUMRVKKJIA-CZUORRHYSA-N	0	3	342.911	3.161	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)CC[C@H]1CCCCO1)C2	ZINC001045969503	1346804675	/nfs/dbraw/zinc/80/46/75/1346804675.db2.gz	ROVBINTUOBOYQR-TZIWHRDSSA-N	0	3	346.515	3.064	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc3ccccn3c1)C2	ZINC001045971853	1346807632	/nfs/dbraw/zinc/80/76/32/1346807632.db2.gz	TWAQVBLZDNYYGB-JOCHJYFZSA-N	0	3	349.478	3.281	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)C[C@@H](C)c1ccco1)C2	ZINC001045979846	1346817357	/nfs/dbraw/zinc/81/73/57/1346817357.db2.gz	KLWWTLIBHFBJEP-YLJYHZDGSA-N	0	3	328.456	3.111	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc3[nH]ccc3s1)C2	ZINC001045981048	1346818663	/nfs/dbraw/zinc/81/86/63/1346818663.db2.gz	BVZNBQSMMBPIJW-LJQANCHMSA-N	0	3	341.480	3.181	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc3[nH]ccc3s1)C2	ZINC001045981047	1346819030	/nfs/dbraw/zinc/81/90/30/1346819030.db2.gz	BVZNBQSMMBPIJW-IBGZPJMESA-N	0	3	341.480	3.181	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N[C@]1(C)CCN(Cc2csc(C)c2)C1	ZINC001046327263	1346935558	/nfs/dbraw/zinc/93/55/58/1346935558.db2.gz	IZWRFDGCKVCZQC-ZIFCJYIRSA-N	0	3	348.512	3.118	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2cc(C)n(CC3CC3)c2C)C1	ZINC001046772356	1347093728	/nfs/dbraw/zinc/09/37/28/1347093728.db2.gz	CSGSDHMNFWNWIA-HXUWFJFHSA-N	0	3	329.488	3.285	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@]2(C)CCN(Cc3ccccc3CC)C2)nc1	ZINC001046781038	1347097748	/nfs/dbraw/zinc/09/77/48/1347097748.db2.gz	DQVSULLDURLKEP-JOCHJYFZSA-N	0	3	347.462	3.020	20	30		EGEDHN
C#CCCN1CC[C@](C)(NC(=O)c2csc3c2CC[C@H](C)C3)C1	ZINC001046817026	1347116559	/nfs/dbraw/zinc/11/65/59/1347116559.db2.gz	RYDYRLPYLTXDJU-LIRRHRJNSA-N	0	3	330.497	3.090	20	30		EGEDHN
C=C(C)CC[N@@H+]1CCC(F)(F)[C@H](CNC(=O)c2ccccc2[O-])C1	ZINC001046919328	1347153858	/nfs/dbraw/zinc/15/38/58/1347153858.db2.gz	SKXCXHMCFWLQTA-CQSZACIVSA-N	0	3	338.398	3.045	20	30		EGEDHN
C=C(C)CC[N@H+]1CCC(F)(F)[C@H](CNC(=O)c2ccccc2[O-])C1	ZINC001046919328	1347153860	/nfs/dbraw/zinc/15/38/60/1347153860.db2.gz	SKXCXHMCFWLQTA-CQSZACIVSA-N	0	3	338.398	3.045	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)Cc3ccsc3)C2)CC1	ZINC001047220543	1347252492	/nfs/dbraw/zinc/25/24/92/1347252492.db2.gz	AVDDWJWCXFJCDL-LJQANCHMSA-N	0	3	344.524	3.265	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)CCc3ccco3)C2)CC1	ZINC001047224861	1347254791	/nfs/dbraw/zinc/25/47/91/1347254791.db2.gz	KAPMOLRWQHNUJG-LJQANCHMSA-N	0	3	342.483	3.186	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)[C@H]3CCC3(F)F)C2)CC1	ZINC001047242070	1347268414	/nfs/dbraw/zinc/26/84/14/1347268414.db2.gz	AYPCHPMTXCKQCZ-IAGOWNOFSA-N	0	3	338.442	3.006	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)[C@H](C)C3CCC3)C2)CC1	ZINC001047243285	1347269359	/nfs/dbraw/zinc/26/93/59/1347269359.db2.gz	JSMAZUXHAYGVQC-XLIONFOSSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3cc(F)cc(F)c3)C2)CC1	ZINC001047264106	1347284796	/nfs/dbraw/zinc/28/47/96/1347284796.db2.gz	GUKSGBSBTJHTGO-MRXNPFEDSA-N	0	3	346.421	3.162	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3c(C)cccc3F)C2)CC1	ZINC001047265659	1347286494	/nfs/dbraw/zinc/28/64/94/1347286494.db2.gz	LBDOJFCKKXDOEF-GOSISDBHSA-N	0	3	342.458	3.332	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@H]([C@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001047733095	1347355278	/nfs/dbraw/zinc/35/52/78/1347355278.db2.gz	RCPYCIQAPLBZRF-YOEHRIQHSA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@H](NCc1c(F)cccc1Cl)[C@H]1CCN(C(=O)C#CC2CC2)C1	ZINC001047837345	1347385312	/nfs/dbraw/zinc/38/53/12/1347385312.db2.gz	WHARZKHUXXZODN-ZFWWWQNUSA-N	0	3	348.849	3.219	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]([C@@H](C)NCc2ccccc2C#N)C1	ZINC001047924430	1347411121	/nfs/dbraw/zinc/41/11/21/1347411121.db2.gz	NOXFIFCPDKKVBO-CRAIPNDOSA-N	0	3	325.456	3.097	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H]([C@H](C)NCc3nc(C)oc3C)C2)CC1	ZINC001047961332	1347425352	/nfs/dbraw/zinc/42/53/52/1347425352.db2.gz	BUFRUPMOKIFFIF-KBXCAEBGSA-N	0	3	345.487	3.364	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)C2(C)CC=CC2)C1	ZINC001047962260	1347425864	/nfs/dbraw/zinc/42/58/64/1347425864.db2.gz	JZEWWSYNZQFMFZ-LPHOPBHVSA-N	0	3	337.467	3.241	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]([C@@H](C)NCc3ccccc3C#N)C2)C1	ZINC001047966212	1347427390	/nfs/dbraw/zinc/42/73/90/1347427390.db2.gz	QQRMCFVXNULWAH-VQIMIIECSA-N	0	3	337.467	3.241	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC(C)(C)C)C[C@H]1CNCc1cc(F)ccc1C#N	ZINC001048149937	1347481980	/nfs/dbraw/zinc/48/19/80/1347481980.db2.gz	YILWTSCYLWBBHV-RHSMWYFYSA-N	0	3	345.462	3.318	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](C)[C@@H](CNCc2ccn(C(C)C)n2)C1	ZINC001048340029	1347523050	/nfs/dbraw/zinc/52/30/50/1347523050.db2.gz	NWQMZUSVEKITPE-IRXDYDNUSA-N	0	3	346.519	3.250	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H](C)[C@@H](CNCc3nc(C)cs3)C2)CC1	ZINC001048370633	1347533040	/nfs/dbraw/zinc/53/30/40/1347533040.db2.gz	SVUQPCRQEILSQD-PBHICJAKSA-N	0	3	347.528	3.382	20	30		EGEDHN
O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)N2CC#Cc1ccccc1)c1ccco1	ZINC001048497532	1347567513	/nfs/dbraw/zinc/56/75/13/1347567513.db2.gz	LUZKVVNGDZGELB-ACDBMABISA-N	0	3	348.446	3.304	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)[C@@H]2CC[C@@H](C)C2)CC1	ZINC001048626523	1347624587	/nfs/dbraw/zinc/62/45/87/1347624587.db2.gz	RRIKZJWFSDQVBF-QZTJIDSGSA-N	0	3	341.499	3.497	20	30		EGEDHN
C=C(C)CN1CCC(N(Cc2ccccn2)C(=O)[C@H]2CC23CC3)CC1	ZINC001048629386	1347625051	/nfs/dbraw/zinc/62/50/51/1347625051.db2.gz	WGYCAONKJLJYEV-LJQANCHMSA-N	0	3	339.483	3.251	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)CC(C)(C)C3CCCCC3)C[C@@H]2C1	ZINC001049172540	1347738478	/nfs/dbraw/zinc/73/84/78/1347738478.db2.gz	YAVHQHQZURDKRH-HDICACEKSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@H](CC)c3ccc(Cl)cc3)C[C@@H]2C1	ZINC001049228462	1347752045	/nfs/dbraw/zinc/75/20/45/1347752045.db2.gz	CXARSGOYPGAEOJ-ZIFCJYIRSA-N	0	3	344.886	3.247	20	30		EGEDHN
Cc1cc(CN2CC[C@H]3[C@H]2CCCN3C(=O)C#CC2CC2)cs1	ZINC001049468765	1347863911	/nfs/dbraw/zinc/86/39/11/1347863911.db2.gz	XXWBSSHNZPJSJD-MSOLQXFVSA-N	0	3	328.481	3.035	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(F)cc2ccncc21	ZINC001049482424	1347870339	/nfs/dbraw/zinc/87/03/39/1347870339.db2.gz	XKUDKAAGJWHONB-RTBURBONSA-N	0	3	339.414	3.239	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1cncc2ccccc21	ZINC001049528815	1347893839	/nfs/dbraw/zinc/89/38/39/1347893839.db2.gz	BBRUCFFLCZPGGQ-PMACEKPBSA-N	0	3	335.451	3.029	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cccc(-n2cccc2)c1	ZINC001049577316	1347918101	/nfs/dbraw/zinc/91/81/01/1347918101.db2.gz	PBNUYMQSBUWOGD-UXHICEINSA-N	0	3	335.451	3.342	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccn(C(C)C)c1C	ZINC001049658921	1347959399	/nfs/dbraw/zinc/95/93/99/1347959399.db2.gz	GVVPLZRQVAQMBG-OALUTQOASA-N	0	3	327.472	3.080	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc2cc(OC)ccc2[nH]1	ZINC001049682981	1347970735	/nfs/dbraw/zinc/97/07/35/1347970735.db2.gz	YVWPSJDXWQMIDO-OALUTQOASA-N	0	3	339.439	3.041	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]3[C@@H]2CCN3CCC(F)(F)F)C1	ZINC001049704696	1347982168	/nfs/dbraw/zinc/98/21/68/1347982168.db2.gz	ZJDQDNQQWGRZMI-KBPBESRZSA-N	0	3	330.394	3.360	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C[C@H](C)c1cccc(F)c1	ZINC001049708143	1347984560	/nfs/dbraw/zinc/98/45/60/1347984560.db2.gz	OOHZLKNOJZPMPE-PWIZWCRZSA-N	0	3	342.458	3.408	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](C)Cc1ccccc1F	ZINC001049713502	1347987777	/nfs/dbraw/zinc/98/77/77/1347987777.db2.gz	DPDBRZQPRQMQOT-AYOQOUSVSA-N	0	3	330.447	3.256	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(C2CC2)nc1C	ZINC001049743041	1347996335	/nfs/dbraw/zinc/99/63/35/1347996335.db2.gz	YGCHJYVETDRRKF-OALUTQOASA-N	0	3	325.456	3.132	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](CC)Oc1ccccc1C	ZINC001049757941	1348004455	/nfs/dbraw/zinc/00/44/55/1348004455.db2.gz	DRVPSSVRHMWONJ-QRVBRYPASA-N	0	3	342.483	3.404	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cnc(C)nc1C(C)C	ZINC001049768691	1348011337	/nfs/dbraw/zinc/01/13/37/1348011337.db2.gz	YQDKEIGRYAKGIW-ROUUACIJSA-N	0	3	342.487	3.163	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cnc(C(C)C)nc1C	ZINC001049768767	1348012182	/nfs/dbraw/zinc/01/21/82/1348012182.db2.gz	DPBRJXAMQNMVTR-ROUUACIJSA-N	0	3	342.487	3.163	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cn1cc(C)c2ccccc21	ZINC001049775435	1348015964	/nfs/dbraw/zinc/01/59/64/1348015964.db2.gz	DFTKUDFGXAPCNH-RTWAWAEBSA-N	0	3	349.478	3.038	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C[C@H](C)c1ccccc1F	ZINC001049788268	1348022016	/nfs/dbraw/zinc/02/20/16/1348022016.db2.gz	MVLWSOPQUFWQEA-KFKAGJAMSA-N	0	3	328.431	3.018	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(F)c2ncccc2c1	ZINC001049789860	1348023212	/nfs/dbraw/zinc/02/32/12/1348023212.db2.gz	IABGQGJTCKXPSC-ZWKOTPCHSA-N	0	3	339.414	3.239	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(OC)cc1Cl	ZINC001049793854	1348024318	/nfs/dbraw/zinc/02/43/18/1348024318.db2.gz	QYIMGPDTVIFFAD-IAGOWNOFSA-N	0	3	334.847	3.214	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(Cl)cc(OC)c1	ZINC001049800431	1348026669	/nfs/dbraw/zinc/02/66/69/1348026669.db2.gz	BHSQWQWCKUHFPT-DLBZAZTESA-N	0	3	334.847	3.214	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cccc(OC)c1F	ZINC001049800077	1348026705	/nfs/dbraw/zinc/02/67/05/1348026705.db2.gz	AGWJOQQOKPMOGA-HZPDHXFCSA-N	0	3	332.419	3.089	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](c1cccnc1)C(C)C	ZINC001049806245	1348028869	/nfs/dbraw/zinc/02/88/69/1348028869.db2.gz	NDPSEWJMJVLNJZ-QRVBRYPASA-N	0	3	327.472	3.073	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc2scnc2c1	ZINC001049820359	1348037475	/nfs/dbraw/zinc/03/74/75/1348037475.db2.gz	KAWFIRLKMSEJOW-HOTGVXAUSA-N	0	3	327.453	3.161	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1[nH]c2ccc(C)cc2c1C	ZINC001049821695	1348038634	/nfs/dbraw/zinc/03/86/34/1348038634.db2.gz	HSGUKDSRAZKJFI-UXHICEINSA-N	0	3	349.478	3.487	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cnc2ccc(F)cc2c1	ZINC001049825024	1348041618	/nfs/dbraw/zinc/04/16/18/1348041618.db2.gz	LPLLGLXNCPGRPK-RTBURBONSA-N	0	3	339.414	3.239	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1coc(C2CCCC2)n1	ZINC001049828879	1348043689	/nfs/dbraw/zinc/04/36/89/1348043689.db2.gz	RCWLUOMUABLSNW-QZTJIDSGSA-N	0	3	341.455	3.034	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cnn([C@H](C)CC)c1C	ZINC001049834531	1348047768	/nfs/dbraw/zinc/04/77/68/1348047768.db2.gz	KXCFAKGGFMPGSW-ZTFGCOKTSA-N	0	3	330.476	3.027	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cnn([C@@H](C)CC)c1C	ZINC001049834528	1348048023	/nfs/dbraw/zinc/04/80/23/1348048023.db2.gz	KXCFAKGGFMPGSW-BMGDILEWSA-N	0	3	330.476	3.027	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1sccc1COC	ZINC001049838800	1348051440	/nfs/dbraw/zinc/05/14/40/1348051440.db2.gz	FNOKRFVDLCAXKR-JKSUJKDBSA-N	0	3	334.485	3.150	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc2nc(C)ccc2o1	ZINC001049854666	1348061591	/nfs/dbraw/zinc/06/15/91/1348061591.db2.gz	OZIKHVNPOMGAGO-IRXDYDNUSA-N	0	3	339.439	3.391	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1sccc1C(F)F	ZINC001049875300	1348080245	/nfs/dbraw/zinc/08/02/45/1348080245.db2.gz	IQHZWIQBZVRSLO-KBPBESRZSA-N	0	3	338.423	3.388	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1sccc1C1CC1	ZINC001049877881	1348082958	/nfs/dbraw/zinc/08/29/58/1348082958.db2.gz	SBYZPHVHLFIFPZ-DLBZAZTESA-N	0	3	328.481	3.328	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(CC)c(C)s1	ZINC001049880492	1348085876	/nfs/dbraw/zinc/08/58/76/1348085876.db2.gz	BNIKTACCGCGFSE-IRXDYDNUSA-N	0	3	330.497	3.321	20	30		EGEDHN
Cc1c[nH]cc1C(=O)N1CCC[C@H]2[C@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049889518	1348094056	/nfs/dbraw/zinc/09/40/56/1348094056.db2.gz	GPESKWREOWPKKF-VQTJNVASSA-N	0	3	348.450	3.074	20	30		EGEDHN
Cc1c[nH]cc1C(=O)N1CCC[C@H]2[C@H]1CCN2Cc1cccc(C#N)c1	ZINC001049890413	1348095040	/nfs/dbraw/zinc/09/50/40/1348095040.db2.gz	MWHUWXJTODOZFD-VQTJNVASSA-N	0	3	348.450	3.074	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc2cc(C)ccc2o1	ZINC001049915171	1348109810	/nfs/dbraw/zinc/10/98/10/1348109810.db2.gz	TYXLRJKPVSIQGP-ZWKOTPCHSA-N	0	3	336.435	3.443	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C12CC(c3ccccc3)(C1)C2	ZINC001049916985	1348110715	/nfs/dbraw/zinc/11/07/15/1348110715.db2.gz	KCJMZFRPAGWGSF-RVEPMOMFSA-N	0	3	336.479	3.360	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](C)Cc1cccc(F)c1	ZINC001049923515	1348115478	/nfs/dbraw/zinc/11/54/78/1348115478.db2.gz	MZNCIHHUADRJOT-AYOQOUSVSA-N	0	3	330.447	3.256	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](C)Cc1cccc(F)c1	ZINC001049925741	1348116492	/nfs/dbraw/zinc/11/64/92/1348116492.db2.gz	FYCJTZIVDHNMRQ-NSISKUIASA-N	0	3	342.458	3.093	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)CCc1ccc(C)s1	ZINC001049928532	1348119229	/nfs/dbraw/zinc/11/92/29/1348119229.db2.gz	UJVVOXWLKJXKPW-ZWKOTPCHSA-N	0	3	330.497	3.078	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1c[nH]c2ccc(F)cc12	ZINC001049937286	1348122618	/nfs/dbraw/zinc/12/26/18/1348122618.db2.gz	RKDYPKDZRSDYCL-OALUTQOASA-N	0	3	339.414	3.009	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3sc(C4CC4)nc3C)[C@@H]2C1	ZINC001050043876	1348163576	/nfs/dbraw/zinc/16/35/76/1348163576.db2.gz	IDIWJCZAUNYVAD-JKSUJKDBSA-N	0	3	345.512	3.441	20	30		EGEDHN
C#CCCN1C[C@@H]2CCCN(C(=O)c3cc4ccccc4s3)[C@@H]2C1	ZINC001050089372	1348179261	/nfs/dbraw/zinc/17/92/61/1348179261.db2.gz	DULHDDUSKCOTJA-DLBZAZTESA-N	0	3	338.476	3.461	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3cc4nc(C)ccc4o3)[C@@H]2C1	ZINC001050188661	1348205440	/nfs/dbraw/zinc/20/54/40/1348205440.db2.gz	ISEALMKJSANQRL-DOTOQJQBSA-N	0	3	339.439	3.249	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3ccc(OC(C)C)cc3)[C@@H]2C1	ZINC001050196925	1348207488	/nfs/dbraw/zinc/20/74/88/1348207488.db2.gz	QGJHAESETHJNLP-PKOBYXMFSA-N	0	3	328.456	3.196	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3csc(C4CC4)n3)[C@@H]2C1	ZINC001050214526	1348212941	/nfs/dbraw/zinc/21/29/41/1348212941.db2.gz	POSXBJGLRMNOAU-GOEBONIOSA-N	0	3	331.485	3.133	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC[C@H](CNCc3coc(C)n3)CC2)C1	ZINC001050362394	1348238717	/nfs/dbraw/zinc/23/87/17/1348238717.db2.gz	AQHNFQGUOJZAAR-WKILWMFISA-N	0	3	331.460	3.104	20	30		EGEDHN
Cc1occc1C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001050423925	1348261517	/nfs/dbraw/zinc/26/15/17/1348261517.db2.gz	KOVHYLSBOFHTSH-UHFFFAOYSA-N	0	3	349.434	3.198	20	30		EGEDHN
Cc1cc(C(=O)N2CC3(C2)CCN(Cc2cccc(C#N)c2)CC3)co1	ZINC001050500683	1348280090	/nfs/dbraw/zinc/28/00/90/1348280090.db2.gz	BUBFDSWUDGZCMZ-UHFFFAOYSA-N	0	3	349.434	3.198	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC2(C1)CCN(C/C=C/Cl)CC2	ZINC001050532536	1348285176	/nfs/dbraw/zinc/28/51/76/1348285176.db2.gz	WAOCTGLZNHCRRU-QPJJXVBHSA-N	0	3	331.287	3.442	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cn(CC)c4ccccc34)C2)CC1	ZINC001050585466	1348294039	/nfs/dbraw/zinc/29/40/39/1348294039.db2.gz	JVAKLCPQXYBWPV-UHFFFAOYSA-N	0	3	349.478	3.223	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H]3CCCC[C@H]3C3CC3)C2)CC1	ZINC001050603957	1348298742	/nfs/dbraw/zinc/29/87/42/1348298742.db2.gz	JAMUMMNAOKJEIE-RBUKOAKNSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cccc(Cl)c3F)C2)CC1	ZINC001050641789	1348312610	/nfs/dbraw/zinc/31/26/10/1348312610.db2.gz	WUVLDRGFCMTCFL-UHFFFAOYSA-N	0	3	334.822	3.040	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H]3[C@@H]4CCCCCC[C@@H]43)C2)CC1	ZINC001050678236	1348324053	/nfs/dbraw/zinc/32/40/53/1348324053.db2.gz	KSHGMWKVNAHYSV-BWTSREIZSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cccn3C3CCCC3)C2)CC1	ZINC001050709775	1348332782	/nfs/dbraw/zinc/33/27/82/1348332782.db2.gz	GFTPAVMBEWXYCD-UHFFFAOYSA-N	0	3	339.483	3.165	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)CC(C)(C)c3ccc(C)cc3)C2)CC1	ZINC001050748539	1348347624	/nfs/dbraw/zinc/34/76/24/1348347624.db2.gz	QOERBXSDVNFHNL-UHFFFAOYSA-N	0	3	338.495	3.220	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3sccc3C)cccc2C1	ZINC001051277806	1348414534	/nfs/dbraw/zinc/41/45/34/1348414534.db2.gz	YUIIDFLIDCLEMD-UHFFFAOYSA-N	0	3	338.476	3.368	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3ccoc3CC)cccc2C1	ZINC001051287920	1348419610	/nfs/dbraw/zinc/41/96/10/1348419610.db2.gz	HKPWNLHSDLONAJ-UHFFFAOYSA-N	0	3	336.435	3.153	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3ccc(C)c(C)n3)cccc2C1	ZINC001051293192	1348422295	/nfs/dbraw/zinc/42/22/95/1348422295.db2.gz	KVBQMCZMGPJCIK-UHFFFAOYSA-N	0	3	347.462	3.010	20	30		EGEDHN
Cc1cc(C(=O)N[C@H]2CCCN(Cc3ccc(C#N)cc3)CC2)co1	ZINC001052338474	1348527905	/nfs/dbraw/zinc/52/79/05/1348527905.db2.gz	TZBZOCNFISSTPT-IBGZPJMESA-N	0	3	337.423	3.244	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@H](NC(=O)[C@@H]3CCC3(F)F)CC2)c1	ZINC001052481584	1348551743	/nfs/dbraw/zinc/55/17/43/1348551743.db2.gz	PUOSIJNQWBWASJ-SJORKVTESA-N	0	3	347.409	3.074	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccccc2-c2ccncc2)CC1	ZINC001052492101	1348556020	/nfs/dbraw/zinc/55/60/20/1348556020.db2.gz	PFFNYJIMMQUZMQ-LJQANCHMSA-N	0	3	347.462	3.356	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2csc(C(F)(F)F)c2)CC1	ZINC001052524585	1348565607	/nfs/dbraw/zinc/56/56/07/1348565607.db2.gz	FDCVGRYURDNRJX-CYBMUJFWSA-N	0	3	344.402	3.375	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc(-n3cccc3)cc2)CC1	ZINC001052535714	1348569447	/nfs/dbraw/zinc/56/94/47/1348569447.db2.gz	WJNRBBZAUVGWBE-IBGZPJMESA-N	0	3	335.451	3.085	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)C2(c3cccc(F)c3)CCC2)CC1	ZINC001052610235	1348596061	/nfs/dbraw/zinc/59/60/61/1348596061.db2.gz	BVDLTYXZZFCOQT-LJQANCHMSA-N	0	3	342.458	3.241	20	30		EGEDHN
CC1(C(=O)N[C@@H]2CCCN(Cc3ccc(C#N)cc3)CC2)CC=CC1	ZINC001052682142	1348628900	/nfs/dbraw/zinc/62/89/00/1348628900.db2.gz	PRRWSDIXTVJORN-LJQANCHMSA-N	0	3	337.467	3.385	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2)CC1	ZINC001052778571	1348676188	/nfs/dbraw/zinc/67/61/88/1348676188.db2.gz	NYFSXDIWVXDWAX-GBESFXJTSA-N	0	3	344.886	3.438	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cc(-c3ccccc3)ccn2)CC1	ZINC001052824469	1348691245	/nfs/dbraw/zinc/69/12/45/1348691245.db2.gz	YKCSKFLUNOYLBR-FQEVSTJZSA-N	0	3	347.462	3.356	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)CC23CC4CC(CC(C4)C2)C3)CC1	ZINC001052890940	1348726999	/nfs/dbraw/zinc/72/69/99/1348726999.db2.gz	FHPGSIGYOQBDDP-VJJCQHNBSA-N	0	3	328.500	3.197	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccsc2C(F)(F)F)CC1	ZINC001052898576	1348733197	/nfs/dbraw/zinc/73/31/97/1348733197.db2.gz	DSRPPXKADVMNLJ-GFCCVEGCSA-N	0	3	344.402	3.375	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2cc(CC)c(CCC)s2)CC1	ZINC001052926007	1348751871	/nfs/dbraw/zinc/75/18/71/1348751871.db2.gz	XOLNNIFUPYDQNY-INIZCTEOSA-N	0	3	332.513	3.481	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)/C=C/c2ccco2)C1	ZINC001053061069	1348870721	/nfs/dbraw/zinc/87/07/21/1348870721.db2.gz	MJMJXBLZSHUFNR-WIMDODNTSA-N	0	3	340.467	3.409	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cc[nH]c2C)C1	ZINC001053076788	1348895572	/nfs/dbraw/zinc/89/55/72/1348895572.db2.gz	UBSBQVXOWBRLBU-HKUYNNGSSA-N	0	3	327.472	3.053	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cscc2C)C1	ZINC001053077000	1348895842	/nfs/dbraw/zinc/89/58/42/1348895842.db2.gz	XFUQUPJLBHMPDP-AEFFLSMTSA-N	0	3	330.497	3.396	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccn3ccccc23)C1	ZINC001053090876	1348916319	/nfs/dbraw/zinc/91/63/19/1348916319.db2.gz	JKHNPNYJQDFQFG-AZUAARDMSA-N	0	3	349.478	3.279	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2occ3c2CCC3)C1	ZINC001053093061	1348920630	/nfs/dbraw/zinc/92/06/30/1348920630.db2.gz	UVWJAQOMFBPPEA-QFBILLFUSA-N	0	3	340.467	3.108	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(Cl)[nH]2)C1	ZINC001053093831	1348922795	/nfs/dbraw/zinc/92/27/95/1348922795.db2.gz	AFRRYKKWZSSJBW-HOCLYGCPSA-N	0	3	333.863	3.008	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cc[nH]c2CCC)C1	ZINC001053095804	1348926227	/nfs/dbraw/zinc/92/62/27/1348926227.db2.gz	LLAWOEOIDWSSLS-PXNSSMCTSA-N	0	3	341.499	3.307	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2nc(C)oc2C)C1	ZINC001053101324	1348934700	/nfs/dbraw/zinc/93/47/00/1348934700.db2.gz	NCKMVZMJHYTSLU-ZWKOTPCHSA-N	0	3	343.471	3.021	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)Cc2ccc(F)cc2)C1	ZINC001053105215	1348942588	/nfs/dbraw/zinc/94/25/88/1348942588.db2.gz	MVBMJTBZCGWEIX-AZUAARDMSA-N	0	3	342.458	3.095	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cnc(CC)s2)C1	ZINC001053106597	1348944169	/nfs/dbraw/zinc/94/41/69/1348944169.db2.gz	UUXWGOWROPLHRR-CVEARBPZSA-N	0	3	345.512	3.045	20	30		EGEDHN
C=C(C)CCN1Cc2ccccc2C[C@H]1CNC(=O)c1[nH]ccc1C	ZINC001054040068	1349135628	/nfs/dbraw/zinc/13/56/28/1349135628.db2.gz	APLWJDLOQOYEAN-IBGZPJMESA-N	0	3	337.467	3.446	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001054074285	1349146466	/nfs/dbraw/zinc/14/64/66/1349146466.db2.gz	JHJQYBNKGONHEC-NRFANRHFSA-N	0	3	337.467	3.339	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)C[C@@H]1CCC(F)(F)C1)C2	ZINC001054143036	1349153276	/nfs/dbraw/zinc/15/32/76/1349153276.db2.gz	MUOYHKYKOFRTSD-FUHWJXTLSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)[C@H](c1ccccc1)C1CC1)C2	ZINC001054163936	1349166348	/nfs/dbraw/zinc/16/63/48/1349166348.db2.gz	UVILWJMTCOPABJ-IRLDBZIGSA-N	0	3	336.479	3.128	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc3ccc(C)cc3[nH]1)C2	ZINC001054171967	1349172838	/nfs/dbraw/zinc/17/28/38/1349172838.db2.gz	CWISYHGODGWBFG-JOCHJYFZSA-N	0	3	349.478	3.428	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccccc1C1(C)CC1)C2	ZINC001054197315	1349199812	/nfs/dbraw/zinc/19/98/12/1349199812.db2.gz	VRXITKMYURTKKC-QFIPXVFZSA-N	0	3	336.479	3.299	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cccc3cc[nH]c31)C2	ZINC001054202096	1349203733	/nfs/dbraw/zinc/20/37/33/1349203733.db2.gz	WJVIPJXVLDXNML-NRFANRHFSA-N	0	3	335.451	3.119	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc3cnccc3c1)C2	ZINC001054223167	1349218627	/nfs/dbraw/zinc/21/86/27/1349218627.db2.gz	OUILSZPBXAVYTC-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc(CC)c(CC)o1)C2	ZINC001054229168	1349222750	/nfs/dbraw/zinc/22/27/50/1349222750.db2.gz	LTARPLIGMVRTAA-NRFANRHFSA-N	0	3	342.483	3.356	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc3[nH]c(C)c(C)c3c1)C2	ZINC001054239832	1349234558	/nfs/dbraw/zinc/23/45/58/1349234558.db2.gz	VCXQPSNMYDXZQV-QFIPXVFZSA-N	0	3	349.478	3.346	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cccc3cnccc31)C2	ZINC001054240185	1349234633	/nfs/dbraw/zinc/23/46/33/1349234633.db2.gz	OIUXMORYRRBAPE-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@]1(C)CC=C(C)CC1)C2	ZINC001054244138	1349237487	/nfs/dbraw/zinc/23/74/87/1349237487.db2.gz	SNHQEJVIEGJBRU-SFTDATJTSA-N	0	3	328.500	3.461	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H](C)c1ccccc1C)C2	ZINC001054243507	1349237497	/nfs/dbraw/zinc/23/74/97/1349237497.db2.gz	JBRRQAHMGGPIDJ-UGKGYDQZSA-N	0	3	338.495	3.436	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@H]1CC3CCC1CC3)C2	ZINC001054245754	1349239256	/nfs/dbraw/zinc/23/92/56/1349239256.db2.gz	BAPNHMIQLSNFOD-KWOGNLBTSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(C)c3c1CCC3)C2	ZINC001054245757	1349239396	/nfs/dbraw/zinc/23/93/96/1349239396.db2.gz	BBPGODPYACFWGH-JOCHJYFZSA-N	0	3	336.479	3.045	20	30		EGEDHN
CC1CC(CN2Cc3ccc(CNC(=O)c4c[nH]c(C#N)c4)cc3C2)C1	ZINC001054261275	1349257555	/nfs/dbraw/zinc/25/75/55/1349257555.db2.gz	WQKIZANMDVUMKK-UHFFFAOYSA-N	0	3	348.450	3.178	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cc(CC)ccn3)cc2C1	ZINC001054266578	1349264193	/nfs/dbraw/zinc/26/41/93/1349264193.db2.gz	BBIKUJYXHYXEFL-UHFFFAOYSA-N	0	3	335.451	3.466	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cc(C(F)F)n[nH]3)cc2C1	ZINC001054280640	1349282581	/nfs/dbraw/zinc/28/25/81/1349282581.db2.gz	PLVUHLHWZMOMLT-UHFFFAOYSA-N	0	3	346.381	3.169	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NCc1ccc2c(c1)CN(CC(C)C)C2	ZINC001054285462	1349288207	/nfs/dbraw/zinc/28/82/07/1349288207.db2.gz	JKPNEEZJMCYJHD-PMACEKPBSA-N	0	3	342.483	3.256	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cc(CCC)on3)cc2C1	ZINC001054288437	1349292615	/nfs/dbraw/zinc/29/26/15/1349292615.db2.gz	XDGFLZYBJXBFES-UHFFFAOYSA-N	0	3	339.439	3.449	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@H]3C[C@@]34CCOC4)cc2C1	ZINC001054288964	1349293346	/nfs/dbraw/zinc/29/33/46/1349293346.db2.gz	PLRCDPOWRIRHJK-TZIWHRDSSA-N	0	3	340.467	3.011	20	30		EGEDHN
C=CCCN1C[C@@H](C)[C@H](NC(=O)c2sc(C)nc2CC(C)C)C1	ZINC001080056568	1357470159	/nfs/dbraw/zinc/47/01/59/1357470159.db2.gz	XRVRLMGZCWIKPX-CZUORRHYSA-N	0	3	335.517	3.276	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)Cc2c(C)[nH]c3ccccc32)C1	ZINC001080364691	1357587910	/nfs/dbraw/zinc/58/79/10/1357587910.db2.gz	WJROYWABMMPVCU-AUUYWEPGSA-N	0	3	325.456	3.031	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CN(C[C@H](OC)c3ccccc3)C[C@H]2C)C1	ZINC001080406323	1357609704	/nfs/dbraw/zinc/60/97/04/1357609704.db2.gz	QNQPIRKBFZNQRX-QRQLOZEOSA-N	0	3	342.483	3.167	20	30		EGEDHN
C=CCCN1C[C@@H](C)[C@H](NC(=O)c2sc(CC3CC3)nc2C)C1	ZINC001080676273	1357720989	/nfs/dbraw/zinc/72/09/89/1357720989.db2.gz	VDEFWOUYQCTMBX-IUODEOHRSA-N	0	3	333.501	3.030	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](NC(=O)CCC2CCC2)C2CC2)s1	ZINC001322976540	1387258934	/nfs/dbraw/zinc/25/89/34/1387258934.db2.gz	RGIWKHPGDGOYAG-KRWDZBQOSA-N	0	3	331.485	3.184	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@H]2CCCC2(C)C)C[C@H]1NCc1ccc(C#N)s1	ZINC001082692334	1358075291	/nfs/dbraw/zinc/07/52/91/1358075291.db2.gz	REOAOWFEARJXCO-KBRIMQKVSA-N	0	3	345.512	3.383	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1cncc(-c2ccccc2)c1	ZINC001085628599	1358645940	/nfs/dbraw/zinc/64/59/40/1358645940.db2.gz	ARSXZYLANRTKIO-FQEVSTJZSA-N	0	3	335.451	3.471	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C1CCCCCC1)C[C@@H](C)O2	ZINC001071142821	1354475335	/nfs/dbraw/zinc/47/53/35/1354475335.db2.gz	UZHHDHBTMSNXMO-YLJYHZDGSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)CC1=CCCCC1)C[C@@H](C)O2	ZINC001071146091	1354475743	/nfs/dbraw/zinc/47/57/43/1354475743.db2.gz	GMEHEJNHAAFEGI-XLIONFOSSA-N	0	3	332.488	3.145	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C(C)(C)C(=C)Cl)C[C@@H](C)O2	ZINC001071170907	1354485949	/nfs/dbraw/zinc/48/59/49/1354485949.db2.gz	DWGZOYMIPQWUQV-RDTXWAMCSA-N	0	3	340.895	3.033	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C1(CC)CCCC1)C[C@H](C)O2	ZINC001071225815	1354513540	/nfs/dbraw/zinc/51/35/40/1354513540.db2.gz	QGMJUXHLRRTXDC-FXAWDEMLSA-N	0	3	334.504	3.225	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)CN(C(=O)CCC1CCCCC1)C[C@H](C)O2	ZINC001071233528	1354516797	/nfs/dbraw/zinc/51/67/97/1354516797.db2.gz	KGEDCQXJZABGJS-GHTZIAJQSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1cc(C)ccc1C)C[C@@H](C)O2	ZINC001071235840	1354520032	/nfs/dbraw/zinc/52/00/32/1354520032.db2.gz	LDQNKWILYQRWRG-WIYYLYMNSA-N	0	3	342.483	3.185	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc(C(F)F)ccc2F)CC[C@H]1C	ZINC001071512501	1354736431	/nfs/dbraw/zinc/73/64/31/1354736431.db2.gz	YLRAYMTVFBTXOD-OCCSQVGLSA-N	0	3	338.373	3.369	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cccc(C(F)F)c2F)CC[C@H]1C	ZINC001071513641	1354737674	/nfs/dbraw/zinc/73/76/74/1354737674.db2.gz	GYOMJMAQVWJIKF-CHWSQXEVSA-N	0	3	338.373	3.369	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)Cc2coc3ccc(C)cc23)CC[C@@H]1C	ZINC001071543933	1354756834	/nfs/dbraw/zinc/75/68/34/1354756834.db2.gz	PWGZJDRYVCTSSO-RDJZCZTQSA-N	0	3	326.440	3.439	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2ccc3c(c2)CCCO3)CC[C@H]1C	ZINC001071589475	1354781139	/nfs/dbraw/zinc/78/11/39/1354781139.db2.gz	VGLHDKPQSPEWSY-APWZRJJASA-N	0	3	342.483	3.099	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cccc3ccc(C)nc32)CC[C@@H]1C	ZINC001071599993	1354787540	/nfs/dbraw/zinc/78/75/40/1354787540.db2.gz	CPRRVURZGZTIMP-WMZOPIPTSA-N	0	3	335.451	3.149	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2cc(C)c(Cl)cn2)CC[C@@H]1C	ZINC001071601776	1354788861	/nfs/dbraw/zinc/78/88/61/1354788861.db2.gz	DSFGTSRKULIKFN-LSDHHAIUSA-N	0	3	335.879	3.131	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(OC)c(C(C)C)c2)CC[C@H]1C	ZINC001071653375	1354827998	/nfs/dbraw/zinc/82/79/98/1354827998.db2.gz	XKHQGWPWDKUWKZ-AEFFLSMTSA-N	0	3	342.483	3.425	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc3ccccc3[nH]c2=O)CC[C@H]1C	ZINC001071724594	1354881036	/nfs/dbraw/zinc/88/10/36/1354881036.db2.gz	JMXVMCXWEVEIKU-ZBFHGGJFSA-N	0	3	339.439	3.099	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2cccc3cccnc32)CC[C@@H]1C	ZINC001071725097	1354882066	/nfs/dbraw/zinc/88/20/66/1354882066.db2.gz	QFRQEYJDISTWPV-QFBILLFUSA-N	0	3	337.467	3.323	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2c(F)ccc(F)c2F)CC[C@@H]1C	ZINC001071784096	1354932974	/nfs/dbraw/zinc/93/29/74/1354932974.db2.gz	YNTMQQKIGFFQTA-NWDGAFQWSA-N	0	3	326.362	3.263	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CC[C@@H](C)N(Cc3ccccc3C)C2)c1	ZINC001071816017	1354957428	/nfs/dbraw/zinc/95/74/28/1354957428.db2.gz	SYZGEMNVLGJURH-UTKZUKDTSA-N	0	3	347.462	3.154	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccccc2OC2CCC2)CC[C@@H]1C	ZINC001071819633	1354959991	/nfs/dbraw/zinc/95/99/91/1354959991.db2.gz	WBUQFXYABCXLHW-IRXDYDNUSA-N	0	3	340.467	3.224	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2noc3ccc(F)cc23)CC[C@H]1C	ZINC001071884033	1355004573	/nfs/dbraw/zinc/00/45/73/1355004573.db2.gz	WOYZNTZODOSSLE-UKRRQHHQSA-N	0	3	345.418	3.055	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)Cc2ccccc2OC(C)C)CC[C@H]1C	ZINC001071890529	1355008978	/nfs/dbraw/zinc/00/89/78/1355008978.db2.gz	NSHWLZLFSGEGJH-SJLPKXTDSA-N	0	3	330.472	3.171	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2occc2Br)CC[C@H]1C	ZINC001071903966	1355016646	/nfs/dbraw/zinc/01/66/46/1355016646.db2.gz	AAEFXUHVFBIYAA-VXGBXAGGSA-N	0	3	341.249	3.201	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2[nH]c3ccc(C)cc3c2C)CC[C@@H]1C	ZINC001071954951	1355040956	/nfs/dbraw/zinc/04/09/56/1355040956.db2.gz	ZFYPGUZOXNIVJG-DOTOQJQBSA-N	0	3	337.467	3.391	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cnn(CCCC)c2CC)CC[C@@H]1C	ZINC001071977297	1355056460	/nfs/dbraw/zinc/05/64/60/1355056460.db2.gz	OVORAARRRWGNSF-IRXDYDNUSA-N	0	3	346.519	3.404	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cccc(NC(C)=O)c2C)CC[C@H]1C	ZINC001071993596	1355063514	/nfs/dbraw/zinc/06/35/14/1355063514.db2.gz	UPCSSSZBIABSQB-RHSMWYFYSA-N	0	3	343.471	3.112	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)CC[C@@H]1C	ZINC001072020151	1355082913	/nfs/dbraw/zinc/08/29/13/1355082913.db2.gz	UJBOOADNHISDIZ-BBRMVZONSA-N	0	3	338.373	3.311	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@@H]1CC[C@H](C)N(Cc2ccccc2)C1	ZINC001072023613	1355085724	/nfs/dbraw/zinc/08/57/24/1355085724.db2.gz	UFGFYJSVTMJVRS-PGRDOPGGSA-N	0	3	346.474	3.380	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2c(Cl)nc3ccccn32)CC[C@H]1C	ZINC001072048475	1355102705	/nfs/dbraw/zinc/10/27/05/1355102705.db2.gz	KMRIWIKIEFPFTE-ZIAGYGMSSA-N	0	3	346.862	3.147	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2cc(C3CCCC3)no2)CC[C@H]1C	ZINC001072087866	1355120801	/nfs/dbraw/zinc/12/08/01/1355120801.db2.gz	CJMKVGBQVHRWBO-ZBFHGGJFSA-N	0	3	331.460	3.491	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(F)c3occc32)CC[C@@H]1C	ZINC001072089043	1355122626	/nfs/dbraw/zinc/12/26/26/1355122626.db2.gz	VEALTQHCDCQVES-KBPBESRZSA-N	0	3	328.387	3.178	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(N(CC)CC)nc2)CC[C@@H]1C	ZINC001072112514	1355137833	/nfs/dbraw/zinc/13/78/33/1355137833.db2.gz	BAZWZQGRGJKMFX-WMZOPIPTSA-N	0	3	344.503	3.087	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C2(c3ccccc3OC)CC2)CC[C@@H]1C	ZINC001072115871	1355140363	/nfs/dbraw/zinc/14/03/63/1355140363.db2.gz	DLQTYZGNCXLXDX-DLBZAZTESA-N	0	3	342.483	3.272	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc(NC(C)=O)ccc2C)CC[C@H]1C	ZINC001072120699	1355141793	/nfs/dbraw/zinc/14/17/93/1355141793.db2.gz	XWFRJULTAFJKAC-CRAIPNDOSA-N	0	3	343.471	3.112	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H]1[C@H]2[C@@H]1[C@@H]1CC[C@H]2C1	ZINC001089736248	1360641034	/nfs/dbraw/zinc/64/10/34/1360641034.db2.gz	MSEQTAKCIAKMCX-JWXAEQQXSA-N	0	3	330.516	3.461	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@H](C)[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001072176894	1355171351	/nfs/dbraw/zinc/17/13/51/1355171351.db2.gz	RTOIDDUFUWGQCJ-MAUKXSAKSA-N	0	3	345.462	3.318	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](C)[C@H](CNCc3ocnc3C)C2)CC1	ZINC001072356066	1355253743	/nfs/dbraw/zinc/25/37/43/1355253743.db2.gz	FQMCRYJVRDIJSW-MAUKXSAKSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](C)[C@H](CNCc3nccs3)C2)CC1	ZINC001072356294	1355254687	/nfs/dbraw/zinc/25/46/87/1355254687.db2.gz	JFVCQXXFTWYADI-NVXWUHKLSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](C)[C@@H](CNCc3cc(C)no3)C2)CC1	ZINC001072356963	1355255152	/nfs/dbraw/zinc/25/51/52/1355255152.db2.gz	SSGYGEWLMBLYDO-QAPCUYQASA-N	0	3	345.487	3.304	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC2(C1)CCN([C@@H]1CCc3ccc(Cl)cc31)C2	ZINC001072551543	1355330002	/nfs/dbraw/zinc/33/00/02/1355330002.db2.gz	HGLSZVDXVHGZJJ-SUMWQHHRSA-N	0	3	343.858	3.021	20	30		EGEDHN
CCc1occc1C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001072683692	1355387184	/nfs/dbraw/zinc/38/71/84/1355387184.db2.gz	NEQBBJVYVAHCSA-UHFFFAOYSA-N	0	3	349.434	3.062	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC2(C1)CCN(Cc1ncccc1C)C2	ZINC001072779906	1355434231	/nfs/dbraw/zinc/43/42/31/1355434231.db2.gz	LLVODHQJXFZWNC-UHFFFAOYSA-N	0	3	347.890	3.203	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3ccc(OC)c(C(C)C)c3)C2)C1	ZINC001072898549	1355487398	/nfs/dbraw/zinc/48/73/98/1355487398.db2.gz	GQXDJOUGENMPNK-UHFFFAOYSA-N	0	3	328.456	3.153	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cccc(-c4ccoc4)c3)C2)C1	ZINC001073109182	1355602055	/nfs/dbraw/zinc/60/20/55/1355602055.db2.gz	VHILNQVENJEGGN-UHFFFAOYSA-N	0	3	334.419	3.118	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3sc(C(C)(C)C)nc3C)C2)C1	ZINC001073488447	1355817860	/nfs/dbraw/zinc/81/78/60/1355817860.db2.gz	BHKBRMHGGHSUPN-UHFFFAOYSA-N	0	3	333.501	3.083	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2c(C)oc3ccccc32)C1	ZINC001073617527	1355846339	/nfs/dbraw/zinc/84/63/39/1355846339.db2.gz	HCXNDYBLKDZYAQ-INIZCTEOSA-N	0	3	342.439	3.138	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2ccc(C(C)C)cc2)C1	ZINC001073865750	1355925591	/nfs/dbraw/zinc/92/55/91/1355925591.db2.gz	MQAZPLIXUPRVGF-LJQANCHMSA-N	0	3	330.472	3.207	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2oc3ccccc3c2C)C1	ZINC001073877882	1355934660	/nfs/dbraw/zinc/93/46/60/1355934660.db2.gz	CYHPEIRCENMKDS-INIZCTEOSA-N	0	3	342.439	3.138	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCCN1C(=O)[C@@H]1CC1(C)C	ZINC001073996674	1356025055	/nfs/dbraw/zinc/02/50/55/1356025055.db2.gz	ITJBSRKCJUZDPP-MOPGFXCFSA-N	0	3	339.483	3.417	20	30		EGEDHN
C[C@H]1[C@@H](NCc2ccc(C#N)s2)CCN1C(=O)[C@H]1CCC1(C)C	ZINC001074816182	1356252510	/nfs/dbraw/zinc/25/25/10/1356252510.db2.gz	WCFLXMZZNBYUCJ-MAZHCROVSA-N	0	3	331.485	3.135	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](C2CCN(C(=O)C(F)F)CC2)CC1	ZINC001075443063	1356372809	/nfs/dbraw/zinc/37/28/09/1356372809.db2.gz	GUEYZHMTTFICAM-CYBMUJFWSA-N	0	3	334.838	3.345	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccc(F)c(Cl)c3F)[C@@H]2C1	ZINC001076207816	1356519101	/nfs/dbraw/zinc/51/91/01/1356519101.db2.gz	QTLARGBNQNUQDP-SMDDNHRTSA-N	0	3	340.801	3.341	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3csc(C(C)(C)C)n3)[C@@H]2C1	ZINC001076360772	1356559077	/nfs/dbraw/zinc/55/90/77/1356559077.db2.gz	PFSNYHARQACERE-DZGCQCFKSA-N	0	3	333.501	3.163	20	30		EGEDHN
C=CCCN1C[C@@H]2CCN(C(=O)c3cnc(-c4ccco4)s3)[C@@H]2C1	ZINC001076484697	1356589666	/nfs/dbraw/zinc/58/96/66/1356589666.db2.gz	BHSSNXLBZTYKEW-UONOGXRCSA-N	0	3	343.452	3.126	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3oc4c(cccc4C)c3C)[C@@H]2C1	ZINC001076608890	1356630386	/nfs/dbraw/zinc/63/03/86/1356630386.db2.gz	ZXWOTDKYUHENOB-FUHWJXTLSA-N	0	3	336.435	3.219	20	30		EGEDHN
CC1(C)CC[C@@H](CNC(=O)CSCC#N)N(CC2=CCCCC2)C1	ZINC001098921425	1363521998	/nfs/dbraw/zinc/52/19/98/1363521998.db2.gz	JAPQFKLETLPWQW-KRWDZBQOSA-N	0	3	349.544	3.350	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)Cc1ccc(F)cc1F	ZINC001099085400	1363615563	/nfs/dbraw/zinc/61/55/63/1363615563.db2.gz	OHRFWUCJOSKVET-MRXNPFEDSA-N	0	3	336.426	3.300	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)Cc1ccccc1	ZINC001099120792	1363635231	/nfs/dbraw/zinc/63/52/31/1363635231.db2.gz	FRJCJWMKHYZTKR-IBGZPJMESA-N	0	3	344.499	3.039	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)C[C@H](C)c1c(C)n[nH]c1C	ZINC001099126661	1363639449	/nfs/dbraw/zinc/63/94/49/1363639449.db2.gz	YBCBKXODMPUNED-WMLDXEAASA-N	0	3	346.519	3.313	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCCO[C@H](CNCc2ccccc2F)C1	ZINC001078460680	1356977657	/nfs/dbraw/zinc/97/76/57/1356977657.db2.gz	YPAZIFWWMLXZIU-XLIONFOSSA-N	0	3	348.462	3.135	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2C[C@H](NC(=O)C3CCC3)C23CCC3)c(F)c1	ZINC001078523450	1356992475	/nfs/dbraw/zinc/99/24/75/1356992475.db2.gz	KZUAFJQCAXFELM-MSOLQXFVSA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@@H](NC(=O)c2ccccc2)C12CCC2	ZINC001078539654	1357004341	/nfs/dbraw/zinc/00/43/41/1357004341.db2.gz	WDFTWYLMMJKMTO-HUUCEWRRSA-N	0	3	349.272	3.226	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc(C)c(C)n2)C12CCC2	ZINC001078679494	1357052562	/nfs/dbraw/zinc/05/25/62/1357052562.db2.gz	CGOLRRFBVXZHLK-JKSUJKDBSA-N	0	3	333.863	3.082	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2occc2Cl)C12CCC2	ZINC001078718006	1357063639	/nfs/dbraw/zinc/06/36/39/1357063639.db2.gz	JOLPJPPPOBGZEY-NWDGAFQWSA-N	0	3	329.227	3.316	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@@H](NCc3conc3CC)C23CCC3)C1	ZINC001078720845	1357065711	/nfs/dbraw/zinc/06/57/11/1357065711.db2.gz	RLFWTBJKTXAGDO-SJORKVTESA-N	0	3	343.471	3.110	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc3c(c2)COC3)C12CCC2	ZINC001078745700	1357069913	/nfs/dbraw/zinc/06/99/13/1357069913.db2.gz	BHVHKTDCMSTIAK-DLBZAZTESA-N	0	3	346.858	3.100	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2csc(Cl)n2)C12CCC2	ZINC001078773175	1357078006	/nfs/dbraw/zinc/07/80/06/1357078006.db2.gz	CBAHHCFWRRYFFI-QWRGUYRKSA-N	0	3	346.283	3.180	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)C2(c3ccc(C)cc3)CCC2)C1	ZINC001081021132	1357782798	/nfs/dbraw/zinc/78/27/98/1357782798.db2.gz	OWNJZECCIVGVED-IEBWSBKVSA-N	0	3	326.484	3.429	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2ccc(N(C)C(C)C)cc2)C1	ZINC001081038111	1357791361	/nfs/dbraw/zinc/79/13/61/1357791361.db2.gz	OJMRWYWRQZQRGZ-VQIMIIECSA-N	0	3	329.488	3.157	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2cc(C)ccc2C)C[C@H]1c1ccccc1	ZINC001081219150	1357850434	/nfs/dbraw/zinc/85/04/34/1357850434.db2.gz	NFTVHVKLZWCGDF-LEWJYISDSA-N	0	3	332.447	3.134	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2ccc(CC)cc2)C[C@H]1c1ccccc1	ZINC001081219965	1357851092	/nfs/dbraw/zinc/85/10/92/1357851092.db2.gz	SQXYUGDLIFNNSM-LEWJYISDSA-N	0	3	332.447	3.080	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2cccc(Cl)c2C)[C@H](OC)C1	ZINC001081716673	1357861396	/nfs/dbraw/zinc/86/13/96/1357861396.db2.gz	RONWLNUEAYAULM-IAGOWNOFSA-N	0	3	336.863	3.044	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2cc(C)cc(Cl)c2)[C@H](OC)C1	ZINC001081947296	1357900187	/nfs/dbraw/zinc/90/01/87/1357900187.db2.gz	VUNUEHDWHVMDBW-IAGOWNOFSA-N	0	3	336.863	3.044	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2ccc(C(C)C)cc2)[C@H](OC)C1	ZINC001082341440	1358020723	/nfs/dbraw/zinc/02/07/23/1358020723.db2.gz	MWDRZWAHACZMCM-RTBURBONSA-N	0	3	330.472	3.205	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2cc(CC)c(C)s2)[C@H](OC)C1	ZINC001082361553	1358023803	/nfs/dbraw/zinc/02/38/03/1358023803.db2.gz	IQKUQLRMSGLQJS-HZPDHXFCSA-N	0	3	336.501	3.014	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)[C@@H]3CCCC(C)(C)C3)[C@H]2C1	ZINC001083286970	1358129367	/nfs/dbraw/zinc/12/93/67/1358129367.db2.gz	LWYQCNRCCRGIFF-FGTMMUONSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3coc(C(C)(C)C)n3)[C@@H]2C1	ZINC001084340521	1358196444	/nfs/dbraw/zinc/19/64/44/1358196444.db2.gz	DIVRMQJBBKEKPH-GDBMZVCRSA-N	0	3	331.460	3.085	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1C[C@H]2CCN(CC[C@@H](C)F)C[C@H]21	ZINC001084460591	1358219770	/nfs/dbraw/zinc/21/97/70/1358219770.db2.gz	BSZUOTSPOZKCJM-JFIYKMOQSA-N	0	3	346.446	3.146	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)CCc3ccc(C)cc3C)[C@@H]2C1	ZINC001084556725	1358238769	/nfs/dbraw/zinc/23/87/69/1358238769.db2.gz	BKZFEPUAXJYPHZ-WOJBJXKFSA-N	0	3	326.484	3.345	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CCN(CCCc3ccsc3)C[C@H]21	ZINC001084578346	1358241961	/nfs/dbraw/zinc/24/19/61/1358241961.db2.gz	VFWXFCUOTNWWTQ-IAGOWNOFSA-N	0	3	332.513	3.426	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@@H]3C[C@H]3c3ccccc3CC)[C@@H]2C1	ZINC001084615097	1358255622	/nfs/dbraw/zinc/25/56/22/1358255622.db2.gz	PVRJJBIOZCSNFL-GFOJFJKKSA-N	0	3	338.495	3.461	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)[C@H](CC)Cc3cccc(C)c3)[C@@H]2C1	ZINC001084704716	1358287443	/nfs/dbraw/zinc/28/74/43/1358287443.db2.gz	OQKXENIBBQABKL-NJDAHSKKSA-N	0	3	338.495	3.120	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3scnc3C3CC3)[C@@H]2C1	ZINC001084709410	1358288903	/nfs/dbraw/zinc/28/89/03/1358288903.db2.gz	AFLFLMJVHQMQDV-HUUCEWRRSA-N	0	3	331.485	3.133	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)[C@@H](C)c3ccc(Cl)s3)[C@@H]2C1	ZINC001084764573	1358304460	/nfs/dbraw/zinc/30/44/60/1358304460.db2.gz	NWAPULDKUIHLCE-BFHYXJOUSA-N	0	3	336.888	3.061	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@H](C)c3ccc(F)cc3F)[C@@H]2C1	ZINC001084842678	1358326264	/nfs/dbraw/zinc/32/62/64/1358326264.db2.gz	YUMGNLIRFUUXGK-HBUWYVDXSA-N	0	3	334.410	3.177	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H]2CCN(CCC(F)(F)F)[C@H]2C1	ZINC001085024004	1358369495	/nfs/dbraw/zinc/36/94/95/1358369495.db2.gz	MPZDFWGXFVPSEY-YCPHGPKFSA-N	0	3	332.410	3.464	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@@H](C)c3ccc(Cl)cc3)C[C@@H]21	ZINC001085022423	1358369878	/nfs/dbraw/zinc/36/98/78/1358369878.db2.gz	FOLOCBYKMYQBKD-WDYCEAGBSA-N	0	3	344.886	3.390	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)C1CCCC1	ZINC001085114188	1358396144	/nfs/dbraw/zinc/39/61/44/1358396144.db2.gz	LMEQJPHMXSOZOK-ZIAGYGMSSA-N	0	3	329.282	3.102	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)c1occc1C	ZINC001085132804	1358407048	/nfs/dbraw/zinc/40/70/48/1358407048.db2.gz	UACKRBVDEJUVFR-CHWSQXEVSA-N	0	3	341.249	3.127	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)c1coc(C)c1	ZINC001085182303	1358426538	/nfs/dbraw/zinc/42/65/38/1358426538.db2.gz	UBBUBNNLKWBPJO-ZIAGYGMSSA-N	0	3	341.249	3.127	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1nccc2occc21	ZINC001085281877	1358451255	/nfs/dbraw/zinc/45/12/55/1358451255.db2.gz	PBJFGNZGQMASCW-ZIAGYGMSSA-N	0	3	333.819	3.211	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)Cc1c(F)cccc1F	ZINC001085314455	1358462765	/nfs/dbraw/zinc/46/27/65/1358462765.db2.gz	XBNIAFUQNIOCMF-HZPDHXFCSA-N	0	3	342.817	3.277	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCCC[C@H]2NCc2cncs2)CC1	ZINC001085321261	1358465509	/nfs/dbraw/zinc/46/55/09/1358465509.db2.gz	OFIKJYCVFBSUTC-IAGOWNOFSA-N	0	3	333.501	3.407	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1coc(CCC)n1	ZINC001085392675	1358487261	/nfs/dbraw/zinc/48/72/61/1358487261.db2.gz	MRLAEUJKYCDYAS-CHWSQXEVSA-N	0	3	325.840	3.010	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccn(C2CCCC2)n1	ZINC001085623004	1358642833	/nfs/dbraw/zinc/64/28/33/1358642833.db2.gz	IWMDMCMZJBBXNQ-KRWDZBQOSA-N	0	3	330.476	3.111	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1c(C)nn(C(C)(C)C)c1C	ZINC001085629252	1358646720	/nfs/dbraw/zinc/64/67/20/1358646720.db2.gz	PYVUDNFQLCWQRW-QGZVFWFLSA-N	0	3	346.519	3.367	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ncoc1-c1ccccc1	ZINC001085630400	1358647281	/nfs/dbraw/zinc/64/72/81/1358647281.db2.gz	SSFVNUPCHKHVCN-QGZVFWFLSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc(N(C)C)cc1F	ZINC001085639371	1358653265	/nfs/dbraw/zinc/65/32/65/1358653265.db2.gz	NNICGQFNIQXQNK-INIZCTEOSA-N	0	3	333.451	3.004	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC001085668352	1358672935	/nfs/dbraw/zinc/67/29/35/1358672935.db2.gz	BCFHGRIDIKLTFB-QUCCMNQESA-N	0	3	341.499	3.012	20	30		EGEDHN
C=CCOc1ccc(C(=O)N(C)C[C@@H]2CCN2CC[C@H](C)F)cc1	ZINC001085679007	1358682566	/nfs/dbraw/zinc/68/25/66/1358682566.db2.gz	YGSZYROAQWOWBQ-RDJZCZTQSA-N	0	3	334.435	3.146	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cnc2c(F)cccc2c1	ZINC001085724760	1358713361	/nfs/dbraw/zinc/71/33/61/1358713361.db2.gz	DSJBRHCBZMUZHP-QGZVFWFLSA-N	0	3	341.430	3.486	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1c(F)cc(OC)cc1F	ZINC001085833087	1358799210	/nfs/dbraw/zinc/79/92/10/1358799210.db2.gz	AHZSMZQVGRTAQQ-ZDUSSCGKSA-N	0	3	338.398	3.086	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N(C)C[C@H]1CCN1CCCC1CCC1	ZINC001085870235	1358835587	/nfs/dbraw/zinc/83/55/87/1358835587.db2.gz	NOPPUGJWUUXGKY-QYZOEREBSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc(-c2cn[nH]c2)cc1	ZINC001085871293	1358836748	/nfs/dbraw/zinc/83/67/48/1358836748.db2.gz	QDLNXZNOCJCXQG-LJQANCHMSA-N	0	3	338.455	3.189	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1cc(F)c2ncccc2c1	ZINC001085876112	1358840336	/nfs/dbraw/zinc/84/03/36/1358840336.db2.gz	RYQAATZIGFQCKC-INIZCTEOSA-N	0	3	327.403	3.096	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccccc1NC(=O)CC	ZINC001085879855	1358844061	/nfs/dbraw/zinc/84/40/61/1358844061.db2.gz	IYFVVGRBVHNHOZ-MRXNPFEDSA-N	0	3	343.471	3.148	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc(Br)o1	ZINC001085940447	1358898280	/nfs/dbraw/zinc/89/82/80/1358898280.db2.gz	HSDHNXOOMUWLBX-LBPRGKRZSA-N	0	3	341.249	3.155	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cnn(C2CCCC2)c1C	ZINC001085917766	1358877791	/nfs/dbraw/zinc/87/77/91/1358877791.db2.gz	JYDROMVIYAKCHF-SFHVURJKSA-N	0	3	344.503	3.419	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cccnc1OCC(C)C	ZINC001085930045	1358886810	/nfs/dbraw/zinc/88/68/10/1358886810.db2.gz	MKBFRAFRKDMQCI-QGZVFWFLSA-N	0	3	345.487	3.229	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C[C@@H]2CCN2CCCC2CCCC2)cn1	ZINC001085932592	1358887952	/nfs/dbraw/zinc/88/79/52/1358887952.db2.gz	CPUYUSPWMFRUNE-FQEVSTJZSA-N	0	3	339.483	3.180	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)Nc1nc2c(s1)COCC2	ZINC001340032822	1390212062	/nfs/dbraw/zinc/21/20/62/1390212062.db2.gz	FUUODMAGEDIKCH-LBPRGKRZSA-N	0	3	325.478	3.232	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@@H](CNC(=O)[C@@H]3CC=CCC3)C2)c(F)c1	ZINC001086027502	1358971810	/nfs/dbraw/zinc/97/18/10/1358971810.db2.gz	VKJBKWJYTNUOIP-NUJGCVRESA-N	0	3	341.430	3.038	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc3ccccc3nc2C)C1	ZINC001086100793	1358997769	/nfs/dbraw/zinc/99/77/69/1358997769.db2.gz	ONHYLKGBMONITR-FZNQNYSPSA-N	0	3	343.858	3.394	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(C)nc2C2CC2)C1	ZINC001086160660	1359011696	/nfs/dbraw/zinc/01/16/96/1359011696.db2.gz	ATGVOIVBGFAHKX-OTVXOJSOSA-N	0	3	333.863	3.118	20	30		EGEDHN
CC1(C)CC[C@@H]1C(=O)NC[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001086172269	1359014364	/nfs/dbraw/zinc/01/43/64/1359014364.db2.gz	RGZGOGDJWWJVNQ-HYVNUMGLSA-N	0	3	343.446	3.118	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@H](CNC(=O)C3CCCCC3)C2)c1	ZINC001086294892	1359058338	/nfs/dbraw/zinc/05/83/38/1359058338.db2.gz	WPDVLYVVOYXBMS-RZDIXWSQSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@H]1C[C@H](NCc2ccccc2F)C1	ZINC001086387720	1359084694	/nfs/dbraw/zinc/08/46/94/1359084694.db2.gz	RDRDVPYLHJEHJI-JCNLHEQBSA-N	0	3	341.430	3.111	20	30		EGEDHN
CC1(C)CC[C@H]1C(=O)NC[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001086451545	1359100313	/nfs/dbraw/zinc/10/03/13/1359100313.db2.gz	METXIHRBGOQYLP-XIRDDKMYSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc3cccc(OC)c3o2)C1	ZINC001086460127	1359103929	/nfs/dbraw/zinc/10/39/29/1359103929.db2.gz	JHQUOOKQPCHSTK-MQMHXKEQSA-N	0	3	348.830	3.292	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2C[C@H](NCc3oc(C)nc3C)C2)CC1	ZINC001086467442	1359108760	/nfs/dbraw/zinc/10/87/60/1359108760.db2.gz	DAGSDURGUFXKMC-JCNLHEQBSA-N	0	3	331.460	3.022	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(Cl)c(F)c2)C1	ZINC001086488395	1359116466	/nfs/dbraw/zinc/11/64/66/1359116466.db2.gz	TUXAZPRKIGKKSZ-UMSPYCQHSA-N	0	3	331.218	3.330	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2cccc(C)c2)C1	ZINC001086572128	1359152118	/nfs/dbraw/zinc/15/21/18/1359152118.db2.gz	HTAZGHZTQSTJTD-LEWJYISDSA-N	0	3	332.447	3.216	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccccc2COC)C1	ZINC001086743864	1359194082	/nfs/dbraw/zinc/19/40/82/1359194082.db2.gz	NZRLKUWKDDTWJB-GOEBONIOSA-N	0	3	336.863	3.074	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cc(-c3ccco3)on2)C1	ZINC001086770875	1359197938	/nfs/dbraw/zinc/19/79/38/1359197938.db2.gz	FHPRISZAVIFSEF-QWHCGFSZSA-N	0	3	349.818	3.175	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)[C@H]2CCc3ccccc3O2)C1	ZINC001086831987	1359210490	/nfs/dbraw/zinc/21/04/90/1359210490.db2.gz	XVBDXFPNYQTNEC-YXJHDRRASA-N	0	3	348.874	3.007	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3cccc(F)c3)C2)CC1	ZINC001086899249	1359229029	/nfs/dbraw/zinc/22/90/29/1359229029.db2.gz	FGBNEXRXTJSQAI-MRXNPFEDSA-N	0	3	328.431	3.166	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3scnc3CC)C2)CC1	ZINC001086925638	1359250995	/nfs/dbraw/zinc/25/09/95/1359250995.db2.gz	CJEAOSKUFIZMFX-HNNXBMFYSA-N	0	3	345.512	3.045	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)[C@H](C)c3ccco3)C2)CC1	ZINC001086942492	1359264287	/nfs/dbraw/zinc/26/42/87/1359264287.db2.gz	SUBBVXFDMXELAF-DLBZAZTESA-N	0	3	328.456	3.109	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)C3CCC(F)(F)CC3)C2)CC1	ZINC001086944674	1359265723	/nfs/dbraw/zinc/26/57/23/1359265723.db2.gz	GEZDPTXWKWHVLL-OAHLLOKOSA-N	0	3	338.442	3.148	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H](CC)OC3CCCC3)C2)CC1	ZINC001086945580	1359266273	/nfs/dbraw/zinc/26/62/73/1359266273.db2.gz	FFPCFIRVZCLEFV-IEBWSBKVSA-N	0	3	346.515	3.060	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@H](C)c3ccc(C)cc3)C2)CC1	ZINC001086952707	1359272664	/nfs/dbraw/zinc/27/26/64/1359272664.db2.gz	OBZZRJVOWDNPGW-RBUKOAKNSA-N	0	3	338.495	3.435	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc(C)c(CC)o3)C2)CC1	ZINC001086952394	1359272684	/nfs/dbraw/zinc/27/26/84/1359272684.db2.gz	HXYDZVRYGPQHEU-QGZVFWFLSA-N	0	3	342.483	3.490	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](CNCc2oc(CCC)nc2C)[C@@H](C)C1	ZINC001184078436	1387388645	/nfs/dbraw/zinc/38/86/45/1387388645.db2.gz	OMJTVASKSIYDQF-RDJZCZTQSA-N	0	3	347.503	3.476	20	30		EGEDHN
C[C@@H]1CCN(C(=O)/C=C/C2CC2)[C@H](CNCc2ccc(C#N)s2)C1	ZINC001087141146	1359303020	/nfs/dbraw/zinc/30/30/20/1359303020.db2.gz	CQHDZYQRIJODIY-LFECJLGQSA-N	0	3	343.496	3.303	20	30		EGEDHN
CC[C@H](F)C(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC001087200059	1359318398	/nfs/dbraw/zinc/31/83/98/1359318398.db2.gz	LGKRNMHDLJZYIJ-COXVUDFISA-N	0	3	349.425	3.162	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(Cl)o3)C(C)(C)[C@H]21	ZINC001087272310	1359345695	/nfs/dbraw/zinc/34/56/95/1359345695.db2.gz	FVUGBANEAMKIBH-WQVCFCJDSA-N	0	3	334.847	3.175	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc(C)sc1C	ZINC001087293893	1359374256	/nfs/dbraw/zinc/37/42/56/1359374256.db2.gz	LMKKTYHPGJIUGS-HYVNUMGLSA-N	0	3	330.497	3.217	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cn(C)c4ccccc34)C(C)(C)[C@@H]21	ZINC001087293846	1359374406	/nfs/dbraw/zinc/37/44/06/1359374406.db2.gz	KVTVXBUPTSBQBM-NSISKUIASA-N	0	3	349.478	3.030	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3c[nH]c4ccccc34)C(C)(C)[C@H]21	ZINC001087294820	1359375398	/nfs/dbraw/zinc/37/53/98/1359375398.db2.gz	YXICLRSNONQKLI-AHRSYUTCSA-N	0	3	349.478	3.410	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc(F)c3F)C(C)(C)[C@H]21	ZINC001087301072	1359384194	/nfs/dbraw/zinc/38/41/94/1359384194.db2.gz	VTAYMJHGZCWKEM-OLMNPRSZSA-N	0	3	346.421	3.207	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)C1CC2(CCC2)C1	ZINC001087301114	1359384253	/nfs/dbraw/zinc/38/42/53/1359384253.db2.gz	WJBHEVZCGCHHHR-FGTMMUONSA-N	0	3	328.500	3.195	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3nccc4ccccc43)C(C)(C)[C@H]21	ZINC001087302312	1359385431	/nfs/dbraw/zinc/38/54/31/1359385431.db2.gz	QQMJPIXTLCSCRQ-RLLQIKCJSA-N	0	3	347.462	3.087	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3occc3CC)C(C)(C)[C@@H]21	ZINC001087303901	1359387156	/nfs/dbraw/zinc/38/71/56/1359387156.db2.gz	UTDNNUXOJCTPFQ-KBAYOESNSA-N	0	3	328.456	3.084	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cccc2cc[nH]c21	ZINC001087304399	1359388354	/nfs/dbraw/zinc/38/83/54/1359388354.db2.gz	BLKCJOLKJGXJMP-YZGWKJHDSA-N	0	3	349.478	3.410	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc(C)ccc1F	ZINC001087304665	1359388618	/nfs/dbraw/zinc/38/86/18/1359388618.db2.gz	FUNOARZKTPUCQW-AYOQOUSVSA-N	0	3	342.458	3.376	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(F)ccc3Cl)C(C)(C)[C@H]21	ZINC001087305847	1359391509	/nfs/dbraw/zinc/39/15/09/1359391509.db2.gz	ZKLLAUKYNDFPSY-XYPHTWIQSA-N	0	3	348.849	3.331	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(Cl)cs3)C(C)(C)[C@@H]21	ZINC001087307088	1359394150	/nfs/dbraw/zinc/39/41/50/1359394150.db2.gz	TVYCYOJULNZHQE-BPLDGKMQSA-N	0	3	336.888	3.254	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc2ccccc2n1	ZINC001087315188	1359404933	/nfs/dbraw/zinc/40/49/33/1359404933.db2.gz	XORRESLZFXQNCL-LSTHTHJFSA-N	0	3	347.462	3.087	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc(F)cc3F)C(C)(C)[C@H]21	ZINC001087316671	1359407330	/nfs/dbraw/zinc/40/73/30/1359407330.db2.gz	VZZHLYKUIXQSAC-NJAFHUGGSA-N	0	3	346.421	3.207	20	30		EGEDHN
O=C(C1CCC1)N1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1CC#Cc1ccccc1	ZINC001087325892	1359416599	/nfs/dbraw/zinc/41/65/99/1359416599.db2.gz	JRMATFBBIJCTKF-LRSLUSHPSA-N	0	3	348.490	3.007	20	30		EGEDHN
C=CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)c2ccccn2)C1	ZINC001087420070	1359457755	/nfs/dbraw/zinc/45/77/55/1359457755.db2.gz	KEACILVUHAVVHQ-UYAOXDASSA-N	0	3	335.451	3.246	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N[C@H]1CCN(Cc2ccsc2)[C@@H]1CC	ZINC001087576570	1359537874	/nfs/dbraw/zinc/53/78/74/1359537874.db2.gz	PJRIXLWTBPKLCA-XDNAFOTISA-N	0	3	348.512	3.198	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccn(C3CCCC3)n2)[C@H]1CC	ZINC001087589897	1359545996	/nfs/dbraw/zinc/54/59/96/1359545996.db2.gz	AVDPSHWTPBBJBO-FUHWJXTLSA-N	0	3	330.476	3.157	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccc(C)nc2C2CC2)[C@H]1CC	ZINC001087675508	1359583860	/nfs/dbraw/zinc/58/38/60/1359583860.db2.gz	QELMIWRWFMLCJU-ZWKOTPCHSA-N	0	3	327.472	3.426	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2c(F)cc(OC)cc2F)[C@H]1CC	ZINC001087734069	1359616723	/nfs/dbraw/zinc/61/67/23/1359616723.db2.gz	KQJPCFDBHCVPDD-JKSUJKDBSA-N	0	3	338.398	3.132	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2c[nH]nc2C2CCCCC2)[C@H]1CC	ZINC001087790972	1359646903	/nfs/dbraw/zinc/64/69/03/1359646903.db2.gz	PLUBMACUYQNGSC-DLBZAZTESA-N	0	3	330.476	3.226	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)nc3ccccc32)[C@H]1CC	ZINC001087818363	1359663222	/nfs/dbraw/zinc/66/32/22/1359663222.db2.gz	OPIYAEBOADUMKP-VQTJNVASSA-N	0	3	335.451	3.149	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2sc(C(C)C)nc2C)[C@H]1CC	ZINC001087826909	1359667511	/nfs/dbraw/zinc/66/75/11/1359667511.db2.gz	MZRNVHGMGSVWKM-LSDHHAIUSA-N	0	3	333.501	3.181	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3ccc(CCCC)cc3)C[C@@H]2C1	ZINC001088033210	1359729396	/nfs/dbraw/zinc/72/93/96/1359729396.db2.gz	YGACXMZPEZITCY-RTWAWAEBSA-N	0	3	338.495	3.446	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)C3CC(C)(C)CC(C)(C)C3)C[C@@H]2C1	ZINC001088053278	1359735824	/nfs/dbraw/zinc/73/58/24/1359735824.db2.gz	BLTSXAWVELSYBU-AEFFLSMTSA-N	0	3	330.516	3.252	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CCN(Cc3c(C)noc3CC)C[C@H]2C1	ZINC001088066461	1359739692	/nfs/dbraw/zinc/73/96/92/1359739692.db2.gz	LJUNKJRRCNVLEG-CVEARBPZSA-N	0	3	345.487	3.038	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CCN(Cc4ncccc4C)C[C@H]3C2)C1	ZINC001088098736	1359755483	/nfs/dbraw/zinc/75/54/83/1359755483.db2.gz	ZGUYIXUSLFSWMJ-MSOLQXFVSA-N	0	3	339.483	3.027	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CN(C(=O)[C@@H]4CC45CCC5)C[C@@H]3C2)c1	ZINC001088123634	1359764063	/nfs/dbraw/zinc/76/40/63/1359764063.db2.gz	ZHGGZHNDMBEARN-AABGKKOBSA-N	0	3	349.478	3.029	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)C(C)(C)c3ccccc3Cl)C[C@@H]2C1	ZINC001088175882	1359781473	/nfs/dbraw/zinc/78/14/73/1359781473.db2.gz	QOCLOVRGNNQLNS-CVEARBPZSA-N	0	3	344.886	3.031	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3cc(Cl)ccc3Cl)C[C@@H]2C1	ZINC001088180817	1359783805	/nfs/dbraw/zinc/78/38/05/1359783805.db2.gz	BWQPLZYVNJXHBQ-OLZOCXBDSA-N	0	3	337.250	3.021	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3cc(CCC)c(C)s3)C[C@@H]2C1	ZINC001088193699	1359790797	/nfs/dbraw/zinc/79/07/97/1359790797.db2.gz	RANMOMYQGSAUSH-SJORKVTESA-N	0	3	330.497	3.036	20	30		EGEDHN
C=CCN1CC[C@@H](OCC2CCN(C(=O)C=C3CCCCC3)CC2)C1	ZINC001088229733	1359808571	/nfs/dbraw/zinc/80/85/71/1359808571.db2.gz	YAMWYSUBFHQCRY-HXUWFJFHSA-N	0	3	346.515	3.392	20	30		EGEDHN
CC(C)(F)C(=O)N1CCCCC[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001088247058	1359816374	/nfs/dbraw/zinc/81/63/74/1359816374.db2.gz	IKQQLKJWLIUKMI-MRXNPFEDSA-N	0	3	349.425	3.306	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCCCC[C@H](NCc3ccccn3)C2)cc1	ZINC001088358185	1359841707	/nfs/dbraw/zinc/84/17/07/1359841707.db2.gz	WFBCNGJBQPBVOI-NRFANRHFSA-N	0	3	347.462	3.238	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2csc(C)n2)C1	ZINC001088368351	1359852082	/nfs/dbraw/zinc/85/20/82/1359852082.db2.gz	IIHXLXHSSJFBBK-CYBMUJFWSA-N	0	3	327.881	3.178	20	30		EGEDHN
C=C1CCC(C(=O)N2CCCCC[C@@H](NCc3cnn(C)c3)C2)CC1	ZINC001088373764	1359854973	/nfs/dbraw/zinc/85/49/73/1359854973.db2.gz	NXWGREJAWBWIAM-LJQANCHMSA-N	0	3	344.503	3.027	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2cc(C(F)F)n[nH]2)C1	ZINC001088380826	1359864229	/nfs/dbraw/zinc/86/42/29/1359864229.db2.gz	PZPRBERVARESFF-NSHDSACASA-N	0	3	346.809	3.074	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2ccccc2N(C)C)C1	ZINC001088433435	1359902113	/nfs/dbraw/zinc/90/21/13/1359902113.db2.gz	WJOQBMGUGLOIQI-INIZCTEOSA-N	0	3	349.906	3.480	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N[C@H]1CCN(CC=C(C)C)[C@@H]1C	ZINC001088672054	1360009494	/nfs/dbraw/zinc/00/94/94/1360009494.db2.gz	LTCGHXFRRMFEDO-AEFFLSMTSA-N	0	3	328.456	3.410	20	30		EGEDHN
CC/C(C)=C\C(=O)N1CC[C@H](CNCc2ccccc2C#N)[C@@H](C)C1	ZINC001184328044	1387430682	/nfs/dbraw/zinc/43/06/82/1387430682.db2.gz	KXQITFOKKPYVTF-BTSJSCHISA-N	0	3	339.483	3.489	20	30		EGEDHN
C=C(C)CCN1CC[C@H](NC(=O)c2cnc(CC3CC3)s2)[C@H]1C	ZINC001088769046	1360037349	/nfs/dbraw/zinc/03/73/49/1360037349.db2.gz	PFVWJRYLDDQBQD-HIFRSBDPSA-N	0	3	333.501	3.254	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CCN(Cc3cc(C)ccc3C)[C@@H]2C)c1	ZINC001088846616	1360080350	/nfs/dbraw/zinc/08/03/50/1360080350.db2.gz	XUCVZSACIAPCIP-UTKZUKDTSA-N	0	3	347.462	3.073	20	30		EGEDHN
C=C(C)CCN1CC[C@H](NC(=O)c2cnc([C@H]3CCCO3)s2)[C@H]1C	ZINC001088906566	1360101723	/nfs/dbraw/zinc/10/17/23/1360101723.db2.gz	BLRIAVPJJVFQRB-QLFBSQMISA-N	0	3	349.500	3.153	20	30		EGEDHN
CC1(C)C[C@@H](NC(=O)CC2CC2)CCN(CC#Cc2ccccc2)C1	ZINC001089302037	1360321313	/nfs/dbraw/zinc/32/13/13/1360321313.db2.gz	XTYNRSCXQMFOEW-FQEVSTJZSA-N	0	3	338.495	3.445	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2conc2C2CCCC2)CC(C)(C)C1	ZINC001089405656	1360404646	/nfs/dbraw/zinc/40/46/46/1360404646.db2.gz	DAMJYTASGUEDSP-MRXNPFEDSA-N	0	3	343.471	3.186	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2ccc(C)cc2Cl)CC(C)(C)C1	ZINC001089424866	1360418146	/nfs/dbraw/zinc/41/81/46/1360418146.db2.gz	ZRKZKHQNMUVARZ-QGZVFWFLSA-N	0	3	346.902	3.431	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2nccc3occc32)CC(C)(C)C1	ZINC001089446346	1360435652	/nfs/dbraw/zinc/43/56/52/1360435652.db2.gz	WFURRZSBHCMESN-HNNXBMFYSA-N	0	3	339.439	3.072	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2F)CC(C)(C)C1	ZINC001089511221	1360482590	/nfs/dbraw/zinc/48/25/90/1360482590.db2.gz	OJZCCFIGBNHXHY-BPQIPLTHSA-N	0	3	342.458	3.169	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc3cnccc3c2)CC(C)(C)C1	ZINC001089534109	1360493600	/nfs/dbraw/zinc/49/36/00/1360493600.db2.gz	OTWCGUINYWUKNO-LJQANCHMSA-N	0	3	335.451	3.088	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ncoc2C(C)C)CC(C)(C)C1	ZINC001089535988	1360495023	/nfs/dbraw/zinc/49/50/23/1360495023.db2.gz	ZJLAQSCBKDHGLA-HNNXBMFYSA-N	0	3	331.460	3.042	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C(F)F)o2)CC(C)(C)C1	ZINC001089548682	1360502090	/nfs/dbraw/zinc/50/20/90/1360502090.db2.gz	OWSNFLIZEKNRSZ-ZDUSSCGKSA-N	0	3	338.398	3.461	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H]1CCCO[C@H]1C(C)C	ZINC001089642353	1360555208	/nfs/dbraw/zinc/55/52/08/1360555208.db2.gz	JVFRWZUKIKYFIW-SQNIBIBYSA-N	0	3	336.520	3.230	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cnn(C2CCC2)c1	ZINC001089642022	1360555621	/nfs/dbraw/zinc/55/56/21/1360555621.db2.gz	ZHARTGVQJFBJHI-SFHVURJKSA-N	0	3	344.503	3.405	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1sccc1CN(C)C	ZINC001089648697	1360562123	/nfs/dbraw/zinc/56/21/23/1360562123.db2.gz	PSVYOKWDPQJSTA-INIZCTEOSA-N	0	3	349.544	3.216	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc2ccsc2[nH]1	ZINC001089677396	1360585889	/nfs/dbraw/zinc/58/58/89/1360585889.db2.gz	XMCXHKLWDFSMGL-HNNXBMFYSA-N	0	3	343.496	3.473	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1nccc2[nH]ccc21	ZINC001089695041	1360599564	/nfs/dbraw/zinc/59/95/64/1360599564.db2.gz	AWUYVBGSDPPOHD-OAHLLOKOSA-N	0	3	340.471	3.359	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1oc(C2CC2)nc1C	ZINC001089707482	1360610769	/nfs/dbraw/zinc/61/07/69/1360610769.db2.gz	LFBRPOPDCXUUEF-INIZCTEOSA-N	0	3	343.471	3.104	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)Cc2ccc(C)o2)C1	ZINC001089797106	1360668057	/nfs/dbraw/zinc/66/80/57/1360668057.db2.gz	JVWUGLIFBRGSFG-DKIMLUQUSA-N	0	3	348.874	3.052	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)Cc1ccc(C)o1	ZINC001089797108	1360668120	/nfs/dbraw/zinc/66/81/20/1360668120.db2.gz	JVWUGLIFBRGSFG-OWLYRPNTSA-N	0	3	348.874	3.052	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C(C)(C)C1CC1	ZINC001089849470	1360696642	/nfs/dbraw/zinc/69/66/42/1360696642.db2.gz	FJBQGDANJCVKTM-SVGFKBNWSA-N	0	3	336.907	3.344	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)Cc1occc1C	ZINC001089858462	1360703317	/nfs/dbraw/zinc/70/33/17/1360703317.db2.gz	AZVWJVBGTSRAMH-YVSFHVDLSA-N	0	3	348.874	3.052	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C(C)(C)C(F)F	ZINC001089865618	1360708317	/nfs/dbraw/zinc/70/83/17/1360708317.db2.gz	RIYYNSZSSUOGBP-FQUUOJAGSA-N	0	3	346.849	3.199	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CC2=CCCCC2)CC2(CCOCC2)C1	ZINC001089928509	1360748815	/nfs/dbraw/zinc/74/88/15/1360748815.db2.gz	GTPWMPFNGFOCCY-SFHVURJKSA-N	0	3	332.488	3.050	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C(C)=C2CCC2)CC2(CCOCC2)C1	ZINC001089934940	1360752133	/nfs/dbraw/zinc/75/21/33/1360752133.db2.gz	KNZWHXJTONGPNP-GOSISDBHSA-N	0	3	332.488	3.050	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C[C@H]2CC=CCC2)CC2(CCOCC2)C1	ZINC001089950970	1360760504	/nfs/dbraw/zinc/76/05/04/1360760504.db2.gz	DPKCOUQKGTWPLS-RBUKOAKNSA-N	0	3	346.515	3.296	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)c2cc(C)cc(C)c2)CC2(CCOCC2)C1	ZINC001089968175	1360771527	/nfs/dbraw/zinc/77/15/27/1360771527.db2.gz	KTFYNNAREBJTRN-IBGZPJMESA-N	0	3	342.483	3.090	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(C)cc2)CC2(CCOCC2)C1	ZINC001089968193	1360771854	/nfs/dbraw/zinc/77/18/54/1360771854.db2.gz	LBEOMFZKHVCNMO-IBGZPJMESA-N	0	3	342.483	3.172	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ncoc2-c2ccccc2)C1	ZINC001091059476	1360987685	/nfs/dbraw/zinc/98/76/85/1360987685.db2.gz	PODSYVQQLJCONQ-UHFFFAOYSA-N	0	3	345.830	3.192	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(-c3cnco3)cc2)C1	ZINC001091100980	1360992710	/nfs/dbraw/zinc/99/27/10/1360992710.db2.gz	OREMUGOWDYZCDK-UHFFFAOYSA-N	0	3	345.830	3.192	20	30		EGEDHN
C=C1CCC(C(=O)NCC2CC(NCc3cccc(Cl)n3)C2)CC1	ZINC001091213616	1361009902	/nfs/dbraw/zinc/00/99/02/1361009902.db2.gz	QBQUJMXWJHYMPT-UHFFFAOYSA-N	0	3	347.890	3.466	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1	ZINC001091222362	1361013112	/nfs/dbraw/zinc/01/31/12/1361013112.db2.gz	MARRXIDYIPVTLQ-XPJGSDBHSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2c(F)cccc2Cl)C1	ZINC001091339377	1361051174	/nfs/dbraw/zinc/05/11/74/1361051174.db2.gz	HSEHCEOGCDWSFW-UHFFFAOYSA-N	0	3	331.218	3.330	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cccc3cnccc32)C1	ZINC001091365574	1361062623	/nfs/dbraw/zinc/06/26/23/1361062623.db2.gz	WEEORFZKYVCKPE-UHFFFAOYSA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)C1	ZINC001091385670	1361073543	/nfs/dbraw/zinc/07/35/43/1361073543.db2.gz	OAGVBKUCXPUZOK-XEXHBRLRSA-N	0	3	336.838	3.166	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3cc(F)c4ccccc4c3)C[C@]2(C)C1	ZINC001091720824	1361191616	/nfs/dbraw/zinc/19/16/16/1361191616.db2.gz	DARDARSOWDYIFS-UTKZUKDTSA-N	0	3	336.410	3.006	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc(C)ccc3C3CC3)C[C@]2(C)C1	ZINC001091879463	1361240481	/nfs/dbraw/zinc/24/04/81/1361240481.db2.gz	LEQGPXRLKTULMV-GCJKJVERSA-N	0	3	336.479	3.290	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CN(Cc3cncc(C)c3)C[C@@]2(C)C1	ZINC001091911067	1361244018	/nfs/dbraw/zinc/24/40/18/1361244018.db2.gz	OCTRSUJKBRUZIZ-NQIIRXRSSA-N	0	3	341.499	3.273	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CN(Cc3ccccc3F)C[C@@]2(C)C1	ZINC001091916296	1361247525	/nfs/dbraw/zinc/24/75/25/1361247525.db2.gz	FEMMNRJHQJHWQX-UZLBHIALSA-N	0	3	330.447	3.318	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3sccc3C3CC3)C[C@]2(C)C1	ZINC001092251131	1361342104	/nfs/dbraw/zinc/34/21/04/1361342104.db2.gz	SCMBOASCXRTLNL-BEFAXECRSA-N	0	3	328.481	3.043	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)CCc3ccccc3Cl)C[C@]2(C)C1	ZINC001092257351	1361345572	/nfs/dbraw/zinc/34/55/72/1361345572.db2.gz	RREFAAVRTHPSSX-XLIONFOSSA-N	0	3	344.886	3.076	20	30		EGEDHN
Cc1cocc1C(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001092890792	1361478868	/nfs/dbraw/zinc/47/88/68/1361478868.db2.gz	GGPFJRJJNOQTKR-TZMCWYRMSA-N	0	3	343.452	3.019	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)c2cccc(C)c2)CC1	ZINC001093352373	1361566076	/nfs/dbraw/zinc/56/60/76/1361566076.db2.gz	YWNOGLHJDHQRLA-HXUWFJFHSA-N	0	3	336.479	3.335	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)c2cc(C)oc2C)CC1	ZINC001093356419	1361569420	/nfs/dbraw/zinc/56/94/20/1361569420.db2.gz	SETXCJFNFYZQBP-LJQANCHMSA-N	0	3	340.467	3.236	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)c2cc(C)oc2C)CC1	ZINC001093356417	1361569630	/nfs/dbraw/zinc/56/96/30/1361569630.db2.gz	SETXCJFNFYZQBP-IBGZPJMESA-N	0	3	340.467	3.236	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)[C@]2(C)C=CCC2)CC1	ZINC001093377087	1361587400	/nfs/dbraw/zinc/58/74/00/1361587400.db2.gz	PVAXTCMHIYMATC-UYAOXDASSA-N	0	3	326.484	3.069	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H](CNCc2csc(C)n2)[C@H](C)C1	ZINC001094018087	1361725134	/nfs/dbraw/zinc/72/51/34/1361725134.db2.gz	DPHASGDXROANBF-SIIHOXLZSA-N	0	3	335.517	3.238	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cc(Cl)ccc3F)CCC[C@@H]12	ZINC001094464320	1361813102	/nfs/dbraw/zinc/81/31/02/1361813102.db2.gz	KNBVLUUGXLFKDO-SJLPKXTDSA-N	0	3	334.822	3.087	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3ccccc3CC(C)C)CCC[C@@H]12	ZINC001094585730	1361870926	/nfs/dbraw/zinc/87/09/26/1361870926.db2.gz	PAQMTGSFNNENQS-IFMALSPDSA-N	0	3	338.495	3.493	20	30		EGEDHN
CC[C@H](C(=O)NCCCCCCNc1cccc(F)c1C#N)N(C)C	ZINC001094964496	1361965119	/nfs/dbraw/zinc/96/51/19/1361965119.db2.gz	GVAHTHKKMAFCMU-GOSISDBHSA-N	0	3	348.466	3.126	20	30		EGEDHN
C[C@H]1CN(C(=O)CCC(F)F)CC[C@@H]1CNCc1ccccc1C#N	ZINC001184831862	1387546514	/nfs/dbraw/zinc/54/65/14/1387546514.db2.gz	NJVBDZHCJPFBNQ-GOEBONIOSA-N	0	3	349.425	3.178	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](NCc2cc(F)cc(F)c2)C1	ZINC001184889872	1387555365	/nfs/dbraw/zinc/55/53/65/1387555365.db2.gz	CPQHIDSEYGCITD-GOSISDBHSA-N	0	3	334.410	3.239	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc3c(cc(C)cc3C)[nH]1)C2	ZINC001095828891	1362247902	/nfs/dbraw/zinc/24/79/02/1362247902.db2.gz	MRYXATJIWQIJGM-BPAFIMBUSA-N	0	3	335.451	3.143	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1cn(C)c3ccccc13)C2	ZINC001095947820	1362300757	/nfs/dbraw/zinc/30/07/57/1362300757.db2.gz	BJVXFDLIJKCNBR-KPFFTGBYSA-N	0	3	337.467	3.018	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1scnc1C(C)(C)C)C2	ZINC001096127861	1362396585	/nfs/dbraw/zinc/39/65/85/1362396585.db2.gz	LFHBLOKBCWTVQH-RDBSUJKOSA-N	0	3	333.501	3.352	20	30		EGEDHN
C[C@@H](C(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1)C1CC1	ZINC001324308710	1387589431	/nfs/dbraw/zinc/58/94/31/1387589431.db2.gz	QOLHDFCSKBTWBM-OAHLLOKOSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC(C)[C@H](C)C(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001324336588	1387597213	/nfs/dbraw/zinc/59/72/13/1387597213.db2.gz	ZRFZJXYHLCOTFJ-INIZCTEOSA-N	0	3	327.472	3.321	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1nccc3ccsc31)C2	ZINC001097259977	1362905005	/nfs/dbraw/zinc/90/50/05/1362905005.db2.gz	CHLNOTRGTMJZCZ-KFWWJZLASA-N	0	3	327.453	3.208	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1[nH]c3ccccc3c1Cl)C2	ZINC001097428079	1362983538	/nfs/dbraw/zinc/98/35/38/1362983538.db2.gz	KASNHDOSSGCAOX-WQVCFCJDSA-N	0	3	341.842	3.180	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](CNCc2csc(C)n2)[C@@H](C)C1	ZINC001185062891	1387605027	/nfs/dbraw/zinc/60/50/27/1387605027.db2.gz	WOXFIGLRIZXVAD-HOCLYGCPSA-N	0	3	335.517	3.382	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C1(c3ccc(C)cc3)CCC1)C2	ZINC001098479317	1363338150	/nfs/dbraw/zinc/33/81/50/1363338150.db2.gz	BHEIZZXFMHIOMK-AQNXPRMDSA-N	0	3	336.479	3.162	20	30		EGEDHN
C=CCC[C@H](C)NCc1cn([C@H]2CCN(C(=O)CCCCC)C2)nn1	ZINC001098615019	1363400057	/nfs/dbraw/zinc/40/00/57/1363400057.db2.gz	GZRQEFZYWOAMJO-WMZOPIPTSA-N	0	3	347.507	3.076	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@@H]1CC=CCC1)C[C@H](C)O2	ZINC001098623773	1363403983	/nfs/dbraw/zinc/40/39/83/1363403983.db2.gz	QJXORSXYZWIEJC-ZWKOTPCHSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1CC[C@H](C)CC1)C[C@@H](C)O2	ZINC001098654659	1363419820	/nfs/dbraw/zinc/41/98/20/1363419820.db2.gz	DRQVDYVDTHXIIZ-KZNAEPCWSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1CC(C(C)(C)C)C1)C[C@H](C)O2	ZINC001098662805	1363425000	/nfs/dbraw/zinc/42/50/00/1363425000.db2.gz	MJJYLAAKCNUQDV-AOCRQIFASA-N	0	3	348.531	3.327	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H]2C[C@H]2c2sccc2C)C1	ZINC001098835408	1363487465	/nfs/dbraw/zinc/48/74/65/1363487465.db2.gz	RXRXSTSZGAQAPU-XLSPSMHOSA-N	0	3	342.508	3.154	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(C3CCCCC3)n[nH]2)C1	ZINC001098879419	1363502102	/nfs/dbraw/zinc/50/21/02/1363502102.db2.gz	SNSUPIIEMNXNAP-JXFKEZNVSA-N	0	3	342.487	3.228	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)C2CCc3ccccc3CC2)C1	ZINC001098912395	1363518405	/nfs/dbraw/zinc/51/84/05/1363518405.db2.gz	GMDRCDZDQWNWAR-UNMCSNQZSA-N	0	3	338.495	3.338	20	30		EGEDHN
C=CCCC(=O)NC[C@@H]1CCC(C)(C)CN1CCc1ccns1	ZINC001098966542	1363545013	/nfs/dbraw/zinc/54/50/13/1363545013.db2.gz	QGDCVYJKXNHXFB-HNNXBMFYSA-N	0	3	335.517	3.259	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H]1CCC(C)(C)CN1CCOC1CCC1	ZINC001099028781	1363584061	/nfs/dbraw/zinc/58/40/61/1363584061.db2.gz	KOSVFRMIAVBCDD-SFHVURJKSA-N	0	3	348.531	3.356	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)C1(c2ccccn2)CC1	ZINC001099073944	1363608993	/nfs/dbraw/zinc/60/89/93/1363608993.db2.gz	FLMIIODJFFKEKW-KRWDZBQOSA-N	0	3	341.499	3.296	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)CCOc1cccc(F)c1	ZINC001099097657	1363619985	/nfs/dbraw/zinc/61/99/85/1363619985.db2.gz	CADIWUQJTSHOKI-QGZVFWFLSA-N	0	3	348.462	3.387	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)CCCc1ncc(C)o1	ZINC001099101977	1363623573	/nfs/dbraw/zinc/62/35/73/1363623573.db2.gz	IFMRJLFGMMORRW-INIZCTEOSA-N	0	3	333.476	3.099	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)C12CCC(CC1)C2	ZINC001099122058	1363635712	/nfs/dbraw/zinc/63/57/12/1363635712.db2.gz	TXXNKIIKOPYBPF-IDYZSHNDSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@H]2CCC(C)(C)CN2CCOCC2CC2)C1	ZINC001099230007	1363703443	/nfs/dbraw/zinc/70/34/43/1363703443.db2.gz	OZXDETXDXAHHLL-GOSISDBHSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2sccc2F)C[C@H]1C(F)(F)F	ZINC001099248011	1363712772	/nfs/dbraw/zinc/71/27/72/1363712772.db2.gz	QQEXLYFCQGOVGO-MWLCHTKSSA-N	0	3	336.354	3.056	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2sc(C)cc2C)C[C@H]1C(F)(F)F	ZINC001099256492	1363717112	/nfs/dbraw/zinc/71/71/12/1363717112.db2.gz	MULFPWFPIWIFJU-VXGBXAGGSA-N	0	3	332.391	3.143	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2cccc3ccncc32)C[C@H]1C(F)(F)F	ZINC001099327404	1363752902	/nfs/dbraw/zinc/75/29/02/1363752902.db2.gz	KPDUMGWQEYCCPP-HZPDHXFCSA-N	0	3	349.356	3.013	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)Cc2sc(C)cc2C)C[C@H]1C(F)(F)F	ZINC001099336975	1363757711	/nfs/dbraw/zinc/75/77/11/1363757711.db2.gz	BMQACRHIHXSROO-CHWSQXEVSA-N	0	3	346.418	3.072	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCC2CCC2)CC2(CCOCC2)C1	ZINC001099574227	1363859384	/nfs/dbraw/zinc/85/93/84/1363859384.db2.gz	BDMMOXCGBNZGTN-GOSISDBHSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CC2(C)CCCC2)CC2(CCOCC2)C1	ZINC001099579631	1363862391	/nfs/dbraw/zinc/86/23/91/1363862391.db2.gz	WYGJLJCEAPCWNL-KRWDZBQOSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)CC(C)(C)C2CCCCC2)[C@@H](O)C1	ZINC001100074805	1364009644	/nfs/dbraw/zinc/00/96/44/1364009644.db2.gz	SWDFTSZSJGVLSO-ROUUACIJSA-N	0	3	336.520	3.111	20	30		EGEDHN
CCC[C@@H](C)C(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100195039	1364041558	/nfs/dbraw/zinc/04/15/58/1364041558.db2.gz	ATBNBUQENBQADM-LSJNQWAISA-N	0	3	330.447	3.098	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)NCC1CC(NCC#Cc2ccc(Cl)cc2)C1	ZINC001100245718	1364056762	/nfs/dbraw/zinc/05/67/62/1364056762.db2.gz	BOTUPJMXGOKUFD-VJFUWPCTSA-N	0	3	344.886	3.222	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)Cc2cccc(C3CC3)c2)C1	ZINC001100529977	1364148982	/nfs/dbraw/zinc/14/89/82/1364148982.db2.gz	YCQIYSDWAQMKKZ-UHFFFAOYSA-N	0	3	332.875	3.343	20	30		EGEDHN
C=CC(C)(C)C(=O)NCC1CC(NCc2oc(CCC)nc2C)C1	ZINC001100564699	1364164184	/nfs/dbraw/zinc/16/41/84/1364164184.db2.gz	SNGHBIOLACAOPT-UHFFFAOYSA-N	0	3	333.476	3.132	20	30		EGEDHN
O=C(C[C@@H]1CC=CCC1)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100572737	1364168411	/nfs/dbraw/zinc/16/84/11/1364168411.db2.gz	OPEMFMKEVGJBOZ-QNGMFEMESA-N	0	3	336.479	3.269	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCC1CC(NCc2ccncc2Cl)C1	ZINC001100596327	1364180776	/nfs/dbraw/zinc/18/07/76/1364180776.db2.gz	PDXRIOXSXHIHGR-VQCLRJIVSA-N	0	3	335.879	3.322	20	30		EGEDHN
C=CCCC1(C(=O)NCC2CC(NCc3c(C)onc3CC)C2)CC1	ZINC001100642504	1364201265	/nfs/dbraw/zinc/20/12/65/1364201265.db2.gz	AGRCRLRZFMFHOW-UHFFFAOYSA-N	0	3	345.487	3.276	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H](C)c2ccc(F)cc2F)C1	ZINC001101006568	1364368498	/nfs/dbraw/zinc/36/84/98/1364368498.db2.gz	PKOQHGHVHFYDCP-DCBWTQNWSA-N	0	3	342.817	3.305	20	30		EGEDHN
C=CCN1CC[C@@H](Oc2ccnc(CNC(=O)[C@@H](C)C(C)(C)C)c2)C1	ZINC001101095419	1364411623	/nfs/dbraw/zinc/41/16/23/1364411623.db2.gz	IIDOBRQDVCAWSR-CRAIPNDOSA-N	0	3	345.487	3.019	20	30		EGEDHN
C=CCN1CC[C@@H](Oc2ccnc(CNC(=O)CCC(C)(C)C)c2)C1	ZINC001101097057	1364413058	/nfs/dbraw/zinc/41/30/58/1364413058.db2.gz	ICEZLZJIPLJCSD-GOSISDBHSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=CCN1CC[C@@H](Oc2ccnc(CNC(=O)CC[C@H](C)CC)c2)C1	ZINC001101097680	1364413357	/nfs/dbraw/zinc/41/33/57/1364413357.db2.gz	XXEHWEYOSHNOAL-VQIMIIECSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=CCCC(=O)N1C[C@H]2CN(CCc3c(F)cccc3F)C[C@@]2(C)C1	ZINC001101167481	1364442719	/nfs/dbraw/zinc/44/27/19/1364442719.db2.gz	GDDIALAAYVGULV-QRWLVFNGSA-N	0	3	348.437	3.254	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1C[C@H]2CN(Cc3ccc(C#N)cc3)C[C@@]2(C)C1	ZINC001101182687	1364451063	/nfs/dbraw/zinc/45/10/63/1364451063.db2.gz	AIOUOCVYSJTSDF-BSIFCXSSSA-N	0	3	339.483	3.275	20	30		EGEDHN
CCC[C@H](C)CCCC(=O)N1C[C@H]2CN(CC#CCOC)C[C@@]2(C)C1	ZINC001101250753	1364485792	/nfs/dbraw/zinc/48/57/92/1364485792.db2.gz	LCNQGUWTPRSPOX-ZVDOUQERSA-N	0	3	348.531	3.023	20	30		EGEDHN
CCCC[C@H](CC)CC(=O)N1C[C@H]2CN(CC#CCOC)C[C@@]2(C)C1	ZINC001101306249	1364504919	/nfs/dbraw/zinc/50/49/19/1364504919.db2.gz	ICIHACTYIVXJHM-ZVDOUQERSA-N	0	3	348.531	3.023	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)[C@H](CCC)CC3CCCC3)C[C@]2(C)C1	ZINC001101381494	1364538418	/nfs/dbraw/zinc/53/84/18/1364538418.db2.gz	SGXQDGKXGBVOTF-SBHAEUEKSA-N	0	3	330.516	3.397	20	30		EGEDHN
CCCC(=O)NC[C@@H]1CN(CC#Cc2cccc(Cl)c2)C[C@H]1C	ZINC001101679997	1364686894	/nfs/dbraw/zinc/68/68/94/1364686894.db2.gz	SMCHHWWLXAWZQX-NVXWUHKLSA-N	0	3	332.875	3.176	20	30		EGEDHN
C[C@H](C(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C)C(C)(C)C	ZINC001102089360	1364849116	/nfs/dbraw/zinc/84/91/16/1364849116.db2.gz	KHNAWBOIDIPLTH-RBSFLKMASA-N	0	3	347.528	3.486	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H]1CN(Cc2oc(CCC)nc2C)C[C@H]1C	ZINC001102226316	1364943252	/nfs/dbraw/zinc/94/32/52/1364943252.db2.gz	KZSMBHFRCPYPHO-GDBMZVCRSA-N	0	3	347.503	3.332	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H]1CN(Cc2cn(C(C)C)nc2C)C[C@H]1C	ZINC001102298163	1364989783	/nfs/dbraw/zinc/98/97/83/1364989783.db2.gz	LLLHAOGTWDWNSQ-SJLPKXTDSA-N	0	3	346.519	3.313	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H]1CN(Cc2oc(CC)nc2C)C[C@H]1C	ZINC001102298411	1364990114	/nfs/dbraw/zinc/99/01/14/1364990114.db2.gz	RDRSLZAYJJZXGH-GDBMZVCRSA-N	0	3	333.476	3.086	20	30		EGEDHN
C=CCCC1(C(=O)NC[C@@H]2CN(Cc3c(C)noc3C)C[C@H]2C)CC1	ZINC001102325674	1365001868	/nfs/dbraw/zinc/00/18/68/1365001868.db2.gz	YVTWGRJTTTWJGI-RHSMWYFYSA-N	0	3	345.487	3.222	20	30		EGEDHN
CCCCC(=O)NCC[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1C	ZINC001102670798	1365163956	/nfs/dbraw/zinc/16/39/56/1365163956.db2.gz	RWNDJJCCWWPUKA-NVXWUHKLSA-N	0	3	345.462	3.462	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2ccsc2C)C1	ZINC001102958951	1365317008	/nfs/dbraw/zinc/31/70/08/1365317008.db2.gz	VVTVDGLKDLDXDN-BXUZGUMPSA-N	0	3	326.893	3.497	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2ccnc(CCC)c2)C1	ZINC001103110284	1365385752	/nfs/dbraw/zinc/38/57/52/1365385752.db2.gz	HKIDBVDXUXQMIM-RHSMWYFYSA-N	0	3	349.906	3.474	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cccc3n[nH]cc32)C1	ZINC001103297087	1365480063	/nfs/dbraw/zinc/48/00/63/1365480063.db2.gz	XNGVKQOJCKLCMU-TZMCWYRMSA-N	0	3	346.862	3.003	20	30		EGEDHN
C=CC(C)(C)C(=O)NCC[C@@H]1CN(Cc2ccc(F)cn2)C[C@H]1C	ZINC001103312072	1365487370	/nfs/dbraw/zinc/48/73/70/1365487370.db2.gz	ZSDPOQQLVBOOGI-HUUCEWRRSA-N	0	3	333.451	3.007	20	30		EGEDHN
C=CC(C)(C)C(=O)NCC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001103311932	1365487392	/nfs/dbraw/zinc/48/73/92/1365487392.db2.gz	RYVCZJSUYBILRX-HUUCEWRRSA-N	0	3	345.512	3.406	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCC[C@@H]1CN(Cc2ccns2)C[C@H]1C	ZINC001103344107	1365510227	/nfs/dbraw/zinc/51/02/27/1365510227.db2.gz	CXLCNNYBOVUENA-BZUAXINKSA-N	0	3	335.517	3.320	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCC[C@@H]1CN(Cc2ccns2)C[C@H]1C	ZINC001103346762	1365510679	/nfs/dbraw/zinc/51/06/79/1365510679.db2.gz	REKJSJROPOVJTB-BZUAXINKSA-N	0	3	335.517	3.320	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC[C@@H]2CN(Cc3cncc(F)c3)C[C@H]2C)C1	ZINC001103418496	1365549540	/nfs/dbraw/zinc/54/95/40/1365549540.db2.gz	LDNQCFIGIPIFES-NVXWUHKLSA-N	0	3	345.462	3.151	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC[C@@H]1CN(Cc2cncc(F)c2)C[C@H]1C	ZINC001103474489	1365583796	/nfs/dbraw/zinc/58/37/96/1365583796.db2.gz	BELSHBHLEUDWPV-NVXWUHKLSA-N	0	3	347.478	3.397	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)Cc2ccsc2C)C1	ZINC001103499708	1365599111	/nfs/dbraw/zinc/59/91/11/1365599111.db2.gz	VXMRQPBGZMKTJL-MLGOLLRUSA-N	0	3	340.920	3.426	20	30		EGEDHN
CCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2ccccc2C#N)C1	ZINC001103892408	1365826547	/nfs/dbraw/zinc/82/65/47/1365826547.db2.gz	PBNHJPRLEFETLY-VQIMIIECSA-N	0	3	327.472	3.323	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2ncc(C)s2)C1	ZINC001104091900	1365908039	/nfs/dbraw/zinc/90/80/39/1365908039.db2.gz	DJEPFTDUPNIFGO-NVXWUHKLSA-N	0	3	347.528	3.219	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)C[C@H]2CC(C)(C)CO2)C[C@H]1C	ZINC001104411200	1366011844	/nfs/dbraw/zinc/01/18/44/1366011844.db2.gz	WWIMNYBSXKASOE-BMFZPTHFSA-N	0	3	342.911	3.018	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)C2CCC(F)CC2)C[C@H]1C	ZINC001104632563	1366111124	/nfs/dbraw/zinc/11/11/24/1366111124.db2.gz	JOGHEXJDANYXKU-GOTCIRLWSA-N	0	3	330.875	3.341	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](C)[C@H](CCNCc3c(C)noc3C)C2)C1	ZINC001104653410	1366119476	/nfs/dbraw/zinc/11/94/76/1366119476.db2.gz	WIQGKLSWWGHJAE-RHSMWYFYSA-N	0	3	345.487	3.222	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2ccn(C)c2CC)C[C@H]1C	ZINC001104679611	1366129002	/nfs/dbraw/zinc/12/90/02/1366129002.db2.gz	LKGLCTTWWYNLEA-UKRRQHHQSA-N	0	3	337.895	3.028	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2ncoc2C(C)C)C[C@H]1C	ZINC001104878229	1366207534	/nfs/dbraw/zinc/20/75/34/1366207534.db2.gz	DDWXBSRMDRBSIJ-TZMCWYRMSA-N	0	3	339.867	3.238	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)N[C@H]1C[C@@](CNCCF)(c2ccccc2)C1	ZINC001105433639	1366465989	/nfs/dbraw/zinc/46/59/89/1366465989.db2.gz	KMVSAVPVNZHFGN-CIWUYKSXSA-N	0	3	332.463	3.220	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](CNCc2ccn(C3CCCC3)n2)[C@H](C)C1	ZINC001105926806	1366599715	/nfs/dbraw/zinc/59/97/15/1366599715.db2.gz	IMBKMBSJCFLZGA-IAGOWNOFSA-N	0	3	344.503	3.149	20	30		EGEDHN
C[C@@H]1CN(C(=O)/C=C\C(C)(C)C)C[C@H]1CNCc1ccccc1C#N	ZINC001105956212	1366602109	/nfs/dbraw/zinc/60/21/09/1366602109.db2.gz	QBYBLJUEIGXZGU-DKBRWSJVSA-N	0	3	339.483	3.345	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@@H](CNC/C(Cl)=C/Cl)[C@H](C)C1	ZINC001106025870	1366606965	/nfs/dbraw/zinc/60/69/65/1366606965.db2.gz	LHUKKTDPJXFINR-XPWVWULPSA-N	0	3	331.287	3.183	20	30		EGEDHN
CC[C@H](C)CC(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001106061568	1366608632	/nfs/dbraw/zinc/60/86/32/1366608632.db2.gz	IHWBIXYSKZRVCH-FRQCXROJSA-N	0	3	327.472	3.179	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H](CNCc2csc(C)n2)[C@H](C)C1	ZINC001106564193	1366737319	/nfs/dbraw/zinc/73/73/19/1366737319.db2.gz	UPHLGQHVXIOJBE-IIAWOOMASA-N	0	3	335.517	3.238	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](N(C)Cc2ccc(OC)c(Cl)c2)C1	ZINC001189279613	1366976293	/nfs/dbraw/zinc/97/62/93/1366976293.db2.gz	LGPBKWXOZMFEEK-OAHLLOKOSA-N	0	3	336.863	3.348	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@]12CCC[C@H]1N(Cc1ocnc1C)CC2	ZINC001107515011	1367014260	/nfs/dbraw/zinc/01/42/60/1367014260.db2.gz	HAYHLTBQPQJLJN-YVWKXTFCSA-N	0	3	345.487	3.446	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@]12CCC[C@H]1N(Cc1cnoc1C)CC2	ZINC001107515104	1367014336	/nfs/dbraw/zinc/01/43/36/1367014336.db2.gz	MBQSOXODJYEPER-ILZDJORESA-N	0	3	345.487	3.446	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCN(C(=O)/C=C\C(C)(C)C)C1	ZINC001189427181	1367018328	/nfs/dbraw/zinc/01/83/28/1367018328.db2.gz	FIKYNYYDRMBLAX-IZTUGPKFSA-N	0	3	325.456	3.193	20	30		EGEDHN
O=C(C#CC1CC1)N[C@H]1C[C@H]2CC[C@@H]1N2CC/C=C/c1ccccc1	ZINC001109257778	1367029269	/nfs/dbraw/zinc/02/92/69/1367029269.db2.gz	MSZNRUUYBHACQM-DXNZDYIYSA-N	0	3	334.463	3.225	20	30		EGEDHN
COCC#CCN1CC[C@@]2(CNC(=O)C(C)(C)CC(C)C)CCC[C@@H]12	ZINC001107603741	1367068372	/nfs/dbraw/zinc/06/83/72/1367068372.db2.gz	NOQLOXOCXKGGFU-WIYYLYMNSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccc(CO)cc1	ZINC001109343180	1367070519	/nfs/dbraw/zinc/07/05/19/1367070519.db2.gz	MFMLXSIZLHJKAV-QYZOEREBSA-N	0	3	342.483	3.003	20	30		EGEDHN
C#CCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3CCc2ccccc2)CCC1	ZINC001109392023	1367101594	/nfs/dbraw/zinc/10/15/94/1367101594.db2.gz	MEIWETKICLGBRM-AABGKKOBSA-N	0	3	336.479	3.144	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2ccc(C)s2)C1	ZINC001107698339	1367107122	/nfs/dbraw/zinc/10/71/22/1367107122.db2.gz	OOYWPMIOIBJNBD-KBXCAEBGSA-N	0	3	336.501	3.232	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](N(C)Cc2ccc(Cl)cc2C)C1	ZINC001189909067	1367128412	/nfs/dbraw/zinc/12/84/12/1367128412.db2.gz	AKEAKVUOKGKWFT-GOSISDBHSA-N	0	3	332.875	3.485	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@]1(C)CN(CC2CC(C)(C)C2)CCO1	ZINC001107971594	1367224102	/nfs/dbraw/zinc/22/41/02/1367224102.db2.gz	UDISLZXBJIIPEK-HXUWFJFHSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)C2(CC(C)C)CC2)C1	ZINC001107989422	1367231675	/nfs/dbraw/zinc/23/16/75/1367231675.db2.gz	RTXPZRKOTYNXRU-IEBWSBKVSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](N(C)CCOCC2CCC2)C1	ZINC001190353922	1367235987	/nfs/dbraw/zinc/23/59/87/1367235987.db2.gz	DPTAPARZRTYVFR-IBGZPJMESA-N	0	3	334.504	3.104	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3C[C@H]2CC(C)(C)CO2)CCC1	ZINC001109683730	1367280343	/nfs/dbraw/zinc/28/03/43/1367280343.db2.gz	ZKNROXARZIZNNY-BDXSIMOUSA-N	0	3	346.515	3.269	20	30		EGEDHN
C=CCCCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cnoc1CC)C2	ZINC001109773336	1367314601	/nfs/dbraw/zinc/31/46/01/1367314601.db2.gz	PZJKOOWEKZCBRJ-PVAVHDDUSA-N	0	3	331.460	3.319	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2cc[nH]c2CCC)C1	ZINC001108154931	1367314557	/nfs/dbraw/zinc/31/45/57/1367314557.db2.gz	KGELVYKDNTVPMW-OXQOHEQNSA-N	0	3	347.503	3.143	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2ccccc2CC)C1	ZINC001108166309	1367320151	/nfs/dbraw/zinc/32/01/51/1367320151.db2.gz	ZDDZNUOYARXQEO-UTKZUKDTSA-N	0	3	344.499	3.424	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@]2(C)CN(CC(CC)CC)CCO2)CC1	ZINC001108186397	1367329770	/nfs/dbraw/zinc/32/97/70/1367329770.db2.gz	OSTXHFQNLYZJHE-HXUWFJFHSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2cc(C)ccc2F)C1	ZINC001108241588	1367356672	/nfs/dbraw/zinc/35/66/72/1367356672.db2.gz	FGGBIRJTHGGUFU-OXQOHEQNSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCc1ccc(F)cc1F)C2	ZINC001109921334	1367404562	/nfs/dbraw/zinc/40/45/62/1367404562.db2.gz	PKWQKZNVXLOFEA-NJAFHUGGSA-N	0	3	334.410	3.195	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2cc(C)ccc2C)C1	ZINC001108364957	1367414112	/nfs/dbraw/zinc/41/41/12/1367414112.db2.gz	YRQCQFJODVJUSZ-NQIIRXRSSA-N	0	3	344.499	3.479	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCc1c[nH]c3ccccc13)C2	ZINC001110063324	1367489390	/nfs/dbraw/zinc/48/93/90/1367489390.db2.gz	ASOTYZLDIHUCQI-UXPWSPDFSA-N	0	3	337.467	3.398	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](CC)c1ccc(F)cc1)C2	ZINC001110172681	1367543710	/nfs/dbraw/zinc/54/37/10/1367543710.db2.gz	HENDTFMSHZZNPY-XWSJACJDSA-N	0	3	328.431	3.064	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2[C@H](C)c1cccc(C)c1	ZINC001110181926	1367551103	/nfs/dbraw/zinc/55/11/03/1367551103.db2.gz	SLFRPIAHFBKADW-LMCOJAPRSA-N	0	3	342.483	3.370	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccc(C)cc1C	ZINC001110184788	1367553185	/nfs/dbraw/zinc/55/31/85/1367553185.db2.gz	WXPVUCDVMURUNH-LMCOJAPRSA-N	0	3	342.483	3.116	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@H](N(C)CCOc2ccccc2)C1	ZINC001191890697	1367627266	/nfs/dbraw/zinc/62/72/66/1367627266.db2.gz	UEMSCKYMYWLTTI-MSOLQXFVSA-N	0	3	330.472	3.200	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H](N(C)CCc2scnc2C)C1	ZINC001191902929	1367630937	/nfs/dbraw/zinc/63/09/37/1367630937.db2.gz	UDQWRHMNIVUVKW-GOEBONIOSA-N	0	3	335.517	3.129	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](N(C)Cc2cccc(OC)c2C)C1	ZINC001192092772	1367684790	/nfs/dbraw/zinc/68/47/90/1367684790.db2.gz	CMQVWRUYONAFEU-SFHVURJKSA-N	0	3	330.472	3.393	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](N(C)CCOc2cccc(C)c2)C1	ZINC001192095023	1367685693	/nfs/dbraw/zinc/68/56/93/1367685693.db2.gz	YIGBAFBGYICDLR-SFHVURJKSA-N	0	3	330.472	3.263	20	30		EGEDHN
C=CCCCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ncoc1CC)C2	ZINC001110408208	1367697888	/nfs/dbraw/zinc/69/78/88/1367697888.db2.gz	UIRTXOAWOPWCDZ-OAGGEKHMSA-N	0	3	331.460	3.319	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)Nc1ccc(OC(F)F)cc1	ZINC001192205465	1367716606	/nfs/dbraw/zinc/71/66/06/1367716606.db2.gz	YBKLMYDOQXNMAZ-ZDUSSCGKSA-N	0	3	325.359	3.060	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2cc(C(C)(C)C)oc2C)C1	ZINC001192560020	1367816988	/nfs/dbraw/zinc/81/69/88/1367816988.db2.gz	LPYQTQCMRJIKOE-MRXNPFEDSA-N	0	3	348.487	3.234	20	30		EGEDHN
O=C(C#CC1CC1)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1cccc2ccccc21	ZINC001110539575	1367818943	/nfs/dbraw/zinc/81/89/43/1367818943.db2.gz	YWUHURBXZHWMAH-FCEUIQTBSA-N	0	3	344.458	3.475	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1c(C)noc1CCC)C2	ZINC001110550655	1367826448	/nfs/dbraw/zinc/82/64/48/1367826448.db2.gz	YUEGXZOWPPIVNK-OAGGEKHMSA-N	0	3	331.460	3.237	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCOC1CCC1	ZINC001110595558	1367854944	/nfs/dbraw/zinc/85/49/44/1367854944.db2.gz	WCNCNLMMNHCSDJ-QRQLOZEOSA-N	0	3	332.488	3.045	20	30		EGEDHN
C=CC1(CC(=O)N2CC[C@H](N(C)CCOCC3CC3)C2)CCCCC1	ZINC001192826292	1367883231	/nfs/dbraw/zinc/88/32/31/1367883231.db2.gz	PKAUPDZVKABIRP-IBGZPJMESA-N	0	3	348.531	3.472	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3CC2=CCCCC2)CCC1	ZINC001110652521	1367896401	/nfs/dbraw/zinc/89/64/01/1367896401.db2.gz	ILDKQLMIVSFFNC-QRVBRYPASA-N	0	3	326.484	3.402	20	30		EGEDHN
CC[C@H](C)CCC(=O)N1CC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001193018121	1367924499	/nfs/dbraw/zinc/92/44/99/1367924499.db2.gz	RFWGZRPDIAJLHK-LPHOPBHVSA-N	0	3	327.472	3.417	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCc1scnc1C	ZINC001110891987	1368066334	/nfs/dbraw/zinc/06/63/34/1368066334.db2.gz	IKLHYUOTTHERNE-OAGGEKHMSA-N	0	3	347.528	3.318	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)C(C)(C)C2CCCC2)C1	ZINC001193829228	1368124658	/nfs/dbraw/zinc/12/46/58/1368124658.db2.gz	YWKYWYHXGXHPJK-QZTJIDSGSA-N	0	3	336.520	3.111	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1sc(CC)nc1C)C2	ZINC001111141453	1368163117	/nfs/dbraw/zinc/16/31/17/1368163117.db2.gz	YPJAUSOAZQMIIA-KFWWJZLASA-N	0	3	333.501	3.315	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)C[C@H](C)c2ccc(F)cc2)C1	ZINC001194200879	1368207410	/nfs/dbraw/zinc/20/74/10/1368207410.db2.gz	PDEFIALWWBYQRC-QFBILLFUSA-N	0	3	348.462	3.055	20	30		EGEDHN
C=CCCOCC(=O)N1CC[C@@H](N(C)Cc2cc3ccccc3o2)C1	ZINC001194382455	1368249856	/nfs/dbraw/zinc/24/98/56/1368249856.db2.gz	ZYKIQUAGYHKAGT-QGZVFWFLSA-N	0	3	342.439	3.058	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)COc1c(C)cc(C)cc1C)C2	ZINC001111360436	1368273010	/nfs/dbraw/zinc/27/30/10/1368273010.db2.gz	LDLGEHIWVXNJMF-QRVBRYPASA-N	0	3	342.483	3.288	20	30		EGEDHN
CCCCCCCC[C@@H](C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCCO	ZINC001111435620	1368306162	/nfs/dbraw/zinc/30/61/62/1368306162.db2.gz	VTTVEBXJBBZGNI-MKXGPGLRSA-N	0	3	338.536	3.477	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H](CC)CC(C)C)C[C@H](C)O2	ZINC001111552426	1368344039	/nfs/dbraw/zinc/34/40/39/1368344039.db2.gz	DXXBBOFWMZIICY-ROUUACIJSA-N	0	3	336.520	3.327	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CCCN(Cc2ccc(C)cc2C)CC1	ZINC001195174380	1368393518	/nfs/dbraw/zinc/39/35/18/1368393518.db2.gz	MDXPBDCULIYKCZ-IBGZPJMESA-N	0	3	344.499	3.319	20	30		EGEDHN
C=CCCC(=O)N[C@]12CCC[C@H]1CN(Cc1c(C)nsc1C)C2	ZINC001111648573	1368411232	/nfs/dbraw/zinc/41/12/32/1368411232.db2.gz	FFUHPCBLXHWPHL-YJBOKZPZSA-N	0	3	333.501	3.197	20	30		EGEDHN
C=CCOCC(=O)N1CCCN(Cc2cccc3ccccc32)CC1	ZINC001195313739	1368419495	/nfs/dbraw/zinc/41/94/95/1368419495.db2.gz	BSAYPDUASOBZRI-UHFFFAOYSA-N	0	3	338.451	3.077	20	30		EGEDHN
C#CCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1sc(C)nc1C)C2	ZINC001111729893	1368431648	/nfs/dbraw/zinc/43/16/48/1368431648.db2.gz	KFTWFUKICXIPAU-LPHOPBHVSA-N	0	3	345.512	3.034	20	30		EGEDHN
C=CCOCCCC(=O)N1CCCN([C@H](C)c2ccccc2)CC1	ZINC001195443915	1368437538	/nfs/dbraw/zinc/43/75/38/1368437538.db2.gz	LWPJFZUOCITSPT-GOSISDBHSA-N	0	3	330.472	3.265	20	30		EGEDHN
C=CCOCCCC(=O)N1CCCN([C@@H](C)c2ccccc2)CC1	ZINC001195443916	1368437584	/nfs/dbraw/zinc/43/75/84/1368437584.db2.gz	LWPJFZUOCITSPT-SFHVURJKSA-N	0	3	330.472	3.265	20	30		EGEDHN
Cc1cc(F)ccc1CN1C[C@@H]2CCC[C@]2(NC(=O)C#CC2CC2)C1	ZINC001111740883	1368438118	/nfs/dbraw/zinc/43/81/18/1368438118.db2.gz	RZSBSOHXUBNYJC-RXVVDRJESA-N	0	3	340.442	3.018	20	30		EGEDHN
C#CCCCC(=O)N1CCCN(CCCc2cccc(F)c2)CC1	ZINC001195674942	1368470207	/nfs/dbraw/zinc/47/02/07/1368470207.db2.gz	NUESNFUKRVHFNX-UHFFFAOYSA-N	0	3	330.447	3.096	20	30		EGEDHN
CCc1ccc(CCN2CCCN(C(=O)C#CC(C)(C)C)CC2)cc1	ZINC001195780589	1368488410	/nfs/dbraw/zinc/48/84/10/1368488410.db2.gz	GGIGHKXZTKCTPM-UHFFFAOYSA-N	0	3	340.511	3.375	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CCCN(CC[C@H]2CCCC2(F)F)CC1	ZINC001195791580	1368490950	/nfs/dbraw/zinc/49/09/50/1368490950.db2.gz	GBILFLPIAKTDKI-MRXNPFEDSA-N	0	3	340.458	3.396	20	30		EGEDHN
CC(C)[C@H](F)C(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(C#N)cc1)C2	ZINC001111844054	1368498470	/nfs/dbraw/zinc/49/84/70/1368498470.db2.gz	AKPUOHGGOAGRPS-BJLQDIEVSA-N	0	3	343.446	3.023	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)C2(F)CCOCC2)CC1	ZINC001196086239	1368545874	/nfs/dbraw/zinc/54/58/74/1368545874.db2.gz	WNUOQNJPQMSKLL-UHFFFAOYSA-N	0	3	328.472	3.010	20	30		EGEDHN
C#CCC1(C(=O)N2CCCN(C[C@H]3CCC(F)(F)C3)CC2)CCC1	ZINC001196137446	1368556138	/nfs/dbraw/zinc/55/61/38/1368556138.db2.gz	BOBZHVSEDBKTEN-INIZCTEOSA-N	0	3	338.442	3.150	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H](CC)Oc2ccccc2F)C1	ZINC001111941522	1368568254	/nfs/dbraw/zinc/56/82/54/1368568254.db2.gz	WMGUXXJFUHZHPX-VPWXQRGCSA-N	0	3	346.446	3.140	20	30		EGEDHN
C#CC[C@H](CC(=O)N[C@]12CCC[C@H]1CN(CC#CC)C2)c1ccccc1	ZINC001112027014	1368625231	/nfs/dbraw/zinc/62/52/31/1368625231.db2.gz	QPEWDFQUHSINBD-GIWBLDEGSA-N	0	3	348.490	3.178	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)[C@@H](CC)CCCC)C[C@H]1C(F)(F)F	ZINC001112051702	1368636649	/nfs/dbraw/zinc/63/66/49/1368636649.db2.gz	GPQANJGLALRAJA-RRFJBIMHSA-N	0	3	332.410	3.205	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)[C@@H]2OC[C@@H]3CCC[C@@H]32)CC1	ZINC001196575312	1368640740	/nfs/dbraw/zinc/64/07/40/1368640740.db2.gz	WDWDGVOAHACBAE-GBESFXJTSA-N	0	3	336.520	3.306	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)[C@@]2(C)CC=C(C)CC2)C[C@H]1C(F)(F)F	ZINC001112209916	1368719138	/nfs/dbraw/zinc/71/91/38/1368719138.db2.gz	NJOSXVXJMPYOMC-INMHGKMJSA-N	0	3	342.405	3.125	20	30		EGEDHN
C=CCC1(C(=O)N2CCCN(C[C@H](OCC)C3CC3)CC2)CCC1	ZINC001197077763	1368741882	/nfs/dbraw/zinc/74/18/82/1368741882.db2.gz	XHHUSDVQZCFZEW-SFHVURJKSA-N	0	3	334.504	3.082	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)[C@H](C)Oc2cccnc2)CC1	ZINC001197125674	1368749655	/nfs/dbraw/zinc/74/96/55/1368749655.db2.gz	HPEFGAROLLDISU-SFHVURJKSA-N	0	3	347.503	3.354	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cc(C)nn2CC)CC1	ZINC001197236494	1368768625	/nfs/dbraw/zinc/76/86/25/1368768625.db2.gz	KXRUUTSJAVAEAY-UHFFFAOYSA-N	0	3	332.492	3.106	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cnn(CCC)c2)CC1	ZINC001197283230	1368779456	/nfs/dbraw/zinc/77/94/56/1368779456.db2.gz	GPCARGHXHBZMML-UHFFFAOYSA-N	0	3	334.508	3.411	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@@H]2CCC[C@]2(CNC/C(Cl)=C\Cl)C1	ZINC001112347787	1368782613	/nfs/dbraw/zinc/78/26/13/1368782613.db2.gz	APRLTDLRCGEVHM-BZNBUERMSA-N	0	3	343.298	3.183	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2c(C)nn(CC)c2C)CC1	ZINC001197454648	1368817541	/nfs/dbraw/zinc/81/75/41/1368817541.db2.gz	TZAURNPDIUMMKS-UHFFFAOYSA-N	0	3	346.519	3.414	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1)C(=S)Nc1cccc(C#N)c1	ZINC001197675194	1368870721	/nfs/dbraw/zinc/87/07/21/1368870721.db2.gz	LIDFYOZZHUMFEC-UHFFFAOYSA-N	0	3	338.480	3.319	20	30		EGEDHN
C=CC[C@H](C(=O)N1CCCN(CCCCOC)CC1)c1ccccc1	ZINC001198196999	1368978287	/nfs/dbraw/zinc/97/82/87/1368978287.db2.gz	KGLGBJYGEVSOPH-FQEVSTJZSA-N	0	3	344.499	3.307	20	30		EGEDHN
C=C[C@@H](CC(=O)N1CCCN(CCCOCC)CC1)c1ccccc1	ZINC001198214847	1368982882	/nfs/dbraw/zinc/98/28/82/1368982882.db2.gz	VOHSTXKIWZVLGX-IBGZPJMESA-N	0	3	344.499	3.307	20	30		EGEDHN
C=CCCOCC(=O)N1CCCN(Cc2ccccc2C(C)C)CC1	ZINC001198330595	1369010071	/nfs/dbraw/zinc/01/00/71/1369010071.db2.gz	NHCOAJHQBBWLFV-UHFFFAOYSA-N	0	3	344.499	3.437	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2cnc(CC(C)C)s2)CC1	ZINC001198373270	1369018184	/nfs/dbraw/zinc/01/81/84/1369018184.db2.gz	QBLAXFKOPGPLRT-UHFFFAOYSA-N	0	3	335.517	3.456	20	30		EGEDHN
C=CCC[C@@H](C)N[C@H](CNC(=O)C(F)F)c1ccccc1OC	ZINC001198472324	1369040377	/nfs/dbraw/zinc/04/03/77/1369040377.db2.gz	OYKYNKKOQOAKPM-TZMCWYRMSA-N	0	3	326.387	3.062	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)Cc1cccs1)c1ccccc1OC	ZINC001198491254	1369043975	/nfs/dbraw/zinc/04/39/75/1369043975.db2.gz	GWWTWWHSTWFUKK-QGZVFWFLSA-N	0	3	344.480	3.322	20	30		EGEDHN
CCCCCCCN1CCN(C(=O)c2cnc(CC(C)C)[nH]2)CC1	ZINC001112852023	1369047502	/nfs/dbraw/zinc/04/75/02/1369047502.db2.gz	MKMPAKBLILFQMS-UHFFFAOYSA-N	0	3	334.508	3.336	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@@H]1CC=CCC1)c1ccccc1OC	ZINC001198523327	1369052109	/nfs/dbraw/zinc/05/21/09/1369052109.db2.gz	VQCXNSHOZSWHRF-SJLPKXTDSA-N	0	3	328.456	3.375	20	30		EGEDHN
C=CCCCCCN[C@H](CNC(=O)[C@@H](C)OC)c1ccccc1OC	ZINC001198577753	1369065303	/nfs/dbraw/zinc/06/53/03/1369065303.db2.gz	LQPZYUDZYTYMDV-SJLPKXTDSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CCN(CC2CCC(C)CC2)CC1)OCC	ZINC001112906598	1369084119	/nfs/dbraw/zinc/08/41/19/1369084119.db2.gz	JBAIHTHUWJPHIG-CTWPCTMYSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)CO[C@@H](C)CC)c1ccccc1OC	ZINC001198669045	1369087320	/nfs/dbraw/zinc/08/73/20/1369087320.db2.gz	XAHARBWLQHNKAK-FUHWJXTLSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)c1ccncc1C)c1ccccc1OC	ZINC001198714676	1369097586	/nfs/dbraw/zinc/09/75/86/1369097586.db2.gz	ZOXQSCGHFSJGTD-GOSISDBHSA-N	0	3	339.439	3.035	20	30		EGEDHN
C=CCC[C@H](C)N[C@@H](CNC(=O)C#CC(C)C)c1ccccc1OC	ZINC001198714330	1369097786	/nfs/dbraw/zinc/09/77/86/1369097786.db2.gz	XIFLTEYGDPWPHH-HKUYNNGSSA-N	0	3	342.483	3.456	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@]1(C)C[C@H]2C[C@H]2C1)c1ccccc1OC	ZINC001198806507	1369119582	/nfs/dbraw/zinc/11/95/82/1369119582.db2.gz	XJSHNTZGZDILQM-VWFIUDSGSA-N	0	3	342.483	3.454	20	30		EGEDHN
C=CCC[C@H](C)N[C@@H](CNC(=O)c1cnco1)c1ccccc1OC	ZINC001198819527	1369121787	/nfs/dbraw/zinc/12/17/87/1369121787.db2.gz	UJWYQWNOXHUOGR-HOCLYGCPSA-N	0	3	343.427	3.099	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)c1cc(C)co1)c1ccccc1OC	ZINC001198857672	1369132757	/nfs/dbraw/zinc/13/27/57/1369132757.db2.gz	VLTBOKUEHOUDNV-MRXNPFEDSA-N	0	3	328.412	3.233	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@@H](NCCCF)c1ccccc1OC	ZINC001198885162	1369139225	/nfs/dbraw/zinc/13/92/25/1369139225.db2.gz	BLWFUQRLABHCDB-VQIMIIECSA-N	0	3	336.451	3.404	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)c1ccc(Cl)[nH]1)c1ccccc1OC	ZINC001198894112	1369141822	/nfs/dbraw/zinc/14/18/22/1369141822.db2.gz	DEUUWOCURYXDPW-HNNXBMFYSA-N	0	3	347.846	3.314	20	30		EGEDHN
CCCCCCCC[C@@H](C)C(=O)N[C@@H]1CN(CCC2CC2)C[C@H]1O	ZINC001198904651	1369144968	/nfs/dbraw/zinc/14/49/68/1369144968.db2.gz	IXPKJJXXPJJVLS-BHIYHBOVSA-N	0	3	338.536	3.335	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@@H](C)c2ccccc2C)C1	ZINC001198940950	1369153963	/nfs/dbraw/zinc/15/39/63/1369153963.db2.gz	WQTVAJVRLLKJKJ-DFQSSKMNSA-N	0	3	344.499	3.006	20	30		EGEDHN
C=CCCOCC(=O)NC[C@@H](NCCC(C)C)c1ccccc1OC	ZINC001199001509	1369170149	/nfs/dbraw/zinc/17/01/49/1369170149.db2.gz	GEJJXHJNWYTVKX-GOSISDBHSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NC[C@H](NCCC(C)C)c1ccccc1OC	ZINC001199002789	1369170229	/nfs/dbraw/zinc/17/02/29/1369170229.db2.gz	ZYSIAXYXJNNIIB-WMZOPIPTSA-N	0	3	348.487	3.079	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)c2cn(C)c3ccccc23)CC1	ZINC001113076104	1369183575	/nfs/dbraw/zinc/18/35/75/1369183575.db2.gz	PXYFRKUIWZYBJY-MRXNPFEDSA-N	0	3	325.456	3.291	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)Cc2cc(F)c(C)cc2F)CC1	ZINC001113139557	1369224084	/nfs/dbraw/zinc/22/40/84/1369224084.db2.gz	TZTRBYCHRASWOV-OAHLLOKOSA-N	0	3	336.426	3.315	20	30		EGEDHN
CC/C=C(/C)C(=O)N1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001199575906	1369238917	/nfs/dbraw/zinc/23/89/17/1369238917.db2.gz	CBEXMEAMIXTSLS-CPSFFCFKSA-N	0	3	329.419	3.134	20	30		EGEDHN
C=CCCC(=O)N1CCC(NCc2csc(-c3ccco3)n2)CC1	ZINC001199707230	1369258050	/nfs/dbraw/zinc/25/80/50/1369258050.db2.gz	UBCFWGMGDRUSIC-UHFFFAOYSA-N	0	3	345.468	3.450	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)Cc2coc3ccccc23)CC1	ZINC001113455566	1369444174	/nfs/dbraw/zinc/44/41/74/1369444174.db2.gz	OHQDQWCLXJMLOY-MRXNPFEDSA-N	0	3	326.440	3.474	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)CCc2ccc(F)cc2F)CC1	ZINC001113486797	1369461984	/nfs/dbraw/zinc/46/19/84/1369461984.db2.gz	CCIRTPGTUFGOLB-HNNXBMFYSA-N	0	3	336.426	3.396	20	30		EGEDHN
CC#CCNC[C@@H]1CN(C(=O)[C@H](CC)CCCCCC)CCCO1	ZINC001201147372	1369486086	/nfs/dbraw/zinc/48/60/86/1369486086.db2.gz	LWBYSJHXERELFO-RTBURBONSA-N	0	3	336.520	3.213	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)CCOc2ccccc2C)CC1	ZINC001113631799	1369531867	/nfs/dbraw/zinc/53/18/67/1369531867.db2.gz	LWUOTFHSWLUORK-SFHVURJKSA-N	0	3	330.472	3.263	20	30		EGEDHN
CCCCCCCN1CCO[C@@H]2[C@H](COc3ncccn3)CC[C@@H]21	ZINC001201776631	1369621928	/nfs/dbraw/zinc/62/19/28/1369621928.db2.gz	HPOLNODGGLWDCT-OKZBNKHCSA-N	0	3	333.476	3.305	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC(NCc2nc(C)sc2C)CC1	ZINC001202129896	1369694997	/nfs/dbraw/zinc/69/49/97/1369694997.db2.gz	BUYZMCULKZCRQW-HNNXBMFYSA-N	0	3	335.517	3.443	20	30		EGEDHN
CC(C)(C)CCCC(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001114047694	1369701559	/nfs/dbraw/zinc/70/15/59/1369701559.db2.gz	LCEYXJAKKACQAO-RUYXUALKSA-N	0	3	339.483	3.321	20	30		EGEDHN
CC(C)CC(C)(C)C(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001186933872	1388030571	/nfs/dbraw/zinc/03/05/71/1388030571.db2.gz	YPYTYCDWCLXVMM-QGZVFWFLSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C)nc3C)C[C@H]21	ZINC001114319050	1369880907	/nfs/dbraw/zinc/88/09/07/1369880907.db2.gz	IRKOQZLAZMFWAK-PMOLBWCYSA-N	0	3	339.483	3.013	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(OC)cc3)C[C@H]21	ZINC001114320227	1369881419	/nfs/dbraw/zinc/88/14/19/1369881419.db2.gz	SIYYXJVKMINJFI-PMOLBWCYSA-N	0	3	340.467	3.010	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1C[C@H](NCc2cccc(F)c2F)C12CCC2	ZINC001202844976	1369905975	/nfs/dbraw/zinc/90/59/75/1369905975.db2.gz	AULLEUBSUPBHQC-IRXDYDNUSA-N	0	3	346.421	3.285	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1C[C@H](NCc2cc(C)ccc2F)C12CCC2	ZINC001202846011	1369906371	/nfs/dbraw/zinc/90/63/71/1369906371.db2.gz	HGHADEYWMHGUCT-OALUTQOASA-N	0	3	342.458	3.455	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1C[C@H](NCc2cnoc2C)C12CCC2	ZINC001202952647	1369935368	/nfs/dbraw/zinc/93/53/68/1369935368.db2.gz	YFKUGMUYDDTECC-ZWKOTPCHSA-N	0	3	343.471	3.268	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1C[C@@H](NCc2cncs2)C12CCC2	ZINC001202959491	1369936874	/nfs/dbraw/zinc/93/68/74/1369936874.db2.gz	FTBVVEHEWDMBRO-IAGOWNOFSA-N	0	3	345.512	3.429	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1C[C@H](NCc2cncs2)C12CCC2	ZINC001202967572	1369939649	/nfs/dbraw/zinc/93/96/49/1369939649.db2.gz	CHAGZQNNOHMJKR-LSDHHAIUSA-N	0	3	333.501	3.262	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1C[C@@H](NCc2ocnc2C)C12CCC2	ZINC001202969073	1369940600	/nfs/dbraw/zinc/94/06/00/1369940600.db2.gz	NCCLXCHRRZVJEE-CVEARBPZSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1C[C@@H](NCc2cnoc2C)C12CCC2	ZINC001202970738	1369942361	/nfs/dbraw/zinc/94/23/61/1369942361.db2.gz	ZBGJIVLNZWVVSV-HZPDHXFCSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1C[C@@H](NCc2c(C)onc2CC)C12CCC2	ZINC001202987686	1369946479	/nfs/dbraw/zinc/94/64/79/1369946479.db2.gz	OBFCQXAEYUMPTJ-QZTJIDSGSA-N	0	3	345.487	3.419	20	30		EGEDHN
CC(C)C[C@@H](C)C(=O)N1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001203108538	1369986244	/nfs/dbraw/zinc/98/62/44/1369986244.db2.gz	MVLKIEYJTHFLCP-OAHLLOKOSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1[C@H]2CN([C@@H](C)c3cccc(OC)c3)C[C@H]21	ZINC001114672763	1370018895	/nfs/dbraw/zinc/01/88/95/1370018895.db2.gz	UTPJVFIQWYPHLI-WQANXHIZSA-N	0	3	342.483	3.405	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C(F)F)cc3)C[C@H]21	ZINC001114717732	1370043347	/nfs/dbraw/zinc/04/33/47/1370043347.db2.gz	AHLOOQMNABZOGX-DZFIZOCASA-N	0	3	346.421	3.364	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1C[C@@H](NCc2cnc(C)o2)C12CCC2	ZINC001203255649	1370043559	/nfs/dbraw/zinc/04/35/59/1370043559.db2.gz	DHBLYHOWBHYYLF-HZPDHXFCSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1C[C@H](NCc2c(C)onc2CC)C12CCC2	ZINC001203272566	1370053071	/nfs/dbraw/zinc/05/30/71/1370053071.db2.gz	DLVPQEDEVPPCLY-IRXDYDNUSA-N	0	3	345.487	3.275	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1C[C@@H](NCc2c(C)noc2C)C12CCC2	ZINC001203272071	1370053404	/nfs/dbraw/zinc/05/34/04/1370053404.db2.gz	ASMGRLPGTONRPY-HZPDHXFCSA-N	0	3	331.460	3.021	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1[C@H]2CN(CCOc3c(C)cccc3C)C[C@H]21	ZINC001114759484	1370065645	/nfs/dbraw/zinc/06/56/45/1370065645.db2.gz	JOGZLXCAUAUVEO-RUYXUALKSA-N	0	3	342.483	3.085	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2[C@H]3CN(CCc4ccccc4F)C[C@H]32)CCC1	ZINC001114785355	1370078716	/nfs/dbraw/zinc/07/87/16/1370078716.db2.gz	MMHKWCHEHVEEIZ-DZFIZOCASA-N	0	3	342.458	3.161	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1C[C@@H](NCc2oc(CC)nc2C)C12CCC2	ZINC001203338625	1370089053	/nfs/dbraw/zinc/08/90/53/1370089053.db2.gz	CKXXZPJFTZEYLF-SJORKVTESA-N	0	3	345.487	3.419	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1C[C@H](NCc2ncccc2C)C12CCC2	ZINC001203341608	1370089732	/nfs/dbraw/zinc/08/97/32/1370089732.db2.gz	RWPARMSOAYMRJH-ROUUACIJSA-N	0	3	327.472	3.263	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2C[C@@H](NCC#Cc3ccccc3)C23CCC3)C1	ZINC001203375086	1370103964	/nfs/dbraw/zinc/10/39/64/1370103964.db2.gz	OCUZESXVMDFBBV-WOJBJXKFSA-N	0	3	348.490	3.411	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H]2C[C@@H](NCc3ocnc3C)C23CCC3)CC1	ZINC001203375609	1370104959	/nfs/dbraw/zinc/10/49/59/1370104959.db2.gz	RJXVILHQVAJLMM-SJORKVTESA-N	0	3	343.471	3.246	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C)c(OC)c3)C[C@H]21	ZINC001114895500	1370135518	/nfs/dbraw/zinc/13/55/18/1370135518.db2.gz	YMZOWQDHZKEROR-DZFIZOCASA-N	0	3	342.483	3.152	20	30		EGEDHN
C=CCOC(=O)N1CC2(C1)CCN(Cc1ccccc1OCC)CC2	ZINC001203535238	1370159163	/nfs/dbraw/zinc/15/91/63/1370159163.db2.gz	MWSHKDOIOSBQLA-UHFFFAOYSA-N	0	3	344.455	3.306	20	30		EGEDHN
Cc1c[nH]cc1C(=O)N[C@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001203720464	1370234662	/nfs/dbraw/zinc/23/46/62/1370234662.db2.gz	DIGCSWURTZNNAE-PMACEKPBSA-N	0	3	347.462	3.005	20	30		EGEDHN
Cc1ccc2nc(C3CCN(Cc4cccc(C#N)c4)CC3)nn2c1	ZINC001203762015	1370254080	/nfs/dbraw/zinc/25/40/80/1370254080.db2.gz	JQZBTPISLJWEDY-UHFFFAOYSA-N	0	3	331.423	3.289	20	30		EGEDHN
CN1c2ccccc2C2(CCN(Cc3ccc(C#N)cc3)CC2)CC1=O	ZINC001203901311	1370307030	/nfs/dbraw/zinc/30/70/30/1370307030.db2.gz	LHIBSVWQCTZHIK-UHFFFAOYSA-N	0	3	345.446	3.459	20	30		EGEDHN
N#Cc1cccc(N2C[C@@]3(CCN(Cc4ccsc4)C3)CC2=O)c1	ZINC001204037310	1370355834	/nfs/dbraw/zinc/35/58/34/1370355834.db2.gz	GSDUSIWNZSFLJW-IBGZPJMESA-N	0	3	337.448	3.249	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CN(Cc3c[nH]c4ccccc34)C2)CC1	ZINC001204041537	1370357375	/nfs/dbraw/zinc/35/73/75/1370357375.db2.gz	QEXNJEFTGOUYNI-UHFFFAOYSA-N	0	3	339.439	3.388	20	30		EGEDHN
O=C(NCC1(NCC#Cc2ccccc2)CCCCC1)c1cccnc1	ZINC001115383147	1370421471	/nfs/dbraw/zinc/42/14/71/1370421471.db2.gz	YUILXIVXQSRYKG-UHFFFAOYSA-N	0	3	347.462	3.156	20	30		EGEDHN
C[C@@H]1C[C@@H]1C(=O)NCC1(NCc2cc(C#N)ccc2F)CCCCC1	ZINC001115389322	1370426350	/nfs/dbraw/zinc/42/63/50/1370426350.db2.gz	OGAPIMCMAWTVCF-PBHICJAKSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=CCOc1ccc(CN2CCC(NC(=O)N(CC)CC)CC2)cc1	ZINC001204302684	1370437159	/nfs/dbraw/zinc/43/71/59/1370437159.db2.gz	QEGYYQWYZXLGRX-UHFFFAOYSA-N	0	3	345.487	3.267	20	30		EGEDHN
CCCCCCCCOc1ccc(CN2C[C@H](CO)[C@H](O)C2)cc1	ZINC001204311966	1370440100	/nfs/dbraw/zinc/44/01/00/1370440100.db2.gz	NAFXEBDNUGRXTE-UYAOXDASSA-N	0	3	335.488	3.211	20	30		EGEDHN
Cc1cc(CN2CC[C@@]3(CC(=O)N(c4cccc(C#N)c4)C3)C2)oc1C	ZINC001204532426	1370507651	/nfs/dbraw/zinc/50/76/51/1370507651.db2.gz	YKZDAXKOJWNFBA-OAQYLSRUSA-N	0	3	349.434	3.397	20	30		EGEDHN
O=C1C=C2CN(Cc3cc(F)ccc3Br)CCC2S1	ZINC001204539471	1370509994	/nfs/dbraw/zinc/50/99/94/1370509994.db2.gz	NNQYXSHNFXIMAI-CYBMUJFWSA-N	0	3	342.233	3.362	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H]2CN(CC[C@@H]3CC3(Cl)Cl)C[C@H]21	ZINC001187239407	1388078939	/nfs/dbraw/zinc/07/89/39/1388078939.db2.gz	BDHNBBFQCVCLMJ-BFHYXJOUSA-N	0	3	331.287	3.069	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccn(C(F)F)n2)CCCCC1	ZINC001115555416	1370553016	/nfs/dbraw/zinc/55/30/16/1370553016.db2.gz	AGXIBCDGPFYOCD-UHFFFAOYSA-N	0	3	346.809	3.053	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccnn2CCC)CCCCC1	ZINC001115556863	1370554918	/nfs/dbraw/zinc/55/49/18/1370554918.db2.gz	GIUXKXGZWRNLIJ-UHFFFAOYSA-N	0	3	338.883	3.068	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CCc2ccccn2)CCCCC1	ZINC001115660377	1370644695	/nfs/dbraw/zinc/64/46/95/1370644695.db2.gz	NNSSZKHRNSJELT-UHFFFAOYSA-N	0	3	335.879	3.175	20	30		EGEDHN
C=CCCN1C[C@@H](O)[C@H](N(Cc2ccccc2)C(=O)CC(C)(C)C)C1	ZINC001205085714	1370646479	/nfs/dbraw/zinc/64/64/79/1370646479.db2.gz	VBAFXSQWCWYRJJ-RTBURBONSA-N	0	3	344.499	3.073	20	30		EGEDHN
C=CC(C)(C)C(=O)NCC1(NCc2conc2CC)CCCCC1	ZINC001115666928	1370647872	/nfs/dbraw/zinc/64/78/72/1370647872.db2.gz	CQJJNOIKQRHBSG-UHFFFAOYSA-N	0	3	333.476	3.358	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)C[C@@H]2CC[C@@H](C)O2)CCCCC1	ZINC001115709925	1370688849	/nfs/dbraw/zinc/68/88/49/1370688849.db2.gz	WALDWGDIBWOWKD-CABCVRRESA-N	0	3	328.884	3.105	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2ccco2)CC[C@H]1c1ccc(F)cc1	ZINC001205238984	1370691279	/nfs/dbraw/zinc/69/12/79/1370691279.db2.gz	SUJJDWBHSNBWFG-ZWKOTPCHSA-N	0	3	340.398	3.030	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C=C2CCC2)CC[C@H]1c1ccc(F)cc1	ZINC001205269746	1370700985	/nfs/dbraw/zinc/70/09/85/1370700985.db2.gz	CZSZPPBAFYVKJY-VQTJNVASSA-N	0	3	340.442	3.233	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@@H](c2cccc(F)c2)[C@H](NCC#CC)C1	ZINC001205428469	1370752455	/nfs/dbraw/zinc/75/24/55/1370752455.db2.gz	BIJTZFPCUBFBIX-LSTHTHJFSA-N	0	3	342.458	3.335	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2c[nH]nc2C2CC2)CCCCC1	ZINC001115802845	1370786070	/nfs/dbraw/zinc/78/60/70/1370786070.db2.gz	PXNLHPOLZJDXJD-UHFFFAOYSA-N	0	3	336.867	3.062	20	30		EGEDHN
CC#CCCCC(=O)N1CCC(CNCc2cc(C3CC3)no2)CC1	ZINC001205970218	1370925088	/nfs/dbraw/zinc/92/50/88/1370925088.db2.gz	NABDXVAPMWCSTP-UHFFFAOYSA-N	0	3	343.471	3.074	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(CNCc3nccs3)CC2)CCC1	ZINC001206181810	1370984059	/nfs/dbraw/zinc/98/40/59/1370984059.db2.gz	SXBPBIXZLCYQEC-UHFFFAOYSA-N	0	3	333.501	3.218	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC(CN[C@H](C)c2cnc(C)cn2)CC1	ZINC001206427629	1371051556	/nfs/dbraw/zinc/05/15/56/1371051556.db2.gz	JGQLDHFFCRFVGM-MRXNPFEDSA-N	0	3	344.503	3.277	20	30		EGEDHN
C=CCOCCCC(=O)N1CC[C@H]2CN(Cc3csc(C)c3)C[C@H]21	ZINC001187473217	1388114233	/nfs/dbraw/zinc/11/42/33/1388114233.db2.gz	VYNYRGVPTNXCBH-ZWKOTPCHSA-N	0	3	348.512	3.072	20	30		EGEDHN
O=C1C=C2CN(Cc3cc(-c4ccc(F)cc4)on3)CCC2S1	ZINC001206831271	1371182327	/nfs/dbraw/zinc/18/23/27/1371182327.db2.gz	HBULMDFQWBOVSN-INIZCTEOSA-N	0	3	330.384	3.255	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CN(CCOc2ccccc2C)C[C@H]1C	ZINC001206887127	1371208080	/nfs/dbraw/zinc/20/80/80/1371208080.db2.gz	XPCWBIDORWADFI-RTBURBONSA-N	0	3	342.483	3.004	20	30		EGEDHN
Cc1cc(CN2C[C@@H](C)[C@H](NC(=O)C#CC(C)(C)C)C2)c(C)s1	ZINC001206949369	1371240472	/nfs/dbraw/zinc/24/04/72/1371240472.db2.gz	AXCSSUBBIJOYFJ-CXAGYDPISA-N	0	3	332.513	3.351	20	30		EGEDHN
O=C(C1CCC1)N1CCC[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001207011889	1371267067	/nfs/dbraw/zinc/26/70/67/1371267067.db2.gz	CIOABCQEVHBOKY-KRWDZBQOSA-N	0	3	330.859	3.072	20	30		EGEDHN
C=CCN(CCN1CCC2(C[C@H](F)CO2)CC1)C(=O)OC(C)(C)C	ZINC001207203690	1371328405	/nfs/dbraw/zinc/32/84/05/1371328405.db2.gz	NQIXYTHPLDSABS-HNNXBMFYSA-N	0	3	342.455	3.003	20	30		EGEDHN
CC(C)CCC(=O)N1CCC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001207222139	1371333824	/nfs/dbraw/zinc/33/38/24/1371333824.db2.gz	NLAPTCLURBLNQN-KRWDZBQOSA-N	0	3	331.435	3.214	20	30		EGEDHN
O=C(CCC1CC1)N1CCC[C@@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207704633	1371479320	/nfs/dbraw/zinc/47/93/20/1371479320.db2.gz	GAJVUDWJUSLFEW-LJQANCHMSA-N	0	3	344.886	3.462	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N1CCC[C@@H](NCC#Cc2ccccc2Cl)C1	ZINC001207820046	1371512481	/nfs/dbraw/zinc/51/24/81/1371512481.db2.gz	OJTPMLMKTKFANE-IAGOWNOFSA-N	0	3	344.886	3.318	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H]2COc3ccccc32)CCCCC1	ZINC001120255110	1371516084	/nfs/dbraw/zinc/51/60/84/1371516084.db2.gz	VVBKASOMYGXVLL-MRXNPFEDSA-N	0	3	348.874	3.324	20	30		EGEDHN
C#CCCCCC(=O)N1CCC[C@@H](NCc2cc(C)ccc2F)C1	ZINC001207863211	1371523237	/nfs/dbraw/zinc/52/32/37/1371523237.db2.gz	IZTKKIYDOFLHPD-GOSISDBHSA-N	0	3	330.447	3.408	20	30		EGEDHN
C=CCOCc1nn(C)c2c1CN(CCCc1ccc(C)o1)CC2	ZINC001207945246	1371546429	/nfs/dbraw/zinc/54/64/29/1371546429.db2.gz	SJGLCZRVDOXKMR-UHFFFAOYSA-N	0	3	329.444	3.015	20	30		EGEDHN
C=CCCOCCCCC(=O)N1CCC[C@@H](NC[C@@H](F)CC)C1	ZINC001208032707	1371574835	/nfs/dbraw/zinc/57/48/35/1371574835.db2.gz	XBWVEBQMAIWGJZ-DLBZAZTESA-N	0	3	328.472	3.078	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H]2CN(CCOC3CCCCCC3)C[C@H]21	ZINC001187706737	1388146662	/nfs/dbraw/zinc/14/66/62/1388146662.db2.gz	RCBHVUUZEVNNBJ-AZUAARDMSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=C(C)[C@@H]1CC=C(CN2CCCC[C@@H]2C(=O)N2CCOCC2)CC1	ZINC001208177572	1371620403	/nfs/dbraw/zinc/62/04/03/1371620403.db2.gz	VBMRDERTZKIYOQ-RTBURBONSA-N	0	3	332.488	3.002	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001208239533	1371672512	/nfs/dbraw/zinc/67/25/12/1371672512.db2.gz	BZQFWADIEKVVIF-LJQANCHMSA-N	0	3	342.458	3.360	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC[C@H](NCc2cc(C#N)ccc2OC)C1	ZINC001208256073	1371686110	/nfs/dbraw/zinc/68/61/10/1371686110.db2.gz	YBZFGQGUKIIZLK-SFHVURJKSA-N	0	3	341.455	3.004	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CN(Cc2ccc3c(c2)CCC3)C[C@H]1C	ZINC001208371096	1371739948	/nfs/dbraw/zinc/73/99/48/1371739948.db2.gz	FLDWXYFNUOHKJI-DYESRHJHSA-N	0	3	338.495	3.305	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CN([C@@H]2CCc3ccc(F)cc32)C[C@H]1C	ZINC001208374437	1371741306	/nfs/dbraw/zinc/74/13/06/1371741306.db2.gz	JIEKRHBEJBASSS-CDHQVMDDSA-N	0	3	342.458	3.443	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2CN(CCOc3ccccc3)C[C@H]2C)CC1	ZINC001208515623	1371796411	/nfs/dbraw/zinc/79/64/11/1371796411.db2.gz	WVGLTFCVACSPFD-IEBWSBKVSA-N	0	3	342.483	3.248	20	30		EGEDHN
CC1(CC(=O)N2CCC[C@H](NCC#Cc3cccc(Cl)c3)C2)CC1	ZINC001208594140	1371832825	/nfs/dbraw/zinc/83/28/25/1371832825.db2.gz	DOJGMSDSTKIROP-SFHVURJKSA-N	0	3	344.886	3.462	20	30		EGEDHN
C[C@@H]1CCN(CCCc2cccc(C#N)c2)C[C@@]1(O)C(F)(F)F	ZINC001208845023	1371915450	/nfs/dbraw/zinc/91/54/50/1371915450.db2.gz	NWWVEWSMNBDTMI-CJNGLKHVSA-N	0	3	326.362	3.126	20	30		EGEDHN
CCOC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1CCCc1cccc(C#N)c1	ZINC001208850887	1371918228	/nfs/dbraw/zinc/91/82/28/1371918228.db2.gz	MWGJYOMMABOYKM-FHWLQOOXSA-N	0	3	326.440	3.154	20	30		EGEDHN
N#Cc1ccc(CCCN2CCN(Cc3cccc(F)c3)CC2)cc1	ZINC001208857478	1371921192	/nfs/dbraw/zinc/92/11/92/1371921192.db2.gz	FUXBRXNPSALDPM-UHFFFAOYSA-N	0	3	337.442	3.448	20	30		EGEDHN
N#Cc1ccc(CCCN2CCN(c3ccc(Cl)cn3)CC2)cc1	ZINC001208863172	1371923718	/nfs/dbraw/zinc/92/37/18/1371923718.db2.gz	ZSNIZEVTQCNNJE-UHFFFAOYSA-N	0	3	340.858	3.361	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CC2(CC(NCc3oc(C)nc3C)C2)C1	ZINC001121534278	1372002201	/nfs/dbraw/zinc/00/22/01/1372002201.db2.gz	BVZSONDROHIJAW-UHFFFAOYSA-N	0	3	331.460	3.021	20	30		EGEDHN
CC#CCCCC(=O)NC1CC2(CC(NCc3ccccc3C#N)C2)C1	ZINC001121580209	1372015747	/nfs/dbraw/zinc/01/57/47/1372015747.db2.gz	HJOJMJFDMMELIC-UHFFFAOYSA-N	0	3	349.478	3.269	20	30		EGEDHN
C=C(Br)CNC1CC2(C1)CC(NC(=O)C(C)(C)CC)C2	ZINC001121667350	1372039957	/nfs/dbraw/zinc/03/99/57/1372039957.db2.gz	FQXCRUKCNBGNKV-UHFFFAOYSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC1CC2(CC(NCc3cnoc3C)C2)C1	ZINC001121616402	1372026367	/nfs/dbraw/zinc/02/63/67/1372026367.db2.gz	JONFWIQPHWXFTI-HKYFHIHASA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC1CC2(C1)CC(N[C@H](C)c1cnccn1)C2	ZINC001121616612	1372026678	/nfs/dbraw/zinc/02/66/78/1372026678.db2.gz	MUWBGOMOZFGTAM-IKJBTNJWSA-N	0	3	342.487	3.157	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC1CC2(CC(NCc3conc3CC)C2)C1	ZINC001121617122	1372027051	/nfs/dbraw/zinc/02/70/51/1372027051.db2.gz	SAIRZHMDUWATND-YADNIXQGSA-N	0	3	345.487	3.356	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC[C@H](NCc2c(C)nsc2C)C1	ZINC001209193075	1372033410	/nfs/dbraw/zinc/03/34/10/1372033410.db2.gz	GGCIXJCDFCJURR-CVEARBPZSA-N	0	3	335.517	3.443	20	30		EGEDHN
C=CCCCCN1Cc2cncn2C[C@@H](COc2ccccn2)C1	ZINC001209202526	1372035524	/nfs/dbraw/zinc/03/55/24/1372035524.db2.gz	KEUSAVGMRNUDPB-KRWDZBQOSA-N	0	3	326.444	3.145	20	30		EGEDHN
O=C(c1cc[nH]c1C1CC1)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001209269531	1372055867	/nfs/dbraw/zinc/05/58/67/1372055867.db2.gz	JAQFBUDDKQCHMW-LJQANCHMSA-N	0	3	347.462	3.138	20	30		EGEDHN
CC(C)[C@H](C)C(=O)NC1CC2(CC(NCc3ccccc3C#N)C2)C1	ZINC001121860769	1372105605	/nfs/dbraw/zinc/10/56/05/1372105605.db2.gz	ORBUCVMBBYDVNW-GUQFABJKSA-N	0	3	339.483	3.367	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1)c1ccco1	ZINC001209601765	1372148571	/nfs/dbraw/zinc/14/85/71/1372148571.db2.gz	PVGVCBMYKMBZOM-PKOBYXMFSA-N	0	3	336.435	3.015	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)COc1ccccc1C)C2	ZINC001122140864	1372185399	/nfs/dbraw/zinc/18/53/99/1372185399.db2.gz	LJRDHVHEZPMOIH-UHFFFAOYSA-N	0	3	348.874	3.143	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N[C@@H]1C[C@@H](c2ccccc2)Oc2ccccc21	ZINC001122227957	1372206366	/nfs/dbraw/zinc/20/63/66/1372206366.db2.gz	STCMDQMMORZXCL-GGPKGHCWSA-N	0	3	349.434	3.389	20	30		EGEDHN
CN1C(=O)CCC[C@H]1C(=O)C(C#N)c1nc2cc(Cl)ccc2s1	ZINC001122474087	1372254681	/nfs/dbraw/zinc/25/46/81/1372254681.db2.gz	HMKVRNQCOWSWIB-JQWIXIFHSA-N	0	3	347.827	3.137	20	30		EGEDHN
C=C(C)Cn1c(-c2ccco2)nnc1N1CCN([C@H](C)CC)CC1	ZINC001122509797	1372262769	/nfs/dbraw/zinc/26/27/69/1372262769.db2.gz	IBKBWYWTEMAHQN-OAHLLOKOSA-N	0	3	329.448	3.035	20	30		EGEDHN
C=C(C)Cn1c([C@H](C)CCC#N)nnc1N1CCN([C@H](C)CC)CC1	ZINC001122530219	1372267837	/nfs/dbraw/zinc/26/78/37/1372267837.db2.gz	CNAXBJCLMAZFKB-IAGOWNOFSA-N	0	3	344.507	3.182	20	30		EGEDHN
N#CC(C(=O)c1c[nH]nc1-c1c(F)cccc1F)c1cccc(F)n1	ZINC001122721123	1372306336	/nfs/dbraw/zinc/30/63/36/1372306336.db2.gz	RCDWPFCTOVDYIM-SECBINFHSA-N	0	3	342.280	3.379	20	30		EGEDHN
CCCCCCCCC(=O)N[C@@H]1CN(CCn2cccn2)C[C@H]1C	ZINC001210547755	1372376159	/nfs/dbraw/zinc/37/61/59/1372376159.db2.gz	WJKSECZCCMVPNP-QZTJIDSGSA-N	0	3	334.508	3.070	20	30		EGEDHN
F[C@@H]1CNCCN(Cc2ccc(C(F)(F)F)cc2C(F)(F)F)C1	ZINC001210580106	1372383970	/nfs/dbraw/zinc/38/39/70/1372383970.db2.gz	FEWRRRFNDOGZKI-LLVKDONJSA-N	0	3	344.274	3.468	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCC(C)(C)NC(=O)OC(C)(C)C	ZINC001123236912	1372403910	/nfs/dbraw/zinc/40/39/10/1372403910.db2.gz	IHWYMPDMBYOAQC-ZDUSSCGKSA-N	0	3	348.447	3.163	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1)c1ccccc1	ZINC001210698696	1372409605	/nfs/dbraw/zinc/40/96/05/1372409605.db2.gz	QZAYVUVBBBPNNS-UGKGYDQZSA-N	0	3	346.474	3.422	20	30		EGEDHN
CCCCCCCCC(=O)N1CCC[C@@H](NCc2ccnn2C)C1	ZINC001210804632	1372429910	/nfs/dbraw/zinc/42/99/10/1372429910.db2.gz	KPNUDKASQLWOKS-QGZVFWFLSA-N	0	3	334.508	3.251	20	30		EGEDHN
CCc1ccc(C(=O)N2CCC[C@H](NCC#Cc3ccccc3)C2)cc1	ZINC001210913495	1372452439	/nfs/dbraw/zinc/45/24/39/1372452439.db2.gz	PJMCVBAVWHHGPD-QFIPXVFZSA-N	0	3	346.474	3.495	20	30		EGEDHN
C=CC[C@@H](C(=O)N[C@@H]1CN(CCOC(C)C)C[C@H]1C)c1ccccc1	ZINC001211200241	1372499858	/nfs/dbraw/zinc/49/98/58/1372499858.db2.gz	PZYJAKXCHZFLFZ-MISYRCLQSA-N	0	3	344.499	3.208	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)C/C=C\c2ccc(C)cc2)C1	ZINC001211506792	1372569859	/nfs/dbraw/zinc/56/98/59/1372569859.db2.gz	ZRUWNNBVPPKDEY-WYTZPYIFSA-N	0	3	342.483	3.037	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2ccoc2CC)[C@H](OC)C1	ZINC001212196239	1372669645	/nfs/dbraw/zinc/66/96/45/1372669645.db2.gz	PCSMWNIUGHZVJU-SJLPKXTDSA-N	0	3	334.460	3.017	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2cccc(Cl)c2C)[C@H](OC)C1	ZINC001212304411	1372683859	/nfs/dbraw/zinc/68/38/59/1372683859.db2.gz	XBDZEQSXRJCAMQ-IAGOWNOFSA-N	0	3	336.863	3.044	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN(Cc2ccccc2C(C)C)C[C@H]1OC	ZINC001212349488	1372692065	/nfs/dbraw/zinc/69/20/65/1372692065.db2.gz	YILZZONBBVMSGL-WOJBJXKFSA-N	0	3	344.499	3.482	20	30		EGEDHN
C=C[C@@H](CC(=O)N1CC[C@@H](NCc2cncs2)C1)c1ccccc1	ZINC001188040529	1388224891	/nfs/dbraw/zinc/22/48/91/1388224891.db2.gz	QVZHVQVVPAEKAR-DOTOQJQBSA-N	0	3	341.480	3.194	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2cc(C)cc(Cl)c2)[C@H](OC)C1	ZINC001213164498	1372851726	/nfs/dbraw/zinc/85/17/26/1372851726.db2.gz	WQDMJQJFTSAPRC-IAGOWNOFSA-N	0	3	336.863	3.044	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2cc(C)ccc2C2CC2)[C@H](OC)C1	ZINC001213204516	1372858857	/nfs/dbraw/zinc/85/88/57/1372858857.db2.gz	NTMNSDUSCMJVFN-WOJBJXKFSA-N	0	3	342.483	3.268	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2occ3c2CCC3)[C@H](OC)C1	ZINC001213219334	1372863116	/nfs/dbraw/zinc/86/31/16/1372863116.db2.gz	NLIPQVRGUPTQIM-QZTJIDSGSA-N	0	3	348.487	3.168	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@H]2CCCC2(C)C)[C@H](OC)C1	ZINC001213290715	1372876911	/nfs/dbraw/zinc/87/69/11/1372876911.db2.gz	YLHZIOZILLOVFS-KZNAEPCWSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1CN(Cc2c(C)cccc2C)C[C@H]1OC	ZINC001213389669	1372899122	/nfs/dbraw/zinc/89/91/22/1372899122.db2.gz	DIFUTZYVOOBHQR-SFHLNBCPSA-N	0	3	344.499	3.221	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2ccc(Cl)[nH]2)[C@H](OC)C1	ZINC001213400010	1372900783	/nfs/dbraw/zinc/90/07/83/1372900783.db2.gz	VYUCLYKFWKRTEV-HUUCEWRRSA-N	0	3	341.883	3.068	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2cc(C(C)(C)C)oc2C)[C@H](OC)C1	ZINC001213494303	1372913847	/nfs/dbraw/zinc/91/38/47/1372913847.db2.gz	WXCLGBYJWNIQNP-IAGOWNOFSA-N	0	3	348.487	3.281	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H]2CN(Cc3ccc(OC)cc3)C[C@H]21	ZINC001188057326	1388230832	/nfs/dbraw/zinc/23/08/32/1388230832.db2.gz	YFWRHRRMNSBGGP-PKOBYXMFSA-N	0	3	342.483	3.330	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)[C@@H](C)CC2CCCCC2)[C@H](OC)C1	ZINC001213524897	1372918692	/nfs/dbraw/zinc/91/86/92/1372918692.db2.gz	PQZCBWCOACHBEI-QXAKKESOSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2cccc3ccsc32)[C@H](OC)C1	ZINC001213669775	1372942997	/nfs/dbraw/zinc/94/29/97/1372942997.db2.gz	RBCORXHYRBCBPC-IAGOWNOFSA-N	0	3	344.480	3.297	20	30		EGEDHN
N#CC[C@@H](C(=O)NC[C@@H]1CCCN1Cc1ccccc1)c1ccccc1	ZINC001126213444	1372949237	/nfs/dbraw/zinc/94/92/37/1372949237.db2.gz	BWAUOZHIDJVVSA-LEWJYISDSA-N	0	3	347.462	3.465	20	30		EGEDHN
CC/C=C(\C)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001214254679	1373031343	/nfs/dbraw/zinc/03/13/43/1373031343.db2.gz	DLJBPVHRJVJYRE-CGPNCGHOSA-N	0	3	344.886	3.484	20	30		EGEDHN
C=CCOCC(=O)N1C[C@@H](C)[C@H](N[C@@H](C)c2ccccc2Cl)C1	ZINC001214329841	1373045060	/nfs/dbraw/zinc/04/50/60/1373045060.db2.gz	MLEOELJSWGVHID-JKIFEVAISA-N	0	3	336.863	3.040	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001214363787	1373049390	/nfs/dbraw/zinc/04/93/90/1373049390.db2.gz	BBUBGQHMNVIOCI-HBUWYVDXSA-N	0	3	331.435	3.070	20	30		EGEDHN
C[C@@H]1CN(C(=O)/C=C\C2CC2)C[C@H]1NCC#Cc1ccc(Cl)cc1	ZINC001214393904	1373053634	/nfs/dbraw/zinc/05/36/34/1373053634.db2.gz	GBSHOEMWTYUCJT-NGFANLLESA-N	0	3	342.870	3.094	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2CCC2)C[C@H]1NCC#Cc1ccccc1Cl	ZINC001214391855	1373053662	/nfs/dbraw/zinc/05/36/62/1373053662.db2.gz	YDEKOLQOLFNHKM-DNVCBOLYSA-N	0	3	344.886	3.318	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H]2CN(CCOc3cccc(F)c3)C[C@H]21	ZINC001188087690	1388239911	/nfs/dbraw/zinc/23/99/11/1388239911.db2.gz	XCYNASVNBUCLJG-QFBILLFUSA-N	0	3	346.446	3.094	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccoc2Cl)C[C@H]1NCC#Cc1ccccc1	ZINC001214514112	1373072517	/nfs/dbraw/zinc/07/25/17/1373072517.db2.gz	OEVMCPISJMCRIO-RHSMWYFYSA-N	0	3	342.826	3.035	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1C[C@@H](C)[C@H](NCc2ccccc2F)C1)OCC	ZINC001214752198	1373114821	/nfs/dbraw/zinc/11/48/21/1373114821.db2.gz	APDDKYNITJBRDS-LZQZEXGQSA-N	0	3	348.462	3.134	20	30		EGEDHN
C#CCC1(C(=O)N2C[C@@H](C)[C@H](NCc3ccccc3Cl)C2)CCC1	ZINC001214830153	1373126807	/nfs/dbraw/zinc/12/68/07/1373126807.db2.gz	SRUFIBHSTBUZQR-CRAIPNDOSA-N	0	3	344.886	3.470	20	30		EGEDHN
CC(C)C[C@H](C)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2)C1	ZINC001216099796	1373263142	/nfs/dbraw/zinc/26/31/42/1373263142.db2.gz	ZULXWQCETNGEBS-NLWGTHIKSA-N	0	3	326.484	3.157	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)C(CC)CC)[C@@H](n2ccnn2)C1	ZINC001128740915	1373307103	/nfs/dbraw/zinc/30/71/03/1373307103.db2.gz	KRMWZWXSJBKIRF-MSOLQXFVSA-N	0	3	349.523	3.026	20	30		EGEDHN
CC(C)Cc1ccc(C(=O)NCCNCc2ccc(C#N)s2)s1	ZINC001129625211	1373404535	/nfs/dbraw/zinc/40/45/35/1373404535.db2.gz	XPXALRMSVWVOOE-UHFFFAOYSA-N	0	3	347.509	3.399	20	30		EGEDHN
CC1(C(=O)NCCNCc2ccc(C#N)c(F)c2)CCCCCC1	ZINC001129647394	1373407592	/nfs/dbraw/zinc/40/75/92/1373407592.db2.gz	KAIXUGOXFOVSJH-UHFFFAOYSA-N	0	3	331.435	3.264	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)C/C=C\c2cccc(F)c2)c1	ZINC001129731929	1373417603	/nfs/dbraw/zinc/41/76/03/1373417603.db2.gz	PQGDXJLMXCWMMK-HYXAFXHYSA-N	0	3	337.398	3.007	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)C/C=C\c2ccc(F)cc2)cc1	ZINC001130171511	1373470045	/nfs/dbraw/zinc/47/00/45/1373470045.db2.gz	RWGLGKFHLHUJAL-UPHRSURJSA-N	0	3	337.398	3.007	20	30		EGEDHN
CC1(C)[NH2+][C@H](CO[C@@H](/C(=N\[O-])c2ccccc2)c2ccccc2)CO1	ZINC001217841624	1373506785	/nfs/dbraw/zinc/50/67/85/1373506785.db2.gz	UDFJWCDREUUFHT-HVJPKQBMSA-N	0	3	340.423	3.347	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)[C@@H](C)CC2CCCC2)C1	ZINC001130430971	1373536053	/nfs/dbraw/zinc/53/60/53/1373536053.db2.gz	NLTRCCVXMAIETB-RDJZCZTQSA-N	0	3	344.503	3.218	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)C[C@@H](C)CC(C)C)C1	ZINC001130442185	1373541598	/nfs/dbraw/zinc/54/15/98/1373541598.db2.gz	HVVJNNICUGOQSZ-HOTGVXAUSA-N	0	3	332.492	3.074	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)C[C@@H](C)C(C)(C)C)C1	ZINC001130442888	1373541911	/nfs/dbraw/zinc/54/19/11/1373541911.db2.gz	PGSYPKXOXXVTBE-HUUCEWRRSA-N	0	3	332.492	3.074	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)C[C@H](C)CCCCC)C[C@H]1c1cn(C)cn1	ZINC001130687560	1373580459	/nfs/dbraw/zinc/58/04/59/1373580459.db2.gz	GAEBPGSYKLLXPL-ZIFCJYIRSA-N	0	3	346.519	3.097	20	30		EGEDHN
C=C(C)[C@@H]1CC[C@H](C)C[C@@H]1Oc1ccnc2c3c(nn21)CCNC3	ZINC001218358319	1373602630	/nfs/dbraw/zinc/60/26/30/1373602630.db2.gz	WAVJMMHROMIGMI-ZQIUZPCESA-N	0	3	326.444	3.135	20	30		EGEDHN
C=C(C)[C@@H]1CC[C@H](C)C[C@H]1Oc1ccnc2c3c(nn21)CCNC3	ZINC001218358316	1373602951	/nfs/dbraw/zinc/60/29/51/1373602951.db2.gz	WAVJMMHROMIGMI-GRDNDAEWSA-N	0	3	326.444	3.135	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)[C@@H]2CCC[C@@H]2c2ccccc2)cc1	ZINC001131157247	1373654693	/nfs/dbraw/zinc/65/46/93/1373654693.db2.gz	SVJRLPHZVOIMBN-NHCUHLMSSA-N	0	3	347.462	3.348	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)c3cccc(C(C)C)c3)[C@H]2C1	ZINC001218892720	1373664812	/nfs/dbraw/zinc/66/48/12/1373664812.db2.gz	FLEGJHGULALCED-VQTJNVASSA-N	0	3	342.483	3.301	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)n1c(=N)sc2cc(N)cc(C)c21	ZINC001218954412	1373670418	/nfs/dbraw/zinc/67/04/18/1373670418.db2.gz	MAVUMQUDXJCABW-ZDUSSCGKSA-N	0	3	332.473	3.177	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2OCCN(C(=O)c3cc(C)c(CC)o3)[C@H]2C1	ZINC001218952366	1373670696	/nfs/dbraw/zinc/67/06/96/1373670696.db2.gz	PESFPKKQMALFKS-JTDSTZFVSA-N	0	3	346.471	3.030	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCO[C@H]1C1CCN(C(=O)[C@H](C)CCC)CC1	ZINC001131456423	1373701440	/nfs/dbraw/zinc/70/14/40/1373701440.db2.gz	PGYMIJFWRVOILB-XYPHTWIQSA-N	0	3	342.911	3.161	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1CN([C@H](CC)c2ccccc2)C[C@@H]1O	ZINC001219686840	1373725436	/nfs/dbraw/zinc/72/54/36/1373725436.db2.gz	WQCBHSWAACKQQG-AQNXPRMDSA-N	0	3	342.483	3.067	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)CN(C(=O)CCCCC(C)(C)C)C[C@@H](C)O2	ZINC001131661114	1373749164	/nfs/dbraw/zinc/74/91/64/1373749164.db2.gz	JPUGNHUYNNWZFT-WIYYLYMNSA-N	0	3	348.531	3.308	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C1(CC(C)C)CCC1)C[C@H](C)O2	ZINC001131669870	1373753964	/nfs/dbraw/zinc/75/39/64/1373753964.db2.gz	VMLCRPZTXXTYAU-RXVVDRJESA-N	0	3	348.531	3.471	20	30		EGEDHN
CCCCCCCOc1ccc(CN2CCOC3(CNC3)C2)cc1	ZINC001222446980	1373848596	/nfs/dbraw/zinc/84/85/96/1373848596.db2.gz	HJSVMYFRGHPOMK-UHFFFAOYSA-N	0	3	332.488	3.210	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](NCc3cncc(C)c3)C2)CCCC1	ZINC001188489590	1388317283	/nfs/dbraw/zinc/31/72/83/1388317283.db2.gz	BAHIEHUYFGKBCV-GOSISDBHSA-N	0	3	327.472	3.217	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@@H](C)N(CCc2ccc3c(c2)CCO3)C1	ZINC001131896930	1375033261	/nfs/dbraw/zinc/03/32/61/1375033261.db2.gz	XLWISOBUPMCPHW-VQIMIIECSA-N	0	3	342.483	3.099	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@H](C)N(CCOc2cccc(C)c2)C1	ZINC001131995119	1375088608	/nfs/dbraw/zinc/08/86/08/1375088608.db2.gz	GZEDGRHREBMADV-RBUKOAKNSA-N	0	3	342.483	3.146	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@@H](C)N(CCc2ccccc2F)C1	ZINC001132002015	1375092163	/nfs/dbraw/zinc/09/21/63/1375092163.db2.gz	GILLUQDDXSXOGJ-SJLPKXTDSA-N	0	3	330.447	3.141	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@@H](C)N(Cc2ccccc2N(C)C)C1	ZINC001132001593	1375092248	/nfs/dbraw/zinc/09/22/48/1375092248.db2.gz	AZTXEGWXVJRRIA-IEBWSBKVSA-N	0	3	341.499	3.025	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CC[C@@H](C)N(Cc2ccccc2N(C)C)C1	ZINC001132001595	1375092458	/nfs/dbraw/zinc/09/24/58/1375092458.db2.gz	AZTXEGWXVJRRIA-MJGOQNOKSA-N	0	3	341.499	3.025	20	30		EGEDHN
CCc1ccccc1CN1C[C@H](NC(=O)C#CC(C)C)CC[C@H]1C	ZINC001132016004	1375099582	/nfs/dbraw/zinc/09/95/82/1375099582.db2.gz	CMLWDOBCDKAIKW-YLJYHZDGSA-N	0	3	326.484	3.378	20	30		EGEDHN
C[C@@H](C#N)C(=O)N[C@@H]1CCCC[C@H]1NCc1cccc(Cl)c1F	ZINC001225395934	1375108101	/nfs/dbraw/zinc/10/81/01/1375108101.db2.gz	VCONESZAAGJUOC-NILFDRSVSA-N	0	3	337.826	3.156	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N[C@@H]2CC[C@H](C)N(CCCF)C2)cc1	ZINC001132041760	1375112856	/nfs/dbraw/zinc/11/28/56/1375112856.db2.gz	KIEIXUFKNPODMZ-FUHWJXTLSA-N	0	3	346.446	3.031	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H]1CC[C@H](C)N(CCOCC2CC2)C1	ZINC001132077943	1375135569	/nfs/dbraw/zinc/13/55/69/1375135569.db2.gz	JLQAAUMRVKKJIA-XJKSGUPXSA-N	0	3	342.911	3.161	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NCC1CCN([C@H](C)c2ccc(F)cc2)CC1	ZINC001225631230	1375135994	/nfs/dbraw/zinc/13/59/94/1375135994.db2.gz	JVPDNYNZBUDOPK-CVEARBPZSA-N	0	3	348.462	3.306	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NCC1CCN(Cc2cc(F)ccc2C)CC1	ZINC001225631550	1375135998	/nfs/dbraw/zinc/13/59/98/1375135998.db2.gz	PFWLQTYPHWDWFB-MRXNPFEDSA-N	0	3	348.462	3.053	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCOc2ccc(C)cc2C)CC[C@@H]1C	ZINC001132083787	1375138169	/nfs/dbraw/zinc/13/81/69/1375138169.db2.gz	WVEQHWYBAQMIRW-ROUUACIJSA-N	0	3	330.472	3.227	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2nc3c(s2)CCC3)CC[C@H]1C	ZINC001132187008	1375195792	/nfs/dbraw/zinc/19/57/92/1375195792.db2.gz	GYPKHRDEMSSKNN-KGLIPLIRSA-N	0	3	333.501	3.181	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CC[C@H](C)N(CCOCC2CCC2)C1	ZINC001132221562	1375219822	/nfs/dbraw/zinc/21/98/22/1375219822.db2.gz	KFXJECBIGRVDKO-FUHWJXTLSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2ccc(CCC)cc2)CC[C@@H]1C	ZINC001132246328	1375241945	/nfs/dbraw/zinc/24/19/45/1375241945.db2.gz	SALCOMQOFWEYTC-PXNSSMCTSA-N	0	3	344.499	3.424	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CC[C@@H](C)N(CCc2scnc2C)C1	ZINC001132257468	1375251063	/nfs/dbraw/zinc/25/10/63/1375251063.db2.gz	WHJOUVSDAHDOIU-GDBMZVCRSA-N	0	3	335.517	3.319	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC1CCN([C@H](C)c2cccc(F)c2)CC1	ZINC001226446470	1375259970	/nfs/dbraw/zinc/25/99/70/1375259970.db2.gz	BTROFIUSPFURAL-HZPDHXFCSA-N	0	3	348.462	3.449	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CCCC[C@H]1NCc1n[nH]c(C(C)C)n1	ZINC001226474598	1375264317	/nfs/dbraw/zinc/26/43/17/1375264317.db2.gz	QEDOXIVXIJPZDU-HUUCEWRRSA-N	0	3	347.507	3.047	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2c(C)cccc2C)CC[C@H]1C	ZINC001132322862	1375302295	/nfs/dbraw/zinc/30/22/95/1375302295.db2.gz	WFZUSAPYYCUXMW-QZTJIDSGSA-N	0	3	330.472	3.089	20	30		EGEDHN
CCC[C@@H](C)C(=O)NC1CCN(Cc2ccc(OCC#N)cc2)CC1	ZINC001226664928	1375304360	/nfs/dbraw/zinc/30/43/60/1375304360.db2.gz	RWFZGPLAYYDMAK-MRXNPFEDSA-N	0	3	343.471	3.106	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCOc2ccccc2CC)CC[C@@H]1C	ZINC001132414807	1375362391	/nfs/dbraw/zinc/36/23/91/1375362391.db2.gz	XIJFJUQWGXXYLK-FUHWJXTLSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=CCCCCCN1C[C@H](NC(=O)c2conc2COC)CC[C@H]1C	ZINC001132420272	1375367578	/nfs/dbraw/zinc/36/75/78/1375367578.db2.gz	PUACLACVOZIZFZ-HZPDHXFCSA-N	0	3	349.475	3.150	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCCOc2cccc(C)c2)CC[C@@H]1C	ZINC001132462022	1375403943	/nfs/dbraw/zinc/40/39/43/1375403943.db2.gz	VCQFVXMFPMQVJM-ZWKOTPCHSA-N	0	3	330.472	3.309	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COc2ccc3c(c2)CCC3)CC[C@H]1C	ZINC001132462050	1375404316	/nfs/dbraw/zinc/40/43/16/1375404316.db2.gz	VLYKXVKEQPLAEJ-VQIMIIECSA-N	0	3	342.483	3.099	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCOc2cc(C)ccc2C)CC[C@@H]1C	ZINC001132472465	1375413343	/nfs/dbraw/zinc/41/33/43/1375413343.db2.gz	HIVOBQPKCYPPAQ-ROUUACIJSA-N	0	3	330.472	3.227	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COc2cc(C)cc(C)c2)CC[C@@H]1C	ZINC001132486744	1375419528	/nfs/dbraw/zinc/41/95/28/1375419528.db2.gz	PECFOVSWJVLOQN-ROUUACIJSA-N	0	3	330.472	3.227	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)C23CCC(CC2)CC3)CC[C@H]1C	ZINC001132501114	1375427006	/nfs/dbraw/zinc/42/70/06/1375427006.db2.gz	UWIZWIRLSOSNPB-BOHSKOPMSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)CCc1cncc(C)c1	ZINC001227414034	1375428502	/nfs/dbraw/zinc/42/85/02/1375428502.db2.gz	UWSPCYCFPSFZRI-IAGOWNOFSA-N	0	3	335.879	3.092	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2ccc(C3CC3)cc2)CC[C@H]1C	ZINC001132505508	1375429785	/nfs/dbraw/zinc/42/97/85/1375429785.db2.gz	SNSSJTSQUXSTGQ-OXQOHEQNSA-N	0	3	342.483	3.349	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1CC[C@@H](C)N(Cc2cccc(CC)c2)C1	ZINC001132529288	1375443424	/nfs/dbraw/zinc/44/34/24/1375443424.db2.gz	LAKXOXXFFFMKIH-YLJYHZDGSA-N	0	3	344.499	3.311	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1CC[C@H](C)N(Cc2ccc(CF)cc2)C1	ZINC001132529119	1375443550	/nfs/dbraw/zinc/44/35/50/1375443550.db2.gz	IUNRCFKODPHRQO-QFBILLFUSA-N	0	3	348.462	3.218	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCc2cccc(F)c2F)CC[C@H]1C	ZINC001132545350	1375452351	/nfs/dbraw/zinc/45/23/51/1375452351.db2.gz	AGHMBXUCTRKIKV-ZBFHGGJFSA-N	0	3	336.426	3.443	20	30		EGEDHN
C#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)C2(CC)CC2)CC1	ZINC001132554009	1375459790	/nfs/dbraw/zinc/45/97/90/1375459790.db2.gz	AHSWBJRUZXPTEH-IBGZPJMESA-N	0	3	339.483	3.088	20	30		EGEDHN
C#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)C(C)(C)C=C)CC1	ZINC001132554726	1375460829	/nfs/dbraw/zinc/46/08/29/1375460829.db2.gz	LBLKRYFCGWGGNZ-LJQANCHMSA-N	0	3	339.483	3.110	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)[C@H](F)CC)CC1	ZINC001132555180	1375462246	/nfs/dbraw/zinc/46/22/46/1375462246.db2.gz	QYPYZMWJSMYWFQ-RTBURBONSA-N	0	3	345.462	3.036	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCNCc1cnc(-c2ccccc2)s1	ZINC001132576697	1375473426	/nfs/dbraw/zinc/47/34/26/1375473426.db2.gz	NRYZTUZYUIURCH-GJZGRUSLSA-N	0	3	343.496	3.474	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CCCC[C@H]1NCc1n[nH]c(C(C)C)n1	ZINC001227917131	1375490603	/nfs/dbraw/zinc/49/06/03/1375490603.db2.gz	MQCSZVHHBQWUAR-HUUCEWRRSA-N	0	3	347.507	3.047	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CCCC[C@H]1NCc1cc(C#N)ccc1F	ZINC001227973286	1375496819	/nfs/dbraw/zinc/49/68/19/1375496819.db2.gz	OQCNZIORNAHRJJ-QZTJIDSGSA-N	0	3	343.446	3.427	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](C)[C@@H](CNCc2ccccc2C#N)C1	ZINC001132698011	1375520070	/nfs/dbraw/zinc/52/00/70/1375520070.db2.gz	VMJZNBGQDPLGPI-LPHOPBHVSA-N	0	3	325.456	3.099	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](C)[C@H](CNCc2nc(C)cs2)C1	ZINC001132761691	1375551893	/nfs/dbraw/zinc/55/18/93/1375551893.db2.gz	KRWJGWDSYDNLFO-NVXWUHKLSA-N	0	3	347.528	3.219	20	30		EGEDHN
CC#CCCCC(=O)NC1CCN(CCO[C@H]2CCCC[C@@H]2C)CC1	ZINC001228712675	1375648797	/nfs/dbraw/zinc/64/87/97/1375648797.db2.gz	YMKCNMCXXGXWFA-ICSRJNTNSA-N	0	3	348.531	3.356	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NC1CCN(CCOc2ccccc2C)CC1	ZINC001228747476	1375660843	/nfs/dbraw/zinc/66/08/43/1375660843.db2.gz	BGOKCCNEODGCIE-SJLPKXTDSA-N	0	3	344.499	3.413	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NC1CCN(CCOCc2ccccc2)CC1	ZINC001228748210	1375660928	/nfs/dbraw/zinc/66/09/28/1375660928.db2.gz	KDSRYULOCMWGIS-QZTJIDSGSA-N	0	3	344.499	3.242	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](C)[C@@H](CNCc2nccs2)C1	ZINC001133038345	1375729008	/nfs/dbraw/zinc/72/90/08/1375729008.db2.gz	APFSXSPCGKFVIZ-SJORKVTESA-N	0	3	347.528	3.301	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](C)[C@@H](CNCc2ncc(C)s2)C1	ZINC001133068675	1375755854	/nfs/dbraw/zinc/75/58/54/1375755854.db2.gz	JIQWIBTYCKDMDR-RDJZCZTQSA-N	0	3	347.528	3.219	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](C)[C@@H](CNCc2csc(C)n2)C1	ZINC001133072145	1375758505	/nfs/dbraw/zinc/75/85/05/1375758505.db2.gz	GIMAXOJWVRHKSX-HOCLYGCPSA-N	0	3	335.517	3.382	20	30		EGEDHN
CCCc1ccc(C(=O)NCCNCc2ccc(F)c(C#N)c2)cc1	ZINC001133089667	1375767836	/nfs/dbraw/zinc/76/78/36/1375767836.db2.gz	NSGHFOQESCSWKS-UHFFFAOYSA-N	0	3	339.414	3.169	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2ccc3c(c2)C=CCC3)CC1	ZINC001229575851	1375857010	/nfs/dbraw/zinc/85/70/10/1375857010.db2.gz	SNSPNKRAGHJFOC-UHFFFAOYSA-N	0	3	340.467	3.043	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)CCc1cccs1	ZINC001230104632	1375943746	/nfs/dbraw/zinc/94/37/46/1375943746.db2.gz	HMBXACRIIRZTSH-HUUCEWRRSA-N	0	3	326.893	3.450	20	30		EGEDHN
CC[C@H](F)CNCCN(Cc1cccc(Cl)c1)C(=O)[C@H](C)C#N	ZINC001133392651	1375976367	/nfs/dbraw/zinc/97/63/67/1375976367.db2.gz	HLWUACRQECPXDE-CJNGLKHVSA-N	0	3	339.842	3.166	20	30		EGEDHN
C=CCC1(C(=O)NCCNCc2ccc(C(C)C)nc2C)CCC1	ZINC001133392044	1375976643	/nfs/dbraw/zinc/97/66/43/1375976643.db2.gz	DYPZDPIZUNOUJE-UHFFFAOYSA-N	0	3	329.488	3.466	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1coc(C)c1	ZINC001133396101	1375979424	/nfs/dbraw/zinc/97/94/24/1375979424.db2.gz	RBWHQAMFUMUUKR-UHFFFAOYSA-N	0	3	330.815	3.107	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H](C)[C@@H](C)C=C	ZINC001133403816	1375987885	/nfs/dbraw/zinc/98/78/85/1375987885.db2.gz	KTHKRWDTUGXSEW-HOTGVXAUSA-N	0	3	332.875	3.350	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C1CC2(CC2)C1	ZINC001133403812	1375988698	/nfs/dbraw/zinc/98/86/98/1375988698.db2.gz	KLEAGMRKUHAPPZ-UHFFFAOYSA-N	0	3	330.859	3.082	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C(C)(C)C1CC1	ZINC001133405503	1375989825	/nfs/dbraw/zinc/98/98/25/1375989825.db2.gz	AZJRRZPYKYCHGX-UHFFFAOYSA-N	0	3	332.875	3.328	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H]1C[C@@]1(C)CC	ZINC001133407537	1375992979	/nfs/dbraw/zinc/99/29/79/1375992979.db2.gz	IXHVZKYBQOPGEU-PKOBYXMFSA-N	0	3	332.875	3.328	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H]1C[C@H]1C1CCC1	ZINC001133410729	1375995369	/nfs/dbraw/zinc/99/53/69/1375995369.db2.gz	YECBPBXWVDOMBU-RBUKOAKNSA-N	0	3	344.886	3.328	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1C1CCN(C(=O)COCCCC)CC1	ZINC001230542012	1376064844	/nfs/dbraw/zinc/06/48/44/1376064844.db2.gz	SJHWVCJGPGJQGH-KRWDZBQOSA-N	0	3	342.911	3.259	20	30		EGEDHN
CN(C[C@H]1CCN1CCC1CCCCCC1)C(=O)CSCC#N	ZINC001230814604	1376156843	/nfs/dbraw/zinc/15/68/43/1376156843.db2.gz	DYHIQKYSUJPLMS-QGZVFWFLSA-N	0	3	337.533	3.136	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)[C@@H]1Cc2ccccc21)Cc1cccnc1	ZINC001230829972	1376161756	/nfs/dbraw/zinc/16/17/56/1376161756.db2.gz	STPQONOGVPCLSP-OAQYLSRUSA-N	0	3	349.478	3.306	20	30		EGEDHN
C#CCCN(CCCNC(=O)CCC(C)(C)C)Cc1cccnc1	ZINC001230871774	1376171275	/nfs/dbraw/zinc/17/12/75/1376171275.db2.gz	RILBIWTTWKFGEX-UHFFFAOYSA-N	0	3	329.488	3.240	20	30		EGEDHN
C#CCCN(CCCNC(=O)c1cc(C)cc(C)c1)Cc1cccnc1	ZINC001230911598	1376181183	/nfs/dbraw/zinc/18/11/83/1376181183.db2.gz	LCDZOEFFBCHTHS-UHFFFAOYSA-N	0	3	349.478	3.344	20	30		EGEDHN
C=CCCC(=O)N[C@@H](C)C[C@@H](C)NCc1nc2ccc(F)cc2o1	ZINC001133887702	1376250979	/nfs/dbraw/zinc/25/09/79/1376250979.db2.gz	BFORZQDLGPRUGD-OLZOCXBDSA-N	0	3	333.407	3.306	20	30		EGEDHN
COCCCOc1cc(CN2CCC(CC#N)CC2)ccc1OC	ZINC001231612000	1376281232	/nfs/dbraw/zinc/28/12/32/1376281232.db2.gz	LFLDJMBTPZSRSL-UHFFFAOYSA-N	0	3	332.444	3.236	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cnc(F)c(C)c1)CC2	ZINC001231928487	1376355492	/nfs/dbraw/zinc/35/54/92/1376355492.db2.gz	NSKREORKHADVJR-IBGZPJMESA-N	0	3	331.435	3.062	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H](C)C[C@H](C)NCc1cc(F)ccc1C#N	ZINC001134113768	1376374347	/nfs/dbraw/zinc/37/43/47/1376374347.db2.gz	FNFRSKCJEWBONK-HOTGVXAUSA-N	0	3	343.446	3.264	20	30		EGEDHN
C#CCCCCC(=O)N[C@H](C)C[C@@H](C)NCc1nc2ccccc2o1	ZINC001134115215	1376375494	/nfs/dbraw/zinc/37/54/94/1376375494.db2.gz	QLQKXIQBFOKVDR-HZPDHXFCSA-N	0	3	341.455	3.394	20	30		EGEDHN
Cc1ccc(C(=O)NCCNCc2cccc(C#N)c2)c(Cl)c1	ZINC001134171124	1376397660	/nfs/dbraw/zinc/39/76/60/1376397660.db2.gz	GGBQWTPJWBFNFL-UHFFFAOYSA-N	0	3	327.815	3.040	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)c1sccc1F	ZINC001134273629	1376448813	/nfs/dbraw/zinc/44/88/13/1376448813.db2.gz	HVGYSPCPKWKTLL-ZJUUUORDSA-N	0	3	349.269	3.282	20	30		EGEDHN
CCC(CC)n1ccc(CN[C@H](C)C[C@@H](C)NC(=O)C#CC2CC2)n1	ZINC001134317484	1376472227	/nfs/dbraw/zinc/47/22/27/1376472227.db2.gz	JQXJLIPTDUXJNK-HZPDHXFCSA-N	0	3	344.503	3.031	20	30		EGEDHN
C=CCCCCC[NH2+][C@H](C)C[C@@H](C)NC(=O)c1cccc2n[n-]nc21	ZINC001134410633	1376515221	/nfs/dbraw/zinc/51/52/21/1376515221.db2.gz	ZDCCGEAOUBVPAI-HUUCEWRRSA-N	0	3	343.475	3.191	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)CC2CCCCCC2)ccc1F	ZINC001134410174	1376515982	/nfs/dbraw/zinc/51/59/82/1376515982.db2.gz	GYUJAIGPJUJYED-UHFFFAOYSA-N	0	3	331.435	3.264	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CC[C@]2(C[C@H](Oc3ccccn3)CO2)C1	ZINC001233081725	1376567994	/nfs/dbraw/zinc/56/79/94/1376567994.db2.gz	NBSFZRFDRNTIQI-FPOVZHCZSA-N	0	3	349.434	3.074	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)Cc1cc(Br)c[nH]c1=O	ZINC001233186434	1376582538	/nfs/dbraw/zinc/58/25/38/1376582538.db2.gz	LCKLNJPJZIGGTH-UHFFFAOYSA-N	0	3	332.201	3.053	20	30		EGEDHN
C=CCN1C(=O)CCC[C@@]12CCCN(Cc1ccc(C)c(O)c1)C2	ZINC001233228402	1376592789	/nfs/dbraw/zinc/59/27/89/1376592789.db2.gz	AUXATNULUNQMMH-FQEVSTJZSA-N	0	3	328.456	3.234	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)C[C@H](C)NC/C(Cl)=C/Cl)CCC1	ZINC001134593200	1376615325	/nfs/dbraw/zinc/61/53/25/1376615325.db2.gz	JFNUHYIBXSAORH-UDVMBWJESA-N	0	3	331.287	3.372	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2oc(CC)nc2C)CCC1	ZINC001134593519	1376616586	/nfs/dbraw/zinc/61/65/86/1376616586.db2.gz	NYCYNBUTODGGKO-HUUCEWRRSA-N	0	3	345.487	3.112	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2oc(CC)nc2C)CCC1	ZINC001134593517	1376616611	/nfs/dbraw/zinc/61/66/11/1376616611.db2.gz	NYCYNBUTODGGKO-CABCVRRESA-N	0	3	345.487	3.112	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)C12CCC(CC1)C2	ZINC001134736999	1376688531	/nfs/dbraw/zinc/68/85/31/1376688531.db2.gz	MJKAKXVJFFAPLU-ILGZHXLLSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)CCOc1cc(C)cc(C)c1	ZINC001235035924	1376835002	/nfs/dbraw/zinc/83/50/02/1376835002.db2.gz	HQXWMAXLXZCUTN-SFHVURJKSA-N	0	3	330.472	3.181	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H](C)C[C@H](C)NCC(=C)Br	ZINC001135188585	1376961860	/nfs/dbraw/zinc/96/18/60/1376961860.db2.gz	MTEOGGSCFDQKAF-GJZGRUSLSA-N	0	3	343.309	3.352	20	30		EGEDHN
CC#CCCCC(=O)N[C@H](C)C[C@@H](C)NCc1ccn(C(C)C)n1	ZINC001135230629	1376989649	/nfs/dbraw/zinc/98/96/49/1376989649.db2.gz	PRFWHQZKERFLAI-IAGOWNOFSA-N	0	3	332.492	3.031	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H](C)C[C@H](C)NCc1ccn(C(C)C)n1	ZINC001135230630	1376989892	/nfs/dbraw/zinc/98/98/92/1376989892.db2.gz	PRFWHQZKERFLAI-IRXDYDNUSA-N	0	3	332.492	3.031	20	30		EGEDHN
CN1CCC[C@@](C)(NC(=O)c2ccc(C#C[Si](C)(C)C)cc2)C1	ZINC001189176488	1388473380	/nfs/dbraw/zinc/47/33/80/1388473380.db2.gz	CRUUTMQAGJNFNV-LJQANCHMSA-N	0	3	328.532	3.130	20	30		EGEDHN
Cc1coc(C(=O)N[C@H](C)C[C@H](C)NCc2ccccc2C#N)c1	ZINC001135237782	1376994759	/nfs/dbraw/zinc/99/47/59/1376994759.db2.gz	FKLDEXSUPFMCKH-LSDHHAIUSA-N	0	3	325.412	3.146	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)C1(C(F)F)CCC1)NCc1ccccc1C#N	ZINC001135288729	1377022071	/nfs/dbraw/zinc/02/20/71/1377022071.db2.gz	JKNYQHNXSXTISP-KGLIPLIRSA-N	0	3	349.425	3.367	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2oc(C)nc2C)CCC1	ZINC001135394352	1377071195	/nfs/dbraw/zinc/07/11/95/1377071195.db2.gz	GJLNCCZAENYAKQ-ZIAGYGMSSA-N	0	3	333.476	3.411	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)c1occc1Cl)NCc1ccccc1C#N	ZINC001135399350	1377074047	/nfs/dbraw/zinc/07/40/47/1377074047.db2.gz	QXTZGLWXTKSDMV-OLZOCXBDSA-N	0	3	345.830	3.491	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)C1(C)CC(F)(F)C1)NCc1ccccc1C#N	ZINC001135906450	1377258198	/nfs/dbraw/zinc/25/81/98/1377258198.db2.gz	CHMZUSKRQWGGQA-KGLIPLIRSA-N	0	3	349.425	3.367	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CC[C@@H](N(C)Cc2ccc(CF)cc2)C1	ZINC001189242129	1388493060	/nfs/dbraw/zinc/49/30/60/1388493060.db2.gz	FLDAABUCGNYKJB-VQIMIIECSA-N	0	3	348.462	3.170	20	30		EGEDHN
CCCCC(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001268260883	1377503442	/nfs/dbraw/zinc/50/34/42/1377503442.db2.gz	AIQHDJSGBJEBKU-RHSMWYFYSA-N	0	3	331.485	3.233	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cccc(OC)n1)[C@@H]2CC	ZINC001137530107	1377561724	/nfs/dbraw/zinc/56/17/24/1377561724.db2.gz	XSGXRCDBVQTZQU-XLIONFOSSA-N	0	3	343.471	3.012	20	30		EGEDHN
CCC[C@H](C)CC(=O)N1CC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001189270502	1388504100	/nfs/dbraw/zinc/50/41/00/1388504100.db2.gz	SPTAZMQOXNQQOE-LPHOPBHVSA-N	0	3	327.472	3.417	20	30		EGEDHN
COC(=O)C[C@H]1CCN(Cc2ccc(C#Cc3ccccc3)cc2)C1	ZINC001138336679	1377704388	/nfs/dbraw/zinc/70/43/88/1377704388.db2.gz	VORZWWNDPWMHCQ-OAQYLSRUSA-N	0	3	333.431	3.471	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CCC(C)(C(=O)N3CCCC3)CC2)c1[O-]	ZINC001138628213	1377756907	/nfs/dbraw/zinc/75/69/07/1377756907.db2.gz	QNDDIJLLAXABTD-UHFFFAOYSA-N	0	3	342.483	3.345	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CCC(N(C(C)=O)C(C)C)CC2)c1[O-]	ZINC001138630272	1377757699	/nfs/dbraw/zinc/75/76/99/1377757699.db2.gz	UROATFAZONUPDC-UHFFFAOYSA-N	0	3	330.472	3.342	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CCC3(CCN(C(C)C)C3=O)CC2)c1[O-]	ZINC001138630918	1377757943	/nfs/dbraw/zinc/75/79/43/1377757943.db2.gz	GGQJVOPSSZOJGU-UHFFFAOYSA-N	0	3	342.483	3.344	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@H](Oc3ccc(OC)cn3)C2)c1[O-]	ZINC001138631389	1377758244	/nfs/dbraw/zinc/75/82/44/1377758244.db2.gz	RHYXIDNQSONDIO-SFHVURJKSA-N	0	3	340.423	3.178	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@H](Oc3ccc(OC)cn3)C2)c1[O-]	ZINC001138631389	1377758247	/nfs/dbraw/zinc/75/82/47/1377758247.db2.gz	RHYXIDNQSONDIO-SFHVURJKSA-N	0	3	340.423	3.178	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@@H]1CCN(Cc1cnn(CCC)c1C)C2	ZINC001138636563	1377758757	/nfs/dbraw/zinc/75/87/57/1377758757.db2.gz	UULCPKJHTXMGOJ-WOJBJXKFSA-N	0	3	347.503	3.175	20	30		EGEDHN
CCn1nc(C)c(CN2CCC[C@@H](Oc3ccc(C#N)cc3)C2)c1C	ZINC001138646189	1377762236	/nfs/dbraw/zinc/76/22/36/1377762236.db2.gz	AEFBNBDBTSYVGD-LJQANCHMSA-N	0	3	338.455	3.435	20	30		EGEDHN
N#CC1(c2ccccc2)CCN(Cc2ccccc2-n2cncn2)CC1	ZINC001139417316	1377881076	/nfs/dbraw/zinc/88/10/76/1377881076.db2.gz	YTGDOBXQQLOWLO-UHFFFAOYSA-N	0	3	343.434	3.325	20	30		EGEDHN
N#Cc1cccc2c(CN3CC[C@H]4[C@@H]3CCC(=O)N4CC3CC3)c[nH]c21	ZINC001139701984	1377937292	/nfs/dbraw/zinc/93/72/92/1377937292.db2.gz	VJRVLOKJWDGEPC-OALUTQOASA-N	0	3	348.450	3.015	20	30		EGEDHN
CCN(CCNC(=O)OC(C)(C)C)Cc1c[nH]c2c1cccc2C#N	ZINC001139707288	1377938246	/nfs/dbraw/zinc/93/82/46/1377938246.db2.gz	VVOVFHVJDZQWBR-UHFFFAOYSA-N	0	3	342.443	3.386	20	30		EGEDHN
Cc1ccc(CN2CCC3(C[C@@H](c4cncnc4)CO3)CC2)cc1C#N	ZINC001139724777	1377941715	/nfs/dbraw/zinc/94/17/15/1377941715.db2.gz	PKKCJVQNATUUBT-LJQANCHMSA-N	0	3	348.450	3.195	20	30		EGEDHN
N#Cc1ccc2[nH]cc(CN3CCC[C@@H](Oc4ccncc4)C3)c2c1	ZINC001140116950	1378011603	/nfs/dbraw/zinc/01/16/03/1378011603.db2.gz	ISSSDUUAKFWUOH-GOSISDBHSA-N	0	3	332.407	3.478	20	30		EGEDHN
N#Cc1ccc2[nH]cc(CN3CCC(N4CCCCC4=O)CC3)c2c1	ZINC001140116187	1378012088	/nfs/dbraw/zinc/01/20/88/1378012088.db2.gz	UXLYHUAEUGSBDF-UHFFFAOYSA-N	0	3	336.439	3.016	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1ccc(O)cc1F)[C@H]2CC	ZINC001140125878	1378013606	/nfs/dbraw/zinc/01/36/06/1378013606.db2.gz	KPXKEBAVMRQBAR-ICSRJNTNSA-N	0	3	346.446	3.453	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN2Cc2ccccc2N2CCCC2)C1=O	ZINC001273360767	1378098948	/nfs/dbraw/zinc/09/89/48/1378098948.db2.gz	VMTCTSNUWJQTKG-NRFANRHFSA-N	0	3	339.483	3.040	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2ccns2)CCCC[C@H]1C	ZINC001753534383	1440432027	/nfs/dbraw/zinc/43/20/27/1440432027.db2.gz	SNQHMTBSKWKAMZ-IAQYHMDHSA-N	0	3	327.881	3.164	20	30		EGEDHN
COc1ccc(CCN(C)Cc2ccc(C#N)c(SC)n2)cc1	ZINC001141941694	1378396613	/nfs/dbraw/zinc/39/66/13/1378396613.db2.gz	UBGKIZXOIGHZIK-UHFFFAOYSA-N	0	3	327.453	3.358	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)[C@H](CC#N)c2ccccc2)N(C)C)cc1	ZINC001142539561	1378455693	/nfs/dbraw/zinc/45/56/93/1378455693.db2.gz	SWBABWNMKCELTQ-UXHICEINSA-N	0	3	335.451	3.411	20	30		EGEDHN
N#Cc1ccc2c(CN3CCC[C@](O)(C(F)(F)F)CC3)c[nH]c2c1	ZINC001142912273	1378508104	/nfs/dbraw/zinc/50/81/04/1378508104.db2.gz	ZXTCJEUGUIIMRM-MRXNPFEDSA-N	0	3	337.345	3.319	20	30		EGEDHN
Cc1cc(OC2CCN(Cc3c[nH]c4cc(C#N)ccc34)CC2)ncn1	ZINC001142929300	1378511867	/nfs/dbraw/zinc/51/18/67/1378511867.db2.gz	CPRLJYCNSQKKCA-UHFFFAOYSA-N	0	3	347.422	3.181	20	30		EGEDHN
COc1cccc(O[C@@H]2CCN(Cc3c[nH]c4cc(C#N)ccc34)C2)n1	ZINC001142930482	1378512316	/nfs/dbraw/zinc/51/23/16/1378512316.db2.gz	KBSWETARFDVTGM-MRXNPFEDSA-N	0	3	348.406	3.096	20	30		EGEDHN
C=CCO[C@@H]1CO[C@@]2(C1)CCCN(Cc1cc(C)cc(OC)c1)C2	ZINC001143157649	1378549133	/nfs/dbraw/zinc/54/91/33/1378549133.db2.gz	PHIRPNBNZXUFLD-VQTJNVASSA-N	0	3	331.456	3.330	20	30		EGEDHN
COc1ccc(CN2CCC3SC(=O)C=C3C2)c(C(F)(F)F)c1	ZINC001143476859	1378602207	/nfs/dbraw/zinc/60/22/07/1378602207.db2.gz	WSIIQXBEGRWIKB-CQSZACIVSA-N	0	3	343.370	3.488	20	30		EGEDHN
CN(Cc1cncc(C#N)c1)C[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC001144083684	1378680743	/nfs/dbraw/zinc/68/07/43/1378680743.db2.gz	OJRXAAUCCJCNRY-OAHLLOKOSA-N	0	3	344.459	3.032	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)C[C@H](C)NCc2nccs2)CCCCC1	ZINC001146661855	1378892341	/nfs/dbraw/zinc/89/23/41/1378892341.db2.gz	CTGHLVBDLAYUPT-JKSUJKDBSA-N	0	3	347.528	3.490	20	30		EGEDHN
C[C@@H](CN(C)C(=O)CC(C)(C)C1CC1)NCc1ccc(C#N)s1	ZINC001283605906	1379048253	/nfs/dbraw/zinc/04/82/53/1379048253.db2.gz	MATXZFWJHVMQHA-ZDUSSCGKSA-N	0	3	333.501	3.383	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC2(C1)CCN(Cc1sc(C)nc1C)C2	ZINC001147631388	1379053182	/nfs/dbraw/zinc/05/31/82/1379053182.db2.gz	WGJFEIQLYPNDAT-UHFFFAOYSA-N	0	3	347.528	3.397	20	30		EGEDHN
C[C@@H](CN(C)C(=O)c1ccc(CF)cc1)NCc1ccc(C#N)s1	ZINC001283720219	1379141189	/nfs/dbraw/zinc/14/11/89/1379141189.db2.gz	AIYDZKZVGDOVAB-ZDUSSCGKSA-N	0	3	345.443	3.340	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)c2cccc(C(F)F)c2)ccc1F	ZINC001148573563	1379215445	/nfs/dbraw/zinc/21/54/45/1379215445.db2.gz	UUWJJKUDWDZWFV-UHFFFAOYSA-N	0	3	347.340	3.155	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)Cc2cccc3ccccc32)c1	ZINC001148710652	1379249592	/nfs/dbraw/zinc/24/95/92/1379249592.db2.gz	TWWZHPQRMXWJCJ-UHFFFAOYSA-N	0	3	343.430	3.160	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N1CC2(C1)CCN([C@@H](C)c1cccc(F)c1)C2	ZINC001148899936	1379294076	/nfs/dbraw/zinc/29/40/76/1379294076.db2.gz	LRBOEYOOIKVTHU-JKSUJKDBSA-N	0	3	346.446	3.012	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2c(Cl)cccc2Cl)c1	ZINC001148902984	1379294371	/nfs/dbraw/zinc/29/43/71/1379294371.db2.gz	BDKYDGHABDVWEJ-UHFFFAOYSA-N	0	3	348.233	3.385	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@H]1CN(Cc2ccc(C)cc2)CCCO1	ZINC001150077889	1379491476	/nfs/dbraw/zinc/49/14/76/1379491476.db2.gz	FLWFFXLRMSEQGO-IBGZPJMESA-N	0	3	344.499	3.304	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H]1CN([C@@H](C)c2ccccc2)CCCO1	ZINC001150211811	1379516339	/nfs/dbraw/zinc/51/63/39/1379516339.db2.gz	LEWBIXZSCWQSKB-PKOBYXMFSA-N	0	3	330.472	3.311	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@@H]1CN(Cc2ccccc2C)CCCO1	ZINC001150372798	1379541427	/nfs/dbraw/zinc/54/14/27/1379541427.db2.gz	SKQIGHVLIOZLIL-LJQANCHMSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=CC[C@@H](C(=O)NC[C@@H]1CN(CC(=C)C)CCCO1)c1ccccc1	ZINC001150745416	1379604386	/nfs/dbraw/zinc/60/43/86/1379604386.db2.gz	PFJGLVJEVXYNOX-WOJBJXKFSA-N	0	3	342.483	3.130	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)C(CC(C)C)CC(C)C)C1	ZINC001150787932	1379615122	/nfs/dbraw/zinc/61/51/22/1379615122.db2.gz	PHPMHNHTEJBLHS-LJQANCHMSA-N	0	3	338.536	3.478	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@H]2CCCC3(CC3)C2)CC1	ZINC001151128349	1379665164	/nfs/dbraw/zinc/66/51/64/1379665164.db2.gz	KEEAUBCCLRGSTD-KRWDZBQOSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@H]2CCCC2(C)C)CC1	ZINC001151249013	1379686967	/nfs/dbraw/zinc/68/69/67/1379686967.db2.gz	WWNWPUZUAKNZPX-QGZVFWFLSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@H]2CCC[C@@H]2CC)CC1	ZINC001151294583	1379694984	/nfs/dbraw/zinc/69/49/84/1379694984.db2.gz	MEXPTGPJPXHJAV-ROUUACIJSA-N	0	3	336.520	3.376	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)C1CCCCC1	ZINC001151613699	1379747127	/nfs/dbraw/zinc/74/71/27/1379747127.db2.gz	JDASNGHILXLGGJ-MRXNPFEDSA-N	0	3	327.472	3.465	20	30		EGEDHN
CCN(Cc1ccc(OC)c(C#N)c1)[C@H](C)CNC(=O)CC1CCC1	ZINC001152585216	1379953689	/nfs/dbraw/zinc/95/36/89/1379953689.db2.gz	RKOGFUPYQWRNBN-OAHLLOKOSA-N	0	3	343.471	3.084	20	30		EGEDHN
C#CCC1(C(=O)NCCNCc2ccc(F)c(F)c2)CCCCC1	ZINC001153009165	1380007352	/nfs/dbraw/zinc/00/73/52/1380007352.db2.gz	IKEGZUVDTJDDNW-UHFFFAOYSA-N	0	3	334.410	3.144	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H](C)N(CC)C[C@H](O)c1ccc(F)cc1	ZINC001153626104	1380106729	/nfs/dbraw/zinc/10/67/29/1380106729.db2.gz	ZJLJBGLFUMGMNI-QAPCUYQASA-N	0	3	336.451	3.042	20	30		EGEDHN
CC(F)(F)c1ccc(C(=O)NCCNCc2ccc(C#N)cc2)cc1	ZINC001153959296	1380162803	/nfs/dbraw/zinc/16/28/03/1380162803.db2.gz	FXVGFXIOLHTHSF-UHFFFAOYSA-N	0	3	343.377	3.190	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)[C@H](C)CC(F)F	ZINC001154359654	1380264060	/nfs/dbraw/zinc/26/40/60/1380264060.db2.gz	FJMMFFCGDFZVMX-ZIAGYGMSSA-N	0	3	337.414	3.176	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)C1CCC(F)CC1	ZINC001155041440	1380397374	/nfs/dbraw/zinc/39/73/74/1380397374.db2.gz	XLAIJBJINZUCCT-VNCLNFNDSA-N	0	3	345.462	3.413	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)C1(C(C)C)CC1	ZINC001155141956	1380415833	/nfs/dbraw/zinc/41/58/33/1380415833.db2.gz	OAGUIHAAWWNOQX-OAHLLOKOSA-N	0	3	345.462	3.460	20	30		EGEDHN
CCN(CC#CCOC)[C@H](C)CNC(=O)[C@@H](C)CC1CCCCC1	ZINC001155601216	1380472341	/nfs/dbraw/zinc/47/23/41/1380472341.db2.gz	JNDRYZORXMZQBX-ZWKOTPCHSA-N	0	3	336.520	3.069	20	30		EGEDHN
CCN(CC#CCOC)[C@H](C)CNC(=O)[C@H](C)CC1CCCCC1	ZINC001155601214	1380472366	/nfs/dbraw/zinc/47/23/66/1380472366.db2.gz	JNDRYZORXMZQBX-QZTJIDSGSA-N	0	3	336.520	3.069	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@H](CC)Oc1cccc(C)c1	ZINC001155770867	1380491072	/nfs/dbraw/zinc/49/10/72/1380491072.db2.gz	GYCDYFDKXFTAGN-MJGOQNOKSA-N	0	3	330.472	3.002	20	30		EGEDHN
Cc1ccnc(N2CCC[C@@H](NCOCC[Si](C)(C)C)C2)c1C#N	ZINC001156464731	1380579344	/nfs/dbraw/zinc/57/93/44/1380579344.db2.gz	VMCQEVUVWIFYPQ-MRXNPFEDSA-N	0	3	346.551	3.132	20	30		EGEDHN
N#Cc1cc(F)c(Cl)nc1-n1cncc1CNCc1ccccc1	ZINC001156472890	1380580764	/nfs/dbraw/zinc/58/07/64/1380580764.db2.gz	QPYMUTMGSYYYHP-UHFFFAOYSA-N	0	3	341.777	3.221	20	30		EGEDHN
Cc1cnc(-n2nc(CN)c3ccccc32)c(C#C[Si](C)(C)C)c1	ZINC001156860943	1380701480	/nfs/dbraw/zinc/70/14/80/1380701480.db2.gz	VPRNCMFFYOREGD-UHFFFAOYSA-N	0	3	334.499	3.417	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NC[C@@H](C)N(CC)Cc1cccc(Cl)c1	ZINC001157216951	1380813011	/nfs/dbraw/zinc/81/30/11/1380813011.db2.gz	DKRRCOQRVIDPNL-CABCVRRESA-N	0	3	338.879	3.258	20	30		EGEDHN
CN1CCC[C@@H]2CN(c3nc4cc(F)ccc4c(Cl)c3C#N)C[C@H]21	ZINC001157281751	1380831529	/nfs/dbraw/zinc/83/15/29/1380831529.db2.gz	IACVLOGPWWDZFH-BDJLRTHQSA-N	0	3	344.821	3.429	20	30		EGEDHN
CC1(CC(=O)NCCCNCc2ccc(C#N)cc2F)CCCC1	ZINC001157461823	1380911529	/nfs/dbraw/zinc/91/15/29/1380911529.db2.gz	LDQRHTJVIYXMSY-UHFFFAOYSA-N	0	3	331.435	3.264	20	30		EGEDHN
C=CCCC(=O)N1CCCC[C@@H]1CN(C)CCOc1ccc(F)cc1	ZINC001157662057	1380993136	/nfs/dbraw/zinc/99/31/36/1380993136.db2.gz	WFWTWQGOPYQJKM-GOSISDBHSA-N	0	3	348.462	3.484	20	30		EGEDHN
C[C@@H](NCCCNC(=O)C#CC1CC1)c1ccccc1Br	ZINC001157719096	1381013280	/nfs/dbraw/zinc/01/32/80/1381013280.db2.gz	RNIQJUZEVXJPQO-CYBMUJFWSA-N	0	3	349.272	3.019	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cncc2sccc21	ZINC001158377787	1381225229	/nfs/dbraw/zinc/22/52/29/1381225229.db2.gz	PHJZKMNEFOZZLI-CQSZACIVSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cccc2oc(C)nc21	ZINC001158928033	1381469763	/nfs/dbraw/zinc/46/97/63/1381469763.db2.gz	KMWCMEINOYSKFT-OAHLLOKOSA-N	0	3	327.428	3.249	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)Cc1cc2ccccc2n1C	ZINC001158949948	1381481427	/nfs/dbraw/zinc/48/14/27/1381481427.db2.gz	XHHZVFUJHQLRDB-GOSISDBHSA-N	0	3	339.483	3.220	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCC1=CCN([C@@H]2CCc3c2cccc3F)CC1	ZINC001159594219	1381840688	/nfs/dbraw/zinc/84/06/88/1381840688.db2.gz	OLTBZCRWOXCCOH-IFXJQAMLSA-N	0	3	341.430	3.111	20	30		EGEDHN
Cc1[nH]ccc1C(=O)NCCC1=CCN(Cc2ccc(C#N)cc2)CC1	ZINC001159744913	1381887185	/nfs/dbraw/zinc/88/71/85/1381887185.db2.gz	FOAFWOBIDLZIQK-UHFFFAOYSA-N	0	3	348.450	3.147	20	30		EGEDHN
C#CCCCCC(=O)NCCC1=CCN(Cc2ncccc2C)CC1	ZINC001159880521	1381927332	/nfs/dbraw/zinc/92/73/32/1381927332.db2.gz	IHKKFAQYDRZBFP-UHFFFAOYSA-N	0	3	339.483	3.222	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)CO[C@H]2CCCC[C@H]2CC)CC1	ZINC001160107342	1381998967	/nfs/dbraw/zinc/99/89/67/1381998967.db2.gz	NMQUMBHPBBBIBI-UXHICEINSA-N	0	3	346.515	3.134	20	30		EGEDHN
C=C(C)CCC(=O)NCCC1=CCN(Cc2cccnc2C)CC1	ZINC001160258662	1382051797	/nfs/dbraw/zinc/05/17/97/1382051797.db2.gz	ZKFGHZGYCMLVTH-UHFFFAOYSA-N	0	3	327.472	3.385	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)C/C=C\Cc1ccccc1	ZINC001160319522	1382071957	/nfs/dbraw/zinc/07/19/57/1382071957.db2.gz	WALWFNRVLCJRCQ-DAXSKMNVSA-N	0	3	347.462	3.343	20	30		EGEDHN
C[Si](C)(C)C#Cc1cccnc1-n1nc(-c2ccncc2)cc1CN	ZINC001160338677	1382076160	/nfs/dbraw/zinc/07/61/60/1382076160.db2.gz	FRLIFFJLOGTDTI-UHFFFAOYSA-N	0	3	347.498	3.017	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C/C=C/Cc2ccccc2)CC1	ZINC001160400741	1382094195	/nfs/dbraw/zinc/09/41/95/1382094195.db2.gz	XMNDVCMRXRNCTF-BQYQJAHWSA-N	0	3	336.479	3.337	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2nccc3ccsc32)CC1	ZINC001160431187	1382101537	/nfs/dbraw/zinc/10/15/37/1382101537.db2.gz	PCQZCZNUWABIBM-UHFFFAOYSA-N	0	3	327.453	3.234	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H]2[C@@H](C=C(C)C)C2(C)C)CC1	ZINC001160646608	1382160026	/nfs/dbraw/zinc/16/00/26/1382160026.db2.gz	STRNGYSGJHQBKU-MOPGFXCFSA-N	0	3	328.500	3.387	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCC1=CCN(Cc2cnccc2C)CC1	ZINC001160941847	1382244742	/nfs/dbraw/zinc/24/47/42/1382244742.db2.gz	RQJLPMMMSJXOTJ-SJLPKXTDSA-N	0	3	341.499	3.487	20	30		EGEDHN
C=CCN1CCC[C@H]1CNc1nc(Cl)cc(C(=O)OCC)c1C	ZINC001160954044	1382250385	/nfs/dbraw/zinc/25/03/85/1382250385.db2.gz	ONFBRLGMTDUXJR-ZDUSSCGKSA-N	0	3	337.851	3.282	20	30		EGEDHN
C=CCN1CCC[C@H]1CNc1cc([N+](=O)[O-])cc2c(Cl)ncnc12	ZINC001160957790	1382251420	/nfs/dbraw/zinc/25/14/20/1382251420.db2.gz	UBVZCUOIBLZCQN-NSHDSACASA-N	0	3	347.806	3.254	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc(C)c(Cl)c2)CC1	ZINC001161116988	1382305529	/nfs/dbraw/zinc/30/55/29/1382305529.db2.gz	XBDMFINSURTIBZ-UHFFFAOYSA-N	0	3	330.859	3.424	20	30		EGEDHN
N#Cc1cnc(Cl)cc1NCC1CCN(Cc2ccccn2)CC1	ZINC001161241114	1382352203	/nfs/dbraw/zinc/35/22/03/1382352203.db2.gz	UDLNPJSOGNSMHI-UHFFFAOYSA-N	0	3	341.846	3.326	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc(OCC)c(C)c2)CC1	ZINC001161363925	1382384281	/nfs/dbraw/zinc/38/42/81/1382384281.db2.gz	QNFZCCVGQUUYBN-UHFFFAOYSA-N	0	3	340.467	3.169	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cnoc2-c2ccccc2)CC1	ZINC001161617324	1382460124	/nfs/dbraw/zinc/46/01/24/1382460124.db2.gz	POBGXLHUJCUVEG-UHFFFAOYSA-N	0	3	337.423	3.280	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc3cccnc3s2)CC1	ZINC001161639878	1382466738	/nfs/dbraw/zinc/46/67/38/1382466738.db2.gz	HMRQZQVHYVFYNP-UHFFFAOYSA-N	0	3	339.464	3.072	20	30		EGEDHN
CC(C)(C)C(=O)Nc1ccc(CN)nc1N[C@H](C#N)c1ccccc1	ZINC001161714282	1382487500	/nfs/dbraw/zinc/48/75/00/1382487500.db2.gz	QTRRMMBKPJIHGX-MRXNPFEDSA-N	0	3	337.427	3.202	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2c(F)cccc2Cl)CC1	ZINC001161763222	1382498255	/nfs/dbraw/zinc/49/82/55/1382498255.db2.gz	NJNQZBFFDIBKQX-UHFFFAOYSA-N	0	3	334.822	3.254	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)CC(C)(C)C(F)(F)F)CC1	ZINC001161797466	1382509192	/nfs/dbraw/zinc/50/91/92/1382509192.db2.gz	ZHTMVMMUCCLYEO-UHFFFAOYSA-N	0	3	330.394	3.127	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CCOc2cccc(C)c2)CC1	ZINC001161856613	1382531686	/nfs/dbraw/zinc/53/16/86/1382531686.db2.gz	ANUDYMOGWQOXKW-UHFFFAOYSA-N	0	3	328.456	3.088	20	30		EGEDHN
C[C@@H](C(=O)N1CCCC[C@H]1CNCC#Cc1ccccc1)C1CCC1	ZINC001328621011	1388791239	/nfs/dbraw/zinc/79/12/39/1388791239.db2.gz	FIOBBKOEHMJHLJ-NQIIRXRSSA-N	0	3	338.495	3.445	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H](C)c2cccc(F)c2)CC1	ZINC001161908574	1382547564	/nfs/dbraw/zinc/54/75/64/1382547564.db2.gz	OSHJNDCDPAFYTQ-INIZCTEOSA-N	0	3	328.431	3.091	20	30		EGEDHN
C#CC1(Nc2nccnc2C(C#N)C(=O)OC(C)(C)C)CCCCC1	ZINC001162479525	1382769283	/nfs/dbraw/zinc/76/92/83/1382769283.db2.gz	IPAWTYIRWRZOKG-AWEZNQCLSA-N	0	3	340.427	3.173	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)c1cc(C)oc1C	ZINC001162696322	1382837714	/nfs/dbraw/zinc/83/77/14/1382837714.db2.gz	JDEDXATUFSHFOG-UHFFFAOYSA-N	0	3	338.451	3.194	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)c1ccc(Cl)o1	ZINC001162707186	1382841843	/nfs/dbraw/zinc/84/18/43/1382841843.db2.gz	LUXYAJBTIXENQH-UHFFFAOYSA-N	0	3	344.842	3.231	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C[C@@H](C)C(C)C	ZINC001162737696	1382852650	/nfs/dbraw/zinc/85/26/50/1382852650.db2.gz	MNVRJYXWYIUJKM-LJQANCHMSA-N	0	3	328.500	3.353	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)CCCC(C)(C)C	ZINC001162741421	1382854915	/nfs/dbraw/zinc/85/49/15/1382854915.db2.gz	OWUQZVCDNAJXLN-UHFFFAOYSA-N	0	3	328.500	3.497	20	30		EGEDHN
CC(C)(C)C#CC(=O)N(CCNC/C=C/Cl)CCc1ccccc1	ZINC001162807036	1382879190	/nfs/dbraw/zinc/87/91/90/1382879190.db2.gz	SDCRCZFOZGMAKQ-NTUHNPAUSA-N	0	3	346.902	3.449	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1sccc1Cl	ZINC001162817445	1382884665	/nfs/dbraw/zinc/88/46/65/1382884665.db2.gz	YCSMTUOMKHCARD-UHFFFAOYSA-N	0	3	346.883	3.309	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C(C)(C)C1CCCC1	ZINC001162831674	1382889416	/nfs/dbraw/zinc/88/94/16/1382889416.db2.gz	BELYOISCJLAZCN-UHFFFAOYSA-N	0	3	340.511	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CCC[C@H]1CC	ZINC001162918887	1382916293	/nfs/dbraw/zinc/91/62/93/1382916293.db2.gz	IGGFAMWXRCTQGJ-WOJBJXKFSA-N	0	3	326.484	3.107	20	30		EGEDHN
C=CCC1(C(=O)N(CCNCCF)CCc2ccccc2)CCC1	ZINC001162919663	1382917715	/nfs/dbraw/zinc/91/77/15/1382917715.db2.gz	XVXHTSNUCSFXKO-UHFFFAOYSA-N	0	3	332.463	3.363	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1ccsc1Cl	ZINC001162952497	1382925756	/nfs/dbraw/zinc/92/57/56/1382925756.db2.gz	RDLGXMPQUKWSPP-UHFFFAOYSA-N	0	3	346.883	3.309	20	30		EGEDHN
CCC(CC)C(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001163510746	1383070144	/nfs/dbraw/zinc/07/01/44/1383070144.db2.gz	POOWLWUMCDYTMU-UHFFFAOYSA-N	0	3	327.472	3.371	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCCNCc2cccc(F)c2Cl)cc1	ZINC001163729059	1383115415	/nfs/dbraw/zinc/11/54/15/1383115415.db2.gz	LPUDPQYIGQQKHG-UHFFFAOYSA-N	0	3	344.817	3.370	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCCN[C@H](C)c2cc(F)ccc2F)cc1	ZINC001163756003	1383118179	/nfs/dbraw/zinc/11/81/79/1383118179.db2.gz	CFRRSJXTWWZXHD-CQSZACIVSA-N	0	3	342.389	3.417	20	30		EGEDHN
C/C=C(/C)C(=O)NCCC1(CNCc2cc(C#N)ccc2F)CC1	ZINC001163993446	1383144074	/nfs/dbraw/zinc/14/40/74/1383144074.db2.gz	UUYQKJFRQQQXQS-BNNQUZSASA-N	0	3	329.419	3.040	20	30		EGEDHN
C#CCCCCC(=O)NCCC1(CNCC=C(Cl)Cl)CC1	ZINC001164178865	1383163413	/nfs/dbraw/zinc/16/34/13/1383163413.db2.gz	MHBJPZMQXFTFJO-UHFFFAOYSA-N	0	3	331.287	3.375	20	30		EGEDHN
CN(C)Cc1ccnc(N2CCC(Cc3ccc(C#N)cc3)CC2)c1	ZINC001165080544	1383223311	/nfs/dbraw/zinc/22/33/11/1383223311.db2.gz	MQSOIBPLAGQGDQ-UHFFFAOYSA-N	0	3	334.467	3.474	20	30		EGEDHN
CN(C)C1(C)CN(c2nc3cc(F)c(F)cc3c(Cl)c2C#N)C1	ZINC001165122182	1383231734	/nfs/dbraw/zinc/23/17/34/1383231734.db2.gz	UAERHACFMNYFFQ-UHFFFAOYSA-N	0	3	336.773	3.178	20	30		EGEDHN
Cc1cnc(N(C)[C@H]2CN(Cc3ccccc3)CC[C@H]2C)c(C#N)n1	ZINC001165180472	1383242702	/nfs/dbraw/zinc/24/27/02/1383242702.db2.gz	BDHBWYGGAAWTMB-BEFAXECRSA-N	0	3	335.455	3.004	20	30		EGEDHN
Cc1cc(Cl)ccc1C(=O)NCCCNCc1ccccc1C#N	ZINC001165731746	1383335057	/nfs/dbraw/zinc/33/50/57/1383335057.db2.gz	QXHXWBQQUJCIAN-UHFFFAOYSA-N	0	3	341.842	3.430	20	30		EGEDHN
C=C1CCC(C(=O)NCCCNCc2ccc(C#N)cc2F)CC1	ZINC001165906677	1383362558	/nfs/dbraw/zinc/36/25/58/1383362558.db2.gz	GQPSATURHKRQLJ-UHFFFAOYSA-N	0	3	329.419	3.040	20	30		EGEDHN
CC1(C)CC[C@@H](C(=O)NCCCNCc2cc(C#N)ccc2F)C1	ZINC001166200358	1383401214	/nfs/dbraw/zinc/40/12/14/1383401214.db2.gz	OVPMUADFFCPHDA-OAHLLOKOSA-N	0	3	331.435	3.120	20	30		EGEDHN
C[C@H](C(=O)NCCCNCc1ccc(C#N)cc1F)c1ccsc1	ZINC001166497479	1383429564	/nfs/dbraw/zinc/42/95/64/1383429564.db2.gz	NIPZCIZMOWLFGD-ZDUSSCGKSA-N	0	3	345.443	3.158	20	30		EGEDHN
C[C@H](C(=O)NCCCNCc1cc(C#N)ccc1F)c1cccs1	ZINC001166511574	1383431734	/nfs/dbraw/zinc/43/17/34/1383431734.db2.gz	ZAERYAGTPSAIOB-ZDUSSCGKSA-N	0	3	345.443	3.158	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCC1(CNCc2cc(C3CC3)no2)CC1	ZINC001166704511	1383464370	/nfs/dbraw/zinc/46/43/70/1383464370.db2.gz	RCXHRWMZEQUUBW-LSDHHAIUSA-N	0	3	345.487	3.386	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)Cc2cc(C)cc(C)c2)CC1	ZINC001166965069	1383506169	/nfs/dbraw/zinc/50/61/69/1383506169.db2.gz	NGIAJVZNWWJGNA-UHFFFAOYSA-N	0	3	334.891	3.475	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCC2(CNCc3oc(C)nc3C)CC2)C1	ZINC001167130530	1383547906	/nfs/dbraw/zinc/54/79/06/1383547906.db2.gz	ORHXUUUWQOLZMN-UHFFFAOYSA-N	0	3	331.460	3.024	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)[C@H](F)c2ccccc2)c1	ZINC001167373130	1383614042	/nfs/dbraw/zinc/61/40/42/1383614042.db2.gz	WBYUGZZZQYNXKY-GOSISDBHSA-N	0	3	343.377	3.004	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1ccc2c(c1)C=CCC2	ZINC001168189153	1383839171	/nfs/dbraw/zinc/83/91/71/1383839171.db2.gz	DSTUQXGSRGCPLD-UHFFFAOYSA-N	0	3	345.446	3.427	20	30		EGEDHN
C=CCOC(=O)N[C@@H]1CCCN([C@H]2CCc3cc(F)ccc3C2)C1	ZINC001168447664	1383908334	/nfs/dbraw/zinc/90/83/34/1383908334.db2.gz	GEBNTCZHGQXXJO-MSOLQXFVSA-N	0	3	332.419	3.060	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1ccc(C(F)F)cc1	ZINC001168505203	1383926984	/nfs/dbraw/zinc/92/69/84/1383926984.db2.gz	YGLQETJKVZZCSL-UHFFFAOYSA-N	0	3	343.377	3.406	20	30		EGEDHN
CNC(=O)N[C@@H]1CCCN(Cc2ccc(-c3ccccc3C#N)cc2)C1	ZINC001308077425	1384087657	/nfs/dbraw/zinc/08/76/57/1384087657.db2.gz	XVPHJTVTNOXKGW-LJQANCHMSA-N	0	3	348.450	3.119	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)[C@@H]2C[C@@H]2C2CCCC2)c(F)c1	ZINC001169678501	1384172368	/nfs/dbraw/zinc/17/23/68/1384172368.db2.gz	CWNQOMODFYZOJT-QZTJIDSGSA-N	0	3	343.446	3.120	20	30		EGEDHN
CCc1nc(CNCCCC[C@H](C)NC(=O)C#CC(C)C)cs1	ZINC001170664771	1384359402	/nfs/dbraw/zinc/35/94/02/1384359402.db2.gz	GVHSRYQWWYITNF-HNNXBMFYSA-N	0	3	335.517	3.130	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H](C)CCCCNCc1nnc(C(C)C)[nH]1	ZINC001171043978	1384435634	/nfs/dbraw/zinc/43/56/34/1384435634.db2.gz	SPXGBNRYIBFDMB-OAHLLOKOSA-N	0	3	335.496	3.049	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H](C)CCCCNCc2nccs2)CCC1	ZINC001171187713	1384463952	/nfs/dbraw/zinc/46/39/52/1384463952.db2.gz	XOHNSPDFZQTGKT-HNNXBMFYSA-N	0	3	333.501	3.101	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)NCc1cc(OCC2CCC2)ncn1	ZINC001171198752	1384466824	/nfs/dbraw/zinc/46/68/24/1384466824.db2.gz	PKVFEGIEFXPTQT-OAHLLOKOSA-N	0	3	336.439	3.248	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)NCc1ccnc(OCC2CCC2)n1	ZINC001171198528	1384466911	/nfs/dbraw/zinc/46/69/11/1384466911.db2.gz	MVMNMNQCRYTLRD-OAHLLOKOSA-N	0	3	336.439	3.248	20	30		EGEDHN
COc1cccnc1O[C@H]1CCN([C@H](C)Cc2cccc(C#N)c2)C1	ZINC001171230404	1384474787	/nfs/dbraw/zinc/47/47/87/1384474787.db2.gz	DINHKHZSNIWQHX-QAPCUYQASA-N	0	3	337.423	3.046	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H](C)CCCCNCc1ocnc1C	ZINC001171260868	1384481141	/nfs/dbraw/zinc/48/11/41/1384481141.db2.gz	NOUNDDZBJPIXRU-OAHLLOKOSA-N	0	3	344.459	3.049	20	30		EGEDHN
C=CCOC(=O)[C@H](CC(C)C)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1	ZINC001171728541	1384615262	/nfs/dbraw/zinc/61/52/62/1384615262.db2.gz	PVYPPPXFJGPLRM-SXLOBPIMSA-N	0	3	344.499	3.383	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)CCC(F)F	ZINC001171821121	1384650732	/nfs/dbraw/zinc/65/07/32/1384650732.db2.gz	KOGMXEVMRZCFCP-CQSZACIVSA-N	0	3	337.414	3.368	20	30		EGEDHN
C=CCOC(=O)N[C@@H]1CCCN([C@@H]2CSc3ccccc3C2)C1	ZINC001172207596	1384748317	/nfs/dbraw/zinc/74/83/17/1384748317.db2.gz	HXVFSYUCVQPLKB-CVEARBPZSA-N	0	3	332.469	3.080	20	30		EGEDHN
COc1ccc(N2CCN([C@H](C)Cc3ccc(C#N)cc3)CC2)cc1	ZINC001172307070	1384765549	/nfs/dbraw/zinc/76/55/49/1384765549.db2.gz	BLFDHUZCVQZHGM-QGZVFWFLSA-N	0	3	335.451	3.320	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)n1nc(C(F)(F)F)c2c1CNCC2	ZINC001172310983	1384766451	/nfs/dbraw/zinc/76/64/51/1384766451.db2.gz	MVAQXWMBNSFUPZ-NSHDSACASA-N	0	3	334.345	3.223	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)N1CC[C@H](NC(=O)OC(C)(C)C)C1	ZINC001172316951	1384768126	/nfs/dbraw/zinc/76/81/26/1384768126.db2.gz	YXIPEAQALABRCP-PBHICJAKSA-N	0	3	329.444	3.088	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)N1CCN(c2ccc(Cl)cn2)CC1	ZINC001172318980	1384768516	/nfs/dbraw/zinc/76/85/16/1384768516.db2.gz	KKNAIJFQRGBVQR-HNNXBMFYSA-N	0	3	340.858	3.360	20	30		EGEDHN
C[C@H](CCCC#N)N1CCN(c2ccc(Br)cn2)CC1	ZINC001172493481	1384804210	/nfs/dbraw/zinc/80/42/10/1384804210.db2.gz	MJFZQZBXZNTAQG-CYBMUJFWSA-N	0	3	337.265	3.048	20	30		EGEDHN
C[C@@H](CCCC#N)N1CCO[C@]2(CCC[C@H]2COc2cccnc2)C1	ZINC001172498939	1384805418	/nfs/dbraw/zinc/80/54/18/1384805418.db2.gz	PLRACSHGPMDNIT-CMKODMSKSA-N	0	3	343.471	3.414	20	30		EGEDHN
C[C@@H](N[C@H]1CCN(C(=O)OC(C)(C)C)[C@H](C#N)C1)c1cccc(O)c1	ZINC001172972207	1384893010	/nfs/dbraw/zinc/89/30/10/1384893010.db2.gz	XLVGUGVMOUXOSG-KBMXLJTQSA-N	0	3	345.443	3.334	20	30		EGEDHN
CC[C@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C#N)C1)c1ccccn1	ZINC001172972544	1384893987	/nfs/dbraw/zinc/89/39/87/1384893987.db2.gz	BAVJIZAJVFMFMB-PMPSAXMXSA-N	0	3	344.459	3.414	20	30		EGEDHN
CCCC1(C(=O)NC[C@@H]2CCCN(Cc3cccc(C#N)c3)C2)CC1	ZINC001317135824	1384898743	/nfs/dbraw/zinc/89/87/43/1384898743.db2.gz	RYQSAELYQXNPEL-IBGZPJMESA-N	0	3	339.483	3.467	20	30		EGEDHN
C[C@H](CNC(=O)c1cc2ccccc2o1)NCc1ccc(C#N)s1	ZINC001317283285	1385054649	/nfs/dbraw/zinc/05/46/49/1385054649.db2.gz	JRPHNMWFHVKVKS-GFCCVEGCSA-N	0	3	339.420	3.274	20	30		EGEDHN
Cc1csc(Cl)c1C(=O)NCCCNCc1ccccc1C#N	ZINC001174722485	1385139633	/nfs/dbraw/zinc/13/96/33/1385139633.db2.gz	OREVTJZUSRCAEA-UHFFFAOYSA-N	0	3	347.871	3.491	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H](C)CCCCNCc2cnns2)CC1	ZINC001175081621	1385191647	/nfs/dbraw/zinc/19/16/47/1385191647.db2.gz	HNRJLPYRNQFNRC-CQSZACIVSA-N	0	3	336.505	3.049	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)c1csc2c1CC[C@H](C)C2	ZINC001175273424	1385237128	/nfs/dbraw/zinc/23/71/28/1385237128.db2.gz	APYMNQNJUSWBPE-NSHDSACASA-N	0	3	326.893	3.335	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H](CNC(=O)CCCC3CC3)C2)c1	ZINC001317538172	1385270479	/nfs/dbraw/zinc/27/04/79/1385270479.db2.gz	UMOUUVJQFRYTNS-IBGZPJMESA-N	0	3	325.456	3.077	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H](C)CCCCN[C@@H](C)c1nnc(CC)[nH]1	ZINC001175469036	1385301470	/nfs/dbraw/zinc/30/14/70/1385301470.db2.gz	MGYMCUOHZFKYBR-CABCVRRESA-N	0	3	349.523	3.295	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H](C)CCCCNCc1nccn1CC	ZINC001175469439	1385301652	/nfs/dbraw/zinc/30/16/52/1385301652.db2.gz	QJQNASMBVNNBPT-INIZCTEOSA-N	0	3	334.508	3.270	20	30		EGEDHN
Cc1cc(C(=O)NCCCNCc2ccc(C#N)cc2F)sc1C	ZINC001175600486	1385345584	/nfs/dbraw/zinc/34/55/84/1385345584.db2.gz	VDZCQVFKFRBIDS-UHFFFAOYSA-N	0	3	345.443	3.285	20	30		EGEDHN
C=CCC1(C(=O)NCCCNCc2cccnc2OC)CCCCC1	ZINC001176786292	1385697128	/nfs/dbraw/zinc/69/71/28/1385697128.db2.gz	WUHDUCIYZPYLKN-UHFFFAOYSA-N	0	3	345.487	3.213	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)C23CCC(CC2)CC3)c(F)c1	ZINC001176706222	1385666301	/nfs/dbraw/zinc/66/63/01/1385666301.db2.gz	AQOZQCIJPHSMLM-UHFFFAOYSA-N	0	3	343.446	3.264	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)CCCCNCc2ccn(C)n2)CCCC1	ZINC001176848063	1385723279	/nfs/dbraw/zinc/72/32/79/1385723279.db2.gz	PUKFXKVXGNASER-QGZVFWFLSA-N	0	3	346.519	3.321	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)CCc2ccon2)CCCC[C@H]1C	ZINC001318745996	1385852189	/nfs/dbraw/zinc/85/21/89/1385852189.db2.gz	QBYYMBFXLNILQB-DYVFJYSZSA-N	0	3	339.867	3.014	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@H](CC)OC	ZINC001177245941	1385882975	/nfs/dbraw/zinc/88/29/75/1385882975.db2.gz	QEAULZZSIMPSPM-INIZCTEOSA-N	0	3	330.900	3.162	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)COCCC	ZINC001177245971	1385883118	/nfs/dbraw/zinc/88/31/18/1385883118.db2.gz	RYKONPKLURGUND-UHFFFAOYSA-N	0	3	330.900	3.164	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NCCCNCc1cc(Cl)ccc1Cl	ZINC001177273136	1385891941	/nfs/dbraw/zinc/89/19/41/1385891941.db2.gz	IJQRBOZHHSEXKU-GFCCVEGCSA-N	0	3	345.270	3.180	20	30		EGEDHN
C=CCC1(C(=O)NCCCNCc2ccccc2[N+](=O)[O-])CCCC1	ZINC001177552545	1385995055	/nfs/dbraw/zinc/99/50/55/1385995055.db2.gz	KFXXFRXMMJRRFQ-UHFFFAOYSA-N	0	3	345.443	3.327	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)[C@@H](CC)SC)CCCC1	ZINC001319350946	1386073717	/nfs/dbraw/zinc/07/37/17/1386073717.db2.gz	HHDRLFAVNCGSEV-GFCCVEGCSA-N	0	3	349.338	3.055	20	30		EGEDHN
N#CC(Cc1cccs1)C(=O)Nc1cccc(C(F)(F)F)n1	ZINC001177904746	1386079109	/nfs/dbraw/zinc/07/91/09/1386079109.db2.gz	RYLFPPNLQSTPQU-VIFPVBQESA-N	0	3	325.315	3.483	20	30		EGEDHN
COC(=O)c1c(C)scc1NC(=O)C(C#N)Cc1cccs1	ZINC001177905065	1386079374	/nfs/dbraw/zinc/07/93/74/1386079374.db2.gz	VVDPFHCUOWFWBK-JTQLQIEISA-N	0	3	334.422	3.226	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)Cc1ccc(-c2ccccn2)cc1	ZINC001177952611	1386094018	/nfs/dbraw/zinc/09/40/18/1386094018.db2.gz	VODXOZDDLXULSB-IBGZPJMESA-N	0	3	335.451	3.058	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccc(Cl)cc2)CCN1C(=O)C(C)(C)F	ZINC001178022587	1386110382	/nfs/dbraw/zinc/11/03/82/1386110382.db2.gz	GBDJKLPECDQTOH-BBRMVZONSA-N	0	3	336.838	3.019	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2Cl)CCN1C(=O)C(C)(C)F	ZINC001178026082	1386111279	/nfs/dbraw/zinc/11/12/79/1386111279.db2.gz	JRXHRWCAGHZJHM-BBRMVZONSA-N	0	3	336.838	3.019	20	30		EGEDHN
COc1ccc(C#N)cc1CNC[C@@H](C)N(C)C(=O)C(C)(C)C(C)C	ZINC001319463963	1386132988	/nfs/dbraw/zinc/13/29/88/1386132988.db2.gz	LKXYABTZNXWIAM-OAHLLOKOSA-N	0	3	345.487	3.186	20	30		EGEDHN
CC/C=C(\C)C(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@@H]1C	ZINC001178246218	1386170901	/nfs/dbraw/zinc/17/09/01/1386170901.db2.gz	YAPOPVAATDMSJR-ZZARRONKSA-N	0	3	328.431	3.113	20	30		EGEDHN
CC(C)[C@@H](C)CC(=O)N1CC[C@H](NCc2ccc(C#N)s2)[C@@H]1C	ZINC001178311391	1386185908	/nfs/dbraw/zinc/18/59/08/1386185908.db2.gz	BDGIAIXTPUULNA-ZQIUZPCESA-N	0	3	333.501	3.381	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](NCc2cc(F)c(OC)c(F)c2)[C@@H]1C	ZINC001178324177	1386189374	/nfs/dbraw/zinc/18/93/74/1386189374.db2.gz	KKTSYLZXTQEDAR-LRDDRELGSA-N	0	3	338.398	3.019	20	30		EGEDHN
C[C@H]1[C@@H](NCc2ccc(C#N)s2)CCN1C(=O)/C=C/C(C)(C)C	ZINC001178378767	1386202183	/nfs/dbraw/zinc/20/21/83/1386202183.db2.gz	HZVKWKOAMMITKI-YIBPYUTOSA-N	0	3	331.485	3.301	20	30		EGEDHN
N#Cc1ccccc1CNCCCCCCNC(=O)C1(C(F)F)CC1	ZINC001178480088	1386229564	/nfs/dbraw/zinc/22/95/64/1386229564.db2.gz	XSDZUIPGYINHGS-UHFFFAOYSA-N	0	3	349.425	3.370	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NCCCCCCNCc1cnns1	ZINC001178575138	1386254314	/nfs/dbraw/zinc/25/43/14/1386254314.db2.gz	MEICUXDHZAFGOQ-UHFFFAOYSA-N	0	3	344.912	3.083	20	30		EGEDHN
Cc1csc(C(=O)N2CC[C@H](NCC#Cc3ccccc3)[C@@H]2C)c1	ZINC001178621694	1386264137	/nfs/dbraw/zinc/26/41/37/1386264137.db2.gz	KKPQEPJPFCDZKB-WMZOPIPTSA-N	0	3	338.476	3.301	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)[C@@H]1C	ZINC001178795019	1386306775	/nfs/dbraw/zinc/30/67/75/1386306775.db2.gz	FRMDSWDBXQSQBD-KSSFIOAISA-N	0	3	343.446	3.379	20	30		EGEDHN
C=C(Br)CNC[C@@H]1[C@H](C)CCCN1C(=O)c1ccco1	ZINC001319830865	1386323699	/nfs/dbraw/zinc/32/36/99/1386323699.db2.gz	GWUMSUAIEVUZEM-DGCLKSJQSA-N	0	3	341.249	3.019	20	30		EGEDHN
CCC(=O)N1CCC(CCN(C)Cc2cc(C#N)ccc2F)CC1	ZINC001319868752	1386346506	/nfs/dbraw/zinc/34/65/06/1386346506.db2.gz	NALKWEVTICSPRG-UHFFFAOYSA-N	0	3	331.435	3.168	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCCCCCNCc1nnc(C(C)C)[nH]1	ZINC001179306619	1386445062	/nfs/dbraw/zinc/44/50/62/1386445062.db2.gz	JKIAOBBYXUNXCQ-CVEARBPZSA-N	0	3	349.523	3.153	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](NCc2ccc(C#N)s2)[C@@H]1C	ZINC001179314272	1386448261	/nfs/dbraw/zinc/44/82/61/1386448261.db2.gz	SSXMRTUEDNEJFJ-YJBOKZPZSA-N	0	3	343.496	3.282	20	30		EGEDHN
N#Cc1ccc(F)cc1CNCCCCCCNC(=O)[C@@H]1CC12CC2	ZINC001179677741	1386549786	/nfs/dbraw/zinc/54/97/86/1386549786.db2.gz	CJZKPMFLGNXKLB-SFHVURJKSA-N	0	3	343.446	3.264	20	30		EGEDHN
N#Cc1ccccc1CNCCCCCCNC(=O)[C@H]1CC12CC2	ZINC001179678114	1386550499	/nfs/dbraw/zinc/55/04/99/1386550499.db2.gz	LWOIXXPJPJMOHQ-GOSISDBHSA-N	0	3	325.456	3.125	20	30		EGEDHN
CC(C)C[C@@H](C)C(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@@H]1C	ZINC001179794651	1386589065	/nfs/dbraw/zinc/58/90/65/1386589065.db2.gz	QLSITPMNHYISLW-UWVAXJGDSA-N	0	3	344.474	3.438	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccoc2)C[C@@]1(C)CNCc1ccccc1C#N	ZINC001180581356	1386841970	/nfs/dbraw/zinc/84/19/70/1386841970.db2.gz	TXYWXCFECPUQOI-FOIQADDNSA-N	0	3	337.423	3.039	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)NC(=O)CCCc1ccccc1	ZINC001321969493	1387021404	/nfs/dbraw/zinc/02/14/04/1387021404.db2.gz	VJFYEAHEPNRXGU-HNNXBMFYSA-N	0	3	341.480	3.237	20	30		EGEDHN
COc1ccc(C#CC(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1	ZINC001182047913	1387098907	/nfs/dbraw/zinc/09/89/07/1387098907.db2.gz	AJXZWNSTODPTSO-OAQYLSRUSA-N	0	3	348.446	3.000	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2oc(CC)nc2C)C1	ZINC001182465289	1387170935	/nfs/dbraw/zinc/17/09/35/1387170935.db2.gz	SJYBYCFNGCLMRS-FOIQADDNSA-N	0	3	347.503	3.476	20	30		EGEDHN
CC(F)(F)C(=O)NCc1ccc(CNCc2ccc(C#N)cc2)cc1	ZINC001698714685	1406357618	/nfs/dbraw/zinc/35/76/18/1406357618.db2.gz	LEKJXENUPJBYHV-UHFFFAOYSA-N	0	3	343.377	3.119	20	30		EGEDHN
CC[C@@H](NCc1cccc(OCC#N)c1)C(=O)Nc1ccc(C)cc1	ZINC001329633174	1389194948	/nfs/dbraw/zinc/19/49/48/1389194948.db2.gz	POGCWGXBAPIGLC-LJQANCHMSA-N	0	3	337.423	3.404	20	30		EGEDHN
CC(C)CN1CCC[C@@H]1C(=O)Nc1cccc(OCCCC#N)c1	ZINC001337026268	1389239440	/nfs/dbraw/zinc/23/94/40/1389239440.db2.gz	WBNQJNMWQMNOSV-GOSISDBHSA-N	0	3	329.444	3.428	20	30		EGEDHN
C#CC[C@@H](CCOC)NCc1cnc(NC(=O)OC(C)(C)C)s1	ZINC001330109999	1389309556	/nfs/dbraw/zinc/30/95/56/1389309556.db2.gz	ZCOGPFDCYMJPOD-LBPRGKRZSA-N	0	3	339.461	3.008	20	30		EGEDHN
C=C[C@@H](COC)N[C@@H]1CCc2ccc(I)cc21	ZINC001330316870	1389386565	/nfs/dbraw/zinc/38/65/65/1389386565.db2.gz	UOCFWWQLSSMSCS-GXTWGEPZSA-N	0	3	343.208	3.069	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)N1CCn2nc(C3CC3)cc2C1	ZINC001341839848	1390535582	/nfs/dbraw/zinc/53/55/82/1390535582.db2.gz	UEDDQCANLMNKAN-KRWDZBQOSA-N	0	3	332.492	3.181	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N[C@@H](c1cccc(F)c1)c1ccccn1	ZINC001341859020	1390538861	/nfs/dbraw/zinc/53/88/61/1390538861.db2.gz	VPUAQDWETMTOLS-WMZOPIPTSA-N	0	3	327.403	3.110	20	30		EGEDHN
N#CC(C(=O)CSCc1cccs1)C(=O)NC1CCCCC1	ZINC001342518825	1390621575	/nfs/dbraw/zinc/62/15/75/1390621575.db2.gz	JHCGNLXEMGYYLE-AWEZNQCLSA-N	0	3	336.482	3.139	20	30		EGEDHN
N#CC(C(=O)CCc1nc(-c2cccs2)no1)c1cccc(F)n1	ZINC001342556834	1390626174	/nfs/dbraw/zinc/62/61/74/1390626174.db2.gz	BWVZHBJUWUKPKP-JTQLQIEISA-N	0	3	342.355	3.141	20	30		EGEDHN
N#CC(C(=O)CC[C@@H]1CCCCO1)c1nccn1Cc1ccccc1	ZINC001342924806	1390673204	/nfs/dbraw/zinc/67/32/04/1390673204.db2.gz	NZNMSBYYTANSHX-ROUUACIJSA-N	0	3	337.423	3.457	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)c2ccnc(Cl)c2)cc1	ZINC001343291072	1390705268	/nfs/dbraw/zinc/70/52/68/1390705268.db2.gz	DHJSRSZJESCYGO-AWEZNQCLSA-N	0	3	327.771	3.259	20	30		EGEDHN
C=C(C)Cn1c(CCCCC#N)nnc1N1CCN([C@H](C)CC)CC1	ZINC001343490147	1390717315	/nfs/dbraw/zinc/71/73/15/1390717315.db2.gz	MFYMSYXKGOXOAY-QGZVFWFLSA-N	0	3	344.507	3.011	20	30		EGEDHN
CCCc1c(C(=O)C(C#N)c2nccn2C)cnn1-c1ccccc1C	ZINC001343705417	1390732242	/nfs/dbraw/zinc/73/22/42/1390732242.db2.gz	RDIFXZDKDUPIOB-HNNXBMFYSA-N	0	3	347.422	3.357	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CCCN(C)C2)nnc1N1CCC[C@@H](C)CC1	ZINC001343966122	1390747084	/nfs/dbraw/zinc/74/70/84/1390747084.db2.gz	JDZSPZQRRGQALQ-SJORKVTESA-N	0	3	331.508	3.290	20	30		EGEDHN
CCCCOCC(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1Cl	ZINC001346039563	1390902338	/nfs/dbraw/zinc/90/23/38/1390902338.db2.gz	MRVQPFRHMCKFDR-NSHDSACASA-N	0	3	343.210	3.457	20	30		EGEDHN
CCn1cc(C(=O)C(C#N)c2nc3c(cccc3Cl)[nH]2)c(C)n1	ZINC001346150190	1390911299	/nfs/dbraw/zinc/91/12/99/1390911299.db2.gz	ILBKYVSSPBUICW-JTQLQIEISA-N	0	3	327.775	3.231	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)NCc1cc(Cl)c(OCC)c(OC)c1	ZINC001353182748	1391953170	/nfs/dbraw/zinc/95/31/70/1391953170.db2.gz	METRMARSLBXXLR-CQSZACIVSA-N	0	3	340.851	3.047	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)NC1(c2ccc(Br)cc2)CC1	ZINC001353202853	1391957942	/nfs/dbraw/zinc/95/79/42/1391957942.db2.gz	ZCUPMSGAZDNXHL-AWEZNQCLSA-N	0	3	337.261	3.238	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)Cc2cccc(C3CC3)c2)C1	ZINC001479384626	1392230107	/nfs/dbraw/zinc/23/01/07/1392230107.db2.gz	YCQIYSDWAQMKKZ-RZDIXWSQSA-N	0	3	332.875	3.343	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1ccn(C(F)F)n1	ZINC001479820737	1392410948	/nfs/dbraw/zinc/41/09/48/1392410948.db2.gz	CRIYCGKXBHMRCM-DGCLKSJQSA-N	0	3	346.809	3.004	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)CCC2(C)CC2)CC1	ZINC001480409075	1392745384	/nfs/dbraw/zinc/74/53/84/1392745384.db2.gz	ACNJWPBCSXKEKF-UHFFFAOYSA-N	0	3	343.309	3.492	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1cc(-c2ccccc2)on1	ZINC001480777825	1392927412	/nfs/dbraw/zinc/92/74/12/1392927412.db2.gz	GFPADJQAYPLYFL-CYBMUJFWSA-N	0	3	333.819	3.192	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)C(C)(C)c1cccc(F)c1	ZINC001480790424	1392935235	/nfs/dbraw/zinc/93/52/35/1392935235.db2.gz	MWMGDMSPJNIAMC-ZDUSSCGKSA-N	0	3	326.843	3.340	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1cc(F)ccc1OC)C1CC1	ZINC001481938520	1394606111	/nfs/dbraw/zinc/60/61/11/1394606111.db2.gz	HWCNHBRPYSEKRJ-QGZVFWFLSA-N	0	3	340.826	3.075	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)[C@@H]1C[C@H]1CC(C)(C)C	ZINC001482101866	1394747181	/nfs/dbraw/zinc/74/71/81/1394747181.db2.gz	HRGZTJOBCHBRML-AYOQOUSVSA-N	0	3	341.499	3.472	20	30		EGEDHN
C[C@@H](CNCc1ccccc1C#N)CNC(=O)[C@@H]1C[C@H]1CC(C)(C)C	ZINC001482101869	1394748280	/nfs/dbraw/zinc/74/82/80/1394748280.db2.gz	HRGZTJOBCHBRML-ZYSHUDEJSA-N	0	3	341.499	3.472	20	30		EGEDHN
Cc1scc(C(=O)NC[C@@H](C)CNCc2ccccc2C#N)c1C	ZINC001482104690	1394748840	/nfs/dbraw/zinc/74/88/40/1394748840.db2.gz	ADQPAABJZTXQEI-ZDUSSCGKSA-N	0	3	341.480	3.392	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)[C@]23C[C@H]2CCC3)CCCC1	ZINC001482225435	1394819758	/nfs/dbraw/zinc/81/97/58/1394819758.db2.gz	VSULGMSSTXJILH-CZUORRHYSA-N	0	3	341.293	3.104	20	30		EGEDHN
C[C@@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)CCC1CCC1	ZINC001482270316	1394857614	/nfs/dbraw/zinc/85/76/14/1394857614.db2.gz	YOGUWRAIJVQKFE-AWEZNQCLSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)CCc1ccc(F)cc1)C(C)C	ZINC001698966891	1406726668	/nfs/dbraw/zinc/72/66/68/1406726668.db2.gz	YYYNPXCITDFHEY-INIZCTEOSA-N	0	3	326.843	3.241	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cnc2ccccc2c1)C(C)C	ZINC001698971190	1406734738	/nfs/dbraw/zinc/73/47/38/1406734738.db2.gz	MHHHNNCEPQFUHJ-QGZVFWFLSA-N	0	3	331.847	3.331	20	30		EGEDHN
CS[C@@H](C)CC(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001483964101	1395165752	/nfs/dbraw/zinc/16/57/52/1395165752.db2.gz	APAVDNKVBXCKRB-HNNXBMFYSA-N	0	3	345.512	3.171	20	30		EGEDHN
C=C(Br)CNCC(C)(C)CN(C)C(=O)CC(C)(F)F	ZINC001485261079	1395746686	/nfs/dbraw/zinc/74/66/86/1395746686.db2.gz	VUJVMTFOBUMEDG-UHFFFAOYSA-N	0	3	341.240	3.015	20	30		EGEDHN
C[C@H](CNC(=O)c1cccc2c1CCC2)N(C)Cc1ccc(C#N)cc1	ZINC001485391130	1395884266	/nfs/dbraw/zinc/88/42/66/1395884266.db2.gz	NWLJYDCMINRVGE-MRXNPFEDSA-N	0	3	347.462	3.297	20	30		EGEDHN
C[C@@H](CCNC(=O)CCC(F)(F)F)NCc1cc(C#N)ccc1F	ZINC001491999924	1396302048	/nfs/dbraw/zinc/30/20/48/1396302048.db2.gz	KZABFFSQBDKEDE-NSHDSACASA-N	0	3	345.340	3.024	20	30		EGEDHN
C[C@H](CCNC(=O)c1ccc2c(c1)CCC2)NCc1ccccc1C#N	ZINC001492123631	1396306202	/nfs/dbraw/zinc/30/62/02/1396306202.db2.gz	PQALPXCVRXBRSA-MRXNPFEDSA-N	0	3	347.462	3.345	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)C2CC(C)(C)C2)CCCC1	ZINC001495909589	1396571310	/nfs/dbraw/zinc/57/13/10/1396571310.db2.gz	BGQPTMVQTLTITC-UHFFFAOYSA-N	0	3	343.309	3.350	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1cnc(CC)s1	ZINC001689911260	1404204082	/nfs/dbraw/zinc/20/40/82/1404204082.db2.gz	DEFDHIYETWWSOB-CHWSQXEVSA-N	0	3	341.908	3.431	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](NCc2ccc(F)c(F)c2)C1	ZINC001690673216	1404688305	/nfs/dbraw/zinc/68/83/05/1404688305.db2.gz	BWNOEAXMBFUOOB-INIZCTEOSA-N	0	3	334.410	3.239	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1ncoc1-c1ccccc1	ZINC001690844927	1404773453	/nfs/dbraw/zinc/77/34/53/1404773453.db2.gz	UCXHPIUPCAUURN-CYBMUJFWSA-N	0	3	333.819	3.192	20	30		EGEDHN
C[C@H](CCNC(=O)C(C)(C)C1CCC1)NCc1ccccc1C#N	ZINC001690856342	1404779421	/nfs/dbraw/zinc/77/94/21/1404779421.db2.gz	KFMNAMZWLBXICP-OAHLLOKOSA-N	0	3	327.472	3.369	20	30		EGEDHN
CCN(CCNC(=O)C1C(C)(C)C1(C)C)Cc1ccc(C#N)cc1	ZINC001691014174	1404929638	/nfs/dbraw/zinc/92/96/38/1404929638.db2.gz	LHCISUYJFIQOBV-UHFFFAOYSA-N	0	3	327.472	3.179	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)Cc2cccc(C3CC3)c2)C1	ZINC001691105265	1405044606	/nfs/dbraw/zinc/04/46/06/1405044606.db2.gz	YCQIYSDWAQMKKZ-RHNCMZPLSA-N	0	3	332.875	3.343	20	30		EGEDHN
CCCN(CCNC(=O)[C@@H](C)C(C)(F)F)Cc1cccc(C#N)c1	ZINC001691190650	1405129858	/nfs/dbraw/zinc/12/98/58/1405129858.db2.gz	JQPGJVROOXDROG-CQSZACIVSA-N	0	3	337.414	3.178	20	30		EGEDHN
C[C@H](C#N)C(=O)NC[C@H]1C[C@@H](NCc2c(Cl)oc3ccccc32)C1	ZINC001691694273	1405428037	/nfs/dbraw/zinc/42/80/37/1405428037.db2.gz	JQLISHZVOJDVLJ-UPJWGTAASA-N	0	3	345.830	3.230	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCC1CN(Cc2ccc(-c3ccccc3)cc2)C1	ZINC001732122733	1428373429	/nfs/dbraw/zinc/37/34/29/1428373429.db2.gz	SVXPFGFKKTTXRQ-INIZCTEOSA-N	0	3	333.435	3.061	20	30		EGEDHN
CC[C@H](CNC(=O)Cc1ccsc1C)NCc1ccc(C#N)s1	ZINC001732223724	1428472380	/nfs/dbraw/zinc/47/23/80/1428472380.db2.gz	PZMDRAYFEDHCLC-CQSZACIVSA-N	0	3	347.509	3.217	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1cccc2[nH]ccc21)C1CC1	ZINC001732248229	1428491436	/nfs/dbraw/zinc/49/14/36/1428491436.db2.gz	PPOKVHBJXHGZLD-SFHVURJKSA-N	0	3	331.847	3.409	20	30		EGEDHN
CC(C)c1occc1C(=O)NC[C@H](C)CNCc1ccccc1C#N	ZINC001732371759	1428552857	/nfs/dbraw/zinc/55/28/57/1428552857.db2.gz	FNMZWQUTHKFTMC-OAHLLOKOSA-N	0	3	339.439	3.430	20	30		EGEDHN
CC(C)(C)CC(=O)N[C@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001699568316	1412924576	/nfs/dbraw/zinc/92/45/76/1412924576.db2.gz	BMGQMRKSHVZJIP-QGZVFWFLSA-N	0	3	331.435	3.118	20	30		EGEDHN
CC(F)(F)CCC(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001699771265	1413177666	/nfs/dbraw/zinc/17/76/66/1413177666.db2.gz	UTSFFDNRHROEPL-UHFFFAOYSA-N	0	3	349.425	3.464	20	30		EGEDHN
CC(F)(F)C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1C#N	ZINC001699975738	1413416636	/nfs/dbraw/zinc/41/66/36/1413416636.db2.gz	VDQYZTSOTUIIIP-AYGBPOKTSA-N	0	3	347.409	3.073	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)c3cccs3)CCC2)s1	ZINC001700128799	1413543755	/nfs/dbraw/zinc/54/37/55/1413543755.db2.gz	CWBJNCMVNDBGII-UHFFFAOYSA-N	0	3	331.466	3.124	20	30		EGEDHN
CN(C(=O)CC1CCC1)[C@@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001700718908	1414378622	/nfs/dbraw/zinc/37/86/22/1414378622.db2.gz	MFDJJKLRNFDPHE-KRWDZBQOSA-N	0	3	331.485	3.137	20	30		EGEDHN
Cc1cc(C)c(C(=O)N(C)C[C@H](C)NCc2ccc(F)c(C#N)c2)o1	ZINC001700747813	1414417361	/nfs/dbraw/zinc/41/73/61/1414417361.db2.gz	MJKJOUONZRXVKS-ZDUSSCGKSA-N	0	3	343.402	3.158	20	30		EGEDHN
CC(C)(C)[C@@H](CNCc1cc(C#N)ccc1F)NC(=O)CCCF	ZINC001700993513	1414639813	/nfs/dbraw/zinc/63/98/13/1414639813.db2.gz	IMQCCQZWWCJDLZ-MRXNPFEDSA-N	0	3	337.414	3.068	20	30		EGEDHN
Cc1ccc(CNCc2ccc(CNC(=O)[C@@H](C)C#N)c(F)c2)cc1	ZINC001701063503	1414721029	/nfs/dbraw/zinc/72/10/29/1414721029.db2.gz	LISDBJPGHZZVGO-HNNXBMFYSA-N	0	3	339.414	3.200	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)NC(=O)C1CCC2(CC2)CC1	ZINC001732963484	1429087609	/nfs/dbraw/zinc/08/76/09/1429087609.db2.gz	JENKNMOICFLFEP-CYBMUJFWSA-N	0	3	331.485	3.184	20	30		EGEDHN
C[C@H](CN(C)Cc1cccc(C#N)c1)NC(=O)c1cc(F)ccc1F	ZINC001733044770	1429176866	/nfs/dbraw/zinc/17/68/66/1429176866.db2.gz	JQMAPRLXUOZJNU-CYBMUJFWSA-N	0	3	343.377	3.087	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)CCc1cc(C)on1	ZINC001713001283	1417554476	/nfs/dbraw/zinc/55/44/76/1417554476.db2.gz	YSELTONDXPTMJJ-HOCLYGCPSA-N	0	3	339.867	3.027	20	30		EGEDHN
CC(C)(C)CC(=O)NC[C@H](NCc1ccc(C#N)cc1F)C1CC1	ZINC001713105051	1417664070	/nfs/dbraw/zinc/66/40/70/1417664070.db2.gz	KFULVSDRAPDERC-KRWDZBQOSA-N	0	3	331.435	3.118	20	30		EGEDHN
C[C@@H](NC(=O)CC1CC1)[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001713272186	1417886539	/nfs/dbraw/zinc/88/65/39/1417886539.db2.gz	SLEUYVIDFRJYRQ-BEFAXECRSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1ccc(Cl)cc1OC	ZINC001713416045	1418039403	/nfs/dbraw/zinc/03/94/03/1418039403.db2.gz	IYACGPUHKGRJTB-LLVKDONJSA-N	0	3	331.243	3.199	20	30		EGEDHN
C=CCCC(=O)N1CCC(CN(C)Cc2cc(C3CC3)no2)CC1	ZINC001713760687	1418568615	/nfs/dbraw/zinc/56/86/15/1418568615.db2.gz	DLERTQMLSCRPSX-UHFFFAOYSA-N	0	3	331.460	3.189	20	30		EGEDHN
C[C@@H](CC(=O)N(C)C1CCN(Cc2ccc(C#N)cc2)CC1)C1CC1	ZINC001713785557	1418602282	/nfs/dbraw/zinc/60/22/82/1418602282.db2.gz	UBMOOFOYIBMSEH-INIZCTEOSA-N	0	3	339.483	3.417	20	30		EGEDHN
CC(C)(C(=O)NC[C@@H]1CCCN(Cc2ccc(C#N)cc2)C1)C(F)F	ZINC001714042903	1418833308	/nfs/dbraw/zinc/83/33/08/1418833308.db2.gz	IUIPTRDALSUOHA-INIZCTEOSA-N	0	3	349.425	3.178	20	30		EGEDHN
CC[C@H](CNC(=O)c1cccc(F)c1)NCc1ccc(C#N)s1	ZINC001714055446	1418853552	/nfs/dbraw/zinc/85/35/52/1418853552.db2.gz	GKEYWNYQXLGWLD-CQSZACIVSA-N	0	3	331.416	3.057	20	30		EGEDHN
CC[C@H](CNC(=O)Cc1cccc(C)c1)NCc1ccc(C#N)s1	ZINC001714098403	1418893145	/nfs/dbraw/zinc/89/31/45/1418893145.db2.gz	NPHXSJMQYWAVIC-MRXNPFEDSA-N	0	3	341.480	3.155	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2cc(C)no2)CCCC[C@H]1C	ZINC001714177192	1418984907	/nfs/dbraw/zinc/98/49/07/1418984907.db2.gz	DHOOYQBXWDGJGH-BZNIZROVSA-N	0	3	325.840	3.004	20	30		EGEDHN
Cc1cc(Cl)ccc1C(=O)NC[C@@H](C)NCc1ccc(C#N)s1	ZINC001714270592	1419051726	/nfs/dbraw/zinc/05/17/26/1419051726.db2.gz	QWBVHWKOBYVSCS-GFCCVEGCSA-N	0	3	347.871	3.490	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@@H](C)NCc2ccc(C#N)s2)cc1Cl	ZINC001714270960	1419051896	/nfs/dbraw/zinc/05/18/96/1419051896.db2.gz	YOYQLAWBUIHOJA-GFCCVEGCSA-N	0	3	347.871	3.490	20	30		EGEDHN
COc1ccc(CN[C@@H](C)CNC(=O)C(C)(C)CC(C)C)cc1C#N	ZINC001714290549	1419068925	/nfs/dbraw/zinc/06/89/25/1419068925.db2.gz	IFELWOMFGNVCRR-HNNXBMFYSA-N	0	3	345.487	3.233	20	30		EGEDHN
CC(C)c1occc1C(=O)NC[C@H](C)NCc1ccc(F)c(C#N)c1	ZINC001714311324	1419091734	/nfs/dbraw/zinc/09/17/34/1419091734.db2.gz	ZXARFTNKSXWNRD-ZDUSSCGKSA-N	0	3	343.402	3.322	20	30		EGEDHN
C=C(Br)CN[C@@H](C)CCNC(=O)c1ccoc1C(C)C	ZINC001714505151	1419232037	/nfs/dbraw/zinc/23/20/37/1419232037.db2.gz	WUQQFAMOADTDNN-LBPRGKRZSA-N	0	3	343.265	3.410	20	30		EGEDHN
C[C@@H](CNCc1ccccc1C#N)CNC(=O)[C@@H]1CCCC1(C)C	ZINC001715243696	1419971626	/nfs/dbraw/zinc/97/16/26/1419971626.db2.gz	CDNJNCFBGVCNDH-YJBOKZPZSA-N	0	3	327.472	3.226	20	30		EGEDHN
N#Cc1ccc(C[NH2+]C2(CNC(=O)c3ccccc3[O-])CCCC2)cc1	ZINC001715297805	1420004798	/nfs/dbraw/zinc/00/47/98/1420004798.db2.gz	YVOQSZFWGZBQMB-UHFFFAOYSA-N	0	3	349.434	3.096	20	30		EGEDHN
C=C(Br)CN[C@H](CNC(=O)CC1CCCC1)C(C)C	ZINC001715486814	1420168294	/nfs/dbraw/zinc/16/82/94/1420168294.db2.gz	LQGBKIHAYGXHAZ-CQSZACIVSA-N	0	3	331.298	3.206	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cc(CC(C)C)c[nH]1)C(C)C	ZINC001715501872	1420184620	/nfs/dbraw/zinc/18/46/20/1420184620.db2.gz	GNABEDSUBHNUOG-MRXNPFEDSA-N	0	3	325.884	3.310	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)NC(=O)c1sccc1C1CC1	ZINC001716006639	1420460422	/nfs/dbraw/zinc/46/04/22/1420460422.db2.gz	MNFZYBKQQVSWOI-NSHDSACASA-N	0	3	345.493	3.467	20	30		EGEDHN
C[C@H](CN(C)Cc1cccc(C#N)c1)NC(=O)c1ccnc(C2CC2)c1	ZINC001716032498	1420491776	/nfs/dbraw/zinc/49/17/76/1420491776.db2.gz	QOIJDLLUJHQZFV-OAHLLOKOSA-N	0	3	348.450	3.081	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)C(C)(C)C(F)(F)F	ZINC001716501066	1420728005	/nfs/dbraw/zinc/72/80/05/1420728005.db2.gz	PPWHBWAVQDJGMH-GFCCVEGCSA-N	0	3	341.377	3.083	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](NC(=O)c2cccs2)C2CC2)c(F)c1	ZINC001723272398	1424326265	/nfs/dbraw/zinc/32/62/65/1424326265.db2.gz	MRBFZFBTRSUEQY-MRXNPFEDSA-N	0	3	343.427	3.057	20	30		EGEDHN
CCC[C@@H](C(=O)NCC1(NCc2cccc(C#N)c2)CC1)C(C)C	ZINC001723569266	1424468682	/nfs/dbraw/zinc/46/86/82/1424468682.db2.gz	BLUVUXRZUQCGRT-GOSISDBHSA-N	0	3	327.472	3.369	20	30		EGEDHN
CC(C)(F)C(=O)NC[C@]1(C)CCCN(Cc2ccc(C#N)cc2)C1	ZINC001724312086	1424796650	/nfs/dbraw/zinc/79/66/50/1424796650.db2.gz	RZNPUEHBICMWSM-IBGZPJMESA-N	0	3	331.435	3.025	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)CCC2CC2)CCN1Cc1cccc(C#N)c1	ZINC001724988162	1425388615	/nfs/dbraw/zinc/38/86/15/1425388615.db2.gz	FNKNLCKQPAMWAK-BEFAXECRSA-N	0	3	325.456	3.218	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)[C@@H]1C[C@H]1c1c(F)cccc1F	ZINC001725007159	1425420516	/nfs/dbraw/zinc/42/05/16/1425420516.db2.gz	BITXFUKDCWJLGI-YNEHKIRRSA-N	0	3	342.817	3.305	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)COc1ccsc1	ZINC001731290537	1427232670	/nfs/dbraw/zinc/23/26/70/1427232670.db2.gz	AAPRPKNZFMZBGS-ZFWWWQNUSA-N	0	3	342.892	3.239	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1cc2c[nH]ccc-2n1	ZINC001731292455	1427234618	/nfs/dbraw/zinc/23/46/18/1427234618.db2.gz	FETYVMSYZXVVOH-CXAGYDPISA-N	0	3	346.862	3.288	20	30		EGEDHN
C[C@@H](C#N)C(=O)N(C)C1CCN([C@@H]2CCc3c2cccc3Cl)CC1	ZINC001731346922	1427284615	/nfs/dbraw/zinc/28/46/15/1427284615.db2.gz	SWKILUZXTLCYAG-SCLBCKFNSA-N	0	3	345.874	3.410	20	30		EGEDHN
CCC(CC)C(=O)NC[C@@H](NCc1cc(C#N)ccc1F)C1CC1	ZINC001731391771	1427344814	/nfs/dbraw/zinc/34/48/14/1427344814.db2.gz	IWLNSLHTEALFQJ-GOSISDBHSA-N	0	3	331.435	3.118	20	30		EGEDHN
CC[C@H](CC(=O)N1CC[C@H](NCc2ccc(F)c(C#N)c2)C1)C(C)C	ZINC001731647352	1427705049	/nfs/dbraw/zinc/70/50/49/1427705049.db2.gz	NLNKKQBXEKYSLY-AEFFLSMTSA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@H](CCNC(=O)c1c(F)cccc1F)NCc1ccccc1C#N	ZINC001731739197	1427824325	/nfs/dbraw/zinc/82/43/25/1427824325.db2.gz	GCRNVFWKPJKQBZ-CYBMUJFWSA-N	0	3	343.377	3.135	20	30		EGEDHN
CCCC(=O)NC[C@@H]1CCCCCN1Cc1ccc(OCC#N)cc1	ZINC001734100858	1437885784	/nfs/dbraw/zinc/88/57/84/1437885784.db2.gz	PVFMYPDROFPWKC-SFHVURJKSA-N	0	3	343.471	3.250	20	30		EGEDHN
C=C(C)CCC(=O)N1CCCC[C@@H]1[C@H](C)NCc1cnc(C)nc1	ZINC001752145016	1440145693	/nfs/dbraw/zinc/14/56/93/1440145693.db2.gz	FDQISYLKOZJZFV-MAUKXSAKSA-N	0	3	330.476	3.001	20	30		EGEDHN
CCN(CC#Cc1ccccc1)CCCNC(=O)[C@@H]1C[C@H]1C(C)C	ZINC001752222414	1440156572	/nfs/dbraw/zinc/15/65/72/1440156572.db2.gz	GPBLIJCWSCOLDO-VQTJNVASSA-N	0	3	326.484	3.158	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC12CCN(CCc1ccc(F)c(F)c1)CC2	ZINC001752420509	1440175752	/nfs/dbraw/zinc/17/57/52/1440175752.db2.gz	FTAKKLDNJVNOQY-GOSISDBHSA-N	0	3	348.437	3.444	20	30		EGEDHN
CCCN(C(=O)[C@H](C)C#N)C1CCN(Cc2ccc(F)cc2C)CC1	ZINC001752431571	1440178299	/nfs/dbraw/zinc/17/82/99/1440178299.db2.gz	KEMQVNMZDKZBLE-MRXNPFEDSA-N	0	3	345.462	3.497	20	30		EGEDHN
COCC#CCN1CCC2(C[C@@H]2NC(=O)[C@@H](C)CCC(C)(C)C)CC1	ZINC001752434778	1440179852	/nfs/dbraw/zinc/17/98/52/1440179852.db2.gz	IUSCKIAZGVVWJA-ROUUACIJSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@H](NCc1c(C)noc1CC)C1CC1	ZINC001752471810	1440184522	/nfs/dbraw/zinc/18/45/22/1440184522.db2.gz	FTBBNIQILNOPJI-INIZCTEOSA-N	0	3	333.476	3.132	20	30		EGEDHN
C[C@H](C(=O)NC[C@@H](NCc1ccc(C#N)s1)C1CC1)c1ccco1	ZINC001752481718	1440185742	/nfs/dbraw/zinc/18/57/42/1440185742.db2.gz	GHKXGLQSAOOPEL-BLLLJJGKSA-N	0	3	343.452	3.001	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)c1cnn(CCC)c1C	ZINC001752542926	1440194759	/nfs/dbraw/zinc/19/47/59/1440194759.db2.gz	HZQHDYBLHQTDNF-NXHRZFHOSA-N	0	3	344.503	3.245	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)c1cc2c([nH]1)CCC2	ZINC001752543023	1440194765	/nfs/dbraw/zinc/19/47/65/1440194765.db2.gz	JMOVFSDNDCYADW-OIISXLGYSA-N	0	3	327.472	3.147	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1C[C@H](N[C@H](C)c2ccccc2Cl)C1	ZINC001752691872	1440200588	/nfs/dbraw/zinc/20/05/88/1440200588.db2.gz	NKTBPJCMFYQEBZ-RBSFLKMASA-N	0	3	336.863	3.231	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)[C@@H](C)CCc2ccc(F)cc2)C1	ZINC001752783824	1440210141	/nfs/dbraw/zinc/21/01/41/1440210141.db2.gz	PVKKKWXNCCFTBO-PKOBYXMFSA-N	0	3	344.474	3.246	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@@H]1CCCN(Cc2scnc2C)C1	ZINC001752784695	1440210736	/nfs/dbraw/zinc/21/07/36/1440210736.db2.gz	HRERAMBULAJDJZ-KRWDZBQOSA-N	0	3	347.528	3.363	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](CNCc2nc(C(C)(C)C)cs2)C1	ZINC001752934041	1440250188	/nfs/dbraw/zinc/25/01/88/1440250188.db2.gz	CXYMRKNEHADYER-HNNXBMFYSA-N	0	3	347.528	3.182	20	30		EGEDHN
CC/C=C(/C)C(=O)N1CCC[C@H](N(C)Cc2ccc(F)c(C#N)c2)C1	ZINC001752988122	1440258758	/nfs/dbraw/zinc/25/87/58/1440258758.db2.gz	HNOAEVJOLYCYDH-HMMSMWIJSA-N	0	3	343.446	3.476	20	30		EGEDHN
CC#CCN(C)[C@@H]1CCCN(C(=O)c2csc3c2CC[C@H](C)C3)C1	ZINC001753001149	1440264528	/nfs/dbraw/zinc/26/45/28/1440264528.db2.gz	XOBRVHVJHGZULU-JKSUJKDBSA-N	0	3	344.524	3.433	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)[C@H](C)CCCc2ccccc2)C1	ZINC001753000971	1440264599	/nfs/dbraw/zinc/26/45/99/1440264599.db2.gz	WXEZOWJEGMYNHL-QUCCMNQESA-N	0	3	326.484	3.201	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCC[C@@H]1CCCN1Cc1sccc1Cl	ZINC001753025733	1440271301	/nfs/dbraw/zinc/27/13/01/1440271301.db2.gz	ZXZFOHIHEZFDOH-QWHCGFSZSA-N	0	3	339.892	3.422	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1CCCNC(=O)c1ncoc1C1CC1	ZINC001753036550	1440274950	/nfs/dbraw/zinc/27/49/50/1440274950.db2.gz	ADAUKIJNWYIKGJ-CQSZACIVSA-N	0	3	337.851	3.279	20	30		EGEDHN
CCN(CCNC(=O)[C@@H]1CCC[C@H](C)C1)Cc1cccc(C#N)c1	ZINC001753087830	1440297230	/nfs/dbraw/zinc/29/72/30/1440297230.db2.gz	RZCCMQOSXALBEO-QFBILLFUSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H]1CCN(Cc2cccc(C(C)C)n2)C1	ZINC001753128786	1440315808	/nfs/dbraw/zinc/31/58/08/1440315808.db2.gz	KDNGVMAQVVGDFQ-KRWDZBQOSA-N	0	3	329.488	3.499	20	30		EGEDHN
COc1ccc(CN(CCNC(=O)C#CC(C)(C)C)C2CC2)cc1C	ZINC001753153108	1440329096	/nfs/dbraw/zinc/32/90/96/1440329096.db2.gz	MSTQLEXOXXOFBU-UHFFFAOYSA-N	0	3	342.483	3.134	20	30		EGEDHN
Cc1cccc(F)c1C(=O)N(C)CCNCc1ccc(F)c(C#N)c1	ZINC001753267572	1440345104	/nfs/dbraw/zinc/34/51/04/1440345104.db2.gz	HBIMZACYGNXRPO-UHFFFAOYSA-N	0	3	343.377	3.007	20	30		EGEDHN
C=CCN[C@H](CNC(=O)c1coc(Br)c1)c1ccccc1	ZINC001753299114	1440353474	/nfs/dbraw/zinc/35/34/74/1440353474.db2.gz	SUDPUPDZWNOMNC-CQSZACIVSA-N	0	3	349.228	3.289	20	30		EGEDHN
C#CCCN[C@H](CNC(=O)c1cnc2ccsc2c1)c1ccccc1	ZINC001753302044	1440354321	/nfs/dbraw/zinc/35/43/21/1440354321.db2.gz	SQSRPVKSZZEMOJ-GOSISDBHSA-N	0	3	349.459	3.380	20	30		EGEDHN
C=C(C)CN[C@H](CNC(=O)CC#Cc1ccccc1)c1ccccc1	ZINC001753302413	1440354425	/nfs/dbraw/zinc/35/44/25/1440354425.db2.gz	AZJYRUXGCDTVQX-OAQYLSRUSA-N	0	3	332.447	3.451	20	30		EGEDHN
C[C@H](CC(=O)NCC[C@@H]1CCN(Cc2ccc(C#N)s2)C1)C1CC1	ZINC001753340811	1440375343	/nfs/dbraw/zinc/37/53/43/1440375343.db2.gz	KEVLENJFCIONAQ-HUUCEWRRSA-N	0	3	345.512	3.384	20	30		EGEDHN
C=CCCC(=O)N1CCC(CN(C)Cc2ccc(C#N)cc2F)CC1	ZINC001753363381	1440383791	/nfs/dbraw/zinc/38/37/91/1440383791.db2.gz	PBPDDCHTPLVIFD-UHFFFAOYSA-N	0	3	343.446	3.334	20	30		EGEDHN
Cc1cc(CN(C)CC2CCN(C(=O)C#CC(C)(C)C)CC2)sn1	ZINC001753364125	1440384414	/nfs/dbraw/zinc/38/44/14/1440384414.db2.gz	PVPXTKFMHHYTFF-UHFFFAOYSA-N	0	3	347.528	3.171	20	30		EGEDHN
C=CCC1(C(=O)N(C)[C@@H]2CCN(C[C@@H]3CCCCO3)C2)CCCC1	ZINC001753451166	1440405795	/nfs/dbraw/zinc/40/57/95/1440405795.db2.gz	YMQPDQWXRPRIDQ-MSOLQXFVSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCN1CC[C@H](N(CC)C(=O)CCOc2c(C)cccc2C)C1	ZINC001753457131	1440408733	/nfs/dbraw/zinc/40/87/33/1440408733.db2.gz	KLAOZNVWWAPUEW-SFHVURJKSA-N	0	3	330.472	3.181	20	30		EGEDHN
CC[C@@H](CNC(=O)c1cc2c([nH]1)CCCC2)NCC#Cc1ccccc1	ZINC001753492072	1440419906	/nfs/dbraw/zinc/41/99/06/1440419906.db2.gz	GONWOYZDWWQFGN-IBGZPJMESA-N	0	3	349.478	3.043	20	30		EGEDHN
CC[C@H](CNC(=O)[C@@H](C)C1CCCC1)NCC#Cc1ccc(F)cc1	ZINC001753492427	1440420065	/nfs/dbraw/zinc/42/00/65/1440420065.db2.gz	NKOUVQUFBMPKTJ-OXJNMPFZSA-N	0	3	344.474	3.488	20	30		EGEDHN
C#CCC1(C(=O)NC[C@@H](CC)NCc2ccccn2)CCCCC1	ZINC001753497985	1440422373	/nfs/dbraw/zinc/42/23/73/1440422373.db2.gz	SODSTGOFNGYELW-QGZVFWFLSA-N	0	3	327.472	3.040	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@@](C)(CNCc1cccc(F)c1F)C1CC1	ZINC001753518950	1440428122	/nfs/dbraw/zinc/42/81/22/1440428122.db2.gz	SZPYXKLQTBIHQQ-FQEVSTJZSA-N	0	3	348.437	3.389	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)C[C@H]1Cc2ccccc2O1)C1CC1	ZINC001753519062	1440428162	/nfs/dbraw/zinc/42/81/62/1440428162.db2.gz	WCMCLCMZXLXSPB-APWZRJJASA-N	0	3	348.874	3.007	20	30		EGEDHN
C=CCCC(=O)N[C@]1(CNCc2cccc(OC)n2)CCCC[C@H]1C	ZINC001753531429	1440431190	/nfs/dbraw/zinc/43/11/90/1440431190.db2.gz	HWIPJNFATSXDOQ-UZLBHIALSA-N	0	3	345.487	3.211	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC(CCNCc2cc(C)no2)CC1	ZINC001753572727	1440438709	/nfs/dbraw/zinc/43/87/09/1440438709.db2.gz	DDCXVYYHEKHBNA-IBGZPJMESA-N	0	3	333.476	3.304	20	30		EGEDHN
C=CCCCC(=O)NCCC1CCN([C@H](C)c2cnccn2)CC1	ZINC001753596841	1440444981	/nfs/dbraw/zinc/44/49/81/1440444981.db2.gz	IRYJSLNNMRCFFG-MRXNPFEDSA-N	0	3	330.476	3.112	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)NCC1(NCc2cc(C#N)ccc2F)CCCC1	ZINC001753666329	1440460328	/nfs/dbraw/zinc/46/03/28/1440460328.db2.gz	DATTYOJCPYMCEM-QGZVFWFLSA-N	0	3	349.425	3.210	20	30		EGEDHN
C#CCCCC(=O)N(C)[C@@H](C)CNCc1cc(Cl)cc2c1OCC2	ZINC001753684493	1440465274	/nfs/dbraw/zinc/46/52/74/1440465274.db2.gz	FCFJUHOULYPUEW-AWEZNQCLSA-N	0	3	348.874	3.015	20	30		EGEDHN
Cc1cc(C(=O)N(C)[C@H](C)CNCC#Cc2ccc(F)cc2)oc1C	ZINC001753685633	1440465427	/nfs/dbraw/zinc/46/54/27/1440465427.db2.gz	NOYDRPXHMGVULG-OAHLLOKOSA-N	0	3	342.414	3.137	20	30		EGEDHN
C#CCCCC(=O)N(C)[C@H](C)CN[C@H]1CCc2c1c(F)ccc2F	ZINC001753686075	1440465567	/nfs/dbraw/zinc/46/55/67/1440465567.db2.gz	SXFQGZWUILAPAW-DYVFJYSZSA-N	0	3	334.410	3.192	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)c(F)c1)N(C)C(=O)C(C)(C)C1CCC1	ZINC001753704326	1440469237	/nfs/dbraw/zinc/46/92/37/1440469237.db2.gz	AGCYVUQFFUNOIA-CQSZACIVSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](NCc2cc(C3CC3)no2)[C@@H](C)C1	ZINC001753756070	1440483246	/nfs/dbraw/zinc/48/32/46/1440483246.db2.gz	ZHSJWALGHHVZFD-WMLDXEAASA-N	0	3	345.487	3.481	20	30		EGEDHN
CC(C)[C@H](CNC(=O)C(C)(F)F)NCC#Cc1ccccc1Cl	ZINC001753822312	1440496747	/nfs/dbraw/zinc/49/67/47/1440496747.db2.gz	GONXNSAGHZPIDV-HNNXBMFYSA-N	0	3	342.817	3.077	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1ccc(-c2cnco2)cc1)C(C)C	ZINC001753831776	1440499887	/nfs/dbraw/zinc/49/98/87/1440499887.db2.gz	AIKIXJXYTBHHTA-INIZCTEOSA-N	0	3	347.846	3.438	20	30		EGEDHN
CC#CCCCC(=O)N(C)CCN(C)[C@H](C)c1cccc(OC)c1	ZINC001753861273	1440511600	/nfs/dbraw/zinc/51/16/00/1440511600.db2.gz	ZPFYNHVVDQJXRW-QGZVFWFLSA-N	0	3	330.472	3.340	20	30		EGEDHN
C[C@H](CCNCc1ccccc1C#N)NC(=O)c1ccc2c(c1)CCC2	ZINC001754035006	1440534118	/nfs/dbraw/zinc/53/41/18/1440534118.db2.gz	VQFOHZJBZRGVTJ-MRXNPFEDSA-N	0	3	347.462	3.345	20	30		EGEDHN
N#Cc1cccc(CNC/C=C\CNC(=O)C2(C3CCC3)CCC2)c1	ZINC001754153691	1440545457	/nfs/dbraw/zinc/54/54/57/1440545457.db2.gz	LBCCSTGSHHTQNE-UPHRSURJSA-N	0	3	337.467	3.291	20	30		EGEDHN
CC(C)c1ccc(C(=O)NC/C=C/CNCc2cccc(C#N)c2)nc1	ZINC001754173597	1440547434	/nfs/dbraw/zinc/54/74/34/1440547434.db2.gz	OLOWIEJBORZOSK-ONEGZZNKSA-N	0	3	348.450	3.152	20	30		EGEDHN
C[C@H](CNCC#Cc1ccc(Cl)cc1)NC(=O)[C@H]1CC=CCC1	ZINC001754217167	1440552099	/nfs/dbraw/zinc/55/20/99/1440552099.db2.gz	BUVYKTXWBCQTTF-WBVHZDCISA-N	0	3	330.859	3.142	20	30		EGEDHN
C[C@@H](CNCC#Cc1cccc(Cl)c1)NC(=O)C[C@@H]1C=CCC1	ZINC001754259436	1440559754	/nfs/dbraw/zinc/55/97/54/1440559754.db2.gz	SJOBBCUFHRKPGR-DOTOQJQBSA-N	0	3	330.859	3.142	20	30		EGEDHN
C[C@@H](CNCc1ccc(F)c(C#N)c1)NC(=O)[C@@H]1C[C@H]1CC(C)(C)C	ZINC001754267041	1440560846	/nfs/dbraw/zinc/56/08/46/1440560846.db2.gz	UAOXAWKOTQJYCT-JLJPHGGASA-N	0	3	345.462	3.364	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)c(F)c1)NC(=O)[C@@H](C)c1ccccc1	ZINC001754290493	1440564930	/nfs/dbraw/zinc/56/49/30/1440564930.db2.gz	DIWOSYJTDNOBGY-GJZGRUSLSA-N	0	3	339.414	3.095	20	30		EGEDHN
C=CC[C@@H](C(=O)N[C@@H](C)CNCc1cncs1)c1ccccc1	ZINC001754295188	1440566128	/nfs/dbraw/zinc/56/61/28/1440566128.db2.gz	PMCJNJUEKOIRQX-WMLDXEAASA-N	0	3	329.469	3.097	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H](C)CN(C)Cc1cc2ccccc2s1	ZINC001754311635	1440573258	/nfs/dbraw/zinc/57/32/58/1440573258.db2.gz	QQRDUNILLCPJNX-HNNXBMFYSA-N	0	3	328.481	3.497	20	30		EGEDHN
CN(CCCNCc1ccc(C#N)cc1F)C(=O)C(F)=C1CCCC1	ZINC001754364998	1440592053	/nfs/dbraw/zinc/59/20/53/1440592053.db2.gz	NRZGKTULWUDFMZ-UHFFFAOYSA-N	0	3	347.409	3.433	20	30		EGEDHN
C=CCCCCCN1CC[C@H]1CNC(=O)c1cncc2[nH]ccc21	ZINC001754488893	1440609531	/nfs/dbraw/zinc/60/95/31/1440609531.db2.gz	LXZLPJRUILGNDA-HNNXBMFYSA-N	0	3	326.444	3.113	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@H]2CCC[C@@H](C1)N2CCC[C@H]1CCOC1	ZINC001754552942	1440630473	/nfs/dbraw/zinc/63/04/73/1440630473.db2.gz	QHWQRJHFAFGOIU-GBESFXJTSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC1CCC1	ZINC001754553123	1440630499	/nfs/dbraw/zinc/63/04/99/1440630499.db2.gz	VPQBMWOSJHJWIA-NSHGMRRFSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N1C[C@H]2CCC[C@@H](C1)N2CCCCC	ZINC001754553688	1440630712	/nfs/dbraw/zinc/63/07/12/1440630712.db2.gz	IYXBSCIOZKTWAJ-RDGPPVDQSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC(N(C/C=C/Cl)CCOC)CC1	ZINC001754559000	1440632900	/nfs/dbraw/zinc/63/29/00/1440632900.db2.gz	JXQWHUHRKLWLPP-HKMNZKMDSA-N	0	3	342.911	3.281	20	30		EGEDHN
O=C(C1CCC1)N1CCC[C@H]1CNCC#Cc1ccccc1Cl	ZINC001754603729	1440642898	/nfs/dbraw/zinc/64/28/98/1440642898.db2.gz	NCZRKDUBCNTXMU-KRWDZBQOSA-N	0	3	330.859	3.072	20	30		EGEDHN
O=C(c1cc2occc2[nH]1)N1CCC[C@H]1CNCC#Cc1ccccc1	ZINC001754611114	1440643891	/nfs/dbraw/zinc/64/38/91/1440643891.db2.gz	PZUWSIGPYOFOKC-KRWDZBQOSA-N	0	3	347.418	3.007	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@H]1CNCc1c(C)nsc1C	ZINC001754617177	1440644754	/nfs/dbraw/zinc/64/47/54/1440644754.db2.gz	GZEWQWUILNHEPH-HNNXBMFYSA-N	0	3	335.517	3.443	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC1(C)CCN(Cc2cnccc2C)CC1	ZINC001754626912	1440646557	/nfs/dbraw/zinc/64/65/57/1440646557.db2.gz	RPVHJXKJRIICOL-UHFFFAOYSA-N	0	3	329.488	3.463	20	30		EGEDHN
C#CCN(C(=O)Cc1cccc(C(F)F)c1)C1CCN(CC=C)CC1	ZINC001754638422	1440648716	/nfs/dbraw/zinc/64/87/16/1440648716.db2.gz	XSMDRYCCFDVLDP-UHFFFAOYSA-N	0	3	346.421	3.279	20	30		EGEDHN
C#CCN(C(=O)[C@H](C)Cc1ccccc1C)C1CCN(CC=C)CC1	ZINC001754643332	1440649414	/nfs/dbraw/zinc/64/94/14/1440649414.db2.gz	TUSQSGPPLSWCNK-LJQANCHMSA-N	0	3	338.495	3.286	20	30		EGEDHN
C#CCN(C(=O)c1cccn1C(C)C)C1CCN(CC(=C)C)CC1	ZINC001754643327	1440649428	/nfs/dbraw/zinc/64/94/28/1440649428.db2.gz	SXGOBGHJWKSZSI-UHFFFAOYSA-N	0	3	327.472	3.185	20	30		EGEDHN
C=CCCOCC(=O)N1CCCC[C@@]2(CCN(C/C=C/Cl)C2)C1	ZINC001754661728	1440655186	/nfs/dbraw/zinc/65/51/86/1440655186.db2.gz	KEECUFLPMAYMBN-YOCVDRLZSA-N	0	3	340.895	3.036	20	30		EGEDHN
C[C@@H](C#N)C(=O)N[C@@]1(C)CCN(Cc2ccc(C3CCC3)cc2)C1	ZINC001754668803	1440657445	/nfs/dbraw/zinc/65/74/45/1440657445.db2.gz	SHLKZXOOSMVNFK-YWZLYKJASA-N	0	3	325.456	3.194	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@](C)(CNCc2cc(C3CC3)no2)C1	ZINC001754702060	1440668155	/nfs/dbraw/zinc/66/81/55/1440668155.db2.gz	MYIJEHVLJRKNHL-LJQANCHMSA-N	0	3	331.460	3.092	20	30		EGEDHN
C=CCN1CCC[C@@](C)(CNC(=O)C2C3CC4CC(C3)CC2C4)C1	ZINC001754727011	1440676706	/nfs/dbraw/zinc/67/67/06/1440676706.db2.gz	DGHWCKYISUUJHU-FZFNZOESSA-N	0	3	330.516	3.463	20	30		EGEDHN
CC#CCN1CCC[C@@](C)(CNC(=O)c2cc(CC(C)C)c[nH]2)C1	ZINC001754732451	1440680502	/nfs/dbraw/zinc/68/05/02/1440680502.db2.gz	UWXSHOVSXMBEII-FQEVSTJZSA-N	0	3	329.488	3.068	20	30		EGEDHN
CC(C)=CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(Cc1ccc(C#N)cc1F)C2	ZINC001754780582	1440686131	/nfs/dbraw/zinc/68/61/31/1440686131.db2.gz	UBUBPMNVOXVGQD-SZMVWBNQSA-N	0	3	341.430	3.133	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@H](C)[C@@H](CNCc2csc(C)n2)C1	ZINC001754815538	1440692241	/nfs/dbraw/zinc/69/22/41/1440692241.db2.gz	TTWLVLQABNUJOA-YOEHRIQHSA-N	0	3	347.528	3.404	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](C)[C@@H](CNCc3nccs3)C2)CCC1	ZINC001754821941	1440692989	/nfs/dbraw/zinc/69/29/89/1440692989.db2.gz	AXZDPDJKNOLRLV-CABCVRRESA-N	0	3	333.501	3.074	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@H]1CC[C@H](CNCc2nccn2C)CC1	ZINC001754833874	1440696322	/nfs/dbraw/zinc/69/63/22/1440696322.db2.gz	PXQRVFWNYPVSFQ-QAQDUYKDSA-N	0	3	346.519	3.035	20	30		EGEDHN
CC#CCNCCN(Cc1ccccc1)C(=O)c1cnoc1C(C)C	ZINC001754839514	1440697676	/nfs/dbraw/zinc/69/76/76/1440697676.db2.gz	SVRKEUQRYYXXBG-UHFFFAOYSA-N	0	3	339.439	3.053	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@H](c3ccccc3)[C@@H](C)CC)C[C@@H]2C1	ZINC001754847544	1440699599	/nfs/dbraw/zinc/69/95/99/1440699599.db2.gz	FIJPQIPCAIAUJA-WJMWBRGCSA-N	0	3	338.495	3.230	20	30		EGEDHN
C=C(C)CN(C)Cc1ccccc1CNC(=O)c1cn(C(C)C)cn1	ZINC001754946545	1440713226	/nfs/dbraw/zinc/71/32/26/1440713226.db2.gz	MEGVIZMHBYNXIN-UHFFFAOYSA-N	0	3	340.471	3.402	20	30		EGEDHN
C=CCN(C)Cc1ccccc1CNC(=O)c1cc(OC)cs1	ZINC001754946419	1440713320	/nfs/dbraw/zinc/71/33/20/1440713320.db2.gz	HQIGIMZMEGXNJI-UHFFFAOYSA-N	0	3	330.453	3.305	20	30		EGEDHN
C=CCN(C)Cc1ccccc1CNC(=O)c1ccn(C)c1CC	ZINC001754946715	1440713576	/nfs/dbraw/zinc/71/35/76/1440713576.db2.gz	UBDDPIQGLBIRTH-UHFFFAOYSA-N	0	3	325.456	3.135	20	30		EGEDHN
C#CCN[C@H](C)c1ccc(CNC(=O)C2(C(F)(F)F)CCC2)cc1	ZINC001754947168	1440713680	/nfs/dbraw/zinc/71/36/80/1440713680.db2.gz	GVZMUVFMJQMFKL-CYBMUJFWSA-N	0	3	338.373	3.319	20	30		EGEDHN
CC#CCN[C@@H](C)c1ccc(CNC(=O)c2scnc2C)cc1	ZINC001754954195	1440715858	/nfs/dbraw/zinc/71/58/58/1440715858.db2.gz	NMYJMXVBQAVPSP-ZDUSSCGKSA-N	0	3	327.453	3.055	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)CCc3ccccc3)cccc2C1	ZINC001754975755	1440719967	/nfs/dbraw/zinc/71/99/67/1440719967.db2.gz	MAWCDYPVXCBQOF-UHFFFAOYSA-N	0	3	346.474	3.317	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1CCCN(Cc2cncc(C)c2)CC1	ZINC001755028703	1440730393	/nfs/dbraw/zinc/73/03/93/1440730393.db2.gz	PFRSJAXNHZQIPJ-FQEVSTJZSA-N	0	3	341.499	3.444	20	30		EGEDHN
CC(C)(C)C#CC(=O)NC[C@H]1Cc2ccccc2CN1CCC1CC1	ZINC001755075506	1440748269	/nfs/dbraw/zinc/74/82/69/1440748269.db2.gz	HWRCFJFJILYYKC-HXUWFJFHSA-N	0	3	338.495	3.379	20	30		EGEDHN
C=CCCN1Cc2ccccc2C[C@@H]1CNC(=O)CCc1cccnc1	ZINC001755075604	1440748394	/nfs/dbraw/zinc/74/83/94/1440748394.db2.gz	KAUAYESFRYBWDG-OAQYLSRUSA-N	0	3	349.478	3.133	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCc1ccc2c(c1)CN(CCc1cccs1)C2	ZINC001755100689	1440752111	/nfs/dbraw/zinc/75/21/11/1440752111.db2.gz	CULYLSIYWYRXPW-AWEZNQCLSA-N	0	3	339.464	3.082	20	30		EGEDHN
CC(C)=CC(=O)N1C[C@H](NCC#Cc2ccc(Cl)cc2)[C@@H](C)C1	ZINC001755102988	1440753612	/nfs/dbraw/zinc/75/36/12/1440753612.db2.gz	FESFQVRJEOIIIT-YJBOKZPZSA-N	0	3	330.859	3.094	20	30		EGEDHN
CC(C)=C(C)CC(=O)N1C[C@@H](C)[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001755113591	1440754509	/nfs/dbraw/zinc/75/45/09/1440754509.db2.gz	JVJHMBAGKSESRN-BEFAXECRSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)CCCC(F)(F)F	ZINC001755187016	1440773533	/nfs/dbraw/zinc/77/35/33/1440773533.db2.gz	QZYRRFJYGKTQFD-GDBMZVCRSA-N	0	3	326.362	3.277	20	30		EGEDHN
CS[C@H](C)CC(=O)N1CCC[C@@H]1CN(C)Cc1cccc(C#N)c1	ZINC001755191962	1440775026	/nfs/dbraw/zinc/77/50/26/1440775026.db2.gz	WSWGJCOXKBXWEV-CRAIPNDOSA-N	0	3	345.512	3.123	20	30		EGEDHN
COc1cc(CN(C)C[C@H]2CCCN2C(=O)C#CC(C)C)ccc1C	ZINC001755193139	1440775545	/nfs/dbraw/zinc/77/55/45/1440775545.db2.gz	SJFDDOMJRBIGIL-LJQANCHMSA-N	0	3	342.483	3.086	20	30		EGEDHN
C=C(Cl)CNCC1CC(NC(=O)C[C@@H](C)c2c(C)noc2C)C1	ZINC001755213616	1440783667	/nfs/dbraw/zinc/78/36/67/1440783667.db2.gz	NLTHIGNAWHROOQ-SFNBMPIDSA-N	0	3	339.867	3.022	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H](C)[C@@H](C)NCc2ccc(C#N)s2)s1	ZINC001755222381	1440784995	/nfs/dbraw/zinc/78/49/95/1440784995.db2.gz	CNKLXWXWXXOBLR-VXGBXAGGSA-N	0	3	333.482	3.286	20	30		EGEDHN
C[C@@H](NC(=O)C1CCCC1)[C@H](C)NCC#Cc1cccc(Cl)c1	ZINC001755225211	1440785764	/nfs/dbraw/zinc/78/57/64/1440785764.db2.gz	YYWARCHCAGGTOZ-LSDHHAIUSA-N	0	3	332.875	3.365	20	30		EGEDHN
COc1ccc(C#N)cc1CN[C@H](C)[C@H](C)NC(=O)C(C)(C)C(C)C	ZINC001755238948	1440788980	/nfs/dbraw/zinc/78/89/80/1440788980.db2.gz	YUSKPGCLGNRHCA-CABCVRRESA-N	0	3	345.487	3.232	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H](C)[C@H](C)NCc1cc(C)ccc1OC	ZINC001755248362	1440791133	/nfs/dbraw/zinc/79/11/33/1440791133.db2.gz	IRRIFWDGHQTKIQ-IRXDYDNUSA-N	0	3	330.472	3.180	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H](C)[C@H](C)NCc1cnn(C(C)(C)C)c1	ZINC001755248011	1440791150	/nfs/dbraw/zinc/79/11/50/1440791150.db2.gz	FSHHGJAHBCKERK-LSDHHAIUSA-N	0	3	334.508	3.223	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)C[C@H]1CCC[C@H](OC)C1	ZINC001755282290	1440800924	/nfs/dbraw/zinc/80/09/24/1440800924.db2.gz	LZSWMIGDMNTISM-HOTGVXAUSA-N	0	3	344.927	3.408	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1cc(C(C)C)on1	ZINC001755282651	1440801054	/nfs/dbraw/zinc/80/10/54/1440801054.db2.gz	AFYDMVVABUVCRZ-UHFFFAOYSA-N	0	3	327.856	3.238	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1ocnc1C(F)F	ZINC001755285320	1440801850	/nfs/dbraw/zinc/80/18/50/1440801850.db2.gz	JBJFYVQCMWFYMB-UHFFFAOYSA-N	0	3	335.782	3.053	20	30		EGEDHN
CC(C)c1[nH]ccc1C(=O)NC[C@@H](C)N(C)Cc1cccc(C#N)c1	ZINC001755312734	1440814080	/nfs/dbraw/zinc/81/40/80/1440814080.db2.gz	IIABRCWFHHIPQZ-OAHLLOKOSA-N	0	3	338.455	3.260	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H](C)N(C)Cc2ccc3c(c2)COC3)CCC1	ZINC001755315542	1440815466	/nfs/dbraw/zinc/81/54/66/1440815466.db2.gz	RTUDYDOPJQLIMD-MRXNPFEDSA-N	0	3	342.483	3.400	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H](C)N(C)[C@@H](C)c2cccc(F)c2)nc1	ZINC001755322229	1440819209	/nfs/dbraw/zinc/81/92/09/1440819209.db2.gz	DMZBMPGBYHSMNB-CABCVRRESA-N	0	3	339.414	3.013	20	30		EGEDHN
CCc1ccsc1C(=O)NC[C@@H](C)N(C)Cc1cccc(C#N)c1	ZINC001755328946	1440823389	/nfs/dbraw/zinc/82/33/89/1440823389.db2.gz	VFCSRGLHWIFOPZ-CQSZACIVSA-N	0	3	341.480	3.432	20	30		EGEDHN
CC(C)[C@H](CCN(C)C(=O)C1CC1)NCc1cc(F)ccc1C#N	ZINC001755344794	1440826297	/nfs/dbraw/zinc/82/62/97/1440826297.db2.gz	ULHGUOHYANAHDO-SFHVURJKSA-N	0	3	331.435	3.070	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@H]1CCCCCN1CCc1ccccc1F	ZINC001755364101	1440833444	/nfs/dbraw/zinc/83/34/44/1440833444.db2.gz	QPPQVNNFFROGMH-LJQANCHMSA-N	0	3	344.474	3.388	20	30		EGEDHN
COc1ccc(CN2CCCCC[C@@H]2CNC(=O)C#CC(C)C)cc1	ZINC001755364345	1440833641	/nfs/dbraw/zinc/83/36/41/1440833641.db2.gz	SZCCLQARCOWZBA-LJQANCHMSA-N	0	3	342.483	3.215	20	30		EGEDHN
C#CCN1CCCCC[C@H]1CNC(=O)C[C@@H](C)c1ccc(F)cc1	ZINC001755367889	1440835535	/nfs/dbraw/zinc/83/55/35/1440835535.db2.gz	KOCSIQZRWFLWHI-APWZRJJASA-N	0	3	330.447	3.313	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)C(C)(C)c1ccccc1	ZINC001755369037	1440836658	/nfs/dbraw/zinc/83/66/58/1440836658.db2.gz	ZUQMBEXQOAFBDV-LJQANCHMSA-N	0	3	326.484	3.348	20	30		EGEDHN
C#CCCN1CC([C@H](C)NC(=O)C(C)(C)c2ccc(Cl)cc2)C1	ZINC001755381136	1440839310	/nfs/dbraw/zinc/83/93/10/1440839310.db2.gz	DBIGPGWXJCBZQD-AWEZNQCLSA-N	0	3	332.875	3.077	20	30		EGEDHN
C=C[C@H](C(=O)N[C@@H](C)C1CN(CC2CC(F)(F)C2)C1)c1ccccc1	ZINC001755390997	1440842121	/nfs/dbraw/zinc/84/21/21/1440842121.db2.gz	DGUQIABCGQDUTL-KSSFIOAISA-N	0	3	348.437	3.438	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@]2(CCN(C(=O)c3cccc(F)c3)C2)C1	ZINC001755399795	1440842754	/nfs/dbraw/zinc/84/27/54/1440842754.db2.gz	QIROMPMNZUDCDP-UZLBHIALSA-N	0	3	346.446	3.097	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)[C@@H](OCC)c2ccccc2)C(C)(C)C1	ZINC001755416573	1440849119	/nfs/dbraw/zinc/84/91/19/1440849119.db2.gz	UWGNTFUMTAZWMI-MSOLQXFVSA-N	0	3	330.472	3.167	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CC[C@H](NC(=O)CCc3ccco3)C[C@@H]2C1	ZINC001755449465	1440852712	/nfs/dbraw/zinc/85/27/12/1440852712.db2.gz	FXTWUZOSCGODPQ-XHSDSOJGSA-N	0	3	336.863	3.181	20	30		EGEDHN
C=C(Cl)CNC[C@H]1C[C@H](NC(=O)Cc2cc3ccccc3o2)C1	ZINC001755476425	1440859556	/nfs/dbraw/zinc/85/95/56/1440859556.db2.gz	XGRNQKTXSBSHPU-CTYIDZIISA-N	0	3	332.831	3.212	20	30		EGEDHN
C=CC(C)(C)CC(=O)N(C)[C@@H](CNCc1cc(C)ns1)C1CC1	ZINC001755562752	1440874868	/nfs/dbraw/zinc/87/48/68/1440874868.db2.gz	UMCLNRBBYRRFSZ-INIZCTEOSA-N	0	3	335.517	3.380	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N(C)[C@H](CNCC#Cc1ccc(F)cc1)C1CC1	ZINC001755568861	1440876522	/nfs/dbraw/zinc/87/65/22/1440876522.db2.gz	FIUMRCQKVIAGNJ-OXJNMPFZSA-N	0	3	344.474	3.296	20	30		EGEDHN
Cc1ccccc1C(=O)N1CC[C@@H](NCC#Cc2ccccc2)[C@@H]1C	ZINC001755649323	1440891184	/nfs/dbraw/zinc/89/11/84/1440891184.db2.gz	RXFNRTLZXMXARG-GHTZIAJQSA-N	0	3	332.447	3.239	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N[C@@]12CCC[C@H]1N(Cc1ccsc1)CC2	ZINC001755697510	1440898499	/nfs/dbraw/zinc/89/84/99/1440898499.db2.gz	YSJYDOWJBHMLOD-SZVBFZGTSA-N	0	3	348.512	3.343	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1C[C@H](NCc2ccc(C#N)s2)C(C)(C)C1	ZINC001755754154	1440913612	/nfs/dbraw/zinc/91/36/12/1440913612.db2.gz	SAUVHLBLPMOTNL-CJNGLKHVSA-N	0	3	333.501	3.383	20	30		EGEDHN
C=C(C)CN(C)CCN(C(=O)c1cccc(NC(=O)CC)c1)C(C)C	ZINC001755813399	1440921705	/nfs/dbraw/zinc/92/17/05/1440921705.db2.gz	PASNIXQAAVWLEP-UHFFFAOYSA-N	0	3	345.487	3.394	20	30		EGEDHN
CC(C)(C)[C@H](CNCC#Cc1ccc(F)cc1)NC(=O)C1CC=CC1	ZINC001755819907	1440925414	/nfs/dbraw/zinc/92/54/14/1440925414.db2.gz	JFAGGFLBJAVZLI-IBGZPJMESA-N	0	3	342.458	3.264	20	30		EGEDHN
C=C(Br)CNC[C@@H](NC(=O)C1CC(C)(C)C1)C(C)(C)C	ZINC001755823955	1440926659	/nfs/dbraw/zinc/92/66/59/1440926659.db2.gz	QCROZGOHCXZKMY-CYBMUJFWSA-N	0	3	345.325	3.452	20	30		EGEDHN
C[C@@H](NC(=O)CC1(C)CC1)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001755844272	1440932686	/nfs/dbraw/zinc/93/26/86/1440932686.db2.gz	OYIZYENMSGRMNH-MRXNPFEDSA-N	0	3	339.483	3.465	20	30		EGEDHN
C#CCN1CCC([C@H](C)NC(=O)C2(c3cccc(Cl)c3)CC2)CC1	ZINC001755848752	1440934242	/nfs/dbraw/zinc/93/42/42/1440934242.db2.gz	LXMHZEOSDZLIKB-HNNXBMFYSA-N	0	3	344.886	3.222	20	30		EGEDHN
C#CCCCC(=O)NC1(C2CCN(Cc3ccsc3)CC2)CC1	ZINC001755867999	1440938198	/nfs/dbraw/zinc/93/81/98/1440938198.db2.gz	HLVCCEFDGICVIA-UHFFFAOYSA-N	0	3	330.497	3.412	20	30		EGEDHN
C=CCNCc1ccc(CNC(=O)[C@H](C)Cc2ccco2)c(F)c1	ZINC001755902203	1440944297	/nfs/dbraw/zinc/94/42/97/1440944297.db2.gz	OHRDHXNAKAXLGJ-CQSZACIVSA-N	0	3	330.403	3.189	20	30		EGEDHN
C=C(Cl)Cn1c(N2C[C@@H](C)N(CC)C[C@@H]2C)nnc1C(C)(C)C	ZINC001760386496	1441368142	/nfs/dbraw/zinc/36/81/42/1441368142.db2.gz	AOISMKXXZOMBOU-KGLIPLIRSA-N	0	3	339.915	3.247	20	30		EGEDHN
CC[C@@](C)(COc1ncccc1Cl)NCc1cc(C#N)n(C)c1	ZINC000191448531	529502220	/nfs/dbraw/zinc/50/22/20/529502220.db2.gz	OUKLRLIWDYKQLP-KRWDZBQOSA-N	0	3	332.835	3.282	20	30		EGEDHN
N#Cc1ccc([C@H](NC[C@H]2CCCC[C@@H]2C(F)(F)F)C(N)=O)cc1	ZINC000352271926	283188139	/nfs/dbraw/zinc/18/81/39/283188139.db2.gz	SVPVXLSIMPQIDW-ILXRZTDVSA-N	0	3	339.361	3.043	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](CC)CNc2ccccc2)CC1	ZINC000297851644	202172720	/nfs/dbraw/zinc/17/27/20/202172720.db2.gz	ZQIXTXOEAMPFBK-QGZVFWFLSA-N	0	3	344.503	3.217	20	30		EGEDHN
C[C@H](NC[C@@H](O)COc1ccc(C#N)cc1)c1ccccc1Cl	ZINC000068046228	202203412	/nfs/dbraw/zinc/20/34/12/202203412.db2.gz	SBVGWGSNWNGODI-DZGCQCFKSA-N	0	3	330.815	3.302	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000189266499	201046302	/nfs/dbraw/zinc/04/63/02/201046302.db2.gz	DFABVVCMKCIQGR-HFSMHLIXSA-N	0	3	344.499	3.385	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@@H]2c2cccc(OC)c2)CC1	ZINC000264373859	201211261	/nfs/dbraw/zinc/21/12/61/201211261.db2.gz	RSDJPJLQOMESOG-LJQANCHMSA-N	0	3	343.471	3.192	20	30		EGEDHN
C#CCCOc1ccc(CN[C@@H](C)[C@H](O)c2ccc(F)cc2)cc1	ZINC000265243703	201215372	/nfs/dbraw/zinc/21/53/72/201215372.db2.gz	MGKFESJMVRJTMS-YWZLYKJASA-N	0	3	327.399	3.440	20	30		EGEDHN
C=CCN(CC=C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000267417880	201222986	/nfs/dbraw/zinc/22/29/86/201222986.db2.gz	PLHKYCNKFGWIIV-PKOBYXMFSA-N	0	3	327.472	3.281	20	30		EGEDHN
C=CCOc1ccc(CNC[C@H]2COC3(CCCC3)O2)cc1OC	ZINC000271448785	201243662	/nfs/dbraw/zinc/24/36/62/201243662.db2.gz	RHHSCCJZEWPQHP-INIZCTEOSA-N	0	3	333.428	3.035	20	30		EGEDHN
C#CC[C@H](N[C@H](C)c1ccc(S(=O)(=O)NC)cc1)c1ccccc1	ZINC000271593401	201245178	/nfs/dbraw/zinc/24/51/78/201245178.db2.gz	YOUWSBRXSWERJY-BEFAXECRSA-N	0	3	342.464	3.010	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N(Cc1ccccc1)C1CCN(C)CC1)OCC	ZINC000270149261	201236500	/nfs/dbraw/zinc/23/65/00/201236500.db2.gz	HKBDSNCJQRHTGB-FQEVSTJZSA-N	0	3	344.499	3.481	20	30		EGEDHN
C=CC[C@@H](C)NCc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-]	ZINC000272254405	201249849	/nfs/dbraw/zinc/24/98/49/201249849.db2.gz	CKEPANOPXHFSMF-SNVBAGLBSA-N	0	3	330.331	3.302	20	30		EGEDHN
C#CCCCC(=O)N(Cc1ccc(O)cc1)C[C@@H]1CCCN1CC	ZINC000277248317	201300895	/nfs/dbraw/zinc/30/08/95/201300895.db2.gz	DKKRHALBKXKMDQ-SFHVURJKSA-N	0	3	328.456	3.009	20	30		EGEDHN
COc1cccc([C@@H](CNc2nc(Cl)c(C#N)s2)N(C)C)c1	ZINC000278471736	201305029	/nfs/dbraw/zinc/30/50/29/201305029.db2.gz	CYZMKWBEPODNNW-GFCCVEGCSA-N	0	3	336.848	3.392	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1C(=O)NCC(C)(C)N[C@H](C)c1ccccc1	ZINC000278642360	201306700	/nfs/dbraw/zinc/30/67/00/201306700.db2.gz	LOBXWSPRGKCJHQ-KBAYOESNSA-N	0	3	330.472	3.213	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@@H]2CCCCN2C2CC2)cc1OC	ZINC000278103447	201309390	/nfs/dbraw/zinc/30/93/90/201309390.db2.gz	ZOBOAAJBORDUAW-KRWDZBQOSA-N	0	3	344.455	3.007	20	30		EGEDHN
C[C@@]1(O)CCCN(CC#Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000279945561	201323110	/nfs/dbraw/zinc/32/31/10/201323110.db2.gz	GLSFMUHIRJQKEZ-MRXNPFEDSA-N	0	3	327.346	3.174	20	30		EGEDHN
C=CCC[C@H](O)CN1CCC(O)(c2ccccc2C(F)(F)F)CC1	ZINC000278868136	201311455	/nfs/dbraw/zinc/31/14/55/201311455.db2.gz	SLIKIYRODLKEHZ-AWEZNQCLSA-N	0	3	343.389	3.316	20	30		EGEDHN
C[C@H](CNC(=O)c1c(F)cc(C#N)cc1F)N(C)Cc1ccccc1	ZINC000151136781	201392000	/nfs/dbraw/zinc/39/20/00/201392000.db2.gz	ATUBJGMVMYHPAP-CYBMUJFWSA-N	0	3	343.377	3.087	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H]1C[C@H](C)N(C2CC2)C1	ZINC000127506829	205103586	/nfs/dbraw/zinc/10/35/86/205103586.db2.gz	UTBFBGSKIYPOPR-MAUKXSAKSA-N	0	3	340.471	3.105	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1CCC[C@H]1c1c(C)n[nH]c1C	ZINC000130710865	205252227	/nfs/dbraw/zinc/25/22/27/205252227.db2.gz	BDDUCFCBJNZNFS-INIZCTEOSA-N	0	3	340.427	3.123	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](C)c2cc(C)ccc2OC)CC1	ZINC000264428907	246491284	/nfs/dbraw/zinc/49/12/84/246491284.db2.gz	TVZQUVAFOSQFLF-OAHLLOKOSA-N	0	3	331.460	3.014	20	30		EGEDHN
C[C@@H](c1ccc(C#N)cc1)N1CCC[C@@H](C(=O)Nc2ccccn2)C1	ZINC000377719545	169067846	/nfs/dbraw/zinc/06/78/46/169067846.db2.gz	LQYJTKUHLFVECX-MAUKXSAKSA-N	0	3	334.423	3.365	20	30		EGEDHN
COc1ccc(CNCc2ccc(NC(=O)C(C)C)cc2)cc1C#N	ZINC000174253140	207004881	/nfs/dbraw/zinc/00/48/81/207004881.db2.gz	RASAZLNBOGZCCK-UHFFFAOYSA-N	0	3	337.423	3.451	20	30		EGEDHN
COC1CCN(CCNc2c(C#N)cnc3ccc(Cl)cc32)CC1	ZINC000301538832	269722697	/nfs/dbraw/zinc/72/26/97/269722697.db2.gz	MPWKBRKKSMMRNQ-UHFFFAOYSA-N	0	3	344.846	3.283	20	30		EGEDHN
Cc1ccc(OC2CCN(C[C@@H](O)c3ccc(C#N)cc3)CC2)cc1	ZINC000268667170	252119689	/nfs/dbraw/zinc/11/96/89/252119689.db2.gz	JOSWLBCSVXPKLE-OAQYLSRUSA-N	0	3	336.435	3.444	20	30		EGEDHN
CCCN(CCN1CCCCC1)C(=O)[C@@H](C)Oc1ccc(C#N)cc1	ZINC000342794955	141148812	/nfs/dbraw/zinc/14/88/12/141148812.db2.gz	MRQBZWBBYPTPDF-QGZVFWFLSA-N	0	3	343.471	3.050	20	30		EGEDHN
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NCc1cc(C#N)cs1	ZINC000342817887	141150934	/nfs/dbraw/zinc/15/09/34/141150934.db2.gz	HYCXDZKLBJZUIY-DYVFJYSZSA-N	0	3	328.437	3.130	20	30		EGEDHN
CCN(CCN1CCCCCC1)C(=O)CSc1ccc(C#N)cc1	ZINC000346288143	141192514	/nfs/dbraw/zinc/19/25/14/141192514.db2.gz	DVBNIEMSTHZUEH-UHFFFAOYSA-N	0	3	345.512	3.375	20	30		EGEDHN
N#Cc1ccc(NCCCN2CCN(Cc3ccccc3)CC2)cc1	ZINC000356820835	141348869	/nfs/dbraw/zinc/34/88/69/141348869.db2.gz	MOZDEASEZLXWJW-UHFFFAOYSA-N	0	3	334.467	3.178	20	30		EGEDHN
COc1cc(OC)c2ncc(C#N)c(NCCN3CCCCC3)c2c1	ZINC000341538218	155342701	/nfs/dbraw/zinc/34/27/01/155342701.db2.gz	UKFQKKWMWMXTFS-UHFFFAOYSA-N	0	3	340.427	3.021	20	30		EGEDHN
CCN(C(=O)c1ccc(C#N)cc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000186295609	153005392	/nfs/dbraw/zinc/00/53/92/153005392.db2.gz	VYLSCGWBNAFWKO-HXUWFJFHSA-N	0	3	333.435	3.295	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H](c3nc(C4CC4)n[nH]3)C2)cc1F	ZINC000192139069	153245524	/nfs/dbraw/zinc/24/55/24/153245524.db2.gz	YCJWAPYCRSILFI-HNNXBMFYSA-N	0	3	325.391	3.072	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H](c3n[nH]c(C4CC4)n3)C2)cc1F	ZINC000192139069	153245528	/nfs/dbraw/zinc/24/55/28/153245528.db2.gz	YCJWAPYCRSILFI-HNNXBMFYSA-N	0	3	325.391	3.072	20	30		EGEDHN
C[C@H](N[C@@H]1CCCC[C@@H]1OC(F)F)C(=O)Nc1cccc(C#N)c1	ZINC000337383070	154323165	/nfs/dbraw/zinc/32/31/65/154323165.db2.gz	DSABWNSHSNRNPK-GLQYFDAESA-N	0	3	337.370	3.025	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)[C@@H]1CC2CCC1CC2	ZINC000339885778	155018260	/nfs/dbraw/zinc/01/82/60/155018260.db2.gz	KFYBNCGRYYMFOD-RRWXTXHCSA-N	0	3	339.483	3.275	20	30		EGEDHN
C[C@@H]1[C@@H](NC(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)CCCN1C	ZINC000345266036	156024740	/nfs/dbraw/zinc/02/47/40/156024740.db2.gz	MEFJJMZWQUAQKP-YGRLFVJLSA-N	0	3	340.349	3.181	20	30		EGEDHN
COc1ccc(C#N)cc1CN[C@@H](C)[C@@H]1OCCc2sccc21	ZINC000368637590	157250011	/nfs/dbraw/zinc/25/00/11/157250011.db2.gz	YNACYRGFWLRMPE-SGTLLEGYSA-N	0	3	328.437	3.420	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1ccc(C#N)cc1	ZINC000248398809	163000213	/nfs/dbraw/zinc/00/02/13/163000213.db2.gz	USQKUBGCJKMQDS-DNVCBOLYSA-N	0	3	334.423	3.200	20	30		EGEDHN
C[C@H](NC(=O)Cc1c(F)cccc1C#N)[C@@H](c1ccccc1)N(C)C	ZINC000354768785	166027149	/nfs/dbraw/zinc/02/71/49/166027149.db2.gz	YJYIVUUJEBGDIM-XOBRGWDASA-N	0	3	339.414	3.047	20	30		EGEDHN
CN(CCOCc1ccc(C#N)cc1)C[C@@H](O)CCc1ccccc1	ZINC000344076635	164097917	/nfs/dbraw/zinc/09/79/17/164097917.db2.gz	VJVXRAQLWFMYIW-NRFANRHFSA-N	0	3	338.451	3.000	20	30		EGEDHN
N#Cc1ccc(NC(=O)C2CCN(C3CC3)CC2)cc1Br	ZINC000344579654	164191920	/nfs/dbraw/zinc/19/19/20/164191920.db2.gz	JVQONNWLXQMPML-UHFFFAOYSA-N	0	3	348.244	3.134	20	30		EGEDHN
Cc1cc(C#N)ccc1Oc1ccc(C(=O)N[C@@H](C)CN(C)C)cc1	ZINC000346164917	164354454	/nfs/dbraw/zinc/35/44/54/164354454.db2.gz	QKUMJQFUBXXDMH-HNNXBMFYSA-N	0	3	337.423	3.339	20	30		EGEDHN
CC[C@@H]1CCCCN1CCNC(=O)N[C@H](C)c1ccc(C#N)cc1	ZINC000354865992	166051265	/nfs/dbraw/zinc/05/12/65/166051265.db2.gz	YTWWOEMXNQWEAA-CRAIPNDOSA-N	0	3	328.460	3.183	20	30		EGEDHN
N#Cc1c(CN2CCCN3c4ccccc4C[C@H]3C2)cn2ccccc12	ZINC000351998691	165187129	/nfs/dbraw/zinc/18/71/29/165187129.db2.gz	XRSCKVPTAHJFJV-IBGZPJMESA-N	0	3	342.446	3.448	20	30		EGEDHN
CC(C)(C)N1C[C@@H](C(=O)Nc2cccc(C#N)c2)[C@H](C(F)(F)F)C1	ZINC000366348206	168109074	/nfs/dbraw/zinc/10/90/74/168109074.db2.gz	NBGFDRKIRSTLPN-ZIAGYGMSSA-N	0	3	339.361	3.406	20	30		EGEDHN
CC(C)(C(=O)N[C@H]1CCN(C2CCCC2)C1)c1cc(F)cc(C#N)c1	ZINC000367217380	168194775	/nfs/dbraw/zinc/19/47/75/168194775.db2.gz	MSQGFMUPJJDLRT-KRWDZBQOSA-N	0	3	343.446	3.108	20	30		EGEDHN
CN(C)[C@@H]1Cc2ccccc2N(C(=O)c2cc(C#N)ccc2Cl)C1	ZINC000367588382	168245684	/nfs/dbraw/zinc/24/56/84/168245684.db2.gz	WLSYQIBGXWKCJU-OAHLLOKOSA-N	0	3	339.826	3.345	20	30		EGEDHN
C[C@@H](N[C@@H]1CCCC[C@H]1OC(F)F)C(=O)Nc1cccc(C#N)c1	ZINC000502564288	269845271	/nfs/dbraw/zinc/84/52/71/269845271.db2.gz	DSABWNSHSNRNPK-KCPJHIHWSA-N	0	3	337.370	3.025	20	30		EGEDHN
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C)[C@@H]1NCc1ccc(C#N)cn1	ZINC000496584073	269855216	/nfs/dbraw/zinc/85/52/16/269855216.db2.gz	ODONXGDPLFNVND-CKEIUWERSA-N	0	3	344.459	3.077	20	30		EGEDHN
Cc1ccc(CC(C)(C)NCC(=O)NCc2ccc(C#N)cc2)cc1	ZINC000419339083	269917195	/nfs/dbraw/zinc/91/71/95/269917195.db2.gz	UDDGUEFMZDEILY-UHFFFAOYSA-N	0	3	335.451	3.094	20	30		EGEDHN
CSc1ccc([C@H](CNC(=O)c2cc(C#N)cs2)N(C)C)cc1	ZINC000294966975	270042365	/nfs/dbraw/zinc/04/23/65/270042365.db2.gz	SRQBBUYXCQPJIE-HNNXBMFYSA-N	0	3	345.493	3.374	20	30		EGEDHN
N#Cc1ccc(CN2CCC(CCN3CCOCC3)CC2)c(Cl)c1	ZINC000439460595	270051741	/nfs/dbraw/zinc/05/17/41/270051741.db2.gz	YRGWHGNMJCLPCE-UHFFFAOYSA-N	0	3	347.890	3.146	20	30		EGEDHN
Cn1ccnc1C[C@@H]1CCCN(Cc2ccc(C#N)cc2Cl)C1	ZINC000439437759	270051915	/nfs/dbraw/zinc/05/19/15/270051915.db2.gz	IVVNDEJSWUGFFH-HNNXBMFYSA-N	0	3	328.847	3.400	20	30		EGEDHN
N#Cc1cccc(COc2cccc(CNC[C@@H](O)C3CCC3)c2)c1	ZINC000449738520	270052717	/nfs/dbraw/zinc/05/27/17/270052717.db2.gz	CNJXNJOUNLASBJ-OAQYLSRUSA-N	0	3	336.435	3.388	20	30		EGEDHN
CC[C@H](C)N1CCN(c2c(C#N)cnc3c(F)c(F)c(F)cc32)CC1	ZINC000450854267	270053214	/nfs/dbraw/zinc/05/32/14/270053214.db2.gz	DBEZJWGWOLQURE-NSHDSACASA-N	0	3	348.372	3.444	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)c2ccc(F)c(C#N)c2)N(C)C)cc1	ZINC000468968536	270055379	/nfs/dbraw/zinc/05/53/79/270055379.db2.gz	MKABLYUJXYMNFG-LJQANCHMSA-N	0	3	339.414	3.292	20	30		EGEDHN
C/C(=C\c1ccccc1)CN(C)C[C@@H](O)COc1ccc(C#N)cc1	ZINC000494272640	270058738	/nfs/dbraw/zinc/05/87/38/270058738.db2.gz	APXPARDMOBBJJT-KEWOFRHOSA-N	0	3	336.435	3.333	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN1CC[C@H]1Cc1ccccc1	ZINC000533346063	270060634	/nfs/dbraw/zinc/06/06/34/270060634.db2.gz	RCKPAHRZRCNGLL-INIZCTEOSA-N	0	3	325.437	3.265	20	30		EGEDHN
CCC1(CC)[C@H](OC)C[C@@H]1NCC(=O)Nc1sc(C)c(C)c1C#N	ZINC000191374869	266013571	/nfs/dbraw/zinc/01/35/71/266013571.db2.gz	AYGDGLKRPGORLA-LSDHHAIUSA-N	0	3	349.500	3.358	20	30		EGEDHN
CCO[C@H]1C[C@H](NCC(=O)Nc2sccc2C#N)C12CCCCC2	ZINC000279247151	266302734	/nfs/dbraw/zinc/30/27/34/266302734.db2.gz	KTQOQQOKEWAEMJ-GJZGRUSLSA-N	0	3	347.484	3.276	20	30		EGEDHN
CN(C)c1cccc(NCc2cccn2Cc2ccccc2C#N)n1	ZINC000187940060	266521704	/nfs/dbraw/zinc/52/17/04/266521704.db2.gz	LHLHYGRBFYJLSW-UHFFFAOYSA-N	0	3	331.423	3.481	20	30		EGEDHN
C[C@@H](CNC(=O)Nc1ccc(Oc2ccccc2C#N)cc1)N(C)C	ZINC000299171298	266928764	/nfs/dbraw/zinc/92/87/64/266928764.db2.gz	JGQKLUVAVALWPK-AWEZNQCLSA-N	0	3	338.411	3.422	20	30		EGEDHN
CCCC1CCC(N(C)CC(=O)NCc2cccc(C#N)c2)CC1	ZINC000484893688	267000288	/nfs/dbraw/zinc/00/02/88/267000288.db2.gz	IXBPUBYBIWLKSM-UHFFFAOYSA-N	0	3	327.472	3.465	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)Cc1ccc2c(c1)oc(=O)n2C	ZINC000507317814	267016140	/nfs/dbraw/zinc/01/61/40/267016140.db2.gz	LDZOZXVCBSYLEG-UHFFFAOYSA-N	0	3	335.407	3.415	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1Nc1nccc(C#N)c1Cl	ZINC000398014152	267056048	/nfs/dbraw/zinc/05/60/48/267056048.db2.gz	FIVHHSGKHSFXAE-PBHICJAKSA-N	0	3	340.858	3.351	20	30		EGEDHN
C[C@@H]1C[C@@H](N[C@H]2CCN(Cc3ccc(C#N)cc3)C2=O)c2ccccc21	ZINC000290154907	267082023	/nfs/dbraw/zinc/08/20/23/267082023.db2.gz	CWLKSDVEUMXUCB-GQWLDOHISA-N	0	3	345.446	3.497	20	30		EGEDHN
C[C@@H]1[C@H](NC(=O)NCc2ccc(C#N)cc2)CCN1Cc1ccccc1	ZINC000287083056	267110083	/nfs/dbraw/zinc/11/00/83/267110083.db2.gz	MAXNHPOPXDOIRO-OXQOHEQNSA-N	0	3	348.450	3.020	20	30		EGEDHN
C[C@H](C(=O)Nc1cccc(C#N)c1)N1CC[C@@H](C2CCOCC2)C1	ZINC000328856902	267144606	/nfs/dbraw/zinc/14/46/06/267144606.db2.gz	UJGSETJDNKLGPW-RHSMWYFYSA-N	0	3	327.428	3.283	20	30		EGEDHN
C[C@H](CNc1cc(C#N)ccc1[N+](=O)[O-])N1CCc2ccccc2C1	ZINC000302208004	267162959	/nfs/dbraw/zinc/16/29/59/267162959.db2.gz	LFUBRWKIEAELMS-CQSZACIVSA-N	0	3	336.395	3.325	20	30		EGEDHN
C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(Cc2ccc(C#N)cc2)C1	ZINC000272526502	267174969	/nfs/dbraw/zinc/17/49/69/267174969.db2.gz	QJVFSVYGSJERJE-WMLDXEAASA-N	0	3	329.444	3.293	20	30		EGEDHN
C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCN(Cc2ccc(C#N)cc2)C1	ZINC000272526504	267175362	/nfs/dbraw/zinc/17/53/62/267175362.db2.gz	QJVFSVYGSJERJE-YOEHRIQHSA-N	0	3	329.444	3.293	20	30		EGEDHN
CC[C@H](NCc1cccc(NS(C)(=O)=O)c1)c1ccc(C#N)cc1	ZINC000447535776	267221512	/nfs/dbraw/zinc/22/15/12/267221512.db2.gz	IIDJKBFUPIROMX-SFHVURJKSA-N	0	3	343.452	3.171	20	30		EGEDHN
CN(C(=O)C(C#N)Cc1ccc(C#N)cc1)C1CC(OC(C)(C)C)C1	ZINC000421690919	267275947	/nfs/dbraw/zinc/27/59/47/267275947.db2.gz	ULFFNFNKZNMLGR-AOCRQIFASA-N	0	3	339.439	3.045	20	30		EGEDHN
CN(C)[C@H]1Cc2ccccc2N(C(=O)[C@@H]2C[C@H]2c2cccc(C#N)c2)C1	ZINC000413408252	267290241	/nfs/dbraw/zinc/29/02/41/267290241.db2.gz	MKXQNXXROBAIHO-SLFFLAALSA-N	0	3	345.446	3.181	20	30		EGEDHN
CN(C[C@H]1CCCN1C)c1c(C#N)cnc2ccc(OC(F)F)cc21	ZINC000420631957	267310361	/nfs/dbraw/zinc/31/03/61/267310361.db2.gz	HETPIXVLBLBISH-CYBMUJFWSA-N	0	3	346.381	3.238	20	30		EGEDHN
COC(=O)CCN(Cc1ccc(C#N)cc1OC(F)F)CC(C)C	ZINC000437433310	267360829	/nfs/dbraw/zinc/36/08/29/267360829.db2.gz	RMRJCLWPLVECMJ-UHFFFAOYSA-N	0	3	340.370	3.181	20	30		EGEDHN
C[C@H](CCCc1cccnc1)N[C@H]1CCN(c2ccc(C#N)cc2)C1=O	ZINC000411826793	267819986	/nfs/dbraw/zinc/81/99/86/267819986.db2.gz	SVZNLTCRFSNGTD-UZLBHIALSA-N	0	3	348.450	3.060	20	30		EGEDHN
Cc1ccc([C@@H](CNC(=O)[C@@H](C)c2cccc(C#N)c2)N(C)C)cc1	ZINC000462000835	268044281	/nfs/dbraw/zinc/04/42/81/268044281.db2.gz	QRNSPYBAQLLGNP-OXJNMPFZSA-N	0	3	335.451	3.389	20	30		EGEDHN
N#Cc1ccc(CNCCC2CCN(CC(F)(F)F)CC2)c(F)c1	ZINC000269415571	268072116	/nfs/dbraw/zinc/07/21/16/268072116.db2.gz	KFDMUBOKZQYXJN-UHFFFAOYSA-N	0	3	343.368	3.451	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CSCCN2Cc2ccccc2)s1	ZINC000276974614	268074119	/nfs/dbraw/zinc/07/41/19/268074119.db2.gz	FWWDVYBBKXXMKT-INIZCTEOSA-N	0	3	343.521	3.327	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCC(=O)NC23CCC3)c(OC(F)F)c1	ZINC000328720047	268076694	/nfs/dbraw/zinc/07/66/94/268076694.db2.gz	VWRHAMDLHMCCRM-AWEZNQCLSA-N	0	3	335.354	3.291	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CC[C@H](c3ccccc3)C2)cc1	ZINC000279421019	268090184	/nfs/dbraw/zinc/09/01/84/268090184.db2.gz	WXBOWNUENVBRSV-VQTJNVASSA-N	0	3	329.403	3.257	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@H]2C[C@@H]2c2cccc(F)c2)cc1	ZINC000279453553	268092259	/nfs/dbraw/zinc/09/22/59/268092259.db2.gz	ZQKHFSQDNHZEDB-QRQLOZEOSA-N	0	3	333.366	3.052	20	30		EGEDHN
N#Cc1ccc(NC[C@@H](O)CN2CCc3ccccc3C2)cc1Cl	ZINC000301521125	268156407	/nfs/dbraw/zinc/15/64/07/268156407.db2.gz	LLGWETZIBUUYTJ-GOSISDBHSA-N	0	3	341.842	3.043	20	30		EGEDHN
N#Cc1ccc(NC[C@H](O)CN2CCc3ccccc3C2)cc1Cl	ZINC000301521126	268156536	/nfs/dbraw/zinc/15/65/36/268156536.db2.gz	LLGWETZIBUUYTJ-SFHVURJKSA-N	0	3	341.842	3.043	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN2CC[C@H](Oc3ccc(Cl)cc3)C2)cc1	ZINC000293030065	268216052	/nfs/dbraw/zinc/21/60/52/268216052.db2.gz	LFGFDBPDOISGSZ-RBUKOAKNSA-N	0	3	342.826	3.398	20	30		EGEDHN
N#Cc1cccc(C2(NCCOCC(F)(F)C(F)(F)F)CC2)c1	ZINC000276264133	268241182	/nfs/dbraw/zinc/24/11/82/268241182.db2.gz	RKYOQEPMHPKCDA-UHFFFAOYSA-N	0	3	334.288	3.351	20	30		EGEDHN
N#Cc1ccc(NC(=O)NC[C@H]2CCN2C2CCCCC2)cc1F	ZINC000529101245	268245339	/nfs/dbraw/zinc/24/53/39/268245339.db2.gz	NUVQTJKRNOLONM-MRXNPFEDSA-N	0	3	330.407	3.226	20	30		EGEDHN
N#Cc1cccc(NC(=O)C2CC[NH+](Cc3ccccc3[O-])CC2)c1	ZINC000271367324	268265327	/nfs/dbraw/zinc/26/53/27/268265327.db2.gz	OMQVJLZKVRZIDG-UHFFFAOYSA-N	0	3	335.407	3.115	20	30		EGEDHN
CN(C)[C@H](CNC(=O)Nc1ccc(F)cc1C#N)c1ccccc1	ZINC000119813371	273813900	/nfs/dbraw/zinc/81/39/00/273813900.db2.gz	DLOODJFMGFXKGM-QGZVFWFLSA-N	0	3	326.375	3.122	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NC[C@H](c1ccccc1)N1CCCC1)OCC	ZINC000270155454	276872707	/nfs/dbraw/zinc/87/27/07/276872707.db2.gz	XGBYDRZOTGRDAM-MOPGFXCFSA-N	0	3	330.472	3.311	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cncnc1C(C)C)C(C)C	ZINC000263966902	277852730	/nfs/dbraw/zinc/85/27/30/277852730.db2.gz	SJPRQQXARPVVBF-QGZVFWFLSA-N	0	3	330.476	3.028	20	30		EGEDHN
C=CC[C@H](CO)N[C@@H]1C[C@H](NC(=O)OC(C)(C)C)c2ccccc21	ZINC000273378249	277888830	/nfs/dbraw/zinc/88/88/30/277888830.db2.gz	BRGULHGRDIPZSK-XYPHTWIQSA-N	0	3	332.444	3.224	20	30		EGEDHN
C[C@@H](CCN1CCN(c2nccnc2C#N)C[C@H]1C)c1ccccc1	ZINC000248828320	308012342	/nfs/dbraw/zinc/01/23/42/308012342.db2.gz	GTWKXQQJMRWWSO-DLBZAZTESA-N	0	3	335.455	3.053	20	30		EGEDHN
N#Cc1ccc(Br)c(CN[C@@H](CO)C2CCCCC2)c1	ZINC000617219507	460776681	/nfs/dbraw/zinc/77/66/81/460776681.db2.gz	HFTZLSRXVGMGHC-INIZCTEOSA-N	0	3	337.261	3.352	20	30		EGEDHN
N#Cc1cccc(OCCCN2CCC(Nc3ccccn3)CC2)c1	ZINC000534861078	314003122	/nfs/dbraw/zinc/00/31/22/314003122.db2.gz	PEBZJAKDURZIJD-UHFFFAOYSA-N	0	3	336.439	3.299	20	30		EGEDHN
N#Cc1ccccc1OCCN1CCC[C@@H]1Cn1cnc2ccccc21	ZINC000536068814	314092926	/nfs/dbraw/zinc/09/29/26/314092926.db2.gz	OLZKPJSKBFGTBC-GOSISDBHSA-N	0	3	346.434	3.451	20	30		EGEDHN
C[C@H](N[C@H]1CCN(c2ncccc2F)C1)c1ccc(C#N)c(F)c1	ZINC000537406308	314179307	/nfs/dbraw/zinc/17/93/07/314179307.db2.gz	CLFZSJGAVNFYNN-WFASDCNBSA-N	0	3	328.366	3.161	20	30		EGEDHN
COc1ccc([C@@H](C)CN2CCN(Cc3ccc(C#N)cc3)CC2)cc1	ZINC000538308281	314239409	/nfs/dbraw/zinc/23/94/09/314239409.db2.gz	SVHKNJZBZABVHP-SFHVURJKSA-N	0	3	349.478	3.488	20	30		EGEDHN
C[C@@H](N[C@H](CN1CCN(C)CC1)c1ccccc1)c1cccc(C#N)c1	ZINC000539497752	314317003	/nfs/dbraw/zinc/31/70/03/314317003.db2.gz	VFHKMBKZDNXDGN-XMSQKQJNSA-N	0	3	348.494	3.198	20	30		EGEDHN
N#Cc1ccc(C(=O)N2CCCN(C3CCCC3)CC2)cc1Cl	ZINC000548632601	315029021	/nfs/dbraw/zinc/02/90/21/315029021.db2.gz	AFMGWIHZWCDXAM-UHFFFAOYSA-N	0	3	331.847	3.302	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CN2CCC=C(c3ccccc3)C2)cc1	ZINC000551405748	315153033	/nfs/dbraw/zinc/15/30/33/315153033.db2.gz	BCNVFODXBCDFKF-FQEVSTJZSA-N	0	3	334.419	3.087	20	30		EGEDHN
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NCc1cc(C#N)ccc1F	ZINC000556516702	315439493	/nfs/dbraw/zinc/43/94/93/315439493.db2.gz	MGOLHOFRFPRXGI-KSSFIOAISA-N	0	3	340.398	3.207	20	30		EGEDHN
CCN1CCCC[C@@H]1CNC(=O)N[C@H]1CCCc2cc(C#N)ccc21	ZINC000570306034	317037684	/nfs/dbraw/zinc/03/76/84/317037684.db2.gz	FBUKBSKKGITZKO-MJGOQNOKSA-N	0	3	340.471	3.109	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@H]1CC[C@H](NCc2ccc(C#N)s2)C1	ZINC000382483523	324251451	/nfs/dbraw/zinc/25/14/51/324251451.db2.gz	YCANATOBECSGKK-STQMWFEESA-N	0	3	335.473	3.403	20	30		EGEDHN
C[C@@H](C1CCN(C)CC1)N(C)C(=O)C(C)(C)c1cc(F)cc(C#N)c1	ZINC000580078943	325200370	/nfs/dbraw/zinc/20/03/70/325200370.db2.gz	PWUAXOFZLXBZMP-AWEZNQCLSA-N	0	3	345.462	3.164	20	30		EGEDHN
C=CCN1CCC(NC(=O)CCOc2ccc(C(C)C)cc2)CC1	ZINC000264496483	455224840	/nfs/dbraw/zinc/22/48/40/455224840.db2.gz	PGFLCLGADUYXII-UHFFFAOYSA-N	0	3	330.472	3.346	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cnn([C@@H](C)C3CC3)c2)CC1	ZINC000189635604	455225065	/nfs/dbraw/zinc/22/50/65/455225065.db2.gz	UJUOKIQMRBRLAD-AWEZNQCLSA-N	0	3	331.464	3.016	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H]2C[C@]23CCCc2ccccc23)CC1	ZINC000173161243	455241489	/nfs/dbraw/zinc/24/14/89/455241489.db2.gz	ZCRKYPFTNLKWCU-IRLDBZIGSA-N	0	3	338.495	3.437	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H]2C[C@@]23CCCc2ccccc23)CC1	ZINC000173161224	455241636	/nfs/dbraw/zinc/24/16/36/455241636.db2.gz	ZCRKYPFTNLKWCU-IFMALSPDSA-N	0	3	338.495	3.437	20	30		EGEDHN
CC(C)Oc1ccc(NC(=O)N2CC[C@@H](N3CCCC3)C2)cc1C#N	ZINC000157870790	455242426	/nfs/dbraw/zinc/24/24/26/455242426.db2.gz	SQFQKSMYAGNDSN-QGZVFWFLSA-N	0	3	342.443	3.047	20	30		EGEDHN
C[C@](C#N)(NC(=O)CN[C@@H](c1cccc(F)c1)C1CCCC1)C1CC1	ZINC000181000428	455274311	/nfs/dbraw/zinc/27/43/11/455274311.db2.gz	LADPLQXHAAUZQZ-WOJBJXKFSA-N	0	3	343.446	3.455	20	30		EGEDHN
CCN(CCC#N)C(=O)CN[C@H](c1cccc(F)c1)C1CCCC1	ZINC000180998181	455274735	/nfs/dbraw/zinc/27/47/35/455274735.db2.gz	WMHCFQKKKQCUKO-IBGZPJMESA-N	0	3	331.435	3.409	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@@H](CO)CC2CC2)cc1OC	ZINC000623472645	460569132	/nfs/dbraw/zinc/56/91/32/460569132.db2.gz	WEBLVUVCAYCXLW-CQSZACIVSA-N	0	3	325.836	3.164	20	30		EGEDHN
CN(C)C(=O)[C@@H]1CCCN1Cc1ccc(-c2ccccc2C#N)cc1	ZINC000012747630	453396077	/nfs/dbraw/zinc/39/60/77/453396077.db2.gz	CWKUYGCFKRZUNM-FQEVSTJZSA-N	0	3	333.435	3.278	20	30		EGEDHN
COc1ccc(CN2CCCN(Cc3ccc(C#N)cc3)CC2)cc1	ZINC000022832160	453699477	/nfs/dbraw/zinc/69/94/77/453699477.db2.gz	FUVXHRJORWRICD-UHFFFAOYSA-N	0	3	335.451	3.275	20	30		EGEDHN
C[C@H](NC[C@@H](O)COCc1ccc(Cl)cc1)c1ccc(C#N)cc1	ZINC000030532587	453836364	/nfs/dbraw/zinc/83/63/64/453836364.db2.gz	SYAWUWXSQXLIDF-IFXJQAMLSA-N	0	3	344.842	3.440	20	30		EGEDHN
C[C@H](CN(C)[C@@H](C)C(=O)NC1(C#N)CCCCC1)c1ccccc1	ZINC000066853978	453881134	/nfs/dbraw/zinc/88/11/34/453881134.db2.gz	USGFCVCMJBTRGO-SJORKVTESA-N	0	3	327.472	3.453	20	30		EGEDHN
Cc1ccc([C@@H](CNCc2ccc(C#N)cc2)N2CCOCC2)s1	ZINC000075603926	453909976	/nfs/dbraw/zinc/90/99/76/453909976.db2.gz	SVNOKAMFVJQOLJ-GOSISDBHSA-N	0	3	341.480	3.091	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)CCc2ccc(C#N)cc2)C1	ZINC000054224539	453917549	/nfs/dbraw/zinc/91/75/49/453917549.db2.gz	ZOIBNRCGNRKDJX-UWJYYQICSA-N	0	3	347.462	3.443	20	30		EGEDHN
N#Cc1cccc(OCCN2CC[C@H](COCc3ccccc3)C2)c1	ZINC000075866522	453933977	/nfs/dbraw/zinc/93/39/77/453933977.db2.gz	PTHQKTYZGSZEDO-FQEVSTJZSA-N	0	3	336.435	3.476	20	30		EGEDHN
CCN(C[C@@H](C#N)CCC#N)CC1CCN(c2ccccn2)CC1	ZINC000076108686	453964803	/nfs/dbraw/zinc/96/48/03/453964803.db2.gz	BOVCMJWEAAKHLJ-GOSISDBHSA-N	0	3	325.460	3.063	20	30		EGEDHN
CC(C)n1ncc2cc(C(=O)C(C#N)c3nc4ccccc4[nH]3)cnc21	ZINC000041495236	453969387	/nfs/dbraw/zinc/96/93/87/453969387.db2.gz	CXCWWUUMKPFAOY-AWEZNQCLSA-N	0	3	344.378	3.379	20	30		EGEDHN
N#Cc1csc(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)c1	ZINC000084183326	453975747	/nfs/dbraw/zinc/97/57/47/453975747.db2.gz	HPCGYEBSEUVQMP-INIZCTEOSA-N	0	3	339.464	3.262	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Nc1nnc(C2CC2)s1)C(C)C	ZINC000043359518	454058771	/nfs/dbraw/zinc/05/87/71/454058771.db2.gz	XBRFJUQDLIAHTL-CQSZACIVSA-N	0	3	349.504	3.236	20	30		EGEDHN
COc1ccc(C(=O)C(C#N)c2cnc3ccccc3n2)cc1OC	ZINC000190926517	455407734	/nfs/dbraw/zinc/40/77/34/455407734.db2.gz	ATVBIKPNQBSRAY-ZDUSSCGKSA-N	0	3	333.347	3.137	20	30		EGEDHN
N#Cc1cccc(CNC[C@@H](O)COc2cccc3ccccc32)c1	ZINC000069160618	454083531	/nfs/dbraw/zinc/08/35/31/454083531.db2.gz	XYCIDTBLZHLYGM-LJQANCHMSA-N	0	3	332.403	3.241	20	30		EGEDHN
Cc1nc(CO/N=C/c2ccc(N3CCOCC3)cc2)sc1C	ZINC000088509240	454108897	/nfs/dbraw/zinc/10/88/97/454108897.db2.gz	TXHAQEKOXSBIAJ-WOJGMQOQSA-N	0	3	331.441	3.147	20	30		EGEDHN
N#Cc1cccc(CNC(=O)c2ccc(CN3CCCCC3)cc2)c1	ZINC000045215560	454146211	/nfs/dbraw/zinc/14/62/11/454146211.db2.gz	VAWDMVYSOLSNBH-UHFFFAOYSA-N	0	3	333.435	3.474	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Cc1ccc(C)c(O)c1)C(C)C	ZINC000089435980	454149159	/nfs/dbraw/zinc/14/91/59/454149159.db2.gz	SFZMFXLLECKNGG-GOSISDBHSA-N	0	3	330.472	3.058	20	30		EGEDHN
N#Cc1ccc(NC[C@H]2C[C@H](O)CN2Cc2ccccc2)cc1Cl	ZINC000089644754	454173657	/nfs/dbraw/zinc/17/36/57/454173657.db2.gz	ODCZFENQNBCERD-MSOLQXFVSA-N	0	3	341.842	3.259	20	30		EGEDHN
N#Cc1cc([N+](=O)[O-])cnc1NC[C@@H](c1cccs1)N1CCCC1	ZINC000070791330	454176556	/nfs/dbraw/zinc/17/65/56/454176556.db2.gz	IUZWYCOMQFTFLJ-AWEZNQCLSA-N	0	3	343.412	3.172	20	30		EGEDHN
C[C@H]1CCCN(C(=O)C2CCN(Cc3cccc(C#N)c3)CC2)C1	ZINC000045804007	454183720	/nfs/dbraw/zinc/18/37/20/454183720.db2.gz	GHJLGOTUIIOCBI-INIZCTEOSA-N	0	3	325.456	3.029	20	30		EGEDHN
C=CCN(Cc1ccccc1)C[C@@H](O)COc1cccc([N+](=O)[O-])c1	ZINC000045796841	454183864	/nfs/dbraw/zinc/18/38/64/454183864.db2.gz	GWMJWIAMEYMVED-GOSISDBHSA-N	0	3	342.395	3.023	20	30		EGEDHN
CCN(CC)Cc1cccc(NC(=O)COc2ccccc2C#N)c1	ZINC000046016165	454206558	/nfs/dbraw/zinc/20/65/58/454206558.db2.gz	FCHZPMUBEYMFSY-UHFFFAOYSA-N	0	3	337.423	3.418	20	30		EGEDHN
N#Cc1ccc(OCCN2CCCN(c3ccccc3C#N)CC2)cc1	ZINC000046086945	454216524	/nfs/dbraw/zinc/21/65/24/454216524.db2.gz	LEYPHJCLZUVVFK-UHFFFAOYSA-N	0	3	346.434	3.021	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc3[nH]c(C4CCC4)nc3c2)CC1	ZINC000119756698	454217924	/nfs/dbraw/zinc/21/79/24/454217924.db2.gz	USPYMJMUCXHXDK-UHFFFAOYSA-N	0	3	336.439	3.114	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc3nc(C4CCC4)[nH]c3c2)CC1	ZINC000119756698	454217928	/nfs/dbraw/zinc/21/79/28/454217928.db2.gz	USPYMJMUCXHXDK-UHFFFAOYSA-N	0	3	336.439	3.114	20	30		EGEDHN
CSCC[C@H](NCCCC(C)(C)C#N)c1nnc2ccccn21	ZINC000119923282	454236192	/nfs/dbraw/zinc/23/61/92/454236192.db2.gz	KIMLNNYSQFJMRR-AWEZNQCLSA-N	0	3	331.489	3.443	20	30		EGEDHN
C=C(C)Cn1c(SCCN(CC)CC)nnc1-c1ccncc1	ZINC000131205700	454240659	/nfs/dbraw/zinc/24/06/59/454240659.db2.gz	ZLBAMJHLWCZQQZ-UHFFFAOYSA-N	0	3	331.489	3.350	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCN2CC[C@H](Nc3ccccc3)C2)cc1	ZINC000060369963	454282792	/nfs/dbraw/zinc/28/27/92/454282792.db2.gz	OPSMSCFETWHTNH-IBGZPJMESA-N	0	3	334.423	3.073	20	30		EGEDHN
Cc1ccc(NC(=O)N(CCC#N)CC2CC2)c(OCCN(C)C)c1	ZINC000078611503	454286115	/nfs/dbraw/zinc/28/61/15/454286115.db2.gz	MVEGWHPSLAGMDD-UHFFFAOYSA-N	0	3	344.459	3.093	20	30		EGEDHN
C[C@H](NCCC(=O)N(C)CCC#N)c1ccc(Cl)cc1Cl	ZINC000131807639	454287853	/nfs/dbraw/zinc/28/78/53/454287853.db2.gz	JPDKGEJETRKIIS-NSHDSACASA-N	0	3	328.243	3.406	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N[C@H](C)c1ccccn1)C(C)C	ZINC000079206332	454381717	/nfs/dbraw/zinc/38/17/17/454381717.db2.gz	RGCTVSFZFNPVKL-SJLPKXTDSA-N	0	3	330.476	3.140	20	30		EGEDHN
C#CCOc1ccccc1CN1CCC[C@@H](c2nnc3ccccn32)C1	ZINC000097032577	454390438	/nfs/dbraw/zinc/39/04/38/454390438.db2.gz	KFWVFXYNOKYADW-GOSISDBHSA-N	0	3	346.434	3.121	20	30		EGEDHN
N#Cc1cccc(COc2cccc(CNCCn3ccnc3)c2)c1	ZINC000047688422	454400791	/nfs/dbraw/zinc/40/07/91/454400791.db2.gz	XJBSUUWGKAFKNY-UHFFFAOYSA-N	0	3	332.407	3.124	20	30		EGEDHN
N#Cc1cccc(CNC(=O)NC[C@H](c2ccccc2)N2CCCC2)c1	ZINC000047948912	454423055	/nfs/dbraw/zinc/42/30/55/454423055.db2.gz	ZZXQFXFPOIUCHB-HXUWFJFHSA-N	0	3	348.450	3.195	20	30		EGEDHN
C[C@@H](CNC(=O)c1cccc(SCC#N)c1)N1CCC[C@H](C)C1	ZINC000079531750	454431433	/nfs/dbraw/zinc/43/14/33/454431433.db2.gz	BHXYEPLMFINCFW-GJZGRUSLSA-N	0	3	331.485	3.152	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)C(=O)N[C@H](C)CN1CCCCC1	ZINC000079610687	454450041	/nfs/dbraw/zinc/45/00/41/454450041.db2.gz	DQMARECCEQBZBJ-QGZVFWFLSA-N	0	3	345.487	3.267	20	30		EGEDHN
N#CC(C(=O)c1ccc(C(F)(F)F)nc1)c1nc2ccccc2[nH]1	ZINC000073972199	454509522	/nfs/dbraw/zinc/50/95/22/454509522.db2.gz	LFILZMNAFFBJAU-SNVBAGLBSA-N	0	3	330.269	3.467	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN1CC[C@H](Nc2ccccc2)C1	ZINC000102845197	454523186	/nfs/dbraw/zinc/52/31/86/454523186.db2.gz	FDGHLCXEKVKAGD-INIZCTEOSA-N	0	3	340.452	3.135	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)NCCCCC#N)CCN1Cc1ccccc1	ZINC000080115874	454536369	/nfs/dbraw/zinc/53/63/69/454536369.db2.gz	XQPSVMIZNWRMRY-FUHWJXTLSA-N	0	3	328.460	3.033	20	30		EGEDHN
CCN(C(=O)c1ccc(C#N)[nH]1)[C@H]1CCN([C@@H](C)c2ccccc2)C1	ZINC000160384579	455453145	/nfs/dbraw/zinc/45/31/45/455453145.db2.gz	WTEYOQQYTBONND-YJBOKZPZSA-N	0	3	336.439	3.184	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(Cc3ccc4c[nH]nc4c3)CC2)cc1	ZINC000122807837	454570489	/nfs/dbraw/zinc/57/04/89/454570489.db2.gz	HJPDEXCTTNVFSI-UHFFFAOYSA-N	0	3	345.450	3.142	20	30		EGEDHN
N#CC(C(=O)CCSc1ccccc1F)C(=O)Nc1ccccn1	ZINC000104055634	454572746	/nfs/dbraw/zinc/57/27/46/454572746.db2.gz	HBMICVQOSFXYJU-LBPRGKRZSA-N	0	3	343.383	3.050	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Cc2cccc(C(F)(F)F)c2)CC1	ZINC000106039505	454675933	/nfs/dbraw/zinc/67/59/33/454675933.db2.gz	SEOROQMYVUFWKK-UHFFFAOYSA-N	0	3	340.389	3.405	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCCOc2ccc(OC)cc2)CC1	ZINC000106039367	454675987	/nfs/dbraw/zinc/67/59/87/454675987.db2.gz	IOCUDFWJYSLJRX-UHFFFAOYSA-N	0	3	346.471	3.011	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](CC)c2c(C)noc2C)CC1	ZINC000123851654	454682217	/nfs/dbraw/zinc/68/22/17/454682217.db2.gz	NTQIDBKEQVMPPQ-INIZCTEOSA-N	0	3	334.464	3.082	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H](c2ccccc2)N(CC)CC)CC1	ZINC000106290896	454689687	/nfs/dbraw/zinc/68/96/87/454689687.db2.gz	IVZDMXLMFNOMEP-FQEVSTJZSA-N	0	3	343.515	3.226	20	30		EGEDHN
N#CCCn1cc(CN(CCCCO)C2CC2)c(-c2ccccc2)n1	ZINC000093383036	454709883	/nfs/dbraw/zinc/70/98/83/454709883.db2.gz	ADEZVALXTKKBGQ-UHFFFAOYSA-N	0	3	338.455	3.201	20	30		EGEDHN
COc1ccc(CN2CCC[C@@H]2C[C@H](C)O)cc1OCCCC#N	ZINC000093483153	454718965	/nfs/dbraw/zinc/71/89/65/454718965.db2.gz	ZAZWNMZJHRISTA-DOTOQJQBSA-N	0	3	332.444	3.113	20	30		EGEDHN
COc1ccc(CN(C)CC2(O)CCCC2)cc1OCCCC#N	ZINC000093503220	454719800	/nfs/dbraw/zinc/71/98/00/454719800.db2.gz	PDXOHAWQGUEREM-UHFFFAOYSA-N	0	3	332.444	3.115	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2c[nH]nc2-c2ccccc2Cl)CC1	ZINC000176301668	454725953	/nfs/dbraw/zinc/72/59/53/454725953.db2.gz	GBWVUJUOCYARKD-UHFFFAOYSA-N	0	3	344.846	3.110	20	30		EGEDHN
N#Cc1cc(F)ccc1NC(=O)N1CCN(C2CCCCC2)CC1	ZINC000152900525	454738393	/nfs/dbraw/zinc/73/83/93/454738393.db2.gz	VOGPFZQPSPJKFY-UHFFFAOYSA-N	0	3	330.407	3.180	20	30		EGEDHN
COc1cc(CN2CC[C@H](Nc3ccc(C#N)cc3)C2)cc(OC)c1	ZINC000152964285	454747531	/nfs/dbraw/zinc/74/75/31/454747531.db2.gz	UDPQXDVNDDSPIH-SFHVURJKSA-N	0	3	337.423	3.262	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H](CC)Oc2ccccc2C)CC1	ZINC000176523497	454755557	/nfs/dbraw/zinc/75/55/57/454755557.db2.gz	XOMNAQAZVCQFBK-SFHVURJKSA-N	0	3	330.472	3.309	20	30		EGEDHN
CC1CCN([C@H](CNC(=O)c2ccc(C#N)cn2)c2ccccc2)CC1	ZINC000107565750	454763689	/nfs/dbraw/zinc/76/36/89/454763689.db2.gz	JKSGJDAXNZYKHE-HXUWFJFHSA-N	0	3	348.450	3.156	20	30		EGEDHN
Cc1cccc(N(CCC#N)C(=O)CN2C[C@@H]3CCC[C@H]3C2)c1C	ZINC000153199986	454769648	/nfs/dbraw/zinc/76/96/48/454769648.db2.gz	SGBLDBORVKANJS-ROUUACIJSA-N	0	3	325.456	3.282	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccccc2SC[C@H](C)C#N)CC1	ZINC000108241064	454790312	/nfs/dbraw/zinc/79/03/12/454790312.db2.gz	RWQCOYZYUMSDAX-OAHLLOKOSA-N	0	3	341.480	3.222	20	30		EGEDHN
COc1cc(OC)cc(N2CC[C@@H](NCc3ccc(C#N)s3)C2)c1	ZINC000176981739	454807785	/nfs/dbraw/zinc/80/77/85/454807785.db2.gz	YICWJGFOQOYABH-CYBMUJFWSA-N	0	3	343.452	3.005	20	30		EGEDHN
CC[C@@H](NCc1cccc(C#N)c1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000153641371	454816319	/nfs/dbraw/zinc/81/63/19/454816319.db2.gz	YJFFXCASBYPJCS-FGZHOGPDSA-N	0	3	349.478	3.327	20	30		EGEDHN
CC[C@H](NCCS(=O)(=O)c1cccc(C#N)c1)c1cccs1	ZINC000163149819	454825689	/nfs/dbraw/zinc/82/56/89/454825689.db2.gz	OZBMYWGZASWYDE-HNNXBMFYSA-N	0	3	334.466	3.134	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NCC1CCN(Cc2cccs2)CC1	ZINC000145652388	454853963	/nfs/dbraw/zinc/85/39/63/454853963.db2.gz	KGXUUUWEXKXUGT-OAHLLOKOSA-N	0	3	336.501	3.058	20	30		EGEDHN
Cc1ccccc1[C@@H](C(C)C)N(C)CC(=O)N[C@@](C)(C#N)C1CC1	ZINC000112357617	454885609	/nfs/dbraw/zinc/88/56/09/454885609.db2.gz	KSHJDLAATCZTJK-UXHICEINSA-N	0	3	327.472	3.432	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@H](CC)[C@H]1CCCO1	ZINC000182326548	455489933	/nfs/dbraw/zinc/48/99/33/455489933.db2.gz	BFQIINGAUNUXRY-GDBMZVCRSA-N	0	3	334.485	3.450	20	30		EGEDHN
C[C@H](NC(C)(C)CNC(=O)N1CCC(C#N)CC1)c1ccccc1	ZINC000113625914	454932727	/nfs/dbraw/zinc/93/27/27/454932727.db2.gz	LDVISPSRPMWXKG-HNNXBMFYSA-N	0	3	328.460	3.061	20	30		EGEDHN
C=CCCC[C@@H](C)N[C@@H](C(N)=O)c1ccc(Br)cc1	ZINC000182343756	455493640	/nfs/dbraw/zinc/49/36/40/455493640.db2.gz	IPAGWTQWNAEJPZ-BXUZGUMPSA-N	0	3	325.250	3.310	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2CCC[C@@H](SCC)C2)CC1	ZINC000175739750	455490628	/nfs/dbraw/zinc/49/06/28/455490628.db2.gz	URWUKNBVIDDCNX-IAGOWNOFSA-N	0	3	339.549	3.390	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)c1c(F)cccc1F	ZINC000151146386	454944714	/nfs/dbraw/zinc/94/47/14/454944714.db2.gz	HGEPRUDITMVIDW-UHFFFAOYSA-N	0	3	343.377	3.040	20	30		EGEDHN
C=CCN(CCc1ccccc1)C(=O)N[C@H]1C[C@@H](C)N(C2CC2)C1	ZINC000127618765	454982984	/nfs/dbraw/zinc/98/29/84/454982984.db2.gz	BUUFVPZWGZBHHT-AEFFLSMTSA-N	0	3	327.472	3.052	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)CN[C@H](C)c1ccc2c(c1)CCCC2	ZINC000128209645	455035708	/nfs/dbraw/zinc/03/57/08/455035708.db2.gz	JFIVHRNYLIRIHE-FOIQADDNSA-N	0	3	327.472	3.270	20	30		EGEDHN
C[C@@H]1CN(CC2CCN(Cc3ccc(C#N)cc3F)CC2)C[C@H](C)O1	ZINC000171306840	455060161	/nfs/dbraw/zinc/06/01/61/455060161.db2.gz	DEYCAYMIWGRBID-IYBDPMFKSA-N	0	3	345.462	3.019	20	30		EGEDHN
C[C@@H]1CN(CC2CCN(Cc3ccc(C#N)cc3F)CC2)C[C@@H](C)O1	ZINC000171306850	455060549	/nfs/dbraw/zinc/06/05/49/455060549.db2.gz	DEYCAYMIWGRBID-HZPDHXFCSA-N	0	3	345.462	3.019	20	30		EGEDHN
C=CC[C@H](C)NC(=O)NC[C@@H](c1cccc(OC)c1)N(CC)CC	ZINC000116938356	455075741	/nfs/dbraw/zinc/07/57/41/455075741.db2.gz	DSYKKUHLPOXCBR-YJBOKZPZSA-N	0	3	333.476	3.342	20	30		EGEDHN
COc1ccc(F)cc1[C@@H](C)NCCC(=O)Nc1ccc(C#N)cc1	ZINC000179938154	455102501	/nfs/dbraw/zinc/10/25/01/455102501.db2.gz	YYKFATLNCHQEIR-CYBMUJFWSA-N	0	3	341.386	3.385	20	30		EGEDHN
C[C@H]1SCCN(CCC(=O)Nc2sc3c(c2C#N)CCC3)[C@H]1C	ZINC000118415285	455105019	/nfs/dbraw/zinc/10/50/19/455105019.db2.gz	LCJUWFRQCKDOQT-NWDGAFQWSA-N	0	3	349.525	3.263	20	30		EGEDHN
C=CCOCCCC(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1	ZINC000118962385	455117601	/nfs/dbraw/zinc/11/76/01/455117601.db2.gz	GUIGNKVLOUGFJD-UHFFFAOYSA-N	0	3	345.487	3.138	20	30		EGEDHN
CCOC[C@H]1CCCN(Cc2cn(C)nc2-c2ccc(C#N)cc2)C1	ZINC000180159006	455141446	/nfs/dbraw/zinc/14/14/46/455141446.db2.gz	JVXOUFWNQAJPLN-KRWDZBQOSA-N	0	3	338.455	3.207	20	30		EGEDHN
CC[C@H](N[C@@H](C)C(=O)NC1(C#N)CCCCC1)c1ccc(OC)cc1	ZINC000157029584	455161918	/nfs/dbraw/zinc/16/19/18/455161918.db2.gz	QLCLWSRJGHHWQT-YJBOKZPZSA-N	0	3	343.471	3.467	20	30		EGEDHN
COc1ccc(OCc2ccccn2)c(CNCCCCC#N)c1	ZINC000237300133	455170596	/nfs/dbraw/zinc/17/05/96/455170596.db2.gz	HKYFVABMLRSRSC-UHFFFAOYSA-N	0	3	325.412	3.453	20	30		EGEDHN
CN1CCC(C(=O)N[C@H](C#N)c2cccc(Cl)c2Cl)CC1	ZINC000172797573	455188962	/nfs/dbraw/zinc/18/89/62/455188962.db2.gz	MHAWYHREQLVGFB-CYBMUJFWSA-N	0	3	326.227	3.016	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN(C)CCc1ncc(C)s1	ZINC000157406199	455191870	/nfs/dbraw/zinc/19/18/70/455191870.db2.gz	YEXOILFMJNKEBL-QGZVFWFLSA-N	0	3	346.496	3.094	20	30		EGEDHN
COC[C@H](NCC(=O)Nc1ccccc1S[C@@H](C)CC#N)C1CC1	ZINC000183432973	455292599	/nfs/dbraw/zinc/29/25/99/455292599.db2.gz	OEWYOLOZWIWNFX-BBRMVZONSA-N	0	3	347.484	3.034	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@H](C)N[C@@H](CC)c1ccc2c(c1)OCCO2	ZINC000180642651	455216305	/nfs/dbraw/zinc/21/63/05/455216305.db2.gz	UIPXQZTXZXUBIY-RDJZCZTQSA-N	0	3	346.471	3.312	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/[C@@H]2CCC[C@@H](C(=O)N(C)C)C2)c([O-])c1	ZINC000265114296	455300963	/nfs/dbraw/zinc/30/09/63/455300963.db2.gz	FJSUMQXBEKHGPU-PXBQPPJSSA-N	0	3	345.487	3.304	20	30		EGEDHN
CC(C)(C)[C@H](CCO)NCC#Cc1ccc(OC(F)(F)F)cc1	ZINC000183694024	455322403	/nfs/dbraw/zinc/32/24/03/455322403.db2.gz	KSKNOORWZJTHGD-HNNXBMFYSA-N	0	3	329.362	3.323	20	30		EGEDHN
C[C@H](NCc1ccc(CN2CCN(C)CC2)cc1)c1cccc(C#N)c1	ZINC000181541593	455351944	/nfs/dbraw/zinc/35/19/44/455351944.db2.gz	RCXCAWYWYNNOQS-SFHVURJKSA-N	0	3	348.494	3.156	20	30		EGEDHN
Cc1ccc(O)c([C@H](C)N[C@H]2CCN(Cc3ccc(C#N)cc3)C2=O)c1	ZINC000190618280	455354283	/nfs/dbraw/zinc/35/42/83/455354283.db2.gz	CPFGSMQOIRZAEU-KXBFYZLASA-N	0	3	349.434	3.024	20	30		EGEDHN
CN(C)CCNC(=O)Nc1ccc(Oc2ccccc2C#N)c(F)c1	ZINC000181615571	455363031	/nfs/dbraw/zinc/36/30/31/455363031.db2.gz	YQVWQZXUIGURBI-UHFFFAOYSA-N	0	3	342.374	3.173	20	30		EGEDHN
CCN(CC)[C@H](CNCc1cc(C#N)n(C)c1)c1cccc(OC)c1	ZINC000190712040	455372129	/nfs/dbraw/zinc/37/21/29/455372129.db2.gz	GERDXKDMFWDNDZ-HXUWFJFHSA-N	0	3	340.471	3.078	20	30		EGEDHN
C[C@@H](C#N)Oc1ccccc1NC(=O)NC[C@H](C)N1CCC(C)CC1	ZINC000184356528	455372800	/nfs/dbraw/zinc/37/28/00/455372800.db2.gz	LPYFXVJBZKFORK-HOTGVXAUSA-N	0	3	344.459	3.219	20	30		EGEDHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)N[C@H](CCC#N)c2ccccc2)C1	ZINC000246005678	455412765	/nfs/dbraw/zinc/41/27/65/455412765.db2.gz	SIZJSKBQYUGZPM-IPMKNSEASA-N	0	3	340.471	3.157	20	30		EGEDHN
C[C@H](O)[C@@H]1CCCCN1CC#Cc1ccc(OC(F)(F)F)cc1	ZINC000160055905	455424871	/nfs/dbraw/zinc/42/48/71/455424871.db2.gz	OBZNRXZDWYJIDX-BBRMVZONSA-N	0	3	327.346	3.172	20	30		EGEDHN
C=CCn1c(SC[C@H]2CCN(C)C2)nnc1-c1ccc(C)cc1	ZINC000191194305	455461724	/nfs/dbraw/zinc/46/17/24/455461724.db2.gz	HEZGSVXMPDRCPR-HNNXBMFYSA-N	0	3	328.485	3.483	20	30		EGEDHN
COCCN(Cc1ccc(C#N)cc1)C[C@H](O)CCc1ccccc1	ZINC000182284053	455479660	/nfs/dbraw/zinc/47/96/60/455479660.db2.gz	BXXNWPWHOPHXCA-OAQYLSRUSA-N	0	3	338.451	3.000	20	30		EGEDHN
N#Cc1ccc(OCCN[C@@H]2CCO[C@@H]2c2ccc(F)c(F)c2)cc1	ZINC000192142816	455563510	/nfs/dbraw/zinc/56/35/10/455563510.db2.gz	MCRMKHXVCKPEKL-RTBURBONSA-N	0	3	344.361	3.335	20	30		EGEDHN
C[C@@H](NCC(=O)N(CCC#N)c1ccccc1)[C@H]1COc2ccccc21	ZINC000185601001	455583395	/nfs/dbraw/zinc/58/33/95/455583395.db2.gz	SOJZITFZHARKGB-VQIMIIECSA-N	0	3	349.434	3.088	20	30		EGEDHN
COC(=O)CCN(CCCC#N)Cc1cccc(Br)c1	ZINC000192328964	455591826	/nfs/dbraw/zinc/59/18/26/455591826.db2.gz	IEZNYTIQHSIXJM-UHFFFAOYSA-N	0	3	339.233	3.118	20	30		EGEDHN
Cc1ccc2c(c1)[C@H]1CN(C)CC[C@@H]1N2C(=O)c1ccc(F)c(C#N)c1	ZINC000283812197	455598550	/nfs/dbraw/zinc/59/85/50/455598550.db2.gz	IPPUZPRQAVNTBD-XLIONFOSSA-N	0	3	349.409	3.454	20	30		EGEDHN
C[C@@H](c1cccc(S(N)(=O)=O)c1)N(C)CCCCC(C)(C)C#N	ZINC000277571079	455602001	/nfs/dbraw/zinc/60/20/01/455602001.db2.gz	BJQVOJFDFCPRDY-AWEZNQCLSA-N	0	3	337.489	3.047	20	30		EGEDHN
C#CCOc1ccc(CN[C@@H](CN(C)C)c2ccc(OC)cc2)cc1	ZINC000283872963	455605703	/nfs/dbraw/zinc/60/57/03/455605703.db2.gz	GSGXSXJTKQQQIH-NRFANRHFSA-N	0	3	338.451	3.100	20	30		EGEDHN
CCOc1cc(N2CCN(C)CC2)ccc1N[C@@H]1CCC[C@H](C#N)C1	ZINC000185731042	455608872	/nfs/dbraw/zinc/60/88/72/455608872.db2.gz	QNWPVPAVIHETJT-DLBZAZTESA-N	0	3	342.487	3.331	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@H](C)Oc2cccc3ccccc32)CC1	ZINC000192532961	455637439	/nfs/dbraw/zinc/63/74/39/455637439.db2.gz	BYHXTVIOTBOVAK-INIZCTEOSA-N	0	3	338.451	3.374	20	30		EGEDHN
COc1ccccc1C(=O)C(C(=S)[N-]C1(C)CC1)[n+]1ccccc1	ZINC000284410436	455681744	/nfs/dbraw/zinc/68/17/44/455681744.db2.gz	NOHXDNVJTVOEEG-UHFFFAOYSA-O	0	3	341.456	3.064	20	30		EGEDHN
CCC[C@H](C)NC(=O)[C@H]1CCCN(Cc2ccc(C#N)cc2C)C1	ZINC000186191859	455714494	/nfs/dbraw/zinc/71/44/94/455714494.db2.gz	KEFSWRUJAIYXAI-LPHOPBHVSA-N	0	3	327.472	3.384	20	30		EGEDHN
CC(C)(C)[C@H](NCCC(C#N)(c1ccccc1)c1ccccc1)C(N)=O	ZINC000193071071	455740720	/nfs/dbraw/zinc/74/07/20/455740720.db2.gz	YFFQMWVYGWJPPS-LJQANCHMSA-N	0	3	349.478	3.376	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@H](C)CN2CCCCCC2)cc1OC	ZINC000186317170	455741318	/nfs/dbraw/zinc/74/13/18/455741318.db2.gz	CTEKJGQBPGLPPH-MRXNPFEDSA-N	0	3	346.471	3.254	20	30		EGEDHN
C=C(C)[C@@H](NC(=O)N1CC[C@]2(CCN(C)C2)C1)c1ccc(F)c(F)c1	ZINC000292732861	455743634	/nfs/dbraw/zinc/74/36/34/455743634.db2.gz	SQBNKQCCULTRFS-MJGOQNOKSA-N	0	3	349.425	3.319	20	30		EGEDHN
Cn1cc(CN[C@@H]2CCN(C)[C@H]2c2ccc(Cl)c(F)c2)cc1C#N	ZINC000249517987	455760507	/nfs/dbraw/zinc/76/05/07/455760507.db2.gz	KMZMHCLXSFZJQK-MSOLQXFVSA-N	0	3	346.837	3.224	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)c1cc(F)cc2nccnc21	ZINC000193580716	455766068	/nfs/dbraw/zinc/76/60/68/455766068.db2.gz	VTMUPQCZABHDEJ-ZDUSSCGKSA-N	0	3	345.337	3.146	20	30		EGEDHN
C#CCNC(=O)CCN(C)[C@H](C)c1sc(-c2ccccc2)nc1C	ZINC000292935744	455766927	/nfs/dbraw/zinc/76/69/27/455766927.db2.gz	ZMBNQTLRKZNBMR-OAHLLOKOSA-N	0	3	341.480	3.251	20	30		EGEDHN
CCN(CCN[C@H](C)c1ccc(OCC#N)cc1)C(=O)OC(C)(C)C	ZINC000271855825	455787837	/nfs/dbraw/zinc/78/78/37/455787837.db2.gz	JHZCSPCSJLXSOI-OAHLLOKOSA-N	0	3	347.459	3.497	20	30		EGEDHN
C=C(C)[C@H](NC(=O)NC[C@@H]1CCCN1CC)c1ccc(F)c(F)c1	ZINC000251880316	455798285	/nfs/dbraw/zinc/79/82/85/455798285.db2.gz	UTRYGYGJRAHLKF-YOEHRIQHSA-N	0	3	337.414	3.366	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](c2ccccc2)C(F)F)CC1	ZINC000294152598	455806684	/nfs/dbraw/zinc/80/66/84/455806684.db2.gz	HNLXMTAURVLVTE-INIZCTEOSA-N	0	3	337.414	3.333	20	30		EGEDHN
CC(=O)Nc1cccc(OCCN[C@@H](C)c2ccc(C#N)c(F)c2)c1	ZINC000271977537	455810558	/nfs/dbraw/zinc/81/05/58/455810558.db2.gz	WFFXWRFEGXOHBC-ZDUSSCGKSA-N	0	3	341.386	3.385	20	30		EGEDHN
C[C@@H](CNC(=O)C(C)(C)c1cc(F)cc(C#N)c1)N1CCC[C@@H](C)C1	ZINC000285315138	455822584	/nfs/dbraw/zinc/82/25/84/455822584.db2.gz	XETHISOQXZYCBH-CABCVRRESA-N	0	3	345.462	3.212	20	30		EGEDHN
C=CCOc1ccc(CN(C)[C@H](CO)c2ccccc2)cc1OC	ZINC000294996480	455834601	/nfs/dbraw/zinc/83/46/01/455834601.db2.gz	HZLFHDOMXPQXSD-GOSISDBHSA-N	0	3	327.424	3.425	20	30		EGEDHN
CC(C)(C)SCCNCc1cn(CCC#N)nc1-c1ccncc1	ZINC000278543643	455838635	/nfs/dbraw/zinc/83/86/35/455838635.db2.gz	AHXMIAFCFOXEMK-UHFFFAOYSA-N	0	3	343.500	3.480	20	30		EGEDHN
C#CCN(C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1)C1CCCC1	ZINC000194417650	455839447	/nfs/dbraw/zinc/83/94/47/455839447.db2.gz	BZQDYWSQTLSPEJ-IBGZPJMESA-N	0	3	339.483	3.096	20	30		EGEDHN
Cc1ccccc1CCN(C)C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000295331289	455846397	/nfs/dbraw/zinc/84/63/97/455846397.db2.gz	FAOXRUXPJYMSLD-HXUWFJFHSA-N	0	3	331.419	3.250	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CN(Cc2ccccc2)CCCO1	ZINC000278745913	455847463	/nfs/dbraw/zinc/84/74/63/455847463.db2.gz	WRRBFNZUJSOSKH-QFIPXVFZSA-N	0	3	349.478	3.281	20	30		EGEDHN
CC[C@@H](C)[C@@H](C)NC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000194474178	455847572	/nfs/dbraw/zinc/84/75/72/455847572.db2.gz	ASDYDPDGVZPOTR-HZPDHXFCSA-N	0	3	330.476	3.066	20	30		EGEDHN
CC[C@@H](NCc1ccc(NS(C)(=O)=O)cc1)c1ccc(C#N)cc1	ZINC000278869210	455851114	/nfs/dbraw/zinc/85/11/14/455851114.db2.gz	WWCZZOLTPWJTMC-GOSISDBHSA-N	0	3	343.452	3.171	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/[C@H](c2nncn2C)C(C)C)c([O-])c1	ZINC000285465410	455851440	/nfs/dbraw/zinc/85/14/40/455851440.db2.gz	QZTPBIQVGXYLIX-WAKXPGHKSA-N	0	3	329.448	3.183	20	30		EGEDHN
C[N@H+](Cc1cn(CCC#N)nc1-c1ccncc1)Cc1ccccc1[O-]	ZINC000278990386	455855214	/nfs/dbraw/zinc/85/52/14/455855214.db2.gz	BGMLTIFVCBBYSJ-UHFFFAOYSA-N	0	3	347.422	3.196	20	30		EGEDHN
C[N@@H+](Cc1cn(CCC#N)nc1-c1ccncc1)Cc1ccccc1[O-]	ZINC000278990386	455855216	/nfs/dbraw/zinc/85/52/16/455855216.db2.gz	BGMLTIFVCBBYSJ-UHFFFAOYSA-N	0	3	347.422	3.196	20	30		EGEDHN
CCC[C@@]1(NCC(=O)N(CCC#N)c2cccc(C)c2C)CCOC1	ZINC000285614650	455883022	/nfs/dbraw/zinc/88/30/22/455883022.db2.gz	QGGGZGOQOKXXGB-HXUWFJFHSA-N	0	3	343.471	3.099	20	30		EGEDHN
CN(C)Cc1ccccc1CNC(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000280087995	455888504	/nfs/dbraw/zinc/88/85/04/455888504.db2.gz	ANIAHYXNCVDZBN-UHFFFAOYSA-N	0	3	335.451	3.479	20	30		EGEDHN
CCC[C@]1(COC)CCCN1CC(=O)N(CCC#N)c1ccccc1	ZINC000194921928	455900416	/nfs/dbraw/zinc/90/04/16/455900416.db2.gz	MRZJOQCWMWJMGV-HXUWFJFHSA-N	0	3	343.471	3.214	20	30		EGEDHN
C=CCC[C@@H](NCCNC(=O)c1ccc(OC)cc1)c1ccco1	ZINC000285893223	455937236	/nfs/dbraw/zinc/93/72/36/455937236.db2.gz	CJJRVDXGNMNBNS-QGZVFWFLSA-N	0	3	328.412	3.315	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1C[C@@H]2CCCN2Cc2ccccc21)OCC	ZINC000270372857	455940953	/nfs/dbraw/zinc/94/09/53/455940953.db2.gz	ULTUPLRVOWGVBP-PKOBYXMFSA-N	0	3	328.456	3.369	20	30		EGEDHN
C=C(C)CN1CCC(N[C@H](c2ncc[nH]2)c2ccc(F)cc2)CC1	ZINC000187977719	455976085	/nfs/dbraw/zinc/97/60/85/455976085.db2.gz	JQTMTKLTDMDVDW-SFHVURJKSA-N	0	3	328.435	3.268	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NCC(C)(C)N1CCc2ccccc2C1	ZINC000188147847	456008307	/nfs/dbraw/zinc/00/83/07/456008307.db2.gz	CWWNQBYITLMKHG-NRFANRHFSA-N	0	3	344.499	3.168	20	30		EGEDHN
C[C@H](CN1CCC[C@H](C)C1)NC(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000280597814	456009682	/nfs/dbraw/zinc/00/96/82/456009682.db2.gz	NTASYZUNGNTACC-JKSUJKDBSA-N	0	3	327.472	3.338	20	30		EGEDHN
COC[C@@H](NC1CCN(c2ccc(C#N)cc2)CC1)c1ccc(C)o1	ZINC000286297192	456017999	/nfs/dbraw/zinc/01/79/99/456017999.db2.gz	WLRDPXRHACWYSV-LJQANCHMSA-N	0	3	339.439	3.406	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C2(Cc3ccccc3F)CC2)CC1	ZINC000188455010	456065875	/nfs/dbraw/zinc/06/58/75/456065875.db2.gz	BFDNQHGKDCFYFQ-UHFFFAOYSA-N	0	3	330.447	3.305	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCC=C(c3ccco3)C2)CC1	ZINC000287440033	456069314	/nfs/dbraw/zinc/06/93/14/456069314.db2.gz	QNQQAWGJSNDPDQ-UHFFFAOYSA-N	0	3	329.444	3.119	20	30		EGEDHN
CC(C)(C#N)CCCCN1C[C@@H]2[C@H](C1)OCCN2Cc1ccccc1	ZINC000280880509	456071711	/nfs/dbraw/zinc/07/17/11/456071711.db2.gz	PCROKVXLJACQNE-UXHICEINSA-N	0	3	341.499	3.292	20	30		EGEDHN
N#CC1(C(=O)N2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)CCCC1	ZINC000288618864	456100069	/nfs/dbraw/zinc/10/00/69/456100069.db2.gz	ZYZVIXOWEDAEME-HXUWFJFHSA-N	0	3	337.467	3.195	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H]2CC[C@@H](c3cccc(F)c3)C2)CC1	ZINC000281005012	456106613	/nfs/dbraw/zinc/10/66/13/456106613.db2.gz	WFFJKUXIVFACOM-APWZRJJASA-N	0	3	345.462	3.411	20	30		EGEDHN
CC(C)c1nc2n(n1)C[C@H](N[C@H](C)c1ccc(C#N)cc1F)CC2	ZINC000332690539	456112868	/nfs/dbraw/zinc/11/28/68/456112868.db2.gz	WHOLFOKRMUBUBF-TZMCWYRMSA-N	0	3	327.407	3.078	20	30		EGEDHN
C=C(CN[C@@H]1CCCc2ccc(S(N)(=O)=O)cc21)c1ccccc1	ZINC000289577397	456131501	/nfs/dbraw/zinc/13/15/01/456131501.db2.gz	DRAOTXIZRRQCRS-LJQANCHMSA-N	0	3	342.464	3.014	20	30		EGEDHN
C=CC[C@@H]1N(C(=O)Nc2ccnn2CCN(C)C)CCCC1(C)C	ZINC000297157695	456135416	/nfs/dbraw/zinc/13/54/16/456135416.db2.gz	GPPGBDRQBRYWKA-HNNXBMFYSA-N	0	3	333.480	3.043	20	30		EGEDHN
C#CCCOc1ccc(CN2CCC[C@](O)(C(F)(F)F)CC2)cc1	ZINC000289734957	456139010	/nfs/dbraw/zinc/13/90/10/456139010.db2.gz	PXRDYQCBWXVGKK-QGZVFWFLSA-N	0	3	341.373	3.368	20	30		EGEDHN
CNc1ccc(C#N)cc1NC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000281205555	456164738	/nfs/dbraw/zinc/16/47/38/456164738.db2.gz	QAMRALKCAAVTAI-UHFFFAOYSA-N	0	3	348.450	3.451	20	30		EGEDHN
COc1cc(C#N)ccc1CN1CC[C@H](C(=O)N(C)c2ccccc2)C1	ZINC000281275795	456186156	/nfs/dbraw/zinc/18/61/56/456186156.db2.gz	VYORKUQGKLKWAA-SFHVURJKSA-N	0	3	349.434	3.052	20	30		EGEDHN
CN(C)CCOc1cccc(-c2noc(-c3ccc(CC#N)cc3)n2)c1	ZINC000273915210	456247097	/nfs/dbraw/zinc/24/70/97/456247097.db2.gz	QEOAGJGAAAUXMS-UHFFFAOYSA-N	0	3	348.406	3.410	20	30		EGEDHN
CC(C)OC(=O)C[C@H]1CCCN(Cc2ccc(OCC#N)cc2)C1	ZINC000274318323	456255465	/nfs/dbraw/zinc/25/54/65/456255465.db2.gz	OEXPYEWLPMVQOD-QGZVFWFLSA-N	0	3	330.428	3.143	20	30		EGEDHN
C=C[C@H](CC(=O)NCC(C)(C)N1CCC(OC)CC1)c1ccccc1	ZINC000340159830	456284304	/nfs/dbraw/zinc/28/43/04/456284304.db2.gz	OFQYRCWJFJQFNN-QGZVFWFLSA-N	0	3	344.499	3.352	20	30		EGEDHN
N#Cc1c(NC[C@@H]2CCCN2Cc2ccccc2)nc2ccccn12	ZINC000302115137	456291381	/nfs/dbraw/zinc/29/13/81/456291381.db2.gz	VWGVNHBXBHVMSK-KRWDZBQOSA-N	0	3	331.423	3.282	20	30		EGEDHN
COc1cc(CN[C@@H](C)C[C@@H](O)c2ccc(F)cc2)ccc1C#N	ZINC000281698601	456295576	/nfs/dbraw/zinc/29/55/76/456295576.db2.gz	NOCXVBWGBHYNHE-SCLBCKFNSA-N	0	3	328.387	3.308	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1C[C@H](C)CC[C@H]1c1ccccc1	ZINC000352801772	456321816	/nfs/dbraw/zinc/32/18/16/456321816.db2.gz	UFLNIHGTUYQVAH-LMMKCTJWSA-N	0	3	327.472	3.468	20	30		EGEDHN
CCOC(=O)C1(N(C)CCCC2(C#N)CCOCC2)CCCCC1	ZINC000337188157	456336155	/nfs/dbraw/zinc/33/61/55/456336155.db2.gz	QNOPBCXKUIZWDM-UHFFFAOYSA-N	0	3	336.476	3.285	20	30		EGEDHN
C=CCCN1CCN(Cc2ccc(Br)c(F)c2)CC1	ZINC000337280206	456342717	/nfs/dbraw/zinc/34/27/17/456342717.db2.gz	VBCQVNNYMVOZCT-UHFFFAOYSA-N	0	3	327.241	3.282	20	30		EGEDHN
C[C@](C#N)(NC(=O)CN[C@H](Cc1ccccc1)c1ccccc1)C1CC1	ZINC000302589959	456363638	/nfs/dbraw/zinc/36/36/38/456363638.db2.gz	JGWHDLGUJMWNCS-IFMALSPDSA-N	0	3	347.462	3.368	20	30		EGEDHN
C[C@@H]1CN(CC2CCN(Cc3cccc(C#N)c3F)CC2)C[C@@H](C)O1	ZINC000352886257	456390220	/nfs/dbraw/zinc/39/02/20/456390220.db2.gz	GIAPMXPKSBKXMR-HZPDHXFCSA-N	0	3	345.462	3.019	20	30		EGEDHN
CC(C)Oc1cc(C(=O)C(C#N)c2nc3ccccc3n2C)ccn1	ZINC000347846794	456401781	/nfs/dbraw/zinc/40/17/81/456401781.db2.gz	NCMCFSHBNWRVMB-CQSZACIVSA-N	0	3	334.379	3.246	20	30		EGEDHN
C=CCN1CC[C@H](N2CCCCC[C@@H]2C[C@H](O)c2cccs2)C1=O	ZINC000282134141	456421970	/nfs/dbraw/zinc/42/19/70/456421970.db2.gz	YYRMEZUIXKOFGO-IKGGRYGDSA-N	0	3	348.512	3.203	20	30		EGEDHN
Cc1cc(C#N)ccc1C(=O)N(C)C[C@H]1CCN(C)[C@@H]1c1cccnc1	ZINC000343128150	456422543	/nfs/dbraw/zinc/42/25/43/456422543.db2.gz	NRVVAPRENAJOFP-UYAOXDASSA-N	0	3	348.450	3.027	20	30		EGEDHN
COC(=O)C[C@@H](NCc1cc(C#N)ccc1OC)C1CCCCC1	ZINC000347958396	456429958	/nfs/dbraw/zinc/42/99/58/456429958.db2.gz	KOGGNAUZSKIEOT-QGZVFWFLSA-N	0	3	330.428	3.168	20	30		EGEDHN
COc1cc(CN(C)[C@@H](C)c2ccc(-n3cncn3)cc2)ccc1C#N	ZINC000282347906	456485574	/nfs/dbraw/zinc/48/55/74/456485574.db2.gz	PDTXXCSQLCWGDZ-HNNXBMFYSA-N	0	3	347.422	3.341	20	30		EGEDHN
C=C[C@H](CC(=O)N(CCCOC)C1CCN(C)CC1)c1ccccc1	ZINC000290821017	456437314	/nfs/dbraw/zinc/43/73/14/456437314.db2.gz	BTEIWBJUVZOJAJ-GOSISDBHSA-N	0	3	344.499	3.306	20	30		EGEDHN
Cc1ccccc1[C@@H]1CCN([C@H]2CCN(c3ccc(C#N)cc3)C2=O)C1	ZINC000337696850	456487992	/nfs/dbraw/zinc/48/79/92/456487992.db2.gz	TVEKJRDYCHXVTF-NQIIRXRSSA-N	0	3	345.446	3.462	20	30		EGEDHN
COc1cc(CN2CCC[C@H]2C[C@H](O)c2ccco2)ccc1C#N	ZINC000282384041	456496932	/nfs/dbraw/zinc/49/69/32/456496932.db2.gz	QVMNZMPJWFIIGB-IRXDYDNUSA-N	0	3	326.396	3.248	20	30		EGEDHN
CC(C)(C)[C@@H]1NC(=O)CC[C@H]1NCc1cccc(OCCCC#N)c1	ZINC000353116049	456500016	/nfs/dbraw/zinc/50/00/16/456500016.db2.gz	ZJLSNPHXUWNTHN-IEBWSBKVSA-N	0	3	343.471	3.152	20	30		EGEDHN
C=CCC[C@@H](O)CN1CCC(c2nc(-c3ccccc3)no2)CC1	ZINC000305077813	456524125	/nfs/dbraw/zinc/52/41/25/456524125.db2.gz	LOFWFKLDRBDLGQ-QGZVFWFLSA-N	0	3	327.428	3.243	20	30		EGEDHN
Cc1nc2ccccc2n1C[C@H]1CCCN1Cc1cc(C#N)n(C)c1	ZINC000276695704	456554015	/nfs/dbraw/zinc/55/40/15/456554015.db2.gz	ADMMSXIMJKWJOA-QGZVFWFLSA-N	0	3	333.439	3.220	20	30		EGEDHN
Cc1ccc(C[C@@H](C)NC(=O)C(C#N)Cc2ccc(C#N)cc2)s1	ZINC000348281192	456595009	/nfs/dbraw/zinc/59/50/09/456595009.db2.gz	KERUYEDRFJFWIH-CXAGYDPISA-N	0	3	337.448	3.358	20	30		EGEDHN
Cn1cc(CNCC2(NC(=O)OC(C)(C)C)CCCCC2)cc1C#N	ZINC000276939746	456625609	/nfs/dbraw/zinc/62/56/09/456625609.db2.gz	GMMXAOGUMKBAPF-UHFFFAOYSA-N	0	3	346.475	3.214	20	30		EGEDHN
C[C@H](c1ccccc1)N1CCC(NC(=O)NCC(C)(C)C#N)CC1	ZINC000353395162	456672045	/nfs/dbraw/zinc/67/20/45/456672045.db2.gz	NAIRVOJZLYWKCA-OAHLLOKOSA-N	0	3	328.460	3.061	20	30		EGEDHN
CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)C(=O)NCC1(C2CC2)CC1	ZINC000328616648	456720861	/nfs/dbraw/zinc/72/08/61/456720861.db2.gz	BXVZDQYWUKNZSR-WMZOPIPTSA-N	0	3	342.487	3.110	20	30		EGEDHN
Cc1nc2c(cccc2C(=O)N[C@@H]2CN(C)C[C@@H]2c2ccccc2)[nH]1	ZINC000328678110	456734882	/nfs/dbraw/zinc/73/48/82/456734882.db2.gz	AYVNWVYDKTWDDB-SJLPKXTDSA-N	0	3	334.423	3.274	20	30		EGEDHN
COc1ccccc1[C@H](C)NC(=O)CN1CC[C@H](C2CCOCC2)C1	ZINC000328723906	456745845	/nfs/dbraw/zinc/74/58/45/456745845.db2.gz	APSHUJQQPIICMR-RDJZCZTQSA-N	0	3	346.471	3.461	20	30		EGEDHN
Cn1cc(C(F)(F)F)nc1[C@@H]1CCCN(CCCSCC#N)C1	ZINC000343749769	456772490	/nfs/dbraw/zinc/77/24/90/456772490.db2.gz	CCOGPGZHNJLWFY-GFCCVEGCSA-N	0	3	346.422	3.265	20	30		EGEDHN
Cc1nc([C@@H]2CCCOC2)sc1C(=O)N[C@@H](C)C1=CCN(C)CC1	ZINC000328957007	456799568	/nfs/dbraw/zinc/79/95/68/456799568.db2.gz	JHLGTCHLDHXTSQ-SWLSCSKDSA-N	0	3	349.500	3.301	20	30		EGEDHN
O=C(NC[C@@H]1CCCN1Cc1ccccc1)[C@H]1CCn2cncc2C1	ZINC000328958863	456801867	/nfs/dbraw/zinc/80/18/67/456801867.db2.gz	ORCQOSUDDFQFHN-ROUUACIJSA-N	0	3	338.455	3.067	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1ccnc(C2CC2)c1)C(C)C	ZINC000341095918	456817752	/nfs/dbraw/zinc/81/77/52/456817752.db2.gz	OMWNLNAZVCHBLM-IBGZPJMESA-N	0	3	327.472	3.387	20	30		EGEDHN
N#C[C@@H](NC(=O)c1ccc(CN2CCCC2)cc1)c1ccccc1F	ZINC000338534078	456836998	/nfs/dbraw/zinc/83/69/98/456836998.db2.gz	CAEQGVDYYLPDRE-LJQANCHMSA-N	0	3	337.398	3.416	20	30		EGEDHN
CCN(Cc1ccc(C(=O)N[C@@](C)(C#N)CCSC)cc1)C1CC1	ZINC000344670752	456846087	/nfs/dbraw/zinc/84/60/87/456846087.db2.gz	MKPYIDGRYGDHGA-LJQANCHMSA-N	0	3	345.512	3.436	20	30		EGEDHN
CCC1CCC(N(C)CC(=O)N[C@@H](C)C(=O)N2CCCCC2)CC1	ZINC000329190357	456851526	/nfs/dbraw/zinc/85/15/26/456851526.db2.gz	RAQBRLWNMXQFGS-GTPINHCMSA-N	0	3	337.508	3.245	20	30		EGEDHN
CCCN1CCC[C@H]1CNC(=O)c1ccc2c(c1)NC(=O)CCN2C	ZINC000329223680	456855849	/nfs/dbraw/zinc/85/58/49/456855849.db2.gz	YKBOCBHZEOASAF-HNNXBMFYSA-N	0	3	344.459	3.294	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN(C)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1	ZINC000348822303	456870950	/nfs/dbraw/zinc/87/09/50/456870950.db2.gz	NRTLGQPFQCCFDP-MOPGFXCFSA-N	0	3	348.462	3.402	20	30		EGEDHN
Cn1ccc(C(=O)C(C#N)c2nnc3n2CCCCC3)c1C1CCC1	ZINC000344924377	456871743	/nfs/dbraw/zinc/87/17/43/456871743.db2.gz	XEIVEYZIBCJHRK-OAHLLOKOSA-N	0	3	337.427	3.101	20	30		EGEDHN
CC[C@@H]1CCCCN1CCNC(=O)N1CCCC[C@@H]1c1ccnn1C	ZINC000329338346	456875627	/nfs/dbraw/zinc/87/56/27/456875627.db2.gz	QJUVRARKYAOTNT-SJLPKXTDSA-N	0	3	347.507	3.126	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)Cc1ccccc1N(C)C	ZINC000348889612	456886725	/nfs/dbraw/zinc/88/67/25/456886725.db2.gz	CKGIZRAQSDEQHP-UHFFFAOYSA-N	0	3	336.483	3.188	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2ccc(F)c(C#N)c2)CN1Cc1ccccc1	ZINC000353766338	456897964	/nfs/dbraw/zinc/89/79/64/456897964.db2.gz	GPIYRUNIYJOZDC-RDTXWAMCSA-N	0	3	337.398	3.090	20	30		EGEDHN
C=C(C)COc1cc(CNCCOc2ncccc2F)ccc1OC	ZINC000345019493	456899910	/nfs/dbraw/zinc/89/99/10/456899910.db2.gz	MWYSTLKVDWHKSE-UHFFFAOYSA-N	0	3	346.402	3.353	20	30		EGEDHN
N#Cc1ccc([C@@H](N[C@H]2CC=C(c3ccc(F)cc3)CC2)C(N)=O)cc1	ZINC000349221943	456916305	/nfs/dbraw/zinc/91/63/05/456916305.db2.gz	FKJFHLIPORPOIP-VQTJNVASSA-N	0	3	349.409	3.449	20	30		EGEDHN
Cc1cccc(N2CCN(CCCNc3cc(C)nc(C#N)c3)CC2)c1	ZINC000341744175	456924234	/nfs/dbraw/zinc/92/42/34/456924234.db2.gz	NMZRCUDMJRMOPV-UHFFFAOYSA-N	0	3	349.482	3.194	20	30		EGEDHN
CCSc1ccc([C@H](C)N[C@@H](C)C(=O)NC2(C#N)CCC2)cc1	ZINC000345110329	456929267	/nfs/dbraw/zinc/92/92/67/456929267.db2.gz	IDLUOCHURMEEKD-KBPBESRZSA-N	0	3	331.485	3.400	20	30		EGEDHN
CC1(C)CCCN(CCNC(=O)c2ccc(C3(C#N)CC3)cc2)C1	ZINC000329906800	456959421	/nfs/dbraw/zinc/95/94/21/456959421.db2.gz	KILBCGVAFJGHBB-UHFFFAOYSA-N	0	3	325.456	3.094	20	30		EGEDHN
C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)CCc1nnc(C2CCCC2)o1	ZINC000329930690	456962400	/nfs/dbraw/zinc/96/24/00/456962400.db2.gz	ZUOWXFQKGSMGHW-IUODEOHRSA-N	0	3	332.448	3.099	20	30		EGEDHN
O=C(N[C@H](CO)Cc1ccc(O)cc1)[C@H]1CCCCN1C1CCCC1	ZINC000329947160	456965574	/nfs/dbraw/zinc/96/55/74/456965574.db2.gz	JXJNNBCIKAMSIJ-QFBILLFUSA-N	0	3	346.471	3.049	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC[C@H]2CCC3(CCCCC3)O2)CC1	ZINC000330044475	456978352	/nfs/dbraw/zinc/97/83/52/456978352.db2.gz	FUBQUXXSBWAJGM-GOSISDBHSA-N	0	3	349.519	3.412	20	30		EGEDHN
C=CC[C@@H](CO)CN[C@H]1CCc2c1c(Br)ccc2F	ZINC000341869958	456979686	/nfs/dbraw/zinc/97/96/86/456979686.db2.gz	AKHARSQKXXXRJI-YGRLFVJLSA-N	0	3	328.225	3.350	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)[C@](C)(C#N)CC)c1cccc(OC)c1	ZINC000349520787	456980968	/nfs/dbraw/zinc/98/09/68/456980968.db2.gz	JEEYHNAPGHJNEX-MJGOQNOKSA-N	0	3	331.460	3.134	20	30		EGEDHN
CC[C@H](C)n1ncc(NC(=O)N2CCCC23CCN(C)CC3)c1C	ZINC000330141589	456990610	/nfs/dbraw/zinc/99/06/10/456990610.db2.gz	XSPXYLIXLGDOJH-AWEZNQCLSA-N	0	3	333.480	3.268	20	30		EGEDHN
CC[C@H](C(=O)Nc1nc(C)c(SCC#N)s1)N(CC)CC	ZINC000345982401	457010007	/nfs/dbraw/zinc/01/00/07/457010007.db2.gz	JCVJTXPQULFLCS-LLVKDONJSA-N	0	3	326.491	3.126	20	30		EGEDHN
COc1cc(C(=O)N[C@@H]2CCN(C)[C@H](C)C2)ccc1OC(F)F	ZINC000330905322	457103171	/nfs/dbraw/zinc/10/31/71/457103171.db2.gz	MTUXZYMVJCYCTN-ZYHUDNBSSA-N	0	3	328.359	3.084	20	30		EGEDHN
CN(C)C(=O)Nc1cccc(C(=O)NCCN2CCCC(C)(C)C2)c1	ZINC000330969163	457111311	/nfs/dbraw/zinc/11/13/11/457111311.db2.gz	MCBHBLSFGCOOBB-UHFFFAOYSA-N	0	3	346.475	3.220	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)[C@@H](CC)N(CC)CC)cc1	ZINC000359797930	457131058	/nfs/dbraw/zinc/13/10/58/457131058.db2.gz	NPSIRAWGSCJHGP-GOSISDBHSA-N	0	3	331.460	3.452	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN2C[C@H](C)CC2(C)C)cc1	ZINC000350255198	457172907	/nfs/dbraw/zinc/17/29/07/457172907.db2.gz	QJIWIRRKMCUSET-MRXNPFEDSA-N	0	3	343.471	3.452	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)N2CCC(C)(C#N)CC2)C1	ZINC000331501420	457195101	/nfs/dbraw/zinc/19/51/01/457195101.db2.gz	BMZXDUWHOAFWJR-WMZOPIPTSA-N	0	3	340.471	3.157	20	30		EGEDHN
CC(C#N)C(=O)N[C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1	ZINC000356891060	457201406	/nfs/dbraw/zinc/20/14/06/457201406.db2.gz	HBUKGDBRKXKRHA-NHYWBVRUSA-N	0	3	340.345	3.449	20	30		EGEDHN
C[C@H](O)[C@H]1CCN(Cc2cccc(OCc3ccccc3C#N)c2)C1	ZINC000356919810	457219992	/nfs/dbraw/zinc/21/99/92/457219992.db2.gz	SCHJYYYFAUJDNF-LPHOPBHVSA-N	0	3	336.435	3.340	20	30		EGEDHN
C=CCOc1ccc(C(=O)N(CCC)CCN2CCCC2)cc1OC	ZINC000342299487	457222347	/nfs/dbraw/zinc/22/23/47/457222347.db2.gz	ZWEALBDOCWMEIJ-UHFFFAOYSA-N	0	3	346.471	3.208	20	30		EGEDHN
CC(C)(C#N)CCN(CCO)Cc1cccc(Br)c1	ZINC000347121481	457240772	/nfs/dbraw/zinc/24/07/72/457240772.db2.gz	FZBUTALNOBKRGZ-UHFFFAOYSA-N	0	3	325.250	3.183	20	30		EGEDHN
C[C@@H](C(=O)N(C)CCC#N)N1CCC[C@H](c2ccc(F)cc2)CC1	ZINC000351198691	457239040	/nfs/dbraw/zinc/23/90/40/457239040.db2.gz	GRPUCSBTXLONES-HOTGVXAUSA-N	0	3	331.435	3.156	20	30		EGEDHN
C[C@@H](CNC(=O)C(C)(C)Oc1ccc(C#N)cc1)N1CCCC[C@H]1C	ZINC000360073254	457239433	/nfs/dbraw/zinc/23/94/33/457239433.db2.gz	UXDAGOWYTGDPFP-CVEARBPZSA-N	0	3	343.471	3.095	20	30		EGEDHN
N#CCc1ccc(CN2CCC(NC(=O)CC3CCCC3)CC2)cc1	ZINC000331948942	457277909	/nfs/dbraw/zinc/27/79/09/457277909.db2.gz	QSMQLAGBYIVRSD-UHFFFAOYSA-N	0	3	339.483	3.414	20	30		EGEDHN
C[C@@H](CNC(=O)C[C@H](CC#N)c1ccccc1)N1CCCC[C@H]1C	ZINC000354559790	457288641	/nfs/dbraw/zinc/28/86/41/457288641.db2.gz	BSBRLDYBVZJPNT-AOIWGVFYSA-N	0	3	327.472	3.453	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@@H]1CCC[C@@]1(C)CO	ZINC000351516099	457301926	/nfs/dbraw/zinc/30/19/26/457301926.db2.gz	IBCFNEGXSZRPAL-AEFFLSMTSA-N	0	3	334.485	3.044	20	30		EGEDHN
C=CCOCCCC(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000354725858	457316265	/nfs/dbraw/zinc/31/62/65/457316265.db2.gz	ZPPMRHVDIPIEBE-LJQANCHMSA-N	0	3	330.472	3.092	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H](C)[C@H]2OCCc3sccc32)CC1	ZINC000339998582	457319009	/nfs/dbraw/zinc/31/90/09/457319009.db2.gz	GROUECWJAINSGG-RDTXWAMCSA-N	0	3	348.512	3.155	20	30		EGEDHN
C=CCCCCCN(C)CC(=O)N1CCN(Cc2ccccc2)CC1	ZINC000351904872	457323784	/nfs/dbraw/zinc/32/37/84/457323784.db2.gz	QRJYVDHSSVPYCL-UHFFFAOYSA-N	0	3	343.515	3.009	20	30		EGEDHN
C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H]1CCCN(C)[C@H]1C	ZINC000355079956	457340330	/nfs/dbraw/zinc/34/03/30/457340330.db2.gz	JXWWEWPUDDGQFC-WMZOPIPTSA-N	0	3	347.507	3.034	20	30		EGEDHN
N#C[C@H](c1cccc(Cl)c1)N1CCN(C[C@@H]2CCSC2)CC1	ZINC000355291894	457354987	/nfs/dbraw/zinc/35/49/87/457354987.db2.gz	OGFMXMZCNAKGTE-WMLDXEAASA-N	0	3	335.904	3.275	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)NCC1CCSCC1)C(C)C	ZINC000355474686	457380251	/nfs/dbraw/zinc/38/02/51/457380251.db2.gz	NKKYLALCKOOPOQ-KRWDZBQOSA-N	0	3	339.549	3.127	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@@H](C)N(C)CC[C@@H]1CCCO1	ZINC000342596298	457389176	/nfs/dbraw/zinc/38/91/76/457389176.db2.gz	QMPDIUDNHAEIFK-CVEARBPZSA-N	0	3	336.501	3.152	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN2CC[C@@](O)(c3ccc(F)cc3)C2)cc1	ZINC000378520386	457406529	/nfs/dbraw/zinc/40/65/29/457406529.db2.gz	NBDJGBUFLALQGX-QRWLVFNGSA-N	0	3	340.398	3.210	20	30		EGEDHN
Cn1cc([C@@H](NCCCOc2ccc(C#N)cc2)c2ccccc2)cn1	ZINC000369906924	457455288	/nfs/dbraw/zinc/45/52/88/457455288.db2.gz	CIHSJTVSSQWSLH-NRFANRHFSA-N	0	3	346.434	3.440	20	30		EGEDHN
CC(=O)Nc1cccc2c1CCN(CCCC1(C#N)CCOCC1)C2	ZINC000374146286	457496436	/nfs/dbraw/zinc/49/64/36/457496436.db2.gz	DRWADXSTPUPJRK-UHFFFAOYSA-N	0	3	341.455	3.104	20	30		EGEDHN
CCN(CCC#N)C(=O)CN1C[C@H](c2ccccc2)[C@@H]2CCC[C@H]21	ZINC000352727103	457564349	/nfs/dbraw/zinc/56/43/49/457564349.db2.gz	SVUXJQZZXIEHCI-IPMKNSEASA-N	0	3	325.456	3.017	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)[C@@H](C)c2cccc(C#N)c2)CC1	ZINC000425475859	457569909	/nfs/dbraw/zinc/56/99/09/457569909.db2.gz	LBCHKPNSWXHHJD-INIZCTEOSA-N	0	3	340.471	3.301	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N(C)CCCN1C(=O)c2ccccc2C1=O	ZINC000425531786	457587010	/nfs/dbraw/zinc/58/70/10/457587010.db2.gz	HYOHKOARWUJYFS-HNNXBMFYSA-N	0	3	347.418	3.237	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N(C)CCc1nc2ccccc2c(=O)[nH]1	ZINC000425539351	457589275	/nfs/dbraw/zinc/58/92/75/457589275.db2.gz	UBICSSCNYMVJNO-AWEZNQCLSA-N	0	3	332.407	3.443	20	30		EGEDHN
COc1ccc(C#N)cc1CN1CC2(CCC2)[C@H]1C1CCOCC1	ZINC000425559203	457599617	/nfs/dbraw/zinc/59/96/17/457599617.db2.gz	YVKCPGOLCVSEPH-LJQANCHMSA-N	0	3	326.440	3.348	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@@H](C)N1CC[C@H](n2ncc3ccccc32)C1	ZINC000357791498	457691427	/nfs/dbraw/zinc/69/14/27/457691427.db2.gz	AGNUWBZGMGHENI-AEFFLSMTSA-N	0	3	340.471	3.096	20	30		EGEDHN
Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@H]1N2C(=O)c1sccc1C#N	ZINC000365080750	457726721	/nfs/dbraw/zinc/72/67/21/457726721.db2.gz	BOPJRMOXSHRQJW-DOTOQJQBSA-N	0	3	337.448	3.376	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H]2CCc3sc(Cl)cc32)CC1	ZINC000357955368	457733548	/nfs/dbraw/zinc/73/35/48/457733548.db2.gz	IMPBUBZUZIUTRK-CYBMUJFWSA-N	0	3	339.892	3.338	20	30		EGEDHN
C[C@@H]1C[C@@H](c2ccccc2)CN1CC(=O)NCc1cccc(C#N)c1	ZINC000365340454	457745042	/nfs/dbraw/zinc/74/50/42/457745042.db2.gz	VTDBEWDLISGXML-OXQOHEQNSA-N	0	3	333.435	3.052	20	30		EGEDHN
C=C[C@@H]1CCCCN1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000426243182	457794981	/nfs/dbraw/zinc/79/49/81/457794981.db2.gz	ZOTBTZMURWRYSG-BHIYHBOVSA-N	0	3	327.472	3.257	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCCCc1nc2ccccc2[nH]1	ZINC000433300144	457801884	/nfs/dbraw/zinc/80/18/84/457801884.db2.gz	SFCMNIBYTDLOBO-KRWDZBQOSA-N	0	3	346.434	3.384	20	30		EGEDHN
Cc1cc(CN[C@H]2CCN(C(=O)CCc3ccccc3)C2)ccc1C#N	ZINC000443999895	457837917	/nfs/dbraw/zinc/83/79/17/457837917.db2.gz	FIENLMHFRARSIZ-NRFANRHFSA-N	0	3	347.462	3.190	20	30		EGEDHN
CCCN(CC(F)(F)F)C(=O)[C@@H]1CCCN([C@H](C)CCC#N)C1	ZINC000411287816	457850186	/nfs/dbraw/zinc/85/01/86/457850186.db2.gz	BGMTWSGMMKAYEP-ZIAGYGMSSA-N	0	3	333.398	3.192	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)NC[C@H]1CCCCN1C1CC1	ZINC000433944131	457918757	/nfs/dbraw/zinc/91/87/57/457918757.db2.gz	XOVGGMJDZMPESP-MRXNPFEDSA-N	0	3	333.501	3.463	20	30		EGEDHN
C=CCN(C)CCN(CC)[C@H](C)C(=O)N1CCC[C@@H]1c1cccs1	ZINC000411637592	457937227	/nfs/dbraw/zinc/93/72/27/457937227.db2.gz	FZAMLKMGFKZWSU-IAGOWNOFSA-N	0	3	349.544	3.240	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)Nc1ccc(OCCN(C)C)c(C)c1)OCC	ZINC000458190655	457963359	/nfs/dbraw/zinc/96/33/59/457963359.db2.gz	ABBBDTZTHYXMCV-GOSISDBHSA-N	0	3	334.460	3.245	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN1CC[C@@H](N2CCCC2)C1	ZINC000371517025	457970547	/nfs/dbraw/zinc/97/05/47/457970547.db2.gz	INQGAQLODMKGRU-MRXNPFEDSA-N	0	3	345.512	3.073	20	30		EGEDHN
N#Cc1cc(C(=O)N2C[C@H]3CCN(Cc4ccccc4)[C@H]3C2)ccc1F	ZINC000375613139	457989988	/nfs/dbraw/zinc/98/99/88/457989988.db2.gz	QQNCSNDHEZUFCG-XLIONFOSSA-N	0	3	349.409	3.044	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)NCCN1CCCC(C)(C)C1	ZINC000445089840	458013663	/nfs/dbraw/zinc/01/36/63/458013663.db2.gz	IQALHYRVPYFVRG-UHFFFAOYSA-N	0	3	345.487	3.173	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CC(C)(CC(F)(F)F)C2)CC1	ZINC000458327431	458014598	/nfs/dbraw/zinc/01/45/98/458014598.db2.gz	WGKVTAXKXKBLHM-UHFFFAOYSA-N	0	3	333.398	3.011	20	30		EGEDHN
COCC1(CNC(=O)C(C#N)CCc2ccccc2)CCCCC1	ZINC000428080213	458075625	/nfs/dbraw/zinc/07/56/25/458075625.db2.gz	YPKULRLCWDQGOW-GOSISDBHSA-N	0	3	328.456	3.472	20	30		EGEDHN
C[C@H](CNC(=O)C1(c2cccc(C#N)c2)CC1)N(C)Cc1ccccc1	ZINC000435003467	458077774	/nfs/dbraw/zinc/07/77/74/458077774.db2.gz	MPSUGFDKJLSHLU-QGZVFWFLSA-N	0	3	347.462	3.227	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)[C@@H](C)N[C@@H]1C[C@H](OC(C)(C)C)C1(C)C	ZINC000412067469	458078703	/nfs/dbraw/zinc/07/87/03/458078703.db2.gz	HFUOCLLHQUPYCK-BKEDOTJMSA-N	0	3	337.508	3.001	20	30		EGEDHN
C=C(CNC(=O)N(CCN(C)C)Cc1ccc(C)o1)c1ccccc1	ZINC000358566731	458080765	/nfs/dbraw/zinc/08/07/65/458080765.db2.gz	BRKRSJXQKOXUJQ-UHFFFAOYSA-N	0	3	341.455	3.375	20	30		EGEDHN
C=C(CC)CN1CCC(C(=O)c2ccc3c(c2)NC(=O)[C@H](C)O3)CC1	ZINC000358610896	458107207	/nfs/dbraw/zinc/10/72/07/458107207.db2.gz	GWUXASZMJDTFGW-AWEZNQCLSA-N	0	3	342.439	3.267	20	30		EGEDHN
CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)N(C)CC(C)(C)C#N	ZINC000458633150	458117201	/nfs/dbraw/zinc/11/72/01/458117201.db2.gz	BSALLLPDROCUHN-SFHVURJKSA-N	0	3	344.503	3.334	20	30		EGEDHN
CN(CC(C)(C)C#N)C(=O)NC[C@@H](C1CC1)N(C)Cc1ccccc1	ZINC000458682227	458133956	/nfs/dbraw/zinc/13/39/56/458133956.db2.gz	RUSLRDFZXNBBBM-SFHVURJKSA-N	0	3	342.487	3.088	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Cc1c(F)cccc1F)C(C)C	ZINC000446112619	458150471	/nfs/dbraw/zinc/15/04/71/458150471.db2.gz	HVWGSLKHIOCRJB-GOSISDBHSA-N	0	3	336.426	3.322	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CC[C@H](n2cc(Cl)cn2)C1	ZINC000428508204	458159806	/nfs/dbraw/zinc/15/98/06/458159806.db2.gz	UDSSYCBYSKKEOF-WBVHZDCISA-N	0	3	342.830	3.082	20	30		EGEDHN
CC(C)Oc1ccc(NC(=O)N[C@@H](C)CN2CCCCC2)cc1C#N	ZINC000435556218	458160701	/nfs/dbraw/zinc/16/07/01/458160701.db2.gz	BPKSOSDAYOGWME-HNNXBMFYSA-N	0	3	344.459	3.341	20	30		EGEDHN
CN(C)CCN(Cc1ccco1)C(=O)c1cccc(SCC#N)c1	ZINC000446442538	458189623	/nfs/dbraw/zinc/18/96/23/458189623.db2.gz	RJASEIOCVJEUSB-UHFFFAOYSA-N	0	3	343.452	3.099	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCN(CCc3ccccc3Cl)C2)nc1	ZINC000428781543	458210850	/nfs/dbraw/zinc/21/08/50/458210850.db2.gz	GYHAEYVWRJLDQN-MRXNPFEDSA-N	0	3	327.815	3.302	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](C)c2ccncc2CC)CC1	ZINC000358785133	458215391	/nfs/dbraw/zinc/21/53/91/458215391.db2.gz	YXGASUPUCAPKOQ-OAHLLOKOSA-N	0	3	330.476	3.045	20	30		EGEDHN
C=C(C)CCNC(=O)N(CCN(C)C)Cc1ccc(F)cc1F	ZINC000459003841	458241379	/nfs/dbraw/zinc/24/13/79/458241379.db2.gz	PFNGXHIKPNVCDI-UHFFFAOYSA-N	0	3	325.403	3.004	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1S[C@@H](C)CCC#N	ZINC000412991792	458290391	/nfs/dbraw/zinc/29/03/91/458290391.db2.gz	SLZGZNQSFJNFNA-HNNXBMFYSA-N	0	3	333.505	3.277	20	30		EGEDHN
CC(C)[C@]1(C)C[C@H]1NC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000459248371	458300883	/nfs/dbraw/zinc/30/08/83/458300883.db2.gz	MLIJBNFFZDUGHX-QUCCMNQESA-N	0	3	342.487	3.066	20	30		EGEDHN
C[C@H](C(=O)Nc1cc(C#N)ccc1NC1CC1)N1[C@H](C)CC[C@H]1C	ZINC000413766889	458306278	/nfs/dbraw/zinc/30/62/78/458306278.db2.gz	LZIIRWKFWCSWHS-MGPQQGTHSA-N	0	3	326.444	3.332	20	30		EGEDHN
CN(C)CCOc1ccc(NC(=O)C2(C#N)CCCCC2)c(F)c1	ZINC000413906840	458312236	/nfs/dbraw/zinc/31/22/36/458312236.db2.gz	ZPXASVHWEIFTDP-UHFFFAOYSA-N	0	3	333.407	3.179	20	30		EGEDHN
C[C@H]1C[C@H](c2cccnc2)N(CCC(=O)Nc2sccc2C#N)C1	ZINC000376552632	458335273	/nfs/dbraw/zinc/33/52/73/458335273.db2.gz	KYAQCBSVRMQVEY-XJKSGUPXSA-N	0	3	340.452	3.426	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN(C)[C@H]2CC[C@H](C)C2)cc1	ZINC000429584976	458349816	/nfs/dbraw/zinc/34/98/16/458349816.db2.gz	PEADYEBDJQEECM-WMZOPIPTSA-N	0	3	343.471	3.452	20	30		EGEDHN
C=CCN(C)CCN(CC)Cc1nc(-c2ccc(Cl)cc2)no1	ZINC000429709902	458361409	/nfs/dbraw/zinc/36/14/09/458361409.db2.gz	STGVTXMMBSUQNI-UHFFFAOYSA-N	0	3	334.851	3.330	20	30		EGEDHN
Cc1ccc([C@@H](CNC(=O)NCC2(C#N)CCC2)N2CCCC2)cc1	ZINC000419431867	458382934	/nfs/dbraw/zinc/38/29/34/458382934.db2.gz	FJSODHCFFMDMOD-GOSISDBHSA-N	0	3	340.471	3.125	20	30		EGEDHN
C[C@@H]1C[C@]1(C#N)C(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1	ZINC000448768239	458409131	/nfs/dbraw/zinc/40/91/31/458409131.db2.gz	PQFRJJPXUSSANA-YVWKXTFCSA-N	0	3	325.456	3.126	20	30		EGEDHN
COc1ccc(CN2CCC[C@H](CCO)CC2)cc1OCCCC#N	ZINC000421397068	458412510	/nfs/dbraw/zinc/41/25/10/458412510.db2.gz	LCEPNTXQKRECDE-KRWDZBQOSA-N	0	3	346.471	3.362	20	30		EGEDHN
C=CCN1CCC(NC(=O)C2(Cc3cccc(Cl)c3)CC2)CC1	ZINC000448921008	458416115	/nfs/dbraw/zinc/41/61/15/458416115.db2.gz	KJGGZPMXAGMTBL-UHFFFAOYSA-N	0	3	332.875	3.429	20	30		EGEDHN
CC(=O)NCCc1ccc([C@@H](C)NCc2ccc(C#N)s2)cc1	ZINC000421870024	458423150	/nfs/dbraw/zinc/42/31/50/458423150.db2.gz	FHQJLFGTXMXFBU-CYBMUJFWSA-N	0	3	327.453	3.149	20	30		EGEDHN
N#CCCCOc1cccc(CNC[C@H](O)Cc2cccc(F)c2)c1	ZINC000449362363	458423738	/nfs/dbraw/zinc/42/37/38/458423738.db2.gz	LCZDZYRUJCRSOG-LJQANCHMSA-N	0	3	342.414	3.201	20	30		EGEDHN
CO[C@@H]1CCN(Cc2cn(CCC#N)nc2-c2ccccc2)C[C@@H]1C	ZINC000449502500	458425233	/nfs/dbraw/zinc/42/52/33/458425233.db2.gz	ONUPPWSRAMDMKA-QFBILLFUSA-N	0	3	338.455	3.321	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCc1cc(Br)ccc1OC	ZINC000449549518	458426706	/nfs/dbraw/zinc/42/67/06/458426706.db2.gz	YRPOHJHCPYJFQC-KGLIPLIRSA-N	0	3	326.234	3.281	20	30		EGEDHN
C=CCC1(C(=O)NCc2ccc(OCCN(C)C)cc2)CCCC1	ZINC000449810383	458431429	/nfs/dbraw/zinc/43/14/29/458431429.db2.gz	LLQQEIBOTFKEQV-UHFFFAOYSA-N	0	3	330.472	3.380	20	30		EGEDHN
C[C@H]1C[C@]1(C#N)C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000449951976	458436247	/nfs/dbraw/zinc/43/62/47/458436247.db2.gz	JBAIYTNOOFUATG-IXIUHKBRSA-N	0	3	325.456	3.048	20	30		EGEDHN
CN(CCCN(C)c1cccc(C#N)c1[N+](=O)[O-])Cc1ccco1	ZINC000450535755	458450849	/nfs/dbraw/zinc/45/08/49/458450849.db2.gz	PMZNQYOALISIPQ-UHFFFAOYSA-N	0	3	328.372	3.018	20	30		EGEDHN
Cc1cc(Br)cn2c(CNCC(C)(C)CC#N)cnc12	ZINC000459726760	458459307	/nfs/dbraw/zinc/45/93/07/458459307.db2.gz	FNEBAEOEXFYTHU-UHFFFAOYSA-N	0	3	335.249	3.435	20	30		EGEDHN
COc1cc(CN(CCN(C)C)Cc2ccsc2)ccc1C#N	ZINC000459749520	458467498	/nfs/dbraw/zinc/46/74/98/458467498.db2.gz	PMRBUMAQDMPXMR-UHFFFAOYSA-N	0	3	329.469	3.192	20	30		EGEDHN
C[C@@H]1C[C@H](c2ccccc2)[C@@H](C)N1CC(=O)NCc1cccc(C#N)c1	ZINC000451194554	458469158	/nfs/dbraw/zinc/46/91/58/458469158.db2.gz	ZDVOYACNACSATA-LZJOCLMNSA-N	0	3	347.462	3.441	20	30		EGEDHN
CC(C)O[C@H]1C[C@H](NCC(=O)N(CCC#N)c2ccccc2)C1(C)C	ZINC000451492996	458478542	/nfs/dbraw/zinc/47/85/42/458478542.db2.gz	IVKLXYBHOFTOQR-ROUUACIJSA-N	0	3	343.471	3.115	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC(=O)N[C@@H](CC)c1ccc(Cl)cc1	ZINC000451669397	458484279	/nfs/dbraw/zinc/48/42/79/458484279.db2.gz	AQPLRDZMWWHAMS-BBWFWOEESA-N	0	3	336.863	3.231	20	30		EGEDHN
CCCN(C)[C@H](CNC(=O)[C@@]1(C#N)C[C@H]1C)c1ccc(Cl)cc1	ZINC000451655349	458484642	/nfs/dbraw/zinc/48/46/42/458484642.db2.gz	XRULJUOXBFKXPW-MZMPZRCHSA-N	0	3	333.863	3.389	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NCC1(N(C)Cc2ccccc2)CCC1	ZINC000452730082	458508269	/nfs/dbraw/zinc/50/82/69/458508269.db2.gz	LPMSIWIVSUIHFC-QGZVFWFLSA-N	0	3	330.472	3.139	20	30		EGEDHN
CC[C@H](COCC(F)(F)F)NC(=O)C(C#N)CCc1ccccc1	ZINC000452746164	458508568	/nfs/dbraw/zinc/50/85/68/458508568.db2.gz	PAMJOIZOPFBJTL-LSDHHAIUSA-N	0	3	342.361	3.233	20	30		EGEDHN
C=C(CC)CN[C@H](C)c1ccc(S(=O)(=O)NCc2ccco2)cc1	ZINC000453359508	458524335	/nfs/dbraw/zinc/52/43/35/458524335.db2.gz	MJSKZOBYDMLMPN-OAHLLOKOSA-N	0	3	348.468	3.375	20	30		EGEDHN
C=C(C)CCN[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl	ZINC000453307718	458524633	/nfs/dbraw/zinc/52/46/33/458524633.db2.gz	BZSDRWJFRFCWNC-VIFPVBQESA-N	0	3	337.272	3.258	20	30		EGEDHN
CCCN(Cc1c(F)cccc1Cl)C(=O)[C@@H](N)CCCC#N	ZINC000424088833	458555770	/nfs/dbraw/zinc/55/57/70/458555770.db2.gz	JVEWRWQFYZBGMG-HNNXBMFYSA-N	0	3	325.815	3.239	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N[C@@H](c1ccccc1)c1ccc(F)cc1	ZINC000424104531	458558687	/nfs/dbraw/zinc/55/86/87/458558687.db2.gz	UPNRNJNPYNQBBR-ROUUACIJSA-N	0	3	325.387	3.052	20	30		EGEDHN
C[C@@H](NC(=O)[C@@H](N)CCCC#N)C(c1ccccc1)c1ccccc1	ZINC000424101757	458559216	/nfs/dbraw/zinc/55/92/16/458559216.db2.gz	PKSZTEAEDPDNGT-APWZRJJASA-N	0	3	335.451	3.344	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)NC[C@H](Cc1ccccc1)c1ccccc1	ZINC000424127040	458564976	/nfs/dbraw/zinc/56/49/76/458564976.db2.gz	PQRJRGMIHIWAQD-VQTJNVASSA-N	0	3	335.451	3.150	20	30		EGEDHN
CCCN(C(=O)[C@H](N)CCCC#N)[C@H]1C[C@H](OCC)C12CCCCC2	ZINC000424134211	458566521	/nfs/dbraw/zinc/56/65/21/458566521.db2.gz	YBWRLDYFOVYFEP-SQNIBIBYSA-N	0	3	349.519	3.374	20	30		EGEDHN
CCc1cccc(Oc2ccc(NC(=O)[C@H](N)CCCC#N)cn2)c1	ZINC000424132920	458567053	/nfs/dbraw/zinc/56/70/53/458567053.db2.gz	LHCYQAUXLJXMMC-QGZVFWFLSA-N	0	3	338.411	3.396	20	30		EGEDHN
C[C@H](C#N)CSc1ccccc1NC(=O)NC(C)(C)CN(C)C	ZINC000454743851	458573211	/nfs/dbraw/zinc/57/32/11/458573211.db2.gz	DPJRNICDYJZNEG-CYBMUJFWSA-N	0	3	334.489	3.400	20	30		EGEDHN
C[C@@H](C(=O)N1CCCN(C2CCCC2)CC1)c1cccc(C#N)c1	ZINC000462133644	458597566	/nfs/dbraw/zinc/59/75/66/458597566.db2.gz	ZJLARTUMJZOXIC-MRXNPFEDSA-N	0	3	325.456	3.139	20	30		EGEDHN
C=C(C)CN(Cc1ccc(CO)o1)C(=O)Nc1cc(C)cc(CN)c1	ZINC000424429927	458640452	/nfs/dbraw/zinc/64/04/52/458640452.db2.gz	YOJQPQNUTHRACA-UHFFFAOYSA-N	0	3	343.427	3.149	20	30		EGEDHN
CC(C)[C@H](NCC(=O)NCc1ccc(C#N)cc1)c1ccc(F)cc1	ZINC000502503974	458654364	/nfs/dbraw/zinc/65/43/64/458654364.db2.gz	XQYOKPYJDNFDRT-FQEVSTJZSA-N	0	3	339.414	3.300	20	30		EGEDHN
C=CC1CCN(C(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)CC1	ZINC000463006005	458671287	/nfs/dbraw/zinc/67/12/87/458671287.db2.gz	FKFSSRUDNOYWSZ-LPHOPBHVSA-N	0	3	327.472	3.115	20	30		EGEDHN
C[C@H]1CCCC[C@@H]1C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000424593071	458674295	/nfs/dbraw/zinc/67/42/95/458674295.db2.gz	BXIYKPYOEPQZGU-LPHOPBHVSA-N	0	3	327.472	3.275	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Nc1ccc(C#N)cc1)C(C)C	ZINC000503435558	458708689	/nfs/dbraw/zinc/70/86/89/458708689.db2.gz	MUNADELQZOZLBK-GOSISDBHSA-N	0	3	326.444	3.378	20	30		EGEDHN
C[C@H](C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H]1C)c1cccc(C#N)c1	ZINC000464640417	458763573	/nfs/dbraw/zinc/76/35/73/458763573.db2.gz	SIBOXZDDBFECJU-XGHQBKJUSA-N	0	3	347.462	3.441	20	30		EGEDHN
C[C@](C#N)(NC(=O)CN1CCC[C@](C)(c2ccccc2)CC1)C1CC1	ZINC000510123221	458774152	/nfs/dbraw/zinc/77/41/52/458774152.db2.gz	HRYMETNRSXRXFH-LEWJYISDSA-N	0	3	339.483	3.239	20	30		EGEDHN
C=CCN(Cc1cccc(C#N)c1)C(=O)NC[C@@H]1CCCN1CCC	ZINC000511904608	458780751	/nfs/dbraw/zinc/78/07/51/458780751.db2.gz	GKEQJLFMYVHVCF-IBGZPJMESA-N	0	3	340.471	3.130	20	30		EGEDHN
CC(C)(C)OC(=O)NC1CCN(Cc2ccc(CC#N)cc2)CC1	ZINC000495014127	458783797	/nfs/dbraw/zinc/78/37/97/458783797.db2.gz	ZNGNURPHUDXNOJ-UHFFFAOYSA-N	0	3	329.444	3.242	20	30		EGEDHN
C[C@@H]1[C@@H](Nc2ccc(Cl)c(C#N)n2)CCN1Cc1ccccc1	ZINC000516506424	458818616	/nfs/dbraw/zinc/81/86/16/458818616.db2.gz	CWYGCGWOZQBRLW-CJNGLKHVSA-N	0	3	326.831	3.103	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)[C@H](C)SCCN(C)Cc1ccccc1	ZINC000433018640	458826436	/nfs/dbraw/zinc/82/64/36/458826436.db2.gz	IIZIEZUUEDBMEZ-LPHOPBHVSA-N	0	3	347.528	3.295	20	30		EGEDHN
C=CCC(C)(C)CNC(=O)Nc1cc(C)nn1C1CCN(C)CC1	ZINC000433015205	458826560	/nfs/dbraw/zinc/82/65/60/458826560.db2.gz	IZHWLPFSXQIJBN-UHFFFAOYSA-N	0	3	333.480	3.182	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(C#Cc3ccccc3)cc2)CC1	ZINC000517304935	458827548	/nfs/dbraw/zinc/82/75/48/458827548.db2.gz	RXUWIXZPVVSOIN-UHFFFAOYSA-N	0	3	344.458	3.467	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccnc(Oc3ccccc3)c2)CC1	ZINC000517320455	458828735	/nfs/dbraw/zinc/82/87/35/458828735.db2.gz	ALGDRNHYJKTDMS-UHFFFAOYSA-N	0	3	337.423	3.254	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCC(C)(C)c2ccccc2F)CC1	ZINC000517999073	458835333	/nfs/dbraw/zinc/83/53/33/458835333.db2.gz	ZSPQRYJKZCBQLG-UHFFFAOYSA-N	0	3	347.478	3.443	20	30		EGEDHN
N#CCC[C@@H](C#N)CNC1CCN(c2nc3ccccc3s2)CC1	ZINC000554552407	458899629	/nfs/dbraw/zinc/89/96/29/458899629.db2.gz	XBKAIDSSUBENHM-AWEZNQCLSA-N	0	3	339.468	3.298	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@H]1CCCC[C@@H]1NCc1ccc(C#N)cn1	ZINC000495707016	458924873	/nfs/dbraw/zinc/92/48/73/458924873.db2.gz	FNOPYKIQKUHLCE-WBVHZDCISA-N	0	3	344.459	3.126	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN(C[C@H]1CCCO1)C1CCC(C)CC1	ZINC000441478921	458951964	/nfs/dbraw/zinc/95/19/64/458951964.db2.gz	UUJCOHZNUISZPD-CTWPCTMYSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)[C@H]1OCCc2ccccc21)C(C)C	ZINC000441492528	458954834	/nfs/dbraw/zinc/95/48/34/458954834.db2.gz	VQIUJWGSPBMUSL-PMACEKPBSA-N	0	3	342.483	3.115	20	30		EGEDHN
C=CC(C)(C)CNC(=O)NC[C@@H](c1cccc(OC)c1)N1CCCC1	ZINC000457483857	458973737	/nfs/dbraw/zinc/97/37/37/458973737.db2.gz	MKBUWQUYZYQCOB-SFHVURJKSA-N	0	3	345.487	3.344	20	30		EGEDHN
C[C@@H]1C[C@H](Nc2c(C#N)cnc3c(F)cc(F)cc32)CN1C1CC1	ZINC000566770345	458996240	/nfs/dbraw/zinc/99/62/40/458996240.db2.gz	RWBITBBDVSQQQZ-MFKMUULPSA-N	0	3	328.366	3.422	20	30		EGEDHN
C[C@@H](N[C@@H](CN1CCN(C)CC1)c1ccccc1)c1ccc(C#N)cc1	ZINC000532022415	459019075	/nfs/dbraw/zinc/01/90/75/459019075.db2.gz	MGQSVUYAVAWZAD-GCJKJVERSA-N	0	3	348.494	3.198	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](NCc3ccc(C4CC4)cc3)C2=O)cc1	ZINC000566900785	459019416	/nfs/dbraw/zinc/01/94/16/459019416.db2.gz	ATJIBCOLZFJZIT-OAQYLSRUSA-N	0	3	345.446	3.326	20	30		EGEDHN
C[C@H](NC(=O)N1CCCN(C(C)(C)C)CC1)c1ccc(C#N)cc1	ZINC000519922018	459022845	/nfs/dbraw/zinc/02/28/45/459022845.db2.gz	WRZKQODSBRELNJ-HNNXBMFYSA-N	0	3	328.460	3.135	20	30		EGEDHN
Cc1cc(NC(=O)C2(C#N)CC(C)C2)ccc1OCCN1CCCC1	ZINC000532081584	459027452	/nfs/dbraw/zinc/02/74/52/459027452.db2.gz	HGKIGSXQPIAYSC-UHFFFAOYSA-N	0	3	341.455	3.348	20	30		EGEDHN
C=CCNC(=O)CN[C@@H]1CC[C@H](c2ccc(C(F)(F)F)cc2)C1	ZINC000442829273	459043707	/nfs/dbraw/zinc/04/37/07/459043707.db2.gz	UMPFCNHOOQROOO-DZGCQCFKSA-N	0	3	326.362	3.233	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC([C@@H]2C[C@H]2NC[C@H](C#N)CCC#N)CC1	ZINC000496248638	459122393	/nfs/dbraw/zinc/12/23/93/459122393.db2.gz	XBWFSMUMFVHGPT-BHYGNILZSA-N	0	3	346.475	3.055	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN(CC2CC2)C(C)C)cc1	ZINC000532667624	459126759	/nfs/dbraw/zinc/12/67/59/459126759.db2.gz	XXXXUUCOVDQJIO-UHFFFAOYSA-N	0	3	343.471	3.452	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1CN[C@@H](C)c1cnccc1NC(=O)OC(C)(C)C	ZINC000496282592	459135981	/nfs/dbraw/zinc/13/59/81/459135981.db2.gz	JGLDYGLJPGKJMA-ZQIUZPCESA-N	0	3	347.459	3.092	20	30		EGEDHN
COc1ccc(N2C[C@H](N[C@H](C)c3cccc(C#N)c3)CC2=O)cc1	ZINC000594723193	459140521	/nfs/dbraw/zinc/14/05/21/459140521.db2.gz	YSQAJPPXVCRWGH-RHSMWYFYSA-N	0	3	335.407	3.023	20	30		EGEDHN
N#Cc1ccc(NC(=O)CN2CCC[C@H]2[C@@H]2CCCOC2)cc1Cl	ZINC000567790347	459168523	/nfs/dbraw/zinc/16/85/23/459168523.db2.gz	XWZHLFRMMWXRPD-PBHICJAKSA-N	0	3	347.846	3.041	20	30		EGEDHN
CC[C@@H](C)N1CCN(c2c(C#N)cnc3c(F)ccc(F)c32)CC1	ZINC000590725991	459194531	/nfs/dbraw/zinc/19/45/31/459194531.db2.gz	FKEAURJKMYYWQZ-GFCCVEGCSA-N	0	3	330.382	3.305	20	30		EGEDHN
CO[C@](C)(CNCc1ccc(C#N)cc1F)COCc1ccccc1	ZINC000594975773	459202132	/nfs/dbraw/zinc/20/21/32/459202132.db2.gz	TYEKESPDICZTTL-HXUWFJFHSA-N	0	3	342.414	3.409	20	30		EGEDHN
CS(=O)(=O)C1(CN[C@H]2CCCc3cc(C#N)ccc32)CCCCC1	ZINC000595077058	459238290	/nfs/dbraw/zinc/23/82/90/459238290.db2.gz	LFESNWKESJYADM-SFHVURJKSA-N	0	3	346.496	3.273	20	30		EGEDHN
C[C@H](NC(=O)[C@@]1(C#N)CC12CCCC2)[C@@H](c1ccccc1)N(C)C	ZINC000579076087	459242291	/nfs/dbraw/zinc/24/22/91/459242291.db2.gz	UGDVUWKSHZICPL-KNBMTAEXSA-N	0	3	325.456	3.268	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@H](N[C@H]1CCc2ccc(C#N)cc21)C1CC1	ZINC000496604206	459256894	/nfs/dbraw/zinc/25/68/94/459256894.db2.gz	LSTNFFCTARYKGF-ROUUACIJSA-N	0	3	341.455	3.438	20	30		EGEDHN
CC#CCN(C)C[C@H](O)CO[C@H](c1ccccc1)c1ccc(C)cc1	ZINC000559458938	459261864	/nfs/dbraw/zinc/26/18/64/459261864.db2.gz	QFROLZYMNUFDGO-FCHUYYIVSA-N	0	3	337.463	3.417	20	30		EGEDHN
CN(CC[C@@H]1Sc2ccccc2NC1=O)Cc1cccc(C#N)c1	ZINC000595286223	459266302	/nfs/dbraw/zinc/26/63/02/459266302.db2.gz	ABUBBGCGDBBVEC-SFHVURJKSA-N	0	3	337.448	3.493	20	30		EGEDHN
CCCCCNC(=O)C1CCN(CCc2ccc(C#N)cc2)CC1	ZINC000595297136	459271022	/nfs/dbraw/zinc/27/10/22/459271022.db2.gz	KAYXASHRYJKMFX-UHFFFAOYSA-N	0	3	327.472	3.119	20	30		EGEDHN
Cc1ccccc1[C@H]1C[C@H](C)N(CC(=O)NCc2ccc(C#N)cc2)C1	ZINC000523441469	459304200	/nfs/dbraw/zinc/30/42/00/459304200.db2.gz	UWYBSIGVOVZMQV-PXNSSMCTSA-N	0	3	347.462	3.361	20	30		EGEDHN
C[C@@H](C(=O)NC1(C#N)CCC1)N1CCC[C@](C)(c2ccccc2)CC1	ZINC000560470430	459353205	/nfs/dbraw/zinc/35/32/05/459353205.db2.gz	WDDCQMMVFHKFTL-PXNSSMCTSA-N	0	3	339.483	3.381	20	30		EGEDHN
CCCOc1ccc(C(C)(C)NCC(=O)N(CC)C[C@@H](C)C#N)cc1	ZINC000483270101	459355335	/nfs/dbraw/zinc/35/53/35/459355335.db2.gz	JSUMNJZMAQTXKE-INIZCTEOSA-N	0	3	345.487	3.308	20	30		EGEDHN
C=CC[C@@H](CC)NC(=O)NC[C@@H](c1cccc(OC)c1)N1CCCC1	ZINC000537401416	459364929	/nfs/dbraw/zinc/36/49/29/459364929.db2.gz	SDJQKFAUWFABKD-MJGOQNOKSA-N	0	3	345.487	3.486	20	30		EGEDHN
C/C=C/c1ccc(OC[C@H](O)CN2CCC[C@@H](CC#N)C2)c(OC)c1	ZINC000595609774	459365233	/nfs/dbraw/zinc/36/52/33/459365233.db2.gz	OWSFFRGPPHXKEP-YBXYLWMYSA-N	0	3	344.455	3.094	20	30		EGEDHN
C/C=C/c1ccc(OC[C@H](O)CN2CCC[C@H](CC#N)C2)c(OC)c1	ZINC000595609771	459365308	/nfs/dbraw/zinc/36/53/08/459365308.db2.gz	OWSFFRGPPHXKEP-FLSJAXMZSA-N	0	3	344.455	3.094	20	30		EGEDHN
COc1ccc(Cl)cc1NC(=O)CCN1CCC[C@@H](CC#N)C1	ZINC000595612340	459367007	/nfs/dbraw/zinc/36/70/07/459367007.db2.gz	UMXHOXOLSFREAS-ZDUSSCGKSA-N	0	3	335.835	3.303	20	30		EGEDHN
Cc1ccccc1[C@H](N[C@@H](C)C(=O)N[C@](C)(C#N)C(C)C)C1CC1	ZINC000540589821	459382608	/nfs/dbraw/zinc/38/26/08/459382608.db2.gz	AMBWBWWCLQOKCC-QKYXUNIQSA-N	0	3	327.472	3.479	20	30		EGEDHN
C=CCN(CC(=O)NCc1cccc(C#N)c1)CC1CCCCC1	ZINC000484511806	459416750	/nfs/dbraw/zinc/41/67/50/459416750.db2.gz	CZCUWRWDHMTCSB-UHFFFAOYSA-N	0	3	325.456	3.243	20	30		EGEDHN
CC(C)C1CCC(NCCS(=O)(=O)c2ccc(C#N)cc2)CC1	ZINC000569232467	459419104	/nfs/dbraw/zinc/41/91/04/459419104.db2.gz	ZSRKQNOCAWOKQM-UHFFFAOYSA-N	0	3	334.485	3.136	20	30		EGEDHN
C[C@H]1CC2(CN1CC1(C#N)CC1)CCN(C(=O)OC(C)(C)C)CC2	ZINC000497066662	459424912	/nfs/dbraw/zinc/42/49/12/459424912.db2.gz	UDHCVAXNXLZQSU-HNNXBMFYSA-N	0	3	333.476	3.402	20	30		EGEDHN
CN1CCC(NN=Cc2ccc(NC(=O)OC(C)(C)C)cc2)CC1	ZINC000497239940	459497964	/nfs/dbraw/zinc/49/79/64/459497964.db2.gz	LZBNGEQJBJBYDU-UHFFFAOYSA-N	0	3	332.448	3.051	20	30		EGEDHN
CC1CCN([C@H](CNc2c(C#N)cnn2C)c2cccs2)CC1	ZINC000596053681	459502372	/nfs/dbraw/zinc/50/23/72/459502372.db2.gz	GKAAGNWMRIFHOJ-OAHLLOKOSA-N	0	3	329.473	3.238	20	30		EGEDHN
CC1CCN([C@@H](CNc2c(C#N)cnn2C)c2cccs2)CC1	ZINC000596053676	459502749	/nfs/dbraw/zinc/50/27/49/459502749.db2.gz	GKAAGNWMRIFHOJ-HNNXBMFYSA-N	0	3	329.473	3.238	20	30		EGEDHN
CC[C@H](C)N[C@@H](CNC(=O)N1CCC(CCC#N)CC1)c1ccco1	ZINC000592022784	459512762	/nfs/dbraw/zinc/51/27/62/459512762.db2.gz	FWZPCNDYJGEMPO-RDJZCZTQSA-N	0	3	346.475	3.434	20	30		EGEDHN
C[C@H]1CN(C)CC[C@@H]1N(C)c1cc(Br)c(C#N)cc1F	ZINC000569824659	459517152	/nfs/dbraw/zinc/51/71/52/459517152.db2.gz	IXKSHXGSOLGVET-HZMBPMFUSA-N	0	3	340.240	3.236	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@H](C)N(C)CCCc1ccc(OC)cc1	ZINC000497477128	459539527	/nfs/dbraw/zinc/53/95/27/459539527.db2.gz	UNUSSPBEXWRPCZ-KRWDZBQOSA-N	0	3	332.488	3.373	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@@H](CC)N1CCc2ccccc2C1	ZINC000488386239	459543235	/nfs/dbraw/zinc/54/32/35/459543235.db2.gz	LKLWWNGFURRPEV-LJQANCHMSA-N	0	3	337.467	3.241	20	30		EGEDHN
C[C@@H]1CCCC[C@@H]1OCCN1CC[C@H](Oc2ccc(C#N)cn2)C1	ZINC000562363293	459546376	/nfs/dbraw/zinc/54/63/76/459546376.db2.gz	QRTXZRKJCDYELM-NJAFHUGGSA-N	0	3	329.444	3.002	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1	ZINC000488737836	459550601	/nfs/dbraw/zinc/55/06/01/459550601.db2.gz	SQYVTSGYTSOOSW-SFHVURJKSA-N	0	3	337.467	3.411	20	30		EGEDHN
CCCN(C)[C@@H](CNC(=O)NC[C@@H](C)C#N)c1ccc(Cl)cc1	ZINC000570069918	459551830	/nfs/dbraw/zinc/55/18/30/459551830.db2.gz	SWOUFLBDUBTRNK-BBRMVZONSA-N	0	3	336.867	3.182	20	30		EGEDHN
CN(C)[C@H](CNc1c(C#N)cnn1C)c1cccc(C(F)(F)F)c1	ZINC000596196326	459557926	/nfs/dbraw/zinc/55/79/26/459557926.db2.gz	SCWXIIOEZQPAFG-CQSZACIVSA-N	0	3	337.349	3.025	20	30		EGEDHN
C=CCCCS(=O)(=O)NCC1(N2CCCCC2)CCCCC1	ZINC000489044978	459559661	/nfs/dbraw/zinc/55/96/61/459559661.db2.gz	RSKIQLNHRWILSS-UHFFFAOYSA-N	0	3	328.522	3.061	20	30		EGEDHN
C=CCn1cccc1C(=O)N(CCN(C)C)Cc1ccc(F)cc1	ZINC000489051086	459559949	/nfs/dbraw/zinc/55/99/49/459559949.db2.gz	SOJIKRMZPRKPRC-UHFFFAOYSA-N	0	3	329.419	3.017	20	30		EGEDHN
C=CCOc1ccc(CNC[C@H](O)COc2ccccc2C)cc1	ZINC000570795365	459560626	/nfs/dbraw/zinc/56/06/26/459560626.db2.gz	YDVLKRROLKRKMU-SFHVURJKSA-N	0	3	327.424	3.089	20	30		EGEDHN
C=C[C@H]1CCCCN1C[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000489506457	459567068	/nfs/dbraw/zinc/56/70/68/459567068.db2.gz	HCZKHDZNCBAVQJ-UONOGXRCSA-N	0	3	329.362	3.486	20	30		EGEDHN
COC(=O)c1cccc(CN[C@H](Cc2ccccc2)C2CC2)c1C#N	ZINC000542549665	459570707	/nfs/dbraw/zinc/57/07/07/459570707.db2.gz	CINSKFRQXJXJKM-HXUWFJFHSA-N	0	3	334.419	3.456	20	30		EGEDHN
COCCOc1ccccc1N1CCN(CCCC(C)(C)C#N)CC1	ZINC000489963417	459573942	/nfs/dbraw/zinc/57/39/42/459573942.db2.gz	ZTNZNZVRDZQBDB-UHFFFAOYSA-N	0	3	345.487	3.164	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(NC(=O)OCC)cc2)CC1	ZINC000491244246	459608882	/nfs/dbraw/zinc/60/88/82/459608882.db2.gz	BBODXXTZWKMTSQ-UHFFFAOYSA-N	0	3	345.443	3.025	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)[C@]2(C#N)CC23CCCC3)C1	ZINC000562639550	459609317	/nfs/dbraw/zinc/60/93/17/459609317.db2.gz	AOCCSPUGZBWCBH-HGHGUNKESA-N	0	3	337.467	3.412	20	30		EGEDHN
COc1ccccc1-c1ncc(CNCCc2cccc(C#N)c2)cn1	ZINC000491377178	459621424	/nfs/dbraw/zinc/62/14/24/459621424.db2.gz	VGLAXBLBDWPSNI-UHFFFAOYSA-N	0	3	344.418	3.356	20	30		EGEDHN
C#C[C@@H](NC(=O)NCc1ccc(CN(C)C)cc1)c1ccc(F)cc1	ZINC000491642365	459645777	/nfs/dbraw/zinc/64/57/77/459645777.db2.gz	WWPXFFFSYBSUGU-LJQANCHMSA-N	0	3	339.414	3.061	20	30		EGEDHN
C=C[C@@H]1CCCCN1C(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H]1C	ZINC000573353858	459664308	/nfs/dbraw/zinc/66/43/08/459664308.db2.gz	FWXQWGIYPAUTKV-QRQLOZEOSA-N	0	3	327.472	3.400	20	30		EGEDHN
C#CCCN1CCC(NC(=O)/C=C/c2ccc([C@@H]3C[C@H]3C)o2)CC1	ZINC000491924561	459685231	/nfs/dbraw/zinc/68/52/31/459685231.db2.gz	JSFKOJPEXFQNPK-VYMYXMEBSA-N	0	3	326.440	3.020	20	30		EGEDHN
N#Cc1cccnc1OC1CCC(NCc2ccncc2Cl)CC1	ZINC000527696495	459704072	/nfs/dbraw/zinc/70/40/72/459704072.db2.gz	KTPFWTFCWQMUDA-UHFFFAOYSA-N	0	3	342.830	3.481	20	30		EGEDHN
N#Cc1cnn2cc(CNCC3(Sc4ccccc4)CC3)cnc12	ZINC000563154264	459725322	/nfs/dbraw/zinc/72/53/22/459725322.db2.gz	LMJLGZOLNUTMOE-UHFFFAOYSA-N	0	3	335.436	3.015	20	30		EGEDHN
N#Cc1cc(F)ccc1NC(=O)C(C[C@H]1CCCO1)C(F)(F)F	ZINC000593083879	459767869	/nfs/dbraw/zinc/76/78/69/459767869.db2.gz	CQZWBLFVQQTFBV-VXGBXAGGSA-N	0	3	330.281	3.383	20	30		EGEDHN
C[C@@H](NC[C@@H](O)CN(C)CCC#N)c1ccc(Cl)c2ccccc21	ZINC000565300115	459783216	/nfs/dbraw/zinc/78/32/16/459783216.db2.gz	TWWOJXHJLZPDBP-HUUCEWRRSA-N	0	3	345.874	3.350	20	30		EGEDHN
N#C[C@@H]1CC[C@H](NCc2cccc(NC(=O)NCc3ccncc3)c2)C1	ZINC000565636964	459786253	/nfs/dbraw/zinc/78/62/53/459786253.db2.gz	DBKIMMIXWFWZCJ-AEFFLSMTSA-N	0	3	349.438	3.185	20	30		EGEDHN
N#CC1(C[C@H](O)CN2CCC[C@H]2c2nc3ccc(Cl)cc3[nH]2)CC1	ZINC000528500490	459808630	/nfs/dbraw/zinc/80/86/30/459808630.db2.gz	BSAFCUKURJPTJQ-BBRMVZONSA-N	0	3	344.846	3.408	20	30		EGEDHN
C[C@H]1O[C@@H](C)[C@@H](C)[C@H]1C(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1	ZINC000528917777	459817924	/nfs/dbraw/zinc/81/79/24/459817924.db2.gz	HPXVTKWXRKHJLB-KAEXTRBYSA-N	0	3	334.803	3.047	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCN(Cc3cc4ccncc4s3)C2)nc1	ZINC000597129486	459845392	/nfs/dbraw/zinc/84/53/92/459845392.db2.gz	KKCHEVRKTFZOPM-HNNXBMFYSA-N	0	3	336.420	3.216	20	30		EGEDHN
C[C@@H](NCC(=O)NCc1cccc(C#N)c1)c1ccc2c(c1)CCCC2	ZINC000546212131	459903761	/nfs/dbraw/zinc/90/37/61/459903761.db2.gz	ZDTKJXQKZSXIBS-MRXNPFEDSA-N	0	3	347.462	3.404	20	30		EGEDHN
CN(C)Cc1cccc(NC(=O)[C@H]2CCCN2c2ccc(C#N)cc2)c1	ZINC000609096573	459904645	/nfs/dbraw/zinc/90/46/45/459904645.db2.gz	KFTNXHYXHBFLMT-HXUWFJFHSA-N	0	3	348.450	3.227	20	30		EGEDHN
CCC(C#N)C(=O)N1CCc2ccccc2[C@@H]1C(=O)OC(C)(C)C	ZINC000598568165	459941208	/nfs/dbraw/zinc/94/12/08/459941208.db2.gz	IIVGHZFRQYMOAQ-XJKSGUPXSA-N	0	3	328.412	3.004	20	30		EGEDHN
COc1ccc(OC)c([C@@H]2CCCN2C[C@@H](O)CC(C)(C)C#N)c1	ZINC000598587183	459953485	/nfs/dbraw/zinc/95/34/85/459953485.db2.gz	OMGGLCVDWYYOQQ-YOEHRIQHSA-N	0	3	332.444	3.141	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CNC1(c2ccc(Br)cc2)CC1	ZINC000598602451	459960441	/nfs/dbraw/zinc/96/04/41/459960441.db2.gz	OHKIADCPMTXNJS-AWEZNQCLSA-N	0	3	337.261	3.329	20	30		EGEDHN
C[C@@H](NC1CCN(Cc2cccc(C#N)c2)CC1)c1nccs1	ZINC000593720634	459962829	/nfs/dbraw/zinc/96/28/29/459962829.db2.gz	IUMZVCGRGYDEHN-CQSZACIVSA-N	0	3	326.469	3.330	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN[C@H](CCO)c1cccc(C(F)(F)F)c1	ZINC000598618835	459964886	/nfs/dbraw/zinc/96/48/86/459964886.db2.gz	RMIQAMMTTBILFT-HUUCEWRRSA-N	0	3	344.377	3.019	20	30		EGEDHN
CCN(CC)[C@@H](CNCc1cccc(C#N)n1)c1cccc(OC)c1	ZINC000602502502	459970322	/nfs/dbraw/zinc/97/03/22/459970322.db2.gz	LIEVSRNMXBWLBH-FQEVSTJZSA-N	0	3	338.455	3.135	20	30		EGEDHN
CCn1cc(CN(C(=O)C(C#N)CCc2ccccc2)C(C)C)cn1	ZINC000593836113	460000561	/nfs/dbraw/zinc/00/05/61/460000561.db2.gz	RPZKFQHGGYJQSW-LJQANCHMSA-N	0	3	338.455	3.413	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN1CC(Cc2cccc(C(F)(F)F)c2)C1	ZINC000598706323	460001469	/nfs/dbraw/zinc/00/14/69/460001469.db2.gz	QLTQJDAUKLUYJM-INIZCTEOSA-N	0	3	340.389	3.480	20	30		EGEDHN
CC(C)(C(=O)N1CCc2c(CC#N)cccc2C1)[C@H](N)c1ccccc1	ZINC000602574111	460005172	/nfs/dbraw/zinc/00/51/72/460005172.db2.gz	RLBJGPXSFZXYKU-HXUWFJFHSA-N	0	3	347.462	3.364	20	30		EGEDHN
COc1ccccc1[C@H](CNC[C@@H](O)CC(C)(C)C#N)OC(C)C	ZINC000598723454	460005955	/nfs/dbraw/zinc/00/59/55/460005955.db2.gz	HZJJFWARKJSBBG-YJBOKZPZSA-N	0	3	334.460	3.052	20	30		EGEDHN
C[C@H](CC1(C#N)CCOCC1)NCc1ccnc(N2CCCCC2)c1	ZINC000602585352	460010348	/nfs/dbraw/zinc/01/03/48/460010348.db2.gz	FXLFAKYHACSKIO-QGZVFWFLSA-N	0	3	342.487	3.260	20	30		EGEDHN
CCCOc1ccc(O[C@@H]2CCCC[C@@H]2NC(=O)C(C)C#N)cc1	ZINC000609921552	460039964	/nfs/dbraw/zinc/03/99/64/460039964.db2.gz	LSZQQHLFHITAHX-JCGIZDLHSA-N	0	3	330.428	3.441	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)N1CCN(C(C)(C)CC)CC1	ZINC000594071583	460087318	/nfs/dbraw/zinc/08/73/18/460087318.db2.gz	QXENGJJBNYRGCS-UHFFFAOYSA-N	0	3	344.459	3.295	20	30		EGEDHN
Cn1ccnc1[C@H]1N(C(=O)C(C#N)CCc2ccccc2)CC1(C)C	ZINC000576198110	460088448	/nfs/dbraw/zinc/08/84/48/460088448.db2.gz	UCMDURZDKLARBF-IAGOWNOFSA-N	0	3	336.439	3.102	20	30		EGEDHN
CC[C@@]1(O)CCCN(Cc2cn(CCC#N)nc2-c2ccccc2)C1	ZINC000602738609	460099721	/nfs/dbraw/zinc/09/97/21/460099721.db2.gz	GFNYSZLLWPIBSJ-HXUWFJFHSA-N	0	3	338.455	3.201	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@H](C)[C@@H](CO)SC)cc1OC	ZINC000598963221	460105495	/nfs/dbraw/zinc/10/54/95/460105495.db2.gz	AWEYSGVFPOBVBU-IAQYHMDHSA-N	0	3	345.892	3.115	20	30		EGEDHN
Cc1cc(CNCCc2ccc(C#N)cc2)ncc1Br	ZINC000598981797	460115906	/nfs/dbraw/zinc/11/59/06/460115906.db2.gz	QGNIJWOKVBJNCQ-UHFFFAOYSA-N	0	3	330.229	3.357	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2N[C@H]1CC(=O)N(c2ccccc2F)C1	ZINC000589729657	460134036	/nfs/dbraw/zinc/13/40/36/460134036.db2.gz	LUXNAYRIUZUILF-LPHOPBHVSA-N	0	3	349.409	3.470	20	30		EGEDHN
CCN1CCC[C@@H]1CNC(=O)N(Cc1ccc(C#N)cc1)CC(C)C	ZINC000610405504	460144911	/nfs/dbraw/zinc/14/49/11/460144911.db2.gz	PJGWITFFDFOTHO-LJQANCHMSA-N	0	3	342.487	3.210	20	30		EGEDHN
C[S@@](=O)c1ccc(CNCc2cccc(OCCCC#N)c2)cc1	ZINC000610575029	460186067	/nfs/dbraw/zinc/18/60/67/460186067.db2.gz	ZAMKPLOFXLAZFO-XMMPIXPASA-N	0	3	342.464	3.396	20	30		EGEDHN
C[C@@H](CCC#N)CN(C)Cc1cc2c(cc1OC(F)F)OCO2	ZINC000618888420	460208636	/nfs/dbraw/zinc/20/86/36/460208636.db2.gz	SKBQFQHROQQOIL-NSHDSACASA-N	0	3	326.343	3.388	20	30		EGEDHN
CCN(C[C@H](O)COc1ccccc1C#N)[C@@H](C)c1ccc(C#N)cc1	ZINC000599270435	460211147	/nfs/dbraw/zinc/21/11/47/460211147.db2.gz	JPBLBXLWFGLXHE-JXFKEZNVSA-N	0	3	349.434	3.253	20	30		EGEDHN
CCO[C@@H]1C[C@H](NCC(=O)NC2(C#N)CCCCC2)C12CCCCC2	ZINC000618902415	460215700	/nfs/dbraw/zinc/21/57/00/460215700.db2.gz	AGWOIYUPPZASBR-DLBZAZTESA-N	0	3	347.503	3.047	20	30		EGEDHN
CN(Cc1cc(Cl)cc(Cl)c1)C(=O)[C@@H](N)CCCCC#N	ZINC000594428661	460216021	/nfs/dbraw/zinc/21/60/21/460216021.db2.gz	NWJWMGUMJVZKHK-AWEZNQCLSA-N	0	3	328.243	3.363	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CN1CCSC2(CCCCC2)C1	ZINC000599306837	460223126	/nfs/dbraw/zinc/22/31/26/460223126.db2.gz	LTACXVIAOPGSQU-QGZVFWFLSA-N	0	3	346.496	3.050	20	30		EGEDHN
CC[C@@H](CN1CCCC1)NC(=O)N(Cc1ccc(C#N)cc1)C1CC1	ZINC000610722120	460225846	/nfs/dbraw/zinc/22/58/46/460225846.db2.gz	JOCUZHQHOBDBEK-SFHVURJKSA-N	0	3	340.471	3.107	20	30		EGEDHN
CC[C@@H](CN1CCCC1)NC(=O)Nc1ccc(OC(C)C)c(C#N)c1	ZINC000610936280	460263188	/nfs/dbraw/zinc/26/31/88/460263188.db2.gz	NPVFHHHNWNSCNC-INIZCTEOSA-N	0	3	344.459	3.341	20	30		EGEDHN
N#Cc1ccc(Cn2cc(CNC3CCCCC3)nn2)c(Cl)c1	ZINC000603225901	460268968	/nfs/dbraw/zinc/26/89/68/460268968.db2.gz	BGULFLGJSMBODI-UHFFFAOYSA-N	0	3	329.835	3.274	20	30		EGEDHN
C=CCC1(NCC(=O)Nc2ccsc2C(=O)OC)CCCCC1	ZINC000599614375	460288136	/nfs/dbraw/zinc/28/81/36/460288136.db2.gz	RDVZHBDLIOKFCX-UHFFFAOYSA-N	0	3	336.457	3.342	20	30		EGEDHN
CN(Cc1ccccc1)C[C@@H](O)COc1cc(Cl)ccc1C#N	ZINC000611113057	460290628	/nfs/dbraw/zinc/29/06/28/460290628.db2.gz	FNNQYKMYZCYINU-QGZVFWFLSA-N	0	3	330.815	3.083	20	30		EGEDHN
COc1cc(C#N)ccc1CN1C[C@H]2CN(c3ccccc3)C[C@@H]2C1	ZINC000611235480	460313335	/nfs/dbraw/zinc/31/33/35/460313335.db2.gz	GXQDBZFKCFTFFN-OALUTQOASA-N	0	3	333.435	3.135	20	30		EGEDHN
COc1ccc(C)cc1CN1CCN(CC(C)(C)CCC#N)CC1	ZINC000611252953	460317224	/nfs/dbraw/zinc/31/72/24/460317224.db2.gz	SOBVNYMQSHTOBN-UHFFFAOYSA-N	0	3	329.488	3.451	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NC[C@H]2CCc3ccccc3C2)cc1	ZINC000619291790	460322569	/nfs/dbraw/zinc/32/25/69/460322569.db2.gz	PHZUUPFZDBIJBT-GHTZIAJQSA-N	0	3	343.430	3.162	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2NCCC(=O)NCc1ccccc1	ZINC000611392368	460353901	/nfs/dbraw/zinc/35/39/01/460353901.db2.gz	NUMHOJIOETWEPE-FQEVSTJZSA-N	0	3	333.435	3.232	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CC[C@H](C(=O)N(C)c2ccccc2)C1	ZINC000619532260	460376749	/nfs/dbraw/zinc/37/67/49/460376749.db2.gz	DZOPKXLGYXFBBI-IBGZPJMESA-N	0	3	333.435	3.352	20	30		EGEDHN
CC(C)[C@H](C#N)NC(=O)c1ccccc1OCCN1CCCC[C@H]1C	ZINC000613370890	460924840	/nfs/dbraw/zinc/92/48/40/460924840.db2.gz	OLNCELSPRVBHTC-AEFFLSMTSA-N	0	3	343.471	3.218	20	30		EGEDHN
C=CC[C@@H]1CCCN(Cc2c(C)nn(C)c2OCC(F)(F)F)C1	ZINC000668493587	461302597	/nfs/dbraw/zinc/30/25/97/461302597.db2.gz	PHYVDZBTVUGOFJ-CYBMUJFWSA-N	0	3	331.382	3.458	20	30		EGEDHN
C=CCC[C@H](CO)NCc1c(C)nn(-c2ccc(F)cc2F)c1C	ZINC000641759793	461355823	/nfs/dbraw/zinc/35/58/23/461355823.db2.gz	JCCMLYVZHKKIBD-OAHLLOKOSA-N	0	3	335.398	3.184	20	30		EGEDHN
N#CC(C(=O)c1ccc(NC(N)=O)cc1)c1nc(C2CC2)cs1	ZINC000647372551	461663951	/nfs/dbraw/zinc/66/39/51/461663951.db2.gz	OQKPUVCRXLCQJH-LBPRGKRZSA-N	0	3	326.381	3.001	20	30		EGEDHN
C=CCC1(NC(=O)NCc2ccc(OCCN(C)C)cc2)CCCC1	ZINC000663586359	461714000	/nfs/dbraw/zinc/71/40/00/461714000.db2.gz	VNSNCJBMEZJXFJ-UHFFFAOYSA-N	0	3	345.487	3.315	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)N[C@H]1CCCN2CCCC[C@@H]12	ZINC000654318464	462161737	/nfs/dbraw/zinc/16/17/37/462161737.db2.gz	NEUVLDLQECMEOP-ROUUACIJSA-N	0	3	344.455	3.007	20	30		EGEDHN
C=CCN(C[C@@H](O)Cc1ccc(C(F)(F)F)cc1)[C@H](C)COC	ZINC000661242388	462166233	/nfs/dbraw/zinc/16/62/33/462166233.db2.gz	NVYUDYSXSYKZIO-CJNGLKHVSA-N	0	3	331.378	3.132	20	30		EGEDHN
C=CCN(C[C@@H](O)COc1ccc2ccccc2c1)[C@@H](C)COC	ZINC000661248127	462169657	/nfs/dbraw/zinc/16/96/57/462169657.db2.gz	SBUMSPACTYFGDU-QFBILLFUSA-N	0	3	329.440	3.102	20	30		EGEDHN
C=CC[C@@H]1CCCN(CC(=O)NCc2ccc(OC(F)F)cc2)C1	ZINC000661378431	462223092	/nfs/dbraw/zinc/22/30/92/462223092.db2.gz	GLHLPFLGZBJCNX-OAHLLOKOSA-N	0	3	338.398	3.192	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)N[C@@H]1CCCN2CCCC[C@@H]12	ZINC000654439613	462225342	/nfs/dbraw/zinc/22/53/42/462225342.db2.gz	SJJYGHNYHHHSKI-MSOLQXFVSA-N	0	3	343.471	3.068	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc(OC)c(COC)c2)CC1	ZINC000640693309	462494656	/nfs/dbraw/zinc/49/46/56/462494656.db2.gz	VRZLXARIQPBFRU-UHFFFAOYSA-N	0	3	347.459	3.004	20	30		EGEDHN
Cc1ccc(CN2CC[C@@H](Nc3nc4c(cc3C#N)COCC4)C2)cc1	ZINC000601249328	468797321	/nfs/dbraw/zinc/79/73/21/468797321.db2.gz	AWBMNPKHXIQBKW-LJQANCHMSA-N	0	3	348.450	3.021	20	30		EGEDHN
C=CCN1CCC(NC(=O)COc2ccc(Cl)cc2Cl)CC1	ZINC000171725305	526421747	/nfs/dbraw/zinc/42/17/47/526421747.db2.gz	OUBVTUOMYNXZSL-UHFFFAOYSA-N	0	3	343.254	3.139	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(Cc2cccc(F)c2)C2CC2)CC1	ZINC000171738380	526425605	/nfs/dbraw/zinc/42/56/05/526425605.db2.gz	MWRUVRGBIJHFFE-UHFFFAOYSA-N	0	3	331.435	3.150	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cccc(COCC3CC3)c2)CC1	ZINC000171636949	526441305	/nfs/dbraw/zinc/44/13/05/526441305.db2.gz	SYBNYQLVDLRTQA-UHFFFAOYSA-N	0	3	343.471	3.385	20	30		EGEDHN
C=CCOCCCC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1	ZINC000173533139	526735360	/nfs/dbraw/zinc/73/53/60/526735360.db2.gz	WUDXAUXSKHFAQI-SFHVURJKSA-N	0	3	330.472	3.092	20	30		EGEDHN
COCC#CCN[C@@H](Cc1ccc(OC)c(OC)c1)c1ccccc1	ZINC000678762609	549555725	/nfs/dbraw/zinc/55/57/25/549555725.db2.gz	JTEUJWVWEVXMOF-IBGZPJMESA-N	0	3	339.435	3.227	20	30		EGEDHN
C=CCCOCCCCC(=O)N1C[C@@H](CN(C)C)Oc2ccccc21	ZINC000678857375	549580326	/nfs/dbraw/zinc/58/03/26/549580326.db2.gz	KDDZNXOJIBTXJB-QGZVFWFLSA-N	0	3	346.471	3.105	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2C[C@H](C(F)(F)F)CC[C@@H]2C)CC1	ZINC000679487639	549718563	/nfs/dbraw/zinc/71/85/63/549718563.db2.gz	JQNPMTCBBVFCQY-UONOGXRCSA-N	0	3	347.425	3.399	20	30		EGEDHN
CC#CCCNC(=O)N(CCC)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000681538428	550011961	/nfs/dbraw/zinc/01/19/61/550011961.db2.gz	SJDYQICVEKNFQP-HXUWFJFHSA-N	0	3	341.499	3.486	20	30		EGEDHN
C#Cc1cccc(NC(=S)N(CCN(C)C)Cc2ccc(C)o2)c1	ZINC000726474554	574559554	/nfs/dbraw/zinc/55/95/54/574559554.db2.gz	VPMICNNVRQIMTN-UHFFFAOYSA-N	0	3	341.480	3.330	20	30		EGEDHN
C[C@@H](NCc1ccc(O[C@@H](C)C#N)cc1)c1ccc2c(c1)CC(=O)N2C	ZINC000728714828	574767713	/nfs/dbraw/zinc/76/77/13/574767713.db2.gz	ABHPTUXUBYHSBQ-LSDHHAIUSA-N	0	3	349.434	3.347	20	30		EGEDHN
CC[NH+](CC)Cc1cc(C(C)N=Nc2ccc(C)nn2)ccc1[O-]	ZINC000729936126	574897604	/nfs/dbraw/zinc/89/76/04/574897604.db2.gz	HXDLTRLHIOWMCP-UHFFFAOYSA-N	0	3	327.432	3.169	20	30		EGEDHN
C#CCOc1ccc(CNCCN(C(=O)OC(C)(C)C)C2CC2)cc1	ZINC000733327057	575327968	/nfs/dbraw/zinc/32/79/68/575327968.db2.gz	MIHQYGPVEXSHKQ-UHFFFAOYSA-N	0	3	344.455	3.188	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)CO[C@@H]2CCCC[C@H]2C)c1	ZINC000733679431	575381360	/nfs/dbraw/zinc/38/13/60/575381360.db2.gz	ZQFWGZQCHAJFQC-QGPMSJSTSA-N	0	3	328.412	3.238	20	30		EGEDHN
CN(C)CCOc1ccc(CN=Nc2cc(F)c(F)cc2F)cc1	ZINC000734302807	575463711	/nfs/dbraw/zinc/46/37/11/575463711.db2.gz	PODMXHSSGKBYLL-UHFFFAOYSA-N	0	3	337.345	3.490	20	30		EGEDHN
CN(C)CCOc1ccc(C=NNc2cc(F)c(F)cc2F)cc1	ZINC000734302807	575463716	/nfs/dbraw/zinc/46/37/16/575463716.db2.gz	PODMXHSSGKBYLL-UHFFFAOYSA-N	0	3	337.345	3.490	20	30		EGEDHN
C#CCCN1CCC(NC(=O)CCc2ccc3ccccc3c2)CC1	ZINC000740737204	576621754	/nfs/dbraw/zinc/62/17/54/576621754.db2.gz	DZAAKMHHARPPBR-UHFFFAOYSA-N	0	3	334.463	3.376	20	30		EGEDHN
C#CCCN1CCC(NC(=O)CCCCc2ccc(C)cc2)CC1	ZINC000740736458	576621807	/nfs/dbraw/zinc/62/18/07/576621807.db2.gz	VCGOLCKMMBPITL-UHFFFAOYSA-N	0	3	326.484	3.312	20	30		EGEDHN
C[C@@H](NCc1ccc(O[C@@H](C)C#N)cc1)c1ccc2[nH]c(=O)[nH]c2c1	ZINC000740897824	576635030	/nfs/dbraw/zinc/63/50/30/576635030.db2.gz	GALFSIZMFNTMGX-QWHCGFSZSA-N	0	3	336.395	3.410	20	30		EGEDHN
CCC(=NNC(=S)NC1CCN(Cc2ccccc2)CC1)C1CC1	ZINC000741161400	576662584	/nfs/dbraw/zinc/66/25/84/576662584.db2.gz	SYVIWXCWFFOODO-UHFFFAOYSA-N	0	3	344.528	3.291	20	30		EGEDHN
N#Cc1ccc(-c2ccn(CN3CCCC4(CCOCC4)C3)n2)cc1	ZINC000742159460	576753469	/nfs/dbraw/zinc/75/34/69/576753469.db2.gz	RHMQITNCCWEPNQ-UHFFFAOYSA-N	0	3	336.439	3.272	20	30		EGEDHN
COc1ccc(CN[C@@H]2CCN(c3ccc(F)cc3F)C2)cc1C#N	ZINC000742370167	576774843	/nfs/dbraw/zinc/77/48/43/576774843.db2.gz	SMYXCOLGUPKPHD-MRXNPFEDSA-N	0	3	343.377	3.214	20	30		EGEDHN
C#CCCCNC(=O)c1ccccc1OCCN1CCCC[C@H]1C	ZINC000742787090	576795449	/nfs/dbraw/zinc/79/54/49/576795449.db2.gz	HYFAMVVMMRCJMR-QGZVFWFLSA-N	0	3	328.456	3.083	20	30		EGEDHN
C[C@@H]1CC[C@@H](CCC(=O)C(C#N)C(=O)Nc2ccccc2Cl)O1	ZINC000744027690	576819118	/nfs/dbraw/zinc/81/91/18/576819118.db2.gz	BIZJKXBKDRLXMK-FRRDWIJNSA-N	0	3	334.803	3.335	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1)C(=O)[C@@H]1C[C@]12CCc1ccccc12	ZINC000744028515	576819191	/nfs/dbraw/zinc/81/91/91/576819191.db2.gz	JCWVIUCPMTYIJP-MDKPJZGXSA-N	0	3	330.387	3.238	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)[C@H](C)c2ccc(C)o2)cc1	ZINC000744033715	576819262	/nfs/dbraw/zinc/81/92/62/576819262.db2.gz	VRGOLRILXKSZRB-DOMZBBRYSA-N	0	3	326.352	3.048	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000769297596	1303086649	/nfs/dbraw/zinc/08/66/49/1303086649.db2.gz	DGCAVQHBNFOVIR-QGZVFWFLSA-N	0	3	329.444	3.390	20	30		EGEDHN
Cc1cc(C)cc(OCCC(=O)C(C#N)C(=O)NC2CCCCC2)c1	ZINC000050683937	1291656022	/nfs/dbraw/zinc/65/60/22/1291656022.db2.gz	MAPOLTQDJUCQHJ-SFHVURJKSA-N	0	3	342.439	3.230	20	30		EGEDHN
CC(=O)N(C)CC(=O)C(C#N)c1nc(-c2ccc(Cl)cc2)cs1	ZINC000103799298	1293013890	/nfs/dbraw/zinc/01/38/90/1293013890.db2.gz	NYMZVWQUSNLNOE-CYBMUJFWSA-N	0	3	347.827	3.118	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)CC[C@@H]1CCCCO1	ZINC000111945172	1293113343	/nfs/dbraw/zinc/11/33/43/1293113343.db2.gz	YDJYBIPZDPKQII-LSDHHAIUSA-N	0	3	344.411	3.082	20	30		EGEDHN
N#CC(C(=O)CSC(F)F)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000835065356	1293197638	/nfs/dbraw/zinc/19/76/38/1293197638.db2.gz	LQAZWSPTQZRPNT-ZETCQYMHSA-N	0	3	336.722	3.082	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)CSCCC(C)C)c1	ZINC000121264217	1293362206	/nfs/dbraw/zinc/36/22/06/1293362206.db2.gz	IPLSGDGOLOFWBB-OAHLLOKOSA-N	0	3	334.441	3.122	20	30		EGEDHN
C[C@H](CC(=O)C(C#N)C(=O)NC1CC1)c1ccc(C(F)(F)F)cc1	ZINC000121321425	1293365705	/nfs/dbraw/zinc/36/57/05/1293365705.db2.gz	YRHWUNBYXXYONS-QMTHXVAHSA-N	0	3	338.329	3.186	20	30		EGEDHN
CC(C)(C)c1ccc(C([O-])=C(C#N)C(=O)Nc2ccccn2)s1	ZINC000122124264	1293402039	/nfs/dbraw/zinc/40/20/39/1293402039.db2.gz	RFABHZQSQIXOAB-LLVKDONJSA-N	0	3	327.409	3.402	20	30		EGEDHN
CC(C)(C)c1ccc(C(=O)C(C#N)C(=O)Nc2ccccn2)s1	ZINC000122124264	1293402041	/nfs/dbraw/zinc/40/20/41/1293402041.db2.gz	RFABHZQSQIXOAB-LLVKDONJSA-N	0	3	327.409	3.402	20	30		EGEDHN
COc1cc(Cl)c(C)cc1NC(=O)C(C#N)C(=O)Cc1ccoc1	ZINC000123614970	1293449575	/nfs/dbraw/zinc/44/95/75/1293449575.db2.gz	DFJBKONUNNFQGE-GFCCVEGCSA-N	0	3	346.770	3.140	20	30		EGEDHN
C[C@H]1CCc2sc(C(=O)C(C#N)C(=O)Nc3ccccn3)cc2C1	ZINC000125110194	1293495568	/nfs/dbraw/zinc/49/55/68/1293495568.db2.gz	BLJHJEBADULXJU-WCQYABFASA-N	0	3	339.420	3.229	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@H](C)Oc1cccc(C)c1	ZINC000125598387	1293511491	/nfs/dbraw/zinc/51/14/91/1293511491.db2.gz	YPNNAYVKKAGZHT-DOTOQJQBSA-N	0	3	330.428	3.168	20	30		EGEDHN
C[C@@H](Oc1ccc(F)c(F)c1)C(=O)C(C#N)C(=O)Nc1ccccc1	ZINC000129858368	1293636920	/nfs/dbraw/zinc/63/69/20/1293636920.db2.gz	WEBOTVMKJMFSID-BXUZGUMPSA-N	0	3	344.317	3.080	20	30		EGEDHN
C[C@@H](Cc1ccccc1Cl)C(=O)C(C#N)C(=O)NC1CCCC1	ZINC000155179247	1294087443	/nfs/dbraw/zinc/08/74/43/1294087443.db2.gz	RNGDTGXYLBATGF-WFASDCNBSA-N	0	3	332.831	3.286	20	30		EGEDHN
C[C@H](Cc1ccccc1Cl)C(=O)C(C#N)C(=O)NC1CCCC1	ZINC000155179148	1294087468	/nfs/dbraw/zinc/08/74/68/1294087468.db2.gz	RNGDTGXYLBATGF-IUODEOHRSA-N	0	3	332.831	3.286	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)C[C@H](C)SC)cc1Cl	ZINC000156353691	1294139790	/nfs/dbraw/zinc/13/97/90/1294139790.db2.gz	MSFUIMHQGUJPEQ-ONGXEEELSA-N	0	3	340.832	3.138	20	30		EGEDHN
C#CCOc1ccccc1CNc1ccc(N2CCN(C)CC2)cc1	ZINC000158154299	1294197200	/nfs/dbraw/zinc/19/72/00/1294197200.db2.gz	FYOLFHLVPXVKJE-UHFFFAOYSA-N	0	3	335.451	3.063	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@H](C)Oc1ccc(SC)cc1	ZINC000158680396	1294211240	/nfs/dbraw/zinc/21/12/40/1294211240.db2.gz	ULRATGVGYUQHIC-XJKSGUPXSA-N	0	3	348.468	3.191	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)CCc1cccc(F)c1F	ZINC000159728587	1294245879	/nfs/dbraw/zinc/24/58/79/1294245879.db2.gz	IZQKILAGOSUHFW-CQSZACIVSA-N	0	3	336.382	3.303	20	30		EGEDHN
C#CCOc1ccc([C@@H](C)N[C@H](C)C(=O)NCc2ccccc2)cc1	ZINC000161190379	1294286883	/nfs/dbraw/zinc/28/68/83/1294286883.db2.gz	MHFIYMKOBRYKAD-IAGOWNOFSA-N	0	3	336.435	3.054	20	30		EGEDHN
C#CCCCOC(=O)C1CCN(c2cc(Cl)ccc2Cl)C1=O	ZINC000170711099	1294378099	/nfs/dbraw/zinc/37/80/99/1294378099.db2.gz	OSAVKZSQVAYTPJ-LBPRGKRZSA-N	0	3	340.206	3.303	20	30		EGEDHN
C#CCOc1ccc(CNCc2ccc(Cn3cccn3)cc2)cc1	ZINC000172112621	1294429062	/nfs/dbraw/zinc/42/90/62/1294429062.db2.gz	BMXASJMVXQSNLK-UHFFFAOYSA-N	0	3	331.419	3.233	20	30		EGEDHN
CCOc1cccc(/C=N/CCN(C)Cc2ccc(F)cc2)c1O	ZINC000176414623	1294605070	/nfs/dbraw/zinc/60/50/70/1294605070.db2.gz	XFOQBFSTXYCSDM-FYJGNVAPSA-N	0	3	330.403	3.481	20	30		EGEDHN
C[C@H](NCc1cc(C#N)cs1)c1ccc(N2CCOC2=O)cc1	ZINC000177691144	1294685896	/nfs/dbraw/zinc/68/58/96/1294685896.db2.gz	ZUGSBOJGJYOMMN-LBPRGKRZSA-N	0	3	327.409	3.427	20	30		EGEDHN
CC[C@H](NCC(=O)N(CCC#N)c1ccc(C)c(C)c1)[C@H]1CCCO1	ZINC000182241727	1295029701	/nfs/dbraw/zinc/02/97/01/1295029701.db2.gz	KYAQHXPJBSGOFP-RBUKOAKNSA-N	0	3	343.471	3.097	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1)C(=O)c1cc(Br)cs1	ZINC000194588654	1295991957	/nfs/dbraw/zinc/99/19/57/1295991957.db2.gz	AYEPWZOZGUTQPB-NSHDSACASA-N	0	3	349.209	3.472	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000870980677	1296164278	/nfs/dbraw/zinc/16/42/78/1296164278.db2.gz	AUFQIWFKLVLUGK-KRWDZBQOSA-N	0	3	333.863	3.142	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@@H]1C[C@H]1c1c(F)cccc1F	ZINC000247568583	1296397492	/nfs/dbraw/zinc/39/74/92/1296397492.db2.gz	WEEQKJBKNLICKD-JHJVBQTASA-N	0	3	334.366	3.084	20	30		EGEDHN
CN(CCON=Cc1ccc(N2CCOCC2)cc1)c1ccccc1	ZINC000255615767	1296553515	/nfs/dbraw/zinc/55/35/15/1296553515.db2.gz	KGKASEDMWLCJLQ-UHFFFAOYSA-N	0	3	339.439	3.010	20	30		EGEDHN
C#C[C@@H](NCc1cc(Br)c2c(c1)OCCCO2)C(C)C	ZINC000379670089	1297537906	/nfs/dbraw/zinc/53/79/06/1297537906.db2.gz	FYPRJOQOPUURRI-CQSZACIVSA-N	0	3	338.245	3.358	20	30		EGEDHN
C#CCSCCN[C@H](C)c1ccccc1I	ZINC000381485223	1297552265	/nfs/dbraw/zinc/55/22/65/1297552265.db2.gz	UYJZFXAPAGYPMW-LLVKDONJSA-N	0	3	345.249	3.308	20	30		EGEDHN
C=C[C@@H](COC)N[C@@H](C)c1ccc(I)cc1	ZINC000390507293	1297626411	/nfs/dbraw/zinc/62/64/11/1297626411.db2.gz	XTASAPYJYRNCSB-GWCFXTLKSA-N	0	3	331.197	3.143	20	30		EGEDHN
C[C@@H]1CCN(Cc2ccccc2)C[C@@H]1NC(=O)c1cccc(C#N)c1	ZINC000716261105	1298296240	/nfs/dbraw/zinc/29/62/40/1298296240.db2.gz	DBXNQWJNWANRTQ-UZLBHIALSA-N	0	3	333.435	3.199	20	30		EGEDHN
C[C@@H](C(=O)C(C#N)C(=O)NC1CC1)c1ccc(Cl)c(Cl)c1	ZINC000747107687	1298728791	/nfs/dbraw/zinc/72/87/91/1298728791.db2.gz	AJGYKPMXVKTGSY-KCJUWKMLSA-N	0	3	325.195	3.084	20	30		EGEDHN
CCC(CC)(CNCc1cccc(C#N)n1)NC(=O)OC(C)(C)C	ZINC000877068257	1299142370	/nfs/dbraw/zinc/14/23/70/1299142370.db2.gz	SRDQVWZGYHGDPS-UHFFFAOYSA-N	0	3	332.448	3.126	20	30		EGEDHN
CC(=O)[C@@](C#N)(CCN(CCCO)CC(C)(C)C)c1ccccc1	ZINC000878081651	1299736978	/nfs/dbraw/zinc/73/69/78/1299736978.db2.gz	GEBONNKUFTXGGX-FQEVSTJZSA-N	0	3	330.472	3.158	20	30		EGEDHN
C#C[C@@H](CC)NC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1	ZINC000753033853	1299850378	/nfs/dbraw/zinc/85/03/78/1299850378.db2.gz	RXNXTYQHQYDFSH-HOTGVXAUSA-N	0	3	333.501	3.232	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000878301041	1299903926	/nfs/dbraw/zinc/90/39/26/1299903926.db2.gz	QVRJTTHCDAEQCA-UHFFFAOYSA-N	0	3	343.515	3.307	20	30		EGEDHN
CNc1cc(C(=O)C(C#N)c2nc3ccccc3n2C)cc(Cl)n1	ZINC000755580822	1300360927	/nfs/dbraw/zinc/36/09/27/1300360927.db2.gz	PFQIZAGJFYTDIL-LLVKDONJSA-N	0	3	339.786	3.153	20	30		EGEDHN
C[C@]1(COC(=O)c2c[nH]c(C#N)c2)CCCCN1Cc1ccccc1	ZINC000755910251	1300413697	/nfs/dbraw/zinc/41/36/97/1300413697.db2.gz	PZKKNWDSOAZKJX-HXUWFJFHSA-N	0	3	337.423	3.488	20	30		EGEDHN
CC1(F)CCN(CC(=O)C(C#N)c2nc3ccccc3s2)CC1	ZINC000879381523	1300508872	/nfs/dbraw/zinc/50/88/72/1300508872.db2.gz	FCXXMJNFTXBEGL-GFCCVEGCSA-N	0	3	331.416	3.297	20	30		EGEDHN
C#CC[C@@H](NC(=O)[C@H]1CCCN(Cc2cccnc2)C1)c1ccccc1	ZINC000757618879	1300695810	/nfs/dbraw/zinc/69/58/10/1300695810.db2.gz	ZZJNHKURPDCYAD-LEWJYISDSA-N	0	3	347.462	3.174	20	30		EGEDHN
C#CCOc1ccc([C@@H](C)NCc2ccccc2Cn2cncn2)cc1	ZINC000764860432	1302151747	/nfs/dbraw/zinc/15/17/47/1302151747.db2.gz	MXWUDKXHHFTUJB-QGZVFWFLSA-N	0	3	346.434	3.189	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@H](C)[C@H](c2ccccc2)N(C)C)cc1	ZINC000770042880	1303212078	/nfs/dbraw/zinc/21/20/78/1303212078.db2.gz	BJUBIZZUGFOKIR-OXQOHEQNSA-N	0	3	336.435	3.120	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]1NCc1cc(C#N)ccc1F	ZINC000775628215	1303997951	/nfs/dbraw/zinc/99/79/51/1303997951.db2.gz	ARJVTEJYKRJNMS-HZPDHXFCSA-N	0	3	333.407	3.233	20	30		EGEDHN
CC(C)(C)OC(=O)CC(C)(C)NC(=O)C(C#N)CCc1ccccc1	ZINC000888152281	1304053595	/nfs/dbraw/zinc/05/35/95/1304053595.db2.gz	NQQZNCRKCIAPCA-MRXNPFEDSA-N	0	3	344.455	3.386	20	30		EGEDHN
CCN(CC)C(=O)[C@@H](Cc1ccccc1)NCc1ccc(C#N)cc1	ZINC000775999605	1304077381	/nfs/dbraw/zinc/07/73/81/1304077381.db2.gz	FSSFPFNAUYPSBH-HXUWFJFHSA-N	0	3	335.451	3.128	20	30		EGEDHN
C[C@@H]1CCN(C(=O)Nc2ccc(C#N)cn2)CCN1Cc1ccccc1	ZINC000889226871	1304418851	/nfs/dbraw/zinc/41/88/51/1304418851.db2.gz	RLYDRUBMSBKDBL-MRXNPFEDSA-N	0	3	349.438	3.082	20	30		EGEDHN
COc1ccc(CN[C@H]2CCCN(c3ccc(C#N)cc3)C2=O)cc1C	ZINC000778545590	1304462883	/nfs/dbraw/zinc/46/28/83/1304462883.db2.gz	XPAONMQGOPRJCP-IBGZPJMESA-N	0	3	349.434	3.161	20	30		EGEDHN
C#C[C@H]([NH2+][C@@H](C)c1cc(Br)cc(C)c1[O-])[C@@H]1CCCO1	ZINC000779052386	1304522938	/nfs/dbraw/zinc/52/29/38/1304522938.db2.gz	PKJMUEWJVGWLPG-CQDKDKBSSA-N	0	3	338.245	3.295	20	30		EGEDHN
C=CCN1CCC(Nc2ccc(-c3c(F)cccc3F)nn2)CC1	ZINC000892397538	1305350056	/nfs/dbraw/zinc/35/00/56/1305350056.db2.gz	VKHAXFBRTDSFLF-UHFFFAOYSA-N	0	3	330.382	3.484	20	30		EGEDHN
C#CCOc1ccccc1CNC[C@H](O)c1cc(F)cc(Cl)c1	ZINC000785611616	1305392686	/nfs/dbraw/zinc/39/26/86/1305392686.db2.gz	ZJSGIRUOYDJDQF-KRWDZBQOSA-N	0	3	333.790	3.314	20	30		EGEDHN
N#Cc1ccc(OCCCOC(=O)[C@@H]2CCCN2C2CCCC2)cc1	ZINC000786884156	1305649113	/nfs/dbraw/zinc/64/91/13/1305649113.db2.gz	URRHUZAHEJFHPU-IBGZPJMESA-N	0	3	342.439	3.277	20	30		EGEDHN
COc1ccc(C(C)=NOC[C@H]2CCOC2)cc1CN1CCCC1	ZINC000788028858	1305849367	/nfs/dbraw/zinc/84/93/67/1305849367.db2.gz	CACNWKVKBFXANT-INIZCTEOSA-N	0	3	332.444	3.068	20	30		EGEDHN
N#CC(C(=O)Cc1cccc(C(F)F)c1)C(=O)NC1CCCCC1	ZINC000790766741	1308861739	/nfs/dbraw/zinc/86/17/39/1308861739.db2.gz	FCDRIUZIKMEBID-HNNXBMFYSA-N	0	3	334.366	3.324	20	30		EGEDHN
Cc1nc(CC2CCN(Cc3ccc(O[C@@H](C)C#N)cc3)CC2)no1	ZINC000896551723	1309912840	/nfs/dbraw/zinc/91/28/40/1309912840.db2.gz	QLOWBXPYJLGETL-AWEZNQCLSA-N	0	3	340.427	3.124	20	30		EGEDHN
Cc1nc(CC2CCN(Cc3ccc(O[C@H](C)C#N)cc3)CC2)no1	ZINC000896551724	1309913073	/nfs/dbraw/zinc/91/30/73/1309913073.db2.gz	QLOWBXPYJLGETL-CQSZACIVSA-N	0	3	340.427	3.124	20	30		EGEDHN
Cc1sc(=O)n(CC(=O)C(C#N)c2ncc(C(C)(C)C)s2)c1C	ZINC000797566465	1310212187	/nfs/dbraw/zinc/21/21/87/1310212187.db2.gz	KUFBNJVIXKRJHR-LLVKDONJSA-N	0	3	349.481	3.157	20	30		EGEDHN
CC(=O)N[C@H](C(=O)C(C#N)c1ncc(C(C)(C)C)s1)C1CCCC1	ZINC000797567241	1310212407	/nfs/dbraw/zinc/21/24/07/1310212407.db2.gz	DZCVLGQRYWAGJF-ZFWWWQNUSA-N	0	3	347.484	3.312	20	30		EGEDHN
Cc1noc(C[C@H]2CCCN(Cc3ccc(O[C@@H](C)C#N)cc3)C2)n1	ZINC000897579074	1310392509	/nfs/dbraw/zinc/39/25/09/1310392509.db2.gz	NUEDZXQYPJEAEA-WMLDXEAASA-N	0	3	340.427	3.124	20	30		EGEDHN
COc1cc(CNC[C@@H](O)c2cc(F)cc(Cl)c2)ccc1C#N	ZINC000799342491	1310530979	/nfs/dbraw/zinc/53/09/79/1310530979.db2.gz	SACCZSAUJHEZHG-MRXNPFEDSA-N	0	3	334.778	3.183	20	30		EGEDHN
C=C1CCN(C(=O)Nc2ccc(N3CCN(CC)CC3)cc2)CC1	ZINC000929347552	1328576597	/nfs/dbraw/zinc/57/65/97/1328576597.db2.gz	HQCBJWLJAZEMAT-UHFFFAOYSA-N	0	3	328.460	3.012	20	30		EGEDHN
CN(C)C[C@@H](NC(=O)C#Cc1ccccc1)c1ccc(Cl)cc1	ZINC000802381655	1317003430	/nfs/dbraw/zinc/00/34/30/1317003430.db2.gz	LKUILDOHVDSSBZ-GOSISDBHSA-N	0	3	326.827	3.111	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3ccc(Cl)nc3)C2)CC1	ZINC001019331074	1317172298	/nfs/dbraw/zinc/17/22/98/1317172298.db2.gz	ISHCNLUEWUNOQC-INIZCTEOSA-N	0	3	333.863	3.172	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@H](NCc2ccc(C#N)s2)C1)c1cccs1	ZINC001019371625	1317199080	/nfs/dbraw/zinc/19/90/80/1317199080.db2.gz	KOMUVGUJFGOTJR-STQMWFEESA-N	0	3	345.493	3.175	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)N2CC[C@H](NCc3ccc(F)c(C#N)c3)C2)CC1	ZINC001019682289	1317328896	/nfs/dbraw/zinc/32/88/96/1317328896.db2.gz	ZLPKPFATPCWJAW-ZVZYQTTQSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C[C@H](C(=O)N1CC[C@H](NCc2ccc(C)nc2C)C1)c1ccccc1	ZINC001019804610	1317431789	/nfs/dbraw/zinc/43/17/89/1317431789.db2.gz	CDBYRXWULYZBCY-SFTDATJTSA-N	0	3	349.478	3.359	20	30		EGEDHN
C=C[C@@H](C(=O)N1CC[C@H](NCc2ccsc2)C1)c1ccccc1	ZINC001019804555	1317431992	/nfs/dbraw/zinc/43/19/92/1317431992.db2.gz	ALEUQDUABZGRAO-ZWKOTPCHSA-N	0	3	326.465	3.408	20	30		EGEDHN
C=C[C@H](C(=O)N1CC[C@H](NCc2cccc(F)c2)C1)c1ccccc1	ZINC001019805154	1317432727	/nfs/dbraw/zinc/43/27/27/1317432727.db2.gz	VCNOIYLOLMTAAQ-PMACEKPBSA-N	0	3	338.426	3.486	20	30		EGEDHN
C#CCOc1ccc(NC(=O)N(CCC)CCN2CCCCC2)cc1	ZINC000806263159	1317475189	/nfs/dbraw/zinc/47/51/89/1317475189.db2.gz	CINYQJNRDIETQQ-UHFFFAOYSA-N	0	3	343.471	3.428	20	30		EGEDHN
C#Cc1cccc(NC(=S)N[C@H](CN(C)C)c2ccc(F)cc2)c1	ZINC000806595257	1317508674	/nfs/dbraw/zinc/50/86/74/1317508674.db2.gz	SUGGHWOVVHHAFL-GOSISDBHSA-N	0	3	341.455	3.396	20	30		EGEDHN
C#CCN(Cc1ccccc1)C(=O)NC[C@@H](C)N(C)Cc1ccccc1	ZINC000806782862	1317524316	/nfs/dbraw/zinc/52/43/16/1317524316.db2.gz	YRPQXRONAIJWCW-LJQANCHMSA-N	0	3	349.478	3.352	20	30		EGEDHN
CCN(Cc1ccccc1C#N)CC1CCN(C(=O)C(C)(F)F)CC1	ZINC000957661479	1317531713	/nfs/dbraw/zinc/53/17/13/1317531713.db2.gz	XANGOPASEDIEKK-UHFFFAOYSA-N	0	3	349.425	3.274	20	30		EGEDHN
CC[C@H](C)N[C@H](CNC(=O)c1ccccc1OCC#N)c1ccco1	ZINC000807681014	1317577017	/nfs/dbraw/zinc/57/70/17/1317577017.db2.gz	YEVFRAHNTULEJE-GOEBONIOSA-N	0	3	341.411	3.041	20	30		EGEDHN
CCN(Cc1ccccc1C#N)CC1CCN(C(=O)C#CC2CC2)CC1	ZINC000957713228	1317584142	/nfs/dbraw/zinc/58/41/42/1317584142.db2.gz	SSSOZSJHZSPCOX-UHFFFAOYSA-N	0	3	349.478	3.032	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1C[C@H](NCc2cc(F)ccc2F)C1	ZINC001020239807	1317605354	/nfs/dbraw/zinc/60/53/54/1317605354.db2.gz	IIVLEOJWJAPPTL-WKILWMFISA-N	0	3	345.393	3.003	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)C[C@@H]2C[C@H]2c2ccc(OC)cc2)C1	ZINC001020254875	1317611775	/nfs/dbraw/zinc/61/17/75/1317611775.db2.gz	XUSVWDMNKISMFL-OVWQWFNUSA-N	0	3	348.874	3.178	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@H](NC(=O)C3CC4(CCC4)C3)C2)c1	ZINC001020487945	1317721040	/nfs/dbraw/zinc/72/10/40/1317721040.db2.gz	XIRFCMKUAFZQGL-QAQDUYKDSA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@H](NCc3cnc(Cl)s3)C2)CC1	ZINC001020544191	1317758547	/nfs/dbraw/zinc/75/85/47/1317758547.db2.gz	LTULECQRPZFRGU-JOCQHMNTSA-N	0	3	339.892	3.280	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@H](NCc3cccc(OC)c3Cl)C2)C1	ZINC001020562963	1317775006	/nfs/dbraw/zinc/77/50/06/1317775006.db2.gz	XNBFHTJRVKQUNZ-SHTZXODSSA-N	0	3	348.874	3.442	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001020606291	1317795714	/nfs/dbraw/zinc/79/57/14/1317795714.db2.gz	IKLURWYUEGVBFS-VDHUWJSZSA-N	0	3	343.446	3.116	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc(C(F)F)cc2F)C1	ZINC001020819004	1317948180	/nfs/dbraw/zinc/94/81/80/1317948180.db2.gz	NSILXBWBBMOTHB-XYPYZODXSA-N	0	3	332.753	3.366	20	30		EGEDHN
CC(C)[C@]1(C)C[C@H]1C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001020860513	1317969225	/nfs/dbraw/zinc/96/92/25/1317969225.db2.gz	QXLFELFJVALJMN-BOSXTWCSSA-N	0	3	343.446	3.116	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@@H](NCc1ccc(N3CCOC3=O)cc1)CC2	ZINC000810235865	1317982847	/nfs/dbraw/zinc/98/28/47/1317982847.db2.gz	VNIIDCPODCGUAV-IBGZPJMESA-N	0	3	333.391	3.292	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@]2(c3ccccc3)C[C@H](F)C2)C1	ZINC001020990012	1318033779	/nfs/dbraw/zinc/03/37/79/1318033779.db2.gz	KPNITQZFOVTQDI-XJWJDNGOSA-N	0	3	336.838	3.046	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)c2coc3ccccc23)C1	ZINC001021132484	1318108285	/nfs/dbraw/zinc/10/82/85/1318108285.db2.gz	DKZQJWSSUXWCPQ-HAQNSBGRSA-N	0	3	349.228	3.192	20	30		EGEDHN
Cc1occc1C(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1cccc(C#N)c1	ZINC001021187120	1318131539	/nfs/dbraw/zinc/13/15/39/1318131539.db2.gz	TZZPTUXUMOQULX-YQQQUEKLSA-N	0	3	349.434	3.385	20	30		EGEDHN
C#Cc1ccc(C(=O)NC2C[C@H]3CC[C@@H](C2)N3C[C@H](F)CC)cc1	ZINC001021342126	1318197611	/nfs/dbraw/zinc/19/76/11/1318197611.db2.gz	JKCUUGGCTSTAJR-MVCQKVDPSA-N	0	3	328.431	3.141	20	30		EGEDHN
CC1(C(=O)NC2C[C@H]3CC[C@@H](C2)N3Cc2cccc(C#N)c2)CCC1	ZINC001021350760	1318203948	/nfs/dbraw/zinc/20/39/48/1318203948.db2.gz	YSSAMXQMFRUUDS-YQQQUEKLSA-N	0	3	337.467	3.360	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCCC[C@H]1CNCc1cc(Cl)ccc1F	ZINC000959927142	1318269236	/nfs/dbraw/zinc/26/92/36/1318269236.db2.gz	ZTVBOBYINFOYCQ-DOMZBBRYSA-N	0	3	337.826	3.109	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@H](CCCN3C(=O)C3CCC3)C2)cc1	ZINC001021494052	1318295192	/nfs/dbraw/zinc/29/51/92/1318295192.db2.gz	YGMZTJQMVDJYKU-WOJBJXKFSA-N	0	3	337.467	3.171	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@@H](CCCN3C(=O)c3ccc[nH]3)C2)c1	ZINC001021519371	1318347412	/nfs/dbraw/zinc/34/74/12/1318347412.db2.gz	NIQRUBURQYCLQW-ICSRJNTNSA-N	0	3	348.450	3.013	20	30		EGEDHN
CN1CCN(C(=O)[C@@H]2C[C@H]2c2cccc(C#N)c2)CC12CCCCC2	ZINC000908572463	1318367215	/nfs/dbraw/zinc/36/72/15/1318367215.db2.gz	XEYUWHNKYKRSPD-RBUKOAKNSA-N	0	3	337.467	3.139	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@H](CCCN3C(=O)C3CC=CC3)C2)cc1	ZINC001021552032	1318391881	/nfs/dbraw/zinc/39/18/81/1318391881.db2.gz	VXHXGRATBZSSCV-RTWAWAEBSA-N	0	3	349.478	3.337	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@H](CCCN3C(=O)C3=CCCC3)C2)cc1	ZINC001021561647	1318410299	/nfs/dbraw/zinc/41/02/99/1318410299.db2.gz	FPJPXEKONOQEFU-NHCUHLMSSA-N	0	3	349.478	3.481	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@@H]1C[C@H]1c1ccsc1	ZINC000960277185	1318439927	/nfs/dbraw/zinc/43/99/27/1318439927.db2.gz	AYJFVIRQSDAHKH-WJFTUGDTSA-N	0	3	338.476	3.409	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccnc(CCC)c1	ZINC000960277825	1318441066	/nfs/dbraw/zinc/44/10/66/1318441066.db2.gz	JEVRPZHDVLGTQZ-WOJBJXKFSA-N	0	3	335.451	3.206	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cccc(COC)c1	ZINC000960280086	1318442126	/nfs/dbraw/zinc/44/21/26/1318442126.db2.gz	KUKXPWIFDZBDHU-WOJBJXKFSA-N	0	3	336.435	3.004	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc(C)c(OC)c1	ZINC000960282224	1318443763	/nfs/dbraw/zinc/44/37/63/1318443763.db2.gz	XUJAOGNGJLRPPH-UYAOXDASSA-N	0	3	336.435	3.175	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@@H]1Cc2ccc(F)cc21	ZINC000960298909	1318450583	/nfs/dbraw/zinc/45/05/83/1318450583.db2.gz	GBMPVVHXEGKTKS-VAMGGRTRSA-N	0	3	336.410	3.023	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(F)cc3ccoc32)C1	ZINC001021621058	1318469870	/nfs/dbraw/zinc/46/98/70/1318469870.db2.gz	YVLDIBRARFSPOF-YJBOKZPZSA-N	0	3	340.398	3.132	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1c2ccc(C)cc2[C@@H]2CN(C)CC[C@H]21	ZINC000812845769	1318470532	/nfs/dbraw/zinc/47/05/32/1318470532.db2.gz	MQUGMCIRSNBQRY-RBBKRZOGSA-N	0	3	344.458	3.353	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cn(C)c3ccccc23)C1	ZINC001021628482	1318482255	/nfs/dbraw/zinc/48/22/55/1318482255.db2.gz	WLVOPCMCVWTRCB-PXNSSMCTSA-N	0	3	349.478	3.128	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc3ccsc3[nH]2)C1	ZINC001021643954	1318501259	/nfs/dbraw/zinc/50/12/59/1318501259.db2.gz	DSLKDUZIOCTUDL-WBVHZDCISA-N	0	3	341.480	3.179	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(C(C)C)cn2)C1	ZINC001021667528	1318530958	/nfs/dbraw/zinc/53/09/58/1318530958.db2.gz	INOSQJGSLONDCB-QUCCMNQESA-N	0	3	339.483	3.155	20	30		EGEDHN
CCC(CC)C(=O)N1CCC[C@@H]1CN(C)Cc1cccc(C#N)c1	ZINC000960418511	1318542251	/nfs/dbraw/zinc/54/22/51/1318542251.db2.gz	HJIUINVQGSVVLS-LJQANCHMSA-N	0	3	327.472	3.417	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2csc(Cl)c2)C1	ZINC001021677118	1318546526	/nfs/dbraw/zinc/54/65/26/1318546526.db2.gz	OLPRYDOMADPOKV-ZFWWWQNUSA-N	0	3	336.888	3.351	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2csc(Cl)c2)C1	ZINC001021677110	1318546573	/nfs/dbraw/zinc/54/65/73/1318546573.db2.gz	OLPRYDOMADPOKV-DZGCQCFKSA-N	0	3	336.888	3.351	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(C(F)F)cc2)C1	ZINC001021691757	1318567203	/nfs/dbraw/zinc/56/72/03/1318567203.db2.gz	RQBFOADZYFKQRE-IAGOWNOFSA-N	0	3	332.394	3.184	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc3cccnc3c2)C1	ZINC001021693878	1318567698	/nfs/dbraw/zinc/56/76/98/1318567698.db2.gz	RVURTYHTNBWJAA-PZJWPPBQSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cccc(C)c2Cl)C1	ZINC001021693476	1318568105	/nfs/dbraw/zinc/56/81/05/1318568105.db2.gz	OSXCNMBUHAYDKU-NVXWUHKLSA-N	0	3	330.859	3.208	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)[C@H]2CC[C@H](C(C)C)CC2)C1	ZINC001021701939	1318574086	/nfs/dbraw/zinc/57/40/86/1318574086.db2.gz	DMAKPQAIAJYKOB-MUGJNUQGSA-N	0	3	330.516	3.395	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(C3CC3)s2)C1	ZINC001021712929	1318590121	/nfs/dbraw/zinc/59/01/21/1318590121.db2.gz	BRNXKOMQRAWPHH-CVEARBPZSA-N	0	3	328.481	3.185	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc3ccccc3n2)C1	ZINC001021720096	1318604531	/nfs/dbraw/zinc/60/45/31/1318604531.db2.gz	VMGCCWINQRCQIG-NQIIRXRSSA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)CCc2cccs2)C1	ZINC001021731218	1318634372	/nfs/dbraw/zinc/63/43/72/1318634372.db2.gz	TUYOZYLPURQAEV-WMZOPIPTSA-N	0	3	330.497	3.017	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc3cccc(C)c3o2)C1	ZINC001021740878	1318650204	/nfs/dbraw/zinc/65/02/04/1318650204.db2.gz	WZVFFPYPEFXGSN-MSOLQXFVSA-N	0	3	336.435	3.301	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)C23CC(C(C)(C)C)(C2)C3)C1	ZINC001021746170	1318660851	/nfs/dbraw/zinc/66/08/51/1318660851.db2.gz	IYMHWOYCBHPBCF-AMZMEHNNSA-N	0	3	328.500	3.149	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)/C=C/c1ccc[nH]1	ZINC000960589699	1318719636	/nfs/dbraw/zinc/71/96/36/1318719636.db2.gz	LDFVQRJDCYLHEN-SQUSKLHYSA-N	0	3	348.450	3.023	20	30		EGEDHN
C[C@@H](N[C@H]1C[C@@H](NC(=O)c2ccc(C#N)[nH]2)C1)c1ccccc1Cl	ZINC001021976625	1318758215	/nfs/dbraw/zinc/75/82/15/1318758215.db2.gz	IQOIGLXJJTZWSG-BNOWGMLFSA-N	0	3	342.830	3.151	20	30		EGEDHN
CCc1ccc(C#CC(=O)N(CCN(C)C)Cc2ccc(C)o2)cc1	ZINC000814648945	1318792932	/nfs/dbraw/zinc/79/29/32/1318792932.db2.gz	XRPDUQROIGFIDT-UHFFFAOYSA-N	0	3	338.451	3.092	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N(C)Cc1ccccc1Br	ZINC000911998279	1318793263	/nfs/dbraw/zinc/79/32/63/1318793263.db2.gz	KJUIKAFPIXANLV-AWEZNQCLSA-N	0	3	325.250	3.091	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)Nc1ccc(C(=O)N(C)C)cc1	ZINC000912039484	1318797098	/nfs/dbraw/zinc/79/70/98/1318797098.db2.gz	GWHWAJASQNPSHB-KRWDZBQOSA-N	0	3	333.476	3.405	20	30		EGEDHN
C[C@@H]1CCC[C@H]1CC(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001022122038	1318803447	/nfs/dbraw/zinc/80/34/47/1318803447.db2.gz	OPYRCVDDEAQRDA-SIUPPRGNSA-N	0	3	343.446	3.260	20	30		EGEDHN
C[C@H]1CCC[C@@H]1CC(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001022122039	1318803925	/nfs/dbraw/zinc/80/39/25/1318803925.db2.gz	OPYRCVDDEAQRDA-UNQWWWNPSA-N	0	3	343.446	3.260	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)[C@@H]1CCC1(F)F	ZINC000960702171	1318804493	/nfs/dbraw/zinc/80/44/93/1318804493.db2.gz	PAFCWJQQAPJWEN-IRXDYDNUSA-N	0	3	347.409	3.026	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)[C@H]2CCC(C)=C(C)C2)C1	ZINC001022130178	1318809302	/nfs/dbraw/zinc/80/93/02/1318809302.db2.gz	ZSBCOSYQTQQORN-SOUVJXGZSA-N	0	3	341.293	3.268	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1C[C@@H](NCc2cc(C)ccc2F)C1	ZINC001022206289	1318842451	/nfs/dbraw/zinc/84/24/51/1318842451.db2.gz	WNBKLDPZKBXDQR-CALCHBBNSA-N	0	3	341.430	3.172	20	30		EGEDHN
C#CCNC(=O)CC[N@H+](Cc1ccccc1[O-])[C@@H](C)c1ccccc1	ZINC000815078433	1318885061	/nfs/dbraw/zinc/88/50/61/1318885061.db2.gz	YUHNCYKAKLYVTO-KRWDZBQOSA-N	0	3	336.435	3.095	20	30		EGEDHN
C#CCNC(=O)CC[N@@H+](Cc1ccccc1[O-])[C@@H](C)c1ccccc1	ZINC000815078433	1318885065	/nfs/dbraw/zinc/88/50/65/1318885065.db2.gz	YUHNCYKAKLYVTO-KRWDZBQOSA-N	0	3	336.435	3.095	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@@H]2CCc3c2cccc3Cl)C1	ZINC001022440353	1318942599	/nfs/dbraw/zinc/94/25/99/1318942599.db2.gz	OEGXTVREOPRCRY-TYNCELHUSA-N	0	3	339.266	3.359	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc3c(cc(C)cc3C)[nH]2)C1	ZINC001022508266	1318971049	/nfs/dbraw/zinc/97/10/49/1318971049.db2.gz	MYXPWJQCOXATCV-OKILXGFUSA-N	0	3	331.847	3.388	20	30		EGEDHN
C[C@@H]1CCN(Cc2ccccc2)C[C@@H]1NC(=O)CCCCCC#N	ZINC000913096037	1318971642	/nfs/dbraw/zinc/97/16/42/1318971642.db2.gz	BKBLTUSEAKYJHL-MJGOQNOKSA-N	0	3	327.472	3.487	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2oc3ccccc3c2OC)C1	ZINC001022533589	1318979487	/nfs/dbraw/zinc/97/94/87/1318979487.db2.gz	ZQSKRHHSSDMBQT-TXEJJXNPSA-N	0	3	334.803	3.044	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2CC)C1	ZINC001022612688	1319014626	/nfs/dbraw/zinc/01/46/26/1319014626.db2.gz	BMUWPYYCRLRIIX-CIRFHOKZSA-N	0	3	332.875	3.342	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@@H](NC(=O)[C@]34C[C@H]3CCCC4)C2)c1	ZINC001022681635	1319066140	/nfs/dbraw/zinc/06/61/40/1319066140.db2.gz	KWIJAWPBEPJTHB-PDOICOKGSA-N	0	3	341.430	3.014	20	30		EGEDHN
CCC(=O)N1CCC[C@@H]([C@@H]2CCN(Cc3ccc(C#N)c(F)c3)C2)C1	ZINC000961074569	1319185737	/nfs/dbraw/zinc/18/57/37/1319185737.db2.gz	IYMSYWPETFPYMI-QZTJIDSGSA-N	0	3	343.446	3.168	20	30		EGEDHN
C=CCC(F)(F)C(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000816681557	1319207609	/nfs/dbraw/zinc/20/76/09/1319207609.db2.gz	ACHRCCKCWMFDDZ-MRXNPFEDSA-N	0	3	340.414	3.404	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)C[C@H]2CCc3ccccc3C2)C1	ZINC001023022233	1319226238	/nfs/dbraw/zinc/22/62/38/1319226238.db2.gz	IANAVMOHNINYKX-JCGIZDLHSA-N	0	3	332.875	3.171	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2csc3c2CC[C@@H](C)C3)C1	ZINC001023051777	1319240315	/nfs/dbraw/zinc/24/03/15/1319240315.db2.gz	KGJAWANZBJQJBT-RTXFEEFZSA-N	0	3	338.904	3.476	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)Cc2ccc3ccccc3c2)C1	ZINC001023069234	1319251449	/nfs/dbraw/zinc/25/14/49/1319251449.db2.gz	ZIWLITRRBACWOU-HDICACEKSA-N	0	3	328.843	3.372	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc3[nH]c(C)c(C)c3c2)C1	ZINC001023074752	1319252920	/nfs/dbraw/zinc/25/29/20/1319252920.db2.gz	JYSXFWMHPGODER-GASCZTMLSA-N	0	3	331.847	3.388	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@@H]([C@H]2CCN(Cc3ccc(C#N)s3)C2)C1	ZINC000961138973	1319257061	/nfs/dbraw/zinc/25/70/61/1319257061.db2.gz	LOJOVEHMTJIRNK-CVEARBPZSA-N	0	3	345.512	3.336	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)c2ccoc2C(C)C)C1	ZINC001023145835	1319289932	/nfs/dbraw/zinc/28/99/32/1319289932.db2.gz	AKMPEPRRWVRVEI-TXEJJXNPSA-N	0	3	341.249	3.162	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc(-c3ccccc3)[nH]2)C1	ZINC001023160580	1319301865	/nfs/dbraw/zinc/30/18/65/1319301865.db2.gz	DTHATWGQVARROJ-GASCZTMLSA-N	0	3	329.831	3.285	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@]2(C)CCc3ccccc3C2)C1	ZINC001023186210	1319310644	/nfs/dbraw/zinc/31/06/44/1319310644.db2.gz	XQWGCSIAMMLXBR-ZIFCJYIRSA-N	0	3	332.875	3.171	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](C2CCN(C(=O)[C@@H](C)SC)CC2)C1	ZINC000961328953	1319484974	/nfs/dbraw/zinc/48/49/74/1319484974.db2.gz	CVJHYKFPPDKRBY-ZBFHGGJFSA-N	0	3	344.952	3.441	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@H]1CCCN(Cc2ccsc2)C1	ZINC001023416021	1319519979	/nfs/dbraw/zinc/51/99/79/1319519979.db2.gz	RSHPHONJASOOHH-MRXNPFEDSA-N	0	3	343.496	3.378	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cccc3c(C)c(C)[nH]c32)C1	ZINC001023447109	1319548336	/nfs/dbraw/zinc/54/83/36/1319548336.db2.gz	GDZJRZNQCFPRRI-KRWDZBQOSA-N	0	3	337.467	3.250	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1cnc(-c2ccc(C)cc2C)s1	ZINC000818589363	1319564150	/nfs/dbraw/zinc/56/41/50/1319564150.db2.gz	ZEQUHANCVIGESC-UHFFFAOYSA-N	0	3	341.480	3.112	20	30		EGEDHN
C#CCN(C)CCCNC(=O)[C@H]1C[C@H]1c1ccc(Cl)cc1Cl	ZINC000818593343	1319564496	/nfs/dbraw/zinc/56/44/96/1319564496.db2.gz	VFMWETHSTUGKKS-GJZGRUSLSA-N	0	3	339.266	3.168	20	30		EGEDHN
C#CCN(C)CCCNC(=O)CCCOc1cccc2ccccc21	ZINC000818599098	1319566324	/nfs/dbraw/zinc/56/63/24/1319566324.db2.gz	AQBYNSAPPIRDSX-UHFFFAOYSA-N	0	3	338.451	3.070	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1ccc(-c2ccc(F)cc2)cc1F	ZINC000818606388	1319568357	/nfs/dbraw/zinc/56/83/57/1319568357.db2.gz	QZKKJNXRXWTTHW-UHFFFAOYSA-N	0	3	342.389	3.317	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2csc3ccccc23)C1	ZINC001023514828	1319619495	/nfs/dbraw/zinc/61/94/95/1319619495.db2.gz	STQNJGODNZRNOA-OAHLLOKOSA-N	0	3	326.465	3.366	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2sccc2-n2cccc2)C1	ZINC001023520307	1319627233	/nfs/dbraw/zinc/62/72/33/1319627233.db2.gz	OLYTWXWHBUDHLR-INIZCTEOSA-N	0	3	341.480	3.004	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN[C@H]2CCCOc3cc(F)ccc32)cc1	ZINC000819210794	1319669398	/nfs/dbraw/zinc/66/93/98/1319669398.db2.gz	LIDKZEUBDQAISV-ROUUACIJSA-N	0	3	326.371	3.234	20	30		EGEDHN
N#CC[C@@H](O)CN[C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1	ZINC000930372417	1328844201	/nfs/dbraw/zinc/84/42/01/1328844201.db2.gz	MCZJPYHVPCJPTF-CVEARBPZSA-N	0	3	342.361	3.037	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc3cc(F)ccc3o2)C1	ZINC001023626537	1319748003	/nfs/dbraw/zinc/74/80/03/1319748003.db2.gz	BLANXIMVYPTZMY-AWEZNQCLSA-N	0	3	328.387	3.037	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc(-c3ccccc3)ccn2)C1	ZINC001023670301	1319784472	/nfs/dbraw/zinc/78/44/72/1319784472.db2.gz	PPLCBEMDBSQPPC-SFHVURJKSA-N	0	3	347.462	3.214	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc(O[C@@H](C)CC)cc2)C1	ZINC001023691469	1319810127	/nfs/dbraw/zinc/81/01/27/1319810127.db2.gz	KPCQCGZLJNYCTG-ZWKOTPCHSA-N	0	3	342.483	3.329	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2c[nH]c3c2cccc3CC)C1	ZINC001023763722	1319911218	/nfs/dbraw/zinc/91/12/18/1319911218.db2.gz	ZIPPFDRGIIKXDU-MRXNPFEDSA-N	0	3	337.467	3.195	20	30		EGEDHN
C#C[C@@H](NC(=O)N1CCN(C2CC2)C[C@H](C)C1)c1ccc(Cl)cc1	ZINC000820560736	1319911758	/nfs/dbraw/zinc/91/17/58/1319911758.db2.gz	YSEGDHLPEVAFMF-KBXCAEBGSA-N	0	3	345.874	3.140	20	30		EGEDHN
C#C[C@H](NC(=O)N1CCN(C2CCCCC2)CC1)c1ccccc1	ZINC000820599928	1319919151	/nfs/dbraw/zinc/91/91/51/1319919151.db2.gz	RAPZDDKKNVZOFT-IBGZPJMESA-N	0	3	325.456	3.021	20	30		EGEDHN
N#Cc1ccccc1CNCC1CC(NC(=O)C2(F)CCCCC2)C1	ZINC000962491935	1319980818	/nfs/dbraw/zinc/98/08/18/1319980818.db2.gz	PUIKNEQGOQJWAW-UHFFFAOYSA-N	0	3	343.446	3.215	20	30		EGEDHN
Cc1ccc(C#N)cc1C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1	ZINC000930508133	1328881570	/nfs/dbraw/zinc/88/15/70/1328881570.db2.gz	NVCOUYRROYJYNS-QFBILLFUSA-N	0	3	333.435	3.432	20	30		EGEDHN
C#CC1CCN(C(=O)NC[C@H](c2ccc(SC)cc2)N(C)C)CC1	ZINC000827114950	1320428181	/nfs/dbraw/zinc/42/81/81/1320428181.db2.gz	SBEFPQBKMVGJTK-GOSISDBHSA-N	0	3	345.512	3.066	20	30		EGEDHN
C[N@H+](CCCC/N=C/c1cc(Br)ccc1[O-])C1CC1	ZINC000840710222	1321132085	/nfs/dbraw/zinc/13/20/85/1321132085.db2.gz	PGAAFHKCWZBPFP-GZTJUZNOSA-N	0	3	325.250	3.448	20	30		EGEDHN
C[N@@H+](CCCC/N=C/c1cc(Br)ccc1[O-])C1CC1	ZINC000840710222	1321132091	/nfs/dbraw/zinc/13/20/91/1321132091.db2.gz	PGAAFHKCWZBPFP-GZTJUZNOSA-N	0	3	325.250	3.448	20	30		EGEDHN
C#Cc1cccc(NC(=S)N(CCN(C)C)Cc2ccsc2)c1	ZINC000840847916	1321161859	/nfs/dbraw/zinc/16/18/59/1321161859.db2.gz	RDYOHXIABNLOCG-UHFFFAOYSA-N	0	3	343.521	3.490	20	30		EGEDHN
COCC1(CC(=O)C(C#N)C(=O)Nc2cccc3ccccc32)CC1	ZINC000842687492	1321418824	/nfs/dbraw/zinc/41/88/24/1321418824.db2.gz	XHKKTHPAYGDZDG-MRXNPFEDSA-N	0	3	336.391	3.304	20	30		EGEDHN
CCN(CC(=O)C(C#N)c1nc(C2CC2)cs1)C(=O)OC(C)(C)C	ZINC000842943349	1321451601	/nfs/dbraw/zinc/45/16/01/1321451601.db2.gz	VLFNWWNNGRZUGA-GFCCVEGCSA-N	0	3	349.456	3.454	20	30		EGEDHN
C=C[C@H](C)ONC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1	ZINC000844283931	1321584988	/nfs/dbraw/zinc/58/49/88/1321584988.db2.gz	KDJIHXAPJZJCJW-GJZGRUSLSA-N	0	3	337.489	3.326	20	30		EGEDHN
C#CCOc1cccc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)c1	ZINC000844380187	1321596734	/nfs/dbraw/zinc/59/67/34/1321596734.db2.gz	YPBCIJGJTLCMTQ-HUUCEWRRSA-N	0	3	341.329	3.385	20	30		EGEDHN
C#CCC(C)(C)C(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847746384	1321900360	/nfs/dbraw/zinc/90/03/60/1321900360.db2.gz	GKUUAAVMPYCOLQ-UHFFFAOYSA-N	0	3	338.451	3.385	20	30		EGEDHN
CC(C)[C@H](F)C(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847747781	1321900682	/nfs/dbraw/zinc/90/06/82/1321900682.db2.gz	QJRRYQZAXBWOLM-KRWDZBQOSA-N	0	3	332.419	3.330	20	30		EGEDHN
N#CC1(COC(=O)[C@H]2CCSC2)CCN(Cc2ccccc2)CC1	ZINC000847749631	1321900718	/nfs/dbraw/zinc/90/07/18/1321900718.db2.gz	WXWYYTRWTOJQDH-KRWDZBQOSA-N	0	3	344.480	3.089	20	30		EGEDHN
C[C@@H](COC(=O)CSCc1ccc(C#N)cc1)N1CCCCC1	ZINC000847958478	1321915845	/nfs/dbraw/zinc/91/58/45/1321915845.db2.gz	AZJUZMUVMKWBOS-HNNXBMFYSA-N	0	3	332.469	3.209	20	30		EGEDHN
N#CCSc1ccccc1C(=O)N[C@H]1CCCN2CCCC[C@@H]12	ZINC000848349452	1321953240	/nfs/dbraw/zinc/95/32/40/1321953240.db2.gz	IDHJGVLTJXUSNK-HOTGVXAUSA-N	0	3	329.469	3.049	20	30		EGEDHN
CCN(CCO)c1ccc(C=NN[C@@H](C)c2ccccc2)c(C)c1	ZINC000920385867	1322170762	/nfs/dbraw/zinc/17/07/62/1322170762.db2.gz	JANJYRRBDKNIJR-KRWDZBQOSA-N	0	3	325.456	3.498	20	30		EGEDHN
Cc1ccccc1CC(=O)NC1CC(CNCc2ccccc2C#N)C1	ZINC000962676112	1323040990	/nfs/dbraw/zinc/04/09/90/1323040990.db2.gz	KFFZVCGAJFMBMF-UHFFFAOYSA-N	0	3	347.462	3.094	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@H]1CCCN1CCc1ccc(C#N)cc1	ZINC000851791112	1323087954	/nfs/dbraw/zinc/08/79/54/1323087954.db2.gz	TYQVKJVQZQULBX-KRWDZBQOSA-N	0	3	329.444	3.090	20	30		EGEDHN
CO[C@@H]1CC[C@H](N2CCN([C@@H](C#N)c3cccc(Cl)c3)CC2)C1	ZINC000851998400	1323130022	/nfs/dbraw/zinc/13/00/22/1323130022.db2.gz	HKIDNAJGKZFDKX-KSZLIROESA-N	0	3	333.863	3.090	20	30		EGEDHN
C#C[C@](C)(CC)NCC(=O)N[C@H](C)c1ccc(OC(F)(F)F)cc1	ZINC000852102395	1323147335	/nfs/dbraw/zinc/14/73/35/1323147335.db2.gz	MIOZVBHUXGLBJF-MLGOLLRUSA-N	0	3	342.361	3.154	20	30		EGEDHN
C#C[C@](C)(CC)NCC(=O)N1CC=C(c2c[nH]c3ccccc32)CC1	ZINC000852100923	1323147797	/nfs/dbraw/zinc/14/77/97/1323147797.db2.gz	KZNJJMNQBDOMSB-OAQYLSRUSA-N	0	3	335.451	3.175	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@H](CN[C@H](C)c3cnccn3)C2)CC1	ZINC001024133796	1323158116	/nfs/dbraw/zinc/15/81/16/1323158116.db2.gz	OQMNTGAHJGLZTB-IAGOWNOFSA-N	0	3	342.487	3.112	20	30		EGEDHN
C=C(Br)CNC1CCC(N(C)C(=O)[C@H]2CC2(C)C)CC1	ZINC000963246286	1323255754	/nfs/dbraw/zinc/25/57/54/1323255754.db2.gz	AYHLHQAJOKWRAR-JXQTWKCFSA-N	0	3	343.309	3.300	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)c2ncoc2C)C1	ZINC000963269148	1323282896	/nfs/dbraw/zinc/28/28/96/1323282896.db2.gz	BFPJHRYZXVNQNO-GJZGRUSLSA-N	0	3	337.851	3.052	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccnn1C(CC)CC	ZINC001024480102	1323432973	/nfs/dbraw/zinc/43/29/73/1323432973.db2.gz	ZIYGBNFRYLYRQK-QGZVFWFLSA-N	0	3	332.492	3.405	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)[C@@H]1CCCC[C@@H]1C(F)(F)F	ZINC001024509097	1323458089	/nfs/dbraw/zinc/45/80/89/1323458089.db2.gz	QMURYIOERSPLEX-OAGGEKHMSA-N	0	3	344.421	3.349	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cnoc1-c1ccco1	ZINC001024511671	1323461833	/nfs/dbraw/zinc/46/18/33/1323461833.db2.gz	JNUYDMIZQGBTRI-CQSZACIVSA-N	0	3	329.400	3.095	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1cc(C)nn1C(CC)CC	ZINC001024521184	1323471054	/nfs/dbraw/zinc/47/10/54/1323471054.db2.gz	PWWHSKXYXWPPKA-SFHVURJKSA-N	0	3	344.503	3.160	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1cnc2ccccc2c1C	ZINC001024559015	1323498971	/nfs/dbraw/zinc/49/89/71/1323498971.db2.gz	RDTYZQZFTVEJKU-QGZVFWFLSA-N	0	3	335.451	3.151	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccc2c(c1)[C@H](C)CO2	ZINC001024617904	1323548046	/nfs/dbraw/zinc/54/80/46/1323548046.db2.gz	NCCRJSMWOWVOBX-WBVHZDCISA-N	0	3	328.456	3.343	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccc2nc(C)sc2c1	ZINC001024744776	1323642015	/nfs/dbraw/zinc/64/20/15/1323642015.db2.gz	FPPSVUUUAHJILE-INIZCTEOSA-N	0	3	341.480	3.212	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCCCN2Cc2ccc(C)cc2)nc1	ZINC001024763558	1323663410	/nfs/dbraw/zinc/66/34/10/1323663410.db2.gz	IZGJRUOBOHYBCU-HXUWFJFHSA-N	0	3	347.462	3.156	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccccc1OC(C)C	ZINC001024767766	1323667733	/nfs/dbraw/zinc/66/77/33/1323667733.db2.gz	IGBZOBNHQOEBTO-QGZVFWFLSA-N	0	3	328.456	3.081	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cnn(C(C)(C)C)c1CC	ZINC001024804242	1323707523	/nfs/dbraw/zinc/70/75/23/1323707523.db2.gz	QSAXMSVCDITWJH-MRXNPFEDSA-N	0	3	346.519	3.361	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccc(-c2ccccc2)[nH]1	ZINC001024825163	1323729447	/nfs/dbraw/zinc/72/94/47/1323729447.db2.gz	VEVYYASEORAAQM-GOSISDBHSA-N	0	3	335.451	3.289	20	30		EGEDHN
Cc1ccc(C(=O)N2CCCC[C@@H]2CNCc2ccc(C#N)s2)o1	ZINC001024859852	1323752731	/nfs/dbraw/zinc/75/27/31/1323752731.db2.gz	PYODMPGWNXITGN-CQSZACIVSA-N	0	3	343.452	3.306	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001024931599	1323790216	/nfs/dbraw/zinc/79/02/16/1323790216.db2.gz	IKFASMJMCQJFKT-IAGOWNOFSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCCC[C@@H]1CN[C@H](C)c1n[nH]c(CC)n1	ZINC001025039688	1323842212	/nfs/dbraw/zinc/84/22/12/1323842212.db2.gz	UYRNZTRDQKYHIX-HUUCEWRRSA-N	0	3	347.507	3.001	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)cc1F	ZINC001025040590	1323843355	/nfs/dbraw/zinc/84/33/55/1323843355.db2.gz	HFJAFXLQZXRBCT-KRWDZBQOSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCCC[C@H]1CNCc1n[nH]c(C(C)C)n1	ZINC001025069502	1323870844	/nfs/dbraw/zinc/87/08/44/1323870844.db2.gz	JTCPJJLMKIZBNX-KXBFYZLASA-N	0	3	347.507	3.001	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)Cc1cccs1	ZINC001025190919	1323970307	/nfs/dbraw/zinc/97/03/07/1323970307.db2.gz	CTPVYQQTKPLKHD-QZTJIDSGSA-N	0	3	330.497	3.159	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(OC)ns1	ZINC001025234108	1324021920	/nfs/dbraw/zinc/02/19/20/1324021920.db2.gz	FOFFPQLLGYEEQB-GJZGRUSLSA-N	0	3	349.500	3.187	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1[nH]ccc1C1CC1	ZINC001025234831	1324023029	/nfs/dbraw/zinc/02/30/29/1324023029.db2.gz	LCKWSDDGQZCNLE-RBUKOAKNSA-N	0	3	339.483	3.375	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(C)n(CC)c1C	ZINC001025247739	1324047016	/nfs/dbraw/zinc/04/70/16/1324047016.db2.gz	PNEOCXGYYXBBGW-PMACEKPBSA-N	0	3	341.499	3.217	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1snnc1CC	ZINC001025250624	1324052215	/nfs/dbraw/zinc/05/22/15/1324052215.db2.gz	MBXUQEAVRGZTOE-CVEARBPZSA-N	0	3	348.516	3.136	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(F)ccc1OC	ZINC001025254522	1324061154	/nfs/dbraw/zinc/06/11/54/1324061154.db2.gz	KDPNPEHEBBROSC-ZWKOTPCHSA-N	0	3	346.446	3.479	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCCC[C@H]2[C@@H]2CCCN2CC#CC)cc1	ZINC001025257921	1324065796	/nfs/dbraw/zinc/06/57/96/1324065796.db2.gz	GXAMKOIPXDYHMC-SFTDATJTSA-N	0	3	334.463	3.150	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccn(CC)c1C	ZINC001025263596	1324075014	/nfs/dbraw/zinc/07/50/14/1324075014.db2.gz	OMUPIZQLAAWCOZ-PMACEKPBSA-N	0	3	341.499	3.299	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc(C)c(F)c1F	ZINC001025269507	1324082056	/nfs/dbraw/zinc/08/20/56/1324082056.db2.gz	RQXIXPJYWHCSQU-IAGOWNOFSA-N	0	3	346.421	3.366	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cccc2[nH]ccc21	ZINC001025269840	1324083253	/nfs/dbraw/zinc/08/32/53/1324083253.db2.gz	XESAHWHETODROC-UXHICEINSA-N	0	3	335.451	3.260	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc2cc[nH]c2c1	ZINC001025270533	1324084906	/nfs/dbraw/zinc/08/49/06/1324084906.db2.gz	DHNXQTXSQWSVRL-UXHICEINSA-N	0	3	335.451	3.260	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1csc2cncn21	ZINC001025273265	1324089448	/nfs/dbraw/zinc/08/94/48/1324089448.db2.gz	CFKUFZIRCJRRBE-CABCVRRESA-N	0	3	344.484	3.041	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cccc(OCC)c1	ZINC001025274394	1324091596	/nfs/dbraw/zinc/09/15/96/1324091596.db2.gz	XQFJNJHICMTKNL-UXHICEINSA-N	0	3	340.467	3.178	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1nc(CC)oc1C	ZINC001025278485	1324099538	/nfs/dbraw/zinc/09/95/38/1324099538.db2.gz	SWOOFSYLLGLSHF-IRXDYDNUSA-N	0	3	343.471	3.028	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cnoc1C(C)C	ZINC001025288178	1324111276	/nfs/dbraw/zinc/11/12/76/1324111276.db2.gz	STEHFIXZYSQFGE-IRXDYDNUSA-N	0	3	331.460	3.443	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cccc(Cl)c1	ZINC001025292427	1324117278	/nfs/dbraw/zinc/11/72/78/1324117278.db2.gz	INFNRPGIAANOQN-MSOLQXFVSA-N	0	3	330.859	3.432	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc2ccccc2n1	ZINC001025292654	1324118053	/nfs/dbraw/zinc/11/80/53/1324118053.db2.gz	LCXWYURYMYLLDD-LEWJYISDSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1CCCC[C@@H]1[C@H]1CCCN1CC#CC	ZINC001025293231	1324119228	/nfs/dbraw/zinc/11/92/28/1324119228.db2.gz	QCELMIFMNKPOJH-FGZHOGPDSA-N	0	3	348.490	3.079	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cccc2cnccc21	ZINC001025296391	1324127662	/nfs/dbraw/zinc/12/76/62/1324127662.db2.gz	SVNUIGXVNCCZIE-NHCUHLMSSA-N	0	3	347.462	3.327	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1c(C)onc1CC	ZINC001025297546	1324130252	/nfs/dbraw/zinc/13/02/52/1324130252.db2.gz	YJRASTALPTVIFV-DLBZAZTESA-N	0	3	331.460	3.191	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(C(C)(C)C)cn2)C1	ZINC001025420304	1324254600	/nfs/dbraw/zinc/25/46/00/1324254600.db2.gz	AHGCFAUWZWKFBO-IAGOWNOFSA-N	0	3	341.499	3.233	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc3c(o2)CCCC3)C1	ZINC001025438765	1324278390	/nfs/dbraw/zinc/27/83/90/1324278390.db2.gz	IBFHHHOKSJLZGJ-RDJZCZTQSA-N	0	3	328.456	3.012	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(F)cc3ccoc32)C1	ZINC001025465861	1324310837	/nfs/dbraw/zinc/31/08/37/1324310837.db2.gz	WTODYSVESBHGBX-HIFRSBDPSA-N	0	3	328.387	3.035	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(F)cc3ccoc32)C1	ZINC001025465862	1324311176	/nfs/dbraw/zinc/31/11/76/1324311176.db2.gz	WTODYSVESBHGBX-UKRRQHHQSA-N	0	3	328.387	3.035	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2csc(C(F)(F)F)c2)C1	ZINC001025471725	1324316554	/nfs/dbraw/zinc/31/65/54/1324316554.db2.gz	IMPDQYFGNWGOAZ-NEPJUHHUSA-N	0	3	344.402	3.230	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc3ccccc3s2)C1	ZINC001025471456	1324317050	/nfs/dbraw/zinc/31/70/50/1324317050.db2.gz	FAXWTKSJTQTLKE-GOEBONIOSA-N	0	3	326.465	3.365	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc3c4c(cccc42)CC3)C1	ZINC001025480162	1324326434	/nfs/dbraw/zinc/32/64/34/1324326434.db2.gz	QOWJPFVVRCGYGG-VQIMIIECSA-N	0	3	346.474	3.402	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccnc3ccccc32)C1	ZINC001025480643	1324327734	/nfs/dbraw/zinc/32/77/34/1324327734.db2.gz	YTWPONWFXKLJKK-IAGOWNOFSA-N	0	3	335.451	3.088	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(-c3ccco3)o2)C1	ZINC001025482127	1324329872	/nfs/dbraw/zinc/32/98/72/1324329872.db2.gz	MELNZBLKZIQYAI-LSDHHAIUSA-N	0	3	326.396	3.003	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc3ccccc3cc2F)C1	ZINC001025482806	1324329920	/nfs/dbraw/zinc/32/99/20/1324329920.db2.gz	QORZLVTVVSGNFN-QAPCUYQASA-N	0	3	338.426	3.442	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(C)nc2C2CC2)C1	ZINC001025494610	1324345542	/nfs/dbraw/zinc/34/55/42/1324345542.db2.gz	ZBSQCJUGFHEUQG-SJLPKXTDSA-N	0	3	339.483	3.121	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc[nH]c2C2CCC2)C1	ZINC001025536899	1324383027	/nfs/dbraw/zinc/38/30/27/1324383027.db2.gz	YTAWDYOGCCDVOH-DOTOQJQBSA-N	0	3	327.472	3.136	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cccc3ccncc32)C1	ZINC001025583118	1324425328	/nfs/dbraw/zinc/42/53/28/1324425328.db2.gz	XVSJAWLPALCPLJ-SJLPKXTDSA-N	0	3	335.451	3.088	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc3sccc3[nH]2)C1	ZINC001025588772	1324432588	/nfs/dbraw/zinc/43/25/88/1324432588.db2.gz	YIEXIKZNYPXMGO-KGLIPLIRSA-N	0	3	329.469	3.083	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc3[nH]ccc3s2)C1	ZINC001025602638	1324449700	/nfs/dbraw/zinc/44/97/00/1324449700.db2.gz	JEISJYXCCWKEOE-ZIAGYGMSSA-N	0	3	329.469	3.083	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(Cl)c(Cl)c2)C1	ZINC001025607913	1324458283	/nfs/dbraw/zinc/45/82/83/1324458283.db2.gz	JFDAWZUQDOWGCG-OCCSQVGLSA-N	0	3	339.266	3.457	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2sc(CCC)nc2C)C1	ZINC001025618663	1324470780	/nfs/dbraw/zinc/47/07/80/1324470780.db2.gz	DOPHCWDCZREAGI-GOEBONIOSA-N	0	3	347.528	3.258	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(-c3ccccc3)[nH]2)C1	ZINC001025633012	1324484635	/nfs/dbraw/zinc/48/46/35/1324484635.db2.gz	RNUZTDZGDXKDAP-FUHWJXTLSA-N	0	3	335.451	3.145	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H]2CC[C@H](NCc3csc(CC)n3)[C@@H]2C1	ZINC001026328215	1324729836	/nfs/dbraw/zinc/72/98/36/1324729836.db2.gz	LLCKWBYNSLYGMB-IMJJTQAJSA-N	0	3	347.528	3.244	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H]2CC[C@H](NCc3ccccc3C#N)[C@H]2C1	ZINC001026332736	1324732862	/nfs/dbraw/zinc/73/28/62/1324732862.db2.gz	PDZKGJMYNKECBR-FHWLQOOXSA-N	0	3	337.467	3.097	20	30		EGEDHN
Cc1coc(C(=O)N2C[C@@H]3CC[C@@H](NCc4ccccc4C#N)[C@@H]3C2)c1	ZINC001026334641	1324734561	/nfs/dbraw/zinc/73/45/61/1324734561.db2.gz	LSNYPDMHBMKTPK-IPMKNSEASA-N	0	3	349.434	3.100	20	30		EGEDHN
CCC(C)(C)C(=O)N1C[C@@H]2CC[C@@H](NCc3ccccc3C#N)[C@H]2C1	ZINC001026344540	1324742204	/nfs/dbraw/zinc/74/22/04/1324742204.db2.gz	SFISTTWUGLDIEG-GBESFXJTSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=C1CC(C)(C(=O)NC2CCC(N[C@@H](C)c3cnc(C)cn3)CC2)C1	ZINC001026555890	1324892618	/nfs/dbraw/zinc/89/26/18/1324892618.db2.gz	QMBCTDZLDNKOTA-GTPINHCMSA-N	0	3	342.487	3.219	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC[C@H](CNCc2cc(Cl)sc2Cl)C1	ZINC001026732525	1324995804	/nfs/dbraw/zinc/99/58/04/1324995804.db2.gz	KDMRRWFMHVTOGD-VHSXEESVSA-N	0	3	346.283	3.153	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@H]1CCN(C(=O)CCC2CCC2)C1	ZINC001026759546	1325006787	/nfs/dbraw/zinc/00/67/87/1325006787.db2.gz	KBYUZFAPWBJYPS-MRXNPFEDSA-N	0	3	343.446	3.216	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)C(F)=C2CCCC2)C1	ZINC001026777712	1325017854	/nfs/dbraw/zinc/01/78/54/1325017854.db2.gz	GBFJVMMBTVQUKM-HNNXBMFYSA-N	0	3	341.430	3.294	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)c2c(C)ccn2C)C1	ZINC000963291897	1325077657	/nfs/dbraw/zinc/07/76/57/1325077657.db2.gz	AEPKATLNSSWLLZ-IRXDYDNUSA-N	0	3	349.906	3.403	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)c2ccncc2C)C1	ZINC000963291092	1325077923	/nfs/dbraw/zinc/07/79/23/1325077923.db2.gz	SCOQYGYLPXGKIV-FUHWJXTLSA-N	0	3	347.890	3.459	20	30		EGEDHN
CCC1(C(=O)N2CC[C@@H](CNCc3cc(F)ccc3C#N)C2)CCC1	ZINC001027004116	1325144202	/nfs/dbraw/zinc/14/42/02/1325144202.db2.gz	KBDBLYWSUQEUOC-HNNXBMFYSA-N	0	3	343.446	3.216	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)c2cccs2)C1	ZINC001027281818	1325407933	/nfs/dbraw/zinc/40/79/33/1325407933.db2.gz	ZSFXANSSLWBLPP-QGZVFWFLSA-N	0	3	339.464	3.356	20	30		EGEDHN
N#CCCc1ccc(NC(=O)Nc2ccc3c(c2)OCCNC3)cc1	ZINC000926183929	1325460139	/nfs/dbraw/zinc/46/01/39/1325460139.db2.gz	POUBTUIBWFPKSA-UHFFFAOYSA-N	0	3	336.395	3.269	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)c(F)c2)C1)C1CC1	ZINC001027352545	1325522314	/nfs/dbraw/zinc/52/23/14/1325522314.db2.gz	XCGKOVFUNPJDSE-RDTXWAMCSA-N	0	3	343.446	3.166	20	30		EGEDHN
CN(Cc1ccc(C#N)c(F)c1)[C@H]1CCCN(C(=O)C2=CCCC2)C1	ZINC001027367472	1325559183	/nfs/dbraw/zinc/55/91/83/1325559183.db2.gz	CARSPWNQIYYTKL-SFHVURJKSA-N	0	3	341.430	3.230	20	30		EGEDHN
CN(Cc1ccc(F)c(C#N)c1)[C@@H]1CCCN(C(=O)[C@H]2CC2(C)C)C1	ZINC001027373061	1325566483	/nfs/dbraw/zinc/56/64/83/1325566483.db2.gz	FHHSCRZWFVURED-IAGOWNOFSA-N	0	3	343.446	3.166	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)[C@@H]2CC[C@H](F)C2)CC1	ZINC001034719762	1342713402	/nfs/dbraw/zinc/71/34/02/1342713402.db2.gz	XOKBNNCAJZWJIP-XJFOESAGSA-N	0	3	347.272	3.050	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)C[C@@H](C)c2ccco2)cc1	ZINC000860472957	1329321778	/nfs/dbraw/zinc/32/17/78/1329321778.db2.gz	QSLHYMOSZKJJPA-IUODEOHRSA-N	0	3	326.352	3.129	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)[C@@H]1[C@H](C)O[C@@H](C)[C@H]1C)c1ccccc1	ZINC000860695938	1329345350	/nfs/dbraw/zinc/34/53/50/1329345350.db2.gz	WVPQBBCRWNCCAW-SKUOUFDCSA-N	0	3	342.439	3.022	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC001027467762	1327722587	/nfs/dbraw/zinc/72/25/87/1327722587.db2.gz	UHIJDQJQWAGAHC-NRFANRHFSA-N	0	3	347.462	3.224	20	30		EGEDHN
C[C@H]1C[C@@H]1CC(=O)NC1CC2(CC(NCc3ccccc3C#N)C2)C1	ZINC000964853836	1327731261	/nfs/dbraw/zinc/73/12/61/1327731261.db2.gz	QIPNCXZFBHNIMQ-YJJFQATDSA-N	0	3	337.467	3.121	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)[C@@H]2CCC2(C)C)C1	ZINC001027534653	1327824952	/nfs/dbraw/zinc/82/49/52/1327824952.db2.gz	BFKDULXKPGTXGC-OALUTQOASA-N	0	3	339.483	3.417	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)[C@H]2CCC2(C)C)C1	ZINC001027535528	1327825671	/nfs/dbraw/zinc/82/56/71/1327825671.db2.gz	HZSYEDYLQGYPEQ-RTBURBONSA-N	0	3	339.483	3.417	20	30		EGEDHN
N#Cc1ccc(NCCN[C@@H]2CCCOc3cc(F)ccc32)nc1	ZINC000927166521	1327903004	/nfs/dbraw/zinc/90/30/04/1327903004.db2.gz	ZDBNFAJKCJYNTQ-MRXNPFEDSA-N	0	3	326.375	3.008	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)Cc2ccc(C(C)(C)C)cc2)C1	ZINC001027597446	1327947810	/nfs/dbraw/zinc/94/78/10/1327947810.db2.gz	KQFRCYZARZUGBJ-IBGZPJMESA-N	0	3	326.484	3.083	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCC[C@@H](N(C)Cc2ccc(F)c(C#N)c2)C1	ZINC001027602814	1327955233	/nfs/dbraw/zinc/95/52/33/1327955233.db2.gz	FGUOGOAQCGAGHM-MAUKXSAKSA-N	0	3	345.462	3.412	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2cscc2C(F)F)C1	ZINC000966165161	1328211196	/nfs/dbraw/zinc/21/11/96/1328211196.db2.gz	DLYFSYKATFULTQ-SMDDNHRTSA-N	0	3	326.412	3.149	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2cc(C)c(OC)c(C)c2)C1	ZINC000966303000	1328263310	/nfs/dbraw/zinc/26/33/10/1328263310.db2.gz	XJWPZUFLMMEZDR-KDOFPFPSSA-N	0	3	330.472	3.328	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2cc3ccncc3s2)C1	ZINC000966667290	1328371419	/nfs/dbraw/zinc/37/14/19/1328371419.db2.gz	NPOBEARCNCQYFP-DZGCQCFKSA-N	0	3	329.469	3.313	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1ccnc(-c2ccco2)c1	ZINC001027955444	1328424155	/nfs/dbraw/zinc/42/41/55/1328424155.db2.gz	BXBVAXCGZVSYTM-INIZCTEOSA-N	0	3	325.412	3.112	20	30		EGEDHN
COc1ccccc1NC(=O)[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC000932635564	1329829893	/nfs/dbraw/zinc/82/98/93/1329829893.db2.gz	KROVRNGLEYCPPA-SFHVURJKSA-N	0	3	349.434	3.418	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc3c(c2)C[C@H](C)O3)CC1	ZINC000933154133	1329867534	/nfs/dbraw/zinc/86/75/34/1329867534.db2.gz	AHDWDTRARJIAKW-AWEZNQCLSA-N	0	3	329.444	3.172	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2cccc(Cl)c2Cl)CC1	ZINC001052891152	1348727252	/nfs/dbraw/zinc/72/72/52/1348727252.db2.gz	LKKJNUGZNNRVQP-LBPRGKRZSA-N	0	3	325.239	3.211	20	30		EGEDHN
CC(C)(C)C(=O)N[C@H]1CCN(Cc2ccc(C#N)cc2)CC1(C)C	ZINC000941177376	1331370590	/nfs/dbraw/zinc/37/05/90/1331370590.db2.gz	KYYAFRRZTUOVOO-KRWDZBQOSA-N	0	3	327.472	3.321	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3ccccc3nc2C)[C@H](C)C1	ZINC000942107174	1331833369	/nfs/dbraw/zinc/83/33/69/1331833369.db2.gz	UYCBGRPTBXBJFK-DNVCBOLYSA-N	0	3	335.451	3.007	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CCN(Cc2ccsc2)C[C@H]1C	ZINC000942128128	1331841427	/nfs/dbraw/zinc/84/14/27/1331841427.db2.gz	CDKWFYRVRMTYSO-NVXWUHKLSA-N	0	3	343.496	3.376	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccccc2C(C)(C)C)[C@@H](C)C1	ZINC000942164442	1331855527	/nfs/dbraw/zinc/85/55/27/1331855527.db2.gz	RUKWBUYUVRVXFH-QFBILLFUSA-N	0	3	326.484	3.448	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc(CCCC)cc2)[C@H](C)C1	ZINC000942270846	1331892520	/nfs/dbraw/zinc/89/25/20/1331892520.db2.gz	GHRHKJZKPZZMOC-WIYYLYMNSA-N	0	3	340.511	3.422	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(Cc3cncc(C)c3)C[C@H]2C)cc1	ZINC000942552482	1331970588	/nfs/dbraw/zinc/97/05/88/1331970588.db2.gz	FWIJCWXDXCPESK-DYESRHJHSA-N	0	3	347.462	3.012	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3ccsc3)C[C@@H]2C)cc1	ZINC000942553065	1331970718	/nfs/dbraw/zinc/97/07/18/1331970718.db2.gz	MBMZUDBDCFKHKN-KXBFYZLASA-N	0	3	338.476	3.370	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc3cccc(OC)c3o2)[C@@H](C)C1	ZINC000942581962	1331988440	/nfs/dbraw/zinc/98/84/40/1331988440.db2.gz	PXOIEPAGUGACKQ-ZFWWWQNUSA-N	0	3	328.412	3.068	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCN(CCc3ccns3)C[C@@H]2C)CC1	ZINC000942599989	1331996886	/nfs/dbraw/zinc/99/68/86/1331996886.db2.gz	IOXKVFYEBILTLP-YJBOKZPZSA-N	0	3	347.528	3.259	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3cncc(C)c3)C[C@@H]2C)C1	ZINC000942601898	1331998035	/nfs/dbraw/zinc/99/80/35/1331998035.db2.gz	AINURTMNLJNTDV-WMZOPIPTSA-N	0	3	327.472	3.073	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3cncc(C)c3)C[C@H]2C)C1	ZINC000942601895	1331998473	/nfs/dbraw/zinc/99/84/73/1331998473.db2.gz	AINURTMNLJNTDV-AEFFLSMTSA-N	0	3	327.472	3.073	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(-c3ccccc3)o2)[C@H](C)C1	ZINC000942937192	1332062415	/nfs/dbraw/zinc/06/24/15/1332062415.db2.gz	HTJQHAVOLCPLNX-AEFFLSMTSA-N	0	3	336.435	3.410	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C(C)(C)C)oc2C)[C@@H](C)C1	ZINC000943029857	1332084647	/nfs/dbraw/zinc/08/46/47/1332084647.db2.gz	UKSABSCGRJNLBK-YOEHRIQHSA-N	0	3	330.472	3.349	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccc3nc(C)sc3c2)[C@@H](C)C1	ZINC000943985994	1332303563	/nfs/dbraw/zinc/30/35/63/1332303563.db2.gz	CCYMCFSSFJDFPQ-SWLSCSKDSA-N	0	3	329.469	3.231	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccc3nc(C)sc3c2)[C@H](C)C1	ZINC000943985993	1332303620	/nfs/dbraw/zinc/30/36/20/1332303620.db2.gz	CCYMCFSSFJDFPQ-IUODEOHRSA-N	0	3	329.469	3.231	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2)[C@@H](C)C1	ZINC000944282326	1332363156	/nfs/dbraw/zinc/36/31/56/1332363156.db2.gz	VLEMBZGINZOTDF-XJKSGUPXSA-N	0	3	338.373	3.169	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc(Cl)cc(Cl)c2)[C@@H](C)C1	ZINC000944303329	1332367479	/nfs/dbraw/zinc/36/74/79/1332367479.db2.gz	CAEJWRAISJOKQU-NHYWBVRUSA-N	0	3	325.239	3.067	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(Cl)ccc2Cl)[C@H](C)C1	ZINC000944305249	1332368207	/nfs/dbraw/zinc/36/82/07/1332368207.db2.gz	LRPUTMDOKRJHRT-MLGOLLRUSA-N	0	3	339.266	3.457	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccsc2C(F)F)[C@@H](C)C1	ZINC000944535782	1332415764	/nfs/dbraw/zinc/41/57/64/1332415764.db2.gz	ZBMJFEDGLSGAKW-WCQYABFASA-N	0	3	326.412	3.149	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2c[nH]c3c2cccc3CC)[C@H](C)C1	ZINC000945180129	1332526381	/nfs/dbraw/zinc/52/63/81/1332526381.db2.gz	KRWUSTMCGICUFT-BEFAXECRSA-N	0	3	337.467	3.194	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2coc(C3CCCCC3)n2)[C@H](C)C1	ZINC000945334227	1332559094	/nfs/dbraw/zinc/55/90/94/1332559094.db2.gz	MHSKMWMCRDPPCO-ZBFHGGJFSA-N	0	3	331.460	3.349	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cscc2C(F)(F)F)[C@H](C)C1	ZINC000946315478	1332786688	/nfs/dbraw/zinc/78/66/88/1332786688.db2.gz	XCYJZKQOWYLSIG-MFKMUULPSA-N	0	3	332.391	3.393	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H]2CCN(Cc3ccc(C#N)cc3)[C@H](C)C2)o1	ZINC000947025495	1332978918	/nfs/dbraw/zinc/97/89/18/1332978918.db2.gz	DZLMVPPZQPMHQY-KDOFPFPSSA-N	0	3	337.423	3.243	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)c2ccsc2)CCN1Cc1ccc(C#N)cc1	ZINC000947026358	1332979083	/nfs/dbraw/zinc/97/90/83/1332979083.db2.gz	LILCTNJQCVCNRO-KBXCAEBGSA-N	0	3	339.464	3.403	20	30		EGEDHN
Cc1occc1C(=O)N[C@H]1CCN(Cc2ccc(C#N)cc2)[C@H](C)C1	ZINC000947032546	1332982626	/nfs/dbraw/zinc/98/26/26/1332982626.db2.gz	PPEKEOZUKKKGKV-KDOFPFPSSA-N	0	3	337.423	3.243	20	30		EGEDHN
Cc1cccnc1C(=O)N[C@H]1CCN(Cc2ccc(C#N)cc2)[C@H](C)C1	ZINC000947156496	1333027848	/nfs/dbraw/zinc/02/78/48/1333027848.db2.gz	DSVQFTGZMSTYQU-APWZRJJASA-N	0	3	348.450	3.045	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(F)cc3ccoc32)C[C@@H]1C	ZINC000947468334	1333140656	/nfs/dbraw/zinc/14/06/56/1333140656.db2.gz	IQCBTCGVEAFELZ-XJKSGUPXSA-N	0	3	328.387	3.178	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C)c(Cl)c2F)C[C@@H]1C	ZINC000947569274	1333175321	/nfs/dbraw/zinc/17/53/21/1333175321.db2.gz	VFAIKQHVFWSARG-KBPBESRZSA-N	0	3	336.838	3.394	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(F)c(Cl)cc2F)C[C@H]1C	ZINC000947674992	1333217943	/nfs/dbraw/zinc/21/79/43/1333217943.db2.gz	DPKIDFAAGMXRQI-GHMZBOCLSA-N	0	3	328.790	3.387	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)C2(C)CC=CC2)CCN1Cc1cccc(C#N)c1	ZINC000947694431	1333228941	/nfs/dbraw/zinc/22/89/41/1333228941.db2.gz	XXLVKRDUQYGOJV-QFBILLFUSA-N	0	3	337.467	3.384	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnc(-c3ccoc3)s2)C[C@H]1C	ZINC000947778366	1333258552	/nfs/dbraw/zinc/25/85/52/1333258552.db2.gz	BROKSPPMGHTXPR-OCCSQVGLSA-N	0	3	331.441	3.172	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cccc3sccc32)C[C@@H]1C	ZINC000947778410	1333258682	/nfs/dbraw/zinc/25/86/82/1333258682.db2.gz	CJVGVRQAGUPOND-RDJZCZTQSA-N	0	3	340.492	3.436	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2c[nH]c3cc(C)ccc23)C[C@@H]1C	ZINC000947800233	1333265253	/nfs/dbraw/zinc/26/52/53/1333265253.db2.gz	GYIDYGCIZLDMLY-FUHWJXTLSA-N	0	3	337.467	3.011	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(F)c3ncccc3c2)C[C@H]1C	ZINC000947809405	1333267168	/nfs/dbraw/zinc/26/71/68/1333267168.db2.gz	BZCSFDYILBNGCD-CZUORRHYSA-N	0	3	327.403	3.143	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccccc2OCC(C)C)C[C@H]1C	ZINC000947818892	1333270400	/nfs/dbraw/zinc/27/04/00/1333270400.db2.gz	BPBXQVRDMMLTPF-IAGOWNOFSA-N	0	3	330.472	3.490	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2csc(-c3ccoc3)n2)C[C@@H]1C	ZINC000947820248	1333271162	/nfs/dbraw/zinc/27/11/62/1333271162.db2.gz	JUFITMONJNXSTO-DZGCQCFKSA-N	0	3	343.452	3.009	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ncc(Cl)cc2Cl)C[C@@H]1C	ZINC000947857164	1333281847	/nfs/dbraw/zinc/28/18/47/1333281847.db2.gz	HPJNPPQDROAGQQ-JQWIXIFHSA-N	0	3	328.243	3.157	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2sc(CC3CC3)nc2C)C[C@@H]1C	ZINC000947861459	1333284478	/nfs/dbraw/zinc/28/44/78/1333284478.db2.gz	MSJCVRSIVKQTIE-XJKSGUPXSA-N	0	3	345.512	3.010	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccccc2C(F)(F)F)C[C@H]1C	ZINC000947962062	1333321651	/nfs/dbraw/zinc/32/16/51/1333321651.db2.gz	JEMWEUIWCANMPT-CHWSQXEVSA-N	0	3	326.362	3.474	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)CC23CC4CC(CC(C4)C2)C3)C[C@H]1C	ZINC000947966499	1333323721	/nfs/dbraw/zinc/32/37/21/1333323721.db2.gz	BZAWGDHGECXZNN-CYSNLQCGSA-N	0	3	328.500	3.195	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(OC(C)C)cc2)C[C@H]1C	ZINC000948003070	1333339328	/nfs/dbraw/zinc/33/93/28/1333339328.db2.gz	XULDSQGJTXUHCB-AEFFLSMTSA-N	0	3	328.456	3.080	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(F)c3occc32)C[C@@H]1C	ZINC000948044291	1333352023	/nfs/dbraw/zinc/35/20/23/1333352023.db2.gz	OUPJDKIPPRETIF-KBPBESRZSA-N	0	3	328.387	3.178	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cccc3c2OCC3(C)C)C[C@@H]1C	ZINC000948104283	1333375040	/nfs/dbraw/zinc/37/50/40/1333375040.db2.gz	KZGCSBGHFAPSME-LSDHHAIUSA-N	0	3	328.456	3.125	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cscc2C(F)(F)F)C[C@@H]1C	ZINC000948105215	1333375914	/nfs/dbraw/zinc/37/59/14/1333375914.db2.gz	SFHPAYBVAKWZJU-RYUDHWBXSA-N	0	3	344.402	3.373	20	30		EGEDHN
CN(C(=O)C(C)(F)F)[C@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948133295	1333385645	/nfs/dbraw/zinc/38/56/45/1333385645.db2.gz	WONFBUUEYKGNNY-INIZCTEOSA-N	0	3	335.398	3.026	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2[nH]c3ccccc3c2Cl)CC1	ZINC000948583495	1333584645	/nfs/dbraw/zinc/58/46/45/1333584645.db2.gz	SJFHHQLEJNDTLD-AWEZNQCLSA-N	0	3	343.858	3.381	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cccc3cccnc32)CC1	ZINC000948586316	1333586210	/nfs/dbraw/zinc/58/62/10/1333586210.db2.gz	GDIRUKMPPCXWPB-GOSISDBHSA-N	0	3	335.451	3.185	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)C2(c3ccccc3)CCC2)CC1	ZINC000948602528	1333592320	/nfs/dbraw/zinc/59/23/20/1333592320.db2.gz	NJUVRTSYAWYAIL-FQEVSTJZSA-N	0	3	338.495	3.445	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2c(F)cc(C)cc2F)CC1	ZINC000948605225	1333593698	/nfs/dbraw/zinc/59/36/98/1333593698.db2.gz	NNJMUEYPAYUWME-HNNXBMFYSA-N	0	3	334.410	3.223	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)[C@H]2CCc3c2cccc3Cl)CC1	ZINC000948621078	1333599541	/nfs/dbraw/zinc/59/95/41/1333599541.db2.gz	LQILIZRQVWAJBN-QAPCUYQASA-N	0	3	344.886	3.316	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)[C@H]2CCCC(F)(F)C2)CC1	ZINC000948766153	1333668789	/nfs/dbraw/zinc/66/87/89/1333668789.db2.gz	HFWYFOYZHUFNJG-JKSUJKDBSA-N	0	3	326.431	3.148	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2ccc(C(C)C)nc2CC)CC1	ZINC000948779530	1333676426	/nfs/dbraw/zinc/67/64/26/1333676426.db2.gz	OMLYSTDLCBUNCG-QGZVFWFLSA-N	0	3	341.499	3.327	20	30		EGEDHN
CN(C(=O)[C@@H]1CC12CC2)[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948809081	1333690537	/nfs/dbraw/zinc/69/05/37/1333690537.db2.gz	LTHAZYYIMYJFRN-MOPGFXCFSA-N	0	3	337.467	3.171	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cnc3ccccc3c2)CC1	ZINC000948812933	1333693540	/nfs/dbraw/zinc/69/35/40/1333693540.db2.gz	OUHRFOLMEPMPPG-LJQANCHMSA-N	0	3	335.451	3.185	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)Cc2ccc(CC)cc2)CC1	ZINC000948816952	1333696149	/nfs/dbraw/zinc/69/61/49/1333696149.db2.gz	QDNMSDZNGFCODD-FQEVSTJZSA-N	0	3	326.484	3.128	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)C2(c3cccc(F)c3)CC2)CC1	ZINC000948820603	1333697639	/nfs/dbraw/zinc/69/76/39/1333697639.db2.gz	NILAXLAKKHFYGA-IBGZPJMESA-N	0	3	342.458	3.194	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccc(C)c(C)c2)CC1	ZINC000948840781	1333705295	/nfs/dbraw/zinc/70/52/95/1333705295.db2.gz	MLYXQOCULVQNCA-PCCBWWKXSA-N	0	3	338.495	3.353	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2scnc2C(C)C)CC1	ZINC000948840324	1333705360	/nfs/dbraw/zinc/70/53/60/1333705360.db2.gz	FMSGJCLCBDPNGO-OAHLLOKOSA-N	0	3	333.501	3.216	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2ccc(-c3ccccc3)nc2)CC1	ZINC000948887144	1333719308	/nfs/dbraw/zinc/71/93/08/1333719308.db2.gz	WPWQAKKNBZOWEH-FQEVSTJZSA-N	0	3	347.462	3.308	20	30		EGEDHN
N#Cc1c[nH]c(C(=O)NC[C@H]2c3ccccc3CCN2CC2CCC2)c1	ZINC000948901787	1333725480	/nfs/dbraw/zinc/72/54/80/1333725480.db2.gz	CXTUHQZAHXSKEG-FQEVSTJZSA-N	0	3	348.450	3.016	20	30		EGEDHN
N#Cc1ccc(C(=O)NC[C@H]2c3ccccc3CCN2CCC2CC2)[nH]1	ZINC000948909807	1333729616	/nfs/dbraw/zinc/72/96/16/1333729616.db2.gz	BDQFCQOEMHOQGI-FQEVSTJZSA-N	0	3	348.450	3.016	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@H]1CNC(=O)c1cc[nH]c1CC	ZINC000948913576	1333732433	/nfs/dbraw/zinc/73/24/33/1333732433.db2.gz	VLBXTNCBFULZMW-HXUWFJFHSA-N	0	3	337.467	3.482	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@@H]1CNC(=O)c1cc(F)c[nH]1	ZINC000948936386	1333740658	/nfs/dbraw/zinc/74/06/58/1333740658.db2.gz	PIRNLIIWYWXIPK-IBGZPJMESA-N	0	3	341.430	3.449	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2c3ccccc3CCN2CC(C)C)nc1	ZINC000948978048	1333754204	/nfs/dbraw/zinc/75/42/04/1333754204.db2.gz	HFBXMXCTBBPNSS-NRFANRHFSA-N	0	3	347.462	3.048	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@]1(C)CC[C@H](C)C1(C)C)CCO2	ZINC000949205552	1333796235	/nfs/dbraw/zinc/79/62/35/1333796235.db2.gz	XKOYTDKTLKWLNI-PXNSSMCTSA-N	0	3	348.531	3.328	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1(CC)CCCCC1)CCO2	ZINC000949247591	1333802993	/nfs/dbraw/zinc/80/29/93/1333802993.db2.gz	AEOLBDWIKFUKJO-UHFFFAOYSA-N	0	3	334.504	3.226	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)c3ccccc3F)CC2)C1	ZINC000949282509	1333814280	/nfs/dbraw/zinc/81/42/80/1333814280.db2.gz	KPAWCTZFTURFLX-UHFFFAOYSA-N	0	3	346.446	3.099	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@H]3CCCC3(C)C)CC2)C1	ZINC000949445298	1333849211	/nfs/dbraw/zinc/84/92/11/1333849211.db2.gz	WFXMSDQRHBXHFM-GOSISDBHSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3cc(C)cc(C)c3)CC2)C1	ZINC000949518383	1333865681	/nfs/dbraw/zinc/86/56/81/1333865681.db2.gz	VDIFNVXWTBGFCC-UHFFFAOYSA-N	0	3	342.483	3.187	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2c(C)c(F)ccc2Cl)C1	ZINC000967032754	1335646652	/nfs/dbraw/zinc/64/66/52/1335646652.db2.gz	OKMGBSZNXBAHJI-LRDDRELGSA-N	0	3	336.838	3.251	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)C(C)(C)C(F)(F)F)C12CCC2	ZINC001203642183	1370198752	/nfs/dbraw/zinc/19/87/52/1370198752.db2.gz	XAEUQKWTCBSUDW-MNOVXSKESA-N	0	3	338.801	3.344	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2cc(C)c(C)cc2Cl)C1	ZINC000967779473	1335815781	/nfs/dbraw/zinc/81/57/81/1335815781.db2.gz	NNEJFABIAMDWSY-SCLBCKFNSA-N	0	3	332.875	3.420	20	30		EGEDHN
C=C(C)CCN1CC[C@H](C)[C@@H](NC(=O)c2nc(Cl)cs2)C1	ZINC000968016715	1335844515	/nfs/dbraw/zinc/84/45/15/1335844515.db2.gz	MEKUHMHLVARUKT-RYUDHWBXSA-N	0	3	327.881	3.203	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CN(CCc3cccs3)CC[C@@H]2C)C1	ZINC000968277160	1335883605	/nfs/dbraw/zinc/88/36/05/1335883605.db2.gz	YAQQSBRAZSGPHZ-RDJZCZTQSA-N	0	3	332.513	3.474	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)Cc2c[nH]c3cc(C)ccc23)C1	ZINC000968405700	1335922521	/nfs/dbraw/zinc/92/25/21/1335922521.db2.gz	PMQSERUKTPUVJM-UZLBHIALSA-N	0	3	339.483	3.422	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccc(OC)c(C3CC3)c2)C1	ZINC000968484715	1335937171	/nfs/dbraw/zinc/93/71/71/1335937171.db2.gz	TXHFPMJBKQOPJB-DNVCBOLYSA-N	0	3	340.467	3.036	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cccc3ccsc32)C1	ZINC000968506374	1335946422	/nfs/dbraw/zinc/94/64/22/1335946422.db2.gz	SMXOOSQARVCZDV-PBHICJAKSA-N	0	3	326.465	3.365	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)Cc2c(C)nn(C(C)C)c2C)C1	ZINC000968528916	1335954587	/nfs/dbraw/zinc/95/45/87/1335954587.db2.gz	INNYTIBWOIJZOV-DNVCBOLYSA-N	0	3	346.519	3.026	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2ccc(Cl)cc2Cl)C1	ZINC000968578651	1335969368	/nfs/dbraw/zinc/96/93/68/1335969368.db2.gz	GZFUHOZXVVDVGX-BLLLJJGKSA-N	0	3	339.266	3.457	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)C2(c3ccc(Cl)cc3)CC2)C1	ZINC000968624812	1335988335	/nfs/dbraw/zinc/98/83/35/1335988335.db2.gz	ZOAWSSYTAPWPKM-YJBOKZPZSA-N	0	3	344.886	3.222	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccc(CC(C)C)cc2)C1	ZINC000968628531	1335990553	/nfs/dbraw/zinc/99/05/53/1335990553.db2.gz	ZZKGSBJHQHNIAM-YLJYHZDGSA-N	0	3	326.484	3.349	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2c[nH]c3ccc(F)cc23)C1	ZINC000968700670	1336017675	/nfs/dbraw/zinc/01/76/75/1336017675.db2.gz	AGESJPBLWJCBCR-ACJLOTCBSA-N	0	3	329.419	3.323	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)C2(c3ccccc3C)CC2)C1	ZINC000968706759	1336018768	/nfs/dbraw/zinc/01/87/68/1336018768.db2.gz	UIPXBIMLKMUMTB-MJGOQNOKSA-N	0	3	326.484	3.429	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H](NCc2ccnc(Cl)c2)C1	ZINC000968795070	1336054490	/nfs/dbraw/zinc/05/44/90/1336054490.db2.gz	FDORBBQEUITOGH-CYBMUJFWSA-N	0	3	342.270	3.204	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1nsc2ccccc21	ZINC000968869274	1336073083	/nfs/dbraw/zinc/07/30/83/1336073083.db2.gz	LGQJOSURKQDLFH-CQSZACIVSA-N	0	3	329.469	3.457	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)NC[C@H]1CCCCCN1Cc1ccc(C#N)cc1	ZINC000968987497	1336110504	/nfs/dbraw/zinc/11/05/04/1336110504.db2.gz	AZBYYDIQFGVLHX-IPELMVKDSA-N	0	3	325.456	3.075	20	30		EGEDHN
C#CCCN1CCCCC[C@H]1CNC(=O)c1oc(C(C)C)nc1C	ZINC000969061844	1336134116	/nfs/dbraw/zinc/13/41/16/1336134116.db2.gz	FFZIIMNKHFTFSR-INIZCTEOSA-N	0	3	331.460	3.104	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)C1CCC(C(F)F)CC1	ZINC000969133417	1336155262	/nfs/dbraw/zinc/15/52/62/1336155262.db2.gz	LVXPCKKSYJBIMQ-JCYILVPMSA-N	0	3	340.458	3.442	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccc(OC)c(OCC)c1	ZINC000969138990	1336158029	/nfs/dbraw/zinc/15/80/29/1336158029.db2.gz	GHDSIYXKOVEVJW-KRWDZBQOSA-N	0	3	346.471	3.254	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1cc(C)n(C(C)(C)C)n1	ZINC000969144776	1336161205	/nfs/dbraw/zinc/16/12/05/1336161205.db2.gz	SXHCXLPTOPBFAN-KRWDZBQOSA-N	0	3	346.519	3.497	20	30		EGEDHN
C#CCCN1CCCCC[C@H]1CNC(=O)c1cnc(CC(C)C)s1	ZINC000969161423	1336168044	/nfs/dbraw/zinc/16/80/44/1336168044.db2.gz	WFWRCXKMWPDDOW-INIZCTEOSA-N	0	3	347.528	3.339	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cc(NC(C)=O)ccc1C	ZINC000969165475	1336169421	/nfs/dbraw/zinc/16/94/21/1336169421.db2.gz	YXKXIUCTLURIKO-SFHVURJKSA-N	0	3	343.471	3.114	20	30		EGEDHN
N#Cc1cc(CN[C@@H]2CCN(C(=O)C[C@@H]3CC=CCC3)C2)ccc1F	ZINC000969599000	1336226787	/nfs/dbraw/zinc/22/67/87/1336226787.db2.gz	ZJYWNWZMDGNFIJ-CRAIPNDOSA-N	0	3	341.430	3.134	20	30		EGEDHN
CC1(C)CCC[C@H]1C(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC000969622048	1336229926	/nfs/dbraw/zinc/22/99/26/1336229926.db2.gz	FGWPLTINLSXILX-SJORKVTESA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](NCc3ccc(Cl)c(OC)c3)C2)C1	ZINC000969884610	1336257133	/nfs/dbraw/zinc/25/71/33/1336257133.db2.gz	KUZWJTIEKDWDEZ-OAHLLOKOSA-N	0	3	348.874	3.395	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@@H](C)C2CN(CC=C(C)C)C2)cc1	ZINC000969989407	1336269318	/nfs/dbraw/zinc/26/93/18/1336269318.db2.gz	OKFPHWZDAWSPOK-INIZCTEOSA-N	0	3	328.456	3.268	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)c2cnc3c(F)cccc3c2)C1	ZINC000970167957	1336287598	/nfs/dbraw/zinc/28/75/98/1336287598.db2.gz	RYGKHOOUMLRMBF-ZDUSSCGKSA-N	0	3	327.403	3.000	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)c2ccc(O[C@H](C)CC)cc2)C1	ZINC000970708572	1336334636	/nfs/dbraw/zinc/33/46/36/1336334636.db2.gz	NRARPWHMEOUHFR-HZPDHXFCSA-N	0	3	330.472	3.490	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)c2ccc(N(CC)CC)cc2)C1	ZINC000970794267	1336338137	/nfs/dbraw/zinc/33/81/37/1336338137.db2.gz	DOLSUBGKDGWBMS-INIZCTEOSA-N	0	3	329.488	3.159	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2oc3ccccc3c2OC)CC1	ZINC001005810644	1336403634	/nfs/dbraw/zinc/40/36/34/1336403634.db2.gz	CVYDKCXRENVNBL-UHFFFAOYSA-N	0	3	328.412	3.164	20	30		EGEDHN
C[C@@H]1CC[C@@H](C(=O)N(C)C2CCN(Cc3ccc(C#N)cc3)CC2)C1	ZINC001006082074	1336448782	/nfs/dbraw/zinc/44/87/82/1336448782.db2.gz	JXALLSMNSKBIKR-VQIMIIECSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cc(F)cc3cccnc32)CC1	ZINC001006087154	1336450404	/nfs/dbraw/zinc/45/04/04/1336450404.db2.gz	OKMRYMJSAKEUHG-UHFFFAOYSA-N	0	3	341.430	3.486	20	30		EGEDHN
CC[C@]1(C)C[C@@H]1C(=O)N(C)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001006224486	1336470664	/nfs/dbraw/zinc/47/06/64/1336470664.db2.gz	JUEDHTMKRXDBCB-TZIWHRDSSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=CCOc1cccnc1C(=O)N(C)C1CCN(CC=C(C)C)CC1	ZINC001006267580	1336478659	/nfs/dbraw/zinc/47/86/59/1336478659.db2.gz	RMZKWQVSRKYJOV-UHFFFAOYSA-N	0	3	343.471	3.149	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccc(OC)c(Cl)c2)CC1	ZINC001006384877	1336498377	/nfs/dbraw/zinc/49/83/77/1336498377.db2.gz	QIRAXZCEAUVCHV-UHFFFAOYSA-N	0	3	336.863	3.461	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)[C@H]2C[C@@H]2c2cc(F)ccc2F)CC1	ZINC001006429517	1336504278	/nfs/dbraw/zinc/50/42/78/1336504278.db2.gz	POGSUJHAIZKRDM-WBVHZDCISA-N	0	3	334.410	3.177	20	30		EGEDHN
Cc1cccc([C@H](C)N2CCC[C@H](NC(=O)c3cc(C#N)c[nH]3)C2)c1	ZINC001007030019	1336628902	/nfs/dbraw/zinc/62/89/02/1336628902.db2.gz	PNEPUWKDHHNOJO-YJBOKZPZSA-N	0	3	336.439	3.150	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2cc(C3CCCCC3)n[nH]2)C1	ZINC001007512294	1336661402	/nfs/dbraw/zinc/66/14/02/1336661402.db2.gz	GQGAMAAHUDZNFZ-MRXNPFEDSA-N	0	3	330.476	3.228	20	30		EGEDHN
C=C(C)CCN1CCC[C@H](NC(=O)c2cc3ncccc3s2)C1	ZINC001008185900	1336787638	/nfs/dbraw/zinc/78/76/38/1336787638.db2.gz	YINXKDNLQBIRIJ-AWEZNQCLSA-N	0	3	329.469	3.457	20	30		EGEDHN
C#CCCN1CCC[C@H](NC(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2)C1	ZINC001008798219	1336926746	/nfs/dbraw/zinc/92/67/46/1336926746.db2.gz	HWJSICYCJVKRTE-OKZBNKHCSA-N	0	3	330.859	3.047	20	30		EGEDHN
C=C(C)CCN1CCC[C@H](NC(=O)c2ccoc2Br)C1	ZINC001009102285	1336969520	/nfs/dbraw/zinc/96/95/20/1336969520.db2.gz	HVXZHILKEFHESK-LBPRGKRZSA-N	0	3	341.249	3.203	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CCN([C@H]2CCc3ccccc32)C1	ZINC001014731020	1337890435	/nfs/dbraw/zinc/89/04/35/1337890435.db2.gz	HSOULKZBKOWKID-HKUYNNGSSA-N	0	3	335.451	3.166	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@H]2CCN(Cc3ccccc3C)C2)cc1	ZINC001015809928	1338321940	/nfs/dbraw/zinc/32/19/40/1338321940.db2.gz	XANNXHJAMHCIMG-FQEVSTJZSA-N	0	3	348.446	3.011	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](NC(=O)c2sc(CC3CC3)nc2C)C1	ZINC001015904206	1338355416	/nfs/dbraw/zinc/35/54/16/1338355416.db2.gz	FNJRTMYCQUXIDI-OAHLLOKOSA-N	0	3	333.501	3.174	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN([C@H](CC)c3ccccc3)C2)nc1	ZINC001016028464	1338415103	/nfs/dbraw/zinc/41/51/03/1338415103.db2.gz	YOQPUGQPGDUBIU-AZUAARDMSA-N	0	3	333.435	3.018	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@H]1CCN(Cc2ccccc2CC)C1	ZINC001016115335	1338467265	/nfs/dbraw/zinc/46/72/65/1338467265.db2.gz	XOKSNDQZGRLWFC-QFIPXVFZSA-N	0	3	346.474	3.164	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@@H]3NC(=O)C3(C4CC4)CC3)CC2)c1	ZINC001016675730	1338687205	/nfs/dbraw/zinc/68/72/05/1338687205.db2.gz	LHAVVWIQXYXOOA-IBGZPJMESA-N	0	3	349.478	3.219	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)[C@H]2CCCc3ccccc32)CC1	ZINC001016685367	1338689394	/nfs/dbraw/zinc/68/93/94/1338689394.db2.gz	NXWYNTYOJPYKGP-PMACEKPBSA-N	0	3	336.479	3.101	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)[C@@H]2CCCc3ccccc32)CC1	ZINC001016685368	1338689522	/nfs/dbraw/zinc/68/95/22/1338689522.db2.gz	NXWYNTYOJPYKGP-UXHICEINSA-N	0	3	336.479	3.101	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccc3cc(C)ccc3n2)CC1	ZINC001016722739	1338702439	/nfs/dbraw/zinc/70/24/39/1338702439.db2.gz	UZNTXLJJFHWSGV-HXUWFJFHSA-N	0	3	347.462	3.151	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)C2(c3cccc(C)c3)CCC2)CC1	ZINC001016763720	1338716201	/nfs/dbraw/zinc/71/62/01/1338716201.db2.gz	QYQBKTFRMWDDCI-LJQANCHMSA-N	0	3	336.479	3.021	20	30		EGEDHN
CC1(C(=O)N[C@H]2CC23CCN(Cc2cccc(C#N)c2)CC3)CCC1	ZINC001016776109	1338721685	/nfs/dbraw/zinc/72/16/85/1338721685.db2.gz	KHBDCAKEHBFXFB-SFHVURJKSA-N	0	3	337.467	3.219	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC23CCN(Cc2cnccc2C)CC3)C1	ZINC001016811304	1338734403	/nfs/dbraw/zinc/73/44/03/1338734403.db2.gz	CQSRZFSGGBIWGS-SFHVURJKSA-N	0	3	339.483	3.217	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)C2[C@H]3CCCCCC[C@H]23)CC1	ZINC001016847230	1338746045	/nfs/dbraw/zinc/74/60/45/1338746045.db2.gz	KPMVBIFXQNCIOO-BZSNNMDCSA-N	0	3	328.500	3.197	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2cc3cc(C)c(C)cc3o2)CC1	ZINC001016933263	1338773841	/nfs/dbraw/zinc/77/38/41/1338773841.db2.gz	HZADRJGRFFXTRL-LJQANCHMSA-N	0	3	336.435	3.267	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2cc3cc(F)ccc3s2)CC1	ZINC001016962732	1338785751	/nfs/dbraw/zinc/78/57/51/1338785751.db2.gz	CSWTVVWUPJTROV-KRWDZBQOSA-N	0	3	342.439	3.258	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cc(C)c(CC)s2)CC1	ZINC001016965800	1338787072	/nfs/dbraw/zinc/78/70/72/1338787072.db2.gz	SOXTZAHSBLMRSZ-KRWDZBQOSA-N	0	3	330.497	3.227	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2c[nH]c3ccc(C)cc23)CC1	ZINC001016991117	1338795913	/nfs/dbraw/zinc/79/59/13/1338795913.db2.gz	XYSYVPVLTUAXTJ-IBGZPJMESA-N	0	3	335.451	3.084	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)C2(c3ccc(C)cc3)CCC2)CC1	ZINC001016994803	1338797820	/nfs/dbraw/zinc/79/78/20/1338797820.db2.gz	VZSBVBVSUWIUGA-LJQANCHMSA-N	0	3	336.479	3.021	20	30		EGEDHN
CC(C)c1cccc(CN(C)C[C@@H]2CCCN(C(=O)[C@H](C)C#N)C2)n1	ZINC001017076147	1338849726	/nfs/dbraw/zinc/84/97/26/1338849726.db2.gz	FLWWCAGMRUNWEG-SJORKVTESA-N	0	3	342.487	3.035	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](CN(C)Cc2oc(CC)nc2C)C1	ZINC001017179859	1338923853	/nfs/dbraw/zinc/92/38/53/1338923853.db2.gz	QNPFGDBJSQSTNG-MRXNPFEDSA-N	0	3	347.503	3.428	20	30		EGEDHN
C[C@@H]1CCC[C@@H](CCN2C[C@H]3CC[C@@H](C2)N3C(=O)C#CC2CC2)C1	ZINC001017536605	1339363698	/nfs/dbraw/zinc/36/36/98/1339363698.db2.gz	WJMSLQGEXRRKID-MDNKFWRPSA-N	0	3	328.500	3.291	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccnn1[C@@H](C)CC	ZINC001017589916	1339373755	/nfs/dbraw/zinc/37/37/55/1339373755.db2.gz	LAESAPSCAUYPBL-YESZJQIVSA-N	0	3	330.476	3.109	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccnc(CCC)c1	ZINC001017637458	1339379956	/nfs/dbraw/zinc/37/99/56/1339379956.db2.gz	CJTKHKDZOLYIGH-KDURUIRLSA-N	0	3	327.472	3.289	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cccnc1C1CC1	ZINC001017704080	1339395209	/nfs/dbraw/zinc/39/52/09/1339395209.db2.gz	PWUXEZIGYYQLPQ-CALCHBBNSA-N	0	3	325.456	3.214	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C1([C@@H]2CCCCO2)CCC1	ZINC001017729363	1339405605	/nfs/dbraw/zinc/40/56/05/1339405605.db2.gz	AUFBLHKBRJTOLM-OTWHNJEPSA-N	0	3	346.515	3.367	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccccc1-n1cccc1	ZINC001017884534	1339439530	/nfs/dbraw/zinc/43/95/30/1339439530.db2.gz	CCNIQHQQTKWMLI-HDICACEKSA-N	0	3	335.451	3.342	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CCc2ccccc2C1	ZINC001017994691	1339477354	/nfs/dbraw/zinc/47/73/54/1339477354.db2.gz	CHHWQUVQNAYAIX-NJYVYQBISA-N	0	3	338.495	3.433	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CCc2ccccc2O1	ZINC001018075175	1339497027	/nfs/dbraw/zinc/49/70/27/1339497027.db2.gz	JZJZMZSLLMMLBL-NSHGMRRFSA-N	0	3	340.467	3.022	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cccc(N(C)C)c1	ZINC001018214009	1339535569	/nfs/dbraw/zinc/53/55/69/1339535569.db2.gz	WNZDVVHPICMCHE-KDURUIRLSA-N	0	3	327.472	3.008	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)Oc1ccccc1	ZINC001018236374	1339543435	/nfs/dbraw/zinc/54/34/35/1339543435.db2.gz	HJKZGUCJQVJKLL-KURKYZTESA-N	0	3	328.456	3.095	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@H](NCc3ccc(C#N)c(F)c3)C2)s1	ZINC001018432399	1339615243	/nfs/dbraw/zinc/61/52/43/1339615243.db2.gz	OPRVFFCZOJSAIN-HNNXBMFYSA-N	0	3	343.427	3.072	20	30		EGEDHN
N#Cc1cc(CN[C@H]2CCN(C(=O)CCC3CCCC3)C2)ccc1F	ZINC001018444170	1339621969	/nfs/dbraw/zinc/62/19/69/1339621969.db2.gz	CZPPBVMSCPVTJI-SFHVURJKSA-N	0	3	343.446	3.358	20	30		EGEDHN
C[C@H](N[C@H]1CCN(C(=O)c2cc(C#N)c[nH]2)C1)c1ccccc1Cl	ZINC001018679594	1339699662	/nfs/dbraw/zinc/69/96/62/1339699662.db2.gz	NTRALBNLRXXOQR-JSGCOSHPSA-N	0	3	342.830	3.105	20	30		EGEDHN
Cc1sccc1C(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001018817609	1339734092	/nfs/dbraw/zinc/73/40/92/1339734092.db2.gz	QRPGNMPDCULJLP-HNNXBMFYSA-N	0	3	343.427	3.072	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CCCN2CCc2scnc2C)CC1	ZINC001028116063	1340437436	/nfs/dbraw/zinc/43/74/36/1340437436.db2.gz	BUTNNBVQVRGLSC-QGZVFWFLSA-N	0	3	347.528	3.321	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@@H]2CCN(Cc3cccc(C#N)c3)C2)s1	ZINC001028376238	1340604177	/nfs/dbraw/zinc/60/41/77/1340604177.db2.gz	VIETYGQYWWRXIC-KRWDZBQOSA-N	0	3	339.464	3.180	20	30		EGEDHN
Cc1ccccc1C(=O)NC[C@@H]1CCN(Cc2ccc(C#N)cc2)C1	ZINC001028383826	1340611586	/nfs/dbraw/zinc/61/15/86/1340611586.db2.gz	YJFIHNXKQIZFNU-IBGZPJMESA-N	0	3	333.435	3.119	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](CNC(=O)c3sccc3F)C2)cc1	ZINC001028519101	1340684367	/nfs/dbraw/zinc/68/43/67/1340684367.db2.gz	JSWSFENABIFOBV-OAHLLOKOSA-N	0	3	343.427	3.011	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H](CNC(=O)[C@@H]3C[C@@H]4C=C[C@H]3CC4)C2)c1	ZINC001028553727	1340698542	/nfs/dbraw/zinc/69/85/42/1340698542.db2.gz	MNGLIDZYTNTSOG-MBPVOVBZSA-N	0	3	349.478	3.099	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CCN(Cc3cccnc3C)C2)CC1	ZINC001028780497	1340812422	/nfs/dbraw/zinc/81/24/22/1340812422.db2.gz	JWAKOQVREUVGDY-KRWDZBQOSA-N	0	3	327.472	3.075	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CCN(Cc3oc(CC)nc3C)C2)CC1	ZINC001028780536	1340812451	/nfs/dbraw/zinc/81/24/51/1340812451.db2.gz	KUPSXMICDMHSKK-INIZCTEOSA-N	0	3	345.487	3.230	20	30		EGEDHN
Cc1cc(C(=O)NC[C@@H]2CCN(Cc3ccc(C#N)cc3)C2)cs1	ZINC001028867126	1340868592	/nfs/dbraw/zinc/86/85/92/1340868592.db2.gz	YRMWPBOESKIZOS-KRWDZBQOSA-N	0	3	339.464	3.180	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC([C@H](C)NCc2cc(C3CC3)no2)CC1	ZINC001029124857	1340936011	/nfs/dbraw/zinc/93/60/11/1340936011.db2.gz	CLAPTPSMOHVMFD-AWEZNQCLSA-N	0	3	345.487	3.481	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC([C@@H](C)NCc3nccs3)CC2)C1	ZINC001029140770	1340941234	/nfs/dbraw/zinc/94/12/34/1340941234.db2.gz	GODRNIMNMPNZQP-CQSZACIVSA-N	0	3	333.501	3.216	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)C1CCN(C(=O)[C@@H]2CC23CC3)CC1	ZINC001029151279	1340943507	/nfs/dbraw/zinc/94/35/07/1340943507.db2.gz	ZTPXMCVJSUHNFR-KXBFYZLASA-N	0	3	337.467	3.075	20	30		EGEDHN
Cc1ccoc1C(=O)N1CC[C@@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001029647721	1341033321	/nfs/dbraw/zinc/03/33/21/1341033321.db2.gz	QNSVRCYIYDIREW-AWEZNQCLSA-N	0	3	343.452	3.115	20	30		EGEDHN
CN(Cc1ccc(Cl)s1)C[C@@H]1CCN(C(=O)C#CC2CC2)C1	ZINC001029734372	1341057805	/nfs/dbraw/zinc/05/78/05/1341057805.db2.gz	VZQXUHQGTHMWHD-AWEZNQCLSA-N	0	3	336.888	3.095	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](CN(C)Cc2c(C)noc2CC)C1	ZINC001029804992	1341079196	/nfs/dbraw/zinc/07/91/96/1341079196.db2.gz	XXVGANMQCNLVHB-OAHLLOKOSA-N	0	3	333.476	3.038	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCN(C(=O)[C@@H]2CCC2(C)C)C1	ZINC001029813212	1341083383	/nfs/dbraw/zinc/08/33/83/1341083383.db2.gz	RQARWQNRCNVANS-YOEHRIQHSA-N	0	3	345.512	3.336	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCN(C(=O)C2(CF)CCC2)C1	ZINC001029846616	1341093884	/nfs/dbraw/zinc/09/38/84/1341093884.db2.gz	IVKULAUTSJOGAS-AWEZNQCLSA-N	0	3	349.475	3.040	20	30		EGEDHN
C#CCCN1CCC[C@H](N(Cc2ccccc2)C(=O)C2CC=CC2)C1	ZINC001029917084	1341117345	/nfs/dbraw/zinc/11/73/45/1341117345.db2.gz	HYWAWSIHSSAHCZ-NRFANRHFSA-N	0	3	336.479	3.469	20	30		EGEDHN
C=CCCN1CCC[C@@H](N(Cc2ccccc2)C(=O)c2cocn2)C1	ZINC001029917781	1341117819	/nfs/dbraw/zinc/11/78/19/1341117819.db2.gz	PKBSDKHQHDYHEI-GOSISDBHSA-N	0	3	339.439	3.358	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC(CN(C)[C@@H](C)c2ccc(F)cc2F)CC1	ZINC001029945968	1341130862	/nfs/dbraw/zinc/13/08/62/1341130862.db2.gz	YZIOVGONMPYFRQ-KGLIPLIRSA-N	0	3	349.425	3.356	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC(CN(C)[C@H](C)c2ccc(F)cc2F)CC1	ZINC001029945970	1341130925	/nfs/dbraw/zinc/13/09/25/1341130925.db2.gz	YZIOVGONMPYFRQ-ZIAGYGMSSA-N	0	3	349.425	3.356	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC(CN(C)[C@@H](C)c2cnccn2)CC1	ZINC001029982960	1341143905	/nfs/dbraw/zinc/14/39/05/1341143905.db2.gz	QHFDXFUYTQMNBM-INIZCTEOSA-N	0	3	344.503	3.310	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC(CN(C)Cc2oc(C)nc2C)CC1	ZINC001029984726	1341144482	/nfs/dbraw/zinc/14/44/82/1341144482.db2.gz	MHVBDMFJJVLAKT-UHFFFAOYSA-N	0	3	333.476	3.174	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C1C2CC3CC(C2)CC1C3	ZINC001032447657	1341513416	/nfs/dbraw/zinc/51/34/16/1341513416.db2.gz	RWHGUYNYAFHWNL-LYSNUAOQSA-N	0	3	328.500	3.310	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccccc1-c1ccncc1	ZINC001032475716	1341518427	/nfs/dbraw/zinc/51/84/27/1341518427.db2.gz	GCVCEQLKMARCDE-ROUUACIJSA-N	0	3	333.435	3.223	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cc(Cl)c(Cl)[nH]1	ZINC001032551304	1341538458	/nfs/dbraw/zinc/53/84/58/1341538458.db2.gz	PUZFTGTXCSNBGK-QWRGUYRKSA-N	0	3	328.243	3.186	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc2scnc2c1	ZINC001032710889	1341587225	/nfs/dbraw/zinc/58/72/25/1341587225.db2.gz	WFLVQYYUIDUCEF-GJZGRUSLSA-N	0	3	327.453	3.161	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H](CC)Cc1ccccc1C	ZINC001032733263	1341594570	/nfs/dbraw/zinc/59/45/70/1341594570.db2.gz	OIKSPVICFSNEKM-IHPCNDPISA-N	0	3	326.484	3.425	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H](C)Oc1cccc(C)c1	ZINC001032770616	1341608957	/nfs/dbraw/zinc/60/89/57/1341608957.db2.gz	GRKAHNARCLNNNY-SQNIBIBYSA-N	0	3	328.456	3.014	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1nsc2ccccc21	ZINC001032796687	1341616894	/nfs/dbraw/zinc/61/68/94/1341616894.db2.gz	MTKDMFIKKAFSMA-GJZGRUSLSA-N	0	3	341.480	3.090	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1[nH]c2ccccc2c1OC	ZINC001032808843	1341621972	/nfs/dbraw/zinc/62/19/72/1341621972.db2.gz	SVDCAOSJYWEZME-GJZGRUSLSA-N	0	3	339.439	3.041	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](N(C)C(=O)c2sc(C3CC3)nc2C)C1	ZINC001033071030	1341715630	/nfs/dbraw/zinc/71/56/30/1341715630.db2.gz	VZJLQTWRONURMR-OAHLLOKOSA-N	0	3	333.501	3.441	20	30		EGEDHN
C=CCCN1CC[C@H](N(C)C(=O)c2cc(-c3cccs3)on2)C1	ZINC001033302190	1341773312	/nfs/dbraw/zinc/77/33/12/1341773312.db2.gz	ZXBBCIDTOVUPMA-ZDUSSCGKSA-N	0	3	331.441	3.126	20	30		EGEDHN
C=CCCN1CC[C@@H](N(C)C(=O)c2cc(-c3cccs3)on2)C1	ZINC001033302189	1341773499	/nfs/dbraw/zinc/77/34/99/1341773499.db2.gz	ZXBBCIDTOVUPMA-CYBMUJFWSA-N	0	3	331.441	3.126	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@@H]2CCN(CC[C@H]3CC3(Cl)Cl)C2)C1	ZINC001033400791	1341814583	/nfs/dbraw/zinc/81/45/83/1341814583.db2.gz	XJXBTKOVZLVXSG-UONOGXRCSA-N	0	3	345.314	3.459	20	30		EGEDHN
C#Cc1cncc(C(=O)N(C)[C@H]2CCN(Cc3cc(C)ccc3C)C2)c1	ZINC001033405729	1341816756	/nfs/dbraw/zinc/81/67/56/1341816756.db2.gz	OUQUDNUQIHABPO-NRFANRHFSA-N	0	3	347.462	3.026	20	30		EGEDHN
C=C(C)CCN1CC[C@H](N(C)C(=O)c2cnc([C@H]3CCCO3)s2)C1	ZINC001033485090	1341842193	/nfs/dbraw/zinc/84/21/93/1341842193.db2.gz	XCYQLBPHDKSQDH-LSDHHAIUSA-N	0	3	349.500	3.107	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](N(C)C(=O)c2cnc([C@H]3CCCO3)s2)C1	ZINC001033485089	1341842232	/nfs/dbraw/zinc/84/22/32/1341842232.db2.gz	XCYQLBPHDKSQDH-HUUCEWRRSA-N	0	3	349.500	3.107	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2ccc(-c3ccccc3)nc2)C1	ZINC001033532189	1341860882	/nfs/dbraw/zinc/86/08/82/1341860882.db2.gz	AMHCLMLNZJEZIR-LJQANCHMSA-N	0	3	335.451	3.471	20	30		EGEDHN
C#CCCN1CC[C@H](N(C)C(=O)c2cccc(Cl)c2Cl)C1	ZINC001033611552	1341901884	/nfs/dbraw/zinc/90/18/84/1341901884.db2.gz	WWOIDVRLWSZZPH-LBPRGKRZSA-N	0	3	325.239	3.163	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2ccc(OCC3CC3)cc2)C1	ZINC001033667988	1341936163	/nfs/dbraw/zinc/93/61/63/1341936163.db2.gz	DGIOMVCTOQSNHJ-GOSISDBHSA-N	0	3	328.456	3.198	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N(C)[C@@H]2CCN(CC=C(C)C)C2)cc1	ZINC001033690301	1341954479	/nfs/dbraw/zinc/95/44/79/1341954479.db2.gz	HZLQNODSXBZARV-LJQANCHMSA-N	0	3	342.483	3.293	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)C2CC(c3cccc(F)c3)C2)C1	ZINC001033714065	1341972518	/nfs/dbraw/zinc/97/25/18/1341972518.db2.gz	VDFLUBOOHBTPGQ-FAFZWHIHSA-N	0	3	330.447	3.428	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cn(C(C)(C)C)nc2C)C1	ZINC001033828568	1342029329	/nfs/dbraw/zinc/02/93/29/1342029329.db2.gz	QCRPCXFUAZUIMP-INIZCTEOSA-N	0	3	332.492	3.059	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@H]2CCc3cc(OC)ccc32)C1	ZINC001033853234	1342044424	/nfs/dbraw/zinc/04/44/24/1342044424.db2.gz	XHUFRQKJEJHULO-XLIONFOSSA-N	0	3	342.483	3.224	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2csc(C(F)(F)F)c2)C1	ZINC001033886561	1342059816	/nfs/dbraw/zinc/05/98/16/1342059816.db2.gz	WYKHHNVGBFTBCV-ZDUSSCGKSA-N	0	3	344.402	3.327	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](N(CC)C(=O)c2nc3cnccc3s2)C1	ZINC001033897641	1342069858	/nfs/dbraw/zinc/06/98/58/1342069858.db2.gz	PXUQDXGUOOBROF-CQSZACIVSA-N	0	3	344.484	3.194	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)[C@@H]2C[C@H]2c2c(F)cccc2F)C1	ZINC001033945765	1342106422	/nfs/dbraw/zinc/10/64/22/1342106422.db2.gz	BLHDDMXWJFNWRQ-BZUAXINKSA-N	0	3	346.421	3.014	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)[C@@H]2C[C@H]2c2c(F)cccc2F)C1	ZINC001033945764	1342106562	/nfs/dbraw/zinc/10/65/62/1342106562.db2.gz	BLHDDMXWJFNWRQ-ARFHVFGLSA-N	0	3	346.421	3.014	20	30		EGEDHN
C=C1CCC(C(=O)N(CC)[C@H]2CCN(C[C@H]3CC(C)(C)CO3)C2)CC1	ZINC001033951503	1342109894	/nfs/dbraw/zinc/10/98/94/1342109894.db2.gz	WUXWKBVMMSUBMT-RBUKOAKNSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cnn(CC3CCCC3)c2)C1	ZINC001034006162	1342143535	/nfs/dbraw/zinc/14/35/35/1342143535.db2.gz	QJNHEBIGPJORMP-LJQANCHMSA-N	0	3	344.503	3.186	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2cc(C)n(CC3CC3)c2C)C1	ZINC001034012766	1342150127	/nfs/dbraw/zinc/15/01/27/1342150127.db2.gz	JJBSRZRPGMMZBT-IBGZPJMESA-N	0	3	341.499	3.075	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccc(OC)c(OCC)c2)C1	ZINC001034037576	1342177683	/nfs/dbraw/zinc/17/76/83/1342177683.db2.gz	ZUUWDVZIBYCOGU-QGZVFWFLSA-N	0	3	346.471	3.206	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2ccc(OCC3CC3)cc2)C1	ZINC001034044034	1342185427	/nfs/dbraw/zinc/18/54/27/1342185427.db2.gz	IWXZPSKXXHQQEV-LJQANCHMSA-N	0	3	340.467	3.035	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)C2CC(c3cccc(F)c3)C2)C1	ZINC001034055464	1342195884	/nfs/dbraw/zinc/19/58/84/1342195884.db2.gz	WNBPUGRSZXWFKW-QLOJAFMTSA-N	0	3	342.458	3.265	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)[C@@H]2CC[C@H](c3ccccc3)O2)C1	ZINC001034209129	1342319006	/nfs/dbraw/zinc/31/90/06/1342319006.db2.gz	HNGJQWLTDYCHRB-QRVBRYPASA-N	0	3	328.456	3.063	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccnn2C(CC)CC)C1	ZINC001034249113	1342347015	/nfs/dbraw/zinc/34/70/15/1342347015.db2.gz	IFXSFMKYINHNNW-INIZCTEOSA-N	0	3	332.492	3.405	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2F)C1	ZINC001034326028	1342401436	/nfs/dbraw/zinc/40/14/36/1342401436.db2.gz	GVSHGZONKCBIDV-BHYGNILZSA-N	0	3	334.410	3.225	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cc(Cl)c(Cl)[nH]2)C1	ZINC001034331021	1342406010	/nfs/dbraw/zinc/40/60/10/1342406010.db2.gz	TYEXOHYYXLVANN-NSHDSACASA-N	0	3	330.259	3.482	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2cc(-c3ccccc3)ccn2)C1	ZINC001034457704	1342515357	/nfs/dbraw/zinc/51/53/57/1342515357.db2.gz	HGWMABBUTBJXHW-HXUWFJFHSA-N	0	3	347.462	3.356	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cc(C(F)(F)F)ccn2)C1	ZINC001034471566	1342526952	/nfs/dbraw/zinc/52/69/52/1342526952.db2.gz	JIQODWCLYFTZIZ-AWEZNQCLSA-N	0	3	341.377	3.261	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccnc(O[C@H](C)CC)c2)C1	ZINC001034478762	1342534803	/nfs/dbraw/zinc/53/48/03/1342534803.db2.gz	OAFYILJTRBJQJP-SJLPKXTDSA-N	0	3	345.487	3.419	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cnn([C@H](C)CC)c2C)C1	ZINC001034482563	1342539623	/nfs/dbraw/zinc/53/96/23/1342539623.db2.gz	CVSGUKMLWFPHOQ-WBVHZDCISA-N	0	3	332.492	3.323	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2ccccc2OC(C)C)C1	ZINC001034496049	1342551901	/nfs/dbraw/zinc/55/19/01/1342551901.db2.gz	ALJDFFKZXGEIJS-KRWDZBQOSA-N	0	3	328.456	3.081	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2c(Cl)nc3ccccn32)C1	ZINC001034516082	1342575779	/nfs/dbraw/zinc/57/57/79/1342575779.db2.gz	WDEWVAWVWOWWFV-CQSZACIVSA-N	0	3	346.862	3.148	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@@H]2Cc3cc(C)c(C)cc3O2)C1	ZINC001034540741	1342599893	/nfs/dbraw/zinc/59/98/93/1342599893.db2.gz	JJFSKWDDVDJLCS-QUCCMNQESA-N	0	3	342.483	3.154	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2coc(C3CCCCC3)n2)C1	ZINC001034549221	1342611726	/nfs/dbraw/zinc/61/17/26/1342611726.db2.gz	XGMFXYVWMOGLAS-KRWDZBQOSA-N	0	3	343.471	3.330	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1CC[C@H](NC(=O)[C@@H]2CCC2(F)F)CC1	ZINC001034667033	1342679672	/nfs/dbraw/zinc/67/96/72/1342679672.db2.gz	HGFSMBHKIWACRX-ULQDDVLXSA-N	0	3	347.409	3.121	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)[C@]23C[C@H]2CCC3)CC1	ZINC001034697256	1342697397	/nfs/dbraw/zinc/69/73/97/1342697397.db2.gz	DRLUXDAPCWNTMC-IXYNUQLISA-N	0	3	341.293	3.102	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)c2sccc2F)s1	ZINC001034929680	1342840628	/nfs/dbraw/zinc/84/06/28/1342840628.db2.gz	UJOBXLYXCLXKOP-LLVKDONJSA-N	0	3	349.456	3.215	20	30		EGEDHN
CC1(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)cc2F)CC=CC1	ZINC001035035202	1342888511	/nfs/dbraw/zinc/88/85/11/1342888511.db2.gz	GRLGIMQTQPALNR-QGZVFWFLSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H]1CNCc1cc(CO)ccc1F	ZINC001035036621	1342890313	/nfs/dbraw/zinc/89/03/13/1342890313.db2.gz	CXBLWRYBVQHYRZ-XLIONFOSSA-N	0	3	348.462	3.001	20	30		EGEDHN
C=C[C@H](C(=O)N1CCC[C@@H]1CNCc1cccnc1)c1ccccc1	ZINC001035133762	1342949708	/nfs/dbraw/zinc/94/97/08/1342949708.db2.gz	NHDNZBBQMLZFLW-UXHICEINSA-N	0	3	335.451	3.132	20	30		EGEDHN
C=C(C)CC[N@@H+]1CCC2(C1)CCN(C(=O)c1ccccc1[O-])CC2	ZINC001035159987	1342976690	/nfs/dbraw/zinc/97/66/90/1342976690.db2.gz	QPTWNXMCHVEAKW-UHFFFAOYSA-N	0	3	328.456	3.287	20	30		EGEDHN
C=C(C)CC[N@H+]1CCC2(C1)CCN(C(=O)c1ccccc1[O-])CC2	ZINC001035159987	1342976692	/nfs/dbraw/zinc/97/66/92/1342976692.db2.gz	QPTWNXMCHVEAKW-UHFFFAOYSA-N	0	3	328.456	3.287	20	30		EGEDHN
CC(C)(C)C(=O)N1CCC2(CCN(Cc3ccc(C#N)s3)C2)CC1	ZINC001035248940	1343072395	/nfs/dbraw/zinc/07/23/95/1343072395.db2.gz	DILUUAGZAAYHNY-UHFFFAOYSA-N	0	3	345.512	3.480	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1c(C)noc1C(C)C)CC2	ZINC001035724950	1343153859	/nfs/dbraw/zinc/15/38/59/1343153859.db2.gz	DYOHZCVOBDMHRU-UHFFFAOYSA-N	0	3	331.460	3.221	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1c(C)noc1C(F)F)CC2	ZINC001035727468	1343154653	/nfs/dbraw/zinc/15/46/53/1343154653.db2.gz	KVDWNFOJRKLRRE-UHFFFAOYSA-N	0	3	339.386	3.035	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cc(F)cc3ccoc31)CC2	ZINC001035737045	1343161599	/nfs/dbraw/zinc/16/15/99/1343161599.db2.gz	PPQMKTTULBLIMK-UHFFFAOYSA-N	0	3	340.398	3.133	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)Cc1c(C)cccc1Cl)CC2	ZINC001035744545	1343164519	/nfs/dbraw/zinc/16/45/19/1343164519.db2.gz	ICVZPAUDWDZSRV-UHFFFAOYSA-N	0	3	344.886	3.139	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cccnc1C(F)F)CC2	ZINC001035747176	1343167232	/nfs/dbraw/zinc/16/72/32/1343167232.db2.gz	HZHOXKQGMKZODC-UHFFFAOYSA-N	0	3	335.398	3.133	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1nc3ccccc3cc1C)CC2	ZINC001035752997	1343171098	/nfs/dbraw/zinc/17/10/98/1343171098.db2.gz	MHGYMCBIGOMAQZ-UHFFFAOYSA-N	0	3	347.462	3.105	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cc1cccc3cccnc31)CC2	ZINC001035763398	1343176315	/nfs/dbraw/zinc/17/63/15/1343176315.db2.gz	WRPFZQBPOYGDDU-UHFFFAOYSA-N	0	3	349.478	3.278	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1sc(CC)nc1C)CC2	ZINC001035817837	1343213967	/nfs/dbraw/zinc/21/39/67/1343213967.db2.gz	VGMPIWYOQMZHQG-UHFFFAOYSA-N	0	3	333.501	3.128	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc3cccnc3s1)CC2	ZINC001035828990	1343217663	/nfs/dbraw/zinc/21/76/63/1343217663.db2.gz	BFRGYNCVZRJRIL-UHFFFAOYSA-N	0	3	341.480	3.410	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc3nc(C)ccc3o1)CC2	ZINC001035842020	1343224224	/nfs/dbraw/zinc/22/42/24/1343224224.db2.gz	YEMZIOLNBFBBST-UHFFFAOYSA-N	0	3	339.439	3.250	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)C1CCC(C(F)F)CC1)CC2	ZINC001035845189	1343226632	/nfs/dbraw/zinc/22/66/32/1343226632.db2.gz	KXIKPVCSDUZARE-UHFFFAOYSA-N	0	3	338.442	3.006	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@H](C)c1cccc(Cl)c1)CC2	ZINC001035854800	1343232079	/nfs/dbraw/zinc/23/20/79/1343232079.db2.gz	DWPJLIKWKOQLDV-MRXNPFEDSA-N	0	3	344.886	3.391	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cnc(C(C)(C)C)s1)CC2	ZINC001035857227	1343233983	/nfs/dbraw/zinc/23/39/83/1343233983.db2.gz	KSWZKNOVQDJVHX-UHFFFAOYSA-N	0	3	345.512	3.002	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CCCCC2)CC[C@H]1NCc1ccccc1C#N	ZINC001035887179	1343249022	/nfs/dbraw/zinc/24/90/22/1343249022.db2.gz	JYGIEQRUNIZPNH-OXQOHEQNSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@H]1CN(C(=O)CC2CCC2)CC[C@H]1NCc1cc(F)ccc1C#N	ZINC001035978317	1343297715	/nfs/dbraw/zinc/29/77/15/1343297715.db2.gz	REUQJBQTYGBSBS-IFXJQAMLSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@H](NCc2cc(C)no2)[C@H](C)C1	ZINC001036041938	1343309471	/nfs/dbraw/zinc/30/94/71/1343309471.db2.gz	HLTDZNHGFKVJLC-ABAIWWIYSA-N	0	3	339.867	3.088	20	30		EGEDHN
CC(C)C1(C(=O)N2CC[C@H](NCc3ccccc3C#N)[C@H](C)C2)CC1	ZINC001036169041	1343341976	/nfs/dbraw/zinc/34/19/76/1343341976.db2.gz	KSUTWWHPSSKNGO-APWZRJJASA-N	0	3	339.483	3.321	20	30		EGEDHN
C[C@H]1CN(C(=O)C2(C)CC=CC2)CC[C@H]1NCc1ccccc1C#N	ZINC001036173729	1343346431	/nfs/dbraw/zinc/34/64/31/1343346431.db2.gz	NZKHMMFIOGTUDT-QFBILLFUSA-N	0	3	337.467	3.241	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CC3(CC3)C2)CC[C@H]1NCc1ccccc1C#N	ZINC001036186290	1343352206	/nfs/dbraw/zinc/35/22/06/1343352206.db2.gz	MHTMSBLIYCAIOT-DNVCBOLYSA-N	0	3	337.467	3.075	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCCN(C(=O)c2ccco2)C1	ZINC001036346744	1343433360	/nfs/dbraw/zinc/43/33/60/1343433360.db2.gz	WZHQJKNPIMVJGP-CRAIPNDOSA-N	0	3	337.423	3.182	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@H]([C@@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001036354518	1343437583	/nfs/dbraw/zinc/43/75/83/1343437583.db2.gz	YMLKRTIRTBADJW-ZBFHGGJFSA-N	0	3	331.435	3.070	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]([C@H](C)NCc2nc(C)oc2C)C1	ZINC001036426037	1343479266	/nfs/dbraw/zinc/47/92/66/1343479266.db2.gz	CXSMYYYNPFSMAU-BBRMVZONSA-N	0	3	333.476	3.220	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]([C@@H](C)NCc2csc(C)n2)C1	ZINC001036429954	1343482175	/nfs/dbraw/zinc/48/21/75/1343482175.db2.gz	XSZLHCXLOYZKFH-HIFRSBDPSA-N	0	3	335.517	3.380	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]([C@@H](C)NCc2ccn(CC)n2)C1	ZINC001036443755	1343491449	/nfs/dbraw/zinc/49/14/49/1343491449.db2.gz	WIGZUZAIONSVMW-IAGOWNOFSA-N	0	3	346.519	3.222	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)C2CCC2)[C@@H]1CNCc1ccc(C#N)s1	ZINC001036485338	1343509366	/nfs/dbraw/zinc/50/93/66/1343509366.db2.gz	HMZVBPGEBPEDHD-CXAGYDPISA-N	0	3	331.485	3.137	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@@H](C)[C@@H]1CNCc1ccc(C#N)s1	ZINC001036490367	1343513138	/nfs/dbraw/zinc/51/31/38/1343513138.db2.gz	GCZKVMWKNRKVFN-PBHICJAKSA-N	0	3	333.501	3.383	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)C(C)(C)F)[C@@H]1CNCc1cc(C#N)ccc1F	ZINC001036501039	1343519571	/nfs/dbraw/zinc/51/95/71/1343519571.db2.gz	NRMRQGVQUGVKFM-CXAGYDPISA-N	0	3	349.425	3.162	20	30		EGEDHN
Cc1occc1C(=O)N1CC[C@H]2[C@H](CCN2CC#Cc2ccccc2)C1	ZINC001036639023	1343594282	/nfs/dbraw/zinc/59/42/82/1343594282.db2.gz	NKIMKXWQAAKHNP-CTNGQTDRSA-N	0	3	348.446	3.176	20	30		EGEDHN
CC(C)C(=O)N1CC[C@H]2[C@@H](CCN2CC#Cc2cccc(Cl)c2)C1	ZINC001036648963	1343599151	/nfs/dbraw/zinc/59/91/51/1343599151.db2.gz	PWAJUXZXFHORPB-HKUYNNGSSA-N	0	3	344.886	3.270	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CN(C(=O)C4CC=CC4)CC[C@@H]32)s1	ZINC001036674581	1343615618	/nfs/dbraw/zinc/61/56/18/1343615618.db2.gz	IBYHLEHQBVQIKP-QAPCUYQASA-N	0	3	341.480	3.009	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@H]2[C@@H](CCN2Cc2sccc2Cl)C1	ZINC001036714037	1343646981	/nfs/dbraw/zinc/64/69/81/1343646981.db2.gz	RWEMMJIKSZWNIJ-HOCLYGCPSA-N	0	3	348.899	3.238	20	30		EGEDHN
CC(C(=O)N1CC[C@H]2[C@H](CCN2CC#Cc2ccccc2)C1)=C1CCC1	ZINC001036714270	1343647412	/nfs/dbraw/zinc/64/74/12/1343647412.db2.gz	VKGZOMVCINKOAZ-YADHBBJMSA-N	0	3	348.490	3.461	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]2[C@H](CCN2Cc2cc(C)no2)C1	ZINC001036793004	1343725143	/nfs/dbraw/zinc/72/51/43/1343725143.db2.gz	XQKNBYJLJHPULE-NVXWUHKLSA-N	0	3	331.460	3.008	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]2[C@H](CCN2Cc2cc(C)ns2)C1	ZINC001036794184	1343726491	/nfs/dbraw/zinc/72/64/91/1343726491.db2.gz	QUIYFKDRUISZKD-NVXWUHKLSA-N	0	3	347.528	3.477	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H]3[C@H](CCN3Cc3cnoc3C)C2)CC1	ZINC001036810512	1343745062	/nfs/dbraw/zinc/74/50/62/1343745062.db2.gz	DQAYDGXIKVRJAU-IEBWSBKVSA-N	0	3	343.471	3.152	20	30		EGEDHN
Cc1ccoc1C(=O)N[C@H]1CCC[C@@H]1CNCc1ccccc1C#N	ZINC001036948391	1343889200	/nfs/dbraw/zinc/88/92/00/1343889200.db2.gz	QARNEHOFILFXPK-MSOLQXFVSA-N	0	3	337.423	3.148	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@H]1CCC[C@@H]1NC(=O)C=C1CCC1	ZINC001036980215	1343907375	/nfs/dbraw/zinc/90/73/75/1343907375.db2.gz	FJMDGBOIEVVALR-APWZRJJASA-N	0	3	341.430	3.182	20	30		EGEDHN
CC1(C)CC(C(=O)N[C@@H]2CCC[C@@H]2CNCc2ccccc2C#N)C1	ZINC001037001888	1343920247	/nfs/dbraw/zinc/92/02/47/1343920247.db2.gz	AENKNNQNXFTZJN-IEBWSBKVSA-N	0	3	339.483	3.369	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCC[C@@H]1NC(=O)C=C1CCC1	ZINC001037200078	1344037393	/nfs/dbraw/zinc/03/73/93/1344037393.db2.gz	ZCMJOTOAWZGDHR-PMACEKPBSA-N	0	3	337.467	3.433	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCCC[C@H]2CNCc2cscn2)C1	ZINC001037239417	1344062085	/nfs/dbraw/zinc/06/20/85/1344062085.db2.gz	GJRKATXXLWEZGY-HOCLYGCPSA-N	0	3	333.501	3.264	20	30		EGEDHN
CC[C@H]1CN(C(=O)CC2CC2)CC[C@@H]1NCc1cc(F)ccc1C#N	ZINC001037756907	1344073368	/nfs/dbraw/zinc/07/33/68/1344073368.db2.gz	FTUZDONDPPMXLO-KXBFYZLASA-N	0	3	343.446	3.214	20	30		EGEDHN
CC[C@H]1CN(C(=O)CC(C)C)CC[C@H]1NCc1cc(F)ccc1C#N	ZINC001037766649	1344079661	/nfs/dbraw/zinc/07/96/61/1344079661.db2.gz	NXGDFPZMZGUBPV-HNAYVOBHSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](NCc2csc(C)n2)[C@@H](CC)C1	ZINC001037895337	1344166540	/nfs/dbraw/zinc/16/65/40/1344166540.db2.gz	FNOGRWNXOXYSKY-HOCLYGCPSA-N	0	3	335.517	3.380	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](NCc2nccs2)[C@H](CC)C1	ZINC001037906064	1344170537	/nfs/dbraw/zinc/17/05/37/1344170537.db2.gz	QDSSUNOBEIIHDX-CABCVRRESA-N	0	3	335.517	3.462	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3cc(C)no3)[C@H](CC)C2)CC1	ZINC001037924876	1344184280	/nfs/dbraw/zinc/18/42/80/1344184280.db2.gz	MDEOAOBKIIKUES-APWZRJJASA-N	0	3	345.487	3.446	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1ccn(C2CCCCC2)n1	ZINC001038250142	1344344360	/nfs/dbraw/zinc/34/43/60/1344344360.db2.gz	LICNFVOBPXMEHW-KRWDZBQOSA-N	0	3	330.476	3.159	20	30		EGEDHN
C#CCOc1ccc(C(=O)NC[C@H]2CCN2CCCC2CCC2)cc1	ZINC001038784195	1344582478	/nfs/dbraw/zinc/58/24/78/1344582478.db2.gz	SRBQFVYVHOZGCE-LJQANCHMSA-N	0	3	340.467	3.083	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2cccs2)CC[C@H]1c1ccc(F)cc1	ZINC001079148720	1357196852	/nfs/dbraw/zinc/19/68/52/1357196852.db2.gz	JIQINGVGOSIGIS-DLBZAZTESA-N	0	3	342.439	3.108	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H]2CCC2(C)C)CC[C@H]1c1ccc(F)cc1	ZINC001079157077	1357197600	/nfs/dbraw/zinc/19/76/00/1357197600.db2.gz	YIGXXEHLETVYKP-GBESFXJTSA-N	0	3	342.458	3.169	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1ccc(N(CC)CC)cc1	ZINC001038951497	1344674875	/nfs/dbraw/zinc/67/48/75/1344674875.db2.gz	YTFWIRIRKSJLIB-IBGZPJMESA-N	0	3	329.488	3.303	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1ccc(OCC2CC2)cc1	ZINC001039024777	1344721525	/nfs/dbraw/zinc/72/15/25/1344721525.db2.gz	GDJJIQYQRIWOTG-GOSISDBHSA-N	0	3	328.456	3.246	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1cc2ccccc2n1CC	ZINC001039044790	1344731806	/nfs/dbraw/zinc/73/18/06/1344731806.db2.gz	MKYMOWVTVVHCIO-QGZVFWFLSA-N	0	3	325.456	3.432	20	30		EGEDHN
C=C(C)C[N@@H+]1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001039194295	1344900807	/nfs/dbraw/zinc/90/08/07/1344900807.db2.gz	YJUAAZMQBIRZAO-WMZOPIPTSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=C(C)C[N@H+]1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001039194295	1344900812	/nfs/dbraw/zinc/90/08/12/1344900812.db2.gz	YJUAAZMQBIRZAO-WMZOPIPTSA-N	0	3	328.456	3.285	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)Cc2ccc(C)cc2)C1	ZINC001039220404	1344937778	/nfs/dbraw/zinc/93/77/78/1344937778.db2.gz	ZBIKCORBZOWTJY-LEWJYISDSA-N	0	3	338.495	3.264	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2nc(C)sc2C)C1	ZINC001039219986	1344937818	/nfs/dbraw/zinc/93/78/18/1344937818.db2.gz	WKMCWVSYVSPASH-DLBZAZTESA-N	0	3	345.512	3.100	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2nccc3ccccc32)C1	ZINC001039224243	1344941952	/nfs/dbraw/zinc/94/19/52/1344941952.db2.gz	DQIZWNQFBJNPBA-AZUAARDMSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(F)c(C)c2)C1	ZINC001039226703	1344945077	/nfs/dbraw/zinc/94/50/77/1344945077.db2.gz	ZLCZBIWAQUACCJ-HKUYNNGSSA-N	0	3	328.431	3.084	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(F)c(C)c2)C1	ZINC001039226525	1344945696	/nfs/dbraw/zinc/94/56/96/1344945696.db2.gz	XWXCSXKTMWFBLX-QUCCMNQESA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc3occc3s2)C1	ZINC001039228733	1344948732	/nfs/dbraw/zinc/94/87/32/1344948732.db2.gz	HMQRSVQZHFYHGU-LSDHHAIUSA-N	0	3	342.464	3.444	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2csc(C(C)C)n2)C1	ZINC001039232422	1344952483	/nfs/dbraw/zinc/95/24/83/1344952483.db2.gz	WDYCZVDUSNMYDE-DOTOQJQBSA-N	0	3	345.512	3.216	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)CCc2ccccc2C)C1	ZINC001039238296	1344961272	/nfs/dbraw/zinc/96/12/72/1344961272.db2.gz	NBJIKZPXHCPHDP-RTWAWAEBSA-N	0	3	338.495	3.264	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)C2CCC(F)(F)CC2)C1	ZINC001039238344	1344962063	/nfs/dbraw/zinc/96/20/63/1344962063.db2.gz	NDSXKMOZXOURJF-IRXDYDNUSA-N	0	3	338.442	3.148	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(F)cc2Cl)C1	ZINC001039241295	1344966306	/nfs/dbraw/zinc/96/63/06/1344966306.db2.gz	YXMGMXUTDOFOKG-KDOFPFPSSA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccoc2C2CC2)C1	ZINC001039242103	1344967957	/nfs/dbraw/zinc/96/79/57/1344967957.db2.gz	ADWJIXIEHZKEIU-HKUYNNGSSA-N	0	3	340.467	3.497	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cccn2C(C)C)C1	ZINC001039242756	1344969585	/nfs/dbraw/zinc/96/95/85/1344969585.db2.gz	QTZSYURPHFPCNN-ROUUACIJSA-N	0	3	327.472	3.019	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc(Cl)cn2CC)C1	ZINC001039243763	1344970925	/nfs/dbraw/zinc/97/09/25/1344970925.db2.gz	WBWXSVQXMQWZPC-NVXWUHKLSA-N	0	3	347.890	3.111	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc(C)c(F)c(C)c2)C1	ZINC001039244608	1344972752	/nfs/dbraw/zinc/97/27/52/1344972752.db2.gz	YGIXLWNYNLGECR-HKUYNNGSSA-N	0	3	342.458	3.392	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccc3[nH]ccc3c2)C1	ZINC001039247245	1344976890	/nfs/dbraw/zinc/97/68/90/1344976890.db2.gz	XBJSKRGYLMOFJT-AZUAARDMSA-N	0	3	335.451	3.118	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(Cl)cc2)C1	ZINC001039247593	1344977754	/nfs/dbraw/zinc/97/77/54/1344977754.db2.gz	XLZCIOPXVJBOAO-WMZOPIPTSA-N	0	3	330.859	3.290	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ncccc2Cl)C1	ZINC001039249990	1344980210	/nfs/dbraw/zinc/98/02/10/1344980210.db2.gz	LFKGSILYMCUTRF-WBVHZDCISA-N	0	3	345.874	3.075	20	30		EGEDHN
Cc1ccc(CN2CC[C@H]3CC[C@@H](C2)N3C(=O)[C@H](C)C#N)c(C)c1	ZINC001039349377	1345023597	/nfs/dbraw/zinc/02/35/97/1345023597.db2.gz	VGDYJQUWDKVMBO-QRQLOZEOSA-N	0	3	325.456	3.028	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccc2c(C)c(C)[nH]c21	ZINC001039395248	1345043925	/nfs/dbraw/zinc/04/39/25/1345043925.db2.gz	CDZGNFAUCHUWJT-MSOLQXFVSA-N	0	3	349.478	3.487	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1cc(C)ccc1OC	ZINC001039401027	1345047020	/nfs/dbraw/zinc/04/70/20/1345047020.db2.gz	GHJVTFNBBQXBHY-MOPGFXCFSA-N	0	3	342.483	3.188	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccc(C(C)C)n1	ZINC001039401429	1345047691	/nfs/dbraw/zinc/04/76/91/1345047691.db2.gz	BSOOHPUJFMDLOX-SJORKVTESA-N	0	3	327.472	3.460	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1cc2ccccc2o1	ZINC001039415404	1345056272	/nfs/dbraw/zinc/05/62/72/1345056272.db2.gz	UTCHORPAOLDAPP-MSOLQXFVSA-N	0	3	336.435	3.064	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2cccnc2c1	ZINC001039454307	1345076592	/nfs/dbraw/zinc/07/65/92/1345076592.db2.gz	VUEJQKAJCBLSJM-MOPGFXCFSA-N	0	3	335.451	3.490	20	30		EGEDHN
C=CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1oc(CCC)nc1C	ZINC001039460557	1345079084	/nfs/dbraw/zinc/07/90/84/1345079084.db2.gz	VPBJRLHZRFKEPQ-CVEARBPZSA-N	0	3	331.460	3.191	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)CCc1ccc(CC)cc1	ZINC001039469448	1345086565	/nfs/dbraw/zinc/08/65/65/1345086565.db2.gz	ILJVPUCNGKLEJE-UXHICEINSA-N	0	3	326.484	3.433	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@H](C)c1cccc(OC)c1	ZINC001039476239	1345090819	/nfs/dbraw/zinc/09/08/19/1345090819.db2.gz	IRUQNZPTZLVRAD-UHOSZYNNSA-N	0	3	342.483	3.440	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)CCc3ccsc3)C2)C1	ZINC001040242547	1345392451	/nfs/dbraw/zinc/39/24/51/1345392451.db2.gz	YTYRQVNYIJDVON-IBGZPJMESA-N	0	3	330.497	3.019	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3ccc(C)c(Cl)c3F)C2)C1	ZINC001040310641	1345425061	/nfs/dbraw/zinc/42/50/61/1345425061.db2.gz	QDGYTFHVNIRUOB-IBGZPJMESA-N	0	3	348.849	3.349	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CC[C@@]3(C2)CCCN(C[C@H](F)CC)C3)cc1	ZINC001040323368	1345432353	/nfs/dbraw/zinc/43/23/53/1345432353.db2.gz	QMMPRGJBDOPNEQ-CTNGQTDRSA-N	0	3	342.458	3.344	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@]2(C1)CCCN(Cc1ccccn1)C2	ZINC001040323729	1345432637	/nfs/dbraw/zinc/43/26/37/1345432637.db2.gz	SPTHXBCQUGOQAG-NRFANRHFSA-N	0	3	341.499	3.498	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)C[C@H]3CCCC3(F)F)C2)C1	ZINC001040353305	1345449823	/nfs/dbraw/zinc/44/98/23/1345449823.db2.gz	HTBLIGCRVXBESE-SJLPKXTDSA-N	0	3	338.442	3.150	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cnc4ccccc4c3)C2)C1	ZINC001040423389	1345490205	/nfs/dbraw/zinc/49/02/05/1345490205.db2.gz	TYQRGOTUHZEZMB-OAQYLSRUSA-N	0	3	335.451	3.349	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3[nH]ccc3-c3ccccc3)C2)C1	ZINC001040490562	1345516769	/nfs/dbraw/zinc/51/67/69/1345516769.db2.gz	BTXVMGHTIQUGCG-QFIPXVFZSA-N	0	3	347.462	3.243	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@@H]3CC4CCC3CC4)C2)C1	ZINC001040545900	1345540563	/nfs/dbraw/zinc/54/05/63/1345540563.db2.gz	XTNMJQIYIBSPJX-SDVBZNEUSA-N	0	3	328.500	3.151	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC2(C1)CCN(Cc1ccc(F)cc1)CC2	ZINC001040697621	1345567266	/nfs/dbraw/zinc/56/72/66/1345567266.db2.gz	WTBBJUNFNLEVGI-UHFFFAOYSA-N	0	3	340.442	3.054	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)C[C@H]3CCC(F)(F)C3)C2)CC1	ZINC001040725089	1345571347	/nfs/dbraw/zinc/57/13/47/1345571347.db2.gz	XDRWLNNNQNHSBO-MRXNPFEDSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cscc3Cl)C2)CC1	ZINC001040734977	1345572299	/nfs/dbraw/zinc/57/22/99/1345572299.db2.gz	FXRNSBYOIBZRLW-UHFFFAOYSA-N	0	3	336.888	3.353	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3occc3C(C)C)C2)CC1	ZINC001040818044	1345582248	/nfs/dbraw/zinc/58/22/48/1345582248.db2.gz	ZCCQMGQLCIXYPZ-UHFFFAOYSA-N	0	3	328.456	3.354	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)C3[C@@H]4CCCCCC[C@@H]34)C2)CC1	ZINC001040864822	1345589664	/nfs/dbraw/zinc/58/96/64/1345589664.db2.gz	KIBJOINKWGNMBU-QZTJIDSGSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@@H](CC)Cc3ccccc3)C2)CC1	ZINC001040869944	1345590784	/nfs/dbraw/zinc/59/07/84/1345590784.db2.gz	APKAKUFOTVPRQM-FQEVSTJZSA-N	0	3	338.495	3.203	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cccc(Cl)c3)C2)CC1	ZINC001040924361	1345601282	/nfs/dbraw/zinc/60/12/82/1345601282.db2.gz	UVUBZOFXJRSWKR-UHFFFAOYSA-N	0	3	330.859	3.291	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cc(C)c(F)c(C)c3)C2)CC1	ZINC001040943877	1345605603	/nfs/dbraw/zinc/60/56/03/1345605603.db2.gz	AXXWTPIJVBVLAY-UHFFFAOYSA-N	0	3	328.431	3.004	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@H](C)c3ccccc3C)C2)CC1	ZINC001040946715	1345606797	/nfs/dbraw/zinc/60/67/97/1345606797.db2.gz	GJJNHBFHCKKTFI-LJQANCHMSA-N	0	3	338.495	3.436	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccc(F)c4occc43)C2)CC1	ZINC001040946674	1345607005	/nfs/dbraw/zinc/60/70/05/1345607005.db2.gz	ZFPAJQXRMMVOAD-UHFFFAOYSA-N	0	3	340.398	3.133	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)C3(C)C(C)(C)C3(C)C)C2)CC1	ZINC001040954578	1345610240	/nfs/dbraw/zinc/61/02/40/1345610240.db2.gz	VSEDFKQIAADSCD-UHFFFAOYSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001041025815	1345627795	/nfs/dbraw/zinc/62/77/95/1345627795.db2.gz	GASDRYPTGBJLSM-FQEVSTJZSA-N	0	3	325.456	3.029	20	30		EGEDHN
Cc1ccc(CN2CC[C@]3(CCN(C(=O)[C@@H](C)C#N)C3)C2)c(Cl)c1	ZINC001041136228	1345658229	/nfs/dbraw/zinc/65/82/29/1345658229.db2.gz	GIZTYHMAAWIUNJ-KXBFYZLASA-N	0	3	345.874	3.233	20	30		EGEDHN
C=CC[C@H]1[NH2+]CCC[C@H]1Oc1c([O-])cc(Br)cc1F	ZINC001218451515	1373615789	/nfs/dbraw/zinc/61/57/89/1373615789.db2.gz	IHIBQQPYCYVAHV-DGCLKSJQSA-N	0	3	330.197	3.369	20	30		EGEDHN
C[C@H](c1ccc(F)cc1)N1CC[C@@]2(CCN(C(=O)C#CC3CC3)C2)C1	ZINC001041266464	1345690730	/nfs/dbraw/zinc/69/07/30/1345690730.db2.gz	SDEVGHWDOQALMW-IIBYNOLFSA-N	0	3	340.442	3.225	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)CC(C)(C)c3ccc(F)cc3)C2)C1	ZINC001041363725	1345710990	/nfs/dbraw/zinc/71/09/90/1345710990.db2.gz	VQDQKIKUPGMFCT-NRFANRHFSA-N	0	3	342.458	3.051	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3cc4cccc(C)c4s3)C2)C1	ZINC001041418429	1345724050	/nfs/dbraw/zinc/72/40/50/1345724050.db2.gz	KIUAIKRUMVJKOV-HXUWFJFHSA-N	0	3	338.476	3.381	20	30		EGEDHN
Cc1cocc1C(=O)N1CC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001041549239	1345761156	/nfs/dbraw/zinc/76/11/56/1345761156.db2.gz	NQBJLUCMDZMZCQ-OAQYLSRUSA-N	0	3	349.434	3.198	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccc(C)c(Cl)c3)C2)C1	ZINC001041625517	1345800536	/nfs/dbraw/zinc/80/05/36/1345800536.db2.gz	IWIJDUCEXKDKJH-IBGZPJMESA-N	0	3	330.859	3.210	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccccc3C3(C)CC3)C2)C1	ZINC001041669036	1345817155	/nfs/dbraw/zinc/81/71/55/1345817155.db2.gz	POJGRGXKOLBDFA-JOCHJYFZSA-N	0	3	336.479	3.299	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccc(C(F)F)cc3)C2)C1	ZINC001041739924	1345837544	/nfs/dbraw/zinc/83/75/44/1345837544.db2.gz	ACADGVOZHASAAB-IBGZPJMESA-N	0	3	332.394	3.186	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccc4nc(C)ccc4c3)C2)C1	ZINC001041751633	1345839914	/nfs/dbraw/zinc/83/99/14/1345839914.db2.gz	KOYUMUKURYUJJW-JOCHJYFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)CCc3cc(C)cc(C)c3)C2)C1	ZINC001041775485	1345846069	/nfs/dbraw/zinc/84/60/69/1345846069.db2.gz	PQSNNTZHTZVGEX-QFIPXVFZSA-N	0	3	338.495	3.184	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3oc4ccccc4c3Cl)C2)C1	ZINC001041786189	1345849376	/nfs/dbraw/zinc/84/93/76/1345849376.db2.gz	RXLOFYTUYGMFIW-IBGZPJMESA-N	0	3	342.826	3.257	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3cc(Cl)ccc3Cl)C2)C1	ZINC001041801256	1345855512	/nfs/dbraw/zinc/85/55/12/1345855512.db2.gz	IQZSCBSDDBTYCS-QGZVFWFLSA-N	0	3	337.250	3.165	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@H]2CCN(Cc3cccc(C#N)c3)[C@@H]2C1	ZINC001041906191	1345890091	/nfs/dbraw/zinc/89/00/91/1345890091.db2.gz	FOVXBRNWNNDXSD-RTBURBONSA-N	0	3	325.456	3.027	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3ccc(CCC)s3)C[C@H]21	ZINC001042080480	1345939510	/nfs/dbraw/zinc/93/95/10/1345939510.db2.gz	LXJYUVDENXFQHI-NVXWUHKLSA-N	0	3	330.497	3.260	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cccc(OCCC)c3)C[C@@H]21	ZINC001042079508	1345939525	/nfs/dbraw/zinc/93/95/25/1345939525.db2.gz	DSBXWZMAWGHXPQ-APWZRJJASA-N	0	3	328.456	3.198	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3c(C)noc3C(F)F)C[C@@H]21	ZINC001042100459	1345944040	/nfs/dbraw/zinc/94/40/40/1345944040.db2.gz	GGRVVGHRLGVBSA-STQMWFEESA-N	0	3	339.386	3.033	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cccc4ccc(C)nc43)C[C@@H]21	ZINC001042111665	1345947161	/nfs/dbraw/zinc/94/71/61/1345947161.db2.gz	MJLXYSYVTZUWSR-XLIONFOSSA-N	0	3	347.462	3.103	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc(-n4cccc4)cc3)C[C@@H]21	ZINC001042140523	1345954203	/nfs/dbraw/zinc/95/42/03/1345954203.db2.gz	ATNKULHRMZJTPJ-RXVVDRJESA-N	0	3	347.462	3.037	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3c(C)[nH]c4ccccc43)C[C@H]21	ZINC001042142028	1345955185	/nfs/dbraw/zinc/95/51/85/1345955185.db2.gz	KPSYNXZRZBRVKB-VQIMIIECSA-N	0	3	335.451	3.036	20	30		EGEDHN
C#CCN1CC[C@H]2CCN(C(=O)Cc3ccc(C4CCC4)cc3)C[C@H]21	ZINC001042167421	1345963047	/nfs/dbraw/zinc/96/30/47/1345963047.db2.gz	LSDWOOHGKWJEMV-LEWJYISDSA-N	0	3	336.479	3.053	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3CCN(C(=O)[C@H]4C[C@H]5C[C@H]5C4)C[C@H]32)c1	ZINC001042196052	1345978373	/nfs/dbraw/zinc/97/83/73/1345978373.db2.gz	GIVMXCMCQNGPSW-WRTQPQOASA-N	0	3	349.478	3.027	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc(C)c(Cl)c3)C[C@H]21	ZINC001042216009	1345989156	/nfs/dbraw/zinc/98/91/56/1345989156.db2.gz	KOORQGNOGHSGEY-CRAIPNDOSA-N	0	3	330.859	3.208	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]3CCN(Cc4ccc(C#N)cc4)[C@H]3C2)C1	ZINC001042224310	1345994668	/nfs/dbraw/zinc/99/46/68/1345994668.db2.gz	LKEMDJRSLCFCNI-PMACEKPBSA-N	0	3	349.478	3.337	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]3CCN(Cc4cccnc4C)[C@@H]3C2)C1	ZINC001042224820	1345995033	/nfs/dbraw/zinc/99/50/33/1345995033.db2.gz	RLIFAOCRFUHDMT-PKOBYXMFSA-N	0	3	339.483	3.169	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]3CCN(Cc4ncccc4C)[C@H]3C2)C1	ZINC001042228072	1345996954	/nfs/dbraw/zinc/99/69/54/1345996954.db2.gz	PLZYHDCDZAKNAP-HKUYNNGSSA-N	0	3	339.483	3.169	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3csc(-c4ccoc4)n3)C[C@H]21	ZINC001042271992	1346014716	/nfs/dbraw/zinc/01/47/16/1346014716.db2.gz	JSOFXAFXDANENQ-CZUORRHYSA-N	0	3	343.452	3.126	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cc(Cl)ccc3C)C[C@H]21	ZINC001042275151	1346014899	/nfs/dbraw/zinc/01/48/99/1346014899.db2.gz	RHAWJGVUVYTNHI-CRAIPNDOSA-N	0	3	330.859	3.208	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3ncsc3C(C)C)C[C@H]21	ZINC001042308976	1346027464	/nfs/dbraw/zinc/02/74/64/1346027464.db2.gz	IQLJUZHAABQKFN-LSDHHAIUSA-N	0	3	333.501	3.379	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3cc4nc(C)ccc4o3)C[C@H]21	ZINC001042324538	1346033516	/nfs/dbraw/zinc/03/35/16/1346033516.db2.gz	WESVGJYTSYYOTR-NVXWUHKLSA-N	0	3	339.439	3.249	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)CCc3c[nH]c4ccccc34)C[C@H]21	ZINC001042337043	1346042945	/nfs/dbraw/zinc/04/29/45/1346042945.db2.gz	CSMKPVWOQFVOIS-DYESRHJHSA-N	0	3	349.478	3.047	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cc(C)nc4ccccc43)C[C@H]21	ZINC001042339518	1346044330	/nfs/dbraw/zinc/04/43/30/1346044330.db2.gz	XUMXDYRGQLVYPC-LAUBAEHRSA-N	0	3	347.462	3.103	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc4[nH]c(C)c(C)c4c3)C[C@H]21	ZINC001042348197	1346049061	/nfs/dbraw/zinc/04/90/61/1346049061.db2.gz	HFEGPZSQGVABSR-LAUBAEHRSA-N	0	3	349.478	3.344	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc(C)c4c3CCC4)C[C@H]21	ZINC001042372672	1346062299	/nfs/dbraw/zinc/06/22/99/1346062299.db2.gz	ZQEIMRDWURBDMT-LAUBAEHRSA-N	0	3	336.479	3.043	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc(C(C)(F)F)cc3)C[C@@H]21	ZINC001042380502	1346065646	/nfs/dbraw/zinc/06/56/46/1346065646.db2.gz	UCFYLSDFCBVMEH-YJBOKZPZSA-N	0	3	346.421	3.358	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@H](NCc3ccccc3C#N)C[C@H]2C)co1	ZINC001044570738	1346371525	/nfs/dbraw/zinc/37/15/25/1346371525.db2.gz	HZCVFGHAHRJRMW-KUHUBIRLSA-N	0	3	337.423	3.243	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)C1(F)CCCC1	ZINC001044655037	1346394710	/nfs/dbraw/zinc/39/47/10/1346394710.db2.gz	WFWLNCJQZCKHHX-QAPCUYQASA-N	0	3	343.446	3.310	20	30		EGEDHN
C[C@H]1C[C@H](NCc2cc(F)ccc2C#N)CCN1C(=O)CC1(C)CC1	ZINC001044689427	1346403848	/nfs/dbraw/zinc/40/38/48/1346403848.db2.gz	OVJIZFOYVIGQDH-KBXCAEBGSA-N	0	3	343.446	3.357	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)CC(C)(F)F	ZINC001044732642	1346415590	/nfs/dbraw/zinc/41/55/90/1346415590.db2.gz	DSVIOCWBCGGSAC-CJNGLKHVSA-N	0	3	335.398	3.073	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC[C@H]1CNCc1cncs1	ZINC001045052266	1346487263	/nfs/dbraw/zinc/48/72/63/1346487263.db2.gz	ROEYPDHHNLUDSX-LBPRGKRZSA-N	0	3	327.881	3.002	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H]1CNCc1ccc(C#N)cc1F)C(C)(C)C	ZINC001045093326	1346493642	/nfs/dbraw/zinc/49/36/42/1346493642.db2.gz	UVGVEXZRKPMTLC-PBHICJAKSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC1(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)s2)CCCC1	ZINC001045139400	1346502343	/nfs/dbraw/zinc/50/23/43/1346502343.db2.gz	CBVWPPHPXCYRNI-AWEZNQCLSA-N	0	3	331.485	3.281	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]2CNCc2cccc(Cl)n2)C1	ZINC001045190685	1346525019	/nfs/dbraw/zinc/52/50/19/1346525019.db2.gz	JIYXBTMHGWYRMG-HNNXBMFYSA-N	0	3	333.863	3.172	20	30		EGEDHN
Cc1cc(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)s2)cs1	ZINC001045240791	1346538831	/nfs/dbraw/zinc/53/88/31/1346538831.db2.gz	GEAVLGIWTWLGOL-AWEZNQCLSA-N	0	3	345.493	3.384	20	30		EGEDHN
CC1(NC(=O)[C@@H]2CC=CCC2)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045364462	1346575234	/nfs/dbraw/zinc/57/52/34/1346575234.db2.gz	HMUYHBHJPPVPBV-LJQANCHMSA-N	0	3	337.467	3.385	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2cc(Cl)c(Cl)n2C)CC1	ZINC001045457274	1346598597	/nfs/dbraw/zinc/59/85/97/1346598597.db2.gz	WDTZMXHVYQDSDO-UHFFFAOYSA-N	0	3	330.259	3.102	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2cc(C)n(C(CC)CC)n2)CC1	ZINC001045482144	1346605372	/nfs/dbraw/zinc/60/53/72/1346605372.db2.gz	FIALUOZMOOPYNT-UHFFFAOYSA-N	0	3	332.492	3.323	20	30		EGEDHN
C=C1CCC(C(=O)NC2(C)CCN(CCc3ccns3)CC2)CC1	ZINC001045546876	1346626129	/nfs/dbraw/zinc/62/61/29/1346626129.db2.gz	ZXGCYPJPWHDUBJ-UHFFFAOYSA-N	0	3	347.528	3.403	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1ccc(C(F)F)cc1	ZINC001045733564	1346682749	/nfs/dbraw/zinc/68/27/49/1346682749.db2.gz	LXMGKDXQOLPDOI-XYPHTWIQSA-N	0	3	347.409	3.349	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)Cc1ccsc1)C2	ZINC001045909251	1346746458	/nfs/dbraw/zinc/74/64/58/1346746458.db2.gz	KYHZDTOHYNMQOK-LJQANCHMSA-N	0	3	330.497	3.019	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCCC[C@@]2(CCN(Cc3ccccc3F)C2)C1	ZINC001045925014	1346761443	/nfs/dbraw/zinc/76/14/43/1346761443.db2.gz	QATOPBJBCBZHBW-UZLBHIALSA-N	0	3	343.446	3.190	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)C[C@@H]1C=CCCC1)C2	ZINC001045947945	1346783499	/nfs/dbraw/zinc/78/34/99/1346783499.db2.gz	QCUPNACVAUCZHE-TZIWHRDSSA-N	0	3	328.500	3.461	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cncc(Cl)c1)C2	ZINC001045973842	1346809919	/nfs/dbraw/zinc/80/99/19/1346809919.db2.gz	PXKMTUGFKQDIBF-IBGZPJMESA-N	0	3	345.874	3.077	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc(Cl)s1)C2	ZINC001045982166	1346821032	/nfs/dbraw/zinc/82/10/32/1346821032.db2.gz	QBWBAVCGXPUKTO-QGZVFWFLSA-N	0	3	336.888	3.353	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)Cc1ccccc1F)C2	ZINC001045982691	1346821439	/nfs/dbraw/zinc/82/14/39/1346821439.db2.gz	DNUZQCYDSVJUGU-NRFANRHFSA-N	0	3	342.458	3.096	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc(OCC)cc1)C2	ZINC001045983013	1346822783	/nfs/dbraw/zinc/82/27/83/1346822783.db2.gz	HTTOJYOHBFDZCE-OAQYLSRUSA-N	0	3	340.467	3.037	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc(F)cc1Cl)C2	ZINC001045983771	1346823797	/nfs/dbraw/zinc/82/37/97/1346823797.db2.gz	RGDGARZFVBPNSM-LJQANCHMSA-N	0	3	348.849	3.431	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cccc3c1CCC3)C2	ZINC001045986276	1346827636	/nfs/dbraw/zinc/82/76/36/1346827636.db2.gz	MWIUDRRERYGVDW-QFIPXVFZSA-N	0	3	336.479	3.127	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@]2(C)CCN(Cc3ccc(C)c(C)c3)C2)c1	ZINC001046605414	1347036054	/nfs/dbraw/zinc/03/60/54/1347036054.db2.gz	SUDPJLZPPZBTID-JOCHJYFZSA-N	0	3	347.462	3.074	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@]2(C)CCN(Cc3ccc(CC)cc3)C2)c1	ZINC001046605235	1347036507	/nfs/dbraw/zinc/03/65/07/1347036507.db2.gz	QRHGLUKOCATRMU-JOCHJYFZSA-N	0	3	347.462	3.020	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@]2(C)CCN([C@@H](C)c3ccccc3)C2)cn1	ZINC001046778534	1347095923	/nfs/dbraw/zinc/09/59/23/1347095923.db2.gz	HDKJCTMSTVXUJF-KKSFZXQISA-N	0	3	333.435	3.018	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2ccc(C)c(F)c2)C1	ZINC001046956067	1347164108	/nfs/dbraw/zinc/16/41/08/1347164108.db2.gz	LNLOQOJSPOQLPQ-HNNXBMFYSA-N	0	3	340.389	3.397	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2occc2Cl)C1	ZINC001046969067	1347170768	/nfs/dbraw/zinc/17/07/68/1347170768.db2.gz	VNECYJIAQHHUCR-NSHDSACASA-N	0	3	332.778	3.196	20	30		EGEDHN
O=C(N[C@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1cccc(Cl)c1)C2)C1CC1	ZINC001047007474	1347183930	/nfs/dbraw/zinc/18/39/30/1347183930.db2.gz	KPHKHBJTXVCINJ-SNRMKQJTSA-N	0	3	342.870	3.071	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H]2C[C@H]3C[C@@H](C2)N(CC#Cc2ccccc2)C3)o1	ZINC001047018472	1347188922	/nfs/dbraw/zinc/18/89/22/1347188922.db2.gz	JHBHBCCMTOKUIK-UFYCRDLUSA-N	0	3	348.446	3.222	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)N(Cc2ocnc2C)C3)CC1	ZINC001047139306	1347217987	/nfs/dbraw/zinc/21/79/87/1347217987.db2.gz	PXDKKWBWYDBVAJ-JQHSSLGASA-N	0	3	343.471	3.199	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)N(Cc2cc(C)ns2)C3)C1	ZINC001047142631	1347218852	/nfs/dbraw/zinc/21/88/52/1347218852.db2.gz	HAOMUIYYQISJQB-XHSDSOJGSA-N	0	3	345.512	3.277	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)CC(C)(C)C3CC3)C2)CC1	ZINC001047237387	1347264084	/nfs/dbraw/zinc/26/40/84/1347264084.db2.gz	QRKVYGAMIILVCM-GOSISDBHSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)C[C@@H]3C[C@H]3C3CC3)C2)CC1	ZINC001047246904	1347272155	/nfs/dbraw/zinc/27/21/55/1347272155.db2.gz	BCWWPKSIHIIFJK-AABGKKOBSA-N	0	3	328.500	3.006	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)[C@H](C)C(F)(F)F)C2)CC1	ZINC001047248529	1347273325	/nfs/dbraw/zinc/27/33/25/1347273325.db2.gz	RPJFIKLBJONHRA-HOCLYGCPSA-N	0	3	344.421	3.159	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)C3(CF)CCC3)C2)CC1	ZINC001047259197	1347281860	/nfs/dbraw/zinc/28/18/60/1347281860.db2.gz	MDDDYINYUNXOGG-SFHVURJKSA-N	0	3	334.479	3.100	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@@H]3C[C@H]3CC(C)C)C2)CC1	ZINC001047260204	1347282726	/nfs/dbraw/zinc/28/27/26/1347282726.db2.gz	YESVTUWHIZQRDR-XUVXKRRUSA-N	0	3	330.516	3.252	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)CCC2CC2)C1	ZINC001047766267	1347364710	/nfs/dbraw/zinc/36/47/10/1347364710.db2.gz	NUPUMTUGPYQIEQ-DNVCBOLYSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)CCC2CCC2)C1	ZINC001047787966	1347371538	/nfs/dbraw/zinc/37/15/38/1347371538.db2.gz	VAPGQHUHNCEHFY-JXFKEZNVSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@H]([C@@H](C)NCc2ccccc2C#N)C1	ZINC001047788296	1347371544	/nfs/dbraw/zinc/37/15/44/1347371544.db2.gz	DFMIWFPTTSVMSG-PBHICJAKSA-N	0	3	329.419	3.148	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H]([C@@H](C)NCc2nccs2)C1	ZINC001047852059	1347388874	/nfs/dbraw/zinc/38/88/74/1347388874.db2.gz	DHGFGHBYBSQUKC-DGCLKSJQSA-N	0	3	341.908	3.248	20	30		EGEDHN
C[C@@H](NCc1cc(F)ccc1C#N)[C@@H]1CCN(C(=O)C2(C)CCC2)C1	ZINC001047934707	1347415512	/nfs/dbraw/zinc/41/55/12/1347415512.db2.gz	CSRYJXILXBDEFE-GDBMZVCRSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)C(C)(C)C(F)F)C1	ZINC001047966688	1347427283	/nfs/dbraw/zinc/42/72/83/1347427283.db2.gz	SRUIPVFJBQFMRX-CZUORRHYSA-N	0	3	349.425	3.176	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2cc(F)cc3ccncc32)C1	ZINC001079714749	1357354784	/nfs/dbraw/zinc/35/47/84/1357354784.db2.gz	JSBXXCOOWZSTLJ-FZKQIMNGSA-N	0	3	327.403	3.000	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2cccs2)C[C@@H]1CNCc1ccccc1C#N	ZINC001048118695	1347472840	/nfs/dbraw/zinc/47/28/40/1347472840.db2.gz	MUFVJEHQGKMURW-PBHICJAKSA-N	0	3	339.464	3.118	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccsc2)C[C@@H]1CNCc1ccccc1C#N	ZINC001048121825	1347474442	/nfs/dbraw/zinc/47/44/42/1347474442.db2.gz	GLWQRZRNWLJSQO-KDOFPFPSSA-N	0	3	339.464	3.118	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@@H](CNCc2nccs2)[C@H](C)C1	ZINC001048264782	1347505832	/nfs/dbraw/zinc/50/58/32/1347505832.db2.gz	DAQBPYVDJSPWBN-DGCLKSJQSA-N	0	3	341.908	3.106	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@@H](C)[C@@H](CNCc2cscn2)C1	ZINC001048272252	1347507971	/nfs/dbraw/zinc/50/79/71/1347507971.db2.gz	WZRDIUVZXQDCKH-YPMHNXCESA-N	0	3	341.908	3.106	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2c(F)ccc3ccncc32)C1	ZINC001079737487	1357361878	/nfs/dbraw/zinc/36/18/78/1357361878.db2.gz	OSGJCABYDQCZID-CXAGYDPISA-N	0	3	327.403	3.000	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2CC#Cc1ccccc1	ZINC001048497921	1347567867	/nfs/dbraw/zinc/56/78/67/1347567867.db2.gz	ADMQJZNKXYUTDI-QNDFHXLGSA-N	0	3	336.479	3.053	20	30		EGEDHN
C=C(C)CN1CCC(N(Cc2ccccn2)C(=O)c2ccc[nH]2)CC1	ZINC001048625834	1347624135	/nfs/dbraw/zinc/62/41/35/1347624135.db2.gz	ONKZPKOUUKBMFN-UHFFFAOYSA-N	0	3	338.455	3.093	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)[C@@H]2CC23CCC3)CC1	ZINC001048626465	1347624236	/nfs/dbraw/zinc/62/42/36/1347624236.db2.gz	PHKABJKWVPBALR-IBGZPJMESA-N	0	3	339.483	3.251	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)c2[nH]ccc2C)CC1	ZINC001048627547	1347624752	/nfs/dbraw/zinc/62/47/52/1347624752.db2.gz	MHSOTZCDNVQJOM-UHFFFAOYSA-N	0	3	338.455	3.011	20	30		EGEDHN
O=C(C=C1CCCCC1)N1C[C@H]2CN(CC#Cc3ccccc3)C[C@H]2C1	ZINC001048709853	1347645461	/nfs/dbraw/zinc/64/54/61/1347645461.db2.gz	SSDOJFJHLTWCGR-SZPZYZBQSA-N	0	3	348.490	3.319	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1C[C@H]2CN(C[C@H](F)CC)C[C@H]2C1	ZINC001048899236	1347680314	/nfs/dbraw/zinc/68/03/14/1347680314.db2.gz	LUQGMYZYCRWTON-IXDOHACOSA-N	0	3	346.446	3.003	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)/C=C/C2CC2)c1	ZINC001049399255	1347821389	/nfs/dbraw/zinc/82/13/89/1347821389.db2.gz	WSYAEJQHOAAVRA-MQFDZRFESA-N	0	3	335.451	3.090	20	30		EGEDHN
Cc1[nH]ccc1C(=O)N1CCC[C@H]2[C@H]1CCN2Cc1cccc(C#N)c1	ZINC001049405697	1347828075	/nfs/dbraw/zinc/82/80/75/1347828075.db2.gz	ISJHDXFRGJKWDY-VQTJNVASSA-N	0	3	348.450	3.074	20	30		EGEDHN
Cc1[nH]ccc1C(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049406839	1347829813	/nfs/dbraw/zinc/82/98/13/1347829813.db2.gz	NQMQGLLPPYPZFH-UXHICEINSA-N	0	3	348.450	3.074	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1nc(C(C)C)oc1C	ZINC001049468409	1347863971	/nfs/dbraw/zinc/86/39/71/1347863971.db2.gz	HNGDMRLCFRVKPI-JKSUJKDBSA-N	0	3	331.460	3.361	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1coc2cc(F)ccc12	ZINC001049475155	1347866986	/nfs/dbraw/zinc/86/69/86/1347866986.db2.gz	NWQKGQZJAWMDMF-MSOLQXFVSA-N	0	3	342.414	3.366	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1cn(CC)nc1C1CC1	ZINC001049501891	1347881149	/nfs/dbraw/zinc/88/11/49/1347881149.db2.gz	LSDKWGCWISJYDF-MSOLQXFVSA-N	0	3	342.487	3.035	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1c(C)noc1C(C)C	ZINC001049531248	1347894333	/nfs/dbraw/zinc/89/43/33/1347894333.db2.gz	IWILCAYKLPMIQO-JKSUJKDBSA-N	0	3	331.460	3.361	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(F)cc2ccoc21	ZINC001049565853	1347912975	/nfs/dbraw/zinc/91/29/75/1347912975.db2.gz	XMUWLGXILQNSJG-DLBZAZTESA-N	0	3	328.387	3.437	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](c1ccccc1)C1CC1	ZINC001049594139	1347927522	/nfs/dbraw/zinc/92/75/22/1347927522.db2.gz	PHYIQDYOJPKMEF-NJDAHSKKSA-N	0	3	336.479	3.269	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H]1CCCN2C(=O)CCc1ccc(C(C)C)cc1	ZINC001049594750	1347927614	/nfs/dbraw/zinc/92/76/14/1347927614.db2.gz	RWBUMOXGJGXPEJ-RTWAWAEBSA-N	0	3	338.495	3.441	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1nc2ccccc2cc1C	ZINC001049606704	1347934063	/nfs/dbraw/zinc/93/40/63/1347934063.db2.gz	URIMXWJSMHVOEP-OALUTQOASA-N	0	3	335.451	3.408	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)CCc1ccc(C)cc1C	ZINC001049620653	1347938415	/nfs/dbraw/zinc/93/84/15/1347938415.db2.gz	LKLLGWJIFMHAEH-NHCUHLMSSA-N	0	3	338.495	3.325	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)CCSC	ZINC001133376922	1375955880	/nfs/dbraw/zinc/95/58/80/1375955880.db2.gz	GZNYWBLUALCBDH-UHFFFAOYSA-N	0	3	338.904	3.035	20	30		EGEDHN
CC1(C(=O)N2CCC[C@@H]3[C@@H]2CCN3Cc2cccc(C#N)c2)CCC1	ZINC001049646580	1347953246	/nfs/dbraw/zinc/95/32/46/1347953246.db2.gz	PDGVCDZLYMNDDW-MOPGFXCFSA-N	0	3	337.467	3.314	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)C(C1CCC1)C1CCC1	ZINC001049674082	1347966717	/nfs/dbraw/zinc/96/67/17/1347966717.db2.gz	BOTDKUPBBAQZLH-MOPGFXCFSA-N	0	3	328.500	3.291	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@H]3[C@@H]2CCN3Cc2ccc(C#N)cc2)CC1	ZINC001049694957	1347976627	/nfs/dbraw/zinc/97/66/27/1347976627.db2.gz	GDRCJQYJGORCJT-OALUTQOASA-N	0	3	337.467	3.314	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@H]3[C@H]2CCN3Cc2cccc(C#N)c2)CC1	ZINC001049704318	1347982274	/nfs/dbraw/zinc/98/22/74/1347982274.db2.gz	PLUFRIYPMNJNFF-RBUKOAKNSA-N	0	3	337.467	3.314	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)C(C)(C)c1cccc(F)c1	ZINC001049716556	1347989161	/nfs/dbraw/zinc/98/91/61/1347989161.db2.gz	FLGKRPUQKDVNQR-MSOLQXFVSA-N	0	3	330.447	3.355	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@H]2[C@H]1CCN2Cc1cccc(C#N)c1	ZINC001049734070	1347993703	/nfs/dbraw/zinc/99/37/03/1347993703.db2.gz	CWFAGCLMQVSIPS-YSTOQKLRSA-N	0	3	337.467	3.170	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1cccc(Cl)c1F	ZINC001049747191	1347998298	/nfs/dbraw/zinc/99/82/98/1347998298.db2.gz	IEKJWROSMCMYKK-IAGOWNOFSA-N	0	3	348.849	3.110	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(F)cc2cccnc21	ZINC001049766570	1348009878	/nfs/dbraw/zinc/00/98/78/1348009878.db2.gz	DFCPKZMSEMLQJN-ZWKOTPCHSA-N	0	3	339.414	3.239	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1scnc1C(C)(C)C	ZINC001049772394	1348013867	/nfs/dbraw/zinc/01/38/67/1348013867.db2.gz	GTPYEYTZTQPZQD-HUUCEWRRSA-N	0	3	345.512	3.143	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc([C@H](C)CC)no1	ZINC001049772277	1348014028	/nfs/dbraw/zinc/01/40/28/1348014028.db2.gz	YZNNMEYJYFQSNN-DJIMGWMZSA-N	0	3	331.460	3.443	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1c[nH]c2cc(C)ccc12	ZINC001049778064	1348017247	/nfs/dbraw/zinc/01/72/47/1348017247.db2.gz	MOSFKMGZDGCQFL-RTWAWAEBSA-N	0	3	349.478	3.107	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cnn(C(C)C)c1C1CC1	ZINC001049837755	1348050161	/nfs/dbraw/zinc/05/01/61/1348050161.db2.gz	RFYMNQKPLNINSC-ROUUACIJSA-N	0	3	342.487	3.206	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(C)n(CC2CC2)c1C	ZINC001049848238	1348057355	/nfs/dbraw/zinc/05/73/55/1348057355.db2.gz	KJWPDHFLBUXOBN-UXHICEINSA-N	0	3	341.499	3.380	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1cccc2ccccc21	ZINC001049853081	1348059733	/nfs/dbraw/zinc/05/97/33/1348059733.db2.gz	CABLJABSYNKGOV-VXKWHMMOSA-N	0	3	346.474	3.471	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1oc2ccccc2c1C	ZINC001049877018	1348081902	/nfs/dbraw/zinc/08/19/02/1348081902.db2.gz	OTLRXJYSVJEPCM-MSOLQXFVSA-N	0	3	336.435	3.443	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)CC1C2CC3CC(C2)CC1C3	ZINC001049902447	1348102028	/nfs/dbraw/zinc/10/20/28/1348102028.db2.gz	AONRQELAWYJVQR-OYZZJKLHSA-N	0	3	340.511	3.147	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C[C@@H](C)c1ccc(F)cc1	ZINC001049907223	1348104642	/nfs/dbraw/zinc/10/46/42/1348104642.db2.gz	BOKZPZSXZOZXLQ-AYOQOUSVSA-N	0	3	328.431	3.018	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cnc(C(C)(C)C)nc1	ZINC001049927315	1348118033	/nfs/dbraw/zinc/11/80/33/1348118033.db2.gz	JCFATPKZBNQWSP-DLBZAZTESA-N	0	3	342.487	3.029	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)COc3cccc(C(C)C)c3)[C@@H]2C1	ZINC001050048947	1348165402	/nfs/dbraw/zinc/16/54/02/1348165402.db2.gz	CPZSDIJXAXWKKG-AZUAARDMSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3cncc(Cl)c3C)[C@@H]2C1	ZINC001050068358	1348171634	/nfs/dbraw/zinc/17/16/34/1348171634.db2.gz	LMXDCYAHWIIKQV-WMLDXEAASA-N	0	3	333.863	3.156	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)c3cn(CC)c4ccccc34)[C@@H]2C1	ZINC001050088447	1348178946	/nfs/dbraw/zinc/17/89/46/1348178946.db2.gz	CPNQRZPSVCIXMI-LAUBAEHRSA-N	0	3	349.478	3.221	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3cccc4c3O[C@H](C)C4)[C@@H]2C1	ZINC001050098377	1348182832	/nfs/dbraw/zinc/18/28/32/1348182832.db2.gz	NILNRPHVDAPNOJ-HHXXYDBFSA-N	0	3	340.467	3.123	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3sc(CC)nc3C)[C@@H]2C1	ZINC001050160960	1348200485	/nfs/dbraw/zinc/20/04/85/1348200485.db2.gz	CKFQOEVTCISCLQ-LSDHHAIUSA-N	0	3	333.501	3.126	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)CC4CCC4)C3)CC2)c1	ZINC001050473561	1348274020	/nfs/dbraw/zinc/27/40/20/1348274020.db2.gz	WVDNRMOOKWSCFZ-UHFFFAOYSA-N	0	3	337.467	3.173	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H]3CCCc4ccccc43)C2)CC1	ZINC001050563158	1348290685	/nfs/dbraw/zinc/29/06/85/1348290685.db2.gz	HIAPNAYZJAGSEN-FQEVSTJZSA-N	0	3	336.479	3.054	20	30		EGEDHN
Cc1coc(C(=O)N2CC3(C2)CCN(Cc2cccc(C#N)c2)CC3)c1	ZINC001050628526	1348308123	/nfs/dbraw/zinc/30/81/23/1348308123.db2.gz	RFDNOPKTYZRDIM-UHFFFAOYSA-N	0	3	349.434	3.198	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc(OC(C)C)cc3)C2)CC1	ZINC001050746278	1348347038	/nfs/dbraw/zinc/34/70/38/1348347038.db2.gz	IAYXNXXZAXCNSR-UHFFFAOYSA-N	0	3	340.467	3.035	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3cc(CC)c(CCC)s3)C2)CC1	ZINC001050752667	1348348797	/nfs/dbraw/zinc/34/87/97/1348348797.db2.gz	RAVXOXUEUUPLQZ-UHFFFAOYSA-N	0	3	344.524	3.434	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H](C)c3cccc(Cl)c3)C2)CC1	ZINC001050759711	1348350530	/nfs/dbraw/zinc/35/05/30/1348350530.db2.gz	QMOOQDLGCQRUJV-MRXNPFEDSA-N	0	3	344.886	3.391	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3ccc(C)s3)cccc2C1	ZINC001051276792	1348414417	/nfs/dbraw/zinc/41/44/17/1348414417.db2.gz	JEHIMNCKDARCCJ-UHFFFAOYSA-N	0	3	338.476	3.368	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3cc(C)c(C)o3)cccc2C1	ZINC001051283510	1348417427	/nfs/dbraw/zinc/41/74/27/1348417427.db2.gz	CQSWPJDDFZBOBH-UHFFFAOYSA-N	0	3	336.435	3.208	20	30		EGEDHN
C=C(C)CCN1CCN([C@H]2CCN(C(=O)C3(CC)CCCC3)C2)CC1	ZINC001052103154	1348502664	/nfs/dbraw/zinc/50/26/64/1348502664.db2.gz	NQQYSKLAKFIYMB-IBGZPJMESA-N	0	3	347.547	3.142	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@H](NC(=O)C3(C4CC4)CC3)CC2)c1	ZINC001052470741	1348548822	/nfs/dbraw/zinc/54/88/22/1348548822.db2.gz	KEUVZMZOLQKSEA-LJQANCHMSA-N	0	3	337.467	3.219	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)c1cccc(F)c1	ZINC001133563579	1376090900	/nfs/dbraw/zinc/09/09/00/1376090900.db2.gz	JWEWPYFXCSUKKB-NWDGAFQWSA-N	0	3	343.240	3.221	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cc(C)n(C(CC)CC)n2)CC1	ZINC001052512371	1348562908	/nfs/dbraw/zinc/56/29/08/1348562908.db2.gz	IYXCJXBSJVERHK-QGZVFWFLSA-N	0	3	344.503	3.160	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc(OCC)c(C)c2)CC1	ZINC001052762047	1348667677	/nfs/dbraw/zinc/66/76/77/1348667677.db2.gz	TWNRKVVITMYNSH-GOSISDBHSA-N	0	3	328.456	3.001	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@H]2CCCN(C/C=C\Cl)CC2)cc1	ZINC001052772662	1348673492	/nfs/dbraw/zinc/67/34/92/1348673492.db2.gz	BRYLINZWOJAALH-OSCZDJLXSA-N	0	3	346.858	3.035	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@@]2(c3ccccc3)CC2(C)C)CC1	ZINC001052818577	1348689037	/nfs/dbraw/zinc/68/90/37/1348689037.db2.gz	UHYFMYDPLZVELV-UGKGYDQZSA-N	0	3	338.495	3.348	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@H](C)c2ccc(Cl)s2)CC1	ZINC001052850163	1348701698	/nfs/dbraw/zinc/70/16/98/1348701698.db2.gz	NJTNERFEHNSYQY-ZIAGYGMSSA-N	0	3	338.904	3.499	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)Cc2c[nH]c3cccc(C)c23)CC1	ZINC001052870637	1348711990	/nfs/dbraw/zinc/71/19/90/1348711990.db2.gz	WCUOHPJKXMPBRD-SFHVURJKSA-N	0	3	337.467	3.013	20	30		EGEDHN
CCC(=O)N1CCC[C@H]([C@@H]2CCCN(CC#Cc3ccccc3)C2)C1	ZINC001052996519	1348793234	/nfs/dbraw/zinc/79/32/34/1348793234.db2.gz	JQCCIGJXYWWYJV-RTWAWAEBSA-N	0	3	338.495	3.399	20	30		EGEDHN
CCC(=O)N1CCC[C@@H]([C@@H]2CCCN(Cc3ccccc3C#N)C2)C1	ZINC001052998365	1348795887	/nfs/dbraw/zinc/79/58/87/1348795887.db2.gz	YCZJABABOQQJAB-WOJBJXKFSA-N	0	3	339.483	3.419	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cccs2)C1	ZINC001053062914	1348874589	/nfs/dbraw/zinc/87/45/89/1348874589.db2.gz	FCMPCZNSKCKMON-IRXDYDNUSA-N	0	3	330.497	3.478	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cc(Cl)c[nH]2)C1	ZINC001053070412	1348885179	/nfs/dbraw/zinc/88/51/79/1348885179.db2.gz	YKOBMQDMVYBPSU-RHSMWYFYSA-N	0	3	333.863	3.008	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)/C=C(/C)C2CC2)C1	ZINC001053072328	1348888562	/nfs/dbraw/zinc/88/85/62/1348888562.db2.gz	QFTONUVENPPDIE-GGKMABOFSA-N	0	3	328.500	3.459	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)/C=C/c2ccc[nH]2)C1	ZINC001053080102	1348900987	/nfs/dbraw/zinc/90/09/87/1348900987.db2.gz	AKLVUHXTWKQIML-FKRMPVFOSA-N	0	3	339.483	3.144	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)C2C=CC=CC=C2)C1	ZINC001053085128	1348906244	/nfs/dbraw/zinc/90/62/44/1348906244.db2.gz	CCROATSZKKZKFA-LEWJYISDSA-N	0	3	338.495	3.401	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(F)ccc2F)C1	ZINC001053087288	1348910759	/nfs/dbraw/zinc/91/07/59/1348910759.db2.gz	JUNQWFMGSZBLBW-BEFAXECRSA-N	0	3	346.421	3.305	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2[nH]ccc2C2CC2)C1	ZINC001053087616	1348911848	/nfs/dbraw/zinc/91/18/48/1348911848.db2.gz	MSAJQTHTDMKCJL-PKOBYXMFSA-N	0	3	339.483	3.232	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2onc(C)c2C)C1	ZINC001053088413	1348913149	/nfs/dbraw/zinc/91/31/49/1348913149.db2.gz	UYGGXRPTKQJFNW-QZTJIDSGSA-N	0	3	343.471	3.021	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(F)c(F)c2)C1	ZINC001053088436	1348913453	/nfs/dbraw/zinc/91/34/53/1348913453.db2.gz	VIYVMZYHRVATHZ-APWZRJJASA-N	0	3	346.421	3.305	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cc3occc3[nH]2)C1	ZINC001053088170	1348913643	/nfs/dbraw/zinc/91/36/43/1348913643.db2.gz	ZJYVIZYWAIJJKY-QAPCUYQASA-N	0	3	339.439	3.101	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)Cc2ccc(C)cc2)C1	ZINC001053091121	1348917421	/nfs/dbraw/zinc/91/74/21/1348917421.db2.gz	LCDYWRCAMPZLJC-NHCUHLMSSA-N	0	3	338.495	3.264	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cc[nH]c2C2CC2)C1	ZINC001053096058	1348925681	/nfs/dbraw/zinc/92/56/81/1348925681.db2.gz	ONRASGNVUCAXCR-IEBWSBKVSA-N	0	3	339.483	3.232	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccccc2OC)C1	ZINC001053106931	1348944930	/nfs/dbraw/zinc/94/49/30/1348944930.db2.gz	XELACKBJDPBBSG-IEBWSBKVSA-N	0	3	340.467	3.035	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cccc(OC)c2)C1	ZINC001053107023	1348945326	/nfs/dbraw/zinc/94/53/26/1348945326.db2.gz	YGIWOGGCPYUTEO-AZUAARDMSA-N	0	3	340.467	3.035	20	30		EGEDHN
C=CCCN1Cc2ccccc2C[C@H]1CNC(=O)c1ccc(Cl)[nH]1	ZINC001054052439	1349140447	/nfs/dbraw/zinc/14/04/47/1349140447.db2.gz	XIPWUKVBXAIPIB-INIZCTEOSA-N	0	3	343.858	3.401	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001054111491	1349150816	/nfs/dbraw/zinc/15/08/16/1349150816.db2.gz	XNOGYQXPAASFFF-ONXLCYEJSA-N	0	3	337.467	3.339	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)C1CCC3(CC3)CC1)C2	ZINC001054164544	1349167516	/nfs/dbraw/zinc/16/75/16/1349167516.db2.gz	LYUFRHBVZSOVDI-NRFANRHFSA-N	0	3	328.500	3.295	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)C1(C3CCC3)CCC1)C2	ZINC001054169686	1349171594	/nfs/dbraw/zinc/17/15/94/1349171594.db2.gz	DBIYLUOAGBQXJE-FQEVSTJZSA-N	0	3	328.500	3.295	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cccc3ccsc31)C2	ZINC001054224066	1349218906	/nfs/dbraw/zinc/21/89/06/1349218906.db2.gz	SALTZGGVCHLOLZ-HXUWFJFHSA-N	0	3	338.476	3.463	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccoc1CCC)C2	ZINC001054226908	1349220716	/nfs/dbraw/zinc/22/07/16/1349220716.db2.gz	GEKZLDORQSNBAL-HXUWFJFHSA-N	0	3	328.456	3.184	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1sccc1C(F)F)C2	ZINC001054234735	1349226563	/nfs/dbraw/zinc/22/65/63/1349226563.db2.gz	ISPCBCSMSJNVIZ-QGZVFWFLSA-N	0	3	338.423	3.247	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc3ccccc3o1)C2	ZINC001054236159	1349228578	/nfs/dbraw/zinc/22/85/78/1349228578.db2.gz	HRNCBWODWHFGJY-OAQYLSRUSA-N	0	3	336.435	3.384	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)CCc1cccs1)C2	ZINC001054238652	1349232638	/nfs/dbraw/zinc/23/26/38/1349232638.db2.gz	AYSZCUMCPOZHEJ-IBGZPJMESA-N	0	3	330.497	3.019	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)[C@H](C)c1ccc(F)c(F)c1)C2	ZINC001054243213	1349236513	/nfs/dbraw/zinc/23/65/13/1349236513.db2.gz	ZBTISSKPICVCLS-QRWLVFNGSA-N	0	3	346.421	3.016	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3cncc(F)c3)cc2C1	ZINC001054260667	1349256709	/nfs/dbraw/zinc/25/67/09/1349256709.db2.gz	UDLUNAGFTJAJGM-UHFFFAOYSA-N	0	3	339.414	3.433	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NCc1ccc2c(c1)CN(CCCC)C2	ZINC001054265043	1349262375	/nfs/dbraw/zinc/26/23/75/1349262375.db2.gz	BKURRRSRFKYYIB-UXHICEINSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NCc1ccc2c(c1)CN(CCC)C2	ZINC001054265677	1349263078	/nfs/dbraw/zinc/26/30/78/1349263078.db2.gz	VQTNIKZALWGVAT-MOPGFXCFSA-N	0	3	328.456	3.010	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3csc(C)n3)cc2C1	ZINC001054277919	1349278260	/nfs/dbraw/zinc/27/82/60/1349278260.db2.gz	CXZRFHDIVOJEEI-UHFFFAOYSA-N	0	3	327.453	3.273	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)NCc1ccc2c(c1)CN(CCC(=C)C)C2	ZINC001054281817	1349283622	/nfs/dbraw/zinc/28/36/22/1349283622.db2.gz	DIUSEFMIRWMPAR-UXHICEINSA-N	0	3	340.467	3.176	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@@H]3CCO[C@H](CC)C3)cc2C1	ZINC001054289073	1349293406	/nfs/dbraw/zinc/29/34/06/1349293406.db2.gz	SYZPJDKSWUWZOW-YLJYHZDGSA-N	0	3	342.483	3.400	20	30		EGEDHN
C#Cc1ccc(C(=O)NCc2ccc3c(c2)CN(CC2CCC2)C3)cn1	ZINC001054290381	1349295367	/nfs/dbraw/zinc/29/53/67/1349295367.db2.gz	OMUMTFVSXFFWLT-UHFFFAOYSA-N	0	3	345.446	3.109	20	30		EGEDHN
C=C(C)CN1Cc2ccc(CNC(=O)[C@H]3CCCCN3CC)cc2C1	ZINC001054292873	1349299718	/nfs/dbraw/zinc/29/97/18/1349299718.db2.gz	XSGXZAWTNCBLKN-HXUWFJFHSA-N	0	3	341.499	3.069	20	30		EGEDHN
C[C@H]1CN(C(=O)C2CCCCC2)C[C@H]1NCc1ccc(C#N)c(F)c1	ZINC001054344266	1349323168	/nfs/dbraw/zinc/32/31/68/1349323168.db2.gz	CKVHPUBITNIQNM-IFXJQAMLSA-N	0	3	343.446	3.214	20	30		EGEDHN
CC(C(=O)N1C[C@@H](C)[C@@H](NCc2ccc(C#N)s2)C1)=C1CCCC1	ZINC001054546479	1349394245	/nfs/dbraw/zinc/39/42/45/1349394245.db2.gz	FUULKEPZFXDUSQ-ACJLOTCBSA-N	0	3	343.496	3.447	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2sccc2F)C[C@H]1NCc1ccc(C#N)s1	ZINC001054624323	1349419665	/nfs/dbraw/zinc/41/96/65/1349419665.db2.gz	SMGLAUWUFYBXCJ-QMTHXVAHSA-N	0	3	349.456	3.071	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2csc(C(F)(F)F)c2)C1	ZINC001080036184	1357463250	/nfs/dbraw/zinc/46/32/50/1357463250.db2.gz	MUVXOEZIQKGEKC-ZYHUDNBSSA-N	0	3	332.391	3.393	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@H](NCc2cc(F)ccc2OC)C1	ZINC001054970993	1349531935	/nfs/dbraw/zinc/53/19/35/1349531935.db2.gz	KYFCLRVNNVHWFL-RHSMWYFYSA-N	0	3	348.462	3.373	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2nsc3ccc(C)cc32)C1	ZINC001080259910	1357539463	/nfs/dbraw/zinc/53/94/63/1357539463.db2.gz	NEGKNIXLKBSJDN-UKRRQHHQSA-N	0	3	329.469	3.231	20	30		EGEDHN
CN1CCC[C@H](NC(=O)C[C@@H](C#N)c2c(Cl)cccc2Cl)C1	ZINC001183119818	1387265387	/nfs/dbraw/zinc/26/53/87/1387265387.db2.gz	CRQHVGFRXWELOF-RYUDHWBXSA-N	0	3	340.254	3.201	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1cc(C)cc(F)c1)C[C@H](C)O2	ZINC001071213230	1354508530	/nfs/dbraw/zinc/50/85/30/1354508530.db2.gz	BDLHOIQGJJKHCP-OXJNMPFZSA-N	0	3	346.446	3.016	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3sccc3Cl)C2)CC1	ZINC001086924251	1359250009	/nfs/dbraw/zinc/25/00/09/1359250009.db2.gz	NRNPOWJZISDZLB-CYBMUJFWSA-N	0	3	336.888	3.351	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccnn2C2CCCC2)CC[C@@H]1C	ZINC001071542542	1354756320	/nfs/dbraw/zinc/75/63/20/1354756320.db2.gz	HGFLYOVDGJUQST-HOTGVXAUSA-N	0	3	330.476	3.157	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cncc(-c3ccccc3)c2)CC[C@H]1C	ZINC001071548689	1354760413	/nfs/dbraw/zinc/76/04/13/1354760413.db2.gz	KHZZKGBVLXPPNM-UTKZUKDTSA-N	0	3	347.462	3.355	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2c(Cl)n[nH]c2C2CC2)CC[C@H]1C	ZINC001071561164	1354765395	/nfs/dbraw/zinc/76/53/95/1354765395.db2.gz	JZENTZPXWMHOIT-DGCLKSJQSA-N	0	3	336.867	3.099	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2cn3cc(C)nc3s2)CC[C@H]1C	ZINC001071568495	1354769160	/nfs/dbraw/zinc/76/91/60/1354769160.db2.gz	OEEJRYUUVSYLLA-CABCVRRESA-N	0	3	346.500	3.253	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C(C)(C)c2cc(C)ccn2)CC[C@H]1C	ZINC001071606318	1354792461	/nfs/dbraw/zinc/79/24/61/1354792461.db2.gz	HNHNQMYUKZOKEV-SJORKVTESA-N	0	3	329.488	3.213	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cccc3c(C)c(C)[nH]c32)CC[C@@H]1C	ZINC001071612614	1354797247	/nfs/dbraw/zinc/79/72/47/1354797247.db2.gz	KZFPBNODPWJYPC-YOEHRIQHSA-N	0	3	337.467	3.391	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N[C@@H]1CC[C@H](C)N(CCCF)C1	ZINC001071619534	1354802273	/nfs/dbraw/zinc/80/22/73/1354802273.db2.gz	PXZGVQBKAZVNKK-JKSUJKDBSA-N	0	3	334.435	3.194	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2c3c[nH]nc3ccc2C)CC[C@H]1C	ZINC001071624273	1354807506	/nfs/dbraw/zinc/80/75/06/1354807506.db2.gz	GNLZVBNKXKBGEV-HUUCEWRRSA-N	0	3	326.444	3.030	20	30		EGEDHN
C=C(C)CCN1C[C@H](NC(=O)c2ncc(Cl)s2)CC[C@@H]1C	ZINC001071683432	1354849756	/nfs/dbraw/zinc/84/97/56/1354849756.db2.gz	ZSRGDLILZQJVIT-NWDGAFQWSA-N	0	3	327.881	3.345	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(C)c(Cl)c2F)CC[C@@H]1C	ZINC001071701261	1354860384	/nfs/dbraw/zinc/86/03/84/1354860384.db2.gz	FRONDASDVWMKOI-UONOGXRCSA-N	0	3	336.838	3.394	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2(c3ccc(F)cc3)CCC2)CC[C@@H]1C	ZINC001071729263	1354884993	/nfs/dbraw/zinc/88/49/93/1354884993.db2.gz	YEYHYKRCBCYHEQ-LPHOPBHVSA-N	0	3	342.458	3.240	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2[nH]ccc2-c2ccccc2)CC[C@H]1C	ZINC001071986687	1355059904	/nfs/dbraw/zinc/05/99/04/1355059904.db2.gz	XKCQSYGIGZJFCC-AEFFLSMTSA-N	0	3	335.451	3.288	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)Cc2c[nH]c3cccc(C)c23)CC[C@H]1C	ZINC001071997874	1355065084	/nfs/dbraw/zinc/06/50/84/1355065084.db2.gz	FSUCIZJFKFXWHV-WBVHZDCISA-N	0	3	325.456	3.174	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C(C)(C)c2ccc(F)cc2)CC[C@H]1C	ZINC001072007275	1355071727	/nfs/dbraw/zinc/07/17/27/1355071727.db2.gz	ZKJJHIHTLCBDRO-CRAIPNDOSA-N	0	3	330.447	3.096	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2ccc(OCC)cc2)CC[C@@H]1C	ZINC001072049256	1355103268	/nfs/dbraw/zinc/10/32/68/1355103268.db2.gz	OLFMHQZAJXIGEL-FUHWJXTLSA-N	0	3	330.472	3.173	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(OCC3CC3)cc2)CC[C@@H]1C	ZINC001072088269	1355121725	/nfs/dbraw/zinc/12/17/25/1355121725.db2.gz	IRDJWJKCNPYJGA-QFBILLFUSA-N	0	3	340.467	3.081	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C2(c3ccccc3OC)CC2)CC[C@@H]1C	ZINC001072115873	1355140888	/nfs/dbraw/zinc/14/08/88/1355140888.db2.gz	DLQTYZGNCXLXDX-IRXDYDNUSA-N	0	3	342.483	3.272	20	30		EGEDHN
C#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)C2=CCCC2)CC1	ZINC001072133149	1355147650	/nfs/dbraw/zinc/14/76/50/1355147650.db2.gz	YGXKYFBHOZAQIP-FQEVSTJZSA-N	0	3	337.467	3.008	20	30		EGEDHN
C[C@H]1CCN(C(=O)CC2CCC2)C[C@@H]1CNCc1ccccc1C#N	ZINC001072241361	1355201564	/nfs/dbraw/zinc/20/15/64/1355201564.db2.gz	VRHPICPACUQBNC-JXFKEZNVSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001072944740	1355512911	/nfs/dbraw/zinc/51/29/11/1355512911.db2.gz	KEERPGFKCGEIIB-HXUWFJFHSA-N	0	3	337.467	3.195	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H](CC)Cc3cccc(C)c3)C2)C1	ZINC001073039355	1355564708	/nfs/dbraw/zinc/56/47/08/1355564708.db2.gz	LXCXCHCDPRSMCX-FQEVSTJZSA-N	0	3	338.495	3.121	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CN(C(=O)[C@@H]4C[C@H]4C4CCC4)C3)C2)cc1	ZINC001073050180	1355569019	/nfs/dbraw/zinc/56/90/19/1355569019.db2.gz	NPYUUEMPEJYKEY-VQTJNVASSA-N	0	3	349.478	3.029	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3coc(C4CCCCC4)n3)C2)C1	ZINC001073476554	1355811335	/nfs/dbraw/zinc/81/13/35/1355811335.db2.gz	KVPFMBPEAYGDOY-UHFFFAOYSA-N	0	3	329.444	3.056	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2cc3c(s2)CCCC3)C1	ZINC001073878894	1355935333	/nfs/dbraw/zinc/93/53/33/1355935333.db2.gz	VYBVFLNLALFEFD-INIZCTEOSA-N	0	3	348.512	3.024	20	30		EGEDHN
Cc1ccc(F)cc1CN(C)C[C@H]1CCCCN1C(=O)C#CC1CC1	ZINC001074012946	1356035552	/nfs/dbraw/zinc/03/55/52/1356035552.db2.gz	VTSAKPOQCXRWIX-HXUWFJFHSA-N	0	3	342.458	3.360	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccc(-c4cnco4)cc3)[C@@H]2C1	ZINC001075951331	1356453557	/nfs/dbraw/zinc/45/35/57/1356453557.db2.gz	QHKCDLOHNXJVBV-ZWKOTPCHSA-N	0	3	337.423	3.064	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@H](C)Cc3ccccc3C)[C@@H]2C1	ZINC001076619870	1356634638	/nfs/dbraw/zinc/63/46/38/1356634638.db2.gz	ZBNQRVXVFSJNHQ-YZGWKJHDSA-N	0	3	326.484	3.282	20	30		EGEDHN
CCCCCCCCC(=O)NCC[C@H](C)NC(=O)CN(C)CCC	ZINC001078328159	1356953116	/nfs/dbraw/zinc/95/31/16/1356953116.db2.gz	KLUHWBDKBQPRKT-KRWDZBQOSA-N	0	3	341.540	3.090	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C2CCCC2)C12CCC2	ZINC001078529223	1356996470	/nfs/dbraw/zinc/99/64/70/1356996470.db2.gz	NRZZLXNUAVTSOB-KBPBESRZSA-N	0	3	341.293	3.102	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@@H](NC(=O)CC3CC3)C23CCC3)c(F)c1	ZINC001078531568	1356998714	/nfs/dbraw/zinc/99/87/14/1356998714.db2.gz	OHTDSUXQKNZEEX-ZWKOTPCHSA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2ccoc2Cl)C12CCC2	ZINC001078601707	1357030392	/nfs/dbraw/zinc/03/03/92/1357030392.db2.gz	LFINCSVZBZFNME-VXGBXAGGSA-N	0	3	329.227	3.316	20	30		EGEDHN
CC1(C(=O)N[C@@H]2C[C@@H](NCc3cc(C#N)ccc3F)C23CCC3)CC1	ZINC001078629820	1357041084	/nfs/dbraw/zinc/04/10/84/1357041084.db2.gz	PIOLBXAQIULSRK-IAGOWNOFSA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2C[C@@H](NCc3ccc(F)cn3)C23CCC3)C1	ZINC001078720639	1357066044	/nfs/dbraw/zinc/06/60/44/1357066044.db2.gz	OGTRWGBSILAHDF-IAGOWNOFSA-N	0	3	343.446	3.094	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C[C@@H]2CCC(F)(F)C2)C[C@H]1c1ccccc1	ZINC001081124403	1357841709	/nfs/dbraw/zinc/84/17/09/1357841709.db2.gz	DKDAXOMKRJJPJK-RYQLBKOJSA-N	0	3	346.421	3.029	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@@H]2CCCC23CC3)C[C@H]1NCc1ccc(C#N)s1	ZINC001082591404	1358064165	/nfs/dbraw/zinc/06/41/65/1358064165.db2.gz	MXSOZBMJRRIHIC-XOKHGSTOSA-N	0	3	343.496	3.137	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)[C@@H](C)CC3CCCCC3)[C@H]2C1	ZINC001083212899	1358124868	/nfs/dbraw/zinc/12/48/68/1358124868.db2.gz	GEBGVVDXDWHAQT-YTQUADARSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)c3ccc(C(C)(C)C)cc3)[C@H]2C1	ZINC001083255724	1358126474	/nfs/dbraw/zinc/12/64/74/1358126474.db2.gz	KRMSDCBWPOXLBY-RBUKOAKNSA-N	0	3	342.483	3.085	20	30		EGEDHN
C[C@H](C#N)C(=O)N1C[C@H]2CCN(CCc3ccc4ccccc4c3)C[C@H]21	ZINC001084233222	1358168042	/nfs/dbraw/zinc/16/80/42/1358168042.db2.gz	XUCZJTWNRNUDMT-MAODMQOUSA-N	0	3	347.462	3.075	20	30		EGEDHN
C[C@H](c1ccc2c(c1)CCC2)N1CC[C@@H]2CN(C(=O)C#CC3CC3)[C@@H]2C1	ZINC001084334157	1358195468	/nfs/dbraw/zinc/19/54/68/1358195468.db2.gz	QYLRIXOGQCHULK-NPFVIJTESA-N	0	3	348.490	3.182	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3ccoc3C(F)(F)F)[C@@H]2C1	ZINC001084374033	1358203764	/nfs/dbraw/zinc/20/37/64/1358203764.db2.gz	FAMRFVXIVTYXMO-DGCLKSJQSA-N	0	3	328.334	3.021	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1C[C@H]2CCN(CC[C@H](C)F)C[C@H]21	ZINC001084460592	1358220201	/nfs/dbraw/zinc/22/02/01/1358220201.db2.gz	BSZUOTSPOZKCJM-LZLYRXPVSA-N	0	3	346.446	3.146	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CCN(CCc3cccs3)C[C@H]21	ZINC001084634840	1358263172	/nfs/dbraw/zinc/26/31/72/1358263172.db2.gz	GODLKQVUIHMNGE-SUMDDJOVSA-N	0	3	332.513	3.426	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CCN(CCc3scnc3C)C[C@H]21	ZINC001084634987	1358263251	/nfs/dbraw/zinc/26/32/51/1358263251.db2.gz	MENUIGDAZLMZPG-MDZRGWNJSA-N	0	3	347.528	3.129	20	30		EGEDHN
N#Cc1oc2ccccc2c1NC(=O)C(C#N)Cc1ccc(O)cc1	ZINC001183606117	1387323230	/nfs/dbraw/zinc/32/32/30/1387323230.db2.gz	XBUBBVIYEUQLPS-CYBMUJFWSA-N	0	3	331.331	3.331	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3cc(C4CCCC4)no3)[C@@H]2C1	ZINC001084840526	1358324172	/nfs/dbraw/zinc/32/41/72/1358324172.db2.gz	IVZRVAAIKAKMTI-NVXWUHKLSA-N	0	3	329.444	3.055	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@H](C)c3ccc(C)s3)C[C@@H]21	ZINC001085074249	1358383101	/nfs/dbraw/zinc/38/31/01/1358383101.db2.gz	SPZXDCBCERMURP-ZACQAIPSSA-N	0	3	330.497	3.106	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)[C@@H](F)Cc3ccccc3)C[C@@H]21	ZINC001085099471	1358390587	/nfs/dbraw/zinc/39/05/87/1358390587.db2.gz	VFNZRJIRAKBFSP-QYZOEREBSA-N	0	3	330.447	3.066	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC001085277405	1358449257	/nfs/dbraw/zinc/44/92/57/1358449257.db2.gz	FUVINIPRDTVAFZ-IAOVAPTHSA-N	0	3	348.874	3.393	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1sccc1COC	ZINC001085393190	1358487948	/nfs/dbraw/zinc/48/79/48/1358487948.db2.gz	KAAHWCDJMWBOCQ-ZIAGYGMSSA-N	0	3	342.892	3.278	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1cccc(C(F)F)c1F	ZINC001085597780	1358623929	/nfs/dbraw/zinc/62/39/29/1358623929.db2.gz	FXTOKOOXBPWJNV-GFCCVEGCSA-N	0	3	326.362	3.486	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@@H]1CC[C@H](c2ccccc2)O1	ZINC001085599363	1358624764	/nfs/dbraw/zinc/62/47/64/1358624764.db2.gz	PJZODNIHCYHEQT-ZCNNSNEGSA-N	0	3	342.483	3.406	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1c(F)ccc2ccncc21	ZINC001085610012	1358629903	/nfs/dbraw/zinc/62/99/03/1358629903.db2.gz	HHBHPKPTXJUUOV-HNNXBMFYSA-N	0	3	327.403	3.096	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cccc(NC(=O)CC)c1	ZINC001085629835	1358646076	/nfs/dbraw/zinc/64/60/76/1358646076.db2.gz	DLRFNGYTBUEADA-GOSISDBHSA-N	0	3	343.471	3.148	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc2nc(C)oc2c1	ZINC001085651695	1358660654	/nfs/dbraw/zinc/66/06/54/1358660654.db2.gz	AVVRXGRCTGIQPN-INIZCTEOSA-N	0	3	327.428	3.249	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccnc(-c2ccco2)c1	ZINC001085661978	1358665362	/nfs/dbraw/zinc/66/53/62/1358665362.db2.gz	NFCWTDSIAFXHBH-KRWDZBQOSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N(C)C[C@@H]1CCN1CCC1CC1	ZINC001085678773	1358683014	/nfs/dbraw/zinc/68/30/14/1358683014.db2.gz	QOTHDOYFNNCSBH-KRWDZBQOSA-N	0	3	328.456	3.198	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cnn(C(C)C)c1Cl	ZINC001085746032	1358728324	/nfs/dbraw/zinc/72/83/24/1358728324.db2.gz	WVKZVYSHBILTFU-AWEZNQCLSA-N	0	3	338.883	3.230	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc(Cl)cc1OC	ZINC001085786590	1358761762	/nfs/dbraw/zinc/76/17/62/1358761762.db2.gz	RHGGNZWTBMSSRE-HNNXBMFYSA-N	0	3	336.863	3.461	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccn(C(CC)CC)n1	ZINC001085854696	1358821817	/nfs/dbraw/zinc/82/18/17/1358821817.db2.gz	FMXSNQZBYLIIQU-KRWDZBQOSA-N	0	3	332.492	3.357	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1ccc2nc(C)sc2c1	ZINC001085908985	1358868352	/nfs/dbraw/zinc/86/83/52/1358868352.db2.gz	XYDUEHVOGXOLQE-HNNXBMFYSA-N	0	3	329.469	3.327	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1cnn(C(CC)CC)c1C	ZINC001085917280	1358877505	/nfs/dbraw/zinc/87/75/05/1358877505.db2.gz	VQJXHFUCIRIVGD-QGZVFWFLSA-N	0	3	332.492	3.275	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc(NC(C)=O)ccc1C	ZINC001086004918	1358958265	/nfs/dbraw/zinc/95/82/65/1358958265.db2.gz	SJHHTMRGWNFJHV-SFHVURJKSA-N	0	3	343.471	3.066	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cccc3scnc32)C1	ZINC001086085465	1358992081	/nfs/dbraw/zinc/99/20/81/1358992081.db2.gz	FYAFWGUZHPOOIY-TXEJJXNPSA-N	0	3	335.860	3.147	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc3cc(C)cn3c2)C1	ZINC001086103873	1358998268	/nfs/dbraw/zinc/99/82/68/1358998268.db2.gz	NMJWTWYNPAYCGQ-FZNQNYSPSA-N	0	3	331.847	3.098	20	30		EGEDHN
CC1(C)CC[C@H]1C(=O)NC[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001086172130	1359014398	/nfs/dbraw/zinc/01/43/98/1359014398.db2.gz	METXIHRBGOQYLP-UAGQMJEPSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)[C@H]2CCC[C@H]2CC)C1	ZINC001086188877	1359021739	/nfs/dbraw/zinc/02/17/39/1359021739.db2.gz	CSFUQJBFNBWTKB-KBXIAJHMSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc(C3CCCC3)no2)C1	ZINC001086275335	1359050917	/nfs/dbraw/zinc/05/09/17/1359050917.db2.gz	WNYDVUZGVGPXRO-XBXGTLAGSA-N	0	3	337.851	3.183	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2csc(CC(C)C)n2)C1	ZINC001086284427	1359055262	/nfs/dbraw/zinc/05/52/62/1359055262.db2.gz	MDLXZAZQAVYWCT-BETUJISGSA-N	0	3	341.908	3.192	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc(C)c(F)cc2F)C1	ZINC001086398426	1359086305	/nfs/dbraw/zinc/08/63/05/1359086305.db2.gz	HYPRSXADWOOQQB-HAQNSBGRSA-N	0	3	328.790	3.124	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc(C)n([C@H](C)CC)n2)C1	ZINC001086412099	1359091087	/nfs/dbraw/zinc/09/10/87/1359091087.db2.gz	JZROEBALWZFHKP-BPLDGKMQSA-N	0	3	338.883	3.013	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc(-c3ccccc3)no2)C1	ZINC001086416331	1359091516	/nfs/dbraw/zinc/09/15/16/1359091516.db2.gz	JOVYQWRFWCSNIU-CTYIDZIISA-N	0	3	345.830	3.192	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)[C@@H]2C[C@H]2C(C)(C)C)C1	ZINC001086426455	1359093987	/nfs/dbraw/zinc/09/39/87/1359093987.db2.gz	TYHLVWVAKHHHJQ-AAVRWANBSA-N	0	3	343.309	3.062	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cnc3ccccc3c2C)C1	ZINC001086430695	1359095872	/nfs/dbraw/zinc/09/58/72/1359095872.db2.gz	FDJYONJBTOBWKE-SHTZXODSSA-N	0	3	343.858	3.394	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2c(Cl)cncc2Cl)C1	ZINC001086466396	1359108140	/nfs/dbraw/zinc/10/81/40/1359108140.db2.gz	BCEOHONXWGFKBR-MGCOHNPYSA-N	0	3	348.661	3.239	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2C[C@H](N[C@H](C)c3cnc(C)cn3)C2)CC1	ZINC001086467694	1359108832	/nfs/dbraw/zinc/10/88/32/1359108832.db2.gz	PQSVPNFGYXKLLH-JFIYKMOQSA-N	0	3	342.487	3.077	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc(F)cc3cccnc32)C1	ZINC001086495319	1359119489	/nfs/dbraw/zinc/11/94/89/1359119489.db2.gz	PFUPUQJXQWGTTH-NNUKFRKNSA-N	0	3	347.821	3.224	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2scnc2C(C)(C)C)C1	ZINC001086499641	1359121128	/nfs/dbraw/zinc/12/11/28/1359121128.db2.gz	QDRHKEUMELUTPE-HAQNSBGRSA-N	0	3	341.908	3.291	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)c2ccc(C)cc2)C1	ZINC001086539854	1359137277	/nfs/dbraw/zinc/13/72/77/1359137277.db2.gz	CFQCPLPGLVXFFV-CTYIDZIISA-N	0	3	337.261	3.002	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)C(C)=C2CCCC2)C1	ZINC001086582163	1359154929	/nfs/dbraw/zinc/15/49/29/1359154929.db2.gz	BQPAEEFLQQQJKL-LEWJYISDSA-N	0	3	336.479	3.484	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](CNCc2nc3ccccc3o2)[C@H](C)C1	ZINC001184007228	1387380613	/nfs/dbraw/zinc/38/06/13/1387380613.db2.gz	BMFQBQCBYVREMU-HZPDHXFCSA-N	0	3	341.455	3.368	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccc(C)c(OC)c2)C1	ZINC001086751035	1359195242	/nfs/dbraw/zinc/19/52/42/1359195242.db2.gz	TXNUENQLLWIDPQ-GOEBONIOSA-N	0	3	336.863	3.244	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cccc3cc[nH]c32)C1	ZINC001086810133	1359205437	/nfs/dbraw/zinc/20/54/37/1359205437.db2.gz	ZHNPSTZSROBYMU-DZGCQCFKSA-N	0	3	331.847	3.409	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)Cc3c(C)cccc3C)C2)CC1	ZINC001086925100	1359250145	/nfs/dbraw/zinc/25/01/45/1359250145.db2.gz	LAKYPYNUTKKERX-LJQANCHMSA-N	0	3	338.495	3.182	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)COC3CCCCC3)C2)CC1	ZINC001086929963	1359254092	/nfs/dbraw/zinc/25/40/92/1359254092.db2.gz	UZUQGNAIEWJHRC-SFHVURJKSA-N	0	3	346.515	3.062	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccn4ccccc34)C2)CC1	ZINC001086932077	1359255789	/nfs/dbraw/zinc/25/57/89/1359255789.db2.gz	ZVBKHNSNLNTSKO-GOSISDBHSA-N	0	3	349.478	3.279	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@H](C)c3cccs3)C2)CC1	ZINC001086941965	1359263830	/nfs/dbraw/zinc/26/38/30/1359263830.db2.gz	FKHHSSHFMWFXIT-JKSUJKDBSA-N	0	3	330.497	3.188	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H](C)c3ccc(C)o3)C2)CC1	ZINC001086946882	1359268074	/nfs/dbraw/zinc/26/80/74/1359268074.db2.gz	KTJOHNFGLFFWCF-AEFFLSMTSA-N	0	3	342.483	3.418	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc(CF)cc3)C2)CC1	ZINC001086959257	1359279875	/nfs/dbraw/zinc/27/98/75/1359279875.db2.gz	WXEUQODYPZGEFX-KRWDZBQOSA-N	0	3	342.458	3.496	20	30		EGEDHN
CC(C)C(=O)N[C@@H]1[C@@H]2CCCN(Cc3cccc(C#N)c3)[C@@H]2C1(C)C	ZINC001087273878	1359347617	/nfs/dbraw/zinc/34/76/17/1359347617.db2.gz	HKRWRLNUJULPLS-OTWHNJEPSA-N	0	3	339.483	3.319	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccoc3Cl)C(C)(C)[C@H]21	ZINC001087282125	1359361714	/nfs/dbraw/zinc/36/17/14/1359361714.db2.gz	RWUYJNPNYPLYTC-YUELXQCFSA-N	0	3	334.847	3.175	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc(C)c(C)o1	ZINC001087282803	1359361908	/nfs/dbraw/zinc/36/19/08/1359361908.db2.gz	DZRHJVTVKWKQOM-BPQIPLTHSA-N	0	3	328.456	3.139	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc(Cl)cc3F)C(C)(C)[C@H]21	ZINC001087294067	1359374271	/nfs/dbraw/zinc/37/42/71/1359374271.db2.gz	NRIMGZAEUOCFDB-PVAVHDDUSA-N	0	3	348.849	3.331	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc4ccc(C)cc4[nH]3)C(C)(C)[C@H]21	ZINC001087296620	1359377854	/nfs/dbraw/zinc/37/78/54/1359377854.db2.gz	CLJJRFFEPSJHQK-AHRSYUTCSA-N	0	3	349.478	3.328	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc4cccnc4c3)C(C)(C)[C@H]21	ZINC001087307927	1359394573	/nfs/dbraw/zinc/39/45/73/1359394573.db2.gz	JIGAKOXJTNWZFJ-RLLQIKCJSA-N	0	3	347.462	3.087	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)C3(F)CCCCC3)C(C)(C)[C@H]21	ZINC001087313359	1359401935	/nfs/dbraw/zinc/40/19/35/1359401935.db2.gz	SWQNKNARXVZYNK-IKGGRYGDSA-N	0	3	334.479	3.287	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(F)cc3C)C(C)(C)[C@H]21	ZINC001087314096	1359402792	/nfs/dbraw/zinc/40/27/92/1359402792.db2.gz	FOUCRMZNTZNQNZ-QRVBRYPASA-N	0	3	342.458	3.376	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(Cl)s3)C(C)(C)[C@@H]21	ZINC001087316607	1359407726	/nfs/dbraw/zinc/40/77/26/1359407726.db2.gz	UWKJKNYBQQWLBJ-KCPJHIHWSA-N	0	3	336.888	3.254	20	30		EGEDHN
O=C(CC1CC1)N1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1CC#Cc1ccccc1	ZINC001087328441	1359418029	/nfs/dbraw/zinc/41/80/29/1359418029.db2.gz	XGLVDCTUWSWOGH-CBPXPLCBSA-N	0	3	348.490	3.007	20	30		EGEDHN
O=C(CC1CC1)N1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1CC#Cc1ccccc1	ZINC001087328444	1359418092	/nfs/dbraw/zinc/41/80/92/1359418092.db2.gz	XGLVDCTUWSWOGH-LRSLUSHPSA-N	0	3	348.490	3.007	20	30		EGEDHN
CC(C)=CC(=O)N1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(CC#Cc2ccccc2)C1	ZINC001087331848	1359421702	/nfs/dbraw/zinc/42/17/02/1359421702.db2.gz	CFROXNKEFXMGIA-CMOCDZPBSA-N	0	3	348.490	3.173	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)C2(C3CC3)CC2)C1	ZINC001087430171	1359462758	/nfs/dbraw/zinc/46/27/58/1359462758.db2.gz	AGPVOVDTUAICDF-WOJBJXKFSA-N	0	3	336.479	3.174	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)[C@@]2(C)C=CCC2)C1	ZINC001087434272	1359463666	/nfs/dbraw/zinc/46/36/66/1359463666.db2.gz	FEOOSMORBMJQIE-SJBKTWHCSA-N	0	3	336.479	3.340	20	30		EGEDHN
C=CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)[C@H]2CC[C@@H](C)O2)C1	ZINC001087438326	1359465687	/nfs/dbraw/zinc/46/56/87/1359465687.db2.gz	RSKQRRWFPRHIEJ-VBSBHUPXSA-N	0	3	342.483	3.104	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)[C@H]2[C@@H]3CCC[C@@H]32)CCN1Cc1ccc(C#N)cc1	ZINC001087534215	1359517117	/nfs/dbraw/zinc/51/71/17/1359517117.db2.gz	SDIJIQXUYBFTRT-PXTPFGJHSA-N	0	3	337.467	3.073	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)[C@@H]2CCC2(C)C)CCN1Cc1ccc(C#N)cc1	ZINC001087693757	1359594288	/nfs/dbraw/zinc/59/42/88/1359594288.db2.gz	VEBVALMCESDMEQ-GBESFXJTSA-N	0	3	339.483	3.464	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cc(-c3cccs3)n[nH]2)[C@H]1CC	ZINC001087733746	1359616483	/nfs/dbraw/zinc/61/64/83/1359616483.db2.gz	SBAAREKOMXEKLQ-XJKSGUPXSA-N	0	3	344.484	3.297	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2coc3cc(C)ccc23)[C@H]1CC	ZINC001087819924	1359663922	/nfs/dbraw/zinc/66/39/22/1359663922.db2.gz	ZASPPMKUPUQNBJ-RBUKOAKNSA-N	0	3	338.451	3.276	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)[C@]2(C)OCCc3ccccc32)[C@H]1CC	ZINC001087847417	1359679594	/nfs/dbraw/zinc/67/95/94/1359679594.db2.gz	TVYRHYBOBIVFBX-QKNQBKEWSA-N	0	3	342.483	3.020	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CN(C(=O)[C@@H]4CC=CCC4)C[C@@H]3C2)c1	ZINC001087881721	1359694897	/nfs/dbraw/zinc/69/48/97/1359694897.db2.gz	PGTONUHVXBLKCF-NJYVYQBISA-N	0	3	349.478	3.195	20	30		EGEDHN
Cc1coc(C(=O)N2C[C@H]3CCN(Cc4cccc(C#N)c4)C[C@H]3C2)c1	ZINC001088075907	1359746578	/nfs/dbraw/zinc/74/65/78/1359746578.db2.gz	CBTJXWKQIHSRSK-MOPGFXCFSA-N	0	3	349.434	3.054	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)[C@@H](C)c3ccc(CC)cc3)C[C@@H]2C1	ZINC001088140926	1359771493	/nfs/dbraw/zinc/77/14/93/1359771493.db2.gz	LTEOFWQJDFMJFZ-WMQCIHAUSA-N	0	3	338.495	3.156	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3cccc(C(C)(C)C)c3)C[C@@H]2C1	ZINC001088147837	1359773224	/nfs/dbraw/zinc/77/32/24/1359773224.db2.gz	YFZYITKQIBLOLH-MOPGFXCFSA-N	0	3	338.495	3.401	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3cccc4ccsc43)C[C@@H]2C1	ZINC001088160230	1359775779	/nfs/dbraw/zinc/77/57/79/1359775779.db2.gz	ILFUPIUCKHPLHU-SJORKVTESA-N	0	3	338.476	3.319	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3cc4ccccc4n3CC)C[C@@H]2C1	ZINC001088210202	1359796205	/nfs/dbraw/zinc/79/62/05/1359796205.db2.gz	BEYXUMJCKDJNFL-MOPGFXCFSA-N	0	3	349.478	3.078	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)Cc2cncc(C)c2)C1	ZINC001088353766	1359837404	/nfs/dbraw/zinc/83/74/04/1359837404.db2.gz	HGMPJLPFMPRZID-QGZVFWFLSA-N	0	3	335.879	3.046	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCCCC[C@@H](NCc3cnoc3C)C2)C1	ZINC001088378390	1359861610	/nfs/dbraw/zinc/86/16/10/1359861610.db2.gz	GVTHVWINGFRLQT-QGZVFWFLSA-N	0	3	331.460	3.200	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2cc(Cl)no2)C1	ZINC001088416364	1359886090	/nfs/dbraw/zinc/88/60/90/1359886090.db2.gz	LPXFJAQBXRGFRX-NSHDSACASA-N	0	3	332.231	3.055	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2cc(C)n(C)c2C)C1	ZINC001088423220	1359892594	/nfs/dbraw/zinc/89/25/94/1359892594.db2.gz	MYEYUBWGAFXRRI-MRXNPFEDSA-N	0	3	337.895	3.369	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2ccccc2N(C)C)C1	ZINC001088433436	1359902302	/nfs/dbraw/zinc/90/23/02/1359902302.db2.gz	WJOQBMGUGLOIQI-MRXNPFEDSA-N	0	3	349.906	3.480	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2cc(Cl)sc2Cl)[C@H]1C	ZINC001088622804	1359993726	/nfs/dbraw/zinc/99/37/26/1359993726.db2.gz	PUZSOWIIVPVPGT-KOLCDFICSA-N	0	3	331.268	3.271	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)C[C@@H]2C[C@H]2c2ccc(OC)cc2)[C@H]1C	ZINC001088634195	1359998547	/nfs/dbraw/zinc/99/85/47/1359998547.db2.gz	BAGMSQQNRSVACF-LQJIQPLVSA-N	0	3	342.483	3.344	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cnc3ccc(F)cc3c2)[C@H]1C	ZINC001088958991	1360116062	/nfs/dbraw/zinc/11/60/62/1360116062.db2.gz	FUOTVFRAALEKGA-DYVFJYSZSA-N	0	3	327.403	3.143	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)Cc2c[nH]c3cccc(C)c23)[C@H]1C	ZINC001088986706	1360125602	/nfs/dbraw/zinc/12/56/02/1360125602.db2.gz	MYDFCNCQBKEUHJ-WBVHZDCISA-N	0	3	325.456	3.174	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCCC[C@H]1CN(C)Cc1ccc(C#N)cc1	ZINC001089229890	1360270306	/nfs/dbraw/zinc/27/03/06/1360270306.db2.gz	GKGADBDZAKBCKH-HSALFYBXSA-N	0	3	339.483	3.417	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCCN1C(=O)[C@@H]1CC12CC2	ZINC001089232967	1360271801	/nfs/dbraw/zinc/27/18/01/1360271801.db2.gz	GGLLXOIJGQXHNU-OALUTQOASA-N	0	3	337.467	3.171	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2conc2C(C)C)CC(C)(C)C1	ZINC001089406330	1360404994	/nfs/dbraw/zinc/40/49/94/1360404994.db2.gz	KWENTCPAUHWAOR-OAHLLOKOSA-N	0	3	331.460	3.042	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(COC)cs2)CC(C)(C)C1	ZINC001089430195	1360422331	/nfs/dbraw/zinc/42/23/31/1360422331.db2.gz	JONHALLCRWIFKL-INIZCTEOSA-N	0	3	348.512	3.138	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2c(C)noc2C2CC2)CC(C)(C)C1	ZINC001089440309	1360430179	/nfs/dbraw/zinc/43/01/79/1360430179.db2.gz	NKBIDLTWNVKMOA-MRXNPFEDSA-N	0	3	343.471	3.104	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc(Cl)c(Cl)[nH]2)CC(C)(C)C1	ZINC001089451830	1360439506	/nfs/dbraw/zinc/43/95/06/1360439506.db2.gz	YHQYBCNJJGRQGV-LLVKDONJSA-N	0	3	342.270	3.175	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2sc(C)cc2OC)CC(C)(C)C1	ZINC001089510004	1360481675	/nfs/dbraw/zinc/48/16/75/1360481675.db2.gz	MFOJKMUSUZZKCA-HNNXBMFYSA-N	0	3	348.512	3.309	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(C[C@H](F)CC)CC(C)(C)C2)nc1	ZINC001089544005	1360499198	/nfs/dbraw/zinc/49/91/98/1360499198.db2.gz	LALOBDYBIIJSSG-SJORKVTESA-N	0	3	345.462	3.031	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc3[nH]ccc3s2)CC(C)(C)C1	ZINC001089549402	1360502653	/nfs/dbraw/zinc/50/26/53/1360502653.db2.gz	XVMZXSRURUHFMG-ZDUSSCGKSA-N	0	3	329.469	3.083	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C2CC(c3ccccc3)C2)CC(C)(C)C1	ZINC001089566590	1360513212	/nfs/dbraw/zinc/51/32/12/1360513212.db2.gz	OEYMNECUMDUFPS-MHJFOBGBSA-N	0	3	338.495	3.420	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc2occc2[nH]1	ZINC001089649118	1360562174	/nfs/dbraw/zinc/56/21/74/1360562174.db2.gz	BDQHPGVCYKLLAS-AWEZNQCLSA-N	0	3	327.428	3.005	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H]1COc2ccccc2C1	ZINC001089667124	1360577447	/nfs/dbraw/zinc/57/74/47/1360577447.db2.gz	BMJCYPWOHZFMAH-QZTJIDSGSA-N	0	3	342.483	3.031	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1nc(C)n2ccccc12	ZINC001089668805	1360578555	/nfs/dbraw/zinc/57/85/55/1360578555.db2.gz	AVILNKQGBHXISL-MRXNPFEDSA-N	0	3	340.471	3.049	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cccc2c1CCOC2	ZINC001089669226	1360579491	/nfs/dbraw/zinc/57/94/91/1360579491.db2.gz	IXSZKZIWZWBRAW-QGZVFWFLSA-N	0	3	342.483	3.166	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(CC)nnc1C	ZINC001089676067	1360583926	/nfs/dbraw/zinc/58/39/26/1360583926.db2.gz	YYZQMFLCYOZBKR-KRWDZBQOSA-N	0	3	344.503	3.144	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)C1Cc2ccccc2C1	ZINC001089699388	1360603433	/nfs/dbraw/zinc/60/34/33/1360603433.db2.gz	LEOZCOYAVXONIQ-IBGZPJMESA-N	0	3	326.484	3.194	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc2c(c1)COC2	ZINC001089705902	1360607882	/nfs/dbraw/zinc/60/78/82/1360607882.db2.gz	DBFLCMRCUOTZBC-GOSISDBHSA-N	0	3	328.456	3.123	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc2cccnn21	ZINC001089707404	1360611375	/nfs/dbraw/zinc/61/13/75/1360611375.db2.gz	IUGQXYAFBJQAJQ-KRWDZBQOSA-N	0	3	340.471	3.131	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cccn2ccnc12	ZINC001089709840	1360614264	/nfs/dbraw/zinc/61/42/64/1360614264.db2.gz	ZWXVPMGGWFIWCE-INIZCTEOSA-N	0	3	340.471	3.131	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cnn(C(C)C)c1C	ZINC001089722378	1360624727	/nfs/dbraw/zinc/62/47/27/1360624727.db2.gz	YBOYKNYMKSZMJP-QGZVFWFLSA-N	0	3	344.503	3.016	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1cccc2[nH]c(C)nc21	ZINC001089721854	1360624863	/nfs/dbraw/zinc/62/48/63/1360624863.db2.gz	LMSRJAPBZGCHEE-HNNXBMFYSA-N	0	3	340.471	3.278	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cccc(NC(C)=O)c1	ZINC001089731187	1360634762	/nfs/dbraw/zinc/63/47/62/1360634762.db2.gz	MMTCZMZQMWOROD-GOSISDBHSA-N	0	3	343.471	3.051	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(N(C)C)c(F)c1	ZINC001089734318	1360637895	/nfs/dbraw/zinc/63/78/95/1360637895.db2.gz	OSGLXMMHQWMPSR-INIZCTEOSA-N	0	3	347.478	3.298	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1(C2CC2)CCC1	ZINC001089841663	1360691569	/nfs/dbraw/zinc/69/15/69/1360691569.db2.gz	GKYOFOPCAWWEDV-RANZSIQMSA-N	0	3	348.918	3.488	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)C2CCCCCC2)CC2(CCOCC2)C1	ZINC001089928245	1360748592	/nfs/dbraw/zinc/74/85/92/1360748592.db2.gz	ZJHWONHVWSSWFI-GOSISDBHSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)[C@@H]2CCCC23CC3)CC2(CCOCC2)C1	ZINC001089943880	1360756705	/nfs/dbraw/zinc/75/67/05/1360756705.db2.gz	VJZMVDHKWRRDQT-ROUUACIJSA-N	0	3	346.515	3.130	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)[C@@]23C[C@@H]2CCCC3)CC2(CCOCC2)C1	ZINC001089959919	1360767003	/nfs/dbraw/zinc/76/70/03/1360767003.db2.gz	UKQBBZDJUSJBQC-UEXGIBASSA-N	0	3	346.515	3.130	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@H]2CCCc3ccccc32)C1	ZINC001091097994	1360991822	/nfs/dbraw/zinc/99/18/22/1360991822.db2.gz	AYDHOFUFMAWNTA-PVARCSIZSA-N	0	3	332.875	3.343	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc3cc(OC)ccc3[nH]2)C1	ZINC001091208618	1361008147	/nfs/dbraw/zinc/00/81/47/1361008147.db2.gz	UNOMACBWESPMNU-UHFFFAOYSA-N	0	3	347.846	3.027	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2sc(C(C)C)nc2C)C1	ZINC001091360499	1361060404	/nfs/dbraw/zinc/06/04/04/1361060404.db2.gz	FKYTUYOIHVEGCP-UHFFFAOYSA-N	0	3	341.908	3.425	20	30		EGEDHN
Cc1cc(Cl)ccc1CN1C[C@@H]2CN(C(=O)[C@@H](C)C#N)C[C@]2(C)C1	ZINC001091547669	1361141550	/nfs/dbraw/zinc/14/15/50/1361141550.db2.gz	QCVWBULQAGBERR-GMBSWORKSA-N	0	3	345.874	3.088	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)CCc3ccc(C(C)C)cc3)C[C@]2(C)C1	ZINC001091847396	1361234900	/nfs/dbraw/zinc/23/49/00/1361234900.db2.gz	ZRWIJDMUFVFARN-IRLDBZIGSA-N	0	3	338.495	3.156	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc(C)c(Cl)cc3C)C[C@]2(C)C1	ZINC001091909791	1361243600	/nfs/dbraw/zinc/24/36/00/1361243600.db2.gz	WRPHBPWLWINBAC-UZLBHIALSA-N	0	3	344.886	3.374	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CN(Cc3scnc3C)C[C@@]2(C)C1	ZINC001091911147	1361244199	/nfs/dbraw/zinc/24/41/99/1361244199.db2.gz	QVHNMFSJUJLUQX-BEFAXECRSA-N	0	3	347.528	3.334	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C[C@H](C)c3cccc(F)c3)C[C@]2(C)C1	ZINC001091999559	1361270322	/nfs/dbraw/zinc/27/03/22/1361270322.db2.gz	UQDSOOPQGNDTJM-CDXJDZJCSA-N	0	3	342.458	3.123	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cccc4ccccc43)C[C@]2(C)C1	ZINC001092248353	1361340158	/nfs/dbraw/zinc/34/01/58/1361340158.db2.gz	RWQCTNBPGBUKTL-GCJKJVERSA-N	0	3	332.447	3.257	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)CC3CCC(C)(C)CC3)C[C@]2(C)C1	ZINC001092329010	1361366597	/nfs/dbraw/zinc/36/65/97/1361366597.db2.gz	WRGNBTYKHQXOHI-NQIIRXRSSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC(=O)N1CCC([C@H]2N(Cc3ccc(C#N)s3)CC23CCC3)CC1	ZINC001093348678	1361563650	/nfs/dbraw/zinc/56/36/50/1361563650.db2.gz	SIJYTRWDHIZEFM-GOSISDBHSA-N	0	3	343.496	3.233	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)/C=C(\C)C2CC2)CC1	ZINC001093359852	1361572215	/nfs/dbraw/zinc/57/22/15/1361572215.db2.gz	VOKXYEKWXBJTLP-VISDOYDDSA-N	0	3	326.484	3.069	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)c2oc(C)cc2C)CC1	ZINC001093363977	1361574492	/nfs/dbraw/zinc/57/44/92/1361574492.db2.gz	LMHPEMIUIIVMIE-IBGZPJMESA-N	0	3	340.467	3.236	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)c2ccc(Cl)[nH]2)CC1	ZINC001093378283	1361589244	/nfs/dbraw/zinc/58/92/44/1361589244.db2.gz	MQBFSNXRNBJSNS-QGZVFWFLSA-N	0	3	345.874	3.008	20	30		EGEDHN
C[C@@H](NC[C@@H]1CN(C(=O)C#CC2CC2)C[C@H]1C)c1c(F)cccc1F	ZINC001093762436	1361692869	/nfs/dbraw/zinc/69/28/69/1361692869.db2.gz	NOQGEUYKVLOGLY-IIAWOOMASA-N	0	3	346.421	3.123	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1oc(CC3CC3)nc1C)C2	ZINC001095423341	1362135792	/nfs/dbraw/zinc/13/57/92/1362135792.db2.gz	QBJCENPNLHLFPH-IKGGRYGDSA-N	0	3	343.471	3.237	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C1(c3ccc(F)cc3)CC1)C2	ZINC001095501149	1362158058	/nfs/dbraw/zinc/15/80/58/1362158058.db2.gz	DMYYHNNQZITNRG-SQNIBIBYSA-N	0	3	328.431	3.155	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](CNCc2cnc(C)o2)[C@H](C)C1	ZINC001184943918	1387567264	/nfs/dbraw/zinc/56/72/64/1387567264.db2.gz	BKOLMJAMZKWQKF-SJLPKXTDSA-N	0	3	345.487	3.141	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(OC)c(C3CC3)c1)C2	ZINC001096261187	1362451703	/nfs/dbraw/zinc/45/17/03/1362451703.db2.gz	JWZORRXSLLCPEP-NEWSRXKRSA-N	0	3	340.467	3.484	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C1C3CC4CC(C3)CC1C4)C2	ZINC001097224833	1362892607	/nfs/dbraw/zinc/89/26/07/1362892607.db2.gz	QOBUJIUKVPJZHJ-BHKQZPHESA-N	0	3	328.500	3.356	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](CNCc2ccn(C(C)C)n2)[C@@H](C)C1	ZINC001185062248	1387605002	/nfs/dbraw/zinc/60/50/02/1387605002.db2.gz	RSEZUFHRTHHEOE-ZWKOTPCHSA-N	0	3	346.519	3.395	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](CNCc2ccn(C(C)C)n2)[C@@H](C)C1	ZINC001185062247	1387605348	/nfs/dbraw/zinc/60/53/48/1387605348.db2.gz	RSEZUFHRTHHEOE-ROUUACIJSA-N	0	3	346.519	3.395	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H]1COc3cc(C)c(C)cc31)C2	ZINC001097584531	1363061079	/nfs/dbraw/zinc/06/10/79/1363061079.db2.gz	VMCMYKCJEWCIPU-OWYHZJEWSA-N	0	3	340.467	3.077	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1cccc(Cl)c1F)C2	ZINC001097924129	1363167677	/nfs/dbraw/zinc/16/76/77/1363167677.db2.gz	AFSYFOVTKQLBHQ-BMFZPTHFSA-N	0	3	336.838	3.319	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(C)c(OCC)c1)C2	ZINC001097967841	1363182807	/nfs/dbraw/zinc/18/28/07/1363182807.db2.gz	HRDXEZQCOKPMMJ-KURKYZTESA-N	0	3	328.456	3.305	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc(OC)cc1)C2	ZINC001098004005	1363194233	/nfs/dbraw/zinc/19/42/33/1363194233.db2.gz	OAWCQBVOVLCARZ-JUSBFGHESA-N	0	3	340.467	3.096	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)CC1C3CC4CC(C3)CC1C4)C2	ZINC001098449165	1363328218	/nfs/dbraw/zinc/32/82/18/1363328218.db2.gz	HZMIDUFYCIRDIK-BILCUZEBSA-N	0	3	340.511	3.194	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](C)c1cccc(OC)c1)C2	ZINC001098465925	1363333975	/nfs/dbraw/zinc/33/39/75/1363333975.db2.gz	LINXISSNTIJLRU-WLWJZTKJSA-N	0	3	328.456	3.096	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)C[C@H](NC(=O)C1(C)CC1)c1ccccc1O2	ZINC001098541697	1363363633	/nfs/dbraw/zinc/36/36/33/1363363633.db2.gz	QNVJRMCPTZDTOM-UWJYYQICSA-N	0	3	340.467	3.447	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1cc(C)cc(F)c1)C[C@H](C)O2	ZINC001098639596	1363411119	/nfs/dbraw/zinc/41/11/19/1363411119.db2.gz	ZYHHHOYTOVFNSL-INIZCTEOSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(C)n([C@H](C)CC)n2)C1	ZINC001098914285	1363517867	/nfs/dbraw/zinc/51/78/67/1363517867.db2.gz	PSKBAVAILJCJMG-SYNHAJSKSA-N	0	3	344.503	3.323	20	30		EGEDHN
CC1(C)CC[C@H](CNC(=O)CSCC#N)N(Cc2ccccc2)C1	ZINC001098922054	1363521665	/nfs/dbraw/zinc/52/16/65/1363521665.db2.gz	MWWAFZJNYQOXBU-QGZVFWFLSA-N	0	3	345.512	3.050	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(F)c(F)cc2F)C1	ZINC001099003078	1363566432	/nfs/dbraw/zinc/56/64/32/1363566432.db2.gz	BYNPYKOFFMOJIJ-SGTLLEGYSA-N	0	3	338.373	3.264	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)Cc2cccc(Cl)c2F)C1	ZINC001099048564	1363592966	/nfs/dbraw/zinc/59/29/66/1363592966.db2.gz	YRSOPUVSRJMDRB-KSSFIOAISA-N	0	3	336.838	3.178	20	30		EGEDHN
C#CCCN1C[C@@H]2CCC[C@]2(NC(=O)c2sc(C(C)C)nc2C)C1	ZINC001099157636	1363661623	/nfs/dbraw/zinc/66/16/23/1363661623.db2.gz	GPBXRKVYNOWIPI-KXBFYZLASA-N	0	3	345.512	3.183	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H](OCC)C1CCCC1	ZINC001099159354	1363663782	/nfs/dbraw/zinc/66/37/82/1363663782.db2.gz	QYMAEPDBBPUFQW-RTBURBONSA-N	0	3	348.531	3.212	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H]1CCC1(C)C	ZINC001099182899	1363678499	/nfs/dbraw/zinc/67/84/99/1363678499.db2.gz	PAOBEOABWPOGDS-SJORKVTESA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(N(C)CCC)cc2)C1	ZINC001099185992	1363679730	/nfs/dbraw/zinc/67/97/30/1363679730.db2.gz	VQCCVCQJHUYYQM-RXVVDRJESA-N	0	3	341.499	3.303	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(OC(C)C)cn2)C1	ZINC001099187422	1363679852	/nfs/dbraw/zinc/67/98/52/1363679852.db2.gz	LBUGHJASTACLGT-JXFKEZNVSA-N	0	3	343.471	3.029	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)C(C)(C)CC=C	ZINC001099252660	1363714732	/nfs/dbraw/zinc/71/47/32/1363714732.db2.gz	YVUXGMCTNJDBNC-KRWDZBQOSA-N	0	3	336.520	3.398	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)Cc2c(C)cccc2C)C[C@H]1C(F)(F)F	ZINC001099259545	1363719971	/nfs/dbraw/zinc/71/99/71/1363719971.db2.gz	LVHBPORUXGFNIR-HZPDHXFCSA-N	0	3	340.389	3.011	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2[nH]ccc2C2CC2)C[C@H]1C(F)(F)F	ZINC001099260418	1363720532	/nfs/dbraw/zinc/72/05/32/1363720532.db2.gz	IPAOPHBRPDYPIA-ZIAGYGMSSA-N	0	3	341.377	3.061	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@@H]2CCC=CCCC2)C[C@H]1C(F)(F)F	ZINC001099268819	1363724399	/nfs/dbraw/zinc/72/43/99/1363724399.db2.gz	OZROSJRYRLXGSL-RBSFLKMASA-N	0	3	330.394	3.288	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)C(C)(C)C2CCC2)C[C@H]1C(F)(F)F	ZINC001099285488	1363731373	/nfs/dbraw/zinc/73/13/73/1363731373.db2.gz	XRFCVMMDCJNCMW-ZIAGYGMSSA-N	0	3	332.410	3.368	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)CCCc1cccnc1	ZINC001099286481	1363733139	/nfs/dbraw/zinc/73/31/39/1363733139.db2.gz	YLBHEZPTOIXLAX-GOSISDBHSA-N	0	3	329.488	3.197	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2cnc3ccccc3c2)C[C@H]1C(F)(F)F	ZINC001099313082	1363745005	/nfs/dbraw/zinc/74/50/05/1363745005.db2.gz	PZGYUWXLWGJYAK-GDBMZVCRSA-N	0	3	349.356	3.013	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)COc1cccc(CC)c1	ZINC001099329819	1363753788	/nfs/dbraw/zinc/75/37/88/1363753788.db2.gz	UZSLGTAJLRDSCO-SFHVURJKSA-N	0	3	344.499	3.421	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@H]2CC[C@H](C)CC2)C[C@H]1C(F)(F)F	ZINC001099333947	1363755351	/nfs/dbraw/zinc/75/53/51/1363755351.db2.gz	CXXMUSBYGKYPJG-KBUPBQIOSA-N	0	3	332.410	3.368	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)CCSCC	ZINC001099424748	1363794291	/nfs/dbraw/zinc/79/42/91/1363794291.db2.gz	LJCYNJSYJMWSTA-JJXSEGSLSA-N	0	3	342.936	3.051	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2ocnc2C)C1	ZINC001099473748	1363810882	/nfs/dbraw/zinc/81/08/82/1363810882.db2.gz	IQZMEITVVFGXFM-JXFKEZNVSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1(CCF)CC1	ZINC001099507265	1363824881	/nfs/dbraw/zinc/82/48/81/1363824881.db2.gz	ZKOYYNCEDSGYTD-JJXSEGSLSA-N	0	3	340.870	3.048	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)CCC2(C)CC2)C1	ZINC001099544551	1363841272	/nfs/dbraw/zinc/84/12/72/1363841272.db2.gz	QPTWHTGRQDNLPO-QAETUUGQSA-N	0	3	336.907	3.488	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)[C@@H](C)C(C)(C)C)CC2(CCOCC2)C1	ZINC001099583318	1363864694	/nfs/dbraw/zinc/86/46/94/1363864694.db2.gz	NZFCBVVLYYZVAE-IAGOWNOFSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCCCC(C)C)CC2(CCOCC2)C1	ZINC001099595347	1363878394	/nfs/dbraw/zinc/87/83/94/1363878394.db2.gz	ZFYAFXMNRCFGHH-GOSISDBHSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)C[C@H](C)C(C)(C)C)CC2(CCOCC2)C1	ZINC001099596599	1363879331	/nfs/dbraw/zinc/87/93/31/1363879331.db2.gz	HIFCMLAGJLAYSC-DLBZAZTESA-N	0	3	336.520	3.232	20	30		EGEDHN
CCCCCCCCCC(=O)N[C@H]1CCN(CCCF)C[C@H]1O	ZINC001100087222	1364014143	/nfs/dbraw/zinc/01/41/43/1364014143.db2.gz	IATSSOBAFQISOC-DLBZAZTESA-N	0	3	330.488	3.038	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CCN(CC=C(C)C)C[C@H]2O)CCCCC1	ZINC001100121517	1364021493	/nfs/dbraw/zinc/02/14/93/1364021493.db2.gz	BRYRPRTULGIADY-QZTJIDSGSA-N	0	3	334.504	3.031	20	30		EGEDHN
CCC[C@H](C)C(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1	ZINC001100196832	1364041979	/nfs/dbraw/zinc/04/19/79/1364041979.db2.gz	VKMQVGBNCCLWTA-KTAKPFMOSA-N	0	3	331.435	3.118	20	30		EGEDHN
C/C=C(\C)C(=O)NCC1CC(NCC#Cc2ccc(Cl)cc2)C1	ZINC001100228784	1364050773	/nfs/dbraw/zinc/05/07/73/1364050773.db2.gz	ZYFUWMZZIQAIKG-LZWSPWQCSA-N	0	3	330.859	3.142	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H](C)OCCCCCC)C1	ZINC001100323785	1364080525	/nfs/dbraw/zinc/08/05/25/1364080525.db2.gz	LDBBLFIAZQHYAK-QQFBHYJXSA-N	0	3	330.900	3.209	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCC1CC(NCC(=C)Br)C1	ZINC001100358181	1364089860	/nfs/dbraw/zinc/08/98/60/1364089860.db2.gz	KLYNMKHPYADRBJ-UHFFFAOYSA-N	0	3	341.293	3.148	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100364495	1364092408	/nfs/dbraw/zinc/09/24/08/1364092408.db2.gz	IEMMWHPKYDIFHG-UHFFFAOYSA-N	0	3	342.458	3.264	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H](C)c2c(F)cccc2F)C1	ZINC001100506911	1364139793	/nfs/dbraw/zinc/13/97/93/1364139793.db2.gz	MUIMFBWGEIMHNS-HIFPTAJRSA-N	0	3	342.817	3.305	20	30		EGEDHN
C#CCCCCCC(=O)NCC1CC(NCc2cc(C)ns2)C1	ZINC001100570069	1364166947	/nfs/dbraw/zinc/16/69/47/1364166947.db2.gz	BRIWZQXYCOEOFK-UHFFFAOYSA-N	0	3	333.501	3.020	20	30		EGEDHN
C=CCCC1(C(=O)NCC2CC(NCC#Cc3ccccc3)C2)CC1	ZINC001100642824	1364201038	/nfs/dbraw/zinc/20/10/38/1364201038.db2.gz	PKYQKXFDDJQMQL-UHFFFAOYSA-N	0	3	336.479	3.269	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC1CC(NCc2cccc(OCC)n2)C1	ZINC001100645164	1364202782	/nfs/dbraw/zinc/20/27/82/1364202782.db2.gz	WSJVUIRRDJKHPA-LAGYLCCXSA-N	0	3	345.487	3.067	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC1CC(NCc2cc(F)ccc2OC)C1	ZINC001100713129	1364231974	/nfs/dbraw/zinc/23/19/74/1364231974.db2.gz	QLFVJGSXAZJAIK-UHFFFAOYSA-N	0	3	348.462	3.421	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)C2(F)CCCCC2)C1	ZINC001100826038	1364280007	/nfs/dbraw/zinc/28/00/07/1364280007.db2.gz	HQZVUFOLKBLUTN-UHFFFAOYSA-N	0	3	347.272	3.052	20	30		EGEDHN
O=C(NCC1CC(NCC#Cc2ccccc2)C1)[C@H]1CC12CCCC2	ZINC001100827907	1364281028	/nfs/dbraw/zinc/28/10/28/1364281028.db2.gz	ZYIAWEITJFQWEI-SOAGJPPSSA-N	0	3	336.479	3.103	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@]2(C)CCc3ccccc3C2)C1	ZINC001101084200	1364406529	/nfs/dbraw/zinc/40/65/29/1364406529.db2.gz	LHMFRPOJFZTSLH-UPQHMETBSA-N	0	3	346.902	3.419	20	30		EGEDHN
C=C(C)CCC(=O)NCc1cc(O[C@@H]2CCN(CC(=C)C)C2)ccn1	ZINC001101093579	1364410299	/nfs/dbraw/zinc/41/02/99/1364410299.db2.gz	DZNXZJSMYLGTLC-LJQANCHMSA-N	0	3	343.471	3.083	20	30		EGEDHN
C=CCCC(=O)N1C[C@H]2CN(Cc3sc(C)nc3C)C[C@@]2(C)C1	ZINC001101162850	1364440119	/nfs/dbraw/zinc/44/01/19/1364440119.db2.gz	KJSHWMNXNRESQS-QAPCUYQASA-N	0	3	333.501	3.006	20	30		EGEDHN
C=CCOCCCC(=O)N1C[C@H]2CN(Cc3ccsc3)C[C@@]2(C)C1	ZINC001101190420	1364455182	/nfs/dbraw/zinc/45/51/82/1364455182.db2.gz	DYALJPHLHUOFJD-MJGOQNOKSA-N	0	3	348.512	3.011	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@H]2CN(Cc3cnccc3C)C[C@@]2(C)C1	ZINC001101337960	1364516841	/nfs/dbraw/zinc/51/68/41/1364516841.db2.gz	RRUWQVIIYPVTMT-DSKINZAPSA-N	0	3	341.499	3.273	20	30		EGEDHN
C=CCCCC(=O)N1C[C@H]2CN(Cc3cnc(C)s3)C[C@@]2(C)C1	ZINC001101347070	1364520506	/nfs/dbraw/zinc/52/05/06/1364520506.db2.gz	UTVUHFQQTZOMSJ-QAPCUYQASA-N	0	3	333.501	3.088	20	30		EGEDHN
C=C[C@@H](CC(=O)N1C[C@H]2CN(CC#CC)C[C@@]2(C)C1)c1ccccc1	ZINC001101471551	1364574896	/nfs/dbraw/zinc/57/48/96/1364574896.db2.gz	XDLSMBRQPKDGDV-DWLFOUALSA-N	0	3	336.479	3.150	20	30		EGEDHN
C=CCCCC(=O)N1CCC(C(C)(C)CNCc2ccn(C)n2)CC1	ZINC001101568775	1364624115	/nfs/dbraw/zinc/62/41/15/1364624115.db2.gz	HBMFXFDDRKJUBV-UHFFFAOYSA-N	0	3	346.519	3.131	20	30		EGEDHN
C=CCC[C@@H](C)N1CC2(C1)C[C@H](NC(=O)CCC(C)C)c1nccn12	ZINC001101607668	1364653767	/nfs/dbraw/zinc/65/37/67/1364653767.db2.gz	UVDDHAYIVHMOGL-SJORKVTESA-N	0	3	344.503	3.246	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1CC2(CN(CCC(C)C)C2)n2ccnc21	ZINC001101643040	1364667833	/nfs/dbraw/zinc/66/78/33/1364667833.db2.gz	UBWLFRPBVMJHAQ-APWZRJJASA-N	0	3	344.503	3.103	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1CNC(=O)/C=C\c1ccco1	ZINC001101687892	1364689478	/nfs/dbraw/zinc/68/94/78/1364689478.db2.gz	YOQYUVSTPCPQJH-YZMSFBEDSA-N	0	3	348.446	3.029	20	30		EGEDHN
CCCCCC(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C	ZINC001101722810	1364703985	/nfs/dbraw/zinc/70/39/85/1364703985.db2.gz	BWKVTHYPFLTVAP-UYAOXDASSA-N	0	3	326.484	3.303	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1CNC(=O)CC(C)(C)C	ZINC001101725210	1364704591	/nfs/dbraw/zinc/70/45/91/1364704591.db2.gz	LTLQTRWFYSQESD-IEBWSBKVSA-N	0	3	326.484	3.158	20	30		EGEDHN
CC(C)C(=O)NC[C@@H]1CN(CC#Cc2ccc(Cl)cc2)C[C@H]1C	ZINC001101727461	1364705089	/nfs/dbraw/zinc/70/50/89/1364705089.db2.gz	YCVPRYWZICHTQO-NVXWUHKLSA-N	0	3	332.875	3.032	20	30		EGEDHN
CCC(CC)C(=O)NC[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1C	ZINC001101744103	1364710941	/nfs/dbraw/zinc/71/09/41/1364710941.db2.gz	AYJAZRGHJMZJBG-RDTXWAMCSA-N	0	3	345.462	3.318	20	30		EGEDHN
C/C(=C\C(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C)C1CC1	ZINC001101772318	1364721431	/nfs/dbraw/zinc/72/14/31/1364721431.db2.gz	BVOIWIVATKUMEB-BYPYNOPISA-N	0	3	343.496	3.160	20	30		EGEDHN
CCC[C@@H](C)C(=O)NC[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1C	ZINC001101828713	1364742165	/nfs/dbraw/zinc/74/21/65/1364742165.db2.gz	GWXTZZQSFOCYKJ-ZHALLVOQSA-N	0	3	344.474	3.298	20	30		EGEDHN
CC[C@@H](C)CC(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001101918388	1364774257	/nfs/dbraw/zinc/77/42/57/1364774257.db2.gz	RMPJKMVUHWKEIE-RBSFLKMASA-N	0	3	333.501	3.240	20	30		EGEDHN
C[C@H](c1ccc(F)c(F)c1)N1C[C@@H](CNC(=O)C#CC2CC2)[C@H](C)C1	ZINC001101953871	1364789080	/nfs/dbraw/zinc/78/90/80/1364789080.db2.gz	HPVYGFKHQMCYJR-CKEIUWERSA-N	0	3	346.421	3.123	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccc(Cl)cc2)C[C@H]1CNC(=O)C1(C)CC1	ZINC001101988999	1364801174	/nfs/dbraw/zinc/80/11/74/1364801174.db2.gz	CBUNLJGJVPPQKL-NVXWUHKLSA-N	0	3	344.886	3.176	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC[C@@H]1CN(Cc2oc(C)nc2C)C[C@H]1C	ZINC001101997793	1364804537	/nfs/dbraw/zinc/80/45/37/1364804537.db2.gz	IFCPTBSWXSWHHS-RDTXWAMCSA-N	0	3	345.487	3.244	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NC[C@@H]1CN(Cc2cncs2)C[C@H]1C	ZINC001102003628	1364807700	/nfs/dbraw/zinc/80/77/00/1364807700.db2.gz	HSWJYZZRVOEJJA-DGCLKSJQSA-N	0	3	341.908	3.106	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@@H]1CN(Cc2cc(C)ns2)C[C@H]1C	ZINC001102228720	1364945958	/nfs/dbraw/zinc/94/59/58/1364945958.db2.gz	JIOSWVSENGAKLI-NVXWUHKLSA-N	0	3	347.528	3.219	20	30		EGEDHN
COCC#CCN1C[C@@H](CNC(=O)C[C@@H](C)CCC=C(C)C)[C@H](C)C1	ZINC001102392810	1365037272	/nfs/dbraw/zinc/03/72/72/1365037272.db2.gz	NLIPIVXWZLDQRE-XUVXKRRUSA-N	0	3	348.531	3.093	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CCNC(=O)c1ccco1	ZINC001102639705	1365149084	/nfs/dbraw/zinc/14/90/84/1365149084.db2.gz	JPBCNGMSOXROTK-ZIAGYGMSSA-N	0	3	343.452	3.101	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2ncc(Cl)s2)C1	ZINC001103227828	1365445004	/nfs/dbraw/zinc/44/50/04/1365445004.db2.gz	YQWVZAAJUWUADW-MWLCHTKSSA-N	0	3	348.299	3.237	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC[C@@H]1CN(Cc2cnc(C)o2)C[C@H]1C	ZINC001103402026	1365538124	/nfs/dbraw/zinc/53/81/24/1365538124.db2.gz	XSESTJKSZXDCLF-OGWOLHLISA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC[C@@H]1CN(Cc2ccns2)C[C@H]1C	ZINC001103402049	1365538166	/nfs/dbraw/zinc/53/81/66/1365538166.db2.gz	YQQXARBEXRYBFH-IIDMSEBBSA-N	0	3	335.517	3.320	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC[C@@H]2CN(Cc3cncs3)C[C@H]2C)C1	ZINC001103418708	1365550018	/nfs/dbraw/zinc/55/00/18/1365550018.db2.gz	VPHMQHYMYSOQHQ-HUUCEWRRSA-N	0	3	333.501	3.074	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC[C@@H]1CN(Cc2cc(C)no2)C[C@H]1C	ZINC001103474895	1365584502	/nfs/dbraw/zinc/58/45/02/1365584502.db2.gz	OQZJWYZRHNCMJN-GDBMZVCRSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2ccc(OC)cc2)C1	ZINC001103668545	1365716431	/nfs/dbraw/zinc/71/64/31/1365716431.db2.gz	HPHBYWHMWURCSS-CZUORRHYSA-N	0	3	336.863	3.136	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cc(Cl)c[nH]2)C[C@H]1C	ZINC001103876014	1365821644	/nfs/dbraw/zinc/82/16/44/1365821644.db2.gz	YQBWOMAJZPIVFM-ZYHUDNBSSA-N	0	3	330.259	3.108	20	30		EGEDHN
C=CCC[C@@H](C)[NH2+]CC[C@@H]1CN(C(=O)c2ccccc2[O-])C[C@H]1C	ZINC001103900969	1365828062	/nfs/dbraw/zinc/82/80/62/1365828062.db2.gz	GFPDFEPDAMUMDW-BRWVUGGUSA-N	0	3	330.472	3.435	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@@H](C)[C@H](CCNCc2c(F)cccc2F)C1	ZINC001104163242	1365932760	/nfs/dbraw/zinc/93/27/60/1365932760.db2.gz	FEIKORPBQANSFI-HZPDHXFCSA-N	0	3	348.437	3.198	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](C)[C@H](CCNCc2ccn(CC)n2)C1	ZINC001104239800	1365965834	/nfs/dbraw/zinc/96/58/34/1365965834.db2.gz	QKIRHVJEOCHDRV-IAGOWNOFSA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)[C@H](CCNCc2nc(C)cs2)C1	ZINC001104245343	1365966944	/nfs/dbraw/zinc/96/69/44/1365966944.db2.gz	CRNCMHGMGJUJQK-GDBMZVCRSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cccc(CC)n2)C[C@H]1C	ZINC001104297246	1365978554	/nfs/dbraw/zinc/97/85/54/1365978554.db2.gz	HTZJJRYTRBCWLO-UKRRQHHQSA-N	0	3	335.879	3.084	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)Cc2ccc(C)cc2)C[C@H]1C	ZINC001104397305	1366004408	/nfs/dbraw/zinc/00/44/08/1366004408.db2.gz	HJJLYYZNSPVFHS-CRAIPNDOSA-N	0	3	334.891	3.364	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@H](CCN[C@H](C)c2cnccn2)C1	ZINC001104485538	1366045264	/nfs/dbraw/zinc/04/52/64/1366045264.db2.gz	ADLBVPZHHNZLQX-BRWVUGGUSA-N	0	3	344.503	3.214	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cccc(F)c2F)C[C@H]1C	ZINC001104597521	1366095383	/nfs/dbraw/zinc/09/53/83/1366095383.db2.gz	HAQNDYXJFGPPSY-DGCLKSJQSA-N	0	3	342.817	3.405	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CN(C(=O)C2(CC)CC2)C[C@H]1C	ZINC001104635880	1366113492	/nfs/dbraw/zinc/11/34/92/1366113492.db2.gz	GZJDFMXJBPICPY-TZMCWYRMSA-N	0	3	343.309	3.159	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](C)[C@H](CCNCc3cnoc3C)C2)CCC1	ZINC001104639232	1366115013	/nfs/dbraw/zinc/11/50/13/1366115013.db2.gz	MEQGFOQRQDJKJA-NVXWUHKLSA-N	0	3	345.487	3.304	20	30		EGEDHN
CCCCCCCCC(=O)N1C[C@@H](CNCc2ccn(C)n2)[C@H](C)C1	ZINC001106912326	1366831022	/nfs/dbraw/zinc/83/10/22/1366831022.db2.gz	UVNDVNGZUHTZLG-QZTJIDSGSA-N	0	3	348.535	3.355	20	30		EGEDHN
CCCC[C@@H](CC)C(=O)NC[C@]12CCC[C@H]1N(CC#CCOC)CC2	ZINC001107295864	1366920396	/nfs/dbraw/zinc/92/03/96/1366920396.db2.gz	AGRGGKJXNUQJHF-SFHLNBCPSA-N	0	3	348.531	3.213	20	30		EGEDHN
C[C@H](C#N)C(=O)NC[C@]12CCC[C@H]1N(Cc1ccccc1Cl)CC2	ZINC001107336334	1366931839	/nfs/dbraw/zinc/93/18/39/1366931839.db2.gz	LQPUGOHRYNYJQW-LSBZLQRGSA-N	0	3	345.874	3.360	20	30		EGEDHN
CCC[C@@H](C)CC(=O)N1CC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001189281030	1366975842	/nfs/dbraw/zinc/97/58/42/1366975842.db2.gz	WSXCJMFWUPCJPW-APWZRJJASA-N	0	3	327.472	3.417	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@]12CCC[C@H]1N(Cc1cnc(C)o1)CC2	ZINC001107533791	1367024824	/nfs/dbraw/zinc/02/48/24/1367024824.db2.gz	GZYRHDDRSNCJJI-YZGWKJHDSA-N	0	3	345.487	3.446	20	30		EGEDHN
Cc1ccccc1CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C#CC(C)C)C2	ZINC001109250313	1367026445	/nfs/dbraw/zinc/02/64/45/1367026445.db2.gz	PYXUYHREZGVBDY-HKBOAZHASA-N	0	3	338.495	3.309	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCCc1ccccc1Cl)C2	ZINC001109382728	1367097358	/nfs/dbraw/zinc/09/73/58/1367097358.db2.gz	PKNFBZITLSSUQJ-NEWSRXKRSA-N	0	3	344.886	3.408	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](N(C)CCOc2ccccc2C)C1	ZINC001189743932	1367100350	/nfs/dbraw/zinc/10/03/50/1367100350.db2.gz	KMWJAYBIVXVMJO-LJQANCHMSA-N	0	3	342.483	3.100	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)C[C@@H](CC)C(C)(C)C)[C@@H]2C1	ZINC001189762633	1367104505	/nfs/dbraw/zinc/10/45/05/1367104505.db2.gz	CVGQBMKYNGUPMW-RCCFBDPRSA-N	0	3	336.520	3.184	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2cccc(C)c2)C1	ZINC001107711645	1367114290	/nfs/dbraw/zinc/11/42/90/1367114290.db2.gz	JGVZRYWOEPHXFG-YLJYHZDGSA-N	0	3	330.472	3.170	20	30		EGEDHN
CC[C@@H](C)CC(=O)N1CC[C@@H](N(C)Cc2ccc(OC)c(C#N)c2)C1	ZINC001189883865	1367123113	/nfs/dbraw/zinc/12/31/13/1367123113.db2.gz	ZHQFDZRNEOHRIF-CRAIPNDOSA-N	0	3	343.471	3.036	20	30		EGEDHN
COc1cc(CN(C)[C@@H]2CCN(C(=O)C#CC(C)(C)C)C2)ccc1C	ZINC001190083946	1367168327	/nfs/dbraw/zinc/16/83/27/1367168327.db2.gz	HWZGWKDQWPBARJ-GOSISDBHSA-N	0	3	342.483	3.086	20	30		EGEDHN
COc1cc(CN(C)[C@H]2CCN(C(=O)C#CC(C)(C)C)C2)ccc1C	ZINC001190083947	1367168631	/nfs/dbraw/zinc/16/86/31/1367168631.db2.gz	HWZGWKDQWPBARJ-SFHVURJKSA-N	0	3	342.483	3.086	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2ccoc2CC)C1	ZINC001107910698	1367198182	/nfs/dbraw/zinc/19/81/82/1367198182.db2.gz	MKSDVBDVVDFFFW-HNAYVOBHSA-N	0	3	334.460	3.017	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCc1scnc1C	ZINC001109596188	1367220391	/nfs/dbraw/zinc/22/03/91/1367220391.db2.gz	IKLHYUOTTHERNE-PMPSAXMXSA-N	0	3	347.528	3.318	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H](N(C)CCOCC2CCC2)C1	ZINC001190353875	1367235937	/nfs/dbraw/zinc/23/59/37/1367235937.db2.gz	CJIZTZNJSSZDTP-MRXNPFEDSA-N	0	3	342.911	3.115	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](N(C)Cc2ccc(COC)cc2)C1	ZINC001190398484	1367253917	/nfs/dbraw/zinc/25/39/17/1367253917.db2.gz	WFKHJUNVOJPXQY-LJQANCHMSA-N	0	3	344.499	3.468	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2cc(F)ccc2C)C1	ZINC001108106968	1367285182	/nfs/dbraw/zinc/28/51/82/1367285182.db2.gz	MRMGLDQUXOCLQL-UZLBHIALSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@@H](C)CCOc3ccccc3)[C@@H]2C1	ZINC001190541495	1367288856	/nfs/dbraw/zinc/28/88/56/1367288856.db2.gz	AGCRVTXYBNIWAH-CMKODMSKSA-N	0	3	342.483	3.200	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@@]1(C)CN(CC2CC(C)(C)C2)CCO1	ZINC001108121608	1367290741	/nfs/dbraw/zinc/29/07/41/1367290741.db2.gz	CPTCFJJEPCZZCI-NRFANRHFSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@@]1(C)CN(CC2CC(C)(C)C2)CCO1	ZINC001108151888	1367312298	/nfs/dbraw/zinc/31/22/98/1367312298.db2.gz	VWLGBTCEPRLTDZ-UZLBHIALSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](C)CC1CCCC1)C2	ZINC001109795083	1367328102	/nfs/dbraw/zinc/32/81/02/1367328102.db2.gz	VCWAEOMMLGAIGR-YSHGAJCASA-N	0	3	334.504	3.127	20	30		EGEDHN
C=CC1(CC(=O)N[C@H]2C[C@H]3CC[C@@H]2N3[C@H](C)COC)CCCCC1	ZINC001109830386	1367344509	/nfs/dbraw/zinc/34/45/09/1367344509.db2.gz	XQJODXJXOOCHJH-BDXSIMOUSA-N	0	3	334.504	3.269	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2cc(C)ccc2F)C1	ZINC001108241586	1367356377	/nfs/dbraw/zinc/35/63/77/1367356377.db2.gz	FGGBIRJTHGGUFU-JXFKEZNVSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2cc(C)ccc2C)C1	ZINC001108364958	1367414365	/nfs/dbraw/zinc/41/43/65/1367414365.db2.gz	YRQCQFJODVJUSZ-RXVVDRJESA-N	0	3	344.499	3.479	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2ccc(CF)cc2)C1	ZINC001108429000	1367453254	/nfs/dbraw/zinc/45/32/54/1367453254.db2.gz	DURMYMNQFWBQTN-JXFKEZNVSA-N	0	3	348.462	3.332	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCc1ccccc1Cl)C2	ZINC001110074245	1367494636	/nfs/dbraw/zinc/49/46/36/1367494636.db2.gz	JWYBWGXSGAWDGC-NJAFHUGGSA-N	0	3	330.859	3.017	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](N(C)CCOCCC(C)C)C1	ZINC001191726950	1367571887	/nfs/dbraw/zinc/57/18/87/1367571887.db2.gz	FAJHSEDNHMKOCX-LJQANCHMSA-N	0	3	336.520	3.166	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](N(C)Cc2ccc(F)cc2C)C1	ZINC001191859347	1367616420	/nfs/dbraw/zinc/61/64/20/1367616420.db2.gz	KJHJCFQAMXBIFU-IBGZPJMESA-N	0	3	330.447	3.360	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001191868160	1367620436	/nfs/dbraw/zinc/62/04/36/1367620436.db2.gz	OZEINKCYLQEWTQ-QFBILLFUSA-N	0	3	325.456	3.193	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@@H](N(C)Cc2cccc(COC)c2)C1	ZINC001191911803	1367635835	/nfs/dbraw/zinc/63/58/35/1367635835.db2.gz	JTOGZWOKBNXCOO-FXAWDEMLSA-N	0	3	344.499	3.468	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccccc1C	ZINC001110366239	1367670122	/nfs/dbraw/zinc/67/01/22/1367670122.db2.gz	MYFJLTUMXIAYOC-AFYVEPGGSA-N	0	3	342.483	3.198	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CC1=CCCCC1	ZINC001110366635	1367671540	/nfs/dbraw/zinc/67/15/40/1367671540.db2.gz	YIYFWVRONLEXRX-AITUJVMLSA-N	0	3	332.488	3.190	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCCOc1ccc(F)cc1	ZINC001110371203	1367674033	/nfs/dbraw/zinc/67/40/33/1367674033.db2.gz	FUIWJGHDHYZDIW-QRQLOZEOSA-N	0	3	346.446	3.282	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](N(C)Cc2cccc(COC)c2)C1	ZINC001192073718	1367681891	/nfs/dbraw/zinc/68/18/91/1367681891.db2.gz	VPWKVPLBBSTYDQ-LJQANCHMSA-N	0	3	330.472	3.222	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccc2c(c1)CCC2	ZINC001110493368	1367781120	/nfs/dbraw/zinc/78/11/20/1367781120.db2.gz	NXNSCECKHAVXHH-NJYVYQBISA-N	0	3	336.479	3.200	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CC/C=C/c1ccccc1	ZINC001110538205	1367818065	/nfs/dbraw/zinc/81/80/65/1367818065.db2.gz	RXAVDHLIKWNPGY-XKUAUUTASA-N	0	3	336.479	3.471	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCc1cccs1	ZINC001110543808	1367822220	/nfs/dbraw/zinc/82/22/20/1367822220.db2.gz	JVTRNYRODBPDKX-OIISXLGYSA-N	0	3	330.497	3.062	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](N(C)CCOc2ccccc2)C1	ZINC001192577358	1367822949	/nfs/dbraw/zinc/82/29/49/1367822949.db2.gz	FOSXXABGOQPOSQ-KRWDZBQOSA-N	0	3	330.472	3.200	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cnc([C@H](C)OC)s1)C2	ZINC001110565565	1367837187	/nfs/dbraw/zinc/83/71/87/1367837187.db2.gz	GFONSBILFDNDID-YJNKXOJESA-N	0	3	349.500	3.152	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCN(C(=O)CCC(C)(C)C)C1	ZINC001192947699	1367909158	/nfs/dbraw/zinc/90/91/58/1367909158.db2.gz	KOIPLPLVKUZBTH-GOSISDBHSA-N	0	3	327.472	3.417	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2ccc(CC(C)C)cc2)C1	ZINC001193921256	1368147582	/nfs/dbraw/zinc/14/75/82/1368147582.db2.gz	JQUMKKFTMXXIQV-FQEVSTJZSA-N	0	3	344.499	3.234	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](N(C)CCOC(C)C)C2)CCCCC1	ZINC001194199392	1368206655	/nfs/dbraw/zinc/20/66/55/1368206655.db2.gz	CEUJCTNTZIPPAT-GOSISDBHSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)C[C@@H](C)c2ccc(F)cc2)C1	ZINC001194200880	1368207480	/nfs/dbraw/zinc/20/74/80/1368207480.db2.gz	PDEFIALWWBYQRC-VQIMIIECSA-N	0	3	348.462	3.055	20	30		EGEDHN
C=CCC[C@@H](C(=O)N1CC[C@@H](N(C)CCOCC)C1)c1ccccc1	ZINC001194555064	1368285121	/nfs/dbraw/zinc/28/51/21/1368285121.db2.gz	ICKORAGXECDOIL-WOJBJXKFSA-N	0	3	344.499	3.306	20	30		EGEDHN
C=CCC[C@@H](C(=O)N1CC[C@H](N(C)CCOCC)C1)c1ccccc1	ZINC001194555063	1368285579	/nfs/dbraw/zinc/28/55/79/1368285579.db2.gz	ICKORAGXECDOIL-VQTJNVASSA-N	0	3	344.499	3.306	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1scnc1Cl)C2	ZINC001111410838	1368302741	/nfs/dbraw/zinc/30/27/41/1368302741.db2.gz	YHUXQCZGNKDRLF-UTUOFQBUSA-N	0	3	325.865	3.098	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](C)CCCc1ccccc1)C2	ZINC001111477811	1368316290	/nfs/dbraw/zinc/31/62/90/1368316290.db2.gz	AIALQLOBUFJOHK-KCLUMXDGSA-N	0	3	338.495	3.390	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccc(CC)cc1	ZINC001111487367	1368319152	/nfs/dbraw/zinc/31/91/52/1368319152.db2.gz	LUABTACJLOMEFE-AQNXPRMDSA-N	0	3	342.483	3.063	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)C2CCC3(CC3)CC2)C1	ZINC001194778378	1368320368	/nfs/dbraw/zinc/32/03/68/1368320368.db2.gz	SRCFHAJYNGIGBT-QZTJIDSGSA-N	0	3	336.520	3.089	20	30		EGEDHN
CC(C)CCC(=O)N[C@]12CCC[C@H]1CN(Cc1cccc(C#N)c1)C2	ZINC001111585504	1368353288	/nfs/dbraw/zinc/35/32/88/1368353288.db2.gz	XSAFCSBAYIUKEY-FPOVZHCZSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC[C@H](C)CC(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(C#N)cc1)C2	ZINC001111728132	1368431201	/nfs/dbraw/zinc/43/12/01/1368431201.db2.gz	WDDNOUCLDVHLQC-LRQRDZAKSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)COc2ccc(C(C)C)cc2)C1	ZINC001111800365	1368467751	/nfs/dbraw/zinc/46/77/51/1368467751.db2.gz	QFXXNQTYDGHCEZ-RXVVDRJESA-N	0	3	342.483	3.346	20	30		EGEDHN
C#CCCCCCC(=O)N[C@]12CCC[C@H]1CN(CCC(F)(F)F)C2	ZINC001111833735	1368489362	/nfs/dbraw/zinc/48/93/62/1368489362.db2.gz	FQGLIGBFBLRRGV-RDJZCZTQSA-N	0	3	344.421	3.493	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@]12CCC[C@H]1CN(Cc1cncc(C)c1)C2	ZINC001111850786	1368504904	/nfs/dbraw/zinc/50/49/04/1368504904.db2.gz	SITHGNPZMXJLKN-CUWPLCDZSA-N	0	3	341.499	3.463	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN([C@H](CC)c3ccccc3)C[C@H]2O)CCC1	ZINC001195940372	1368520204	/nfs/dbraw/zinc/52/02/04/1368520204.db2.gz	SSLNEPJDTGOULF-GUDVDZBRSA-N	0	3	342.483	3.045	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCCN(CC2CC(F)(F)C2)CC1	ZINC001195966700	1368524393	/nfs/dbraw/zinc/52/43/93/1368524393.db2.gz	SKWMGIBBLXLXQX-UHFFFAOYSA-N	0	3	326.431	3.334	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2ccnn2CC(C)C)CC1	ZINC001195996637	1368531979	/nfs/dbraw/zinc/53/19/79/1368531979.db2.gz	BDXIQCBEPGFKOO-UHFFFAOYSA-N	0	3	346.519	3.433	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2cc3ccncc3s2)CC1	ZINC001196177777	1368562895	/nfs/dbraw/zinc/56/28/95/1368562895.db2.gz	OPZZQBLJPDBQHR-UHFFFAOYSA-N	0	3	329.469	3.410	20	30		EGEDHN
CC[C@H](F)CN1C[C@@H]2CCC[C@]2(NC(=O)CC#Cc2ccccc2)C1	ZINC001111999362	1368603337	/nfs/dbraw/zinc/60/33/37/1368603337.db2.gz	FQGIVOAJXOYVQV-ZJOUEHCJSA-N	0	3	342.458	3.147	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H]2CCC[C@]2(CNCc2csc(C)n2)C1	ZINC001112282667	1368747923	/nfs/dbraw/zinc/74/79/23/1368747923.db2.gz	JRZAJTNSMNQSAT-YJBOKZPZSA-N	0	3	333.501	3.136	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H]2CCC[C@]2(CNCc2cc(C)no2)C1	ZINC001112373697	1368799963	/nfs/dbraw/zinc/79/99/63/1368799963.db2.gz	CMMIOGRFZFYMHU-JXFKEZNVSA-N	0	3	345.487	3.304	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cnn(CC3CC3)c2)CC1	ZINC001197713900	1368879027	/nfs/dbraw/zinc/87/90/27/1368879027.db2.gz	OJMTUHXAFZCTIO-UHFFFAOYSA-N	0	3	346.519	3.411	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@@H](C)CCC(C)(C)C)C1	ZINC001197800059	1368900419	/nfs/dbraw/zinc/90/04/19/1368900419.db2.gz	WFJMLUWNKNXRCO-RCCFBDPRSA-N	0	3	338.536	3.357	20	30		EGEDHN
CCCCCCCC[C@H](C)C(=O)N1CCCN(CCCO)CC1	ZINC001198198284	1368978601	/nfs/dbraw/zinc/97/86/01/1368978601.db2.gz	YPTCUZZDGZERBJ-SFHVURJKSA-N	0	3	326.525	3.290	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)C[C@@H](C)c2ccccc2)C1	ZINC001198380664	1369019516	/nfs/dbraw/zinc/01/95/16/1369019516.db2.gz	POENBALHIQQWOX-MISYRCLQSA-N	0	3	344.499	3.088	20	30		EGEDHN
C=CCC[C@H](C(=O)N1CCCN([C@@H](C)COC)CC1)c1ccccc1	ZINC001198411259	1369026037	/nfs/dbraw/zinc/02/60/37/1369026037.db2.gz	NZFUMSVOQHAATB-ICSRJNTNSA-N	0	3	344.499	3.306	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)[C@@H](CC)OCC)c1ccccc1OC	ZINC001198584132	1369066311	/nfs/dbraw/zinc/06/63/11/1369066311.db2.gz	BGZQNAHDDVBYPO-QZTJIDSGSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC[C@H](NCC(C)C)c1ccccc1OC	ZINC001198596595	1369069372	/nfs/dbraw/zinc/06/93/72/1369069372.db2.gz	SRWQJEVYIJYIQM-AEFFLSMTSA-N	0	3	348.487	3.079	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)CO[C@H](C)CC)c1ccccc1OC	ZINC001198669044	1369087230	/nfs/dbraw/zinc/08/72/30/1369087230.db2.gz	XAHARBWLQHNKAK-AEFFLSMTSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCC[C@H](C)N[C@H](CNC(=O)C#CC1CC1)c1ccccc1OC	ZINC001198723845	1369099979	/nfs/dbraw/zinc/09/99/79/1369099979.db2.gz	LJBZOOOXUJLZPY-QFBILLFUSA-N	0	3	340.467	3.210	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@H]1CCC1(F)F)c1ccccc1OC	ZINC001198766648	1369108287	/nfs/dbraw/zinc/10/82/87/1369108287.db2.gz	FNPLFADCHPFQFX-CABCVRRESA-N	0	3	338.398	3.064	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)c1ccc(CC)o1)c1ccccc1OC	ZINC001198776100	1369111002	/nfs/dbraw/zinc/11/10/02/1369111002.db2.gz	MLRPKGQDCRWENM-KRWDZBQOSA-N	0	3	342.439	3.487	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)Cc2cncc3ccccc32)CC1	ZINC001112978818	1369121495	/nfs/dbraw/zinc/12/14/95/1369121495.db2.gz	UDGOQRVHQQRMSL-KRWDZBQOSA-N	0	3	337.467	3.276	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NC[C@@H](NCCC)c1ccccc1OC	ZINC001198819880	1369121512	/nfs/dbraw/zinc/12/15/12/1369121512.db2.gz	XHPWGSINJJDRER-YLJYHZDGSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)[C@H](CCC)OC)c1ccccc1OC	ZINC001198828015	1369123473	/nfs/dbraw/zinc/12/34/73/1369123473.db2.gz	WJSMUBMEJJCTPX-HKUYNNGSSA-N	0	3	348.487	3.223	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@H](NCCC)c1ccccc1OC	ZINC001198843722	1369128109	/nfs/dbraw/zinc/12/81/09/1369128109.db2.gz	WXNUWNAQCNWFIM-SFHVURJKSA-N	0	3	330.472	3.436	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@@H](NCCC)c1ccccc1OC	ZINC001198843721	1369128369	/nfs/dbraw/zinc/12/83/69/1369128369.db2.gz	WXNUWNAQCNWFIM-GOSISDBHSA-N	0	3	330.472	3.436	20	30		EGEDHN
C=CCCC(=O)N1CCC(NCc2cc(-c3ccccc3)on2)CC1	ZINC001199706540	1369257988	/nfs/dbraw/zinc/25/79/88/1369257988.db2.gz	KXOXCJNTTXQXPC-UHFFFAOYSA-N	0	3	339.439	3.388	20	30		EGEDHN
C=C(Br)CNC1CCN(C(=O)/C=C\C(C)(C)C)CC1	ZINC001199848045	1369281057	/nfs/dbraw/zinc/28/10/57/1369281057.db2.gz	SVHKRWVKXJYRJR-YVMONPNESA-N	0	3	329.282	3.078	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CC#Cc1ccccc1	ZINC001325529478	1387998036	/nfs/dbraw/zinc/99/80/36/1387998036.db2.gz	IACYKPXUMACORM-NQIIRXRSSA-N	0	3	332.447	3.065	20	30		EGEDHN
C=C(C)CCC(=O)N1CCCO[C@@H](CN[C@H](C)c2ccccc2F)C1	ZINC001200621465	1369401415	/nfs/dbraw/zinc/40/14/15/1369401415.db2.gz	JAISOEZWSCSBLY-SJORKVTESA-N	0	3	348.462	3.450	20	30		EGEDHN
C#CCC1(C(=O)N2CCC(NC/C(Cl)=C\Cl)CC2)CCC1	ZINC001201002445	1369465185	/nfs/dbraw/zinc/46/51/85/1369465185.db2.gz	MWDHVGWEGUYOCA-ACCUITESSA-N	0	3	329.271	3.080	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCCO[C@@H](CNCc2cccc(F)c2)C1	ZINC001201516712	1369563833	/nfs/dbraw/zinc/56/38/33/1369563833.db2.gz	YYYRDWUVTPSAPU-SFHVURJKSA-N	0	3	348.462	3.135	20	30		EGEDHN
COc1ccc(C#N)cc1Nc1cccc(CN2CCN(C)CC2)c1	ZINC001201588272	1369583155	/nfs/dbraw/zinc/58/31/55/1369583155.db2.gz	QATNOBGHTVWEKH-UHFFFAOYSA-N	0	3	336.439	3.058	20	30		EGEDHN
CCCCCCCN1CCN(CCNC(=O)OC(C)(C)C)CC1	ZINC001201761736	1369618676	/nfs/dbraw/zinc/61/86/76/1369618676.db2.gz	QISVYKDNMXUXRL-UHFFFAOYSA-N	0	3	327.513	3.099	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC(NCc2cc(C3CC3)no2)CC1	ZINC001202005076	1369665433	/nfs/dbraw/zinc/66/54/33/1369665433.db2.gz	XNEBHUZVRJKPOR-UHFFFAOYSA-N	0	3	343.471	3.216	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)N1CCC(NCc2nc3ccccc3o2)CC1	ZINC001202092058	1369685780	/nfs/dbraw/zinc/68/57/80/1369685780.db2.gz	GZXCVHKZIOGKNT-CABCVRRESA-N	0	3	341.455	3.367	20	30		EGEDHN
C=CCCC(=O)NC1[C@H]2CN(C/C=C/c3ccc(Cl)cc3)C[C@@H]12	ZINC001114026224	1369690512	/nfs/dbraw/zinc/69/05/12/1369690512.db2.gz	YAQAAWAUVKETMM-LFJURXANSA-N	0	3	330.859	3.366	20	30		EGEDHN
O=C(N[C@@H]1C[C@@H](NCC#Cc2ccc(Cl)cc2)C12CCC2)C1CC1	ZINC001202282057	1369728785	/nfs/dbraw/zinc/72/87/85/1369728785.db2.gz	XDZOBZWKVKIXOH-QZTJIDSGSA-N	0	3	342.870	3.119	20	30		EGEDHN
CCCC1(C(=O)N2CCC(NCc3cc(F)ccc3C#N)CC2)CC1	ZINC001202398095	1369760217	/nfs/dbraw/zinc/76/02/17/1369760217.db2.gz	JGDUXKXIPCPINX-UHFFFAOYSA-N	0	3	343.446	3.358	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1[C@H]2CN([C@H](C)c3cccc(F)c3)C[C@H]21	ZINC001114166661	1369771838	/nfs/dbraw/zinc/77/18/38/1369771838.db2.gz	WFCZRCPNWGIRRN-QKUWSGOFSA-N	0	3	328.431	3.127	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@H](NCc2ccncc2Cl)C12CCC2	ZINC001202593287	1369816322	/nfs/dbraw/zinc/81/63/22/1369816322.db2.gz	ZMZGXYLVTJCXMZ-HOTGVXAUSA-N	0	3	333.863	3.218	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@H](NCc2ccc(C#N)cc2F)C12CCC2	ZINC001202598512	1369818324	/nfs/dbraw/zinc/81/83/24/1369818324.db2.gz	GZRSRBPPKGBDAR-ZWKOTPCHSA-N	0	3	341.430	3.181	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001202693664	1369853939	/nfs/dbraw/zinc/85/39/39/1369853939.db2.gz	BJLJYFJPZOVBHQ-UHFFFAOYSA-N	0	3	325.456	3.241	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@@H](NC(=O)C(F)=C(C)C)C12CCC2	ZINC001202735290	1369872496	/nfs/dbraw/zinc/87/24/96/1369872496.db2.gz	LZFIVZIAVXEEMS-VXGBXAGGSA-N	0	3	345.256	3.175	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1C[C@H](NCc2ccncc2Cl)C12CCC2	ZINC001202844879	1369905638	/nfs/dbraw/zinc/90/56/38/1369905638.db2.gz	AEGGUSBXCJINGD-IRXDYDNUSA-N	0	3	345.874	3.056	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@@H](NC(=O)/C=C(/C)CC)C12CCC2	ZINC001202846326	1369906364	/nfs/dbraw/zinc/90/63/64/1369906364.db2.gz	JTOJZEQFLLXNRY-RDNHTORASA-N	0	3	341.293	3.268	20	30		EGEDHN
O=C(C#CC1CC1)N[C@H]1C[C@@H](NCc2sccc2Cl)C12CCC2	ZINC001202888761	1369917731	/nfs/dbraw/zinc/91/77/31/1369917731.db2.gz	UBOWLDBHRAZODN-CVEARBPZSA-N	0	3	348.899	3.332	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2[C@H]3CN([C@H](C)c4cccc(F)c4)C[C@H]32)CCC1	ZINC001114396764	1369931926	/nfs/dbraw/zinc/93/19/26/1369931926.db2.gz	DGKPGMWSAAYVJQ-OAOYMFHYSA-N	0	3	340.442	3.127	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1C[C@H](NCc2c(C)noc2C)C12CCC2	ZINC001202960245	1369937107	/nfs/dbraw/zinc/93/71/07/1369937107.db2.gz	LNXSTOLBDVIAIQ-IRXDYDNUSA-N	0	3	345.487	3.411	20	30		EGEDHN
CC1(CCC(=O)N2CCC(NCc3cc(F)ccc3C#N)CC2)CC1	ZINC001203181445	1370013414	/nfs/dbraw/zinc/01/34/14/1370013414.db2.gz	BJYMHXDYNAFUSD-UHFFFAOYSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1C[C@H](NCc2oc(C)nc2C)C12CCC2	ZINC001203257580	1370045002	/nfs/dbraw/zinc/04/50/02/1370045002.db2.gz	NGCYPBDXDXJDNO-DLBZAZTESA-N	0	3	345.487	3.411	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001203275442	1370055949	/nfs/dbraw/zinc/05/59/49/1370055949.db2.gz	UWSJAHGVRBRRPM-OALUTQOASA-N	0	3	336.479	3.267	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1C[C@H](NCc2ncccc2C)C12CCC2	ZINC001203281111	1370059182	/nfs/dbraw/zinc/05/91/82/1370059182.db2.gz	MUDPBWFFJSCBAU-RBUKOAKNSA-N	0	3	339.483	3.101	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1C[C@@H](NCc2oc(C)nc2C)C12CCC2	ZINC001203282029	1370060004	/nfs/dbraw/zinc/06/00/04/1370060004.db2.gz	UUVMXPXWDXXFNX-CVEARBPZSA-N	0	3	331.460	3.021	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1[C@H]2CN(Cc3cc(F)ccc3C)C[C@H]21	ZINC001114791621	1370083040	/nfs/dbraw/zinc/08/30/40/1370083040.db2.gz	HSNAYNKCQVQZFE-DOADOZAASA-N	0	3	330.447	3.283	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2[C@H]3CN(Cc4csc(C)c4)C[C@H]32)CC1	ZINC001114795915	1370085526	/nfs/dbraw/zinc/08/55/26/1370085526.db2.gz	BUOZDOPQJBJCGL-FVQHAEBGSA-N	0	3	330.497	3.349	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1C[C@@H](NCc2ccc(F)cn2)C12CCC2	ZINC001203339681	1370089334	/nfs/dbraw/zinc/08/93/34/1370089334.db2.gz	IWZBTFOHAXFNOH-SJORKVTESA-N	0	3	331.435	3.094	20	30		EGEDHN
CCC1(C(=O)N[C@@H]2C[C@H](NCC#Cc3ccccc3)C23CCC3)CC1	ZINC001203387851	1370108848	/nfs/dbraw/zinc/10/88/48/1370108848.db2.gz	XUCQSPZTDBTYLT-RBUKOAKNSA-N	0	3	336.479	3.245	20	30		EGEDHN
O=C(N[C@@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2)C1CC2(CC2)C1	ZINC001203402614	1370113572	/nfs/dbraw/zinc/11/35/72/1370113572.db2.gz	IQRJSJSNWRWPPN-VQTJNVASSA-N	0	3	348.490	3.245	20	30		EGEDHN
C=CCN1C(=O)CCC[C@]12CCCN(Cc1ccccc1OC)C2	ZINC001203427495	1370122017	/nfs/dbraw/zinc/12/20/17/1370122017.db2.gz	IQBXOACMTMBRII-HXUWFJFHSA-N	0	3	328.456	3.228	20	30		EGEDHN
C[C@H](CC(C)(C)C)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001114937025	1370163739	/nfs/dbraw/zinc/16/37/39/1370163739.db2.gz	HFNMBNMPNITQEC-OAOYMFHYSA-N	0	3	339.483	3.177	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)CCCc2cccnc2)C12CCC2	ZINC001203554325	1370167975	/nfs/dbraw/zinc/16/79/75/1370167975.db2.gz	BZRCIVYYSGSNBA-IAGOWNOFSA-N	0	3	347.890	3.174	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)CCCn2cccc2)C12CCC2	ZINC001203770211	1370258139	/nfs/dbraw/zinc/25/81/39/1370258139.db2.gz	FGBJBOSOABMRRT-CVEARBPZSA-N	0	3	335.879	3.038	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CC2)NC(=O)Nc2ccccc23)cc1	ZINC001203905521	1370310115	/nfs/dbraw/zinc/31/01/15/1370310115.db2.gz	QPXMYOCXJZXDAC-UHFFFAOYSA-N	0	3	332.407	3.185	20	30		EGEDHN
CC(C)(F)C(=O)NCC1(NCc2ccc(C#N)cc2F)CCCCC1	ZINC001115380342	1370419475	/nfs/dbraw/zinc/41/94/75/1370419475.db2.gz	YISBWHRMTXGAGO-UHFFFAOYSA-N	0	3	349.425	3.354	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCC1(NCc2cc(C)ncn2)CCCCC1	ZINC001115555115	1370553034	/nfs/dbraw/zinc/55/30/34/1370553034.db2.gz	ZEHRZXACKYTQAD-UHFFFAOYSA-N	0	3	344.503	3.296	20	30		EGEDHN
C=C(C)CCC(=O)NCC1(NCc2cc(OC)ccn2)CCCCC1	ZINC001115556865	1370554704	/nfs/dbraw/zinc/55/47/04/1370554704.db2.gz	GKDWHDWJDJMCIV-UHFFFAOYSA-N	0	3	345.487	3.355	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H]2CN(Cc3cccc(OC)c3C)C[C@H]21	ZINC001187239464	1388079604	/nfs/dbraw/zinc/07/96/04/1388079604.db2.gz	CRAKQKJCUMGKBS-ZWKOTPCHSA-N	0	3	328.456	3.003	20	30		EGEDHN
C#CCC1(C(=O)NCC2(NCc3cncs3)CCCCC2)CCC1	ZINC001115567973	1370569224	/nfs/dbraw/zinc/56/92/24/1370569224.db2.gz	YHXNMXLJNSVENQ-UHFFFAOYSA-N	0	3	345.512	3.245	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cc3cccn3cn2)CCCCC1	ZINC001115591863	1370593041	/nfs/dbraw/zinc/59/30/41/1370593041.db2.gz	ITOQAOBKQTZMQC-UHFFFAOYSA-N	0	3	346.862	3.109	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC1(NCc2conc2C)CCCCC1	ZINC001115661628	1370645445	/nfs/dbraw/zinc/64/54/45/1370645445.db2.gz	IADCDGRWMXKZPT-UHFFFAOYSA-N	0	3	333.476	3.494	20	30		EGEDHN
C=CCCN1C[C@@H](O)[C@H](N(Cc2ccccc2)C(=O)C(CC)CC)C1	ZINC001205090946	1370647035	/nfs/dbraw/zinc/64/70/35/1370647035.db2.gz	SLCOZNDFJYUPGP-WOJBJXKFSA-N	0	3	344.499	3.073	20	30		EGEDHN
N#Cc1ccc(F)c(CNC2(CNC(=O)CCCF)CCCCC2)c1	ZINC001115671371	1370653225	/nfs/dbraw/zinc/65/32/25/1370653225.db2.gz	WTWUDFRLWYFEHU-UHFFFAOYSA-N	0	3	349.425	3.356	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCC1(NCc2cnoc2C)CCCCC1	ZINC001115684988	1370667380	/nfs/dbraw/zinc/66/73/80/1370667380.db2.gz	QAANHJAWMTUDFA-INIZCTEOSA-N	0	3	333.476	3.494	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC1(NCc2cc(C)ncn2)CCCCC1	ZINC001115712323	1370691516	/nfs/dbraw/zinc/69/15/16/1370691516.db2.gz	GPXJDSHQKLCJAI-IBGZPJMESA-N	0	3	344.503	3.296	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)/C=C(\C)CC)CC[C@H]1c1ccc(F)cc1	ZINC001205276393	1370703642	/nfs/dbraw/zinc/70/36/42/1370703642.db2.gz	VRFDXRYGNBLWGO-ZTIKBKQBSA-N	0	3	328.431	3.089	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H](CC)CCC)C[C@H]1c1cccc(F)c1	ZINC001205448999	1370758905	/nfs/dbraw/zinc/75/89/05/1370758905.db2.gz	OXIGKPNGTOIHFK-AYOQOUSVSA-N	0	3	330.447	3.169	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C[C@H](C)C(C)(C)C)C[C@H]1c1cccc(F)c1	ZINC001205452590	1370760166	/nfs/dbraw/zinc/76/01/66/1370760166.db2.gz	JJNBSBDIDUTVBW-ZYSHUDEJSA-N	0	3	344.474	3.415	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@@H](CC)CCCC)[C@@H]3COC[C@@H]32)CC1	ZINC001205474272	1370766031	/nfs/dbraw/zinc/76/60/31/1370766031.db2.gz	QTPCXZPEDLEESV-GBESFXJTSA-N	0	3	348.531	3.328	20	30		EGEDHN
C[NH+](C)[C@@H]1CCCC[C@H]1/N=C\c1cc(Br)ccc1[O-]	ZINC001116024308	1370821188	/nfs/dbraw/zinc/82/11/88/1370821188.db2.gz	PWKCGVCBTBQLEP-SRDPGZLCSA-N	0	3	325.250	3.446	20	30		EGEDHN
CC(C)(C)/C=C/C(=O)N1CC[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001187357448	1388098726	/nfs/dbraw/zinc/09/87/26/1388098726.db2.gz	UQWOMLSDLKBGOP-VKJZPDJHSA-N	0	3	337.467	3.193	20	30		EGEDHN
COC(=O)CC(C)(C)N(C)CC#Cc1ccc(OC(F)(F)F)cc1	ZINC001116352685	1370892124	/nfs/dbraw/zinc/89/21/24/1370892124.db2.gz	SJBSDUGNTXHVEG-UHFFFAOYSA-N	0	3	343.345	3.210	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC(CNCc2csc(C)n2)CC1	ZINC001205975991	1370927845	/nfs/dbraw/zinc/92/78/45/1370927845.db2.gz	UNHXWMLAHOMWEL-OAHLLOKOSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CN(Cc2cccc(OC(C)C)c2)C[C@H]1C	ZINC001206490053	1371071354	/nfs/dbraw/zinc/07/13/54/1371071354.db2.gz	HEBGURJKDGIGIN-VQIMIIECSA-N	0	3	330.472	3.377	20	30		EGEDHN
CCN(C(=O)c1csc(C#N)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC001117799204	1371088936	/nfs/dbraw/zinc/08/89/36/1371088936.db2.gz	RZQJFKJMPVLWDJ-QGZVFWFLSA-N	0	3	339.464	3.356	20	30		EGEDHN
Cc1cc(N(C)C)ncc1Nc1sc2c(c1C#N)CCN(C)C2	ZINC001206715104	1371143414	/nfs/dbraw/zinc/14/34/14/1371143414.db2.gz	WSOZFSRLFVNEPB-UHFFFAOYSA-N	0	3	327.457	3.121	20	30		EGEDHN
C[C@@H]1CN([C@@H]2CCCc3ccc(F)cc32)C[C@H]1NC(=O)C#CC1CC1	ZINC001206948478	1371241121	/nfs/dbraw/zinc/24/11/21/1371241121.db2.gz	MLOPPXPGOCXMSG-JSNMRZPZSA-N	0	3	340.442	3.053	20	30		EGEDHN
O=C(c1ccco1)N1CCC[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207082010	1371287702	/nfs/dbraw/zinc/28/77/02/1371287702.db2.gz	NSOBOPNGALBZPH-KRWDZBQOSA-N	0	3	342.826	3.179	20	30		EGEDHN
Cn1cc(CN2CCC3(C[C@H](c4ccccc4)CO3)CC2)cc1C#N	ZINC001207104926	1371294584	/nfs/dbraw/zinc/29/45/84/1371294584.db2.gz	KVYHQGBHVNSDMK-IBGZPJMESA-N	0	3	335.451	3.435	20	30		EGEDHN
C=CCN(CCN1CC[C@H](c2ccncc2)C1)C(=O)OC(C)(C)C	ZINC001207205525	1371328525	/nfs/dbraw/zinc/32/85/25/1371328525.db2.gz	KKJKLTCOGSBABL-KRWDZBQOSA-N	0	3	331.460	3.294	20	30		EGEDHN
C=CCN(CCN1CCN(CCCCC)CC1)C(=O)OC(C)(C)C	ZINC001207206243	1371328805	/nfs/dbraw/zinc/32/88/05/1371328805.db2.gz	SVWAKJCJKPLDPT-UHFFFAOYSA-N	0	3	339.524	3.217	20	30		EGEDHN
CCC[C@@H](C)CC(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001207644411	1371462382	/nfs/dbraw/zinc/46/23/82/1371462382.db2.gz	DRIQTIWESPLDFO-UYAOXDASSA-N	0	3	326.484	3.445	20	30		EGEDHN
CC(C)[C@H](C)CC(=O)N1CCC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001207644769	1371462407	/nfs/dbraw/zinc/46/24/07/1371462407.db2.gz	HKHUJPFPMNXACM-CRAIPNDOSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC(C)[C@H](C)CC(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207645155	1371462840	/nfs/dbraw/zinc/46/28/40/1371462840.db2.gz	KLJCYXZEFARDSK-YLJYHZDGSA-N	0	3	344.474	3.440	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H](NCC#Cc2ccccc2Cl)C1)C1CC1	ZINC001207743779	1371491705	/nfs/dbraw/zinc/49/17/05/1371491705.db2.gz	FUKWYUHXGKJSFI-QAPCUYQASA-N	0	3	344.886	3.318	20	30		EGEDHN
C=CCOC[C@@H]1c2c(ncn2C)CCN1CC1(c2ccccc2)CC1	ZINC001207838225	1371515953	/nfs/dbraw/zinc/51/59/53/1371515953.db2.gz	XRSSVHYJXYHYLX-LJQANCHMSA-N	0	3	337.467	3.254	20	30		EGEDHN
CC[C@H](C)CC(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207914708	1371537351	/nfs/dbraw/zinc/53/73/51/1371537351.db2.gz	NMXPYYJFDQVEEI-QFBILLFUSA-N	0	3	330.447	3.194	20	30		EGEDHN
CC[C@@H](C)CC(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207914706	1371537452	/nfs/dbraw/zinc/53/74/52/1371537452.db2.gz	NMXPYYJFDQVEEI-APWZRJJASA-N	0	3	330.447	3.194	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H]2CN(Cc3ccc(C4CC4)cc3)C[C@H]21	ZINC001187706055	1388146963	/nfs/dbraw/zinc/14/69/63/1388146963.db2.gz	AOFSVTJQDCEFET-LEWJYISDSA-N	0	3	336.479	3.400	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@@H](NCc2c(C)nsc2C)C1	ZINC001208240786	1371676263	/nfs/dbraw/zinc/67/62/63/1371676263.db2.gz	QWJRZROHENLQSA-OAHLLOKOSA-N	0	3	335.517	3.443	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC[C@@H](NCc2cc(F)ccc2OC)C1	ZINC001208260677	1371687673	/nfs/dbraw/zinc/68/76/73/1371687673.db2.gz	BKCJFUYFAPLNPI-QGZVFWFLSA-N	0	3	334.435	3.271	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CN(C[C@@H](OC)c2ccccc2)C[C@H]1C	ZINC001208374172	1371741890	/nfs/dbraw/zinc/74/18/90/1371741890.db2.gz	BVLMFNNKSXHFNT-MISYRCLQSA-N	0	3	342.483	3.004	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1CN(Cc2cccc(N(C)C)c2)C[C@H]1C	ZINC001208392906	1371750132	/nfs/dbraw/zinc/75/01/32/1371750132.db2.gz	FNPZIFDOODVTJC-FUHIMQAGSA-N	0	3	343.515	3.291	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1)C1CCC1	ZINC001208400366	1371753801	/nfs/dbraw/zinc/75/38/01/1371753801.db2.gz	KJCHGQROZADCKR-OXQOHEQNSA-N	0	3	342.458	3.194	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN(CCOc2c(C)cccc2C)C[C@H]1C	ZINC001208458384	1371774395	/nfs/dbraw/zinc/77/43/95/1371774395.db2.gz	GPAVZBFXJWFNCG-RTBURBONSA-N	0	3	344.499	3.475	20	30		EGEDHN
C=C(Br)CNC1CC2(C1)CC(NC(=O)C[C@H](C)CC)C2	ZINC001121015274	1371835668	/nfs/dbraw/zinc/83/56/68/1371835668.db2.gz	ZNBQTWNAQHWWLS-NYKNNPSKSA-N	0	3	343.309	3.348	20	30		EGEDHN
CC(C)(C)C#CC(=O)NC1CC2(CC(NC/C(Cl)=C/Cl)C2)C1	ZINC001121091550	1371852263	/nfs/dbraw/zinc/85/22/63/1371852263.db2.gz	KMYNIEBVQPHHER-BENRWUELSA-N	0	3	343.298	3.372	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)[C@H](CC)CC(F)F)C2	ZINC001121233931	1371902812	/nfs/dbraw/zinc/90/28/12/1371902812.db2.gz	UCRPYHPZCUKGER-MPXNVAGNSA-N	0	3	334.838	3.437	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@H]1CCCN(CCCc2cccc(C#N)c2)C1	ZINC001208844171	1371915611	/nfs/dbraw/zinc/91/56/11/1371915611.db2.gz	FOCXFVHFHTXUNT-SFHVURJKSA-N	0	3	343.471	3.480	20	30		EGEDHN
N#Cc1ccc(CCCN2CC[C@H](N3CCCCC3)[C@@H](F)C2)cc1	ZINC001208863489	1371923264	/nfs/dbraw/zinc/92/32/64/1371923264.db2.gz	FHUXLWFHBLWXMS-PMACEKPBSA-N	0	3	329.463	3.389	20	30		EGEDHN
N#Cc1ccc(CCN2CCC(n3c4ccccc4oc3=O)CC2)cc1	ZINC001208926478	1371947395	/nfs/dbraw/zinc/94/73/95/1371947395.db2.gz	UNGNUAQQNSBAHA-UHFFFAOYSA-N	0	3	347.418	3.346	20	30		EGEDHN
N#Cc1ccc(CCN2CC[C@@H](n3cc(Br)cn3)C2)cc1	ZINC001208929852	1371949421	/nfs/dbraw/zinc/94/94/21/1371949421.db2.gz	VLTLTKLDQPWUBZ-MRXNPFEDSA-N	0	3	345.244	3.007	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001208963695	1371963415	/nfs/dbraw/zinc/96/34/15/1371963415.db2.gz	VGAZIZQSBYEHOU-SFHVURJKSA-N	0	3	344.886	3.484	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC[C@H](NCc2ccc(C#N)s2)C1	ZINC001209004897	1371971758	/nfs/dbraw/zinc/97/17/58/1371971758.db2.gz	QRJYHYOLLYLLQE-INIZCTEOSA-N	0	3	343.496	3.284	20	30		EGEDHN
C=CCN(CCN1CCC2(CC1)OCc1ccccc12)C(=O)OCC	ZINC001209021631	1371976945	/nfs/dbraw/zinc/97/69/45/1371976945.db2.gz	AOWCFXIDOQSKSF-UHFFFAOYSA-N	0	3	344.455	3.152	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N1CCC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001209054138	1371984677	/nfs/dbraw/zinc/98/46/77/1371984677.db2.gz	YGVWWGBRVDUSER-HMMSMWIJSA-N	0	3	341.430	3.300	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@H](NCc2cc(C)ccc2F)C1	ZINC001209156260	1372016759	/nfs/dbraw/zinc/01/67/59/1372016759.db2.gz	LGMXJPXISFRUDK-SFHVURJKSA-N	0	3	330.447	3.408	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)NC1CC2(CC(NCc3ccccc3C#N)C2)C1	ZINC001121588438	1372018280	/nfs/dbraw/zinc/01/82/80/1372018280.db2.gz	RQEJKRSPDSIGLP-QAELIBMJSA-N	0	3	343.446	3.069	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NC1CC2(CC(NCc3ncc(C)s3)C2)C1	ZINC001121609372	1372023460	/nfs/dbraw/zinc/02/34/60/1372023460.db2.gz	CNFRMGWBWPJSEE-BSMHSISQSA-N	0	3	347.528	3.427	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC1CC2(CC(NCc3oc(C)nc3C)C2)C1	ZINC001121616365	1372026384	/nfs/dbraw/zinc/02/63/84/1372026384.db2.gz	INNWFMFYORLUCY-UEBDJUODSA-N	0	3	345.487	3.411	20	30		EGEDHN
C=CCCCCN1CCO[C@H]2[C@H](OCc3cccc(C)n3)CC[C@@H]21	ZINC001209199797	1372035390	/nfs/dbraw/zinc/03/53/90/1372035390.db2.gz	BJXKVCUZPUSCDM-XUVXKRRUSA-N	0	3	330.472	3.495	20	30		EGEDHN
CC1(C)OCC(CN2CCC(C#N)(c3ccccc3F)CC2)CO1	ZINC001209201137	1372036267	/nfs/dbraw/zinc/03/62/67/1372036267.db2.gz	LHVBYDOLVKDOJN-UHFFFAOYSA-N	0	3	332.419	3.082	20	30		EGEDHN
Cc1cccc(CC(=O)N2CCC[C@H](NCC#Cc3ccccc3)C2)c1	ZINC001209345754	1372073692	/nfs/dbraw/zinc/07/36/92/1372073692.db2.gz	NOXPIOYXOUYSLB-QFIPXVFZSA-N	0	3	346.474	3.170	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC[C@H](NCc3cncc(C)c3)C2)CC1	ZINC001209493032	1372119930	/nfs/dbraw/zinc/11/99/30/1372119930.db2.gz	IDENXRZUBFAGMM-SFHVURJKSA-N	0	3	327.472	3.217	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC[C@@H](NCC#Cc3ccccc3)C2)CC1	ZINC001209494025	1372120733	/nfs/dbraw/zinc/12/07/33/1372120733.db2.gz	RAXONBLEWBTLHM-HXUWFJFHSA-N	0	3	336.479	3.365	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)NCCc1nc2cc(Cl)ccc2s1	ZINC001121912425	1372120971	/nfs/dbraw/zinc/12/09/71/1372120971.db2.gz	IFKDDEZJMMTPGL-GFCCVEGCSA-N	0	3	337.876	3.292	20	30		EGEDHN
C=CCC1(C(=O)N2CCC[C@@H](NCc3cncc(F)c3)C2)CCC1	ZINC001209505111	1372123033	/nfs/dbraw/zinc/12/30/33/1372123033.db2.gz	YVULXYQTOIUKST-QGZVFWFLSA-N	0	3	331.435	3.048	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1cnn(Cc2ccc(Cl)cc2)c1	ZINC001121966256	1372136629	/nfs/dbraw/zinc/13/66/29/1372136629.db2.gz	CUTUNAVGBPCAHK-INIZCTEOSA-N	0	3	332.835	3.207	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N1CCC(N2c3ccccc3C[C@@H]2C)CC1	ZINC001122127819	1372181629	/nfs/dbraw/zinc/18/16/29/1372181629.db2.gz	FOTXUTOEKVSDNE-LPHOPBHVSA-N	0	3	341.499	3.112	20	30		EGEDHN
O=C([C@@H]1CC12CC2)N1CCC[C@@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001209809570	1372205512	/nfs/dbraw/zinc/20/55/12/1372205512.db2.gz	XDXPGIRQCWMGMC-MSOLQXFVSA-N	0	3	342.870	3.072	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@@H](NCc2cnn(C(C)(C)C)c2)C1	ZINC001209873779	1372219242	/nfs/dbraw/zinc/21/92/42/1372219242.db2.gz	BNDXGQJSXGRBED-QGZVFWFLSA-N	0	3	346.519	3.321	20	30		EGEDHN
CC(C)C[C@H](C)C(=O)N1CCC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001210358885	1372332167	/nfs/dbraw/zinc/33/21/67/1372332167.db2.gz	QISCAOBNXNPUNO-YJBOKZPZSA-N	0	3	345.462	3.460	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)Cc1ccc(Br)cc1C	ZINC001123337181	1372431470	/nfs/dbraw/zinc/43/14/70/1372431470.db2.gz	OHINCEQEENURKG-CQSZACIVSA-N	0	3	346.228	3.393	20	30		EGEDHN
C#CCC1(C(=O)N2CCC[C@H](NCc3cncs3)C2)CCCCC1	ZINC001211344369	1372536367	/nfs/dbraw/zinc/53/63/67/1372536367.db2.gz	BHAFZRQFYZHZKY-INIZCTEOSA-N	0	3	345.512	3.198	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(C[C@H]3CCCCO3)C[C@H]2C)CCCC1	ZINC001211495782	1372568160	/nfs/dbraw/zinc/56/81/60/1372568160.db2.gz	WRZYXOGWAMNDJT-KZNAEPCWSA-N	0	3	334.504	3.129	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2cccc(F)c2)C[C@H]1c1ccccc1	ZINC001211519287	1372572268	/nfs/dbraw/zinc/57/22/68/1372572268.db2.gz	PYQATOKMDKAGQV-VQTJNVASSA-N	0	3	336.410	3.047	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2cc[nH]c2C(C)C)C[C@H]1c1ccccc1	ZINC001211655223	1372596634	/nfs/dbraw/zinc/59/66/34/1372596634.db2.gz	CXRDWMPAFUFUFD-VQTJNVASSA-N	0	3	349.478	3.359	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@]23C[C@H]2CCCC3)C[C@H]1c1ccccc1	ZINC001211671134	1372600400	/nfs/dbraw/zinc/60/04/00/1372600400.db2.gz	ZTPCMBYRNDIQTC-XAPVIXHLSA-N	0	3	336.479	3.174	20	30		EGEDHN
C=CC[C@H](C(=O)N1CC[C@@H](NCc2ncccc2C)C1)c1ccccc1	ZINC001188002905	1388210744	/nfs/dbraw/zinc/21/07/44/1388210744.db2.gz	YZQJCCAMUISTOC-UXHICEINSA-N	0	3	349.478	3.440	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2cc(C)c(C)o2)[C@H](OC)C1	ZINC001212122283	1372661113	/nfs/dbraw/zinc/66/11/13/1372661113.db2.gz	GBBWFPZYDTWONA-SJLPKXTDSA-N	0	3	334.460	3.072	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN([C@H]2CCCc3ccccc32)C[C@H]1OC	ZINC001212344922	1372691234	/nfs/dbraw/zinc/69/12/34/1372691234.db2.gz	SJFKUNKZDGLRCC-HSALFYBXSA-N	0	3	342.483	3.236	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H](NC(=O)c2cscc2Cl)[C@H](OC)C1	ZINC001212440804	1372707254	/nfs/dbraw/zinc/70/72/54/1372707254.db2.gz	LTTAODICBUTMKZ-KCPJHIHWSA-N	0	3	342.892	3.185	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2cc(F)ccc2C)[C@H](OC)C1	ZINC001213235262	1372865144	/nfs/dbraw/zinc/86/51/44/1372865144.db2.gz	JEVWCUUPQPJWLK-RTBURBONSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2ccc(F)c(C)c2)[C@H](OC)C1	ZINC001213350606	1372889700	/nfs/dbraw/zinc/88/97/00/1372889700.db2.gz	WUVKOSLYZBVPSO-RTBURBONSA-N	0	3	348.462	3.310	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)Cc2cccc(C)c2)[C@H](OC)C1	ZINC001213355184	1372890552	/nfs/dbraw/zinc/89/05/52/1372890552.db2.gz	LFJWBVCZGGTNLT-WOJBJXKFSA-N	0	3	346.515	3.323	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)[C@H](CC)CC2CCCC2)[C@H](OC)C1	ZINC001213526378	1372919585	/nfs/dbraw/zinc/91/95/85/1372919585.db2.gz	KQHBKDWQAUMHOX-GUDVDZBRSA-N	0	3	336.520	3.375	20	30		EGEDHN
C[C@H](N[C@@H]1CN(C(=O)C#CC(C)(C)C)C[C@H]1C)c1ccccc1F	ZINC001214586303	1373085530	/nfs/dbraw/zinc/08/55/30/1373085530.db2.gz	WYXYOGUDVJYOAJ-RVKKMQEKSA-N	0	3	330.447	3.373	20	30		EGEDHN
Cc1c(Cl)cccc1C(=O)NCCNCc1ccc(C#N)cc1	ZINC001127874820	1373193749	/nfs/dbraw/zinc/19/37/49/1373193749.db2.gz	BLEDASAESDHBDM-UHFFFAOYSA-N	0	3	327.815	3.040	20	30		EGEDHN
CC1=C(C)C[C@@H](C(=O)NCCNCc2ccc(C#N)c(F)c2)CC1	ZINC001128031600	1373210690	/nfs/dbraw/zinc/21/06/90/1373210690.db2.gz	WRSLQEZEDDBFEZ-INIZCTEOSA-N	0	3	329.419	3.040	20	30		EGEDHN
Cc1csc(C(=O)NCCNCc2ccc(C#N)s2)c1Cl	ZINC001128075218	1373215101	/nfs/dbraw/zinc/21/51/01/1373215101.db2.gz	CJCMZQHETUBORB-UHFFFAOYSA-N	0	3	339.873	3.163	20	30		EGEDHN
CCC[C@H](C)CCCC(=O)NCCNCc1ccc(OC)c(C#N)c1	ZINC001128152016	1373224676	/nfs/dbraw/zinc/22/46/76/1373224676.db2.gz	FGSJRGMGSMZPLY-INIZCTEOSA-N	0	3	345.487	3.379	20	30		EGEDHN
CCC[C@@H](CC)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2)C1	ZINC001216104772	1373263896	/nfs/dbraw/zinc/26/38/96/1373263896.db2.gz	KJKPDRNSCOGBFX-MISYRCLQSA-N	0	3	326.484	3.301	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2(F)CCCCC2)C[C@H]1NCC#Cc1ccccc1	ZINC001216205563	1373279382	/nfs/dbraw/zinc/27/93/82/1373279382.db2.gz	WOUBHFYJZVRXRT-IEBWSBKVSA-N	0	3	342.458	3.147	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)[C@H](C)CCc3ccc(F)cc3)[C@@H]2C1	ZINC001188165958	1388255509	/nfs/dbraw/zinc/25/55/09/1388255509.db2.gz	UBTLOPVREZPGJO-HHXXYDBFSA-N	0	3	330.447	3.113	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)C/C=C/Cc2ccccc2)s1	ZINC001129884766	1373432000	/nfs/dbraw/zinc/43/20/00/1373432000.db2.gz	LJTMODXUZCMSHZ-SNAWJCMRSA-N	0	3	339.464	3.015	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)[C@@](C)(CC)CCC)C1	ZINC001130438621	1373539977	/nfs/dbraw/zinc/53/99/77/1373539977.db2.gz	NARKWCYMCMITBS-BEFAXECRSA-N	0	3	332.492	3.218	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)C[C@H](C)CC(C)C)C1	ZINC001130442186	1373542152	/nfs/dbraw/zinc/54/21/52/1373542152.db2.gz	HVVJNNICUGOQSZ-HZPDHXFCSA-N	0	3	332.492	3.074	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)CCCC2CCCC2)C1	ZINC001130449863	1373543866	/nfs/dbraw/zinc/54/38/66/1373543866.db2.gz	HGQWMGDXFIWKFV-QGZVFWFLSA-N	0	3	344.503	3.362	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)[C@@H](CCCC)C(C)C)C1	ZINC001130450407	1373544474	/nfs/dbraw/zinc/54/44/74/1373544474.db2.gz	NTPHTPGSQPIXKG-WMZOPIPTSA-N	0	3	346.519	3.464	20	30		EGEDHN
Cc1noc2nc(O[C@H](CC#N)c3ccccc3)c3c(c12)CCNC3	ZINC001218316898	1373594514	/nfs/dbraw/zinc/59/45/14/1373594514.db2.gz	HTMMOLMCURKCGE-MRXNPFEDSA-N	0	3	334.379	3.211	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)Nc1ccnn1-c1ccccc1OC	ZINC001218728886	1373648416	/nfs/dbraw/zinc/64/84/16/1373648416.db2.gz	QBWZXXDSPFLYPN-HNNXBMFYSA-N	0	3	342.443	3.283	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)C[C@H](C)CCCCC)[C@H]2C1	ZINC001218737537	1373648897	/nfs/dbraw/zinc/64/88/97/1373648897.db2.gz	NFPXPXQGBDYWOK-CEXWTWQISA-N	0	3	336.520	3.471	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)[C@H]2CCC[C@@H]2c2ccccc2)cc1	ZINC001131157249	1373654511	/nfs/dbraw/zinc/65/45/11/1373654511.db2.gz	SVJRLPHZVOIMBN-RTWAWAEBSA-N	0	3	347.462	3.348	20	30		EGEDHN
N#Cc1ccc(NC(=O)[C@@H](N)CC2CCCC2)c(OC(F)(F)F)c1	ZINC001218840941	1373659816	/nfs/dbraw/zinc/65/98/16/1373659816.db2.gz	UOOVJXFWAFVJRQ-LBPRGKRZSA-N	0	3	341.333	3.303	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2OCCN(C(=O)c3cccc(C)c3C)[C@H]2C1	ZINC001219014628	1373679656	/nfs/dbraw/zinc/67/96/56/1373679656.db2.gz	JVCRFDXYTYUPHE-FFZOFVMBSA-N	0	3	342.483	3.183	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2OCCN(C(=O)c3cccc(C)c3C)[C@H]2C1	ZINC001219014629	1373679736	/nfs/dbraw/zinc/67/97/36/1373679736.db2.gz	JVCRFDXYTYUPHE-LSTHTHJFSA-N	0	3	342.483	3.183	20	30		EGEDHN
C[Si](C)(C)C#Cc1cccc(NC(=O)C[C@@H]2CCNC[C@@H]2F)c1	ZINC001219311154	1373699817	/nfs/dbraw/zinc/69/98/17/1373699817.db2.gz	TXVHWTDASLQWHG-RDJZCZTQSA-N	0	3	332.495	3.192	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H](NC(=O)c2cc3ccccc3s2)[C@@H](O)C1	ZINC001219953146	1373741913	/nfs/dbraw/zinc/74/19/13/1373741913.db2.gz	DNVREHXZMNEAIK-IMJJTQAJSA-N	0	3	344.480	3.031	20	30		EGEDHN
C#CCCCCCC(=O)N1C[C@@H](C)O[C@@]2(CCN(CC=C(C)C)C2)C1	ZINC001131672895	1373755274	/nfs/dbraw/zinc/75/52/74/1373755274.db2.gz	CJIZTWBALWBRNF-TZIWHRDSSA-N	0	3	346.515	3.228	20	30		EGEDHN
C#CCCN1CC[C@]2(C1)CN(C(=O)C(C)(C)CCCCC)C[C@H](C)O2	ZINC001131701401	1373771682	/nfs/dbraw/zinc/77/16/82/1373771682.db2.gz	TZBZBJLKBPSZCY-RXVVDRJESA-N	0	3	348.531	3.308	20	30		EGEDHN
Cc1cc(C)cc(CN2C[C@@H](NC(=O)CSCC#N)CC[C@@H]2C)c1	ZINC001131831294	1373829216	/nfs/dbraw/zinc/82/92/16/1373829216.db2.gz	ZEOLYFPTHMBVTP-WMZOPIPTSA-N	0	3	345.512	3.029	20	30		EGEDHN
N#Cc1ccc(CN2CCC(CNC(=O)CC3CCC3)CC2)cc1	ZINC001222756067	1373867550	/nfs/dbraw/zinc/86/75/50/1373867550.db2.gz	IRVMAJDCZUQWGF-UHFFFAOYSA-N	0	3	325.456	3.077	20	30		EGEDHN
C#CCCCCC(=O)NCC1CCN(Cc2cccc(F)c2)CC1	ZINC001222873466	1373905175	/nfs/dbraw/zinc/90/51/75/1373905175.db2.gz	XQCKSWNGMKSZBP-UHFFFAOYSA-N	0	3	330.447	3.348	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)CC(C)(C)C	ZINC001224826461	1375079106	/nfs/dbraw/zinc/07/91/06/1375079106.db2.gz	MUWQXNHNOWPANY-CHWSQXEVSA-N	0	3	331.298	3.348	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@H](C)N(CCCOc2ccccc2)C1	ZINC001131995367	1375088362	/nfs/dbraw/zinc/08/83/62/1375088362.db2.gz	JRDOROXVOPXXLP-RBUKOAKNSA-N	0	3	342.483	3.228	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H]1CC[C@H](C)N(Cc2ccc3cc[nH]c3c2)C1	ZINC001132021670	1375102707	/nfs/dbraw/zinc/10/27/07/1375102707.db2.gz	OANOTWTUODBPKE-LPHOPBHVSA-N	0	3	337.467	3.296	20	30		EGEDHN
C[C@@H]1CC[C@H](NC(=O)C#CC2CC2)CN1Cc1ccc(C2CC2)cc1	ZINC001132033579	1375108956	/nfs/dbraw/zinc/10/89/56/1375108956.db2.gz	IJSXIJXFAPISJF-IERDGZPVSA-N	0	3	336.479	3.447	20	30		EGEDHN
Cc1cc(CN2C[C@@H](NC(=O)C#CC3CC3)CC[C@@H]2C)c(C)s1	ZINC001132034748	1375109685	/nfs/dbraw/zinc/10/96/85/1375109685.db2.gz	UTWPDWKICKYXNE-UGSOOPFHSA-N	0	3	330.497	3.247	20	30		EGEDHN
CCc1ccccc1CCN1C[C@@H](NC(=O)C#CC2CC2)CC[C@H]1C	ZINC001132047105	1375115832	/nfs/dbraw/zinc/11/58/32/1375115832.db2.gz	UIYBGGSOZIBJOF-UTKZUKDTSA-N	0	3	338.495	3.174	20	30		EGEDHN
Cc1cccnc1C(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1	ZINC001225592177	1375129082	/nfs/dbraw/zinc/12/90/82/1375129082.db2.gz	FTMCIXHFYRCBDJ-WOJBJXKFSA-N	0	3	347.462	3.072	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NCC1CCN(Cc2ccc(F)cc2C)CC1	ZINC001225630739	1375135097	/nfs/dbraw/zinc/13/50/97/1375135097.db2.gz	GCLDQCJAMPQVOA-INIZCTEOSA-N	0	3	348.462	3.053	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCc2ncc(C(C)(C)C)o2)CC[C@H]1C	ZINC001132117047	1375157096	/nfs/dbraw/zinc/15/70/96/1375157096.db2.gz	ZIWDRDWBVSWNNA-HUUCEWRRSA-N	0	3	333.476	3.060	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2cc(C)sc2C)CC[C@H]1C	ZINC001132157926	1375176487	/nfs/dbraw/zinc/17/64/87/1375176487.db2.gz	UXXJFTSMVBXEBD-CJNGLKHVSA-N	0	3	336.501	3.150	20	30		EGEDHN
O=C(C#CC1CC1)N[C@@H]1CCCC[C@H]1NCc1sccc1Cl	ZINC001226111400	1375204782	/nfs/dbraw/zinc/20/47/82/1375204782.db2.gz	HOOJJKXDWIQKOV-HUUCEWRRSA-N	0	3	336.888	3.332	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CC[C@@H](C)N(CCc2scnc2C)C1	ZINC001132228165	1375224228	/nfs/dbraw/zinc/22/42/28/1375224228.db2.gz	NJBZJWJYZIRZAI-UKRRQHHQSA-N	0	3	335.517	3.175	20	30		EGEDHN
CCCCCCC[N@@H+]1C[C@H](NC(=O)c2c(C)nc[n-]c2=O)CC[C@@H]1C	ZINC001132235685	1375230679	/nfs/dbraw/zinc/23/06/79/1375230679.db2.gz	ROKUPACLVQGOMW-GOEBONIOSA-N	0	3	348.491	3.044	20	30		EGEDHN
CCCCCCC[N@H+]1C[C@H](NC(=O)c2c(C)nc[n-]c2=O)CC[C@@H]1C	ZINC001132235685	1375230680	/nfs/dbraw/zinc/23/06/80/1375230680.db2.gz	ROKUPACLVQGOMW-GOEBONIOSA-N	0	3	348.491	3.044	20	30		EGEDHN
CC#CCCCC(=O)N[C@H]1CC[C@H](C)N(CCc2scnc2C)C1	ZINC001132235910	1375231367	/nfs/dbraw/zinc/23/13/67/1375231367.db2.gz	VJSOYDLGPZODKJ-RDJZCZTQSA-N	0	3	347.528	3.157	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2ccccc2CC)CC[C@@H]1C	ZINC001132260050	1375251386	/nfs/dbraw/zinc/25/13/86/1375251386.db2.gz	AGRAXZXNCSNGEH-FUHWJXTLSA-N	0	3	330.472	3.034	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC1CCN(Cc2csc(C)c2)CC1	ZINC001226447220	1375260310	/nfs/dbraw/zinc/26/03/10/1375260310.db2.gz	IUIZLJQKQUEDRD-HNNXBMFYSA-N	0	3	336.501	3.118	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CCCC[C@H]1NCc1c(C)noc1CC	ZINC001226522544	1375274413	/nfs/dbraw/zinc/27/44/13/1375274413.db2.gz	CSUARPZEXKOUER-IAGOWNOFSA-N	0	3	333.476	3.419	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2ccc(C=C)cc2)CC[C@@H]1C	ZINC001132310607	1375287593	/nfs/dbraw/zinc/28/75/93/1375287593.db2.gz	LYNRRZWGQSXDQC-LPHOPBHVSA-N	0	3	328.456	3.115	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2c(C)cccc2C)CC[C@@H]1C	ZINC001132322864	1375301799	/nfs/dbraw/zinc/30/17/99/1375301799.db2.gz	WFZUSAPYYCUXMW-ZWKOTPCHSA-N	0	3	330.472	3.089	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COc2ccsc2Cl)CC[C@H]1C	ZINC001132344053	1375322019	/nfs/dbraw/zinc/32/20/19/1375322019.db2.gz	LTACEAGQIRQDCY-CHWSQXEVSA-N	0	3	342.892	3.326	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)CCc1ccsc1	ZINC001226791103	1375335892	/nfs/dbraw/zinc/33/58/92/1375335892.db2.gz	JPEKIGIPUMPDEI-HUUCEWRRSA-N	0	3	326.893	3.450	20	30		EGEDHN
C#CCCCCC(=O)NC1CCN(Cc2ccc(F)cc2C)CC1	ZINC001226951884	1375368141	/nfs/dbraw/zinc/36/81/41/1375368141.db2.gz	LTVAGBORLVJFAK-UHFFFAOYSA-N	0	3	330.447	3.408	20	30		EGEDHN
C#CCCCCC(=O)NC1CCN(Cc2cc(F)ccc2C)CC1	ZINC001226952300	1375369648	/nfs/dbraw/zinc/36/96/48/1375369648.db2.gz	WYNSPIUHGIJUED-UHFFFAOYSA-N	0	3	330.447	3.408	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2ccc(Cl)cc2)CC[C@@H]1C	ZINC001132441334	1375384702	/nfs/dbraw/zinc/38/47/02/1375384702.db2.gz	NOAFXMRENBICQK-YOEHRIQHSA-N	0	3	336.863	3.125	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COc2ccccc2OCC)CC[C@H]1C	ZINC001132460826	1375403006	/nfs/dbraw/zinc/40/30/06/1375403006.db2.gz	LYBVIFWTAVGHBQ-SJORKVTESA-N	0	3	346.471	3.009	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCc2ccc(OC)cc2)CC[C@@H]1C	ZINC001132464555	1375407655	/nfs/dbraw/zinc/40/76/55/1375407655.db2.gz	VXVQFURDZTYSFT-FUHWJXTLSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCOc2ccccc2F)CC[C@@H]1C	ZINC001132472112	1375412574	/nfs/dbraw/zinc/41/25/74/1375412574.db2.gz	BKTWRJVUJCKRJM-HOTGVXAUSA-N	0	3	334.435	3.140	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCOc2ccccc2OC)CC[C@H]1C	ZINC001132472528	1375412927	/nfs/dbraw/zinc/41/29/27/1375412927.db2.gz	IJQBFBFFIZTUHS-IAGOWNOFSA-N	0	3	346.471	3.009	20	30		EGEDHN
CC(C)C#CC(=O)NC1CCN([C@@H]2CCc3ccc(F)cc32)CC1	ZINC001227265017	1375414683	/nfs/dbraw/zinc/41/46/83/1375414683.db2.gz	BWZRPZPWIFSFJV-LJQANCHMSA-N	0	3	328.431	3.053	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COc2cc(C)ccc2C)CC[C@H]1C	ZINC001132498996	1375425886	/nfs/dbraw/zinc/42/58/86/1375425886.db2.gz	ACSNERDQSZBDNP-QZTJIDSGSA-N	0	3	330.472	3.227	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2ccc(C3CC3)cc2)CC[C@H]1C	ZINC001132505509	1375429757	/nfs/dbraw/zinc/42/97/57/1375429757.db2.gz	SNSSJTSQUXSTGQ-UZLBHIALSA-N	0	3	342.483	3.349	20	30		EGEDHN
COCCN1CCC(Oc2ccc(C#C[Si](C)(C)C)cc2)CC1	ZINC001227433011	1375430741	/nfs/dbraw/zinc/43/07/41/1375430741.db2.gz	WGQHCBYUQJYKQS-UHFFFAOYSA-N	0	3	331.532	3.405	20	30		EGEDHN
C#CCN1CC[C@@H](CN(Cc2scnc2C)C(=O)/C(C)=C/CC)C1	ZINC001132558276	1375465336	/nfs/dbraw/zinc/46/53/36/1375465336.db2.gz	KDZJEPKDAWVNNY-SXKJYUOZSA-N	0	3	345.512	3.092	20	30		EGEDHN
C=CCCC(=O)N(Cc1scnc1C)C[C@@H]1CCN(CC#CC)C1	ZINC001132559281	1375467909	/nfs/dbraw/zinc/46/79/09/1375467909.db2.gz	WAZXSRMHEJEEJK-QGZVFWFLSA-N	0	3	345.512	3.092	20	30		EGEDHN
CC#CCCCC(=O)NCCNCc1cc(C(C)C)ccc1OC	ZINC001132593071	1375479497	/nfs/dbraw/zinc/47/94/97/1375479497.db2.gz	POMLGUSUVNVDEE-UHFFFAOYSA-N	0	3	330.472	3.218	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](C)[C@H](CNCc2nc(C)c(C)s2)C1	ZINC001132696336	1375518373	/nfs/dbraw/zinc/51/83/73/1375518373.db2.gz	JUHPIYVCTQJADG-CZUORRHYSA-N	0	3	335.517	3.300	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2cc(C)cc(Cl)c2)CC1	ZINC001228266650	1375537819	/nfs/dbraw/zinc/53/78/19/1375537819.db2.gz	ZUESNJMRTHJTLY-UHFFFAOYSA-N	0	3	336.863	3.045	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](C)[C@@H](CNCc2ocnc2C)C1	ZINC001132843009	1375594859	/nfs/dbraw/zinc/59/48/59/1375594859.db2.gz	GXKPMHPIZQPGNV-QAPCUYQASA-N	0	3	345.487	3.326	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](C)[C@H](CNCc2ocnc2C)C1	ZINC001132846884	1375598304	/nfs/dbraw/zinc/59/83/04/1375598304.db2.gz	NVRPHJRQBJGPDP-GOEBONIOSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NC1CCN(CCc2ccccc2F)CC1	ZINC001228750415	1375663749	/nfs/dbraw/zinc/66/37/49/1375663749.db2.gz	YEKSBBWBIPLPKN-JKSUJKDBSA-N	0	3	332.463	3.407	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC1CCN(Cc2ccc(OC)cc2)CC1	ZINC001228786125	1375674644	/nfs/dbraw/zinc/67/46/44/1375674644.db2.gz	CLHGIJPHMPUDBB-MRXNPFEDSA-N	0	3	330.472	3.378	20	30		EGEDHN
C=CCCCC(=O)NC1CCN(CCOc2ccc(C)cc2)CC1	ZINC001228913056	1375712759	/nfs/dbraw/zinc/71/27/59/1375712759.db2.gz	YOGYKUWYRRAILV-UHFFFAOYSA-N	0	3	330.472	3.311	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](C)[C@H](CNCc2cc(C)no2)C1	ZINC001133039664	1375729787	/nfs/dbraw/zinc/72/97/87/1375729787.db2.gz	UDBKVWDBJOMYBO-FUHWJXTLSA-N	0	3	345.487	3.141	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC1CCN(CCOc2ccccc2)CC1	ZINC001229017032	1375738750	/nfs/dbraw/zinc/73/87/50/1375738750.db2.gz	PFWVACPPBSFXSC-HXUWFJFHSA-N	0	3	330.472	3.248	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC1CCN(C[C@@H](O)c2ccc(F)cc2)CC1	ZINC001229017482	1375740644	/nfs/dbraw/zinc/74/06/44/1375740644.db2.gz	TXKMDEJZSCMFKX-QUCCMNQESA-N	0	3	348.462	3.042	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](C)[C@H](CNCc2ocnc2C)C1	ZINC001133142326	1375803737	/nfs/dbraw/zinc/80/37/37/1375803737.db2.gz	NPXLUHMYIIRQCY-GDBMZVCRSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](C)[C@H](CNCc2cnc(C)o2)C1	ZINC001133143714	1375804886	/nfs/dbraw/zinc/80/48/86/1375804886.db2.gz	WZEAEICIRPMJRE-GOEBONIOSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC1CCN(CCOc2ccccc2)CC1	ZINC001229370287	1375820861	/nfs/dbraw/zinc/82/08/61/1375820861.db2.gz	VRYPRLJTAAFISD-UHFFFAOYSA-N	0	3	330.472	3.248	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)[C@@H](C)CC2CCCCC2)CC1	ZINC001229446517	1375836665	/nfs/dbraw/zinc/83/66/65/1375836665.db2.gz	YJYOTSPUBUULHJ-KRWDZBQOSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)C[C@@H](C)C2CCCCC2)CC1	ZINC001229593063	1375862962	/nfs/dbraw/zinc/86/29/62/1375862962.db2.gz	QXFGYBGEKUQZMX-QGZVFWFLSA-N	0	3	336.520	3.376	20	30		EGEDHN
C[C@@H](C(=O)NCCNCc1ccc(C#N)s1)c1ccc(Cl)cc1	ZINC001133244827	1375865861	/nfs/dbraw/zinc/86/58/61/1375865861.db2.gz	PPLNAWPHADMTBD-GFCCVEGCSA-N	0	3	347.871	3.283	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2cc3c(s2)CCCC3)CC1	ZINC001230184574	1375959406	/nfs/dbraw/zinc/95/94/06/1375959406.db2.gz	QGBFQAUQMFWNIE-UHFFFAOYSA-N	0	3	348.512	3.024	20	30		EGEDHN
C[C@H](C#N)C(=O)N(CCNC/C=C/Cl)Cc1cccc(Cl)c1	ZINC001133392640	1375976794	/nfs/dbraw/zinc/97/67/94/1375976794.db2.gz	HCLIITHSQGEMGY-VUUYWXRKSA-N	0	3	340.254	3.170	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1cocc1C	ZINC001133401600	1375985657	/nfs/dbraw/zinc/98/56/57/1375985657.db2.gz	IQLAYEOBMLBCDW-UHFFFAOYSA-N	0	3	330.815	3.107	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C(C)(C)C(=C)C	ZINC001133402081	1375987020	/nfs/dbraw/zinc/98/70/20/1375987020.db2.gz	XYLGOCPSAWIVDM-UHFFFAOYSA-N	0	3	332.875	3.494	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NC1CCN(Cc2cc3ccccc3o2)CC1	ZINC001230406680	1376021434	/nfs/dbraw/zinc/02/14/34/1376021434.db2.gz	BKXUNTGDAKWOFI-OAHLLOKOSA-N	0	3	342.439	3.105	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1C1CCN(C(=O)[C@@H](CCC)OC)CC1	ZINC001230584728	1376086787	/nfs/dbraw/zinc/08/67/87/1376086787.db2.gz	TZNANADWBYCLDP-IAGOWNOFSA-N	0	3	342.911	3.257	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCNCc2ccccc2C(F)(F)F)C1	ZINC001133564794	1376092137	/nfs/dbraw/zinc/09/21/37/1376092137.db2.gz	YOEHYHDRZLUZOX-UHFFFAOYSA-N	0	3	326.362	3.268	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)c1cccc(F)c1)NCc1ccccc1C#N	ZINC001133576311	1376101323	/nfs/dbraw/zinc/10/13/23/1376101323.db2.gz	GEGULSCCIOWZIB-CABCVRRESA-N	0	3	339.414	3.384	20	30		EGEDHN
C#CCCN(CCCNC(=O)c1sccc1C)Cc1cccnc1	ZINC001230652968	1376116316	/nfs/dbraw/zinc/11/63/16/1376116316.db2.gz	JAXWSJAOLUWAEA-UHFFFAOYSA-N	0	3	341.480	3.097	20	30		EGEDHN
C[C@H](CC(=O)NCCNCc1cccc(C#N)c1)c1cccc(F)c1	ZINC001133612669	1376121454	/nfs/dbraw/zinc/12/14/54/1376121454.db2.gz	SOVJLYUXIYEYOC-OAHLLOKOSA-N	0	3	339.414	3.097	20	30		EGEDHN
Cc1occc1C(=O)N[C@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001133628403	1376126863	/nfs/dbraw/zinc/12/68/63/1376126863.db2.gz	UCMHSTHYICUIIH-UONOGXRCSA-N	0	3	325.412	3.146	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)CCSCC)Cc1cccnc1	ZINC001230696230	1376128190	/nfs/dbraw/zinc/12/81/90/1376128190.db2.gz	ZUNMWKRHWCVYMF-UHFFFAOYSA-N	0	3	335.517	3.109	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1ccccc1C#N)NC(=O)c1ccsc1	ZINC001133632343	1376128199	/nfs/dbraw/zinc/12/81/99/1376128199.db2.gz	FSDBAEMRIALKHF-UONOGXRCSA-N	0	3	327.453	3.306	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)[C@H](C)OCC(C)C)Cc1cccnc1	ZINC001230701753	1376129806	/nfs/dbraw/zinc/12/98/06/1376129806.db2.gz	RTSZHQJEICZLTM-SFHVURJKSA-N	0	3	347.503	3.027	20	30		EGEDHN
Cc1ccoc1C(=O)N[C@@H](C)C[C@H](C)NCc1cc(F)ccc1C#N	ZINC001133680328	1376150959	/nfs/dbraw/zinc/15/09/59/1376150959.db2.gz	YDZAIXBZCKKNQA-KBPBESRZSA-N	0	3	343.402	3.286	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)/C=C/C(C)(C)C	ZINC001133951001	1376280697	/nfs/dbraw/zinc/28/06/97/1376280697.db2.gz	UWNQTMIWBREUIW-NAISLTENSA-N	0	3	331.298	3.370	20	30		EGEDHN
C=CCOc1cccc(CN2CC[C@@H](Oc3cccc(OC)n3)C2)c1	ZINC001231624839	1376285182	/nfs/dbraw/zinc/28/51/82/1376285182.db2.gz	YGTUJEJPDZMYQV-GOSISDBHSA-N	0	3	340.423	3.308	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CCN(Cc3ccc(CC)cn3)C2)C1	ZINC001231637276	1376288897	/nfs/dbraw/zinc/28/88/97/1376288897.db2.gz	FEQIOYHXHRNUQO-FQEVSTJZSA-N	0	3	343.471	3.255	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H]2CN(CCOCc3ccccc3)C[C@H]21	ZINC001189007486	1388435138	/nfs/dbraw/zinc/43/51/38/1388435138.db2.gz	VYZIBHOMCXDMNW-VQTJNVASSA-N	0	3	342.483	3.092	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)c1cc(C)c(C)o1	ZINC001134110421	1376372730	/nfs/dbraw/zinc/37/27/30/1376372730.db2.gz	VZELJYOBPHQHGI-RYUDHWBXSA-N	0	3	343.265	3.292	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H](C)C[C@H](C)NCc2cc(F)ccc2C#N)co1	ZINC001134176460	1376399966	/nfs/dbraw/zinc/39/99/66/1376399966.db2.gz	BDGPHJBWYRRXNI-STQMWFEESA-N	0	3	343.402	3.286	20	30		EGEDHN
C#CCCCC(=O)N[C@@H](C)C[C@@H](C)NCc1nc2ccc(F)cc2o1	ZINC001134206458	1376418275	/nfs/dbraw/zinc/41/82/75/1376418275.db2.gz	VEMGMUSXXMQIDJ-KGLIPLIRSA-N	0	3	345.418	3.143	20	30		EGEDHN
Cc1cc[nH]c1C(=O)N[C@H](C)C[C@H](C)NCc1cc(F)ccc1C#N	ZINC001134273696	1376449739	/nfs/dbraw/zinc/44/97/39/1376449739.db2.gz	ITSZPNSODTXKMT-UONOGXRCSA-N	0	3	342.418	3.021	20	30		EGEDHN
CC(C(=O)N[C@@H](C)C[C@@H](C)NCc1ccccc1C#N)=C1CCC1	ZINC001134307427	1376466384	/nfs/dbraw/zinc/46/63/84/1376466384.db2.gz	MCIFXCNUWKRTKM-CABCVRRESA-N	0	3	325.456	3.432	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@@H]1CCN(Cc1cccc(CF)n1)C2	ZINC001232534575	1376477590	/nfs/dbraw/zinc/47/75/90/1376477590.db2.gz	RWXJKFWJZJHGNG-RTBURBONSA-N	0	3	334.435	3.125	20	30		EGEDHN
Cc1nc(CN[C@@H](C)C[C@@H](C)NC(=O)C#CC(C)(C)C)sc1C	ZINC001134329771	1376480451	/nfs/dbraw/zinc/48/04/51/1376480451.db2.gz	SBPNGWSQCFKQSQ-QWHCGFSZSA-N	0	3	335.517	3.182	20	30		EGEDHN
N#Cc1ccccc1OC1CCN(Cc2ccc(CCO)cc2)CC1	ZINC001232779419	1376511934	/nfs/dbraw/zinc/51/19/34/1376511934.db2.gz	NNCZOFIXNQTCNP-UHFFFAOYSA-N	0	3	336.435	3.136	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@H](C)C[C@@H](C)NCc1oc(C)nc1C	ZINC001134447560	1376542122	/nfs/dbraw/zinc/54/21/22/1376542122.db2.gz	JCXRZFVPNNBDGZ-GHMZBOCLSA-N	0	3	341.883	3.443	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H](C)C[C@H](C)NCC(=C)Br	ZINC001134447072	1376542702	/nfs/dbraw/zinc/54/27/02/1376542702.db2.gz	FYNBGSAVMRWHPP-STQMWFEESA-N	0	3	331.298	3.370	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H](C)C[C@H](C)NCc1ocnc1C	ZINC001134449377	1376544100	/nfs/dbraw/zinc/54/41/00/1376544100.db2.gz	UCNZHZPJLJCBLO-QWRGUYRKSA-N	0	3	327.856	3.135	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1ccccc1C#N)NC(=O)C1C=CC=CC=C1	ZINC001134476445	1376559441	/nfs/dbraw/zinc/55/94/41/1376559441.db2.gz	RUQMYNBWSFCINI-DLBZAZTESA-N	0	3	335.451	3.230	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CC[C@]2(C[C@H](Oc3cccnc3)CO2)C1	ZINC001233079347	1376564742	/nfs/dbraw/zinc/56/47/42/1376564742.db2.gz	BWUQTMYBTVZBKZ-SFTDATJTSA-N	0	3	349.434	3.074	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CC[C@]2(CCN2C(=O)OC(C)(C)C)C1	ZINC001233080133	1376567092	/nfs/dbraw/zinc/56/70/92/1376567092.db2.gz	SUAJBNCKNLAZDX-FQEVSTJZSA-N	0	3	341.455	3.452	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)C[C@H](C)NCc2cc(C3CC3)no2)CCC1	ZINC001134566502	1376599098	/nfs/dbraw/zinc/59/90/98/1376599098.db2.gz	FWIMTGBDSNMSOW-LSDHHAIUSA-N	0	3	343.471	3.119	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2nc(C)sc2C)CCC1	ZINC001134592391	1376614268	/nfs/dbraw/zinc/61/42/68/1376614268.db2.gz	CSWXPHWNATZJKT-ZIAGYGMSSA-N	0	3	347.528	3.326	20	30		EGEDHN
CC[C@@H](CC1CCCC1)C(=O)NCCNCc1cccc(C#N)c1	ZINC001134683467	1376655715	/nfs/dbraw/zinc/65/57/15/1376655715.db2.gz	POZOWJUPJSDPJF-IBGZPJMESA-N	0	3	327.472	3.371	20	30		EGEDHN
CC[C@@H](CC1CCCC1)C(=O)NCCNCc1ccc(C#N)s1	ZINC001134689009	1376659831	/nfs/dbraw/zinc/65/98/31/1376659831.db2.gz	ZXYVSTAGFLPFEM-HNNXBMFYSA-N	0	3	333.501	3.432	20	30		EGEDHN
Cc1ccccc1[C@@H](C)CC(=O)NCCNCc1ccc(C#N)cc1	ZINC001134727341	1376680400	/nfs/dbraw/zinc/68/04/00/1376680400.db2.gz	GGACMJUVBOVECG-KRWDZBQOSA-N	0	3	335.451	3.266	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1ccccc1C#N)NC(=O)C1(F)CCCC1	ZINC001134790757	1376724578	/nfs/dbraw/zinc/72/45/78/1376724578.db2.gz	HTAOEGIYUVNALD-LSDHHAIUSA-N	0	3	331.435	3.213	20	30		EGEDHN
C#CCCCC(=O)N(C)C[C@H]1CCN1CCCCOc1ccccc1	ZINC001233946969	1376740725	/nfs/dbraw/zinc/74/07/25/1376740725.db2.gz	GPMIZAZDRZRZTM-LJQANCHMSA-N	0	3	342.483	3.182	20	30		EGEDHN
Cc1ccc(CC(=O)N[C@@H](C)C[C@@H](C)NCc2ccccc2C#N)cc1	ZINC001134903042	1376778230	/nfs/dbraw/zinc/77/82/30/1376778230.db2.gz	WYIADHYLQUOFGD-MSOLQXFVSA-N	0	3	349.478	3.482	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)CCOc1ccc(C)cc1C	ZINC001235035455	1376833420	/nfs/dbraw/zinc/83/34/20/1376833420.db2.gz	BFMBINWKVUAGJX-SFHVURJKSA-N	0	3	330.472	3.181	20	30		EGEDHN
C=CCCCN1CC[C@@H]1CN(C)C(=O)c1ccc(-c2ccncc2)o1	ZINC001235304223	1376867189	/nfs/dbraw/zinc/86/71/89/1376867189.db2.gz	PKINWRDKBYMEMF-QGZVFWFLSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=CCCCCCN1CC[C@H]1CN(C)C(=O)c1cc2cccn2cn1	ZINC001235725737	1376887168	/nfs/dbraw/zinc/88/71/68/1376887168.db2.gz	UGAUBEFHACFSJN-SFHVURJKSA-N	0	3	340.471	3.227	20	30		EGEDHN
C=CC1(CC(=O)NCCNCc2ccccc2N(C)C)CCCCC1	ZINC001135186794	1376959668	/nfs/dbraw/zinc/95/96/68/1376959668.db2.gz	KPNJIALRDZXPQV-UHFFFAOYSA-N	0	3	343.515	3.485	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1ccc(F)c(O)c1)[C@H]2CC	ZINC001236700786	1376962126	/nfs/dbraw/zinc/96/21/26/1376962126.db2.gz	YSFKNDMILJJSJZ-ICSRJNTNSA-N	0	3	346.446	3.453	20	30		EGEDHN
CC#CCCCC(=O)N[C@H](C)C[C@H](C)NCc1nc(C)c(C)s1	ZINC001135224290	1376984452	/nfs/dbraw/zinc/98/44/52/1376984452.db2.gz	APXFUIIZBTUKOS-UONOGXRCSA-N	0	3	335.517	3.326	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C[C@H](C)NCc2ccn(CC)n2)CCC1	ZINC001135395204	1377071678	/nfs/dbraw/zinc/07/16/78/1377071678.db2.gz	ORIWUHANAYLYOJ-JKSUJKDBSA-N	0	3	332.492	3.022	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)c1occc1Cl)NCc1ccccc1C#N	ZINC001135399349	1377074056	/nfs/dbraw/zinc/07/40/56/1377074056.db2.gz	QXTZGLWXTKSDMV-CHWSQXEVSA-N	0	3	345.830	3.491	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H](C)C[C@@H](C)NCc2nccn2C(F)F)C1	ZINC001135420709	1377086254	/nfs/dbraw/zinc/08/62/54/1377086254.db2.gz	YPDAFJLKHKVTQF-CHWSQXEVSA-N	0	3	340.418	3.007	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1ccccc1C#N)NC(=O)C(C)(C)C(F)F	ZINC001135422175	1377087080	/nfs/dbraw/zinc/08/70/80/1377087080.db2.gz	FWSGRYKPUZSXMJ-QWHCGFSZSA-N	0	3	337.414	3.222	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)C(C)(C)C(F)F	ZINC001135427304	1377091092	/nfs/dbraw/zinc/09/10/92/1377091092.db2.gz	PFEMHVPADCOYRX-VHSXEESVSA-N	0	3	341.240	3.059	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)C1(CF)CCC1)NCc1ccccc1C#N	ZINC001135502101	1377121326	/nfs/dbraw/zinc/12/13/26/1377121326.db2.gz	WUCXDUADDFOQDK-GJZGRUSLSA-N	0	3	331.435	3.071	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cccn2C2CCCC2)s1	ZINC001135945500	1377273711	/nfs/dbraw/zinc/27/37/11/1377273711.db2.gz	CMCQEDMAOGMDFJ-UHFFFAOYSA-N	0	3	342.468	3.056	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)[C@@H](CC)CC(C)C)C1	ZINC001266630163	1377351823	/nfs/dbraw/zinc/35/18/23/1377351823.db2.gz	GHNYJAJICWYPAU-IHRRRGAJSA-N	0	3	331.298	3.204	20	30		EGEDHN
Cc1cccnc1O[C@H]1CCCN(Cc2ccc(OCC#N)cc2)C1	ZINC001137122459	1377482210	/nfs/dbraw/zinc/48/22/10/1377482210.db2.gz	BNPFGBSQPISHFU-IBGZPJMESA-N	0	3	337.423	3.336	20	30		EGEDHN
C=CCOC(=O)N[C@H]1CCCN(Cc2cccc3cccnc32)C1	ZINC001137180162	1377492422	/nfs/dbraw/zinc/49/24/22/1377492422.db2.gz	ZNUPDDLPSRPLRQ-KRWDZBQOSA-N	0	3	325.412	3.111	20	30		EGEDHN
C=CCN1C(=O)CC[C@@]12CCCN(Cc1n[nH]c3ccccc31)CC2	ZINC001137347350	1377527340	/nfs/dbraw/zinc/52/73/40/1377527340.db2.gz	ILNUMXNJOUVLJK-HXUWFJFHSA-N	0	3	338.455	3.096	20	30		EGEDHN
C=CCN1C(=O)CCC[C@@]12CCCN(Cc1[nH]nc3ccccc31)C2	ZINC001137346021	1377527743	/nfs/dbraw/zinc/52/77/43/1377527743.db2.gz	HYGHMZBUBJCRQK-FQEVSTJZSA-N	0	3	338.455	3.096	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@H]1CCN(Cc1n[nH]c3ccccc31)C2	ZINC001137346393	1377527811	/nfs/dbraw/zinc/52/78/11/1377527811.db2.gz	VTWIPKWOGKXJMX-PMACEKPBSA-N	0	3	341.455	3.137	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC(CCN(C)Cc2cccc(F)c2F)CC1	ZINC001271766622	1377651511	/nfs/dbraw/zinc/65/15/11/1377651511.db2.gz	SJTFNDVDKPHLMW-CQSZACIVSA-N	0	3	349.425	3.185	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3ccc(OC)c(Cl)c3)C2)C1=O	ZINC001138473502	1377727737	/nfs/dbraw/zinc/72/77/37/1377727737.db2.gz	RKVVSZOZNOQWLA-LJQANCHMSA-N	0	3	348.874	3.349	20	30		EGEDHN
C#CCOc1ccc(CN2CCCN(c3cccc(C)n3)CC2)cc1	ZINC001138557356	1377741786	/nfs/dbraw/zinc/74/17/86/1377741786.db2.gz	IGOQXTMVHQLKKR-UHFFFAOYSA-N	0	3	335.451	3.114	20	30		EGEDHN
C#CCOc1ccc(CN2CCC[C@@H](Oc3ncccc3C)C2)cc1	ZINC001138560596	1377742219	/nfs/dbraw/zinc/74/22/19/1377742219.db2.gz	BPTLCQVEVYTTFU-HXUWFJFHSA-N	0	3	336.435	3.445	20	30		EGEDHN
COc1cc(CN2CCC3SC(=O)C=C3C2)ccc1OC(C)C	ZINC001138572444	1377745138	/nfs/dbraw/zinc/74/51/38/1377745138.db2.gz	SGEXXYAHXNGIOK-QGZVFWFLSA-N	0	3	333.453	3.257	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CCN(c3ccc(OC)cc3)CC2)c1[O-]	ZINC001138623408	1377754924	/nfs/dbraw/zinc/75/49/24/1377754924.db2.gz	FGORGIAUEDLJEH-UHFFFAOYSA-N	0	3	338.451	3.452	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2C[C@H]3CN(Cc4ccccn4)C[C@H]3C2)c1[O-]	ZINC001138626846	1377755886	/nfs/dbraw/zinc/75/58/86/1377755886.db2.gz	QGTDAJOIQNGNPU-BGYRXZFFSA-N	0	3	349.478	3.080	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2C[C@H]3CN(Cc4ccccn4)C[C@H]3C2)c1[O-]	ZINC001138626846	1377755892	/nfs/dbraw/zinc/75/58/92/1377755892.db2.gz	QGTDAJOIQNGNPU-BGYRXZFFSA-N	0	3	349.478	3.080	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)OC(C)(C)C)c1[O-]	ZINC001138625960	1377756163	/nfs/dbraw/zinc/75/61/63/1377756163.db2.gz	YJWAFMMNJLEWMX-FVQHAEBGSA-N	0	3	344.455	3.076	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)OC(C)(C)C)c1[O-]	ZINC001138625960	1377756164	/nfs/dbraw/zinc/75/61/64/1377756164.db2.gz	YJWAFMMNJLEWMX-FVQHAEBGSA-N	0	3	344.455	3.076	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@]3(C2)c2ccccc2N(C)C3=O)c1[O-]	ZINC001138629273	1377756870	/nfs/dbraw/zinc/75/68/70/1377756870.db2.gz	SSQMHVJWXBHUPX-QFIPXVFZSA-N	0	3	348.446	3.241	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@]3(C2)c2ccccc2N(C)C3=O)c1[O-]	ZINC001138629273	1377756871	/nfs/dbraw/zinc/75/68/71/1377756871.db2.gz	SSQMHVJWXBHUPX-QFIPXVFZSA-N	0	3	348.446	3.241	20	30		EGEDHN
C=CCc1cccc(CN(CCC(=O)OC)Cc2ccco2)c1O	ZINC001138628905	1377756968	/nfs/dbraw/zinc/75/69/68/1377756968.db2.gz	JJUYIFZJRVTTGN-UHFFFAOYSA-N	0	3	329.396	3.279	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CCC(Oc3ncc(C)cn3)CC2)c1[O-]	ZINC001138631021	1377758415	/nfs/dbraw/zinc/75/84/15/1377758415.db2.gz	IIXBTRWBEKMYJA-UHFFFAOYSA-N	0	3	339.439	3.263	20	30		EGEDHN
C=C(C)COc1ccccc1CN1CCC[C@@]2(CCCC(=O)N2)C1	ZINC001138660953	1377764486	/nfs/dbraw/zinc/76/44/86/1377764486.db2.gz	JBPYHRNRYVKSLC-FQEVSTJZSA-N	0	3	328.456	3.276	20	30		EGEDHN
COc1cc(Cl)cc(CN2CCC3SC(=O)C=C3C2)c1OC	ZINC001138743055	1377778547	/nfs/dbraw/zinc/77/85/47/1377778547.db2.gz	LQYZYIKPCHONAW-AWEZNQCLSA-N	0	3	339.844	3.131	20	30		EGEDHN
CCOc1ccc(CN2CCC3SC(=O)C=C3C2)c(OCC)c1	ZINC001138981765	1377812437	/nfs/dbraw/zinc/81/24/37/1377812437.db2.gz	WFIXPAKOZVMQKW-QGZVFWFLSA-N	0	3	333.453	3.258	20	30		EGEDHN
N#Cc1cccc(O[C@H]2CCCN(Cc3ccc4nonc4c3)C2)c1	ZINC001139222878	1377855611	/nfs/dbraw/zinc/85/56/11/1377855611.db2.gz	YHCWMIJTACCGQJ-KRWDZBQOSA-N	0	3	334.379	3.138	20	30		EGEDHN
CC(=O)N1CCC[C@H](N(C)Cc2ccc(-c3cc(C#N)ccn3)cc2)C1	ZINC001139406234	1377880152	/nfs/dbraw/zinc/88/01/52/1377880152.db2.gz	NOCRPSLZDLFOTM-FQEVSTJZSA-N	0	3	348.450	3.063	20	30		EGEDHN
Cc1ccc(CN2CC[C@]3(C[C@@H](Oc4cccnc4)CO3)C2)cc1C#N	ZINC001139725363	1377942065	/nfs/dbraw/zinc/94/20/65/1377942065.db2.gz	MLQRWQNQTJJDLE-RTWAWAEBSA-N	0	3	349.434	3.074	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1ccc(C)cn1)[C@@H]2CC	ZINC001139837381	1377959521	/nfs/dbraw/zinc/95/95/21/1377959521.db2.gz	VFWLJJUAMMATEB-QUCCMNQESA-N	0	3	327.472	3.312	20	30		EGEDHN
N#Cc1ccc2[nH]cc(CN3CCCN(Cc4ccncc4)CC3)c2c1	ZINC001140111549	1378010909	/nfs/dbraw/zinc/01/09/09/1378010909.db2.gz	MBXKYCXIGSLQOL-UHFFFAOYSA-N	0	3	345.450	3.142	20	30		EGEDHN
Cc1cccnc1O[C@H]1CCN(Cc2c[nH]c3ccc(C#N)cc23)C1	ZINC001140116962	1378012049	/nfs/dbraw/zinc/01/20/49/1378012049.db2.gz	JDSYHFOBVWJYFX-KRWDZBQOSA-N	0	3	332.407	3.396	20	30		EGEDHN
O=C1C=C2CN(Cc3ccc(Br)c(F)c3)CCC2S1	ZINC001140210436	1378032117	/nfs/dbraw/zinc/03/21/17/1378032117.db2.gz	CQBQDSKIGXJHKQ-CYBMUJFWSA-N	0	3	342.233	3.362	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@]3(CCN(CC(F)F)C3=O)CC2)c1	ZINC001272651854	1378077119	/nfs/dbraw/zinc/07/71/19/1378077119.db2.gz	YFKWDRYGFRWJBW-LJQANCHMSA-N	0	3	347.409	3.028	20	30		EGEDHN
C#CCN1CC2(CCC1=O)CCN(Cc1cc(C)ccc1Cl)CC2	ZINC001274492092	1378128235	/nfs/dbraw/zinc/12/82/35/1378128235.db2.gz	GZHSHBYGOXUIJS-UHFFFAOYSA-N	0	3	344.886	3.486	20	30		EGEDHN
CCCCN1CC[C@]2(CCN(Cc3ccc(C#N)c(Cl)c3)C2)C1=O	ZINC001274492226	1378128465	/nfs/dbraw/zinc/12/84/65/1378128465.db2.gz	IMOJZIUZTGYDMR-IBGZPJMESA-N	0	3	345.874	3.436	20	30		EGEDHN
N#Cc1c(F)cc(CN2CC[C@@H](N3CCCCC3)[C@@H](F)C2)cc1F	ZINC001140755421	1378130695	/nfs/dbraw/zinc/13/06/95/1378130695.db2.gz	FCRJQRKJWAGWOG-ZWKOTPCHSA-N	0	3	337.389	3.235	20	30		EGEDHN
COc1ccc(CN2CCC[C@@H](Oc3ccccc3C#N)C2)cc1N	ZINC001140898264	1378174650	/nfs/dbraw/zinc/17/46/50/1378174650.db2.gz	DZBMXZYEKKKMCA-QGZVFWFLSA-N	0	3	337.423	3.192	20	30		EGEDHN
CCCCN1CC2(C1)SCC[C@H]2C(=O)Nc1cc(C)ccc1C#N	ZINC001278218341	1378264265	/nfs/dbraw/zinc/26/42/65/1378264265.db2.gz	YONDKKOCROGIDC-INIZCTEOSA-N	0	3	343.496	3.413	20	30		EGEDHN
C[C@H](CNC(=O)C1(F)CCCCC1)N(C)Cc1ccc(C#N)cc1	ZINC001282478830	1378510877	/nfs/dbraw/zinc/51/08/77/1378510877.db2.gz	RAYVYJGGLHHFFE-OAHLLOKOSA-N	0	3	331.435	3.167	20	30		EGEDHN
C=CCOC(=O)N[C@@H]1CCCN(Cc2c(C)cc(OC)cc2C)C1	ZINC001142949656	1378515434	/nfs/dbraw/zinc/51/54/34/1378515434.db2.gz	MHDBYZUOZZGZGP-MRXNPFEDSA-N	0	3	332.444	3.189	20	30		EGEDHN
C=CCO[C@@H]1CO[C@]2(C1)CCCN(Cc1cc(C)cc(OC)c1)C2	ZINC001143157647	1378549282	/nfs/dbraw/zinc/54/92/82/1378549282.db2.gz	PHIRPNBNZXUFLD-PMACEKPBSA-N	0	3	331.456	3.330	20	30		EGEDHN
CN(Cc1ccccc1F)C1CCN(Cc2cncc(C#N)c2)CC1	ZINC001144085140	1378680357	/nfs/dbraw/zinc/68/03/57/1378680357.db2.gz	UGFAWGBHRDTJPA-UHFFFAOYSA-N	0	3	338.430	3.189	20	30		EGEDHN
O=C1C=C2CN(Cc3ccc(O)cc3C(F)(F)F)CCC2S1	ZINC001144387699	1378724289	/nfs/dbraw/zinc/72/42/89/1378724289.db2.gz	ZCZJAPMXHQJOIU-ZDUSSCGKSA-N	0	3	329.343	3.185	20	30		EGEDHN
C#Cc1ccc(CN2CCC3(CN(C(=O)OC(C)(C)C)C3)C2)cc1	ZINC001144568338	1378745747	/nfs/dbraw/zinc/74/57/47/1378745747.db2.gz	RISZFYDEYVVGTO-UHFFFAOYSA-N	0	3	326.440	3.111	20	30		EGEDHN
C#Cc1ccc(CN2CCC(c3noc(C(F)(F)F)n3)CC2)cc1	ZINC001144573986	1378747276	/nfs/dbraw/zinc/74/72/76/1378747276.db2.gz	XCPRHFLKHCZLLL-UHFFFAOYSA-N	0	3	335.329	3.449	20	30		EGEDHN
Cc1ccccc1CC(=O)N[C@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001146205671	1378795288	/nfs/dbraw/zinc/79/52/88/1378795288.db2.gz	OLBXMXCLOHQNJK-QZTJIDSGSA-N	0	3	349.478	3.482	20	30		EGEDHN
Cc1c[nH]cc1C(=O)N[C@@H](C)C[C@H](C)NCc1cc(F)ccc1C#N	ZINC001146374867	1378830173	/nfs/dbraw/zinc/83/01/73/1378830173.db2.gz	RTHFFTLRZLPOJH-KBPBESRZSA-N	0	3	342.418	3.021	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C[C@H](C)NCc2ccn(C)n2)CCCCC1	ZINC001146502250	1378853165	/nfs/dbraw/zinc/85/31/65/1378853165.db2.gz	BUSKVEQLJYVWHT-DLBZAZTESA-N	0	3	346.519	3.320	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2cc(OC)no2)CCCC1	ZINC001146823098	1378929077	/nfs/dbraw/zinc/92/90/77/1378929077.db2.gz	XZJIMCZWRWMRKQ-CABCVRRESA-N	0	3	349.475	3.193	20	30		EGEDHN
CC[C@@H](CC(=O)NCCNCc1ccc(OC)c(C#N)c1)C(C)(C)C	ZINC001147466772	1379026001	/nfs/dbraw/zinc/02/60/01/1379026001.db2.gz	VYIVBTZLGMGOAI-KRWDZBQOSA-N	0	3	345.487	3.235	20	30		EGEDHN
CCCCCC[C@@H](F)C(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001147791593	1379080234	/nfs/dbraw/zinc/08/02/34/1379080234.db2.gz	OXRFAUFOFKPQNM-QGZVFWFLSA-N	0	3	337.414	3.212	20	30		EGEDHN
CCCCCC[C@H](F)C(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001147791592	1379080264	/nfs/dbraw/zinc/08/02/64/1379080264.db2.gz	OXRFAUFOFKPQNM-KRWDZBQOSA-N	0	3	337.414	3.212	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc3c(c2)CCC=C3)s1	ZINC001148057016	1379110265	/nfs/dbraw/zinc/11/02/65/1379110265.db2.gz	CYBYFBJPQFGNIZ-UHFFFAOYSA-N	0	3	337.448	3.099	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)N1CC2(C1)CCN(Cc1ccc(OC)cc1)C2	ZINC001148087506	1379114575	/nfs/dbraw/zinc/11/45/75/1379114575.db2.gz	DJJQYNXYEGDVTI-IAGOWNOFSA-N	0	3	342.483	3.188	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)N1CC2(C1)CCN(Cc1cccc(OC)c1)C2	ZINC001148088638	1379115106	/nfs/dbraw/zinc/11/51/06/1379115106.db2.gz	OQXYJDNULMEDAD-IAGOWNOFSA-N	0	3	342.483	3.188	20	30		EGEDHN
Cc1ccc(C(C)(C)C(=O)NCCNCc2ccc(C#N)s2)cc1	ZINC001148329306	1379154120	/nfs/dbraw/zinc/15/41/20/1379154120.db2.gz	GCSLHCVLLMKCGA-UHFFFAOYSA-N	0	3	341.480	3.112	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC2(C1)CCN(CCOc1ccccc1)C2	ZINC001148372118	1379158067	/nfs/dbraw/zinc/15/80/67/1379158067.db2.gz	SPSJYLFDXWZHCT-UHFFFAOYSA-N	0	3	342.483	3.202	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2cccc(C(F)(F)F)c2)c1	ZINC001148795818	1379269612	/nfs/dbraw/zinc/26/96/12/1379269612.db2.gz	FPVXXOGMCWWHHA-UHFFFAOYSA-N	0	3	347.340	3.097	20	30		EGEDHN
CCCCCCCCCC(=O)NCCN[C@H](C)C(=O)N[C@H](C)CC	ZINC001148825866	1379277822	/nfs/dbraw/zinc/27/78/22/1379277822.db2.gz	NEGPNDWAZRJAFI-IAGOWNOFSA-N	0	3	341.540	3.136	20	30		EGEDHN
CC(C)(CC(=O)NCCNCc1ccc(C#N)s1)CC(F)(F)F	ZINC001149167079	1379337584	/nfs/dbraw/zinc/33/75/84/1379337584.db2.gz	VCWSFVAVKGYDAP-UHFFFAOYSA-N	0	3	347.406	3.194	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H]1CN(Cc2ccc(C)cc2C)CCCO1	ZINC001150085575	1379491993	/nfs/dbraw/zinc/49/19/93/1379491993.db2.gz	QNOAIZRMWOBKMW-LJQANCHMSA-N	0	3	344.499	3.223	20	30		EGEDHN
C#CCCN1CCCO[C@@H](CNC(=O)[C@@H](CC)CCCCCC)C1	ZINC001150100414	1379495088	/nfs/dbraw/zinc/49/50/88/1379495088.db2.gz	POMZUVKOXZIQRX-OALUTQOASA-N	0	3	336.520	3.213	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)[C@H](CC)CC2CCCC2)C1	ZINC001150402093	1379546464	/nfs/dbraw/zinc/54/64/64/1379546464.db2.gz	ABFICEUQTDOJKJ-MOPGFXCFSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2cc(C)oc2C)CC1	ZINC001150942885	1379637160	/nfs/dbraw/zinc/63/71/60/1379637160.db2.gz	BPADDTYLRBPKIQ-UHFFFAOYSA-N	0	3	334.460	3.073	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)CC(C)(C)CC(F)F)CC1	ZINC001151237274	1379684352	/nfs/dbraw/zinc/68/43/52/1379684352.db2.gz	RKOZSZSWPCOTKX-UHFFFAOYSA-N	0	3	346.462	3.231	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2ccn(C(C)C)c2C)CC1	ZINC001151266839	1379691217	/nfs/dbraw/zinc/69/12/17/1379691217.db2.gz	ZCTNDZCTRGDXJR-UHFFFAOYSA-N	0	3	347.503	3.164	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)C2[C@@H]3CCCCCC[C@@H]23)CC1	ZINC001151339831	1379701266	/nfs/dbraw/zinc/70/12/66/1379701266.db2.gz	MHLYJZDIIGJZMP-QZTJIDSGSA-N	0	3	348.531	3.376	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)c1ccccc1F	ZINC001151606262	1379745591	/nfs/dbraw/zinc/74/55/91/1379745591.db2.gz	XMBJFQIXIDBIMH-OAHLLOKOSA-N	0	3	339.414	3.338	20	30		EGEDHN
C=CC[C@H](C(=O)NCCNCc1ccc(C#N)cc1)c1ccccc1	ZINC001151837696	1379793160	/nfs/dbraw/zinc/79/31/60/1379793160.db2.gz	ADQPCEZZEDGBKJ-FQEVSTJZSA-N	0	3	333.435	3.124	20	30		EGEDHN
C=CC[C@@H](C(=O)NCCNCc1ccc(C)nc1C)c1ccccc1	ZINC001151837993	1379793904	/nfs/dbraw/zinc/79/39/04/1379793904.db2.gz	FFRHBRSWSBDXAP-HXUWFJFHSA-N	0	3	337.467	3.264	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)C(=O)NCCNCc1ccsc1	ZINC001151906185	1379813769	/nfs/dbraw/zinc/81/37/69/1379813769.db2.gz	AKWMXZJYOCGEPF-GOSISDBHSA-N	0	3	328.481	3.389	20	30		EGEDHN
C=C[C@@H](C(=O)NCCNCc1cc(F)cc(F)c1)c1ccccc1	ZINC001151990613	1379832470	/nfs/dbraw/zinc/83/24/70/1379832470.db2.gz	KLBSJVHBXVHCNW-GOSISDBHSA-N	0	3	330.378	3.140	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)/C=C(\C)C1CC1	ZINC001152128593	1379867612	/nfs/dbraw/zinc/86/76/12/1379867612.db2.gz	KBLNUGRTKCPFMK-AAWPKVBNSA-N	0	3	343.446	3.380	20	30		EGEDHN
CC(C)(C)[C@@H](CNCc1ccc(C#N)cc1F)NC(=O)c1ccco1	ZINC001284562609	1379972026	/nfs/dbraw/zinc/97/20/26/1379972026.db2.gz	NFVGOEDGMVPNAF-QGZVFWFLSA-N	0	3	343.402	3.225	20	30		EGEDHN
C[C@@H](CCCc1ccccc1)C(=O)NCCNCc1ccc(C#N)cc1	ZINC001152769193	1379980056	/nfs/dbraw/zinc/98/00/56/1379980056.db2.gz	DHZGTAKZQONZNY-SFHVURJKSA-N	0	3	349.478	3.423	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)c1sccc1F	ZINC001153164181	1380028367	/nfs/dbraw/zinc/02/83/67/1380028367.db2.gz	GAACUYYFJSVHJT-CYBMUJFWSA-N	0	3	345.443	3.399	20	30		EGEDHN
C#CC[C@@H](CC(=O)NCCNCc1ccc(F)cc1)c1ccccc1	ZINC001153714473	1380117371	/nfs/dbraw/zinc/11/73/71/1380117371.db2.gz	MVMNDLSXSJFRTE-IBGZPJMESA-N	0	3	338.426	3.229	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@@H](C)N(CC)Cc1ccsc1	ZINC001153830845	1380139701	/nfs/dbraw/zinc/13/97/01/1380139701.db2.gz	MNNVUWUBZJLILO-OAHLLOKOSA-N	0	3	331.485	3.376	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C1(Cc2ccccc2)CCC1	ZINC001153858937	1380144964	/nfs/dbraw/zinc/14/49/64/1380144964.db2.gz	UOYYLSNFQDHURT-GOSISDBHSA-N	0	3	326.484	3.249	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)C2(CCc3ccccc3)CC2)c1	ZINC001153959919	1380162736	/nfs/dbraw/zinc/16/27/36/1380162736.db2.gz	OGPSKIMTUPZXTC-UHFFFAOYSA-N	0	3	347.462	3.177	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)[C@@H](F)C(C)C	ZINC001154706195	1380336236	/nfs/dbraw/zinc/33/62/36/1380336236.db2.gz	SZSSWHRIDAFBLY-DYVFJYSZSA-N	0	3	337.414	3.018	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H](C)N(CC)C[C@@H](O)c2ccccc2)CC1	ZINC001155028348	1380394459	/nfs/dbraw/zinc/39/44/59/1380394459.db2.gz	ZXPDJABXEHDKCC-YLJYHZDGSA-N	0	3	344.499	3.293	20	30		EGEDHN
CCc1ccoc1C(=O)NC[C@@H](C)N(CC)Cc1cccc(C#N)c1	ZINC001155062014	1380401004	/nfs/dbraw/zinc/40/10/04/1380401004.db2.gz	RMXVLUFCOOBHBH-OAHLLOKOSA-N	0	3	339.439	3.354	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)[C@@]12C[C@@H]1CCCC2	ZINC001155120387	1380412457	/nfs/dbraw/zinc/41/24/57/1380412457.db2.gz	QTTABBZFGPZUME-PBEJRMEISA-N	0	3	339.483	3.465	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NCCCNCc1c(F)cccc1Cl	ZINC001155428249	1380451349	/nfs/dbraw/zinc/45/13/49/1380451349.db2.gz	YRTXXTLVNKYPCS-CYBMUJFWSA-N	0	3	342.842	3.056	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C1(c2ccccc2F)CCC1	ZINC001156329759	1380559604	/nfs/dbraw/zinc/55/96/04/1380559604.db2.gz	AQBGOIBLNKYMTC-MRXNPFEDSA-N	0	3	330.447	3.097	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@H](C)CCc1cccc(F)c1	ZINC001157013551	1380751588	/nfs/dbraw/zinc/75/15/88/1380751588.db2.gz	LKLCRTYMKKNGKT-IAGOWNOFSA-N	0	3	332.463	3.244	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@@H]1CCCCc2ccccc21	ZINC001157171008	1380793732	/nfs/dbraw/zinc/79/37/32/1380793732.db2.gz	DGWOWNKGGFRPSE-YLJYHZDGSA-N	0	3	326.484	3.347	20	30		EGEDHN
C=CCOC(=O)[C@@H](Nc1ccc(CN(C)C2CC2)cn1)[C@@H](C)CC	ZINC001157186387	1380801203	/nfs/dbraw/zinc/80/12/03/1380801203.db2.gz	NVKVXGVFXPCBAO-KSSFIOAISA-N	0	3	331.460	3.232	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NC[C@@H](C)N(CC)Cc1cc(C)sc1C	ZINC001157217020	1380813602	/nfs/dbraw/zinc/81/36/02/1380813602.db2.gz	GDJIPRKFAJUGLS-UKRRQHHQSA-N	0	3	338.517	3.283	20	30		EGEDHN
Cc1c(Cl)c(Cl)nc(N2C[C@@H]3CCCN(C)[C@@H]3C2)c1C#N	ZINC001157259096	1380826847	/nfs/dbraw/zinc/82/68/47/1380826847.db2.gz	CQFMOOPPZNKLPV-CMPLNLGQSA-N	0	3	325.243	3.099	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1cccc(C)c1	ZINC001157509954	1380951336	/nfs/dbraw/zinc/95/13/36/1380951336.db2.gz	BSCMDFJXZYSVKM-LJQANCHMSA-N	0	3	330.472	3.124	20	30		EGEDHN
C[Si](C)(C)C#Cc1ccnc(N2CCN[C@H](c3ccccc3)C2)c1	ZINC001157766528	1381027852	/nfs/dbraw/zinc/02/78/52/1381027852.db2.gz	JALWZDUDRFVQML-IBGZPJMESA-N	0	3	335.527	3.461	20	30		EGEDHN
C#CCCCC(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(C#N)cc1	ZINC001157884741	1381060186	/nfs/dbraw/zinc/06/01/86/1381060186.db2.gz	GWVVLPLLYNODJB-HXUWFJFHSA-N	0	3	337.467	3.175	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)CC(C)(C)C1CC1	ZINC001157907776	1381067325	/nfs/dbraw/zinc/06/73/25/1381067325.db2.gz	FFWSIMMJHQMILB-GOSISDBHSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cccc(NC(=O)CC)c1	ZINC001158050163	1381112277	/nfs/dbraw/zinc/11/22/77/1381112277.db2.gz	LBOMLADBGDZZMZ-GOSISDBHSA-N	0	3	343.471	3.148	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc(C)n([C@H](C)CC)n1	ZINC001158154936	1381143796	/nfs/dbraw/zinc/14/37/96/1381143796.db2.gz	CUACQLCTHNQSQF-NVXWUHKLSA-N	0	3	332.492	3.275	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)Cc1ccc2cnccc2c1	ZINC001158217041	1381161230	/nfs/dbraw/zinc/16/12/30/1381161230.db2.gz	BHBJUBYJADTYDA-HXUWFJFHSA-N	0	3	337.467	3.276	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)CCC(C)(F)F)CCN1Cc1ccc(C#N)cc1	ZINC001328260652	1388702618	/nfs/dbraw/zinc/70/26/18/1388702618.db2.gz	SVXXKSVHSSJBIU-YOEHRIQHSA-N	0	3	349.425	3.463	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCCN1C(=O)CCCF	ZINC001158329033	1381202661	/nfs/dbraw/zinc/20/26/61/1381202661.db2.gz	GVAIQYVHJFEXSM-GOSISDBHSA-N	0	3	331.435	3.121	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCCC[C@@H]1CN(C)CCOCC(F)F	ZINC001158370325	1381222186	/nfs/dbraw/zinc/22/21/86/1381222186.db2.gz	UUHLMUTYCRVPNL-JKSUJKDBSA-N	0	3	346.462	3.183	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1CCc2ccccc2C1	ZINC001158522119	1381280325	/nfs/dbraw/zinc/28/03/25/1381280325.db2.gz	MHTFLZPBDRPMIM-WOJBJXKFSA-N	0	3	326.484	3.290	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)[C@H](C)c1ccc(C)o1	ZINC001158565569	1381303443	/nfs/dbraw/zinc/30/34/43/1381303443.db2.gz	RLHMMPJCIDTPOO-QZTJIDSGSA-N	0	3	348.487	3.207	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cnn(CC2CCCC2)c1	ZINC001158680408	1381349461	/nfs/dbraw/zinc/34/94/61/1381349461.db2.gz	SCZVMGOCXGUTEX-LJQANCHMSA-N	0	3	344.503	3.186	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)CCc1ccc(F)cc1F	ZINC001158697021	1381357028	/nfs/dbraw/zinc/35/70/28/1381357028.db2.gz	JOLCOHGRSXPLMK-QGZVFWFLSA-N	0	3	336.426	3.396	20	30		EGEDHN
C[C@@]1(C(=O)NCCCNCc2ccc(C#N)cc2F)CC=CCC1	ZINC001158761245	1381386816	/nfs/dbraw/zinc/38/68/16/1381386816.db2.gz	HNHSWDLETLBEAI-LJQANCHMSA-N	0	3	329.419	3.040	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)Cc1c[nH]c2ccccc12	ZINC001158780664	1381395707	/nfs/dbraw/zinc/39/57/07/1381395707.db2.gz	DELKBVQXMVWWDU-QGZVFWFLSA-N	0	3	325.456	3.209	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc(Cl)cc2c1OCC2	ZINC001158936029	1381473562	/nfs/dbraw/zinc/47/35/62/1381473562.db2.gz	QLDZLTNBHZYFAO-MRXNPFEDSA-N	0	3	348.874	3.387	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1Cc2c1cccc2Cl	ZINC001158936280	1381474114	/nfs/dbraw/zinc/47/41/14/1381474114.db2.gz	ZLKLZINEIGVYMD-RHSMWYFYSA-N	0	3	332.875	3.479	20	30		EGEDHN
CCCCC(=O)NCCC1=CCN(Cc2ccc(C#N)cc2)CC1	ZINC001159281041	1381749929	/nfs/dbraw/zinc/74/99/29/1381749929.db2.gz	KKVNDIUAHUACOU-UHFFFAOYSA-N	0	3	325.456	3.387	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1ccccc1C(C)C	ZINC001159408869	1381788975	/nfs/dbraw/zinc/78/89/75/1381788975.db2.gz	VQAPVTCAAHSRND-UHFFFAOYSA-N	0	3	339.277	3.428	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCC1=CCN([C@H](C)c2cccc(F)c2)CC1	ZINC001159595436	1381842548	/nfs/dbraw/zinc/84/25/48/1381842548.db2.gz	YTAVVGWQJYBVDV-HUUCEWRRSA-N	0	3	329.419	3.185	20	30		EGEDHN
C#CCCCCC(=O)NCCC1=CCN(CCc2ccns2)CC1	ZINC001159859468	1381923209	/nfs/dbraw/zinc/92/32/09/1381923209.db2.gz	QTKRYYOYDXKKGA-UHFFFAOYSA-N	0	3	345.512	3.018	20	30		EGEDHN
C#CCCCC(=O)NCCC1=CCN(Cc2ccc(C#N)cc2)CC1	ZINC001159957762	1381950333	/nfs/dbraw/zinc/95/03/33/1381950333.db2.gz	MZOJBGMDNSBCMK-UHFFFAOYSA-N	0	3	335.451	3.000	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)C(C)(C)C1CCCC1	ZINC001160069037	1381988277	/nfs/dbraw/zinc/98/82/77/1381988277.db2.gz	OLMWEUYURIEYDM-UHFFFAOYSA-N	0	3	331.298	3.207	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc(F)cc3ccncc32)CC1	ZINC001160155999	1382018990	/nfs/dbraw/zinc/01/89/90/1382018990.db2.gz	NNXGMWAUVUZCEB-UHFFFAOYSA-N	0	3	339.414	3.312	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H]2CCc3cc(OC)ccc32)CC1	ZINC001160301864	1382066890	/nfs/dbraw/zinc/06/68/90/1382066890.db2.gz	GPMWZSQQSAHDPO-FQEVSTJZSA-N	0	3	340.467	3.049	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C2C3CC4CC(C3)CC2C4)CC1	ZINC001160367293	1382085030	/nfs/dbraw/zinc/08/50/30/1382085030.db2.gz	HJHBZBYGXPOSLE-UHFFFAOYSA-N	0	3	328.500	3.383	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CCc2ccc(N(C)C)cc2)CC1	ZINC001160623008	1382155027	/nfs/dbraw/zinc/15/50/27/1382155027.db2.gz	KAUUOFZMFICYEV-UHFFFAOYSA-N	0	3	341.499	3.010	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc3cc(C)ccc3n2)CC1	ZINC001160646571	1382160100	/nfs/dbraw/zinc/16/01/00/1382160100.db2.gz	RDXGQHVYQXUSIM-UHFFFAOYSA-N	0	3	347.462	3.319	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc(C)nc2C(C)C)CC1	ZINC001160798954	1382200823	/nfs/dbraw/zinc/20/08/23/1382200823.db2.gz	UDZKHRPLZVARRO-UHFFFAOYSA-N	0	3	327.472	3.451	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cnc3ccsc3c2)CC1	ZINC001160861014	1382219274	/nfs/dbraw/zinc/21/92/74/1382219274.db2.gz	QJMRPRZFFRCEEW-UHFFFAOYSA-N	0	3	339.464	3.072	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc3occc3s2)CC1	ZINC001161199261	1382337558	/nfs/dbraw/zinc/33/75/58/1382337558.db2.gz	FIRXEGDDNYPXSE-UHFFFAOYSA-N	0	3	328.437	3.270	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc(OCC)c(C)c2)CC1	ZINC001161363419	1382384335	/nfs/dbraw/zinc/38/43/35/1382384335.db2.gz	AWQVCTJCGVFFPO-UHFFFAOYSA-N	0	3	328.456	3.332	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C2(Cc3ccc(F)cc3)CC2)CC1	ZINC001161417074	1382402460	/nfs/dbraw/zinc/40/24/60/1382402460.db2.gz	BKUKCXBLBDXZEE-UHFFFAOYSA-N	0	3	342.458	3.473	20	30		EGEDHN
CCC(CC)[C@@H](C)C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001161428154	1382407298	/nfs/dbraw/zinc/40/72/98/1382407298.db2.gz	RGYXABCVBNJLMB-CQSZACIVSA-N	0	3	333.451	3.366	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc(Cl)ccc2C)CC1	ZINC001161504436	1382425173	/nfs/dbraw/zinc/42/51/73/1382425173.db2.gz	LNLUAVGSOJIVTE-UHFFFAOYSA-N	0	3	330.859	3.424	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)[C@@H]1CCC[C@H](C(F)(F)F)C1	ZINC001161596715	1382450223	/nfs/dbraw/zinc/45/02/23/1382450223.db2.gz	VBLSKOORRPMNNJ-NEPJUHHUSA-N	0	3	326.790	3.204	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc3ccncc3c2)CC1	ZINC001161660600	1382474213	/nfs/dbraw/zinc/47/42/13/1382474213.db2.gz	QEPQIVHHFHVUIU-UHFFFAOYSA-N	0	3	333.435	3.010	20	30		EGEDHN
N#C[C@H](Nc1cccc2cc([C@@H]3CNCCO3)cn21)c1ccccc1	ZINC001161721161	1382488933	/nfs/dbraw/zinc/48/89/33/1382488933.db2.gz	LIXKPLDWOQKJME-OALUTQOASA-N	0	3	332.407	3.277	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc(OCC)c(OC)c2)CC1	ZINC001161850288	1382529904	/nfs/dbraw/zinc/52/99/04/1382529904.db2.gz	XYUMLXONEYKIST-UHFFFAOYSA-N	0	3	344.455	3.032	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc3c(cccc3OC)[nH]2)CC1	ZINC001161874530	1382535861	/nfs/dbraw/zinc/53/58/61/1382535861.db2.gz	BEHWFORGYHHMHS-UHFFFAOYSA-N	0	3	339.439	3.115	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CCc2cc(F)ccc2F)CC1	ZINC001161938695	1382562695	/nfs/dbraw/zinc/56/26/95/1382562695.db2.gz	SXMRFEIOXARLOL-UHFFFAOYSA-N	0	3	334.410	3.222	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)C[C@@H]2CCCC[C@@H]2C)(COC)CC1	ZINC001162623374	1382814027	/nfs/dbraw/zinc/81/40/27/1382814027.db2.gz	SQWOQDAKAODZRJ-OALUTQOASA-N	0	3	348.531	3.071	20	30		EGEDHN
C[C@@H](N)c1nc2ccccc2n1-c1cc(Cl)nc2[nH]cc(C#N)c21	ZINC001162761971	1382861780	/nfs/dbraw/zinc/86/17/80/1382861780.db2.gz	AIVQUVQUOCOQOJ-SECBINFHSA-N	0	3	336.786	3.447	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C1CC(C)(C)C1	ZINC001162798260	1382875603	/nfs/dbraw/zinc/87/56/03/1382875603.db2.gz	QOPWUIXTXJBONR-UHFFFAOYSA-N	0	3	326.484	3.107	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1csc(C)c1C	ZINC001162822695	1382887006	/nfs/dbraw/zinc/88/70/06/1382887006.db2.gz	ZKQIKFCMNLKTRR-UHFFFAOYSA-N	0	3	340.492	3.273	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C[C@H]1CC[C@@H](C)C1	ZINC001162892110	1382907193	/nfs/dbraw/zinc/90/71/93/1382907193.db2.gz	HYCFFTAFQOMHHW-QUCCMNQESA-N	0	3	326.484	3.107	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C(C)(C)C1CC1	ZINC001162898117	1382909646	/nfs/dbraw/zinc/90/96/46/1382909646.db2.gz	YCDGDYKXVUXTKM-UHFFFAOYSA-N	0	3	326.484	3.107	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1ccccc1CC	ZINC001162906710	1382911846	/nfs/dbraw/zinc/91/18/46/1382911846.db2.gz	ONCWXPUKYOGRES-UHFFFAOYSA-N	0	3	334.463	3.157	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CCC[C@H](C)C1	ZINC001162907151	1382911943	/nfs/dbraw/zinc/91/19/43/1382911943.db2.gz	YWWISXGFVUXRRI-PZJWPPBQSA-N	0	3	340.511	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)CCCC(F)(F)F	ZINC001162946298	1382923808	/nfs/dbraw/zinc/92/38/08/1382923808.db2.gz	DUDANSAIPXSBRH-UHFFFAOYSA-N	0	3	340.389	3.013	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H](C)c1ccc(C)cc1	ZINC001162987426	1382938770	/nfs/dbraw/zinc/93/87/70/1382938770.db2.gz	RHSYIQWMSIQMAX-FQEVSTJZSA-N	0	3	348.490	3.393	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H](C)Cc1ccccc1	ZINC001163001560	1382943398	/nfs/dbraw/zinc/94/33/98/1382943398.db2.gz	JRQOPQCOAWNNBB-HXUWFJFHSA-N	0	3	348.490	3.159	20	30		EGEDHN
N#Cc1ccccc1CNCC1(CCNC(=O)C2CCCC2)CC1	ZINC001163128040	1382971373	/nfs/dbraw/zinc/97/13/73/1382971373.db2.gz	KJVJBLPDOGIZTR-UHFFFAOYSA-N	0	3	325.456	3.125	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)C2CCCCC2)CC1	ZINC001163205863	1382992446	/nfs/dbraw/zinc/99/24/46/1382992446.db2.gz	APPGRDFVUPZEMC-UHFFFAOYSA-N	0	3	343.309	3.351	20	30		EGEDHN
CC(C)=CC(=O)NCCC1(CNCc2cc(C#N)ccc2F)CC1	ZINC001163275997	1383011230	/nfs/dbraw/zinc/01/12/30/1383011230.db2.gz	OTNFFTIUMZOVFR-UHFFFAOYSA-N	0	3	329.419	3.040	20	30		EGEDHN
Cc1occc1C(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001163361235	1383031480	/nfs/dbraw/zinc/03/14/80/1383031480.db2.gz	REIQWSWDRRNASY-UHFFFAOYSA-N	0	3	337.423	3.150	20	30		EGEDHN
CC(C)(C(=O)NCCCNCc1ccc(C#N)cc1F)C1CCC1	ZINC001163429846	1383050310	/nfs/dbraw/zinc/05/03/10/1383050310.db2.gz	BXPHXGBQWVDMHA-UHFFFAOYSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=CCCC(=O)NCCC1(CNCc2cc(O)ccc2Cl)CC1	ZINC001163746375	1383117336	/nfs/dbraw/zinc/11/73/36/1383117336.db2.gz	JCCFMSUOQBSNOV-UHFFFAOYSA-N	0	3	336.863	3.388	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCCNCc1cc(-c2ccc(F)cc2)no1	ZINC001163963872	1383140359	/nfs/dbraw/zinc/14/03/59/1383140359.db2.gz	NOKQNZLVVZVKTE-UHFFFAOYSA-N	0	3	345.418	3.289	20	30		EGEDHN
Cc1ccc(CN2CC[C@@H](Nc3c(C#N)nnc4ccccc43)C2)cc1	ZINC001163968887	1383141050	/nfs/dbraw/zinc/14/10/50/1383141050.db2.gz	WXHGVRJLXYBGBF-QGZVFWFLSA-N	0	3	343.434	3.496	20	30		EGEDHN
CC1(C)CCC[C@H]1C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001164171833	1383162681	/nfs/dbraw/zinc/16/26/81/1383162681.db2.gz	QDDVFMSEAVPQBS-INIZCTEOSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCCNCc1ccn(C2CCCC2)n1	ZINC001164221927	1383167504	/nfs/dbraw/zinc/16/75/04/1383167504.db2.gz	GTFRUCPYORPUIW-HOTGVXAUSA-N	0	3	332.492	3.052	20	30		EGEDHN
CC#CCCCC(=O)NCCCNCc1c(Cl)cccc1OC	ZINC001164244685	1383170627	/nfs/dbraw/zinc/17/06/27/1383170627.db2.gz	MZGGYEUESCGRQA-UHFFFAOYSA-N	0	3	336.863	3.138	20	30		EGEDHN
CCC1CCN(c2nccnc2C(C#N)C(=O)OC(C)(C)C)CC1	ZINC001164455194	1383188465	/nfs/dbraw/zinc/18/84/65/1383188465.db2.gz	CAEHSRODSHOWBU-CQSZACIVSA-N	0	3	330.432	3.052	20	30		EGEDHN
CCN1CCC(N(C)C(F)(F)c2cnc(Cl)c(C#N)c2)CC1	ZINC001165068904	1383221857	/nfs/dbraw/zinc/22/18/57/1383221857.db2.gz	YMEFSQUWABFGMG-UHFFFAOYSA-N	0	3	328.794	3.072	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2[nH]nc3ccc(C)cc32)CC1	ZINC001165968076	1383371581	/nfs/dbraw/zinc/37/15/81/1383371581.db2.gz	SFCRQGUQZJOHNZ-UHFFFAOYSA-N	0	3	346.862	3.114	20	30		EGEDHN
CC[C@@H]1CCC[C@@H]1C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001166035896	1383379811	/nfs/dbraw/zinc/37/98/11/1383379811.db2.gz	HLDGYQZTRAEKCJ-WBVHZDCISA-N	0	3	331.435	3.120	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C(C)(C)C2CCOCC2)CC1	ZINC001166089575	1383388976	/nfs/dbraw/zinc/38/89/76/1383388976.db2.gz	ZYFJXEYQXYQUTL-UHFFFAOYSA-N	0	3	342.911	3.068	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cccnc2C(F)F)CC1	ZINC001166094612	1383389530	/nfs/dbraw/zinc/38/95/30/1383389530.db2.gz	PMRCGKVFXHGGKP-UHFFFAOYSA-N	0	3	343.805	3.261	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCC1(CNCc2cccc(OCC)n2)CC1	ZINC001166573862	1383439801	/nfs/dbraw/zinc/43/98/01/1383439801.db2.gz	GFAWKDGPFLYACV-UHFFFAOYSA-N	0	3	345.487	3.069	20	30		EGEDHN
CC(C)N(CC1CC1)c1nccnc1C(C#N)C(=O)OC(C)(C)C	ZINC001166620155	1383447983	/nfs/dbraw/zinc/44/79/83/1383447983.db2.gz	PCLFXZYYBIHVTC-AWEZNQCLSA-N	0	3	330.432	3.050	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCC1(CNCc2oc(C)nc2C)CC1	ZINC001166694297	1383462079	/nfs/dbraw/zinc/46/20/79/1383462079.db2.gz	MYOCCOVDCOXDCN-KGLIPLIRSA-N	0	3	333.476	3.126	20	30		EGEDHN
C=CCC1(C(=O)NCCC2(CNCc3c(C)noc3C)CC2)CCC1	ZINC001167035702	1383524980	/nfs/dbraw/zinc/52/49/80/1383524980.db2.gz	MQSNHHAWKFJOKN-UHFFFAOYSA-N	0	3	345.487	3.414	20	30		EGEDHN
CCC(CC)N(CC)c1nccnc1C(C#N)C(=O)OC(C)(C)C	ZINC001167107625	1383540686	/nfs/dbraw/zinc/54/06/86/1383540686.db2.gz	ZCABYTBUGLORHU-CQSZACIVSA-N	0	3	332.448	3.440	20	30		EGEDHN
C[C@@H](C(=O)NCCC1(CNCc2ccccc2C#N)CC1)C(C)(F)F	ZINC001167251563	1383576285	/nfs/dbraw/zinc/57/62/85/1383576285.db2.gz	WECXOYIRKBFHOP-AWEZNQCLSA-N	0	3	349.425	3.226	20	30		EGEDHN
Cc1ccc(C(=O)NCCCNCc2cc(C#N)ccc2F)c(F)c1	ZINC001167289512	1383585683	/nfs/dbraw/zinc/58/56/83/1383585683.db2.gz	LXBHNAXIXYDDEL-UHFFFAOYSA-N	0	3	343.377	3.055	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cccc3[nH]ccc32)CC1	ZINC001167312155	1383593422	/nfs/dbraw/zinc/59/34/22/1383593422.db2.gz	XNVBWQVMJGTOCR-UHFFFAOYSA-N	0	3	331.847	3.410	20	30		EGEDHN
N#Cc1ccccc1CNCC1(CCNC(=O)[C@@H]2CC23CCC3)CC1	ZINC001167342714	1383603413	/nfs/dbraw/zinc/60/34/13/1383603413.db2.gz	AJORFKUHJIJVLC-SFHVURJKSA-N	0	3	337.467	3.125	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2coc(C3CCC3)n2)CC1	ZINC001167676407	1383707009	/nfs/dbraw/zinc/70/70/09/1383707009.db2.gz	RGKDWQHJXDIWQI-UHFFFAOYSA-N	0	3	337.851	3.184	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc3ccccc3n2)CC1	ZINC001167843041	1383757624	/nfs/dbraw/zinc/75/76/24/1383757624.db2.gz	QTTJXWVGYUIDLF-UHFFFAOYSA-N	0	3	343.858	3.477	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2c(F)cccc2F)CC1	ZINC001167868982	1383761852	/nfs/dbraw/zinc/76/18/52/1383761852.db2.gz	CWHMIOPJAFDTIU-UHFFFAOYSA-N	0	3	328.790	3.207	20	30		EGEDHN
C=CCC1(C(=O)NCCC2(CNCc3cnoc3C)CC2)CCCC1	ZINC001168589765	1383943274	/nfs/dbraw/zinc/94/32/74/1383943274.db2.gz	DSQWORPDCDAFKG-UHFFFAOYSA-N	0	3	345.487	3.496	20	30		EGEDHN
Cc1ccc(Cl)cc1C(=O)NCCCNCc1ccccc1C#N	ZINC001168723685	1383981472	/nfs/dbraw/zinc/98/14/72/1383981472.db2.gz	UKMRBORURDPJSN-UHFFFAOYSA-N	0	3	341.842	3.430	20	30		EGEDHN
C[C@H]1C[C@@H](N(C)Cc2cccc(C#N)c2)CN1C(=O)OC(C)(C)C	ZINC001168886475	1384047385	/nfs/dbraw/zinc/04/73/85/1384047385.db2.gz	YODCNYLPSXKABY-WMLDXEAASA-N	0	3	329.444	3.388	20	30		EGEDHN
C[C@]1(CNCc2cc(C#N)ccc2Br)CCCC[C@@H]1O	ZINC001308301819	1384117665	/nfs/dbraw/zinc/11/76/65/1384117665.db2.gz	JAETWSDYZPVZPK-JKSUJKDBSA-N	0	3	337.261	3.352	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@@H]1C[C@@]1(CC)C(C)C	ZINC001169729663	1384179775	/nfs/dbraw/zinc/17/97/75/1384179775.db2.gz	NRDISXMRQHQUCG-ZFWWWQNUSA-N	0	3	331.298	3.063	20	30		EGEDHN
CO[C@H](C)CCC(=O)N[C@@H](C)CCCCNCc1ccccc1C#N	ZINC001170303751	1384286656	/nfs/dbraw/zinc/28/66/56/1384286656.db2.gz	PQJMOGIQNVZERV-DLBZAZTESA-N	0	3	345.487	3.138	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)C1(C(F)F)CC1	ZINC001170751805	1384378968	/nfs/dbraw/zinc/37/89/68/1384378968.db2.gz	VQPXGPZJXZINBR-AWEZNQCLSA-N	0	3	349.425	3.368	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1CCN(c2cccc(C#N)c2)CC1	ZINC001171229480	1384474162	/nfs/dbraw/zinc/47/41/62/1384474162.db2.gz	NVRJNUDZPPTTGU-QGZVFWFLSA-N	0	3	330.435	3.183	20	30		EGEDHN
C[C@@H](Cc1cccc(C#N)c1)N1CCN2CCc3ccccc3[C@@H]2C1	ZINC001171227839	1384474223	/nfs/dbraw/zinc/47/42/23/1384474223.db2.gz	AYPMZWNCKTYRMF-JTSKRJEESA-N	0	3	331.463	3.404	20	30		EGEDHN
CCC[C@@H](C)C(=O)NC[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001316628345	1384493031	/nfs/dbraw/zinc/49/30/31/1384493031.db2.gz	KTGNXKJNNPFBOB-FRFSOERESA-N	0	3	331.435	3.118	20	30		EGEDHN
C=CCOC(=O)N[C@@H]1CCCN([C@@H]2CCc3c(F)cccc3C2)C1	ZINC001171445566	1384525469	/nfs/dbraw/zinc/52/54/69/1384525469.db2.gz	LCMLAOVVPHMPQQ-HZPDHXFCSA-N	0	3	332.419	3.060	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)NCc1ccnc(OCC2CCC2)n1	ZINC001172300636	1384763691	/nfs/dbraw/zinc/76/36/91/1384763691.db2.gz	ZAMZRMOIWZWKCR-OAHLLOKOSA-N	0	3	336.439	3.248	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)N1CCCN(C(=O)OC(C)(C)C)CC1	ZINC001172316556	1384767874	/nfs/dbraw/zinc/76/78/74/1384767874.db2.gz	UQPKXVBPXQIVPD-MRXNPFEDSA-N	0	3	343.471	3.432	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)N1CC[C@@](O)(C(F)(F)F)[C@@H](C)C1	ZINC001172316544	1384767989	/nfs/dbraw/zinc/76/79/89/1384767989.db2.gz	ULQWCYXCFBKBDW-ZENOOKHLSA-N	0	3	326.362	3.124	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H](CC)Oc2ccccc2C)C1	ZINC001317087529	1384849565	/nfs/dbraw/zinc/84/95/65/1384849565.db2.gz	KDVSNQKZUBLNQZ-BZUAXINKSA-N	0	3	336.863	3.142	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H](NCc2cccc(F)c2)C[C@H]1C#N	ZINC001172967970	1384891869	/nfs/dbraw/zinc/89/18/69/1384891869.db2.gz	NHQHFCAMCLLYLI-CVEARBPZSA-N	0	3	333.407	3.207	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H](NCc2cc(C#N)cs2)C[C@H]1C#N	ZINC001172978598	1384894498	/nfs/dbraw/zinc/89/44/98/1384894498.db2.gz	NVUSKOOIQVBLAD-KBPBESRZSA-N	0	3	346.456	3.001	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H](N2CCCC(F)(F)CC2)C[C@H]1C#N	ZINC001172979947	1384894607	/nfs/dbraw/zinc/89/46/07/1384894607.db2.gz	IXPMQOMFXBJEMX-KGLIPLIRSA-N	0	3	343.418	3.399	20	30		EGEDHN
CC(C)N(C)Cc1cnc2n1CCN(C1CCC(CC#N)CC1)C2	ZINC001173332748	1384960690	/nfs/dbraw/zinc/96/06/90/1384960690.db2.gz	FITHLVBKQUHICV-UHFFFAOYSA-N	0	3	329.492	3.011	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](C)CCCCNCc1nnc(C(C)C)[nH]1	ZINC001174649684	1385129926	/nfs/dbraw/zinc/12/99/26/1385129926.db2.gz	HPSYZPUSFNTIFY-HNNXBMFYSA-N	0	3	349.523	3.295	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H](C)CCCCNCc1ncc(Cl)n1C	ZINC001174681480	1385133990	/nfs/dbraw/zinc/13/39/90/1385133990.db2.gz	DGDAAVGBRUWYHC-ZDUSSCGKSA-N	0	3	340.899	3.050	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@H](C)CCCCNCc1nnc(C(C)C)[nH]1	ZINC001174850095	1385160119	/nfs/dbraw/zinc/16/01/19/1385160119.db2.gz	SYCDHPRGQLMIMN-JKSUJKDBSA-N	0	3	349.523	3.295	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@H](C)CCCCNCc1cc(C)n(C)n1	ZINC001174850400	1385160168	/nfs/dbraw/zinc/16/01/68/1385160168.db2.gz	XZUPOSHTEOABMR-HZPDHXFCSA-N	0	3	334.508	3.095	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H](C)CCCCNCc1cc(C)n(C)n1	ZINC001174850156	1385160252	/nfs/dbraw/zinc/16/02/52/1385160252.db2.gz	UYLRVESECZGPDY-RDJZCZTQSA-N	0	3	334.508	3.095	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H](C)CCCCNCc2ocnc2C)CC1	ZINC001175082192	1385191473	/nfs/dbraw/zinc/19/14/73/1385191473.db2.gz	MCMRSDSIMCTVAE-OAHLLOKOSA-N	0	3	333.476	3.494	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)CCCCNCc2nccn2CC)CCC1	ZINC001175089032	1385193032	/nfs/dbraw/zinc/19/30/32/1385193032.db2.gz	GQXZJNDMVXLUIO-QGZVFWFLSA-N	0	3	346.519	3.414	20	30		EGEDHN
CC(C)(C)CC(=O)NCCN(Cc1ccc(OCC#N)cc1)C1CC1	ZINC001317548412	1385302147	/nfs/dbraw/zinc/30/21/47/1385302147.db2.gz	WDZKYJYYNSAJAT-UHFFFAOYSA-N	0	3	343.471	3.106	20	30		EGEDHN
CC(C)(C)CC(=O)NCC[C@H]1CCN(Cc2ccc(F)c(C#N)c2)C1	ZINC001317773391	1385464808	/nfs/dbraw/zinc/46/48/08/1385464808.db2.gz	BKFUGTFBPBROBX-HNNXBMFYSA-N	0	3	345.462	3.462	20	30		EGEDHN
Cc1cc(C(=O)NCCCNCc2ccccc2C#N)cc(C)c1F	ZINC001176302830	1385545769	/nfs/dbraw/zinc/54/57/69/1385545769.db2.gz	REIQCDKUZPASEO-UHFFFAOYSA-N	0	3	339.414	3.224	20	30		EGEDHN
CC1=CC[C@@](C)(C(=O)NCCCNCc2ccc(C#N)cc2F)CC1	ZINC001176744138	1385679260	/nfs/dbraw/zinc/67/92/60/1385679260.db2.gz	GOEVFNLHOURAGJ-HXUWFJFHSA-N	0	3	343.446	3.430	20	30		EGEDHN
C=C[C@@H](C(=O)NCCCNCc1ncc(C)s1)c1ccccc1	ZINC001176778926	1385693629	/nfs/dbraw/zinc/69/36/29/1385693629.db2.gz	QXHFQDOYMCSREB-MRXNPFEDSA-N	0	3	329.469	3.017	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)CCCC1CCCC1	ZINC001177095693	1385807294	/nfs/dbraw/zinc/80/72/94/1385807294.db2.gz	NWJXKZDAPYKARM-UHFFFAOYSA-N	0	3	331.298	3.351	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2ccsn2)CCCC[C@H]1C	ZINC001318743320	1385849866	/nfs/dbraw/zinc/84/98/66/1385849866.db2.gz	HNOIOQLUZWXYHV-IAQYHMDHSA-N	0	3	327.881	3.164	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@@H](C)SC	ZINC001177225439	1385874212	/nfs/dbraw/zinc/87/42/12/1385874212.db2.gz	MOUNRFCWNQKULD-CQSZACIVSA-N	0	3	332.941	3.489	20	30		EGEDHN
C=CCCC(=O)N(CCCNCc1conc1C)CC1CCCC1	ZINC001177241975	1385881189	/nfs/dbraw/zinc/88/11/89/1385881189.db2.gz	CGRLCMOMZZLRNQ-UHFFFAOYSA-N	0	3	333.476	3.448	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)c1c[nH]nc1C	ZINC001177379173	1385935583	/nfs/dbraw/zinc/93/55/83/1385935583.db2.gz	URUXSMRKADZEPQ-UHFFFAOYSA-N	0	3	338.883	3.083	20	30		EGEDHN
C=CCC1(C(=O)NCCCNCc2ccn(C(C)C)n2)CCCC1	ZINC001177548074	1385993471	/nfs/dbraw/zinc/99/34/71/1385993471.db2.gz	OINNADALAWAJJQ-UHFFFAOYSA-N	0	3	332.492	3.196	20	30		EGEDHN
N#Cc1cccnc1NCCNCc1ccc(F)cc1C(F)(F)F	ZINC001319316252	1386054753	/nfs/dbraw/zinc/05/47/53/1386054753.db2.gz	SHSFADKNVVNGKG-UHFFFAOYSA-N	0	3	338.308	3.313	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cccc(OC)c2F)CCCC1	ZINC001319378483	1386091958	/nfs/dbraw/zinc/09/19/58/1386091958.db2.gz	AGIRWWQKIHBRQH-UHFFFAOYSA-N	0	3	340.826	3.219	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](NCc2cn(C(C)C)nc2C)[C@@H]1C	ZINC001178503530	1386237201	/nfs/dbraw/zinc/23/72/01/1386237201.db2.gz	DJTFWVDGJJUSOL-HKUYNNGSSA-N	0	3	344.503	3.045	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CC[C@H](NCc2ccccc2F)[C@@H]1C)OCC	ZINC001178818727	1386316570	/nfs/dbraw/zinc/31/65/70/1386316570.db2.gz	WXFXNBZLAYEANX-SNRMKQJTSA-N	0	3	348.462	3.276	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2ccc(F)cc2F)CCCC1	ZINC001698639500	1406287013	/nfs/dbraw/zinc/28/70/13/1406287013.db2.gz	RJVMXKUOZSHKNL-UHFFFAOYSA-N	0	3	328.790	3.350	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCCCCCNCc1ccn(CC)n1	ZINC001179212277	1386424427	/nfs/dbraw/zinc/42/44/27/1386424427.db2.gz	JNSISDBNGJIMIY-UHFFFAOYSA-N	0	3	334.508	3.272	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCCCCCCNCc1nnc(C(C)C)[nH]1	ZINC001179335243	1386453960	/nfs/dbraw/zinc/45/39/60/1386453960.db2.gz	HZRCQCQCKCIENF-MRXNPFEDSA-N	0	3	349.523	3.297	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@@H]1C	ZINC001179363894	1386464204	/nfs/dbraw/zinc/46/42/04/1386464204.db2.gz	ABOHYICYFRGZTN-ZWOKBUDYSA-N	0	3	342.458	3.359	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@H](NCc2cccc(Cl)n2)[C@@H]1C	ZINC001179384052	1386468910	/nfs/dbraw/zinc/46/89/10/1386468910.db2.gz	BFIQCLXELSQAJR-LZWOXQAQSA-N	0	3	335.879	3.416	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCCCCCNCc2nnc(C(C)C)[nH]2)C1	ZINC001179533765	1386508589	/nfs/dbraw/zinc/50/85/89/1386508589.db2.gz	UBWXRKQIEFCCHH-UHFFFAOYSA-N	0	3	347.507	3.051	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)CCCC(C)=O)CCCC[C@H]1C	ZINC001698657345	1406307848	/nfs/dbraw/zinc/30/78/48/1406307848.db2.gz	QYIXGJFNWXTHKS-CXAGYDPISA-N	0	3	328.884	3.153	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2ncc(C)s2)C1	ZINC001181199523	1386957717	/nfs/dbraw/zinc/95/77/17/1386957717.db2.gz	IMKSBTXFUYOQFJ-DNVCBOLYSA-N	0	3	347.528	3.219	20	30		EGEDHN
C#CCN(CC1CC1)C(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F	ZINC001321905461	1387007058	/nfs/dbraw/zinc/00/70/58/1387007058.db2.gz	SEOJKNAXBGKVJX-GOSISDBHSA-N	0	3	346.421	3.016	20	30		EGEDHN
C#CC(C)(C)C(=O)N(C)C[C@H]1CCCCN1Cc1ccc(OC)cc1	ZINC001182637153	1387199648	/nfs/dbraw/zinc/19/96/48/1387199648.db2.gz	WIQNBVKZYSYTQV-GOSISDBHSA-N	0	3	342.483	3.168	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)[C@@H]1CCc2c3ccccc3[nH]c2C1	ZINC001182720852	1387214298	/nfs/dbraw/zinc/21/42/98/1387214298.db2.gz	ZZFLIBKFYYHTED-CVEARBPZSA-N	0	3	337.467	3.039	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2ocnc2C)C1	ZINC001182750934	1387218651	/nfs/dbraw/zinc/21/86/51/1387218651.db2.gz	QFWSEDPNFKWKQV-AUUYWEPGSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1c2ccccc2nn1C	ZINC001329346104	1389070628	/nfs/dbraw/zinc/07/06/28/1389070628.db2.gz	PKEJCLORSGLKKJ-UHFFFAOYSA-N	0	3	348.878	3.014	20	30		EGEDHN
CCCC[C@@H](CNCc1ccc(C#N)s1)NC(=O)c1ccoc1	ZINC001329873634	1389240775	/nfs/dbraw/zinc/24/07/75/1389240775.db2.gz	ABGJYMBWIDZNSZ-AWEZNQCLSA-N	0	3	331.441	3.291	20	30		EGEDHN
CN(C(=O)C1=CCCC1)[C@@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001331273199	1389679882	/nfs/dbraw/zinc/67/98/82/1389679882.db2.gz	CWCUTJQNASGRJY-IBGZPJMESA-N	0	3	341.430	3.134	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N1C[C@H](C)CC(C)(C)C1	ZINC001338851257	1389790730	/nfs/dbraw/zinc/79/07/30/1389790730.db2.gz	KHHOMPDGVPOVGT-CVEARBPZSA-N	0	3	331.508	3.146	20	30		EGEDHN
C#CCOc1ccc(CNCc2ccc(NC(=O)C3CC3)cc2)cc1	ZINC001339016801	1389860259	/nfs/dbraw/zinc/86/02/59/1389860259.db2.gz	DTFQRGDZTNLGKU-UHFFFAOYSA-N	0	3	334.419	3.337	20	30		EGEDHN
CN(C)C[C@@H]1CCc2ccccc2N1C(=O)c1csc(C#N)c1	ZINC001332012946	1389945685	/nfs/dbraw/zinc/94/56/85/1389945685.db2.gz	VJHDKDUWDHSDGO-HNNXBMFYSA-N	0	3	325.437	3.143	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N(CC)Cc1cccs1	ZINC001339485994	1390043658	/nfs/dbraw/zinc/04/36/58/1390043658.db2.gz	ZRBYKZIJSQFZCE-HNNXBMFYSA-N	0	3	345.516	3.361	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccc(N2C[C@@H](C)O[C@@H](C)C2)c(F)c1	ZINC001340173413	1390241954	/nfs/dbraw/zinc/24/19/54/1390241954.db2.gz	ROEOPZNFQJSIHA-JKIFEVAISA-N	0	3	349.450	3.061	20	30		EGEDHN
CN(C(=O)CCC1CCC1)C1CC(NCc2cc(C#N)ccc2F)C1	ZINC001333049741	1390242310	/nfs/dbraw/zinc/24/23/10/1390242310.db2.gz	RTUXDLDULHEQJQ-UHFFFAOYSA-N	0	3	343.446	3.357	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccc(C)c(OCC2CCOCC2)c1	ZINC001340717514	1390352013	/nfs/dbraw/zinc/35/20/13/1390352013.db2.gz	PZBVMLCITRZEEP-GOSISDBHSA-N	0	3	346.471	3.423	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCCC2CCC(F)(F)CC2)CC1	ZINC001333710331	1390379800	/nfs/dbraw/zinc/37/98/00/1390379800.db2.gz	JHLCWEUBZUUGTQ-UHFFFAOYSA-N	0	3	329.435	3.152	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)Cc3c[nH]c4cnccc34)nc21	ZINC001341929854	1390551010	/nfs/dbraw/zinc/55/10/10/1390551010.db2.gz	LJQIMQDBRDKNDB-CQSZACIVSA-N	0	3	329.363	3.167	20	30		EGEDHN
CC(C)Oc1ccc(C(=O)C(C#N)c2nc(N)c3ccccc3n2)cc1	ZINC001342607984	1390631937	/nfs/dbraw/zinc/63/19/37/1390631937.db2.gz	VPHYEJXOKRZPDL-INIZCTEOSA-N	0	3	346.390	3.489	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)[C@H](C)OC2CCCCC2)cc1	ZINC001343337129	1390707877	/nfs/dbraw/zinc/70/78/77/1390707877.db2.gz	WZELENZNVLMSSJ-GUYCJALGSA-N	0	3	344.411	3.080	20	30		EGEDHN
Cn1c(Cl)cnc1C(C#N)C(=O)C[C@H]1CCc2ccccc2C1	ZINC001344321779	1390782082	/nfs/dbraw/zinc/78/20/82/1390782082.db2.gz	BFJCGPHDNYSGEE-SWLSCSKDSA-N	0	3	327.815	3.445	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccc(Cl)c(NC(=O)C2CC2)c1	ZINC001344803109	1390816018	/nfs/dbraw/zinc/81/60/18/1390816018.db2.gz	YKNHPJVIEBOYMJ-CQSZACIVSA-N	0	3	335.835	3.311	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCCOc1ccc(F)cc1F	ZINC001344875164	1390821157	/nfs/dbraw/zinc/82/11/57/1390821157.db2.gz	NCSRKQDARGZYFC-ZDUSSCGKSA-N	0	3	333.338	3.217	20	30		EGEDHN
Cn1c(Cl)cnc1C(C#N)C(=O)CCc1nc2ccccc2s1	ZINC001346095649	1390907057	/nfs/dbraw/zinc/90/70/57/1390907057.db2.gz	ICFGXUJGBKWWLA-SNVBAGLBSA-N	0	3	344.827	3.492	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccc(NC[C@H]2CCCO2)c(F)c1	ZINC001353559872	1392039336	/nfs/dbraw/zinc/03/93/36/1392039336.db2.gz	PAIBOSUOFPBFGU-GDBMZVCRSA-N	0	3	335.423	3.039	20	30		EGEDHN
Cc1ccc(C#N)cc1C(=O)N1CCN(C2CCC(C)CC2)CC1	ZINC001353602326	1392048154	/nfs/dbraw/zinc/04/81/54/1392048154.db2.gz	GXBOJVAKMLGXQF-UHFFFAOYSA-N	0	3	325.456	3.203	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@@H](CNC(=O)CCCC3CC3)C2)c1	ZINC001479315643	1392212916	/nfs/dbraw/zinc/21/29/16/1392212916.db2.gz	ZWIGOSAYRGXQKQ-MAEOIBBWSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@H](C)Cc2ccc(F)cc2)C1	ZINC001479418763	1392239981	/nfs/dbraw/zinc/23/99/81/1392239981.db2.gz	WBPLSUSFHVWBTK-SRCQZFHVSA-N	0	3	338.854	3.241	20	30		EGEDHN
C[C@@H](NC(=O)C(C)(C)C)[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001480388658	1392734197	/nfs/dbraw/zinc/73/41/97/1392734197.db2.gz	ZKKAAYGFXXUNMW-CRAIPNDOSA-N	0	3	327.472	3.321	20	30		EGEDHN
Cc1ccc(F)c(C(=O)NCC[C@H](C)NCc2ccccc2C#N)c1	ZINC001480794718	1392938247	/nfs/dbraw/zinc/93/82/47/1392938247.db2.gz	GEIXCFQYUOIJJN-HNNXBMFYSA-N	0	3	339.414	3.304	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)CCc1ccccc1	ZINC001480805692	1392945231	/nfs/dbraw/zinc/94/52/31/1392945231.db2.gz	VKWDTFBQSAVBRO-CQSZACIVSA-N	0	3	339.277	3.012	20	30		EGEDHN
C[C@H](CNC(=O)c1ccc2c(c1)CCC2)N(C)Cc1ccc(C#N)cc1	ZINC001485384866	1395872484	/nfs/dbraw/zinc/87/24/84/1395872484.db2.gz	WSXWZUQWDVMGHU-MRXNPFEDSA-N	0	3	347.462	3.297	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)C(C)(C)C(F)F)CCN1Cc1ccc(C#N)cc1	ZINC001502989863	1396238264	/nfs/dbraw/zinc/23/82/64/1396238264.db2.gz	QNYUYQTVJPKWLM-XJKSGUPXSA-N	0	3	349.425	3.319	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)NC(=O)c1ccc(C2CC2)cc1	ZINC001497990560	1396905378	/nfs/dbraw/zinc/90/53/78/1396905378.db2.gz	HKHOXPXWSIAKGA-CYBMUJFWSA-N	0	3	339.464	3.405	20	30		EGEDHN
CC[C@H](c1ccc(F)cc1)N1CCC(N(C)C(=O)[C@@H](C)C#N)CC1	ZINC001690018880	1404259011	/nfs/dbraw/zinc/25/90/11/1404259011.db2.gz	VFKBJZMSQWEMCB-KBXCAEBGSA-N	0	3	331.435	3.359	20	30		EGEDHN
CC(F)(F)CCC(=O)NC[C@@H]1CCCN(Cc2ccc(C#N)cc2)C1	ZINC001690385524	1404518283	/nfs/dbraw/zinc/51/82/83/1404518283.db2.gz	NWOFMCVQBBMNTB-KRWDZBQOSA-N	0	3	349.425	3.322	20	30		EGEDHN
C[C@H](CCNC(=O)C1CCCCC1)NCc1cc(C#N)ccc1F	ZINC001690829698	1404765992	/nfs/dbraw/zinc/76/59/92/1404765992.db2.gz	DMHLQOURAMOLOB-CQSZACIVSA-N	0	3	331.435	3.262	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)CCc2ccc(C)cc2C)C1	ZINC001691158445	1405093088	/nfs/dbraw/zinc/09/30/88/1405093088.db2.gz	DWYDKQOSHXVOGJ-SAABIXHNSA-N	0	3	334.891	3.473	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@H](C)Cc2ccc(F)cc2)C1	ZINC001691481875	1405295429	/nfs/dbraw/zinc/29/54/29/1405295429.db2.gz	WBPLSUSFHVWBTK-VMGRFDJRSA-N	0	3	338.854	3.241	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)C[C@H](CC)C(C)C)C1	ZINC001691825527	1405541892	/nfs/dbraw/zinc/54/18/92/1405541892.db2.gz	NGXZLYKVGFPZRS-KKUMJFAQSA-N	0	3	345.325	3.452	20	30		EGEDHN
Cc1coc(C(=O)NCC[C@@H]2CCN(Cc3ccccc3C#N)C2)c1	ZINC001691905242	1405629271	/nfs/dbraw/zinc/62/92/71/1405629271.db2.gz	PXPNUPHFPMPBJG-MRXNPFEDSA-N	0	3	337.423	3.102	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1ncc(Cl)s1)C1CC1	ZINC001732245295	1428489483	/nfs/dbraw/zinc/48/94/83/1428489483.db2.gz	PWRMLHZIKRGVQP-ZDUSSCGKSA-N	0	3	334.272	3.037	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1cc(-c2ccco2)on1)C1CC1	ZINC001732245906	1428489689	/nfs/dbraw/zinc/48/96/89/1428489689.db2.gz	UJCVUSMMGJIWQB-QGZVFWFLSA-N	0	3	349.818	3.175	20	30		EGEDHN
CC(F)(F)C1(C(=O)N2CCC[C@@H]2CNCC#Cc2ccccc2)CC1	ZINC001732327971	1428535203	/nfs/dbraw/zinc/53/52/03/1428535203.db2.gz	HGLQEANWBNYUQG-QGZVFWFLSA-N	0	3	346.421	3.054	20	30		EGEDHN
Cc1cc(C(=O)N(C)[C@@H](C)CNCc2ccc(C#N)s2)c(C)o1	ZINC001732406599	1428569250	/nfs/dbraw/zinc/56/92/50/1428569250.db2.gz	ITBCVUCLRPCSBQ-NSHDSACASA-N	0	3	331.441	3.080	20	30		EGEDHN
Cc1cc(C(=O)N(C)[C@H](C)CNCc2ccc(C#N)s2)c(C)o1	ZINC001732406596	1428569274	/nfs/dbraw/zinc/56/92/74/1428569274.db2.gz	ITBCVUCLRPCSBQ-LLVKDONJSA-N	0	3	331.441	3.080	20	30		EGEDHN
C[C@H](CNCc1ccc(F)c(C#N)c1)NC(=O)C1CCCCCC1	ZINC001699358392	1412665529	/nfs/dbraw/zinc/66/55/29/1412665529.db2.gz	ZPFXIEFQHAYZOE-CQSZACIVSA-N	0	3	331.435	3.262	20	30		EGEDHN
C=Cc1ccc(C(=O)N[C@@H](C)CNCc2cc(C#N)ccc2OC)cc1	ZINC001699420445	1412734384	/nfs/dbraw/zinc/73/43/84/1412734384.db2.gz	WIUTUIQBYDEVRV-HNNXBMFYSA-N	0	3	349.434	3.118	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)CC1CCC1)NCc1ccc(C#N)cc1F	ZINC001732554443	1428741577	/nfs/dbraw/zinc/74/15/77/1428741577.db2.gz	UOKCDNWTXULFPU-GOSISDBHSA-N	0	3	331.435	3.118	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)CC2(C)CC2)CCN1Cc1ccc(C#N)cc1	ZINC001700315032	1413772478	/nfs/dbraw/zinc/77/24/78/1413772478.db2.gz	BRZIZDWLPJLEKL-QAPCUYQASA-N	0	3	325.456	3.218	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)[C@H](CC)SC)CC1	ZINC001700340239	1413817976	/nfs/dbraw/zinc/81/79/76/1413817976.db2.gz	NUYIFDCZHYCORM-HNNXBMFYSA-N	0	3	332.941	3.441	20	30		EGEDHN
CCCc1occc1C(=O)NC[C@H](C)N(C)Cc1ccc(C#N)cc1	ZINC001700482688	1414122661	/nfs/dbraw/zinc/12/26/61/1414122661.db2.gz	CRCNLIJQLUEEKR-HNNXBMFYSA-N	0	3	339.439	3.354	20	30		EGEDHN
C[C@H](C#N)C(=O)NCc1ccc(CN[C@@H](C)c2ccccc2)cc1F	ZINC001701063556	1414721080	/nfs/dbraw/zinc/72/10/80/1414721080.db2.gz	NALUVMKXOTVBBM-CABCVRRESA-N	0	3	339.414	3.452	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)C2(F)CCCCC2)C1	ZINC001707087517	1417194338	/nfs/dbraw/zinc/19/43/38/1417194338.db2.gz	HQZVUFOLKBLUTN-JOCQHMNTSA-N	0	3	347.272	3.052	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)C1CC2(CCC2)C1	ZINC001733048293	1429183392	/nfs/dbraw/zinc/18/33/92/1429183392.db2.gz	GHGSANCARLEHDX-HNNXBMFYSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@H](C#N)C(=O)N(C)C1CCN(Cc2ccc(C(F)F)cc2)CC1	ZINC001713051989	1417603499	/nfs/dbraw/zinc/60/34/99/1417603499.db2.gz	WZTLULQDFFWTGV-CYBMUJFWSA-N	0	3	335.398	3.207	20	30		EGEDHN
CCC1(C(=O)NC[C@H](NCc2ccc(C#N)s2)C2CC2)CCC1	ZINC001713116563	1417681139	/nfs/dbraw/zinc/68/11/39/1417681139.db2.gz	GKSFHNFSZYPISI-INIZCTEOSA-N	0	3	331.485	3.184	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H](C)CCc2ccc(F)cc2)C1	ZINC001713159563	1417735645	/nfs/dbraw/zinc/73/56/45/1417735645.db2.gz	DXDPDNNLPJICDI-ZLIFDBKOSA-N	0	3	338.854	3.384	20	30		EGEDHN
CCCN(CCNC(=O)C1(C(C)(F)F)CC1)Cc1ccc(C#N)cc1	ZINC001713551007	1418331504	/nfs/dbraw/zinc/33/15/04/1418331504.db2.gz	WLRUJNXSTICDKQ-UHFFFAOYSA-N	0	3	349.425	3.322	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](NC(=O)c2cccc(F)c2)C2CC2)s1	ZINC001733165106	1429267874	/nfs/dbraw/zinc/26/78/74/1429267874.db2.gz	YYNHOQYIWFLRFW-KRWDZBQOSA-N	0	3	343.427	3.057	20	30		EGEDHN
CC[C@H](N[C@H](C)CNC(=O)c1cc(C#N)c[nH]1)c1ccc(F)cc1F	ZINC001714222599	1419017044	/nfs/dbraw/zinc/01/70/44/1419017044.db2.gz	LJGLGKWNXKXTSD-BZNIZROVSA-N	0	3	346.381	3.024	20	30		EGEDHN
C[C@@H](CNC(=O)c1cccc2cc[nH]c21)NCc1ccc(C#N)s1	ZINC001714276105	1419056151	/nfs/dbraw/zinc/05/61/51/1419056151.db2.gz	ZXYYBEOUIUCXLM-LBPRGKRZSA-N	0	3	338.436	3.009	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC[C@@H]1CNCC#Cc1ccccc1Cl	ZINC001714332291	1419112481	/nfs/dbraw/zinc/11/24/81/1419112481.db2.gz	PTRGVHBCPZVBQY-NVXWUHKLSA-N	0	3	332.875	3.318	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccc(C(F)F)nc2)CCCC1	ZINC001714497210	1419221723	/nfs/dbraw/zinc/22/17/23/1419221723.db2.gz	OETSCWOUMMWZCG-UHFFFAOYSA-N	0	3	343.805	3.404	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](CNC(=O)CCC3CCC3)C2)cc1	ZINC001714631828	1419403183	/nfs/dbraw/zinc/40/31/83/1419403183.db2.gz	UCGDEAISHXACMV-LJQANCHMSA-N	0	3	325.456	3.077	20	30		EGEDHN
CCCN(CCNC(=O)c1ccc(C)o1)Cc1ccc(C#N)cc1	ZINC001714646704	1419422449	/nfs/dbraw/zinc/42/24/49/1419422449.db2.gz	MLIVNSSNIJTJRX-UHFFFAOYSA-N	0	3	325.412	3.102	20	30		EGEDHN
CCc1ccsc1C(=O)N(C)[C@H](C)CNCc1ccc(C#N)s1	ZINC001714878143	1419613738	/nfs/dbraw/zinc/61/37/38/1419613738.db2.gz	GJGKCIADEBVODP-GFCCVEGCSA-N	0	3	347.509	3.494	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2ncoc2C)CCCC[C@H]1C	ZINC001715133351	1419882531	/nfs/dbraw/zinc/88/25/31/1419882531.db2.gz	WMFFHSCBUYDEJG-BDJLRTHQSA-N	0	3	325.840	3.004	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)c1cccc(Cl)c1	ZINC001715268943	1419985801	/nfs/dbraw/zinc/98/58/01/1419985801.db2.gz	FJTIBLQBZQXMSY-CQSZACIVSA-N	0	3	341.842	3.367	20	30		EGEDHN
Cc1cc(C)c(C(=O)N(C)[C@H](C)CNCc2ccc(F)c(C#N)c2)o1	ZINC001715329627	1420035330	/nfs/dbraw/zinc/03/53/30/1420035330.db2.gz	MOOJQKASFYLELL-CYBMUJFWSA-N	0	3	343.402	3.158	20	30		EGEDHN
CC(C)CC1(C(=O)N[C@@H](C)CNCc2ccc(C#N)s2)CCC1	ZINC001716444992	1420663227	/nfs/dbraw/zinc/66/32/27/1420663227.db2.gz	RFUIFZCRGPQUDV-AWEZNQCLSA-N	0	3	333.501	3.430	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)C[C@@H]2CCCCO2)CC1	ZINC001717355013	1421289339	/nfs/dbraw/zinc/28/93/39/1421289339.db2.gz	AUCHYHBXWCDONI-KRWDZBQOSA-N	0	3	342.911	3.259	20	30		EGEDHN
CN(CC(C)(C)CNCc1ccccc1C#N)C(=O)C1(C)CCC1	ZINC001717455853	1421384963	/nfs/dbraw/zinc/38/49/63/1421384963.db2.gz	CKMIESIJRGKYDG-UHFFFAOYSA-N	0	3	327.472	3.323	20	30		EGEDHN
COc1ccc(C#N)cc1CNC[C@@H]1CCCN1C(=O)CCC(C)C	ZINC001733333012	1429518145	/nfs/dbraw/zinc/51/81/45/1429518145.db2.gz	OVVLBAQEDRCAGV-SFHVURJKSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=C(Cl)Cn1c([C@H](C)CC)nnc1N1C[C@@H](C)N(CC)C[C@@H]1C	ZINC001722544631	1424212670	/nfs/dbraw/zinc/21/26/70/1424212670.db2.gz	UOPVZHDBACXHRX-YUELXQCFSA-N	0	3	339.915	3.463	20	30		EGEDHN
Cc1ccc(C(=O)NCC2(NCc3ccc(C#N)cc3)CC2)c(F)c1	ZINC001723559693	1424465207	/nfs/dbraw/zinc/46/52/07/1424465207.db2.gz	GVIQNVHZPCKYCY-UHFFFAOYSA-N	0	3	337.398	3.058	20	30		EGEDHN
CCC1(C(=O)N[C@@H]2CCN(Cc3cccc(C#N)c3)[C@H](C)C2)CC1	ZINC001724996803	1425402665	/nfs/dbraw/zinc/40/26/65/1425402665.db2.gz	MPRMNDQOUHPUDO-CRAIPNDOSA-N	0	3	325.456	3.218	20	30		EGEDHN
CCCC[C@@H](CNCc1ccc(C#N)s1)NC(=O)c1ccc[nH]1	ZINC001725230587	1425803466	/nfs/dbraw/zinc/80/34/66/1425803466.db2.gz	ZSGXUMFXLCYXMV-ZDUSSCGKSA-N	0	3	330.457	3.026	20	30		EGEDHN
Cc1sccc1C(=O)N(C)C[C@H](C)NCc1ccc(C#N)s1	ZINC001725483926	1426160240	/nfs/dbraw/zinc/16/02/40/1426160240.db2.gz	UMCRXTMBEIYWLY-NSHDSACASA-N	0	3	333.482	3.240	20	30		EGEDHN
C=C(Br)CNC1CC(N(C)C(=O)C2(CCC)CC2)C1	ZINC001725784512	1426469375	/nfs/dbraw/zinc/46/93/75/1426469375.db2.gz	UQKICIVRSWMUNA-UHFFFAOYSA-N	0	3	329.282	3.054	20	30		EGEDHN
Cc1ccc(CCC(=O)NC[C@H](C)NCc2ccc(C#N)s2)s1	ZINC001731642810	1427703400	/nfs/dbraw/zinc/70/34/00/1427703400.db2.gz	RNZGRSJXCAYZGR-LBPRGKRZSA-N	0	3	347.509	3.217	20	30		EGEDHN
CCN(CCNC(=O)[C@H](C)c1ccsc1)Cc1ccc(C#N)cc1	ZINC001731810696	1427991732	/nfs/dbraw/zinc/99/17/32/1427991732.db2.gz	HFRZZZOKYUSVNC-OAHLLOKOSA-N	0	3	341.480	3.362	20	30		EGEDHN
CC1(CCC(=O)NC[C@@H]2CCN(Cc3ccc(C#N)cc3)C2)CC1	ZINC001731859345	1428096150	/nfs/dbraw/zinc/09/61/50/1428096150.db2.gz	XKCKAZKYVDTWCJ-SFHVURJKSA-N	0	3	325.456	3.077	20	30		EGEDHN
CCCN(CCNC(=O)[C@H](F)C(C)C)Cc1ccc(F)c(C#N)c1	ZINC001731868642	1428120754	/nfs/dbraw/zinc/12/07/54/1428120754.db2.gz	KNYRGIDQEYYCHP-QGZVFWFLSA-N	0	3	337.414	3.020	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CCCC[C@@H]1CNCc1ccccc1F	ZINC001733710135	1429925033	/nfs/dbraw/zinc/92/50/33/1429925033.db2.gz	IJHXTDLDGPABIH-QGZVFWFLSA-N	0	3	330.447	3.346	20	30		EGEDHN
CN(C(=O)CC(C)(C)C)[C@@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001734291530	1438021637	/nfs/dbraw/zinc/02/16/37/1438021637.db2.gz	CCRCLFRMVKCMPO-INIZCTEOSA-N	0	3	333.501	3.383	20	30		EGEDHN
C[C@H](CN(C)C(=O)c1ccsc1)NCc1ccc(F)c(C#N)c1	ZINC001734311821	1438042768	/nfs/dbraw/zinc/04/27/68/1438042768.db2.gz	CWSXBQIVMPTMPP-GFCCVEGCSA-N	0	3	331.416	3.009	20	30		EGEDHN
C=C(Cl)CNC1CC(N(C)C(=O)COc2cc(C)ccc2C)C1	ZINC001734602735	1438183743	/nfs/dbraw/zinc/18/37/43/1438183743.db2.gz	OOXUGOJNOPJUOT-UHFFFAOYSA-N	0	3	336.863	3.014	20	30		EGEDHN
C=C(Br)CN[C@H](C)[C@H]1CCCCN1C(=O)C=C1CCC1	ZINC001752138726	1440144194	/nfs/dbraw/zinc/14/41/94/1440144194.db2.gz	DZSZJLVCJAQZLC-UKRRQHHQSA-N	0	3	341.293	3.365	20	30		EGEDHN
C=C(C)CCC(=O)N1CCCC[C@@H]1[C@@H](C)NCc1cnc(C)nc1	ZINC001752145015	1440145696	/nfs/dbraw/zinc/14/56/96/1440145696.db2.gz	FDQISYLKOZJZFV-CRAIPNDOSA-N	0	3	330.476	3.001	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCCC[C@H]2[C@H](C)NCC(=C)Cl)cc1	ZINC001752145260	1440145698	/nfs/dbraw/zinc/14/56/98/1440145698.db2.gz	UFHHFLXULZJSJW-YJBOKZPZSA-N	0	3	330.859	3.393	20	30		EGEDHN
CC#CCN(CCCNC(=O)Cc1ccc(C)c(Cl)c1)C1CC1	ZINC001752262538	1440161935	/nfs/dbraw/zinc/16/19/35/1440161935.db2.gz	XGANFIDKDLJIBT-UHFFFAOYSA-N	0	3	332.875	3.185	20	30		EGEDHN
C#CCN(CCCNC(=O)c1cc(Cl)sc1Cl)C1CC1	ZINC001752260977	1440161990	/nfs/dbraw/zinc/16/19/90/1440161990.db2.gz	INAATDUQABMZPN-UHFFFAOYSA-N	0	3	331.268	3.272	20	30		EGEDHN
CC#CCN(CCCNC(=O)C[C@H]1CCCc2ccccc21)C1CC1	ZINC001752284993	1440165049	/nfs/dbraw/zinc/16/50/49/1440165049.db2.gz	OYIJYWAKIMAUIY-LJQANCHMSA-N	0	3	338.495	3.491	20	30		EGEDHN
CC#CCN(CCCNC(=O)c1cnc(-c2ccco2)s1)C1CC1	ZINC001752287008	1440165522	/nfs/dbraw/zinc/16/55/22/1440165522.db2.gz	KXHRDBZMTKKFKE-UHFFFAOYSA-N	0	3	343.452	3.011	20	30		EGEDHN
C=CCOCCN1CCC(N(C)C(=O)C2(C)CCCCCC2)CC1	ZINC001752301313	1440167849	/nfs/dbraw/zinc/16/78/49/1440167849.db2.gz	IKAVXANESONVPZ-UHFFFAOYSA-N	0	3	336.520	3.472	20	30		EGEDHN
O=C(NC[C@@H](NCC#Cc1ccc(Cl)cc1)C1CC1)C1CCCC1	ZINC001752441243	1440181348	/nfs/dbraw/zinc/18/13/48/1440181348.db2.gz	CCNLMIIPORFKLH-LJQANCHMSA-N	0	3	344.886	3.366	20	30		EGEDHN
C=CCN1CCC(N(CCC)C(=O)c2c[nH]c3ncccc23)CC1	ZINC001752441741	1440181502	/nfs/dbraw/zinc/18/15/02/1440181502.db2.gz	LJEKASKGGJKMII-UHFFFAOYSA-N	0	3	326.444	3.066	20	30		EGEDHN
CC1(C)C(C(=O)NC[C@H](NCC#Cc2ccccc2)C2CC2)C1(C)C	ZINC001752454645	1440182881	/nfs/dbraw/zinc/18/28/81/1440182881.db2.gz	OLUFAZPLBGXVDO-SFHVURJKSA-N	0	3	338.495	3.205	20	30		EGEDHN
CC1(C(=O)NC[C@@H](NCC#Cc2ccccc2Cl)C2CC2)CCC1	ZINC001752472396	1440184604	/nfs/dbraw/zinc/18/46/04/1440184604.db2.gz	IDSGHNVEJPVOTI-GOSISDBHSA-N	0	3	344.886	3.366	20	30		EGEDHN
CC(C)(C)C(=O)NC[C@@H](NCC#Cc1ccccc1Cl)C1CC1	ZINC001752491910	1440186971	/nfs/dbraw/zinc/18/69/71/1440186971.db2.gz	XLADBNRHDUTYPG-QGZVFWFLSA-N	0	3	332.875	3.222	20	30		EGEDHN
C=CCCCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)CC1CCOCC1	ZINC001752532639	1440194002	/nfs/dbraw/zinc/19/40/02/1440194002.db2.gz	UBTDVPPWFYGXQC-KDURUIRLSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)c1cccc2c1OCC2	ZINC001752564431	1440195293	/nfs/dbraw/zinc/19/52/93/1440195293.db2.gz	COUSEHYKWRAZQJ-RYQLBKOJSA-N	0	3	340.467	3.265	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H](NCc3ccc(F)cc3F)C2)CCC1	ZINC001752663063	1440198418	/nfs/dbraw/zinc/19/84/18/1440198418.db2.gz	DIZSTBGPUJYUIJ-WKILWMFISA-N	0	3	334.410	3.448	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1C[C@H](N[C@@H](C)c2ccccc2Cl)C1	ZINC001752691871	1440200611	/nfs/dbraw/zinc/20/06/11/1440200611.db2.gz	NKTBPJCMFYQEBZ-KKUMJFAQSA-N	0	3	336.863	3.231	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H](N[C@@H](C)c3cnc(C)cn3)C2)CCCC1	ZINC001752691772	1440200629	/nfs/dbraw/zinc/20/06/29/1440200629.db2.gz	LHELUAACGRUBQK-ULQDDVLXSA-N	0	3	342.487	3.219	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@H]2CN(Cc3c(C)noc3C)CC[C@@H]21	ZINC001752705758	1440202355	/nfs/dbraw/zinc/20/23/55/1440202355.db2.gz	BKUDMQZOWGICME-HKUYNNGSSA-N	0	3	345.487	3.461	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N[C@H]1C[C@@H](N[C@@H](C)c2ccccc2F)C1	ZINC001752714282	1440203640	/nfs/dbraw/zinc/20/36/40/1440203640.db2.gz	GRRUQGGAOMLKJQ-XUWVNRHRSA-N	0	3	334.435	3.105	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H]1C[C@@H](NCc2ccc(Cl)cc2Cl)C1	ZINC001752726552	1440203972	/nfs/dbraw/zinc/20/39/72/1440203972.db2.gz	PJLRMJSQUKVFHK-GASCZTMLSA-N	0	3	339.266	3.390	20	30		EGEDHN
CCC(C)(C)C(=O)N[C@H]1C[C@@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001752757577	1440205354	/nfs/dbraw/zinc/20/53/54/1440205354.db2.gz	GXMWWHJAWVWLTG-CALCHBBNSA-N	0	3	332.875	3.365	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H]1CCCN(CCOc2cccc(F)c2)C1	ZINC001752785071	1440210871	/nfs/dbraw/zinc/21/08/71/1440210871.db2.gz	OTXMXJLNROCRFR-INIZCTEOSA-N	0	3	348.462	3.245	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@H](CNC(=O)C3(CF)CCC3)C2)c1	ZINC001752787794	1440212052	/nfs/dbraw/zinc/21/20/52/1440212052.db2.gz	UOWZNKLMBRKYKB-SFHVURJKSA-N	0	3	343.446	3.026	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)CC23CC4CC(CC(C4)C2)C3)C1	ZINC001752788331	1440212433	/nfs/dbraw/zinc/21/24/33/1440212433.db2.gz	HUZHCIAOERTUMT-GWVGAJKQSA-N	0	3	342.527	3.444	20	30		EGEDHN
CC(C)(C)/C=C\C(=O)N1CCC[C@H](CNCc2ccccc2C#N)C1	ZINC001752795714	1440214290	/nfs/dbraw/zinc/21/42/90/1440214290.db2.gz	YKYJZQVMJFCEKQ-QXPKXGMISA-N	0	3	339.483	3.489	20	30		EGEDHN
CC(C)(C)/C=C/C(=O)N1CCC[C@@H](CNCc2ccccc2C#N)C1	ZINC001752795712	1440214301	/nfs/dbraw/zinc/21/43/01/1440214301.db2.gz	YKYJZQVMJFCEKQ-DVQDXYAYSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H](C)[C@@H]1CCCN(Cc2ccccn2)C1	ZINC001752842488	1440231535	/nfs/dbraw/zinc/23/15/35/1440231535.db2.gz	XJCPNUNLHAMMSL-IAGOWNOFSA-N	0	3	329.488	3.401	20	30		EGEDHN
C=C(C)CCC(=O)NC1CCC(NCc2ccccc2C#N)CC1	ZINC001752850597	1440233574	/nfs/dbraw/zinc/23/35/74/1440233574.db2.gz	WBUXBSWSAWYJNI-UHFFFAOYSA-N	0	3	325.456	3.432	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](CNCc2csc(C3CC3)n2)C1	ZINC001752937414	1440250578	/nfs/dbraw/zinc/25/05/78/1440250578.db2.gz	FDKUQZSWJNTHEQ-CQSZACIVSA-N	0	3	333.501	3.315	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N1CC[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001752950049	1440252032	/nfs/dbraw/zinc/25/20/32/1440252032.db2.gz	RTKSFTSBFOFEST-SSTBGOPISA-N	0	3	341.430	3.158	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CCC[C@H](NCc2oc(CCC)nc2C)C1	ZINC001752964690	1440253905	/nfs/dbraw/zinc/25/39/05/1440253905.db2.gz	GVCQKFYJXSOUEI-JKSUJKDBSA-N	0	3	333.476	3.419	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1cccc(-n2cccc2)c1	ZINC001753008754	1440266382	/nfs/dbraw/zinc/26/63/82/1440266382.db2.gz	NILNPZMLMSQJGR-OAHLLOKOSA-N	0	3	331.847	3.328	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCC[C@H]1CCCN1Cc1sccc1Cl	ZINC001753025732	1440271409	/nfs/dbraw/zinc/27/14/09/1440271409.db2.gz	ZXZFOHIHEZFDOH-OLZOCXBDSA-N	0	3	339.892	3.422	20	30		EGEDHN
CC(C)(C)C(=O)NCCC[C@@H]1CCCN1CC#Cc1ccccc1	ZINC001753038058	1440275218	/nfs/dbraw/zinc/27/52/18/1440275218.db2.gz	OEZTYEFNJPZDJC-LJQANCHMSA-N	0	3	326.484	3.445	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCN(C)[C@@H]1CCc2c1cc(Cl)cc2Cl	ZINC001753043523	1440277226	/nfs/dbraw/zinc/27/72/26/1440277226.db2.gz	DDTLVGJTQXYQIR-MEBBXXQBSA-N	0	3	340.254	3.188	20	30		EGEDHN
C=CCC1(C(=O)NCCN(C)[C@H](C)c2ccc(F)cc2)CCOCC1	ZINC001753072494	1440289305	/nfs/dbraw/zinc/28/93/05/1440289305.db2.gz	USUCIUZVNZBLHW-MRXNPFEDSA-N	0	3	348.462	3.308	20	30		EGEDHN
C#CCCN1CCC[C@@H]1CNC(=O)c1ccc(OCCCC)cc1	ZINC001753116782	1440311778	/nfs/dbraw/zinc/31/17/78/1440311778.db2.gz	ZSQBHCGVHXJDLV-GOSISDBHSA-N	0	3	328.456	3.083	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H](CNC(=O)CCC3CCCC3)C2)c1	ZINC001753119034	1440312808	/nfs/dbraw/zinc/31/28/08/1440312808.db2.gz	MIIUMJLDXICDOE-HXUWFJFHSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@@H]1CCN(Cc2oc(CC)nc2C)C1	ZINC001753132303	1440317308	/nfs/dbraw/zinc/31/73/08/1440317308.db2.gz	LYDDRJMTALHALM-HOTGVXAUSA-N	0	3	333.476	3.086	20	30		EGEDHN
C=C(C)CN(CCNC(=O)c1cc(F)cc2cccnc21)C1CC1	ZINC001753161052	1440333962	/nfs/dbraw/zinc/33/39/62/1440333962.db2.gz	KVKFQYUMMQRYBU-UHFFFAOYSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=CCCC(=O)N(C)CCNCc1csc(Br)c1	ZINC001753174424	1440336568	/nfs/dbraw/zinc/33/65/68/1440336568.db2.gz	DFFIXAMDAROIOZ-UHFFFAOYSA-N	0	3	331.279	3.025	20	30		EGEDHN
C[C@@H](CC(=O)N(C)CCNCc1ccc(C#N)s1)c1ccccc1	ZINC001753262183	1440344364	/nfs/dbraw/zinc/34/43/64/1440344364.db2.gz	SWKGGNXWQWHVFS-HNNXBMFYSA-N	0	3	341.480	3.362	20	30		EGEDHN
C=C[C@@H](CC(=O)N(C)CCNCc1cncc(F)c1)c1ccccc1	ZINC001753272423	1440345640	/nfs/dbraw/zinc/34/56/40/1440345640.db2.gz	MRSJTOUZUNDJHF-KRWDZBQOSA-N	0	3	341.430	3.129	20	30		EGEDHN
C#CCCN[C@H](CNC(=O)C1=COCCC1)c1ccc(C(C)C)cc1	ZINC001753294843	1440352046	/nfs/dbraw/zinc/35/20/46/1440352046.db2.gz	WLRUTAFVSPXTPV-HXUWFJFHSA-N	0	3	340.467	3.275	20	30		EGEDHN
C=CCN[C@@H](CNC(=O)C(C)(C)C1CCOCC1)c1ccccc1	ZINC001753300622	1440353962	/nfs/dbraw/zinc/35/39/62/1440353962.db2.gz	XHEYBBBOISCEPO-SFHVURJKSA-N	0	3	330.472	3.072	20	30		EGEDHN
CC(C)N(CC#Cc1ccccc1)CCCNC(=O)[C@H]1CC12CCC2	ZINC001753301003	1440354024	/nfs/dbraw/zinc/35/40/24/1440354024.db2.gz	UCZPPWHLVCLEPG-HXUWFJFHSA-N	0	3	338.495	3.445	20	30		EGEDHN
C=C(C)CN[C@H](CNC(=O)[C@@H](C)Cc1ccco1)c1ccccc1	ZINC001753314426	1440358446	/nfs/dbraw/zinc/35/84/46/1440358446.db2.gz	ZOZGRMUNYNOBIY-QFBILLFUSA-N	0	3	326.440	3.481	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)NCC[C@H]1CCN(Cc2ccc(F)c(C#N)c2)C1	ZINC001753333098	1440370602	/nfs/dbraw/zinc/37/06/02/1440370602.db2.gz	BQCLHYPNXUZUIF-KBXCAEBGSA-N	0	3	349.425	3.020	20	30		EGEDHN
C#CCC1(C(=O)NCC2CN(CC3CC(F)(F)C3)C2)CCCCC1	ZINC001753416019	1440394484	/nfs/dbraw/zinc/39/44/84/1440394484.db2.gz	UQAQXHJQRKPJKZ-UHFFFAOYSA-N	0	3	338.442	3.054	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C/C=C\c1ccc(F)cc1	ZINC001753422236	1440395626	/nfs/dbraw/zinc/39/56/26/1440395626.db2.gz	OQIBCYLUKUCYIT-FPXQDXNASA-N	0	3	328.431	3.480	20	30		EGEDHN
C=CCCCN1C[C@@H]2C[C@H]1CN2C(=O)c1cc(F)cc2cccnc21	ZINC001753425032	1440396415	/nfs/dbraw/zinc/39/64/15/1440396415.db2.gz	MQBFJTBGGZXXQV-IRXDYDNUSA-N	0	3	339.414	3.239	20	30		EGEDHN
CCCCCCCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H]1COc2ccccc21	ZINC001753427577	1440397296	/nfs/dbraw/zinc/39/72/96/1440397296.db2.gz	MHHVFBYEFNLECX-JENIJYKNSA-N	0	3	342.483	3.418	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)N(C)[C@H]1CCN(Cc2ccc(C(C)C)cc2)C1	ZINC001753434171	1440399561	/nfs/dbraw/zinc/39/95/61/1440399561.db2.gz	AZMBATBDGXILPI-FPOVZHCZSA-N	0	3	344.499	3.170	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N(C)[C@H]1CCN(CCOCc2ccccc2)C1	ZINC001753444387	1440402960	/nfs/dbraw/zinc/40/29/60/1440402960.db2.gz	QBSWUNBJNHYQJD-FPOVZHCZSA-N	0	3	344.499	3.338	20	30		EGEDHN
C=C(C)CCC(=O)N(CC)[C@H]1CCN(C[C@@H](O)c2ccc(F)cc2)C1	ZINC001753457128	1440408725	/nfs/dbraw/zinc/40/87/25/1440408725.db2.gz	KEZHYERXWUZRIG-RBUKOAKNSA-N	0	3	348.462	3.138	20	30		EGEDHN
C=C(C)CCC(=O)N(CC)[C@@H]1CCN(C[C@H](O)c2ccc(F)cc2)C1	ZINC001753457126	1440408730	/nfs/dbraw/zinc/40/87/30/1440408730.db2.gz	KEZHYERXWUZRIG-MOPGFXCFSA-N	0	3	348.462	3.138	20	30		EGEDHN
CC[C@H](CNC(=O)[C@H](C)C1CC1)NCC#Cc1ccccc1Cl	ZINC001753469101	1440413470	/nfs/dbraw/zinc/41/34/70/1440413470.db2.gz	TZBUXQLKTKAYJC-RHSMWYFYSA-N	0	3	332.875	3.222	20	30		EGEDHN
CC[C@H](CNC(=O)c1ccoc1Cl)NCC#Cc1ccccc1	ZINC001753472251	1440414362	/nfs/dbraw/zinc/41/43/62/1440414362.db2.gz	CQWGKBJBEDNGKY-OAHLLOKOSA-N	0	3	330.815	3.083	20	30		EGEDHN
CC[C@H](CNC(=O)c1cc(F)ccc1F)NCC#Cc1ccccc1	ZINC001753475911	1440415210	/nfs/dbraw/zinc/41/52/10/1440415210.db2.gz	BHJUFMAFNVVXOQ-QGZVFWFLSA-N	0	3	342.389	3.115	20	30		EGEDHN
CC[C@@H](CNC(=O)Cc1ccccc1C)NCC#Cc1ccccc1	ZINC001753495850	1440421518	/nfs/dbraw/zinc/42/15/18/1440421518.db2.gz	ZHSJBDJLXSCAPQ-NRFANRHFSA-N	0	3	334.463	3.074	20	30		EGEDHN
C=C/C(C)=C\CC(=O)NC1(CNCC(=C)Br)CCCC1	ZINC001753507178	1440424706	/nfs/dbraw/zinc/42/47/06/1440424706.db2.gz	OZYMANCFIGLBCQ-QPEQYQDCSA-N	0	3	341.293	3.436	20	30		EGEDHN
C#CCCCC(=O)N[C@@]1(CNCc2cncs2)CCCC[C@H]1C	ZINC001753532662	1440431497	/nfs/dbraw/zinc/43/14/97/1440431497.db2.gz	UKGSSKXCRQGXAU-CRAIPNDOSA-N	0	3	333.501	3.101	20	30		EGEDHN
Cc1cccnc1CNC[C@]1(NC(=O)C#CC(C)C)CCCC[C@@H]1C	ZINC001753532990	1440431589	/nfs/dbraw/zinc/43/15/89/1440431589.db2.gz	VXFXSHXZUDWRIS-GHTZIAJQSA-N	0	3	341.499	3.204	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](CCNCc2conc2CC)C1	ZINC001753552507	1440435327	/nfs/dbraw/zinc/43/53/27/1440435327.db2.gz	WUFOPRSKRLTEIF-OAHLLOKOSA-N	0	3	333.476	3.168	20	30		EGEDHN
C#CCCCC(=O)NCc1ccc(CNCc2cncc(C)c2)cc1	ZINC001753590106	1440442603	/nfs/dbraw/zinc/44/26/03/1440442603.db2.gz	AIOBKPRXIUHOFE-UHFFFAOYSA-N	0	3	335.451	3.100	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@H](CCC)c1ccccn1)CC2	ZINC001753674939	1440463080	/nfs/dbraw/zinc/46/30/80/1440463080.db2.gz	MCUHIBOZSNNYDI-GOSISDBHSA-N	0	3	341.499	3.466	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)N(C)C(=O)C[C@H]1C=CCCC1	ZINC001753698979	1440468144	/nfs/dbraw/zinc/46/81/44/1440468144.db2.gz	OECQULFHVPWSGT-CABCVRRESA-N	0	3	331.485	3.303	20	30		EGEDHN
Cc1cccc(CC(=O)N(C)[C@@H](C)CNCc2ccc(C#N)s2)c1	ZINC001753710433	1440470438	/nfs/dbraw/zinc/47/04/38/1440470438.db2.gz	OYKUMJLVJTVJCW-HNNXBMFYSA-N	0	3	341.480	3.107	20	30		EGEDHN
C[C@@H](C#N)C(=O)N[C@@H](CNCc1ccc(F)cc1F)C1CCCCC1	ZINC001753744679	1440480498	/nfs/dbraw/zinc/48/04/98/1440480498.db2.gz	MITMYFCROCCVOQ-UGSOOPFHSA-N	0	3	349.425	3.279	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H](CN[C@H](C)c1n[nH]c(C)n1)C1CCCCC1	ZINC001753747447	1440481483	/nfs/dbraw/zinc/48/14/83/1440481483.db2.gz	QWZFNXJBYVFBJQ-CJNGLKHVSA-N	0	3	347.507	3.041	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCCC[C@@H]1CCNCc1cc(C)ncn1	ZINC001753776112	1440486449	/nfs/dbraw/zinc/48/64/49/1440486449.db2.gz	AEULCQUWCLHWQF-GOSISDBHSA-N	0	3	344.503	3.248	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H](C)[C@H]1CNCc1ccnc(Cl)c1	ZINC001753818949	1440495021	/nfs/dbraw/zinc/49/50/21/1440495021.db2.gz	NYULBRNTJZCHBZ-DOTOQJQBSA-N	0	3	347.890	3.255	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@H](NCc2cnn(C(C)(C)C)c2)C(C)C)C1	ZINC001753838142	1440501692	/nfs/dbraw/zinc/50/16/92/1440501692.db2.gz	NYVKWPKZEUNIBU-QGZVFWFLSA-N	0	3	346.519	3.225	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N(C)CCN(C)Cc1ccc(CC)cc1	ZINC001753865320	1440514012	/nfs/dbraw/zinc/51/40/12/1440514012.db2.gz	PUVZBJVAHAYIMB-PMACEKPBSA-N	0	3	344.499	3.120	20	30		EGEDHN
C=C(Cl)CNCC[C@@H](C)NC(=O)C12CC(c3ccccc3)(C1)C2	ZINC001754025536	1440533135	/nfs/dbraw/zinc/53/31/35/1440533135.db2.gz	LXQWVUFJUKXQDP-VNCLNFNDSA-N	0	3	332.875	3.345	20	30		EGEDHN
CCN(CCNCc1ccc(Cl)c(Cl)c1)C(=O)C#CC1CC1	ZINC001754043760	1440534990	/nfs/dbraw/zinc/53/49/90/1440534990.db2.gz	CBJRPYWACFZQGA-UHFFFAOYSA-N	0	3	339.266	3.345	20	30		EGEDHN
CCc1ccc(C(=O)N(CC)CCNCc2ccc(C#N)s2)s1	ZINC001754056231	1440536278	/nfs/dbraw/zinc/53/62/78/1440536278.db2.gz	VQFZXYYTCCAKOH-UHFFFAOYSA-N	0	3	347.509	3.496	20	30		EGEDHN
CCN(CCNCc1ccc(C#N)s1)C(=O)c1cc(C)cc(F)c1	ZINC001754068680	1440537875	/nfs/dbraw/zinc/53/78/75/1440537875.db2.gz	URZXPEADUZFOLI-UHFFFAOYSA-N	0	3	345.443	3.319	20	30		EGEDHN
CCC(C)(CC)C(=O)NC/C=C/CNCc1ccc(C#N)c(F)c1	ZINC001754207520	1440550731	/nfs/dbraw/zinc/55/07/31/1440550731.db2.gz	CHZLXQSYVVOGDJ-VOTSOKGWSA-N	0	3	331.435	3.286	20	30		EGEDHN
C[C@H](CNCC#Cc1ccc(F)cc1)NC(=O)c1ccc2[nH]ccc2c1	ZINC001754240097	1440555522	/nfs/dbraw/zinc/55/55/22/1440555522.db2.gz	CKWFEFCXNVGYCF-OAHLLOKOSA-N	0	3	349.409	3.067	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)c(F)c1)NC(=O)[C@@H]1CCCC2(CC2)C1	ZINC001754267331	1440560769	/nfs/dbraw/zinc/56/07/69/1440560769.db2.gz	FYPVJJLXYIDNSS-GOEBONIOSA-N	0	3	343.446	3.262	20	30		EGEDHN
CC(C)c1nc(C(=O)N[C@@H](C)CNCC#Cc2ccccc2)cs1	ZINC001754288940	1440564548	/nfs/dbraw/zinc/56/45/48/1440564548.db2.gz	KSULSSHPUVIXQV-HNNXBMFYSA-N	0	3	341.480	3.026	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccc(C(F)F)cc1)NC(=O)c1ccc(C#N)[nH]1	ZINC001754305361	1440570523	/nfs/dbraw/zinc/57/05/23/1440570523.db2.gz	QTTCNCUZAHNMIG-LBPRGKRZSA-N	0	3	346.381	3.074	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H](C)CN(C)CCOc2cccc(C)c2)C1	ZINC001754325387	1440580332	/nfs/dbraw/zinc/58/03/32/1440580332.db2.gz	OOALPGCCEWMDIS-KRWDZBQOSA-N	0	3	330.472	3.167	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1CCCC[C@H]1CNCc1ncc(C)s1	ZINC001754339472	1440587796	/nfs/dbraw/zinc/58/77/96/1440587796.db2.gz	FIDNIWYNAFACDB-IRXDYDNUSA-N	0	3	347.528	3.410	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001754447309	1440600260	/nfs/dbraw/zinc/60/02/60/1440600260.db2.gz	BCZAMAKFMOSUJB-INIZCTEOSA-N	0	3	331.485	3.206	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)c3ccc(C4CC4)cc3)CC2)cc1	ZINC001754534509	1440623666	/nfs/dbraw/zinc/62/36/66/1440623666.db2.gz	RPYYUFYAHCMSKX-UHFFFAOYSA-N	0	3	345.446	3.488	20	30		EGEDHN
CC#CCN(CCOC)C1CCN(C(=O)C2(CC(C)C)CCC2)CC1	ZINC001754560113	1440633453	/nfs/dbraw/zinc/63/34/53/1440633453.db2.gz	ZILUJLCTVOELAQ-UHFFFAOYSA-N	0	3	348.531	3.166	20	30		EGEDHN
C=CCOCC(=O)N[C@]1(C)CCN(Cc2ccc(CC(C)C)cc2)C1	ZINC001754668345	1440657421	/nfs/dbraw/zinc/65/74/21/1440657421.db2.gz	JNPWHAMULNMJHD-OAQYLSRUSA-N	0	3	344.499	3.168	20	30		EGEDHN
C=CCOCCN1CC[C@@](C)(NC(=O)C/C=C\c2ccc(F)cc2)C1	ZINC001754675539	1440659785	/nfs/dbraw/zinc/65/97/85/1440659785.db2.gz	RAYJOEACCLFHMZ-BBIZLLLXSA-N	0	3	346.446	3.012	20	30		EGEDHN
CC/C=C(/C)C(=O)N1CC[C@](C)(CNCc2ccccc2C#N)C1	ZINC001754688767	1440665721	/nfs/dbraw/zinc/66/57/21/1440665721.db2.gz	BQGQXNBTADMYOE-XLMFOLKISA-N	0	3	325.456	3.243	20	30		EGEDHN
CC[C@@H](C)CC(=O)N1CC[C@](C)(CNCc2ccccc2C#N)C1	ZINC001754691758	1440666189	/nfs/dbraw/zinc/66/61/89/1440666189.db2.gz	CTBNXJUTMRUKNM-OXQOHEQNSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@](C)(CNCc2ccccc2C#N)C1	ZINC001754702971	1440668428	/nfs/dbraw/zinc/66/84/28/1440668428.db2.gz	ZDCWTMKMFPQYMZ-HXUWFJFHSA-N	0	3	325.456	3.099	20	30		EGEDHN
C[C@H](C#N)C(=O)NCC1(C)CCN(Cc2cccc(Cl)c2)CC1	ZINC001754715811	1440671408	/nfs/dbraw/zinc/67/14/08/1440671408.db2.gz	DTILIUNOYCRIJY-CQSZACIVSA-N	0	3	333.863	3.218	20	30		EGEDHN
C=C(Cl)CN1CCC(C)(CNC(=O)c2ccc(Cl)[nH]2)CC1	ZINC001754720472	1440672963	/nfs/dbraw/zinc/67/29/63/1440672963.db2.gz	PROKGJUSKBUFFZ-UHFFFAOYSA-N	0	3	330.259	3.253	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC2(C)CCN(Cc3oc(C)nc3C)CC2)C1	ZINC001754720905	1440673127	/nfs/dbraw/zinc/67/31/27/1440673127.db2.gz	VZYNZRPLUJHTNW-UHFFFAOYSA-N	0	3	345.487	3.366	20	30		EGEDHN
C=CCN1CCC[C@](C)(CNC(=O)[C@@H](C)n2cnc3ccccc32)C1	ZINC001754731409	1440679429	/nfs/dbraw/zinc/67/94/29/1440679429.db2.gz	GFKCTLKABSBLPG-OXQOHEQNSA-N	0	3	340.471	3.002	20	30		EGEDHN
C=CCN1CCC[C@](C)(CNC(=O)[C@@H](C)CCOc2ccccc2)C1	ZINC001754734667	1440681710	/nfs/dbraw/zinc/68/17/10/1440681710.db2.gz	PDOHERPKRUQKNM-GHTZIAJQSA-N	0	3	344.499	3.496	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H]([C@@H](C)NCc2csc(CC)n2)C1	ZINC001754801034	1440690374	/nfs/dbraw/zinc/69/03/74/1440690374.db2.gz	YFSDHEASJOSQBU-CABCVRRESA-N	0	3	335.517	3.388	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](C)[C@@H](CNCc2ccccc2C#N)C1	ZINC001754815467	1440692299	/nfs/dbraw/zinc/69/22/99/1440692299.db2.gz	RWOQVZGAVVXJCB-APWZRJJASA-N	0	3	339.483	3.345	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@H](C)[C@H](CNCc3cnc(C)o3)C2)CCCC1	ZINC001754828769	1440693972	/nfs/dbraw/zinc/69/39/72/1440693972.db2.gz	QLMZBFVKHMFBNM-DOTOQJQBSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@H]1CC[C@H](CNCc2nccs2)CC1	ZINC001754834699	1440696452	/nfs/dbraw/zinc/69/64/52/1440696452.db2.gz	VNCZTLJGAIWTIH-SHTZXODSSA-N	0	3	335.517	3.368	20	30		EGEDHN
C#CCCN(C)Cc1ccccc1CNC(=O)CC(F)(F)C(F)F	ZINC001754946309	1440713069	/nfs/dbraw/zinc/71/30/69/1440713069.db2.gz	DPIKFCCSHXRALF-UHFFFAOYSA-N	0	3	344.352	3.048	20	30		EGEDHN
C#CCN[C@@H](C)c1ccc(CNC(=O)[C@H](OCC)C2CCCC2)cc1	ZINC001754949083	1440714368	/nfs/dbraw/zinc/71/43/68/1440714368.db2.gz	VXXNHRWQMJHHJV-OXJNMPFZSA-N	0	3	342.483	3.182	20	30		EGEDHN
C=CCN(C)Cc1ccccc1CNC(=O)COc1cccc(C)c1	ZINC001754954349	1440715880	/nfs/dbraw/zinc/71/58/80/1440715880.db2.gz	QZACUSYAHCQGGG-UHFFFAOYSA-N	0	3	338.451	3.308	20	30		EGEDHN
C=C(C)CN(C)Cc1ccccc1CNC(=O)CCc1nccs1	ZINC001754954202	1440715970	/nfs/dbraw/zinc/71/59/70/1440715970.db2.gz	NSPGCTXFDVKUPV-UHFFFAOYSA-N	0	3	343.496	3.400	20	30		EGEDHN
C=CCN(C)Cc1ccccc1CNC(=O)c1ccc(COC)cc1	ZINC001754955250	1440716305	/nfs/dbraw/zinc/71/63/05/1440716305.db2.gz	YNDMQJGMVGMXPQ-UHFFFAOYSA-N	0	3	338.451	3.381	20	30		EGEDHN
CC/C=C(/C)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001754958407	1440716999	/nfs/dbraw/zinc/71/69/99/1440716999.db2.gz	GPQMQPLJROQRJF-ZWSORDCHSA-N	0	3	337.467	3.339	20	30		EGEDHN
CC(C)C#CC(=O)N1CC2(C1)CCN(Cc1cccc(Cl)c1)CC2	ZINC001754962384	1440717901	/nfs/dbraw/zinc/71/79/01/1440717901.db2.gz	ZZOMLQLSKPNNSD-UHFFFAOYSA-N	0	3	344.886	3.424	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](N2CCN(CCCC(C)C)CC2)C1	ZINC001755020078	1440726734	/nfs/dbraw/zinc/72/67/34/1440726734.db2.gz	XQIKCWDCOBOVAW-IBGZPJMESA-N	0	3	349.563	3.243	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@H]1Cc2ccccc2CN1C[C@@H](CC)OC	ZINC001755075374	1440748305	/nfs/dbraw/zinc/74/83/05/1440748305.db2.gz	FKGPLDROSQYKDX-WOJBJXKFSA-N	0	3	344.499	3.311	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)CCCOc2ccc(F)cc2)C(C)(C)C1	ZINC001755140677	1440759988	/nfs/dbraw/zinc/75/99/88/1440759988.db2.gz	CBFUEVWZCXOCAA-GOSISDBHSA-N	0	3	348.462	3.387	20	30		EGEDHN
C=CCN1CCN(CCCCCNC(=O)c2cc(C)cc(C)c2)CC1	ZINC001755175067	1440770472	/nfs/dbraw/zinc/77/04/72/1440770472.db2.gz	FPSZNGABJWVRDX-UHFFFAOYSA-N	0	3	343.515	3.007	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1Cc2ccccc2[C@H]1NC[C@@H](OC)C1CCC1	ZINC001755185912	1440773222	/nfs/dbraw/zinc/77/32/22/1440773222.db2.gz	YLOJGSHYOUDYFC-SFHLNBCPSA-N	0	3	342.483	3.140	20	30		EGEDHN
CN(CCOC1CCCCCC1)C[C@H]1CCCN1C(=O)C#CC1CC1	ZINC001755192507	1440775314	/nfs/dbraw/zinc/77/53/14/1440775314.db2.gz	GUWCOHSOSNTKQW-LJQANCHMSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=CCN(C)C[C@@H]1CCCN1C(=O)CCc1ccc(OCC)cc1	ZINC001755193705	1440775826	/nfs/dbraw/zinc/77/58/26/1440775826.db2.gz	DZNXTQJPFKWOIP-SFHVURJKSA-N	0	3	330.472	3.127	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H](C)[C@@H](C)NCC(=O)Nc1ccc(C)cc1	ZINC001755257294	1440793542	/nfs/dbraw/zinc/79/35/42/1440793542.db2.gz	MOOCSCXXPBZVAG-HZPDHXFCSA-N	0	3	345.487	3.019	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)COc1ccc(CC)cc1	ZINC001755367058	1440835048	/nfs/dbraw/zinc/83/50/48/1440835048.db2.gz	BVWMIHPPOVTQLY-LJQANCHMSA-N	0	3	342.483	3.012	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CC[C@H](NC(=O)C3(C(F)F)CCC3)C[C@@H]2C1	ZINC001755453893	1440854777	/nfs/dbraw/zinc/85/47/77/1440854777.db2.gz	UHFLTJIZSUONPB-MJBXVCDLSA-N	0	3	346.849	3.391	20	30		EGEDHN
C[C@@H](CCCNCc1ccccc1C#N)NC(=O)Cc1ccsc1	ZINC001755486857	1440860881	/nfs/dbraw/zinc/86/08/81/1440860881.db2.gz	ULQWSECTDHAKOI-HNNXBMFYSA-N	0	3	341.480	3.237	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(N(C)Cc3conc3C)CC2)CCC1	ZINC001755533461	1440868315	/nfs/dbraw/zinc/86/83/15/1440868315.db2.gz	SGTPREDGMZMQGM-UHFFFAOYSA-N	0	3	331.460	3.152	20	30		EGEDHN
C=C(C)CCC(=O)N(C)[C@@H](CNCc1cnc(Cl)s1)C1CC1	ZINC001755562058	1440874755	/nfs/dbraw/zinc/87/47/55/1440874755.db2.gz	GGXFJLGRNDBEPK-AWEZNQCLSA-N	0	3	341.908	3.479	20	30		EGEDHN
C=C1CCC(C(=O)N(C)C[C@H](C)NCc2ccc(C#N)c(F)c2)CC1	ZINC001755604997	1440885100	/nfs/dbraw/zinc/88/51/00/1440885100.db2.gz	GFIHGBAMHNMGMY-HNNXBMFYSA-N	0	3	343.446	3.380	20	30		EGEDHN
C#CCOc1ccc(C(=O)N(C)C[C@@H](C)NCc2ccsc2)cc1	ZINC001755608510	1440886388	/nfs/dbraw/zinc/88/63/88/1440886388.db2.gz	CVOFVNVJJLTDOB-OAHLLOKOSA-N	0	3	342.464	3.010	20	30		EGEDHN
C[C@@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)CC1CC(F)(F)C1	ZINC001755655910	1440891974	/nfs/dbraw/zinc/89/19/74/1440891974.db2.gz	DSNFQYQJJZBQGW-QAPCUYQASA-N	0	3	346.421	3.053	20	30		EGEDHN
C[C@H]1[C@H](NCC#Cc2ccc(F)cc2)CCN1C(=O)CCCC1CC1	ZINC001755659313	1440892531	/nfs/dbraw/zinc/89/25/31/1440892531.db2.gz	QPCYBTWXFRHVCM-OXJNMPFZSA-N	0	3	342.458	3.337	20	30		EGEDHN
C#CCCCC(=O)N1C[C@H](NCc2ccc(F)c(Cl)c2)C[C@@H]1C	ZINC001755673517	1440894176	/nfs/dbraw/zinc/89/41/76/1440894176.db2.gz	ILGTXPXAVDQPEF-DZGCQCFKSA-N	0	3	336.838	3.362	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](NCc2cn(C(C)C)nc2C)C[C@H]1C	ZINC001755673801	1440894307	/nfs/dbraw/zinc/89/43/07/1440894307.db2.gz	BQRCQPSYODLKGG-QAPCUYQASA-N	0	3	332.492	3.208	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@@]12CCC[C@H]1N(CCc1ccccc1Cl)CC2	ZINC001755696090	1440897934	/nfs/dbraw/zinc/89/79/34/1440897934.db2.gz	KTMZJTMBPRKUEG-LSBZLQRGSA-N	0	3	345.874	3.155	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CC[C@H](CNCc3nccs3)C2)CCC1	ZINC001755742266	1440911931	/nfs/dbraw/zinc/91/19/31/1440911931.db2.gz	CJNQXVIVLJHKEY-LSDHHAIUSA-N	0	3	333.501	3.264	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](NCC#Cc2ccccc2)C(C)(C)C1	ZINC001755760206	1440914819	/nfs/dbraw/zinc/91/48/19/1440914819.db2.gz	ISXJUGYKZKSRBY-LJQANCHMSA-N	0	3	338.495	3.467	20	30		EGEDHN
C#CCCN(C)CCN(C(=O)C[C@H]1CCc2ccccc21)C(C)C	ZINC001755814650	1440922605	/nfs/dbraw/zinc/92/26/05/1440922605.db2.gz	JSUIXUNGXAZDGQ-LJQANCHMSA-N	0	3	326.484	3.299	20	30		EGEDHN
C=C(C)CN(C)CCN(C(=O)[C@@H]1[C@@H]2Cc3ccccc3[C@@H]21)C(C)C	ZINC001755814696	1440922690	/nfs/dbraw/zinc/92/26/90/1440922690.db2.gz	LRMFNZJYCJIGPO-HSALFYBXSA-N	0	3	326.484	3.317	20	30		EGEDHN
C=C(Br)CNC[C@@H](NC(=O)[C@@]1(C)C=CCC1)C(C)(C)C	ZINC001755829520	1440928314	/nfs/dbraw/zinc/92/83/14/1440928314.db2.gz	DIKQCALQONULOR-CJNGLKHVSA-N	0	3	343.309	3.372	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H](CNCc1cnc(C)nc1)C(C)(C)C	ZINC001755831263	1440928652	/nfs/dbraw/zinc/92/86/52/1440928652.db2.gz	WIDPBKUJSVVGCF-RDJZCZTQSA-N	0	3	332.492	3.008	20	30		EGEDHN
C#CCN1CCC([C@@H](C)NC(=O)Cc2coc3ccc(C)cc23)CC1	ZINC001755843705	1440932375	/nfs/dbraw/zinc/93/23/75/1440932375.db2.gz	SKFJYHPQRDBLSS-MRXNPFEDSA-N	0	3	338.451	3.134	20	30		EGEDHN
CC[C@@H](C)C(=O)N(C)C1CC(NCC#Cc2ccccc2Cl)C1	ZINC001755853023	1440935372	/nfs/dbraw/zinc/93/53/72/1440935372.db2.gz	IPTAFUMELXKMRI-ODIFPOPNSA-N	0	3	332.875	3.317	20	30		EGEDHN
C/C(=C/C(=O)N(C)C1CC(NCC#Cc2ccc(F)cc2)C1)C1CC1	ZINC001755854292	1440935641	/nfs/dbraw/zinc/93/56/41/1440935641.db2.gz	GHFJMUIAAZKJGN-QINSGFPZSA-N	0	3	340.442	3.113	20	30		EGEDHN
C=C(Cl)CNC1CC(N(C)C(=O)COc2ccccc2Cl)C1	ZINC001755864781	1440937551	/nfs/dbraw/zinc/93/75/51/1440937551.db2.gz	BFMXORCMYSHHSK-UHFFFAOYSA-N	0	3	343.254	3.050	20	30		EGEDHN
C=C(Cl)CNC1CC(N(C)C(=O)CCc2nc3ccccc3o2)C1	ZINC001755865182	1440937707	/nfs/dbraw/zinc/93/77/07/1440937707.db2.gz	SHYGVEJAOKUCHY-UHFFFAOYSA-N	0	3	347.846	3.092	20	30		EGEDHN
CC#CCN1CCC(C2(NC(=O)[C@H](C)c3cccc(F)c3)CC2)CC1	ZINC001755869579	1440938756	/nfs/dbraw/zinc/93/87/56/1440938756.db2.gz	KOKMHYICYOZWEX-MRXNPFEDSA-N	0	3	342.458	3.313	20	30		EGEDHN
C=C(C)C[NH2+]Cc1ccc(CNC(=O)c2ccccc2[O-])c(F)c1	ZINC001755900587	1440943834	/nfs/dbraw/zinc/94/38/34/1440943834.db2.gz	LIGDERAZQTZJII-UHFFFAOYSA-N	0	3	328.387	3.127	20	30		EGEDHN
C=CCNCc1ccc(CNC(=O)c2sc(C)cc2OC)c(F)c1	ZINC001755901775	1440944188	/nfs/dbraw/zinc/94/41/88/1440944188.db2.gz	CXAMCEYMIYLQND-UHFFFAOYSA-N	0	3	348.443	3.410	20	30		EGEDHN
Cc1ccc(C#N)c(N2C[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C2)n1	ZINC000368130298	168314773	/nfs/dbraw/zinc/31/47/73/168314773.db2.gz	AOCSWDFUJCKVGE-VQTJNVASSA-N	0	3	332.451	3.220	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Cc1cnccc1Cl)C(C)C	ZINC000298572130	202333909	/nfs/dbraw/zinc/33/39/09/202333909.db2.gz	IYIWDZPLKRVROE-KRWDZBQOSA-N	0	3	335.879	3.092	20	30		EGEDHN
C#CCN1CCC(C(=O)NC(c2cccs2)c2cccs2)CC1	ZINC000078189006	201185571	/nfs/dbraw/zinc/18/55/71/201185571.db2.gz	XBEFGRCFXILUPC-UHFFFAOYSA-N	0	3	344.505	3.360	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2nnc(-c3ccsc3)s2)CC1	ZINC000264399628	201210077	/nfs/dbraw/zinc/21/00/77/201210077.db2.gz	ZDDJBVJSBNCVMH-UHFFFAOYSA-N	0	3	349.485	3.039	20	30		EGEDHN
C#CCOc1ccc(CN[C@@H](C)c2ccc3c(c2)CC(=O)N3C)cc1	ZINC000264962140	201213739	/nfs/dbraw/zinc/21/37/39/201213739.db2.gz	OMLJHZMQXZHFOJ-HNNXBMFYSA-N	0	3	334.419	3.068	20	30		EGEDHN
Cc1nnc(N[C@H]2CCN(Cc3ccccc3)C[C@H]2C)c(C#N)c1C	ZINC000267208739	201223345	/nfs/dbraw/zinc/22/33/45/201223345.db2.gz	LGFKYWZEWILRSI-KUHUBIRLSA-N	0	3	335.455	3.288	20	30		EGEDHN
C=CCCOCCN[C@@H](C)c1ccc(OC)c(Cn2cccn2)c1	ZINC000271534139	201244773	/nfs/dbraw/zinc/24/47/73/201244773.db2.gz	PZTMWBLMGDZWOL-INIZCTEOSA-N	0	3	329.444	3.183	20	30		EGEDHN
C[C@H](NC[C@@H]1CN(Cc2ccccc2)CCO1)c1cccc(C#N)c1	ZINC000271785796	201246524	/nfs/dbraw/zinc/24/65/24/201246524.db2.gz	GZPPLVKJQIEDHW-LAUBAEHRSA-N	0	3	335.451	3.110	20	30		EGEDHN
C=CCN1CCC(Nc2nc(-c3cccnc3)nc3c2CCC3)CC1	ZINC000269020982	201229129	/nfs/dbraw/zinc/22/91/29/201229129.db2.gz	FARBPHDHUHGCII-UHFFFAOYSA-N	0	3	335.455	3.090	20	30		EGEDHN
C=CCN1CCC(NC(=O)CCOc2ccccc2C(C)C)CC1	ZINC000269759289	201233173	/nfs/dbraw/zinc/23/31/73/201233173.db2.gz	WNWHIMXGKTUMIB-UHFFFAOYSA-N	0	3	330.472	3.346	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C)OCC	ZINC000270204406	201237557	/nfs/dbraw/zinc/23/75/57/201237557.db2.gz	QWGFXWCOMSWSNR-RLLQIKCJSA-N	0	3	344.499	3.385	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@@]1(C)CCO[C@H]1C1CC1	ZINC000273077416	201253959	/nfs/dbraw/zinc/25/39/59/201253959.db2.gz	PVRUTALQZWKRSC-OALUTQOASA-N	0	3	346.496	3.450	20	30		EGEDHN
C=CCS(=O)(=O)CCN[C@@H](CC)c1ccc2cc(OC)ccc2c1	ZINC000272888042	201258290	/nfs/dbraw/zinc/25/82/90/201258290.db2.gz	SCODJDNRWZFRQC-IBGZPJMESA-N	0	3	347.480	3.490	20	30		EGEDHN
C#CCCCCc1nc(-c2ccc3c(c2)C(SC)C(=O)N3)no1	ZINC000274061880	201265696	/nfs/dbraw/zinc/26/56/96/201265696.db2.gz	WBHXNZPIIGALKT-HNNXBMFYSA-N	0	3	327.409	3.439	20	30		EGEDHN
Cn1cc(CNCc2cccc(COCC(F)(F)F)c2)cc1C#N	ZINC000191463649	239129043	/nfs/dbraw/zinc/12/90/43/239129043.db2.gz	IBWKLBXYKHTCEI-UHFFFAOYSA-N	0	3	337.345	3.265	20	30		EGEDHN
C=CCC[C@H](CC)N[C@H](C(N)=O)c1cccc(Br)c1	ZINC000279592171	201319520	/nfs/dbraw/zinc/31/95/20/201319520.db2.gz	CRKXYBYLGCYGMG-KBPBESRZSA-N	0	3	325.250	3.310	20	30		EGEDHN
C=CCC[C@@H](O)CN1CCC(O)(c2ccccc2C(F)(F)F)CC1	ZINC000278868138	201311883	/nfs/dbraw/zinc/31/18/83/201311883.db2.gz	SLIKIYRODLKEHZ-CQSZACIVSA-N	0	3	343.389	3.316	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1C(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1	ZINC000278981628	201312679	/nfs/dbraw/zinc/31/26/79/201312679.db2.gz	DPRYBCWZNWUOIP-MISYRCLQSA-N	0	3	342.483	3.091	20	30		EGEDHN
CN(C)CCN(C)C(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1	ZINC000072309882	203199750	/nfs/dbraw/zinc/19/97/50/203199750.db2.gz	CECKCXXREDIPRG-UHFFFAOYSA-N	0	3	338.411	3.376	20	30		EGEDHN
COc1ccc(CN(C)CCOc2ccc(C#N)cc2OC)cc1	ZINC000077247162	203375262	/nfs/dbraw/zinc/37/52/62/203375262.db2.gz	JYDJFSPCHXKEAC-UHFFFAOYSA-N	0	3	326.396	3.086	20	30		EGEDHN
C[C@@H](C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1)c1cccs1	ZINC000078069933	203410024	/nfs/dbraw/zinc/41/00/24/203410024.db2.gz	UZFPQKAWQVSRQI-OAHLLOKOSA-N	0	3	341.480	3.314	20	30		EGEDHN
C=CCOCCCC(=O)NCC1CCN(Cc2cccs2)CC1	ZINC000079815868	217256000	/nfs/dbraw/zinc/25/60/00/217256000.db2.gz	GAXVJRZNHRGOKH-UHFFFAOYSA-N	0	3	336.501	3.059	20	30		EGEDHN
C[C@H](NC(=O)C(C#N)Cc1ccc(C#N)cc1)c1ccc(F)cc1F	ZINC000348009352	257930859	/nfs/dbraw/zinc/93/08/59/257930859.db2.gz	YSXSOAOURXBANA-SWLSCSKDSA-N	0	3	339.345	3.396	20	30		EGEDHN
C[C@@H](NCCCS(=O)(=O)c1ccc(F)cc1)c1ccc(C#N)cc1	ZINC000338367725	141108862	/nfs/dbraw/zinc/10/88/62/141108862.db2.gz	VNLYTVKUZCMIEM-CQSZACIVSA-N	0	3	346.427	3.212	20	30		EGEDHN
COCC#CCN(Cc1ccc(OC)c(OC)c1)C1CCCCC1	ZINC000677819172	549337721	/nfs/dbraw/zinc/33/77/21/549337721.db2.gz	TTZPJLCMUHVMRB-UHFFFAOYSA-N	0	3	331.456	3.488	20	30		EGEDHN
CN(CCCc1cc(-c2ccccc2)n[nH]1)Cc1cc(C#N)n(C)c1	ZINC000191259128	153185161	/nfs/dbraw/zinc/18/51/61/153185161.db2.gz	PZFZPPNDABPPRB-UHFFFAOYSA-N	0	3	333.439	3.351	20	30		EGEDHN
Cn1cc(CN[C@@H]2CCN(C)[C@@H]2c2ccc(Cl)cc2)cc1C#N	ZINC000191500537	153201861	/nfs/dbraw/zinc/20/18/61/153201861.db2.gz	BINCBMQJNFZCFW-QZTJIDSGSA-N	0	3	328.847	3.085	20	30		EGEDHN
C[C@H](N[C@H]1CCCC[C@H]1OC(F)F)C(=O)Nc1ccccc1C#N	ZINC000337373814	154317454	/nfs/dbraw/zinc/31/74/54/154317454.db2.gz	ADYSRSOMRVKSBN-TUKIKUTGSA-N	0	3	337.370	3.025	20	30		EGEDHN
CCN(C[C@H]1CCN(Cc2cc(C#N)cs2)C1)CC(F)(F)F	ZINC000093771198	162025031	/nfs/dbraw/zinc/02/50/31/162025031.db2.gz	AESXVOSSLBTTKI-GFCCVEGCSA-N	0	3	331.407	3.326	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN1CC[C@@H](c2ccccc2)C1	ZINC000123357922	162255521	/nfs/dbraw/zinc/25/55/21/162255521.db2.gz	XVVCEFLGHFNUNF-MRXNPFEDSA-N	0	3	325.437	3.438	20	30		EGEDHN
Cc1c(Cl)cnc(N(C)CCCN(C)Cc2ccco2)c1C#N	ZINC000343759191	164027973	/nfs/dbraw/zinc/02/79/73/164027973.db2.gz	HMZIZPNWINQNRP-UHFFFAOYSA-N	0	3	332.835	3.466	20	30		EGEDHN
CN(CCOCc1ccc(C#N)cc1)CCC(=O)Nc1ccccc1	ZINC000344061627	164094217	/nfs/dbraw/zinc/09/42/17/164094217.db2.gz	ALQBVSHWCILDTK-UHFFFAOYSA-N	0	3	337.423	3.035	20	30		EGEDHN
CCN(CCN1CCCCCC1)C(=O)[C@@H](C)Oc1ccc(C#N)cc1	ZINC000346350436	164373316	/nfs/dbraw/zinc/37/33/16/164373316.db2.gz	RQCGYMRZLOIPJJ-QGZVFWFLSA-N	0	3	343.471	3.050	20	30		EGEDHN
N#Cc1ccc(OC[C@H]2CN(Cc3ccccc3)CCCO2)cc1F	ZINC000351896999	165140363	/nfs/dbraw/zinc/14/03/63/165140363.db2.gz	KDMKRYYGEQARMB-LJQANCHMSA-N	0	3	340.398	3.367	20	30		EGEDHN
CN(C)Cc1ccc(-c2noc(CNc3ccc(C#N)cc3)n2)cc1	ZINC000355598772	166256371	/nfs/dbraw/zinc/25/63/71/166256371.db2.gz	QNMHFSRWIJIZIG-UHFFFAOYSA-N	0	3	333.395	3.282	20	30		EGEDHN
CN(C)CCN(C)C(=O)c1ccc(Oc2cccc(F)c2C#N)cc1	ZINC000359588534	167202027	/nfs/dbraw/zinc/20/20/27/167202027.db2.gz	IJKRSTHOJBGUDE-UHFFFAOYSA-N	0	3	341.386	3.123	20	30		EGEDHN
COc1ccc(CN[C@H](C)[C@H]2OCCc3sccc32)cc1C#N	ZINC000291762311	269782435	/nfs/dbraw/zinc/78/24/35/269782435.db2.gz	RQDXRNGPQQQFAA-KZULUSFZSA-N	0	3	328.437	3.420	20	30		EGEDHN
CSc1ccc([C@@H](CNC(=O)c2cc(C#N)cs2)N(C)C)cc1	ZINC000294966977	270042376	/nfs/dbraw/zinc/04/23/76/270042376.db2.gz	SRQBBUYXCQPJIE-OAHLLOKOSA-N	0	3	345.493	3.374	20	30		EGEDHN
N#Cc1ccc(CN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)cc1	ZINC000299635407	270043750	/nfs/dbraw/zinc/04/37/50/270043750.db2.gz	MDCKMRCXBFHWMK-UHFFFAOYSA-N	0	3	344.418	3.281	20	30		EGEDHN
CCN1CCN(c2cccc(NCc3ccc(C#N)c(F)c3)c2)CC1	ZINC000421349005	270048612	/nfs/dbraw/zinc/04/86/12/270048612.db2.gz	WZAFJOUKLDPOIG-UHFFFAOYSA-N	0	3	338.430	3.451	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)cc1F	ZINC000453383824	270053604	/nfs/dbraw/zinc/05/36/04/270053604.db2.gz	MUCMLJLDMXKLBC-CVEARBPZSA-N	0	3	343.362	3.076	20	30		EGEDHN
N#Cc1cccc(COc2cccc(CNCCN3CC=CCC3)c2)c1	ZINC000475502710	270055747	/nfs/dbraw/zinc/05/57/47/270055747.db2.gz	PHYKEPHDWIUPIW-UHFFFAOYSA-N	0	3	347.462	3.489	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CN1CCC(c2ccsc2)CC1	ZINC000528457694	270059992	/nfs/dbraw/zinc/05/99/92/270059992.db2.gz	GDUGOWIJXCBJJV-SFHVURJKSA-N	0	3	342.464	3.239	20	30		EGEDHN
N#Cc1ccc(N2CC[C@@H](N3CC[C@@H](Cc4ccccc4)C3)C2=O)cc1	ZINC000533293199	270060687	/nfs/dbraw/zinc/06/06/87/270060687.db2.gz	BNRBJSKYEPYFDK-PZJWPPBQSA-N	0	3	345.446	3.228	20	30		EGEDHN
COc1ccc2c(c1)CCN(CCCOc1cccc(C#N)c1)CC2	ZINC000534103507	270061213	/nfs/dbraw/zinc/06/12/13/270061213.db2.gz	BHCDDJUOCPNZIH-UHFFFAOYSA-N	0	3	336.435	3.437	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@H](CCNCc2ccc(C#N)o2)C1	ZINC000174372208	265711238	/nfs/dbraw/zinc/71/12/38/265711238.db2.gz	OJEOVUCMVHWJOP-CQSZACIVSA-N	0	3	333.432	3.278	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@@H]1CCNCc1ccc(C#N)s1	ZINC000227643432	266201313	/nfs/dbraw/zinc/20/13/13/266201313.db2.gz	MBCVARRVLCTJOU-CYBMUJFWSA-N	0	3	335.473	3.499	20	30		EGEDHN
CN(Cc1cc(F)cc(F)c1)C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000348514052	266559725	/nfs/dbraw/zinc/55/97/25/266559725.db2.gz	ZJJSWLPRSZMFFD-INIZCTEOSA-N	0	3	339.345	3.177	20	30		EGEDHN
COc1cc(OC)cc([C@H](O)CN[C@@H](C)c2ccc(C#N)c(F)c2)c1	ZINC000271969358	266844605	/nfs/dbraw/zinc/84/46/05/266844605.db2.gz	UBRTYDUVFNOPLX-HXPMCKFVSA-N	0	3	344.386	3.099	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)C[C@@H](O)COc1ccccc1F	ZINC000515410913	267015523	/nfs/dbraw/zinc/01/55/23/267015523.db2.gz	JZKJYHNDWXFFNM-GOSISDBHSA-N	0	3	342.414	3.349	20	30		EGEDHN
CCOC(=O)N1CCC[C@@H]([C@@H](C)NCc2cccc(C#N)c2F)C1	ZINC000495486513	267122375	/nfs/dbraw/zinc/12/23/75/267122375.db2.gz	HTNLGQGZILSLLM-CZUORRHYSA-N	0	3	333.407	3.044	20	30		EGEDHN
C[C@H](NC(=O)C(C#N)Cc1ccc(C#N)cc1)c1ccc(Cl)cn1	ZINC000338902652	267177349	/nfs/dbraw/zinc/17/73/49/267177349.db2.gz	KPBYIYYAGOLBIK-WFASDCNBSA-N	0	3	338.798	3.166	20	30		EGEDHN
CC[C@@H](N[C@H](C)C(=O)NCCc1ccccc1)c1ccc(C#N)cc1	ZINC000453408916	267197940	/nfs/dbraw/zinc/19/79/40/267197940.db2.gz	NYTVAFZMBOJMNW-OXQOHEQNSA-N	0	3	335.451	3.346	20	30		EGEDHN
C[C@]1(NCc2ccc(C#N)cc2Br)CCO[C@@H]1C1CC1	ZINC000273097787	267263556	/nfs/dbraw/zinc/26/35/56/267263556.db2.gz	UXXRPFIPVLUTDV-CVEARBPZSA-N	0	3	335.245	3.368	20	30		EGEDHN
CN(C)CC1(NC(=O)Nc2ccc(OC(C)(C)C)c(C#N)c2)CCC1	ZINC000455770358	267278880	/nfs/dbraw/zinc/27/88/80/267278880.db2.gz	MTNIJRQXXWWLDU-UHFFFAOYSA-N	0	3	344.459	3.341	20	30		EGEDHN
CN(C)CCOc1cccc(NC(=O)/C=C\c2cccc(C#N)c2)c1	ZINC000491119001	267280473	/nfs/dbraw/zinc/28/04/73/267280473.db2.gz	MSXALUPLWOINKP-KTKRTIGZSA-N	0	3	335.407	3.151	20	30		EGEDHN
CN(C)CCc1ccccc1NC(=O)NCCc1cccc(C#N)c1	ZINC000439397091	267281565	/nfs/dbraw/zinc/28/15/65/267281565.db2.gz	ZYGCTCUYYQQBGY-UHFFFAOYSA-N	0	3	336.439	3.027	20	30		EGEDHN
CN(Cc1ccc(CN2CCOCC2)cc1)Cc1cccc(C#N)c1	ZINC000420906814	267314977	/nfs/dbraw/zinc/31/49/77/267314977.db2.gz	TYSYREFKQWGFHU-UHFFFAOYSA-N	0	3	335.451	3.022	20	30		EGEDHN
CN1CCC(Oc2ccc(NCc3ccc(C#N)c(F)c3)cn2)CC1	ZINC000421341042	267334251	/nfs/dbraw/zinc/33/42/51/267334251.db2.gz	KLUCLUXIZDGJKV-UHFFFAOYSA-N	0	3	340.402	3.177	20	30		EGEDHN
C[C@@H](NCCC(=O)N1CCc2ccccc2C1)c1ccc(C#N)cc1	ZINC000275423130	267357975	/nfs/dbraw/zinc/35/79/75/267357975.db2.gz	GLSONRQDJGKTOB-MRXNPFEDSA-N	0	3	333.435	3.184	20	30		EGEDHN
C[C@H](O)[C@](C)(CNCc1ccc(C#N)cc1F)Cc1ccccc1	ZINC000276699622	267606986	/nfs/dbraw/zinc/60/69/86/267606986.db2.gz	MWUDNGDPEROUTL-YWZLYKJASA-N	0	3	326.415	3.417	20	30		EGEDHN
Cc1cc(NC(=O)[C@@H](C#N)Cc2ccc(C#N)cc2)ccc1CN(C)C	ZINC000458260846	268010089	/nfs/dbraw/zinc/01/00/89/268010089.db2.gz	IOIQOCVIQVWCPF-LJQANCHMSA-N	0	3	346.434	3.249	20	30		EGEDHN
Cc1ccc(/C=C\C(=O)N(CCN(C)C)Cc2cccc(C#N)c2)o1	ZINC000491573960	268024553	/nfs/dbraw/zinc/02/45/53/268024553.db2.gz	BFSAUOFDWLOELB-KTKRTIGZSA-N	0	3	337.423	3.063	20	30		EGEDHN
Cc1ccc(CN(CCN(C)C)C(=O)/C=C/c2cccc(C#N)c2)o1	ZINC000491399198	268037102	/nfs/dbraw/zinc/03/71/02/268037102.db2.gz	DJKNKNUNTUGCML-CSKARUKUSA-N	0	3	337.423	3.063	20	30		EGEDHN
N#Cc1ccc(CN2CCC(Nc3ccc(CCO)cc3)CC2)cc1	ZINC000272203984	268065260	/nfs/dbraw/zinc/06/52/60/268065260.db2.gz	JJVONISCUQAJJZ-UHFFFAOYSA-N	0	3	335.451	3.170	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CCCc3ccccc3C2)cc1	ZINC000280600594	268084183	/nfs/dbraw/zinc/08/41/83/268084183.db2.gz	XDJZZLJJYWSTHL-FQEVSTJZSA-N	0	3	329.403	3.216	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCC(F)(F)c2ccccc2)cc1	ZINC000356921835	268090257	/nfs/dbraw/zinc/09/02/57/268090257.db2.gz	AVFJYGPMWLJMMD-MRXNPFEDSA-N	0	3	339.345	3.149	20	30		EGEDHN
Cc1oc(NC(=O)CN[C@@H](C)CCCc2cccnc2)c(C#N)c1C	ZINC000459642015	268104654	/nfs/dbraw/zinc/10/46/54/268104654.db2.gz	MZAJPULYLAZPEX-ZDUSSCGKSA-N	0	3	340.427	3.103	20	30		EGEDHN
Cc1oc([N-]C(=O)C[NH2+][C@@H](C)CCCc2cccnc2)c(C#N)c1C	ZINC000459642015	268104657	/nfs/dbraw/zinc/10/46/57/268104657.db2.gz	MZAJPULYLAZPEX-ZDUSSCGKSA-N	0	3	340.427	3.103	20	30		EGEDHN
N#Cc1ccc(N2CCC(NCc3cn4ccsc4n3)CC2)cc1	ZINC000286089701	268108399	/nfs/dbraw/zinc/10/83/99/268108399.db2.gz	MSIRTONXEKGNPB-UHFFFAOYSA-N	0	3	337.452	3.026	20	30		EGEDHN
Cn1cc(CN2CC[C@@H](c3cccnc3)C2)c(-c2ccc(C#N)cc2)n1	ZINC000515379488	268126793	/nfs/dbraw/zinc/12/67/93/268126793.db2.gz	CACZFFCTDLFTIR-LJQANCHMSA-N	0	3	343.434	3.343	20	30		EGEDHN
Cn1cc(CNCCOCC2CCCC2)c(-c2ccc(C#N)cc2)n1	ZINC000453585333	268128193	/nfs/dbraw/zinc/12/81/93/268128193.db2.gz	OBRYFMAAVHMIST-UHFFFAOYSA-N	0	3	338.455	3.255	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCN(CCCOCc3ccccc3)C2)nc1	ZINC000292145787	268184720	/nfs/dbraw/zinc/18/47/20/268184720.db2.gz	JUNUBKSPTOUOTJ-IBGZPJMESA-N	0	3	337.423	3.013	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CC[N@@H+](Cc3c([O-])ccc4ccccc43)C2)nc1	ZINC000366282050	268184978	/nfs/dbraw/zinc/18/49/78/268184978.db2.gz	FEBDQIMGIKILPO-KRWDZBQOSA-N	0	3	345.402	3.465	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CC[N@H+](Cc3c([O-])ccc4ccccc43)C2)nc1	ZINC000366282050	268184980	/nfs/dbraw/zinc/18/49/80/268184980.db2.gz	FEBDQIMGIKILPO-KRWDZBQOSA-N	0	3	345.402	3.465	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN[C@H](c2ccccc2)C2(CO)CCC2)cc1	ZINC000292553220	268216000	/nfs/dbraw/zinc/21/60/00/268216000.db2.gz	ALCMWCFAXFABKN-WOJBJXKFSA-N	0	3	336.435	3.085	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H]2[C@H]2CCC[C@@H]2O)c(Br)c1	ZINC000451415650	268219983	/nfs/dbraw/zinc/21/99/83/268219983.db2.gz	FOJQMLYXVYUCPW-OIISXLGYSA-N	0	3	349.272	3.446	20	30		EGEDHN
N#Cc1ccc(CNC[C@@]2(O)CCC[C@H](C(F)(F)F)C2)cc1F	ZINC000421383031	268233404	/nfs/dbraw/zinc/23/34/04/268233404.db2.gz	JQIRGEOEUGZACC-DZGCQCFKSA-N	0	3	330.325	3.271	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CN1CCC[C@@H]1c1cccc(F)c1	ZINC000528350187	268300163	/nfs/dbraw/zinc/30/01/63/268300163.db2.gz	DAURFQUBPCDZHZ-RTBURBONSA-N	0	3	340.398	3.274	20	30		EGEDHN
CN1CCC[C@@H](CNC(=O)c2ccccc2-c2ccccc2C#N)C1	ZINC000108326961	275174801	/nfs/dbraw/zinc/17/48/01/275174801.db2.gz	SCPDCNHKYGSNMH-INIZCTEOSA-N	0	3	333.435	3.297	20	30		EGEDHN
N#Cc1ccc(C(=O)NCC2(N3CCSCC3)CCCCC2)cc1	ZINC000112186776	275187159	/nfs/dbraw/zinc/18/71/59/275187159.db2.gz	QUPNHBPKAGYBKN-UHFFFAOYSA-N	0	3	343.496	3.040	20	30		EGEDHN
COc1ccc(CNC[C@]2(C)OCCc3sccc32)cc1C#N	ZINC000289779456	276392980	/nfs/dbraw/zinc/39/29/80/276392980.db2.gz	KKCRNWQSLDDQCL-SFHVURJKSA-N	0	3	328.437	3.206	20	30		EGEDHN
COc1ccccc1[C@@H](CN[C@@H]1CCc2ccc(C#N)cc21)N(C)C	ZINC000353381321	295384526	/nfs/dbraw/zinc/38/45/26/295384526.db2.gz	FDDXOGBWFWUKLF-WOJBJXKFSA-N	0	3	335.451	3.447	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)cc1)C[C@H](O)COc1ccccc1F	ZINC000058397094	307348639	/nfs/dbraw/zinc/34/86/39/307348639.db2.gz	METFQLZRUJNPPO-SFHVURJKSA-N	0	3	342.414	3.348	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](CO)Cc2c(F)cccc2Cl)s1	ZINC000538410688	314245404	/nfs/dbraw/zinc/24/54/04/314245404.db2.gz	GRQNGDCFRIRYNG-LLVKDONJSA-N	0	3	338.835	3.353	20	30		EGEDHN
Cc1c(CNC[C@H](O)COc2ccc(C#N)cc2)oc2ccccc12	ZINC000563952647	316095679	/nfs/dbraw/zinc/09/56/79/316095679.db2.gz	OTFWVUBZSXQUGG-INIZCTEOSA-N	0	3	336.391	3.142	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)CC1=Cc2ccccc2OC1	ZINC000564316164	316135331	/nfs/dbraw/zinc/13/53/31/316135331.db2.gz	YDVGMZRHTVZADK-UHFFFAOYSA-N	0	3	347.462	3.398	20	30		EGEDHN
C[C@@H](OC[C@@H](O)CNCc1ccc(C#N)cc1)c1ccc(Cl)cc1	ZINC000564845084	316216842	/nfs/dbraw/zinc/21/68/42/316216842.db2.gz	PTPOYPGYKPFINW-KUHUBIRLSA-N	0	3	344.842	3.440	20	30		EGEDHN
C[C@H]1OCC[C@]1(O)CN(Cc1ccccc1)Cc1ccc(C#N)cc1	ZINC000565708617	316359750	/nfs/dbraw/zinc/35/97/50/316359750.db2.gz	LDTUUCFTVXBTNE-UTKZUKDTSA-N	0	3	336.435	3.100	20	30		EGEDHN
C[C@H]1C[C@@H](C(C)(C)C)CCN1CC(=O)NCc1ccc(C#N)cc1	ZINC000570072177	317004353	/nfs/dbraw/zinc/00/43/53/317004353.db2.gz	QHICJOSIMVUYLK-YJBOKZPZSA-N	0	3	327.472	3.321	20	30		EGEDHN
CC(C)(C)c1ccc(OC[C@H](O)CNCc2ccc(C#N)cc2)cc1	ZINC000571908750	317264803	/nfs/dbraw/zinc/26/48/03/317264803.db2.gz	BZEBESHMOXXZJZ-LJQANCHMSA-N	0	3	338.451	3.385	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCN(Cc3ccc(F)c4cccnc34)C2)nc1	ZINC000571976072	317273383	/nfs/dbraw/zinc/27/33/83/317273383.db2.gz	RLEZJSWWFGZKPT-MRXNPFEDSA-N	0	3	348.381	3.294	20	30		EGEDHN
CN(C)C[C@@H](CNC(=O)c1cc(C#N)cs1)c1ccc(Cl)cc1	ZINC000573748819	317524654	/nfs/dbraw/zinc/52/46/54/317524654.db2.gz	MOYWADIAYXHEOZ-CQSZACIVSA-N	0	3	347.871	3.348	20	30		EGEDHN
CC[C@H](NCCOc1cccc(C#N)c1)c1ccc2c(c1)OCCO2	ZINC000180646438	323450153	/nfs/dbraw/zinc/45/01/53/323450153.db2.gz	WVHZVQDLNTXAOA-SFHVURJKSA-N	0	3	338.407	3.449	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@H]1Nc1c(C#N)nnc2ccccc21	ZINC000389877175	324280829	/nfs/dbraw/zinc/28/08/29/324280829.db2.gz	VJHLABKIDQQKTD-FOIQADDNSA-N	0	3	343.434	3.434	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CN[C@@H]1CCCc2sccc21	ZINC000390722734	324283326	/nfs/dbraw/zinc/28/33/26/324283326.db2.gz	MCSFCPBGYNGJHO-GOEBONIOSA-N	0	3	328.437	3.027	20	30		EGEDHN
Cc1csc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c1C#N	ZINC000579073941	325057112	/nfs/dbraw/zinc/05/71/12/325057112.db2.gz	YIWOTAVQUFAJGJ-OAHLLOKOSA-N	0	3	340.452	3.324	20	30		EGEDHN
CN(Cc1cnc2c(C#N)cnn2c1)[C@H]1CC[C@@H](C(F)(F)F)CC1	ZINC000579108405	325063573	/nfs/dbraw/zinc/06/35/73/325063573.db2.gz	BOKZBWCGMAITIQ-OKILXGFUSA-N	0	3	337.349	3.154	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCNC2(c3ccccc3)CCOCC2)c1	ZINC000580293041	325229684	/nfs/dbraw/zinc/22/96/84/325229684.db2.gz	KBOOWEAYPOAUGA-UHFFFAOYSA-N	0	3	349.434	3.182	20	30		EGEDHN
C[S@](=O)C[C@H](NCCCOc1cccc(C#N)c1)c1ccccc1	ZINC000183086303	455225270	/nfs/dbraw/zinc/22/52/70/455225270.db2.gz	RQQFFKHPJRIBPA-CYFREDJKSA-N	0	3	342.464	3.037	20	30		EGEDHN
C=CCSc1ccccc1C(=O)NC[C@]1(N(C)C)CCSC1	ZINC000362388622	458144727	/nfs/dbraw/zinc/14/47/27/458144727.db2.gz	IADLCPVWQRUHHM-QGZVFWFLSA-N	0	3	336.526	3.132	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H]2C[C@]23CCCc2ccccc23)CC1	ZINC000173161231	455241611	/nfs/dbraw/zinc/24/16/11/455241611.db2.gz	ZCRKYPFTNLKWCU-UNMCSNQZSA-N	0	3	338.495	3.437	20	30		EGEDHN
C=C(C)CN(C)C(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000180845985	455254907	/nfs/dbraw/zinc/25/49/07/455254907.db2.gz	OPYFRPRWMFNROJ-UHFFFAOYSA-N	0	3	345.487	3.125	20	30		EGEDHN
CCO[C@H]1C[C@@](CO)(NCc2ccccc2C(C)(C)C#N)C1(C)C	ZINC000189983996	455265907	/nfs/dbraw/zinc/26/59/07/455265907.db2.gz	LZVIIOUAAQFISU-PXNSSMCTSA-N	0	3	330.472	3.143	20	30		EGEDHN
N#Cc1ccc(N2CCC(NCc3ccsc3Cl)CC2)nc1	ZINC000616473443	460565346	/nfs/dbraw/zinc/56/53/46/460565346.db2.gz	IMQOUSSPKQBEIK-UHFFFAOYSA-N	0	3	332.860	3.427	20	30		EGEDHN
Cc1oc2ccccc2c1CNC[C@H](O)COc1ccccc1C#N	ZINC000600735693	460584178	/nfs/dbraw/zinc/58/41/78/460584178.db2.gz	PGCQFHPXJPJSRQ-INIZCTEOSA-N	0	3	336.391	3.142	20	30		EGEDHN
C[C@H](NCCCS(=O)(=O)c1ccccc1)c1ccc(C#N)cc1	ZINC000174009644	455350339	/nfs/dbraw/zinc/35/03/39/455350339.db2.gz	SRIMXBXWRPDPCV-HNNXBMFYSA-N	0	3	328.437	3.073	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)N1CC[C@@H](c2ccccc2OC)C1	ZINC000265656390	455357014	/nfs/dbraw/zinc/35/70/14/455357014.db2.gz	PSEAQAJJCVPMFM-DLBZAZTESA-N	0	3	328.456	3.074	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CCOc2cc(F)ccc2C1	ZINC000600802841	460609678	/nfs/dbraw/zinc/60/96/78/460609678.db2.gz	ANZLDVMBHOPWEB-INIZCTEOSA-N	0	3	338.382	3.319	20	30		EGEDHN
Cc1ccccc1OCCN(C)CCC(=O)Nc1ccc(C#N)cc1	ZINC000026337215	453797014	/nfs/dbraw/zinc/79/70/14/453797014.db2.gz	VSHPUKMOQUOCFC-UHFFFAOYSA-N	0	3	337.423	3.206	20	30		EGEDHN
C#CCNC(=O)[C@H](C)NC[C@@H](c1c[nH]c2ccccc21)c1ccccc1	ZINC000029569865	453829894	/nfs/dbraw/zinc/82/98/94/453829894.db2.gz	GNNIJHPVGYUVPW-QFBILLFUSA-N	0	3	345.446	3.027	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H](C#N)c2ccc(C(C)(C)C)cc2)CC1	ZINC000066397235	453841920	/nfs/dbraw/zinc/84/19/20/453841920.db2.gz	PBMKLMFWVSOIOI-IBGZPJMESA-N	0	3	337.467	3.010	20	30		EGEDHN
CN(c1ccc(NC(=O)C#Cc2ccccc2)cc1)C1CCN(C)CC1	ZINC000081562170	453887069	/nfs/dbraw/zinc/88/70/69/453887069.db2.gz	RJGSSKADORABQE-UHFFFAOYSA-N	0	3	347.462	3.207	20	30		EGEDHN
N#Cc1nc(-c2ccco2)oc1N1CCN(CC2CCCC2)CC1	ZINC000075826828	453928672	/nfs/dbraw/zinc/92/86/72/453928672.db2.gz	CKEZPUFQBYWAMV-UHFFFAOYSA-N	0	3	326.400	3.118	20	30		EGEDHN
Cc1ccc(NC(=O)c2cc(C#N)cs2)c(OCCN(C)C)c1	ZINC000084112922	453969705	/nfs/dbraw/zinc/96/97/05/453969705.db2.gz	PUAGCUUDWWWLQR-UHFFFAOYSA-N	0	3	329.425	3.121	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)c2ccc(OC[C@H]3CCCO3)cc2)n1	ZINC000041521746	453970332	/nfs/dbraw/zinc/97/03/32/453970332.db2.gz	PWJOAKGQNJKFJV-HZPDHXFCSA-N	0	3	342.420	3.499	20	30		EGEDHN
N#CC(C(=O)c1cccc([N+](=O)[O-])c1)c1ccc(C(F)(F)F)cn1	ZINC000041555721	453971522	/nfs/dbraw/zinc/97/15/22/453971522.db2.gz	QOAFSSJRTGATPL-GFCCVEGCSA-N	0	3	335.241	3.499	20	30		EGEDHN
CN1CCC(Nc2ccccc2NC(=O)c2cc(C#N)cs2)CC1	ZINC000084283631	453982294	/nfs/dbraw/zinc/98/22/94/453982294.db2.gz	XPDMFQFQRWCSMH-UHFFFAOYSA-N	0	3	340.452	3.378	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C	ZINC000076389284	453995808	/nfs/dbraw/zinc/99/58/08/453995808.db2.gz	RVQRBZOWZZDAHD-ZWKOTPCHSA-N	0	3	330.472	3.091	20	30		EGEDHN
CC(C)(C)CCN1CCN(CCC(=O)Nc2sccc2C#N)CC1	ZINC000055935548	454027293	/nfs/dbraw/zinc/02/72/93/454027293.db2.gz	ZWKQIMNLECGZNR-UHFFFAOYSA-N	0	3	348.516	3.002	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N(C)[C@H](C)c1ccccn1)C(C)C	ZINC000068583907	454040034	/nfs/dbraw/zinc/04/00/34/454040034.db2.gz	CWDPCGYENCMTDM-IEBWSBKVSA-N	0	3	344.503	3.483	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2C[C@@H](c3ccc(F)cc3)C[C@@H]2C)CC1	ZINC000076984260	454056430	/nfs/dbraw/zinc/05/64/30/454056430.db2.gz	XEIPVYZAYBYTCJ-RDJZCZTQSA-N	0	3	345.462	3.364	20	30		EGEDHN
COCCN(CCOc1ccc(C#N)cc1OC)Cc1ccccc1	ZINC000077247186	454081661	/nfs/dbraw/zinc/08/16/61/454081661.db2.gz	WYYBSIULSXVBSV-UHFFFAOYSA-N	0	3	340.423	3.094	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](O)COc2cccc3ccccc32)cc1	ZINC000069160585	454083919	/nfs/dbraw/zinc/08/39/19/454083919.db2.gz	GQYGLIUZACFDOW-LJQANCHMSA-N	0	3	332.403	3.241	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Cc1csc(CC)n1)C(C)C	ZINC000056969086	454093409	/nfs/dbraw/zinc/09/34/09/454093409.db2.gz	MHOULOLOBUJIRD-MRXNPFEDSA-N	0	3	335.517	3.063	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cccc(-c3nc(C)cs3)c2)CC1	ZINC000069351160	454097051	/nfs/dbraw/zinc/09/70/51/454097051.db2.gz	ATIFZYNSGOWOSM-UHFFFAOYSA-N	0	3	339.464	3.402	20	30		EGEDHN
CC(C)Oc1ccc(C#N)cc1NC(=O)N1CCCN(C(C)C)CC1	ZINC000069655943	454129557	/nfs/dbraw/zinc/12/95/57/454129557.db2.gz	RTKZAXPHSAJHSY-UHFFFAOYSA-N	0	3	344.459	3.293	20	30		EGEDHN
N#Cc1ccccc1-c1ccccc1C(=O)N[C@H]1CCN(C2CC2)C1	ZINC000057553789	454135328	/nfs/dbraw/zinc/13/53/28/454135328.db2.gz	YJFHHXJMDVMDJL-INIZCTEOSA-N	0	3	331.419	3.192	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccccc1-c1ccccc1C#N)N(C)C1CC1	ZINC000057715665	454142557	/nfs/dbraw/zinc/14/25/57/454142557.db2.gz	SXZJUBVNCOMHSS-HNNXBMFYSA-N	0	3	333.435	3.438	20	30		EGEDHN
CC(C)(NC[C@@H](O)COc1ccc(C#N)cc1)c1ccc(Cl)cc1	ZINC000057846679	454151804	/nfs/dbraw/zinc/15/18/04/454151804.db2.gz	OYRHPZDRMVESGQ-QGZVFWFLSA-N	0	3	344.842	3.476	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@H]1CCCN(Cc2ccc(C#N)cc2)C1	ZINC000058225097	454172540	/nfs/dbraw/zinc/17/25/40/454172540.db2.gz	WUOFWERWMTYAGT-KRWDZBQOSA-N	0	3	329.444	3.295	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)Nc1cccc(F)c1	ZINC000058331154	454187886	/nfs/dbraw/zinc/18/78/86/454187886.db2.gz	BNGQNDFFHBVFNA-UHFFFAOYSA-N	0	3	340.402	3.293	20	30		EGEDHN
CN(C)CCN(Cc1cccs1)C(=O)c1c(F)cc(C#N)cc1F	ZINC000119604015	454207824	/nfs/dbraw/zinc/20/78/24/454207824.db2.gz	KFTJRAHZQVDZTA-UHFFFAOYSA-N	0	3	349.406	3.102	20	30		EGEDHN
Cc1ccc2c(c1)[C@H]1CN(C)CC[C@@H]1N2C(=O)c1ccc(C#N)c(C)n1	ZINC000078430218	454252662	/nfs/dbraw/zinc/25/26/62/454252662.db2.gz	WULFZCCJXOELLZ-XLIONFOSSA-N	0	3	346.434	3.018	20	30		EGEDHN
Cn1ccnc1C[C@@H]1CCCN(CC#Cc2cccc(Cl)c2)C1	ZINC000090004355	454259897	/nfs/dbraw/zinc/25/98/97/454259897.db2.gz	POUPYPBTISXONG-KRWDZBQOSA-N	0	3	327.859	3.380	20	30		EGEDHN
CN(CCCCN1C(=O)c2ccccc2C1=O)Cc1ccc(C#N)cc1	ZINC000046528157	454259879	/nfs/dbraw/zinc/25/98/79/454259879.db2.gz	TVACKJSSEVTURU-UHFFFAOYSA-N	0	3	347.418	3.066	20	30		EGEDHN
CN(C)[C@H](CNCc1ccc(N(C)CCC#N)cc1)c1ccco1	ZINC000072670312	454325996	/nfs/dbraw/zinc/32/59/96/454325996.db2.gz	CKIBAJCNPOBGJN-GOSISDBHSA-N	0	3	326.444	3.022	20	30		EGEDHN
N#Cc1cccc(NC(=O)NC2CCN(CCc3ccccc3)CC2)c1	ZINC000079083703	454365702	/nfs/dbraw/zinc/36/57/02/454365702.db2.gz	CYMLTYYJYMLRJR-UHFFFAOYSA-N	0	3	348.450	3.387	20	30		EGEDHN
C[C@@H](CNC(=O)N[C@@H](CCC#N)c1ccccc1)N1CCC[C@@H](C)C1	ZINC000132860731	454371869	/nfs/dbraw/zinc/37/18/69/454371869.db2.gz	GUIOGTZJHXKBHU-AOIWGVFYSA-N	0	3	342.487	3.451	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)N[C@H]1CCCC1(C)C	ZINC000079131052	454373095	/nfs/dbraw/zinc/37/30/95/454373095.db2.gz	XGWBIGKLGHMYSL-SFHVURJKSA-N	0	3	342.487	3.210	20	30		EGEDHN
Cc1ccccc1NC(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000062368287	454375439	/nfs/dbraw/zinc/37/54/39/454375439.db2.gz	LBWZVEWTWQBAOE-UHFFFAOYSA-N	0	3	336.439	3.462	20	30		EGEDHN
CC[C@@H](N[C@@H]1CCCN(c2ccc(C#N)cc2F)C1)c1cnn(C)c1	ZINC000097016865	454387493	/nfs/dbraw/zinc/38/74/93/454387493.db2.gz	PRNBPWOIAQJXHT-SJLPKXTDSA-N	0	3	341.434	3.141	20	30		EGEDHN
COCCN1CCC(Nc2ccc(C#N)cc2C(F)(F)F)CC1	ZINC000133477279	454430158	/nfs/dbraw/zinc/43/01/58/454430158.db2.gz	ZQOVROIVYSYFBI-UHFFFAOYSA-N	0	3	327.350	3.100	20	30		EGEDHN
CC(C)CN(C(=O)c1cccc(SCC#N)c1)C1CCN(C)CC1	ZINC000079536214	454432596	/nfs/dbraw/zinc/43/25/96/454432596.db2.gz	LDJFLNZFULNBHY-UHFFFAOYSA-N	0	3	345.512	3.495	20	30		EGEDHN
C#CCCN1CCN(c2ccnc3cc(Br)ccc32)CC1	ZINC000091480484	454439888	/nfs/dbraw/zinc/43/98/88/454439888.db2.gz	WFONYIZLPYWSDP-UHFFFAOYSA-N	0	3	344.256	3.143	20	30		EGEDHN
N#CC1(NC(=O)CN[C@H]2CCC[C@H]2c2ccccc2)CCCCC1	ZINC000133586026	454442071	/nfs/dbraw/zinc/44/20/71/454442071.db2.gz	RBGTUJFWJOVZRI-ROUUACIJSA-N	0	3	325.456	3.255	20	30		EGEDHN
N#Cc1cccc(NC(=O)N2CCN(CC3CCCCC3)CC2)c1	ZINC000064130717	454467835	/nfs/dbraw/zinc/46/78/35/454467835.db2.gz	IHKYZJSDESGJJP-UHFFFAOYSA-N	0	3	326.444	3.288	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2CNCc2ccc(C#N)cc2)C[C@H](C)O1	ZINC000048816786	454518363	/nfs/dbraw/zinc/51/83/63/454518363.db2.gz	BFUNZJBQBJZNFQ-HDICACEKSA-N	0	3	349.478	3.457	20	30		EGEDHN
C#CCCCCNC(=O)NC[C@H]1CCCN(Cc2cccs2)C1	ZINC000122606756	454552719	/nfs/dbraw/zinc/55/27/19/454552719.db2.gz	JJLDISCOWIARKY-MRXNPFEDSA-N	0	3	333.501	3.063	20	30		EGEDHN
COc1ccccc1CC(=O)C(C#N)C(=O)Nc1ccccc1Cl	ZINC000103504476	454561174	/nfs/dbraw/zinc/56/11/74/454561174.db2.gz	LVEDIWRMUODRPY-CYBMUJFWSA-N	0	3	342.782	3.239	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)c1snc(Cl)c1C#N	ZINC000092681710	454609978	/nfs/dbraw/zinc/60/99/78/454609978.db2.gz	KYWRAQKUQAYCHD-UHFFFAOYSA-N	0	3	345.859	3.108	20	30		EGEDHN
C#CCCOc1ccc(CN2CCC[C@@H](CNC(=O)CCC)C2)cc1	ZINC000092707788	454615546	/nfs/dbraw/zinc/61/55/46/454615546.db2.gz	UIXBUEPMWISQJP-IBGZPJMESA-N	0	3	342.483	3.217	20	30		EGEDHN
N#Cc1cccc(OCCN2CCC([C@H](O)c3ccccc3)CC2)c1	ZINC000051531941	454629071	/nfs/dbraw/zinc/62/90/71/454629071.db2.gz	OIIHDKFUPNVUHR-OAQYLSRUSA-N	0	3	336.435	3.383	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CCC[C@@H](C(=O)NCC2CC2)C1	ZINC000135129140	454637392	/nfs/dbraw/zinc/63/73/92/454637392.db2.gz	SCUPXPQALITYRA-GOSISDBHSA-N	0	3	339.483	3.226	20	30		EGEDHN
COc1ccc(CN(C)CCCSCC#N)cc1OC(F)F	ZINC000074981588	454669095	/nfs/dbraw/zinc/66/90/95/454669095.db2.gz	IHXZYOFSUVWKAN-UHFFFAOYSA-N	0	3	330.400	3.375	20	30		EGEDHN
N#CCSCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1	ZINC000074980861	454669292	/nfs/dbraw/zinc/66/92/92/454669292.db2.gz	ZILHGQSKBLRAJX-UHFFFAOYSA-N	0	3	343.418	3.474	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H](C)SCc2ccccc2)CC1	ZINC000106036008	454674243	/nfs/dbraw/zinc/67/42/43/454674243.db2.gz	XFMVYQWDGNHFQM-INIZCTEOSA-N	0	3	332.513	3.465	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CSc2ccc(F)c(F)c2)CC1	ZINC000106038866	454675612	/nfs/dbraw/zinc/67/56/12/454675612.db2.gz	KXOAAPMYFVTLIV-UHFFFAOYSA-N	0	3	340.439	3.214	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)/C=C/c2ccc(OCC)cc2)CC1	ZINC000106038046	454675785	/nfs/dbraw/zinc/67/57/85/454675785.db2.gz	PMNCJAVSXIFPEJ-JXMROGBWSA-N	0	3	328.456	3.255	20	30		EGEDHN
CN(c1ccccc1CN(CCC#N)CC1CC1)C1CCN(C)CC1	ZINC000093091454	454681283	/nfs/dbraw/zinc/68/12/83/454681283.db2.gz	AGXRFYBDAQTAMB-UHFFFAOYSA-N	0	3	340.515	3.343	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H]2CCCc3ccc(F)cc32)CC1	ZINC000093126406	454685008	/nfs/dbraw/zinc/68/50/08/454685008.db2.gz	XOKZQNRVTYTEQN-GOSISDBHSA-N	0	3	331.435	3.153	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)CCCOc2ccccc2)CC1	ZINC000106276103	454689553	/nfs/dbraw/zinc/68/95/53/454689553.db2.gz	KUECUZNYJBZJOW-UHFFFAOYSA-N	0	3	345.487	3.137	20	30		EGEDHN
CC[C@@]1(NCC(=O)Nc2ccccc2SC[C@@H](C)C#N)CCOC1	ZINC000616866128	460648326	/nfs/dbraw/zinc/64/83/26/460648326.db2.gz	QGBCZNPWCACOBG-KBXCAEBGSA-N	0	3	347.484	3.036	20	30		EGEDHN
C#CCCCCNC(=O)Nc1ccc(CCN2CCSCC2)cc1	ZINC000152994902	454751187	/nfs/dbraw/zinc/75/11/87/454751187.db2.gz	DFFMCSGRKUPXLY-UHFFFAOYSA-N	0	3	345.512	3.203	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CC[C@H](Cc3ccccc3)C2)CC1	ZINC000176501066	454752968	/nfs/dbraw/zinc/75/29/68/454752968.db2.gz	VPKFQAQODGRXSM-LJQANCHMSA-N	0	3	341.499	3.301	20	30		EGEDHN
C[C@@H](NCC(=O)Nc1ccccc1S[C@@H](C)CC#N)[C@@H]1CCOC1	ZINC000162755184	454798661	/nfs/dbraw/zinc/79/86/61/454798661.db2.gz	PNXSBMVFNGMXFD-RRFJBIMHSA-N	0	3	347.484	3.034	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cccc(CCC(F)(F)F)c2)CC1	ZINC000176949760	454803584	/nfs/dbraw/zinc/80/35/84/454803584.db2.gz	LOWJRCZOYXZLAE-UHFFFAOYSA-N	0	3	338.373	3.465	20	30		EGEDHN
CN(C)[C@H]1Cc2ccccc2N(C(=O)CCc2ccc(C#N)cc2)C1	ZINC000109113087	454822072	/nfs/dbraw/zinc/82/20/72/454822072.db2.gz	NXWIFCSTWYZTMV-IBGZPJMESA-N	0	3	333.435	3.010	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CCC[C@@H]1c1ccncc1	ZINC000154033594	454858346	/nfs/dbraw/zinc/85/83/46/454858346.db2.gz	DPMFLFMOAOEKRO-VQTJNVASSA-N	0	3	338.451	3.387	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@@H](C)N1CCC[C@H](COC)C1	ZINC000112987993	454909867	/nfs/dbraw/zinc/90/98/67/454909867.db2.gz	HUFWVZWWGVMXDN-CVEARBPZSA-N	0	3	336.501	3.010	20	30		EGEDHN
C=C(Cl)COc1ccc([C@@H](C)N[C@H]2CCN(C(=O)CC)C2)cc1	ZINC000126730342	454914760	/nfs/dbraw/zinc/91/47/60/454914760.db2.gz	UBXUNAMCQJQHGY-ZBFHGGJFSA-N	0	3	336.863	3.479	20	30		EGEDHN
N#Cc1ccsc1NC(=O)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000170700337	454960267	/nfs/dbraw/zinc/96/02/67/454960267.db2.gz	CJVZGGVWSSJIIS-INIZCTEOSA-N	0	3	325.437	3.470	20	30		EGEDHN
N#Cc1cccc(CNC(=O)NC[C@H]2CCCN2Cc2ccccc2)c1	ZINC000114785092	454978860	/nfs/dbraw/zinc/97/88/60/454978860.db2.gz	KKGNOWRCESAYDY-HXUWFJFHSA-N	0	3	348.450	3.022	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN[C@@H](C)c1ccc(C#N)cc1	ZINC000127770619	454995316	/nfs/dbraw/zinc/99/53/16/454995316.db2.gz	FWEIGAOIQJXLEQ-JXFKEZNVSA-N	0	3	336.435	3.377	20	30		EGEDHN
CC(=O)Nc1cccc(OCCNC2CC(C#N)(c3ccccc3)C2)c1	ZINC000127850577	455003290	/nfs/dbraw/zinc/00/32/90/455003290.db2.gz	SPDXQVMBGDEANA-UHFFFAOYSA-N	0	3	349.434	3.237	20	30		EGEDHN
CN(CCC#N)c1ccc(CNC[C@@H]2COC3(CCCCC3)O2)cc1	ZINC000128345548	455047567	/nfs/dbraw/zinc/04/75/67/455047567.db2.gz	GNGUZAMRELPUBL-LJQANCHMSA-N	0	3	343.471	3.202	20	30		EGEDHN
C[C@H]1CN(CC2CCN(Cc3ccc(C#N)cc3F)CC2)C[C@H](C)O1	ZINC000171306847	455060227	/nfs/dbraw/zinc/06/02/27/455060227.db2.gz	DEYCAYMIWGRBID-HOTGVXAUSA-N	0	3	345.462	3.019	20	30		EGEDHN
C#CCOc1ccc(CN2CCC[C@H](c3nnc4ccccn43)C2)cc1	ZINC000179779609	455077642	/nfs/dbraw/zinc/07/76/42/455077642.db2.gz	QQTHYQLCHDGOBI-SFHVURJKSA-N	0	3	346.434	3.121	20	30		EGEDHN
CN(CCC#N)c1ccc(CNCCOc2ccc(Cl)cn2)cc1	ZINC000152146267	455078881	/nfs/dbraw/zinc/07/88/81/455078881.db2.gz	QJZJPPFEYOXOAD-UHFFFAOYSA-N	0	3	344.846	3.253	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H]2CCC[C@H](SC)C2)CC1	ZINC000117493434	455087700	/nfs/dbraw/zinc/08/77/00/455087700.db2.gz	GFHHGFQOIGHRPM-HOTGVXAUSA-N	0	3	325.522	3.000	20	30		EGEDHN
Cc1cccc(C(=O)N2CCCN(CC(C)(C)CCC#N)CC2)c1	ZINC000129070126	455097101	/nfs/dbraw/zinc/09/71/01/455097101.db2.gz	IVQAKLGJTAEESG-UHFFFAOYSA-N	0	3	327.472	3.473	20	30		EGEDHN
CCN(CCC#N)C(=O)CN[C@H](c1ccc(F)cc1)C1CCCC1	ZINC000180280376	455154705	/nfs/dbraw/zinc/15/47/05/455154705.db2.gz	KZKNNOXRUNVWMN-IBGZPJMESA-N	0	3	331.435	3.409	20	30		EGEDHN
C=CC[C@H](C)NC(=O)N(C)CCC1CCN(c2ccncc2)CC1	ZINC000180366341	455161788	/nfs/dbraw/zinc/16/17/88/455161788.db2.gz	OEZLSUJQBGSWAC-INIZCTEOSA-N	0	3	330.476	3.294	20	30		EGEDHN
C[C@H]1C[C@@H](N(C)C(=O)NCCCCC#N)CCN1Cc1ccccc1	ZINC000172582854	455162891	/nfs/dbraw/zinc/16/28/91/455162891.db2.gz	WARYDSSVAAGEGZ-HKUYNNGSSA-N	0	3	342.487	3.375	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)N1CC[C@H](N2CCCCC2)C1	ZINC000264428459	455211097	/nfs/dbraw/zinc/21/10/97/455211097.db2.gz	AVVUJKPWOYYBNR-INIZCTEOSA-N	0	3	342.443	3.049	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CNC[C@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000181085086	455285017	/nfs/dbraw/zinc/28/50/17/455285017.db2.gz	UKBJLUOFJPPJMB-MBBYKFCKSA-N	0	3	344.455	3.389	20	30		EGEDHN
C[C@@H](NCC#Cc1ccc(F)cc1)c1ccc(N2CCOC2=O)cc1	ZINC000181271646	455310557	/nfs/dbraw/zinc/31/05/57/455310557.db2.gz	VLZPWHMLPJBSQG-OAHLLOKOSA-N	0	3	338.382	3.485	20	30		EGEDHN
COc1ccccc1CNC1CCN(Cc2ccc(C#N)cc2)CC1	ZINC000181386312	455326721	/nfs/dbraw/zinc/32/67/21/455326721.db2.gz	AOXWHNUDXWMIFH-UHFFFAOYSA-N	0	3	335.451	3.321	20	30		EGEDHN
Cc1nc(-c2ccccc2)oc1C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000181432456	455334332	/nfs/dbraw/zinc/33/43/32/455334332.db2.gz	IGGJNBBFAJIZDL-CQSZACIVSA-N	0	3	346.346	3.006	20	30		EGEDHN
CC[C@@H](N[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O)c1ccccc1	ZINC000190615916	455354155	/nfs/dbraw/zinc/35/41/55/455354155.db2.gz	GRICTZMHZMBZSX-UXHICEINSA-N	0	3	333.435	3.400	20	30		EGEDHN
C[C@@H](CSC(C)(C)C)N[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000190621936	455355480	/nfs/dbraw/zinc/35/54/80/455355480.db2.gz	ZJULDWUEYXZSQM-WMLDXEAASA-N	0	3	345.512	3.169	20	30		EGEDHN
CC(C)(C#N)CN[C@H]1CCCC[C@H](N2C(=O)c3ccccc3C2=O)C1	ZINC000612585238	460670067	/nfs/dbraw/zinc/67/00/67/460670067.db2.gz	TWJPUJXVZIOVBC-GJZGRUSLSA-N	0	3	339.439	3.123	20	30		EGEDHN
C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)N[C@H](CCC#N)c1ccccc1	ZINC000245912883	455396821	/nfs/dbraw/zinc/39/68/21/455396821.db2.gz	DUPRUFSMFQFBQG-ZIFCJYIRSA-N	0	3	342.487	3.451	20	30		EGEDHN
C[C@H](NCCOc1ncccc1Cl)c1ccc(OCC#N)cc1	ZINC000182016572	455417366	/nfs/dbraw/zinc/41/73/66/455417366.db2.gz	KFOONQFVBXROIX-ZDUSSCGKSA-N	0	3	331.803	3.367	20	30		EGEDHN
C[C@@H](NCCOc1ccc(Cl)cn1)c1ccc(OCC#N)cc1	ZINC000182016949	455417498	/nfs/dbraw/zinc/41/74/98/455417498.db2.gz	YEDXMBBVJOQXJG-CYBMUJFWSA-N	0	3	331.803	3.367	20	30		EGEDHN
Cc1cc([C@](C)(O)CNCc2ccc(N(C)CCC#N)cc2)c(C)o1	ZINC000266128278	455424048	/nfs/dbraw/zinc/42/40/48/455424048.db2.gz	CCOMUGKYQJXDLD-HXUWFJFHSA-N	0	3	341.455	3.244	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN1CCS[C@H]2CCCC[C@H]21	ZINC000246089399	455424321	/nfs/dbraw/zinc/42/43/21/455424321.db2.gz	GSEHKYFOVYOAPM-KGLIPLIRSA-N	0	3	335.498	3.308	20	30		EGEDHN
CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)Cc1ccc(C#N)cc1	ZINC000184843227	455458654	/nfs/dbraw/zinc/45/86/54/455458654.db2.gz	JHIICDIRRMMBML-NRFANRHFSA-N	0	3	349.478	3.374	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cn(C(C)(C)C)nc1C)C(C)C	ZINC000182255778	455473410	/nfs/dbraw/zinc/47/34/10/455473410.db2.gz	PVMIPWNSGZXAER-SFHVURJKSA-N	0	3	346.519	3.375	20	30		EGEDHN
CCCCNC(=O)[C@H]1CC[C@H](C)N(Cc2ccc(F)c(C#N)c2)C1	ZINC000161004038	455523515	/nfs/dbraw/zinc/52/35/15/455523515.db2.gz	ZNRCLZVYFJTLDK-HOCLYGCPSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2csc(Br)c2C)CC1	ZINC000185330733	455541330	/nfs/dbraw/zinc/54/13/30/455541330.db2.gz	GPOMEEZMNCUXTJ-UHFFFAOYSA-N	0	3	343.290	3.199	20	30		EGEDHN
N#Cc1ccccc1OCCN[C@@H]1CCO[C@H]1c1ccc(F)c(F)c1	ZINC000192137654	455563137	/nfs/dbraw/zinc/56/31/37/455563137.db2.gz	IYJSHLOUKNBILI-MJGOQNOKSA-N	0	3	344.361	3.335	20	30		EGEDHN
CCN1CCN(Cc2ccc(N[C@H]3CCC[C@@H](C#N)C3)cc2)CC1	ZINC000185726482	455607547	/nfs/dbraw/zinc/60/75/47/455607547.db2.gz	AZYBRJQHFXAQOQ-QUCCMNQESA-N	0	3	326.488	3.318	20	30		EGEDHN
COc1ccc(CN(CCO)CCCCC(C)(C)C#N)c(OC)c1	ZINC000277638909	455621675	/nfs/dbraw/zinc/62/16/75/455621675.db2.gz	HJLHSURWHBUWBD-UHFFFAOYSA-N	0	3	334.460	3.218	20	30		EGEDHN
C[C@@H](NCCOc1ccc(C#N)cc1)[C@H]1OCCc2sccc21	ZINC000292415257	455656488	/nfs/dbraw/zinc/65/64/88/455656488.db2.gz	MJGDHOKOYDLXDP-FZKQIMNGSA-N	0	3	328.437	3.291	20	30		EGEDHN
CSC[C@@H]1CCCN([C@H]2CCCN(c3ccc(C#N)cc3)C2=O)C1	ZINC000292449220	455666309	/nfs/dbraw/zinc/66/63/09/455666309.db2.gz	PFOKTYDQDURTCU-AEFFLSMTSA-N	0	3	343.496	3.129	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1ccc(CC#N)cc1	ZINC000248929104	455739113	/nfs/dbraw/zinc/73/91/13/455739113.db2.gz	XOQOGTGHZGLISK-OXQOHEQNSA-N	0	3	348.450	3.395	20	30		EGEDHN
C=CCOCCN1CCC[C@@H](CNC(=O)Nc2ccc(C)cc2)C1	ZINC000292750343	455746740	/nfs/dbraw/zinc/74/67/40/455746740.db2.gz	IAGXTSUQFALQQC-KRWDZBQOSA-N	0	3	331.460	3.031	20	30		EGEDHN
C=CCN(CC=C)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000193267291	455750263	/nfs/dbraw/zinc/75/02/63/455750263.db2.gz	IPWKEJOYNIPNER-UHFFFAOYSA-N	0	3	327.472	3.077	20	30		EGEDHN
C#CC[C@H](NC(=O)N1CCN(C2CCC2)C[C@@H](C)C1)c1ccccc1	ZINC000292778977	455755962	/nfs/dbraw/zinc/75/59/62/455755962.db2.gz	XVKSCDZGUIZTEE-XLIONFOSSA-N	0	3	339.483	3.267	20	30		EGEDHN
CC(C)C[C@H]1OCCC[C@H]1NCC(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000186386547	455757619	/nfs/dbraw/zinc/75/76/19/455757619.db2.gz	GHXIJMFXDAFPQH-IAGOWNOFSA-N	0	3	349.862	3.333	20	30		EGEDHN
CC[C@H](NC[C@@H](O)c1cc(OC)ccc1OC)c1ccc(C#N)cc1	ZINC000278220581	455789870	/nfs/dbraw/zinc/78/98/70/455789870.db2.gz	IZJBTNGQDRNFIH-RBUKOAKNSA-N	0	3	340.423	3.350	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H]2CCCc3sc(Cl)cc32)CC1	ZINC000293786141	455796739	/nfs/dbraw/zinc/79/67/39/455796739.db2.gz	WNDFLVXOJUUEEH-AWEZNQCLSA-N	0	3	336.888	3.240	20	30		EGEDHN
C[C@@H](NCCN1CCc2sccc2C1)c1ccc(C#N)c(F)c1	ZINC000271913893	455799207	/nfs/dbraw/zinc/79/92/07/455799207.db2.gz	FTSPLWMBBVGVHQ-CYBMUJFWSA-N	0	3	329.444	3.468	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)[C@H]1CCCCC1(F)F	ZINC000294530616	455819591	/nfs/dbraw/zinc/81/95/91/455819591.db2.gz	QZYOAQNOEPMMEN-QGZVFWFLSA-N	0	3	349.425	3.274	20	30		EGEDHN
Cc1cnccc1CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000294688973	455823587	/nfs/dbraw/zinc/82/35/87/455823587.db2.gz	DPSVEFVCLQQVAZ-UHFFFAOYSA-N	0	3	334.423	3.112	20	30		EGEDHN
N#CC1(C(=O)NC2CCN(CCc3ccccc3)CC2)CCCCC1	ZINC000194338408	455830153	/nfs/dbraw/zinc/83/01/53/455830153.db2.gz	JWBVAZNGXFBCTC-UHFFFAOYSA-N	0	3	339.483	3.284	20	30		EGEDHN
N#Cc1cccc(NC2CCN(CCOc3ccc(F)cc3)CC2)n1	ZINC000269334718	455837552	/nfs/dbraw/zinc/83/75/52/455837552.db2.gz	IZAAYVWYSZZKEK-UHFFFAOYSA-N	0	3	340.402	3.048	20	30		EGEDHN
CC1(C)[C@H](NCc2ccc(Br)cc2C#N)[C@@H]2CCO[C@H]21	ZINC000295094919	455838317	/nfs/dbraw/zinc/83/83/17/455838317.db2.gz	AKQMSVJUTCEBIF-RRFJBIMHSA-N	0	3	335.245	3.224	20	30		EGEDHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@]1(C#N)CC12CCCC2	ZINC000295122784	455840455	/nfs/dbraw/zinc/84/04/55/455840455.db2.gz	WYQVJLGKACSDNM-OXQOHEQNSA-N	0	3	325.456	3.097	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cccnc2-c2csc(C)c2)CC1	ZINC000186870730	455845613	/nfs/dbraw/zinc/84/56/13/455845613.db2.gz	VWLXWJBGXRONFD-UHFFFAOYSA-N	0	3	339.464	3.402	20	30		EGEDHN
CCN1CCN(c2ccc(F)cc2[C@H](C)N[C@H]2CC[C@H](C#N)C2)CC1	ZINC000278707068	455845571	/nfs/dbraw/zinc/84/55/71/455845571.db2.gz	UFARPBCVFIQZJZ-BQFCYCMXSA-N	0	3	344.478	3.310	20	30		EGEDHN
CC[C@H](C)[N-]C(=S)C(C(=O)c1c(C)noc1C)[n+]1cccc(C)c1	ZINC000186965123	455856580	/nfs/dbraw/zinc/85/65/80/455856580.db2.gz	XGIUGHSCDRXDGI-LBPRGKRZSA-O	0	3	346.476	3.214	20	30		EGEDHN
C=CCSCCNC(=O)NC[C@H](c1cccs1)N1CCCC1	ZINC000194634291	455866767	/nfs/dbraw/zinc/86/67/67/455866767.db2.gz	GZFWPDDUSCLIMJ-CQSZACIVSA-N	0	3	339.530	3.103	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)/C=C\c2ccnc3ccccc23)CC1	ZINC000255732887	455872893	/nfs/dbraw/zinc/87/28/93/455872893.db2.gz	BGTHOSUYSMFDAW-FPLPWBNLSA-N	0	3	335.451	3.405	20	30		EGEDHN
CSCc1cccc(CNC(=O)C(C#N)Cc2ccc(C#N)cc2)c1	ZINC000279957328	455878889	/nfs/dbraw/zinc/87/88/89/455878889.db2.gz	HZKWTOBDOKRHNJ-IBGZPJMESA-N	0	3	349.459	3.420	20	30		EGEDHN
Cc1cccc2c1CN(C(=O)C(C#N)Cc1ccc(C#N)cc1)CC2	ZINC000279968491	455879547	/nfs/dbraw/zinc/87/95/47/455879547.db2.gz	IUEUJZBHQDSMTO-IBGZPJMESA-N	0	3	329.403	3.134	20	30		EGEDHN
C[C@H](NC(=O)CCc1ccc(C#N)cc1)[C@@H](c1ccccc1)N(C)C	ZINC000187264377	455889309	/nfs/dbraw/zinc/88/93/09/455889309.db2.gz	VOKPFBDEOUVBOB-KKSFZXQISA-N	0	3	335.451	3.298	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)Nc1ccc(C)cc1OCCN(C)C)OCC	ZINC000270229468	455908322	/nfs/dbraw/zinc/90/83/22/455908322.db2.gz	VAPFSUXYUGAGFX-QGZVFWFLSA-N	0	3	334.460	3.245	20	30		EGEDHN
Cc1nc(C)c(CNCc2cn(C)nc2-c2ccc(C#N)cc2)s1	ZINC000272379022	455931604	/nfs/dbraw/zinc/93/16/04/455931604.db2.gz	YIFUBEZYURZMQI-UHFFFAOYSA-N	0	3	337.452	3.322	20	30		EGEDHN
C=CCn1c(SC[C@H]2CCN(C)C2)nnc1-c1cccc(C)c1	ZINC000187666776	455935850	/nfs/dbraw/zinc/93/58/50/455935850.db2.gz	IFRABLMGGKHIHW-HNNXBMFYSA-N	0	3	328.485	3.483	20	30		EGEDHN
N#CCc1ccc(C(=O)N2CCN(CC3CCCCC3)CC2)cc1	ZINC000270370493	455939790	/nfs/dbraw/zinc/93/97/90/455939790.db2.gz	VFKINPYHKJUVDZ-UHFFFAOYSA-N	0	3	325.456	3.091	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)c2ccc(CC#N)cc2)CN1Cc1ccccc1	ZINC000270382682	455943161	/nfs/dbraw/zinc/94/31/61/455943161.db2.gz	QCQNQCAIZNGZGV-OXJNMPFZSA-N	0	3	333.435	3.145	20	30		EGEDHN
CCN(C(=O)C1CCN(C2CC2)CC1)[C@H](C)c1ccc(C#N)cc1	ZINC000195341656	455946167	/nfs/dbraw/zinc/94/61/67/455946167.db2.gz	AHATVBZLBGJJQB-OAHLLOKOSA-N	0	3	325.456	3.342	20	30		EGEDHN
C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC000272496853	455970477	/nfs/dbraw/zinc/97/04/77/455970477.db2.gz	NKWIIYZPTFRSIV-RHSMWYFYSA-N	0	3	329.444	3.293	20	30		EGEDHN
CC(C)(CNC(=O)C(C#N)Cc1ccc(C#N)cc1)c1cccs1	ZINC000280451641	455974009	/nfs/dbraw/zinc/97/40/09/455974009.db2.gz	NRSDELVWCMDGOU-INIZCTEOSA-N	0	3	337.448	3.396	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CC[C@@H](C(F)(F)F)[C@H](CO)C1	ZINC000286549103	456049582	/nfs/dbraw/zinc/04/95/82/456049582.db2.gz	ONPJYQWQPDZRLW-GOEBONIOSA-N	0	3	340.389	3.480	20	30		EGEDHN
C[C@@H](NC(=O)NCc1cccc(C#N)c1)[C@@H](c1ccccc1)N(C)C	ZINC000286944727	456058107	/nfs/dbraw/zinc/05/81/07/456058107.db2.gz	CPKOBGBQWACXFR-BEFAXECRSA-N	0	3	336.439	3.049	20	30		EGEDHN
C=CCS(=O)(=O)CCNCCCc1c(Cl)cccc1Cl	ZINC000280843943	456064949	/nfs/dbraw/zinc/06/49/49/456064949.db2.gz	MDIUHCQBHKNMGI-UHFFFAOYSA-N	0	3	336.284	3.116	20	30		EGEDHN
C=CCC[C@@H](NCC1(N2CCOCC2)CC(OCC)C1)c1ccco1	ZINC000287761667	456077996	/nfs/dbraw/zinc/07/79/96/456077996.db2.gz	ZTVADZPMPWDLEC-QPIRBTGLSA-N	0	3	348.487	3.146	20	30		EGEDHN
CN(C)c1ccccc1CN(C)CCC(=O)Nc1ccccc1C#N	ZINC000289021033	456111671	/nfs/dbraw/zinc/11/16/71/456111671.db2.gz	OARSYAIMZYAXAQ-UHFFFAOYSA-N	0	3	336.439	3.085	20	30		EGEDHN
CN(CCNc1ccc([N+](=O)[O-])cc1C#N)Cc1ccc(F)cc1	ZINC000301549264	456143770	/nfs/dbraw/zinc/14/37/70/456143770.db2.gz	QGHZVRPVNMMEIK-UHFFFAOYSA-N	0	3	328.347	3.149	20	30		EGEDHN
C=CCc1cc(CN[C@@H](CO)Cc2ccccc2C)cc(OC)c1O	ZINC000188940042	456177650	/nfs/dbraw/zinc/17/76/50/456177650.db2.gz	XCQUJRDZMFODRQ-LJQANCHMSA-N	0	3	341.451	3.131	20	30		EGEDHN
Cc1cc(CN(C)C)cc(NC(=O)[C@@H](C#N)Cc2ccc(C#N)cc2)c1	ZINC000281367566	456215275	/nfs/dbraw/zinc/21/52/75/456215275.db2.gz	AXQBKQVZGDMIGK-LJQANCHMSA-N	0	3	346.434	3.249	20	30		EGEDHN
CSCCCN(C)Cc1cn(CCC#N)nc1-c1ccncc1	ZINC000281390957	456221317	/nfs/dbraw/zinc/22/13/17/456221317.db2.gz	WTPPCRITFPAWOR-UHFFFAOYSA-N	0	3	329.473	3.044	20	30		EGEDHN
CC[C@H]1CN(Cc2ccc(OC)c(OCCCC#N)c2)CCCO1	ZINC000281416488	456228441	/nfs/dbraw/zinc/22/84/41/456228441.db2.gz	YRJOJQPELZZFCW-KRWDZBQOSA-N	0	3	332.444	3.379	20	30		EGEDHN
C=CCN(Cc1cccc(OC)c1)[C@@H](C)c1cccc(-n2cnnn2)c1	ZINC000340146095	456282165	/nfs/dbraw/zinc/28/21/65/456282165.db2.gz	LTKBHPIDOSQEBU-INIZCTEOSA-N	0	3	349.438	3.420	20	30		EGEDHN
Cc1nc2ccccc2c(N(C)CCCc2[nH]nc(N)c2C#N)c1C	ZINC000302088367	456282926	/nfs/dbraw/zinc/28/29/26/456282926.db2.gz	OHQKPPRNOYYBHG-UHFFFAOYSA-N	0	3	334.427	3.098	20	30		EGEDHN
CCc1ccc(CN[C@@H]2CCCN(c3ccc(C#N)cc3F)C2)cn1	ZINC000352763764	456285216	/nfs/dbraw/zinc/28/52/16/456285216.db2.gz	HEKOUBURRSVSAK-GOSISDBHSA-N	0	3	338.430	3.413	20	30		EGEDHN
COc1cc(CN[C@@H](C)C[C@H](O)c2ccc(F)cc2)ccc1C#N	ZINC000281698605	456296126	/nfs/dbraw/zinc/29/61/26/456296126.db2.gz	NOCXVBWGBHYNHE-UGSOOPFHSA-N	0	3	328.387	3.308	20	30		EGEDHN
CCN1C[C@@H](C)N(Cc2ccc(C#N)cc2Br)[C@@H](C)C1	ZINC000347710261	456317772	/nfs/dbraw/zinc/31/77/72/456317772.db2.gz	SJROFODAHRVTCJ-BETUJISGSA-N	0	3	336.277	3.235	20	30		EGEDHN
COc1cccc(OC)c1OCCCCN(CCC#N)CC1CC1	ZINC000290404085	456317857	/nfs/dbraw/zinc/31/78/57/456317857.db2.gz	TVEQVUZPOQELAA-UHFFFAOYSA-N	0	3	332.444	3.488	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1C[C@@H](C)CC[C@H]1c1ccccc1	ZINC000352801774	456321377	/nfs/dbraw/zinc/32/13/77/456321377.db2.gz	UFLNIHGTUYQVAH-SCTDSRPQSA-N	0	3	327.472	3.468	20	30		EGEDHN
C=CCN1CC[C@H](NC2(c3ccc(Br)cc3)CCC2)C1=O	ZINC000337157603	456332000	/nfs/dbraw/zinc/33/20/00/456332000.db2.gz	PYMJOVQDCKUNAW-HNNXBMFYSA-N	0	3	349.272	3.205	20	30		EGEDHN
C=CCNC(=O)[C@@H](C)N[C@@H](Cc1ccccc1)c1ccc(OC)cc1	ZINC000290535745	456355710	/nfs/dbraw/zinc/35/57/10/456355710.db2.gz	LENHZLJDCCUALJ-UZLBHIALSA-N	0	3	338.451	3.259	20	30		EGEDHN
CN1CCN(CCCC2(C#N)CCOCC2)[C@H](c2ccccc2)C1	ZINC000282024172	456393150	/nfs/dbraw/zinc/39/31/50/456393150.db2.gz	PLUSTFLJSBNZOM-IBGZPJMESA-N	0	3	327.472	3.076	20	30		EGEDHN
N#Cc1cc(F)ccc1NC[C@H]1CN(Cc2ccccc2)CCCO1	ZINC000302798445	456403638	/nfs/dbraw/zinc/40/36/38/456403638.db2.gz	RLQRWKLYIHQBPZ-IBGZPJMESA-N	0	3	339.414	3.400	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCC1(c2ccccn2)CCC1	ZINC000343108441	456410942	/nfs/dbraw/zinc/41/09/42/456410942.db2.gz	REGDLOLOLOLRRI-SFHVURJKSA-N	0	3	333.435	3.392	20	30		EGEDHN
C=CCOCCCN1CCCC[C@@H]1CNC(=O)Nc1ccccc1	ZINC000348051071	456445549	/nfs/dbraw/zinc/44/55/49/456445549.db2.gz	QLFRBHCUAINFHL-GOSISDBHSA-N	0	3	331.460	3.255	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)NC[C@H](C)N1CCC[C@@H](C)C1	ZINC000303474412	456462195	/nfs/dbraw/zinc/46/21/95/456462195.db2.gz	OKXCDMZKOOXBMA-SJORKVTESA-N	0	3	345.487	3.171	20	30		EGEDHN
COc1ccc(CN2CC[C@H](OC)C[C@@H]2C)cc1OCCCC#N	ZINC000282307693	456472815	/nfs/dbraw/zinc/47/28/15/456472815.db2.gz	MTWNVMKZRRIFRN-RDJZCZTQSA-N	0	3	332.444	3.377	20	30		EGEDHN
C=CCOc1cccc(CNCc2ccc(C[S@@](C)=O)cc2)c1	ZINC000353115816	456499264	/nfs/dbraw/zinc/49/92/64/456499264.db2.gz	FJQJZOQQMXDVCZ-HSZRJFAPSA-N	0	3	329.465	3.420	20	30		EGEDHN
C=CCc1ccc(OC[C@H](O)CN2CCCC(C)(C)C2)c(OC)c1	ZINC000353249981	456586826	/nfs/dbraw/zinc/58/68/26/456586826.db2.gz	AQINEOMTRHOSOV-QGZVFWFLSA-N	0	3	333.472	3.285	20	30		EGEDHN
CC[C@H](C)N[C@@H](CNC(=O)Nc1ccc(C#N)cc1)c1ccco1	ZINC000353328393	456640981	/nfs/dbraw/zinc/64/09/81/456640981.db2.gz	HYAZPRDLHOLYOD-BBRMVZONSA-N	0	3	326.400	3.402	20	30		EGEDHN
CS[C@H]1CN(c2c(C#N)cnc3ccc(Cl)cc32)C[C@H]1N(C)C	ZINC000340740994	456660628	/nfs/dbraw/zinc/66/06/28/456660628.db2.gz	IUYMREPJXQYIEV-CVEARBPZSA-N	0	3	346.887	3.242	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCC[C@H]2OC(F)F)c(OC(F)F)c1	ZINC000348443878	456689829	/nfs/dbraw/zinc/68/98/29/456689829.db2.gz	AKMRZOQCTXRYCO-VXGBXAGGSA-N	0	3	332.297	3.410	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@H](NC[C@@H]1CN(Cc3ccccc3)CCO1)CC2	ZINC000353426627	456693007	/nfs/dbraw/zinc/69/30/07/456693007.db2.gz	NDZVEKSRKAYRHR-IFMALSPDSA-N	0	3	347.462	3.036	20	30		EGEDHN
CCCN(CC(=O)N[C@@](C)(C#N)C1CC1)[C@H]1CCc2ccccc21	ZINC000299450266	456696847	/nfs/dbraw/zinc/69/68/47/456696847.db2.gz	ZHCGFEWZPPTGNX-ICSRJNTNSA-N	0	3	325.456	3.194	20	30		EGEDHN
N#Cc1ccc(S(=O)(=O)CCN[C@H]2CCCCC23CCCC3)cc1	ZINC000326971947	456702338	/nfs/dbraw/zinc/70/23/38/456702338.db2.gz	HEMXVTWQQIDWTI-SFHVURJKSA-N	0	3	346.496	3.425	20	30		EGEDHN
C=CCN(Cc1cccc(C#N)c1)[C@H](C)c1cccc(-n2cnnn2)c1	ZINC000353493333	456713482	/nfs/dbraw/zinc/71/34/82/456713482.db2.gz	SOGUKIQRYBPVGD-MRXNPFEDSA-N	0	3	344.422	3.283	20	30		EGEDHN
C=CCN(Cc1cccc(O)c1)[C@H](C)c1cccc(-n2cnnn2)c1	ZINC000353500010	456719047	/nfs/dbraw/zinc/71/90/47/456719047.db2.gz	FHARCGFKHCBMJE-OAHLLOKOSA-N	0	3	335.411	3.117	20	30		EGEDHN
C=CCN(CCC(=O)Nc1ccccc1[N+](=O)[O-])CCc1ccco1	ZINC000283191708	456733662	/nfs/dbraw/zinc/73/36/62/456733662.db2.gz	FSWHVZBENINNAO-UHFFFAOYSA-N	0	3	343.383	3.247	20	30		EGEDHN
CCc1ccccc1NC(=O)[C@H](C)N1CCC[C@@H]1[C@@H]1COCC[C@@H]1O	ZINC000328691009	456737608	/nfs/dbraw/zinc/73/76/08/456737608.db2.gz	BVQMEYQVXJSPIL-WQCNXYOZSA-N	0	3	346.471	3.087	20	30		EGEDHN
Cc1cc(C)cc(NC(=O)[C@H](C)N2CCC[C@@H]2[C@@H]2COCC[C@@H]2O)c1	ZINC000328693858	456738646	/nfs/dbraw/zinc/73/86/46/456738646.db2.gz	CSMTWECORMUIFB-KANFNMMFSA-N	0	3	346.471	3.142	20	30		EGEDHN
Cn1nccc1CCC(=O)NCCN1CCC2(CCCCC2)CC1	ZINC000328727711	456747533	/nfs/dbraw/zinc/74/75/33/456747533.db2.gz	VFTJBNCCNZGLGB-UHFFFAOYSA-N	0	3	332.492	3.356	20	30		EGEDHN
CC[C@H](N[C@H](C)C(=O)N[C@](C)(C#N)C(C)C)c1ccc(OC)cc1	ZINC000340897796	456747945	/nfs/dbraw/zinc/74/79/45/456747945.db2.gz	KDNJLZPOBQGTDX-DKSSEZFCSA-N	0	3	331.460	3.179	20	30		EGEDHN
O=C(CCC(=O)N1CCN(CC2CCCCC2)CC1)NC1CCCC1	ZINC000328786686	456760815	/nfs/dbraw/zinc/76/08/15/456760815.db2.gz	OQJSJQCPWVVPHN-UHFFFAOYSA-N	0	3	349.519	3.390	20	30		EGEDHN
Cc1nc(-c2cccc(C)c2)[nH]c1C(=O)N[C@@H]1CN(C2CC2)C[C@@H]1C	ZINC000328798004	456763424	/nfs/dbraw/zinc/76/34/24/456763424.db2.gz	FQTOGHWIQAFGNK-SUMWQHHRSA-N	0	3	338.455	3.481	20	30		EGEDHN
Cc1c(C(=O)C(C#N)c2cc(C)nc(C)n2)cnn1Cc1ccccc1	ZINC000338316218	456768927	/nfs/dbraw/zinc/76/89/27/456768927.db2.gz	KGWXQOUREMMOPE-QGZVFWFLSA-N	0	3	345.406	3.137	20	30		EGEDHN
COc1ccccc1CNC(=O)[C@H](C)N1CC[C@@H](C2CCOCC2)C1	ZINC000328829080	456770092	/nfs/dbraw/zinc/77/00/92/456770092.db2.gz	KBPYIPIVGWXHNZ-MAUKXSAKSA-N	0	3	346.471	3.289	20	30		EGEDHN
C[C@H](NC(=O)C1CCCC1)C(=O)N1CCN(C2CCC(C)CC2)CC1	ZINC000328839933	456772189	/nfs/dbraw/zinc/77/21/89/456772189.db2.gz	YWKRSRGZKAOTMG-PQUAAJSLSA-N	0	3	349.519	3.245	20	30		EGEDHN
C[C@@H](C(=O)Nc1ccc2c(c1)OCO2)N1CC[C@H](C2CCOCC2)C1	ZINC000328855915	456776933	/nfs/dbraw/zinc/77/69/33/456776933.db2.gz	UCLOSFYXFJHCTC-ZFWWWQNUSA-N	0	3	346.427	3.140	20	30		EGEDHN
CC(C#N)C(=O)N1C[C@@H](C)O[C@H](c2cccc(C(F)(F)F)c2)C1	ZINC000343963910	456786208	/nfs/dbraw/zinc/78/62/08/456786208.db2.gz	GMQSARKXYRZICJ-GYSYKLTISA-N	0	3	326.318	3.153	20	30		EGEDHN
C[C@@H](CNC(=O)OC(C)(C)C)N[C@@H](C)c1ccc(OCC#N)cc1	ZINC000277354042	456792014	/nfs/dbraw/zinc/79/20/14/456792014.db2.gz	ZHJAYZCFPHVGRY-KBPBESRZSA-N	0	3	333.432	3.153	20	30		EGEDHN
CCN(CCC#N)C(=O)CN[C@@H](C)c1ccc(F)c2ccccc21	ZINC000344104231	456798196	/nfs/dbraw/zinc/79/81/96/456798196.db2.gz	OXAWPRBQPYNDAU-AWEZNQCLSA-N	0	3	327.403	3.392	20	30		EGEDHN
C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)c1ccc2c(c1)NC(=O)C2(C)C	ZINC000328954282	456799626	/nfs/dbraw/zinc/79/96/26/456799626.db2.gz	YJMBCGWBEPPKFN-BZNIZROVSA-N	0	3	327.428	3.353	20	30		EGEDHN
CC(C#N)C(=O)N1C[C@H](c2cccc(C(F)(F)F)c2)OC[C@@H]1C	ZINC000341000802	456808248	/nfs/dbraw/zinc/80/82/48/456808248.db2.gz	JCGUUUDVANGALO-UHIISALHSA-N	0	3	326.318	3.153	20	30		EGEDHN
Cc1cc(NC(=O)[C@H]2CCCN2C2CCOCC2)cc2n[nH]cc21	ZINC000328999967	456809717	/nfs/dbraw/zinc/80/97/17/456809717.db2.gz	HHWWPQMYCLOGOE-QGZVFWFLSA-N	0	3	328.416	3.103	20	30		EGEDHN
Cn1nccc1C1=C[C@H]2CC[C@@H](C1)N2CCCC1(C#N)CCOCC1	ZINC000283775501	456837595	/nfs/dbraw/zinc/83/75/95/456837595.db2.gz	QEFBKSFELWPDCM-MSOLQXFVSA-N	0	3	340.471	3.141	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cc(-c2ccco2)n[nH]1)C(C)C	ZINC000344787097	456859055	/nfs/dbraw/zinc/85/90/55/456859055.db2.gz	JTODNIPQMXIYFO-KRWDZBQOSA-N	0	3	342.443	3.098	20	30		EGEDHN
C=CCOc1cccnc1C(=O)Nc1cc(CN(C)C)ccc1C	ZINC000341447820	456864762	/nfs/dbraw/zinc/86/47/62/456864762.db2.gz	BOCJVAQGPBWMSY-UHFFFAOYSA-N	0	3	325.412	3.269	20	30		EGEDHN
N#CC(=C([O-])c1cncc(C(F)(F)F)c1)c1nc2ccccc2[nH]1	ZINC000344854462	456868924	/nfs/dbraw/zinc/86/89/24/456868924.db2.gz	XHAGSAPSJAKLAC-NSHDSACASA-N	0	3	330.269	3.467	20	30		EGEDHN
N#CC(C(=O)c1cncc(C(F)(F)F)c1)c1nc2ccccc2[nH]1	ZINC000344854462	456868929	/nfs/dbraw/zinc/86/89/29/456868929.db2.gz	XHAGSAPSJAKLAC-NSHDSACASA-N	0	3	330.269	3.467	20	30		EGEDHN
C[C@H](NC(=O)N[C@H]1CCOC2(CCCCC2)C1)C1=CCN(C)CC1	ZINC000329357590	456878600	/nfs/dbraw/zinc/87/86/00/456878600.db2.gz	WQQLCFYQNSKQQF-RDJZCZTQSA-N	0	3	335.492	3.022	20	30		EGEDHN
CN(C[C@H](O)COc1ccc(C(F)(F)F)cc1)[C@@H]1CC[C@@H](C#N)C1	ZINC000338994515	456891255	/nfs/dbraw/zinc/89/12/55/456891255.db2.gz	WWMICRFVQVHSBK-YUELXQCFSA-N	0	3	342.361	3.069	20	30		EGEDHN
C=CCc1cc(CN(C)C[C@@H](O)Cc2ccccc2)cc(OC)c1O	ZINC000353765567	456896598	/nfs/dbraw/zinc/89/65/98/456896598.db2.gz	DLVAQSPTBCUZSG-IBGZPJMESA-N	0	3	341.451	3.165	20	30		EGEDHN
C=CCC[C@@H](C)[NH2+]Cc1cccc(-c2n[n-]c(C(=O)OCC)n2)c1	ZINC000349274506	456928171	/nfs/dbraw/zinc/92/81/71/456928171.db2.gz	FXRKDWYUCLJNRT-CYBMUJFWSA-N	0	3	328.416	3.093	20	30		EGEDHN
[O-]C(N[C@@H]1CCSc2ccc(F)cc21)=[NH+][C@@H]1CCc2nc[nH]c2C1	ZINC000329732441	456933600	/nfs/dbraw/zinc/93/36/00/456933600.db2.gz	QDRFRDQFLLIGIH-DGCLKSJQSA-N	0	3	346.431	3.147	20	30		EGEDHN
[O-]C(N[C@@H]1CCSc2ccc(F)cc21)=[NH+][C@@H]1CCc2[nH]cnc2C1	ZINC000329732441	456933606	/nfs/dbraw/zinc/93/36/06/456933606.db2.gz	QDRFRDQFLLIGIH-DGCLKSJQSA-N	0	3	346.431	3.147	20	30		EGEDHN
Cc1c(C(=O)N[C@H](C)CN2CCC[C@H](C)C2)nnn1CC1CCCC1	ZINC000329842631	456949325	/nfs/dbraw/zinc/94/93/25/456949325.db2.gz	KLCATNJMFUDDQT-LSDHHAIUSA-N	0	3	347.507	3.202	20	30		EGEDHN
C[C@H](CN1C[C@H](C)C[C@H](C)C1)NC(=O)c1coc(C2CCOCC2)n1	ZINC000329933966	456963029	/nfs/dbraw/zinc/96/30/29/456963029.db2.gz	JMHKOLLOVMECOO-QLFBSQMISA-N	0	3	349.475	3.240	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)NC[C@@H](C)N2CCC(C)CC2)cc1	ZINC000345373091	456977215	/nfs/dbraw/zinc/97/72/15/456977215.db2.gz	BKTCYKJMNBUPGY-QGZVFWFLSA-N	0	3	345.487	3.171	20	30		EGEDHN
N#CC1(c2ccc(C(=O)N3CCCN(CC4CCC4)CC3)cc2)CC1	ZINC000339196967	456987623	/nfs/dbraw/zinc/98/76/23/456987623.db2.gz	VALIWWBFOUUGOO-UHFFFAOYSA-N	0	3	337.467	3.190	20	30		EGEDHN
C[C@H](C(=O)N[C@@H]1CC(=O)N(C2CCCCC2)C1)N1[C@H](C)CC[C@@H]1C	ZINC000330186502	456998328	/nfs/dbraw/zinc/99/83/28/456998328.db2.gz	JVHGZQDTUURLJR-QKPAOTATSA-N	0	3	335.492	3.138	20	30		EGEDHN
CC[C@H](NCc1cccc(OCCCC#N)c1)[C@H](O)C(F)(F)F	ZINC000345816298	456999606	/nfs/dbraw/zinc/99/96/06/456999606.db2.gz	LBDQLHKNJCCJGX-GJZGRUSLSA-N	0	3	330.350	3.161	20	30		EGEDHN
C=C[C@@H](C)NC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1	ZINC000362613619	457005517	/nfs/dbraw/zinc/00/55/17/457005517.db2.gz	KUEPBJSTPFNGFF-CZUORRHYSA-N	0	3	326.362	3.132	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2CCN([C@@H]3C[C@@H]3C)C[C@@H](C)C2)cc1	ZINC000346161861	457021525	/nfs/dbraw/zinc/02/15/25/457021525.db2.gz	NFLKAUGZIYMFQV-JTDSTZFVSA-N	0	3	328.456	3.054	20	30		EGEDHN
COCCOc1ccccc1N1CCN(CC(C)(C)CCC#N)CC1	ZINC000354073646	457044366	/nfs/dbraw/zinc/04/43/66/457044366.db2.gz	QDBYIJNXRQUNCX-UHFFFAOYSA-N	0	3	345.487	3.164	20	30		EGEDHN
CCN(CCC#N)C(=O)CN1CC[C@H](Cc2ccc(C(C)C)cc2)C1	ZINC000359291572	457071349	/nfs/dbraw/zinc/07/13/49/457071349.db2.gz	NOPWXWJMMHNURC-LJQANCHMSA-N	0	3	341.499	3.437	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCN(Cc2ccccc2)C2(CCCCC2)C1	ZINC000359367717	457076726	/nfs/dbraw/zinc/07/67/26/457076726.db2.gz	DQDQXGXLCUCJJL-KRWDZBQOSA-N	0	3	325.456	3.193	20	30		EGEDHN
CC(C#N)C(=O)N1CCN(Cc2ccccc2)C2(CCCCC2)C1	ZINC000359367717	457076731	/nfs/dbraw/zinc/07/67/31/457076731.db2.gz	DQDQXGXLCUCJJL-KRWDZBQOSA-N	0	3	325.456	3.193	20	30		EGEDHN
C[C@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1F)N1CCC[C@@H](C)C1	ZINC000330848990	457093994	/nfs/dbraw/zinc/09/39/94/457093994.db2.gz	MMKMPMHXADGZSU-VXGBXAGGSA-N	0	3	338.383	3.180	20	30		EGEDHN
COc1ccc(CN[C@@H](C)c2cc[nH]c(=O)c2)cc1OCCCC#N	ZINC000339456177	457125040	/nfs/dbraw/zinc/12/50/40/457125040.db2.gz	UPHDMLGPVXMNFT-AWEZNQCLSA-N	0	3	341.411	3.329	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H]1C)OCC	ZINC000359829599	457134010	/nfs/dbraw/zinc/13/40/10/457134010.db2.gz	FYQRDWZDLWKRQV-NEWSRXKRSA-N	0	3	330.472	3.137	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN(C)CCCOc1ccccc1	ZINC000354236625	457147746	/nfs/dbraw/zinc/14/77/46/457147746.db2.gz	DUHIKLOHAWWFQI-UHFFFAOYSA-N	0	3	340.423	3.347	20	30		EGEDHN
COc1ccc(OC(F)(F)F)c(C(=O)N[C@@H]2CCN(C)[C@@H](C)C2)c1	ZINC000331322266	457167235	/nfs/dbraw/zinc/16/72/35/457167235.db2.gz	MGKCWXIRHSBPNR-WDEREUQCSA-N	0	3	346.349	3.381	20	30		EGEDHN
C=CCc1cc(CNC[C@](C)(CO)c2ccccc2)cc(OC)c1O	ZINC000342212176	457171823	/nfs/dbraw/zinc/17/18/23/457171823.db2.gz	NFQDNQOPDJUJIR-OAQYLSRUSA-N	0	3	341.451	3.169	20	30		EGEDHN
N#Cc1ccccc1NC(=O)CCN1CC[C@H](Oc2ccccc2)C1	ZINC000362953762	457172824	/nfs/dbraw/zinc/17/28/24/457172824.db2.gz	YOOCSPUMNJAFPJ-SFHVURJKSA-N	0	3	335.407	3.040	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N2CCC(C)(C)CC2)cc1	ZINC000350916556	457210987	/nfs/dbraw/zinc/21/09/87/457210987.db2.gz	FDPIUBBZIPASOP-CYBMUJFWSA-N	0	3	349.456	3.026	20	30		EGEDHN
C[C@H](CO)N(Cc1ccc(Br)cc1C#N)CC1CCC1	ZINC000347094303	457226711	/nfs/dbraw/zinc/22/67/11/457226711.db2.gz	QXBSWTUAKWWOBN-GFCCVEGCSA-N	0	3	337.261	3.304	20	30		EGEDHN
CN(CCC#N)C(=O)CCNC1(c2cccc(C(F)(F)F)c2)CC1	ZINC000356989291	457261474	/nfs/dbraw/zinc/26/14/74/457261474.db2.gz	RXHCGNMMUZLAEB-UHFFFAOYSA-N	0	3	339.361	3.046	20	30		EGEDHN
CC(=O)Nc1c[nH]nc1[C@H]1CCCN([C@H](C)c2ccc(C#N)cc2)C1	ZINC000332316483	457346977	/nfs/dbraw/zinc/34/69/77/457346977.db2.gz	KLTVFGPNCQMTBQ-DYVFJYSZSA-N	0	3	337.427	3.180	20	30		EGEDHN
N#Cc1cccc(CN[C@@H]2CC(=O)N(c3ccccc3Cl)C2)c1	ZINC000363618069	457383533	/nfs/dbraw/zinc/38/35/33/457383533.db2.gz	PGNQPSNXKXOYJI-OAHLLOKOSA-N	0	3	325.799	3.107	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC(CN3C[C@H](C)O[C@@H](C)C3)CC2)CC1	ZINC000355554854	457388956	/nfs/dbraw/zinc/38/89/56/457388956.db2.gz	XRUNLIUYGRJXBV-IRXDYDNUSA-N	0	3	334.504	3.081	20	30		EGEDHN
CCCCCCCC(=O)N1CCC(N2CCN(C(C)C)CC2)CC1	ZINC000378324665	457389364	/nfs/dbraw/zinc/38/93/64/457389364.db2.gz	XXIBHWGFMBQWCG-UHFFFAOYSA-N	0	3	337.552	3.364	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1	ZINC000352474335	457394898	/nfs/dbraw/zinc/39/48/98/457394898.db2.gz	GCJISQVURHHKPT-YVWKXTFCSA-N	0	3	330.472	3.167	20	30		EGEDHN
COC(=O)COc1ccc([C@@H](C)NCc2ccc(CC#N)cc2)cc1	ZINC000342629182	457415541	/nfs/dbraw/zinc/41/55/41/457415541.db2.gz	DLUTXGQIKLMDOC-OAHLLOKOSA-N	0	3	338.407	3.155	20	30		EGEDHN
CC1CC(C#N)(C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)C1	ZINC000379718139	457418809	/nfs/dbraw/zinc/41/88/09/457418809.db2.gz	QEIUEERHSQSWPA-CAZWYBIWSA-N	0	3	325.456	3.096	20	30		EGEDHN
CN(Cc1ccc(CC#N)cc1)Cc1ccccc1N1CCOCC1	ZINC000342699207	457463892	/nfs/dbraw/zinc/46/38/92/457463892.db2.gz	VRFPFYBTPBLSKB-UHFFFAOYSA-N	0	3	335.451	3.221	20	30		EGEDHN
COC[C@@H]1CCCCN([C@H](C)C(=O)N(C)C2(C#N)CCC(C)CC2)C1	ZINC000342740488	457491016	/nfs/dbraw/zinc/49/10/16/457491016.db2.gz	KSMOERKKMDEZIH-SFANZJOMSA-N	0	3	349.519	3.054	20	30		EGEDHN
C[C@H]1[C@H](c2ccccc2)CCN1CC(=O)NCc1ccc(C#N)cc1	ZINC000374202095	457521738	/nfs/dbraw/zinc/52/17/38/457521738.db2.gz	ZBWGRXVSJIHRCP-OXJNMPFZSA-N	0	3	333.435	3.052	20	30		EGEDHN
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NCc3ccc(C#N)o3)C[C@@H]2C1	ZINC000401121713	457524585	/nfs/dbraw/zinc/52/45/85/457524585.db2.gz	OOAPMHJYJPMWIF-ZNMIVQPWSA-N	0	3	345.443	3.276	20	30		EGEDHN
C=CCCCCCN1CCCN(Cc2nc([C@H](C)OC)no2)CC1	ZINC000370094699	457542568	/nfs/dbraw/zinc/54/25/68/457542568.db2.gz	ZTQWSEDSSUTGAZ-INIZCTEOSA-N	0	3	336.480	3.031	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@H](C)N1CCC(CCCn2ccnc2)CC1	ZINC000361058461	457553719	/nfs/dbraw/zinc/55/37/19/457553719.db2.gz	QDLDRSFQIZETMR-SFHVURJKSA-N	0	3	346.519	3.188	20	30		EGEDHN
CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H](CC#N)c1ccccc1	ZINC000356267523	457555473	/nfs/dbraw/zinc/55/54/73/457555473.db2.gz	BPQGYFJMAPNVFY-QRVBRYPASA-N	0	3	325.456	3.159	20	30		EGEDHN
CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@H](CC#N)c1ccccc1	ZINC000356267522	457555641	/nfs/dbraw/zinc/55/56/41/457555641.db2.gz	BPQGYFJMAPNVFY-OTWHNJEPSA-N	0	3	325.456	3.159	20	30		EGEDHN
C[C@H](CN1CCC[C@@H](C)C1)NC(=O)N(C)[C@H](C)c1cccc(C#N)c1	ZINC000425474605	457570006	/nfs/dbraw/zinc/57/00/06/457570006.db2.gz	LHBVPRQIXCQWPL-BRWVUGGUSA-N	0	3	342.487	3.381	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)N[C@@H]2CC[C@H](C#N)C2)CCN1Cc1ccccc1	ZINC000425497009	457577094	/nfs/dbraw/zinc/57/70/94/457577094.db2.gz	WEZXTLIVBQHFMQ-GDAAHCPNSA-N	0	3	340.471	3.031	20	30		EGEDHN
CN(C)CCN(Cc1cccc(Cl)c1)C(=O)N[C@@H]1CC[C@H](C#N)C1	ZINC000425845343	457645742	/nfs/dbraw/zinc/64/57/42/457645742.db2.gz	MEXLJQTUCCCDOW-WMLDXEAASA-N	0	3	348.878	3.105	20	30		EGEDHN
CN1CC[C@H]2[C@@H](CCCN2C(=O)C(C)(C)Cc2ccc(C#N)cc2)C1	ZINC000410596356	457650698	/nfs/dbraw/zinc/65/06/98/457650698.db2.gz	ZCXPNGINICOURV-OALUTQOASA-N	0	3	339.483	3.070	20	30		EGEDHN
FC(F)(F)Oc1ccc(C#CCN[C@@H]2CCO[C@@H]2C2CC2)cc1	ZINC000364779147	457691761	/nfs/dbraw/zinc/69/17/61/457691761.db2.gz	FQIAGRHFVULNOH-HZPDHXFCSA-N	0	3	325.330	3.094	20	30		EGEDHN
CC(C#N)C(=O)N1CCC[C@H]1C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000357797133	457693703	/nfs/dbraw/zinc/69/37/03/457693703.db2.gz	LEXUJMPSUNSHRJ-RNCFNFMXSA-N	0	3	340.210	3.083	20	30		EGEDHN
C#CCOc1ccc([C@@H](C)NCc2ccc(-n3ccnc3)nc2)cc1	ZINC000370670222	457696548	/nfs/dbraw/zinc/69/65/48/457696548.db2.gz	YJYOLQZQDVZFNL-MRXNPFEDSA-N	0	3	332.407	3.130	20	30		EGEDHN
N#Cc1cccc(OCCN2CC[C@@H](n3ncc4ccccc43)C2)c1	ZINC000374736155	457697359	/nfs/dbraw/zinc/69/73/59/457697359.db2.gz	QWAAKVUMDVJQLS-GOSISDBHSA-N	0	3	332.407	3.234	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H](C)[C@@H](c1ccccc1C)N(C)C	ZINC000357852649	457712653	/nfs/dbraw/zinc/71/26/53/457712653.db2.gz	BPLXNMSDMYEBTN-APWZRJJASA-N	0	3	325.456	3.404	20	30		EGEDHN
CN1CCN(CC2(C)CCN(c3cc(Cl)ccc3C#N)CC2)CC1	ZINC000364940057	457718670	/nfs/dbraw/zinc/71/86/70/457718670.db2.gz	BHZRCYLYMFTUSF-UHFFFAOYSA-N	0	3	346.906	3.066	20	30		EGEDHN
CN(CCOc1ccc(Br)cc1)Cc1cc(C#N)n(C)c1	ZINC000361501201	457758401	/nfs/dbraw/zinc/75/84/01/457758401.db2.gz	NSGBIOYMYMGWMK-UHFFFAOYSA-N	0	3	348.244	3.170	20	30		EGEDHN
Cc1nc2ccccc2n1CCNC(=O)C(C#N)CCc1ccccc1	ZINC000433154752	457765269	/nfs/dbraw/zinc/76/52/69/457765269.db2.gz	UXNIULYEXRZTCD-GOSISDBHSA-N	0	3	346.434	3.234	20	30		EGEDHN
C[C@@H](CNc1ccc(C(F)(F)F)c(C#N)n1)N(C)Cc1ccccc1	ZINC000443509857	457772542	/nfs/dbraw/zinc/77/25/42/457772542.db2.gz	KQRFOHQYFIBVQU-ZDUSSCGKSA-N	0	3	348.372	3.326	20	30		EGEDHN
C[C@@H](CNC(=O)Nc1ccc(C#N)cc1Cl)N1CCC(C)CC1	ZINC000426165639	457781031	/nfs/dbraw/zinc/78/10/31/457781031.db2.gz	ZXRJJLDRIVOXDP-ZDUSSCGKSA-N	0	3	334.851	3.454	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2cncc(-c3ccc(C)cc3)c2)CC1	ZINC000366068817	457791132	/nfs/dbraw/zinc/79/11/32/457791132.db2.gz	QWSDWCKNSLKTED-UHFFFAOYSA-N	0	3	347.462	3.275	20	30		EGEDHN
CC1(C)CN(C(=O)C(C#N)CCc2ccccc2)[C@H]1[C@@H]1CCCO1	ZINC000426238478	457792011	/nfs/dbraw/zinc/79/20/11/457792011.db2.gz	LNPUHXIYSQHRRY-BZSNNMDCSA-N	0	3	326.440	3.175	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCCc1ccc([N+](=O)[O-])cc1	ZINC000433309730	457805678	/nfs/dbraw/zinc/80/56/78/457805678.db2.gz	COEXXLCBFUZRIA-KRWDZBQOSA-N	0	3	337.379	3.026	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N(C)Cc1cccc(C)n1)C(C)C	ZINC000457736991	457811316	/nfs/dbraw/zinc/81/13/16/457811316.db2.gz	DMFMSMIWZGYWHQ-IBGZPJMESA-N	0	3	344.503	3.230	20	30		EGEDHN
C[C@@H](CNC(=O)C(C#N)CCc1ccccc1)Oc1ccccc1F	ZINC000433379208	457825201	/nfs/dbraw/zinc/82/52/01/457825201.db2.gz	SVXSSUWMEZDVHT-DOTOQJQBSA-N	0	3	340.398	3.482	20	30		EGEDHN
C[C@H](CN(C)C(=O)C(C#N)CCc1ccccc1)c1nccs1	ZINC000433382792	457826223	/nfs/dbraw/zinc/82/62/23/457826223.db2.gz	PXJXBMFONFOPQL-GDBMZVCRSA-N	0	3	327.453	3.478	20	30		EGEDHN
CCO[C@@H]1C[C@@H](N(C)C(=O)C(C#N)CCc2ccccc2)C1(C)C	ZINC000433479982	457839830	/nfs/dbraw/zinc/83/98/30/457839830.db2.gz	ZPHHENPYJQXBQH-KZNAEPCWSA-N	0	3	328.456	3.421	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)[C@@H]1C[C@H]1c1cccc(O)c1)C(C)C	ZINC000411371861	457868559	/nfs/dbraw/zinc/86/85/59/457868559.db2.gz	ZAPBAXGQYAXPQS-XUVXKRRUSA-N	0	3	342.483	3.311	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)NC[C@@H]1CCCCN1C1CC1	ZINC000433944130	457918008	/nfs/dbraw/zinc/91/80/08/457918008.db2.gz	XOVGGMJDZMPESP-INIZCTEOSA-N	0	3	333.501	3.463	20	30		EGEDHN
C=CCN(C)CCN(CC)CC(=O)N1CCc2sccc2[C@H]1CC	ZINC000411634684	457935479	/nfs/dbraw/zinc/93/54/79/457935479.db2.gz	ANAWVBFMVPUBNI-QGZVFWFLSA-N	0	3	349.544	3.024	20	30		EGEDHN
Cc1cc(NC(=O)c2ccc(C#N)s2)ccc1OCCN(C)C	ZINC000458192944	457963603	/nfs/dbraw/zinc/96/36/03/457963603.db2.gz	HYDQPSNUZIYKES-UHFFFAOYSA-N	0	3	329.425	3.121	20	30		EGEDHN
CN(C)CCN(Cc1ccsc1)C(=O)c1cccc(CC#N)c1	ZINC000458204463	457968227	/nfs/dbraw/zinc/96/82/27/457968227.db2.gz	QMYUOVODHLZSRF-UHFFFAOYSA-N	0	3	327.453	3.018	20	30		EGEDHN
N#CC1(CCNC2(C(N)=O)C3CC4CC(C3)CC2C4)CCCCC1	ZINC000411823775	457987316	/nfs/dbraw/zinc/98/73/16/457987316.db2.gz	PWTZAKFYOAVPLZ-UHFFFAOYSA-N	0	3	329.488	3.120	20	30		EGEDHN
CCN(CCC#N)C(=O)CN[C@@H]1CCCC[C@H]1Oc1ccccc1C	ZINC000362017202	458006861	/nfs/dbraw/zinc/00/68/61/458006861.db2.gz	BSDDVZLIOUWGAQ-IEBWSBKVSA-N	0	3	343.471	3.037	20	30		EGEDHN
N#Cc1cccc(CNC(=O)CN[C@@H]2CCC[C@H]2c2ccccc2)c1	ZINC000368437895	458038021	/nfs/dbraw/zinc/03/80/21/458038021.db2.gz	HTUOWNFSVJDACA-VQTJNVASSA-N	0	3	333.435	3.100	20	30		EGEDHN
CC(C)(C)C[C@H]1CCN(CC(=O)N(CCC#N)CCC#N)C1(C)C	ZINC000412029026	458051985	/nfs/dbraw/zinc/05/19/85/458051985.db2.gz	CDUQLUYCNXOSEZ-MRXNPFEDSA-N	0	3	332.492	3.179	20	30		EGEDHN
CC(C)(C)CCN1CCN(C(=O)Nc2ccc(F)cc2C#N)CC1	ZINC000435163328	458098560	/nfs/dbraw/zinc/09/85/60/458098560.db2.gz	XZXMDCJVQAQIIN-UHFFFAOYSA-N	0	3	332.423	3.283	20	30		EGEDHN
CC(C)N1CC[C@@H](N(C)C(=O)N[C@@H](CCC#N)c2ccccc2)C1	ZINC000458579457	458100281	/nfs/dbraw/zinc/10/02/81/458100281.db2.gz	NJXVJAGTYIIFLD-MSOLQXFVSA-N	0	3	328.460	3.156	20	30		EGEDHN
Cc1ccc(C)c(OCCN2CC[C@H](Oc3ccc(C#N)cn3)C2)c1	ZINC000428778015	458210567	/nfs/dbraw/zinc/21/05/67/458210567.db2.gz	HWOHKWLHWUEPJR-SFHVURJKSA-N	0	3	337.423	3.102	20	30		EGEDHN
C=C(CC)CNC(=O)N(CCN(C)C)Cc1ccc(F)cc1F	ZINC000459075938	458259655	/nfs/dbraw/zinc/25/96/55/458259655.db2.gz	MAGYFBGZJVJPRE-UHFFFAOYSA-N	0	3	325.403	3.004	20	30		EGEDHN
C=CCCC[C@@H](C)NC(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000369644833	458301664	/nfs/dbraw/zinc/30/16/64/458301664.db2.gz	APXOQTCNIMCMMU-NEWSRXKRSA-N	0	3	344.503	3.461	20	30		EGEDHN
C[C@@H](C(=O)Nc1cc(C#N)ccc1NC1CC1)N1[C@H](C)CC[C@@H]1C	ZINC000413766894	458306321	/nfs/dbraw/zinc/30/63/21/458306321.db2.gz	LZIIRWKFWCSWHS-MJBXVCDLSA-N	0	3	326.444	3.332	20	30		EGEDHN
CN(C(=O)NCC(C)(C)CC#N)C1CCN(Cc2ccccc2)CC1	ZINC000459262231	458306968	/nfs/dbraw/zinc/30/69/68/458306968.db2.gz	UQAFBZIVOAPZEJ-UHFFFAOYSA-N	0	3	342.487	3.232	20	30		EGEDHN
CN(CCC#N)C[C@@H](O)CN1CC2(CCCCC2)[C@@H]1c1ccccc1	ZINC000414135684	458315109	/nfs/dbraw/zinc/31/51/09/458315109.db2.gz	DOGKVSJRCAPJHO-UXHICEINSA-N	0	3	341.499	3.200	20	30		EGEDHN
CC(C)c1ccc([C@H](N)CNC(=O)NCC#Cc2ccccc2)cc1	ZINC000416955368	458358682	/nfs/dbraw/zinc/35/86/82/458358682.db2.gz	XIAIWJKKQDAUKG-HXUWFJFHSA-N	0	3	335.451	3.161	20	30		EGEDHN
C=CCSCCNC(=O)N[C@@H](CN)c1ccc2ccccc2c1	ZINC000417342819	458362437	/nfs/dbraw/zinc/36/24/37/458362437.db2.gz	NIDXYKNZAASXRU-KRWDZBQOSA-N	0	3	329.469	3.058	20	30		EGEDHN
CN1CCCC(C)(C)[C@@H]1CNC(=O)N[C@H](CCC#N)c1ccccc1	ZINC000447962235	458371578	/nfs/dbraw/zinc/37/15/78/458371578.db2.gz	KEBSDYOZVMDAKR-MSOLQXFVSA-N	0	3	342.487	3.451	20	30		EGEDHN
COCCCCN(C)[C@@H](C)C(=O)N(CCC#N)c1cc(C)cc(C)c1	ZINC000419384882	458381123	/nfs/dbraw/zinc/38/11/23/458381123.db2.gz	KMEXKYYGARDQIT-SFHVURJKSA-N	0	3	345.487	3.297	20	30		EGEDHN
N#CCCn1cc(CN2C[C@H](C3CC3)[C@@H]2C2CC2)c(-c2ccncc2)n1	ZINC000449543137	458426061	/nfs/dbraw/zinc/42/60/61/458426061.db2.gz	SEPNDFOETNTRPW-CTNGQTDRSA-N	0	3	347.466	3.479	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCc1cc(OC)ccc1Br	ZINC000449548855	458426184	/nfs/dbraw/zinc/42/61/84/458426184.db2.gz	RINISRHLCQUNEP-CABCVRRESA-N	0	3	326.234	3.281	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCc1ccc(OC)c(Br)c1	ZINC000449546274	458426406	/nfs/dbraw/zinc/42/64/06/458426406.db2.gz	BIJAIOXJYMPOTO-KGLIPLIRSA-N	0	3	326.234	3.281	20	30		EGEDHN
C[C@@H]1C[C@@]1(C#N)C(=O)N1CC[C@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000450024715	458437439	/nfs/dbraw/zinc/43/74/39/458437439.db2.gz	QNFIUICEBUBJDQ-UIFIKXQLSA-N	0	3	337.467	3.051	20	30		EGEDHN
CC[C@@H]1OCC[C@H]1N[C@H](C)C(=O)N(CCC#N)c1cc(C)cc(C)c1	ZINC000459780630	458478133	/nfs/dbraw/zinc/47/81/33/458478133.db2.gz	RFUKQTSPLWWFON-QRQLOZEOSA-N	0	3	343.471	3.096	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@H]1C[C@H](OC)C1(C)C	ZINC000451490505	458478395	/nfs/dbraw/zinc/47/83/95/458478395.db2.gz	IDAOWFWJCVSTFQ-HOTGVXAUSA-N	0	3	334.485	3.306	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1N[C@H](C)c1ccc(I)cc1	ZINC000453355385	458524759	/nfs/dbraw/zinc/52/47/59/458524759.db2.gz	LKMXBRAJKMSRIL-HONMWMINSA-N	0	3	343.208	3.285	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(CC)[C@H]2CCOC(C)(C)C2)CC1	ZINC000460252522	458508319	/nfs/dbraw/zinc/50/83/19/458508319.db2.gz	AJNCIANYTZTACZ-KRWDZBQOSA-N	0	3	337.508	3.016	20	30		EGEDHN
C=C(C)Cn1c(CC(C)C)nnc1N1CCN([C@@H]2C[C@@H]2C)C[C@H](C)C1	ZINC000453452110	458532111	/nfs/dbraw/zinc/53/21/11/458532111.db2.gz	LONQDNNPSPOYIC-OKZBNKHCSA-N	0	3	345.535	3.219	20	30		EGEDHN
CCc1ccc(-c2csc(NC(=O)[C@H](N)CCCC#N)n2)cc1	ZINC000424083423	458554801	/nfs/dbraw/zinc/55/48/01/458554801.db2.gz	XKBSPIFVPBLAQP-CQSZACIVSA-N	0	3	328.441	3.332	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N(Cc1ccccc1C(F)(F)F)C1CC1	ZINC000424089686	458557306	/nfs/dbraw/zinc/55/73/06/458557306.db2.gz	IBAINKBQMVYRLF-OAHLLOKOSA-N	0	3	339.361	3.218	20	30		EGEDHN
COc1ccc(C2(CNC(=O)[C@H](N)CCCC#N)CCCCC2)cc1	ZINC000424104403	458559178	/nfs/dbraw/zinc/55/91/78/458559178.db2.gz	OLWGNVRPZQLVDJ-GOSISDBHSA-N	0	3	343.471	3.034	20	30		EGEDHN
Cc1cccc(C)c1OC[C@@H](NC(=O)[C@@H](N)CCCC#N)C(C)(C)C	ZINC000424145868	458570660	/nfs/dbraw/zinc/57/06/60/458570660.db2.gz	ZTNWCXUFUFECDA-DLBZAZTESA-N	0	3	345.487	3.234	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1ccc(Cn2cnc3ccccc32)cc1	ZINC000424162409	458575424	/nfs/dbraw/zinc/57/54/24/458575424.db2.gz	WTPXOJORZZBQCS-KRWDZBQOSA-N	0	3	347.422	3.044	20	30		EGEDHN
CN(C(=O)[C@@H](N)CCCC#N)c1ccc(OCc2ccccc2)cc1	ZINC000424194379	458581535	/nfs/dbraw/zinc/58/15/35/458581535.db2.gz	WJZLPWHDLXVNSV-IBGZPJMESA-N	0	3	337.423	3.250	20	30		EGEDHN
CCN1CCC[C@H]1CN(C)C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000455706679	458607732	/nfs/dbraw/zinc/60/77/32/458607732.db2.gz	QNYPOYPPCLNBAT-AWEZNQCLSA-N	0	3	334.851	3.354	20	30		EGEDHN
C[C@H](CNC(=O)Nc1cccc(CC#N)c1)N(C)Cc1ccccc1	ZINC000455916256	458621379	/nfs/dbraw/zinc/62/13/79/458621379.db2.gz	IDDYOPJPTPZASS-MRXNPFEDSA-N	0	3	336.439	3.395	20	30		EGEDHN
C[C@H]1CCN(CC(=O)NCc2cccc(C#N)c2)CC12CCCCC2	ZINC000462455422	458622937	/nfs/dbraw/zinc/62/29/37/458622937.db2.gz	ROLBBZYFGWDVBS-KRWDZBQOSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N1CCN(Cc2ccccc2)C[C@H](C)C1	ZINC000456321513	458637559	/nfs/dbraw/zinc/63/75/59/458637559.db2.gz	CUTGRXYYYOEKGY-GHTZIAJQSA-N	0	3	344.499	3.196	20	30		EGEDHN
Cc1cc(C)cc(N(CCC#N)C(=O)[C@H](C)N[C@@]2(C)CCO[C@@H]2C)c1	ZINC000494277158	458652760	/nfs/dbraw/zinc/65/27/60/458652760.db2.gz	OQRVZFNSKRXAFN-QKLQHJQFSA-N	0	3	343.471	3.096	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@H](c3ccccc3)C2)CC1	ZINC000431976146	458655697	/nfs/dbraw/zinc/65/56/97/458655697.db2.gz	ALORPBSKCLFAON-SFHVURJKSA-N	0	3	327.472	3.226	20	30		EGEDHN
C[C@@H]1CCCC[C@H]1C(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000424610755	458679757	/nfs/dbraw/zinc/67/97/57/458679757.db2.gz	CCCFRUZCGOBMHP-VQIMIIECSA-N	0	3	327.472	3.275	20	30		EGEDHN
C=CCCCNC(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000503361840	458704368	/nfs/dbraw/zinc/70/43/68/458704368.db2.gz	NQSWSFNACCYYLG-GOSISDBHSA-N	0	3	333.476	3.342	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CCC[C@H](OCC2CC2)C1	ZINC000494660527	458722813	/nfs/dbraw/zinc/72/28/13/458722813.db2.gz	GBLVLQRKYPTSCN-UXHICEINSA-N	0	3	345.483	3.046	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N[C@@H]1C[C@@H](OC)C1(C)C	ZINC000439626761	458734258	/nfs/dbraw/zinc/73/42/58/458734258.db2.gz	YRQPRJIBWUMGRJ-NUEKZKHPSA-N	0	3	336.501	3.054	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1SCCCCF	ZINC000505456085	458743857	/nfs/dbraw/zinc/74/38/57/458743857.db2.gz	VJFFOYUDRQQGSD-UHFFFAOYSA-N	0	3	326.485	3.334	20	30		EGEDHN
C=C(C)CN(Cc1ccccc1)C(=O)N[C@@H]1C[C@@H](C)N(C2CC2)C1	ZINC000472036202	458762353	/nfs/dbraw/zinc/76/23/53/458762353.db2.gz	BWMUJSOHZNGVQJ-SJLPKXTDSA-N	0	3	327.472	3.400	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)c2cccc(F)c2C#N)N(C)C)cc1	ZINC000494911580	458764879	/nfs/dbraw/zinc/76/48/79/458764879.db2.gz	TZBLQXHRTUNFHR-IBGZPJMESA-N	0	3	339.414	3.292	20	30		EGEDHN
N#Cc1cccc(NC(=O)C2CCN(C/C=C/c3ccncc3)CC2)c1	ZINC000494982917	458778186	/nfs/dbraw/zinc/77/81/86/458778186.db2.gz	YXYPFNUJSSJCOL-DUXPYHPUSA-N	0	3	346.434	3.317	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)NCC#Cc1ccccc1)c1ccccc1	ZINC000514438337	458797449	/nfs/dbraw/zinc/79/74/49/458797449.db2.gz	UUZJJSXQPYEDJX-NRFANRHFSA-N	0	3	349.478	3.420	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NC[C@@H]1CCOC2(CCC2)C1	ZINC000515464483	458809412	/nfs/dbraw/zinc/80/94/12/458809412.db2.gz	KVROVZSJGHCZID-QZTJIDSGSA-N	0	3	326.440	3.224	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@H]1CCCN(Cc2ccc(CC#N)cc2)C1	ZINC000495256394	458821249	/nfs/dbraw/zinc/82/12/49/458821249.db2.gz	YRTGAEYDANEVBQ-SFHVURJKSA-N	0	3	343.471	3.489	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@H](NCc1cccc(C#N)c1F)C1CC1	ZINC000495271227	458823772	/nfs/dbraw/zinc/82/37/72/458823772.db2.gz	QESHJEYGJWMPRE-OAHLLOKOSA-N	0	3	333.407	3.090	20	30		EGEDHN
Cc1cc(CN2CC[C@@H](Oc3ccc(C#N)cn3)C2)cc2cccnc12	ZINC000517478814	458829576	/nfs/dbraw/zinc/82/95/76/458829576.db2.gz	BTTMIJZTHFHOLS-LJQANCHMSA-N	0	3	344.418	3.463	20	30		EGEDHN
O[C@@H]1CCN(CC#Cc2ccc(OC(F)(F)F)cc2)C12CCCC2	ZINC000433035484	458831114	/nfs/dbraw/zinc/83/11/14/458831114.db2.gz	MNPMDACFGXSLHS-MRXNPFEDSA-N	0	3	339.357	3.316	20	30		EGEDHN
CC1(CNCCS(=O)(=O)c2ccc(C#N)cc2)CCCCCC1	ZINC000518362631	458861422	/nfs/dbraw/zinc/86/14/22/458861422.db2.gz	PYWHOGLUHCOVPR-UHFFFAOYSA-N	0	3	334.485	3.282	20	30		EGEDHN
C=CCN1CCC(NC(=O)C(C)(C)Oc2ccc(OCC)cc2)CC1	ZINC000552526896	458892089	/nfs/dbraw/zinc/89/20/89/458892089.db2.gz	QFTHGIIZMXGJOX-UHFFFAOYSA-N	0	3	346.471	3.009	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@H]1CCCN(C)[C@@H]1c1ccccc1	ZINC000552657587	458892160	/nfs/dbraw/zinc/89/21/60/458892160.db2.gz	ASCJCKVSYSKFML-UYAOXDASSA-N	0	3	337.467	3.487	20	30		EGEDHN
CC(C)(C)c1ccc(OC[C@H](O)CNCc2cccc(C#N)c2)cc1	ZINC000518964050	458902762	/nfs/dbraw/zinc/90/27/62/458902762.db2.gz	XVKJKDVWRAMSGM-LJQANCHMSA-N	0	3	338.451	3.385	20	30		EGEDHN
C=CCOc1ccccc1CN1CCC[C@@H](c2nc(N(C)C)no2)C1	ZINC000556045133	458924978	/nfs/dbraw/zinc/92/49/78/458924978.db2.gz	XIMUTKIUEDRLMP-MRXNPFEDSA-N	0	3	342.443	3.080	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@]2(C1)CCCN([C@H]1CC[C@@H](C#N)C1)C2	ZINC000495794357	458957332	/nfs/dbraw/zinc/95/73/32/458957332.db2.gz	SBUNKCPPALQDQR-GJYPPUQNSA-N	0	3	333.476	3.402	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CCC(OCC2CC2)CC1	ZINC000441687571	458969947	/nfs/dbraw/zinc/96/99/47/458969947.db2.gz	MGCHVEONTXEGGH-IBGZPJMESA-N	0	3	345.483	3.046	20	30		EGEDHN
C=CCn1c(CC)nnc1N1CCN(Cc2ccccc2)[C@H](CC)C1	ZINC000566666176	458979629	/nfs/dbraw/zinc/97/96/29/458979629.db2.gz	QVEKGCGCPNNWSE-GOSISDBHSA-N	0	3	339.487	3.127	20	30		EGEDHN
Cc1cc(C)c(CNC[C@H](O)COc2ccc(CC#N)cc2)c(C)c1	ZINC000566733005	458990889	/nfs/dbraw/zinc/99/08/89/458990889.db2.gz	KLFIMXUHULXGFZ-IBGZPJMESA-N	0	3	338.451	3.207	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N[C@H]1CCN(C)[C@@H](C)C1)c1ccc(F)c(F)c1	ZINC000477048861	459028657	/nfs/dbraw/zinc/02/86/57/459028657.db2.gz	YZJFGFOBRTUGHA-JDFRZJQESA-N	0	3	337.414	3.364	20	30		EGEDHN
N#CCCCOc1cccc(NC2CCN([C@H]3CCOC3)CC2)c1	ZINC000594512309	459070924	/nfs/dbraw/zinc/07/09/24/459070924.db2.gz	JXQBBRUMIUKPHB-SFHVURJKSA-N	0	3	329.444	3.034	20	30		EGEDHN
N#Cc1ccc(CCNCc2cc3c(cc2OC(F)F)OCO3)cc1	ZINC000594954432	459191157	/nfs/dbraw/zinc/19/11/57/459191157.db2.gz	GIANMEHMGCNABL-UHFFFAOYSA-N	0	3	346.333	3.221	20	30		EGEDHN
Cc1c([C@H](C)NCCc2ccc(C#N)cc2)nnn1-c1ccc(F)cc1	ZINC000595055563	459229224	/nfs/dbraw/zinc/22/92/24/459229224.db2.gz	GKNOBAVRMPDUJH-AWEZNQCLSA-N	0	3	349.413	3.480	20	30		EGEDHN
CC(C#N)C(=O)N[C@@H](CCCNC(=O)OC(C)(C)C)c1ccccc1	ZINC000496551559	459237082	/nfs/dbraw/zinc/23/70/82/459237082.db2.gz	SEUMXXQQRSXVNT-ZBFHGGJFSA-N	0	3	345.443	3.308	20	30		EGEDHN
C[C@H](NC(=O)N1CCC(CC#N)CC1)[C@H](c1ccccc1)N(C)C	ZINC000580483789	459260468	/nfs/dbraw/zinc/26/04/68/459260468.db2.gz	OAJIKZJKBXYWAG-MAUKXSAKSA-N	0	3	328.460	3.013	20	30		EGEDHN
CN(CCC(=O)Nc1cccc(C#N)c1)Cc1cc(C(C)(C)C)[nH]n1	ZINC000581937292	459279538	/nfs/dbraw/zinc/27/95/38/459279538.db2.gz	NEXKVQAQGSWOSD-UHFFFAOYSA-N	0	3	339.443	3.039	20	30		EGEDHN
N#Cc1ccc(CCN2CCCC[C@H]2CNC(=O)c2ccccc2)cc1	ZINC000595335971	459280264	/nfs/dbraw/zinc/28/02/64/459280264.db2.gz	FIAKONSYWQDZHL-NRFANRHFSA-N	0	3	347.462	3.385	20	30		EGEDHN
Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2NCC2(CC#N)CC2)cc1	ZINC000581980375	459286107	/nfs/dbraw/zinc/28/61/07/459286107.db2.gz	SYTXNUHVLUCIPB-ZWKOTPCHSA-N	0	3	346.496	3.363	20	30		EGEDHN
N#CCCn1cc(CN2CCC[C@@H]3COC[C@@H]32)c(-c2ccccc2)n1	ZINC000590972191	459286152	/nfs/dbraw/zinc/28/61/52/459286152.db2.gz	TVHGTEDFJHDLGC-MJGOQNOKSA-N	0	3	336.439	3.075	20	30		EGEDHN
C=CC[C@@H](CO)CN[C@H](C)c1ccc(OC)cc1Br	ZINC000538406351	459370453	/nfs/dbraw/zinc/37/04/53/459370453.db2.gz	AWOFLPQSMWJGCI-VXGBXAGGSA-N	0	3	328.250	3.293	20	30		EGEDHN
C[C@@H](CN1CCC(C)CC1)NC(=O)N[C@@H](C)c1cccc(C#N)c1	ZINC000595541534	459339147	/nfs/dbraw/zinc/33/91/47/459339147.db2.gz	UFQSTSCMZDCAKK-HOTGVXAUSA-N	0	3	328.460	3.039	20	30		EGEDHN
C[C@H]1CCN(CCNC(=O)c2cn(CCCC#N)c3ccccc23)C1	ZINC000568818800	459348460	/nfs/dbraw/zinc/34/84/60/459348460.db2.gz	ZLGDLPHPKQBKEE-INIZCTEOSA-N	0	3	338.455	3.017	20	30		EGEDHN
COC1(CN2CCN(c3cccc(F)c3C#N)CC2)CCCCC1	ZINC000483274383	459356629	/nfs/dbraw/zinc/35/66/29/459356629.db2.gz	XJBYPZIGDSLHRO-UHFFFAOYSA-N	0	3	331.435	3.169	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N(CCN1CCCC1)c1ccccc1)OCC	ZINC000535911336	459358241	/nfs/dbraw/zinc/35/82/41/459358241.db2.gz	VVBZMKZBGADKHA-LJQANCHMSA-N	0	3	330.472	3.487	20	30		EGEDHN
N#CC[C@@H]1CCCN(C[C@H](O)CO[C@@H]2CCCc3ccccc32)C1	ZINC000595611912	459366855	/nfs/dbraw/zinc/36/68/55/459366855.db2.gz	OXNFWIJARGWGMM-XKGZKEIXSA-N	0	3	328.456	3.067	20	30		EGEDHN
C=CCNC(=O)NC(=O)CN[C@H](c1ccc(Cl)cc1)[C@@H](C)CC	ZINC000538214725	459369810	/nfs/dbraw/zinc/36/98/10/459369810.db2.gz	JOLQJJXJQLXSAU-LRDDRELGSA-N	0	3	337.851	3.029	20	30		EGEDHN
CC(C)CN1CCCC[C@@H]1CNC(=O)c1cc(C#N)ccc1Cl	ZINC000560601545	459379003	/nfs/dbraw/zinc/37/90/03/459379003.db2.gz	RPJBDRJMSZDTNY-OAHLLOKOSA-N	0	3	333.863	3.452	20	30		EGEDHN
CCCOc1ccc(CN2CC[C@@H](Oc3ccc(C#N)cn3)C2)cc1	ZINC000569181188	459408501	/nfs/dbraw/zinc/40/85/01/459408501.db2.gz	JFHLMBPDUQPKMT-LJQANCHMSA-N	0	3	337.423	3.395	20	30		EGEDHN
N#CCC1CCN(C(=O)c2cccc(CN3CCCCC3)c2)CC1	ZINC000569208266	459414072	/nfs/dbraw/zinc/41/40/72/459414072.db2.gz	HFYDVZUCHLUOQS-UHFFFAOYSA-N	0	3	325.456	3.438	20	30		EGEDHN
N#Cc1ccc(CNC(=O)CN2CC[C@H](C3CCCCC3)C2)cc1	ZINC000595732970	459418580	/nfs/dbraw/zinc/41/85/80/459418580.db2.gz	GTFDQVMFWHXRAX-IBGZPJMESA-N	0	3	325.456	3.077	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](O)CO[C@@H]2CCCc3ccccc32)cc1	ZINC000591725163	459425697	/nfs/dbraw/zinc/42/56/97/459425697.db2.gz	DTFQVZXMINMMCF-TZIWHRDSSA-N	0	3	336.435	3.103	20	30		EGEDHN
C[C@H](c1ccncc1)N1CCC(Nc2nc3c(cc2C#N)CCC3)CC1	ZINC000591822213	459448280	/nfs/dbraw/zinc/44/82/80/459448280.db2.gz	GIYXEZYGKCHNDA-OAHLLOKOSA-N	0	3	347.466	3.474	20	30		EGEDHN
CCOC(=O)C1CCC(O)(CN[C@@H](CCC#N)c2ccccc2)CC1	ZINC000569448528	459453201	/nfs/dbraw/zinc/45/32/01/459453201.db2.gz	DBAGHICDPVZZPT-FDYSRKEFSA-N	0	3	344.455	3.105	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@H](Nc2nc(C#N)c(Cl)s2)C1	ZINC000596088598	459515702	/nfs/dbraw/zinc/51/57/02/459515702.db2.gz	LNBQHCCUJURTQA-AAEUAGOBSA-N	0	3	332.860	3.337	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@@H](Nc2ccc(Cl)c(C#N)n2)C1	ZINC000486932439	459525261	/nfs/dbraw/zinc/52/52/61/459525261.db2.gz	DEZRDRJOBFNZQN-DZGCQCFKSA-N	0	3	326.831	3.276	20	30		EGEDHN
Cc1ccc2ncc(C#N)c(NCCc3ccc4cn[nH]c4c3)c2c1	ZINC000487724695	459531728	/nfs/dbraw/zinc/53/17/28/459531728.db2.gz	PMEKQMDXCHTSQZ-UHFFFAOYSA-N	0	3	327.391	3.368	20	30		EGEDHN
CCCCNC(=O)C1(NCc2ccc(CC#N)cc2)CCCCC1	ZINC000542204104	459533970	/nfs/dbraw/zinc/53/39/70/459533970.db2.gz	HUMVWMIXEKFXJS-UHFFFAOYSA-N	0	3	327.472	3.461	20	30		EGEDHN
C[C@@H]1C[C@H](Nc2nc(C#N)c(Cl)s2)CN1Cc1ccccc1	ZINC000596160881	459543857	/nfs/dbraw/zinc/54/38/57/459543857.db2.gz	JFKWFHBHXQNEJF-YPMHNXCESA-N	0	3	332.860	3.165	20	30		EGEDHN
CC(C)(C)[C@@H]1CCN([C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)C1	ZINC000542320828	459547801	/nfs/dbraw/zinc/54/78/01/459547801.db2.gz	WVCMEKUQUQMFIX-SJLPKXTDSA-N	0	3	325.456	3.422	20	30		EGEDHN
C=CCn1cccc1C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000488899957	459555910	/nfs/dbraw/zinc/55/59/10/459555910.db2.gz	IMBJWBJJQJXSKY-IBGZPJMESA-N	0	3	337.467	3.411	20	30		EGEDHN
C=CCn1cccc1C(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000489058643	459560382	/nfs/dbraw/zinc/56/03/82/459560382.db2.gz	FGGLDJWXBPYAFD-UHFFFAOYSA-N	0	3	337.467	3.377	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCCSc2ccc(C)cc2)CC1	ZINC000592293546	459571964	/nfs/dbraw/zinc/57/19/64/459571964.db2.gz	RNZJEWRFJSXHJP-UHFFFAOYSA-N	0	3	347.528	3.427	20	30		EGEDHN
C[C@@H](C(=O)NC1(C#N)CCC1)N1CC[C@](C)(CCc2ccccc2)C1	ZINC000527048422	459582269	/nfs/dbraw/zinc/58/22/69/459582269.db2.gz	LQSIBIZMHJCUJN-PXNSSMCTSA-N	0	3	339.483	3.282	20	30		EGEDHN
CN(CCCc1[nH]nc(N)c1C#N)Cc1cc(Cl)cc(Cl)c1	ZINC000583721694	459585770	/nfs/dbraw/zinc/58/57/70/459585770.db2.gz	KMXDOIPUHYDOLP-UHFFFAOYSA-N	0	3	338.242	3.065	20	30		EGEDHN
CC[C@@H](N[C@H](C)c1cccc(C#N)c1)C(=O)NCc1cccs1	ZINC000592393961	459589935	/nfs/dbraw/zinc/58/99/35/459589935.db2.gz	LXGRPEHGBWYPOH-CXAGYDPISA-N	0	3	327.453	3.365	20	30		EGEDHN
C#C[C@@H](NC(=O)NC1CCN(CC=C)CC1)c1ccc(Cl)cc1F	ZINC000491179802	459602537	/nfs/dbraw/zinc/60/25/37/459602537.db2.gz	HTKAFINOPVAPNH-QGZVFWFLSA-N	0	3	349.837	3.103	20	30		EGEDHN
C#CCN1CCC(C(=O)NCC(C)(C)c2ccc(C)cc2C)CC1	ZINC000491221077	459607262	/nfs/dbraw/zinc/60/72/62/459607262.db2.gz	SQIFYHVDOJPHIW-UHFFFAOYSA-N	0	3	326.484	3.042	20	30		EGEDHN
C#CCN1C(=O)c2ccccc2N[C@]12CCN(C)[C@H](c1ccccc1)C2	ZINC000491295323	459613669	/nfs/dbraw/zinc/61/36/69/459613669.db2.gz	GRUIGJSIPQCPTK-RBBKRZOGSA-N	0	3	345.446	3.351	20	30		EGEDHN
CC(C)OC1CC(N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)C1	ZINC000562680097	459619159	/nfs/dbraw/zinc/61/91/59/459619159.db2.gz	ZHYIIYOSAZGNEY-UHFFFAOYSA-N	0	3	341.455	3.165	20	30		EGEDHN
C#CCN(Cc1ccccc1)C(=O)NCc1cccc(CN(C)C)c1	ZINC000491710643	459658713	/nfs/dbraw/zinc/65/87/13/459658713.db2.gz	RTWHWMYOARCJSZ-UHFFFAOYSA-N	0	3	335.451	3.093	20	30		EGEDHN
C[C@H](OC[C@H](O)CNCC#Cc1ccccc1)c1ccc(Cl)cc1	ZINC000562987050	459686838	/nfs/dbraw/zinc/68/68/38/459686838.db2.gz	UWACKCLAKWUQGZ-OXJNMPFZSA-N	0	3	343.854	3.420	20	30		EGEDHN
N#CCC[C@@H](C#N)CN[C@H]1CCCN(Cc2ccc(F)cc2Cl)C1	ZINC000562993757	459688203	/nfs/dbraw/zinc/68/82/03/459688203.db2.gz	NLHNNIJVPYACQN-YOEHRIQHSA-N	0	3	348.853	3.477	20	30		EGEDHN
C[C@H](NC(=O)N1CCC[C@@H](CC#N)C1)[C@H](c1ccccc1)N(C)C	ZINC000596596992	459691048	/nfs/dbraw/zinc/69/10/48/459691048.db2.gz	HWWXIOGUVAPEDZ-XYJFISCASA-N	0	3	328.460	3.013	20	30		EGEDHN
Cc1ccccc1[C@H]([C@H](C)NC(=O)N1CCC[C@@H](CC#N)C1)N(C)C	ZINC000596598679	459692395	/nfs/dbraw/zinc/69/23/95/459692395.db2.gz	KRXWNGVOBXLRKG-LNLFQRSKSA-N	0	3	342.487	3.322	20	30		EGEDHN
CC(C)CN1CCN(Cc2cc(C#N)ccc2Br)CC1	ZINC000492417110	459703578	/nfs/dbraw/zinc/70/35/78/459703578.db2.gz	NISQEILUFVFZTE-UHFFFAOYSA-N	0	3	336.277	3.094	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1CNCc1ncc(Br)cc1F	ZINC000527704172	459707851	/nfs/dbraw/zinc/70/78/51/459707851.db2.gz	VIICJGFCOGCXRM-HZMBPMFUSA-N	0	3	329.213	3.054	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)N2CCC(CC#N)CC2)N(C)C)cc1	ZINC000543822332	459703818	/nfs/dbraw/zinc/70/38/18/459703818.db2.gz	SALJCOPPPGXUAG-LJQANCHMSA-N	0	3	342.487	3.187	20	30		EGEDHN
C[C@H]1CC2(CN1C(=O)C(C#N)CCc1ccccc1)CCOCC2	ZINC000592894635	459714460	/nfs/dbraw/zinc/71/44/60/459714460.db2.gz	NCSFWSMXAVDZQZ-WMZOPIPTSA-N	0	3	326.440	3.177	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN(C)Cc1ccc(F)cc1	ZINC000501348212	459722765	/nfs/dbraw/zinc/72/27/65/459722765.db2.gz	OMXFTSFZJLWHKC-LJQANCHMSA-N	0	3	329.415	3.426	20	30		EGEDHN
C=C(C)CN(CC)C(=O)NC[C@@H](CC)N1CCc2ccccc2C1	ZINC000501388198	459725666	/nfs/dbraw/zinc/72/56/66/459725666.db2.gz	NTJNIVVUMOIKHI-LJQANCHMSA-N	0	3	329.488	3.431	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CCC(CC(F)(F)F)CC2)cc1	ZINC000501422237	459726315	/nfs/dbraw/zinc/72/63/15/459726315.db2.gz	ULOCNSASQPKNOD-MRXNPFEDSA-N	0	3	349.356	3.432	20	30		EGEDHN
CN(C(=O)C(C[C@@H]1CCCO1)C(F)(F)F)c1cccc(C#N)c1	ZINC000593038131	459750141	/nfs/dbraw/zinc/75/01/41/459750141.db2.gz	WILFRLYWSBIUQB-UONOGXRCSA-N	0	3	326.318	3.269	20	30		EGEDHN
Cc1cc2cc(CNC[C@@H](O)COc3ccc(CC#N)cc3)ccc2[nH]1	ZINC000563618155	459767345	/nfs/dbraw/zinc/76/73/45/459767345.db2.gz	MZUGAWNXZOZVCI-LJQANCHMSA-N	0	3	349.434	3.072	20	30		EGEDHN
C[C@H](NC[C@@H](O)CN(C)CCC#N)c1ccc(Cl)c2ccccc21	ZINC000565300116	459782911	/nfs/dbraw/zinc/78/29/11/459782911.db2.gz	TWWOJXHJLZPDBP-LSDHHAIUSA-N	0	3	345.874	3.350	20	30		EGEDHN
Cc1csc(NC(=O)NC[C@@H]2CCN2C2CCCCC2)c1C#N	ZINC000529098781	459822724	/nfs/dbraw/zinc/82/27/24/459822724.db2.gz	QBTGRCAONVVJHL-AWEZNQCLSA-N	0	3	332.473	3.457	20	30		EGEDHN
N#CCCC1CCN(C(=O)c2ccc(CN3CCCC3)cc2)CC1	ZINC000566277058	459834077	/nfs/dbraw/zinc/83/40/77/459834077.db2.gz	WULYMTBNAPWGEE-UHFFFAOYSA-N	0	3	325.456	3.438	20	30		EGEDHN
C[C@H](CN1CCC(C)CC1)NC(=O)CSCc1ccc(C#N)cc1	ZINC000598265016	459843349	/nfs/dbraw/zinc/84/33/49/459843349.db2.gz	SAKVZKBTSIKXQC-MRXNPFEDSA-N	0	3	345.512	3.028	20	30		EGEDHN
C[C@H](c1ccncc1)N1CCC(Nc2ncc3c(c2C#N)CCC3)CC1	ZINC000574751487	459866273	/nfs/dbraw/zinc/86/62/73/459866273.db2.gz	LQDFKDQRGRXIIO-OAHLLOKOSA-N	0	3	347.466	3.474	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)CN1C[C@H](c2ccccc2)[C@@H]2CCC[C@@H]21	ZINC000586776477	459870600	/nfs/dbraw/zinc/87/06/00/459870600.db2.gz	FNFMURZHKNLRLZ-JTJHWIPRSA-N	0	3	339.483	3.309	20	30		EGEDHN
N#CCCCOc1cccc(CNCCN2Cc3ccccc3C2)c1	ZINC000608860974	459891511	/nfs/dbraw/zinc/89/15/11/459891511.db2.gz	DRDMFGOWQPEPPD-UHFFFAOYSA-N	0	3	335.451	3.475	20	30		EGEDHN
N#Cc1ccc(CNC(=O)CN2CCCC[C@H]2Cc2ccccc2)cc1	ZINC000608909304	459894016	/nfs/dbraw/zinc/89/40/16/459894016.db2.gz	BNPYHBWXVVMIRF-NRFANRHFSA-N	0	3	347.462	3.272	20	30		EGEDHN
CCC(C#N)C(=O)N1CCc2ccccc2[C@@H]1C(=O)OC(C)(C)C	ZINC000598568164	459940810	/nfs/dbraw/zinc/94/08/10/459940810.db2.gz	IIVGHZFRQYMOAQ-CZUORRHYSA-N	0	3	328.412	3.004	20	30		EGEDHN
CNc1ccc(C#N)cc1NC(=O)C(C[C@H]1CCCO1)C(F)(F)F	ZINC000593678968	459947960	/nfs/dbraw/zinc/94/79/60/459947960.db2.gz	SUSSBTHUJUUTKJ-NEPJUHHUSA-N	0	3	341.333	3.286	20	30		EGEDHN
CC1(C)CN(C2(CNC(=O)CCCCCC#N)CCCCC2)CCO1	ZINC000588356438	459950080	/nfs/dbraw/zinc/95/00/80/459950080.db2.gz	LOYYBVNHHYFABI-UHFFFAOYSA-N	0	3	349.519	3.390	20	30		EGEDHN
COC[C@@H](NC[C@@H](O)CC(C)(C)C#N)c1cccc(C(F)(F)F)c1	ZINC000598599211	459958948	/nfs/dbraw/zinc/95/89/48/459958948.db2.gz	AVOUPSCFQPUSIR-LSDHHAIUSA-N	0	3	344.377	3.283	20	30		EGEDHN
COc1cc2c(cc1CN[C@H](C)CC1(C#N)CCOCC1)O[C@H](C)C2	ZINC000602512286	459976400	/nfs/dbraw/zinc/97/64/00/459976400.db2.gz	SHPQFHOXUGCJOU-HUUCEWRRSA-N	0	3	344.455	3.207	20	30		EGEDHN
C[C@H](Cc1cccc(Br)c1)NCc1cccc(C#N)n1	ZINC000602520768	459981360	/nfs/dbraw/zinc/98/13/60/459981360.db2.gz	JEXXIJQAXHSHBG-GFCCVEGCSA-N	0	3	330.229	3.437	20	30		EGEDHN
N#Cc1cccc(CN[C@H]2CCN(c3ccc(C(F)(F)F)cc3)C2)n1	ZINC000602559215	459995989	/nfs/dbraw/zinc/99/59/89/459995989.db2.gz	VDBCVHHOHDIKNB-INIZCTEOSA-N	0	3	346.356	3.341	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N[C@H]1CCCc2c3cc(Cl)ccc3[nH]c21	ZINC000602565419	459999192	/nfs/dbraw/zinc/99/91/92/459999192.db2.gz	HTNUHTNZLRTAFV-HOCLYGCPSA-N	0	3	344.846	3.336	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN1CC(Cc2cccc(C(F)(F)F)c2)C1	ZINC000598706324	460001614	/nfs/dbraw/zinc/00/16/14/460001614.db2.gz	QLTQJDAUKLUYJM-MRXNPFEDSA-N	0	3	340.389	3.480	20	30		EGEDHN
C[C@H](C#N)CN(C)C(=O)N[C@H](CN1CCCCC1)c1ccccc1	ZINC000609640194	460001682	/nfs/dbraw/zinc/00/16/82/460001682.db2.gz	ZRTBWCRHASDCKR-SJLPKXTDSA-N	0	3	328.460	3.015	20	30		EGEDHN
CC(C)C[C@@H](C)Oc1cc(CNC[C@H](O)CC(C)(C)C#N)ccn1	ZINC000598720615	460006328	/nfs/dbraw/zinc/00/63/28/460006328.db2.gz	PXXGLYQVCWNYDM-NVXWUHKLSA-N	0	3	333.476	3.285	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CNCc1ccc(Oc2ccccc2)nc1	ZINC000598721134	460006620	/nfs/dbraw/zinc/00/66/20/460006620.db2.gz	STXBDTANHYMQAJ-INIZCTEOSA-N	0	3	325.412	3.264	20	30		EGEDHN
Cc1cc(F)ccc1-c1ccc(CNC2CCN(CC#N)CC2)o1	ZINC000609677622	460007592	/nfs/dbraw/zinc/00/75/92/460007592.db2.gz	QJOOPLUZINSHOF-UHFFFAOYSA-N	0	3	327.403	3.472	20	30		EGEDHN
CC(C)(C)[C@@H]1CCCN(CC(=O)NCc2cccc(C#N)c2)CC1	ZINC000609706128	460009137	/nfs/dbraw/zinc/00/91/37/460009137.db2.gz	AMHTVYWHHLZACN-GOSISDBHSA-N	0	3	327.472	3.323	20	30		EGEDHN
Cc1ccc([C@H](CN[C@H](C)CC2(C#N)CCOCC2)N2CCCC2)o1	ZINC000602585031	460010576	/nfs/dbraw/zinc/01/05/76/460010576.db2.gz	BNDJBLCMJXZWOT-AEFFLSMTSA-N	0	3	345.487	3.414	20	30		EGEDHN
N#CC(C(=O)c1cnc2n1CCCCC2)c1cnc2ccccc2n1	ZINC000621717332	460022797	/nfs/dbraw/zinc/02/27/97/460022797.db2.gz	ARUJDKQIUVUBHP-ZDUSSCGKSA-N	0	3	331.379	3.043	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)C(=O)NCCCN(C)Cc1ccccc1	ZINC000593955674	460026828	/nfs/dbraw/zinc/02/68/28/460026828.db2.gz	UXYCWAFKPLGWPI-GOSISDBHSA-N	0	3	349.478	3.375	20	30		EGEDHN
CC(C)Oc1ccc([C@@H](CNCc2cccc(C#N)n2)N(C)C)cc1	ZINC000602667341	460054340	/nfs/dbraw/zinc/05/43/40/460054340.db2.gz	QCYRXEUIMBKJNQ-HXUWFJFHSA-N	0	3	338.455	3.133	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)cn2)[C@H](C)[C@H](C)N1Cc1ccccc1	ZINC000594015139	460056951	/nfs/dbraw/zinc/05/69/51/460056951.db2.gz	GQJHGZVEQPZNEC-KURKYZTESA-N	0	3	334.467	3.437	20	30		EGEDHN
C[C@@H](CC1(C#N)CCOCC1)NCc1ccnc(C(F)(F)F)c1	ZINC000602678135	460061217	/nfs/dbraw/zinc/06/12/17/460061217.db2.gz	CMLGBPPCKZRKOS-LBPRGKRZSA-N	0	3	327.350	3.289	20	30		EGEDHN
COc1cccc2c1OCC[C@@H]2N[C@@H](C)CC1(C#N)CCOCC1	ZINC000602712972	460080566	/nfs/dbraw/zinc/08/05/66/460080566.db2.gz	XBHIMFGQNGWXAW-HOCLYGCPSA-N	0	3	330.428	3.207	20	30		EGEDHN
N#Cc1cccc(CN2CCC(NCc3ccncc3Cl)CC2)c1	ZINC000598982452	460116126	/nfs/dbraw/zinc/11/61/26/460116126.db2.gz	VGQJJOCEDNPBNQ-UHFFFAOYSA-N	0	3	340.858	3.361	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCc1cccnc1N1CCCC1	ZINC000597940303	460120750	/nfs/dbraw/zinc/12/07/50/460120750.db2.gz	IFFBTNWCLKGHEP-GOSISDBHSA-N	0	3	348.450	3.071	20	30		EGEDHN
N#CCC1(C[NH+]2CCC(C(=O)Nc3cc(Cl)ccc3[O-])CC2)CC1	ZINC000602790863	460127857	/nfs/dbraw/zinc/12/78/57/460127857.db2.gz	LENGIZTWPVXWAB-UHFFFAOYSA-N	0	3	347.846	3.390	20	30		EGEDHN
N#CC[C@H](CC(=O)N[C@H]1CCCN2CCCC[C@@H]12)c1ccccc1	ZINC000594199013	460145791	/nfs/dbraw/zinc/14/57/91/460145791.db2.gz	XTHOMJQFIQPPFM-QYZOEREBSA-N	0	3	325.456	3.207	20	30		EGEDHN
C[C@@H](CC(=O)NCCc1ccccc1)N[C@@H]1CCc2cc(C#N)ccc21	ZINC000618801370	460181562	/nfs/dbraw/zinc/18/15/62/460181562.db2.gz	AMMLVTVOUXKQKA-HRAATJIYSA-N	0	3	347.462	3.273	20	30		EGEDHN
C[C@@H](NC(=O)[C@@H](N)CCCCC#N)c1ccc(Br)cc1	ZINC000594431934	460216809	/nfs/dbraw/zinc/21/68/09/460216809.db2.gz	STCJXSQOWWXXRC-RISCZKNCSA-N	0	3	338.249	3.038	20	30		EGEDHN
Cc1cc(C)cc(-c2nnc(NC(=O)[C@H](N)CCCCC#N)s2)c1	ZINC000594443493	460223037	/nfs/dbraw/zinc/22/30/37/460223037.db2.gz	IJFBRYJIBXXWPB-CQSZACIVSA-N	0	3	343.456	3.172	20	30		EGEDHN
N#Cc1cc(F)cc(NC(=O)N2CCCN(C3CCCC3)CC2)c1	ZINC000603079183	460238425	/nfs/dbraw/zinc/23/84/25/460238425.db2.gz	RQZXVPGLTGFFPB-UHFFFAOYSA-N	0	3	330.407	3.180	20	30		EGEDHN
C[C@@H](NCCC(=O)N1CCc2ccccc2C1)c1cccc(C#N)c1	ZINC000614911570	460244268	/nfs/dbraw/zinc/24/42/68/460244268.db2.gz	NGUQIBAKOUXYNV-MRXNPFEDSA-N	0	3	333.435	3.184	20	30		EGEDHN
C/C(=C\c1ccccc1)CN(C)C[C@H](O)COc1ccccc1C#N	ZINC000599388288	460244639	/nfs/dbraw/zinc/24/46/39/460244639.db2.gz	GFDLQWALKWISRZ-KZFLWGQDSA-N	0	3	336.435	3.333	20	30		EGEDHN
CSc1ccc([C@@H](C)NC[C@H](O)COc2ccccc2C#N)cc1	ZINC000599397573	460247379	/nfs/dbraw/zinc/24/73/79/460247379.db2.gz	RCTJEQCDBMPNCO-PBHICJAKSA-N	0	3	342.464	3.371	20	30		EGEDHN
CC(C)[C@H]1CN(Cc2ccccc2)CCN1C[C@H](O)CC(C)(C)C#N	ZINC000599536680	460270159	/nfs/dbraw/zinc/27/01/59/460270159.db2.gz	OMCYEOYRCVLFCY-WOJBJXKFSA-N	0	3	343.515	3.130	20	30		EGEDHN
CC(C)(C)[C@H](N)c1cn(Cc2cc(C#N)ccc2Br)nn1	ZINC000603240848	460270755	/nfs/dbraw/zinc/27/07/55/460270755.db2.gz	FMLAHBZOTRIDBP-CQSZACIVSA-N	0	3	348.248	3.006	20	30		EGEDHN
C[C@@H](NC[C@H](O)COc1ccccc1Cl)c1cccc(C#N)c1	ZINC000611386301	460350414	/nfs/dbraw/zinc/35/04/14/460350414.db2.gz	KTXKPQHCDCXJTE-CJNGLKHVSA-N	0	3	330.815	3.302	20	30		EGEDHN
CCNC(=O)c1cccc(CN[C@@H]2CCCc3cc(C#N)ccc32)c1	ZINC000611392561	460353488	/nfs/dbraw/zinc/35/34/88/460353488.db2.gz	WBDQRKWOKGWGRX-HXUWFJFHSA-N	0	3	333.435	3.475	20	30		EGEDHN
CCN(C(=O)CCCCOc1cccc(C#N)c1)C1CCN(C)CC1	ZINC000599985859	460367079	/nfs/dbraw/zinc/36/70/79/460367079.db2.gz	MBNTZFMKIKITFD-UHFFFAOYSA-N	0	3	343.471	3.050	20	30		EGEDHN
N#CC(C(=O)c1ccnc(-n2cccn2)c1)c1ccc2ccccc2n1	ZINC000607009543	460776068	/nfs/dbraw/zinc/77/60/68/460776068.db2.gz	SBNRJXNZUBOZDL-MRXNPFEDSA-N	0	3	339.358	3.306	20	30		EGEDHN
N#Cc1ccc2c(c1)CCCC[C@@H]2NC[C@@H](n1cncn1)C(F)(F)F	ZINC000601294682	460779833	/nfs/dbraw/zinc/77/98/33/460779833.db2.gz	PNATZFLGZIKWBF-JKSUJKDBSA-N	0	3	349.360	3.310	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H](CNC(=O)c1ccccc1CC#N)C1CC1	ZINC000601465146	460817056	/nfs/dbraw/zinc/81/70/56/460817056.db2.gz	SMPAMDSGFDIIES-NRFANRHFSA-N	0	3	347.462	3.393	20	30		EGEDHN
C[C@H]1[C@H](NC(=O)c2ccccc2CC#N)CCN1Cc1ccccc1	ZINC000601580542	460837513	/nfs/dbraw/zinc/83/75/13/460837513.db2.gz	NTDLROQXYGKPHY-OXJNMPFZSA-N	0	3	333.435	3.145	20	30		EGEDHN
C[C@@H](c1ccccc1)[C@@H](CO)NCc1ccc(C#N)cc1OC(F)F	ZINC000613389300	460932125	/nfs/dbraw/zinc/93/21/25/460932125.db2.gz	HWBJRYHNKYNSEE-SUMWQHHRSA-N	0	3	346.377	3.414	20	30		EGEDHN
CC#CC[C@@H](CO)NCc1ccc(OC)c(OCc2ccccc2)c1	ZINC000641769193	461362175	/nfs/dbraw/zinc/36/21/75/461362175.db2.gz	PPICFIQSDNNPEA-IBGZPJMESA-N	0	3	339.435	3.138	20	30		EGEDHN
C=C(CNC[C@H](O)Cn1cnc2cc(C)c(C)cc21)c1ccccc1	ZINC000644647317	462021791	/nfs/dbraw/zinc/02/17/91/462021791.db2.gz	OJTJTFWVFUMCTA-IBGZPJMESA-N	0	3	335.451	3.317	20	30		EGEDHN
C=CCCn1cc(CNC[C@H]2CCCO[C@@H]2c2ccc(C)cc2)nn1	ZINC000657385819	462088290	/nfs/dbraw/zinc/08/82/90/462088290.db2.gz	WQVSCJAYNKWSAB-UYAOXDASSA-N	0	3	340.471	3.420	20	30		EGEDHN
C=CC[C@H]1CCCC[C@@H]1NCc1ccccc1S(=O)(=O)N(C)C	ZINC000657830400	462288700	/nfs/dbraw/zinc/28/87/00/462288700.db2.gz	IESFQHPRFQYHIW-RDJZCZTQSA-N	0	3	336.501	3.161	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@@H](C)Cc2ccc(OCC)cc2)CC1	ZINC000665242506	462365891	/nfs/dbraw/zinc/36/58/91/462365891.db2.gz	HJCCELNLWQRTSF-INIZCTEOSA-N	0	3	330.472	3.031	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N1CCC(CN2CCCCC2=O)CC1	ZINC000187697023	534082740	/nfs/dbraw/zinc/08/27/40/534082740.db2.gz	ZWHPXFPOXHHIFX-INIZCTEOSA-N	0	3	325.456	3.344	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@@H]2c2cccc(C)c2)CC1	ZINC000171741029	526427600	/nfs/dbraw/zinc/42/76/00/526427600.db2.gz	BHHANGSGVRFHGZ-LJQANCHMSA-N	0	3	327.472	3.492	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](CC)c2ccc(OC)cc2)CC1	ZINC000171701287	526436378	/nfs/dbraw/zinc/43/63/78/526436378.db2.gz	OXQBJDAXMXYDKM-SFHVURJKSA-N	0	3	331.460	3.096	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(OC(C)C)cc2F)CC1	ZINC000171637605	526441289	/nfs/dbraw/zinc/44/12/89/526441289.db2.gz	IBCDNDPHRZDGIP-UHFFFAOYSA-N	0	3	335.423	3.385	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc3ccc(F)cc3nc2C)CC1	ZINC000171721356	526445964	/nfs/dbraw/zinc/44/59/64/526445964.db2.gz	QJUVENGCNPBLRQ-UHFFFAOYSA-N	0	3	327.403	3.063	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(Cl)c3cccnc23)CC1	ZINC000171719119	526448007	/nfs/dbraw/zinc/44/80/07/526448007.db2.gz	ZEHYUDIQEGZOEO-UHFFFAOYSA-N	0	3	329.831	3.268	20	30		EGEDHN
CC(C)(C)[C@H](CCO)NCc1ccc(C#N)cc1Br	ZINC000183700945	526692791	/nfs/dbraw/zinc/69/27/91/526692791.db2.gz	ZOCWWJARWMPXBU-AWEZNQCLSA-N	0	3	325.250	3.207	20	30		EGEDHN
C=C(Cl)COc1ccc([C@H](C)N[C@H](C)CN2CCCC2=O)cc1	ZINC000178498743	526890202	/nfs/dbraw/zinc/89/02/02/526890202.db2.gz	YEMPCDJQYAPBHK-CABCVRRESA-N	0	3	336.863	3.479	20	30		EGEDHN
CN(CCN(C)C1CC1)C(=O)c1ccccc1-c1ccccc1C#N	ZINC000186736880	536367034	/nfs/dbraw/zinc/36/70/34/536367034.db2.gz	VGUXBSSGVNDSJH-UHFFFAOYSA-N	0	3	333.435	3.391	20	30		EGEDHN
N#CC1(C(=O)NCC2(N3CCSCC3)CCCCC2)CCCCC1	ZINC000112186528	546698128	/nfs/dbraw/zinc/69/81/28/546698128.db2.gz	WUUCMXXIJWEUOG-UHFFFAOYSA-N	0	3	349.544	3.328	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cccc(CC#N)c1)C(C)C	ZINC000171980461	546996369	/nfs/dbraw/zinc/99/63/69/546996369.db2.gz	KKEHKMYVHKYDEJ-IBGZPJMESA-N	0	3	325.456	3.181	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@@H](C)N1CC[C@@H](N(C)Cc2ccccc2)C1	ZINC000674252210	548713388	/nfs/dbraw/zinc/71/33/88/548713388.db2.gz	XTKCQXJYSYRUNX-UYAOXDASSA-N	0	3	343.515	3.006	20	30		EGEDHN
COc1ccc(C2(NCC#Cc3ccc(F)cc3)CCOCC2)cc1	ZINC000676704350	549131787	/nfs/dbraw/zinc/13/17/87/549131787.db2.gz	PENSCKMANQLYMW-UHFFFAOYSA-N	0	3	339.410	3.481	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2C[C@@H](C(F)(F)F)CC[C@H]2C)CC1	ZINC000679487638	549718857	/nfs/dbraw/zinc/71/88/57/549718857.db2.gz	JQNPMTCBBVFCQY-KGLIPLIRSA-N	0	3	347.425	3.399	20	30		EGEDHN
Cc1cc(C(=O)C(C#N)c2nc3cc(F)ccc3s2)cc(=O)[nH]1	ZINC000679883646	549785474	/nfs/dbraw/zinc/78/54/74/549785474.db2.gz	ZOLQFGSKKFTQBN-LLVKDONJSA-N	0	3	327.340	3.335	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc(C(F)(F)F)cn2)CC1	ZINC000680367979	549857065	/nfs/dbraw/zinc/85/70/65/549857065.db2.gz	ZLKRSVSDKHUDTN-UHFFFAOYSA-N	0	3	342.365	3.262	20	30		EGEDHN
C[C@H](CC(=O)C(C#N)C(=O)NC1CCCCC1)c1ccccc1F	ZINC000726858725	574574300	/nfs/dbraw/zinc/57/43/00/574574300.db2.gz	UAFPKAJBNCHIHH-CJNGLKHVSA-N	0	3	330.403	3.477	20	30		EGEDHN
COC(=O)CCCN1CCC(N=Nc2ccc3ccccc3n2)CC1	ZINC000727059867	574638614	/nfs/dbraw/zinc/63/86/14/574638614.db2.gz	VIWJQEGWXZBDLU-UHFFFAOYSA-N	0	3	340.427	3.052	20	30		EGEDHN
N#Cc1ccc(NC(=S)N2CC[C@H](N3CCCC3)C2)cc1Cl	ZINC000727089362	574647631	/nfs/dbraw/zinc/64/76/31/574647631.db2.gz	RGYGFTSTRHUSCX-AWEZNQCLSA-N	0	3	334.876	3.079	20	30		EGEDHN
C[C@@H]1CN(c2ccccc2C=NNCCCc2ccccc2)CCO1	ZINC000729146367	574818608	/nfs/dbraw/zinc/81/86/08/574818608.db2.gz	UDGRQDCMJDFHTR-GOSISDBHSA-N	0	3	337.467	3.468	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCC23CC4CC(CC(C4)C2)C3)CC1	ZINC000730111886	574922810	/nfs/dbraw/zinc/92/28/10/574922810.db2.gz	PTSRGMPHSFWXFK-UHFFFAOYSA-N	0	3	331.504	3.152	20	30		EGEDHN
C[C@@H](NC(=O)C(C)(C)C)C(=O)C(C#N)c1nc2cc(F)ccc2s1	ZINC000730416492	574984423	/nfs/dbraw/zinc/98/44/23/574984423.db2.gz	DPWOQGGRVJNXMY-KOLCDFICSA-N	0	3	347.415	3.162	20	30		EGEDHN
COc1ccc(C(C)N=Nc2cc(C)ncn2)cc1CN1CCCC1	ZINC000731935623	575222666	/nfs/dbraw/zinc/22/26/66/575222666.db2.gz	JBPJTOJNYDWLQV-UHFFFAOYSA-N	0	3	339.443	3.226	20	30		EGEDHN
CC(C)CCC(=O)NCC(=O)C(C#N)c1nc2cc(F)ccc2s1	ZINC000732505499	575273050	/nfs/dbraw/zinc/27/30/50/575273050.db2.gz	VSMJPQJRNQVEIO-GFCCVEGCSA-N	0	3	347.415	3.164	20	30		EGEDHN
C#CCCOc1ccc(CNCc2ccccc2Cn2cncn2)cc1	ZINC000733324395	575327725	/nfs/dbraw/zinc/32/77/25/575327725.db2.gz	VWHDXKVYYUEXNT-UHFFFAOYSA-N	0	3	346.434	3.018	20	30		EGEDHN
C#CCCOc1ccc(CN[C@@H](C)c2ccc3c(c2)CC(=O)N3C)cc1	ZINC000733327430	575328079	/nfs/dbraw/zinc/32/80/79/575328079.db2.gz	XFICRHNRZKMNOW-INIZCTEOSA-N	0	3	348.446	3.458	20	30		EGEDHN
Cc1nc(Cl)cc(N=NC(C)c2ccc(OCCN(C)C)cc2)n1	ZINC000741766086	575378879	/nfs/dbraw/zinc/37/88/79/575378879.db2.gz	NXLXCODCUBBFJP-UHFFFAOYSA-N	0	3	347.850	3.215	20	30		EGEDHN
C=CC[C@@H](NC(=O)NC[C@@H](C)N1CCC(C)CC1)c1ccncc1	ZINC000734666209	575534356	/nfs/dbraw/zinc/53/43/56/575534356.db2.gz	WCGJCRIAVWAODW-SJLPKXTDSA-N	0	3	330.476	3.118	20	30		EGEDHN
C=CC[C@H](NC(=O)NCCN1CCCC[C@@H]1CC)c1ccncc1	ZINC000734678858	575541021	/nfs/dbraw/zinc/54/10/21/575541021.db2.gz	JGYDGFWPFOVKIR-ROUUACIJSA-N	0	3	330.476	3.263	20	30		EGEDHN
C=C(Cl)CNC(=O)c1ccccc1OCCN1CCCC[C@@H]1C	ZINC000736239254	575920773	/nfs/dbraw/zinc/92/07/73/575920773.db2.gz	SPODSOAMYSTIEQ-HNNXBMFYSA-N	0	3	336.863	3.422	20	30		EGEDHN
C=C(C)CNC(=S)N(C)[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000737458547	576232742	/nfs/dbraw/zinc/23/27/42/576232742.db2.gz	WPBFQXCUCZPDAS-WMZOPIPTSA-N	0	3	331.529	3.422	20	30		EGEDHN
N#CCSc1ccccc1C(=O)N1CCCN(C2CCCC2)CC1	ZINC000737958636	576276694	/nfs/dbraw/zinc/27/66/94/576276694.db2.gz	CANOQOFQEJXETB-UHFFFAOYSA-N	0	3	343.496	3.393	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2cc(F)c(Cl)cc2Cl)CC1	ZINC000740736505	576621635	/nfs/dbraw/zinc/62/16/35/576621635.db2.gz	XENWKWIPBKUBLR-UHFFFAOYSA-N	0	3	343.229	3.350	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2cc(Cl)cc3cccnc32)CC1	ZINC000740737554	576621803	/nfs/dbraw/zinc/62/18/03/576621803.db2.gz	QNDIJKFCVUSGGG-UHFFFAOYSA-N	0	3	341.842	3.106	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2ccc(Cl)c(Cl)c2)CC1	ZINC000740736237	576621810	/nfs/dbraw/zinc/62/18/10/576621810.db2.gz	KMNPGEIDKJCGJY-UHFFFAOYSA-N	0	3	325.239	3.211	20	30		EGEDHN
C=C(C)CN1CCC(NC(=S)Nc2cccc(OCC)c2)CC1	ZINC000742997672	576799154	/nfs/dbraw/zinc/79/91/54/576799154.db2.gz	PKVHNENKBLBVFR-UHFFFAOYSA-N	0	3	333.501	3.412	20	30		EGEDHN
C#CCOc1ccc(F)cc1NC(=O)NC[C@@H](C)N1CCC(C)CC1	ZINC000743201370	576803226	/nfs/dbraw/zinc/80/32/26/576803226.db2.gz	PDYJVCSXQQDXKW-OAHLLOKOSA-N	0	3	347.434	3.080	20	30		EGEDHN
CC(=NNCc1cc(F)ccc1F)c1cccc(OCCN(C)C)c1	ZINC000743531066	576811203	/nfs/dbraw/zinc/81/12/03/576811203.db2.gz	CILZWIYGPYWOSE-UHFFFAOYSA-N	0	3	347.409	3.419	20	30		EGEDHN
C#CCN(Cc1ccc(F)cc1)C(=O)NC[C@H](C)N1CCC(C)CC1	ZINC000744869422	576836001	/nfs/dbraw/zinc/83/60/01/576836001.db2.gz	YEXQTEPRQXLFOK-KRWDZBQOSA-N	0	3	345.462	3.091	20	30		EGEDHN
C=C[C@@H](C)[NH2+]Cc1cccc(OCc2ccccc2-c2nnn[n-]2)c1	ZINC000819730016	606771582	/nfs/dbraw/zinc/77/15/82/606771582.db2.gz	PQJGIIJFQDUBLD-CQSZACIVSA-N	0	3	335.411	3.110	20	30		EGEDHN
C=C[C@@H](C)[NH2+]Cc1cccc(OCc2ccccc2-c2nn[n-]n2)c1	ZINC000819730016	606771584	/nfs/dbraw/zinc/77/15/84/606771584.db2.gz	PQJGIIJFQDUBLD-CQSZACIVSA-N	0	3	335.411	3.110	20	30		EGEDHN
CN(CCC#N)c1ccc(CNCc2ccc(N3CCCC3)nc2)cc1	ZINC000030900204	1291357927	/nfs/dbraw/zinc/35/79/27/1291357927.db2.gz	ISUQBHISYWABHM-UHFFFAOYSA-N	0	3	349.482	3.321	20	30		EGEDHN
COc1ccc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)cc1C#N	ZINC000830413073	1292717315	/nfs/dbraw/zinc/71/73/15/1292717315.db2.gz	FGXUSPJBPOCSAO-CHWSQXEVSA-N	0	3	342.317	3.253	20	30		EGEDHN
COc1ccccc1OCCN(C)Cc1ccc(O[C@@H](C)C#N)cc1	ZINC000091899853	1292846311	/nfs/dbraw/zinc/84/63/11/1292846311.db2.gz	REXCURCIFHDEDW-INIZCTEOSA-N	0	3	340.423	3.497	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC(=O)Nc1ccccc1SC(F)F	ZINC000831823222	1292922748	/nfs/dbraw/zinc/92/27/48/1292922748.db2.gz	SSZJZYJBHNTPBO-YPMHNXCESA-N	0	3	342.411	3.263	20	30		EGEDHN
CS[C@H](C)C(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000103330229	1293001610	/nfs/dbraw/zinc/00/16/10/1293001610.db2.gz	AAILXGGFDCQSPQ-VXNVDRBHSA-N	0	3	331.224	3.392	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)c2ccc(-n3cccn3)c(F)c2)n1	ZINC000103795891	1293013769	/nfs/dbraw/zinc/01/37/69/1293013769.db2.gz	KETAPSXZTHMACU-GFCCVEGCSA-N	0	3	326.356	3.266	20	30		EGEDHN
CO[C@@](C)(C(=O)C(C#N)c1nc2ccccc2n1C)c1ccccc1	ZINC000106982431	1293055293	/nfs/dbraw/zinc/05/52/93/1293055293.db2.gz	BSKIHZQJUCPCAU-MGPUTAFESA-N	0	3	333.391	3.311	20	30		EGEDHN
N#CC(C(=O)NC1CCCC1)C(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1	ZINC000107409773	1293066081	/nfs/dbraw/zinc/06/60/81/1293066081.db2.gz	GYXBYHPCCIZHOL-ARFHVFGLSA-N	0	3	330.815	3.211	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN[C@@H](C)c2ccc(NC(N)=O)cc2)cc1	ZINC000113351171	1293147479	/nfs/dbraw/zinc/14/74/79/1293147479.db2.gz	RCQGOOMKIJZYPZ-KGLIPLIRSA-N	0	3	338.411	3.319	20	30		EGEDHN
C=CCC[C@@H](CO)[NH2+][C@@H](C)c1cc(Br)cc(C)c1[O-]	ZINC000834903957	1293171111	/nfs/dbraw/zinc/17/11/11/1293171111.db2.gz	LTTIWAWRELEHIV-AAEUAGOBSA-N	0	3	328.250	3.441	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@H]1C[C@@H]1c1c(F)cccc1F	ZINC000116592006	1293207605	/nfs/dbraw/zinc/20/76/05/1293207605.db2.gz	WEEQKJBKNLICKD-RWMBFGLXSA-N	0	3	334.366	3.084	20	30		EGEDHN
C=CCNC(=O)C(C#N)C(=O)CCCc1csc2ccccc12	ZINC000120035821	1293300273	/nfs/dbraw/zinc/30/02/73/1293300273.db2.gz	ZLSHVGWMBHLJOF-HNNXBMFYSA-N	0	3	326.421	3.235	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)[C@H](C)OCC2CC2)cc1	ZINC000120260599	1293313601	/nfs/dbraw/zinc/31/36/01/1293313601.db2.gz	VVRRZGTUNGKWTM-KBXCAEBGSA-N	0	3	342.439	3.492	20	30		EGEDHN
CCc1nc(CC(=O)C(C#N)C(=O)Nc2ccc(CC)cc2)cs1	ZINC000121300823	1293364805	/nfs/dbraw/zinc/36/48/05/1293364805.db2.gz	DYQJVPJIEFMXJS-HNNXBMFYSA-N	0	3	341.436	3.158	20	30		EGEDHN
N#CC(C(=O)Cc1ccoc1)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000123638718	1293449638	/nfs/dbraw/zinc/44/96/38/1293449638.db2.gz	QCGLWBKRYGDVRW-NSHDSACASA-N	0	3	337.162	3.476	20	30		EGEDHN
N#CC(C(=O)CCc1nc(-c2ccoc2)no1)c1nc2ccccc2[nH]1	ZINC000123811205	1293456179	/nfs/dbraw/zinc/45/61/79/1293456179.db2.gz	BEZCBSLYXOTZCJ-GFCCVEGCSA-N	0	3	347.334	3.015	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)COc2ccc3c(c2)CCC3)c1	ZINC000127509668	1293566130	/nfs/dbraw/zinc/56/61/30/1293566130.db2.gz	RNCLPRHZHSGBRH-LJQANCHMSA-N	0	3	348.402	3.210	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)CO[C@H](C)CC)cc1	ZINC000152323793	1293964187	/nfs/dbraw/zinc/96/41/87/1293964187.db2.gz	BGXZVNWSLGZDAS-PBHICJAKSA-N	0	3	330.428	3.492	20	30		EGEDHN
C#CCOc1ccc(F)cc1NC(=O)N(CCN(C)C)C1CCCC1	ZINC000154839148	1294072987	/nfs/dbraw/zinc/07/29/87/1294072987.db2.gz	MAQYOQZPMZXBNO-UHFFFAOYSA-N	0	3	347.434	3.176	20	30		EGEDHN
C#CCCCCNC(=O)N(CCN(C)C)Cc1cccc(Cl)c1	ZINC000154906611	1294075798	/nfs/dbraw/zinc/07/57/98/1294075798.db2.gz	YNTLTFNPXHTKTP-UHFFFAOYSA-N	0	3	335.879	3.217	20	30		EGEDHN
C[C@H](Cc1ccccc1Cl)C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000155197147	1294088707	/nfs/dbraw/zinc/08/87/07/1294088707.db2.gz	DZOSORIYZSYKSE-OCCSQVGLSA-N	0	3	341.798	3.261	20	30		EGEDHN
Cc1noc(C)c1[C@H](C)C(=O)C(C#N)C(=O)Nc1cccc(C)c1	ZINC000159762523	1294246518	/nfs/dbraw/zinc/24/65/18/1294246518.db2.gz	DPBNESZZRZHDOB-NHYWBVRUSA-N	0	3	325.368	3.051	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)[C@@H](C)c2c(C)noc2C)cc1	ZINC000159769551	1294246747	/nfs/dbraw/zinc/24/67/47/1294246747.db2.gz	GBUMHHIAWKNUQH-MEDUHNTESA-N	0	3	339.395	3.305	20	30		EGEDHN
C[C@@H](OC1CCCCCC1)C(=O)C(C#N)C(=O)NCc1ccccc1	ZINC000162393040	1294314723	/nfs/dbraw/zinc/31/47/23/1294314723.db2.gz	AVNJWXRFOJIYJM-QAPCUYQASA-N	0	3	342.439	3.140	20	30		EGEDHN
Cc1ccc(N(CCC#N)C(=O)[C@@H](C)N2C[C@@H]3[C@H](C2)C3(C)C)cc1	ZINC000172951493	1294451336	/nfs/dbraw/zinc/45/13/36/1294451336.db2.gz	YQCWOYSQZXMJDM-NXHRZFHOSA-N	0	3	325.456	3.218	20	30		EGEDHN
COc1ccc(CNCc2ccc(Cn3cccn3)cc2)cc1C#N	ZINC000174250872	1294489630	/nfs/dbraw/zinc/48/96/30/1294489630.db2.gz	VPZBMQMUFPCBLS-UHFFFAOYSA-N	0	3	332.407	3.101	20	30		EGEDHN
COc1ccc(CNCCN(C(=O)OC(C)(C)C)C2CC2)cc1C#N	ZINC000174341006	1294495378	/nfs/dbraw/zinc/49/53/78/1294495378.db2.gz	DHZMSLWXHMKNOI-UHFFFAOYSA-N	0	3	345.443	3.056	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)Cc2cccc(F)c2F)cc1	ZINC000176917162	1294643539	/nfs/dbraw/zinc/64/35/39/1294643539.db2.gz	DMAOPHVGBMUEBS-OAHLLOKOSA-N	0	3	342.345	3.417	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)Cc1ccccc1OC(C)C	ZINC000194582046	1295990508	/nfs/dbraw/zinc/99/05/08/1295990508.db2.gz	ZYIPMSGVCGOREQ-MRXNPFEDSA-N	0	3	330.428	3.032	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N1CCC(Cc2ccc(Cl)cc2)CC1	ZINC000870980678	1296164763	/nfs/dbraw/zinc/16/47/63/1296164763.db2.gz	AUFQIWFKLVLUGK-QGZVFWFLSA-N	0	3	333.863	3.142	20	30		EGEDHN
N#CC(C(=O)NC1CCCC1)C(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1	ZINC000250526492	1296456863	/nfs/dbraw/zinc/45/68/63/1296456863.db2.gz	QKNBZIODINGSOY-XHSDSOJGSA-N	0	3	330.815	3.211	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]\C[C@H](O)Cc2ccccc2)c([O-])c1	ZINC000255839234	1296570135	/nfs/dbraw/zinc/57/01/35/1296570135.db2.gz	AMNURCHCJNBJKY-BWCLHNGZSA-N	0	3	326.440	3.261	20	30		EGEDHN
C#CCOc1ccccc1CN[C@H]1CCC[C@@H]1NC(=O)OC(C)(C)C	ZINC000301726746	1296792367	/nfs/dbraw/zinc/79/23/67/1296792367.db2.gz	AJFMLKCAONKTMZ-IRXDYDNUSA-N	0	3	344.455	3.234	20	30		EGEDHN
C[C@H](NC[C@H](O)c1c(F)cccc1F)c1ccc(OCC#N)cc1	ZINC000305787309	1297050909	/nfs/dbraw/zinc/05/09/09/1297050909.db2.gz	YPDSUIGVYQNRNQ-SJCJKPOMSA-N	0	3	332.350	3.251	20	30		EGEDHN
C[C@H](CNC1CC(C#N)(c2ccccc2)C1)NC(=O)OC(C)(C)C	ZINC000379818607	1297539911	/nfs/dbraw/zinc/53/99/11/1297539911.db2.gz	SZOIZPOTAKNLDO-ICXUMSERSA-N	0	3	329.444	3.113	20	30		EGEDHN
N#CCCNC(=O)N1CCN(Cc2ccccc2)C2(CCCCC2)C1	ZINC000426416953	1297811287	/nfs/dbraw/zinc/81/12/87/1297811287.db2.gz	NLQCHXGUIXZXGI-UHFFFAOYSA-N	0	3	340.471	3.130	20	30		EGEDHN
N#Cc1sc(NC(=O)[C@H]2CCN(Cc3ccccc3)C2)nc1Cl	ZINC000875684073	1298439112	/nfs/dbraw/zinc/43/91/12/1298439112.db2.gz	YQOVYZUYMMJCDP-LBPRGKRZSA-N	0	3	346.843	3.129	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/Cc2csc(N(C)C)n2)c([O-])c1	ZINC000746815541	1298664645	/nfs/dbraw/zinc/66/46/45/1298664645.db2.gz	KIYIIXWABRFPHK-VCHYOVAHSA-N	0	3	332.473	3.380	20	30		EGEDHN
CCCN(CC(=O)N(CCC#N)c1ccc(C)c(C)c1)CC(C)(C)O	ZINC000747529339	1298796483	/nfs/dbraw/zinc/79/64/83/1298796483.db2.gz	IKWYZYABWOUTRZ-UHFFFAOYSA-N	0	3	345.487	3.033	20	30		EGEDHN
C=C(Cl)C[C@H](N)C(=O)Nc1ccc(F)cc1OCC(F)(F)F	ZINC000876663089	1298905238	/nfs/dbraw/zinc/90/52/38/1298905238.db2.gz	QGRDQJYEMCZQNS-VIFPVBQESA-N	0	3	340.704	3.175	20	30		EGEDHN
C=C(Cl)C[C@@H](N)C(=O)N1CCC[C@H]1c1nc2cc(C)ccc2[nH]1	ZINC000876875799	1299046646	/nfs/dbraw/zinc/04/66/46/1299046646.db2.gz	AZGYFAFCQXNTAZ-DOMZBBRYSA-N	0	3	332.835	3.005	20	30		EGEDHN
C=C(Cl)C[C@H](N)C(=O)N1CCC(c2c[nH]c3ccccc32)CC1	ZINC000876942281	1299080240	/nfs/dbraw/zinc/08/02/40/1299080240.db2.gz	TUTIOKDUKYUKJC-INIZCTEOSA-N	0	3	331.847	3.344	20	30		EGEDHN
CC(C)C[C@@](C)(CNC(=O)OC(C)(C)C)NCc1cccc(C#N)n1	ZINC000877149287	1299183715	/nfs/dbraw/zinc/18/37/15/1299183715.db2.gz	KJVMHHDPCUECJS-IBGZPJMESA-N	0	3	346.475	3.372	20	30		EGEDHN
C=CCOc1ccc(CN2CCC3(CCNC3=O)CC2)cc1Cl	ZINC000877783234	1299554963	/nfs/dbraw/zinc/55/49/63/1299554963.db2.gz	KQGVAYUNYHEIGW-UHFFFAOYSA-N	0	3	334.847	3.007	20	30		EGEDHN
CC(=O)[C@](C#N)(CCN(CCCO)CC(C)(C)C)c1ccccc1	ZINC000878081652	1299736690	/nfs/dbraw/zinc/73/66/90/1299736690.db2.gz	GEBONNKUFTXGGX-HXUWFJFHSA-N	0	3	330.472	3.158	20	30		EGEDHN
CC[C@H](O)[C@H]1CCCCN1CC[C@@](C#N)(C(C)=O)c1ccccc1	ZINC000878119819	1299760349	/nfs/dbraw/zinc/76/03/49/1299760349.db2.gz	FMHKIRZVEGMGHJ-HSALFYBXSA-N	0	3	328.456	3.052	20	30		EGEDHN
CC[C@H](O)[C@@H]1CCCCN1CC[C@@](C#N)(C(C)=O)c1ccccc1	ZINC000878119822	1299761052	/nfs/dbraw/zinc/76/10/52/1299761052.db2.gz	FMHKIRZVEGMGHJ-SLFFLAALSA-N	0	3	328.456	3.052	20	30		EGEDHN
COC(=O)c1ccccc1CC(=O)C(C#N)c1nc2ccccc2o1	ZINC000755615966	1300366064	/nfs/dbraw/zinc/36/60/64/1300366064.db2.gz	OPGQTWRPQGSJRH-AWEZNQCLSA-N	0	3	334.331	3.033	20	30		EGEDHN
COC(=O)[C@H](C)[C@@H](NCc1ccc(OCC#N)cc1)c1ccccc1	ZINC000756893370	1300584611	/nfs/dbraw/zinc/58/46/11/1300584611.db2.gz	YDJAOXODYPGIFS-DNVCBOLYSA-N	0	3	338.407	3.229	20	30		EGEDHN
C=CCC[C@H](O)CN[C@H](COC)c1cccc(Br)c1	ZINC000879662985	1300660417	/nfs/dbraw/zinc/66/04/17/1300660417.db2.gz	RIGKLHYFWXHJAJ-LSDHHAIUSA-N	0	3	328.250	3.053	20	30		EGEDHN
C=CCN1CC[C@@H](NC(C)(C)c2ccc(C(F)(F)F)cc2)C1=O	ZINC000880385834	1301098155	/nfs/dbraw/zinc/09/81/55/1301098155.db2.gz	WLBWDRODNTXBOL-CQSZACIVSA-N	0	3	326.362	3.317	20	30		EGEDHN
C#CCCN[C@@H](c1ccc(C)cc1)c1cccc(S(C)(=O)=O)c1	ZINC000760295778	1301247481	/nfs/dbraw/zinc/24/74/81/1301247481.db2.gz	MVHANMBHWARLBT-IBGZPJMESA-N	0	3	327.449	3.101	20	30		EGEDHN
N#CC(C(=O)c1ccc(C2SCCS2)cc1)c1ccncn1	ZINC000760358271	1301261886	/nfs/dbraw/zinc/26/18/86/1301261886.db2.gz	OROFPHJPNXAIIP-CYBMUJFWSA-N	0	3	327.434	3.445	20	30		EGEDHN
C=C(C)CN1CCC(N2C(=O)CN([C@H](C)c3ccccc3)C2=O)CC1	ZINC000761257432	1301429233	/nfs/dbraw/zinc/42/92/33/1301429233.db2.gz	RDGVPCMBHMBOIX-MRXNPFEDSA-N	0	3	341.455	3.052	20	30		EGEDHN
C#CCOc1ccccc1CNC[C@@](C)(O)c1cccc(Cl)c1	ZINC000764978388	1302180202	/nfs/dbraw/zinc/18/02/02/1302180202.db2.gz	IEVSXVPHXRFNHJ-LJQANCHMSA-N	0	3	329.827	3.349	20	30		EGEDHN
C#CC[C@H](CO)NCc1cccc(OCc2ccc(F)cc2F)c1	ZINC000883125945	1302262110	/nfs/dbraw/zinc/26/21/10/1302262110.db2.gz	ZTWAVIYUGXYTOE-QGZVFWFLSA-N	0	3	331.362	3.018	20	30		EGEDHN
C#CC[C@H](CO)NCc1ccccc1OCc1ccc(F)cc1F	ZINC000883125681	1302262554	/nfs/dbraw/zinc/26/25/54/1302262554.db2.gz	QPIDDVNUYBBLGI-QGZVFWFLSA-N	0	3	331.362	3.018	20	30		EGEDHN
CC(C)N1CCN(c2cccc(NC(=O)C#Cc3ccccc3)c2)CC1	ZINC000767934560	1302787867	/nfs/dbraw/zinc/78/78/67/1302787867.db2.gz	ZAMLVFRLDYQKAJ-UHFFFAOYSA-N	0	3	347.462	3.207	20	30		EGEDHN
C#C[C@H](C)N(C)C[C@@H](O)CO[C@H](c1ccccc1)c1ccccc1C	ZINC000769976327	1303201126	/nfs/dbraw/zinc/20/11/26/1303201126.db2.gz	ZJHLITDHNDZIQV-CZTZKLFOSA-N	0	3	337.463	3.415	20	30		EGEDHN
COc1cc(Cl)c(C)cc1NC(=O)C(C#N)C(=O)C=CSC	ZINC000771581992	1303423035	/nfs/dbraw/zinc/42/30/35/1303423035.db2.gz	IDLYYPLFVKOSCD-ORAHPGNNSA-N	0	3	338.816	3.181	20	30		EGEDHN
C#CCN1CCC[C@H](N[C@@H](c2cccnc2)c2ccc(F)c(C)c2)C1	ZINC000886663206	1303543893	/nfs/dbraw/zinc/54/38/93/1303543893.db2.gz	VVQACOVMXDXBFA-PZJWPPBQSA-N	0	3	337.442	3.306	20	30		EGEDHN
C=CCC1(O)CCN(CCOc2ccccc2C(F)(F)F)CC1	ZINC000886764071	1303589084	/nfs/dbraw/zinc/58/90/84/1303589084.db2.gz	KNZXXNQSPIKDNE-UHFFFAOYSA-N	0	3	329.362	3.487	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/C[C@@H]2COC3(CCCC3)O2)c([O-])c1	ZINC000773146811	1303632939	/nfs/dbraw/zinc/63/29/39/1303632939.db2.gz	CMMHWBMZRCZANG-XNHPLOEXSA-N	0	3	332.444	3.343	20	30		EGEDHN
C#CCN(C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCc2ccccc21	ZINC000776580091	1304173977	/nfs/dbraw/zinc/17/39/77/1304173977.db2.gz	QZYWNPCQTJIRGL-VQTJNVASSA-N	0	3	336.391	3.251	20	30		EGEDHN
C#CCSCC(=O)N(c1cccc(SC)c1)C1CCN(C)CC1	ZINC000888937229	1304337136	/nfs/dbraw/zinc/33/71/36/1304337136.db2.gz	DWVMJHWVFPWUGQ-UHFFFAOYSA-N	0	3	348.537	3.202	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CN[C@@H]1CCc2nc(C)ncc2C1	ZINC000778156536	1304405310	/nfs/dbraw/zinc/40/53/10/1304405310.db2.gz	XPPATCSUNZMZBE-OAHLLOKOSA-N	0	3	341.842	3.098	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CNCC1(C(=O)N(C)C)CCCC1	ZINC000778170814	1304408914	/nfs/dbraw/zinc/40/89/14/1304408914.db2.gz	YQFNARHIXAUTJH-UHFFFAOYSA-N	0	3	348.874	3.090	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)N(C)C)CC1	ZINC000891243504	1304998106	/nfs/dbraw/zinc/99/81/06/1304998106.db2.gz	OZZXQMXCIHKFQW-IBGZPJMESA-N	0	3	329.488	3.218	20	30		EGEDHN
N#Cc1ccc(NC[C@@H](c2ccco2)N2CCCCC2)c(CO)c1	ZINC000891484140	1305064850	/nfs/dbraw/zinc/06/48/50/1305064850.db2.gz	BZJPSPGRHOFEQS-SFHVURJKSA-N	0	3	325.412	3.283	20	30		EGEDHN
COc1ccc([C@@H](CCn2cncn2)NCc2ccc(C#N)cc2)cc1	ZINC000783223115	1305065135	/nfs/dbraw/zinc/06/51/35/1305065135.db2.gz	LYYAKNIVIYKVQY-HXUWFJFHSA-N	0	3	347.422	3.080	20	30		EGEDHN
C[C@@H]1C[C@H](C(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2Cl)CO1	ZINC000784491520	1305250841	/nfs/dbraw/zinc/25/08/41/1305250841.db2.gz	UFWCEQPIRBESRB-YWVKMMECSA-N	0	3	341.194	3.066	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)C(=O)NC1CCCC1)c1c[nH]c2ccccc21	ZINC000786320830	1305556659	/nfs/dbraw/zinc/55/66/59/1305556659.db2.gz	CVBKAYHTFUFKMH-XJKSGUPXSA-N	0	3	337.423	3.429	20	30		EGEDHN
C[C@@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(N2CCNC2=O)cc1	ZINC000786835878	1305640254	/nfs/dbraw/zinc/64/02/54/1305640254.db2.gz	JZMAVICQNDWXBF-HUUCEWRRSA-N	0	3	334.423	3.500	20	30		EGEDHN
C=CCOc1ccc(OS(=O)(=O)c2ccc(CN(C)C)cc2)cc1	ZINC000790029055	1306250012	/nfs/dbraw/zinc/25/00/12/1306250012.db2.gz	JDOJMVUDXJZOGF-UHFFFAOYSA-N	0	3	347.436	3.081	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]\CC2CCN(C(=O)OC)CC2)c([O-])c1	ZINC000794675408	1309570581	/nfs/dbraw/zinc/57/05/81/1309570581.db2.gz	AJCOOQNSQUCTAX-ZHZULCJRSA-N	0	3	347.459	3.136	20	30		EGEDHN
C[C@H](Cn1ccc2ccccc21)C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000796819133	1310093460	/nfs/dbraw/zinc/09/34/60/1310093460.db2.gz	QBNKUTMQVJABCE-GDBMZVCRSA-N	0	3	346.390	3.020	20	30		EGEDHN
N#Cc1ccc(Br)c(CNCC[C@H]2CCCC[C@H]2O)c1	ZINC000897533845	1310366399	/nfs/dbraw/zinc/36/63/99/1310366399.db2.gz	XVSQTYBNHGFNLJ-CZUORRHYSA-N	0	3	337.261	3.352	20	30		EGEDHN
C#CCCOc1ccc(CN[C@]2(CO)CCCc3ccccc32)cc1	ZINC000799344615	1310532408	/nfs/dbraw/zinc/53/24/08/1310532408.db2.gz	DSHQBBFQSKJLCB-QFIPXVFZSA-N	0	3	335.447	3.402	20	30		EGEDHN
C=C1CCN(C(=O)Nc2ccc(N3CCN(CC)CC3)cc2C)CC1	ZINC000800904056	1310833402	/nfs/dbraw/zinc/83/34/02/1310833402.db2.gz	NVKYHPVGODLTQD-UHFFFAOYSA-N	0	3	342.487	3.321	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2nc(CC(F)(F)F)cs2)CC1	ZINC000836703344	1320523563	/nfs/dbraw/zinc/52/35/63/1320523563.db2.gz	DJNGXZRGEFZXHA-UHFFFAOYSA-N	0	3	348.394	3.020	20	30		EGEDHN
CN(CCCN(C)C(=O)OC(C)(C)C)Cc1ccc(F)c(C#N)c1	ZINC000839654101	1320951740	/nfs/dbraw/zinc/95/17/40/1320951740.db2.gz	GGWGHTVKJGMUJQ-UHFFFAOYSA-N	0	3	335.423	3.386	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2cc(F)c(Cl)cc2F)C1	ZINC001008364224	1336834934	/nfs/dbraw/zinc/83/49/34/1336834934.db2.gz	IWRCRNAOQGKLEQ-LLVKDONJSA-N	0	3	328.790	3.389	20	30		EGEDHN
C[C@H](C#N)OCCN1CC[C@@H](Oc2ccc(Cl)c(Cl)c2)C1	ZINC000801927134	1316967224	/nfs/dbraw/zinc/96/72/24/1316967224.db2.gz	IGQLSGQGCSHNEO-DGCLKSJQSA-N	0	3	329.227	3.375	20	30		EGEDHN
C[C@H](C#N)OCCN(Cc1ccccc1)C[C@@H](O)c1ccsc1	ZINC000801927059	1316967159	/nfs/dbraw/zinc/96/71/59/1316967159.db2.gz	HXBRKCYSTZKDBF-CRAIPNDOSA-N	0	3	330.453	3.212	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)Cc2ccc(Cl)s2)cc1	ZINC000802042009	1316975583	/nfs/dbraw/zinc/97/55/83/1316975583.db2.gz	LCLDWVBTIMXGDX-CYBMUJFWSA-N	0	3	348.811	3.300	20	30		EGEDHN
COc1ccc(C(NCCO[C@@H](C)C#N)c2ccc(OC)cc2)cc1	ZINC000802741678	1317033748	/nfs/dbraw/zinc/03/37/48/1317033748.db2.gz	RLQZVYWFBZNTBO-HNNXBMFYSA-N	0	3	340.423	3.311	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)cc1F	ZINC001019112986	1317051770	/nfs/dbraw/zinc/05/17/70/1317051770.db2.gz	VXICMWGCVYVZFT-AWEZNQCLSA-N	0	3	343.427	3.072	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](NCc3ccc(Cl)c(OC)c3)C2)C1	ZINC001019353441	1317189504	/nfs/dbraw/zinc/18/95/04/1317189504.db2.gz	KUZWJTIEKDWDEZ-HNNXBMFYSA-N	0	3	348.874	3.395	20	30		EGEDHN
C=Cc1ccc(C(=O)N2CC[C@H](NCc3ccc(F)c(C#N)c3)C2)cc1	ZINC001019421017	1317230773	/nfs/dbraw/zinc/23/07/73/1317230773.db2.gz	WLFRKZHOWGRPKS-IBGZPJMESA-N	0	3	349.409	3.345	20	30		EGEDHN
C=CC(C)(C)CC(=O)Nc1cccc(CN2CCC(CO)CC2)c1	ZINC000901003916	1317371442	/nfs/dbraw/zinc/37/14/42/1317371442.db2.gz	QMRXATMYUUXEKD-UHFFFAOYSA-N	0	3	330.472	3.432	20	30		EGEDHN
CC[C@H](C)N[C@@H](CNC(=O)c1ccccc1OCC#N)c1ccco1	ZINC000807681015	1317577787	/nfs/dbraw/zinc/57/77/87/1317577787.db2.gz	YEVFRAHNTULEJE-HOCLYGCPSA-N	0	3	341.411	3.041	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)[C@@H]2CCC[C@@H]2CCC)C1	ZINC001020326355	1317645274	/nfs/dbraw/zinc/64/52/74/1317645274.db2.gz	NWWJDFILMLUFTK-ZQDZILKHSA-N	0	3	343.309	3.348	20	30		EGEDHN
CC1(C(=O)N[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)CCCC1	ZINC001020445499	1317702060	/nfs/dbraw/zinc/70/20/60/1317702060.db2.gz	KVBSCJGYQXFVII-WKILWMFISA-N	0	3	329.419	3.014	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@H](NC(=O)C[C@@H]3CC=CCC3)C2)c(F)c1	ZINC001020473266	1317710329	/nfs/dbraw/zinc/71/03/29/1317710329.db2.gz	VBWKZACKECCXSD-ZTFGCOKTSA-N	0	3	341.430	3.181	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)Cc2c(C)[nH]c3ccccc32)C1	ZINC001020533793	1317751490	/nfs/dbraw/zinc/75/14/90/1317751490.db2.gz	HOKGXFNTNAVGMJ-HDJSIYSDSA-N	0	3	331.847	3.008	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@H](C)c2ccc(Cl)cc2)C1	ZINC001020540080	1317753394	/nfs/dbraw/zinc/75/33/94/1317753394.db2.gz	PALMLAUEUBSDBI-KCPJHIHWSA-N	0	3	327.255	3.433	20	30		EGEDHN
C[C@H]1CCC[C@@]1(C)C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001020555983	1317769733	/nfs/dbraw/zinc/76/97/33/1317769733.db2.gz	XGFQJNNEQUEYSD-VZYKRBATSA-N	0	3	343.446	3.260	20	30		EGEDHN
CC(=O)N(C)c1ccc(CNCc2ccc(O[C@@H](C)C#N)cc2)cc1	ZINC000858249975	1328722127	/nfs/dbraw/zinc/72/21/27/1328722127.db2.gz	FLPYZLGNQHIZLT-HNNXBMFYSA-N	0	3	337.423	3.250	20	30		EGEDHN
COc1cc(-c2nc(-c3ccc(CN(C)C)cc3)no2)ccc1C#N	ZINC000904624903	1317872298	/nfs/dbraw/zinc/87/22/98/1317872298.db2.gz	LVYDWRSACQLZBY-UHFFFAOYSA-N	0	3	334.379	3.345	20	30		EGEDHN
CCOc1cc(/C=C2\C(=O)c3ncnn3C2C)cc(Cl)c1OC	ZINC000905081472	1317921600	/nfs/dbraw/zinc/92/16/00/1317921600.db2.gz	QVEARNUNEXKZFM-QQCYMQAYSA-N	0	3	333.775	3.180	20	30		EGEDHN
CC1/C(=C/c2ccc(OCC(F)(F)F)c(F)c2)C(=O)c2ncnn21	ZINC000905087840	1317922136	/nfs/dbraw/zinc/92/21/36/1317922136.db2.gz	ZSZGGFSRTMMCET-YXSUAUNDSA-N	0	3	341.264	3.199	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)Cc2cccc3ccccc32)C1	ZINC001020964839	1318018188	/nfs/dbraw/zinc/01/81/88/1318018188.db2.gz	MCIOGKVJLZUXRJ-QAQDUYKDSA-N	0	3	328.843	3.372	20	30		EGEDHN
COc1ccc(C#N)cc1CNC[C@@H]1CCCCN1C(=O)CC(C)C	ZINC000959860516	1318233213	/nfs/dbraw/zinc/23/32/13/1318233213.db2.gz	SDJRQSSARUDXAL-SFHVURJKSA-N	0	3	343.471	3.084	20	30		EGEDHN
C#C[C@@H](NC(=O)NC[C@@H]1CCCCN1C1CC1)c1ccc(Cl)cc1	ZINC000811911468	1318289538	/nfs/dbraw/zinc/28/95/38/1318289538.db2.gz	PPOKIJDYWXKERK-ZWKOTPCHSA-N	0	3	345.874	3.330	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)C2(F)CCCC2)s1	ZINC000960053110	1318331955	/nfs/dbraw/zinc/33/19/55/1318331955.db2.gz	XQAYUVVNCUNYGO-AWEZNQCLSA-N	0	3	349.475	3.373	20	30		EGEDHN
CC(F)(F)CC(=O)N1CCCC[C@H]1CNCc1ccc(C#N)s1	ZINC000960119419	1318366997	/nfs/dbraw/zinc/36/69/97/1318366997.db2.gz	KDGRWAGSVSVIER-LBPRGKRZSA-N	0	3	341.427	3.136	20	30		EGEDHN
C=CCCC(=O)[C@@H]1CCCN1C(=O)C[C@@H](c1ccccc1)N(C)C	ZINC000908658706	1318383068	/nfs/dbraw/zinc/38/30/68/1318383068.db2.gz	FKJPETGJGZYTOV-ROUUACIJSA-N	0	3	328.456	3.206	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@@H](CCCN3C(=O)c3cc[nH]c3)C2)c1	ZINC001021592432	1318437753	/nfs/dbraw/zinc/43/77/53/1318437753.db2.gz	RPLHKTVVCMZYAA-VQTJNVASSA-N	0	3	348.450	3.013	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(CCC)s2)C1	ZINC001021595516	1318440738	/nfs/dbraw/zinc/44/07/38/1318440738.db2.gz	ZHHUCJPZFUTJMA-WBVHZDCISA-N	0	3	330.497	3.260	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cccc2cccnc21	ZINC000960282306	1318443954	/nfs/dbraw/zinc/44/39/54/1318443954.db2.gz	ZYRCOFIMGVTKPV-TZIWHRDSSA-N	0	3	343.430	3.406	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1c[nH]c2ccccc12	ZINC000960281652	1318444032	/nfs/dbraw/zinc/44/40/32/1318444032.db2.gz	PTPXWXCZJFDHOW-WOJBJXKFSA-N	0	3	331.419	3.339	20	30		EGEDHN
CC1(C(=O)OCc2cc(C#N)ccn2)CCN(Cc2ccccc2)CC1	ZINC000909189517	1318446228	/nfs/dbraw/zinc/44/62/28/1318446228.db2.gz	AINFRSPGHWDILZ-UHFFFAOYSA-N	0	3	349.434	3.299	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1scnc1C1CC1	ZINC000960312467	1318455718	/nfs/dbraw/zinc/45/57/18/1318455718.db2.gz	CRROQOXGZOTLKY-NVXWUHKLSA-N	0	3	339.464	3.192	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc2[nH]c(C)nc2c1	ZINC000960313273	1318456005	/nfs/dbraw/zinc/45/60/05/1318456005.db2.gz	CDHUEYNLUWQXML-WOJBJXKFSA-N	0	3	346.434	3.043	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)C1Cc2ccccc2C1	ZINC000960312819	1318456112	/nfs/dbraw/zinc/45/61/12/1318456112.db2.gz	FFTQZIGOAQLMKI-FGZHOGPDSA-N	0	3	346.474	3.349	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc2cnccc2c1	ZINC000960318093	1318458914	/nfs/dbraw/zinc/45/89/14/1318458914.db2.gz	KEWLLTYEDILCNS-NHCUHLMSSA-N	0	3	343.430	3.406	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@@H](C)c1cccnc1	ZINC000960327209	1318463440	/nfs/dbraw/zinc/46/34/40/1318463440.db2.gz	PSXHZWLOJBLFDB-CWFSZBLJSA-N	0	3	335.451	3.133	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc(C)nc1C	ZINC000960333387	1318466437	/nfs/dbraw/zinc/46/64/37/1318466437.db2.gz	JRNXGJWIEDHUTG-WOJBJXKFSA-N	0	3	335.451	3.260	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2coc3cc(F)ccc32)C1	ZINC001021619365	1318467913	/nfs/dbraw/zinc/46/79/13/1318467913.db2.gz	KSVKASSQIUEIFU-KBXCAEBGSA-N	0	3	340.398	3.132	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1sc(C)nc1C	ZINC000960335447	1318469062	/nfs/dbraw/zinc/46/90/62/1318469062.db2.gz	RXYGMUKBSKHUNZ-IAGOWNOFSA-N	0	3	341.480	3.321	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc3cc(C)ccc3n2)C1	ZINC001021627029	1318479054	/nfs/dbraw/zinc/47/90/54/1318479054.db2.gz	KJMRWRDKZJXLBB-WIYYLYMNSA-N	0	3	347.462	3.103	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(-c3ccco3)o2)C1	ZINC001021629567	1318483163	/nfs/dbraw/zinc/48/31/63/1318483163.db2.gz	HLXAFQCZYIGJEM-HOTGVXAUSA-N	0	3	338.407	3.099	20	30		EGEDHN
CC(COC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)[N+](=O)[O-]	ZINC000813101710	1318499357	/nfs/dbraw/zinc/49/93/57/1318499357.db2.gz	HKQZPLXYXHVTGI-NSHDSACASA-N	0	3	344.298	3.312	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)CCc2cccc(Cl)c2)C1	ZINC001021642404	1318499752	/nfs/dbraw/zinc/49/97/52/1318499752.db2.gz	QDVCRHGHWVWIIE-IEBWSBKVSA-N	0	3	344.886	3.219	20	30		EGEDHN
CC(COC(=O)c1ccccc1Oc1ccccc1C#N)[N+](=O)[O-]	ZINC000813114235	1318503069	/nfs/dbraw/zinc/50/30/69/1318503069.db2.gz	OEARRBVGDZKMHQ-LBPRGKRZSA-N	0	3	326.308	3.173	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2cccc(Cl)c2)C1	ZINC001021664846	1318526891	/nfs/dbraw/zinc/52/68/91/1318526891.db2.gz	IVLDDBOLFIDSMK-PKOBYXMFSA-N	0	3	344.886	3.219	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(Cl)cs2)C1	ZINC001021677518	1318546048	/nfs/dbraw/zinc/54/60/48/1318546048.db2.gz	QPKFBGFTXBDDGJ-HIFRSBDPSA-N	0	3	336.888	3.351	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)C2CCC(F)(F)CC2)C1	ZINC001021679075	1318550069	/nfs/dbraw/zinc/55/00/69/1318550069.db2.gz	LXUNQGVSAYCVMR-IAGOWNOFSA-N	0	3	338.442	3.148	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc3cc[nH]c3c2)C1	ZINC001021679878	1318551074	/nfs/dbraw/zinc/55/10/74/1318551074.db2.gz	UAPUYPUQHOFWJD-QUCCMNQESA-N	0	3	335.451	3.118	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)[C@H]2CC[C@H](C(C)C)CC2)C1	ZINC001021701941	1318574784	/nfs/dbraw/zinc/57/47/84/1318574784.db2.gz	DMAKPQAIAJYKOB-WTGUMLROSA-N	0	3	330.516	3.395	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2[nH]ccc2-c2ccccc2)C1	ZINC001021712863	1318589614	/nfs/dbraw/zinc/58/96/14/1318589614.db2.gz	LEHJRFGOAFPMGZ-ICSRJNTNSA-N	0	3	347.462	3.241	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(C)c(F)cc2Cl)C1	ZINC001021715935	1318595549	/nfs/dbraw/zinc/59/55/49/1318595549.db2.gz	BDGKXFFDHXTJOW-RDTXWAMCSA-N	0	3	348.849	3.347	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccccc2Cl)C1	ZINC001021720701	1318604395	/nfs/dbraw/zinc/60/43/95/1318604395.db2.gz	YQUQJOPZLAGTEU-YJBOKZPZSA-N	0	3	330.859	3.290	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc3ccccc3c2)C1	ZINC001021721314	1318606658	/nfs/dbraw/zinc/60/66/58/1318606658.db2.gz	DXKHCLLUXNZVEC-RTWAWAEBSA-N	0	3	332.447	3.400	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(OCC)cc2)C1	ZINC001021724848	1318616833	/nfs/dbraw/zinc/61/68/33/1318616833.db2.gz	OVDDVXLWBQXIFL-QUCCMNQESA-N	0	3	340.467	3.035	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)CCc2ccccc2Cl)C1	ZINC001021726521	1318620310	/nfs/dbraw/zinc/62/03/10/1318620310.db2.gz	CYQBHKMNPYCJKK-HKUYNNGSSA-N	0	3	344.886	3.219	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)C23CC(C(C)(C)C)(C2)C3)C1	ZINC001021746173	1318660806	/nfs/dbraw/zinc/66/08/06/1318660806.db2.gz	IYMHWOYCBHPBCF-UUBYJMPYSA-N	0	3	328.500	3.149	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc3c(cccc3C)o2)C1	ZINC001021746992	1318662543	/nfs/dbraw/zinc/66/25/43/1318662543.db2.gz	RUROEXGFXHDCES-FUHWJXTLSA-N	0	3	336.435	3.301	20	30		EGEDHN
CCC(=NNC(=N)N)c1ccc(Br)cc1C(F)(F)F	ZINC000814796426	1318819915	/nfs/dbraw/zinc/81/99/15/1318819915.db2.gz	CNMTZJWERCXEFI-UHFFFAOYSA-N	0	3	337.143	3.065	20	30		EGEDHN
C#CCNC(=O)CCN1CCCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000815094984	1318889578	/nfs/dbraw/zinc/88/95/78/1318889578.db2.gz	QPRFPQIQVHFORO-INIZCTEOSA-N	0	3	338.373	3.372	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H]1CN(C)C[C@@H]1CC(C)(C)CO1	ZINC000960789421	1318893571	/nfs/dbraw/zinc/89/35/71/1318893571.db2.gz	WNTZGASKGOAXSK-IRXDYDNUSA-N	0	3	336.520	3.327	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]1CN(C)Cc1ccccc1N(C)C	ZINC000960792270	1318897316	/nfs/dbraw/zinc/89/73/16/1318897316.db2.gz	UORBPVLUCHEJKV-SFHVURJKSA-N	0	3	343.515	3.388	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)C2CCC3(CC3)CC2)C1	ZINC001022441862	1318943544	/nfs/dbraw/zinc/94/35/44/1318943544.db2.gz	DDAPNIZZIOKZLA-OKILXGFUSA-N	0	3	341.293	3.102	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@@H]2CC[C@@H]2c2ccc(F)cc2)C1	ZINC001022486030	1318959861	/nfs/dbraw/zinc/95/98/61/1318959861.db2.gz	DQJXHUPMIYOJOF-YYIAUSFCSA-N	0	3	336.838	3.309	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)C(C)(C)C(F)F	ZINC000960851404	1318992237	/nfs/dbraw/zinc/99/22/37/1318992237.db2.gz	LYEMAHMMPLYYIL-MRXNPFEDSA-N	0	3	349.425	3.272	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)[C@@H]1C[C@H]1C1CC1	ZINC000960916241	1319062449	/nfs/dbraw/zinc/06/24/49/1319062449.db2.gz	DWNQVJLHTASLJK-HSALFYBXSA-N	0	3	337.467	3.027	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)C2(c3ccccc3F)CCC2)C1	ZINC001022962994	1319189927	/nfs/dbraw/zinc/18/99/27/1319189927.db2.gz	LJLNNOQLXQXMAD-OKILXGFUSA-N	0	3	336.838	3.237	20	30		EGEDHN
C=CCC[N@H+]1CC[C@@H]([C@@H]2CCCN(C(=O)c3ccccc3[O-])C2)C1	ZINC000961092939	1319203299	/nfs/dbraw/zinc/20/32/99/1319203299.db2.gz	MHRCBKVQFKISGC-IAGOWNOFSA-N	0	3	328.456	3.142	20	30		EGEDHN
C=CCC[N@@H+]1CC[C@@H]([C@@H]2CCCN(C(=O)c3ccccc3[O-])C2)C1	ZINC000961092939	1319203305	/nfs/dbraw/zinc/20/33/05/1319203305.db2.gz	MHRCBKVQFKISGC-IAGOWNOFSA-N	0	3	328.456	3.142	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)CC2C3CC4CC(C3)CC2C4)C1	ZINC001023117869	1319268158	/nfs/dbraw/zinc/26/81/58/1319268158.db2.gz	FMIXYAIGVXXQMR-FOXMUNAVSA-N	0	3	336.907	3.438	20	30		EGEDHN
C[C@H]1C[C@@H](C(=O)OC(C)(C)C)CN(Cc2ccc(OCC#N)cc2)C1	ZINC000817289312	1319314051	/nfs/dbraw/zinc/31/40/51/1319314051.db2.gz	WXMDWVFMEVBUMG-DOTOQJQBSA-N	0	3	344.455	3.389	20	30		EGEDHN
C[C@H]1C[C@H](C(=O)OC(C)(C)C)CN(Cc2ccc(OCC#N)cc2)C1	ZINC000817289314	1319314099	/nfs/dbraw/zinc/31/40/99/1319314099.db2.gz	WXMDWVFMEVBUMG-RDJZCZTQSA-N	0	3	344.455	3.389	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]([C@H]2CCN(Cc3conc3C)C2)C1	ZINC000961223258	1319350315	/nfs/dbraw/zinc/35/03/15/1319350315.db2.gz	AJLJNSGYPNJHQM-SJORKVTESA-N	0	3	345.487	3.256	20	30		EGEDHN
Cc1ccoc1C(=O)NC[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001023222949	1319360367	/nfs/dbraw/zinc/36/03/67/1319360367.db2.gz	GATISNJWZDINNL-GOSISDBHSA-N	0	3	337.423	3.102	20	30		EGEDHN
CC(=O)Nc1ccc(CC(=O)C(C#N)c2nc3ccccc3o2)cc1	ZINC000915104998	1319423356	/nfs/dbraw/zinc/42/33/56/1319423356.db2.gz	ROHJVEPGOWVSRD-HNNXBMFYSA-N	0	3	333.347	3.205	20	30		EGEDHN
C#CCN1CCC[C@@H](CNC(=O)c2ccc(C(C)(C)CC)cc2)C1	ZINC001023438273	1319533643	/nfs/dbraw/zinc/53/36/43/1319533643.db2.gz	RJVNDOTXXLOGQH-KRWDZBQOSA-N	0	3	326.484	3.449	20	30		EGEDHN
C#CCN(C)CCCNC(=O)[C@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1	ZINC000818584101	1319563918	/nfs/dbraw/zinc/56/39/18/1319563918.db2.gz	FEKJWHIEOANVQV-CVEARBPZSA-N	0	3	339.266	3.168	20	30		EGEDHN
C#CCN(C)CCCNC(=O)[C@@H]1C[C@H]1c1cc(Cl)cc(Cl)c1	ZINC000818584104	1319562890	/nfs/dbraw/zinc/56/28/90/1319562890.db2.gz	FEKJWHIEOANVQV-JKSUJKDBSA-N	0	3	339.266	3.168	20	30		EGEDHN
C#CCN(C)CCCNC(=O)[C@@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1	ZINC000818584103	1319563107	/nfs/dbraw/zinc/56/31/07/1319563107.db2.gz	FEKJWHIEOANVQV-HZPDHXFCSA-N	0	3	339.266	3.168	20	30		EGEDHN
C#CCN(C)CCCNC(=O)C[C@@H](C)c1ccccc1C(F)(F)F	ZINC000818599576	1319566303	/nfs/dbraw/zinc/56/63/03/1319566303.db2.gz	ZHJMXRYBKMEMDV-CQSZACIVSA-N	0	3	340.389	3.270	20	30		EGEDHN
C#CCN(C)CCCNC(=O)[C@@H](CC)c1cccc(C(F)(F)F)c1	ZINC000818612272	1319569242	/nfs/dbraw/zinc/56/92/42/1319569242.db2.gz	RUTXPHVQZDDZBE-INIZCTEOSA-N	0	3	340.389	3.270	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc3c(cc(C)cc3C)[nH]2)C1	ZINC001023515768	1319622084	/nfs/dbraw/zinc/62/20/84/1319622084.db2.gz	HKJKCXSMOWQPHS-QGZVFWFLSA-N	0	3	337.467	3.250	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCCN(CCC(F)(F)F)C2)cc1	ZINC001023527592	1319633692	/nfs/dbraw/zinc/63/36/92/1319633692.db2.gz	YILPBUDDAMOZJG-OAHLLOKOSA-N	0	3	338.373	3.062	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc3c(ccc(C)c3C)[nH]2)C1	ZINC001023529218	1319633848	/nfs/dbraw/zinc/63/38/48/1319633848.db2.gz	ZSKRALRWMRSKSW-QGZVFWFLSA-N	0	3	337.467	3.250	20	30		EGEDHN
CC1(C)CC[C@H]1C(=O)NC[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001023536108	1319642906	/nfs/dbraw/zinc/64/29/06/1319642906.db2.gz	QGYYJJXEPQXCID-OALUTQOASA-N	0	3	339.483	3.323	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN[C@H]2CCCOc3cc(F)ccc32)cc1	ZINC000819210795	1319668669	/nfs/dbraw/zinc/66/86/69/1319668669.db2.gz	LIDKZEUBDQAISV-ZWKOTPCHSA-N	0	3	326.371	3.234	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN[C@H]2CCCOc3c(F)cccc32)cc1	ZINC000819214831	1319670181	/nfs/dbraw/zinc/67/01/81/1319670181.db2.gz	UVGIRIYYFSETTQ-ROUUACIJSA-N	0	3	326.371	3.234	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2[C@H]3CN([C@H](C)c4cccc(F)c4)C[C@H]32)C1	ZINC000961690492	1319701307	/nfs/dbraw/zinc/70/13/07/1319701307.db2.gz	WGMGVURSVPKSRJ-ZSGPHXLJSA-N	0	3	328.431	3.289	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)NC[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001023580552	1319701939	/nfs/dbraw/zinc/70/19/39/1319701939.db2.gz	PBCVBGMOWDQURM-XUVXKRRUSA-N	0	3	339.483	3.323	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)[C@@H](C)Oc2ccccc2F)c1	ZINC000916897780	1319721820	/nfs/dbraw/zinc/72/18/20/1319721820.db2.gz	SUYLLOYMGLVMLQ-HIFRSBDPSA-N	0	3	340.354	3.249	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)COc2cccc(Cl)c2)c1	ZINC000916897269	1319721969	/nfs/dbraw/zinc/72/19/69/1319721969.db2.gz	FQNYCEYVWAKVHV-INIZCTEOSA-N	0	3	342.782	3.375	20	30		EGEDHN
CCCCSCC(=O)C(C#N)C(=O)Nc1ccccc1OCC	ZINC000916924904	1319726688	/nfs/dbraw/zinc/72/66/88/1319726688.db2.gz	GMERLPVRAHLEIJ-ZDUSSCGKSA-N	0	3	334.441	3.266	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)Cc1coc2ccc3ccccc3c12	ZINC000916946696	1319727111	/nfs/dbraw/zinc/72/71/11/1319727111.db2.gz	GLGOXRKQLRGSFN-INIZCTEOSA-N	0	3	334.375	3.362	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc3nc(C)ccc3c2)C1	ZINC001023656642	1319776887	/nfs/dbraw/zinc/77/68/87/1319776887.db2.gz	BKKWDLSJGCTVPM-KRWDZBQOSA-N	0	3	335.451	3.008	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc(OC)c(C3CC3)c2)C1	ZINC001023672188	1319786943	/nfs/dbraw/zinc/78/69/43/1319786943.db2.gz	WUVDTILKSNHGKA-MRXNPFEDSA-N	0	3	340.467	3.038	20	30		EGEDHN
CC[C@H](Cc1ccccc1C)C(=O)C(C#N)C(=O)NC1CCCC1	ZINC000819947561	1319809058	/nfs/dbraw/zinc/80/90/58/1319809058.db2.gz	HHQHQGFYXAQMSX-QAPCUYQASA-N	0	3	326.440	3.331	20	30		EGEDHN
C#CCN1CCC[C@H](CNC(=O)c2coc3ccc(Cl)cc23)C1	ZINC001023725938	1319865697	/nfs/dbraw/zinc/86/56/97/1319865697.db2.gz	UIENUXXSEMILLZ-CYBMUJFWSA-N	0	3	330.815	3.161	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc3c(s2)CCCC3)C1	ZINC001023738157	1319882340	/nfs/dbraw/zinc/88/23/40/1319882340.db2.gz	ZFXYRTQXSOTSQU-HNNXBMFYSA-N	0	3	330.497	3.092	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc(CCC)c(C)s2)C1	ZINC001023741390	1319887036	/nfs/dbraw/zinc/88/70/36/1319887036.db2.gz	VBLVGLMFEXUMAE-MRXNPFEDSA-N	0	3	332.513	3.474	20	30		EGEDHN
C#C[C@H](NC(=O)N[C@H](CN(C)C)c1ccc(F)cc1)c1ccccc1	ZINC000820591767	1319917886	/nfs/dbraw/zinc/91/78/86/1319917886.db2.gz	WVOMAYAXAYOOMK-RBUKOAKNSA-N	0	3	339.414	3.102	20	30		EGEDHN
C[C@H](CC(=O)C(C#N)C(=O)NC1CCCCC1)c1ccc(F)cc1	ZINC000918486344	1319955500	/nfs/dbraw/zinc/95/55/00/1319955500.db2.gz	ABFYGFACVRGBEC-DYVFJYSZSA-N	0	3	330.403	3.477	20	30		EGEDHN
COC(=O)C1(C#N)CCN([C@H]2CC[C@@](C)(c3ccccc3)C2)CC1	ZINC000824871439	1320293215	/nfs/dbraw/zinc/29/32/15/1320293215.db2.gz	GTNIPEONUWWEOC-PKOBYXMFSA-N	0	3	326.440	3.276	20	30		EGEDHN
COc1ccc(CN(C)CCCN(C)C(=O)OC(C)(C)C)cc1C#N	ZINC000839654387	1320952621	/nfs/dbraw/zinc/95/26/21/1320952621.db2.gz	KWXZQGNWQMSYJR-UHFFFAOYSA-N	0	3	347.459	3.256	20	30		EGEDHN
CC[C@H](OC1CCCC1)C(=O)C(C#N)C(=O)Nc1cccc(C)c1	ZINC000842289704	1321368061	/nfs/dbraw/zinc/36/80/61/1321368061.db2.gz	SCUQLQNGUNZOTP-IRXDYDNUSA-N	0	3	328.412	3.380	20	30		EGEDHN
Cc1ncsc1CCC(=O)C(C#N)C(=O)Nc1ccccc1Cl	ZINC000842290654	1321368317	/nfs/dbraw/zinc/36/83/17/1321368317.db2.gz	NHAIBBOHEJWVKK-LLVKDONJSA-N	0	3	347.827	3.385	20	30		EGEDHN
C[C@H](N[C@H]1CCc2ccc(C#N)cc21)c1ccc(N2CCNC2=O)cc1	ZINC000842903422	1321448710	/nfs/dbraw/zinc/44/87/10/1321448710.db2.gz	ROZSCEYZBBHYQX-XOBRGWDASA-N	0	3	346.434	3.426	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)C(C#N)c1nc(C2CC2)cs1	ZINC000842945211	1321452512	/nfs/dbraw/zinc/45/25/12/1321452512.db2.gz	OKDOQYGJPSHVGS-WCQYABFASA-N	0	3	347.440	3.206	20	30		EGEDHN
CCN(CC)c1ccc(/C=N/[C@H]2CCN(C(C)(C)C)C2=O)c(O)c1	ZINC000843265612	1321495869	/nfs/dbraw/zinc/49/58/69/1321495869.db2.gz	HFXMJIFAPAVMTL-UOEVCUDDSA-N	0	3	331.460	3.057	20	30		EGEDHN
CS[C@@H](C)CC(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847748738	1321900232	/nfs/dbraw/zinc/90/02/32/1321900232.db2.gz	HKKMNGAWRMIHAX-INIZCTEOSA-N	0	3	346.496	3.477	20	30		EGEDHN
CCCCCCCCCN(C)CC(=O)N1CCC2(CC1)OCCO2	ZINC000918742067	1321989306	/nfs/dbraw/zinc/98/93/06/1321989306.db2.gz	SLZWNGDRGHIMFH-UHFFFAOYSA-N	0	3	340.508	3.034	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)Cc2cc3ccccc3o2)c1	ZINC000920108997	1322137794	/nfs/dbraw/zinc/13/77/94/1322137794.db2.gz	MHCDFZVSUSUNRA-QGZVFWFLSA-N	0	3	348.358	3.331	20	30		EGEDHN
COc1cccc([C@H](OC)C(=O)C(C#N)c2nc3ccccc3n2C)c1	ZINC000850738356	1322281410	/nfs/dbraw/zinc/28/14/10/1322281410.db2.gz	KFGDKZAYDLQICU-BEFAXECRSA-N	0	3	349.390	3.146	20	30		EGEDHN
CC[C@H](C(=O)C(C#N)c1nc(C)cs1)N(C)C(=O)OC(C)(C)C	ZINC000850736858	1322281682	/nfs/dbraw/zinc/28/16/82/1322281682.db2.gz	NVCRGRFSXHJJFO-VXGBXAGGSA-N	0	3	337.445	3.273	20	30		EGEDHN
CC(C)(C)O[C@@H]1C[C@H]1C(=O)C(C#N)C(=O)Nc1ccccc1Cl	ZINC000850758981	1322286096	/nfs/dbraw/zinc/28/60/96/1322286096.db2.gz	FTXBXBHSLCTATQ-UHIISALHSA-N	0	3	334.803	3.191	20	30		EGEDHN
C[C@@H](Cc1ccccn1)NCc1cc(C#N)ccc1Br	ZINC000922222778	1322481671	/nfs/dbraw/zinc/48/16/71/1322481671.db2.gz	JAYPGABZVWLEMN-LBPRGKRZSA-N	0	3	330.229	3.437	20	30		EGEDHN
C=CCc1cc(CN[C@H](c2cnn(C)c2)C(C)C)cc(OC)c1O	ZINC000922897415	1322643667	/nfs/dbraw/zinc/64/36/67/1322643667.db2.gz	ZWAOBJAJZOGTCL-SFHVURJKSA-N	0	3	329.444	3.350	20	30		EGEDHN
CCN(CC)C(=O)[C@H](Cc1ccccc1)N[C@@H](C)CC(C)(C)C#N	ZINC000924530905	1323044062	/nfs/dbraw/zinc/04/40/62/1323044062.db2.gz	BVFJORHNOZWJKP-WMZOPIPTSA-N	0	3	329.488	3.384	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCN(C(=O)C2(F)CCCC2)C1	ZINC001024045332	1323096285	/nfs/dbraw/zinc/09/62/85/1323096285.db2.gz	GKPREUBXCCIMKB-INIZCTEOSA-N	0	3	343.446	3.169	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](CNCc2cc(C3CC3)no2)C1	ZINC001024093206	1323124183	/nfs/dbraw/zinc/12/41/83/1323124183.db2.gz	QVTQXLRDGBCORJ-CQSZACIVSA-N	0	3	331.460	3.092	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](CNCc2nc(C)sc2C)C1	ZINC001024094967	1323127058	/nfs/dbraw/zinc/12/70/58/1323127058.db2.gz	OHLBPZPTANHPQT-HNNXBMFYSA-N	0	3	335.517	3.300	20	30		EGEDHN
C#CCN(Cc1ccccc1)C[C@@H]1CCCN(C(=O)C(C)(C)C)C1	ZINC000852044966	1323136375	/nfs/dbraw/zinc/13/63/75/1323136375.db2.gz	JCQSJPNXXXFEFK-IBGZPJMESA-N	0	3	326.484	3.407	20	30		EGEDHN
C#C[C@@](C)(CC)NCC(=O)N[C@@H](C)c1ccc(OC(F)(F)F)cc1	ZINC000852102393	1323147258	/nfs/dbraw/zinc/14/72/58/1323147258.db2.gz	MIOZVBHUXGLBJF-LRDDRELGSA-N	0	3	342.361	3.154	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H](CNCc2ccn(C(C)C)n2)C1	ZINC001024138107	1323162430	/nfs/dbraw/zinc/16/24/30/1323162430.db2.gz	ZRCSUCYTQAHANM-PXNSSMCTSA-N	0	3	346.519	3.395	20	30		EGEDHN
C[C@@H](CC(C)(C)C#N)NCc1cccc(C(=O)NC[C@@H]2CCCO2)c1	ZINC000924787732	1323163236	/nfs/dbraw/zinc/16/32/36/1323163236.db2.gz	ZVSYPTTUKWVVBN-YJBOKZPZSA-N	0	3	343.471	3.013	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H](CNCc3ccccc3C#N)C2)C1	ZINC001024146516	1323172613	/nfs/dbraw/zinc/17/26/13/1323172613.db2.gz	XAGZEIXCWHQAOI-QGZVFWFLSA-N	0	3	337.467	3.243	20	30		EGEDHN
C=CCCCCCCCNC(=O)NC1CCN([C@@H]2CCOC2)CC1	ZINC000852343381	1323180007	/nfs/dbraw/zinc/18/00/07/1323180007.db2.gz	BXRODBJZNJXAPD-GOSISDBHSA-N	0	3	337.508	3.066	20	30		EGEDHN
C=C(C)CN1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1cc2cccc(Cl)c2o1	ZINC000963172122	1323223526	/nfs/dbraw/zinc/22/35/26/1323223526.db2.gz	VBMNLWNAERKQHT-VIKVFOODSA-N	0	3	330.815	3.322	20	30		EGEDHN
CCC(=O)N1CCC[C@@H]([C@@H]2CCCN2Cc2cc(C#N)ccc2F)C1	ZINC000963213462	1323239622	/nfs/dbraw/zinc/23/96/22/1323239622.db2.gz	AALRSMZBDUJWSJ-APWZRJJASA-N	0	3	343.446	3.310	20	30		EGEDHN
CN(CC(=O)C(C#N)c1nc2ccccc2s1)C[C@@H]1CC1(C)C	ZINC000852771140	1323240126	/nfs/dbraw/zinc/24/01/26/1323240126.db2.gz	CGDAWHKDXZTJKI-QWHCGFSZSA-N	0	3	327.453	3.450	20	30		EGEDHN
CN(CC(=O)C(C#N)c1nc2ccccc2s1)C[C@H]1CC1(C)C	ZINC000852771139	1323240823	/nfs/dbraw/zinc/24/08/23/1323240823.db2.gz	CGDAWHKDXZTJKI-OLZOCXBDSA-N	0	3	327.453	3.450	20	30		EGEDHN
C[C@@H](CC(=O)N1CCC[C@H](CNCc2ccccc2C#N)C1)C1CC1	ZINC001024280604	1323258689	/nfs/dbraw/zinc/25/86/89/1323258689.db2.gz	DKLIBWFJRMEOBR-DLBZAZTESA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)c2ccc(C)n2C)C1	ZINC000963251369	1323261531	/nfs/dbraw/zinc/26/15/31/1323261531.db2.gz	PFOJXLKZAXVDGG-SJORKVTESA-N	0	3	349.906	3.403	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)[C@@H]1C[C@H]1c1sccc1C	ZINC001024438478	1323400067	/nfs/dbraw/zinc/40/00/67/1323400067.db2.gz	PDFFLELNZLCRLA-GVDBMIGSSA-N	0	3	330.497	3.154	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccc(-n2cccn2)cc1	ZINC001024476408	1323430141	/nfs/dbraw/zinc/43/01/41/1323430141.db2.gz	CHERXVNMVUCYPI-LJQANCHMSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=C(C)CCN1CCCC[C@H]1CNC(=O)c1nc2cccnc2s1	ZINC001024482631	1323437144	/nfs/dbraw/zinc/43/71/44/1323437144.db2.gz	HUVLEIZYMHMMCE-AWEZNQCLSA-N	0	3	344.484	3.242	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC001024507826	1323455347	/nfs/dbraw/zinc/45/53/47/1323455347.db2.gz	ZAGUCBDHDJXCAQ-ICSRJNTNSA-N	0	3	341.499	3.060	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)C1CCc2ccccc2CC1	ZINC001024516328	1323467853	/nfs/dbraw/zinc/46/78/53/1323467853.db2.gz	HXBOKXJSARUWLW-NRFANRHFSA-N	0	3	338.495	3.176	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCCCN2Cc2ccccc2)cc1	ZINC001024591164	1323525276	/nfs/dbraw/zinc/52/52/76/1323525276.db2.gz	AMENRFLPFPOHDF-NRFANRHFSA-N	0	3	332.447	3.452	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccccc1OC1CCC1	ZINC001024640416	1323565377	/nfs/dbraw/zinc/56/53/77/1323565377.db2.gz	VLKZBVLXZVTDRP-KRWDZBQOSA-N	0	3	340.467	3.226	20	30		EGEDHN
C=CCCN1CCCC[C@@H]1CNC(=O)c1c(C)noc1C(F)(F)F	ZINC001024683964	1323598741	/nfs/dbraw/zinc/59/87/41/1323598741.db2.gz	RSPNZRWTEZANKZ-GFCCVEGCSA-N	0	3	345.365	3.162	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1c[nH]c(=O)c2ccccc12	ZINC001024689335	1323604313	/nfs/dbraw/zinc/60/43/13/1323604313.db2.gz	DATUFSJNWCWTLV-OAHLLOKOSA-N	0	3	339.439	3.101	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cccc2c1OCCCO2	ZINC001024729255	1323630922	/nfs/dbraw/zinc/63/09/22/1323630922.db2.gz	MHSDDFAFKJSZNE-INIZCTEOSA-N	0	3	344.455	3.008	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1[nH]c2ccc(C)cc2c1C	ZINC001024741307	1323641328	/nfs/dbraw/zinc/64/13/28/1323641328.db2.gz	ZQHZXKGIFMOZFH-QGZVFWFLSA-N	0	3	337.467	3.392	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cccc2[nH]c(C)nc21	ZINC001024743761	1323643029	/nfs/dbraw/zinc/64/30/29/1323643029.db2.gz	RXNVLWFYZGBMIS-OAHLLOKOSA-N	0	3	326.444	3.032	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCCCN2Cc2ccccc2C)nc1	ZINC001024764106	1323664532	/nfs/dbraw/zinc/66/45/32/1323664532.db2.gz	MUWVFNQIMQVGTD-FQEVSTJZSA-N	0	3	347.462	3.156	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccc2ncsc2c1	ZINC001024786768	1323689948	/nfs/dbraw/zinc/68/99/48/1323689948.db2.gz	QJJRNNKEOQTOIU-OAHLLOKOSA-N	0	3	329.469	3.457	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1csc2c1CCCC2	ZINC001024790381	1323695729	/nfs/dbraw/zinc/69/57/29/1323695729.db2.gz	HKLVSMWNQJRWRT-OAHLLOKOSA-N	0	3	330.497	3.235	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccc2[nH]c(C)c(C)c2c1	ZINC001024795288	1323701227	/nfs/dbraw/zinc/70/12/27/1323701227.db2.gz	DSZGYMVRQAIOJX-GOSISDBHSA-N	0	3	337.467	3.392	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccc(N(C)CC)cc1	ZINC001024824959	1323728624	/nfs/dbraw/zinc/72/86/24/1323728624.db2.gz	NPEGEJVEKWGPRE-LJQANCHMSA-N	0	3	329.488	3.303	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)/C=C\C2CC2)cc1F	ZINC001024910505	1323776695	/nfs/dbraw/zinc/77/66/95/1323776695.db2.gz	RGRQUJINFFDUDQ-YPLUBFQTSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCCC[C@@H]1CNCc1cccnc1	ZINC001024974751	1323808551	/nfs/dbraw/zinc/80/85/51/1323808551.db2.gz	NIWVQINUQOVTFZ-MRXNPFEDSA-N	0	3	335.879	3.331	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)c(F)c1	ZINC001025101486	1323895282	/nfs/dbraw/zinc/89/52/82/1323895282.db2.gz	CLXVBDRRMDQXTC-MAUKXSAKSA-N	0	3	345.462	3.460	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1csc(C)c1C	ZINC001025236443	1324027046	/nfs/dbraw/zinc/02/70/46/1324027046.db2.gz	USUBELMFHHAVRJ-ZWKOTPCHSA-N	0	3	330.497	3.457	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1scnc1CC	ZINC001025238486	1324029969	/nfs/dbraw/zinc/02/99/69/1324029969.db2.gz	RVSVDUQPRGNFON-JKSUJKDBSA-N	0	3	333.501	3.351	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)C1(C(F)(F)F)CCC1	ZINC001025246693	1324045352	/nfs/dbraw/zinc/04/53/52/1324045352.db2.gz	YWVBVQNTSZKFCR-CABCVRRESA-N	0	3	342.405	3.198	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ocnc1C(F)F	ZINC001025265960	1324078229	/nfs/dbraw/zinc/07/82/29/1324078229.db2.gz	HKKHLHFDXGWVRN-CHWSQXEVSA-N	0	3	339.386	3.257	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cnc2ccccc2c1	ZINC001025270577	1324084468	/nfs/dbraw/zinc/08/44/68/1324084468.db2.gz	DUNUUARRDDBEKE-NHCUHLMSSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cccc2cc[nH]c21	ZINC001025271171	1324086414	/nfs/dbraw/zinc/08/64/14/1324086414.db2.gz	HFUZJSICZOXXJB-MOPGFXCFSA-N	0	3	335.451	3.260	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccncc1Cl	ZINC001025273921	1324090961	/nfs/dbraw/zinc/09/09/61/1324090961.db2.gz	SJFRXKUZQJFFJM-MSOLQXFVSA-N	0	3	345.874	3.217	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)C1(CC)CCOCC1	ZINC001025281351	1324103391	/nfs/dbraw/zinc/10/33/91/1324103391.db2.gz	TXJDKPPOYOHBSX-RTBURBONSA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc2ccncc2c1	ZINC001025286901	1324108784	/nfs/dbraw/zinc/10/87/84/1324108784.db2.gz	MBQPXIYSSCESLV-LEWJYISDSA-N	0	3	347.462	3.327	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)C1(C)CC(F)(F)C1	ZINC001025287827	1324110287	/nfs/dbraw/zinc/11/02/87/1324110287.db2.gz	GYNCNNPXBXVEBS-HZPDHXFCSA-N	0	3	338.442	3.291	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)C(C)(C)C(F)(F)F	ZINC001025291905	1324115866	/nfs/dbraw/zinc/11/58/66/1324115866.db2.gz	CTDBGDWEQPTQJV-CABCVRRESA-N	0	3	344.421	3.444	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cccc(OC)c1	ZINC001025292957	1324119272	/nfs/dbraw/zinc/11/92/72/1324119272.db2.gz	NOLMJADFDNQMJI-WOJBJXKFSA-N	0	3	340.467	3.178	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc2c(c1)CCC2	ZINC001025294089	1324123257	/nfs/dbraw/zinc/12/32/57/1324123257.db2.gz	HUNAEIHDTGNFDM-SFTDATJTSA-N	0	3	336.479	3.268	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc(F)cc1F	ZINC001025298749	1324133341	/nfs/dbraw/zinc/13/33/41/1324133341.db2.gz	ZUJMMBAAJUATPK-OALUTQOASA-N	0	3	346.421	3.447	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)CCc1ccc(C)s1	ZINC001025306910	1324140308	/nfs/dbraw/zinc/14/03/08/1324140308.db2.gz	KKMUHTQUKRUVOD-RBUKOAKNSA-N	0	3	344.524	3.468	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(C(C)(C)C)cn2)C1	ZINC001025420305	1324254001	/nfs/dbraw/zinc/25/40/01/1324254001.db2.gz	AHGCFAUWZWKFBO-IRXDYDNUSA-N	0	3	341.499	3.233	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cccc3c2CCCC3)C1	ZINC001025425954	1324261516	/nfs/dbraw/zinc/26/15/16/1324261516.db2.gz	TWSKWACAHYRMHG-PKOBYXMFSA-N	0	3	338.495	3.419	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(C)c3ccccc3n2)C1	ZINC001025458053	1324300195	/nfs/dbraw/zinc/30/01/95/1324300195.db2.gz	GUALGVMMAXDITH-MSOLQXFVSA-N	0	3	349.478	3.397	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc3cc(C)ccc3n2)C1	ZINC001025477848	1324321621	/nfs/dbraw/zinc/32/16/21/1324321621.db2.gz	JPSJHSQESZWFRO-AEFFLSMTSA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(-c3ccco3)o2)C1	ZINC001025481141	1324329154	/nfs/dbraw/zinc/32/91/54/1324329154.db2.gz	FHKXARXPDOSQMI-HZPDHXFCSA-N	0	3	340.423	3.393	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(C)c(Cl)cc2C)C1	ZINC001025500593	1324348938	/nfs/dbraw/zinc/34/89/38/1324348938.db2.gz	UVDXDLCMBUWIFJ-JKSUJKDBSA-N	0	3	332.875	3.420	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc3c(ccc(C)c3C)[nH]2)C1	ZINC001025506114	1324354360	/nfs/dbraw/zinc/35/43/60/1324354360.db2.gz	OQPGOAFCXWQYMX-DLBZAZTESA-N	0	3	337.467	3.248	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2nccc3ccccc32)C1	ZINC001025518806	1324363352	/nfs/dbraw/zinc/36/33/52/1324363352.db2.gz	IHJSVEOGNBMZDT-FUHWJXTLSA-N	0	3	335.451	3.088	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](C)[C@@H]2CCCN(Cc3ocnc3C)C2)CC1	ZINC001025523026	1324368690	/nfs/dbraw/zinc/36/86/90/1324368690.db2.gz	LFJIYEFRRZBSGA-CRAIPNDOSA-N	0	3	345.487	3.446	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(C(C)C)cn2)C1	ZINC001025531292	1324377859	/nfs/dbraw/zinc/37/78/59/1324377859.db2.gz	OZTPXBKJOPBWRT-SJLPKXTDSA-N	0	3	327.472	3.059	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)C23CCC(CC2)C3(C)C)C1	ZINC001025556654	1324404958	/nfs/dbraw/zinc/40/49/58/1324404958.db2.gz	XETSOYNQWZKSRC-DQOAATFDSA-N	0	3	330.516	3.443	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc3ccncc3c2)C1	ZINC001025586741	1324428364	/nfs/dbraw/zinc/42/83/64/1324428364.db2.gz	DMHXZUYXRVQMFF-APWZRJJASA-N	0	3	335.451	3.088	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2sccc2C(F)F)C1	ZINC001025605997	1324455099	/nfs/dbraw/zinc/45/50/99/1324455099.db2.gz	KMKWXSYSENVCHU-RYUDHWBXSA-N	0	3	326.412	3.149	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2c(Cl)cccc2Cl)C1	ZINC001025610498	1324462419	/nfs/dbraw/zinc/46/24/19/1324462419.db2.gz	WWQXVCAHWYFJEK-OLZOCXBDSA-N	0	3	339.266	3.457	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2csc3c2CCCC3)C1	ZINC001025612369	1324464787	/nfs/dbraw/zinc/46/47/87/1324464787.db2.gz	STPOCIPCHXMOLJ-GJZGRUSLSA-N	0	3	330.497	3.090	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(Cl)ccc2OC)C1	ZINC001025614981	1324468089	/nfs/dbraw/zinc/46/80/89/1324468089.db2.gz	QTTOPLJVPMOYCO-HUUCEWRRSA-N	0	3	348.874	3.202	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cccc3cnccc32)C1	ZINC001025617086	1324469566	/nfs/dbraw/zinc/46/95/66/1324469566.db2.gz	DMIUZZGWCONSQF-AEFFLSMTSA-N	0	3	335.451	3.088	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc3cccc(F)c3o2)C1	ZINC001025624261	1324474632	/nfs/dbraw/zinc/47/46/32/1324474632.db2.gz	CFPIXWJYMQVBEP-UKRRQHHQSA-N	0	3	328.387	3.035	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(C3CCCC3)no2)C1	ZINC001025624208	1324474938	/nfs/dbraw/zinc/47/49/38/1324474938.db2.gz	BTHDKIOUYZTCIS-NVXWUHKLSA-N	0	3	343.471	3.186	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2[C@H]3CN(C/C=C/c4ccccc4)C[C@H]32)CC1	ZINC001026002632	1324577156	/nfs/dbraw/zinc/57/71/56/1324577156.db2.gz	WDJMBCPEAPWPTM-SGJZHTJYSA-N	0	3	336.479	3.493	20	30		EGEDHN
CC1(C(=O)N2C[C@@H]3CC[C@@H](NCc4ccccc4C#N)[C@H]3C2)CCC1	ZINC001026332697	1324732784	/nfs/dbraw/zinc/73/27/84/1324732784.db2.gz	OKSWBFZQQZBMQC-GBESFXJTSA-N	0	3	337.467	3.075	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H]3CC[C@@H](NCc4ccccc4C#N)[C@H]3C2)C1	ZINC001026356856	1324749520	/nfs/dbraw/zinc/74/95/20/1324749520.db2.gz	YTTUUCXXGCJRBV-SLFFLAALSA-N	0	3	349.478	3.241	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CC[C@H]2CN(C(=O)C3CC4(CC4)C3)C[C@@H]21	ZINC001026357839	1324750520	/nfs/dbraw/zinc/75/05/20/1324750520.db2.gz	KMDRBRDZLRAZRC-YSIASYRMSA-N	0	3	349.478	3.075	20	30		EGEDHN
Cc1cnccc1C(=O)NC1CCC(NCc2ccccc2C#N)CC1	ZINC001026489287	1324844153	/nfs/dbraw/zinc/84/41/53/1324844153.db2.gz	CDMYYKHJQQXGGH-UHFFFAOYSA-N	0	3	348.450	3.093	20	30		EGEDHN
N#Cc1ccccc1CNC1CCC(NC(=O)C2(C3CC3)CC2)CC1	ZINC001026511768	1324857483	/nfs/dbraw/zinc/85/74/83/1324857483.db2.gz	WDRHFSRBULMAGM-UHFFFAOYSA-N	0	3	337.467	3.265	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)c2ncccc2C)C1	ZINC000963282980	1325064064	/nfs/dbraw/zinc/06/40/64/1325064064.db2.gz	RNWFWKMXLAGQQO-SJORKVTESA-N	0	3	347.890	3.459	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@H](CNCc2cc(F)ccc2C#N)C1)C1CCC1	ZINC001026913376	1325075595	/nfs/dbraw/zinc/07/55/95/1325075595.db2.gz	IEXCTNXZLKDIHP-HUUCEWRRSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)Cc2ccoc2)C1	ZINC000963290355	1325076685	/nfs/dbraw/zinc/07/66/85/1325076685.db2.gz	OSXACXXDLIBMQJ-IAGOWNOFSA-N	0	3	336.863	3.278	20	30		EGEDHN
C#Cc1cccnc1NC1CCN(Cc2ccc(NC(C)=O)cc2)CC1	ZINC000853665137	1325145271	/nfs/dbraw/zinc/14/52/71/1325145271.db2.gz	FEOQDKFOLNIPOE-UHFFFAOYSA-N	0	3	348.450	3.098	20	30		EGEDHN
CC1(C)CC[C@@H]1C(=O)N1CC[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001027009125	1325149162	/nfs/dbraw/zinc/14/91/62/1325149162.db2.gz	WRWSDPZKVUDZDT-RDTXWAMCSA-N	0	3	343.446	3.072	20	30		EGEDHN
CC(C)(C(=O)N1CC[C@@H](CNCc2cc(F)ccc2C#N)C1)C1CC1	ZINC001027010757	1325151195	/nfs/dbraw/zinc/15/11/95/1325151195.db2.gz	BLCKNHZLMUJGPX-AWEZNQCLSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](CNCc2ccccc2C#N)C1	ZINC001027038061	1325171990	/nfs/dbraw/zinc/17/19/90/1325171990.db2.gz	HDYQXWFAONIPIU-OXJNMPFZSA-N	0	3	325.456	3.099	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@H](CNCc2oc(CCC)nc2C)C1	ZINC001027039058	1325172930	/nfs/dbraw/zinc/17/29/30/1325172930.db2.gz	UZWUVJHLSLFZMC-JXFKEZNVSA-N	0	3	347.503	3.476	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)c2occc2Cl)C1	ZINC001027044856	1325180607	/nfs/dbraw/zinc/18/06/07/1325180607.db2.gz	HCMKHNNDBLKJMA-ZDUSSCGKSA-N	0	3	343.814	3.057	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)c2nccs2)C1	ZINC000963374675	1325181002	/nfs/dbraw/zinc/18/10/02/1325181002.db2.gz	RRJQUWHDQJVDOU-KGLIPLIRSA-N	0	3	339.892	3.212	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N1CC[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001027048812	1325185286	/nfs/dbraw/zinc/18/52/86/1325185286.db2.gz	UFCROFSNWYOHPY-QMTMVMCOSA-N	0	3	343.446	3.072	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)c(F)c2)C1	ZINC001027279570	1325402831	/nfs/dbraw/zinc/40/28/31/1325402831.db2.gz	AGIGECDTYKAKJT-QGZVFWFLSA-N	0	3	329.419	3.086	20	30		EGEDHN
C[C@H](CC(C)(C)C#N)N[C@H]1CCCN(Cc2ccc(F)cc2F)C1=O	ZINC000926255908	1325492641	/nfs/dbraw/zinc/49/26/41/1325492641.db2.gz	NKHIZLGROIVVJX-DYVFJYSZSA-N	0	3	349.425	3.374	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)C2CC(F)(F)C2)C1	ZINC001027358616	1325537988	/nfs/dbraw/zinc/53/79/88/1325537988.db2.gz	JMKUDPCQANHNTP-QGZVFWFLSA-N	0	3	347.409	3.026	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)C2CC(F)(F)C2)C1	ZINC001027359518	1325540714	/nfs/dbraw/zinc/54/07/14/1325540714.db2.gz	ULBZNDDXSPEQRH-QGZVFWFLSA-N	0	3	347.409	3.026	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001027363128	1325549288	/nfs/dbraw/zinc/54/92/88/1325549288.db2.gz	BLLDFLQHKRMUNJ-KRWDZBQOSA-N	0	3	329.419	3.244	20	30		EGEDHN
N#CC(C(=O)CCCc1ccc2c(c1)OCCCO2)c1ccccn1	ZINC000860467190	1329320614	/nfs/dbraw/zinc/32/06/14/1329320614.db2.gz	GHACAASDJNDQDT-MRXNPFEDSA-N	0	3	336.391	3.442	20	30		EGEDHN
CC[C@@H](C)c1ccc(NC(=O)C(C#N)C(=O)C2CC(OC)C2)cc1	ZINC000860472220	1329321291	/nfs/dbraw/zinc/32/12/91/1329321291.db2.gz	FRKZEXBCKBVIRE-BZVDIIDJSA-N	0	3	328.412	3.272	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)C[C@@H](C)c1ccco1	ZINC000860473109	1329321665	/nfs/dbraw/zinc/32/16/65/1329321665.db2.gz	IJSXKUHAKPGFMS-CHWSQXEVSA-N	0	3	326.352	3.129	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)[C@H]1[C@@H](C)[C@H](C)O[C@H]1C)c1ccccc1	ZINC000860695941	1329345375	/nfs/dbraw/zinc/34/53/75/1329345375.db2.gz	WVPQBBCRWNCCAW-YTWWXZCUSA-N	0	3	342.439	3.022	20	30		EGEDHN
CC(C(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)cc2)C1)=C1CCC1	ZINC001027404270	1327629329	/nfs/dbraw/zinc/62/93/29/1327629329.db2.gz	YEWZKQHGQLYKTK-HXUWFJFHSA-N	0	3	337.467	3.481	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@@H](N(C)Cc3ccc(C#N)c(F)c3)C2)CC1	ZINC001027561745	1327880565	/nfs/dbraw/zinc/88/05/65/1327880565.db2.gz	AJQSPOIPPPMBOS-QGZVFWFLSA-N	0	3	343.446	3.310	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001027563753	1327887527	/nfs/dbraw/zinc/88/75/27/1327887527.db2.gz	CXFJBFLZMROQER-HSALFYBXSA-N	0	3	339.483	3.417	20	30		EGEDHN
COc1ccc([C@H](C)NCCNc2ccc(C#N)cn2)c(Cl)c1	ZINC000927168177	1327905166	/nfs/dbraw/zinc/90/51/66/1327905166.db2.gz	QBDQJGPGTRLPEX-LBPRGKRZSA-N	0	3	330.819	3.378	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)c(F)c2)C1	ZINC001027604880	1327961327	/nfs/dbraw/zinc/96/13/27/1327961327.db2.gz	UDAOKCYKFIKIPJ-YJBOKZPZSA-N	0	3	345.462	3.412	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2C2CC2)C1	ZINC001027609616	1327972222	/nfs/dbraw/zinc/97/22/22/1327972222.db2.gz	YMSUXFHKUCPDQL-HSALFYBXSA-N	0	3	337.467	3.027	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2cccc3ccccc32)C1	ZINC001027618044	1327981672	/nfs/dbraw/zinc/98/16/72/1327981672.db2.gz	CXIZESHXIKVVGF-YUXAGFNASA-N	0	3	346.474	3.499	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)c2cc3cc(C)ccc3s2)C1	ZINC001027637271	1328005829	/nfs/dbraw/zinc/00/58/29/1328005829.db2.gz	PDOHTZLWKXGBBX-INIZCTEOSA-N	0	3	326.465	3.379	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1csc(Cl)n1)C2	ZINC000965733423	1328026041	/nfs/dbraw/zinc/02/60/41/1328026041.db2.gz	VFNFVGIUYJCKNW-UHFFFAOYSA-N	0	3	346.283	3.180	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)c2ccc(Cl)cc2Cl)C1	ZINC001027661351	1328051554	/nfs/dbraw/zinc/05/15/54/1328051554.db2.gz	DMOSSYOMWUNYRX-ZDUSSCGKSA-N	0	3	325.239	3.163	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)c2cc3c(s2)CC[C@H](C)C3)C1	ZINC001027679010	1328079126	/nfs/dbraw/zinc/07/91/26/1328079126.db2.gz	SESQDHNMYYWGKX-GOEBONIOSA-N	0	3	330.497	3.043	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1c(F)ccc2ccncc21	ZINC001027897473	1328362283	/nfs/dbraw/zinc/36/22/83/1328362283.db2.gz	OOKXGCTZJCTBDO-OAHLLOKOSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)C2C3CC4CC(C3)CC2C4)C1	ZINC000966722883	1328392529	/nfs/dbraw/zinc/39/25/29/1328392529.db2.gz	MIVHXUMQPROGAK-XVSCRIFDSA-N	0	3	330.516	3.461	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1ncoc1-c1ccccc1	ZINC001027918510	1328397944	/nfs/dbraw/zinc/39/79/44/1328397944.db2.gz	OCVPDMRKKFBFEA-MRXNPFEDSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=C(C)CCN1CC[C@H](C)[C@@H](NC(=O)c2sc3nccn3c2C)C1	ZINC000966817157	1328426159	/nfs/dbraw/zinc/42/61/59/1328426159.db2.gz	WKCQZPAPQAYXKZ-ZFWWWQNUSA-N	0	3	346.500	3.111	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cccc3ccc(C)nc32)C1	ZINC000966899315	1328461681	/nfs/dbraw/zinc/46/16/81/1328461681.db2.gz	GGXOTWSAMWTXOL-BEFAXECRSA-N	0	3	335.451	3.007	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1ccc2c(c1)C(C)(C)CO2	ZINC001028023872	1328486611	/nfs/dbraw/zinc/48/66/11/1328486611.db2.gz	YJJGWBCFVNLDES-INIZCTEOSA-N	0	3	328.456	3.127	20	30		EGEDHN
N#Cc1ccc(C2CCN([C@@H]3C[C@@H]4CCCC[C@H]4NC3=O)CC2)cc1	ZINC000933606288	1329905569	/nfs/dbraw/zinc/90/55/69/1329905569.db2.gz	HONFDZJBXDENIL-XUVXKRRUSA-N	0	3	337.467	3.185	20	30		EGEDHN
C#Cc1ccc(NC(=O)N(CCN(C)C)Cc2ccsc2)cc1	ZINC000934924473	1330017775	/nfs/dbraw/zinc/01/77/75/1330017775.db2.gz	ADLKBKNYCATJFZ-UHFFFAOYSA-N	0	3	327.453	3.325	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H](C)[C@H](NCc3ncccc3C)C2)CC1	ZINC000939050783	1330365494	/nfs/dbraw/zinc/36/54/94/1330365494.db2.gz	UOZGQVDPQQSWEU-VQIMIIECSA-N	0	3	327.472	3.073	20	30		EGEDHN
CCC(C)(CC)C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC000939797881	1330986407	/nfs/dbraw/zinc/98/64/07/1330986407.db2.gz	WWDFHTRZQFUVAM-CZUORRHYSA-N	0	3	333.501	3.383	20	30		EGEDHN
CC1(C)CN(Cc2ccc(C#N)cc2)CC[C@H]1NC(=O)c1ccoc1	ZINC000940573745	1331115150	/nfs/dbraw/zinc/11/51/50/1331115150.db2.gz	FRLNSHPDBGWXLR-GOSISDBHSA-N	0	3	337.423	3.182	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2coc3ccc(C)cc23)[C@@H](C)C1	ZINC000942093254	1331826499	/nfs/dbraw/zinc/82/64/99/1331826499.db2.gz	ZCWPQWHTWHQVFF-QFBILLFUSA-N	0	3	338.451	3.134	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(F)c3ccccc3c2)[C@@H](C)C1	ZINC000942109486	1331834052	/nfs/dbraw/zinc/83/40/52/1331834052.db2.gz	ONAWTEIMTDAYOW-MGPUTAFESA-N	0	3	338.426	3.442	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2oc3c(cccc3F)c2C)[C@@H](C)C1	ZINC000942124538	1331839008	/nfs/dbraw/zinc/83/90/08/1331839008.db2.gz	ZAHHVRMORQKDTK-SUMWQHHRSA-N	0	3	342.414	3.344	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(CC(C)C)s2)[C@H](C)C1	ZINC000942138280	1331844410	/nfs/dbraw/zinc/84/44/10/1331844410.db2.gz	WMBZIBBXFUSBHY-NVXWUHKLSA-N	0	3	332.513	3.410	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C3CC3)[nH]c2C2CC2)[C@@H](C)C1	ZINC000942172297	1331859412	/nfs/dbraw/zinc/85/94/12/1331859412.db2.gz	BYMMODSANSUFOJ-KSSFIOAISA-N	0	3	339.483	3.233	20	30		EGEDHN
C[C@H]1CN(Cc2cccc(C#N)c2)CC[C@H]1NC(=O)Cc1ccccc1	ZINC000942188588	1331869462	/nfs/dbraw/zinc/86/94/62/1331869462.db2.gz	LMYNAWUJBGCSNO-LAUBAEHRSA-N	0	3	347.462	3.128	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2[nH]c3ccccc3c2Cl)[C@@H](C)C1	ZINC000942260252	1331890892	/nfs/dbraw/zinc/89/08/92/1331890892.db2.gz	XYHZMWLVNKTGDL-DZGCQCFKSA-N	0	3	343.858	3.285	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2csc3ccccc23)[C@H](C)C1	ZINC000942541203	1331965515	/nfs/dbraw/zinc/96/55/15/1331965515.db2.gz	WXCVYFCBDIXMSU-RHSMWYFYSA-N	0	3	326.465	3.365	20	30		EGEDHN
Cc1cocc1C(=O)N[C@@H]1CCN(Cc2cccc(C#N)c2)C[C@H]1C	ZINC000942558447	1331972928	/nfs/dbraw/zinc/97/29/28/1331972928.db2.gz	WPBOCMSTMZILAI-AUUYWEPGSA-N	0	3	337.423	3.100	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C(C)(C)c2ccc(Cl)cc2)[C@H](C)C1	ZINC000942595378	1331994887	/nfs/dbraw/zinc/99/48/87/1331994887.db2.gz	YNGALNGEEVTWFP-PBHICJAKSA-N	0	3	332.875	3.077	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3c(C)nsc3C)C[C@@H]2C)C1	ZINC000942602889	1332000113	/nfs/dbraw/zinc/00/01/13/1332000113.db2.gz	OSXPFINCVOGINL-GUYCJALGSA-N	0	3	347.528	3.443	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccccc2OC2CCC2)[C@@H](C)C1	ZINC000942700124	1332022529	/nfs/dbraw/zinc/02/25/29/1332022529.db2.gz	NBEQRHKBXFANNW-LPHOPBHVSA-N	0	3	340.467	3.081	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(-c3ccco3)s2)[C@@H](C)C1	ZINC000943814695	1332272236	/nfs/dbraw/zinc/27/22/36/1332272236.db2.gz	JHXHHZTVZHYIGH-GJZGRUSLSA-N	0	3	342.464	3.472	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C(C)(C)c2ccc(CC)cc2)[C@H](C)C1	ZINC000944080852	1332323453	/nfs/dbraw/zinc/32/34/53/1332323453.db2.gz	OWHFVOAYGGAZDQ-XLIONFOSSA-N	0	3	340.511	3.377	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2sccc2C(F)F)[C@@H](C)C1	ZINC000944530952	1332414395	/nfs/dbraw/zinc/41/43/95/1332414395.db2.gz	HPZCQQYHBZBWGP-WCQYABFASA-N	0	3	326.412	3.149	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3c(s2)CCCCC3)[C@H](C)C1	ZINC000944618206	1332417950	/nfs/dbraw/zinc/41/79/50/1332417950.db2.gz	BYCPLYLYOHZVLJ-WBVHZDCISA-N	0	3	344.524	3.481	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3ccccc3)CCCC2)[C@H](C)C1	ZINC000944697072	1332422901	/nfs/dbraw/zinc/42/29/01/1332422901.db2.gz	BDHVPEDXMKOAFN-UYAOXDASSA-N	0	3	338.495	3.348	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccccc2-c2ccccc2)[C@H](C)C1	ZINC000944698354	1332422941	/nfs/dbraw/zinc/42/29/41/1332422941.db2.gz	FRKMMEBKNOMERQ-DYESRHJHSA-N	0	3	332.447	3.427	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc3ccccc3c2)[C@H](C)C1	ZINC000944814240	1332428360	/nfs/dbraw/zinc/42/83/60/1332428360.db2.gz	XQTPGJWMVNUYBZ-UTKZUKDTSA-N	0	3	334.463	3.232	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2sc(C(C)C)nc2C)[C@H](C)C1	ZINC000944905671	1332450233	/nfs/dbraw/zinc/45/02/33/1332450233.db2.gz	DNMWTBQZQPZMDF-HIFRSBDPSA-N	0	3	333.501	3.038	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(-c3ccccc3)co2)[C@H](C)C1	ZINC000946314184	1332786208	/nfs/dbraw/zinc/78/62/08/1332786208.db2.gz	SNSQORLCVKTSJQ-APWZRJJASA-N	0	3	336.435	3.410	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2ccsc2)CCN1Cc1ccc(C#N)cc1	ZINC000947026359	1332979593	/nfs/dbraw/zinc/97/95/93/1332979593.db2.gz	LILCTNJQCVCNRO-KDOFPFPSSA-N	0	3	339.464	3.403	20	30		EGEDHN
Cc1cccc(C(=O)N[C@H]2CCN(Cc3ccc(C#N)cc3)[C@@H](C)C2)n1	ZINC000947075288	1333002904	/nfs/dbraw/zinc/00/29/04/1333002904.db2.gz	ORSKFLLBVFYXQV-LPHOPBHVSA-N	0	3	348.450	3.045	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2oc3ccccc3c2OC)C[C@@H]1C	ZINC000947611830	1333192771	/nfs/dbraw/zinc/19/27/71/1333192771.db2.gz	QUPWGRXJYHLQPX-KBPBESRZSA-N	0	3	328.412	3.210	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2nsc3ccc(C)cc32)C[C@@H]1C	ZINC000947622022	1333196060	/nfs/dbraw/zinc/19/60/60/1333196060.db2.gz	ZTTOJQHMVDACJW-GJZGRUSLSA-N	0	3	341.480	3.211	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc(F)c(Cl)c2F)C[C@@H]1C	ZINC000947692744	1333226526	/nfs/dbraw/zinc/22/65/26/1333226526.db2.gz	AJKJGIQAIXEWKH-QWRGUYRKSA-N	0	3	328.790	3.387	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(F)c(Cl)c2F)C[C@@H]1C	ZINC000947693660	1333228158	/nfs/dbraw/zinc/22/81/58/1333228158.db2.gz	QAHPCCFPTMVRLQ-RYUDHWBXSA-N	0	3	340.801	3.224	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccccc2OC2CCC2)C[C@H]1C	ZINC000947712041	1333236749	/nfs/dbraw/zinc/23/67/49/1333236749.db2.gz	ZYFDXKSZHKWTNA-SJORKVTESA-N	0	3	340.467	3.224	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C(C)(C)c2cccc(F)c2)C[C@@H]1C	ZINC000947718816	1333239357	/nfs/dbraw/zinc/23/93/57/1333239357.db2.gz	CGRDWURVTQXTOL-YJBOKZPZSA-N	0	3	330.447	3.096	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cnc(-c3ccoc3)s2)C[C@@H]1C	ZINC000947779796	1333259153	/nfs/dbraw/zinc/25/91/53/1333259153.db2.gz	SYMPAABGTKGUIY-DZGCQCFKSA-N	0	3	343.452	3.009	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cnc(CC(C)(C)C)s2)C[C@H]1C	ZINC000947903009	1333299514	/nfs/dbraw/zinc/29/95/14/1333299514.db2.gz	BCXSCMHEXMCFLL-HUUCEWRRSA-N	0	3	347.528	3.338	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnn(C(C)C)c2C2CC2)C[C@@H]1C	ZINC000947913073	1333305259	/nfs/dbraw/zinc/30/52/59/1333305259.db2.gz	VCERIDWANDFEKW-GOEBONIOSA-N	0	3	330.476	3.110	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)n(CC3CC3)c2C)C[C@H]1C	ZINC000947938734	1333312658	/nfs/dbraw/zinc/31/26/58/1333312658.db2.gz	ATYZTSSINKMWPR-DNVCBOLYSA-N	0	3	341.499	3.121	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)CC23CC4CC(CC(C4)C2)C3)C[C@@H]1C	ZINC000947966500	1333323325	/nfs/dbraw/zinc/32/33/25/1333323325.db2.gz	BZAWGDHGECXZNN-GZKSLDRRSA-N	0	3	328.500	3.195	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(CC(C)C)cc2)C[C@H]1C	ZINC000948020300	1333343906	/nfs/dbraw/zinc/34/39/06/1333343906.db2.gz	BAZQNUUEOFMTNX-XLIONFOSSA-N	0	3	326.484	3.491	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)[C@@H]2CCCc3ccccc32)CC1	ZINC000948547252	1333568184	/nfs/dbraw/zinc/56/81/84/1333568184.db2.gz	VEEZIKRKFMCGKC-PZJWPPBQSA-N	0	3	338.495	3.443	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2c(C)c(F)ccc2Cl)CC1	ZINC000948560464	1333576797	/nfs/dbraw/zinc/57/67/97/1333576797.db2.gz	BMBVEHSSSOBUNJ-CQSZACIVSA-N	0	3	336.838	3.347	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2ccc(OC)c(C(C)C)c2)CC1	ZINC000948589575	1333586589	/nfs/dbraw/zinc/58/65/89/1333586589.db2.gz	CMGLMYGDAHXDAX-GOSISDBHSA-N	0	3	342.483	3.378	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2ccc(-c3ccco3)o2)CC1	ZINC000948604539	1333593034	/nfs/dbraw/zinc/59/30/34/1333593034.db2.gz	GCMODJCWGAPNKG-HNNXBMFYSA-N	0	3	326.396	3.099	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@@H]2CCCN(C[C@H](F)CC)CC2)cc1	ZINC000948665726	1333620811	/nfs/dbraw/zinc/62/08/11/1333620811.db2.gz	QJMGLQKAAKTQSM-RTBURBONSA-N	0	3	330.447	3.343	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@H]2CCCN(Cc3cccnc3)CC2)cc1	ZINC000948665793	1333621091	/nfs/dbraw/zinc/62/10/91/1333621091.db2.gz	RKVZTCSMHOMQAZ-NRFANRHFSA-N	0	3	347.462	3.190	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2ccc3c(c2)[C@H](C)CO3)CC1	ZINC000948701272	1333638704	/nfs/dbraw/zinc/63/87/04/1333638704.db2.gz	UEEYKDYYUPVCCA-AEFFLSMTSA-N	0	3	340.467	3.132	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cc3ccccc3n2C)CC1	ZINC000948722253	1333646748	/nfs/dbraw/zinc/64/67/48/1333646748.db2.gz	KEXRXNVEYUYDTB-SFHVURJKSA-N	0	3	337.467	3.128	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)Cc2cc(C)cc(C)c2)CC1	ZINC000948743524	1333655347	/nfs/dbraw/zinc/65/53/47/1333655347.db2.gz	WPQUEIHFIUWRGG-FQEVSTJZSA-N	0	3	326.484	3.182	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2oc(CC(C)C)nc2C)CC1	ZINC000948841417	1333705959	/nfs/dbraw/zinc/70/59/59/1333705959.db2.gz	WHJPTQGHBBWKAI-KRWDZBQOSA-N	0	3	345.487	3.131	20	30		EGEDHN
N#Cc1c[nH]c(C(=O)NC[C@@H]2c3ccccc3CCN2CC2CCC2)c1	ZINC000948901788	1333725472	/nfs/dbraw/zinc/72/54/72/1333725472.db2.gz	CXTUHQZAHXSKEG-HXUWFJFHSA-N	0	3	348.450	3.016	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@@H]1CNC(=O)[C@@H]1CCC1(F)F	ZINC000948933059	1333739469	/nfs/dbraw/zinc/73/94/69/1333739469.db2.gz	TYDZAYWWVSYRES-IRXDYDNUSA-N	0	3	334.410	3.323	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1CCC[C@@H]1CCC)CCO2	ZINC000949129553	1333781849	/nfs/dbraw/zinc/78/18/49/1333781849.db2.gz	NQKADBQIEWXHHN-ROUUACIJSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H](C)CC1CCCC1)CCO2	ZINC000949202032	1333794972	/nfs/dbraw/zinc/79/49/72/1333794972.db2.gz	BPERRFPXDFWUDA-KRWDZBQOSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)c3ccc(F)cc3)CC2)C1	ZINC000949276966	1333813222	/nfs/dbraw/zinc/81/32/22/1333813222.db2.gz	PVJDICQQSUFPFT-UHFFFAOYSA-N	0	3	346.446	3.099	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C34CCC(CC3)C4)CC2)C1	ZINC000949398050	1333837428	/nfs/dbraw/zinc/83/74/28/1333837428.db2.gz	FOSZKELSGXHZBW-UHFFFAOYSA-N	0	3	346.515	3.226	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@]3(C)C[C@H]4C[C@H]4C3)CC2)C1	ZINC000949427601	1333845005	/nfs/dbraw/zinc/84/50/05/1333845005.db2.gz	QROQAZKYZWJFRR-OPVJXMOQSA-N	0	3	346.515	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C[C@@H]3CC=CCC3)CC2)C1	ZINC000949436804	1333846760	/nfs/dbraw/zinc/84/67/60/1333846760.db2.gz	BGWSHPYAXONSPZ-LJQANCHMSA-N	0	3	346.515	3.392	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@@H]3CCCC[C@@H]3CC)CC2)C1	ZINC000949504793	1333862627	/nfs/dbraw/zinc/86/26/27/1333862627.db2.gz	UTQPYTSQOVCIRJ-RBUKOAKNSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@@H]3CC34CCCC4)CC2)C1	ZINC000949506029	1333862674	/nfs/dbraw/zinc/86/26/74/1333862674.db2.gz	BOBZGMUDGAEEJX-SFHVURJKSA-N	0	3	346.515	3.226	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2cc(-c3ccccc3)no2)C1	ZINC000967181754	1335675726	/nfs/dbraw/zinc/67/57/26/1335675726.db2.gz	HYCTUEILWSKTOZ-MAUKXSAKSA-N	0	3	339.439	3.358	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2noc3c2CC(C)(C)CC3)C1	ZINC000967424557	1335734425	/nfs/dbraw/zinc/73/44/25/1335734425.db2.gz	SDIVQQYDGLZQFE-HOCLYGCPSA-N	0	3	345.487	3.206	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2sccc2-n2cccc2)C1	ZINC000967619203	1335793746	/nfs/dbraw/zinc/79/37/46/1335793746.db2.gz	BTZIJDNMPSVBHA-CVEARBPZSA-N	0	3	341.480	3.002	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2cc(C)c(C)cc2Cl)C1	ZINC000967779470	1335815801	/nfs/dbraw/zinc/81/58/01/1335815801.db2.gz	NNEJFABIAMDWSY-FZKQIMNGSA-N	0	3	332.875	3.420	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2csc(-c3ccco3)n2)C1	ZINC000968078817	1335854283	/nfs/dbraw/zinc/85/42/83/1335854283.db2.gz	LVGSVAVPOVMJFS-KBPBESRZSA-N	0	3	345.468	3.419	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2cc(F)cc3cccnc32)C1	ZINC000968369715	1335906851	/nfs/dbraw/zinc/90/68/51/1335906851.db2.gz	PGYRRMNJHGSCPA-KBXCAEBGSA-N	0	3	341.430	3.390	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2cc(Br)co2)C1	ZINC000968386431	1335913883	/nfs/dbraw/zinc/91/38/83/1335913883.db2.gz	IWBWTHYBBXVCDA-AAEUAGOBSA-N	0	3	341.249	3.058	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)Cc2c[nH]c3ccccc23)C1	ZINC000968569511	1335963290	/nfs/dbraw/zinc/96/32/90/1335963290.db2.gz	JTHUNYCKSWPYPB-DNVCBOLYSA-N	0	3	325.456	3.113	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2csc3c2CCCC3)C1	ZINC000968620745	1335986213	/nfs/dbraw/zinc/98/62/13/1335986213.db2.gz	YVTIYASUWSZIIT-PBHICJAKSA-N	0	3	330.497	3.090	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2cccc(OCC(C)C)c2)C1	ZINC000968628329	1335989732	/nfs/dbraw/zinc/98/97/32/1335989732.db2.gz	WNMHPXJYVGJCGO-PXNSSMCTSA-N	0	3	342.483	3.185	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccc(CC(C)C)cc2)C1	ZINC000968628529	1335990117	/nfs/dbraw/zinc/99/01/17/1335990117.db2.gz	ZZKGSBJHQHNIAM-PXNSSMCTSA-N	0	3	326.484	3.349	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2cc(OC)c(OC)cc2C)C1	ZINC000968664816	1336002234	/nfs/dbraw/zinc/00/22/34/1336002234.db2.gz	JJQMSURGWZRMFA-PBHICJAKSA-N	0	3	346.471	3.029	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(OCC3CC3)cc2)C1	ZINC000968669326	1336003571	/nfs/dbraw/zinc/00/35/71/1336003571.db2.gz	LFHZYPYFHXXRPC-UZLBHIALSA-N	0	3	342.483	3.492	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)Cc2ccc(OC(C)C)cc2)C1	ZINC000968669564	1336004177	/nfs/dbraw/zinc/00/41/77/1336004177.db2.gz	OYAODTOVXYNZTG-PXNSSMCTSA-N	0	3	344.499	3.419	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)C2(c3ccccc3OC)CC2)C1	ZINC000968706586	1336018777	/nfs/dbraw/zinc/01/87/77/1336018777.db2.gz	RNEQXDWUUZLNHA-FUHWJXTLSA-N	0	3	342.483	3.130	20	30		EGEDHN
N#Cc1cccc(CN2CCCCC[C@@H]2CNC(=O)[C@H]2CC2(F)F)c1	ZINC000968853713	1336068769	/nfs/dbraw/zinc/06/87/69/1336068769.db2.gz	OSQGQENCJZLMAU-IAGOWNOFSA-N	0	3	347.409	3.074	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccn(C2CCCC2)n1	ZINC000968874632	1336075127	/nfs/dbraw/zinc/07/51/27/1336075127.db2.gz	OQQMWIVVDMJSPM-QGZVFWFLSA-N	0	3	330.476	3.159	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)[C@@H]1CCCN1c1ccccc1	ZINC000968882263	1336079011	/nfs/dbraw/zinc/07/90/11/1336079011.db2.gz	KPAAFCXMBHBQPQ-UXHICEINSA-N	0	3	341.499	3.202	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccc2cc(C)cn2c1	ZINC000968888618	1336080349	/nfs/dbraw/zinc/08/03/49/1336080349.db2.gz	WYXWMROCZPBOPZ-IBGZPJMESA-N	0	3	325.456	3.408	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)[C@H]1CCOc2c(F)cccc21	ZINC000968942219	1336098729	/nfs/dbraw/zinc/09/87/29/1336098729.db2.gz	VEPOMCNXROEVAT-RDJZCZTQSA-N	0	3	346.446	3.239	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)[C@H]1CCc2ccc(F)cc2O1	ZINC000968952653	1336101372	/nfs/dbraw/zinc/10/13/72/1336101372.db2.gz	VUKHNMOHKFVADQ-QZTJIDSGSA-N	0	3	346.446	3.066	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1cnc2onc(C)c2c1	ZINC000968974389	1336106715	/nfs/dbraw/zinc/10/67/15/1336106715.db2.gz	RHQJOBJDFICVTN-MRXNPFEDSA-N	0	3	342.443	3.082	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cncc2sccc21	ZINC000969001409	1336114985	/nfs/dbraw/zinc/11/49/85/1336114985.db2.gz	ADEFNCPCLUYQDP-AWEZNQCLSA-N	0	3	329.469	3.457	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1ccc(C)c(OCC)c1	ZINC000969057000	1336131725	/nfs/dbraw/zinc/13/17/25/1336131725.db2.gz	PPLGKQGCXHIRIG-IBGZPJMESA-N	0	3	342.483	3.391	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(C(=O)[C@H]3CCC=CCCC3)C2)s1	ZINC000969066375	1336136959	/nfs/dbraw/zinc/13/69/59/1336136959.db2.gz	UNIMSPRRVAYZPM-JKSUJKDBSA-N	0	3	343.496	3.447	20	30		EGEDHN
C#CCCN1CCCCC[C@@H]1CNC(=O)c1cc2cccnc2s1	ZINC000969103558	1336144715	/nfs/dbraw/zinc/14/47/15/1336144715.db2.gz	YDPPKDBFBKLYDD-MRXNPFEDSA-N	0	3	341.480	3.294	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cncc(C(F)(F)F)c1	ZINC000969103378	1336144861	/nfs/dbraw/zinc/14/48/61/1336144861.db2.gz	QJOXEEKDGPGJAI-OAHLLOKOSA-N	0	3	341.377	3.261	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1cc2c(s1)CCOC2	ZINC000969118537	1336150304	/nfs/dbraw/zinc/15/03/04/1336150304.db2.gz	RGSJPPLCFGUIGJ-MRXNPFEDSA-N	0	3	348.512	3.371	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1c(Cl)nc2ccccn21	ZINC000969139289	1336158280	/nfs/dbraw/zinc/15/82/80/1336158280.db2.gz	LABGZXMORLLCSI-CQSZACIVSA-N	0	3	346.862	3.148	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1n[nH]c2c1CCCCC2	ZINC000969141784	1336159374	/nfs/dbraw/zinc/15/93/74/1336159374.db2.gz	LTFOIPFXYGCLEE-MRXNPFEDSA-N	0	3	344.503	3.229	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cc(C)n(C(C)(C)C)n1	ZINC000969144485	1336161390	/nfs/dbraw/zinc/16/13/90/1336161390.db2.gz	MXJSXGXYJKSYLC-MRXNPFEDSA-N	0	3	332.492	3.107	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)[C@H]1Cc2cc(C)c(C)cc2O1	ZINC000969153144	1336164694	/nfs/dbraw/zinc/16/46/94/1336164694.db2.gz	AZVOZUPXRWGNTO-AZUAARDMSA-N	0	3	342.483	3.154	20	30		EGEDHN
CC(C)(C)C(C)(C)C(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C1	ZINC000969579068	1336226199	/nfs/dbraw/zinc/22/61/99/1336226199.db2.gz	VDPGEZQZKIVUCM-CYBMUJFWSA-N	0	3	333.501	3.383	20	30		EGEDHN
C#CCCN1CC([C@H](C)NC(=O)c2cc3cccc(C)c3s2)C1	ZINC000969992722	1336270076	/nfs/dbraw/zinc/27/00/76/1336270076.db2.gz	ORTRGKPAMAOZJZ-AWEZNQCLSA-N	0	3	326.465	3.283	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cn(C)c3ccc(F)cc23)CC1	ZINC001005511834	1336364778	/nfs/dbraw/zinc/36/47/78/1336364778.db2.gz	IUQBLRWHEVXRDQ-UHFFFAOYSA-N	0	3	343.446	3.430	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2ccc(-c3cnco3)cc2)CC1	ZINC001005588813	1336376478	/nfs/dbraw/zinc/37/64/78/1336376478.db2.gz	NPJJKSOPHLZLCP-UHFFFAOYSA-N	0	3	325.412	3.064	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cc(C)n([C@@H](C)C3CC3)n2)CC1	ZINC001005628098	1336384802	/nfs/dbraw/zinc/38/48/02/1336384802.db2.gz	BDKJTMVLXOCFOV-INIZCTEOSA-N	0	3	344.503	3.275	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)Cc2c[nH]c3c2cccc3C)CC1	ZINC001006085974	1336450362	/nfs/dbraw/zinc/45/03/62/1336450362.db2.gz	HSPMQEUWOGIFAH-UHFFFAOYSA-N	0	3	325.456	3.128	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cccc(N3CCCC3)c2)CC1	ZINC001006179073	1336463174	/nfs/dbraw/zinc/46/31/74/1336463174.db2.gz	ABUYSPZMFQQFGT-UHFFFAOYSA-N	0	3	341.499	3.399	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)[C@]2(c3ccccc3)CC2(C)C)CC1	ZINC001006185485	1336464131	/nfs/dbraw/zinc/46/41/31/1336464131.db2.gz	XLBPXVYVRVIONW-OAQYLSRUSA-N	0	3	326.484	3.463	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C2CCN(Cc3ccc(C)cc3)CC2)cn1	ZINC001006310048	1336487083	/nfs/dbraw/zinc/48/70/83/1336487083.db2.gz	LMVALLBZUUPALE-UHFFFAOYSA-N	0	3	347.462	3.108	20	30		EGEDHN
N#Cc1c[nH]c(C(=O)N[C@@H]2CCCN(Cc3ccccc3C3CC3)C2)c1	ZINC001007028366	1336627741	/nfs/dbraw/zinc/62/77/41/1336627741.db2.gz	HPZUTVQUSYJMRK-GOSISDBHSA-N	0	3	348.450	3.158	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@H]2CCCN(CC[C@@H](C)F)C2)cc1	ZINC001007668618	1336686488	/nfs/dbraw/zinc/68/64/88/1336686488.db2.gz	JKBRQBAFVXLFOG-WBVHZDCISA-N	0	3	334.435	3.194	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H](NC(=O)c2cc3nc(C)ccc3o2)C1	ZINC001009294156	1336999744	/nfs/dbraw/zinc/99/97/44/1336999744.db2.gz	BMRZVAHCGLWWSY-OAHLLOKOSA-N	0	3	327.428	3.297	20	30		EGEDHN
C=C(C)CCN1CCC[C@H](NC(=O)c2cc(C3CCCC3)no2)C1	ZINC001009576562	1337041091	/nfs/dbraw/zinc/04/10/91/1337041091.db2.gz	GHLDKUDNWLPOAL-INIZCTEOSA-N	0	3	331.460	3.493	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2cccc3c2OCC3(C)C)C1	ZINC001009762525	1337070235	/nfs/dbraw/zinc/07/02/35/1337070235.db2.gz	PKSYDTKIEXJADN-HNNXBMFYSA-N	0	3	328.456	3.127	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CCN(CCc2ccc(C)cc2)C1	ZINC001014730273	1337889543	/nfs/dbraw/zinc/88/95/43/1337889543.db2.gz	CAAPITYWERSKEQ-LJQANCHMSA-N	0	3	337.467	3.029	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](NC(=O)c2cc3cccc(OC)c3o2)C1	ZINC001015630221	1338216915	/nfs/dbraw/zinc/21/69/15/1338216915.db2.gz	VIYONAUEFPJDPN-OAHLLOKOSA-N	0	3	328.412	3.212	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@@H]2CCN(Cc3cccc(C)c3)C2)cc1	ZINC001015804675	1338317803	/nfs/dbraw/zinc/31/78/03/1338317803.db2.gz	XERQRXGCWPBPKM-HXUWFJFHSA-N	0	3	348.446	3.011	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@H]1CCN(Cc2cccc(CC)c2)C1	ZINC001016114311	1338467113	/nfs/dbraw/zinc/46/71/13/1338467113.db2.gz	QTPQTBCXUOOQSF-QFIPXVFZSA-N	0	3	346.474	3.164	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N[C@@H]1CC12CCN(Cc1cccc(C#N)c1)CC2	ZINC001016577691	1338654075	/nfs/dbraw/zinc/65/40/75/1338654075.db2.gz	YOVNKDQHNBYXQT-ZWKOTPCHSA-N	0	3	337.467	3.075	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)C2C3CC4CC(C3)CC2C4)CC1	ZINC001016663135	1338683461	/nfs/dbraw/zinc/68/34/61/1338683461.db2.gz	PMIDPAUCCIXOBT-RDOIFFKNSA-N	0	3	340.511	3.053	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)[C@@H]2CCCc3ccccc32)CC1	ZINC001016685370	1338689476	/nfs/dbraw/zinc/68/94/76/1338689476.db2.gz	NXWYNTYOJPYKGP-WOJBJXKFSA-N	0	3	336.479	3.101	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cn(CC)c3ccccc23)CC1	ZINC001016718942	1338701474	/nfs/dbraw/zinc/70/14/74/1338701474.db2.gz	ITQYURGTCDUMNK-FQEVSTJZSA-N	0	3	349.478	3.269	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)Cc2cccc(C)c2Cl)CC1	ZINC001016724131	1338703051	/nfs/dbraw/zinc/70/30/51/1338703051.db2.gz	NXYLQWVUYIZULB-KRWDZBQOSA-N	0	3	344.886	3.185	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cc3c(ccc(C)c3C)[nH]2)CC1	ZINC001016764610	1338716594	/nfs/dbraw/zinc/71/65/94/1338716594.db2.gz	WOMTYFZVCCENQX-FQEVSTJZSA-N	0	3	349.478	3.392	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2c(Cl)oc3ccccc32)CC1	ZINC001016790887	1338728517	/nfs/dbraw/zinc/72/85/17/1338728517.db2.gz	QPEPSTMJBYXXRF-OAHLLOKOSA-N	0	3	342.826	3.304	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cc3cc(F)ccc3o2)CC1	ZINC001016860438	1338750205	/nfs/dbraw/zinc/75/02/05/1338750205.db2.gz	QRRNMDPXTOUSMA-SFHVURJKSA-N	0	3	340.398	3.180	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2coc3ccc(Cl)cc32)CC1	ZINC001016954308	1338782704	/nfs/dbraw/zinc/78/27/04/1338782704.db2.gz	HSOTUMHRRWCBQD-QGZVFWFLSA-N	0	3	342.826	3.304	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)[C@@H](C)c2cccc(Cl)c2)CC1	ZINC001016988439	1338794542	/nfs/dbraw/zinc/79/45/42/1338794542.db2.gz	ZXYBKLWWOUYMOZ-WMLDXEAASA-N	0	3	330.859	3.047	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](CN(C)Cc2ncccc2C)C1	ZINC001017179808	1338924026	/nfs/dbraw/zinc/92/40/26/1338924026.db2.gz	PDMGYOIKNHDIDB-KRWDZBQOSA-N	0	3	329.488	3.273	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)CCc1cccc(OC)c1F	ZINC001017601619	1339375461	/nfs/dbraw/zinc/37/54/61/1339375461.db2.gz	JHDVRRNNGLQZSH-CALCHBBNSA-N	0	3	346.446	3.018	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C1C2CC3CC(C2)CC1C3	ZINC001017620765	1339378208	/nfs/dbraw/zinc/37/82/08/1339378208.db2.gz	CSBLDSJCNRMYFT-QFFNFFIKSA-N	0	3	328.500	3.310	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cc2ccccc2n1C	ZINC001017859168	1339431781	/nfs/dbraw/zinc/43/17/81/1339431781.db2.gz	PWRCUFGFPORWOH-HDICACEKSA-N	0	3	337.467	3.433	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CO[C@H]1CCCC[C@@H]1C	ZINC001018016333	1339481944	/nfs/dbraw/zinc/48/19/44/1339481944.db2.gz	JHCBLLGGZXHNGB-OKYOBFRVSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1[C@@H]2c3ccccc3C[C@H]12	ZINC001018038933	1339488713	/nfs/dbraw/zinc/48/87/13/1339488713.db2.gz	UMCPYCHTJPHJAE-GBMAXXPESA-N	0	3	336.479	3.214	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](CC)c1c(C)noc1C	ZINC001018065972	1339493889	/nfs/dbraw/zinc/49/38/89/1339493889.db2.gz	ZSBDZRDRQPIBQH-FGTMMUONSA-N	0	3	345.487	3.426	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CCc1ccccc1F	ZINC001018257671	1339551747	/nfs/dbraw/zinc/55/17/47/1339551747.db2.gz	CWZLRNNUHAYPBO-HDICACEKSA-N	0	3	330.447	3.400	20	30		EGEDHN
Cc1cccc(C(=O)N2CC[C@H](NCc3ccc(C#N)c(F)c3)C2)c1	ZINC001018456060	1339627627	/nfs/dbraw/zinc/62/76/27/1339627627.db2.gz	JHCRMDUVBHYFDY-SFHVURJKSA-N	0	3	337.398	3.010	20	30		EGEDHN
C#CCCN1CCC[C@H]1CNC(=O)c1cc(Cl)cc(Cl)c1	ZINC001028283638	1340538734	/nfs/dbraw/zinc/53/87/34/1340538734.db2.gz	LXFLTIOSSMLTKA-HNNXBMFYSA-N	0	3	325.239	3.211	20	30		EGEDHN
C#CCCN1CCC[C@H]1CNC(=O)c1coc2ccc(Cl)cc12	ZINC001028289986	1340542206	/nfs/dbraw/zinc/54/22/06/1340542206.db2.gz	GQANCNPXLPHBCD-AWEZNQCLSA-N	0	3	330.815	3.304	20	30		EGEDHN
C=C(C)CCN1CCC[C@H]1CNC(=O)c1ccc(P(C)(C)=O)cc1	ZINC001028331461	1340569214	/nfs/dbraw/zinc/56/92/14/1340569214.db2.gz	SNNOTBNEHZEXBE-KRWDZBQOSA-N	0	3	348.427	3.095	20	30		EGEDHN
Cc1cscc1C(=O)NC[C@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC001028469040	1340657186	/nfs/dbraw/zinc/65/71/86/1340657186.db2.gz	IZTCZGSRGAPCMN-QGZVFWFLSA-N	0	3	339.464	3.180	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)c2csc3cc(C)ccc23)C1	ZINC001028568218	1340706955	/nfs/dbraw/zinc/70/69/55/1340706955.db2.gz	OEBREABUEXEWGH-OAHLLOKOSA-N	0	3	326.465	3.285	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H]1C(=O)NC[C@@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC001028813063	1340832293	/nfs/dbraw/zinc/83/22/93/1340832293.db2.gz	SOVYXNAPRVTEDW-XUVXKRRUSA-N	0	3	339.483	3.179	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)C1CCN(C(=O)c2ccoc2)CC1	ZINC001029051813	1340919484	/nfs/dbraw/zinc/91/94/84/1340919484.db2.gz	YYFWCJLEQPCICU-OAHLLOKOSA-N	0	3	337.423	3.182	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)C1CCN(C(=O)C2(C)CCC2)CC1	ZINC001029127642	1340936793	/nfs/dbraw/zinc/93/67/93/1340936793.db2.gz	WQOAXRRTAWUTFD-INIZCTEOSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC([C@@H](C)NCc3cc(C)no3)CC2)C1	ZINC001029140958	1340941225	/nfs/dbraw/zinc/94/12/25/1340941225.db2.gz	LJPLIXKTVAJHRU-OAHLLOKOSA-N	0	3	331.460	3.056	20	30		EGEDHN
C[C@H](NCc1cc(F)ccc1C#N)C1CCN(C(=O)C(C)(C)C)CC1	ZINC001029168136	1340947511	/nfs/dbraw/zinc/94/75/11/1340947511.db2.gz	SASDQEWTNDPWGP-AWEZNQCLSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C[C@@H](C(=O)N1C[C@H]2CC[C@@H](C1)N2CC[C@@H](C)F)c1ccccc1	ZINC001029594672	1341018336	/nfs/dbraw/zinc/01/83/36/1341018336.db2.gz	UCPRTJNWXCSSRV-OQIJWPOYSA-N	0	3	330.447	3.380	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCN(C(=O)CC2CCC2)C1	ZINC001029688102	1341043043	/nfs/dbraw/zinc/04/30/43/1341043043.db2.gz	QDVLMVUQFNGXLN-OAHLLOKOSA-N	0	3	331.485	3.090	20	30		EGEDHN
C[C@@H](c1ccc(F)cc1F)N(C)C[C@@H]1CCN(C(=O)C#CC2CC2)C1	ZINC001029733136	1341057461	/nfs/dbraw/zinc/05/74/61/1341057461.db2.gz	GDHAGVSCWPJZAU-HOCLYGCPSA-N	0	3	346.421	3.220	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H](CN(C)Cc2ccccn2)C1	ZINC001029749403	1341062903	/nfs/dbraw/zinc/06/29/03/1341062903.db2.gz	WTYPWHZDKOYGAS-HNNXBMFYSA-N	0	3	335.879	3.141	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(-n3ccnc3)cc2)CC[C@H]1C	ZINC001071712507	1354871287	/nfs/dbraw/zinc/87/12/87/1354871287.db2.gz	PGOIKRMYSCARBP-AEFFLSMTSA-N	0	3	338.455	3.031	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](CN(C)Cc2cn(C(C)C)nc2C)C1	ZINC001029803112	1341078329	/nfs/dbraw/zinc/07/83/29/1341078329.db2.gz	JBJVILKDSRHBHU-QGZVFWFLSA-N	0	3	346.519	3.265	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@H](CN(C)Cc2cncc(C)c2)C1	ZINC001029825377	1341087227	/nfs/dbraw/zinc/08/72/27/1341087227.db2.gz	CJDLKGSMXYBYFU-PXNSSMCTSA-N	0	3	329.488	3.273	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@H](CN(C)Cc2oc(CC)nc2C)C1	ZINC001029828678	1341088731	/nfs/dbraw/zinc/08/87/31/1341088731.db2.gz	IGFXZMHGBWCPNI-JXFKEZNVSA-N	0	3	347.503	3.428	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CC[C@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001029859212	1341098529	/nfs/dbraw/zinc/09/85/29/1341098529.db2.gz	PRQYEMPJNYAOEM-LSDHHAIUSA-N	0	3	333.501	3.192	20	30		EGEDHN
C#Cc1cncc(C(=O)N(Cc2ccccc2)[C@@H]2CCCN(CC)C2)c1	ZINC001029922291	1341120893	/nfs/dbraw/zinc/12/08/93/1341120893.db2.gz	YTGQUZPUOAMRCS-OAQYLSRUSA-N	0	3	347.462	3.190	20	30		EGEDHN
CCCC(=O)N1CCC(CN(C)Cc2cc(C#N)ccc2F)CC1	ZINC001029925906	1341122516	/nfs/dbraw/zinc/12/25/16/1341122516.db2.gz	QGBKUOMBYKIJRM-UHFFFAOYSA-N	0	3	331.435	3.168	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)CC1CCN(C(=O)C2(C)CCC2)CC1	ZINC001029984255	1341144023	/nfs/dbraw/zinc/14/40/23/1341144023.db2.gz	BBEDDUAVTSPFCB-UHFFFAOYSA-N	0	3	345.512	3.480	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC(CN(C)Cc3cncs3)CC2)C1	ZINC001029993327	1341150207	/nfs/dbraw/zinc/15/02/07/1341150207.db2.gz	BQXPMGDYLVWQIW-UHFFFAOYSA-N	0	3	333.501	3.170	20	30		EGEDHN
CC(C)(C)C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C12CCC2	ZINC001078788279	1357083917	/nfs/dbraw/zinc/08/39/17/1357083917.db2.gz	FFHVLAHYLVKFLG-IRXDYDNUSA-N	0	3	343.446	3.260	20	30		EGEDHN
N#Cc1cc(C(=O)N2C[C@@H]3C[C@H]2CN3CCC2CCCCCC2)c[nH]1	ZINC001032364473	1341502540	/nfs/dbraw/zinc/50/25/40/1341502540.db2.gz	BSDHWTAMLFVHLM-OALUTQOASA-N	0	3	340.471	3.146	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C1(c2cccc(F)c2)CCC1	ZINC001032553208	1341538832	/nfs/dbraw/zinc/53/88/32/1341538832.db2.gz	RMLMLXPIMNFUKQ-OALUTQOASA-N	0	3	342.458	3.499	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N1C[C@@H]2C[C@H]1CN2CCC1CCCC1	ZINC001032673318	1341578369	/nfs/dbraw/zinc/57/83/69/1341578369.db2.gz	KOBVLPVGBANMCI-MUGJNUQGSA-N	0	3	346.515	3.223	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cc(C)n(CC2CC2)c1C	ZINC001032737457	1341595671	/nfs/dbraw/zinc/59/56/71/1341595671.db2.gz	RECNHHOGCPHNKY-OALUTQOASA-N	0	3	341.499	3.380	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C(C)(C)c1ccc(F)cc1	ZINC001032738401	1341596164	/nfs/dbraw/zinc/59/61/64/1341596164.db2.gz	DTXLRVITCDOSID-ROUUACIJSA-N	0	3	330.447	3.355	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(OC(C)C)cc1	ZINC001032765221	1341607318	/nfs/dbraw/zinc/60/73/18/1341607318.db2.gz	CBJUYQPJJGFXMH-ROUUACIJSA-N	0	3	328.456	3.339	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H](c1ccc(F)cc1)C(C)C	ZINC001032807161	1341620458	/nfs/dbraw/zinc/62/04/58/1341620458.db2.gz	ZVFIKZFKNHQCPK-GBESFXJTSA-N	0	3	330.447	3.427	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H]1Cc2c1cccc2Cl	ZINC001032810036	1341622970	/nfs/dbraw/zinc/62/29/70/1341622970.db2.gz	OWGJQEBZPUGPAM-ZQIUZPCESA-N	0	3	330.859	3.231	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C1(C(F)(F)F)CCCC1	ZINC001032817804	1341625831	/nfs/dbraw/zinc/62/58/31/1341625831.db2.gz	RQXHNMYJYOMLKD-KBPBESRZSA-N	0	3	330.394	3.360	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)C2(c3cccc(Cl)c3)CC2)C1	ZINC001033127930	1341734444	/nfs/dbraw/zinc/73/44/44/1341734444.db2.gz	YLQOEPFXHSYERP-QGZVFWFLSA-N	0	3	332.875	3.480	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@H]2CCN(Cc3cccc(OC)c3C)C2)C1	ZINC001033400325	1341813615	/nfs/dbraw/zinc/81/36/15/1341813615.db2.gz	ULGSJRGESYFWEF-SFHVURJKSA-N	0	3	342.483	3.393	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)Cn2cc(C)c3ccccc32)C1	ZINC001033496472	1341847207	/nfs/dbraw/zinc/84/72/07/1341847207.db2.gz	ZNUNIPNTHWTNKU-KRWDZBQOSA-N	0	3	325.456	3.059	20	30		EGEDHN
C#CCCN1CC[C@@H](N(C)C(=O)c2c(Cl)cccc2Cl)C1	ZINC001033611384	1341901776	/nfs/dbraw/zinc/90/17/76/1341901776.db2.gz	SAPGNZUMHLMGPS-GFCCVEGCSA-N	0	3	325.239	3.163	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)[C@@H]2C[C@H]2c2cccc(F)c2F)C1	ZINC001033679866	1341947079	/nfs/dbraw/zinc/94/70/79/1341947079.db2.gz	MHDXLFLRHGUFPA-CWRNSKLLSA-N	0	3	334.410	3.177	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2csc([C@@H]3CCCO3)n2)C1	ZINC001033828809	1342029377	/nfs/dbraw/zinc/02/93/77/1342029377.db2.gz	RMGMVOKLPLPBPB-ZBFHGGJFSA-N	0	3	349.500	3.107	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cc3cc(F)ccc3[nH]2)C1	ZINC001033916115	1342086280	/nfs/dbraw/zinc/08/62/80/1342086280.db2.gz	LBUNITURVBTBKO-INIZCTEOSA-N	0	3	329.419	3.420	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2ccc(OC)c(C3CC3)c2)C1	ZINC001033996962	1342137829	/nfs/dbraw/zinc/13/78/29/1342137829.db2.gz	BPQLGRPQTXMKHN-GOSISDBHSA-N	0	3	340.467	3.132	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2cccc(C(F)(F)F)c2)C1	ZINC001034026095	1342164391	/nfs/dbraw/zinc/16/43/91/1342164391.db2.gz	UMIPOTDEJCTKRP-MRXNPFEDSA-N	0	3	338.373	3.265	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2ccc(F)c3occc32)C1	ZINC001034046841	1342185681	/nfs/dbraw/zinc/18/56/81/1342185681.db2.gz	ALNSKQXTHCPXSO-CQSZACIVSA-N	0	3	328.387	3.132	20	30		EGEDHN
C=CCCN1CC[C@@H](N(CC)C(=O)c2cc(C3CCCC3)no2)C1	ZINC001034047031	1342186788	/nfs/dbraw/zinc/18/67/88/1342186788.db2.gz	BOMJOHAVMZUMHQ-MRXNPFEDSA-N	0	3	331.460	3.445	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cc(C)c(OC)c(C)c2)C1	ZINC001034224789	1342328557	/nfs/dbraw/zinc/32/85/57/1342328557.db2.gz	BYYFYWOIWWNKGO-SFHVURJKSA-N	0	3	330.472	3.472	20	30		EGEDHN
C=CCCN1CCCC[C@H](NC(=O)c2ccc(-c3cc[nH]n3)s2)C1	ZINC001034266250	1342357077	/nfs/dbraw/zinc/35/70/77/1342357077.db2.gz	VWXLMWZPBXGXNR-AWEZNQCLSA-N	0	3	344.484	3.299	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)C(C)(C)c2cc(C)ccn2)C1	ZINC001034275155	1342366170	/nfs/dbraw/zinc/36/61/70/1342366170.db2.gz	XITOKZABNSPWQM-KRWDZBQOSA-N	0	3	329.488	3.214	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2coc3ccc(OC)cc32)C1	ZINC001034304111	1342386452	/nfs/dbraw/zinc/38/64/52/1342386452.db2.gz	OUBBPXPVZAUJGH-OAHLLOKOSA-N	0	3	340.423	3.049	20	30		EGEDHN
C=CCCN1CCCC[C@@H](NC(=O)c2cnc(CC3CC3)s2)C1	ZINC001034320317	1342397098	/nfs/dbraw/zinc/39/70/98/1342397098.db2.gz	WPXCOXGZDOKITC-OAHLLOKOSA-N	0	3	333.501	3.256	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2c[nH]nc2-c2ccccc2)C1	ZINC001034330792	1342405778	/nfs/dbraw/zinc/40/57/78/1342405778.db2.gz	RXFTZUBXLJYXMZ-QGZVFWFLSA-N	0	3	338.455	3.237	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2c(F)cc(OC)cc2F)C1	ZINC001034415550	1342477876	/nfs/dbraw/zinc/47/78/76/1342477876.db2.gz	WDZFGBHCHQBVKQ-ZDUSSCGKSA-N	0	3	338.398	3.134	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2ccccc2O[C@@H](C)CC)C1	ZINC001034420541	1342482391	/nfs/dbraw/zinc/48/23/91/1342482391.db2.gz	JCXCTQGCPVLDFM-ZWKOTPCHSA-N	0	3	342.483	3.472	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)C(C)(C)c2ccccc2F)C1	ZINC001034447892	1342508598	/nfs/dbraw/zinc/50/85/98/1342508598.db2.gz	LIDSGIHRTCNSQJ-MRXNPFEDSA-N	0	3	330.447	3.097	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccnc(OC3CCC3)c2)C1	ZINC001034461973	1342517535	/nfs/dbraw/zinc/51/75/35/1342517535.db2.gz	HCKRRJJDLWXSJG-KRWDZBQOSA-N	0	3	343.471	3.173	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cnn(CC(C)C)c2C)C1	ZINC001034505571	1342563657	/nfs/dbraw/zinc/56/36/57/1342563657.db2.gz	CFGBRWANXRAGBU-KRWDZBQOSA-N	0	3	332.492	3.008	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)c2cccc(OCC(C)C)c2)C1	ZINC001034521208	1342580125	/nfs/dbraw/zinc/58/01/25/1342580125.db2.gz	CRNDWBNCVPWPKI-SFHVURJKSA-N	0	3	330.472	3.492	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cc(OC)c(OC)cc2C)C1	ZINC001034534524	1342590010	/nfs/dbraw/zinc/59/00/10/1342590010.db2.gz	MATXIGSFIBADSK-MRXNPFEDSA-N	0	3	346.471	3.173	20	30		EGEDHN
N#Cc1cccc(C[NH2+][C@H]2CC[C@H](NC(=O)c3ccccc3[O-])CC2)c1	ZINC001034593434	1342637919	/nfs/dbraw/zinc/63/79/19/1342637919.db2.gz	NYLKBCHCYKTGEL-IYARVYRRSA-N	0	3	349.434	3.095	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)C2(C)CCCC2)CC1	ZINC001034700713	1342699884	/nfs/dbraw/zinc/69/98/84/1342699884.db2.gz	YXBHAYJGSYZNAA-HDJSIYSDSA-N	0	3	343.309	3.492	20	30		EGEDHN
Cc1ncccc1C(=O)N[C@H]1CC[C@H](NCc2ccccc2C#N)CC1	ZINC001034720450	1342714361	/nfs/dbraw/zinc/71/43/61/1342714361.db2.gz	FUCGGWYOZARPFI-WGSAOQKQSA-N	0	3	348.450	3.093	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)C2(C)CC=CC2)CC1	ZINC001034726715	1342721214	/nfs/dbraw/zinc/72/12/14/1342721214.db2.gz	WOVXOYCSLBTOHY-HDJSIYSDSA-N	0	3	341.293	3.268	20	30		EGEDHN
C[C@@H]1C[C@@H]1C(=O)NCc1ccc(CNCc2cccc(C#N)c2)cc1	ZINC001034806433	1342772093	/nfs/dbraw/zinc/77/20/93/1342772093.db2.gz	GFGAHORSIYLNSQ-QRWLVFNGSA-N	0	3	333.435	3.120	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)c2ccccc2)cc1F	ZINC001034844883	1342797886	/nfs/dbraw/zinc/79/78/86/1342797886.db2.gz	DIPGJHKFYAKCAX-GOSISDBHSA-N	0	3	337.398	3.092	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@@H]1CNCc1ccc(Cl)cc1Cl	ZINC001034879337	1342818588	/nfs/dbraw/zinc/81/85/88/1342818588.db2.gz	CKTCLAQBFBUWFT-BXUZGUMPSA-N	0	3	340.254	3.234	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@@H]1CNCc1cc(Cl)ccc1Cl	ZINC001034887185	1342821449	/nfs/dbraw/zinc/82/14/49/1342821449.db2.gz	UDQYHKAPBWUXQQ-BXUZGUMPSA-N	0	3	340.254	3.234	20	30		EGEDHN
CC(C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)s1)=C1CCC1	ZINC001034932155	1342841801	/nfs/dbraw/zinc/84/18/01/1342841801.db2.gz	AOLHLIACJJVUSH-OAHLLOKOSA-N	0	3	329.469	3.201	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)s2)CCC1	ZINC001035019071	1342880267	/nfs/dbraw/zinc/88/02/67/1342880267.db2.gz	TUEYFPSNKQDCGV-CQSZACIVSA-N	0	3	331.485	3.281	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2cccn2C(C)C)C12CCC2	ZINC001078816167	1357096540	/nfs/dbraw/zinc/09/65/40/1357096540.db2.gz	IRAPUKZWWCFFKV-CVEARBPZSA-N	0	3	335.879	3.452	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)CO[C@H]1CCCC[C@@H]1CC)CC2	ZINC001035704186	1343143641	/nfs/dbraw/zinc/14/36/41/1343143641.db2.gz	ZDRXMNAACFGGBK-OALUTQOASA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1nccc3ccsc31)CC2	ZINC001035725750	1343154226	/nfs/dbraw/zinc/15/42/26/1343154226.db2.gz	CMXQHGILEARLHV-UHFFFAOYSA-N	0	3	341.480	3.410	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc(C)c(F)cc1F)CC2	ZINC001035727267	1343154885	/nfs/dbraw/zinc/15/48/85/1343154885.db2.gz	CNDVTWPOZFRVDE-UHFFFAOYSA-N	0	3	334.410	3.387	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C[C@H](C)c1c(C)noc1C)CC2	ZINC001035734275	1343160333	/nfs/dbraw/zinc/16/03/33/1343160333.db2.gz	BCHMFIJKCVGTNM-HNNXBMFYSA-N	0	3	345.487	3.286	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccc(C)c(Cl)c1F)CC2	ZINC001035759436	1343174239	/nfs/dbraw/zinc/17/42/39/1343174239.db2.gz	FGXBVMDPSGBINH-UHFFFAOYSA-N	0	3	348.849	3.349	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cc3cc(C)ccc3[nH]1)CC2	ZINC001035761690	1343175441	/nfs/dbraw/zinc/17/54/41/1343175441.db2.gz	BEZCBAZQQFXYIW-UHFFFAOYSA-N	0	3	335.451	3.038	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc3ccccc3n1C)CC2	ZINC001035778272	1343188568	/nfs/dbraw/zinc/18/85/68/1343188568.db2.gz	IZCHEJUBOFPYQU-UHFFFAOYSA-N	0	3	337.467	3.292	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc(C(C)C)cn1)CC2	ZINC001035797219	1343203617	/nfs/dbraw/zinc/20/36/17/1343203617.db2.gz	FRRNIXWEDCNLML-UHFFFAOYSA-N	0	3	327.472	3.319	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cccc(F)c1Cl)CC2	ZINC001035803753	1343206414	/nfs/dbraw/zinc/20/64/14/1343206414.db2.gz	IXHBPHWHGUBKAU-UHFFFAOYSA-N	0	3	334.822	3.040	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)C(C)(C)Cc1ccccc1)CC2	ZINC001035832994	1343220150	/nfs/dbraw/zinc/22/01/50/1343220150.db2.gz	XESOYNNJHWIQIN-UHFFFAOYSA-N	0	3	338.495	3.203	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc(CC(C)C)c[nH]1)CC2	ZINC001035837086	1343220404	/nfs/dbraw/zinc/22/04/04/1343220404.db2.gz	MZCUAVCBYGYCTL-UHFFFAOYSA-N	0	3	329.488	3.327	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cccc3ccccc31)CC2	ZINC001035845239	1343226389	/nfs/dbraw/zinc/22/63/89/1343226389.db2.gz	DBWWDYKKGMYLDJ-UHFFFAOYSA-N	0	3	332.447	3.401	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc(OC)c(Cl)c1)CC2	ZINC001035850271	1343229748	/nfs/dbraw/zinc/22/97/48/1343229748.db2.gz	VXNLDSBUGWMOIV-UHFFFAOYSA-N	0	3	348.874	3.463	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc(Cl)cn1CC)CC2	ZINC001035851991	1343230327	/nfs/dbraw/zinc/23/03/27/1343230327.db2.gz	CKLXAZXPSMPIEV-UHFFFAOYSA-N	0	3	335.879	3.276	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cccc3oc(C)nc31)CC2	ZINC001035859548	1343235621	/nfs/dbraw/zinc/23/56/21/1343235621.db2.gz	CLVNRRBSBMZRFR-UHFFFAOYSA-N	0	3	339.439	3.250	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](NCc2csc(C)n2)[C@H](C)C1	ZINC001036140145	1343325152	/nfs/dbraw/zinc/32/51/52/1343325152.db2.gz	BLQFVXJVEYGQET-CJNGLKHVSA-N	0	3	335.517	3.380	20	30		EGEDHN
C[C@H]1CN(C(=O)C2(C)CCC2)CC[C@H]1NCc1ccccc1C#N	ZINC001036141223	1343325705	/nfs/dbraw/zinc/32/57/05/1343325705.db2.gz	GRQWVAAXBGBQRJ-MAUKXSAKSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCCN(C(=O)CC2CC2)C1	ZINC001036346980	1343433684	/nfs/dbraw/zinc/43/36/84/1343433684.db2.gz	YVKLLCRVFVTTJX-HNAYVOBHSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCCN(C(=O)c2ccoc2)C1	ZINC001036361507	1343443111	/nfs/dbraw/zinc/44/31/11/1343443111.db2.gz	JUBJJVAYOMUOBM-QAPCUYQASA-N	0	3	337.423	3.182	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCCN(C(=O)CC2(C)CC2)C1	ZINC001036425561	1343478997	/nfs/dbraw/zinc/47/89/97/1343478997.db2.gz	LTLVWSZDACTKPN-QFBILLFUSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCCN(C(=O)C2(C)CCC2)C1	ZINC001036428002	1343480730	/nfs/dbraw/zinc/48/07/30/1343480730.db2.gz	OSTCJJNAJHSJFQ-QFBILLFUSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]([C@@H](C)NCc2cc(C)n(C)n2)C1	ZINC001036436161	1343486247	/nfs/dbraw/zinc/48/62/47/1343486247.db2.gz	BUDUPVKSTZQEOB-IAGOWNOFSA-N	0	3	346.519	3.048	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]([C@H](C)NCc2cscn2)C1	ZINC001036443637	1343491458	/nfs/dbraw/zinc/49/14/58/1343491458.db2.gz	WBWXQPFXUGNQAS-LSDHHAIUSA-N	0	3	335.517	3.462	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]([C@H](C)NCc3nc(C)oc3C)C2)C1	ZINC001036443535	1343491513	/nfs/dbraw/zinc/49/15/13/1343491513.db2.gz	HYPBOTKIENEXFR-WMLDXEAASA-N	0	3	345.487	3.364	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]([C@H](C)NCc2ccn(CC)n2)C1	ZINC001036443753	1343491523	/nfs/dbraw/zinc/49/15/23/1343491523.db2.gz	WIGZUZAIONSVMW-DLBZAZTESA-N	0	3	346.519	3.222	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)C2CCC2)[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001036490929	1343513665	/nfs/dbraw/zinc/51/36/65/1343513665.db2.gz	WYZZELDNIRDXHT-AUUYWEPGSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)C#CC2CC2)[C@@H]1CNCc1cc(F)ccc1F	ZINC001036550435	1343549482	/nfs/dbraw/zinc/54/94/82/1343549482.db2.gz	VJKKPHGGIJLDIC-AUUYWEPGSA-N	0	3	346.421	3.095	20	30		EGEDHN
O=C(C1CC1)N1CC[C@@H]2[C@H](CCN2CC#Cc2cccc(Cl)c2)C1	ZINC001036613868	1343574843	/nfs/dbraw/zinc/57/48/43/1343574843.db2.gz	NJVRULIZPVYHBD-IEBWSBKVSA-N	0	3	342.870	3.024	20	30		EGEDHN
CCCC(=O)N1CC[C@H]2[C@@H](CCN2CC#Cc2cccc(Cl)c2)C1	ZINC001036617691	1343577007	/nfs/dbraw/zinc/57/70/07/1343577007.db2.gz	PQZIYLPWMJCLOV-HKUYNNGSSA-N	0	3	344.886	3.414	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@H]2[C@@H](CCN2Cc2ccc(C#N)c(F)c2)C1	ZINC001036631619	1343588298	/nfs/dbraw/zinc/58/82/98/1343588298.db2.gz	AKKIDKAIIPBJPD-HKUYNNGSSA-N	0	3	341.430	3.086	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@H]2[C@H](CCN2Cc2ccccc2C#N)C1	ZINC001036652400	1343602019	/nfs/dbraw/zinc/60/20/19/1343602019.db2.gz	RSOKFAILHFGDFU-UXHICEINSA-N	0	3	339.483	3.417	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@H]2[C@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001036652785	1343602779	/nfs/dbraw/zinc/60/27/79/1343602779.db2.gz	XZXLTDHDCLHTFN-QAPCUYQASA-N	0	3	345.512	3.479	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@@H]2CN(C(=O)C3(C4CC4)CC3)CC[C@H]21	ZINC001036745022	1343670067	/nfs/dbraw/zinc/67/00/67/1343670067.db2.gz	RYKOTNNGSGQYKO-UYAOXDASSA-N	0	3	349.478	3.171	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2cc(C)ns2)C1	ZINC001036789192	1343718447	/nfs/dbraw/zinc/71/84/47/1343718447.db2.gz	NMAXUUDMIHEADC-GOEBONIOSA-N	0	3	333.501	3.087	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccccc2F)C1	ZINC001036792892	1343725190	/nfs/dbraw/zinc/72/51/90/1343725190.db2.gz	WHYZECVXACPVEU-FUHWJXTLSA-N	0	3	330.447	3.461	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]3[C@H](CCN3Cc3oc(C)nc3C)C2)C1	ZINC001036815956	1343753202	/nfs/dbraw/zinc/75/32/02/1343753202.db2.gz	NQSKAXQXTDSNDS-IAGOWNOFSA-N	0	3	343.471	3.071	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCC[C@H]1NC(=O)c1cccs1	ZINC001036933891	1343877617	/nfs/dbraw/zinc/87/76/17/1343877617.db2.gz	GAIHCVQLKATMIU-DLBZAZTESA-N	0	3	339.464	3.308	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@@H]1CCC[C@@H]1NC(=O)C=C1CCC1	ZINC001036980216	1343907250	/nfs/dbraw/zinc/90/72/50/1343907250.db2.gz	FJMDGBOIEVVALR-LPHOPBHVSA-N	0	3	341.430	3.182	20	30		EGEDHN
CC1(C(=O)N[C@@H]2CCCC[C@H]2CNCc2ccccc2C#N)CC1	ZINC001037189698	1344028819	/nfs/dbraw/zinc/02/88/19/1344028819.db2.gz	DBYNCUMBIYKCDL-ZWKOTPCHSA-N	0	3	325.456	3.123	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCC[C@H]2CNCc2ocnc2C)C1	ZINC001037242939	1344064242	/nfs/dbraw/zinc/06/42/42/1344064242.db2.gz	SXIAGNTVPTTXFQ-JKSUJKDBSA-N	0	3	331.460	3.104	20	30		EGEDHN
CC(C)(C)C(=O)N[C@@H]1CCCC[C@H]1CNCc1ccccc1C#N	ZINC001037265765	1344069902	/nfs/dbraw/zinc/06/99/02/1344069902.db2.gz	SNHWPJQFASRASJ-ZWKOTPCHSA-N	0	3	327.472	3.369	20	30		EGEDHN
CC[C@@H]1CN(C(=O)C=C(C)C)CC[C@@H]1NCc1cc(F)ccc1C#N	ZINC001037781541	1344092152	/nfs/dbraw/zinc/09/21/52/1344092152.db2.gz	WBSNOMDQRWDVOM-BEFAXECRSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3cc(C)no3)[C@H](CC)C2)CC1	ZINC001037924881	1344184407	/nfs/dbraw/zinc/18/44/07/1344184407.db2.gz	MDEOAOBKIIKUES-VQIMIIECSA-N	0	3	345.487	3.446	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NC[C@H]1CCN1CCC1=CCCCC1	ZINC001038265774	1344348751	/nfs/dbraw/zinc/34/87/51/1344348751.db2.gz	HJKNOYCTKQLRRJ-QRVBRYPASA-N	0	3	332.488	3.049	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1cccc(N2CCCC2)c1	ZINC001038850440	1344611333	/nfs/dbraw/zinc/61/13/33/1344611333.db2.gz	SVLDIXIAKABGRE-IBGZPJMESA-N	0	3	327.472	3.057	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C2CCCCCC2)C[C@H]1c1cccc(F)c1	ZINC001079173817	1357201134	/nfs/dbraw/zinc/20/11/34/1357201134.db2.gz	PDOHCEZHVKFHOO-VQTJNVASSA-N	0	3	342.458	3.313	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2cscc2C)C[C@H]1c1cccc(F)c1	ZINC001079178089	1357201949	/nfs/dbraw/zinc/20/19/49/1357201949.db2.gz	VMGKXMVAEZPQJU-FUHWJXTLSA-N	0	3	342.439	3.027	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)c3ccncc3)CC2)C1	ZINC001039095709	1344768982	/nfs/dbraw/zinc/76/89/82/1344768982.db2.gz	FLXRNDGHHVLSBU-QGZVFWFLSA-N	0	3	333.863	3.008	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)c3ccncc3C)CC2)C1	ZINC001039120387	1344794523	/nfs/dbraw/zinc/79/45/23/1344794523.db2.gz	JPTSULCYIWLSOV-QGZVFWFLSA-N	0	3	347.890	3.317	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2sccc2C)C1	ZINC001039178338	1344872735	/nfs/dbraw/zinc/87/27/35/1344872735.db2.gz	OSKWNFICCLKDME-IAGOWNOFSA-N	0	3	330.497	3.396	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(C)cs2)C1	ZINC001039200774	1344910417	/nfs/dbraw/zinc/91/04/17/1344910417.db2.gz	RFYZPBBDGSEYTR-SJORKVTESA-N	0	3	330.497	3.396	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(F)ccc2F)C1	ZINC001039212431	1344927660	/nfs/dbraw/zinc/92/76/60/1344927660.db2.gz	FZZYUYKPRRCNDU-BEFAXECRSA-N	0	3	346.421	3.305	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)COC2CCCCC2)C1	ZINC001039214590	1344930613	/nfs/dbraw/zinc/93/06/13/1344930613.db2.gz	TWDYOSXYAOECCN-UYAOXDASSA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc3ccsc3[nH]2)C1	ZINC001039224337	1344941799	/nfs/dbraw/zinc/94/17/99/1344941799.db2.gz	DSSWKTUBYKZKSX-RDJZCZTQSA-N	0	3	341.480	3.179	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc3ccc(C)cc3[nH]2)C1	ZINC001039226010	1344944809	/nfs/dbraw/zinc/94/48/09/1344944809.db2.gz	RHBWSTHVVOCFLD-WIYYLYMNSA-N	0	3	349.478	3.426	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc(C)cc(F)c2)C1	ZINC001039233810	1344954156	/nfs/dbraw/zinc/95/41/56/1344954156.db2.gz	OJEPBZCIMGAUBK-QFBILLFUSA-N	0	3	328.431	3.084	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)CC(C2CC2)C2CC2)C1	ZINC001039244927	1344973635	/nfs/dbraw/zinc/97/36/35/1344973635.db2.gz	ZOPOMHZAIRBRDS-UYAOXDASSA-N	0	3	328.500	3.149	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)CCc2ccccc2)C1	ZINC001039246015	1344975270	/nfs/dbraw/zinc/97/52/70/1344975270.db2.gz	OLJGUJYZFIRZKZ-LEWJYISDSA-N	0	3	338.495	3.346	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)Cc2ccc(Cl)cc2)C1	ZINC001039250046	1344980763	/nfs/dbraw/zinc/98/07/63/1344980763.db2.gz	MLLMTZRPCKKYLX-PKOBYXMFSA-N	0	3	344.886	3.219	20	30		EGEDHN
Cc1ccc(CN2CC[C@H]3CC[C@@H](C2)N3C(=O)C#CC2CC2)c(C)c1	ZINC001039373158	1345031928	/nfs/dbraw/zinc/03/19/28/1345031928.db2.gz	HFCSDVFJOSLSRE-RTWAWAEBSA-N	0	3	336.479	3.282	20	30		EGEDHN
CCc1ccccc1CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C#CC1CC1	ZINC001039373682	1345032567	/nfs/dbraw/zinc/03/25/67/1345032567.db2.gz	IIPSGLRNPFBZFU-RTWAWAEBSA-N	0	3	336.479	3.228	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C1(c2ccc(F)cc2)CC1	ZINC001039381876	1345036614	/nfs/dbraw/zinc/03/66/14/1345036614.db2.gz	KBRIDRIEWFCPRT-MOPGFXCFSA-N	0	3	342.458	3.499	20	30		EGEDHN
C=CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1c(C)noc1C(F)F	ZINC001039392103	1345041558	/nfs/dbraw/zinc/04/15/58/1345041558.db2.gz	DMCSDWJKHSWMDE-OLZOCXBDSA-N	0	3	339.386	3.176	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccccc1COC	ZINC001039399539	1345046490	/nfs/dbraw/zinc/04/64/90/1345046490.db2.gz	FFQDJHJOLSYMKU-MSOLQXFVSA-N	0	3	328.456	3.088	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1Cc2ccc(F)cc21	ZINC001039425830	1345062447	/nfs/dbraw/zinc/06/24/47/1345062447.db2.gz	YZWCPVUDEHUGBZ-AOIWGVFYSA-N	0	3	328.431	3.107	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)CCc1csc(C)n1	ZINC001039447715	1345072593	/nfs/dbraw/zinc/07/25/93/1345072593.db2.gz	ZXNBIDPZVTWLFL-SJORKVTESA-N	0	3	333.501	3.026	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(C)n(C(C)(C)C)n1	ZINC001039472109	1345087698	/nfs/dbraw/zinc/08/76/98/1345087698.db2.gz	CBMURSKOMMAZAB-SJORKVTESA-N	0	3	344.503	3.202	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(Cl)cn1CC	ZINC001039472584	1345088252	/nfs/dbraw/zinc/08/82/52/1345088252.db2.gz	ZTECVYSHYROHHH-CVEARBPZSA-N	0	3	335.879	3.416	20	30		EGEDHN
CC[C@H](C)C(=O)N1CC[C@@]2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001040084251	1345329690	/nfs/dbraw/zinc/32/96/90/1345329690.db2.gz	RZADBQAHAKTBQG-UWJYYQICSA-N	0	3	339.483	3.419	20	30		EGEDHN
C/C=C(\C)C(=O)N1CC[C@@]2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001040149034	1345354426	/nfs/dbraw/zinc/35/44/26/1345354426.db2.gz	FJWPCVOEKRGWID-PKJWAPKXSA-N	0	3	337.467	3.339	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@]2(C1)CCCN(C/C=C/c1ccccc1)C2	ZINC001040203472	1345374303	/nfs/dbraw/zinc/37/43/03/1345374303.db2.gz	ZBEJJTGUQBLYSA-VURDRKPISA-N	0	3	348.490	3.428	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@H]3CCCC4(CC4)C3)C2)C1	ZINC001040209112	1345375814	/nfs/dbraw/zinc/37/58/14/1345375814.db2.gz	NXXXRXLRLZLTCE-RXVVDRJESA-N	0	3	328.500	3.295	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3sc(C)cc3C)C2)C1	ZINC001040228992	1345385388	/nfs/dbraw/zinc/38/53/88/1345385388.db2.gz	OLVORDOMPLAGHD-LJQANCHMSA-N	0	3	330.497	3.316	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)C3(C(F)(F)F)CCC3)C2)C1	ZINC001040264277	1345402023	/nfs/dbraw/zinc/40/20/23/1345402023.db2.gz	NLOFOKZYSVJAJW-INIZCTEOSA-N	0	3	342.405	3.057	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@H]3CC[C@@H]4C[C@@H]4CC3)C2)C1	ZINC001040308894	1345424697	/nfs/dbraw/zinc/42/46/97/1345424697.db2.gz	DZPCRQGKSNDFSR-RCLSDMTESA-N	0	3	328.500	3.151	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3ccc(C)c(F)c3F)C2)C1	ZINC001040416458	1345485161	/nfs/dbraw/zinc/48/51/61/1345485161.db2.gz	VRZXSWFLTJLAJU-LJQANCHMSA-N	0	3	334.410	3.387	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3oc(C(C)C)nc3C)C2)C1	ZINC001040436339	1345499495	/nfs/dbraw/zinc/49/94/95/1345499495.db2.gz	UWXAWENYDNQJIF-HXUWFJFHSA-N	0	3	343.471	3.058	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3cc(C(C)C)oc3C)C2)C1	ZINC001040479246	1345514362	/nfs/dbraw/zinc/51/43/62/1345514362.db2.gz	PLUXPNYSTUBHSK-FQEVSTJZSA-N	0	3	328.456	3.273	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ccccc3OCC)C2)C1	ZINC001040515219	1345528412	/nfs/dbraw/zinc/52/84/12/1345528412.db2.gz	HRYZACUJGFDKPT-NRFANRHFSA-N	0	3	340.467	3.037	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cncc4ccccc43)C2)C1	ZINC001040543259	1345538633	/nfs/dbraw/zinc/53/86/33/1345538633.db2.gz	NBYQGLMZXFHPCD-OAQYLSRUSA-N	0	3	335.451	3.349	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@@H](C)Cc3ccccc3C)C2)C1	ZINC001040546326	1345540871	/nfs/dbraw/zinc/54/08/71/1345540871.db2.gz	CJEHOLXKHNIAEE-UGKGYDQZSA-N	0	3	338.495	3.121	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cnc(CC(C)C)s3)C2)C1	ZINC001040550803	1345542683	/nfs/dbraw/zinc/54/26/83/1345542683.db2.gz	FUSXPGMXVOSACQ-IBGZPJMESA-N	0	3	347.528	3.456	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3csc(CC(C)C)n3)C2)C1	ZINC001040552269	1345544408	/nfs/dbraw/zinc/54/44/08/1345544408.db2.gz	ZVLVQNTWFZOZQN-IBGZPJMESA-N	0	3	347.528	3.456	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@H](C)c3ccc(Cl)cc3)C2)CC1	ZINC001040829724	1345584127	/nfs/dbraw/zinc/58/41/27/1345584127.db2.gz	GBTKCZFNFZPSSX-MRXNPFEDSA-N	0	3	344.886	3.391	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@H](C)c3ccc(C)o3)C2)CC1	ZINC001040875711	1345592540	/nfs/dbraw/zinc/59/25/40/1345592540.db2.gz	FSSGCCVNGAAMIV-QGZVFWFLSA-N	0	3	328.456	3.029	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)C[C@@H](C)c3ccccc3F)C2)CC1	ZINC001040883114	1345594025	/nfs/dbraw/zinc/59/40/25/1345594025.db2.gz	WUZQZSMQRCUCTL-QGZVFWFLSA-N	0	3	342.458	3.267	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3oc(CC)cc3C)C2)CC1	ZINC001040914713	1345599074	/nfs/dbraw/zinc/59/90/74/1345599074.db2.gz	SATFPSLHZNYMSV-UHFFFAOYSA-N	0	3	328.456	3.102	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3sccc3C(F)F)C2)CC1	ZINC001040923908	1345601519	/nfs/dbraw/zinc/60/15/19/1345601519.db2.gz	GDOOZSLQNSSJBJ-UHFFFAOYSA-N	0	3	338.423	3.247	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)Cc3ccc4ccccc4c3)C2)CC1	ZINC001040929859	1345603253	/nfs/dbraw/zinc/60/32/53/1345603253.db2.gz	FHLXRWLQJONWKI-UHFFFAOYSA-N	0	3	346.474	3.330	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cc(C)nc4ccccc43)C2)CC1	ZINC001040931964	1345604417	/nfs/dbraw/zinc/60/44/17/1345604417.db2.gz	YFMWYIPOTNISKA-UHFFFAOYSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@H](C)c3cccc(F)c3)C2)CC1	ZINC001040946002	1345606501	/nfs/dbraw/zinc/60/65/01/1345606501.db2.gz	UWYMBPJHVUKZIM-QGZVFWFLSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@@H](C)c3ccc(F)c(F)c3)C2)CC1	ZINC001040945028	1345606513	/nfs/dbraw/zinc/60/65/13/1345606513.db2.gz	MAJGHTHWDJFIRP-HNNXBMFYSA-N	0	3	346.421	3.016	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cnc(C(C)(C)C)s3)C2)CC1	ZINC001040953225	1345609500	/nfs/dbraw/zinc/60/95/00/1345609500.db2.gz	LMJBFDOWQVTNTC-UHFFFAOYSA-N	0	3	345.512	3.002	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001041020880	1345624024	/nfs/dbraw/zinc/62/40/24/1345624024.db2.gz	APCIWKABHXYRIG-HXUWFJFHSA-N	0	3	325.456	3.029	20	30		EGEDHN
CC[C@H](C)C(=O)N1CC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001041086761	1345648853	/nfs/dbraw/zinc/64/88/53/1345648853.db2.gz	IWNJJHGBCNKVCF-OXJNMPFZSA-N	0	3	325.456	3.029	20	30		EGEDHN
C/C(=C\C(=O)N1CC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1)C1CC1	ZINC001041096409	1345651962	/nfs/dbraw/zinc/65/19/62/1345651962.db2.gz	DGKLOBXRFNEMIX-BVZCLVNKSA-N	0	3	349.478	3.339	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3csc4cc(C)ccc43)C2)C1	ZINC001041320573	1345701847	/nfs/dbraw/zinc/70/18/47/1345701847.db2.gz	CZSMCEFHKSLYDS-FQEVSTJZSA-N	0	3	338.476	3.381	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)Cc3cccc(C)c3Cl)C2)C1	ZINC001041469255	1345737923	/nfs/dbraw/zinc/73/79/23/1345737923.db2.gz	ZFRKOBQGPMWDSV-FQEVSTJZSA-N	0	3	344.886	3.139	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001041545693	1345760005	/nfs/dbraw/zinc/76/00/05/1345760005.db2.gz	XPLHPXDZFCPWLQ-OAQYLSRUSA-N	0	3	337.467	3.195	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@]2(CCN(Cc3c(C)noc3C)C2)C1	ZINC001041626236	1345801272	/nfs/dbraw/zinc/80/12/72/1345801272.db2.gz	QIPMDBQKLYBOQT-PMACEKPBSA-N	0	3	345.487	3.318	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)[C@H](Cc3ccccc3)C(C)C)C2)C1	ZINC001041670912	1345817850	/nfs/dbraw/zinc/81/78/50/1345817850.db2.gz	KCTJNNILOAOYEG-IRLDBZIGSA-N	0	3	338.495	3.059	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)[C@H](c3ccccc3)C(C)C)C2)C1	ZINC001041711793	1345826777	/nfs/dbraw/zinc/82/67/77/1345826777.db2.gz	ILCWIQXBSZITJD-UNMCSNQZSA-N	0	3	338.495	3.374	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)[C@]3(C)CC[C@H](C)C3(C)C)C2)C1	ZINC001041719422	1345830133	/nfs/dbraw/zinc/83/01/33/1345830133.db2.gz	CKFKBXUEXDJYOT-YYWHXJBOSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)[C@@H]3C[C@H]3c3ccccc3C)C2)C1	ZINC001041736232	1345835717	/nfs/dbraw/zinc/83/57/17/1345835717.db2.gz	MYFOGGBENOCBSE-TUNNFDKTSA-N	0	3	336.479	3.046	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3[nH]ccc3-c3ccccc3)C2)C1	ZINC001041782562	1345848811	/nfs/dbraw/zinc/84/88/11/1345848811.db2.gz	AKPDQOUNKRDOFF-QFIPXVFZSA-N	0	3	347.462	3.243	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)C34CC5CC(CC(C5)C3)C4)C2)C1	ZINC001041800165	1345854434	/nfs/dbraw/zinc/85/44/34/1345854434.db2.gz	KLNBJTYBFJRFKM-RKRCHRGQSA-N	0	3	340.511	3.151	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cccc4ccccc43)C2)C1	ZINC001041813498	1345859984	/nfs/dbraw/zinc/85/99/84/1345859984.db2.gz	BOVANXCOTUBDFJ-QFIPXVFZSA-N	0	3	332.447	3.401	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)CCc3c[nH]c4ccccc34)C2)C1	ZINC001041816383	1345861221	/nfs/dbraw/zinc/86/12/21/1345861221.db2.gz	NMMNXJOJKDYWBJ-JOCHJYFZSA-N	0	3	349.478	3.048	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)CCc3ccccc3Cl)C2)C1	ZINC001041819199	1345862386	/nfs/dbraw/zinc/86/23/86/1345862386.db2.gz	BSJBWDNJXRDZFC-FQEVSTJZSA-N	0	3	344.886	3.220	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3cc4c(cccc4F)s3)C2)C1	ZINC001041823897	1345864141	/nfs/dbraw/zinc/86/41/41/1345864141.db2.gz	QTAHQNGTZHAPLI-IBGZPJMESA-N	0	3	342.439	3.212	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)[C@@H](C)Cc3ccccc3C)C2)C1	ZINC001041850960	1345873030	/nfs/dbraw/zinc/87/30/30/1345873030.db2.gz	SDVPNXKEAUMNHW-SIKLNZKXSA-N	0	3	338.495	3.121	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(F)cc4ccncc43)C[C@H]21	ZINC001042065185	1345933629	/nfs/dbraw/zinc/93/36/29/1345933629.db2.gz	PWLFABCHFDIVBB-IFXJQAMLSA-N	0	3	339.414	3.096	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cccc(C(F)F)c3F)C[C@H]21	ZINC001042065326	1345933648	/nfs/dbraw/zinc/93/36/48/1345933648.db2.gz	RGLNXQWAWVYVRL-IUODEOHRSA-N	0	3	338.373	3.486	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(F)c(C(F)F)c3)C[C@@H]21	ZINC001042065586	1345934655	/nfs/dbraw/zinc/93/46/55/1345934655.db2.gz	WMIHKNYHCXXZLR-LRDDRELGSA-N	0	3	338.373	3.486	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccoc3C(F)(F)F)C[C@H]21	ZINC001042075776	1345938577	/nfs/dbraw/zinc/93/85/77/1345938577.db2.gz	NRTSEHQZPXLHCS-WCQYABFASA-N	0	3	328.334	3.021	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)Cc3c(C)cccc3Cl)C[C@@H]21	ZINC001042136638	1345953585	/nfs/dbraw/zinc/95/35/85/1345953585.db2.gz	VTDGIFIXPRJYRG-LPHOPBHVSA-N	0	3	344.886	3.137	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3cccnc3C(F)F)C[C@@H]21	ZINC001042146478	1345956760	/nfs/dbraw/zinc/95/67/60/1345956760.db2.gz	QBCUZKXYPYMUGV-ZFWWWQNUSA-N	0	3	335.398	3.132	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc4c(c3)C(C)(C)CO4)C[C@H]21	ZINC001042147741	1345956995	/nfs/dbraw/zinc/95/69/95/1345956995.db2.gz	HJXCHUNWJMADOZ-CRAIPNDOSA-N	0	3	340.467	3.079	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(-c4cccs4)on3)C[C@H]21	ZINC001042170998	1345965346	/nfs/dbraw/zinc/96/53/46/1345965346.db2.gz	BUVGIRNAVCIAMK-DZGCQCFKSA-N	0	3	343.452	3.126	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)CCc3ccc(C)cc3C)C[C@@H]21	ZINC001042175048	1345966345	/nfs/dbraw/zinc/96/63/45/1345966345.db2.gz	ZFBIDJBXHARESA-RTWAWAEBSA-N	0	3	338.495	3.182	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3c(C)cc(F)cc3C)C[C@H]21	ZINC001042184003	1345971754	/nfs/dbraw/zinc/97/17/54/1345971754.db2.gz	SHMLDWVVTYMLEM-FUHWJXTLSA-N	0	3	328.431	3.002	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2CCN(CCc3ccns3)[C@@H]2C1	ZINC001042185574	1345972847	/nfs/dbraw/zinc/97/28/47/1345972847.db2.gz	VFDTTWVOAVAXEM-NVXWUHKLSA-N	0	3	347.528	3.211	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]3CCN(Cc4cnccc4C)[C@H]3C2)C1	ZINC001042227192	1345995795	/nfs/dbraw/zinc/99/57/95/1345995795.db2.gz	ILSABRUZMFQSCV-MJGOQNOKSA-N	0	3	339.483	3.169	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]3CCN(Cc4cccc(C#N)c4)[C@@H]3C2)C1	ZINC001042227036	1345995863	/nfs/dbraw/zinc/99/58/63/1345995863.db2.gz	HMOPMOXZJILMGS-WOJBJXKFSA-N	0	3	349.478	3.337	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3cc4cc(F)ccc4o3)C[C@H]21	ZINC001042251926	1346006422	/nfs/dbraw/zinc/00/64/22/1346006422.db2.gz	GPLSDUOHCZXJEJ-RHSMWYFYSA-N	0	3	340.398	3.132	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3scnc3C3CC3)C[C@@H]21	ZINC001042261891	1346009782	/nfs/dbraw/zinc/00/97/82/1346009782.db2.gz	AYHDKHYSOSXMJG-HIFRSBDPSA-N	0	3	331.485	3.133	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(OC)c(C4CC4)c3)C[C@H]21	ZINC001042290972	1346018924	/nfs/dbraw/zinc/01/89/24/1346018924.db2.gz	VHFFUYITDSXVLO-VQIMIIECSA-N	0	3	340.467	3.295	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cccn3C3CCCC3)C[C@H]21	ZINC001042289999	1346019115	/nfs/dbraw/zinc/01/91/15/1346019115.db2.gz	NDWDLGJAOHFHJK-FXAWDEMLSA-N	0	3	339.483	3.163	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3[nH]c4ccc(C)cc4c3C)C[C@@H]21	ZINC001042296606	1346020832	/nfs/dbraw/zinc/02/08/32/1346020832.db2.gz	CMIBUZKQNLHSMC-XLIONFOSSA-N	0	3	349.478	3.344	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3cc4cccnc4s3)C[C@@H]21	ZINC001042299909	1346023793	/nfs/dbraw/zinc/02/37/93/1346023793.db2.gz	SBLQLHTZKVVOBN-ZBFHGGJFSA-N	0	3	341.480	3.409	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C(C)(C)c3ccc(F)cc3)C[C@@H]21	ZINC001042317110	1346030853	/nfs/dbraw/zinc/03/08/53/1346030853.db2.gz	WENBHSXCLMHWEO-QAPCUYQASA-N	0	3	330.447	3.212	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cccc(C(F)F)c3)C[C@@H]21	ZINC001042316405	1346030858	/nfs/dbraw/zinc/03/08/58/1346030858.db2.gz	LRHCRTPRSQUWHK-YOEHRIQHSA-N	0	3	332.394	3.184	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3coc4ccc(F)cc34)C[C@@H]21	ZINC001042326079	1346035220	/nfs/dbraw/zinc/03/52/20/1346035220.db2.gz	LIKKVHZZZUVKRD-DYVFJYSZSA-N	0	3	328.387	3.294	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)CCc3c[nH]c4ccccc34)C[C@@H]21	ZINC001042337049	1346042691	/nfs/dbraw/zinc/04/26/91/1346042691.db2.gz	CSMKPVWOQFVOIS-UTKZUKDTSA-N	0	3	349.478	3.047	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)CCc3ccccc3Cl)C[C@H]21	ZINC001042341326	1346045979	/nfs/dbraw/zinc/04/59/79/1346045979.db2.gz	MTFHICMXDYEILO-PKOBYXMFSA-N	0	3	344.886	3.219	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cccc(OCC(C)C)c3)C[C@H]21	ZINC001042349058	1346050147	/nfs/dbraw/zinc/05/01/47/1346050147.db2.gz	NRNIISQSWAYNQB-FXAWDEMLSA-N	0	3	342.483	3.444	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C(C)(C)c3ccc(OC)cc3)C[C@@H]21	ZINC001042362039	1346055466	/nfs/dbraw/zinc/05/54/66/1346055466.db2.gz	GXYXDAPYFDGMPE-LPHOPBHVSA-N	0	3	342.483	3.082	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3cc(C)n(C(C)(C)C)n3)C[C@@H]21	ZINC001042360987	1346055659	/nfs/dbraw/zinc/05/56/59/1346055659.db2.gz	ZKZRGCITLLDOII-WMZOPIPTSA-N	0	3	344.503	3.059	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3cc4cc(C)ccc4o3)C[C@@H]21	ZINC001042369170	1346059959	/nfs/dbraw/zinc/05/99/59/1346059959.db2.gz	UPJOPDSGWXPJBL-WMZOPIPTSA-N	0	3	336.435	3.301	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc(C)c4c3CCC4)C[C@H]21	ZINC001042372670	1346061974	/nfs/dbraw/zinc/06/19/74/1346061974.db2.gz	ZQEIMRDWURBDMT-DYESRHJHSA-N	0	3	336.479	3.043	20	30		EGEDHN
C[C@H]1C[C@@H](NCc2cc(F)ccc2C#N)CCN1C(=O)C1CCCC1	ZINC001044414801	1346321719	/nfs/dbraw/zinc/32/17/19/1346321719.db2.gz	WKXOILMQYTZGJZ-LIRRHRJNSA-N	0	3	343.446	3.357	20	30		EGEDHN
Cc1cccnc1C(=O)N1CC[C@@H](NCc2ccccc2C#N)C[C@H]1C	ZINC001044540002	1346363541	/nfs/dbraw/zinc/36/35/41/1346363541.db2.gz	QUZITNPFNLAPCW-VQIMIIECSA-N	0	3	348.450	3.045	20	30		EGEDHN
C[C@H]1C[C@@H](NCc2cc(F)ccc2C#N)CCN1C(=O)C=C1CCC1	ZINC001044540885	1346364128	/nfs/dbraw/zinc/36/41/28/1346364128.db2.gz	WVVIOHWERFSZGW-LIRRHRJNSA-N	0	3	341.430	3.277	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@H]2CNCc2scnc2C)CC1	ZINC001045182076	1346517702	/nfs/dbraw/zinc/51/77/02/1346517702.db2.gz	LFKMUBJFMRJIJE-INIZCTEOSA-N	0	3	333.501	3.279	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H]1CNCc1cccc(OCC)n1	ZINC001045185699	1346520951	/nfs/dbraw/zinc/52/09/51/1346520951.db2.gz	IWULYCHAOIGKAE-FXAWDEMLSA-N	0	3	345.487	3.163	20	30		EGEDHN
CCc1ccoc1C(=O)N1CCC[C@H]1CNCc1ccc(C#N)s1	ZINC001045186390	1346522253	/nfs/dbraw/zinc/52/22/53/1346522253.db2.gz	LFZGKMFZHNEWEG-AWEZNQCLSA-N	0	3	343.452	3.170	20	30		EGEDHN
Cc1cncc(C(=O)NC2(C)CCN(Cc3ccc(C#N)cc3)CC2)c1	ZINC001045398275	1346582728	/nfs/dbraw/zinc/58/27/28/1346582728.db2.gz	YXARJVOCSGGZOK-UHFFFAOYSA-N	0	3	348.450	3.046	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2cc3c(cc(C)cc3C)[nH]2)CC1	ZINC001045515799	1346614711	/nfs/dbraw/zinc/61/47/11/1346614711.db2.gz	WHWHVFRORYPPIS-UHFFFAOYSA-N	0	3	337.467	3.392	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2sc(Cl)nc2Cl)CC1	ZINC001045642523	1346656640	/nfs/dbraw/zinc/65/66/40/1346656640.db2.gz	GETMLYYJCAYTKG-UHFFFAOYSA-N	0	3	334.272	3.220	20	30		EGEDHN
CC1CC(C(=O)N2CC[C@H]3CC[C@@H](C2)N3Cc2cccc(C#N)c2)C1	ZINC001045749410	1346688901	/nfs/dbraw/zinc/68/89/01/1346688901.db2.gz	ZKTZFLPZLDPDIE-AVMZVFHNSA-N	0	3	337.467	3.170	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1cccc(C#N)c1	ZINC001045851007	1346720613	/nfs/dbraw/zinc/72/06/13/1346720613.db2.gz	MRSOHFUJBAVQNC-YSTOQKLRSA-N	0	3	337.467	3.170	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1ccc(C#N)cc1	ZINC001045858217	1346723122	/nfs/dbraw/zinc/72/31/22/1346723122.db2.gz	WYHNVABVVIMHKH-AHRSYUTCSA-N	0	3	339.483	3.416	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)/C=C\c1ccco1)C2	ZINC001045909186	1346746536	/nfs/dbraw/zinc/74/65/36/1346746536.db2.gz	KHKLIPCBIXCVKG-ZTBDEIDFSA-N	0	3	326.440	3.021	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cccc(F)c1)C2	ZINC001045911733	1346749889	/nfs/dbraw/zinc/74/98/89/1346749889.db2.gz	PKUWJWOCGSTRRQ-HXUWFJFHSA-N	0	3	328.431	3.167	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc(C(C)C)nc1)C2	ZINC001045943634	1346779025	/nfs/dbraw/zinc/77/90/25/1346779025.db2.gz	KRXRBHXLROGKGP-NRFANRHFSA-N	0	3	339.483	3.156	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)C[C@@H]1C[C@H]1C1CC1)C2	ZINC001045953997	1346789388	/nfs/dbraw/zinc/78/93/88/1346789388.db2.gz	OQTFPDIGPHHBIK-IRFCIJBXSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)C1CC3(CCC3)C1)C2	ZINC001045956941	1346791944	/nfs/dbraw/zinc/79/19/44/1346791944.db2.gz	PRNUJBNNUQNKDJ-NRFANRHFSA-N	0	3	328.500	3.295	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc3cc(C)ccc3[nH]1)C2	ZINC001045956982	1346791997	/nfs/dbraw/zinc/79/19/97/1346791997.db2.gz	VKBRTQRYNOHREF-QFIPXVFZSA-N	0	3	349.478	3.428	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc[nH]c1C(C)C)C2	ZINC001045962141	1346797546	/nfs/dbraw/zinc/79/75/46/1346797546.db2.gz	XVJHRDRLFDKHKO-FQEVSTJZSA-N	0	3	327.472	3.090	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1occc1CC)C2	ZINC001045964071	1346798947	/nfs/dbraw/zinc/79/89/47/1346798947.db2.gz	XSAMEQFVBXMWDB-HXUWFJFHSA-N	0	3	328.456	3.184	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H](C)C(C)(F)F)C2	ZINC001045967645	1346802384	/nfs/dbraw/zinc/80/23/84/1346802384.db2.gz	ZCDKYEGCEFCAHH-QAPCUYQASA-N	0	3	326.431	3.006	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H](C)c1ccc(C)o1)C2	ZINC001045971599	1346807504	/nfs/dbraw/zinc/80/75/04/1346807504.db2.gz	QWRVJXPILZULFG-FXAWDEMLSA-N	0	3	328.456	3.029	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)C1(C)CC(F)(F)C1)C2	ZINC001045978976	1346815920	/nfs/dbraw/zinc/81/59/20/1346815920.db2.gz	MCKHROPWDGRWOI-GOSISDBHSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1sc(C)nc1C)C2	ZINC001045982977	1346822745	/nfs/dbraw/zinc/82/27/45/1346822745.db2.gz	HJHQOPHUVBLKPM-LJQANCHMSA-N	0	3	345.512	3.101	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)C13CCC(CC1)CC3)C2	ZINC001045986478	1346827882	/nfs/dbraw/zinc/82/78/82/1346827882.db2.gz	RQGICCQOIBNVCC-VEDCXYSMSA-N	0	3	328.500	3.295	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2cc(F)cc3ccncc32)C1	ZINC001046320279	1346933868	/nfs/dbraw/zinc/93/38/68/1346933868.db2.gz	RJQGNLIHEVHORD-LJQANCHMSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@]1(C)CCN(Cc2cccc(C)c2)C1	ZINC001046374151	1346953919	/nfs/dbraw/zinc/95/39/19/1346953919.db2.gz	LYHBVZDWFCXIOJ-OAQYLSRUSA-N	0	3	337.467	3.377	20	30		EGEDHN
C#CCCN1CC[C@@](C)(NC(=O)c2cc(Cl)sc2Cl)C1	ZINC001046378792	1346956181	/nfs/dbraw/zinc/95/61/81/1346956181.db2.gz	YPPLEKBIGSHWJG-CQSZACIVSA-N	0	3	331.268	3.272	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2ccnc(-c3ccco3)c2)C1	ZINC001046404655	1346962561	/nfs/dbraw/zinc/96/25/61/1346962561.db2.gz	FOKXLVIBYPWSLH-LJQANCHMSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=CCCN1CC[C@@](C)(NC(=O)c2cnc(-c3ccoc3)s2)C1	ZINC001046679328	1347060570	/nfs/dbraw/zinc/06/05/70/1347060570.db2.gz	MSQLWSVQVFQGHP-QGZVFWFLSA-N	0	3	331.441	3.173	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](NC(=O)CN(C)CCCCCC)CC[C@@H]1C	ZINC001132365696	1375330294	/nfs/dbraw/zinc/33/02/94/1375330294.db2.gz	OFFJIHDPDBUFHK-IRXDYDNUSA-N	0	3	343.943	3.220	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2cnn(CCC(C)C)c2C)C1	ZINC001046761501	1347088617	/nfs/dbraw/zinc/08/86/17/1347088617.db2.gz	VZWMJXDWVHOOHX-LJQANCHMSA-N	0	3	332.492	3.008	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)[C@@H]2CCCc3sc(C)nc32)C1	ZINC001046765577	1347090805	/nfs/dbraw/zinc/09/08/05/1347090805.db2.gz	ZEJLAXIUJCUCKS-RDTXWAMCSA-N	0	3	333.501	3.028	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@]2(C)CCN(Cc3ccccc3CC)C2)nc1	ZINC001046781039	1347097654	/nfs/dbraw/zinc/09/76/54/1347097654.db2.gz	DQVSULLDURLKEP-QFIPXVFZSA-N	0	3	347.462	3.020	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2oc(C)cc2C)C1	ZINC001046923952	1347153701	/nfs/dbraw/zinc/15/37/01/1347153701.db2.gz	AHPIFIDVHBNJFV-AWEZNQCLSA-N	0	3	326.387	3.160	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2cc(C)c(C)o2)C1	ZINC001046928908	1347155635	/nfs/dbraw/zinc/15/56/35/1347155635.db2.gz	VRVWZSWVYKTDHQ-CQSZACIVSA-N	0	3	326.387	3.160	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2nc(C)c(C)s2)C1	ZINC001046994330	1347177094	/nfs/dbraw/zinc/17/70/94/1347177094.db2.gz	CMHVDDSHMQKFQE-CYBMUJFWSA-N	0	3	343.443	3.023	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2nc(C)c(C)s2)C1	ZINC001046994331	1347177249	/nfs/dbraw/zinc/17/72/49/1347177249.db2.gz	CMHVDDSHMQKFQE-ZDUSSCGKSA-N	0	3	343.443	3.023	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3sccc3F)C2)CC1	ZINC001047236143	1347263673	/nfs/dbraw/zinc/26/36/73/1347263673.db2.gz	GIVHTMDTEUOJHZ-HNNXBMFYSA-N	0	3	334.460	3.085	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@@H]3C[C@@H]4C=C[C@H]3CC4)C2)CC1	ZINC001047241930	1347268278	/nfs/dbraw/zinc/26/82/78/1347268278.db2.gz	QCYVVVXATFKYRG-BVOGOJNSSA-N	0	3	340.511	3.173	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)C[C@H]3C=CCCC3)C2)CC1	ZINC001047245603	1347270995	/nfs/dbraw/zinc/27/09/95/1347270995.db2.gz	ZSJGLAZPJANLPL-ICSRJNTNSA-N	0	3	328.500	3.317	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@@H]3C[C@H]3C(C)(C)C)C2)CC1	ZINC001047250157	1347274615	/nfs/dbraw/zinc/27/46/15/1347274615.db2.gz	DNAWJQWONWAPAT-IPMKNSEASA-N	0	3	330.516	3.252	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)[C@]34C[C@H]3CCC4)C2)CC1	ZINC001047251881	1347276479	/nfs/dbraw/zinc/27/64/79/1347276479.db2.gz	YDSQFFNRGPHQKD-QKNQBKEWSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)C(C)(C)C(C)(F)F)C2)CC1	ZINC001047264248	1347285515	/nfs/dbraw/zinc/28/55/15/1347285515.db2.gz	NAKWDHPHHUSJBJ-INIZCTEOSA-N	0	3	340.458	3.252	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC001047683777	1347328966	/nfs/dbraw/zinc/32/89/66/1347328966.db2.gz	SCNUCXXLVPJSLF-JXFKEZNVSA-N	0	3	333.435	3.199	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)C2CCCCC2)C1	ZINC001047688953	1347331364	/nfs/dbraw/zinc/33/13/64/1347331364.db2.gz	VHUAYNYQDJQVOH-JXFKEZNVSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H]([C@@H](C)NCc3nc(C)oc3C)C2)CC1	ZINC001047961335	1347425245	/nfs/dbraw/zinc/42/52/45/1347425245.db2.gz	BUFRUPMOKIFFIF-RDTXWAMCSA-N	0	3	345.487	3.364	20	30		EGEDHN
CC(C(=O)N1C[C@@H](C)[C@@H](CNCc2ccccc2C#N)C1)=C1CCC1	ZINC001048246804	1347501804	/nfs/dbraw/zinc/50/18/04/1347501804.db2.gz	DDDMELLFYKNEBE-QRWLVFNGSA-N	0	3	337.467	3.243	20	30		EGEDHN
C[C@@H]1C[C@@H]1C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccc(C#N)s1	ZINC001048499623	1347569153	/nfs/dbraw/zinc/56/91/53/1347569153.db2.gz	RXBDQMZYHZKHLG-NSIVTLKISA-N	0	3	343.496	3.135	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)[C@@H]2C[C@H]2CC)CC1	ZINC001048628276	1347624781	/nfs/dbraw/zinc/62/47/81/1347624781.db2.gz	CLQQLIKEFAGQTL-VQIMIIECSA-N	0	3	327.472	3.107	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C[C@@H]3C[C@H](C)CC(C)(C)C3)C[C@@H]2C1	ZINC001049117815	1347729019	/nfs/dbraw/zinc/72/90/19/1347729019.db2.gz	KHTBQVPQCMSLFA-CADBVGFASA-N	0	3	330.516	3.252	20	30		EGEDHN
Cc1cc(F)ccc1CN1CC[C@@H]2[C@H]1CCCN2C(=O)C#CC1CC1	ZINC001049468478	1347864147	/nfs/dbraw/zinc/86/41/47/1347864147.db2.gz	VMLCEKYSOYBBSY-WOJBJXKFSA-N	0	3	340.442	3.113	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cccc2ccc(C)nc21	ZINC001049541559	1347898727	/nfs/dbraw/zinc/89/87/27/1347898727.db2.gz	RGVTWLWIIRZLFI-WOJBJXKFSA-N	0	3	347.462	3.245	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc2c([nH]1)c(F)ccc2C	ZINC001049562505	1347911216	/nfs/dbraw/zinc/91/12/16/1347911216.db2.gz	WFXIEEQDSOWBEJ-QZTJIDSGSA-N	0	3	341.430	3.480	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(C)cc(OC)c1C	ZINC001049572720	1347916064	/nfs/dbraw/zinc/91/60/64/1347916064.db2.gz	NGQQNMJIPNKJNO-MSOLQXFVSA-N	0	3	328.456	3.177	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc2cc(C)ccc2n1	ZINC001049586960	1347923957	/nfs/dbraw/zinc/92/39/57/1347923957.db2.gz	ZLRMVZLUIVOFHO-VQTJNVASSA-N	0	3	335.451	3.408	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)CCc1ccc2[nH]ccc2c1	ZINC001049592774	1347927079	/nfs/dbraw/zinc/92/70/79/1347927079.db2.gz	JSXRRGBANHTUPF-NHCUHLMSSA-N	0	3	349.478	3.189	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1c(C)noc1C1CC1	ZINC001049602610	1347932009	/nfs/dbraw/zinc/93/20/09/1347932009.db2.gz	NPKDDNAIZNBDNH-JKSUJKDBSA-N	0	3	329.444	3.115	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1cc(F)c(C)cc1F	ZINC001049612299	1347935602	/nfs/dbraw/zinc/93/56/02/1347935602.db2.gz	LZNWPJUCPGXKDP-QZTJIDSGSA-N	0	3	334.410	3.067	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1cccc(C#N)c1	ZINC001049635030	1347945735	/nfs/dbraw/zinc/94/57/35/1347945735.db2.gz	JFXOEGHMSGIWRL-MOPGFXCFSA-N	0	3	337.467	3.336	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]2[C@@H]1CCN2CCOc1ccccc1	ZINC001049639165	1347948899	/nfs/dbraw/zinc/94/88/99/1347948899.db2.gz	NXBVZERTGBNHAZ-MOPGFXCFSA-N	0	3	342.483	3.343	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]2[C@@H]1CCN2CCOc1ccccc1	ZINC001049639166	1347948951	/nfs/dbraw/zinc/94/89/51/1347948951.db2.gz	NXBVZERTGBNHAZ-OALUTQOASA-N	0	3	342.483	3.343	20	30		EGEDHN
CC1(C(=O)N2CCC[C@@H]3[C@H]2CCN3Cc2cccc(C#N)c2)CCC1	ZINC001049646600	1347953027	/nfs/dbraw/zinc/95/30/27/1347953027.db2.gz	PDGVCDZLYMNDDW-RTBURBONSA-N	0	3	337.467	3.314	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H]2[C@H]1CCN2CCc1ccns1	ZINC001049699468	1347979447	/nfs/dbraw/zinc/97/94/47/1347979447.db2.gz	HVCBEEAAPZLPTO-ZHALLVOQSA-N	0	3	347.528	3.353	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](C)Cc1ccccc1F	ZINC001049714656	1347988494	/nfs/dbraw/zinc/98/84/94/1347988494.db2.gz	PLMOHSJVBUGXBI-LSTHTHJFSA-N	0	3	342.458	3.093	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(C2CC2)nc1C	ZINC001049743043	1347996038	/nfs/dbraw/zinc/99/60/38/1347996038.db2.gz	YGCHJYVETDRRKF-RTBURBONSA-N	0	3	325.456	3.132	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1cccc(Cl)c1F	ZINC001049747845	1347998353	/nfs/dbraw/zinc/99/83/53/1347998353.db2.gz	KUQGBRGGEVDKIZ-CVEARBPZSA-N	0	3	336.838	3.273	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1oc(CC(C)C)nc1C	ZINC001049774884	1348015492	/nfs/dbraw/zinc/01/54/92/1348015492.db2.gz	YOCRYRVXPBCSGA-IRXDYDNUSA-N	0	3	345.487	3.437	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cn1cc(C)c2ccccc21	ZINC001049777730	1348016525	/nfs/dbraw/zinc/01/65/25/1348016525.db2.gz	RMVRDEYVHCKCPF-PMACEKPBSA-N	0	3	337.467	3.201	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cn1cc(C)c2ccccc21	ZINC001049777734	1348016729	/nfs/dbraw/zinc/01/67/29/1348016729.db2.gz	RMVRDEYVHCKCPF-VQTJNVASSA-N	0	3	337.467	3.201	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccccc1C	ZINC001049783250	1348019841	/nfs/dbraw/zinc/01/98/41/1348019841.db2.gz	UNVXJQUMBPKSNO-BQJUDKOJSA-N	0	3	336.479	3.187	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](C)c1ccc(CC)cc1	ZINC001049789524	1348023353	/nfs/dbraw/zinc/02/33/53/1348023353.db2.gz	ASKDQCXBWFLMMH-JRGCBEDISA-N	0	3	338.495	3.441	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc2nc(C)sc2c1	ZINC001049823310	1348040122	/nfs/dbraw/zinc/04/01/22/1348040122.db2.gz	AFPMOPPGQCVEEX-IAGOWNOFSA-N	0	3	341.480	3.470	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](C)Oc1cccc(C)c1	ZINC001049881932	1348087277	/nfs/dbraw/zinc/08/72/77/1348087277.db2.gz	UIOFOZFKFUKATL-NZSAHSFTSA-N	0	3	328.456	3.014	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)C(C)(C)c1ccc(OC)cc1	ZINC001049902979	1348102825	/nfs/dbraw/zinc/10/28/25/1348102825.db2.gz	DBKVIILYVYNKOX-MOPGFXCFSA-N	0	3	342.483	3.224	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](F)Cc1ccccc1	ZINC001049912584	1348107691	/nfs/dbraw/zinc/10/76/91/1348107691.db2.gz	MTNWADQSPLBSTE-GBESFXJTSA-N	0	3	330.447	3.209	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H]1Cc2c1cccc2Cl	ZINC001049920970	1348113350	/nfs/dbraw/zinc/11/33/50/1348113350.db2.gz	DBJXEEASZTXASU-BHIYHBOVSA-N	0	3	342.870	3.068	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)CCc1ccc(C)s1	ZINC001049928529	1348119256	/nfs/dbraw/zinc/11/92/56/1348119256.db2.gz	UJVVOXWLKJXKPW-MSOLQXFVSA-N	0	3	330.497	3.078	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)Cn3c(C)cc4ccccc43)[C@@H]2C1	ZINC001050089201	1348178988	/nfs/dbraw/zinc/17/89/88/1348178988.db2.gz	BZCGXISOVDKCNG-AZUAARDMSA-N	0	3	337.467	3.059	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3ccc(COC)c(F)c3)[C@@H]2C1	ZINC001050191443	1348206909	/nfs/dbraw/zinc/20/69/09/1348206909.db2.gz	XIBJKTODHGSCKW-QFBILLFUSA-N	0	3	346.446	3.085	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)[C@@H](C)Cc3ccc(C)cc3)[C@@H]2C1	ZINC001050210143	1348211922	/nfs/dbraw/zinc/21/19/22/1348211922.db2.gz	OAPZGHFPRCDFLK-YSIASYRMSA-N	0	3	326.484	3.282	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C3C4CC5CC(C4)CC3C5)C2)CC1	ZINC001050547272	1348287618	/nfs/dbraw/zinc/28/76/18/1348287618.db2.gz	ZGTOCWQJXTYESN-UHFFFAOYSA-N	0	3	340.511	3.006	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3ccc(CC(C)C)s3)C2)CC1	ZINC001050547577	1348287694	/nfs/dbraw/zinc/28/76/94/1348287694.db2.gz	AKNRADJIEXWSKB-UHFFFAOYSA-N	0	3	330.497	3.118	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C[C@@H](C)c3ccccc3C)C2)CC1	ZINC001050691318	1348328847	/nfs/dbraw/zinc/32/88/47/1348328847.db2.gz	WGACXHTUECAYGP-LJQANCHMSA-N	0	3	338.495	3.436	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cc(C(C)C)oc3C)C2)CC1	ZINC001050718365	1348336057	/nfs/dbraw/zinc/33/60/57/1348336057.db2.gz	TVOHYLYWIRYYJG-UHFFFAOYSA-N	0	3	328.456	3.273	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3cccc(-c4ccoc4)c3)C2)CC1	ZINC001050723771	1348338282	/nfs/dbraw/zinc/33/82/82/1348338282.db2.gz	VKYUKJGSICIXCZ-UHFFFAOYSA-N	0	3	334.419	3.118	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3ccc(Cl)cc3Cl)C2)CC1	ZINC001050738497	1348343672	/nfs/dbraw/zinc/34/36/72/1348343672.db2.gz	ZROORODABHCLBX-UHFFFAOYSA-N	0	3	337.250	3.165	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)[C@H]3CCCOCC3)cccc2C1	ZINC001051284956	1348418120	/nfs/dbraw/zinc/41/81/20/1348418120.db2.gz	QSXWRCUBCUFLBA-KRWDZBQOSA-N	0	3	342.483	3.054	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2scnc2C2CCCC2)CC1	ZINC001052532748	1348568417	/nfs/dbraw/zinc/56/84/17/1348568417.db2.gz	LLRVUWSNVKEPID-MRXNPFEDSA-N	0	3	345.512	3.408	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2cc3cc(Cl)ccc3o2)CC1	ZINC001052535943	1348569283	/nfs/dbraw/zinc/56/92/83/1348569283.db2.gz	APDBHPNPXJKAQS-HNNXBMFYSA-N	0	3	330.815	3.304	20	30		EGEDHN
Cc1ncccc1C(=O)N[C@H]1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC001052668602	1348622169	/nfs/dbraw/zinc/62/21/69/1348622169.db2.gz	QWCHILNICNWLPB-IBGZPJMESA-N	0	3	348.450	3.046	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)Cc2ccc(Cl)c(F)c2)CC1	ZINC001052745390	1348659002	/nfs/dbraw/zinc/65/90/02/1348659002.db2.gz	NMEHIPHKTDHXPR-OAHLLOKOSA-N	0	3	336.838	3.016	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2scnc2C(C)(C)C)CC1	ZINC001052774553	1348674455	/nfs/dbraw/zinc/67/44/55/1348674455.db2.gz	DOHKSEQOUIZLMK-CQSZACIVSA-N	0	3	333.501	3.048	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2ccc(-c3ccco3)s2)CC1	ZINC001052838071	1348696057	/nfs/dbraw/zinc/69/60/57/1348696057.db2.gz	ZVIANDIBJOAYOR-AWEZNQCLSA-N	0	3	328.437	3.226	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cc3c(s2)CCCC3)CC1	ZINC001052914868	1348746294	/nfs/dbraw/zinc/74/62/94/1348746294.db2.gz	WNXVXFQIGHXSLK-MRXNPFEDSA-N	0	3	330.497	3.235	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2sc(C(C)(C)C)nc2C)CC1	ZINC001052971151	1348780587	/nfs/dbraw/zinc/78/05/87/1348780587.db2.gz	HTEMLAZICQHTHT-OAHLLOKOSA-N	0	3	347.528	3.357	20	30		EGEDHN
CC(=O)N1CCC[C@@H]([C@@H]2CCCN(Cc3ccc(C#N)cc3F)C2)C1	ZINC001052997534	1348794224	/nfs/dbraw/zinc/79/42/24/1348794224.db2.gz	RMCSOEFGLGCGNU-QZTJIDSGSA-N	0	3	343.446	3.168	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2sccc2C)C1	ZINC001053062296	1348872555	/nfs/dbraw/zinc/87/25/55/1348872555.db2.gz	YDGBHARKMOOFGM-IRXDYDNUSA-N	0	3	330.497	3.396	20	30		EGEDHN
C=CC[N@H+]1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001053067564	1348881768	/nfs/dbraw/zinc/88/17/68/1348881768.db2.gz	RWTOOQRGSNIMOD-SJLPKXTDSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=CC[N@@H+]1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001053067564	1348881773	/nfs/dbraw/zinc/88/17/73/1348881773.db2.gz	RWTOOQRGSNIMOD-SJLPKXTDSA-N	0	3	328.456	3.285	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cnccc2C)C1	ZINC001053074553	1348892596	/nfs/dbraw/zinc/89/25/96/1348892596.db2.gz	CHGSMXDKTPMQPZ-AZUAARDMSA-N	0	3	339.483	3.120	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)C2(F)CCCC2)C1	ZINC001053087530	1348911406	/nfs/dbraw/zinc/91/14/06/1348911406.db2.gz	LVCDIPKXUTYWOZ-QZTJIDSGSA-N	0	3	334.479	3.385	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cc(C)c(C)cn2)C1	ZINC001053092285	1348918857	/nfs/dbraw/zinc/91/88/57/1348918857.db2.gz	QSLFXZOADOTGCB-AZUAARDMSA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cccn2C(C)C)C1	ZINC001053103956	1348938362	/nfs/dbraw/zinc/93/83/62/1348938362.db2.gz	BDMHMIMRSNYEQY-RBUKOAKNSA-N	0	3	341.499	3.409	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)CCc2cccs2)C1	ZINC001053107585	1348946720	/nfs/dbraw/zinc/94/67/20/1348946720.db2.gz	JWBJYSDUMQQYKN-IEBWSBKVSA-N	0	3	344.524	3.407	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2Cc3ccccc3CN2CCC=C)cc1	ZINC001054049791	1349139304	/nfs/dbraw/zinc/13/93/04/1349139304.db2.gz	JBVXZAXABYALKF-JOCHJYFZSA-N	0	3	344.458	3.401	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H]1CC[C@@H]3C[C@@H]3CC1)C2	ZINC001054168849	1349170702	/nfs/dbraw/zinc/17/07/02/1349170702.db2.gz	JGRLTPGKDRVAEX-WERVVEIQSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@H]1CCCCC1(F)F)C2	ZINC001054170443	1349172067	/nfs/dbraw/zinc/17/20/67/1349172067.db2.gz	PGFDAICRRTZGMP-SJLPKXTDSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)CCc1cccc(Cl)c1)C2	ZINC001054172525	1349173841	/nfs/dbraw/zinc/17/38/41/1349173841.db2.gz	QUHSQHVQXILQDN-FQEVSTJZSA-N	0	3	344.886	3.220	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@]2(CCN(Cc3c(C)noc3C)C2)C1	ZINC001054175284	1349177075	/nfs/dbraw/zinc/17/70/75/1349177075.db2.gz	LJCKOKOVNPLXKR-FQEVSTJZSA-N	0	3	345.487	3.318	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)Cc1cccc(Cl)c1)C2	ZINC001054186449	1349189375	/nfs/dbraw/zinc/18/93/75/1349189375.db2.gz	SKAFBIWAZVFUAS-HXUWFJFHSA-N	0	3	344.886	3.220	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc3ncccc3c1)C2	ZINC001054188916	1349191741	/nfs/dbraw/zinc/19/17/41/1349191741.db2.gz	WPXYGPYRZLBXSJ-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cccc(F)c1Cl)C2	ZINC001054204244	1349205820	/nfs/dbraw/zinc/20/58/20/1349205820.db2.gz	QHJWWLYKSNOKGL-LJQANCHMSA-N	0	3	348.849	3.431	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(F)cc1Cl)C2	ZINC001054235917	1349228294	/nfs/dbraw/zinc/22/82/94/1349228294.db2.gz	DNMHUJJWXQDAAB-LJQANCHMSA-N	0	3	348.849	3.431	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@]1(C)CC=C(C)CC1)C2	ZINC001054244136	1349238079	/nfs/dbraw/zinc/23/80/79/1349238079.db2.gz	SNHQEJVIEGJBRU-NHCUHLMSSA-N	0	3	328.500	3.461	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H]1CC3CCC1CC3)C2	ZINC001054245753	1349239814	/nfs/dbraw/zinc/23/98/14/1349239814.db2.gz	BAPNHMIQLSNFOD-BRAJZSMUSA-N	0	3	328.500	3.151	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3cc(C)no3)cc2C1	ZINC001054254990	1349250661	/nfs/dbraw/zinc/25/06/61/1349250661.db2.gz	RNJJOACCJMZBRZ-UHFFFAOYSA-N	0	3	325.412	3.195	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@H]3CCCO[C@H]3C)cc2C1	ZINC001054262201	1349260089	/nfs/dbraw/zinc/26/00/89/1349260089.db2.gz	OOABTKBHMGFIJS-JXFKEZNVSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cnc4[nH]ccc4c3)cc2C1	ZINC001054269212	1349268076	/nfs/dbraw/zinc/26/80/76/1349268076.db2.gz	RBGOOEIQSAQYGZ-UHFFFAOYSA-N	0	3	346.434	3.336	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cccc4n[nH]cc43)cc2C1	ZINC001054276809	1349276865	/nfs/dbraw/zinc/27/68/65/1349276865.db2.gz	WHERKLWUKZIJHM-UHFFFAOYSA-N	0	3	346.434	3.385	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3conc3C)cc2C1	ZINC001054280096	1349281210	/nfs/dbraw/zinc/28/12/10/1349281210.db2.gz	ZMKDBTHDBNWYOE-UHFFFAOYSA-N	0	3	325.412	3.195	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@H]3CCOC[C@H]3C)cc2C1	ZINC001054280893	1349282553	/nfs/dbraw/zinc/28/25/53/1349282553.db2.gz	VYHCAZMDDDPZAV-UZLBHIALSA-N	0	3	342.483	3.257	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)NCc1ccc2c(c1)CN(C(C)C)C2	ZINC001054285111	1349287419	/nfs/dbraw/zinc/28/74/19/1349287419.db2.gz	SLFMZIFZGOEGQU-PMACEKPBSA-N	0	3	342.483	3.398	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccccc2F)C[C@H]1NCc1ccc(C#N)s1	ZINC001054341036	1349320816	/nfs/dbraw/zinc/32/08/16/1349320816.db2.gz	LIMOLXJXGJXHHW-SJKOYZFVSA-N	0	3	343.427	3.009	20	30		EGEDHN
C[C@H]1CN(C(=O)CC2CCCC2)C[C@H]1NCc1ccc(C#N)s1	ZINC001054346510	1349325957	/nfs/dbraw/zinc/32/59/57/1349325957.db2.gz	JNMLFDRHHWWWKJ-SUMWQHHRSA-N	0	3	331.485	3.137	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccc(Cl)o2)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054389076	1349345205	/nfs/dbraw/zinc/34/52/05/1349345205.db2.gz	FQUHVRQRISQHSP-MFKMUULPSA-N	0	3	349.843	3.116	20	30		EGEDHN
Cc1coc(C)c1C(=O)N1C[C@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001054616397	1349416013	/nfs/dbraw/zinc/41/60/13/1349416013.db2.gz	AXSOVNDUOKYFPT-MEDUHNTESA-N	0	3	343.452	3.080	20	30		EGEDHN
C[C@H]1CN(C(=O)C(C)(C)C2CC2)C[C@H]1NCc1ccc(C#N)c(F)c1	ZINC001054990885	1349541184	/nfs/dbraw/zinc/54/11/84/1349541184.db2.gz	BZIUAUWVFRASJL-SCLBCKFNSA-N	0	3	343.446	3.070	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2)C1	ZINC001080583803	1357686436	/nfs/dbraw/zinc/68/64/36/1357686436.db2.gz	XDWQYDVNSPTFMV-BVPBIZIASA-N	0	3	332.875	3.456	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3cc([C@@H](C)CC)no3)[C@@H]2C1	ZINC001084708205	1358288367	/nfs/dbraw/zinc/28/83/67/1358288367.db2.gz	SMCBLTYVVVFLMW-ZMSDIMECSA-N	0	3	331.460	3.301	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C(C)=C1CCCC1)C[C@H](C)O2	ZINC001071155217	1354479729	/nfs/dbraw/zinc/47/97/29/1354479729.db2.gz	XNWIVSDHLMUNJF-OXJNMPFZSA-N	0	3	332.488	3.145	20	30		EGEDHN
C#CCCN1CC[C@]2(C1)CN(C(=O)C1CCCCCCC1)C[C@H](C)O2	ZINC001071188973	1354493936	/nfs/dbraw/zinc/49/39/36/1354493936.db2.gz	DBIGXXLCUKIKPT-RXVVDRJESA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCCN1CC[C@]2(C1)CN(C(=O)CC1(C)CCCCC1)C[C@@H](C)O2	ZINC001071190168	1354494684	/nfs/dbraw/zinc/49/46/84/1354494684.db2.gz	VFJPKQPSQNBSJC-NQIIRXRSSA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCCN1CC[C@]2(C1)CN(C(=O)CC1(C)CCCCC1)C[C@H](C)O2	ZINC001071190169	1354495025	/nfs/dbraw/zinc/49/50/25/1354495025.db2.gz	VFJPKQPSQNBSJC-RXVVDRJESA-N	0	3	346.515	3.062	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)[C@H]1CC[C@H](C)CC1)C[C@H](C)O2	ZINC001071232109	1354516224	/nfs/dbraw/zinc/51/62/24/1354516224.db2.gz	ZEBWWTFEWKJTJS-CGBFIWBNSA-N	0	3	334.504	3.081	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)CN(C(=O)C1(CC)CCCCC1)C[C@@H](C)O2	ZINC001071244397	1354524515	/nfs/dbraw/zinc/52/45/15/1354524515.db2.gz	UGYHTTMRWFJSLE-WIYYLYMNSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C1CCC(C)(C)CC1)C[C@H](C)O2	ZINC001071246181	1354526435	/nfs/dbraw/zinc/52/64/35/1354526435.db2.gz	QCLYUHVYZUKMSK-LAUBAEHRSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cccc3scnc32)CC[C@H]1C	ZINC001071508084	1354732656	/nfs/dbraw/zinc/73/26/56/1354732656.db2.gz	HVGMFTSMCGXLMT-KGLIPLIRSA-N	0	3	329.469	3.455	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cccc3scnc32)CC[C@@H]1C	ZINC001071508085	1354732716	/nfs/dbraw/zinc/73/27/16/1354732716.db2.gz	HVGMFTSMCGXLMT-UONOGXRCSA-N	0	3	329.469	3.455	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc3ccccc3nc2C)CC[C@H]1C	ZINC001071546950	1354758948	/nfs/dbraw/zinc/75/89/48/1354758948.db2.gz	PCYZVNJQJJRBGP-QAPCUYQASA-N	0	3	335.451	3.149	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCCC[C@@H](N[C@H](C)c2n[nH]c(CC)n2)C1	ZINC001088359543	1359843051	/nfs/dbraw/zinc/84/30/51/1359843051.db2.gz	AWGLXQNATDFVHQ-HUUCEWRRSA-N	0	3	347.507	3.001	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(-n3cccn3)cc2)CC[C@H]1C	ZINC001071561889	1354765743	/nfs/dbraw/zinc/76/57/43/1354765743.db2.gz	WYBUXLVYDUDBQI-SJLPKXTDSA-N	0	3	338.455	3.031	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C(C)(C)c2cc(C)ccn2)CC[C@H]1C	ZINC001071606316	1354792398	/nfs/dbraw/zinc/79/23/98/1354792398.db2.gz	HNHNQMYUKZOKEV-IAGOWNOFSA-N	0	3	329.488	3.213	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2CCc3ccccc3CC2)CC[C@H]1C	ZINC001071621689	1354804490	/nfs/dbraw/zinc/80/44/90/1354804490.db2.gz	BPYPETJVLOMNAH-UTKZUKDTSA-N	0	3	338.495	3.174	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2[nH]nc3ccc(C)cc32)CC[C@H]1C	ZINC001071642133	1354820933	/nfs/dbraw/zinc/82/09/33/1354820933.db2.gz	KXRJQDUTRPODIL-HUUCEWRRSA-N	0	3	326.444	3.030	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(OC)c(C(C)C)c2)CC[C@@H]1C	ZINC001071653378	1354828467	/nfs/dbraw/zinc/82/84/67/1354828467.db2.gz	XKHQGWPWDKUWKZ-WMZOPIPTSA-N	0	3	342.483	3.425	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cn(C)c3ccccc23)CC[C@@H]1C	ZINC001071657594	1354830061	/nfs/dbraw/zinc/83/00/61/1354830061.db2.gz	AIBJWLZMXCQSMO-JKSUJKDBSA-N	0	3	325.456	3.337	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cn2c(C)cc3ccccc32)CC[C@@H]1C	ZINC001071660312	1354832570	/nfs/dbraw/zinc/83/25/70/1354832570.db2.gz	UAWCKOREXIBJHE-LPHOPBHVSA-N	0	3	339.483	3.495	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2nsc3ccc(C)cc32)CC[C@@H]1C	ZINC001071742644	1354893184	/nfs/dbraw/zinc/89/31/84/1354893184.db2.gz	RWXNREGUSUEHCG-GJZGRUSLSA-N	0	3	341.480	3.211	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)c2ccc(F)c3ccncc23)CC[C@H]1C	ZINC001071759390	1354906964	/nfs/dbraw/zinc/90/69/64/1354906964.db2.gz	HDPUMJILBYKQAR-ZIAGYGMSSA-N	0	3	327.403	3.143	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cccc3c2OCCCO3)CC[C@@H]1C	ZINC001071934680	1355033368	/nfs/dbraw/zinc/03/33/68/1355033368.db2.gz	QQHACSYMKUCZAC-HOTGVXAUSA-N	0	3	344.455	3.007	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CC[C@@H](C)N(CC3=CCCCC3)C2)cn1	ZINC001072002009	1355067196	/nfs/dbraw/zinc/06/71/96/1355067196.db2.gz	IISWRIHLAMGHKM-OXQOHEQNSA-N	0	3	337.467	3.146	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CC[C@@H](C)N(CC3=CCCCC3)C2)cn1	ZINC001072002010	1355067364	/nfs/dbraw/zinc/06/73/64/1355067364.db2.gz	IISWRIHLAMGHKM-UZLBHIALSA-N	0	3	337.467	3.146	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cnn(C(C)(C)C)c2CC)CC[C@@H]1C	ZINC001072072294	1355113052	/nfs/dbraw/zinc/11/30/52/1355113052.db2.gz	IMJPQMCSYKKVIW-JKSUJKDBSA-N	0	3	346.519	3.359	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2nsc3ccccc32)CC[C@@H]1C	ZINC001072092260	1355124134	/nfs/dbraw/zinc/12/41/34/1355124134.db2.gz	OSZDOZBGELHMIC-GJZGRUSLSA-N	0	3	343.496	3.384	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc(Cl)cc3c2OCC3)CC[C@@H]1C	ZINC001072109911	1355136648	/nfs/dbraw/zinc/13/66/48/1355136648.db2.gz	PDTUYNIMUYIEKS-BBRMVZONSA-N	0	3	348.874	3.434	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cscc2C(F)(F)F)CC[C@H]1C	ZINC001072127182	1355143910	/nfs/dbraw/zinc/14/39/10/1355143910.db2.gz	PZMUSRIIYGPBDM-VXGBXAGGSA-N	0	3	344.402	3.373	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H]1COc2ccccc21	ZINC001089735760	1360641247	/nfs/dbraw/zinc/64/12/47/1360641247.db2.gz	HSLDRYSTPFVAOX-SJLPKXTDSA-N	0	3	342.483	3.346	20	30		EGEDHN
C[C@@H]1CCN(C(=O)C2CCCC2)C[C@@H]1CNCc1ccccc1C#N	ZINC001072155949	1355157309	/nfs/dbraw/zinc/15/73/09/1355157309.db2.gz	JOMZITXZPKYDGX-UZLBHIALSA-N	0	3	339.483	3.323	20	30		EGEDHN
C[C@@H]1CCN(C(=O)CC2CCC2)C[C@@H]1CNCc1ccccc1C#N	ZINC001072241364	1355201673	/nfs/dbraw/zinc/20/16/73/1355201673.db2.gz	VRHPICPACUQBNC-UZLBHIALSA-N	0	3	339.483	3.323	20	30		EGEDHN
C[C@@H]1CCN(C(=O)C=C2CCC2)C[C@@H]1CNCc1ccccc1C#N	ZINC001072252728	1355209460	/nfs/dbraw/zinc/20/94/60/1355209460.db2.gz	ZHBSCKCPYXHFST-UZLBHIALSA-N	0	3	337.467	3.243	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001072776692	1355432977	/nfs/dbraw/zinc/43/29/77/1355432977.db2.gz	FGTSFPDBNNNANZ-UHFFFAOYSA-N	0	3	339.483	3.275	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC2(C1)CCN(Cc1cnccc1C)C2	ZINC001072779931	1355433524	/nfs/dbraw/zinc/43/35/24/1355433524.db2.gz	MMMXJQKNECHEIN-UHFFFAOYSA-N	0	3	347.890	3.203	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)[C@@H]4CCC[C@H]5C[C@H]54)C3)C2)c1	ZINC001072875414	1355478241	/nfs/dbraw/zinc/47/82/41/1355478241.db2.gz	QNSPRODKXDJCJS-XUVXKRRUSA-N	0	3	349.478	3.029	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CN(C(=O)C[C@@H]4CC[C@H]5C[C@H]54)C3)C2)cc1	ZINC001072875135	1355478462	/nfs/dbraw/zinc/47/84/62/1355478462.db2.gz	LOHRJPODSAWNGK-SLFFLAALSA-N	0	3	349.478	3.029	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001072944924	1355513065	/nfs/dbraw/zinc/51/30/65/1355513065.db2.gz	OODDXFSDWVFJKI-FQEVSTJZSA-N	0	3	337.467	3.195	20	30		EGEDHN
C=C1CCC(C(=O)N2CC3(C2)CCN(Cc2cccnc2C)C3)CC1	ZINC001072946814	1355515636	/nfs/dbraw/zinc/51/56/36/1355515636.db2.gz	QADOMAAXWPNDDO-UHFFFAOYSA-N	0	3	339.483	3.171	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)Cc3ccc(C(C)(C)C)cc3)C2)C1	ZINC001073012359	1355546829	/nfs/dbraw/zinc/54/68/29/1355546829.db2.gz	OEQKAVMBEPUZMO-UHFFFAOYSA-N	0	3	338.495	3.084	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3ccc(-c4ccccc4)nc3)C2)C1	ZINC001073075119	1355581907	/nfs/dbraw/zinc/58/19/07/1355581907.db2.gz	PZQQASJOECWEGP-UHFFFAOYSA-N	0	3	333.435	3.083	20	30		EGEDHN
CCCC(C)(C)C(=O)N[C@@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001323069243	1387282525	/nfs/dbraw/zinc/28/25/25/1387282525.db2.gz	ZTZMZMDSCUWGJD-INIZCTEOSA-N	0	3	333.501	3.430	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2cccc(C(C)(C)C)c2)C1	ZINC001073830594	1355911236	/nfs/dbraw/zinc/91/12/36/1355911236.db2.gz	LYQJAHLSYNLYJM-LJQANCHMSA-N	0	3	344.499	3.381	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCCN1C(=O)C1CCC1	ZINC001073928600	1355962782	/nfs/dbraw/zinc/96/27/82/1355962782.db2.gz	JJWDFASKZPOSMZ-LJQANCHMSA-N	0	3	325.456	3.171	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCCN1C(=O)[C@H]1CC1(C)C	ZINC001073993461	1356021990	/nfs/dbraw/zinc/02/19/90/1356021990.db2.gz	ITJBSRKCJUZDPP-RTBURBONSA-N	0	3	339.483	3.417	20	30		EGEDHN
C[C@H]1[C@@H](NCc2ccc(C#N)c(F)c2)CCN1C(=O)C[C@H]1C=CCC1	ZINC001074520111	1356203091	/nfs/dbraw/zinc/20/30/91/1356203091.db2.gz	RRXRZBVXLVYPJX-DOXZYTNZSA-N	0	3	341.430	3.133	20	30		EGEDHN
C[C@H]1[C@@H](NCc2ccc(C#N)s2)CCN1C(=O)[C@@H]1CC=CCC1	ZINC001074522883	1356203538	/nfs/dbraw/zinc/20/35/38/1356203538.db2.gz	AHCVJYAQZHOCLC-VBQJREDUSA-N	0	3	329.469	3.055	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC[C@H](NCc2cc(Cl)ccc2Cl)[C@@H]1C	ZINC001074568622	1356209841	/nfs/dbraw/zinc/20/98/41/1356209841.db2.gz	VBAAFMPGNWBPJJ-ZETOZRRWSA-N	0	3	340.254	3.232	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)[C@@H]1C	ZINC001074862284	1356270313	/nfs/dbraw/zinc/27/03/13/1356270313.db2.gz	AYCHNWCDLGYKHT-KOJWFEOWSA-N	0	3	343.446	3.213	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cc(C(F)F)ccc3F)[C@@H]2C1	ZINC001075801273	1356423222	/nfs/dbraw/zinc/42/32/22/1356423222.db2.gz	YWMMCKYSJHHJIM-XJKSGUPXSA-N	0	3	338.373	3.486	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)COc3ccc(C(C)C)cc3)[C@@H]2C1	ZINC001076000657	1356463224	/nfs/dbraw/zinc/46/32/24/1356463224.db2.gz	DGRPRRPZGOYAQP-AZUAARDMSA-N	0	3	342.483	3.298	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CC[C@H]3CN(Cc4ccc(C)cc4)C[C@H]32)cc1	ZINC001076117699	1356495208	/nfs/dbraw/zinc/49/52/08/1356495208.db2.gz	QMDBASDPFWKGHR-FCHUYYIVSA-N	0	3	344.458	3.323	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)C[C@H](C)c3ccc(CC)cc3)[C@@H]2C1	ZINC001076235777	1356527072	/nfs/dbraw/zinc/52/70/72/1356527072.db2.gz	FYEOWURMNFNWTC-FFZOFVMBSA-N	0	3	326.484	3.461	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)Cc3cccc(Cl)c3F)[C@@H]2C1	ZINC001076285554	1356536004	/nfs/dbraw/zinc/53/60/04/1356536004.db2.gz	SIVYZGLAAWOXNC-GOEBONIOSA-N	0	3	336.838	3.130	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C1(c3cc(C)cc(C)c3)CC1)C2	ZINC001098417696	1363320319	/nfs/dbraw/zinc/32/03/19/1363320319.db2.gz	WOAGEQJURMRIHY-AQNXPRMDSA-N	0	3	336.479	3.080	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)[C@@H](C)Cc3ccccc3Cl)[C@@H]2C1	ZINC001076309528	1356544494	/nfs/dbraw/zinc/54/44/94/1356544494.db2.gz	WFHCWPHSOOSQLP-QILLFSRXSA-N	0	3	332.875	3.237	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cc(F)cc4cccnc43)[C@@H]2C1	ZINC001076319367	1356548073	/nfs/dbraw/zinc/54/80/73/1356548073.db2.gz	NLJFLVWPZYPECT-MAUKXSAKSA-N	0	3	339.414	3.096	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cnn(C(CC)CC)c3C)[C@@H]2C1	ZINC001076440104	1356578972	/nfs/dbraw/zinc/57/89/72/1356578972.db2.gz	URPPGFMNDVYLTR-QFBILLFUSA-N	0	3	344.503	3.275	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)Cc3coc4cc(C)ccc34)[C@@H]2C1	ZINC001076540486	1356612819	/nfs/dbraw/zinc/61/28/19/1356612819.db2.gz	ORLSUMXDQSRHNE-QFBILLFUSA-N	0	3	338.451	3.393	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccc(OCC4CC4)cc3)[C@@H]2C1	ZINC001076581117	1356623660	/nfs/dbraw/zinc/62/36/60/1356623660.db2.gz	UOMWQWIMTWMRJH-AZUAARDMSA-N	0	3	340.467	3.198	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccc(N(C)CCC)cc3)[C@@H]2C1	ZINC001076637237	1356639200	/nfs/dbraw/zinc/63/92/00/1356639200.db2.gz	PMBIKQWCBZZLCX-AZUAARDMSA-N	0	3	341.499	3.255	20	30		EGEDHN
C#CCC1(C(=O)NC[C@H]2CCC(C)(C)CN2CCOC(C)C)CCC1	ZINC001099106839	1363625778	/nfs/dbraw/zinc/62/57/78/1363625778.db2.gz	QBMGYAJBBYBPIV-GOSISDBHSA-N	0	3	348.531	3.212	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H](F)Cc1ccccc1	ZINC001099349677	1363765953	/nfs/dbraw/zinc/76/59/53/1363765953.db2.gz	RJPCXDKTLGNWPP-RTBURBONSA-N	0	3	344.474	3.197	20	30		EGEDHN
C#CCCN1C[C@@H](C)[C@H](NC(=O)c2ccc(-c3ccccc3)cc2)C1	ZINC001080874989	1357754528	/nfs/dbraw/zinc/75/45/28/1357754528.db2.gz	HRUUVPDEVWOXGY-DYESRHJHSA-N	0	3	332.447	3.427	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C2=CCCC2)C12CCC2	ZINC001078588559	1357022342	/nfs/dbraw/zinc/02/23/42/1357022342.db2.gz	DBVQWIPKAFBNGC-KBPBESRZSA-N	0	3	339.277	3.022	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2C[C@H](NCc3cnoc3C)C23CCC3)CC1	ZINC001078716580	1357062767	/nfs/dbraw/zinc/06/27/67/1357062767.db2.gz	VGKTVVHWVBZFBQ-ZWKOTPCHSA-N	0	3	343.471	3.246	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)Cc2ccsc2C)C12CCC2	ZINC001078742525	1357067978	/nfs/dbraw/zinc/06/79/78/1357067978.db2.gz	XOBACNFQGSGROK-CABCVRRESA-N	0	3	338.904	3.369	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C[C@H]2CCC(F)(F)C2)C[C@H]1c1ccccc1	ZINC001081124402	1357841912	/nfs/dbraw/zinc/84/19/12/1357841912.db2.gz	DKDAXOMKRJJPJK-BPQIPLTHSA-N	0	3	346.421	3.029	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C2CCC(F)(F)CC2)C[C@H]1c1ccccc1	ZINC001081187497	1357848502	/nfs/dbraw/zinc/84/85/02/1357848502.db2.gz	JLVLXAYQJDXQLF-ZWKOTPCHSA-N	0	3	346.421	3.029	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H](C=C)c2ccccc2)C[C@H]1c1ccccc1	ZINC001081229909	1357851372	/nfs/dbraw/zinc/85/13/72/1357851372.db2.gz	GWCXPCVCAUAMMI-FDFHNCONSA-N	0	3	344.458	3.174	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2coc3ccc(CC)cc32)[C@H](OC)C1	ZINC001081670048	1357861355	/nfs/dbraw/zinc/86/13/55/1357861355.db2.gz	CQKCOFPZSCWWRF-IEBWSBKVSA-N	0	3	342.439	3.000	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)[C@H]2CC[C@H](C3CCC3)CC2)[C@H](OC)C1	ZINC001081811464	1357864741	/nfs/dbraw/zinc/86/47/41/1357864741.db2.gz	ZIYUSJHBCDWBOS-UAFMIMERSA-N	0	3	348.531	3.375	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)C3[C@@H]4CCCCCC[C@@H]34)[C@H]2C1	ZINC001083203206	1358122943	/nfs/dbraw/zinc/12/29/43/1358122943.db2.gz	GZSPCQOYJCNMJR-AKHDSKFASA-N	0	3	346.515	3.081	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)c3cccc4ccsc43)[C@H]2C1	ZINC001083240613	1358125087	/nfs/dbraw/zinc/12/50/87/1358125087.db2.gz	OTJDNUCMILFYAP-DLBZAZTESA-N	0	3	342.464	3.003	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)[C@H](C)c3ccc(C)s3)[C@H]2C1	ZINC001083247608	1358125620	/nfs/dbraw/zinc/12/56/20/1358125620.db2.gz	XOCQAELGPOTTRH-IXDOHACOSA-N	0	3	348.512	3.038	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2ccccc2C(C)(C)CC)[C@@H](O)C1	ZINC001083553755	1358133959	/nfs/dbraw/zinc/13/39/59/1358133959.db2.gz	VLNNRDOEUXFYCQ-MOPGFXCFSA-N	0	3	344.499	3.115	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@H]2CCN(CC3CC(F)(F)C3)C[C@H]21	ZINC001084372088	1358202789	/nfs/dbraw/zinc/20/27/89/1358202789.db2.gz	FVIJKEMZEBPWEU-ZIAGYGMSSA-N	0	3	346.849	3.343	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)[C@H](C)c3cc4ccccc4o3)[C@@H]2C1	ZINC001084765377	1358304466	/nfs/dbraw/zinc/30/44/66/1358304466.db2.gz	WYTODGZKHCWPBU-KBAYOESNSA-N	0	3	336.435	3.092	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)c3c(CC)oc4ccccc43)[C@@H]2C1	ZINC001084856551	1358330776	/nfs/dbraw/zinc/33/07/76/1358330776.db2.gz	MBBUVLLEDFFMIX-NVXWUHKLSA-N	0	3	336.435	3.165	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@H]3CCCC[C@@H]3C(F)(F)F)C[C@@H]21	ZINC001084973261	1358357985	/nfs/dbraw/zinc/35/79/85/1358357985.db2.gz	CUEIJVGSTNPGLB-WCVJEAGWSA-N	0	3	344.421	3.464	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@H](CC)Oc3cccc(C)c3)C[C@@H]21	ZINC001085054899	1358380205	/nfs/dbraw/zinc/38/02/05/1358380205.db2.gz	BGMXWFJNKMMKOS-HOJAQTOUSA-N	0	3	342.483	3.261	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1[nH]cnc1C(C)(C)C	ZINC001085202714	1358432167	/nfs/dbraw/zinc/43/21/67/1358432167.db2.gz	SOCXEVKUWDURJT-CHWSQXEVSA-N	0	3	338.883	3.090	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cc(COC)cs1	ZINC001085261198	1358446105	/nfs/dbraw/zinc/44/61/05/1358446105.db2.gz	ARUYYBMOBGYRCW-ZIAGYGMSSA-N	0	3	342.892	3.278	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cnc2cnccc2c1	ZINC001085273749	1358448688	/nfs/dbraw/zinc/44/86/88/1358448688.db2.gz	UFJZUVKAQIHHIO-HZPDHXFCSA-N	0	3	344.846	3.013	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCC[C@H]2NCc2cncc(F)c2)C1	ZINC001085324574	1358467453	/nfs/dbraw/zinc/46/74/53/1358467453.db2.gz	DYCQXBDAADAVOH-IAGOWNOFSA-N	0	3	331.435	3.094	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccc2cnccc2n1	ZINC001085344830	1358473522	/nfs/dbraw/zinc/47/35/22/1358473522.db2.gz	UQGWMZXYBXZSHV-HZPDHXFCSA-N	0	3	344.846	3.013	20	30		EGEDHN
CN(C[C@H]1CCN1CCC1CCCCCC1)C(=O)c1c[nH]c(C#N)c1	ZINC001085556571	1358592799	/nfs/dbraw/zinc/59/27/99/1358592799.db2.gz	UQJHCDDFLRWOFF-LJQANCHMSA-N	0	3	342.487	3.393	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cccc2scnc21	ZINC001085594740	1358621844	/nfs/dbraw/zinc/62/18/44/1358621844.db2.gz	OUTMVKQIPRKDPL-AWEZNQCLSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1coc2c1cccc2OC	ZINC001085596971	1358622980	/nfs/dbraw/zinc/62/29/80/1358622980.db2.gz	NEHGVNGISNRVJN-CQSZACIVSA-N	0	3	328.412	3.164	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc(F)cc2ccncc21	ZINC001085599978	1358625644	/nfs/dbraw/zinc/62/56/44/1358625644.db2.gz	HBYCRPPMSLCIEB-KRWDZBQOSA-N	0	3	341.430	3.486	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1cc(F)cc2ccncc21	ZINC001085600324	1358626212	/nfs/dbraw/zinc/62/62/12/1358626212.db2.gz	QCNTUAOWQMIRQR-INIZCTEOSA-N	0	3	327.403	3.096	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc(-c2ccccc2)n[nH]1	ZINC001085708529	1358700303	/nfs/dbraw/zinc/70/03/03/1358700303.db2.gz	KKVBAUBWHMIWSF-QGZVFWFLSA-N	0	3	338.455	3.189	20	30		EGEDHN
CCCC[C@](C)(F)C(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001183799738	1387351167	/nfs/dbraw/zinc/35/11/67/1387351167.db2.gz	LJMBUCVMLJTRGU-APWZRJJASA-N	0	3	349.425	3.306	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1nc(Cl)sc1C	ZINC001085715499	1358706623	/nfs/dbraw/zinc/70/66/23/1358706623.db2.gz	MEDWDVLRLQTLTB-GFCCVEGCSA-N	0	3	327.881	3.217	20	30		EGEDHN
CCCC[C@@](C)(F)C(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001183801980	1387351590	/nfs/dbraw/zinc/35/15/90/1387351590.db2.gz	XANIEWOKNGOZFJ-VQIMIIECSA-N	0	3	349.425	3.306	20	30		EGEDHN
CCCC[C@@](C)(F)C(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C1	ZINC001183801298	1387351868	/nfs/dbraw/zinc/35/18/68/1387351868.db2.gz	UMAPGCPFMAQYSU-CXAGYDPISA-N	0	3	337.464	3.229	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@@H]1C[C@]1(C)c1ccccc1	ZINC001085733914	1358718958	/nfs/dbraw/zinc/71/89/58/1358718958.db2.gz	SLTFXXHPGQRGAM-SVFBPWRDSA-N	0	3	326.484	3.463	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc2c(c1)[C@@H](C)CO2	ZINC001085775852	1358749521	/nfs/dbraw/zinc/74/95/21/1358749521.db2.gz	DCWKHHUXIQKTTN-RDJZCZTQSA-N	0	3	328.456	3.295	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1ccc(F)c(Cl)c1F	ZINC001085799920	1358774798	/nfs/dbraw/zinc/77/47/98/1358774798.db2.gz	GISYRBKZBSGCDW-LLVKDONJSA-N	0	3	328.790	3.341	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@@H]1C[C@H]1c1ccccc1OC	ZINC001085865797	1358831607	/nfs/dbraw/zinc/83/16/07/1358831607.db2.gz	NORVWHJTMXBIJT-YTQUADARSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@H]1CCOc2ccccc21	ZINC001085876163	1358840618	/nfs/dbraw/zinc/84/06/18/1358840618.db2.gz	SUANXIKGNORBBD-WMZOPIPTSA-N	0	3	328.456	3.052	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1cnn(C2CCCCC2)c1	ZINC001085913643	1358873692	/nfs/dbraw/zinc/87/36/92/1358873692.db2.gz	GMUYAESKQKGNBD-GOSISDBHSA-N	0	3	330.476	3.111	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C[C@@H]2CCN2[C@@H](CC)c2ccccc2)cn1	ZINC001085933935	1358889602	/nfs/dbraw/zinc/88/96/02/1358889602.db2.gz	NNVNNCHJURBMNV-SFTDATJTSA-N	0	3	347.462	3.361	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc(F)c(F)c(F)c1F	ZINC001085939216	1358894800	/nfs/dbraw/zinc/89/48/00/1358894800.db2.gz	ARSBMYYHIYOKSF-LLVKDONJSA-N	0	3	344.352	3.356	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc3nccc(C)c3c2)C1	ZINC001086095911	1358995559	/nfs/dbraw/zinc/99/55/59/1358995559.db2.gz	ATTOTPBDJPZWDA-FZNQNYSPSA-N	0	3	343.858	3.394	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cnc3ccccc3c2C)C1	ZINC001086150880	1359009654	/nfs/dbraw/zinc/00/96/54/1359009654.db2.gz	FDJYONJBTOBWKE-GASCZTMLSA-N	0	3	343.858	3.394	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc3ccc(OC)cc3[nH]2)C1	ZINC001086163673	1359012219	/nfs/dbraw/zinc/01/22/19/1359012219.db2.gz	AELKEYVAWOMVGX-XBXGTLAGSA-N	0	3	347.846	3.027	20	30		EGEDHN
C[C@@H]1CC[C@H](C(=O)NC[C@H]2C[C@@H](NCc3ccc(C#N)cc3F)C2)C1	ZINC001086216242	1359029959	/nfs/dbraw/zinc/02/99/59/1359029959.db2.gz	NKJYMTZVCXFYRD-KBEGMRNHSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2c[nH]c3ccc(C)cc23)C1	ZINC001086279201	1359051963	/nfs/dbraw/zinc/05/19/63/1359051963.db2.gz	FFESIMDRYTWYIL-OKILXGFUSA-N	0	3	331.847	3.327	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)c2cc(C)cs2)C1	ZINC001086360991	1359077450	/nfs/dbraw/zinc/07/74/50/1359077450.db2.gz	AXUJTCKYKWAKDV-HAQNSBGRSA-N	0	3	343.290	3.063	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2coc3c2cccc3OC)C1	ZINC001086367397	1359078879	/nfs/dbraw/zinc/07/88/79/1359078879.db2.gz	MJOCOOHIBUZVCZ-JOCQHMNTSA-N	0	3	348.830	3.292	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ocnc2-c2ccccc2)C1	ZINC001086384043	1359083871	/nfs/dbraw/zinc/08/38/71/1359083871.db2.gz	AQUGVKHQZGJXIM-CTYIDZIISA-N	0	3	345.830	3.192	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc3ccc(OC)cc3[nH]2)C1	ZINC001086443994	1359098542	/nfs/dbraw/zinc/09/85/42/1359098542.db2.gz	AELKEYVAWOMVGX-MQMHXKEQSA-N	0	3	347.846	3.027	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cccc(-c3cnco3)c2)C1	ZINC001086523776	1359131161	/nfs/dbraw/zinc/13/11/61/1359131161.db2.gz	IWIMEQNQTPMECJ-SAZUREKKSA-N	0	3	345.830	3.192	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc3c(cccc3OC)[nH]2)C1	ZINC001086550792	1359142238	/nfs/dbraw/zinc/14/22/38/1359142238.db2.gz	WGUYTHHSLPMRCV-JOCQHMNTSA-N	0	3	347.846	3.027	20	30		EGEDHN
C=C(C)CN1C[C@@H](c2ccccc2)[C@H](NC(=O)[C@H]2Cc3ccccc32)C1	ZINC001086607249	1359163217	/nfs/dbraw/zinc/16/32/17/1359163217.db2.gz	RRGHABVEGUJVCI-FDFHNCONSA-N	0	3	346.474	3.487	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cn(C)c3ccccc23)C1	ZINC001086748732	1359194322	/nfs/dbraw/zinc/19/43/22/1359194322.db2.gz	OYBNGPCWSBKZBJ-LSDHHAIUSA-N	0	3	345.874	3.419	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cc(COC)cs2)C1	ZINC001086747299	1359194364	/nfs/dbraw/zinc/19/43/64/1359194364.db2.gz	RQXYJZNORMPYFX-GXTWGEPZSA-N	0	3	342.892	3.135	20	30		EGEDHN
CC1(C)CCC[C@H]1C(=O)NCC1(NCc2ccc(C#N)cc2)CC1	ZINC001323520883	1387381029	/nfs/dbraw/zinc/38/10/29/1387381029.db2.gz	WIYFCQGBTPEACM-KRWDZBQOSA-N	0	3	325.456	3.123	20	30		EGEDHN
N#Cc1cc(CNC2(CNC(=O)CCCC3CC3)CC2)ccc1F	ZINC001323520776	1387381290	/nfs/dbraw/zinc/38/12/90/1387381290.db2.gz	VBSOFDVJUICZNA-UHFFFAOYSA-N	0	3	329.419	3.016	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cc3c(C)cccn3c2)C1	ZINC001086852106	1359213599	/nfs/dbraw/zinc/21/35/99/1359213599.db2.gz	NCRJICWXCLFUNT-DOTOQJQBSA-N	0	3	345.874	3.488	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2csc(C3CC3)n2)C1	ZINC001086887336	1359221446	/nfs/dbraw/zinc/22/14/46/1359221446.db2.gz	YAQHXSGOBBDSMD-WCQYABFASA-N	0	3	339.892	3.261	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccsc3Cl)C2)CC1	ZINC001086947120	1359268369	/nfs/dbraw/zinc/26/83/69/1359268369.db2.gz	PZDNPOLBOKRZBI-CYBMUJFWSA-N	0	3	336.888	3.351	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc4ccccc4o3)C2)CC1	ZINC001086955294	1359276054	/nfs/dbraw/zinc/27/60/54/1359276054.db2.gz	JYAMAQUPOZOHIH-MRXNPFEDSA-N	0	3	336.435	3.383	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc(CF)cc3)C2)CC1	ZINC001086958989	1359279722	/nfs/dbraw/zinc/27/97/22/1359279722.db2.gz	KUPMKTGGURWGJI-INIZCTEOSA-N	0	3	328.431	3.106	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC[C@@H](C)C[C@H]1CNCc1sccc1Cl	ZINC001087136497	1359301636	/nfs/dbraw/zinc/30/16/36/1359301636.db2.gz	WBDSALXHEYOMFI-UPJWGTAASA-N	0	3	339.892	3.278	20	30		EGEDHN
C/C=C(/C)C(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC001087145215	1359305525	/nfs/dbraw/zinc/30/55/25/1359305525.db2.gz	MKMFQLHDVYEBST-ALJHWNEKSA-N	0	3	343.446	3.380	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cn(C)c4ccccc34)C(C)(C)[C@H]21	ZINC001087293847	1359374670	/nfs/dbraw/zinc/37/46/70/1359374670.db2.gz	KVTVXBUPTSBQBM-UXPWSPDFSA-N	0	3	349.478	3.030	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3c(C)oc(C)c3C)C(C)(C)[C@@H]21	ZINC001087295221	1359376001	/nfs/dbraw/zinc/37/60/01/1359376001.db2.gz	GFGFANBHVGBBGH-KBAYOESNSA-N	0	3	328.456	3.057	20	30		EGEDHN
C=CCN1CCC[C@@H]2[C@@H](NC(=O)c3ocnc3C(F)F)C(C)(C)[C@H]21	ZINC001087303012	1359386184	/nfs/dbraw/zinc/38/61/84/1359386184.db2.gz	FGJUJAXYLIXYSV-HONMWMINSA-N	0	3	339.386	3.017	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(C)ccc3F)C(C)(C)[C@@H]21	ZINC001087304664	1359388798	/nfs/dbraw/zinc/38/87/98/1359388798.db2.gz	FUNOARZKTPUCQW-ATZDWAIDSA-N	0	3	342.458	3.376	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc4[nH]ccc43)C(C)(C)[C@@H]21	ZINC001087305796	1359391159	/nfs/dbraw/zinc/39/11/59/1359391159.db2.gz	YUBGTEZNHKLBMS-BHIYHBOVSA-N	0	3	335.451	3.020	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)Cc3ccc(Cl)cc3)C(C)(C)[C@@H]21	ZINC001087315540	1359405605	/nfs/dbraw/zinc/40/56/05/1359405605.db2.gz	DMVGKCMOVHSBLE-BHIYHBOVSA-N	0	3	344.886	3.121	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(F)cc3F)C(C)(C)[C@H]21	ZINC001087316672	1359407626	/nfs/dbraw/zinc/40/76/26/1359407626.db2.gz	VZZHLYKUIXQSAC-NXHRZFHOSA-N	0	3	346.421	3.207	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cncc4ccccc43)C(C)(C)[C@@H]21	ZINC001087317703	1359409274	/nfs/dbraw/zinc/40/92/74/1359409274.db2.gz	LQJCHGBWLKTWOP-MISYRCLQSA-N	0	3	347.462	3.087	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)C12CC(C(C)(C)C)(C1)C2	ZINC001087318749	1359410425	/nfs/dbraw/zinc/41/04/25/1359410425.db2.gz	CBQHIWQFIQRGIM-XYOLMSGHSA-N	0	3	342.527	3.441	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)C3CCC=CCC3)C(C)(C)[C@@H]21	ZINC001087319983	1359412186	/nfs/dbraw/zinc/41/21/86/1359412186.db2.gz	XEKWFNYVNHWLSI-GUDVDZBRSA-N	0	3	328.500	3.361	20	30		EGEDHN
C=CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)c2cc(F)c[nH]2)C1	ZINC001087433043	1359463715	/nfs/dbraw/zinc/46/37/15/1359463715.db2.gz	YGBHEBZUGBJDQF-IEBWSBKVSA-N	0	3	341.430	3.318	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CN(C(C)C)CC[C@@H]2c2ccccc2)nc1	ZINC001087442144	1359466881	/nfs/dbraw/zinc/46/68/81/1359466881.db2.gz	UXZHSOJGERVLDC-TZIWHRDSSA-N	0	3	347.462	3.059	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccc(F)cc2)[C@H](NC(=O)CC2CCC2)C1	ZINC001087463078	1359478310	/nfs/dbraw/zinc/47/83/10/1359478310.db2.gz	PSJRLRUIXQMNNU-WOJBJXKFSA-N	0	3	342.458	3.313	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccc(F)cc2)[C@H](NC(=O)C2=CCCC2)C1	ZINC001087463820	1359478904	/nfs/dbraw/zinc/47/89/04/1359478904.db2.gz	BHRQAKBMBNIBGK-WOJBJXKFSA-N	0	3	340.442	3.233	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cnn(CC(C)C)c2CC)[C@H]1CC	ZINC001087569136	1359534563	/nfs/dbraw/zinc/53/45/63/1359534563.db2.gz	GAFOBQMLXDJGSW-PKOBYXMFSA-N	0	3	346.519	3.260	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc3c([nH]2)c(F)ccc3C)[C@H]1CC	ZINC001087632353	1359563889	/nfs/dbraw/zinc/56/38/89/1359563889.db2.gz	XMZVECHGVWMAGC-DOTOQJQBSA-N	0	3	329.419	3.384	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cnn([C@@H](C)CC)c2C)[C@H]1CC	ZINC001087790308	1359646414	/nfs/dbraw/zinc/64/64/14/1359646414.db2.gz	DUPPHJMSUHGIQC-JCGIZDLHSA-N	0	3	332.492	3.321	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)[C@H]2CCCc3sc(C)nc32)[C@H]1CC	ZINC001087794096	1359649363	/nfs/dbraw/zinc/64/93/63/1359649363.db2.gz	SMSZZPOBKSOREP-SOUVJXGZSA-N	0	3	333.501	3.027	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccc(Br)o2)[C@H]1CC	ZINC001087807848	1359657910	/nfs/dbraw/zinc/65/79/10/1359657910.db2.gz	IJHQCHBLMFXFRB-NWDGAFQWSA-N	0	3	341.249	3.201	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CCN(Cc3ncccc3C)C[C@H]2C1	ZINC001088064545	1359739988	/nfs/dbraw/zinc/73/99/88/1359739988.db2.gz	JZFANYXRIBGYPF-MSOLQXFVSA-N	0	3	341.499	3.273	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)[C@@H](OC)C2CCCC2)C1	ZINC001088419523	1359889248	/nfs/dbraw/zinc/88/92/48/1359889248.db2.gz	RVHLWVFTBNECFD-IRXDYDNUSA-N	0	3	342.911	3.305	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccn(C3CCCCC3)n2)[C@H]1C	ZINC001088566365	1359977108	/nfs/dbraw/zinc/97/71/08/1359977108.db2.gz	LHGYAEPQPJEVGN-WBVHZDCISA-N	0	3	330.476	3.157	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCN(Cc3ccc(CO)cc3)[C@@H]2C)CC1	ZINC001088838607	1360073210	/nfs/dbraw/zinc/07/32/10/1360073210.db2.gz	SFFUJCIBKCFHQZ-UZLBHIALSA-N	0	3	342.483	3.004	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cc(F)cc3cccnc32)[C@H]1C	ZINC001088896104	1360096233	/nfs/dbraw/zinc/09/62/33/1360096233.db2.gz	OTTGFDHZXFBMJQ-DYVFJYSZSA-N	0	3	327.403	3.143	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)[C@@]2(C)CCCc3ccccc32)[C@H]1C	ZINC001088920587	1360103241	/nfs/dbraw/zinc/10/32/41/1360103241.db2.gz	NCRQXXOMYXWNIT-PBEJRMEISA-N	0	3	326.484	3.436	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cc(F)c3ncccc3c2)[C@H]1C	ZINC001088926263	1360105947	/nfs/dbraw/zinc/10/59/47/1360105947.db2.gz	PRZHFRMAZBBTRZ-DYVFJYSZSA-N	0	3	327.403	3.143	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCCC[C@H]1CN(C)Cc1ccc(CF)cc1	ZINC001089139870	1360197078	/nfs/dbraw/zinc/19/70/78/1360197078.db2.gz	QDLHYKHIRIUVPR-QAPCUYQASA-N	0	3	331.435	3.129	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCCN1C(=O)C1=CCCC1	ZINC001089156535	1360212143	/nfs/dbraw/zinc/21/21/43/1360212143.db2.gz	OGJDPWPULQECKY-FQEVSTJZSA-N	0	3	337.467	3.481	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCCC[C@H]1CN(C)Cc1cccc(C#N)c1	ZINC001089230032	1360270392	/nfs/dbraw/zinc/27/03/92/1360270392.db2.gz	JFQUPLJBUKYETE-HSALFYBXSA-N	0	3	339.483	3.417	20	30		EGEDHN
CC(F)(F)C(=O)N[C@@H]1CCN(CC#Cc2ccccc2)CC(C)(C)C1	ZINC001089299306	1360318055	/nfs/dbraw/zinc/31/80/55/1360318055.db2.gz	RQRNCKBTLRIZKC-QGZVFWFLSA-N	0	3	348.437	3.300	20	30		EGEDHN
CC[C@H](CC#N)NC(=O)[C@H]1CCCN(Cc2ccc(Cl)cc2)C1	ZINC001184404278	1387450537	/nfs/dbraw/zinc/45/05/37/1387450537.db2.gz	HKQWOOJZKVKROI-DOTOQJQBSA-N	0	3	333.863	3.360	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cccc3scnc32)CC(C)(C)C1	ZINC001089384381	1360386239	/nfs/dbraw/zinc/38/62/39/1360386239.db2.gz	PWHNABPSQKCJEJ-CQSZACIVSA-N	0	3	341.480	3.150	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2cncc3ccccc32)CC(C)(C)C1	ZINC001089410149	1360408246	/nfs/dbraw/zinc/40/82/46/1360408246.db2.gz	NURMWUAPHKLJLQ-LJQANCHMSA-N	0	3	349.478	3.017	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc(F)cc3ccoc32)CC(C)(C)C1	ZINC001089425627	1360418473	/nfs/dbraw/zinc/41/84/73/1360418473.db2.gz	BSCLEILZSXCPSB-MRXNPFEDSA-N	0	3	342.414	3.426	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc(C(C)C)n2)CC(C)(C)C1	ZINC001089429686	1360421683	/nfs/dbraw/zinc/42/16/83/1360421683.db2.gz	DMIGIUUIJJHGEQ-KRWDZBQOSA-N	0	3	341.499	3.449	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@@H]2C[C@H]2c2cccc(C)c2)CC(C)(C)C1	ZINC001089513969	1360484945	/nfs/dbraw/zinc/48/49/45/1360484945.db2.gz	GVDKPHQVFLDJDS-HSALFYBXSA-N	0	3	338.495	3.339	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@@H](C)c2ccc(C)s2)CC(C)(C)C1	ZINC001089537534	1360496142	/nfs/dbraw/zinc/49/61/42/1360496142.db2.gz	NVWBIGDKQZXREG-JKSUJKDBSA-N	0	3	332.513	3.400	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@@H](C)c2ccc(C)s2)CC(C)(C)C1	ZINC001089537530	1360496148	/nfs/dbraw/zinc/49/61/48/1360496148.db2.gz	NVWBIGDKQZXREG-HOTGVXAUSA-N	0	3	332.513	3.400	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2coc(C3CCC3)n2)CC(C)(C)C1	ZINC001089537456	1360496155	/nfs/dbraw/zinc/49/61/55/1360496155.db2.gz	MTNUYMUHFCAJJV-MRXNPFEDSA-N	0	3	343.471	3.186	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2c(C)cc(C)cc2C)CC(C)(C)C1	ZINC001089556274	1360506841	/nfs/dbraw/zinc/50/68/41/1360506841.db2.gz	OSSAYLMLHHJMGJ-GOSISDBHSA-N	0	3	326.484	3.465	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(F)c3occc32)CC(C)(C)C1	ZINC001089560869	1360509171	/nfs/dbraw/zinc/50/91/71/1360509171.db2.gz	IWSIQIDAROROPF-AWEZNQCLSA-N	0	3	342.414	3.426	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@H](C)c2ccccc2C)CC(C)(C)C1	ZINC001089561704	1360509395	/nfs/dbraw/zinc/50/93/95/1360509395.db2.gz	SAAOPMNWGIJCMW-MSOLQXFVSA-N	0	3	326.484	3.339	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(=O)[nH]c(C2CC2)c1	ZINC001089651395	1360564229	/nfs/dbraw/zinc/56/42/29/1360564229.db2.gz	BSROMRMVCKWSTA-INIZCTEOSA-N	0	3	343.471	3.071	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ncn2ccc(C)cc12	ZINC001089664113	1360574432	/nfs/dbraw/zinc/57/44/32/1360574432.db2.gz	ZWQMJJJESXBFMQ-MRXNPFEDSA-N	0	3	340.471	3.049	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H]1C[C@H]1C1CCOCC1	ZINC001089667371	1360577479	/nfs/dbraw/zinc/57/74/79/1360577479.db2.gz	FCSUBLQXXMBHAY-GBESFXJTSA-N	0	3	348.531	3.232	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(C)c(C)cn1	ZINC001089675756	1360584001	/nfs/dbraw/zinc/58/40/01/1360584001.db2.gz	PDPNGJMJWKWDQY-QGZVFWFLSA-N	0	3	329.488	3.495	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ncoc1C1CC1	ZINC001089721280	1360623898	/nfs/dbraw/zinc/62/38/98/1360623898.db2.gz	GBBQEXOSLKDZRV-HNNXBMFYSA-N	0	3	331.460	3.349	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccoc1CCC	ZINC001089722114	1360624605	/nfs/dbraw/zinc/62/46/05/1360624605.db2.gz	QWYGIRKMWDUIJW-INIZCTEOSA-N	0	3	330.472	3.476	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc2c(c1)CCN2C	ZINC001089722027	1360625125	/nfs/dbraw/zinc/62/51/25/1360625125.db2.gz	PENIAOXJANSKDF-GOSISDBHSA-N	0	3	341.499	3.085	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)CC2CCCC2)C1	ZINC001089762115	1360653656	/nfs/dbraw/zinc/65/36/56/1360653656.db2.gz	CNCCJMFSXLUYDA-XSLAGTTESA-N	0	3	336.907	3.488	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1ccsc1	ZINC001089764243	1360655134	/nfs/dbraw/zinc/65/51/34/1360655134.db2.gz	NUFILPYLAOPXCX-UKMLZYKCSA-N	0	3	336.888	3.283	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](CNCc2nccs2)[C@H](C)C1	ZINC001184461777	1387466608	/nfs/dbraw/zinc/46/66/08/1387466608.db2.gz	VOOBJSAYQGRGLZ-WBVHZDCISA-N	0	3	347.528	3.486	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](CNCc2oc(C)nc2C)[C@@H](C)C1	ZINC001184471614	1387467699	/nfs/dbraw/zinc/46/76/99/1387467699.db2.gz	GBYIRTSBVWODQI-YOEHRIQHSA-N	0	3	347.503	3.468	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1cocc1C	ZINC001089846904	1360695477	/nfs/dbraw/zinc/69/54/77/1360695477.db2.gz	NPOLUNBFZHPTSA-HWMZRRJGSA-N	0	3	334.847	3.123	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](CNCc2nccs2)[C@H](C)C1	ZINC001184488704	1387470573	/nfs/dbraw/zinc/47/05/73/1387470573.db2.gz	XURGKKMBUQITHB-CABCVRRESA-N	0	3	335.517	3.320	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccccc2F)CC2(CCOCC2)C1	ZINC001089918851	1360744287	/nfs/dbraw/zinc/74/42/87/1360744287.db2.gz	YOYDYKHBLNMWQJ-INIZCTEOSA-N	0	3	346.446	3.003	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)C=C2CCCCC2)CC2(CCOCC2)C1	ZINC001089926001	1360748337	/nfs/dbraw/zinc/74/83/37/1360748337.db2.gz	BGSXXHOECQXWAT-GOSISDBHSA-N	0	3	332.488	3.050	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)[C@@H]2CCC(C)=C(C)C2)CC2(CCOCC2)C1	ZINC001089939323	1360754263	/nfs/dbraw/zinc/75/42/63/1360754263.db2.gz	PXIQQXGGQXUPAZ-RTBURBONSA-N	0	3	346.515	3.296	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)[C@@]2(C)CC=CCC2)CC2(CCOCC2)C1	ZINC001089938761	1360754574	/nfs/dbraw/zinc/75/45/74/1360754574.db2.gz	HPPCUJOGWIFNEG-ICSRJNTNSA-N	0	3	346.515	3.296	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C[C@@H]2CC=CCC2)CC2(CCOCC2)C1	ZINC001089950971	1360760301	/nfs/dbraw/zinc/76/03/01/1360760301.db2.gz	DPKCOUQKGTWPLS-RTBURBONSA-N	0	3	346.515	3.296	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc3ccc(OC)cc3[nH]2)C1	ZINC001091174239	1361000570	/nfs/dbraw/zinc/00/05/70/1361000570.db2.gz	AELKEYVAWOMVGX-UHFFFAOYSA-N	0	3	347.846	3.027	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2c(C)cccc2Cl)C1	ZINC001091217127	1361010674	/nfs/dbraw/zinc/01/06/74/1361010674.db2.gz	OBBMFCSKDFNBHL-UHFFFAOYSA-N	0	3	327.255	3.499	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(C)c(F)c2F)C1	ZINC001091248312	1361020592	/nfs/dbraw/zinc/02/05/92/1361020592.db2.gz	QIALWHVZERKILQ-UHFFFAOYSA-N	0	3	328.790	3.124	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(F)cc2Cl)C1	ZINC001091351673	1361056284	/nfs/dbraw/zinc/05/62/84/1361056284.db2.gz	DVBOPWAGFNUYNS-UHFFFAOYSA-N	0	3	331.218	3.330	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc3c(cccc3OC)[nH]2)C1	ZINC001091360861	1361060686	/nfs/dbraw/zinc/06/06/86/1361060686.db2.gz	WGUYTHHSLPMRCV-UHFFFAOYSA-N	0	3	347.846	3.027	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CN(Cc3oc(C)nc3C)C[C@@]2(C)C1	ZINC001091980994	1361265887	/nfs/dbraw/zinc/26/58/87/1361265887.db2.gz	IWQBSTACUNEBNO-AHRSYUTCSA-N	0	3	345.487	3.174	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C[C@H](C)c3ccccc3F)C[C@]2(C)C1	ZINC001092101990	1361301456	/nfs/dbraw/zinc/30/14/56/1361301456.db2.gz	RKJQYYBTBPUSJI-FVJLSDCUSA-N	0	3	342.458	3.123	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3[nH]c4ccc(C)cc4c3C)C[C@]2(C)C1	ZINC001092157835	1361314544	/nfs/dbraw/zinc/31/45/44/1361314544.db2.gz	RLYOZWARWBHNRS-VGSWGCGISA-N	0	3	349.478	3.202	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc(C(C)(C)C)cc3)C[C@]2(C)C1	ZINC001092221656	1361328841	/nfs/dbraw/zinc/32/88/41/1361328841.db2.gz	JJMXCJIASRLVLA-KNQAVFIVSA-N	0	3	338.495	3.401	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C3(C4CCCCC4)CC3)C[C@]2(C)C1	ZINC001092233394	1361334903	/nfs/dbraw/zinc/33/49/03/1361334903.db2.gz	MHVQLLINYVQGPO-QUCCMNQESA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3cc4cccc(Cl)c4o3)C[C@]2(C)C1	ZINC001092332255	1361366861	/nfs/dbraw/zinc/36/68/61/1361366861.db2.gz	HSUNKJZIWWFFRQ-KUHUBIRLSA-N	0	3	342.826	3.113	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)[C@@H](C)C2CCC2)CC1	ZINC001093373507	1361582927	/nfs/dbraw/zinc/58/29/27/1361582927.db2.gz	NTZCENCNVUZSIZ-QFBILLFUSA-N	0	3	328.500	3.149	20	30		EGEDHN
C/C(=C\C(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1)C1CC1	ZINC001093654042	1361667609	/nfs/dbraw/zinc/66/76/09/1361667609.db2.gz	UQJXLACOOBYYMQ-HMEGIPIXSA-N	0	3	337.467	3.099	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3c(C)c(F)ccc3Cl)CCC[C@@H]12	ZINC001094451019	1361806078	/nfs/dbraw/zinc/80/60/78/1361806078.db2.gz	QEDGOIVTTKLYNR-VQIMIIECSA-N	0	3	348.849	3.395	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cc(F)cc4ccoc43)CCC[C@@H]12	ZINC001094453993	1361807395	/nfs/dbraw/zinc/80/73/95/1361807395.db2.gz	JQZYSGXSVFAIPS-YLJYHZDGSA-N	0	3	340.398	3.180	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)NC[C@]12CCC[C@H]1N(CC#Cc1ccccc1)CC2	ZINC001094490313	1361827288	/nfs/dbraw/zinc/82/72/88/1361827288.db2.gz	NXRCYHLOIBZPMS-JWUVWSEFSA-N	0	3	336.479	3.055	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1C[C@H]2C[C@@H](C1)N(C(=O)CCC1CC1)C2	ZINC001094879871	1361933258	/nfs/dbraw/zinc/93/32/58/1361933258.db2.gz	MVCFTXMDEOONLB-VDGAXYAQSA-N	0	3	337.467	3.218	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cnc([C@@H](C)OC)s1)C2	ZINC001095419079	1362134178	/nfs/dbraw/zinc/13/41/78/1362134178.db2.gz	NQFZDNWMIISKFC-KBXIAJHMSA-N	0	3	349.500	3.152	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1nc(C(C)(C)C)cs1)C2	ZINC001095568354	1362171600	/nfs/dbraw/zinc/17/16/00/1362171600.db2.gz	JWLZCYMJLLMTDB-RDBSUJKOSA-N	0	3	333.501	3.352	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H]1CCc3cccc(OC)c31)C2	ZINC001096122499	1362393432	/nfs/dbraw/zinc/39/34/32/1362393432.db2.gz	COMIALBRVSITBP-BDXSIMOUSA-N	0	3	340.467	3.023	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1csc(C(C)(C)C)n1)C2	ZINC001096179234	1362417142	/nfs/dbraw/zinc/41/71/42/1362417142.db2.gz	ZAFJUAOMDQZUCG-PMPSAXMXSA-N	0	3	347.528	3.281	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cccc(N3CCCC3)c1)C2	ZINC001096231786	1362444723	/nfs/dbraw/zinc/44/47/23/1362444723.db2.gz	CDLVHJHZXXUCEU-AABGKKOBSA-N	0	3	339.483	3.198	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1oc(CCC)nc1C)C2	ZINC001096344625	1362468861	/nfs/dbraw/zinc/46/88/61/1362468861.db2.gz	DFHKGOXCKXPMEE-PMPSAXMXSA-N	0	3	331.460	3.237	20	30		EGEDHN
CCCC1(C(=O)N2CC[C@@H](NCc3ccc(C#N)c(F)c3)C2)CCC1	ZINC001185007635	1387588969	/nfs/dbraw/zinc/58/89/69/1387588969.db2.gz	WQKHRMULDYJJIL-QGZVFWFLSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](CNCc2ncc(C)s2)[C@H](C)C1	ZINC001185060136	1387603375	/nfs/dbraw/zinc/60/33/75/1387603375.db2.gz	DRVJCVYWZHJWRI-GDBMZVCRSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](CNCc2csc(C)n2)[C@@H](C)C1	ZINC001185062890	1387605147	/nfs/dbraw/zinc/60/51/47/1387605147.db2.gz	WOXFIGLRIZXVAD-GOEBONIOSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3CCc2cccs2)C1	ZINC001097809686	1363126948	/nfs/dbraw/zinc/12/69/48/1363126948.db2.gz	MOMORQAONXQXLB-OIISXLGYSA-N	0	3	330.497	3.368	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H]1C[C@H]1c1c(F)cccc1F)C2	ZINC001097810474	1363127289	/nfs/dbraw/zinc/12/72/89/1363127289.db2.gz	SXYJYZHFSMELNQ-NBZYUPRNSA-N	0	3	346.421	3.366	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H]1CCc3cccc(OC)c31)C2	ZINC001097993046	1363191351	/nfs/dbraw/zinc/19/13/51/1363191351.db2.gz	COMIALBRVSITBP-TVFCKZIOSA-N	0	3	340.467	3.023	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1oc(CC(C)C)nc1C)C2	ZINC001098003842	1363194011	/nfs/dbraw/zinc/19/40/11/1363194011.db2.gz	CXEWPXBPGBPDKH-ZACQAIPSSA-N	0	3	345.487	3.483	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)C[C@@H](NC(=O)C1(C)CC1)c1ccccc1O2	ZINC001098541694	1363363601	/nfs/dbraw/zinc/36/36/01/1363363601.db2.gz	QNVJRMCPTZDTOM-DYESRHJHSA-N	0	3	340.467	3.447	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)CC1CCCCC1)C[C@H](C)O2	ZINC001098560134	1363377096	/nfs/dbraw/zinc/37/70/96/1363377096.db2.gz	QAVJAXAUOWYMEX-KRWDZBQOSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1cccc(F)c1C)C[C@H](C)O2	ZINC001098602674	1363395325	/nfs/dbraw/zinc/39/53/25/1363395325.db2.gz	CWFQSCKLDOLAGI-HNNXBMFYSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1(C)CCCCC1)C[C@H](C)O2	ZINC001098632750	1363407866	/nfs/dbraw/zinc/40/78/66/1363407866.db2.gz	AJMXJKDCXTZCSI-KRWDZBQOSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cccc(F)c1	ZINC001098869488	1363499265	/nfs/dbraw/zinc/49/92/65/1363499265.db2.gz	WQURWECJYDOZHS-GOSISDBHSA-N	0	3	348.462	3.249	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(C)o1	ZINC001098872659	1363499868	/nfs/dbraw/zinc/49/98/68/1363499868.db2.gz	CYWXHDSUIDDMEC-MRXNPFEDSA-N	0	3	334.460	3.011	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H]1CC=CCC1	ZINC001098881339	1363503908	/nfs/dbraw/zinc/50/39/08/1363503908.db2.gz	ZJRNBTAATHRASK-QZTJIDSGSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=CCCC(=O)NC[C@@H]1CCC(C)(C)CN1CCOCC1CCC1	ZINC001098967139	1363545690	/nfs/dbraw/zinc/54/56/90/1363545690.db2.gz	YVWKUKAWHANUHY-SFHVURJKSA-N	0	3	336.520	3.376	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@@H]1CCC(C)(C)CN1C[C@H]1CC(C)(C)CO1	ZINC001099065107	1363604040	/nfs/dbraw/zinc/60/40/40/1363604040.db2.gz	MPLOREIFWZCMAO-ZWKOTPCHSA-N	0	3	348.531	3.068	20	30		EGEDHN
CC(C)CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)C#CC1CC1	ZINC001099069436	1363605829	/nfs/dbraw/zinc/60/58/29/1363605829.db2.gz	HRUCTZYVPHNHTK-IBGZPJMESA-N	0	3	348.531	3.069	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cnc3ccc(F)cc3c2)C1	ZINC001099107773	1363627024	/nfs/dbraw/zinc/62/70/24/1363627024.db2.gz	ZAXUXGUAORWTKZ-JXFKEZNVSA-N	0	3	339.414	3.144	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cnn(CCC(C)C)c2C)C1	ZINC001099111686	1363629295	/nfs/dbraw/zinc/62/92/95/1363629295.db2.gz	MIICAPZJGHUGMR-PXNSSMCTSA-N	0	3	344.503	3.008	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)Cc1sc(C)nc1C	ZINC001099145526	1363654187	/nfs/dbraw/zinc/65/41/87/1363654187.db2.gz	YFSSOQXUHZCAFZ-MRXNPFEDSA-N	0	3	349.544	3.485	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H](C)c2ccc(F)cc2F)C1	ZINC001099170544	1363668429	/nfs/dbraw/zinc/66/84/29/1363668429.db2.gz	GXJJUIKEKUTKTE-AVYPCKFXSA-N	0	3	346.421	3.062	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H]1CCC(C)(C)CN1CCn1cccn1	ZINC001099171457	1363669191	/nfs/dbraw/zinc/66/91/91/1363669191.db2.gz	QAOYAFZPZRMUJZ-KRWDZBQOSA-N	0	3	346.519	3.092	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)Cc1ccc(F)c(F)c1	ZINC001099198870	1363687509	/nfs/dbraw/zinc/68/75/09/1363687509.db2.gz	GWJUASMPLWSZQB-OAHLLOKOSA-N	0	3	336.426	3.300	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H]2CCC(C)(C)CN2CCOCC)CCC1	ZINC001099225468	1363700946	/nfs/dbraw/zinc/70/09/46/1363700946.db2.gz	VYASUZAIEKLJRL-KRWDZBQOSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)Cc1cc(F)ccc1OC	ZINC001099281329	1363729978	/nfs/dbraw/zinc/72/99/78/1363729978.db2.gz	SNMCTUHXKQFISU-QGZVFWFLSA-N	0	3	348.462	3.170	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@H](C)CC(C)C	ZINC001099291303	1363734270	/nfs/dbraw/zinc/73/42/70/1363734270.db2.gz	GUYXUDPRPMSIHW-MSOLQXFVSA-N	0	3	338.536	3.478	20	30		EGEDHN
C=CCCC[N@@H+]1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1ccccc1[O-]	ZINC001099400633	1363787240	/nfs/dbraw/zinc/78/72/40/1363787240.db2.gz	FXAFPTMNMZVHOP-AITUJVMLSA-N	0	3	340.467	3.141	20	30		EGEDHN
C=CCCC[N@H+]1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1ccccc1[O-]	ZINC001099400633	1363787242	/nfs/dbraw/zinc/78/72/42/1363787242.db2.gz	FXAFPTMNMZVHOP-AITUJVMLSA-N	0	3	340.467	3.141	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H]3CCC[C@]3(CNCc3cnc(C)o3)C2)C1	ZINC001099494087	1363820491	/nfs/dbraw/zinc/82/04/91/1363820491.db2.gz	UFZIMWHVJZIXBS-JXFKEZNVSA-N	0	3	343.471	3.058	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)[C@@H](CC)CCCC)CC2(CCOCC2)C1	ZINC001099566526	1363852814	/nfs/dbraw/zinc/85/28/14/1363852814.db2.gz	QVTICPDCHWNHKM-ZWKOTPCHSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CC[C@H](C)CC)CC2(CCOCC2)C1	ZINC001099595171	1363877744	/nfs/dbraw/zinc/87/77/44/1363877744.db2.gz	UXENTWFOAAMFHO-MSOLQXFVSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CCN(Cc2ccc(C(C)(C)C)cc2)C[C@H]1O	ZINC001099728467	1363927574	/nfs/dbraw/zinc/92/75/74/1363927574.db2.gz	XIIRQJOHYCGSRB-RTBURBONSA-N	0	3	344.499	3.002	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CCN(Cc2ccc(C(C)(C)C)cc2)C[C@@H]1O	ZINC001099728461	1363927600	/nfs/dbraw/zinc/92/76/00/1363927600.db2.gz	XIIRQJOHYCGSRB-MOPGFXCFSA-N	0	3	344.499	3.002	20	30		EGEDHN
CCCCCCCCC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1O	ZINC001100085462	1364012175	/nfs/dbraw/zinc/01/21/75/1364012175.db2.gz	LRELGHFIENOTDR-UXHICEINSA-N	0	3	346.515	3.489	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)C[C@@H](C)CCC)C1	ZINC001100175885	1364036237	/nfs/dbraw/zinc/03/62/37/1364036237.db2.gz	UDUKTEVXDUZWJG-XGNXJENSSA-N	0	3	331.298	3.206	20	30		EGEDHN
C#CCCCCC(=O)NCC1CC(NCc2cc(F)ccc2F)C1	ZINC001100259732	1364060860	/nfs/dbraw/zinc/06/08/60/1364060860.db2.gz	SRXCESIZMPKEHE-UHFFFAOYSA-N	0	3	334.410	3.143	20	30		EGEDHN
Cc1ccc(CNC2CC(CNC(=O)C#CC3CC3)C2)c(Cl)c1	ZINC001100315002	1364077916	/nfs/dbraw/zinc/07/79/16/1364077916.db2.gz	OYNJZEKGKVCIMH-UHFFFAOYSA-N	0	3	330.859	3.046	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C/C=C/c2cccc(F)c2)C1	ZINC001100417110	1364107884	/nfs/dbraw/zinc/10/78/84/1364107884.db2.gz	DXEYKXCBRVVWAM-HWKANZROSA-N	0	3	336.838	3.466	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C/C=C\Cc2ccccc2)C1	ZINC001100420591	1364108390	/nfs/dbraw/zinc/10/83/90/1364108390.db2.gz	NXANENREEYTAHI-WAYWQWQTSA-N	0	3	332.875	3.412	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C[C@@H](C)c2c(C)noc2C)C1	ZINC001100458298	1364120963	/nfs/dbraw/zinc/12/09/63/1364120963.db2.gz	VWCOCPMHNFPFMN-SFNBMPIDSA-N	0	3	339.867	3.022	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)CCc2ccc(C)cc2C)C1	ZINC001100547026	1364156215	/nfs/dbraw/zinc/15/62/15/1364156215.db2.gz	DWYDKQOSHXVOGJ-UHFFFAOYSA-N	0	3	334.891	3.473	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)C(C)(C)C(C)(C)C)C1	ZINC001100570307	1364167544	/nfs/dbraw/zinc/16/75/44/1364167544.db2.gz	MWDJCRRJTAUPMQ-UHFFFAOYSA-N	0	3	345.325	3.452	20	30		EGEDHN
C=C/C(C)=C/CC(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1	ZINC001100583094	1364173989	/nfs/dbraw/zinc/17/39/89/1364173989.db2.gz	KQGJXAVXKQDUPE-LNKIKWGQSA-N	0	3	341.430	3.204	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCC1CC(NCc2ccncc2Cl)C1	ZINC001100587034	1364175799	/nfs/dbraw/zinc/17/57/99/1364175799.db2.gz	GORPBJDBQPZJJX-VQCLRJIVSA-N	0	3	335.879	3.322	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)Cc2ccc(Cl)s2)C1	ZINC001100741019	1364243430	/nfs/dbraw/zinc/24/34/30/1364243430.db2.gz	DDMQJHCPMWWAOS-UHFFFAOYSA-N	0	3	333.284	3.181	20	30		EGEDHN
C=C[C@H](CC(=O)NCC1CC(NCc2ccccn2)C1)c1ccccc1	ZINC001101013819	1364372724	/nfs/dbraw/zinc/37/27/24/1364372724.db2.gz	MGTCXJXXOOUWGZ-IDYZSHNDSA-N	0	3	349.478	3.426	20	30		EGEDHN
C=C[C@H](C(=O)NCC1CC(NCc2ncccc2C)C1)c1ccccc1	ZINC001101016742	1364375507	/nfs/dbraw/zinc/37/55/07/1364375507.db2.gz	CRAQXHWKPJIVRB-UUKMXZOPSA-N	0	3	349.478	3.344	20	30		EGEDHN
C=C(C)CN1CC[C@H](Oc2ccnc(CNC(=O)C(C)(C)CC)c2)C1	ZINC001101096816	1364412191	/nfs/dbraw/zinc/41/21/91/1364412191.db2.gz	BWQLIYYLUGYKBB-SFHVURJKSA-N	0	3	345.487	3.163	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@H]2CN([C@H](C)c3ccc(F)cc3)C[C@@]2(C)C1	ZINC001101230735	1364476268	/nfs/dbraw/zinc/47/62/68/1364476268.db2.gz	HOWUQYKLCYSJGA-BLIXFSHQSA-N	0	3	342.458	3.326	20	30		EGEDHN
CC[C@@H](C)CCCCC(=O)N1C[C@H]2CN(CC#CCOC)C[C@@]2(C)C1	ZINC001101249718	1364485587	/nfs/dbraw/zinc/48/55/87/1364485587.db2.gz	JRZNDUDHOMOQGW-SBHAEUEKSA-N	0	3	348.531	3.023	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)CCCCc3ccccc3)C[C@]2(C)C1	ZINC001101347802	1364520494	/nfs/dbraw/zinc/52/04/94/1364520494.db2.gz	JMNDMGAYWAXBEP-IRLDBZIGSA-N	0	3	338.495	3.203	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC2(CN(CCCC(C)(C)C)C2)n2ccnc21	ZINC001101615405	1364656865	/nfs/dbraw/zinc/65/68/65/1364656865.db2.gz	JLLVEPPIIGIKAT-INIZCTEOSA-N	0	3	344.503	3.248	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC2(CN(CC3CCCCC3)C2)n2ccnc21	ZINC001101615306	1364656895	/nfs/dbraw/zinc/65/68/95/1364656895.db2.gz	GGCVXHUQOUUZIY-QGZVFWFLSA-N	0	3	342.487	3.002	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1CC2(CN(CC(CC)CC)C2)n2ccnc21	ZINC001101630982	1364662145	/nfs/dbraw/zinc/66/21/45/1364662145.db2.gz	PSTSGDJRXHVFJW-KRWDZBQOSA-N	0	3	344.503	3.248	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@H]1CC2(CN(CCC(C)C)C2)n2ccnc21	ZINC001101638045	1364664810	/nfs/dbraw/zinc/66/48/10/1364664810.db2.gz	UDMKGUUZEKQMHP-SJORKVTESA-N	0	3	344.503	3.103	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1CC2(CN(C[C@@H](C)CC)C2)n2ccnc21	ZINC001101646675	1364669548	/nfs/dbraw/zinc/66/95/48/1364669548.db2.gz	UKLMRSUNWFFSAG-HOTGVXAUSA-N	0	3	344.503	3.103	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1CNC(=O)CC(C)(C)C	ZINC001101725371	1364704218	/nfs/dbraw/zinc/70/42/18/1364704218.db2.gz	RXMNSNRJHLAVGW-RHSMWYFYSA-N	0	3	345.462	3.318	20	30		EGEDHN
CCC[C@@H](C)C(=O)NC[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1C	ZINC001101828565	1364741602	/nfs/dbraw/zinc/74/16/02/1364741602.db2.gz	CCZKXANURCYDIG-IIDMSEBBSA-N	0	3	345.462	3.318	20	30		EGEDHN
C[C@@H]1CN(Cc2cccc(F)c2)C[C@H]1CNC(=O)C#CC(C)(C)C	ZINC001101955056	1364789800	/nfs/dbraw/zinc/78/98/00/1364789800.db2.gz	QJXRDUGMXPOAGN-NVXWUHKLSA-N	0	3	330.447	3.059	20	30		EGEDHN
C=CCCOCCCCC(=O)NC[C@@H]1CN(C/C=C/Cl)C[C@H]1C	ZINC001101969139	1364793708	/nfs/dbraw/zinc/79/37/08/1364793708.db2.gz	HZMBLPBXOHWCDF-ISIQUDIPSA-N	0	3	342.911	3.186	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2cccc(Cl)c2)C[C@H]1CNC(=O)C1(C)CC1	ZINC001101989191	1364801232	/nfs/dbraw/zinc/80/12/32/1364801232.db2.gz	LVQJVJCMUZOYFN-NVXWUHKLSA-N	0	3	344.886	3.176	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H]1CN(Cc2conc2CC)C[C@H]1C	ZINC001102219806	1364941077	/nfs/dbraw/zinc/94/10/77/1364941077.db2.gz	WZEDPZBRQSXQFF-HUUCEWRRSA-N	0	3	333.476	3.023	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CNC(=O)CCCC1CC1	ZINC001102254298	1364968459	/nfs/dbraw/zinc/96/84/59/1364968459.db2.gz	VCKUHHLAHCVOGK-GDBMZVCRSA-N	0	3	345.512	3.384	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@@H]1CN(Cc2conc2CC)C[C@H]1C	ZINC001102410079	1365042929	/nfs/dbraw/zinc/04/29/29/1365042929.db2.gz	JEDIEPQCOJXSID-HUUCEWRRSA-N	0	3	333.476	3.023	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](NCc3cc(F)cc(F)c3)C2)CC1	ZINC001185438751	1387717593	/nfs/dbraw/zinc/71/75/93/1387717593.db2.gz	FOEKVZAZJPCTAT-QGZVFWFLSA-N	0	3	334.410	3.402	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](NCc3c(C)nsc3C)C2)CC1	ZINC001185439171	1387717616	/nfs/dbraw/zinc/71/76/16/1387717616.db2.gz	NUQCWLMWQHJTDD-OAHLLOKOSA-N	0	3	333.501	3.197	20	30		EGEDHN
CC(C)CC(=O)NCC[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1C	ZINC001102642667	1365150223	/nfs/dbraw/zinc/15/02/23/1365150223.db2.gz	LKODLOHQXJQDFS-CRAIPNDOSA-N	0	3	345.462	3.318	20	30		EGEDHN
CC[C@@H](C)C(=O)NCC[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1C	ZINC001102678097	1365166614	/nfs/dbraw/zinc/16/66/14/1365166614.db2.gz	NWKHLGPDBUTGOW-ZHALLVOQSA-N	0	3	344.474	3.298	20	30		EGEDHN
C[C@H](C(=O)NCC[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1C)C1CC1	ZINC001102826577	1365240016	/nfs/dbraw/zinc/24/00/16/1365240016.db2.gz	QTXXHWDOXSABLA-JTDSTZFVSA-N	0	3	339.483	3.179	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cncc3[nH]ccc32)C1	ZINC001103190515	1365427848	/nfs/dbraw/zinc/42/78/48/1365427848.db2.gz	GEFKYEYXJVJIRP-TZMCWYRMSA-N	0	3	346.862	3.003	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCC[C@@H]1CN(Cc2cncc(F)c2)C[C@H]1C	ZINC001103346240	1365510983	/nfs/dbraw/zinc/51/09/83/1365510983.db2.gz	HAACJONFDRXANW-SOLBZPMBSA-N	0	3	347.478	3.397	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC[C@@H]1CN(Cc2cncs2)C[C@H]1C	ZINC001103402004	1365537841	/nfs/dbraw/zinc/53/78/41/1365537841.db2.gz	XDCMSYWUXDOINW-IIDMSEBBSA-N	0	3	335.517	3.320	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cc3ccccn3c2)C1	ZINC001103492339	1365594773	/nfs/dbraw/zinc/59/47/73/1365594773.db2.gz	STJQDSCKAGGLBQ-GDBMZVCRSA-N	0	3	345.874	3.380	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1CCNC(=O)C(C)(C)C	ZINC001103667733	1365715410	/nfs/dbraw/zinc/71/54/10/1365715410.db2.gz	MDJXIPIAYBNNIR-SJLPKXTDSA-N	0	3	344.474	3.298	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)CCCOC(C)C)C1	ZINC001103776946	1365779602	/nfs/dbraw/zinc/77/96/02/1365779602.db2.gz	YHBFLTARISOBGN-GDBMZVCRSA-N	0	3	330.900	3.018	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@H](CCNCc2cnc(Cl)s2)C1	ZINC001103979454	1365857913	/nfs/dbraw/zinc/85/79/13/1365857913.db2.gz	RAVLXYKFJKQHCQ-CHWSQXEVSA-N	0	3	341.908	3.337	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cc3ncccc3o2)C[C@H]1C	ZINC001104427839	1366023133	/nfs/dbraw/zinc/02/31/33/1366023133.db2.gz	UDJMWNGDHSCNMK-TZMCWYRMSA-N	0	3	347.846	3.268	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cccc3[nH]ncc32)C[C@H]1C	ZINC001104473367	1366041936	/nfs/dbraw/zinc/04/19/36/1366041936.db2.gz	GKARYNNDWPVRJU-TZMCWYRMSA-N	0	3	346.862	3.003	20	30		EGEDHN
CC[C@H](F)C(=O)N1C[C@@H](C)[C@H](CCNCc2cc(C#N)ccc2F)C1	ZINC001104500608	1366051118	/nfs/dbraw/zinc/05/11/18/1366051118.db2.gz	XGUNQLGTRCFIPF-UNEWFSDZSA-N	0	3	349.425	3.020	20	30		EGEDHN
CC#CCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2ncc(C)s2)C1	ZINC001104553201	1366072723	/nfs/dbraw/zinc/07/27/23/1366072723.db2.gz	VZHKTMPATOXYQK-NVXWUHKLSA-N	0	3	347.528	3.219	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H](C)[C@H](CCNCc2c(C)noc2C)C1	ZINC001104631440	1366110191	/nfs/dbraw/zinc/11/01/91/1366110191.db2.gz	NKXLOSXLTJTWCD-WIBUTAKZSA-N	0	3	347.503	3.468	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)C(C)(C)C(C)(F)F)C[C@H]1C	ZINC001104955105	1366240842	/nfs/dbraw/zinc/24/08/42/1366240842.db2.gz	JUVFMPPXXLDGIL-DGCLKSJQSA-N	0	3	336.854	3.495	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cc(C)n(C)c2C)C[C@H]1C	ZINC001104993231	1366262169	/nfs/dbraw/zinc/26/21/69/1366262169.db2.gz	OJIADPUKLQJGCB-MLGOLLRUSA-N	0	3	337.895	3.082	20	30		EGEDHN
CC(C)CCCC(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001185834008	1387810054	/nfs/dbraw/zinc/81/00/54/1387810054.db2.gz	PDNHBTDPFXXWOC-QGZVFWFLSA-N	0	3	331.435	3.214	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C[C@@H](C)C(C)C)CC1	ZINC001105388929	1366435883	/nfs/dbraw/zinc/43/58/83/1366435883.db2.gz	FIPNEKHFFHQHIR-YLJYHZDGSA-N	0	3	330.516	3.395	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@H]1C[C@@](CNCCF)(c2ccccc2)C1	ZINC001105436895	1366467680	/nfs/dbraw/zinc/46/76/80/1366467680.db2.gz	MTHCHGFZYHCRTD-YSIASYRMSA-N	0	3	332.463	3.364	20	30		EGEDHN
CC(C)CCC(=O)N1C[C@@H](CNCc2cc(F)ccc2C#N)[C@H](C)C1	ZINC001105807606	1366592379	/nfs/dbraw/zinc/59/23/79/1366592379.db2.gz	ZKLQIZAQCVIGRT-CRAIPNDOSA-N	0	3	345.462	3.318	20	30		EGEDHN
CC(C)=C(C)CC(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001106537568	1366726593	/nfs/dbraw/zinc/72/65/93/1366726593.db2.gz	WSDWSQIIKYRNCF-YLJYHZDGSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=CCCC(=O)NC[C@]12CCC[C@H]1N(Cc1c(C)noc1C)CC2	ZINC001107319148	1366925963	/nfs/dbraw/zinc/92/59/63/1366925963.db2.gz	GMLKULRJSVBNGK-IEBWSBKVSA-N	0	3	331.460	3.118	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2C[C@H]1CC(C)(C)CO1	ZINC001109328906	1367054863	/nfs/dbraw/zinc/05/48/63/1367054863.db2.gz	GBDMDBMDDQELOP-YRXWBPOGSA-N	0	3	346.515	3.291	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCOc1c(C)cccc1C)C2	ZINC001109372733	1367091141	/nfs/dbraw/zinc/09/11/41/1367091141.db2.gz	NKEHKMPGHKFWHV-QYZOEREBSA-N	0	3	342.483	3.370	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](N(C)Cc2ccc(COC)cc2)C1	ZINC001189744688	1367100395	/nfs/dbraw/zinc/10/03/95/1367100395.db2.gz	XMFKHQWBIIQIOT-FQEVSTJZSA-N	0	3	342.483	3.059	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](N(C)CCOC2CCCCCC2)C1	ZINC001189751778	1367102607	/nfs/dbraw/zinc/10/26/07/1367102607.db2.gz	JPWAFWDPUGACHI-IBGZPJMESA-N	0	3	348.531	3.452	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1c(C)noc1C(C)C)C2	ZINC001109422754	1367114726	/nfs/dbraw/zinc/11/47/26/1367114726.db2.gz	HTKLBIQTGOSTHB-PMPSAXMXSA-N	0	3	331.460	3.408	20	30		EGEDHN
CCCC[C@@H](C)C(=O)N1CC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001189972176	1367143216	/nfs/dbraw/zinc/14/32/16/1367143216.db2.gz	FYBWAZSVQOJLNO-APWZRJJASA-N	0	3	327.472	3.417	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@H](N(C)Cc2cccc(OC(C)C)c2)C1	ZINC001190046818	1367160793	/nfs/dbraw/zinc/16/07/93/1367160793.db2.gz	LYQILYMBQAHBPO-IBGZPJMESA-N	0	3	342.483	3.166	20	30		EGEDHN
C[C@@H](c1ccc(F)cc1)N(C)[C@H]1CCN(C(=O)C#CC(C)(C)C)C1	ZINC001190085281	1367169675	/nfs/dbraw/zinc/16/96/75/1367169675.db2.gz	WJLHTHLLRLPRBT-YJBOKZPZSA-N	0	3	330.447	3.469	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001190353927	1367236010	/nfs/dbraw/zinc/23/60/10/1367236010.db2.gz	DSWDXXVNIMYADE-HXUWFJFHSA-N	0	3	337.467	3.359	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](N(C)Cc2ccc(COC)cc2)C1	ZINC001190428664	1367262554	/nfs/dbraw/zinc/26/25/54/1367262554.db2.gz	NAKNKMZKXKDIBR-IBGZPJMESA-N	0	3	330.472	3.222	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](C)c1cccc(C)c1)C2	ZINC001109766085	1367310538	/nfs/dbraw/zinc/31/05/38/1367310538.db2.gz	PCXBZNVMADDHAQ-LMCOJAPRSA-N	0	3	342.483	3.023	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2cc(C)ccc2F)C1	ZINC001108241587	1367356514	/nfs/dbraw/zinc/35/65/14/1367356514.db2.gz	FGGBIRJTHGGUFU-OXJNMPFZSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2ccc(CC)cc2)C1	ZINC001108374389	1367422272	/nfs/dbraw/zinc/42/22/72/1367422272.db2.gz	KUIUYGFDUIPSCW-LAUBAEHRSA-N	0	3	344.499	3.424	20	30		EGEDHN
C=CCCC(=O)N1CCC([C@H]2OCCC[C@H]2NCC(=C)Cl)CC1	ZINC001186122555	1387874030	/nfs/dbraw/zinc/87/40/30/1387874030.db2.gz	CAPUHFANAZMVLP-SJLPKXTDSA-N	0	3	340.895	3.081	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](c1ccc(F)cc1)C(C)C)C2	ZINC001110171797	1367542639	/nfs/dbraw/zinc/54/26/39/1367542639.db2.gz	UTZQFCBEJUVWQE-FYQPLNBISA-N	0	3	342.458	3.310	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](N(C)CCOCc2ccccc2)C1	ZINC001191684664	1367560299	/nfs/dbraw/zinc/56/02/99/1367560299.db2.gz	TUNLUNRAKVAKTE-IBGZPJMESA-N	0	3	344.499	3.338	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](C)CCOc1ccccc1)C2	ZINC001110206185	1367562821	/nfs/dbraw/zinc/56/28/21/1367562821.db2.gz	CMCXTLAHFHAXKI-JYBIWHBTSA-N	0	3	342.483	3.389	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](N(C)Cc2ccc(OC)cc2)C1	ZINC001191754150	1367576969	/nfs/dbraw/zinc/57/69/69/1367576969.db2.gz	MEEYJHHTAJARLE-IBGZPJMESA-N	0	3	342.483	3.312	20	30		EGEDHN
CC(C)=C(C)CC(=O)N1CC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001191763259	1367580709	/nfs/dbraw/zinc/58/07/09/1367580709.db2.gz	KGZAAJLOPSRBMG-LJQANCHMSA-N	0	3	325.456	3.337	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](N(C)C[C@H](OC)c2ccccc2)C1	ZINC001191859912	1367616268	/nfs/dbraw/zinc/61/62/68/1367616268.db2.gz	SVJUNGXXMLDFGR-PMACEKPBSA-N	0	3	342.483	3.100	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](N(C)Cc2ccc(OC)c(C)c2)C1	ZINC001191868339	1367622534	/nfs/dbraw/zinc/62/25/34/1367622534.db2.gz	RUYGCMRRRMJKHD-LJQANCHMSA-N	0	3	342.483	3.230	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](N(C)C[C@@H](O)c2ccc(CC)cc2)C1	ZINC001192093942	1367685649	/nfs/dbraw/zinc/68/56/49/1367685649.db2.gz	OKJJNTOHWBEKTM-VQTJNVASSA-N	0	3	344.499	3.171	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](N(C)CCOc2ccc(C)cc2)C1	ZINC001192093932	1367686097	/nfs/dbraw/zinc/68/60/97/1367686097.db2.gz	OERWUYOMBCRNQZ-GOSISDBHSA-N	0	3	330.472	3.263	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](N(C)C[C@H](O)c2ccc(CC)cc2)C1	ZINC001192093941	1367686234	/nfs/dbraw/zinc/68/62/34/1367686234.db2.gz	OKJJNTOHWBEKTM-UXHICEINSA-N	0	3	344.499	3.171	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@H](N(C)C[C@H]3CC(C)(C)CO3)C2)CC1	ZINC001192217699	1367720832	/nfs/dbraw/zinc/72/08/32/1367720832.db2.gz	HYFVAGOFHIXAMF-DLBZAZTESA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](N(C)CCc2scnc2C)C1	ZINC001192587051	1367827015	/nfs/dbraw/zinc/82/70/15/1367827015.db2.gz	ZAXONDBAMRQDDK-OAHLLOKOSA-N	0	3	335.517	3.129	20	30		EGEDHN
CC[C@H](C)CCC(=O)N1CC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001193017699	1367923865	/nfs/dbraw/zinc/92/38/65/1367923865.db2.gz	PAEZRSXMISRKLJ-LPHOPBHVSA-N	0	3	327.472	3.417	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)[C@@H](F)CCCCCC)C1	ZINC001193479403	1368042563	/nfs/dbraw/zinc/04/25/63/1368042563.db2.gz	VAGUDRBTLWBUIH-SJORKVTESA-N	0	3	328.472	3.030	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCc1ccc(Cl)cc1)C2	ZINC001110869654	1368048003	/nfs/dbraw/zinc/04/80/03/1368048003.db2.gz	GTQAHMOADIEKIU-KURKYZTESA-N	0	3	330.859	3.017	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2C[C@H]1CC(C)(C)CO1	ZINC001110900465	1368074332	/nfs/dbraw/zinc/07/43/32/1368074332.db2.gz	AZZGSJVSSSKPNG-MKXGPGLRSA-N	0	3	346.515	3.107	20	30		EGEDHN
C=CCC[C@H](C)N1[C@@H]2CC[C@H]1[C@H](NC(=O)c1nc(Cl)cs1)C2	ZINC001110940852	1368109808	/nfs/dbraw/zinc/10/98/08/1368109808.db2.gz	DSHGPNCGVCLXAP-LOWDOPEQSA-N	0	3	339.892	3.486	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](c1ccncc1)C(C)C)C2	ZINC001110946838	1368113835	/nfs/dbraw/zinc/11/38/35/1368113835.db2.gz	YETFXZNSJHJMQO-YRXWBPOGSA-N	0	3	327.472	3.119	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3C[C@H]2CC(C)(C)CO2)CCC1	ZINC001110987667	1368134958	/nfs/dbraw/zinc/13/49/58/1368134958.db2.gz	ZKNROXARZIZNNY-TVFCKZIOSA-N	0	3	346.515	3.269	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1oc(C3CC3)nc1C)C2	ZINC001111119941	1368161755	/nfs/dbraw/zinc/16/17/55/1368161755.db2.gz	LKCKXQMOFICARH-OAGGEKHMSA-N	0	3	329.444	3.162	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)C[C@@H](C=C)c2ccccc2)C1	ZINC001194200935	1368207585	/nfs/dbraw/zinc/20/75/85/1368207585.db2.gz	QENUQARDKMZXMI-UYAOXDASSA-N	0	3	342.483	3.082	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2sccc2C(C)C)C1	ZINC001194218390	1368210583	/nfs/dbraw/zinc/21/05/83/1368210583.db2.gz	QRUIWBQRCHSAEV-OAHLLOKOSA-N	0	3	336.501	3.220	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](N(C)C[C@H]3CCCCO3)C2)CCCC1	ZINC001194568558	1368288776	/nfs/dbraw/zinc/28/87/76/1368288776.db2.gz	UGLKEOKRKQRDJV-ZWKOTPCHSA-N	0	3	334.504	3.225	20	30		EGEDHN
N#Cc1cccc([C@H](O)CN2CC[C@H](Oc3ccc(Cl)cc3)C2)c1	ZINC001194633357	1368299740	/nfs/dbraw/zinc/29/97/40/1368299740.db2.gz	RYMQPPHADQDTFV-RBUKOAKNSA-N	0	3	342.826	3.398	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccc(C)cc1C	ZINC001111488839	1368320350	/nfs/dbraw/zinc/32/03/50/1368320350.db2.gz	WXPVUCDVMURUNH-AFYVEPGGSA-N	0	3	342.483	3.116	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1cc(C)ccc1C	ZINC001111488466	1368320461	/nfs/dbraw/zinc/32/04/61/1368320461.db2.gz	KYXZBBUPPIORQM-AFYVEPGGSA-N	0	3	342.483	3.116	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCc1cccc(F)c1F)C2	ZINC001111512359	1368323955	/nfs/dbraw/zinc/32/39/55/1368323955.db2.gz	HTZIUMAZMHAIMG-OIISXLGYSA-N	0	3	334.410	3.195	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3CCOC(C)C)CCCC1	ZINC001111522864	1368324738	/nfs/dbraw/zinc/32/47/38/1368324738.db2.gz	LXQYHRFWGJUTLK-KURKYZTESA-N	0	3	334.504	3.269	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)C[C@H](NC(=O)CCCF)c1ccccc1O2	ZINC001111531642	1368331194	/nfs/dbraw/zinc/33/11/94/1368331194.db2.gz	GHOJZCNGKADYER-FXAWDEMLSA-N	0	3	346.446	3.397	20	30		EGEDHN
CC[C@H](C)C(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(C#N)cc1)C2	ZINC001111592740	1368357421	/nfs/dbraw/zinc/35/74/21/1368357421.db2.gz	WHRHRUJONDTNCJ-QSFXBCCZSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC/C=C(\C)C(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(C#N)cc1)C2	ZINC001111632731	1368395135	/nfs/dbraw/zinc/39/51/35/1368395135.db2.gz	XOVLSKKAFVPZLV-DCUAIRSBSA-N	0	3	337.467	3.385	20	30		EGEDHN
C=CCCC(=O)N[C@]12CCC[C@H]1CN(CCOc1ccc(F)cc1)C2	ZINC001111648667	1368411618	/nfs/dbraw/zinc/41/16/18/1368411618.db2.gz	IQOCESKKAHBVCJ-JXFKEZNVSA-N	0	3	346.446	3.141	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CN([C@H](C)c2cc(C)ccc2C)C[C@H]1O	ZINC001195277509	1368413006	/nfs/dbraw/zinc/41/30/06/1368413006.db2.gz	GJVJBQOLKDMYOZ-BHIYHBOVSA-N	0	3	344.499	3.128	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)OC(C)(C)C)CN1CCOc1ccccc1C#N	ZINC001195288315	1368414615	/nfs/dbraw/zinc/41/46/15/1368414615.db2.gz	FJYPKLUVXNRFQB-RDJZCZTQSA-N	0	3	344.455	3.379	20	30		EGEDHN
C#CCCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1ccsc1)C2	ZINC001111714654	1368428699	/nfs/dbraw/zinc/42/86/99/1368428699.db2.gz	KLRVZWZAPQBPHY-HKUYNNGSSA-N	0	3	330.497	3.412	20	30		EGEDHN
CC(C)C#CC(=O)N1CCCN(CCCCc2ccccc2)CC1	ZINC001195775183	1368488002	/nfs/dbraw/zinc/48/80/02/1368488002.db2.gz	PUXQSXISTSERAQ-UHFFFAOYSA-N	0	3	326.484	3.203	20	30		EGEDHN
C=CCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1cccc(C#N)c1)C2	ZINC001111855607	1368507958	/nfs/dbraw/zinc/50/79/58/1368507958.db2.gz	DMZIRPUIRDARBW-FPOVZHCZSA-N	0	3	337.467	3.385	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2c(F)c(F)cc(F)c2F)CC1	ZINC001195908061	1368514790	/nfs/dbraw/zinc/51/47/90/1368514790.db2.gz	RQHRELQGLKDGGE-UHFFFAOYSA-N	0	3	344.352	3.357	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2ccn(C(F)F)n2)CC1	ZINC001195957563	1368522712	/nfs/dbraw/zinc/52/27/12/1368522712.db2.gz	CDTKXLBZTAMHMZ-UHFFFAOYSA-N	0	3	340.418	3.173	20	30		EGEDHN
C#CCC1(C(=O)N2CCCN([C@@H]3CCc4ccccc43)CC2)CCC1	ZINC001196139343	1368556178	/nfs/dbraw/zinc/55/61/78/1368556178.db2.gz	WJOLZDGCQBSFRX-HXUWFJFHSA-N	0	3	336.479	3.402	20	30		EGEDHN
C#CCC1(C(=O)N2CCCN([C@H]3CCc4ccccc43)CC2)CCC1	ZINC001196139341	1368556649	/nfs/dbraw/zinc/55/66/49/1368556649.db2.gz	WJOLZDGCQBSFRX-FQEVSTJZSA-N	0	3	336.479	3.402	20	30		EGEDHN
C=CCCCN1C[C@@H](O)[C@H](NC(=O)C[C@H](CC)c2ccc(C)cc2)C1	ZINC001196161239	1368559940	/nfs/dbraw/zinc/55/99/40/1368559940.db2.gz	MXFVWSOQHJSTRB-DFQSSKMNSA-N	0	3	344.499	3.006	20	30		EGEDHN
C=CCC[C@@H](C)N1CCCN(C(=O)c2cc(C(F)(F)F)no2)CC1	ZINC001196223579	1368570955	/nfs/dbraw/zinc/57/09/55/1368570955.db2.gz	YQDSORFNBLIQFV-GFCCVEGCSA-N	0	3	345.365	3.196	20	30		EGEDHN
N#Cc1ccccc1NC(=S)N1CCN(CC2CCCC2)CC1	ZINC001196309493	1368586470	/nfs/dbraw/zinc/58/64/70/1368586470.db2.gz	BRDBLYBHKIGUGN-UHFFFAOYSA-N	0	3	328.485	3.063	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)C[C@H](C)c2ccc(F)cc2)C1	ZINC001112001191	1368605455	/nfs/dbraw/zinc/60/54/55/1368605455.db2.gz	LVRBHVIIHGERKW-MDKPJZGXSA-N	0	3	342.458	3.313	20	30		EGEDHN
C=CCC[C@H](C)N1CCCN(C(=O)c2cc(COC)cs2)CC1	ZINC001196423477	1368612906	/nfs/dbraw/zinc/61/29/06/1368612906.db2.gz	LOMBVEHTABYSCI-HNNXBMFYSA-N	0	3	336.501	3.397	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@@](C)(F)CCCC)C[C@H]1C(F)(F)F	ZINC001112124474	1368670828	/nfs/dbraw/zinc/67/08/28/1368670828.db2.gz	JXPBKBLXKAZYEJ-NFAWXSAZSA-N	0	3	338.389	3.460	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)CC2(C)CCCCC2)C[C@H]1C(F)(F)F	ZINC001112129347	1368674161	/nfs/dbraw/zinc/67/41/61/1368674161.db2.gz	FWYUJYRRJJCMDU-HUUCEWRRSA-N	0	3	344.421	3.349	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H]2CCC[C@]2(CNCc2cc(C3CC3)no2)C1	ZINC001112282440	1368747663	/nfs/dbraw/zinc/74/76/63/1368747663.db2.gz	ZFIHXJIJKNONKY-JXFKEZNVSA-N	0	3	343.471	3.237	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2c(F)cc(OC)cc2F)CC1	ZINC001197228052	1368767205	/nfs/dbraw/zinc/76/72/05/1368767205.db2.gz	YEDDIAKUWYASRG-UHFFFAOYSA-N	0	3	338.398	3.088	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N1CCCN(CC/C=C\CC)CC1	ZINC001197396706	1368805328	/nfs/dbraw/zinc/80/53/28/1368805328.db2.gz	KTNJYSPXDDYRFX-DSQZMVHQSA-N	0	3	334.504	3.248	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2cc(C)no2)C1	ZINC001112537416	1368919081	/nfs/dbraw/zinc/91/90/81/1368919081.db2.gz	FKIBYADPCBZYCU-JXFKEZNVSA-N	0	3	345.487	3.304	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cn3ccccc3n2)CC1	ZINC001198021927	1368944195	/nfs/dbraw/zinc/94/41/95/1368944195.db2.gz	LJAHBXOGNRWYSC-UHFFFAOYSA-N	0	3	342.487	3.453	20	30		EGEDHN
C=CCC1(C(=O)N2CCCN(C[C@@H](CC)OC)CC2)CCCCC1	ZINC001198221849	1368983664	/nfs/dbraw/zinc/98/36/64/1368983664.db2.gz	OXUYLFVRTFTFPY-GOSISDBHSA-N	0	3	336.520	3.472	20	30		EGEDHN
C=CCC[C@H](C(=O)N1CCCN(C[C@H](C)OC)CC1)c1ccccc1	ZINC001198423083	1369029552	/nfs/dbraw/zinc/02/95/52/1369029552.db2.gz	KAYDDXFHSUYUSN-ICSRJNTNSA-N	0	3	344.499	3.306	20	30		EGEDHN
CCCCCCCN[C@@H](CNC(=O)COC)c1ccccc1OC	ZINC001198443119	1369033199	/nfs/dbraw/zinc/03/31/99/1369033199.db2.gz	HJXLGSFCIZDZFA-KRWDZBQOSA-N	0	3	336.476	3.059	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC[C@H](NCC(C)C)c1ccccc1OC	ZINC001198596600	1369069223	/nfs/dbraw/zinc/06/92/23/1369069223.db2.gz	SRWQJEVYIJYIQM-WMZOPIPTSA-N	0	3	348.487	3.079	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)c1cnc(C)s1)c1ccccc1OC	ZINC001198596300	1369069356	/nfs/dbraw/zinc/06/93/56/1369069356.db2.gz	PUENLAVPVZMLRD-HNNXBMFYSA-N	0	3	345.468	3.097	20	30		EGEDHN
C=CCCCCCN[C@@H](CNC(=O)[C@H](C)C#N)c1ccccc1OC	ZINC001198618005	1369074536	/nfs/dbraw/zinc/07/45/36/1369074536.db2.gz	VMBYEHVWCZAEEJ-AEFFLSMTSA-N	0	3	343.471	3.348	20	30		EGEDHN
COc1ccccc1[C@@H](CNC(=O)[C@H](C)C#N)NCCCC(C)(C)C	ZINC001198617773	1369074992	/nfs/dbraw/zinc/07/49/92/1369074992.db2.gz	SCTMCJXWKIPJQV-NVXWUHKLSA-N	0	3	345.487	3.428	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CCC([C@@H]2CCCN(CCF)CC2)CC1	ZINC001186591134	1387978505	/nfs/dbraw/zinc/97/85/05/1387978505.db2.gz	WVVGEPYIRNBQAM-QGZVFWFLSA-N	0	3	336.495	3.346	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)C1CC(C)C1)c1ccccc1OC	ZINC001198656720	1369084698	/nfs/dbraw/zinc/08/46/98/1369084698.db2.gz	OJPWCJZGPHYAQG-LEOMRAHMSA-N	0	3	330.472	3.454	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H](NCCC1CC1)c1ccccc1OC	ZINC001198676956	1369088723	/nfs/dbraw/zinc/08/87/23/1369088723.db2.gz	FRVARBSOZKAMBN-LJQANCHMSA-N	0	3	342.483	3.436	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)[C@@H]1CC1(F)F)c1ccccc1OC	ZINC001198712763	1369097158	/nfs/dbraw/zinc/09/71/58/1369097158.db2.gz	GLDMDCCLLKIWND-GJZGRUSLSA-N	0	3	338.398	3.064	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NC[C@@H](NC(C)C)c1ccccc1OC)OCC	ZINC001198751905	1369105158	/nfs/dbraw/zinc/10/51/58/1369105158.db2.gz	KMKCWUOCGNEZIV-IEBWSBKVSA-N	0	3	348.487	3.222	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H](NCCCOC)c1ccccc1OC	ZINC001198826952	1369122319	/nfs/dbraw/zinc/12/23/19/1369122319.db2.gz	NHXTWKPHAQJNHW-QGZVFWFLSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)Cc2cc(C)c(Cl)cn2)CC1	ZINC001113008462	1369133358	/nfs/dbraw/zinc/13/33/58/1369133358.db2.gz	RAJPCNLOXPAVSD-HNNXBMFYSA-N	0	3	335.879	3.085	20	30		EGEDHN
C=CC[C@H](C(=O)N[C@@H]1CN(CCCCCC)C[C@H]1O)c1ccccc1	ZINC001198880973	1369137579	/nfs/dbraw/zinc/13/75/79/1369137579.db2.gz	RASOTFKNONEPMI-XUVXKRRUSA-N	0	3	344.499	3.088	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@H](C)c1ccco1)c1ccccc1OC	ZINC001198894993	1369142294	/nfs/dbraw/zinc/14/22/94/1369142294.db2.gz	NLPHWVISVKBEOJ-NVXWUHKLSA-N	0	3	342.439	3.415	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CCCC3CCC3)C[C@H]2O)CCCCC1	ZINC001198944877	1369154370	/nfs/dbraw/zinc/15/43/70/1369154370.db2.gz	PRLROOKBGANOMM-RTBURBONSA-N	0	3	348.531	3.255	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)c1c[nH]cc1C)c1ccccc1OC	ZINC001198983943	1369165306	/nfs/dbraw/zinc/16/53/06/1369165306.db2.gz	KGSQJNKARSWTMN-GOSISDBHSA-N	0	3	341.455	3.359	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)c1c[nH]cc1C)c1ccccc1OC	ZINC001198983946	1369165662	/nfs/dbraw/zinc/16/56/62/1369165662.db2.gz	KGSQJNKARSWTMN-SFHVURJKSA-N	0	3	341.455	3.359	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)C23CC(C(C)(C)C)(C2)C3)C1	ZINC001199245946	1369197158	/nfs/dbraw/zinc/19/71/58/1369197158.db2.gz	PUYXBQVZUHOCSO-FBIZOPLVSA-N	0	3	348.531	3.111	20	30		EGEDHN
C=CCCC(=O)N1CCCO[C@H](CNCc2cc3ccccc3o2)C1	ZINC001200074411	1369312778	/nfs/dbraw/zinc/31/27/78/1369312778.db2.gz	OCESDOCLZNSEJY-GOSISDBHSA-N	0	3	342.439	3.106	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)Cc2csc(C3CC3)n2)CC1	ZINC001113405881	1369403995	/nfs/dbraw/zinc/40/39/95/1369403995.db2.gz	HTMMAAFBEXHMJH-AWEZNQCLSA-N	0	3	333.501	3.062	20	30		EGEDHN
CC(C)CC1(C(=O)N2CCC(NCc3ccccc3C#N)CC2)CC1	ZINC001200986371	1369462914	/nfs/dbraw/zinc/46/29/14/1369462914.db2.gz	XMVHISHNXKQNEZ-UHFFFAOYSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N1CCC(NC/C(Cl)=C/Cl)CC1	ZINC001201845795	1369633321	/nfs/dbraw/zinc/63/33/21/1369633321.db2.gz	OEYBPTRCFIVNTC-KVNDZABWSA-N	0	3	349.302	3.115	20	30		EGEDHN
CC#CCNC[C@H]1CN(C(=O)CCCCCCCCC)CCCO1	ZINC001201935807	1369645915	/nfs/dbraw/zinc/64/59/15/1369645915.db2.gz	CQKRBXKLCQFUCT-IBGZPJMESA-N	0	3	336.520	3.358	20	30		EGEDHN
CC#CCCCC(=O)N1CCC(NCc2c(F)cccc2F)CC1	ZINC001202075490	1369681769	/nfs/dbraw/zinc/68/17/69/1369681769.db2.gz	HGZLSNPKKIZEPN-UHFFFAOYSA-N	0	3	334.410	3.239	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001202130170	1369695878	/nfs/dbraw/zinc/69/58/78/1369695878.db2.gz	IFERMUZQQOVTNI-OAHLLOKOSA-N	0	3	343.446	3.380	20	30		EGEDHN
C#CCNC[C@@H]1CN(C(=O)[C@H](C)CCCCCCCC)CCCO1	ZINC001202142567	1369700311	/nfs/dbraw/zinc/70/03/11/1369700311.db2.gz	XPFKWBKYWAYMRJ-RTBURBONSA-N	0	3	336.520	3.213	20	30		EGEDHN
CC(C)CC(=O)N[C@@H]1C[C@@H](NCc2ccc(C#N)cc2F)C12CCC2	ZINC001202340605	1369743184	/nfs/dbraw/zinc/74/31/84/1369743184.db2.gz	KUQHGXBQAWAJNY-QZTJIDSGSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC(NCc3oc(C)nc3C)CC2)CC1	ZINC001202364963	1369751039	/nfs/dbraw/zinc/75/10/39/1369751039.db2.gz	BOTRKWVPWLEZTI-UHFFFAOYSA-N	0	3	331.460	3.118	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1[C@H]2CN([C@@H](C)c3ccc(F)cc3)C[C@H]21	ZINC001114165789	1369771949	/nfs/dbraw/zinc/77/19/49/1369771949.db2.gz	KDNDVRXEZBVXEG-FEUVXWNVSA-N	0	3	328.431	3.127	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1[C@H]2CN(CCOc3ccc(C)cc3)C[C@H]21	ZINC001114340567	1369900996	/nfs/dbraw/zinc/90/09/96/1369900996.db2.gz	ISZRGUJSURKILQ-RUYXUALKSA-N	0	3	342.483	3.023	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1C[C@H](NCc2cc(F)ccc2F)C12CCC2	ZINC001202867367	1369911990	/nfs/dbraw/zinc/91/19/90/1369911990.db2.gz	QHZRAADQTZTYTA-ZWKOTPCHSA-N	0	3	346.421	3.141	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1C[C@@H](NCc2oc(CC)nc2C)C12CCC2	ZINC001202987987	1369947284	/nfs/dbraw/zinc/94/72/84/1369947284.db2.gz	PNOUXJZWLWLLSB-IAGOWNOFSA-N	0	3	345.487	3.419	20	30		EGEDHN
C=C(Br)CNC1CCN(C(=O)[C@H](C)[C@@H](C)CC)CC1	ZINC001203092036	1369979952	/nfs/dbraw/zinc/97/99/52/1369979952.db2.gz	IMQCGQPDTBXEIC-WCQYABFASA-N	0	3	331.298	3.158	20	30		EGEDHN
N#Cc1ccccc1OC1CCN(Cc2cccc3nonc32)CC1	ZINC001203140358	1369996003	/nfs/dbraw/zinc/99/60/03/1369996003.db2.gz	NQPPGXUBSXDCCE-UHFFFAOYSA-N	0	3	334.379	3.138	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@@H](NC(=O)CC2(C)CC2)C12CCC2	ZINC001203204483	1370023812	/nfs/dbraw/zinc/02/38/12/1370023812.db2.gz	VILNPQJBIYGCNR-CHWSQXEVSA-N	0	3	341.293	3.102	20	30		EGEDHN
CC#CCCCC(=O)N[C@H]1C[C@@H](NCc2ncccc2C)C12CCC2	ZINC001203281109	1370059211	/nfs/dbraw/zinc/05/92/11/1370059211.db2.gz	MUDPBWFFJSCBAU-MOPGFXCFSA-N	0	3	339.483	3.101	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1C[C@@H](NCc2oc(C)nc2C)C12CCC2	ZINC001203282031	1370059963	/nfs/dbraw/zinc/05/99/63/1370059963.db2.gz	UUVMXPXWDXXFNX-HZPDHXFCSA-N	0	3	331.460	3.021	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1[C@H]2CN(Cc3cccc(OCCC)c3)C[C@H]21	ZINC001114757467	1370063932	/nfs/dbraw/zinc/06/39/32/1370063932.db2.gz	LGBLZLIOZPVJKQ-KXTWHKPSSA-N	0	3	342.483	3.378	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1C[C@H](NCc2cnoc2C)C12CCC2	ZINC001203295823	1370067848	/nfs/dbraw/zinc/06/78/48/1370067848.db2.gz	NGQOYOONTXUDLO-ROUUACIJSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(OC)c(C)c3)C[C@H]21	ZINC001114792374	1370083450	/nfs/dbraw/zinc/08/34/50/1370083450.db2.gz	RVAVDRAKIQDWFW-DIJFTKHXSA-N	0	3	342.483	3.152	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1C[C@@H](NCc2cc(OC)ns2)C12CCC2	ZINC001203340961	1370089748	/nfs/dbraw/zinc/08/97/48/1370089748.db2.gz	NGTBJAYZQKINAN-CABCVRRESA-N	0	3	349.500	3.025	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H](NCc3ccccn3)C23CCC3)CCC1	ZINC001203364749	1370099116	/nfs/dbraw/zinc/09/91/16/1370099116.db2.gz	BHHFCDUTLTWMMB-ROUUACIJSA-N	0	3	339.483	3.345	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1C[C@@H](NCc2ccccn2)C12CCC2	ZINC001203450614	1370130694	/nfs/dbraw/zinc/13/06/94/1370130694.db2.gz	CUCUHCMKPZABHR-SJORKVTESA-N	0	3	327.472	3.201	20	30		EGEDHN
CCC1(C(=O)N[C@@H]2[C@H]3CN(Cc4ccc(C#N)cc4)C[C@H]32)CCCC1	ZINC001115063760	1370250617	/nfs/dbraw/zinc/25/06/17/1370250617.db2.gz	VDXSULHJMHVOMN-BWTSREIZSA-N	0	3	337.467	3.075	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@H]2CCC(=O)N3c2ccccc2)cc1	ZINC001203901327	1370306801	/nfs/dbraw/zinc/30/68/01/1370306801.db2.gz	LSARIXJSIRIYQM-WOJBJXKFSA-N	0	3	331.419	3.328	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@H]1[C@@H]2CC[C@H]1CN(Cc1ccc(C#N)cc1)C2	ZINC001203905612	1370309933	/nfs/dbraw/zinc/30/99/33/1370309933.db2.gz	XEAAIOLUZDAFMA-BCDXTJNWSA-N	0	3	341.455	3.293	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CCN(Cc3ccc(F)cc3)C2)C1	ZINC001203912288	1370312543	/nfs/dbraw/zinc/31/25/43/1370312543.db2.gz	PXDCTWSIYLDTKA-IBGZPJMESA-N	0	3	332.419	3.436	20	30		EGEDHN
C=CCO[C@@H]1CO[C@]2(C1)CCCN(Cc1ccc(OCC)cc1)C2	ZINC001203967030	1370333962	/nfs/dbraw/zinc/33/39/62/1370333962.db2.gz	AJBAPPOQERBLLX-PMACEKPBSA-N	0	3	331.456	3.411	20	30		EGEDHN
C=CCO[C@H]1CO[C@@]2(C1)CCCN(Cc1ccc(OCC)cc1)C2	ZINC001203967033	1370334099	/nfs/dbraw/zinc/33/40/99/1370334099.db2.gz	AJBAPPOQERBLLX-WOJBJXKFSA-N	0	3	331.456	3.411	20	30		EGEDHN
C=CCOC(=O)N[C@@H]1CCCN(Cc2cn(C)c3ccccc23)C1	ZINC001204319944	1370442876	/nfs/dbraw/zinc/44/28/76/1370442876.db2.gz	ISJFUYCYYMBYCD-MRXNPFEDSA-N	0	3	327.428	3.055	20	30		EGEDHN
C=CCOC(=O)N[C@H]1CCCN(Cc2cn(C)c3ccccc23)C1	ZINC001204319943	1370443266	/nfs/dbraw/zinc/44/32/66/1370443266.db2.gz	ISJFUYCYYMBYCD-INIZCTEOSA-N	0	3	327.428	3.055	20	30		EGEDHN
CS[C@@H](C)C(=O)NCC1(NCC#Cc2ccccc2)CCCCC1	ZINC001115419374	1370444482	/nfs/dbraw/zinc/44/44/82/1370444482.db2.gz	PZZRXXUHXQCMGU-KRWDZBQOSA-N	0	3	344.524	3.198	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)CCC2CC2)CCCCC1	ZINC001115456400	1370462716	/nfs/dbraw/zinc/46/27/16/1370462716.db2.gz	NVDWTYFMNCUNCC-UHFFFAOYSA-N	0	3	343.309	3.494	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)C=C2CCC2)CCCCC1	ZINC001115477022	1370483410	/nfs/dbraw/zinc/48/34/10/1370483410.db2.gz	PFHUUFKUAVQYQG-UHFFFAOYSA-N	0	3	341.293	3.414	20	30		EGEDHN
N[C@H]1CN(Cc2ccc(C(F)(F)F)cc2C(F)(F)F)C[C@@H]1F	ZINC001204892369	1370598104	/nfs/dbraw/zinc/59/81/04/1370598104.db2.gz	YNKYYRMPVBIXHL-QWRGUYRKSA-N	0	3	330.247	3.205	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H]2Cc3ccccc3O2)CCCCC1	ZINC001115620333	1370615566	/nfs/dbraw/zinc/61/55/66/1370615566.db2.gz	YWADEDNFRTZATI-QGZVFWFLSA-N	0	3	348.874	3.151	20	30		EGEDHN
C#CCCCCC(=O)N1CCC(CNCc2oc(CC)nc2C)CC1	ZINC001205033291	1370635222	/nfs/dbraw/zinc/63/52/22/1370635222.db2.gz	UQEWOVNPAQUZNQ-UHFFFAOYSA-N	0	3	345.487	3.067	20	30		EGEDHN
C=CCCN1C[C@@H](O)[C@H](N(Cc2ccccc2)C(=O)[C@H](C)CCC)C1	ZINC001205109955	1370653000	/nfs/dbraw/zinc/65/30/00/1370653000.db2.gz	LLYMIQZXUNOWFX-MISYRCLQSA-N	0	3	344.499	3.073	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N(Cc1ccccc1)[C@@H]1CN(C(C)C)C[C@H]1O	ZINC001205175003	1370670406	/nfs/dbraw/zinc/67/04/06/1370670406.db2.gz	GMJBYAZENPPMBP-DFQSSKMNSA-N	0	3	344.499	3.071	20	30		EGEDHN
C[C@@H]1C[C@H]1CC(=O)NCC1(NCC#Cc2ccccc2)CCCCC1	ZINC001115710439	1370689227	/nfs/dbraw/zinc/68/92/27/1370689227.db2.gz	KUCAMDIGEYKLMV-QUCCMNQESA-N	0	3	338.495	3.493	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@@H]2CC2(C)C)CC[C@H]1c1ccc(F)cc1	ZINC001205270093	1370700946	/nfs/dbraw/zinc/70/09/46/1370700946.db2.gz	LFGKOTPHQWJXBA-GBESFXJTSA-N	0	3	342.458	3.169	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C2CC(C)(C)C2)C[C@H]1c1cccc(F)c1	ZINC001205404701	1370745809	/nfs/dbraw/zinc/74/58/09/1370745809.db2.gz	YZCQOEWSWYACHB-RBUKOAKNSA-N	0	3	342.458	3.169	20	30		EGEDHN
Cc1ccc(CN2CC[C@@H]3[C@@H]2CCN3Cc2ccc(F)c(C#N)c2)o1	ZINC001205467070	1370764062	/nfs/dbraw/zinc/76/40/62/1370764062.db2.gz	HPUCPCVWUXVRNY-UXHICEINSA-N	0	3	339.414	3.448	20	30		EGEDHN
C=CCOCC(=O)N1CC[C@H]2CN([C@H](CC)c3ccc(F)cc3)C[C@H]21	ZINC001187325681	1388094557	/nfs/dbraw/zinc/09/45/57/1388094557.db2.gz	CEEFZCKQNJIKNO-QXAKKESOSA-N	0	3	346.446	3.012	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CCN(Cc3ncccc3C)C2)C1	ZINC001205771032	1370865295	/nfs/dbraw/zinc/86/52/95/1370865295.db2.gz	PJKSFEQWHWJCCG-LJQANCHMSA-N	0	3	329.444	3.001	20	30		EGEDHN
C[C@@H](CC(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1)C(C)(C)C	ZINC001187412808	1388103744	/nfs/dbraw/zinc/10/37/44/1388103744.db2.gz	FJKZMUOSPLZULE-WMLDXEAASA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC(CNCc2oc(CC)nc2C)CC1	ZINC001205989846	1370931265	/nfs/dbraw/zinc/93/12/65/1370931265.db2.gz	XRXKTHKPEUPRSZ-HNNXBMFYSA-N	0	3	347.503	3.476	20	30		EGEDHN
C=CCCCC(=O)N1CCC(CNCc2nc(C)sc2C)CC1	ZINC001206106281	1370960798	/nfs/dbraw/zinc/96/07/98/1370960798.db2.gz	XNLKFQMDMRCFMW-UHFFFAOYSA-N	0	3	335.517	3.444	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC(CN[C@@H](C)c2cnc(C)cn2)CC1	ZINC001206427628	1371051388	/nfs/dbraw/zinc/05/13/88/1371051388.db2.gz	JGQLDHFFCRFVGM-INIZCTEOSA-N	0	3	344.503	3.277	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CN(CCOc2cccc(CC)c2)C[C@H]1C	ZINC001206502093	1371074662	/nfs/dbraw/zinc/07/46/62/1371074662.db2.gz	LXTGHFWZDRWNAF-VQIMIIECSA-N	0	3	330.472	3.031	20	30		EGEDHN
COc1ccc(-c2cc(CN3CCC4SC(=O)C=C4C3)no2)cc1	ZINC001206826326	1371181462	/nfs/dbraw/zinc/18/14/62/1371181462.db2.gz	WMAJRYNXNGEOPB-QGZVFWFLSA-N	0	3	342.420	3.124	20	30		EGEDHN
C[C@@H]1CN(Cc2cccc3cccnc32)C[C@H]1NC(=O)C#CC(C)(C)C	ZINC001206951064	1371242391	/nfs/dbraw/zinc/24/23/91/1371242391.db2.gz	VNBVHXSWPNYFKV-VQIMIIECSA-N	0	3	349.478	3.221	20	30		EGEDHN
CN(Cc1cc(C#N)n(C)c1)[C@@H]1CCCC[C@@H]1NC(=O)OC(C)(C)C	ZINC001207110189	1371297142	/nfs/dbraw/zinc/29/71/42/1371297142.db2.gz	GHHSSAGWSYBLPY-DLBZAZTESA-N	0	3	346.475	3.164	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CCN(Cc3cncc(C)c3)CC2)CC1	ZINC001207153973	1371312719	/nfs/dbraw/zinc/31/27/19/1371312719.db2.gz	MDESLLOFKFIRQF-UHFFFAOYSA-N	0	3	343.471	3.391	20	30		EGEDHN
C=CCN(CCN1CCC(OCCC)CC1)C(=O)OC(C)(C)C	ZINC001207205173	1371329126	/nfs/dbraw/zinc/32/91/26/1371329126.db2.gz	GOPIUBKOEMAPCE-UHFFFAOYSA-N	0	3	326.481	3.301	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H](NCc2ccccc2OC2CC2)C1	ZINC001207654463	1371465692	/nfs/dbraw/zinc/46/56/92/1371465692.db2.gz	RCNNPJBMUPEGHY-QGZVFWFLSA-N	0	3	328.456	3.275	20	30		EGEDHN
C=CCOCC(=O)N1CCC[C@H](N[C@@H](C)c2ccccc2Cl)C1	ZINC001207679700	1371472801	/nfs/dbraw/zinc/47/28/01/1371472801.db2.gz	CKSMGGVLNBVFFB-GJZGRUSLSA-N	0	3	336.863	3.184	20	30		EGEDHN
O=C(C1=CCCC1)N1CCC[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207790192	1371505595	/nfs/dbraw/zinc/50/55/95/1371505595.db2.gz	SBIQEGOEEDJQTI-IBGZPJMESA-N	0	3	342.870	3.382	20	30		EGEDHN
O=C(Nc1ccc(F)c(Cl)c1)N1CCC2SC(=O)C=C2C1	ZINC001187680036	1388141622	/nfs/dbraw/zinc/14/16/22/1388141622.db2.gz	ZFNVPAGPPCOOPO-LBPRGKRZSA-N	0	3	326.780	3.285	20	30		EGEDHN
C#CCCCCC(=O)N1CCC[C@H](NCc2cc(F)cc(F)c2)C1	ZINC001207860358	1371522451	/nfs/dbraw/zinc/52/24/51/1371522451.db2.gz	KNWPNPIGPQNIBV-SFHVURJKSA-N	0	3	334.410	3.239	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)COC(C)(C)C)C1	ZINC001120362369	1371547992	/nfs/dbraw/zinc/54/79/92/1371547992.db2.gz	FHJICTXMGLMANP-CVEARBPZSA-N	0	3	342.911	3.257	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC[C@H]([C@H]2CCCN2Cc2cncs2)C1	ZINC001120382551	1371554940	/nfs/dbraw/zinc/55/49/40/1371554940.db2.gz	PTCHSDUFWGXROG-FUHWJXTLSA-N	0	3	345.512	3.006	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC[C@H](N[C@@H]2CCc3c2c(F)ccc3F)C1	ZINC001208005228	1371564845	/nfs/dbraw/zinc/56/48/45/1371564845.db2.gz	BAWSSIITHLSBJY-KBXCAEBGSA-N	0	3	346.421	3.192	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CN(CCOc2ccc(C)cc2)C[C@H]1C	ZINC001208298108	1371705922	/nfs/dbraw/zinc/70/59/22/1371705922.db2.gz	DNGOCGQQZWZCDQ-IEBWSBKVSA-N	0	3	344.499	3.413	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1CN(CCc2ccccc2F)C[C@H]1C	ZINC001208315162	1371713103	/nfs/dbraw/zinc/71/31/03/1371713103.db2.gz	NATSXBAEMQITEJ-YLJYHZDGSA-N	0	3	344.474	3.388	20	30		EGEDHN
C#CCC1(C(=O)N2CCC[C@H](NCc3cc(C)ccc3F)C2)CCC1	ZINC001208318751	1371715125	/nfs/dbraw/zinc/71/51/25/1371715125.db2.gz	HFDRBVTWMFIPPU-SFHVURJKSA-N	0	3	342.458	3.408	20	30		EGEDHN
C#CCC1(C(=O)N2CCC[C@@H](NCc3ccccc3F)C2)CCC1	ZINC001208318855	1371715715	/nfs/dbraw/zinc/71/57/15/1371715715.db2.gz	JCFJKFXOTGWNMD-QGZVFWFLSA-N	0	3	328.431	3.100	20	30		EGEDHN
C#CCC1(C(=O)N2CCC[C@H](NCc3c(C)nsc3C)C2)CCC1	ZINC001208319253	1371716634	/nfs/dbraw/zinc/71/66/34/1371716634.db2.gz	PNKURRYNSUIHOP-INIZCTEOSA-N	0	3	345.512	3.034	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CN(Cc2ccc3ncccc3c2)C[C@H]1C	ZINC001208371068	1371740277	/nfs/dbraw/zinc/74/02/77/1371740277.db2.gz	DBTAXJROKQBZSQ-DYESRHJHSA-N	0	3	349.478	3.365	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1CN(Cc2cccc(OC)c2)C[C@H]1C	ZINC001208392731	1371750055	/nfs/dbraw/zinc/75/00/55/1371750055.db2.gz	CJZHDAVQAFWQQH-JTDSTZFVSA-N	0	3	330.472	3.234	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)CCCc2ccc(OC)cc2)C1	ZINC001208494342	1371786960	/nfs/dbraw/zinc/78/69/60/1371786960.db2.gz	QPBISWYKBATKEI-VQIMIIECSA-N	0	3	330.472	3.031	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1CN(CCOc2ccccc2)C[C@H]1C	ZINC001208497948	1371787420	/nfs/dbraw/zinc/78/74/20/1371787420.db2.gz	HLZMTIYAVVMISN-YVWKXTFCSA-N	0	3	330.472	3.104	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1CN(CCOc2ccccc2C)C[C@H]1C	ZINC001208511920	1371794724	/nfs/dbraw/zinc/79/47/24/1371794724.db2.gz	OGKUYFKHHSSRFI-OPYAIIAOSA-N	0	3	344.499	3.413	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@H]1CCN(CCCc2cccc(C#N)c2)C1	ZINC001208851916	1371918339	/nfs/dbraw/zinc/91/83/39/1371918339.db2.gz	NAQBWYBLLPMTLL-KRWDZBQOSA-N	0	3	329.444	3.090	20	30		EGEDHN
N#Cc1ccc(CCN2CC[C@H](N3Cc4ccccc4NC3=O)C2)cc1	ZINC001208929515	1371949745	/nfs/dbraw/zinc/94/97/45/1371949745.db2.gz	UFXTYPGDSYUNJV-IBGZPJMESA-N	0	3	346.434	3.223	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC[C@@H](NCc2cncc(C)c2)C1	ZINC001209005000	1371972059	/nfs/dbraw/zinc/97/20/59/1371972059.db2.gz	SCLQQIZPVDDZJZ-LJQANCHMSA-N	0	3	327.472	3.054	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CCC[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001209017396	1371975899	/nfs/dbraw/zinc/97/58/99/1371975899.db2.gz	KYOFJMQQUATCMS-DOTOQJQBSA-N	0	3	336.838	3.020	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@@H](NCc2ccc(Cl)nc2)C1	ZINC001209110580	1372000949	/nfs/dbraw/zinc/00/09/49/1372000949.db2.gz	BULLJTQTKJFYBH-MRXNPFEDSA-N	0	3	333.863	3.009	20	30		EGEDHN
CC#CCCCC(=O)NC1CC2(CC(NCc3ncc(C)s3)C2)C1	ZINC001121580350	1372015689	/nfs/dbraw/zinc/01/56/89/1372015689.db2.gz	IPNHUKNHDRRVOP-UHFFFAOYSA-N	0	3	345.512	3.162	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N(C)CCc1cccs1	ZINC001121595244	1372019384	/nfs/dbraw/zinc/01/93/84/1372019384.db2.gz	NMEQIPSULZMUNN-HNNXBMFYSA-N	0	3	345.516	3.014	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NC1CC2(CC(NCc3nc(C)cs3)C2)C1	ZINC001121611710	1372024394	/nfs/dbraw/zinc/02/43/94/1372024394.db2.gz	XNUYZCZGZGPLSE-UHOAPKMXSA-N	0	3	347.528	3.427	20	30		EGEDHN
C=CCCCC(=O)NC1CC2(C1)CC(N[C@H](C)c1cnc(C)cn1)C2	ZINC001121668501	1372040726	/nfs/dbraw/zinc/04/07/26/1372040726.db2.gz	SINCUPURMGDCKC-UEBDJUODSA-N	0	3	342.487	3.219	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC1CC2(C1)CC(N[C@H](C)c1cnccn1)C2	ZINC001121714072	1372056576	/nfs/dbraw/zinc/05/65/76/1372056576.db2.gz	USNUAFNFFHZPDG-RYLDMIIRSA-N	0	3	342.487	3.157	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC[C@@H](NCc3cc(C)ns3)C2)CC1	ZINC001209492673	1372120301	/nfs/dbraw/zinc/12/03/01/1372120301.db2.gz	FGBUYWJUNVXCKV-OAHLLOKOSA-N	0	3	333.501	3.279	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC[C@H](NCC#Cc3ccccc3)C2)CC1	ZINC001209494023	1372121109	/nfs/dbraw/zinc/12/11/09/1372121109.db2.gz	RAXONBLEWBTLHM-FQEVSTJZSA-N	0	3	336.479	3.365	20	30		EGEDHN
CC1(C)CC[C@@H](C(=O)N2CCC[C@@H](NCC#Cc3ccccc3)C2)C1	ZINC001209523059	1372127691	/nfs/dbraw/zinc/12/76/91/1372127691.db2.gz	FVPXNRXOAVDQLG-WOJBJXKFSA-N	0	3	338.495	3.445	20	30		EGEDHN
O=C(N1CCC[C@@H](NCC#Cc2ccc(Cl)cc2)C1)C1(CF)CC1	ZINC001209567897	1372138983	/nfs/dbraw/zinc/13/89/83/1372138983.db2.gz	JEIYRBQTFPIBDL-QGZVFWFLSA-N	0	3	348.849	3.022	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@@H](NCc2ccc(Cl)nc2)C1	ZINC001209865136	1372217122	/nfs/dbraw/zinc/21/71/22/1372217122.db2.gz	COKNJZKHMGNFFY-OAHLLOKOSA-N	0	3	335.879	3.418	20	30		EGEDHN
CCC[C@@H](CC)C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001210378062	1372337379	/nfs/dbraw/zinc/33/73/79/1372337379.db2.gz	QDNHKPCNXQGNJR-UXHICEINSA-N	0	3	326.484	3.445	20	30		EGEDHN
F[C@H]1CNCCN(Cc2ccc(C(F)(F)F)cc2C(F)(F)F)C1	ZINC001210580107	1372384424	/nfs/dbraw/zinc/38/44/24/1372384424.db2.gz	FEWRRRFNDOGZKI-NSHDSACASA-N	0	3	344.274	3.468	20	30		EGEDHN
N#CC(C(=O)c1cc2n(n1)CCCC2)c1nc2c(cccc2Cl)[nH]1	ZINC001123345405	1372435668	/nfs/dbraw/zinc/43/56/68/1372435668.db2.gz	GMTIPFGTRHEPAB-NSHDSACASA-N	0	3	339.786	3.239	20	30		EGEDHN
C=C[C@H](CC(=O)N[C@@H]1CN(CCOC(C)C)C[C@H]1C)c1ccccc1	ZINC001211228342	1372508003	/nfs/dbraw/zinc/50/80/03/1372508003.db2.gz	VRGJZTPPBKAELQ-QWFCFKBJSA-N	0	3	344.499	3.208	20	30		EGEDHN
C=CCCOCC(=O)N1CCC[C@@H](NCc2cc3ccccc3o2)C1	ZINC001211355096	1372538947	/nfs/dbraw/zinc/53/89/47/1372538947.db2.gz	MQPQLZCNRBCDCP-QGZVFWFLSA-N	0	3	342.439	3.106	20	30		EGEDHN
C=C(CN1CCCCC1)c1nc(-c2ncc(Cl)cc2OC)no1	ZINC001211436815	1372558579	/nfs/dbraw/zinc/55/85/79/1372558579.db2.gz	YSFMKZCTPZPRSN-UHFFFAOYSA-N	0	3	334.807	3.293	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C(C)(C)C(C)C)C[C@H]1c1ccccc1	ZINC001211607290	1372589524	/nfs/dbraw/zinc/58/95/24/1372589524.db2.gz	ANDQOCKEBADEDA-RBUKOAKNSA-N	0	3	326.484	3.276	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H](C)C(CC)CC)C[C@H]1c1ccccc1	ZINC001211628011	1372592430	/nfs/dbraw/zinc/59/24/30/1372592430.db2.gz	YMIWZMLBJHWVRD-FFZOFVMBSA-N	0	3	326.484	3.276	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@H](C)CC(C)C)C[C@H]1c1ccccc1	ZINC001211698339	1372603832	/nfs/dbraw/zinc/60/38/32/1372603832.db2.gz	IQUFOBABPXDCSL-YZGWKJHDSA-N	0	3	326.484	3.276	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2ccsc2C)[C@H](OC)C1	ZINC001212230863	1372674383	/nfs/dbraw/zinc/67/43/83/1372674383.db2.gz	AQJVOLYQRYIUON-IAGOWNOFSA-N	0	3	336.501	3.232	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@H]2CCCC23CC3)[C@H](OC)C1	ZINC001212455897	1372709670	/nfs/dbraw/zinc/70/96/70/1372709670.db2.gz	YOWOWUKBKWLXKX-KZNAEPCWSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@](C)(F)CCCC)[C@H](OC)C1	ZINC001212489693	1372714622	/nfs/dbraw/zinc/71/46/22/1372714622.db2.gz	RNHHOWWBKYJWGV-ZHALLVOQSA-N	0	3	342.499	3.467	20	30		EGEDHN
C[C@@H]1[C@@H](NC(=O)c2csc(C#N)c2)CCN1Cc1ccccc1	ZINC001326517291	1388226440	/nfs/dbraw/zinc/22/64/40/1388226440.db2.gz	USJWQEVAGRZDLS-DYVFJYSZSA-N	0	3	325.437	3.013	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)C2(C3CC3)CCC2)[C@H](OC)C1	ZINC001213224304	1372864198	/nfs/dbraw/zinc/86/41/98/1372864198.db2.gz	VYRVUIVUBUVSMV-QZTJIDSGSA-N	0	3	336.520	3.353	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN([C@@H]2CCCc3ccccc32)C[C@H]1OC	ZINC001213273378	1372872927	/nfs/dbraw/zinc/87/29/27/1372872927.db2.gz	MPRBYNHNNPVDPM-GUDVDZBRSA-N	0	3	342.483	3.092	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN([C@@H](C)c2cc(C)ccc2C)C[C@H]1OC	ZINC001213273355	1372873080	/nfs/dbraw/zinc/87/30/80/1372873080.db2.gz	LOTWNIISOGUTJG-QXAKKESOSA-N	0	3	344.499	3.392	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN([C@@H](C)c2ccccc2C)C[C@H]1OC	ZINC001213350582	1372890067	/nfs/dbraw/zinc/89/00/67/1372890067.db2.gz	VVXQKQPQTSLLRZ-QXAKKESOSA-N	0	3	330.472	3.228	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](NCc3cccnc3)C2)CCCCC1	ZINC001188053510	1388230511	/nfs/dbraw/zinc/23/05/11/1388230511.db2.gz	RYTQQCQQBHIMLN-GOSISDBHSA-N	0	3	327.472	3.299	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)[C@@H](CC2CCCC2)C(C)C)[C@H](OC)C1	ZINC001213524412	1372918995	/nfs/dbraw/zinc/91/89/95/1372918995.db2.gz	CWDHJLJFULKXSV-IPMKNSEASA-N	0	3	336.520	3.230	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2cc(Cl)ccc2C)[C@H](OC)C1	ZINC001213594642	1372931945	/nfs/dbraw/zinc/93/19/45/1372931945.db2.gz	KVTDMEJYAJJABV-IAGOWNOFSA-N	0	3	336.863	3.044	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H]2CN(CCOCCC(C)C)C[C@H]21	ZINC001188063361	1388232271	/nfs/dbraw/zinc/23/22/71/1388232271.db2.gz	JNMHHURFUXADRG-ZWKOTPCHSA-N	0	3	336.520	3.184	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2cc(C)c(CC)o2)[C@H](OC)C1	ZINC001213714935	1372950025	/nfs/dbraw/zinc/95/00/25/1372950025.db2.gz	DBMAWOQHFBMDGU-VQIMIIECSA-N	0	3	348.487	3.326	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H](NC(=O)c2cc3[nH]ccc3s2)[C@H](OC)C1	ZINC001213783979	1372961575	/nfs/dbraw/zinc/96/15/75/1372961575.db2.gz	YFITXMCSGUUFGN-NWANDNLSSA-N	0	3	347.484	3.013	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H](NC(=O)c2cc(C)c(C)s2)[C@H](OC)C1	ZINC001213823420	1372967237	/nfs/dbraw/zinc/96/72/37/1372967237.db2.gz	YAYKMNDTRQRDGJ-NUEKZKHPSA-N	0	3	336.501	3.149	20	30		EGEDHN
C=CC[C@@H](C(=O)N[C@@H]1CN(CCC(=C)C)C[C@H]1OC)c1ccccc1	ZINC001213896098	1372976562	/nfs/dbraw/zinc/97/65/62/1372976562.db2.gz	USLOOPQTMWGVFL-VAMGGRTRSA-N	0	3	342.483	3.128	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)[C@@H](CC)c2ccc(F)cc2)[C@H](OC)C1	ZINC001213951517	1372986105	/nfs/dbraw/zinc/98/61/05/1372986105.db2.gz	VPKBCCXKESGRMS-IPMKNSEASA-N	0	3	348.462	3.101	20	30		EGEDHN
C=CCC[C@H](C(=O)N[C@@H]1CN(CCC=C)C[C@H]1OC)c1ccccc1	ZINC001214001987	1372993397	/nfs/dbraw/zinc/99/33/97/1372993397.db2.gz	QXRUTXBKVHLRFR-XUVXKRRUSA-N	0	3	342.483	3.128	20	30		EGEDHN
CC(C)C#CC(=O)NCCNCc1ccc(Cl)c(C(F)(F)F)c1	ZINC001126815621	1373033446	/nfs/dbraw/zinc/03/34/46/1373033446.db2.gz	FSVYGENLURFDAY-UHFFFAOYSA-N	0	3	346.780	3.224	20	30		EGEDHN
CC(C)=C(F)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001214426491	1373058767	/nfs/dbraw/zinc/05/87/67/1373058767.db2.gz	ALYDVUVOUZIMON-RHSMWYFYSA-N	0	3	348.849	3.391	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2(C)CCCC2)C[C@H]1NCC#Cc1ccccc1	ZINC001214552829	1373079841	/nfs/dbraw/zinc/07/98/41/1373079841.db2.gz	AXWXHNLEBYOXLB-UYAOXDASSA-N	0	3	338.495	3.445	20	30		EGEDHN
C=CCCOCCCCC(=O)NCCNCc1ccc(Cl)s1	ZINC001127124675	1373091471	/nfs/dbraw/zinc/09/14/71/1373091471.db2.gz	JHSUAQPEHBXYFD-UHFFFAOYSA-N	0	3	344.908	3.370	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](C)[C@H](NCc2ccc(Cl)nc2)C1	ZINC001214727659	1373110323	/nfs/dbraw/zinc/11/03/23/1373110323.db2.gz	LKZUFCYNPRCAFE-UKRRQHHQSA-N	0	3	335.879	3.274	20	30		EGEDHN
C=C(C)CNCc1ccncc1O[C@H]1CCN(C(=O)C(CC)CC)C1	ZINC001127873199	1373192984	/nfs/dbraw/zinc/19/29/84/1373192984.db2.gz	HIERMEAPRUUFNG-SFHVURJKSA-N	0	3	345.487	3.163	20	30		EGEDHN
Cc1c(Cl)cccc1C(=O)NCCNCc1ccc(C#N)s1	ZINC001127876126	1373194095	/nfs/dbraw/zinc/19/40/95/1373194095.db2.gz	VCNJZAKIIJJKNR-UHFFFAOYSA-N	0	3	333.844	3.101	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1C[C@@H](C)[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001215586192	1373214177	/nfs/dbraw/zinc/21/41/77/1373214177.db2.gz	XAFICEJSPYGWMG-YCEFEEMOSA-N	0	3	344.886	3.174	20	30		EGEDHN
C=CCNCc1cccc(N2CC[C@H](NC(=O)CCCCCC)C2)n1	ZINC001128132526	1373222357	/nfs/dbraw/zinc/22/23/57/1373222357.db2.gz	FDMDYJIJKCCXNZ-SFHVURJKSA-N	0	3	344.503	3.023	20	30		EGEDHN
CC(C)c1ccccc1C(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001128864896	1373317703	/nfs/dbraw/zinc/31/77/03/1373317703.db2.gz	MWUPISDQDDEGKD-UHFFFAOYSA-N	0	3	339.414	3.340	20	30		EGEDHN
C=CCCOc1ccc(-c2nc(-c3ccc4c(n3)CCNC4)no2)cc1	ZINC001217020861	1373379150	/nfs/dbraw/zinc/37/91/50/1373379150.db2.gz	AOOANPKETQKWLN-UHFFFAOYSA-N	0	3	348.406	3.399	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](C)[C@H](NCc3ncccc3C)C2)CCCC1	ZINC001217105335	1373388427	/nfs/dbraw/zinc/38/84/27/1373388427.db2.gz	GGSCDCFPLYQNQI-IEBWSBKVSA-N	0	3	341.499	3.463	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)CCSCC)[C@H]2C1	ZINC001217405428	1373438643	/nfs/dbraw/zinc/43/86/43/1373438643.db2.gz	HURCLTAKFXPQOY-DLBZAZTESA-N	0	3	342.549	3.012	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cc3sccc3s2)s1	ZINC001130283577	1373485017	/nfs/dbraw/zinc/48/50/17/1373485017.db2.gz	DPJURAYTDSGHQX-UHFFFAOYSA-N	0	3	347.490	3.416	20	30		EGEDHN
COc1ccccc1/C=C/C(=O)c1ccccc1O[C@@H]1CNC[C@@H]1F	ZINC001218000682	1373531225	/nfs/dbraw/zinc/53/12/25/1373531225.db2.gz	JOAXNAUOPMUXCA-FQEHLOLLSA-N	0	3	341.382	3.280	20	30		EGEDHN
N#Cc1cc(-c2ccc(Cl)cc2)cnc1O[C@H]1CCNC[C@H]1F	ZINC001218064582	1373550904	/nfs/dbraw/zinc/55/09/04/1373550904.db2.gz	NAAOKGBFUCHAGE-CVEARBPZSA-N	0	3	331.778	3.352	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)[C@@H](CC)CCCCCC)[C@H]2C1	ZINC001218429572	1373611699	/nfs/dbraw/zinc/61/16/99/1373611699.db2.gz	MZQYXRANFPICFP-GBESFXJTSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2OCCN(C(=O)c3oc(CC)cc3C)[C@H]2C1	ZINC001218965814	1373670951	/nfs/dbraw/zinc/67/09/51/1373670951.db2.gz	URFGYHADRYHSLU-BPQIPLTHSA-N	0	3	346.471	3.030	20	30		EGEDHN
C=C[C@@H]1C[C@]1(N)C(=O)Nc1cc(F)cc(OCc2ccccc2)c1	ZINC001219076722	1373685923	/nfs/dbraw/zinc/68/59/23/1373685923.db2.gz	SLOCNEAYGJEJJV-AUUYWEPGSA-N	0	3	326.371	3.247	20	30		EGEDHN
C[Si](C)(C)C#Cc1cc(Cl)ccc1NC(=O)[C@@H](N)CC(F)F	ZINC001219482688	1373711393	/nfs/dbraw/zinc/71/13/93/1373711393.db2.gz	IEDPHVLYRIADGS-LBPRGKRZSA-N	0	3	344.865	3.490	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)NCc1cc(Cl)nc(Cl)c1	ZINC001220069612	1373750621	/nfs/dbraw/zinc/75/06/21/1373750621.db2.gz	FTJAKAVQVKNKMK-LBPRGKRZSA-N	0	3	330.259	3.468	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C1(CC(C)C)CC1)C[C@H](C)O2	ZINC001131665704	1373751647	/nfs/dbraw/zinc/75/16/47/1373751647.db2.gz	IRLMOMBQQGCUHI-PXNSSMCTSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C1(CC(C)C)CCC1)C[C@@H](C)O2	ZINC001131669869	1373754323	/nfs/dbraw/zinc/75/43/23/1373754323.db2.gz	VMLCRPZTXXTYAU-NQIIRXRSSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C1(CCC)CCC1)C[C@H](C)O2	ZINC001131673456	1373755927	/nfs/dbraw/zinc/75/59/27/1373755927.db2.gz	MLPWBZRJZKJRLV-FXAWDEMLSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)CCCCC(C)C)C[C@H](C)O2	ZINC001131694202	1373767429	/nfs/dbraw/zinc/76/74/29/1373767429.db2.gz	VYLKSISWFBDQOR-ICSRJNTNSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC[C@H](C)N(Cc2cccc3c2CCOC3)C1	ZINC001131896548	1375033213	/nfs/dbraw/zinc/03/32/13/1375033213.db2.gz	TYAQMTQYQZVYBG-LPHOPBHVSA-N	0	3	342.483	3.195	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)CC[C@H](C)c2ccccc2)CC1	ZINC001224745568	1375073205	/nfs/dbraw/zinc/07/32/05/1375073205.db2.gz	BSELMWHGLJHWSR-SFHVURJKSA-N	0	3	326.484	3.422	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)CCc2ccc(Cl)cc2)c1	ZINC001131983199	1375081425	/nfs/dbraw/zinc/08/14/25/1375081425.db2.gz	WVHOECYBDPUYBS-UHFFFAOYSA-N	0	3	341.842	3.050	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)/C(C)=C\CC	ZINC001225147527	1375095378	/nfs/dbraw/zinc/09/53/78/1375095378.db2.gz	UPIVYMHQOQAPSW-XAVULWGNSA-N	0	3	329.282	3.268	20	30		EGEDHN
C#CCN1CCC(CNC(=O)C[C@H](c2ccccc2)C(C)C)CC1	ZINC001225138586	1375093615	/nfs/dbraw/zinc/09/36/15/1375093615.db2.gz	RCCGSRDVYDNMDJ-FQEVSTJZSA-N	0	3	326.484	3.278	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2csc3ccccc23)cc1	ZINC001132013108	1375097441	/nfs/dbraw/zinc/09/74/41/1375097441.db2.gz	JURFYIIRQBZIGJ-UHFFFAOYSA-N	0	3	335.432	3.293	20	30		EGEDHN
C[C@H]1CC[C@@H](NC(=O)C#CC(C)(C)C)CN1CCc1ccccc1	ZINC001132033745	1375108242	/nfs/dbraw/zinc/10/82/42/1375108242.db2.gz	KQLHRNMJRJXGFR-PKOBYXMFSA-N	0	3	326.484	3.248	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)C[C@H](C)c2ccc(OC)cc2)CC1	ZINC001225525511	1375117677	/nfs/dbraw/zinc/11/76/77/1375117677.db2.gz	ONZGCSTVUJBFKJ-KRWDZBQOSA-N	0	3	342.483	3.040	20	30		EGEDHN
O=C(/C=C/C1CC1)N[C@@H]1CCCC[C@H]1NCC#Cc1ccc(F)cc1	ZINC001225560331	1375125021	/nfs/dbraw/zinc/12/50/21/1375125021.db2.gz	LWUQTMJHLMGKBG-HZFXBWRWSA-N	0	3	340.442	3.160	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NCC1CCN(Cc2ccc(C)c(F)c2)CC1	ZINC001225632166	1375136046	/nfs/dbraw/zinc/13/60/46/1375136046.db2.gz	ZBEPWPCIBVVZLW-MRXNPFEDSA-N	0	3	348.462	3.053	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)COCCCCCCCC)CC[C@@H]1C	ZINC001132107038	1375151331	/nfs/dbraw/zinc/15/13/31/1375151331.db2.gz	XAWBIYRZSZQGNS-RBUKOAKNSA-N	0	3	336.520	3.356	20	30		EGEDHN
CCc1[nH]ccc1C(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1	ZINC001225995944	1375186713	/nfs/dbraw/zinc/18/67/13/1375186713.db2.gz	RPEMFNQGEQRCHI-NHCUHLMSSA-N	0	3	349.478	3.259	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1CC[C@@H](C)N(CCc2cnn(CC)c2)C1	ZINC001132217897	1375216454	/nfs/dbraw/zinc/21/64/54/1375216454.db2.gz	IQMQLNJPTVBMJN-AEFFLSMTSA-N	0	3	346.519	3.017	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2ccccc2CC)CC[C@H]1C	ZINC001132260051	1375252030	/nfs/dbraw/zinc/25/20/30/1375252030.db2.gz	AGRAXZXNCSNGEH-SJLPKXTDSA-N	0	3	330.472	3.034	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC1CCN(C/C=C/c2ccccc2)CC1	ZINC001226455265	1375262725	/nfs/dbraw/zinc/26/27/25/1375262725.db2.gz	DOABYYHCCMECAL-MZEUMTGBSA-N	0	3	342.483	3.262	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CCCC[C@H]1NCc1cccnc1OC	ZINC001226474419	1375264263	/nfs/dbraw/zinc/26/42/63/1375264263.db2.gz	LRJLEGDKLICSLX-IAGOWNOFSA-N	0	3	345.487	3.210	20	30		EGEDHN
C=CCCC(=O)NC1CCN(CCOc2cccc(CC)c2)CC1	ZINC001226518340	1375273250	/nfs/dbraw/zinc/27/32/50/1375273250.db2.gz	GNNDXWXHEVCPER-UHFFFAOYSA-N	0	3	330.472	3.175	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CC[C@@H](C)N(CCc2cnn(CC)c2)C1	ZINC001132330565	1375310284	/nfs/dbraw/zinc/31/02/84/1375310284.db2.gz	JFUBMMYONNNKJN-SJLPKXTDSA-N	0	3	346.519	3.017	20	30		EGEDHN
C=CCOCCCC(=O)NC1CCN(Cc2ccc(CC)cc2)CC1	ZINC001226769860	1375330200	/nfs/dbraw/zinc/33/02/00/1375330200.db2.gz	QFMVHCXURCGGFT-UHFFFAOYSA-N	0	3	344.499	3.312	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2cccc(C)c2C)CC[C@H]1C	ZINC001132458524	1375401418	/nfs/dbraw/zinc/40/14/18/1375401418.db2.gz	WEPLTTSAEPJJQA-AEFFLSMTSA-N	0	3	330.472	3.089	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCCOc2ccccc2F)CC[C@@H]1C	ZINC001132504478	1375429373	/nfs/dbraw/zinc/42/93/73/1375429373.db2.gz	JKCXVLCEMLJYCG-JKSUJKDBSA-N	0	3	334.435	3.140	20	30		EGEDHN
C[C@H](CC(F)F)C(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1	ZINC001227582971	1375447254	/nfs/dbraw/zinc/44/72/54/1375447254.db2.gz	OCTGQRZGUGFLSQ-KBAYOESNSA-N	0	3	348.437	3.346	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CCCC[C@H]1NCc1cccnc1OC	ZINC001227917488	1375490393	/nfs/dbraw/zinc/49/03/93/1375490393.db2.gz	WMVPDPVMDCIHDX-IAGOWNOFSA-N	0	3	345.487	3.210	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CCCC[C@H]1N[C@@H](C)c1n[nH]c(CC)n1	ZINC001227926109	1375492534	/nfs/dbraw/zinc/49/25/34/1375492534.db2.gz	WRXGPHCSZCMZFD-RRFJBIMHSA-N	0	3	347.507	3.047	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](C)[C@@H](CNCc2csc(C)n2)C1	ZINC001132773710	1375555890	/nfs/dbraw/zinc/55/58/90/1375555890.db2.gz	OYDZAOHXCWGEIO-WBVHZDCISA-N	0	3	347.528	3.219	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](C)[C@@H](CNCc2nc(C)sc2C)C1	ZINC001132786218	1375563859	/nfs/dbraw/zinc/56/38/59/1375563859.db2.gz	QHDWPGXPQUQRPH-PBHICJAKSA-N	0	3	347.528	3.138	20	30		EGEDHN
Cc1cnc(CNC[C@H]2CN(C(=O)C#CC(C)(C)C)CC[C@H]2C)s1	ZINC001132820412	1375582975	/nfs/dbraw/zinc/58/29/75/1375582975.db2.gz	VFWNFZQIAWPOEE-ZBFHGGJFSA-N	0	3	347.528	3.075	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NC1CCN(CCOc2ccccc2C)CC1	ZINC001228747477	1375660828	/nfs/dbraw/zinc/66/08/28/1375660828.db2.gz	BGOKCCNEODGCIE-WMZOPIPTSA-N	0	3	344.499	3.413	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@H](C)[C@H](CNCc3nccs3)C2)CC1	ZINC001133105519	1375777960	/nfs/dbraw/zinc/77/79/60/1375777960.db2.gz	UTQCPXFUYMWIOB-JKSUJKDBSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC1CCN(Cc2ccccc2N(C)C)CC1	ZINC001229376904	1375821823	/nfs/dbraw/zinc/82/18/23/1375821823.db2.gz	MJMRRRXLHWZVDX-UHFFFAOYSA-N	0	3	343.515	3.436	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)CCSCC	ZINC001133385390	1375968879	/nfs/dbraw/zinc/96/88/79/1375968879.db2.gz	KVMDWEDGKQFXDS-UHFFFAOYSA-N	0	3	338.904	3.035	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C[C@@H]1CC[C@H]2C[C@H]21	ZINC001133399382	1375983181	/nfs/dbraw/zinc/98/31/81/1375983181.db2.gz	LOWHAIQFJYOODQ-JENIJYKNSA-N	0	3	344.886	3.328	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)C/C=C/c2ccc(C)cc2)CC1	ZINC001230496594	1376040267	/nfs/dbraw/zinc/04/02/67/1376040267.db2.gz	DBCBUQJUJJUQIW-SNAWJCMRSA-N	0	3	342.483	3.182	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)c1cccc(F)c1	ZINC001133563580	1376091130	/nfs/dbraw/zinc/09/11/30/1376091130.db2.gz	JWEWPYFXCSUKKB-RYUDHWBXSA-N	0	3	343.240	3.221	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)Cc1ccsc1	ZINC001133564936	1376092559	/nfs/dbraw/zinc/09/25/59/1376092559.db2.gz	TVFBZVHXGMJIST-VXGBXAGGSA-N	0	3	345.306	3.072	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)[C@H](C)OCCCC)Cc1cccnc1	ZINC001230701178	1376129760	/nfs/dbraw/zinc/12/97/60/1376129760.db2.gz	IDKLCZXRTFHYOM-SFHVURJKSA-N	0	3	347.503	3.171	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1ccccc1C#N)NC(=O)c1cc(Cl)c[nH]1	ZINC001133670762	1376146850	/nfs/dbraw/zinc/14/68/50/1376146850.db2.gz	FCHKKIQUQDYZNF-QWHCGFSZSA-N	0	3	344.846	3.226	20	30		EGEDHN
Cc1ccoc1C(=O)N[C@@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001133678722	1376149387	/nfs/dbraw/zinc/14/93/87/1376149387.db2.gz	GEKXGGMLYOWECW-CABCVRRESA-N	0	3	325.412	3.146	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)c1ccc(Cl)o1)NCc1ccccc1C#N	ZINC001133689058	1376156816	/nfs/dbraw/zinc/15/68/16/1376156816.db2.gz	UQIOYUGFBIPPBN-OLZOCXBDSA-N	0	3	345.830	3.491	20	30		EGEDHN
CN(C[C@@H]1CCN1CCC1CCCCCC1)C(=O)CSCC#N	ZINC001230814602	1376157057	/nfs/dbraw/zinc/15/70/57/1376157057.db2.gz	DYHIQKYSUJPLMS-KRWDZBQOSA-N	0	3	337.533	3.136	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)CC/C=C/c2ccccc2)s1	ZINC001133699981	1376163707	/nfs/dbraw/zinc/16/37/07/1376163707.db2.gz	CDLUDRCRMGTYCW-XBXARRHUSA-N	0	3	339.464	3.319	20	30		EGEDHN
C#CCCN(CCCNC(=O)[C@@](C)(C=C)CC)Cc1cccnc1	ZINC001230838933	1376163999	/nfs/dbraw/zinc/16/39/99/1376163999.db2.gz	XAGJAGTTWIYJPX-FQEVSTJZSA-N	0	3	327.472	3.016	20	30		EGEDHN
C/C(=C/C(=O)N[C@H](C)C[C@H](C)NCc1cc(F)ccc1C#N)C1CC1	ZINC001133867074	1376242827	/nfs/dbraw/zinc/24/28/27/1376242827.db2.gz	PQBYVGRUEXKXDW-QUWCCNNGSA-N	0	3	343.446	3.427	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)CCC(F)(F)F)NCc1ccccc1C#N	ZINC001134003626	1376306334	/nfs/dbraw/zinc/30/63/34/1376306334.db2.gz	LCOGDQUECGKFRB-STQMWFEESA-N	0	3	341.377	3.274	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)NCCNC1c2ccccc2-c2ccccc21	ZINC001134053338	1376332032	/nfs/dbraw/zinc/33/20/32/1376332032.db2.gz	SRSWKAXPYDAARD-UXHICEINSA-N	0	3	348.446	3.053	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1cc(F)ccc1C#N)NC(=O)C=C1CCC1	ZINC001134113777	1376374222	/nfs/dbraw/zinc/37/42/22/1376374222.db2.gz	FQEBAERWCJAHOS-UONOGXRCSA-N	0	3	329.419	3.181	20	30		EGEDHN
CN(CCCN(C)C(=O)C1CC(C)(C)C1)Cc1ccc(F)c(C#N)c1	ZINC001327202229	1388441075	/nfs/dbraw/zinc/44/10/75/1388441075.db2.gz	WPWNWMXAKOWDBJ-UHFFFAOYSA-N	0	3	345.462	3.414	20	30		EGEDHN
C#CCCCC(=O)N[C@@H](C)C[C@@H](C)NCc1oc(C(C)C)nc1C	ZINC001134201848	1376415566	/nfs/dbraw/zinc/41/55/66/1376415566.db2.gz	SWZAJCMDSOJIJE-CABCVRRESA-N	0	3	333.476	3.283	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2c(F)ccc(F)c2Cl)c1	ZINC001134254724	1376438224	/nfs/dbraw/zinc/43/82/24/1376438224.db2.gz	JDVUSMKVLGZWMU-UHFFFAOYSA-N	0	3	349.768	3.009	20	30		EGEDHN
C[C@@H](CC(=O)NCCNCc1ccc(C#N)c(F)c1)CC(C)(C)C	ZINC001134258189	1376441712	/nfs/dbraw/zinc/44/17/12/1376441712.db2.gz	CSOQOOLSLPLWHJ-AWEZNQCLSA-N	0	3	333.451	3.366	20	30		EGEDHN
COc1cc(CN2CCC3SC(=O)C=C3C2)c(OC)cc1Cl	ZINC001232371469	1376452961	/nfs/dbraw/zinc/45/29/61/1376452961.db2.gz	GMOYDKNMMXNJAO-OAHLLOKOSA-N	0	3	339.844	3.131	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)c1cc(C)cs1	ZINC001134281020	1376454986	/nfs/dbraw/zinc/45/49/86/1376454986.db2.gz	VKYYHKZRVXMXFC-NWDGAFQWSA-N	0	3	345.306	3.452	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)C2[C@H]3CCCCCC[C@H]23)s1	ZINC001134315070	1376470085	/nfs/dbraw/zinc/47/00/85/1376470085.db2.gz	WGBUODPDAJPWSQ-HOTGVXAUSA-N	0	3	331.485	3.042	20	30		EGEDHN
C=CCCCCC[NH2+][C@@H](C)C[C@@H](C)NC(=O)c1cccc2n[n-]nc21	ZINC001134410634	1376515296	/nfs/dbraw/zinc/51/52/96/1376515296.db2.gz	ZDCCGEAOUBVPAI-LSDHHAIUSA-N	0	3	343.475	3.191	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@H](C)C[C@H](C)NCc1cc(C)no1	ZINC001134457947	1376549329	/nfs/dbraw/zinc/54/93/29/1376549329.db2.gz	WFGYIICVEYOCPY-WDEREUQCSA-N	0	3	327.856	3.135	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H](C)C[C@H](C)NCc1nccn1C(F)F	ZINC001134470028	1376555065	/nfs/dbraw/zinc/55/50/65/1376555065.db2.gz	LJAIIVZBKXVEQV-STQMWFEESA-N	0	3	328.407	3.007	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCCN(Cc3cc(Cl)ncc3O)C2)cc1	ZINC001233037675	1376558614	/nfs/dbraw/zinc/55/86/14/1376558614.db2.gz	GPTOXBYIHPIIJO-INIZCTEOSA-N	0	3	343.814	3.356	20	30		EGEDHN
N#Cc1ccc(C[NH+]2CCC3(CN(Cc4ccccc4)C3)CC2)c([O-])c1	ZINC001233386746	1376633332	/nfs/dbraw/zinc/63/33/32/1376633332.db2.gz	HHTXOCVJCZWPCJ-UHFFFAOYSA-N	0	3	347.462	3.362	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CCC[N@@H+]3CC3CC3)CC2)c([O-])c1	ZINC001233384267	1376635277	/nfs/dbraw/zinc/63/52/77/1376635277.db2.gz	OUEOLKBETSDIGE-UHFFFAOYSA-N	0	3	325.456	3.104	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CCC[N@H+]3CC3CC3)CC2)c([O-])c1	ZINC001233384267	1376635279	/nfs/dbraw/zinc/63/52/79/1376635279.db2.gz	OUEOLKBETSDIGE-UHFFFAOYSA-N	0	3	325.456	3.104	20	30		EGEDHN
CN(C[C@@H]1CCN1CC/C=C\c1ccccc1)C(=O)c1c[nH]c(C#N)c1	ZINC001233743055	1376708511	/nfs/dbraw/zinc/70/85/11/1376708511.db2.gz	URGPBXOFEGTQKN-JUIXODQZSA-N	0	3	348.450	3.136	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)C1(F)CCCC1	ZINC001134792138	1376726250	/nfs/dbraw/zinc/72/62/50/1376726250.db2.gz	ZAEPCCNZLZKIJV-NEPJUHHUSA-N	0	3	335.261	3.050	20	30		EGEDHN
C=CCCCN1CC[C@H]1CN(C)C(=O)[C@](C)(OC)c1ccccc1F	ZINC001235125069	1376854875	/nfs/dbraw/zinc/85/48/75/1376854875.db2.gz	VCDCVUCRYMKXKL-OXJNMPFZSA-N	0	3	348.462	3.186	20	30		EGEDHN
C=CC1(CC(=O)NCCNCc2ccc(C)nc2C)CCCCC1	ZINC001135190768	1376963656	/nfs/dbraw/zinc/96/36/56/1376963656.db2.gz	MLKSABLSTCUMKG-UHFFFAOYSA-N	0	3	329.488	3.431	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N[C@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001135242593	1376997597	/nfs/dbraw/zinc/99/75/97/1376997597.db2.gz	BOOBTKNCWCRUEO-UTZIXYHNSA-N	0	3	325.456	3.454	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)C1(CC)CCC1	ZINC001135256772	1377007147	/nfs/dbraw/zinc/00/71/47/1377007147.db2.gz	WPANUGADZSWIJF-STQMWFEESA-N	0	3	331.298	3.348	20	30		EGEDHN
C[C@@]1(C(=O)NCCNCc2cccc(C#N)c2)CCCc2ccccc21	ZINC001135349727	1377047627	/nfs/dbraw/zinc/04/76/27/1377047627.db2.gz	AXXSYOFHWMDZAT-JOCHJYFZSA-N	0	3	347.462	3.058	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)C1(C)CC=CC1	ZINC001135410772	1377080395	/nfs/dbraw/zinc/08/03/95/1377080395.db2.gz	GDBQPYINBKRLQT-OLZOCXBDSA-N	0	3	329.282	3.124	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)C[C@@H](C)NC(=O)c1cc(=O)c2ccccc2o1	ZINC001136071584	1377327174	/nfs/dbraw/zinc/32/71/74/1377327174.db2.gz	PJPFDZMBJUFOJN-QWHCGFSZSA-N	0	3	348.830	3.032	20	30		EGEDHN
C[C@H](CCNC(=O)c1ccnc(C2CC2)c1)NCc1ccccc1C#N	ZINC001267133707	1377416520	/nfs/dbraw/zinc/41/65/20/1377416520.db2.gz	LSBHDOXUXGRDSE-OAHLLOKOSA-N	0	3	348.450	3.129	20	30		EGEDHN
C=CCOC(=O)N[C@@H]1CCCN(Cc2cccc3ncccc23)C1	ZINC001137632643	1377576982	/nfs/dbraw/zinc/57/69/82/1377576982.db2.gz	GMFWEDUFRSRFIE-MRXNPFEDSA-N	0	3	325.412	3.111	20	30		EGEDHN
C#CCOc1ccc(CN2CCC[C@@H](Oc3cccc(C)n3)C2)cc1	ZINC001138560822	1377742789	/nfs/dbraw/zinc/74/27/89/1377742789.db2.gz	PGTSHIOYGLAMIU-HXUWFJFHSA-N	0	3	336.435	3.445	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@H](F)[C@](O)(C(F)(F)F)CC2)c1[O-]	ZINC001138625919	1377756206	/nfs/dbraw/zinc/75/62/06/1377756206.db2.gz	WYJQASJOCTTXQU-HOCLYGCPSA-N	0	3	347.352	3.348	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@H](F)[C@](O)(C(F)(F)F)CC2)c1[O-]	ZINC001138625919	1377756207	/nfs/dbraw/zinc/75/62/07/1377756207.db2.gz	WYJQASJOCTTXQU-HOCLYGCPSA-N	0	3	347.352	3.348	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@H]3[C@@H](CCN3C(=O)C(C)C)C2)c1[O-]	ZINC001138627241	1377756844	/nfs/dbraw/zinc/75/68/44/1377756844.db2.gz	AJZPDRDBDYJZSI-HKUYNNGSSA-N	0	3	342.483	3.200	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@H]3[C@@H](CCN3C(=O)C(C)C)C2)c1[O-]	ZINC001138627241	1377756845	/nfs/dbraw/zinc/75/68/45/1377756845.db2.gz	AJZPDRDBDYJZSI-HKUYNNGSSA-N	0	3	342.483	3.200	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@H](Oc3nccc(C)n3)C2)c1[O-]	ZINC001138631720	1377758187	/nfs/dbraw/zinc/75/81/87/1377758187.db2.gz	ZTVVHVSSKRMKNE-SFHVURJKSA-N	0	3	339.439	3.263	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@H](Oc3nccc(C)n3)C2)c1[O-]	ZINC001138631720	1377758192	/nfs/dbraw/zinc/75/81/92/1377758192.db2.gz	ZTVVHVSSKRMKNE-SFHVURJKSA-N	0	3	339.439	3.263	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@@H](Oc3ncc(C)cn3)C2)c1[O-]	ZINC001138630847	1377758325	/nfs/dbraw/zinc/75/83/25/1377758325.db2.gz	FDDQMRIRUXJVSK-GOSISDBHSA-N	0	3	339.439	3.263	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@@H](Oc3ncc(C)cn3)C2)c1[O-]	ZINC001138630847	1377758328	/nfs/dbraw/zinc/75/83/28/1377758328.db2.gz	FDDQMRIRUXJVSK-GOSISDBHSA-N	0	3	339.439	3.263	20	30		EGEDHN
C[C@H]1CC[C@@H](CO)CN1Cc1ccc(Oc2ccc(C#N)cc2)nc1	ZINC001139427186	1377882301	/nfs/dbraw/zinc/88/23/01/1377882301.db2.gz	XHAPWLXLJNBUGU-MAUKXSAKSA-N	0	3	337.423	3.338	20	30		EGEDHN
Cc1ccc(CN2CCC[C@H](C(=O)N3CCCCC3)C2)cc1C#N	ZINC001139723781	1377941678	/nfs/dbraw/zinc/94/16/78/1377941678.db2.gz	GCRYCDDLJZGTCB-SFHVURJKSA-N	0	3	325.456	3.091	20	30		EGEDHN
C=CCn1cc(CN2CCC(CCNC(=O)OC(C)(C)C)CC2)cn1	ZINC001139768537	1377948274	/nfs/dbraw/zinc/94/82/74/1377948274.db2.gz	PMQZWCXNPKZOJC-UHFFFAOYSA-N	0	3	348.491	3.196	20	30		EGEDHN
C=CCn1cc(CN(C)C[C@H]2CCCN(C(=O)OC(C)(C)C)C2)cn1	ZINC001139772576	1377949015	/nfs/dbraw/zinc/94/90/15/1377949015.db2.gz	LINOTANRIGSJJC-MRXNPFEDSA-N	0	3	348.491	3.148	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CCN(Cc3ccc(C)cn3)C2)C1	ZINC001139837671	1377959457	/nfs/dbraw/zinc/95/94/57/1377959457.db2.gz	MVXRIKIHROGEMQ-IBGZPJMESA-N	0	3	329.444	3.001	20	30		EGEDHN
Cn1c(CN2CCCN(c3ccc(C#N)cn3)CC2)cc2ccccc21	ZINC001139871946	1377967849	/nfs/dbraw/zinc/96/78/49/1377967849.db2.gz	XOYZRNWMXIBWCX-UHFFFAOYSA-N	0	3	345.450	3.157	20	30		EGEDHN
Cn1ncc2ccc(CN3CCC[C@H](Oc4ccc(C#N)cc4)C3)cc21	ZINC001139910298	1377976591	/nfs/dbraw/zinc/97/65/91/1377976591.db2.gz	KXHXFIGSEDEQCO-FQEVSTJZSA-N	0	3	346.434	3.488	20	30		EGEDHN
Cn1ncc2cc(CN3CCC(Oc4ccccc4C#N)CC3)ccc21	ZINC001139952630	1377982760	/nfs/dbraw/zinc/98/27/60/1377982760.db2.gz	RUHDQUUXEACTDU-UHFFFAOYSA-N	0	3	346.434	3.488	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCC[N@@H+](Cc1cc(F)ccc1[O-])[C@@H]2CC	ZINC001140062856	1377999311	/nfs/dbraw/zinc/99/93/11/1377999311.db2.gz	GTMXJBFNLUJGDM-QUCCMNQESA-N	0	3	346.446	3.453	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCC[N@H+](Cc1cc(F)ccc1[O-])[C@@H]2CC	ZINC001140062856	1377999313	/nfs/dbraw/zinc/99/93/13/1377999313.db2.gz	GTMXJBFNLUJGDM-QUCCMNQESA-N	0	3	346.446	3.453	20	30		EGEDHN
CCO[C@@H]1CO[C@@]2(C1)CCCN(Cc1c[nH]c3ccc(C#N)cc13)C2	ZINC001140113738	1378010652	/nfs/dbraw/zinc/01/06/52/1378010652.db2.gz	JXECTBZOALTGRO-FXAWDEMLSA-N	0	3	339.439	3.200	20	30		EGEDHN
Cc1cnc2n1CCC21CCN(Cc2c[nH]c3ccc(C#N)cc23)CC1	ZINC001140112532	1378010733	/nfs/dbraw/zinc/01/07/33/1378010733.db2.gz	OGHZCWPBHLKWRQ-UHFFFAOYSA-N	0	3	345.450	3.482	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3c[nH]c4ccc(C#N)cc34)C2)C1=O	ZINC001140112954	1378010932	/nfs/dbraw/zinc/01/09/32/1378010932.db2.gz	PCOYREHBWGVNCE-OAQYLSRUSA-N	0	3	348.450	3.040	20	30		EGEDHN
N#Cc1ccc2[nH]cc(CN3CCC[C@H](Oc4cccnc4)C3)c2c1	ZINC001140114481	1378010974	/nfs/dbraw/zinc/01/09/74/1378010974.db2.gz	QZNMKNZNQFUFIT-SFHVURJKSA-N	0	3	332.407	3.478	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CN(Cc3cc(C)c(O)cc3C)C2)CC1	ZINC001140196880	1378030112	/nfs/dbraw/zinc/03/01/12/1378030112.db2.gz	CGMMETIGJCWUTM-UHFFFAOYSA-N	0	3	344.455	3.229	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@@H]1CCN(Cc1cc(F)cc(OC)c1)C2	ZINC001140480616	1378070007	/nfs/dbraw/zinc/07/00/07/1378070007.db2.gz	OPSUHHIYQYNFRH-WOJBJXKFSA-N	0	3	349.446	3.408	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CCC(=O)N(CC(F)F)C3)CC2)c1	ZINC001272651923	1378077239	/nfs/dbraw/zinc/07/72/39/1378077239.db2.gz	ZPBJSIZCKBDHNB-UHFFFAOYSA-N	0	3	347.409	3.028	20	30		EGEDHN
CCCN(Cc1ccc(C#N)nc1)[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC001140546832	1378082874	/nfs/dbraw/zinc/08/28/74/1378082874.db2.gz	WFRMLQKHGDCPMW-KRWDZBQOSA-N	0	3	344.459	3.175	20	30		EGEDHN
C=CCOC(=O)N[C@@H]1CCCN(Cc2cccc3ccncc32)C1	ZINC001140646260	1378104183	/nfs/dbraw/zinc/10/41/83/1378104183.db2.gz	WNWOBGQQKRCSIR-QGZVFWFLSA-N	0	3	325.412	3.111	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1c(N)cccc1F)[C@H]2CC	ZINC001140872849	1378165420	/nfs/dbraw/zinc/16/54/20/1378165420.db2.gz	IKLHZBCUDRXLEJ-ICSRJNTNSA-N	0	3	345.462	3.330	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](NC(=O)c2ccoc2Cl)C2CC2)s1	ZINC001276576130	1378180204	/nfs/dbraw/zinc/18/02/04/1378180204.db2.gz	ZOGRLBTYLJJXHN-AWEZNQCLSA-N	0	3	349.843	3.164	20	30		EGEDHN
C=CCOC[C@H]1CCC[C@@]12CN(Cc1ccc(C)cc1O)CCO2	ZINC001140949666	1378189677	/nfs/dbraw/zinc/18/96/77/1378189677.db2.gz	HPCDMZOILWSMAF-UYAOXDASSA-N	0	3	331.456	3.274	20	30		EGEDHN
CCC[C@@H](C)CN1CCc2nc(C(=O)NC3(C#N)CCC3)ccc2C1	ZINC001278146424	1378259804	/nfs/dbraw/zinc/25/98/04/1378259804.db2.gz	MQNHSWHDCVOWRM-OAHLLOKOSA-N	0	3	340.471	3.052	20	30		EGEDHN
Cc1cccnc1N1CCC[C@]2(CCN(Cc3cc(C#N)n(C)c3)C2)C1	ZINC001280101429	1378328132	/nfs/dbraw/zinc/32/81/32/1378328132.db2.gz	FXUPBJMYVWPXLL-OAQYLSRUSA-N	0	3	349.482	3.093	20	30		EGEDHN
O[C@H]1CCN(Cc2ccc(C#Cc3ccccc3)s2)CC[C@H]1F	ZINC001141972458	1378400312	/nfs/dbraw/zinc/40/03/12/1378400312.db2.gz	KRQDFGRXYFRPHV-MOPGFXCFSA-N	0	3	329.440	3.443	20	30		EGEDHN
C=CCOC[C@@H]1CCC[C@@]12CN(Cc1cccc3n[nH]cc31)CCO2	ZINC001143091336	1378537164	/nfs/dbraw/zinc/53/71/64/1378537164.db2.gz	GIOYBMYXNXZJMG-FXAWDEMLSA-N	0	3	341.455	3.137	20	30		EGEDHN
CN(Cc1ccc(C#N)cn1)[C@H]1CC[C@H](NC(=O)OC(C)(C)C)CC1	ZINC001144166523	1378690587	/nfs/dbraw/zinc/69/05/87/1378690587.db2.gz	JGXDSOCBPLJURV-JCNLHEQBSA-N	0	3	344.459	3.221	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C[C@H](C)NCc2nccnc2C)CCCC1	ZINC001146821449	1378928542	/nfs/dbraw/zinc/92/85/42/1378928542.db2.gz	MEVOMRHUQPNGIF-JKSUJKDBSA-N	0	3	344.503	3.294	20	30		EGEDHN
C[C@@H](C(=O)NCCNCc1ccc(C#N)cc1)c1cc2ccccc2o1	ZINC001147201952	1378986224	/nfs/dbraw/zinc/98/62/24/1378986224.db2.gz	NRWVBYNSJCGPAK-OAHLLOKOSA-N	0	3	347.418	3.314	20	30		EGEDHN
CC(C)[C@@H](C)CC(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001147245419	1378996030	/nfs/dbraw/zinc/99/60/30/1378996030.db2.gz	MNYGZXSBICLHRI-KRWDZBQOSA-N	0	3	339.483	3.275	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@H](C)CCc3ccc(F)cc3)C2)C1	ZINC001147690436	1379060875	/nfs/dbraw/zinc/06/08/75/1379060875.db2.gz	SODQALSYCKLXDI-MRXNPFEDSA-N	0	3	330.447	3.115	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)CCCC4CC4)C3)C2)c1	ZINC001148117151	1379120470	/nfs/dbraw/zinc/12/04/70/1379120470.db2.gz	NMSQFZANLFTTCM-UHFFFAOYSA-N	0	3	337.467	3.173	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)N1CC2(C1)CCN(Cc1sc(C)nc1C)C2	ZINC001148137976	1379123167	/nfs/dbraw/zinc/12/31/67/1379123167.db2.gz	KHUUJEFOZXEIHF-UONOGXRCSA-N	0	3	347.528	3.252	20	30		EGEDHN
CCCC(C)(C)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001148187807	1379130668	/nfs/dbraw/zinc/13/06/68/1379130668.db2.gz	AVSZNILSBHRXIL-UHFFFAOYSA-N	0	3	339.483	3.419	20	30		EGEDHN
CC[C@H](C)[C@@H](C)C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001148500821	1379193845	/nfs/dbraw/zinc/19/38/45/1379193845.db2.gz	LRJJFVFZFAEODN-DLBZAZTESA-N	0	3	339.483	3.275	20	30		EGEDHN
CCCCCCCCCC(=O)NCCNCc1ccc(OC)nc1	ZINC001148820019	1379275824	/nfs/dbraw/zinc/27/58/24/1379275824.db2.gz	AAWDWVOYDKLBNU-UHFFFAOYSA-N	0	3	335.492	3.437	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc3ccccc3c2)s1	ZINC001148870928	1379287611	/nfs/dbraw/zinc/28/76/11/1379287611.db2.gz	UCDBHZBJFGTJCC-UHFFFAOYSA-N	0	3	335.432	3.293	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC[C@@H]1CN(CC2=CCCCC2)CCCO1	ZINC001149765169	1379441850	/nfs/dbraw/zinc/44/18/50/1379441850.db2.gz	SAONWZJXSYHQOR-HXUWFJFHSA-N	0	3	346.515	3.462	20	30		EGEDHN
C[C@@H](CC(=O)NCCNCc1ccc(C#N)s1)c1ccccc1	ZINC001149980872	1379477927	/nfs/dbraw/zinc/47/79/27/1379477927.db2.gz	YYUBQGJQVVKZGA-AWEZNQCLSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@H]1CN(CC2=CCCCC2)CCCO1	ZINC001150247881	1379523536	/nfs/dbraw/zinc/52/35/36/1379523536.db2.gz	RFSPFXYVBCHEKX-ICSRJNTNSA-N	0	3	334.504	3.296	20	30		EGEDHN
C#CCCN1CCCO[C@@H](CNC(=O)[C@@H](CCCCC)C(C)C)C1	ZINC001150562919	1379569632	/nfs/dbraw/zinc/56/96/32/1379569632.db2.gz	UDZHAYTUNWRIBD-OALUTQOASA-N	0	3	336.520	3.069	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)C(C)(C)c2ccc(C)cc2)C1	ZINC001150614741	1379580323	/nfs/dbraw/zinc/58/03/23/1379580323.db2.gz	YPYQIJXDNXWCLU-IBGZPJMESA-N	0	3	344.499	3.056	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)[C@H](CCC)c2ccccc2)C1	ZINC001150686228	1379595262	/nfs/dbraw/zinc/59/52/62/1379595262.db2.gz	XVRLBSYWKSXRTM-WOJBJXKFSA-N	0	3	344.499	3.354	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2cc(C)c(C)o2)CC1	ZINC001151062491	1379656111	/nfs/dbraw/zinc/65/61/11/1379656111.db2.gz	DCLSQNFBAGOEIZ-UHFFFAOYSA-N	0	3	334.460	3.073	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)C2CCC(=C)CC2)CC1	ZINC001151295260	1379695763	/nfs/dbraw/zinc/69/57/63/1379695763.db2.gz	YEJQKVPOGZBRKC-UHFFFAOYSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@H]2CCCCC2(C)C)CC1	ZINC001151415213	1379715815	/nfs/dbraw/zinc/71/58/15/1379715815.db2.gz	IFQZVGWOFGBIMH-QGZVFWFLSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2ccc(F)s2)CC1	ZINC001151415471	1379716148	/nfs/dbraw/zinc/71/61/48/1379716148.db2.gz	ULEHCCUQEZKGBQ-UHFFFAOYSA-N	0	3	340.464	3.064	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)c1ccc(F)cc1	ZINC001151571856	1379740057	/nfs/dbraw/zinc/74/00/57/1379740057.db2.gz	DBMOVMDSNARVGP-OAHLLOKOSA-N	0	3	339.414	3.338	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc(OC3CCC3)cc2)cc1	ZINC001151715535	1379767869	/nfs/dbraw/zinc/76/78/69/1379767869.db2.gz	DRIOUHXQTQGCMU-UHFFFAOYSA-N	0	3	349.434	3.009	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)C(=O)NCCNCc1cncc(C)c1	ZINC001151923299	1379816083	/nfs/dbraw/zinc/81/60/83/1379816083.db2.gz	UYNZIZKUPDQOKH-HXUWFJFHSA-N	0	3	337.467	3.031	20	30		EGEDHN
C=CCC1(C(=O)NCCNC[C@@H](O)c2ccccc2F)CCCCC1	ZINC001151997094	1379834350	/nfs/dbraw/zinc/83/43/50/1379834350.db2.gz	BODHVWWWKQHENG-GOSISDBHSA-N	0	3	348.462	3.092	20	30		EGEDHN
CC/C=C(\C)C(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)c(F)c1	ZINC001152189649	1379881954	/nfs/dbraw/zinc/88/19/54/1379881954.db2.gz	URLMSQHTUPKPNT-KEQVLUGWSA-N	0	3	331.435	3.380	20	30		EGEDHN
CCN(Cc1cccc(Cl)c1)[C@H](C)CNC(=O)c1cc(C#N)c[nH]1	ZINC001152628319	1379958588	/nfs/dbraw/zinc/95/85/88/1379958588.db2.gz	OUCZOWIDFOOHBS-CYBMUJFWSA-N	0	3	344.846	3.180	20	30		EGEDHN
CCCC[C@@H](C(=O)NCCNCc1ccc(F)c(C#N)c1)C(C)C	ZINC001152652943	1379963063	/nfs/dbraw/zinc/96/30/63/1379963063.db2.gz	OHNJYHRDJHVERD-QGZVFWFLSA-N	0	3	333.451	3.366	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)Cc1ccc(C)o1	ZINC001152813554	1379982922	/nfs/dbraw/zinc/98/29/22/1379982922.db2.gz	YKZOHRNNIQLXGS-OAHLLOKOSA-N	0	3	339.439	3.029	20	30		EGEDHN
C=CCC[C@@H](C(=O)NCCNCc1cncc(C)c1)c1ccccc1	ZINC001153818139	1380136109	/nfs/dbraw/zinc/13/61/09/1380136109.db2.gz	YBKRSVQYWVSMLX-HXUWFJFHSA-N	0	3	337.467	3.346	20	30		EGEDHN
Cc1ccc(/C=C\CC(=O)NCCNCc2ccc(C#N)cc2)cc1	ZINC001153979401	1380167559	/nfs/dbraw/zinc/16/75/59/1380167559.db2.gz	AVABNJDERGTQFD-IHWYPQMZSA-N	0	3	333.435	3.176	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)c(F)c1	ZINC001154957807	1380381303	/nfs/dbraw/zinc/38/13/03/1380381303.db2.gz	PXFPOLJMSGJVHD-OAHLLOKOSA-N	0	3	331.435	3.380	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)C(C)(C)CC	ZINC001154963924	1380382028	/nfs/dbraw/zinc/38/20/28/1380382028.db2.gz	WBUPAGUAIDOCNA-CQSZACIVSA-N	0	3	333.451	3.460	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)c1occc1Cl	ZINC001155085522	1380405885	/nfs/dbraw/zinc/40/58/85/1380405885.db2.gz	OVQHETZTNMZMSC-CYBMUJFWSA-N	0	3	345.830	3.445	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)C1(C(C)C)CC1	ZINC001155142650	1380415775	/nfs/dbraw/zinc/41/57/75/1380415775.db2.gz	YNVDJUBRAWUFOI-OAHLLOKOSA-N	0	3	345.462	3.460	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)[C@H](C)c1ccco1	ZINC001155204761	1380424944	/nfs/dbraw/zinc/42/49/44/1380424944.db2.gz	KGSNJPDHUGLROS-HZPDHXFCSA-N	0	3	339.439	3.282	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1cccc(Cl)c1Cl	ZINC001156602111	1380598796	/nfs/dbraw/zinc/59/87/96/1380598796.db2.gz	MLNKBGDERMUWGB-GFCCVEGCSA-N	0	3	327.255	3.457	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@H]1CCCCc2ccccc21	ZINC001157171007	1380793991	/nfs/dbraw/zinc/79/39/91/1380793991.db2.gz	DGWOWNKGGFRPSE-XLIONFOSSA-N	0	3	326.484	3.347	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)CC(C)(C)C)CCN1Cc1ccc(C#N)cc1	ZINC001328224744	1388693034	/nfs/dbraw/zinc/69/30/34/1388693034.db2.gz	ULSDASVYVDUCLB-QAPCUYQASA-N	0	3	327.472	3.464	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)[C@@H]2CCCC3(CC3)C2)c(F)c1	ZINC001158011381	1381102698	/nfs/dbraw/zinc/10/26/98/1381102698.db2.gz	VLHGMGDZNPLYFG-MRXNPFEDSA-N	0	3	343.446	3.264	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc(C)n([C@@H](C)CC)n1	ZINC001158154935	1381143891	/nfs/dbraw/zinc/14/38/91/1381143891.db2.gz	CUACQLCTHNQSQF-DOTOQJQBSA-N	0	3	332.492	3.275	20	30		EGEDHN
CC(C)(C)C[C@@H]1C[C@H]1C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001158390059	1381228373	/nfs/dbraw/zinc/22/83/73/1381228373.db2.gz	PDVLEYJYGWIMCS-DOTOQJQBSA-N	0	3	345.462	3.366	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc(Br)co1	ZINC001158554811	1381296744	/nfs/dbraw/zinc/29/67/44/1381296744.db2.gz	OULNWTBFKDLTIZ-CYBMUJFWSA-N	0	3	341.249	3.155	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1oc(CC(C)C)nc1C	ZINC001158565551	1381302758	/nfs/dbraw/zinc/30/27/58/1381302758.db2.gz	QHADEMHNRMLRLK-MRXNPFEDSA-N	0	3	333.476	3.294	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cccc(-c2cnco2)c1	ZINC001158689787	1381354452	/nfs/dbraw/zinc/35/44/52/1381354452.db2.gz	SPKYJYQPLJQLEG-GOSISDBHSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCCNCc1oc(CCC)nc1C	ZINC001158746781	1381379772	/nfs/dbraw/zinc/37/97/72/1381379772.db2.gz	HNLYDWUKBLKNAW-UHFFFAOYSA-N	0	3	333.476	3.300	20	30		EGEDHN
Cc1scc(C(=O)NCCCNCc2cc(C#N)ccc2F)c1C	ZINC001158798045	1381404732	/nfs/dbraw/zinc/40/47/32/1381404732.db2.gz	KVCKEBMNVFENMK-UHFFFAOYSA-N	0	3	345.443	3.285	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc(Br)o1	ZINC001158801222	1381405645	/nfs/dbraw/zinc/40/56/45/1381405645.db2.gz	XZBHDIJBQLFRND-GFCCVEGCSA-N	0	3	341.249	3.155	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)CCOc1cccc(C)c1	ZINC001158865908	1381441774	/nfs/dbraw/zinc/44/17/74/1381441774.db2.gz	KIVCZVAMJGFYSU-GOSISDBHSA-N	0	3	330.472	3.263	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc(N(CC)CC)nc1	ZINC001158949636	1381481565	/nfs/dbraw/zinc/48/15/65/1381481565.db2.gz	SFCMUNVYZOHQCV-GOSISDBHSA-N	0	3	344.503	3.040	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cccc3scnc32)CC1	ZINC001160131731	1382008518	/nfs/dbraw/zinc/00/85/18/1382008518.db2.gz	UDTIAZMXJIPXFR-UHFFFAOYSA-N	0	3	327.453	3.234	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2sc(C3CC3)nc2C)CC1	ZINC001160142488	1382014832	/nfs/dbraw/zinc/01/48/32/1382014832.db2.gz	MBEHVWZNDMPKIH-UHFFFAOYSA-N	0	3	343.496	3.104	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)Cc2coc3cc(F)ccc23)CC1	ZINC001160142675	1382014952	/nfs/dbraw/zinc/01/49/52/1382014952.db2.gz	RYSBVGWMVUVUAM-UHFFFAOYSA-N	0	3	342.414	3.439	20	30		EGEDHN
C=CCOc1ccc(C(=O)NCCC2=CCN(CC=C)CC2)cc1	ZINC001160537662	1382136042	/nfs/dbraw/zinc/13/60/42/1382136042.db2.gz	QGYWYYSKJYDHJV-UHFFFAOYSA-N	0	3	326.440	3.189	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)Cc2cccc(C(F)F)c2)CC1	ZINC001160665735	1382165119	/nfs/dbraw/zinc/16/51/19/1382165119.db2.gz	FJDZKPAMLQZPCB-UHFFFAOYSA-N	0	3	334.410	3.491	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cncc3sccc32)CC1	ZINC001160997274	1382266422	/nfs/dbraw/zinc/26/64/22/1382266422.db2.gz	MRDNHSJYRPZMQQ-UHFFFAOYSA-N	0	3	339.464	3.072	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@H](CCC)c2ccccn2)CC1	ZINC001161013563	1382272119	/nfs/dbraw/zinc/27/21/19/1382272119.db2.gz	FIODDBOOZRCANJ-LJQANCHMSA-N	0	3	339.483	3.127	20	30		EGEDHN
N#Cc1ccc(CN2CC=C(CCNC(=O)C3CC4(CC4)C3)CC2)cc1	ZINC001161189380	1382334001	/nfs/dbraw/zinc/33/40/01/1382334001.db2.gz	LQBODDFGYLAGDQ-UHFFFAOYSA-N	0	3	349.478	3.387	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@H](C)Cc2cccs2)CC1	ZINC001161382876	1382390708	/nfs/dbraw/zinc/39/07/08/1382390708.db2.gz	CPSYCRHTMVLNMP-MRXNPFEDSA-N	0	3	330.497	3.088	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H]2C[C@H]2c2ccccc2OC)CC1	ZINC001161421970	1382404169	/nfs/dbraw/zinc/40/41/69/1382404169.db2.gz	AXVKAQNVZFSWDX-RBUKOAKNSA-N	0	3	340.467	3.123	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C[C@H]2CCc3ccccc32)CC1	ZINC001161510221	1382426720	/nfs/dbraw/zinc/42/67/20/1382426720.db2.gz	ZIYQSMIPVVBQHW-HXUWFJFHSA-N	0	3	336.479	3.268	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H]2C[C@]23CCc2ccccc23)CC1	ZINC001161617811	1382461060	/nfs/dbraw/zinc/46/10/60/1382461060.db2.gz	UDXPDSYOZZBHIN-GMAHTHKFSA-N	0	3	348.490	3.052	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2sc(CCC)nc2C)CC1	ZINC001161863182	1382533526	/nfs/dbraw/zinc/53/35/26/1382533526.db2.gz	OEOXNFGOCKJBRJ-UHFFFAOYSA-N	0	3	333.501	3.342	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc(C)c(F)c(C)c2)CC1	ZINC001161893647	1382543196	/nfs/dbraw/zinc/54/31/96/1382543196.db2.gz	OADBFSRBNMSLRA-UHFFFAOYSA-N	0	3	328.431	3.218	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2c(Cl)cccc2OC)CC1	ZINC001161938824	1382562045	/nfs/dbraw/zinc/56/20/45/1382562045.db2.gz	YKRUQUKZVRGBIU-UHFFFAOYSA-N	0	3	334.847	3.287	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H](C)c2cccc(OC)c2)CC1	ZINC001161952987	1382569386	/nfs/dbraw/zinc/56/93/86/1382569386.db2.gz	OCSQVZFEAVRJLL-INIZCTEOSA-N	0	3	328.456	3.123	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc(C)c3c2CCC3)CC1	ZINC001161963656	1382573812	/nfs/dbraw/zinc/57/38/12/1382573812.db2.gz	PEMZYKBIPAQZBS-UHFFFAOYSA-N	0	3	336.479	3.259	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)C2(C)CCC(C)CC2)(COC)CC1	ZINC001162623183	1382814108	/nfs/dbraw/zinc/81/41/08/1382814108.db2.gz	LBDQPTJWUFWFCD-UHFFFAOYSA-N	0	3	348.531	3.071	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)c1ccc(C)s1	ZINC001162666438	1382827170	/nfs/dbraw/zinc/82/71/70/1382827170.db2.gz	MJYMRRPPTUVNHL-UHFFFAOYSA-N	0	3	340.492	3.354	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@H]1[C@@H]2CCCC[C@@H]21	ZINC001162756615	1382860421	/nfs/dbraw/zinc/86/04/21/1382860421.db2.gz	NDDPBOWCLNXHBZ-AERCQKQUSA-N	0	3	338.495	3.107	20	30		EGEDHN
CO/N=C/c1cc(-n2c3ccccc3nc2[C@@H](C)N)cc(F)c1F	ZINC001162778379	1382869414	/nfs/dbraw/zinc/86/94/14/1382869414.db2.gz	KJHBITQLRVFULG-PRMNVEQPSA-N	0	3	330.338	3.304	20	30		EGEDHN
C#CCCCC(=O)N(CCNCc1cccnc1)CCc1ccccc1	ZINC001162790110	1382873840	/nfs/dbraw/zinc/87/38/40/1382873840.db2.gz	ACAILHLKEGZFSX-UHFFFAOYSA-N	0	3	349.478	3.046	20	30		EGEDHN
Cc1ccn2c(CNc3ccc(/N=C/N(C)C)c(C#N)c3)cnc2c1	ZINC001162822114	1382886245	/nfs/dbraw/zinc/88/62/45/1382886245.db2.gz	NZHLSCRSMLXBEH-YDZHTSKRSA-N	0	3	332.411	3.348	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@H](C)C1CCC1	ZINC001162841288	1382891708	/nfs/dbraw/zinc/89/17/08/1382891708.db2.gz	PSMZUOYDJKVSCN-GOSISDBHSA-N	0	3	326.484	3.107	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CC[C@@H]2C[C@@H]2CC1	ZINC001162870971	1382899861	/nfs/dbraw/zinc/89/98/61/1382899861.db2.gz	BNYBSBSYKJELNC-MZADTFQBSA-N	0	3	338.495	3.107	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C[C@@H]1CC=CCC1	ZINC001162888186	1382905371	/nfs/dbraw/zinc/90/53/71/1382905371.db2.gz	QTPFUDDSEYFXDR-OAQYLSRUSA-N	0	3	338.495	3.417	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)N(CCNCC#CC)CCc1ccccc1	ZINC001162892044	1382907198	/nfs/dbraw/zinc/90/71/98/1382907198.db2.gz	FIAJZQMEDMUTTJ-OALUTQOASA-N	0	3	326.484	3.129	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1ccc(CC)cc1	ZINC001162992790	1382941408	/nfs/dbraw/zinc/94/14/08/1382941408.db2.gz	WJZGBEQURBJPSC-UHFFFAOYSA-N	0	3	334.463	3.157	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)[C@@H]2CC[C@@H]3C[C@@H]3CC2)c1	ZINC001163008216	1382947313	/nfs/dbraw/zinc/94/73/13/1382947313.db2.gz	XZAIDTYADRAQMR-OSYLJGHBSA-N	0	3	343.446	3.120	20	30		EGEDHN
C=CCCN1CCN(Cc2ccc(CNC(=O)CCCC)cc2)CC1	ZINC001163017893	1382949214	/nfs/dbraw/zinc/94/92/14/1382949214.db2.gz	BAMISLRFEFNHSK-UHFFFAOYSA-N	0	3	343.515	3.187	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)Cc1cc2ccccc2o1	ZINC001163622896	1383091185	/nfs/dbraw/zinc/09/11/85/1383091185.db2.gz	CSGOQHPXYPKPRG-UHFFFAOYSA-N	0	3	347.418	3.143	20	30		EGEDHN
C=CCCC(=O)NCCC1(CNCc2ccc(C#N)cc2F)CC1	ZINC001163767649	1383120238	/nfs/dbraw/zinc/12/02/38/1383120238.db2.gz	UKBCOMAISOWALA-UHFFFAOYSA-N	0	3	329.419	3.040	20	30		EGEDHN
C=C(C)CCC(=O)NCCC1(CNCc2ccccc2[N+](=O)[O-])CC1	ZINC001165258712	1383259235	/nfs/dbraw/zinc/25/92/35/1383259235.db2.gz	MXHJWMSDYOEGDU-UHFFFAOYSA-N	0	3	345.443	3.327	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1cccc(Cl)c1F	ZINC001165657364	1383320443	/nfs/dbraw/zinc/32/04/43/1383320443.db2.gz	ONGGHVLIERMTBX-UHFFFAOYSA-N	0	3	345.805	3.260	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cnoc2-c2ccco2)CC1	ZINC001165809393	1383349011	/nfs/dbraw/zinc/34/90/11/1383349011.db2.gz	BNLPVCVLJPQGHR-UHFFFAOYSA-N	0	3	349.818	3.177	20	30		EGEDHN
C=C1CCC(C(=O)NCCCNCc2cc(C#N)ccc2F)CC1	ZINC001165907054	1383362880	/nfs/dbraw/zinc/36/28/80/1383362880.db2.gz	RBULTBYBFZSADI-UHFFFAOYSA-N	0	3	329.419	3.040	20	30		EGEDHN
C[C@@H](CC(F)F)C(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001166226577	1383404854	/nfs/dbraw/zinc/40/48/54/1383404854.db2.gz	RPSGOXOFTSIDPO-AWEZNQCLSA-N	0	3	349.425	3.226	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCCNCc2cc(-c3ccccc3)no2)C1	ZINC001166245835	1383406585	/nfs/dbraw/zinc/40/65/85/1383406585.db2.gz	RYVDCPMAHHTVKZ-UHFFFAOYSA-N	0	3	339.439	3.294	20	30		EGEDHN
CC1(C(=O)NCCC2(CNCc3ccccc3C#N)CC2)CCC1	ZINC001166614931	1383447410	/nfs/dbraw/zinc/44/74/10/1383447410.db2.gz	UWUKQMTYSDOZKM-UHFFFAOYSA-N	0	3	325.456	3.125	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCC1(CNCc2c(C)noc2CC)CC1	ZINC001166703713	1383463920	/nfs/dbraw/zinc/46/39/20/1383463920.db2.gz	JSYGSPSMZMWDST-HUUCEWRRSA-N	0	3	347.503	3.380	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCCC1(CNCc2nc(C)cs2)CC1	ZINC001166746487	1383470403	/nfs/dbraw/zinc/47/04/03/1383470403.db2.gz	GGBFYAHIONLCQX-AWEZNQCLSA-N	0	3	335.517	3.430	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCCC1(CN[C@@H](C)c2cnccn2)CC1	ZINC001166765541	1383474439	/nfs/dbraw/zinc/47/44/39/1383474439.db2.gz	PXLVYDLMVRULRV-HOTGVXAUSA-N	0	3	330.476	3.016	20	30		EGEDHN
C=CCCCC(=O)NCCC1(CNCc2ccccc2[N+](=O)[O-])CC1	ZINC001166910530	1383498648	/nfs/dbraw/zinc/49/86/48/1383498648.db2.gz	XFKLAVIBZTYCAD-UHFFFAOYSA-N	0	3	345.443	3.327	20	30		EGEDHN
C=CCCC1(C(=O)NCCC2(CNCc3cnc(C)o3)CC2)CC1	ZINC001167025101	1383521297	/nfs/dbraw/zinc/52/12/97/1383521297.db2.gz	AIHQMGALMAPQMD-UHFFFAOYSA-N	0	3	331.460	3.106	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCC1(CNCc2cccnc2OC)CC1	ZINC001167025901	1383522030	/nfs/dbraw/zinc/52/20/30/1383522030.db2.gz	QJNQRDSUHGURTR-IBGZPJMESA-N	0	3	345.487	3.069	20	30		EGEDHN
C=C1CCC(C(=O)NCCC2(CNCc3cnc(C)o3)CC2)CC1	ZINC001167029840	1383523104	/nfs/dbraw/zinc/52/31/04/1383523104.db2.gz	LUZUZFKBIXBHPJ-UHFFFAOYSA-N	0	3	331.460	3.106	20	30		EGEDHN
CC(C)C1(C(=O)NCCC2(CNCc3ccccc3C#N)CC2)CC1	ZINC001167148920	1383552302	/nfs/dbraw/zinc/55/23/02/1383552302.db2.gz	POGOMIPFOIWGQI-UHFFFAOYSA-N	0	3	339.483	3.371	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCC1(CN[C@@H](C)c2cnccn2)CC1	ZINC001167340308	1383603579	/nfs/dbraw/zinc/60/35/79/1383603579.db2.gz	XOHMABKIKHBFJR-HNNXBMFYSA-N	0	3	330.476	3.016	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)CCCc2cccnc2)CC1	ZINC001167552735	1383665261	/nfs/dbraw/zinc/66/52/61/1383665261.db2.gz	IIXLDHSQAUEYKS-UHFFFAOYSA-N	0	3	335.879	3.033	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@@H](C)CC1CCCC1	ZINC001167557277	1383667800	/nfs/dbraw/zinc/66/78/00/1383667800.db2.gz	PIIDARMEFTYSID-LBPRGKRZSA-N	0	3	331.298	3.207	20	30		EGEDHN
CC(C)[C@H]1C[C@@H]1C(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001167578320	1383676030	/nfs/dbraw/zinc/67/60/30/1383676030.db2.gz	KDDVQMAMYUBCQU-MOPGFXCFSA-N	0	3	339.483	3.226	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@@H]2C[C@H]2c2ccccc2)CC1	ZINC001167794151	1383742358	/nfs/dbraw/zinc/74/23/58/1383742358.db2.gz	ROMISCPZNRJDSE-DLBZAZTESA-N	0	3	332.875	3.419	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2sc(C)nc2C)CC1	ZINC001168032031	1383800420	/nfs/dbraw/zinc/80/04/20/1383800420.db2.gz	FSDUSLABDCMLAG-UHFFFAOYSA-N	0	3	327.881	3.002	20	30		EGEDHN
N#Cc1ccc(N2CCN([C@H]3CCc4cc(F)ccc4C3)CC2)cc1	ZINC001168439425	1383905835	/nfs/dbraw/zinc/90/58/35/1383905835.db2.gz	WATAVHVOHJUXGD-NRFANRHFSA-N	0	3	335.426	3.377	20	30		EGEDHN
COc1ccc([C@@H]2C[C@H](NC(=N)c3ccc(Cl)cn3)CCO2)cc1	ZINC001168594540	1383943919	/nfs/dbraw/zinc/94/39/19/1383943919.db2.gz	HTNARONOYAROFE-PBHICJAKSA-N	0	3	345.830	3.369	20	30		EGEDHN
CCc1cccc(CN[C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)c1	ZINC001308370019	1384122704	/nfs/dbraw/zinc/12/27/04/1384122704.db2.gz	WANIMBCCVHELRH-HXUWFJFHSA-N	0	3	333.435	3.406	20	30		EGEDHN
CCN(CC)C(=O)C[C@H](C)NCc1ccc(C#N)cc1C(F)(F)F	ZINC001169459988	1384150201	/nfs/dbraw/zinc/15/02/01/1384150201.db2.gz	SYXRERBNSCVHQX-LBPRGKRZSA-N	0	3	341.377	3.314	20	30		EGEDHN
C/C=C(/C)C(=O)N[C@H](C)CCCCNCc1cc(F)ccc1C#N	ZINC001170067240	1384228534	/nfs/dbraw/zinc/22/85/34/1384228534.db2.gz	JLEHEQNXTWMVLE-PSGIOISBSA-N	0	3	331.435	3.428	20	30		EGEDHN
CC[C@@H](C)OCC(=O)N[C@@H](C)CCCCNCc1ccccc1C#N	ZINC001170233564	1384272518	/nfs/dbraw/zinc/27/25/18/1384272518.db2.gz	SNHHQXVVQGUZJS-DLBZAZTESA-N	0	3	345.487	3.138	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H](C)CCCCNCc1csc(C2CC2)n1	ZINC001170637110	1384355017	/nfs/dbraw/zinc/35/50/17/1384355017.db2.gz	BVRIDOLMVLQLES-OAHLLOKOSA-N	0	3	347.528	3.445	20	30		EGEDHN
CCc1nc(CNCCCC[C@@H](C)NC(=O)C#CC(C)C)cs1	ZINC001170664772	1384359614	/nfs/dbraw/zinc/35/96/14/1384359614.db2.gz	GVHSRYQWWYITNF-OAHLLOKOSA-N	0	3	335.517	3.130	20	30		EGEDHN
Cc1csc(CNCCCC[C@H](C)NC(=O)C#CC(C)(C)C)n1	ZINC001170710218	1384371633	/nfs/dbraw/zinc/37/16/33/1384371633.db2.gz	NDXKVRIMVSSRHG-AWEZNQCLSA-N	0	3	335.517	3.266	20	30		EGEDHN
C[C@@H](CCCCNCc1cc(F)ccc1C#N)NC(=O)C1(C)CC1	ZINC001170923979	1384412148	/nfs/dbraw/zinc/41/21/48/1384412148.db2.gz	VPVPBKKQCVGUEP-AWEZNQCLSA-N	0	3	331.435	3.262	20	30		EGEDHN
C=C[C@@H]1C[C@]1(Nc1ccc([C@H]2CCCCN2C)cn1)C(=O)OCC	ZINC001170924709	1384412344	/nfs/dbraw/zinc/41/23/44/1384412344.db2.gz	PMFXBZYMHQWIDZ-GPMSIDNRSA-N	0	3	329.444	3.158	20	30		EGEDHN
C=C[C@@H]1C[C@@]1(Nc1ccc(F)c(CN2CCCC2)c1)C(=O)OCC	ZINC001170927237	1384412989	/nfs/dbraw/zinc/41/29/89/1384412989.db2.gz	JGSZKDIAFQVQFK-BEFAXECRSA-N	0	3	332.419	3.341	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H](C)CCCCNCc1cc(OC)no1	ZINC001170963133	1384419051	/nfs/dbraw/zinc/41/90/51/1384419051.db2.gz	OUJFVFVGQYPYAS-HNNXBMFYSA-N	0	3	349.475	3.216	20	30		EGEDHN
N#Cc1cccc(N2CCN([C@H]3CCc4cccc(F)c4C3)CC2)c1	ZINC001171004506	1384428222	/nfs/dbraw/zinc/42/82/22/1384428222.db2.gz	GHZJKLSGMQEORO-IBGZPJMESA-N	0	3	335.426	3.377	20	30		EGEDHN
C=CCOC(=O)[C@@H](N)CCCCNc1nccc2cc(C)ccc21	ZINC001171068648	1384440703	/nfs/dbraw/zinc/44/07/03/1384440703.db2.gz	PKTXFAXAMPFUKD-KRWDZBQOSA-N	0	3	327.428	3.182	20	30		EGEDHN
Cc1cnc(OC2CCN([C@@H](C)Cc3cccc(C#N)c3)CC2)nc1	ZINC001171232150	1384475697	/nfs/dbraw/zinc/47/56/97/1384475697.db2.gz	PVTJMAHGWZBLIV-INIZCTEOSA-N	0	3	336.439	3.131	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)CC[C@@H](C)CC)C1	ZINC001316621384	1384487006	/nfs/dbraw/zinc/48/70/06/1384487006.db2.gz	DVHWKMKYZCATCH-FPMFFAJLSA-N	0	3	331.298	3.206	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)CCCc2csc(C)n2)C1	ZINC001316629056	1384493296	/nfs/dbraw/zinc/49/32/96/1384493296.db2.gz	GXKIVIUDYANRTD-CTYIDZIISA-N	0	3	341.908	3.011	20	30		EGEDHN
C=CCOC(=O)N[C@H]1CCCN([C@H]2CCc3c(F)cccc3C2)C1	ZINC001171445447	1384525589	/nfs/dbraw/zinc/52/55/89/1384525589.db2.gz	LCMLAOVVPHMPQQ-HOTGVXAUSA-N	0	3	332.419	3.060	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)c2ccc(Cl)cc2)c1	ZINC001171818231	1384649447	/nfs/dbraw/zinc/64/94/47/1384649447.db2.gz	BUHWMXFEISPBFP-UHFFFAOYSA-N	0	3	345.805	3.260	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1nc(C)oc1C	ZINC001316879179	1384663581	/nfs/dbraw/zinc/66/35/81/1384663581.db2.gz	JREZTPJZDUWLME-BXUZGUMPSA-N	0	3	325.840	3.017	20	30		EGEDHN
Cc1ccc(C)c(C(=O)NCCCNCc2cc(C#N)ccc2F)c1	ZINC001171947049	1384692297	/nfs/dbraw/zinc/69/22/97/1384692297.db2.gz	RETDOWVTACYPBC-UHFFFAOYSA-N	0	3	339.414	3.224	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)N1CCN(CCc2cccs2)CC1	ZINC001172308118	1384765035	/nfs/dbraw/zinc/76/50/35/1384765035.db2.gz	TVGZPRCSBBEYGL-QGZVFWFLSA-N	0	3	339.508	3.411	20	30		EGEDHN
COc1ccccc1N1CCN([C@@H](C)Cc2ccc(C#N)cc2)CC1	ZINC001172307415	1384765593	/nfs/dbraw/zinc/76/55/93/1384765593.db2.gz	DXSQGGXREHOCEV-KRWDZBQOSA-N	0	3	335.451	3.320	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H](N2CC[C@]3(CC3(F)F)C2)C[C@H]1C#N	ZINC001172985380	1384895229	/nfs/dbraw/zinc/89/52/29/1384895229.db2.gz	PIZZEHNHDVSSKQ-WWGRRREGSA-N	0	3	341.402	3.009	20	30		EGEDHN
CSC1CCN([C@@H]2CCN(C(=O)OC(C)(C)C)[C@H](C#N)C2)CC1	ZINC001172983926	1384895706	/nfs/dbraw/zinc/89/57/06/1384895706.db2.gz	IADNHOSKVLHTGJ-KGLIPLIRSA-N	0	3	339.505	3.105	20	30		EGEDHN
CCOc1cccc(N2CCN(C3CCC(C)(C#N)CC3)CC2)n1	ZINC001173597963	1384984635	/nfs/dbraw/zinc/98/46/35/1384984635.db2.gz	KJBVYHAWGDZHMD-UHFFFAOYSA-N	0	3	328.460	3.075	20	30		EGEDHN
CC1(C#N)CCC(N2CCN(c3ccc(C#N)cc3F)CC2)CC1	ZINC001173598317	1384984786	/nfs/dbraw/zinc/98/47/86/1384984786.db2.gz	PEXYJVCPMHPCQI-UHFFFAOYSA-N	0	3	326.419	3.292	20	30		EGEDHN
C[C@@H](CNC(=O)c1cc2ccccc2o1)NCc1ccc(C#N)s1	ZINC001317283286	1385054624	/nfs/dbraw/zinc/05/46/24/1385054624.db2.gz	JRPHNMWFHVKVKS-LBPRGKRZSA-N	0	3	339.420	3.274	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H](C)CCCCNCc1cn(C(C)C)nn1	ZINC001174649793	1385129971	/nfs/dbraw/zinc/12/99/71/1385129971.db2.gz	JUEFEELVUACOFM-MRXNPFEDSA-N	0	3	349.523	3.226	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H](C)CCCCNCc1cc(C)n(C)n1	ZINC001174694454	1385135602	/nfs/dbraw/zinc/13/56/02/1385135602.db2.gz	PDXKOVILJLUEDI-KRWDZBQOSA-N	0	3	346.519	3.077	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@H](C)CCCCNCc1cc(OC)no1	ZINC001174832872	1385156471	/nfs/dbraw/zinc/15/64/71/1385156471.db2.gz	GXHBQFWUJOWLAN-HUUCEWRRSA-N	0	3	337.464	3.050	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H](C)CCCCNCc1cn(C(C)C)nn1	ZINC001175468742	1385301055	/nfs/dbraw/zinc/30/10/55/1385301055.db2.gz	JYYMIXSMNINXQM-INIZCTEOSA-N	0	3	349.523	3.226	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H](C)CCCCN[C@H](C)c1nnc(C)[nH]1	ZINC001175468194	1385301250	/nfs/dbraw/zinc/30/12/50/1385301250.db2.gz	CYRUSWQIGLZCFX-UONOGXRCSA-N	0	3	335.496	3.041	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)c1cc2c(s1)CC[C@@H](C)C2	ZINC001175800989	1385408828	/nfs/dbraw/zinc/40/88/28/1385408828.db2.gz	FRLSJUOMGQAKBX-LLVKDONJSA-N	0	3	326.893	3.335	20	30		EGEDHN
C[C@@H]1CC(C(=O)NCCCNCc2ccccc2C#N)C[C@@H](C)C1	ZINC001177136501	1385829098	/nfs/dbraw/zinc/82/90/98/1385829098.db2.gz	OGUCPCRGEDFDPA-HOTGVXAUSA-N	0	3	327.472	3.226	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)CCc2ccon2)CCCC[C@@H]1C	ZINC001318745997	1385852035	/nfs/dbraw/zinc/85/20/35/1385852035.db2.gz	QBYYMBFXLNILQB-GUYCJALGSA-N	0	3	339.867	3.014	20	30		EGEDHN
CS[C@H](C)CC(=O)N[C@H]1CC[C@H](NCc2ccccc2C#N)CC1	ZINC001318947781	1385892426	/nfs/dbraw/zinc/89/24/26/1385892426.db2.gz	LZHMUXOVRMEROP-ZTFGCOKTSA-N	0	3	345.512	3.217	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NCCCNCc1c(Cl)cccc1Cl	ZINC001177276695	1385893708	/nfs/dbraw/zinc/89/37/08/1385893708.db2.gz	GQZRKXUPJNNDGP-LBPRGKRZSA-N	0	3	345.270	3.180	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)C1=CCOCC1	ZINC001177295711	1385901184	/nfs/dbraw/zinc/90/11/84/1385901184.db2.gz	HKRMXVPBQZMJNY-UHFFFAOYSA-N	0	3	340.895	3.084	20	30		EGEDHN
Cc1cc(C(=O)NC[C@@H](C)CNCc2ccccc2C#N)ccc1F	ZINC001319230907	1386015543	/nfs/dbraw/zinc/01/55/43/1386015543.db2.gz	CXBFUHFPKAQZNH-AWEZNQCLSA-N	0	3	339.414	3.162	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccc(F)cc2)CCN1C(=O)C1CCCCC1	ZINC001178046955	1386116011	/nfs/dbraw/zinc/11/60/11/1386116011.db2.gz	SQAWHNMIBTXVDY-JXFKEZNVSA-N	0	3	342.458	3.337	20	30		EGEDHN
N#Cc1ccc(F)cc1CNCCCCCCNC(=O)/C=C/C1CC1	ZINC001178110288	1386131501	/nfs/dbraw/zinc/13/15/01/1386131501.db2.gz	VAOJBKYXFNSIGU-JXMROGBWSA-N	0	3	343.446	3.430	20	30		EGEDHN
C#CCCCCC(=O)NCCCCCCNCc1csc(C)n1	ZINC001178253834	1386173847	/nfs/dbraw/zinc/17/38/47/1386173847.db2.gz	KCYLYLYUNJBFMC-UHFFFAOYSA-N	0	3	335.517	3.411	20	30		EGEDHN
CCC[C@H](C)C(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@@H]1C	ZINC001178375234	1386199927	/nfs/dbraw/zinc/19/99/27/1386199927.db2.gz	JMMAPZMHMUEVJK-BXWFABGCSA-N	0	3	330.447	3.192	20	30		EGEDHN
CC(C)C[C@@H](CNCc1ccc(C#N)s1)NC(=O)c1cc(F)c[nH]1	ZINC001319617646	1386210826	/nfs/dbraw/zinc/21/08/26/1386210826.db2.gz	BWZLVISBVJDSOV-ZDUSSCGKSA-N	0	3	348.447	3.021	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCCCCCNCc1cc(C)n(C)n1	ZINC001178579799	1386254990	/nfs/dbraw/zinc/25/49/90/1386254990.db2.gz	GWOZHDVVKOOYLE-UHFFFAOYSA-N	0	3	334.508	3.097	20	30		EGEDHN
CC(C(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@@H]1C)=C1CCC1	ZINC001178648608	1386269062	/nfs/dbraw/zinc/26/90/62/1386269062.db2.gz	IIMRKZGTLYNIKZ-JXFKEZNVSA-N	0	3	340.442	3.257	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)CCC(C)(F)F	ZINC001179024908	1386379950	/nfs/dbraw/zinc/37/99/50/1386379950.db2.gz	CCZMLCLPEYLSNQ-RDJZCZTQSA-N	0	3	334.410	3.053	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCCCCCCN[C@H](C)c1nnc(CC)[nH]1	ZINC001179339575	1386455809	/nfs/dbraw/zinc/45/58/09/1386455809.db2.gz	HUPFBLQWYHBPAB-HZPDHXFCSA-N	0	3	349.523	3.297	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](NCc2ccc(Cl)nc2)[C@@H]1C	ZINC001179365351	1386463884	/nfs/dbraw/zinc/46/38/84/1386463884.db2.gz	YFFQPGHGUIRBQN-DZKIICNBSA-N	0	3	335.879	3.416	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H](NCc2ccc(Cl)nc2)[C@@H]1C	ZINC001179365353	1386464130	/nfs/dbraw/zinc/46/41/30/1386464130.db2.gz	YFFQPGHGUIRBQN-YCPHGPKFSA-N	0	3	335.879	3.416	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)Cc1c[nH]c2ccccc12)C1CC1	ZINC001698653691	1406303583	/nfs/dbraw/zinc/30/35/83/1406303583.db2.gz	QEPGIQUGCCUXNP-LJQANCHMSA-N	0	3	345.874	3.337	20	30		EGEDHN
CCOC(=O)[C@H]1CCC[C@H]1N(Cc1ccc(F)cc1)C(=O)C(C)C#N	ZINC001179897523	1386622005	/nfs/dbraw/zinc/62/20/05/1386622005.db2.gz	YXLLBQIEUGLUHL-RRQGHBQHSA-N	0	3	346.402	3.046	20	30		EGEDHN
N#CCCN(C(=O)CN1CC[C@@H]2CCCC[C@H]2C1)c1ccccc1	ZINC001321718894	1386964908	/nfs/dbraw/zinc/96/49/08/1386964908.db2.gz	WOFNHDWRBXHBGH-ROUUACIJSA-N	0	3	325.456	3.445	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)[C@](C)(CNCc2nc(C)cs2)C1	ZINC001181628985	1387026224	/nfs/dbraw/zinc/02/62/24/1387026224.db2.gz	FTOOFNULZKBAOR-RDTXWAMCSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@@H](C)[C@](C)(CNCc2nccn2CC)C1	ZINC001182305546	1387142905	/nfs/dbraw/zinc/14/29/05/1387142905.db2.gz	JPSCPJSWFFMAAX-FUHIMQAGSA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2nccs2)C1	ZINC001182306173	1387143756	/nfs/dbraw/zinc/14/37/56/1387143756.db2.gz	WARUNORZAKKDOZ-IIDMSEBBSA-N	0	3	335.517	3.320	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2nccs2)C1	ZINC001182749808	1387218682	/nfs/dbraw/zinc/21/86/82/1387218682.db2.gz	CKQTYGXGTKXKOF-RDTXWAMCSA-N	0	3	335.517	3.320	20	30		EGEDHN
C[C@H](C(=O)N1CCN(CC2CCCCC2)CC1)c1ccc(C#N)cc1	ZINC001182790789	1387225040	/nfs/dbraw/zinc/22/50/40/1387225040.db2.gz	VCXZCMFWESICOK-KRWDZBQOSA-N	0	3	339.483	3.386	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](NCc2cnn(C(C)(C)C)c2)C1	ZINC001182841433	1387233573	/nfs/dbraw/zinc/23/35/73/1387233573.db2.gz	LPHLDJRIJAFABU-GOSISDBHSA-N	0	3	344.503	3.097	20	30		EGEDHN
CC[C@H](NCc1cccc(OCC#N)c1)C(=O)Nc1ccc(C)cc1	ZINC001329633172	1389194573	/nfs/dbraw/zinc/19/45/73/1389194573.db2.gz	POGCWGXBAPIGLC-IBGZPJMESA-N	0	3	337.423	3.404	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CCC[C@@H]1CNCc1ccccc1F)OCC	ZINC001698729642	1406380007	/nfs/dbraw/zinc/38/00/07/1406380007.db2.gz	DTHJTAMNLFXARJ-MJGOQNOKSA-N	0	3	348.462	3.278	20	30		EGEDHN
CCC(CC)C(=O)N(C)[C@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001331260288	1389675031	/nfs/dbraw/zinc/67/50/31/1389675031.db2.gz	WEUUZLGVQCSGNW-QGZVFWFLSA-N	0	3	333.501	3.383	20	30		EGEDHN
C=C(Cl)CNC[C@H](C1CC1)N(C)C(=O)c1c(C)cc(C)nc1C	ZINC001331300450	1389691776	/nfs/dbraw/zinc/69/17/76/1389691776.db2.gz	ACTKELYQPQYWST-MRXNPFEDSA-N	0	3	335.879	3.200	20	30		EGEDHN
CN(C)C[C@H]1CCc2ccccc2N1C(=O)c1ccc(C#N)cc1F	ZINC001339054173	1389877697	/nfs/dbraw/zinc/87/76/97/1389877697.db2.gz	LGYSAOROUWPKRE-MRXNPFEDSA-N	0	3	337.398	3.221	20	30		EGEDHN
Cc1ccc(C2=NO[C@H](CN[C@H](C)CC3(C#N)CCOCC3)C2)cc1	ZINC001332725460	1390171157	/nfs/dbraw/zinc/17/11/57/1390171157.db2.gz	SOPMPENTHQHIRW-AEFFLSMTSA-N	0	3	341.455	3.177	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N1CCO[C@H](c2ccc(F)c(Cl)c2)C1	ZINC001339899129	1390185170	/nfs/dbraw/zinc/18/51/70/1390185170.db2.gz	NSDVMMYPXXBIHX-HOTGVXAUSA-N	0	3	340.826	3.063	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N[C@H](c1nc2ccccc2[nH]1)[C@H](C)CC	ZINC001340043918	1390214618	/nfs/dbraw/zinc/21/46/18/1390214618.db2.gz	CUHVAYVSCBGKEO-KEYYUXOJSA-N	0	3	328.460	3.450	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)N(C)Cc1ncc(Cl)n1C	ZINC001340358701	1390276636	/nfs/dbraw/zinc/27/66/36/1390276636.db2.gz	ZXTDKRPTHSCRBK-ZDUSSCGKSA-N	0	3	328.888	3.110	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)NCCc1ccc(-c2csc(C)n2)cc1	ZINC001341510672	1390496201	/nfs/dbraw/zinc/49/62/01/1390496201.db2.gz	NTPNLVOMCRHPDR-KRWDZBQOSA-N	0	3	343.496	3.461	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CCCN(C)C2)nnc1N1CCC2(CCCC2)C1	ZINC001342354660	1390604677	/nfs/dbraw/zinc/60/46/77/1390604677.db2.gz	JPOAELSPRAJVOB-KRWDZBQOSA-N	0	3	343.519	3.434	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1cccc(OCc2cccnc2)c1	ZINC001343379514	1390710274	/nfs/dbraw/zinc/71/02/74/1390710274.db2.gz	WCOVGSPUWKVGRN-SFHVURJKSA-N	0	3	325.412	3.283	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)NC[C@H](Cc1ccccc1)c1ccccn1	ZINC001343459760	1390715489	/nfs/dbraw/zinc/71/54/89/1390715489.db2.gz	PWOJCSZEHMPZKN-OALUTQOASA-N	0	3	337.467	3.208	20	30		EGEDHN
CC[C@H](C)N1CCN(c2nnc([C@@H](C)CCC#N)n2CC(C)C)CC1	ZINC001343482417	1390716711	/nfs/dbraw/zinc/71/67/11/1390716711.db2.gz	LUOBRACSMBLJGN-IRXDYDNUSA-N	0	3	346.523	3.262	20	30		EGEDHN
C=C(C)Cn1c(C(F)F)nnc1N1CCN(C2CCCCC2)CC1	ZINC001343612075	1390726392	/nfs/dbraw/zinc/72/63/92/1390726392.db2.gz	CKDALUMCADPWSU-UHFFFAOYSA-N	0	3	339.434	3.247	20	30		EGEDHN
N#CC(C(=O)[C@@H]1C[C@H]2CC(=O)[C@@H]1C2)c1nc2c(cccc2Cl)[nH]1	ZINC001345673789	1390874662	/nfs/dbraw/zinc/87/46/62/1390874662.db2.gz	WNEOZWAYBUWFKN-ZDCRXTMVSA-N	0	3	327.771	3.008	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCN(C(=O)OC(C)(C)C)C(C)C	ZINC001349701615	1391355643	/nfs/dbraw/zinc/35/56/43/1391355643.db2.gz	HKUBUKLPYCSRQN-CQSZACIVSA-N	0	3	348.447	3.115	20	30		EGEDHN
Cn1c(Cl)cnc1C(C#N)C(=O)CCc1ncc(C(C)(C)C)o1	ZINC001349702465	1391355793	/nfs/dbraw/zinc/35/57/93/1391355793.db2.gz	QASAWLMSRHCGHS-SNVBAGLBSA-N	0	3	334.807	3.168	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@H](CC)OC2CCCCC2)C1	ZINC001479368978	1392226260	/nfs/dbraw/zinc/22/62/60/1392226260.db2.gz	LONSEKNEHZFVPF-ZOBUZTSGSA-N	0	3	342.911	3.351	20	30		EGEDHN
C=C(Br)CN[C@H](C)[C@@H]1CCCCN1C(=O)C1=CCCC1	ZINC001479819430	1392410642	/nfs/dbraw/zinc/41/06/42/1392410642.db2.gz	BKAMSELSKIVITF-HIFRSBDPSA-N	0	3	341.293	3.365	20	30		EGEDHN
Cc1ccccc1CC(=O)N(C)[C@@H](C)CNCc1ccc(C#N)s1	ZINC001698856572	1406564408	/nfs/dbraw/zinc/56/44/08/1406564408.db2.gz	IDFCIOKYMXUDLY-HNNXBMFYSA-N	0	3	341.480	3.107	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)C2(Cc3ccc(F)cc3)CC2)C1	ZINC001480161743	1392605242	/nfs/dbraw/zinc/60/52/42/1392605242.db2.gz	VOXNTWAVUKLDJS-WKILWMFISA-N	0	3	336.838	3.138	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1CCN([C@H](C)c2ccc3c(c2)CCC3)C1	ZINC001481696938	1394458119	/nfs/dbraw/zinc/45/81/19/1394458119.db2.gz	LSVPPKQLKBAHQC-UZLBHIALSA-N	0	3	342.483	3.020	20	30		EGEDHN
CC(C)C(=O)N[C@H](CNCc1ccc(C#N)s1)C1CCCCC1	ZINC001482402472	1394964679	/nfs/dbraw/zinc/96/46/79/1394964679.db2.gz	OJFNWTQLMMGDFF-QGZVFWFLSA-N	0	3	333.501	3.430	20	30		EGEDHN
CCCC(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1C#N	ZINC001484386870	1395352756	/nfs/dbraw/zinc/35/27/56/1395352756.db2.gz	HLGFNMWPKMSMCE-IDHPPYADSA-N	0	3	325.456	3.218	20	30		EGEDHN
C[C@@H](CCNC(=O)c1cccs1)NCc1cc(C#N)ccc1F	ZINC001484988886	1395632717	/nfs/dbraw/zinc/63/27/17/1395632717.db2.gz	DDBGJGIPHZOONU-LBPRGKRZSA-N	0	3	331.416	3.057	20	30		EGEDHN
C/C(=C/C(=O)NCC[C@H](C)NCc1cc(C#N)ccc1F)C1CC1	ZINC001484989685	1395633411	/nfs/dbraw/zinc/63/34/11/1395633411.db2.gz	HXEVSQRQTDGJPV-XXYUJHKVSA-N	0	3	329.419	3.038	20	30		EGEDHN
C[C@H](CNCc1ccc(F)c(C#N)c1)NC(=O)[C@@H]1CC[C@@H](C)CC1	ZINC001497967188	1396890545	/nfs/dbraw/zinc/89/05/45/1396890545.db2.gz	NVGJVRXHYLPWMD-IIAWOOMASA-N	0	3	331.435	3.118	20	30		EGEDHN
Cc1cc(C)cc(CC(=O)NCC[C@@H](C)NCc2ccccc2C#N)c1	ZINC001690860734	1404781938	/nfs/dbraw/zinc/78/19/38/1404781938.db2.gz	GJLVNRMIGRMWPP-GOSISDBHSA-N	0	3	349.478	3.402	20	30		EGEDHN
CCN(CCNC(=O)c1sc(C)cc1C)Cc1ccc(C#N)cc1	ZINC001691022364	1404936077	/nfs/dbraw/zinc/93/60/77/1404936077.db2.gz	SFTRZTAVNSDDGB-UHFFFAOYSA-N	0	3	341.480	3.489	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)Cc2cccc(C(F)F)c2)C1	ZINC001691105331	1405044461	/nfs/dbraw/zinc/04/44/61/1405044461.db2.gz	ZYPQGNMUMILMDZ-OTVXOJSOSA-N	0	3	342.817	3.404	20	30		EGEDHN
CCC1(C(=O)NC[C@H]2C[C@@H](NCc3cc(C#N)ccc3F)C2)CCC1	ZINC001691109607	1405050420	/nfs/dbraw/zinc/05/04/20/1405050420.db2.gz	DIFHKWFRKKIFAP-WOVMCDHWSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)Cn2c(C)cc3ccccc32)C1	ZINC001691508929	1405310794	/nfs/dbraw/zinc/31/07/94/1405310794.db2.gz	IJGQZOSYDWRXGH-JCNLHEQBSA-N	0	3	345.874	3.187	20	30		EGEDHN
C[C@H](C#N)C(=O)NC[C@H]1C[C@@H](NCc2cc(Cl)ccc2Cl)C1	ZINC001691694479	1405428487	/nfs/dbraw/zinc/42/84/87/1405428487.db2.gz	MYYSXPAPGBVDLY-GYSYKLTISA-N	0	3	340.254	3.137	20	30		EGEDHN
CCCC(=O)N[C@@H]1CN(Cc2cccc(C#N)c2)C[C@H]1c1ccccc1	ZINC001691832874	1405546548	/nfs/dbraw/zinc/54/65/48/1405546548.db2.gz	FKLLVYLLTGWNIR-LEWJYISDSA-N	0	3	347.462	3.443	20	30		EGEDHN
CC[C@@H](CNC(=O)c1cc(C)oc1C)NCc1ccc(C#N)s1	ZINC001732190851	1428442455	/nfs/dbraw/zinc/44/24/55/1428442455.db2.gz	CCKWONUNERGPJQ-ZDUSSCGKSA-N	0	3	331.441	3.128	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2cccc3c2OCC3)CCCC1	ZINC001732235926	1428482049	/nfs/dbraw/zinc/48/20/49/1428482049.db2.gz	KDPWSPJOGYFCSN-UHFFFAOYSA-N	0	3	334.847	3.006	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H]2Cc3cccc(C)c3O2)CCCC1	ZINC001732400537	1428566594	/nfs/dbraw/zinc/56/65/94/1428566594.db2.gz	SECFNGOQXPSLRC-MRXNPFEDSA-N	0	3	348.874	3.070	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)Cc1cccc(C(F)F)c1	ZINC001700325254	1413794682	/nfs/dbraw/zinc/79/46/82/1413794682.db2.gz	BYKQMDDARQRCIV-LBPRGKRZSA-N	0	3	330.806	3.404	20	30		EGEDHN
Cc1cccc(C)c1C(=O)NCC[C@H](C)NCc1ccccc1C#N	ZINC001700326964	1413797192	/nfs/dbraw/zinc/79/71/92/1413797192.db2.gz	KAFMKPDCGKXPCL-KRWDZBQOSA-N	0	3	335.451	3.473	20	30		EGEDHN
C=C(Br)CN[C@H](CNC(=O)C(C)(C)CCC)C(C)C	ZINC001732564572	1428755818	/nfs/dbraw/zinc/75/58/18/1428755818.db2.gz	HFVNZPXBIREKQR-CYBMUJFWSA-N	0	3	333.314	3.452	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)COc1ccc(Cl)cc1)C(C)C	ZINC001732571306	1428766560	/nfs/dbraw/zinc/76/65/60/1428766560.db2.gz	BJLNYDCDIITDBP-OAHLLOKOSA-N	0	3	345.270	3.202	20	30		EGEDHN
C[C@H](CNC(=O)c1cc2ccccc2[nH]1)N(C)Cc1ccc(C#N)cc1	ZINC001700484874	1414129004	/nfs/dbraw/zinc/12/90/04/1414129004.db2.gz	FHDPDGQBQIXTIB-OAHLLOKOSA-N	0	3	346.434	3.290	20	30		EGEDHN
CCc1ccccc1C(=O)N(C)C[C@H](C)NCc1ccc(C#N)s1	ZINC001700763896	1414437748	/nfs/dbraw/zinc/43/77/48/1414437748.db2.gz	KZMOOFXDDYXUQG-AWEZNQCLSA-N	0	3	341.480	3.432	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2ccc(C#N)s2)CN1C(=O)CCCC1CC1	ZINC001700843132	1414492500	/nfs/dbraw/zinc/49/25/00/1414492500.db2.gz	SZTYAFBMCGTJRY-UKRRQHHQSA-N	0	3	331.485	3.279	20	30		EGEDHN
CC(C)(C)[C@@H](CNCc1ccc(C#N)cc1F)NC(=O)C1CCC1	ZINC001700981455	1414621985	/nfs/dbraw/zinc/62/19/85/1414621985.db2.gz	VHLUTRYQHLOBFO-QGZVFWFLSA-N	0	3	331.435	3.118	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCC[C@H]1NC(=O)CCC1CC1	ZINC001732615088	1428878241	/nfs/dbraw/zinc/87/82/41/1428878241.db2.gz	IRMKQYUBJWVGSN-RTBURBONSA-N	0	3	325.456	3.123	20	30		EGEDHN
CCc1ccc(C(=O)N[C@H](C)CNCc2ccc(C#N)s2)s1	ZINC001732962212	1429086278	/nfs/dbraw/zinc/08/62/78/1429086278.db2.gz	BAKCNUWRANOILY-LLVKDONJSA-N	0	3	333.482	3.152	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)NC(=O)C1(C(F)F)CCCC1	ZINC001733010568	1429130280	/nfs/dbraw/zinc/13/02/80/1429130280.db2.gz	XTCVNVRYZNKKPU-NSHDSACASA-N	0	3	341.427	3.040	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)CCc1cncs1	ZINC001707446287	1417350780	/nfs/dbraw/zinc/35/07/80/1417350780.db2.gz	VGEDYYPQLZSBEU-HIFRSBDPSA-N	0	3	341.908	3.187	20	30		EGEDHN
Cc1cc(C)cc(CC(=O)N[C@H](C)CN(C)Cc2ccc(C#N)cc2)c1	ZINC001733055038	1429196731	/nfs/dbraw/zinc/19/67/31/1429196731.db2.gz	KVXFRHJCAVCSLA-GOSISDBHSA-N	0	3	349.478	3.354	20	30		EGEDHN
Cc1cc(C)cc(CC(=O)N[C@@H](C)CN(C)Cc2ccc(C#N)cc2)c1	ZINC001733055039	1429197358	/nfs/dbraw/zinc/19/73/58/1429197358.db2.gz	KVXFRHJCAVCSLA-SFHVURJKSA-N	0	3	349.478	3.354	20	30		EGEDHN
CCCC[C@](C)(F)C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001713163078	1417738180	/nfs/dbraw/zinc/73/81/80/1417738180.db2.gz	YHFWSRIRQJUVBI-BXWFABGCSA-N	0	3	349.425	3.353	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H](C)CN(C)Cc2ccc(C#N)cc2)cc1C	ZINC001733061976	1429211134	/nfs/dbraw/zinc/21/11/34/1429211134.db2.gz	GVQNUNXGFHMVBM-KRWDZBQOSA-N	0	3	335.451	3.425	20	30		EGEDHN
C[C@@H](CCNC(=O)c1ccsc1)NCc1cc(C#N)ccc1F	ZINC001713402719	1418026323	/nfs/dbraw/zinc/02/63/23/1418026323.db2.gz	RFYFLDKONKPPOQ-LBPRGKRZSA-N	0	3	331.416	3.057	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)Cc1cccc(C(F)F)c1	ZINC001713412093	1418035527	/nfs/dbraw/zinc/03/55/27/1418035527.db2.gz	BYKQMDDARQRCIV-GFCCVEGCSA-N	0	3	330.806	3.404	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@@H](CCNC(=O)C2(F)CCCC2)C1	ZINC001713730693	1418517275	/nfs/dbraw/zinc/51/72/75/1418517275.db2.gz	SWSNNSQSGHWPMZ-MRXNPFEDSA-N	0	3	343.446	3.169	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@H](CCNC(=O)C2(F)CCCC2)C1	ZINC001713730692	1418517364	/nfs/dbraw/zinc/51/73/64/1418517364.db2.gz	SWSNNSQSGHWPMZ-INIZCTEOSA-N	0	3	343.446	3.169	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1ccc2cnccc2c1)C1CC1	ZINC001714174728	1418982038	/nfs/dbraw/zinc/98/20/38/1418982038.db2.gz	OYEHFGDQTBBVRQ-LJQANCHMSA-N	0	3	343.858	3.475	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1csc(C2CC2)n1)C1CC1	ZINC001714177416	1418984691	/nfs/dbraw/zinc/98/46/91/1418984691.db2.gz	HKYJBXNEMGIPAQ-MRXNPFEDSA-N	0	3	339.892	3.261	20	30		EGEDHN
Cc1cc(C)cc(C(=O)NC[C@H](C)CNCc2ccccc2C#N)c1	ZINC001714447225	1419179255	/nfs/dbraw/zinc/17/92/55/1419179255.db2.gz	ZMTVINVLPDWWHF-QGZVFWFLSA-N	0	3	335.451	3.331	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](CNC(=O)CCC3CCC3)C2)cc1	ZINC001714631826	1419403088	/nfs/dbraw/zinc/40/30/88/1419403088.db2.gz	UCGDEAISHXACMV-IBGZPJMESA-N	0	3	325.456	3.077	20	30		EGEDHN
CCCN(CCNC(=O)c1ccc(C)o1)Cc1ccc(F)c(C#N)c1	ZINC001714647315	1419422807	/nfs/dbraw/zinc/42/28/07/1419422807.db2.gz	OYFKWBREYUPAOR-UHFFFAOYSA-N	0	3	343.402	3.241	20	30		EGEDHN
C=C(Br)CNCC1(NC(=O)c2ccoc2C)CCCC1	ZINC001715090010	1419830780	/nfs/dbraw/zinc/83/07/80/1419830780.db2.gz	WDZDNRIZLROXJE-UHFFFAOYSA-N	0	3	341.249	3.129	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2cccc(N(C)C)c2)CCCC1	ZINC001715103642	1419844913	/nfs/dbraw/zinc/84/49/13/1419844913.db2.gz	RPHRVGACLQIURS-UHFFFAOYSA-N	0	3	335.879	3.137	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)C2=COCCC2)CCCC[C@@H]1C	ZINC001715131845	1419881621	/nfs/dbraw/zinc/88/16/21/1419881621.db2.gz	SVPJAULOUXZNCB-GUYCJALGSA-N	0	3	326.868	3.088	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H]1CNCc1ccccc1OC1CC1	ZINC001715209429	1419942709	/nfs/dbraw/zinc/94/27/09/1419942709.db2.gz	FFSIQYCQIFKZNO-GOSISDBHSA-N	0	3	340.467	3.112	20	30		EGEDHN
C[C@@H](CNCc1ccccc1C#N)CNC(=O)[C@H]1CCC(C)(C)C1	ZINC001715254395	1419977946	/nfs/dbraw/zinc/97/79/46/1419977946.db2.gz	YOKJOMHDNJORGP-HOTGVXAUSA-N	0	3	327.472	3.226	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1oc(CCC)nc1C)C(C)C	ZINC001715690431	1420296495	/nfs/dbraw/zinc/29/64/95/1420296495.db2.gz	JMSVNOFWWXSUQU-ZDUSSCGKSA-N	0	3	327.856	3.032	20	30		EGEDHN
C[C@H](CN(C)Cc1cccc(C#N)c1)NC(=O)[C@@H]1CC[C@@H](C)CC1	ZINC001722904706	1424230778	/nfs/dbraw/zinc/23/07/78/1424230778.db2.gz	FQULYBHMNXWYHX-GPMSIDNRSA-N	0	3	327.472	3.321	20	30		EGEDHN
N#Cc1cccc(CNC2(CNC(=O)c3ccc4[nH]ccc4c3)CC2)c1	ZINC001723553754	1424461714	/nfs/dbraw/zinc/46/17/14/1424461714.db2.gz	BYAQCFUJNBSVNQ-UHFFFAOYSA-N	0	3	344.418	3.092	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)[C@]2(C)CCCOC2)CC1	ZINC001725025412	1425443336	/nfs/dbraw/zinc/44/33/36/1425443336.db2.gz	ARFWGGKBVUXNOT-GOSISDBHSA-N	0	3	342.911	3.116	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@H](C)N(C)Cc2cccc(C#N)c2)s1	ZINC001725158508	1425653212	/nfs/dbraw/zinc/65/32/12/1425653212.db2.gz	UHSFLZHGFKFHEO-ZDUSSCGKSA-N	0	3	327.453	3.179	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1ncoc1C1CC1	ZINC001731294982	1427237364	/nfs/dbraw/zinc/23/73/64/1427237364.db2.gz	STHNDIQUUZHXKT-JSGCOSHPSA-N	0	3	337.851	3.277	20	30		EGEDHN
CCCN(CCNC(=O)[C@H](C)C1CCC1)Cc1ccc(C#N)cc1	ZINC001731866079	1428113795	/nfs/dbraw/zinc/11/37/95/1428113795.db2.gz	HFZNYCFYTNMMQG-MRXNPFEDSA-N	0	3	327.472	3.323	20	30		EGEDHN
CCCN(CCNC(=O)c1cocc1C)Cc1cccc(C#N)c1	ZINC001731868958	1428120715	/nfs/dbraw/zinc/12/07/15/1428120715.db2.gz	OEDZBDSAYMKGGZ-UHFFFAOYSA-N	0	3	325.412	3.102	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)CC(F)(F)F)CC1	ZINC001733917604	1437731279	/nfs/dbraw/zinc/73/12/79/1437731279.db2.gz	CKZCBHUPHSLXPJ-UHFFFAOYSA-N	0	3	326.790	3.252	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)CC[C@@H]2CCCO2)CC1	ZINC001733918617	1437732128	/nfs/dbraw/zinc/73/21/28/1437732128.db2.gz	LYDFVAYDEFXAIV-KRWDZBQOSA-N	0	3	342.911	3.259	20	30		EGEDHN
C[C@@H](NCC#Cc1ccccc1)[C@@H]1CCCCN1C(=O)c1ccc[nH]1	ZINC001752132949	1440143819	/nfs/dbraw/zinc/14/38/19/1440143819.db2.gz	XLIFSNUHWKTJFR-XLIONFOSSA-N	0	3	335.451	3.039	20	30		EGEDHN
CCN(CCCNC(=O)[C@@H]1CC[C@@H](F)C1)Cc1ccc(C#N)s1	ZINC001752208366	1440154438	/nfs/dbraw/zinc/15/44/38/1440154438.db2.gz	VVYJFSLTTUVDCY-ZIAGYGMSSA-N	0	3	337.464	3.086	20	30		EGEDHN
Cc1ccc(CN[C@@H](CNC(=O)C#CC2CC2)C2CC2)c(Cl)c1	ZINC001752462283	1440183870	/nfs/dbraw/zinc/18/38/70/1440183870.db2.gz	CAWYJOMQDJORDW-SFHVURJKSA-N	0	3	330.859	3.046	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1Cc2ccccc2O1	ZINC001752538040	1440194231	/nfs/dbraw/zinc/19/42/31/1440194231.db2.gz	BOWHQUFBZOQTGN-LBKNJMOBSA-N	0	3	340.467	3.020	20	30		EGEDHN
CC[C@@H](C)[C@@H](C)C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001752672938	1440199053	/nfs/dbraw/zinc/19/90/53/1440199053.db2.gz	ITOYGKJCXVMPTF-BQGCOEIASA-N	0	3	331.435	3.116	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)NC[C@H]1CCCCN1Cc1cccc(CC)c1	ZINC001752819422	1440219781	/nfs/dbraw/zinc/21/97/81/1440219781.db2.gz	VLNOEZBXAXNPAW-CTNGQTDRSA-N	0	3	344.499	3.047	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)C[C@@H](C)c1c(C)noc1C	ZINC001752821612	1440220865	/nfs/dbraw/zinc/22/08/65/1440220865.db2.gz	PKAZAVZANWKREA-PBHICJAKSA-N	0	3	333.476	3.332	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)C[C@H](C)c1c(C)noc1C	ZINC001752821614	1440220965	/nfs/dbraw/zinc/22/09/65/1440220965.db2.gz	PKAZAVZANWKREA-WMLDXEAASA-N	0	3	333.476	3.332	20	30		EGEDHN
C=CCCC(=O)N1CCCC[C@@H]1[C@@H]1CCCN1Cc1conc1C	ZINC001752832487	1440225880	/nfs/dbraw/zinc/22/58/80/1440225880.db2.gz	WQXLHRGPCTVGSF-ZWKOTPCHSA-N	0	3	331.460	3.295	20	30		EGEDHN
CCCC1(C(=O)N2CCCC[C@H]2[C@@H]2CCCN2CC#CCOC)CC1	ZINC001752833022	1440226360	/nfs/dbraw/zinc/22/63/60/1440226360.db2.gz	AJMOQSSEAQMING-OALUTQOASA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)COCCCCCC	ZINC001752834559	1440227072	/nfs/dbraw/zinc/22/70/72/1440227072.db2.gz	UKTFKIHTNUXXPJ-RBUKOAKNSA-N	0	3	334.504	3.062	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)Cc2cccc(C(F)F)c2)C1	ZINC001752836429	1440227886	/nfs/dbraw/zinc/22/78/86/1440227886.db2.gz	NDZPUQSFNXPXMP-CRAIPNDOSA-N	0	3	348.437	3.407	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)CC(C)(C)C(F)(F)F)C1	ZINC001752841375	1440230667	/nfs/dbraw/zinc/23/06/67/1440230667.db2.gz	PUEWGVKKWXGPHC-KGLIPLIRSA-N	0	3	332.410	3.205	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H](C)[C@H]1CCCN(Cc2cnoc2C)C1	ZINC001752841876	1440231043	/nfs/dbraw/zinc/23/10/43/1440231043.db2.gz	SVXPXXGPZWIBTJ-WMZOPIPTSA-N	0	3	345.487	3.283	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC1CCC(NCc2oc(C)nc2C)CC1	ZINC001752849974	1440233230	/nfs/dbraw/zinc/23/32/30/1440233230.db2.gz	FTSHZTSWHKERJQ-UHFFFAOYSA-N	0	3	333.476	3.411	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)C(C)(C)CC)CC1	ZINC001752853667	1440234198	/nfs/dbraw/zinc/23/41/98/1440234198.db2.gz	LMBGRDZMZLYPSE-UHFFFAOYSA-N	0	3	331.298	3.348	20	30		EGEDHN
Cc1scc(C(=O)NC[C@@H](C)NCc2ccc(C#N)c(F)c2)c1C	ZINC001752874449	1440237723	/nfs/dbraw/zinc/23/77/23/1440237723.db2.gz	HNUBVGRLBZKGQA-LLVKDONJSA-N	0	3	345.443	3.284	20	30		EGEDHN
CC[C@H](C)CC(=O)N1CC[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001752936771	1440250418	/nfs/dbraw/zinc/25/04/18/1440250418.db2.gz	VVZVGBCAQGFETL-GJZGRUSLSA-N	0	3	331.435	3.072	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1CC[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001752937031	1440250483	/nfs/dbraw/zinc/25/04/83/1440250483.db2.gz	YBVILWKXGTYOQJ-CABCVRRESA-N	0	3	331.435	3.072	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@@H](CNCc2ccn(C(C)C)n2)C1	ZINC001752949862	1440251918	/nfs/dbraw/zinc/25/19/18/1440251918.db2.gz	OZQQTNXALKFBAM-SJORKVTESA-N	0	3	332.492	3.004	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1CCC[C@H](NCc2cnc(C)o2)C1	ZINC001752975775	1440255932	/nfs/dbraw/zinc/25/59/32/1440255932.db2.gz	FYLLDSAVOPMOKZ-DLBZAZTESA-N	0	3	331.460	3.084	20	30		EGEDHN
C=CCOCCCC(=O)N1CCC[C@@H](N(C)Cc2ccsc2)C1	ZINC001752989277	1440259086	/nfs/dbraw/zinc/25/90/86/1440259086.db2.gz	AKRVAULJQLSNMB-QGZVFWFLSA-N	0	3	336.501	3.154	20	30		EGEDHN
CC#CCN(C)[C@H]1CCCN(C(=O)C[C@H](C)c2cccc(OC)c2)C1	ZINC001752999810	1440263997	/nfs/dbraw/zinc/26/39/97/1440263997.db2.gz	ICKVBFDSEQDQRS-HKUYNNGSSA-N	0	3	342.483	3.135	20	30		EGEDHN
C[C@@H](CCNC(=O)c1ccc(Cl)o1)NCc1ccccc1C#N	ZINC001753003366	1440265170	/nfs/dbraw/zinc/26/51/70/1440265170.db2.gz	NSXHWUYNJXTNGX-LBPRGKRZSA-N	0	3	331.803	3.103	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1CCCNC(=O)c1cc(C)n(C)c1C	ZINC001753037511	1440275105	/nfs/dbraw/zinc/27/51/05/1440275105.db2.gz	HLIKNLRLYNZPHC-MRXNPFEDSA-N	0	3	337.895	3.369	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCN(C)[C@@H]2CCc3c2cccc3F)cc1	ZINC001753059772	1440282857	/nfs/dbraw/zinc/28/28/57/1440282857.db2.gz	URGSHXNOFFGNJT-HXUWFJFHSA-N	0	3	336.410	3.156	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@H]1CCN(CCc2csc(C)n2)C1	ZINC001753131097	1440316841	/nfs/dbraw/zinc/31/68/41/1440316841.db2.gz	MTVALFXERHMJBF-OAHLLOKOSA-N	0	3	335.517	3.034	20	30		EGEDHN
CCCN(CCNC(=O)/C=C(/C)C1CC1)Cc1ccc(F)c(C#N)c1	ZINC001753142564	1440322116	/nfs/dbraw/zinc/32/21/16/1440322116.db2.gz	GZJKXIFILCTNAI-PTNGSMBKSA-N	0	3	343.446	3.382	20	30		EGEDHN
Cc1ccc(Cl)cc1C(=O)N(C)CCNCc1cccc(C#N)c1	ZINC001753242963	1440342309	/nfs/dbraw/zinc/34/23/09/1440342309.db2.gz	FNKVHOGCYKNMHU-UHFFFAOYSA-N	0	3	341.842	3.382	20	30		EGEDHN
C#CCCCC(=O)N1CCC([C@H](C)NC/C(Cl)=C/Cl)CC1	ZINC001753274766	1440346022	/nfs/dbraw/zinc/34/60/22/1440346022.db2.gz	IWWFDFXRNDABMS-WZMONFQBSA-N	0	3	331.287	3.326	20	30		EGEDHN
CC(C)N(CCCNC(=O)[C@@H](C)C1CC1)Cc1ccc(C#N)cc1F	ZINC001753284136	1440348256	/nfs/dbraw/zinc/34/82/56/1440348256.db2.gz	KNXUHJYMPUQPNH-HNNXBMFYSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC/C=C(\C)C(=O)NCC[C@H]1CCN(Cc2ccc(C#N)s2)C1	ZINC001753321082	1440363487	/nfs/dbraw/zinc/36/34/87/1440363487.db2.gz	BNCZWDKPXMXHEO-DOCFVWFQSA-N	0	3	331.485	3.304	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H]2C[C@H]1CN2C(=O)c1ccnc(C2CC2)c1	ZINC001753423287	1440395858	/nfs/dbraw/zinc/39/58/58/1440395858.db2.gz	CLMRTBMUADBUIQ-JLSDUUJJSA-N	0	3	325.456	3.212	20	30		EGEDHN
C=CCCC(=O)N(C)[C@@H]1CCN(CCCOc2ccccc2C)C1	ZINC001753433730	1440399310	/nfs/dbraw/zinc/39/93/10/1440399310.db2.gz	MQFPHZACNCJTJD-GOSISDBHSA-N	0	3	330.472	3.263	20	30		EGEDHN
C#CCCCC(=O)N(CC)[C@H]1CCN(Cc2cccc(COC)c2)C1	ZINC001753455636	1440407978	/nfs/dbraw/zinc/40/79/78/1440407978.db2.gz	MZEICSAVUJYXKR-FQEVSTJZSA-N	0	3	342.483	3.059	20	30		EGEDHN
C=CCOCCN1CC[C@@H](N(CC)C(=O)[C@@H]2C[C@H]2CC(C)(C)C)C1	ZINC001753457499	1440408910	/nfs/dbraw/zinc/40/89/10/1440408910.db2.gz	RUYRAPKDSUSZBW-RCCFBDPRSA-N	0	3	336.520	3.184	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)COc2cccc(Cl)c2)C1	ZINC001753460912	1440410669	/nfs/dbraw/zinc/41/06/69/1440410669.db2.gz	BPPQNOPKFMEUFX-INIZCTEOSA-N	0	3	336.863	3.218	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@H](CC)N[C@H](C)C(=O)Nc1ccccc1	ZINC001753481561	1440416788	/nfs/dbraw/zinc/41/67/88/1440416788.db2.gz	SRJXVKMVKGKNBK-CVEARBPZSA-N	0	3	345.487	3.100	20	30		EGEDHN
CC[C@H](CNC(=O)C[C@H]1CC=CCC1)NCc1ccc(C#N)c(F)c1	ZINC001753482111	1440416959	/nfs/dbraw/zinc/41/69/59/1440416959.db2.gz	BIYGYMVSDNFIFZ-MAUKXSAKSA-N	0	3	343.446	3.428	20	30		EGEDHN
CC[C@H](CNC(=O)[C@H](C)C1CCCC1)NCC#Cc1ccc(F)cc1	ZINC001753492428	1440419981	/nfs/dbraw/zinc/41/99/81/1440419981.db2.gz	NKOUVQUFBMPKTJ-OXQOHEQNSA-N	0	3	344.474	3.488	20	30		EGEDHN
C[C@H](C#N)C(=O)NC1(CNCc2cc(Cl)ccc2F)CCCC1	ZINC001753500788	1440423219	/nfs/dbraw/zinc/42/32/19/1440423219.db2.gz	NXMVPQLBEINWDX-GFCCVEGCSA-N	0	3	337.826	3.157	20	30		EGEDHN
CCC(CC)C(=O)N[C@@](C)(CNCC#Cc1ccccc1)C1CC1	ZINC001753513758	1440426820	/nfs/dbraw/zinc/42/68/20/1440426820.db2.gz	VUPHCTMNPZHPRY-NRFANRHFSA-N	0	3	326.484	3.349	20	30		EGEDHN
Cc1cc(C(=O)N[C@@](C)(CNCC#Cc2ccccc2)C2CC2)co1	ZINC001753517030	1440427688	/nfs/dbraw/zinc/42/76/88/1440427688.db2.gz	WADYCWDGNVKEFZ-NRFANRHFSA-N	0	3	336.435	3.128	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCCN(C(=O)c2cnc(C3CC3)o2)C1	ZINC001753547233	1440434461	/nfs/dbraw/zinc/43/44/61/1440434461.db2.gz	ALJONTWQONUJIV-ZDUSSCGKSA-N	0	3	337.851	3.136	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)[C@H](C)CCC)CC1	ZINC001753579932	1440439925	/nfs/dbraw/zinc/43/99/25/1440439925.db2.gz	XJILGOZFWTVSGX-MRVWCRGKSA-N	0	3	331.298	3.348	20	30		EGEDHN
C#CCNCc1ccc(CNC(=O)c2c(F)cccc2Cl)cc1	ZINC001753592114	1440443161	/nfs/dbraw/zinc/44/31/61/1440443161.db2.gz	ZVBPQHDLXSELKG-UHFFFAOYSA-N	0	3	330.790	3.132	20	30		EGEDHN
CC#CCNCc1ccc(CNC(=O)[C@H](C)c2ccccc2F)cc1	ZINC001753591873	1440443188	/nfs/dbraw/zinc/44/31/88/1440443188.db2.gz	QMPKHMBGCWLULQ-MRXNPFEDSA-N	0	3	338.426	3.359	20	30		EGEDHN
CC[C@@H](C)C(=O)NCc1ccc(CNCC#Cc2ccccc2)cc1	ZINC001753597717	1440445337	/nfs/dbraw/zinc/44/53/37/1440445337.db2.gz	HYJUGVSVRDKXEL-GOSISDBHSA-N	0	3	334.463	3.490	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H]1C(=O)NC[C@H](C)CNCc1ccccc1C#N	ZINC001753630916	1440452187	/nfs/dbraw/zinc/45/21/87/1440452187.db2.gz	QWILBKJMTFODKG-ATZDWAIDSA-N	0	3	327.472	3.082	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@H](C)CNCc1nc2ccccc2o1	ZINC001753633627	1440452725	/nfs/dbraw/zinc/45/27/25/1440452725.db2.gz	HEXFVNGKJAPQQA-CQSZACIVSA-N	0	3	329.444	3.272	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)CCC2CC2)CCCC1	ZINC001753662261	1440459069	/nfs/dbraw/zinc/45/90/69/1440459069.db2.gz	BGNFPDVYYIBCGY-UHFFFAOYSA-N	0	3	329.282	3.104	20	30		EGEDHN
CC(C)C#CC(=O)NCC1(NCc2ccc(F)cc2F)CCCC1	ZINC001753663840	1440459637	/nfs/dbraw/zinc/45/96/37/1440459637.db2.gz	JTHQMALHZIWESU-UHFFFAOYSA-N	0	3	334.410	3.143	20	30		EGEDHN
C[C@H](CNCC#Cc1ccccc1)N(C)C(=O)[C@H]1CCC(C)(C)C1	ZINC001753710696	1440470548	/nfs/dbraw/zinc/47/05/48/1440470548.db2.gz	HBZGKHHFEJCITO-MJGOQNOKSA-N	0	3	326.484	3.301	20	30		EGEDHN
Cc1ccc([C@@H](C)C(=O)N(C)[C@@H](C)CNCc2ccc(C#N)s2)o1	ZINC001753716537	1440472110	/nfs/dbraw/zinc/47/21/10/1440472110.db2.gz	WCHSKCBOPGQHDP-GXTWGEPZSA-N	0	3	345.468	3.261	20	30		EGEDHN
CCC1(C(=O)N(C)[C@@H](C)CNCC#Cc2ccccc2)CCCC1	ZINC001753717504	1440472179	/nfs/dbraw/zinc/47/21/79/1440472179.db2.gz	QFMSEUNRBHZXKW-SFHVURJKSA-N	0	3	326.484	3.445	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](NCc2cc(C3CC3)no2)[C@@H](C)C1	ZINC001753756071	1440483167	/nfs/dbraw/zinc/48/31/67/1440483167.db2.gz	ZHSJWALGHHVZFD-YOEHRIQHSA-N	0	3	345.487	3.481	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H](C)[C@@H]1CNCc1c(C)nsc1C	ZINC001753806003	1440491742	/nfs/dbraw/zinc/49/17/42/1440491742.db2.gz	UUQIHBBOECZCRZ-DYVFJYSZSA-N	0	3	335.517	3.443	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@@H]([C@@H](C)NCc2nnc(C(C)C)[nH]2)C1	ZINC001753815332	1440493710	/nfs/dbraw/zinc/49/37/10/1440493710.db2.gz	LMDLGQOVIVWEAD-HZPDHXFCSA-N	0	3	347.507	3.001	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)C1CC=CC1)NCC#Cc1ccccc1Cl	ZINC001753827040	1440498620	/nfs/dbraw/zinc/49/86/20/1440498620.db2.gz	IEHQILVOBFGFPV-LJQANCHMSA-N	0	3	344.886	3.388	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)Cc1ccc(OC)cc1C)C(C)C	ZINC001753829897	1440499305	/nfs/dbraw/zinc/49/93/05/1440499305.db2.gz	COFLVMSSBYTTRR-KRWDZBQOSA-N	0	3	338.879	3.029	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1ccc2ncsc2c1)C(C)C	ZINC001753841618	1440502988	/nfs/dbraw/zinc/50/29/88/1440502988.db2.gz	BTOUYLXUYUWAOE-CQSZACIVSA-N	0	3	337.876	3.393	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)CCN(C)CCOc2ccc(C)cc2)C1	ZINC001753862773	1440512447	/nfs/dbraw/zinc/51/24/47/1440512447.db2.gz	IXPHUJOESCYITH-UHFFFAOYSA-N	0	3	330.472	3.120	20	30		EGEDHN
CCCSCC(=O)N[C@@H]1CCC[C@H]1CNCc1ccccc1C#N	ZINC001753880624	1440520484	/nfs/dbraw/zinc/52/04/84/1440520484.db2.gz	RIGOKWAZHHNGCJ-ZWKOTPCHSA-N	0	3	345.512	3.076	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CCC[C@@H]1CNCc1nc(C)sc1C	ZINC001753887435	1440521494	/nfs/dbraw/zinc/52/14/94/1440521494.db2.gz	JHEMUCWDYNCCGA-HZPDHXFCSA-N	0	3	335.517	3.491	20	30		EGEDHN
C=CCCC(=O)NC/C=C\CNCc1ccc(Br)cc1	ZINC001754102062	1440541314	/nfs/dbraw/zinc/54/13/14/1440541314.db2.gz	YPWBSKDLFNLMFW-PLNGDYQASA-N	0	3	337.261	3.177	20	30		EGEDHN
CC(C)(C)/C=C/C(=O)NC/C=C/CNCc1ccc(F)c(C#N)c1	ZINC001754104617	1440541517	/nfs/dbraw/zinc/54/15/17/1440541517.db2.gz	VDEBJFOFNKGPQO-KQWYESAVSA-N	0	3	329.419	3.062	20	30		EGEDHN
C[C@@H]1CC[C@@H](CC(=O)NC/C=C/CNCc2cccc(C#N)c2)C1	ZINC001754159032	1440545892	/nfs/dbraw/zinc/54/58/92/1440545892.db2.gz	LEQFUTADLUMENZ-MLMMWPPISA-N	0	3	325.456	3.147	20	30		EGEDHN
C[C@@H]1CC[C@H](CC(=O)NC/C=C\CNCc2cccc(C#N)c2)C1	ZINC001754159033	1440545967	/nfs/dbraw/zinc/54/59/67/1440545967.db2.gz	LEQFUTADLUMENZ-SNSIWUOESA-N	0	3	325.456	3.147	20	30		EGEDHN
C[C@H](CNCC#Cc1ccc(Cl)cc1)NC(=O)[C@@]12C[C@@H]1CCCC2	ZINC001754241230	1440555883	/nfs/dbraw/zinc/55/58/83/1440555883.db2.gz	SUVIJAFVNRLXTD-SYNHAJSKSA-N	0	3	344.886	3.366	20	30		EGEDHN
C[C@H](CNCc1ccc(F)c(C#N)c1)NC(=O)c1ccc(Cl)cc1	ZINC001754250397	1440557919	/nfs/dbraw/zinc/55/79/19/1440557919.db2.gz	LBJKRJYPKXWMQW-GFCCVEGCSA-N	0	3	345.805	3.259	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)C1(F)CCCCC1	ZINC001754330490	1440583554	/nfs/dbraw/zinc/58/35/54/1440583554.db2.gz	LPERNPXYPWZTLV-HNNXBMFYSA-N	0	3	331.435	3.167	20	30		EGEDHN
C[C@H](CN(C)Cc1cccc(C#N)c1)NC(=O)c1cccc2c1CCC2	ZINC001754336698	1440586976	/nfs/dbraw/zinc/58/69/76/1440586976.db2.gz	OOFCFAKSXGRTMB-MRXNPFEDSA-N	0	3	347.462	3.297	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CCCC[C@H]1CNCc1ncc(C)s1	ZINC001754339468	1440587937	/nfs/dbraw/zinc/58/79/37/1440587937.db2.gz	FIDNIWYNAFACDB-DLBZAZTESA-N	0	3	347.528	3.410	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CCCC[C@H]1CNCc1ocnc1C	ZINC001754344482	1440589478	/nfs/dbraw/zinc/58/94/78/1440589478.db2.gz	DRSQNEYJUNDAFN-JKSUJKDBSA-N	0	3	333.476	3.350	20	30		EGEDHN
CC1=C(C)C[C@H](C(=O)NCC2(NCc3ccc(C#N)cc3)CC2)CC1	ZINC001754515076	1440618441	/nfs/dbraw/zinc/61/84/41/1440618441.db2.gz	OCHQYRPBUFFSGX-LJQANCHMSA-N	0	3	337.467	3.433	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)[C@@]34C[C@@H]3CCCC4)CC2)cc1F	ZINC001754524761	1440620812	/nfs/dbraw/zinc/62/08/12/1440620812.db2.gz	QALURYGTPGXSEJ-JXFKEZNVSA-N	0	3	341.430	3.016	20	30		EGEDHN
CCc1ccsc1C(=O)NCC1(NCc2cccc(C#N)c2)CC1	ZINC001754535415	1440624103	/nfs/dbraw/zinc/62/41/03/1440624103.db2.gz	HMZWLPUTCOXCPX-UHFFFAOYSA-N	0	3	339.464	3.234	20	30		EGEDHN
CC#CCN(CCOC)C1CCN(C(=O)[C@@H](C)C(CC)CC)CC1	ZINC001754560122	1440633446	/nfs/dbraw/zinc/63/34/46/1440633446.db2.gz	ZVVUXPYCNNKZSW-KRWDZBQOSA-N	0	3	336.520	3.021	20	30		EGEDHN
C#CCN(C(=O)[C@H](F)C(C)C)C1CCN(Cc2ccc(C)cc2)CC1	ZINC001754639359	1440648812	/nfs/dbraw/zinc/64/88/12/1440648812.db2.gz	FFZZHLBGTWIFTN-HXUWFJFHSA-N	0	3	344.474	3.415	20	30		EGEDHN
CC#CCNC[C@@H](NC(=O)[C@H]1CC12CC2)c1ccc2ccccc2c1	ZINC001754643966	1440649528	/nfs/dbraw/zinc/64/95/28/1440649528.db2.gz	LGFXHKBGGRHXFD-WOJBJXKFSA-N	0	3	332.447	3.410	20	30		EGEDHN
C=C(C)CCC(=O)N[C@]1(C)CCN(CCOc2ccccc2C)C1	ZINC001754673462	1440658995	/nfs/dbraw/zinc/65/89/95/1440658995.db2.gz	ASVHJLIXRUZGCI-HXUWFJFHSA-N	0	3	330.472	3.311	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)Cc2coc3ccc(C)cc23)C1	ZINC001754674054	1440659123	/nfs/dbraw/zinc/65/91/23/1440659123.db2.gz	MLBHSBGGYXLODA-HXUWFJFHSA-N	0	3	326.440	3.440	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC2(C)CCN(Cc3ccccn3)CC2)C1	ZINC001754721085	1440673158	/nfs/dbraw/zinc/67/31/58/1440673158.db2.gz	ZGZKHBGTGSTCCT-UHFFFAOYSA-N	0	3	327.472	3.156	20	30		EGEDHN
C=CCN1CCC[C@@](C)(CNC(=O)[C@]2(C)CCc3ccccc32)C1	ZINC001754733681	1440681388	/nfs/dbraw/zinc/68/13/88/1440681388.db2.gz	FIZHWBXYMWAXKW-LEWJYISDSA-N	0	3	326.484	3.295	20	30		EGEDHN
C=CCN1CCC[C@](C)(CNC(=O)Cn2c(C)cc3ccccc32)C1	ZINC001754737079	1440682522	/nfs/dbraw/zinc/68/25/22/1440682522.db2.gz	ZCXVOIMXCVYMJI-OAQYLSRUSA-N	0	3	339.483	3.354	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(Cc1cnc(C)o1)C2	ZINC001754785322	1440687595	/nfs/dbraw/zinc/68/75/95/1440687595.db2.gz	LNAINBJMPVYSPR-JQHSSLGASA-N	0	3	343.471	3.221	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)CCCOC(C)C)C2)CC1	ZINC001754785868	1440687830	/nfs/dbraw/zinc/68/78/30/1440687830.db2.gz	RAGGDVDLZMQGJK-FQEVSTJZSA-N	0	3	348.531	3.166	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H](NC[C@@H](C)O)c2ccccc2CC)CC1	ZINC001754792258	1440688726	/nfs/dbraw/zinc/68/87/26/1440688726.db2.gz	ZLGDWTVEOFUFBC-OXQOHEQNSA-N	0	3	344.499	3.123	20	30		EGEDHN
C#CCCN(C)Cc1ccccc1CNC(=O)c1cccc2c1OCC2	ZINC001754946830	1440713547	/nfs/dbraw/zinc/71/35/47/1440713547.db2.gz	YYLNHUIZFJOWAR-UHFFFAOYSA-N	0	3	348.446	3.007	20	30		EGEDHN
C#CCN[C@@H](C)c1ccc(CNC(=O)c2cccc3cc[nH]c32)cc1	ZINC001754949202	1440714538	/nfs/dbraw/zinc/71/45/38/1440714538.db2.gz	XVIFZFSKJGJBOI-HNNXBMFYSA-N	0	3	331.419	3.382	20	30		EGEDHN
CC/C(C)=C\C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001754960159	1440717443	/nfs/dbraw/zinc/71/74/43/1440717443.db2.gz	ZFMRDABJRSGGNZ-BOPFTXTBSA-N	0	3	337.467	3.339	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCO[C@H](CNCc2cc(C)ccc2F)C1	ZINC001755010207	1440725889	/nfs/dbraw/zinc/72/58/89/1440725889.db2.gz	ZZLAGDPEQADXAW-QGZVFWFLSA-N	0	3	348.462	3.053	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CCCN(Cc2oc(CCC)nc2C)CC1	ZINC001755020613	1440726589	/nfs/dbraw/zinc/72/65/89/1440726589.db2.gz	IDJFUOIGLUBTLJ-MRXNPFEDSA-N	0	3	333.476	3.372	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CCCN(Cc2cn(C(C)C)nc2C)CC1	ZINC001755027452	1440729519	/nfs/dbraw/zinc/72/95/19/1440729519.db2.gz	AJZPJYBQPYXLPM-GOSISDBHSA-N	0	3	346.519	3.455	20	30		EGEDHN
CC[C@@H](c1ccc(F)cc1F)N(C)CCCN(C)C(=O)[C@@H](C)C#N	ZINC001755035141	1440733918	/nfs/dbraw/zinc/73/39/18/1440733918.db2.gz	JTPUHXCTQQMNCD-GUYCJALGSA-N	0	3	337.414	3.356	20	30		EGEDHN
CC#CCN(C)CCCN(C)C(=O)CCc1ccc([C@@H]2C[C@H]2C)o1	ZINC001755040155	1440736751	/nfs/dbraw/zinc/73/67/51/1440736751.db2.gz	LAJKPOZSBQGFPH-SJLPKXTDSA-N	0	3	330.472	3.139	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC[C@@]2(CCN(Cc3ocnc3C)C2)C1	ZINC001755079480	1440750485	/nfs/dbraw/zinc/75/04/85/1440750485.db2.gz	LASITDINDDLKAE-PXNSSMCTSA-N	0	3	345.487	3.400	20	30		EGEDHN
C=CCOCCCC(=O)N1C[C@H](C)[C@H](NCc2cc(C)ccc2F)C1	ZINC001755107135	1440753878	/nfs/dbraw/zinc/75/38/78/1440753878.db2.gz	JKQWHLPNSUXUNO-QFBILLFUSA-N	0	3	348.462	3.053	20	30		EGEDHN
CCC(=CC(=O)N1C[C@@H](C)[C@@H](NCc2ccc(C#N)c(F)c2)C1)CC	ZINC001755108126	1440753988	/nfs/dbraw/zinc/75/39/88/1440753988.db2.gz	ZUUCSBHWXYSORA-KUHUBIRLSA-N	0	3	343.446	3.380	20	30		EGEDHN
C[C@@H]1CN(C(=O)C23CCC(CC2)C3)C[C@@H]1NCC#Cc1ccccc1	ZINC001755110176	1440754164	/nfs/dbraw/zinc/75/41/64/1440754164.db2.gz	JGQMQHQVRMJGRQ-QIYGCADZSA-N	0	3	336.479	3.055	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)CCc2cc(F)ccc2F)C(C)(C)C1	ZINC001755143043	1440761788	/nfs/dbraw/zinc/76/17/88/1440761788.db2.gz	HEEJZXHJWQPSDR-SFHVURJKSA-N	0	3	348.437	3.137	20	30		EGEDHN
C=CCCCN1CCOC2(CCN(C(=O)C[C@@H]3CC=CCC3)CC2)C1	ZINC001755174619	1440770369	/nfs/dbraw/zinc/77/03/69/1440770369.db2.gz	WMIPKONMZTYQIH-LJQANCHMSA-N	0	3	346.515	3.392	20	30		EGEDHN
C=CCOCCN(C)C[C@@H]1CCCN1C(=O)C1(C2CCC2)CCC1	ZINC001755196173	1440776962	/nfs/dbraw/zinc/77/69/62/1440776962.db2.gz	HHPHOBKYZBUNKU-SFHVURJKSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(Br)CNCC1CC(NC(=O)c2cccc(C)c2)C1	ZINC001755204345	1440781675	/nfs/dbraw/zinc/78/16/75/1440781675.db2.gz	CKVVWRQRGWXWGN-UHFFFAOYSA-N	0	3	337.261	3.002	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H](C)[C@@H](C)NCc2ccc(C#N)s2)cc1F	ZINC001755242585	1440789748	/nfs/dbraw/zinc/78/97/48/1440789748.db2.gz	CTZWSDKEMNFNRT-OLZOCXBDSA-N	0	3	345.443	3.364	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H](C)[C@H](C)NCc2ccc(C#N)s2)cc1F	ZINC001755242586	1440789866	/nfs/dbraw/zinc/78/98/66/1440789866.db2.gz	CTZWSDKEMNFNRT-QWHCGFSZSA-N	0	3	345.443	3.364	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H](C)[C@@H](C)NCC#Cc1ccc(Cl)cc1	ZINC001755249570	1440791587	/nfs/dbraw/zinc/79/15/87/1440791587.db2.gz	QXWBTXDVRVXMKC-HUUCEWRRSA-N	0	3	332.875	3.387	20	30		EGEDHN
Cc1ccc(C(=O)N(C)CC(C)(C)CNCc2ccccc2C#N)o1	ZINC001755277046	1440799397	/nfs/dbraw/zinc/79/93/97/1440799397.db2.gz	CLTQZXMISLKQKM-UHFFFAOYSA-N	0	3	339.439	3.348	20	30		EGEDHN
C=C(Br)CNCC(C)(C)CN(C)C(=O)[C@H]1CC12CCC2	ZINC001755285066	1440801852	/nfs/dbraw/zinc/80/18/52/1440801852.db2.gz	DPGLGHURPKMFMU-CYBMUJFWSA-N	0	3	343.309	3.159	20	30		EGEDHN
COc1cccc([C@@H](C)N(C)[C@@H](C)CNC(=O)C#CC(C)(C)C)c1	ZINC001755299328	1440807860	/nfs/dbraw/zinc/80/78/60/1440807860.db2.gz	AIGPZWNSRPFFSU-JKSUJKDBSA-N	0	3	330.472	3.242	20	30		EGEDHN
Cc1ccc(C)c(CC(=O)NC[C@@H](C)N(C)Cc2ccc(C#N)cc2)c1	ZINC001755313957	1440814741	/nfs/dbraw/zinc/81/47/41/1440814741.db2.gz	QNQSPRVELBVQTO-GOSISDBHSA-N	0	3	349.478	3.354	20	30		EGEDHN
CCCC[C@@H](CNCc1ccc(C#N)s1)NC(=O)c1cc[nH]c1C	ZINC001755356976	1440829933	/nfs/dbraw/zinc/82/99/33/1440829933.db2.gz	CGWYWVCBFYDXHF-AWEZNQCLSA-N	0	3	344.484	3.335	20	30		EGEDHN
CCCC[C@@H](CNCc1ccc(F)c(C#N)c1)NC(=O)C#CC(C)C	ZINC001755357251	1440830167	/nfs/dbraw/zinc/83/01/67/1440830167.db2.gz	GXCJHOVIFUWZFY-SFHVURJKSA-N	0	3	343.446	3.121	20	30		EGEDHN
C[C@H](C(=O)NC[C@@H]1CCCCCN1Cc1ccc(C#N)cc1)C1CC1	ZINC001755365009	1440833969	/nfs/dbraw/zinc/83/39/69/1440833969.db2.gz	OEBDJENGVCBIER-JXFKEZNVSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@H]1CN(Cc2cc3ccccc3s2)CC1(C)C	ZINC001755407363	1440844834	/nfs/dbraw/zinc/84/48/34/1440844834.db2.gz	OGBNNASBZMJXQE-DYVFJYSZSA-N	0	3	341.480	3.388	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C[C@H](C)c2ccccc2C)C(C)(C)C1	ZINC001755411815	1440846523	/nfs/dbraw/zinc/84/65/23/1440846523.db2.gz	OMXLDMHGXQCZKW-PKOBYXMFSA-N	0	3	326.484	3.339	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)[C@H](C)CCc2ccccc2F)C(C)(C)C1	ZINC001755412372	1440846904	/nfs/dbraw/zinc/84/69/04/1440846904.db2.gz	UCMBABYIANBDKW-APWZRJJASA-N	0	3	344.474	3.244	20	30		EGEDHN
C=CCCCC(=O)N1CCC2(CO[C@H](CNCC(=C)Cl)C2)CC1	ZINC001755463116	1440857907	/nfs/dbraw/zinc/85/79/07/1440857907.db2.gz	GWICOMMHWRDTAV-INIZCTEOSA-N	0	3	340.895	3.083	20	30		EGEDHN
C[C@@H](CCCNCc1ccccc1C#N)NC(=O)[C@H]1CC=CCC1	ZINC001755487699	1440861080	/nfs/dbraw/zinc/86/10/80/1440861080.db2.gz	BCKOIZCLNBFILP-IRXDYDNUSA-N	0	3	325.456	3.289	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CCC(N(C)C/C=C\Cl)CC1)OCC	ZINC001755530291	1440867030	/nfs/dbraw/zinc/86/70/30/1440867030.db2.gz	ZGYKMDDLXNENHF-HWYHOQROSA-N	0	3	328.884	3.033	20	30		EGEDHN
Cc1ccccc1C(=O)N(C)C[C@H](C)NCc1ccc(C#N)c(F)c1	ZINC001755576355	1440878157	/nfs/dbraw/zinc/87/81/57/1440878157.db2.gz	UXAHXWRRXHEMSF-HNNXBMFYSA-N	0	3	339.414	3.256	20	30		EGEDHN
C[C@H](CN(C)C(=O)c1ccsc1)NCc1ccc(C#N)c(F)c1	ZINC001755576345	1440878255	/nfs/dbraw/zinc/87/82/55/1440878255.db2.gz	BMKAZGPWJMZGNW-GFCCVEGCSA-N	0	3	331.416	3.009	20	30		EGEDHN
C[C@@H](CN(C)C(=O)[C@@H](C)C(C)(C)C)NCc1ccc(C#N)c(F)c1	ZINC001755592255	1440881723	/nfs/dbraw/zinc/88/17/23/1440881723.db2.gz	BAKTUSSVOXTSDP-UONOGXRCSA-N	0	3	333.451	3.316	20	30		EGEDHN
C#Cc1cncc(C(=O)N(C)C[C@H](C)N[C@H](C)c2ccccc2F)c1	ZINC001755604340	1440885016	/nfs/dbraw/zinc/88/50/16/1440885016.db2.gz	UJQPDFFEHLCGOW-LSDHHAIUSA-N	0	3	339.414	3.013	20	30		EGEDHN
C[C@@H](CN(C)C(=O)C1CCC(F)CC1)NCc1ccc(F)c(C#N)c1	ZINC001755605181	1440885317	/nfs/dbraw/zinc/88/53/17/1440885317.db2.gz	HIAVRCJESYLPAO-KTAKPFMOSA-N	0	3	349.425	3.162	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@H](CO)N[C@@H](C)c1ccc2ccccc2c1	ZINC001755630978	1440890661	/nfs/dbraw/zinc/89/06/61/1440890661.db2.gz	UYSYZJRHAPSJCN-OXJNMPFZSA-N	0	3	340.467	3.324	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@@H](NCc2cc(Cl)ccc2F)[C@@H]1C	ZINC001755653890	1440891700	/nfs/dbraw/zinc/89/17/00/1440891700.db2.gz	LPZHVDVNOFFBFU-SUMWQHHRSA-N	0	3	336.838	3.218	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)[C@@H]1C	ZINC001755657954	1440892289	/nfs/dbraw/zinc/89/22/89/1440892289.db2.gz	DOFJFUAVQHBYGG-KBXCAEBGSA-N	0	3	329.419	3.133	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2cc(F)cc(F)c2)CN1C(=O)C#CC(C)(C)C	ZINC001755677987	1440894892	/nfs/dbraw/zinc/89/48/92/1440894892.db2.gz	FBQQERNUZWKYRA-CXAGYDPISA-N	0	3	334.410	3.093	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)CCc2ccc(F)cc2F)[C@H]1C	ZINC001755721358	1440907613	/nfs/dbraw/zinc/90/76/13/1440907613.db2.gz	NJWRSZSCDRTMPZ-RDTXWAMCSA-N	0	3	336.426	3.443	20	30		EGEDHN
CCCCC[C@@H](CC)C(=O)N1C[C@@H](NCC#CCOC)C(C)(C)C1	ZINC001755765972	1440916199	/nfs/dbraw/zinc/91/61/99/1440916199.db2.gz	AEWHQRVAGZKXLU-QZTJIDSGSA-N	0	3	336.520	3.069	20	30		EGEDHN
CC(C)(C)[C@H](CNCc1ccc(C#N)s1)NC(=O)[C@@H]1CC12CC2	ZINC001755833696	1440929408	/nfs/dbraw/zinc/92/94/08/1440929408.db2.gz	ODKVOIFNCGHPQJ-GJZGRUSLSA-N	0	3	331.485	3.040	20	30		EGEDHN
C=CCC1(C(=O)NCC2=CCN(C[C@H]3CCCCO3)CC2)CCCC1	ZINC001755899150	1440943386	/nfs/dbraw/zinc/94/33/86/1440943386.db2.gz	JIDDMQUQXVEEEY-LJQANCHMSA-N	0	3	346.515	3.440	20	30		EGEDHN
C=CCC1(C(=O)NCC2=CCN(CCOC(C)C)CC2)CCCC1	ZINC001755899086	1440943500	/nfs/dbraw/zinc/94/35/00/1440943500.db2.gz	HTDQQGDIEPUZBF-UHFFFAOYSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=CCNCc1ccc(CNC(=O)c2cc(C(C)C)on2)c(F)c1	ZINC001755902479	1440944225	/nfs/dbraw/zinc/94/42/25/1440944225.db2.gz	TUDWUJNTNRPYPR-UHFFFAOYSA-N	0	3	331.391	3.143	20	30		EGEDHN
CC(C)CN1CCN(c2nc3c(cc2C#N)CCCC3(C)C)CC1	ZINC001164661393	719340307	/nfs/dbraw/zinc/34/03/07/719340307.db2.gz	KSXFHNXAWRSMQG-UHFFFAOYSA-N	0	3	326.488	3.345	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(C(F)(F)F)c(F)c2)CC1	ZINC000189728298	201048806	/nfs/dbraw/zinc/04/88/06/201048806.db2.gz	KNXWWATXHUNOGX-UHFFFAOYSA-N	0	3	330.325	3.225	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)[C@@H](C)c2cc(F)ccc2F)CC1	ZINC000264335092	201210435	/nfs/dbraw/zinc/21/04/35/201210435.db2.gz	GNXUAHKOIYMICL-ZDUSSCGKSA-N	0	3	337.414	3.318	20	30		EGEDHN
C=C(C)COc1cc(CN2CCC(CCC(N)=O)CC2)ccc1OC	ZINC000271184062	201242704	/nfs/dbraw/zinc/24/27/04/201242704.db2.gz	IUZFRZYOSMOIOL-UHFFFAOYSA-N	0	3	346.471	3.128	20	30		EGEDHN
C=CCN1CCC(NC(=O)COc2cc(C)c(Cl)c(C)c2)CC1	ZINC000269009931	201229383	/nfs/dbraw/zinc/22/93/83/201229383.db2.gz	NHMLYHKJVCQBMT-UHFFFAOYSA-N	0	3	336.863	3.102	20	30		EGEDHN
C#CCCCCc1nc(-c2ccc3c(c2)C(SC)C(=O)N3)no1	ZINC000274061884	201265073	/nfs/dbraw/zinc/26/50/73/201265073.db2.gz	WBHXNZPIIGALKT-OAHLLOKOSA-N	0	3	327.409	3.439	20	30		EGEDHN
CC#CCCCC(=O)N(Cc1ccncc1)C[C@H]1CCCN1CC	ZINC000274260639	201267256	/nfs/dbraw/zinc/26/72/56/201267256.db2.gz	BTUVNULHRLJYDF-LJQANCHMSA-N	0	3	327.472	3.088	20	30		EGEDHN
CN(C)CCOc1ccc(NCc2cc(C#N)n(C)c2)cc1Cl	ZINC000191410712	239095150	/nfs/dbraw/zinc/09/51/50/239095150.db2.gz	BXHMJBPZYXAKOD-UHFFFAOYSA-N	0	3	332.835	3.103	20	30		EGEDHN
C=CC[C@H](C)[C@@H](C)N[C@H](C(N)=O)c1cccc(Br)c1	ZINC000279685499	201321163	/nfs/dbraw/zinc/32/11/63/201321163.db2.gz	PEPKTGCGWOCTLK-WDMOLILDSA-N	0	3	325.250	3.166	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@H]1CCC[C@@H]1CCO	ZINC000279196943	201314407	/nfs/dbraw/zinc/31/44/07/201314407.db2.gz	FOYGXZUALRWCGB-CABCVRRESA-N	0	3	334.485	3.044	20	30		EGEDHN
C[C@@H]1CN(Cc2cccc(CNCc3ccc(C#N)cc3)c2)CCO1	ZINC000071828159	203122243	/nfs/dbraw/zinc/12/22/43/203122243.db2.gz	AYHMQROVLVLXLH-QGZVFWFLSA-N	0	3	335.451	3.069	20	30		EGEDHN
C#CCCCCNC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000152019231	204187391	/nfs/dbraw/zinc/18/73/91/204187391.db2.gz	KVWFBVAVZBZQBP-IEBWSBKVSA-N	0	3	327.472	3.142	20	30		EGEDHN
COC[C@@H]1CCCN(CC#Cc2ccc(OC(F)(F)F)cc2)C1	ZINC000152632099	204398164	/nfs/dbraw/zinc/39/81/64/204398164.db2.gz	PUNKMMXJVWGEKR-OAHLLOKOSA-N	0	3	327.346	3.295	20	30		EGEDHN
COc1ccc(Cl)cc1N1CC[C@@H](NCc2ccc(C#N)o2)C1	ZINC000174336946	207013025	/nfs/dbraw/zinc/01/30/25/207013025.db2.gz	NUSKHNSXLOZMKG-CYBMUJFWSA-N	0	3	331.803	3.182	20	30		EGEDHN
Cc1ccccc1[C@@H](C)N[C@H]1CCN(c2sccc2C#N)C1=O	ZINC000267725562	251289126	/nfs/dbraw/zinc/28/91/26/251289126.db2.gz	VSNCSZWAEAEZRI-CJNGLKHVSA-N	0	3	325.437	3.384	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN2CCC(c3nc4ccccc4[nH]3)CC2)cc1	ZINC000268618733	252072966	/nfs/dbraw/zinc/07/29/66/252072966.db2.gz	AULZZCOAXURUJF-HXUWFJFHSA-N	0	3	346.434	3.348	20	30		EGEDHN
C[C@H](N[C@@H]1CCCN(C(=O)Cc2ccccc2)C1)c1ccc(C#N)cc1	ZINC000338032456	141077015	/nfs/dbraw/zinc/07/70/15/141077015.db2.gz	VXOBJCFVJFZGNZ-LAUBAEHRSA-N	0	3	347.462	3.443	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)NC1CCN([C@H](C)c2ccncc2)CC1	ZINC000338120999	141096487	/nfs/dbraw/zinc/09/64/87/141096487.db2.gz	OCQWWEWCYMFBRQ-MRXNPFEDSA-N	0	3	348.450	3.217	20	30		EGEDHN
C[C@@H](c1ccc(C#N)cc1)N(C)CCn1cc(Br)cn1	ZINC000348059744	141236972	/nfs/dbraw/zinc/23/69/72/141236972.db2.gz	GHXONPFHMFRQEE-LBPRGKRZSA-N	0	3	333.233	3.210	20	30		EGEDHN
CN(C)CCOc1ccc(NC(=O)c2cc(C#N)ccc2Cl)cc1	ZINC000350618576	141255711	/nfs/dbraw/zinc/25/57/11/141255711.db2.gz	FBNMNMIRJBETHY-UHFFFAOYSA-N	0	3	343.814	3.404	20	30		EGEDHN
CC[C@H](CC(F)(F)F)N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000354574549	141308507	/nfs/dbraw/zinc/30/85/07/141308507.db2.gz	XZUVZNARZXBFDO-UKRRQHHQSA-N	0	3	339.361	3.374	20	30		EGEDHN
CN(Cc1ccccc1)CC(C)(C)NC(=O)c1ccc(F)c(C#N)c1	ZINC000341418313	155282485	/nfs/dbraw/zinc/28/24/85/155282485.db2.gz	FRBHDLYUUVMQSU-UHFFFAOYSA-N	0	3	339.414	3.338	20	30		EGEDHN
N#Cc1cccc(CCNCc2cc3c(cc2OC(F)F)OCO3)c1	ZINC000341476213	155312140	/nfs/dbraw/zinc/31/21/40/155312140.db2.gz	GCRNBGYUAXGFII-UHFFFAOYSA-N	0	3	346.333	3.221	20	30		EGEDHN
N#Cc1ccc(CN2CCC(CCCN3CCOCC3)CC2)cc1F	ZINC000192170227	153244552	/nfs/dbraw/zinc/24/45/52/153244552.db2.gz	MRDNKBCSNDZBKD-UHFFFAOYSA-N	0	3	345.462	3.022	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](NC/C=C/c3ccc(F)cc3)C2=O)cc1	ZINC000192244593	153246251	/nfs/dbraw/zinc/24/62/51/153246251.db2.gz	SENJQGZAVHKDFF-ZGTHZTNPSA-N	0	3	349.409	3.101	20	30		EGEDHN
COc1ccc(C#N)cc1CN1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O	ZINC000326518646	154184364	/nfs/dbraw/zinc/18/43/64/154184364.db2.gz	UGXBNOAAKOEYPN-OTWHNJEPSA-N	0	3	328.456	3.472	20	30		EGEDHN
C[C@H](CNC(=O)Nc1ccc(C#N)c(Cl)c1)N1CCC[C@@H](C)C1	ZINC000337372841	154315370	/nfs/dbraw/zinc/31/53/70/154315370.db2.gz	PPRSNQLUCIYKTA-CHWSQXEVSA-N	0	3	334.851	3.454	20	30		EGEDHN
CN(C)CCN(Cc1c[nH]nc1C(C)(C)C)Cc1ccc(C#N)cc1	ZINC000348891045	156277214	/nfs/dbraw/zinc/27/72/14/156277214.db2.gz	GOFQZKPBAMVBPN-UHFFFAOYSA-N	0	3	339.487	3.143	20	30		EGEDHN
N#Cc1ccccc1OCCN1CCC[C@@H](C(=O)Nc2ccccc2)C1	ZINC000125613188	162280105	/nfs/dbraw/zinc/28/01/05/162280105.db2.gz	YRCNNEUQAFNNIE-GOSISDBHSA-N	0	3	349.434	3.288	20	30		EGEDHN
N#Cc1ccc(CN2CCN(CCCCC3CCOCC3)CC2)cc1	ZINC000337142994	163142919	/nfs/dbraw/zinc/14/29/19/163142919.db2.gz	XUWLKVDLCCUPCE-UHFFFAOYSA-N	0	3	341.499	3.273	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N1CCC[C@H](CNC(=O)c2ccco2)C1	ZINC000338354166	163219943	/nfs/dbraw/zinc/21/99/43/163219943.db2.gz	MACMFABQXNMHII-NVXWUHKLSA-N	0	3	337.423	3.354	20	30		EGEDHN
CN(CCCN(C)c1nc2c(cc1C#N)CCCC2)Cc1ccco1	ZINC000343804758	164039023	/nfs/dbraw/zinc/03/90/23/164039023.db2.gz	HHWOLVYFBMAKGK-UHFFFAOYSA-N	0	3	338.455	3.383	20	30		EGEDHN
CC[C@@H](C(=O)NCCSCc1ccccc1C#N)N(CC)CC	ZINC000345952762	164302758	/nfs/dbraw/zinc/30/27/58/164302758.db2.gz	ICFWJBHVAHTJQE-KRWDZBQOSA-N	0	3	333.501	3.028	20	30		EGEDHN
CC[C@@H](C(=O)N1CCC(Oc2cccc(C#N)c2)CC1)N(CC)CC	ZINC000346021285	164319643	/nfs/dbraw/zinc/31/96/43/164319643.db2.gz	CGLKHOSQWRZRRL-IBGZPJMESA-N	0	3	343.471	3.048	20	30		EGEDHN
C[C@H]1C[C@H]1N1CCN(C(=O)c2cc(C#N)ccc2Cl)C[C@@H](C)C1	ZINC000346175921	164357257	/nfs/dbraw/zinc/35/72/57/164357257.db2.gz	DVVSULIBJQOIMR-GDZNZVCISA-N	0	3	331.847	3.014	20	30		EGEDHN
C[C@@H]1C[C@H]1N1CCN(C(=O)c2cc(C#N)ccc2Cl)C[C@@H](C)C1	ZINC000346175923	164357279	/nfs/dbraw/zinc/35/72/79/164357279.db2.gz	DVVSULIBJQOIMR-OGHNNQOOSA-N	0	3	331.847	3.014	20	30		EGEDHN
CN(C)Cc1cnc(CNCCSCc2ccccc2C#N)s1	ZINC000352245005	165305888	/nfs/dbraw/zinc/30/58/88/165305888.db2.gz	AZCWWOFBBFDUHG-UHFFFAOYSA-N	0	3	346.525	3.099	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)NC[C@@H](C)N1CCCC[C@@H]1C	ZINC000352400087	165382099	/nfs/dbraw/zinc/38/20/99/165382099.db2.gz	BJGQLRBIVCJSDE-LSDHHAIUSA-N	0	3	344.459	3.341	20	30		EGEDHN
COc1cc(C#N)ccc1CN1CCC[C@]1(CO)Cc1ccccc1	ZINC000355671771	166280143	/nfs/dbraw/zinc/28/01/43/166280143.db2.gz	NPRIAHGOLOWVOC-OAQYLSRUSA-N	0	3	336.435	3.136	20	30		EGEDHN
CC[C@H](C)N[C@H](CNC(=O)c1ncc(C#N)cc1Cl)c1ccco1	ZINC000359535411	167182951	/nfs/dbraw/zinc/18/29/51/167182951.db2.gz	CTMQTOKHKAJXTR-SMDDNHRTSA-N	0	3	346.818	3.059	20	30		EGEDHN
N#Cc1cccc(OC2CCN(CCCO[C@@H]3CCCCO3)CC2)c1	ZINC000366887110	168152312	/nfs/dbraw/zinc/15/23/12/168152312.db2.gz	UWSNCDJUOXNGGU-HXUWFJFHSA-N	0	3	344.455	3.335	20	30		EGEDHN
C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NCc1cccc(F)c1C#N	ZINC000495966952	269859829	/nfs/dbraw/zinc/85/98/29/269859829.db2.gz	FZDPCKWSLIPCJP-DYVFJYSZSA-N	0	3	347.434	3.432	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H](c3nnc4n3CCCCC4)C2)cc1	ZINC000298229863	270042865	/nfs/dbraw/zinc/04/28/65/270042865.db2.gz	YEANLDKFLCBYKW-GOSISDBHSA-N	0	3	335.455	3.256	20	30		EGEDHN
CSc1ccc(OC[C@H](O)CN[C@H](C)c2ccc(C#N)cc2)cc1	ZINC000411456682	270046511	/nfs/dbraw/zinc/04/65/11/270046511.db2.gz	VBWDBEGJGGWNOT-RHSMWYFYSA-N	0	3	342.464	3.371	20	30		EGEDHN
CSc1ccc(OC[C@@H](O)CN[C@H](C)c2ccc(C#N)cc2)cc1	ZINC000411456679	270046692	/nfs/dbraw/zinc/04/66/92/270046692.db2.gz	VBWDBEGJGGWNOT-PBHICJAKSA-N	0	3	342.464	3.371	20	30		EGEDHN
C#C[C@@H](NC(=O)C(C#N)Cc1ccc(C#N)cc1)c1ccc(Cl)cc1	ZINC000491712723	270058136	/nfs/dbraw/zinc/05/81/36/270058136.db2.gz	AFFKCBXCOXLCCY-IEBWSBKVSA-N	0	3	347.805	3.385	20	30		EGEDHN
CCCN(CC(=O)NCc1ccc(C#N)cc1)CC1CCCCC1	ZINC000497731599	270059109	/nfs/dbraw/zinc/05/91/09/270059109.db2.gz	BWFKXENFBHTQFQ-UHFFFAOYSA-N	0	3	327.472	3.467	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CN1CCC(c2ccccc2)CC1	ZINC000528336599	270060060	/nfs/dbraw/zinc/06/00/60/270060060.db2.gz	CPNDUGQXXLAXSP-FQEVSTJZSA-N	0	3	336.435	3.178	20	30		EGEDHN
CCCN(C)[C@H](CNC(=O)c1c[nH]c(C#N)c1)c1ccc(Cl)cc1	ZINC000286597469	266044975	/nfs/dbraw/zinc/04/49/75/266044975.db2.gz	WGFIHRPGLKGAEL-QGZVFWFLSA-N	0	3	344.846	3.353	20	30		EGEDHN
CCC[C@H](CC)NC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000195395585	266180878	/nfs/dbraw/zinc/18/08/78/266180878.db2.gz	LFIKIYWYJJBYGC-SFHVURJKSA-N	0	3	330.476	3.210	20	30		EGEDHN
CCOC(=O)N1CCC([C@H](C)NCc2ccc(F)cc2C#N)CC1	ZINC000186435188	266258845	/nfs/dbraw/zinc/25/88/45/266258845.db2.gz	ONPXTCONBPZGDT-ZDUSSCGKSA-N	0	3	333.407	3.044	20	30		EGEDHN
CCOCc1ccc(CNC(=O)C(C#N)Cc2ccc(C#N)cc2)cc1	ZINC000279820942	266285549	/nfs/dbraw/zinc/28/55/49/266285549.db2.gz	YEXCXZWCMNGHNP-HXUWFJFHSA-N	0	3	347.418	3.093	20	30		EGEDHN
CN(C)[C@@H](CNC(=O)NC1(c2cccc(C#N)c2)CC1)c1ccccc1	ZINC000269666050	266509665	/nfs/dbraw/zinc/50/96/65/266509665.db2.gz	KQTJZZLTIIDJNS-IBGZPJMESA-N	0	3	348.450	3.149	20	30		EGEDHN
COc1ccc([C@@H](OC)[C@@H](C)NCc2ccc(OC)c(C#N)c2)cc1	ZINC000271589477	266691213	/nfs/dbraw/zinc/69/12/13/266691213.db2.gz	WPTDZDXZLHPKBH-VLIAUNLRSA-N	0	3	340.423	3.441	20	30		EGEDHN
C/C=C(/C=C/C(=O)N(CCN(C)C)Cc1cccc(C#N)c1)CC	ZINC000492117432	266805438	/nfs/dbraw/zinc/80/54/38/266805438.db2.gz	IYOJWVJLSFISMY-CTEMIJIWSA-N	0	3	325.456	3.361	20	30		EGEDHN
C[C@@H]1CC=CC[C@H]1C(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000283918620	267011733	/nfs/dbraw/zinc/01/17/33/267011733.db2.gz	LAGSXYQTRNRIIH-VQIMIIECSA-N	0	3	325.456	3.051	20	30		EGEDHN
C[C@@H]1CN(CCC2CCN(c3ccc(C#N)cc3F)CC2)C[C@H](C)O1	ZINC000301512265	267049182	/nfs/dbraw/zinc/04/91/82/267049182.db2.gz	BAXORMRITDAJHT-IYBDPMFKSA-N	0	3	345.462	3.413	20	30		EGEDHN
CCN(C)C(=O)[C@@H](N[C@@H]1CCCCc2cc(C#N)ccc21)C(C)C	ZINC000453289533	267050917	/nfs/dbraw/zinc/05/09/17/267050917.db2.gz	SDZFUBYUXNULMK-MOPGFXCFSA-N	0	3	327.472	3.418	20	30		EGEDHN
CCO[C@@H]1CCCC[C@H]1N[C@@H](C)C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000452036695	267146826	/nfs/dbraw/zinc/14/68/26/267146826.db2.gz	RXKFJNBCNHWKBW-JCURWCKSSA-N	0	3	349.862	3.476	20	30		EGEDHN
C[C@H](NC(=O)C(C#N)Cc1ccc(C#N)cc1)c1cccc([N+](=O)[O-])c1	ZINC000348125459	267176749	/nfs/dbraw/zinc/17/67/49/267176749.db2.gz	WMDCGKOJPOCKHJ-GUYCJALGSA-N	0	3	348.362	3.026	20	30		EGEDHN
C[C@H](NCCOc1ccccc1C#N)[C@H]1OCCc2sccc21	ZINC000292373066	267183191	/nfs/dbraw/zinc/18/31/91/267183191.db2.gz	IZYRXNNRUWKXNR-SCLBCKFNSA-N	0	3	328.437	3.291	20	30		EGEDHN
CC[C@@H](NCCC(=O)Nc1ccccc1C#N)c1c(C)noc1C	ZINC000411513387	267194178	/nfs/dbraw/zinc/19/41/78/267194178.db2.gz	DDEKCWBGXPTARX-OAHLLOKOSA-N	0	3	326.400	3.233	20	30		EGEDHN
CC[C@H](CN[C@@H]1CCc2ccc(C#N)cc21)NC(=O)OC(C)(C)C	ZINC000495925491	267212560	/nfs/dbraw/zinc/21/25/60/267212560.db2.gz	XYEWKSAWEJPVQR-NVXWUHKLSA-N	0	3	329.444	3.438	20	30		EGEDHN
CCc1cc(OC)ccc1CN1CC[C@@H](Oc2ccc(C#N)cn2)C1	ZINC000430176278	267245884	/nfs/dbraw/zinc/24/58/84/267245884.db2.gz	HNNCFUBTMQNZNP-LJQANCHMSA-N	0	3	337.423	3.178	20	30		EGEDHN
C[C@H]1c2ccccc2CCN1C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000280544560	267253792	/nfs/dbraw/zinc/25/37/92/267253792.db2.gz	TYAMPOLHHDOMQM-KXBFYZLASA-N	0	3	329.403	3.386	20	30		EGEDHN
CN(C)CCOc1ccc(CCNc2c(C#N)cccc2C#N)cc1	ZINC000436397088	267281657	/nfs/dbraw/zinc/28/16/57/267281657.db2.gz	YWIZRVRYYALNTE-UHFFFAOYSA-N	0	3	334.423	3.025	20	30		EGEDHN
COc1ccc([C@H](CO)CN[C@@H](C)c2ccc(C#N)c(F)c2)cc1	ZINC000414177064	267643353	/nfs/dbraw/zinc/64/33/53/267643353.db2.gz	JLCDCFNLSRPQPD-GUYCJALGSA-N	0	3	328.387	3.133	20	30		EGEDHN
C[C@H](C(=O)Nc1cccc(OCCN(C)C)c1)c1cccc(C#N)c1	ZINC000463581321	267810355	/nfs/dbraw/zinc/81/03/55/267810355.db2.gz	FRVDMNDUKVDWKC-HNNXBMFYSA-N	0	3	337.423	3.241	20	30		EGEDHN
Cn1cc(CN2CCCC[C@@H]2CCNC(=O)OC(C)(C)C)cc1C#N	ZINC000495852293	268126664	/nfs/dbraw/zinc/12/66/64/268126664.db2.gz	VQRGNDJFBILPQK-MRXNPFEDSA-N	0	3	346.475	3.166	20	30		EGEDHN
N#Cc1ccc(CNC[C@@]2(O)CCC[C@@H](C(F)(F)F)C2)cc1F	ZINC000421383033	268233376	/nfs/dbraw/zinc/23/33/76/268233376.db2.gz	JQIRGEOEUGZACC-UKRRQHHQSA-N	0	3	330.325	3.271	20	30		EGEDHN
N#Cc1ncc(NC(=O)N2CCCN(C3CCCC3)CC2)cc1Cl	ZINC000516544881	268322818	/nfs/dbraw/zinc/32/28/18/268322818.db2.gz	TTZJTROOHDTVBM-UHFFFAOYSA-N	0	3	347.850	3.089	20	30		EGEDHN
COc1ccc(CNC[C@@]2(C)OCCc3sccc32)cc1C#N	ZINC000289779451	276392941	/nfs/dbraw/zinc/39/29/41/276392941.db2.gz	KKCRNWQSLDDQCL-GOSISDBHSA-N	0	3	328.437	3.206	20	30		EGEDHN
COC(=O)[C@@H](C)[C@H](NCCOc1cccc(C#N)c1)c1ccccc1	ZINC000079923773	307430007	/nfs/dbraw/zinc/43/00/07/307430007.db2.gz	OIFNSZQUDMWETF-KXBFYZLASA-N	0	3	338.407	3.077	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)c1cccc2[nH]ccc21	ZINC000080572496	307434323	/nfs/dbraw/zinc/43/43/23/307434323.db2.gz	NZXLOWODPCBMIM-UHFFFAOYSA-N	0	3	346.434	3.244	20	30		EGEDHN
CC(C)(NCCOc1cccc(C#N)c1)C(=O)NCC1CCCCC1	ZINC000155328006	307812262	/nfs/dbraw/zinc/81/22/62/307812262.db2.gz	HAFSMBXRCQQAKO-UHFFFAOYSA-N	0	3	343.471	3.002	20	30		EGEDHN
CCC1(CC)[C@H](NCC(=O)Nc2oc(C)c(C)c2C#N)[C@H](C)[C@H]1OC	ZINC000248838656	308012760	/nfs/dbraw/zinc/01/27/60/308012760.db2.gz	OSZCQMWDCCXNPE-JCURWCKSSA-N	0	3	347.459	3.136	20	30		EGEDHN
N#Cc1ccc(NC(=O)N2CCN(CC3CCCCC3)CC2)cc1F	ZINC000554994489	315360926	/nfs/dbraw/zinc/36/09/26/315360926.db2.gz	JSJUSELHORDITL-UHFFFAOYSA-N	0	3	344.434	3.427	20	30		EGEDHN
C[C@]1(Cc2ccccc2)CCCN1Cc1cnc2c(C#N)cnn2c1	ZINC000564984895	316242022	/nfs/dbraw/zinc/24/20/22/316242022.db2.gz	CUNPBUVLIQULMG-HXUWFJFHSA-N	0	3	331.423	3.198	20	30		EGEDHN
CN1CCC[C@@H](NCCC(=O)Nc2ccc(C#N)cc2)c2ccccc21	ZINC000569316661	316896175	/nfs/dbraw/zinc/89/61/75/316896175.db2.gz	NIKJRPKFGSQMJU-LJQANCHMSA-N	0	3	348.450	3.448	20	30		EGEDHN
C[C@@H](NCCOc1ccccc1C#N)c1ccc(-n2cccn2)cc1	ZINC000180852778	323459867	/nfs/dbraw/zinc/45/98/67/323459867.db2.gz	YJWDWNIGUDSTJN-MRXNPFEDSA-N	0	3	332.407	3.474	20	30		EGEDHN
CC#CCCNC(=O)NC[C@@H](c1ccc(Cl)cc1)N(C)CCC	ZINC000502116316	458637602	/nfs/dbraw/zinc/63/76/02/458637602.db2.gz	SWQDCBZNKBQLRE-KRWDZBQOSA-N	0	3	335.879	3.436	20	30		EGEDHN
CC(C)(CO)[C@H](NCC#Cc1ccc(C(F)(F)F)cc1)C1CC1	ZINC000567412769	459101481	/nfs/dbraw/zinc/10/14/81/459101481.db2.gz	LRDIXWXNOLMAJA-MRXNPFEDSA-N	0	3	325.374	3.444	20	30		EGEDHN
C=CCc1cc(CN2CCC[C@@H](C3(C)OCCO3)C2)cc(OC)c1O	ZINC000183237146	455257312	/nfs/dbraw/zinc/25/73/12/455257312.db2.gz	QGOGDWVHVJEABS-QGZVFWFLSA-N	0	3	347.455	3.104	20	30		EGEDHN
CN(CCOc1ccccc1)Cc1cn(C)nc1-c1ccc(C#N)cc1	ZINC000183244592	455259054	/nfs/dbraw/zinc/25/90/54/455259054.db2.gz	QMCLFAWXJIWEIQ-UHFFFAOYSA-N	0	3	346.434	3.470	20	30		EGEDHN
Cc1cnn(CCCCCN2CCN(c3ccccc3C#N)CC2)c1	ZINC000264744447	455274128	/nfs/dbraw/zinc/27/41/28/455274128.db2.gz	UUZFXOFXQBBFDI-UHFFFAOYSA-N	0	3	337.471	3.056	20	30		EGEDHN
Cc1ccc2c(c1)[C@H](N[C@@H]1CCN(Cc3ccc(C#N)cc3)C1=O)CC2	ZINC000190633797	455357542	/nfs/dbraw/zinc/35/75/42/455357542.db2.gz	TUEWZKLQMYDEAC-NHCUHLMSSA-N	0	3	345.446	3.245	20	30		EGEDHN
C[C@@H](CNc1ccc(C#N)cc1[N+](=O)[O-])N1CCc2ccccc2C1	ZINC000026729889	453804807	/nfs/dbraw/zinc/80/48/07/453804807.db2.gz	HKVFQWMZVJIVJZ-AWEZNQCLSA-N	0	3	336.395	3.325	20	30		EGEDHN
CC[NH+](CC)[C@@H](C/N=C/c1c([O-])c(C)ncc1CO)c1ccsc1	ZINC000032070378	453863088	/nfs/dbraw/zinc/86/30/88/453863088.db2.gz	OIYWFXYHPDUGGO-IFQVXRHPSA-N	0	3	347.484	3.151	20	30		EGEDHN
CCN(CC)[C@@H](C/N=C/c1c(O)c(C)ncc1CO)c1ccsc1	ZINC000032070378	453863092	/nfs/dbraw/zinc/86/30/92/453863092.db2.gz	OIYWFXYHPDUGGO-IFQVXRHPSA-N	0	3	347.484	3.151	20	30		EGEDHN
CCN(Cc1ccc(CN(C)C)cc1)C(=O)Cc1ccc(C#N)cc1	ZINC000066725845	453866950	/nfs/dbraw/zinc/86/69/50/453866950.db2.gz	ALCAEJHKQWRNRQ-UHFFFAOYSA-N	0	3	335.451	3.211	20	30		EGEDHN
CN(C)[C@@H](CNc1ccc(C#N)cc1[N+](=O)[O-])c1cccc(F)c1	ZINC000032534029	453877926	/nfs/dbraw/zinc/87/79/26/453877926.db2.gz	PBPQLAOEJHUXIM-KRWDZBQOSA-N	0	3	328.347	3.320	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc3[nH]c(-c4ccco4)nc3c2)CC1	ZINC000066921084	453885958	/nfs/dbraw/zinc/88/59/58/453885958.db2.gz	FYEJVAFRANMMFX-UHFFFAOYSA-N	0	3	348.406	3.107	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc3nc(-c4ccco4)[nH]c3c2)CC1	ZINC000066921084	453885961	/nfs/dbraw/zinc/88/59/61/453885961.db2.gz	FYEJVAFRANMMFX-UHFFFAOYSA-N	0	3	348.406	3.107	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H](c2ccc(F)cc2)C(C)(C)C)CC1	ZINC000067166542	453908668	/nfs/dbraw/zinc/90/86/68/453908668.db2.gz	QEFCQLNSSIGGCP-SFHVURJKSA-N	0	3	330.447	3.374	20	30		EGEDHN
C[C@H]1CN(C)c2ccccc2CN1CCC(=O)Nc1ccccc1C#N	ZINC000083248283	453946474	/nfs/dbraw/zinc/94/64/74/453946474.db2.gz	IUXWJDCTDADAFU-INIZCTEOSA-N	0	3	348.450	3.227	20	30		EGEDHN
Cc1cccc([C@H]2CCCN2C[C@H](O)COc2ccc(C#N)cc2)c1	ZINC000055157057	453966638	/nfs/dbraw/zinc/96/66/38/453966638.db2.gz	JMIPHTZZUUBNHQ-PZJWPPBQSA-N	0	3	336.435	3.444	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)Nc1ccc(N(C)C2CCN(C)CC2)cc1	ZINC000069357298	454098270	/nfs/dbraw/zinc/09/82/70/454098270.db2.gz	NGNRGIVPAHXJQG-INIZCTEOSA-N	0	3	345.487	3.137	20	30		EGEDHN
C[C@@H](N[C@H]1CCCN(Cc2ccccc2)C1=O)c1ccc(C#N)cc1	ZINC000089596481	454165703	/nfs/dbraw/zinc/16/57/03/454165703.db2.gz	CKAFSZYLXNKQEB-UZLBHIALSA-N	0	3	333.435	3.400	20	30		EGEDHN
N#Cc1cc(C(F)(F)F)ccc1NC1CCN([C@@H]2CCOC2)CC1	ZINC000089603169	454167053	/nfs/dbraw/zinc/16/70/53/454167053.db2.gz	QGKJSRBIJBAPGL-OAHLLOKOSA-N	0	3	339.361	3.242	20	30		EGEDHN
N#Cc1cc(Cl)ccc1NC[C@H]1C[C@H](O)CN1Cc1ccccc1	ZINC000089644772	454173429	/nfs/dbraw/zinc/17/34/29/454173429.db2.gz	NHPLTOXVPAERCB-MSOLQXFVSA-N	0	3	341.842	3.259	20	30		EGEDHN
N#Cc1cc([N+](=O)[O-])cnc1NC[C@H](c1cccs1)N1CCCC1	ZINC000070791328	454176241	/nfs/dbraw/zinc/17/62/41/454176241.db2.gz	IUZWYCOMQFTFLJ-CQSZACIVSA-N	0	3	343.412	3.172	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)[C@@H]2C[C@H](OCC)C23CCC3)CC1	ZINC000119568045	454204606	/nfs/dbraw/zinc/20/46/06/454204606.db2.gz	HUQARQCGKAWJMW-MSOLQXFVSA-N	0	3	349.519	3.016	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)NCc1ccc(C#N)cc1)C(C)C	ZINC000046042609	454210534	/nfs/dbraw/zinc/21/05/34/454210534.db2.gz	IJDNGFZRNPXSNF-LJQANCHMSA-N	0	3	340.471	3.056	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H]2CCCC[C@H]2SCC)CC1	ZINC000078331643	454232988	/nfs/dbraw/zinc/23/29/88/454232988.db2.gz	ADOFBHZNTHCHMT-JKSUJKDBSA-N	0	3	325.522	3.000	20	30		EGEDHN
CN(Cc1ccccc1)[C@H]1CCN(c2snc(Cl)c2C#N)C1	ZINC000078506337	454266698	/nfs/dbraw/zinc/26/66/98/454266698.db2.gz	RTGZSHZHDZZNND-ZDUSSCGKSA-N	0	3	332.860	3.379	20	30		EGEDHN
C[C@@H](C(=O)Nc1ccc(C#N)c(Cl)c1)N(C)CCC1CCOCC1	ZINC000120401218	454297698	/nfs/dbraw/zinc/29/76/98/454297698.db2.gz	DWMOFGCQFVABPD-ZDUSSCGKSA-N	0	3	349.862	3.287	20	30		EGEDHN
C=CCN(CCc1ccccc1)C(=O)NC1CCN(C2CC2)CC1	ZINC000062477306	454377429	/nfs/dbraw/zinc/37/74/29/454377429.db2.gz	XJRDFSYVMZKJPG-UHFFFAOYSA-N	0	3	327.472	3.054	20	30		EGEDHN
C#CCN(C(=O)NCc1cccc(CN(C)C)c1)C1CCCCC1	ZINC000062486970	454377597	/nfs/dbraw/zinc/37/75/97/454377597.db2.gz	QAPAVSNROLODTQ-UHFFFAOYSA-N	0	3	327.472	3.226	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)C(=O)N[C@@H](C)CN1CCCCC1	ZINC000079610684	454449969	/nfs/dbraw/zinc/44/99/69/454449969.db2.gz	DQMARECCEQBZBJ-KRWDZBQOSA-N	0	3	345.487	3.267	20	30		EGEDHN
C[C@@H](CNC(=O)N[C@@H](CCC#N)c1ccccc1)N1CCC(C)CC1	ZINC000133882403	454478664	/nfs/dbraw/zinc/47/86/64/454478664.db2.gz	NWXLYURQQGCRDC-HKUYNNGSSA-N	0	3	342.487	3.451	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)NCCCCC#N)CCN1Cc1ccccc1	ZINC000080115884	454536301	/nfs/dbraw/zinc/53/63/01/454536301.db2.gz	XQPSVMIZNWRMRY-WMZOPIPTSA-N	0	3	328.460	3.033	20	30		EGEDHN
CN(CCN1CCCC1)C(=O)c1ccccc1-c1ccccc1C#N	ZINC000103119206	454538528	/nfs/dbraw/zinc/53/85/28/454538528.db2.gz	OVNCPGVDSAXOIC-UHFFFAOYSA-N	0	3	333.435	3.393	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cc2c(s1)CCOC2)C(C)C	ZINC000103205748	454542346	/nfs/dbraw/zinc/54/23/46/454542346.db2.gz	OZTUCXHOZXOWSV-INIZCTEOSA-N	0	3	348.512	3.249	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cc(Br)ccc2C)CC1	ZINC000049376871	454546029	/nfs/dbraw/zinc/54/60/29/454546029.db2.gz	HDGQRXPEIAQURJ-UHFFFAOYSA-N	0	3	335.245	3.041	20	30		EGEDHN
Cc1ccc(C(=O)C(C#N)c2nnc3n2CCCCC3)cc1Cl	ZINC000103330818	454550609	/nfs/dbraw/zinc/55/06/09/454550609.db2.gz	HEEPYHYEAGFYKY-CYBMUJFWSA-N	0	3	328.803	3.456	20	30		EGEDHN
C=CCOCCCC(=O)NC1CCN([C@@H](C)c2ccccc2)CC1	ZINC000080326913	454567419	/nfs/dbraw/zinc/56/74/19/454567419.db2.gz	MKJYPPQJFNLUIV-KRWDZBQOSA-N	0	3	330.472	3.311	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)C2(C#N)CCCCC2)CN1Cc1ccccc1	ZINC000134924407	454609745	/nfs/dbraw/zinc/60/97/45/454609745.db2.gz	VKKPRUKWGOQETM-WMZOPIPTSA-N	0	3	325.456	3.240	20	30		EGEDHN
COc1cccc([C@@H](CNc2snc(Cl)c2C#N)N(C)C)c1	ZINC000051261749	454615577	/nfs/dbraw/zinc/61/55/77/454615577.db2.gz	FDBOOAZJKLSLMO-CYBMUJFWSA-N	0	3	336.848	3.392	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CCC[C@H](c2nnc3n2CCC3)C1	ZINC000135231777	454650034	/nfs/dbraw/zinc/65/00/34/454650034.db2.gz	LOGMEJORMZGTCH-KRWDZBQOSA-N	0	3	349.482	3.405	20	30		EGEDHN
N#CC1(NC(=O)CN2CCC[C@@H]2CCc2ccccc2)CCCCC1	ZINC000052105782	454655100	/nfs/dbraw/zinc/65/51/00/454655100.db2.gz	MPHIQOZQMCPFCQ-LJQANCHMSA-N	0	3	339.483	3.426	20	30		EGEDHN
C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCCCN1CCCSCC#N	ZINC000074989994	454671536	/nfs/dbraw/zinc/67/15/36/454671536.db2.gz	RMIJXGGILBYUDF-LSDHHAIUSA-N	0	3	341.521	3.401	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCCOc2ccc(F)cc2)CC1	ZINC000106037219	454674371	/nfs/dbraw/zinc/67/43/71/454674371.db2.gz	ITDBQAXCLCBTDI-UHFFFAOYSA-N	0	3	334.435	3.141	20	30		EGEDHN
C=CCNC(=O)[C@@H](C)N1CCC(c2c(C)[nH]c3ccccc32)CC1	ZINC000052464673	454675947	/nfs/dbraw/zinc/67/59/47/454675947.db2.gz	OSYRSQDHCUJHRQ-OAHLLOKOSA-N	0	3	325.456	3.346	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](CC)Cc2ccccc2)CC1	ZINC000106270589	454689543	/nfs/dbraw/zinc/68/95/43/454689543.db2.gz	MZDSMCCEUVFOFD-SFHVURJKSA-N	0	3	329.488	3.347	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(Cc2cccnc2)C(C)C)CC1	ZINC000106340796	454691923	/nfs/dbraw/zinc/69/19/23/454691923.db2.gz	KQYXNDOIPPRTJK-UHFFFAOYSA-N	0	3	330.476	3.042	20	30		EGEDHN
C=CCOc1ccc(CNC[C@](C)(O)c2ccsc2)cc1OC	ZINC000124085219	454698317	/nfs/dbraw/zinc/69/83/17/454698317.db2.gz	FXXPAEINTGDKNW-SFHVURJKSA-N	0	3	333.453	3.319	20	30		EGEDHN
CCN1CCC[C@H]1CN(C)C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000176293153	454723557	/nfs/dbraw/zinc/72/35/57/454723557.db2.gz	IZULUFYZNDPUEM-KRWDZBQOSA-N	0	3	328.460	3.436	20	30		EGEDHN
C=CCCOCCNC(=O)NC1CCN([C@@H](C)c2ccccc2)CC1	ZINC000124375441	454726165	/nfs/dbraw/zinc/72/61/65/454726165.db2.gz	XXOSNGFSIPMLPX-KRWDZBQOSA-N	0	3	345.487	3.104	20	30		EGEDHN
C#CCCOc1ccc(CN2CCC(N3CCCCC3=O)CC2)cc1	ZINC000093741673	454732064	/nfs/dbraw/zinc/73/20/64/454732064.db2.gz	YIDBUSZWKZKIKL-UHFFFAOYSA-N	0	3	340.467	3.066	20	30		EGEDHN
C=CCNc1ncc(C(=O)Nc2ccc(C)cc2CN(C)C)s1	ZINC000136279378	454733711	/nfs/dbraw/zinc/73/37/11/454733711.db2.gz	NULUVFHNVMUUDN-UHFFFAOYSA-N	0	3	330.457	3.363	20	30		EGEDHN
COc1ccc(CN(C)[C@@H](CO)C(C)(C)C)cc1OCCCC#N	ZINC000093837457	454738000	/nfs/dbraw/zinc/73/80/00/454738000.db2.gz	VPMVIDSWNFMPJK-SFHVURJKSA-N	0	3	334.460	3.217	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2CCCC[C@H]2SCC)CC1	ZINC000176486151	454751158	/nfs/dbraw/zinc/75/11/58/454751158.db2.gz	LAJMKKXYGPQJLG-IAGOWNOFSA-N	0	3	339.549	3.390	20	30		EGEDHN
CCc1noc(C)c1CN1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC000162674733	454792935	/nfs/dbraw/zinc/79/29/35/454792935.db2.gz	LTVRUZZLPJYAIP-UHFFFAOYSA-N	0	3	338.455	3.125	20	30		EGEDHN
C=CC1CCN(C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)CC1	ZINC000110969599	454854739	/nfs/dbraw/zinc/85/47/39/454854739.db2.gz	JAGYGWRUYQTJIO-SFHVURJKSA-N	0	3	330.447	3.462	20	30		EGEDHN
N#Cc1ccccc1N1CCCN(C[C@H](O)CCc2ccccc2)CC1	ZINC000182238335	455468904	/nfs/dbraw/zinc/46/89/04/455468904.db2.gz	DFGRDWFAIKNUOW-OAQYLSRUSA-N	0	3	349.478	3.064	20	30		EGEDHN
N#CC1(c2ccccc2)CC(NCCC(=O)NC2CCCCC2)C1	ZINC000126105697	454871274	/nfs/dbraw/zinc/87/12/74/454871274.db2.gz	IRRNQWSHDUPQOO-UHFFFAOYSA-N	0	3	325.456	3.039	20	30		EGEDHN
C=CCN(Cc1cccc(C#N)c1)C(=O)NC[C@@H]1CCCCN1CC	ZINC000111882986	454877381	/nfs/dbraw/zinc/87/73/81/454877381.db2.gz	PEWPXVVDRWMYDK-IBGZPJMESA-N	0	3	340.471	3.130	20	30		EGEDHN
COc1ccc(C#N)cc1CN(CCCO)[C@@H]1CCc2ccccc21	ZINC000154609754	454912039	/nfs/dbraw/zinc/91/20/39/454912039.db2.gz	NDFZSQCUAVHONZ-HXUWFJFHSA-N	0	3	336.435	3.439	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@@H]1Nc1ccc([N+](=O)[O-])c(C#N)c1	ZINC000167522789	454921466	/nfs/dbraw/zinc/92/14/66/454921466.db2.gz	OKWOWJARLKPTIY-KSSFIOAISA-N	0	3	336.395	3.399	20	30		EGEDHN
CCC(CC)[C@H](O)CNCc1cn(CCC#N)nc1-c1ccccc1	ZINC000113341563	454923767	/nfs/dbraw/zinc/92/37/67/454923767.db2.gz	UHEHICRBIAFLIM-LJQANCHMSA-N	0	3	340.471	3.350	20	30		EGEDHN
C[C@H](N[C@H]1CCN(C(=O)C2CCCCC2)C1)c1ccc(C#N)cc1	ZINC000151058641	454931710	/nfs/dbraw/zinc/93/17/10/454931710.db2.gz	NKXSRGFJAVZTJX-KXBFYZLASA-N	0	3	325.456	3.390	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H](c2cccc(F)c2)C(C)(C)C)CC1	ZINC000178135435	454937524	/nfs/dbraw/zinc/93/75/24/454937524.db2.gz	LHLXETAWZFCVRP-SFHVURJKSA-N	0	3	330.447	3.374	20	30		EGEDHN
C=CCc1cc(CNC[C@@](C)(O)c2ccccc2)cc(OC)c1O	ZINC000114508664	454958692	/nfs/dbraw/zinc/95/86/92/454958692.db2.gz	IZLLCBANYBJGBM-HXUWFJFHSA-N	0	3	327.424	3.127	20	30		EGEDHN
C=CCN(CCc1ccccc1)C(=O)N[C@@H]1C[C@H](C)N(C2CC2)C1	ZINC000127619351	454982950	/nfs/dbraw/zinc/98/29/50/454982950.db2.gz	BUUFVPZWGZBHHT-FUHWJXTLSA-N	0	3	327.472	3.052	20	30		EGEDHN
N#CC1(c2ccccc2)CC(NCCc2nnc(-c3ccccc3)o2)C1	ZINC000128147162	455029419	/nfs/dbraw/zinc/02/94/19/455029419.db2.gz	BBOGAUYIRHTSDQ-UHFFFAOYSA-N	0	3	344.418	3.493	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H]2CCCc3ccc(C)cc32)CC1	ZINC000179340753	455034777	/nfs/dbraw/zinc/03/47/77/455034777.db2.gz	PILCEPFDSCFQEU-IBGZPJMESA-N	0	3	327.472	3.322	20	30		EGEDHN
CCN(Cc1ccc(C(=O)Nc2ccn(CCC#N)n2)cc1)C1CC1	ZINC000117710358	455091657	/nfs/dbraw/zinc/09/16/57/455091657.db2.gz	RSABMCNZXRYQHK-UHFFFAOYSA-N	0	3	337.427	3.033	20	30		EGEDHN
C=C(C)COc1cc(CN2CCC[C@@H]2CC(=O)OC)ccc1OC	ZINC000179897054	455095675	/nfs/dbraw/zinc/09/56/75/455095675.db2.gz	FUOGMRPASIDVSR-MRXNPFEDSA-N	0	3	333.428	3.178	20	30		EGEDHN
CN(C(=O)Cc1ccc(C#N)cc1)C1CCN(Cc2ccccc2)CC1	ZINC000172005939	455108311	/nfs/dbraw/zinc/10/83/11/455108311.db2.gz	PYSUQYXTYBQOFW-UHFFFAOYSA-N	0	3	347.462	3.224	20	30		EGEDHN
C=CCNC(=O)NC(=O)[C@H](C)N[C@H](c1ccc(Cl)cc1)[C@@H]1C[C@@H]1C	ZINC000180022125	455117698	/nfs/dbraw/zinc/11/76/98/455117698.db2.gz	MPWJGJPVMGWHDU-YXAMBPQSSA-N	0	3	349.862	3.027	20	30		EGEDHN
Cc1ccccc1[C@H](NCC(=O)N[C@](C)(C#N)C1CC1)C(C)(C)C	ZINC000180084530	455129759	/nfs/dbraw/zinc/12/97/59/455129759.db2.gz	ZPTCFQFTLRIMOM-AZUAARDMSA-N	0	3	327.472	3.480	20	30		EGEDHN
N#CCCN(Cc1ccccn1)C(=O)c1ccc(CN2CCCC2)cc1	ZINC000264159210	455193285	/nfs/dbraw/zinc/19/32/85/455193285.db2.gz	ICHXWMISQAWCAX-UHFFFAOYSA-N	0	3	348.450	3.233	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC=C(c3ccc(F)cc3)CC2)CC1	ZINC000264401338	455205547	/nfs/dbraw/zinc/20/55/47/455205547.db2.gz	ZTEIXQICDHLHKO-UHFFFAOYSA-N	0	3	343.446	3.275	20	30		EGEDHN
CC(C)(C)[C@H](NCC(=O)N[C@](C)(C#N)C1CC1)c1cccc(F)c1	ZINC000181057432	455281185	/nfs/dbraw/zinc/28/11/85/455281185.db2.gz	ANKJQJJBKWOBIA-IEBWSBKVSA-N	0	3	331.435	3.311	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN1CCC[C@@H](c2ccccc2)CC1	ZINC000245406272	455288106	/nfs/dbraw/zinc/28/81/06/455288106.db2.gz	WRLHZDCVZBDOFM-PKOBYXMFSA-N	0	3	327.472	3.264	20	30		EGEDHN
C[C@](C#N)(NC(=O)CN[C@@H](CC1CCC1)c1ccccc1)C1CC1	ZINC000181348500	455321845	/nfs/dbraw/zinc/32/18/45/455321845.db2.gz	BIKBEBHWFQHZES-AZUAARDMSA-N	0	3	325.456	3.316	20	30		EGEDHN
N#CCCn1ccc(NC(=O)c2ccc(CN3CCCCC3)cc2)n1	ZINC000265520685	455337460	/nfs/dbraw/zinc/33/74/60/455337460.db2.gz	CJVZZMGZDKPUIL-UHFFFAOYSA-N	0	3	337.427	3.035	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CN[C@H](Cc1ccccc1)C1CC1	ZINC000181545867	455353167	/nfs/dbraw/zinc/35/31/67/455353167.db2.gz	DCFYBINBKXPLAM-MRXNPFEDSA-N	0	3	325.437	3.169	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](NC3CC(c4ccccc4)C3)C2=O)cc1	ZINC000190619064	455354263	/nfs/dbraw/zinc/35/42/63/455354263.db2.gz	BZLCYRIRWVGNOM-CBNMVNINSA-N	0	3	345.446	3.195	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](CN(C)Cc2cccnc2)C1	ZINC000190645005	455358563	/nfs/dbraw/zinc/35/85/63/455358563.db2.gz	IJYNHFKUIWLGTC-SFHVURJKSA-N	0	3	327.472	3.130	20	30		EGEDHN
CCCC[C@H](NCCS(=O)(=O)c1ccc(C#N)cc1)C1CCC1	ZINC000184886250	455467105	/nfs/dbraw/zinc/46/71/05/455467105.db2.gz	CGLITQBXSSSRQZ-SFHVURJKSA-N	0	3	334.485	3.280	20	30		EGEDHN
C[C@@H](N[C@@H](Cc1ccccc1)c1cccs1)C(=O)N(C)CCC#N	ZINC000184988656	455482631	/nfs/dbraw/zinc/48/26/31/455482631.db2.gz	ZRADGRSVSZADEM-WBVHZDCISA-N	0	3	341.480	3.382	20	30		EGEDHN
CCCCNC(=O)[C@@H]1CC[C@@H](C)N(Cc2ccc(F)c(C#N)c2)C1	ZINC000161004171	455523288	/nfs/dbraw/zinc/52/32/88/455523288.db2.gz	ZNRCLZVYFJTLDK-GDBMZVCRSA-N	0	3	331.435	3.214	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H](CNC(=O)c1cc(C#N)cs1)C1CC1	ZINC000185341167	455543226	/nfs/dbraw/zinc/54/32/26/455543226.db2.gz	LURFHZLQEHIEPR-KRWDZBQOSA-N	0	3	339.464	3.260	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)N[C@H]1CCO[C@@H]1c1ccc(Cl)cc1	ZINC000192050942	455548112	/nfs/dbraw/zinc/54/81/12/455548112.db2.gz	QGZJWFAGESDVPQ-JCGIZDLHSA-N	0	3	348.874	3.349	20	30		EGEDHN
CCO[C@@H]1C[C@H](N[C@H](C)C(=O)Nc2ccccc2C#N)C1(CC)CC	ZINC000247092205	455558403	/nfs/dbraw/zinc/55/84/03/455558403.db2.gz	PWLRHSWCMFNHQE-FHLIZLRMSA-N	0	3	343.471	3.459	20	30		EGEDHN
N#Cc1cccc(OCCN[C@@H]2CCO[C@H]2c2ccc(F)c(F)c2)c1	ZINC000192138702	455563023	/nfs/dbraw/zinc/56/30/23/455563023.db2.gz	UWENXAAKNGUWCA-MOPGFXCFSA-N	0	3	344.361	3.335	20	30		EGEDHN
C[C@H](N[C@H]1CCC[C@H](C#N)C1)c1cc(F)ccc1N1CCN(C)CC1	ZINC000185821943	455628985	/nfs/dbraw/zinc/62/89/85/455628985.db2.gz	KKODVTATIYYGEC-BQFCYCMXSA-N	0	3	344.478	3.310	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N1CCC[C@@H](N(C)C)C1)c1ccc(F)c(F)c1	ZINC000185836838	455632464	/nfs/dbraw/zinc/63/24/64/455632464.db2.gz	YDAYZWCHJPLEEQ-PBHICJAKSA-N	0	3	337.414	3.318	20	30		EGEDHN
C#CCC(C)(C)C(=O)N(CC)C[C@@H]1CCN(Cc2ccccc2)C1	ZINC000185949255	455660050	/nfs/dbraw/zinc/66/00/50/455660050.db2.gz	ZJVZDLZYFDEYHP-LJQANCHMSA-N	0	3	326.484	3.407	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC2(Cc3ccccc3)CCCC2)CC1	ZINC000186016910	455675701	/nfs/dbraw/zinc/67/57/01/455675701.db2.gz	XLKKWDUQPPICPB-UHFFFAOYSA-N	0	3	341.499	3.492	20	30		EGEDHN
C[C@@H](NCc1ccc(OCC#N)cc1)[C@@H]1OCCc2sccc21	ZINC000292562151	455697818	/nfs/dbraw/zinc/69/78/18/455697818.db2.gz	ZIDYNVQASALXQR-ACJLOTCBSA-N	0	3	328.437	3.443	20	30		EGEDHN
C[C@@H](CN1CCCCCC1)NC(=O)c1cccc(SCC#N)c1	ZINC000186290519	455735871	/nfs/dbraw/zinc/73/58/71/455735871.db2.gz	PABSIQWWZQGCGF-HNNXBMFYSA-N	0	3	331.485	3.297	20	30		EGEDHN
CCO[C@@H]1C[C@@H](O)C12CCN(Cc1ccccc1C(C)(C)C#N)CC2	ZINC000268986688	455754253	/nfs/dbraw/zinc/75/42/53/455754253.db2.gz	QXWHWASUERVYCZ-RTBURBONSA-N	0	3	342.483	3.240	20	30		EGEDHN
Cn1cc(CN2CCC[C@H]2[C@@H]2CCCO2)c(-c2ccc(C#N)cc2)n1	ZINC000284990004	455773313	/nfs/dbraw/zinc/77/33/13/455773313.db2.gz	YJRJVWBJKQXBRO-OALUTQOASA-N	0	3	336.439	3.102	20	30		EGEDHN
COc1cc(NC2CCN([C@H]3CC[C@H](C#N)C3)CC2)cc(OC)c1	ZINC000293931275	455801634	/nfs/dbraw/zinc/80/16/34/455801634.db2.gz	YWJBTWSEQFAWRK-YOEHRIQHSA-N	0	3	329.444	3.272	20	30		EGEDHN
COc1cc(OC)cc([C@H](O)CN[C@H](C)c2ccc(C#N)c(F)c2)c1	ZINC000271969357	455807832	/nfs/dbraw/zinc/80/78/32/455807832.db2.gz	UBRTYDUVFNOPLX-CWTRNNRKSA-N	0	3	344.386	3.099	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C	ZINC000294428736	455815170	/nfs/dbraw/zinc/81/51/70/455815170.db2.gz	NQDXWCSXVJSPDJ-WMLDXEAASA-N	0	3	336.501	3.109	20	30		EGEDHN
N#C[C@@H]1CC[C@@H](N2CCC[C@H](CNC(=O)Nc3cccc(F)c3)C2)C1	ZINC000278618932	455842705	/nfs/dbraw/zinc/84/27/05/455842705.db2.gz	NFGOGDHIVBFLOW-IIDMSEBBSA-N	0	3	344.434	3.351	20	30		EGEDHN
C=CC1CCN(C(=O)NC[C@H]2CCN(Cc3ccccc3)C2)CC1	ZINC000194453703	455844235	/nfs/dbraw/zinc/84/42/35/455844235.db2.gz	NHNDLQQMKJBDLL-LJQANCHMSA-N	0	3	327.472	3.116	20	30		EGEDHN
CCC[C@@]1(NCC(=O)N(CCC#N)c2cc(C)cc(C)c2)CCOC1	ZINC000285493864	455857485	/nfs/dbraw/zinc/85/74/85/455857485.db2.gz	IWKACNAHBILKKZ-HXUWFJFHSA-N	0	3	343.471	3.099	20	30		EGEDHN
C#CCO[C@@H](C)c1nc(-c2cccc(CN3CCCCC3)c2)no1	ZINC000295906550	455862633	/nfs/dbraw/zinc/86/26/33/455862633.db2.gz	LWECJPUMHXFAJH-HNNXBMFYSA-N	0	3	325.412	3.433	20	30		EGEDHN
CCCCN(CCOC)Cc1cn(CCC#N)nc1-c1ccncc1	ZINC000279364355	455863056	/nfs/dbraw/zinc/86/30/56/455863056.db2.gz	HTHLCCYFGGAEBS-UHFFFAOYSA-N	0	3	341.459	3.107	20	30		EGEDHN
Cc1ccsc1CN[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000272165218	455864650	/nfs/dbraw/zinc/86/46/50/455864650.db2.gz	FERDBIJKTMNOJM-MRXNPFEDSA-N	0	3	325.437	3.213	20	30		EGEDHN
CSC[C@H]1CCCN1Cc1cn(CCC#N)nc1-c1ccncc1	ZINC000279439149	455865961	/nfs/dbraw/zinc/86/59/61/455865961.db2.gz	RHISVVQOUIRZIO-QGZVFWFLSA-N	0	3	341.484	3.186	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccc(C(C)(C)C#N)cc1)N1CCC(C)CC1	ZINC000279665112	455870479	/nfs/dbraw/zinc/87/04/79/455870479.db2.gz	MLCFKFBUBYDMSB-INIZCTEOSA-N	0	3	327.472	3.338	20	30		EGEDHN
Cc1nc2ccccc2n1C1CCN(Cc2cc(C#N)n(C)c2)CC1	ZINC000279832893	455874833	/nfs/dbraw/zinc/87/48/33/455874833.db2.gz	QKIRHJXEZSMKBI-UHFFFAOYSA-N	0	3	333.439	3.392	20	30		EGEDHN
C=CCC[C@H](C(=O)Nc1ccn(CCN(C)C)n1)c1ccccc1	ZINC000187290578	455892356	/nfs/dbraw/zinc/89/23/56/455892356.db2.gz	BELTZXBEOHHYHB-KRWDZBQOSA-N	0	3	326.444	3.133	20	30		EGEDHN
C#CCCCCN[C@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl	ZINC000280113530	455894937	/nfs/dbraw/zinc/89/49/37/455894937.db2.gz	NTSRDWSQUXTFRX-SNVBAGLBSA-N	0	3	349.283	3.095	20	30		EGEDHN
C=CCOc1cccc(CN2CCC[C@H](c3nc(N(C)C)no3)C2)c1	ZINC000194937494	455903322	/nfs/dbraw/zinc/90/33/22/455903322.db2.gz	OXWDMXNYAWVFNI-INIZCTEOSA-N	0	3	342.443	3.080	20	30		EGEDHN
C=CCN1CCC(NC(=O)/C=C/c2ccc(OCC)c(C)c2)CC1	ZINC000187629454	455932485	/nfs/dbraw/zinc/93/24/85/455932485.db2.gz	HYKCGOFVGRHGSE-VQHVLOKHSA-N	0	3	328.456	3.174	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(OC)cc2OCCCC)CC1	ZINC000187629420	455932749	/nfs/dbraw/zinc/93/27/49/455932749.db2.gz	VJKNVQZBKDGWCQ-UHFFFAOYSA-N	0	3	346.471	3.254	20	30		EGEDHN
CCN(C[C@H]1CCN(Cc2ccccc2)C1)C(=O)[C@](C)(C#N)CC	ZINC000285900085	455937657	/nfs/dbraw/zinc/93/76/57/455937657.db2.gz	BIDODMOCXIUOGH-ICSRJNTNSA-N	0	3	327.472	3.297	20	30		EGEDHN
Cc1cc(CN(C)C)cc(NC(=O)[C@@H](C)Oc2ccc(C#N)cc2)c1	ZINC000270404589	455947289	/nfs/dbraw/zinc/94/72/89/455947289.db2.gz	XPDFCKFFCUXMDZ-OAHLLOKOSA-N	0	3	337.423	3.334	20	30		EGEDHN
C#CCCN[C@H](CO)c1ccc(Br)cc1C(F)(F)F	ZINC000280696763	456032943	/nfs/dbraw/zinc/03/29/43/456032943.db2.gz	IBLJQVFUKKMJEO-GFCCVEGCSA-N	0	3	336.151	3.114	20	30		EGEDHN
C[C@@H](CN(C)C)NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1	ZINC000286982040	456058470	/nfs/dbraw/zinc/05/84/70/456058470.db2.gz	LMUOBCWMBJMYCQ-AWEZNQCLSA-N	0	3	338.411	3.422	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N[C@H]2CCCC2(C)C)cc1	ZINC000287382978	456068110	/nfs/dbraw/zinc/06/81/10/456068110.db2.gz	RRZRLMCTDNENFR-WFASDCNBSA-N	0	3	349.456	3.073	20	30		EGEDHN
C=CCC1(C(=O)NCc2ccccc2CN2CCC(O)CC2)CCC1	ZINC000188519463	456077731	/nfs/dbraw/zinc/07/77/31/456077731.db2.gz	ITFJNBJWFQLGEC-UHFFFAOYSA-N	0	3	342.483	3.006	20	30		EGEDHN
COCCOc1cc(C)ccc1CNC(=N)Nc1cc(F)ccc1F	ZINC000288634434	456102157	/nfs/dbraw/zinc/10/21/57/456102157.db2.gz	BPZBCPFYOBFGDO-UHFFFAOYSA-N	0	3	349.381	3.225	20	30		EGEDHN
Cn1cc(CN[C@H]2c3ccccc3CC[C@H]2n2ccnc2)cc1C#N	ZINC000289242721	456119378	/nfs/dbraw/zinc/11/93/78/456119378.db2.gz	AALVGQFUGSQLNZ-UXHICEINSA-N	0	3	331.423	3.112	20	30		EGEDHN
COC[C@]1(CN[C@H](C)c2cccc(C#N)c2)OCCc2ccccc21	ZINC000289765958	456140439	/nfs/dbraw/zinc/14/04/39/456140439.db2.gz	LWXSRKYTSLVHMN-IERDGZPVSA-N	0	3	336.435	3.323	20	30		EGEDHN
CCc1nnc(NC[C@H](c2cccc(F)c2)N(C)C)c(C#N)c1CC	ZINC000301634433	456168593	/nfs/dbraw/zinc/16/85/93/456168593.db2.gz	VTONUYJLQSCPEM-GOSISDBHSA-N	0	3	341.434	3.327	20	30		EGEDHN
C[C@H](N[C@@H]1[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]21)c1ccc(C#N)c(F)c1	ZINC000297323108	456185291	/nfs/dbraw/zinc/18/52/91/456185291.db2.gz	NNLXOIGGICWKBX-ZYIUAKIQSA-N	0	3	345.418	3.213	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C	ZINC000188992646	456192577	/nfs/dbraw/zinc/19/25/77/456192577.db2.gz	LMJQBRVKZSMPOC-GHTZIAJQSA-N	0	3	344.499	3.338	20	30		EGEDHN
CC(C)N1CCN(C2CCN(c3cccc(Cl)c3C#N)CC2)CC1	ZINC000297460736	456225792	/nfs/dbraw/zinc/22/57/92/456225792.db2.gz	KACLGKOVDRTCOB-UHFFFAOYSA-N	0	3	346.906	3.206	20	30		EGEDHN
COc1ccc([C@@H](OC)[C@@H](C)NCc2ccc(C#N)c(OC)c2)cc1	ZINC000281467650	456242068	/nfs/dbraw/zinc/24/20/68/456242068.db2.gz	BHJICEZOLVWNJW-VLIAUNLRSA-N	0	3	340.423	3.441	20	30		EGEDHN
CCC[C@]1(CO)CCN(Cc2ccc(OC)c(OCCCC#N)c2)C1	ZINC000290222461	456269584	/nfs/dbraw/zinc/26/95/84/456269584.db2.gz	RUCFXRFNSGDZMQ-FQEVSTJZSA-N	0	3	346.471	3.362	20	30		EGEDHN
COCCCOc1cccc(CNCc2ccc(C#N)c(OC)c2)c1	ZINC000281595033	456272865	/nfs/dbraw/zinc/27/28/65/456272865.db2.gz	FHKXUCLUKMTGIQ-UHFFFAOYSA-N	0	3	340.423	3.272	20	30		EGEDHN
N#Cc1c(NC(=O)c2ccc(CN3CCCC3)cc2)n[nH]c1C1CC1	ZINC000290270789	456277755	/nfs/dbraw/zinc/27/77/55/456277755.db2.gz	AEDKAZPVIWJNGX-UHFFFAOYSA-N	0	3	335.411	3.007	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000290286765	456280280	/nfs/dbraw/zinc/28/02/80/456280280.db2.gz	DQYHOBWWTKIZQR-AVRDEDQJSA-N	0	3	346.474	3.380	20	30		EGEDHN
N#Cc1c(NC(=O)[C@H]2CCCN(Cc3ccccc3)C2)n[nH]c1C1CC1	ZINC000290290431	456281460	/nfs/dbraw/zinc/28/14/60/456281460.db2.gz	BNFXPHAQCOHGRO-INIZCTEOSA-N	0	3	349.438	3.009	20	30		EGEDHN
C[C@H](CCc1ccc(I)cc1)NCCC#N	ZINC000336730344	456309048	/nfs/dbraw/zinc/30/90/48/456309048.db2.gz	DPDSZPQIWQFRPY-LLVKDONJSA-N	0	3	328.197	3.116	20	30		EGEDHN
CC(C)Oc1ccc([C@@H](CNC(=O)C2(C#N)CCCC2)N(C)C)cc1	ZINC000290389095	456313866	/nfs/dbraw/zinc/31/38/66/456313866.db2.gz	HYYROXVGQCOOID-GOSISDBHSA-N	0	3	343.471	3.277	20	30		EGEDHN
CC1CCC(N2CCN(c3ccc([N+](=O)[O-])c(C#N)c3)CC2)CC1	ZINC000302205109	456316335	/nfs/dbraw/zinc/31/63/35/456316335.db2.gz	VRBMAQBEGLIVKI-UHFFFAOYSA-N	0	3	328.416	3.167	20	30		EGEDHN
N#Cc1ccccc1COc1cccc(CN[C@H]2C=C[C@H](CO)C2)c1	ZINC000347777879	456362644	/nfs/dbraw/zinc/36/26/44/456362644.db2.gz	MTGMAWWBVIUHID-PXNSSMCTSA-N	0	3	334.419	3.164	20	30		EGEDHN
CN(CCCSCC#N)C[C@H](O)c1cccc(Br)c1	ZINC000298094594	456362857	/nfs/dbraw/zinc/36/28/57/456362857.db2.gz	IKQOPTPIVLARQH-AWEZNQCLSA-N	0	3	343.290	3.061	20	30		EGEDHN
C[S@@](=O)c1ccc(CNCCSCc2ccccc2C#N)cc1	ZINC000343035445	456365104	/nfs/dbraw/zinc/36/51/04/456365104.db2.gz	RZXGGYHLZVFJRB-HSZRJFAPSA-N	0	3	344.505	3.319	20	30		EGEDHN
CN(CCCC1(C#N)CCOCC1)C[C@@H]1OCCc2ccccc21	ZINC000281964185	456375655	/nfs/dbraw/zinc/37/56/55/456375655.db2.gz	KRTOFGPHFIBYIK-IBGZPJMESA-N	0	3	328.456	3.333	20	30		EGEDHN
CC(=O)c1ccc(C#N)c(NCc2ccccc2OCCN(C)C)c1	ZINC000290626847	456387336	/nfs/dbraw/zinc/38/73/36/456387336.db2.gz	MDAKZZKLDALCAI-UHFFFAOYSA-N	0	3	337.423	3.313	20	30		EGEDHN
CN(C)CCOc1ccccc1CNc1ccc(C#N)c([N+](=O)[O-])c1	ZINC000290657896	456398484	/nfs/dbraw/zinc/39/84/84/456398484.db2.gz	POTCGTSGNLUIAM-UHFFFAOYSA-N	0	3	340.383	3.019	20	30		EGEDHN
N#Cc1ccc(NC[C@H]2CN(Cc3ccccc3)CCCO2)c(F)c1	ZINC000302796146	456403841	/nfs/dbraw/zinc/40/38/41/456403841.db2.gz	PMXLCNIANMXCEW-SFHVURJKSA-N	0	3	339.414	3.400	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)C1(c2cccc(C#N)c2)CC1	ZINC000343246817	456480107	/nfs/dbraw/zinc/48/01/07/456480107.db2.gz	IROKDEZMMYBOFN-KRWDZBQOSA-N	0	3	347.462	3.227	20	30		EGEDHN
C[C@H](c1ccc(C#N)cc1)N(C)CCN1CCN(c2ccccc2)CC1	ZINC000303724026	456480824	/nfs/dbraw/zinc/48/08/24/456480824.db2.gz	BRFXSTDTXASSMC-LJQANCHMSA-N	0	3	348.494	3.373	20	30		EGEDHN
CCCN(CC(=O)NC1(C#N)CCCCC1)[C@H]1C[C@H](OCC)C1(C)C	ZINC000303928174	456495662	/nfs/dbraw/zinc/49/56/62/456495662.db2.gz	WUSDWSNJNBUDCJ-IRXDYDNUSA-N	0	3	349.519	3.245	20	30		EGEDHN
C[C@@H](CCC#N)[NH+]1CCC(C(=O)Nc2cc(Cl)ccc2[O-])CC1	ZINC000298723359	456525825	/nfs/dbraw/zinc/52/58/25/456525825.db2.gz	USZKRLUXCOKWOY-LBPRGKRZSA-N	0	3	335.835	3.388	20	30		EGEDHN
C=CCn1c(-c2ccc(C)o2)nnc1N1CCN(C2CCCC2)CC1	ZINC000337808284	456559819	/nfs/dbraw/zinc/55/98/19/456559819.db2.gz	JIWCEIZBYINDNV-UHFFFAOYSA-N	0	3	341.459	3.097	20	30		EGEDHN
C[C@@H](N[C@@H]1CCN(C(=O)Cc2ccccc2)C1)c1cccc(C#N)c1	ZINC000340622023	456577996	/nfs/dbraw/zinc/57/79/96/456577996.db2.gz	UAHIOBSXZNPMGP-OXQOHEQNSA-N	0	3	333.435	3.052	20	30		EGEDHN
CCc1ccc([C@H]2CCCN([C@H](C)C(=O)N(C)CCC#N)C2)cc1	ZINC000353257127	456592087	/nfs/dbraw/zinc/59/20/87/456592087.db2.gz	IEPLRSXUKSWBOF-APWZRJJASA-N	0	3	327.472	3.189	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN[C@@H]2CCCc3sccc32)cc1	ZINC000321185272	456636362	/nfs/dbraw/zinc/63/63/62/456636362.db2.gz	DANBVAUWHWIUCN-RHSMWYFYSA-N	0	3	328.437	3.027	20	30		EGEDHN
Cc1c(Cl)cnc(NCCN(C)Cc2ccc(F)cc2)c1C#N	ZINC000343509358	456668578	/nfs/dbraw/zinc/66/85/78/456668578.db2.gz	KIIGSAZCZOQTKT-UHFFFAOYSA-N	0	3	332.810	3.020	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CCC(NC(=O)NCC(C)(C)C#N)CC1	ZINC000353395161	456672180	/nfs/dbraw/zinc/67/21/80/456672180.db2.gz	NAIRVOJZLYWKCA-HNNXBMFYSA-N	0	3	328.460	3.061	20	30		EGEDHN
Cc1cc(NC(=O)CCCC#N)cc(N2CCN(C(C)C)CC2)c1	ZINC000291594830	456690570	/nfs/dbraw/zinc/69/05/70/456690570.db2.gz	BLCQQUBHADBYFE-UHFFFAOYSA-N	0	3	328.460	3.158	20	30		EGEDHN
N#CCc1ccc(CN2CCC(OC[C@@H]3CCCCO3)CC2)cc1	ZINC000343542008	456695068	/nfs/dbraw/zinc/69/50/68/456695068.db2.gz	TVGMJPXQHMVASI-FQEVSTJZSA-N	0	3	328.456	3.303	20	30		EGEDHN
C=CCC[C@H](NCCCN1C(=O)NC2(CCCC2)C1=O)c1ccco1	ZINC000353444956	456698995	/nfs/dbraw/zinc/69/89/95/456698995.db2.gz	HLVZNQDYPRRKRQ-HNNXBMFYSA-N	0	3	345.443	3.131	20	30		EGEDHN
N#CCCN(Cc1cccnc1)C(=O)c1cccc(CN2CCCC2)c1	ZINC000299537558	456722224	/nfs/dbraw/zinc/72/22/24/456722224.db2.gz	SURBQLHBYWNIFP-UHFFFAOYSA-N	0	3	348.450	3.233	20	30		EGEDHN
CN(C)C[C@@H](NC(=O)Nc1ccc(C#N)c(F)c1)c1ccc(F)cc1	ZINC000353524173	456735196	/nfs/dbraw/zinc/73/51/96/456735196.db2.gz	SKSMAYRFVXXZTG-QGZVFWFLSA-N	0	3	344.365	3.261	20	30		EGEDHN
C[C@H](N[C@@H]1[C@@H]2CCO[C@H]2C12CCC2)C(=O)NC1(C#N)CCCCC1	ZINC000328683574	456735319	/nfs/dbraw/zinc/73/53/19/456735319.db2.gz	PHRAQZONDYPQQY-CAOSSQGBSA-N	0	3	331.460	3.105	20	30		EGEDHN
C=CCSCCNC(=O)NC[C@@H](c1ccc(CC)cc1)N(C)C	ZINC000338273181	456743282	/nfs/dbraw/zinc/74/32/82/456743282.db2.gz	CBMDKFXHHXETSO-KRWDZBQOSA-N	0	3	335.517	3.070	20	30		EGEDHN
CC(C)(C)OC(=O)NCC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000299615341	456745754	/nfs/dbraw/zinc/74/57/54/456745754.db2.gz	KIYSKZQBEZHDSU-UHFFFAOYSA-N	0	3	329.444	3.295	20	30		EGEDHN
CN(C)[C@H](CNC(=O)C[C@H](CC#N)c1ccccc1)c1ccccc1	ZINC000353604394	456796055	/nfs/dbraw/zinc/79/60/55/456796055.db2.gz	OQXXKFCSAKIUHA-VQTJNVASSA-N	0	3	335.451	3.493	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN(C)C[C@H](C)CC)cc1	ZINC000341004801	456807596	/nfs/dbraw/zinc/80/75/96/456807596.db2.gz	BYXCIOBZHYNYSF-MRXNPFEDSA-N	0	3	331.460	3.310	20	30		EGEDHN
CC(C#N)C(=O)N1C[C@@H](c2cccc(C(F)(F)F)c2)OC[C@@H]1C	ZINC000341000801	456808075	/nfs/dbraw/zinc/80/80/75/456808075.db2.gz	JCGUUUDVANGALO-SUNKGSAMSA-N	0	3	326.318	3.153	20	30		EGEDHN
O=C(NCCOc1cncc(Cl)c1)[C@@H]1CCCN1C1CCCC1	ZINC000329035335	456820178	/nfs/dbraw/zinc/82/01/78/456820178.db2.gz	CCGBYMQKOOBLDI-INIZCTEOSA-N	0	3	337.851	3.477	20	30		EGEDHN
CC(C)[C@H]1N(C[C@@H](O)COc2ccc(CC#N)cc2)CC12CCC2	ZINC000292003241	456826427	/nfs/dbraw/zinc/82/64/27/456826427.db2.gz	XTJYICVRCNQNEV-IEBWSBKVSA-N	0	3	328.456	3.003	20	30		EGEDHN
CC(C)[C@H](C(=O)NCCC(=O)N1CCCCCC1)N1CCCCC1	ZINC000329083310	456831054	/nfs/dbraw/zinc/83/10/54/456831054.db2.gz	FEIVHNCXQCVAPU-GOSISDBHSA-N	0	3	337.508	3.246	20	30		EGEDHN
C[C@](C#N)(NC(=O)CN1CCC[C@H]1[C@H]1CCCC[C@]1(C)O)C1CC1	ZINC000329131669	456840664	/nfs/dbraw/zinc/84/06/64/456840664.db2.gz	OXIWXFNLSCRHKE-JFRXWTBNSA-N	0	3	333.476	3.041	20	30		EGEDHN
CC1(C)CC[C@H](NC(=O)NCC2CCN(c3ccncc3)CC2)C1	ZINC000329149103	456843575	/nfs/dbraw/zinc/84/35/75/456843575.db2.gz	QHKMVDUPYCISOK-INIZCTEOSA-N	0	3	330.476	3.380	20	30		EGEDHN
C=CC[C@H](CO)CNCc1cc(Cl)ccc1OC[C@@H]1CCCO1	ZINC000341326945	456848973	/nfs/dbraw/zinc/84/89/73/456848973.db2.gz	ZDCNSWCJQULGGF-YOEHRIQHSA-N	0	3	339.863	3.172	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1	ZINC000338758833	456856076	/nfs/dbraw/zinc/85/60/76/456856076.db2.gz	UKGDDLIQMXRDFY-MRXNPFEDSA-N	0	3	331.847	3.360	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1sc(CC)nc1C)C(C)C	ZINC000344790242	456859664	/nfs/dbraw/zinc/85/96/64/456859664.db2.gz	NYRCDMIGTLTGRV-HNNXBMFYSA-N	0	3	335.517	3.442	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)[C@@H]1CC12CCCC2	ZINC000353772696	456900735	/nfs/dbraw/zinc/90/07/35/456900735.db2.gz	WBUGNSBZXGLKDH-SFHVURJKSA-N	0	3	325.456	3.029	20	30		EGEDHN
N#Cc1ccc(C2=CCN(C[C@H](O)Cc3ccc(F)cc3)CC2)cc1	ZINC000339060189	456921885	/nfs/dbraw/zinc/92/18/85/456921885.db2.gz	FTIFSCPVTJTKBH-OAQYLSRUSA-N	0	3	336.410	3.390	20	30		EGEDHN
CN(C)[C@@H](CNC(=O)C[C@@H](CC#N)c1ccccc1)Cc1ccccc1	ZINC000353820336	456922646	/nfs/dbraw/zinc/92/26/46/456922646.db2.gz	YEOWPWUSTWWRNN-NHCUHLMSSA-N	0	3	349.478	3.363	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cc(F)cc2[nH]cnc21)C(C)C	ZINC000353827258	456925535	/nfs/dbraw/zinc/92/55/35/456925535.db2.gz	NSSCLEDTSFAZPV-QGZVFWFLSA-N	0	3	344.434	3.130	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cc(F)cc2nc[nH]c21)C(C)C	ZINC000353827258	456925537	/nfs/dbraw/zinc/92/55/37/456925537.db2.gz	NSSCLEDTSFAZPV-QGZVFWFLSA-N	0	3	344.434	3.130	20	30		EGEDHN
COc1ccc([C@H](CN2CCCC2)NC(=O)[C@@H]2C[C@@]23CCOC3)cc1	ZINC000329757687	456936533	/nfs/dbraw/zinc/93/65/33/456936533.db2.gz	ZMSMBODPDJSIHI-CMKODMSKSA-N	0	3	344.455	3.215	20	30		EGEDHN
COc1cc(CN2CCC(CCCn3ccnc3)CC2)ccc1C#N	ZINC000349416703	456965357	/nfs/dbraw/zinc/96/53/57/456965357.db2.gz	LBZBLWWLRFHQQM-UHFFFAOYSA-N	0	3	338.455	3.456	20	30		EGEDHN
C=CCOc1ccc(CN2CCC3(C[C@H]3C(=O)OC)CC2)cc1OC	ZINC000353924960	456967595	/nfs/dbraw/zinc/96/75/95/456967595.db2.gz	UPUJLDNKXHGQRR-INIZCTEOSA-N	0	3	345.439	3.035	20	30		EGEDHN
CC(C)N1CCN(c2cccc(NC(=O)c3csc(=O)[nH]3)c2)CC1	ZINC000329970203	456967991	/nfs/dbraw/zinc/96/79/91/456967991.db2.gz	XTVSSOLJBFVWEZ-UHFFFAOYSA-N	0	3	346.456	3.015	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)[C@@](C)(C#N)CC)c1cccc(OC)c1	ZINC000349520788	456980807	/nfs/dbraw/zinc/98/08/07/456980807.db2.gz	JEEYHNAPGHJNEX-PKOBYXMFSA-N	0	3	331.460	3.134	20	30		EGEDHN
C[C@@H]1CCCc2ccccc2[C@@H]1NC([O-])=[NH+][C@@H]1CCn2ccnc2C1	ZINC000330163082	456993639	/nfs/dbraw/zinc/99/36/39/456993639.db2.gz	ARMMPSFMCMKGCA-IDHHARJASA-N	0	3	338.455	3.415	20	30		EGEDHN
N#Cc1ccc(CN2CCN(Cc3cccc4cc[nH]c43)CC2)cc1	ZINC000349613931	456996193	/nfs/dbraw/zinc/99/61/93/456996193.db2.gz	NWLKHJVRBNCCOD-UHFFFAOYSA-N	0	3	330.435	3.357	20	30		EGEDHN
[O-]C(NC[C@H]1CCc2nccn2C1)=[NH+]C[C@@H]1CCCCC(F)(F)C1	ZINC000330202363	457001511	/nfs/dbraw/zinc/00/15/11/457001511.db2.gz	ZEUDLJSPFDOCLZ-ZIAGYGMSSA-N	0	3	340.418	3.165	20	30		EGEDHN
[O-]C(NC[C@@H]1CCCCC(F)(F)C1)=[NH+]C[C@H]1CCc2nccn2C1	ZINC000330202363	457001517	/nfs/dbraw/zinc/00/15/17/457001517.db2.gz	ZEUDLJSPFDOCLZ-ZIAGYGMSSA-N	0	3	340.418	3.165	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)c2ccc(C#N)c(C)n2)N2CCCC2)cc1	ZINC000346578152	457055418	/nfs/dbraw/zinc/05/54/18/457055418.db2.gz	WPHIGMZOZBZPKJ-FQEVSTJZSA-N	0	3	348.450	3.137	20	30		EGEDHN
O=C(N[C@H](CO)CN1CCCCC1)c1cc(Cl)cc(Cl)c1	ZINC000330610223	457061079	/nfs/dbraw/zinc/06/10/79/457061079.db2.gz	OUKSWWHGYQEJOR-AWEZNQCLSA-N	0	3	331.243	3.145	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCCN(Cc1ccccc1)Cc1ccccc1	ZINC000359766523	457128674	/nfs/dbraw/zinc/12/86/74/457128674.db2.gz	NUQLLBYVRFXUCT-SFHVURJKSA-N	0	3	335.451	3.355	20	30		EGEDHN
CC(C#N)C(=O)NCC1(c2ccc(Br)cc2Cl)CC1	ZINC000356712795	457129198	/nfs/dbraw/zinc/12/91/98/457129198.db2.gz	DKXOSOSYFDNUHI-SECBINFHSA-N	0	3	341.636	3.410	20	30		EGEDHN
C=CCOc1ccc(CNC[C@@](C)(CO)c2ccccc2)cc1OC	ZINC000342184569	457155398	/nfs/dbraw/zinc/15/53/98/457155398.db2.gz	CQBRTOQXTQSFOG-NRFANRHFSA-N	0	3	341.451	3.300	20	30		EGEDHN
Cc1ccc(C#N)c(NCCCN2CCN(C)C[C@H]2c2ccccc2)n1	ZINC000346855400	457185839	/nfs/dbraw/zinc/18/58/39/457185839.db2.gz	UMXWXAIYRRHFCN-FQEVSTJZSA-N	0	3	349.482	3.052	20	30		EGEDHN
C=CCOc1ccc(C(=O)NCCN2CCCC[C@@H]2CC)cc1OC	ZINC000354373424	457186872	/nfs/dbraw/zinc/18/68/72/457186872.db2.gz	SPJAEXKGMDABHX-KRWDZBQOSA-N	0	3	346.471	3.254	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N(C)[C@@H]2CC[C@@H](C)C2)cc1	ZINC000350948418	457212786	/nfs/dbraw/zinc/21/27/86/457212786.db2.gz	ICYRSDQYZMAOMH-VNHYZAJKSA-N	0	3	349.456	3.025	20	30		EGEDHN
CCCN(CC(=O)N(CC)CCC#N)[C@H]1C[C@@H](OCC)C12CCCC2	ZINC000354468202	457243509	/nfs/dbraw/zinc/24/35/09/457243509.db2.gz	WDNJYJCFRQUTMQ-ZWKOTPCHSA-N	0	3	349.519	3.198	20	30		EGEDHN
COc1ccc2cc(CN(C)CCC(=O)N(C)CCC#N)ccc2c1	ZINC000356958212	457243655	/nfs/dbraw/zinc/24/36/55/457243655.db2.gz	UQIHDDQHFQOVHE-UHFFFAOYSA-N	0	3	339.439	3.042	20	30		EGEDHN
Cc1cc(CN(C)C)cc(NC(=O)Cc2c(F)cccc2C#N)c1	ZINC000354519410	457268384	/nfs/dbraw/zinc/26/83/84/457268384.db2.gz	AHVWOIFGSSLSDX-UHFFFAOYSA-N	0	3	325.387	3.249	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)N1CCC[C@@H](N(C)C)C1	ZINC000339799371	457275837	/nfs/dbraw/zinc/27/58/37/457275837.db2.gz	XIFXGUOVZINHNB-CQSZACIVSA-N	0	3	327.453	3.248	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CC[C@H](c3cccc(F)c3)C2)CC1	ZINC000363393575	457309162	/nfs/dbraw/zinc/30/91/62/457309162.db2.gz	SNEJJJQTNBJRTF-KRWDZBQOSA-N	0	3	345.462	3.365	20	30		EGEDHN
CN(CCNC(=O)C[C@H](CC#N)c1ccccc1)Cc1ccccc1	ZINC000355048028	457338814	/nfs/dbraw/zinc/33/88/14/457338814.db2.gz	ZVZJXVVIJQYVIZ-FQEVSTJZSA-N	0	3	335.451	3.322	20	30		EGEDHN
C=CCSCCNC(=O)N[C@H](C)[C@H](c1ccccc1C)N(C)C	ZINC000352254166	457352106	/nfs/dbraw/zinc/35/21/06/457352106.db2.gz	YWWGDKFYYYSQBV-NVXWUHKLSA-N	0	3	335.517	3.205	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)N[C@@H](C)CN1CCC[C@H](C)C1	ZINC000352442238	457370633	/nfs/dbraw/zinc/37/06/33/457370633.db2.gz	MRDUXIJNOBXOCD-GJZGRUSLSA-N	0	3	344.459	3.199	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cn2cc(C)nc2s1)C(C)C	ZINC000355404962	457370684	/nfs/dbraw/zinc/37/06/84/457370684.db2.gz	XCQLVIIHSDTJCT-OAHLLOKOSA-N	0	3	346.500	3.133	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1)OCC	ZINC000425002668	457401516	/nfs/dbraw/zinc/40/15/16/457401516.db2.gz	GSTTXPOUESGFQJ-ZCNNSNEGSA-N	0	3	342.483	3.091	20	30		EGEDHN
COc1ccc(CN2CC3(CCC3)[C@@H]2C2CCOCC2)cc1C#N	ZINC000425374161	457526927	/nfs/dbraw/zinc/52/69/27/457526927.db2.gz	RGROTCGKQMQPNK-IBGZPJMESA-N	0	3	326.440	3.348	20	30		EGEDHN
CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)N[C@@H]1CC[C@H](C#N)C1	ZINC000425500225	457579229	/nfs/dbraw/zinc/57/92/29/457579229.db2.gz	LJKSDJRAKWPBGL-IPMKNSEASA-N	0	3	342.487	3.134	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N(C)C[C@@H](O)COCc1cccs1	ZINC000425538146	457589542	/nfs/dbraw/zinc/58/95/42/457589542.db2.gz	ROXJPMQFTJLTEL-WMLDXEAASA-N	0	3	330.453	3.190	20	30		EGEDHN
CN1C[C@H](NC(=O)c2ccc(C3(C#N)CC3)cc2)[C@H](c2ccccc2)C1	ZINC000370344612	457625139	/nfs/dbraw/zinc/62/51/39/457625139.db2.gz	YTSYVTRXZAKMRG-PMACEKPBSA-N	0	3	345.446	3.069	20	30		EGEDHN
C[C@@H](NC(C)(C)CNC(=O)N[C@@H]1CC[C@H](C#N)C1)c1ccccc1	ZINC000425680348	457628816	/nfs/dbraw/zinc/62/88/16/457628816.db2.gz	ZBFMKOPAYZFJMB-HLLBOEOZSA-N	0	3	328.460	3.107	20	30		EGEDHN
C=CCNC(=O)c1ccc(N[C@@H](C)[C@H](c2ccccc2)N(C)C)nc1	ZINC000357663009	457645875	/nfs/dbraw/zinc/64/58/75/457645875.db2.gz	PVPQRKIHFLYLDC-HNAYVOBHSA-N	0	3	338.455	3.101	20	30		EGEDHN
Cc1cccc(C)c1NC(=O)CNC(=O)C(C#N)CCc1ccccc1	ZINC000433228464	457786030	/nfs/dbraw/zinc/78/60/30/457786030.db2.gz	WRBNYWLLKSIRGU-GOSISDBHSA-N	0	3	349.434	3.131	20	30		EGEDHN
CC1(C)CN(C(=O)C(C#N)CCc2ccccc2)[C@H]1[C@H]1CCCO1	ZINC000426238479	457793451	/nfs/dbraw/zinc/79/34/51/457793451.db2.gz	LNPUHXIYSQHRRY-KSZLIROESA-N	0	3	326.440	3.175	20	30		EGEDHN
CCCOc1ncccc1CNC(=O)C(C#N)CCc1ccccc1	ZINC000433311950	457807406	/nfs/dbraw/zinc/80/74/06/457807406.db2.gz	JOGZKABOOOSVGX-QGZVFWFLSA-N	0	3	337.423	3.259	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N[C@@H](CCCO)c1ccccc1	ZINC000433370120	457823727	/nfs/dbraw/zinc/82/37/27/457823727.db2.gz	CQNQSTZVMSJOIW-UXHICEINSA-N	0	3	336.435	3.389	20	30		EGEDHN
CCC1(CC)[C@H](NC(=O)C(C#N)CCc2ccccc2)C[C@H]1OC	ZINC000433381723	457826948	/nfs/dbraw/zinc/82/69/48/457826948.db2.gz	LHUFUNTZEOELNB-RCCFBDPRSA-N	0	3	328.456	3.469	20	30		EGEDHN
FC(F)(F)Oc1ccc(C#CCN2CC[C@@H]([C@H]3CCOC3)C2)cc1	ZINC000361750581	457832944	/nfs/dbraw/zinc/83/29/44/457832944.db2.gz	IYCOLNZQPRAREL-CVEARBPZSA-N	0	3	339.357	3.295	20	30		EGEDHN
CN(CCC1(C#N)CCCCC1)C[C@H](O)COCc1ccccc1	ZINC000411264742	457845091	/nfs/dbraw/zinc/84/50/91/457845091.db2.gz	MQAXKTXGSLEODN-IBGZPJMESA-N	0	3	330.472	3.360	20	30		EGEDHN
CC(C)(CC#N)CNC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000457987595	457892673	/nfs/dbraw/zinc/89/26/73/457892673.db2.gz	KHTADLQHIGTBCX-MRXNPFEDSA-N	0	3	331.435	3.094	20	30		EGEDHN
COc1cccc(C2(NCCC(=O)Nc3cccc(C#N)c3)CC2)c1	ZINC000411471857	457895517	/nfs/dbraw/zinc/89/55/17/457895517.db2.gz	LRJWSUXSIOMITL-UHFFFAOYSA-N	0	3	335.407	3.174	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cccc(F)c1C#N)C(C)C	ZINC000426816523	457908555	/nfs/dbraw/zinc/90/85/55/457908555.db2.gz	LDLKRXLWUXUARE-GOSISDBHSA-N	0	3	329.419	3.126	20	30		EGEDHN
CCOC(=O)[C@]1(COC)CCCN(CCC2(C#N)CCCCC2)C1	ZINC000411667245	457944450	/nfs/dbraw/zinc/94/44/50/457944450.db2.gz	BFBNARZTFWSMMU-LJQANCHMSA-N	0	3	336.476	3.142	20	30		EGEDHN
C=CC[C@H]1N(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CCCC1(C)C	ZINC000444778548	457975552	/nfs/dbraw/zinc/97/55/52/457975552.db2.gz	JDBYBXSDDLWAMV-MRXNPFEDSA-N	0	3	331.416	3.260	20	30		EGEDHN
N#Cc1cc(C(=O)N2CC[C@]3(C2)CCCN(Cc2ccccc2)C3)c[nH]1	ZINC000367768201	457980693	/nfs/dbraw/zinc/98/06/93/457980693.db2.gz	MOSKWKHMGJCGEU-OAQYLSRUSA-N	0	3	348.450	3.015	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@H]2CCN(C3CCCC3)C2)cc1OC	ZINC000371596930	458002226	/nfs/dbraw/zinc/00/22/26/458002226.db2.gz	LTBBVHHBUHKRTJ-INIZCTEOSA-N	0	3	344.455	3.007	20	30		EGEDHN
CC(C)(C(=O)N1CCC[C@H](N2CCCC2)C1)c1cc(F)cc(C#N)c1	ZINC000375666078	458010633	/nfs/dbraw/zinc/01/06/33/458010633.db2.gz	PGYFWHAHWXELBY-SFHVURJKSA-N	0	3	343.446	3.062	20	30		EGEDHN
C=CCOc1cccc(CN2CCC(OC[C@H]3CCOC3)CC2)c1	ZINC000371802190	458081351	/nfs/dbraw/zinc/08/13/51/458081351.db2.gz	JVXSOKMGDJCFAC-SFHVURJKSA-N	0	3	331.456	3.269	20	30		EGEDHN
C[C@H](CNC(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1)N(C)Cc1ccccc1	ZINC000412102368	458093007	/nfs/dbraw/zinc/09/30/07/458093007.db2.gz	WTMFFLGPEAULFF-TYCQWZJGSA-N	0	3	347.462	3.298	20	30		EGEDHN
C=CC[C@@H](C)NC(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000358629256	458117759	/nfs/dbraw/zinc/11/77/59/458117759.db2.gz	TUSWVINDIQTRCP-CRAIPNDOSA-N	0	3	333.476	3.340	20	30		EGEDHN
CC(C)c1nc(C2CCN(CCCC3(C#N)CCOCC3)CC2)no1	ZINC000369203038	458122610	/nfs/dbraw/zinc/12/26/10/458122610.db2.gz	JZVZHQRUGMYJPD-UHFFFAOYSA-N	0	3	346.475	3.473	20	30		EGEDHN
C[C@@H](NC(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1)[C@@H](c1ccccc1)N(C)C	ZINC000412249363	458143475	/nfs/dbraw/zinc/14/34/75/458143475.db2.gz	CDTPJYUZGNGWOX-QAJUQPOASA-N	0	3	347.462	3.469	20	30		EGEDHN
CN(CCC#N)c1ccc(CNC[C@H]2OCCc3ccccc32)cc1	ZINC000369291793	458160491	/nfs/dbraw/zinc/16/04/91/458160491.db2.gz	CEMGNKOLBAZSHD-OAQYLSRUSA-N	0	3	335.451	3.440	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1CNc1cc(C)nc2ccc([N+](=O)[O-])cc21	ZINC000435596046	458169220	/nfs/dbraw/zinc/16/92/20/458169220.db2.gz	GBRMUEWQOJHBST-UGSOOPFHSA-N	0	3	327.384	3.266	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1CNCc1ccc(OC)c(OC)c1Cl	ZINC000435733165	458192651	/nfs/dbraw/zinc/19/26/51/458192651.db2.gz	BAARDIJFNNKJTQ-XJKSGUPXSA-N	0	3	325.836	3.428	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1CNCc1c(C)nn(CC(C)C)c1OCC	ZINC000435751263	458196259	/nfs/dbraw/zinc/19/62/59/458196259.db2.gz	QNKRLDOOSQDJQI-AEFFLSMTSA-N	0	3	335.492	3.317	20	30		EGEDHN
C=C(CN[C@@H](C)c1cc(S(N)(=O)=O)c(C)cc1C)c1ccccc1	ZINC000358759055	458198840	/nfs/dbraw/zinc/19/88/40/458198840.db2.gz	SVMRFMKVBWDDMX-INIZCTEOSA-N	0	3	344.480	3.315	20	30		EGEDHN
C[C@@H]1C[C@@H]1N1CCN(c2cc(C(F)(F)F)cnc2C#N)C[C@@H](C)C1	ZINC000413294699	458297032	/nfs/dbraw/zinc/29/70/32/458297032.db2.gz	BOZNDMNJVPXWCC-ZOWXZIJZSA-N	0	3	338.377	3.139	20	30		EGEDHN
CN(C)CCOc1ccc(NC(=O)[C@@]2(C#N)CC23CCCC3)c(F)c1	ZINC000413922851	458312197	/nfs/dbraw/zinc/31/21/97/458312197.db2.gz	ZXAMEDDUCZMNGV-IBGZPJMESA-N	0	3	345.418	3.179	20	30		EGEDHN
C=CCN(C)CCN(CC)Cc1nnc(-c2ccccc2Cl)o1	ZINC000429721022	458362702	/nfs/dbraw/zinc/36/27/02/458362702.db2.gz	WUFQKEGKZJNWMM-UHFFFAOYSA-N	0	3	334.851	3.330	20	30		EGEDHN
C=CCN(C)CCN(CC)[C@@H](C)C(=O)Nc1cccc(Cl)c1C	ZINC000429717956	458362916	/nfs/dbraw/zinc/36/29/16/458362916.db2.gz	DHVXEIFZNOAXRY-HNNXBMFYSA-N	0	3	337.895	3.415	20	30		EGEDHN
C=CCC(C)(C)CNC(=O)Nc1ccc(OCCN(C)C)c(OC)c1	ZINC000417689076	458367468	/nfs/dbraw/zinc/36/74/68/458367468.db2.gz	SWVSWPOSYSPWFN-UHFFFAOYSA-N	0	3	349.475	3.359	20	30		EGEDHN
C=CCN(Cc1ccccc1)C(=O)NC[C@@H]1NCCc2ccccc21	ZINC000418639775	458375933	/nfs/dbraw/zinc/37/59/33/458375933.db2.gz	QAVZRYVOQNOKDP-FQEVSTJZSA-N	0	3	335.451	3.271	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)N[C@H]1CCN2CCCC[C@H]12	ZINC000429871935	458378496	/nfs/dbraw/zinc/37/84/96/458378496.db2.gz	WKIYUYAAEBRVTC-JKSUJKDBSA-N	0	3	339.464	3.438	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)NC[C@H](c1cccs1)N1CCC(C)CC1	ZINC000448583146	458401943	/nfs/dbraw/zinc/40/19/43/458401943.db2.gz	RBMXAYHHVQMPQV-ZACQAIPSSA-N	0	3	348.512	3.228	20	30		EGEDHN
C=CCOc1ccc(CC(=O)NC[C@@H](c2ccccc2)N(C)C)cc1	ZINC000448576305	458402682	/nfs/dbraw/zinc/40/26/82/458402682.db2.gz	ZNXOHFLBSRIAHH-FQEVSTJZSA-N	0	3	338.451	3.213	20	30		EGEDHN
CC1(C)Cc2cc(CN3CC[C@@H](Oc4ccc(C#N)cn4)C3)ccc2O1	ZINC000430170655	458415489	/nfs/dbraw/zinc/41/54/89/458415489.db2.gz	QXNCZHYWYLGGAH-GOSISDBHSA-N	0	3	349.434	3.320	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)N(C)C[C@H]1CCCN1C	ZINC000421715822	458419613	/nfs/dbraw/zinc/41/96/13/458419613.db2.gz	ZBPVAFFDBZBNHV-CQSZACIVSA-N	0	3	327.453	3.248	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)s1)c1cccc(N2CCOCC2)c1	ZINC000421877457	458423075	/nfs/dbraw/zinc/42/30/75/458423075.db2.gz	KSEQVWORRZBBEK-AWEZNQCLSA-N	0	3	327.453	3.307	20	30		EGEDHN
CO[C@H]1CCN(Cc2cn(CCC#N)nc2-c2ccccc2)C[C@H]1C	ZINC000449502101	458425204	/nfs/dbraw/zinc/42/52/04/458425204.db2.gz	ONUPPWSRAMDMKA-APWZRJJASA-N	0	3	338.455	3.321	20	30		EGEDHN
C=CCOc1ccc(CN2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)cc1OC	ZINC000449555458	458427298	/nfs/dbraw/zinc/42/72/98/458427298.db2.gz	QHUYOXXGLYWERY-KZNAEPCWSA-N	0	3	331.456	3.243	20	30		EGEDHN
COc1ccc(NC(=O)C[C@H](C)NCc2ccc(C#N)c(F)c2)cc1	ZINC000449735076	458429620	/nfs/dbraw/zinc/42/96/20/458429620.db2.gz	FZCFMQFQHCGQBK-ZDUSSCGKSA-N	0	3	341.386	3.213	20	30		EGEDHN
C=CCC[C@@H](CO)NCc1nc2cc(C(F)(F)F)ccc2n1C	ZINC000449696314	458429784	/nfs/dbraw/zinc/42/97/84/458429784.db2.gz	HQLOCDALOUIDQZ-LBPRGKRZSA-N	0	3	327.350	3.009	20	30		EGEDHN
C[C@H]1[C@@H](NC(=O)NCC(C)(C)CCC#N)CCN1Cc1ccccc1	ZINC000377040338	458447726	/nfs/dbraw/zinc/44/77/26/458447726.db2.gz	BUZFLQKXKHESDV-WMZOPIPTSA-N	0	3	342.487	3.279	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000373294941	458455340	/nfs/dbraw/zinc/45/53/40/458455340.db2.gz	TYSSPBPVNWYZCD-CYBMUJFWSA-N	0	3	325.372	3.061	20	30		EGEDHN
CN(CCN1CCC[C@]2(CCCCO2)[C@@H]1C#N)Cc1ccccc1	ZINC000450883147	458459248	/nfs/dbraw/zinc/45/92/48/458459248.db2.gz	PCPLCGVHJFWMNE-VQTJNVASSA-N	0	3	327.472	3.046	20	30		EGEDHN
CN(CCOc1cccc(C#N)c1)[C@H](CO)c1ccc(Cl)cc1	ZINC000451324661	458472883	/nfs/dbraw/zinc/47/28/83/458472883.db2.gz	LOYCXCXEGRVCFP-GOSISDBHSA-N	0	3	330.815	3.256	20	30		EGEDHN
CO[C@@H]1C[C@H](N[C@H](C)C(=O)Nc2ccc(C#N)c(Cl)c2)C12CCC2	ZINC000459766875	458473478	/nfs/dbraw/zinc/47/34/78/458473478.db2.gz	PYIXMRVJKWNFMA-XFBWCDHKSA-N	0	3	347.846	3.086	20	30		EGEDHN
CC[C@@H]1OCC[C@H]1NCC(=O)Nc1ccccc1SC[C@@H](C)C#N	ZINC000459776932	458476513	/nfs/dbraw/zinc/47/65/13/458476513.db2.gz	NJPBSMFAOJDBLJ-LZWOXQAQSA-N	0	3	347.484	3.034	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2ccc(C#N)s2)CCN1Cc1ccccc1	ZINC000430662524	458476822	/nfs/dbraw/zinc/47/68/22/458476822.db2.gz	JRDJHUYAWOUEDV-GDBMZVCRSA-N	0	3	339.464	3.403	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC(=O)N(C)[C@H](C)c1ccc(Cl)cc1	ZINC000451675103	458485206	/nfs/dbraw/zinc/48/52/06/458485206.db2.gz	OSXHQACYAMSPMO-XYPHTWIQSA-N	0	3	336.863	3.183	20	30		EGEDHN
CCO[C@@H]1CCCC[C@H]1N[C@@H](C)C(=O)N(C)C1(C#N)CCC(C)CC1	ZINC000452034706	458492561	/nfs/dbraw/zinc/49/25/61/458492561.db2.gz	LRUPVFQNMLAZLH-KZIZELGASA-N	0	3	349.519	3.243	20	30		EGEDHN
N#Cc1ccc(OCCN[C@H](c2cccs2)C2(CO)CCC2)cc1	ZINC000452061651	458493842	/nfs/dbraw/zinc/49/38/42/458493842.db2.gz	PVPLXWHIKQVHET-GOSISDBHSA-N	0	3	342.464	3.492	20	30		EGEDHN
C[C@H]1CN(C(=O)C[C@H](CC#N)c2ccccc2)CCN(C2CC2)C1	ZINC000452167199	458497043	/nfs/dbraw/zinc/49/70/43/458497043.db2.gz	BOSGLJRBWOMQPP-AEFFLSMTSA-N	0	3	325.456	3.017	20	30		EGEDHN
CC(C)[C@]1(CO)CCN(CC#Cc2ccc(OC(F)(F)F)cc2)C1	ZINC000377645666	458509005	/nfs/dbraw/zinc/50/90/05/458509005.db2.gz	CKXZEXPJXYFKRG-QGZVFWFLSA-N	0	3	341.373	3.277	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1N[C@H](C)c1ccc(OCCOC)c(OC)c1	ZINC000453329505	458525055	/nfs/dbraw/zinc/52/50/55/458525055.db2.gz	AKPPFYYGQZQMPQ-OIISXLGYSA-N	0	3	335.444	3.105	20	30		EGEDHN
C=C(CC)CN[C@@H](CN1CCC(C(N)=O)CC1)c1ccc(Cl)cc1	ZINC000453379448	458525790	/nfs/dbraw/zinc/52/57/90/458525790.db2.gz	WHDXJLVLXCXSPA-SFHVURJKSA-N	0	3	349.906	3.134	20	30		EGEDHN
C=C(C)Cn1c(-c2ccc(C)s2)nnc1N1CCCN(CC)CC1	ZINC000460804786	458535209	/nfs/dbraw/zinc/53/52/09/458535209.db2.gz	PABVYFJRCDAROW-UHFFFAOYSA-N	0	3	345.516	3.423	20	30		EGEDHN
COc1ccccc1Oc1ccc(NC(=O)[C@H](N)CCCC#N)cc1	ZINC000424067379	458548910	/nfs/dbraw/zinc/54/89/10/458548910.db2.gz	VSGUPWJJRWGCKD-MRXNPFEDSA-N	0	3	339.395	3.447	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N(Cc1cc(F)ccc1F)C1CCCC1	ZINC000424126174	458565512	/nfs/dbraw/zinc/56/55/12/458565512.db2.gz	SLXOUWOTJOQHFP-KRWDZBQOSA-N	0	3	335.398	3.257	20	30		EGEDHN
C[C@H](NCCNC(=O)CCCc1ccccc1)c1cccc(C#N)c1	ZINC000424134232	458567061	/nfs/dbraw/zinc/56/70/61/458567061.db2.gz	HPJWAZYFTOLIKX-KRWDZBQOSA-N	0	3	335.451	3.348	20	30		EGEDHN
Cc1csc(Nc2ccc(NC(=O)[C@@H](N)CCCC#N)cc2)n1	ZINC000424140245	458568911	/nfs/dbraw/zinc/56/89/11/458568911.db2.gz	NVVLQTIZCXPKBQ-AWEZNQCLSA-N	0	3	329.429	3.155	20	30		EGEDHN
Cc1cc(N2CCCC[C@H]2C)ccc1NC(=O)[C@@H](N)CCCC#N	ZINC000424150266	458571634	/nfs/dbraw/zinc/57/16/34/458571634.db2.gz	YNERAKUZTLWKFR-WBVHZDCISA-N	0	3	328.460	3.334	20	30		EGEDHN
C[C@H](CC#N)Sc1ccccc1NC(=O)CN[C@@]1(C)CCO[C@H]1C	ZINC000494214665	458642294	/nfs/dbraw/zinc/64/22/94/458642294.db2.gz	CBTWJENNVLYLGE-GLJUWKHASA-N	0	3	347.484	3.176	20	30		EGEDHN
CC1(CNC(=O)C(C#N)Cc2ccc(C#N)cc2)Cc2ccccc2C1	ZINC000471097442	458680002	/nfs/dbraw/zinc/68/00/02/458680002.db2.gz	DGOOQCNVONLMCZ-FQEVSTJZSA-N	0	3	343.430	3.162	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@H]2C3CCC(CC3)[C@@H]2C(F)(F)F)CC1	ZINC000424651165	458696268	/nfs/dbraw/zinc/69/62/68/458696268.db2.gz	OSHVFOSVQWLZKB-BGHVQYPCSA-N	0	3	344.421	3.368	20	30		EGEDHN
C=CC[C@H](CO)CNCc1cccc2c1N(C(=O)OC(C)(C)C)CC2	ZINC000494590908	458705450	/nfs/dbraw/zinc/70/54/50/458705450.db2.gz	SIXVBIGSHQQYDW-HNNXBMFYSA-N	0	3	346.471	3.258	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)NCc1ccccc1F)C(C)C	ZINC000503443732	458708700	/nfs/dbraw/zinc/70/87/00/458708700.db2.gz	YTCHFGAWDFMGHG-SFHVURJKSA-N	0	3	333.451	3.324	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N[C@H]1C[C@H](OC)C1(C)C	ZINC000439626758	458733727	/nfs/dbraw/zinc/73/37/27/458733727.db2.gz	YRQPRJIBWUMGRJ-BPUTZDHNSA-N	0	3	336.501	3.054	20	30		EGEDHN
C=CCn1c([C@@H](C)CC)nnc1N1CCN(C2CCCCC2)CC1	ZINC000508497195	458760237	/nfs/dbraw/zinc/76/02/37/458760237.db2.gz	JPPMSFPWJWCVCL-INIZCTEOSA-N	0	3	331.508	3.432	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccnc(N3CCC[C@@H](C)C3)c2)nc(C)n1	ZINC000517004088	458825480	/nfs/dbraw/zinc/82/54/80/458825480.db2.gz	JOFOFCPORRKAPX-CXAGYDPISA-N	0	3	349.438	3.215	20	30		EGEDHN
COc1cc(CNC[C@](C)(Cc2ccccc2)[C@@H](C)O)ccc1C#N	ZINC000440643028	458836515	/nfs/dbraw/zinc/83/65/15/458836515.db2.gz	ZEFCPNVYXJPMBU-IERDGZPVSA-N	0	3	338.451	3.286	20	30		EGEDHN
C=CC1CCN(C(=O)NC[C@@H](CC)N2CCc3ccccc3C2)CC1	ZINC000518441999	458867534	/nfs/dbraw/zinc/86/75/34/458867534.db2.gz	UKUWVDIIHVOKPK-HXUWFJFHSA-N	0	3	341.499	3.431	20	30		EGEDHN
N#CCC[C@H](C#N)CNc1cccc(N2CCN(CC3CC3)CC2)c1	ZINC000548788369	458874016	/nfs/dbraw/zinc/87/40/16/458874016.db2.gz	QISBZNDFEOLQSV-GOSISDBHSA-N	0	3	337.471	3.074	20	30		EGEDHN
C=C(C)Cn1c([C@@H](C)CC)nnc1N1CC[C@@H](N2CCCCC2)C1	ZINC000549693014	458883088	/nfs/dbraw/zinc/88/30/88/458883088.db2.gz	LQDACGJKWLFRSS-DLBZAZTESA-N	0	3	331.508	3.432	20	30		EGEDHN
C[C@@H]1CCC[C@H]1CNC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000466718796	458915648	/nfs/dbraw/zinc/91/56/48/458915648.db2.gz	JLUPMYQJCZEVCU-APWZRJJASA-N	0	3	342.487	3.068	20	30		EGEDHN
C[C@@H]1COCCN1C1CCN(Cc2ccccc2C(C)(C)C#N)CC1	ZINC000576898604	458942369	/nfs/dbraw/zinc/94/23/69/458942369.db2.gz	JSPKUGPCUBXNCC-QGZVFWFLSA-N	0	3	341.499	3.173	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)NCC(C)(C)CC#N)c1ccccc1	ZINC000457462444	458964821	/nfs/dbraw/zinc/96/48/21/458964821.db2.gz	TYDDMXWFHPVWGK-QGZVFWFLSA-N	0	3	330.476	3.309	20	30		EGEDHN
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NCc1ccc(C#N)c(C)c1	ZINC000556522405	458968929	/nfs/dbraw/zinc/96/89/29/458968929.db2.gz	GIEJKFOLACNSDF-JXFKEZNVSA-N	0	3	336.435	3.377	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)N[C@@H](C)CN1CCCCCC1	ZINC000476394759	458999902	/nfs/dbraw/zinc/99/99/02/458999902.db2.gz	VEJNSKSGEREWQP-INIZCTEOSA-N	0	3	346.471	3.254	20	30		EGEDHN
C[C@H](N[C@H](CN1CCN(C)CC1)c1ccccc1)c1ccc(C#N)cc1	ZINC000532022416	459019103	/nfs/dbraw/zinc/01/91/03/459019103.db2.gz	MGQSVUYAVAWZAD-PGRDOPGGSA-N	0	3	348.494	3.198	20	30		EGEDHN
N#Cc1ccc(OCCN2CC[C@]3(C2)CCc2ccccc2O3)cc1	ZINC000577563437	459050995	/nfs/dbraw/zinc/05/09/95/459050995.db2.gz	QSKPPKZZBBKACZ-NRFANRHFSA-N	0	3	334.419	3.407	20	30		EGEDHN
Cc1csc(NC(=O)NC[C@H](Cc2ccccc2)N(C)C)c1C#N	ZINC000520424059	459059036	/nfs/dbraw/zinc/05/90/36/459059036.db2.gz	XVHVUSKPLBKYPI-HNNXBMFYSA-N	0	3	342.468	3.223	20	30		EGEDHN
CC1CC(C#N)(C(=O)NCC2CCN(Cc3cccs3)CC2)C1	ZINC000532319221	459065999	/nfs/dbraw/zinc/06/59/99/459065999.db2.gz	XKZXESUBPZRDHB-UHFFFAOYSA-N	0	3	331.485	3.016	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1cccc(C#N)n1	ZINC000577630554	459066045	/nfs/dbraw/zinc/06/60/45/459066045.db2.gz	MVCHBRZMUDWZRI-MRXNPFEDSA-N	0	3	349.438	3.082	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCCc1nc2ccccc2o1	ZINC000520817220	459096838	/nfs/dbraw/zinc/09/68/38/459096838.db2.gz	SBJBIYLYHIMUQP-MRXNPFEDSA-N	0	3	333.391	3.259	20	30		EGEDHN
CCC(C)(C)N1CCN(c2nc(C(F)(F)F)ccc2C#N)CC1	ZINC000594593863	459101989	/nfs/dbraw/zinc/10/19/89/459101989.db2.gz	FLPNMLLBJMYDSC-UHFFFAOYSA-N	0	3	326.366	3.283	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)NCc1ccccc1Oc1cccc(F)c1	ZINC000567462998	459110758	/nfs/dbraw/zinc/11/07/58/459110758.db2.gz	YRLBYAUSRCBRKG-KRWDZBQOSA-N	0	3	341.386	3.255	20	30		EGEDHN
CCN1CC[C@@H](N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)C1=O	ZINC000594712156	459136427	/nfs/dbraw/zinc/13/64/27/459136427.db2.gz	ZMUVTFVDOKRCNR-FOIQADDNSA-N	0	3	333.435	3.497	20	30		EGEDHN
N#CCc1ccc(OC[C@H](O)CNCc2ccc3occc3c2)cc1	ZINC000594718998	459138608	/nfs/dbraw/zinc/13/86/08/459138608.db2.gz	YCUCUOIRSANHJV-GOSISDBHSA-N	0	3	336.391	3.028	20	30		EGEDHN
COc1ccc(N2C[C@@H](N[C@@H](C)c3ccc(C#N)cc3)CC2=O)cc1	ZINC000594722571	459140753	/nfs/dbraw/zinc/14/07/53/459140753.db2.gz	RVVGBTYHMZVIEV-YOEHRIQHSA-N	0	3	335.407	3.023	20	30		EGEDHN
N#Cc1ccc(NC(=O)CN2CCC[C@@H]2[C@@H]2CCCOC2)cc1Cl	ZINC000567790348	459169122	/nfs/dbraw/zinc/16/91/22/459169122.db2.gz	XWZHLFRMMWXRPD-RHSMWYFYSA-N	0	3	347.846	3.041	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@H]1CCC[C@@H](CNCc2ccc(C#N)o2)C1	ZINC000496388181	459175259	/nfs/dbraw/zinc/17/52/59/459175259.db2.gz	RMWMVMFLXCJPDJ-KGLIPLIRSA-N	0	3	333.432	3.324	20	30		EGEDHN
C[C@@](C#N)(NC(=O)[C@H]1CCN(Cc2ccccc2)C1)C1CCCCC1	ZINC000578336778	459185153	/nfs/dbraw/zinc/18/51/53/459185153.db2.gz	PJRITSSNSOTFPY-RXVVDRJESA-N	0	3	339.483	3.487	20	30		EGEDHN
COC[C@H](C)Oc1ccc(CNCc2ccc(C#N)c(F)c2)cc1	ZINC000594952256	459191293	/nfs/dbraw/zinc/19/12/93/459191293.db2.gz	FMRYRLUSVNQYCN-AWEZNQCLSA-N	0	3	328.387	3.401	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)N(CC)C[C@H]1CCCN1CC	ZINC000578390766	459194057	/nfs/dbraw/zinc/19/40/57/459194057.db2.gz	NYJLWKGOFXKPHW-MRXNPFEDSA-N	0	3	346.471	3.206	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN[C@H](C)[C@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000496444571	459195243	/nfs/dbraw/zinc/19/52/43/459195243.db2.gz	SCDHZZHSCVNXMG-KFWWJZLASA-N	0	3	347.459	3.369	20	30		EGEDHN
C[C@@H]1OCC[C@@]1(O)CN(Cc1cc(C#N)cs1)Cc1ccccc1	ZINC000578579521	459224192	/nfs/dbraw/zinc/22/41/92/459224192.db2.gz	ABOBFJFSBKOXTB-HNAYVOBHSA-N	0	3	342.464	3.162	20	30		EGEDHN
Cc1cc(Br)c(Cl)cc1NC(=O)[C@H](N)CCCC#N	ZINC000595254949	459263126	/nfs/dbraw/zinc/26/31/26/459263126.db2.gz	FXCQHOCCWGRMEI-LLVKDONJSA-N	0	3	344.640	3.371	20	30		EGEDHN
CN(Cc1ccc(OCC#N)cc1)C1CC(NC(=O)OC(C)(C)C)C1	ZINC000496681105	459284845	/nfs/dbraw/zinc/28/48/45/459284845.db2.gz	XOHCMWYUBVXBMJ-UHFFFAOYSA-N	0	3	345.443	3.076	20	30		EGEDHN
CN(CCC(=O)Nc1sccc1C#N)Cc1cc(C(C)(C)C)[nH]n1	ZINC000559974231	459288931	/nfs/dbraw/zinc/28/89/31/459288931.db2.gz	QQUVPHPKVKGYNX-UHFFFAOYSA-N	0	3	345.472	3.101	20	30		EGEDHN
C[C@H](CCC#N)N1CCC[C@@H](CNC(=O)OCc2ccccc2)C1	ZINC000496700135	459293282	/nfs/dbraw/zinc/29/32/82/459293282.db2.gz	JYANKIDXQCFVQY-AEFFLSMTSA-N	0	3	329.444	3.317	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCNC1(c2cccc(C#N)c2)CC1	ZINC000560174730	459309241	/nfs/dbraw/zinc/30/92/41/459309241.db2.gz	NRGYNVYUHYXPPW-UHFFFAOYSA-N	0	3	336.420	3.099	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)C(=O)NCc1ccc2c(c1)CNC2	ZINC000591360310	459361978	/nfs/dbraw/zinc/36/19/78/459361978.db2.gz	JIZNIBGQSLULPS-UHFFFAOYSA-N	0	3	348.450	3.283	20	30		EGEDHN
N#CC[C@H]1CCCN(C[C@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000595609125	459364429	/nfs/dbraw/zinc/36/44/29/459364429.db2.gz	GOAWNVIDBFRCPQ-OCCSQVGLSA-N	0	3	343.254	3.359	20	30		EGEDHN
C=CCN(C(=O)NCC(C)(C)N1CCc2ccccc2C1)C1CC1	ZINC000537908898	459367556	/nfs/dbraw/zinc/36/75/56/459367556.db2.gz	HIDLEIMRERGYGE-UHFFFAOYSA-N	0	3	327.472	3.183	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCCC[C@@H]1[C@H]1CCCC1=Nn1cnnc1	ZINC000496985174	459395724	/nfs/dbraw/zinc/39/57/24/459395724.db2.gz	LCANVMBOCBWNJP-DZGCQCFKSA-N	0	3	333.436	3.072	20	30		EGEDHN
C[C@H]1CN(c2ccccc2CN2CCC(CCC#N)CC2)CCO1	ZINC000569123221	459401537	/nfs/dbraw/zinc/40/15/37/459401537.db2.gz	KAAHCZQRBGPIOF-KRWDZBQOSA-N	0	3	327.472	3.427	20	30		EGEDHN
C[C@@H]1CC2(CN1CC1(C#N)CC1)CCN(C(=O)OC(C)(C)C)CC2	ZINC000497066663	459425233	/nfs/dbraw/zinc/42/52/33/459425233.db2.gz	UDHCVAXNXLZQSU-OAHLLOKOSA-N	0	3	333.476	3.402	20	30		EGEDHN
CC(C)(C)OC(=O)NCc1ccc(CN[C@H]2CC[C@@H](C#N)C2)cc1	ZINC000497137799	459455935	/nfs/dbraw/zinc/45/59/35/459455935.db2.gz	ZOBOUXLGNITMOI-SJORKVTESA-N	0	3	329.444	3.493	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)c2ccc(C#Cc3ccccc3)cc2)CCN1C	ZINC000525618159	459468457	/nfs/dbraw/zinc/46/84/57/459468457.db2.gz	LKKSKZNEQYUVMV-UWJYYQICSA-N	0	3	332.447	3.299	20	30		EGEDHN
CN(CCC(=O)Nc1sc2c(c1C#N)CCC2)CC1=CCSC1	ZINC000595889807	459476959	/nfs/dbraw/zinc/47/69/59/459476959.db2.gz	WXUBVZVBZFIBBY-UHFFFAOYSA-N	0	3	347.509	3.042	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CNCC1(C(F)(F)F)CC1	ZINC000583139774	459489433	/nfs/dbraw/zinc/48/94/33/459489433.db2.gz	BKAFCQNGTTZLHQ-AWEZNQCLSA-N	0	3	329.362	3.087	20	30		EGEDHN
CCC(CC)(CN[C@H](C)C(=O)N(C)CCC#N)c1ccc(F)cc1	ZINC000596052800	459502520	/nfs/dbraw/zinc/50/25/20/459502520.db2.gz	YZGKQFLINAFLBE-OAHLLOKOSA-N	0	3	333.451	3.234	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@H](N[C@H]3CCc4ccccc43)C2=O)cc1	ZINC000541881719	459504861	/nfs/dbraw/zinc/50/48/61/459504861.db2.gz	LYWFRIZKOYSQQN-PMACEKPBSA-N	0	3	331.419	3.331	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CCC(F)(F)[C@H](C)C1	ZINC000562046957	459506546	/nfs/dbraw/zinc/50/65/46/459506546.db2.gz	RRHWRGBVXJEECS-ZBFHGGJFSA-N	0	3	325.399	3.132	20	30		EGEDHN
CC[C@@H](C)N[C@H](CNC(=O)N1CCC(CCC#N)CC1)c1ccco1	ZINC000592022782	459512920	/nfs/dbraw/zinc/51/29/20/459512920.db2.gz	FWZPCNDYJGEMPO-NVXWUHKLSA-N	0	3	346.475	3.434	20	30		EGEDHN
N#CCC1CCN(C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)CC1	ZINC000541976768	459516616	/nfs/dbraw/zinc/51/66/16/459516616.db2.gz	YIXSUCOUFWSMFQ-GOSISDBHSA-N	0	3	343.446	3.190	20	30		EGEDHN
COc1cc(C#N)ccc1NC(=O)N1CCCN(C2CCCC2)CC1	ZINC000562290271	459530923	/nfs/dbraw/zinc/53/09/23/459530923.db2.gz	MUBVAAHWEQBMOW-UHFFFAOYSA-N	0	3	342.443	3.049	20	30		EGEDHN
CCc1nc(C#N)cc(N(C)[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)n1	ZINC000596132983	459531234	/nfs/dbraw/zinc/53/12/34/459531234.db2.gz	AALFPAUUGLWRKP-QFBILLFUSA-N	0	3	349.482	3.400	20	30		EGEDHN
CCN(CCc1cccs1)[C@@H](C)C(=O)NC1(C#N)CCCCC1	ZINC000488322530	459542083	/nfs/dbraw/zinc/54/20/83/459542083.db2.gz	JLQGQHOCLZRPII-HNNXBMFYSA-N	0	3	333.501	3.344	20	30		EGEDHN
CC(C)[C@@H]1C[C@@H](N[C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)CS1	ZINC000488551057	459545231	/nfs/dbraw/zinc/54/52/31/459545231.db2.gz	ZTUORGNZLPCHCN-NXHRZFHOSA-N	0	3	343.496	3.173	20	30		EGEDHN
CN(CCCOc1ccc(F)cc1)CCOc1ccccc1C#N	ZINC000497615011	459548818	/nfs/dbraw/zinc/54/88/18/459548818.db2.gz	DTTRYQYODQKVEE-UHFFFAOYSA-N	0	3	328.387	3.477	20	30		EGEDHN
C=CCn1cccc1C(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000488770740	459550536	/nfs/dbraw/zinc/55/05/36/459550536.db2.gz	VOTYTLOAAHIFJN-IBGZPJMESA-N	0	3	337.467	3.411	20	30		EGEDHN
N#Cc1ccc([C@H](N[C@@H]2CC[C@@H](Cc3ccccc3)C2)C(N)=O)cc1	ZINC000526121178	459551199	/nfs/dbraw/zinc/55/11/99/459551199.db2.gz	JWWCTKDKWIFAJQ-SXLOBPIMSA-N	0	3	333.435	3.086	20	30		EGEDHN
CC1CCN([C@H](CNC(=O)NCC2(C#N)CC2)c2ccccc2)CC1	ZINC000562388066	459551613	/nfs/dbraw/zinc/55/16/13/459551613.db2.gz	BGBFBRXBYLFIHH-GOSISDBHSA-N	0	3	340.471	3.063	20	30		EGEDHN
C=C[C@@H]1CCCCN1C(=O)c1ccc(N2CCN(C(C)C)CC2)cc1	ZINC000488865283	459553473	/nfs/dbraw/zinc/55/34/73/459553473.db2.gz	DRKLRZQQUDAQDT-LJQANCHMSA-N	0	3	341.499	3.398	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCC(N2CCc3ccccc3C2)CC1	ZINC000489006703	459558579	/nfs/dbraw/zinc/55/85/79/459558579.db2.gz	DHTTXDVKZPRMAF-UHFFFAOYSA-N	0	3	349.478	3.337	20	30		EGEDHN
C=CCn1cccc1C(=O)N(CCN(C)C)Cc1ccccc1F	ZINC000489033587	459558901	/nfs/dbraw/zinc/55/89/01/459558901.db2.gz	AXHXAIPLGSDJLH-UHFFFAOYSA-N	0	3	329.419	3.017	20	30		EGEDHN
CC[C@@H]1CCC[C@@H](CN2CCN(c3nccnc3C#N)C[C@@H]2C)C1	ZINC000542465662	459559234	/nfs/dbraw/zinc/55/92/34/459559234.db2.gz	IAIULSSPSAAEST-GVDBMIGSSA-N	0	3	327.476	3.075	20	30		EGEDHN
N#CCSCCCN1CCC(Oc2cncc(Cl)c2)CC1	ZINC000570694612	459559691	/nfs/dbraw/zinc/55/96/91/459559691.db2.gz	KVILCBDXAIHJPB-UHFFFAOYSA-N	0	3	325.865	3.225	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H](c2ccc(Cl)cc2)N(C)C)CC1	ZINC000570983632	459562714	/nfs/dbraw/zinc/56/27/14/459562714.db2.gz	OIYTWESDDDIHEF-GOSISDBHSA-N	0	3	349.906	3.099	20	30		EGEDHN
C=C(C)Cn1c(CC)nnc1N1CCCN(Cc2ccccc2)CC1	ZINC000571427592	459568910	/nfs/dbraw/zinc/56/89/10/459568910.db2.gz	ZLOYBMXKSFDVPR-UHFFFAOYSA-N	0	3	339.487	3.129	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2ccc([C@@H]3C[C@H]3C)o2)CC1	ZINC000592293636	459572155	/nfs/dbraw/zinc/57/21/55/459572155.db2.gz	DWHFWMLETOLHMZ-RHSMWYFYSA-N	0	3	331.460	3.243	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Nc1cnn(C(C)C)c1)C(C)C	ZINC000572665658	459582407	/nfs/dbraw/zinc/58/24/07/459582407.db2.gz	XJMRZSJDZRVJTO-QGZVFWFLSA-N	0	3	333.480	3.284	20	30		EGEDHN
C#CCN1CCC(C(=O)NC(C)(C)c2ccc(OCCC)cc2)CC1	ZINC000490738750	459585039	/nfs/dbraw/zinc/58/50/39/459585039.db2.gz	CYFRQEDBISNHME-UHFFFAOYSA-N	0	3	342.483	3.172	20	30		EGEDHN
COc1ccc(CN(C)C)cc1NC(=O)/C=C/c1ccc(C#N)cc1	ZINC000491092699	459597264	/nfs/dbraw/zinc/59/72/64/459597264.db2.gz	NIKVVSKZFZSDMR-PKNBQFBNSA-N	0	3	335.407	3.280	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccc(OC3CCCC3)nc2)nc(C)n1	ZINC000542877169	459607217	/nfs/dbraw/zinc/60/72/17/459607217.db2.gz	OIRHNLDQDJRZQL-INIZCTEOSA-N	0	3	336.395	3.300	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)[C@@]2(C#N)CC23CCCC3)C1	ZINC000562639551	459608537	/nfs/dbraw/zinc/60/85/37/459608537.db2.gz	AOCCSPUGZBWCBH-MMOPVJDHSA-N	0	3	337.467	3.412	20	30		EGEDHN
Cc1ccc(C[C@H]2CCCN(Cc3cnc4c(C#N)cnn4c3)C2)cc1	ZINC000592498734	459614173	/nfs/dbraw/zinc/61/41/73/459614173.db2.gz	BKEMNIOQYBBHNY-GOSISDBHSA-N	0	3	345.450	3.364	20	30		EGEDHN
C=CCN(CCc1ccco1)C[C@@H](O)COc1cc(C)ccc1C	ZINC000491329777	459616827	/nfs/dbraw/zinc/61/68/27/459616827.db2.gz	NZHKUCSSHCKWDO-GOSISDBHSA-N	0	3	329.440	3.367	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cc(Cl)ccc2OC(C)C)CC1	ZINC000491523665	459633887	/nfs/dbraw/zinc/63/38/87/459633887.db2.gz	GISKXIYXMLHMJT-UHFFFAOYSA-N	0	3	334.847	3.411	20	30		EGEDHN
C#C[C@H](NC(=O)NCc1ccc(CN(C)C)cc1)c1ccc(F)cc1	ZINC000491642364	459645400	/nfs/dbraw/zinc/64/54/00/459645400.db2.gz	WWPXFFFSYBSUGU-IBGZPJMESA-N	0	3	339.414	3.061	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H]2CC[C@@H](c3cccc(Cl)c3)C2)CC1	ZINC000491752472	459667546	/nfs/dbraw/zinc/66/75/46/459667546.db2.gz	MHJMSWQUFGCUPU-MJGOQNOKSA-N	0	3	344.886	3.438	20	30		EGEDHN
C[C@H](CNC(=O)c1ccc(Cl)c(C#N)c1)N(C)Cc1ccccc1	ZINC000543645931	459680187	/nfs/dbraw/zinc/68/01/87/459680187.db2.gz	AVGCHHWBERDRGZ-CQSZACIVSA-N	0	3	341.842	3.462	20	30		EGEDHN
CN(C)C/C=C\C(=O)N[C@@H](C#N)c1ccc(OCc2ccccc2)cc1	ZINC000491875081	459683328	/nfs/dbraw/zinc/68/33/28/459683328.db2.gz	YAGVTJDCOIYCAY-NSDNCLLMSA-N	0	3	349.434	3.064	20	30		EGEDHN
C[C@@H](OC[C@H](O)CNCC#Cc1ccccc1)c1ccc(Cl)cc1	ZINC000562987051	459687225	/nfs/dbraw/zinc/68/72/25/459687225.db2.gz	UWACKCLAKWUQGZ-OXQOHEQNSA-N	0	3	343.854	3.420	20	30		EGEDHN
C[C@@H](NC(=O)c1ccc(C#Cc2ccccc2)cc1)C1=CCN(C)CC1	ZINC000543754364	459696343	/nfs/dbraw/zinc/69/63/43/459696343.db2.gz	IKZZNVKFLIMTOK-GOSISDBHSA-N	0	3	344.458	3.467	20	30		EGEDHN
CC(C)N(C(=O)c1ccc(C#N)[nH]1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000592870834	459707348	/nfs/dbraw/zinc/70/73/48/459707348.db2.gz	GITSPQMJCYDAPS-SFHVURJKSA-N	0	3	336.439	3.011	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NC(=O)N[C@H](C)[C@H](c1ccccc1C)N(C)C	ZINC000563064670	459707935	/nfs/dbraw/zinc/70/79/35/459707935.db2.gz	UDVOAHBFQZLXPH-OQIJWPOYSA-N	0	3	345.487	3.019	20	30		EGEDHN
C[C@@H](NC(=O)OC(C)(C)C)[C@@H](Cc1ccccc1)NCCCC#N	ZINC000492791627	459720545	/nfs/dbraw/zinc/72/05/45/459720545.db2.gz	NROKCLMEFTZVJX-NVXWUHKLSA-N	0	3	331.460	3.404	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)[C@@H]1C[C@@H]2C=C[C@H]1CC2	ZINC000593031266	459746948	/nfs/dbraw/zinc/74/69/48/459746948.db2.gz	ZPRPDIWWEMXPMF-LSTHTHJFSA-N	0	3	337.467	3.051	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)NCCCC1CCC1	ZINC000596828575	459772880	/nfs/dbraw/zinc/77/28/80/459772880.db2.gz	FDZNURODWHFEFV-UHFFFAOYSA-N	0	3	342.487	3.212	20	30		EGEDHN
C=CCCO[C@H](C)c1nc(-c2ccc(OCCN(C)C)cc2)no1	ZINC000544972106	459794538	/nfs/dbraw/zinc/79/45/38/459794538.db2.gz	GWXQQKSGLCLDGC-CQSZACIVSA-N	0	3	331.416	3.331	20	30		EGEDHN
COc1ccc([C@@H](CCC#N)NC2CCN(C(=O)C3CC3)CC2)cc1	ZINC000584878679	459818424	/nfs/dbraw/zinc/81/84/24/459818424.db2.gz	SSEUPPDVGVCVQE-LJQANCHMSA-N	0	3	341.455	3.031	20	30		EGEDHN
COc1ccccc1[C@@H]1C[C@H]1NC(=O)C(C#N)CCc1ccccc1	ZINC000598311125	459861111	/nfs/dbraw/zinc/86/11/11/459861111.db2.gz	UDBSYRHTQLJOCU-NZSAHSFTSA-N	0	3	334.419	3.440	20	30		EGEDHN
C[C@@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccccc1-n1ccnn1	ZINC000586793825	459875601	/nfs/dbraw/zinc/87/56/01/459875601.db2.gz	CNRVHXLETHYSEV-AUUYWEPGSA-N	0	3	329.407	3.477	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN2CCC[C@H]2C2CC2)cc1	ZINC000609133701	459907568	/nfs/dbraw/zinc/90/75/68/459907568.db2.gz	VKLNAHBRUYQZLF-IBGZPJMESA-N	0	3	341.455	3.206	20	30		EGEDHN
CN(C)CCOc1ccc(-c2noc(-c3ccc(CC#N)cc3)n2)cc1	ZINC000546296621	459908258	/nfs/dbraw/zinc/90/82/58/459908258.db2.gz	UGTIREKQXZMLEV-UHFFFAOYSA-N	0	3	348.406	3.410	20	30		EGEDHN
N#Cc1ccc(Oc2cccc(C(=O)N[C@H]3CCN(C4CC4)C3)c2)cc1	ZINC000609135915	459909233	/nfs/dbraw/zinc/90/92/33/459909233.db2.gz	IFCCWEJTSLAWNU-KRWDZBQOSA-N	0	3	347.418	3.317	20	30		EGEDHN
CC(C)(C)CN(CCC#N)C(=O)[C@H]1CCCN(Cc2cccnc2)C1	ZINC000609192021	459921980	/nfs/dbraw/zinc/92/19/80/459921980.db2.gz	YQRYOTSACFSROU-SFHVURJKSA-N	0	3	342.487	3.082	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NC[C@H]1CCN1Cc1ccccc1	ZINC000598512012	459927612	/nfs/dbraw/zinc/92/76/12/459927612.db2.gz	VZKAONRASCWXGL-NHCUHLMSSA-N	0	3	347.462	3.150	20	30		EGEDHN
N#Cc1ccccc1NC(=O)CCN1CCCO[C@@H](c2ccccc2)C1	ZINC000609233554	459928639	/nfs/dbraw/zinc/92/86/39/459928639.db2.gz	GLDRIFZVHAIQBX-HXUWFJFHSA-N	0	3	349.434	3.350	20	30		EGEDHN
CCC(C#N)C(=O)N[C@@](C)(C(=O)OC)c1ccc(Cl)c(Cl)c1	ZINC000593614746	459934208	/nfs/dbraw/zinc/93/42/08/459934208.db2.gz	AFRMDROXTBFMSP-BJOHPYRUSA-N	0	3	343.210	3.048	20	30		EGEDHN
COc1cccc([C@@H](CNC(=O)CCCCCC#N)N2CCCC2)c1	ZINC000588248605	459937511	/nfs/dbraw/zinc/93/75/11/459937511.db2.gz	VUAIGWUNRPQJOE-LJQANCHMSA-N	0	3	343.471	3.422	20	30		EGEDHN
CC1(C)CCCN(CCNC(=O)c2cc3ccccc3n2CC#N)C1	ZINC000618273391	459950146	/nfs/dbraw/zinc/95/01/46/459950146.db2.gz	DHLNCSSPPKJYNA-UHFFFAOYSA-N	0	3	338.455	3.017	20	30		EGEDHN
C/C(=C/c1ccccc1)CN[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000588619508	459955987	/nfs/dbraw/zinc/95/59/87/459955987.db2.gz	KLPHGZVHSWAXDX-WYPWOVKWSA-N	0	3	345.446	3.352	20	30		EGEDHN
CCC[C@H]1CN(C[C@H](O)CC(C)(C)C#N)CCN1Cc1ccccc1	ZINC000598600881	459959159	/nfs/dbraw/zinc/95/91/59/459959159.db2.gz	HOVARKUQUCOPKW-VQTJNVASSA-N	0	3	343.515	3.274	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN1CCC(c2noc3cc(F)ccc32)CC1	ZINC000598616276	459965167	/nfs/dbraw/zinc/96/51/67/459965167.db2.gz	LMBVIOMWNCUKHB-OAHLLOKOSA-N	0	3	345.418	3.447	20	30		EGEDHN
C[C@@H]1C[C@@H](NC2CCN(Cc3cccc(C#N)c3)CC2)c2nccn21	ZINC000593724687	459965756	/nfs/dbraw/zinc/96/57/56/459965756.db2.gz	GOSAKHWOQCROMA-DNVCBOLYSA-N	0	3	335.455	3.015	20	30		EGEDHN
Cc1ccccc1[C@H]([C@@H](C)NC(=O)N1CCC[C@](C)(C#N)C1)N(C)C	ZINC000588722068	459975033	/nfs/dbraw/zinc/97/50/33/459975033.db2.gz	SWSJBRJNBCRKEH-IMFGXOCKSA-N	0	3	342.487	3.322	20	30		EGEDHN
C[C@H](NC(=O)N1CCC[C@](C)(C#N)C1)[C@H](c1ccccc1)N(C)C	ZINC000588721188	459975080	/nfs/dbraw/zinc/97/50/80/459975080.db2.gz	XXJRRPSLRIYVEP-KVSKMBFKSA-N	0	3	328.460	3.013	20	30		EGEDHN
N#CCN1CCC(NCc2c(Cl)cccc2OC(F)F)CC1	ZINC000609578346	459986258	/nfs/dbraw/zinc/98/62/58/459986258.db2.gz	LNBXWLSIPPULQO-UHFFFAOYSA-N	0	3	329.778	3.019	20	30		EGEDHN
CC1(C)[C@H](c2cccc(F)c2)CCN1C(=O)[C@@H](N)CCCCC#N	ZINC000602552332	459994415	/nfs/dbraw/zinc/99/44/15/459994415.db2.gz	OKNFPEJYSDEXAJ-IRXDYDNUSA-N	0	3	331.435	3.331	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CNCc1cccc(OCc2ccccn2)c1	ZINC000598715970	460003160	/nfs/dbraw/zinc/00/31/60/460003160.db2.gz	WRZMBESLPKIBGW-SFHVURJKSA-N	0	3	339.439	3.051	20	30		EGEDHN
Cc1ccc(Br)cc1CNC[C@@H](O)CC(C)(C)C#N	ZINC000598723744	460006754	/nfs/dbraw/zinc/00/67/54/460006754.db2.gz	JZOCBLAXRRIXLF-AWEZNQCLSA-N	0	3	325.250	3.148	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CNCc1cccc(Br)c1Cl	ZINC000598727149	460007976	/nfs/dbraw/zinc/00/79/76/460007976.db2.gz	DFMJKSAHJKCVJV-NSHDSACASA-N	0	3	345.668	3.493	20	30		EGEDHN
Cc1ccc(-c2ncc(CNC3CCN(CC#N)CC3)s2)cc1	ZINC000609677687	460008112	/nfs/dbraw/zinc/00/81/12/460008112.db2.gz	XKSHUCRNAOBJBA-UHFFFAOYSA-N	0	3	326.469	3.196	20	30		EGEDHN
CC(C)(C)c1cc(N2CCCN(Cc3ccc(C#N)cc3)CC2)ncn1	ZINC000589104486	460029579	/nfs/dbraw/zinc/02/95/79/460029579.db2.gz	LFSHUVIRWYDPKP-UHFFFAOYSA-N	0	3	349.482	3.358	20	30		EGEDHN
N#Cc1ccc(NC(=O)N[C@@H]2CCCN3CCCC[C@@H]23)c(Cl)c1	ZINC000594084978	460094861	/nfs/dbraw/zinc/09/48/61/460094861.db2.gz	UXESAVLUMICXID-CVEARBPZSA-N	0	3	332.835	3.350	20	30		EGEDHN
N#Cc1ccc(CN2CCN(CC3Cc4ccccc4C3)CC2)cc1	ZINC000589495262	460095297	/nfs/dbraw/zinc/09/52/97/460095297.db2.gz	LQTKJYNPWAITNZ-UHFFFAOYSA-N	0	3	331.463	3.091	20	30		EGEDHN
CC(C)(C)n1cc(C#N)cc1NC(=O)N[C@H]1CCCN2CCCC[C@H]12	ZINC000594095694	460098980	/nfs/dbraw/zinc/09/89/80/460098980.db2.gz	BYUCIJLIEHHYFB-JKSUJKDBSA-N	0	3	343.475	3.253	20	30		EGEDHN
N#Cc1cnc2c(F)ccc(F)c2c1N1CC[C@@H](N2CCCC2)C1	ZINC000610275837	460102592	/nfs/dbraw/zinc/10/25/92/460102592.db2.gz	NHDGLVJQUYCQPL-CYBMUJFWSA-N	0	3	328.366	3.059	20	30		EGEDHN
CCN(CCn1c(C)ncc1[N+](=O)[O-])[C@@H](C)c1ccc(C#N)cc1	ZINC000602764276	460112761	/nfs/dbraw/zinc/11/27/61/460112761.db2.gz	OUTCTEUOZQJLJA-ZDUSSCGKSA-N	0	3	327.388	3.055	20	30		EGEDHN
COc1cc(NC2CCN(CC3(CC#N)CC3)CC2)cc(OC)c1	ZINC000602791805	460127749	/nfs/dbraw/zinc/12/77/49/460127749.db2.gz	FHVKWPXOMDDYHW-UHFFFAOYSA-N	0	3	329.444	3.274	20	30		EGEDHN
CC(C)(C#N)c1ccc(C(=O)N[C@H]2CCCN3CCCC[C@@H]23)cc1	ZINC000594196809	460143990	/nfs/dbraw/zinc/14/39/90/460143990.db2.gz	NGMMVLCAHHBPQA-ROUUACIJSA-N	0	3	325.456	3.234	20	30		EGEDHN
Cc1ccc(C(=O)NC2CCN(Cc3ccc(CC#N)cc3)CC2)cc1	ZINC000602931972	460192344	/nfs/dbraw/zinc/19/23/44/460192344.db2.gz	KVDGCAAKXRZSJL-UHFFFAOYSA-N	0	3	347.462	3.456	20	30		EGEDHN
CN(CCc1ccccc1)[C@@H]1CCN(C(=O)c2cc(C#N)cs2)C1	ZINC000598194379	460200471	/nfs/dbraw/zinc/20/04/71/460200471.db2.gz	GMBKOPJBCZOJRL-QGZVFWFLSA-N	0	3	339.464	3.009	20	30		EGEDHN
N#CCCCC[C@@H](N)C(=O)Nc1ccc(Oc2ccc(F)cc2)nc1	ZINC000594440469	460221990	/nfs/dbraw/zinc/22/19/90/460221990.db2.gz	CTTKNFWHDAZKHI-MRXNPFEDSA-N	0	3	342.374	3.363	20	30		EGEDHN
CC[C@@H](CN1CCCC1)NC(=O)Nc1cc(C#N)ccc1OC(C)C	ZINC000610717892	460223665	/nfs/dbraw/zinc/22/36/65/460223665.db2.gz	UMGMNXZZMTUHNX-INIZCTEOSA-N	0	3	344.459	3.341	20	30		EGEDHN
CN(C)CCN(Cc1cccs1)C(=O)Nc1cc(F)cc(C#N)c1	ZINC000603073226	460236721	/nfs/dbraw/zinc/23/67/21/460236721.db2.gz	NMZSYZICGADRMY-UHFFFAOYSA-N	0	3	346.431	3.355	20	30		EGEDHN
C[C@@H](N[C@@H](C)CC(=O)NCCc1ccccc1)c1cccc(C#N)c1	ZINC000610830491	460245413	/nfs/dbraw/zinc/24/54/13/460245413.db2.gz	XCSKOGISLUXLHF-DLBZAZTESA-N	0	3	335.451	3.346	20	30		EGEDHN
CC(C)(C#N)CCCN[C@H](Cc1ccccc1)[C@H](O)C(F)(F)F	ZINC000603147489	460255111	/nfs/dbraw/zinc/25/51/11/460255111.db2.gz	YRQSPGHHJKWYEB-CABCVRRESA-N	0	3	328.378	3.440	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(c3ccc(F)cc3F)C2)c(F)c1	ZINC000610946878	460264490	/nfs/dbraw/zinc/26/44/90/460264490.db2.gz	HZXBVGIUGSQVTD-HNNXBMFYSA-N	0	3	331.341	3.344	20	30		EGEDHN
CC(C)(C)[C@@H](N)c1cn(Cc2cc(C#N)ccc2Br)nn1	ZINC000603240847	460270749	/nfs/dbraw/zinc/27/07/49/460270749.db2.gz	FMLAHBZOTRIDBP-AWEZNQCLSA-N	0	3	348.248	3.006	20	30		EGEDHN
N#Cc1cc(Cl)ccc1Cn1cc(CNC2CCCCC2)nn1	ZINC000603242896	460271170	/nfs/dbraw/zinc/27/11/70/460271170.db2.gz	JOCFEQUIJWCJEO-UHFFFAOYSA-N	0	3	329.835	3.274	20	30		EGEDHN
N#Cc1cccc(OCCCn2cc(CNC3CCCCC3)nn2)c1	ZINC000603242578	460271563	/nfs/dbraw/zinc/27/15/63/460271563.db2.gz	MLEKIUNAGYVQGE-UHFFFAOYSA-N	0	3	339.443	3.041	20	30		EGEDHN
CN(Cc1ccccc1)C[C@H](O)COc1ccc(C#N)c(Cl)c1	ZINC000615167020	460287083	/nfs/dbraw/zinc/28/70/83/460287083.db2.gz	QSBVFBYTNLSNRM-INIZCTEOSA-N	0	3	330.815	3.083	20	30		EGEDHN
COCCOCc1cc(C#N)ccc1NC[C@H]1CCCCN1C1CC1	ZINC000603363970	460290934	/nfs/dbraw/zinc/29/09/34/460290934.db2.gz	ZGLMYAUETPYYBU-LJQANCHMSA-N	0	3	343.471	3.150	20	30		EGEDHN
CO[C@]1(C(F)(F)F)CCCN(CCCC2(C#N)CCOCC2)C1	ZINC000619621553	460398893	/nfs/dbraw/zinc/39/88/93/460398893.db2.gz	AOJYKRJVLCEPTC-OAHLLOKOSA-N	0	3	334.382	3.130	20	30		EGEDHN
CC(C)C[C@](C)(C#N)NC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000604545211	460443514	/nfs/dbraw/zinc/44/35/14/460443514.db2.gz	HOEHOVPPLWAFGJ-HXUWFJFHSA-N	0	3	327.472	3.343	20	30		EGEDHN
CC(C)(CC#N)CNC[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000601963795	460963425	/nfs/dbraw/zinc/96/34/25/460963425.db2.gz	GYAKOFKCKORRMI-CYBMUJFWSA-N	0	3	331.243	3.263	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)C(=O)N[C@H]1CCN(C(C)(C)C)C1	ZINC000665556961	461124406	/nfs/dbraw/zinc/12/44/06/461124406.db2.gz	INGHOKSHJGXRBV-KRWDZBQOSA-N	0	3	345.487	3.266	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC[C@]2(c3ccccc3)CC2(C)C)CC1	ZINC000660703817	461930246	/nfs/dbraw/zinc/93/02/46/461930246.db2.gz	HTFFWCSTELYTLU-NRFANRHFSA-N	0	3	341.499	3.304	20	30		EGEDHN
C=CCCn1cc(CNCCCc2cccc(Br)c2)nn1	ZINC000657359119	462070223	/nfs/dbraw/zinc/07/02/23/462070223.db2.gz	PWDVXHCGACMRGM-UHFFFAOYSA-N	0	3	349.276	3.339	20	30		EGEDHN
C=CCN(CCc1nc(-c2ccc(Cl)cc2)no1)[C@H](C)COC	ZINC000661244606	462168735	/nfs/dbraw/zinc/16/87/35/462168735.db2.gz	WKOWVKJIWPNCRV-CYBMUJFWSA-N	0	3	335.835	3.455	20	30		EGEDHN
C=CC[C@H]1CCCN(CCCOc2ccc(S(C)(=O)=O)cc2)C1	ZINC000661378300	462223833	/nfs/dbraw/zinc/22/38/33/462223833.db2.gz	CERJWACMRDERHP-INIZCTEOSA-N	0	3	337.485	3.147	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H]2CCCC[C@H]2C(F)(F)F)CC1	ZINC000645266057	462261420	/nfs/dbraw/zinc/26/14/20/462261420.db2.gz	KHOQSDOTLKMRKC-KGLIPLIRSA-N	0	3	333.398	3.057	20	30		EGEDHN
C=CC[C@@H]1CCCC[C@@H]1NCc1ccccc1S(=O)(=O)N(C)C	ZINC000657830402	462287803	/nfs/dbraw/zinc/28/78/03/462287803.db2.gz	IESFQHPRFQYHIW-WBVHZDCISA-N	0	3	336.501	3.161	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1N[C@@H](CC)c1cc(OC)c(OC)c(OC)c1	ZINC000652204973	462471771	/nfs/dbraw/zinc/47/17/71/462471771.db2.gz	IUCOBWQDTHDWRL-XHSDSOJGSA-N	0	3	335.444	3.487	20	30		EGEDHN
Cc1cc(NC(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)ncc1C#N	ZINC000603113541	469268923	/nfs/dbraw/zinc/26/89/23/469268923.db2.gz	PNYHEEFHPJMCLT-KDOFPFPSSA-N	0	3	337.427	3.075	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCCCC[C@H]2c2ccncc2)CC1	ZINC000171738334	526425592	/nfs/dbraw/zinc/42/55/92/526425592.db2.gz	CTQYNQYQOINPIR-IBGZPJMESA-N	0	3	342.487	3.359	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(Cc2ccc(OC)cc2)C2CC2)CC1	ZINC000171740796	526426046	/nfs/dbraw/zinc/42/60/46/526426046.db2.gz	AEVYUNPUOKANHE-UHFFFAOYSA-N	0	3	343.471	3.020	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC[C@H](Nc2ccccc2)C(C)C)CC1	ZINC000171707664	526435406	/nfs/dbraw/zinc/43/54/06/526435406.db2.gz	LTMYXGMNXDFSDF-IBGZPJMESA-N	0	3	344.503	3.073	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(F)cc2OC(F)F)CC1	ZINC000174049558	526441166	/nfs/dbraw/zinc/44/11/66/526441166.db2.gz	RNGZFERVQNVQCD-UHFFFAOYSA-N	0	3	343.349	3.199	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc3[nH]c4c(c3c2)CCCC4)CC1	ZINC000171725609	526447442	/nfs/dbraw/zinc/44/74/42/526447442.db2.gz	BQDKXNGTTRXSAV-UHFFFAOYSA-N	0	3	337.467	3.427	20	30		EGEDHN
N#CCc1ccc(OC[C@@H](O)CN2CCC[C@@H]2c2cccs2)cc1	ZINC000025229122	526485670	/nfs/dbraw/zinc/48/56/70/526485670.db2.gz	HCZQTRLDYKKAFJ-FUHWJXTLSA-N	0	3	342.464	3.391	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@@H](C)N[C@H](C)c1ccc(-n2cccn2)cc1	ZINC000174370488	526538055	/nfs/dbraw/zinc/53/80/55/526538055.db2.gz	UGJFIQOVRQAXRJ-IAGOWNOFSA-N	0	3	340.471	3.336	20	30		EGEDHN
C#CCCCCNC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C	ZINC000155113534	526697857	/nfs/dbraw/zinc/69/78/57/526697857.db2.gz	LCNKGFYCSQSSIF-SFHVURJKSA-N	0	3	327.472	3.096	20	30		EGEDHN
C=C(Cl)COc1ccc([C@@H](C)N[C@@H](C)CN2CCCC2=O)cc1	ZINC000178498756	526891146	/nfs/dbraw/zinc/89/11/46/526891146.db2.gz	YEMPCDJQYAPBHK-LSDHHAIUSA-N	0	3	336.863	3.479	20	30		EGEDHN
CC(C)[C@]1(C)C[C@H]1C(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000185732451	535293323	/nfs/dbraw/zinc/29/33/23/535293323.db2.gz	LNHFIZAVXQNZMP-ICSRJNTNSA-N	0	3	327.472	3.131	20	30		EGEDHN
CCO[C@@H]1C[C@H](N[C@@H](C)C(=O)Nc2ccccc2C#N)C1(CC)CC	ZINC000178667957	535511511	/nfs/dbraw/zinc/51/15/11/535511511.db2.gz	PWLRHSWCMFNHQE-JCGIZDLHSA-N	0	3	343.471	3.459	20	30		EGEDHN
O=C(N[C@@H]1CCCN(C2CCCCC2)C1=O)C1CCN(C2CC2)CC1	ZINC000328708183	547483908	/nfs/dbraw/zinc/48/39/08/547483908.db2.gz	BARCFTTUTQMCFR-GOSISDBHSA-N	0	3	347.503	3.141	20	30		EGEDHN
Cc1cc2c(o1)CC(C)(C)C[C@@H]2NC(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000329307323	547494702	/nfs/dbraw/zinc/49/47/02/547494702.db2.gz	POOGGYMGFNAYFF-CJNGLKHVSA-N	0	3	331.460	3.342	20	30		EGEDHN
COCC#CCN[C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1	ZINC000671249010	548269211	/nfs/dbraw/zinc/26/92/11/548269211.db2.gz	RYASXINOFQCTKG-QGZVFWFLSA-N	0	3	341.373	3.413	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)NCC(C)(C)N2CCCCC2)cc1	ZINC000672352978	548429367	/nfs/dbraw/zinc/42/93/67/548429367.db2.gz	CLPZEQZTMOSJFT-UHFFFAOYSA-N	0	3	345.487	3.315	20	30		EGEDHN
CCn1nccc1C(=O)C(C#N)c1nc2ccccc2n1C(F)F	ZINC000681352736	549985355	/nfs/dbraw/zinc/98/53/55/549985355.db2.gz	QPQXLCSANFWMJJ-SNVBAGLBSA-N	0	3	329.310	3.138	20	30		EGEDHN
CCCCCCCCCN(C)C(=O)NC[C@H]1CN2CCC[C@H]2CO1	ZINC000729504349	574866270	/nfs/dbraw/zinc/86/62/70/574866270.db2.gz	HREPRMHGMUGSFC-ROUUACIJSA-N	0	3	339.524	3.242	20	30		EGEDHN
C=CCN1CCC(NC(=S)Nc2ccc(F)c(Cl)c2)CC1	ZINC000729942386	574897796	/nfs/dbraw/zinc/89/77/96/574897796.db2.gz	MNBGFEXDEALGLL-UHFFFAOYSA-N	0	3	327.856	3.416	20	30		EGEDHN
O=C1CC2(CCCCC2)CC(=O)C1=CNCCCN1CCCCC1	ZINC000730970721	575041260	/nfs/dbraw/zinc/04/12/60/575041260.db2.gz	MUNFCHLEPGGFCQ-UHFFFAOYSA-N	0	3	332.488	3.218	20	30		EGEDHN
C#CCNC(=O)[C@H](C)NCC1(c2ccc(C(C)C)cc2)CCCC1	ZINC000731040945	575046093	/nfs/dbraw/zinc/04/60/93/575046093.db2.gz	RDCDJCRWUFPXGF-KRWDZBQOSA-N	0	3	326.484	3.349	20	30		EGEDHN
C[C@@H]1CCC[C@@H](C)N1Cc1cc(=O)n2c3ccccc3[nH]c2c1C#N	ZINC000731213462	575060649	/nfs/dbraw/zinc/06/06/49/575060649.db2.gz	WGNATGUFCXWART-FMKPAKJESA-N	0	3	334.423	3.487	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)c2cc(F)cc([N+](=O)[O-])c2)c1	ZINC000731545800	575080164	/nfs/dbraw/zinc/08/01/64/575080164.db2.gz	FFOMKWNBDOUFAG-HNNXBMFYSA-N	0	3	341.298	3.004	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)CO[C@@H]2CCC[C@@H](C)C2)cc1	ZINC000733053653	575303789	/nfs/dbraw/zinc/30/37/89/575303789.db2.gz	QAVOMLDMLVKOCE-ZTFGCOKTSA-N	0	3	342.439	3.492	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)CCc2csc(C)n2)cc1	ZINC000733678522	575381278	/nfs/dbraw/zinc/38/12/78/575381278.db2.gz	BQOPECXPDVZUBY-INIZCTEOSA-N	0	3	341.436	3.294	20	30		EGEDHN
C=CC[C@H](NC(=O)NCCN1CCCC[C@H]1CC)c1ccncc1	ZINC000734678855	575540987	/nfs/dbraw/zinc/54/09/87/575540987.db2.gz	JGYDGFWPFOVKIR-MSOLQXFVSA-N	0	3	330.476	3.263	20	30		EGEDHN
C=CCNC(=O)CN[C@H](c1ccc(Br)cc1)C1CCC1	ZINC000678756960	576170301	/nfs/dbraw/zinc/17/03/01/576170301.db2.gz	SQKTYCIGDFWMMQ-INIZCTEOSA-N	0	3	337.261	3.182	20	30		EGEDHN
C[C@@H](Cc1ccccc1F)C(=O)C(C#N)C(=O)NC1CCCCC1	ZINC000739153288	576379808	/nfs/dbraw/zinc/37/98/08/576379808.db2.gz	AITFYWBUNXZNFR-BBRMVZONSA-N	0	3	330.403	3.162	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2ccccc2Oc2cccnc2)CC1	ZINC000740736173	576621457	/nfs/dbraw/zinc/62/14/57/576621457.db2.gz	HUTRRPQFDSKZNA-UHFFFAOYSA-N	0	3	349.434	3.091	20	30		EGEDHN
C#CCCN1CCC(NC(=O)[C@@H](c2ccccc2)[C@@H](C)CC)CC1	ZINC000740737734	576621970	/nfs/dbraw/zinc/62/19/70/576621970.db2.gz	UWDOUGDRVQBSFK-FXAWDEMLSA-N	0	3	326.484	3.420	20	30		EGEDHN
C#CCOc1cc(F)ccc1NC(=O)NC[C@@H](C)N1CCCC[C@@H]1C	ZINC000743194183	576802934	/nfs/dbraw/zinc/80/29/34/576802934.db2.gz	GNQAQECKZJRLNA-LSDHHAIUSA-N	0	3	347.434	3.222	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)Cc2cc(F)ccc2F)c1	ZINC000744027893	576819105	/nfs/dbraw/zinc/81/91/05/576819105.db2.gz	CJVFGRHQVYFWRB-OAHLLOKOSA-N	0	3	328.318	3.163	20	30		EGEDHN
C[C@@H](C(=O)C(C#N)C(=O)NCc1ccccc1)c1cccc(Cl)c1	ZINC000744027269	576819134	/nfs/dbraw/zinc/81/91/34/576819134.db2.gz	OMOVOLDAGZQQJR-CXAGYDPISA-N	0	3	340.810	3.469	20	30		EGEDHN
CC(=CC(=O)C(C#N)C(=O)Nc1ccc2c(c1)OCCO2)C(C)(C)C	ZINC000744032642	576819255	/nfs/dbraw/zinc/81/92/55/576819255.db2.gz	UYGZZYFUPJFEGW-UQTJOTSZSA-N	0	3	342.395	3.098	20	30		EGEDHN
N#Cc1c2[nH]c3ccccc3n2c(=O)cc1CN1CCC2(CCCC2)C1	ZINC000744421838	576827667	/nfs/dbraw/zinc/82/76/67/576827667.db2.gz	IVOFJLDAXGZAPQ-MRXNPFEDSA-N	0	3	346.434	3.490	20	30		EGEDHN
C[C@@H](Oc1ccc(F)c(F)c1)C(=O)C(C#N)c1nc2ccccc2[nH]1	ZINC000744929825	576837112	/nfs/dbraw/zinc/83/71/12/576837112.db2.gz	OUUVNCUEVVUHLP-PWSUYJOCSA-N	0	3	341.317	3.485	20	30		EGEDHN
N#CC(C(=O)CCCc1nc(-c2cccs2)no1)c1ccccn1	ZINC000049458134	1291628149	/nfs/dbraw/zinc/62/81/49/1291628149.db2.gz	WAQZCDIMFJHJHA-GFCCVEGCSA-N	0	3	338.392	3.392	20	30		EGEDHN
CCCC(=O)N1CCC[C@H]1C(=O)C(C#N)c1nc(C(C)C)cs1	ZINC000080451720	1292603963	/nfs/dbraw/zinc/60/39/63/1292603963.db2.gz	KPMFLKMDHIPINZ-OCCSQVGLSA-N	0	3	333.457	3.234	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N(CCC)CCN2CCCC2)cc1	ZINC000831853081	1292926806	/nfs/dbraw/zinc/92/68/06/1292926806.db2.gz	OCOOGIMKTKXMOR-UHFFFAOYSA-N	0	3	328.456	3.037	20	30		EGEDHN
C[C@@H]1CCC[C@@H](C)N1Cc1cc(=O)n2c3ccccc3[nH]c2c1C#N	ZINC000108864011	1293082971	/nfs/dbraw/zinc/08/29/71/1293082971.db2.gz	WGNATGUFCXWART-IIAWOOMASA-N	0	3	334.423	3.487	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@H](C)CSc1ccccc1	ZINC000111944223	1293113432	/nfs/dbraw/zinc/11/34/32/1293113432.db2.gz	JIYIXBKWUQVGMY-ZBFHGGJFSA-N	0	3	332.469	3.430	20	30		EGEDHN
C=CCN1CCC(N[C@@H](C)c2nc(Br)cs2)CC1	ZINC000834571404	1293118821	/nfs/dbraw/zinc/11/88/21/1293118821.db2.gz	SIXJNXUKKFRLIY-JTQLQIEISA-N	0	3	330.295	3.207	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)C(=O)Nc1ccccn1)c1cccc(F)c1	ZINC000116593556	1293207546	/nfs/dbraw/zinc/20/75/46/1293207546.db2.gz	IQQUANVPLNOURU-WFASDCNBSA-N	0	3	325.343	3.062	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)CCC(C)(C)C)cc1OC	ZINC000121749786	1293388129	/nfs/dbraw/zinc/38/81/29/1293388129.db2.gz	UKMUMISCZIKSHL-CYBMUJFWSA-N	0	3	332.400	3.177	20	30		EGEDHN
COc1ccc([C@H](C)NCc2cccc(OCC#N)c2)cc1OC	ZINC000128497405	1293595699	/nfs/dbraw/zinc/59/56/99/1293595699.db2.gz	QQWHPAUWTAZAGM-AWEZNQCLSA-N	0	3	326.396	3.457	20	30		EGEDHN
C#CCCCNC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1	ZINC000173402556	1294460961	/nfs/dbraw/zinc/46/09/61/1294460961.db2.gz	GBRCHTIAORVMTG-INIZCTEOSA-N	0	3	333.501	3.234	20	30		EGEDHN
CCOCCC(=O)C(C#N)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000176095987	1294590311	/nfs/dbraw/zinc/59/03/11/1294590311.db2.gz	YYDULPASHDJFAE-LBPRGKRZSA-N	0	3	329.183	3.067	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2cc(Cl)ccc2C)CC1	ZINC000188066319	1295433330	/nfs/dbraw/zinc/43/33/30/1295433330.db2.gz	PMQBVZWMVLBQCD-UHFFFAOYSA-N	0	3	335.879	3.488	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@@H](C)Sc1ccc(OC)cc1	ZINC000193382751	1295861004	/nfs/dbraw/zinc/86/10/04/1295861004.db2.gz	AIERGJONNIXDRP-CZUORRHYSA-N	0	3	348.468	3.191	20	30		EGEDHN
C#CCOc1ccccc1CN1CCC[C@@H]1C[C@@H](O)c1ccco1	ZINC000245698570	1296320856	/nfs/dbraw/zinc/32/08/56/1296320856.db2.gz	BIKMKHVGQRIVCI-QZTJIDSGSA-N	0	3	325.408	3.380	20	30		EGEDHN
N#CC(C(=O)NC1CC1)C(=O)[C@H]1C[C@H]1c1ccc(Cl)cc1Cl	ZINC000245897404	1296329248	/nfs/dbraw/zinc/32/92/48/1296329248.db2.gz	FCKKEHDVOBSJED-AVGNSLFASA-N	0	3	337.206	3.084	20	30		EGEDHN
CC[C@H](C)c1ccc(NC(=O)C(C#N)C(=O)[C@H]2CCCCO2)cc1	ZINC000246161257	1296339766	/nfs/dbraw/zinc/33/97/66/1296339766.db2.gz	GIASDGOEQPKIHM-IAOVAPTHSA-N	0	3	328.412	3.417	20	30		EGEDHN
CC[C@H](C)c1ccc(NC(=O)C(C#N)C(=O)[C@H]2CCCCO2)cc1	ZINC000246161266	1296340255	/nfs/dbraw/zinc/34/02/55/1296340255.db2.gz	GIASDGOEQPKIHM-RRQGHBQHSA-N	0	3	328.412	3.417	20	30		EGEDHN
CCO[C@@H]1C[C@@H]1C(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000249713659	1296450378	/nfs/dbraw/zinc/45/03/78/1296450378.db2.gz	GSKWTXAFTSZAAH-OUJBWJOFSA-N	0	3	341.194	3.066	20	30		EGEDHN
O=c1[nH]c2ccccc2cc1C=NCCN1CCc2ccccc2C1	ZINC000255379270	1296526332	/nfs/dbraw/zinc/52/63/32/1296526332.db2.gz	VBXQDOAYMFFXPP-HMAPJEAMSA-N	0	3	331.419	3.418	20	30		EGEDHN
C[C@@H](NC[C@@H](O)c1c(F)cccc1F)c1ccc(OCC#N)cc1	ZINC000305787311	1297051759	/nfs/dbraw/zinc/05/17/59/1297051759.db2.gz	YPDSUIGVYQNRNQ-SJKOYZFVSA-N	0	3	332.350	3.251	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)C1(C)C	ZINC000404746195	1297759100	/nfs/dbraw/zinc/75/91/00/1297759100.db2.gz	SQBDTCDHXFSBCO-GHMZBOCLSA-N	0	3	333.270	3.176	20	30		EGEDHN
C#CCOc1ccc(Br)cc1CNCCOC1CCC1	ZINC000690680436	1298130455	/nfs/dbraw/zinc/13/04/55/1298130455.db2.gz	HNIORWVGBBKABQ-UHFFFAOYSA-N	0	3	338.245	3.120	20	30		EGEDHN
C=CCC1(O)CCN(CCOc2cccc(Br)c2)CC1	ZINC000717473772	1298304001	/nfs/dbraw/zinc/30/40/01/1298304001.db2.gz	WTHDYTPTTVZEIF-UHFFFAOYSA-N	0	3	340.261	3.231	20	30		EGEDHN
C=C(Cl)C[C@H](N)C(=O)NCc1ccc(N2CCC(C)CC2)cc1	ZINC000876756248	1298961399	/nfs/dbraw/zinc/96/13/99/1298961399.db2.gz	PMLDYCIJPRMLOQ-KRWDZBQOSA-N	0	3	335.879	3.009	20	30		EGEDHN
Cc1noc(C)c1[C@@H](C)C(=O)C(C#N)C(=O)Nc1ccccc1Cl	ZINC000750391358	1299387139	/nfs/dbraw/zinc/38/71/39/1299387139.db2.gz	GFVJKBDYTFIOQW-SKDRFNHKSA-N	0	3	345.786	3.396	20	30		EGEDHN
CC(=O)[C@](C#N)(CCN1CCC2(CCOCC2)CC1)c1ccccc1	ZINC000878573860	1300087347	/nfs/dbraw/zinc/08/73/47/1300087347.db2.gz	MYHJGIQOJLKHCJ-OAQYLSRUSA-N	0	3	340.467	3.320	20	30		EGEDHN
CC[C@@H]1CC[C@@H](C(=O)C(C#N)C(=O)Nc2ccc(F)c(Cl)c2)O1	ZINC000757304690	1300663288	/nfs/dbraw/zinc/66/32/88/1300663288.db2.gz	MKPSIPZWLNCVGC-GYSYKLTISA-N	0	3	338.766	3.084	20	30		EGEDHN
COC(=O)c1ccccc1CCC(=O)C(C#N)c1nc2ccccc2o1	ZINC000759237058	1301046962	/nfs/dbraw/zinc/04/69/62/1301046962.db2.gz	HADJFINJUKDKBS-HNNXBMFYSA-N	0	3	348.358	3.423	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@H](C)Oc1ccc(Cl)cc1	ZINC000759430219	1301089828	/nfs/dbraw/zinc/08/98/28/1301089828.db2.gz	OZYOLCDEZHGNCN-WFASDCNBSA-N	0	3	336.819	3.123	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)c1cccc(C(C)C)n1	ZINC000762066812	1301607158	/nfs/dbraw/zinc/60/71/58/1301607158.db2.gz	BROPWQQVQOHXLX-ZDUSSCGKSA-N	0	3	337.379	3.175	20	30		EGEDHN
C#C[C@@H](NC1CC(c2cccc(Br)c2)C1)[C@@H]1CCCO1	ZINC000762619690	1301715427	/nfs/dbraw/zinc/71/54/27/1301715427.db2.gz	CIFRABJJEJXCJW-BNICSPFPSA-N	0	3	334.257	3.466	20	30		EGEDHN
C[C@H]1CN(C2CC2)C[C@H]1Nc1nccc(Oc2cccc(C#N)c2)n1	ZINC000882083546	1301820140	/nfs/dbraw/zinc/82/01/40/1301820140.db2.gz	BTXJLDICWGALRH-SUMWQHHRSA-N	0	3	335.411	3.035	20	30		EGEDHN
C[C@@H]1CN(C2CC2)C[C@@H]1Nc1nccc(Oc2cccc(C#N)c2)n1	ZINC000882083544	1301820575	/nfs/dbraw/zinc/82/05/75/1301820575.db2.gz	BTXJLDICWGALRH-DYVFJYSZSA-N	0	3	335.411	3.035	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN[C@H]2CCCOc3ccc(F)cc32)cc1	ZINC000763236747	1301854611	/nfs/dbraw/zinc/85/46/11/1301854611.db2.gz	SOROIYZXUWLJCZ-ZWKOTPCHSA-N	0	3	326.371	3.234	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(N3CCCCC3)c(F)c2)CC1	ZINC000882648461	1302043353	/nfs/dbraw/zinc/04/33/53/1302043353.db2.gz	ASAAAVUNRZWERT-UHFFFAOYSA-N	0	3	343.446	3.100	20	30		EGEDHN
C#CCN(C(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1)C1CC1	ZINC000764671693	1302115938	/nfs/dbraw/zinc/11/59/38/1302115938.db2.gz	LAWRIHQCBGHMJB-KRWDZBQOSA-N	0	3	345.512	3.328	20	30		EGEDHN
N#CCSc1ccccc1C(=O)NC[C@@H]1CCCCN1C1CC1	ZINC000765204434	1302219487	/nfs/dbraw/zinc/21/94/87/1302219487.db2.gz	HFXUXKOUUQUYJE-HNNXBMFYSA-N	0	3	329.469	3.049	20	30		EGEDHN
C#CCOc1ccc([C@@H](C)NCc2ccc(N3CCNC3=O)cc2)cc1	ZINC000883285361	1302364828	/nfs/dbraw/zinc/36/48/28/1302364828.db2.gz	NIQUFNFKAJBWLX-MRXNPFEDSA-N	0	3	349.434	3.079	20	30		EGEDHN
C[C@@H]1CN(C[C@H](O)c2ccc(C#N)cc2)[C@@H](C)CN1Cc1ccccc1	ZINC000766965042	1302554524	/nfs/dbraw/zinc/55/45/24/1302554524.db2.gz	WQPVAXQPQWBSBM-FGSXEWAUSA-N	0	3	349.478	3.186	20	30		EGEDHN
C[C@@H]1CCN(CC(=O)C(C#N)c2nc3ccccc3s2)C[C@H]1C	ZINC000766984822	1302558217	/nfs/dbraw/zinc/55/82/17/1302558217.db2.gz	MTZYHFVTYOSSKP-MCIONIFRSA-N	0	3	327.453	3.450	20	30		EGEDHN
CCCCCCCN1C(=O)N[C@]2(CCN(Cc3ccccc3)C2)C1=O	ZINC000767143154	1302591637	/nfs/dbraw/zinc/59/16/37/1302591637.db2.gz	FWPDASSUVZORLY-FQEVSTJZSA-N	0	3	343.471	3.153	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2nc(Cl)sc2C)CC1	ZINC000948608197	1333594910	/nfs/dbraw/zinc/59/49/10/1333594910.db2.gz	MEKSPRCPTSBMCV-ZDUSSCGKSA-N	0	3	339.892	3.055	20	30		EGEDHN
C[C@@H](NC(=O)Cc1ccccc1CC#N)[C@H](c1ccccc1)N(C)C	ZINC000770046605	1303211618	/nfs/dbraw/zinc/21/16/18/1303211618.db2.gz	HPVFXTYSZLKCKI-IIBYNOLFSA-N	0	3	335.451	3.103	20	30		EGEDHN
N#Cc1ccc(N2CCC(NCc3nc4c(s3)CCC4)CC2)cc1	ZINC000771817802	1303447020	/nfs/dbraw/zinc/44/70/20/1303447020.db2.gz	GDVJVVUDXIEXBL-UHFFFAOYSA-N	0	3	338.480	3.262	20	30		EGEDHN
C#CCOc1ccc([C@@H](C)N[C@H]2CCN(Cc3ccccc3)C2=O)cc1	ZINC000772950491	1303597835	/nfs/dbraw/zinc/59/78/35/1303597835.db2.gz	LPTJUDGNCHKWPX-UTKZUKDTSA-N	0	3	348.446	3.150	20	30		EGEDHN
COc1ccc(OC)c([C@@H](O)CN[C@H](CCC#N)c2ccccc2)c1	ZINC000775554226	1303983183	/nfs/dbraw/zinc/98/31/83/1303983183.db2.gz	VXWAZFNNQJNKRP-MOPGFXCFSA-N	0	3	340.423	3.372	20	30		EGEDHN
C=C(C)[C@@H](NC[C@@H]1CC(C(=O)OC)=C(C)O1)c1ccc(F)c(F)c1	ZINC000775725862	1304021304	/nfs/dbraw/zinc/02/13/04/1304021304.db2.gz	XIVZBBKEERRINH-SUMWQHHRSA-N	0	3	337.366	3.408	20	30		EGEDHN
C#C[C@@H](NCc1ccc(OCc2ccccc2)cc1O)[C@@H]1CCCO1	ZINC000775998186	1304077164	/nfs/dbraw/zinc/07/71/64/1304077164.db2.gz	DTBZVLDYANQFRV-CTNGQTDRSA-N	0	3	337.419	3.242	20	30		EGEDHN
C#C[C@@H]([NH2+]Cc1ccc(OCc2ccccc2)cc1[O-])[C@@H]1CCCO1	ZINC000775998186	1304077166	/nfs/dbraw/zinc/07/71/66/1304077166.db2.gz	DTBZVLDYANQFRV-CTNGQTDRSA-N	0	3	337.419	3.242	20	30		EGEDHN
C#CCSCCN[C@@H](C)c1ccc(OC)cc1Br	ZINC000776165414	1304104758	/nfs/dbraw/zinc/10/47/58/1304104758.db2.gz	QMHZQIKUNYJXOD-NSHDSACASA-N	0	3	328.275	3.475	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CNCC1(SC)CCOCC1	ZINC000778172408	1304409820	/nfs/dbraw/zinc/40/98/20/1304409820.db2.gz	JLPZAUBUKUHXBC-UHFFFAOYSA-N	0	3	339.888	3.354	20	30		EGEDHN
C=CCS(=O)(=O)CCN[C@H](CC)CSc1ccc(Cl)cc1	ZINC000783536896	1305105153	/nfs/dbraw/zinc/10/51/53/1305105153.db2.gz	QPCWMNUWIKPOKT-CQSZACIVSA-N	0	3	347.933	3.401	20	30		EGEDHN
N#CC(C(=O)CCCOc1ccc2c(c1)NC(=O)CC2)c1ccccn1	ZINC000786298989	1305552099	/nfs/dbraw/zinc/55/20/99/1305552099.db2.gz	LWUMNADISBQXEV-INIZCTEOSA-N	0	3	349.390	3.002	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)C1CCSCC1)c1ccccc1	ZINC000787045118	1305683459	/nfs/dbraw/zinc/68/34/59/1305683459.db2.gz	HXGPSQMVARQEPO-CVEARBPZSA-N	0	3	330.453	3.106	20	30		EGEDHN
CC(C)N1CCN(c2ccc(C(=O)OC3(CC#N)CCC3)cc2)CC1	ZINC000788129905	1305874100	/nfs/dbraw/zinc/87/41/00/1305874100.db2.gz	CBTXYSLPFRSPCD-UHFFFAOYSA-N	0	3	341.455	3.210	20	30		EGEDHN
C=CCc1cc(C[NH2+]Cc2ccc(OC)cc2[O-])cc(OC)c1O	ZINC000793387556	1309362088	/nfs/dbraw/zinc/36/20/88/1309362088.db2.gz	GSGKLZVRBZZPPR-UHFFFAOYSA-N	0	3	329.396	3.133	20	30		EGEDHN
N#CCCn1cc(CN2CCC[C@@H](CF)C2)c(-c2ccncc2)n1	ZINC000895546070	1309395198	/nfs/dbraw/zinc/39/51/98/1309395198.db2.gz	XNRTUAXONLWVLV-HNNXBMFYSA-N	0	3	327.407	3.040	20	30		EGEDHN
C#CC[C@H](CCOC)NCc1nc(-c2cccc(OC)c2)cs1	ZINC000895667881	1309455466	/nfs/dbraw/zinc/45/54/66/1309455466.db2.gz	AZCSVMRWBKTAOA-OAHLLOKOSA-N	0	3	330.453	3.337	20	30		EGEDHN
COc1ccc(C(C)N=Nc2cncnc2)cc1CN1CCCCC1	ZINC000794979541	1309638955	/nfs/dbraw/zinc/63/89/55/1309638955.db2.gz	YUCBMBZFJYCTBK-UHFFFAOYSA-N	0	3	339.443	3.307	20	30		EGEDHN
C[C@@H](NC[C@@H](O)c1ccc(C#N)cc1)c1ccc(Br)cn1	ZINC000796498624	1310015991	/nfs/dbraw/zinc/01/59/91/1310015991.db2.gz	NMKCZAFTAJIHMU-BDJLRTHQSA-N	0	3	346.228	3.100	20	30		EGEDHN
C[C@@H](NCc1ccc(C[S@](C)=O)cc1)c1ccc(OCC#N)cc1	ZINC000797135638	1310145535	/nfs/dbraw/zinc/14/55/35/1310145535.db2.gz	YKORLIXQRSHUIE-MYYSRTQBSA-N	0	3	342.464	3.318	20	30		EGEDHN
CCC(=O)N1CCCC[C@H]1C(=O)C(C#N)c1ncc(C(C)(C)C)s1	ZINC000797572864	1310213893	/nfs/dbraw/zinc/21/38/93/1310213893.db2.gz	JUFJRGOOCSGOMC-STQMWFEESA-N	0	3	347.484	3.408	20	30		EGEDHN
N#Cc1ccc(NCCNCc2ccsc2C(F)(F)F)nc1	ZINC000897397447	1310321121	/nfs/dbraw/zinc/32/11/21/1310321121.db2.gz	YIXZIQHHTBPYSN-UHFFFAOYSA-N	0	3	326.347	3.235	20	30		EGEDHN
CCCCCCCS(=O)(=O)[N-]c1cc(C[NH+](C)C)ccc1OC	ZINC000799644107	1310594063	/nfs/dbraw/zinc/59/40/63/1310594063.db2.gz	JSNAQGQVNATYQX-UHFFFAOYSA-N	0	3	342.505	3.469	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)[C@@H]2CCCC(F)(F)C2)cc1	ZINC000800385315	1310747144	/nfs/dbraw/zinc/74/71/44/1310747144.db2.gz	ACIQLJNPPZYOAM-BXUZGUMPSA-N	0	3	336.338	3.168	20	30		EGEDHN
N#Cc1ccc(CNCc2ccc(N3CCOCC3)cc2)cc1Cl	ZINC000800895543	1310831375	/nfs/dbraw/zinc/83/13/75/1310831375.db2.gz	HHYNOCCZXYQFEX-UHFFFAOYSA-N	0	3	341.842	3.338	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccsc2C(F)(F)F)C1	ZINC001023721099	1319857689	/nfs/dbraw/zinc/85/76/89/1319857689.db2.gz	BBZZGCZPVSVBAS-GFCCVEGCSA-N	0	3	344.402	3.232	20	30		EGEDHN
C#C[C@@H](NCCC(=O)Nc1ccccc1-c1ccccc1)[C@H]1CCCO1	ZINC000839563276	1320938905	/nfs/dbraw/zinc/93/89/05/1320938905.db2.gz	GQLIQZMEHUUJCU-TZIWHRDSSA-N	0	3	348.446	3.453	20	30		EGEDHN
CCc1ccccc1[C@@H]1C[C@H]1C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000802047335	1316976205	/nfs/dbraw/zinc/97/62/05/1316976205.db2.gz	BHHGWSMHLWLLKL-GVDBMIGSSA-N	0	3	333.391	3.095	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)C[C@H]3C=CCCC3)C2)cc1F	ZINC001019029072	1317011925	/nfs/dbraw/zinc/01/19/25/1317011925.db2.gz	LMJAYOHKBHJPIX-YJBOKZPZSA-N	0	3	341.430	3.134	20	30		EGEDHN
N#CC[C@@H](O)CN1CCC(COc2cc(Cl)cc(Cl)c2)CC1	ZINC000929707393	1328674550	/nfs/dbraw/zinc/67/45/50/1328674550.db2.gz	LPSUNALOIHFDAM-OAHLLOKOSA-N	0	3	343.254	3.359	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)c3ccccc3Cl)C2)s1	ZINC001019691175	1317337361	/nfs/dbraw/zinc/33/73/61/1317337361.db2.gz	QCZOFQIUFFNXCM-LBPRGKRZSA-N	0	3	345.855	3.277	20	30		EGEDHN
CCOCc1nc(Cl)cc(N=NC2CCCN3CCCC[C@H]23)n1	ZINC000901314430	1317403572	/nfs/dbraw/zinc/40/35/72/1317403572.db2.gz	SWRZMJUZGWHXLH-CYBMUJFWSA-N	0	3	337.855	3.083	20	30		EGEDHN
N#CC(C(=O)C1CCN(CC(F)F)CC1)c1ccc2ccccc2n1	ZINC000805845523	1317430992	/nfs/dbraw/zinc/43/09/92/1317430992.db2.gz	WVEMXECEHXJMHD-HNNXBMFYSA-N	0	3	343.377	3.388	20	30		EGEDHN
C=C[C@@H](C(=O)N1CC[C@H](NCc2ncccc2C)C1)c1ccccc1	ZINC001019805142	1317432446	/nfs/dbraw/zinc/43/24/46/1317432446.db2.gz	UQAJIDULIDTOPH-RBUKOAKNSA-N	0	3	335.451	3.050	20	30		EGEDHN
Cc1cccc(F)c1C(=O)N1CC[C@H](NCc2ccc(C#N)s2)C1	ZINC001019878306	1317455616	/nfs/dbraw/zinc/45/56/16/1317455616.db2.gz	DCGBTFLQABRIKU-ZDUSSCGKSA-N	0	3	343.427	3.072	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@H](NC(=O)C(F)=C3CCCC3)C2)c(F)c1	ZINC001020071791	1317532980	/nfs/dbraw/zinc/53/29/80/1317532980.db2.gz	USJUNCTWYLVCNK-WKILWMFISA-N	0	3	345.393	3.232	20	30		EGEDHN
CCN(Cc1cccc(F)c1F)CC1CCN(C(=O)[C@H](C)C#N)CC1	ZINC000957692451	1317559840	/nfs/dbraw/zinc/55/98/40/1317559840.db2.gz	TVNIVVPXBLDRMA-CQSZACIVSA-N	0	3	349.425	3.185	20	30		EGEDHN
CC[C@@H](NCc1ccc(N2CCOCC2)nc1)c1cccc(C#N)c1	ZINC000902735669	1317610227	/nfs/dbraw/zinc/61/02/27/1317610227.db2.gz	HSLDFKBAMREBNQ-LJQANCHMSA-N	0	3	336.439	3.031	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC(CN(CC)Cc2cncn2C)CC1	ZINC000957749509	1317616221	/nfs/dbraw/zinc/61/62/21/1317616221.db2.gz	KQAPOLKKLUIBKM-FQEVSTJZSA-N	0	3	346.519	3.083	20	30		EGEDHN
C#C[C@@H](NC(=O)N[C@H](CN1CCCC1)c1ccccc1)C(C)(C)C	ZINC000808213919	1317645388	/nfs/dbraw/zinc/64/53/88/1317645388.db2.gz	SSXYEUJISXECPS-QZTJIDSGSA-N	0	3	327.472	3.171	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc(-n3cccc3)cc2)C1	ZINC001020360824	1317660762	/nfs/dbraw/zinc/66/07/62/1317660762.db2.gz	CYARRKJNGCHFQO-WKILWMFISA-N	0	3	329.831	3.080	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)Cc2ccc(Cl)c(F)c2)C1	ZINC001020629111	1317813338	/nfs/dbraw/zinc/81/33/38/1317813338.db2.gz	CCJXEJRIAWRTPY-HAQNSBGRSA-N	0	3	331.218	3.011	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@]2(c3ccccc3)CC2(C)C)C1	ZINC001020801646	1317935448	/nfs/dbraw/zinc/93/54/48/1317935448.db2.gz	IYKGJTGHGJUHBH-GPMSIDNRSA-N	0	3	332.875	3.344	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2[nH]c3ccc(C)cc3c2C)C1	ZINC001020864004	1317973277	/nfs/dbraw/zinc/97/32/77/1317973277.db2.gz	IKGUTNACRYAWLJ-HDJSIYSDSA-N	0	3	331.847	3.388	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1	ZINC000810268361	1317990660	/nfs/dbraw/zinc/99/06/60/1317990660.db2.gz	QUIUIIOPLKTDLE-QFIPXVFZSA-N	0	3	346.474	3.472	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc(N(CC)CC)cc2)C1	ZINC001020973257	1318024585	/nfs/dbraw/zinc/02/45/85/1318024585.db2.gz	OKHFJHDCYMBVLK-WKILWMFISA-N	0	3	335.879	3.136	20	30		EGEDHN
C#Cc1ccc(C(=O)NC2C[C@H]3CC[C@@H](C2)N3C/C=C\Cl)cc1	ZINC001021342022	1318197414	/nfs/dbraw/zinc/19/74/14/1318197414.db2.gz	HRMJGWDBGCNTQJ-SKRBASTQSA-N	0	3	328.843	3.146	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)s1	ZINC000959959193	1318290239	/nfs/dbraw/zinc/29/02/39/1318290239.db2.gz	ZGJPPXXQQHIPQY-ZDUSSCGKSA-N	0	3	335.448	3.354	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@@H](CCCN3C(=O)CC3CC3)C2)c1	ZINC001021497630	1318305603	/nfs/dbraw/zinc/30/56/03/1318305603.db2.gz	ZIKMQBDLFSKUPO-VQTJNVASSA-N	0	3	337.467	3.171	20	30		EGEDHN
CN(CCCCC1(C#N)CCC1)[C@@H]1CCCC[C@H]1S(C)(=O)=O	ZINC000930000034	1328760880	/nfs/dbraw/zinc/76/08/80/1328760880.db2.gz	LUQCARNVQMIMEG-HZPDHXFCSA-N	0	3	326.506	3.138	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)Cc2c(C)cccc2C)C1	ZINC001021604427	1318449076	/nfs/dbraw/zinc/44/90/76/1318449076.db2.gz	VXOLBPJMEWKJRO-CTNGQTDRSA-N	0	3	338.495	3.182	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@@H]1CCc2cccnc21	ZINC000960300248	1318450857	/nfs/dbraw/zinc/45/08/57/1318450857.db2.gz	NKSNWCIRLQMANA-SFHLNBCPSA-N	0	3	347.462	3.059	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cncc(Cl)c1	ZINC000960317073	1318458022	/nfs/dbraw/zinc/45/80/22/1318458022.db2.gz	MTCSBYRSOZUVDO-QZTJIDSGSA-N	0	3	341.842	3.297	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1coc(CCC)n1	ZINC000960326727	1318463391	/nfs/dbraw/zinc/46/33/91/1318463391.db2.gz	JHAQXWIRHXOLKX-VQIMIIECSA-N	0	3	339.439	3.189	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc(N(C)C)cc1	ZINC000960331274	1318464607	/nfs/dbraw/zinc/46/46/07/1318464607.db2.gz	SCAFWPOELQEALH-NHCUHLMSSA-N	0	3	349.478	3.314	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(C)n(CC)c2C)C1	ZINC001021623951	1318474098	/nfs/dbraw/zinc/47/40/98/1318474098.db2.gz	QLPBXUCYPABYAU-ICSRJNTNSA-N	0	3	341.499	3.075	20	30		EGEDHN
COC[C@H](C)[C@@H](C)C(=O)C(C#N)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000813059720	1318493317	/nfs/dbraw/zinc/49/33/17/1318493317.db2.gz	GTCLSLKCXPJZNW-HOSYDEDBSA-N	0	3	340.782	3.045	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc3ccc(C)cc3[nH]2)C1	ZINC001021637792	1318493916	/nfs/dbraw/zinc/49/39/16/1318493916.db2.gz	AFPVLKMJAZBXBC-XLIONFOSSA-N	0	3	335.451	3.036	20	30		EGEDHN
CC(COC(=O)c1ccccc1Oc1ccccc1C#N)[N+](=O)[O-]	ZINC000813114234	1318502653	/nfs/dbraw/zinc/50/26/53/1318502653.db2.gz	OEARRBVGDZKMHQ-GFCCVEGCSA-N	0	3	326.308	3.173	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)c1ccsc1	ZINC000960412933	1318537314	/nfs/dbraw/zinc/53/73/14/1318537314.db2.gz	ZBEQKMKYIRZXFT-GOSISDBHSA-N	0	3	339.464	3.356	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cccc3[nH]ccc32)C1	ZINC001021673807	1318537631	/nfs/dbraw/zinc/53/76/31/1318537631.db2.gz	MAKMBMCKGXVWQY-OXJNMPFZSA-N	0	3	335.451	3.118	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cccc(OCC)c2)C1	ZINC001021679373	1318549727	/nfs/dbraw/zinc/54/97/27/1318549727.db2.gz	NQVBQJBAMYDXPV-QUCCMNQESA-N	0	3	340.467	3.035	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(C)ccc2F)C1	ZINC001021679524	1318549893	/nfs/dbraw/zinc/54/98/93/1318549893.db2.gz	OVBZOEJVLDIFQN-LPHOPBHVSA-N	0	3	328.431	3.084	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)CCc2cc(C)cc(C)c2)C1	ZINC001021708538	1318583732	/nfs/dbraw/zinc/58/37/32/1318583732.db2.gz	FIXDZINOESYPAU-LEWJYISDSA-N	0	3	338.495	3.182	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)Cc2cccc3ccccc32)C1	ZINC001021716162	1318596071	/nfs/dbraw/zinc/59/60/71/1318596071.db2.gz	CJXOUWLCKYPWMX-IRLDBZIGSA-N	0	3	346.474	3.328	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc3ccccc3n2)C1	ZINC001021720095	1318602965	/nfs/dbraw/zinc/60/29/65/1318602965.db2.gz	VMGCCWINQRCQIG-GHTZIAJQSA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)Cc2c[nH]c3ccccc23)C1	ZINC001021722504	1318610839	/nfs/dbraw/zinc/61/08/39/1318610839.db2.gz	OICMMVQHLVWDCU-DYESRHJHSA-N	0	3	349.478	3.047	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)Cc2ccc(C)c(C)c2)C1	ZINC001021730054	1318632463	/nfs/dbraw/zinc/63/24/63/1318632463.db2.gz	KWJBQPNTHVQZPF-RTWAWAEBSA-N	0	3	338.495	3.182	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2sc(C(C)C)nc2C)C1	ZINC001021733437	1318638342	/nfs/dbraw/zinc/63/83/42/1318638342.db2.gz	MUHNFUXYCIYERH-HZPDHXFCSA-N	0	3	345.512	3.135	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2coc3ccccc23)C1	ZINC001021749666	1318666664	/nfs/dbraw/zinc/66/66/64/1318666664.db2.gz	GVWZNZLKHKKSJR-LPHOPBHVSA-N	0	3	336.435	3.383	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CCC[C@@H]1CN(C)Cc1cccc(C#N)c1	ZINC000960563357	1318693770	/nfs/dbraw/zinc/69/37/70/1318693770.db2.gz	OHFXNKAHXOMXOJ-QGZVFWFLSA-N	0	3	329.419	3.244	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)/C=C\c1ccc[nH]1	ZINC000960581950	1318711875	/nfs/dbraw/zinc/71/18/75/1318711875.db2.gz	QHYYQBIVVXHMJM-JPMGXVIASA-N	0	3	348.450	3.023	20	30		EGEDHN
Cc1cscc1C(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001021946728	1318741769	/nfs/dbraw/zinc/74/17/69/1318741769.db2.gz	ROUYNUVYZGTYDW-GASCZTMLSA-N	0	3	343.427	3.118	20	30		EGEDHN
CN(Cc1ccc(Cl)cc1)C[C@H]1CCCN1C(=O)C#CC1CC1	ZINC000960614065	1318741950	/nfs/dbraw/zinc/74/19/50/1318741950.db2.gz	QGGGVXMKESNSHO-GOSISDBHSA-N	0	3	330.859	3.176	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccc(Cl)cc1C(=O)NCC1CC1	ZINC000912300555	1318862896	/nfs/dbraw/zinc/86/28/96/1318862896.db2.gz	JNPNNCDFUVSJFJ-OAHLLOKOSA-N	0	3	349.862	3.102	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)Nc1cc(C(=O)NC)ccc1C	ZINC000912323602	1318869733	/nfs/dbraw/zinc/86/97/33/1318869733.db2.gz	YNRNCJFNEDNIOI-INIZCTEOSA-N	0	3	333.476	3.371	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N(C)Cc1cccc(Br)c1	ZINC000912343725	1318875424	/nfs/dbraw/zinc/87/54/24/1318875424.db2.gz	SLHZHYMTFGFEEH-AWEZNQCLSA-N	0	3	325.250	3.091	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)[C@]2(C)CCC[C@@H]2CC)C1	ZINC001022285827	1318877828	/nfs/dbraw/zinc/87/78/28/1318877828.db2.gz	MGHKBNKEZKVXTB-TTZDDIAXSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cccc3c(C)c(C)[nH]c32)C1	ZINC001022300276	1318883776	/nfs/dbraw/zinc/88/37/76/1318883776.db2.gz	RNIYDSKBDCOQPM-OKILXGFUSA-N	0	3	331.847	3.388	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)c2ccc(CC)s2)C1	ZINC001022381122	1318915271	/nfs/dbraw/zinc/91/52/71/1318915271.db2.gz	JJMUXYYCVHWXQS-PHIMTYICSA-N	0	3	343.290	3.070	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)C(C)(C)C1CC1	ZINC000960810333	1318926617	/nfs/dbraw/zinc/92/66/17/1318926617.db2.gz	RTFXFRJBHVIKCQ-LJQANCHMSA-N	0	3	339.483	3.417	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)[C@@H]1CCC1(C)C	ZINC000960813567	1318932001	/nfs/dbraw/zinc/93/20/01/1318932001.db2.gz	GMSVHKGVIZPNMA-MOPGFXCFSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@@H]2CC[C@H]2c2ccc(F)cc2)C1	ZINC001022486028	1318960720	/nfs/dbraw/zinc/96/07/20/1318960720.db2.gz	DQJXHUPMIYOJOF-VVLHAWIVSA-N	0	3	336.838	3.309	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@@H]2CN(C)C[C@@H]2CC(C)(C)CO2)CC1	ZINC000960835259	1318964667	/nfs/dbraw/zinc/96/46/67/1318964667.db2.gz	XPGZZCNQNGGEJP-MOPGFXCFSA-N	0	3	348.531	3.471	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2C[C@@H](N[C@H](C)c3ccccc3F)C2)cc1	ZINC001022526318	1318978337	/nfs/dbraw/zinc/97/83/37/1318978337.db2.gz	DOTYIUMELXZBPD-OLMNPRSZSA-N	0	3	336.410	3.419	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)C(C)(C)C(F)F	ZINC000960855365	1318999040	/nfs/dbraw/zinc/99/90/40/1318999040.db2.gz	YIIYCCVVEAXTRN-INIZCTEOSA-N	0	3	349.425	3.272	20	30		EGEDHN
CO[C@@H]1CCC[C@@H](C(=O)C(C#N)C(=O)Nc2ccccc2Cl)C1	ZINC000815907444	1319071813	/nfs/dbraw/zinc/07/18/13/1319071813.db2.gz	ATKOKONCOPEKHQ-UPJWGTAASA-N	0	3	334.803	3.193	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccccc2O[C@H](C)CC)C1	ZINC001022784748	1319110261	/nfs/dbraw/zinc/11/02/61/1319110261.db2.gz	MJGUGFFLIPNPHZ-KFWWJZLASA-N	0	3	336.863	3.467	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N[C@H]1C[C@@H](N[C@H](C)c2ccccc2F)C1	ZINC001022840868	1319133457	/nfs/dbraw/zinc/13/34/57/1319133457.db2.gz	PWRRLKMLQZWJHM-JBFGMIDGSA-N	0	3	346.446	3.105	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)[C@@H]2CCCC[C@@H]2CC)C1	ZINC001022904215	1319155508	/nfs/dbraw/zinc/15/55/08/1319155508.db2.gz	HOFUYXDTYYQADA-BYNSBNAKSA-N	0	3	343.309	3.348	20	30		EGEDHN
CCC(=O)N1CCC[C@H]([C@H]2CCN(Cc3ccc(C#N)c(F)c3)C2)C1	ZINC000961074573	1319186994	/nfs/dbraw/zinc/18/69/94/1319186994.db2.gz	IYMSYWPETFPYMI-ROUUACIJSA-N	0	3	343.446	3.168	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2c[nH]c3c2cccc3CC)C1	ZINC001023131164	1319275621	/nfs/dbraw/zinc/27/56/21/1319275621.db2.gz	YMCHZWYXQGNDFP-OKILXGFUSA-N	0	3	331.847	3.333	20	30		EGEDHN
CC(C)Oc1cccc([C@@H](O)CNCc2ccc(C#N)c(F)c2)c1	ZINC000817407217	1319350374	/nfs/dbraw/zinc/35/03/74/1319350374.db2.gz	FTOWRVUOUFTQSY-IBGZPJMESA-N	0	3	328.387	3.308	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]([C@@H]2CCN(Cc3cnoc3C)C2)C1	ZINC000961229626	1319359471	/nfs/dbraw/zinc/35/94/71/1319359471.db2.gz	NCCJBTIUVPRSMI-DLBZAZTESA-N	0	3	345.487	3.256	20	30		EGEDHN
C[C@H](NCc1ccc(OCC#N)cc1)c1ccc2c(c1)CCC(=O)N2	ZINC000915683744	1319519171	/nfs/dbraw/zinc/51/91/71/1319519171.db2.gz	ZWTXPICGMRDYBF-AWEZNQCLSA-N	0	3	335.407	3.324	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc(C)c3ccccc3n2)C1	ZINC001023446899	1319547223	/nfs/dbraw/zinc/54/72/23/1319547223.db2.gz	AIOQTNYPNFCUPR-KRWDZBQOSA-N	0	3	335.451	3.008	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc(C)n(C(CC)CC)n2)C1	ZINC001023453711	1319556548	/nfs/dbraw/zinc/55/65/48/1319556548.db2.gz	GEOKVBYMYBHQSL-KRWDZBQOSA-N	0	3	344.503	3.018	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1csc(-c2ccccc2Cl)n1	ZINC000818608946	1319568111	/nfs/dbraw/zinc/56/81/11/1319568111.db2.gz	AADVHTQTKXDNRX-UHFFFAOYSA-N	0	3	347.871	3.148	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1sc(C2CCCCC2)nc1C	ZINC000818606415	1319568482	/nfs/dbraw/zinc/56/84/82/1319568482.db2.gz	SKXSKENFYFIENR-UHFFFAOYSA-N	0	3	333.501	3.184	20	30		EGEDHN
CC(C)[C@H](NC[C@@H](O)c1ccc(C#N)cc1)c1nc2ccccc2[nH]1	ZINC000818947680	1319584354	/nfs/dbraw/zinc/58/43/54/1319584354.db2.gz	QOLKNCZOZZIPTG-MOPGFXCFSA-N	0	3	334.423	3.455	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2sccc2-n2cccc2)C1	ZINC001023520311	1319625799	/nfs/dbraw/zinc/62/57/99/1319625799.db2.gz	OLYTWXWHBUDHLR-MRXNPFEDSA-N	0	3	341.480	3.004	20	30		EGEDHN
Cc1cocc1C(=O)NC[C@H]1CCCN(Cc2ccc(C#N)cc2)C1	ZINC001023534465	1319638689	/nfs/dbraw/zinc/63/86/89/1319638689.db2.gz	RBZNYONZGDGRJK-GOSISDBHSA-N	0	3	337.423	3.102	20	30		EGEDHN
N#Cc1ccc(F)c(CNCC2CC(NC(=O)[C@H]3CC=CCC3)C2)c1	ZINC000961544638	1319644948	/nfs/dbraw/zinc/64/49/48/1319644948.db2.gz	IOHPKQAFHGEYHP-PQUAAJSLSA-N	0	3	341.430	3.038	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2[C@H]3CN(Cc4ccc(CF)cc4)C[C@H]32)C1	ZINC000961690805	1319701435	/nfs/dbraw/zinc/70/14/35/1319701435.db2.gz	NXHTUOJRECGLEK-PIIMJCKOSA-N	0	3	328.431	3.059	20	30		EGEDHN
Cc1nccc([C@@H]2CCCN(CCCOc3ccc(C#N)cc3)C2)n1	ZINC000916741919	1319703094	/nfs/dbraw/zinc/70/30/94/1319703094.db2.gz	MMNYVOVCAFQSJR-GOSISDBHSA-N	0	3	336.439	3.305	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)[C@H](C)Oc2ccccc2F)c1	ZINC000916897782	1319721520	/nfs/dbraw/zinc/72/15/20/1319721520.db2.gz	SUYLLOYMGLVMLQ-ZFWWWQNUSA-N	0	3	340.354	3.249	20	30		EGEDHN
CC(C(=O)NC1CC(CNCc2cc(C#N)ccc2F)C1)=C1CCC1	ZINC000961825267	1319742906	/nfs/dbraw/zinc/74/29/06/1319742906.db2.gz	UAHMQZBXFHFUSQ-UHFFFAOYSA-N	0	3	341.430	3.182	20	30		EGEDHN
C=CCn1c(COc2ccccc2)nnc1SC[C@H]1CCCN1C	ZINC000917241859	1319774378	/nfs/dbraw/zinc/77/43/78/1319774378.db2.gz	GLZJEHXGDZWGLC-OAHLLOKOSA-N	0	3	344.484	3.229	20	30		EGEDHN
CC1(C)CCC[C@H]1C(=O)NC1CC(CNCc2ccccc2C#N)C1	ZINC000962188025	1319851663	/nfs/dbraw/zinc/85/16/63/1319851663.db2.gz	MHMCKQZVHZLHCU-PPSBMQLTSA-N	0	3	339.483	3.369	20	30		EGEDHN
C#CCN1CCC[C@@H](CNC(=O)c2ccc(-c3ccccc3)cc2)C1	ZINC001023727299	1319864767	/nfs/dbraw/zinc/86/47/67/1319864767.db2.gz	FMYPKZCUQGVVJS-SFHVURJKSA-N	0	3	332.447	3.429	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccsc2C(F)F)C1	ZINC001023727995	1319865913	/nfs/dbraw/zinc/86/59/13/1319865913.db2.gz	XKYDAXJPNIKOEQ-LBPRGKRZSA-N	0	3	326.412	3.151	20	30		EGEDHN
C=C1CCC(C(=O)NC2CC(CNCc3oc(CC)nc3C)C2)CC1	ZINC000962264157	1319888732	/nfs/dbraw/zinc/88/87/32/1319888732.db2.gz	BHVSZEUNZWRHEN-UHFFFAOYSA-N	0	3	345.487	3.276	20	30		EGEDHN
C=CCN(C(=O)NC[C@@H](CC)N1CCc2ccccc2C1)C(C)C	ZINC000918065978	1319912486	/nfs/dbraw/zinc/91/24/86/1319912486.db2.gz	WWIWWSIAOILLCJ-LJQANCHMSA-N	0	3	329.488	3.429	20	30		EGEDHN
C#C[C@@H](NC(=O)N(CCN(C)C)Cc1cccs1)c1ccccc1	ZINC000820599513	1319919545	/nfs/dbraw/zinc/91/95/45/1319919545.db2.gz	NIVMTWDEDWHHBJ-GOSISDBHSA-N	0	3	341.480	3.196	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)C2CC(c3cccc(F)c3)C2)C1	ZINC001023774329	1319923821	/nfs/dbraw/zinc/92/38/21/1319923821.db2.gz	GUKOKLOUQOVXJC-IVMQYODDSA-N	0	3	342.458	3.171	20	30		EGEDHN
CC[C@H](C#N)Oc1cc(CNCc2ccncc2C)ccc1OC	ZINC000823847300	1320211275	/nfs/dbraw/zinc/21/12/75/1320211275.db2.gz	KVQMJCQFXBTCLD-QGZVFWFLSA-N	0	3	325.412	3.369	20	30		EGEDHN
C#Cc1cccc(CNCc2cc(OC)c(OCC)c(OC)c2)c1	ZINC000825226117	1320319668	/nfs/dbraw/zinc/31/96/68/1320319668.db2.gz	DGMNXURCCOSOPZ-UHFFFAOYSA-N	0	3	325.408	3.374	20	30		EGEDHN
C=C(C)CN1CCC([NH2+]Cc2ccc(Br)cc2[O-])CC1	ZINC000825222599	1320319998	/nfs/dbraw/zinc/31/99/98/1320319998.db2.gz	KMAYANYRKKAJJX-UHFFFAOYSA-N	0	3	339.277	3.285	20	30		EGEDHN
C#CCOc1ccc(CNC(=O)c2cccc(CN3CCCC3)c2)cc1	ZINC000836869401	1320544453	/nfs/dbraw/zinc/54/44/53/1320544453.db2.gz	UYSTUCHGNWSQTR-UHFFFAOYSA-N	0	3	348.446	3.224	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1ccc(-c2csc(C)n2)cc1	ZINC000838624061	1320796308	/nfs/dbraw/zinc/79/63/08/1320796308.db2.gz	FDECAARPUFOACR-UHFFFAOYSA-N	0	3	342.468	3.195	20	30		EGEDHN
Cc1ccc([C@H](C)N[C@@H]2CCN(c3sccc3C#N)C2=O)s1	ZINC000839553420	1320936446	/nfs/dbraw/zinc/93/64/46/1320936446.db2.gz	QBICDBCQGSCCHW-WCQYABFASA-N	0	3	331.466	3.446	20	30		EGEDHN
COc1ccc(CN(C)C[C@H](O)c2ccc(C#N)cc2)cc1Cl	ZINC000839660087	1320953543	/nfs/dbraw/zinc/95/35/43/1320953543.db2.gz	BJBMTOODQPMFKS-KRWDZBQOSA-N	0	3	330.815	3.386	20	30		EGEDHN
C[C@H](NCC(C)(C)CC#N)c1ccc(S(=O)(=O)C(F)F)cc1	ZINC000840786512	1321148242	/nfs/dbraw/zinc/14/82/42/1321148242.db2.gz	QUORTOXXIYOOIX-NSHDSACASA-N	0	3	330.400	3.273	20	30		EGEDHN
C#Cc1ccc(CN[C@H](c2ccccc2)C2(CO)CCOCC2)cc1	ZINC000840972268	1321191309	/nfs/dbraw/zinc/19/13/09/1321191309.db2.gz	IUQCCSMTCCRBPJ-OAQYLSRUSA-N	0	3	335.447	3.288	20	30		EGEDHN
C#Cc1cccc(N(C)C(=O)C(C[C@@H]2CCCO2)C(F)(F)F)c1	ZINC000844375922	1321595850	/nfs/dbraw/zinc/59/58/50/1321595850.db2.gz	NVBUFEJUVWJZGS-LSDHHAIUSA-N	0	3	325.330	3.378	20	30		EGEDHN
C#CCOc1cccc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)c1	ZINC000844380182	1321596469	/nfs/dbraw/zinc/59/64/69/1321596469.db2.gz	YPBCIJGJTLCMTQ-CABCVRRESA-N	0	3	341.329	3.385	20	30		EGEDHN
C#CCOc1ccccc1NC(=O)C(C[C@H]1CCCO1)C(F)(F)F	ZINC000845956829	1321758609	/nfs/dbraw/zinc/75/86/09/1321758609.db2.gz	JMTPDHBTNSHOGI-CHWSQXEVSA-N	0	3	341.329	3.385	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@H]1CCCc2ccc(OC)cc21	ZINC000847622343	1321885145	/nfs/dbraw/zinc/88/51/45/1321885145.db2.gz	IIXWGSVSQCHIQO-WMZOPIPTSA-N	0	3	342.439	3.130	20	30		EGEDHN
N#Cc1ccc(C(=O)OCC2(C#N)CCN(Cc3ccccc3)CC2)o1	ZINC000847747187	1321900851	/nfs/dbraw/zinc/90/08/51/1321900851.db2.gz	YRNSSJJMLUKYBZ-UHFFFAOYSA-N	0	3	349.390	3.114	20	30		EGEDHN
N#CCSc1ccccc1C(=O)N[C@@H]1CCCN2CCCC[C@H]12	ZINC000848349453	1321953722	/nfs/dbraw/zinc/95/37/22/1321953722.db2.gz	IDHJGVLTJXUSNK-HZPDHXFCSA-N	0	3	329.469	3.049	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CNC[C@H](OC2CCCC2)C(F)(F)F)cc1	ZINC000849328780	1322112948	/nfs/dbraw/zinc/11/29/48/1322112948.db2.gz	QRBHLOFNSMGWLP-HOTGVXAUSA-N	0	3	342.361	3.071	20	30		EGEDHN
Cc1cc(C)n(CCCNCc2cc(C#N)ccc2Br)n1	ZINC000921486296	1322327862	/nfs/dbraw/zinc/32/78/62/1322327862.db2.gz	HVELILDXVGPKBC-UHFFFAOYSA-N	0	3	347.260	3.314	20	30		EGEDHN
C[C@@H](O)CC(C)(C)CNCc1cc(C#N)ccc1Br	ZINC000921777870	1322397238	/nfs/dbraw/zinc/39/72/38/1322397238.db2.gz	ZAZZZVUCDSPOSD-LLVKDONJSA-N	0	3	325.250	3.207	20	30		EGEDHN
C[C@H](CC(C)(C)C#N)OC(=O)C1CCN(c2ccc(F)cc2)C1=O	ZINC000851210935	1323001456	/nfs/dbraw/zinc/00/14/56/1323001456.db2.gz	WEXMKPQXJZUHGV-DOMZBBRYSA-N	0	3	332.375	3.050	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N1CCC[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001023942339	1323044792	/nfs/dbraw/zinc/04/47/92/1323044792.db2.gz	YKJAKKDWICAPFV-KSSFIOAISA-N	0	3	343.446	3.072	20	30		EGEDHN
CC1(C(=O)N2CCC[C@H](CNCc3ccccc3C#N)C2)CCCC1	ZINC001024083749	1323119223	/nfs/dbraw/zinc/11/92/23/1323119223.db2.gz	WWVPOWJLGNKWQT-QGZVFWFLSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H](CNCc2csc(C)n2)C1	ZINC001024090664	1323122844	/nfs/dbraw/zinc/12/28/44/1323122844.db2.gz	NVLWEWMLDJYANV-OAHLLOKOSA-N	0	3	335.517	3.382	20	30		EGEDHN
Cc1coc(C(=O)N2CCC[C@@H](CNCc3ccccc3C#N)C2)c1	ZINC001024111056	1323143290	/nfs/dbraw/zinc/14/32/90/1323143290.db2.gz	FKQFGLVJWMKXSQ-INIZCTEOSA-N	0	3	337.423	3.102	20	30		EGEDHN
C#C[C@@](C)(CC)NCC(=O)N[C@H](c1cccs1)c1ccc(F)cc1	ZINC000852097113	1323145672	/nfs/dbraw/zinc/14/56/72/1323145672.db2.gz	LSFBJFIOSJFVSJ-OALUTQOASA-N	0	3	344.455	3.484	20	30		EGEDHN
CC(C)(C)OC(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1	ZINC000924977915	1323234501	/nfs/dbraw/zinc/23/45/01/1323234501.db2.gz	CZQVZZBVTIDWPW-UHFFFAOYSA-N	0	3	333.407	3.090	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)c2cscn2)C1	ZINC000963262056	1323276735	/nfs/dbraw/zinc/27/67/35/1323276735.db2.gz	DGIQLOJFAVEBQG-DZGCQCFKSA-N	0	3	339.892	3.212	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@H]1CCCN1c1ccccc1	ZINC001024471715	1323426186	/nfs/dbraw/zinc/42/61/86/1323426186.db2.gz	KMJHJBNMIJLCHP-VQTJNVASSA-N	0	3	341.499	3.202	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccc2cc(C)cn2c1	ZINC001024475148	1323428247	/nfs/dbraw/zinc/42/82/47/1323428247.db2.gz	GEZGQRXXLNYEHU-LJQANCHMSA-N	0	3	325.456	3.408	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@@H]2CCCCN2CCCF)cc1	ZINC001024511718	1323461466	/nfs/dbraw/zinc/46/14/66/1323461466.db2.gz	KTTFZQKFPWMIQF-KRWDZBQOSA-N	0	3	334.435	3.195	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cccc2c1O[C@@H](C)C2	ZINC001024561813	1323501400	/nfs/dbraw/zinc/50/14/00/1323501400.db2.gz	YYCYKVLHJGSUPR-DOTOQJQBSA-N	0	3	328.456	3.170	20	30		EGEDHN
C=CCCN1CCCC[C@@H]1CNC(=O)c1cc2ncccc2s1	ZINC001024587264	1323523463	/nfs/dbraw/zinc/52/34/63/1323523463.db2.gz	FPYCDHKMKOHQCC-CQSZACIVSA-N	0	3	329.469	3.457	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1cc2c(ccc(C)c2C)[nH]1	ZINC001024593695	1323526364	/nfs/dbraw/zinc/52/63/64/1323526364.db2.gz	QBMMEQDBCKZOLA-KRWDZBQOSA-N	0	3	337.467	3.392	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1cnn(C(CC)CC)c1C	ZINC001024750330	1323653585	/nfs/dbraw/zinc/65/35/85/1323653585.db2.gz	PLXATZJTMSILJI-GOSISDBHSA-N	0	3	344.503	3.160	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1cc(F)c(F)cc1Cl	ZINC001024788106	1323692166	/nfs/dbraw/zinc/69/21/66/1323692166.db2.gz	FDOBBWWKTDHSAO-GFCCVEGCSA-N	0	3	340.801	3.226	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccc(OCC)c(OC)c1	ZINC001024795447	1323700475	/nfs/dbraw/zinc/70/04/75/1323700475.db2.gz	ILJISSUGUVHGHW-KRWDZBQOSA-N	0	3	346.471	3.254	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cc(Cl)cc2c1OCC2	ZINC001024817120	1323719202	/nfs/dbraw/zinc/71/92/02/1323719202.db2.gz	ULEPIGYUTNVGSU-MRXNPFEDSA-N	0	3	348.874	3.435	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1c[nH]c2ccc(F)cc12	ZINC001024824154	1323727137	/nfs/dbraw/zinc/72/71/37/1323727137.db2.gz	CPXLAPZTOCNFOY-HNNXBMFYSA-N	0	3	329.419	3.467	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)c2cccs2)s1	ZINC001024854517	1323748307	/nfs/dbraw/zinc/74/83/07/1323748307.db2.gz	PXDIZKTVHYQCDF-CYBMUJFWSA-N	0	3	345.493	3.466	20	30		EGEDHN
C=C1CCC(C(=O)N2CCCC[C@@H]2CNCc2cncc(F)c2)CC1	ZINC001025068438	1323869282	/nfs/dbraw/zinc/86/92/82/1323869282.db2.gz	LEYXVADMSSNGFV-LJQANCHMSA-N	0	3	345.462	3.438	20	30		EGEDHN
CC(C)(C)C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001025145420	1323920848	/nfs/dbraw/zinc/92/08/48/1323920848.db2.gz	JGACEYPTIUZDDY-MRXNPFEDSA-N	0	3	331.435	3.214	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccoc1CC	ZINC001025229010	1324015381	/nfs/dbraw/zinc/01/53/81/1324015381.db2.gz	FMVFVEMTDIZCBQ-ZWKOTPCHSA-N	0	3	328.456	3.324	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc[nH]c1CC	ZINC001025230182	1324017258	/nfs/dbraw/zinc/01/72/58/1324017258.db2.gz	VIWPCLHZKRSONK-RBUKOAKNSA-N	0	3	327.472	3.060	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1csc(C)c1C	ZINC001025236442	1324025741	/nfs/dbraw/zinc/02/57/41/1324025741.db2.gz	USUBELMFHHAVRJ-ROUUACIJSA-N	0	3	330.497	3.457	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc(C(F)F)nc1	ZINC001025238660	1324029940	/nfs/dbraw/zinc/02/99/40/1324029940.db2.gz	ULFHKSXSODCXFO-DLBZAZTESA-N	0	3	347.409	3.112	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1[nH]c(C)cc1C	ZINC001025244050	1324039704	/nfs/dbraw/zinc/03/97/04/1324039704.db2.gz	GKZGPTKXFDPAGT-ZWKOTPCHSA-N	0	3	327.472	3.114	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(C)n(CC)c1C	ZINC001025247740	1324046710	/nfs/dbraw/zinc/04/67/10/1324046710.db2.gz	PNEOCXGYYXBBGW-UXHICEINSA-N	0	3	341.499	3.217	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(C)n(CC)c1C	ZINC001025247742	1324047433	/nfs/dbraw/zinc/04/74/33/1324047433.db2.gz	PNEOCXGYYXBBGW-WOJBJXKFSA-N	0	3	341.499	3.217	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(F)ccc1CC	ZINC001025247849	1324048803	/nfs/dbraw/zinc/04/88/03/1324048803.db2.gz	RHLUSZAEWIRDHZ-VQTJNVASSA-N	0	3	342.458	3.480	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cccnc1C(F)F	ZINC001025252810	1324058365	/nfs/dbraw/zinc/05/83/65/1324058365.db2.gz	ZJSKHAIWDJVYQI-HZPDHXFCSA-N	0	3	347.409	3.112	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)CCc1cccc(C)c1	ZINC001025254919	1324061020	/nfs/dbraw/zinc/06/10/20/1324061020.db2.gz	NFDKFZMAJLUWQM-LEWJYISDSA-N	0	3	338.495	3.406	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(OC)cs1	ZINC001025258412	1324066307	/nfs/dbraw/zinc/06/63/07/1324066307.db2.gz	JWWIDASLVLMWKS-HZPDHXFCSA-N	0	3	334.485	3.402	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccn(C(C)C)c1C	ZINC001025263656	1324074900	/nfs/dbraw/zinc/07/49/00/1324074900.db2.gz	PEDXUCYRBKCQDH-PMACEKPBSA-N	0	3	341.499	3.470	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc[nH]c1C1CCC1	ZINC001025269576	1324083862	/nfs/dbraw/zinc/08/38/62/1324083862.db2.gz	TUCUBOXIOBKLQS-RBUKOAKNSA-N	0	3	339.483	3.375	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccncc1Cl	ZINC001025270969	1324085857	/nfs/dbraw/zinc/08/58/57/1324085857.db2.gz	FOMNDGPJUANPCK-DLBZAZTESA-N	0	3	333.863	3.380	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc2ccccn2c1	ZINC001025275221	1324095046	/nfs/dbraw/zinc/09/50/46/1324095046.db2.gz	UUHXSAJVKOOQEU-WOJBJXKFSA-N	0	3	335.451	3.032	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1nc(CC)oc1C	ZINC001025278487	1324099870	/nfs/dbraw/zinc/09/98/70/1324099870.db2.gz	SWOOFSYLLGLSHF-SJORKVTESA-N	0	3	343.471	3.028	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(CCC)on1	ZINC001025283875	1324104263	/nfs/dbraw/zinc/10/42/63/1324104263.db2.gz	BYIYENYOMUDZEA-QZTJIDSGSA-N	0	3	331.460	3.272	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)Cc1ccccc1F	ZINC001025294787	1324124454	/nfs/dbraw/zinc/12/44/54/1324124454.db2.gz	CRVMGYOTAGYFHX-UXHICEINSA-N	0	3	342.458	3.237	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)Cc1ccc(C)s1	ZINC001025301464	1324135641	/nfs/dbraw/zinc/13/56/41/1324135641.db2.gz	KEUMCQKAJATLAI-MSOLQXFVSA-N	0	3	330.497	3.078	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1ccc(-c2ccncc2)c(C)c1	ZINC000931522171	1329135054	/nfs/dbraw/zinc/13/50/54/1329135054.db2.gz	NPWWVWTWLBRPJG-UHFFFAOYSA-N	0	3	336.439	3.134	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cscc2C(F)F)C1	ZINC001025424557	1324257481	/nfs/dbraw/zinc/25/74/81/1324257481.db2.gz	FMBURRXROIXCKZ-NWDGAFQWSA-N	0	3	326.412	3.149	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cccc3c2CCCC3)C1	ZINC001025425951	1324260457	/nfs/dbraw/zinc/26/04/57/1324260457.db2.gz	TWSKWACAHYRMHG-MJGOQNOKSA-N	0	3	338.495	3.419	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc3nccc(C)c3c2)C1	ZINC001025429045	1324263669	/nfs/dbraw/zinc/26/36/69/1324263669.db2.gz	QXNJFZATEMXTAK-AEFFLSMTSA-N	0	3	335.451	3.007	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc3nccc(C)c3c2)C1	ZINC001025429047	1324263718	/nfs/dbraw/zinc/26/37/18/1324263718.db2.gz	QXNJFZATEMXTAK-SJLPKXTDSA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cccc(OCCC)c2)C1	ZINC001025430492	1324265381	/nfs/dbraw/zinc/26/53/81/1324265381.db2.gz	FKDPJENHLJCQID-MJGOQNOKSA-N	0	3	342.483	3.329	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cncc(-c3ccccc3)c2)C1	ZINC001025432956	1324271651	/nfs/dbraw/zinc/27/16/51/1324271651.db2.gz	KVVDATNTAJKVDH-HKUYNNGSSA-N	0	3	347.462	3.212	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc3ccncc3s2)C1	ZINC001025438867	1324277610	/nfs/dbraw/zinc/27/76/10/1324277610.db2.gz	JARWVFUDFNGQDT-GDBMZVCRSA-N	0	3	341.480	3.150	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc3ccncc3s2)C1	ZINC001025438871	1324277640	/nfs/dbraw/zinc/27/76/40/1324277640.db2.gz	JARWVFUDFNGQDT-ZBFHGGJFSA-N	0	3	341.480	3.150	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(C(C)C)nc2)C1	ZINC001025443763	1324285203	/nfs/dbraw/zinc/28/52/03/1324285203.db2.gz	UHXDXEGKMQHHMG-AEFFLSMTSA-N	0	3	327.472	3.059	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cccc3ccc(C)nc32)C1	ZINC001025458077	1324298919	/nfs/dbraw/zinc/29/89/19/1324298919.db2.gz	YBKQZEZIVQUFPR-PKOBYXMFSA-N	0	3	349.478	3.397	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(F)ccc2CC)C1	ZINC001025471975	1324317205	/nfs/dbraw/zinc/31/72/05/1324317205.db2.gz	LNVHFPIGRCVBBA-DOTOQJQBSA-N	0	3	330.447	3.242	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2sc(C)nc2CC(C)C)C1	ZINC001025472212	1324317477	/nfs/dbraw/zinc/31/74/77/1324317477.db2.gz	OKNMXYFSIFRORZ-GDBMZVCRSA-N	0	3	347.528	3.114	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cnc3ccccc3c2C)C1	ZINC001025488271	1324339436	/nfs/dbraw/zinc/33/94/36/1324339436.db2.gz	JVIMZPJEKUZXNB-MSOLQXFVSA-N	0	3	349.478	3.397	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc3cc(F)ccc3[nH]2)C1	ZINC001025503258	1324352294	/nfs/dbraw/zinc/35/22/94/1324352294.db2.gz	PSAZZPNSCPHZJI-LSDHHAIUSA-N	0	3	341.430	3.161	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cnc3ccsc3c2)C1	ZINC001025503870	1324353353	/nfs/dbraw/zinc/35/33/53/1324353353.db2.gz	VWBVGQTUNZWVEJ-HUUCEWRRSA-N	0	3	341.480	3.150	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cccc(Cl)c2F)C1	ZINC001025519048	1324363100	/nfs/dbraw/zinc/36/31/00/1324363100.db2.gz	JLBMBCJSZHOXRX-KGLIPLIRSA-N	0	3	336.838	3.333	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(C3CC3)nc2C)C1	ZINC001025533484	1324379615	/nfs/dbraw/zinc/37/96/15/1324379615.db2.gz	FDKLNTRGVUBBGH-QAPCUYQASA-N	0	3	339.483	3.121	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2oc(CC(C)C)nc2C)C1	ZINC001025555260	1324403838	/nfs/dbraw/zinc/40/38/38/1324403838.db2.gz	LCPFYBCXIXKQDN-RDJZCZTQSA-N	0	3	345.487	3.035	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc3cccnc3c2)C1	ZINC001025563501	1324410717	/nfs/dbraw/zinc/41/07/17/1324410717.db2.gz	CTIBEHWDCDAUHL-APWZRJJASA-N	0	3	335.451	3.088	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(-c3ccccc3)nc2)C1	ZINC001025577839	1324418088	/nfs/dbraw/zinc/41/80/88/1324418088.db2.gz	VANRCYQMKGGSGB-PXNSSMCTSA-N	0	3	347.462	3.212	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(-c3ccccc3)ccn2)C1	ZINC001025579887	1324419729	/nfs/dbraw/zinc/41/97/29/1324419729.db2.gz	PPZDNJYJJTVTMK-XLIONFOSSA-N	0	3	347.462	3.212	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(C)c(C)c2Cl)C1	ZINC001025592628	1324440367	/nfs/dbraw/zinc/44/03/67/1324440367.db2.gz	QLMLDFJIWBPSMJ-JKSUJKDBSA-N	0	3	332.875	3.420	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cccc(Cl)c2Cl)C1	ZINC001025606866	1324456654	/nfs/dbraw/zinc/45/66/54/1324456654.db2.gz	GVUZWGFBAUHXPA-CHWSQXEVSA-N	0	3	339.266	3.457	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(OC(C)C)cc2)C1	ZINC001025614717	1324468426	/nfs/dbraw/zinc/46/84/26/1324468426.db2.gz	OIEKNQHVPFRBLI-HKUYNNGSSA-N	0	3	342.483	3.327	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(C)c(F)c(C)c2)C1	ZINC001025629107	1324480355	/nfs/dbraw/zinc/48/03/55/1324480355.db2.gz	ZZKBOGPCTVKSII-SJORKVTESA-N	0	3	330.447	3.296	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(C(F)(F)F)s2)C1	ZINC001025635561	1324487605	/nfs/dbraw/zinc/48/76/05/1324487605.db2.gz	RWPTUJYGFYRIED-VXGBXAGGSA-N	0	3	344.402	3.230	20	30		EGEDHN
Cc1coc(C(=O)N2C[C@@H]3CC[C@H](NCc4ccccc4C#N)[C@H]3C2)c1	ZINC001026334639	1324734799	/nfs/dbraw/zinc/73/47/99/1324734799.db2.gz	LSNYPDMHBMKTPK-FHWLQOOXSA-N	0	3	349.434	3.100	20	30		EGEDHN
N#Cc1ccccc1CNC1CCC(NC(=O)C2CCCC2)CC1	ZINC001026439142	1324801801	/nfs/dbraw/zinc/80/18/01/1324801801.db2.gz	DBIPKSFPWLHTTB-UHFFFAOYSA-N	0	3	325.456	3.265	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)C2(C)CCC2)CC1	ZINC001026541927	1324878785	/nfs/dbraw/zinc/87/87/85/1324878785.db2.gz	TYAACBMMSJFKIM-UHFFFAOYSA-N	0	3	329.282	3.102	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@H]1CCN(C(=O)C2CCCCC2)C1	ZINC001026653496	1324952561	/nfs/dbraw/zinc/95/25/61/1324952561.db2.gz	MFPZYJGYCAYQTE-OAHLLOKOSA-N	0	3	343.446	3.216	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](CNCc2nsc3ccccc23)C1	ZINC001026992981	1325131202	/nfs/dbraw/zinc/13/12/02/1325131202.db2.gz	WYKHDVGJZXNVAD-CQSZACIVSA-N	0	3	343.496	3.447	20	30		EGEDHN
CC(C)N1CCCC[C@@H]1CN1C(=O)CS/C1=C\C(=O)C(C)(C)C	ZINC000853641223	1325138295	/nfs/dbraw/zinc/13/82/95/1325138295.db2.gz	HYUPEAUXIZQRHT-AYCSXLNKSA-N	0	3	338.517	3.281	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)C2CC3(CCC3)C2)C1	ZINC001027008646	1325147165	/nfs/dbraw/zinc/14/71/65/1325147165.db2.gz	QICBEVFWUJVFCT-INIZCTEOSA-N	0	3	337.467	3.077	20	30		EGEDHN
Cc1cccc(CC(=O)N2CC[C@H](CNCc3ccccc3C#N)C2)c1	ZINC001027031161	1325165530	/nfs/dbraw/zinc/16/55/30/1325165530.db2.gz	DVUMDPKCUZNFSY-LJQANCHMSA-N	0	3	347.462	3.048	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](CNCc3cc(C4CC4)no3)C2)CC1	ZINC001027041233	1325177318	/nfs/dbraw/zinc/17/73/18/1325177318.db2.gz	SAHLYEYYGMRPAV-HNNXBMFYSA-N	0	3	343.471	3.237	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)/C=C\c2ccco2)C1	ZINC001027276323	1325390417	/nfs/dbraw/zinc/39/04/17/1325390417.db2.gz	HHPACHMUUWEZGO-VJIACCKLSA-N	0	3	349.434	3.287	20	30		EGEDHN
Cc1ccc(C(=O)N2CCC[C@@H](N(C)Cc3ccc(C#N)cc3)C2)o1	ZINC001027286179	1325415183	/nfs/dbraw/zinc/41/51/83/1325415183.db2.gz	ONQKLLCUWJVNPX-GOSISDBHSA-N	0	3	337.423	3.196	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)C2(F)CCCC2)C1	ZINC001027469257	1327725635	/nfs/dbraw/zinc/72/56/35/1327725635.db2.gz	BCCVYMYYFZCBBJ-GOSISDBHSA-N	0	3	343.446	3.263	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CCC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001027604537	1327961910	/nfs/dbraw/zinc/96/19/10/1327961910.db2.gz	RJCILPZOGJHTGT-VQIMIIECSA-N	0	3	327.472	3.273	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)[C@@H](CC)Cc2ccccc2C)C1	ZINC001027650077	1328030495	/nfs/dbraw/zinc/03/04/95/1328030495.db2.gz	AKTNTOGKXOOZAS-AZUAARDMSA-N	0	3	326.484	3.120	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)CC(C)(C)c2ccc(C)cc2)C1	ZINC001027673777	1328070355	/nfs/dbraw/zinc/07/03/55/1328070355.db2.gz	MKIXCUPKKDINEL-IBGZPJMESA-N	0	3	326.484	3.219	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1cc(C)n(C)c1C)C2	ZINC000965907883	1328095794	/nfs/dbraw/zinc/09/57/94/1328095794.db2.gz	SYLFWQLUXNMOCB-UHFFFAOYSA-N	0	3	335.879	3.025	20	30		EGEDHN
C#CCCN1CCC[C@@H]1CNC(=O)c1ccc(OC)c(C(C)C)c1	ZINC001028003420	1328465423	/nfs/dbraw/zinc/46/54/23/1328465423.db2.gz	NPHUYNGTBRVLJM-QGZVFWFLSA-N	0	3	328.456	3.036	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)Cc2ccc(C)c(Cl)c2)C1	ZINC000966907886	1328468578	/nfs/dbraw/zinc/46/85/78/1328468578.db2.gz	HPVSDLBSYBRKIQ-YJBOKZPZSA-N	0	3	332.875	3.041	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1ccc(N(C)C)cc1	ZINC001028043705	1328509812	/nfs/dbraw/zinc/50/98/12/1328509812.db2.gz	VPWDNVICRZPWIU-HSALFYBXSA-N	0	3	341.499	3.013	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)[C@@H](C)N[C@H](C)COCC1CCCCC1	ZINC000932426810	1329813965	/nfs/dbraw/zinc/81/39/65/1329813965.db2.gz	NGNGVWONGQNPLJ-GPMSIDNRSA-N	0	3	337.508	3.004	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](C)[C@H](NCc3ccc(F)c(F)c3)C2)C1	ZINC000939103659	1330377490	/nfs/dbraw/zinc/37/74/90/1330377490.db2.gz	WUQSQZUFZUXKRH-CXAGYDPISA-N	0	3	334.410	3.258	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2oc3c(cccc3F)c2C)[C@@H](C)C1	ZINC000942124536	1331839492	/nfs/dbraw/zinc/83/94/92/1331839492.db2.gz	ZAHHVRMORQKDTK-GUYCJALGSA-N	0	3	342.414	3.344	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CCN(CCC(F)(F)F)C[C@H]1C	ZINC000942128708	1331841271	/nfs/dbraw/zinc/84/12/71/1331841271.db2.gz	GUWDWDXYMFHZRD-KGLIPLIRSA-N	0	3	343.393	3.067	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccccc2C(C)(C)CC)[C@H](C)C1	ZINC000942163875	1331855566	/nfs/dbraw/zinc/85/55/66/1331855566.db2.gz	PAJNWSZXKFMPNY-VQIMIIECSA-N	0	3	326.484	3.448	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(F)cc3ccoc32)[C@H](C)C1	ZINC000942199782	1331875199	/nfs/dbraw/zinc/87/51/99/1331875199.db2.gz	HMUXMXSKNGOJCX-DYVFJYSZSA-N	0	3	328.387	3.035	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2coc3cc(F)ccc23)[C@H](C)C1	ZINC000942203917	1331877569	/nfs/dbraw/zinc/87/75/69/1331877569.db2.gz	LOENZKNGRDWEJN-CXAGYDPISA-N	0	3	328.387	3.035	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2[nH]c3ccccc3c2Cl)[C@H](C)C1	ZINC000942260253	1331891145	/nfs/dbraw/zinc/89/11/45/1331891145.db2.gz	XYHZMWLVNKTGDL-HIFRSBDPSA-N	0	3	343.858	3.285	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2cccc(C(C)C)c2)[C@@H](C)C1	ZINC000942270867	1331892579	/nfs/dbraw/zinc/89/25/79/1331892579.db2.gz	GRBNLZUDYXTZGJ-FXAWDEMLSA-N	0	3	326.484	3.202	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(CC(C)C)cc2)[C@H](C)C1	ZINC000942346077	1331908713	/nfs/dbraw/zinc/90/87/13/1331908713.db2.gz	XANJXAALBLXWQL-NQIIRXRSSA-N	0	3	340.511	3.278	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(CCCC)cc2)[C@@H](C)C1	ZINC000942391020	1331921094	/nfs/dbraw/zinc/92/10/94/1331921094.db2.gz	DOGUJNSSSYZMOX-PXNSSMCTSA-N	0	3	326.484	3.493	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc(C3CCC3)cc2)[C@H](C)C1	ZINC000942535589	1331961719	/nfs/dbraw/zinc/96/17/19/1331961719.db2.gz	LHXVVSQOHZBVPS-DYESRHJHSA-N	0	3	338.495	3.347	20	30		EGEDHN
C[C@H]1CN(Cc2cccc(C#N)c2)CC[C@@H]1NC(=O)C1(C)CCCC1	ZINC000942540209	1331964720	/nfs/dbraw/zinc/96/47/20/1331964720.db2.gz	HWGLMLXJVCVEQY-LPHOPBHVSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@H]1CN(Cc2ccc(C#N)cc2)CC[C@H]1NC(=O)C1(C)CCCC1	ZINC000942540068	1331964802	/nfs/dbraw/zinc/96/48/02/1331964802.db2.gz	GRHSBTFIAUOPEW-QFBILLFUSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@H]1CN(Cc2cccc(C#N)c2)CC[C@@H]1NC(=O)C1(C)CCC1	ZINC000942560071	1331975095	/nfs/dbraw/zinc/97/50/95/1331975095.db2.gz	KMYRGZAAPCLJFN-YJBOKZPZSA-N	0	3	325.456	3.075	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C(C)(C)c2ccc(Cl)cc2)[C@@H](C)C1	ZINC000942595380	1331994714	/nfs/dbraw/zinc/99/47/14/1331994714.db2.gz	YNGALNGEEVTWFP-WMLDXEAASA-N	0	3	332.875	3.077	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCN(Cc3cccnc3C)C[C@@H]2C)CC1	ZINC000942600891	1331998042	/nfs/dbraw/zinc/99/80/42/1331998042.db2.gz	WNMZZQCRZPPJSO-JXFKEZNVSA-N	0	3	341.499	3.463	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(F)c3ccccc23)[C@@H](C)C1	ZINC000942938723	1332063025	/nfs/dbraw/zinc/06/30/25/1332063025.db2.gz	MHVWAFWILKFNRN-YWZLYKJASA-N	0	3	338.426	3.442	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cccc3sccc32)[C@@H](C)C1	ZINC000943335158	1332152320	/nfs/dbraw/zinc/15/23/20/1332152320.db2.gz	QGVOIXNNXWBCKY-YJBOKZPZSA-N	0	3	340.492	3.294	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc(-c3ccccc3)nc2)[C@@H](C)C1	ZINC000943756626	1332255305	/nfs/dbraw/zinc/25/53/05/1332255305.db2.gz	SMXLAUMIMXAQJN-LPHOPBHVSA-N	0	3	335.451	3.375	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccn2C2CCCC2)[C@@H](C)C1	ZINC000943772085	1332261436	/nfs/dbraw/zinc/26/14/36/1332261436.db2.gz	QAIJWYBHFSMNMY-WMZOPIPTSA-N	0	3	327.472	3.067	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccn2C2CCCC2)[C@H](C)C1	ZINC000943772084	1332261643	/nfs/dbraw/zinc/26/16/43/1332261643.db2.gz	QAIJWYBHFSMNMY-SJLPKXTDSA-N	0	3	327.472	3.067	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(OC)c(C3CC3)c2)[C@@H](C)C1	ZINC000943778894	1332264206	/nfs/dbraw/zinc/26/42/06/1332264206.db2.gz	XNLDMFCDKIXSQD-HNAYVOBHSA-N	0	3	340.467	3.036	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(-c3ccco3)s2)[C@H](C)C1	ZINC000943814694	1332272178	/nfs/dbraw/zinc/27/21/78/1332272178.db2.gz	JHXHHZTVZHYIGH-CABCVRRESA-N	0	3	342.464	3.472	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C)c(C)c2Cl)[C@H](C)C1	ZINC000944078979	1332322393	/nfs/dbraw/zinc/32/23/93/1332322393.db2.gz	IFMPETCTOIVQCM-RHSMWYFYSA-N	0	3	332.875	3.420	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(Cl)c3occc32)[C@H](C)C1	ZINC000944135111	1332333076	/nfs/dbraw/zinc/33/30/76/1332333076.db2.gz	IPGHEAFCWXTXFI-WBMJQRKESA-N	0	3	330.815	3.160	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C(C)(C)c2ccccc2Cl)[C@@H](C)C1	ZINC000944213817	1332346331	/nfs/dbraw/zinc/34/63/31/1332346331.db2.gz	GLOUXZRKUFEIOD-YJBOKZPZSA-N	0	3	346.902	3.468	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(Cl)c(Cl)c2)[C@H](C)C1	ZINC000944305995	1332368736	/nfs/dbraw/zinc/36/87/36/1332368736.db2.gz	QFKSUUMMATUPHC-IAQYHMDHSA-N	0	3	325.239	3.067	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(-c3ccccc3)cc2)[C@@H](C)C1	ZINC000944530795	1332414552	/nfs/dbraw/zinc/41/45/52/1332414552.db2.gz	GWBWRVDKZQCRAN-LAUBAEHRSA-N	0	3	332.447	3.427	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(F)c(F)cc2Cl)[C@@H](C)C1	ZINC000944619669	1332419335	/nfs/dbraw/zinc/41/93/35/1332419335.db2.gz	OIUFFYHMYXMAMH-MEDUHNTESA-N	0	3	340.801	3.082	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)nc3ccccc32)[C@H](C)C1	ZINC000944619942	1332419424	/nfs/dbraw/zinc/41/94/24/1332419424.db2.gz	PWWVJVVCHSNVOV-DNVCBOLYSA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2coc3cc(C)ccc23)[C@H](C)C1	ZINC000944651120	1332420875	/nfs/dbraw/zinc/42/08/75/1332420875.db2.gz	DIPWIRFULAETIY-APWZRJJASA-N	0	3	338.451	3.134	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)CC2C3CC4CC(C3)CC2C4)[C@@H](C)C1	ZINC000945006088	1332475300	/nfs/dbraw/zinc/47/53/00/1332475300.db2.gz	GYQDJZALBBWLFB-LWZPZBHMSA-N	0	3	342.527	3.299	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)CC2C3CC4CC(C3)CC2C4)[C@@H](C)C1	ZINC000945006086	1332475452	/nfs/dbraw/zinc/47/54/52/1332475452.db2.gz	GYQDJZALBBWLFB-JJVFZAKESA-N	0	3	342.527	3.299	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccc(C(F)(F)F)s2)[C@@H](C)C1	ZINC000945365323	1332567484	/nfs/dbraw/zinc/56/74/84/1332567484.db2.gz	JSBULHQHIYGETF-WDEREUQCSA-N	0	3	332.391	3.393	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc(C(F)(F)F)s2)[C@@H](C)C1	ZINC000945365321	1332567711	/nfs/dbraw/zinc/56/77/11/1332567711.db2.gz	JSBULHQHIYGETF-QWRGUYRKSA-N	0	3	332.391	3.393	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CC[C@H]3CN(CC(=C)Cl)C[C@H]3CC2)cc1	ZINC000946707669	1332881359	/nfs/dbraw/zinc/88/13/59/1332881359.db2.gz	XTTSUNIXKAHZFV-KDURUIRLSA-N	0	3	342.870	3.204	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)c2cccs2)CCN1Cc1cccc(C#N)c1	ZINC000947018343	1332975638	/nfs/dbraw/zinc/97/56/38/1332975638.db2.gz	XDOQJEYOKUHIDQ-YOEHRIQHSA-N	0	3	339.464	3.403	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2cccs2)CCN1Cc1ccc(C#N)cc1	ZINC000947018624	1332976447	/nfs/dbraw/zinc/97/64/47/1332976447.db2.gz	ZZCMEFJUUWTDPG-PBHICJAKSA-N	0	3	339.464	3.403	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H]2CCN(Cc3cccc(C#N)c3)[C@@H](C)C2)o1	ZINC000947027732	1332980945	/nfs/dbraw/zinc/98/09/45/1332980945.db2.gz	UMCVKRBDSCZKRL-KSSFIOAISA-N	0	3	337.423	3.243	20	30		EGEDHN
Cc1cncc(C(=O)N[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@H](C)C2)c1	ZINC000947162927	1333030362	/nfs/dbraw/zinc/03/03/62/1333030362.db2.gz	NUBLBGFIDAOPQS-OXQOHEQNSA-N	0	3	348.450	3.045	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H]2CCN(Cc3cccc(C#N)c3)[C@@H](C)C2)co1	ZINC000947244675	1333063733	/nfs/dbraw/zinc/06/37/33/1333063733.db2.gz	NXYJTQQYMUYFLB-IFXJQAMLSA-N	0	3	337.423	3.243	20	30		EGEDHN
Cc1cnccc1C(=O)N[C@H]1CCN(Cc2ccc(C#N)cc2)[C@H](C)C1	ZINC000947282263	1333076532	/nfs/dbraw/zinc/07/65/32/1333076532.db2.gz	NVXSGPGQHMBKFK-APWZRJJASA-N	0	3	348.450	3.045	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc(C(F)F)c2F)C[C@H]1C	ZINC000947319873	1333087567	/nfs/dbraw/zinc/08/75/67/1333087567.db2.gz	VLGOEPOAKARUTP-OLZOCXBDSA-N	0	3	338.373	3.369	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc3nccc(C)c3c2)C[C@@H]1C	ZINC000947346859	1333097921	/nfs/dbraw/zinc/09/79/21/1333097921.db2.gz	BNMBDYIQEQCQMH-FUHWJXTLSA-N	0	3	335.451	3.149	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CCN(CCC(F)(F)F)[C@H](C)C1	ZINC000947391116	1333112713	/nfs/dbraw/zinc/11/27/13/1333112713.db2.gz	GVLXYXJKGMZTHU-KGLIPLIRSA-N	0	3	343.393	3.209	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)c3ccccc3n2)C[C@H]1C	ZINC000947456278	1333136176	/nfs/dbraw/zinc/13/61/76/1333136176.db2.gz	YXKUOXFVWWLPNJ-SJORKVTESA-N	0	3	335.451	3.149	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc3cc(C)ccc3n2)C[C@@H]1C	ZINC000947532764	1333160723	/nfs/dbraw/zinc/16/07/23/1333160723.db2.gz	MPLYTUBXIYCTHW-FUHWJXTLSA-N	0	3	335.451	3.149	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2sccc2-n2cccc2)C[C@@H]1C	ZINC000947599350	1333188289	/nfs/dbraw/zinc/18/82/89/1333188289.db2.gz	UBPNCVKSFQPKJZ-HOTGVXAUSA-N	0	3	341.480	3.145	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(CCC(F)(F)F)[C@H](C)C2)cc1	ZINC000947612112	1333192436	/nfs/dbraw/zinc/19/24/36/1333192436.db2.gz	UAAGOSDWWXMNGN-CJNGLKHVSA-N	0	3	338.373	3.203	20	30		EGEDHN
Cc1coc(C(=O)N[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@@H](C)C2)c1	ZINC000947630272	1333200954	/nfs/dbraw/zinc/20/09/54/1333200954.db2.gz	XTHIHRCJJKZIND-MAUKXSAKSA-N	0	3	337.423	3.243	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccc(F)c(Cl)c2F)C[C@@H]1C	ZINC000947692745	1333226404	/nfs/dbraw/zinc/22/64/04/1333226404.db2.gz	AJKJGIQAIXEWKH-WDEREUQCSA-N	0	3	328.790	3.387	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3ccc(C#N)cc3)[C@@H](C)C2)C1	ZINC000947701459	1333231339	/nfs/dbraw/zinc/23/13/39/1333231339.db2.gz	CCPASHKBXWULGG-LPHOPBHVSA-N	0	3	337.467	3.384	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(CCc3csc(C)n3)[C@@H](C)C2)C1	ZINC000947702743	1333232390	/nfs/dbraw/zinc/23/23/90/1333232390.db2.gz	RUNQKZIBOBPMDZ-HOCLYGCPSA-N	0	3	347.528	3.319	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(CCc3ccns3)[C@@H](C)C2)C1	ZINC000947702768	1333232694	/nfs/dbraw/zinc/23/26/94/1333232694.db2.gz	SBNCZFDCWGFJDK-LSDHHAIUSA-N	0	3	333.501	3.011	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C(C)C)nc2C)C[C@@H]1C	ZINC000947727549	1333242401	/nfs/dbraw/zinc/24/24/01/1333242401.db2.gz	YXCNDMMFOIZGPF-RDJZCZTQSA-N	0	3	327.472	3.119	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2coc(-c3ccccc3)n2)C[C@@H]1C	ZINC000947940982	1333313595	/nfs/dbraw/zinc/31/35/95/1333313595.db2.gz	VTGGMGVKBLHTHH-HOCLYGCPSA-N	0	3	325.412	3.110	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cnc(-c3ccco3)s2)C[C@H]1C	ZINC000947944125	1333314534	/nfs/dbraw/zinc/31/45/34/1333314534.db2.gz	RBVKIUNGUIOCMH-ZIAGYGMSSA-N	0	3	343.452	3.009	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cnc(C(C)(C)C)s2)C[C@@H]1C	ZINC000948070118	1333363858	/nfs/dbraw/zinc/36/38/58/1333363858.db2.gz	MOSLRXGCPYCTRB-KBPBESRZSA-N	0	3	333.501	3.047	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cccc(OC(C)C)c2)C[C@@H]1C	ZINC000948083764	1333370910	/nfs/dbraw/zinc/37/09/10/1333370910.db2.gz	YQNINQOBQBSSSD-HKUYNNGSSA-N	0	3	342.483	3.009	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(CC)c(CC)c2)C[C@@H]1C	ZINC000948105302	1333375680	/nfs/dbraw/zinc/37/56/80/1333375680.db2.gz	UNUAGZRQCIZUBJ-OXJNMPFZSA-N	0	3	326.484	3.417	20	30		EGEDHN
CN(C(=O)c1ccco1)[C@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948148985	1333394845	/nfs/dbraw/zinc/39/48/45/1333394845.db2.gz	LTAARAVCKRIUNR-SFHVURJKSA-N	0	3	337.423	3.278	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2cscc2C(F)F)CC1	ZINC000948382007	1333503443	/nfs/dbraw/zinc/50/34/43/1333503443.db2.gz	WSDVJSIMSYVFAK-GFCCVEGCSA-N	0	3	326.412	3.245	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)Cc2ccc(C)c(Cl)c2)CC1	ZINC000948474041	1333540034	/nfs/dbraw/zinc/54/00/34/1333540034.db2.gz	PNXHDLGESFLMFC-KRWDZBQOSA-N	0	3	332.875	3.137	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)Cc2cccc3cnccc32)CC1	ZINC000948546916	1333567261	/nfs/dbraw/zinc/56/72/61/1333567261.db2.gz	LRTADOUXFGVZII-FQEVSTJZSA-N	0	3	349.478	3.114	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2c(C)c(F)ccc2Cl)CC1	ZINC000948560463	1333576788	/nfs/dbraw/zinc/57/67/88/1333576788.db2.gz	BMBVEHSSSOBUNJ-AWEZNQCLSA-N	0	3	336.838	3.347	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)C2CCc3ccccc3CC2)CC1	ZINC000948565345	1333578735	/nfs/dbraw/zinc/57/87/35/1333578735.db2.gz	COQQXSJUWIFWGM-NRFANRHFSA-N	0	3	338.495	3.128	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)Cc2cc3ccccc3s2)CC1	ZINC000948612515	1333596619	/nfs/dbraw/zinc/59/66/19/1333596619.db2.gz	ORZGHBWVEKDNIC-QGZVFWFLSA-N	0	3	340.492	3.390	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)[C@@H]2C[C@]2(C)c2ccccc2)CC1	ZINC000948627678	1333602555	/nfs/dbraw/zinc/60/25/55/1333602555.db2.gz	BQGUBAUODSHUQZ-JAXLGGSGSA-N	0	3	338.495	3.300	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2c(F)ccc(F)c2F)CC1	ZINC000948730047	1333650154	/nfs/dbraw/zinc/65/01/54/1333650154.db2.gz	RWYMWFUOLKEEOF-ZDUSSCGKSA-N	0	3	338.373	3.054	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@H]2CCCN(Cc3c(C)noc3C)CC2)C1	ZINC000948746034	1333655916	/nfs/dbraw/zinc/65/59/16/1333655916.db2.gz	AREGPPWWJMOARS-KRWDZBQOSA-N	0	3	345.487	3.461	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@@H]1CNC(=O)[C@H]1CCCCO1	ZINC000948909949	1333729964	/nfs/dbraw/zinc/72/99/64/1333729964.db2.gz	FBDVMQCBARRYQU-VQTJNVASSA-N	0	3	342.483	3.237	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@H]1CNC(=O)C1CC(OC)C1	ZINC000948928775	1333737189	/nfs/dbraw/zinc/73/71/89/1333737189.db2.gz	LRVRCKYTSYDQJF-AFMYVXGZSA-N	0	3	342.483	3.093	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@@H]1CNC(=O)c1[nH]cnc1C	ZINC000948990061	1333762533	/nfs/dbraw/zinc/76/25/33/1333762533.db2.gz	YBYXUPNLUYPJMX-SFHVURJKSA-N	0	3	338.455	3.014	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H]1CCCCC1(C)C)CCO2	ZINC000949251655	1333804357	/nfs/dbraw/zinc/80/43/57/1333804357.db2.gz	RCYVGNXJMNSTSZ-KRWDZBQOSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C[C@H]3C=CCC3)CC2)C1	ZINC000949295319	1333817090	/nfs/dbraw/zinc/81/70/90/1333817090.db2.gz	CPPDJKNILICAHT-SFHVURJKSA-N	0	3	332.488	3.002	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C3CCC(=C)CC3)CC2)C1	ZINC000949455254	1333851950	/nfs/dbraw/zinc/85/19/50/1333851950.db2.gz	YRCPBEDJPQKJAY-UHFFFAOYSA-N	0	3	332.488	3.002	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC2(CC1)CN(CCC(C)C)CCO2	ZINC000949463425	1333854291	/nfs/dbraw/zinc/85/42/91/1333854291.db2.gz	MBQIBLAXDABXEU-IBGZPJMESA-N	0	3	336.520	3.328	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@@H]3C[C@]3(C)C(C)C)CC2)C1	ZINC000949501529	1333861009	/nfs/dbraw/zinc/86/10/09/1333861009.db2.gz	WYGIKJFZZJCPJM-AZUAARDMSA-N	0	3	348.531	3.328	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3cccc(C)c3C)CC2)C1	ZINC000949520272	1333866335	/nfs/dbraw/zinc/86/63/35/1333866335.db2.gz	OFWZQYOVDZBIFJ-UHFFFAOYSA-N	0	3	342.483	3.187	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3c(C)cccc3F)CC2)C1	ZINC000949534277	1333870734	/nfs/dbraw/zinc/87/07/34/1333870734.db2.gz	UWMOZNIGOFUKNG-UHFFFAOYSA-N	0	3	346.446	3.017	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2cc(-c3ccccc3)no2)C1	ZINC000967181753	1335675814	/nfs/dbraw/zinc/67/58/14/1335675814.db2.gz	HYCTUEILWSKTOZ-CRAIPNDOSA-N	0	3	339.439	3.358	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccc(OC)c(C(C)C)c2)C1	ZINC000967265002	1335681436	/nfs/dbraw/zinc/68/14/36/1335681436.db2.gz	RRXJWWWHWTYJBZ-VQIMIIECSA-N	0	3	342.483	3.282	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)C2(c3cccc(F)c3)CCC2)C1	ZINC000967654427	1335800890	/nfs/dbraw/zinc/80/08/90/1335800890.db2.gz	GIEFXQVYGPUQLD-LPHOPBHVSA-N	0	3	342.458	3.097	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2cc3cc(C)ccc3[nH]2)C1	ZINC000967661386	1335802902	/nfs/dbraw/zinc/80/29/02/1335802902.db2.gz	YNPJMZAEVQQGNV-KXBFYZLASA-N	0	3	325.456	3.493	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2cncc3sccc32)C1	ZINC000967919662	1335830166	/nfs/dbraw/zinc/83/01/66/1335830166.db2.gz	MANJFTJHIPHUPW-XJKSGUPXSA-N	0	3	329.469	3.313	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(F)c3ccncc23)C1	ZINC000967947801	1335832606	/nfs/dbraw/zinc/83/26/06/1335832606.db2.gz	YFDRYXIFBDSYOF-KUHUBIRLSA-N	0	3	341.430	3.390	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2cc3ccccc3n2C)C1	ZINC000968078256	1335854294	/nfs/dbraw/zinc/85/42/94/1335854294.db2.gz	KFKWFGXQHCOALO-RDJZCZTQSA-N	0	3	325.456	3.195	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2c(F)ccc(F)c2F)C1	ZINC000968105155	1335857616	/nfs/dbraw/zinc/85/76/16/1335857616.db2.gz	IJCIKTYJBOWDGT-FZMZJTMJSA-N	0	3	326.362	3.120	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CN(CCOC3CCC3)CC[C@H]2C)CC1	ZINC000968193973	1335869398	/nfs/dbraw/zinc/86/93/98/1335869398.db2.gz	XGMWRDNQKHKEFF-APWZRJJASA-N	0	3	334.504	3.129	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2ccccc2OC2CCC2)C1	ZINC000968316056	1335888061	/nfs/dbraw/zinc/88/80/61/1335888061.db2.gz	DAVICYMOOXDJCE-QFBILLFUSA-N	0	3	340.467	3.081	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2ccc(C3CC3)nc2C)C1	ZINC000968341710	1335894869	/nfs/dbraw/zinc/89/48/69/1335894869.db2.gz	YINAOZNHFYJZPQ-LIRRHRJNSA-N	0	3	327.472	3.284	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)Cc2cc(F)c(F)cc2F)C1	ZINC000968354445	1335899883	/nfs/dbraw/zinc/89/98/83/1335899883.db2.gz	SVKDJYMEELCXDW-YVEFUNNKSA-N	0	3	340.389	3.049	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2cc(C(C)(C)C)oc2C)C1	ZINC000968357549	1335901646	/nfs/dbraw/zinc/90/16/46/1335901646.db2.gz	OULSMOWXJOBJAW-YOEHRIQHSA-N	0	3	330.472	3.349	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2cccc(C(C)(C)C)c2)C1	ZINC000968453756	1335929846	/nfs/dbraw/zinc/92/98/46/1335929846.db2.gz	GGAWEYPHDAEKMY-QFBILLFUSA-N	0	3	326.484	3.448	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CN(CC3=CCCCC3)CC[C@H]2C)nc1	ZINC000968549421	1335959842	/nfs/dbraw/zinc/95/98/42/1335959842.db2.gz	QNGKEAMKYILDCO-UZLBHIALSA-N	0	3	337.467	3.004	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(Cl)c(Cl)c2)C1	ZINC000968579946	1335969725	/nfs/dbraw/zinc/96/97/25/1335969725.db2.gz	QWDHXANTZORDPM-WBMJQRKESA-N	0	3	339.266	3.457	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccsc2C(F)F)C1	ZINC000968598337	1335979102	/nfs/dbraw/zinc/97/91/02/1335979102.db2.gz	DCUUOGSNNCJICJ-AAEUAGOBSA-N	0	3	326.412	3.149	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(OCC(C)C)cc2)C1	ZINC000968620325	1335985636	/nfs/dbraw/zinc/98/56/36/1335985636.db2.gz	STPKBNYCLLEUGQ-XLIONFOSSA-N	0	3	342.483	3.185	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)C2(c3ccccc3)CCCC2)C1	ZINC000968623003	1335986923	/nfs/dbraw/zinc/98/69/23/1335986923.db2.gz	DJODEDURYYYKOB-AZUAARDMSA-N	0	3	338.495	3.348	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2ccc(OC)c(OCC)c2)C1	ZINC000968624163	1335987432	/nfs/dbraw/zinc/98/74/32/1335987432.db2.gz	OKKOWDAMWMXFRF-RDJZCZTQSA-N	0	3	346.471	3.110	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2sc(CCC)nc2C)C1	ZINC000968643410	1335994294	/nfs/dbraw/zinc/99/42/94/1335994294.db2.gz	LTPATPXISAXOKM-DZGCQCFKSA-N	0	3	335.517	3.420	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2cnc(C(C)(C)C)s2)C1	ZINC000968681605	1336008939	/nfs/dbraw/zinc/00/89/39/1336008939.db2.gz	KKRQBQMRUICRFS-ZIAGYGMSSA-N	0	3	335.517	3.457	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N[C@H]2CN(CC(=C)C)CC[C@H]2C)cc1	ZINC000968685250	1336010793	/nfs/dbraw/zinc/01/07/93/1336010793.db2.gz	PJXSGLARGVYHOZ-XLIONFOSSA-N	0	3	342.483	3.197	20	30		EGEDHN
N#Cc1ccc(CN2CCCCC[C@H]2CNC(=O)C2CCC2)cc1	ZINC000968724314	1336024645	/nfs/dbraw/zinc/02/46/45/1336024645.db2.gz	DEGPQHIURTUCFD-IBGZPJMESA-N	0	3	325.456	3.219	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC000968788427	1336050818	/nfs/dbraw/zinc/05/08/18/1336050818.db2.gz	FJRQOLHHFCKBOL-MRXNPFEDSA-N	0	3	331.435	3.070	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H](NCc2ccc(F)c(F)c2)C1	ZINC000968795811	1336054228	/nfs/dbraw/zinc/05/42/28/1336054228.db2.gz	ZRIAOIHKDSOUAM-CYBMUJFWSA-N	0	3	342.817	3.434	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccnn1C(CC)CC	ZINC000968890049	1336081287	/nfs/dbraw/zinc/08/12/87/1336081287.db2.gz	AKZYQWOQUANLSZ-KRWDZBQOSA-N	0	3	332.492	3.405	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccc(N(C)C)cc1F	ZINC000968890523	1336081485	/nfs/dbraw/zinc/08/14/85/1336081485.db2.gz	JSRZJBFDJANZNK-MRXNPFEDSA-N	0	3	333.451	3.052	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cnn2c1ccc(C)c2C	ZINC000968896631	1336084333	/nfs/dbraw/zinc/08/43/33/1336084333.db2.gz	WSUXZESZXDIHBE-QGZVFWFLSA-N	0	3	340.471	3.112	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1cc(C)cc(OC)c1C	ZINC000968936516	1336095783	/nfs/dbraw/zinc/09/57/83/1336095783.db2.gz	KFCKNFQHUPTKOH-SFHVURJKSA-N	0	3	342.483	3.310	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1cc2ccccc2nn1	ZINC000968974468	1336106524	/nfs/dbraw/zinc/10/65/24/1336106524.db2.gz	URQFPLKEKQVUHN-KRWDZBQOSA-N	0	3	338.455	3.180	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)NC[C@H]1CCCCCN1Cc1cccc(C#N)c1	ZINC000968987579	1336111065	/nfs/dbraw/zinc/11/10/65/1336111065.db2.gz	DTZXNMCINVKYNM-IPELMVKDSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1ccc2c(c1)[C@@H](C)CO2	ZINC000968998531	1336115014	/nfs/dbraw/zinc/11/50/14/1336115014.db2.gz	YRWNUQLQDYIGRC-WMZOPIPTSA-N	0	3	340.467	3.180	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1noc2c1CCCCC2	ZINC000969053295	1336129303	/nfs/dbraw/zinc/12/93/03/1336129303.db2.gz	IHZUWJJGPSHATE-MRXNPFEDSA-N	0	3	345.487	3.494	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cccc2c1ccn2C	ZINC000969072942	1336138173	/nfs/dbraw/zinc/13/81/73/1336138173.db2.gz	UTWCDCCYSHOZPA-INIZCTEOSA-N	0	3	325.456	3.339	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cnn(CC2CCCC2)c1	ZINC000969090612	1336139426	/nfs/dbraw/zinc/13/94/26/1336139426.db2.gz	GDEXJWQEDULJLT-LJQANCHMSA-N	0	3	344.503	3.234	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccc2scnc2c1	ZINC000969101130	1336143580	/nfs/dbraw/zinc/14/35/80/1336143580.db2.gz	RJCHGDXBNHZFQR-HNNXBMFYSA-N	0	3	329.469	3.457	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccnc(OC(C)C)c1	ZINC000969111788	1336148207	/nfs/dbraw/zinc/14/82/07/1336148207.db2.gz	SOHADPONHNNQKU-QGZVFWFLSA-N	0	3	331.460	3.029	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1ccc(OC(C)C)cc1	ZINC000969133601	1336155544	/nfs/dbraw/zinc/15/55/44/1336155544.db2.gz	QBIZTYASGZGSMQ-IBGZPJMESA-N	0	3	342.483	3.472	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1c(Cl)nc2ccccn21	ZINC000969139288	1336158541	/nfs/dbraw/zinc/15/85/41/1336158541.db2.gz	LABGZXMORLLCSI-AWEZNQCLSA-N	0	3	346.862	3.148	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccc(OCC)c(OC)c1	ZINC000969141999	1336160130	/nfs/dbraw/zinc/16/01/30/1336160130.db2.gz	RPJYUMRHXCCYGI-KRWDZBQOSA-N	0	3	346.471	3.254	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(C(=O)C3CCC4(CC4)CC3)C2)s1	ZINC000969366076	1336203850	/nfs/dbraw/zinc/20/38/50/1336203850.db2.gz	LCGDIILXRPSGDL-OAHLLOKOSA-N	0	3	343.496	3.281	20	30		EGEDHN
CC(C)(C(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1)C1CCC1	ZINC000969481999	1336217057	/nfs/dbraw/zinc/21/70/57/1336217057.db2.gz	FYCHGCJPZUVHAA-QGZVFWFLSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3ccc(Cl)nc3)C2)CC1	ZINC000969830337	1336251783	/nfs/dbraw/zinc/25/17/83/1336251783.db2.gz	ISHCNLUEWUNOQC-MRXNPFEDSA-N	0	3	333.863	3.172	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)c2cc3c([nH]2)c(F)ccc3C)C1	ZINC000970004048	1336271075	/nfs/dbraw/zinc/27/10/75/1336271075.db2.gz	HBZHLBZJZKVMNL-CYBMUJFWSA-N	0	3	329.419	3.242	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2c(F)c(F)cc(F)c2F)CC1	ZINC001005430739	1336347084	/nfs/dbraw/zinc/34/70/84/1336347084.db2.gz	FCYKYHDCLOZMSG-UHFFFAOYSA-N	0	3	344.352	3.356	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ocnc2-c2ccccc2)CC1	ZINC001005490225	1336360392	/nfs/dbraw/zinc/36/03/92/1336360392.db2.gz	YPVDOLYRKGQAMX-UHFFFAOYSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccc(N(C)C)cc2F)CC1	ZINC001005496979	1336361775	/nfs/dbraw/zinc/36/17/75/1336361775.db2.gz	KDWACEBTKSDSSA-UHFFFAOYSA-N	0	3	333.451	3.004	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccc(-c3cc[nH]n3)s2)CC1	ZINC001005539999	1336369685	/nfs/dbraw/zinc/36/96/85/1336369685.db2.gz	SWUAVNQQZUHCST-UHFFFAOYSA-N	0	3	344.484	3.251	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)[C@H]2CCC[C@H](C(F)(F)F)C2)CC1	ZINC001005637972	1336386728	/nfs/dbraw/zinc/38/67/28/1336386728.db2.gz	JSCXHBQFPKLHNK-KBPBESRZSA-N	0	3	332.410	3.464	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cn(CC)c3ccccc23)CC1	ZINC001005685048	1336392425	/nfs/dbraw/zinc/39/24/25/1336392425.db2.gz	NQQAGKDUAJHHLD-UHFFFAOYSA-N	0	3	325.456	3.384	20	30		EGEDHN
CN(C(=O)C1(C)CCC1)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001005834474	1336406382	/nfs/dbraw/zinc/40/63/82/1336406382.db2.gz	VZAGDIGQFKCTEV-UHFFFAOYSA-N	0	3	325.456	3.171	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cc(F)c(Cl)cc2F)CC1	ZINC001005906278	1336420068	/nfs/dbraw/zinc/42/00/68/1336420068.db2.gz	LSAPOXRNZOXVHL-UHFFFAOYSA-N	0	3	328.790	3.341	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cc(F)c3ncccc3c2)CC1	ZINC001006149705	1336460503	/nfs/dbraw/zinc/46/05/03/1336460503.db2.gz	BZZZMOUHYCPFIH-UHFFFAOYSA-N	0	3	341.430	3.486	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cnoc2-c2ccccc2)CC1	ZINC001006235172	1336473918	/nfs/dbraw/zinc/47/39/18/1336473918.db2.gz	LAFOIKIAVLDVNH-UHFFFAOYSA-N	0	3	325.412	3.064	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN(Cc3cccc(C)c3)C2)cc1	ZINC001008147292	1336780146	/nfs/dbraw/zinc/78/01/46/1336780146.db2.gz	JQRRHYOALBUREB-OAQYLSRUSA-N	0	3	332.447	3.371	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)Cc2c(C)[nH]c3ccccc32)C1	ZINC001008383498	1336838646	/nfs/dbraw/zinc/83/86/46/1336838646.db2.gz	IBMPQJJLLGRSND-MRXNPFEDSA-N	0	3	325.456	3.176	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CCCN(CCCC3CCCC3)C2)c1	ZINC001008470974	1336865002	/nfs/dbraw/zinc/86/50/02/1336865002.db2.gz	XVAHAZOSJGJSFO-FQEVSTJZSA-N	0	3	339.483	3.228	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CCCN(Cc3ccc(C)cc3C)C2)c1	ZINC001008471449	1336865220	/nfs/dbraw/zinc/86/52/20/1336865220.db2.gz	ZMUIWAWEFXPELL-OAQYLSRUSA-N	0	3	347.462	3.074	20	30		EGEDHN
C#CCCN1CCC[C@@H](NC(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2)C1	ZINC001008798188	1336926443	/nfs/dbraw/zinc/92/64/43/1336926443.db2.gz	HWJSICYCJVKRTE-FGTMMUONSA-N	0	3	330.859	3.047	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN(Cc3c(C)cccc3C)C2)nc1	ZINC001009251910	1336991459	/nfs/dbraw/zinc/99/14/59/1336991459.db2.gz	KCXAPIPHDKONDI-LJQANCHMSA-N	0	3	347.462	3.074	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@@H]1CCCN(CCc2ccccc2)C1	ZINC001009355287	1337010296	/nfs/dbraw/zinc/01/02/96/1337010296.db2.gz	VZSWHHWPIJNXES-JOCHJYFZSA-N	0	3	346.474	3.034	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2cc(F)c(F)cc2Cl)C1	ZINC001009405759	1337018911	/nfs/dbraw/zinc/01/89/11/1337018911.db2.gz	YZRGXIKXMKRKPL-NSHDSACASA-N	0	3	328.790	3.389	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(CCCc3ccsc3)C2)cc1	ZINC001015482999	1338155099	/nfs/dbraw/zinc/15/50/99/1338155099.db2.gz	TXLJNHBBECPARA-IBGZPJMESA-N	0	3	338.476	3.166	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN([C@@H]3CCc4ccccc43)C2)cc1	ZINC001015482393	1338155597	/nfs/dbraw/zinc/15/55/97/1338155597.db2.gz	NUIHIYWLSWRBOA-PZJWPPBQSA-N	0	3	330.431	3.160	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(CC[C@@H]3CCCC3(F)F)C2)C1	ZINC001015677495	1338253861	/nfs/dbraw/zinc/25/38/61/1338253861.db2.gz	WGWNHFMGDAXSOP-LSDHHAIUSA-N	0	3	326.431	3.359	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(CCc3ccccc3CC)C2)C1	ZINC001015677686	1338254231	/nfs/dbraw/zinc/25/42/31/1338254231.db2.gz	YBFFVABEEQCTJN-IBGZPJMESA-N	0	3	326.484	3.338	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CCN([C@H](CC)c3ccccc3)C2)c1	ZINC001015679958	1338255605	/nfs/dbraw/zinc/25/56/05/1338255605.db2.gz	QRAXFTRMCCBXSL-WOJBJXKFSA-N	0	3	333.435	3.018	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@H]3NC(=O)C3CCCC3)CC2)c1	ZINC001016460667	1338610238	/nfs/dbraw/zinc/61/02/38/1338610238.db2.gz	GFNKXWKNCXWHCV-LJQANCHMSA-N	0	3	337.467	3.219	20	30		EGEDHN
Cc1occc1C(=O)N[C@@H]1CC12CCN(Cc1cccc(C#N)c1)CC2	ZINC001016493580	1338624071	/nfs/dbraw/zinc/62/40/71/1338624071.db2.gz	DAWZSWKYBXLASO-LJQANCHMSA-N	0	3	349.434	3.244	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2coc3c2cccc3C)CC1	ZINC001016663423	1338683838	/nfs/dbraw/zinc/68/38/38/1338683838.db2.gz	QSQYWBNVPXVCLK-SFHVURJKSA-N	0	3	336.435	3.349	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2ccccc2CC(C)(C)C)CC1	ZINC001016680753	1338688453	/nfs/dbraw/zinc/68/84/53/1338688453.db2.gz	FBHHICKQGVLIMQ-IBGZPJMESA-N	0	3	338.495	3.493	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CC23CCN(Cc2cccc(C#N)c2)CC3)C1	ZINC001016811866	1338734506	/nfs/dbraw/zinc/73/45/06/1338734506.db2.gz	GTDAOSLTWNIJEN-LJQANCHMSA-N	0	3	349.478	3.385	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@H]3NC(=O)[C@H]3CC34CCC4)CC2)c1	ZINC001016857507	1338749075	/nfs/dbraw/zinc/74/90/75/1338749075.db2.gz	ZZTYUCGPGSGGGN-RTBURBONSA-N	0	3	349.478	3.219	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)[C@@H]2C[C@H]2c2ccc(C)s2)CC1	ZINC001016869826	1338753200	/nfs/dbraw/zinc/75/32/00/1338753200.db2.gz	JXDLEYGFTJQYOZ-JFIYKMOQSA-N	0	3	342.508	3.154	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cccc(C)c2Cl)CC1	ZINC001016886432	1338759012	/nfs/dbraw/zinc/75/90/12/1338759012.db2.gz	DNLPBHLRNIKFKO-INIZCTEOSA-N	0	3	330.859	3.256	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cccn2C2CCCC2)CC1	ZINC001016903072	1338764250	/nfs/dbraw/zinc/76/42/50/1338764250.db2.gz	VQFWYVVAHIVBRR-IBGZPJMESA-N	0	3	339.483	3.211	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2[nH]c3ccc(C)cc3c2C)CC1	ZINC001016907479	1338765755	/nfs/dbraw/zinc/76/57/55/1338765755.db2.gz	RXFUEYXKUBWQHQ-SFHVURJKSA-N	0	3	335.451	3.002	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2cc(Cl)cc(Cl)c2)CC1	ZINC001016947019	1338780705	/nfs/dbraw/zinc/78/07/05/1338780705.db2.gz	SMIQDVNIOKXODE-HNNXBMFYSA-N	0	3	337.250	3.211	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(F)c3occc32)CC1	ZINC001016987526	1338794132	/nfs/dbraw/zinc/79/41/32/1338794132.db2.gz	VDRJOCNQPQICCN-KRWDZBQOSA-N	0	3	340.398	3.180	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCCN(C(=O)CCC2CC2)C1	ZINC001017080735	1338851774	/nfs/dbraw/zinc/85/17/74/1338851774.db2.gz	GZZUUDJJNDUQNO-MRXNPFEDSA-N	0	3	345.512	3.480	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCCN(C(=O)[C@H]2CC2(C)C)C1	ZINC001017106466	1338870299	/nfs/dbraw/zinc/87/02/99/1338870299.db2.gz	HVTIASHCWFZGPG-RHSMWYFYSA-N	0	3	345.512	3.336	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H](CN(C)Cc3ccccn3)C2)C1	ZINC001017206949	1338953172	/nfs/dbraw/zinc/95/31/72/1338953172.db2.gz	KSLQSWXILDXDJG-KRWDZBQOSA-N	0	3	327.472	3.108	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H](CN(C)[C@H](C)c3cnccn3)C2)C1	ZINC001017208668	1338955055	/nfs/dbraw/zinc/95/50/55/1338955055.db2.gz	UBNOKMVXQGBNEO-IAGOWNOFSA-N	0	3	342.487	3.064	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H](CN(C)Cc3cncc(F)c3)C2)C1	ZINC001017209134	1338955793	/nfs/dbraw/zinc/95/57/93/1338955793.db2.gz	YSZXTDXYRZSWLC-INIZCTEOSA-N	0	3	345.462	3.247	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cccc2scnc21	ZINC001017552211	1339366222	/nfs/dbraw/zinc/36/62/22/1339366222.db2.gz	UQHIHVYBVLJWLX-OKILXGFUSA-N	0	3	327.453	3.161	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc(C)c(OC)c1	ZINC001017718385	1339400374	/nfs/dbraw/zinc/40/03/74/1339400374.db2.gz	AEFPMRVAFALLBE-KDURUIRLSA-N	0	3	342.483	3.188	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cccc(OCC)c1	ZINC001017998927	1339478901	/nfs/dbraw/zinc/47/89/01/1339478901.db2.gz	RIGBWTQIVBUPFV-HDICACEKSA-N	0	3	328.456	3.340	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1c(C)[nH]nc1C(C)C	ZINC001018154154	1339516933	/nfs/dbraw/zinc/51/69/33/1339516933.db2.gz	DWRNRCGMXDLQTF-IYBDPMFKSA-N	0	3	330.476	3.097	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1c(C)n[nH]c1C(C)C	ZINC001018154154	1339516936	/nfs/dbraw/zinc/51/69/36/1339516936.db2.gz	DWRNRCGMXDLQTF-IYBDPMFKSA-N	0	3	330.476	3.097	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H]1CCO[C@@H](C(C)C)C1	ZINC001018157283	1339517972	/nfs/dbraw/zinc/51/79/72/1339517972.db2.gz	ODYACOGDVGQLNK-AKHDSKFASA-N	0	3	334.504	3.079	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)CCn1ccc2ccccc21	ZINC001018248549	1339549440	/nfs/dbraw/zinc/54/94/40/1339549440.db2.gz	DRGQLJWSJDADKW-KDURUIRLSA-N	0	3	337.467	3.283	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](CC)c1ccc(OC)cc1	ZINC001018295104	1339566468	/nfs/dbraw/zinc/56/64/68/1339566468.db2.gz	LAHLGSIQMNXWPK-WSTZPKSXSA-N	0	3	342.483	3.440	20	30		EGEDHN
C=CCCN1CCC[C@@H]1CNC(=O)c1cnc(-c2ccco2)s1	ZINC001028278967	1340533063	/nfs/dbraw/zinc/53/30/63/1340533063.db2.gz	UMCPMMVHGYGRIY-CYBMUJFWSA-N	0	3	331.441	3.173	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1ccc(N(CC)CC)cc1	ZINC001028283000	1340537900	/nfs/dbraw/zinc/53/79/00/1340537900.db2.gz	SOPCZGZZRBBLIH-LJQANCHMSA-N	0	3	329.488	3.303	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1cccc2c1OCC2(C)C	ZINC001028354051	1340590402	/nfs/dbraw/zinc/59/04/02/1340590402.db2.gz	ITAZMJQJILQZAL-HNNXBMFYSA-N	0	3	328.456	3.127	20	30		EGEDHN
Cc1coc(C)c1C(=O)NC[C@@H]1CCN(Cc2ccc(C#N)cc2)C1	ZINC001028516247	1340681842	/nfs/dbraw/zinc/68/18/42/1340681842.db2.gz	RVHGBEUTOCTUDE-SFHVURJKSA-N	0	3	337.423	3.020	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H](CNC(=O)[C@@H]3C[C@@H]4C=C[C@H]3CC4)C2)c1	ZINC001028553728	1340698494	/nfs/dbraw/zinc/69/84/94/1340698494.db2.gz	MNGLIDZYTNTSOG-RZXSNQJFSA-N	0	3	349.478	3.099	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](CNC(=O)c3cc[nH]c3C3CC3)C2)cc1	ZINC001028764717	1340798328	/nfs/dbraw/zinc/79/83/28/1340798328.db2.gz	LDYYZMUFSLUCCE-QGZVFWFLSA-N	0	3	348.450	3.016	20	30		EGEDHN
CC1(C)CC[C@@H](C(=O)NC[C@@H]2CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001028782030	1340814092	/nfs/dbraw/zinc/81/40/92/1340814092.db2.gz	ADKROZDXSYITGU-RBUKOAKNSA-N	0	3	339.483	3.323	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)c2c(Cl)cccc2Cl)C1	ZINC001028951320	1340892423	/nfs/dbraw/zinc/89/24/23/1340892423.db2.gz	YEEICVROXNHDAM-LBPRGKRZSA-N	0	3	325.239	3.068	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)c2cc3c(cccc3F)s2)C1	ZINC001028973810	1340898478	/nfs/dbraw/zinc/89/84/78/1340898478.db2.gz	RWJYNJGYYZNNKU-ZDUSSCGKSA-N	0	3	330.428	3.115	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](CNC(=O)C3CCC=CCC3)C2)cc1	ZINC001028990031	1340902077	/nfs/dbraw/zinc/90/20/77/1340902077.db2.gz	CLKRUVXCHCZGFG-LJQANCHMSA-N	0	3	337.467	3.243	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC([C@@H](C)NCc2nccs2)CC1	ZINC001029136178	1340939560	/nfs/dbraw/zinc/93/95/60/1340939560.db2.gz	AVCGLWVIOHNMTJ-KDOFPFPSSA-N	0	3	335.517	3.462	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC([C@H](C)NCc2nccs2)CC1	ZINC001029136177	1340939638	/nfs/dbraw/zinc/93/96/38/1340939638.db2.gz	AVCGLWVIOHNMTJ-KBXCAEBGSA-N	0	3	335.517	3.462	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CC[C@@H](C1)N2C[C@@H](OC)C1CCCC1	ZINC001029456992	1340994671	/nfs/dbraw/zinc/99/46/71/1340994671.db2.gz	WAKOWYUSNOPOOG-RCLSDMTESA-N	0	3	348.531	3.469	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CC[C@@H](C2)N3CCCC2CCOCC2)C1	ZINC001029464576	1340996335	/nfs/dbraw/zinc/99/63/35/1340996335.db2.gz	BOMBOJADWZOTDA-KDURUIRLSA-N	0	3	346.515	3.225	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](CN(C)Cc2cc(F)ccc2OC)C1	ZINC001029804256	1341078776	/nfs/dbraw/zinc/07/87/76/1341078776.db2.gz	UAQDVDDPEOKDCU-HNNXBMFYSA-N	0	3	348.462	3.327	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCN(C(=O)[C@]2(C)C=CCC2)C1	ZINC001029806462	1341079975	/nfs/dbraw/zinc/07/99/75/1341079975.db2.gz	LNRJATOXIQRHQR-DNVCBOLYSA-N	0	3	343.496	3.256	20	30		EGEDHN
C#CCCN1CCC[C@H](N(Cc2ccccc2)C(=O)[C@@H]2CC23CC3)C1	ZINC001029920853	1341120382	/nfs/dbraw/zinc/12/03/82/1341120382.db2.gz	AIRPNMYYTVLIDW-PMACEKPBSA-N	0	3	336.479	3.303	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2c(F)ccc(F)c2Cl)CC[C@@H]1C	ZINC001071845077	1354976041	/nfs/dbraw/zinc/97/60/41/1354976041.db2.gz	WOHKJUYQWYCFNO-RYUDHWBXSA-N	0	3	340.801	3.224	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)CC1CCN(C(=O)C2(C)CC2)CC1	ZINC001029967664	1341137896	/nfs/dbraw/zinc/13/78/96/1341137896.db2.gz	PGBHBCHNVPWBIW-UHFFFAOYSA-N	0	3	331.485	3.090	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC(CN(C)Cc2cc(C)no2)CC1	ZINC001029982115	1341143465	/nfs/dbraw/zinc/14/34/65/1341143465.db2.gz	MRCABSFCCCAINX-UHFFFAOYSA-N	0	3	333.476	3.256	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC(CN(C)Cc2cc(C3CC3)no2)CC1	ZINC001029985147	1341144514	/nfs/dbraw/zinc/14/45/14/1341144514.db2.gz	TVJXSQNDVVXCLE-UHFFFAOYSA-N	0	3	345.487	3.435	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC(CN(C)Cc3ocnc3C)CC2)C1	ZINC001029993922	1341150499	/nfs/dbraw/zinc/15/04/99/1341150499.db2.gz	SCDGTHFXYBOEAK-UHFFFAOYSA-N	0	3	331.460	3.010	20	30		EGEDHN
C=CCn1cccc1C(=O)NCC1CN(Cc2ccc(C)c(C)c2)C1	ZINC001031733153	1341394696	/nfs/dbraw/zinc/39/46/96/1341394696.db2.gz	OJNHJSSCOSXYAH-UHFFFAOYSA-N	0	3	337.467	3.153	20	30		EGEDHN
C=CCn1cccc1C(=O)NCC1CN(Cc2ccccc2C2CC2)C1	ZINC001031733680	1341395069	/nfs/dbraw/zinc/39/50/69/1341395069.db2.gz	JOTJVIOTDMILME-UHFFFAOYSA-N	0	3	349.478	3.413	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1ccc(CCCC)cc1	ZINC001032502159	1341524041	/nfs/dbraw/zinc/52/40/41/1341524041.db2.gz	ALMRLUKEDKJMRN-PMACEKPBSA-N	0	3	326.484	3.433	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(-n2cccc2)cc1	ZINC001032504087	1341524752	/nfs/dbraw/zinc/52/47/52/1341524752.db2.gz	IAVFJYQSXVHSLC-PMACEKPBSA-N	0	3	335.451	3.342	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H](CC)Oc1ccccc1F	ZINC001032731261	1341593796	/nfs/dbraw/zinc/59/37/96/1341593796.db2.gz	GVCIPSLCWMIBHJ-XYJFISCASA-N	0	3	346.446	3.234	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(OC2CCC2)cc1	ZINC001032793854	1341615593	/nfs/dbraw/zinc/61/55/93/1341615593.db2.gz	IGVSGYNRMWIBBS-ROUUACIJSA-N	0	3	340.467	3.483	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)CCc1cc(F)ccc1F	ZINC001032801699	1341618240	/nfs/dbraw/zinc/61/82/40/1341618240.db2.gz	KLMQWTIAURYJCD-IRXDYDNUSA-N	0	3	334.410	3.149	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)[C@H]2CCc3c2cccc3Cl)C1	ZINC001033267175	1341763258	/nfs/dbraw/zinc/76/32/58/1341763258.db2.gz	AQJBCRXKYPGSQK-PBHICJAKSA-N	0	3	332.875	3.479	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)C2(c3cccc(F)c3)CCC2)C1	ZINC001033314676	1341777768	/nfs/dbraw/zinc/77/77/68/1341777768.db2.gz	AUPCGELPPDLVAQ-SFHVURJKSA-N	0	3	330.447	3.356	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)C2(c3cccnc3)CCCC2)C1	ZINC001033365435	1341797347	/nfs/dbraw/zinc/79/73/47/1341797347.db2.gz	GSFQKSYDXMVKNI-SFHVURJKSA-N	0	3	327.472	3.002	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)[C@]2(c3ccccc3)CC2(C)C)C1	ZINC001033523028	1341857907	/nfs/dbraw/zinc/85/79/07/1341857907.db2.gz	VZMDCUNUONFHQH-GHTZIAJQSA-N	0	3	326.484	3.463	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2ccc(-c3ccccc3)nc2)C1	ZINC001033532186	1341860779	/nfs/dbraw/zinc/86/07/79/1341860779.db2.gz	AMHCLMLNZJEZIR-IBGZPJMESA-N	0	3	335.451	3.471	20	30		EGEDHN
C=CCCN1CC[C@H](N(C)C(=O)c2sc(CC3CC3)nc2C)C1	ZINC001033542793	1341864344	/nfs/dbraw/zinc/86/43/44/1341864344.db2.gz	GTBVMDZBJKAZCE-HNNXBMFYSA-N	0	3	333.501	3.126	20	30		EGEDHN
C=CCCN1CC[C@H](N(C)C(=O)c2cnc(CC(C)(C)C)s2)C1	ZINC001033558813	1341871867	/nfs/dbraw/zinc/87/18/67/1341871867.db2.gz	VFIADXGEQCOSJG-AWEZNQCLSA-N	0	3	335.517	3.454	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@@H]2CCN(Cc3cc(C)ccc3C)C2)nc1	ZINC001033594143	1341888494	/nfs/dbraw/zinc/88/84/94/1341888494.db2.gz	SVQVRJALVXWKEF-HXUWFJFHSA-N	0	3	347.462	3.026	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)Cc2coc3cc(C)ccc23)C1	ZINC001033639057	1341921659	/nfs/dbraw/zinc/92/16/59/1341921659.db2.gz	ZRHNALBGERKJDC-QGZVFWFLSA-N	0	3	326.440	3.393	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)Cc2c(C)oc3ccccc32)C1	ZINC001033728335	1341980400	/nfs/dbraw/zinc/98/04/00/1341980400.db2.gz	LUSVPXREAZTHJZ-MRXNPFEDSA-N	0	3	326.440	3.393	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cn(C)c3ccc(F)cc23)C1	ZINC001033855029	1342046263	/nfs/dbraw/zinc/04/62/63/1342046263.db2.gz	GFYMWYASGBBDNX-MRXNPFEDSA-N	0	3	343.446	3.430	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2cc(C3CC3)[nH]c2C2CC2)C1	ZINC001033878442	1342055398	/nfs/dbraw/zinc/05/53/98/1342055398.db2.gz	LDBGWRKYEMOQSC-QGZVFWFLSA-N	0	3	339.483	3.329	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2cc(C)nn2C(CC)CC)C1	ZINC001033879010	1342056623	/nfs/dbraw/zinc/05/66/23/1342056623.db2.gz	NXXAMWFTTKNTQV-SFHVURJKSA-N	0	3	344.503	3.112	20	30		EGEDHN
C=CCCN1CC[C@@H](N(CC)C(=O)c2cnc(CC3CC3)s2)C1	ZINC001033905687	1342078147	/nfs/dbraw/zinc/07/81/47/1342078147.db2.gz	CEDWLNWPZMSQAN-OAHLLOKOSA-N	0	3	333.501	3.208	20	30		EGEDHN
C=C1CCC(C(=O)N(CC)[C@@H]2CCN(CCOC3CCC3)C2)CC1	ZINC001033943662	1342105250	/nfs/dbraw/zinc/10/52/50/1342105250.db2.gz	AGYFSDVNCGAXCY-GOSISDBHSA-N	0	3	334.504	3.225	20	30		EGEDHN
C#Cc1ccc(C(=O)N(CC)[C@H]2CCN(Cc3ccc(C)cc3)C2)nc1	ZINC001034023182	1342161292	/nfs/dbraw/zinc/16/12/92/1342161292.db2.gz	OGUHVOUMWLIWFP-FQEVSTJZSA-N	0	3	347.462	3.108	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)C2CCC(C(F)F)CC2)C1	ZINC001034038840	1342179458	/nfs/dbraw/zinc/17/94/58/1342179458.db2.gz	XOCPBWAYBKPCLR-GPANFISMSA-N	0	3	326.431	3.004	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cccc3oc(C)nc32)C1	ZINC001034050200	1342190620	/nfs/dbraw/zinc/19/06/20/1342190620.db2.gz	GRLMHKGJHPXIGI-HNNXBMFYSA-N	0	3	327.428	3.249	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2c[nH]c3ccc(F)cc32)C1	ZINC001034054845	1342195868	/nfs/dbraw/zinc/19/58/68/1342195868.db2.gz	RPOZLYBEYBVGNM-HNNXBMFYSA-N	0	3	329.419	3.420	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2ccc(CC)c(CC)c2)C1	ZINC001034059263	1342198553	/nfs/dbraw/zinc/19/85/53/1342198553.db2.gz	DOYTUYXDFAXEEG-FQEVSTJZSA-N	0	3	326.484	3.371	20	30		EGEDHN
Cc1cc(CN2CCCC[C@H](NC(=O)c3c[nH]c(C#N)c3)C2)cs1	ZINC001034171591	1342293626	/nfs/dbraw/zinc/29/36/26/1342293626.db2.gz	VBYAMFSJNKBYJH-INIZCTEOSA-N	0	3	342.468	3.041	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2cc(C(F)F)ccc2F)C1	ZINC001034210115	1342320418	/nfs/dbraw/zinc/32/04/18/1342320418.db2.gz	MZESKOFUKACPGC-CQSZACIVSA-N	0	3	338.373	3.371	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2oc3c(cccc3F)c2C)C1	ZINC001034245955	1342344279	/nfs/dbraw/zinc/34/42/79/1342344279.db2.gz	AVCWTWYDQASZDG-OAHLLOKOSA-N	0	3	342.414	3.488	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)c2ccc3c(c2)C(C)(C)CO3)C1	ZINC001034303729	1342387052	/nfs/dbraw/zinc/38/70/52/1342387052.db2.gz	JPZCFLJKUCDGFB-MRXNPFEDSA-N	0	3	328.456	3.127	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2nc(Cl)sc2C)C1	ZINC001034307284	1342390229	/nfs/dbraw/zinc/39/02/29/1342390229.db2.gz	UPDBUOXZESILDR-LBPRGKRZSA-N	0	3	327.881	3.265	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@H]2COc3ccc(Cl)cc32)C1	ZINC001034308169	1342391056	/nfs/dbraw/zinc/39/10/56/1342391056.db2.gz	URFANZLVABVYSN-RDJZCZTQSA-N	0	3	348.874	3.363	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2oc3ccccc3c2OC)C1	ZINC001034342337	1342414210	/nfs/dbraw/zinc/41/42/10/1342414210.db2.gz	PGXIOFUNVDWNLE-HNNXBMFYSA-N	0	3	340.423	3.049	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2c(F)ccc(F)c2OC)C1	ZINC001034341935	1342414812	/nfs/dbraw/zinc/41/48/12/1342414812.db2.gz	IQSWMBWKAUHNRE-CYBMUJFWSA-N	0	3	338.398	3.134	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)C(C)(C)c2c(C)noc2C)C1	ZINC001034355077	1342426667	/nfs/dbraw/zinc/42/66/67/1342426667.db2.gz	BOJPPLNQUJTAJM-INIZCTEOSA-N	0	3	333.476	3.116	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@@H]2CCCc3cccnc32)C1	ZINC001034366490	1342435940	/nfs/dbraw/zinc/43/59/40/1342435940.db2.gz	AITKSPRHHFFJGD-QZTJIDSGSA-N	0	3	327.472	3.048	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2ccc(F)c(Cl)c2F)C1	ZINC001034376968	1342446025	/nfs/dbraw/zinc/44/60/25/1342446025.db2.gz	QQBWKJIHQVGGSW-LBPRGKRZSA-N	0	3	340.801	3.226	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)Cc2c[nH]c3ccc(F)cc23)C1	ZINC001034418834	1342480696	/nfs/dbraw/zinc/48/06/96/1342480696.db2.gz	WFXWIKVIULSECU-INIZCTEOSA-N	0	3	329.419	3.006	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)[C@@]2(C)CCCc3ccccc32)C1	ZINC001034441550	1342503563	/nfs/dbraw/zinc/50/35/63/1342503563.db2.gz	GYDSEDLCISPYOF-NQIIRXRSSA-N	0	3	326.484	3.437	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@@]2(C)CCOc3ccccc32)C1	ZINC001034485593	1342543729	/nfs/dbraw/zinc/54/37/29/1342543729.db2.gz	FJZYHAFGPMGOFS-UWJYYQICSA-N	0	3	342.483	3.274	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)c2ccc(N(CC)CC)cc2)C1	ZINC001034506833	1342564730	/nfs/dbraw/zinc/56/47/30/1342564730.db2.gz	NBTLUBOIQLRWPT-SFHVURJKSA-N	0	3	329.488	3.303	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)Cc2nsc3ccccc32)C1	ZINC001034538925	1342598014	/nfs/dbraw/zinc/59/80/14/1342598014.db2.gz	WOVGNUFLVVTOAT-HNNXBMFYSA-N	0	3	343.496	3.386	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@@]2(C)OCCc3ccccc32)C1	ZINC001034552494	1342614813	/nfs/dbraw/zinc/61/48/13/1342614813.db2.gz	NGPBGAFYGSUYCQ-RXVVDRJESA-N	0	3	342.483	3.021	20	30		EGEDHN
Cc1ccoc1C(=O)N[C@H]1CC[C@H](NCc2ccccc2C#N)CC1	ZINC001034594237	1342638913	/nfs/dbraw/zinc/63/89/13/1342638913.db2.gz	FWCZXVHZJUOXTF-IYARVYRRSA-N	0	3	337.423	3.291	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1CC[C@H](NC(=O)[C@H]2CCC2(F)F)CC1	ZINC001034667031	1342679401	/nfs/dbraw/zinc/67/94/01/1342679401.db2.gz	HGFSMBHKIWACRX-BRWVUGGUSA-N	0	3	347.409	3.121	20	30		EGEDHN
CC(C)[C@H]1C[C@H]1C(=O)N[C@H]1CC[C@H](NCc2ccccc2C#N)CC1	ZINC001034771775	1342751155	/nfs/dbraw/zinc/75/11/55/1342751155.db2.gz	STAXEBQWWUDGCX-UAFMIMERSA-N	0	3	339.483	3.367	20	30		EGEDHN
N#Cc1ccc(CNCc2ccc(CNC(=O)C3CCC3)cc2)cc1	ZINC001034806015	1342770875	/nfs/dbraw/zinc/77/08/75/1342770875.db2.gz	OMKDYEWLFGXIQQ-UHFFFAOYSA-N	0	3	333.435	3.264	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC[C@@H]1CNCc1cccc(Cl)c1Cl	ZINC001034886451	1342821316	/nfs/dbraw/zinc/82/13/16/1342821316.db2.gz	KWCDXNODQYHOGR-WCQYABFASA-N	0	3	340.254	3.234	20	30		EGEDHN
CC1(C)CC(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)s2)C1	ZINC001034925943	1342838774	/nfs/dbraw/zinc/83/87/74/1342838774.db2.gz	NKCUGEMLAHJUHE-CQSZACIVSA-N	0	3	331.485	3.137	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001034944798	1342846287	/nfs/dbraw/zinc/84/62/87/1342846287.db2.gz	OHLIUHLRNRMKSI-QGZVFWFLSA-N	0	3	345.462	3.460	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)C2(C3CC3)CCC2)s1	ZINC001035004735	1342871154	/nfs/dbraw/zinc/87/11/54/1342871154.db2.gz	JUPWBPPWVJPIJB-OAHLLOKOSA-N	0	3	343.496	3.281	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]1CNCc1cnc(Cl)s1	ZINC001035013745	1342875761	/nfs/dbraw/zinc/87/57/61/1342875761.db2.gz	GSEOVLHWYMZACX-LLVKDONJSA-N	0	3	327.881	3.089	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)C[C@H]2CC=CCC2)s1	ZINC001035014678	1342876363	/nfs/dbraw/zinc/87/63/63/1342876363.db2.gz	RSJQLCFACZQALX-JKSUJKDBSA-N	0	3	343.496	3.447	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)C2CC3(CCC3)C2)s1	ZINC001035021265	1342880818	/nfs/dbraw/zinc/88/08/18/1342880818.db2.gz	XRCSNPGDJLQNJO-OAHLLOKOSA-N	0	3	343.496	3.281	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2nc(C)c(C)s2)C12CCC2	ZINC001078812008	1357094098	/nfs/dbraw/zinc/09/40/98/1357094098.db2.gz	CJIKPZFKEBOVSZ-STQMWFEESA-N	0	3	339.892	3.143	20	30		EGEDHN
C=C[C@@H](C(=O)N1CCC[C@@H]1CNCc1ccccn1)c1ccccc1	ZINC001035134671	1342950297	/nfs/dbraw/zinc/95/02/97/1342950297.db2.gz	ZUIHPWVBKPFHSH-WOJBJXKFSA-N	0	3	335.451	3.132	20	30		EGEDHN
C[C@@H]1C[C@@H]1C(=O)N1CCC2(CCN(Cc3ccc(C#N)s3)C2)CC1	ZINC001035156158	1342971551	/nfs/dbraw/zinc/97/15/51/1342971551.db2.gz	JIUABBTWRLDEQJ-PBHICJAKSA-N	0	3	343.496	3.090	20	30		EGEDHN
CCc1ccc(CN2CC3(C2)CCN(C(=O)C#CC2CC2)CC3)cc1	ZINC001035700887	1343141986	/nfs/dbraw/zinc/14/19/86/1343141986.db2.gz	KYTSKJRKCSYDPM-UHFFFAOYSA-N	0	3	336.479	3.087	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H](C)Oc1cccc(F)c1)CC2	ZINC001035710551	1343145548	/nfs/dbraw/zinc/14/55/48/1343145548.db2.gz	VPKPWJMTPWEACX-MRXNPFEDSA-N	0	3	346.446	3.094	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cc1ccc3cccnc3c1)CC2	ZINC001035732234	1343158470	/nfs/dbraw/zinc/15/84/70/1343158470.db2.gz	YBCWYGDNPHGTSC-UHFFFAOYSA-N	0	3	349.478	3.278	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@@H]1CCCC[C@H]1C1CC1)CC2	ZINC001035757247	1343172759	/nfs/dbraw/zinc/17/27/59/1343172759.db2.gz	IBMWJLOAEOCKRP-RBUKOAKNSA-N	0	3	328.500	3.151	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cc1cc(C)ccc1C)CC2	ZINC001035782150	1343192674	/nfs/dbraw/zinc/19/26/74/1343192674.db2.gz	ICWHTPOPKGUGFK-UHFFFAOYSA-N	0	3	326.484	3.346	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)C[C@@H](C)c1cccc(F)c1)CC2	ZINC001035792017	1343202306	/nfs/dbraw/zinc/20/23/06/1343202306.db2.gz	LKZDTWKIQQZKTR-QGZVFWFLSA-N	0	3	342.458	3.267	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)CO[C@H]1CCC[C@@H](C)C1)CC2	ZINC001035810166	1343210193	/nfs/dbraw/zinc/21/01/93/1343210193.db2.gz	UYDLNAKNSQCHTR-MSOLQXFVSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cnc(C)nc1C(C)C)CC2	ZINC001035810998	1343210856	/nfs/dbraw/zinc/21/08/56/1343210856.db2.gz	AHDCRVFAQRLLPS-UHFFFAOYSA-N	0	3	342.487	3.023	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc(Cl)cc(OC)c1)CC2	ZINC001035822102	1343215642	/nfs/dbraw/zinc/21/56/42/1343215642.db2.gz	QVMZZHRIRLFCGM-UHFFFAOYSA-N	0	3	348.874	3.463	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)COc1cccc(CC)c1)CC2	ZINC001035846224	1343227065	/nfs/dbraw/zinc/22/70/65/1343227065.db2.gz	FEIATHKPNBSHJJ-UHFFFAOYSA-N	0	3	342.483	3.128	20	30		EGEDHN
C[C@H]1CN(C(=O)C2CCCCC2)CC[C@H]1NCc1ccccc1C#N	ZINC001035887178	1343249291	/nfs/dbraw/zinc/24/92/91/1343249291.db2.gz	JYGIEQRUNIZPNH-OXJNMPFZSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC(C)(C)C)CC[C@H]1NCc1cc(F)ccc1C#N	ZINC001035906179	1343263140	/nfs/dbraw/zinc/26/31/40/1343263140.db2.gz	APZIAUAGHZUAAA-RDTXWAMCSA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2(C)CC2)CC[C@H]1NCc1ccccc1C#N	ZINC001036123989	1343317631	/nfs/dbraw/zinc/31/76/31/1343317631.db2.gz	PZZNBOUASLOSHW-CRAIPNDOSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCCN(C(=O)C2CCC2)C1	ZINC001036341694	1343427876	/nfs/dbraw/zinc/42/78/76/1343427876.db2.gz	WBTJZPXXOLDYDK-BEFAXECRSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCCN(C(=O)c2ccco2)C1	ZINC001036346746	1343433448	/nfs/dbraw/zinc/43/34/48/1343433448.db2.gz	WZHQJKNPIMVJGP-MAUKXSAKSA-N	0	3	337.423	3.182	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]([C@H](C)NCc2ccccc2C#N)C1	ZINC001036429121	1343481914	/nfs/dbraw/zinc/48/19/14/1343481914.db2.gz	SUBILBSNNLGTOL-LPHOPBHVSA-N	0	3	339.483	3.487	20	30		EGEDHN
C[C@H]1CCCN(C(=O)C2CCC2)[C@@H]1CNCc1ccc(C#N)s1	ZINC001036485341	1343509500	/nfs/dbraw/zinc/50/95/00/1343509500.db2.gz	HMZVBPGEBPEDHD-SUMWQHHRSA-N	0	3	331.485	3.137	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@@H]2[C@H](CCN2CC#Cc2ccc(F)cc2)C1	ZINC001036626666	1343583584	/nfs/dbraw/zinc/58/35/84/1343583584.db2.gz	APBQUXFCNDHSEZ-UYAOXDASSA-N	0	3	342.458	3.146	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001036652784	1343602784	/nfs/dbraw/zinc/60/27/84/1343602784.db2.gz	XZXLTDHDCLHTFN-MAUKXSAKSA-N	0	3	345.512	3.479	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@H]3[C@H](CCN3CC#Cc3ccccc3)C2)co1	ZINC001036699571	1343638748	/nfs/dbraw/zinc/63/87/48/1343638748.db2.gz	RJZIDPIFVADKGK-CTNGQTDRSA-N	0	3	348.446	3.176	20	30		EGEDHN
CC1(C(=O)N2CC[C@H]3[C@@H](CCN3CC#Cc3ccccc3)C2)CCC1	ZINC001036793139	1343725724	/nfs/dbraw/zinc/72/57/24/1343725724.db2.gz	ZYEHPDAJOPKPBN-PMACEKPBSA-N	0	3	336.479	3.151	20	30		EGEDHN
CC(F)(F)CC(=O)N1CC[C@H]2[C@@H](CCN2Cc2ccccc2C#N)C1	ZINC001036811125	1343745694	/nfs/dbraw/zinc/74/56/94/1343745694.db2.gz	LWQASZHFHOJXGB-IRXDYDNUSA-N	0	3	347.409	3.026	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H]3[C@@H](CCN3Cc3cnc(C)o3)C2)CC1	ZINC001036811938	1343747467	/nfs/dbraw/zinc/74/74/67/1343747467.db2.gz	YZTWGEPWJBTIIJ-PKOBYXMFSA-N	0	3	343.471	3.152	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]3[C@H](CCN3Cc3cnc(C)s3)C2)C1	ZINC001036815338	1343752673	/nfs/dbraw/zinc/75/26/73/1343752673.db2.gz	CJRHUXWTPLZNQV-WBVHZDCISA-N	0	3	345.512	3.231	20	30		EGEDHN
O=C(C1CC2(CC2)C1)N1CC[C@H]2[C@@H](CCN2CC#Cc2ccccc2)C1	ZINC001036818540	1343756422	/nfs/dbraw/zinc/75/64/22/1343756422.db2.gz	CVVFUZZDYBEQRU-FPOVZHCZSA-N	0	3	348.490	3.151	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCC[C@@H]1NC(=O)C1CC=CC1	ZINC001037180328	1344022820	/nfs/dbraw/zinc/02/28/20/1344022820.db2.gz	FZHIPDWDLKTBPF-PMACEKPBSA-N	0	3	337.467	3.289	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCC[C@@H]2CNCc2cc(C)no2)C1	ZINC001037236524	1344059937	/nfs/dbraw/zinc/05/99/37/1344059937.db2.gz	RPUNVXSYLBWEMY-NVXWUHKLSA-N	0	3	331.460	3.104	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCCC[C@H]2CNCc2ocnc2C)CC1	ZINC001037237624	1344060666	/nfs/dbraw/zinc/06/06/66/1344060666.db2.gz	VQUSVSUOBYHGOC-ROUUACIJSA-N	0	3	345.487	3.494	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3cnns3)[C@H](CC)C2)CC1	ZINC001037924303	1344184211	/nfs/dbraw/zinc/18/42/11/1344184211.db2.gz	LPBJSVOVKIXJBS-PBHICJAKSA-N	0	3	348.516	3.001	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1ncoc1-c1ccccc1	ZINC001038326646	1344381177	/nfs/dbraw/zinc/38/11/77/1344381177.db2.gz	HJUDGOWMNZXFMC-MRXNPFEDSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC001038416261	1344419089	/nfs/dbraw/zinc/41/90/89/1344419089.db2.gz	MIEKGBQRQDNBFF-RBSFLKMASA-N	0	3	330.394	3.288	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NC[C@@H]1CCN1CCC(C)(C)C	ZINC001038428460	1344424249	/nfs/dbraw/zinc/42/42/49/1344424249.db2.gz	RDOZKODDXSPWIP-INIZCTEOSA-N	0	3	330.472	3.492	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1cc(Cl)cc2c1OCC2	ZINC001039056793	1344739775	/nfs/dbraw/zinc/73/97/75/1344739775.db2.gz	LHHNBNYNPQJWND-OAHLLOKOSA-N	0	3	334.847	3.045	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC([C@@H]2CCN(CC=C(Cl)Cl)C2)CC1	ZINC001039127682	1344805341	/nfs/dbraw/zinc/80/53/41/1344805341.db2.gz	SDPMUDWMIDHKAO-TZMCWYRMSA-N	0	3	344.286	3.026	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc3c(o2)CCCC3)C1	ZINC001039209739	1344922958	/nfs/dbraw/zinc/92/29/58/1344922958.db2.gz	LDXMKPKFBRUDKG-ROUUACIJSA-N	0	3	340.467	3.108	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc(C)c(F)cc2F)C1	ZINC001039210524	1344924571	/nfs/dbraw/zinc/92/45/71/1344924571.db2.gz	BGYJSFJLUILAAC-DNVCBOLYSA-N	0	3	346.421	3.223	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cccc(F)c2C)C1	ZINC001039212968	1344927995	/nfs/dbraw/zinc/92/79/95/1344927995.db2.gz	ZDTLYAOTIFNHAI-FXAWDEMLSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)CCc2ccsc2)C1	ZINC001039213811	1344929092	/nfs/dbraw/zinc/92/90/92/1344929092.db2.gz	LZQJLWXFTYBXCH-ZWKOTPCHSA-N	0	3	330.497	3.017	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(C)c(F)c2)C1	ZINC001039216716	1344933522	/nfs/dbraw/zinc/93/35/22/1344933522.db2.gz	RGUPSWIPTAUMFQ-MJGOQNOKSA-N	0	3	328.431	3.084	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc3ccsc3[nH]2)C1	ZINC001039224336	1344941869	/nfs/dbraw/zinc/94/18/69/1344941869.db2.gz	DSSWKTUBYKZKSX-NVXWUHKLSA-N	0	3	341.480	3.179	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)CCc2cccc(C)c2)C1	ZINC001039224380	1344942097	/nfs/dbraw/zinc/94/20/97/1344942097.db2.gz	FQRYFCUKYXAMIJ-NHCUHLMSSA-N	0	3	338.495	3.264	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2csc(C)c2)C1	ZINC001039232231	1344953010	/nfs/dbraw/zinc/95/30/10/1344953010.db2.gz	URZLRMYTDPYUEM-FUHWJXTLSA-N	0	3	330.497	3.396	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(C)cc2F)C1	ZINC001039240518	1344965751	/nfs/dbraw/zinc/96/57/51/1344965751.db2.gz	XMLRIAQRJHUFBG-APWZRJJASA-N	0	3	328.431	3.084	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)Cc2ccccc2F)C1	ZINC001039241333	1344967261	/nfs/dbraw/zinc/96/72/61/1344967261.db2.gz	ZMWIIUQAGPZWSI-UYAOXDASSA-N	0	3	342.458	3.095	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc(C)c(CC)o2)C1	ZINC001039242986	1344969374	/nfs/dbraw/zinc/96/93/74/1344969374.db2.gz	DYQBTASYHKLESV-ZWKOTPCHSA-N	0	3	342.483	3.490	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccc3cccnc3c2)C1	ZINC001039248132	1344978137	/nfs/dbraw/zinc/97/81/37/1344978137.db2.gz	RFZXSVCDSOEGSX-FPOVZHCZSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc3[nH]ccc3s2)C1	ZINC001039249458	1344979312	/nfs/dbraw/zinc/97/93/12/1344979312.db2.gz	IQWRFQQLHRGFFK-HOCLYGCPSA-N	0	3	341.480	3.179	20	30		EGEDHN
N#Cc1ccccc1CNC1C[C@H]2CCC[C@@H](C1)N2C(=O)C1CCC1	ZINC001039254573	1344985491	/nfs/dbraw/zinc/98/54/91/1344985491.db2.gz	WHWCQFLQAMBGLA-IHWFROFDSA-N	0	3	337.467	3.360	20	30		EGEDHN
CCCc1ccc(CN2CC[C@H]3CC[C@@H](C2)N3C(=O)[C@H](C)C#N)cc1	ZINC001039348770	1345022908	/nfs/dbraw/zinc/02/29/08/1345022908.db2.gz	CFUFJKFRGVPZFX-AHRSYUTCSA-N	0	3	339.483	3.364	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(-c2ccncc2)o1	ZINC001039386498	1345039228	/nfs/dbraw/zinc/03/92/28/1345039228.db2.gz	QGZUGYZWJCHNKV-MSOLQXFVSA-N	0	3	349.434	3.044	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1CCCc2ccccc21	ZINC001039394765	1345044181	/nfs/dbraw/zinc/04/41/81/1345044181.db2.gz	IISVJJISIMCUFF-DYXWJJEUSA-N	0	3	336.479	3.195	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H](C)c1c(C)noc1C	ZINC001039395826	1345044709	/nfs/dbraw/zinc/04/47/09/1345044709.db2.gz	LVEYQEALUFXLKQ-XYPHTWIQSA-N	0	3	331.460	3.036	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cnc2ccccc2c1C	ZINC001039408401	1345052642	/nfs/dbraw/zinc/05/26/42/1345052642.db2.gz	NQDMTRYXTRKKJT-MSOLQXFVSA-N	0	3	347.462	3.245	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@H]1OCCc2ccsc21	ZINC001039461387	1345080417	/nfs/dbraw/zinc/08/04/17/1345080417.db2.gz	OJGFLBLCEZRNCE-IXDOHACOSA-N	0	3	346.496	3.003	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](OC)c1ccc(F)cc1	ZINC001039476025	1345090976	/nfs/dbraw/zinc/09/09/76/1345090976.db2.gz	VYQCYPOSOBSIJO-QYZOEREBSA-N	0	3	346.446	3.155	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CCC[C@@H](C1)N2C[C@H]1CCO[C@@H](C)C1	ZINC001039820633	1345199311	/nfs/dbraw/zinc/19/93/11/1345199311.db2.gz	KEIZOOBQLLMVCW-XLAORIBOSA-N	0	3	334.504	3.079	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@]3(CCN(C(=O)C=C4CCC4)C3)C2)c1	ZINC001040153052	1345357415	/nfs/dbraw/zinc/35/74/15/1345357415.db2.gz	MDDHPAWIZLSIPP-JOCHJYFZSA-N	0	3	349.478	3.483	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)Cc3ccccc3CC)C2)C1	ZINC001040256915	1345397755	/nfs/dbraw/zinc/39/77/55/1345397755.db2.gz	BORZKRWNLBBSFN-QFIPXVFZSA-N	0	3	338.495	3.129	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3ccsc3COC)C2)C1	ZINC001040263716	1345402614	/nfs/dbraw/zinc/40/26/14/1345402614.db2.gz	HPNFGRPAQWYNBL-GOSISDBHSA-N	0	3	334.485	3.009	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(Cl)cc3F)C2)C1	ZINC001040284407	1345412088	/nfs/dbraw/zinc/41/20/88/1345412088.db2.gz	VQUQVYYPQRJNDY-LJQANCHMSA-N	0	3	348.849	3.431	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(C(C)C)cn3)C2)C1	ZINC001040393370	1345473580	/nfs/dbraw/zinc/47/35/80/1345473580.db2.gz	BAWQHAONRCCAIJ-OAQYLSRUSA-N	0	3	339.483	3.156	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3ccc(Cl)c(F)c3)C2)C1	ZINC001040419663	1345487167	/nfs/dbraw/zinc/48/71/67/1345487167.db2.gz	XUCTXLPQWXHNJR-SFHVURJKSA-N	0	3	334.822	3.040	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cnc(C)nc3C(C)C)C2)C1	ZINC001040432637	1345495436	/nfs/dbraw/zinc/49/54/36/1345495436.db2.gz	OSBVVUQCUNQEGM-HXUWFJFHSA-N	0	3	342.487	3.023	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ccoc3CCC)C2)C1	ZINC001040492383	1345518151	/nfs/dbraw/zinc/51/81/51/1345518151.db2.gz	QPLVMOGWIKHSCB-HXUWFJFHSA-N	0	3	328.456	3.184	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cnc(C4CC4)s3)C2)C1	ZINC001040500779	1345521792	/nfs/dbraw/zinc/52/17/92/1345521792.db2.gz	QZNFKXOQQQKERV-SFHVURJKSA-N	0	3	331.485	3.135	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3occ4c3CCCC4)C2)C1	ZINC001040505860	1345524535	/nfs/dbraw/zinc/52/45/35/1345524535.db2.gz	IVMRIIBQYLAFBS-NRFANRHFSA-N	0	3	340.467	3.110	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)Cc3ccccc3Cl)C2)C1	ZINC001040518505	1345529618	/nfs/dbraw/zinc/52/96/18/1345529618.db2.gz	AIKZHALMHONWFR-HXUWFJFHSA-N	0	3	344.886	3.220	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)Cc3ccc4ccccc4c3)C2)C1	ZINC001040522550	1345531441	/nfs/dbraw/zinc/53/14/41/1345531441.db2.gz	MYVOYQFTROBAQQ-QHCPKHFHSA-N	0	3	346.474	3.330	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@@H](C)Cc3ccccc3)C2)C1	ZINC001040543252	1345538617	/nfs/dbraw/zinc/53/86/17/1345538617.db2.gz	MXZCAOCHGANKDU-SIKLNZKXSA-N	0	3	338.495	3.203	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cccc4c3CCC4)C2)C1	ZINC001040547428	1345542348	/nfs/dbraw/zinc/54/23/48/1345542348.db2.gz	LOLIRVOBHAEUHL-JOCHJYFZSA-N	0	3	336.479	3.127	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)N1CCC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001040590239	1345551439	/nfs/dbraw/zinc/55/14/39/1345551439.db2.gz	OJAWDIPTBYDSFA-VQIMIIECSA-N	0	3	337.467	3.029	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CCN(C(=O)/C=C\C4CC4)C3)CC2)c1	ZINC001040649626	1345559582	/nfs/dbraw/zinc/55/95/82/1345559582.db2.gz	YZNFXYGDFXKOQR-SREVYHEPSA-N	0	3	349.478	3.339	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cc(F)c(C)cc3F)C2)CC1	ZINC001040735283	1345572105	/nfs/dbraw/zinc/57/21/05/1345572105.db2.gz	MZTKPIZKWFMWGL-UHFFFAOYSA-N	0	3	346.421	3.225	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccoc3C3CC3)C2)CC1	ZINC001040821432	1345583129	/nfs/dbraw/zinc/58/31/29/1345583129.db2.gz	GHKUFNRQJJQXHB-UHFFFAOYSA-N	0	3	326.440	3.108	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@@H](C)c3ccsc3)C2)CC1	ZINC001040847648	1345587886	/nfs/dbraw/zinc/58/78/86/1345587886.db2.gz	UXASXSVCIWFWCX-INIZCTEOSA-N	0	3	330.497	3.189	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@@]3(C)C[C@@H]3c3ccccc3)C2)CC1	ZINC001040883559	1345594434	/nfs/dbraw/zinc/59/44/34/1345594434.db2.gz	XLKWRXRLPPQMHJ-CTNGQTDRSA-N	0	3	336.479	3.128	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccc4cnccc4c3)C2)CC1	ZINC001040906522	1345597480	/nfs/dbraw/zinc/59/74/80/1345597480.db2.gz	HYYPWTFTBALQDR-UHFFFAOYSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)C(C)(C)c3ccc(F)cc3)C2)CC1	ZINC001040919020	1345599881	/nfs/dbraw/zinc/59/98/81/1345599881.db2.gz	FXYKSYMCMNLSFX-UHFFFAOYSA-N	0	3	342.458	3.051	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccc(CC)c(CC)c3)C2)CC1	ZINC001040960961	1345610840	/nfs/dbraw/zinc/61/08/40/1345610840.db2.gz	OWDDIUYVXIZYQL-UHFFFAOYSA-N	0	3	338.495	3.373	20	30		EGEDHN
CC(C)(C)CC(=O)N1CC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001041051315	1345636260	/nfs/dbraw/zinc/63/62/60/1345636260.db2.gz	IBXQGTJVRUXEPT-OAQYLSRUSA-N	0	3	339.483	3.419	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@]3(CCN(C(=O)C[C@@H]4C=CCC4)C3)C2)cc1	ZINC001041053385	1345637881	/nfs/dbraw/zinc/63/78/81/1345637881.db2.gz	JBPLHWKDOXDCFL-GCJKJVERSA-N	0	3	349.478	3.339	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@]3(CCN(C(=O)C[C@@H]4C=CCC4)C3)C2)c1	ZINC001041055811	1345638516	/nfs/dbraw/zinc/63/85/16/1345638516.db2.gz	ZDOBNPJCSQHPTP-GCJKJVERSA-N	0	3	349.478	3.339	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@]3(CCN(C(=O)C[C@H]4C=CCC4)C3)C2)c1	ZINC001041055814	1345638967	/nfs/dbraw/zinc/63/89/67/1345638967.db2.gz	ZDOBNPJCSQHPTP-PGRDOPGGSA-N	0	3	349.478	3.339	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001041077870	1345646418	/nfs/dbraw/zinc/64/64/18/1345646418.db2.gz	PCGGSDXVUOOQLC-OAQYLSRUSA-N	0	3	339.483	3.419	20	30		EGEDHN
C[C@@H](c1cccc(F)c1)N1CC[C@@]2(CCN(C(=O)C#CC3CC3)C2)C1	ZINC001041266707	1345690645	/nfs/dbraw/zinc/69/06/45/1345690645.db2.gz	VGOKSWZBBNHHRE-HRAATJIYSA-N	0	3	340.442	3.225	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@]2(CCN(C[C@H](F)CC)C2)C1	ZINC001041320544	1345701749	/nfs/dbraw/zinc/70/17/49/1345701749.db2.gz	CYMMHDLPENPJOK-PBHICJAKSA-N	0	3	330.875	3.438	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)[C@@H]3CCCc4ccccc43)C2)C1	ZINC001041406984	1345720424	/nfs/dbraw/zinc/72/04/24/1345720424.db2.gz	FSEWISYTIBCDLO-IFMALSPDSA-N	0	3	336.479	3.054	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cccc4c(C)c(C)[nH]c43)C2)C1	ZINC001041412369	1345722175	/nfs/dbraw/zinc/72/21/75/1345722175.db2.gz	LADNBZUIKWHPEY-JOCHJYFZSA-N	0	3	349.478	3.346	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cc(F)cc4ccoc43)C2)C1	ZINC001041420698	1345724890	/nfs/dbraw/zinc/72/48/90/1345724890.db2.gz	BLSHPWCONGASNT-HXUWFJFHSA-N	0	3	340.398	3.133	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccc(-n4cccc4)cc3)C2)C1	ZINC001041447565	1345729585	/nfs/dbraw/zinc/72/95/85/1345729585.db2.gz	ADVZLWLKGYYTPG-QFIPXVFZSA-N	0	3	347.462	3.039	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3cc4ccccc4cc3F)C2)C1	ZINC001041464542	1345735628	/nfs/dbraw/zinc/73/56/28/1345735628.db2.gz	RMCHPAIRKBBLDZ-NRFANRHFSA-N	0	3	336.410	3.150	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001041543935	1345758695	/nfs/dbraw/zinc/75/86/95/1345758695.db2.gz	LXVQYIFPBNUFQO-OAQYLSRUSA-N	0	3	337.467	3.195	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@]2(CCN(Cc3ccccc3F)C2)C1	ZINC001041543965	1345759061	/nfs/dbraw/zinc/75/90/61/1345759061.db2.gz	MEQOKZPICKDDPQ-HXUWFJFHSA-N	0	3	330.447	3.462	20	30		EGEDHN
C[C@@]1(C(=O)N2CC[C@]3(CCN(Cc4ccc(C#N)cc4)C3)C2)C=CCC1	ZINC001041560143	1345770204	/nfs/dbraw/zinc/77/02/04/1345770204.db2.gz	PFVKLQZSQLLWLE-YADHBBJMSA-N	0	3	349.478	3.339	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@]2(CCN(Cc3ncccc3C)C2)C1	ZINC001041624790	1345800122	/nfs/dbraw/zinc/80/01/22/1345800122.db2.gz	CPYILAGVAIGNEP-NHCUHLMSSA-N	0	3	341.499	3.417	20	30		EGEDHN
CC(F)(F)CC(=O)N1CC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001041647061	1345809262	/nfs/dbraw/zinc/80/92/62/1345809262.db2.gz	WBYVPJXPVPPHSK-LJQANCHMSA-N	0	3	347.409	3.028	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@]3(CCN(C(=O)C4CC5(CC5)C4)C3)C2)c1	ZINC001041664503	1345815713	/nfs/dbraw/zinc/81/57/13/1345815713.db2.gz	NDTZHJQVVQDRDS-QFIPXVFZSA-N	0	3	349.478	3.173	20	30		EGEDHN
C=CCN1CC[C@@]2(CCN(C(=O)c3cc(C(CC)CC)no3)C2)C1	ZINC001041729921	1345834807	/nfs/dbraw/zinc/83/48/07/1345834807.db2.gz	XOKSPJMEQOIMHS-LJQANCHMSA-N	0	3	331.460	3.302	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccc4sccc4c3)C2)C1	ZINC001041766892	1345843213	/nfs/dbraw/zinc/84/32/13/1345843213.db2.gz	CNCXETGYVBQZPX-FQEVSTJZSA-N	0	3	338.476	3.463	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cccc4ccsc43)C2)C1	ZINC001041772300	1345844792	/nfs/dbraw/zinc/84/47/92/1345844792.db2.gz	JTFUKROMIUCUBF-HXUWFJFHSA-N	0	3	338.476	3.463	20	30		EGEDHN
N#CC1(CNC(=O)C[C@@H](N)c2ccc(Cl)cc2Cl)CCC1	ZINC001219632979	1373721164	/nfs/dbraw/zinc/72/11/64/1373721164.db2.gz	VIUISEFSPXIPCR-CYBMUJFWSA-N	0	3	326.227	3.193	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)Cc3ccc4ccccc4c3)C2)C1	ZINC001041821019	1345863473	/nfs/dbraw/zinc/86/34/73/1345863473.db2.gz	CAJKRWMTDMJANX-HSZRJFAPSA-N	0	3	346.474	3.330	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cc4cc(C)ccc4o3)C2)C1	ZINC001041844421	1345870935	/nfs/dbraw/zinc/87/09/35/1345870935.db2.gz	HTNQZWJCOITTKS-NRFANRHFSA-N	0	3	336.435	3.303	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3CCN(C(=O)c4ccccc4)C[C@@H]32)c1	ZINC001041909997	1345892914	/nfs/dbraw/zinc/89/29/14/1345892914.db2.gz	LIQPXURCBLFEKZ-FPOVZHCZSA-N	0	3	345.446	3.295	20	30		EGEDHN
CC(C)(C)CC(=O)N1CC[C@@H]2CCN(Cc3cccc(C#N)c3)[C@@H]2C1	ZINC001041929955	1345900637	/nfs/dbraw/zinc/90/06/37/1345900637.db2.gz	VKZKYMCXNJATGH-RBUKOAKNSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(F)cc4ccncc43)C[C@@H]21	ZINC001042065186	1345934075	/nfs/dbraw/zinc/93/40/75/1345934075.db2.gz	PWLFABCHFDIVBB-KUHUBIRLSA-N	0	3	339.414	3.096	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3cc(F)c(C)cc3F)C[C@H]21	ZINC001042104049	1345945464	/nfs/dbraw/zinc/94/54/64/1345945464.db2.gz	ZWSRZBBEUFBOGA-RDTXWAMCSA-N	0	3	334.410	3.386	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(C)c4ccccc4n3)C[C@@H]21	ZINC001042115209	1345947668	/nfs/dbraw/zinc/94/76/68/1345947668.db2.gz	SWCHMGBBOAHLTB-JXFKEZNVSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc4c([nH]3)c(F)ccc4C)C[C@H]21	ZINC001042123611	1345950162	/nfs/dbraw/zinc/95/01/62/1345950162.db2.gz	UFPYEKBIXCVTCH-RDTXWAMCSA-N	0	3	341.430	3.338	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc4c([nH]3)c(F)ccc4C)C[C@@H]21	ZINC001042123610	1345950263	/nfs/dbraw/zinc/95/02/63/1345950263.db2.gz	UFPYEKBIXCVTCH-KSSFIOAISA-N	0	3	341.430	3.338	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3cc(COC)cs3)C[C@@H]21	ZINC001042134960	1345952831	/nfs/dbraw/zinc/95/28/31/1345952831.db2.gz	RMAVPOBAZCYUNM-CVEARBPZSA-N	0	3	334.485	3.007	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)Cn3c(C)cc4ccccc43)C[C@@H]21	ZINC001042140759	1345954019	/nfs/dbraw/zinc/95/40/19/1345954019.db2.gz	ANZUCTBUDNIJQL-PXNSSMCTSA-N	0	3	337.467	3.059	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cc(C)cc(Cl)c3)C[C@@H]21	ZINC001042156456	1345958766	/nfs/dbraw/zinc/95/87/66/1345958766.db2.gz	JCSNOTGGWAQSMF-YJBOKZPZSA-N	0	3	330.859	3.208	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)CCc3ccc(Cl)cc3)C[C@@H]21	ZINC001042168433	1345963617	/nfs/dbraw/zinc/96/36/17/1345963617.db2.gz	UZDCJESPMBZXAC-MJGOQNOKSA-N	0	3	344.886	3.219	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3sccc3-n3cccc3)C[C@H]21	ZINC001042175238	1345966803	/nfs/dbraw/zinc/96/68/03/1345966803.db2.gz	AHIJWJUPNFLASZ-DOTOQJQBSA-N	0	3	341.480	3.261	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cncc4sccc43)C[C@@H]21	ZINC001042205580	1345983361	/nfs/dbraw/zinc/98/33/61/1345983361.db2.gz	XUQLEHWFEBTCOQ-BBRMVZONSA-N	0	3	327.453	3.019	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3ccc(C#N)cc3)[C@H]2C1	ZINC001042208899	1345986994	/nfs/dbraw/zinc/98/69/94/1345986994.db2.gz	UPWJPTJRAIKANH-MOPGFXCFSA-N	0	3	339.483	3.417	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)C(C)(C)c3cccc(F)c3)C[C@H]21	ZINC001042229515	1345997289	/nfs/dbraw/zinc/99/72/89/1345997289.db2.gz	FQUABHXGRMNPPE-QFBILLFUSA-N	0	3	342.458	3.049	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(Cl)c(OC)c3)C[C@H]21	ZINC001042257765	1346008642	/nfs/dbraw/zinc/00/86/42/1346008642.db2.gz	LSGGWEORRNUSTO-CZUORRHYSA-N	0	3	334.847	3.071	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cc(Cl)ccc3C)C[C@@H]21	ZINC001042275154	1346015162	/nfs/dbraw/zinc/01/51/62/1346015162.db2.gz	RHAWJGVUVYTNHI-YJBOKZPZSA-N	0	3	330.859	3.208	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cnn(C4CCCCC4)c3)C[C@@H]21	ZINC001042305071	1346025517	/nfs/dbraw/zinc/02/55/17/1346025517.db2.gz	WOXHFOXWINJVEX-LPHOPBHVSA-N	0	3	342.487	3.111	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3oc(CCC)nc3C)C[C@@H]21	ZINC001042315000	1346030036	/nfs/dbraw/zinc/03/00/36/1346030036.db2.gz	YFCYYKPFGDBRPQ-HOTGVXAUSA-N	0	3	331.460	3.048	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)Cc3cccc4ccccc43)C[C@@H]21	ZINC001042323095	1346033204	/nfs/dbraw/zinc/03/32/04/1346033204.db2.gz	RAAWTTNPCLJSNM-UGKGYDQZSA-N	0	3	346.474	3.328	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3occ4c3CCCC4)C[C@H]21	ZINC001042330823	1346038700	/nfs/dbraw/zinc/03/87/00/1346038700.db2.gz	HFITWJMJIOQXJF-CRAIPNDOSA-N	0	3	328.456	3.271	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(OC4CCC4)cc3)C[C@@H]21	ZINC001042362308	1346055769	/nfs/dbraw/zinc/05/57/69/1346055769.db2.gz	JJYQUEVEZUKALE-JXFKEZNVSA-N	0	3	340.467	3.340	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc(F)c4occc43)C[C@@H]21	ZINC001042362715	1346056325	/nfs/dbraw/zinc/05/63/25/1346056325.db2.gz	MCIBLNSYJZINBN-KSSFIOAISA-N	0	3	340.398	3.132	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3c(Cl)cccc3OC)C[C@@H]21	ZINC001042370937	1346060527	/nfs/dbraw/zinc/06/05/27/1346060527.db2.gz	JBCSWKNYJGCUJU-HOCLYGCPSA-N	0	3	348.874	3.461	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3c(Cl)cccc3OC)C[C@H]21	ZINC001042370935	1346060608	/nfs/dbraw/zinc/06/06/08/1346060608.db2.gz	JBCSWKNYJGCUJU-GDBMZVCRSA-N	0	3	348.874	3.461	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3csc(C4CC4)n3)C[C@@H]21	ZINC001042375438	1346063397	/nfs/dbraw/zinc/06/33/97/1346063397.db2.gz	XHHCJBGXTZJEQK-BBRMVZONSA-N	0	3	331.485	3.133	20	30		EGEDHN
Cc1cccc(C(=O)N2CC[C@H](NCc3ccccc3C#N)C[C@@H]2C)n1	ZINC001044480469	1346344632	/nfs/dbraw/zinc/34/46/32/1346344632.db2.gz	BOBFMWSULHYNLW-LPHOPBHVSA-N	0	3	348.450	3.045	20	30		EGEDHN
Cc1cnccc1C(=O)N1CC[C@@H](NCc2ccccc2C#N)C[C@@H]1C	ZINC001044590344	1346377336	/nfs/dbraw/zinc/37/73/36/1346377336.db2.gz	ZJAWSKYCHVLSAU-QFBILLFUSA-N	0	3	348.450	3.045	20	30		EGEDHN
C[C@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)C1CC2(CC2)C1	ZINC001044738868	1346417331	/nfs/dbraw/zinc/41/73/31/1346417331.db2.gz	GYOHEIDMPFWXRD-HNAYVOBHSA-N	0	3	337.467	3.218	20	30		EGEDHN
Cc1cc(C)c(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)s2)o1	ZINC001044982236	1346473896	/nfs/dbraw/zinc/47/38/96/1346473896.db2.gz	PKAOJNLUDCLNPT-AWEZNQCLSA-N	0	3	343.452	3.224	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H]1CNCc1cccc(OCC)n1	ZINC001045148693	1346505987	/nfs/dbraw/zinc/50/59/87/1346505987.db2.gz	FPXHODDJHYJBJA-KRWDZBQOSA-N	0	3	345.487	3.163	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)[C@@]23C[C@@H]2CCCC3)s1	ZINC001045190320	1346524345	/nfs/dbraw/zinc/52/43/45/1346524345.db2.gz	AYHOVDQRIJWUFW-DOXZYTNZSA-N	0	3	343.496	3.281	20	30		EGEDHN
CC1(NC(=O)c2ccccc2)CCN(Cc2cccc(C#N)c2)CC1	ZINC001045349997	1346569711	/nfs/dbraw/zinc/56/97/11/1346569711.db2.gz	ORKGBKHQQWAHLC-UHFFFAOYSA-N	0	3	333.435	3.343	20	30		EGEDHN
Cc1ccoc1C(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045364151	1346574829	/nfs/dbraw/zinc/57/48/29/1346574829.db2.gz	ZIQSZLHVZLDXDI-UHFFFAOYSA-N	0	3	337.423	3.244	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2ccc(F)c3ccncc23)CC1	ZINC001045533687	1346619938	/nfs/dbraw/zinc/61/99/38/1346619938.db2.gz	TUMVQBMHPPFYCV-UHFFFAOYSA-N	0	3	327.403	3.144	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1	ZINC001045562825	1346629763	/nfs/dbraw/zinc/62/97/63/1346629763.db2.gz	SUPXLWRMBFSQKF-QZTJIDSGSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2[nH]c3ccc(C)cc3c2C)CC1	ZINC001045605864	1346643248	/nfs/dbraw/zinc/64/32/48/1346643248.db2.gz	IBFAHTGKOKPSRM-UHFFFAOYSA-N	0	3	337.467	3.392	20	30		EGEDHN
CC(C)[C@H]1C[C@H]1C(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045607512	1346644906	/nfs/dbraw/zinc/64/49/06/1346644906.db2.gz	XIUUXBSXBYJESD-RTBURBONSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2cnn(CCC(C)C)c2C)CC1	ZINC001045617057	1346648943	/nfs/dbraw/zinc/64/89/43/1346648943.db2.gz	NRUPWQNLPNGTMW-UHFFFAOYSA-N	0	3	332.492	3.008	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2cc(C)n(CC3CC3)c2C)CC1	ZINC001045618652	1346649203	/nfs/dbraw/zinc/64/92/03/1346649203.db2.gz	SFUHLYYSYRCSTH-UHFFFAOYSA-N	0	3	329.488	3.285	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2ccc(CC(C)C)cc2)CC1	ZINC001045635840	1346654861	/nfs/dbraw/zinc/65/48/61/1346654861.db2.gz	VZASHDYHAOMDLF-UHFFFAOYSA-N	0	3	326.484	3.493	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc3cc(C)cn3c1)C2	ZINC001045944269	1346779832	/nfs/dbraw/zinc/77/98/32/1346779832.db2.gz	JAHPADDVHGUODX-QFIPXVFZSA-N	0	3	349.478	3.199	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc(C)c(F)cc1F)C2	ZINC001045946477	1346782032	/nfs/dbraw/zinc/78/20/32/1346782032.db2.gz	QRJUEISECHIYCA-HXUWFJFHSA-N	0	3	346.421	3.225	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)COC1CCCCC1)C2	ZINC001045948459	1346783733	/nfs/dbraw/zinc/78/37/33/1346783733.db2.gz	JXJAJIHFVJCZGD-NRFANRHFSA-N	0	3	346.515	3.064	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc(Cl)ccc1F)C2	ZINC001045950630	1346785718	/nfs/dbraw/zinc/78/57/18/1346785718.db2.gz	HXGANWPICMAHNE-LJQANCHMSA-N	0	3	348.849	3.431	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc(C)n(CC)c1C)C2	ZINC001045950674	1346785746	/nfs/dbraw/zinc/78/57/46/1346785746.db2.gz	IURDEXWVVJOJSN-OAQYLSRUSA-N	0	3	341.499	3.076	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)C[C@@H]1CC=CCC1)C2	ZINC001045956948	1346792047	/nfs/dbraw/zinc/79/20/47/1346792047.db2.gz	PUJALFNLXHDSIK-TZIWHRDSSA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cccc3ncccc31)C2	ZINC001045958650	1346793286	/nfs/dbraw/zinc/79/32/86/1346793286.db2.gz	VEVQYSUYHOFWQF-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)C1(C(F)F)CCCC1)C2	ZINC001045959888	1346794681	/nfs/dbraw/zinc/79/46/81/1346794681.db2.gz	CFGDSXDGKLPIRB-SFHVURJKSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1nccc3ccccc31)C2	ZINC001045960244	1346795552	/nfs/dbraw/zinc/79/55/52/1346795552.db2.gz	HVNKYLNHWXCETH-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@H]1CCCC(F)(F)C1)C2	ZINC001045965367	1346800326	/nfs/dbraw/zinc/80/03/26/1346800326.db2.gz	GNQXSAGRNIVNMW-WMZOPIPTSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@H](C)c1cccs1)C2	ZINC001045966471	1346802127	/nfs/dbraw/zinc/80/21/27/1346802127.db2.gz	XHRGMECZUMINEQ-VQIMIIECSA-N	0	3	330.497	3.189	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cccc(F)c1Cl)C2	ZINC001045969328	1346804545	/nfs/dbraw/zinc/80/45/45/1346804545.db2.gz	OOZSMNMBHUVSEN-IBGZPJMESA-N	0	3	348.849	3.431	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccccc1Cl)C2	ZINC001045981720	1346820511	/nfs/dbraw/zinc/82/05/11/1346820511.db2.gz	YREPARSPYUOEHU-LJQANCHMSA-N	0	3	330.859	3.291	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cccc(OC)c1)C2	ZINC001045982132	1346821024	/nfs/dbraw/zinc/82/10/24/1346821024.db2.gz	OWYHTTGSYDBAHC-OAQYLSRUSA-N	0	3	340.467	3.037	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccoc1C(C)C)C2	ZINC001045985719	1346827193	/nfs/dbraw/zinc/82/71/93/1346827193.db2.gz	AQXAILLYCOWMLA-FQEVSTJZSA-N	0	3	328.456	3.354	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2ccn(C3CCCCC3)n2)C1	ZINC001046314176	1346931464	/nfs/dbraw/zinc/93/14/64/1346931464.db2.gz	FOBZWFJSWGKGNG-IBGZPJMESA-N	0	3	330.476	3.159	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N[C@@]1(C)CCN(Cc2csc(C)c2)C1	ZINC001046327262	1346935686	/nfs/dbraw/zinc/93/56/86/1346935686.db2.gz	IZWRFDGCKVCZQC-AOIWGVFYSA-N	0	3	348.512	3.118	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@]2(C)CCN(Cc3cccc(CC)c3)C2)nc1	ZINC001046781239	1347097879	/nfs/dbraw/zinc/09/78/79/1347097879.db2.gz	GFQVCBRMUACFRG-JOCHJYFZSA-N	0	3	347.462	3.020	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@]2(C)CCN(Cc3ccc(CC)cc3)C2)nc1	ZINC001046783099	1347098194	/nfs/dbraw/zinc/09/81/94/1347098194.db2.gz	JAZGCRWQWUCKQV-QFIPXVFZSA-N	0	3	347.462	3.020	20	30		EGEDHN
C=C(C)CCN1CC[C@@](C)(NC(=O)c2ccc(P(C)(C)=O)cc2)C1	ZINC001046850753	1347129684	/nfs/dbraw/zinc/12/96/84/1347129684.db2.gz	XCQAPXMXQZVCJC-LJQANCHMSA-N	0	3	348.427	3.095	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2cccc(F)c2C)C1	ZINC001046940477	1347157744	/nfs/dbraw/zinc/15/77/44/1347157744.db2.gz	VPQKSCXEFOOTKJ-AWEZNQCLSA-N	0	3	340.389	3.397	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2ccc(CC)o2)C1	ZINC001046954120	1347162771	/nfs/dbraw/zinc/16/27/71/1347162771.db2.gz	QHUKOFVDMSHXKI-CYBMUJFWSA-N	0	3	326.387	3.105	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CN(CCCF)CCC2(F)F)CC1	ZINC001046969373	1347170755	/nfs/dbraw/zinc/17/07/55/1347170755.db2.gz	ANZSDUQHAUXZPM-HNNXBMFYSA-N	0	3	332.410	3.166	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2cccc3cc[nH]c32)C1	ZINC001046975987	1347173232	/nfs/dbraw/zinc/17/32/32/1347173232.db2.gz	ZWNLGWPHRKZVIM-HNNXBMFYSA-N	0	3	347.409	3.431	20	30		EGEDHN
Cc1occc1C(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1ccccc1)C2	ZINC001047021694	1347189818	/nfs/dbraw/zinc/18/98/18/1347189818.db2.gz	ZVZGJJGPPPDCJA-UFYCRDLUSA-N	0	3	348.446	3.222	20	30		EGEDHN
CC(C)(C)C(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(Cc1ccc(F)c(C#N)c1)C2	ZINC001047187849	1347235270	/nfs/dbraw/zinc/23/52/70/1347235270.db2.gz	GXBLKMXJYRZFKT-XIRDDKMYSA-N	0	3	343.446	3.213	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)[C@@H]3CC=CCC3)C2)CC1	ZINC001047220974	1347252883	/nfs/dbraw/zinc/25/28/83/1347252883.db2.gz	AANNUBATRJIKKM-WOJBJXKFSA-N	0	3	328.500	3.317	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)c3cc(C)co3)C2)CC1	ZINC001047249061	1347274129	/nfs/dbraw/zinc/27/41/29/1347274129.db2.gz	RFDYUDCIPHZNLF-GOSISDBHSA-N	0	3	328.456	3.176	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)CCc3cccs3)C2)CC1	ZINC001047264670	1347285327	/nfs/dbraw/zinc/28/53/27/1347285327.db2.gz	LKJAQJVZQYUVNL-SFHVURJKSA-N	0	3	344.524	3.265	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3cccn3C(C)C)C2)CC1	ZINC001047265837	1347287151	/nfs/dbraw/zinc/28/71/51/1347287151.db2.gz	XLAVJJAPYUNDQJ-IBGZPJMESA-N	0	3	341.499	3.266	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@@H]([C@@H](C)NCc3ccccc3C#N)C2)o1	ZINC001047697408	1347337717	/nfs/dbraw/zinc/33/77/17/1347337717.db2.gz	GSUCPGHSHPVNRR-CRAIPNDOSA-N	0	3	337.423	3.100	20	30		EGEDHN
Cc1ccoc1C(=O)N1CC[C@H]([C@H](C)NCc2ccccc2C#N)C1	ZINC001047726591	1347352226	/nfs/dbraw/zinc/35/22/26/1347352226.db2.gz	SUCWSVDSXBGEDZ-YJBOKZPZSA-N	0	3	337.423	3.100	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)C2(F)CCCC2)C1	ZINC001047887409	1347399514	/nfs/dbraw/zinc/39/95/14/1347399514.db2.gz	NNZQROJOCQMPFH-CRAIPNDOSA-N	0	3	343.446	3.167	20	30		EGEDHN
C[C@H](NCc1cc(F)ccc1C#N)[C@@H]1CCN(C(=O)CC2(C)CC2)C1	ZINC001047908020	1347405362	/nfs/dbraw/zinc/40/53/62/1347405362.db2.gz	HPHVIYRRAQZJJF-GOEBONIOSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]([C@@H](C)NCc2nc(C)oc2C)C1	ZINC001047924310	1347411154	/nfs/dbraw/zinc/41/11/54/1347411154.db2.gz	MXWSDIQJTPMKFT-CZUORRHYSA-N	0	3	333.476	3.220	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]([C@@H](C)NCc2csc(C)n2)C1	ZINC001047924337	1347411321	/nfs/dbraw/zinc/41/13/21/1347411321.db2.gz	NFSBBCJARNZXDW-HIFRSBDPSA-N	0	3	335.517	3.380	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)C(C)(C)C(F)F)C1	ZINC001047966691	1347427211	/nfs/dbraw/zinc/42/72/11/1347427211.db2.gz	SRUIPVFJBQFMRX-XJKSGUPXSA-N	0	3	349.425	3.176	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]([C@H](C)NCc3csc(C)n3)C2)C1	ZINC001047967858	1347428170	/nfs/dbraw/zinc/42/81/70/1347428170.db2.gz	YTLJNOXEHNNPLN-ZFWWWQNUSA-N	0	3	333.501	3.134	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]([C@@H](C)NCc3nc(C)cs3)C2)C1	ZINC001047972037	1347430285	/nfs/dbraw/zinc/43/02/85/1347430285.db2.gz	OKOHNPZQWXBBQI-HUUCEWRRSA-N	0	3	333.501	3.134	20	30		EGEDHN
C[C@@H]1CN(C(=O)/C=C\c2ccco2)C[C@@H]1CNCc1ccccc1C#N	ZINC001048108957	1347469361	/nfs/dbraw/zinc/46/93/61/1347469361.db2.gz	QAPQCRXAMDJCND-RQUZMNLWSA-N	0	3	349.434	3.049	20	30		EGEDHN
C[C@H]1CN(C(=O)CC(C)(C)C)C[C@H]1CNCc1ccccc1C#N	ZINC001048147599	1347481195	/nfs/dbraw/zinc/48/11/95/1347481195.db2.gz	NIYLGMQXEVOWFF-MAUKXSAKSA-N	0	3	327.472	3.179	20	30		EGEDHN
CC(C)=C(F)C(=O)N1C[C@@H](CNCc2cc(F)ccc2C#N)[C@H](C)C1	ZINC001048210196	1347495671	/nfs/dbraw/zinc/49/56/71/1347495671.db2.gz	LAIROUSGISCBNF-CZUORRHYSA-N	0	3	347.409	3.145	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@H](C)[C@H](CNCc2cscn2)C1	ZINC001048272251	1347508012	/nfs/dbraw/zinc/50/80/12/1347508012.db2.gz	WZRDIUVZXQDCKH-WCQYABFASA-N	0	3	341.908	3.106	20	30		EGEDHN
C[C@H]1CN(C(=O)C2(C)CCC2)C[C@H]1CNCc1cc(F)ccc1C#N	ZINC001048345769	1347525451	/nfs/dbraw/zinc/52/54/51/1347525451.db2.gz	WSVIYGQYGWUZBI-WMLDXEAASA-N	0	3	343.446	3.072	20	30		EGEDHN
CCC(C)(C)C(=O)N1C[C@@H](C)[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001048357925	1347529786	/nfs/dbraw/zinc/52/97/86/1347529786.db2.gz	HXWMWGRSHRCSRZ-PBHICJAKSA-N	0	3	345.462	3.318	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](CNCc3csc(CC)n3)[C@H](C)C2)C1	ZINC001048373980	1347534839	/nfs/dbraw/zinc/53/48/39/1347534839.db2.gz	LXYWIKXAFNTIJK-HUUCEWRRSA-N	0	3	347.528	3.246	20	30		EGEDHN
CC(C)C1(C(=O)N2C[C@@H](CNCc3ccccc3C#N)[C@H](C)C2)CC1	ZINC001048374856	1347535039	/nfs/dbraw/zinc/53/50/39/1347535039.db2.gz	RTCFVSFLUOAPQP-VQIMIIECSA-N	0	3	339.483	3.179	20	30		EGEDHN
N#Cc1ccccc1CN1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)C1CC=CC1)C2	ZINC001048511972	1347573058	/nfs/dbraw/zinc/57/30/58/1347573058.db2.gz	QXZUQFZRDRMIOA-HTWNETDVSA-N	0	3	349.478	3.384	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)[C@H]2[C@@H]3CCC[C@@H]32)CC1	ZINC001048625881	1347624191	/nfs/dbraw/zinc/62/41/91/1347624191.db2.gz	QYZUENAMNRFRJT-PMOLBWCYSA-N	0	3	339.483	3.107	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CN(C(=O)CC4=CCCCC4)C[C@@H]3C2)c1	ZINC001048724486	1347647095	/nfs/dbraw/zinc/64/70/95/1347647095.db2.gz	APBLOBDOPNUFAH-OYRHEFFESA-N	0	3	349.478	3.339	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@H]2C1	ZINC001048975252	1347694918	/nfs/dbraw/zinc/69/49/18/1347694918.db2.gz	UDIFIHBCXMLLLA-KDURUIRLSA-N	0	3	337.467	3.051	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CN(Cc3c(C)noc3CC)C[C@H]2C1	ZINC001049034936	1347711939	/nfs/dbraw/zinc/71/19/39/1347711939.db2.gz	IYMIGRKDHLUJPS-GQIGUUNPSA-N	0	3	345.487	3.038	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc(C(C)(C)C)s3)C[C@@H]2C1	ZINC001049226900	1347751172	/nfs/dbraw/zinc/75/11/72/1347751172.db2.gz	TXRCVALHUIFHMZ-GASCZTMLSA-N	0	3	330.497	3.073	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@H]2[C@H]1CCN2Cc1cc2ccccc2o1	ZINC001049380750	1347811600	/nfs/dbraw/zinc/81/16/00/1347811600.db2.gz	GZIFQLVUSKMGEE-FHLIZLRMSA-N	0	3	337.423	3.158	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C[C@@H]1C[C@H]1c1ccccc1	ZINC001049479402	1347869183	/nfs/dbraw/zinc/86/91/83/1347869183.db2.gz	KAWHRPZWDSGNCZ-UWHLTILDSA-N	0	3	336.479	3.269	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1conc1C1CCCC1	ZINC001049517655	1347887526	/nfs/dbraw/zinc/88/75/26/1347887526.db2.gz	LPIZRCWUAFFXBB-MSOLQXFVSA-N	0	3	341.455	3.034	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ocnc1-c1ccccc1	ZINC001049519291	1347888429	/nfs/dbraw/zinc/88/84/29/1347888429.db2.gz	RDALUFJAHYIEIK-DLBZAZTESA-N	0	3	337.423	3.207	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(-n2cccc2)cc1	ZINC001049579535	1347919636	/nfs/dbraw/zinc/91/96/36/1347919636.db2.gz	LMFULJQLCVWLAS-NHCUHLMSSA-N	0	3	347.462	3.180	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1nc(Cl)sc1C	ZINC001049588837	1347924477	/nfs/dbraw/zinc/92/44/77/1347924477.db2.gz	OGIGSUQDGQSYCC-OLZOCXBDSA-N	0	3	339.892	3.360	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(C(C)(C)C)on1	ZINC001049590008	1347925455	/nfs/dbraw/zinc/92/54/55/1347925455.db2.gz	WLHUSOIUOALCGP-HOTGVXAUSA-N	0	3	331.460	3.227	20	30		EGEDHN
CC1(CC(=O)N2CCC[C@H]3[C@H]2CCN3Cc2ccc(C#N)cc2)CC1	ZINC001049602136	1347931728	/nfs/dbraw/zinc/93/17/28/1347931728.db2.gz	LCYSFTMHGWUWPR-RBUKOAKNSA-N	0	3	337.467	3.314	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1ncccc1C	ZINC001049635906	1347946576	/nfs/dbraw/zinc/94/65/76/1347946576.db2.gz	NQVZBUINXACWSV-ROUUACIJSA-N	0	3	327.472	3.168	20	30		EGEDHN
C[C@]1(C(=O)N2CCC[C@H]3[C@@H]2CCN3Cc2ccc(C#N)cc2)C=CCC1	ZINC001049644405	1347952223	/nfs/dbraw/zinc/95/22/23/1347952223.db2.gz	JDFVJDDLUVNUDJ-ONTIZHBOSA-N	0	3	349.478	3.480	20	30		EGEDHN
CC1(C(=O)N2CCC[C@H]3[C@@H]2CCN3Cc2cccc(C#N)c2)CCC1	ZINC001049646585	1347952978	/nfs/dbraw/zinc/95/29/78/1347952978.db2.gz	PDGVCDZLYMNDDW-OALUTQOASA-N	0	3	337.467	3.314	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccccc1-n1cccc1	ZINC001049686805	1347971742	/nfs/dbraw/zinc/97/17/42/1347971742.db2.gz	HOEIWEKPHLPPCH-VQTJNVASSA-N	0	3	335.451	3.342	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@@H]3[C@@H]2CCN3Cc2ccc(C#N)cc2)CC1	ZINC001049694954	1347976497	/nfs/dbraw/zinc/97/64/97/1347976497.db2.gz	GDRCJQYJGORCJT-MOPGFXCFSA-N	0	3	337.467	3.314	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H]2[C@H]1CCN2CCc1ccns1	ZINC001049699467	1347979150	/nfs/dbraw/zinc/97/91/50/1347979150.db2.gz	HVCBEEAAPZLPTO-YQVWRLOYSA-N	0	3	347.528	3.353	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C[C@@H](C)c1ccc(CC)cc1	ZINC001049716163	1347988755	/nfs/dbraw/zinc/98/87/55/1347988755.db2.gz	ZQZDOGZRSGNRIG-JRGCBEDISA-N	0	3	338.495	3.441	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)CC(C1CCC1)C1CCC1	ZINC001049717944	1347989578	/nfs/dbraw/zinc/98/95/78/1347989578.db2.gz	HRDAMHGIRZQLQB-WOJBJXKFSA-N	0	3	328.500	3.291	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(OCC)c(C)c1	ZINC001049762429	1348007344	/nfs/dbraw/zinc/00/73/44/1348007344.db2.gz	OWTRWJCOTQERGL-OALUTQOASA-N	0	3	340.467	3.096	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccccc1OC	ZINC001049778850	1348017110	/nfs/dbraw/zinc/01/71/10/1348017110.db2.gz	ZFRMUZWOXOLBOS-MANSERQUSA-N	0	3	340.467	3.050	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C1(c2ccccc2F)CC1	ZINC001049821505	1348038996	/nfs/dbraw/zinc/03/89/96/1348038996.db2.gz	ZVSDPCVPQSZFHR-ZWKOTPCHSA-N	0	3	328.431	3.109	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cnn(C(C)C)c1C1CC1	ZINC001049837753	1348050237	/nfs/dbraw/zinc/05/02/37/1348050237.db2.gz	RFYMNQKPLNINSC-MSOLQXFVSA-N	0	3	342.487	3.206	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H]1CCCN2C(=O)CC12CC3CC(CC(C3)C1)C2	ZINC001049866014	1348072376	/nfs/dbraw/zinc/07/23/76/1348072376.db2.gz	XGFSWTGAWQMLBM-CHAHAOGTSA-N	0	3	340.511	3.291	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc2c(s1)CCCC2	ZINC001049875978	1348080554	/nfs/dbraw/zinc/08/05/54/1348080554.db2.gz	GWUFDSWBLKPWJS-SJORKVTESA-N	0	3	342.508	3.329	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1csc2c1CCCC2	ZINC001049880558	1348085502	/nfs/dbraw/zinc/08/55/02/1348085502.db2.gz	GQMWQRHKQAUZCE-DLBZAZTESA-N	0	3	330.497	3.492	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)CCc1ccccc1Cl	ZINC001049886841	1348091167	/nfs/dbraw/zinc/09/11/67/1348091167.db2.gz	VBDICQNCHUCPBF-RBUKOAKNSA-N	0	3	344.886	3.361	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1sc(CCC)nc1C	ZINC001049888853	1348093403	/nfs/dbraw/zinc/09/34/03/1348093403.db2.gz	ABNGAWNWZSSEGX-HZPDHXFCSA-N	0	3	345.512	3.106	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(COC(C)C)cc1	ZINC001049888822	1348093820	/nfs/dbraw/zinc/09/38/20/1348093820.db2.gz	LCPRRICGCRRKJF-WOJBJXKFSA-N	0	3	342.483	3.477	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1ccc2ccccc2c1	ZINC001049890655	1348095388	/nfs/dbraw/zinc/09/53/88/1348095388.db2.gz	XOMMEFYJACIYBR-YADHBBJMSA-N	0	3	346.474	3.471	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)CCc1ccc(Cl)s1	ZINC001049892092	1348095676	/nfs/dbraw/zinc/09/56/76/1348095676.db2.gz	ZKBLJWBJCQODLE-HUUCEWRRSA-N	0	3	336.888	3.033	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1c[nH]cc1-c1ccccc1	ZINC001049898017	1348099157	/nfs/dbraw/zinc/09/91/57/1348099157.db2.gz	VQOOEOVIMIEGJV-SFTDATJTSA-N	0	3	347.462	3.384	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](C)c1ccc(F)c(F)c1	ZINC001049905148	1348103845	/nfs/dbraw/zinc/10/38/45/1348103845.db2.gz	VLLSACNPZGSUOD-MORSLUCNSA-N	0	3	334.410	3.320	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1	ZINC001049920303	1348112628	/nfs/dbraw/zinc/11/26/28/1348112628.db2.gz	AQIIXMBZJDRVBG-MTQWCTHYSA-N	0	3	340.442	3.018	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1c[nH]c2c1cccc2CC	ZINC001049921709	1348113820	/nfs/dbraw/zinc/11/38/20/1348113820.db2.gz	XRIYIJQQHOCJHG-UXHICEINSA-N	0	3	349.478	3.433	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(N(C)CCC)cc1	ZINC001049924211	1348115913	/nfs/dbraw/zinc/11/59/13/1348115913.db2.gz	CBSRLFLWHYWWTN-VQTJNVASSA-N	0	3	341.499	3.398	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@]1(C)CCc2ccccc2C1	ZINC001049937847	1348123256	/nfs/dbraw/zinc/12/32/56/1348123256.db2.gz	WCVZRPYENHVGNG-SJBKTWHCSA-N	0	3	338.495	3.433	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21)C1CC1	ZINC001050009889	1348152810	/nfs/dbraw/zinc/15/28/10/1348152810.db2.gz	FGLGHDZUTDQEMT-RYGJVYDSSA-N	0	3	337.467	3.027	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3oc(C(C)C)nc3C)[C@@H]2C1	ZINC001050160341	1348199780	/nfs/dbraw/zinc/19/97/80/1348199780.db2.gz	WSLQWQQYBQLUTM-JKSUJKDBSA-N	0	3	331.460	3.219	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)Cc3cccc4ccccc43)[C@@H]2C1	ZINC001050189118	1348205561	/nfs/dbraw/zinc/20/55/61/1348205561.db2.gz	SCCUZHWUSMBRBT-PZJWPPBQSA-N	0	3	334.463	3.491	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001050486139	1348278037	/nfs/dbraw/zinc/27/80/37/1348278037.db2.gz	POFNYSWFLHCKNM-UHFFFAOYSA-N	0	3	341.430	3.246	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cc(Cl)ccc3F)C2)CC1	ZINC001050585287	1348294061	/nfs/dbraw/zinc/29/40/61/1348294061.db2.gz	FSERSPDZEUSTAL-UHFFFAOYSA-N	0	3	334.822	3.040	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)Cc3c(C)cc(C)cc3C)C2)CC1	ZINC001050645641	1348313917	/nfs/dbraw/zinc/31/39/17/1348313917.db2.gz	SGOYWHKNQFRHKG-UHFFFAOYSA-N	0	3	338.495	3.102	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@@H](CC)Cc3cccc(C)c3)C2)CC1	ZINC001050691487	1348328746	/nfs/dbraw/zinc/32/87/46/1348328746.db2.gz	XOMVPWKKMPYVKH-FQEVSTJZSA-N	0	3	338.495	3.121	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C[C@H](C)c3ccccc3F)C2)CC1	ZINC001050701656	1348331239	/nfs/dbraw/zinc/33/12/39/1348331239.db2.gz	NYYYOUDEVONQLZ-KRWDZBQOSA-N	0	3	342.458	3.267	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H]3CC[C@H](C(C)C)CC3)C2)CC1	ZINC001050709442	1348333016	/nfs/dbraw/zinc/33/30/16/1348333016.db2.gz	USBWXRWFTWMALW-WGSAOQKQSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3csc4c3CC[C@H](C)C4)C2)CC1	ZINC001050745554	1348346298	/nfs/dbraw/zinc/34/62/98/1348346298.db2.gz	XMFHRRGVMIUMPZ-HNNXBMFYSA-N	0	3	342.508	3.044	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3oc4ccccc4c3C)C2)CC1	ZINC001050746045	1348346719	/nfs/dbraw/zinc/34/67/19/1348346719.db2.gz	DJFBVWKROOELIN-UHFFFAOYSA-N	0	3	336.435	3.303	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3ccc(F)cc3)cccc2C1	ZINC001051277871	1348415062	/nfs/dbraw/zinc/41/50/62/1348415062.db2.gz	BEURFRCKTBGVTB-UHFFFAOYSA-N	0	3	336.410	3.137	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3cncc(F)c3)cccc2C1	ZINC001051284471	1348417772	/nfs/dbraw/zinc/41/77/72/1348417772.db2.gz	VJWLTIGRESTPDE-UHFFFAOYSA-N	0	3	339.414	3.085	20	30		EGEDHN
CC(C)=CCN1CCc2c(CNC(=O)c3cc(C#N)c[nH]3)cccc2C1	ZINC001051285404	1348418465	/nfs/dbraw/zinc/41/84/65/1348418465.db2.gz	KILQKMHMWDWKCE-UHFFFAOYSA-N	0	3	348.450	3.141	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3c(C)cncc3C)cccc2C1	ZINC001051293937	1348422835	/nfs/dbraw/zinc/42/28/35/1348422835.db2.gz	XNYXZWJMFJDHRU-UHFFFAOYSA-N	0	3	347.462	3.010	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CCCN(CCC(F)(F)F)CC1	ZINC001052446705	1348543555	/nfs/dbraw/zinc/54/35/55/1348543555.db2.gz	PAHPQMFYJAOBAK-AWEZNQCLSA-N	0	3	343.393	3.211	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cc3c(ccc(C)c3C)[nH]2)CC1	ZINC001052620712	1348597819	/nfs/dbraw/zinc/59/78/19/1348597819.db2.gz	SBJZHARGGWMPJE-KRWDZBQOSA-N	0	3	337.467	3.392	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCCN(Cc3c(C)onc3CC)CC2)C1	ZINC001052691415	1348635110	/nfs/dbraw/zinc/63/51/10/1348635110.db2.gz	UJRMOEWLJRIZIP-INIZCTEOSA-N	0	3	345.487	3.372	20	30		EGEDHN
Cc1cc(C(=O)N[C@H]2CCCN(Cc3ccc(C#N)cc3)CC2)ccn1	ZINC001052808676	1348686221	/nfs/dbraw/zinc/68/62/21/1348686221.db2.gz	DEQARPBBUDTQMM-FQEVSTJZSA-N	0	3	348.450	3.046	20	30		EGEDHN
COc1ccc(CN2CCC[C@@H](NC(=O)C(C)(C)C)CC2)cc1C#N	ZINC001052886453	1348723413	/nfs/dbraw/zinc/72/34/13/1348723413.db2.gz	KWHDUKYPGZBHHS-QGZVFWFLSA-N	0	3	343.471	3.084	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2coc3ccc(Cl)cc23)CC1	ZINC001052900648	1348734425	/nfs/dbraw/zinc/73/44/25/1348734425.db2.gz	JCYILEYIGYXDNA-CQSZACIVSA-N	0	3	330.815	3.304	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc(OCC(C)C)cc2)CC1	ZINC001052911721	1348743636	/nfs/dbraw/zinc/74/36/36/1348743636.db2.gz	NKDQOQPEXZGAIN-LJQANCHMSA-N	0	3	342.483	3.329	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cc(F)c(F)cc2Cl)CC1	ZINC001052910994	1348743906	/nfs/dbraw/zinc/74/39/06/1348743906.db2.gz	ZBIHLDJAHFADAV-LBPRGKRZSA-N	0	3	340.801	3.226	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cc3c(s2)CC[C@@H](C)C3)CC1	ZINC001052924159	1348750385	/nfs/dbraw/zinc/75/03/85/1348750385.db2.gz	VPCWXABKGIQQKL-WBVHZDCISA-N	0	3	344.524	3.481	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2c(C)noc2C)C1	ZINC001053067900	1348880998	/nfs/dbraw/zinc/88/09/98/1348880998.db2.gz	SLBLEZFENBGKEZ-QZTJIDSGSA-N	0	3	343.471	3.021	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2oc(C)nc2C)C1	ZINC001053075528	1348893259	/nfs/dbraw/zinc/89/32/59/1348893259.db2.gz	HOYJZDOVAWXKHS-ROUUACIJSA-N	0	3	343.471	3.021	20	30		EGEDHN
C=C(C)CN1CCC[C@H]([C@@H]2CCCCN2C(=O)C(=O)C(C)(C)C)C1	ZINC001053077443	1348896951	/nfs/dbraw/zinc/89/69/51/1348896951.db2.gz	JTYLRGKGXRNOBT-IRXDYDNUSA-N	0	3	334.504	3.271	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2[nH]ccc2C2CC2)C1	ZINC001053087614	1348912122	/nfs/dbraw/zinc/91/21/22/1348912122.db2.gz	MSAJQTHTDMKCJL-MJGOQNOKSA-N	0	3	339.483	3.232	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ncc(C)cc2C)C1	ZINC001053089559	1348915733	/nfs/dbraw/zinc/91/57/33/1348915733.db2.gz	CFUGKIAOTHKXCA-RTBURBONSA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cc[nH]c2C(C)C)C1	ZINC001053094113	1348922890	/nfs/dbraw/zinc/92/28/90/1348922890.db2.gz	CTHHJQMNHQUWPC-PKOBYXMFSA-N	0	3	341.499	3.478	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2occc2Cl)C1	ZINC001053096914	1348926759	/nfs/dbraw/zinc/92/67/59/1348926759.db2.gz	BFABDFPRSMDYOO-HOCLYGCPSA-N	0	3	334.847	3.273	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cc(C)cc(F)c2)C1	ZINC001053098036	1348929671	/nfs/dbraw/zinc/92/96/71/1348929671.db2.gz	JHQVFYBUWQLLRC-YLJYHZDGSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(C)cc2F)C1	ZINC001053099712	1348932516	/nfs/dbraw/zinc/93/25/16/1348932516.db2.gz	XYOVCMNOKVGMHI-XLIONFOSSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2nc(C)c(C)s2)C1	ZINC001053104063	1348939076	/nfs/dbraw/zinc/93/90/76/1348939076.db2.gz	BPPRVIMZUFZQOS-IAGOWNOFSA-N	0	3	345.512	3.100	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cccn2CC)C1	ZINC001053104804	1348941388	/nfs/dbraw/zinc/94/13/88/1348941388.db2.gz	JOEBHMZNHCMFFS-RBUKOAKNSA-N	0	3	341.499	3.238	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccnc(C)c2)C1	ZINC001053105289	1348942096	/nfs/dbraw/zinc/94/20/96/1348942096.db2.gz	SWGJILZCQZCPKP-VQTJNVASSA-N	0	3	339.483	3.120	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)C2CCC=CCC2)C1	ZINC001053106228	1348944017	/nfs/dbraw/zinc/94/40/17/1348944017.db2.gz	SRMBERJCLHGSPB-WOJBJXKFSA-N	0	3	328.500	3.459	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001054111493	1349150416	/nfs/dbraw/zinc/15/04/16/1349150416.db2.gz	XNOGYQXPAASFFF-PQTHCYMGSA-N	0	3	337.467	3.339	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1oc(C(F)F)cc1C)C2	ZINC001054148286	1349154928	/nfs/dbraw/zinc/15/49/28/1349154928.db2.gz	LIKHTWDVYDRPPC-GOSISDBHSA-N	0	3	336.382	3.087	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc(C)sc1C)C2	ZINC001054160226	1349162060	/nfs/dbraw/zinc/16/20/60/1349162060.db2.gz	YUPHMQFKZJSJSE-LJQANCHMSA-N	0	3	330.497	3.316	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc(C)n(CC)c1C)C2	ZINC001054161159	1349163509	/nfs/dbraw/zinc/16/35/09/1349163509.db2.gz	YNSTYMMRURULOH-OAQYLSRUSA-N	0	3	341.499	3.076	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1c(C)oc(C)c1C)C2	ZINC001054162001	1349164049	/nfs/dbraw/zinc/16/40/49/1349164049.db2.gz	UUZNKTDRFPGFAW-FQEVSTJZSA-N	0	3	328.456	3.156	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@H](C)OC1CCCCCC1)C2	ZINC001054194307	1349196633	/nfs/dbraw/zinc/19/66/33/1349196633.db2.gz	NKSSFQUDBWXFKN-GHTZIAJQSA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc(C(C)C)oc1C)C2	ZINC001054221769	1349217069	/nfs/dbraw/zinc/21/70/69/1349217069.db2.gz	BAINVSXKMIVDPG-FQEVSTJZSA-N	0	3	328.456	3.273	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)Cc1c[nH]c3ccccc13)C2	ZINC001054231707	1349225591	/nfs/dbraw/zinc/22/55/91/1349225591.db2.gz	XWDKWLBWJNROJR-JOCHJYFZSA-N	0	3	349.478	3.048	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(OC(C)C)cc1)C2	ZINC001054236426	1349229160	/nfs/dbraw/zinc/22/91/60/1349229160.db2.gz	KLESOEISVVNMJP-OAQYLSRUSA-N	0	3	340.467	3.035	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)C3CC(OC)C3)cc2C1	ZINC001054269811	1349269437	/nfs/dbraw/zinc/26/94/37/1349269437.db2.gz	QJYQHLNJIYXVSR-UHFFFAOYSA-N	0	3	328.456	3.010	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3cc(F)c[nH]3)cc2C1	ZINC001054274718	1349275378	/nfs/dbraw/zinc/27/53/78/1349275378.db2.gz	QQRXDDUWRSLZQB-UHFFFAOYSA-N	0	3	327.403	3.366	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cccn4ccnc34)cc2C1	ZINC001054285591	1349287826	/nfs/dbraw/zinc/28/78/26/1349287826.db2.gz	PPTYZSDGOKFUFQ-UHFFFAOYSA-N	0	3	346.434	3.156	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@H]3CCO[C@H](C)C3)cc2C1	ZINC001054287113	1349290358	/nfs/dbraw/zinc/29/03/58/1349290358.db2.gz	ZMXAXNKAOOGGKO-AEFFLSMTSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cn4ccccc4n3)cc2C1	ZINC001054291456	1349297075	/nfs/dbraw/zinc/29/70/75/1349297075.db2.gz	PKSCWFQELBSGML-UHFFFAOYSA-N	0	3	346.434	3.156	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@H](NCc2c(C)nsc2C)C1	ZINC001054970800	1349531072	/nfs/dbraw/zinc/53/10/72/1349531072.db2.gz	ISAABGRLPLQRCV-MLGOLLRUSA-N	0	3	335.517	3.299	20	30		EGEDHN
CCC1(C(=O)N2C[C@H](NCc3ccc(C#N)c(F)c3)[C@@H](C)C2)CCC1	ZINC001054987225	1349539706	/nfs/dbraw/zinc/53/97/06/1349539706.db2.gz	VCBKIZUDXXWYNF-KSSFIOAISA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@H](C)Cc3ccc(F)cc3)[C@@H]2C1	ZINC001084863589	1358334855	/nfs/dbraw/zinc/33/48/55/1358334855.db2.gz	HUXVNYZTGNVUHA-SZVBFZGTSA-N	0	3	330.447	3.113	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)[C@H]2CCC(C)=C(C)C2)C1	ZINC001070410203	1354340404	/nfs/dbraw/zinc/34/04/04/1354340404.db2.gz	XTMWWALFQCNUQU-DLBZAZTESA-N	0	3	342.487	3.138	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)[C@H]2CCCCC2(C)C)C1	ZINC001070435641	1354348270	/nfs/dbraw/zinc/34/82/70/1354348270.db2.gz	MSWGXXSKHJRTQT-DOTOQJQBSA-N	0	3	344.503	3.218	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C=C1CCCCC1)C[C@@H](C)O2	ZINC001071144419	1354475160	/nfs/dbraw/zinc/47/51/60/1354475160.db2.gz	NCNXNMAFWSFXRX-XLIONFOSSA-N	0	3	332.488	3.145	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C(C)(C)C(=C)Cl)C[C@@H](C)O2	ZINC001071170905	1354486478	/nfs/dbraw/zinc/48/64/78/1354486478.db2.gz	DWGZOYMIPQWUQV-KDOFPFPSSA-N	0	3	340.895	3.033	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1cc(C)sc1C)C[C@H](C)O2	ZINC001071185358	1354491501	/nfs/dbraw/zinc/49/15/01/1354491501.db2.gz	FCOAKMCIQXCEAA-LIRRHRJNSA-N	0	3	348.512	3.246	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1ccccc1CC)C[C@H](C)O2	ZINC001071201910	1354502877	/nfs/dbraw/zinc/50/28/77/1354502877.db2.gz	MPLKDGSVYFEDHK-UWJYYQICSA-N	0	3	342.483	3.131	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cnn(CC(C)C)c2CC)CC[C@@H]1C	ZINC001071501215	1354730236	/nfs/dbraw/zinc/73/02/36/1354730236.db2.gz	LQRBFMUISFNVFZ-DLBZAZTESA-N	0	3	346.519	3.260	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2nsc3ccccc32)CC[C@H]1C	ZINC001071525101	1354745547	/nfs/dbraw/zinc/74/55/47/1354745547.db2.gz	KBSICEALTDECKX-KGLIPLIRSA-N	0	3	329.469	3.455	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(C)c(NC(C)=O)c2)CC[C@@H]1C	ZINC001071527340	1354747265	/nfs/dbraw/zinc/74/72/65/1354747265.db2.gz	BPAZEABJUNMJHM-MAUKXSAKSA-N	0	3	343.471	3.112	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(OC(C)C)nc2)CC[C@H]1C	ZINC001071547298	1354759547	/nfs/dbraw/zinc/75/95/47/1354759547.db2.gz	SOONUSSSFXGWBZ-WBVHZDCISA-N	0	3	331.460	3.028	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(-n3cccn3)cc2)CC[C@@H]1C	ZINC001071561888	1354766098	/nfs/dbraw/zinc/76/60/98/1354766098.db2.gz	WYBUXLVYDUDBQI-FUHWJXTLSA-N	0	3	338.455	3.031	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc3c(c2)OCCCO3)CC[C@H]1C	ZINC001071568790	1354768442	/nfs/dbraw/zinc/76/84/42/1354768442.db2.gz	SUTPXZKCLDBDGN-WBVHZDCISA-N	0	3	344.455	3.007	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2nc3cccnc3s2)CC[C@@H]1C	ZINC001071571923	1354771760	/nfs/dbraw/zinc/77/17/60/1354771760.db2.gz	NRTVERXYBGAXRF-KBPBESRZSA-N	0	3	344.484	3.240	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2nccc3ccsc32)CC[C@@H]1C	ZINC001071583378	1354778442	/nfs/dbraw/zinc/77/84/42/1354778442.db2.gz	HBOCFOBXKYOCGO-ZFWWWQNUSA-N	0	3	329.469	3.455	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2ccc3cccnc3c2)CC[C@H]1C	ZINC001071607562	1354792838	/nfs/dbraw/zinc/79/28/38/1354792838.db2.gz	PSZCSHJPXKNQCN-VQIMIIECSA-N	0	3	337.467	3.323	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc(C)c3ccccc3n2)CC[C@H]1C	ZINC001071612622	1354797141	/nfs/dbraw/zinc/79/71/41/1354797141.db2.gz	LBPBCBVRIIDKKX-SJORKVTESA-N	0	3	335.451	3.149	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2CCc3ccccc3CC2)CC[C@@H]1C	ZINC001071621690	1354803825	/nfs/dbraw/zinc/80/38/25/1354803825.db2.gz	BPYPETJVLOMNAH-UWJYYQICSA-N	0	3	338.495	3.174	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc(F)cc3ccoc32)CC[C@H]1C	ZINC001071628680	1354812875	/nfs/dbraw/zinc/81/28/75/1354812875.db2.gz	SBKHWNVBNKNHNS-CJNGLKHVSA-N	0	3	328.387	3.178	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc(C(C)C)nn2CC)CC[C@@H]1C	ZINC001071642600	1354821517	/nfs/dbraw/zinc/82/15/17/1354821517.db2.gz	SZIDGHDGMKUVOX-HOTGVXAUSA-N	0	3	332.492	3.185	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2ncc(Cl)s2)CC[C@@H]1C	ZINC001071683433	1354850326	/nfs/dbraw/zinc/85/03/26/1354850326.db2.gz	ZSRGDLILZQJVIT-RYUDHWBXSA-N	0	3	327.881	3.345	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cnc3ccccc3c2C)CC[C@@H]1C	ZINC001071695727	1354857826	/nfs/dbraw/zinc/85/78/26/1354857826.db2.gz	SISIJXGPQHPRNL-DOTOQJQBSA-N	0	3	335.451	3.149	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2cc3c(C)nn(C)c3s2)CC[C@@H]1C	ZINC001071719695	1354876746	/nfs/dbraw/zinc/87/67/46/1354876746.db2.gz	YYQVKHCZRNGMNY-GXTWGEPZSA-N	0	3	346.500	3.102	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2sccc2-n2cccc2)CC[C@H]1C	ZINC001071724603	1354880565	/nfs/dbraw/zinc/88/05/65/1354880565.db2.gz	JRDTUZDWBSAPSI-CVEARBPZSA-N	0	3	341.480	3.145	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2(c3cccc(F)c3)CCC2)CC[C@@H]1C	ZINC001071728265	1354883824	/nfs/dbraw/zinc/88/38/24/1354883824.db2.gz	KANCJDLSIONSBF-QFBILLFUSA-N	0	3	342.458	3.240	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2(c3ccc(F)cc3)CCC2)CC[C@H]1C	ZINC001071729260	1354884851	/nfs/dbraw/zinc/88/48/51/1354884851.db2.gz	YEYHYKRCBCYHEQ-APWZRJJASA-N	0	3	342.458	3.240	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc3nc(C)n(C)c3c2)CC[C@@H]1C	ZINC001071738478	1354888860	/nfs/dbraw/zinc/88/88/60/1354888860.db2.gz	CWAHCQUCHQYDIZ-YOEHRIQHSA-N	0	3	340.471	3.041	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CC[C@@H](C)N(CC3=CCCCC3)C2)c1	ZINC001071814614	1354956462	/nfs/dbraw/zinc/95/64/62/1354956462.db2.gz	KLBBSCZESXVFFM-UZLBHIALSA-N	0	3	337.467	3.146	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccccc2OC2CCC2)CC[C@H]1C	ZINC001071819632	1354959423	/nfs/dbraw/zinc/95/94/23/1354959423.db2.gz	WBUQFXYABCXLHW-IAGOWNOFSA-N	0	3	340.467	3.224	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(-c3cn[nH]c3)cc2)CC[C@H]1C	ZINC001071893348	1355010142	/nfs/dbraw/zinc/01/01/42/1355010142.db2.gz	NUPLBYHLXVNPAQ-DNVCBOLYSA-N	0	3	338.455	3.236	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(-c3ccccc3)nc2)CC[C@H]1C	ZINC001071928198	1355029881	/nfs/dbraw/zinc/02/98/81/1355029881.db2.gz	ZGODELGKRFUEAE-YLJYHZDGSA-N	0	3	347.462	3.355	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cccn2C2CCCC2)CC[C@H]1C	ZINC001071937364	1355034715	/nfs/dbraw/zinc/03/47/15/1355034715.db2.gz	AMJBAVFLJXYFDI-IAGOWNOFSA-N	0	3	327.472	3.209	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cccc(NC(C)=O)c2C)CC[C@@H]1C	ZINC001071993597	1355063424	/nfs/dbraw/zinc/06/34/24/1355063424.db2.gz	UPCSSSZBIABSQB-WMLDXEAASA-N	0	3	343.471	3.112	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(OCC)c(OC)c2)CC[C@@H]1C	ZINC001072058911	1355107932	/nfs/dbraw/zinc/10/79/32/1355107932.db2.gz	UWYAEPUJVMIABH-DOTOQJQBSA-N	0	3	346.471	3.253	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2[nH]c3ccccc3c2OC)CC[C@@H]1C	ZINC001072104945	1355133384	/nfs/dbraw/zinc/13/33/84/1355133384.db2.gz	FIYSLUIWUVVTOP-GJZGRUSLSA-N	0	3	341.455	3.335	20	30		EGEDHN
C=CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)c2ccco2)CC1	ZINC001072126835	1355143460	/nfs/dbraw/zinc/14/34/60/1355143460.db2.gz	NXKLTKCTYMTYRB-GOSISDBHSA-N	0	3	339.439	3.358	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2N(Cc2ccsc2)C(=O)C2CCC2)CC1	ZINC001072134079	1355148332	/nfs/dbraw/zinc/14/83/32/1355148332.db2.gz	CXDXJVMHKKDNLV-GOSISDBHSA-N	0	3	342.508	3.365	20	30		EGEDHN
C[C@@H]1CCN(C(=O)C=C2CCC2)C[C@H]1CNCc1ccccc1C#N	ZINC001072252727	1355209485	/nfs/dbraw/zinc/20/94/85/1355209485.db2.gz	ZHBSCKCPYXHFST-OXQOHEQNSA-N	0	3	337.467	3.243	20	30		EGEDHN
C[C@H]1CCN(C(=O)C2(C)CC2)C[C@@H]1CNCc1cc(F)ccc1C#N	ZINC001072288440	1355222218	/nfs/dbraw/zinc/22/22/18/1355222218.db2.gz	LKIKPAHGQAJJEY-YOEHRIQHSA-N	0	3	343.446	3.072	20	30		EGEDHN
C[C@H]1CCN(C(=O)CC(C)(F)F)C[C@H]1CNCc1ccccc1C#N	ZINC001072359815	1355255923	/nfs/dbraw/zinc/25/59/23/1355255923.db2.gz	HXEAPPXSHOIWSI-WMLDXEAASA-N	0	3	349.425	3.178	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](C)[C@H](CNCc3ncc(C)s3)C2)C1	ZINC001072363370	1355258092	/nfs/dbraw/zinc/25/80/92/1355258092.db2.gz	DHSNRGAZCUVTGL-GOEBONIOSA-N	0	3	347.528	3.382	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC2(C1)CCN([C@H](C)c1cccc(Cl)c1)C2	ZINC001072544288	1355326409	/nfs/dbraw/zinc/32/64/09/1355326409.db2.gz	HKUZYMXGXBKUDJ-ZIAGYGMSSA-N	0	3	331.847	3.095	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CN(C(=O)CCC4CCC4)C3)C2)cc1	ZINC001072593028	1355349681	/nfs/dbraw/zinc/34/96/81/1355349681.db2.gz	YBLLTZXXVLSZFY-UHFFFAOYSA-N	0	3	337.467	3.173	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1ccc(C)nc1C)C2	ZINC001072945134	1355513827	/nfs/dbraw/zinc/51/38/27/1355513827.db2.gz	URLWYASNNCEYOM-FQEVSTJZSA-N	0	3	341.499	3.335	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@@H](C)Cc3cccc(Cl)c3)C2)C1	ZINC001073488651	1355817781	/nfs/dbraw/zinc/81/77/81/1355817781.db2.gz	GDUVMUOIWFWZOH-HNNXBMFYSA-N	0	3	332.875	3.239	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2cscc2C(F)F)C1	ZINC001073603585	1355843598	/nfs/dbraw/zinc/84/35/98/1355843598.db2.gz	KLEWIWRAXMMIJG-GFCCVEGCSA-N	0	3	344.427	3.083	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2ccc3sccc3c2)C1	ZINC001073841802	1355914777	/nfs/dbraw/zinc/91/47/77/1355914777.db2.gz	SVSQEQBAHMKPPE-QGZVFWFLSA-N	0	3	344.480	3.298	20	30		EGEDHN
C#CCCN1CCCO[C@H](CNC(=O)C2CCC(CCCC)CC2)C1	ZINC001073880437	1355938306	/nfs/dbraw/zinc/93/83/06/1355938306.db2.gz	JDIKPLGONHXPLZ-SOAGJPPSSA-N	0	3	348.531	3.213	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(CF)cc1	ZINC001073973087	1356004397	/nfs/dbraw/zinc/00/43/97/1356004397.db2.gz	QDLHYKHIRIUVPR-CRAIPNDOSA-N	0	3	331.435	3.129	20	30		EGEDHN
C[C@H](C(=O)N1CCCC[C@@H]1CN(C)Cc1cccc(C#N)c1)C1CC1	ZINC001073981694	1356010705	/nfs/dbraw/zinc/01/07/05/1356010705.db2.gz	LMQRFYVBVKVXHC-OXJNMPFZSA-N	0	3	339.483	3.417	20	30		EGEDHN
CC1CC(C(=O)N2CCCC[C@@H]2CN(C)Cc2cccc(C#N)c2)C1	ZINC001073989470	1356018042	/nfs/dbraw/zinc/01/80/42/1356018042.db2.gz	HNAQXWSDYZSENC-RRWXTXHCSA-N	0	3	339.483	3.417	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H]1C(=O)N1CC[C@H](NCc2ccc(C#N)s2)[C@@H]1C	ZINC001074898259	1356281582	/nfs/dbraw/zinc/28/15/82/1356281582.db2.gz	WAJARCCLAZDDIY-JFTQMJAMSA-N	0	3	345.512	3.381	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cc(Cl)c(Cl)n3C)[C@@H]2C1	ZINC001075858912	1356434500	/nfs/dbraw/zinc/43/45/00/1356434500.db2.gz	JLGIIRDFBNIVGS-SMDDNHRTSA-N	0	3	342.270	3.054	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3cc(F)c4ccccc4c3)[C@@H]2C1	ZINC001075862557	1356434795	/nfs/dbraw/zinc/43/47/95/1356434795.db2.gz	SSDBTTWNYWNGCB-OXJNMPFZSA-N	0	3	336.410	3.149	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3csc(-c4ccco4)n3)[C@@H]2C1	ZINC001076187312	1356515138	/nfs/dbraw/zinc/51/51/38/1356515138.db2.gz	YIPSWXWNFGHXLM-DZGCQCFKSA-N	0	3	343.452	3.126	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3coc(-c4ccccc4)n3)[C@@H]2C1	ZINC001076470863	1356585795	/nfs/dbraw/zinc/58/57/95/1356585795.db2.gz	IAHHXJVDZBUSDD-FUHWJXTLSA-N	0	3	337.423	3.064	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@H](CC)c3ccc(OC)cc3)[C@@H]2C1	ZINC001076598306	1356628047	/nfs/dbraw/zinc/62/80/47/1356628047.db2.gz	VRPIXXHMWIGSGV-DFQSSKMNSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)Cn2c(C)cc3ccccc32)C1	ZINC001098929774	1363525284	/nfs/dbraw/zinc/52/52/84/1363525284.db2.gz	WIIQQEVOXYHZMN-RXVVDRJESA-N	0	3	337.467	3.106	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@H](NCc3ccns3)C23CCC3)CC1	ZINC001078716807	1357062878	/nfs/dbraw/zinc/06/28/78/1357062878.db2.gz	YWAQPZAHGAHSJQ-IRXDYDNUSA-N	0	3	345.512	3.407	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2ccc(C)cc2OC)C12CCC2	ZINC001078785328	1357080929	/nfs/dbraw/zinc/08/09/29/1357080929.db2.gz	BRHPGDLFJBQPEY-SJORKVTESA-N	0	3	348.874	3.387	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2cccc(OCC(C)C)c2)C1	ZINC001080914548	1357764307	/nfs/dbraw/zinc/76/43/07/1357764307.db2.gz	IBBUTVCVNXSXGH-VQIMIIECSA-N	0	3	330.472	3.348	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H]2C[C@@H]2c2ccccc2)C[C@H]1c1ccccc1	ZINC001081193045	1357848202	/nfs/dbraw/zinc/84/82/02/1357848202.db2.gz	GFZRNZZPYBHGBW-CLAROIROSA-N	0	3	344.458	3.008	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2c(C)cc(C)cc2C)C[C@H]1c1ccccc1	ZINC001081222251	1357851429	/nfs/dbraw/zinc/85/14/29/1357851429.db2.gz	UKSAJTHNQWBGRF-LEWJYISDSA-N	0	3	346.474	3.443	20	30		EGEDHN
C=C[C@H](C(=O)N1C[C@@H](C)[C@H](NCc2ncccc2C)C1)c1ccccc1	ZINC001082936954	1358106174	/nfs/dbraw/zinc/10/61/74/1358106174.db2.gz	DYIMPDNWHLXFPF-SLYNCCJLSA-N	0	3	349.478	3.296	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)c3ccc(C)c(Cl)c3)[C@H]2C1	ZINC001083182665	1358122275	/nfs/dbraw/zinc/12/22/75/1358122275.db2.gz	QPISRZUBZMCXMH-ZWKOTPCHSA-N	0	3	348.874	3.140	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)C[C@@H]3CCCC(C)(C)C3)[C@H]2C1	ZINC001083248175	1358126394	/nfs/dbraw/zinc/12/63/94/1358126394.db2.gz	UUMUAJTWONPWNU-GBESFXJTSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)c3cn(CC)c4ccccc34)[C@@H]2C1	ZINC001084500961	1358227195	/nfs/dbraw/zinc/22/71/95/1358227195.db2.gz	NFKPKPVSJIJIPX-OXQOHEQNSA-N	0	3	337.467	3.384	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3cnc(CC4CC4)s3)[C@@H]2C1	ZINC001084542133	1358234258	/nfs/dbraw/zinc/23/42/58/1358234258.db2.gz	LQKSHJKBSJLFQO-HZPDHXFCSA-N	0	3	345.512	3.208	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CCN(Cc3cccc4cccnc43)C[C@H]21	ZINC001084577257	1358241374	/nfs/dbraw/zinc/24/13/74/1358241374.db2.gz	HCBXCLLQMCAIIO-IEBWSBKVSA-N	0	3	349.478	3.480	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CCN(Cc3ccc(CC)cc3)C[C@H]21	ZINC001084578056	1358242200	/nfs/dbraw/zinc/24/22/00/1358242200.db2.gz	HQEGAIRDJISVJZ-RTBURBONSA-N	0	3	326.484	3.494	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)Cc3c[nH]c4cc(C)ccc34)[C@@H]2C1	ZINC001084718463	1358291570	/nfs/dbraw/zinc/29/15/70/1358291570.db2.gz	SAFZSGDIBSHPKX-OXQOHEQNSA-N	0	3	337.467	3.128	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)Cc3coc4cc(C)ccc34)[C@@H]2C1	ZINC001084816234	1358319300	/nfs/dbraw/zinc/31/93/00/1358319300.db2.gz	VYGQCHAPLJRDAT-VQIMIIECSA-N	0	3	338.451	3.393	20	30		EGEDHN
C[C@@]1(C(=O)N2CC[C@H]3CCN(Cc4ccc(C#N)cc4)[C@H]3C2)C=CCC1	ZINC001085010374	1358366193	/nfs/dbraw/zinc/36/61/93/1358366193.db2.gz	UZFZKSNWMZAREB-RZUBCFFCSA-N	0	3	349.478	3.337	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1c(C)noc1C(C)C	ZINC001085231877	1358438747	/nfs/dbraw/zinc/43/87/47/1358438747.db2.gz	YEAMTLMKWGRRAG-ZIAGYGMSSA-N	0	3	339.867	3.490	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1c(C)cc(C)nc1C	ZINC001085279760	1358450225	/nfs/dbraw/zinc/45/02/25/1358450225.db2.gz	BXXXSCUYSWLGAG-HZPDHXFCSA-N	0	3	335.879	3.390	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCCC[C@H]2NC(=O)[C@H]2CC23CC3)c(F)c1	ZINC001085343708	1358471935	/nfs/dbraw/zinc/47/19/35/1358471935.db2.gz	CTOPNZUIFJCYFW-KBAYOESNSA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cnoc1C(C)C	ZINC001085380975	1358482996	/nfs/dbraw/zinc/48/29/96/1358482996.db2.gz	BLWYFAGRVYBLLQ-ZIAGYGMSSA-N	0	3	325.840	3.181	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1Cc2c(cccc2C)O1	ZINC001085396545	1358488736	/nfs/dbraw/zinc/48/87/36/1358488736.db2.gz	RQAKVKVBEDRFMX-NUJGCVRESA-N	0	3	348.874	3.068	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H](C)n1c(C)ccc1C	ZINC001085432244	1358498235	/nfs/dbraw/zinc/49/82/35/1358498235.db2.gz	PDGCLJSMHIDXGE-BRWVUGGUSA-N	0	3	337.895	3.435	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)[C@@H]1CC[C@H](c2ccccc2)O1	ZINC001085599645	1358624212	/nfs/dbraw/zinc/62/42/12/1358624212.db2.gz	XOAVWEPIPIUGQH-QRVBRYPASA-N	0	3	328.456	3.016	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccn(C2CCCC2)n1	ZINC001085623005	1358642441	/nfs/dbraw/zinc/64/24/41/1358642441.db2.gz	IWMDMCMZJBBXNQ-QGZVFWFLSA-N	0	3	330.476	3.111	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@H]1COc2ccc(Cl)cc21	ZINC001085722577	1358712048	/nfs/dbraw/zinc/71/20/48/1358712048.db2.gz	BHDWRDRKMWTYAQ-RDJZCZTQSA-N	0	3	348.874	3.315	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cncc2sccc21	ZINC001085782856	1358758055	/nfs/dbraw/zinc/75/80/55/1358758055.db2.gz	GMMQLJAZHPXYFC-AWEZNQCLSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=C1CCC(C(=O)N(C)C[C@H]2CCN2C[C@@H](O)C2CCCCC2)CC1	ZINC001085801001	1358776079	/nfs/dbraw/zinc/77/60/79/1358776079.db2.gz	HQFZBQWSXUYREN-WOJBJXKFSA-N	0	3	348.531	3.207	20	30		EGEDHN
C=C1CCC(C(=O)N(C)C[C@@H]2CCN2CC2CC(OCC)C2)CC1	ZINC001085800862	1358776549	/nfs/dbraw/zinc/77/65/49/1358776549.db2.gz	DKRDOWPHNLUMDS-AVAKVYKDSA-N	0	3	334.504	3.081	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C[C@H]2CCN2CCC2CCCCC2)nc1	ZINC001085934113	1358889590	/nfs/dbraw/zinc/88/95/90/1358889590.db2.gz	SGWMHYPDEDQHQM-LJQANCHMSA-N	0	3	339.483	3.180	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1ccccc1C(F)(F)F	ZINC001085939963	1358897139	/nfs/dbraw/zinc/89/71/39/1358897139.db2.gz	VMOWJZAHOGWLCO-ZDUSSCGKSA-N	0	3	326.362	3.428	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)[C@@H]1C[C@H]1c1cccc(F)c1F	ZINC001085980939	1358934367	/nfs/dbraw/zinc/93/43/67/1358934367.db2.gz	ALGIHWUZMSALHP-CWRNSKLLSA-N	0	3	334.410	3.177	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@@H]1Cc2c1cccc2Cl	ZINC001085995299	1358950650	/nfs/dbraw/zinc/95/06/50/1358950650.db2.gz	JHQYJQJGXXARTJ-RHSMWYFYSA-N	0	3	332.875	3.479	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@@H](CNC(=O)c3ccsc3)C2)c1	ZINC001086022599	1358969367	/nfs/dbraw/zinc/96/93/67/1358969367.db2.gz	QJYXXNNGKVRKJE-AKAXFMLLSA-N	0	3	343.427	3.057	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc(C)c3ccccc3n2)C1	ZINC001086123954	1359003350	/nfs/dbraw/zinc/00/33/50/1359003350.db2.gz	BLGDFZIWAVCURU-GASCZTMLSA-N	0	3	343.858	3.394	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@H]2COc3cc(C)c(C)cc32)C1	ZINC001086159149	1359011333	/nfs/dbraw/zinc/01/13/33/1359011333.db2.gz	KTOQFYIHSBVNJC-UXLLHSPISA-N	0	3	348.874	3.016	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@@H]2C[C@@]23CCc2ccccc23)C1	ZINC001086240534	1359037918	/nfs/dbraw/zinc/03/79/18/1359037918.db2.gz	XLZJUZYHOYWJPA-RTBCOKGWSA-N	0	3	344.886	3.127	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@H]2Cc3c2cccc3Cl)C1	ZINC001086282679	1359054886	/nfs/dbraw/zinc/05/48/86/1359054886.db2.gz	XWOHLCJQJSXKJW-ZOWXZIJZSA-N	0	3	339.266	3.217	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N[C@@H]1CCc2c1cccc2Br	ZINC001341421782	1390484847	/nfs/dbraw/zinc/48/48/47/1390484847.db2.gz	FNCGVCDGGPBXBE-LSDHHAIUSA-N	0	3	337.261	3.236	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc3c([nH]2)c(F)ccc3C)C1	ZINC001086411893	1359090857	/nfs/dbraw/zinc/09/08/57/1359090857.db2.gz	ZIJZZNYCWYXLSA-JOCQHMNTSA-N	0	3	349.837	3.466	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc3c(c2)[C@@H](C)CO3)C1	ZINC001086454971	1359102070	/nfs/dbraw/zinc/10/20/70/1359102070.db2.gz	QJMMDJSYHZETJE-WHOFXGATSA-N	0	3	334.847	3.033	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc([C@H](C)CC)no2)C1	ZINC001086498958	1359121072	/nfs/dbraw/zinc/12/10/72/1359121072.db2.gz	LEDGYMFPRJPSHP-RAIGVLPGSA-N	0	3	325.840	3.039	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc(Cl)ccc2OC)C1	ZINC001086546882	1359140438	/nfs/dbraw/zinc/14/04/38/1359140438.db2.gz	FRMJVCOHGZDAKR-AULYBMBSSA-N	0	3	343.254	3.199	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc(CC)c(C)s2)C1	ZINC001086548283	1359141567	/nfs/dbraw/zinc/14/15/67/1359141567.db2.gz	DALRPXWVERBAHV-MQMHXKEQSA-N	0	3	326.893	3.469	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc(C3CCCC3)no2)C1	ZINC001086555778	1359144173	/nfs/dbraw/zinc/14/41/73/1359144173.db2.gz	WNYDVUZGVGPXRO-MQMHXKEQSA-N	0	3	337.851	3.183	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2csc(CC(C)C)n2)C1	ZINC001086564485	1359148967	/nfs/dbraw/zinc/14/89/67/1359148967.db2.gz	MDLXZAZQAVYWCT-JOCQHMNTSA-N	0	3	341.908	3.192	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](CNCc2cc(F)ccc2C#N)[C@@H](C)C1	ZINC001184019600	1387382620	/nfs/dbraw/zinc/38/26/20/1387382620.db2.gz	LLCRZLAKDIAYKC-DOTOQJQBSA-N	0	3	343.446	3.238	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CN(CC(=C)C)C[C@H]2c2ccccc2)cc1	ZINC001086602629	1359161269	/nfs/dbraw/zinc/16/12/69/1359161269.db2.gz	KLMNVDJZBVOQID-FCHUYYIVSA-N	0	3	344.458	3.442	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2c(F)cc(F)cc2F)C1	ZINC001086791813	1359202251	/nfs/dbraw/zinc/20/22/51/1359202251.db2.gz	OPYWKYRZQMTYAJ-CMPLNLGQSA-N	0	3	346.780	3.345	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cc3c(s2)CCC3)C1	ZINC001086870254	1359218092	/nfs/dbraw/zinc/21/80/92/1359218092.db2.gz	WWFGXTARBWLUMG-GXTWGEPZSA-N	0	3	338.904	3.477	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cc3n(c2)CCCC3)C1	ZINC001086892565	1359222755	/nfs/dbraw/zinc/22/27/55/1359222755.db2.gz	NKIIAWWCIJTALA-GOEBONIOSA-N	0	3	335.879	3.065	20	30		EGEDHN
CC1(C)CC[C@@H](C(=O)NCC2(NCc3cccc(C#N)c3)CC2)C1	ZINC001323541496	1387384181	/nfs/dbraw/zinc/38/41/81/1387384181.db2.gz	UAVSCQYMABXPOJ-QGZVFWFLSA-N	0	3	325.456	3.123	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC2(C[C@@H]1C)CCN(Cc1cccc(F)c1)CC2	ZINC001086908827	1359237009	/nfs/dbraw/zinc/23/70/09/1359237009.db2.gz	IVCHEIHJNXZPQC-CVEARBPZSA-N	0	3	343.446	3.188	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC2(C[C@@H]1C)CCN(Cc1ccc(F)cc1)CC2	ZINC001086910243	1359237610	/nfs/dbraw/zinc/23/76/10/1359237610.db2.gz	PAQXGPVTWVVULU-CVEARBPZSA-N	0	3	343.446	3.188	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc4c(o3)CCCC4)C2)CC1	ZINC001086927047	1359251889	/nfs/dbraw/zinc/25/18/89/1359251889.db2.gz	QRYAMUMPPZKBKB-MRXNPFEDSA-N	0	3	340.467	3.108	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc(C)c(F)c3)C2)CC1	ZINC001086931154	1359255104	/nfs/dbraw/zinc/25/51/04/1359255104.db2.gz	AUTLVEYBOHQBRQ-MRXNPFEDSA-N	0	3	328.431	3.084	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)CCc3cccc(C)c3)C2)CC1	ZINC001086935702	1359258694	/nfs/dbraw/zinc/25/86/94/1359258694.db2.gz	YQCFPBYZMFQRHC-IBGZPJMESA-N	0	3	338.495	3.264	20	30		EGEDHN
C=C1CCC(C(=O)N2CC3(C[C@H]2C)CCN(CC#CC)CC3)CC1	ZINC001086941409	1359263121	/nfs/dbraw/zinc/26/31/21/1359263121.db2.gz	SQTALTUZALXMSJ-GOSISDBHSA-N	0	3	328.500	3.459	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@H](C)c3ccc(C)o3)C2)CC1	ZINC001086946982	1359268035	/nfs/dbraw/zinc/26/80/35/1359268035.db2.gz	NLBIEVUGCWRAOA-DOTOQJQBSA-N	0	3	328.456	3.028	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)[C@H]3CC34CCCC4)C2)CC1	ZINC001086951573	1359271504	/nfs/dbraw/zinc/27/15/04/1359271504.db2.gz	JOMGEICHTBJQSW-QZTJIDSGSA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3oc(CC)cc3C)C2)CC1	ZINC001086953663	1359273532	/nfs/dbraw/zinc/27/35/32/1359273532.db2.gz	PJBLVJQHMCXPKL-MRXNPFEDSA-N	0	3	328.456	3.100	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc(Cl)cn3)C2)CC1	ZINC001086953357	1359273563	/nfs/dbraw/zinc/27/35/63/1359273563.db2.gz	GJZJNSAYDKWYGN-OAHLLOKOSA-N	0	3	345.874	3.075	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3sc(C)nc3C)C2)CC1	ZINC001086955192	1359275506	/nfs/dbraw/zinc/27/55/06/1359275506.db2.gz	GRCMBOWNMARUQL-CQSZACIVSA-N	0	3	345.512	3.100	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](CNCc2ccn(C(C)C)n2)[C@@H](C)C1	ZINC001184079132	1387389854	/nfs/dbraw/zinc/38/98/54/1387389854.db2.gz	UHHXGLBDULEMRC-IRXDYDNUSA-N	0	3	332.492	3.004	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc4c(o3)CCCC4)C(C)(C)[C@H]21	ZINC001087289681	1359368936	/nfs/dbraw/zinc/36/89/36/1359368936.db2.gz	QMHVXKFRUSOQSE-LZQZEXGQSA-N	0	3	340.467	3.010	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)C1CCC2(CC2)CC1	ZINC001087297776	1359379223	/nfs/dbraw/zinc/37/92/23/1359379223.db2.gz	TVINVKKZHPMXFX-FGTMMUONSA-N	0	3	328.500	3.195	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)C3CCC4(CC4)CC3)C(C)(C)[C@H]21	ZINC001087297777	1359379859	/nfs/dbraw/zinc/37/98/59/1359379859.db2.gz	TVINVKKZHPMXFX-KURKYZTESA-N	0	3	328.500	3.195	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccn(CC)c3C)C(C)(C)[C@@H]21	ZINC001087299843	1359381341	/nfs/dbraw/zinc/38/13/41/1359381341.db2.gz	CHYOKYYEZBFQIW-GUDVDZBRSA-N	0	3	341.499	3.059	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccn(CC)c1C	ZINC001087299842	1359381654	/nfs/dbraw/zinc/38/16/54/1359381654.db2.gz	CHYOKYYEZBFQIW-CEXWTWQISA-N	0	3	341.499	3.059	20	30		EGEDHN
C=CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ocnc1C(F)F	ZINC001087303010	1359385936	/nfs/dbraw/zinc/38/59/36/1359385936.db2.gz	FGJUJAXYLIXYSV-DDTOSNHZSA-N	0	3	339.386	3.017	20	30		EGEDHN
C=CCN1CCC[C@@H]2[C@H](NC(=O)c3cc(C(C)C)no3)C(C)(C)[C@H]21	ZINC001087305456	1359390474	/nfs/dbraw/zinc/39/04/74/1359390474.db2.gz	SSEPFUBDQPRYKR-COXVUDFISA-N	0	3	331.460	3.203	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cnc2ccccc2c1	ZINC001087307103	1359394025	/nfs/dbraw/zinc/39/40/25/1359394025.db2.gz	UBAQARWLFRFVFO-YZGWKJHDSA-N	0	3	347.462	3.087	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc2ccn(C)c2c1	ZINC001087313769	1359403083	/nfs/dbraw/zinc/40/30/83/1359403083.db2.gz	ZZSSSGHCIYKKDQ-YZGWKJHDSA-N	0	3	349.478	3.030	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc(CC)c(CC)o1	ZINC001087314480	1359403461	/nfs/dbraw/zinc/40/34/61/1359403461.db2.gz	LPUZHJYYKWRCDS-AYOQOUSVSA-N	0	3	342.483	3.256	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1c(C)nsc1C	ZINC001087319579	1359412257	/nfs/dbraw/zinc/41/22/57/1359412257.db2.gz	QBKCBMODBCZDFC-HYVNUMGLSA-N	0	3	345.512	3.002	20	30		EGEDHN
C=CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)c2cc(C)no2)C1	ZINC001087421207	1359458680	/nfs/dbraw/zinc/45/86/80/1359458680.db2.gz	SBVPVCTZKBTMRG-QZTJIDSGSA-N	0	3	339.439	3.147	20	30		EGEDHN
C=CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)c2coc(C)n2)C1	ZINC001087426167	1359460891	/nfs/dbraw/zinc/46/08/91/1359460891.db2.gz	OOLGMIPYZASVCB-QZTJIDSGSA-N	0	3	339.439	3.147	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)c2ccccc2)CCN1Cc1ccc(C#N)cc1	ZINC001087489058	1359492207	/nfs/dbraw/zinc/49/22/07/1359492207.db2.gz	DRRXCCGHFYIHTH-VQTJNVASSA-N	0	3	333.435	3.341	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccn(-c3ccccc3)n2)[C@H]1CC	ZINC001087639512	1359566927	/nfs/dbraw/zinc/56/69/27/1359566927.db2.gz	AXXKAJFFUGJMCI-PKOBYXMFSA-N	0	3	338.455	3.031	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2sc(C)nc2CC(C)C)[C@H]1CC	ZINC001087643946	1359568576	/nfs/dbraw/zinc/56/85/76/1359568576.db2.gz	VBEDKUMPTGPWRF-DOTOQJQBSA-N	0	3	347.528	3.256	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C)c3cccnc23)[C@H]1CC	ZINC001087662048	1359578069	/nfs/dbraw/zinc/57/80/69/1359578069.db2.gz	PWNUGJFHWIXTPH-RBUKOAKNSA-N	0	3	335.451	3.149	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2nc(Cl)sc2Cl)[C@H]1CC	ZINC001087684822	1359588158	/nfs/dbraw/zinc/58/81/58/1359588158.db2.gz	QAOMOTGLFBJTFW-VHSXEESVSA-N	0	3	346.283	3.056	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N[C@H]1CCN(Cc2ccc(C#N)cc2)[C@@H]1CC	ZINC001087732888	1359615466	/nfs/dbraw/zinc/61/54/66/1359615466.db2.gz	VPPAABYAAFQVHI-AKHDSKFASA-N	0	3	325.456	3.073	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cccnc2C(F)(F)F)[C@H]1CC	ZINC001087740351	1359621503	/nfs/dbraw/zinc/62/15/03/1359621503.db2.gz	AHESFCFEVZOSAO-UONOGXRCSA-N	0	3	341.377	3.259	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2cc3cc(F)ccc3o2)[C@H]1CC	ZINC001087746616	1359625081	/nfs/dbraw/zinc/62/50/81/1359625081.db2.gz	HUFVJKFQBOHSER-JKSUJKDBSA-N	0	3	328.387	3.178	20	30		EGEDHN
C=CCCN1CC[C@H](NC(=O)c2cnc([C@H]3CCCO3)s2)[C@H]1CC	ZINC001087754166	1359629392	/nfs/dbraw/zinc/62/93/92/1359629392.db2.gz	QYKNXEUQJKYVMG-RRFJBIMHSA-N	0	3	349.500	3.153	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ncccc2C(F)(F)F)[C@H]1CC	ZINC001087783682	1359641666	/nfs/dbraw/zinc/64/16/66/1359641666.db2.gz	PIOGCHOMDQUTGD-UONOGXRCSA-N	0	3	341.377	3.259	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cncc(C(F)(F)F)c2)[C@H]1CC	ZINC001087783866	1359642225	/nfs/dbraw/zinc/64/22/25/1359642225.db2.gz	YWIMIMXCWJVOBT-LSDHHAIUSA-N	0	3	341.377	3.259	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccnc(O[C@H](C)CC)c2)[C@H]1CC	ZINC001087789288	1359646129	/nfs/dbraw/zinc/64/61/29/1359646129.db2.gz	IRMQSLOEMOYTMP-BPQIPLTHSA-N	0	3	345.487	3.418	20	30		EGEDHN
CC1(C(=O)N2C[C@H]3CCN(Cc4ccc(C#N)cc4)C[C@H]3C2)CCC1	ZINC001088069177	1359743343	/nfs/dbraw/zinc/74/33/43/1359743343.db2.gz	MOVXGKUKLCBTIA-MOPGFXCFSA-N	0	3	337.467	3.029	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3ccc(F)c4ccccc34)C[C@@H]2C1	ZINC001088116000	1359760208	/nfs/dbraw/zinc/76/02/08/1359760208.db2.gz	ADTOXPVKCSXULV-CVEARBPZSA-N	0	3	336.410	3.006	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)[C@@H](C)c3cccc(Cl)c3)C[C@@H]2C1	ZINC001088206603	1359794389	/nfs/dbraw/zinc/79/43/89/1359794389.db2.gz	WZXNCHCAWQOGCR-JQHSSLGASA-N	0	3	344.886	3.247	20	30		EGEDHN
CC(C)(F)C(=O)N1CCCCC[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001088246740	1359816484	/nfs/dbraw/zinc/81/64/84/1359816484.db2.gz	AKZJMDKHGKVGHI-MRXNPFEDSA-N	0	3	349.425	3.306	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCCCC[C@@H](NCC(=C)Cl)C1	ZINC001088327398	1359831303	/nfs/dbraw/zinc/83/13/03/1359831303.db2.gz	MPEWZWIQGWORQD-MRXNPFEDSA-N	0	3	335.879	3.401	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCCC[C@H](NCc2ccc(F)cn2)C1	ZINC001088360287	1359843693	/nfs/dbraw/zinc/84/36/93/1359843693.db2.gz	VITQWFWMDALXKA-KRWDZBQOSA-N	0	3	333.451	3.294	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCCCN(C(=O)[C@@H](F)CC)C1	ZINC001088360602	1359844343	/nfs/dbraw/zinc/84/43/43/1359844343.db2.gz	CGORYIAMVITDKU-OLZOCXBDSA-N	0	3	335.261	3.004	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCCCC[C@H](NCc3cnoc3C)C2)C1	ZINC001088378389	1359861902	/nfs/dbraw/zinc/86/19/02/1359861902.db2.gz	GVTHVWINGFRLQT-KRWDZBQOSA-N	0	3	331.460	3.200	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2cncc(Cl)c2)C1	ZINC001088398382	1359873302	/nfs/dbraw/zinc/87/33/02/1359873302.db2.gz	HFSZJUZVFLVZJX-OAHLLOKOSA-N	0	3	342.270	3.462	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](CNCc2nc(C)c(C)s2)[C@@H](C)C1	ZINC001184302775	1387424646	/nfs/dbraw/zinc/42/46/46/1387424646.db2.gz	WIYNKFKJKYDZIN-WMLDXEAASA-N	0	3	347.528	3.138	20	30		EGEDHN
Cc1nc(CNC[C@@H]2CCN(C(=O)C#CC(C)(C)C)C[C@@H]2C)cs1	ZINC001184371397	1387442778	/nfs/dbraw/zinc/44/27/78/1387442778.db2.gz	LZYCISUUQUUQAU-HOCLYGCPSA-N	0	3	347.528	3.075	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCc2sc(CNCC3CC3)nc2C1	ZINC001089277877	1360297927	/nfs/dbraw/zinc/29/79/27/1360297927.db2.gz	RJCVWPFLOIUUJL-UHFFFAOYSA-N	0	3	333.501	3.130	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc3ccncc3s2)CC(C)(C)C1	ZINC001089405958	1360404693	/nfs/dbraw/zinc/40/46/93/1360404693.db2.gz	FZFCITLSSXGAHM-OAHLLOKOSA-N	0	3	341.480	3.150	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2oc(C(F)F)cc2C)CC(C)(C)C1	ZINC001089411236	1360408349	/nfs/dbraw/zinc/40/83/49/1360408349.db2.gz	FDFONOFCSMSXEB-CYBMUJFWSA-N	0	3	338.398	3.379	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(C)c3cccnc23)CC(C)(C)C1	ZINC001089439890	1360429931	/nfs/dbraw/zinc/42/99/31/1360429931.db2.gz	KCSSJRQZUQWSEG-QGZVFWFLSA-N	0	3	349.478	3.397	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3cnoc3C)CC(C)(C)C2)C1	ZINC001089485121	1360465553	/nfs/dbraw/zinc/46/55/53/1360465553.db2.gz	HKOCIQBODUILNI-QGZVFWFLSA-N	0	3	345.487	3.446	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)ccc2F)CC(C)(C)C1	ZINC001089501730	1360475775	/nfs/dbraw/zinc/47/57/75/1360475775.db2.gz	GTKIAJRVONSTSO-MRXNPFEDSA-N	0	3	330.447	3.378	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2oc(C3CC3)nc2C)CC(C)(C)C1	ZINC001089514383	1360484790	/nfs/dbraw/zinc/48/47/90/1360484790.db2.gz	LGERLWVPHXISFT-MRXNPFEDSA-N	0	3	343.471	3.104	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cn(C(C)C)nc2C)CC(C)(C)C1	ZINC001089541045	1360497949	/nfs/dbraw/zinc/49/79/49/1360497949.db2.gz	GWYYBNBGGXJGCQ-QGZVFWFLSA-N	0	3	344.503	3.016	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(C/C=C/Cl)CC(C)(C)C2)cn1	ZINC001089544610	1360500015	/nfs/dbraw/zinc/50/00/15/1360500015.db2.gz	WETIXQMRUFDOCD-HFTQHKIXSA-N	0	3	345.874	3.036	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2sc(CCC)nc2C)CC(C)(C)C1	ZINC001089559164	1360507106	/nfs/dbraw/zinc/50/71/06/1360507106.db2.gz	NJESGOJEEBELJY-OAHLLOKOSA-N	0	3	347.528	3.258	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc(C)c(F)c(C)c2)CC(C)(C)C1	ZINC001089561586	1360509047	/nfs/dbraw/zinc/50/90/47/1360509047.db2.gz	RQNSTCPOUJYMSB-QGZVFWFLSA-N	0	3	330.447	3.296	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@@]2(C)CCc3ccccc32)CC(C)(C)C1	ZINC001089565249	1360512562	/nfs/dbraw/zinc/51/25/62/1360512562.db2.gz	QHKJGTJFVLQTND-GCJKJVERSA-N	0	3	338.495	3.131	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1c(C)[nH]nc1Cl	ZINC001089649490	1360563164	/nfs/dbraw/zinc/56/31/64/1360563164.db2.gz	KFTZMAGPHAHKII-CYBMUJFWSA-N	0	3	338.883	3.168	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cc2cccn2cn1	ZINC001089656898	1360568610	/nfs/dbraw/zinc/56/86/10/1360568610.db2.gz	ORRZODDESLTKRN-KRWDZBQOSA-N	0	3	340.471	3.131	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1occ2c1CCC2	ZINC001089676160	1360583940	/nfs/dbraw/zinc/58/39/40/1360583940.db2.gz	BEYNLPUTWWCWGH-MRXNPFEDSA-N	0	3	328.456	3.012	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(C(C)C)on1	ZINC001089676509	1360585121	/nfs/dbraw/zinc/58/51/21/1360585121.db2.gz	IYMHOAVGESNFOQ-OAHLLOKOSA-N	0	3	331.460	3.042	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(F)ccc1C	ZINC001089677574	1360585604	/nfs/dbraw/zinc/58/56/04/1360585604.db2.gz	ZSQAZLSHVNNRAN-QGZVFWFLSA-N	0	3	330.447	3.378	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H]1CCc2cccnc21	ZINC001089687068	1360592521	/nfs/dbraw/zinc/59/25/21/1360592521.db2.gz	DTBOARCSZMBLME-QZTJIDSGSA-N	0	3	341.499	3.294	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(C)ccc1F	ZINC001089704009	1360606866	/nfs/dbraw/zinc/60/68/66/1360606866.db2.gz	RUJQIWHVWNANPP-MRXNPFEDSA-N	0	3	330.447	3.378	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1coc(C2CC2)n1	ZINC001089705813	1360607766	/nfs/dbraw/zinc/60/77/66/1360607766.db2.gz	ATEGHTAATXJICA-HNNXBMFYSA-N	0	3	331.460	3.349	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc([C@H](C)CC)no1	ZINC001089707779	1360612183	/nfs/dbraw/zinc/61/21/83/1360612183.db2.gz	SZRZVFGECXPLTF-CVEARBPZSA-N	0	3	345.487	3.432	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cnn(C(F)F)c1	ZINC001089716410	1360617293	/nfs/dbraw/zinc/61/72/93/1360617293.db2.gz	IRGMFFLXYMYOKM-AWEZNQCLSA-N	0	3	340.418	3.075	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1oc(C)cc1C	ZINC001089791397	1360664885	/nfs/dbraw/zinc/66/48/85/1360664885.db2.gz	GKSURTLSMHHAPI-HZMVEIRTSA-N	0	3	348.874	3.431	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1occc1CC	ZINC001089858423	1360703195	/nfs/dbraw/zinc/70/31/95/1360703195.db2.gz	AILAIOJGBIIQPL-HZMVEIRTSA-N	0	3	348.874	3.377	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(F)cc2)CC2(CCOCC2)C1	ZINC001089914883	1360742223	/nfs/dbraw/zinc/74/22/23/1360742223.db2.gz	ZCAZKVAIJLXVHA-SFHVURJKSA-N	0	3	346.446	3.003	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccccc2C(C)(C)CC)[C@@H](O)C1	ZINC001090348496	1360894410	/nfs/dbraw/zinc/89/44/10/1360894410.db2.gz	YGARPARHDZCUOS-OALUTQOASA-N	0	3	344.499	3.115	20	30		EGEDHN
C=CCn1cccc1C(=O)NCC1CC(NCc2ccccc2F)C1	ZINC001091068497	1360988910	/nfs/dbraw/zinc/98/89/10/1360988910.db2.gz	RDRDVPYLHJEHJI-UHFFFAOYSA-N	0	3	341.430	3.111	20	30		EGEDHN
C=C1CCC(C(=O)NCC2CC(NCc3c(C)onc3CC)C2)CC1	ZINC001091213095	1361008924	/nfs/dbraw/zinc/00/89/24/1361008924.db2.gz	GFXJPFXSLAYOJN-UHFFFAOYSA-N	0	3	345.487	3.276	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(OC(C)C)cc2)C1	ZINC001091353247	1361056708	/nfs/dbraw/zinc/05/67/08/1361056708.db2.gz	DQHVKMZZCLZRON-UHFFFAOYSA-N	0	3	336.863	3.324	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@H]2CN(C[C@@H](F)CC)C[C@@]2(C)C1	ZINC001091702462	1361185952	/nfs/dbraw/zinc/18/59/52/1361185952.db2.gz	ZWNHXMZZSSMQBW-KEYYUXOJSA-N	0	3	330.875	3.294	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)C[C@@H](C)c3ccc(CC)cc3)C[C@]2(C)C1	ZINC001092008290	1361273661	/nfs/dbraw/zinc/27/36/61/1361273661.db2.gz	FTCPMTNQZMJRLM-ZNLUXHQJSA-N	0	3	338.495	3.156	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)CC(C3CCC3)C3CCC3)C[C@]2(C)C1	ZINC001092016560	1361274595	/nfs/dbraw/zinc/27/45/95/1361274595.db2.gz	WTEFXFPSROXOPZ-KNQAVFIVSA-N	0	3	342.527	3.397	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cccc4ccsc43)C[C@]2(C)C1	ZINC001092169465	1361314945	/nfs/dbraw/zinc/31/49/45/1361314945.db2.gz	KPWIRDDXCVKHMU-UZLBHIALSA-N	0	3	338.476	3.319	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@@H](C)c3cccc(Cl)c3)C[C@]2(C)C1	ZINC001092290331	1361355575	/nfs/dbraw/zinc/35/55/75/1361355575.db2.gz	NKZXQAVRWXNPCQ-VPWXQRGCSA-N	0	3	344.886	3.247	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)[C@@H](CC)c3ccc(Cl)cc3)C[C@]2(C)C1	ZINC001092294239	1361355911	/nfs/dbraw/zinc/35/59/11/1361355911.db2.gz	NCRAPIXGBAUIFK-KPFFTGBYSA-N	0	3	344.886	3.247	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@@]3(C)CCC(C)=C(C)C3)C[C@]2(C)C1	ZINC001092311058	1361362193	/nfs/dbraw/zinc/36/21/93/1361362193.db2.gz	GNOGMNDVVHZIEA-GIVPXCGWSA-N	0	3	328.500	3.317	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C[C@H]2C=CCCC2)CC1	ZINC001093372606	1361582124	/nfs/dbraw/zinc/58/21/24/1361582124.db2.gz	FXBLMZLMYZIXRD-RXVVDRJESA-N	0	3	340.511	3.459	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@]2(C)C[C@H]3C[C@H]3C2)CC1	ZINC001093375308	1361585873	/nfs/dbraw/zinc/58/58/73/1361585873.db2.gz	RZDPCCMCANVYNY-JTJHWIPRSA-N	0	3	340.511	3.149	20	30		EGEDHN
CC#CCN1CC[C@@]2(CNC(=O)c3cc([C@@H](C)CC)no3)CCC[C@@H]12	ZINC001094531653	1361847600	/nfs/dbraw/zinc/84/76/00/1361847600.db2.gz	ZNMSWDASHMGRCM-QKYXUNIQSA-N	0	3	343.471	3.186	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3sccc3C3CC3)CCC[C@@H]12	ZINC001094571357	1361864995	/nfs/dbraw/zinc/86/49/95/1361864995.db2.gz	GXLSHEARWQOYOB-VQIMIIECSA-N	0	3	328.481	3.233	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cc(C)c(CC)s3)CCC[C@@H]12	ZINC001094575383	1361867283	/nfs/dbraw/zinc/86/72/83/1361867283.db2.gz	NJCVAARERZSXET-IEBWSBKVSA-N	0	3	330.497	3.227	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](NCc2cn(C(C)C)nc2C)C1	ZINC001184900392	1387558154	/nfs/dbraw/zinc/55/81/54/1387558154.db2.gz	SWHAYPHFKCYSJS-LJQANCHMSA-N	0	3	344.503	3.047	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cccc3c(C)c(C)[nH]c31)C2	ZINC001095635520	1362192249	/nfs/dbraw/zinc/19/22/49/1362192249.db2.gz	FANGQZNHOGLGEX-MNEFBYGVSA-N	0	3	335.451	3.143	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C1(c3cccc(C)c3)CCC1)C2	ZINC001095847725	1362253293	/nfs/dbraw/zinc/25/32/93/1362253293.db2.gz	KXNLRQAMLSAESX-AABGKKOBSA-N	0	3	336.479	3.162	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccccc1OC)C2	ZINC001096132523	1362399209	/nfs/dbraw/zinc/39/92/09/1362399209.db2.gz	OFCUPBSDZVKSIP-XXQMMXQMSA-N	0	3	340.467	3.096	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1)C2	ZINC001096142224	1362404348	/nfs/dbraw/zinc/40/43/48/1362404348.db2.gz	OOGDHDPZXKNYEW-LFDJNIOPSA-N	0	3	342.870	3.188	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1coc3cc(C)ccc13)C2	ZINC001096494249	1362535916	/nfs/dbraw/zinc/53/59/16/1362535916.db2.gz	HMSZNNLXXGQXRZ-NEWSRXKRSA-N	0	3	336.435	3.029	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(F)c3occc31)C2	ZINC001096573415	1362584471	/nfs/dbraw/zinc/58/44/71/1362584471.db2.gz	UFLWATXBLDBLOM-DQYPLSBCSA-N	0	3	328.387	3.483	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@]1(C)CCc3ccccc3C1)C2	ZINC001096688454	1362639387	/nfs/dbraw/zinc/63/93/87/1362639387.db2.gz	WLWOSGHUGIYYGL-AQCRLBJHSA-N	0	3	338.495	3.479	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1c(C)c(F)ccc1Cl)C2	ZINC001097375950	1362958503	/nfs/dbraw/zinc/95/85/03/1362958503.db2.gz	BJLGGVHFNFRRFU-WQVCFCJDSA-N	0	3	334.822	3.146	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc(C)c(C)cc1Cl)C2	ZINC001097642476	1363087578	/nfs/dbraw/zinc/08/75/78/1363087578.db2.gz	GVMUEBGXCRSXMF-OLMNPRSZSA-N	0	3	330.859	3.315	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1CC[C@@H]3C[C@@H]3CC1)C[C@@H](C)O2	ZINC001098616366	1363400467	/nfs/dbraw/zinc/40/04/67/1363400467.db2.gz	JQLNRVTYZVOYGI-AKHDSKFASA-N	0	3	346.515	3.081	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1CCC(C)(C)C1)C[C@@H](C)O2	ZINC001098635920	1363409856	/nfs/dbraw/zinc/40/98/56/1363409856.db2.gz	UZKFGLIYPLESID-SJORKVTESA-N	0	3	334.504	3.081	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3CCC[C@]3(NC(=O)C[C@H]3C=CCC3)C2)cc1	ZINC001098723060	1363449963	/nfs/dbraw/zinc/44/99/63/1363449963.db2.gz	DWSDVWHVUXYKTR-XJABCFGWSA-N	0	3	349.478	3.385	20	30		EGEDHN
C=CCCC(=O)NC[C@H]1CCC(C)(C)CN1CCOCC1CCC1	ZINC001098967138	1363545830	/nfs/dbraw/zinc/54/58/30/1363545830.db2.gz	YVWKUKAWHANUHY-GOSISDBHSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2nsc3ccc(C)cc32)C1	ZINC001098974459	1363549330	/nfs/dbraw/zinc/54/93/30/1363549330.db2.gz	VDXYBRGVABETPR-LIRRHRJNSA-N	0	3	341.480	3.375	20	30		EGEDHN
Cc1cccc(CN2CC(C)(C)CC[C@@H]2CNC(=O)[C@@H](C)C#N)c1	ZINC001098976556	1363551443	/nfs/dbraw/zinc/55/14/43/1363551443.db2.gz	VLZPIQGULNPDDE-FUHWJXTLSA-N	0	3	327.472	3.262	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc3nc(C)ccc3c2)C1	ZINC001099089598	1363616920	/nfs/dbraw/zinc/61/69/20/1363616920.db2.gz	HDANQZXYELCISW-RXVVDRJESA-N	0	3	335.451	3.314	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2coc3ccc(F)cc23)C1	ZINC001099138635	1363647791	/nfs/dbraw/zinc/64/77/91/1363647791.db2.gz	NDVVGYXBAVTBRC-DJJJIMSYSA-N	0	3	328.387	3.342	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)C(C)(C)C1CCOCC1	ZINC001099139971	1363649663	/nfs/dbraw/zinc/64/96/63/1363649663.db2.gz	MGTBKGDHEQHAIZ-KRWDZBQOSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)CCc1cccc(OC)c1	ZINC001099140538	1363650793	/nfs/dbraw/zinc/65/07/93/1363650793.db2.gz	ZMTVICMVAZEQOJ-SFHVURJKSA-N	0	3	344.499	3.421	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H]1CCC(C)(C)CN1CCOCC(C)C	ZINC001099171818	1363670220	/nfs/dbraw/zinc/67/02/20/1363670220.db2.gz	URLUMAWBAVOEDO-KRWDZBQOSA-N	0	3	338.536	3.478	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)C/C=C(\C)C=C	ZINC001099182547	1363678586	/nfs/dbraw/zinc/67/85/86/1363678586.db2.gz	MDRSFGJLYARXPT-SMHZUEHJSA-N	0	3	334.504	3.318	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@H]2CCC(C)(C)CN2CCOC(C)C)C1	ZINC001099230250	1363704191	/nfs/dbraw/zinc/70/41/91/1363704191.db2.gz	RUGOUVDFNSFIIM-QGZVFWFLSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2c[nH]cc2C2CC2)C[C@H]1C(F)(F)F	ZINC001099327508	1363753164	/nfs/dbraw/zinc/75/31/64/1363753164.db2.gz	PVZDUXZGHABENC-HUUCEWRRSA-N	0	3	341.377	3.061	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)Cc2ccc(C)c(C)c2)C[C@H]1C(F)(F)F	ZINC001099339807	1363759826	/nfs/dbraw/zinc/75/98/26/1363759826.db2.gz	GPERNCCNVSOWCV-HZPDHXFCSA-N	0	3	340.389	3.011	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2c(C)cccc2F)C[C@H]1C(F)(F)F	ZINC001099351010	1363767259	/nfs/dbraw/zinc/76/72/59/1363767259.db2.gz	ZAMYMGUJAARYJJ-TZMCWYRMSA-N	0	3	344.352	3.303	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)[C@H](OC)c1ccc(F)cc1	ZINC001099357928	1363771240	/nfs/dbraw/zinc/77/12/40/1363771240.db2.gz	BTFSYXURNPAHLC-ZWKOTPCHSA-N	0	3	348.462	3.306	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H]2CCC(C)(C)CN2CCOC)CCCC1	ZINC001099378175	1363779941	/nfs/dbraw/zinc/77/99/41/1363779941.db2.gz	ARPKLFJYKVEPJF-KRWDZBQOSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)CC1CCC(OC)CC1	ZINC001099379911	1363781838	/nfs/dbraw/zinc/78/18/38/1363781838.db2.gz	OITKAWIVLYGEJQ-LXPRWKDFSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2cscn2)C1	ZINC001099474529	1363810762	/nfs/dbraw/zinc/81/07/62/1363810762.db2.gz	UPWHRTFIOYFTNU-KSSFIOAISA-N	0	3	333.501	3.074	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H]3CCC[C@]3(CNCc3ocnc3C)C2)C1	ZINC001099493248	1363819606	/nfs/dbraw/zinc/81/96/06/1363819606.db2.gz	JHDDAUFZGJEQEE-JXFKEZNVSA-N	0	3	343.471	3.058	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1CN(CC=C(C)C)CC2(CCOCC2)C1	ZINC001099591027	1363873184	/nfs/dbraw/zinc/87/31/84/1363873184.db2.gz	QUVJQTZWMDIVRH-GOSISDBHSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)[C@H](C)CC(C)C)CC2(CCOCC2)C1	ZINC001099594727	1363876823	/nfs/dbraw/zinc/87/68/23/1363876823.db2.gz	JRMBVZAXWWSPDM-MSOLQXFVSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)C[C@@H](CC)C(C)C)CC2(CCOCC2)C1	ZINC001099596415	1363879439	/nfs/dbraw/zinc/87/94/39/1363879439.db2.gz	BKVRUJJECXHHIR-MSOLQXFVSA-N	0	3	336.520	3.232	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCC1CC(NCc2c(Cl)oc3ccccc32)C1	ZINC001100196433	1364041913	/nfs/dbraw/zinc/04/19/13/1364041913.db2.gz	JQLISHZVOJDVLJ-HIFPTAJRSA-N	0	3	345.830	3.230	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](CNCc2oc(C)nc2C)[C@@H](C)C1	ZINC001185227243	1387656843	/nfs/dbraw/zinc/65/68/43/1387656843.db2.gz	WBDUZFRARYRQQA-YOEHRIQHSA-N	0	3	347.503	3.468	20	30		EGEDHN
CC(C)C#CC(=O)NCC1CC(NCc2cccc(Cl)c2F)C1	ZINC001100309265	1364076562	/nfs/dbraw/zinc/07/65/62/1364076562.db2.gz	NICWBGHNHDWBFH-UHFFFAOYSA-N	0	3	336.838	3.123	20	30		EGEDHN
CC(C)CC1(C(=O)NCC2CC(NCC#Cc3ccccc3)C2)CC1	ZINC001100395792	1364100461	/nfs/dbraw/zinc/10/04/61/1364100461.db2.gz	URMLSJHGGCIFTG-UHFFFAOYSA-N	0	3	338.495	3.349	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)Cc2cc(F)c(C)cc2F)C1	ZINC001100530811	1364149401	/nfs/dbraw/zinc/14/94/01/1364149401.db2.gz	MUXOAJWUVIVAMN-UHFFFAOYSA-N	0	3	342.817	3.053	20	30		EGEDHN
C=C/C(C)=C\CC(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100583714	1364174878	/nfs/dbraw/zinc/17/48/78/1364174878.db2.gz	ZZWDPFKOMGZBCO-SOFYXZRVSA-N	0	3	340.442	3.184	20	30		EGEDHN
C[C@]1(C(=O)NCC2CC(NCc3ccc(C#N)cc3F)C2)C=CCC1	ZINC001100585370	1364175230	/nfs/dbraw/zinc/17/52/30/1364175230.db2.gz	ZCOHGXHHMNEKKH-LAGYLCCXSA-N	0	3	341.430	3.038	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCC1CC(NCc2c(C)nsc2C)C1	ZINC001100595809	1364181237	/nfs/dbraw/zinc/18/12/37/1364181237.db2.gz	GULFBVVHYDHDAP-FHERZECASA-N	0	3	335.517	3.347	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1	ZINC001100596106	1364181254	/nfs/dbraw/zinc/18/12/54/1364181254.db2.gz	KWZJNROVCPSZQW-NXVRBGIVSA-N	0	3	343.446	3.284	20	30		EGEDHN
CC1(C(=O)NCC2CC(NCC#Cc3ccc(F)cc3)C2)CC=CC1	ZINC001100640803	1364200428	/nfs/dbraw/zinc/20/04/28/1364200428.db2.gz	XVGDKUJAOMCKOG-UHFFFAOYSA-N	0	3	340.442	3.018	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100644784	1364202239	/nfs/dbraw/zinc/20/22/39/1364202239.db2.gz	HYYJQSJEVHEDOX-CNBHCMJISA-N	0	3	342.458	3.264	20	30		EGEDHN
CCC[C@@H](CC)C(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100798109	1364266529	/nfs/dbraw/zinc/26/65/29/1364266529.db2.gz	RAYWWGXICWYKHU-IOJLRTSASA-N	0	3	326.484	3.349	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)[C@@H](C)C2CCCC2)C1	ZINC001100853646	1364292517	/nfs/dbraw/zinc/29/25/17/1364292517.db2.gz	RFINHLNBBQNKBW-OPFPJEHXSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C(C)(C)c2ccc(F)cc2)C1	ZINC001100887334	1364313091	/nfs/dbraw/zinc/31/30/91/1364313091.db2.gz	BXDMNRZDTYIODO-UHFFFAOYSA-N	0	3	338.854	3.340	20	30		EGEDHN
C=C(C)CN1CC[C@@H](Oc2ccnc(CNC(=O)CCC(C)C)c2)C1	ZINC001101089673	1364407581	/nfs/dbraw/zinc/40/75/81/1364407581.db2.gz	YQNMZOPYEJSMLI-LJQANCHMSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=CCN1CC[C@@H](Oc2ccnc(CNC(=O)C[C@H](C)C(C)C)c2)C1	ZINC001101092719	1364409568	/nfs/dbraw/zinc/40/95/68/1364409568.db2.gz	WBZFVAUCDPSXBI-QFBILLFUSA-N	0	3	345.487	3.019	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@H]2CN(Cc3ccc(C)nc3C)C[C@@]2(C)C1	ZINC001101253847	1364487381	/nfs/dbraw/zinc/48/73/81/1364487381.db2.gz	ZWONUBRVROZBDU-CTNGQTDRSA-N	0	3	341.499	3.335	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C/C=C/c3ccc(F)cc3)C[C@]2(C)C1	ZINC001101277331	1364496384	/nfs/dbraw/zinc/49/63/84/1364496384.db2.gz	CEDVMBWVRNFFRI-ABGJEJFVSA-N	0	3	340.442	3.033	20	30		EGEDHN
C=CCCCC(=O)N1C[C@H]2CN(Cc3ccc(C#N)cc3)C[C@@]2(C)C1	ZINC001101347876	1364521276	/nfs/dbraw/zinc/52/12/76/1364521276.db2.gz	NACFMTPGXUFKSV-CTNGQTDRSA-N	0	3	337.467	3.195	20	30		EGEDHN
C=CCC[C@@H](C)N1CC2(C1)C[C@@H](NC(=O)CC(C)(C)C)c1nccn12	ZINC001101610049	1364654854	/nfs/dbraw/zinc/65/48/54/1364654854.db2.gz	DVDWUZRBRJEBKJ-HZPDHXFCSA-N	0	3	344.503	3.246	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1CC2(CN(C[C@@H](C)CC)C2)n2ccnc21	ZINC001101630449	1364662450	/nfs/dbraw/zinc/66/24/50/1364662450.db2.gz	HOCUTZKRSMKJKK-HOTGVXAUSA-N	0	3	344.503	3.103	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1CC2(CN([C@H](C)CCC=C)C2)n2ccnc21	ZINC001101641058	1364666419	/nfs/dbraw/zinc/66/64/19/1364666419.db2.gz	IINUMTNAGZRRAB-SJORKVTESA-N	0	3	342.487	3.166	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1CNC(=O)CC(C)(C)C	ZINC001101725525	1364704513	/nfs/dbraw/zinc/70/45/13/1364704513.db2.gz	ZHNAORSIVDQERP-SJLPKXTDSA-N	0	3	344.474	3.298	20	30		EGEDHN
C=CCCC(=O)NC[C@@H]1CN(Cc2oc(CCC)nc2C)C[C@H]1C	ZINC001101805583	1364733510	/nfs/dbraw/zinc/73/35/10/1364733510.db2.gz	VIPRSWLZVDTMSF-GDBMZVCRSA-N	0	3	333.476	3.086	20	30		EGEDHN
CC[C@@H](C)CC(=O)NC[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1C	ZINC001101917922	1364773420	/nfs/dbraw/zinc/77/34/20/1364773420.db2.gz	CQRIVBNHTNPMBM-IIDMSEBBSA-N	0	3	345.462	3.318	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001102004726	1364807717	/nfs/dbraw/zinc/80/77/17/1364807717.db2.gz	ASEPPZJJUQHWSI-HUUCEWRRSA-N	0	3	345.512	3.406	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@@H]1CN(Cc2cc(C)ns2)C[C@H]1C	ZINC001102261203	1364973905	/nfs/dbraw/zinc/97/39/05/1364973905.db2.gz	RFQNZBNHDXABAU-IIAWOOMASA-N	0	3	335.517	3.238	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@H]2CN(Cc3ccc(C#N)s3)C[C@H]2C)C1	ZINC001102347891	1365015641	/nfs/dbraw/zinc/01/56/41/1365015641.db2.gz	GPJUBOKYWHCADM-HUUCEWRRSA-N	0	3	343.496	3.160	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@@H]1CN(Cc2c(C)onc2CC)C[C@H]1C	ZINC001102409925	1365043120	/nfs/dbraw/zinc/04/31/20/1365043120.db2.gz	BPGUXACAWMQOBU-GDBMZVCRSA-N	0	3	347.503	3.332	20	30		EGEDHN
C=CCCC(=O)NCC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001102760115	1365205983	/nfs/dbraw/zinc/20/59/83/1365205983.db2.gz	FZPYVYHKBQFUHB-HUUCEWRRSA-N	0	3	331.485	3.160	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1CCNC(=O)CCC1CC1	ZINC001102799689	1365225358	/nfs/dbraw/zinc/22/53/58/1365225358.db2.gz	ITMVROSCAGTSBM-VQIMIIECSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C(C)CCC(=O)NCC[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1C	ZINC001103040011	1365350894	/nfs/dbraw/zinc/35/08/94/1365350894.db2.gz	BJULRLQBHXPSRI-IEBWSBKVSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC[C@@H]1CN(Cc2ccns2)C[C@H]1C	ZINC001103308166	1365485754	/nfs/dbraw/zinc/48/57/54/1365485754.db2.gz	WXVZXPAAPXSYDK-HUUCEWRRSA-N	0	3	335.517	3.320	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)C[C@H](C)C(F)(F)F)C1	ZINC001103392551	1365532624	/nfs/dbraw/zinc/53/26/24/1365532624.db2.gz	IDAJKBWMDNSDRE-NTZNESFSSA-N	0	3	340.817	3.402	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)C2(F)CCCCC2)C1	ZINC001103609555	1365673757	/nfs/dbraw/zinc/67/37/57/1365673757.db2.gz	UOHFELMKUDJVJQ-UKRRQHHQSA-N	0	3	330.875	3.486	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2sccc2OC)C1	ZINC001103664593	1365712771	/nfs/dbraw/zinc/71/27/71/1365712771.db2.gz	KWELSJDPKDFTAV-DGCLKSJQSA-N	0	3	342.892	3.197	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@H](CCNCc2ccn(C(C)C)n2)C1	ZINC001103977713	1365857098	/nfs/dbraw/zinc/85/70/98/1365857098.db2.gz	BPPAPQGXNUFQOI-IAGOWNOFSA-N	0	3	332.492	3.004	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)[C@H](CCNCc2c(C)noc2C)C1	ZINC001104245286	1365967080	/nfs/dbraw/zinc/96/70/80/1365967080.db2.gz	ACKFGOQSYWSTNZ-RHSMWYFYSA-N	0	3	333.476	3.222	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)[C@H](CCNCc2c(C)noc2CC)C1	ZINC001104247054	1365968067	/nfs/dbraw/zinc/96/80/67/1365968067.db2.gz	UZUUWGICHGMNOW-NVXWUHKLSA-N	0	3	347.503	3.476	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cccnc2C2CC2)C[C@H]1C	ZINC001104387119	1365997998	/nfs/dbraw/zinc/99/79/98/1365997998.db2.gz	GVWHJFWMSJACTR-CZUORRHYSA-N	0	3	347.890	3.399	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@@H](C)[C@H](CCNCc2ccn(CC)n2)C1	ZINC001104564410	1366078631	/nfs/dbraw/zinc/07/86/31/1366078631.db2.gz	LCGKPMUKQDDQRK-FGTMMUONSA-N	0	3	346.519	3.080	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)CC(C)(C)C=C)CC1	ZINC001105392280	1366441107	/nfs/dbraw/zinc/44/11/07/1366441107.db2.gz	XANWOXLMMDSSRZ-LJQANCHMSA-N	0	3	328.500	3.315	20	30		EGEDHN
CC/C(C)=C\C(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001106093863	1366610730	/nfs/dbraw/zinc/61/07/30/1366610730.db2.gz	NXPINFJIJQMLMU-NDBSJYDGSA-N	0	3	325.456	3.099	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H](CNCc2nc(C)cs2)[C@H](C)C1	ZINC001106564392	1366737440	/nfs/dbraw/zinc/73/74/40/1366737440.db2.gz	ZMARMHHUNMJGGE-IIAWOOMASA-N	0	3	335.517	3.238	20	30		EGEDHN
C/C=C(/C)C(=O)NC[C@]12CCC[C@H]1N(CC#Cc1ccccc1)CC2	ZINC001107355949	1366940443	/nfs/dbraw/zinc/94/04/43/1366940443.db2.gz	PSLZEKPJDBXDMF-AQUSTGIESA-N	0	3	336.479	3.365	20	30		EGEDHN
C#CCCCC(=O)NC[C@]12CCC[C@H]1N(CC#Cc1ccccc1)CC2	ZINC001107387524	1366949564	/nfs/dbraw/zinc/94/95/64/1366949564.db2.gz	UPSJBVFMWRXUJV-FYYLOGMGSA-N	0	3	348.490	3.202	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@]3(CNC(=O)CCCF)CCC[C@@H]23)s1	ZINC001107508154	1367008270	/nfs/dbraw/zinc/00/82/70/1367008270.db2.gz	YDRFWUPLHKBBLH-SJLPKXTDSA-N	0	3	349.475	3.230	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@]12CCC[C@H]1N(Cc1cnc(C)o1)CC2	ZINC001107514345	1367013244	/nfs/dbraw/zinc/01/32/44/1367013244.db2.gz	BZBVUTGSXITOLL-XFQXTVEOSA-N	0	3	345.487	3.446	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](N(C)Cc2ccc(CF)cc2)C1	ZINC001189707144	1367092245	/nfs/dbraw/zinc/09/22/45/1367092245.db2.gz	RDSAMYWPAQCEFO-IBGZPJMESA-N	0	3	330.447	3.382	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2sccc2C)C1	ZINC001107698344	1367107303	/nfs/dbraw/zinc/10/73/03/1367107303.db2.gz	OPBBYACYSVIRDY-MAUKXSAKSA-N	0	3	336.501	3.232	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)c3ccc(C(C)C)cc3)[C@@H]2C1	ZINC001189930743	1367134058	/nfs/dbraw/zinc/13/40/58/1367134058.db2.gz	BILAJBVRMZPSNB-VQTJNVASSA-N	0	3	342.483	3.159	20	30		EGEDHN
C=CCCC(=O)NC[C@@]1(C)CN(CC2CCC(C)(C)CC2)CCO1	ZINC001107801828	1367153546	/nfs/dbraw/zinc/15/35/46/1367153546.db2.gz	BWNDUGKRHIFKQJ-FQEVSTJZSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCCCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1coc(OCC)n1)C2	ZINC001109487316	1367154654	/nfs/dbraw/zinc/15/46/54/1367154654.db2.gz	KXDRDPCAUYCRKH-VYDXJSESSA-N	0	3	347.459	3.155	20	30		EGEDHN
C[C@@H](c1cccc(F)c1)N(C)[C@H]1CCN(C(=O)C#CC(C)(C)C)C1	ZINC001190084605	1367168031	/nfs/dbraw/zinc/16/80/31/1367168031.db2.gz	QAQVLNTTXDYGHK-YJBOKZPZSA-N	0	3	330.447	3.469	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)C(C)(C)C2CCC2)C1	ZINC001108101236	1367282753	/nfs/dbraw/zinc/28/27/53/1367282753.db2.gz	IWOMYMBVRWNTRM-OXQOHEQNSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@]1(C)CN(CC2CCCCC2)CCO1	ZINC001108115793	1367289477	/nfs/dbraw/zinc/28/94/77/1367289477.db2.gz	UGKMNLAUGIQJKB-HXUWFJFHSA-N	0	3	336.520	3.376	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](Cc1ccccc1)C(C)C)C2	ZINC001109718162	1367291895	/nfs/dbraw/zinc/29/18/95/1367291895.db2.gz	AWHPYYUWDXZFNV-ANULTFPQSA-N	0	3	338.495	3.246	20	30		EGEDHN
N#Cc1cccc(C(=O)NC[C@H](c2ccccc2)N2CCCC2)c1F	ZINC001190555112	1367291949	/nfs/dbraw/zinc/29/19/49/1367291949.db2.gz	RDKPJFKBDCMDNX-GOSISDBHSA-N	0	3	337.398	3.264	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](Cc1ccccc1)C(C)C)C2	ZINC001109718163	1367292342	/nfs/dbraw/zinc/29/23/42/1367292342.db2.gz	AWHPYYUWDXZFNV-CGXNFDGLSA-N	0	3	338.495	3.246	20	30		EGEDHN
CC[C@@H](CC(F)F)C(=O)N1CC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001190614192	1367308921	/nfs/dbraw/zinc/30/89/21/1367308921.db2.gz	WNQHHWQDRUNVQF-IRXDYDNUSA-N	0	3	349.425	3.272	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)COc1ccsc1Cl)C2	ZINC001109828059	1367343639	/nfs/dbraw/zinc/34/36/39/1367343639.db2.gz	JTHNWKXHSLJHGU-AGIUHOORSA-N	0	3	340.876	3.078	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)CCc2ccccc2)C1	ZINC001108363109	1367412303	/nfs/dbraw/zinc/41/23/03/1367412303.db2.gz	WHNVNGDJTKCWBH-GHTZIAJQSA-N	0	3	344.499	3.181	20	30		EGEDHN
C#Cc1ccccc1C(=O)NCCN1CCC(Cc2ccccc2)CC1	ZINC001191116512	1367426362	/nfs/dbraw/zinc/42/63/62/1367426362.db2.gz	LVXIOPVJOUWQFW-UHFFFAOYSA-N	0	3	346.474	3.352	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](CC)Cc1ccccc1C)C2	ZINC001109977678	1367440653	/nfs/dbraw/zinc/44/06/53/1367440653.db2.gz	URTIKCCIWFWQKX-NRDMVMEKSA-N	0	3	338.495	3.309	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2cc3ccccc3s2)C1	ZINC001191187625	1367440988	/nfs/dbraw/zinc/44/09/88/1367440988.db2.gz	ASFFQZHZZHWOQZ-INIZCTEOSA-N	0	3	344.480	3.250	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CC(C)(C)CC(F)(F)F)C2	ZINC001110040581	1367478426	/nfs/dbraw/zinc/47/84/26/1367478426.db2.gz	VZFNGNHWJDLCEM-RDBSUJKOSA-N	0	3	330.394	3.100	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3CC=C(C)C)CCOCC1	ZINC001110043982	1367479252	/nfs/dbraw/zinc/47/92/52/1367479252.db2.gz	PLKCGTOFXHYLBX-SQNIBIBYSA-N	0	3	332.488	3.047	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCc1nc3ccccc3o1)C2	ZINC001110091758	1367499110	/nfs/dbraw/zinc/49/91/10/1367499110.db2.gz	JHBYDCCCCPVSJI-PVAVHDDUSA-N	0	3	339.439	3.058	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@H](C)c1ccc(OC)cc1)C2	ZINC001110133104	1367516547	/nfs/dbraw/zinc/51/65/47/1367516547.db2.gz	YLRZAORMMPSLGC-RKOGWWSCSA-N	0	3	342.483	3.486	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](C)c1ccccc1C)C2	ZINC001110135180	1367518300	/nfs/dbraw/zinc/51/83/00/1367518300.db2.gz	PDGLETFKRBGBNF-HNJRGHQBSA-N	0	3	342.483	3.023	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3CCOC(C)C)CCCC1	ZINC001110214544	1367568805	/nfs/dbraw/zinc/56/88/05/1367568805.db2.gz	LXQYHRFWGJUTLK-SQNIBIBYSA-N	0	3	334.504	3.269	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@H](N(C)CCc2csc(C)n2)C1	ZINC001191889597	1367626828	/nfs/dbraw/zinc/62/68/28/1367626828.db2.gz	IPDHJBACWIQKTQ-RDJZCZTQSA-N	0	3	335.517	3.129	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@H](N(C)CCOc2ccc(F)cc2)C1	ZINC001191891326	1367629012	/nfs/dbraw/zinc/62/90/12/1367629012.db2.gz	XTLGCQUKJMIIDL-WMZOPIPTSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@H](N(C)Cc2ccc(COC)cc2)C1	ZINC001191913013	1367637371	/nfs/dbraw/zinc/63/73/71/1367637371.db2.gz	VFPNGKTYSXVXJA-XLIONFOSSA-N	0	3	344.499	3.468	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@@H](N(C)CCOc2ccc(F)cc2)C1	ZINC001191913610	1367638424	/nfs/dbraw/zinc/63/84/24/1367638424.db2.gz	ZQDBBPJXMCOHAP-SJLPKXTDSA-N	0	3	348.462	3.340	20	30		EGEDHN
CC#CCN1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)C2(C)CC2)C1	ZINC001186188429	1387892338	/nfs/dbraw/zinc/89/23/38/1387892338.db2.gz	APFGUKWOMSEQBQ-IEBWSBKVSA-N	0	3	342.458	3.171	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](N(C)C[C@H](OC)c2ccccc2)C1	ZINC001192093420	1367686024	/nfs/dbraw/zinc/68/60/24/1367686024.db2.gz	JUMVNDIKBBENAS-MOPGFXCFSA-N	0	3	330.472	3.263	20	30		EGEDHN
O=C(Nc1ccc(OC(F)F)cc1)N1CCC2SC(=O)C=C2C1	ZINC001192157269	1367704357	/nfs/dbraw/zinc/70/43/57/1367704357.db2.gz	RSJLOUGTUICSSV-LBPRGKRZSA-N	0	3	340.351	3.094	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](N(C)Cc3cccc(OC)c3)C2)CC1	ZINC001192180877	1367707922	/nfs/dbraw/zinc/70/79/22/1367707922.db2.gz	NWIRQXXJSVAXBW-GOSISDBHSA-N	0	3	342.483	3.474	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](N(C)Cc3cccc(C#N)c3)C2)CC1	ZINC001192180594	1367708796	/nfs/dbraw/zinc/70/87/96/1367708796.db2.gz	JLZJYXKUXRVXDX-LJQANCHMSA-N	0	3	337.467	3.337	20	30		EGEDHN
CC(C)CCCC(=O)N1CC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001192489458	1367795117	/nfs/dbraw/zinc/79/51/17/1367795117.db2.gz	FGLACDVEOLEXSP-IBGZPJMESA-N	0	3	327.472	3.417	20	30		EGEDHN
CCCCCCC[C@H](C)NC(=O)N1CCN2C[C@H](OCC)C[C@H]2C1	ZINC001192927296	1367905963	/nfs/dbraw/zinc/90/59/63/1367905963.db2.gz	JMUQSWYZGRUROL-OKZBNKHCSA-N	0	3	339.524	3.240	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)C[C@@H]2CCCC(C)(C)C2)C1	ZINC001193461124	1368035367	/nfs/dbraw/zinc/03/53/67/1368035367.db2.gz	FIXGUQZIHYTGLL-ROUUACIJSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2sccc2C(F)F)C1	ZINC001193755322	1368108712	/nfs/dbraw/zinc/10/87/12/1368108712.db2.gz	IMVRTVXEOZRMED-LBPRGKRZSA-N	0	3	344.427	3.035	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@@H](C)c1ccc(CC)cc1)C2	ZINC001111019976	1368144460	/nfs/dbraw/zinc/14/44/60/1368144460.db2.gz	YRVBDNVEMPOYKS-OTNPHJDUSA-N	0	3	338.495	3.487	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H]1CC[C@H](C(C)C)CC1)C2	ZINC001111180722	1368181575	/nfs/dbraw/zinc/18/15/75/1368181575.db2.gz	KJMVKHZWHNTLSH-WAPOTWQKSA-N	0	3	348.531	3.373	20	30		EGEDHN
C=CC[C@H](C(=O)N1CC[C@@H](N(C)CCOC(C)C)C1)c1ccccc1	ZINC001194173803	1368197932	/nfs/dbraw/zinc/19/79/32/1368197932.db2.gz	FJWYRRJOSHCOAJ-UXHICEINSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=CCCOCC(=O)N1CC[C@H](N(C)[C@H](C)c2ccc(F)cc2)C1	ZINC001194396593	1368252354	/nfs/dbraw/zinc/25/23/54/1368252354.db2.gz	GDFIMSIAAPOYOW-QAPCUYQASA-N	0	3	334.435	3.012	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](CCCC)C(C)C)C2	ZINC001111475100	1368314549	/nfs/dbraw/zinc/31/45/49/1368314549.db2.gz	XIVNAVBTUWLZOA-MKXGPGLRSA-N	0	3	336.520	3.373	20	30		EGEDHN
C#CCCN1CC[C@]2(C1)C[C@H](NC(=O)CCCC)c1ccccc1O2	ZINC001111529090	1368327840	/nfs/dbraw/zinc/32/78/40/1368327840.db2.gz	DMPQMCHHDNTMAD-GHTZIAJQSA-N	0	3	340.467	3.284	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)C[C@@H](NC(=O)C=C(C)C)c1ccccc1O2	ZINC001111530206	1368329685	/nfs/dbraw/zinc/32/96/85/1368329685.db2.gz	UVQFRNMDWCWRMF-NQIIRXRSSA-N	0	3	338.451	3.060	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@H](C)CC(C)C)C[C@@H](C)O2	ZINC001111552601	1368343785	/nfs/dbraw/zinc/34/37/85/1368343785.db2.gz	IWSZNLPYKSGVCY-QZTJIDSGSA-N	0	3	336.520	3.327	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)C(CCC)CCC)C1	ZINC001195692311	1368473739	/nfs/dbraw/zinc/47/37/39/1368473739.db2.gz	ZLLMFDPOFMXHMF-QZTJIDSGSA-N	0	3	326.525	3.335	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cc(C3CC3)n(C)n2)CC1	ZINC001196072643	1368544157	/nfs/dbraw/zinc/54/41/57/1368544157.db2.gz	IRXMXISVBFEVRG-UHFFFAOYSA-N	0	3	344.503	3.192	20	30		EGEDHN
C#CCC1(C(=O)N2CCCN(C[C@@H]3CCC(F)(F)C3)CC2)CCC1	ZINC001196137447	1368556502	/nfs/dbraw/zinc/55/65/02/1368556502.db2.gz	BOBZHVSEDBKTEN-MRXNPFEDSA-N	0	3	338.442	3.150	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@@H](CCC)C(C)C)C1	ZINC001196534267	1368634078	/nfs/dbraw/zinc/63/40/78/1368634078.db2.gz	BLLMJWOFUMEITB-RCCFBDPRSA-N	0	3	326.525	3.190	20	30		EGEDHN
C=CCCN1C[C@@H](O)[C@H](NC(=O)[C@@H](CCC)CC2CCCCC2)C1	ZINC001196637816	1368653536	/nfs/dbraw/zinc/65/35/36/1368653536.db2.gz	MWFPLPYEBWIFSD-IPMKNSEASA-N	0	3	336.520	3.111	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)[C@@H]2CCC(C)=C(C)C2)C[C@H]1C(F)(F)F	ZINC001112107182	1368661388	/nfs/dbraw/zinc/66/13/88/1368661388.db2.gz	RLEMMFISPIXPCS-BZUAXINKSA-N	0	3	342.405	3.125	20	30		EGEDHN
C#CCCCCCC(=O)N1C[C@@H](C(F)(F)F)[C@H](NCC(=C)C)C1	ZINC001112145303	1368679773	/nfs/dbraw/zinc/67/97/73/1368679773.db2.gz	QQQWPUWEOSYASI-HUUCEWRRSA-N	0	3	330.394	3.125	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCCN(C[C@@H](O)C2CCCCC2)CC1	ZINC001196881237	1368706005	/nfs/dbraw/zinc/70/60/05/1368706005.db2.gz	RDZGYZQQXBGBOC-IEBWSBKVSA-N	0	3	336.520	3.064	20	30		EGEDHN
C=CCC[C@H](C)N1CCCN(C(=O)c2nc(Cl)cs2)CC1	ZINC001196908975	1368711637	/nfs/dbraw/zinc/71/16/37/1368711637.db2.gz	AJRFPRMNMNRWFT-LBPRGKRZSA-N	0	3	327.881	3.299	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)C2CCC(C)(C)CC2)C[C@H]1C(F)(F)F	ZINC001112213631	1368721857	/nfs/dbraw/zinc/72/18/57/1368721857.db2.gz	QRTCOPZEBZDKFA-HUUCEWRRSA-N	0	3	344.421	3.205	20	30		EGEDHN
C=CCCCC(=O)N1CCCN(C[C@H](O)[C@H](C)c2ccccc2)CC1	ZINC001197000721	1368729983	/nfs/dbraw/zinc/72/99/83/1368729983.db2.gz	YFGFZNLNIIVKNV-QUCCMNQESA-N	0	3	344.499	3.042	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H]2CCC[C@]2(CNCc2nc(C)sc2C)C1	ZINC001112282101	1368746888	/nfs/dbraw/zinc/74/68/88/1368746888.db2.gz	IYQLMFABGLOYEQ-LPHOPBHVSA-N	0	3	347.528	3.444	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2conc2C2CC2)CC1	ZINC001197134654	1368751822	/nfs/dbraw/zinc/75/18/22/1368751822.db2.gz	UOFDCGUYASPPMC-UHFFFAOYSA-N	0	3	331.460	3.446	20	30		EGEDHN
C#CCCN1CCCN(C(=O)C[C@H](CC)c2ccc(C)cc2)CC1	ZINC001197149608	1368755139	/nfs/dbraw/zinc/75/51/39/1368755139.db2.gz	DAQRNDWCJNIRCZ-IBGZPJMESA-N	0	3	326.484	3.436	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N1CCCN(CC/C=C/CCC)CC1	ZINC001197402453	1368806450	/nfs/dbraw/zinc/80/64/50/1368806450.db2.gz	CKZSZGQSFYACQY-FNYRVFDFSA-N	0	3	334.504	3.248	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N1CCCN(CC/C=C\CCC)CC1	ZINC001197402454	1368806641	/nfs/dbraw/zinc/80/66/41/1368806641.db2.gz	CKZSZGQSFYACQY-RJCMGOLDSA-N	0	3	334.504	3.248	20	30		EGEDHN
C[C@@H](C#N)c1ccc(NC(=O)c2ccc(CN3CC[C@@H](O)C3)cc2)cc1	ZINC001197611420	1368854310	/nfs/dbraw/zinc/85/43/10/1368854310.db2.gz	XZLJVDIKJOLALG-MGPUTAFESA-N	0	3	349.434	3.133	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@@H]2CCC[C@]2(CNCc2cscn2)C1	ZINC001112514716	1368909200	/nfs/dbraw/zinc/90/92/00/1368909200.db2.gz	GCSIJENZOBGGKW-GJYPPUQNSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2ccc(Br)o2)CC1	ZINC001197934209	1368926634	/nfs/dbraw/zinc/92/66/34/1368926634.db2.gz	OWGHBUPOACLATP-UHFFFAOYSA-N	0	3	341.249	3.156	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)CCCC2CC2)C1	ZINC001325438314	1387972243	/nfs/dbraw/zinc/97/22/43/1387972243.db2.gz	NTXDUFNADHCYBE-OXJNMPFZSA-N	0	3	339.483	3.465	20	30		EGEDHN
C#CCCN1CCCN(C(=O)CCCc2cc(C)sc2C)CC1	ZINC001198290848	1368998032	/nfs/dbraw/zinc/99/80/32/1368998032.db2.gz	UKDHBXNNEJBBNP-UHFFFAOYSA-N	0	3	332.513	3.245	20	30		EGEDHN
C#CCC1(C(=O)N2CCCN(CCCCCOC)CC2)CCCCC1	ZINC001198316030	1369007795	/nfs/dbraw/zinc/00/77/95/1369007795.db2.gz	QJOJFXLSHHEANS-UHFFFAOYSA-N	0	3	348.531	3.311	20	30		EGEDHN
C=CCCOCC(=O)N1CCCN([C@H](C)c2cc(C)ccc2C)CC1	ZINC001198336578	1369011362	/nfs/dbraw/zinc/01/13/62/1369011362.db2.gz	DSWXBHHWKDVKSP-LJQANCHMSA-N	0	3	344.499	3.491	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N1CCCN(CC/C=C\c2ccccc2)CC1	ZINC001198342771	1369011891	/nfs/dbraw/zinc/01/18/91/1369011891.db2.gz	AICAVNDWOHAIAX-DIBVOSKASA-N	0	3	342.483	3.215	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)C[C@@H](C)c2ccccc2)C1	ZINC001198374556	1369018310	/nfs/dbraw/zinc/01/83/10/1369018310.db2.gz	XMFVSYCCUDHTRC-MISYRCLQSA-N	0	3	346.515	3.312	20	30		EGEDHN
C#CC[C@@H](CC(=O)N1CCCN(CC[C@H](C)F)CC1)c1ccccc1	ZINC001198394414	1369022047	/nfs/dbraw/zinc/02/20/47/1369022047.db2.gz	IWKWUXDTZKEYJL-ICSRJNTNSA-N	0	3	344.474	3.466	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cc(CC)n(C)n2)CC1	ZINC001198394306	1369022087	/nfs/dbraw/zinc/02/20/87/1369022087.db2.gz	GEGCBWSXKCAKRF-UHFFFAOYSA-N	0	3	334.508	3.101	20	30		EGEDHN
C=CCC[C@@H](C(=O)N1CCCN([C@H](C)COC)CC1)c1ccccc1	ZINC001198411261	1369025615	/nfs/dbraw/zinc/02/56/15/1369025615.db2.gz	NZFUMSVOQHAATB-UYAOXDASSA-N	0	3	344.499	3.306	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)C(C)(F)F)c1ccccc1OC	ZINC001198493135	1369044956	/nfs/dbraw/zinc/04/49/56/1369044956.db2.gz	WYJJGGJLABBITM-AWEZNQCLSA-N	0	3	326.387	3.064	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@@H](C)OCC(C)C)c1ccccc1OC	ZINC001198577356	1369064346	/nfs/dbraw/zinc/06/43/46/1369064346.db2.gz	IXYSNYPOZZGOAS-SJLPKXTDSA-N	0	3	348.487	3.079	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)CSCCC)c1ccccc1OC	ZINC001198578676	1369064778	/nfs/dbraw/zinc/06/47/78/1369064778.db2.gz	TWJROLIQMZODCE-INIZCTEOSA-N	0	3	336.501	3.161	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)CC(F)(F)F)c1ccccc1OC	ZINC001198585011	1369067407	/nfs/dbraw/zinc/06/74/07/1369067407.db2.gz	PJCOSMBGWNHIKL-AWEZNQCLSA-N	0	3	344.377	3.361	20	30		EGEDHN
C=CCCC(=O)NC[C@@H](NCCCCCOC)c1ccccc1OC	ZINC001198594679	1369067664	/nfs/dbraw/zinc/06/76/64/1369067664.db2.gz	AHIYICGQQWMRGT-GOSISDBHSA-N	0	3	348.487	3.225	20	30		EGEDHN
COc1ccccc1[C@H](CNC(=O)[C@H](C)C#N)NCCCC(C)C	ZINC001198617325	1369074854	/nfs/dbraw/zinc/07/48/54/1369074854.db2.gz	NFYXWTRDCPCEOQ-WBVHZDCISA-N	0	3	331.460	3.038	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)C1CC=CC1)c1ccccc1OC	ZINC001198627710	1369076594	/nfs/dbraw/zinc/07/65/94/1369076594.db2.gz	QQIJGAGPTIERCG-GOSISDBHSA-N	0	3	328.456	3.375	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@@H](OCC)C(C)C)c1ccccc1OC	ZINC001198724134	1369100960	/nfs/dbraw/zinc/10/09/60/1369100960.db2.gz	PXFXVWLJMIESFN-MJGOQNOKSA-N	0	3	348.487	3.079	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@H](NCCCCOC)c1ccccc1OC	ZINC001198751943	1369105164	/nfs/dbraw/zinc/10/51/64/1369105164.db2.gz	KZTZLRDOXVMIJB-SFHVURJKSA-N	0	3	348.487	3.225	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@H](NC(C)C)c1ccccc1OC	ZINC001198759443	1369106753	/nfs/dbraw/zinc/10/67/53/1369106753.db2.gz	GZCFBJAXINQYKP-KRWDZBQOSA-N	0	3	341.455	3.152	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)CCc2ncc(C(C)(C)C)o2)CC1	ZINC001112972376	1369117604	/nfs/dbraw/zinc/11/76/04/1369117604.db2.gz	VTOCVWWJDNEJIE-INIZCTEOSA-N	0	3	347.503	3.404	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H](NCCCF)c1ccccc1OC	ZINC001198825538	1369122438	/nfs/dbraw/zinc/12/24/38/1369122438.db2.gz	CSMCOGALJCUSNN-MRXNPFEDSA-N	0	3	336.451	3.404	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)[C@H](F)C(C)C)c1ccccc1OC	ZINC001198842266	1369127234	/nfs/dbraw/zinc/12/72/34/1369127234.db2.gz	FXGOVEDWAWGCSC-FUHWJXTLSA-N	0	3	336.451	3.402	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@H](NCC1CC1)c1ccccc1OC	ZINC001198856860	1369130866	/nfs/dbraw/zinc/13/08/66/1369130866.db2.gz	KUADVIQGLDJYAD-QAPCUYQASA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)C1(CF)CC1)c1ccccc1OC	ZINC001198902918	1369145228	/nfs/dbraw/zinc/14/52/28/1369145228.db2.gz	RRTCEZJTHDICBV-MRXNPFEDSA-N	0	3	334.435	3.158	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)c2ccc(C3CC3)cc2)C1	ZINC001198904213	1369145285	/nfs/dbraw/zinc/14/52/85/1369145285.db2.gz	CYYCKEADYWOZJI-WOJBJXKFSA-N	0	3	342.483	3.085	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)c1cc(C)[nH]c1C)c1ccccc1OC	ZINC001198916658	1369148706	/nfs/dbraw/zinc/14/87/06/1369148706.db2.gz	QHDUUANSMYWYPZ-GOSISDBHSA-N	0	3	341.455	3.277	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)C[C@@H](C)c2c(C)n[nH]c2C)CC1	ZINC001113032983	1369153871	/nfs/dbraw/zinc/15/38/71/1369153871.db2.gz	TVLWGAZRSRQWBH-HUUCEWRRSA-N	0	3	332.492	3.019	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)c1oncc1C)c1ccccc1OC	ZINC001198952965	1369156847	/nfs/dbraw/zinc/15/68/47/1369156847.db2.gz	FMUMJLMOGZDEQE-INIZCTEOSA-N	0	3	343.427	3.019	20	30		EGEDHN
C=CCCOCC(=O)NC[C@@H](NCCCCC)c1ccccc1OC	ZINC001199002584	1369169915	/nfs/dbraw/zinc/16/99/15/1369169915.db2.gz	WHWZVFFMQRMGAZ-GOSISDBHSA-N	0	3	348.487	3.225	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@@H]2CCCC(C)(C)C2)C1	ZINC001199210253	1369191170	/nfs/dbraw/zinc/19/11/70/1369191170.db2.gz	DZYOZSPVJLFUSS-KZNAEPCWSA-N	0	3	338.536	3.335	20	30		EGEDHN
CC[C@H](C)CC(=O)N1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001200273917	1369339970	/nfs/dbraw/zinc/33/99/70/1369339970.db2.gz	WYDYLURAWOIMJE-AWEZNQCLSA-N	0	3	331.435	3.214	20	30		EGEDHN
Cc1cc(C#N)c(NC(=S)NCCN2CCCCC2)cc1Cl	ZINC001200432996	1369366883	/nfs/dbraw/zinc/36/68/83/1369366883.db2.gz	HTBOCKWKWQXRMC-UHFFFAOYSA-N	0	3	336.892	3.292	20	30		EGEDHN
C=C(Br)CNC1CCN(C(=O)CC(C)(C)CC)CC1	ZINC001200758512	1369424082	/nfs/dbraw/zinc/42/40/82/1369424082.db2.gz	GLIUOBLQHCBSQJ-UHFFFAOYSA-N	0	3	331.298	3.302	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC(NCc2nc(C)sc2C)CC1	ZINC001200795044	1369430552	/nfs/dbraw/zinc/43/05/52/1369430552.db2.gz	UXNWRAOLSOQJMV-UHFFFAOYSA-N	0	3	335.517	3.443	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)C[C@@H]2OCCc3ccsc32)CC1	ZINC001113559525	1369493139	/nfs/dbraw/zinc/49/31/39/1369493139.db2.gz	XLUKDFNBDKCHHC-WBVHZDCISA-N	0	3	348.512	3.251	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCCO[C@@H](CNCc2ccsc2)C1	ZINC001201232398	1369501015	/nfs/dbraw/zinc/50/10/15/1369501015.db2.gz	FYUXSYWYDIDADP-WBVHZDCISA-N	0	3	336.501	3.058	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)CCOc2cccc(C)c2)CC1	ZINC001113628333	1369530417	/nfs/dbraw/zinc/53/04/17/1369530417.db2.gz	ZAXFZBJDFPDDFW-SFHVURJKSA-N	0	3	330.472	3.263	20	30		EGEDHN
C#CCNC[C@H]1CN(C(=O)[C@@H](CC2CCCCC2)C(C)C)CCCO1	ZINC001201546135	1369570924	/nfs/dbraw/zinc/57/09/24/1369570924.db2.gz	GDTIGOSCAJXQGC-PMACEKPBSA-N	0	3	348.531	3.069	20	30		EGEDHN
C#CC[C@@H](CC(=O)N1CCN(C[C@H](C)CC)CC1)c1ccccc1	ZINC001113736622	1369596108	/nfs/dbraw/zinc/59/61/08/1369596108.db2.gz	MDTUZBVVFJGOLK-QUCCMNQESA-N	0	3	326.484	3.374	20	30		EGEDHN
CN1CCN(c2cc(Nc3c(F)cc(C#N)cc3Cl)ccn2)CC1	ZINC001201667255	1369601095	/nfs/dbraw/zinc/60/10/95/1369601095.db2.gz	DQENTEINEWUWHZ-UHFFFAOYSA-N	0	3	345.809	3.241	20	30		EGEDHN
CC#CCNC[C@@H]1CN(C(=O)[C@H](CCCCC)C(C)C)CCCO1	ZINC001201822442	1369629396	/nfs/dbraw/zinc/62/93/96/1369629396.db2.gz	AORSQBBMGRQZTL-RTBURBONSA-N	0	3	336.520	3.069	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)N1CCC(NCc2cc(C3CC3)no2)CC1	ZINC001202084384	1369683900	/nfs/dbraw/zinc/68/39/00/1369683900.db2.gz	BLSIQTKNCRLOGW-UONOGXRCSA-N	0	3	331.460	3.091	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)N1CCC(NCc2nc(C)sc2C)CC1	ZINC001202084680	1369684037	/nfs/dbraw/zinc/68/40/37/1369684037.db2.gz	HRBQQCMCQLWWQQ-QWHCGFSZSA-N	0	3	335.517	3.299	20	30		EGEDHN
CCC(=O)N[C@H]1C[C@H](NCC#Cc2cccc(Cl)c2)C12CCC2	ZINC001202257373	1369724335	/nfs/dbraw/zinc/72/43/35/1369724335.db2.gz	AJNGCBAHJQKSMK-IRXDYDNUSA-N	0	3	330.859	3.119	20	30		EGEDHN
CC(C)CC(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C12CCC2	ZINC001202340600	1369743179	/nfs/dbraw/zinc/74/31/79/1369743179.db2.gz	KUQHGXBQAWAJNY-MSOLQXFVSA-N	0	3	343.446	3.260	20	30		EGEDHN
CC(C)CC(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C12CCC2	ZINC001202340609	1369743260	/nfs/dbraw/zinc/74/32/60/1369743260.db2.gz	KUQHGXBQAWAJNY-ROUUACIJSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC(NCC(=C)Br)CC2)CC1	ZINC001202358963	1369748791	/nfs/dbraw/zinc/74/87/91/1369748791.db2.gz	JEYQZKLDTXVFOD-UHFFFAOYSA-N	0	3	341.293	3.222	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H]2C[C@@H](NCC#Cc3ccccc3)C23CCC3)o1	ZINC001202370576	1369752967	/nfs/dbraw/zinc/75/29/67/1369752967.db2.gz	IPOHIUGXUBPJKC-WOJBJXKFSA-N	0	3	348.446	3.270	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@H](NCC#Cc2ccc(F)cc2)C12CCC2	ZINC001202591593	1369815766	/nfs/dbraw/zinc/81/57/66/1369815766.db2.gz	PFZZFNYKPFCQOK-OALUTQOASA-N	0	3	340.442	3.160	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@H](NCc2cnc(Cl)s2)C12CCC2	ZINC001202593159	1369816286	/nfs/dbraw/zinc/81/62/86/1369816286.db2.gz	XXHPRURDIACBRU-STQMWFEESA-N	0	3	339.892	3.280	20	30		EGEDHN
O=C(C#CC1CC1)N[C@H]1C[C@@H](NCc2ccccc2Cl)C12CCC2	ZINC001202888072	1369917925	/nfs/dbraw/zinc/91/79/25/1369917925.db2.gz	OSWIQYGQVBEYKY-MSOLQXFVSA-N	0	3	342.870	3.270	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2[C@H]3CN([C@@H](C)c4ccc(F)cc4)C[C@H]32)CCC1	ZINC001114397845	1369932336	/nfs/dbraw/zinc/93/23/36/1369932336.db2.gz	SWSYJLLWWSSWDK-WQANXHIZSA-N	0	3	340.442	3.127	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1C[C@@H](NCc2c(C)noc2C)C12CCC2	ZINC001202960246	1369937188	/nfs/dbraw/zinc/93/71/88/1369937188.db2.gz	LNXSTOLBDVIAIQ-SJORKVTESA-N	0	3	345.487	3.411	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1C[C@@H](NCc2ccc(F)cn2)C12CCC2	ZINC001202960213	1369937363	/nfs/dbraw/zinc/93/73/63/1369937363.db2.gz	KSJRUFGPUDBIAE-SJORKVTESA-N	0	3	345.462	3.340	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1C[C@@H](NCc2cnc(C)o2)C12CCC2	ZINC001202961318	1369937853	/nfs/dbraw/zinc/93/78/53/1369937853.db2.gz	WUXWRMQJVZNDLS-QZTJIDSGSA-N	0	3	343.471	3.268	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1C[C@H](NCc2cnc(C)o2)C12CCC2	ZINC001202961320	1369937858	/nfs/dbraw/zinc/93/78/58/1369937858.db2.gz	WUXWRMQJVZNDLS-ROUUACIJSA-N	0	3	343.471	3.268	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1C[C@@H](NCc2c(C)onc2CC)C12CCC2	ZINC001202987682	1369946779	/nfs/dbraw/zinc/94/67/79/1369946779.db2.gz	OBFCQXAEYUMPTJ-MSOLQXFVSA-N	0	3	345.487	3.419	20	30		EGEDHN
CC[C@H](C)CCC(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001203037264	1369962548	/nfs/dbraw/zinc/96/25/48/1369962548.db2.gz	KOJSRCDMWJHCTA-INIZCTEOSA-N	0	3	327.472	3.465	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C)c(OC)c3)C[C@H]21	ZINC001114681263	1370022544	/nfs/dbraw/zinc/02/25/44/1370022544.db2.gz	RHTIOPCVXXDDIW-DZFIZOCASA-N	0	3	342.483	3.152	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C(F)F)cc3)C[C@H]21	ZINC001114683860	1370023668	/nfs/dbraw/zinc/02/36/68/1370023668.db2.gz	WFJCCGHYHHODTP-ZSHCYNCHSA-N	0	3	334.410	3.383	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)CC2(C)CC2)C12CCC2	ZINC001203204488	1370024093	/nfs/dbraw/zinc/02/40/93/1370024093.db2.gz	VILNPQJBIYGCNR-QWHCGFSZSA-N	0	3	341.293	3.102	20	30		EGEDHN
C#CCCCCCC(=O)NC1[C@H]2CN(C/C=C\c3ccccc3)C[C@@H]12	ZINC001114692218	1370028722	/nfs/dbraw/zinc/02/87/22/1370028722.db2.gz	CSIXCXINYMSOTK-PKULTJPBSA-N	0	3	336.479	3.330	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)C2(C(F)F)CCC2)C12CCC2	ZINC001203311272	1370076565	/nfs/dbraw/zinc/07/65/65/1370076565.db2.gz	MMHQWPAEUHLCIS-NWDGAFQWSA-N	0	3	332.822	3.191	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1C[C@H](NCc2c(C)onc2CC)C12CCC2	ZINC001203272561	1370053582	/nfs/dbraw/zinc/05/35/82/1370053582.db2.gz	DLVPQEDEVPPCLY-DLBZAZTESA-N	0	3	345.487	3.275	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1C[C@@H](NCc2ccccn2)C12CCC2	ZINC001203295314	1370067330	/nfs/dbraw/zinc/06/73/30/1370067330.db2.gz	JRFIQTBTXICLSK-RTBURBONSA-N	0	3	339.483	3.182	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1C[C@@H](NCc2ccns2)C12CCC2	ZINC001203295574	1370067798	/nfs/dbraw/zinc/06/77/98/1370067798.db2.gz	LXBITSOWULXZNM-SJORKVTESA-N	0	3	345.512	3.244	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1C[C@H](NCc2oc(C)nc2C)C12CCC2	ZINC001203339510	1370089288	/nfs/dbraw/zinc/08/92/88/1370089288.db2.gz	HZXRUYRKBKEZHN-IRXDYDNUSA-N	0	3	331.460	3.165	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1C[C@H](NCc2conc2CC)C12CCC2	ZINC001203341624	1370089868	/nfs/dbraw/zinc/08/98/68/1370089868.db2.gz	RZQAIMAZXYJESG-IRXDYDNUSA-N	0	3	331.460	3.110	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1C[C@@H](NCc2cc(OC)ns2)C12CCC2	ZINC001203340963	1370090032	/nfs/dbraw/zinc/09/00/32/1370090032.db2.gz	NGTBJAYZQKINAN-HUUCEWRRSA-N	0	3	349.500	3.025	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)C2(C(F)(F)F)CC2)C12CCC2	ZINC001203435572	1370125630	/nfs/dbraw/zinc/12/56/30/1370125630.db2.gz	OSWDNRVYXCEFJW-GHMZBOCLSA-N	0	3	336.785	3.098	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1[C@H]2CN(CCc3ccc(F)c(F)c3)C[C@H]21	ZINC001114898464	1370137114	/nfs/dbraw/zinc/13/71/14/1370137114.db2.gz	ALEWKEMXEXVRNS-HWWDLCQESA-N	0	3	348.437	3.156	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3ccccc3OCC)C2)C1=O	ZINC001203536778	1370159766	/nfs/dbraw/zinc/15/97/66/1370159766.db2.gz	HZCXHMIIJGNNDL-FQEVSTJZSA-N	0	3	328.456	3.086	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)COCCCCCC)C12CCC2	ZINC001203659606	1370205890	/nfs/dbraw/zinc/20/58/90/1370205890.db2.gz	JWEKGZDKOINKBC-CVEARBPZSA-N	0	3	342.911	3.353	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@H]1C[C@@H]2C[C@H]1CN2Cc1cccc(C#N)c1	ZINC001203756956	1370250717	/nfs/dbraw/zinc/25/07/17/1370250717.db2.gz	GANBGGABPCQBLU-ULQDDVLXSA-N	0	3	327.428	3.046	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC001203756892	1370251366	/nfs/dbraw/zinc/25/13/66/1370251366.db2.gz	FLHOEKCZQCYRIU-QGZVFWFLSA-N	0	3	329.444	3.390	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(N[C@H](C)c3cnccn3)CC2)CCCC1	ZINC001204157153	1370393132	/nfs/dbraw/zinc/39/31/32/1370393132.db2.gz	NYCMKNQQSXZEIU-MRXNPFEDSA-N	0	3	342.487	3.255	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)CC2CC2)CCCCC1	ZINC001115378189	1370417953	/nfs/dbraw/zinc/41/79/53/1370417953.db2.gz	YNJTUNCRQJZOHW-UHFFFAOYSA-N	0	3	329.282	3.104	20	30		EGEDHN
C[C@H]1C[C@H]1C(=O)NCC1(NCc2cc(C#N)ccc2F)CCCCC1	ZINC001115389324	1370425897	/nfs/dbraw/zinc/42/58/97/1370425897.db2.gz	OGAPIMCMAWTVCF-WMLDXEAASA-N	0	3	343.446	3.262	20	30		EGEDHN
C=CCOc1ccc(CN2CCC(NC(=O)N3CCCC3)CC2)cc1	ZINC001204302613	1370437418	/nfs/dbraw/zinc/43/74/18/1370437418.db2.gz	OSTSLBLTTQPPDC-UHFFFAOYSA-N	0	3	343.471	3.021	20	30		EGEDHN
CCc1ccc(CN2CC[C@@]3(CC(=O)N(c4cccc(C#N)c4)C3)C2)o1	ZINC001204393480	1370464872	/nfs/dbraw/zinc/46/48/72/1370464872.db2.gz	PPZHXQRTYGMZBJ-OAQYLSRUSA-N	0	3	349.434	3.343	20	30		EGEDHN
C#CCCCC(=O)NCC1(NCc2cccc(Cl)n2)CCCCC1	ZINC001115507903	1370507801	/nfs/dbraw/zinc/50/78/01/1370507801.db2.gz	UQCSTZNMJWFVJK-UHFFFAOYSA-N	0	3	347.890	3.447	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H](C)[C@H](C)COC)CCCCC1	ZINC001115567530	1370568128	/nfs/dbraw/zinc/56/81/28/1370568128.db2.gz	KRSHONUVQYEKNF-HIFRSBDPSA-N	0	3	330.900	3.066	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H](OC)[C@@H](C)CC)CCCCC1	ZINC001115606443	1370605119	/nfs/dbraw/zinc/60/51/19/1370605119.db2.gz	GJIUSUZHULAEMQ-DZGCQCFKSA-N	0	3	330.900	3.209	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H](C)C(F)(F)F)CCCCC1	ZINC001115672144	1370653721	/nfs/dbraw/zinc/65/37/21/1370653721.db2.gz	DQAWSYIYPYUCBZ-LLVKDONJSA-N	0	3	326.790	3.346	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCC1(NCc2cnc(C)cn2)CCCCC1	ZINC001115679656	1370663200	/nfs/dbraw/zinc/66/32/00/1370663200.db2.gz	LTBIDSRZPPBYFQ-NVXWUHKLSA-N	0	3	344.503	3.152	20	30		EGEDHN
CCc1nc(CNCC2CCN(C(=O)C#CC(C)(C)C)CC2)cs1	ZINC001205230611	1370688977	/nfs/dbraw/zinc/68/89/77/1370688977.db2.gz	RGKYELNDSBZMPE-UHFFFAOYSA-N	0	3	347.528	3.083	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H](CC(C)C)OC)CCCCC1	ZINC001115717011	1370697079	/nfs/dbraw/zinc/69/70/79/1370697079.db2.gz	LCPWGBQHSSQKCQ-OAHLLOKOSA-N	0	3	330.900	3.209	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccc3c(c2)CCO3)CCCCC1	ZINC001115744027	1370723914	/nfs/dbraw/zinc/72/39/14/1370723914.db2.gz	KUVWBTUVWUGUKH-UHFFFAOYSA-N	0	3	348.874	3.396	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@@H]2CC=CCC2)C[C@H]1c1cccc(F)c1	ZINC001205354707	1370730113	/nfs/dbraw/zinc/73/01/13/1370730113.db2.gz	IYHOPOOBYZBZSN-LSTHTHJFSA-N	0	3	340.442	3.089	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC(CN[C@@H](C)c2cnccn2)CC1	ZINC001205384473	1370738275	/nfs/dbraw/zinc/73/82/75/1370738275.db2.gz	VISMEKAVINQWEM-INIZCTEOSA-N	0	3	342.487	3.134	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC(CNCc2cc(C3CC3)no2)CC1	ZINC001205398008	1370743484	/nfs/dbraw/zinc/74/34/84/1370743484.db2.gz	SKYLAFVPAWAJNG-UHFFFAOYSA-N	0	3	345.487	3.483	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC(CN[C@H](C)c2cnc(C)cn2)CC1	ZINC001205407567	1370747000	/nfs/dbraw/zinc/74/70/00/1370747000.db2.gz	RBJCJVNMSYPWAQ-MRXNPFEDSA-N	0	3	330.476	3.031	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@@H]2C[C@H]2CCC)C[C@H]1c1cccc(F)c1	ZINC001205434517	1370754018	/nfs/dbraw/zinc/75/40/18/1370754018.db2.gz	KAQXAVGTQPJOJQ-GEALJGNFSA-N	0	3	342.458	3.169	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H](c2cccc(F)c2)[C@H](NCC#CC)C1	ZINC001205439734	1370756025	/nfs/dbraw/zinc/75/60/25/1370756025.db2.gz	IMBOWJWOGMFLEV-RBUKOAKNSA-N	0	3	342.458	3.335	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@@H](CCC)C(C)C)[C@@H]3COC[C@@H]32)CC1	ZINC001205512218	1370776365	/nfs/dbraw/zinc/77/63/65/1370776365.db2.gz	RHAVBCAXVDXDBY-GBESFXJTSA-N	0	3	348.531	3.184	20	30		EGEDHN
CC(F)(F)CCC(=O)N1CCC(CNCc2ccccc2C#N)CC1	ZINC001205543583	1370787346	/nfs/dbraw/zinc/78/73/46/1370787346.db2.gz	XEOZPOXUTKCMPW-UHFFFAOYSA-N	0	3	349.425	3.322	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)N1CCC(CNCc2ccccc2C#N)CC1	ZINC001205956063	1370922928	/nfs/dbraw/zinc/92/29/28/1370922928.db2.gz	ZKJIXBVGWDWLBP-IAGOWNOFSA-N	0	3	339.483	3.345	20	30		EGEDHN
C=C(CN1CCCC1)c1nc(-c2ccncc2Br)no1	ZINC001206100568	1370960449	/nfs/dbraw/zinc/96/04/49/1370960449.db2.gz	RTEBQXBGRSYYLI-UHFFFAOYSA-N	0	3	335.205	3.003	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N[C@@H]1CN(Cc2cc(C)cc(C)c2)C[C@H]1C	ZINC001206429174	1371051988	/nfs/dbraw/zinc/05/19/88/1371051988.db2.gz	RPLQWNSZSSYWIF-QWFCFKBJSA-N	0	3	344.499	3.221	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N[C@@H]1CN(Cc2ccc(C)cc2C)C[C@H]1C	ZINC001206429258	1371052547	/nfs/dbraw/zinc/05/25/47/1371052547.db2.gz	VAHBABVMKIVHQL-WSTZPKSXSA-N	0	3	344.499	3.221	20	30		EGEDHN
N#CCc1ccc(CN2CCC(O)(Cc3ccccc3F)CC2)cc1	ZINC001118100324	1371131862	/nfs/dbraw/zinc/13/18/62/1371131862.db2.gz	TYLDCXDBBGUWKO-UHFFFAOYSA-N	0	3	338.426	3.461	20	30		EGEDHN
COC(=O)Cc1ccccc1CNC1CC(C#N)(c2ccccc2)C1	ZINC001118390819	1371172013	/nfs/dbraw/zinc/17/20/13/1371172013.db2.gz	YGKTWPBUUPMZAI-UHFFFAOYSA-N	0	3	334.419	3.116	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H]1CN(CCOCC2CCC2)C[C@H]1C	ZINC001207145625	1371309184	/nfs/dbraw/zinc/30/91/84/1371309184.db2.gz	LZWJTBGVOHTFHY-CZUORRHYSA-N	0	3	342.911	3.018	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN(Cc2ccc(OC)c(C)c2)C[C@H]1C	ZINC001207215585	1371331968	/nfs/dbraw/zinc/33/19/68/1371331968.db2.gz	MAFBLENEUNMJEF-SJLPKXTDSA-N	0	3	330.472	3.296	20	30		EGEDHN
CC[C@H](C)N[C@@H](CNC(=O)Nc1sccc1C#N)c1ccco1	ZINC001119831553	1371410743	/nfs/dbraw/zinc/41/07/43/1371410743.db2.gz	YZFAMZTVVZWSML-AAEUAGOBSA-N	0	3	332.429	3.464	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H](C)CCCOC)CCCCC1	ZINC001119978728	1371438815	/nfs/dbraw/zinc/43/88/15/1371438815.db2.gz	MZURELMFZXFKIM-CQSZACIVSA-N	0	3	330.900	3.210	20	30		EGEDHN
C=CCOCCCC(=O)N1CCC[C@H](N[C@H](C)c2ccccc2F)C1	ZINC001207741634	1371490591	/nfs/dbraw/zinc/49/05/91/1371490591.db2.gz	NXTWGXUNRSOGQR-SJORKVTESA-N	0	3	348.462	3.450	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)CCCOCC)C1	ZINC001120329689	1371536637	/nfs/dbraw/zinc/53/66/37/1371536637.db2.gz	UKLNVCZOQMKIMM-DLBZAZTESA-N	0	3	342.911	3.259	20	30		EGEDHN
CC/C(C)=C/C(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001208002980	1371564660	/nfs/dbraw/zinc/56/46/60/1371564660.db2.gz	ZYQUEMRBBUNTHT-JRJUITNWSA-N	0	3	328.431	3.114	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC[C@@H](N[C@@H]2CCc3c2c(F)ccc3F)C1	ZINC001208005231	1371564781	/nfs/dbraw/zinc/56/47/81/1371564781.db2.gz	BAWSSIITHLSBJY-RDTXWAMCSA-N	0	3	346.421	3.192	20	30		EGEDHN
C=C(C)[C@@H]1CC=C(CN2CCC[C@@H](OCC(=O)N(C)CC)C2)CC1	ZINC001208178547	1371618935	/nfs/dbraw/zinc/61/89/35/1371618935.db2.gz	JNGBQIXHDDWKLY-RTBURBONSA-N	0	3	334.504	3.248	20	30		EGEDHN
O=C([C@@H]1CCCC12CC2)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001208414261	1371758912	/nfs/dbraw/zinc/75/89/12/1371758912.db2.gz	LJZPYGBUYCSALQ-UXHICEINSA-N	0	3	336.479	3.199	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC[C@H](NCC=C(Cl)Cl)C2)cc1	ZINC001208901159	1371938749	/nfs/dbraw/zinc/93/87/49/1371938749.db2.gz	MJJLAOVXHOUIND-HNNXBMFYSA-N	0	3	337.250	3.181	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NC1CC2(CC(NCc3nc(C)cs3)C2)C1	ZINC001121611709	1372024680	/nfs/dbraw/zinc/02/46/80/1372024680.db2.gz	XNUYZCZGZGPLSE-BSMHSISQSA-N	0	3	347.528	3.427	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001209182185	1372026794	/nfs/dbraw/zinc/02/67/94/1372026794.db2.gz	ATTMCHCDMXZJAS-YJBOKZPZSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC1CC2(CC(NCc3nccs3)C2)C1	ZINC001121616622	1372026802	/nfs/dbraw/zinc/02/68/02/1372026802.db2.gz	NBPUZEIBZIVAHY-RWQKBRBCSA-N	0	3	333.501	3.262	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001209182183	1372027013	/nfs/dbraw/zinc/02/70/13/1372027013.db2.gz	ATTMCHCDMXZJAS-MAUKXSAKSA-N	0	3	343.446	3.380	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC(F)(CN2CCC(S)CC2)CC1	ZINC001209236849	1372047002	/nfs/dbraw/zinc/04/70/02/1372047002.db2.gz	VDHQLPHUOIRRFC-UHFFFAOYSA-N	0	3	332.485	3.120	20	30		EGEDHN
C#CCCCN1CC[C@H](NC(=O)OC(C)(C)C)[C@H](C(F)(F)F)C1	ZINC001209268115	1372054963	/nfs/dbraw/zinc/05/49/63/1372054963.db2.gz	UIBFRJRYXRFMSX-OLZOCXBDSA-N	0	3	334.382	3.177	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC1CC2(CC(NCc3conc3C)C2)C1	ZINC001121713376	1372056185	/nfs/dbraw/zinc/05/61/85/1372056185.db2.gz	HVJSPQIFDSDEQZ-CBRGODRTSA-N	0	3	331.460	3.102	20	30		EGEDHN
Cc1cccc(CC(=O)N2CCC[C@@H](NCC#Cc3ccccc3)C2)c1	ZINC001209345753	1372073762	/nfs/dbraw/zinc/07/37/62/1372073762.db2.gz	NOXPIOYXOUYSLB-JOCHJYFZSA-N	0	3	346.474	3.170	20	30		EGEDHN
CC(C)(C)OC(=O)NCCCCN1CCc2ccc(C#N)cc2C1	ZINC001209360288	1372078117	/nfs/dbraw/zinc/07/81/17/1372078117.db2.gz	MOGLQBJNKUHPIB-UHFFFAOYSA-N	0	3	329.444	3.221	20	30		EGEDHN
C=CCCCCCCCN1CC[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C1	ZINC001209442855	1372106980	/nfs/dbraw/zinc/10/69/80/1372106980.db2.gz	XRFDOFPTGOEWNG-IAGOWNOFSA-N	0	3	340.508	3.473	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001209708808	1372176036	/nfs/dbraw/zinc/17/60/36/1372176036.db2.gz	RIQPMIVZBVTZGU-NZSAHSFTSA-N	0	3	344.886	3.318	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N1CCC(N2c3ccccc3C[C@H]2C)CC1	ZINC001122127818	1372181800	/nfs/dbraw/zinc/18/18/00/1372181800.db2.gz	FOTXUTOEKVSDNE-APWZRJJASA-N	0	3	341.499	3.112	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001209867416	1372217571	/nfs/dbraw/zinc/21/75/71/1372217571.db2.gz	YQFZCUNWJROYSA-KRWDZBQOSA-N	0	3	343.446	3.380	20	30		EGEDHN
CC[C@@H](C)c1ccc(NC(=O)C(C#N)C(=O)[C@@H]2[C@H]3CCCO[C@H]32)cc1	ZINC001122546893	1372271955	/nfs/dbraw/zinc/27/19/55/1372271955.db2.gz	DAHVPIGJUDMARY-SPTUJORTSA-N	0	3	340.423	3.272	20	30		EGEDHN
CC1(CCC(=O)N2CCC[C@@H](NCC#Cc3ccc(F)cc3)C2)CC1	ZINC001210463948	1372359804	/nfs/dbraw/zinc/35/98/04/1372359804.db2.gz	HQRHXWSMIHWBJX-LJQANCHMSA-N	0	3	342.458	3.338	20	30		EGEDHN
N#Cc1ccc(Oc2ccc(CN3CCNC[C@@H](F)C3)cc2)cc1	ZINC001210611755	1372391031	/nfs/dbraw/zinc/39/10/31/1372391031.db2.gz	UGAUUVQHEVBAOZ-QGZVFWFLSA-N	0	3	325.387	3.094	20	30		EGEDHN
Cn1c(Cl)cnc1C(C#N)C(=O)C[C@@H](CC#N)c1ccccc1	ZINC001123337908	1372431460	/nfs/dbraw/zinc/43/14/60/1372431460.db2.gz	VVACLRGHKCWSAC-ZIAGYGMSSA-N	0	3	326.787	3.337	20	30		EGEDHN
C[C@@H](CC(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1)C1CC1	ZINC001211276317	1372519170	/nfs/dbraw/zinc/51/91/70/1372519170.db2.gz	FKCZMPGJIUFPFM-JXFKEZNVSA-N	0	3	342.458	3.194	20	30		EGEDHN
CCC(=O)N1C[C@@H](c2ccccc2)[C@H](NCC#Cc2ccccc2)C1	ZINC001211502303	1372569994	/nfs/dbraw/zinc/56/99/94/1372569994.db2.gz	VSMZKHYEGJLTPV-LEWJYISDSA-N	0	3	332.447	3.032	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C(F)=C2CCCC2)C[C@H]1c1ccccc1	ZINC001211571253	1372582605	/nfs/dbraw/zinc/58/26/05/1372582605.db2.gz	GGYHQMIIQDIDCA-RBUKOAKNSA-N	0	3	340.442	3.392	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C[C@H]2CC=CCC2)C[C@H]1c1ccccc1	ZINC001211648496	1372595472	/nfs/dbraw/zinc/59/54/72/1372595472.db2.gz	BAUIHKNVDJPDNH-SESVDKBCSA-N	0	3	336.479	3.340	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2cccc(CC)n2)[C@H](OC)C1	ZINC001212414874	1372702398	/nfs/dbraw/zinc/70/23/98/1372702398.db2.gz	XINWQKVWASLJFR-RTBURBONSA-N	0	3	347.503	3.043	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN([C@@H](C)c2cccc(C)c2)C[C@H]1OC	ZINC001213356902	1372890969	/nfs/dbraw/zinc/89/09/69/1372890969.db2.gz	DMDARMQNQCJPLU-QXAKKESOSA-N	0	3	330.472	3.228	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1CN(CCCC2CCCC2)C[C@H]1OC	ZINC001213390220	1372898488	/nfs/dbraw/zinc/89/84/88/1372898488.db2.gz	UOQICBPIVACDFY-GGPKGHCWSA-N	0	3	336.520	3.375	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@H](C)C(C)(F)F)[C@H](OC)C1	ZINC001213451662	1372907666	/nfs/dbraw/zinc/90/76/66/1372907666.db2.gz	IEHBCRQDZDGHLC-RRFJBIMHSA-N	0	3	334.451	3.064	20	30		EGEDHN
CCCCC(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001214161674	1373017922	/nfs/dbraw/zinc/01/79/22/1373017922.db2.gz	APKIJXMULIKOSO-CRAIPNDOSA-N	0	3	332.875	3.318	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](C)[C@H](NCc2c(C)nsc2C)C1	ZINC001214727763	1373110306	/nfs/dbraw/zinc/11/03/06/1373110306.db2.gz	QVSRTNWHDXTVMR-MLGOLLRUSA-N	0	3	335.517	3.299	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001214727534	1373110397	/nfs/dbraw/zinc/11/03/97/1373110397.db2.gz	GGHWNNHHCAPROW-RDTXWAMCSA-N	0	3	343.446	3.236	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@H]2CCCC23CC3)C[C@H]1NCC#Cc1ccccc1	ZINC001214954843	1373147329	/nfs/dbraw/zinc/14/73/29/1373147329.db2.gz	HWNQEHFQDGOXSY-MISYRCLQSA-N	0	3	336.479	3.055	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001215367375	1373203688	/nfs/dbraw/zinc/20/36/88/1373203688.db2.gz	MBFDJTWAMKDXAI-JJRVBVJISA-N	0	3	331.485	3.159	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc(C3CCC3)cc2)cc1	ZINC001128859866	1373317357	/nfs/dbraw/zinc/31/73/57/1373317357.db2.gz	RGZHIMGIGQFHER-UHFFFAOYSA-N	0	3	333.435	3.345	20	30		EGEDHN
CN(C)Cc1ccc(-c2noc(-c3ccc(C#N)c([N+](=O)[O-])c3)n2)cc1	ZINC001216962320	1373372259	/nfs/dbraw/zinc/37/22/59/1373372259.db2.gz	ZLWPNHKGNWBLOT-UHFFFAOYSA-N	0	3	349.350	3.245	20	30		EGEDHN
COc1ccc(CNCCNC(=O)C2(C)CCCCCC2)cc1C#N	ZINC001129647874	1373407537	/nfs/dbraw/zinc/40/75/37/1373407537.db2.gz	PGYATJFONRBGOJ-UHFFFAOYSA-N	0	3	343.471	3.133	20	30		EGEDHN
C=C(C)CN1CC[C@H](Oc2cnccc2CNC(=O)/C=C(\C)CC)C1	ZINC001130317130	1373491272	/nfs/dbraw/zinc/49/12/72/1373491272.db2.gz	LDVOAZHQNMRHLX-BXBHGGAKSA-N	0	3	343.471	3.083	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)C[C@H](C)CC(C)(C)C)C1	ZINC001130426945	1373534213	/nfs/dbraw/zinc/53/42/13/1373534213.db2.gz	KLUSSJNZQADTEN-HOTGVXAUSA-N	0	3	346.519	3.464	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)C(C)(C)CC(C)(C)C)C1	ZINC001130450591	1373544967	/nfs/dbraw/zinc/54/49/67/1373544967.db2.gz	POWPBLZETFEDPC-HNNXBMFYSA-N	0	3	346.519	3.464	20	30		EGEDHN
N#Cc1ccc(OCc2ccccc2)cc1O[C@@H]1CCNC[C@@H]1F	ZINC001218066953	1373552028	/nfs/dbraw/zinc/55/20/28/1373552028.db2.gz	OWXLERZXSIGMFP-ZWKOTPCHSA-N	0	3	326.371	3.216	20	30		EGEDHN
CCCCCCCC(=O)c1ccc(O[C@@H]2CN3C[C@H]2NCC3)cc1	ZINC001218111733	1373563062	/nfs/dbraw/zinc/56/30/62/1373563062.db2.gz	VWIJABNIARPHHB-UYAOXDASSA-N	0	3	330.472	3.265	20	30		EGEDHN
Fc1ccc(N=Cc2ccccc2O[C@H]2CC[C@@H]3NCCO[C@H]32)cc1	ZINC001218149328	1373569962	/nfs/dbraw/zinc/56/99/62/1373569962.db2.gz	INOWZJSNZPNJIV-YSIASYRMSA-N	0	3	340.398	3.475	20	30		EGEDHN
Fc1cc(O[C@H]2CNCCC2(F)F)cc(F)c1OC(F)(F)F	ZINC001218446120	1373614142	/nfs/dbraw/zinc/61/41/42/1373614142.db2.gz	CAWVUJPSUXTLAV-VIFPVBQESA-N	0	3	333.203	3.239	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCO[C@@H]2CN(CCC3CCCCC3)C[C@@H]21	ZINC001218524030	1373629884	/nfs/dbraw/zinc/62/98/84/1373629884.db2.gz	TVZLRLXMEZSXES-YSIASYRMSA-N	0	3	348.531	3.471	20	30		EGEDHN
CC(C)=C[C@@H]1[C@H](C(=O)NCCNCc2ccc(C#N)cc2)C1(C)C	ZINC001131088199	1373640945	/nfs/dbraw/zinc/64/09/45/1373640945.db2.gz	MCIVHBSUTDHFAK-QZTJIDSGSA-N	0	3	325.456	3.002	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2OCCN(C(=O)c3ccc(F)cc3C)[C@H]2C1	ZINC001218996276	1373676186	/nfs/dbraw/zinc/67/61/86/1373676186.db2.gz	WXVYDDZOGUXQCS-ZYSHUDEJSA-N	0	3	346.446	3.014	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@H](C)C(CC)CC)[C@@H](O)C1	ZINC001219917779	1373739288	/nfs/dbraw/zinc/73/92/88/1373739288.db2.gz	SAIFUOHFQUONJA-NXHRZFHOSA-N	0	3	326.525	3.190	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)NC[C@H](C)Oc1ccc(OC)cc1	ZINC001219945508	1373740904	/nfs/dbraw/zinc/74/09/04/1373740904.db2.gz	LPKMEGWDOCFRFN-YJBOKZPZSA-N	0	3	334.460	3.043	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H](C)O[C@@]2(CCN(CC(=C)C)C2)C1	ZINC001131660998	1373749065	/nfs/dbraw/zinc/74/90/65/1373749065.db2.gz	INRMJURWIROQBH-YLJYHZDGSA-N	0	3	332.488	3.023	20	30		EGEDHN
CCCCCCCC[C@H](C)C(=O)N1C[C@H]2CCN(CCCO)C[C@H]21	ZINC001222037144	1373813486	/nfs/dbraw/zinc/81/34/86/1373813486.db2.gz	SSUSDNAPUFIXQS-IPMKNSEASA-N	0	3	338.536	3.288	20	30		EGEDHN
C=CCOCCCC(=O)N[C@@H]1CC[C@H](C)N(Cc2cccc(C)c2)C1	ZINC001131938343	1375057666	/nfs/dbraw/zinc/05/76/66/1375057666.db2.gz	FVLZOYKBNPRFDB-AZUAARDMSA-N	0	3	344.499	3.447	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CC[C@@H](C)N(CCc2scnc2C)C1	ZINC001131971139	1375075985	/nfs/dbraw/zinc/07/59/85/1375075985.db2.gz	CKCSWTAVKAQNFT-NVXWUHKLSA-N	0	3	347.528	3.157	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1CC[C@H](C)N(CCOCCC(C)C)C1	ZINC001131975966	1375078248	/nfs/dbraw/zinc/07/82/48/1375078248.db2.gz	GVFONWJVRGBATJ-OALUTQOASA-N	0	3	336.520	3.212	20	30		EGEDHN
CC[C@@H](C)C(=O)N[C@@H]1CCCC[C@H]1NCc1ccc(C#N)cc1F	ZINC001224861442	1375080877	/nfs/dbraw/zinc/08/08/77/1375080877.db2.gz	SXBOAPJUEDFCKP-FSPWUOQZSA-N	0	3	331.435	3.260	20	30		EGEDHN
Cc1ccc(CN2C[C@@H](NC(=O)C#CC(C)C)CC[C@H]2C)c(C)c1	ZINC001132021723	1375102751	/nfs/dbraw/zinc/10/27/51/1375102751.db2.gz	OWFJDCPXUSADHI-QUCCMNQESA-N	0	3	326.484	3.432	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@H]1CC[C@H](C)N(CCOC(C)C)C1	ZINC001132076931	1375134725	/nfs/dbraw/zinc/13/47/25/1375134725.db2.gz	DWBJXEUGHFBPOH-ZFWWWQNUSA-N	0	3	330.900	3.159	20	30		EGEDHN
C=CCCOCC(=O)NCC1CCN([C@H](C)c2ccc(F)cc2)CC1	ZINC001225626269	1375134848	/nfs/dbraw/zinc/13/48/48/1375134848.db2.gz	WQZAVMHKXYXXMB-MRXNPFEDSA-N	0	3	348.462	3.308	20	30		EGEDHN
C[C@@H](C(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1)n1cccc1	ZINC001225698480	1375147270	/nfs/dbraw/zinc/14/72/70/1375147270.db2.gz	MEPSSYWSQUXDLL-CEWLAPEOSA-N	0	3	349.478	3.118	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CCCC[C@H]1NCc1ccncc1Cl	ZINC001225752354	1375152264	/nfs/dbraw/zinc/15/22/64/1375152264.db2.gz	GABSEDBURHSCGX-QZTJIDSGSA-N	0	3	347.890	3.446	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CCCC[C@H]1NCc1ccc(F)cc1F	ZINC001225920410	1375175664	/nfs/dbraw/zinc/17/56/64/1375175664.db2.gz	ARBOGWXQIVIVQK-QZTJIDSGSA-N	0	3	334.410	3.285	20	30		EGEDHN
C=CCCCN1C[C@H](NC(=O)c2nc3cnccc3s2)CC[C@H]1C	ZINC001132164887	1375180702	/nfs/dbraw/zinc/18/07/02/1375180702.db2.gz	LGTRYUSUQFWCQH-ZIAGYGMSSA-N	0	3	344.484	3.240	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2ccccc2CCC)CC[C@H]1C	ZINC001132165466	1375181756	/nfs/dbraw/zinc/18/17/56/1375181756.db2.gz	VMDSGGQGBYDIIY-MJGOQNOKSA-N	0	3	344.499	3.424	20	30		EGEDHN
O=C(C#CC1CC1)N[C@@H]1CCCC[C@H]1NCc1cc(F)ccc1Cl	ZINC001226111526	1375204142	/nfs/dbraw/zinc/20/41/42/1375204142.db2.gz	KNGZAKQJNGQAET-QZTJIDSGSA-N	0	3	348.849	3.410	20	30		EGEDHN
O=C(C#CC1CC1)N[C@@H]1CCCC[C@H]1NCc1ccccc1Cl	ZINC001226111184	1375204564	/nfs/dbraw/zinc/20/45/64/1375204564.db2.gz	BYFVMVPNLBULEQ-QZTJIDSGSA-N	0	3	330.859	3.270	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)C2(C3CCC3)CCC2)CC[C@@H]1C	ZINC001132201129	1375206172	/nfs/dbraw/zinc/20/61/72/1375206172.db2.gz	XEMZFHNIBVPOMP-FUHWJXTLSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)C(C2CCC2)C2CCC2)CC[C@@H]1C	ZINC001132249550	1375246298	/nfs/dbraw/zinc/24/62/98/1375246298.db2.gz	QGMOAQIJDWEBKY-QFBILLFUSA-N	0	3	348.531	3.375	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCOc2ccc(F)cc2)CC[C@H]1C	ZINC001132252085	1375247374	/nfs/dbraw/zinc/24/73/74/1375247374.db2.gz	AMSNAJINNACKKT-NVXWUHKLSA-N	0	3	334.435	3.140	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCCOCc2ccccc2)CC[C@H]1C	ZINC001132261133	1375253253	/nfs/dbraw/zinc/25/32/53/1375253253.db2.gz	KRVJGLKUNBOUKV-IEBWSBKVSA-N	0	3	330.472	3.139	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2conc2COC)CC[C@H]1C	ZINC001132420270	1375368761	/nfs/dbraw/zinc/36/87/61/1375368761.db2.gz	PUACLACVOZIZFZ-CVEARBPZSA-N	0	3	349.475	3.150	20	30		EGEDHN
C=C[C@@](C)(O)CC(=O)NC1CCN(Cc2ccc(C(C)C)cc2)CC1	ZINC001227124186	1375394140	/nfs/dbraw/zinc/39/41/40/1375394140.db2.gz	OOEVURANIMSHKZ-OAQYLSRUSA-N	0	3	344.499	3.218	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2CC[C@@H](C)N(CC=C(C)C)C2)CCOCC1	ZINC001132454042	1375397190	/nfs/dbraw/zinc/39/71/90/1375397190.db2.gz	VGLVFCCIAGZGCS-MSOLQXFVSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCOc2ccc(OC)cc2)CC[C@H]1C	ZINC001132499010	1375426124	/nfs/dbraw/zinc/42/61/24/1375426124.db2.gz	AJKRCNWVCLSREN-SJORKVTESA-N	0	3	346.471	3.009	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NC1CCN(Cc2ccc(C)cc2)CC1)OCC	ZINC001227606867	1375451887	/nfs/dbraw/zinc/45/18/87/1375451887.db2.gz	BSCZFYUVSDLMBU-HXUWFJFHSA-N	0	3	344.499	3.447	20	30		EGEDHN
CC#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)C(C)(C)F)CC1	ZINC001132551603	1375458159	/nfs/dbraw/zinc/45/81/59/1375458159.db2.gz	KKHTZQWSCDZTGA-SFHVURJKSA-N	0	3	345.462	3.036	20	30		EGEDHN
CC#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)[C@H](C)CC)CC1	ZINC001132552813	1375460074	/nfs/dbraw/zinc/46/00/74/1375460074.db2.gz	ZTAJALGQRNIGEJ-QUCCMNQESA-N	0	3	341.499	3.334	20	30		EGEDHN
C#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)CCC(=C)C)CC1	ZINC001132554705	1375461047	/nfs/dbraw/zinc/46/10/47/1375461047.db2.gz	KOEWEOREAHRGBG-FQEVSTJZSA-N	0	3	339.483	3.254	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCNCc1ccccc1C(F)(F)F	ZINC001132574299	1375471756	/nfs/dbraw/zinc/47/17/56/1375471756.db2.gz	ZALHGHPIEONDHC-STQMWFEESA-N	0	3	328.378	3.369	20	30		EGEDHN
CC#CCCCC(=O)NCCNCc1ccc(Cl)c(Cl)c1	ZINC001132593156	1375479907	/nfs/dbraw/zinc/47/99/07/1375479907.db2.gz	TZXVMLANZDUWHX-UHFFFAOYSA-N	0	3	327.255	3.393	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](C)[C@@H](CNCc2ccn(C(C)C)n2)C1	ZINC001132700252	1375521072	/nfs/dbraw/zinc/52/10/72/1375521072.db2.gz	FGPZRSJKLHLORG-IRXDYDNUSA-N	0	3	332.492	3.004	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](C)[C@@H](CNCc2c(F)cccc2F)C1	ZINC001132786739	1375564780	/nfs/dbraw/zinc/56/47/80/1375564780.db2.gz	ZURTYMVJZKIVQO-HOTGVXAUSA-N	0	3	348.437	3.343	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](C)[C@H](CNCc2nccs2)C1	ZINC001132846901	1375599160	/nfs/dbraw/zinc/59/91/60/1375599160.db2.gz	OFNYKORTPHJOIL-HUUCEWRRSA-N	0	3	335.517	3.320	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CCN(Cc2ccc(COC)cc2)CC1	ZINC001228621605	1375618693	/nfs/dbraw/zinc/61/86/93/1375618693.db2.gz	AFUJNGPFUQABKJ-UHFFFAOYSA-N	0	3	330.472	3.126	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NC1CCN(Cc2ccc(OC)cc2)CC1	ZINC001228750231	1375663950	/nfs/dbraw/zinc/66/39/50/1375663950.db2.gz	YAEPAFCAXKOBHD-HOTGVXAUSA-N	0	3	330.472	3.234	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC1CCN(Cc2sc(C)nc2C)CC1	ZINC001228809568	1375683513	/nfs/dbraw/zinc/68/35/13/1375683513.db2.gz	JYIVNQRGAOQGFV-OAHLLOKOSA-N	0	3	335.517	3.443	20	30		EGEDHN
C=CCCCC(=O)NC1CCN(CCOc2cccc(OC)c2)CC1	ZINC001228927850	1375717423	/nfs/dbraw/zinc/71/74/23/1375717423.db2.gz	MXVNRZWHWZZZDB-UHFFFAOYSA-N	0	3	346.471	3.011	20	30		EGEDHN
C=CCCCC(=O)NC1CCN(C[C@@H](O)c2ccc(CC)cc2)CC1	ZINC001228927401	1375717595	/nfs/dbraw/zinc/71/75/95/1375717595.db2.gz	AMXPIYYSRJBXFL-HXUWFJFHSA-N	0	3	344.499	3.219	20	30		EGEDHN
C=C1CCC(C(=O)NC2CCN(CCOCCC(C)C)CC2)CC1	ZINC001228999714	1375732304	/nfs/dbraw/zinc/73/23/04/1375732304.db2.gz	UUWAKGQHDOXHKJ-UHFFFAOYSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](C)[C@@H](CNCc2csc(C)n2)C1	ZINC001133072146	1375758398	/nfs/dbraw/zinc/75/83/98/1375758398.db2.gz	GIMAXOJWVRHKSX-ZBFHGGJFSA-N	0	3	335.517	3.382	20	30		EGEDHN
C[C@@H](c1ccccn1)N1CC[C@@H](Oc2ncnc3ccc(C#N)cc32)C1	ZINC001229107682	1375765848	/nfs/dbraw/zinc/76/58/48/1375765848.db2.gz	MWSMOFZWMRPVQY-GOEBONIOSA-N	0	3	345.406	3.111	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@@H]1Oc1cc(C#N)ccc1[N+](=O)[O-]	ZINC001229186866	1375783396	/nfs/dbraw/zinc/78/33/96/1375783396.db2.gz	QPQUZNZEMQVPKH-LIRRHRJNSA-N	0	3	337.379	3.366	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H](C)Oc1ccccc1	ZINC001230047643	1375936018	/nfs/dbraw/zinc/93/60/18/1375936018.db2.gz	OPAMSETVIZSTRF-DJIMGWMZSA-N	0	3	336.863	3.223	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2csc3c2CCCC3)CC1	ZINC001230194108	1375964655	/nfs/dbraw/zinc/96/46/55/1375964655.db2.gz	MPZSCNBLIPLHKJ-UHFFFAOYSA-N	0	3	348.512	3.024	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)C=C1CCC1	ZINC001133390743	1375974823	/nfs/dbraw/zinc/97/48/23/1375974823.db2.gz	GUTJAEAWVAKMAQ-UHFFFAOYSA-N	0	3	330.859	3.392	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H](C)[C@H](C)C=C	ZINC001133403815	1375987899	/nfs/dbraw/zinc/98/78/99/1375987899.db2.gz	KTHKRWDTUGXSEW-CVEARBPZSA-N	0	3	332.875	3.350	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H](C)C(C)(F)F	ZINC001133405679	1375991102	/nfs/dbraw/zinc/99/11/02/1375991102.db2.gz	LBDGXNPTXWFVNN-CYBMUJFWSA-N	0	3	342.817	3.183	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H]1CC[C@H](C)C1	ZINC001133408121	1375992308	/nfs/dbraw/zinc/99/23/08/1375992308.db2.gz	XNHGSPMCYNMIQW-DOTOQJQBSA-N	0	3	332.875	3.328	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)Cc1cccs1	ZINC001133520906	1376055463	/nfs/dbraw/zinc/05/54/63/1376055463.db2.gz	NUQKGIPRKSWBEY-RYUDHWBXSA-N	0	3	345.306	3.072	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1C1CCN(C(=O)CC[C@@H](C)OC)CC1	ZINC001230552051	1376074192	/nfs/dbraw/zinc/07/41/92/1376074192.db2.gz	HKBNWZLXVVAZCP-NVXWUHKLSA-N	0	3	342.911	3.257	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)c1cccc(F)c1	ZINC001133563581	1376091335	/nfs/dbraw/zinc/09/13/35/1376091335.db2.gz	JWEWPYFXCSUKKB-VXGBXAGGSA-N	0	3	343.240	3.221	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCNCc2csc(Br)c2)C1	ZINC001133571419	1376097607	/nfs/dbraw/zinc/09/76/07/1376097607.db2.gz	QDLSWRAHZLJWOG-UHFFFAOYSA-N	0	3	343.290	3.073	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)c1cccc(C)c1	ZINC001133567828	1376093834	/nfs/dbraw/zinc/09/38/34/1376093834.db2.gz	CDERXIGVXYVJSK-KGLIPLIRSA-N	0	3	339.277	3.390	20	30		EGEDHN
Cc1occc1C(=O)N[C@@H](C)C[C@H](C)NCc1cc(F)ccc1C#N	ZINC001133627656	1376125584	/nfs/dbraw/zinc/12/55/84/1376125584.db2.gz	IFZWBUZQLJHULD-STQMWFEESA-N	0	3	343.402	3.286	20	30		EGEDHN
CN(CCCN(C)C(=O)c1cccs1)Cc1ccc(F)c(C#N)c1	ZINC001327176163	1388424071	/nfs/dbraw/zinc/42/40/71/1388424071.db2.gz	HISAFOBZBKJIKA-UHFFFAOYSA-N	0	3	345.443	3.353	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)c1ccc(Cl)o1	ZINC001133682710	1376151667	/nfs/dbraw/zinc/15/16/67/1376151667.db2.gz	CABNBYBOOXGVCS-NXEZZACHSA-N	0	3	349.656	3.328	20	30		EGEDHN
C#CCCN(CCCNC(=O)[C@@H]1CCC[C@@H](C)C1)Cc1cccnc1	ZINC001230829957	1376162054	/nfs/dbraw/zinc/16/20/54/1376162054.db2.gz	SJHNHENJMFFVSD-UYAOXDASSA-N	0	3	341.499	3.240	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCCN(Cc1cccnc1)C[C@H](C)OC	ZINC001230838770	1376163318	/nfs/dbraw/zinc/16/33/18/1376163318.db2.gz	UPQJSWGOZYJJHU-PXNSSMCTSA-N	0	3	347.503	3.027	20	30		EGEDHN
CC1(c2ccccc2C(=O)NCCNCc2cccc(C#N)c2)CC1	ZINC001133716222	1376172411	/nfs/dbraw/zinc/17/24/11/1376172411.db2.gz	NOMWWWHGAKVLJH-UHFFFAOYSA-N	0	3	333.435	3.129	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)/C=C(/C)C1CC1	ZINC001133868254	1376242811	/nfs/dbraw/zinc/24/28/11/1376242811.db2.gz	WYOLAHLBQJTQKZ-ZBKFBRRISA-N	0	3	329.282	3.124	20	30		EGEDHN
C#Cc1cccc(CN2CC[C@H]3[C@@H]2CCN3C(=O)OC(C)(C)C)c1	ZINC001231656218	1376295411	/nfs/dbraw/zinc/29/54/11/1376295411.db2.gz	GSYPXCUTAHKBAZ-ROUUACIJSA-N	0	3	326.440	3.252	20	30		EGEDHN
Cc1nscc1C(=O)N[C@@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001134127541	1376383188	/nfs/dbraw/zinc/38/31/88/1376383188.db2.gz	PJRFUQGBSIEIDN-STQMWFEESA-N	0	3	342.468	3.010	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2ccc(F)c3ccccc23)c1	ZINC001134164727	1376395228	/nfs/dbraw/zinc/39/52/28/1376395228.db2.gz	DKFRAXVZHKNCDB-UHFFFAOYSA-N	0	3	347.393	3.370	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cc(F)ccc2Cl)cc1F	ZINC001134272752	1376447951	/nfs/dbraw/zinc/44/79/51/1376447951.db2.gz	IVBALSWFCGJODK-UHFFFAOYSA-N	0	3	349.768	3.009	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)C2[C@@H]3CCCCCC[C@@H]23)cc1F	ZINC001134315470	1376471769	/nfs/dbraw/zinc/47/17/69/1376471769.db2.gz	ZOYKOQRLFXRHDN-IAGOWNOFSA-N	0	3	343.446	3.120	20	30		EGEDHN
C=CCN1C(=O)CC[C@@]12CCCN(Cc1cccc(CF)n1)CC2	ZINC001232534547	1376478036	/nfs/dbraw/zinc/47/80/36/1376478036.db2.gz	RMXQEDHUWITSGB-LJQANCHMSA-N	0	3	331.435	3.084	20	30		EGEDHN
Cc1nc(CN[C@@H](C)C[C@H](C)NC(=O)C#CC(C)(C)C)sc1C	ZINC001134329772	1376479966	/nfs/dbraw/zinc/47/99/66/1376479966.db2.gz	SBPNGWSQCFKQSQ-STQMWFEESA-N	0	3	335.517	3.182	20	30		EGEDHN
CC(C)[C@@H](C(=O)NCCNCc1cccc(C#N)c1)c1ccccc1	ZINC001134412592	1376517099	/nfs/dbraw/zinc/51/70/99/1376517099.db2.gz	DCTAFYIRBDYKQO-HXUWFJFHSA-N	0	3	335.451	3.204	20	30		EGEDHN
CCCCCCC[NH2+][C@H](C)C[C@H](C)NC(=O)c1cccc2n[n-]nc21	ZINC001134419752	1376525476	/nfs/dbraw/zinc/52/54/76/1376525476.db2.gz	ZTDZOOBJRFIVFS-CABCVRRESA-N	0	3	345.491	3.415	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2ccccc2C#N)CCC1	ZINC001134593466	1376615502	/nfs/dbraw/zinc/61/55/02/1376615502.db2.gz	NHEJKKBINJSJDF-IAGOWNOFSA-N	0	3	337.467	3.125	20	30		EGEDHN
C=CCOCCCC(=O)N(C)C[C@H]1CCN1Cc1ccccc1C	ZINC001233491362	1376654052	/nfs/dbraw/zinc/65/40/52/1376654052.db2.gz	XAOHILPJOPNRMH-LJQANCHMSA-N	0	3	330.472	3.011	20	30		EGEDHN
C[C@H](CC1CCCC1)C(=O)NCCNCc1ccc(C#N)c(F)c1	ZINC001134683172	1376656166	/nfs/dbraw/zinc/65/61/66/1376656166.db2.gz	JNTHLNMXYNVRJQ-CQSZACIVSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)c1[nH]c(C)cc1C	ZINC001134757028	1376702375	/nfs/dbraw/zinc/70/23/75/1376702375.db2.gz	TVMOGAGSDCKVJQ-YPMHNXCESA-N	0	3	342.281	3.027	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)C1(F)CCCC1)NCc1cc(F)ccc1C#N	ZINC001134792157	1376725797	/nfs/dbraw/zinc/72/57/97/1376725797.db2.gz	ZBDMCRUHGITMKB-ZIAGYGMSSA-N	0	3	349.425	3.353	20	30		EGEDHN
CC[C@@H](Cc1cccc(C)c1)C(=O)NCCNCc1ccc(C#N)cc1	ZINC001134846981	1376752259	/nfs/dbraw/zinc/75/22/59/1376752259.db2.gz	LONFVRWYIRSWFB-NRFANRHFSA-N	0	3	349.478	3.341	20	30		EGEDHN
CCCCCCCN1CC[C@@H]1CN(C)C(=O)c1c(Cl)cnn1C	ZINC001234322980	1376810090	/nfs/dbraw/zinc/81/00/90/1376810090.db2.gz	MBBYBYNEPDVAJJ-CQSZACIVSA-N	0	3	340.899	3.190	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)CCC(F)F)NCc1cc(F)ccc1C#N	ZINC001135011501	1376844285	/nfs/dbraw/zinc/84/42/85/1376844285.db2.gz	FLUXDFUEZOEESI-RYUDHWBXSA-N	0	3	341.377	3.116	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1cc(F)ccc1C#N)NC(=O)CCC(F)F	ZINC001135011500	1376844572	/nfs/dbraw/zinc/84/45/72/1376844572.db2.gz	FLUXDFUEZOEESI-NWDGAFQWSA-N	0	3	341.377	3.116	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H](C)C[C@H](C)NC/C(Cl)=C/Cl)cc1	ZINC001135184902	1376958227	/nfs/dbraw/zinc/95/82/27/1376958227.db2.gz	QRIYGONXCFIKDW-NLIXSGRYSA-N	0	3	339.266	3.473	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H](C)C[C@H](C)NCc1nc(C)sc1C	ZINC001135238919	1376996049	/nfs/dbraw/zinc/99/60/49/1376996049.db2.gz	SDPQCAWIWOTMCK-KBPBESRZSA-N	0	3	335.517	3.326	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)c1occc1Cl)NCc1ccccc1C#N	ZINC001135399352	1377073933	/nfs/dbraw/zinc/07/39/33/1377073933.db2.gz	QXTZGLWXTKSDMV-STQMWFEESA-N	0	3	345.830	3.491	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)C1(C)CC=CC1	ZINC001135410774	1377080664	/nfs/dbraw/zinc/08/06/64/1377080664.db2.gz	GDBQPYINBKRLQT-STQMWFEESA-N	0	3	329.282	3.124	20	30		EGEDHN
CC(C)CC1(C(=O)NCCNCc2cccc(C#N)c2)CCCC1	ZINC001135413947	1377081442	/nfs/dbraw/zinc/08/14/42/1377081442.db2.gz	BVRPQLUZQMBPGP-UHFFFAOYSA-N	0	3	327.472	3.371	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H](C)C[C@@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001135418951	1377084616	/nfs/dbraw/zinc/08/46/16/1377084616.db2.gz	ISVDNVKDJTZAMF-HUUCEWRRSA-N	0	3	343.446	3.427	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H](C)C[C@@H](C)NCc2nccn2C(F)F)C1	ZINC001135420710	1377086579	/nfs/dbraw/zinc/08/65/79/1377086579.db2.gz	YPDAFJLKHKVTQF-OLZOCXBDSA-N	0	3	340.418	3.007	20	30		EGEDHN
CC(C)[C@H]1CC[C@H](C(=O)NCCNCc2ccc(F)c(C#N)c2)CC1	ZINC001135733571	1377196686	/nfs/dbraw/zinc/19/66/86/1377196686.db2.gz	AGCYZXPNGUUMPT-QAQDUYKDSA-N	0	3	345.462	3.366	20	30		EGEDHN
CC[C@@H]1CCCC[C@@H]1C(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001136080311	1377333594	/nfs/dbraw/zinc/33/35/94/1377333594.db2.gz	DVXUHKQMMMNQJH-WBVHZDCISA-N	0	3	331.435	3.120	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1c(F)ccc(F)c1Cl	ZINC001267146240	1377417827	/nfs/dbraw/zinc/41/78/27/1377417827.db2.gz	NGSHUSRPKNRSRR-VIFPVBQESA-N	0	3	337.197	3.469	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(OCC#N)cc2)CCC[C@@]1(O)C(F)(F)F	ZINC001137115315	1377481279	/nfs/dbraw/zinc/48/12/79/1377481279.db2.gz	IJCTXDXZQYNCDL-CJNGLKHVSA-N	0	3	342.361	3.114	20	30		EGEDHN
CC(C)OCCN(CCOC(C)C)Cc1ccc(OCC#N)cc1	ZINC001137119267	1377481618	/nfs/dbraw/zinc/48/16/18/1377481618.db2.gz	BYSBZDRVZJNTBN-UHFFFAOYSA-N	0	3	334.460	3.241	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cccc2oc(C)nc21)C(C)C	ZINC001268227661	1377498658	/nfs/dbraw/zinc/49/86/58/1377498658.db2.gz	NLQMPSIJSPZIEO-AWEZNQCLSA-N	0	3	335.835	3.233	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CCN(Cc3[nH]c(C)cc3C)C2)C1	ZINC001137323089	1377518944	/nfs/dbraw/zinc/51/89/44/1377518944.db2.gz	XKGJURCGFOBKFJ-LJQANCHMSA-N	0	3	331.460	3.242	20	30		EGEDHN
CCC#CC(=O)N1CCC2(CCCN(Cc3scnc3C)C2)CC1	ZINC001268951336	1377532126	/nfs/dbraw/zinc/53/21/26/1377532126.db2.gz	MLBRLHCRZVYFFE-UHFFFAOYSA-N	0	3	345.512	3.070	20	30		EGEDHN
CCC#CC(=O)N1CCC[C@@]2(CN(C[C@@H](CC)CCCC)CCO2)C1	ZINC001268951563	1377532590	/nfs/dbraw/zinc/53/25/90/1377532590.db2.gz	VPTXBBOTXYRNCM-PZJWPPBQSA-N	0	3	348.531	3.310	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@]2(CCN(Cc3ccc[nH]3)C2)C1	ZINC001268985576	1377535407	/nfs/dbraw/zinc/53/54/07/1377535407.db2.gz	SUMCVSYYJDCIEZ-HXUWFJFHSA-N	0	3	329.488	3.432	20	30		EGEDHN
C=CCO[C@@H]1CO[C@@]2(C1)CCCN(Cc1cc(C)ccc1OC)C2	ZINC001138486783	1377731346	/nfs/dbraw/zinc/73/13/46/1377731346.db2.gz	XRCOYMDTHRZRSU-AZUAARDMSA-N	0	3	331.456	3.330	20	30		EGEDHN
C#CCOc1ccc(CN2CCC[C@@]3(CCCCN3C(C)=O)C2)cc1	ZINC001138558211	1377741891	/nfs/dbraw/zinc/74/18/91/1377741891.db2.gz	MYGQNIHLJJWVNY-NRFANRHFSA-N	0	3	340.467	3.066	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@@](O)(C(F)(F)F)CC2)c1[O-]	ZINC001138624340	1377756079	/nfs/dbraw/zinc/75/60/79/1377756079.db2.gz	DWZKSQNRYQUDCP-INIZCTEOSA-N	0	3	329.362	3.400	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@@](O)(C(F)(F)F)CC2)c1[O-]	ZINC001138624340	1377756081	/nfs/dbraw/zinc/75/60/81/1377756081.db2.gz	DWZKSQNRYQUDCP-INIZCTEOSA-N	0	3	329.362	3.400	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@@]3(C[C@H](OCC)CO3)C2)c1[O-]	ZINC001138627423	1377756671	/nfs/dbraw/zinc/75/66/71/1377756671.db2.gz	HAEPDOUUOWDHCV-AZUAARDMSA-N	0	3	331.456	3.281	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@@]3(C[C@H](OCC)CO3)C2)c1[O-]	ZINC001138627423	1377756673	/nfs/dbraw/zinc/75/66/73/1377756673.db2.gz	HAEPDOUUOWDHCV-AZUAARDMSA-N	0	3	331.456	3.281	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@@]3(C[C@@H](OCC4CC4)CO3)C2)c1[O-]	ZINC001138628663	1377756974	/nfs/dbraw/zinc/75/69/74/1377756974.db2.gz	BFLWMUVBJYWUGI-TZIWHRDSSA-N	0	3	343.467	3.281	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@@]3(C[C@@H](OCC4CC4)CO3)C2)c1[O-]	ZINC001138628663	1377756976	/nfs/dbraw/zinc/75/69/76/1377756976.db2.gz	BFLWMUVBJYWUGI-TZIWHRDSSA-N	0	3	343.467	3.281	20	30		EGEDHN
O=C1C=C2CN(Cc3cccn3-c3ccccc3F)CCC2S1	ZINC001138631973	1377758175	/nfs/dbraw/zinc/75/81/75/1377758175.db2.gz	JFWNZPMGONKRBU-KRWDZBQOSA-N	0	3	328.412	3.391	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@H](Oc3ncc(C)cn3)C2)c1[O-]	ZINC001138630848	1377758259	/nfs/dbraw/zinc/75/82/59/1377758259.db2.gz	FDDQMRIRUXJVSK-SFHVURJKSA-N	0	3	339.439	3.263	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@H](Oc3ncc(C)cn3)C2)c1[O-]	ZINC001138630848	1377758263	/nfs/dbraw/zinc/75/82/63/1377758263.db2.gz	FDDQMRIRUXJVSK-SFHVURJKSA-N	0	3	339.439	3.263	20	30		EGEDHN
C=CCOc1ccccc1CN1CCC2(CCC(=O)N2CC)CC1	ZINC001139028033	1377819854	/nfs/dbraw/zinc/81/98/54/1377819854.db2.gz	JUEYZIQZQRGLDN-UHFFFAOYSA-N	0	3	328.456	3.228	20	30		EGEDHN
C=CCOc1ccccc1CN1CC[C@@]2(C1)CCCCN2C(C)=O	ZINC001139032919	1377820398	/nfs/dbraw/zinc/82/03/98/1377820398.db2.gz	WUXDNEGYJMFTGD-HXUWFJFHSA-N	0	3	328.456	3.228	20	30		EGEDHN
C[C@@H]1CCCN(Cc2ccc(Oc3ccc(C#N)cc3)nc2)[C@H]1CO	ZINC001139427229	1377882460	/nfs/dbraw/zinc/88/24/60/1377882460.db2.gz	ZFHCFKJVCRDDFL-BEFAXECRSA-N	0	3	337.423	3.338	20	30		EGEDHN
C=CCN1C(=O)CCC[C@]12CCCN(Cc1ccc(COC)s1)C2	ZINC001139826266	1377957865	/nfs/dbraw/zinc/95/78/65/1377957865.db2.gz	UMQBTNXTNBSSQI-LJQANCHMSA-N	0	3	348.512	3.428	20	30		EGEDHN
COC(=O)c1ccc(C2CN(Cc3c[nH]c4ccc(C#N)cc34)C2)cc1	ZINC001140117414	1378011782	/nfs/dbraw/zinc/01/17/82/1378011782.db2.gz	PTCPCFAZCJFIKJ-UHFFFAOYSA-N	0	3	345.402	3.426	20	30		EGEDHN
N#Cc1cccc(N2CCN(Cc3cccc4cnccc43)CC2)c1	ZINC001140145084	1378020867	/nfs/dbraw/zinc/02/08/67/1378020867.db2.gz	KULGKMJXJIZTPL-UHFFFAOYSA-N	0	3	328.419	3.429	20	30		EGEDHN
C#CCCCC(=O)N1CCC(CCNC/C(Cl)=C/Cl)CC1	ZINC001753569715	1440438262	/nfs/dbraw/zinc/43/82/62/1440438262.db2.gz	ZFJNQYUXDJNBHM-QINSGFPZSA-N	0	3	331.287	3.327	20	30		EGEDHN
Cc1ccc(F)cc1CN1CC[C@@H]2[C@H]1CCC(=O)N2CCCC#N	ZINC001272617439	1378076816	/nfs/dbraw/zinc/07/68/16/1378076816.db2.gz	XPBRBUSFJJSJOW-QZTJIDSGSA-N	0	3	329.419	3.003	20	30		EGEDHN
N#Cc1ccc(CN2CCCC3(CN(Cc4ccccc4)C3)C2)cn1	ZINC001140546604	1378083082	/nfs/dbraw/zinc/08/30/82/1378083082.db2.gz	NLUSAYZGFPFDOZ-UHFFFAOYSA-N	0	3	332.451	3.051	20	30		EGEDHN
C=CCN1C[C@]2(CC1=O)CCCCN2Cc1ccc2ccccc2n1	ZINC001273007164	1378085221	/nfs/dbraw/zinc/08/52/21/1378085221.db2.gz	YKEHYUYENHSRFW-OAQYLSRUSA-N	0	3	335.451	3.378	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(CCN(Cc3cc(OC)ccc3Cl)C2)C1=O	ZINC001273174744	1378091282	/nfs/dbraw/zinc/09/12/82/1378091282.db2.gz	YVTUCDZNTBTGGM-LJQANCHMSA-N	0	3	348.874	3.349	20	30		EGEDHN
C=C(C)CN1C[C@]2(CCN(Cc3ccc(CCC)cc3)C2)OCC1=O	ZINC001273363817	1378099922	/nfs/dbraw/zinc/09/99/22/1378099922.db2.gz	PRRRVSNKNJIRRV-OAQYLSRUSA-N	0	3	342.483	3.019	20	30		EGEDHN
C=C(C)CN1CC2(CCC1=O)CCN(Cc1ccc(COC)o1)CC2	ZINC001274170579	1378117596	/nfs/dbraw/zinc/11/75/96/1378117596.db2.gz	XJQHKGBPRPEZSF-UHFFFAOYSA-N	0	3	346.471	3.207	20	30		EGEDHN
CN1CC[C@]2(CCCN(Cc3ccc(C#N)c(Cl)c3)CC2)C1=O	ZINC001274492896	1378128441	/nfs/dbraw/zinc/12/84/41/1378128441.db2.gz	WJDCVCCRJUJIFA-SFHVURJKSA-N	0	3	331.847	3.046	20	30		EGEDHN
C[C@@H](CNC(=O)c1cccc2cc[nH]c21)N(C)Cc1ccc(C#N)cc1	ZINC001275936768	1378164370	/nfs/dbraw/zinc/16/43/70/1378164370.db2.gz	VWTIJAPAXSXQMA-HNNXBMFYSA-N	0	3	346.434	3.290	20	30		EGEDHN
Cc1ccccc1CN1C[C@@H]2CC[C@H](C1)[C@H]2C(=O)NC1(C#N)CCC1	ZINC001277470693	1378225522	/nfs/dbraw/zinc/22/55/22/1378225522.db2.gz	VBPJPLUAKDYVQR-REPLKXPHSA-N	0	3	337.467	3.016	20	30		EGEDHN
N#Cc1c(N)sc(CN2CCN(C3CCCCC3)CC2)c1Cl	ZINC001141108579	1378241244	/nfs/dbraw/zinc/24/12/44/1378241244.db2.gz	AEYFIPXTELGEPV-UHFFFAOYSA-N	0	3	338.908	3.306	20	30		EGEDHN
N#Cc1cc(Br)ccc1CN1CCC2SC(=O)C=C2C1	ZINC001141810296	1378381343	/nfs/dbraw/zinc/38/13/43/1378381343.db2.gz	RSAQGBLLRIDMBN-AWEZNQCLSA-N	0	3	349.253	3.095	20	30		EGEDHN
CCCCN1CCN(Cc2cc(Br)ccc2C#N)CC1	ZINC001141901147	1378391765	/nfs/dbraw/zinc/39/17/65/1378391765.db2.gz	PQSNNFLTILCPQB-UHFFFAOYSA-N	0	3	336.277	3.238	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@H]1CCN(Cc1[nH]cnc1C(C)(C)C)C2	ZINC001142217740	1378421553	/nfs/dbraw/zinc/42/15/53/1378421553.db2.gz	RJQFSAHJFBONPR-FXAWDEMLSA-N	0	3	347.503	3.281	20	30		EGEDHN
N#Cc1ccc2c(CN3CCN(CCc4ccccc4)CC3)c[nH]c2c1	ZINC001142921683	1378509155	/nfs/dbraw/zinc/50/91/55/1378509155.db2.gz	SHXJQLJFWNAEJA-UHFFFAOYSA-N	0	3	344.462	3.400	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3cc(F)cc(F)c3C)C2)C1=O	ZINC001143760529	1378642787	/nfs/dbraw/zinc/64/27/87/1378642787.db2.gz	AAGGBIIQZPDWMU-LJQANCHMSA-N	0	3	334.410	3.274	20	30		EGEDHN
CCN(Cc1cncc(C#N)c1)C[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC001144084925	1378680689	/nfs/dbraw/zinc/68/06/89/1378680689.db2.gz	SKNHUDGTZYWSIT-HNNXBMFYSA-N	0	3	344.459	3.032	20	30		EGEDHN
C=CCN1C(=O)CCC[C@@]12CCCN(Cc1ccc3cc[nH]c3n1)C2	ZINC001144171561	1378691758	/nfs/dbraw/zinc/69/17/58/1378691758.db2.gz	CVHSCAJWFDBGDM-FQEVSTJZSA-N	0	3	338.455	3.096	20	30		EGEDHN
C#Cc1ccc(CN2C[C@H]3CCCN(C(=O)OC(C)(C)C)[C@H]3C2)cc1	ZINC001144568566	1378745761	/nfs/dbraw/zinc/74/57/61/1378745761.db2.gz	YJXANHGSYTYNKT-MOPGFXCFSA-N	0	3	340.467	3.499	20	30		EGEDHN
N#CC[C@H]1CCCN(Cc2c[nH]c3cc(Br)cnc23)C1	ZINC001144700873	1378761211	/nfs/dbraw/zinc/76/12/11/1378761211.db2.gz	QEEBVJWFCVQDDS-LLVKDONJSA-N	0	3	333.233	3.451	20	30		EGEDHN
CC(C)OCCCC(=O)N[C@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001146797073	1378921559	/nfs/dbraw/zinc/92/15/59/1378921559.db2.gz	ILELSALZLSGKLN-IAGOWNOFSA-N	0	3	345.487	3.136	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2cnc(C)cn2)CCCC1	ZINC001146819523	1378926937	/nfs/dbraw/zinc/92/69/37/1378926937.db2.gz	AUJUECGDMNEVSS-CVEARBPZSA-N	0	3	344.503	3.294	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2cc(C)n(C)n2)CCCC1	ZINC001146822651	1378928654	/nfs/dbraw/zinc/92/86/54/1378928654.db2.gz	UBFKZJVFECKRKA-HOTGVXAUSA-N	0	3	346.519	3.238	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)N1CC2(C1)CCN(CCc1ccccc1F)C2	ZINC001148095597	1379117056	/nfs/dbraw/zinc/11/70/56/1379117056.db2.gz	MMMHHRUOIKPECG-IRXDYDNUSA-N	0	3	344.474	3.361	20	30		EGEDHN
C=CCCCC(=O)N1CC2(C1)CCN(CCO[C@@H]1CCCC[C@H]1C)C2	ZINC001148180868	1379128478	/nfs/dbraw/zinc/12/84/78/1379128478.db2.gz	FQBIJPNVTPJPIS-RTBURBONSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC2(C1)CCN(Cc1ncccc1C)C2	ZINC001148358175	1379156518	/nfs/dbraw/zinc/15/65/18/1379156518.db2.gz	WTKSSOIDZXEIAN-UHFFFAOYSA-N	0	3	327.472	3.027	20	30		EGEDHN
CC[C@@H](C)CCC(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001148485884	1379185331	/nfs/dbraw/zinc/18/53/31/1379185331.db2.gz	UUHCRYSXXJSMGL-QGZVFWFLSA-N	0	3	339.483	3.419	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccccc2C(F)(F)F)cc1	ZINC001148763879	1379264097	/nfs/dbraw/zinc/26/40/97/1379264097.db2.gz	IJCIOHYOSJQIJB-UHFFFAOYSA-N	0	3	347.340	3.097	20	30		EGEDHN
C=CCCC(=O)NC[C@H]1CN(Cc2ccccc2C(C)C)CCCO1	ZINC001149362782	1379368868	/nfs/dbraw/zinc/36/88/68/1379368868.db2.gz	UCGHHMHIMIVTPQ-IBGZPJMESA-N	0	3	344.499	3.483	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@H]1CN(Cc2ccc(C)cc2)CCCO1	ZINC001149780048	1379443962	/nfs/dbraw/zinc/44/39/62/1379443962.db2.gz	CKLYAFGGNGCFAW-IBGZPJMESA-N	0	3	344.499	3.304	20	30		EGEDHN
C=CCCCC(=O)NC[C@H]1CN([C@H](C)c2ccccc2)CCCO1	ZINC001150211810	1379515885	/nfs/dbraw/zinc/51/58/85/1379515885.db2.gz	LEWBIXZSCWQSKB-MJGOQNOKSA-N	0	3	330.472	3.311	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@@H]1CN(Cc2ccccc2C)CCCO1	ZINC001150245975	1379521882	/nfs/dbraw/zinc/52/18/82/1379521882.db2.gz	BMCYOBMPMBMPRC-TZIWHRDSSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@H]2CN(CC3=CCCCC3)CCCO2)C1	ZINC001150299529	1379529751	/nfs/dbraw/zinc/52/97/51/1379529751.db2.gz	PGHGKFNXXFLGGD-GOSISDBHSA-N	0	3	332.488	3.050	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)CC[C@@H](C)c2ccccc2)C1	ZINC001150395966	1379547276	/nfs/dbraw/zinc/54/72/76/1379547276.db2.gz	XWCBWKWGFHQZCL-UYAOXDASSA-N	0	3	344.499	3.354	20	30		EGEDHN
C=CC1(CC(=O)NC[C@@H]2CN(CCCF)CCCO2)CCCCC1	ZINC001150436557	1379553423	/nfs/dbraw/zinc/55/34/23/1379553423.db2.gz	VBILYEITKRSGKN-QGZVFWFLSA-N	0	3	340.483	3.080	20	30		EGEDHN
C#CCC1(C(=O)NC[C@@H]2CN(CC=C(C)C)CCCO2)CCCCC1	ZINC001150795877	1379617045	/nfs/dbraw/zinc/61/70/45/1379617045.db2.gz	QSLVRVREFVDCHL-LJQANCHMSA-N	0	3	346.515	3.134	20	30		EGEDHN
CCc1ccc(CCC(=O)NCCNCc2ccc(C#N)s2)cc1	ZINC001150823116	1379619331	/nfs/dbraw/zinc/61/93/31/1379619331.db2.gz	PJRMYBUDSITIRP-UHFFFAOYSA-N	0	3	341.480	3.021	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2cc[nH]c2C(C)C)CC1	ZINC001151266847	1379690931	/nfs/dbraw/zinc/69/09/31/1379690931.db2.gz	ZUPHFEHLRIWHKI-UHFFFAOYSA-N	0	3	347.503	3.315	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)C[C@H](C)c2ccco2)CC1	ZINC001151392944	1379711029	/nfs/dbraw/zinc/71/10/29/1379711029.db2.gz	UIHPYSPRABPNGT-KRWDZBQOSA-N	0	3	348.487	3.337	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)Cc2ccc(C)c(C)c2)CC1	ZINC001151406332	1379712324	/nfs/dbraw/zinc/71/23/24/1379712324.db2.gz	CKZSEDLWWRSUPZ-UHFFFAOYSA-N	0	3	344.499	3.019	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)CCc1ccco1	ZINC001151841416	1379795159	/nfs/dbraw/zinc/79/51/59/1379795159.db2.gz	JBEWUWCWVCDQJP-MRXNPFEDSA-N	0	3	339.439	3.111	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)c1cc(C)oc1C	ZINC001151853123	1379800151	/nfs/dbraw/zinc/80/01/51/1379800151.db2.gz	YQXWINNCNAKTDP-CQSZACIVSA-N	0	3	339.439	3.409	20	30		EGEDHN
Cc1ccc(C)c(CCCC(=O)NCCNCc2ccc(C#N)cc2)c1	ZINC001151877787	1379807711	/nfs/dbraw/zinc/80/77/11/1379807711.db2.gz	YUTYACVUFBSDGY-UHFFFAOYSA-N	0	3	349.478	3.404	20	30		EGEDHN
Cc1nc(C(C)C)ccc1CNCCNC(=O)CC#Cc1ccccc1	ZINC001151952735	1379824374	/nfs/dbraw/zinc/82/43/74/1379824374.db2.gz	FBXPDZDISZQZTO-UHFFFAOYSA-N	0	3	349.478	3.161	20	30		EGEDHN
Cc1ccc2oc(C(=O)NCCNCc3ccc(C#N)s3)cc2c1	ZINC001152389428	1379924814	/nfs/dbraw/zinc/92/48/14/1379924814.db2.gz	OCFSXXXHEVLYGJ-UHFFFAOYSA-N	0	3	339.420	3.194	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)[C@H]1CC1(C)C	ZINC001152801721	1379982188	/nfs/dbraw/zinc/98/21/88/1379982188.db2.gz	BYOSNUGQBYAZIB-CZUORRHYSA-N	0	3	331.435	3.070	20	30		EGEDHN
Cc1ccc(C2(C(=O)NCCNCc3cccc(C#N)c3)CCC2)cc1	ZINC001152934404	1379996165	/nfs/dbraw/zinc/99/61/65/1379996165.db2.gz	GXUXJVLFSGRHED-UHFFFAOYSA-N	0	3	347.462	3.194	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)NC[C@@H](C)N(CC)Cc1cc(C)sc1C	ZINC001153091089	1380018771	/nfs/dbraw/zinc/01/87/71/1380018771.db2.gz	WGQYCMQKDKYJAT-ACJLOTCBSA-N	0	3	338.517	3.019	20	30		EGEDHN
CCN(Cc1ccccc1N(C)C)[C@H](C)CNC(=O)C#CC(C)(C)C	ZINC001153281790	1380047886	/nfs/dbraw/zinc/04/78/86/1380047886.db2.gz	ZJVBJBACNXJJAH-QGZVFWFLSA-N	0	3	343.515	3.129	20	30		EGEDHN
CCN(Cc1ccc(OC)c(F)c1)[C@H](C)CNC(=O)C#CC(C)(C)C	ZINC001153281692	1380047941	/nfs/dbraw/zinc/04/79/41/1380047941.db2.gz	YGKMQNXLMAFYAV-OAHLLOKOSA-N	0	3	348.462	3.210	20	30		EGEDHN
C#CC[C@H](CC(=O)NCCNCc1ccsc1)c1ccccc1	ZINC001153715207	1380117921	/nfs/dbraw/zinc/11/79/21/1380117921.db2.gz	ZCEFKMHAEHRKQT-GOSISDBHSA-N	0	3	326.465	3.151	20	30		EGEDHN
C#CCC1(C(=O)NC[C@@H](C)N(CC)Cc2cccc(OC)c2)CCC1	ZINC001153776110	1380127354	/nfs/dbraw/zinc/12/73/54/1380127354.db2.gz	BRZUEMZVQBTKEC-QGZVFWFLSA-N	0	3	342.483	3.215	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)C1(CCF)CC1	ZINC001154443840	1380278753	/nfs/dbraw/zinc/27/87/53/1380278753.db2.gz	HCBMOOUJMZFZKP-OAHLLOKOSA-N	0	3	331.435	3.025	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C1(c2ccc(F)cc2)CCC1	ZINC001154545076	1380302973	/nfs/dbraw/zinc/30/29/73/1380302973.db2.gz	BFACYYGVNFMESZ-MRXNPFEDSA-N	0	3	330.447	3.097	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H](C)N(CC)Cc1ccc(OC)c(C#N)c1	ZINC001154620256	1380319273	/nfs/dbraw/zinc/31/92/73/1380319273.db2.gz	FUBDKTIGLAVRFD-OAHLLOKOSA-N	0	3	343.471	3.106	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@@H](C)N(CC)C[C@@H](O)c1ccccc1	ZINC001154743282	1380344407	/nfs/dbraw/zinc/34/44/07/1380344407.db2.gz	YAPYOVQSHFWALL-ZHALLVOQSA-N	0	3	332.488	3.149	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)C1CC2(CC2)C1	ZINC001155167936	1380418242	/nfs/dbraw/zinc/41/82/42/1380418242.db2.gz	VOKRUIYXRIDPSB-CQSZACIVSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[Si](C)(C)CCOCN[C@@H]1CCCN(c2cc(CC#N)ccn2)C1	ZINC001156473166	1380580753	/nfs/dbraw/zinc/58/07/53/1380580753.db2.gz	ZEYDTPJFGFVFMK-QGZVFWFLSA-N	0	3	346.551	3.018	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C[C@H]1CCCc2ccccc21	ZINC001156530385	1380588629	/nfs/dbraw/zinc/58/86/29/1380588629.db2.gz	NVUSYLSBUKWOOY-IEBWSBKVSA-N	0	3	326.484	3.347	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1ccc(OCC(C)C)cc1	ZINC001156739608	1380620072	/nfs/dbraw/zinc/62/00/72/1380620072.db2.gz	AFKRKMVINLNHCA-QGZVFWFLSA-N	0	3	330.472	3.185	20	30		EGEDHN
C#CCCCC(=O)N1CCCC[C@@H]1CN(C)Cc1cccc(F)c1	ZINC001157885413	1381060537	/nfs/dbraw/zinc/06/05/37/1381060537.db2.gz	UIMKMQJGPLCWME-LJQANCHMSA-N	0	3	330.447	3.442	20	30		EGEDHN
C=C(Cl)CNCCCOC1CCN(C(=O)/C=C(\C)CC)CC1	ZINC001755345297	1440826397	/nfs/dbraw/zinc/82/63/97/1440826397.db2.gz	LPQPGUYIOAGSAC-WYMLVPIESA-N	0	3	328.884	3.083	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cn(C(C)(C)C)nc1C	ZINC001157950631	1381079245	/nfs/dbraw/zinc/07/92/45/1381079245.db2.gz	BTCAXARSAUQACT-MRXNPFEDSA-N	0	3	332.492	3.059	20	30		EGEDHN
CC(C)COCCN(C)C[C@H]1CCCCN1C(=O)C#CC(C)(C)C	ZINC001157965230	1381084800	/nfs/dbraw/zinc/08/48/00/1381084800.db2.gz	UXZLPLRQFNDIEG-GOSISDBHSA-N	0	3	336.520	3.021	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ocnc1-c1ccccc1	ZINC001158072254	1381121586	/nfs/dbraw/zinc/12/15/86/1381121586.db2.gz	XPBKKWIGFDXKSF-QGZVFWFLSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1CCCC12CC2	ZINC001158123848	1381134835	/nfs/dbraw/zinc/13/48/35/1381134835.db2.gz	FUIKPILYQGWECU-MSOLQXFVSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc(C)n([C@@H](C)C2CC2)n1	ZINC001158155074	1381143705	/nfs/dbraw/zinc/14/37/05/1381143705.db2.gz	GKWUXPOYOSZQNY-FUHWJXTLSA-N	0	3	344.503	3.275	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1c(C)oc(C)c1C	ZINC001158199850	1381157386	/nfs/dbraw/zinc/15/73/86/1381157386.db2.gz	KOEGFCJCJOORBC-GOSISDBHSA-N	0	3	348.487	3.334	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N2CCCC[C@@H]2CN(C)CC=C)cc1	ZINC001158927721	1381467780	/nfs/dbraw/zinc/46/77/80/1381467780.db2.gz	CONIVTFVCWDBPN-LJQANCHMSA-N	0	3	342.483	3.293	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)c1cncc(-c2ccccc2)c1	ZINC001159340697	1381770546	/nfs/dbraw/zinc/77/05/46/1381770546.db2.gz	BLAZGWDFTBUNQH-UHFFFAOYSA-N	0	3	329.831	3.211	20	30		EGEDHN
Cc1cc(F)ccc1CN1CC=C(CCNC(=O)C#CC(C)C)CC1	ZINC001160055051	1381983835	/nfs/dbraw/zinc/98/38/35/1381983835.db2.gz	SJPRBOBDVFHELV-UHFFFAOYSA-N	0	3	342.458	3.432	20	30		EGEDHN
C[C@H](c1cccc(F)c1)N1CC=C(CCNC(=O)C#CC2CC2)CC1	ZINC001160083930	1381993153	/nfs/dbraw/zinc/99/31/53/1381993153.db2.gz	AGRXGMHJMRUBFB-MRXNPFEDSA-N	0	3	340.442	3.439	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H]2C[C@H]2c2sccc2C)CC1	ZINC001160131180	1382008100	/nfs/dbraw/zinc/00/81/00/1382008100.db2.gz	GVVMJTIFETVPOM-IAGOWNOFSA-N	0	3	330.497	3.484	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCC1=CCN(CCOCC2CC2)CC1	ZINC001160242446	1382046906	/nfs/dbraw/zinc/04/69/06/1382046906.db2.gz	RJZDFEFNWVMOKP-UHFFFAOYSA-N	0	3	334.504	3.154	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)CCc2ccc(Cl)cc2)CC1	ZINC001160804356	1382201182	/nfs/dbraw/zinc/20/11/82/1382201182.db2.gz	IDWRGCQPVAMQQW-UHFFFAOYSA-N	0	3	344.886	3.434	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C[C@H]2CCOc3ccccc32)CC1	ZINC001160860208	1382218449	/nfs/dbraw/zinc/21/84/49/1382218449.db2.gz	FQUJLSYQMTWTCY-GOSISDBHSA-N	0	3	340.467	3.267	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCCC1=CCN(CCOCC2CC2)CC1	ZINC001160991542	1382264776	/nfs/dbraw/zinc/26/47/76/1382264776.db2.gz	PQLPUSWIOFUDSW-KRWDZBQOSA-N	0	3	334.504	3.154	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@H]2CC[C@H](C(F)(F)F)C2)CC1	ZINC001161021045	1382275530	/nfs/dbraw/zinc/27/55/30/1382275530.db2.gz	JZAANNYCHMOVAI-HOTGVXAUSA-N	0	3	342.405	3.127	20	30		EGEDHN
CCCCCCCCCCN(C)C(=O)CNC(=O)[C@@H](N)[C@@H](C)CC	ZINC001161226476	1382348819	/nfs/dbraw/zinc/34/88/19/1382348819.db2.gz	IVVFOYCPJYPDTB-WMZOPIPTSA-N	0	3	341.540	3.075	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cnc3ccccc3c2)CC1	ZINC001161335673	1382374075	/nfs/dbraw/zinc/37/40/75/1382374075.db2.gz	FCOLKDUANXCDCZ-UHFFFAOYSA-N	0	3	333.435	3.010	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)Cn2cc(C)c3ccccc32)CC1	ZINC001161451294	1382414779	/nfs/dbraw/zinc/41/47/79/1382414779.db2.gz	BGALJSXBSGAHCT-UHFFFAOYSA-N	0	3	337.467	3.274	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C(C)(C)c2ccccc2F)CC1	ZINC001161472105	1382417961	/nfs/dbraw/zinc/41/79/61/1382417961.db2.gz	LMTHETCUTCYBBQ-UHFFFAOYSA-N	0	3	342.458	3.265	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc3scnc3c2)CC1	ZINC001161623034	1382463248	/nfs/dbraw/zinc/46/32/48/1382463248.db2.gz	YMXZTGCRCDPDQL-UHFFFAOYSA-N	0	3	327.453	3.234	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2c(C)csc2Cl)CC1	ZINC001161779848	1382503771	/nfs/dbraw/zinc/50/37/71/1382503771.db2.gz	WJYBXSYBHQKLCY-UHFFFAOYSA-N	0	3	336.888	3.485	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@H]2CCCCC2(C)C)(COC)CC1	ZINC001162623305	1382814189	/nfs/dbraw/zinc/81/41/89/1382814189.db2.gz	QEJZVVASIPSPQM-GOSISDBHSA-N	0	3	348.531	3.071	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)c1ccc(F)cc1	ZINC001162666881	1382826872	/nfs/dbraw/zinc/82/68/72/1382826872.db2.gz	XDNVLBOIFKXWTP-UHFFFAOYSA-N	0	3	338.426	3.124	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1sc(C)cc1C	ZINC001162827175	1382888287	/nfs/dbraw/zinc/88/82/87/1382888287.db2.gz	VLMBIZUZPKUNSK-UHFFFAOYSA-N	0	3	340.492	3.273	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)CC1CC(F)(F)C1	ZINC001162850765	1382894468	/nfs/dbraw/zinc/89/44/68/1382894468.db2.gz	QUDQSIZMYJRMNE-UHFFFAOYSA-N	0	3	348.437	3.106	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N(CCNCC#CC)CCc1ccccc1	ZINC001162880757	1382903683	/nfs/dbraw/zinc/90/36/83/1382903683.db2.gz	YHBAVJSXFLFLEF-UHFFFAOYSA-N	0	3	326.484	3.273	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1cc[nH]c1C(C)C	ZINC001162897781	1382909227	/nfs/dbraw/zinc/90/92/27/1382909227.db2.gz	IUPMYPCHXQECRQ-UHFFFAOYSA-N	0	3	337.467	3.046	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)Cc1cccc(C)c1	ZINC001162911476	1382913907	/nfs/dbraw/zinc/91/39/07/1382913907.db2.gz	PCTQSCSRONCZBW-UHFFFAOYSA-N	0	3	348.490	3.222	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1ccc(C=C)cc1	ZINC001162947114	1382924178	/nfs/dbraw/zinc/92/41/78/1382924178.db2.gz	ZLOAGKQSLYDWRB-UHFFFAOYSA-N	0	3	332.447	3.237	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1ccc(Cl)cc1	ZINC001162992010	1382939870	/nfs/dbraw/zinc/93/98/70/1382939870.db2.gz	ANHLKTGZULZKQF-UHFFFAOYSA-N	0	3	340.854	3.248	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C(C)(CC)CC	ZINC001163001442	1382943682	/nfs/dbraw/zinc/94/36/82/1382943682.db2.gz	CUXWUMNVMRNZJV-UHFFFAOYSA-N	0	3	328.500	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C1(C)CCC(C)CC1	ZINC001163006676	1382945712	/nfs/dbraw/zinc/94/57/12/1382945712.db2.gz	IUSOHPGOXMDKJP-UHFFFAOYSA-N	0	3	340.511	3.497	20	30		EGEDHN
CC1(C)CCC[C@@H]1C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001164171240	1383162665	/nfs/dbraw/zinc/16/26/65/1383162665.db2.gz	JZKHAIMXFZQJCP-MRXNPFEDSA-N	0	3	331.435	3.120	20	30		EGEDHN
CC/C(C)=C\C(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001164448160	1383187933	/nfs/dbraw/zinc/18/79/33/1383187933.db2.gz	RRJWQFRVSUZOKC-VBKFSLOCSA-N	0	3	325.456	3.291	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCC1(CN[C@H](C)c2cnccn2)CC1	ZINC001165221383	1383252387	/nfs/dbraw/zinc/25/23/87/1383252387.db2.gz	XLONFRFXXRWBEH-OAHLLOKOSA-N	0	3	330.476	3.016	20	30		EGEDHN
C[C@H]1CCC[C@@H](C(=O)NCCCNCc2cc(C#N)ccc2F)C1	ZINC001165423262	1383293006	/nfs/dbraw/zinc/29/30/06/1383293006.db2.gz	GKNZLUCPXBNZCQ-GOEBONIOSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2c(C)noc2C(C)C)CC1	ZINC001165600599	1383314567	/nfs/dbraw/zinc/31/45/67/1383314567.db2.gz	FSFOHDBQADDIQS-UHFFFAOYSA-N	0	3	339.867	3.349	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCC1(CNCc2nc(C)c(C)s2)CC1	ZINC001166573627	1383439736	/nfs/dbraw/zinc/43/97/36/1383439736.db2.gz	BJPRZRDVUXELSI-UHFFFAOYSA-N	0	3	335.517	3.348	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCC1(CNCc2cc(C3CC3)no2)CC1	ZINC001166580119	1383441187	/nfs/dbraw/zinc/44/11/87/1383441187.db2.gz	XMXAVJHLIVWMOT-UHFFFAOYSA-N	0	3	331.460	3.140	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@H]2CCO[C@@H](CCC)C2)CC1	ZINC001167540107	1383661083	/nfs/dbraw/zinc/66/10/83/1383661083.db2.gz	NBLALUVODCNFCW-HOTGVXAUSA-N	0	3	342.911	3.210	20	30		EGEDHN
CSCC[C@@H](Nc1ccc(/N=C/N(C)C)c(C#N)c1)C(C)(C)O	ZINC001168213092	1383845052	/nfs/dbraw/zinc/84/50/52/1383845052.db2.gz	PNQPFXRXJGIDHW-PUMYGXPMSA-N	0	3	334.489	3.084	20	30		EGEDHN
COc1ccc([C@@H]2C[C@@H](NC(=N)c3ccc(Cl)cn3)CCO2)cc1	ZINC001168594541	1383943907	/nfs/dbraw/zinc/94/39/07/1383943907.db2.gz	HTNARONOYAROFE-YOEHRIQHSA-N	0	3	345.830	3.369	20	30		EGEDHN
N#Cc1cccc([C@@H](O)CN2CC=C(c3c[nH]c4ncccc34)CC2)c1	ZINC001307570296	1384004825	/nfs/dbraw/zinc/00/48/25/1384004825.db2.gz	GICCQFYIOKTGIS-FQEVSTJZSA-N	0	3	344.418	3.257	20	30		EGEDHN
N#Cc1ccc(C2(N[C@@H]3CCCN(C(=O)c4ccccc4)C3)CC2)cc1	ZINC001169734708	1384180453	/nfs/dbraw/zinc/18/04/53/1384180453.db2.gz	CTSHLSCMLIDRGG-HXUWFJFHSA-N	0	3	345.446	3.442	20	30		EGEDHN
CCCCOCC(=O)N[C@@H](C)CCCCNCc1ccccc1C#N	ZINC001169915044	1384198183	/nfs/dbraw/zinc/19/81/83/1384198183.db2.gz	NONWJSITLYPCRU-KRWDZBQOSA-N	0	3	345.487	3.140	20	30		EGEDHN
CCCCOCC(=O)N[C@H](C)CCCCNCc1ccccc1C#N	ZINC001169915046	1384198293	/nfs/dbraw/zinc/19/82/93/1384198293.db2.gz	NONWJSITLYPCRU-QGZVFWFLSA-N	0	3	345.487	3.140	20	30		EGEDHN
C[C@@H](CCCCNCc1cc(F)ccc1C#N)NC(=O)/C=C\C1CC1	ZINC001169981539	1384209910	/nfs/dbraw/zinc/20/99/10/1384209910.db2.gz	GDBSRQWFMZVERS-XMELGKRDSA-N	0	3	343.446	3.428	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)[C@@H](C)C1CC1	ZINC001170018287	1384218914	/nfs/dbraw/zinc/21/89/14/1384218914.db2.gz	IQVINCHPEPBLTG-CVEARBPZSA-N	0	3	327.472	3.369	20	30		EGEDHN
C[C@@H](CCCCNC/C(Cl)=C/Cl)NC(=O)c1ccc(C#N)[nH]1	ZINC001170202046	1384262705	/nfs/dbraw/zinc/26/27/05/1384262705.db2.gz	QYLBEMIPLYIKME-LCFDYFRESA-N	0	3	343.258	3.084	20	30		EGEDHN
C[C@@H](CCCCNC/C(Cl)=C/Cl)NC(=O)c1c[nH]c(C#N)c1	ZINC001170283745	1384282560	/nfs/dbraw/zinc/28/25/60/1384282560.db2.gz	YDNJQVXZQCTOTN-HKMIMPICSA-N	0	3	343.258	3.084	20	30		EGEDHN
CO[C@@H](C)CCC(=O)N[C@H](C)CCCCNCc1ccccc1C#N	ZINC001170303754	1384286186	/nfs/dbraw/zinc/28/61/86/1384286186.db2.gz	PQJMOGIQNVZERV-SJORKVTESA-N	0	3	345.487	3.138	20	30		EGEDHN
COC1C[C@@H]2COC[C@H](C1)N2C1CCC(C#N)(c2ccccc2)CC1	ZINC001170386709	1384305349	/nfs/dbraw/zinc/30/53/49/1384305349.db2.gz	JJNZPXBHNXKYCR-DOFOLRJGSA-N	0	3	340.467	3.269	20	30		EGEDHN
C[C@@H](CCCCNCc1nc2ccccc2o1)NC(=O)C#CC1CC1	ZINC001170665178	1384359488	/nfs/dbraw/zinc/35/94/88/1384359488.db2.gz	LONKOZUOZZLSTA-HNNXBMFYSA-N	0	3	339.439	3.006	20	30		EGEDHN
C[C@H](CCCCNCc1c(F)cccc1F)NC(=O)C#CC1CC1	ZINC001170673688	1384361923	/nfs/dbraw/zinc/36/19/23/1384361923.db2.gz	IBEREGROJBCNDK-CQSZACIVSA-N	0	3	334.410	3.143	20	30		EGEDHN
CCCc1nc(CNCCCC[C@@H](C)NC(=O)C#CC2CC2)cs1	ZINC001170674126	1384362056	/nfs/dbraw/zinc/36/20/56/1384362056.db2.gz	MVHIYTFRRCJEFU-OAHLLOKOSA-N	0	3	347.528	3.274	20	30		EGEDHN
C[C@H](CCCCNCc1csc(C2CC2)n1)NC(=O)C#CC1CC1	ZINC001170674710	1384362158	/nfs/dbraw/zinc/36/21/58/1384362158.db2.gz	RVCPVHBBPVSSMA-CQSZACIVSA-N	0	3	345.512	3.199	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@H](C)CCCCNCc1cnns1	ZINC001170992719	1384426402	/nfs/dbraw/zinc/42/64/02/1384426402.db2.gz	ZNXZQNFQERXWOE-LLVKDONJSA-N	0	3	344.912	3.081	20	30		EGEDHN
N#Cc1ccc(N2CCN([C@@H]3CCc4cccc(F)c4C3)CC2)cc1	ZINC001170997304	1384426784	/nfs/dbraw/zinc/42/67/84/1384426784.db2.gz	RCZDPPBAICAPDK-LJQANCHMSA-N	0	3	335.426	3.377	20	30		EGEDHN
C[C@@H]1Oc2ccc(NC(=N)c3ccc4cc(O)ccc4c3)cc2NC1=O	ZINC001171185369	1384463122	/nfs/dbraw/zinc/46/31/22/1384463122.db2.gz	WCLIZDXZDURSNW-NSHDSACASA-N	0	3	347.374	3.302	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1CC(CN(C)C(=O)OC(C)(C)C)C1	ZINC001171208547	1384469171	/nfs/dbraw/zinc/46/91/71/1384469171.db2.gz	DEFMZXIGABHHKD-OAHLLOKOSA-N	0	3	343.471	3.288	20	30		EGEDHN
COc1cccnc1O[C@@H]1CCN([C@H](C)Cc2cccc(C#N)c2)C1	ZINC001171230396	1384474612	/nfs/dbraw/zinc/47/46/12/1384474612.db2.gz	DINHKHZSNIWQHX-CRAIPNDOSA-N	0	3	337.423	3.046	20	30		EGEDHN
Cc1cncnc1O[C@H]1CCCN([C@H](C)Cc2cccc(C#N)c2)C1	ZINC001171232490	1384475513	/nfs/dbraw/zinc/47/55/13/1384475513.db2.gz	SUZRSCJZAOAMSF-APWZRJJASA-N	0	3	336.439	3.131	20	30		EGEDHN
Cc1cc(OC2CCN([C@@H](C)Cc3cccc(C#N)c3)CC2)ncn1	ZINC001171231534	1384475670	/nfs/dbraw/zinc/47/56/70/1384475670.db2.gz	KKNQSDSZIJHOGT-INIZCTEOSA-N	0	3	336.439	3.131	20	30		EGEDHN
CCCCC(=O)N1C[C@H]2CCN(Cc3ccc(C#N)cc3)C[C@H]2C1	ZINC001316746848	1384558605	/nfs/dbraw/zinc/55/86/05/1384558605.db2.gz	BTUOLIPFUCTWLB-MOPGFXCFSA-N	0	3	325.456	3.029	20	30		EGEDHN
Cc1cc(F)ccc1C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001171689104	1384603412	/nfs/dbraw/zinc/60/34/12/1384603412.db2.gz	OEKSPOBSTYOILL-UHFFFAOYSA-N	0	3	343.377	3.055	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1scnc1CC	ZINC001316872323	1384657338	/nfs/dbraw/zinc/65/73/38/1384657338.db2.gz	BKCHQZGSYWZROM-TZMCWYRMSA-N	0	3	341.908	3.431	20	30		EGEDHN
N#Cc1c[nH]c(C(=O)N[C@@H]2CCCN(CC/C=C\c3ccccc3)C2)c1	ZINC001316939933	1384710359	/nfs/dbraw/zinc/71/03/59/1384710359.db2.gz	CBOXZTISDNHTSV-ZONXLDJSSA-N	0	3	348.450	3.184	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CCCN(CC/C=C/CCC)C2)c1	ZINC001316946333	1384718773	/nfs/dbraw/zinc/71/87/73/1384718773.db2.gz	ANEMURTVARTICM-GHOSXJJBSA-N	0	3	325.456	3.004	20	30		EGEDHN
COc1ccc(N2CCN([C@@H](C)Cc3ccc(C#N)cc3)CC2)cc1	ZINC001172307063	1384765058	/nfs/dbraw/zinc/76/50/58/1384765058.db2.gz	BLFDHUZCVQZHGM-KRWDZBQOSA-N	0	3	335.451	3.320	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)N1CC[C@@](O)(C(F)(F)F)[C@H](C)C1	ZINC001172316541	1384768305	/nfs/dbraw/zinc/76/83/05/1384768305.db2.gz	ULQWCYXCFBKBDW-IOASZLSFSA-N	0	3	326.362	3.124	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)CCCc2sccc2C)C1	ZINC001317092210	1384853699	/nfs/dbraw/zinc/85/36/99/1384853699.db2.gz	YWUJLHODNPDVRJ-HDJSIYSDSA-N	0	3	326.893	3.369	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H](NC(C)(C)c2cccnc2)C[C@H]1C#N	ZINC001172967215	1384891814	/nfs/dbraw/zinc/89/18/14/1384891814.db2.gz	UTYLRXFOUDLMMM-CVEARBPZSA-N	0	3	344.459	3.198	20	30		EGEDHN
C[C@H](N[C@H]1CCN(C(=O)OC(C)(C)C)[C@H](C#N)C1)c1cccc(O)c1	ZINC001172972205	1384892905	/nfs/dbraw/zinc/89/29/05/1384892905.db2.gz	XLVGUGVMOUXOSG-BPUTZDHNSA-N	0	3	345.443	3.334	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H](N2CC[C@@]3(CC3(F)F)C2)C[C@H]1C#N	ZINC001172985377	1384895181	/nfs/dbraw/zinc/89/51/81/1384895181.db2.gz	PIZZEHNHDVSSKQ-HEHGZKQESA-N	0	3	341.402	3.009	20	30		EGEDHN
CCC(C)(C)C(=O)NC[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001317135463	1384898370	/nfs/dbraw/zinc/89/83/70/1384898370.db2.gz	KVYWKDYGIZHVJV-GOSISDBHSA-N	0	3	327.472	3.323	20	30		EGEDHN
C[C@@H](N[C@@H](C)CNC(=O)c1cc(C#N)c[nH]1)c1ccc(F)c(Cl)c1	ZINC001317230748	1385009096	/nfs/dbraw/zinc/00/90/96/1385009096.db2.gz	BRYDWLGPLPJOQL-WDEREUQCSA-N	0	3	348.809	3.148	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H](C)CCCCNCc2nccs2)cc1	ZINC001174634667	1385128106	/nfs/dbraw/zinc/12/81/06/1385128106.db2.gz	DSOGSJKYSMFJMP-OAHLLOKOSA-N	0	3	341.480	3.203	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H](C)CCCCNCc1cc(C)n(C)n1	ZINC001174694455	1385135658	/nfs/dbraw/zinc/13/56/58/1385135658.db2.gz	PDXKOVILJLUEDI-QGZVFWFLSA-N	0	3	346.519	3.077	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](C)CCCCNCc2cc(OC)no2)CC1	ZINC001175074662	1385190773	/nfs/dbraw/zinc/19/07/73/1385190773.db2.gz	YBBIPMKQDDLKCM-OAHLLOKOSA-N	0	3	349.475	3.194	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@H](C)CCCCNCc1ccn(CC)n1	ZINC001175082245	1385191488	/nfs/dbraw/zinc/19/14/88/1385191488.db2.gz	MYHDUZVOVAFPDE-APWZRJJASA-N	0	3	334.508	3.270	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H](C)CCCCNCc2ccn(CC)n2)C1	ZINC001175150343	1385205014	/nfs/dbraw/zinc/20/50/14/1385205014.db2.gz	MQZORRBGTWEXIY-MRXNPFEDSA-N	0	3	332.492	3.024	20	30		EGEDHN
CCCN(CCNC(=O)[C@H](C)C#N)Cc1ccc(Cl)c(Cl)c1	ZINC001317538388	1385271284	/nfs/dbraw/zinc/27/12/84/1385271284.db2.gz	KKVPFUWQQODCSV-GFCCVEGCSA-N	0	3	342.270	3.481	20	30		EGEDHN
CCCN(CCNC(=O)[C@H]1CCC(F)(F)C1)Cc1cccc(C#N)c1	ZINC001317540825	1385278138	/nfs/dbraw/zinc/27/81/38/1385278138.db2.gz	MBEUWKCNNMLIEM-KRWDZBQOSA-N	0	3	349.425	3.322	20	30		EGEDHN
N#Cc1nn(C2=CCN(Cc3ccccc3)CC2)c2ccc(N)cc12	ZINC001175506713	1385315535	/nfs/dbraw/zinc/31/55/35/1385315535.db2.gz	FDLHYTRKAKQHNT-UHFFFAOYSA-N	0	3	329.407	3.237	20	30		EGEDHN
CCc1sc(C(=O)NCCCNCc2ccccc2C#N)cc1C	ZINC001175549459	1385330225	/nfs/dbraw/zinc/33/02/25/1385330225.db2.gz	MTCAXNYCAQJWCC-UHFFFAOYSA-N	0	3	341.480	3.400	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)C2CCC=CCC2)c(F)c1	ZINC001176261271	1385530733	/nfs/dbraw/zinc/53/07/33/1385530733.db2.gz	DMBBYKLHVNTAOS-UHFFFAOYSA-N	0	3	329.419	3.040	20	30		EGEDHN
CC[C@H](CNC(=O)c1ccc(CF)cc1)NCc1ccc(C#N)s1	ZINC001318607616	1385792197	/nfs/dbraw/zinc/79/21/97/1385792197.db2.gz	QGJDWUMIEPBXPY-OAHLLOKOSA-N	0	3	345.443	3.387	20	30		EGEDHN
N#Cc1ccc(F)c(CNCC2(NC(=O)c3ccco3)CCCC2)c1	ZINC001318615060	1385797487	/nfs/dbraw/zinc/79/74/87/1385797487.db2.gz	SUKNMBAGPZEOKE-UHFFFAOYSA-N	0	3	341.386	3.123	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@H]1C[C@H](C)C[C@H](C)C1	ZINC001177131702	1385826775	/nfs/dbraw/zinc/82/67/75/1385826775.db2.gz	NRKMPRXWKXZDPB-IMRBUKKESA-N	0	3	331.298	3.063	20	30		EGEDHN
C[C@H]1CC(C(=O)NCCCNCc2ccc(C#N)cc2F)C[C@H](C)C1	ZINC001177137067	1385828828	/nfs/dbraw/zinc/82/88/28/1385828828.db2.gz	XQNQLAZQVBVEMG-HUUCEWRRSA-N	0	3	345.462	3.366	20	30		EGEDHN
C[C@@](CNCc1cc(C#N)ccc1F)(NC(=O)C1=CCCC1)C1CC1	ZINC001318688459	1385841800	/nfs/dbraw/zinc/84/18/00/1385841800.db2.gz	FZJZMECIDCDGGL-FQEVSTJZSA-N	0	3	341.430	3.182	20	30		EGEDHN
Cc1ccccc1C[C@H](C)C(=O)NCCCNCc1ccccc1C#N	ZINC001177169259	1385842261	/nfs/dbraw/zinc/84/22/61/1385842261.db2.gz	HDBNSGXIIKUPAG-SFHVURJKSA-N	0	3	349.478	3.341	20	30		EGEDHN
CC(C)c1occc1C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001177234290	1385877925	/nfs/dbraw/zinc/87/79/25/1385877925.db2.gz	HAMUHRKEDUSONK-UHFFFAOYSA-N	0	3	343.402	3.323	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)c1n[nH]cc1C	ZINC001177317303	1385912311	/nfs/dbraw/zinc/91/23/11/1385912311.db2.gz	UBIWOBOKCWCNPS-UHFFFAOYSA-N	0	3	338.883	3.083	20	30		EGEDHN
C=C(C)CCC(=O)N(CCCNCc1ccn(C)n1)CC1CCCC1	ZINC001177328166	1385916078	/nfs/dbraw/zinc/91/60/78/1385916078.db2.gz	BLQOUIXXZWLGCK-UHFFFAOYSA-N	0	3	346.519	3.275	20	30		EGEDHN
C=CCC1(C(=O)NCCCN[C@H](C)c2cnc(C)cn2)CCCC1	ZINC001177548098	1385993237	/nfs/dbraw/zinc/99/32/37/1385993237.db2.gz	PIOFSTJDTJZHPF-MRXNPFEDSA-N	0	3	330.476	3.078	20	30		EGEDHN
C[C@@H](C(=O)NC[C@@H](C)CNCc1ccccc1C#N)c1ccccc1	ZINC001319270596	1386033580	/nfs/dbraw/zinc/03/35/80/1386033580.db2.gz	PXUWYDUCRPOMAJ-DLBZAZTESA-N	0	3	335.451	3.204	20	30		EGEDHN
COc1nc(NC(=O)C(C#N)Cc2cccs2)cc2cccnc21	ZINC001177903666	1386078567	/nfs/dbraw/zinc/07/85/67/1386078567.db2.gz	JSALGWFLNNHAIT-LBPRGKRZSA-N	0	3	338.392	3.021	20	30		EGEDHN
COCCCN(C(=O)C(C#N)Cc1cccs1)c1ccccc1N	ZINC001177917702	1386083417	/nfs/dbraw/zinc/08/34/17/1386083417.db2.gz	WINOAYJGIYSRJX-CQSZACIVSA-N	0	3	343.452	3.082	20	30		EGEDHN
N#CC(Cc1cccs1)C(=O)NCc1ccc(-c2c[nH]cn2)cc1	ZINC001177918302	1386084710	/nfs/dbraw/zinc/08/47/10/1386084710.db2.gz	UTXHXLCVAALNKV-OAHLLOKOSA-N	0	3	336.420	3.137	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](NCc2ccc(Cl)cc2OC)[C@@H]1C	ZINC001178324677	1386189100	/nfs/dbraw/zinc/18/91/00/1386189100.db2.gz	WVMARRKEJCFYJG-BBRMVZONSA-N	0	3	336.863	3.394	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](NCc2ccccc2OC2CC2)[C@@H]1C	ZINC001178324101	1386189344	/nfs/dbraw/zinc/18/93/44/1386189344.db2.gz	HHMOYEMHWFUNHX-YJBOKZPZSA-N	0	3	328.456	3.273	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2cccc(Cl)c2)CCN1C(=O)CC1CCC1	ZINC001178415034	1386209947	/nfs/dbraw/zinc/20/99/47/1386209947.db2.gz	YZGUOLDGWSWPLQ-KXBFYZLASA-N	0	3	344.886	3.461	20	30		EGEDHN
O=C(C#CC1CC1)NCCCCCCNCc1cc(O)ccc1Cl	ZINC001178446427	1386220274	/nfs/dbraw/zinc/22/02/74/1386220274.db2.gz	XJIHOTXSTTUMRN-UHFFFAOYSA-N	0	3	348.874	3.225	20	30		EGEDHN
Cc1cccc(CN(CCN(C)C)C(=O)CC#Cc2ccccc2)c1	ZINC001319655270	1386236368	/nfs/dbraw/zinc/23/63/68/1386236368.db2.gz	OWDCMLXWKDPALF-UHFFFAOYSA-N	0	3	334.463	3.327	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](NCc2cc(C)ccc2F)[C@@H]1C	ZINC001178503890	1386238139	/nfs/dbraw/zinc/23/81/39/1386238139.db2.gz	VNRJRRNWLXJFOJ-LPHOPBHVSA-N	0	3	330.447	3.407	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](NCc2cc(F)ccc2OC)[C@@H]1C	ZINC001178805915	1386311227	/nfs/dbraw/zinc/31/12/27/1386311227.db2.gz	PGRNXZHLRNLNHK-YOEHRIQHSA-N	0	3	334.435	3.270	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)[C@@H]1CCCC12CC2	ZINC001178985477	1386367778	/nfs/dbraw/zinc/36/77/78/1386367778.db2.gz	KVLYLJJGJNQEJE-IHPCNDPISA-N	0	3	336.479	3.197	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCCCCCNCc1cc2n(n1)CCC2	ZINC001179306812	1386446004	/nfs/dbraw/zinc/44/60/04/1386446004.db2.gz	MSIDTKDYICHZQS-DLBZAZTESA-N	0	3	346.519	3.054	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCCCCCCN[C@H](C)c1nnc(C)[nH]1	ZINC001179335221	1386454007	/nfs/dbraw/zinc/45/40/07/1386454007.db2.gz	HNZBFTGDXRUVPP-LSDHHAIUSA-N	0	3	335.496	3.043	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCCCCCCNCc1cc(OC)no1	ZINC001179339533	1386455714	/nfs/dbraw/zinc/45/57/14/1386455714.db2.gz	GYZLCQNQCXRACK-HNNXBMFYSA-N	0	3	337.464	3.052	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CC[C@@H](NCc2ccc(Cl)s2)C1	ZINC001181468980	1387000263	/nfs/dbraw/zinc/00/02/63/1387000263.db2.gz	GTSVWSPLNVZBHM-QWHCGFSZSA-N	0	3	342.892	3.073	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@@H](C)[C@](C)(CNCc2nccs2)C1	ZINC001182306325	1387143818	/nfs/dbraw/zinc/14/38/18/1387143818.db2.gz	ZKCOVPLKTAQTKP-RVKKMQEKSA-N	0	3	335.517	3.320	20	30		EGEDHN
CC[C@@H](N[C@@H]1CCN(C(=O)C#CC(C)C)C1)c1ccc(F)cc1F	ZINC001182431741	1387164908	/nfs/dbraw/zinc/16/49/08/1387164908.db2.gz	GAXHGTUFROSRDP-CRAIPNDOSA-N	0	3	334.410	3.266	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](C)[C@](C)(CNCc3ncc(C)s3)C2)C1	ZINC001182558528	1387187012	/nfs/dbraw/zinc/18/70/12/1387187012.db2.gz	PPZNHIOLHBJRDP-AUUYWEPGSA-N	0	3	347.528	3.382	20	30		EGEDHN
CCC(C)(C)CC(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001182848157	1387235125	/nfs/dbraw/zinc/23/51/25/1387235125.db2.gz	LWDDPIFPQNOLKH-MRXNPFEDSA-N	0	3	331.435	3.214	20	30		EGEDHN
C[C@H](CNC(=O)c1cc(C#N)c[nH]1)N(C)[C@H](C)c1ccc(Cl)cc1	ZINC001329409894	1389100929	/nfs/dbraw/zinc/10/09/29/1389100929.db2.gz	MAGPVYJKGSDJGE-CHWSQXEVSA-N	0	3	344.846	3.351	20	30		EGEDHN
CC(C)(NC(=O)[C@@H](N)CCCC#N)c1ccc(C(F)(F)F)cc1	ZINC001337068006	1389247906	/nfs/dbraw/zinc/24/79/06/1389247906.db2.gz	CGJQFXCLEAMKRZ-ZDUSSCGKSA-N	0	3	327.350	3.078	20	30		EGEDHN
N#CC1(c2ccccc2)CC(NCCOc2ccc(Cl)cn2)C1	ZINC001338632360	1389719524	/nfs/dbraw/zinc/71/95/24/1389719524.db2.gz	VTKKNCVNAWWYJE-UHFFFAOYSA-N	0	3	327.815	3.327	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N1CC[C@@H](C)C(C)(C)C1	ZINC001338850434	1389789888	/nfs/dbraw/zinc/78/98/88/1389789888.db2.gz	BAVJHFYZPNWIQA-CVEARBPZSA-N	0	3	331.508	3.146	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N1C[C@@H](C)CC(C)(C)C1	ZINC001338851259	1389790546	/nfs/dbraw/zinc/79/05/46/1389790546.db2.gz	KHHOMPDGVPOVGT-HOTGVXAUSA-N	0	3	331.508	3.146	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)Nc1cccc(-c2nncn2C)c1	ZINC001339839002	1390168137	/nfs/dbraw/zinc/16/81/37/1390168137.db2.gz	PMGSHBDQRIATFC-KRWDZBQOSA-N	0	3	343.475	3.499	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1cc(F)ccc1OC[C@@H]1CCCO1	ZINC001339924089	1390190778	/nfs/dbraw/zinc/19/07/78/1390190778.db2.gz	XLBSVNPRRJSLJK-LSDHHAIUSA-N	0	3	336.407	3.006	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1cc(Br)ccc1OCC	ZINC001341492704	1390493814	/nfs/dbraw/zinc/49/38/14/1390493814.db2.gz	IIUVBUKMQYCISL-LBPRGKRZSA-N	0	3	341.249	3.470	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N[C@H](c1cccc(F)c1)c1ccccn1	ZINC001341859015	1390538801	/nfs/dbraw/zinc/53/88/01/1390538801.db2.gz	VPUAQDWETMTOLS-FUHWJXTLSA-N	0	3	327.403	3.110	20	30		EGEDHN
N#Cc1ccc(C2CCN(C(=O)c3ccc4c(c3)CNC4)CC2)cc1	ZINC001342110766	1390572842	/nfs/dbraw/zinc/57/28/42/1390572842.db2.gz	HIXYEDJOKRMNSI-UHFFFAOYSA-N	0	3	331.419	3.181	20	30		EGEDHN
N#CC(C(=O)c1ccsc1C(F)F)c1nnc2n1CCCCC2	ZINC001342157812	1390579578	/nfs/dbraw/zinc/57/95/78/1390579578.db2.gz	SLXQMASDQVVGQD-SNVBAGLBSA-N	0	3	336.367	3.494	20	30		EGEDHN
COc1ccc(OC(C)(C)C(=O)C(C#N)c2cccc(F)n2)cc1	ZINC001343384670	1390710448	/nfs/dbraw/zinc/71/04/48/1390710448.db2.gz	IDWBJDKYRYPDSB-AWEZNQCLSA-N	0	3	328.343	3.263	20	30		EGEDHN
Cn1ccnc1C(C#N)C(=O)CCCc1ccccc1Br	ZINC001343704914	1390732129	/nfs/dbraw/zinc/73/21/29/1390732129.db2.gz	NASXEXNFVPSSKX-CYBMUJFWSA-N	0	3	346.228	3.382	20	30		EGEDHN
CC(C)n1ncc2c1nc(C1CC1)cc2C(=O)C(C#N)c1nccn1C	ZINC001343715421	1390732915	/nfs/dbraw/zinc/73/29/15/1390732915.db2.gz	CUDNRKUBPWTSGP-CQSZACIVSA-N	0	3	348.410	3.113	20	30		EGEDHN
C=CCc1ccc(OCC(=O)Nc2cccc3c2CNC3)c(OC)c1	ZINC001344591348	1390801615	/nfs/dbraw/zinc/80/16/15/1390801615.db2.gz	VPNNBNHYAIMQDH-UHFFFAOYSA-N	0	3	338.407	3.044	20	30		EGEDHN
C[C@H](C#N)C(=O)NCC1(N[C@H](C)c2cc(F)ccc2F)CCCC1	ZINC001698795535	1406463759	/nfs/dbraw/zinc/46/37/59/1406463759.db2.gz	FSNYVALRIGAYLR-CHWSQXEVSA-N	0	3	335.398	3.204	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN[C@H](c2ccccc2)[C@@H]2CCCO2)c1	ZINC001345606405	1390868371	/nfs/dbraw/zinc/86/83/71/1390868371.db2.gz	PIISLZZJQFUNGB-PZJWPPBQSA-N	0	3	349.434	3.397	20	30		EGEDHN
N#CC(C(=O)CCCC(=O)C1CC1)c1nccn1Cc1ccccc1	ZINC001346536926	1390950847	/nfs/dbraw/zinc/95/08/47/1390950847.db2.gz	DJSXXVQHBORNMI-QGZVFWFLSA-N	0	3	335.407	3.257	20	30		EGEDHN
C=C(CC)C(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC001346581062	1390957804	/nfs/dbraw/zinc/95/78/04/1390957804.db2.gz	VHISQABJPXPGOV-UHFFFAOYSA-N	0	3	336.863	3.266	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N1CCC(Oc2cc(C)ccc2C)CC1	ZINC001353223430	1391964913	/nfs/dbraw/zinc/96/49/13/1391964913.db2.gz	OPPAGMBSSSBQFH-SFHVURJKSA-N	0	3	330.472	3.357	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)CCc1nccs1	ZINC001479834208	1392420078	/nfs/dbraw/zinc/42/00/78/1392420078.db2.gz	NXXBUBQXDPSWPO-KBPBESRZSA-N	0	3	341.908	3.187	20	30		EGEDHN
Cc1cc(C(=O)NCC[C@@H](C)NCc2cc(C#N)ccc2F)oc1C	ZINC001480759342	1392917469	/nfs/dbraw/zinc/91/74/69/1392917469.db2.gz	ONNGDTCZIPHPMQ-CYBMUJFWSA-N	0	3	343.402	3.205	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1cnn(C(C)(C)C)c1CC	ZINC001480808161	1392947350	/nfs/dbraw/zinc/94/73/50/1392947350.db2.gz	DBKCWBOVKRRHRO-CYBMUJFWSA-N	0	3	340.899	3.051	20	30		EGEDHN
CCCC1(C(=O)NC[C@@H]2CCN(Cc3cccc(C#N)c3)C2)CC1	ZINC001481110398	1393122308	/nfs/dbraw/zinc/12/23/08/1393122308.db2.gz	LKNPJSGEOXJJQA-SFHVURJKSA-N	0	3	325.456	3.077	20	30		EGEDHN
CCCN(CCNC(=O)[C@@H](C)C1CC1)Cc1ccc(F)c(C#N)c1	ZINC001481133292	1393129039	/nfs/dbraw/zinc/12/90/39/1393129039.db2.gz	QUCOGUQJEOKCSR-AWEZNQCLSA-N	0	3	331.435	3.072	20	30		EGEDHN
CC[C@@H](CNC(=O)c1cnoc1C(C)C)NCc1ccc(C#N)s1	ZINC001481862765	1394566110	/nfs/dbraw/zinc/56/61/10/1394566110.db2.gz	ABAZYWUFVNQAKK-LBPRGKRZSA-N	0	3	346.456	3.029	20	30		EGEDHN
CC[C@@H](CNC(=O)c1cccn1C(C)C)NCc1ccc(C#N)s1	ZINC001481877977	1394572877	/nfs/dbraw/zinc/57/28/77/1394572877.db2.gz	GGJUJLCYJIKTBI-AWEZNQCLSA-N	0	3	344.484	3.300	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2ccc(OC)c(C)c2)CCCC1	ZINC001481910058	1394591882	/nfs/dbraw/zinc/59/18/82/1394591882.db2.gz	SRBUUSRQQWWPGX-UHFFFAOYSA-N	0	3	336.863	3.388	20	30		EGEDHN
COc1ccc(C#N)cc1CNC[C@@H](C)N(C)C(=O)CCC1CCC1	ZINC001482270386	1394857779	/nfs/dbraw/zinc/85/77/79/1394857779.db2.gz	YWXUROIINJPRSY-OAHLLOKOSA-N	0	3	343.471	3.084	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)N(C)C(=O)c1cccc(F)c1F	ZINC001482322285	1394893037	/nfs/dbraw/zinc/89/30/37/1394893037.db2.gz	BIOSBZUTAVWLMJ-NSHDSACASA-N	0	3	349.406	3.148	20	30		EGEDHN
CCCc1occc1C(=O)N(C)[C@@H](C)CNCc1ccc(C#N)s1	ZINC001482353855	1394917062	/nfs/dbraw/zinc/91/70/62/1394917062.db2.gz	LWVMBCZCAWFXCB-ZDUSSCGKSA-N	0	3	345.468	3.416	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)c2cc(Cl)no2)CC1	ZINC001505400041	1396287420	/nfs/dbraw/zinc/28/74/20/1396287420.db2.gz	AJLUUCVFGCRFRH-UHFFFAOYSA-N	0	3	346.258	3.255	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1n[nH]c2ccccc21	ZINC001689911639	1404204589	/nfs/dbraw/zinc/20/45/89/1404204589.db2.gz	JJJKYJJRINCIAA-BBRMVZONSA-N	0	3	346.862	3.288	20	30		EGEDHN
C[C@@H](CNC(=O)c1cc2ccsc2[nH]1)NCc1ccc(C#N)s1	ZINC001690607650	1404650063	/nfs/dbraw/zinc/65/00/63/1404650063.db2.gz	BAUPAOWFXBHEFQ-JTQLQIEISA-N	0	3	344.465	3.071	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@H](C)c2c(F)cccc2F)C1	ZINC001691156201	1405090210	/nfs/dbraw/zinc/09/02/10/1405090210.db2.gz	MUIMFBWGEIMHNS-JHJVBQTASA-N	0	3	342.817	3.305	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@@H](C)c2c(F)cccc2F)C1	ZINC001691156200	1405090244	/nfs/dbraw/zinc/09/02/44/1405090244.db2.gz	MUIMFBWGEIMHNS-AVGNSLFASA-N	0	3	342.817	3.305	20	30		EGEDHN
C=C(Br)CNC[C@H](NC(=O)c1cc(C)co1)C(C)(C)C	ZINC001725804216	1426484300	/nfs/dbraw/zinc/48/43/00/1426484300.db2.gz	YCLFFRLFJRDJHG-ZDUSSCGKSA-N	0	3	343.265	3.231	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2csnc2C)CCCC[C@@H]1C	ZINC001732262357	1428502804	/nfs/dbraw/zinc/50/28/04/1428502804.db2.gz	VHXAVVDCGQPSKV-ZBEGNZNMSA-N	0	3	341.908	3.472	20	30		EGEDHN
Cc1cscc1C(=O)NC[C@@H](C)CNCc1ccccc1C#N	ZINC001732337742	1428540306	/nfs/dbraw/zinc/54/03/06/1428540306.db2.gz	AULKKDNKYWIWHB-ZDUSSCGKSA-N	0	3	327.453	3.084	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)[C@H]3CC34CC4)CCCC2)c(F)c1	ZINC001732396296	1428563566	/nfs/dbraw/zinc/56/35/66/1428563566.db2.gz	IDOKKCOJBOHCIE-MRXNPFEDSA-N	0	3	341.430	3.016	20	30		EGEDHN
Cc1c(F)cccc1C(=O)NCC1(NCc2cccc(C#N)c2)CC1	ZINC001699650909	1413033703	/nfs/dbraw/zinc/03/37/03/1413033703.db2.gz	GPUVRQPRQICTDA-UHFFFAOYSA-N	0	3	337.398	3.058	20	30		EGEDHN
Cc1ccc(CN2CCC(C)(CNC(=O)[C@@H](C)C#N)CC2)cc1F	ZINC001699857989	1413289961	/nfs/dbraw/zinc/28/99/61/1413289961.db2.gz	HUPRGTZDQVPQNY-HNNXBMFYSA-N	0	3	331.435	3.012	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)CC2(C)CC2)CCN1Cc1ccc(C#N)cc1	ZINC001700315031	1413773204	/nfs/dbraw/zinc/77/32/04/1413773204.db2.gz	BRZIZDWLPJLEKL-MAUKXSAKSA-N	0	3	325.456	3.218	20	30		EGEDHN
CN(CC(C)(C)CNCc1ccccc1C#N)C(=O)C1CC(F)(F)C1	ZINC001700440745	1414012161	/nfs/dbraw/zinc/01/21/61/1414012161.db2.gz	JTNPHEHOHWTQPK-UHFFFAOYSA-N	0	3	349.425	3.178	20	30		EGEDHN
CC(C)C(C)(C)C(=O)NC[C@@H](C)N(C)Cc1ccc(OCC#N)cc1	ZINC001700462266	1414062597	/nfs/dbraw/zinc/06/25/97/1414062597.db2.gz	YSRWGCOCMPOEJW-MRXNPFEDSA-N	0	3	345.487	3.208	20	30		EGEDHN
C[C@H]1C[C@@H](NCc2ccc(F)c(C#N)c2)CN1C(=O)CCCC1CC1	ZINC001700841000	1414491247	/nfs/dbraw/zinc/49/12/47/1414491247.db2.gz	KNBZAIYVRQIOSX-KBXCAEBGSA-N	0	3	343.446	3.357	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H](CNCc2ccc(C#N)s2)C(C)(C)C)o1	ZINC001700978946	1414617680	/nfs/dbraw/zinc/61/76/80/1414617680.db2.gz	OUBHLMMQZDMADO-INIZCTEOSA-N	0	3	345.468	3.456	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@@H](CNC(=O)CC3CCCC3)C2)c(F)c1	ZINC001707055763	1417170407	/nfs/dbraw/zinc/17/04/07/1417170407.db2.gz	FAEKNJRROLWDQO-MAEOIBBWSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1cc(C)sn1	ZINC001712996160	1417547275	/nfs/dbraw/zinc/54/72/75/1417547275.db2.gz	GRKUFRKRPWCXTK-TZMCWYRMSA-N	0	3	327.881	3.177	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1cc(Cl)no1	ZINC001713002278	1417556184	/nfs/dbraw/zinc/55/61/84/1417556184.db2.gz	JFJRCUPEMICOND-MNOVXSKESA-N	0	3	332.231	3.053	20	30		EGEDHN
Cc1cscc1C(=O)NC[C@H](NCc1ccc(C#N)s1)C1CC1	ZINC001713107600	1417668063	/nfs/dbraw/zinc/66/80/63/1417668063.db2.gz	NMPPWFQGDMELRH-INIZCTEOSA-N	0	3	345.493	3.288	20	30		EGEDHN
CC1(C(=O)NC[C@@H]2CCCN(Cc3ccc(C#N)cc3)C2)CCCC1	ZINC001713217673	1417796637	/nfs/dbraw/zinc/79/66/37/1417796637.db2.gz	GKEXEMXMBQKVDJ-IBGZPJMESA-N	0	3	339.483	3.467	20	30		EGEDHN
CC(C)(C(=O)NC[C@H]1CCN(Cc2ccc(C#N)cc2)C1)C1CCC1	ZINC001713533414	1418284569	/nfs/dbraw/zinc/28/45/69/1418284569.db2.gz	FVQAGTTXWAAUOY-GOSISDBHSA-N	0	3	339.483	3.323	20	30		EGEDHN
C[C@@H](NCCN(C)C(=O)c1cc(C#N)c[nH]1)c1ccc(F)c(Cl)c1	ZINC001713581486	1418383274	/nfs/dbraw/zinc/38/32/74/1418383274.db2.gz	IFJGKMWIVOWJLN-LLVKDONJSA-N	0	3	348.809	3.102	20	30		EGEDHN
C[C@@H](C#N)C(=O)N[C@H]1CCN(Cc2ccc(-c3ccccc3)cc2)C1	ZINC001713947147	1418732775	/nfs/dbraw/zinc/73/27/75/1418732775.db2.gz	IFKQBQWVFNFFMQ-JXFKEZNVSA-N	0	3	333.435	3.204	20	30		EGEDHN
CCC[C@H](CC)C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001713963238	1418743320	/nfs/dbraw/zinc/74/33/20/1418743320.db2.gz	YLIDSUVWLOSWEN-XIRDDKMYSA-N	0	3	331.435	3.260	20	30		EGEDHN
CCCc1occc1C(=O)NC[C@H](CC)NCc1ccc(C#N)s1	ZINC001714116411	1418919493	/nfs/dbraw/zinc/91/94/93/1418919493.db2.gz	URRPIMMSHKSYPU-ZDUSSCGKSA-N	0	3	345.468	3.463	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2cnc(C3CC3)s2)CCCC1	ZINC001714147872	1418953512	/nfs/dbraw/zinc/95/35/12/1418953512.db2.gz	DBDNHYAHQIOGLU-UHFFFAOYSA-N	0	3	339.892	3.405	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1cc2ccccc2n1C)C1CC1	ZINC001714169250	1418977608	/nfs/dbraw/zinc/97/76/08/1418977608.db2.gz	IPFWVTBVEFLNDK-IBGZPJMESA-N	0	3	345.874	3.419	20	30		EGEDHN
CCc1ccc(C(=O)NC[C@@H](C)NCc2ccc(F)c(C#N)c2)cc1	ZINC001714298810	1419077449	/nfs/dbraw/zinc/07/74/49/1419077449.db2.gz	FKUCKMRTPRNJPN-CQSZACIVSA-N	0	3	339.414	3.168	20	30		EGEDHN
Cc1ccc(F)cc1C(=O)NC[C@@H](C)CNCc1ccccc1C#N	ZINC001714420099	1419156280	/nfs/dbraw/zinc/15/62/80/1419156280.db2.gz	POFXKVNQZBGRBT-AWEZNQCLSA-N	0	3	339.414	3.162	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)C[C@@H](C)c1ccco1	ZINC001714443586	1419175586	/nfs/dbraw/zinc/17/55/86/1419175586.db2.gz	DHMFJYBXADNBAJ-HZPDHXFCSA-N	0	3	339.439	3.187	20	30		EGEDHN
CCN(CCNC(=O)c1ccc(C)s1)Cc1cccc(C#N)c1	ZINC001714575859	1419311987	/nfs/dbraw/zinc/31/19/87/1419311987.db2.gz	LEOZNBBKDUYRMB-UHFFFAOYSA-N	0	3	327.453	3.180	20	30		EGEDHN
CCN(CCNC(=O)c1ccc(C)cc1F)Cc1cccc(C#N)c1	ZINC001714597403	1419350117	/nfs/dbraw/zinc/35/01/17/1419350117.db2.gz	XVMMABPBOMQRRC-UHFFFAOYSA-N	0	3	339.414	3.258	20	30		EGEDHN
CCCN(CCNC(=O)[C@H](C)C(C)C)Cc1ccc(F)c(C#N)c1	ZINC001714659811	1419443633	/nfs/dbraw/zinc/44/36/33/1419443633.db2.gz	VVERBMGJEUBSOS-OAHLLOKOSA-N	0	3	333.451	3.318	20	30		EGEDHN
N#Cc1ccc(CNCC2(NC(=O)c3ccco3)CCCC2)c(F)c1	ZINC001715082587	1419819613	/nfs/dbraw/zinc/81/96/13/1419819613.db2.gz	FPLHNDBGRQGMGC-UHFFFAOYSA-N	0	3	341.386	3.123	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2cc(-c3ccco3)n[nH]2)CCCC1	ZINC001715103955	1419845212	/nfs/dbraw/zinc/84/52/12/1419845212.db2.gz	HCVGPASNCJMARO-UHFFFAOYSA-N	0	3	348.834	3.054	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1oc(C(C)C)nc1C)C1CC1	ZINC001715119095	1419863829	/nfs/dbraw/zinc/86/38/29/1419863829.db2.gz	IYEQCIRSBXMAQI-QGZVFWFLSA-N	0	3	339.867	3.347	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2oc(C)nc2C)CCCC[C@H]1C	ZINC001715126641	1419873033	/nfs/dbraw/zinc/87/30/33/1419873033.db2.gz	CHLNFRPLWDMDTG-PIGZYNQJSA-N	0	3	339.867	3.312	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](CNCc2ccc(C#N)s2)CC(C)C)co1	ZINC001715381893	1420078497	/nfs/dbraw/zinc/07/84/97/1420078497.db2.gz	JANQPBFSSSXMOP-HNNXBMFYSA-N	0	3	345.468	3.456	20	30		EGEDHN
CC(C)[C@H](CNC(=O)C1CC(C)(C)C1)NCc1ccc(C#N)cc1F	ZINC001715490188	1420171567	/nfs/dbraw/zinc/17/15/67/1420171567.db2.gz	AHIFRGKTSRMTSB-SFHVURJKSA-N	0	3	345.462	3.364	20	30		EGEDHN
Cc1cccc(C(=O)N[C@@H](C)CNCc2ccc(C#N)s2)c1C	ZINC001716461812	1420675350	/nfs/dbraw/zinc/67/53/50/1420675350.db2.gz	DRSBRWUJBMEYBE-ZDUSSCGKSA-N	0	3	327.453	3.145	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H]1C(=O)NCC1(NCc2ccc(F)c(C#N)c2)CC1	ZINC001716695555	1420848727	/nfs/dbraw/zinc/84/87/27/1420848727.db2.gz	UTZQWQZGPOIQPV-NVXWUHKLSA-N	0	3	343.446	3.118	20	30		EGEDHN
CN(CCCN(C)C(=O)C(C)(C)C1CC1)Cc1ccc(F)c(C#N)c1	ZINC001717210210	1421182951	/nfs/dbraw/zinc/18/29/51/1421182951.db2.gz	BSGDJLMVTKXSPL-UHFFFAOYSA-N	0	3	345.462	3.414	20	30		EGEDHN
C[C@@H](CCNC(=O)[C@@]1(C)CC=CCC1)NCc1cc(C#N)ccc1F	ZINC001717340779	1421278098	/nfs/dbraw/zinc/27/80/98/1421278098.db2.gz	RWPTVGOOLXELDE-YWZLYKJASA-N	0	3	343.446	3.428	20	30		EGEDHN
C[C@@H](CCNC(=O)c1c(F)cccc1F)NCc1ccccc1C#N	ZINC001717342529	1421279937	/nfs/dbraw/zinc/27/99/37/1421279937.db2.gz	GCRNVFWKPJKQBZ-ZDUSSCGKSA-N	0	3	343.377	3.135	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1cnc(-c2ccco2)s1	ZINC001717342527	1421280082	/nfs/dbraw/zinc/28/00/82/1421280082.db2.gz	FVWQNOFOMZPZFF-NSHDSACASA-N	0	3	339.848	3.254	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)Cc2ccc(C)nc2)CC1	ZINC001717357215	1421292577	/nfs/dbraw/zinc/29/25/77/1421292577.db2.gz	BQULZZDACOPCTA-UHFFFAOYSA-N	0	3	349.906	3.246	20	30		EGEDHN
CC(C)SCC(=O)N1CC[C@H]([C@H](C)NCc2ccccc2C#N)C1	ZINC001733523309	1429731513	/nfs/dbraw/zinc/73/15/13/1429731513.db2.gz	BASJTOVNKMNVIJ-YJBOKZPZSA-N	0	3	345.512	3.026	20	30		EGEDHN
CCC1(C(=O)N[C@H]2CCN(Cc3cccc(C#N)c3)[C@@H](C)C2)CC1	ZINC001724996812	1425402624	/nfs/dbraw/zinc/40/26/24/1425402624.db2.gz	MPRMNDQOUHPUDO-YJBOKZPZSA-N	0	3	325.456	3.218	20	30		EGEDHN
CCC(CC)C(=O)NC[C@H](NCc1cc(C#N)ccc1F)C1CC1	ZINC001731391773	1427345464	/nfs/dbraw/zinc/34/54/64/1427345464.db2.gz	IWLNSLHTEALFQJ-SFHVURJKSA-N	0	3	331.435	3.118	20	30		EGEDHN
CCC[C@H](CC)C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001731454511	1427430704	/nfs/dbraw/zinc/43/07/04/1427430704.db2.gz	DJYIFDIDJKQUFF-XIRDDKMYSA-N	0	3	331.435	3.260	20	30		EGEDHN
CC(C)(C)CC(=O)NCC1(NCc2ccc(F)c(C#N)c2)CCC1	ZINC001733712168	1429929347	/nfs/dbraw/zinc/92/93/47/1429929347.db2.gz	FZTBQAZQUJZIHU-UHFFFAOYSA-N	0	3	331.435	3.262	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@H](C)N(C)Cc2ccc(C#N)cc2)cc1F	ZINC001734043481	1437831938	/nfs/dbraw/zinc/83/19/38/1437831938.db2.gz	OCZSXLQESHHYCY-HNNXBMFYSA-N	0	3	339.414	3.256	20	30		EGEDHN
C[C@H](CNC(=O)c1ccoc1C1CC1)N(C)Cc1cccc(C#N)c1	ZINC001734051624	1437841617	/nfs/dbraw/zinc/84/16/17/1437841617.db2.gz	OLINQNBCVHSGDK-CQSZACIVSA-N	0	3	337.423	3.279	20	30		EGEDHN
CC(C)c1cccc(CN(C)CCCNC(=O)C#CC(C)(C)C)n1	ZINC001751972496	1440129453	/nfs/dbraw/zinc/12/94/53/1440129453.db2.gz	LYIIZMCRSXBFAT-UHFFFAOYSA-N	0	3	329.488	3.193	20	30		EGEDHN
CN(CCCNC(=O)C[C@@H]1CC[C@@H]2C[C@@H]21)Cc1ccc(C#N)c(F)c1	ZINC001752004830	1440131999	/nfs/dbraw/zinc/13/19/99/1440131999.db2.gz	RLHMTUNNBYZHCZ-RYRKJORJSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1cnn(C(F)F)c1	ZINC001752156873	1440147414	/nfs/dbraw/zinc/14/74/14/1440147414.db2.gz	IDSUETMQNOEANF-YPMHNXCESA-N	0	3	346.809	3.004	20	30		EGEDHN
CCN(CCCNC(=O)[C@H]1CC[C@@H](F)C1)Cc1ccc(C#N)s1	ZINC001752208365	1440154498	/nfs/dbraw/zinc/15/44/98/1440154498.db2.gz	VVYJFSLTTUVDCY-UONOGXRCSA-N	0	3	337.464	3.086	20	30		EGEDHN
CC#CCN(CCCNC(=O)[C@@H](C)Cc1ccc(C)cc1)C1CC1	ZINC001752290749	1440165995	/nfs/dbraw/zinc/16/59/95/1440165995.db2.gz	UISZIMDYXUBGOJ-SFHVURJKSA-N	0	3	326.484	3.168	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CC12CCN(Cc1cncc(C)c1)CC2	ZINC001752426256	1440177213	/nfs/dbraw/zinc/17/72/13/1440177213.db2.gz	IIGCZTXYUKUIIO-GOSISDBHSA-N	0	3	327.472	3.217	20	30		EGEDHN
C=C(C)CN1CCC(N(CCC)C(=O)[C@H](C)Oc2cccnc2)CC1	ZINC001752439492	1440180861	/nfs/dbraw/zinc/18/08/61/1440180861.db2.gz	INKWRJWOYJFFFX-KRWDZBQOSA-N	0	3	345.487	3.128	20	30		EGEDHN
C=CCN1CCC(N(CCC)C(=O)[C@@H]2CCc3cccnc32)CC1	ZINC001752439822	1440181037	/nfs/dbraw/zinc/18/10/37/1440181037.db2.gz	OUSWCLZSNIVLTC-GOSISDBHSA-N	0	3	327.472	3.000	20	30		EGEDHN
CCCCCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccnc1	ZINC001752531603	1440193998	/nfs/dbraw/zinc/19/39/98/1440193998.db2.gz	ANOFQNPYYKEKDS-KDURUIRLSA-N	0	3	329.488	3.270	20	30		EGEDHN
CC(C)[C@@H]1C[C@@H]1C(=O)N[C@H]1C[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001752673545	1440199068	/nfs/dbraw/zinc/19/90/68/1440199068.db2.gz	GAOXFJHGRGHQKF-XSLAGTTESA-N	0	3	344.886	3.220	20	30		EGEDHN
CC(C)CCC(=O)N[C@H]1C[C@@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001752712326	1440203379	/nfs/dbraw/zinc/20/33/79/1440203379.db2.gz	GGHMODYLSXUTQN-HDICACEKSA-N	0	3	332.875	3.365	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001752754497	1440205122	/nfs/dbraw/zinc/20/51/22/1440205122.db2.gz	TYSMOJUEZNMATL-XYPHTWIQSA-N	0	3	329.419	3.036	20	30		EGEDHN
CCC(C)(CC)C(=O)N[C@H]1C[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001752774348	1440206498	/nfs/dbraw/zinc/20/64/98/1440206498.db2.gz	UFJYQIJUHLDBRE-HDICACEKSA-N	0	3	330.447	3.240	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CCC[C@@H](CNC/C(Cl)=C/Cl)C1	ZINC001752794977	1440214277	/nfs/dbraw/zinc/21/42/77/1440214277.db2.gz	VPSFONPBZTVTJY-SYCNKOGLSA-N	0	3	349.302	3.115	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)COC[C@H](C)c1ccccc1	ZINC001752825282	1440223156	/nfs/dbraw/zinc/22/31/56/1440223156.db2.gz	OXGHJECFZIGMLJ-ICSRJNTNSA-N	0	3	344.499	3.354	20	30		EGEDHN
C=CCCC(=O)N1CCCC[C@H]1[C@@H]1CCCN1Cc1conc1C	ZINC001752832486	1440226008	/nfs/dbraw/zinc/22/60/08/1440226008.db2.gz	WQXLHRGPCTVGSF-ROUUACIJSA-N	0	3	331.460	3.295	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)Cc2cc(F)c(C)cc2F)C1	ZINC001752836450	1440227936	/nfs/dbraw/zinc/22/79/36/1440227936.db2.gz	NHDGNFRXIRLRSZ-HZPDHXFCSA-N	0	3	348.437	3.056	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H](C)[C@H]1CCCN(Cc2ccc(F)cc2)C1	ZINC001752841450	1440230648	/nfs/dbraw/zinc/23/06/48/1440230648.db2.gz	QSXRDCHXXSVQSZ-WMZOPIPTSA-N	0	3	348.462	3.135	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC1CCC(NCc2snnc2C)CC1	ZINC001752850218	1440233353	/nfs/dbraw/zinc/23/33/53/1440233353.db2.gz	ONOAEEIEXQILCS-UHFFFAOYSA-N	0	3	348.516	3.132	20	30		EGEDHN
Cc1csc(CN[C@@H]2CCC[C@@H](NC(=O)C#CC(C)(C)C)C2)n1	ZINC001752970033	1440254775	/nfs/dbraw/zinc/25/47/75/1440254775.db2.gz	XAFNYMLMGGUMOU-HUUCEWRRSA-N	0	3	333.501	3.018	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CCC[C@H](NCc2nccn2C(F)F)C1	ZINC001752971313	1440255088	/nfs/dbraw/zinc/25/50/88/1440255088.db2.gz	LBXBVPRFZGHKAC-UONOGXRCSA-N	0	3	340.418	3.152	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)CCC(C)(F)F)C1	ZINC001752993651	1440260995	/nfs/dbraw/zinc/26/09/95/1440260995.db2.gz	KVUUYADTHXTBQI-QGZVFWFLSA-N	0	3	349.425	3.416	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)[C@@H](C)CCCc2ccccc2)C1	ZINC001753000970	1440264565	/nfs/dbraw/zinc/26/45/65/1440264565.db2.gz	WXEZOWJEGMYNHL-ICSRJNTNSA-N	0	3	326.484	3.201	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)[C@@H](C)CCCc2ccccc2)C1	ZINC001753000969	1440264594	/nfs/dbraw/zinc/26/45/94/1440264594.db2.gz	WXEZOWJEGMYNHL-AZUAARDMSA-N	0	3	326.484	3.201	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1cc2cccc(OC)c2o1	ZINC001753012643	1440267437	/nfs/dbraw/zinc/26/74/37/1440267437.db2.gz	FORIKIJBWNVTIY-GFCCVEGCSA-N	0	3	336.819	3.292	20	30		EGEDHN
N#Cc1ccccc1CN1CCC[C@@H]1CCCNC(=O)CCC(F)F	ZINC001753030605	1440272635	/nfs/dbraw/zinc/27/26/35/1440272635.db2.gz	AINVCHOTBKAXJO-KRWDZBQOSA-N	0	3	349.425	3.464	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCC[C@H]2CCCN2Cc2ccns2)C1	ZINC001753033029	1440273506	/nfs/dbraw/zinc/27/35/06/1440273506.db2.gz	CLKMGXWSVHOZGW-HNNXBMFYSA-N	0	3	333.501	3.360	20	30		EGEDHN
C=C1CCC(C(=O)NCCC[C@H]2CCCN2Cc2ccnn2C)CC1	ZINC001753033310	1440273658	/nfs/dbraw/zinc/27/36/58/1440273658.db2.gz	JVIORJZABDRMQE-SFHVURJKSA-N	0	3	344.503	3.027	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCN(C)[C@H]2CCc3c2cccc3F)cc1	ZINC001753059771	1440282757	/nfs/dbraw/zinc/28/27/57/1440282757.db2.gz	URGSHXNOFFGNJT-FQEVSTJZSA-N	0	3	336.410	3.156	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCN(CC)[C@H](C)c2cccc(F)c2)nc1	ZINC001753092829	1440300249	/nfs/dbraw/zinc/30/02/49/1440300249.db2.gz	JOHGHSWDAAAXNE-OAHLLOKOSA-N	0	3	339.414	3.015	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCN(CC)Cc2ccccc2C2CC2)cn1	ZINC001753093557	1440300912	/nfs/dbraw/zinc/30/09/12/1440300912.db2.gz	ZTBGIFUVJSJWQB-UHFFFAOYSA-N	0	3	347.462	3.192	20	30		EGEDHN
CCCN(CCNC(=O)c1cc(C#N)c[nH]1)Cc1cc(C)sc1C	ZINC001753143490	1440322877	/nfs/dbraw/zinc/32/28/77/1440322877.db2.gz	UXUAVSRNVPBMSV-UHFFFAOYSA-N	0	3	344.484	3.207	20	30		EGEDHN
CN(CCNCc1ccc(C#N)c(F)c1)C(=O)[C@H]1CCC=CCCC1	ZINC001753202429	1440338438	/nfs/dbraw/zinc/33/84/38/1440338438.db2.gz	DILXPLNVFCDBFD-KRWDZBQOSA-N	0	3	343.446	3.382	20	30		EGEDHN
CCc1ccsc1C(=O)N(C)CCNCc1ccc(C#N)c(F)c1	ZINC001753264014	1440344435	/nfs/dbraw/zinc/34/44/35/1440344435.db2.gz	FJPOQSLYOOALGC-UHFFFAOYSA-N	0	3	345.443	3.183	20	30		EGEDHN
CC(C)N(CC#Cc1ccccc1)CCCNC(=O)[C@]12C[C@H]1CCC2	ZINC001753289712	1440349732	/nfs/dbraw/zinc/34/97/32/1440349732.db2.gz	RIAHINBLHAUSRQ-IFMALSPDSA-N	0	3	338.495	3.445	20	30		EGEDHN
C=CCN[C@H](CNC(=O)c1ncoc1C)c1ccc(C(C)C)cc1	ZINC001753294883	1440351975	/nfs/dbraw/zinc/35/19/75/1440351975.db2.gz	WZLXQQDSPWDYGQ-QGZVFWFLSA-N	0	3	327.428	3.353	20	30		EGEDHN
C=C(C)CN[C@@H](CNC(=O)c1nc(C)n2ccccc12)c1ccccc1	ZINC001753300536	1440353859	/nfs/dbraw/zinc/35/38/59/1440353859.db2.gz	VLHGQDDMSMWSAL-SFHVURJKSA-N	0	3	348.450	3.280	20	30		EGEDHN
C=CCOCCN1CC[C@@H](N(CCC)C(=O)[C@H]2CC23CCCC3)C1	ZINC001753319879	1440362745	/nfs/dbraw/zinc/36/27/45/1440362745.db2.gz	OPHXWZLUOINJLS-QZTJIDSGSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCOCCN1CC[C@H](N(CCC)C(=O)C2CCC=CCC2)C1	ZINC001753321528	1440363845	/nfs/dbraw/zinc/36/38/45/1440363845.db2.gz	ASYJVPAPUAVCEF-IBGZPJMESA-N	0	3	334.504	3.248	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CCC)C(=O)C[C@@H](C)n2nc(C)cc2C)C1	ZINC001753321756	1440363877	/nfs/dbraw/zinc/36/38/77/1440363877.db2.gz	DLOVBLXLRUSHGI-MOPGFXCFSA-N	0	3	346.519	3.340	20	30		EGEDHN
CC/C=C(\C)C(=O)NCC[C@@H]1CCN(Cc2ccccc2C#N)C1	ZINC001753322718	1440364625	/nfs/dbraw/zinc/36/46/25/1440364625.db2.gz	PPDFHRSORYITEZ-UMNNMYMZSA-N	0	3	325.456	3.243	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CCC)C(=O)[C@@H](OC)C2CCCCC2)C1	ZINC001753324227	1440365588	/nfs/dbraw/zinc/36/55/88/1440365588.db2.gz	ZWSFAJWLGLEUHY-OALUTQOASA-N	0	3	336.520	3.471	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCC[C@H]1CCN(Cc2ccccc2C#N)C1	ZINC001753336638	1440372670	/nfs/dbraw/zinc/37/26/70/1440372670.db2.gz	XKRSYDUTSUAFRU-ROUUACIJSA-N	0	3	339.483	3.489	20	30		EGEDHN
CCCCCCCN1CCN(CCN(C)C(=O)C#CC(C)(C)C)CC1	ZINC001753342624	1440375790	/nfs/dbraw/zinc/37/57/90/1440375790.db2.gz	XSJBCXBPRFKPCG-UHFFFAOYSA-N	0	3	349.563	3.082	20	30		EGEDHN
CN(CC#Cc1ccccc1)CC1CCN(C(=O)CC2(C)CC2)CC1	ZINC001753365580	1440385103	/nfs/dbraw/zinc/38/51/03/1440385103.db2.gz	YUMKRMMFJFXAPU-UHFFFAOYSA-N	0	3	338.495	3.399	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N1C[C@@H]2C[C@H]1CN2CCCC1CCCC1	ZINC001753422949	1440395967	/nfs/dbraw/zinc/39/59/67/1440395967.db2.gz	QMVOCELXDUKGPG-ZJOUEHCJSA-N	0	3	348.531	3.471	20	30		EGEDHN
CC(C)c1ccccc1CN1CC[C@@H](N(C)C(=O)CSCC#N)C1	ZINC001753429697	1440398233	/nfs/dbraw/zinc/39/82/33/1440398233.db2.gz	JNTCEVBLOPVJCO-QGZVFWFLSA-N	0	3	345.512	3.099	20	30		EGEDHN
CC[C@H](CNC(=O)[C@@H]1CC1(C)C)NCC#Cc1ccccc1Cl	ZINC001753469808	1440413747	/nfs/dbraw/zinc/41/37/47/1440413747.db2.gz	GXKQMUHLZCIAKN-CVEARBPZSA-N	0	3	332.875	3.222	20	30		EGEDHN
CC[C@@H](CNC(=O)C(F)=C1CCCC1)NCc1ccc(C#N)c(F)c1	ZINC001753470102	1440413804	/nfs/dbraw/zinc/41/38/04/1440413804.db2.gz	MOZDTVOYTWMTGB-INIZCTEOSA-N	0	3	347.409	3.479	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1nc(Cl)cs1)C1CC1	ZINC001753523771	1440429052	/nfs/dbraw/zinc/42/90/52/1440429052.db2.gz	PZVKHNRXDQSLBR-ZDUSSCGKSA-N	0	3	334.272	3.037	20	30		EGEDHN
C#CCCCC(=O)N[C@]1(CNCc2cncs2)CCCC[C@H]1C	ZINC001753532664	1440431535	/nfs/dbraw/zinc/43/15/35/1440431535.db2.gz	UKGSSKXCRQGXAU-QAPCUYQASA-N	0	3	333.501	3.101	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)Cc2cccnc2C)CCCC[C@H]1C	ZINC001753535880	1440432555	/nfs/dbraw/zinc/43/25/55/1440432555.db2.gz	NAPYVDIZMUKYRN-KUHUBIRLSA-N	0	3	349.906	3.340	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCCN(C(=O)c2cc(OC)cs2)C1	ZINC001753552533	1440435317	/nfs/dbraw/zinc/43/53/17/1440435317.db2.gz	XCMVRANXDDRUAZ-ZDUSSCGKSA-N	0	3	342.892	3.341	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCCN(C(=O)Cc2ccccc2F)C1	ZINC001753561700	1440437068	/nfs/dbraw/zinc/43/70/68/1440437068.db2.gz	YMURPNNZISSCTH-OAHLLOKOSA-N	0	3	338.854	3.339	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1CC[C@H](NCc2cc(C)ncn2)CC1	ZINC001753581761	1440440294	/nfs/dbraw/zinc/44/02/94/1440440294.db2.gz	ADWAKHIUVMITDP-IYARVYRRSA-N	0	3	342.487	3.070	20	30		EGEDHN
C[C@@H](CNC(=O)C#CC(C)(C)C)CN[C@H](C)c1nc2ccccc2o1	ZINC001753612854	1440449176	/nfs/dbraw/zinc/44/91/76/1440449176.db2.gz	LJZWQSPWIXVVBW-HUUCEWRRSA-N	0	3	341.455	3.280	20	30		EGEDHN
C[C@H](CNC(=O)C#CC(C)(C)C)CN[C@@H](C)c1nc2ccccc2o1	ZINC001753612853	1440449224	/nfs/dbraw/zinc/44/92/24/1440449224.db2.gz	LJZWQSPWIXVVBW-GJZGRUSLSA-N	0	3	341.455	3.280	20	30		EGEDHN
COc1ccc(C#N)cc1CNC[C@H](C)N(C)C(=O)C1(C)CCCC1	ZINC001753704747	1440469260	/nfs/dbraw/zinc/46/92/60/1440469260.db2.gz	JUECBTKQICNCTP-HNNXBMFYSA-N	0	3	343.471	3.084	20	30		EGEDHN
CC(C)C[C@@H](CNCc1ccc(C#N)s1)NC(=O)C1CCCC1	ZINC001753731292	1440475954	/nfs/dbraw/zinc/47/59/54/1440475954.db2.gz	ONLNEZZFSCJARJ-HNNXBMFYSA-N	0	3	333.501	3.430	20	30		EGEDHN
CC(C)C[C@H](CNCc1ccc(C#N)c(F)c1)NC(=O)C1CC(C)C1	ZINC001753732648	1440476543	/nfs/dbraw/zinc/47/65/43/1440476543.db2.gz	IMKIOMXVKWELFD-IUPXNIOVSA-N	0	3	345.462	3.364	20	30		EGEDHN
Cc1ccc(F)c(CNC[C@@H](CC(C)C)NC(=O)C#CC2CC2)c1	ZINC001753734928	1440477325	/nfs/dbraw/zinc/47/73/25/1440477325.db2.gz	MDSYCUDRPFBPJJ-GOSISDBHSA-N	0	3	330.447	3.168	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](NC(=O)C2CC2)C2CCCCC2)c(F)c1	ZINC001753743039	1440479919	/nfs/dbraw/zinc/47/99/19/1440479919.db2.gz	DTCQJVSVXRWCIV-LJQANCHMSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCCCN1C(=O)[C@H](CC(C)C)OC	ZINC001753794913	1440489591	/nfs/dbraw/zinc/48/95/91/1440489591.db2.gz	DLYKFJYMDHJFLR-HOTGVXAUSA-N	0	3	330.900	3.161	20	30		EGEDHN
CC(C)[C@H](CNC(=O)c1cccs1)NCc1ccc(C#N)cc1F	ZINC001753822156	1440496773	/nfs/dbraw/zinc/49/67/73/1440496773.db2.gz	CNOHLOWDBBOGHA-INIZCTEOSA-N	0	3	345.443	3.303	20	30		EGEDHN
CC(C)[C@H](CNC(=O)C1C=CC=CC=C1)NCC#Cc1ccccc1	ZINC001753831074	1440499574	/nfs/dbraw/zinc/49/95/74/1440499574.db2.gz	MHNRMCVKFXQNPL-NRFANRHFSA-N	0	3	334.463	3.067	20	30		EGEDHN
C=C(Br)CN[C@@H](CNC(=O)[C@@H]1C[C@H]1C(C)(C)C)C(C)C	ZINC001753835030	1440500692	/nfs/dbraw/zinc/50/06/92/1440500692.db2.gz	QLGCXIYISIVWNS-MCIONIFRSA-N	0	3	345.325	3.308	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1c(F)cc(F)cc1F)C(C)C	ZINC001753838859	1440501999	/nfs/dbraw/zinc/50/19/99/1440501999.db2.gz	VOGZZUDORFKNSX-CYBMUJFWSA-N	0	3	334.769	3.200	20	30		EGEDHN
CC(C)[C@H](CNC(=O)[C@@H]1CCC1(C)C)NCC#Cc1ccccc1	ZINC001753839287	1440502124	/nfs/dbraw/zinc/50/21/24/1440502124.db2.gz	WDJNAAMONPPEAX-OALUTQOASA-N	0	3	326.484	3.205	20	30		EGEDHN
CCCCCCCCC(=O)N1CC[C@@H]2[C@@H](CCN2CC#CCOC)C1	ZINC001753875828	1440519402	/nfs/dbraw/zinc/51/94/02/1440519402.db2.gz	NMTDTJKFQHPYMA-VQTJNVASSA-N	0	3	348.531	3.310	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H]1CCC[C@H]1CNCc1csc(C2CC2)n1	ZINC001753883931	1440520868	/nfs/dbraw/zinc/52/08/68/1440520868.db2.gz	BYODOHOJXWPBGJ-RDJZCZTQSA-N	0	3	345.512	3.054	20	30		EGEDHN
Cc1sccc1C(=O)N[C@@H](C)CCNCc1cc(C#N)ccc1F	ZINC001753962920	1440526393	/nfs/dbraw/zinc/52/63/93/1440526393.db2.gz	APDIVWZFSRXLHZ-LBPRGKRZSA-N	0	3	345.443	3.366	20	30		EGEDHN
CC(C)(C)/C=C/C(=O)NC/C=C\CNCc1ccc(F)c(C#N)c1	ZINC001754104616	1440541506	/nfs/dbraw/zinc/54/15/06/1440541506.db2.gz	VDEBJFOFNKGPQO-FTGFODROSA-N	0	3	329.419	3.062	20	30		EGEDHN
Cc1csc(C(=O)N[C@H](C)CNCC#Cc2ccccc2)c1Cl	ZINC001754226950	1440553363	/nfs/dbraw/zinc/55/33/63/1440553363.db2.gz	IKNMCNJPWCITIB-CQSZACIVSA-N	0	3	346.883	3.470	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccccc1)NC(=O)c1ccccc1Cl	ZINC001754291358	1440565220	/nfs/dbraw/zinc/56/52/20/1440565220.db2.gz	HEDBHBUCRKYZRM-HNNXBMFYSA-N	0	3	326.827	3.100	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccccc1)NC(=O)c1cc2ccccc2o1	ZINC001754292655	1440565626	/nfs/dbraw/zinc/56/56/26/1440565626.db2.gz	LQDBLZRAVSTLJO-INIZCTEOSA-N	0	3	332.403	3.192	20	30		EGEDHN
CN(CCCNCc1cc(C#N)ccc1F)C(=O)C[C@@H]1CC=CCC1	ZINC001754389406	1440594071	/nfs/dbraw/zinc/59/40/71/1440594071.db2.gz	GYVIYHOPRWIYON-MRXNPFEDSA-N	0	3	343.446	3.382	20	30		EGEDHN
C=C(Cl)CNCCCN(C)C(=O)[C@H](C)Cc1ccccc1F	ZINC001754395395	1440594662	/nfs/dbraw/zinc/59/46/62/1440594662.db2.gz	BULXMPJJLRVWFM-CYBMUJFWSA-N	0	3	326.843	3.195	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](CNCC#Cc1ccc(F)cc1)C1CC1	ZINC001754447349	1440600174	/nfs/dbraw/zinc/60/01/74/1440600174.db2.gz	CNWBFAMAVZEZBH-IBGZPJMESA-N	0	3	342.458	3.264	20	30		EGEDHN
C=CCC[C@H](C)N1CC[C@H]1CNC(=O)c1ccc(OC(C)C)nc1	ZINC001754485605	1440608497	/nfs/dbraw/zinc/60/84/97/1440608497.db2.gz	YQGFIBBYXSLEDE-RDJZCZTQSA-N	0	3	331.460	3.028	20	30		EGEDHN
C=CCC[C@@H](C)N1CC[C@@H]1CNC(=O)c1cnccc1C(F)(F)F	ZINC001754494929	1440611803	/nfs/dbraw/zinc/61/18/03/1440611803.db2.gz	AYLKIXPWCGPIDC-CHWSQXEVSA-N	0	3	341.377	3.259	20	30		EGEDHN
C=CCC1(C(=O)NC[C@H]2CCN2C[C@@H](OC)C2CCC2)CCCC1	ZINC001754505564	1440616261	/nfs/dbraw/zinc/61/62/61/1440616261.db2.gz	VTCHGVCKASHGEA-QZTJIDSGSA-N	0	3	334.504	3.129	20	30		EGEDHN
Cc1cc(C)cc(CC(=O)NCC2(NCc3cccc(C#N)c3)CC2)c1	ZINC001754523657	1440620294	/nfs/dbraw/zinc/62/02/94/1440620294.db2.gz	DKYWBSJLSWQRCV-UHFFFAOYSA-N	0	3	347.462	3.156	20	30		EGEDHN
C=Cc1ccc(C(=O)NCC2(NCc3ccc(F)c(C#N)c3)CC2)cc1	ZINC001754526612	1440621301	/nfs/dbraw/zinc/62/13/01/1440621301.db2.gz	VGBSKTPIUCGYJT-UHFFFAOYSA-N	0	3	349.409	3.393	20	30		EGEDHN
C#CCN(C(=O)c1cc(C2CC2)no1)C1CCN(CC=C(C)C)CC1	ZINC001754641013	1440649143	/nfs/dbraw/zinc/64/91/43/1440649143.db2.gz	MGMBTKGAIXWQHZ-UHFFFAOYSA-N	0	3	341.455	3.058	20	30		EGEDHN
C#CCN(C(=O)Cc1c[nH]c2cc(C)ccc12)C1CCN(CC=C)CC1	ZINC001754642196	1440649251	/nfs/dbraw/zinc/64/92/51/1440649251.db2.gz	UNVOFFRRMVKPHO-UHFFFAOYSA-N	0	3	349.478	3.131	20	30		EGEDHN
C#CCN(C(=O)CCc1cc(F)ccc1F)C1CCN(CC=C)CC1	ZINC001754643280	1440649360	/nfs/dbraw/zinc/64/93/60/1440649360.db2.gz	RLVYVGGRTPAIQP-UHFFFAOYSA-N	0	3	346.421	3.010	20	30		EGEDHN
O=C(N[C@H](CNCC#Cc1ccc(Cl)cc1)C1CCCC1)C1CC1	ZINC001754643745	1440649556	/nfs/dbraw/zinc/64/95/56/1440649556.db2.gz	GXNUIVGROOJWFR-LJQANCHMSA-N	0	3	344.886	3.366	20	30		EGEDHN
CC#CCN1CCC[C@@](C)(CNC(=O)[C@H](CC)c2c(C)noc2C)C1	ZINC001754732081	1440680150	/nfs/dbraw/zinc/68/01/50/1440680150.db2.gz	NDUYILINRCTXCB-XLIONFOSSA-N	0	3	345.487	3.027	20	30		EGEDHN
C=CCN1CCC[C@@](C)(CNC(=O)c2cc3nc(C)ccc3o2)C1	ZINC001754732793	1440680609	/nfs/dbraw/zinc/68/06/09/1440680609.db2.gz	CFUDNHKUOFRRCD-IBGZPJMESA-N	0	3	327.428	3.154	20	30		EGEDHN
C=C(C)CN1CC[C@](O)(CNC(=O)C[C@H](CC)c2ccc(C)cc2)C1	ZINC001754757327	1440685332	/nfs/dbraw/zinc/68/53/32/1440685332.db2.gz	IVBMRVFVISRYME-RXVVDRJESA-N	0	3	344.499	3.008	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(Cc1cnc(C)o1)C2	ZINC001754785323	1440687703	/nfs/dbraw/zinc/68/77/03/1440687703.db2.gz	LNAINBJMPVYSPR-SZMVWBNQSA-N	0	3	343.471	3.221	20	30		EGEDHN
C=CCOCCCC(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1ccsc1	ZINC001754864730	1440702416	/nfs/dbraw/zinc/70/24/16/1440702416.db2.gz	YGMFJKMKOZGSDL-ROUUACIJSA-N	0	3	348.512	3.296	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@H]2[C@H]1CCN2Cc1ncccc1C	ZINC001754868980	1440704055	/nfs/dbraw/zinc/70/40/55/1440704055.db2.gz	REUJBEFMYWECJM-RBUKOAKNSA-N	0	3	327.472	3.312	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1ncccc1C	ZINC001754868981	1440704177	/nfs/dbraw/zinc/70/41/77/1440704177.db2.gz	REUJBEFMYWECJM-RTBURBONSA-N	0	3	327.472	3.312	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](CCNCc3cc(C)no3)C2)CCCC1	ZINC001754943538	1440712108	/nfs/dbraw/zinc/71/21/08/1440712108.db2.gz	HTQLUFBQTOMXDH-QGZVFWFLSA-N	0	3	345.487	3.448	20	30		EGEDHN
CC(C)OCCN(C)Cc1ccccc1CNC(=O)C#CC(C)(C)C	ZINC001754945773	1440712956	/nfs/dbraw/zinc/71/29/56/1440712956.db2.gz	IRRWSKGRVXZAHJ-UHFFFAOYSA-N	0	3	344.499	3.209	20	30		EGEDHN
C=C1CC(C)(C(=O)NCc2ccccc2CN(C)C[C@H](C)OC)C1	ZINC001754946746	1440713479	/nfs/dbraw/zinc/71/34/79/1440713479.db2.gz	VCMFHWMGZHEWQQ-INIZCTEOSA-N	0	3	330.472	3.126	20	30		EGEDHN
C#CCN[C@H](C)c1ccc(CNC(=O)c2coc(C(F)F)c2)cc1	ZINC001754947964	1440713929	/nfs/dbraw/zinc/71/39/29/1440713929.db2.gz	CUIUOHDRUASTQF-GFCCVEGCSA-N	0	3	332.350	3.431	20	30		EGEDHN
C=CCN(C)Cc1ccccc1CNC(=O)Cc1n[nH]c2ccccc12	ZINC001754952392	1440715417	/nfs/dbraw/zinc/71/54/17/1440715417.db2.gz	BEULEPSTKHMITG-UHFFFAOYSA-N	0	3	348.450	3.040	20	30		EGEDHN
CC(C)=CC(=O)N1C[C@@H](C)[C@@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001755102987	1440753555	/nfs/dbraw/zinc/75/35/55/1440753555.db2.gz	FESFQVRJEOIIIT-QAPCUYQASA-N	0	3	330.859	3.094	20	30		EGEDHN
Cc1cccc(Cl)c1CN[C@@H]1CN(C(=O)C#CC(C)C)C[C@@H]1C	ZINC001755108366	1440754013	/nfs/dbraw/zinc/75/40/13/1440754013.db2.gz	DPGQEGUJHFXWAO-MAUKXSAKSA-N	0	3	332.875	3.244	20	30		EGEDHN
CCc1ccc(C(=O)N2C[C@@H](C)[C@@H](NCC#Cc3ccccc3)C2)cc1	ZINC001755123932	1440756074	/nfs/dbraw/zinc/75/60/74/1440756074.db2.gz	WDGMIKXAILHHQB-GCJKJVERSA-N	0	3	346.474	3.351	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(C)(NCc3ccn(CC)n3)CC2)CCC1	ZINC001755133183	1440757629	/nfs/dbraw/zinc/75/76/29/1440757629.db2.gz	FXBDJGWBPORWDY-UHFFFAOYSA-N	0	3	344.503	3.120	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)CC(C)(C)c2ccc(F)cc2)C[C@H]1C	ZINC001755162434	1440765293	/nfs/dbraw/zinc/76/52/93/1440765293.db2.gz	VBYITEKJNPILQK-CRAIPNDOSA-N	0	3	330.447	3.096	20	30		EGEDHN
C=CCCCN1CCc2ccccc2[C@H]1CNC(=O)[C@@H](C)OCC	ZINC001755171629	1440768988	/nfs/dbraw/zinc/76/89/88/1440768988.db2.gz	ALSJQYDJLAGGPF-VQIMIIECSA-N	0	3	330.472	3.093	20	30		EGEDHN
C=CCCCN1CCOC2(CCN(C(=O)[C@@H]3CC[C@H]4C[C@H]4C3)CC2)C1	ZINC001755174867	1440770539	/nfs/dbraw/zinc/77/05/39/1440770539.db2.gz	ZDZGWFGADPKBJV-OTWHNJEPSA-N	0	3	346.515	3.082	20	30		EGEDHN
C=CCCCN1CCOC2(CCN(C(=O)[C@@H](C)CCCC)CC2)C1	ZINC001755174830	1440770586	/nfs/dbraw/zinc/77/05/86/1440770586.db2.gz	YPQHROIELQTDDX-SFHVURJKSA-N	0	3	336.520	3.472	20	30		EGEDHN
C#CCCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1sccc1Cl	ZINC001755185979	1440773161	/nfs/dbraw/zinc/77/31/61/1440773161.db2.gz	ARACLZIOUWQUJO-HZPDHXFCSA-N	0	3	344.867	3.410	20	30		EGEDHN
COc1ccc(CN(C)C[C@@H]2CCCN2C(=O)C#CC(C)C)cc1C	ZINC001755193448	1440775475	/nfs/dbraw/zinc/77/54/75/1440775475.db2.gz	YIHQCSDNQTXVJJ-IBGZPJMESA-N	0	3	342.483	3.086	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCN1C(=O)C(C)(C)c1ccc(OC)cc1	ZINC001755201051	1440779587	/nfs/dbraw/zinc/77/95/87/1440779587.db2.gz	OXRQQWRJBBNDDH-QGZVFWFLSA-N	0	3	330.472	3.082	20	30		EGEDHN
Cc1occc1C(=O)N[C@@H](C)[C@@H](C)NCC#Cc1ccccc1Cl	ZINC001755228141	1440786384	/nfs/dbraw/zinc/78/63/84/1440786384.db2.gz	ZJZYUWJKFIYIDU-KGLIPLIRSA-N	0	3	344.842	3.390	20	30		EGEDHN
CCCC1(C(=O)N[C@@H](C)[C@H](C)NCC#Cc2ccc(F)cc2)CC1	ZINC001755252941	1440792457	/nfs/dbraw/zinc/79/24/57/1440792457.db2.gz	MXUDQFYGRNXXKJ-HOTGVXAUSA-N	0	3	330.447	3.240	20	30		EGEDHN
C[C@@H](NC(=O)c1cccc2cc[nH]c21)[C@H](C)NCC#Cc1ccccc1	ZINC001755258780	1440794019	/nfs/dbraw/zinc/79/40/19/1440794019.db2.gz	VSYNKUZCKRDPOI-DLBZAZTESA-N	0	3	345.446	3.316	20	30		EGEDHN
C#CCCCCC(=O)NC[C@H](C)N(C)[C@H]1CCc2ccc(F)cc21	ZINC001755296742	1440806583	/nfs/dbraw/zinc/80/65/83/1440806583.db2.gz	QKNOQGWDXGNYLX-KXBFYZLASA-N	0	3	330.447	3.443	20	30		EGEDHN
CC#CCCCC(=O)NC[C@H](C)N(C)[C@H]1CCc2c1cccc2F	ZINC001755314992	1440815235	/nfs/dbraw/zinc/81/52/35/1440815235.db2.gz	ZUUHQKCRUJLSJF-KXBFYZLASA-N	0	3	330.447	3.443	20	30		EGEDHN
Cc1cccc(C(=O)NC[C@H](C)N(C)Cc2ccc(C#N)cc2)c1C	ZINC001755324803	1440820996	/nfs/dbraw/zinc/82/09/96/1440820996.db2.gz	QGPOZGQOXDOXAK-INIZCTEOSA-N	0	3	335.451	3.425	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2c[nH]c3ncccc23)CCCCC1	ZINC001755355575	1440829420	/nfs/dbraw/zinc/82/94/20/1440829420.db2.gz	LHNNHLUMNLRFCL-UHFFFAOYSA-N	0	3	346.862	3.338	20	30		EGEDHN
CCCC[C@@H](CNCC#Cc1ccccc1)NC(=O)c1ccc(C)nc1	ZINC001755356297	1440829759	/nfs/dbraw/zinc/82/97/59/1440829759.db2.gz	KAMAVAHVWBFDQB-NRFANRHFSA-N	0	3	349.478	3.320	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2(CCc3ccccc3)CC2)C(C)(C)C1	ZINC001755432918	1440851456	/nfs/dbraw/zinc/85/14/56/1440851456.db2.gz	NECMHFXLXPLECM-LJQANCHMSA-N	0	3	338.495	3.249	20	30		EGEDHN
C=CCN1CCCC2(CN(C(=O)CCOc3ccc(C)c(C)c3)C2)C1	ZINC001755456401	1440855726	/nfs/dbraw/zinc/85/57/26/1440855726.db2.gz	VAQHZYMTFBVPDI-UHFFFAOYSA-N	0	3	342.483	3.183	20	30		EGEDHN
C=C(Cl)CNC[C@H]1C[C@H](NC(=O)C2C3CC4CC(C3)CC2C4)C1	ZINC001755471709	1440858907	/nfs/dbraw/zinc/85/89/07/1440858907.db2.gz	CXWBZNDCIDTFIN-MVFKYCOMSA-N	0	3	336.907	3.296	20	30		EGEDHN
C=C(Cl)CNC[C@H]1C[C@H](NC(=O)C[C@@H]2CCO[C@H](C(C)C)C2)C1	ZINC001755481121	1440860139	/nfs/dbraw/zinc/86/01/39/1440860139.db2.gz	DQNUVXIKNQZJEG-VQHPVUNQSA-N	0	3	342.911	3.065	20	30		EGEDHN
C[C@@H](CCCNCc1ccccc1C#N)NC(=O)[C@@H]1CC=CCC1	ZINC001755487697	1440860954	/nfs/dbraw/zinc/86/09/54/1440860954.db2.gz	BCKOIZCLNBFILP-DLBZAZTESA-N	0	3	325.456	3.289	20	30		EGEDHN
C=CCCCC(=O)N1CCC(N(C)Cc2ccc(C#N)s2)CC1	ZINC001755533411	1440868341	/nfs/dbraw/zinc/86/83/41/1440868341.db2.gz	QMFSMKSFFMKNOD-UHFFFAOYSA-N	0	3	331.485	3.399	20	30		EGEDHN
C=C(Br)CNC[C@@H](C1CC1)N(C)C(=O)C[C@@H](C)CC	ZINC001755572222	1440877165	/nfs/dbraw/zinc/87/71/65/1440877165.db2.gz	RMDINYVUZPPYLM-FZMZJTMJSA-N	0	3	331.298	3.158	20	30		EGEDHN
C[C@H](CN(C)C(=O)[C@@H]1CCCC1(C)C)NCc1ccc(F)c(C#N)c1	ZINC001755601363	1440884228	/nfs/dbraw/zinc/88/42/28/1440884228.db2.gz	LKGRHNOKJBCSDZ-PBHICJAKSA-N	0	3	345.462	3.460	20	30		EGEDHN
CCC[C@H](CC)C(=O)N(C)C[C@H](C)NCC#Cc1ccc(F)cc1	ZINC001755611826	1440887245	/nfs/dbraw/zinc/88/72/45/1440887245.db2.gz	VCQPSGYOTQLZOJ-WMZOPIPTSA-N	0	3	332.463	3.440	20	30		EGEDHN
Cc1ccc(CC(=O)N(C)C[C@H](C)NCC#Cc2ccccc2)cc1C	ZINC001755616621	1440889121	/nfs/dbraw/zinc/88/91/21/1440889121.db2.gz	UYFCJJPRPHRCDR-FQEVSTJZSA-N	0	3	348.490	3.334	20	30		EGEDHN
CCCCCC(=O)N1C[C@@H](NCc2ccc(F)c(C#N)c2)C[C@H]1C	ZINC001755670382	1440893941	/nfs/dbraw/zinc/89/39/41/1440893941.db2.gz	QMSVWRSPSNINMB-PBHICJAKSA-N	0	3	331.435	3.357	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@H](NCc2ccc(OC)c(C#N)c2)C[C@H]1C	ZINC001755675123	1440894468	/nfs/dbraw/zinc/89/44/68/1440894468.db2.gz	INOZHAKLSXVANG-CRAIPNDOSA-N	0	3	341.455	3.002	20	30		EGEDHN
C=CCCCC(=O)N1C[C@H](NCc2cnn(C(C)(C)C)c2)C[C@H]1C	ZINC001755680256	1440895044	/nfs/dbraw/zinc/89/50/44/1440895044.db2.gz	CNISDPTXOWMFSO-NVXWUHKLSA-N	0	3	332.492	3.073	20	30		EGEDHN
CC#CCN[C@H]1C[C@@H](C)N(C(=O)c2cc3c(s2)CCCCC3)C1	ZINC001755688394	1440896290	/nfs/dbraw/zinc/89/62/90/1440896290.db2.gz	IIQALJGKGDMCLS-ZBFHGGJFSA-N	0	3	330.497	3.233	20	30		EGEDHN
C=CCCCC(=O)N[C@@]12CCC[C@@H]1N(CCc1ccns1)CC2	ZINC001755702642	1440901001	/nfs/dbraw/zinc/90/10/01/1440901001.db2.gz	WZQPYAQWFWRCAT-FUHWJXTLSA-N	0	3	333.501	3.155	20	30		EGEDHN
C=CCOCCN1CCC[C@@H](NC(=O)c2cc(C)sc2C)[C@@H]1C	ZINC001755717901	1440906000	/nfs/dbraw/zinc/90/60/00/1440906000.db2.gz	WFIAJZHUUVJJJA-WMLDXEAASA-N	0	3	336.501	3.150	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CC[C@H](CNCc2nc(C)cs2)C1	ZINC001755726228	1440909428	/nfs/dbraw/zinc/90/94/28/1440909428.db2.gz	FJBATZKIPWZPMW-JKSUJKDBSA-N	0	3	333.501	3.020	20	30		EGEDHN
CC#CCCCC(=O)N[C@H]1CC[C@@H](CNCc2nc(C)c(C)s2)C1	ZINC001755743558	1440912058	/nfs/dbraw/zinc/91/20/58/1440912058.db2.gz	KADROCVPPMUYNH-SJORKVTESA-N	0	3	347.528	3.328	20	30		EGEDHN
CC(C)CCC(=O)N1C[C@@H](NCc2ccc(C#N)s2)C(C)(C)C1	ZINC001755751706	1440913401	/nfs/dbraw/zinc/91/34/01/1440913401.db2.gz	UUIVBXAUKWOMNA-MRXNPFEDSA-N	0	3	333.501	3.383	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@H](NCc2cnn(C(C)(C)C)c2)C(C)(C)C1	ZINC001755757661	1440914297	/nfs/dbraw/zinc/91/42/97/1440914297.db2.gz	PMUYSGLZGYWABN-KRWDZBQOSA-N	0	3	346.519	3.321	20	30		EGEDHN
Cc1cccc(C)c1OCCN(C)CCN(C(=O)[C@H](C)C#N)C(C)C	ZINC001755810608	1440920085	/nfs/dbraw/zinc/92/00/85/1440920085.db2.gz	GBPMVLBLQKSTQN-GOSISDBHSA-N	0	3	345.487	3.011	20	30		EGEDHN
C=C(C)CN(C)CCN(C(=O)c1ccc(OC)c(OC)c1C)C(C)C	ZINC001755813370	1440921752	/nfs/dbraw/zinc/92/17/52/1440921752.db2.gz	ODBFGTGUWJWDQC-UHFFFAOYSA-N	0	3	348.487	3.371	20	30		EGEDHN
C#CCCN(C)CCN(C(=O)CCc1ccc(F)cc1F)C(C)C	ZINC001755817032	1440923886	/nfs/dbraw/zinc/92/38/86/1440923886.db2.gz	ACXNLDIFCPMGJK-UHFFFAOYSA-N	0	3	336.426	3.090	20	30		EGEDHN
C=C(Br)CNC[C@H](NC(=O)[C@H](C)C(C)C)C(C)(C)C	ZINC001755833080	1440929250	/nfs/dbraw/zinc/92/92/50/1440929250.db2.gz	FJMGTWXPEPZHOP-OLZOCXBDSA-N	0	3	333.314	3.308	20	30		EGEDHN
CC#CCN1CCC([C@H](C)NC(=O)Cc2cccc3cnccc32)CC1	ZINC001755848039	1440933960	/nfs/dbraw/zinc/93/39/60/1440933960.db2.gz	BLJABLZOZQXBFT-KRWDZBQOSA-N	0	3	349.478	3.017	20	30		EGEDHN
C=CC(C)(C)C(=O)N(C)C1CC(NCC#Cc2cccc(Cl)c2)C1	ZINC001755860184	1440936526	/nfs/dbraw/zinc/93/65/26/1440936526.db2.gz	VDCPDVUYTMWOJI-UHFFFAOYSA-N	0	3	344.886	3.483	20	30		EGEDHN
C=CCNCc1ccc(CNC(=O)Cc2cccc(F)c2F)c(F)c1	ZINC001755902228	1440944267	/nfs/dbraw/zinc/94/42/67/1440944267.db2.gz	PBKJBBCGKMLIKE-UHFFFAOYSA-N	0	3	348.368	3.238	20	30		EGEDHN
N#Cc1cnc2cnc(Cl)cc2c1N1CCN(C2CCCC2)CC1	ZINC001165028658	721853997	/nfs/dbraw/zinc/85/39/97/721853997.db2.gz	CYPPBXVIHZAIJF-UHFFFAOYSA-N	0	3	341.846	3.219	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)c1ccc(F)cc1[N+](=O)[O-]	ZINC000347758711	282096694	/nfs/dbraw/zinc/09/66/94/282096694.db2.gz	WPCDCDDTMPFVPA-UHFFFAOYSA-N	0	3	342.374	3.174	20	30		EGEDHN
COc1ccc(C#N)cc1CN[C@H](C)[C@H]1OCCc2sccc21	ZINC000368637589	168377313	/nfs/dbraw/zinc/37/73/13/168377313.db2.gz	YNACYRGFWLRMPE-KZULUSFZSA-N	0	3	328.437	3.420	20	30		EGEDHN
C[C@H](N[C@H]1CN(Cc2ccccc2)CC[C@@H]1CO)c1cccc(C#N)c1	ZINC000181784632	234322405	/nfs/dbraw/zinc/32/24/05/234322405.db2.gz	LJUZYHQDSZUATK-WTOYTKOKSA-N	0	3	349.478	3.092	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N1CCC(CN2CCCCC2=O)CC1	ZINC000187697045	236279615	/nfs/dbraw/zinc/27/96/15/236279615.db2.gz	ZWHPXFPOXHHIFX-MRXNPFEDSA-N	0	3	325.456	3.344	20	30		EGEDHN
C[C@H]1C[C@H](c2cccnc2)N(CCC(=O)Nc2ccc(C#N)cc2)C1	ZINC000359867966	201114625	/nfs/dbraw/zinc/11/46/25/201114625.db2.gz	HDIVNIRRQIYZCU-HNAYVOBHSA-N	0	3	334.423	3.365	20	30		EGEDHN
C=CCOCCCC(=O)Nc1ccc(N(C)C2CCN(C)CC2)cc1	ZINC000079658112	201207180	/nfs/dbraw/zinc/20/71/80/201207180.db2.gz	QYSDJHRMXILMML-UHFFFAOYSA-N	0	3	345.487	3.138	20	30		EGEDHN
C=CCN1CCC(NC(=O)CCCOc2ccc(OCC)cc2)CC1	ZINC000264451498	201210994	/nfs/dbraw/zinc/21/09/94/201210994.db2.gz	CVQNRSWCBAFUKE-UHFFFAOYSA-N	0	3	346.471	3.011	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cc(C(F)(F)F)ccc2F)CC1	ZINC000263972966	201208677	/nfs/dbraw/zinc/20/86/77/201208677.db2.gz	XZBNYGPVUWOKDT-UHFFFAOYSA-N	0	3	328.309	3.128	20	30		EGEDHN
C=CCSCCN[C@H](C)c1ccc(S(=O)(=O)C(F)F)cc1	ZINC000271499395	201245067	/nfs/dbraw/zinc/24/50/67/201245067.db2.gz	QJYKFCCGNLIIKA-LLVKDONJSA-N	0	3	335.441	3.253	20	30		EGEDHN
C#CCCN1CCN(CCCOc2cccc(C(F)(F)F)c2)CC1	ZINC000272058377	201247605	/nfs/dbraw/zinc/24/76/05/201247605.db2.gz	WCDMLXQJWDTBGV-UHFFFAOYSA-N	0	3	340.389	3.115	20	30		EGEDHN
N#Cc1ccc(CNCCCOCCOCc2ccccc2)c(F)c1	ZINC000272633887	201252188	/nfs/dbraw/zinc/25/21/88/201252188.db2.gz	YGRRQECQNPEMCR-UHFFFAOYSA-N	0	3	342.414	3.410	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H]2C[C@H](OCC)[C@@]23CCCO3)cc1OC	ZINC000273544190	201259825	/nfs/dbraw/zinc/25/98/25/201259825.db2.gz	BOHHEYLHZKKWHI-HSALFYBXSA-N	0	3	347.455	3.076	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(C)oc2C(F)(F)F)CC1	ZINC000274829480	201272092	/nfs/dbraw/zinc/27/20/92/201272092.db2.gz	QQXGEUNHFQPRIJ-UHFFFAOYSA-N	0	3	330.350	3.377	20	30		EGEDHN
C=C(C)COc1cc(CNCC2(C(=O)NCC)CCC2)ccc1OC	ZINC000277464778	201301778	/nfs/dbraw/zinc/30/17/78/201301778.db2.gz	RBMRILLLXQCDHM-UHFFFAOYSA-N	0	3	346.471	3.046	20	30		EGEDHN
C#CCN1CCC(C(=O)NCC2(c3ccc(C)c(C)c3)CCC2)CC1	ZINC000279019221	201314452	/nfs/dbraw/zinc/31/44/52/201314452.db2.gz	AJSDKOFXQSZUSR-UHFFFAOYSA-N	0	3	338.495	3.187	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H]1C[C@H](C)N(C2CC2)C1	ZINC000127507053	205102999	/nfs/dbraw/zinc/10/29/99/205102999.db2.gz	UTBFBGSKIYPOPR-YJBOKZPZSA-N	0	3	340.471	3.105	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN2CC[C@]3(C2)CCc2ccccc2O3)cc1	ZINC000377657920	169056193	/nfs/dbraw/zinc/05/61/93/169056193.db2.gz	IRRVDCFYOUFLIY-FPOVZHCZSA-N	0	3	334.419	3.061	20	30		EGEDHN
COC(=O)[C@@H](CCNC1(c2cccc(C#N)c2)CC1)c1ccccc1	ZINC000425458913	269702944	/nfs/dbraw/zinc/70/29/44/269702944.db2.gz	NSIKEFSAOAXYSG-IBGZPJMESA-N	0	3	334.419	3.484	20	30		EGEDHN
COCCO[C@H]1CCN(Cc2ccc(-c3ccccc3C#N)cc2)C1	ZINC000189727221	533200556	/nfs/dbraw/zinc/20/05/56/533200556.db2.gz	BTHURQNFQANXGY-FQEVSTJZSA-N	0	3	336.435	3.463	20	30		EGEDHN
Cc1cc(CN2CCSCC2)ccc1NCc1cc(C#N)n(C)c1	ZINC000191418632	533620381	/nfs/dbraw/zinc/62/03/81/533620381.db2.gz	UKAUWDNEABDSIU-UHFFFAOYSA-N	0	3	340.496	3.366	20	30		EGEDHN
N#Cc1ccc(CN2CCN(c3ccnc4ccccc43)CC2)cc1	ZINC000346623971	141206335	/nfs/dbraw/zinc/20/63/35/141206335.db2.gz	GNUHKCYUKNLLCG-UHFFFAOYSA-N	0	3	328.419	3.429	20	30		EGEDHN
COCC[C@H](NCCC(=O)Nc1cccc(C#N)c1)c1ccc(C)o1	ZINC000348141539	141237610	/nfs/dbraw/zinc/23/76/10/141237610.db2.gz	DLVHDPWVSRRKBF-KRWDZBQOSA-N	0	3	341.411	3.156	20	30		EGEDHN
CS[C@H]1CN(c2ccc(C(F)(F)F)c(C#N)c2)C[C@H]1N(C)C	ZINC000361704079	144352097	/nfs/dbraw/zinc/35/20/97/144352097.db2.gz	FLHBBUWQTWRNOC-KGLIPLIRSA-N	0	3	329.391	3.059	20	30		EGEDHN
C[C@@H]1CC=CC[C@@H]1C(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000341146472	155189058	/nfs/dbraw/zinc/18/90/58/155189058.db2.gz	LAGSXYQTRNRIIH-APWZRJJASA-N	0	3	325.456	3.051	20	30		EGEDHN
N#Cc1ccccc1CSCCNCc1c[nH]nc1-c1cccnc1	ZINC000194360145	153331404	/nfs/dbraw/zinc/33/14/04/153331404.db2.gz	RWLWDOXDXDZGBV-UHFFFAOYSA-N	0	3	349.463	3.366	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2cccc(C#N)c2)C1	ZINC000338331314	163212888	/nfs/dbraw/zinc/21/28/88/163212888.db2.gz	WHRCHIIBEIFKFF-OXJNMPFZSA-N	0	3	348.450	3.193	20	30		EGEDHN
CS[C@@H]1CN(c2ccc(C#N)cc2C(F)(F)F)C[C@@H]1N(C)C	ZINC000340735515	163657107	/nfs/dbraw/zinc/65/71/07/163657107.db2.gz	ATYWPQIFUCSCEF-UONOGXRCSA-N	0	3	329.391	3.059	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@H](NCc3ccc(Cl)cc3)C2=O)cc1	ZINC000351916666	165149142	/nfs/dbraw/zinc/14/91/42/165149142.db2.gz	FOYRMYCRLQLVCD-SFHVURJKSA-N	0	3	339.826	3.497	20	30		EGEDHN
COc1cccc(C2(NCCC(=O)Nc3sccc3C#N)CC2)c1	ZINC000352194859	165279217	/nfs/dbraw/zinc/27/92/17/165279217.db2.gz	MFBBSHRWUJKHBB-UHFFFAOYSA-N	0	3	341.436	3.236	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)NC[C@@H](C)N1CCC[C@H](C)C1	ZINC000352394925	165380560	/nfs/dbraw/zinc/38/05/60/165380560.db2.gz	WTVNQYCLGCVNNS-LSDHHAIUSA-N	0	3	344.459	3.199	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)NC[C@H](C)N1CCCC[C@H]1C	ZINC000352400084	165381589	/nfs/dbraw/zinc/38/15/89/165381589.db2.gz	BJGQLRBIVCJSDE-CABCVRRESA-N	0	3	344.459	3.341	20	30		EGEDHN
N#Cc1cccc(OCCCN2CC3(CCC3)[C@H]2[C@@H]2CCCO2)c1	ZINC000352423410	165394551	/nfs/dbraw/zinc/39/45/51/165394551.db2.gz	NXGMUMPESDTGRN-RBUKOAKNSA-N	0	3	326.440	3.361	20	30		EGEDHN
CN(Cc1cccc(OCc2ccccc2C#N)c1)CC1(O)CCC1	ZINC000355371805	166178100	/nfs/dbraw/zinc/17/81/00/166178100.db2.gz	OVZVURCSVUVGEV-UHFFFAOYSA-N	0	3	336.435	3.484	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)CCCC(F)(F)F	ZINC000356026175	166379648	/nfs/dbraw/zinc/37/96/48/166379648.db2.gz	SYYRWGPMFUODQH-UHFFFAOYSA-N	0	3	341.377	3.181	20	30		EGEDHN
CN(C)[C@@]1(CNc2c(C#N)cnc3ccc(Cl)cc32)CCSC1	ZINC000359013529	167037326	/nfs/dbraw/zinc/03/73/26/167037326.db2.gz	IRUIVAPDURDXKN-QGZVFWFLSA-N	0	3	346.887	3.031	20	30		EGEDHN
C[C@@H]1[C@H](NC(=O)Nc2ccc(C#N)cc2)CCN1Cc1ccccc1	ZINC000359021707	167041119	/nfs/dbraw/zinc/04/11/19/167041119.db2.gz	UFCOVUHVKMPQNS-DNVCBOLYSA-N	0	3	334.423	3.343	20	30		EGEDHN
C[C@@H](C(=O)NCCCN(C)Cc1ccccc1)c1cccc(C#N)c1	ZINC000359853711	167249402	/nfs/dbraw/zinc/24/94/02/167249402.db2.gz	TZFHLRLTZCCKOF-QGZVFWFLSA-N	0	3	335.451	3.300	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)N1C[C@@H]2CCN(Cc3ccccc3)C[C@H]2C1	ZINC000365728738	168039389	/nfs/dbraw/zinc/03/93/89/168039389.db2.gz	WADSPTPFXSYZHM-ROUUACIJSA-N	0	3	349.434	3.054	20	30		EGEDHN
COc1cc(CN[C@H]2CCC[C@@H]2NC(=O)OC(C)(C)C)ccc1C#N	ZINC000497025387	269769783	/nfs/dbraw/zinc/76/97/83/269769783.db2.gz	KOLFBMGEQVVWOA-HOTGVXAUSA-N	0	3	345.443	3.102	20	30		EGEDHN
CSc1ccc([C@@H](CNC(=O)c2ccc(C#N)cc2)N(C)C)cc1	ZINC000294401976	270042401	/nfs/dbraw/zinc/04/24/01/270042401.db2.gz	MLAWVQKMJLGRKH-GOSISDBHSA-N	0	3	339.464	3.313	20	30		EGEDHN
CN(C)CCOc1cc(CNc2c(C#N)cnc3ccccc32)ccn1	ZINC000301889940	270044447	/nfs/dbraw/zinc/04/44/47/270044447.db2.gz	QTSUMHZWLNLOSS-UHFFFAOYSA-N	0	3	347.422	3.054	20	30		EGEDHN
CC(C)Oc1cccc(CN2CC[C@@H](Oc3ccc(C#N)cn3)C2)c1	ZINC000428813848	270050304	/nfs/dbraw/zinc/05/03/04/270050304.db2.gz	FJSPTLSZLYHHIY-LJQANCHMSA-N	0	3	337.423	3.394	20	30		EGEDHN
CCCN(CC(=O)NCc1cccc(C#N)c1)CC1CCCCC1	ZINC000497733092	270058869	/nfs/dbraw/zinc/05/88/69/270058869.db2.gz	XJPYXVYGNJBYDC-UHFFFAOYSA-N	0	3	327.472	3.467	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)C[C@H](O)COCc1cccs1	ZINC000298581332	266051410	/nfs/dbraw/zinc/05/14/10/266051410.db2.gz	UXXTYRKZIHGSLX-SFHVURJKSA-N	0	3	344.480	3.409	20	30		EGEDHN
CCS[C@@H]1CCC[C@@H]1NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000280499905	266346458	/nfs/dbraw/zinc/34/64/58/266346458.db2.gz	QTPTXUSJJMDNTJ-YESZJQIVSA-N	0	3	327.453	3.031	20	30		EGEDHN
CC(C)(Cc1ccc(C#N)cc1)C(=O)N1CCC[C@@H](N2CCCC2)C1	ZINC000455515950	266884626	/nfs/dbraw/zinc/88/46/26/266884626.db2.gz	GZGLBIGLBKYGAA-LJQANCHMSA-N	0	3	339.483	3.214	20	30		EGEDHN
C[C@@H]1CC[C@H](CC(=O)N(CCN(C)C)Cc2cccc(C#N)c2)C1	ZINC000177688990	267029455	/nfs/dbraw/zinc/02/94/55/267029455.db2.gz	SFLLSMIIKRSRMV-SJORKVTESA-N	0	3	327.472	3.275	20	30		EGEDHN
C[C@@H]1CN(CCCCNc2nc3c(cc2C#N)CCCC3)C[C@H](C)O1	ZINC000301901104	267050385	/nfs/dbraw/zinc/05/03/85/267050385.db2.gz	VISTYBURNZFTGB-IYBDPMFKSA-N	0	3	342.487	3.133	20	30		EGEDHN
C[C@@H]1C[C@H](Nc2cc(C#N)c3cc([N+](=O)[O-])ccc3n2)CN1C1CC1	ZINC000302702870	267091670	/nfs/dbraw/zinc/09/16/70/267091670.db2.gz	XTKHVBCQCYXERO-YPMHNXCESA-N	0	3	337.383	3.052	20	30		EGEDHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)c1cc(C#N)ccc1Cl	ZINC000285912211	267155625	/nfs/dbraw/zinc/15/56/25/267155625.db2.gz	VXKPPWPWDHUMDW-CQSZACIVSA-N	0	3	341.842	3.462	20	30		EGEDHN
C[C@H](NC(=O)C1C[C@@H](c2ccccc2)OC1=O)c1ccc(C#N)cc1	ZINC000289223158	267177129	/nfs/dbraw/zinc/17/71/29/267177129.db2.gz	JLORIFHVLAXIOG-KKXDTOCCSA-N	0	3	334.375	3.040	20	30		EGEDHN
CCS[C@@H]1CCCC[C@@H]1N[C@@H]1CCN(c2ccc(C#N)cc2)C1=O	ZINC000411564014	267180314	/nfs/dbraw/zinc/18/03/14/267180314.db2.gz	VOCOOCKJLDIDRU-RCCFBDPRSA-N	0	3	343.496	3.317	20	30		EGEDHN
CC[C@@H](N[C@@H](C)C(=O)NCCc1ccccc1)c1ccc(C#N)cc1	ZINC000453347514	267195660	/nfs/dbraw/zinc/19/56/60/267195660.db2.gz	NYTVAFZMBOJMNW-OXJNMPFZSA-N	0	3	335.451	3.346	20	30		EGEDHN
CC[C@@H](N[C@@H]1CC(=O)N(c2cccc(OC)c2)C1)c1ccc(C#N)cc1	ZINC000521536260	267195872	/nfs/dbraw/zinc/19/58/72/267195872.db2.gz	OABGXSLRXNFOMS-YLJYHZDGSA-N	0	3	349.434	3.413	20	30		EGEDHN
CC[C@@H]1CCCCN1CCNC(=O)C(C)(C)c1cc(F)cc(C#N)c1	ZINC000512263950	267200882	/nfs/dbraw/zinc/20/08/82/267200882.db2.gz	XQDGLQMHSWFNLC-GOSISDBHSA-N	0	3	345.462	3.356	20	30		EGEDHN
CC[C@H](CN[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O)c1ccccc1	ZINC000488556673	267212892	/nfs/dbraw/zinc/21/28/92/267212892.db2.gz	JVBAUUNUPMXIHJ-CTNGQTDRSA-N	0	3	347.462	3.443	20	30		EGEDHN
CC[C@]1(O)CCN(Cc2cccc(OCc3ccccc3C#N)c2)C1	ZINC000428424381	267242010	/nfs/dbraw/zinc/24/20/10/267242010.db2.gz	TVMMPWLXKGTGJE-NRFANRHFSA-N	0	3	336.435	3.484	20	30		EGEDHN
CCc1cc(N2CCC(C(=O)Nc3cccc(C#N)c3)CC2)ccn1	ZINC000450292725	267246043	/nfs/dbraw/zinc/24/60/43/267246043.db2.gz	IQCVNSQNSRLFNK-UHFFFAOYSA-N	0	3	334.423	3.371	20	30		EGEDHN
CN(C)C[C@@H]1CCc2ccccc2N1C(=O)Cc1cccc(C#N)c1	ZINC000520571691	267282502	/nfs/dbraw/zinc/28/25/02/267282502.db2.gz	FOZOSMQUBXPCDU-IBGZPJMESA-N	0	3	333.435	3.010	20	30		EGEDHN
CN(C)Cc1ccc(NC(=O)c2cc(C#N)cc(N(C)C)c2)c(F)c1	ZINC000412567374	267284453	/nfs/dbraw/zinc/28/44/53/267284453.db2.gz	CTEFDONSALDACV-UHFFFAOYSA-N	0	3	340.402	3.077	20	30		EGEDHN
CN(C)Cc1ccccc1C(=O)N[C@@H]1CCCc2cc(C#N)ccc21	ZINC000416338123	267284500	/nfs/dbraw/zinc/28/45/00/267284500.db2.gz	CJGNVKRIHXVONK-HXUWFJFHSA-N	0	3	333.435	3.427	20	30		EGEDHN
CN(CC(=O)NCc1ccc(C#N)cc1)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000459667451	267297982	/nfs/dbraw/zinc/29/79/82/267297982.db2.gz	ARJMGSLJTRIIJS-RTWAWAEBSA-N	0	3	347.462	3.443	20	30		EGEDHN
CN(C[C@H]1CCCN1C)C(=O)c1ccccc1-c1ccccc1C#N	ZINC000421706806	267310128	/nfs/dbraw/zinc/31/01/28/267310128.db2.gz	VSAAOWQKPQBBBS-QGZVFWFLSA-N	0	3	333.435	3.391	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)Cc1ccc(CN2CCOCC2)cc1	ZINC000420899474	267315206	/nfs/dbraw/zinc/31/52/06/267315206.db2.gz	HBPZWHBCCDNTCN-UHFFFAOYSA-N	0	3	335.451	3.022	20	30		EGEDHN
CN1CCCC(C)(C)[C@@H]1CNC(=O)Nc1cc(C#N)cn1C(C)(C)C	ZINC000447893668	267334011	/nfs/dbraw/zinc/33/40/11/267334011.db2.gz	PCKUBZWMBTUXBI-HNNXBMFYSA-N	0	3	345.491	3.357	20	30		EGEDHN
Cc1cc(N2CC[C@H](N3CC=CC3)C2)n2c3ccccc3nc2c1C#N	ZINC000301436893	267340767	/nfs/dbraw/zinc/34/07/67/267340767.db2.gz	HOEOZRJLXBPTFZ-INIZCTEOSA-N	0	3	343.434	3.118	20	30		EGEDHN
COC(=O)c1cc(CN[C@@H]2CCCc3cc(C#N)ccc32)n(C)c1C	ZINC000418140895	267399888	/nfs/dbraw/zinc/39/98/88/267399888.db2.gz	GDRJLCPEUIQTDY-LJQANCHMSA-N	0	3	337.423	3.159	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)N(C)C[C@H]1CCN(Cc2ccccc2)C1	ZINC000280559829	267714396	/nfs/dbraw/zinc/71/43/96/267714396.db2.gz	FQCSAVURWMILKU-QGZVFWFLSA-N	0	3	337.423	3.054	20	30		EGEDHN
Cc1ccc([C@@H](CNC(=O)Nc2ccc(F)cc2C#N)N(C)C)cc1	ZINC000435166042	268044089	/nfs/dbraw/zinc/04/40/89/268044089.db2.gz	PJSDISLGSCFAGM-GOSISDBHSA-N	0	3	340.402	3.430	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@@H]2CCc3cc(F)ccc32)cc1	ZINC000279395048	268092248	/nfs/dbraw/zinc/09/22/48/268092248.db2.gz	UPNMBGSYMDEBED-VQIMIIECSA-N	0	3	333.366	3.183	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@@H]2[C@H]3CCc4ccccc4[C@@H]23)cc1	ZINC000281445194	268092349	/nfs/dbraw/zinc/09/23/49/268092349.db2.gz	FJSXWOHRMDAHKY-GFOJFJKKSA-N	0	3	341.414	3.085	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCN(Cc3ccc4ncccc4c3)C2)nc1	ZINC000292047846	268183741	/nfs/dbraw/zinc/18/37/41/268183741.db2.gz	BAEJWQBAQOUXGZ-GOSISDBHSA-N	0	3	330.391	3.155	20	30		EGEDHN
N#Cc1ccc(CN2CCN(C3CCCC3)CC2)c(Br)c1	ZINC000480702647	268221338	/nfs/dbraw/zinc/22/13/38/268221338.db2.gz	NDZNIYUPTRZXNV-UHFFFAOYSA-N	0	3	348.288	3.381	20	30		EGEDHN
N#Cc1ccc(CNC(=O)CN(Cc2ccccc2)CC2CCC2)cc1	ZINC000519903874	268226570	/nfs/dbraw/zinc/22/65/70/268226570.db2.gz	FGNNPVNRMCZNHB-UHFFFAOYSA-N	0	3	347.462	3.477	20	30		EGEDHN
N#Cc1ccc(CNCCOc2cccc(C(F)(F)F)n2)cc1F	ZINC000421324188	268232065	/nfs/dbraw/zinc/23/20/65/268232065.db2.gz	BMCIHFGGJYAWJN-UHFFFAOYSA-N	0	3	339.292	3.280	20	30		EGEDHN
N#Cc1cccc(C2(NC[C@@H](O)Cc3cccc(Cl)c3)CC2)c1	ZINC000287674725	268240988	/nfs/dbraw/zinc/24/09/88/268240988.db2.gz	HUXYLXDFCVSMOI-SFHVURJKSA-N	0	3	326.827	3.394	20	30		EGEDHN
CC(C)OC1CC(N2CCC(Oc3ccc(C#N)cc3F)CC2)C1	ZINC000459478947	269621880	/nfs/dbraw/zinc/62/18/80/269621880.db2.gz	HQDQUJFQVCMUKV-UHFFFAOYSA-N	0	3	332.419	3.497	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H]2CCCOc3cc(Cl)ccc32)CC1	ZINC000179629840	275382250	/nfs/dbraw/zinc/38/22/50/275382250.db2.gz	KYBKLARMWWMRGZ-QGZVFWFLSA-N	0	3	346.858	3.015	20	30		EGEDHN
COc1cccc(CCNCc2ccc(C#N)cc2C(F)(F)F)n1	ZINC000352837083	278009431	/nfs/dbraw/zinc/00/94/31/278009431.db2.gz	LHNTWJWHSHNZPR-UHFFFAOYSA-N	0	3	335.329	3.313	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)N(C)CCN(C)C1CC1	ZINC000347064270	280261289	/nfs/dbraw/zinc/26/12/89/280261289.db2.gz	GETJZHKIDXXRNX-UHFFFAOYSA-N	0	3	327.453	3.248	20	30		EGEDHN
C[C@H](N[C@H]1CN(Cc2ccccc2)CC[C@H]1CO)c1cccc(C#N)c1	ZINC000245885479	290059185	/nfs/dbraw/zinc/05/91/85/290059185.db2.gz	LJUZYHQDSZUATK-HSQYWUDLSA-N	0	3	349.478	3.092	20	30		EGEDHN
COc1ccc(CCN2CCCN(Cc3ccc(C#N)cc3)CC2)cc1	ZINC000055172682	307339930	/nfs/dbraw/zinc/33/99/30/307339930.db2.gz	GTOCLNURZZHDDH-UHFFFAOYSA-N	0	3	349.478	3.317	20	30		EGEDHN
COCCN(CCC(=O)Nc1ccccc1C#N)Cc1ccccc1	ZINC000074021090	307390202	/nfs/dbraw/zinc/39/02/02/307390202.db2.gz	KGONZYUHHCJBAH-UHFFFAOYSA-N	0	3	337.423	3.035	20	30		EGEDHN
CC[C@H](NCc1cccc(C#N)c1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000153641279	307777598	/nfs/dbraw/zinc/77/75/98/307777598.db2.gz	YJFFXCASBYPJCS-FCHUYYIVSA-N	0	3	349.478	3.327	20	30		EGEDHN
CCN(C[C@@H](O)COCc1ccco1)[C@H](C)c1ccc(C#N)cc1	ZINC000249749099	308027863	/nfs/dbraw/zinc/02/78/63/308027863.db2.gz	PRAIWGFBDZGIEW-CRAIPNDOSA-N	0	3	328.412	3.112	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN(C2CC2)[C@@H]2CCc3ccccc32)cc1	ZINC000250154699	308029660	/nfs/dbraw/zinc/02/96/60/308029660.db2.gz	NMVDQJGVZGHGCU-DENIHFKCSA-N	0	3	348.446	3.450	20	30		EGEDHN
CC[C@@H](CN1CCN(c2nccnc2C#N)C[C@H]1C)c1ccccc1	ZINC000537704755	314204716	/nfs/dbraw/zinc/20/47/16/314204716.db2.gz	CDYAGAUDIXTRFK-SJORKVTESA-N	0	3	335.455	3.053	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](CO)Cc2c(F)cccc2Cl)s1	ZINC000538410689	314245240	/nfs/dbraw/zinc/24/52/40/314245240.db2.gz	GRQNGDCFRIRYNG-NSHDSACASA-N	0	3	338.835	3.353	20	30		EGEDHN
CC[C@@H](N[C@@H]1CCCN(c2ccc(C#N)cc2F)C1)c1ccn(C)n1	ZINC000541734833	314483425	/nfs/dbraw/zinc/48/34/25/314483425.db2.gz	NVEPYCBQBSJECI-NVXWUHKLSA-N	0	3	341.434	3.141	20	30		EGEDHN
CN(CCCOc1cccc(C#N)c1)CCc1cccc([N+](=O)[O-])c1	ZINC000549170954	315079489	/nfs/dbraw/zinc/07/94/89/315079489.db2.gz	LQJYCJHSFKIKJR-UHFFFAOYSA-N	0	3	339.395	3.410	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)N(C)[C@@H]1CCN(C)C[C@H]1C	ZINC000551409244	315153016	/nfs/dbraw/zinc/15/30/16/315153016.db2.gz	MLDFVNDQTBFOSM-MLGOLLRUSA-N	0	3	341.480	3.494	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)c1ncc(C#N)cc1C)c1ccsc1	ZINC000555298157	315377842	/nfs/dbraw/zinc/37/78/42/315377842.db2.gz	GJRBHQKANZQHHH-MRXNPFEDSA-N	0	3	342.468	3.136	20	30		EGEDHN
C[C@@H](c1ccncc1)N1CCC(Nc2nc3ccccn3c2C#N)CC1	ZINC000564794299	316206555	/nfs/dbraw/zinc/20/65/55/316206555.db2.gz	DUVIJTZNLMFOEM-HNNXBMFYSA-N	0	3	346.438	3.238	20	30		EGEDHN
C[C@H](c1ccncc1)N1CCC(Nc2nc3ccccn3c2C#N)CC1	ZINC000564794300	316206856	/nfs/dbraw/zinc/20/68/56/316206856.db2.gz	DUVIJTZNLMFOEM-OAHLLOKOSA-N	0	3	346.438	3.238	20	30		EGEDHN
N#Cc1ccc(C2=CCN(CCC(=O)Nc3cccnc3)CC2)cc1	ZINC000565339427	316310395	/nfs/dbraw/zinc/31/03/95/316310395.db2.gz	NOTWGAJXLQAGLZ-UHFFFAOYSA-N	0	3	332.407	3.071	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](O)Cc2ccc(C(F)(F)F)cc2)s1	ZINC000566118420	316420985	/nfs/dbraw/zinc/42/09/85/316420985.db2.gz	BRKOGFLWFQRRFB-CYBMUJFWSA-N	0	3	340.370	3.332	20	30		EGEDHN
CCCCO[C@@H]1C[C@@H](N[C@H](C)C(=O)Nc2ccccc2C#N)C1(C)C	ZINC000568681311	316806743	/nfs/dbraw/zinc/80/67/43/316806743.db2.gz	CMANIBJZGAFOCS-ZTFGCOKTSA-N	0	3	343.471	3.459	20	30		EGEDHN
CS(=O)(=O)[C@@H]1CCC[C@@H](N[C@@H]2CCCCc3cc(C#N)ccc32)C1	ZINC000574858195	317643559	/nfs/dbraw/zinc/64/35/59/317643559.db2.gz	NWLLVXIWGPOEJZ-ZHALLVOQSA-N	0	3	346.496	3.271	20	30		EGEDHN
CN(CCc1ccc(Cl)cc1)C[C@@H](O)COc1ccc(C#N)cc1	ZINC000172079698	323268675	/nfs/dbraw/zinc/26/86/75/323268675.db2.gz	LNADYHMBFKBNDN-GOSISDBHSA-N	0	3	344.842	3.126	20	30		EGEDHN
CCc1nnc(NC[C@H]2CCN(Cc3ccccc3)C2)c(C#N)c1CC	ZINC000382352083	324249935	/nfs/dbraw/zinc/24/99/35/324249935.db2.gz	JVTHEJYKWLIGHS-QGZVFWFLSA-N	0	3	349.482	3.407	20	30		EGEDHN
CC[C@@H]1CCCC[C@H]1CNCCS(=O)(=O)c1ccc(C#N)cc1	ZINC000577860305	324878975	/nfs/dbraw/zinc/87/89/75/324878975.db2.gz	WCLGGJQMMLUFIR-SJORKVTESA-N	0	3	334.485	3.138	20	30		EGEDHN
COC(=O)COc1ccc([C@H](C)NCc2ccc(C#N)s2)cc1	ZINC000579001022	325048884	/nfs/dbraw/zinc/04/88/84/325048884.db2.gz	OMJOFJPGPXQKAG-LBPRGKRZSA-N	0	3	330.409	3.022	20	30		EGEDHN
CCSc1cccc(CNC[C@@H](O)COc2ccc(C#N)cc2)c1	ZINC000579113707	325064727	/nfs/dbraw/zinc/06/47/27/325064727.db2.gz	WJNPUIOGWBDQJZ-QGZVFWFLSA-N	0	3	342.464	3.200	20	30		EGEDHN
C=CCS(=O)(=O)CCN[C@H]1CCC[C@H]1c1ccccc1Cl	ZINC000368319614	458025262	/nfs/dbraw/zinc/02/52/62/458025262.db2.gz	STMYHIGJGHPSMY-HOCLYGCPSA-N	0	3	327.877	3.167	20	30		EGEDHN
CC(C)(C)[C@@H](CCO)NCC#Cc1ccc(OC(F)(F)F)cc1	ZINC000183694008	455322514	/nfs/dbraw/zinc/32/25/14/455322514.db2.gz	KSKNOORWZJTHGD-OAHLLOKOSA-N	0	3	329.362	3.323	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@H](CCO)C(C)(C)C	ZINC000181487935	455343060	/nfs/dbraw/zinc/34/30/60/455343060.db2.gz	MGRKCOOCSMRVBJ-MRXNPFEDSA-N	0	3	336.501	3.290	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@H](C)C2(CO)CC2)cc1OC	ZINC000623564195	460615621	/nfs/dbraw/zinc/61/56/21/460615621.db2.gz	VJDIJNXMGDAEQN-GFCCVEGCSA-N	0	3	325.836	3.164	20	30		EGEDHN
COc1ccc([C@H](NC(=O)C(C#N)CCc2ccccc2)C2CC2)cn1	ZINC000600811162	460612697	/nfs/dbraw/zinc/61/26/97/460612697.db2.gz	CDDPYGIKISYVRF-FXAWDEMLSA-N	0	3	349.434	3.430	20	30		EGEDHN
COc1ccc([C@@H](C/N=C/c2cccc(O)c2O)N2CCCC2)cc1	ZINC000022768421	453698071	/nfs/dbraw/zinc/69/80/71/453698071.db2.gz	CUJWIHYITPVIPB-KOMLCTQHSA-N	0	3	340.423	3.362	20	30		EGEDHN
C[C@@H]1CCCC[C@H]1CN1CCN(c2oc(C3CC3)nc2C#N)CC1	ZINC000612397681	460618626	/nfs/dbraw/zinc/61/86/26/460618626.db2.gz	XPWAKDCFMJCFKN-ZBFHGGJFSA-N	0	3	328.460	3.372	20	30		EGEDHN
C=CC1CCN(C(=O)NCC(C)(C)N2CCc3ccccc3C2)CC1	ZINC000600840761	460619733	/nfs/dbraw/zinc/61/97/33/460619733.db2.gz	ZMFYNWOJFZOBLJ-UHFFFAOYSA-N	0	3	341.499	3.431	20	30		EGEDHN
Cc1nc(C(=O)Nc2cccc(CN3CCCCC3)c2)ccc1C#N	ZINC000027142889	453812134	/nfs/dbraw/zinc/81/21/34/453812134.db2.gz	APJDKHVZKIKHSJ-UHFFFAOYSA-N	0	3	334.423	3.500	20	30		EGEDHN
COc1ccccc1NC(=O)C1CCN(Cc2cccc(C#N)c2)CC1	ZINC000029905711	453832557	/nfs/dbraw/zinc/83/25/57/453832557.db2.gz	QDGCWJHLGXXOQP-UHFFFAOYSA-N	0	3	349.434	3.418	20	30		EGEDHN
C[C@H](NC[C@@H](O)COCc1ccccc1Cl)c1ccc(C#N)cc1	ZINC000030532595	453836392	/nfs/dbraw/zinc/83/63/92/453836392.db2.gz	SCIOCXKQNQPYMY-KBXCAEBGSA-N	0	3	344.842	3.440	20	30		EGEDHN
CCOc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc(C#N)cc2)cc1	ZINC000030532884	453836427	/nfs/dbraw/zinc/83/64/27/453836427.db2.gz	RNGRSADPFMJMPU-YJBOKZPZSA-N	0	3	340.423	3.047	20	30		EGEDHN
C[C@@H](C#N)CN(C)C(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1	ZINC000052582230	453838302	/nfs/dbraw/zinc/83/83/02/453838302.db2.gz	AOGPFJFDBSQPMP-PKOBYXMFSA-N	0	3	342.487	3.261	20	30		EGEDHN
COc1ccc(C)cc1C1(CNC[C@@H](C#N)CCC#N)CCOCC1	ZINC000066484197	453848232	/nfs/dbraw/zinc/84/82/32/453848232.db2.gz	SIXKHXBAQZNYQG-QGZVFWFLSA-N	0	3	341.455	3.085	20	30		EGEDHN
N#CCC[C@H](C#N)CNCC1(c2ccc(Cl)cc2)CCOCC1	ZINC000066484190	453848250	/nfs/dbraw/zinc/84/82/50/453848250.db2.gz	STMOORLNAXSIPK-OAHLLOKOSA-N	0	3	331.847	3.421	20	30		EGEDHN
N#Cc1ccc(CCC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)cc1	ZINC000031564905	453849312	/nfs/dbraw/zinc/84/93/12/453849312.db2.gz	ALPLHYOUTLZZGI-OAQYLSRUSA-N	0	3	347.462	3.272	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/C[C@H](O)c2ccc(OC)cc2)c([O-])c1	ZINC000032069246	453862978	/nfs/dbraw/zinc/86/29/78/453862978.db2.gz	NFJNRFXDRUZEJS-DZSVRRGNSA-N	0	3	342.439	3.400	20	30		EGEDHN
CC(C)(C)CCN1CCN(C(=O)[C@@H]2C[C@H]2c2cccc(C#N)c2)CC1	ZINC000081581376	453891299	/nfs/dbraw/zinc/89/12/99/453891299.db2.gz	PKNCTILMJFAKNI-RBUKOAKNSA-N	0	3	339.483	3.242	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1)C(=O)CCc1ccc(C#N)cc1	ZINC000053690952	453892790	/nfs/dbraw/zinc/89/27/90/453892790.db2.gz	PCLUJITZHDYPGP-UHFFFAOYSA-N	0	3	335.451	3.081	20	30		EGEDHN
Cc1cc(NC(=O)C(C)(C)C#N)cc(N2CCN(C(C)C)CC2)c1	ZINC000190804062	455385034	/nfs/dbraw/zinc/38/50/34/455385034.db2.gz	GSYFHEXUYXCXNN-UHFFFAOYSA-N	0	3	328.460	3.014	20	30		EGEDHN
C[C@H](NCc1ccc(N2CCOCC2)c(F)c1)c1cccc(C#N)c1	ZINC000174429906	455391008	/nfs/dbraw/zinc/39/10/08/455391008.db2.gz	YGTBZZNVDFYYQP-HNNXBMFYSA-N	0	3	339.414	3.385	20	30		EGEDHN
N#CC(C(=O)c1cccc([N+](=O)[O-])c1)c1ccc(C(F)(F)F)cn1	ZINC000041555719	453971736	/nfs/dbraw/zinc/97/17/36/453971736.db2.gz	QOAFSSJRTGATPL-LBPRGKRZSA-N	0	3	335.241	3.499	20	30		EGEDHN
Cc1c(C(=O)C(C#N)c2cc(C)nc(C)n2)cnn1-c1ccccc1F	ZINC000041560768	453972464	/nfs/dbraw/zinc/97/24/64/453972464.db2.gz	MXGSBGWOJHNBBA-AWEZNQCLSA-N	0	3	349.369	3.217	20	30		EGEDHN
N#Cc1ccc(OCCN2CCC([C@@H](O)c3ccccc3)CC2)cc1	ZINC000042634780	454016947	/nfs/dbraw/zinc/01/69/47/454016947.db2.gz	CUKPKFVNBZPCJA-NRFANRHFSA-N	0	3	336.435	3.383	20	30		EGEDHN
C[C@H]1CN(Cc2ccc(C#N)cc2)CC[C@H]1NC(=O)OC(C)(C)C	ZINC000265884945	455399672	/nfs/dbraw/zinc/39/96/72/455399672.db2.gz	ZVFXLQWSSKPAIE-WMLDXEAASA-N	0	3	329.444	3.293	20	30		EGEDHN
N#Cc1ccc(NC2CCN([C@H]3CCOC3)CC2)cc1C(F)(F)F	ZINC000089603314	454166958	/nfs/dbraw/zinc/16/69/58/454166958.db2.gz	PFCAXPPVMPSINF-HNNXBMFYSA-N	0	3	339.361	3.242	20	30		EGEDHN
CC[C@@H]1CCCN(C(C)(C)CNC(=O)c2c(F)cc(C#N)cc2F)C1	ZINC000095410144	454204841	/nfs/dbraw/zinc/20/48/41/454204841.db2.gz	XRXYSQQXQXWWRH-CYBMUJFWSA-N	0	3	349.425	3.467	20	30		EGEDHN
CC(C)Oc1cncc(C(=O)C(C#N)c2nc3ccccc3n2C)c1	ZINC000119583172	454206549	/nfs/dbraw/zinc/20/65/49/454206549.db2.gz	FUOIPCCPXQPTMD-OAHLLOKOSA-N	0	3	334.379	3.246	20	30		EGEDHN
CC(C)Oc1cncc(C(=O)C(C#N)c2nc3ccccc3n2C)c1	ZINC000119583324	454206592	/nfs/dbraw/zinc/20/65/92/454206592.db2.gz	FUOIPCCPXQPTMD-HNNXBMFYSA-N	0	3	334.379	3.246	20	30		EGEDHN
C[C@@H](C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1)c1ccccc1	ZINC000119809711	454222083	/nfs/dbraw/zinc/22/20/83/454222083.db2.gz	FVIWWVQAVSYXHQ-QGZVFWFLSA-N	0	3	335.451	3.252	20	30		EGEDHN
CCN(Cc1cccs1)C[C@@H](O)COc1ccc(CC#N)cc1	ZINC000078395644	454247647	/nfs/dbraw/zinc/24/76/47/454247647.db2.gz	GRDVFVJQHJNFMG-MRXNPFEDSA-N	0	3	330.453	3.076	20	30		EGEDHN
Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@@H]1N2C(=O)c1ccc(C#N)c(C)n1	ZINC000078430215	454252546	/nfs/dbraw/zinc/25/25/46/454252546.db2.gz	WULFZCCJXOELLZ-PXNSSMCTSA-N	0	3	346.434	3.018	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H](CC)C(C)(C)c2ccccc2)CC1	ZINC000120346069	454289302	/nfs/dbraw/zinc/28/93/02/454289302.db2.gz	YPNWZXVZQCCWET-IBGZPJMESA-N	0	3	326.484	3.204	20	30		EGEDHN
Cc1cccc([C@H]2CCCN2CCC(=O)Nc2sccc2C#N)n1	ZINC000160162570	455433740	/nfs/dbraw/zinc/43/37/40/455433740.db2.gz	JDEYZJKOMLRCPT-MRXNPFEDSA-N	0	3	340.452	3.489	20	30		EGEDHN
Cc1ccc([C@@H](C)N(C)C[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000061255889	454334500	/nfs/dbraw/zinc/33/45/00/454334500.db2.gz	JCHQSKIBSKNAHB-YLJYHZDGSA-N	0	3	338.451	3.494	20	30		EGEDHN
C[C@@H](O)[C@H](C)SCC(=O)C(C#N)c1nc(-c2ccccc2)cs1	ZINC000079064872	454362877	/nfs/dbraw/zinc/36/28/77/454362877.db2.gz	CBPPLTXCWJGWJC-MBNYWOFBSA-N	0	3	346.477	3.489	20	30		EGEDHN
CC(C)CCCNC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000079250337	454386476	/nfs/dbraw/zinc/38/64/76/454386476.db2.gz	HEDARHODKIUDQV-UHFFFAOYSA-N	0	3	330.476	3.068	20	30		EGEDHN
Cc1ccc(CN(CCN(C)C)C(=O)/C=C/c2ccc(C#N)cc2)o1	ZINC000063497867	454419109	/nfs/dbraw/zinc/41/91/09/454419109.db2.gz	LSPVTPWFFQKYMP-PKNBQFBNSA-N	0	3	337.423	3.063	20	30		EGEDHN
C[C@H]1CN(CC2CCN(c3c(F)cc(C#N)cc3F)CC2)C[C@H](C)O1	ZINC000091478106	454440334	/nfs/dbraw/zinc/44/03/34/454440334.db2.gz	JPADWSTVOZAKCL-KBPBESRZSA-N	0	3	349.425	3.162	20	30		EGEDHN
N#CC1(NC(=O)CN[C@H]2CCC[C@@H]2c2ccccc2)CCCCC1	ZINC000133586226	454442278	/nfs/dbraw/zinc/44/22/78/454442278.db2.gz	RBGTUJFWJOVZRI-MSOLQXFVSA-N	0	3	325.456	3.255	20	30		EGEDHN
CN1CCC(N(Cc2ccco2)C(=O)/C=C/c2ccccc2C#N)CC1	ZINC000073573967	454453210	/nfs/dbraw/zinc/45/32/10/454453210.db2.gz	IIBMCEPNARRBJY-CMDGGOBGSA-N	0	3	349.434	3.287	20	30		EGEDHN
CS[C@@H](C)C(=O)C(C#N)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000100819220	454467904	/nfs/dbraw/zinc/46/79/04/454467904.db2.gz	FIQAVPGWTHTJHJ-WRWORJQWSA-N	0	3	331.224	3.392	20	30		EGEDHN
C=CCNC(=O)Nc1ccc(NC(=O)[C@H](C)N2[C@@H](C)CC[C@@H]2C)cc1	ZINC000101635362	454478070	/nfs/dbraw/zinc/47/80/70/454478070.db2.gz	WUGJMSCMQGNJHU-KKUMJFAQSA-N	0	3	344.459	3.194	20	30		EGEDHN
COc1ccc(C#N)cc1NC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000064533341	454489456	/nfs/dbraw/zinc/48/94/56/454489456.db2.gz	CFFSJCZWMWXFMC-UHFFFAOYSA-N	0	3	349.434	3.418	20	30		EGEDHN
COc1cc(CN(CCOc2ccc(C#N)cc2)C2CC2)ccc1O	ZINC000102175921	454495520	/nfs/dbraw/zinc/49/55/20/454495520.db2.gz	YBZGTLLGNRLVSD-UHFFFAOYSA-N	0	3	338.407	3.316	20	30		EGEDHN
C[C@H](CNC(=O)N[C@H](C)c1cccc(C#N)c1)N1CCC(C)CC1	ZINC000073897913	454499123	/nfs/dbraw/zinc/49/91/23/454499123.db2.gz	GUERIKXWLSGRPV-HZPDHXFCSA-N	0	3	328.460	3.039	20	30		EGEDHN
C=CCc1cc(CN2CCC[C@H](c3ncc[nH]3)C2)cc(OC)c1O	ZINC000092072144	454515573	/nfs/dbraw/zinc/51/55/73/454515573.db2.gz	AUXXNAOMDPNMFN-INIZCTEOSA-N	0	3	327.428	3.232	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNc1ccc2nnc(C3CC3)n2n1)C(C)C	ZINC000102822560	454521760	/nfs/dbraw/zinc/52/17/60/454521760.db2.gz	OGFQKFSPKLYVQJ-MRXNPFEDSA-N	0	3	340.475	3.112	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(OC3CCC3)cc2)CC1	ZINC000080079925	454529540	/nfs/dbraw/zinc/52/95/40/454529540.db2.gz	ZCBCRMIPUASPEN-UHFFFAOYSA-N	0	3	328.456	3.388	20	30		EGEDHN
C[C@@H](CNC(=O)N[C@@H](C)c1ccc(C#N)cc1)N1CCCC[C@H]1C	ZINC000049193669	454538895	/nfs/dbraw/zinc/53/88/95/454538895.db2.gz	VYVRMHHCROVXQW-PMPSAXMXSA-N	0	3	328.460	3.181	20	30		EGEDHN
CCN(C(=O)c1ccc(C#N)[nH]1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1	ZINC000160384437	455452980	/nfs/dbraw/zinc/45/29/80/455452980.db2.gz	WTEYOQQYTBONND-MAUKXSAKSA-N	0	3	336.439	3.184	20	30		EGEDHN
C=CCc1cc(CN[C@H](COC)Cc2ccccc2)cc(OC)c1O	ZINC000080244320	454554649	/nfs/dbraw/zinc/55/46/49/454554649.db2.gz	HUULPGIZWWZEEV-IBGZPJMESA-N	0	3	341.451	3.477	20	30		EGEDHN
C=CCNC(=O)NC(=O)[C@H](C)N[C@H](C)c1ccc(SC(C)C)cc1	ZINC000103499422	454561594	/nfs/dbraw/zinc/56/15/94/454561594.db2.gz	HJNGVTAKXAPROF-KGLIPLIRSA-N	0	3	349.500	3.238	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)c1ccc(OC)cc1	ZINC000103504669	454561669	/nfs/dbraw/zinc/56/16/69/454561669.db2.gz	JVDYSTAZGCMTOT-HNNXBMFYSA-N	0	3	338.363	3.055	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)CCN1Cc1ccc(C#N)cc1	ZINC000134641577	454572966	/nfs/dbraw/zinc/57/29/66/454572966.db2.gz	JBFHLCWEXSORQD-PBHICJAKSA-N	0	3	329.444	3.436	20	30		EGEDHN
C#CCOc1ccc(CN2CCC(NC(=O)c3ccccc3)CC2)cc1	ZINC000123073871	454599370	/nfs/dbraw/zinc/59/93/70/454599370.db2.gz	AOBTXSLWQYVXPK-UHFFFAOYSA-N	0	3	348.446	3.093	20	30		EGEDHN
CCCNC(=O)[C@H]1CCCN(Cc2cccc(OCCCC#N)c2)C1	ZINC000092733981	454619621	/nfs/dbraw/zinc/61/96/21/454619621.db2.gz	WCETXFYLOMPLCV-SFHVURJKSA-N	0	3	343.471	3.107	20	30		EGEDHN
CCC[C@@H](C)NC(=O)[C@H]1CCCN(Cc2ccc(OC)c(C#N)c2)C1	ZINC000135013699	454624427	/nfs/dbraw/zinc/62/44/27/454624427.db2.gz	HSUANRCILBDRGB-WBVHZDCISA-N	0	3	343.471	3.084	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CN2CCC[C@@H]2c2cccc(F)c2)cc1	ZINC000051472507	454626923	/nfs/dbraw/zinc/62/69/23/454626923.db2.gz	PFBKBXWFIWPVCF-AZUAARDMSA-N	0	3	340.398	3.274	20	30		EGEDHN
N#Cc1cccc(OCCN2CCC([C@@H](O)c3ccccc3)CC2)c1	ZINC000051531940	454628662	/nfs/dbraw/zinc/62/86/62/454628662.db2.gz	OIIHDKFUPNVUHR-NRFANRHFSA-N	0	3	336.435	3.383	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN(CCC(N)=O)Cc1ccccc1	ZINC000135109223	454634776	/nfs/dbraw/zinc/63/47/76/454634776.db2.gz	BFSKLFCHSSKHBA-UHFFFAOYSA-N	0	3	335.451	3.365	20	30		EGEDHN
N#Cc1ccsc1C(=O)N1CCCN(CC2CCCCC2)CC1	ZINC000052050264	454651858	/nfs/dbraw/zinc/65/18/58/454651858.db2.gz	OHAFCQVMLLORQW-UHFFFAOYSA-N	0	3	331.485	3.348	20	30		EGEDHN
C[C@@H]1CN(CCCCNc2ccc3cc(C#N)ccc3n2)C[C@@H](C)O1	ZINC000092920677	454654578	/nfs/dbraw/zinc/65/45/78/454654578.db2.gz	HPLLXXXJZZERNB-HZPDHXFCSA-N	0	3	338.455	3.408	20	30		EGEDHN
CCN1CCC[C@@H]1CN(Cc1ccncc1)C(=O)c1ccc(C#N)cc1	ZINC000123752536	454671842	/nfs/dbraw/zinc/67/18/42/454671842.db2.gz	HXEKYCZRNALHDY-HXUWFJFHSA-N	0	3	348.450	3.080	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)COc2ccc(Cl)c(C)c2)CC1	ZINC000106040639	454675912	/nfs/dbraw/zinc/67/59/12/454675912.db2.gz	ABRCBBATYRNUFU-UHFFFAOYSA-N	0	3	336.863	3.184	20	30		EGEDHN
C=CCCC(=O)NCCCOC1CCN(Cc2ccccc2)CC1	ZINC000176849443	454789757	/nfs/dbraw/zinc/78/97/57/454789757.db2.gz	QJGQEEGIYBCGHG-UHFFFAOYSA-N	0	3	330.472	3.140	20	30		EGEDHN
C[C@H]1CN(C[C@H](O)COc2ccc(CC#N)cc2)[C@@H]1c1ccccc1	ZINC000177073634	454819494	/nfs/dbraw/zinc/81/94/94/454819494.db2.gz	UGHWGKNRVUZVSU-LRQRDZAKSA-N	0	3	336.435	3.185	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cc(-c3ccc(Cl)s3)[nH]n2)CC1	ZINC000163146078	454825827	/nfs/dbraw/zinc/82/58/27/454825827.db2.gz	UDKDMPPAXBTRMP-UHFFFAOYSA-N	0	3	348.859	3.075	20	30		EGEDHN
C[C@@H]1CN(CCC2CCN(Cc3ccccc3C#N)CC2)C[C@H](C)O1	ZINC000177482236	454868636	/nfs/dbraw/zinc/86/86/36/454868636.db2.gz	DSHGRLYXKXIMIG-HDICACEKSA-N	0	3	341.499	3.270	20	30		EGEDHN
C=CCN1CCC(NC(=O)Cc2cccc(Cl)c2OCC)CC1	ZINC000191366331	455481377	/nfs/dbraw/zinc/48/13/77/455481377.db2.gz	INUZPJJVYXDYBJ-UHFFFAOYSA-N	0	3	336.863	3.048	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)N1CCN(C2CCCC2)CC1	ZINC000111885976	454877787	/nfs/dbraw/zinc/87/77/87/454877787.db2.gz	GWMZSWRQXDBSNN-UHFFFAOYSA-N	0	3	343.471	3.021	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN2CCC[C@@H]2CN2CCCCC2)c1C	ZINC000177595277	454881854	/nfs/dbraw/zinc/88/18/54/454881854.db2.gz	IFCIUIVTBBKURB-LJQANCHMSA-N	0	3	343.515	3.424	20	30		EGEDHN
N#CCCN(C(=O)CN1C[C@@H]2CCC[C@@H]2C1)c1cccc(Cl)c1	ZINC000154323837	454884946	/nfs/dbraw/zinc/88/49/46/454884946.db2.gz	GKEJDZCXASDYED-GASCZTMLSA-N	0	3	331.847	3.319	20	30		EGEDHN
CC[C@@H](NCC(=O)N(CCC#N)c1cccc(C)c1C)[C@@H]1CCCO1	ZINC000182329727	455490316	/nfs/dbraw/zinc/49/03/16/455490316.db2.gz	CVGQIRIDEKZCOX-MJGOQNOKSA-N	0	3	343.471	3.097	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc([N+](=O)[O-])ccc2SCC)CC1	ZINC000179229219	455022319	/nfs/dbraw/zinc/02/23/19/455022319.db2.gz	XVKORUSONXHGIX-UHFFFAOYSA-N	0	3	349.456	3.087	20	30		EGEDHN
Cc1cccc(C2(CN[C@H](C(N)=O)c3ccc(C#N)cc3)CCCC2)c1	ZINC000115599233	455022432	/nfs/dbraw/zinc/02/24/32/455022432.db2.gz	LKRSGEOAHOJVQV-FQEVSTJZSA-N	0	3	347.462	3.495	20	30		EGEDHN
COc1cc(C#N)ccc1OCCNC1(c2cccc(F)c2)CC1	ZINC000179704315	455068668	/nfs/dbraw/zinc/06/86/68/455068668.db2.gz	IVGLLXWXBHWACD-UHFFFAOYSA-N	0	3	326.371	3.364	20	30		EGEDHN
COC(=O)[C@H](C)[C@H](NCCOc1ccccc1C#N)c1ccccc1	ZINC000152136744	455077667	/nfs/dbraw/zinc/07/76/67/455077667.db2.gz	IKOQSSQMQGMLOA-BEFAXECRSA-N	0	3	338.407	3.077	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@H]2c2ccccc2OC)CC1	ZINC000171737222	455090050	/nfs/dbraw/zinc/09/00/50/455090050.db2.gz	LPBRTPOUIRIEHO-SFHVURJKSA-N	0	3	343.471	3.192	20	30		EGEDHN
Cn1cc(C[N@H+](C)Cc2ccccc2[O-])c(-c2ccc(C#N)cc2)n1	ZINC000179942702	455103590	/nfs/dbraw/zinc/10/35/90/455103590.db2.gz	GXZVUUJQUCUSFA-UHFFFAOYSA-N	0	3	332.407	3.296	20	30		EGEDHN
Cn1cc(C[N@@H+](C)Cc2ccccc2[O-])c(-c2ccc(C#N)cc2)n1	ZINC000179942702	455103594	/nfs/dbraw/zinc/10/35/94/455103594.db2.gz	GXZVUUJQUCUSFA-UHFFFAOYSA-N	0	3	332.407	3.296	20	30		EGEDHN
C[C@@H](C#N)Oc1ccccc1NC(=O)NC[C@H](C)N1CCC[C@H](C)C1	ZINC000180042947	455120895	/nfs/dbraw/zinc/12/08/95/455120895.db2.gz	WKHDEQTXJXORTJ-JYJNAYRXSA-N	0	3	344.459	3.219	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccccc2O[C@@H](C)C#N)CC1	ZINC000180073699	455126897	/nfs/dbraw/zinc/12/68/97/455126897.db2.gz	XYBWBSXPVFECGT-HNNXBMFYSA-N	0	3	342.443	3.139	20	30		EGEDHN
CCCN(CCn1cnc2ccccc2c1=O)Cc1ccc(C#N)cc1	ZINC000172244365	455138817	/nfs/dbraw/zinc/13/88/17/455138817.db2.gz	XIPUIPXZUQOMCX-UHFFFAOYSA-N	0	3	346.434	3.180	20	30		EGEDHN
FC(F)(F)Oc1ccc(C#CCN2CC[C@]3(CCOC3)C2)cc1	ZINC000156826010	455151954	/nfs/dbraw/zinc/15/19/54/455151954.db2.gz	HKLICGBLTMOERV-INIZCTEOSA-N	0	3	325.330	3.049	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccnc(O[C@H](C)CC)c2)CC1	ZINC000180287418	455155095	/nfs/dbraw/zinc/15/50/95/455155095.db2.gz	QTCAPYLWWZXVFF-OAHLLOKOSA-N	0	3	331.460	3.029	20	30		EGEDHN
CN(C)C(=O)CC1CCN(Cc2cccc(OCCCC#N)c2)CC1	ZINC000180326908	455158332	/nfs/dbraw/zinc/15/83/32/455158332.db2.gz	QLNMOGWKBQFGTE-UHFFFAOYSA-N	0	3	343.471	3.059	20	30		EGEDHN
COC[C@@H](NCC(=O)Nc1ccccc1S[C@@H](C)CC#N)C1CC1	ZINC000183433379	455292248	/nfs/dbraw/zinc/29/22/48/455292248.db2.gz	OEWYOLOZWIWNFX-XJKSGUPXSA-N	0	3	347.484	3.034	20	30		EGEDHN
CCS[C@H]1CCCC[C@@H]1NCC(=O)Nc1oc(C)c(C)c1C#N	ZINC000189512703	455211167	/nfs/dbraw/zinc/21/11/67/455211167.db2.gz	HPRFZNRYBDIKMF-GJZGRUSLSA-N	0	3	335.473	3.361	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC[C@@H]2CCCc3ccccc32)CC1	ZINC000264444880	455214161	/nfs/dbraw/zinc/21/41/61/455214161.db2.gz	XNIMSAQREUZQPH-KRWDZBQOSA-N	0	3	327.472	3.056	20	30		EGEDHN
CCCCOCCNCc1cn(CCC#N)nc1-c1ccccc1	ZINC000265001156	455298596	/nfs/dbraw/zinc/29/85/96/455298596.db2.gz	ZSDDASVGVORCFV-UHFFFAOYSA-N	0	3	326.444	3.370	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCc1ccc(CN2CCN(CC)CC2)cc1	ZINC000190572910	455346472	/nfs/dbraw/zinc/34/64/72/455346472.db2.gz	FWZYLIDKOFTOCV-NRFANRHFSA-N	0	3	343.515	3.043	20	30		EGEDHN
C[C@H](NCc1ccc(N2CCO[C@@H](C)C2)nc1)c1cccc(C#N)c1	ZINC000181510576	455346780	/nfs/dbraw/zinc/34/67/80/455346780.db2.gz	FCYXQPWOVHEPTN-HOTGVXAUSA-N	0	3	336.439	3.029	20	30		EGEDHN
CN1CCC[C@@H](CNC(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)C1	ZINC000174092558	455358868	/nfs/dbraw/zinc/35/88/68/455358868.db2.gz	FFZCFQYVBBNAGO-NSHDSACASA-N	0	3	340.349	3.040	20	30		EGEDHN
CCc1nc(CN2CCC(CNCc3ccc(C#N)o3)CC2)cs1	ZINC000174377971	455384325	/nfs/dbraw/zinc/38/43/25/455384325.db2.gz	YPGMZVOCPCHZRY-UHFFFAOYSA-N	0	3	344.484	3.172	20	30		EGEDHN
CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)NCCCCC#N	ZINC000184560072	455402848	/nfs/dbraw/zinc/40/28/48/455402848.db2.gz	LGCDIIUTNFBVSP-SFHVURJKSA-N	0	3	330.476	3.136	20	30		EGEDHN
COc1ccc(COCCN[C@@H](C)c2ccc(OCC#N)cc2)cc1	ZINC000182000329	455413059	/nfs/dbraw/zinc/41/30/59/455413059.db2.gz	SZPYPBUIGVQPDF-INIZCTEOSA-N	0	3	340.423	3.465	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cn(C(C)(C)C)nc1C)C(C)C	ZINC000182255802	455473828	/nfs/dbraw/zinc/47/38/28/455473828.db2.gz	PVMIPWNSGZXAER-GOSISDBHSA-N	0	3	346.519	3.375	20	30		EGEDHN
C[C@H](c1ccc(C#N)cc1)N1CCC[C@@H](CNC(=O)C(C)(C)C)C1	ZINC000246351237	455475147	/nfs/dbraw/zinc/47/51/47/455475147.db2.gz	KBDUUTMITXDJPN-WBVHZDCISA-N	0	3	327.472	3.494	20	30		EGEDHN
N#C[C@@H](NC(=O)c1ccc(CN2CCCC2)cc1)C1CCCCC1	ZINC000267282871	455530661	/nfs/dbraw/zinc/53/06/61/455530661.db2.gz	SSBHIKPDCPAHQS-LJQANCHMSA-N	0	3	325.456	3.485	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1C[C@H](c2ccccc2C)C[C@H]1C	ZINC000246932523	455536187	/nfs/dbraw/zinc/53/61/87/455536187.db2.gz	DRODYVIUKLUADB-KBAYOESNSA-N	0	3	327.472	3.181	20	30		EGEDHN
CN(Cc1ccccc1)[C@H](CNC(=O)C1(C#N)CCCC1)C1CC1	ZINC000185322615	455540509	/nfs/dbraw/zinc/54/05/09/455540509.db2.gz	CLGAQNWEKMOSRO-GOSISDBHSA-N	0	3	325.456	3.097	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@@H](C)c2cn(C)c3ccccc23)CC1	ZINC000185330754	455541611	/nfs/dbraw/zinc/54/16/11/455541611.db2.gz	OBNDTVQYAQKPSR-HNNXBMFYSA-N	0	3	325.456	3.048	20	30		EGEDHN
N#CCOc1ccc(CN2CCC(OC[C@@H]3CCCCO3)CC2)cc1	ZINC000267344602	455543531	/nfs/dbraw/zinc/54/35/31/455543531.db2.gz	DIMXZBJAYWXYPL-FQEVSTJZSA-N	0	3	344.455	3.139	20	30		EGEDHN
C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCN2CCC[C@H]2C1	ZINC000247228056	455575259	/nfs/dbraw/zinc/57/52/59/455575259.db2.gz	CLWQIVRTJYFRRB-CABCVRRESA-N	0	3	344.484	3.393	20	30		EGEDHN
C=CCNC(=O)CN[C@H]1CCC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000284343452	455671690	/nfs/dbraw/zinc/67/16/90/455671690.db2.gz	MWOGTTBKXSOAKG-CABCVRRESA-N	0	3	326.362	3.233	20	30		EGEDHN
O=C1NC(CC(F)(F)F)C(=O)N1c1ccc(F)c(C(F)(F)F)c1	ZINC000277893526	455699893	/nfs/dbraw/zinc/69/98/93/455699893.db2.gz	BDTMVHZILYDCMV-QMMMGPOBSA-N	0	3	344.186	3.222	20	30		EGEDHN
C[C@@H]1CN(C(=O)Nc2ccc(CC#N)cc2)CCN(C2CCC2)C1	ZINC000292596278	455707471	/nfs/dbraw/zinc/70/74/71/455707471.db2.gz	JJZWEPZSYXZJBM-HNNXBMFYSA-N	0	3	326.444	3.091	20	30		EGEDHN
CC(C)COc1ccc(C(C)(C)NCCC(=O)N(C)CCC#N)cc1	ZINC000271655186	455713096	/nfs/dbraw/zinc/71/30/96/455713096.db2.gz	CDJWCYJHGPOVKP-UHFFFAOYSA-N	0	3	345.487	3.308	20	30		EGEDHN
COc1ccc(OCCN[C@H](C)c2ccc(C#N)cc2)c([N+](=O)[O-])c1	ZINC000271712088	455729886	/nfs/dbraw/zinc/72/98/86/455729886.db2.gz	VZLWSXLOUNTZDU-CYBMUJFWSA-N	0	3	341.367	3.205	20	30		EGEDHN
COc1cccc(C2(NCCC(=O)Nc3ccc(C#N)cc3)CC2)c1	ZINC000271735958	455739811	/nfs/dbraw/zinc/73/98/11/455739811.db2.gz	UJOGKSBNGIHHED-UHFFFAOYSA-N	0	3	335.407	3.174	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N1CC[C@@]2(CCN(C)C2)C1)c1ccc(F)c(F)c1	ZINC000292732869	455743763	/nfs/dbraw/zinc/74/37/63/455743763.db2.gz	SQBNKQCCULTRFS-PKOBYXMFSA-N	0	3	349.425	3.319	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)COc2ccc(Cl)c(F)c2)CC1	ZINC000292988731	455769666	/nfs/dbraw/zinc/76/96/66/455769666.db2.gz	DVRDOQFBOPOAJS-UHFFFAOYSA-N	0	3	340.826	3.015	20	30		EGEDHN
CCc1cc[n+](C(C(=O)c2nccs2)C(=S)[N-]C(C)(C)C)cc1	ZINC000278197573	455783829	/nfs/dbraw/zinc/78/38/29/455783829.db2.gz	GRGJDKYTJDSBSI-UHFFFAOYSA-O	0	3	348.517	3.320	20	30		EGEDHN
CC[C@@H](NC[C@H](O)COc1ccc(F)cc1)c1ccc(C#N)cc1	ZINC000278253497	455799159	/nfs/dbraw/zinc/79/91/59/455799159.db2.gz	MTYBMCFKWORANA-PKOBYXMFSA-N	0	3	328.387	3.178	20	30		EGEDHN
C[C@H]1CN(C(=O)C(C#N)Cc2ccc(C#N)cc2)Cc2ccccc2O1	ZINC000293962354	455801803	/nfs/dbraw/zinc/80/18/03/455801803.db2.gz	TYFSWVZBVOKFPO-HNAYVOBHSA-N	0	3	345.402	3.050	20	30		EGEDHN
COc1ccc(CCN2CCCN(c3ccccc3C#N)CC2)cc1	ZINC000194256173	455820785	/nfs/dbraw/zinc/82/07/85/455820785.db2.gz	DVOOPGFSHGPQGT-UHFFFAOYSA-N	0	3	335.451	3.322	20	30		EGEDHN
Cc1ccc([C@@H](CNC(=O)[C@@]2(C#N)CC23CCCC3)N(C)C)cc1	ZINC000294652428	455823077	/nfs/dbraw/zinc/82/30/77/455823077.db2.gz	HQEKUKYYOFYTNI-XLIONFOSSA-N	0	3	325.456	3.188	20	30		EGEDHN
Cc1ccccc1[C@@H](NCC(=O)NC1(C#N)CCCCC1)C1CC1	ZINC000272021125	455823320	/nfs/dbraw/zinc/82/33/20/455823320.db2.gz	LKUSDYDZKNOQIF-IBGZPJMESA-N	0	3	325.456	3.378	20	30		EGEDHN
CC[C@@](C)(C#N)C(=O)Nc1ccc(OCCN2CCCC2)c(C)c1	ZINC000285382448	455833561	/nfs/dbraw/zinc/83/35/61/455833561.db2.gz	CSYHOYRSOXPNPJ-IBGZPJMESA-N	0	3	329.444	3.348	20	30		EGEDHN
CC(C)(C#N)CCN1CCC(C(=O)NCCc2cccs2)CC1	ZINC000272055393	455834078	/nfs/dbraw/zinc/83/40/78/455834078.db2.gz	VIINJXMYXRNPRG-UHFFFAOYSA-N	0	3	333.501	3.059	20	30		EGEDHN
Cc1cc([C@H](NCC(=O)N[C@@](C)(C#N)C(C)C)C2CC2)ccc1F	ZINC000272059912	455835153	/nfs/dbraw/zinc/83/51/53/455835153.db2.gz	HPVQXFTYEWKTQD-MOPGFXCFSA-N	0	3	331.435	3.229	20	30		EGEDHN
CN(CCC(C)(C)C#N)[C@H](CO)c1cccc(Br)c1	ZINC000272058352	455835198	/nfs/dbraw/zinc/83/51/98/455835198.db2.gz	WAMWUEXWBBKELG-CQSZACIVSA-N	0	3	325.250	3.354	20	30		EGEDHN
CC1(C)[C@H](NCc2ccc(Br)cc2C#N)[C@@H]2CCO[C@@H]21	ZINC000295094921	455838416	/nfs/dbraw/zinc/83/84/16/455838416.db2.gz	AKQMSVJUTCEBIF-ZNMIVQPWSA-N	0	3	335.245	3.224	20	30		EGEDHN
C=C1CCN(C(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)CC1	ZINC000285408116	455838772	/nfs/dbraw/zinc/83/87/72/455838772.db2.gz	PFIYQGRQRAQZDV-QGZVFWFLSA-N	0	3	334.410	3.322	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N(C)CC2CCCC2)cc1	ZINC000278549131	455840139	/nfs/dbraw/zinc/84/01/39/455840139.db2.gz	HEHWHSKNTNJHDN-ZDUSSCGKSA-N	0	3	349.456	3.026	20	30		EGEDHN
CC[C@@H]([NH2+]CCCNC(=O)c1cccc([O-])c1)c1ccc(C#N)cc1	ZINC000278693441	455844670	/nfs/dbraw/zinc/84/46/70/455844670.db2.gz	KNSMLNRLMZSYKQ-LJQANCHMSA-N	0	3	337.423	3.125	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)[C@@]1(C#N)CC12CCCC2	ZINC000295330982	455846458	/nfs/dbraw/zinc/84/64/58/455846458.db2.gz	MIVMKUCBNKEMEJ-BLIXFSHQSA-N	0	3	337.467	3.097	20	30		EGEDHN
CC[C@@H](C)[N-]C(=S)C(C(=O)c1c(C)noc1C)[n+]1cccc(C)c1	ZINC000186965102	455857053	/nfs/dbraw/zinc/85/70/53/455857053.db2.gz	XGIUGHSCDRXDGI-GFCCVEGCSA-O	0	3	346.476	3.214	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1F)C(=O)c1ccc(F)c(C#N)c1	ZINC000279245802	455861471	/nfs/dbraw/zinc/86/14/71/455861471.db2.gz	RAAQKVJRCHDMSC-UHFFFAOYSA-N	0	3	343.377	3.040	20	30		EGEDHN
C[C@@H](CNC(=O)C(C#N)Cc1ccc(C#N)cc1)c1ccc(F)cc1	ZINC000279368526	455863603	/nfs/dbraw/zinc/86/36/03/455863603.db2.gz	RPOVMFORDNUYSA-KSSFIOAISA-N	0	3	335.382	3.300	20	30		EGEDHN
CN(Cc1cn(CCC#N)nc1-c1ccncc1)Cc1ccccc1	ZINC000279362673	455863915	/nfs/dbraw/zinc/86/39/15/455863915.db2.gz	HPMWOHWVVPARGU-UHFFFAOYSA-N	0	3	331.423	3.491	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)Cc1ccc(C#N)cc1)c1nc(C)cs1	ZINC000279453354	455865147	/nfs/dbraw/zinc/86/51/47/455865147.db2.gz	ZOKWZKGJGPFHKO-CVEARBPZSA-N	0	3	338.436	3.273	20	30		EGEDHN
C[C@@H]1CSCCN(Cc2cn(CCC#N)nc2-c2ccncc2)C1	ZINC000279503046	455866763	/nfs/dbraw/zinc/86/67/63/455866763.db2.gz	ZLXPVOFSJGEFNP-HNNXBMFYSA-N	0	3	341.484	3.044	20	30		EGEDHN
C[C@@]1(O)CCCN(Cc2cn(CCC#N)nc2-c2ccccc2)CC1	ZINC000279590666	455868355	/nfs/dbraw/zinc/86/83/55/455868355.db2.gz	CNEHCRAQENXKJT-HXUWFJFHSA-N	0	3	338.455	3.201	20	30		EGEDHN
C[C@@H](Cn1cc(Br)cn1)NC1(c2cccc(C#N)c2)CC1	ZINC000272195694	455873195	/nfs/dbraw/zinc/87/31/95/455873195.db2.gz	IEZUIUIFQXWQHP-LBPRGKRZSA-N	0	3	345.244	3.185	20	30		EGEDHN
CC1CCN([C@H](CNc2nccc(C#N)n2)c2cccs2)CC1	ZINC000296196934	455877746	/nfs/dbraw/zinc/87/77/46/455877746.db2.gz	BXLAJEQOPDOEGI-OAHLLOKOSA-N	0	3	327.457	3.295	20	30		EGEDHN
CC[C@H](NCCn1cc(Br)cn1)c1ccc(C#N)cc1	ZINC000285843097	455927173	/nfs/dbraw/zinc/92/71/73/455927173.db2.gz	YLVLZJXPHUMDLS-HNNXBMFYSA-N	0	3	333.233	3.258	20	30		EGEDHN
C[C@@H](O)C[C@@H]1CCCCCN1Cc1nnc(-c2ccc(C#N)cc2)o1	ZINC000286059590	455969846	/nfs/dbraw/zinc/96/98/46/455969846.db2.gz	RLJPXOAKPNCCHG-PBHICJAKSA-N	0	3	340.427	3.124	20	30		EGEDHN
CCO[C@H]1C[C@@H](NCC#Cc2ccc(Cl)cc2)C12CCOCC2	ZINC000286129480	455983257	/nfs/dbraw/zinc/98/32/57/455983257.db2.gz	MORLCRFRXSZKMU-MSOLQXFVSA-N	0	3	333.859	3.255	20	30		EGEDHN
C#CCOc1ccccc1NC(=O)N1CCCN(C2CCCC2)CC1	ZINC000188084103	455993086	/nfs/dbraw/zinc/99/30/86/455993086.db2.gz	VCFQHDWJCUWBQB-UHFFFAOYSA-N	0	3	341.455	3.181	20	30		EGEDHN
CC[C@@H]1c2ccsc2CCN1C[C@H](O)COc1ccc(C#N)cc1	ZINC000198642949	456010609	/nfs/dbraw/zinc/01/06/09/456010609.db2.gz	GBLKYIBDVCLAKL-MAUKXSAKSA-N	0	3	342.464	3.369	20	30		EGEDHN
N=C(NCc1ccnc(N2CCCCC2)c1)Nc1cc(F)ccc1F	ZINC000262250766	456017213	/nfs/dbraw/zinc/01/72/13/456017213.db2.gz	DIIHQYDRRGGTPS-UHFFFAOYSA-N	0	3	345.397	3.277	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@H](C)N[C@H](C)c1ccc(OC)c(OC)c1C	ZINC000286671020	456050737	/nfs/dbraw/zinc/05/07/37/456050737.db2.gz	BNFHJRQGRIIOOX-CVEARBPZSA-N	0	3	348.487	3.476	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H]2C[C@H](c3ccccc3F)C2)CC1	ZINC000280895392	456075022	/nfs/dbraw/zinc/07/50/22/456075022.db2.gz	FPTUKCBIDKOKPO-KOMQPUFPSA-N	0	3	331.435	3.021	20	30		EGEDHN
COc1cc(C#N)ccc1CN1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O	ZINC000280897892	456076047	/nfs/dbraw/zinc/07/60/47/456076047.db2.gz	DQNCCIZPPXMCJL-IPMKNSEASA-N	0	3	328.456	3.472	20	30		EGEDHN
COc1cc(C#N)ccc1CN1CCCC[C@@H]1[C@H]1CCCC[C@H]1O	ZINC000280897884	456076099	/nfs/dbraw/zinc/07/60/99/456076099.db2.gz	DQNCCIZPPXMCJL-GUDVDZBRSA-N	0	3	328.456	3.472	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C(=O)c1ccc(CN2CCCC2)cc1	ZINC000225503117	456088867	/nfs/dbraw/zinc/08/88/67/456088867.db2.gz	CCYHTBDRRVDVBD-UHFFFAOYSA-N	0	3	333.435	3.426	20	30		EGEDHN
COCCCOc1ccc(CNC(=N)Nc2cc(F)ccc2F)cc1	ZINC000288753659	456104833	/nfs/dbraw/zinc/10/48/33/456104833.db2.gz	REPDSWOOCHVEFR-UHFFFAOYSA-N	0	3	349.381	3.307	20	30		EGEDHN
C=C[C@](C)(CCOC)c1nc(-c2cccc(OCCN(C)C)c2)no1	ZINC000289064206	456113578	/nfs/dbraw/zinc/11/35/78/456113578.db2.gz	GMQDOZQHLNXGBB-LJQANCHMSA-N	0	3	345.443	3.157	20	30		EGEDHN
COCCOCc1ccc(CNCc2ccc(OCC#N)cc2)cc1	ZINC000289721988	456137537	/nfs/dbraw/zinc/13/75/37/456137537.db2.gz	LYOUUOTZJYXTEK-UHFFFAOYSA-N	0	3	340.423	3.042	20	30		EGEDHN
CN(C)CCN(Cc1ccc(F)cc1)c1ccc(Cl)c(C#N)n1	ZINC000301613476	456162798	/nfs/dbraw/zinc/16/27/98/456162798.db2.gz	ABMVONXTHGPBQK-UHFFFAOYSA-N	0	3	332.810	3.314	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)CCC1	ZINC000188985861	456190469	/nfs/dbraw/zinc/19/04/69/456190469.db2.gz	QXPKQOAYECSALR-QZTJIDSGSA-N	0	3	348.531	3.471	20	30		EGEDHN
C[C@H](CNC(=O)OC(C)(C)C)N[C@H](C)c1ccc(OCC#N)cc1	ZINC000274706452	456264273	/nfs/dbraw/zinc/26/42/73/456264273.db2.gz	ZHJAYZCFPHVGRY-ZIAGYGMSSA-N	0	3	333.432	3.153	20	30		EGEDHN
C=CCOc1cccc(CN2CCC[C@@H]2CN2C[C@H](C)O[C@@H](C)C2)c1	ZINC000352766056	456287542	/nfs/dbraw/zinc/28/75/42/456287542.db2.gz	UZKHOUQSPNCPMZ-CMKODMSKSA-N	0	3	344.499	3.325	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Cc1c(F)cccc1C#N)C(C)C	ZINC000352841084	456356656	/nfs/dbraw/zinc/35/66/56/456356656.db2.gz	YYRIZROUYNMJBH-LJQANCHMSA-N	0	3	343.446	3.055	20	30		EGEDHN
N#Cc1cc(NC2CCN(C3CC3)CC2)ccc1OC(F)(F)F	ZINC000298209977	456393154	/nfs/dbraw/zinc/39/31/54/456393154.db2.gz	YYLAEFDORJIQSC-UHFFFAOYSA-N	0	3	325.334	3.496	20	30		EGEDHN
CC(C)[C@@H](C(=O)Nc1ccc(Oc2ccnc(C#N)c2)cc1)N(C)C	ZINC000290684021	456405133	/nfs/dbraw/zinc/40/51/33/456405133.db2.gz	ZZBJAJYBJVSTDR-SFHVURJKSA-N	0	3	338.411	3.270	20	30		EGEDHN
C=CCOCCCN[C@H](CCO)c1ccccc1Br	ZINC000348028118	456439668	/nfs/dbraw/zinc/43/96/68/456439668.db2.gz	CHYYLTAWHRCNRR-OAHLLOKOSA-N	0	3	328.250	3.055	20	30		EGEDHN
C=CCOCCCN(C)[C@H](CO)c1cccc(Br)c1	ZINC000348059677	456449766	/nfs/dbraw/zinc/44/97/66/456449766.db2.gz	WPLQWDQPOZHEKQ-OAHLLOKOSA-N	0	3	328.250	3.007	20	30		EGEDHN
C=CCC(C)(C)C(=O)N(C)C[C@H]1CCCN(CC)[C@@H]1c1cnn(C)c1	ZINC000348067624	456452690	/nfs/dbraw/zinc/45/26/90/456452690.db2.gz	DKOMKXWCESBKNJ-AEFFLSMTSA-N	0	3	346.519	3.254	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1C[C@H](F)CN1Cc1nccs1	ZINC000348080276	456462018	/nfs/dbraw/zinc/46/20/18/456462018.db2.gz	HWHMFKAUUFCKTD-IRXDYDNUSA-N	0	3	344.459	3.059	20	30		EGEDHN
N#Cc1ncn(CCNCc2ccc(Sc3ccccc3)cc2)n1	ZINC000353050785	456462831	/nfs/dbraw/zinc/46/28/31/456462831.db2.gz	WLTAGNDYINXPIG-UHFFFAOYSA-N	0	3	335.436	3.091	20	30		EGEDHN
CN(Cc1ccc(F)c(F)c1)C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000348092326	456471867	/nfs/dbraw/zinc/47/18/67/456471867.db2.gz	XEMPULPRHBAPPD-INIZCTEOSA-N	0	3	339.345	3.177	20	30		EGEDHN
CC1(C)CN(Cc2ccccc2)CC[C@@H]1NC(=O)NCCCCC#N	ZINC000282389037	456497564	/nfs/dbraw/zinc/49/75/64/456497564.db2.gz	JPNSEJMEPSHGJW-SFHVURJKSA-N	0	3	342.487	3.280	20	30		EGEDHN
N#Cc1csc(CNCCCNc2ccc(C(F)(F)F)cn2)c1	ZINC000343268822	456497608	/nfs/dbraw/zinc/49/76/08/456497608.db2.gz	GUJBYDQQBXFZNU-UHFFFAOYSA-N	0	3	340.374	3.047	20	30		EGEDHN
C=CCOCCCN1CCN(c2cccc3cnccc32)C[C@@H]1C	ZINC000348191295	456525936	/nfs/dbraw/zinc/52/59/36/456525936.db2.gz	BQBYJXIWFHSCSC-KRWDZBQOSA-N	0	3	325.456	3.338	20	30		EGEDHN
CCCN(CC1(C#N)CC1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000343325359	456532646	/nfs/dbraw/zinc/53/26/46/456532646.db2.gz	MOBMWZVDTYSTNG-UHFFFAOYSA-N	0	3	325.456	3.307	20	30		EGEDHN
CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(CC2(C#N)CC2)[C@H]2CCCC[C@H]12	ZINC000343328154	456534119	/nfs/dbraw/zinc/53/41/19/456534119.db2.gz	XEVPPCNSHQTWKZ-AVEIZBFRSA-N	0	3	331.504	3.474	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H]2CCOC[C@@H]2OCC)cc1Cl	ZINC000353197962	456553209	/nfs/dbraw/zinc/55/32/09/456553209.db2.gz	ZUVFTMCQRYNVPW-WBVHZDCISA-N	0	3	325.836	3.188	20	30		EGEDHN
CCN1CCO[C@@H](CNCc2cccc(C#N)c2)[C@H]1c1ccccc1	ZINC000343391594	456585560	/nfs/dbraw/zinc/58/55/60/456585560.db2.gz	RAUJCNWXBHVCLB-LEWJYISDSA-N	0	3	335.451	3.110	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1ccccc1OCC#N)C(C)C	ZINC000299156473	456621714	/nfs/dbraw/zinc/62/17/14/456621714.db2.gz	RYMRRSXHJOTDEH-GOSISDBHSA-N	0	3	341.455	3.017	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(Cc2ccc(Cl)cc2)OC)CC1	ZINC000291394944	456631772	/nfs/dbraw/zinc/63/17/72/456631772.db2.gz	TWBUERPSEDWVPS-UHFFFAOYSA-N	0	3	337.851	3.063	20	30		EGEDHN
CCC(C#N)(CC)C(=O)N1CCN(Cc2ccccc2)C[C@@H](C)C1	ZINC000324125351	456662453	/nfs/dbraw/zinc/66/24/53/456662453.db2.gz	JCPURAJWKNGABI-QGZVFWFLSA-N	0	3	327.472	3.297	20	30		EGEDHN
Cc1c(Cl)cnc(N(CCN(C)C)Cc2ccccc2)c1C#N	ZINC000343529288	456687224	/nfs/dbraw/zinc/68/72/24/456687224.db2.gz	MQBRHFQQBBFQBZ-UHFFFAOYSA-N	0	3	328.847	3.483	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@@H](NC[C@@H]1CN(Cc3ccccc3)CCO1)CC2	ZINC000353426630	456692681	/nfs/dbraw/zinc/69/26/81/456692681.db2.gz	NDZVEKSRKAYRHR-IRLDBZIGSA-N	0	3	347.462	3.036	20	30		EGEDHN
COC(=O)COc1ccccc1[C@@H](C)NCCc1cccc(C#N)c1	ZINC000343543295	456697420	/nfs/dbraw/zinc/69/74/20/456697420.db2.gz	YCGBYHLTPCTJEO-OAHLLOKOSA-N	0	3	338.407	3.003	20	30		EGEDHN
CO[C@]1(C)C[C@H](N[C@H](C)C(=O)Nc2ccc(C#N)c(Cl)c2)C1(C)C	ZINC000340821064	456702060	/nfs/dbraw/zinc/70/20/60/456702060.db2.gz	LQKFBXKGRNNGPF-DJCROIMJSA-N	0	3	349.862	3.332	20	30		EGEDHN
CN1CCC[C@H]1CNC(=O)NCc1ccc(OC2CCCC2)cc1	ZINC000328729133	456746476	/nfs/dbraw/zinc/74/64/76/456746476.db2.gz	FHBTXQYZMPOUMO-INIZCTEOSA-N	0	3	331.460	3.106	20	30		EGEDHN
CC1CCC(N2CCN(C(=O)CCC(=O)NC3CCCC3)CC2)CC1	ZINC000328801116	456764850	/nfs/dbraw/zinc/76/48/50/456764850.db2.gz	ZCERADNMDABGLN-UHFFFAOYSA-N	0	3	349.519	3.389	20	30		EGEDHN
Cn1cc(C(F)(F)F)nc1[C@H]1CCCN(CCCSCC#N)C1	ZINC000343749814	456772692	/nfs/dbraw/zinc/77/26/92/456772692.db2.gz	CCOGPGZHNJLWFY-LBPRGKRZSA-N	0	3	346.422	3.265	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CNC(C)(C)c1ccc(C)nc1	ZINC000353578016	456777633	/nfs/dbraw/zinc/77/76/33/456777633.db2.gz	CDDVRQLLEMGCBT-LJQANCHMSA-N	0	3	340.467	3.383	20	30		EGEDHN
O=C(CN[C@@H]1CCC(=O)N[C@@H]1C1CC1)NC12CC3CC(CC(C3)C1)C2	ZINC000328903260	456787887	/nfs/dbraw/zinc/78/78/87/456787887.db2.gz	HQFOCVHTTSHNGH-FYEYODOUSA-N	0	3	345.487	3.399	20	30		EGEDHN
Cc1cccc(NC(=O)[C@H](C)N2CCC[C@@H]2[C@H]2COCC[C@@]2(C)O)c1	ZINC000328995434	456808747	/nfs/dbraw/zinc/80/87/47/456808747.db2.gz	WIAZCQMRODIAIE-ZCDKGFTFSA-N	0	3	346.471	3.223	20	30		EGEDHN
CSCC[C@@](C)(C#N)NC(=O)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000344698575	456849092	/nfs/dbraw/zinc/84/90/92/456849092.db2.gz	JAVPYMAEUMIGSY-HKUYNNGSSA-N	0	3	345.512	3.050	20	30		EGEDHN
C[C@H](NC(=O)CN1CCC[C@H]1CC(C)(C)C)C(=O)N1CCCCC1	ZINC000329419161	456887560	/nfs/dbraw/zinc/88/75/60/456887560.db2.gz	GNGXEZSVJKAEKJ-HOTGVXAUSA-N	0	3	337.508	3.245	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CCOC[C@@H](C2CCC2)C1	ZINC000329512400	456902201	/nfs/dbraw/zinc/90/22/01/456902201.db2.gz	XUTVPJMHGNCDGE-OALUTQOASA-N	0	3	326.440	3.034	20	30		EGEDHN
N#Cc1ccc([C@@H](N[C@@H]2CC=C(c3ccc(F)cc3)CC2)C(N)=O)cc1	ZINC000349221945	456916383	/nfs/dbraw/zinc/91/63/83/456916383.db2.gz	FKJFHLIPORPOIP-WOJBJXKFSA-N	0	3	349.409	3.449	20	30		EGEDHN
CCN1C[C@@H](C)N(Cc2ccc(OC)c(OCCCC#N)c2)C[C@@H]1C	ZINC000353816440	456920366	/nfs/dbraw/zinc/92/03/66/456920366.db2.gz	MOJUQPFLTOOMAT-DLBZAZTESA-N	0	3	345.487	3.292	20	30		EGEDHN
N#CC[C@H](CC(=O)N[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1	ZINC000353875787	456945198	/nfs/dbraw/zinc/94/51/98/456945198.db2.gz	IJWWYRFNLRGIDM-RTWAWAEBSA-N	0	3	347.462	3.465	20	30		EGEDHN
Cc1ccccc1[C@H]1C[C@H]([NH+]=C([O-])NC[C@H]2CCc3nccn3C2)C1	ZINC000329818653	456945914	/nfs/dbraw/zinc/94/59/14/456945914.db2.gz	XFJYKWNPVGPTKC-BRWVUGGUSA-N	0	3	338.455	3.204	20	30		EGEDHN
C[C@@H]1C[C@@H](N(C)C(=O)Nc2csc(-c3ccccn3)n2)CCN1C	ZINC000329831366	456948099	/nfs/dbraw/zinc/94/80/99/456948099.db2.gz	KCBQIIIRAGLVJC-OLZOCXBDSA-N	0	3	345.472	3.165	20	30		EGEDHN
C[C@@H]1CC[C@H](C)N1CC(=O)N[C@@H]1CC(=O)N(c2ccccc2Cl)C1	ZINC000329895434	456957740	/nfs/dbraw/zinc/95/77/40/456957740.db2.gz	KLYBVPDJDWTTPA-HZSPNIEDSA-N	0	3	349.862	3.275	20	30		EGEDHN
CC(C)N1CCC[C@H](NC(=O)[C@@H]2CCCC[C@H]2C(=O)N2CCCC2)C1	ZINC000329943768	456964765	/nfs/dbraw/zinc/96/47/65/456964765.db2.gz	HYJPXBRIBRLZOL-RCCFBDPRSA-N	0	3	349.519	3.245	20	30		EGEDHN
CC(C)C[C@H]1OCCC[C@@H]1NCC(=O)Nc1ccc2c(c1)OCO2	ZINC000330148682	456992254	/nfs/dbraw/zinc/99/22/54/456992254.db2.gz	MGWBONNZTHXKMK-GOEBONIOSA-N	0	3	334.416	3.187	20	30		EGEDHN
CC1(C)CCc2ccccc2[C@@H]1NC([O-])=[NH+][C@H]1CCn2ccnc2C1	ZINC000330182010	456996851	/nfs/dbraw/zinc/99/68/51/456996851.db2.gz	GYAGUXDOKYFCOI-YJBOKZPZSA-N	0	3	338.455	3.415	20	30		EGEDHN
CC1(C)CCc2ccccc2[C@@H]1NC([O-])=[NH+][C@@H]1CCn2ccnc2C1	ZINC000330182009	456997045	/nfs/dbraw/zinc/99/70/45/456997045.db2.gz	GYAGUXDOKYFCOI-QAPCUYQASA-N	0	3	338.455	3.415	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)NC[C@@]2(C)CCCN2Cc2ccccc2)CCO1	ZINC000330189375	456999536	/nfs/dbraw/zinc/99/95/36/456999536.db2.gz	LSWCPVHIGGLSPS-YVWKXTFCSA-N	0	3	345.487	3.112	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1C(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C	ZINC000362607413	457003323	/nfs/dbraw/zinc/00/33/23/457003323.db2.gz	DCNMCALRNWFXLE-SXLOBPIMSA-N	0	3	342.483	3.091	20	30		EGEDHN
CCn1ccnc1[C@@H]1CCCCN1C(=O)N[C@H](C)CN1CCCCC1	ZINC000330243119	457010204	/nfs/dbraw/zinc/01/02/04/457010204.db2.gz	CLBPMDPHGUKKNU-SJORKVTESA-N	0	3	347.507	3.218	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2cn(CCCC#N)c3ccccc23)CCN1C	ZINC000346104312	457016573	/nfs/dbraw/zinc/01/65/73/457016573.db2.gz	WOYZITDTBVYARL-CVEARBPZSA-N	0	3	338.455	3.158	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CC2(CCC2)[C@H]1[C@H]1CCCO1	ZINC000330293482	457023342	/nfs/dbraw/zinc/02/33/42/457023342.db2.gz	DSKKZWNOEAKBLB-IPMKNSEASA-N	0	3	338.451	3.319	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1CCC[C@H]1Cc1ccccc1C	ZINC000358962268	457043618	/nfs/dbraw/zinc/04/36/18/457043618.db2.gz	BPQWTLUGQSZLDZ-APWZRJJASA-N	0	3	327.472	3.010	20	30		EGEDHN
COCCN(C)CC[C@H](Nc1cc(C#N)cc(C)n1)c1ccccc1	ZINC000341987623	457044049	/nfs/dbraw/zinc/04/40/49/457044049.db2.gz	YVYLFDMTCYXQBJ-IBGZPJMESA-N	0	3	338.455	3.383	20	30		EGEDHN
CC(C)Cn1ncc(C(=O)N[C@@H]2CCN(C)[C@@H](C)C2)c1C(F)F	ZINC000330492300	457048987	/nfs/dbraw/zinc/04/89/87/457048987.db2.gz	QOKKDIWITLWMEO-NWDGAFQWSA-N	0	3	328.407	3.264	20	30		EGEDHN
Cc1c(NC(=O)N(C)[C@H](C)C2CCN(C)CC2)cccc1[N+](=O)[O-]	ZINC000330702946	457073094	/nfs/dbraw/zinc/07/30/94/457073094.db2.gz	IQFPISPZOGYOSF-CYBMUJFWSA-N	0	3	334.420	3.111	20	30		EGEDHN
COc1cccc(C(=O)N[C@@H]2CCN(C)[C@H](C)C2)c1OC(F)F	ZINC000330894479	457101973	/nfs/dbraw/zinc/10/19/73/457101973.db2.gz	FJJSQFIWVVMDSD-GHMZBOCLSA-N	0	3	328.359	3.084	20	30		EGEDHN
C[C@H]1[C@H](NC(=O)NCC#Cc2ccccc2)CCN1Cc1ccccc1	ZINC000350124222	457166334	/nfs/dbraw/zinc/16/63/34/457166334.db2.gz	XJCQYUKXKZYPNC-GHTZIAJQSA-N	0	3	347.462	3.000	20	30		EGEDHN
N#CC[C@@H](CC(=O)N1CCN(C2CCCC2)CC1)c1ccccc1	ZINC000354319839	457184970	/nfs/dbraw/zinc/18/49/70/457184970.db2.gz	PMIWEMOXULRWIF-SFHVURJKSA-N	0	3	325.456	3.161	20	30		EGEDHN
N#Cc1ccc(N2CCC(Nc3ccnc4ccccc43)CC2)nc1	ZINC000363008030	457194058	/nfs/dbraw/zinc/19/40/58/457194058.db2.gz	SFDOTRKONMAXQS-UHFFFAOYSA-N	0	3	329.407	3.004	20	30		EGEDHN
C=CCn1c(-c2ccc(C)s2)nnc1N(C)[C@@H]1CCN(C2CC2)C1	ZINC000350753331	457205924	/nfs/dbraw/zinc/20/59/24/457205924.db2.gz	YSZXNFHCVGIZLE-OAHLLOKOSA-N	0	3	343.500	3.174	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2CCCN(CC3CCC3)CC2)cc1	ZINC000351029563	457215375	/nfs/dbraw/zinc/21/53/75/457215375.db2.gz	XJCZHJZMXOARIE-UHFFFAOYSA-N	0	3	328.456	3.199	20	30		EGEDHN
CCCOc1ccccc1Oc1ncccc1CNC(=O)C(C)C#N	ZINC000347080164	457219737	/nfs/dbraw/zinc/21/97/37/457219737.db2.gz	WIEMQQYLGINNGW-AWEZNQCLSA-N	0	3	339.395	3.439	20	30		EGEDHN
CN(C)CCN(Cc1cccs1)c1ccc(C#N)cc1[N+](=O)[O-]	ZINC000347108852	457233075	/nfs/dbraw/zinc/23/30/75/457233075.db2.gz	QQLOBINBAYGACD-UHFFFAOYSA-N	0	3	330.413	3.096	20	30		EGEDHN
CC(C)(CO)[C@H](NCc1ccc(C#N)cc1Br)C1CC1	ZINC000339731270	457237700	/nfs/dbraw/zinc/23/77/00/457237700.db2.gz	ZGUFJPPMPZWHOH-OAHLLOKOSA-N	0	3	337.261	3.207	20	30		EGEDHN
C[C@H](CCC#N)N(C)C[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000351269694	457249682	/nfs/dbraw/zinc/24/96/82/457249682.db2.gz	MPWIUEZHHLOUKX-CHWSQXEVSA-N	0	3	330.350	3.069	20	30		EGEDHN
CC[C@@H](CC#N)N[C@@H](C)CCCCN1C(=O)c2ccccc2C1=O	ZINC000351980611	457328738	/nfs/dbraw/zinc/32/87/38/457328738.db2.gz	GCAXNIUSEYXCKP-GJZGRUSLSA-N	0	3	327.428	3.123	20	30		EGEDHN
CN(Cc1ccccc1)C1(CNC(=O)C2(C#N)CCCC2)CCC1	ZINC000386655368	457431890	/nfs/dbraw/zinc/43/18/90/457431890.db2.gz	LGKHFADVFDNCSN-UHFFFAOYSA-N	0	3	325.456	3.241	20	30		EGEDHN
N#Cc1cccc(OCCCN2CCc3ccc([N+](=O)[O-])cc3C2)c1	ZINC000357309485	457436574	/nfs/dbraw/zinc/43/65/74/457436574.db2.gz	TXBOITOONVPOKE-UHFFFAOYSA-N	0	3	337.379	3.294	20	30		EGEDHN
N#Cc1ccc(NCCCN2CCc3ccccc3C2)cc1[N+](=O)[O-]	ZINC000357311258	457439160	/nfs/dbraw/zinc/43/91/60/457439160.db2.gz	HJJCRHNJWPDWNV-UHFFFAOYSA-N	0	3	336.395	3.327	20	30		EGEDHN
C=CCCC1(C(=O)N(C)C[C@@H]2CCN(C)[C@H]2c2cccnc2)CC1	ZINC000356088779	457446946	/nfs/dbraw/zinc/44/69/46/457446946.db2.gz	JPIHQTBCJMNXTL-ROUUACIJSA-N	0	3	327.472	3.279	20	30		EGEDHN
CC(C#N)C(=O)N[C@H](c1cc(F)cc(Br)c1)C1CC1	ZINC000360970379	457477005	/nfs/dbraw/zinc/47/70/05/457477005.db2.gz	KJXFFFSQOVFWOU-OQPBUACISA-N	0	3	325.181	3.315	20	30		EGEDHN
CC1CCC(N2CCN(C(=O)Nc3ccc(F)c(C#N)c3)CC2)CC1	ZINC000360979572	457484721	/nfs/dbraw/zinc/48/47/21/457484721.db2.gz	XEEDYPZAZDXYOW-UHFFFAOYSA-N	0	3	344.434	3.426	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C1(C#N)CCCCC1	ZINC000398162623	457496273	/nfs/dbraw/zinc/49/62/73/457496273.db2.gz	LIYRTRMEWLEUTH-HKUYNNGSSA-N	0	3	339.483	3.487	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)[C@H]1CC12CCCCC2	ZINC000357455703	457538883	/nfs/dbraw/zinc/53/88/83/457538883.db2.gz	RRIDZVMVGVTUMN-LJQANCHMSA-N	0	3	339.483	3.419	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NC[C@]1(C)CCN(Cc2ccccc2)C1)OCC	ZINC000374254043	457545514	/nfs/dbraw/zinc/54/55/14/457545514.db2.gz	CIHPUJXKCOCJBB-CTNGQTDRSA-N	0	3	344.499	3.386	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC[C@H](C(C)C)N1CCc2ccccc2C1	ZINC000347613097	457549978	/nfs/dbraw/zinc/54/99/78/457549978.db2.gz	AKEGAMITGDPULE-YLJYHZDGSA-N	0	3	344.499	3.167	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC(CCN3C[C@H](C)O[C@@H](C)C3)CC2)CC1	ZINC000356310516	457567211	/nfs/dbraw/zinc/56/72/11/457567211.db2.gz	UJCHIWIATPQREV-ROUUACIJSA-N	0	3	348.531	3.471	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)C[C@H](O)COc1cccc2[nH]ccc21	ZINC000425541258	457591641	/nfs/dbraw/zinc/59/16/41/457591641.db2.gz	WIMOLLBFAPTQEW-QAPCUYQASA-N	0	3	349.434	3.472	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC[C@H]2CCCC(F)(F)C2)CC1	ZINC000409609754	457609277	/nfs/dbraw/zinc/60/92/77/457609277.db2.gz	CJRVYWHQEVWWPC-AWEZNQCLSA-N	0	3	329.435	3.152	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H]2C[C@@H](OCC)[C@H]2OC)cc1Cl	ZINC000361150475	457614782	/nfs/dbraw/zinc/61/47/82/457614782.db2.gz	ANKQSGUMMAQBAF-OIISXLGYSA-N	0	3	325.836	3.187	20	30		EGEDHN
COC(=O)CCC(C)(C)NCc1ccc(C#N)cc1C(F)(F)F	ZINC000356444301	457629313	/nfs/dbraw/zinc/62/93/13/457629313.db2.gz	YCGNRGBVYAGTLF-UHFFFAOYSA-N	0	3	328.334	3.398	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)NCc1cccc(C)c1)C(C)C	ZINC000410253789	457635744	/nfs/dbraw/zinc/63/57/44/457635744.db2.gz	RQMUFPFHWSVQEY-IBGZPJMESA-N	0	3	329.488	3.493	20	30		EGEDHN
C=CCNC(=O)c1ccc(N[C@H](C)[C@H](c2ccccc2)N(C)C)nc1	ZINC000357663008	457646213	/nfs/dbraw/zinc/64/62/13/457646213.db2.gz	PVPQRKIHFLYLDC-DNVCBOLYSA-N	0	3	338.455	3.101	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C(=O)[C@H]1CCCCN1C1CCCC1	ZINC000370490314	457660771	/nfs/dbraw/zinc/66/07/71/457660771.db2.gz	GFROYUWIWSOGTI-LJQANCHMSA-N	0	3	325.456	3.314	20	30		EGEDHN
CCOc1ccc(O)c(CN2CCC(C#N)(c3ccccn3)CC2)c1	ZINC000370534227	457668047	/nfs/dbraw/zinc/66/80/47/457668047.db2.gz	RTPSBXXDERQSJA-UHFFFAOYSA-N	0	3	337.423	3.243	20	30		EGEDHN
CCO[C@H]1C[C@H](N(C)CCOc2ccc(C#N)cc2OC)C12CCC2	ZINC000357779736	457686638	/nfs/dbraw/zinc/68/66/38/457686638.db2.gz	NAHGRKKIBLILMY-OALUTQOASA-N	0	3	344.455	3.225	20	30		EGEDHN
Cc1noc(C2(C)CCN(Cc3ccc(O[C@@H](C)C#N)cc3)CC2)n1	ZINC000374744639	457699575	/nfs/dbraw/zinc/69/95/75/457699575.db2.gz	SKBSXGJOCTYMPT-AWEZNQCLSA-N	0	3	340.427	3.223	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)c1ccc(C#N)cc1	ZINC000361390499	457715472	/nfs/dbraw/zinc/71/54/72/457715472.db2.gz	GDZWEKUFFWHJKO-OXJNMPFZSA-N	0	3	333.435	3.199	20	30		EGEDHN
CO[C@@]1(C)CCCN([C@@H](C)C(=O)N(C)C2(C#N)CCC(C)CC2)CC1	ZINC000361414416	457724328	/nfs/dbraw/zinc/72/43/28/457724328.db2.gz	VNTJBCGMYONGIB-HECZYDGTSA-N	0	3	349.519	3.197	20	30		EGEDHN
Cc1ccc([C@H](CN2CCOCC2)N[C@@H]2CCC[C@H](C#N)C2)cc1	ZINC000361464613	457740062	/nfs/dbraw/zinc/74/00/62/457740062.db2.gz	RCPHDVAEZPCIMK-SXLOBPIMSA-N	0	3	327.472	3.040	20	30		EGEDHN
CCCOc1ccc(C(C)(C)NCCC(=O)N(C)CCC#N)cc1	ZINC000361561992	457797959	/nfs/dbraw/zinc/79/79/59/457797959.db2.gz	HKGOKDODVYPPKO-UHFFFAOYSA-N	0	3	331.460	3.062	20	30		EGEDHN
C[C@H](CNCc1cn(CCC#N)nc1-c1ccncc1)C(F)(F)F	ZINC000433335772	457813768	/nfs/dbraw/zinc/81/37/68/457813768.db2.gz	MUDDYQRHIFJKFY-GFCCVEGCSA-N	0	3	337.349	3.147	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCCCCNc1ccccn1	ZINC000433340094	457814963	/nfs/dbraw/zinc/81/49/63/457814963.db2.gz	ACNXHTBZVQLXPB-SFHVURJKSA-N	0	3	336.439	3.162	20	30		EGEDHN
CCc1ccc([C@@H](COC)NC(=O)C(C#N)CCc2ccccc2)o1	ZINC000433369921	457822753	/nfs/dbraw/zinc/82/27/53/457822753.db2.gz	AXOUVTXPJDJLGX-FUHWJXTLSA-N	0	3	340.423	3.418	20	30		EGEDHN
COC[C@@H](NC(=O)C(C#N)CCc1ccccc1)c1ccc(C)o1	ZINC000433389103	457826025	/nfs/dbraw/zinc/82/60/25/457826025.db2.gz	WFVPYGHIXVVBFP-IAGOWNOFSA-N	0	3	326.396	3.164	20	30		EGEDHN
CCO[C@@H]1C[C@H](N(C)C(=O)C(C#N)CCc2ccccc2)C1(C)C	ZINC000433479983	457840692	/nfs/dbraw/zinc/84/06/92/457840692.db2.gz	ZPHHENPYJQXBQH-OKZBNKHCSA-N	0	3	328.456	3.421	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)Cc2ccc(F)c(C)c2)CC1	ZINC000444185655	457864691	/nfs/dbraw/zinc/86/46/91/457864691.db2.gz	BZWPMZYWCAEMEE-UHFFFAOYSA-N	0	3	333.451	3.316	20	30		EGEDHN
C=CCN(C)CCN(CC)Cc1nc(-c2cccc(Cl)c2)no1	ZINC000411647795	457938581	/nfs/dbraw/zinc/93/85/81/457938581.db2.gz	YQKNSCXWPUYCRW-UHFFFAOYSA-N	0	3	334.851	3.330	20	30		EGEDHN
COc1ccc(C(=O)C(C#N)c2nc3ccccc3n2C(F)F)nc1	ZINC000361959660	457979289	/nfs/dbraw/zinc/97/92/89/457979289.db2.gz	NSRCZUZJOYNFTE-NSHDSACASA-N	0	3	342.305	3.325	20	30		EGEDHN
COc1ccc(C(=O)C(C#N)c2nc3ccccc3n2C(F)F)nc1	ZINC000361959653	457979573	/nfs/dbraw/zinc/97/95/73/457979573.db2.gz	NSRCZUZJOYNFTE-LLVKDONJSA-N	0	3	342.305	3.325	20	30		EGEDHN
N#Cc1cc(C(=O)N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)ccc1F	ZINC000375613135	457990648	/nfs/dbraw/zinc/99/06/48/457990648.db2.gz	QQNCSNDHEZUFCG-FXAWDEMLSA-N	0	3	349.409	3.044	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CCC(NC(=O)N(C)CC(C)(C)C#N)CC1	ZINC000458404097	458037766	/nfs/dbraw/zinc/03/77/66/458037766.db2.gz	JDOPZHWGUMOYDX-INIZCTEOSA-N	0	3	342.487	3.403	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)[C@@H](C)N[C@@H]1C[C@H](OC(C)(C)C)C1(C)C	ZINC000412067473	458078406	/nfs/dbraw/zinc/07/84/06/458078406.db2.gz	HFUOCLLHQUPYCK-CUYVQJCZSA-N	0	3	337.508	3.001	20	30		EGEDHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1	ZINC000412236310	458138822	/nfs/dbraw/zinc/13/88/22/458138822.db2.gz	VCKZNLMFEFOFHJ-TYCQWZJGSA-N	0	3	347.462	3.298	20	30		EGEDHN
C=CCC1(NC(=O)NCCCN2CCCO[C@@H](C)C2)CCCCC1	ZINC000458712943	458145002	/nfs/dbraw/zinc/14/50/02/458145002.db2.gz	HCXMROYQXVKOMZ-KRWDZBQOSA-N	0	3	337.508	3.066	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)N(C)C[C@H](C)C#N)N(CC)CC)cc1	ZINC000458790216	458170808	/nfs/dbraw/zinc/17/08/08/458170808.db2.gz	IBDSYNLNYIQQIW-APWZRJJASA-N	0	3	344.503	3.433	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1CNCc1c(C)nn(CC(C)C)c1OCC	ZINC000435751269	458196650	/nfs/dbraw/zinc/19/66/50/458196650.db2.gz	QNKRLDOOSQDJQI-WMZOPIPTSA-N	0	3	335.492	3.317	20	30		EGEDHN
CC(C)Oc1ccc(CN2CC[C@@H](Oc3ccc(C#N)cn3)C2)cc1	ZINC000428821446	458217429	/nfs/dbraw/zinc/21/74/29/458217429.db2.gz	VAWVHHZOUZHVNA-LJQANCHMSA-N	0	3	337.423	3.394	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCc2csc3ccccc23)CC1	ZINC000358798113	458223971	/nfs/dbraw/zinc/22/39/71/458223971.db2.gz	YTFBSPSGHWGNPD-UHFFFAOYSA-N	0	3	329.469	3.351	20	30		EGEDHN
CN(CCOCc1ccc(C#N)cc1)CCN1CCc2ccccc21	ZINC000428942346	458236482	/nfs/dbraw/zinc/23/64/82/458236482.db2.gz	MXEPRMITBBDVJF-UHFFFAOYSA-N	0	3	335.451	3.069	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cc(NC(=O)CC)ccc2C)CC1	ZINC000358826996	458242062	/nfs/dbraw/zinc/24/20/62/458242062.db2.gz	IBPHNEIWXQAVMV-UHFFFAOYSA-N	0	3	344.459	3.115	20	30		EGEDHN
Oc1cccc2c1C[C@@H](NCC#Cc1ccc(OC(F)(F)F)cc1)C2	ZINC000429246565	458298437	/nfs/dbraw/zinc/29/84/37/458298437.db2.gz	OJKOSEWNAQCPEP-HNNXBMFYSA-N	0	3	347.336	3.399	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NC(=O)N1CC[C@]2(C1)CCCN(C)C2	ZINC000413825677	458308485	/nfs/dbraw/zinc/30/84/85/458308485.db2.gz	GSWPYOBDTGVEKF-TZIWHRDSSA-N	0	3	341.499	3.301	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)NC(=O)N(C)C[C@H]1CCCN(C)C1	ZINC000413828487	458308803	/nfs/dbraw/zinc/30/88/03/458308803.db2.gz	UXXGLVTXBXLRFY-OALUTQOASA-N	0	3	329.488	3.157	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)NC(=O)N(C)CC1(N(C)C)CCC1	ZINC000413840810	458310446	/nfs/dbraw/zinc/31/04/46/458310446.db2.gz	WBQBFNBCVCEONZ-SFHVURJKSA-N	0	3	329.488	3.300	20	30		EGEDHN
COC(=O)[C@@H]1CN(Cc2ccc(C#N)cc2F)C[C@H]1c1ccccc1	ZINC000369700172	458319591	/nfs/dbraw/zinc/31/95/91/458319591.db2.gz	ACEGPBDAMXDALI-ZWKOTPCHSA-N	0	3	338.382	3.086	20	30		EGEDHN
CN1CCc2ccc(C(=O)C(C#N)c3cnc4ccccc4n3)cc21	ZINC000447628000	458324155	/nfs/dbraw/zinc/32/41/55/458324155.db2.gz	FABGDORBYNVKJT-OAHLLOKOSA-N	0	3	328.375	3.112	20	30		EGEDHN
C[C@H](CC#N)Sc1ccccc1NC(=O)N1C[C@@H](C)NC[C@@H]1C	ZINC000415161575	458329454	/nfs/dbraw/zinc/32/94/54/458329454.db2.gz	MSFXGFYIQAHQJW-HZSPNIEDSA-N	0	3	332.473	3.295	20	30		EGEDHN
N#Cc1ccc2c(c1)CCN2C(=O)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000416022198	458336735	/nfs/dbraw/zinc/33/67/35/458336735.db2.gz	QBVOPFPMMAHISC-FQEVSTJZSA-N	0	3	345.446	3.360	20	30		EGEDHN
Cc1cc(C#N)ccc1Oc1ccc(C(=O)NCC2(N(C)C)CC2)cc1	ZINC000416310006	458342243	/nfs/dbraw/zinc/34/22/43/458342243.db2.gz	XTXQQHJJDSKVBI-UHFFFAOYSA-N	0	3	349.434	3.483	20	30		EGEDHN
C=CCOc1ccc(C(F)(F)F)cc1C(=O)NCC1(N(C)C)CC1	ZINC000416303428	458342319	/nfs/dbraw/zinc/34/23/19/458342319.db2.gz	RIUKBAJYCOLMEL-UHFFFAOYSA-N	0	3	342.361	3.094	20	30		EGEDHN
CN(C)CCN(Cc1ccsc1)C(=O)Nc1ccc(F)cc1C#N	ZINC000459431391	458368747	/nfs/dbraw/zinc/36/87/47/458368747.db2.gz	FGBVRCWJEFEQMH-UHFFFAOYSA-N	0	3	346.431	3.355	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)NC[C@H]1NCCc2ccccc21	ZINC000418628247	458375962	/nfs/dbraw/zinc/37/59/62/458375962.db2.gz	CBUUDCFIZNNPQK-GOSISDBHSA-N	0	3	341.480	3.333	20	30		EGEDHN
C=CCC[C@H]1NC(=O)N(CC(C)(C)N[C@@H](C)c2ccccc2)C1=O	ZINC000419994620	458395449	/nfs/dbraw/zinc/39/54/49/458395449.db2.gz	HLHRHPNEZHJLRP-GOEBONIOSA-N	0	3	329.444	3.002	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)NCc1ccc(C#N)s1)C(C)C	ZINC000420892870	458404232	/nfs/dbraw/zinc/40/42/32/458404232.db2.gz	UVUMTZRTKDUMSW-QGZVFWFLSA-N	0	3	346.500	3.118	20	30		EGEDHN
C[C@H]1C[C@@]1(C#N)C(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1	ZINC000448768231	458408841	/nfs/dbraw/zinc/40/88/41/458408841.db2.gz	PQFRJJPXUSSANA-HQRMLTQVSA-N	0	3	325.456	3.126	20	30		EGEDHN
C=CCCCCCCNC(=O)N1CCN(C2CCOCC2)C[C@@H]1C	ZINC000376898160	458417543	/nfs/dbraw/zinc/41/75/43/458417543.db2.gz	VNKZXHAJJWUXFN-KRWDZBQOSA-N	0	3	337.508	3.018	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1c(C)onc1C1CC1)C(C)C	ZINC000448976095	458417766	/nfs/dbraw/zinc/41/77/66/458417766.db2.gz	RZQKUGDQVTWYIH-MRXNPFEDSA-N	0	3	331.460	3.289	20	30		EGEDHN
C=CCC[C@@H](CO)N[C@@H](C)c1ccc(OC)cc1Br	ZINC000449696341	458429945	/nfs/dbraw/zinc/42/99/45/458429945.db2.gz	HUVYVUQHGRXNJW-RYUDHWBXSA-N	0	3	328.250	3.435	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1CNC(=O)c1ccc(CN(CC)C2CC2)cc1	ZINC000437519978	458461270	/nfs/dbraw/zinc/46/12/70/458461270.db2.gz	WYCIBUOPDBKRNY-AZUAARDMSA-N	0	3	342.483	3.382	20	30		EGEDHN
CC(C)(C)c1cnc(C(C#N)C(=O)c2ccnn2CC(F)F)s1	ZINC000430636047	458474808	/nfs/dbraw/zinc/47/48/08/458474808.db2.gz	XGZGCYOZYCDBTO-SECBINFHSA-N	0	3	338.383	3.392	20	30		EGEDHN
CC(C)(CCC#N)CNC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000377164852	458479865	/nfs/dbraw/zinc/47/98/65/458479865.db2.gz	YNRGGEJZVXWHTP-UHFFFAOYSA-N	0	3	327.472	3.345	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCc1cc([N+](=O)[O-])ccc1C(F)(F)F	ZINC000451680191	458485247	/nfs/dbraw/zinc/48/52/47/458485247.db2.gz	IVMYXJSIHZRPHU-KGLIPLIRSA-N	0	3	330.306	3.437	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@@H]1CCCO[C@H]1C=C	ZINC000451678164	458485369	/nfs/dbraw/zinc/48/53/69/458485369.db2.gz	WIXQSXJXBUMPKJ-ZBFHGGJFSA-N	0	3	332.469	3.226	20	30		EGEDHN
CC[C@H]1CN(CC)CCN1CC#Cc1ccc(OC(F)(F)F)cc1	ZINC000451743287	458486279	/nfs/dbraw/zinc/48/62/79/458486279.db2.gz	TVTXSHDORICLKH-INIZCTEOSA-N	0	3	340.389	3.353	20	30		EGEDHN
CC(C)Cc1ccc([C@H](CNC(=O)[C@@]2(C#N)C[C@H]2C)N(C)C)cc1	ZINC000451773887	458487095	/nfs/dbraw/zinc/48/70/95/458487095.db2.gz	NMNPZLZOYOYOOB-MOXGXCLJSA-N	0	3	327.472	3.154	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCOC[C@@H]1[C@@H]1CCCN1C(=O)OC(C)(C)C	ZINC000373422617	458488694	/nfs/dbraw/zinc/48/86/94/458488694.db2.gz	OOUCXCBTALJHRH-ZNMIVQPWSA-N	0	3	344.883	3.133	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NCC(C)(C)N[C@H](C)c1ccccc1	ZINC000437834546	458499935	/nfs/dbraw/zinc/49/99/35/458499935.db2.gz	FJRQYEGXYAPIBU-OXQOHEQNSA-N	0	3	332.488	3.461	20	30		EGEDHN
CCN(Cc1ccc(C(=O)N[C@H]2CC[C@@H](CC#N)C2)cc1)C1CC1	ZINC000452563916	458503581	/nfs/dbraw/zinc/50/35/81/458503581.db2.gz	WSPPYXZVJZRUIZ-YJBOKZPZSA-N	0	3	325.456	3.483	20	30		EGEDHN
C=C(C)Cn1c(CC(C)C)nnc1N1CCN([C@@H]2C[C@H]2C)C[C@H](C)C1	ZINC000453452112	458531724	/nfs/dbraw/zinc/53/17/24/458531724.db2.gz	LONQDNNPSPOYIC-RCCFBDPRSA-N	0	3	345.535	3.219	20	30		EGEDHN
CCc1ccc(-c2csc(NC(=O)[C@@H](N)CCCC#N)n2)s1	ZINC000424066447	458548863	/nfs/dbraw/zinc/54/88/63/458548863.db2.gz	NHYKCAUZXKNUOJ-NSHDSACASA-N	0	3	334.470	3.394	20	30		EGEDHN
Cc1ccc(-c2csc(NC(=O)[C@@H](N)CCCC#N)n2)c(C)c1	ZINC000424063746	458549392	/nfs/dbraw/zinc/54/93/92/458549392.db2.gz	IQBZIZOCBPKTFC-AWEZNQCLSA-N	0	3	328.441	3.387	20	30		EGEDHN
CC(C)COc1ccc(C(C)(C)CNC(=O)[C@@H](N)CCCC#N)cc1	ZINC000424111588	458561250	/nfs/dbraw/zinc/56/12/50/458561250.db2.gz	AVHZRQQWEALHQE-SFHVURJKSA-N	0	3	345.487	3.136	20	30		EGEDHN
C[C@H](Cc1ccc(Cl)cc1Cl)NC(=O)[C@@H](N)CCCC#N	ZINC000424117918	458562123	/nfs/dbraw/zinc/56/21/23/458562123.db2.gz	ZOKDHVUDYNZKGB-YGRLFVJLSA-N	0	3	328.243	3.062	20	30		EGEDHN
C[C@@H](CCNC(=O)[C@H](N)CCCC#N)c1cccc(C(F)(F)F)c1	ZINC000424126668	458565546	/nfs/dbraw/zinc/56/55/46/458565546.db2.gz	TWUCKHUEHFNKCI-SWLSCSKDSA-N	0	3	341.377	3.336	20	30		EGEDHN
CCOc1ccccc1[C@@H](CC(C)C)NC(=O)[C@@H](N)CCCC#N	ZINC000424126456	458565571	/nfs/dbraw/zinc/56/55/71/458565571.db2.gz	PAGCASOBMJWLBX-DLBZAZTESA-N	0	3	331.460	3.310	20	30		EGEDHN
Cc1ccc(CNC(=O)[C@H](N)CCCC#N)c(OCCC(C)C)c1	ZINC000424126712	458565665	/nfs/dbraw/zinc/56/56/65/458565665.db2.gz	PQDXMDFSMGOTDA-QGZVFWFLSA-N	0	3	331.460	3.057	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1ccc(OCC(F)(F)F)c(Cl)c1	ZINC000424163976	458574688	/nfs/dbraw/zinc/57/46/88/458574688.db2.gz	BERDGRBKMVIICX-LLVKDONJSA-N	0	3	349.740	3.241	20	30		EGEDHN
C[C@@H](Cc1c(Cl)cccc1Cl)NC(=O)[C@@H](N)CCCC#N	ZINC000424172429	458576457	/nfs/dbraw/zinc/57/64/57/458576457.db2.gz	NXTSRCAYISUYRS-HZMBPMFUSA-N	0	3	328.243	3.062	20	30		EGEDHN
C=C(C)CCNC(=O)N(C)CCC1CCN(c2ccncc2)CC1	ZINC000455329790	458594066	/nfs/dbraw/zinc/59/40/66/458594066.db2.gz	TYPIYXSJAJTMPG-UHFFFAOYSA-N	0	3	330.476	3.296	20	30		EGEDHN
CC(C)(C)CCN1CCN(C(=O)Nc2cnc(C#N)c(Cl)c2)CC1	ZINC000455782927	458614546	/nfs/dbraw/zinc/61/45/46/458614546.db2.gz	KJMMSKDKAUKELR-UHFFFAOYSA-N	0	3	349.866	3.192	20	30		EGEDHN
Cc1cc(C#N)cc(NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)c1	ZINC000455957987	458624920	/nfs/dbraw/zinc/62/49/20/458624920.db2.gz	RDTSJJUKBLHUBM-SFHVURJKSA-N	0	3	340.402	3.430	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N1CCN(Cc2ccccc2)C[C@@H](C)C1	ZINC000456321520	458637987	/nfs/dbraw/zinc/63/79/87/458637987.db2.gz	CUTGRXYYYOEKGY-WIYYLYMNSA-N	0	3	344.499	3.196	20	30		EGEDHN
CC#CCCNC(=O)NC[C@H](c1ccc(Cl)cc1)N(C)CCC	ZINC000502116317	458638317	/nfs/dbraw/zinc/63/83/17/458638317.db2.gz	SWQDCBZNKBQLRE-QGZVFWFLSA-N	0	3	335.879	3.436	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN1CCCC[C@@H]1[C@@H]1C[C@H](C)CC[C@@H]1O	ZINC000439006200	458640181	/nfs/dbraw/zinc/64/01/81/458640181.db2.gz	GPWZMWXBCZLEBW-HCXYKTFWSA-N	0	3	336.520	3.063	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N1CCN(Cc2ccccc2)C[C@@H](C)C1	ZINC000456353128	458642236	/nfs/dbraw/zinc/64/22/36/458642236.db2.gz	ZEUGNHFWNBFZPM-QGZVFWFLSA-N	0	3	347.462	3.461	20	30		EGEDHN
CC1CCN(CCNc2c(C#N)cnc3c(F)c(F)c(F)cc32)CC1	ZINC000439102240	458654134	/nfs/dbraw/zinc/65/41/34/458654134.db2.gz	VOVCDFRQWLQWJT-UHFFFAOYSA-N	0	3	348.372	3.089	20	30		EGEDHN
C[C@@H](NC(C)(C)CNC(=O)NCC#Cc1ccccc1)c1ccccc1	ZINC000502809272	458671097	/nfs/dbraw/zinc/67/10/97/458671097.db2.gz	BRBRWAPKSKHDRH-GOSISDBHSA-N	0	3	349.478	3.467	20	30		EGEDHN
C=C(C)CN[C@H](C)c1ccc(Br)cc1OCCCO	ZINC000463361990	458692068	/nfs/dbraw/zinc/69/20/68/458692068.db2.gz	QWWZTVWVRGEDLG-GFCCVEGCSA-N	0	3	328.250	3.437	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1)C(C)C	ZINC000503435825	458708216	/nfs/dbraw/zinc/70/82/16/458708216.db2.gz	IAIKAVRDVSHIGC-QGZVFWFLSA-N	0	3	346.431	3.415	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CC(COc2ccccc2)C1	ZINC000494802471	458747014	/nfs/dbraw/zinc/74/70/14/458747014.db2.gz	ZUXAWFKJRBFYCW-LJQANCHMSA-N	0	3	334.419	3.296	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN2CCC[C@@H]2/C=C/c2ccccc2)cc1	ZINC000505899770	458749506	/nfs/dbraw/zinc/74/95/06/458749506.db2.gz	AJULLHVYMLBXQT-AZHXHMFBSA-N	0	3	348.446	3.476	20	30		EGEDHN
C[C@@H](N[C@@H](C)c1ccc(-c2ccncc2)cc1)C(=O)NC1(C#N)CCC1	ZINC000530337201	458750515	/nfs/dbraw/zinc/75/05/15/458750515.db2.gz	UNWFDOGZSKIQCY-JKSUJKDBSA-N	0	3	348.450	3.350	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN(C)CCc1ccc(F)cc1	ZINC000508481760	458759813	/nfs/dbraw/zinc/75/98/13/458759813.db2.gz	AHNJBMYGYMBSKR-FQEVSTJZSA-N	0	3	343.442	3.468	20	30		EGEDHN
C=CCn1c(-c2ccccc2F)nnc1N1CCN(C)[C@@H](C(C)C)C1	ZINC000508901159	458766952	/nfs/dbraw/zinc/76/69/52/458766952.db2.gz	DXHCIQJYCRENMT-QGZVFWFLSA-N	0	3	343.450	3.047	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@H](C)Oc2ccc3ccccc3c2)CC1	ZINC000472105562	458768436	/nfs/dbraw/zinc/76/84/36/458768436.db2.gz	GKGZLNWOUBDAFB-INIZCTEOSA-N	0	3	338.451	3.374	20	30		EGEDHN
C=CCn1c(CC(C)(C)C)nnc1N1CC[C@H](N2CCCCC2)C1	ZINC000508993376	458769143	/nfs/dbraw/zinc/76/91/43/458769143.db2.gz	COIKCVBIJIDFNC-INIZCTEOSA-N	0	3	331.508	3.117	20	30		EGEDHN
CN1CCC[C@@H](CNC(=O)N[C@@H]2CC[C@H](C#N)C2)[C@H]1c1cccs1	ZINC000515469289	458809552	/nfs/dbraw/zinc/80/95/52/458809552.db2.gz	YWBKEZZEOIQAPT-MPTYRVRUSA-N	0	3	346.500	3.122	20	30		EGEDHN
C=C[C@H]1CCCCN1C(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000495198431	458809811	/nfs/dbraw/zinc/80/98/11/458809811.db2.gz	BQMZSYHFAAKYPE-OALUTQOASA-N	0	3	327.472	3.401	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC[C@H](CN(C)C)c1ccc(Cl)cc1	ZINC000516557317	458818397	/nfs/dbraw/zinc/81/83/97/458818397.db2.gz	IQJDKMXRLKADLT-GDBMZVCRSA-N	0	3	338.879	3.083	20	30		EGEDHN
CC(C)(C)OC(=O)CN[C@@]1(C)CCN(CCCCC(C)(C)C#N)C1	ZINC000440514739	458821864	/nfs/dbraw/zinc/82/18/64/458821864.db2.gz	XWQNNKJDTWAHJW-IBGZPJMESA-N	0	3	337.508	3.102	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCc1ccc(OCCN2CCCC2)cc1	ZINC000473542191	458834195	/nfs/dbraw/zinc/83/41/95/458834195.db2.gz	AMISKBVQKLTOLX-FQEVSTJZSA-N	0	3	330.472	3.380	20	30		EGEDHN
C=C(C)Cn1c(-c2ccccc2)nnc1N1CCN(CC2CC2)CC1	ZINC000549322511	458880355	/nfs/dbraw/zinc/88/03/55/458880355.db2.gz	WFVMZMFJBDUOBH-UHFFFAOYSA-N	0	3	337.471	3.053	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cnc(C(C)(C)C)nc1)C(C)C	ZINC000554324242	458897684	/nfs/dbraw/zinc/89/76/84/458897684.db2.gz	OXRZKIKNGTUWNZ-KRWDZBQOSA-N	0	3	344.503	3.203	20	30		EGEDHN
C[C@@]1(c2ccccc2)CCCN(Cc2cnc3c(C#N)cnn3c2)C1	ZINC000519156716	458920951	/nfs/dbraw/zinc/92/09/51/458920951.db2.gz	HEBBMBSDINGTPG-HXUWFJFHSA-N	0	3	331.423	3.155	20	30		EGEDHN
C[C@]1(c2ccccc2)CCCN(Cc2cnc3c(C#N)cnn3c2)C1	ZINC000519156715	458921426	/nfs/dbraw/zinc/92/14/26/458921426.db2.gz	HEBBMBSDINGTPG-FQEVSTJZSA-N	0	3	331.423	3.155	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc(N(C)C)cc2C)CC1	ZINC000519286048	458931587	/nfs/dbraw/zinc/93/15/87/458931587.db2.gz	UCCANIVOOWCRRM-UHFFFAOYSA-N	0	3	330.476	3.223	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)[C@@H]1OCCc2ccccc21)C(C)C	ZINC000441492530	458954451	/nfs/dbraw/zinc/95/44/51/458954451.db2.gz	VQIUJWGSPBMUSL-VQTJNVASSA-N	0	3	342.483	3.115	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)C2(C#N)CC(C)C2)N2CCCC2)cc1	ZINC000531816035	458982858	/nfs/dbraw/zinc/98/28/58/458982858.db2.gz	FGLFRDBMEBBRPW-IPCDKGFNSA-N	0	3	325.456	3.188	20	30		EGEDHN
C[C@H]1C[C@@H](Nc2c(C#N)cnc3c(F)cc(F)cc32)CN1C1CC1	ZINC000566770344	458996335	/nfs/dbraw/zinc/99/63/35/458996335.db2.gz	RWBITBBDVSQQQZ-GXFFZTMASA-N	0	3	328.366	3.422	20	30		EGEDHN
CC[C@@H](CNCc1ccc(O[C@@H](C)C#N)cc1)NC(=O)OC(C)(C)C	ZINC000495916261	459004458	/nfs/dbraw/zinc/00/44/58/459004458.db2.gz	UUIWFPPICNQUGJ-HOCLYGCPSA-N	0	3	347.459	3.370	20	30		EGEDHN
CC(C)CN(CC(=O)NC1(C#N)CCCCC1)Cc1ccccc1	ZINC000519906633	459020875	/nfs/dbraw/zinc/02/08/75/459020875.db2.gz	NOAKIYUQNPWPNV-UHFFFAOYSA-N	0	3	327.472	3.487	20	30		EGEDHN
CN1CCC[C@H](CNC(=O)NCC2(C#N)CCC2)[C@H]1c1cccs1	ZINC000567097458	459046906	/nfs/dbraw/zinc/04/69/06/459046906.db2.gz	ILXGOIZBMRMIHZ-ZBFHGGJFSA-N	0	3	346.500	3.124	20	30		EGEDHN
C=CCN(Cc1cccs1)C[C@](C)(O)CNC(=O)OC(C)(C)C	ZINC000496061879	459051796	/nfs/dbraw/zinc/05/17/96/459051796.db2.gz	OGWZXUWFERFDMO-QGZVFWFLSA-N	0	3	340.489	3.012	20	30		EGEDHN
N#CCCCN1CCC([C@H]2C[C@@H]2NC(=O)OCc2ccccc2)CC1	ZINC000496128005	459077281	/nfs/dbraw/zinc/07/72/81/459077281.db2.gz	JOLVZKFLTUHYOD-MOPGFXCFSA-N	0	3	341.455	3.317	20	30		EGEDHN
C=CC1CCN(C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)CC1	ZINC000557885843	459116600	/nfs/dbraw/zinc/11/66/00/459116600.db2.gz	WAQUIGNZNJMCCJ-VQIMIIECSA-N	0	3	327.472	3.257	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](N3CCN(C(C)C)CC3)C2)CCCCC1	ZINC000590677283	459178462	/nfs/dbraw/zinc/17/84/62/459178462.db2.gz	QYXVACSKFFSKOD-LJQANCHMSA-N	0	3	347.547	3.140	20	30		EGEDHN
CCN(CCC#N)C(=O)CS[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000567859540	459179487	/nfs/dbraw/zinc/17/94/87/459179487.db2.gz	GNGAGPKQNBOCEV-GOSISDBHSA-N	0	3	345.512	3.146	20	30		EGEDHN
CO[C@@](C)(CNCc1ccc(C#N)cc1F)COCc1ccccc1	ZINC000594975749	459202884	/nfs/dbraw/zinc/20/28/84/459202884.db2.gz	TYEKESPDICZTTL-FQEVSTJZSA-N	0	3	342.414	3.409	20	30		EGEDHN
CCCN(Cc1cnc2c(C#N)cnn2c1)[C@@H]1C[C@H](OCC)C1(C)C	ZINC000578508032	459212390	/nfs/dbraw/zinc/21/23/90/459212390.db2.gz	KVUUZLKKTOQWNX-SJORKVTESA-N	0	3	341.459	3.017	20	30		EGEDHN
C=C(C)Cn1c(CC2CCCCC2)nnc1N1CCN2CCC[C@@H]2C1	ZINC000558984425	459228125	/nfs/dbraw/zinc/22/81/25/459228125.db2.gz	VCYBLRQIXQSFBJ-GOSISDBHSA-N	0	3	343.519	3.261	20	30		EGEDHN
C=C(C)Cn1c(CCCC)nnc1N1CCN(C2CCCC2)CC1	ZINC000580348812	459258699	/nfs/dbraw/zinc/25/86/99/459258699.db2.gz	DOUWDKNKSXNSKK-UHFFFAOYSA-N	0	3	331.508	3.261	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CCC(CCC#N)CC1	ZINC000580711868	459263397	/nfs/dbraw/zinc/26/33/97/459263397.db2.gz	OWOCRFXNOQFXHA-IBGZPJMESA-N	0	3	328.456	3.171	20	30		EGEDHN
Cc1cc([C@@H](C)NC[C@@H](O)COc2ccc(CC#N)cc2)ccc1F	ZINC000581291725	459270821	/nfs/dbraw/zinc/27/08/21/459270821.db2.gz	IUXIJQADGGWYFE-CRAIPNDOSA-N	0	3	342.414	3.291	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)N1CCC[C@H](CC#N)C1)c1ccccc1	ZINC000595428290	459298075	/nfs/dbraw/zinc/29/80/75/459298075.db2.gz	XBSBNGZIBHUKPI-MJGOQNOKSA-N	0	3	342.487	3.405	20	30		EGEDHN
C=CC1CCN(C[C@@H](O)COc2ccc(Br)cc2)CC1	ZINC000523607560	459316138	/nfs/dbraw/zinc/31/61/38/459316138.db2.gz	IXGGFLRZTZWNBM-OAHLLOKOSA-N	0	3	340.261	3.087	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2N[C@@H]1CCN(c2ccc(F)cc2)C1=O	ZINC000591255929	459342221	/nfs/dbraw/zinc/34/22/21/459342221.db2.gz	HTDPYDXUMRAABQ-WOJBJXKFSA-N	0	3	349.409	3.470	20	30		EGEDHN
CC(C)(C)OC(=O)CC1(NCc2ccc(CC#N)cc2)CCOCC1	ZINC000595549022	459343197	/nfs/dbraw/zinc/34/31/97/459343197.db2.gz	FNXGQVRKWNDUNK-UHFFFAOYSA-N	0	3	344.455	3.123	20	30		EGEDHN
C[C@]12CN(Cc3nnc(-c4cccc(C#N)c4)o3)C[C@H]1[C@@H]1CC[C@H]2C1	ZINC000568833567	459351948	/nfs/dbraw/zinc/35/19/48/459351948.db2.gz	ZNLBFUYWNFXXSU-HSSOGYSNSA-N	0	3	334.423	3.476	20	30		EGEDHN
N#Cc1cnn2cc(CNCCCCCOC3CCCCC3)cnc12	ZINC000568866182	459357000	/nfs/dbraw/zinc/35/70/00/459357000.db2.gz	HGGPLIUBEGWUJY-UHFFFAOYSA-N	0	3	341.459	3.210	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1OC(F)F)[C@@H](CO)Cc1ccccc1	ZINC000595599835	459360759	/nfs/dbraw/zinc/36/07/59/459360759.db2.gz	ZZRDTUIWUXMCON-QGZVFWFLSA-N	0	3	346.377	3.195	20	30		EGEDHN
CC[C@@H](CN1CCCC1)NC(=O)N[C@@H]1CCCc2cc(C#N)ccc21	ZINC000591391206	459369475	/nfs/dbraw/zinc/36/94/75/459369475.db2.gz	QMMYBPIVYWSLQA-PKOBYXMFSA-N	0	3	340.471	3.109	20	30		EGEDHN
COc1cc(CN[C@@H]2CCC[C@@H]2NC(=O)OC(C)(C)C)ccc1C#N	ZINC000497025386	459409292	/nfs/dbraw/zinc/40/92/92/459409292.db2.gz	KOLFBMGEQVVWOA-CVEARBPZSA-N	0	3	345.443	3.102	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cnc(C2CC2)s1)C(C)C	ZINC000591643501	459418222	/nfs/dbraw/zinc/41/82/22/459418222.db2.gz	UWXQOPZRKIOBJR-HNNXBMFYSA-N	0	3	333.501	3.449	20	30		EGEDHN
N#C[C@H]1CC[C@@H](NC[C@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000591771490	459432404	/nfs/dbraw/zinc/43/24/04/459432404.db2.gz	KONRGSLARVOPDO-TUAOUCFPSA-N	0	3	329.227	3.015	20	30		EGEDHN
C=CCN(CC(=O)NCc1cccc(OC)c1)CC1CCCCC1	ZINC000484969433	459436830	/nfs/dbraw/zinc/43/68/30/459436830.db2.gz	HNDCOPHUKNQQIM-UHFFFAOYSA-N	0	3	330.472	3.380	20	30		EGEDHN
C[C@H](CN1CCC(C)CC1)NC(=O)N(C)[C@@H](C)c1cccc(C#N)c1	ZINC000595786004	459440432	/nfs/dbraw/zinc/44/04/32/459440432.db2.gz	OUNMFAZYAAFJNE-SJORKVTESA-N	0	3	342.487	3.381	20	30		EGEDHN
Cc1ccccc1[C@H]([C@H](C)Nc1nccc(C#N)c1Cl)N(C)C	ZINC000561408591	459450101	/nfs/dbraw/zinc/45/01/01/459450101.db2.gz	PLTNWDXQJYDGFO-GUYCJALGSA-N	0	3	328.847	3.440	20	30		EGEDHN
Cc1cc(C#N)cnc1C(=O)NCC(C)(C)N[C@@H](C)c1ccccc1	ZINC000582919138	459451790	/nfs/dbraw/zinc/45/17/90/459451790.db2.gz	RWNISXKOSRNLHD-HNNXBMFYSA-N	0	3	336.439	3.121	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCN2CC[C@@H](Oc3ccccc3)C2)cc1	ZINC000595831066	459456396	/nfs/dbraw/zinc/45/63/96/459456396.db2.gz	MHKKNBHENLIDRI-LJQANCHMSA-N	0	3	335.407	3.040	20	30		EGEDHN
N#C[C@H]1CC[C@@H](NC(=O)N[C@H](CN2CCCCC2)c2ccccc2)C1	ZINC000591867039	459457980	/nfs/dbraw/zinc/45/79/80/459457980.db2.gz	AHTRRRVUMOIQBM-QXAKKESOSA-N	0	3	340.471	3.205	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccc(Cl)c(C#N)c2)CCN(C2CCC2)C1	ZINC000561531550	459462127	/nfs/dbraw/zinc/46/21/27/459462127.db2.gz	BAEQJBDOECYPQR-ZDUSSCGKSA-N	0	3	331.847	3.158	20	30		EGEDHN
CC(C)n1cc([C@H](C)NCCC(=O)Nc2cccc(C#N)c2)cn1	ZINC000541646165	459477819	/nfs/dbraw/zinc/47/78/19/459477819.db2.gz	YOBDSVXDHMIQPI-AWEZNQCLSA-N	0	3	325.416	3.015	20	30		EGEDHN
C=C(C)CN1CCC([C@@H]2OCCC[C@H]2NC(=O)OC(C)(C)C)CC1	ZINC000497210241	459487461	/nfs/dbraw/zinc/48/74/61/459487461.db2.gz	ADVFUYJVEUONOT-SJORKVTESA-N	0	3	338.492	3.347	20	30		EGEDHN
C=C(C)CN1CCC([C@@H]2OCCC[C@@H]2NC(=O)OC(C)(C)C)CC1	ZINC000497210240	459487524	/nfs/dbraw/zinc/48/75/24/459487524.db2.gz	ADVFUYJVEUONOT-IRXDYDNUSA-N	0	3	338.492	3.347	20	30		EGEDHN
CN1CCC[C@@H](CNC(=O)Nc2ccc(OC(C)(C)C)c(C#N)c2)C1	ZINC000583127609	459487877	/nfs/dbraw/zinc/48/78/77/459487877.db2.gz	SBXHEYVXSYWEDL-AWEZNQCLSA-N	0	3	344.459	3.199	20	30		EGEDHN
N#Cc1cccc(OCCCN[C@@H](CCO)c2ccccc2F)c1	ZINC000592162226	459540789	/nfs/dbraw/zinc/54/07/89/459540789.db2.gz	VRKYZKVOSPXVPA-IBGZPJMESA-N	0	3	328.387	3.180	20	30		EGEDHN
Cc1ccc(NC(=O)C2(CNC(=O)C(C)C#N)CCCC2)cc1C	ZINC000488244258	459540904	/nfs/dbraw/zinc/54/09/04/459540904.db2.gz	BUUPDLWUBIYQLF-HNNXBMFYSA-N	0	3	327.428	3.078	20	30		EGEDHN
N#Cc1ccc([C@H](N[C@@H]2CC[C@H](Cc3ccccc3)C2)C(N)=O)cc1	ZINC000526121177	459551808	/nfs/dbraw/zinc/55/18/08/459551808.db2.gz	JWWCTKDKWIFAJQ-RLLQIKCJSA-N	0	3	333.435	3.086	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@@H](C1CC1)N(C)Cc1ccccc1	ZINC000488900336	459556094	/nfs/dbraw/zinc/55/60/94/459556094.db2.gz	RIOYHJOLFKBOMK-FQEVSTJZSA-N	0	3	337.467	3.315	20	30		EGEDHN
C=CCN(Cc1ccncc1C)[C@H](C)c1cccc(-n2cnnn2)c1	ZINC000570592544	459557841	/nfs/dbraw/zinc/55/78/41/459557841.db2.gz	RSHPSRJEHXPCSY-MRXNPFEDSA-N	0	3	334.427	3.115	20	30		EGEDHN
C=CCn1cccc1C(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1	ZINC000489056685	459560087	/nfs/dbraw/zinc/56/00/87/459560087.db2.gz	YVYGPPNQLQKKLF-UHFFFAOYSA-N	0	3	347.409	3.156	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CC[C@@H]2Cc2ccccc2)cc1	ZINC000526928271	459560771	/nfs/dbraw/zinc/56/07/71/459560771.db2.gz	UDTBYQAQTDLWSP-VQTJNVASSA-N	0	3	329.403	3.084	20	30		EGEDHN
CN(C(=O)Nc1cccc(C#N)n1)C1CCN(Cc2ccccc2)CC1	ZINC000592268614	459564782	/nfs/dbraw/zinc/56/47/82/459564782.db2.gz	NBCJSGCZWOCOEK-UHFFFAOYSA-N	0	3	349.438	3.082	20	30		EGEDHN
C=CCCCS(=O)(=O)NC1CCN([C@@H](C)c2ccccc2)CC1	ZINC000489494211	459565704	/nfs/dbraw/zinc/56/57/04/459565704.db2.gz	GTZDZCBCKUAYAI-INIZCTEOSA-N	0	3	336.501	3.098	20	30		EGEDHN
CC(C)[C@@H](NC(=O)C(C#N)CCc1ccccc1)C1(CO)CCC1	ZINC000571579282	459570253	/nfs/dbraw/zinc/57/02/53/459570253.db2.gz	DEYPJCHWZNDSML-ZWKOTPCHSA-N	0	3	328.456	3.062	20	30		EGEDHN
Cc1nc(COc2ccc(CNCc3ccc(CC#N)cc3)cc2)no1	ZINC000592371099	459582286	/nfs/dbraw/zinc/58/22/86/459582286.db2.gz	HUHAUXJTPKBPAI-UHFFFAOYSA-N	0	3	348.406	3.313	20	30		EGEDHN
C#CCN1CCC(C(=O)NC2CCC(c3ccc(F)cc3)CC2)CC1	ZINC000490938313	459591090	/nfs/dbraw/zinc/59/10/90/459591090.db2.gz	WXCGTSWGASVPKS-UHFFFAOYSA-N	0	3	342.458	3.313	20	30		EGEDHN
C[C@@H]1C[C@H]1c1ccc(CNC(=O)C(C#N)Cc2ccc(C#N)cc2)o1	ZINC000527159613	459599201	/nfs/dbraw/zinc/59/92/01/459599201.db2.gz	LYCNCJJLJMDDHK-RPVQJOFSSA-N	0	3	333.391	3.273	20	30		EGEDHN
C#CCNC(=O)C1CCN(Cc2ccc(-c3ccccc3)cc2)CC1	ZINC000491153610	459601826	/nfs/dbraw/zinc/60/18/26/459601826.db2.gz	BFYZYACUXGOZEB-UHFFFAOYSA-N	0	3	332.447	3.315	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)[C@]2(C#N)CC23CCCC3)C1	ZINC000562639552	459609159	/nfs/dbraw/zinc/60/91/59/459609159.db2.gz	AOCCSPUGZBWCBH-PLMTUMEDSA-N	0	3	337.467	3.412	20	30		EGEDHN
C=CCN(CCc1ccco1)C[C@H](O)COc1c(C)cccc1C	ZINC000491369746	459621440	/nfs/dbraw/zinc/62/14/40/459621440.db2.gz	WKMDSJZDRFNTOJ-SFHVURJKSA-N	0	3	329.440	3.367	20	30		EGEDHN
C=CCOc1ccc(CNCc2cc3ccccc3n(C)c2=O)cc1	ZINC000491500932	459631645	/nfs/dbraw/zinc/63/16/45/459631645.db2.gz	RKJRBNHDYKCCDY-UHFFFAOYSA-N	0	3	334.419	3.393	20	30		EGEDHN
C[C@@H](C#N)CN[C@@H](C)CCc1ccc(I)cc1	ZINC000527526562	459656315	/nfs/dbraw/zinc/65/63/15/459656315.db2.gz	IOBRMVPBUOERKN-RYUDHWBXSA-N	0	3	342.224	3.362	20	30		EGEDHN
C#C[C@H](NC1CCN(c2cnccn2)CC1)c1ccc(Cl)cc1	ZINC000491752885	459667491	/nfs/dbraw/zinc/66/74/91/459667491.db2.gz	XGONCKFBJSFABM-KRWDZBQOSA-N	0	3	326.831	3.063	20	30		EGEDHN
N#C[C@H](c1cccc(Cl)c1)N1CCN(C[C@H]2CCCC[C@H]2O)CC1	ZINC000584175469	459674619	/nfs/dbraw/zinc/67/46/19/459674619.db2.gz	AHJVXHHSJXTKKY-BHIYHBOVSA-N	0	3	347.890	3.073	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1ccc([C@H](C)C(F)(F)F)cc1	ZINC000491807494	459677878	/nfs/dbraw/zinc/67/78/78/459677878.db2.gz	BZKLCRRQBXPMOF-ZDUSSCGKSA-N	0	3	326.362	3.037	20	30		EGEDHN
Cc1cc(N2CCN(C3CCC3)CC2)n2c3ccccc3nc2c1C#N	ZINC000500411227	459678374	/nfs/dbraw/zinc/67/83/74/459678374.db2.gz	VZIDVXAUPLGWDI-UHFFFAOYSA-N	0	3	345.450	3.342	20	30		EGEDHN
C=CCN1CCC(NCc2ccc(Br)c(F)c2F)CC1	ZINC000527656194	459687143	/nfs/dbraw/zinc/68/71/43/459687143.db2.gz	DDWHQULUKNYBKY-UHFFFAOYSA-N	0	3	345.231	3.467	20	30		EGEDHN
C[C@@H]1CC2(CN1C(=O)C(C#N)CCc1ccccc1)CCOCC2	ZINC000592894632	459714824	/nfs/dbraw/zinc/71/48/24/459714824.db2.gz	NCSFWSMXAVDZQZ-SJLPKXTDSA-N	0	3	326.440	3.177	20	30		EGEDHN
C[C@@H](NC[C@H](O)COc1ccc(CC#N)cc1)c1ccccc1Cl	ZINC000573751498	459728313	/nfs/dbraw/zinc/72/83/13/459728313.db2.gz	LRKNCYDRFIKYOD-ZBFHGGJFSA-N	0	3	344.842	3.497	20	30		EGEDHN
N#CCc1ccc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)cc1	ZINC000593014664	459739762	/nfs/dbraw/zinc/73/97/62/459739762.db2.gz	CGCAPMNYRLOFIK-KGLIPLIRSA-N	0	3	326.318	3.439	20	30		EGEDHN
CCC[C@@H]1CN(Cc2ccccc2C(C)(C)C#N)CCN1CCOC	ZINC000501797313	459745361	/nfs/dbraw/zinc/74/53/61/459745361.db2.gz	XFXULFDGZAFAPG-LJQANCHMSA-N	0	3	343.515	3.420	20	30		EGEDHN
C[C@@H](C(=O)N(C)CCC#N)N1CCC2(CCc3ccccc3C2)CC1	ZINC000593038493	459750992	/nfs/dbraw/zinc/75/09/92/459750992.db2.gz	YZWNSMVIACGLAO-KRWDZBQOSA-N	0	3	339.483	3.018	20	30		EGEDHN
Cc1cccc(N(CCC#N)C(=O)CNC2(C3CCC3)CC2)c1C	ZINC000593082479	459767879	/nfs/dbraw/zinc/76/78/79/459767879.db2.gz	WGCWABMHRVRRFW-UHFFFAOYSA-N	0	3	325.456	3.472	20	30		EGEDHN
C=CCn1c(-c2ccccc2F)nnc1N1C[C@@H](C)N(CC)C[C@@H]1C	ZINC000564384505	459773571	/nfs/dbraw/zinc/77/35/71/459773571.db2.gz	OTXOWZDIRIUEPW-CABCVRRESA-N	0	3	343.450	3.189	20	30		EGEDHN
N#Cc1ccc2c(c1)N(C(=O)C(C[C@@H]1CCCO1)C(F)(F)F)CC2	ZINC000593108361	459775216	/nfs/dbraw/zinc/77/52/16/459775216.db2.gz	WFHBVFYLBCHHOK-UONOGXRCSA-N	0	3	338.329	3.195	20	30		EGEDHN
Cc1csc(C(C#N)=C([O-])c2ccc(O[C@H]3CCOC3)cc2)n1	ZINC000584697936	459783987	/nfs/dbraw/zinc/78/39/87/459783987.db2.gz	HKPVDJIMGQBZFT-GJZGRUSLSA-N	0	3	328.393	3.109	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)c2ccc(O[C@H]3CCOC3)cc2)n1	ZINC000584697936	459783993	/nfs/dbraw/zinc/78/39/93/459783993.db2.gz	HKPVDJIMGQBZFT-GJZGRUSLSA-N	0	3	328.393	3.109	20	30		EGEDHN
C[C@@H]1CC[C@@H](N(CC#Cc2ccc(OC(F)(F)F)cc2)CCO)C1	ZINC000565919520	459789404	/nfs/dbraw/zinc/78/94/04/459789404.db2.gz	DBICXAZVCBGXST-GDBMZVCRSA-N	0	3	341.373	3.420	20	30		EGEDHN
CCC(C#N)(CC)C(=O)NCc1ccc(OCCN2CCCC2)cc1	ZINC000528526463	459809106	/nfs/dbraw/zinc/80/91/06/459809106.db2.gz	JCEAUYFRNBWMPF-UHFFFAOYSA-N	0	3	343.471	3.107	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN2CCC[C@]3(CCc4ccccc4O3)C2)cc1	ZINC000528737720	459813147	/nfs/dbraw/zinc/81/31/47/459813147.db2.gz	WSLQQNBGARFBSG-IRLDBZIGSA-N	0	3	348.446	3.451	20	30		EGEDHN
N#CC(C(=O)NC1CCCCC1)C(=O)[C@@H]1Cc2c1cccc2Cl	ZINC000528919602	459817948	/nfs/dbraw/zinc/81/79/48/459817948.db2.gz	MHUQRNJIIVJUCC-CABCVRRESA-N	0	3	330.815	3.137	20	30		EGEDHN
CCC(C#N)(CC)C(=O)N1CC[C@@H](N(C)CCc2ccccc2)C1	ZINC000529520349	459830055	/nfs/dbraw/zinc/83/00/55/459830055.db2.gz	RZLQWUFCDDJFRE-GOSISDBHSA-N	0	3	327.472	3.092	20	30		EGEDHN
N#CCc1ccc(OC[C@H](O)CN2CCC=C(c3ccccc3)C2)cc1	ZINC000585756043	459841451	/nfs/dbraw/zinc/84/14/51/459841451.db2.gz	ZKIGQBGLIHRLQA-OAQYLSRUSA-N	0	3	348.446	3.282	20	30		EGEDHN
COc1ccccc1[C@@H]1C[C@H]1NC(=O)C(C#N)CCc1ccccc1	ZINC000598311127	459860654	/nfs/dbraw/zinc/86/06/54/459860654.db2.gz	UDBSYRHTQLJOCU-YTQUADARSA-N	0	3	334.419	3.440	20	30		EGEDHN
N#Cc1ccc(CC(=O)N[C@H](CN2CCCCC2)c2ccccc2)cc1	ZINC000609018397	459899761	/nfs/dbraw/zinc/89/97/61/459899761.db2.gz	XKCATBQCBMFSNW-OAQYLSRUSA-N	0	3	347.462	3.444	20	30		EGEDHN
CN(C)CCOc1cccc(-c2noc(-c3cccc(C#N)c3)n2)c1	ZINC000546384355	459914943	/nfs/dbraw/zinc/91/49/43/459914943.db2.gz	OLYFDNHUDTYKNQ-UHFFFAOYSA-N	0	3	334.379	3.216	20	30		EGEDHN
N#CCCCCCC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000588154678	459920229	/nfs/dbraw/zinc/92/02/29/459920229.db2.gz	BEIOXAKQMVKMKV-LJQANCHMSA-N	0	3	327.472	3.489	20	30		EGEDHN
CN(C)CCN(Cc1cc2cnccc2o1)Cc1ccc(C#N)cc1	ZINC000593627568	459936585	/nfs/dbraw/zinc/93/65/85/459936585.db2.gz	IHHSIWUOTYBIQJ-UHFFFAOYSA-N	0	3	334.423	3.263	20	30		EGEDHN
C=CCC1(NC(=O)[C@@H]2CCCN(Cc3ccccc3)C2)CCOCC1	ZINC000618246964	459938979	/nfs/dbraw/zinc/93/89/79/459938979.db2.gz	FDXUAUILASXNKC-LJQANCHMSA-N	0	3	342.483	3.140	20	30		EGEDHN
C[C@@H]1c2ccccc2CCN1C[C@@H](O)COc1ccc(CC#N)cc1	ZINC000609316941	459943120	/nfs/dbraw/zinc/94/31/20/459943120.db2.gz	DWDITGJYBHXVCZ-VQIMIIECSA-N	0	3	336.435	3.112	20	30		EGEDHN
COc1ccc(CN2CCC([C@H](C)CO)CC2)cc1OCCCC#N	ZINC000593677205	459947799	/nfs/dbraw/zinc/94/77/99/459947799.db2.gz	UKGLHMBWZHWFRU-MRXNPFEDSA-N	0	3	346.471	3.218	20	30		EGEDHN
CNc1ccc(C#N)cc1NC(=O)C(C[C@@H]1CCCO1)C(F)(F)F	ZINC000593678970	459948121	/nfs/dbraw/zinc/94/81/21/459948121.db2.gz	SUSSBTHUJUUTKJ-RYUDHWBXSA-N	0	3	341.333	3.286	20	30		EGEDHN
N#Cc1ccc(S(=O)(=O)CCNCCC2=CCCCCC2)cc1	ZINC000575252038	459955925	/nfs/dbraw/zinc/95/59/25/459955925.db2.gz	KKRSEBMREGEKFG-UHFFFAOYSA-N	0	3	332.469	3.202	20	30		EGEDHN
CCOc1ccc([C@@H](C)NC[C@H](O)CC(C)(C)C#N)cc1OCC	ZINC000598599281	459959173	/nfs/dbraw/zinc/95/91/73/459959173.db2.gz	IYPQLASIJGSTQT-GDBMZVCRSA-N	0	3	334.460	3.435	20	30		EGEDHN
Cc1ncc([C@H](C)NC2CCN(Cc3cccc(C#N)c3)CC2)c(C)n1	ZINC000593723748	459963843	/nfs/dbraw/zinc/96/38/43/459963843.db2.gz	YGXNQWQOJUUCRO-INIZCTEOSA-N	0	3	349.482	3.280	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1	ZINC000598621895	459966313	/nfs/dbraw/zinc/96/63/13/459966313.db2.gz	YNAIATXDNAAARJ-RDJZCZTQSA-N	0	3	331.416	3.075	20	30		EGEDHN
CC(C)(C)OC(=O)CC[C@@H]1CCCCN1C[C@@H](O)CC(C)(C)C#N	ZINC000598622129	459966430	/nfs/dbraw/zinc/96/64/30/459966430.db2.gz	LQKHBQYSWIFSQZ-HOTGVXAUSA-N	0	3	338.492	3.264	20	30		EGEDHN
Cc1c(CN2CCSCC2)cccc1NCc1cccc(C#N)n1	ZINC000602491002	459966997	/nfs/dbraw/zinc/96/69/97/459966997.db2.gz	MKGORIHOQXWQIH-UHFFFAOYSA-N	0	3	338.480	3.423	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN1CCC[C@@H]2O[C@H](c3ccccc3)C[C@@H]21	ZINC000598621687	459967433	/nfs/dbraw/zinc/96/74/33/459967433.db2.gz	BOUHWUVPSNXQNS-VJANTYMQSA-N	0	3	328.456	3.282	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN1CC2(CCOCC2)[C@H]1c1ccccc1	ZINC000598623195	459967693	/nfs/dbraw/zinc/96/76/93/459967693.db2.gz	VMMYLELXCMVNMU-ZWKOTPCHSA-N	0	3	328.456	3.141	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN(Cc1ccccc1)[C@H]1COC(C)(C)C1	ZINC000598626031	459969327	/nfs/dbraw/zinc/96/93/27/459969327.db2.gz	XPKDTBDEBVRSNB-MSOLQXFVSA-N	0	3	330.472	3.357	20	30		EGEDHN
C[C@@H](CC1(C#N)CCOCC1)NCc1ccccc1Cn1cccn1	ZINC000602501088	459971210	/nfs/dbraw/zinc/97/12/10/459971210.db2.gz	DHDZNKUEOBUXIL-KRWDZBQOSA-N	0	3	338.455	3.120	20	30		EGEDHN
C[C@@H](CC1(C#N)CCOCC1)NCc1cccc(Cn2cccn2)c1	ZINC000602517748	459979926	/nfs/dbraw/zinc/97/99/26/459979926.db2.gz	GLEZTHXSDAGKTI-KRWDZBQOSA-N	0	3	338.455	3.120	20	30		EGEDHN
CN1CCC(N(C(=O)c2cccc(CC#N)c2)c2ccccc2)CC1	ZINC000609566913	459983928	/nfs/dbraw/zinc/98/39/28/459983928.db2.gz	WSSWKOLOTYQUMI-UHFFFAOYSA-N	0	3	333.435	3.494	20	30		EGEDHN
C[C@H](CCC#N)CNCc1csc(CNC(=O)c2ccccc2)n1	ZINC000602572042	460003281	/nfs/dbraw/zinc/00/32/81/460003281.db2.gz	JKVRVTIXFVGDSP-CQSZACIVSA-N	0	3	342.468	3.103	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CNCc1ccc(Oc2cccc(F)c2)nc1	ZINC000598718687	460004765	/nfs/dbraw/zinc/00/47/65/460004765.db2.gz	CKFSFNRLUARARU-INIZCTEOSA-N	0	3	343.402	3.403	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CNCc1ccncc1OCc1ccccc1	ZINC000598728319	460008901	/nfs/dbraw/zinc/00/89/01/460008901.db2.gz	QLGIMEMWWPNJDD-GOSISDBHSA-N	0	3	339.439	3.051	20	30		EGEDHN
C=CCCCCCN(C)C(=O)NCC1(SC)CCN(C)CC1	ZINC000575964063	460040439	/nfs/dbraw/zinc/04/04/39/460040439.db2.gz	OINNHJGRJGVVIK-UHFFFAOYSA-N	0	3	327.538	3.202	20	30		EGEDHN
N#Cc1ccc(NC(=O)N[C@H]2CCCN3CCCC[C@H]23)c(Cl)c1	ZINC000594084983	460094603	/nfs/dbraw/zinc/09/46/03/460094603.db2.gz	UXESAVLUMICXID-JKSUJKDBSA-N	0	3	332.835	3.350	20	30		EGEDHN
CN(Cc1ccccc1)[C@H]1CCN(c2nc3c(cc2C#N)CCC3)C1	ZINC000610281731	460105410	/nfs/dbraw/zinc/10/54/10/460105410.db2.gz	CKZYECYQWQCADY-IBGZPJMESA-N	0	3	332.451	3.153	20	30		EGEDHN
C=C(C)COc1cccc(NC(=O)NCCN2CCC(C)CC2)c1	ZINC000589741121	460134775	/nfs/dbraw/zinc/13/47/75/460134775.db2.gz	STFHDWRCJFDSDB-UHFFFAOYSA-N	0	3	331.460	3.495	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN2CCC(C3CCCC3)CC2)cc1	ZINC000610370825	460138531	/nfs/dbraw/zinc/13/85/31/460138531.db2.gz	NDJNMORCZILMOB-LJQANCHMSA-N	0	3	328.456	3.200	20	30		EGEDHN
C[C@H]1CCc2c(F)cccc2[C@@H]1NCc1cnc2c(C#N)cnn2c1	ZINC000576466058	460147437	/nfs/dbraw/zinc/14/74/37/460147437.db2.gz	MKTJDPLGRRACBV-KPZWWZAWSA-N	0	3	335.386	3.153	20	30		EGEDHN
C[C@H](NC(=O)N1CCN(C2CCC2)C[C@H](C)C1)c1cccc(C#N)c1	ZINC000589893151	460156626	/nfs/dbraw/zinc/15/66/26/460156626.db2.gz	LJHQUNVWAOZYIQ-HOTGVXAUSA-N	0	3	340.471	3.135	20	30		EGEDHN
C[C@@H](CC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1)c1ccco1	ZINC000599089050	460158168	/nfs/dbraw/zinc/15/81/68/460158168.db2.gz	WROYPPHSHAFORI-INIZCTEOSA-N	0	3	339.439	3.235	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)C(=O)N1CCN(CCC(C)(C)C)CC1	ZINC000594245216	460170835	/nfs/dbraw/zinc/17/08/35/460170835.db2.gz	QICOHHNKZCYXFO-KRWDZBQOSA-N	0	3	341.499	3.317	20	30		EGEDHN
CC(C)(C#N)CCN1CC[C@@H](Oc2cncc(Br)c2)C1	ZINC000602889113	460173118	/nfs/dbraw/zinc/17/31/18/460173118.db2.gz	WQEBXVRXSNXWBU-CYBMUJFWSA-N	0	3	338.249	3.237	20	30		EGEDHN
C[C@@H](c1ccc(F)cc1)N(C)C[C@@H](O)COc1ccccc1C#N	ZINC000599249741	460207051	/nfs/dbraw/zinc/20/70/51/460207051.db2.gz	GQFASPYSZCFEIV-KBXCAEBGSA-N	0	3	328.387	3.130	20	30		EGEDHN
C[C@@H]1CO[C@@H](c2ccccc2Cl)CN1C(=O)[C@@H](N)CCCCC#N	ZINC000594433846	460218266	/nfs/dbraw/zinc/21/82/66/460218266.db2.gz	IBMJLPMEZXAOJW-XOKHGSTOSA-N	0	3	349.862	3.040	20	30		EGEDHN
CC[C@@H](NC[C@H](O)COc1ccccc1C#N)c1ccc(F)cc1F	ZINC000599355916	460236607	/nfs/dbraw/zinc/23/66/07/460236607.db2.gz	KDJDKNVUQPUOMB-MAUKXSAKSA-N	0	3	346.377	3.317	20	30		EGEDHN
CC(C)(C)[C@@H](N)c1cn(Cc2ccc(C#N)cc2Br)nn1	ZINC000603243807	460271190	/nfs/dbraw/zinc/27/11/90/460271190.db2.gz	OKYVZQMXCVPQTL-AWEZNQCLSA-N	0	3	348.248	3.006	20	30		EGEDHN
C[C@@H]1CN(CCc2ccc(C#N)cc2)CC[C@H]1C(=O)OC(C)(C)C	ZINC000599585124	460279857	/nfs/dbraw/zinc/27/98/57/460279857.db2.gz	XGVAYAPXCXYHLA-CRAIPNDOSA-N	0	3	328.456	3.400	20	30		EGEDHN
N#CCCN1CCN(CC/C=C\c2ccc(Br)cc2)CC1	ZINC000611174800	460301562	/nfs/dbraw/zinc/30/15/62/460301562.db2.gz	NFSUKJDRJCHKAG-RJRFIUFISA-N	0	3	348.288	3.384	20	30		EGEDHN
C=CCC1(NCc2csc(CS(C)(=O)=O)n2)CCCCC1	ZINC000625936379	460309992	/nfs/dbraw/zinc/30/99/92/460309992.db2.gz	JZFGFTWHIQLYLH-UHFFFAOYSA-N	0	3	328.503	3.056	20	30		EGEDHN
CCC(C#N)(CC)C(=O)N(C)CCC1CCN(c2ccncc2)CC1	ZINC000599739158	460324131	/nfs/dbraw/zinc/32/41/31/460324131.db2.gz	JDWDUFQXJGSNIJ-UHFFFAOYSA-N	0	3	342.487	3.476	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2[NH2+]CCCNC(=O)c1cccc([O-])c1	ZINC000611392329	460353267	/nfs/dbraw/zinc/35/32/67/460353267.db2.gz	MKSHKKXZZWSLHA-FQEVSTJZSA-N	0	3	349.434	3.051	20	30		EGEDHN
CC[C@@H]1CN(C)CCCN1C(=O)CCCCOc1cccc(C#N)c1	ZINC000619567041	460385361	/nfs/dbraw/zinc/38/53/61/460385361.db2.gz	JKADSKRWGIBYQI-GOSISDBHSA-N	0	3	343.471	3.050	20	30		EGEDHN
C[C@@H](Cc1cccs1)N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000611559849	460398942	/nfs/dbraw/zinc/39/89/42/460398942.db2.gz	BEVNTGQKMLGXLO-KBXCAEBGSA-N	0	3	339.464	3.336	20	30		EGEDHN
C[C@H]1CCCCN1CCOc1ccccc1C(=O)NCC(C)(C)C#N	ZINC000611690098	460429584	/nfs/dbraw/zinc/42/95/84/460429584.db2.gz	HBRDKRMEBHCLEY-INIZCTEOSA-N	0	3	343.471	3.219	20	30		EGEDHN
C[C@@H]1CCCCN1CCOc1ccccc1C(=O)NCC(C)(C)C#N	ZINC000611690103	460430284	/nfs/dbraw/zinc/43/02/84/460430284.db2.gz	HBRDKRMEBHCLEY-MRXNPFEDSA-N	0	3	343.471	3.219	20	30		EGEDHN
Cc1ccccc1CN1CCCN(C(=O)Cc2ccc(C#N)cc2)CC1	ZINC000604548694	460444130	/nfs/dbraw/zinc/44/41/30/460444130.db2.gz	WBGIACOTIXXWGN-UHFFFAOYSA-N	0	3	347.462	3.144	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)c1ccccc1CC#N	ZINC000601279965	460774512	/nfs/dbraw/zinc/77/45/12/460774512.db2.gz	LKYCREZTTXTGNM-UTKZUKDTSA-N	0	3	347.462	3.393	20	30		EGEDHN
C[C@@H](Oc1ccc(C#N)cc1)c1nc(C2C[C@H]3CC[C@@H](C2)N3C)no1	ZINC000612955084	460783046	/nfs/dbraw/zinc/78/30/46/460783046.db2.gz	RYQLAKHEBUSRKP-OHRKKDJYSA-N	0	3	338.411	3.421	20	30		EGEDHN
Cc1ccc(CN2CC[C@H](NC(=O)NCC(C)(C)CCC#N)C2)cc1	ZINC000601604392	460844391	/nfs/dbraw/zinc/84/43/91/460844391.db2.gz	SOCMEOWVOOVTAF-SFHVURJKSA-N	0	3	342.487	3.199	20	30		EGEDHN
COc1cc(CN(C)C)ccc1NC(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1	ZINC000601620752	460849147	/nfs/dbraw/zinc/84/91/47/460849147.db2.gz	KMNQURFEIAAKEX-ZWKOTPCHSA-N	0	3	349.434	3.371	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2NCCn1ccc(C(F)(F)F)n1	ZINC000601962656	460963963	/nfs/dbraw/zinc/96/39/63/460963963.db2.gz	HLRRSZBXOIXLCW-HNNXBMFYSA-N	0	3	334.345	3.441	20	30		EGEDHN
CC(C)(CC#N)CNC[C@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000601963796	460964068	/nfs/dbraw/zinc/96/40/68/460964068.db2.gz	GYAKOFKCKORRMI-ZDUSSCGKSA-N	0	3	331.243	3.263	20	30		EGEDHN
C=CC[C@H]1CCCN(C(=O)CCN2CCN(c3ccccc3)CC2)C1	ZINC000617782963	460975595	/nfs/dbraw/zinc/97/55/95/460975595.db2.gz	PZFJLVLALBJGAW-IBGZPJMESA-N	0	3	341.499	3.013	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN(CCO)CC2CC2)cc1OC	ZINC000628154542	461021792	/nfs/dbraw/zinc/02/17/92/461021792.db2.gz	ABYWXQOKCMBRPB-UHFFFAOYSA-N	0	3	325.836	3.118	20	30		EGEDHN
N#Cc1cnc2c(F)ccc(F)c2c1NC[C@H]1CCCCN1C1CC1	ZINC000617976663	461049150	/nfs/dbraw/zinc/04/91/50/461049150.db2.gz	LMYQYSGGQHSLOI-CQSZACIVSA-N	0	3	342.393	3.235	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(-c3ccc(F)cc3)no2)CC1	ZINC000668370519	461259730	/nfs/dbraw/zinc/25/97/30/461259730.db2.gz	ZBCUZPKCJLIBHA-UHFFFAOYSA-N	0	3	343.402	3.251	20	30		EGEDHN
CC#CC[C@H](CO)NCc1ccc(OC)c(OCc2ccccc2)c1	ZINC000641769194	461361818	/nfs/dbraw/zinc/36/18/18/461361818.db2.gz	PPICFIQSDNNPEA-LJQANCHMSA-N	0	3	339.435	3.138	20	30		EGEDHN
CC#CC[C@@H](CO)NCc1c(C)nn(Cc2ccccc2Cl)c1C	ZINC000641768797	461362453	/nfs/dbraw/zinc/36/24/53/461362453.db2.gz	IKEVYGHNHYNZMH-KRWDZBQOSA-N	0	3	345.874	3.066	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)[C@H](C)c1nc(C)cs1)C(C)C	ZINC000668683430	461380080	/nfs/dbraw/zinc/38/00/80/461380080.db2.gz	VZSUDGGKWVTCIO-JKSUJKDBSA-N	0	3	335.517	3.370	20	30		EGEDHN
C=C(C)CN1CCC(Nc2nc(C)nc(C)c2Br)CC1	ZINC000663567501	461706604	/nfs/dbraw/zinc/70/66/04/461706604.db2.gz	HVDJXSSATVJOQV-UHFFFAOYSA-N	0	3	339.281	3.308	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CC[C@@H]2c2ccc(F)cc2)CC1	ZINC000660597484	461871240	/nfs/dbraw/zinc/87/12/40/461871240.db2.gz	PQRZUOONOUJBCB-GOSISDBHSA-N	0	3	331.435	3.323	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](CC)Cc2ccc(F)cc2)CC1	ZINC000660600705	461873603	/nfs/dbraw/zinc/87/36/03/461873603.db2.gz	VUQBQXHHJDXCPM-GOSISDBHSA-N	0	3	347.478	3.487	20	30		EGEDHN
C=CCOc1cccc(NC(=O)N[C@H]2CCCN3CCCC[C@@H]23)c1	ZINC000653953294	461958720	/nfs/dbraw/zinc/95/87/20/461958720.db2.gz	XITBUIXIYWNBRM-ROUUACIJSA-N	0	3	329.444	3.390	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(F)cc3ccncc32)CC1	ZINC000651273309	462163275	/nfs/dbraw/zinc/16/32/75/462163275.db2.gz	IYFQBAHORUQCII-UHFFFAOYSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=CCN(CCC(=O)Nc1cc(Cl)ccc1OC)[C@@H](C)COC	ZINC000661244541	462168747	/nfs/dbraw/zinc/16/87/47/462168747.db2.gz	URKGTQXUXJWLGL-ZDUSSCGKSA-N	0	3	340.851	3.200	20	30		EGEDHN
C=CCC1(NCc2cc3c(cc2OC(F)F)OCO3)CCOCC1	ZINC000657632958	462211965	/nfs/dbraw/zinc/21/19/65/462211965.db2.gz	FGNLVDOVSXMJEX-UHFFFAOYSA-N	0	3	341.354	3.232	20	30		EGEDHN
C=CC[C@H]1CCCN(CC(=O)NCc2ccccc2COCC)C1	ZINC000661379863	462225635	/nfs/dbraw/zinc/22/56/35/462225635.db2.gz	IZHXOVZIZQDULA-KRWDZBQOSA-N	0	3	330.472	3.127	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cc(-c3ccoc3C)on2)CC1	ZINC000490140216	468197996	/nfs/dbraw/zinc/19/79/96/468197996.db2.gz	SMAQMRJAQFWKED-UHFFFAOYSA-N	0	3	330.388	3.015	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N1CC[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000187665656	534084358	/nfs/dbraw/zinc/08/43/58/534084358.db2.gz	GLDRRFVSMNTLTL-GOEBONIOSA-N	0	3	329.444	3.466	20	30		EGEDHN
C=CCN1CCC(NC(=O)/C=C/c2ccc(OC(C)C)cc2)CC1	ZINC000171717966	526416138	/nfs/dbraw/zinc/41/61/38/526416138.db2.gz	IDOCFPTVFJQYCQ-JXMROGBWSA-N	0	3	328.456	3.254	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCc2ccc(C(F)(F)F)cc2)CC1	ZINC000171705502	526434918	/nfs/dbraw/zinc/43/49/18/526434918.db2.gz	CKKZCCMFYBSOGR-UHFFFAOYSA-N	0	3	341.377	3.155	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cncc(-c3cccc(C)c3)c2)CC1	ZINC000178308761	526449123	/nfs/dbraw/zinc/44/91/23/526449123.db2.gz	UNBQZOCLPJVQPS-UHFFFAOYSA-N	0	3	335.451	3.437	20	30		EGEDHN
CCOc1ccccc1CN(C)CCC(=O)Nc1ccc(C#N)cc1	ZINC000172168244	535503089	/nfs/dbraw/zinc/50/30/89/535503089.db2.gz	ZZWCJUQTXQGZFI-UHFFFAOYSA-N	0	3	337.423	3.418	20	30		EGEDHN
Cc1cc(Cl)ccc1C(=O)C(C#N)c1nnc2n1CCCCC2	ZINC000134156573	546826207	/nfs/dbraw/zinc/82/62/07/546826207.db2.gz	UMVRWQXABYMJCN-AWEZNQCLSA-N	0	3	328.803	3.456	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Nc1cnn(C(C)(C)C)c1)C(C)C	ZINC000357723374	547740453	/nfs/dbraw/zinc/74/04/53/547740453.db2.gz	DBZDVVKWVSQDIJ-QGZVFWFLSA-N	0	3	347.507	3.458	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N[C@@H](C)c1cnccc1C)C(C)C	ZINC000678436190	549491887	/nfs/dbraw/zinc/49/18/87/549491887.db2.gz	MINHOQWRAYOKKS-PKOBYXMFSA-N	0	3	344.503	3.449	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N(C)Cc1ccc(C)cn1)C(C)C	ZINC000682701095	550132997	/nfs/dbraw/zinc/13/29/97/550132997.db2.gz	CNFLYIPNXLYRBK-LJQANCHMSA-N	0	3	344.503	3.230	20	30		EGEDHN
C#Cc1cccc(NC(=S)NC[C@@H](Cc2ccccc2)N(C)C)c1	ZINC000726441020	574555118	/nfs/dbraw/zinc/55/51/18/574555118.db2.gz	KDGUBFLPTFPJRP-LJQANCHMSA-N	0	3	337.492	3.127	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc(NC(C)=O)c(C)c2)CC1	ZINC000730060668	574914922	/nfs/dbraw/zinc/91/49/22/574914922.db2.gz	CLOREWOOXCBKGG-UHFFFAOYSA-N	0	3	344.459	3.115	20	30		EGEDHN
CC(C)N(C)CC(=O)NCc1cccc(-c2ccc(C#N)s2)c1	ZINC000739750837	574951693	/nfs/dbraw/zinc/95/16/93/574951693.db2.gz	ZILALDITBWKPKL-UHFFFAOYSA-N	0	3	327.453	3.243	20	30		EGEDHN
CC(C)(C)C(=O)NCCC(=O)C(C#N)c1nc2cc(F)ccc2s1	ZINC000730418784	574984667	/nfs/dbraw/zinc/98/46/67/574984667.db2.gz	ZVOVXXTYRBWUMI-NSHDSACASA-N	0	3	347.415	3.164	20	30		EGEDHN
C#CCOc1ccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000731113185	575055305	/nfs/dbraw/zinc/05/53/05/575055305.db2.gz	LNZDFKAWDNXOOL-IBGZPJMESA-N	0	3	349.434	3.095	20	30		EGEDHN
C[C@@H]1CCCCN1CCOc1ccccc1C(=O)OCCCC#N	ZINC000731252573	575062292	/nfs/dbraw/zinc/06/22/92/575062292.db2.gz	HYXPJGJYCPADTL-MRXNPFEDSA-N	0	3	330.428	3.400	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](C)c2nc3ccccc3s2)CC1	ZINC000734215386	575453271	/nfs/dbraw/zinc/45/32/71/575453271.db2.gz	JHHONNUUKRGLPR-CYBMUJFWSA-N	0	3	344.484	3.307	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)CCc3nc(C(C)C)no3)nc21	ZINC000735791856	575712556	/nfs/dbraw/zinc/71/25/56/575712556.db2.gz	CMYTXNHPBSWJME-GFCCVEGCSA-N	0	3	337.383	3.187	20	30		EGEDHN
Cc1cccc2nc(C(C#N)C(=O)CCc3nc(C(C)C)no3)[nH]c21	ZINC000735791856	575712559	/nfs/dbraw/zinc/71/25/59/575712559.db2.gz	CMYTXNHPBSWJME-GFCCVEGCSA-N	0	3	337.383	3.187	20	30		EGEDHN
C#Cc1ccc(C(=O)Nc2ccc(OCCN3CCCC3)c(C)c2)cn1	ZINC000736247275	575922927	/nfs/dbraw/zinc/92/29/27/575922927.db2.gz	WRTVTWKMPXXEIP-UHFFFAOYSA-N	0	3	349.434	3.098	20	30		EGEDHN
N#CCN(CC(=O)C(C#N)c1nc2ccccc2s1)C1CCCC1	ZINC000738330639	576314738	/nfs/dbraw/zinc/31/47/38/576314738.db2.gz	VAOAJJNDVCSNRO-AWEZNQCLSA-N	0	3	338.436	3.241	20	30		EGEDHN
CN(CC(=O)C(C#N)c1nc2ccccc2s1)c1cccc(O)c1	ZINC000741793115	576722288	/nfs/dbraw/zinc/72/22/88/576722288.db2.gz	YNLFAXSGXNHJNP-AWEZNQCLSA-N	0	3	337.404	3.315	20	30		EGEDHN
C=CCSc1nc2ccccc2n1CN1CC[C@@H](N2CC=CC2)C1	ZINC000742163011	576753763	/nfs/dbraw/zinc/75/37/63/576753763.db2.gz	MSVFCXNUSXPERH-MRXNPFEDSA-N	0	3	340.496	3.218	20	30		EGEDHN
C#CCOc1ccc(F)cc1NC(=O)NC[C@@H](C)N1CCCC[C@H]1C	ZINC000743201291	576803229	/nfs/dbraw/zinc/80/32/29/576803229.db2.gz	MPXUYGWMGKMXKK-HUUCEWRRSA-N	0	3	347.434	3.222	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000769297595	1303087551	/nfs/dbraw/zinc/08/75/51/1303087551.db2.gz	DGCAVQHBNFOVIR-KRWDZBQOSA-N	0	3	329.444	3.390	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)CCc1ccc(Cl)s1	ZINC000049253795	1291624676	/nfs/dbraw/zinc/62/46/76/1291624676.db2.gz	HCUQSLVPPFWWDX-LBPRGKRZSA-N	0	3	326.849	3.349	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@@H](C)SCc1ccccc1	ZINC000049252948	1291625273	/nfs/dbraw/zinc/62/52/73/1291625273.db2.gz	NNIHSWOGCGFHOE-ZBFHGGJFSA-N	0	3	332.469	3.324	20	30		EGEDHN
N#CC(C(=O)CCc1ccccc1Cl)C(=O)NC1CCCCC1	ZINC000050679088	1291654539	/nfs/dbraw/zinc/65/45/39/1291654539.db2.gz	CGKHPAHDHYPUNO-OAHLLOKOSA-N	0	3	332.831	3.430	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)CCSc1ccccc1F	ZINC000069912144	1292253850	/nfs/dbraw/zinc/25/38/50/1292253850.db2.gz	LOOGQZXMJIVCID-CYBMUJFWSA-N	0	3	336.432	3.323	20	30		EGEDHN
C#CCC[N@@H+](CCOC)Cc1ccc(OCc2ccccc2)cc1[O-]	ZINC000827823418	1292383230	/nfs/dbraw/zinc/38/32/30/1292383230.db2.gz	OOPLZRURSWFFGM-UHFFFAOYSA-N	0	3	339.435	3.443	20	30		EGEDHN
C#CCC[N@H+](CCOC)Cc1ccc(OCc2ccccc2)cc1[O-]	ZINC000827823418	1292383234	/nfs/dbraw/zinc/38/32/34/1292383234.db2.gz	OOPLZRURSWFFGM-UHFFFAOYSA-N	0	3	339.435	3.443	20	30		EGEDHN
CCc1ccc2nccc(N3CCN(c4ccc(C#N)nc4)CC3)c2c1	ZINC000828101539	1292430135	/nfs/dbraw/zinc/43/01/35/1292430135.db2.gz	OYMHMFFVOKVBLT-UHFFFAOYSA-N	0	3	343.434	3.390	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@@H]1C[C@@H]1c1cccc(F)c1F	ZINC000076818370	1292444309	/nfs/dbraw/zinc/44/43/09/1292444309.db2.gz	WTXJMJUAWJQLKO-RBSFLKMASA-N	0	3	348.393	3.474	20	30		EGEDHN
COc1ccc(CNC(=O)C(C#N)C(=O)CCCC(C)(C)C)cc1	ZINC000103640094	1293010788	/nfs/dbraw/zinc/01/07/88/1293010788.db2.gz	WNDOKWONBGSQEN-INIZCTEOSA-N	0	3	330.428	3.237	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CC[C@@H]2CN(C(=O)OC(C)(C)C)C[C@@H]21	ZINC000832602283	1293025106	/nfs/dbraw/zinc/02/51/06/1293025106.db2.gz	UXFUTDAOOBEYCJ-MSOLQXFVSA-N	0	3	341.455	3.308	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@@H](C)CSc1ccccc1	ZINC000111944220	1293113720	/nfs/dbraw/zinc/11/37/20/1293113720.db2.gz	JIYIXBKWUQVGMY-GOEBONIOSA-N	0	3	332.469	3.430	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)c(F)c1)c1ccc(N2CCNC2=O)cc1	ZINC000834903439	1293171191	/nfs/dbraw/zinc/17/11/91/1293171191.db2.gz	PLGMZHAABAWTHU-ZDUSSCGKSA-N	0	3	338.386	3.078	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)[C@@H]1CC12CCSCC2	ZINC000835034979	1293191602	/nfs/dbraw/zinc/19/16/02/1293191602.db2.gz	DBZSHKPKHBENLM-STQMWFEESA-N	0	3	325.437	3.283	20	30		EGEDHN
Cc1ccc(Oc2ccccc2CC(=O)C(C#N)C(=O)NC2CC2)cc1	ZINC000835064896	1293197715	/nfs/dbraw/zinc/19/77/15/1293197715.db2.gz	JFQNETQIKIZBLJ-GOSISDBHSA-N	0	3	348.402	3.317	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)C[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000121770333	1293388963	/nfs/dbraw/zinc/38/89/63/1293388963.db2.gz	MMFCVFSWYCGTRM-SMDDNHRTSA-N	0	3	340.345	3.432	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CNCc2ccc(C3OCCO3)cc2)cc1	ZINC000123141785	1293435646	/nfs/dbraw/zinc/43/56/46/1293435646.db2.gz	QSVMWPCZIYNDAT-OAHLLOKOSA-N	0	3	338.407	3.313	20	30		EGEDHN
N#CC(C(=O)CCCc1nc(C2CC2)no1)c1nc2ccccc2[nH]1	ZINC000123810524	1293456239	/nfs/dbraw/zinc/45/62/39/1293456239.db2.gz	UQNHHKMSSBHKSG-LBPRGKRZSA-N	0	3	335.367	3.022	20	30		EGEDHN
CN(CCOc1cccc(Cl)c1)C[C@H](O)c1ccc(C#N)cc1	ZINC000126910089	1293548011	/nfs/dbraw/zinc/54/80/11/1293548011.db2.gz	GRUOXXGOOPDOGK-SFHVURJKSA-N	0	3	330.815	3.256	20	30		EGEDHN
CN(CCOc1cccc(Cl)c1)C[C@@H](O)c1ccc(C#N)cc1	ZINC000126910355	1293548201	/nfs/dbraw/zinc/54/82/01/1293548201.db2.gz	GRUOXXGOOPDOGK-GOSISDBHSA-N	0	3	330.815	3.256	20	30		EGEDHN
C[C@H](Oc1ccc(Cl)cc1)C(=O)C(C#N)C(=O)Nc1ccccc1	ZINC000127865865	1293575243	/nfs/dbraw/zinc/57/52/43/1293575243.db2.gz	YXNPSSVTQFSEOY-BLLLJJGKSA-N	0	3	342.782	3.455	20	30		EGEDHN
N#CC(C(=O)CCc1ccc(-c2ccccc2F)o1)C(=O)NC1CC1	ZINC000129282490	1293619538	/nfs/dbraw/zinc/61/95/38/1293619538.db2.gz	RGOVJLNENFWWSU-OAHLLOKOSA-N	0	3	340.354	3.006	20	30		EGEDHN
O=c1[nH]c2ccccc2cc1C=NCCN1CCc2ccccc2C1	ZINC000129656413	1293630043	/nfs/dbraw/zinc/63/00/43/1293630043.db2.gz	VBXQDOAYMFFXPP-HYARGMPZSA-N	0	3	331.419	3.418	20	30		EGEDHN
CC[C@H](C)OCC(=O)C(C#N)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000152367435	1293965045	/nfs/dbraw/zinc/96/50/45/1293965045.db2.gz	ZPYMRVOZPJFVGK-TVQRCGJNSA-N	0	3	343.210	3.456	20	30		EGEDHN
C=C(Br)CNC(=O)N(CCN(C)C)CC1CCCCC1	ZINC000157880815	1294190177	/nfs/dbraw/zinc/19/01/77/1294190177.db2.gz	FSTWEJJQHKFHQT-UHFFFAOYSA-N	0	3	346.313	3.049	20	30		EGEDHN
C#Cc1cccc(NC(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)c1	ZINC000162753933	1294322390	/nfs/dbraw/zinc/32/23/90/1294322390.db2.gz	VWRPIUMXDREUNS-UHFFFAOYSA-N	0	3	346.434	3.135	20	30		EGEDHN
N#CC(C(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)[C@@H]1CCCOC1	ZINC000171037123	1294391843	/nfs/dbraw/zinc/39/18/43/1294391843.db2.gz	ZDJOHBUIQFYFES-NOZJJQNGSA-N	0	3	341.194	3.067	20	30		EGEDHN
COc1ccc(CNCc2ccc(-n3ccnc3)c(F)c2)cc1C#N	ZINC000174304967	1294492724	/nfs/dbraw/zinc/49/27/24/1294492724.db2.gz	RHDZZKVOSBKXIE-UHFFFAOYSA-N	0	3	336.370	3.181	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)c1oc(C)cc1C	ZINC000175110507	1294540850	/nfs/dbraw/zinc/54/08/50/1294540850.db2.gz	ZGWAWLYYMQFUJS-CYBMUJFWSA-N	0	3	326.352	3.256	20	30		EGEDHN
CCCCNC(=O)C1CCN(Cc2ccc(O[C@@H](C)C#N)cc2)CC1	ZINC000179330159	1294786315	/nfs/dbraw/zinc/78/63/15/1294786315.db2.gz	DTXPOSWTKXRTEL-INIZCTEOSA-N	0	3	343.471	3.106	20	30		EGEDHN
Cc1cccc(CO[C@@H](C)C(=O)C(C#N)C(=O)Nc2ccccc2)c1	ZINC000870136612	1295694163	/nfs/dbraw/zinc/69/41/63/1295694163.db2.gz	MAVFRSPOIPOOBU-YJBOKZPZSA-N	0	3	336.391	3.248	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)C1C[C@H]2CCC[C@@H](C1)C2=O	ZINC000193263994	1295848872	/nfs/dbraw/zinc/84/88/72/1295848872.db2.gz	ADOYCWFOAICGCK-IZGVIRRGSA-N	0	3	335.407	3.145	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(Cl)cc1)C(=O)c1ccc([N+](=O)[O-])cc1	ZINC000193390853	1295860765	/nfs/dbraw/zinc/86/07/65/1295860765.db2.gz	ZMWMHWZOBFYNTJ-CQSZACIVSA-N	0	3	343.726	3.209	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(Cl)cc1)C(=O)c1ccc([N+](=O)[O-])cc1	ZINC000193390862	1295860826	/nfs/dbraw/zinc/86/08/26/1295860826.db2.gz	ZMWMHWZOBFYNTJ-AWEZNQCLSA-N	0	3	343.726	3.209	20	30		EGEDHN
CCO[C@@H]1C[C@H]1C(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000193468162	1295872530	/nfs/dbraw/zinc/87/25/30/1295872530.db2.gz	GSKWTXAFTSZAAH-GIPNMCIBSA-N	0	3	341.194	3.066	20	30		EGEDHN
COc1ccc([C@@H](C/N=C/c2ccccc2O)N(C)C)cc1OC	ZINC000194860941	1296017606	/nfs/dbraw/zinc/01/76/06/1296017606.db2.gz	PDJQBQWEYKRTNA-DDLUMYACSA-N	0	3	328.412	3.131	20	30		EGEDHN
N#CC(C(=O)NC1CCCC1)C(=O)[C@@H]1C[C@]12CCCc1ccccc12	ZINC000246661489	1296365186	/nfs/dbraw/zinc/36/51/86/1296365186.db2.gz	XRUQTPWASHTFLC-MDKPJZGXSA-N	0	3	336.435	3.048	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN2CCC(Oc3cccc(F)c3)CC2)cc1	ZINC000528575951	1297990221	/nfs/dbraw/zinc/99/02/21/1297990221.db2.gz	VYHLGUCMICSKPM-FQEVSTJZSA-N	0	3	340.398	3.274	20	30		EGEDHN
Cc1ccc(SCC(=O)C(C#N)C(=O)Nc2ccccn2)c(C)c1	ZINC000747021624	1298711121	/nfs/dbraw/zinc/71/11/21/1298711121.db2.gz	WLGRQSMOJFSXMG-AWEZNQCLSA-N	0	3	339.420	3.138	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)[C@H](C)c1ccc(Cl)c(Cl)c1	ZINC000747108830	1298728675	/nfs/dbraw/zinc/72/86/75/1298728675.db2.gz	KEZKOHMITNAONW-KOLCDFICSA-N	0	3	327.211	3.330	20	30		EGEDHN
C[C@H](NCc1cc(C#N)cs1)c1ccc(N2CCOCC2)cc1	ZINC000748099089	1298927413	/nfs/dbraw/zinc/92/74/13/1298927413.db2.gz	DRZJHKSPSTZXJC-AWEZNQCLSA-N	0	3	327.453	3.307	20	30		EGEDHN
C#CCCCCCCN[C@H](C(N)=O)c1cccc(Br)c1	ZINC000877487401	1299338552	/nfs/dbraw/zinc/33/85/52/1299338552.db2.gz	FGAHJDCSOXGVOL-HNNXBMFYSA-N	0	3	337.261	3.149	20	30		EGEDHN
CC(=O)[C@](C#N)(CCN1CCC(c2ncc[nH]2)CC1)c1ccccc1	ZINC000878172427	1299796783	/nfs/dbraw/zinc/79/67/83/1299796783.db2.gz	HTTSWYDZKGXDDF-HXUWFJFHSA-N	0	3	336.439	3.030	20	30		EGEDHN
C[C@@H](NCc1ccc(-n2ccnc2)nc1)c1ccc(OCC#N)cc1	ZINC000753367350	1299922835	/nfs/dbraw/zinc/92/28/35/1299922835.db2.gz	HBLADZJPVZYSFS-OAHLLOKOSA-N	0	3	333.395	3.020	20	30		EGEDHN
CC[C@@H]1CC[C@@H](C(=O)C(C#N)C(=O)Nc2cccc3ccccc32)O1	ZINC000757307763	1300664414	/nfs/dbraw/zinc/66/44/14/1300664414.db2.gz	XZRWCCRFRHIKDH-HFTRVMKXSA-N	0	3	336.391	3.445	20	30		EGEDHN
CCOC(=O)c1sc(C2CCN([C@@H]3CC[C@@H](C#N)C3)CC2)nc1C	ZINC000879679275	1300672284	/nfs/dbraw/zinc/67/22/84/1300672284.db2.gz	JCJYGWFDAQEYBW-UKRRQHHQSA-N	0	3	347.484	3.500	20	30		EGEDHN
C#C[C@@H](NC1CC(c2cccc(Br)c2)C1)[C@H]1CCCO1	ZINC000762619696	1301715678	/nfs/dbraw/zinc/71/56/78/1301715678.db2.gz	CIFRABJJEJXCJW-OKEQZYBDSA-N	0	3	334.257	3.466	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1	ZINC000763928162	1301983291	/nfs/dbraw/zinc/98/32/91/1301983291.db2.gz	BOACVQANVCMYKP-XJKSGUPXSA-N	0	3	345.399	3.104	20	30		EGEDHN
N#CC(C(=O)CCc1cncc2ccccc21)C(=O)NC1CCCCC1	ZINC000765589134	1302285395	/nfs/dbraw/zinc/28/53/95/1302285395.db2.gz	VZBQSLNLROLZAF-IBGZPJMESA-N	0	3	349.434	3.325	20	30		EGEDHN
N#C[C@H]1CNCC12CC(C(=O)N[C@@H](c1ccccc1)C1CCCC1)C2	ZINC000884095748	1302731474	/nfs/dbraw/zinc/73/14/74/1302731474.db2.gz	YEWQTIFZYDLGNR-JMDAGXMHSA-N	0	3	337.467	3.173	20	30		EGEDHN
N#C[C@@H]1CNCC12CC(C(=O)N1CCC[C@@H]1CC1CCCCC1)C2	ZINC000884110471	1302738713	/nfs/dbraw/zinc/73/87/13/1302738713.db2.gz	LERQDXWVWJKIIW-SFANZJOMSA-N	0	3	329.488	3.087	20	30		EGEDHN
S=C(NN=C1CCCC[C@H]1N1CCCCC1)Nc1ccccn1	ZINC000767807261	1302767897	/nfs/dbraw/zinc/76/78/97/1302767897.db2.gz	XHKILHLJKLRRNR-OAHLLOKOSA-N	0	3	331.489	3.153	20	30		EGEDHN
C#C[C@H](C)N(C)Cc1sc(N2CCOCC2)nc1-c1ccccc1	ZINC000775182561	1303920517	/nfs/dbraw/zinc/92/05/17/1303920517.db2.gz	CYQGQSOVTWCCOP-HNNXBMFYSA-N	0	3	341.480	3.100	20	30		EGEDHN
N#CCCNC(=O)CN[C@@H](Cc1ccc(Cl)cc1)c1ccccc1	ZINC000775206175	1303924567	/nfs/dbraw/zinc/92/45/67/1303924567.db2.gz	IBWPZMIKOWEBQG-SFHVURJKSA-N	0	3	341.842	3.243	20	30		EGEDHN
CC1(C)OCC(C)(C(=O)C(C#N)c2nc3cc(F)ccc3s2)CO1	ZINC000775241165	1303928788	/nfs/dbraw/zinc/92/87/88/1303928788.db2.gz	XBEAVZDKHKTGHK-LLVKDONJSA-N	0	3	348.399	3.401	20	30		EGEDHN
C#CCNC(=O)CN[C@@H](CC(C)C)c1cccc(C(F)(F)F)c1	ZINC000775323439	1303939862	/nfs/dbraw/zinc/93/98/62/1303939862.db2.gz	FKZPNKXPGYYCGC-HNNXBMFYSA-N	0	3	326.362	3.132	20	30		EGEDHN
CC[C@@](C)(NCCS(=O)(=O)c1ccc(C#N)cc1)c1ccccc1	ZINC000775386704	1303952772	/nfs/dbraw/zinc/95/27/72/1303952772.db2.gz	FXSULLKJQSACOI-LJQANCHMSA-N	0	3	342.464	3.247	20	30		EGEDHN
C#CC[C@@H](NC[C@H](O)COc1ccc(Cl)cc1)c1ccccc1	ZINC000775400887	1303957616	/nfs/dbraw/zinc/95/76/16/1303957616.db2.gz	SVRJAJBTBWDVKY-PKOBYXMFSA-N	0	3	329.827	3.434	20	30		EGEDHN
C#CC[C@H](NCCCS(=O)(=O)c1ccc(F)cc1)c1ccccc1	ZINC000775405031	1303958426	/nfs/dbraw/zinc/95/84/26/1303958426.db2.gz	UAHXZEKYFSGGNG-IBGZPJMESA-N	0	3	345.439	3.344	20	30		EGEDHN
C#CC[C@@H](NC[C@@H](O)COc1cccc2[nH]ccc21)c1ccccc1	ZINC000775405076	1303958676	/nfs/dbraw/zinc/95/86/76/1303958676.db2.gz	VDEJPTAQCUXQNP-IEBWSBKVSA-N	0	3	334.419	3.262	20	30		EGEDHN
Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@H]1N2C(=O)c1cc(C#N)ccc1F	ZINC000887857974	1303959120	/nfs/dbraw/zinc/95/91/20/1303959120.db2.gz	XIAKDSVBCHCTNL-FXAWDEMLSA-N	0	3	349.409	3.454	20	30		EGEDHN
C=C(C)[C@H](NC[C@@H]1CC(C(=O)OC)=C(C)O1)c1ccc(F)c(F)c1	ZINC000775725861	1304021747	/nfs/dbraw/zinc/02/17/47/1304021747.db2.gz	XIVZBBKEERRINH-GUYCJALGSA-N	0	3	337.366	3.408	20	30		EGEDHN
N#Cc1ccc(F)c(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000888351878	1304127378	/nfs/dbraw/zinc/12/73/78/1304127378.db2.gz	AWGISLHVRWSHHO-MRXNPFEDSA-N	0	3	338.386	3.093	20	30		EGEDHN
C=CCN(CCc1ccco1)C[C@H](O)c1cc(OC)ccc1OC	ZINC000778996883	1304516169	/nfs/dbraw/zinc/51/61/69/1304516169.db2.gz	VGVNAWPGKZBNCS-SFHVURJKSA-N	0	3	331.412	3.061	20	30		EGEDHN
CCOCOc1ccc(CNCc2ccc(OCC#N)cc2)cc1	ZINC000782960646	1305029988	/nfs/dbraw/zinc/02/99/88/1305029988.db2.gz	URJXBICMSVPOAT-UHFFFAOYSA-N	0	3	326.396	3.252	20	30		EGEDHN
C=C1CCC(C(=O)C(C#N)C(=O)Nc2ccc(OC)c(OC)c2)CC1	ZINC000892498473	1305408374	/nfs/dbraw/zinc/40/83/74/1305408374.db2.gz	JKEHVJDDOBGWIL-HNNXBMFYSA-N	0	3	342.395	3.098	20	30		EGEDHN
N#CC(C(=O)CC[C@@H]1CCCCO1)C(=O)NCc1cccc(Cl)c1	ZINC000786546811	1305595439	/nfs/dbraw/zinc/59/54/39/1305595439.db2.gz	MBIIENRXGQHLNX-HOTGVXAUSA-N	0	3	348.830	3.014	20	30		EGEDHN
Cc1cccc(CNC(=O)C(C#N)C(=O)CCCc2ccccc2)c1	ZINC000786550410	1305597014	/nfs/dbraw/zinc/59/70/14/1305597014.db2.gz	PEQZYZAZKQDQBN-IBGZPJMESA-N	0	3	334.419	3.343	20	30		EGEDHN
C#CCCOc1ccc(CN[C@@H](C(C)C)[C@H](O)C(F)(F)F)cc1	ZINC000788830254	1306023510	/nfs/dbraw/zinc/02/35/10/1306023510.db2.gz	BOJBTCXOWGWMTB-HOTGVXAUSA-N	0	3	329.362	3.126	20	30		EGEDHN
C#C[C@@H](CCC)NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C	ZINC000791068733	1308920555	/nfs/dbraw/zinc/92/05/55/1308920555.db2.gz	BPVTVVPGQRGITH-HKUYNNGSSA-N	0	3	327.472	3.094	20	30		EGEDHN
C#CCCCN(CCn1ccnc1)Cc1ccc(Br)o1	ZINC000796188250	1309930205	/nfs/dbraw/zinc/93/02/05/1309930205.db2.gz	YAAVFKUTZAMMDQ-UHFFFAOYSA-N	0	3	336.233	3.154	20	30		EGEDHN
C#CCOc1ccc([C@@H](C)NCc2ccc(C[S@@](C)=O)cc2)cc1	ZINC000797133211	1310145733	/nfs/dbraw/zinc/14/57/33/1310145733.db2.gz	PWANMCKVTIEWLF-VOIUYBSRSA-N	0	3	341.476	3.428	20	30		EGEDHN
C[C@@H](NCc1ccc(C[S@@](C)=O)cc1)c1ccc(OCC#N)cc1	ZINC000797135643	1310145892	/nfs/dbraw/zinc/14/58/92/1310145892.db2.gz	YKORLIXQRSHUIE-OYLFLEFRSA-N	0	3	342.464	3.318	20	30		EGEDHN
C=CCN1CC[C@@H](N(C)Cc2cc(-c3ccccc3)ccc2O)C1=O	ZINC000798956724	1310464003	/nfs/dbraw/zinc/46/40/03/1310464003.db2.gz	LGLARFNENKRNQO-LJQANCHMSA-N	0	3	336.435	3.278	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)cc1C#N	ZINC000799686028	1310600043	/nfs/dbraw/zinc/60/00/43/1310600043.db2.gz	NPXLINVTKZHODO-OXJNMPFZSA-N	0	3	333.435	3.260	20	30		EGEDHN
COc1ccc2[nH]cc(C3=CCN(CCO[C@H](C)C#N)CC3)c2c1	ZINC000801930427	1316968006	/nfs/dbraw/zinc/96/80/06/1316968006.db2.gz	PJKJRGIOFSETSQ-CQSZACIVSA-N	0	3	325.412	3.194	20	30		EGEDHN
CC1(C)CC[C@H](C(=O)N2CC[C@H](NCc3ccc(F)c(C#N)c3)C2)C1	ZINC001019347902	1317183554	/nfs/dbraw/zinc/18/35/54/1317183554.db2.gz	SKJWFDAAKBKOHD-RDJZCZTQSA-N	0	3	343.446	3.214	20	30		EGEDHN
CCCN1CCC(N(C)C(=O)/C=C\C(=O)c2ccc(C)cc2)CC1	ZINC000900323448	1317272111	/nfs/dbraw/zinc/27/21/11/1317272111.db2.gz	VLXGIELSMPMYEP-KTKRTIGZSA-N	0	3	328.456	3.067	20	30		EGEDHN
C=C(Cl)C[NH+]1CCC2(CCN(C(=O)c3ccccc3[O-])CC2)CC1	ZINC000957505107	1317412520	/nfs/dbraw/zinc/41/25/20/1317412520.db2.gz	SGUIAXUMPHZMRL-UHFFFAOYSA-N	0	3	348.874	3.463	20	30		EGEDHN
CC[C@H](C)N[C@H](CNC(=O)Cc1ccccc1CC#N)c1ccco1	ZINC000807679228	1317576370	/nfs/dbraw/zinc/57/63/70/1317576370.db2.gz	GIJQJSYCWOEDGJ-MAUKXSAKSA-N	0	3	339.439	3.134	20	30		EGEDHN
COc1ccc(C(C)=NN[C@@H]2CCSC2)cc1CN1CCCC1	ZINC000808002140	1317610338	/nfs/dbraw/zinc/61/03/38/1317610338.db2.gz	VIMDCHKAPATSSH-QGZVFWFLSA-N	0	3	333.501	3.110	20	30		EGEDHN
CC[C@H](N[C@H]1CCCN(Cc2ccccn2)C1=O)c1cccc(C#N)c1	ZINC000902950699	1317632799	/nfs/dbraw/zinc/63/27/99/1317632799.db2.gz	KCQWIMSQLDRWGA-PMACEKPBSA-N	0	3	348.450	3.185	20	30		EGEDHN
CC(C)(C)[C@@H]1C[C@H]1C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001020385491	1317673163	/nfs/dbraw/zinc/67/31/63/1317673163.db2.gz	OJXTTYLTKGNPJD-QBPKDAKJSA-N	0	3	343.446	3.116	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)c2cnc(C(C)(C)C)nc2)c1	ZINC000808979847	1317756194	/nfs/dbraw/zinc/75/61/94/1317756194.db2.gz	NUHMRIWHUVGOEA-HNNXBMFYSA-N	0	3	336.395	3.044	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccccc2OC2CCC2)C1	ZINC001020569843	1317780480	/nfs/dbraw/zinc/78/04/80/1317780480.db2.gz	LJBABRBDSAESJI-HDJSIYSDSA-N	0	3	334.847	3.221	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)Cc2cccc(Cl)c2F)C1	ZINC001020629152	1317812582	/nfs/dbraw/zinc/81/25/82/1317812582.db2.gz	CWVPRKLEDKNOCU-HAQNSBGRSA-N	0	3	331.218	3.011	20	30		EGEDHN
C#Cc1ccc(CN[C@@H](CC(C)C)C(=O)Nc2nccs2)cc1	ZINC000809629413	1317850439	/nfs/dbraw/zinc/85/04/39/1317850439.db2.gz	PBLHETSWLGXNRU-INIZCTEOSA-N	0	3	327.453	3.267	20	30		EGEDHN
Cc1cc(C(=O)N[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)cs1	ZINC001020751604	1317904439	/nfs/dbraw/zinc/90/44/39/1317904439.db2.gz	MPARFSKYZDEKED-WKILWMFISA-N	0	3	343.427	3.118	20	30		EGEDHN
C[C@@H]1CN(CC(=O)C(C#N)c2nc3ccccc3s2)CCC1(F)F	ZINC000810045880	1317942655	/nfs/dbraw/zinc/94/26/55/1317942655.db2.gz	IZLIQQVETSNIBQ-VXGBXAGGSA-N	0	3	349.406	3.450	20	30		EGEDHN
N#Cc1ccc(OCCCN2CC3(CCC3)[C@@H]2[C@H]2CCCO2)cc1	ZINC000810091562	1317949250	/nfs/dbraw/zinc/94/92/50/1317949250.db2.gz	BATVDNSQMDIOPS-MOPGFXCFSA-N	0	3	326.440	3.361	20	30		EGEDHN
CC(C)[C@@]1(C)C[C@@H]1C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001020860516	1317969040	/nfs/dbraw/zinc/96/90/40/1317969040.db2.gz	QXLFELFJVALJMN-WOCWXWTJSA-N	0	3	343.446	3.116	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)Cc1cccc(Cl)c1F	ZINC000810526682	1318018557	/nfs/dbraw/zinc/01/85/57/1318018557.db2.gz	DQBNSQUCKLGXGZ-CYBMUJFWSA-N	0	3	338.810	3.427	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N1CCCN(Cc2ccccc2C)CC1	ZINC000906103547	1318038667	/nfs/dbraw/zinc/03/86/67/1318038667.db2.gz	PZJIHCBYRKHUKP-PMACEKPBSA-N	0	3	342.483	3.011	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)Cc2coc3cc(C)ccc23)C1	ZINC001021018878	1318049130	/nfs/dbraw/zinc/04/91/30/1318049130.db2.gz	CMIMRCURBCLLOP-SHTZXODSSA-N	0	3	332.831	3.273	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccccc2OCC2CC2)C1	ZINC001021087574	1318075528	/nfs/dbraw/zinc/07/55/28/1318075528.db2.gz	AENAWYBMQFDBSN-SHTZXODSSA-N	0	3	334.847	3.078	20	30		EGEDHN
CC[C@H](C#N)Oc1cccc(CNC(=O)C(C)(C)N2CCCCC2)c1	ZINC000906696739	1318137981	/nfs/dbraw/zinc/13/79/81/1318137981.db2.gz	IPVNDEJDGQZMSP-QGZVFWFLSA-N	0	3	343.471	3.248	20	30		EGEDHN
CO[C@H](C)[C@@H](C)N[C@@H](C)C(=O)/C=C1\N(C)c2ccccc2C1(C)C	ZINC000811637666	1318217046	/nfs/dbraw/zinc/21/70/46/1318217046.db2.gz	HHDQVZGFZNGGHX-FEOKACIKSA-N	0	3	330.472	3.269	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)CC2CCC2)s1	ZINC000959935897	1318274070	/nfs/dbraw/zinc/27/40/70/1318274070.db2.gz	CCCHGMKPBITAPT-HNNXBMFYSA-N	0	3	331.485	3.281	20	30		EGEDHN
C[C@@H](C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)c(F)c1)C1CC1	ZINC000959941344	1318276276	/nfs/dbraw/zinc/27/62/76/1318276276.db2.gz	CDBUSUNYSSQRIG-KDOFPFPSSA-N	0	3	343.446	3.214	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@H](CCCN3C(=O)c3ccco3)C2)cc1	ZINC001021492977	1318292719	/nfs/dbraw/zinc/29/27/19/1318292719.db2.gz	OCZOHHBPSPHRDA-RTBURBONSA-N	0	3	349.434	3.278	20	30		EGEDHN
CCCC(=O)N1CCC[C@@H]2CN(Cc3ccc(C#N)cc3)CC[C@@H]21	ZINC001021500539	1318312494	/nfs/dbraw/zinc/31/24/94/1318312494.db2.gz	YNYUGPGEQNCPJZ-MOPGFXCFSA-N	0	3	325.456	3.171	20	30		EGEDHN
C#C[C@@H](CCC)NC(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000812380515	1318379074	/nfs/dbraw/zinc/37/90/74/1318379074.db2.gz	GBAFZJGCBYWMQY-HKUYNNGSSA-N	0	3	345.487	3.178	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@H](CCCN3C(=O)C3CC=CC3)C2)cc1	ZINC001021552031	1318393922	/nfs/dbraw/zinc/39/39/22/1318393922.db2.gz	VXHXGRATBZSSCV-NHCUHLMSSA-N	0	3	349.478	3.337	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1scnc1C	ZINC000960252573	1318430536	/nfs/dbraw/zinc/43/05/36/1318430536.db2.gz	KXWVXSAXPTXGOJ-HZPDHXFCSA-N	0	3	327.453	3.013	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1c(C)noc1C(F)F	ZINC000960276249	1318439655	/nfs/dbraw/zinc/43/96/55/1318439655.db2.gz	OIMFEPPWXVIPHH-UKRRQHHQSA-N	0	3	347.365	3.092	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc(OC)c(F)c1	ZINC000960277250	1318440224	/nfs/dbraw/zinc/44/02/24/1318440224.db2.gz	BNIXSLABUNCAFW-IEBWSBKVSA-N	0	3	340.398	3.006	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(C(C)C)nc2)C1	ZINC001021602778	1318445678	/nfs/dbraw/zinc/44/56/78/1318445678.db2.gz	JBIPFACEMPRBDN-AZUAARDMSA-N	0	3	339.483	3.155	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)CCc2ccsc2)C1	ZINC001021603914	1318447790	/nfs/dbraw/zinc/44/77/90/1318447790.db2.gz	SPZJSKPLIHYKOU-MSOLQXFVSA-N	0	3	330.497	3.017	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@@H]1CCCc2cccnc21	ZINC000960300280	1318450974	/nfs/dbraw/zinc/45/09/74/1318450974.db2.gz	PKOVVEKKFXRSEC-SFHLNBCPSA-N	0	3	347.462	3.059	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ocnc1C(F)F	ZINC000960303241	1318451790	/nfs/dbraw/zinc/45/17/90/1318451790.db2.gz	DXPXHDLUVYQOBR-ZIAGYGMSSA-N	0	3	347.365	3.174	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)C2C3CC4CC(C3)CC2C4)C1	ZINC001021607034	1318455350	/nfs/dbraw/zinc/45/53/50/1318455350.db2.gz	TYAUKTZMPTZSOK-YETXIRRSSA-N	0	3	340.511	3.005	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc(CC(C)C)c[nH]1	ZINC000960328710	1318463827	/nfs/dbraw/zinc/46/38/27/1318463827.db2.gz	ZMKKZQMHWBCSNJ-UYAOXDASSA-N	0	3	337.467	3.385	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)c1ccsc1	ZINC000960411318	1318535475	/nfs/dbraw/zinc/53/54/75/1318535475.db2.gz	VMFGOOCBDQRVST-SFHVURJKSA-N	0	3	339.464	3.356	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC[C@@H]1CN(C)Cc1ccc(OC)c(C#N)c1	ZINC000960452249	1318573970	/nfs/dbraw/zinc/57/39/70/1318573970.db2.gz	SBZFYMCZXFVRPG-MAUKXSAKSA-N	0	3	343.471	3.036	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc3ccn(C)c3c2)C1	ZINC001021710908	1318586219	/nfs/dbraw/zinc/58/62/19/1318586219.db2.gz	RACULBLXHIMAIU-UXHICEINSA-N	0	3	349.478	3.128	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(OCC)cc2)C1	ZINC001021724844	1318616026	/nfs/dbraw/zinc/61/60/26/1318616026.db2.gz	OVDDVXLWBQXIFL-AZUAARDMSA-N	0	3	340.467	3.035	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(C)nc3ccccc32)C1	ZINC001021724832	1318617202	/nfs/dbraw/zinc/61/72/02/1318617202.db2.gz	ONVJHIBFQMRLOC-UTKZUKDTSA-N	0	3	347.462	3.103	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)Cc2ccccc2Cl)C1	ZINC001021726316	1318618895	/nfs/dbraw/zinc/61/88/95/1318618895.db2.gz	BCNFJRDQASRSLD-IEBWSBKVSA-N	0	3	344.886	3.219	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)Cc2ccc3ccccc3c2)C1	ZINC001021730720	1318631452	/nfs/dbraw/zinc/63/14/52/1318631452.db2.gz	PWTMFHVNSWXPQZ-YADHBBJMSA-N	0	3	346.474	3.328	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc3[nH]c(C)c(C)c3c2)C1	ZINC001021733881	1318638531	/nfs/dbraw/zinc/63/85/31/1318638531.db2.gz	SLDPSQLUCOBHFZ-RXVVDRJESA-N	0	3	349.478	3.344	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc3c(c2)CCC3)C1	ZINC001021733892	1318638822	/nfs/dbraw/zinc/63/88/22/1318638822.db2.gz	SOXIRIZQJKZYTH-NHCUHLMSSA-N	0	3	336.479	3.125	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(CF)cc2)C1	ZINC001021742275	1318654256	/nfs/dbraw/zinc/65/42/56/1318654256.db2.gz	CWAYSGDRXRJWQY-RTBURBONSA-N	0	3	328.431	3.106	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)[C@@H]1CC1(C)C	ZINC000960564892	1318696539	/nfs/dbraw/zinc/69/65/39/1318696539.db2.gz	QZPKGTGMZIPNSB-MSOLQXFVSA-N	0	3	325.456	3.027	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)/C=C/c1ccc[nH]1	ZINC000960581946	1318711902	/nfs/dbraw/zinc/71/19/02/1318711902.db2.gz	QHYYQBIVVXHMJM-CFGKVWFZSA-N	0	3	348.450	3.023	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)/C=C\c1ccc[nH]1	ZINC000960589698	1318719072	/nfs/dbraw/zinc/71/90/72/1318719072.db2.gz	LDFVQRJDCYLHEN-QJRAZLAKSA-N	0	3	348.450	3.023	20	30		EGEDHN
CN(Cc1cccc(C(F)F)c1)C[C@H]1CCCN1C(=O)C#CC1CC1	ZINC000960612391	1318737322	/nfs/dbraw/zinc/73/73/22/1318737322.db2.gz	GESHZCORVCNMEA-GOSISDBHSA-N	0	3	346.421	3.460	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N[C@H]1C[C@@H](N[C@@H](C)c2ccccc2F)C1	ZINC001022100912	1318796330	/nfs/dbraw/zinc/79/63/30/1318796330.db2.gz	ATJHXWUOASWGHU-LSIDRNEPSA-N	0	3	346.446	3.105	20	30		EGEDHN
C[C@H]1CCC(=NNC(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000814727716	1318807217	/nfs/dbraw/zinc/80/72/17/1318807217.db2.gz	VTDLWSKKFKALIO-HNNXBMFYSA-N	0	3	344.528	3.291	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccccc1C(=O)N1CCC(C)CC1	ZINC000912300504	1318864094	/nfs/dbraw/zinc/86/40/94/1318864094.db2.gz	HOEXDYVQQVOKLQ-QGZVFWFLSA-N	0	3	343.471	3.181	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)C2CCCCCCC2)C1	ZINC001022406913	1318925986	/nfs/dbraw/zinc/92/59/86/1318925986.db2.gz	DNLXMDGSISEPCO-GASCZTMLSA-N	0	3	343.309	3.492	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)Cc2cccc(C(F)F)c2)C1	ZINC001022421118	1318933763	/nfs/dbraw/zinc/93/37/63/1318933763.db2.gz	FNNBQHCLZWKBDN-OKILXGFUSA-N	0	3	328.790	3.156	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)C[C@@H]2C[C@H]2Cc2ccccc2)C1	ZINC001022475275	1318955737	/nfs/dbraw/zinc/95/57/37/1318955737.db2.gz	YWXOIRKYCHWBMS-XDNAFOTISA-N	0	3	332.875	3.245	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)C1(C)CC=CC1	ZINC000960840047	1318974024	/nfs/dbraw/zinc/97/40/24/1318974024.db2.gz	UAWIQBRIIGYUCL-LJQANCHMSA-N	0	3	337.467	3.337	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]2CN(C)C[C@H]2CC(C)(C)CO2)C1	ZINC000960847640	1318986763	/nfs/dbraw/zinc/98/67/63/1318986763.db2.gz	RDVGPSJSAMSSAN-DLBZAZTESA-N	0	3	334.504	3.081	20	30		EGEDHN
CC1(C)CCC[C@@H]1C(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001022557305	1318989355	/nfs/dbraw/zinc/98/93/55/1318989355.db2.gz	MSTNGAKBZSVAFK-IXDOHACOSA-N	0	3	343.446	3.260	20	30		EGEDHN
C[C@@H]1CCCC[C@H]1C(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001022620401	1319019934	/nfs/dbraw/zinc/01/99/34/1319019934.db2.gz	NHRIOOLMCJNISU-NKGKWGDASA-N	0	3	343.446	3.260	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCC[C@@H]1CN(C)Cc1ccc(C#N)cc1	ZINC000960904477	1319046668	/nfs/dbraw/zinc/04/66/68/1319046668.db2.gz	GSXNVPOQLWMTFY-QFBILLFUSA-N	0	3	327.472	3.273	20	30		EGEDHN
CC[C@@H]1CCC[C@@H]1C(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001022661361	1319050278	/nfs/dbraw/zinc/05/02/78/1319050278.db2.gz	LWIBKEWZPXYWBJ-BGTYHANMSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc(C)n(CC3CC3)c2C)C1	ZINC001022982717	1319201249	/nfs/dbraw/zinc/20/12/49/1319201249.db2.gz	VXNTZXGRFGXPGG-IYBDPMFKSA-N	0	3	335.879	3.118	20	30		EGEDHN
CC(=O)N1CCC[C@H]([C@@H]2CCN(CC#Cc3ccc(Cl)cc3)C2)C1	ZINC000961095022	1319207741	/nfs/dbraw/zinc/20/77/41/1319207741.db2.gz	XSORVCDFBBFCLR-RBUKOAKNSA-N	0	3	344.886	3.272	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@H](C)c2cccc(Cl)c2)C1	ZINC001023110126	1319264511	/nfs/dbraw/zinc/26/45/11/1319264511.db2.gz	PWBCMFOOCCYNSO-DFBGVHRSSA-N	0	3	327.255	3.433	20	30		EGEDHN
C[C@H](C#N)OCCN1CCC[C@@H]1Cc1ccccc1Br	ZINC000817276515	1319310330	/nfs/dbraw/zinc/31/03/30/1319310330.db2.gz	HDCBKHWTFZYROM-UKRRQHHQSA-N	0	3	337.261	3.385	20	30		EGEDHN
N#Cc1ccc(C(=O)NC[C@@H]2CCCN(C/C=C\c3ccccc3)C2)[nH]1	ZINC001023318393	1319442896	/nfs/dbraw/zinc/44/28/96/1319442896.db2.gz	IFXNRUKDGABRRR-MSEQUDFZSA-N	0	3	348.450	3.042	20	30		EGEDHN
Cc1cc(C(=O)NC[C@@H]2CCCN(Cc3ccc(C#N)cc3)C2)co1	ZINC001023323307	1319447128	/nfs/dbraw/zinc/44/71/28/1319447128.db2.gz	IBLIQNXEUDBJLA-SFHVURJKSA-N	0	3	337.423	3.102	20	30		EGEDHN
N#Cc1ccccc1/C=C\C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000915264541	1319456245	/nfs/dbraw/zinc/45/62/45/1319456245.db2.gz	QLJVGUWBOQNCTQ-BIGNBACZSA-N	0	3	345.446	3.352	20	30		EGEDHN
CN(C)CCN(CCc1ccccc1)C(=O)/C=C/c1ccccc1C#N	ZINC000915628796	1319510260	/nfs/dbraw/zinc/51/02/60/1319510260.db2.gz	CCTWXEOKDGDDGB-OUKQBFOZSA-N	0	3	347.462	3.204	20	30		EGEDHN
C#CCN(C)CCCNC(=O)[C@@H](C)c1ccc2cc(OC)ccc2c1	ZINC000818595681	1319564865	/nfs/dbraw/zinc/56/48/65/1319564865.db2.gz	JOGSLHYRDWBDDE-INIZCTEOSA-N	0	3	338.451	3.023	20	30		EGEDHN
C#CCN(C)CCCNC(=O)CCc1cccc(OC2CCCC2)c1	ZINC000818606499	1319568619	/nfs/dbraw/zinc/56/86/19/1319568619.db2.gz	VSTBIQYDZNRAAG-UHFFFAOYSA-N	0	3	342.483	3.012	20	30		EGEDHN
C#CCN(C)CCCNC(=O)CCc1ccc(-c2ccccc2F)o1	ZINC000818615305	1319570640	/nfs/dbraw/zinc/57/06/40/1319570640.db2.gz	HYBJJQNGNNQWCX-UHFFFAOYSA-N	0	3	342.414	3.090	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cn(CC)c3ccccc23)C1	ZINC001023476675	1319579891	/nfs/dbraw/zinc/57/98/91/1319579891.db2.gz	RXEDKWRROPTEMT-KRWDZBQOSA-N	0	3	337.467	3.126	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2[C@H]3CN([C@H](C)c4cccc(F)c4)C[C@H]32)cc1	ZINC000961432596	1319585186	/nfs/dbraw/zinc/58/51/86/1319585186.db2.gz	OULZDBUBEOQCCM-PLBGURBNSA-N	0	3	348.421	3.228	20	30		EGEDHN
C=CCN1CCC[C@H](CNC(=O)c2oc3ccccc3c2OC)C1	ZINC001023528360	1319632849	/nfs/dbraw/zinc/63/28/49/1319632849.db2.gz	KKCAAAIEQMSNKB-CQSZACIVSA-N	0	3	328.412	3.069	20	30		EGEDHN
C[C@H](Oc1ccccc1)C(=O)C(C#N)C(=O)Nc1ccccc1Cl	ZINC000916905889	1319722809	/nfs/dbraw/zinc/72/28/09/1319722809.db2.gz	NZAUQACNUMKARZ-GXTWGEPZSA-N	0	3	342.782	3.455	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2c(F)ccc(F)c2Cl)C1	ZINC001023609324	1319723184	/nfs/dbraw/zinc/72/31/84/1319723184.db2.gz	QFDRXSJNSLXINE-GFCCVEGCSA-N	0	3	340.801	3.083	20	30		EGEDHN
CCc1cccc(CC)c1NC(=O)C(C#N)C(=O)COC1CCCC1	ZINC000916910975	1319724509	/nfs/dbraw/zinc/72/45/09/1319724509.db2.gz	YVOSKKDCXMGOMR-KRWDZBQOSA-N	0	3	342.439	3.418	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc(-c3ccccc3)o2)C1	ZINC001023609538	1319724683	/nfs/dbraw/zinc/72/46/83/1319724683.db2.gz	SRTIEZBUVNMFNA-KRWDZBQOSA-N	0	3	336.435	3.412	20	30		EGEDHN
CC(C)(C)c1cc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)n[nH]1	ZINC000916913568	1319725149	/nfs/dbraw/zinc/72/51/49/1319725149.db2.gz	XAUWRHAHKRJRGO-JTQLQIEISA-N	0	3	344.802	3.322	20	30		EGEDHN
CC(C)SCC(=O)C(C#N)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000916937302	1319726599	/nfs/dbraw/zinc/72/65/99/1319726599.db2.gz	CFGXWKWPIGRBFO-SNVBAGLBSA-N	0	3	328.796	3.268	20	30		EGEDHN
N#Cc1ccccc1CNCC1CC(NC(=O)c2cc[nH]c2C2CC2)C1	ZINC000962228688	1319868618	/nfs/dbraw/zinc/86/86/18/1319868618.db2.gz	IDHCRYKLTMBMDH-UHFFFAOYSA-N	0	3	348.450	3.062	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2csc3c2CC[C@H](C)C3)C1	ZINC001023734193	1319877039	/nfs/dbraw/zinc/87/70/39/1319877039.db2.gz	XOZMAOAXXDNJQT-JKSUJKDBSA-N	0	3	344.524	3.338	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cccc(OCC(C)C)c2)C1	ZINC001023738555	1319883921	/nfs/dbraw/zinc/88/39/21/1319883921.db2.gz	CKDFOIRFJWVRJV-GOSISDBHSA-N	0	3	342.483	3.187	20	30		EGEDHN
C=CCN(C(=O)NCC(C)(C)N1CCc2ccccc2C1)C(C)C	ZINC000918071253	1319912537	/nfs/dbraw/zinc/91/25/37/1319912537.db2.gz	PIYANJIPUDYKLG-UHFFFAOYSA-N	0	3	329.488	3.429	20	30		EGEDHN
C#C[C@@H](CCC)NC(=O)N(Cc1ccccc1)C1CCN(C)CC1	ZINC000820647089	1319928065	/nfs/dbraw/zinc/92/80/65/1319928065.db2.gz	NKOMZZUDJQTCQH-SFHVURJKSA-N	0	3	327.472	3.094	20	30		EGEDHN
C#CC[C@H](CO)NCc1cn(-c2ccccc2)nc1-c1ccccc1	ZINC000821207654	1320003335	/nfs/dbraw/zinc/00/33/35/1320003335.db2.gz	WSLJNBROITUKBM-LJQANCHMSA-N	0	3	331.419	3.013	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1ccc(SC(F)F)cc1	ZINC000838624124	1320796290	/nfs/dbraw/zinc/79/62/90/1320796290.db2.gz	IFPGVNCWWPSLDK-UHFFFAOYSA-N	0	3	327.400	3.078	20	30		EGEDHN
C=CCSc1nc2ccccc2n1CN1C[C@@H](C)N(C)[C@@H](C)C1	ZINC000840088178	1321025788	/nfs/dbraw/zinc/02/57/88/1321025788.db2.gz	IRBMJUPWTREFEV-GASCZTMLSA-N	0	3	330.501	3.296	20	30		EGEDHN
C=CCn1c2ccccc2n(CN2CCN(C)C[C@H]2CC)c1=S	ZINC000840094554	1321028183	/nfs/dbraw/zinc/02/81/83/1321028183.db2.gz	VQISESAMNCXVIS-OAHLLOKOSA-N	0	3	330.501	3.342	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/C[C@@H](O)Cc2cccc(F)c2)c([O-])c1	ZINC000840707065	1321131134	/nfs/dbraw/zinc/13/11/34/1321131134.db2.gz	NEHPAJCDQILERN-MEGCXXLRSA-N	0	3	344.430	3.400	20	30		EGEDHN
CC[C@@H](OC1CCCC1)C(=O)C(C#N)C(=O)Nc1cccc(C)c1	ZINC000842289702	1321368348	/nfs/dbraw/zinc/36/83/48/1321368348.db2.gz	SCUQLQNGUNZOTP-IAGOWNOFSA-N	0	3	328.412	3.380	20	30		EGEDHN
CC1(C)C[C@H](C(=O)C(C#N)C(=O)NC2CCCC2)c2ccccc2O1	ZINC000842292312	1321368982	/nfs/dbraw/zinc/36/89/82/1321368982.db2.gz	SJIMAFJQRLTVCM-HOTGVXAUSA-N	0	3	340.423	3.099	20	30		EGEDHN
CC(C)n1cnnc1SCC(=O)C(C#N)c1nc(C2CC2)cs1	ZINC000842940053	1321451206	/nfs/dbraw/zinc/45/12/06/1321451206.db2.gz	WKIBARKYRJQFFK-NSHDSACASA-N	0	3	347.469	3.161	20	30		EGEDHN
C#CCOc1cccc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)c1	ZINC000844380185	1321596789	/nfs/dbraw/zinc/59/67/89/1321596789.db2.gz	YPBCIJGJTLCMTQ-GJZGRUSLSA-N	0	3	341.329	3.385	20	30		EGEDHN
COc1ccc(N(C)CCN(C)Cc2ccc(F)c(C#N)c2)cc1	ZINC000844401776	1321600525	/nfs/dbraw/zinc/60/05/25/1321600525.db2.gz	QMOVPGRLEYNWIP-UHFFFAOYSA-N	0	3	327.403	3.274	20	30		EGEDHN
C=CC[C@@H](NC(=O)N1CCN(C(C)(C)CC)CC1)c1ccncc1	ZINC000847318471	1321862191	/nfs/dbraw/zinc/86/21/91/1321862191.db2.gz	JUTCPQBZTQPYET-QGZVFWFLSA-N	0	3	330.476	3.215	20	30		EGEDHN
CC[C@H](C)OCC(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847749600	1321900751	/nfs/dbraw/zinc/90/07/51/1321900751.db2.gz	WDRCKLNUXWNCHY-KRWDZBQOSA-N	0	3	344.455	3.151	20	30		EGEDHN
C[C@@H](C(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1)C1CC1	ZINC000847748720	1321900769	/nfs/dbraw/zinc/90/07/69/1321900769.db2.gz	GXBUHSBZSSWNLS-MRXNPFEDSA-N	0	3	326.440	3.382	20	30		EGEDHN
C#CCCOc1ccc(CN[C@H]2CCc3ccccc3NC2=O)cc1	ZINC000848561520	1321976524	/nfs/dbraw/zinc/97/65/24/1321976524.db2.gz	XMFYMVGGIZQZSN-FQEVSTJZSA-N	0	3	334.419	3.132	20	30		EGEDHN
C[C@@H](Cc1ccc(F)cc1)C(=O)C(C#N)C(=O)NC1CCCCC1	ZINC000921131062	1322260776	/nfs/dbraw/zinc/26/07/76/1322260776.db2.gz	GMNNZOSTYUTMPA-GUYCJALGSA-N	0	3	330.403	3.162	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H](CNCc2nc(C)cs2)C1	ZINC001024090542	1323122414	/nfs/dbraw/zinc/12/24/14/1323122414.db2.gz	KRJLNGHLLMLOQR-OAHLLOKOSA-N	0	3	335.517	3.382	20	30		EGEDHN
C#C[C@@](C)(CC)NCC(=O)N[C@H](C)c1ccc(Br)cc1	ZINC000852098931	1323146478	/nfs/dbraw/zinc/14/64/78/1323146478.db2.gz	ZKCNPPQHUDEHMY-WBMJQRKESA-N	0	3	337.261	3.018	20	30		EGEDHN
C#C[C@](C)(CC)N[C@@H](C)C(=O)N(C)Cc1nc2ccccc2s1	ZINC000852101352	1323146954	/nfs/dbraw/zinc/14/69/54/1323146954.db2.gz	PKKGVTHNEWKHPU-SCLBCKFNSA-N	0	3	329.469	3.035	20	30		EGEDHN
CCC(C)(C)C(=O)N1CCC[C@H](CNCc2ccccc2C#N)C1	ZINC001024129153	1323154193	/nfs/dbraw/zinc/15/41/93/1323154193.db2.gz	LQLPKQMUGWTIOK-MRXNPFEDSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@@H](CNCc3nccs3)C2)CC1	ZINC001024133123	1323155933	/nfs/dbraw/zinc/15/59/33/1323155933.db2.gz	IFDNJANPNFWBNU-HNNXBMFYSA-N	0	3	333.501	3.218	20	30		EGEDHN
C[C@@H](CC(C)(C)C#N)NCc1cccc(NC(=O)[C@H]2CCCO2)c1	ZINC000924778560	1323159619	/nfs/dbraw/zinc/15/96/19/1323159619.db2.gz	UYIZOMFJGMPJQS-WMLDXEAASA-N	0	3	329.444	3.222	20	30		EGEDHN
CC1(C(=O)N2CCC[C@H](CNCc3ccccc3C#N)C2)CC=CC1	ZINC001024138077	1323162935	/nfs/dbraw/zinc/16/29/35/1323162935.db2.gz	ZANUHFUGNJFNEZ-QGZVFWFLSA-N	0	3	337.467	3.243	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H](CNCc3cc(C4CC4)no3)C2)C1	ZINC001024146137	1323171497	/nfs/dbraw/zinc/17/14/97/1323171497.db2.gz	NXJQTUJWCJMNQM-HNNXBMFYSA-N	0	3	343.471	3.237	20	30		EGEDHN
C=CCN(C[C@H](O)c1ccc(F)c(Br)c1)[C@@H](C)COC	ZINC000852356296	1323182742	/nfs/dbraw/zinc/18/27/42/1323182742.db2.gz	AGKJNSUEPMCDEH-NHYWBVRUSA-N	0	3	346.240	3.145	20	30		EGEDHN
CN(C(=O)c1ccc[nH]1)C1CCC(NCc2ccccc2C#N)CC1	ZINC000963055053	1323198654	/nfs/dbraw/zinc/19/86/54/1323198654.db2.gz	IZNASHWVNQYUOC-UHFFFAOYSA-N	0	3	336.439	3.059	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)c2ccc(C)n2C)C1	ZINC000963251367	1323261239	/nfs/dbraw/zinc/26/12/39/1323261239.db2.gz	PFOJXLKZAXVDGG-IAGOWNOFSA-N	0	3	349.906	3.403	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)c2ccc(C)nc2)C1	ZINC000963260336	1323271629	/nfs/dbraw/zinc/27/16/29/1323271629.db2.gz	SRGUBAFOLYZWPJ-QZTJIDSGSA-N	0	3	347.890	3.459	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccnn1C1CCCC1	ZINC001024463959	1323419315	/nfs/dbraw/zinc/41/93/15/1323419315.db2.gz	MSWFTUHKNPRSGU-QGZVFWFLSA-N	0	3	330.476	3.159	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1cc(C2CCCCC2)n[nH]1	ZINC001024480835	1323435022	/nfs/dbraw/zinc/43/50/22/1323435022.db2.gz	PNFZYJMZRBRTKU-QGZVFWFLSA-N	0	3	342.487	3.065	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)C1C2CC3CC(C2)CC1C3	ZINC001024481135	1323435328	/nfs/dbraw/zinc/43/53/28/1323435328.db2.gz	TYBSDLZNGANSNH-RDOIFFKNSA-N	0	3	328.500	3.053	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@@H]2CCCCN2CC(=C)C)cc1	ZINC001024512141	1323461729	/nfs/dbraw/zinc/46/17/29/1323461729.db2.gz	SHOIZLMRKNCFPA-SFHVURJKSA-N	0	3	328.456	3.412	20	30		EGEDHN
C=CCCN1CCCC[C@H]1CNC(=O)c1c(F)ccc(F)c1F	ZINC001024628897	1323555760	/nfs/dbraw/zinc/55/57/60/1323555760.db2.gz	VZNHOBOIFIOHIY-LBPRGKRZSA-N	0	3	326.362	3.264	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cccc(N2CC=CC2)c1	ZINC001024677272	1323590402	/nfs/dbraw/zinc/59/04/02/1323590402.db2.gz	GRROMAFAIVOYLR-FQEVSTJZSA-N	0	3	339.483	3.223	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccc(OCC)c(C)c1	ZINC001024689941	1323606432	/nfs/dbraw/zinc/60/64/32/1323606432.db2.gz	OSDSNIALYROGQF-SFHVURJKSA-N	0	3	328.456	3.001	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccn(C(CC)CC)n1	ZINC001024691645	1323606761	/nfs/dbraw/zinc/60/67/61/1323606761.db2.gz	YIJIIDFVNGVEMF-QGZVFWFLSA-N	0	3	332.492	3.405	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1csc(C(C)(C)C)n1	ZINC001024710801	1323618380	/nfs/dbraw/zinc/61/83/80/1323618380.db2.gz	ZGZWQAFHHGGAPU-CQSZACIVSA-N	0	3	333.501	3.048	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccc(COC(C)C)cc1	ZINC001024793802	1323698635	/nfs/dbraw/zinc/69/86/35/1323698635.db2.gz	CHKDXTAGKBMOAP-FQEVSTJZSA-N	0	3	342.483	3.219	20	30		EGEDHN
N#Cc1ccc(C[NH2+]C[C@H]2CCCCN2C(=O)c2ccccc2[O-])cc1	ZINC001024876916	1323761750	/nfs/dbraw/zinc/76/17/50/1323761750.db2.gz	USIFLHMDKYFWLZ-GOSISDBHSA-N	0	3	349.434	3.048	20	30		EGEDHN
C[C@@H](C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)s1)C1CC1	ZINC001024913572	1323777805	/nfs/dbraw/zinc/77/78/05/1323777805.db2.gz	KXFPUJOIAAQYRQ-UKRRQHHQSA-N	0	3	331.485	3.137	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCCC[C@@H]1CNCc1c(C)noc1C	ZINC001025069580	1323870855	/nfs/dbraw/zinc/87/08/55/1323870855.db2.gz	LUUKBDBNUABCMA-VQIMIIECSA-N	0	3	333.476	3.364	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc(Cl)o1	ZINC001025199572	1323982641	/nfs/dbraw/zinc/98/26/41/1323982641.db2.gz	XNSZPHBYTPRZNH-HUUCEWRRSA-N	0	3	334.847	3.415	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccoc1Cl	ZINC001025223997	1324011216	/nfs/dbraw/zinc/01/12/16/1324011216.db2.gz	KEVVVVPACLVSIF-CVEARBPZSA-N	0	3	334.847	3.415	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cccc(F)c1C	ZINC001025235039	1324022636	/nfs/dbraw/zinc/02/26/36/1324022636.db2.gz	MRQWOKUVGHCDNO-RTBURBONSA-N	0	3	328.431	3.226	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1conc1C(C)C	ZINC001025236093	1324025383	/nfs/dbraw/zinc/02/53/83/1324025383.db2.gz	DGAWWRNUDBHAHW-DLBZAZTESA-N	0	3	331.460	3.443	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cn(C)c2ccccc12	ZINC001025247440	1324047144	/nfs/dbraw/zinc/04/71/44/1324047144.db2.gz	KYZLIMFHUWKWGT-RTWAWAEBSA-N	0	3	349.478	3.271	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)CCc1ccc(C)cc1	ZINC001025251538	1324055135	/nfs/dbraw/zinc/05/51/35/1324055135.db2.gz	SFVRWWLNGWXQQR-LEWJYISDSA-N	0	3	338.495	3.406	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cccc(F)c1F	ZINC001025258818	1324066906	/nfs/dbraw/zinc/06/69/06/1324066906.db2.gz	JFNSGWJUOAFZRM-ZWKOTPCHSA-N	0	3	346.421	3.447	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)Cc1cc(C)cc(C)c1	ZINC001025261675	1324072117	/nfs/dbraw/zinc/07/21/17/1324072117.db2.gz	AYTAVEYSGJMZMB-RTWAWAEBSA-N	0	3	338.495	3.325	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ocnc1C1CC1	ZINC001025268898	1324080534	/nfs/dbraw/zinc/08/05/34/1324080534.db2.gz	HWWKDVTYQFAZRD-CVEARBPZSA-N	0	3	329.444	3.197	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cccc2[nH]ccc21	ZINC001025269839	1324083192	/nfs/dbraw/zinc/08/31/92/1324083192.db2.gz	XESAHWHETODROC-PMACEKPBSA-N	0	3	335.451	3.260	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)C1CCC(F)(F)CC1	ZINC001025273528	1324089162	/nfs/dbraw/zinc/08/91/62/1324089162.db2.gz	PVTOERAQFLIGRE-IAGOWNOFSA-N	0	3	338.442	3.291	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)C1CCC(F)(F)CC1	ZINC001025273530	1324089532	/nfs/dbraw/zinc/08/95/32/1324089532.db2.gz	PVTOERAQFLIGRE-SJORKVTESA-N	0	3	338.442	3.291	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1coc(C2CC2)n1	ZINC001025278185	1324099791	/nfs/dbraw/zinc/09/97/91/1324099791.db2.gz	RNSWKZORSAMQAY-SJORKVTESA-N	0	3	329.444	3.197	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)C1(CC)CCOCC1	ZINC001025281348	1324102933	/nfs/dbraw/zinc/10/29/33/1324102933.db2.gz	TXJDKPPOYOHBSX-MOPGFXCFSA-N	0	3	346.515	3.062	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1c[nH]cc1C1CC1	ZINC001025284834	1324106815	/nfs/dbraw/zinc/10/68/15/1324106815.db2.gz	OHIYZPFYXJRMLL-VQTJNVASSA-N	0	3	339.483	3.375	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc2ccncc2c1	ZINC001025286906	1324108709	/nfs/dbraw/zinc/10/87/09/1324108709.db2.gz	MBQPXIYSSCESLV-SFTDATJTSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1CCCC[C@H]1[C@H]1CCCN1CC#CC	ZINC001025293233	1324119719	/nfs/dbraw/zinc/11/97/19/1324119719.db2.gz	QCELMIFMNKPOJH-YADHBBJMSA-N	0	3	348.490	3.079	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)C(C)(C)C(F)(F)F	ZINC001025294325	1324122765	/nfs/dbraw/zinc/12/27/65/1324122765.db2.gz	ZJPSVOBHHHTBTB-ZIAGYGMSSA-N	0	3	330.394	3.054	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)Cc1cccc(F)c1	ZINC001025297083	1324128996	/nfs/dbraw/zinc/12/89/96/1324128996.db2.gz	OBWLYWOKPZNYRH-PMACEKPBSA-N	0	3	342.458	3.237	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1c(C)noc1CC	ZINC001025297571	1324131073	/nfs/dbraw/zinc/13/10/73/1324131073.db2.gz	YSEDWQKFGLZDON-HOTGVXAUSA-N	0	3	331.460	3.191	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cnc(CC)s1	ZINC001025301615	1324135599	/nfs/dbraw/zinc/13/55/99/1324135599.db2.gz	MWQDVIMBCAICMH-LSDHHAIUSA-N	0	3	333.501	3.351	20	30		EGEDHN
C[C@@H](NC(=O)c1ccco1)[C@@H]1CCCN(Cc2ccc(C#N)cc2)C1	ZINC001025320821	1324157998	/nfs/dbraw/zinc/15/79/98/1324157998.db2.gz	QTDGJZIVQYJXII-CRAIPNDOSA-N	0	3	337.423	3.182	20	30		EGEDHN
C[C@H](NC(=O)c1ccoc1)[C@@H]1CCCN(Cc2ccc(C#N)cc2)C1	ZINC001025347071	1324193104	/nfs/dbraw/zinc/19/31/04/1324193104.db2.gz	XFGXFYRWNCPJTE-MAUKXSAKSA-N	0	3	337.423	3.182	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2oc3c(cccc3F)c2C)C1	ZINC001025441583	1324280999	/nfs/dbraw/zinc/28/09/99/1324280999.db2.gz	FUFTZGFWGCYHLB-GJZGRUSLSA-N	0	3	342.414	3.344	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2nccc3ccsc32)C1	ZINC001025447765	1324289593	/nfs/dbraw/zinc/28/95/93/1324289593.db2.gz	LTGMTMTWTGLSKN-GDBMZVCRSA-N	0	3	341.480	3.150	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc3c([nH]2)c(F)ccc3C)C1	ZINC001025465219	1324311074	/nfs/dbraw/zinc/31/10/74/1324311074.db2.gz	TXMODNKRSNAFAJ-HUUCEWRRSA-N	0	3	341.430	3.079	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2scnc2C2CCCC2)C1	ZINC001025474101	1324319024	/nfs/dbraw/zinc/31/90/24/1324319024.db2.gz	IPXOKRKGLBNCIG-ZBFHGGJFSA-N	0	3	345.512	3.264	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(C)c3cccnc23)C1	ZINC001025489063	1324339869	/nfs/dbraw/zinc/33/98/69/1324339869.db2.gz	NSBULCMYBRAZET-SJORKVTESA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(C)nc2C(C)C)C1	ZINC001025489742	1324340904	/nfs/dbraw/zinc/34/09/04/1324340904.db2.gz	QIZUYMRXIBBVSI-QZTJIDSGSA-N	0	3	341.499	3.367	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2c(C)cc(F)cc2C)C1	ZINC001025505544	1324352848	/nfs/dbraw/zinc/35/28/48/1324352848.db2.gz	IAJFGGAHKNWQOI-IAGOWNOFSA-N	0	3	330.447	3.296	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccccc2-n2cccc2)C1	ZINC001025521659	1324365755	/nfs/dbraw/zinc/36/57/55/1324365755.db2.gz	CUAXWBJAQXIUBB-RTBURBONSA-N	0	3	349.478	3.331	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(CCC)cc2)C1	ZINC001025522882	1324367487	/nfs/dbraw/zinc/36/74/87/1324367487.db2.gz	IPDYEOWIIKDTLT-FXAWDEMLSA-N	0	3	326.484	3.493	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(F)ccc2Cl)C1	ZINC001025540612	1324388668	/nfs/dbraw/zinc/38/86/68/1324388668.db2.gz	XYEBLNUYRHLRIM-UONOGXRCSA-N	0	3	336.838	3.333	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(Cl)c(OC)c2)C1	ZINC001025553017	1324399962	/nfs/dbraw/zinc/39/99/62/1324399962.db2.gz	QDMGVVRUFFTOHJ-GOEBONIOSA-N	0	3	348.874	3.202	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(C(CC)CC)no2)C1	ZINC001025555571	1324403234	/nfs/dbraw/zinc/40/32/34/1324403234.db2.gz	OVOAJFTURDQOMP-DOTOQJQBSA-N	0	3	345.487	3.432	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc3nc(C)ccc3c2)C1	ZINC001025564047	1324410381	/nfs/dbraw/zinc/41/03/81/1324410381.db2.gz	GZQLKIOHVOBKGP-PXNSSMCTSA-N	0	3	349.478	3.397	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(OC)cc2Cl)C1	ZINC001025565008	1324411652	/nfs/dbraw/zinc/41/16/52/1324411652.db2.gz	OPICYJCLNAUMJO-CABCVRRESA-N	0	3	348.874	3.202	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(OC)c(C3CC3)c2)C1	ZINC001025578424	1324418609	/nfs/dbraw/zinc/41/86/09/1324418609.db2.gz	IDSATLITFJGUDT-YJBOKZPZSA-N	0	3	340.467	3.036	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc3cccnc3s2)C1	ZINC001025586789	1324428874	/nfs/dbraw/zinc/42/88/74/1324428874.db2.gz	FLMBOOQQSXEBOR-GDBMZVCRSA-N	0	3	341.480	3.150	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(C(F)(F)F)cc2)C1	ZINC001025603202	1324453071	/nfs/dbraw/zinc/45/30/71/1324453071.db2.gz	RNRUOTVCZWFACD-ZFWWWQNUSA-N	0	3	338.373	3.169	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)C23CC4CC(CC(C4)C2)C3)C1	ZINC001025606438	1324455215	/nfs/dbraw/zinc/45/52/15/1324455215.db2.gz	FOVCJFPAENTYEQ-GZKSLDRRSA-N	0	3	328.500	3.053	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc3ccccc3n2)C1	ZINC001025606346	1324455761	/nfs/dbraw/zinc/45/57/61/1324455761.db2.gz	DQRNUGGQLMISHW-FUHWJXTLSA-N	0	3	335.451	3.088	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cccc(Cl)c2Cl)C1	ZINC001025606869	1324457298	/nfs/dbraw/zinc/45/72/98/1324457298.db2.gz	GVUZWGFBAUHXPA-STQMWFEESA-N	0	3	339.266	3.457	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2c(Cl)cccc2Cl)C1	ZINC001025610499	1324462359	/nfs/dbraw/zinc/46/23/59/1324462359.db2.gz	WWQXVCAHWYFJEK-QWHCGFSZSA-N	0	3	339.266	3.457	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cncc3ccccc32)C1	ZINC001025627418	1324478822	/nfs/dbraw/zinc/47/88/22/1324478822.db2.gz	JLVPDGCQZQUMHF-FUHWJXTLSA-N	0	3	335.451	3.088	20	30		EGEDHN
CCC(CC)C(=O)N1C[C@@H]2CC[C@H](NCc3ccccc3C#N)[C@@H]2C1	ZINC001026203860	1324662751	/nfs/dbraw/zinc/66/27/51/1324662751.db2.gz	YCSVWRSDODGNIP-ZCNNSNEGSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H]2CC[C@@H](NCc3nc(C)sc3C)[C@H]2C1	ZINC001026332488	1324732723	/nfs/dbraw/zinc/73/27/23/1324732723.db2.gz	NBVDWKXTRFZGGX-HRCADAONSA-N	0	3	347.528	3.299	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H]2CC[C@H](NCc3nc(C)sc3C)[C@@H]2C1	ZINC001026332491	1324733079	/nfs/dbraw/zinc/73/30/79/1324733079.db2.gz	NBVDWKXTRFZGGX-XHSDSOJGSA-N	0	3	347.528	3.299	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H]3CC[C@@H](NCc4ncc(C)s4)[C@H]3C2)C1	ZINC001026352896	1324746990	/nfs/dbraw/zinc/74/69/90/1324746990.db2.gz	WOBQIUASOPIZAP-HRCADAONSA-N	0	3	345.512	3.134	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H]3CC[C@H](NCc4ccccc4C#N)[C@@H]3C2)C1	ZINC001026356859	1324749873	/nfs/dbraw/zinc/74/98/73/1324749873.db2.gz	YTTUUCXXGCJRBV-ZCNNSNEGSA-N	0	3	349.478	3.241	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)[C@H]2CC23CCC3)CC1	ZINC001026569338	1324902677	/nfs/dbraw/zinc/90/26/77/1324902677.db2.gz	PSWKVCVSVYPZKS-JXQTWKCFSA-N	0	3	341.293	3.102	20	30		EGEDHN
Cc1cc(C)c(C(=O)N2CC[C@H](CNCc3ccccc3C#N)C2)o1	ZINC001026763823	1325009734	/nfs/dbraw/zinc/00/97/34/1325009734.db2.gz	YACJBHTVSMGTID-MRXNPFEDSA-N	0	3	337.423	3.020	20	30		EGEDHN
Cc1csc(C(=O)N2CC[C@H](CNCc3ccccc3C#N)C2)c1	ZINC001026829919	1325038611	/nfs/dbraw/zinc/03/86/11/1325038611.db2.gz	ZWDFVCMTLZOLCB-OAHLLOKOSA-N	0	3	339.464	3.180	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)CC(F)(F)F)C1	ZINC000963272030	1325051438	/nfs/dbraw/zinc/05/14/38/1325051438.db2.gz	RBYPXSGVLJZLPT-OLZOCXBDSA-N	0	3	338.801	3.394	20	30		EGEDHN
C[C@H](CC(C)(C)C#N)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000925199790	1325078438	/nfs/dbraw/zinc/07/84/38/1325078438.db2.gz	FYJXZQFFWFQUHF-QGZVFWFLSA-N	0	3	341.499	3.386	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)CC(C)(F)F)C1	ZINC000963355964	1325150636	/nfs/dbraw/zinc/15/06/36/1325150636.db2.gz	AEYCLJDCUOUKDY-ZIAGYGMSSA-N	0	3	334.838	3.487	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H](CNCc2cc(C3CC3)no2)C1	ZINC001027041105	1325175293	/nfs/dbraw/zinc/17/52/93/1325175293.db2.gz	PGBAYVCQEZXOOM-KUHUBIRLSA-N	0	3	331.460	3.092	20	30		EGEDHN
CC1(C)CC[C@@H](C(=O)N2CC[C@H](CNCc3ccccc3C#N)C2)C1	ZINC001027045326	1325182238	/nfs/dbraw/zinc/18/22/38/1325182238.db2.gz	QSYCCZURAAESAS-IAGOWNOFSA-N	0	3	339.483	3.323	20	30		EGEDHN
N#Cc1ccc(F)c(C(=O)NC2CCN(Cc3ccccc3)CC2)c1	ZINC000854157836	1325223081	/nfs/dbraw/zinc/22/30/81/1325223081.db2.gz	YEPDRZTXAHLTQM-UHFFFAOYSA-N	0	3	337.398	3.092	20	30		EGEDHN
CO[C@H](C#N)c1ccc(-c2ccccc2CN2CCN(C)CC2)cc1	ZINC000854194783	1325226644	/nfs/dbraw/zinc/22/66/44/1325226644.db2.gz	PDDMCGGLTOBUFC-OAQYLSRUSA-N	0	3	335.451	3.312	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)NC1CC2(CC(NCc3ccccc3C#N)C2)C1	ZINC000963696115	1325376573	/nfs/dbraw/zinc/37/65/73/1325376573.db2.gz	UHGWEAHAJXHNBP-GEUNIFFNSA-N	0	3	337.467	3.121	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)c2ccccc2)C1	ZINC001027277828	1325397065	/nfs/dbraw/zinc/39/70/65/1325397065.db2.gz	MWQXTZVGAGLRAX-FQEVSTJZSA-N	0	3	333.435	3.295	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)c(F)c2)C1	ZINC001027305109	1325449265	/nfs/dbraw/zinc/44/92/65/1325449265.db2.gz	HTMYYZCXEYACET-RHSMWYFYSA-N	0	3	331.435	3.166	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1cc3cnccc3o1)C2	ZINC000964212718	1325488804	/nfs/dbraw/zinc/48/88/04/1325488804.db2.gz	PQXYXLGGTOVLRF-UHFFFAOYSA-N	0	3	345.830	3.211	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H](N(C)Cc2ccc(F)c(C#N)c2)C1)C1CC1	ZINC001027351666	1325520337	/nfs/dbraw/zinc/52/03/37/1325520337.db2.gz	MDLZIDAGUVVQAK-KDOFPFPSSA-N	0	3	343.446	3.166	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)[C@@H]1C[C@H]1c1ccco1	ZINC000860471863	1329321557	/nfs/dbraw/zinc/32/15/57/1329321557.db2.gz	VVFWWOCOIGDGPE-MCIONIFRSA-N	0	3	338.363	3.129	20	30		EGEDHN
CC[C@@H](NC(=O)C(C#N)C(=O)[C@@H]1C[C@H]1c1ccco1)c1ccccc1	ZINC000860693483	1329344906	/nfs/dbraw/zinc/34/49/06/1329344906.db2.gz	HGKLPHRIWBFAPF-WCXIOVBPSA-N	0	3	336.391	3.359	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)[C@@H]2CCC2(C)C)C1	ZINC001027534650	1327825186	/nfs/dbraw/zinc/82/51/86/1327825186.db2.gz	BFKDULXKPGTXGC-MOPGFXCFSA-N	0	3	339.483	3.417	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)C(C)(C)C2CC2)C1	ZINC001027540557	1327839771	/nfs/dbraw/zinc/83/97/71/1327839771.db2.gz	ZEIUADGOJQWMRC-LJQANCHMSA-N	0	3	339.483	3.417	20	30		EGEDHN
N#Cc1ccc(NCCN[C@H]2CCCOc3ccc(F)cc32)nc1	ZINC000927165765	1327903214	/nfs/dbraw/zinc/90/32/14/1327903214.db2.gz	UGSLEGQHGFJKNM-INIZCTEOSA-N	0	3	326.375	3.008	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1cccc(OCC)c1)C2	ZINC000965296344	1327974430	/nfs/dbraw/zinc/97/44/30/1327974430.db2.gz	PWUNMJHMWJPERO-UHFFFAOYSA-N	0	3	348.874	3.468	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1	ZINC001027663060	1328055624	/nfs/dbraw/zinc/05/56/24/1328055624.db2.gz	VRPCLSLHMSUSOU-CYBMUJFWSA-N	0	3	325.239	3.163	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)c2cc3cccc(Cl)c3o2)C1	ZINC001027707377	1328121544	/nfs/dbraw/zinc/12/15/44/1328121544.db2.gz	GNZOJWJJJMNFLC-AWEZNQCLSA-N	0	3	330.815	3.256	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2cc(F)cc3ccncc32)C1	ZINC000966171031	1328214060	/nfs/dbraw/zinc/21/40/60/1328214060.db2.gz	ZKTUPDXUAPCXTD-IFXJQAMLSA-N	0	3	341.430	3.390	20	30		EGEDHN
N#Cc1c[nH]c(C(=O)NC[C@@H]2CCCN2Cc2ccc(C3CC3)cc2)c1	ZINC001027815656	1328267497	/nfs/dbraw/zinc/26/74/97/1328267497.db2.gz	YXOUSLVXMSWYMF-IBGZPJMESA-N	0	3	348.450	3.158	20	30		EGEDHN
C#CCCN1CCC[C@H]1CNC(=O)c1cc(Cl)sc1Cl	ZINC001027931347	1328410366	/nfs/dbraw/zinc/41/03/66/1328410366.db2.gz	FIJQPTPYYBFVRX-JTQLQIEISA-N	0	3	331.268	3.272	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2nccc3ccsc32)C1	ZINC000966846023	1328436831	/nfs/dbraw/zinc/43/68/31/1328436831.db2.gz	OOQFXMSEWMQUKO-DZGCQCFKSA-N	0	3	329.469	3.313	20	30		EGEDHN
CC[C@@H](NC[C@@H](O)c1ccc(C#N)cc1)c1cc(F)ccc1OC	ZINC000932474817	1329817160	/nfs/dbraw/zinc/81/71/60/1329817160.db2.gz	MGCBGHMTLNOMDK-QZTJIDSGSA-N	0	3	328.387	3.480	20	30		EGEDHN
C[C@H](Cc1cccnc1)NCc1cc(C#N)ccc1Br	ZINC000934231085	1329957116	/nfs/dbraw/zinc/95/71/16/1329957116.db2.gz	LNSLQABLTZESNB-GFCCVEGCSA-N	0	3	330.229	3.437	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CCN(CCC(F)(F)F)C[C@H]1C	ZINC000942128713	1331841467	/nfs/dbraw/zinc/84/14/67/1331841467.db2.gz	GUWDWDXYMFHZRD-ZIAGYGMSSA-N	0	3	343.393	3.067	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(C)c(Cl)c2)[C@H](C)C1	ZINC000942175675	1331860639	/nfs/dbraw/zinc/86/06/39/1331860639.db2.gz	JGZNBHOVLMYSEL-QAPCUYQASA-N	0	3	332.875	3.041	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3sccc3s2)[C@@H](C)C1	ZINC000942183744	1331866275	/nfs/dbraw/zinc/86/62/75/1331866275.db2.gz	LERFSKKCIGUNMJ-STQMWFEESA-N	0	3	332.494	3.426	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(C)CCC(F)(F)CC2)[C@@H](C)C1	ZINC000942192215	1331872415	/nfs/dbraw/zinc/87/24/15/1331872415.db2.gz	MMUFLNODIPGFRE-GJZGRUSLSA-N	0	3	326.431	3.052	20	30		EGEDHN
C[C@H]1CN(Cc2ccc(C#N)cc2)CC[C@H]1NC(=O)C1(F)CCCC1	ZINC000942194383	1331872959	/nfs/dbraw/zinc/87/29/59/1331872959.db2.gz	ALZRXIKGOMEUGU-MAUKXSAKSA-N	0	3	343.446	3.167	20	30		EGEDHN
C[C@@H]1CN(Cc2cccc(C#N)c2)CC[C@@H]1NC(=O)C1(F)CCCC1	ZINC000942195165	1331874776	/nfs/dbraw/zinc/87/47/76/1331874776.db2.gz	GSLHVMLEZFFAFL-QAPCUYQASA-N	0	3	343.446	3.167	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2csc(C(F)(F)F)c2)[C@@H](C)C1	ZINC000942260038	1331891119	/nfs/dbraw/zinc/89/11/19/1331891119.db2.gz	WFBWGOOTFNLFHV-WCQYABFASA-N	0	3	344.402	3.230	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc3cc(C)ccc3n2)[C@H](C)C1	ZINC000942430003	1331932358	/nfs/dbraw/zinc/93/23/58/1331932358.db2.gz	FOLLNRYMOWWVCD-AEFFLSMTSA-N	0	3	335.451	3.007	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2nc(Cl)sc2Cl)[C@@H](C)C1	ZINC000942561008	1331975491	/nfs/dbraw/zinc/97/54/91/1331975491.db2.gz	ZYTRFELHGBZDKV-IUCAKERBSA-N	0	3	334.272	3.076	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCN(Cc3cnccc3C)C[C@@H]2C)CC1	ZINC000942599627	1331996279	/nfs/dbraw/zinc/99/62/79/1331996279.db2.gz	BZQPFWZXZQMWHF-PXNSSMCTSA-N	0	3	341.499	3.463	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCN(Cc3cncc(C)c3)C[C@@H]2C)CC1	ZINC000942599886	1331996916	/nfs/dbraw/zinc/99/69/16/1331996916.db2.gz	HEGPFDBMELJXAN-FXAWDEMLSA-N	0	3	341.499	3.463	20	30		EGEDHN
C[C@@H]1CN(Cc2cccc(C#N)c2)CC[C@@H]1NC(=O)C1(C)CC=CC1	ZINC000942602291	1331999388	/nfs/dbraw/zinc/99/93/88/1331999388.db2.gz	HBIZDPIENIOQJL-APWZRJJASA-N	0	3	337.467	3.241	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(F)c(Cl)c2F)[C@H](C)C1	ZINC000942602397	1331999467	/nfs/dbraw/zinc/99/94/67/1331999467.db2.gz	ILNGHNBITKDTJN-RISCZKNCSA-N	0	3	340.801	3.082	20	30		EGEDHN
C[C@H]1CN(Cc2cccc(C#N)c2)CC[C@H]1NC(=O)C1(C)CC=CC1	ZINC000942602293	1332000015	/nfs/dbraw/zinc/00/00/15/1332000015.db2.gz	HBIZDPIENIOQJL-QFBILLFUSA-N	0	3	337.467	3.241	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3ccc(C#N)cc3)C[C@H]2C)C1	ZINC000942602842	1332000908	/nfs/dbraw/zinc/00/09/08/1332000908.db2.gz	OEWRYDJQQQHVKL-VQIMIIECSA-N	0	3	337.467	3.241	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3sc(C)nc3C)C[C@@H]2C)C1	ZINC000942603344	1332001032	/nfs/dbraw/zinc/00/10/32/1332001032.db2.gz	VXNLSWBDCBVIBF-XJKSGUPXSA-N	0	3	347.528	3.443	20	30		EGEDHN
C[C@H]1CN(Cc2cccc(C#N)c2)CC[C@H]1NC(=O)C1CC2(CC2)C1	ZINC000942698494	1332022339	/nfs/dbraw/zinc/02/23/39/1332022339.db2.gz	HRSIEKNZJJOVKE-HNAYVOBHSA-N	0	3	337.467	3.075	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2c(F)ccc(F)c2Cl)[C@@H](C)C1	ZINC000942959751	1332066908	/nfs/dbraw/zinc/06/69/08/1332066908.db2.gz	NPHHCLYYXAMMMP-GWCFXTLKSA-N	0	3	328.790	3.244	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3cc(F)ccc3o2)[C@H](C)C1	ZINC000943286777	1332138424	/nfs/dbraw/zinc/13/84/24/1332138424.db2.gz	GBSGBYSEUCUTMN-CJNGLKHVSA-N	0	3	328.387	3.035	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnc(CC(C)(C)C)s2)[C@H](C)C1	ZINC000944033769	1332312428	/nfs/dbraw/zinc/31/24/28/1332312428.db2.gz	PLGABFMMFCRJFG-ZIAGYGMSSA-N	0	3	335.517	3.358	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccccc2C(F)(F)F)[C@H](C)C1	ZINC000944263775	1332356735	/nfs/dbraw/zinc/35/67/35/1332356735.db2.gz	LECARGHEWAAVTN-DOMZBBRYSA-N	0	3	326.362	3.332	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccsc2C(F)(F)F)[C@H](C)C1	ZINC000944344532	1332379463	/nfs/dbraw/zinc/37/94/63/1332379463.db2.gz	ARMYHDDTFALKKF-PWSUYJOCSA-N	0	3	332.391	3.393	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2sc(Cl)nc2Cl)[C@@H](C)C1	ZINC000944944981	1332459924	/nfs/dbraw/zinc/45/99/24/1332459924.db2.gz	PRBOYUYFBRPSOM-DTWKUNHWSA-N	0	3	334.272	3.076	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccccc2OCC2CC2)[C@H](C)C1	ZINC000945094384	1332499419	/nfs/dbraw/zinc/49/94/19/1332499419.db2.gz	WTDUKYZMIZRXTO-QAPCUYQASA-N	0	3	328.456	3.102	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)C3(C4CC4)CCC3)CC[C@@H]2C1	ZINC000946699947	1332879651	/nfs/dbraw/zinc/87/96/51/1332879651.db2.gz	NHSKQQGYTUOYDQ-IYBDPMFKSA-N	0	3	336.907	3.490	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)c2ccsc2)CCN1Cc1ccc(C#N)cc1	ZINC000947026360	1332979279	/nfs/dbraw/zinc/97/92/79/1332979279.db2.gz	LILCTNJQCVCNRO-KSSFIOAISA-N	0	3	339.464	3.403	20	30		EGEDHN
Cc1cncc(C(=O)N[C@H]2CCN(Cc3cccc(C#N)c3)[C@@H](C)C2)c1	ZINC000947161389	1333029372	/nfs/dbraw/zinc/02/93/72/1333029372.db2.gz	FFNMNHOANYGTTH-JXFKEZNVSA-N	0	3	348.450	3.045	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)CC2CCC2)CCN1Cc1ccc(C#N)cc1	ZINC000947166521	1333033074	/nfs/dbraw/zinc/03/30/74/1333033074.db2.gz	ORCRUBZPARNQAQ-DNVCBOLYSA-N	0	3	325.456	3.218	20	30		EGEDHN
Cc1cc(CN2CC[C@H](NC(=O)c3cc(C#N)c[nH]3)C[C@@H]2C)cs1	ZINC000947171606	1333035383	/nfs/dbraw/zinc/03/53/83/1333035383.db2.gz	YELSMRXQINIAIP-LRDDRELGSA-N	0	3	342.468	3.039	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CCN(CCC(F)(F)F)[C@H](C)C1	ZINC000947391118	1333112725	/nfs/dbraw/zinc/11/27/25/1333112725.db2.gz	GVLXYXJKGMZTHU-ZIAGYGMSSA-N	0	3	343.393	3.209	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C3CCCCC3)n[nH]2)C[C@H]1C	ZINC000947403859	1333116639	/nfs/dbraw/zinc/11/66/39/1333116639.db2.gz	HVCQXZPDPSZIQH-WBVHZDCISA-N	0	3	342.487	3.063	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccc3c(C)c(C)[nH]c32)C[C@H]1C	ZINC000947454168	1333134288	/nfs/dbraw/zinc/13/42/88/1333134288.db2.gz	FSEDOFPBWZGIOS-RHSMWYFYSA-N	0	3	337.467	3.391	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2c(C)c(F)ccc2Cl)C[C@@H]1C	ZINC000947467590	1333139607	/nfs/dbraw/zinc/13/96/07/1333139607.db2.gz	CPHMTJYKBBQLIP-JSGCOSHPSA-N	0	3	336.838	3.394	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2cc3ccccc3s2)C[C@@H]1C	ZINC000947540748	1333164776	/nfs/dbraw/zinc/16/47/76/1333164776.db2.gz	YBMJXTBSUCGAEH-DOTOQJQBSA-N	0	3	340.492	3.436	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2c(C)occ2C(F)(F)F)C[C@@H]1C	ZINC000947547671	1333167621	/nfs/dbraw/zinc/16/76/21/1333167621.db2.gz	SWVWVGHPXNIARR-CMPLNLGQSA-N	0	3	330.350	3.376	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2sccc2-n2cccc2)C[C@H]1C	ZINC000947597539	1333187878	/nfs/dbraw/zinc/18/78/78/1333187878.db2.gz	ICDWOCBSONZFEW-CABCVRRESA-N	0	3	329.469	3.308	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)C2(C)CCC2)CCN1Cc1ccc(C#N)cc1	ZINC000947622051	1333196299	/nfs/dbraw/zinc/19/62/99/1333196299.db2.gz	ZYGCWPXIKLJGJX-QAPCUYQASA-N	0	3	325.456	3.218	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C(C)(C)c2ccc(Cl)cc2)C[C@H]1C	ZINC000947670641	1333217568	/nfs/dbraw/zinc/21/75/68/1333217568.db2.gz	HBSLCCPMQUEOEL-PBHICJAKSA-N	0	3	332.875	3.220	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(F)c(Cl)cc2F)C[C@@H]1C	ZINC000947674996	1333218439	/nfs/dbraw/zinc/21/84/39/1333218439.db2.gz	DPKIDFAAGMXRQI-QWRGUYRKSA-N	0	3	328.790	3.387	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C(C)(C)c2cccc(F)c2)C[C@H]1C	ZINC000947718815	1333239308	/nfs/dbraw/zinc/23/93/08/1333239308.db2.gz	CGRDWURVTQXTOL-QAPCUYQASA-N	0	3	330.447	3.096	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C(C)(C)C)oc2C)C[C@@H]1C	ZINC000947751242	1333250938	/nfs/dbraw/zinc/25/09/38/1333250938.db2.gz	WIRJWOLNLHMHDP-HOCLYGCPSA-N	0	3	330.472	3.492	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnc(-c3ccoc3)s2)C[C@H]1C	ZINC000947778367	1333258210	/nfs/dbraw/zinc/25/82/10/1333258210.db2.gz	BROKSPPMGHTXPR-TZMCWYRMSA-N	0	3	331.441	3.172	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(OC)c(C3CC3)c2)C[C@H]1C	ZINC000947868720	1333286241	/nfs/dbraw/zinc/28/62/41/1333286241.db2.gz	YEBKTRCMZBOMGX-QAPCUYQASA-N	0	3	340.467	3.179	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cccc(OCCC)c2)C[C@H]1C	ZINC000947912950	1333304773	/nfs/dbraw/zinc/30/47/73/1333304773.db2.gz	SVILKUMZHYSHCE-MJGOQNOKSA-N	0	3	342.483	3.010	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C23CC4CC(CC(C4)C2)C3)C[C@@H]1C	ZINC000947966436	1333323409	/nfs/dbraw/zinc/32/34/09/1333323409.db2.gz	ASNZERARSDUTPH-GZKSLDRRSA-N	0	3	328.500	3.195	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)nc3ccccc32)C[C@@H]1C	ZINC000947997652	1333336405	/nfs/dbraw/zinc/33/64/05/1333336405.db2.gz	FAMUAYYOGAASLD-IRXDYDNUSA-N	0	3	335.451	3.149	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3ccc(Cl)cc3)CC2)C[C@@H]1C	ZINC000948001631	1333337788	/nfs/dbraw/zinc/33/77/88/1333337788.db2.gz	CNMLKZFZDHDRAM-MAUKXSAKSA-N	0	3	344.886	3.364	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2sc(C(C)C)nc2C)C[C@@H]1C	ZINC000948029354	1333346278	/nfs/dbraw/zinc/34/62/78/1333346278.db2.gz	AFHMDUIBIIMYKQ-DZGCQCFKSA-N	0	3	333.501	3.181	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3ccc(C)cc3)CCC2)C[C@@H]1C	ZINC000948082558	1333369640	/nfs/dbraw/zinc/36/96/40/1333369640.db2.gz	FHZNQPZMXRBMHX-AZUAARDMSA-N	0	3	338.495	3.409	20	30		EGEDHN
CN(C(=O)[C@@H]1CC1(F)F)[C@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948355456	1333491104	/nfs/dbraw/zinc/49/11/04/1333491104.db2.gz	ZMLKAGSKCOWKFT-IRXDYDNUSA-N	0	3	347.409	3.026	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2cc(C(F)F)ccc2F)CC1	ZINC000948376912	1333502580	/nfs/dbraw/zinc/50/25/80/1333502580.db2.gz	DLYRNPLXILYFKT-CQSZACIVSA-N	0	3	338.373	3.323	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2cc3ccccc3nc2C)CC1	ZINC000948416653	1333516686	/nfs/dbraw/zinc/51/66/86/1333516686.db2.gz	LORYDTZWYGVYAO-SFHVURJKSA-N	0	3	335.451	3.103	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cc(C)n([C@H](C)CC)n2)CC1	ZINC000948570232	1333580250	/nfs/dbraw/zinc/58/02/50/1333580250.db2.gz	ITAOLTKUCUQJCW-SJLPKXTDSA-N	0	3	344.503	3.112	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2c(C)[nH]c3ccccc32)CC1	ZINC000948602292	1333591808	/nfs/dbraw/zinc/59/18/08/1333591808.db2.gz	JIEXROOALHNNRM-KRWDZBQOSA-N	0	3	337.467	3.426	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)[C@H]2CCc3cc(F)ccc32)CC1	ZINC000948621636	1333600547	/nfs/dbraw/zinc/60/05/47/1333600547.db2.gz	SMSZXNJUBGYFRL-QUCCMNQESA-N	0	3	342.458	3.192	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cnc(CC3CC3)s2)CC1	ZINC000948642395	1333608055	/nfs/dbraw/zinc/60/80/55/1333608055.db2.gz	HDHLQPRZOKKCEP-INIZCTEOSA-N	0	3	345.512	3.045	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@H]2CCCN(C/C=C/Cl)CC2)cc1	ZINC000948665950	1333620877	/nfs/dbraw/zinc/62/08/77/1333620877.db2.gz	WRVONKYEXHMPIH-VRQAPCGNSA-N	0	3	330.859	3.347	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@@H]2CCCN(C/C=C\Cl)CC2)cc1	ZINC000948665948	1333620977	/nfs/dbraw/zinc/62/09/77/1333620977.db2.gz	WRVONKYEXHMPIH-OHMHXEGESA-N	0	3	330.859	3.347	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)Cc2cc(C)ccc2C)CC1	ZINC000948742702	1333654621	/nfs/dbraw/zinc/65/46/21/1333654621.db2.gz	LHOJFBRBJMSBFG-HXUWFJFHSA-N	0	3	326.484	3.182	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2ccc(OCC)c(C)c2)CC1	ZINC000948824629	1333698707	/nfs/dbraw/zinc/69/87/07/1333698707.db2.gz	KHANQSJGNFDQGL-IBGZPJMESA-N	0	3	342.483	3.344	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2cc(C(CC)CC)no2)CC1	ZINC000948836604	1333703941	/nfs/dbraw/zinc/70/39/41/1333703941.db2.gz	KNOWAURPXOMSHW-MRXNPFEDSA-N	0	3	331.460	3.138	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2)CC1	ZINC000948845907	1333707226	/nfs/dbraw/zinc/70/72/26/1333707226.db2.gz	YNPOPNGAVVZKEZ-GBESFXJTSA-N	0	3	344.886	3.390	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2ccc3nc(C)ccc3c2)CC1	ZINC000948877812	1333717283	/nfs/dbraw/zinc/71/72/83/1333717283.db2.gz	RPCVPTWYCHPRGM-LJQANCHMSA-N	0	3	335.451	3.103	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@@H]1CNC(=O)c1cnccc1C	ZINC000948906849	1333728860	/nfs/dbraw/zinc/72/88/60/1333728860.db2.gz	SIAVHQRTLFOJQH-FQEVSTJZSA-N	0	3	335.451	3.295	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@H]3CC=CCC3)CC2)C1	ZINC000949295341	1333817381	/nfs/dbraw/zinc/81/73/81/1333817381.db2.gz	DVJQQCRWLRPBJE-SFHVURJKSA-N	0	3	332.488	3.002	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C3CC4(CCC4)C3)CC2)C1	ZINC000949443873	1333848290	/nfs/dbraw/zinc/84/82/90/1333848290.db2.gz	APIGQDMETWCTMQ-UHFFFAOYSA-N	0	3	346.515	3.226	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@]3(C)CCC[C@H]3C)CC2)C1	ZINC000949463180	1333854391	/nfs/dbraw/zinc/85/43/91/1333854391.db2.gz	KXQXQZULMVIZSY-UYAOXDASSA-N	0	3	348.531	3.472	20	30		EGEDHN
CCCCCCCCCCS(=O)(=O)N[C@H]1CCN(C)C[C@H]1C	ZINC001201837831	1369631481	/nfs/dbraw/zinc/63/14/81/1369631481.db2.gz	VEMJFHYUFQDWLC-SJORKVTESA-N	0	3	332.554	3.387	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)Cc2ccc(CCCC)cc2)C1	ZINC000967252434	1335678840	/nfs/dbraw/zinc/67/88/40/1335678840.db2.gz	DPRPIAFNTPQVRT-GHTZIAJQSA-N	0	3	340.511	3.422	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2cc(C)cc(OC)c2C)C1	ZINC000967258281	1335679282	/nfs/dbraw/zinc/67/92/82/1335679282.db2.gz	OVVDQUZBSKUCSP-CRAIPNDOSA-N	0	3	330.472	3.328	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](C)[C@@H](NC(=O)c2nc3cnccc3s2)C1	ZINC000967315707	1335699018	/nfs/dbraw/zinc/69/90/18/1335699018.db2.gz	RDTAYGOUSWDUEQ-HIFRSBDPSA-N	0	3	344.484	3.098	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)Cc2cccc(C)c2Cl)C1	ZINC000967340513	1335707323	/nfs/dbraw/zinc/70/73/23/1335707323.db2.gz	WOEASKITYHYMIY-PBHICJAKSA-N	0	3	332.875	3.041	20	30		EGEDHN
C=C(C)CCN1CC[C@H](C)[C@H](NC(=O)c2ncc(Cl)s2)C1	ZINC000967355577	1335712088	/nfs/dbraw/zinc/71/20/88/1335712088.db2.gz	HOSOBSXSZSAOKU-NWDGAFQWSA-N	0	3	327.881	3.203	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2nc(Cl)sc2Cl)C1	ZINC000967720119	1335806967	/nfs/dbraw/zinc/80/69/67/1335806967.db2.gz	IQXXHJVLHUZZKN-UWVGGRQHSA-N	0	3	348.299	3.466	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2coc(C3CCCC3)n2)C1	ZINC000968486866	1335938169	/nfs/dbraw/zinc/93/81/69/1335938169.db2.gz	AOKHCYWEVKEYFM-HOCLYGCPSA-N	0	3	331.460	3.349	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2ccc3scnc3c2)C1	ZINC000968498258	1335942192	/nfs/dbraw/zinc/94/21/92/1335942192.db2.gz	YUUMTYGDGKRBEU-XJKSGUPXSA-N	0	3	329.469	3.313	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ncccc2C(F)(F)F)C1	ZINC000968500385	1335942898	/nfs/dbraw/zinc/94/28/98/1335942898.db2.gz	CZWPPRXWCACZHS-OCCSQVGLSA-N	0	3	341.377	3.117	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2ccc3ccn(C)c3c2)C1	ZINC000968506084	1335946280	/nfs/dbraw/zinc/94/62/80/1335946280.db2.gz	RVWWBCLFHOGPKB-MAUKXSAKSA-N	0	3	325.456	3.195	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2c[nH]cc2-c2ccccc2)C1	ZINC000968646603	1335994708	/nfs/dbraw/zinc/99/47/08/1335994708.db2.gz	FHTMOWGXCCPJLK-JXFKEZNVSA-N	0	3	335.451	3.145	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2c[nH]c3ccc(F)cc23)C1	ZINC000968700671	1336017407	/nfs/dbraw/zinc/01/74/07/1336017407.db2.gz	AGESJPBLWJCBCR-FZKQIMNGSA-N	0	3	329.419	3.323	20	30		EGEDHN
N#Cc1ccc(CN2CCCCC[C@@H]2CNC(=O)C2CC=CC2)cc1	ZINC000968790709	1336051937	/nfs/dbraw/zinc/05/19/37/1336051937.db2.gz	GVUCMOFORZUUJN-HXUWFJFHSA-N	0	3	337.467	3.385	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1nsc2ccccc21	ZINC000968869273	1336073026	/nfs/dbraw/zinc/07/30/26/1336073026.db2.gz	LGQJOSURKQDLFH-AWEZNQCLSA-N	0	3	329.469	3.457	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NC[C@H]1CCCCCN1CC=C	ZINC000968923521	1336091597	/nfs/dbraw/zinc/09/15/97/1336091597.db2.gz	VWJXKTVATDCFAP-QGZVFWFLSA-N	0	3	328.456	3.412	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1coc(C(F)(F)F)n1	ZINC000968936492	1336095639	/nfs/dbraw/zinc/09/56/39/1336095639.db2.gz	JHFKPHJPUZLHEH-LBPRGKRZSA-N	0	3	345.365	3.244	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1cccc(OCC)c1	ZINC000969050843	1336128920	/nfs/dbraw/zinc/12/89/20/1336128920.db2.gz	WALHRQGRQQUOJH-GOSISDBHSA-N	0	3	328.456	3.083	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cnc(C)nc1C(C)C	ZINC000969057087	1336131715	/nfs/dbraw/zinc/13/17/15/1336131715.db2.gz	RKRVQPGPWVWZJA-MRXNPFEDSA-N	0	3	330.476	3.069	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)[C@H]1CCOc2ccccc21	ZINC000969072245	1336137643	/nfs/dbraw/zinc/13/76/43/1336137643.db2.gz	CGKNMBRVAXTBAB-WMZOPIPTSA-N	0	3	328.456	3.100	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cnn(CCC)c1C1CC1	ZINC000969108470	1336146872	/nfs/dbraw/zinc/14/68/72/1336146872.db2.gz	CHQYAFWOXSKDCU-KRWDZBQOSA-N	0	3	344.503	3.331	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccc(N(C)C)c(F)c1	ZINC000969156357	1336165920	/nfs/dbraw/zinc/16/59/20/1336165920.db2.gz	QVDFXZRMQSIHBN-MRXNPFEDSA-N	0	3	333.451	3.052	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(C(=O)[C@@H]3C[C@@H]4CCCC[C@H]34)C2)s1	ZINC000969437569	1336210232	/nfs/dbraw/zinc/21/02/32/1336210232.db2.gz	YZQJZMAEBBJSOO-IHETXDGRSA-N	0	3	343.496	3.137	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3c(C)nsc3C)C2)CC1	ZINC000969829949	1336251890	/nfs/dbraw/zinc/25/18/90/1336251890.db2.gz	ABETXYFXPADQSY-MRXNPFEDSA-N	0	3	333.501	3.197	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3sc(C)nc3C)C2)CC1	ZINC000969830623	1336251923	/nfs/dbraw/zinc/25/19/23/1336251923.db2.gz	OWQZPUQFXRGABH-MRXNPFEDSA-N	0	3	333.501	3.197	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)c2ccc(OC)c(C(C)C)c2)C1	ZINC000970068646	1336275818	/nfs/dbraw/zinc/27/58/18/1336275818.db2.gz	UYMRVZKCGATITB-HNNXBMFYSA-N	0	3	330.472	3.445	20	30		EGEDHN
C#CCCN1CC([C@H](C)NC(=O)c2cc3cc(Cl)ccc3o2)C1	ZINC000970081990	1336277632	/nfs/dbraw/zinc/27/76/32/1336277632.db2.gz	KMUFOVGOMZLFBJ-LBPRGKRZSA-N	0	3	330.815	3.160	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H](C)C2CN([C@H](C)c3cccc(C)c3)C2)c1	ZINC000970400901	1336304058	/nfs/dbraw/zinc/30/40/58/1336304058.db2.gz	HSZKDIIDRUASOS-IAGOWNOFSA-N	0	3	347.462	3.183	20	30		EGEDHN
C#CCCN1CC([C@H](C)NC(=O)c2cc3cc(C)ccc3s2)C1	ZINC000970676462	1336332588	/nfs/dbraw/zinc/33/25/88/1336332588.db2.gz	PXTBNRYKUGGSKU-AWEZNQCLSA-N	0	3	326.465	3.283	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cc(Cl)c(Cl)n2C)CC1	ZINC001005473608	1336357763	/nfs/dbraw/zinc/35/77/63/1336357763.db2.gz	RTSYNKOMSLPDAI-UHFFFAOYSA-N	0	3	330.259	3.054	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2ccnc(-c3ccco3)c2)CC1	ZINC001005556818	1336371083	/nfs/dbraw/zinc/37/10/83/1336371083.db2.gz	LDNAABYXFRIWIQ-UHFFFAOYSA-N	0	3	325.412	3.064	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cccc([C@H]3CCOC3)c2)CC1	ZINC001005630149	1336385620	/nfs/dbraw/zinc/38/56/20/1336385620.db2.gz	WLJNBGYIGQWTMQ-IBGZPJMESA-N	0	3	342.483	3.303	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2nsc3ccc(C)cc32)CC1	ZINC001005815480	1336404108	/nfs/dbraw/zinc/40/41/08/1336404108.db2.gz	RJJBTRKELIBZTO-UHFFFAOYSA-N	0	3	329.469	3.327	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cncc3sccc32)CC1	ZINC001005869581	1336413326	/nfs/dbraw/zinc/41/33/26/1336413326.db2.gz	NGFFFFAUKCESCY-UHFFFAOYSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cccc(N3CC=CC3)c2)CC1	ZINC001006061601	1336445219	/nfs/dbraw/zinc/44/52/19/1336445219.db2.gz	UFNWNJYDDFZEKE-UHFFFAOYSA-N	0	3	339.483	3.175	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2sc(C(C)(C)C)nc2C)CC1	ZINC001006473235	1336513871	/nfs/dbraw/zinc/51/38/71/1336513871.db2.gz	SVLRBAAKIHYRDD-UHFFFAOYSA-N	0	3	335.517	3.471	20	30		EGEDHN
C=C(C)CCN1CCC[C@H](NC(=O)c2n[nH]c(C3CC3)c2Cl)C1	ZINC001007780087	1336698584	/nfs/dbraw/zinc/69/85/84/1336698584.db2.gz	FBASNEFWXYGLQL-ZDUSSCGKSA-N	0	3	336.867	3.101	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2cc(-c3cccs3)on2)C1	ZINC001008110400	1336771802	/nfs/dbraw/zinc/77/18/02/1336771802.db2.gz	UTAGHORLVIQPII-CYBMUJFWSA-N	0	3	331.441	3.173	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCN(CCc3cccs3)C2)cc1	ZINC001008150910	1336780978	/nfs/dbraw/zinc/78/09/78/1336780978.db2.gz	XAOBYLITDFEYIK-SFHVURJKSA-N	0	3	338.476	3.166	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2ccccc2OC2CCC2)C1	ZINC001008478023	1336867186	/nfs/dbraw/zinc/86/71/86/1336867186.db2.gz	CBEGFZVHOHUWIH-MRXNPFEDSA-N	0	3	328.456	3.388	20	30		EGEDHN
C=C(C)CCN1CCC[C@H](NC(=O)c2csc(C(F)(F)F)n2)C1	ZINC001009096308	1336968612	/nfs/dbraw/zinc/96/86/12/1336968612.db2.gz	MDTAMOGNFDDWNV-NSHDSACASA-N	0	3	347.406	3.322	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCN([C@H](C)c3cccc(C)c3)C2)nc1	ZINC001009271998	1336994723	/nfs/dbraw/zinc/99/47/23/1336994723.db2.gz	WSGNGVCXQKJBQG-XLIONFOSSA-N	0	3	347.462	3.327	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)Cc2coc3cc(C)ccc23)C1	ZINC001009438889	1337023652	/nfs/dbraw/zinc/02/36/52/1337023652.db2.gz	YWOPPKOIHOFIII-KRWDZBQOSA-N	0	3	326.440	3.440	20	30		EGEDHN
CC(C)c1ccccc1CN1CC[C@@H](NC(=O)c2cc(C#N)c[nH]2)C1	ZINC001010482053	1337204576	/nfs/dbraw/zinc/20/45/76/1337204576.db2.gz	WNNWCPJSMLTYTD-QGZVFWFLSA-N	0	3	336.439	3.014	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CCN(Cc2cc(C)cc(C)c2)C1	ZINC001014726027	1337887240	/nfs/dbraw/zinc/88/72/40/1337887240.db2.gz	VPPBJZXNGJWIPC-LJQANCHMSA-N	0	3	337.467	3.295	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CCN(Cc2ccc(C)c(C)c2)C1	ZINC001014731844	1337890890	/nfs/dbraw/zinc/89/08/90/1337890890.db2.gz	NPLTWOQEQUKHAO-IBGZPJMESA-N	0	3	337.467	3.295	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CCN([C@H](C)c3cc(C)ccc3C)C2)c1	ZINC001015680307	1338254869	/nfs/dbraw/zinc/25/48/69/1338254869.db2.gz	ZUHIUGSRJKSXMC-YLJYHZDGSA-N	0	3	347.462	3.245	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N[C@H]1CCN(Cc2cccc(C)c2)C1	ZINC001015816972	1338325259	/nfs/dbraw/zinc/32/52/59/1338325259.db2.gz	QZLISVSMIOVLRK-UFYCRDLUSA-N	0	3	342.483	3.057	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3ccccc3C(C)C)C2)nc1	ZINC001016027860	1338415180	/nfs/dbraw/zinc/41/51/80/1338415180.db2.gz	SWJCHVODWKLTAD-IBGZPJMESA-N	0	3	347.462	3.191	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@H]3NC(=O)CC3CCC3)CC2)c1	ZINC001016544723	1338640369	/nfs/dbraw/zinc/64/03/69/1338640369.db2.gz	GQLJLLIFANPOJN-LJQANCHMSA-N	0	3	337.467	3.219	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2cccc3c2CCCCC3)CC1	ZINC001016672286	1338686233	/nfs/dbraw/zinc/68/62/33/1338686233.db2.gz	OUTBSVNWSJYTCN-HXUWFJFHSA-N	0	3	336.479	3.173	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)[C@@H]2CC[C@@H](c3ccccc3)C2)CC1	ZINC001016685464	1338689843	/nfs/dbraw/zinc/68/98/43/1338689843.db2.gz	PZGCASLHPUXLLA-AQNXPRMDSA-N	0	3	336.479	3.174	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)[C@H](C)c2c(F)cccc2F)CC1	ZINC001016738955	1338708328	/nfs/dbraw/zinc/70/83/28/1338708328.db2.gz	UVSWDZOADWLWQC-RHSMWYFYSA-N	0	3	346.421	3.062	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cc3cc(C)ccc3[nH]2)CC1	ZINC001016764694	1338716872	/nfs/dbraw/zinc/71/68/72/1338716872.db2.gz	YJHXDIMESXLKTI-LJQANCHMSA-N	0	3	335.451	3.084	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)[C@H](C)c2ccc(Cl)cc2)CC1	ZINC001016809051	1338733365	/nfs/dbraw/zinc/73/33/65/1338733365.db2.gz	UIAOJHYIPVNFIR-CRAIPNDOSA-N	0	3	344.886	3.438	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccc(C(C)C)nc2C)CC1	ZINC001016831864	1338740306	/nfs/dbraw/zinc/74/03/06/1338740306.db2.gz	FVKUVWMAGXEDFP-LJQANCHMSA-N	0	3	339.483	3.121	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)[C@@H](C)c2cc3ccccc3o2)CC1	ZINC001016921284	1338770539	/nfs/dbraw/zinc/77/05/39/1338770539.db2.gz	PULGPUWUSBBQRF-KXBFYZLASA-N	0	3	336.435	3.140	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)C(C)(C)c2ccc(C)cc2)CC1	ZINC001016940249	1338776846	/nfs/dbraw/zinc/77/68/46/1338776846.db2.gz	JSJYADWMSSNCKY-IBGZPJMESA-N	0	3	338.495	3.267	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(Cl)cc2Cl)CC1	ZINC001016944836	1338779010	/nfs/dbraw/zinc/77/90/10/1338779010.db2.gz	UEFDUIWEFRUSFW-HNNXBMFYSA-N	0	3	337.250	3.211	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2sc(CCC)nc2C)CC1	ZINC001016976235	1338789336	/nfs/dbraw/zinc/78/93/36/1338789336.db2.gz	VUYLBROAPBTRJV-OAHLLOKOSA-N	0	3	345.512	3.012	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@@H](CN(C)Cc3ccccn3)C2)CC1	ZINC001017196074	1338941225	/nfs/dbraw/zinc/94/12/25/1338941225.db2.gz	DOOIOFNHAGWUEY-SFHVURJKSA-N	0	3	341.499	3.498	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H](CN(C)Cc2cnc(C)nc2)C1	ZINC001017201885	1338946711	/nfs/dbraw/zinc/94/67/11/1338946711.db2.gz	MYQKBBHHEMEBSY-YLJYHZDGSA-N	0	3	344.503	3.058	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001017219919	1338961027	/nfs/dbraw/zinc/96/10/27/1338961027.db2.gz	MQQJPAJQNSNYEL-HDMKZQKVSA-N	0	3	345.512	3.336	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)COc1cc(C)ccc1F	ZINC001017551701	1339366154	/nfs/dbraw/zinc/36/61/54/1339366154.db2.gz	JOXIKWDRZBARMK-CALCHBBNSA-N	0	3	346.446	3.154	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C(C)(C)c1cc(C)ccn1	ZINC001017658433	1339385706	/nfs/dbraw/zinc/38/57/06/1339385706.db2.gz	GZTFNCOROXWKBD-HDICACEKSA-N	0	3	341.499	3.309	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc(CC)cc1	ZINC001018004409	1339479942	/nfs/dbraw/zinc/47/99/42/1339479942.db2.gz	HHGGUHCQRQVGAC-BGYRXZFFSA-N	0	3	326.484	3.433	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CO[C@H]1CCC[C@H](C)C1	ZINC001018014548	1339481649	/nfs/dbraw/zinc/48/16/49/1339481649.db2.gz	LQUDVTXAROHLLY-OKYOBFRVSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CCO[C@H](C(C)C)C1	ZINC001018144860	1339513615	/nfs/dbraw/zinc/51/36/15/1339513615.db2.gz	UVZVDOUWSBGBRP-YRXWBPOGSA-N	0	3	334.504	3.079	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccc(OCCC)c1	ZINC001018151483	1339515980	/nfs/dbraw/zinc/51/59/80/1339515980.db2.gz	CJQMTDFUENIGAW-KDURUIRLSA-N	0	3	342.483	3.269	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H]1CCO[C@@H](C(C)C)C1	ZINC001018161450	1339519128	/nfs/dbraw/zinc/51/91/28/1339519128.db2.gz	ZHTKANVCUURJMP-YSTOQKLRSA-N	0	3	348.531	3.469	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(OCC)cc1	ZINC001018229979	1339541495	/nfs/dbraw/zinc/54/14/95/1339541495.db2.gz	PQNYOLIFCVYRSC-HDICACEKSA-N	0	3	328.456	3.340	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H](C)n1nc(C)cc1C	ZINC001018270954	1339556588	/nfs/dbraw/zinc/55/65/88/1339556588.db2.gz	XCJXGQOHOKDJAU-QRVBRYPASA-N	0	3	344.503	3.092	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1C[C@H]1c1cc(F)ccc1F	ZINC001018291730	1339564953	/nfs/dbraw/zinc/56/49/53/1339564953.db2.gz	LYTURDGFMLHNAE-UIBIWLFHSA-N	0	3	346.421	3.320	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)n1c(C)ccc1C	ZINC001018303896	1339569679	/nfs/dbraw/zinc/56/96/79/1339569679.db2.gz	QONWJRMZLHJOJH-QRVBRYPASA-N	0	3	329.488	3.307	20	30		EGEDHN
C[C@@H](N[C@H]1CCN(C(=O)c2c[nH]c(C#N)c2)C1)c1ccccc1Cl	ZINC001018747878	1339718795	/nfs/dbraw/zinc/71/87/95/1339718795.db2.gz	OOBJJTKBKRKCEK-OCCSQVGLSA-N	0	3	342.830	3.105	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1nsc2ccc(C)cc21	ZINC001028073334	1340409888	/nfs/dbraw/zinc/40/98/88/1340409888.db2.gz	QQXLLLOVCWYLNM-AWEZNQCLSA-N	0	3	329.469	3.375	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCCN2Cc2ccc(C)c(C)c2)cn1	ZINC001028269758	1340523636	/nfs/dbraw/zinc/52/36/36/1340523636.db2.gz	ANYRTAXGJPFQIO-NRFANRHFSA-N	0	3	347.462	3.074	20	30		EGEDHN
C#CCCN1CCC[C@H]1CNC(=O)c1cc2c(s1)CC[C@@H](C)C2	ZINC001028306158	1340554803	/nfs/dbraw/zinc/55/48/03/1340554803.db2.gz	DJBDBQMFNOBFMO-ZBFHGGJFSA-N	0	3	330.497	3.090	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H]1CNC(=O)c1ccc(P(C)(C)=O)cc1	ZINC001028331462	1340569297	/nfs/dbraw/zinc/56/92/97/1340569297.db2.gz	SNNOTBNEHZEXBE-QGZVFWFLSA-N	0	3	348.427	3.095	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)C1CC(c2cccc(F)c2)C1	ZINC001028349091	1340587589	/nfs/dbraw/zinc/58/75/89/1340587589.db2.gz	HODFDTNHYOXTQA-FAFZWHIHSA-N	0	3	330.447	3.476	20	30		EGEDHN
Cc1cccc(C(=O)NC[C@@H]2CCN(Cc3ccc(C#N)cc3)C2)c1	ZINC001028387247	1340613885	/nfs/dbraw/zinc/61/38/85/1340613885.db2.gz	XQWBHCVUOCRUTB-IBGZPJMESA-N	0	3	333.435	3.119	20	30		EGEDHN
Cc1sccc1C(=O)NC[C@@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC001028531298	1340690205	/nfs/dbraw/zinc/69/02/05/1340690205.db2.gz	FJXSREVOUJIXKK-KRWDZBQOSA-N	0	3	339.464	3.180	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCN(Cc3ccccc3F)C2)cc1	ZINC001028730729	1340779148	/nfs/dbraw/zinc/77/91/48/1340779148.db2.gz	PNHZWNLQLDPZDY-KRWDZBQOSA-N	0	3	336.410	3.059	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H](CNC(=O)C3CCC(F)CC3)C2)c1	ZINC001028779772	1340810785	/nfs/dbraw/zinc/81/07/85/1340810785.db2.gz	LVXIXFGGWOJOQS-VIQWUECVSA-N	0	3	343.446	3.025	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)c2cc(Cl)cc(Cl)c2)C1	ZINC001028950368	1340892171	/nfs/dbraw/zinc/89/21/71/1340892171.db2.gz	GISJJJUUQROICY-LBPRGKRZSA-N	0	3	325.239	3.068	20	30		EGEDHN
Cc1cccc(C(=O)NC[C@H]2CCN(Cc3cccc(C#N)c3)C2)c1C	ZINC001028965036	1340894878	/nfs/dbraw/zinc/89/48/78/1340894878.db2.gz	XAPASHMNZLNXHU-HXUWFJFHSA-N	0	3	347.462	3.427	20	30		EGEDHN
CC(C)CC(=O)N1CCC([C@H](C)NCc2ccccc2C#N)CC1	ZINC001029041669	1340915625	/nfs/dbraw/zinc/91/56/25/1340915625.db2.gz	SAZXYPDGWNICHM-INIZCTEOSA-N	0	3	327.472	3.321	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)C1CCN(C(=O)[C@@H]2CC23CC3)CC1	ZINC001029151273	1340943572	/nfs/dbraw/zinc/94/35/72/1340943572.db2.gz	ZTPXMCVJSUHNFR-BEFAXECRSA-N	0	3	337.467	3.075	20	30		EGEDHN
C[C@H](C#N)C(=O)N1C[C@H]2CC[C@@H](C1)N2Cc1cccc2ccccc21	ZINC001029244424	1340960664	/nfs/dbraw/zinc/96/06/64/1340960664.db2.gz	GFDYTUJZTBASGB-LZQZEXGQSA-N	0	3	333.435	3.175	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCN(C(=O)C2(F)CCCC2)C1	ZINC001029771087	1341069029	/nfs/dbraw/zinc/06/90/29/1341069029.db2.gz	ANMROCFCVSUHDO-AWEZNQCLSA-N	0	3	349.475	3.182	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCN(C(=O)[C@H]2CCC2(C)C)C1	ZINC001029813211	1341083293	/nfs/dbraw/zinc/08/32/93/1341083293.db2.gz	RQARWQNRCNVANS-WMLDXEAASA-N	0	3	345.512	3.336	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H](CN(C)Cc2c(C)noc2C)C1	ZINC001029825798	1341087233	/nfs/dbraw/zinc/08/72/33/1341087233.db2.gz	IHMGSPJNWQTHET-VQIMIIECSA-N	0	3	333.476	3.174	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H](CN(C)Cc2oc(C)nc2C)C1	ZINC001029828910	1341088818	/nfs/dbraw/zinc/08/88/18/1341088818.db2.gz	OCJJPRPWVSKXLM-VQIMIIECSA-N	0	3	333.476	3.174	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CC[C@@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001029859209	1341098695	/nfs/dbraw/zinc/09/86/95/1341098695.db2.gz	PRQYEMPJNYAOEM-CABCVRRESA-N	0	3	333.501	3.192	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2c(F)ccc(F)c2Cl)CC[C@@H]1C	ZINC001071845076	1354975673	/nfs/dbraw/zinc/97/56/73/1354975673.db2.gz	WOHKJUYQWYCFNO-NWDGAFQWSA-N	0	3	340.801	3.224	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC(CN(C)Cc2cnc(C)o2)CC1	ZINC001029982460	1341143498	/nfs/dbraw/zinc/14/34/98/1341143498.db2.gz	AFNFSGKSOFBWJP-UHFFFAOYSA-N	0	3	333.476	3.256	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC(CN(C)Cc2c(C)onc2CC)CC1	ZINC001029983572	1341143779	/nfs/dbraw/zinc/14/37/79/1341143779.db2.gz	IOMJELJUBRRECV-UHFFFAOYSA-N	0	3	347.503	3.428	20	30		EGEDHN
C=CCn1cccc1C(=O)NCC1CN([C@@H]2CCc3ccccc32)C1	ZINC001031733069	1341394873	/nfs/dbraw/zinc/39/48/73/1341394873.db2.gz	KVZSWIXNTMEYIN-LJQANCHMSA-N	0	3	335.451	3.023	20	30		EGEDHN
C#Cc1ccc(C(=O)NCC2CN(CCCc3ccsc3)C2)cc1	ZINC001031892138	1341417653	/nfs/dbraw/zinc/41/76/53/1341417653.db2.gz	OCNPOGYWORMJTG-UHFFFAOYSA-N	0	3	338.476	3.024	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)CCc1ccccc1OCC	ZINC001032502886	1341524026	/nfs/dbraw/zinc/52/40/26/1341524026.db2.gz	WSRIHEQMSBNCJR-OALUTQOASA-N	0	3	342.483	3.269	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1	ZINC001032587667	1341550056	/nfs/dbraw/zinc/55/00/56/1341550056.db2.gz	OZVVFSAYDTVRJN-IGQOVBAYSA-N	0	3	336.888	3.366	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1cccc(Cl)c1F	ZINC001032649055	1341570027	/nfs/dbraw/zinc/57/00/27/1341570027.db2.gz	BPYNFAPRNSEZDH-GJZGRUSLSA-N	0	3	336.838	3.273	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H](C)Cc1ccccc1Cl	ZINC001032654763	1341572020	/nfs/dbraw/zinc/57/20/20/1341572020.db2.gz	IYRKQYUDGNYPMS-XIRDDKMYSA-N	0	3	332.875	3.380	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C1(Cc2ccc(F)cc2)CC1	ZINC001032672668	1341578661	/nfs/dbraw/zinc/57/86/61/1341578661.db2.gz	XNAKRXQGLWSFPT-OALUTQOASA-N	0	3	342.458	3.400	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H]1CCCc2sc(C)nc21	ZINC001032728482	1341593402	/nfs/dbraw/zinc/59/34/02/1341593402.db2.gz	ZUODQVWMORZPSR-JYJNAYRXSA-N	0	3	345.512	3.123	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1ccc(OC(C)C)cc1	ZINC001032798799	1341618099	/nfs/dbraw/zinc/61/80/99/1341618099.db2.gz	JBTQFUKLIFBIFJ-OALUTQOASA-N	0	3	342.483	3.268	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)C[C@@H]2C[C@H]2c2ccc(OC)cc2)C1	ZINC001033166375	1341743028	/nfs/dbraw/zinc/74/30/28/1341743028.db2.gz	SXSQHGMUPFCMFR-BJLQDIEVSA-N	0	3	342.483	3.298	20	30		EGEDHN
C#CCCN1CC[C@@H](N(C)C(=O)c2c(Cl)oc3ccccc32)C1	ZINC001033355049	1341794073	/nfs/dbraw/zinc/79/40/73/1341794073.db2.gz	URZXIBUXBPMDKA-CYBMUJFWSA-N	0	3	330.815	3.256	20	30		EGEDHN
C#Cc1cncc(C(=O)N(C)[C@@H]2CCN([C@H](C)c3cccc(C)c3)C2)c1	ZINC001033405895	1341816839	/nfs/dbraw/zinc/81/68/39/1341816839.db2.gz	PZNBTCSIDGGEQB-DYESRHJHSA-N	0	3	347.462	3.279	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@H]2CCN([C@H](C)c3cccc(C)c3)C2)nc1	ZINC001033597049	1341890022	/nfs/dbraw/zinc/89/00/22/1341890022.db2.gz	QXVZSDWLUZNLSJ-XLIONFOSSA-N	0	3	347.462	3.279	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2cccc(C(F)F)c2F)C1	ZINC001033830936	1342031056	/nfs/dbraw/zinc/03/10/56/1342031056.db2.gz	PZBLYIPEYCVVQS-ZDUSSCGKSA-N	0	3	338.373	3.323	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2cc(C(F)F)ccc2F)C1	ZINC001033830469	1342031282	/nfs/dbraw/zinc/03/12/82/1342031282.db2.gz	ITAHMVBLVAVPGW-AWEZNQCLSA-N	0	3	338.373	3.323	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cc3ccccc3c(=O)[nH]2)C1	ZINC001033853397	1342044616	/nfs/dbraw/zinc/04/46/16/1342044616.db2.gz	AIYDVZQRRWZHHD-MRXNPFEDSA-N	0	3	339.439	3.053	20	30		EGEDHN
C=C(C)CCN1CC[C@H](N(CC)C(=O)c2nc3cnccc3s2)C1	ZINC001033897637	1342069330	/nfs/dbraw/zinc/06/93/30/1342069330.db2.gz	PXUQDXGUOOBROF-AWEZNQCLSA-N	0	3	344.484	3.194	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2ccc(C)c(Cl)c2F)C1	ZINC001033907332	1342079535	/nfs/dbraw/zinc/07/95/35/1342079535.db2.gz	VCHSPMODRDKNIC-CQSZACIVSA-N	0	3	336.838	3.347	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2csc3ccccc32)C1	ZINC001033918814	1342087787	/nfs/dbraw/zinc/08/77/87/1342087787.db2.gz	OOQXSRLNNKVOJW-OAHLLOKOSA-N	0	3	326.465	3.461	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2cc3cccc(OC)c3o2)C1	ZINC001033942958	1342104559	/nfs/dbraw/zinc/10/45/59/1342104559.db2.gz	NVNXXXYWCRMUQX-INIZCTEOSA-N	0	3	340.423	3.001	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2c[nH]c(=O)c3ccccc23)C1	ZINC001033973978	1342123460	/nfs/dbraw/zinc/12/34/60/1342123460.db2.gz	KZUAQTCKVDRGTM-OAHLLOKOSA-N	0	3	339.439	3.053	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2ccc(OC)c(C3CC3)c2)C1	ZINC001033996966	1342137858	/nfs/dbraw/zinc/13/78/58/1342137858.db2.gz	BPQLGRPQTXMKHN-SFHVURJKSA-N	0	3	340.467	3.132	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2ccc3sccc3c2)C1	ZINC001034004691	1342142608	/nfs/dbraw/zinc/14/26/08/1342142608.db2.gz	PNYNLRXQEFXGCX-QGZVFWFLSA-N	0	3	326.465	3.461	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@@H]2CCCc3sc(C)nc32)C1	ZINC001034015198	1342153348	/nfs/dbraw/zinc/15/33/48/1342153348.db2.gz	MAEYDDXOKZYIKE-HZPDHXFCSA-N	0	3	347.528	3.370	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2ccc(COC(C)C)cc2)C1	ZINC001034033854	1342172760	/nfs/dbraw/zinc/17/27/60/1342172760.db2.gz	CPCDFXYKUCVDFS-FQEVSTJZSA-N	0	3	342.483	3.171	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CC[C@H]3CN(Cc4ccccc4)C[C@H]32)cc1	ZINC001076117518	1356495480	/nfs/dbraw/zinc/49/54/80/1356495480.db2.gz	MCLCZMJEBABOAG-LEWJYISDSA-N	0	3	330.431	3.014	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2ccc(-c3ccco3)o2)C1	ZINC001034305791	1342388468	/nfs/dbraw/zinc/38/84/68/1342388468.db2.gz	MBFYADPGWXIWNT-OAHLLOKOSA-N	0	3	326.396	3.147	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@@H]2COc3ccc(Cl)cc32)C1	ZINC001034308168	1342391045	/nfs/dbraw/zinc/39/10/45/1342391045.db2.gz	URFANZLVABVYSN-NVXWUHKLSA-N	0	3	348.874	3.363	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@H]2CCCc3cccnc32)C1	ZINC001034366492	1342436456	/nfs/dbraw/zinc/43/64/56/1342436456.db2.gz	AITKSPRHHFFJGD-ROUUACIJSA-N	0	3	327.472	3.048	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)c2cc(F)cc3cccnc32)C1	ZINC001034427709	1342490178	/nfs/dbraw/zinc/49/01/78/1342490178.db2.gz	IFJLQLYWAYJIJY-MRXNPFEDSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)Cn2cc(C)c3ccccc32)C1	ZINC001034435598	1342498525	/nfs/dbraw/zinc/49/85/25/1342498525.db2.gz	KNVKFCBYAXKKHX-KRWDZBQOSA-N	0	3	325.456	3.106	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@@H]2CCOc3ccccc32)C1	ZINC001034446118	1342506957	/nfs/dbraw/zinc/50/69/57/1342506957.db2.gz	LOKQQEYKHRYECE-FUHWJXTLSA-N	0	3	328.456	3.100	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cccc(C(F)(F)F)n2)C1	ZINC001034460790	1342516799	/nfs/dbraw/zinc/51/67/99/1342516799.db2.gz	KMPMOYCGNNPOQA-CYBMUJFWSA-N	0	3	341.377	3.261	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccncc2C(F)(F)F)C1	ZINC001034467343	1342522780	/nfs/dbraw/zinc/52/27/80/1342522780.db2.gz	JHABOGFCGKZQFK-ZDUSSCGKSA-N	0	3	341.377	3.261	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cccnc2OCC(C)C)C1	ZINC001034492416	1342548216	/nfs/dbraw/zinc/54/82/16/1342548216.db2.gz	CQNBVKPHCKVOAH-QGZVFWFLSA-N	0	3	345.487	3.277	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@@H]2CCCc3sc(C)nc32)C1	ZINC001034494376	1342550048	/nfs/dbraw/zinc/55/00/48/1342550048.db2.gz	YJLKCEBOVPYEOD-HZPDHXFCSA-N	0	3	347.528	3.418	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2c(Cl)nc3ccccn32)C1	ZINC001034516077	1342575011	/nfs/dbraw/zinc/57/50/11/1342575011.db2.gz	WDEWVAWVWOWWFV-AWEZNQCLSA-N	0	3	346.862	3.148	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc(OCC3CC3)nc2)C1	ZINC001034537820	1342595389	/nfs/dbraw/zinc/59/53/89/1342595389.db2.gz	FBHUDWHJKPMSHT-GOSISDBHSA-N	0	3	343.471	3.031	20	30		EGEDHN
N#Cc1ccc(F)cc1CN[C@H]1CC[C@H](NC(=O)C2CC=CC2)CC1	ZINC001034611901	1342648317	/nfs/dbraw/zinc/64/83/17/1342648317.db2.gz	DLLRBMGWDYYDJQ-WGSAOQKQSA-N	0	3	341.430	3.181	20	30		EGEDHN
N#Cc1ccc(F)cc1CN[C@H]1CC[C@H](NC(=O)CC2CCC2)CC1	ZINC001034613857	1342648659	/nfs/dbraw/zinc/64/86/59/1342648659.db2.gz	DKCCNCILEGVEQG-WGSAOQKQSA-N	0	3	343.446	3.405	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)CC2CCC2)CC1	ZINC001034614436	1342649146	/nfs/dbraw/zinc/64/91/46/1342649146.db2.gz	QAGXREKDMNZSKO-HDJSIYSDSA-N	0	3	329.282	3.102	20	30		EGEDHN
Cc1coc(C(=O)N[C@H]2CC[C@H](NCc3ccccc3C#N)CC2)c1	ZINC001034715374	1342710973	/nfs/dbraw/zinc/71/09/73/1342710973.db2.gz	KNJIBXWBPGLKJS-IYARVYRRSA-N	0	3	337.423	3.291	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1CC[C@H](NC(=O)[C@@H]2C[C@H]2C2CC2)CC1	ZINC001034753632	1342739429	/nfs/dbraw/zinc/73/94/29/1342739429.db2.gz	ISPPMBMOVFEKPS-LWYYNNOASA-N	0	3	337.467	3.121	20	30		EGEDHN
Cc1ccsc1C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)s1	ZINC001034842778	1342797155	/nfs/dbraw/zinc/79/71/55/1342797155.db2.gz	BVFCXDGGSHMTDC-CYBMUJFWSA-N	0	3	345.493	3.384	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)c2ccsc2)s1	ZINC001034853996	1342805458	/nfs/dbraw/zinc/80/54/58/1342805458.db2.gz	RGWUJAAPVCZGRT-CYBMUJFWSA-N	0	3	331.466	3.076	20	30		EGEDHN
C[C@]1(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)s2)CC=CCC1	ZINC001034944391	1342845417	/nfs/dbraw/zinc/84/54/17/1342845417.db2.gz	DTZLHWQUBOFBKU-BEFAXECRSA-N	0	3	343.496	3.447	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)s1	ZINC001034943858	1342845672	/nfs/dbraw/zinc/84/56/72/1342845672.db2.gz	AUECTFUHYQXPDW-CQSZACIVSA-N	0	3	333.501	3.383	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@@H]2CNCc2ncccc2C)CC1	ZINC001035039308	1342892766	/nfs/dbraw/zinc/89/27/66/1342892766.db2.gz	JGFGZAHGIYLCLX-GOSISDBHSA-N	0	3	327.472	3.217	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)s2)C1	ZINC001035044959	1342896568	/nfs/dbraw/zinc/89/65/68/1342896568.db2.gz	SQDGCELSWNHLEU-CQSZACIVSA-N	0	3	329.469	3.057	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N1CCC2(CCN(CC#Cc3ccccc3)C2)CC1	ZINC001035156968	1342972591	/nfs/dbraw/zinc/97/25/91/1342972591.db2.gz	OSMVDFOGJOTCJT-ICSRJNTNSA-N	0	3	336.479	3.009	20	30		EGEDHN
O=C(C1CC=CC1)N1CCC2(CCN(CC#Cc3ccccc3)C2)CC1	ZINC001035172435	1342988094	/nfs/dbraw/zinc/98/80/94/1342988094.db2.gz	ZNAIPZVHGFEIHP-UHFFFAOYSA-N	0	3	348.490	3.319	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC2(CCN(Cc3ocnc3C)C2)CC1	ZINC001035210949	1343029395	/nfs/dbraw/zinc/02/93/95/1343029395.db2.gz	GPPLRODKLNNEKL-UHFFFAOYSA-N	0	3	331.460	3.010	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC2(CCN(Cc3cnc(C)s3)C2)CC1	ZINC001035212390	1343030147	/nfs/dbraw/zinc/03/01/47/1343030147.db2.gz	SUBBBKGZHWFKBU-UHFFFAOYSA-N	0	3	347.528	3.478	20	30		EGEDHN
CC[C@@H](c1ccc(F)cc1)N1CC2(C1)CCN(C(=O)[C@@H](C)C#N)CC2	ZINC001035667913	1343129145	/nfs/dbraw/zinc/12/91/45/1343129145.db2.gz	AWMHXFJPYBPYHI-YJBOKZPZSA-N	0	3	343.446	3.361	20	30		EGEDHN
CCCc1ccc(CN2CC3(C2)CCN(C(=O)[C@H](C)C#N)CC3)cc1	ZINC001035670375	1343130691	/nfs/dbraw/zinc/13/06/91/1343130691.db2.gz	FAMIYUCJQIXUEN-QGZVFWFLSA-N	0	3	339.483	3.223	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccc(CCC)s1)CC2	ZINC001035717483	1343149746	/nfs/dbraw/zinc/14/97/46/1343149746.db2.gz	ZDURUEAVRDQBLC-UHFFFAOYSA-N	0	3	330.497	3.262	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc3c(cn1)CCCC3)CC2	ZINC001035749171	1343168223	/nfs/dbraw/zinc/16/82/23/1343168223.db2.gz	KCXBKOFCIILFEF-UHFFFAOYSA-N	0	3	339.483	3.075	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cc1cc3ccccc3o1)CC2	ZINC001035763165	1343176794	/nfs/dbraw/zinc/17/67/94/1343176794.db2.gz	PDORGDTVEKHRMY-UHFFFAOYSA-N	0	3	338.451	3.476	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccc(Cl)c(C)c1)CC2	ZINC001035786364	1343196947	/nfs/dbraw/zinc/19/69/47/1343196947.db2.gz	UROXJLLLPUVPHX-UHFFFAOYSA-N	0	3	330.859	3.210	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)C1[C@@H]3CCCCCC[C@@H]13)CC2	ZINC001035803428	1343205350	/nfs/dbraw/zinc/20/53/50/1343205350.db2.gz	GDUROPLNAJXWLN-QZTJIDSGSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cc(C)n(C(C)C)c1C)CC2	ZINC001035849474	1343228925	/nfs/dbraw/zinc/22/89/25/1343228925.db2.gz	AKYRXASULHUBLL-UHFFFAOYSA-N	0	3	341.499	3.247	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccc(F)c3occc31)CC2	ZINC001035854349	1343231363	/nfs/dbraw/zinc/23/13/63/1343231363.db2.gz	YIJYZMNDGXBMMM-UHFFFAOYSA-N	0	3	340.398	3.133	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)C1(C(F)(F)F)CCCC1)CC2	ZINC001035861426	1343237088	/nfs/dbraw/zinc/23/70/88/1343237088.db2.gz	VMPAJCMEUYOFJO-UHFFFAOYSA-N	0	3	342.405	3.057	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@@H](NCc3ccccc3C#N)[C@H](C)C2)o1	ZINC001035897026	1343256969	/nfs/dbraw/zinc/25/69/69/1343256969.db2.gz	OKNSJVAXSFGBMG-RDTXWAMCSA-N	0	3	337.423	3.100	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@H](NCc2cc(F)ccc2C#N)[C@H](C)C1	ZINC001035920046	1343273005	/nfs/dbraw/zinc/27/30/05/1343273005.db2.gz	NEZFWLRQVMASOG-KUHUBIRLSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](NCc2ccn(C(C)C)n2)[C@H](C)C1	ZINC001036140661	1343324970	/nfs/dbraw/zinc/32/49/70/1343324970.db2.gz	CZSLVSLZCBRSMV-NVXWUHKLSA-N	0	3	332.492	3.003	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3cc(C)no3)[C@H](C)C2)CC1	ZINC001036172812	1343345617	/nfs/dbraw/zinc/34/56/17/1343345617.db2.gz	KNXYEXUMBOHQNV-RDTXWAMCSA-N	0	3	331.460	3.056	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCCN(C(=O)C(C)(C)F)C1	ZINC001036359292	1343441328	/nfs/dbraw/zinc/44/13/28/1343441328.db2.gz	XHGJVUIBFXNDMM-YOEHRIQHSA-N	0	3	331.435	3.023	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]([C@@H](C)NCc2ncc(C)s2)C1	ZINC001036427209	1343480437	/nfs/dbraw/zinc/48/04/37/1343480437.db2.gz	JUEMWGSEKPZOGM-CABCVRRESA-N	0	3	335.517	3.380	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]([C@H](C)NCc2ccccc2C#N)C1	ZINC001036429122	1343481776	/nfs/dbraw/zinc/48/17/76/1343481776.db2.gz	SUBILBSNNLGTOL-QFBILLFUSA-N	0	3	339.483	3.487	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)C2CCC2)[C@H]1CNCc1ccc(C#N)cc1F	ZINC001036490931	1343513614	/nfs/dbraw/zinc/51/36/14/1343513614.db2.gz	WYZZELDNIRDXHT-KUHUBIRLSA-N	0	3	343.446	3.214	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@@H](C)[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001036496591	1343518017	/nfs/dbraw/zinc/51/80/17/1343518017.db2.gz	YUMFUCGDAIURHS-BEFAXECRSA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)c2ccoc2)[C@H]1CNCc1ccc(C#N)s1	ZINC001036501822	1343519882	/nfs/dbraw/zinc/51/98/82/1343519882.db2.gz	OGWCDHJSOJDXDL-DYVFJYSZSA-N	0	3	343.452	3.243	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC[C@H](C)[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001036532934	1343540508	/nfs/dbraw/zinc/54/05/08/1343540508.db2.gz	KNRZSYLGTARLRV-QGFYBQKZSA-N	0	3	343.446	3.380	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@H]2[C@@H](CCN2CC#Cc2ccc(F)cc2)C1	ZINC001036626664	1343583861	/nfs/dbraw/zinc/58/38/61/1343583861.db2.gz	APBQUXFCNDHSEZ-ICSRJNTNSA-N	0	3	342.458	3.146	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@H]2CN(C(=O)c3ccccc3)CC[C@@H]21	ZINC001036627002	1343584035	/nfs/dbraw/zinc/58/40/35/1343584035.db2.gz	GGFIKOCDCVVKGP-SFTDATJTSA-N	0	3	345.446	3.295	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@H]2[C@@H](CCN2Cc2ccccc2C#N)C1	ZINC001036629972	1343588087	/nfs/dbraw/zinc/58/80/87/1343588087.db2.gz	ZCSLATPCXJDSJK-OALUTQOASA-N	0	3	325.456	3.027	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@@H]3[C@@H](CCN3CC#Cc3ccccc3)C2)o1	ZINC001036637537	1343593402	/nfs/dbraw/zinc/59/34/02/1343593402.db2.gz	PFRUXRUDQGGYOB-VQTJNVASSA-N	0	3	348.446	3.176	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2[C@H](CCN2Cc2cncs2)C1	ZINC001036794334	1343726472	/nfs/dbraw/zinc/72/64/72/1343726472.db2.gz	SSUNSDYTJTXDFE-ZBFHGGJFSA-N	0	3	333.501	3.168	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2[C@H](CCN2Cc2cnoc2C)C1	ZINC001036794418	1343726670	/nfs/dbraw/zinc/72/66/70/1343726670.db2.gz	USZAANPARFYPJR-WBVHZDCISA-N	0	3	331.460	3.008	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@H]2[C@H](CCN2Cc2ccccc2C#N)C1	ZINC001036804187	1343738224	/nfs/dbraw/zinc/73/82/24/1343738224.db2.gz	FTSHETHYLDFJTC-MOPGFXCFSA-N	0	3	339.483	3.417	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@@H]1CCC[C@@H]1NC(=O)C1CCCC1	ZINC001036921776	1343865755	/nfs/dbraw/zinc/86/57/55/1343865755.db2.gz	HWUXAKGRERFQRX-LPHOPBHVSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCC[C@@H]2CNCc2cscn2)CC1	ZINC001037070996	1343964455	/nfs/dbraw/zinc/96/44/55/1343964455.db2.gz	ZSKDGSXJNCQWNC-NVXWUHKLSA-N	0	3	333.501	3.264	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCC[C@@H]2CNCc2nc(C)sc2C)C1	ZINC001037075533	1343968327	/nfs/dbraw/zinc/96/83/27/1343968327.db2.gz	QWUBXYWUWWUZCF-HZPDHXFCSA-N	0	3	347.528	3.491	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCC[C@@H]1NC(=O)C1CCC1	ZINC001037138492	1343988166	/nfs/dbraw/zinc/98/81/66/1343988166.db2.gz	KVDDEVHTGUGMOE-OALUTQOASA-N	0	3	325.456	3.123	20	30		EGEDHN
CC(C)C(=O)N[C@@H]1CCCC[C@H]1CNCc1cc(F)ccc1C#N	ZINC001037188770	1344028027	/nfs/dbraw/zinc/02/80/27/1344028027.db2.gz	RLDGCTCQOTZQHD-MAUKXSAKSA-N	0	3	331.435	3.118	20	30		EGEDHN
CC1(C(=O)N[C@@H]2CCCC[C@@H]2CNCc2cc(F)ccc2C#N)CC1	ZINC001037189779	1344029111	/nfs/dbraw/zinc/02/91/11/1344029111.db2.gz	FAICPIJEDGXJNN-CRAIPNDOSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCCC[C@@H]2CNCc2cc(C)no2)CC1	ZINC001037228244	1344056953	/nfs/dbraw/zinc/05/69/53/1344056953.db2.gz	ARQQNQRVOOXHOR-MJGOQNOKSA-N	0	3	345.487	3.494	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCCC[C@H]2CNCc2cc(C)no2)CC1	ZINC001037228235	1344057011	/nfs/dbraw/zinc/05/70/11/1344057011.db2.gz	ARQQNQRVOOXHOR-HKUYNNGSSA-N	0	3	345.487	3.494	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCC[C@@H]2CNCc2cscn2)C1	ZINC001037239414	1344062030	/nfs/dbraw/zinc/06/20/30/1344062030.db2.gz	GJRKATXXLWEZGY-GDBMZVCRSA-N	0	3	333.501	3.264	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@@H]1CCN1CC1CC2(CCC2)C1	ZINC001038346636	1344389641	/nfs/dbraw/zinc/38/96/41/1344389641.db2.gz	YOOFONKWSVRZRS-KRWDZBQOSA-N	0	3	327.472	3.059	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C(C)(C)CC)CC[C@H]1c1ccc(F)cc1	ZINC001079156936	1357198048	/nfs/dbraw/zinc/19/80/48/1357198048.db2.gz	PFLLFQAIONAOMB-ZWKOTPCHSA-N	0	3	330.447	3.169	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1ccccc1OCC1CC1	ZINC001039041484	1344729364	/nfs/dbraw/zinc/72/93/64/1344729364.db2.gz	DRTPAVNAFHNDKY-KRWDZBQOSA-N	0	3	328.456	3.246	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)c3ccc(C)nc3)CC2)C1	ZINC001039110889	1344782317	/nfs/dbraw/zinc/78/23/17/1344782317.db2.gz	XPOSBJZVEGWKMS-GOSISDBHSA-N	0	3	347.890	3.317	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)c3cscn3)CC2)C1	ZINC001039121875	1344796606	/nfs/dbraw/zinc/79/66/06/1344796606.db2.gz	LVNJWONFQAVOQB-CQSZACIVSA-N	0	3	339.892	3.070	20	30		EGEDHN
CCC(=O)N1CCCC[C@@H]1[C@@H]1CCN(Cc2ccc(C#N)c(F)c2)C1	ZINC001039179442	1344875676	/nfs/dbraw/zinc/87/56/76/1344875676.db2.gz	FVMWEQHMILDBEN-IEBWSBKVSA-N	0	3	343.446	3.310	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(Cl)ccc2F)C1	ZINC001039213869	1344928833	/nfs/dbraw/zinc/92/88/33/1344928833.db2.gz	BQLOVNHBBHTATD-KDOFPFPSSA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccc(C)c(F)c2)C1	ZINC001039216497	1344932956	/nfs/dbraw/zinc/93/29/56/1344932956.db2.gz	PQFYUIAQWYNHRP-AZUAARDMSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2nccc3ccccc32)C1	ZINC001039224245	1344942031	/nfs/dbraw/zinc/94/20/31/1344942031.db2.gz	DQIZWNQFBJNPBA-QUCCMNQESA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(F)c(C)c2)C1	ZINC001039226524	1344945207	/nfs/dbraw/zinc/94/52/07/1344945207.db2.gz	XWXCSXKTMWFBLX-ICSRJNTNSA-N	0	3	342.458	3.474	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccn(CC)c2C)C1	ZINC001039226676	1344945794	/nfs/dbraw/zinc/94/57/94/1344945794.db2.gz	YUXUAPTXBZGEIN-ICSRJNTNSA-N	0	3	341.499	3.156	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc3occc3s2)C1	ZINC001039228729	1344948617	/nfs/dbraw/zinc/94/86/17/1344948617.db2.gz	HMQRSVQZHFYHGU-CABCVRRESA-N	0	3	342.464	3.444	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(C)cc(F)c2)C1	ZINC001039228687	1344948695	/nfs/dbraw/zinc/94/86/95/1344948695.db2.gz	HDQHLURCZLGANC-XLIONFOSSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccsc2Cl)C1	ZINC001039232221	1344951980	/nfs/dbraw/zinc/95/19/80/1344951980.db2.gz	UKLFMKYBKHGOKS-ZFWWWQNUSA-N	0	3	336.888	3.351	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cnc(CC)s2)C1	ZINC001039241597	1344966909	/nfs/dbraw/zinc/96/69/09/1344966909.db2.gz	DMEUGNMBKIWKFT-JKSUJKDBSA-N	0	3	345.512	3.045	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc[nH]c2C(C)C)C1	ZINC001039242139	1344967731	/nfs/dbraw/zinc/96/77/31/1344967731.db2.gz	ANCDADNFMCGGDJ-FUHWJXTLSA-N	0	3	327.472	3.088	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc[nH]c2C2CC2)C1	ZINC001039242792	1344969475	/nfs/dbraw/zinc/96/94/75/1344969475.db2.gz	FFNWZHQABJYNQH-PKOBYXMFSA-N	0	3	339.483	3.232	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc(CC(C)C)c[nH]2)C1	ZINC001039247827	1344977696	/nfs/dbraw/zinc/97/76/96/1344977696.db2.gz	XYWXBFLYQWZAQR-AZUAARDMSA-N	0	3	341.499	3.163	20	30		EGEDHN
Cc1cc(CN2CC[C@H]3CC[C@@H](C2)N3C(=O)[C@H](C)C#N)c(C)s1	ZINC001039343269	1345021549	/nfs/dbraw/zinc/02/15/49/1345021549.db2.gz	NMQWYBLUOXEOIV-JLZZUVOBSA-N	0	3	331.485	3.090	20	30		EGEDHN
Cc1ccc(CN2CC[C@H]3CC[C@@H](C2)N3C(=O)c2c[nH]c(C#N)c2)cc1	ZINC001039358377	1345027540	/nfs/dbraw/zinc/02/75/40/1345027540.db2.gz	KZPDTHKPJNXLRC-UXHICEINSA-N	0	3	348.450	3.074	20	30		EGEDHN
Cc1ccc(CN2CC[C@H]3CC[C@@H](C2)N3C(=O)C#CC2CC2)cc1C	ZINC001039373296	1345032082	/nfs/dbraw/zinc/03/20/82/1345032082.db2.gz	NHIDXLWJTWBTRP-RTWAWAEBSA-N	0	3	336.479	3.282	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@H]1CCC(C)(C)CO1	ZINC001039408294	1345052728	/nfs/dbraw/zinc/05/27/28/1345052728.db2.gz	JDAOPKPXWXLMAW-FGTMMUONSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccccc1OCC	ZINC001039465504	1345083073	/nfs/dbraw/zinc/08/30/73/1345083073.db2.gz	JUTZZZQLJPFNDK-SJORKVTESA-N	0	3	328.456	3.340	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)CCc1nc2ccccc2o1	ZINC001039469755	1345086761	/nfs/dbraw/zinc/08/67/61/1345086761.db2.gz	NIWAEABXZSKZLD-CVEARBPZSA-N	0	3	339.439	3.012	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc2ccccc2n1CC	ZINC001039474136	1345088991	/nfs/dbraw/zinc/08/89/91/1345088991.db2.gz	SANOZKIRQUKERZ-MOPGFXCFSA-N	0	3	349.478	3.363	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)c1cccc(OC)c1	ZINC001039475022	1345089371	/nfs/dbraw/zinc/08/93/71/1345089371.db2.gz	ZMAXYMDSPGHUIY-QRQLOZEOSA-N	0	3	342.483	3.440	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C(C)(C)c1ccccc1C	ZINC001039478851	1345093091	/nfs/dbraw/zinc/09/30/91/1345093091.db2.gz	SZSDUGRESBFJIS-MOPGFXCFSA-N	0	3	338.495	3.361	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CCC[C@@H](C1)N2C[C@H](OC)C1CCCC1	ZINC001039821550	1345199475	/nfs/dbraw/zinc/19/94/75/1345199475.db2.gz	TXJUDVWQBVZLFP-OTWHNJEPSA-N	0	3	348.531	3.469	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC[C@@H]1CCCO1	ZINC001039822050	1345199741	/nfs/dbraw/zinc/19/97/41/1345199741.db2.gz	ATPDFKQQVCTFLO-KSZLIROESA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CCC[C@@H](C1)N2C[C@H]1CCO[C@H](C)C1	ZINC001039823400	1345200224	/nfs/dbraw/zinc/20/02/24/1345200224.db2.gz	RKVJVXYJXRTUMM-HCXYKTFWSA-N	0	3	348.531	3.469	20	30		EGEDHN
C#Cc1ccc(C(=O)N2C[C@H]3CCC[C@@H](C2)N3CCC(C)(C)C)cn1	ZINC001039979377	1345277365	/nfs/dbraw/zinc/27/73/65/1345277365.db2.gz	SJHICVTUDXVVRT-KDURUIRLSA-N	0	3	339.483	3.178	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@@]2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001040049568	1345311242	/nfs/dbraw/zinc/31/12/42/1345311242.db2.gz	HDHIYLVEYLRRTC-NRFANRHFSA-N	0	3	337.467	3.339	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)CC3(c4ccccc4)CC3)C2)C1	ZINC001040230891	1345386023	/nfs/dbraw/zinc/38/60/23/1345386023.db2.gz	HHSFLFNRKPAREY-NRFANRHFSA-N	0	3	336.479	3.056	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1CC[C@@]2(C1)CCCN(CC=C)C2	ZINC001040265869	1345403197	/nfs/dbraw/zinc/40/31/97/1345403197.db2.gz	GRQSYCCUWCPNOW-NRFANRHFSA-N	0	3	340.467	3.366	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cc(Cl)ccc3F)C2)C1	ZINC001040284282	1345412351	/nfs/dbraw/zinc/41/23/51/1345412351.db2.gz	UGUSVBYOJGKJFG-LJQANCHMSA-N	0	3	348.849	3.431	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@@H](c3ccccc3)C3CC3)C2)C1	ZINC001040289091	1345413878	/nfs/dbraw/zinc/41/38/78/1345413878.db2.gz	CCNZHOBQEIJLEB-UNMCSNQZSA-N	0	3	336.479	3.128	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)CCc3cccc(C)c3)C2)C1	ZINC001040314163	1345426281	/nfs/dbraw/zinc/42/62/81/1345426281.db2.gz	AFKYQDORCLXPMK-QFIPXVFZSA-N	0	3	338.495	3.265	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)CCc3cccc(Cl)c3)C2)C1	ZINC001040315636	1345427136	/nfs/dbraw/zinc/42/71/36/1345427136.db2.gz	CFIGDOYAOGRTDN-HXUWFJFHSA-N	0	3	344.886	3.220	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(F)c(C)c3)C2)C1	ZINC001040359533	1345453182	/nfs/dbraw/zinc/45/31/82/1345453182.db2.gz	FPRNARFQJOFIMS-HXUWFJFHSA-N	0	3	328.431	3.086	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3ccc(F)c(F)c3F)C2)C1	ZINC001040362066	1345455181	/nfs/dbraw/zinc/45/51/81/1345455181.db2.gz	ZJKWLDLRSOXVOU-SFHVURJKSA-N	0	3	338.373	3.218	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3ccc(Cl)c(C)c3)C2)C1	ZINC001040371940	1345460424	/nfs/dbraw/zinc/46/04/24/1345460424.db2.gz	MINKJCBHHYDXQM-IBGZPJMESA-N	0	3	330.859	3.210	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cc(C)cc(F)c3)C2)C1	ZINC001040416503	1345485352	/nfs/dbraw/zinc/48/53/52/1345485352.db2.gz	WMOMZJDJBSFUPY-HXUWFJFHSA-N	0	3	328.431	3.086	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cccc(F)c3Cl)C2)C1	ZINC001040417126	1345485959	/nfs/dbraw/zinc/48/59/59/1345485959.db2.gz	BKRWAWKQZTVEAM-LJQANCHMSA-N	0	3	348.849	3.431	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)C[C@H](C)c3ccccc3C)C2)C1	ZINC001040433802	1345497194	/nfs/dbraw/zinc/49/71/94/1345497194.db2.gz	ZIMNYQQUJBXTOT-SIKLNZKXSA-N	0	3	338.495	3.436	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cccc4c3ccn4C)C2)C1	ZINC001040452270	1345507196	/nfs/dbraw/zinc/50/71/96/1345507196.db2.gz	HLYSFXYTBNKWMV-JOCHJYFZSA-N	0	3	349.478	3.130	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3ccc4ccccc4c3)C2)C1	ZINC001040506812	1345524546	/nfs/dbraw/zinc/52/45/46/1345524546.db2.gz	OISMZFBQFSVRGS-QFIPXVFZSA-N	0	3	332.447	3.401	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)C3CCC(C4CC4)CC3)C2)C1	ZINC001040514577	1345528039	/nfs/dbraw/zinc/52/80/39/1345528039.db2.gz	VPSPYAJITAXVIX-GZNCHQMQSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cc4c(s3)CCC4)C2)C1	ZINC001040519531	1345530308	/nfs/dbraw/zinc/53/03/08/1345530308.db2.gz	MBNCMNKXTLCMKD-FQEVSTJZSA-N	0	3	342.508	3.188	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cc(C4CCCC4)no3)C2)C1	ZINC001040530455	1345534671	/nfs/dbraw/zinc/53/46/71/1345534671.db2.gz	ZFEQVOGUAVBXEB-FQEVSTJZSA-N	0	3	343.471	3.446	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@H]3CC4CCC3CC4)C2)C1	ZINC001040545899	1345539779	/nfs/dbraw/zinc/53/97/79/1345539779.db2.gz	XTNMJQIYIBSPJX-KWOGNLBTSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)CCc3ccc(C)s3)C2)C1	ZINC001040551943	1345543772	/nfs/dbraw/zinc/54/37/72/1345543772.db2.gz	SUMYNRIJQVKSAW-HXUWFJFHSA-N	0	3	344.524	3.327	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3csc(C4CC4)n3)C2)C1	ZINC001040552262	1345543959	/nfs/dbraw/zinc/54/39/59/1345543959.db2.gz	ZQZOSDZILJADNP-SFHVURJKSA-N	0	3	331.485	3.135	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3c(C)cccc3F)C2)C1	ZINC001040552224	1345543966	/nfs/dbraw/zinc/54/39/66/1345543966.db2.gz	YNHCZHAYMOJLCV-HXUWFJFHSA-N	0	3	328.431	3.086	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccc(C(C)C)nc3)C2)CC1	ZINC001040727505	1345571313	/nfs/dbraw/zinc/57/13/13/1345571313.db2.gz	SEGRLRFYSKQUGL-UHFFFAOYSA-N	0	3	339.483	3.156	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cc(C)ccc3C3CC3)C2)CC1	ZINC001040789217	1345578158	/nfs/dbraw/zinc/57/81/58/1345578158.db2.gz	FAIQIJIDAOGTFM-UHFFFAOYSA-N	0	3	336.479	3.434	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC2(C1)CCN(Cc1cnoc1C)CC2	ZINC001040829337	1345583825	/nfs/dbraw/zinc/58/38/25/1345583825.db2.gz	BKAZHJPMCYFRDG-IBGZPJMESA-N	0	3	345.487	3.400	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)C(C)(C)c3cccc(F)c3)C2)CC1	ZINC001040846977	1345587790	/nfs/dbraw/zinc/58/77/90/1345587790.db2.gz	ZDAQKUSBFQJGAA-UHFFFAOYSA-N	0	3	342.458	3.051	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@H]3[C@@H]4CCCCCC[C@@H]43)C2)CC1	ZINC001040864816	1345589630	/nfs/dbraw/zinc/58/96/30/1345589630.db2.gz	KIBJOINKWGNMBU-BWTSREIZSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)C[C@H](C)c3ccccc3F)C2)CC1	ZINC001040883113	1345594073	/nfs/dbraw/zinc/59/40/73/1345594073.db2.gz	WUZQZSMQRCUCTL-KRWDZBQOSA-N	0	3	342.458	3.267	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)C(C)(C)C(C)(F)F)C2)CC1	ZINC001040925109	1345602090	/nfs/dbraw/zinc/60/20/90/1345602090.db2.gz	QXHUOLVQYXJTFT-UHFFFAOYSA-N	0	3	326.431	3.006	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@@H](C)Cc3ccccc3C)C2)CC1	ZINC001040951760	1345608166	/nfs/dbraw/zinc/60/81/66/1345608166.db2.gz	JCOJILMKGHTWHK-IBGZPJMESA-N	0	3	338.495	3.121	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@]3(CCN(C(=O)C=C4CCC4)C3)C2)c1	ZINC001041198914	1345675732	/nfs/dbraw/zinc/67/57/32/1345675732.db2.gz	BEWZYSSCLOXGFF-OAQYLSRUSA-N	0	3	335.451	3.093	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@]2(CCN(C/C=C/c3ccccc3)C2)C1	ZINC001041273561	1345691923	/nfs/dbraw/zinc/69/19/23/1345691923.db2.gz	OBEFSJODVOTRRI-SNXGKTBFSA-N	0	3	334.463	3.038	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)[C@H](CC)OC3CCCCC3)C2)C1	ZINC001041282293	1345693553	/nfs/dbraw/zinc/69/35/53/1345693553.db2.gz	JBYSWQWTJQXVNS-FPOVZHCZSA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3cc(C4CC4)oc3C3CC3)C2)C1	ZINC001041492888	1345743644	/nfs/dbraw/zinc/74/36/44/1345743644.db2.gz	SNTRIJLPKYZGRC-NRFANRHFSA-N	0	3	338.451	3.206	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)C3CC(C)(C)CC(C)(C)C3)C2)C1	ZINC001041507926	1345747264	/nfs/dbraw/zinc/74/72/64/1345747264.db2.gz	KJWPDBYVSMBYCF-OAQYLSRUSA-N	0	3	330.516	3.397	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@]2(CCN(Cc3ncccc3C)C2)C1	ZINC001041536763	1345755198	/nfs/dbraw/zinc/75/51/98/1345755198.db2.gz	QOSCSDUBVTXURV-OAQYLSRUSA-N	0	3	341.499	3.417	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@]2(CCN(Cc3cnc(C)s3)C2)C1	ZINC001041541656	1345757505	/nfs/dbraw/zinc/75/75/05/1345757505.db2.gz	YSEXBGHUQFUSKL-GOSISDBHSA-N	0	3	333.501	3.088	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccc(F)c(Cl)c3)C2)C1	ZINC001041609027	1345791680	/nfs/dbraw/zinc/79/16/80/1345791680.db2.gz	BGGDFUOQCZTVQO-GOSISDBHSA-N	0	3	334.822	3.040	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@]3(CCN(C(=O)[C@@H]4CC45CCC5)C3)C2)cc1	ZINC001041713127	1345828438	/nfs/dbraw/zinc/82/84/38/1345828438.db2.gz	CWYXPYLDNPGTHL-PZJWPPBQSA-N	0	3	349.478	3.173	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)[C@@H](F)CC3CCCCC3)C2)C1	ZINC001041788409	1345850306	/nfs/dbraw/zinc/85/03/06/1345850306.db2.gz	DCYFHATUUUUJTN-ICSRJNTNSA-N	0	3	334.479	3.243	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cc4ccccc4n3CC)C2)C1	ZINC001041842535	1345870109	/nfs/dbraw/zinc/87/01/09/1345870109.db2.gz	IBIWQSVNBAEYFK-JOCHJYFZSA-N	0	3	349.478	3.223	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@@H]2C1	ZINC001041902568	1345888812	/nfs/dbraw/zinc/88/88/12/1345888812.db2.gz	AXWHPRKFBAVPLZ-RBUKOAKNSA-N	0	3	325.456	3.027	20	30		EGEDHN
CC(C(=O)N1CC[C@H]2CCN(Cc3ccc(C#N)cc3)[C@H]2C1)=C1CCC1	ZINC001042054757	1345932146	/nfs/dbraw/zinc/93/21/46/1345932146.db2.gz	LXQOVRRBUONLOE-RTWAWAEBSA-N	0	3	349.478	3.481	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccn(C4CCCCC4)n3)C[C@H]21	ZINC001042063423	1345933564	/nfs/dbraw/zinc/93/35/64/1345933564.db2.gz	WMMMGLATTDCRCR-VQIMIIECSA-N	0	3	342.487	3.111	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(F)cc4ccncc43)C[C@@H]21	ZINC001042065187	1345933702	/nfs/dbraw/zinc/93/37/02/1345933702.db2.gz	PWLFABCHFDIVBB-LIRRHRJNSA-N	0	3	339.414	3.096	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3nsc4ccccc43)C[C@H]21	ZINC001042078748	1345939183	/nfs/dbraw/zinc/93/91/83/1345939183.db2.gz	YDGBFLUOVUOTQU-DZGCQCFKSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cccc(-n4cccc4)c3)C[C@H]21	ZINC001042139592	1345954239	/nfs/dbraw/zinc/95/42/39/1345954239.db2.gz	YACBFQDFBJCSKW-FXAWDEMLSA-N	0	3	335.451	3.200	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)COc3ccc(C(C)C)cc3)C[C@H]21	ZINC001042139575	1345954254	/nfs/dbraw/zinc/95/42/54/1345954254.db2.gz	XUIYAEHOGLRVTO-UYAOXDASSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3coc4ccc(OC)cc43)C[C@H]21	ZINC001042147931	1345956989	/nfs/dbraw/zinc/95/69/89/1345956989.db2.gz	HTIVQBBUBPXZEM-RDTXWAMCSA-N	0	3	340.423	3.164	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)Cc3ccc(C(F)F)cc3)C[C@@H]21	ZINC001042148350	1345957048	/nfs/dbraw/zinc/95/70/48/1345957048.db2.gz	IZYVGUNSULNWMO-AEFFLSMTSA-N	0	3	346.421	3.113	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)CCc3cccc(Cl)c3)C[C@H]21	ZINC001042168276	1345964092	/nfs/dbraw/zinc/96/40/92/1345964092.db2.gz	UOAPFGCVKKEXKQ-IEBWSBKVSA-N	0	3	344.886	3.219	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3cc(-c4ccco4)on3)C[C@H]21	ZINC001042171612	1345965737	/nfs/dbraw/zinc/96/57/37/1345965737.db2.gz	XLJPCUOUOSUXOI-GDBMZVCRSA-N	0	3	341.411	3.047	20	30		EGEDHN
CC1(C(=O)N2CC[C@H]3CCN(Cc4ccc(C#N)cc4)[C@@H]3C2)CCC1	ZINC001042187187	1345974372	/nfs/dbraw/zinc/97/43/72/1345974372.db2.gz	MFTZFUHRVGLHOM-RTBURBONSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3ncccc3C)[C@@H]2C1	ZINC001042188575	1345975071	/nfs/dbraw/zinc/97/50/71/1345975071.db2.gz	UPSOHXOBZNFFFQ-FUHWJXTLSA-N	0	3	327.472	3.025	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cc4c(ccc(C)c4C)[nH]3)C[C@H]21	ZINC001042188719	1345975665	/nfs/dbraw/zinc/97/56/65/1345975665.db2.gz	WKTIMIDXHSKAOF-DYESRHJHSA-N	0	3	349.478	3.344	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc4cccc(OC)c4o3)C[C@@H]21	ZINC001042202185	1345981719	/nfs/dbraw/zinc/98/17/19/1345981719.db2.gz	XGKCOUJQMXSQSD-ZBFHGGJFSA-N	0	3	340.423	3.164	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3c(Cl)cncc3Cl)C[C@@H]21	ZINC001042215950	1345989085	/nfs/dbraw/zinc/98/90/85/1345989085.db2.gz	JUWYFADQEDFEGU-FZMZJTMJSA-N	0	3	340.254	3.111	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3cc(C(CC)CC)no3)C[C@@H]21	ZINC001042263004	1346010578	/nfs/dbraw/zinc/01/05/78/1346010578.db2.gz	RIKSPTBXZBAPSN-AEFFLSMTSA-N	0	3	343.471	3.138	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3oc(C(C)C)nc3C)C[C@@H]21	ZINC001042262689	1346010706	/nfs/dbraw/zinc/01/07/06/1346010706.db2.gz	OLTOIAXQARVJOM-HOTGVXAUSA-N	0	3	331.460	3.219	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3scnc3C(C)C)C[C@H]21	ZINC001042263943	1346010958	/nfs/dbraw/zinc/01/09/58/1346010958.db2.gz	ZRIVRBGLTXUGSE-HUUCEWRRSA-N	0	3	333.501	3.379	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3csc(-c4ccoc4)n3)C[C@@H]21	ZINC001042271990	1346014326	/nfs/dbraw/zinc/01/43/26/1346014326.db2.gz	JSOFXAFXDANENQ-BBRMVZONSA-N	0	3	343.452	3.126	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cnn(C4CCCCC4)c3)C[C@H]21	ZINC001042305073	1346025671	/nfs/dbraw/zinc/02/56/71/1346025671.db2.gz	WOXHFOXWINJVEX-VQIMIIECSA-N	0	3	342.487	3.111	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2cc(F)ccc2C#N)CCN1C(=O)C1CCCC1	ZINC001044414800	1346321664	/nfs/dbraw/zinc/32/16/64/1346321664.db2.gz	WKXOILMQYTZGJZ-KUHUBIRLSA-N	0	3	343.446	3.357	20	30		EGEDHN
Cc1cncc(C(=O)N2CC[C@@H](NCc3ccccc3C#N)C[C@@H]2C)c1	ZINC001044522773	1346355549	/nfs/dbraw/zinc/35/55/49/1346355549.db2.gz	KRQUNTPHIUNISJ-OXJNMPFZSA-N	0	3	348.450	3.045	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)[C@@H]2CC=CCC2)cc1F	ZINC001044919517	1346462787	/nfs/dbraw/zinc/46/27/87/1346462787.db2.gz	OUPCEVABXQHAFG-AEFFLSMTSA-N	0	3	341.430	3.134	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)C[C@@H]2C=CCCC2)s1	ZINC001045088789	1346492703	/nfs/dbraw/zinc/49/27/03/1346492703.db2.gz	SVCWKCJZWNAUPF-CVEARBPZSA-N	0	3	343.496	3.447	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC[C@H]2CNCc2ccccc2F)cc1	ZINC001045145599	1346505559	/nfs/dbraw/zinc/50/55/59/1346505559.db2.gz	QRTQZUGQMLTSKI-IBGZPJMESA-N	0	3	336.410	3.201	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]1CNCc1cc(F)ccc1OC	ZINC001045147825	1346506109	/nfs/dbraw/zinc/50/61/09/1346506109.db2.gz	MYDGHVNZJXKZPC-INIZCTEOSA-N	0	3	334.435	3.127	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H]1CNCc1c(C)onc1CC	ZINC001045182227	1346517676	/nfs/dbraw/zinc/51/76/76/1346517676.db2.gz	PEIUAHHIPBGPCZ-HNAYVOBHSA-N	0	3	333.476	3.228	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045411276	1346587570	/nfs/dbraw/zinc/58/75/70/1346587570.db2.gz	XZWWPDFWCLCUOC-KRWDZBQOSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)C2CCc3ccccc3CC2)CC1	ZINC001045490517	1346607654	/nfs/dbraw/zinc/60/76/54/1346607654.db2.gz	QRKOORVCKJVONM-UHFFFAOYSA-N	0	3	326.484	3.338	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)[C@@H]2CC[C@@H]2c2ccc(F)cc2)CC1	ZINC001045511587	1346613637	/nfs/dbraw/zinc/61/36/37/1346613637.db2.gz	SZRJAMCKDZKXPW-QZTJIDSGSA-N	0	3	330.447	3.476	20	30		EGEDHN
C=C(Cl)CN1CCC(C)(NC(=O)c2cccc3nc(C)[nH]c32)CC1	ZINC001045612090	1346647218	/nfs/dbraw/zinc/64/72/18/1346647218.db2.gz	YATPMJKYNZIHKS-UHFFFAOYSA-N	0	3	346.862	3.208	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2cnn(C3CCCCC3)c2)CC1	ZINC001045616545	1346648880	/nfs/dbraw/zinc/64/88/80/1346648880.db2.gz	CFMVFMZBZQKHEQ-UHFFFAOYSA-N	0	3	330.476	3.159	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CC[C@@H](C1)N2CCOc1ccccc1	ZINC001045827299	1346710501	/nfs/dbraw/zinc/71/05/01/1346710501.db2.gz	JLOOIVLWCZPIQY-MSOLQXFVSA-N	0	3	342.483	3.343	20	30		EGEDHN
CC(F)(F)CC(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1ccc(C#N)cc1	ZINC001045842597	1346717958	/nfs/dbraw/zinc/71/79/58/1346717958.db2.gz	QEWPCLWEVPKZIS-SJORKVTESA-N	0	3	347.409	3.169	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@]3(C2)CCCCN(C(=O)C2CC2)C3)c1	ZINC001045906025	1346742114	/nfs/dbraw/zinc/74/21/14/1346742114.db2.gz	PCSZTXJXRNZQAW-OAQYLSRUSA-N	0	3	337.467	3.173	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)C1C(C)(C)C1(C)C)C2	ZINC001045926264	1346762290	/nfs/dbraw/zinc/76/22/90/1346762290.db2.gz	BGKHSXBYGHRDEV-NRFANRHFSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc(C)c(C)o1)C2	ZINC001045931150	1346768973	/nfs/dbraw/zinc/76/89/73/1346768973.db2.gz	GYAGGNDCAXULHV-FQEVSTJZSA-N	0	3	328.456	3.238	20	30		EGEDHN
O=C(C#CC1CC1)N1CCCC[C@@]2(CCN(Cc3ccsc3)C2)C1	ZINC001045937080	1346773888	/nfs/dbraw/zinc/77/38/88/1346773888.db2.gz	SXLSINVAGPCWKY-FQEVSTJZSA-N	0	3	342.508	3.366	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H]1CCCC13CC3)C2	ZINC001045946975	1346782638	/nfs/dbraw/zinc/78/26/38/1346782638.db2.gz	GIFAGMXVLUSTCX-ICSRJNTNSA-N	0	3	328.500	3.295	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc(C)c(F)c1)C2	ZINC001045951360	1346786848	/nfs/dbraw/zinc/78/68/48/1346786848.db2.gz	XWAJGLBBKOMPMD-OAQYLSRUSA-N	0	3	342.458	3.476	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H](C)Cc1cccs1)C2	ZINC001045968599	1346802848	/nfs/dbraw/zinc/80/28/48/1346802848.db2.gz	DHCYFEQIKRZWEZ-PXNSSMCTSA-N	0	3	344.524	3.265	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccsc1Cl)C2	ZINC001045970299	1346805785	/nfs/dbraw/zinc/80/57/85/1346805785.db2.gz	DFUMIGGAPVBTGO-KRWDZBQOSA-N	0	3	336.888	3.353	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc(F)ccc1Cl)C2	ZINC001045970780	1346806607	/nfs/dbraw/zinc/80/66/07/1346806607.db2.gz	LFVVJDITKAVOQR-LJQANCHMSA-N	0	3	348.849	3.431	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H](C)c1cc(C)oc1C)C2	ZINC001045974923	1346811210	/nfs/dbraw/zinc/81/12/10/1346811210.db2.gz	QEMFTOKDFZBBKB-UWJYYQICSA-N	0	3	342.483	3.338	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@H](C)c1ccccc1F)C2	ZINC001045974940	1346811410	/nfs/dbraw/zinc/81/14/10/1346811410.db2.gz	QPWNATXDOARULL-DYESRHJHSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc3ccncc3c1)C2	ZINC001045978116	1346814394	/nfs/dbraw/zinc/81/43/94/1346814394.db2.gz	RKFKUICWKZIHGA-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ncoc1C(C)C)C2	ZINC001045979515	1346816630	/nfs/dbraw/zinc/81/66/30/1346816630.db2.gz	UUGMYYTVCIPGJF-FQEVSTJZSA-N	0	3	343.471	3.140	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccccc1OC)C2	ZINC001045980591	1346817852	/nfs/dbraw/zinc/81/78/52/1346817852.db2.gz	CUXXEAHRYYOSIS-NRFANRHFSA-N	0	3	340.467	3.037	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)C(C)(C)C(C)(F)F)C2	ZINC001045981969	1346820881	/nfs/dbraw/zinc/82/08/81/1346820881.db2.gz	KTWPPHUCAZWRNR-GOSISDBHSA-N	0	3	326.431	3.006	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc(C)c(F)c(C)c1)C2	ZINC001045984411	1346825547	/nfs/dbraw/zinc/82/55/47/1346825547.db2.gz	ZNSHVFPFWPNSID-NRFANRHFSA-N	0	3	342.458	3.394	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1c(C)cccc1F)C2	ZINC001045987661	1346829429	/nfs/dbraw/zinc/82/94/29/1346829429.db2.gz	YGJOMKHMDOEPTK-FQEVSTJZSA-N	0	3	328.431	3.086	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2ccc3c(c2)C(C)(C)CO3)C1	ZINC001046477047	1346988733	/nfs/dbraw/zinc/98/87/33/1346988733.db2.gz	OAAZCDBTZYRWJF-FQEVSTJZSA-N	0	3	328.456	3.127	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@]2(C)CCN(Cc3ccc(CO)cc3)C2)CC1	ZINC001046594367	1347030764	/nfs/dbraw/zinc/03/07/64/1347030764.db2.gz	GZFHXYYLQGORIF-NRFANRHFSA-N	0	3	342.483	3.006	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2ccc(OC)c(C3CC3)c2)C1	ZINC001046738193	1347077670	/nfs/dbraw/zinc/07/76/70/1347077670.db2.gz	VUKRUOINAQSBAN-HXUWFJFHSA-N	0	3	328.456	3.343	20	30		EGEDHN
C#CCCN1CC[C@@](C)(NC(=O)c2ccc(O[C@H](C)CC)cc2)C1	ZINC001046754289	1347084657	/nfs/dbraw/zinc/08/46/57/1347084657.db2.gz	NPMAWYRRPUSSRA-OXQOHEQNSA-N	0	3	328.456	3.081	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@]2(C)CCN(Cc3cc(C)cc(C)c3)C2)nc1	ZINC001046781272	1347097806	/nfs/dbraw/zinc/09/78/06/1347097806.db2.gz	GOJQAMMDKIXOGY-JOCHJYFZSA-N	0	3	347.462	3.074	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2ccn(CC)c2C)C1	ZINC001046963208	1347167374	/nfs/dbraw/zinc/16/73/74/1347167374.db2.gz	FPMFJPZPCMSXGW-HNNXBMFYSA-N	0	3	339.430	3.080	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@@H](CNC(=O)C23CCC(CC2)CC3)C1	ZINC001046993303	1347176353	/nfs/dbraw/zinc/17/63/53/1347176353.db2.gz	CHISNEQAKHTPLN-PQUAAJSLSA-N	0	3	338.442	3.054	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2scnc2Cl)C1	ZINC001046993130	1347176510	/nfs/dbraw/zinc/17/65/10/1347176510.db2.gz	LHAJOXDUHMUCDN-JTQLQIEISA-N	0	3	349.834	3.060	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)[C@@H]3CC=CCC3)C2)CC1	ZINC001047220972	1347252907	/nfs/dbraw/zinc/25/29/07/1347252907.db2.gz	AANNUBATRJIKKM-UXHICEINSA-N	0	3	328.500	3.317	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)C3CC(C)(C)C3)C2)CC1	ZINC001047236149	1347263487	/nfs/dbraw/zinc/26/34/87/1347263487.db2.gz	GIZQKHVZUAHLCE-SFHVURJKSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)C3CC4(CCC4)C3)C2)CC1	ZINC001047251239	1347275965	/nfs/dbraw/zinc/27/59/65/1347275965.db2.gz	HJYCRRFWXVJBHW-GOSISDBHSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)c3cocc3C)C2)CC1	ZINC001047251164	1347275977	/nfs/dbraw/zinc/27/59/77/1347275977.db2.gz	GNFFYBTWTIEDIH-GOSISDBHSA-N	0	3	328.456	3.176	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3cc(C)ccc3F)C2)CC1	ZINC001047258584	1347281143	/nfs/dbraw/zinc/28/11/43/1347281143.db2.gz	COSMISZLNARCJF-GOSISDBHSA-N	0	3	342.458	3.332	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3ccoc3CCC)C2)CC1	ZINC001047263077	1347284141	/nfs/dbraw/zinc/28/41/41/1347284141.db2.gz	YNYWFMULFZHFSE-SFHVURJKSA-N	0	3	342.483	3.430	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)C[C@@H](C)c3ccco3)C2)CC1	ZINC001047263163	1347284580	/nfs/dbraw/zinc/28/45/80/1347284580.db2.gz	ATYLWGANSNEDNK-IEBWSBKVSA-N	0	3	342.483	3.357	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)CC2CCCC2)C1	ZINC001047695095	1347335913	/nfs/dbraw/zinc/33/59/13/1347335913.db2.gz	QCLFIYJUBSHHPZ-JXFKEZNVSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)C2(C3CC3)CC2)C1	ZINC001047878729	1347397056	/nfs/dbraw/zinc/39/70/56/1347397056.db2.gz	CXTAHMYOXGQAKQ-QAPCUYQASA-N	0	3	337.467	3.075	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)C(C)(C)C2CC2)C1	ZINC001047942407	1347419137	/nfs/dbraw/zinc/41/91/37/1347419137.db2.gz	XKMYTKQQMGHQPN-MAUKXSAKSA-N	0	3	339.483	3.321	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)C2(C)CC=CC2)C1	ZINC001047962259	1347425858	/nfs/dbraw/zinc/42/58/58/1347425858.db2.gz	JZEWWSYNZQFMFZ-APWZRJJASA-N	0	3	337.467	3.241	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)C(C)(C)C(F)F)C1	ZINC001047966685	1347427133	/nfs/dbraw/zinc/42/71/33/1347427133.db2.gz	SRUIPVFJBQFMRX-BBRMVZONSA-N	0	3	349.425	3.176	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]([C@@H](C)NCc3csc(C)n3)C2)C1	ZINC001047967855	1347428083	/nfs/dbraw/zinc/42/80/83/1347428083.db2.gz	YTLJNOXEHNNPLN-HIFRSBDPSA-N	0	3	333.501	3.134	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@@H]2[C@@H](c3ccccc3)C2(C)C)C1	ZINC001079711578	1357354578	/nfs/dbraw/zinc/35/45/78/1357354578.db2.gz	FACGYPBUYJJCTB-OWYHZJEWSA-N	0	3	326.484	3.439	20	30		EGEDHN
C[C@H]1CN(C(=O)CC2CCCC2)C[C@H]1CNCc1ccccc1C#N	ZINC001048122008	1347474224	/nfs/dbraw/zinc/47/42/24/1347474224.db2.gz	KCGGFIZMVMHWFN-OXJNMPFZSA-N	0	3	339.483	3.323	20	30		EGEDHN
C[C@H]1CN(C(=O)CCC2CCC2)C[C@H]1CNCc1ccccc1C#N	ZINC001048199488	1347491804	/nfs/dbraw/zinc/49/18/04/1347491804.db2.gz	YHHAXMHMANSVLD-OXJNMPFZSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](CNCc2csc(CC)n2)[C@H](C)C1	ZINC001048340360	1347523035	/nfs/dbraw/zinc/52/30/35/1347523035.db2.gz	RGRSIUVVGVZTLZ-ZIAGYGMSSA-N	0	3	335.517	3.102	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H](C)[C@H](CNCc2csc(C3CC3)n2)C1	ZINC001048341879	1347524155	/nfs/dbraw/zinc/52/41/55/1347524155.db2.gz	FPPIEBOTHNRRQE-DZGCQCFKSA-N	0	3	347.528	3.417	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2(C)CCC2)C[C@H]1CNCc1cc(F)ccc1C#N	ZINC001048345768	1347525407	/nfs/dbraw/zinc/52/54/07/1347525407.db2.gz	WSVIYGQYGWUZBI-RHSMWYFYSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)[C@@H]2CC[C@H](F)C2)CC1	ZINC001048626679	1347624346	/nfs/dbraw/zinc/62/43/46/1347624346.db2.gz	SVEFYOUUPYMCNH-SJORKVTESA-N	0	3	345.462	3.199	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)[C@@H]2C[C@H]2C(C)C)CC1	ZINC001048628731	1347624646	/nfs/dbraw/zinc/62/46/46/1347624646.db2.gz	GQCZSORMBYLARE-VQTJNVASSA-N	0	3	341.499	3.353	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CN(Cc3cc(C)ccc3F)C[C@H]2C1	ZINC001048979669	1347696625	/nfs/dbraw/zinc/69/66/25/1347696625.db2.gz	APAOAFUVOXUXIN-CALCHBBNSA-N	0	3	330.447	3.237	20	30		EGEDHN
C=C[C@@H](C(=O)N1C[C@H]2CN(C[C@@H](F)CC)C[C@H]2C1)c1ccccc1	ZINC001049229828	1347751666	/nfs/dbraw/zinc/75/16/66/1347751666.db2.gz	RAFLZYITFMLTTA-ZSYWTGECSA-N	0	3	330.447	3.095	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049344856	1347799055	/nfs/dbraw/zinc/79/90/55/1347799055.db2.gz	RDAMEYWQOHYKAP-KFKAGJAMSA-N	0	3	325.456	3.170	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cccc2scnc21	ZINC001049468260	1347863927	/nfs/dbraw/zinc/86/39/27/1347863927.db2.gz	GXPVSCLIXWMDGL-CABCVRRESA-N	0	3	327.453	3.161	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1csc([C@@H](C)OC)n1	ZINC001049472289	1347865147	/nfs/dbraw/zinc/86/51/47/1347865147.db2.gz	AVZDDNRCIMHKKB-VNQPRFMTSA-N	0	3	349.500	3.106	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1oc(CC2CC2)nc1C	ZINC001049470945	1347865253	/nfs/dbraw/zinc/86/52/53/1347865253.db2.gz	URYUBEZYAVQWJS-SJORKVTESA-N	0	3	343.471	3.191	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1sc(C2CC2)nc1C	ZINC001049475117	1347866612	/nfs/dbraw/zinc/86/66/12/1347866612.db2.gz	NFBPCZHSSFOVFL-HOTGVXAUSA-N	0	3	343.496	3.031	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1sccc1C	ZINC001049475330	1347866899	/nfs/dbraw/zinc/86/68/99/1347866899.db2.gz	SZTQXDVFOFXTMV-BRSBDYLESA-N	0	3	342.508	3.249	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)COc1cccc(C(C)C)c1	ZINC001049490151	1347874065	/nfs/dbraw/zinc/87/40/65/1347874065.db2.gz	KIGUXWZVTWHMBO-UXHICEINSA-N	0	3	342.483	3.440	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1scc(C)c1Cl	ZINC001049495181	1347876748	/nfs/dbraw/zinc/87/67/48/1347876748.db2.gz	OGQDRMCDBNJRCT-UONOGXRCSA-N	0	3	336.888	3.412	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccsc1COC	ZINC001049552934	1347905950	/nfs/dbraw/zinc/90/59/50/1347905950.db2.gz	RDFRFRIHCRVLEN-JKSUJKDBSA-N	0	3	334.485	3.150	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1c(C)cccc1Cl	ZINC001049568697	1347914964	/nfs/dbraw/zinc/91/49/64/1347914964.db2.gz	WFLDRGFLJVMIQE-MOPGFXCFSA-N	0	3	344.886	3.280	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(-c2ccccc2)no1	ZINC001049576682	1347917783	/nfs/dbraw/zinc/91/77/83/1347917783.db2.gz	VRNLPZJDCLXLEF-OALUTQOASA-N	0	3	349.434	3.044	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc2c(cn1)CCCC2	ZINC001049581721	1347921036	/nfs/dbraw/zinc/92/10/36/1347921036.db2.gz	HUBYXVAKWDYBBU-UXHICEINSA-N	0	3	339.483	3.215	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1c(C)[nH]c2ccccc21	ZINC001049582827	1347921655	/nfs/dbraw/zinc/92/16/55/1347921655.db2.gz	QHMQMPRCWOLSLD-RTBURBONSA-N	0	3	335.451	3.179	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc2cc(C)ccc2n1	ZINC001049586958	1347923992	/nfs/dbraw/zinc/92/39/92/1347923992.db2.gz	ZLRMVZLUIVOFHO-PMACEKPBSA-N	0	3	335.451	3.408	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1ccc(C2CCC2)cc1	ZINC001049622424	1347939893	/nfs/dbraw/zinc/93/98/93/1347939893.db2.gz	UTIZKAUCXTUFOH-NHCUHLMSSA-N	0	3	336.479	3.195	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1ccc(OC)cc1	ZINC001049636506	1347946945	/nfs/dbraw/zinc/94/69/45/1347946945.db2.gz	SFMZYJKUBKZVML-MOPGFXCFSA-N	0	3	342.483	3.473	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]2[C@H]1CCN2CCOc1ccccc1	ZINC001049639167	1347948814	/nfs/dbraw/zinc/94/88/14/1347948814.db2.gz	NXBVZERTGBNHAZ-RBUKOAKNSA-N	0	3	342.483	3.343	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049649105	1347955064	/nfs/dbraw/zinc/95/50/64/1347955064.db2.gz	ZECKDJAGKNLLCG-MOPGFXCFSA-N	0	3	337.467	3.336	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(F)c2ccncc12	ZINC001049661795	1347961496	/nfs/dbraw/zinc/96/14/96/1347961496.db2.gz	ZVDRBCRCJWBMCN-RBUKOAKNSA-N	0	3	339.414	3.239	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(F)c(Cl)cc1F	ZINC001049678585	1347968919	/nfs/dbraw/zinc/96/89/19/1347968919.db2.gz	CAVZZMUVNZYZFZ-HOTGVXAUSA-N	0	3	340.801	3.483	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(F)c(Cl)c1F	ZINC001049690062	1347972917	/nfs/dbraw/zinc/97/29/17/1347972917.db2.gz	NNUGEYYBELFTHF-UONOGXRCSA-N	0	3	340.801	3.483	20	30		EGEDHN
CC1(C(=O)N2CCC[C@@H]3[C@@H]2CCN3Cc2cccc(C#N)c2)CC=CC1	ZINC001049690300	1347974064	/nfs/dbraw/zinc/97/40/64/1347974064.db2.gz	OVVHPQHKOSDUOS-UXHICEINSA-N	0	3	349.478	3.480	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1cccc(Cl)c1F	ZINC001049747193	1347998361	/nfs/dbraw/zinc/99/83/61/1347998361.db2.gz	IEKJWROSMCMYKK-SJORKVTESA-N	0	3	348.849	3.110	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1cccc(Cl)c1F	ZINC001049747189	1347998513	/nfs/dbraw/zinc/99/85/13/1347998513.db2.gz	IEKJWROSMCMYKK-DLBZAZTESA-N	0	3	348.849	3.110	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1oc(C(C)C)nc1C	ZINC001049774554	1348014964	/nfs/dbraw/zinc/01/49/64/1348014964.db2.gz	XIPJNXMWIFRLSM-HOTGVXAUSA-N	0	3	331.460	3.361	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccc(C)s1	ZINC001049779023	1348018041	/nfs/dbraw/zinc/01/80/41/1348018041.db2.gz	BBTADIRSVFKNIA-NCOADZHNSA-N	0	3	330.497	3.411	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1cccc(C)c1	ZINC001049784808	1348020890	/nfs/dbraw/zinc/02/08/90/1348020890.db2.gz	XNZOZJFFEMHGFT-DOIPELPJSA-N	0	3	336.479	3.187	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cccc(N2CCCC2)c1	ZINC001049805649	1348028570	/nfs/dbraw/zinc/02/85/70/1348028570.db2.gz	KRHJXPQALJLKAK-VQTJNVASSA-N	0	3	339.483	3.152	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](C)c1ccc(C)s1	ZINC001049835266	1348048330	/nfs/dbraw/zinc/04/83/30/1348048330.db2.gz	HDGZFOQCOFREME-IXDOHACOSA-N	0	3	330.497	3.249	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1[nH]ccc1-c1ccccc1	ZINC001049840188	1348051817	/nfs/dbraw/zinc/05/18/17/1348051817.db2.gz	GKJWGMGKWKRDJA-VQTJNVASSA-N	0	3	347.462	3.384	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1c[nH]nc1C1CCCCC1	ZINC001049843260	1348054036	/nfs/dbraw/zinc/05/40/36/1348054036.db2.gz	OKZNPGOLAWZULD-ZWKOTPCHSA-N	0	3	342.487	3.322	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C[C@@H]1CCCc2ccccc21	ZINC001049854599	1348060954	/nfs/dbraw/zinc/06/09/54/1348060954.db2.gz	OCWOWMKHELAJAG-SESVDKBCSA-N	0	3	336.479	3.195	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)COc1ccccc1C(C)C	ZINC001049881030	1348086604	/nfs/dbraw/zinc/08/66/04/1348086604.db2.gz	LGRXEGSXLFRAAE-RTBURBONSA-N	0	3	342.483	3.440	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(F)c2occc21	ZINC001049907897	1348106017	/nfs/dbraw/zinc/10/60/17/1348106017.db2.gz	LBWMHUIHRNIZAU-SJORKVTESA-N	0	3	328.387	3.437	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cnc(C(C)(C)C)nc1	ZINC001049927316	1348117992	/nfs/dbraw/zinc/11/79/92/1348117992.db2.gz	JCFATPKZBNQWSP-IAGOWNOFSA-N	0	3	342.487	3.029	20	30		EGEDHN
C[C@@H](c1ccc(F)cc1)N1C[C@@H]2CCCN(C(=O)C#CC3CC3)[C@@H]2C1	ZINC001050045862	1348164789	/nfs/dbraw/zinc/16/47/89/1348164789.db2.gz	MTUYZGWNUQSDRI-ZAAXVRCTSA-N	0	3	340.442	3.223	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3ccc(N(C)C)cc3F)[C@@H]2C1	ZINC001050067034	1348171332	/nfs/dbraw/zinc/17/13/32/1348171332.db2.gz	LEEZFJVVHVMNCY-HNAYVOBHSA-N	0	3	345.462	3.004	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)[C@@H](CC)Oc3ccccc3C)[C@@H]2C1	ZINC001050152205	1348197427	/nfs/dbraw/zinc/19/74/27/1348197427.db2.gz	CUQBLNPZGNSECY-IPMKNSEASA-N	0	3	342.483	3.261	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)c3[nH]ccc3-c3ccccc3)[C@@H]2C1	ZINC001050180589	1348203538	/nfs/dbraw/zinc/20/35/38/1348203538.db2.gz	IPCUOTUSCUYQON-AZUAARDMSA-N	0	3	347.462	3.241	20	30		EGEDHN
CC(C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)CC2)=C1CCC1	ZINC001050515609	1348281808	/nfs/dbraw/zinc/28/18/08/1348281808.db2.gz	GGYZOQFXDNJQAW-UHFFFAOYSA-N	0	3	349.478	3.483	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CN(Cc2ccc(C)cc2)C[C@H]1C	ZINC001079850185	1357400884	/nfs/dbraw/zinc/40/08/84/1357400884.db2.gz	JDTIPLIPYMCWEV-IEBWSBKVSA-N	0	3	337.467	3.233	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1cncc(C)c1)CC2	ZINC001050645570	1348313681	/nfs/dbraw/zinc/31/36/81/1348313681.db2.gz	QYHOLSJKPBDBIR-FQEVSTJZSA-N	0	3	341.499	3.417	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3cc4cc(C)ccc4s3)C2)CC1	ZINC001050717518	1348335764	/nfs/dbraw/zinc/33/57/64/1348335764.db2.gz	RRZXZZVUMSBLKR-UHFFFAOYSA-N	0	3	338.476	3.381	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@H](C)c3cc4ccccc4o3)C2)CC1	ZINC001050726004	1348338656	/nfs/dbraw/zinc/33/86/56/1348338656.db2.gz	PDLJJHUTUUJXJB-MRXNPFEDSA-N	0	3	336.435	3.094	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cc4c(s3)CCCC4)C2)CC1	ZINC001050746761	1348347295	/nfs/dbraw/zinc/34/72/95/1348347295.db2.gz	YHYGCWIQGXLUBQ-UHFFFAOYSA-N	0	3	342.508	3.188	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cc(C)n(C(C)C)c3C)C2)CC1	ZINC001050749168	1348348025	/nfs/dbraw/zinc/34/80/25/1348348025.db2.gz	GTNOPHHPXPMRCF-UHFFFAOYSA-N	0	3	341.499	3.247	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cc4cccc(F)c4o3)C2)CC1	ZINC001050760698	1348351122	/nfs/dbraw/zinc/35/11/22/1348351122.db2.gz	RNPAKGGSYFFLAA-UHFFFAOYSA-N	0	3	340.398	3.133	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cc4cccc(C)c4o3)C2)CC1	ZINC001050766922	1348352398	/nfs/dbraw/zinc/35/23/98/1348352398.db2.gz	CNNJGZNLFOLTSK-UHFFFAOYSA-N	0	3	336.435	3.303	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@@H](c3ccc(F)cc3)C(C)C)C2)CC1	ZINC001050768224	1348353388	/nfs/dbraw/zinc/35/33/88/1348353388.db2.gz	QKMHPTLYCIJGEY-LJQANCHMSA-N	0	3	342.458	3.123	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)C3CC(OCC)C3)cccc2C1	ZINC001051287526	1348419248	/nfs/dbraw/zinc/41/92/48/1348419248.db2.gz	XJBAVBSMWPRAOP-UHFFFAOYSA-N	0	3	342.483	3.052	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)[C@@H]3C[C@H]3c3ccco3)cccc2C1	ZINC001051302747	1348426345	/nfs/dbraw/zinc/42/63/45/1348426345.db2.gz	PGSVXNSPTNADKY-WOJBJXKFSA-N	0	3	348.446	3.081	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CCCN(CCC(F)(F)F)CC1	ZINC001052446706	1348543601	/nfs/dbraw/zinc/54/36/01/1348543601.db2.gz	PAHPQMFYJAOBAK-CQSZACIVSA-N	0	3	343.393	3.211	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2cc3ccc(F)cc3s2)CC1	ZINC001052538485	1348570262	/nfs/dbraw/zinc/57/02/62/1348570262.db2.gz	SGNKYXTUNAOWQY-HNNXBMFYSA-N	0	3	330.428	3.258	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCN(Cc3cncc(C)c3)CC2)cc1	ZINC001052613384	1348597015	/nfs/dbraw/zinc/59/70/15/1348597015.db2.gz	DGQHRDDTIWRTNE-NRFANRHFSA-N	0	3	347.462	3.156	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)C(C)(C)c2ccc(Cl)cc2)CC1	ZINC001052674457	1348623690	/nfs/dbraw/zinc/62/36/90/1348623690.db2.gz	NGBGCEPSZZJCAO-QGZVFWFLSA-N	0	3	332.875	3.222	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N[C@H]1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC001052728664	1348650007	/nfs/dbraw/zinc/65/00/07/1348650007.db2.gz	MJLRQDOVRRVVCD-CEXWTWQISA-N	0	3	325.456	3.075	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)Cc2cccc(Cl)c2F)CC1	ZINC001052745563	1348658871	/nfs/dbraw/zinc/65/88/71/1348658871.db2.gz	OOMUWYNASWWEGT-HNNXBMFYSA-N	0	3	336.838	3.016	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)Cc2cccc(Cl)c2F)CC1	ZINC001052745565	1348659010	/nfs/dbraw/zinc/65/90/10/1348659010.db2.gz	OOMUWYNASWWEGT-OAHLLOKOSA-N	0	3	336.838	3.016	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H](NC(=O)[C@H]3CC34CCC4)CC2)cc1	ZINC001052753803	1348663758	/nfs/dbraw/zinc/66/37/58/1348663758.db2.gz	IMWSXPGUNITWAY-RBUKOAKNSA-N	0	3	337.467	3.219	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cc(C)oc2C(F)(F)F)CC1	ZINC001052754891	1348664724	/nfs/dbraw/zinc/66/47/24/1348664724.db2.gz	RJTKRQOFFIHHAC-CYBMUJFWSA-N	0	3	342.361	3.214	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N[C@@H]1CCCN(C/C=C/Cl)CC1	ZINC001052779509	1348675589	/nfs/dbraw/zinc/67/55/89/1348675589.db2.gz	GXUJCSCJIOQSBR-OAPCPPSCSA-N	0	3	340.895	3.081	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)Cc2ccsc2)C1	ZINC001053063071	1348874448	/nfs/dbraw/zinc/87/44/48/1348874448.db2.gz	GZPFFWCXTPEOTH-QZTJIDSGSA-N	0	3	330.497	3.017	20	30		EGEDHN
C=CC[N@H+]1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001053067562	1348881075	/nfs/dbraw/zinc/88/10/75/1348881075.db2.gz	RWTOOQRGSNIMOD-AEFFLSMTSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=CC[N@@H+]1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001053067562	1348881081	/nfs/dbraw/zinc/88/10/81/1348881081.db2.gz	RWTOOQRGSNIMOD-AEFFLSMTSA-N	0	3	328.456	3.285	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)CCc2ccoc2)C1	ZINC001053074642	1348892065	/nfs/dbraw/zinc/89/20/65/1348892065.db2.gz	DMYGUPCMCOURIR-PMACEKPBSA-N	0	3	342.483	3.329	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2oc(C)nc2C)C1	ZINC001053075526	1348893051	/nfs/dbraw/zinc/89/30/51/1348893051.db2.gz	HOYJZDOVAWXKHS-MSOLQXFVSA-N	0	3	343.471	3.021	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)/C=C/c2ccc[nH]2)C1	ZINC001053080106	1348901676	/nfs/dbraw/zinc/90/16/76/1348901676.db2.gz	AKLVUHXTWKQIML-WIMDODNTSA-N	0	3	339.483	3.144	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccsc2C)C1	ZINC001053083479	1348904202	/nfs/dbraw/zinc/90/42/02/1348904202.db2.gz	LBJNDXGEVQABPL-WMZOPIPTSA-N	0	3	330.497	3.396	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2c(C)ccn2C)C1	ZINC001053084485	1348906278	/nfs/dbraw/zinc/90/62/78/1348906278.db2.gz	RMBKNHNWXCSPQH-RBUKOAKNSA-N	0	3	341.499	3.064	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(Cl)[nH]2)C1	ZINC001053094476	1348923428	/nfs/dbraw/zinc/92/34/28/1348923428.db2.gz	FRKCGSVEDFKWFL-NVXWUHKLSA-N	0	3	347.890	3.398	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cc[nH]c2CCC)C1	ZINC001053095805	1348925533	/nfs/dbraw/zinc/92/55/33/1348925533.db2.gz	LLAWOEOIDWSSLS-XLIONFOSSA-N	0	3	341.499	3.307	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccn(C)c2C)C1	ZINC001053096808	1348927476	/nfs/dbraw/zinc/92/74/76/1348927476.db2.gz	ZUIYNLWJMCETNG-AZUAARDMSA-N	0	3	341.499	3.064	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)Cc2cccc(F)c2)C1	ZINC001053104397	1348939654	/nfs/dbraw/zinc/93/96/54/1348939654.db2.gz	GCMCIJVRTPNDIQ-AZUAARDMSA-N	0	3	342.458	3.095	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H]1CCCc3ccccc31)C2	ZINC001054153369	1349156115	/nfs/dbraw/zinc/15/61/15/1349156115.db2.gz	PWJJBWDZDZABAT-IRLDBZIGSA-N	0	3	336.479	3.054	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@]2(CCN(Cc3ocnc3C)C2)C1	ZINC001054174905	1349176101	/nfs/dbraw/zinc/17/61/01/1349176101.db2.gz	CPCIMMZYISFCLT-FQEVSTJZSA-N	0	3	345.487	3.400	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc3cc(C)ccc3[nH]1)C2	ZINC001054174586	1349176464	/nfs/dbraw/zinc/17/64/64/1349176464.db2.gz	UUXSFPOTNXPVNM-JOCHJYFZSA-N	0	3	349.478	3.428	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc3cccnc3c1)C2	ZINC001054215704	1349215235	/nfs/dbraw/zinc/21/52/35/1349215235.db2.gz	CARQOFNQHBIMEY-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc3nc(C)ccc3c1)C2	ZINC001054217619	1349215667	/nfs/dbraw/zinc/21/56/67/1349215667.db2.gz	ZURJRTHDGGZHQH-JOCHJYFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)C[C@H](C)c1ccco1)C2	ZINC001054229028	1349222759	/nfs/dbraw/zinc/22/27/59/1349222759.db2.gz	IIGBFQXMDDUKFJ-FXAWDEMLSA-N	0	3	328.456	3.111	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)Cc1sc(C)cc1C)C2	ZINC001054233307	1349225748	/nfs/dbraw/zinc/22/57/48/1349225748.db2.gz	HKAARIBOZNYKKO-FQEVSTJZSA-N	0	3	344.524	3.245	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc3c(c1)CCCC3)C2	ZINC001054237455	1349231309	/nfs/dbraw/zinc/23/13/09/1349231309.db2.gz	XODWWRPGUOYACY-QFIPXVFZSA-N	0	3	336.479	3.127	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)[C@H](C)c1ccc(F)cc1F)C2	ZINC001054241972	1349235421	/nfs/dbraw/zinc/23/54/21/1349235421.db2.gz	CDTHRVRMKOELOH-QRWLVFNGSA-N	0	3	346.421	3.016	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1cnc(C(C)(C)C)s1)C2	ZINC001054245865	1349240241	/nfs/dbraw/zinc/24/02/41/1349240241.db2.gz	GERWISOIDUPOCU-IBGZPJMESA-N	0	3	345.512	3.002	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccccc1CC(C)C)C2	ZINC001054246760	1349242166	/nfs/dbraw/zinc/24/21/66/1349242166.db2.gz	ISTWLEIBAXWDPQ-QFIPXVFZSA-N	0	3	338.495	3.446	20	30		EGEDHN
CC(C)CCN1Cc2ccc(CNC(=O)c3cc(C#N)c[nH]3)cc2C1	ZINC001054260241	1349256911	/nfs/dbraw/zinc/25/69/11/1349256911.db2.gz	IBQVAPTVCWLGFX-UHFFFAOYSA-N	0	3	336.439	3.178	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@@H]3CC[C@@H](OC)C3)cc2C1	ZINC001054271009	1349270048	/nfs/dbraw/zinc/27/00/48/1349270048.db2.gz	FFICIIWHRCGXQO-YLJYHZDGSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3conc3C3CC3)cc2C1	ZINC001054280171	1349281042	/nfs/dbraw/zinc/28/10/42/1349281042.db2.gz	BQGBSHVFUTVJJK-UHFFFAOYSA-N	0	3	337.423	3.374	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CCCCC2)C[C@H]1NCc1ccc(C#N)s1	ZINC001054345191	1349324538	/nfs/dbraw/zinc/32/45/38/1349324538.db2.gz	MBIAWDXTFULVII-CXAGYDPISA-N	0	3	331.485	3.137	20	30		EGEDHN
C[C@H]1CN(C(=O)CC2=CCCCC2)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054477004	1349369767	/nfs/dbraw/zinc/36/97/67/1349369767.db2.gz	AUTDWKUJYYOEFW-KSSFIOAISA-N	0	3	343.496	3.447	20	30		EGEDHN
C[C@H]1CN(C(=O)CCC2CCC2)C[C@H]1NCc1ccc(C#N)s1	ZINC001054525241	1349384942	/nfs/dbraw/zinc/38/49/42/1349384942.db2.gz	NPRBQNPRNKKAAZ-SUMWQHHRSA-N	0	3	331.485	3.137	20	30		EGEDHN
C[C@H]1CN(C(=O)CC(C)(C)C2CC2)C[C@H]1NCc1ccc(C#N)s1	ZINC001054642186	1349426227	/nfs/dbraw/zinc/42/62/27/1349426227.db2.gz	JQVNNHSKCYAJQN-SUMWQHHRSA-N	0	3	345.512	3.383	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](C)[C@H](NCc2ccc(Cl)nc2)C1	ZINC001054970976	1349531716	/nfs/dbraw/zinc/53/17/16/1349531716.db2.gz	KQJKCTRJSLIABW-DZGCQCFKSA-N	0	3	335.879	3.274	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CN(CCOc3ccccc3C)C[C@H]2C)C1	ZINC001080404676	1357608947	/nfs/dbraw/zinc/60/89/47/1357608947.db2.gz	TYVNBALRJRXIFN-QZTJIDSGSA-N	0	3	342.483	3.167	20	30		EGEDHN
C=C(C)CCN1C[C@@H](C)[C@H](NC(=O)c2cnc(-c3ccoc3)s2)C1	ZINC001080574325	1357682149	/nfs/dbraw/zinc/68/21/49/1357682149.db2.gz	WSUQNQXLAJFELJ-UKRRQHHQSA-N	0	3	345.468	3.419	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2ccc(C(F)F)cc2)[C@H](OC)C1	ZINC001082241108	1357989525	/nfs/dbraw/zinc/98/95/25/1357989525.db2.gz	BVCLMHOAHVGFKR-HZPDHXFCSA-N	0	3	338.398	3.019	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)CCC1CCCC1)C[C@H](C)O2	ZINC001071126325	1354465946	/nfs/dbraw/zinc/46/59/46/1354465946.db2.gz	BIHCAYUGTPWQBF-FXAWDEMLSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1ccccc1OC1CCC1	ZINC001085808246	1358786407	/nfs/dbraw/zinc/78/64/07/1358786407.db2.gz	ZMHWKZYCGPPNQH-INIZCTEOSA-N	0	3	328.456	3.340	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)CN(C(=O)C1CCCCCCC1)C[C@H](C)O2	ZINC001071188971	1354494102	/nfs/dbraw/zinc/49/41/02/1354494102.db2.gz	DBIGXXLCUKIKPT-GHTZIAJQSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=Cc1ccc(C(=O)N2C[C@H](C)O[C@]3(CCN(CC(=C)C)C3)C2)cc1	ZINC001071209403	1354506351	/nfs/dbraw/zinc/50/63/51/1354506351.db2.gz	JIUADVGEWOSQOJ-UWJYYQICSA-N	0	3	340.467	3.211	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1ccc(F)cc1C)C[C@@H](C)O2	ZINC001071231139	1354516029	/nfs/dbraw/zinc/51/60/29/1354516029.db2.gz	NOOHLPOBYAVJFK-OXQOHEQNSA-N	0	3	346.446	3.016	20	30		EGEDHN
C#CCCN1CC[C@]2(C1)CN(C(=O)C1(CC)CCCCC1)C[C@@H](C)O2	ZINC001071244395	1354524620	/nfs/dbraw/zinc/52/46/20/1354524620.db2.gz	UGYHTTMRWFJSLE-NQIIRXRSSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1ccc(CF)cc1)C[C@@H](C)O2	ZINC001071245839	1354525924	/nfs/dbraw/zinc/52/59/24/1354525924.db2.gz	KERRGWCDXZBWQR-UZLBHIALSA-N	0	3	346.446	3.038	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cn(C(C)(C)C)nc2C)CC[C@H]1C	ZINC001071501727	1354731135	/nfs/dbraw/zinc/73/11/35/1354731135.db2.gz	UCGFIIUXEMJEDD-GDBMZVCRSA-N	0	3	332.492	3.105	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2sc(C3CC3)nc2C)CC[C@@H]1C	ZINC001071508501	1354733647	/nfs/dbraw/zinc/73/36/47/1354733647.db2.gz	PBKNJJVDGDMQBC-SWLSCSKDSA-N	0	3	333.501	3.488	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc3nccc(C)c3c2)CC[C@H]1C	ZINC001071533636	1354750434	/nfs/dbraw/zinc/75/04/34/1354750434.db2.gz	IZBDURDSLZYXAU-AEFFLSMTSA-N	0	3	335.451	3.149	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc3ccccc3nc2C)CC[C@H]1C	ZINC001071546946	1354758622	/nfs/dbraw/zinc/75/86/22/1354758622.db2.gz	PCYZVNJQJJRBGP-CRAIPNDOSA-N	0	3	335.451	3.149	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cncn2-c2ccccc2)CC[C@@H]1C	ZINC001071560559	1354764520	/nfs/dbraw/zinc/76/45/20/1354764520.db2.gz	CHQAIPZMVRBKLO-DLBZAZTESA-N	0	3	338.455	3.031	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2cc3ccncc3s2)CC[C@@H]1C	ZINC001071568543	1354768636	/nfs/dbraw/zinc/76/86/36/1354768636.db2.gz	OSQXCOYMZWCOCI-DZGCQCFKSA-N	0	3	329.469	3.455	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2cncc3ccccc32)CC[C@H]1C	ZINC001071584629	1354779072	/nfs/dbraw/zinc/77/90/72/1354779072.db2.gz	RLMQYNXZZHITOM-APWZRJJASA-N	0	3	337.467	3.323	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2oc(CC)nc2C)C1	ZINC001088409915	1359881806	/nfs/dbraw/zinc/88/18/06/1359881806.db2.gz	VDKLUQKROLVWQV-AWEZNQCLSA-N	0	3	339.867	3.272	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cccc3ccc(C)nc32)CC[C@H]1C	ZINC001071599991	1354787768	/nfs/dbraw/zinc/78/77/68/1354787768.db2.gz	CPRRVURZGZTIMP-SJLPKXTDSA-N	0	3	335.451	3.149	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2(c3cccc(C)c3)CCC2)CC[C@H]1C	ZINC001071728129	1354883495	/nfs/dbraw/zinc/88/34/95/1354883495.db2.gz	HWHRNOWJCUCVKK-QUCCMNQESA-N	0	3	338.495	3.409	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CC[C@H](C)N(Cc3cccc(C)c3)C2)c1	ZINC001071813672	1354955799	/nfs/dbraw/zinc/95/57/99/1354955799.db2.gz	CYNWHNMPXRMMDX-LAUBAEHRSA-N	0	3	347.462	3.154	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CC[C@H](C)N(CC3=CCCCC3)C2)c1	ZINC001071814611	1354956593	/nfs/dbraw/zinc/95/65/93/1354956593.db2.gz	KLBBSCZESXVFFM-JXFKEZNVSA-N	0	3	337.467	3.146	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C(C)(C)c2cccc(F)c2)CC[C@@H]1C	ZINC001071825542	1354963172	/nfs/dbraw/zinc/96/31/72/1354963172.db2.gz	YKGAPHJTFHAALI-YJBOKZPZSA-N	0	3	330.447	3.096	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2cc(Br)co2)CC[C@@H]1C	ZINC001071868651	1354993715	/nfs/dbraw/zinc/99/37/15/1354993715.db2.gz	LWFVAZXCTNQVEF-AAEUAGOBSA-N	0	3	341.249	3.201	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cnc(C(C)C)nc2C)CC[C@@H]1C	ZINC001071875829	1355000694	/nfs/dbraw/zinc/00/06/94/1355000694.db2.gz	FGCLTEGJYSCJQX-HOCLYGCPSA-N	0	3	330.476	3.067	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc(C)cc3c[nH]nc32)CC[C@H]1C	ZINC001071890191	1355008837	/nfs/dbraw/zinc/00/88/37/1355008837.db2.gz	IGTBFLMESPZJHH-GDBMZVCRSA-N	0	3	326.444	3.030	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cnn(CC3CCCC3)c2)CC[C@@H]1C	ZINC001071931693	1355032146	/nfs/dbraw/zinc/03/21/46/1355032146.db2.gz	YXYPCENWMOIFBD-QFBILLFUSA-N	0	3	344.503	3.232	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cccc(-n3ccnc3)c2)CC[C@H]1C	ZINC001071954423	1355040229	/nfs/dbraw/zinc/04/02/29/1355040229.db2.gz	OOHSGBXCVYYFSO-AEFFLSMTSA-N	0	3	338.455	3.031	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CC[C@H](C)N(Cc3cccc(C)c3)C2)cn1	ZINC001072002154	1355067115	/nfs/dbraw/zinc/06/71/15/1355067115.db2.gz	JEELGYCJBQYDEO-UWJYYQICSA-N	0	3	347.462	3.154	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C23CC4CC(CC(C4)C2)C3)CC[C@H]1C	ZINC001072012076	1355075459	/nfs/dbraw/zinc/07/54/59/1355075459.db2.gz	HZMLPXPMEODOCS-CYSNLQCGSA-N	0	3	328.500	3.195	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(CC(C)C)cc2)CC[C@H]1C	ZINC001072064213	1355109155	/nfs/dbraw/zinc/10/91/55/1355109155.db2.gz	XROISAWBTGOFDL-YLJYHZDGSA-N	0	3	326.484	3.491	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(OCC3CC3)cc2)CC[C@@H]1C	ZINC001072088268	1355121358	/nfs/dbraw/zinc/12/13/58/1355121358.db2.gz	IRDJWJKCNPYJGA-LPHOPBHVSA-N	0	3	340.467	3.081	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2coc(C3CCCCC3)n2)CC[C@@H]1C	ZINC001072102002	1355131144	/nfs/dbraw/zinc/13/11/44/1355131144.db2.gz	MAUHTEFUGBBGKT-RDJZCZTQSA-N	0	3	343.471	3.328	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C23CC(c4ccccc4)(C2)C3)CC[C@H]1C	ZINC001072110321	1355136437	/nfs/dbraw/zinc/13/64/37/1355136437.db2.gz	WDOUGRHMBJVJSI-LGRHEBEHSA-N	0	3	336.479	3.101	20	30		EGEDHN
C=CCN1CC[C@@H](CN(Cc2scnc2C)C(=O)c2ccco2)C1	ZINC001072132596	1355147004	/nfs/dbraw/zinc/14/70/04/1355147004.db2.gz	QYPLNGORBCWRKG-OAHLLOKOSA-N	0	3	345.468	3.195	20	30		EGEDHN
C[C@@H]1CCN(C(=O)C2=CCCC2)C[C@@H]1CNCc1ccccc1C#N	ZINC001072248408	1355206607	/nfs/dbraw/zinc/20/66/07/1355206607.db2.gz	QBDKTLIDKFKKNT-UZLBHIALSA-N	0	3	337.467	3.243	20	30		EGEDHN
CCC1(C(=O)N2CC[C@H](C)[C@@H](CNCc3ccccc3C#N)C2)CC1	ZINC001072364206	1355258398	/nfs/dbraw/zinc/25/83/98/1355258398.db2.gz	QCTCQSBWLHQTMI-LPHOPBHVSA-N	0	3	339.483	3.323	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)C[C@@H]4CC[C@@H]5C[C@@H]54)C3)C2)c1	ZINC001072874789	1355477702	/nfs/dbraw/zinc/47/77/02/1355477702.db2.gz	FRFHZTWVAMFFBZ-AABGKKOBSA-N	0	3	349.478	3.029	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC3(C2)CCN(Cc2csc(C)c2)C3)C1	ZINC001072964519	1355526996	/nfs/dbraw/zinc/52/69/96/1355526996.db2.gz	ZIZWPSRQKNOTLU-UHFFFAOYSA-N	0	3	330.497	3.447	20	30		EGEDHN
CC[C@]1(C)C[C@H]1C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001073091061	1355588395	/nfs/dbraw/zinc/58/83/95/1355588395.db2.gz	DHKTVHFWNSGQHJ-AZUAARDMSA-N	0	3	337.467	3.029	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@@H](N[C@H](C)c3ccc(F)c(F)c3)C2)CCC1	ZINC001183200256	1387277411	/nfs/dbraw/zinc/27/74/11/1387277411.db2.gz	MKWIGXJLSRWQRY-GDBMZVCRSA-N	0	3	346.421	3.410	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2cccc(Cl)c2C)C1	ZINC001073616608	1355846044	/nfs/dbraw/zinc/84/60/44/1355846044.db2.gz	ZDIQRSUDMDVXMS-HNNXBMFYSA-N	0	3	336.863	3.045	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2scc(C)c2Cl)C1	ZINC001073617935	1355846143	/nfs/dbraw/zinc/84/61/43/1355846143.db2.gz	PWCHPQUFOASLIV-CYBMUJFWSA-N	0	3	342.892	3.107	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2ccccc2CCC)C1	ZINC001073689966	1355867065	/nfs/dbraw/zinc/86/70/65/1355867065.db2.gz	IZPPVQVUARTDJW-GOSISDBHSA-N	0	3	330.472	3.036	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2cccn2C2CCCC2)C1	ZINC001073834805	1355911720	/nfs/dbraw/zinc/91/17/20/1355911720.db2.gz	KOBMTDBWXSJKDU-GOSISDBHSA-N	0	3	345.487	3.000	20	30		EGEDHN
C[C@H]1[C@@H](NCc2ccc(C#N)s2)CCN1C(=O)/C=C\c1ccco1	ZINC001074502256	1356200942	/nfs/dbraw/zinc/20/09/42/1356200942.db2.gz	RZMJBPMASWGJQM-MHCXUBMFSA-N	0	3	341.436	3.005	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001075209769	1356344210	/nfs/dbraw/zinc/34/42/10/1356344210.db2.gz	QMPYPOXLBHPDFR-AEFFLSMTSA-N	0	3	325.456	3.099	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)c3cc(C4CC4)[nH]c3C3CC3)[C@@H]2C1	ZINC001075944707	1356452163	/nfs/dbraw/zinc/45/21/63/1356452163.db2.gz	MCRXDHRLOWMLCW-MAUKXSAKSA-N	0	3	325.456	3.102	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cc(-c4ccccc4)ccn3)[C@@H]2C1	ZINC001076401450	1356570714	/nfs/dbraw/zinc/57/07/14/1356570714.db2.gz	PBXIVGRFUUUKNX-PZJWPPBQSA-N	0	3	347.462	3.471	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cccc(-c4cnco4)c3)[C@@H]2C1	ZINC001076419953	1356574101	/nfs/dbraw/zinc/57/41/01/1356574101.db2.gz	VICDOTSYTRBTGA-ZWKOTPCHSA-N	0	3	337.423	3.064	20	30		EGEDHN
C#CCCN1CC[C@]2(C1)C[C@@H](NC(=O)C(C)(C)C)c1ccccc1O2	ZINC001098545863	1363368152	/nfs/dbraw/zinc/36/81/52/1363368152.db2.gz	ZNZOYKDFYOKNAU-DYESRHJHSA-N	0	3	340.467	3.140	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)CC34CC5CC(CC(C5)C3)C4)[C@@H]2C1	ZINC001076494601	1356595816	/nfs/dbraw/zinc/59/58/16/1356595816.db2.gz	IHCYEDDXMVRBOW-GELQRLDPSA-N	0	3	328.500	3.312	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccc(OCC(C)C)cc3)[C@@H]2C1	ZINC001076532853	1356608892	/nfs/dbraw/zinc/60/88/92/1356608892.db2.gz	HPAKYPXDNMDKKE-AZUAARDMSA-N	0	3	342.483	3.444	20	30		EGEDHN
CC1(C)CC[C@@H](CNC(=O)CSCC#N)N(Cc2ccccc2)C1	ZINC001098922050	1363521956	/nfs/dbraw/zinc/52/19/56/1363521956.db2.gz	MWWAFZJNYQOXBU-KRWDZBQOSA-N	0	3	345.512	3.050	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc3c(c2)C(C)(C)CO3)C1	ZINC001098939420	1363529753	/nfs/dbraw/zinc/52/97/53/1363529753.db2.gz	RZNRUSAHETYIOW-KKSFZXQISA-N	0	3	340.467	3.127	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CN([C@@H](CC)c3ccccc3)C[C@H]2O)CC1	ZINC001077618451	1356810877	/nfs/dbraw/zinc/81/08/77/1356810877.db2.gz	IWFNNKBJALWAHT-HSALFYBXSA-N	0	3	342.483	3.045	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CN(CCC3CCCCCC3)C[C@H]2O)CC1	ZINC001077624859	1356810916	/nfs/dbraw/zinc/81/09/16/1356810916.db2.gz	FPHQYFVRCYKFRW-WOJBJXKFSA-N	0	3	348.531	3.255	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc(C)c(OC)c2)C12CCC2	ZINC001078676410	1357050808	/nfs/dbraw/zinc/05/08/08/1357050808.db2.gz	WFPFXBSCBPFYHI-IRXDYDNUSA-N	0	3	348.874	3.387	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)C2(c3ccc(Cl)cc3)CC2)C1	ZINC001080897152	1357761349	/nfs/dbraw/zinc/76/13/49/1357761349.db2.gz	LJZUVXXQOHBUPY-RHSMWYFYSA-N	0	3	332.875	3.384	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)Cc2coc3cc(C)ccc23)C1	ZINC001080901197	1357762316	/nfs/dbraw/zinc/76/23/16/1357762316.db2.gz	QAPITOXOGAOGEZ-CRAIPNDOSA-N	0	3	326.440	3.296	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)C2(c3cc(C)cc(C)c3)CC2)C1	ZINC001080951325	1357769137	/nfs/dbraw/zinc/76/91/37/1357769137.db2.gz	PIAFQQZSGKNBAB-IEBWSBKVSA-N	0	3	326.484	3.348	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@@H]2C[C@H]2c2cccc(F)c2F)C1	ZINC001080968979	1357770734	/nfs/dbraw/zinc/77/07/34/1357770734.db2.gz	YCLJMFUQMUXFNV-DUFGSWQCSA-N	0	3	334.410	3.081	20	30		EGEDHN
C#CCCN1C[C@@H](C)[C@H](NC(=O)c2cc3cccc(Cl)c3o2)C1	ZINC001081065965	1357806707	/nfs/dbraw/zinc/80/67/07/1357806707.db2.gz	SAXFPPCEGYDOTE-IUODEOHRSA-N	0	3	330.815	3.160	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H]2CCCC3(CC3)C2)C[C@H]1c1ccccc1	ZINC001081116847	1357836713	/nfs/dbraw/zinc/83/67/13/1357836713.db2.gz	CUSMLICMVDDMGS-SLFFLAALSA-N	0	3	336.479	3.174	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H]2CCC(C)=C(C)C2)C[C@H]1c1ccccc1	ZINC001081120969	1357839646	/nfs/dbraw/zinc/83/96/46/1357839646.db2.gz	NEBXQTWOPCZGBV-PCCBWWKXSA-N	0	3	336.479	3.340	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)CCc2ccc(C)cc2)C[C@H]1c1ccccc1	ZINC001081142970	1357844720	/nfs/dbraw/zinc/84/47/20/1357844720.db2.gz	DVUXOZLLYYYHDS-FCHUYYIVSA-N	0	3	346.474	3.145	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C2CCC(C)(C)CC2)C[C@H]1c1ccccc1	ZINC001081233177	1357851838	/nfs/dbraw/zinc/85/18/38/1357851838.db2.gz	VJZNZDMVBSXURF-VQTJNVASSA-N	0	3	338.495	3.420	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2ccccc2CC(C)(C)C)[C@H](OC)C1	ZINC001081834135	1357869323	/nfs/dbraw/zinc/86/93/23/1357869323.db2.gz	VTWRHAJCVIIJNP-RTBURBONSA-N	0	3	344.499	3.280	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)[C@@H]3CCC(C)=C(C)C3)[C@H]2C1	ZINC001083091585	1358118963	/nfs/dbraw/zinc/11/89/63/1358118963.db2.gz	VOTSNLYHSHQFSI-CEXWTWQISA-N	0	3	332.488	3.001	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)c3cc(C)cc(Cl)c3)[C@H]2C1	ZINC001083144151	1358119517	/nfs/dbraw/zinc/11/95/17/1358119517.db2.gz	RHWGCFUBYDUQHZ-ZWKOTPCHSA-N	0	3	348.874	3.140	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)c3ccccc3CC(C)(C)C)[C@@H]2C1	ZINC001084437134	1358212543	/nfs/dbraw/zinc/21/25/43/1358212543.db2.gz	CZFCGGOKHQWHSV-UYAOXDASSA-N	0	3	338.495	3.445	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)c3ccc(-n4cccc4)cc3)[C@@H]2C1	ZINC001084494012	1358224910	/nfs/dbraw/zinc/22/49/10/1358224910.db2.gz	ODTOMOMEMYOJRE-UYAOXDASSA-N	0	3	335.451	3.200	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)CCc3ccc4[nH]ccc4c3)[C@@H]2C1	ZINC001084523550	1358230368	/nfs/dbraw/zinc/23/03/68/1358230368.db2.gz	MEJVCLDABCMMBY-UYAOXDASSA-N	0	3	337.467	3.209	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)c3cccc(N4CCCC4)c3)[C@@H]2C1	ZINC001084736866	1358295883	/nfs/dbraw/zinc/29/58/83/1358295883.db2.gz	GOZROJMSONAPJA-UYAOXDASSA-N	0	3	339.483	3.009	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)c3ccc(C4=CCCC4)cc3)[C@@H]2C1	ZINC001084875735	1358336935	/nfs/dbraw/zinc/33/69/35/1358336935.db2.gz	NYAUMQVOIBDERF-NHCUHLMSSA-N	0	3	334.463	3.424	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)CC3CC(c4ccccc4)C3)C[C@@H]21	ZINC001084975484	1358358418	/nfs/dbraw/zinc/35/84/18/1358358418.db2.gz	GYJGPIRWHFAGMM-WDQDQHCCSA-N	0	3	336.479	3.126	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@@H](c3ccccc3)C3CC3)C[C@@H]21	ZINC001084988829	1358360283	/nfs/dbraw/zinc/36/02/83/1358360283.db2.gz	JCVSESYZKDYQIS-QMMLZNLJSA-N	0	3	336.479	3.126	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H]2CCN(Cc3ncccc3C)[C@H]2C1	ZINC001085023974	1358369852	/nfs/dbraw/zinc/36/98/52/1358369852.db2.gz	JJUGMDAVEUNJAS-SLYNCCJLSA-N	0	3	341.499	3.415	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H]2CCN(Cc3cnccc3C)[C@H]2C1	ZINC001085023921	1358369901	/nfs/dbraw/zinc/36/99/01/1358369901.db2.gz	FHGNCECJQHKIBI-LMNJBCLMSA-N	0	3	341.499	3.415	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H]2CCN(Cc3scnc3C)[C@H]2C1	ZINC001085024164	1358371028	/nfs/dbraw/zinc/37/10/28/1358371028.db2.gz	ZPIWVPQGHGMPCC-GJYPPUQNSA-N	0	3	347.528	3.477	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@]3(C)CC[C@H](C)C3(C)C)C[C@@H]21	ZINC001085048923	1358377938	/nfs/dbraw/zinc/37/79/38/1358377938.db2.gz	PPTSFZQTAKEHQB-NYUBLWNDSA-N	0	3	330.516	3.395	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3c3ccccc3C)C[C@@H]21	ZINC001085055100	1358379977	/nfs/dbraw/zinc/37/99/77/1358379977.db2.gz	PMDFOQPADCBCCU-PMXSJFBMSA-N	0	3	336.479	3.045	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)C(C)(C)[C@@H]1CCCCO1	ZINC001085201188	1358432158	/nfs/dbraw/zinc/43/21/58/1358432158.db2.gz	TUVNMKKWQFEJMY-OAGGEKHMSA-N	0	3	342.911	3.351	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cnn2ccc(C)cc12	ZINC001085232598	1358438798	/nfs/dbraw/zinc/43/87/98/1358438798.db2.gz	NTECJYSPLOSSNK-HZPDHXFCSA-N	0	3	346.862	3.026	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@]1(C)C=CCC1	ZINC001085301005	1358458205	/nfs/dbraw/zinc/45/82/05/1358458205.db2.gz	PMWNJCORPZCOAW-FMKPAKJESA-N	0	3	341.293	3.268	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1c(C)[nH]nc1C(C)C	ZINC001085387534	1358485271	/nfs/dbraw/zinc/48/52/71/1358485271.db2.gz	VHTXKBPUXHKBQE-ZIAGYGMSSA-N	0	3	338.883	3.225	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1c(C)n[nH]c1C(C)C	ZINC001085387534	1358485275	/nfs/dbraw/zinc/48/52/75/1358485275.db2.gz	VHTXKBPUXHKBQE-ZIAGYGMSSA-N	0	3	338.883	3.225	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ncn2cc(Cl)ccc12	ZINC001085605723	1358627646	/nfs/dbraw/zinc/62/76/46/1358627646.db2.gz	RHBWYUDRNBNMHA-OAHLLOKOSA-N	0	3	346.862	3.100	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@@H]1CCCN1c1ccccc1	ZINC001085634550	1358650952	/nfs/dbraw/zinc/65/09/52/1358650952.db2.gz	SSEOCECKFUBWAG-UXHICEINSA-N	0	3	341.499	3.154	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1cnc2c(F)cccc2c1	ZINC001085725385	1358713936	/nfs/dbraw/zinc/71/39/36/1358713936.db2.gz	URLNTUCQMUVRDD-INIZCTEOSA-N	0	3	327.403	3.096	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)[C@@H]1CCc2c1cccc2Cl	ZINC001085726120	1358714091	/nfs/dbraw/zinc/71/40/91/1358714091.db2.gz	PMURCKFREFKNGF-RHSMWYFYSA-N	0	3	332.875	3.479	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cn(C)nc1C1CCCC1	ZINC001085810853	1358788786	/nfs/dbraw/zinc/78/87/86/1358788786.db2.gz	PZEFRFAKJGAXEA-QGZVFWFLSA-N	0	3	344.503	3.190	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1oc(CC(C)C)nc1C	ZINC001085862641	1358828868	/nfs/dbraw/zinc/82/88/68/1358828868.db2.gz	FQMHXXNQGKUPJJ-MRXNPFEDSA-N	0	3	333.476	3.294	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cnc2ccc(F)cc2c1	ZINC001085908876	1358867904	/nfs/dbraw/zinc/86/79/04/1358867904.db2.gz	UWBRTSCLZQIOCP-SFHVURJKSA-N	0	3	341.430	3.486	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc(NC(C)=O)ccc1C	ZINC001086004917	1358958157	/nfs/dbraw/zinc/95/81/57/1358958157.db2.gz	SJHHTMRGWNFJHV-GOSISDBHSA-N	0	3	343.471	3.066	20	30		EGEDHN
CCCCC(=O)N1CC[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001183913523	1387369978	/nfs/dbraw/zinc/36/99/78/1387369978.db2.gz	SBKJQZCHHSIMFR-AEFFLSMTSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(-c3ccncc3)o2)C1	ZINC001086106614	1358999176	/nfs/dbraw/zinc/99/91/76/1358999176.db2.gz	RKGDGYGQHQOHJP-OTVXOJSOSA-N	0	3	345.830	3.192	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)[C@@H]2CCCC2(C)C)C1	ZINC001086171312	1359013627	/nfs/dbraw/zinc/01/36/27/1359013627.db2.gz	JHFORYLRUFXZFK-MJBXVCDLSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc3c(c2)[C@H](C)CO3)C1	ZINC001086174737	1359014981	/nfs/dbraw/zinc/01/49/81/1359014981.db2.gz	QJMMDJSYHZETJE-KYOSRNDESA-N	0	3	334.847	3.033	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)NC[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001086190801	1359022620	/nfs/dbraw/zinc/02/26/20/1359022620.db2.gz	MWNYYOXTGCLMRX-XYVMCAHJSA-N	0	3	343.446	3.118	20	30		EGEDHN
CC[C@]1(C)C[C@@H]1C(=O)NC[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001086239429	1359036951	/nfs/dbraw/zinc/03/69/51/1359036951.db2.gz	FCAVKWUNBPCAMK-XNWPKKHHSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@H]2C[C@@]23CCc2ccccc23)C1	ZINC001086240533	1359037749	/nfs/dbraw/zinc/03/77/49/1359037749.db2.gz	XLZJUZYHOYWJPA-IHMNZUQTSA-N	0	3	344.886	3.127	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2nsc3ccccc32)C1	ZINC001086375177	1359080936	/nfs/dbraw/zinc/08/09/36/1359080936.db2.gz	DGXNNNLJBXZWCW-HAQNSBGRSA-N	0	3	335.860	3.147	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc3cc(C)ccc3n2)C1	ZINC001086424198	1359093140	/nfs/dbraw/zinc/09/31/40/1359093140.db2.gz	NPIBHQYZLZNIBH-KOMQPUFPSA-N	0	3	343.858	3.394	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc3cc(C)ccc3[nH]2)C1	ZINC001086444609	1359098647	/nfs/dbraw/zinc/09/86/47/1359098647.db2.gz	GLNSTJLCTUYFBJ-CTYIDZIISA-N	0	3	331.847	3.327	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(F)c3ccncc23)C1	ZINC001086455440	1359102109	/nfs/dbraw/zinc/10/21/09/1359102109.db2.gz	LRWJQZFMJYWNBS-JOCQHMNTSA-N	0	3	347.821	3.224	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@@H]2CC[C@@H](C(F)(F)F)C2)C1	ZINC001086459735	1359103979	/nfs/dbraw/zinc/10/39/79/1359103979.db2.gz	WGKKABZBUKYCCI-FDYHWXHSSA-N	0	3	338.801	3.202	20	30		EGEDHN
C[C@@H]1CC[C@H](C(=O)NC[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)C1	ZINC001086496097	1359119953	/nfs/dbraw/zinc/11/99/53/1359119953.db2.gz	NAYYXABQHCGBCF-NYCLONFESA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@@H]2C[C@H]2c2ccccc2OC)C1	ZINC001086500630	1359121413	/nfs/dbraw/zinc/12/14/13/1359121413.db2.gz	KWZPRBYGEPTSST-NXNVCVFFSA-N	0	3	348.874	3.036	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)[C@H]2C[C@]2(C)C(C)C)C1	ZINC001086522393	1359130514	/nfs/dbraw/zinc/13/05/14/1359130514.db2.gz	UFHGYAJFNZMZEP-IXYNUQLISA-N	0	3	343.309	3.062	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc3cnccc3c2)C1	ZINC001086526730	1359133075	/nfs/dbraw/zinc/13/30/75/1359133075.db2.gz	VTHINGHKVLEASQ-WJYNOGRTSA-N	0	3	329.831	3.085	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)[C@H]2CCCC23CC3)C1	ZINC001086595385	1359159340	/nfs/dbraw/zinc/15/93/40/1359159340.db2.gz	ZGSUUGSDIYRHBY-XUVXKRRUSA-N	0	3	336.479	3.174	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2conc2C(C)C)C1	ZINC001086716543	1359190897	/nfs/dbraw/zinc/19/08/97/1359190897.db2.gz	HCJKSVNAIIRRCW-QWHCGFSZSA-N	0	3	325.840	3.039	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cccc3c2ccn3C)C1	ZINC001086830094	1359210629	/nfs/dbraw/zinc/21/06/29/1359210629.db2.gz	DVAPIQLJGCKBCV-LSDHHAIUSA-N	0	3	345.874	3.419	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC2(C[C@@H]1C)CCN(Cc1cccc(F)c1)CC2	ZINC001086908828	1359237034	/nfs/dbraw/zinc/23/70/34/1359237034.db2.gz	IVCHEIHJNXZPQC-HOTGVXAUSA-N	0	3	343.446	3.188	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC2(C[C@H]1C)CCN(Cc1cccc(F)c1)CC2	ZINC001086908830	1359237340	/nfs/dbraw/zinc/23/73/40/1359237340.db2.gz	IVCHEIHJNXZPQC-JKSUJKDBSA-N	0	3	343.446	3.188	20	30		EGEDHN
CCCC1(C(=O)NCC2(NCc3ccc(F)c(C#N)c3)CC2)CC1	ZINC001323542023	1387384511	/nfs/dbraw/zinc/38/45/11/1387384511.db2.gz	XZMZVOQRJQXGMO-UHFFFAOYSA-N	0	3	329.419	3.016	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3scnc3CC)C2)CC1	ZINC001086925639	1359250677	/nfs/dbraw/zinc/25/06/77/1359250677.db2.gz	CJEAOSKUFIZMFX-OAHLLOKOSA-N	0	3	345.512	3.045	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)Cc3cccc(CC)c3)C2)CC1	ZINC001086929707	1359254067	/nfs/dbraw/zinc/25/40/67/1359254067.db2.gz	PEYDJAAHGNUILV-SFHVURJKSA-N	0	3	338.495	3.128	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc(C)cc(C)n3)C2)CC1	ZINC001086929692	1359254389	/nfs/dbraw/zinc/25/43/89/1359254389.db2.gz	OTDFWQOJNBXBDK-GOSISDBHSA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cn(C)c4ccccc34)C2)CC1	ZINC001086931206	1359255240	/nfs/dbraw/zinc/25/52/40/1359255240.db2.gz	BTOAPFYYRURXHC-QGZVFWFLSA-N	0	3	349.478	3.128	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc(C)c(F)c3)C2)CC1	ZINC001086931884	1359255817	/nfs/dbraw/zinc/25/58/17/1359255817.db2.gz	UTGUFZTWLCBNDV-QGZVFWFLSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)C3CCC4(CC4)CC3)C2)CC1	ZINC001086933637	1359257147	/nfs/dbraw/zinc/25/71/47/1359257147.db2.gz	RWFDLFVVYFGAGW-KRWDZBQOSA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H]3CCCCC3(F)F)C2)CC1	ZINC001086934152	1359257895	/nfs/dbraw/zinc/25/78/95/1359257895.db2.gz	INQDMXLYZRRTMG-CVEARBPZSA-N	0	3	338.442	3.148	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H](C)c3cccc(C)c3)C2)CC1	ZINC001086945458	1359266281	/nfs/dbraw/zinc/26/62/81/1359266281.db2.gz	BTXMAUYBSNTWLN-OALUTQOASA-N	0	3	338.495	3.435	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H](C)c3cccc(C)c3)C2)CC1	ZINC001086945457	1359266668	/nfs/dbraw/zinc/26/66/68/1359266668.db2.gz	BTXMAUYBSNTWLN-MOPGFXCFSA-N	0	3	338.495	3.435	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)C[C@@H](C)n3cccc3)C2)CC1	ZINC001086953472	1359273543	/nfs/dbraw/zinc/27/35/43/1359273543.db2.gz	JLBULUQOGDWWFY-MOPGFXCFSA-N	0	3	341.499	3.166	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3occ4c3CCCC4)C2)CC1	ZINC001086954595	1359275057	/nfs/dbraw/zinc/27/50/57/1359275057.db2.gz	PFDSLNGABGHQNJ-INIZCTEOSA-N	0	3	340.467	3.108	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)Cc3ccccc3F)C2)CC1	ZINC001086955070	1359275455	/nfs/dbraw/zinc/27/54/55/1359275455.db2.gz	CBDNQHNGGAXHHY-QGZVFWFLSA-N	0	3	342.458	3.095	20	30		EGEDHN
CCCC(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC001087110477	1359289707	/nfs/dbraw/zinc/28/97/07/1359289707.db2.gz	OJCGZGLMNQODNJ-PBHICJAKSA-N	0	3	331.435	3.214	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccoc3CC)C(C)(C)[C@H]21	ZINC001087284098	1359363595	/nfs/dbraw/zinc/36/35/95/1359363595.db2.gz	BQPYWTJTUWBSNS-NXHRZFHOSA-N	0	3	328.456	3.084	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3sc(C)cc3C)C(C)(C)[C@H]21	ZINC001087289994	1359368732	/nfs/dbraw/zinc/36/87/32/1359368732.db2.gz	VQZUPPMVXODTRA-PVAVHDDUSA-N	0	3	330.497	3.217	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(F)c(F)c3)C(C)(C)[C@@H]21	ZINC001087290134	1359369286	/nfs/dbraw/zinc/36/92/86/1359369286.db2.gz	XSNMBHBNTXLMEP-ZTFGCOKTSA-N	0	3	346.421	3.207	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3nc(C)sc3C)C(C)(C)[C@@H]21	ZINC001087291340	1359370455	/nfs/dbraw/zinc/37/04/55/1359370455.db2.gz	SIJJDDIURIJKLM-DJIMGWMZSA-N	0	3	345.512	3.002	20	30		EGEDHN
C=CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ncc(Cl)s1	ZINC001087294960	1359375452	/nfs/dbraw/zinc/37/54/52/1359375452.db2.gz	BKAHVCSAIYDUOC-KGYLQXTDSA-N	0	3	339.892	3.201	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc(C(C)C)n3)C(C)(C)[C@H]21	ZINC001087294990	1359376115	/nfs/dbraw/zinc/37/61/15/1359376115.db2.gz	BXSZFQVWFCGMEU-LZQZEXGQSA-N	0	3	339.483	3.057	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc(C)c(F)c1F	ZINC001087304296	1359387514	/nfs/dbraw/zinc/38/75/14/1359387514.db2.gz	AHNGYMHTJUEEQL-FHLIZLRMSA-N	0	3	346.421	3.125	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc4occc4s3)C(C)(C)[C@H]21	ZINC001087304949	1359389245	/nfs/dbraw/zinc/38/92/45/1359389245.db2.gz	KDFQHPNULSTICJ-DQYPLSBCSA-N	0	3	342.464	3.346	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc(F)ccc1Cl	ZINC001087305846	1359390972	/nfs/dbraw/zinc/39/09/72/1359390972.db2.gz	ZKLLAUKYNDFPSY-XOKHGSTOSA-N	0	3	348.849	3.331	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cccc2[nH]ccc21	ZINC001087305798	1359390979	/nfs/dbraw/zinc/39/09/79/1359390979.db2.gz	YUBGTEZNHKLBMS-NZSAHSFTSA-N	0	3	335.451	3.020	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccsc3Cl)C(C)(C)[C@@H]21	ZINC001087306790	1359393853	/nfs/dbraw/zinc/39/38/53/1359393853.db2.gz	OLWCUMKLYNUPOL-MRVWCRGKSA-N	0	3	336.888	3.254	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc(CC)c(CC)o3)C(C)(C)[C@H]21	ZINC001087314482	1359403397	/nfs/dbraw/zinc/40/33/97/1359403397.db2.gz	LPUZHJYYKWRCDS-MNEFBYGVSA-N	0	3	342.483	3.256	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3sc(C)nc3C)C(C)(C)[C@@H]21	ZINC001087315925	1359405647	/nfs/dbraw/zinc/40/56/47/1359405647.db2.gz	KHKKNDIZKBUOLW-DJIMGWMZSA-N	0	3	345.512	3.002	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc4c(s3)CCC4)C(C)(C)[C@@H]21	ZINC001087316864	1359407734	/nfs/dbraw/zinc/40/77/34/1359407734.db2.gz	YNXTXKRDENPNIF-ZTFGCOKTSA-N	0	3	342.508	3.089	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc4cnccc43)C(C)(C)[C@@H]21	ZINC001087317689	1359408975	/nfs/dbraw/zinc/40/89/75/1359408975.db2.gz	LJEGOGWKGDBQQF-VAMGGRTRSA-N	0	3	347.462	3.087	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(C)c(C)s3)C(C)(C)[C@H]21	ZINC001087317423	1359408984	/nfs/dbraw/zinc/40/89/84/1359408984.db2.gz	HZUBMWQDNIIRTN-OIISXLGYSA-N	0	3	330.497	3.217	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)Cc3ccc(C)s3)C(C)(C)[C@@H]21	ZINC001087318278	1359409977	/nfs/dbraw/zinc/40/99/77/1359409977.db2.gz	UVUNSLNTORDEFB-BHIYHBOVSA-N	0	3	344.524	3.228	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)C3CCC=CCC3)C(C)(C)[C@H]21	ZINC001087319984	1359412092	/nfs/dbraw/zinc/41/20/92/1359412092.db2.gz	XEKWFNYVNHWLSI-QRVBRYPASA-N	0	3	328.500	3.361	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1Cc1cncs1	ZINC001087378214	1359438983	/nfs/dbraw/zinc/43/89/83/1359438983.db2.gz	KNLADLZAAOGYKB-LLLHUVSDSA-N	0	3	345.512	3.024	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)[C@@H]2CC=CCC2)C1	ZINC001087421004	1359458756	/nfs/dbraw/zinc/45/87/56/1359458756.db2.gz	IHBWDZVSZBDJIO-NJDAHSKKSA-N	0	3	336.479	3.340	20	30		EGEDHN
C=CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)c2cc(C#N)c[nH]2)C1	ZINC001087424851	1359460298	/nfs/dbraw/zinc/46/02/98/1359460298.db2.gz	SCFZIRJXWATWCC-UYAOXDASSA-N	0	3	348.450	3.050	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)c2ccc(C#N)[nH]2)CCN1C/C=C/c1ccccc1	ZINC001087546067	1359525530	/nfs/dbraw/zinc/52/55/30/1359525530.db2.gz	OBZFYBCLXSLBDW-ULXJXQFFSA-N	0	3	348.450	3.182	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)C2(c3cccnc3)CCCC2)[C@H]1CC	ZINC001087704528	1359600194	/nfs/dbraw/zinc/60/01/94/1359600194.db2.gz	YQDDFMJBEDXUGU-ZWKOTPCHSA-N	0	3	327.472	3.049	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)[C@@H]2OCC[C@@H]2c2ccccc2)[C@H]1CC	ZINC001087758165	1359631166	/nfs/dbraw/zinc/63/11/66/1359631166.db2.gz	FAQYQYKMEMJJEG-IYWMVGAKSA-N	0	3	342.483	3.104	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2csc(C(F)(F)F)n2)[C@H]1CC	ZINC001087783942	1359642242	/nfs/dbraw/zinc/64/22/42/1359642242.db2.gz	CFUKAXMVCIRFCI-CMPLNLGQSA-N	0	3	347.406	3.321	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2cc3c(s2)CC[C@@H](C)C3)[C@H]1CC	ZINC001087825302	1359666215	/nfs/dbraw/zinc/66/62/15/1359666215.db2.gz	ZSXQRPWZHMKWBP-HYVNUMGLSA-N	0	3	344.524	3.479	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CCN(Cc3scnc3C)C[C@H]2C1	ZINC001088064851	1359739921	/nfs/dbraw/zinc/73/99/21/1359739921.db2.gz	YBWILULCUOJZSH-CVEARBPZSA-N	0	3	347.528	3.334	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CCN(Cc4ccc(C#N)cc4)C[C@H]3C2)C1	ZINC001088098421	1359755587	/nfs/dbraw/zinc/75/55/87/1359755587.db2.gz	ILYIDRZHQQKTJN-UXHICEINSA-N	0	3	349.478	3.195	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3[nH]c4ccc(C)cc4c3C)C[C@@H]2C1	ZINC001088157001	1359775165	/nfs/dbraw/zinc/77/51/65/1359775165.db2.gz	RERTZHSQKIUVDQ-MSOLQXFVSA-N	0	3	349.478	3.202	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)[C@]3(C)CCC(C)=C(C)C3)C[C@@H]2C1	ZINC001088216799	1359799444	/nfs/dbraw/zinc/79/94/44/1359799444.db2.gz	ZTSATXOOEXZZPF-SVFBPWRDSA-N	0	3	328.500	3.317	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](CNCc2ncc(C)s2)[C@@H](C)C1	ZINC001184232120	1387417099	/nfs/dbraw/zinc/41/70/99/1387417099.db2.gz	RKLVUWUALCGWFJ-DOTOQJQBSA-N	0	3	347.528	3.219	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)CCc2cncc(C)c2)C1	ZINC001088345817	1359832917	/nfs/dbraw/zinc/83/29/17/1359832917.db2.gz	YSESEHFNFOXGAD-GOSISDBHSA-N	0	3	349.906	3.436	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)CC2CC(OCC)C2)C1	ZINC001088367327	1359851698	/nfs/dbraw/zinc/85/16/98/1359851698.db2.gz	HOAMGEWXOGSREJ-AQFXKWCLSA-N	0	3	342.911	3.305	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)CCc2cncs2)C1	ZINC001088381183	1359865020	/nfs/dbraw/zinc/86/50/20/1359865020.db2.gz	YZYLSCLBWLEIOC-AWEZNQCLSA-N	0	3	341.908	3.189	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2coc(C3CC3)n2)C1	ZINC001088394561	1359870941	/nfs/dbraw/zinc/87/09/41/1359870941.db2.gz	JJIWJYHIARLNGM-AWEZNQCLSA-N	0	3	337.851	3.279	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2cc(Cl)no2)C1	ZINC001088416363	1359885683	/nfs/dbraw/zinc/88/56/83/1359885683.db2.gz	LPXFJAQBXRGFRX-LLVKDONJSA-N	0	3	332.231	3.055	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1CCCCC[C@@H](NCC(=C)Cl)C1	ZINC001088418514	1359888722	/nfs/dbraw/zinc/88/87/22/1359888722.db2.gz	QRXCABDAQNFILF-LJQANCHMSA-N	0	3	344.886	3.324	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)[C@@H](C)C2CCOCC2)C1	ZINC001088435740	1359903657	/nfs/dbraw/zinc/90/36/57/1359903657.db2.gz	NVILOBSZZZQUSX-RDJZCZTQSA-N	0	3	342.911	3.162	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](CNCc2csc(CC)n2)[C@H](C)C1	ZINC001184313162	1387427747	/nfs/dbraw/zinc/42/77/47/1387427747.db2.gz	XGQMQNVBRRKZJA-HZPDHXFCSA-N	0	3	347.528	3.083	20	30		EGEDHN
C=CCCN1CC[C@H](NC(=O)c2cnc(-c3ccccc3)o2)[C@H]1C	ZINC001088642983	1360000590	/nfs/dbraw/zinc/00/05/90/1360000590.db2.gz	JADOORJCLOBBFT-ZBFHGGJFSA-N	0	3	325.412	3.110	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2cc(C3CC3)oc2C2CC2)[C@H]1C	ZINC001088762491	1360034174	/nfs/dbraw/zinc/03/41/74/1360034174.db2.gz	CVFRVRUSVSMEOG-DYVFJYSZSA-N	0	3	326.440	3.250	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2c(Cl)oc3ccccc32)[C@H]1C	ZINC001088809075	1360058892	/nfs/dbraw/zinc/05/88/92/1360058892.db2.gz	DRWBNCDQCCWWKH-OCCSQVGLSA-N	0	3	330.815	3.302	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)[C@]2(C)CCCc3ccccc32)[C@H]1C	ZINC001088920586	1360102983	/nfs/dbraw/zinc/10/29/83/1360102983.db2.gz	NCRQXXOMYXWNIT-LKUPVBHCSA-N	0	3	326.484	3.436	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccc(OC)c(C3CC3)c2)[C@H]1C	ZINC001088948049	1360111239	/nfs/dbraw/zinc/11/12/39/1360111239.db2.gz	JDRYCTQMCDIVMY-KDOFPFPSSA-N	0	3	328.456	3.341	20	30		EGEDHN
CS[C@@H](C)C(=O)N1CCCC[C@H]1CN(C)Cc1ccc(C#N)cc1	ZINC001089124541	1360187998	/nfs/dbraw/zinc/18/79/98/1360187998.db2.gz	ZXYJEWQXLAJDID-YJBOKZPZSA-N	0	3	345.512	3.123	20	30		EGEDHN
C[C@H](C(=O)N1CCCC[C@H]1CN(C)Cc1ccc(C#N)cc1)C1CC1	ZINC001089147626	1360202686	/nfs/dbraw/zinc/20/26/86/1360202686.db2.gz	AYCLTTIRXHQVHX-JXFKEZNVSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N1CCCC[C@H]1CN(C)Cc1ccccc1	ZINC001089228791	1360269727	/nfs/dbraw/zinc/26/97/27/1360269727.db2.gz	NPVJAMQFAQCSAZ-ZCNNSNEGSA-N	0	3	342.483	3.091	20	30		EGEDHN
Cc1csc(CNC[C@H]2CCN(C(=O)C#CC(C)(C)C)C[C@@H]2C)n1	ZINC001184385696	1387445393	/nfs/dbraw/zinc/44/53/93/1387445393.db2.gz	DHOMKEYVSDXRMX-GOEBONIOSA-N	0	3	347.528	3.075	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(C)nc2C2CC2)CC(C)(C)C1	ZINC001089449088	1360437736	/nfs/dbraw/zinc/43/77/36/1360437736.db2.gz	HPAZAPYOCQHEHW-KRWDZBQOSA-N	0	3	339.483	3.121	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc3ncccc3s2)CC(C)(C)C1	ZINC001089459361	1360445837	/nfs/dbraw/zinc/44/58/37/1360445837.db2.gz	URDIPKIROFGJDS-CQSZACIVSA-N	0	3	341.480	3.150	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cccc(Cl)c2F)CC(C)(C)C1	ZINC001089476853	1360459646	/nfs/dbraw/zinc/45/96/46/1360459646.db2.gz	RTWJIRZTQLXZCB-ZDUSSCGKSA-N	0	3	336.838	3.333	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(Cl)c(OC)c2)CC(C)(C)C1	ZINC001089510212	1360481366	/nfs/dbraw/zinc/48/13/66/1360481366.db2.gz	OTQLAIJKWCWUSC-HNNXBMFYSA-N	0	3	348.874	3.202	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C(C)(C)c2ccccc2F)CC(C)(C)C1	ZINC001089520420	1360487897	/nfs/dbraw/zinc/48/78/97/1360487897.db2.gz	VURRXAUZFSQJON-MRXNPFEDSA-N	0	3	344.474	3.343	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc3cccnc3c2)CC(C)(C)C1	ZINC001089520884	1360488833	/nfs/dbraw/zinc/48/88/33/1360488833.db2.gz	BSKBOCCKJSGBJT-GOSISDBHSA-N	0	3	335.451	3.088	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(C/C=C\Cl)CC(C)(C)C2)nc1	ZINC001089544470	1360499889	/nfs/dbraw/zinc/49/98/89/1360499889.db2.gz	SUEFYGYDIGXFTF-MEMKZHQFSA-N	0	3	345.874	3.036	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(C/C=C/Cl)CC(C)(C)C2)nc1	ZINC001089544471	1360500050	/nfs/dbraw/zinc/50/00/50/1360500050.db2.gz	SUEFYGYDIGXFTF-RDTXFTJFSA-N	0	3	345.874	3.036	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc(C)c(CC)s2)CC(C)(C)C1	ZINC001089555455	1360505674	/nfs/dbraw/zinc/50/56/74/1360505674.db2.gz	KWBHJIRIAAAALZ-OAHLLOKOSA-N	0	3	332.513	3.473	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2csc(C3CC3)n2)CC(C)(C)C1	ZINC001089568752	1360513893	/nfs/dbraw/zinc/51/38/93/1360513893.db2.gz	OKEHXVACXSYGDB-HNNXBMFYSA-N	0	3	345.512	3.264	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cnc(C(C)C)s2)CC(C)(C)C1	ZINC001089569500	1360514615	/nfs/dbraw/zinc/51/46/15/1360514615.db2.gz	DFZBGNNTRQFDAB-AWEZNQCLSA-N	0	3	333.501	3.120	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C23CC(C(C)(C)C)(C2)C3)CC(C)(C)C1	ZINC001089568970	1360514682	/nfs/dbraw/zinc/51/46/82/1360514682.db2.gz	PNDQJVSCQUWGRI-YMTQGWHGSA-N	0	3	330.516	3.443	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(C2CC2)n(C)n1	ZINC001089648876	1360562203	/nfs/dbraw/zinc/56/22/03/1360562203.db2.gz	UJMXLAVYXZPSAC-INIZCTEOSA-N	0	3	344.503	3.094	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccsc1COC	ZINC001089659386	1360570751	/nfs/dbraw/zinc/57/07/51/1360570751.db2.gz	ZIKKYYPTMSLHSD-HNNXBMFYSA-N	0	3	348.512	3.138	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H]1CCCc2cccnc21	ZINC001089684930	1360590624	/nfs/dbraw/zinc/59/06/24/1360590624.db2.gz	VUTPPSWXTUEFKZ-ZWKOTPCHSA-N	0	3	341.499	3.294	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)[C@H]1Cc2ccc(F)cc21	ZINC001089687373	1360593355	/nfs/dbraw/zinc/59/33/55/1360593355.db2.gz	IYDFYJRMVDOXRJ-WMZOPIPTSA-N	0	3	330.447	3.258	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc2ncccc2c1	ZINC001089690456	1360596386	/nfs/dbraw/zinc/59/63/86/1360596386.db2.gz	QHBPOIKCVDSSDY-LJQANCHMSA-N	0	3	349.478	3.479	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cnoc1C(C)C	ZINC001089720415	1360622253	/nfs/dbraw/zinc/62/22/53/1360622253.db2.gz	WOYBOOQOUCGBAK-HNNXBMFYSA-N	0	3	331.460	3.042	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cncnc1C1CC1	ZINC001089729452	1360632863	/nfs/dbraw/zinc/63/28/63/1360632863.db2.gz	OFHMYMZWECULKJ-MRXNPFEDSA-N	0	3	342.487	3.151	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1[nH]nc2ccccc21	ZINC001089731477	1360635092	/nfs/dbraw/zinc/63/50/92/1360635092.db2.gz	RDRFPCSVRGQWKB-OAHLLOKOSA-N	0	3	340.471	3.359	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(C)n(C)c1C	ZINC001089731488	1360635436	/nfs/dbraw/zinc/63/54/36/1360635436.db2.gz	RGAWYGXHZNAWHE-KRWDZBQOSA-N	0	3	331.504	3.438	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1cc(C)oc1C	ZINC001089769316	1360657189	/nfs/dbraw/zinc/65/71/89/1360657189.db2.gz	KNQINJIPUUBFLR-HPBDAGMYSA-N	0	3	348.874	3.431	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)Cc1ccccc1	ZINC001089825287	1360682244	/nfs/dbraw/zinc/68/22/44/1360682244.db2.gz	AXMRPLKVGTUAPG-MANSERQUSA-N	0	3	344.886	3.150	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)c2ccc(CC)o2)C1	ZINC001089826671	1360682678	/nfs/dbraw/zinc/68/26/78/1360682678.db2.gz	JUFZTTWATXDKQX-HJWJTTGWSA-N	0	3	348.874	3.377	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)C2(C)CC=CC2)C1	ZINC001089860434	1360704825	/nfs/dbraw/zinc/70/48/25/1360704825.db2.gz	WTHJKBHLTAKUGG-QAETUUGQSA-N	0	3	334.891	3.264	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](CNCc2nccs2)[C@@H](C)C1	ZINC001184488705	1387470164	/nfs/dbraw/zinc/47/01/64/1387470164.db2.gz	XURGKKMBUQITHB-GJZGRUSLSA-N	0	3	335.517	3.320	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CC2CCCCC2)CC2(CCOCC2)C1	ZINC001089922293	1360746297	/nfs/dbraw/zinc/74/62/97/1360746297.db2.gz	JGOPLCTXKMUTPB-GOSISDBHSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](CNCc2ncc(C)s2)[C@@H](C)C1	ZINC001184497995	1387473213	/nfs/dbraw/zinc/47/32/13/1387473213.db2.gz	OHOAQVKVEJVILW-GOEBONIOSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C1CCC(C(=O)NCC2CC(NCc3c(C)nsc3C)C2)CC1	ZINC001091216034	1361010201	/nfs/dbraw/zinc/01/02/01/1361010201.db2.gz	RRNLDXQVXVDOEC-UHFFFAOYSA-N	0	3	347.528	3.491	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)[C@H]2CCC(C)(C)C2)C1	ZINC001091217570	1361011197	/nfs/dbraw/zinc/01/11/97/1361011197.db2.gz	BKEUKWSCFRBGHN-MOKVOYLWSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H]2CCc3ccccc3C2)C1	ZINC001091257201	1361023886	/nfs/dbraw/zinc/02/38/86/1361023886.db2.gz	GYVWKHILHHVJMH-ZCDVPAHGSA-N	0	3	332.875	3.028	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc([C@@H](C)CC)no2)C1	ZINC001091270081	1361026960	/nfs/dbraw/zinc/02/69/60/1361026960.db2.gz	LEDGYMFPRJPSHP-PKSQDBQZSA-N	0	3	325.840	3.039	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc(C)n(CC3CC3)c2C)C1	ZINC001091323878	1361044903	/nfs/dbraw/zinc/04/49/03/1361044903.db2.gz	QDWSZHVLZKBJEB-UHFFFAOYSA-N	0	3	349.906	3.365	20	30		EGEDHN
C[C@@]12CN(Cc3cccc(C#N)c3)C[C@@H]1CN(C(=O)C[C@H]1C=CCC1)C2	ZINC001091465998	1361108788	/nfs/dbraw/zinc/10/87/88/1361108788.db2.gz	YBSRUODQIQMBBF-WEYGHZABSA-N	0	3	349.478	3.195	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)Cc3cccc(C(C)C)c3)C[C@]2(C)C1	ZINC001091819941	1361227958	/nfs/dbraw/zinc/22/79/58/1361227958.db2.gz	OVZAJADUADYFAC-IRLDBZIGSA-N	0	3	338.495	3.156	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3c(C)cccc3Cl)C[C@]2(C)C1	ZINC001091978507	1361264878	/nfs/dbraw/zinc/26/48/78/1361264878.db2.gz	UIFMYCBECWCZST-BEFAXECRSA-N	0	3	330.859	3.066	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)NC[C@@H]1CN(CC#Cc2cccc(Cl)c2)C[C@H]1C	ZINC001092893287	1361479989	/nfs/dbraw/zinc/47/99/89/1361479989.db2.gz	ZKMVZIWWSGFELC-MGTHKWJCSA-N	0	3	344.886	3.032	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@]23C[C@H]2CCCC3)CC1	ZINC001093378445	1361589380	/nfs/dbraw/zinc/58/93/80/1361589380.db2.gz	OFNFELBIFCXCLV-XQBPLPMBSA-N	0	3	340.511	3.293	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cccc(Cl)c3C)CCC[C@@H]12	ZINC001094423403	1361795920	/nfs/dbraw/zinc/79/59/20/1361795920.db2.gz	REGVEICHFLAFBO-IEBWSBKVSA-N	0	3	330.859	3.256	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3ccc(F)cc3Cl)CCC[C@@H]12	ZINC001094573804	1361866088	/nfs/dbraw/zinc/86/60/88/1361866088.db2.gz	LCGQZYWAGJEATB-SJLPKXTDSA-N	0	3	334.822	3.087	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cc(C)c(F)c(C)c3)CCC[C@@H]12	ZINC001094581184	1361869458	/nfs/dbraw/zinc/86/94/58/1361869458.db2.gz	QIZIPOSGYSRWQB-YLJYHZDGSA-N	0	3	328.431	3.050	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1C[C@H]2C[C@@H](C1)N(C(=O)C1(C3CC3)CC1)C2	ZINC001094943825	1361954487	/nfs/dbraw/zinc/95/44/87/1361954487.db2.gz	KCYKBBWBNGVMHC-YSSFQJQWSA-N	0	3	349.478	3.218	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](NCc2c(C)nsc2C)C1	ZINC001184889952	1387554995	/nfs/dbraw/zinc/55/49/95/1387554995.db2.gz	DTRCJHDVGOKMBR-MRXNPFEDSA-N	0	3	333.501	3.034	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cccc3scnc31)C2	ZINC001095406960	1362130642	/nfs/dbraw/zinc/13/06/42/1362130642.db2.gz	ASSDOYPRGNWUPY-SNPRPXQTSA-N	0	3	327.453	3.208	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H]1CCCC[C@@H]1C(F)(F)F)C2	ZINC001095621890	1362187580	/nfs/dbraw/zinc/18/75/80/1362187580.db2.gz	AHCNWGYTMMNBLO-OWYFMNJBSA-N	0	3	342.405	3.100	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cn(CC)c3ccccc13)C2	ZINC001095722129	1362212354	/nfs/dbraw/zinc/21/23/54/1362212354.db2.gz	PRSVEKWXZGTZMI-BPAFIMBUSA-N	0	3	335.451	3.020	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H]1CCc3cc(F)ccc31)C2	ZINC001095772691	1362224908	/nfs/dbraw/zinc/22/49/08/1362224908.db2.gz	AWPYRQSTGCJFHX-BVBHFADKSA-N	0	3	328.431	3.153	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc3ccc(OC)cc3[nH]1)C2	ZINC001095849753	1362253818	/nfs/dbraw/zinc/25/38/18/1362253818.db2.gz	DJELHZLAHZGLOB-LJHODMEESA-N	0	3	339.439	3.088	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1nc(Cl)cs1)C2	ZINC001095920478	1362287890	/nfs/dbraw/zinc/28/78/90/1362287890.db2.gz	ZQMMXNZANMIYCQ-WOPDTQHZSA-N	0	3	325.865	3.098	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cnccc1C(F)(F)F)C2	ZINC001096068231	1362364898	/nfs/dbraw/zinc/36/48/98/1362364898.db2.gz	LYIZGTQMUVUXCW-UGFHNGPFSA-N	0	3	339.361	3.012	20	30		EGEDHN
C[C@H]1CN(C(=O)CCCF)CC[C@H]1CNCc1cc(F)ccc1C#N	ZINC001184955293	1387572097	/nfs/dbraw/zinc/57/20/97/1387572097.db2.gz	CYSXORLQQGFGMT-HOCLYGCPSA-N	0	3	349.425	3.021	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](CNCc2csc(C)n2)[C@@H](C)C1	ZINC001184967823	1387575826	/nfs/dbraw/zinc/57/58/26/1387575826.db2.gz	MBJSWJRDWSOEDF-DOTOQJQBSA-N	0	3	347.528	3.219	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](C)c1ccc(F)cc1F)C2	ZINC001096577972	1362585476	/nfs/dbraw/zinc/58/54/76/1362585476.db2.gz	IRWQPJDWVLWSDQ-YENGBRFLSA-N	0	3	334.410	3.366	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1ccc(OC(C)C)cc1)C2	ZINC001096593272	1362590230	/nfs/dbraw/zinc/59/02/30/1362590230.db2.gz	LQJROBPPYLKGNQ-HOJAQTOUSA-N	0	3	342.483	3.314	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)CC1CC(c3ccccc3)C1)C2	ZINC001097379066	1362960806	/nfs/dbraw/zinc/96/08/06/1362960806.db2.gz	RTYKJXAHDDLGOA-CEFRSTGISA-N	0	3	336.479	3.315	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc3ccc(OC)cc3[nH]1)C2	ZINC001097622397	1363078793	/nfs/dbraw/zinc/07/87/93/1363078793.db2.gz	DJELHZLAHZGLOB-BJZITVGISA-N	0	3	339.439	3.088	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3C[C@H]2CC(C)(C)CO2)CC1	ZINC001097788849	1363121738	/nfs/dbraw/zinc/12/17/38/1363121738.db2.gz	LHUOCNAAPBBPTQ-MKXGPGLRSA-N	0	3	346.515	3.269	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@]1(C)CCCc3ccccc31)C2	ZINC001098041735	1363205674	/nfs/dbraw/zinc/20/56/74/1363205674.db2.gz	DLIPOQMPISZCPX-PBVWOCPUSA-N	0	3	336.479	3.025	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](CNCc3nccs3)[C@H](C)C2)CCC1	ZINC001185095815	1387617711	/nfs/dbraw/zinc/61/77/11/1387617711.db2.gz	TXKOVORUJASVHA-HZPDHXFCSA-N	0	3	347.528	3.464	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1coc3ccc(Cl)cc13)C2	ZINC001098299871	1363289683	/nfs/dbraw/zinc/28/96/83/1363289683.db2.gz	ZXIZBNLQHFQETI-XYPHTWIQSA-N	0	3	342.826	3.445	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](C)c1cccc(Cl)c1)C2	ZINC001098443201	1363327229	/nfs/dbraw/zinc/32/72/29/1363327229.db2.gz	FSAYTKINORNDON-PILAGYSTSA-N	0	3	330.859	3.188	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H]1CCCCc3ccccc31)C2	ZINC001098470180	1363335686	/nfs/dbraw/zinc/33/56/86/1363335686.db2.gz	GXKLHOPTSGJPOF-PMXSJFBMSA-N	0	3	336.479	3.241	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H]1CCCC3(CC3)C1)C[C@H](C)O2	ZINC001098600351	1363394218	/nfs/dbraw/zinc/39/42/18/1363394218.db2.gz	ZFJQARHLOBKVGQ-ZWKOTPCHSA-N	0	3	346.515	3.225	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1CCC=CCCC1)C[C@@H](C)O2	ZINC001098606354	1363396593	/nfs/dbraw/zinc/39/65/93/1363396593.db2.gz	QOHSUBJMSLRZFL-MOPGFXCFSA-N	0	3	346.515	3.391	20	30		EGEDHN
C/C=C(/C)C(=O)N1CC[C@H](n2cc(CNCCCCCCC)nn2)C1	ZINC001098650114	1363416831	/nfs/dbraw/zinc/41/68/31/1363416831.db2.gz	YKDNDDBBMGDURS-UUGSPAKMSA-N	0	3	347.507	3.078	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1CCC=CCC1)C[C@@H](C)O2	ZINC001098659997	1363423406	/nfs/dbraw/zinc/42/34/06/1363423406.db2.gz	PGVDVSYINCBJGQ-QGZVFWFLSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1CC3CCC1CC3)C[C@H](C)O2	ZINC001098663186	1363425200	/nfs/dbraw/zinc/42/52/00/1363425200.db2.gz	YKIMFBJBHIOROT-RGVPCPSESA-N	0	3	346.515	3.081	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)Cc2coc3ccc(C)cc23)C1	ZINC001098859682	1363495133	/nfs/dbraw/zinc/49/51/33/1363495133.db2.gz	UQHJQRMZCPFGNW-UWJYYQICSA-N	0	3	338.451	3.440	20	30		EGEDHN
C=CCCCN1CC(C)(C)CC[C@H]1CNC(=O)c1snnc1C	ZINC001098873101	1363500420	/nfs/dbraw/zinc/50/04/20/1363500420.db2.gz	JOZRJJJVAFWYRW-AWEZNQCLSA-N	0	3	336.505	3.033	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(-c3cnco3)cc2)C1	ZINC001098903090	1363512723	/nfs/dbraw/zinc/51/27/23/1363512723.db2.gz	AOOSDHFNMLMVHT-PXNSSMCTSA-N	0	3	337.423	3.112	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H]2CCCc3ccccc32)C1	ZINC001098903547	1363512979	/nfs/dbraw/zinc/51/29/79/1363512979.db2.gz	UCVUIFUBKZRAAL-VCOUNFBDSA-N	0	3	336.479	3.101	20	30		EGEDHN
C=CCCC(=O)NC[C@H]1CCC(C)(C)CN1Cc1ccc(CO)cc1	ZINC001098966877	1363545508	/nfs/dbraw/zinc/54/55/08/1363545508.db2.gz	VVIVAEPTIBMCKK-LJQANCHMSA-N	0	3	344.499	3.252	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@H]1CCC(C)(C)CN1CCOCC1CCC1	ZINC001099064667	1363603493	/nfs/dbraw/zinc/60/34/93/1363603493.db2.gz	GXOPDNRHUMBNGE-LJQANCHMSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)C(C)(C)n1cnc(C)c1	ZINC001099121721	1363635578	/nfs/dbraw/zinc/63/55/78/1363635578.db2.gz	NRHKTUZGMVURMU-KRWDZBQOSA-N	0	3	346.519	3.110	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)C2CCC(C(F)F)CC2)C1	ZINC001099141732	1363651136	/nfs/dbraw/zinc/65/11/36/1363651136.db2.gz	HCAMHEUJCYNAOL-GULCKSEBSA-N	0	3	326.431	3.215	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)C1(C2CC2)CCC1	ZINC001099158224	1363661487	/nfs/dbraw/zinc/66/14/87/1363661487.db2.gz	DGGXFUKKMKUTDJ-GOSISDBHSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@H]1CCC(C)(C)CN1CCn1cccn1	ZINC001099171458	1363669365	/nfs/dbraw/zinc/66/93/65/1363669365.db2.gz	QAOYAFZPZRMUJZ-QGZVFWFLSA-N	0	3	346.519	3.092	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H](C)c2cccc(Cl)c2)C1	ZINC001099172074	1363669748	/nfs/dbraw/zinc/66/97/48/1363669748.db2.gz	QSXKKNQOWLGBRG-KNBMTAEXSA-N	0	3	344.886	3.438	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)C[C@@H](C)c1cccnc1	ZINC001099258488	1363719283	/nfs/dbraw/zinc/71/92/83/1363719283.db2.gz	RIERBVFRISMCOY-SJLPKXTDSA-N	0	3	329.488	3.368	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)Cc1ccccc1COC	ZINC001099263685	1363721529	/nfs/dbraw/zinc/72/15/29/1363721529.db2.gz	IIKCSSURUSJYNN-LJQANCHMSA-N	0	3	344.499	3.168	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2ccc(F)c(F)c2)C[C@H]1C(F)(F)F	ZINC001099264693	1363723131	/nfs/dbraw/zinc/72/31/31/1363723131.db2.gz	PTQFIWWNXVBJNY-BXUZGUMPSA-N	0	3	348.315	3.133	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H](C)c1c(C)noc1C	ZINC001099271364	1363725129	/nfs/dbraw/zinc/72/51/29/1363725129.db2.gz	XEEXFZLSYGJXJB-YOEHRIQHSA-N	0	3	345.487	3.025	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)Cc1ccc(OCC)cc1	ZINC001099328681	1363752940	/nfs/dbraw/zinc/75/29/40/1363752940.db2.gz	HVBXYSYHJGDJBS-GOSISDBHSA-N	0	3	344.499	3.421	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)COc1cccc(F)c1	ZINC001099340749	1363760456	/nfs/dbraw/zinc/76/04/56/1363760456.db2.gz	YHUSVESVVIVCTH-KRWDZBQOSA-N	0	3	348.462	3.387	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2csc(C)n2)C1	ZINC001099473933	1363810900	/nfs/dbraw/zinc/81/09/00/1363810900.db2.gz	KRXWFGQZWJOYSZ-KXBFYZLASA-N	0	3	347.528	3.382	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1(CCC)CC1	ZINC001099529698	1363834490	/nfs/dbraw/zinc/83/44/90/1363834490.db2.gz	UYYCZLPDKDPJDV-YVSFHVDLSA-N	0	3	336.907	3.488	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCCC(C)(C)C)CC2(CCOCC2)C1	ZINC001099571452	1363856056	/nfs/dbraw/zinc/85/60/56/1363856056.db2.gz	IAWPMQXVVIBQKC-QGZVFWFLSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](CNCc2ocnc2C)[C@H](C)C1	ZINC001185224664	1387656268	/nfs/dbraw/zinc/65/62/68/1387656268.db2.gz	GIDHQAUEQXIGPZ-GDBMZVCRSA-N	0	3	333.476	3.160	20	30		EGEDHN
O=C(NCC1CC(NCC#Cc2cccc(Cl)c2)C1)C1=CCCC1	ZINC001100239440	1364054000	/nfs/dbraw/zinc/05/40/00/1364054000.db2.gz	UIBABJRQLVUBCI-UHFFFAOYSA-N	0	3	342.870	3.286	20	30		EGEDHN
CC1(CC(=O)NCC2CC(NCC#Cc3ccccc3)C2)CCCC1	ZINC001100301353	1364072304	/nfs/dbraw/zinc/07/23/04/1364072304.db2.gz	HHQBISCANSLHOW-UHFFFAOYSA-N	0	3	338.495	3.493	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)CC2(C)CCCC2)C1	ZINC001100301552	1364072437	/nfs/dbraw/zinc/07/24/37/1364072437.db2.gz	QVGNCLSWUPVPNV-UHFFFAOYSA-N	0	3	343.309	3.350	20	30		EGEDHN
CC(C)C(C)(C)C(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1	ZINC001100366025	1364093687	/nfs/dbraw/zinc/09/36/87/1364093687.db2.gz	YPYZLSBMPYLXRO-UHFFFAOYSA-N	0	3	345.462	3.364	20	30		EGEDHN
C[C@H](C(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1)C(C)(C)C	ZINC001100448030	1364118975	/nfs/dbraw/zinc/11/89/75/1364118975.db2.gz	FPVSFXGOJFJXKR-LSJNQWAISA-N	0	3	344.474	3.344	20	30		EGEDHN
CC(C)(C)[C@@H]1C[C@H]1C(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100499349	1364137159	/nfs/dbraw/zinc/13/71/59/1364137159.db2.gz	IACFUFVGCCOLBD-NTFDOXNWSA-N	0	3	338.495	3.205	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCC1CC(NCc2oc(CC)nc2C)C1	ZINC001100595013	1364180428	/nfs/dbraw/zinc/18/04/28/1364180428.db2.gz	JYDHPVUQHPIVFF-JEYLPNPQSA-N	0	3	333.476	3.132	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCC1CC(NCc2c(C)nsc2C)C1	ZINC001100594961	1364180455	/nfs/dbraw/zinc/18/04/55/1364180455.db2.gz	ISAWCGULFWNZRZ-JQRITLKVSA-N	0	3	335.517	3.347	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100644785	1364202034	/nfs/dbraw/zinc/20/20/34/1364202034.db2.gz	HYYJQSJEVHEDOX-XTXLOEGASA-N	0	3	342.458	3.264	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H](C)Cc2ccccc2F)C1	ZINC001100674101	1364213408	/nfs/dbraw/zinc/21/34/08/1364213408.db2.gz	MKZBTXOVANHBOY-YGONEPDPSA-N	0	3	338.854	3.241	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)NCC1CC(NCC#Cc2ccccc2Cl)C1	ZINC001100688629	1364219558	/nfs/dbraw/zinc/21/95/58/1364219558.db2.gz	JYGJZQGVSJGOHA-XPJGSDBHSA-N	0	3	344.886	3.222	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](NCc2ccc(Cl)c(OC)c2)C1	ZINC001185305546	1387676167	/nfs/dbraw/zinc/67/61/67/1387676167.db2.gz	UVCLGOXQGNFPFL-OAHLLOKOSA-N	0	3	336.863	3.395	20	30		EGEDHN
C=C(C)CN1CC[C@H](Oc2ccnc(CNC(=O)CCC(C)C)c2)C1	ZINC001101089672	1364407555	/nfs/dbraw/zinc/40/75/55/1364407555.db2.gz	YQNMZOPYEJSMLI-IBGZPJMESA-N	0	3	345.487	3.163	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@H]2CN([C@@H](C)c3ccccc3F)C[C@@]2(C)C1	ZINC001101231324	1364477174	/nfs/dbraw/zinc/47/71/74/1364477174.db2.gz	XZGYIGBXEPNJBF-FVJLSDCUSA-N	0	3	342.458	3.326	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)CCCc3ccc(C)cc3)C[C@]2(C)C1	ZINC001101350174	1364521744	/nfs/dbraw/zinc/52/17/44/1364521744.db2.gz	ZVPYOVBFMONBJR-IRLDBZIGSA-N	0	3	338.495	3.121	20	30		EGEDHN
CCCCCC(C)(C)C(=O)N1C[C@H]2CN(CC#CCOC)C[C@@]2(C)C1	ZINC001101470424	1364574408	/nfs/dbraw/zinc/57/44/08/1364574408.db2.gz	POJJTSRXIJJVQU-NQIIRXRSSA-N	0	3	348.531	3.023	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)N1CCC(C(C)(C)CNCc2ccon2)CC1	ZINC001101564789	1364621712	/nfs/dbraw/zinc/62/17/12/1364621712.db2.gz	GCZSODLEGPKGQP-CVEARBPZSA-N	0	3	347.503	3.487	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1CC2(CN(C[C@H](C)CC)C2)n2ccnc21	ZINC001101630448	1364662482	/nfs/dbraw/zinc/66/24/82/1364662482.db2.gz	HOCUTZKRSMKJKK-CVEARBPZSA-N	0	3	344.503	3.103	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@H]1CC2(CN(CCC(C)C)C2)n2ccnc21	ZINC001101643041	1364667881	/nfs/dbraw/zinc/66/78/81/1364667881.db2.gz	UBWLFRPBVMJHAQ-LPHOPBHVSA-N	0	3	344.503	3.103	20	30		EGEDHN
C#CCCCC(=O)NC[C@@H]1CN(Cc2ccc(Cl)cc2)C[C@H]1C	ZINC001101919237	1364774563	/nfs/dbraw/zinc/77/45/63/1364774563.db2.gz	CRFSDNJVHDNJIP-NVXWUHKLSA-N	0	3	332.875	3.328	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@@H]1CN(Cc2c(C)noc2C)C[C@H]1C	ZINC001102260728	1364973340	/nfs/dbraw/zinc/97/33/40/1364973340.db2.gz	BMRINLQBWSELEB-CKEIUWERSA-N	0	3	333.476	3.078	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001102261158	1364974065	/nfs/dbraw/zinc/97/40/65/1364974065.db2.gz	PPDQFKHWWBIRKP-ARFHVFGLSA-N	0	3	345.512	3.406	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@@H]1CN(Cc2oc(C)nc2C)C[C@H]1C	ZINC001102262551	1364974927	/nfs/dbraw/zinc/97/49/27/1364974927.db2.gz	DLOWYCCAVYIQMH-KBRIMQKVSA-N	0	3	333.476	3.078	20	30		EGEDHN
CC(C)[C@H](C)C(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001102422919	1365047228	/nfs/dbraw/zinc/04/72/28/1365047228.db2.gz	GKOWVIXMLGQYOR-QLFBSQMISA-N	0	3	333.501	3.096	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2cccc(Cl)c2)C[C@H]1CNC(=O)C(C)(C)C	ZINC001102526552	1365099115	/nfs/dbraw/zinc/09/91/15/1365099115.db2.gz	GALWSPCGLGVZMM-NVXWUHKLSA-N	0	3	346.902	3.422	20	30		EGEDHN
C#CCC1(C(=O)NC[C@@H]2CN(C/C=C\Cl)C[C@H]2C)CCCCC1	ZINC001102607588	1365135513	/nfs/dbraw/zinc/13/55/13/1365135513.db2.gz	LQRFJTZGVJRKBU-RVHKNYROSA-N	0	3	336.907	3.397	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1CCNC(=O)C1CCC1	ZINC001102632389	1365144861	/nfs/dbraw/zinc/14/48/61/1365144861.db2.gz	UZKOKIWCYXAVFJ-RDTXWAMCSA-N	0	3	343.446	3.072	20	30		EGEDHN
CC(C)C#CC(=O)NCC[C@@H]1CN(Cc2ccc(F)cc2F)C[C@H]1C	ZINC001102955764	1365315546	/nfs/dbraw/zinc/31/55/46/1365315546.db2.gz	FOUNREWWJZQYLS-HZPDHXFCSA-N	0	3	348.437	3.198	20	30		EGEDHN
CC(C)C#CC(=O)NCC[C@@H]1CN(Cc2cc(F)ccc2F)C[C@H]1C	ZINC001102955780	1365315660	/nfs/dbraw/zinc/31/56/60/1365315660.db2.gz	GQKPAYAVCMNQEE-HZPDHXFCSA-N	0	3	348.437	3.198	20	30		EGEDHN
CC[C@@H](F)C(=O)NCC[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1C	ZINC001103320175	1365491439	/nfs/dbraw/zinc/49/14/39/1365491439.db2.gz	PKJXWVCOFLQMIU-KBRIMQKVSA-N	0	3	349.425	3.020	20	30		EGEDHN
CC[C@@H](C)C(=O)N1C[C@@H](C)[C@H](CCNCc2ccccc2C#N)C1	ZINC001103904345	1365828917	/nfs/dbraw/zinc/82/89/17/1365828917.db2.gz	ABDHAGOLZZOGPE-GPMSIDNRSA-N	0	3	327.472	3.179	20	30		EGEDHN
C[C@@H]1CN(C(=O)C=C2CCC2)C[C@H]1CCNCc1ccccc1C#N	ZINC001104061420	1365894535	/nfs/dbraw/zinc/89/45/35/1365894535.db2.gz	BWEPFNPIXVSAIY-OXQOHEQNSA-N	0	3	337.467	3.243	20	30		EGEDHN
C=C(C)CS(=O)(=O)NC1C[C@H]2CCC[C@@H](C1)N2Cc1ccccc1	ZINC001324785182	1387772195	/nfs/dbraw/zinc/77/21/95/1387772195.db2.gz	ORHQYPKVBNFXDI-YQQQUEKLSA-N	0	3	348.512	3.068	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2c(C)noc2C)C1	ZINC001104091938	1365907747	/nfs/dbraw/zinc/90/77/47/1365907747.db2.gz	FQPAJCRTYVAMEJ-CRAIPNDOSA-N	0	3	345.487	3.059	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](C)[C@H](CCNCc2cnc(C)o2)C1	ZINC001104239834	1365966048	/nfs/dbraw/zinc/96/60/48/1365966048.db2.gz	SMJUFRPAPQPCIF-GDBMZVCRSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2cc(C3CC3)no2)C1	ZINC001104607261	1366099006	/nfs/dbraw/zinc/09/90/06/1366099006.db2.gz	OCYDXRRRLRHZPX-NVXWUHKLSA-N	0	3	345.487	3.483	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2cccnc2OC)C1	ZINC001104606844	1366099400	/nfs/dbraw/zinc/09/94/00/1366099400.db2.gz	FOFQKLOSRRGYBT-SJLPKXTDSA-N	0	3	345.487	3.021	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)C2(C(F)(F)F)CC2)C[C@H]1C	ZINC001104711679	1366139911	/nfs/dbraw/zinc/13/99/11/1366139911.db2.gz	WVSTVNRMPUDPSG-ZYHUDNBSSA-N	0	3	338.801	3.156	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cc(CCC)on2)C[C@H]1C	ZINC001104860731	1366201975	/nfs/dbraw/zinc/20/19/75/1366201975.db2.gz	LWINKVXQCRYEMM-TZMCWYRMSA-N	0	3	339.867	3.067	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2ccc(F)cc2F)C[C@H]1C	ZINC001104969097	1366247444	/nfs/dbraw/zinc/24/74/44/1366247444.db2.gz	IVXGOXKOEJWHHJ-DGCLKSJQSA-N	0	3	342.817	3.405	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cnc(CC)s2)C[C@H]1C	ZINC001105090653	1366320453	/nfs/dbraw/zinc/32/04/53/1366320453.db2.gz	DUQSBPCQWRDZJP-DGCLKSJQSA-N	0	3	341.908	3.146	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC([C@H]2N(C/C=C/Cl)CC23CCC3)CC1	ZINC001105392242	1366440342	/nfs/dbraw/zinc/44/03/42/1366440342.db2.gz	WJYUGRDZYNRHAL-OINDORCXSA-N	0	3	348.918	3.491	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@@H](CNCc2cc(C3CC3)no2)[C@H](C)C1	ZINC001106567758	1366739717	/nfs/dbraw/zinc/73/97/17/1366739717.db2.gz	RVIJADNEBODVCF-BFYDXBDKSA-N	0	3	345.487	3.338	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](CNCc3ncc(C)s3)[C@H](C)C2)CCC1	ZINC001106636225	1366762332	/nfs/dbraw/zinc/76/23/32/1366762332.db2.gz	YYILYLFACRUWHF-GDBMZVCRSA-N	0	3	347.528	3.382	20	30		EGEDHN
CCC[C@@H](C)CC(=O)N1CC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001189281033	1366975444	/nfs/dbraw/zinc/97/54/44/1366975444.db2.gz	WSXCJMFWUPCJPW-VQIMIIECSA-N	0	3	327.472	3.417	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)c1cc(C)sc1-n1cccc1	ZINC001189313899	1366985967	/nfs/dbraw/zinc/98/59/67/1366985967.db2.gz	NPCPWTQUHNGQGW-HNNXBMFYSA-N	0	3	329.469	3.227	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](N(C)CCOc2cc(C)ccc2C)C1	ZINC001189318709	1366988774	/nfs/dbraw/zinc/98/87/74/1366988774.db2.gz	OBFWAOFWIQSZEM-GOSISDBHSA-N	0	3	330.472	3.181	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@]12CCC[C@H]1N(Cc1ccccn1)CC2	ZINC001107495080	1366994192	/nfs/dbraw/zinc/99/41/92/1366994192.db2.gz	IUSGANNIVUXNBZ-YLJYHZDGSA-N	0	3	327.472	3.155	20	30		EGEDHN
C=CCOCCCC(=O)N1CC[C@H](N(C)C/C=C\c2ccccc2)C1	ZINC001189564637	1367055730	/nfs/dbraw/zinc/05/57/30/1367055730.db2.gz	FOPKGLSSFIKFFC-QRGKHIHXSA-N	0	3	342.483	3.215	20	30		EGEDHN
CC(C)(C)C(=O)NC[C@]12CCC[C@H]1N(CC#Cc1ccccc1)CC2	ZINC001107617190	1367076423	/nfs/dbraw/zinc/07/64/23/1367076423.db2.gz	WLSVEKGTSALSQN-DENIHFKCSA-N	0	3	338.495	3.445	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](N(C)Cc2ccc(OC)c(C)c2)C1	ZINC001189744240	1367100093	/nfs/dbraw/zinc/10/00/93/1367100093.db2.gz	PEBWIJLZHBCFBW-IBGZPJMESA-N	0	3	342.483	3.230	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](N(C)CCc2ccccc2F)C1	ZINC001189744560	1367100571	/nfs/dbraw/zinc/10/05/71/1367100571.db2.gz	VIFNNLMVHOENEU-SFHVURJKSA-N	0	3	330.447	3.095	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2sccc2C)C1	ZINC001107698346	1367107644	/nfs/dbraw/zinc/10/76/44/1367107644.db2.gz	OPBBYACYSVIRDY-YJBOKZPZSA-N	0	3	336.501	3.232	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)C(C)=C2CCCC2)C1	ZINC001107859895	1367179448	/nfs/dbraw/zinc/17/94/48/1367179448.db2.gz	GKSBHPSQXDKUKV-UZLBHIALSA-N	0	3	334.504	3.439	20	30		EGEDHN
C#CCCCCC(=O)NC[C@]1(C)CN(CC2CCC(C)CC2)CCO1	ZINC001107882712	1367191115	/nfs/dbraw/zinc/19/11/15/1367191115.db2.gz	AJTYEBUQYOQZAJ-GZNCHQMQSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2cscc2C(F)F)C1	ZINC001190213567	1367201096	/nfs/dbraw/zinc/20/10/96/1367201096.db2.gz	MJLMAWXUBKUQEY-LBPRGKRZSA-N	0	3	344.427	3.035	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)C(CC=C)CC=C)C1	ZINC001107965340	1367221431	/nfs/dbraw/zinc/22/14/31/1367221431.db2.gz	VUWWPUSXPPVNED-PXNSSMCTSA-N	0	3	334.504	3.317	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)C(C)(C)C(=C)Cl)C1	ZINC001107971059	1367224719	/nfs/dbraw/zinc/22/47/19/1367224719.db2.gz	NHYFUDJACUUAMT-KDOFPFPSSA-N	0	3	342.911	3.327	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](N(C)CCc2scnc2C)C1	ZINC001190397105	1367252609	/nfs/dbraw/zinc/25/26/09/1367252609.db2.gz	IGOKVTXHMSAEIW-HNNXBMFYSA-N	0	3	335.517	3.129	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](N(C)Cc2cccc(NC(C)=O)c2)C1	ZINC001190421715	1367260775	/nfs/dbraw/zinc/26/07/75/1367260775.db2.gz	BATYGZQYCMDWKI-LJQANCHMSA-N	0	3	343.471	3.034	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2ccc(C)c(F)c2)C1	ZINC001108058289	1367261545	/nfs/dbraw/zinc/26/15/45/1367261545.db2.gz	XVLOFXVJQPVQSE-JXFKEZNVSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](N(C)CCc2c(F)cccc2F)C1	ZINC001190429162	1367262382	/nfs/dbraw/zinc/26/23/82/1367262382.db2.gz	VTHQHFQGXNWCFK-HNNXBMFYSA-N	0	3	336.426	3.396	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CC[C@H](N(C)Cc2ccc(F)cc2)C1)OCC	ZINC001190445543	1367267611	/nfs/dbraw/zinc/26/76/11/1367267611.db2.gz	YLJZCQFWDICDBQ-OALUTQOASA-N	0	3	348.462	3.230	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CC[C@H](N(C)Cc2ccc(F)cc2)C1)OCC	ZINC001190445545	1367268294	/nfs/dbraw/zinc/26/82/94/1367268294.db2.gz	YLJZCQFWDICDBQ-RBUKOAKNSA-N	0	3	348.462	3.230	20	30		EGEDHN
C=CCCCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ocnc1CC)C2	ZINC001109696786	1367285543	/nfs/dbraw/zinc/28/55/43/1367285543.db2.gz	MNBFPUHKNOCFHB-PVAVHDDUSA-N	0	3	331.460	3.319	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@]1(C)CN(CC2CC(C)(C)C2)CCO1	ZINC001108121609	1367291356	/nfs/dbraw/zinc/29/13/56/1367291356.db2.gz	CPTCFJJEPCZZCI-OAQYLSRUSA-N	0	3	348.531	3.213	20	30		EGEDHN
N#Cc1cccc(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)c1F	ZINC001190554752	1367292328	/nfs/dbraw/zinc/29/23/28/1367292328.db2.gz	KTJLBNBEMUABSB-KRWDZBQOSA-N	0	3	337.398	3.092	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@]2(C)CN(CC(CC)CC)CCO2)CCC1	ZINC001108187242	1367330685	/nfs/dbraw/zinc/33/06/85/1367330685.db2.gz	CVMHRIGVAYGOPL-IBGZPJMESA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1oc(CC(C)C)nc1C)C2	ZINC001109819313	1367339622	/nfs/dbraw/zinc/33/96/22/1367339622.db2.gz	DVYVTDNAMDCTBI-IKGGRYGDSA-N	0	3	345.487	3.483	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2c(C)cccc2C)C1	ZINC001108236382	1367353724	/nfs/dbraw/zinc/35/37/24/1367353724.db2.gz	KQJJSGQXJAQSLB-RXVVDRJESA-N	0	3	344.499	3.479	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@@]1(C)CN(C[C@H](C)CC(C)C)CCO1	ZINC001108246782	1367359829	/nfs/dbraw/zinc/35/98/29/1367359829.db2.gz	VECFYHZNMPCTIO-XLIONFOSSA-N	0	3	338.536	3.478	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2c[nH]cc2C2CC2)C1	ZINC001108313644	1367387374	/nfs/dbraw/zinc/38/73/74/1367387374.db2.gz	DWUJWIMDNSHYHG-MGPUTAFESA-N	0	3	345.487	3.068	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3CC/C=C\CCC)nc1	ZINC001109997555	1367451634	/nfs/dbraw/zinc/45/16/34/1367451634.db2.gz	AYZZSOCOSIGUAW-HNMRIYCXSA-N	0	3	337.467	3.144	20	30		EGEDHN
CCCCCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ncccc1OC)C2	ZINC001110032374	1367469919	/nfs/dbraw/zinc/46/99/19/1367469919.db2.gz	FZLMJEUKCPPWRW-IKGGRYGDSA-N	0	3	345.487	3.396	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCC1CCCCC1)C2	ZINC001110056809	1367487430	/nfs/dbraw/zinc/48/74/30/1367487430.db2.gz	MNVKHHRCISHOEI-QYZOEREBSA-N	0	3	334.504	3.271	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCOc1cccc(C)c1)C2	ZINC001110096541	1367502524	/nfs/dbraw/zinc/50/25/24/1367502524.db2.gz	QSHARFWERMLKIO-NEWSRXKRSA-N	0	3	328.456	3.062	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](C)Cc1ccccc1C)C2	ZINC001110174109	1367545404	/nfs/dbraw/zinc/54/54/04/1367545404.db2.gz	MQRSVUIZIMEQEL-RNQOJCNYSA-N	0	3	326.484	3.471	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccc(C)cc1C	ZINC001110184789	1367552922	/nfs/dbraw/zinc/55/29/22/1367552922.db2.gz	WXPVUCDVMURUNH-RNQOJCNYSA-N	0	3	342.483	3.116	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3C[C@@H]2CCCCO2)CCCC1	ZINC001110214523	1367569205	/nfs/dbraw/zinc/56/92/05/1367569205.db2.gz	LDFBDFNTVIVMAP-XWSJACJDSA-N	0	3	346.515	3.414	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](N(C)CCOc2cccc(C)c2)C1	ZINC001191727092	1367571426	/nfs/dbraw/zinc/57/14/26/1367571426.db2.gz	FUHGQTCAVHWFBT-QGZVFWFLSA-N	0	3	330.472	3.119	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](N(C)CCOc2ccccc2C)C1	ZINC001191726837	1367571544	/nfs/dbraw/zinc/57/15/44/1367571544.db2.gz	CRVHWZXWRLRJJE-QGZVFWFLSA-N	0	3	330.472	3.119	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](N(C)Cc2cc(F)ccc2C)C1	ZINC001191840713	1367608732	/nfs/dbraw/zinc/60/87/32/1367608732.db2.gz	ZYSHLWBVIOMYIE-IBGZPJMESA-N	0	3	330.447	3.360	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001191867992	1367620106	/nfs/dbraw/zinc/62/01/06/1367620106.db2.gz	MKVKVHMTSUOFHU-APWZRJJASA-N	0	3	325.456	3.193	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@H](N(C)CCOc2ccc(F)cc2)C1	ZINC001191891323	1367628885	/nfs/dbraw/zinc/62/88/85/1367628885.db2.gz	XTLGCQUKJMIIDL-AEFFLSMTSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=CCCC(=O)NC[C@@H]1CN(CC#CC)CC[C@@H]1c1ccc(F)cc1	ZINC001186172239	1387889948	/nfs/dbraw/zinc/88/99/48/1387889948.db2.gz	TWJWMYJQBHVLER-UYAOXDASSA-N	0	3	342.458	3.337	20	30		EGEDHN
Cc1ccccc1[C@@H](C)N1[C@@H]2CC[C@H]1[C@@H](NC(=O)CSCC#N)C2	ZINC001108947043	1367675764	/nfs/dbraw/zinc/67/57/64/1367675764.db2.gz	AZAPPSMVCDFOEA-LMSBXDPUSA-N	0	3	343.496	3.034	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H](N(C)CCOc2ccccc2)C1	ZINC001192162128	1367705667	/nfs/dbraw/zinc/70/56/67/1367705667.db2.gz	MXKUAVAOYJOPAY-PXNSSMCTSA-N	0	3	330.472	3.200	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](N(C)C[C@H]3CC(C)(C)CO3)C2)CCC1	ZINC001192227555	1367724987	/nfs/dbraw/zinc/72/49/87/1367724987.db2.gz	SBQVXLDFJIGXCT-DLBZAZTESA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](N(C)CCOc3ccc(C)cc3)C2)C1	ZINC001192258635	1367732659	/nfs/dbraw/zinc/73/26/59/1367732659.db2.gz	YXFYYXNWLWQQSK-GOSISDBHSA-N	0	3	342.483	3.263	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)C[C@@H](C)c2cccc(F)c2)C1	ZINC001192282480	1367738616	/nfs/dbraw/zinc/73/86/16/1367738616.db2.gz	AFYRNRSHIDXKLR-APWZRJJASA-N	0	3	348.462	3.055	20	30		EGEDHN
CCCCCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1nccc(C)n1)C2	ZINC001110503664	1367791055	/nfs/dbraw/zinc/79/10/55/1367791055.db2.gz	CZDTYIAGXLETOG-ZACQAIPSSA-N	0	3	330.476	3.091	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)[C@@H](c2ccccc2)C(C)C)C1	ZINC001192560643	1367816722	/nfs/dbraw/zinc/81/67/22/1367816722.db2.gz	RRECQFMVFITLDT-VQTJNVASSA-N	0	3	344.499	3.162	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](N(C)Cc2cccc(OC)c2)C1	ZINC001192586060	1367825511	/nfs/dbraw/zinc/82/55/11/1367825511.db2.gz	IAEBJFGWQIFPBW-QGZVFWFLSA-N	0	3	330.472	3.330	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2C[C@H]1CC(C)(C)CO1	ZINC001110603684	1367865619	/nfs/dbraw/zinc/86/56/19/1367865619.db2.gz	OCGJRTKAVVXRGP-VQHPVUNQSA-N	0	3	334.504	3.125	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCOc1cc(C)cc(C)c1)C2	ZINC001110629250	1367875296	/nfs/dbraw/zinc/87/52/96/1367875296.db2.gz	NOTGLKRHAINLOZ-RLLQIKCJSA-N	0	3	342.483	3.370	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)CC2(C=C)CCCCC2)C1	ZINC001192826740	1367883354	/nfs/dbraw/zinc/88/33/54/1367883354.db2.gz	SPJDVCNFELQCRI-SFHVURJKSA-N	0	3	334.504	3.248	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2cccc(C(C)(C)C)c2)C1	ZINC001192998593	1367919597	/nfs/dbraw/zinc/91/95/97/1367919597.db2.gz	LYHHMUUUMGGZRG-LJQANCHMSA-N	0	3	344.499	3.333	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2C[C@H](OC)c1ccccc1	ZINC001110967218	1368127895	/nfs/dbraw/zinc/12/78/95/1368127895.db2.gz	YEVLLVBGDFIFKK-ZRNYENFQSA-N	0	3	342.483	3.452	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](C)CCc1ccccc1F)C2	ZINC001111018218	1368144546	/nfs/dbraw/zinc/14/45/46/1368144546.db2.gz	NGGWIOAPNHQGJK-ZSXHRAQDSA-N	0	3	342.458	3.139	20	30		EGEDHN
C=CCCCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(OC)o1)C2	ZINC001111178551	1368181889	/nfs/dbraw/zinc/18/18/89/1368181889.db2.gz	XQZGNFAITHFCFC-OAGGEKHMSA-N	0	3	332.444	3.370	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N2CC[C@@H](N(C)CC=C(C)C)C2)cc1	ZINC001194337178	1368236344	/nfs/dbraw/zinc/23/63/44/1368236344.db2.gz	PYGTZJKNARREHZ-LJQANCHMSA-N	0	3	342.483	3.293	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](c1ccc(F)cc1)C(C)C)C2	ZINC001111476207	1368316369	/nfs/dbraw/zinc/31/63/69/1368316369.db2.gz	UTZQFCBEJUVWQE-ZRNYENFQSA-N	0	3	342.458	3.310	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@@H](C)c1cccc(OC)c1)C2	ZINC001111479066	1368317353	/nfs/dbraw/zinc/31/73/53/1368317353.db2.gz	DADJTZNTAHKGLV-QOJCHSLYSA-N	0	3	342.483	3.486	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2[C@H](C)c1cccc(C)c1	ZINC001111487509	1368317887	/nfs/dbraw/zinc/31/78/87/1368317887.db2.gz	SLFRPIAHFBKADW-AFYVEPGGSA-N	0	3	342.483	3.370	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1cc(C)ccc1C	ZINC001111488467	1368320288	/nfs/dbraw/zinc/32/02/88/1368320288.db2.gz	KYXZBBUPPIORQM-NBYUQASBSA-N	0	3	342.483	3.116	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3CCC[C@H](C)O)CCCC1	ZINC001111523037	1368325090	/nfs/dbraw/zinc/32/50/90/1368325090.db2.gz	PHVSHLJZWAKMBW-MLHJIOFPSA-N	0	3	334.504	3.005	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@H](C)CC(C)C)C[C@H](C)O2	ZINC001111552600	1368344096	/nfs/dbraw/zinc/34/40/96/1368344096.db2.gz	IWSZNLPYKSGVCY-MSOLQXFVSA-N	0	3	336.520	3.327	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CCCN([C@H]2CCc3ccccc32)CC1	ZINC001195174601	1368393152	/nfs/dbraw/zinc/39/31/52/1368393152.db2.gz	QIVRLJRZZZBABT-XLIONFOSSA-N	0	3	342.483	3.189	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CCCN([C@@H]2CCc3ccccc32)CC1	ZINC001195174599	1368393411	/nfs/dbraw/zinc/39/34/11/1368393411.db2.gz	QIVRLJRZZZBABT-FXAWDEMLSA-N	0	3	342.483	3.189	20	30		EGEDHN
C=CCOCCCC(=O)N1CCCN(Cc2cc(C)cc(C)c2)CC1	ZINC001195444496	1368437999	/nfs/dbraw/zinc/43/79/99/1368437999.db2.gz	ROYALOMUWIPUGZ-UHFFFAOYSA-N	0	3	344.499	3.321	20	30		EGEDHN
C=C(C)CCC(=O)N[C@]12CCC[C@H]1CN(CCc1csc(C)n1)C2	ZINC001111764003	1368450507	/nfs/dbraw/zinc/45/05/07/1368450507.db2.gz	UBPPBNVCJODPST-LPHOPBHVSA-N	0	3	347.528	3.321	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CCCN(C[C@@H]2CCCC(F)(F)C2)CC1	ZINC001195785797	1368490151	/nfs/dbraw/zinc/49/01/51/1368490151.db2.gz	VVPPONGCILYWGY-MRXNPFEDSA-N	0	3	340.458	3.396	20	30		EGEDHN
CC(F)(F)CC(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(C#N)cc1)C2	ZINC001111865134	1368514115	/nfs/dbraw/zinc/51/41/15/1368514115.db2.gz	AEUZRLBQCNDUDD-LPHOPBHVSA-N	0	3	347.409	3.074	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)CC/C=C\c2ccccc2)C1	ZINC001111871028	1368518118	/nfs/dbraw/zinc/51/81/18/1368518118.db2.gz	XDJOLIOHRGEMPO-CBILNDSKSA-N	0	3	336.479	3.474	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cn3c(n2)CCCC3)CC1	ZINC001196010464	1368535241	/nfs/dbraw/zinc/53/52/41/1368535241.db2.gz	OFKSNVNQYLUGGR-UHFFFAOYSA-N	0	3	344.503	3.114	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cc(C)nnc2CC)CC1	ZINC001196325295	1368589475	/nfs/dbraw/zinc/58/94/75/1368589475.db2.gz	OMKQRUZODCUALK-UHFFFAOYSA-N	0	3	346.519	3.466	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H](C)Cc2ccccc2C)C1	ZINC001112014455	1368618834	/nfs/dbraw/zinc/61/88/34/1368618834.db2.gz	SPKMSVUDLYMZAH-VCOUNFBDSA-N	0	3	338.495	3.168	20	30		EGEDHN
CC1(C)C[C@]1(NC[C@@H](O)COc1ccccc1C#N)c1ccccc1	ZINC001196460466	1368620397	/nfs/dbraw/zinc/62/03/97/1368620397.db2.gz	ZMESSLMTIWRIFR-NQIIRXRSSA-N	0	3	336.435	3.213	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)C2CCCCCCC2)C[C@H]1C(F)(F)F	ZINC001112129555	1368674181	/nfs/dbraw/zinc/67/41/81/1368674181.db2.gz	QVOMJHJUSUCYMJ-HZPDHXFCSA-N	0	3	344.421	3.349	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cn(CC)nc2C)CC1	ZINC001197283777	1368779782	/nfs/dbraw/zinc/77/97/82/1368779782.db2.gz	TZCDCTDUPXAIPS-UHFFFAOYSA-N	0	3	334.508	3.330	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2csc3cncn32)CC1	ZINC001197309362	1368785349	/nfs/dbraw/zinc/78/53/49/1368785349.db2.gz	ZXDNMWHNSITYKB-UHFFFAOYSA-N	0	3	346.500	3.290	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)C[C@H](C)CC(C)C)C1	ZINC001197698631	1368875521	/nfs/dbraw/zinc/87/55/21/1368875521.db2.gz	LWLJJQLGHWBKFE-KZNAEPCWSA-N	0	3	326.525	3.190	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2cnc(C)o2)C1	ZINC001112515597	1368909475	/nfs/dbraw/zinc/90/94/75/1368909475.db2.gz	SIWCAELDSFZJLO-SYNHAJSKSA-N	0	3	345.487	3.304	20	30		EGEDHN
C#CCCN1CCCN(C(=O)[C@@H](c2ccccc2)[C@H](C)CC)CC1	ZINC001198078386	1368955594	/nfs/dbraw/zinc/95/55/94/1368955594.db2.gz	VFTIUFXYFIZHCG-UYAOXDASSA-N	0	3	326.484	3.374	20	30		EGEDHN
C=C[C@H](CC(=O)N1CCCN(CCC[C@H](C)O)CC1)c1ccccc1	ZINC001198214639	1368982120	/nfs/dbraw/zinc/98/21/20/1368982120.db2.gz	UNIQGBUAQYEHPG-RBUKOAKNSA-N	0	3	344.499	3.042	20	30		EGEDHN
C=C[C@@H](CC(=O)N1CCCN(CCC[C@@H](C)O)CC1)c1ccccc1	ZINC001198214637	1368982267	/nfs/dbraw/zinc/98/22/67/1368982267.db2.gz	UNIQGBUAQYEHPG-MOPGFXCFSA-N	0	3	344.499	3.042	20	30		EGEDHN
C=CCC[C@H](C(=O)N1CCCN(C[C@@H](C)OC)CC1)c1ccccc1	ZINC001198423084	1369029603	/nfs/dbraw/zinc/02/96/03/1369029603.db2.gz	KAYDDXFHSUYUSN-QUCCMNQESA-N	0	3	344.499	3.306	20	30		EGEDHN
C=CCC[C@@H](C)N[C@H](CNC(=O)c1ccon1)c1ccccc1OC	ZINC001198577024	1369064232	/nfs/dbraw/zinc/06/42/32/1369064232.db2.gz	HCUPFEMWSPWGLO-RHSMWYFYSA-N	0	3	343.427	3.099	20	30		EGEDHN
C=CCC[C@@H](C)N[C@H](CNC(=O)COC(C)C)c1ccccc1OC	ZINC001198584465	1369065810	/nfs/dbraw/zinc/06/58/10/1369065810.db2.gz	HRRFEKZMGBGGHM-SJLPKXTDSA-N	0	3	348.487	3.222	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)c1cscn1)c1ccccc1OC	ZINC001198605889	1369071729	/nfs/dbraw/zinc/07/17/29/1369071729.db2.gz	LKTNKJYIGDILIT-HNNXBMFYSA-N	0	3	345.468	3.179	20	30		EGEDHN
C=CCOCC(=O)NC[C@@H](NCCC(C)(C)C)c1ccccc1OC	ZINC001198606551	1369071977	/nfs/dbraw/zinc/07/19/77/1369071977.db2.gz	UERIXQGPZWMDMN-QGZVFWFLSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)C(=O)C(C)(C)C)c1ccccc1OC	ZINC001198617607	1369074489	/nfs/dbraw/zinc/07/44/89/1369074489.db2.gz	OYGOKELYRFSWHI-MRXNPFEDSA-N	0	3	346.471	3.024	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)c1[nH]ccc1C)c1ccccc1OC	ZINC001198704810	1369095198	/nfs/dbraw/zinc/09/51/98/1369095198.db2.gz	LTOUIRKVUJWLNY-QGZVFWFLSA-N	0	3	341.455	3.359	20	30		EGEDHN
C=CCC[C@H](C)N[C@H](CNC(=O)C#CC(C)C)c1ccccc1OC	ZINC001198714333	1369097600	/nfs/dbraw/zinc/09/76/00/1369097600.db2.gz	XIFLTEYGDPWPHH-PKOBYXMFSA-N	0	3	342.483	3.456	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)C1C=CC=CC=C1)c1ccccc1OC	ZINC001198752784	1369105646	/nfs/dbraw/zinc/10/56/46/1369105646.db2.gz	VGBCNMJLPVSFTH-LJQANCHMSA-N	0	3	338.451	3.317	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)[C@@H](CCC)OC)c1ccccc1OC	ZINC001198828022	1369123899	/nfs/dbraw/zinc/12/38/99/1369123899.db2.gz	WJSMUBMEJJCTPX-PKOBYXMFSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)[C@@H](F)C(C)C)c1ccccc1OC	ZINC001198842265	1369127112	/nfs/dbraw/zinc/12/71/12/1369127112.db2.gz	FXGOVEDWAWGCSC-AEFFLSMTSA-N	0	3	336.451	3.402	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@H](NCC1CC1)c1ccccc1OC	ZINC001198856862	1369130456	/nfs/dbraw/zinc/13/04/56/1369130456.db2.gz	KUADVIQGLDJYAD-YJBOKZPZSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@H](NCC(C)C)c2ccccc2OC)C1	ZINC001198895951	1369143145	/nfs/dbraw/zinc/14/31/45/1369143145.db2.gz	YYDOXMBOPKWDLU-KRWDZBQOSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=C[C@H](CC(=O)N[C@@H]1CN(CCCCCC)C[C@H]1O)c1ccccc1	ZINC001198941119	1369153820	/nfs/dbraw/zinc/15/38/20/1369153820.db2.gz	YSNSDDSQXRCNOM-MISYRCLQSA-N	0	3	344.499	3.088	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)c1nocc1C)c1ccccc1OC	ZINC001198953549	1369157017	/nfs/dbraw/zinc/15/70/17/1369157017.db2.gz	PVJSGORARFWZHQ-INIZCTEOSA-N	0	3	343.427	3.019	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)C[C@H](C)C1CC1)c1ccccc1OC	ZINC001198992521	1369167122	/nfs/dbraw/zinc/16/71/22/1369167122.db2.gz	BVHRTFAQEBDNGK-MAUKXSAKSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)CCc2ccc(OC)c(F)c2)CC1	ZINC001113095480	1369199211	/nfs/dbraw/zinc/19/92/11/1369199211.db2.gz	LXMICAPNENJWLR-MRXNPFEDSA-N	0	3	348.462	3.266	20	30		EGEDHN
CC(C)(C)/C=C\C(=O)N1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001199848100	1369280977	/nfs/dbraw/zinc/28/09/77/1369280977.db2.gz	UWYWFDGYKZMAHW-TWGQIWQCSA-N	0	3	343.446	3.380	20	30		EGEDHN
C#CCCCC(=O)N1CCC(N[C@@H](C)c2c(F)cccc2F)CC1	ZINC001200317013	1369347271	/nfs/dbraw/zinc/34/72/71/1369347271.db2.gz	HLAIRHPQEDSFTQ-AWEZNQCLSA-N	0	3	334.410	3.410	20	30		EGEDHN
Cc1nc(C(C)C)oc1CNC1CCN(C(=O)C#CC(C)(C)C)CC1	ZINC001200462109	1369373920	/nfs/dbraw/zinc/37/39/20/1369373920.db2.gz	SWCNECCMGAKLIM-UHFFFAOYSA-N	0	3	345.487	3.237	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC(NCc2cc(O)ccc2Cl)CC1	ZINC001200823451	1369434200	/nfs/dbraw/zinc/43/42/00/1369434200.db2.gz	JZIPMUHUCLZSTB-UHFFFAOYSA-N	0	3	336.863	3.483	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)[C@@H](c2ccccc2)N(C)CC)CC1	ZINC001113529056	1369479488	/nfs/dbraw/zinc/47/94/88/1369479488.db2.gz	BUOXKCLCXVFFOA-AZUAARDMSA-N	0	3	343.515	3.178	20	30		EGEDHN
CCCCCCCCCN1CCCn2nnc(Cn3ccnc3)c2C1	ZINC001201840361	1369632363	/nfs/dbraw/zinc/63/23/63/1369632363.db2.gz	YTPVJUIEXNGDAA-UHFFFAOYSA-N	0	3	344.507	3.479	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC(NC/C(Cl)=C\Cl)CC1	ZINC001202005029	1369665659	/nfs/dbraw/zinc/66/56/59/1369665659.db2.gz	WKOPUTZUNXFRMO-WYMLVPIESA-N	0	3	331.287	3.470	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)N1CCC(NCc2oc(CCC)nc2C)CC1	ZINC001202084423	1369683909	/nfs/dbraw/zinc/68/39/09/1369683909.db2.gz	CGZXFTLINBNNCZ-GJZGRUSLSA-N	0	3	347.503	3.474	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC(NCC(=C)Br)CC1	ZINC001202130731	1369696189	/nfs/dbraw/zinc/69/61/89/1369696189.db2.gz	PEWPCLWOKJGMNS-ZDUSSCGKSA-N	0	3	329.282	3.078	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC(NCc2ccncc2Cl)CC1	ZINC001202131112	1369696577	/nfs/dbraw/zinc/69/65/77/1369696577.db2.gz	SPPCLPOIWAPFAF-CQSZACIVSA-N	0	3	335.879	3.418	20	30		EGEDHN
CCC(=O)N[C@@H]1C[C@@H](NCC#Cc2ccccc2Cl)C12CCC2	ZINC001202257683	1369724274	/nfs/dbraw/zinc/72/42/74/1369724274.db2.gz	BIXAHZQFBSQZEI-IAGOWNOFSA-N	0	3	330.859	3.119	20	30		EGEDHN
CC(C)CC(=O)N[C@@H]1C[C@H](NCc2cc(C#N)ccc2F)C12CCC2	ZINC001202340111	1369743123	/nfs/dbraw/zinc/74/31/23/1369743123.db2.gz	JTGONYRKYHQSCN-ZWKOTPCHSA-N	0	3	343.446	3.260	20	30		EGEDHN
CCCCC(=O)N[C@@H]1C[C@H](NCc2cc(C#N)ccc2F)C12CCC2	ZINC001202491753	1369789312	/nfs/dbraw/zinc/78/93/12/1369789312.db2.gz	WKDFGKBEAXCIKG-ZWKOTPCHSA-N	0	3	343.446	3.405	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@H](NCc2c(C)onc2CC)C12CCC2	ZINC001202589079	1369814802	/nfs/dbraw/zinc/81/48/02/1369814802.db2.gz	BBZJTPKIPPHICL-IRXDYDNUSA-N	0	3	331.460	3.029	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1C[C@@H](NCc2cc(C)ccc2F)C12CCC2	ZINC001202846010	1369906379	/nfs/dbraw/zinc/90/63/79/1369906379.db2.gz	HGHADEYWMHGUCT-MOPGFXCFSA-N	0	3	342.458	3.455	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1C[C@H](NCc2cc(F)ccc2F)C12CCC2	ZINC001202847299	1369907139	/nfs/dbraw/zinc/90/71/39/1369907139.db2.gz	RVHQOKXCHJZLRO-ZWKOTPCHSA-N	0	3	346.421	3.285	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1[C@H]2CN(CCCc3c(F)cccc3F)C[C@H]21	ZINC001114687017	1370024691	/nfs/dbraw/zinc/02/46/91/1370024691.db2.gz	WEBFUWJUNOFPIJ-HWWDLCQESA-N	0	3	348.437	3.156	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1[C@H]2CN(Cc3ccc(CF)cc3)C[C@H]21	ZINC001114693127	1370029584	/nfs/dbraw/zinc/02/95/84/1370029584.db2.gz	VFLDXLPYVYCYRU-KXTWHKPSSA-N	0	3	342.458	3.286	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1[C@H]2CN(CCOc3cccc(C)c3)C[C@H]21	ZINC001114720637	1370045011	/nfs/dbraw/zinc/04/50/11/1370045011.db2.gz	ZWQVYBJTHQRZTN-XFIJJGBISA-N	0	3	342.483	3.023	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1C[C@@H](NCc2cncs2)C12CCC2	ZINC001203294558	1370066556	/nfs/dbraw/zinc/06/65/56/1370066556.db2.gz	CZOQLHVTDLDLHL-SJORKVTESA-N	0	3	345.512	3.244	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1C[C@@H](NCc2ocnc2C)C12CCC2	ZINC001203297036	1370069831	/nfs/dbraw/zinc/06/98/31/1370069831.db2.gz	WNWNONDXOQTBQJ-QZTJIDSGSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1[C@H]2CN(CCOc3ccc(C)cc3)C[C@H]21	ZINC001114780352	1370076453	/nfs/dbraw/zinc/07/64/53/1370076453.db2.gz	HXHAIEFOIGPLGA-XODKDNOYSA-N	0	3	342.483	3.023	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1C[C@@H](NCC(=C)Br)C12CCC2	ZINC001203339183	1370089140	/nfs/dbraw/zinc/08/91/40/1370089140.db2.gz	FYUKZHZGBANYOS-ZIAGYGMSSA-N	0	3	341.293	3.268	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H]2C[C@@H](NCc3ccns3)C23CCC3)CC1	ZINC001203372894	1370103175	/nfs/dbraw/zinc/10/31/75/1370103175.db2.gz	GFMAOUOZDULHSI-CVEARBPZSA-N	0	3	345.512	3.407	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1C[C@@H](NCc2cnoc2C)C12CCC2	ZINC001203451018	1370131502	/nfs/dbraw/zinc/13/15/02/1370131502.db2.gz	HMKDEGQSOHKBQO-CVEARBPZSA-N	0	3	331.460	3.102	20	30		EGEDHN
CCCCCCCCC(=O)N1CCC(NCc2cnns2)CC1	ZINC001203468903	1370137073	/nfs/dbraw/zinc/13/70/73/1370137073.db2.gz	YKGZHJQQSGKBJJ-UHFFFAOYSA-N	0	3	338.521	3.369	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CC1)CC[NH+](Cc1ccccc1[O-])CC2	ZINC001203547632	1370165410	/nfs/dbraw/zinc/16/54/10/1370165410.db2.gz	RIPMWILLCQQRTA-UHFFFAOYSA-N	0	3	344.455	3.393	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)CCOc2ccccc2)C12CCC2	ZINC001203731093	1370238727	/nfs/dbraw/zinc/23/87/27/1370238727.db2.gz	NOGKQACJDMKRMA-IAGOWNOFSA-N	0	3	348.874	3.225	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@]3(C[C@H](Oc4cccnc4)CO3)C2)c1	ZINC001203762798	1370254328	/nfs/dbraw/zinc/25/43/28/1370254328.db2.gz	WOIGAENKBWHYIY-LEWJYISDSA-N	0	3	349.434	3.156	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@H]1CCN(Cc1ccc(OC)c(F)c1)C2	ZINC001203793105	1370267881	/nfs/dbraw/zinc/26/78/81/1370267881.db2.gz	PTILCZAGXGNVGN-PMACEKPBSA-N	0	3	349.446	3.408	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H]2CN(CCOc3c(C)cccc3C)C[C@H]21	ZINC001187198752	1388069377	/nfs/dbraw/zinc/06/93/77/1388069377.db2.gz	IIEYAWATWVTVFW-RBUKOAKNSA-N	0	3	342.483	3.181	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(NCc3cnc(C)cn3)CC2)CCCC1	ZINC001204156733	1370393149	/nfs/dbraw/zinc/39/31/49/1370393149.db2.gz	DSNAMSFEGCTMIS-UHFFFAOYSA-N	0	3	342.487	3.002	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cnc(C)s2)CCCCC1	ZINC001115439452	1370453452	/nfs/dbraw/zinc/45/34/52/1370453452.db2.gz	WTZYTSCHNHIDGG-UHFFFAOYSA-N	0	3	327.881	3.226	20	30		EGEDHN
C=CCCC(=O)NCC1(NCc2cc(OC)ns2)CCCCC1	ZINC001115442492	1370455047	/nfs/dbraw/zinc/45/50/47/1370455047.db2.gz	BIMGFZRMTQFODS-UHFFFAOYSA-N	0	3	337.489	3.027	20	30		EGEDHN
CCCCCCCOc1ccc(CN2CC[C@@H](CO)[C@@H](O)C2)cc1	ZINC001204369169	1370455487	/nfs/dbraw/zinc/45/54/87/1370455487.db2.gz	PUIXDEIITWBFRQ-ICSRJNTNSA-N	0	3	335.488	3.211	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CCN(Cc3ccc(CC)o3)C2)C1	ZINC001204389235	1370463321	/nfs/dbraw/zinc/46/33/21/1370463321.db2.gz	NAZQRZHKFPMXEH-IBGZPJMESA-N	0	3	332.444	3.453	20	30		EGEDHN
CCc1ccc(CN2CC[C@]3(CC(=O)N(c4cccc(C#N)c4)C3)C2)o1	ZINC001204393477	1370464864	/nfs/dbraw/zinc/46/48/64/1370464864.db2.gz	PPZHXQRTYGMZBJ-NRFANRHFSA-N	0	3	349.434	3.343	20	30		EGEDHN
C#CCCCCC(=O)NCC1(NCc2cnoc2C)CCCCC1	ZINC001115490664	1370493188	/nfs/dbraw/zinc/49/31/88/1370493188.db2.gz	FCMQVKOJNNFKKZ-UHFFFAOYSA-N	0	3	331.460	3.085	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H]2CN(CC[C@H]3CC3(Cl)Cl)C[C@H]21	ZINC001187239409	1388079508	/nfs/dbraw/zinc/07/95/08/1388079508.db2.gz	BDHNBBFQCVCLMJ-MELADBBJSA-N	0	3	331.287	3.069	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ncc(F)cc2F)CCCCC1	ZINC001115596324	1370597495	/nfs/dbraw/zinc/59/74/95/1370597495.db2.gz	BIROSVUDHDCTMQ-UHFFFAOYSA-N	0	3	343.805	3.135	20	30		EGEDHN
CN(C)Cc1ccc(C(=O)Nc2cnc(C#N)c(C(F)(F)F)c2)cc1	ZINC001187277369	1388085808	/nfs/dbraw/zinc/08/58/08/1388085808.db2.gz	DWBMWRNBYPQCIX-UHFFFAOYSA-N	0	3	348.328	3.286	20	30		EGEDHN
CC[C@@H](F)C(=O)NCC1(NCC#Cc2ccc(F)cc2)CCCCC1	ZINC001115669110	1370650411	/nfs/dbraw/zinc/65/04/11/1370650411.db2.gz	OATAJGIBNKZNDQ-GOSISDBHSA-N	0	3	348.437	3.334	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCC1(NCc2cc(C)ncn2)CCCCC1	ZINC001115679890	1370662590	/nfs/dbraw/zinc/66/25/90/1370662590.db2.gz	RBINYYIJJJYIIR-RDJZCZTQSA-N	0	3	344.503	3.152	20	30		EGEDHN
C=CCC(C)(C)C(=O)N(Cc1ccccc1)[C@@H]1CN(CCC)C[C@H]1O	ZINC001205194772	1370675379	/nfs/dbraw/zinc/67/53/79/1370675379.db2.gz	AQIFOUNWDLJNJW-RTBURBONSA-N	0	3	344.499	3.073	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C[C@@H](C=C)CC)CC[C@H]1c1ccc(F)cc1	ZINC001205307195	1370716041	/nfs/dbraw/zinc/71/60/41/1370716041.db2.gz	UEISMCCNXLGKSH-FFZOFVMBSA-N	0	3	342.458	3.335	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H](C)CC(=C)C)CC[C@H]1c1ccc(F)cc1	ZINC001205307234	1370716274	/nfs/dbraw/zinc/71/62/74/1370716274.db2.gz	WLGIJLNSGDFIFP-FFZOFVMBSA-N	0	3	342.458	3.335	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C2(CCC)CC2)CC[C@H]1c1ccc(F)cc1	ZINC001205306892	1370716387	/nfs/dbraw/zinc/71/63/87/1370716387.db2.gz	CUVHYOZZLGUDIV-RBUKOAKNSA-N	0	3	342.458	3.313	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccnc(C3CC3)n2)CCCCC1	ZINC001115755473	1370736898	/nfs/dbraw/zinc/73/68/98/1370736898.db2.gz	BLCZPPVQWSAKPF-UHFFFAOYSA-N	0	3	348.878	3.129	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC(CNCc2cnc(C)o2)CC1	ZINC001205386841	1370739267	/nfs/dbraw/zinc/73/92/67/1370739267.db2.gz	JWCAVSQSDROYDY-UHFFFAOYSA-N	0	3	331.460	3.080	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC(CN[C@@H](C)c2cnc(C)cn2)CC1	ZINC001205989864	1370932538	/nfs/dbraw/zinc/93/25/38/1370932538.db2.gz	XUUJGGHODJYXME-RDJZCZTQSA-N	0	3	344.503	3.277	20	30		EGEDHN
CCN1CCN(c2ccc(NC(=O)c3csc(C#N)c3)cc2)CC1	ZINC001117784474	1371083158	/nfs/dbraw/zinc/08/31/58/1371083158.db2.gz	QSIFONNPVHANQE-UHFFFAOYSA-N	0	3	340.452	3.014	20	30		EGEDHN
C=C[C@@H](COC)NC[C@H](O)COc1cc(C)c(Cl)cc1C(C)C	ZINC001326156316	1388120708	/nfs/dbraw/zinc/12/07/08/1388120708.db2.gz	OJDRLLQQTYCWLH-GJZGRUSLSA-N	0	3	341.879	3.302	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(CNCc3ocnc3C)CC2)CCCC1	ZINC001206979792	1371257720	/nfs/dbraw/zinc/25/77/20/1371257720.db2.gz	LYDAUIHBFMCWTI-UHFFFAOYSA-N	0	3	345.487	3.448	20	30		EGEDHN
CC(C)(F)C(=O)N1CCC[C@@H](NCC#Cc2ccccc2Cl)C1	ZINC001207047082	1371276364	/nfs/dbraw/zinc/27/63/64/1371276364.db2.gz	KBPDHIDADVTBLR-OAHLLOKOSA-N	0	3	336.838	3.020	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H]1CN(C[C@@H]2CC(C)(C)CO2)C[C@H]1C	ZINC001207152773	1371312910	/nfs/dbraw/zinc/31/29/10/1371312910.db2.gz	DUZXNOOPCDCXMR-VHDGCEQUSA-N	0	3	342.911	3.017	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CN(Cc2cccc(COC)c2)C[C@H]1C	ZINC001207158100	1371314305	/nfs/dbraw/zinc/31/43/05/1371314305.db2.gz	FYHLQQYGSXSVKU-VQIMIIECSA-N	0	3	344.499	3.372	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CN(Cc2ccc(COC)cc2)C[C@H]1C	ZINC001207158012	1371314619	/nfs/dbraw/zinc/31/46/19/1371314619.db2.gz	CVGKYUJAWJFVTL-VQIMIIECSA-N	0	3	344.499	3.372	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN(Cc2ccccc2N(C)C)C[C@H]1C	ZINC001207180037	1371322025	/nfs/dbraw/zinc/32/20/25/1371322025.db2.gz	RPTXXYFYLGDXRQ-SJLPKXTDSA-N	0	3	329.488	3.045	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1CCC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001207717599	1371484793	/nfs/dbraw/zinc/48/47/93/1371484793.db2.gz	JJTDHMKZHVQCOG-PBHICJAKSA-N	0	3	331.435	3.214	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1CCC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001207718468	1371485220	/nfs/dbraw/zinc/48/52/20/1371485220.db2.gz	QNGXJGVXJGSHAR-PBHICJAKSA-N	0	3	331.435	3.214	20	30		EGEDHN
CCC[C@H](C)C(=O)N1CCC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001207718470	1371485492	/nfs/dbraw/zinc/48/54/92/1371485492.db2.gz	QNGXJGVXJGSHAR-WMLDXEAASA-N	0	3	331.435	3.214	20	30		EGEDHN
O=C(/C=C\C1CC1)N1CCC[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207741739	1371491073	/nfs/dbraw/zinc/49/10/73/1371491073.db2.gz	PHRYWWUVGXNHLZ-ADYPVZHUSA-N	0	3	342.870	3.238	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CCc2nccs2)CCCCC1	ZINC001120164854	1371497289	/nfs/dbraw/zinc/49/72/89/1371497289.db2.gz	NIDRYZFMTZUFHK-UHFFFAOYSA-N	0	3	341.908	3.237	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207763997	1371497929	/nfs/dbraw/zinc/49/79/29/1371497929.db2.gz	JNLBXKUDIRWYMW-FDDPXEEKSA-N	0	3	330.859	3.238	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H](N[C@H](C)c2ccc(F)cc2F)C1	ZINC001207909048	1371535650	/nfs/dbraw/zinc/53/56/50/1371535650.db2.gz	NBKYUXJBJWOZDR-ZBFHGGJFSA-N	0	3	334.410	3.410	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H](NCc2ccc(Cl)cc2OC)C1	ZINC001207934341	1371542299	/nfs/dbraw/zinc/54/22/99/1371542299.db2.gz	CDKSDMGIWFFSEH-QGZVFWFLSA-N	0	3	348.874	3.233	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H]([C@H]2CCCN2Cc2cncc(F)c2)C1	ZINC001120348222	1371543358	/nfs/dbraw/zinc/54/33/58/1371543358.db2.gz	RORXDOZAJAGNNR-IEBWSBKVSA-N	0	3	345.462	3.390	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H](NCc2ccc(Cl)cc2F)C1	ZINC001207944146	1371545318	/nfs/dbraw/zinc/54/53/18/1371545318.db2.gz	JKHCMDYYBRTOLD-MRXNPFEDSA-N	0	3	336.838	3.363	20	30		EGEDHN
CC/C(C)=C/C(=O)N1CCC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001208002205	1371563818	/nfs/dbraw/zinc/56/38/18/1371563818.db2.gz	PUVRAELGJPDWBD-RKCSUWQLSA-N	0	3	329.419	3.134	20	30		EGEDHN
COc1ccc(C)cc1CN[C@@H]1CCCN(C(=O)C#CC(C)(C)C)C1	ZINC001208014124	1371568727	/nfs/dbraw/zinc/56/87/27/1371568727.db2.gz	MFTCORXOGAEIMA-GOSISDBHSA-N	0	3	342.483	3.134	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CCC[C@H](NCC=C(Cl)Cl)C1)OCC	ZINC001208264015	1371690198	/nfs/dbraw/zinc/69/01/98/1371690198.db2.gz	HNZAPIQVDMCJBO-UONOGXRCSA-N	0	3	349.302	3.257	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1CN(CCc2scnc2C)C[C@H]1C	ZINC001208315238	1371713351	/nfs/dbraw/zinc/71/33/51/1371713351.db2.gz	PUYDRQLXXGFXOE-NVXWUHKLSA-N	0	3	347.528	3.014	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN([C@@H]2CCc3ccc(F)cc32)C[C@H]1C	ZINC001208318142	1371715762	/nfs/dbraw/zinc/71/57/62/1371715762.db2.gz	LVIDLLMYWLYTQJ-FSPWUOQZSA-N	0	3	330.447	3.462	20	30		EGEDHN
O=C([C@@H]1CCCC12CC2)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001208414260	1371758967	/nfs/dbraw/zinc/75/89/67/1371758967.db2.gz	LJZPYGBUYCSALQ-PMACEKPBSA-N	0	3	336.479	3.199	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1)C(C)(C)C	ZINC001208423313	1371762577	/nfs/dbraw/zinc/76/25/77/1371762577.db2.gz	HFBZREAETLBWGU-VQIMIIECSA-N	0	3	344.474	3.440	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1CCC[C@@H](NC[C@@H](F)CC)C1	ZINC001208433008	1371764230	/nfs/dbraw/zinc/76/42/30/1371764230.db2.gz	PSRXIDAXVNJBHG-JKSUJKDBSA-N	0	3	334.435	3.194	20	30		EGEDHN
C[C@H](C#N)C(=O)NC1CC2(C1)CC(N[C@@H](C)c1c(F)cccc1F)C2	ZINC001120859640	1371787455	/nfs/dbraw/zinc/78/74/55/1371787455.db2.gz	WUEVYIWVVWSMAD-QTSDNRQPSA-N	0	3	347.409	3.202	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@H](C)CCc2ccccc2F)C1	ZINC001208574865	1371823581	/nfs/dbraw/zinc/82/35/81/1371823581.db2.gz	HMPIERJCDHXHID-GPMSIDNRSA-N	0	3	332.463	3.407	20	30		EGEDHN
C#CCCCCC(=O)NC1CC2(CC(NCc3ncc(C)s3)C2)C1	ZINC001120968484	1371824937	/nfs/dbraw/zinc/82/49/37/1371824937.db2.gz	JOCYMBCKUVULBP-UHFFFAOYSA-N	0	3	345.512	3.162	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC1CC2(CC(NCc3ccn(CC)n3)C2)C1	ZINC001121176040	1371878931	/nfs/dbraw/zinc/87/89/31/1371878931.db2.gz	SOGFZSWTLYRXBT-UHFFFAOYSA-N	0	3	344.503	3.022	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N1CCC[C@H](NCC=C(Cl)Cl)C1	ZINC001208796863	1371899625	/nfs/dbraw/zinc/89/96/25/1371899625.db2.gz	OCXHXRYCRRQUPE-BBRMVZONSA-N	0	3	349.302	3.115	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@@H](CC)Oc2ccccc2C)C1	ZINC001208996242	1371970871	/nfs/dbraw/zinc/97/08/71/1371970871.db2.gz	UFDIJBGBQNMZGJ-KZNAEPCWSA-N	0	3	330.472	3.165	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CCC[C@@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001209015435	1371975043	/nfs/dbraw/zinc/97/50/43/1371975043.db2.gz	BBZUYHADMCRQRI-IAGOWNOFSA-N	0	3	336.838	3.020	20	30		EGEDHN
C=CCN(CCN1CCC(OCc2ccccc2)CC1)C(=O)OCC	ZINC001209021495	1371976667	/nfs/dbraw/zinc/97/66/67/1371976667.db2.gz	HCJKHMVSKRBNDN-UHFFFAOYSA-N	0	3	346.471	3.312	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC1CC2(CC(NCc3oc(C)nc3C)C2)C1	ZINC001121527210	1372000540	/nfs/dbraw/zinc/00/05/40/1372000540.db2.gz	BXZQDJDEIBDXLO-UHFFFAOYSA-N	0	3	345.487	3.411	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCCN(C(=O)CCCC3CC3)C2)cc1F	ZINC001209145189	1372013180	/nfs/dbraw/zinc/01/31/80/1372013180.db2.gz	CDKNIMHQCHXFAT-GOSISDBHSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001209182523	1372027754	/nfs/dbraw/zinc/02/77/54/1372027754.db2.gz	FCIPLDMJANXAHC-YLJYHZDGSA-N	0	3	342.458	3.360	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@H](NCc2cn(C(C)C)nc2C)C1	ZINC001209184413	1372029612	/nfs/dbraw/zinc/02/96/12/1372029612.db2.gz	SGFAFGOLRROFNF-QFBILLFUSA-N	0	3	346.519	3.455	20	30		EGEDHN
C=CCCCC(=O)NC1CC2(CC(NCc3csnc3OC)C2)C1	ZINC001121674334	1372042717	/nfs/dbraw/zinc/04/27/17/1372042717.db2.gz	DWWMOQMEKISWKJ-UHFFFAOYSA-N	0	3	349.500	3.025	20	30		EGEDHN
C=CCO[C@H]1CO[C@@]2(C1)CCCN(CCc1ccc(F)c(F)c1)C2	ZINC001209243501	1372048284	/nfs/dbraw/zinc/04/82/84/1372048284.db2.gz	HRZBKTWGXWWFIL-VQIMIIECSA-N	0	3	337.410	3.333	20	30		EGEDHN
CCc1ccccc1C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001209295425	1372060257	/nfs/dbraw/zinc/06/02/57/1372060257.db2.gz	UQFLZEAPFIKXTM-OAQYLSRUSA-N	0	3	346.474	3.495	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@@H](NCc2cc(F)ccc2OC)C1	ZINC001209346918	1372073269	/nfs/dbraw/zinc/07/32/69/1372073269.db2.gz	WYXVWFYSHZXEGD-QGZVFWFLSA-N	0	3	334.435	3.271	20	30		EGEDHN
C=CCCCCCCN1CCN(c2ccnc(N3CCCC3)n2)CC1	ZINC001209440130	1372107112	/nfs/dbraw/zinc/10/71/12/1372107112.db2.gz	BVDJUVXRFGABGA-UHFFFAOYSA-N	0	3	343.519	3.335	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)NCc1ccnc(Oc2ccc(F)cc2)c1	ZINC001121915196	1372121588	/nfs/dbraw/zinc/12/15/88/1372121588.db2.gz	BPGRCWAXKZUYBG-KRWDZBQOSA-N	0	3	343.402	3.313	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc(F)cc1OCC(F)(F)F	ZINC001121954460	1372133195	/nfs/dbraw/zinc/13/31/95/1372133195.db2.gz	BQBZLNARKVXPFC-NSHDSACASA-N	0	3	334.313	3.389	20	30		EGEDHN
CC(C)C[C@@H](C)C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001210357387	1372331055	/nfs/dbraw/zinc/33/10/55/1372331055.db2.gz	AVBOVQTZKFGRDK-UYAOXDASSA-N	0	3	326.484	3.301	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCC(=O)c1cc(C)sc1C	ZINC001123338098	1372431505	/nfs/dbraw/zinc/43/15/05/1372431505.db2.gz	YBXPINYOMQPJON-AWEZNQCLSA-N	0	3	329.425	3.421	20	30		EGEDHN
N#CC(C(=O)c1cc2n(n1)CCCC2)c1nc2c(cccc2Cl)[nH]1	ZINC001123345404	1372435378	/nfs/dbraw/zinc/43/53/78/1372435378.db2.gz	GMTIPFGTRHEPAB-LLVKDONJSA-N	0	3	339.786	3.239	20	30		EGEDHN
CCCCCC[C@](C)(CC)C(=O)N1CC[C@@H](NCC#CCOC)C1	ZINC001187989457	1388206323	/nfs/dbraw/zinc/20/63/23/1388206323.db2.gz	ZQRNNUKEKCERFY-QUCCMNQESA-N	0	3	336.520	3.213	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C[C@@H](C)C(C)C)C[C@H]1c1ccccc1	ZINC001211555476	1372579757	/nfs/dbraw/zinc/57/97/57/1372579757.db2.gz	SQSGMPGXGRGTQO-YZGWKJHDSA-N	0	3	326.484	3.276	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)CCC(C)(F)F)C[C@H]1c1ccccc1	ZINC001211625504	1372592194	/nfs/dbraw/zinc/59/21/94/1372592194.db2.gz	JSCSGBBOQOWMJH-DLBZAZTESA-N	0	3	334.410	3.029	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CN([C@@H](C)c2ccccc2C)C[C@H]1OC	ZINC001212338141	1372690413	/nfs/dbraw/zinc/69/04/13/1372690413.db2.gz	FOFGJIOKXVBVPO-QXAKKESOSA-N	0	3	344.499	3.474	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN([C@H](CC)c2ccccc2)C[C@H]1OC	ZINC001212345047	1372691276	/nfs/dbraw/zinc/69/12/76/1372691276.db2.gz	YIFJBKVEMPWUGV-GUDVDZBRSA-N	0	3	330.472	3.309	20	30		EGEDHN
C=C[C@H](CC(=O)N1CC[C@@H](NCc2cncs2)C1)c1ccccc1	ZINC001188040530	1388224412	/nfs/dbraw/zinc/22/44/12/1388224412.db2.gz	QVZHVQVVPAEKAR-NVXWUHKLSA-N	0	3	341.480	3.194	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2ccc(C)c(F)c2)[C@H](OC)C1	ZINC001213139325	1372847357	/nfs/dbraw/zinc/84/73/57/1372847357.db2.gz	NWSGGWSXKRUJNK-RTBURBONSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CN(CCC2=CCCCC2)C[C@H]1OC	ZINC001213263085	1372870663	/nfs/dbraw/zinc/87/06/63/1372870663.db2.gz	WAFFEXCUTGWPER-QZTJIDSGSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN([C@H](C)c2ccccc2C)C[C@H]1OC	ZINC001213350581	1372889613	/nfs/dbraw/zinc/88/96/13/1372889613.db2.gz	VVXQKQPQTSLLRZ-BHIYHBOVSA-N	0	3	330.472	3.228	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1CN(CCC2=CCCCC2)C[C@H]1OC	ZINC001213389812	1372899264	/nfs/dbraw/zinc/89/92/64/1372899264.db2.gz	IFJSSENAUVJFAO-QWFCFKBJSA-N	0	3	334.504	3.295	20	30		EGEDHN
CSc1ccc([C@H](CNC(=O)c2csc(C#N)c2)N(C)C)cc1	ZINC001326528451	1388230348	/nfs/dbraw/zinc/23/03/48/1388230348.db2.gz	DLLPYZAXHSRSEY-INIZCTEOSA-N	0	3	345.493	3.374	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)[C@@H](c2ccccc2)C(C)C)[C@H](OC)C1	ZINC001213496608	1372914164	/nfs/dbraw/zinc/91/41/64/1372914164.db2.gz	UFGMZWDERBPAMW-VAMGGRTRSA-N	0	3	344.499	3.208	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)[C@@H](CC)Cc2ccccc2)[C@H](OC)C1	ZINC001213506233	1372915889	/nfs/dbraw/zinc/91/58/89/1372915889.db2.gz	HAASEALBJBCNLU-XUVXKRRUSA-N	0	3	344.499	3.037	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H](NC(=O)c2ccsc2Cl)[C@H](OC)C1	ZINC001213532082	1372921264	/nfs/dbraw/zinc/92/12/64/1372921264.db2.gz	RHYUYBRQLWCXSN-MRVWCRGKSA-N	0	3	342.892	3.185	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@@H]2C[C@H]2C2CCC2)[C@H](OC)C1	ZINC001213555525	1372925283	/nfs/dbraw/zinc/92/52/83/1372925283.db2.gz	RFDBAOPTRINTNX-WJFTUGDTSA-N	0	3	336.520	3.208	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H](NC(=O)c2cc(C(C)C)oc2C)[C@H](OC)C1	ZINC001213655154	1372940824	/nfs/dbraw/zinc/94/08/24/1372940824.db2.gz	FDMSDFIABRVHSM-POZUXBRTSA-N	0	3	348.487	3.495	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)C[C@@H](C)n2cccc2)[C@H](OC)C1	ZINC001213753709	1372956790	/nfs/dbraw/zinc/95/67/90/1372956790.db2.gz	LMGSYEIBSQOUBV-GUDVDZBRSA-N	0	3	347.503	3.001	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H](NC(=O)c2cc3c(s2)CCC3)[C@H](OC)C1	ZINC001213814131	1372965878	/nfs/dbraw/zinc/96/58/78/1372965878.db2.gz	DWEBQNRJFLRGNX-FVQBIDKESA-N	0	3	348.512	3.021	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)[C@H](CC=C)c2ccccc2)[C@H](OC)C1	ZINC001213895600	1372976245	/nfs/dbraw/zinc/97/62/45/1372976245.db2.gz	IYJLQXDLBFVVTN-VAMGGRTRSA-N	0	3	342.483	3.128	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)C2(CC=C)CCCCC2)[C@H](OC)C1	ZINC001213903058	1372977942	/nfs/dbraw/zinc/97/79/42/1372977942.db2.gz	DXCPTKFZRZZDLI-QZTJIDSGSA-N	0	3	334.504	3.295	20	30		EGEDHN
C/C=C(\C)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001214413939	1373056851	/nfs/dbraw/zinc/05/68/51/1373056851.db2.gz	NLQYNPJMFBFLPY-UPJFGJQXSA-N	0	3	330.859	3.094	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@@H]2CC2(C)C)C[C@H]1NCC#Cc1cccc(Cl)c1	ZINC001214445765	1373062992	/nfs/dbraw/zinc/06/29/92/1373062992.db2.gz	MAICAUWDVWEFEC-FHLIZLRMSA-N	0	3	344.886	3.174	20	30		EGEDHN
C=C(C)CNCc1ccncc1O[C@H]1CCN(C(=O)[C@H](C)C(C)C)C1	ZINC001127898707	1373197914	/nfs/dbraw/zinc/19/79/14/1373197914.db2.gz	YYHWQVOCLVPGJR-AEFFLSMTSA-N	0	3	345.487	3.019	20	30		EGEDHN
CCC(CC)CC(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001216085904	1373259857	/nfs/dbraw/zinc/25/98/57/1373259857.db2.gz	CKPRMQRLKRPIJX-OXQOHEQNSA-N	0	3	344.474	3.440	20	30		EGEDHN
C=C(C)CCC(=O)NCCNCc1ccc(Br)c(F)c1	ZINC001128414019	1373264392	/nfs/dbraw/zinc/26/43/92/1373264392.db2.gz	SOHQWBZUGAALPU-UHFFFAOYSA-N	0	3	343.240	3.150	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)C/C=C\c2cccc(F)c2)cc1	ZINC001129730759	1373417552	/nfs/dbraw/zinc/41/75/52/1373417552.db2.gz	BSWQXOXEWMKODE-RQOWECAXSA-N	0	3	337.398	3.007	20	30		EGEDHN
Cc1ccc(CC(=O)NCCNCc2ccc(C#N)s2)cc1Cl	ZINC001130156957	1373463890	/nfs/dbraw/zinc/46/38/90/1373463890.db2.gz	AGZDNQNQDIDXBE-UHFFFAOYSA-N	0	3	347.871	3.030	20	30		EGEDHN
C=CCOc1ccc(C(=O)NCCN[C@@H](C)c2cccc(F)c2)cc1	ZINC001130371379	1373508284	/nfs/dbraw/zinc/50/82/84/1373508284.db2.gz	QBWKRSHQPCLNGQ-HNNXBMFYSA-N	0	3	342.414	3.471	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)C[C@H](CC)C(C)(C)C)C1	ZINC001130442344	1373541871	/nfs/dbraw/zinc/54/18/71/1373541871.db2.gz	JDSANDYFVDEYNS-WBVHZDCISA-N	0	3	346.519	3.464	20	30		EGEDHN
N#Cc1ccc(-c2ccc(Cl)cc2)nc1O[C@H]1CCNC[C@@H]1F	ZINC001218066560	1373552074	/nfs/dbraw/zinc/55/20/74/1373552074.db2.gz	MAURDZDLOPVEDN-HOCLYGCPSA-N	0	3	331.778	3.352	20	30		EGEDHN
COc1cc([O-])cc(O[C@H]2C[NH2+][C@H]2C)c1C(=O)/C=C/c1ccccc1	ZINC001218385930	1373604480	/nfs/dbraw/zinc/60/44/80/1373604480.db2.gz	MLNUDYWXZZYUBW-WLOHWFEXSA-N	0	3	339.391	3.036	20	30		EGEDHN
CC(C)=C[C@@H]1[C@@H](C(=O)NCCNCc2ccc(F)c(C#N)c2)C1(C)C	ZINC001131087232	1373639546	/nfs/dbraw/zinc/63/95/46/1373639546.db2.gz	BFNCBMXZWKGBJJ-AEFFLSMTSA-N	0	3	343.446	3.142	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)[C@H](C)CC3CCCCC3)[C@H]2C1	ZINC001218716113	1373646493	/nfs/dbraw/zinc/64/64/93/1373646493.db2.gz	UURMRHBRNAQPME-YZGWKJHDSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)[C@H](CC)CCC)[C@H]2C1	ZINC001218851965	1373661569	/nfs/dbraw/zinc/66/15/69/1373661569.db2.gz	MZSQRPMQRBPVOB-CEXWTWQISA-N	0	3	336.520	3.471	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)c3cccn3CC)[C@H]2C1	ZINC001219035162	1373682062	/nfs/dbraw/zinc/68/20/62/1373682062.db2.gz	KPQJPOZYTXMVEI-RBUKOAKNSA-N	0	3	347.503	3.004	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)[C@@H](CCCC)C(C)C)[C@H]2C1	ZINC001219059150	1373684256	/nfs/dbraw/zinc/68/42/56/1373684256.db2.gz	YCSNZGVETQQBAO-GBESFXJTSA-N	0	3	336.520	3.327	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CN([C@H](C)c2ccc3ccccc3c2)C[C@@H]1O	ZINC001219326235	1373700798	/nfs/dbraw/zinc/70/07/98/1373700798.db2.gz	NCRFLNZHVBBKEV-YSGRDPCXSA-N	0	3	338.451	3.028	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCO[C@H]1C1CCN(C(=O)/C(C)=C\CC)CC1	ZINC001131456430	1373701483	/nfs/dbraw/zinc/70/14/83/1373701483.db2.gz	PNPQYTFVHKPEBT-DTMMCCNQSA-N	0	3	340.895	3.081	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@@H]2CCC(C)=C(C)C2)[C@@H](O)C1	ZINC001219684152	1373725115	/nfs/dbraw/zinc/72/51/15/1373725115.db2.gz	JVKHBOAKGIPOKM-QRVBRYPASA-N	0	3	336.520	3.255	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2ccccc2C(C)(C)CC)[C@@H](O)C1	ZINC001219855168	1373736484	/nfs/dbraw/zinc/73/64/84/1373736484.db2.gz	OSOXQLSVXIZFBX-MOPGFXCFSA-N	0	3	344.499	3.115	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)C(C)(C)c2ccccc2)[C@@H](O)C1	ZINC001220931682	1373766531	/nfs/dbraw/zinc/76/65/31/1373766531.db2.gz	DTRHNYYAEWVJKN-MOPGFXCFSA-N	0	3	346.515	3.096	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@H](C)O[C@@]3(CCN(CC(=C)C)C3)C2)CCCC1	ZINC001131703568	1373771764	/nfs/dbraw/zinc/77/17/64/1373771764.db2.gz	DQTHHRUJVDWREV-GHTZIAJQSA-N	0	3	346.515	3.391	20	30		EGEDHN
C=CCCCCCN1C[C@H](NC(=O)c2snnc2C)CC[C@H]1C	ZINC001131779769	1373800194	/nfs/dbraw/zinc/80/01/94/1373800194.db2.gz	JZDKSIBUNYWNDL-UKRRQHHQSA-N	0	3	336.505	3.176	20	30		EGEDHN
CCC(C)(C)C(=O)NCC1(NCc2ccc(OC)c(C#N)c2)CCC1	ZINC001326878284	1388337896	/nfs/dbraw/zinc/33/78/96/1388337896.db2.gz	SOFYOQUYZKQVRH-UHFFFAOYSA-N	0	3	343.471	3.132	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC[C@H](C)N(Cc2ccccc2N(C)C)C1	ZINC001131898606	1375034437	/nfs/dbraw/zinc/03/44/37/1375034437.db2.gz	BKFQENYODXBQHP-WMZOPIPTSA-N	0	3	329.488	3.188	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)CCc2ccc(Cl)cc2)s1	ZINC001131982783	1375081991	/nfs/dbraw/zinc/08/19/91/1375081991.db2.gz	FGWCMAQZPPPGKU-UHFFFAOYSA-N	0	3	347.871	3.112	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CC[C@@H](C)N(CCCCC(F)(F)F)C1	ZINC001132002339	1375092528	/nfs/dbraw/zinc/09/25/28/1375092528.db2.gz	ISZXFJZDAUCKNP-CABCVRRESA-N	0	3	332.410	3.492	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccc(F)cc1	ZINC001225682134	1375143535	/nfs/dbraw/zinc/14/35/35/1375143535.db2.gz	NYQBUTCGMLNWLH-IPMKNSEASA-N	0	3	342.458	3.240	20	30		EGEDHN
CCN1CCC[C@@H](Oc2nc(C)c(Br)c(C)c2C#N)C1	ZINC001226203204	1375219963	/nfs/dbraw/zinc/21/99/63/1375219963.db2.gz	FRDDKKRWVZTOEQ-GFCCVEGCSA-N	0	3	338.249	3.196	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCOc2ccc(F)cc2)CC[C@@H]1C	ZINC001132252083	1375246869	/nfs/dbraw/zinc/24/68/69/1375246869.db2.gz	AMSNAJINNACKKT-DOTOQJQBSA-N	0	3	334.435	3.140	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CC[C@H](C)N(CCOCC3CC3)C2)CCC1	ZINC001132281814	1375263896	/nfs/dbraw/zinc/26/38/96/1375263896.db2.gz	FUCPBBBRYAWLRE-FUHWJXTLSA-N	0	3	334.504	3.129	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2(Cc3ccc(F)cc3)CC2)CC[C@@H]1C	ZINC001132340674	1375320891	/nfs/dbraw/zinc/32/08/91/1375320891.db2.gz	XCBNGIJXWAUCDL-QFBILLFUSA-N	0	3	342.458	3.141	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc(CCCCC)n[nH]2)CC[C@@H]1C	ZINC001132348726	1375325806	/nfs/dbraw/zinc/32/58/06/1375325806.db2.gz	RESHSLKYQHVOAS-DOTOQJQBSA-N	0	3	332.492	3.301	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCN(C)c2ccccc2)CC[C@H]1C	ZINC001132365421	1375331189	/nfs/dbraw/zinc/33/11/89/1375331189.db2.gz	KCHFCMGXOYNWJQ-MSOLQXFVSA-N	0	3	329.488	3.058	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C(C)(C)CC2CCOCC2)CC[C@H]1C	ZINC001132397304	1375352474	/nfs/dbraw/zinc/35/24/74/1375352474.db2.gz	RAOGIMVUHBSSJU-AEFFLSMTSA-N	0	3	336.520	3.375	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C(C)(C)Cc2ccccc2)CC[C@H]1C	ZINC001132409655	1375359214	/nfs/dbraw/zinc/35/92/14/1375359214.db2.gz	CKIBLMFSBWFPRU-IEBWSBKVSA-N	0	3	326.484	3.248	20	30		EGEDHN
C#CCCCCC(=O)NC1CCN(Cc2ccc(CF)cc2)CC1	ZINC001226951814	1375367204	/nfs/dbraw/zinc/36/72/04/1375367204.db2.gz	JNPVNDLSHCSGHM-UHFFFAOYSA-N	0	3	330.447	3.430	20	30		EGEDHN
C#CCCCC(=O)NC1CCN([C@@H]2CCc3ccc(F)cc32)CC1	ZINC001227107604	1375391135	/nfs/dbraw/zinc/39/11/35/1375391135.db2.gz	FSUIVBKPQDQBCA-LJQANCHMSA-N	0	3	328.431	3.197	20	30		EGEDHN
C#CCCCC(=O)NC1CCN(CCOc2cccc(CC)c2)CC1	ZINC001227108006	1375391172	/nfs/dbraw/zinc/39/11/72/1375391172.db2.gz	KGUATNOVRUOTCG-UHFFFAOYSA-N	0	3	342.483	3.012	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COc2ccc(OCC)cc2)CC[C@H]1C	ZINC001132460206	1375403497	/nfs/dbraw/zinc/40/34/97/1375403497.db2.gz	HGOJISLKDWSKAJ-IAGOWNOFSA-N	0	3	346.471	3.009	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2CC[C@H](C)N(CCOC(C)C)C2)CCCCC1	ZINC001132530375	1375445011	/nfs/dbraw/zinc/44/50/11/1375445011.db2.gz	XLVOUFSJTQHJPJ-RBUKOAKNSA-N	0	3	348.531	3.354	20	30		EGEDHN
C#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)C(C)(C)C=C)CC1	ZINC001132554725	1375460940	/nfs/dbraw/zinc/46/09/40/1375460940.db2.gz	LBLKRYFCGWGGNZ-IBGZPJMESA-N	0	3	339.483	3.110	20	30		EGEDHN
C#CCN1CC[C@@H](CN(Cc2scnc2C)C(=O)C(CC)CC)C1	ZINC001132558620	1375465076	/nfs/dbraw/zinc/46/50/76/1375465076.db2.gz	NKCJEAOIDLWZGA-MRXNPFEDSA-N	0	3	347.528	3.171	20	30		EGEDHN
C#CCN1CC[C@@H](CN(Cc2scnc2C)C(=O)[C@@H](C)C(C)C)C1	ZINC001132562060	1375468399	/nfs/dbraw/zinc/46/83/99/1375468399.db2.gz	DNIJEGZJDMAIKX-DOTOQJQBSA-N	0	3	347.528	3.027	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CCCC[C@H]1NCc1cncc(F)c1	ZINC001228111498	1375517684	/nfs/dbraw/zinc/51/76/84/1375517684.db2.gz	CFUTZKUBYVFXIV-ZTFGCOKTSA-N	0	3	333.451	3.340	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](C)[C@@H](CNCc2nc(C)cs2)C1	ZINC001132761693	1375551993	/nfs/dbraw/zinc/55/19/93/1375551993.db2.gz	KRWJGWDSYDNLFO-WBVHZDCISA-N	0	3	347.528	3.219	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](C)[C@@H](CNCc2nc(C)sc2C)C1	ZINC001132786221	1375564005	/nfs/dbraw/zinc/56/40/05/1375564005.db2.gz	QHDWPGXPQUQRPH-YOEHRIQHSA-N	0	3	347.528	3.138	20	30		EGEDHN
C[C@@H]1CCN(C(=O)C#CC(C)(C)C)C[C@@H]1CNC/C(Cl)=C\Cl	ZINC001132820371	1375583159	/nfs/dbraw/zinc/58/31/59/1375583159.db2.gz	ULFGRTCWHQBEDP-PWCXKOHKSA-N	0	3	345.314	3.429	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](C)[C@@H](CNCc2cnc(C)o2)C1	ZINC001132843347	1375595104	/nfs/dbraw/zinc/59/51/04/1375595104.db2.gz	LNZGPSOAOMFTSS-YJBOKZPZSA-N	0	3	345.487	3.326	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](C)[C@H](CNCc2csc(C)n2)C1	ZINC001132866144	1375610551	/nfs/dbraw/zinc/61/05/51/1375610551.db2.gz	WMUOSWIAPQXLDN-GDBMZVCRSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CCN(Cc2cccc(N(C)C)c2)CC1	ZINC001228621941	1375618352	/nfs/dbraw/zinc/61/83/52/1375618352.db2.gz	HIDMYURWJKVSIC-UHFFFAOYSA-N	0	3	329.488	3.045	20	30		EGEDHN
CC#CCCCC(=O)NC1CCN(Cc2ccccc2N(C)C)CC1	ZINC001228718613	1375652212	/nfs/dbraw/zinc/65/22/12/1375652212.db2.gz	RMUNEXGLDUYIKE-UHFFFAOYSA-N	0	3	341.499	3.027	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NC1CCN(Cc2ccc(COC)cc2)CC1	ZINC001228748931	1375662001	/nfs/dbraw/zinc/66/20/01/1375662001.db2.gz	OMTXUABMOMSMCS-IRXDYDNUSA-N	0	3	344.499	3.372	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NC1CCN(CCc2ccccc2F)CC1	ZINC001228750412	1375663320	/nfs/dbraw/zinc/66/33/20/1375663320.db2.gz	YEKSBBWBIPLPKN-CVEARBPZSA-N	0	3	332.463	3.407	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NC1CCN(CCOc2ccccc2)CC1	ZINC001228750436	1375663543	/nfs/dbraw/zinc/66/35/43/1375663543.db2.gz	YRUFMDNMKSUQDK-DLBZAZTESA-N	0	3	330.472	3.104	20	30		EGEDHN
CC#CCCCC(=O)NC1CCN(Cc2ccc(F)cc2C)CC1	ZINC001228770361	1375671268	/nfs/dbraw/zinc/67/12/68/1375671268.db2.gz	JODARTLQCYLVJQ-UHFFFAOYSA-N	0	3	330.447	3.408	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC1CCN(Cc2ccccc2N(C)C)CC1	ZINC001228810426	1375684960	/nfs/dbraw/zinc/68/49/60/1375684960.db2.gz	VPFMRIXQUXLSSF-KRWDZBQOSA-N	0	3	343.515	3.436	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccc(F)cc1	ZINC001228901960	1375710148	/nfs/dbraw/zinc/71/01/48/1375710148.db2.gz	OPUCXQQUAOEAJE-PWIZWCRZSA-N	0	3	344.474	3.486	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](C)[C@@H](CNCc2ncc(C)s2)C1	ZINC001133068676	1375755896	/nfs/dbraw/zinc/75/58/96/1375755896.db2.gz	JIQWIBTYCKDMDR-WBVHZDCISA-N	0	3	347.528	3.219	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](C)[C@H](CNCc3cnc(C)o3)C2)CCC1	ZINC001133104784	1375777074	/nfs/dbraw/zinc/77/70/74/1375777074.db2.gz	KCYFOESLJPQXCD-DOTOQJQBSA-N	0	3	345.487	3.304	20	30		EGEDHN
CCCCCC(=O)N1CC[C@@H](N(C)Cc2ccc(OCC#N)cc2)C1	ZINC001188905339	1388404838	/nfs/dbraw/zinc/40/48/38/1388404838.db2.gz	CXVYFFGCWVIQDY-GOSISDBHSA-N	0	3	343.471	3.202	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)[C@@H](C)c2ccc(CC)cc2)CC1	ZINC001229616854	1375865328	/nfs/dbraw/zinc/86/53/28/1375865328.db2.gz	UUTWJYVJHBSKFC-KRWDZBQOSA-N	0	3	344.499	3.136	20	30		EGEDHN
Cc1ccc(C(=O)NCCNCc2ccc(F)c(C#N)c2)cc1Cl	ZINC001133262276	1375878217	/nfs/dbraw/zinc/87/82/17/1375878217.db2.gz	ZKMSTTPLYOMQGZ-UHFFFAOYSA-N	0	3	345.805	3.179	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)C[C@H]2CCCC(C)(C)C2)CC1	ZINC001230035836	1375934031	/nfs/dbraw/zinc/93/40/31/1375934031.db2.gz	XLLBZVMROXSEKL-QGZVFWFLSA-N	0	3	336.520	3.376	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1ccco1	ZINC001133377290	1375958219	/nfs/dbraw/zinc/95/82/19/1375958219.db2.gz	PVTLDHFXLQUBHT-UHFFFAOYSA-N	0	3	330.815	3.188	20	30		EGEDHN
C=CCC1(C(=O)NCCN[C@@H]2CCc3c2cc(F)cc3F)CCC1	ZINC001133392056	1375977190	/nfs/dbraw/zinc/97/71/90/1375977190.db2.gz	FNDPIBZECPLXGL-QGZVFWFLSA-N	0	3	334.410	3.404	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@]12C[C@H]1CCCC2	ZINC001133403852	1375987950	/nfs/dbraw/zinc/98/79/50/1375987950.db2.gz	MWPCORIJTLVZJF-YLJYHZDGSA-N	0	3	344.886	3.472	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)Cc1ccco1	ZINC001133410756	1375995487	/nfs/dbraw/zinc/99/54/87/1375995487.db2.gz	ZSYUAPGKKMVGJO-UHFFFAOYSA-N	0	3	344.842	3.117	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2ccccc2CC(C)C)CC1	ZINC001230397485	1376017467	/nfs/dbraw/zinc/01/74/67/1376017467.db2.gz	VPZBLXYBFHJUFJ-UHFFFAOYSA-N	0	3	344.499	3.282	20	30		EGEDHN
C=CCCOCC(=O)NC1CCN(Cc2cc(C)sc2C)CC1	ZINC001230407504	1376022893	/nfs/dbraw/zinc/02/28/93/1376022893.db2.gz	SGFDSUYTYGVTIO-UHFFFAOYSA-N	0	3	336.501	3.038	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2ccc(CC)c(CC)c2)CC1	ZINC001230479888	1376037092	/nfs/dbraw/zinc/03/70/92/1376037092.db2.gz	ZGIADYZMSDTHTN-UHFFFAOYSA-N	0	3	344.499	3.208	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)Cc1cccs1)NCc1ccccc1C#N	ZINC001133521501	1376055309	/nfs/dbraw/zinc/05/53/09/1376055309.db2.gz	SLFXIIKHIAKQJA-GJZGRUSLSA-N	0	3	341.480	3.235	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1C1CCN(C(=O)CO[C@H](C)CC)CC1	ZINC001230547954	1376068077	/nfs/dbraw/zinc/06/80/77/1376068077.db2.gz	DEMYZVWZMBUYMZ-NVXWUHKLSA-N	0	3	342.911	3.257	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1C1CCN(C(=O)CO[C@@H](C)CC)CC1	ZINC001230547955	1376068149	/nfs/dbraw/zinc/06/81/49/1376068149.db2.gz	DEMYZVWZMBUYMZ-RDJZCZTQSA-N	0	3	342.911	3.257	20	30		EGEDHN
C#CCCCCC(=O)N1CCC([C@H]2CCCN2Cc2ccon2)CC1	ZINC001230549761	1376072266	/nfs/dbraw/zinc/07/22/66/1376072266.db2.gz	UAOKOYWRZPHXJR-LJQANCHMSA-N	0	3	343.471	3.071	20	30		EGEDHN
C#CCCN(CCCNC(=O)C(CC=C)CC=C)Cc1cccnc1	ZINC001230769254	1376144798	/nfs/dbraw/zinc/14/47/98/1376144798.db2.gz	HETWMAKADTVUOP-UHFFFAOYSA-N	0	3	339.483	3.182	20	30		EGEDHN
C#CCCN(CCCNC(=O)[C@@]1(C)CC=CCC1)Cc1cccnc1	ZINC001230769408	1376145002	/nfs/dbraw/zinc/14/50/02/1376145002.db2.gz	PCXQBQONDSRMLR-NRFANRHFSA-N	0	3	339.483	3.160	20	30		EGEDHN
C#CCCN(CCCNC(=O)c1ccc(C)cc1C)Cc1cccnc1	ZINC001230911295	1376181389	/nfs/dbraw/zinc/18/13/89/1376181389.db2.gz	DDPSWKBGZHDDCR-UHFFFAOYSA-N	0	3	349.478	3.344	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)CC(F)(F)F)NCc1cc(F)ccc1C#N	ZINC001133849328	1376232897	/nfs/dbraw/zinc/23/28/97/1376232897.db2.gz	VWYRRPOUSOVQPK-MNOVXSKESA-N	0	3	345.340	3.023	20	30		EGEDHN
O=C1NC2(CO1)CCN(Cc1ccccc1C#Cc1ccccc1)CC2	ZINC001231578140	1376269490	/nfs/dbraw/zinc/26/94/90/1376269490.db2.gz	JAAMTGCDPCECAX-UHFFFAOYSA-N	0	3	346.430	3.161	20	30		EGEDHN
C#Cc1cccc(CN2CCC3(CC2)C(=O)N(C)[C@H]3c2ccccc2)c1	ZINC001231656965	1376296322	/nfs/dbraw/zinc/29/63/22/1376296322.db2.gz	KMCCEJXMTVPOEW-NRFANRHFSA-N	0	3	344.458	3.463	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H]2CN(Cc3cccc(OC)c3C)C[C@H]21	ZINC001189007100	1388434591	/nfs/dbraw/zinc/43/45/91/1388434591.db2.gz	NVDSQAKKRIXHDV-RBUKOAKNSA-N	0	3	342.483	3.393	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H](C)C[C@@H](C)NCc1nc(C(C)(C)C)cs1	ZINC001134316847	1376471402	/nfs/dbraw/zinc/47/14/02/1376471402.db2.gz	BWOTZFFZAKIEQP-CABCVRRESA-N	0	3	349.544	3.473	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@H]1CCN(Cc1cccc(CF)n1)C2	ZINC001232534573	1376477666	/nfs/dbraw/zinc/47/76/66/1376477666.db2.gz	RWXJKFWJZJHGNG-OALUTQOASA-N	0	3	334.435	3.125	20	30		EGEDHN
Cc1nc(CN[C@H](C)C[C@H](C)NC(=O)C#CC(C)(C)C)c(C)s1	ZINC001134329242	1376479304	/nfs/dbraw/zinc/47/93/04/1376479304.db2.gz	MDFBLIVFXUQWDY-OLZOCXBDSA-N	0	3	335.517	3.182	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CC[C@@]2(CCN2C(=O)OC(C)(C)C)C1	ZINC001233080135	1376566222	/nfs/dbraw/zinc/56/62/22/1376566222.db2.gz	SUAJBNCKNLAZDX-HXUWFJFHSA-N	0	3	341.455	3.452	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCC[C@](O)(C(F)(F)F)[C@H](C)C1	ZINC001233080534	1376566326	/nfs/dbraw/zinc/56/63/26/1376566326.db2.gz	NKDNYBVXFRNNAF-CZUORRHYSA-N	0	3	326.362	3.392	20	30		EGEDHN
COc1cccc(O[C@@H]2CCCN(Cc3ccc(C#N)cc3C)C2)n1	ZINC001233083245	1376567743	/nfs/dbraw/zinc/56/77/43/1376567743.db2.gz	BGTQFFHWFFMJPI-GOSISDBHSA-N	0	3	337.423	3.314	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@@H]1CCN(Cc1cnc(C)c(C)c1)C2	ZINC001233158233	1376577235	/nfs/dbraw/zinc/57/72/35/1376577235.db2.gz	DODSFOWXVYFHQP-UXHICEINSA-N	0	3	330.472	3.272	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2cc(C3CC3)no2)CCC1	ZINC001134566495	1376598940	/nfs/dbraw/zinc/59/89/40/1376598940.db2.gz	FWIMTGBDSNMSOW-CABCVRRESA-N	0	3	343.471	3.119	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H](C)C[C@@H](C)NCc1ncc(C)s1	ZINC001134637625	1376636300	/nfs/dbraw/zinc/63/63/00/1376636300.db2.gz	DNZHDUMGNIYUNM-KGLIPLIRSA-N	0	3	346.500	3.126	20	30		EGEDHN
C=CCOCCCC(=O)N(C)C[C@H]1CCN1CCc1ccc(C)cc1	ZINC001233491670	1376653953	/nfs/dbraw/zinc/65/39/53/1376653953.db2.gz	YQTSXOYTDDASNS-HXUWFJFHSA-N	0	3	344.499	3.053	20	30		EGEDHN
C=CCOCCCC(=O)N(C)C[C@H]1CCN1[C@@H]1CCc2ccccc21	ZINC001233489612	1376654676	/nfs/dbraw/zinc/65/46/76/1376654676.db2.gz	KYYPXVFSQBNCIE-UYAOXDASSA-N	0	3	342.483	3.189	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)C1(C2CC2)CC1)NCc1ccccc1C#N	ZINC001134694418	1376665644	/nfs/dbraw/zinc/66/56/44/1376665644.db2.gz	RKAPBCOKRYNXMF-GJZGRUSLSA-N	0	3	325.456	3.121	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)c1ccc(CC)o1	ZINC001134749195	1376698128	/nfs/dbraw/zinc/69/81/28/1376698128.db2.gz	QPKPVJPRCCNVIH-NEPJUHHUSA-N	0	3	343.265	3.237	20	30		EGEDHN
CN(C[C@@H]1CCN1CC/C=C/c1ccccc1)C(=O)c1c[nH]c(C#N)c1	ZINC001233743056	1376709110	/nfs/dbraw/zinc/70/91/10/1376709110.db2.gz	URGPBXOFEGTQKN-MRSBXDGLSA-N	0	3	348.450	3.136	20	30		EGEDHN
C[C@H]1CC[C@@](C)(C(=O)NCCNCc2cccc(C#N)c2)C1(C)C	ZINC001134783035	1376717860	/nfs/dbraw/zinc/71/78/60/1376717860.db2.gz	RNESDDYGROPSBK-YWZLYKJASA-N	0	3	327.472	3.226	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)C1(F)CCCC1)NCc1ccccc1C#N	ZINC001134790755	1376723751	/nfs/dbraw/zinc/72/37/51/1376723751.db2.gz	HTAOEGIYUVNALD-GJZGRUSLSA-N	0	3	331.435	3.213	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)C1(F)CCCC1	ZINC001134792140	1376726094	/nfs/dbraw/zinc/72/60/94/1376726094.db2.gz	ZAEPCCNZLZKIJV-NWDGAFQWSA-N	0	3	335.261	3.050	20	30		EGEDHN
CC[C@H](Cc1cccc(C)c1)C(=O)NCCNCc1ccc(C#N)cc1	ZINC001134846982	1376752691	/nfs/dbraw/zinc/75/26/91/1376752691.db2.gz	LONFVRWYIRSWFB-OAQYLSRUSA-N	0	3	349.478	3.341	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)C1(CCF)CC1)NCc1cc(F)ccc1C#N	ZINC001135065976	1376877468	/nfs/dbraw/zinc/87/74/68/1376877468.db2.gz	MUXHSULVCWSRMI-KBPBESRZSA-N	0	3	349.425	3.210	20	30		EGEDHN
CC#CCCCC(=O)N[C@H](C)C[C@@H](C)NCc1nc2ccccc2o1	ZINC001135236060	1376992660	/nfs/dbraw/zinc/99/26/60/1376992660.db2.gz	PRMSYQQIZYCRMW-HZPDHXFCSA-N	0	3	341.455	3.394	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)CCCC1CC1	ZINC001135246417	1376999139	/nfs/dbraw/zinc/99/91/39/1376999139.db2.gz	HMHRQDHUDGFBON-CHWSQXEVSA-N	0	3	331.298	3.348	20	30		EGEDHN
CCc1cc(CN2CC[C@]3(C[C@@H](OCC4CC4)CO3)C2)ccc1C#N	ZINC001238776337	1377001441	/nfs/dbraw/zinc/00/14/41/1377001441.db2.gz	VEPPAXCDBNFBHN-RTWAWAEBSA-N	0	3	340.467	3.281	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H](C)C[C@@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001135418949	1377084628	/nfs/dbraw/zinc/08/46/28/1377084628.db2.gz	ISVDNVKDJTZAMF-CABCVRRESA-N	0	3	343.446	3.427	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H](C)C[C@@H](C)NCc2nc(C)sc2C)C1	ZINC001135426983	1377091197	/nfs/dbraw/zinc/09/11/97/1377091197.db2.gz	KEIPTZWKJQMQQV-OLZOCXBDSA-N	0	3	335.517	3.489	20	30		EGEDHN
CC(C)C1(C(=O)N[C@@H](C)C[C@@H](C)NCc2ccccc2C#N)CC1	ZINC001135439158	1377098722	/nfs/dbraw/zinc/09/87/22/1377098722.db2.gz	RXXNKWREPLFMQP-CVEARBPZSA-N	0	3	327.472	3.367	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CCC(=O)N(Cc2ccccc2)CC1	ZINC001258572144	1377117815	/nfs/dbraw/zinc/11/78/15/1377117815.db2.gz	JDZJTEAGVIDMTO-HXUWFJFHSA-N	0	3	333.435	3.229	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H](C)C[C@@H](C)NCc1csnc1OC	ZINC001135565203	1377148011	/nfs/dbraw/zinc/14/80/11/1377148011.db2.gz	QVTNLTSNYSXTGO-OLZOCXBDSA-N	0	3	339.505	3.127	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)CCC1(C)CC1	ZINC001135840519	1377228843	/nfs/dbraw/zinc/22/88/43/1377228843.db2.gz	KEBZAUXTDMDYTR-STQMWFEESA-N	0	3	331.298	3.348	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)c1ccc(C)cc1	ZINC001136006166	1377296567	/nfs/dbraw/zinc/29/65/67/1377296567.db2.gz	JCCAEGLRMKMEPV-ZIAGYGMSSA-N	0	3	339.277	3.390	20	30		EGEDHN
CC[C@H]1CCCC[C@H]1C(=O)NCCNCc1ccc(C#N)c(F)c1	ZINC001136081174	1377334223	/nfs/dbraw/zinc/33/42/23/1377334223.db2.gz	QIBBAAHUBQHIGF-DOTOQJQBSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CC[C@H](N(C)C/C=C/c2ccccc2)C1	ZINC001189243339	1388494756	/nfs/dbraw/zinc/49/47/56/1388494756.db2.gz	VATFCKZBMVVPMV-QQNBDIPXSA-N	0	3	342.483	3.214	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CC[C@H](N(C)Cc2ccc(CF)cc2)C1	ZINC001189242126	1388493696	/nfs/dbraw/zinc/49/36/96/1388493696.db2.gz	FLDAABUCGNYKJB-APWZRJJASA-N	0	3	348.462	3.170	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)CC3CCCCCC3)[C@@H]2C1	ZINC001189252813	1388497113	/nfs/dbraw/zinc/49/71/13/1388497113.db2.gz	BWBCWEKDJVMNTG-RBUKOAKNSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3c[nH]c4cc(C)ccc34)C2)C1=O	ZINC001136970537	1377447101	/nfs/dbraw/zinc/44/71/01/1377447101.db2.gz	SOIGBWMNTPMBSX-NRFANRHFSA-N	0	3	337.467	3.477	20	30		EGEDHN
C=CCN1C(=O)CCC12CCN(Cc1c[nH]c3c1cccc3F)CC2	ZINC001137053035	1377468299	/nfs/dbraw/zinc/46/82/99/1377468299.db2.gz	WBBNKKVCQPYDEO-UHFFFAOYSA-N	0	3	341.430	3.450	20	30		EGEDHN
O=C1C=C2CN(Cc3ccc(F)c(Br)c3)CCC2S1	ZINC001137553203	1377564890	/nfs/dbraw/zinc/56/48/90/1377564890.db2.gz	CRVRQPRPWZKDIB-CYBMUJFWSA-N	0	3	342.233	3.362	20	30		EGEDHN
COC(CN(C)Cc1ccc(N(C)c2ccc(C#N)cc2)cc1)OC	ZINC001137902739	1377642064	/nfs/dbraw/zinc/64/20/64/1377642064.db2.gz	QJCZWCNOPLZQJR-UHFFFAOYSA-N	0	3	339.439	3.377	20	30		EGEDHN
C#CCOc1ccc(CN(C)Cc2ccc(OC)cc2)cc1OC	ZINC001138342753	1377706656	/nfs/dbraw/zinc/70/66/56/1377706656.db2.gz	CTCFHXUIFFJHEU-UHFFFAOYSA-N	0	3	325.408	3.348	20	30		EGEDHN
C#CCOc1ccc(CN2CC[C@H](Oc3ccccc3OC)C2)cc1	ZINC001138557901	1377741878	/nfs/dbraw/zinc/74/18/78/1377741878.db2.gz	VJLPEANCMACRLT-IBGZPJMESA-N	0	3	337.419	3.361	20	30		EGEDHN
C#CCOc1ccc(CN2CC[C@@H](Oc3ccc(F)cc3)C2)cc1	ZINC001138559629	1377742039	/nfs/dbraw/zinc/74/20/39/1377742039.db2.gz	YOLQNBNJYCSUEI-HXUWFJFHSA-N	0	3	325.383	3.491	20	30		EGEDHN
C#CCOc1ccc(CN2CC[C@H](CC(=O)OC(C)(C)C)C2)cc1	ZINC001138560349	1377742043	/nfs/dbraw/zinc/74/20/43/1377742043.db2.gz	SHUMNNTYRZZEPV-QGZVFWFLSA-N	0	3	329.440	3.252	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCCC[C@@](O)(C(F)(F)F)C2)c1[O-]	ZINC001138625946	1377756212	/nfs/dbraw/zinc/75/62/12/1377756212.db2.gz	XYGCEFBUUGJPJW-INIZCTEOSA-N	0	3	329.362	3.400	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCCC[C@@](O)(C(F)(F)F)C2)c1[O-]	ZINC001138625946	1377756213	/nfs/dbraw/zinc/75/62/13/1377756213.db2.gz	XYGCEFBUUGJPJW-INIZCTEOSA-N	0	3	329.362	3.400	20	30		EGEDHN
C=CCOc1ccccc1CN1CCC2(CC(=O)N(CC)C2)CC1	ZINC001139031438	1377820283	/nfs/dbraw/zinc/82/02/83/1377820283.db2.gz	YSRHCIOFRPNZQG-UHFFFAOYSA-N	0	3	328.456	3.086	20	30		EGEDHN
N#Cc1ccnc(-c2ccc(CN3CCc4c(cc[nH]c4=O)C3)cc2)c1	ZINC001139406088	1377880284	/nfs/dbraw/zinc/88/02/84/1377880284.db2.gz	LZDZAFAVSRJKLP-UHFFFAOYSA-N	0	3	342.402	3.279	20	30		EGEDHN
CCN(CCn1ccnc1)Cc1ccc(Oc2ccc(C#N)cc2)nc1	ZINC001139428426	1377883512	/nfs/dbraw/zinc/88/35/12/1377883512.db2.gz	JRGZMCMRAJUXKS-UHFFFAOYSA-N	0	3	347.422	3.464	20	30		EGEDHN
C=CCN1C(=O)CC[C@@]12CCCN(Cc1ccc(C#N)c(F)c1)CC2	ZINC001139527381	1377897308	/nfs/dbraw/zinc/89/73/08/1377897308.db2.gz	CUVWJAMWUMEYQC-HXUWFJFHSA-N	0	3	341.430	3.230	20	30		EGEDHN
COc1cc2c(cc1OC)[C@@H](CN(C)Cc1cc(C#N)ccc1F)C2	ZINC001139650025	1377926295	/nfs/dbraw/zinc/92/62/95/1377926295.db2.gz	PBZAVLFORVTXCY-OAHLLOKOSA-N	0	3	340.398	3.486	20	30		EGEDHN
COCC[C@H]1CO[C@@]2(C1)CCCN(Cc1ccc(C)c(C#N)c1)C2	ZINC001139725368	1377941991	/nfs/dbraw/zinc/94/19/91/1377941991.db2.gz	MNNGMNFYQSODQX-UYAOXDASSA-N	0	3	328.456	3.274	20	30		EGEDHN
Cc1ccc(CN2C[C@H]3CN(C(=O)c4ccccc4)C[C@@H]3C2)cc1C#N	ZINC001139724995	1377942114	/nfs/dbraw/zinc/94/21/14/1377942114.db2.gz	YOEWGRZGNXXMJH-SFTDATJTSA-N	0	3	345.446	3.071	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CCN(Cc3ccc(C)nc3)CC2)CC1	ZINC001139926845	1377977320	/nfs/dbraw/zinc/97/73/20/1377977320.db2.gz	BJKMEJAZCUDWKZ-UHFFFAOYSA-N	0	3	343.471	3.391	20	30		EGEDHN
Cc1cc(CN2CCC3(C[C@H]3C(=O)NCCCC#N)CC2)ccc1F	ZINC001272686707	1378078832	/nfs/dbraw/zinc/07/88/32/1378078832.db2.gz	PNEKBBYNOXHGGQ-KRWDZBQOSA-N	0	3	343.446	3.156	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1sc(CC)nc1C)C1CC1	ZINC001753526275	1440429709	/nfs/dbraw/zinc/42/97/09/1440429709.db2.gz	SITWRULENGCISU-MRXNPFEDSA-N	0	3	341.908	3.255	20	30		EGEDHN
C#Cc1cccc(CN2CCC[C@@]3(CCN(CCCC#N)C3=O)CC2)c1	ZINC001276712506	1378183612	/nfs/dbraw/zinc/18/36/12/1378183612.db2.gz	PALVRYCBLTXBPY-QFIPXVFZSA-N	0	3	349.478	3.176	20	30		EGEDHN
C=CCO[C@@H]1CO[C@@]2(C1)CCCN(Cc1cnc(CCCC)[nH]1)C2	ZINC001141069921	1378228901	/nfs/dbraw/zinc/22/89/01/1378228901.db2.gz	IPGYDKWEXMPJRH-PKOBYXMFSA-N	0	3	333.476	3.078	20	30		EGEDHN
CC[C@H](CNC(=O)c1ccc(C)c(C#N)c1)N1CCc2ccccc2C1	ZINC001141569294	1378344869	/nfs/dbraw/zinc/34/48/69/1378344869.db2.gz	FPDRGBRXIUXJST-OAQYLSRUSA-N	0	3	347.462	3.433	20	30		EGEDHN
C=C1CC=C(F)C=C1NC(=O)C1CCN(Cc2ccncc2)CC1	ZINC001142349778	1378435043	/nfs/dbraw/zinc/43/50/43/1378435043.db2.gz	KGBMYFUJVOQWRO-UHFFFAOYSA-N	0	3	327.403	3.107	20	30		EGEDHN
C#Cc1ccc(CN2CCC3(CC2)C(=O)NC[C@@H]3c2ccccc2)cc1	ZINC001144572026	1378746945	/nfs/dbraw/zinc/74/69/45/1378746945.db2.gz	NBYGFAWTPKEOLO-OAQYLSRUSA-N	0	3	344.458	3.164	20	30		EGEDHN
CC(C)OCCCC(=O)N[C@@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001146797074	1378921541	/nfs/dbraw/zinc/92/15/41/1378921541.db2.gz	ILELSALZLSGKLN-IRXDYDNUSA-N	0	3	345.487	3.136	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2ocnc2C)CCCC1	ZINC001146819437	1378927023	/nfs/dbraw/zinc/92/70/23/1378927023.db2.gz	AHJVMJXRQNJNFD-GJZGRUSLSA-N	0	3	333.476	3.492	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C[C@H](C)NCc2cc(OC)no2)CCCC1	ZINC001146823101	1378928937	/nfs/dbraw/zinc/92/89/37/1378928937.db2.gz	XZJIMCZWRWMRKQ-LSDHHAIUSA-N	0	3	349.475	3.193	20	30		EGEDHN
C=C(Br)CNC[C@H](C1CC1)N(C)C(=O)c1ccccc1	ZINC001283481318	1378976834	/nfs/dbraw/zinc/97/68/34/1378976834.db2.gz	UVGRAOCENYRLJU-OAHLLOKOSA-N	0	3	337.261	3.035	20	30		EGEDHN
C=CCCC(=O)N1CC2(C1)CCN(CCc1ccc(F)c(F)c1)C2	ZINC001147165416	1378981515	/nfs/dbraw/zinc/98/15/15/1378981515.db2.gz	GFDDKMQBECZNGM-UHFFFAOYSA-N	0	3	334.410	3.008	20	30		EGEDHN
C=CCCC(=O)N1CC2(C1)CCN(Cc1ccc(C)c(OC)c1)C2	ZINC001147181098	1378983301	/nfs/dbraw/zinc/98/33/01/1378983301.db2.gz	FLYDVIMLJYCTQO-UHFFFAOYSA-N	0	3	328.456	3.004	20	30		EGEDHN
C=CCCC(=O)N1CC2(C1)CCN(Cc1ccc(OC)c(C)c1)C2	ZINC001147188202	1378984121	/nfs/dbraw/zinc/98/41/21/1378984121.db2.gz	UFUHPSNLNWBHIB-UHFFFAOYSA-N	0	3	328.456	3.004	20	30		EGEDHN
C=CCCC(=O)N1CC2(C1)CCN(CCOc1c(C)cccc1C)C2	ZINC001147188427	1378984385	/nfs/dbraw/zinc/98/43/85/1378984385.db2.gz	ZHGFMKAJXNJIRN-UHFFFAOYSA-N	0	3	342.483	3.183	20	30		EGEDHN
Cc1cocc1C(=O)N(C)[C@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001283530621	1379003089	/nfs/dbraw/zinc/00/30/89/1379003089.db2.gz	PJTZZKJQULERBH-QGZVFWFLSA-N	0	3	343.452	3.162	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)c2ccc(C3CC3)s2)ccc1F	ZINC001147733806	1379068960	/nfs/dbraw/zinc/06/89/60/1379068960.db2.gz	VOCOZQMSMKBYCB-UHFFFAOYSA-N	0	3	343.427	3.156	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc(C3CC3)s2)cc1F	ZINC001147733970	1379068978	/nfs/dbraw/zinc/06/89/78/1379068978.db2.gz	YUGWKAWLLFVMCE-UHFFFAOYSA-N	0	3	343.427	3.156	20	30		EGEDHN
C[C@H](CN(C)C(=O)C1CC2(CCC2)C1)NCc1ccc(C#N)s1	ZINC001283654228	1379085288	/nfs/dbraw/zinc/08/52/88/1379085288.db2.gz	SKEVKHHPFCUCCS-CYBMUJFWSA-N	0	3	331.485	3.137	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC2(C1)CCN(Cc1cnccc1C)C2	ZINC001148147723	1379125669	/nfs/dbraw/zinc/12/56/69/1379125669.db2.gz	YQJCXCQQIAFUGV-QGZVFWFLSA-N	0	3	327.472	3.027	20	30		EGEDHN
C=CCCC1(C(=O)N2CC3(C2)CCN(Cc2cnccc2C)C3)CC1	ZINC001148263372	1379141341	/nfs/dbraw/zinc/14/13/41/1379141341.db2.gz	YLJAOQXUUAZROD-UHFFFAOYSA-N	0	3	339.483	3.171	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC2(C1)CCN(CCc1csc(C)n1)C2	ZINC001148363877	1379157732	/nfs/dbraw/zinc/15/77/32/1379157732.db2.gz	OVECBGYKWSPIKW-UHFFFAOYSA-N	0	3	347.528	3.131	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2ccc(Cl)cc2Cl)c1	ZINC001148803600	1379271188	/nfs/dbraw/zinc/27/11/88/1379271188.db2.gz	OIGHZNYYDOVILE-UHFFFAOYSA-N	0	3	348.233	3.385	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H](C)CCCc3ccccc3)C2)C1	ZINC001148851925	1379284298	/nfs/dbraw/zinc/28/42/98/1379284298.db2.gz	VYRXYNJEWBSTLF-LJQANCHMSA-N	0	3	338.495	3.203	20	30		EGEDHN
Cc1csc(Cl)c1C(=O)NCCNCc1ccc(C#N)cc1	ZINC001149166908	1379337638	/nfs/dbraw/zinc/33/76/38/1379337638.db2.gz	RTGFIOKCSSZSOR-UHFFFAOYSA-N	0	3	333.844	3.101	20	30		EGEDHN
Cc1c2ccccc2oc1C(=O)NCCNCc1ccc(C#N)cc1	ZINC001150020401	1379484950	/nfs/dbraw/zinc/48/49/50/1379484950.db2.gz	ZMOLYRFKLWZKFK-UHFFFAOYSA-N	0	3	333.391	3.133	20	30		EGEDHN
CCC[C@H](C(=O)NCCNCc1ccc(C#N)cc1)c1ccccc1	ZINC001150043967	1379488962	/nfs/dbraw/zinc/48/89/62/1379488962.db2.gz	JKOWYZLVMIQVFI-FQEVSTJZSA-N	0	3	335.451	3.348	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)CC[C@@H](C)c2ccccc2)C1	ZINC001150395964	1379546783	/nfs/dbraw/zinc/54/67/83/1379546783.db2.gz	XWCBWKWGFHQZCL-QUCCMNQESA-N	0	3	344.499	3.354	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)C[C@@H](C)c2ccccc2C)C1	ZINC001150404150	1379549810	/nfs/dbraw/zinc/54/98/10/1379549810.db2.gz	URJZMJAGJJVPIB-MOPGFXCFSA-N	0	3	344.499	3.272	20	30		EGEDHN
C#CCCN1CCCO[C@@H](CNC(=O)[C@H](CCCCC)C(C)C)C1	ZINC001150562920	1379569797	/nfs/dbraw/zinc/56/97/97/1379569797.db2.gz	UDZHAYTUNWRIBD-RBUKOAKNSA-N	0	3	336.520	3.069	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)[C@H](F)CCCCCC)C1	ZINC001150588019	1379574397	/nfs/dbraw/zinc/57/43/97/1379574397.db2.gz	LYURJPAETZERIE-DLBZAZTESA-N	0	3	328.472	3.078	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2ccc(C)s2)CC1	ZINC001150911536	1379630679	/nfs/dbraw/zinc/63/06/79/1379630679.db2.gz	VUYAFOFIFOIDEA-UHFFFAOYSA-N	0	3	336.501	3.234	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@H](C)c2cccc(C)c2)CC1	ZINC001151340045	1379701406	/nfs/dbraw/zinc/70/14/06/1379701406.db2.gz	OZELMDNZLYDLPH-GOSISDBHSA-N	0	3	344.499	3.272	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@@H](C)[C@@H](C)C(C)(C)C)CC1	ZINC001151357025	1379704867	/nfs/dbraw/zinc/70/48/67/1379704867.db2.gz	OBJSXXPUKFXBEG-DLBZAZTESA-N	0	3	338.536	3.478	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@@H]2C[C@@]2(C)C(C)C)CC1	ZINC001151374874	1379707323	/nfs/dbraw/zinc/70/73/23/1379707323.db2.gz	PIEZGDBOGAJWQO-HKUYNNGSSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@@H](C=C)c2ccccc2)CC1	ZINC001151410144	1379713252	/nfs/dbraw/zinc/71/32/52/1379713252.db2.gz	QWCSPZGEDGIZQF-IBGZPJMESA-N	0	3	342.483	3.130	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@@H]2CCCC(C)(C)C2)CC1	ZINC001151412681	1379715088	/nfs/dbraw/zinc/71/50/88/1379715088.db2.gz	JVZJIOWHYNLQCI-QGZVFWFLSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2coc3ccccc32)CC1	ZINC001151415365	1379715731	/nfs/dbraw/zinc/71/57/31/1379715731.db2.gz	PGAQYKTYJVEYMZ-UHFFFAOYSA-N	0	3	342.439	3.220	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)c1cccs1	ZINC001151664761	1379760808	/nfs/dbraw/zinc/76/08/08/1379760808.db2.gz	UTNVXWYDRNZMQB-CYBMUJFWSA-N	0	3	345.443	3.399	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)c1ccc(C)o1	ZINC001151720611	1379769058	/nfs/dbraw/zinc/76/90/58/1379769058.db2.gz	AZKQMVIDEXMIND-CYBMUJFWSA-N	0	3	343.402	3.239	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)[C@@H]1CC=CCC1	ZINC001151828975	1379789615	/nfs/dbraw/zinc/78/96/15/1379789615.db2.gz	BQEZFXRTBLHDJP-VQIMIIECSA-N	0	3	325.456	3.241	20	30		EGEDHN
Cc1ccc(C)c(CCCC(=O)NCCNCc2cccc(C#N)c2)c1	ZINC001151869609	1379805931	/nfs/dbraw/zinc/80/59/31/1379805931.db2.gz	BMHQFLZZFLMAKA-UHFFFAOYSA-N	0	3	349.478	3.404	20	30		EGEDHN
CC1=CC[C@@](C)(C(=O)NCCNCc2ccc(C#N)c(F)c2)CC1	ZINC001151912756	1379814551	/nfs/dbraw/zinc/81/45/51/1379814551.db2.gz	AERYBVUAGRMDML-LJQANCHMSA-N	0	3	329.419	3.040	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)/C=C(/C)C1CC1	ZINC001152128595	1379867660	/nfs/dbraw/zinc/86/76/60/1379867660.db2.gz	KBLNUGRTKCPFMK-KQGZCTBQSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=CCCC(=O)NC[C@@H](C)N(CC)C[C@@H](O)c1ccccc1Cl	ZINC001152313066	1379906325	/nfs/dbraw/zinc/90/63/25/1379906325.db2.gz	FJEUUGKPWLZEJU-RHSMWYFYSA-N	0	3	338.879	3.166	20	30		EGEDHN
C=CCOCCCC(=O)NC[C@@H](C)N(CC)Cc1csc(C)c1	ZINC001152584832	1379953540	/nfs/dbraw/zinc/95/35/40/1379953540.db2.gz	FXQTTXDHMOVDGB-OAHLLOKOSA-N	0	3	338.517	3.366	20	30		EGEDHN
CC[C@H](SC)C(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)cc1	ZINC001152841357	1379985934	/nfs/dbraw/zinc/98/59/34/1379985934.db2.gz	BJIRWDOAQZDRQE-PBHICJAKSA-N	0	3	333.501	3.026	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)c1sccc1F	ZINC001153164737	1380029537	/nfs/dbraw/zinc/02/95/37/1380029537.db2.gz	UTTFYKSPZJDOFK-CYBMUJFWSA-N	0	3	345.443	3.399	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)c1c(C)coc1C	ZINC001153171427	1380030891	/nfs/dbraw/zinc/03/08/91/1380030891.db2.gz	MNTAFHPMHJAIRC-OAHLLOKOSA-N	0	3	339.439	3.409	20	30		EGEDHN
COc1ccc(C#N)cc1CNC[C@@H](NC(=O)C(C)(C)C)C(C)(C)C	ZINC001284643327	1380050109	/nfs/dbraw/zinc/05/01/09/1380050109.db2.gz	MFMJHFYNKKONLB-QGZVFWFLSA-N	0	3	345.487	3.233	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)C1(C2CC2)CC1	ZINC001153956380	1380161758	/nfs/dbraw/zinc/16/17/58/1380161758.db2.gz	CFUPZSSBSDLECU-OAHLLOKOSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1cc(C)nn1C(CC)CC	ZINC001154112214	1380211129	/nfs/dbraw/zinc/21/11/29/1380211129.db2.gz	DBJOTVWWLXYVLN-MRXNPFEDSA-N	0	3	332.492	3.016	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)Cc1ccc(C)cc1	ZINC001154212360	1380230384	/nfs/dbraw/zinc/23/03/84/1380230384.db2.gz	HUFDVYYNTTYVMC-GOSISDBHSA-N	0	3	349.478	3.436	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)CCC(F)F	ZINC001154332013	1380257166	/nfs/dbraw/zinc/25/71/66/1380257166.db2.gz	ASSBHZYEFFDUKR-GFCCVEGCSA-N	0	3	341.377	3.069	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)C1CC2(CCC2)C1	ZINC001154724758	1380340606	/nfs/dbraw/zinc/34/06/06/1380340606.db2.gz	KVYAMMUXSYLHMD-MRXNPFEDSA-N	0	3	339.483	3.465	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)[C@H]1CCC1(C)C	ZINC001154756824	1380346702	/nfs/dbraw/zinc/34/67/02/1380346702.db2.gz	HDQNRYNFFYDXQL-CRAIPNDOSA-N	0	3	327.472	3.321	20	30		EGEDHN
N#Cc1cnc(-n2cnc(CN)c2)c2cc(-c3ccccc3)sc21	ZINC001154909320	1380375117	/nfs/dbraw/zinc/37/51/17/1380375117.db2.gz	PGRHCIQSPMNMGG-UHFFFAOYSA-N	0	3	331.404	3.479	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)C(C)(C)CC	ZINC001154963706	1380381821	/nfs/dbraw/zinc/38/18/21/1380381821.db2.gz	VDARWJSEDJJUHL-CQSZACIVSA-N	0	3	333.451	3.460	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1ccc(C(C)C)nc1CC	ZINC001155283391	1380433351	/nfs/dbraw/zinc/43/33/51/1380433351.db2.gz	QVQFBEBTLLEHHG-MRXNPFEDSA-N	0	3	329.488	3.231	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)C1(CF)CCC1	ZINC001155330225	1380437714	/nfs/dbraw/zinc/43/77/14/1380437714.db2.gz	LBMGCSDTGNZNSD-CQSZACIVSA-N	0	3	349.425	3.164	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NCCCNCc1cc(F)ccc1Cl	ZINC001155427471	1380451537	/nfs/dbraw/zinc/45/15/37/1380451537.db2.gz	SJHLIDPIDXHBRD-ZDUSSCGKSA-N	0	3	342.842	3.056	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@@H](CC)Oc1ccccc1C	ZINC001155528648	1380464743	/nfs/dbraw/zinc/46/47/43/1380464743.db2.gz	PLMRBWPYSARRNK-QZTJIDSGSA-N	0	3	330.472	3.002	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)CC2=CCCCC2)c1	ZINC001155748039	1380488791	/nfs/dbraw/zinc/48/87/91/1380488791.db2.gz	BMEINLUIBZUFQJ-UHFFFAOYSA-N	0	3	329.419	3.184	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1ccccc1C(F)(F)F	ZINC001156553406	1380593295	/nfs/dbraw/zinc/59/32/95/1380593295.db2.gz	GVNBWWVXQIZUJA-CYBMUJFWSA-N	0	3	326.362	3.169	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1ccc(C(F)(F)F)cc1	ZINC001156561558	1380594791	/nfs/dbraw/zinc/59/47/91/1380594791.db2.gz	YBXJRZSBAUWOIN-CYBMUJFWSA-N	0	3	326.362	3.169	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)CC12CC3CC(CC(C3)C1)C2	ZINC001156595254	1380598157	/nfs/dbraw/zinc/59/81/57/1380598157.db2.gz	UQGCUKNZAZXLPG-HINLZNOGSA-N	0	3	330.516	3.443	20	30		EGEDHN
C#CCCCCC(=O)NCCCNCc1cccc(OC)c1Cl	ZINC001156827852	1380656896	/nfs/dbraw/zinc/65/68/96/1380656896.db2.gz	KJUTWCCHKZDZQB-UHFFFAOYSA-N	0	3	336.863	3.138	20	30		EGEDHN
C#CCCCC(=O)NCCCNCc1ncc(-c2ccccc2)s1	ZINC001157164563	1380791954	/nfs/dbraw/zinc/79/19/54/1380791954.db2.gz	SYYQTYCEQSBZMZ-UHFFFAOYSA-N	0	3	341.480	3.210	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NC[C@@H](C)N(CC)Cc1ccc(F)cc1C	ZINC001157217622	1380813731	/nfs/dbraw/zinc/81/37/31/1380813731.db2.gz	TZSMUYREPVEHNZ-HZPDHXFCSA-N	0	3	336.451	3.052	20	30		EGEDHN
C=CCCC(=O)N1CCCC[C@@H]1CN(C)Cc1cccc(OC)c1	ZINC001157706331	1381008933	/nfs/dbraw/zinc/00/89/33/1381008933.db2.gz	YBIWCTHCYPWNBQ-GOSISDBHSA-N	0	3	330.472	3.474	20	30		EGEDHN
N#Cc1ccc(Cl)nc1C(F)(F)N1CCN[C@H](c2ccccc2)C1	ZINC001157764854	1381026947	/nfs/dbraw/zinc/02/69/47/1381026947.db2.gz	IZKAYDHLSKLLTL-AWEZNQCLSA-N	0	3	348.784	3.302	20	30		EGEDHN
C#CCCCCC(=O)N1CCCC[C@@H]1CN(C)CCc1ccns1	ZINC001157855875	1381052760	/nfs/dbraw/zinc/05/27/60/1381052760.db2.gz	BSTGDWAPOLFJAK-QGZVFWFLSA-N	0	3	347.528	3.192	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1cc(C)cs1	ZINC001157914082	1381069512	/nfs/dbraw/zinc/06/95/12/1381069512.db2.gz	VQWZQNFDKGQLJV-MRXNPFEDSA-N	0	3	336.501	3.186	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCCC[C@@H]1CN(C)CCOC(C)C	ZINC001158071779	1381120046	/nfs/dbraw/zinc/12/00/46/1381120046.db2.gz	JRACFGMRNVEASU-GOSISDBHSA-N	0	3	347.503	3.026	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1cc[nH]c1CCC	ZINC001158358252	1381216723	/nfs/dbraw/zinc/21/67/23/1381216723.db2.gz	ZTCLEGYQJJVJHW-QGZVFWFLSA-N	0	3	347.503	3.096	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H](CCC)c1ccccn1	ZINC001158396613	1381229656	/nfs/dbraw/zinc/22/96/56/1381229656.db2.gz	CXCUGGMZYOVJEI-QZTJIDSGSA-N	0	3	329.488	3.464	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1C[C@H]1CC(C)C	ZINC001158512394	1381274553	/nfs/dbraw/zinc/27/45/53/1381274553.db2.gz	IOHWVCUHAIIUIM-GUDVDZBRSA-N	0	3	336.520	3.184	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1occc1Br	ZINC001158631426	1381332224	/nfs/dbraw/zinc/33/22/24/1381332224.db2.gz	PJJMLVWNICPFGD-GFCCVEGCSA-N	0	3	341.249	3.155	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1ccc(C)cc1	ZINC001158781402	1381395873	/nfs/dbraw/zinc/39/58/73/1381395873.db2.gz	PRJLZIIJQRJGLR-LJQANCHMSA-N	0	3	330.472	3.124	20	30		EGEDHN
C[C@H](c1ccccc1)N(c1ncc2c(n1)CCNC2)C1=CC(=O)CCC1	ZINC001158794875	1381403347	/nfs/dbraw/zinc/40/33/47/1381403347.db2.gz	VKQFKWIBLFNXIS-OAHLLOKOSA-N	0	3	348.450	3.327	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1c(Cl)nc2ccccn21	ZINC001158825020	1381418608	/nfs/dbraw/zinc/41/86/08/1381418608.db2.gz	ILOCDDPTIPRLJR-CQSZACIVSA-N	0	3	346.862	3.100	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H](C)Cc1ccc(OC)cc1	ZINC001158914680	1381462483	/nfs/dbraw/zinc/46/24/83/1381462483.db2.gz	RRLCINAMVSUZKM-PKOBYXMFSA-N	0	3	344.499	3.373	20	30		EGEDHN
Cc1cc(C)c(C(=O)NCCCNCc2cc(C#N)ccc2F)s1	ZINC001158945344	1381478798	/nfs/dbraw/zinc/47/87/98/1381478798.db2.gz	QWNLOBWNRRGIID-UHFFFAOYSA-N	0	3	345.443	3.285	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc(N(C)CC)cc1	ZINC001158949224	1381479885	/nfs/dbraw/zinc/47/98/85/1381479885.db2.gz	GZOVYBQYXPNCGN-LJQANCHMSA-N	0	3	329.488	3.255	20	30		EGEDHN
C=CCOCCCC(=O)NCCC1=CCN(Cc2ccsc2)CC1	ZINC001159674415	1381864339	/nfs/dbraw/zinc/86/43/39/1381864339.db2.gz	MITFNSHGSJUGIN-UHFFFAOYSA-N	0	3	348.512	3.369	20	30		EGEDHN
O=C(C#CC1CC1)NCCC1=CCN(Cc2cc3ccccc3o2)CC1	ZINC001160081013	1381991432	/nfs/dbraw/zinc/99/14/32/1381991432.db2.gz	BKKPRPLHGTZUPO-UHFFFAOYSA-N	0	3	348.446	3.485	20	30		EGEDHN
Cc1ncccc1CN1CC=C(CCNC(=O)C#CC(C)(C)C)CC1	ZINC001160084815	1381992621	/nfs/dbraw/zinc/99/26/21/1381992621.db2.gz	VZMZRDZRWXOFGE-UHFFFAOYSA-N	0	3	339.483	3.078	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc(C)c(OC)c(C)c2)CC1	ZINC001160201717	1382031620	/nfs/dbraw/zinc/03/16/20/1382031620.db2.gz	DSUVZSCSVCPWEA-UHFFFAOYSA-N	0	3	328.456	3.250	20	30		EGEDHN
N#Cc1cc(Cl)c(Nc2ccncc2CN)cc1C(F)(F)F	ZINC001160323482	1382073318	/nfs/dbraw/zinc/07/33/18/1382073318.db2.gz	PSMSZQUTKZVTFT-UHFFFAOYSA-N	0	3	326.709	3.250	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H]2[C@H](C=C(C)C)C2(C)C)CC1	ZINC001160646609	1382160180	/nfs/dbraw/zinc/16/01/80/1382160180.db2.gz	STRNGYSGJHQBKU-OALUTQOASA-N	0	3	328.500	3.387	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)CCc2ccc3[nH]ccc3c2)CC1	ZINC001160677366	1382168629	/nfs/dbraw/zinc/16/86/29/1382168629.db2.gz	YOEVKDVQUASJCQ-UHFFFAOYSA-N	0	3	349.478	3.262	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc(C)c(OCC)c2)CC1	ZINC001161375922	1382388270	/nfs/dbraw/zinc/38/82/70/1382388270.db2.gz	FHCBHVQIFJVVTB-UHFFFAOYSA-N	0	3	328.456	3.332	20	30		EGEDHN
CC[C@@H](Nc1nccnc1C(C#N)C(=O)OC(C)(C)C)C(F)(F)F	ZINC001161382702	1382390758	/nfs/dbraw/zinc/39/07/58/1382390758.db2.gz	OEMLCTSTMDNAJZ-VHSXEESVSA-N	0	3	344.337	3.178	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc(-c3cn[nH]c3)cc2)CC1	ZINC001161457576	1382415253	/nfs/dbraw/zinc/41/52/53/1382415253.db2.gz	JXVMIOIXGYZQGD-UHFFFAOYSA-N	0	3	336.439	3.015	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2csc(C(C)(C)C)n2)CC1	ZINC001161472725	1382418533	/nfs/dbraw/zinc/41/85/33/1382418533.db2.gz	ZRWVAVLRVNOXQU-UHFFFAOYSA-N	0	3	333.501	3.379	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc3nc(C)ccc3c2)CC1	ZINC001161524036	1382429236	/nfs/dbraw/zinc/42/92/36/1382429236.db2.gz	FFNOLMVROUACII-UHFFFAOYSA-N	0	3	335.451	3.481	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cccc(F)c2OCC)CC1	ZINC001161573900	1382443697	/nfs/dbraw/zinc/44/36/97/1382443697.db2.gz	NMXQJROIYODSFY-UHFFFAOYSA-N	0	3	332.419	3.162	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H]2Cc3ccc(Cl)cc32)CC1	ZINC001161805709	1382512553	/nfs/dbraw/zinc/51/25/53/1382512553.db2.gz	OSOHVZQQOZFRIC-GOSISDBHSA-N	0	3	330.859	3.304	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C2(C(F)(F)F)CCCC2)CC1	ZINC001162002080	1382596122	/nfs/dbraw/zinc/59/61/22/1382596122.db2.gz	CNBWJNMQSURPQI-UHFFFAOYSA-N	0	3	342.405	3.271	20	30		EGEDHN
C#CCN1CCC(CNC(=O)C[C@H](CC)CCCC)(COC)CC1	ZINC001162362927	1382740548	/nfs/dbraw/zinc/74/05/48/1382740548.db2.gz	XFBURMMZDSFBML-GOSISDBHSA-N	0	3	336.520	3.071	20	30		EGEDHN
C#CCN1CCC(CNC(=O)CCCCCC(C)C)(COC)CC1	ZINC001162513392	1382778237	/nfs/dbraw/zinc/77/82/37/1382778237.db2.gz	LHRYKVDHWVCSPL-UHFFFAOYSA-N	0	3	336.520	3.071	20	30		EGEDHN
C#CCN1CCC(CNC(=O)[C@H](CC)CCCCC)(COC)CC1	ZINC001162617280	1382811013	/nfs/dbraw/zinc/81/10/13/1382811013.db2.gz	DWAYRXNDJBCWQE-GOSISDBHSA-N	0	3	336.520	3.071	20	30		EGEDHN
CCOC(=O)c1cc(-n2c3ccccc3nc2[C@@H](C)N)ccc1C#N	ZINC001162777009	1382869714	/nfs/dbraw/zinc/86/97/14/1382869714.db2.gz	ISFPLMUYACIHFL-GFCCVEGCSA-N	0	3	334.379	3.094	20	30		EGEDHN
CO/N=C/c1cc(-n2c3ccccc3nc2[C@H](C)N)cc(F)c1F	ZINC001162778378	1382869918	/nfs/dbraw/zinc/86/99/18/1382869918.db2.gz	KJHBITQLRVFULG-LUKZVCJISA-N	0	3	330.338	3.304	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)CC1(C)CCCC1	ZINC001162802608	1382877187	/nfs/dbraw/zinc/87/71/87/1382877187.db2.gz	MVWRFYXQBUSVJC-UHFFFAOYSA-N	0	3	326.484	3.251	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1cscc1Cl	ZINC001162836642	1382890709	/nfs/dbraw/zinc/89/07/09/1382890709.db2.gz	NIPTYHAWKQMWQV-UHFFFAOYSA-N	0	3	346.883	3.309	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C1(C(F)F)CCC1	ZINC001162897795	1382909112	/nfs/dbraw/zinc/90/91/12/1382909112.db2.gz	JYFFZFHFYODRMO-UHFFFAOYSA-N	0	3	348.437	3.106	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CCCC[C@@H]1C	ZINC001162905867	1382911002	/nfs/dbraw/zinc/91/10/02/1382911002.db2.gz	AGDWYMOBMMGXEP-ICSRJNTNSA-N	0	3	326.484	3.107	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H](CCC)C(C)C	ZINC001162946933	1382924130	/nfs/dbraw/zinc/92/41/30/1382924130.db2.gz	TZQVYGPCPJJXKJ-FQEVSTJZSA-N	0	3	328.500	3.353	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1C[C@]1(C)C(C)C	ZINC001162970751	1382932294	/nfs/dbraw/zinc/93/22/94/1382932294.db2.gz	JPKFTJVUJUUMGX-RBBKRZOGSA-N	0	3	340.511	3.353	20	30		EGEDHN
CCN(CC)CCNC(=N)Nc1nc2ccccc2c(Cl)c1C#N	ZINC001163129463	1382972215	/nfs/dbraw/zinc/97/22/15/1382972215.db2.gz	YWZFHKFFYNVNPC-UHFFFAOYSA-N	0	3	344.850	3.038	20	30		EGEDHN
C[C@@H](NCC1(CCNC(=O)[C@@H](C)C#N)CC1)c1c(F)cccc1F	ZINC001163841004	1383127950	/nfs/dbraw/zinc/12/79/50/1383127950.db2.gz	LHVKNVRUJHJSOK-QWHCGFSZSA-N	0	3	335.398	3.062	20	30		EGEDHN
C[C@H]1CC[C@@H](CC(=O)NCCCNCc2cc(C#N)ccc2F)C1	ZINC001164188068	1383164307	/nfs/dbraw/zinc/16/43/07/1383164307.db2.gz	RAYFFWGQUYXOAL-LSDHHAIUSA-N	0	3	331.435	3.120	20	30		EGEDHN
C[C@@H](NCC1(CCNC(=O)C#CC2CC2)CC1)c1cc(F)ccc1F	ZINC001164483015	1383191670	/nfs/dbraw/zinc/19/16/70/1383191670.db2.gz	VRPHTQVEXZOUBA-CQSZACIVSA-N	0	3	346.421	3.315	20	30		EGEDHN
Cc1cnc(N(C)[C@@H]2CN(Cc3ccccc3)CC[C@@H]2C)c(C#N)n1	ZINC001165180474	1383242283	/nfs/dbraw/zinc/24/22/83/1383242283.db2.gz	BDHBWYGGAAWTMB-HNAYVOBHSA-N	0	3	335.455	3.004	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1cccc(Cl)c1F	ZINC001165657433	1383320577	/nfs/dbraw/zinc/32/05/77/1383320577.db2.gz	RRZGCZDUYVTWHV-UHFFFAOYSA-N	0	3	349.631	3.097	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccsc2COC)CC1	ZINC001165749718	1383338690	/nfs/dbraw/zinc/33/86/90/1383338690.db2.gz	IACVBHRYTOEKHU-UHFFFAOYSA-N	0	3	342.892	3.137	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCCNCc1nsc2ccccc12	ZINC001165929124	1383367043	/nfs/dbraw/zinc/36/70/43/1383367043.db2.gz	IHRBYCCESXAUAR-SFHVURJKSA-N	0	3	331.485	3.495	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccnc3ccccc32)CC1	ZINC001166042210	1383380391	/nfs/dbraw/zinc/38/03/91/1383380391.db2.gz	WSJBUNTXHNPEFZ-UHFFFAOYSA-N	0	3	343.858	3.477	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCC1(CN[C@H](C)c2cnccn2)CC1	ZINC001166541959	1383435678	/nfs/dbraw/zinc/43/56/78/1383435678.db2.gz	WKWBSNBYADRQHU-OAHLLOKOSA-N	0	3	330.476	3.016	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCC1(CNCc2cccc(Cl)n2)CC1	ZINC001166574390	1383440433	/nfs/dbraw/zinc/44/04/33/1383440433.db2.gz	OGPUVFLYBHUFGF-UHFFFAOYSA-N	0	3	335.879	3.323	20	30		EGEDHN
C#CCCCCCC(=O)NCCC1(CNCc2oc(C)nc2C)CC1	ZINC001166579096	1383440676	/nfs/dbraw/zinc/44/06/76/1383440676.db2.gz	BWUJCHWCHPDSMN-UHFFFAOYSA-N	0	3	345.487	3.251	20	30		EGEDHN
C=CCCCC(=O)NCCC1(CN[C@@H](C)c2cnc(C)cn2)CC1	ZINC001166910003	1383498165	/nfs/dbraw/zinc/49/81/65/1383498165.db2.gz	IILYSOHZKCRURE-INIZCTEOSA-N	0	3	330.476	3.078	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCC1(CNCc2nc(C)cs2)CC1	ZINC001167025749	1383522165	/nfs/dbraw/zinc/52/21/65/1383522165.db2.gz	LCIYTFMBMZGPIO-KRWDZBQOSA-N	0	3	335.517	3.430	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001167119128	1383543789	/nfs/dbraw/zinc/54/37/89/1383543789.db2.gz	UIOJPESBDCBSGC-VQIMIIECSA-N	0	3	339.483	3.371	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C2Cc3ccccc3C2)CC1	ZINC001167319501	1383595885	/nfs/dbraw/zinc/59/58/85/1383595885.db2.gz	GJSDAJKTGHAODU-UHFFFAOYSA-N	0	3	332.875	3.030	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCC1(CNCc2oc(C)nc2C)CC1	ZINC001167339478	1383603077	/nfs/dbraw/zinc/60/30/77/1383603077.db2.gz	DNPTUMCTPPNYRV-UHFFFAOYSA-N	0	3	333.476	3.270	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cnoc2C(C)C)CC1	ZINC001167599287	1383684955	/nfs/dbraw/zinc/68/49/55/1383684955.db2.gz	DPMNWZMMFZRGAO-UHFFFAOYSA-N	0	3	325.840	3.040	20	30		EGEDHN
C=C[C@H](C(=O)NCCC1(CNCc2ccccn2)CC1)c1ccccc1	ZINC001168276836	1383860300	/nfs/dbraw/zinc/86/03/00/1383860300.db2.gz	IXWDMNXKNPKPPM-FQEVSTJZSA-N	0	3	349.478	3.428	20	30		EGEDHN
CC(C)c1nc(C(=O)NCCCNCc2ccccc2C#N)cs1	ZINC001168493650	1383923079	/nfs/dbraw/zinc/92/30/79/1383923079.db2.gz	NFMYGILHJRPEDE-UHFFFAOYSA-N	0	3	342.468	3.048	20	30		EGEDHN
C[C@@H](N)c1ccn(-c2c(F)c(F)c(C(F)(F)F)c(F)c2F)n1	ZINC001169233217	1384125322	/nfs/dbraw/zinc/12/53/22/1384125322.db2.gz	OPEIKMOXGJXOQU-SCSAIBSYSA-N	0	3	327.203	3.467	20	30		EGEDHN
CCOC(=O)[C@@H]1CC[C@@H](N(CCC#N)C2CCCCCCC2)CO1	ZINC001169394247	1384143417	/nfs/dbraw/zinc/14/34/17/1384143417.db2.gz	WKMDNQRGCGQRLE-MSOLQXFVSA-N	0	3	336.476	3.426	20	30		EGEDHN
Cc1cc(NC(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)ncc1C#N	ZINC001311069912	1384255324	/nfs/dbraw/zinc/25/53/24/1384255324.db2.gz	BYVDDMPABOYTCT-QAPCUYQASA-N	0	3	349.438	3.046	20	30		EGEDHN
N#CC1(c2ccccc2)CCC(N[C@H]2c3ccccc3CNC2=O)CC1	ZINC001170367553	1384301891	/nfs/dbraw/zinc/30/18/91/1384301891.db2.gz	JRJXJQDCFPRHDG-JGBTYHIZSA-N	0	3	345.446	3.351	20	30		EGEDHN
C#CCCCC(=O)N[C@H](C)CCCCNCc1cc(F)ccc1C#N	ZINC001170424588	1384315551	/nfs/dbraw/zinc/31/55/51/1384315551.db2.gz	BVQCYKCPHDTHRN-MRXNPFEDSA-N	0	3	343.446	3.265	20	30		EGEDHN
C[C@@H](Nc1c(F)c(F)c(C(F)(F)F)c(F)c1F)[C@@H]1CNCCO1	ZINC001170568271	1384344356	/nfs/dbraw/zinc/34/43/56/1384344356.db2.gz	FXSIEUXQHAKLKT-RITPCOANSA-N	0	3	346.246	3.051	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H](C)CCCCNCc1ccn(CC)n1	ZINC001170997209	1384426641	/nfs/dbraw/zinc/42/66/41/1384426641.db2.gz	DRKZWIAGNDWDCX-INIZCTEOSA-N	0	3	334.508	3.270	20	30		EGEDHN
C[C@@H](Cc1cccc(C#N)c1)N1CCCC[C@](O)(C(F)(F)F)C1	ZINC001171208552	1384469090	/nfs/dbraw/zinc/46/90/90/1384469090.db2.gz	DEXKYRMYYNGVHF-XJKSGUPXSA-N	0	3	326.362	3.269	20	30		EGEDHN
C[C@@H](Cc1cccc(C#N)c1)N1CCN(c2cccc(C#N)c2)CC1	ZINC001171229479	1384474028	/nfs/dbraw/zinc/47/40/28/1384474028.db2.gz	NVRJNUDZPPTTGU-KRWDZBQOSA-N	0	3	330.435	3.183	20	30		EGEDHN
Cc1ccnc(O[C@H]2CCCN([C@H](C)Cc3cccc(C#N)c3)C2)n1	ZINC001171231323	1384474932	/nfs/dbraw/zinc/47/49/32/1384474932.db2.gz	IKRUEURDQKJATO-APWZRJJASA-N	0	3	336.439	3.131	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)Cc2ccc3c(c2)CCCC3)C1	ZINC001316624466	1384489957	/nfs/dbraw/zinc/48/99/57/1384489957.db2.gz	AHUUSTVLZXQTSY-UWUNEBHHSA-N	0	3	346.902	3.345	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@H]1CC[C@H](CC)CC1	ZINC001171667171	1384596154	/nfs/dbraw/zinc/59/61/54/1384596154.db2.gz	FNOLMJHIPYXPOZ-HDJSIYSDSA-N	0	3	331.298	3.207	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)N1CCN(c2ccccc2C#N)CC1	ZINC001172309102	1384765361	/nfs/dbraw/zinc/76/53/61/1384765361.db2.gz	QTGCKSALACXPBE-KRWDZBQOSA-N	0	3	330.435	3.183	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)N1C[C@@H]2C[C@]2(NC(=O)OC(C)(C)C)C1	ZINC001172313598	1384767495	/nfs/dbraw/zinc/76/74/95/1384767495.db2.gz	DPWFRZHVPSYOBU-VHFSOBRXSA-N	0	3	341.455	3.088	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)N1CCC[C@@H](C(F)(F)F)[C@H]1CO	ZINC001172315166	1384768217	/nfs/dbraw/zinc/76/82/17/1384768217.db2.gz	NZINPFKXAXJNLU-APHBMKBZSA-N	0	3	326.362	3.124	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)N1CCN(c2nccc3occc32)CC1	ZINC001172320057	1384768555	/nfs/dbraw/zinc/76/85/55/1384768555.db2.gz	SRHBRJDAMXUYEL-INIZCTEOSA-N	0	3	346.434	3.453	20	30		EGEDHN
Cc1cccc(CO[C@@H]2CC[C@H]3[C@H]2OCCN3[C@@H](C)CCCC#N)n1	ZINC001172495118	1384804199	/nfs/dbraw/zinc/80/41/99/1384804199.db2.gz	MTFRBNTWXCHLNA-IJXRJRJASA-N	0	3	343.471	3.221	20	30		EGEDHN
Cc1nc(CO[C@@H]2CC[C@H]3[C@H]2OCCN3[C@@H](C)CCCC#N)cs1	ZINC001172499988	1384805298	/nfs/dbraw/zinc/80/52/98/1384805298.db2.gz	VXFDCOXIRSPLDW-VIBAHUMZSA-N	0	3	349.500	3.282	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H](C)OC2CCCCCC2)C1	ZINC001317088666	1384850785	/nfs/dbraw/zinc/85/07/85/1384850785.db2.gz	UHCUGPPSAHHPOQ-RBSFLKMASA-N	0	3	328.884	3.104	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H](N2CC[C@]3(CC3(F)F)C2)C[C@H]1C#N	ZINC001172985383	1384895503	/nfs/dbraw/zinc/89/55/03/1384895503.db2.gz	PIZZEHNHDVSSKQ-XEZPLFJOSA-N	0	3	341.402	3.009	20	30		EGEDHN
CCCCCCCC[C@H](CCC)N1CC(N2CCN(C)C(=O)C2)C1	ZINC001173310137	1384955962	/nfs/dbraw/zinc/95/59/62/1384955962.db2.gz	QMYCAMLZFBBVBD-SFHVURJKSA-N	0	3	337.552	3.364	20	30		EGEDHN
COc1ccc(C(=O)N2CCC(NC3(CC#N)CCCC3)CC2)cc1	ZINC001173404285	1384966995	/nfs/dbraw/zinc/96/69/95/1384966995.db2.gz	YOLGPGQASCIHMR-UHFFFAOYSA-N	0	3	341.455	3.116	20	30		EGEDHN
CC(C)(C)OC(=O)[C@@H]1CCCCN1CNC1CCC(C)(C#N)CC1	ZINC001173590240	1384982162	/nfs/dbraw/zinc/98/21/62/1384982162.db2.gz	AGUIOWLLHYLZFV-WUJZJPHMSA-N	0	3	335.492	3.202	20	30		EGEDHN
C[C@@H](CNC(=O)Cc1cccc(Cl)c1)NCc1ccc(C#N)s1	ZINC001317263369	1385032414	/nfs/dbraw/zinc/03/24/14/1385032414.db2.gz	CTEXPBISICFDBS-LBPRGKRZSA-N	0	3	347.871	3.110	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)Cc1cccc(C)c1Cl	ZINC001317398518	1385114470	/nfs/dbraw/zinc/11/44/70/1385114470.db2.gz	DTFPRJJLMVOMDF-ZDUSSCGKSA-N	0	3	329.271	3.428	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1ccc2c(c1)C(C)(C)CO2	ZINC001317401900	1385116285	/nfs/dbraw/zinc/11/62/85/1385116285.db2.gz	YTXPADPCQZRPMM-CYBMUJFWSA-N	0	3	336.863	3.207	20	30		EGEDHN
C[C@@H](CCNC(=O)c1cc2ccccc2[nH]1)NCc1ccccc1C#N	ZINC001317414292	1385124687	/nfs/dbraw/zinc/12/46/87/1385124687.db2.gz	PVKXBTNDKQHKRR-HNNXBMFYSA-N	0	3	346.434	3.338	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H](C)CCCCNCc1nnc(C(C)C)[nH]1	ZINC001174649685	1385129836	/nfs/dbraw/zinc/12/98/36/1385129836.db2.gz	HPSYZPUSFNTIFY-OAHLLOKOSA-N	0	3	349.523	3.295	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@H](C)CCCCNCc1nccn1CC	ZINC001174848715	1385159375	/nfs/dbraw/zinc/15/93/75/1385159375.db2.gz	GQRXCYCDBGDNBU-IAGOWNOFSA-N	0	3	334.508	3.270	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H](C)CCCCNCc1nnc(C(C)C)[nH]1	ZINC001174850093	1385160032	/nfs/dbraw/zinc/16/00/32/1385160032.db2.gz	SYCDHPRGQLMIMN-HOTGVXAUSA-N	0	3	349.523	3.295	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H](C)CCCCNCc1cn(C(C)C)nn1	ZINC001174850110	1385160104	/nfs/dbraw/zinc/16/01/04/1385160104.db2.gz	UCTOOMKELOTMOQ-IRXDYDNUSA-N	0	3	349.523	3.226	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](C)CCCCNCc2ccn(CC)n2)CC1	ZINC001175074466	1385190116	/nfs/dbraw/zinc/19/01/16/1385190116.db2.gz	SILXBWYWMBFCHN-QGZVFWFLSA-N	0	3	346.519	3.414	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H](C)CCCCN[C@H](C)c2nnc(C)[nH]2)CC1	ZINC001175081729	1385191678	/nfs/dbraw/zinc/19/16/78/1385191678.db2.gz	IFFHHBZNJOFGCI-LSDHHAIUSA-N	0	3	347.507	3.185	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1cc2ccccc2o1	ZINC001175298679	1385243210	/nfs/dbraw/zinc/24/32/10/1385243210.db2.gz	NBUVBTHVQFWPLN-UHFFFAOYSA-N	0	3	337.217	3.051	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H](CNC(=O)CCC3CCC3)C2)c1	ZINC001317524579	1385243934	/nfs/dbraw/zinc/24/39/34/1385243934.db2.gz	QKJKOUOTOXBGKM-LJQANCHMSA-N	0	3	325.456	3.077	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H](C)CCCCN[C@H](C)c1nnc(C)[nH]1	ZINC001175468196	1385301073	/nfs/dbraw/zinc/30/10/73/1385301073.db2.gz	CYRUSWQIGLZCFX-ZIAGYGMSSA-N	0	3	335.496	3.041	20	30		EGEDHN
CCN1CCN(c2ccc(Nc3ccc(Cl)nc3C#N)cc2)CC1	ZINC001175779530	1385402741	/nfs/dbraw/zinc/40/27/41/1385402741.db2.gz	KAVXAXUBXWENCG-UHFFFAOYSA-N	0	3	341.846	3.492	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)C(=O)NCCCNCc1cnc(C)o1	ZINC001176744913	1385679649	/nfs/dbraw/zinc/67/96/49/1385679649.db2.gz	NFJKOAUWTOXYBB-GOSISDBHSA-N	0	3	341.455	3.014	20	30		EGEDHN
C[C@@H]1CC(C(=O)NCCCNCc2cc(C#N)ccc2F)C[C@@H](C)C1	ZINC001177136731	1385829415	/nfs/dbraw/zinc/82/94/15/1385829415.db2.gz	RJLUICJAAOMKQC-GJZGRUSLSA-N	0	3	345.462	3.366	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)COC(C)C	ZINC001177245917	1385882634	/nfs/dbraw/zinc/88/26/34/1385882634.db2.gz	PDOALBFNCCPYTI-UHFFFAOYSA-N	0	3	330.900	3.162	20	30		EGEDHN
COc1nc(NC(=O)C(C#N)Cc2cccs2)cc2cccnc21	ZINC001177903664	1386078562	/nfs/dbraw/zinc/07/85/62/1386078562.db2.gz	JSALGWFLNNHAIT-GFCCVEGCSA-N	0	3	338.392	3.021	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2cccc(Cl)c2)CCN1C(=O)CC1CC1	ZINC001178023493	1386110495	/nfs/dbraw/zinc/11/04/95/1386110495.db2.gz	QRCGYJOJQZWSBG-KSSFIOAISA-N	0	3	330.859	3.071	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)N(C)C(=O)C1C(C)(C)C1(C)C	ZINC001319438799	1386122100	/nfs/dbraw/zinc/12/21/00/1386122100.db2.gz	HLJBHWMCZDHVQC-GFCCVEGCSA-N	0	3	333.501	3.238	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccc(Cl)cc2)CCN1C(=O)c1ccoc1	ZINC001178107140	1386129984	/nfs/dbraw/zinc/12/99/84/1386129984.db2.gz	WLAPTFHLQNJJMH-KSSFIOAISA-N	0	3	342.826	3.177	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)c1ccc(Cl)o1	ZINC001178113922	1386133268	/nfs/dbraw/zinc/13/32/68/1386133268.db2.gz	NPFCTAUJXIDAFM-HOCLYGCPSA-N	0	3	342.826	3.177	20	30		EGEDHN
CCC1(C(=O)N(C)[C@@H](C)CNCc2ccc(F)c(C#N)c2)CCC1	ZINC001319515707	1386156625	/nfs/dbraw/zinc/15/66/25/1386156625.db2.gz	SIKITLHRKKFXBG-AWEZNQCLSA-N	0	3	331.435	3.214	20	30		EGEDHN
C#CCCCC(=O)NCCCCCCNCc1cc(C2CC2)no1	ZINC001178331389	1386190776	/nfs/dbraw/zinc/19/07/76/1386190776.db2.gz	OSJAYGAYNJBQIF-UHFFFAOYSA-N	0	3	331.460	3.122	20	30		EGEDHN
Cc1cc(C)c(C(=O)N2CC[C@H](NCC#Cc3ccccc3)[C@@H]2C)o1	ZINC001178437638	1386217368	/nfs/dbraw/zinc/21/73/68/1386217368.db2.gz	LSHPIHJOLFBWGE-HKUYNNGSSA-N	0	3	336.435	3.141	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@H](NCC#Cc2ccc(Cl)cc2)[C@@H]1C)C1CC1	ZINC001178437397	1386217505	/nfs/dbraw/zinc/21/75/05/1386217505.db2.gz	FGBBHUVISHPIBX-VCBZYWHSSA-N	0	3	344.886	3.317	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](NCc2ccc(Cl)nc2)[C@@H]1C	ZINC001178503884	1386237937	/nfs/dbraw/zinc/23/79/37/1386237937.db2.gz	VHRHPZJCOYOYFY-HOCLYGCPSA-N	0	3	333.863	3.008	20	30		EGEDHN
CC/C(C)=C/C(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)[C@@H]1C	ZINC001178660000	1386270838	/nfs/dbraw/zinc/27/08/38/1386270838.db2.gz	PKDQENCHNVGXAA-AIOHSGBXSA-N	0	3	329.419	3.133	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@@H]1C	ZINC001178802661	1386309532	/nfs/dbraw/zinc/30/95/32/1386309532.db2.gz	SWFMMGTVLQBURX-LPHOPBHVSA-N	0	3	328.431	3.113	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CC[C@H](NCC=C(Cl)Cl)[C@@H]1C)OCC	ZINC001178817848	1386315999	/nfs/dbraw/zinc/31/59/99/1386315999.db2.gz	KKQAOKCJPFXWOD-MELADBBJSA-N	0	3	349.302	3.256	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)C[C@@H]1C=CCCC1	ZINC001178982935	1386367106	/nfs/dbraw/zinc/36/71/06/1386367106.db2.gz	UHCHLFVBRIFQDG-TYPHKJRUSA-N	0	3	336.479	3.364	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1ccoc1Br)C(C)C	ZINC001319954944	1386414918	/nfs/dbraw/zinc/41/49/18/1386414918.db2.gz	AVUXJPWCGXUQNH-LLVKDONJSA-N	0	3	349.656	3.139	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cnc(C2CC2)s1)C(C)C	ZINC001319957096	1386417832	/nfs/dbraw/zinc/41/78/32/1386417832.db2.gz	OIJQLXVYXBMZIJ-LBPRGKRZSA-N	0	3	327.881	3.117	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCCCCCNCc1ccn(C(C)C)n1	ZINC001179230331	1386427580	/nfs/dbraw/zinc/42/75/80/1386427580.db2.gz	KSVHKQXKPOKEFP-UHFFFAOYSA-N	0	3	334.508	3.442	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCCCCCCNCc1cn(C(C)C)nn1	ZINC001179339863	1386456646	/nfs/dbraw/zinc/45/66/46/1386456646.db2.gz	NHVRUHGUGQARQW-QGZVFWFLSA-N	0	3	349.523	3.228	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N1CC[C@H](NCc2ccc(C#N)s2)[C@@H]1C	ZINC001179351685	1386460349	/nfs/dbraw/zinc/46/03/49/1386460349.db2.gz	TYEFLBXXAGFSKC-GMYPXHNCSA-N	0	3	329.469	3.221	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H](NCc2c(C)nsc2C)[C@@H]1C	ZINC001179381314	1386468271	/nfs/dbraw/zinc/46/82/71/1386468271.db2.gz	YMDYXAGNIKVDHN-IFIJOSMWSA-N	0	3	335.517	3.441	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](NCc2ccc(C#N)s2)[C@@H]1C	ZINC001179381277	1386468362	/nfs/dbraw/zinc/46/83/62/1386468362.db2.gz	WUZVNXPLIXDFDD-ZQIUZPCESA-N	0	3	331.485	3.301	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@H](NCc2ccc(Cl)nc2)[C@@H]1C	ZINC001179384577	1386469688	/nfs/dbraw/zinc/46/96/88/1386469688.db2.gz	QLWKIVVPKSEYQI-DZKIICNBSA-N	0	3	335.879	3.416	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](NCc2cn(C(C)C)nc2C)[C@@H]1C	ZINC001179384674	1386470176	/nfs/dbraw/zinc/47/01/76/1386470176.db2.gz	TWTADNXLYKIUKU-IEZWGBDMSA-N	0	3	346.519	3.454	20	30		EGEDHN
CC#CC(=O)N(Cc1ccccc1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC001179752662	1386572616	/nfs/dbraw/zinc/57/26/16/1386572616.db2.gz	ZOBKNGXWTAYJEI-OAQYLSRUSA-N	0	3	332.447	3.313	20	30		EGEDHN
CCCCCCCCC(=O)N1CC[C@H](NCc2ccnn2C)[C@@H]1C	ZINC001179994299	1386662327	/nfs/dbraw/zinc/66/23/27/1386662327.db2.gz	MAXLCMGHBYVRFL-WMZOPIPTSA-N	0	3	334.508	3.250	20	30		EGEDHN
C=CCC[C@H](C)[NH2+]C[C@]1(C)CN(C(=O)c2ccccc2[O-])C[C@H]1C	ZINC001180640715	1386854587	/nfs/dbraw/zinc/85/45/87/1386854587.db2.gz	UMXDHSKVJPCREI-GQIGUUNPSA-N	0	3	330.472	3.435	20	30		EGEDHN
Cc1cc(F)ccc1C(=O)N[C@@H](C)CNCc1ccc(F)c(C#N)c1	ZINC001322051262	1387039901	/nfs/dbraw/zinc/03/99/01/1387039901.db2.gz	ZJOGNHRIJVIJJJ-ZDUSSCGKSA-N	0	3	343.377	3.053	20	30		EGEDHN
C[C@@H](CN(C)Cc1cccc(C#N)c1)NC(=O)CCc1ccsc1	ZINC001322178683	1387089892	/nfs/dbraw/zinc/08/98/92/1387089892.db2.gz	YSVKWKVBVHDCFM-HNNXBMFYSA-N	0	3	341.480	3.189	20	30		EGEDHN
Cc1cc(F)ccc1C(=O)N[C@H](C)CN(C)Cc1cccc(C#N)c1	ZINC001322281521	1387138081	/nfs/dbraw/zinc/13/80/81/1387138081.db2.gz	PVCZCTLLUVEJPU-OAHLLOKOSA-N	0	3	339.414	3.256	20	30		EGEDHN
C[C@H](CN(C)Cc1cccc(C#N)c1)NC(=O)c1ccccc1Cl	ZINC001322287220	1387142815	/nfs/dbraw/zinc/14/28/15/1387142815.db2.gz	YGFJNYLUTUYEBQ-CQSZACIVSA-N	0	3	341.842	3.462	20	30		EGEDHN
CCC1(C(=O)N2C[C@@H](C)[C@](C)(CNCc3ccccc3C#N)C2)CC1	ZINC001182516483	1387181316	/nfs/dbraw/zinc/18/13/16/1387181316.db2.gz	GQDRLBSHCIFCRG-OXQOHEQNSA-N	0	3	339.483	3.323	20	30		EGEDHN
N#Cc1ccc(CNCc2ccc(CNC(=O)CCCF)cc2)s1	ZINC001698716755	1406360461	/nfs/dbraw/zinc/36/04/61/1406360461.db2.gz	KFNSSHWPZAKGBY-UHFFFAOYSA-N	0	3	345.443	3.275	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N1CCC[C@H]1C1CCC1	ZINC001338692952	1389734293	/nfs/dbraw/zinc/73/42/93/1389734293.db2.gz	HWUYRBLGDUMLQR-IRXDYDNUSA-N	0	3	329.492	3.042	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCNCc2ccccc2OCC2CC2)c1	ZINC001331958363	1389926062	/nfs/dbraw/zinc/92/60/62/1389926062.db2.gz	KINYKCPPCZVXIV-UHFFFAOYSA-N	0	3	349.434	3.465	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N[C@H](COC)c1cccc(C(F)(F)F)c1	ZINC001339954751	1390198674	/nfs/dbraw/zinc/19/86/74/1390198674.db2.gz	HPYZDDVSDIPATN-LSDHHAIUSA-N	0	3	344.377	3.193	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N1CCC[C@H]2CCC[C@H]21	ZINC001340207165	1390250364	/nfs/dbraw/zinc/25/03/64/1390250364.db2.gz	LVFFSYYSECIRLE-IXDOHACOSA-N	0	3	329.492	3.042	20	30		EGEDHN
C=C[C@@H](COC)NCc1ccc2c(c1)CN(C(=O)OC(C)(C)C)CC2	ZINC001333306319	1390280525	/nfs/dbraw/zinc/28/05/25/1390280525.db2.gz	CLGITHXXZAAZNG-SFHVURJKSA-N	0	3	346.471	3.270	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1nn(-c2ccc(Cl)cc2)cc1C	ZINC001340453533	1390291343	/nfs/dbraw/zinc/29/13/43/1390291343.db2.gz	SJOAUGXVKXDDIA-HNNXBMFYSA-N	0	3	332.835	3.456	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)Nc1ccc(N(C)C(=O)NC)cc1	ZINC001341594159	1390507509	/nfs/dbraw/zinc/50/75/09/1390507509.db2.gz	QVBMGPAJXNFTTA-KRWDZBQOSA-N	0	3	348.491	3.479	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1Cl)C(=O)c1ccnc(Cl)c1	ZINC001342521515	1390621962	/nfs/dbraw/zinc/62/19/62/1390621962.db2.gz	SEOATCOKBOJNJW-JTQLQIEISA-N	0	3	334.162	3.350	20	30		EGEDHN
C[C@@H](CC#N)OC(=O)C1CCN(c2cc(Cl)ccc2Cl)C1=O	ZINC001342565526	1390626859	/nfs/dbraw/zinc/62/68/59/1390626859.db2.gz	GRTAMQWSPPCQNE-ONGXEEELSA-N	0	3	341.194	3.192	20	30		EGEDHN
N#CC(C(=O)CCC(=O)c1ccc(F)cc1F)c1cccc(F)n1	ZINC001342563281	1390626920	/nfs/dbraw/zinc/62/69/20/1390626920.db2.gz	WABPMLAKVDBUQQ-GFCCVEGCSA-N	0	3	332.281	3.338	20	30		EGEDHN
CCCn1cc(C(=O)C(C#N)c2nccn2Cc2ccccc2)cn1	ZINC001342919359	1390672501	/nfs/dbraw/zinc/67/25/01/1390672501.db2.gz	YNTRQUHGPQOMCR-KRWDZBQOSA-N	0	3	333.395	3.028	20	30		EGEDHN
Cn1ccnc1C(C#N)C(=O)CCCc1ncc(-c2ccccc2)o1	ZINC001342924151	1390673211	/nfs/dbraw/zinc/67/32/11/1390673211.db2.gz	KCRYRSOAADLPBF-OAHLLOKOSA-N	0	3	334.379	3.274	20	30		EGEDHN
Cc1ccc(CC(=O)C(C#N)C(=O)NC2CCCCC2)cc1Cl	ZINC001343582147	1390724153	/nfs/dbraw/zinc/72/41/53/1390724153.db2.gz	IXCIQEGIXYFARZ-OAHLLOKOSA-N	0	3	332.831	3.349	20	30		EGEDHN
Cn1c(Cl)cnc1C(C#N)C(=O)CCCC(=O)c1ccccc1	ZINC001346087982	1390906283	/nfs/dbraw/zinc/90/62/83/1390906283.db2.gz	PECAIPVPCQCSDP-ZDUSSCGKSA-N	0	3	329.787	3.303	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCSc1ccc(OC)cc1	ZINC001346096564	1390907204	/nfs/dbraw/zinc/90/72/04/1390907204.db2.gz	RAWVRFRXBDGDML-OAHLLOKOSA-N	0	3	329.425	3.270	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cc(C)cc([N+](=O)[O-])c2)CC1	ZINC001346656559	1390966777	/nfs/dbraw/zinc/96/67/77/1390966777.db2.gz	MCOSZNLKXFJMLH-UHFFFAOYSA-N	0	3	332.404	3.065	20	30		EGEDHN
C=CCn1c(-c2coc(C)c2)nnc1N1CCN(C2CCCC2)CC1	ZINC001351851169	1391701547	/nfs/dbraw/zinc/70/15/47/1391701547.db2.gz	GHUAVPKSXKQYLC-UHFFFAOYSA-N	0	3	341.459	3.097	20	30		EGEDHN
Cc1ccc(C(=O)N(C)[C@H](C)CNCc2ccc(C#N)s2)cc1C	ZINC001698857755	1406566716	/nfs/dbraw/zinc/56/67/16/1406566716.db2.gz	XZHVHMYCDGZWPJ-OAHLLOKOSA-N	0	3	341.480	3.487	20	30		EGEDHN
O=C(C#CC1CC1)N[C@@H]1CCCN(CCc2ccc3ccccc3c2)C1	ZINC001479903581	1392470279	/nfs/dbraw/zinc/47/02/79/1392470279.db2.gz	YTDRKKDMPZJZQS-JOCHJYFZSA-N	0	3	346.474	3.376	20	30		EGEDHN
CCCN(C(=O)[C@@H](C)C#N)C1CCN(Cc2cccc(OC)c2)CC1	ZINC001479992166	1392523771	/nfs/dbraw/zinc/52/37/71/1392523771.db2.gz	WSFMQJDMSHOGOV-INIZCTEOSA-N	0	3	343.471	3.058	20	30		EGEDHN
CC(C)C[C@H](CNCc1ccc(F)c(C#N)c1)NC(=O)CC1CC1	ZINC001698867746	1406584065	/nfs/dbraw/zinc/58/40/65/1406584065.db2.gz	ZKHHVBYLFQPJBL-QGZVFWFLSA-N	0	3	331.435	3.118	20	30		EGEDHN
C[C@@H](NC(=O)C(C)(C)C)[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001480388662	1392734261	/nfs/dbraw/zinc/73/42/61/1392734261.db2.gz	ZKKAAYGFXXUNMW-QAPCUYQASA-N	0	3	327.472	3.321	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)c1ccoc1CCC	ZINC001480804142	1392944159	/nfs/dbraw/zinc/94/41/59/1392944159.db2.gz	PUJUMJLNMPGHGT-GFCCVEGCSA-N	0	3	343.265	3.239	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)NCC[C@H]1CCN(Cc2ccc(C#N)c(F)c2)C1	ZINC001481426174	1394283544	/nfs/dbraw/zinc/28/35/44/1394283544.db2.gz	GZXIGXPBCZKPEF-WMLDXEAASA-N	0	3	343.446	3.072	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N[C@@H]1CCCN(Cc2ccc(C)cc2)C1)OCC	ZINC001481525890	1394377576	/nfs/dbraw/zinc/37/75/76/1394377576.db2.gz	OMYRZYMADHUTOD-UXHICEINSA-N	0	3	344.499	3.447	20	30		EGEDHN
C[C@@H](NCCC1CCN(C(=O)[C@@H](C)C#N)CC1)c1c(F)cccc1F	ZINC001481996406	1394656069	/nfs/dbraw/zinc/65/60/69/1394656069.db2.gz	FTVOQFGVFYKXCZ-UONOGXRCSA-N	0	3	349.425	3.404	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cccc(OCC)c2)CCCC1	ZINC001482231598	1394826503	/nfs/dbraw/zinc/82/65/03/1394826503.db2.gz	IAVDOYSHQJCTAS-UHFFFAOYSA-N	0	3	336.863	3.470	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cncc(C(F)(F)F)c1)C(C)C	ZINC001698977185	1406748598	/nfs/dbraw/zinc/74/85/98/1406748598.db2.gz	GNWWSUYSHSSXQJ-CYBMUJFWSA-N	0	3	349.784	3.197	20	30		EGEDHN
N#Cc1cccc(CN2CCCCC[C@@H]2CNC(=O)CC2CC2)c1	ZINC001485473690	1395951061	/nfs/dbraw/zinc/95/10/61/1395951061.db2.gz	WWAILJGGYQMZNS-LJQANCHMSA-N	0	3	325.456	3.219	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)N1CCC(N(C)CC#Cc2ccccc2Cl)CC1	ZINC001485761215	1396137224	/nfs/dbraw/zinc/13/72/24/1396137224.db2.gz	KHEDJBQPDAGFNS-CRAIPNDOSA-N	0	3	344.886	3.270	20	30		EGEDHN
C[C@@H](CNCc1ccccc1C#N)CNC(=O)c1cc2ccccc2o1	ZINC001495798381	1396559275	/nfs/dbraw/zinc/55/92/75/1396559275.db2.gz	MVZFHYKWGJNELP-HNNXBMFYSA-N	0	3	347.418	3.460	20	30		EGEDHN
Cc1cccc(CCC(=O)NCC[C@H](C)NCc2ccccc2C#N)c1	ZINC001690856692	1404779445	/nfs/dbraw/zinc/77/94/45/1404779445.db2.gz	UOFBZTAQOPEZAP-SFHVURJKSA-N	0	3	349.478	3.484	20	30		EGEDHN
C[C@@H](C(=O)NC[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1)C(C)(C)C	ZINC001691450218	1405276414	/nfs/dbraw/zinc/27/64/14/1405276414.db2.gz	MFGFNIPDNBUGBN-JLJPHGGASA-N	0	3	345.462	3.364	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)CCc2cc(C)cc(C)c2)C1	ZINC001691473981	1405291559	/nfs/dbraw/zinc/29/15/59/1405291559.db2.gz	WTFIPRCIBOHZTI-HDICACEKSA-N	0	3	334.891	3.473	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC[C@H]1C[C@@H](NCc2c(Cl)oc3ccccc32)C1	ZINC001691694272	1405428355	/nfs/dbraw/zinc/42/83/55/1405428355.db2.gz	JQLISHZVOJDVLJ-RWMBFGLXSA-N	0	3	345.830	3.230	20	30		EGEDHN
CC[C@@H](CNC(=O)CCc1ccccc1)NCc1ccc(C#N)s1	ZINC001732217754	1428465649	/nfs/dbraw/zinc/46/56/49/1428465649.db2.gz	OLJOWAKPPSXRCW-INIZCTEOSA-N	0	3	341.480	3.237	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2coc(CCC)n2)CCCC1	ZINC001732234169	1428480558	/nfs/dbraw/zinc/48/05/58/1428480558.db2.gz	DTASOMBNPTULBJ-UHFFFAOYSA-N	0	3	325.840	3.012	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCC1CCN(Cc2cccc(Cl)c2)CC1	ZINC001732319989	1428529860	/nfs/dbraw/zinc/52/98/60/1428529860.db2.gz	XXJKPNCYTXJCBS-AWEZNQCLSA-N	0	3	333.863	3.218	20	30		EGEDHN
Cc1cccc(CC(=O)N[C@@H](C)CN(C)Cc2cccc(C#N)c2)c1	ZINC001699458385	1412806199	/nfs/dbraw/zinc/80/61/99/1412806199.db2.gz	AAFKDJFOZQBBJH-KRWDZBQOSA-N	0	3	335.451	3.046	20	30		EGEDHN
C[C@@H](CN(C)Cc1cccc(C#N)c1)NC(=O)C1CCC(F)(F)CC1	ZINC001699464589	1412827791	/nfs/dbraw/zinc/82/77/91/1412827791.db2.gz	SKXNVYGBSPLZPR-AWEZNQCLSA-N	0	3	349.425	3.320	20	30		EGEDHN
CC(C)CCC(=O)N1CC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001699699294	1413111528	/nfs/dbraw/zinc/11/15/28/1413111528.db2.gz	BRBXASPBJXABBU-NRFANRHFSA-N	0	3	339.483	3.419	20	30		EGEDHN
C=C(Cl)CN[C@H](C)c1ccc(CNC(=O)CN(C)C2CCC2)cc1	ZINC001700094411	1413508848	/nfs/dbraw/zinc/50/88/48/1413508848.db2.gz	JQMSOAYRNMOKRI-OAHLLOKOSA-N	0	3	349.906	3.190	20	30		EGEDHN
CC(C)C(C)(C)C(=O)NC[C@H](C)N(C)Cc1ccc(OCC#N)cc1	ZINC001700462262	1414063149	/nfs/dbraw/zinc/06/31/49/1414063149.db2.gz	YSRWGCOCMPOEJW-INIZCTEOSA-N	0	3	345.487	3.208	20	30		EGEDHN
C[C@H](CNC(=O)c1ccc(Cl)o1)N(C)Cc1ccc(C#N)cc1	ZINC001700473043	1414092482	/nfs/dbraw/zinc/09/24/82/1414092482.db2.gz	HGUCROWYJBTCGZ-GFCCVEGCSA-N	0	3	331.803	3.055	20	30		EGEDHN
Cc1cc(C(=O)NC[C@H](C)N(C)Cc2ccc(C#N)cc2)sc1C	ZINC001700485470	1414131141	/nfs/dbraw/zinc/13/11/41/1414131141.db2.gz	LHOWZYMDHANVGY-AWEZNQCLSA-N	0	3	341.480	3.487	20	30		EGEDHN
CCCC[C@@H](CNCc1ccc(C#N)s1)NC(=O)C1=COCCC1	ZINC001700516791	1414169117	/nfs/dbraw/zinc/16/91/17/1414169117.db2.gz	KJJLDUODNPZYSO-HNNXBMFYSA-N	0	3	347.484	3.079	20	30		EGEDHN
CC(C)(C(=O)N[C@@H]1CCC[C@@H]1CNCc1ccccc1C#N)C(F)F	ZINC001732625149	1428888428	/nfs/dbraw/zinc/88/84/28/1428888428.db2.gz	OYIRQRAOFQOVHA-HZPDHXFCSA-N	0	3	349.425	3.224	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)[C@H](CC)CCC)C1	ZINC001707090530	1417196458	/nfs/dbraw/zinc/19/64/58/1417196458.db2.gz	UMXAJZNLVQITCJ-MGPQQGTHSA-N	0	3	331.298	3.206	20	30		EGEDHN
Cc1c(F)cccc1C(=O)N[C@@H](C)CN(C)Cc1cccc(C#N)c1	ZINC001733040259	1429168768	/nfs/dbraw/zinc/16/87/68/1429168768.db2.gz	ZVCOUGPDHJTNIV-AWEZNQCLSA-N	0	3	339.414	3.256	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1cc(C2CC2)no1	ZINC001707449360	1417353664	/nfs/dbraw/zinc/35/36/64/1417353664.db2.gz	WGXZKGVOQWQRKT-DOMZBBRYSA-N	0	3	337.851	3.277	20	30		EGEDHN
CCC1(C(=O)NC[C@@H](NCc2ccc(C#N)s2)C2CC2)CCC1	ZINC001713116564	1417681088	/nfs/dbraw/zinc/68/10/88/1417681088.db2.gz	GKSFHNFSZYPISI-MRXNPFEDSA-N	0	3	331.485	3.184	20	30		EGEDHN
CCC[C@H](C)CC(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2OC)C1	ZINC001713155506	1417733644	/nfs/dbraw/zinc/73/36/44/1417733644.db2.gz	OYVWBLKOKIRXHA-WBAXXEDZSA-N	0	3	343.471	3.130	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H](C)CN(C)Cc2ccc(C#N)cc2)cc1C	ZINC001733061977	1429211213	/nfs/dbraw/zinc/21/12/13/1429211213.db2.gz	GVQNUNXGFHMVBM-QGZVFWFLSA-N	0	3	335.451	3.425	20	30		EGEDHN
CC[C@H](SC)C(=O)N1CCCC[C@H]1CNCC#Cc1ccccc1	ZINC001713261516	1417870083	/nfs/dbraw/zinc/87/00/83/1417870083.db2.gz	VZYJAGZFJNHQHL-OALUTQOASA-N	0	3	344.524	3.150	20	30		EGEDHN
CCN(CCNC(=O)C(C)(C)c1ccccc1)Cc1cccc(C#N)c1	ZINC001713497006	1418207852	/nfs/dbraw/zinc/20/78/52/1418207852.db2.gz	UOILYSJFXMPIDE-UHFFFAOYSA-N	0	3	349.478	3.474	20	30		EGEDHN
CCCN(CCNC(=O)C(C)(C)C1CC1)Cc1ccc(F)c(C#N)c1	ZINC001713549074	1418324646	/nfs/dbraw/zinc/32/46/46/1418324646.db2.gz	FWVVCPUIUGAUDT-UHFFFAOYSA-N	0	3	345.462	3.462	20	30		EGEDHN
CCCCCCCN1CC[C@H](NC(=O)c2cnc3ccccc3n2)C1	ZINC001714997949	1419729631	/nfs/dbraw/zinc/72/96/31/1419729631.db2.gz	WOCBVHJOKYOPFA-INIZCTEOSA-N	0	3	340.471	3.404	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cc(C(C)C)nn1CC)C(C)C	ZINC001715495235	1420176659	/nfs/dbraw/zinc/17/66/59/1420176659.db2.gz	ITXACRINSOFMBB-HNNXBMFYSA-N	0	3	340.899	3.123	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cnc(-c2ccccc2)[nH]1)C(C)C	ZINC001715501946	1420184371	/nfs/dbraw/zinc/18/43/71/1420184371.db2.gz	HKBFOWRUKNYBAV-HNNXBMFYSA-N	0	3	346.862	3.173	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cc(CC(C)C)c[nH]1)C(C)C	ZINC001715501871	1420184523	/nfs/dbraw/zinc/18/45/23/1420184523.db2.gz	GNABEDSUBHNUOG-INIZCTEOSA-N	0	3	325.884	3.310	20	30		EGEDHN
CC(C)CCC(=O)N[C@H]1CCC[C@H]1CNCc1ccccc1C#N	ZINC001716054856	1420518696	/nfs/dbraw/zinc/51/86/96/1420518696.db2.gz	NHHGQFGKJQDMHW-OALUTQOASA-N	0	3	327.472	3.369	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H](C)CNCc2ccc(C#N)s2)c(F)c1F	ZINC001716454011	1420668656	/nfs/dbraw/zinc/66/86/56/1420668656.db2.gz	RRDWSRLSFKUJMX-NSHDSACASA-N	0	3	349.406	3.115	20	30		EGEDHN
Cc1ncsc1CN(CCNC(=O)[C@@H](C)C#N)C1CCCCCC1	ZINC001733275461	1429438329	/nfs/dbraw/zinc/43/83/29/1429438329.db2.gz	KRRZAZCTEPDXTK-AWEZNQCLSA-N	0	3	348.516	3.252	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCC1(NCc2ccc(-c3ccsc3)cc2)CC1	ZINC001716677957	1420833089	/nfs/dbraw/zinc/83/30/89/1420833089.db2.gz	OREKULDFTGWFMG-AWEZNQCLSA-N	0	3	339.464	3.313	20	30		EGEDHN
C[C@@]1(CNCc2ccccc2C#N)CCN(C(=O)c2ccccc2)C1	ZINC001716854975	1420986952	/nfs/dbraw/zinc/98/69/52/1420986952.db2.gz	GFRANGOUTODUFM-NRFANRHFSA-N	0	3	333.435	3.200	20	30		EGEDHN
CCC1(C(=O)NCC2(NCc3ccc(C#N)s3)CCC2)CCC1	ZINC001717155665	1421145497	/nfs/dbraw/zinc/14/54/97/1421145497.db2.gz	FCQZCBMBOMWGDF-UHFFFAOYSA-N	0	3	331.485	3.329	20	30		EGEDHN
C[C@H](C#N)C(=O)N(C)CC(C)(C)CN[C@@H](C)c1c(F)cccc1F	ZINC001717450983	1421380872	/nfs/dbraw/zinc/38/08/72/1421380872.db2.gz	FTXOGRZIKDNZPH-OLZOCXBDSA-N	0	3	337.414	3.260	20	30		EGEDHN
C=C(Br)CNCC(C)(C)CN(C)C(=O)C1(F)CCCC1	ZINC001717454423	1421383875	/nfs/dbraw/zinc/38/38/75/1421383875.db2.gz	AJYKGSRIQCPQBU-UHFFFAOYSA-N	0	3	349.288	3.252	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)CCC(F)(F)F)s1	ZINC001733337797	1429522205	/nfs/dbraw/zinc/52/22/05/1429522205.db2.gz	AULJGKPEVMCXRJ-NSHDSACASA-N	0	3	345.390	3.043	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)Cc1cccc(OC)c1	ZINC001725147002	1425629254	/nfs/dbraw/zinc/62/92/54/1425629254.db2.gz	LGHWOEZTEJFVBX-UHFFFAOYSA-N	0	3	338.879	3.064	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1cc2c[nH]ccc-2n1	ZINC001731292457	1427234755	/nfs/dbraw/zinc/23/47/55/1427234755.db2.gz	FETYVMSYZXVVOH-GUYCJALGSA-N	0	3	346.862	3.288	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@@H](CNC(=O)CCC2CCC2)C2CC2)c1	ZINC001731400846	1427361281	/nfs/dbraw/zinc/36/12/81/1427361281.db2.gz	UMKXPXYDKHURBL-IBGZPJMESA-N	0	3	343.446	3.262	20	30		EGEDHN
CCC[C@@H](CC)C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001731454510	1427430732	/nfs/dbraw/zinc/43/07/32/1427430732.db2.gz	DJYIFDIDJKQUFF-DJIMGWMZSA-N	0	3	331.435	3.260	20	30		EGEDHN
CCC(CC)CC(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2OC)C1	ZINC001731455370	1427431350	/nfs/dbraw/zinc/43/13/50/1427431350.db2.gz	PLTOVZGTASFAAQ-IYARVYRRSA-N	0	3	343.471	3.130	20	30		EGEDHN
CCC(C)(C)C(=O)NC[C@@H]1CCCN(Cc2ccc(C#N)cc2)C1	ZINC001731498408	1427476162	/nfs/dbraw/zinc/47/61/62/1427476162.db2.gz	LWMLHXWBPMRBIH-SFHVURJKSA-N	0	3	327.472	3.323	20	30		EGEDHN
CC(C)SCC(=O)N[C@H]1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC001733754150	1429966584	/nfs/dbraw/zinc/96/65/84/1429966584.db2.gz	LELLVQQBMHPHTG-SFHVURJKSA-N	0	3	345.512	3.171	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)CC2(C)CC2)CCN1Cc1cccc(C#N)c1	ZINC001733902551	1437720556	/nfs/dbraw/zinc/72/05/56/1437720556.db2.gz	VKCIHKYEGHWYOE-YJBOKZPZSA-N	0	3	325.456	3.218	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1cccc2c1OCC2	ZINC001734020078	1437809192	/nfs/dbraw/zinc/80/91/92/1437809192.db2.gz	KJKOUPLWBSAIIR-UHFFFAOYSA-N	0	3	336.863	3.062	20	30		EGEDHN
CN(C(=O)CC(C)(C)C)[C@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001734291531	1438021795	/nfs/dbraw/zinc/02/17/95/1438021795.db2.gz	CCRCLFRMVKCMPO-MRXNPFEDSA-N	0	3	333.501	3.383	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N2CCCC[C@H]2[C@@H](C)NCCF)cc1	ZINC001752146453	1440145972	/nfs/dbraw/zinc/14/59/72/1440145972.db2.gz	LULGLKQDFLHMRK-APWZRJJASA-N	0	3	346.446	3.031	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1cnc2[nH]ccc2c1	ZINC001752148407	1440146420	/nfs/dbraw/zinc/14/64/20/1440146420.db2.gz	YZTGZXLOQNBZAR-CZUORRHYSA-N	0	3	346.862	3.240	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)CN(C)c1ccccc1	ZINC001752153905	1440146447	/nfs/dbraw/zinc/14/64/47/1440146447.db2.gz	ADDIXZZXBKWCIT-SJLPKXTDSA-N	0	3	349.906	3.235	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCCN(CC)Cc2cccc(Cl)n2)C1	ZINC001752211637	1440155077	/nfs/dbraw/zinc/15/50/77/1440155077.db2.gz	DDHOWDULLKYPOF-UHFFFAOYSA-N	0	3	335.879	3.420	20	30		EGEDHN
C=C(C)CCC(=O)N(C)C1CCN(CCOc2cccc(F)c2)CC1	ZINC001752301975	1440167756	/nfs/dbraw/zinc/16/77/56/1440167756.db2.gz	WBNUKLJWNCPHFX-UHFFFAOYSA-N	0	3	348.462	3.484	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N(C)C1CCN(CCOCC2CCC2)CC1	ZINC001752304266	1440168258	/nfs/dbraw/zinc/16/82/58/1440168258.db2.gz	MUMLRLWITANJCG-UHFFFAOYSA-N	0	3	336.520	3.328	20	30		EGEDHN
CCCCCCCN1CC[C@@H](NC(=O)c2ncoc2C(F)(F)F)C1	ZINC001752391974	1440173616	/nfs/dbraw/zinc/17/36/16/1440173616.db2.gz	KBOVUMWEWRLHAI-GFCCVEGCSA-N	0	3	347.381	3.468	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)CCc2ccc(OCC)cc2)C1	ZINC001752638975	1440197556	/nfs/dbraw/zinc/19/75/56/1440197556.db2.gz	GUTSUKUXTUWWRF-WKILWMFISA-N	0	3	336.863	3.007	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H]2CN(Cc3ccsc3)CC[C@@H]21	ZINC001752706788	1440202884	/nfs/dbraw/zinc/20/28/84/1440202884.db2.gz	ROPCUGFASPYPLM-MSOLQXFVSA-N	0	3	330.497	3.365	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1C[C@@H](NCc2cccc(F)c2F)C1	ZINC001752753367	1440205057	/nfs/dbraw/zinc/20/50/57/1440205057.db2.gz	NQPDRFFIHKYZAF-IYBDPMFKSA-N	0	3	334.410	3.285	20	30		EGEDHN
O=C(C=C1CCC1)N1CCCC[C@H]1CNCC#Cc1ccc(F)cc1	ZINC001752826456	1440223849	/nfs/dbraw/zinc/22/38/49/1440223849.db2.gz	PEHBXUUASSCWTK-FQEVSTJZSA-N	0	3	340.442	3.258	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)CC(C)(C)C(F)(F)F)C1	ZINC001752841373	1440230707	/nfs/dbraw/zinc/23/07/07/1440230707.db2.gz	PUEWGVKKWXGPHC-KBPBESRZSA-N	0	3	332.410	3.205	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H](C)[C@H]1CCCN(Cc2ccccn2)C1	ZINC001752842490	1440231425	/nfs/dbraw/zinc/23/14/25/1440231425.db2.gz	XJCPNUNLHAMMSL-SJORKVTESA-N	0	3	329.488	3.401	20	30		EGEDHN
Cc1ccc(CCC(=O)NC[C@@H](C)NCc2ccc(C#N)s2)cc1	ZINC001752887547	1440240206	/nfs/dbraw/zinc/24/02/06/1440240206.db2.gz	YNLUVINBRWSYGA-OAHLLOKOSA-N	0	3	341.480	3.155	20	30		EGEDHN
C[C@@H](CNC(=O)C[C@H](C)c1ccco1)NCc1ccc(F)c(C#N)c1	ZINC001752912676	1440246019	/nfs/dbraw/zinc/24/60/19/1440246019.db2.gz	DSQUGQGXNNKZIK-KBPBESRZSA-N	0	3	343.402	3.078	20	30		EGEDHN
CCC[C@H](C)C(=O)N1CC[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001752937032	1440250477	/nfs/dbraw/zinc/25/04/77/1440250477.db2.gz	YBVILWKXGTYOQJ-GJZGRUSLSA-N	0	3	331.435	3.072	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](CNCc2ccccc2C#N)C1	ZINC001752947504	1440251642	/nfs/dbraw/zinc/25/16/42/1440251642.db2.gz	GDFUIUGBWNAMLQ-SFHVURJKSA-N	0	3	337.467	3.080	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1CCCNC(=O)c1ccc(Cl)[nH]1	ZINC001753034029	1440273865	/nfs/dbraw/zinc/27/38/65/1440273865.db2.gz	YTAQZWMJDMMEEK-GFCCVEGCSA-N	0	3	330.259	3.395	20	30		EGEDHN
CCN(CCNC(=O)c1ccc(F)s1)Cc1ccc(C#N)cc1	ZINC001753094520	1440301686	/nfs/dbraw/zinc/30/16/86/1440301686.db2.gz	BOWZTHLTHWFOMR-UHFFFAOYSA-N	0	3	331.416	3.011	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@@H]1CCN(Cc2sc(C)nc2C)C1	ZINC001753129278	1440316097	/nfs/dbraw/zinc/31/60/97/1440316097.db2.gz	NDCSVAIIHLMOEA-HNNXBMFYSA-N	0	3	335.517	3.300	20	30		EGEDHN
CCCN(CCNC(=O)C1CC(C)C1)Cc1ccc(F)c(C#N)c1	ZINC001753144387	1440323293	/nfs/dbraw/zinc/32/32/93/1440323293.db2.gz	UVUOOTLVYLRWSD-UHFFFAOYSA-N	0	3	331.435	3.072	20	30		EGEDHN
CC#CCN(CCC)CCNC(=O)c1sc(C(C)(C)C)nc1C	ZINC001753150504	1440327904	/nfs/dbraw/zinc/32/79/04/1440327904.db2.gz	KYJBYRTUBDQIRR-UHFFFAOYSA-N	0	3	335.517	3.214	20	30		EGEDHN
CC[C@H]1CCC[C@]1(C)C(=O)N(C)CCNCc1ccc(C#N)s1	ZINC001753202464	1440338360	/nfs/dbraw/zinc/33/83/60/1440338360.db2.gz	SKZRURFNNJHBAU-KSSFIOAISA-N	0	3	333.501	3.384	20	30		EGEDHN
CN(CCNCc1cccc(C#N)c1)C(=O)c1ccc(F)cc1Cl	ZINC001753257868	1440343850	/nfs/dbraw/zinc/34/38/50/1440343850.db2.gz	MFEOSEFAJKLLBJ-UHFFFAOYSA-N	0	3	345.805	3.213	20	30		EGEDHN
C#CCCCC(=O)N1CCC([C@@H](C)NC/C(Cl)=C/Cl)CC1	ZINC001753274764	1440346033	/nfs/dbraw/zinc/34/60/33/1440346033.db2.gz	IWWFDFXRNDABMS-LKKYZFDUSA-N	0	3	331.287	3.326	20	30		EGEDHN
CC(C)N(CCCNC(=O)[C@H](C)C1CC1)Cc1ccc(C#N)cc1F	ZINC001753284137	1440348302	/nfs/dbraw/zinc/34/83/02/1440348302.db2.gz	KNXUHJYMPUQPNH-OAHLLOKOSA-N	0	3	345.462	3.460	20	30		EGEDHN
C#CCCN[C@@H](CNC(=O)c1cccc(C(C)C)n1)c1ccccc1	ZINC001753299695	1440353610	/nfs/dbraw/zinc/35/36/10/1440353610.db2.gz	GAWNMXGDYBWWNZ-FQEVSTJZSA-N	0	3	335.451	3.289	20	30		EGEDHN
C#CCCN1CC[C@H](N(CCC)C(=O)Cc2cc(C)ccc2F)C1	ZINC001753319649	1440362402	/nfs/dbraw/zinc/36/24/02/1440362402.db2.gz	JUEGPJYAYHXXNV-SFHVURJKSA-N	0	3	330.447	3.013	20	30		EGEDHN
CCC(CC)C(=O)NCC[C@@H]1CCN(CC#Cc2ccccc2)C1	ZINC001753322707	1440364614	/nfs/dbraw/zinc/36/46/14/1440364614.db2.gz	PHLRWGMFKJZJMX-LJQANCHMSA-N	0	3	326.484	3.303	20	30		EGEDHN
C#CCCN1CC[C@H](N(CCC)C(=O)[C@H](C)c2cccc(OC)c2)C1	ZINC001753323134	1440364983	/nfs/dbraw/zinc/36/49/83/1440364983.db2.gz	LVTPYXTUSUIDCG-MJGOQNOKSA-N	0	3	342.483	3.135	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)NCC[C@@H]1CCN(Cc2ccc(F)c(C#N)c2)C1	ZINC001753333101	1440370614	/nfs/dbraw/zinc/37/06/14/1440370614.db2.gz	BQCLHYPNXUZUIF-RDTXWAMCSA-N	0	3	349.425	3.020	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC[C@@H]2CCN(Cc3cc(C)ns3)C2)C1	ZINC001753335547	1440372008	/nfs/dbraw/zinc/37/20/08/1440372008.db2.gz	RUDGVMAPUSAIGN-OAHLLOKOSA-N	0	3	333.501	3.136	20	30		EGEDHN
C=CCC1(C(=O)NCC[C@@H]2CCN([C@@H](C)c3cnccn3)C2)CCC1	ZINC001753336562	1440372739	/nfs/dbraw/zinc/37/27/39/1440372739.db2.gz	WCGOQCHJDTWTCI-DLBZAZTESA-N	0	3	342.487	3.112	20	30		EGEDHN
C=C(C)CN1CCC[C@H](N(Cc2ccccc2)C(=O)COCCC)C1	ZINC001753362491	1440383521	/nfs/dbraw/zinc/38/35/21/1440383521.db2.gz	ZHHBTJCYBRWGKM-FQEVSTJZSA-N	0	3	344.499	3.482	20	30		EGEDHN
CC#CCCCC(=O)NCC1CN(CCc2ccc(Cl)cc2)C1	ZINC001753408682	1440392606	/nfs/dbraw/zinc/39/26/06/1440392606.db2.gz	VUSHPWOFSFAPHV-UHFFFAOYSA-N	0	3	332.875	3.124	20	30		EGEDHN
C=CCCCN1C[C@@H]2C[C@H]1CN2C(=O)c1cn(C)c2ccc(F)cc12	ZINC001753421479	1440395365	/nfs/dbraw/zinc/39/53/65/1440395365.db2.gz	LGFUTSUHMZFITF-HOTGVXAUSA-N	0	3	341.430	3.182	20	30		EGEDHN
C=C(C)CCC(=O)N(C)[C@@H]1CCN(CCOc2ccccc2C)C1	ZINC001753437440	1440400547	/nfs/dbraw/zinc/40/05/47/1440400547.db2.gz	WIIWSKZFOJPSQK-GOSISDBHSA-N	0	3	330.472	3.263	20	30		EGEDHN
C=CCCCC(=O)N(C)[C@@H]1CCN(CC[C@H]2CC2(Cl)Cl)C1	ZINC001753442118	1440401968	/nfs/dbraw/zinc/40/19/68/1440401968.db2.gz	WAGXNDQBVHTUMN-UONOGXRCSA-N	0	3	333.303	3.459	20	30		EGEDHN
C=CCOCCN1CC[C@@H](N(C)C(=O)[C@H](CC)c2ccc(F)cc2)C1	ZINC001753450123	1440405568	/nfs/dbraw/zinc/40/55/68/1440405568.db2.gz	MYUWVOMJVPTXFB-RTBURBONSA-N	0	3	348.462	3.055	20	30		EGEDHN
CCN(C(=O)[C@@H](C)C#N)[C@H]1CCN(CCCc2ccccc2Cl)C1	ZINC001753453818	1440407319	/nfs/dbraw/zinc/40/73/19/1440407319.db2.gz	XWNHLBKRULESBS-RDJZCZTQSA-N	0	3	347.890	3.355	20	30		EGEDHN
CC[C@@H](CNC(=O)c1cscc1C)NCc1ccc(C#N)c(F)c1	ZINC001753469812	1440413766	/nfs/dbraw/zinc/41/37/66/1440413766.db2.gz	HABAOFKNGCVDNT-HNNXBMFYSA-N	0	3	345.443	3.366	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@H](CC)NCc2ccc(C#N)c(F)c2)C1	ZINC001753490443	1440419342	/nfs/dbraw/zinc/41/93/42/1440419342.db2.gz	WUPWWDRUDHKLOT-MRXNPFEDSA-N	0	3	329.419	3.038	20	30		EGEDHN
Cc1ccncc1C(=O)NC1(CNCC#Cc2ccccc2)CCCC1	ZINC001753500436	1440423207	/nfs/dbraw/zinc/42/32/07/1440423207.db2.gz	FZOPGAZXKOUNRG-UHFFFAOYSA-N	0	3	347.462	3.074	20	30		EGEDHN
O=C(NC1(CNCC#Cc2ccccc2)CCCC1)[C@@H]1C[C@H]1C1CC1	ZINC001753508924	1440425310	/nfs/dbraw/zinc/42/53/10/1440425310.db2.gz	XAWVEVJLVTWDMM-VQTJNVASSA-N	0	3	336.479	3.103	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1sc(C)nc1C)C1CC1	ZINC001753527700	1440429999	/nfs/dbraw/zinc/42/99/99/1440429999.db2.gz	PIBNSMYEWMWTFW-HNNXBMFYSA-N	0	3	327.881	3.001	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2ccc(C)n2C)CCCC[C@@H]1C	ZINC001753529302	1440430495	/nfs/dbraw/zinc/43/04/95/1440430495.db2.gz	CXWVUGKSLXSSPY-SCLBCKFNSA-N	0	3	337.895	3.354	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H](CCNCc2ocnc2C)C1	ZINC001753554790	1440435785	/nfs/dbraw/zinc/43/57/85/1440435785.db2.gz	HOWLIQCWWZTYBN-QFBILLFUSA-N	0	3	333.476	3.304	20	30		EGEDHN
CC#CCNCc1ccc(CNC(=O)c2cccc3[nH]ccc32)cc1	ZINC001753591041	1440442816	/nfs/dbraw/zinc/44/28/16/1440442816.db2.gz	UIWJSHGSAOKGLO-UHFFFAOYSA-N	0	3	331.419	3.211	20	30		EGEDHN
COCC#CCN1CCC(CCNC(=O)CC2(C)CCCCC2)CC1	ZINC001753595836	1440444548	/nfs/dbraw/zinc/44/45/48/1440444548.db2.gz	JOVHUZNNPVTGIO-UHFFFAOYSA-N	0	3	348.531	3.215	20	30		EGEDHN
C=CCC1(C(=O)NCCC2CCN(Cc3ocnc3C)CC2)CCC1	ZINC001753597552	1440445280	/nfs/dbraw/zinc/44/52/80/1440445280.db2.gz	XQZSWAVPXMIZAK-UHFFFAOYSA-N	0	3	345.487	3.448	20	30		EGEDHN
C[C@H](CNCc1cc(F)ccc1C#N)CNC(=O)C[C@@H]1C=CCCC1	ZINC001753620882	1440450442	/nfs/dbraw/zinc/45/04/42/1440450442.db2.gz	DGDIHXDDJLKMPC-HZPDHXFCSA-N	0	3	343.446	3.286	20	30		EGEDHN
C[C@@H](CNCc1ccccc1C#N)CNC(=O)C(C)(C)c1ccccc1	ZINC001753641942	1440454668	/nfs/dbraw/zinc/45/46/68/1440454668.db2.gz	FEHRURKZJARQQC-KRWDZBQOSA-N	0	3	349.478	3.378	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C1(CCOC)CCCC1)CC2	ZINC001753675794	1440463244	/nfs/dbraw/zinc/46/32/44/1440463244.db2.gz	LIUNBQCBKNBXCI-UHFFFAOYSA-N	0	3	334.504	3.084	20	30		EGEDHN
C#CCCCC(=O)N(C)[C@H](C)CN[C@@H]1CCc2c1c(F)ccc2F	ZINC001753686074	1440465541	/nfs/dbraw/zinc/46/55/41/1440465541.db2.gz	SXFQGZWUILAPAW-CXAGYDPISA-N	0	3	334.410	3.192	20	30		EGEDHN
C#CCCCCC(=O)N(C)[C@H](C)CNCC#Cc1cccc(Cl)c1	ZINC001753686193	1440465562	/nfs/dbraw/zinc/46/55/62/1440465562.db2.gz	SUKZDYLPZQABQC-QGZVFWFLSA-N	0	3	344.886	3.322	20	30		EGEDHN
Cc1csc(C(=O)N(C)[C@@H](C)CNCc2ccc(C#N)s2)c1	ZINC001753688789	1440466081	/nfs/dbraw/zinc/46/60/81/1440466081.db2.gz	DMRZNYXNYIXQDG-LBPRGKRZSA-N	0	3	333.482	3.240	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)c(F)c1)N(C)C(=O)C12CCC(CC1)C2	ZINC001753699642	1440468229	/nfs/dbraw/zinc/46/82/29/1440468229.db2.gz	ZUZGZBVHKXVJFQ-ZUIJCZDSSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@@H](C)CNCc2cccc(C(C)C)n2)C1	ZINC001753711957	1440470881	/nfs/dbraw/zinc/47/08/81/1440470881.db2.gz	AWZXESJAUOOREX-INIZCTEOSA-N	0	3	329.488	3.498	20	30		EGEDHN
Cc1nn(C(C)C)cc1CNC[C@H](CC(C)C)NC(=O)C#CC(C)C	ZINC001753734428	1440477241	/nfs/dbraw/zinc/47/72/41/1440477241.db2.gz	AUUUSPYPWNTCSN-IBGZPJMESA-N	0	3	346.519	3.052	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H]([C@H](C)NCc2nc(C)sc2C)C1	ZINC001753794040	1440489358	/nfs/dbraw/zinc/48/93/58/1440489358.db2.gz	JPPAQVZOAUMXJK-WMLDXEAASA-N	0	3	347.528	3.280	20	30		EGEDHN
C=C(Br)CNC[C@H]1[C@H](C)CCCN1C(=O)C=C(C)C	ZINC001753803240	1440491369	/nfs/dbraw/zinc/49/13/69/1440491369.db2.gz	KYHUDENRAWCFRW-OCCSQVGLSA-N	0	3	329.282	3.078	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H](C)[C@H]1CNCc1c(C)nsc1C	ZINC001753818969	1440495168	/nfs/dbraw/zinc/49/51/68/1440495168.db2.gz	OEEODBGNDFHMFC-KBXCAEBGSA-N	0	3	347.528	3.280	20	30		EGEDHN
C=CCC1(C(=O)NC[C@H](NCc2ncccc2C)C(C)C)CCC1	ZINC001753837073	1440501458	/nfs/dbraw/zinc/50/14/58/1440501458.db2.gz	ADMMLHUEANEFIK-KRWDZBQOSA-N	0	3	329.488	3.367	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H](NCC#Cc1ccc(F)cc1)C(C)C	ZINC001753838004	1440501686	/nfs/dbraw/zinc/50/16/86/1440501686.db2.gz	QJJMRFJHRIHFIY-LJQANCHMSA-N	0	3	330.447	3.264	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)COc1cc(C)ccc1C)C(C)C	ZINC001753842404	1440503248	/nfs/dbraw/zinc/50/32/48/1440503248.db2.gz	KIKCWNJRXVPNRP-MRXNPFEDSA-N	0	3	338.879	3.165	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H]2[C@@H](CCN2Cc2oc(CC)nc2C)C1	ZINC001753873354	1440518092	/nfs/dbraw/zinc/51/80/92/1440518092.db2.gz	SCZYWYPUBNRWGJ-DLBZAZTESA-N	0	3	345.487	3.325	20	30		EGEDHN
C[C@@H](CCNCc1cc(C#N)ccc1F)NC(=O)c1ccoc1Cl	ZINC001753960844	1440526218	/nfs/dbraw/zinc/52/62/18/1440526218.db2.gz	JMTRMOQLQFPOQG-NSHDSACASA-N	0	3	349.793	3.242	20	30		EGEDHN
C=C(Cl)CNCC[C@H](C)NC(=O)c1cccc(N2CCCC2)c1	ZINC001754022315	1440532661	/nfs/dbraw/zinc/53/26/61/1440532661.db2.gz	ZFTAUJREVQAYIL-HNNXBMFYSA-N	0	3	335.879	3.137	20	30		EGEDHN
N#Cc1ccc(CNC/C=C/CNC(=O)[C@@]23C[C@@H]2CCCC3)cc1F	ZINC001754169554	1440546877	/nfs/dbraw/zinc/54/68/77/1440546877.db2.gz	VCLYDHKGHGTNII-LADOFLMKSA-N	0	3	341.430	3.040	20	30		EGEDHN
C=C[C@@H](CC(=O)N[C@H](C)CNCc1cc(C)ns1)c1ccccc1	ZINC001754254565	1440558854	/nfs/dbraw/zinc/55/88/54/1440558854.db2.gz	HGRRWUIEGHUMSE-CVEARBPZSA-N	0	3	343.496	3.406	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccccc1)NC(=O)c1sccc1C1CC1	ZINC001754292206	1440565427	/nfs/dbraw/zinc/56/54/27/1440565427.db2.gz	AKZGHNOLNYYCMD-HNNXBMFYSA-N	0	3	338.476	3.385	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H](C)CN(C)CCOc2cccc(C)c2)C1	ZINC001754325388	1440580123	/nfs/dbraw/zinc/58/01/23/1440580123.db2.gz	OOALPGCCEWMDIS-QGZVFWFLSA-N	0	3	330.472	3.167	20	30		EGEDHN
C=CCOCCN(C)C[C@H](C)NC(=O)c1cccc2ccsc21	ZINC001754331587	1440584235	/nfs/dbraw/zinc/58/42/35/1440584235.db2.gz	UZYNYUCZFFZDOV-AWEZNQCLSA-N	0	3	332.469	3.154	20	30		EGEDHN
CN(CCCNCc1cc(C#N)ccc1F)C(=O)[C@H]1CC12CCCC2	ZINC001754407128	1440595718	/nfs/dbraw/zinc/59/57/18/1440595718.db2.gz	MLRUCQDDOYBWAH-QGZVFWFLSA-N	0	3	343.446	3.216	20	30		EGEDHN
O=C(N[C@H](CNCC#Cc1ccc(F)cc1)C1CC1)C1CCCCC1	ZINC001754435512	1440598106	/nfs/dbraw/zinc/59/81/06/1440598106.db2.gz	LFXDQRBEOKPYJE-HXUWFJFHSA-N	0	3	342.458	3.242	20	30		EGEDHN
CC1(C(=O)N[C@@H](CNCc2ccc(C#N)c(F)c2)C2CC2)CCCC1	ZINC001754446830	1440600158	/nfs/dbraw/zinc/60/01/58/1440600158.db2.gz	QSXSCCZCHYMPFA-SFHVURJKSA-N	0	3	343.446	3.262	20	30		EGEDHN
CC[C@@H](C)CCC(=O)N[C@@H](CNCC#Cc1ccccc1)C1CC1	ZINC001754455183	1440602017	/nfs/dbraw/zinc/60/20/17/1440602017.db2.gz	NLJRBGKNLVBDIR-XLIONFOSSA-N	0	3	326.484	3.349	20	30		EGEDHN
C=CCCCN1CC[C@H]1CNC(=O)c1ocnc1-c1ccccc1	ZINC001754485567	1440608620	/nfs/dbraw/zinc/60/86/20/1440608620.db2.gz	XUKFVJZHKDELGR-INIZCTEOSA-N	0	3	325.412	3.112	20	30		EGEDHN
CCCCCCCN1CC[C@@H]1CNC(=O)c1ccc2c(c1)COC2	ZINC001754497574	1440612657	/nfs/dbraw/zinc/61/26/57/1440612657.db2.gz	NSORQQGAOZKXPE-LJQANCHMSA-N	0	3	330.472	3.491	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)C[C@@H]1CCc2ccccc2C1	ZINC001754499575	1440613366	/nfs/dbraw/zinc/61/33/66/1440613366.db2.gz	ATJBNXMEXSSUCL-XLIONFOSSA-N	0	3	326.484	3.338	20	30		EGEDHN
C=CCCCN1CC[C@@H]1CNC(=O)c1c[nH]nc1C1CCCCC1	ZINC001754501640	1440614795	/nfs/dbraw/zinc/61/47/95/1440614795.db2.gz	ZMFQOPVPUQICOG-MRXNPFEDSA-N	0	3	330.476	3.228	20	30		EGEDHN
CC[C@H](C)CCC(=O)NCC1(NCc2ccc(F)c(C#N)c2)CC1	ZINC001754529290	1440621823	/nfs/dbraw/zinc/62/18/23/1440621823.db2.gz	DUCBYXMKOYPXED-AWEZNQCLSA-N	0	3	331.435	3.262	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)CC2(C(F)(F)F)CC2)C1	ZINC001754537757	1440625193	/nfs/dbraw/zinc/62/51/93/1440625193.db2.gz	CYPWJKBORVGGEO-LSDHHAIUSA-N	0	3	342.405	3.055	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@]2(C1)CCCN(CCc1csc(C)n1)C2	ZINC001754556178	1440631740	/nfs/dbraw/zinc/63/17/40/1440631740.db2.gz	WHCIFZAWFQCWIB-IBGZPJMESA-N	0	3	347.528	3.275	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@]2(C1)CCCN(Cc1ccccn1)C2	ZINC001754557684	1440632389	/nfs/dbraw/zinc/63/23/89/1440632389.db2.gz	QWOMDFWUFIVUGZ-NRFANRHFSA-N	0	3	339.483	3.090	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)CCCc3cccs3)C2)CC1	ZINC001754560821	1440633693	/nfs/dbraw/zinc/63/36/93/1440633693.db2.gz	CIGLGNSZWLABBP-UHFFFAOYSA-N	0	3	330.497	3.019	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CCC[C@H]1CNCc1ccccc1F)OCC	ZINC001754610356	1440643727	/nfs/dbraw/zinc/64/37/27/1440643727.db2.gz	DTHJTAMNLFXARJ-HKUYNNGSSA-N	0	3	348.462	3.278	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)Cc2cccc(OC(C)C)c2)CC1	ZINC001754629793	1440647442	/nfs/dbraw/zinc/64/74/42/1440647442.db2.gz	LZJUWZXEZGJPAK-UHFFFAOYSA-N	0	3	330.472	3.173	20	30		EGEDHN
C#CCN1CCC2(CO[C@H](CNC(=O)[C@@H](CCCC)C(C)C)C2)CC1	ZINC001754632053	1440648093	/nfs/dbraw/zinc/64/80/93/1440648093.db2.gz	ISKZYGSXRCGVFU-OALUTQOASA-N	0	3	348.531	3.069	20	30		EGEDHN
C#CCN1CCC2(CO[C@H](CNC(=O)C[C@@H](C)CC(C)(C)C)C2)CC1	ZINC001754631817	1440648150	/nfs/dbraw/zinc/64/81/50/1440648150.db2.gz	CINLONDDTBOTOZ-MSOLQXFVSA-N	0	3	348.531	3.069	20	30		EGEDHN
C#CCN(C(=O)c1ccc(F)cc1Cl)C1CCN(CC=C)CC1	ZINC001754642359	1440649299	/nfs/dbraw/zinc/64/92/99/1440649299.db2.gz	MVEOJRBUMVEANF-UHFFFAOYSA-N	0	3	334.822	3.205	20	30		EGEDHN
C[C@@]1(CNCc2ccccc2C#N)CCN(C(=O)CCC2CCC2)C1	ZINC001754693785	1440666679	/nfs/dbraw/zinc/66/66/79/1440666679.db2.gz	YCORFJKFEXTCIA-NRFANRHFSA-N	0	3	339.483	3.467	20	30		EGEDHN
C#CCN1CCC(C)(CNC(=O)C(C)(C)c2ccc(CC)cc2)CC1	ZINC001754721487	1440673389	/nfs/dbraw/zinc/67/33/89/1440673389.db2.gz	PXFSPHJZENISNW-UHFFFAOYSA-N	0	3	340.511	3.378	20	30		EGEDHN
CC#CCN1CCC[C@](C)(CNC(=O)c2ccc(C(C)C)cn2)C1	ZINC001754730716	1440679170	/nfs/dbraw/zinc/67/91/70/1440679170.db2.gz	LNPQCZGNJWUWOU-HXUWFJFHSA-N	0	3	327.472	3.060	20	30		EGEDHN
CC#CCN1CCC[C@](C)(CNC(=O)C(C)(C)c2cccc(F)c2)C1	ZINC001754730722	1440679192	/nfs/dbraw/zinc/67/91/92/1440679192.db2.gz	LSOXZSQJYJNHHP-OAQYLSRUSA-N	0	3	344.474	3.345	20	30		EGEDHN
C=C(C)CN1CC[C@@](O)(CNC(=O)c2ccccc2CC(C)(C)C)C1	ZINC001754754756	1440685116	/nfs/dbraw/zinc/68/51/16/1440685116.db2.gz	QVFBYYIDBPNHCT-OAQYLSRUSA-N	0	3	344.499	3.018	20	30		EGEDHN
C/C=C(/C)C(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(Cc1ccc(C#N)cc1F)C2	ZINC001754782022	1440686474	/nfs/dbraw/zinc/68/64/74/1440686474.db2.gz	WEEWWGMGLFEMAJ-FRJYZQEQSA-N	0	3	341.430	3.133	20	30		EGEDHN
C/C=C(\C)C(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(Cc1ccc(C#N)cc1F)C2	ZINC001754782025	1440686500	/nfs/dbraw/zinc/68/65/00/1440686500.db2.gz	WEEWWGMGLFEMAJ-YEFJLWMCSA-N	0	3	341.430	3.133	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2Cc1cnc(C)o1	ZINC001754831951	1440695787	/nfs/dbraw/zinc/69/57/87/1440695787.db2.gz	VQADDODRTDHQAU-BJWYYQGGSA-N	0	3	345.487	3.445	20	30		EGEDHN
CC(C)C(=O)N(CCNCc1ccc(C#N)cc1)Cc1ccccc1	ZINC001754836322	1440696855	/nfs/dbraw/zinc/69/68/55/1440696855.db2.gz	JLNQPEADRGASGV-UHFFFAOYSA-N	0	3	335.451	3.333	20	30		EGEDHN
CC#CCNCCN(Cc1ccccc1)C(=O)C1(C(C)(F)F)CC1	ZINC001754837199	1440697013	/nfs/dbraw/zinc/69/70/13/1440697013.db2.gz	FYKBJQIVZSDERW-UHFFFAOYSA-N	0	3	334.410	3.064	20	30		EGEDHN
C=CCCC(=O)N(Cc1ccccn1)C1CCN(CC(=C)C)CC1	ZINC001754839072	1440697457	/nfs/dbraw/zinc/69/74/57/1440697457.db2.gz	BLGMRAVXWFYPDM-UHFFFAOYSA-N	0	3	327.472	3.417	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@H]2CN([C@H](C)c3ccc(Cl)cc3)C[C@H]2C1	ZINC001754842134	1440698098	/nfs/dbraw/zinc/69/80/98/1440698098.db2.gz	LDDBTWAEVOOOSP-NXHRZFHOSA-N	0	3	344.886	3.451	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@H](CC(C)C)c3ccccc3)C[C@@H]2C1	ZINC001754844351	1440698685	/nfs/dbraw/zinc/69/86/85/1440698685.db2.gz	INTCBVSEXPGIMH-QHAWAJNXSA-N	0	3	338.495	3.230	20	30		EGEDHN
C=C1CCC(C(=O)N[C@]2(CO)CCCN(CC/C=C/CC)C2)CC1	ZINC001754858391	1440700485	/nfs/dbraw/zinc/70/04/85/1440700485.db2.gz	ZJGXJHQHLMPFMP-DPZZJQGRSA-N	0	3	334.504	3.032	20	30		EGEDHN
N#Cc1ccc(F)c(CNCC[C@H]2CCN(C(=O)CCC3CC3)C2)c1	ZINC001754907416	1440707620	/nfs/dbraw/zinc/70/76/20/1440707620.db2.gz	FEAFLKAAAHASTE-INIZCTEOSA-N	0	3	343.446	3.216	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](CCNCc2cc(F)ccc2F)C1	ZINC001754910291	1440708102	/nfs/dbraw/zinc/70/81/02/1440708102.db2.gz	IDDCIBMCOHJIMA-MRXNPFEDSA-N	0	3	348.437	3.487	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCN(C(=O)c2cc(F)c(C)cc2F)C1	ZINC001754919926	1440709178	/nfs/dbraw/zinc/70/91/78/1440709178.db2.gz	XWMXBZNEVQKYKP-CYBMUJFWSA-N	0	3	342.817	3.468	20	30		EGEDHN
C=CCN(C)Cc1ccccc1CNC(=O)c1conc1C(C)C	ZINC001754946218	1440713101	/nfs/dbraw/zinc/71/31/01/1440713101.db2.gz	ZXSUIYHICWQCHJ-UHFFFAOYSA-N	0	3	327.428	3.346	20	30		EGEDHN
COCC#CCN[C@H](C)c1ccc(CNC(=O)C(C)=C2CCC2)cc1	ZINC001754948335	1440714121	/nfs/dbraw/zinc/71/41/21/1440714121.db2.gz	YKSKGNWEHKEWEI-QGZVFWFLSA-N	0	3	340.467	3.104	20	30		EGEDHN
CC#CCN[C@@H](C)c1ccc(CNC(=O)c2nc(CC)oc2C)cc1	ZINC001754949247	1440714645	/nfs/dbraw/zinc/71/46/45/1440714645.db2.gz	YSVSMGZRJCICGU-AWEZNQCLSA-N	0	3	339.439	3.149	20	30		EGEDHN
COCC#CCN[C@@H](C)c1ccc(CNC(=O)/C=C/C(C)(C)C)cc1	ZINC001754954378	1440715953	/nfs/dbraw/zinc/71/59/53/1440715953.db2.gz	RWCHKYRCYDZVAK-UJGDBWEASA-N	0	3	342.483	3.206	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC1(NCc2ccc([N+](=O)[O-])cc2)CCC1	ZINC001754984280	1440722232	/nfs/dbraw/zinc/72/22/32/1440722232.db2.gz	BTJADMKZDOPZAQ-UHFFFAOYSA-N	0	3	345.443	3.326	20	30		EGEDHN
CC#CCNC[C@@H]1CN(C(=O)[C@H](CCC)CC2CCCCC2)CCO1	ZINC001755009657	1440725859	/nfs/dbraw/zinc/72/58/59/1440725859.db2.gz	PCYGTNJCKKFCTA-WOJBJXKFSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=C(C)CCN1CCN([C@H]2CCN(C(=O)[C@H](C)C(CC)CC)C2)CC1	ZINC001755019978	1440726438	/nfs/dbraw/zinc/72/64/38/1440726438.db2.gz	VTBCDEZDHYGNRD-QUCCMNQESA-N	0	3	349.563	3.243	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1CCCN(Cc2ccc3nonc3c2)CC1	ZINC001755025296	1440728486	/nfs/dbraw/zinc/72/84/86/1440728486.db2.gz	RGRHCXCGRCSMBX-INIZCTEOSA-N	0	3	342.443	3.050	20	30		EGEDHN
CC(F)(F)CCC(=O)N[C@@H]1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC001755026539	1440729070	/nfs/dbraw/zinc/72/90/70/1440729070.db2.gz	RHRLLQHVLSCZAC-QGZVFWFLSA-N	0	3	349.425	3.464	20	30		EGEDHN
CCC1(NCc2cscn2)CCN(C(=O)C#CC(C)(C)C)CC1	ZINC001755069118	1440745978	/nfs/dbraw/zinc/74/59/78/1440745978.db2.gz	ULWFSXVYQFNIST-UHFFFAOYSA-N	0	3	333.501	3.053	20	30		EGEDHN
COCC#CCN1CCC(CCCCCNC(=O)C2CC(C)C2)CC1	ZINC001755073794	1440747664	/nfs/dbraw/zinc/74/76/64/1440747664.db2.gz	GHENBKCYXNPXQT-UHFFFAOYSA-N	0	3	348.531	3.071	20	30		EGEDHN
C=C(C)CCN1Cc2ccccc2C[C@@H]1CNC(=O)CC[C@H](C)OC	ZINC001755075587	1440748350	/nfs/dbraw/zinc/74/83/50/1440748350.db2.gz	JRYNCTWNSUJAEH-FXAWDEMLSA-N	0	3	344.499	3.311	20	30		EGEDHN
C=CCCCN1Cc2ccccc2C[C@H]1CNC(=O)c1ccsn1	ZINC001755076143	1440748926	/nfs/dbraw/zinc/74/89/26/1440748926.db2.gz	UXJIRBFKNQNZLH-KRWDZBQOSA-N	0	3	341.480	3.266	20	30		EGEDHN
Cc1cc(F)ccc1CN1CC[C@@H](NC(=O)[C@H](C)C#N)C(C)(C)C1	ZINC001755139382	1440759668	/nfs/dbraw/zinc/75/96/68/1440759668.db2.gz	HUMSIFDEHKBOHL-RHSMWYFYSA-N	0	3	331.435	3.011	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)[C@@H](C)OCc2cccc(C)c2)C(C)(C)C1	ZINC001755142014	1440761093	/nfs/dbraw/zinc/76/10/93/1440761093.db2.gz	RTNSINNLIDPGFO-IEBWSBKVSA-N	0	3	344.499	3.303	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1CCN(CCc2ccns2)CC1(C)C	ZINC001755142819	1440761486	/nfs/dbraw/zinc/76/14/86/1440761486.db2.gz	VIFITJAHBJBEGP-INIZCTEOSA-N	0	3	335.517	3.259	20	30		EGEDHN
C=CCCCN1CCc2ccccc2[C@H]1CNC(=O)[C@H](C)OCC	ZINC001755171628	1440769124	/nfs/dbraw/zinc/76/91/24/1440769124.db2.gz	ALSJQYDJLAGGPF-QFBILLFUSA-N	0	3	330.472	3.093	20	30		EGEDHN
CC(C)CCCN1CCc2ccccc2[C@H]1CNC(=O)[C@@H](C)C#N	ZINC001755172172	1440769749	/nfs/dbraw/zinc/76/97/49/1440769749.db2.gz	LIIXKTBPLQZUBF-QFBILLFUSA-N	0	3	327.472	3.298	20	30		EGEDHN
C=CCCCCCN1CCOC2(CCN(C(=O)[C@H](C)C3CC3)CC2)C1	ZINC001755174151	1440770335	/nfs/dbraw/zinc/77/03/35/1440770335.db2.gz	LMUAMKXLHBHJSR-GOSISDBHSA-N	0	3	348.531	3.472	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC[C@@H]2CN(C)CCOCCCC)cc1	ZINC001755196105	1440776897	/nfs/dbraw/zinc/77/68/97/1440776897.db2.gz	FMXAMIFSJAOEIR-HXUWFJFHSA-N	0	3	342.483	3.021	20	30		EGEDHN
C=CCN(C)C[C@@H]1CCCN1C(=O)[C@H](C)CCOc1ccccc1	ZINC001755203579	1440781411	/nfs/dbraw/zinc/78/14/11/1440781411.db2.gz	YXZIVPHQEZNHCE-MSOLQXFVSA-N	0	3	330.472	3.200	20	30		EGEDHN
C[C@@H](NCC#Cc1ccccc1)[C@@H](C)NC(=O)C(C)(C)C1CCC1	ZINC001755247133	1440790949	/nfs/dbraw/zinc/79/09/49/1440790949.db2.gz	ZAEVMSMUMMSXTJ-IAGOWNOFSA-N	0	3	326.484	3.347	20	30		EGEDHN
CCCC1(C(=O)N[C@H](C)[C@H](C)NCC#Cc2ccc(F)cc2)CC1	ZINC001755252943	1440792429	/nfs/dbraw/zinc/79/24/29/1440792429.db2.gz	MXUDQFYGRNXXKJ-JKSUJKDBSA-N	0	3	330.447	3.240	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)C[C@H]1CCC[C@@H](OC)C1	ZINC001755282292	1440800947	/nfs/dbraw/zinc/80/09/47/1440800947.db2.gz	LZSWMIGDMNTISM-JKSUJKDBSA-N	0	3	344.927	3.408	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)C[C@H]1CC[C@H](C2CC2)O1	ZINC001755282709	1440800989	/nfs/dbraw/zinc/80/09/89/1440800989.db2.gz	CEIJQAMUOQVGRM-HZPDHXFCSA-N	0	3	342.911	3.161	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H](C)C1CN(CCCc2ccsc2)C1	ZINC001755381868	1440839522	/nfs/dbraw/zinc/83/95/22/1440839522.db2.gz	BKTYESTWYYMQIU-INIZCTEOSA-N	0	3	332.513	3.311	20	30		EGEDHN
C=C[C@@H](C(=O)N[C@H](C)C1CN(CC2CC(F)(F)C2)C1)c1ccccc1	ZINC001755390998	1440842113	/nfs/dbraw/zinc/84/21/13/1440842113.db2.gz	DGUQIABCGQDUTL-RDTXWAMCSA-N	0	3	348.437	3.438	20	30		EGEDHN
C=C[C@@H](C(=O)N[C@@H](C)C1CN(CC2CC(F)(F)C2)C1)c1ccccc1	ZINC001755390995	1440842138	/nfs/dbraw/zinc/84/21/38/1440842138.db2.gz	DGUQIABCGQDUTL-KBXCAEBGSA-N	0	3	348.437	3.438	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)C23CC(C(C)(C)C)(C2)C3)C(C)(C)C1	ZINC001755415869	1440848688	/nfs/dbraw/zinc/84/86/88/1440848688.db2.gz	MGYAGFVZGYLFHQ-YMTQGWHGSA-N	0	3	348.531	3.232	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@@H]2CN(Cc3ccnc(Cl)c3)C[C@@H]2C1	ZINC001755449240	1440852738	/nfs/dbraw/zinc/85/27/38/1440852738.db2.gz	DDNPLXHFPCPCRU-IXDOHACOSA-N	0	3	347.890	3.418	20	30		EGEDHN
C#CCN1C[C@]2(C)CN(C(=O)CC/C=C\c3ccccc3)C[C@]2(C)C1	ZINC001755461195	1440857572	/nfs/dbraw/zinc/85/75/72/1440857572.db2.gz	WQFHXSVWZBYYEI-XEYBBXKNSA-N	0	3	336.479	3.284	20	30		EGEDHN
Cc1ccoc1C(=O)N[C@@H](C)CCCNCc1ccc(C#N)cc1F	ZINC001755488671	1440861197	/nfs/dbraw/zinc/86/11/97/1440861197.db2.gz	PVGKBHAMQAQQMZ-AWEZNQCLSA-N	0	3	343.402	3.287	20	30		EGEDHN
CC/C(C)=C/C(=O)N(C)[C@H](CNCc1cc(C#N)ccc1F)C1CC1	ZINC001755571636	1440877121	/nfs/dbraw/zinc/87/71/21/1440877121.db2.gz	PRXGVZNDKHRBML-CECLQJIQSA-N	0	3	343.446	3.380	20	30		EGEDHN
C[C@@H](CN(C)C(=O)c1sccc1F)NCc1ccc(C#N)s1	ZINC001755585181	1440880339	/nfs/dbraw/zinc/88/03/39/1440880339.db2.gz	LMPWLHJLCHFSRQ-JTQLQIEISA-N	0	3	337.445	3.071	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N(C)C[C@H](C)NCc1ccc(OC)c(C#N)c1	ZINC001755602067	1440884298	/nfs/dbraw/zinc/88/42/98/1440884298.db2.gz	PRIRTLNHNBKSQN-NHKNYXOTSA-N	0	3	341.455	3.026	20	30		EGEDHN
CCC[C@H](CC)C(=O)N(C)C[C@@H](C)NCC#Cc1ccc(F)cc1	ZINC001755611823	1440887349	/nfs/dbraw/zinc/88/73/49/1440887349.db2.gz	VCQPSGYOTQLZOJ-AEFFLSMTSA-N	0	3	332.463	3.440	20	30		EGEDHN
C=CCC1(C(=O)NC[C@H](CO)N[C@@H](C)c2ccccc2C)CCCC1	ZINC001755649429	1440891131	/nfs/dbraw/zinc/89/11/31/1440891131.db2.gz	UVNFRBLJKHMLEP-ZWKOTPCHSA-N	0	3	344.499	3.259	20	30		EGEDHN
C#CCN1CC[C@]2(NC(=O)C[C@H](C)c3ccc(CC)cc3)CCC[C@@H]12	ZINC001755699930	1440899484	/nfs/dbraw/zinc/89/94/84/1440899484.db2.gz	DGEUFXYGYVCXLL-UCNVEGJOSA-N	0	3	338.495	3.489	20	30		EGEDHN
C#CCN1CC[C@]2(NC(=O)CCCc3sccc3C)CCC[C@H]12	ZINC001755704066	1440901711	/nfs/dbraw/zinc/90/17/11/1440901711.db2.gz	HFKLEESNRXHRNX-PKOBYXMFSA-N	0	3	330.497	3.126	20	30		EGEDHN
C=C(Cl)CN[C@H](CCNC(=O)c1ccns1)Cc1ccccc1	ZINC001755724546	1440909049	/nfs/dbraw/zinc/90/90/49/1440909049.db2.gz	XYBNXPJVJQCPTJ-OAHLLOKOSA-N	0	3	349.887	3.216	20	30		EGEDHN
CC(C)CCC(=O)N1C[C@H](NCc2ccc(C#N)s2)C(C)(C)C1	ZINC001755751705	1440913269	/nfs/dbraw/zinc/91/32/69/1440913269.db2.gz	UUIVBXAUKWOMNA-INIZCTEOSA-N	0	3	333.501	3.383	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](NCc2ccc(Cl)nc2)C(C)(C)C1	ZINC001755757588	1440914321	/nfs/dbraw/zinc/91/43/21/1440914321.db2.gz	NXZUDDBDRSSQFS-OAHLLOKOSA-N	0	3	335.879	3.418	20	30		EGEDHN
CC1(C)CN(C(=O)CC#Cc2ccccc2)C[C@@H]1NC/C=C/Cl	ZINC001755767605	1440916508	/nfs/dbraw/zinc/91/65/08/1440916508.db2.gz	ZRAPDXWYLVZJPX-CRVDFBCUSA-N	0	3	330.859	3.007	20	30		EGEDHN
C#CCCN(C)CCN(C(=O)C[C@@H]1CCc2ccccc21)C(C)C	ZINC001755814649	1440922616	/nfs/dbraw/zinc/92/26/16/1440922616.db2.gz	JSUIXUNGXAZDGQ-IBGZPJMESA-N	0	3	326.484	3.299	20	30		EGEDHN
CC[C@H](C)C(=O)N[C@H](CNCc1cc(C#N)ccc1OC)C(C)(C)C	ZINC001755818589	1440924943	/nfs/dbraw/zinc/92/49/43/1440924943.db2.gz	OVGBEKXBAPAFIG-KBXCAEBGSA-N	0	3	345.487	3.233	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)C2CCN(CC#CC)CC2)CCCCC1	ZINC001755845222	1440933028	/nfs/dbraw/zinc/93/30/28/1440933028.db2.gz	BNLUBGAQXLWIIA-GOSISDBHSA-N	0	3	328.500	3.200	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@H](C)C1CCN(Cc2cccnc2)CC1	ZINC001755845142	1440933034	/nfs/dbraw/zinc/93/30/34/1440933034.db2.gz	YDMNXLGSURUDSP-OXQOHEQNSA-N	0	3	329.488	3.401	20	30		EGEDHN
CC#CCN1CCC(C2(NC(=O)Cn3ccc4ccccc43)CC2)CC1	ZINC001755869802	1440938742	/nfs/dbraw/zinc/93/87/42/1440938742.db2.gz	PEPJENYOTLMCDN-UHFFFAOYSA-N	0	3	349.478	3.025	20	30		EGEDHN
CC(C)CN1CCN(c2nc(-c3cccs3)ccc2C#N)CC1	ZINC001164657563	719337708	/nfs/dbraw/zinc/33/77/08/719337708.db2.gz	RTBSHBHSBGRGMY-UHFFFAOYSA-N	0	3	326.469	3.460	20	30		EGEDHN
C#Cc1cccc(NC(=O)c2ccc(CN3CCC(CO)CC3)cc2)c1	ZINC000298684072	202346354	/nfs/dbraw/zinc/34/63/54/202346354.db2.gz	LAXUTLRTIFTVDB-UHFFFAOYSA-N	0	3	348.446	3.125	20	30		EGEDHN
CN(C(=O)c1cccc(C#N)c1)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000074447501	202373337	/nfs/dbraw/zinc/37/33/37/202373337.db2.gz	OJLHTDKHINHEIK-FQEVSTJZSA-N	0	3	333.435	3.295	20	30		EGEDHN
C=CCN(C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C)C1CC1	ZINC000271354742	201242567	/nfs/dbraw/zinc/24/25/67/201242567.db2.gz	DUYOFXAWHCAFQE-VQIMIIECSA-N	0	3	327.472	3.257	20	30		EGEDHN
C#CC[C@@H](NC(=O)N(CCN(C)C)Cc1ccco1)c1ccccc1	ZINC000270234511	201237135	/nfs/dbraw/zinc/23/71/35/201237135.db2.gz	IUQHFPHLHJEMPE-LJQANCHMSA-N	0	3	339.439	3.117	20	30		EGEDHN
CN(CC#Cc1ccccc1)C1CCN(C(=O)c2ccccc2)CC1	ZINC000277049107	201300539	/nfs/dbraw/zinc/30/05/39/201300539.db2.gz	UQKCMMAGDATDEU-UHFFFAOYSA-N	0	3	332.447	3.275	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@@H]1CCC[C@H]1CCO	ZINC000279196949	201315406	/nfs/dbraw/zinc/31/54/06/201315406.db2.gz	FOYGXZUALRWCGB-LSDHHAIUSA-N	0	3	334.485	3.044	20	30		EGEDHN
Cn1cc(CN[C@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)cc1C#N	ZINC000191550503	239179954	/nfs/dbraw/zinc/17/99/54/239179954.db2.gz	NUOVRCSUXBHUGY-IRXDYDNUSA-N	0	3	333.794	3.309	20	30		EGEDHN
C[C@H]1CN(Cc2cccc(CNCc3ccc(C#N)cc3)c2)CCO1	ZINC000071828160	203122199	/nfs/dbraw/zinc/12/21/99/203122199.db2.gz	AYHMQROVLVLXLH-KRWDZBQOSA-N	0	3	335.451	3.069	20	30		EGEDHN
N#Cc1cccc(OC2CCN(C[C@@H](O)Cc3ccccc3)CC2)c1	ZINC000104713171	204116004	/nfs/dbraw/zinc/11/60/04/204116004.db2.gz	VTDWMOQFFMLFNL-IBGZPJMESA-N	0	3	336.435	3.005	20	30		EGEDHN
COCc1ccc([C@H]2CCCN2C[C@H](O)c2ccc(C#N)cc2)o1	ZINC000131292675	205281326	/nfs/dbraw/zinc/28/13/26/205281326.db2.gz	GULUWNDYUAWEEV-MSOLQXFVSA-N	0	3	326.396	3.168	20	30		EGEDHN
CC[C@H](NCc1ccc(OC)c(C#N)c1)[C@@H](O)c1c(F)cccc1F	ZINC000266307995	248239107	/nfs/dbraw/zinc/23/91/07/248239107.db2.gz	OSXAQIAMYHLCRJ-QFBILLFUSA-N	0	3	346.377	3.447	20	30		EGEDHN
CCN(C(=O)c1c[nH]c(C#N)c1)[C@@H]1CCN([C@H](C)c2ccccc2)C1	ZINC000378477001	169127178	/nfs/dbraw/zinc/12/71/78/169127178.db2.gz	XFSCRNQWSYJQRR-DNVCBOLYSA-N	0	3	336.439	3.184	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)s1)c1ccc(N2CCOC2=O)cc1	ZINC000176956421	207278032	/nfs/dbraw/zinc/27/80/32/207278032.db2.gz	OYXVYMWHLHHMMN-GFCCVEGCSA-N	0	3	327.409	3.427	20	30		EGEDHN
CN(Cc1ccccc1N1CCCC1)C[C@H](O)c1ccc(C#N)cc1	ZINC000268650794	252104448	/nfs/dbraw/zinc/10/44/48/252104448.db2.gz	GKGRSJPPHZGQKK-NRFANRHFSA-N	0	3	335.451	3.324	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN2CCC(OC3CCCCC3)CC2)cc1	ZINC000268702358	252152697	/nfs/dbraw/zinc/15/26/97/252152697.db2.gz	RONHDGIUMYCGHF-FQEVSTJZSA-N	0	3	328.456	3.405	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN(C)C[C@@H](C)c1nccs1	ZINC000183942744	533503334	/nfs/dbraw/zinc/50/33/34/533503334.db2.gz	OQARQEMWTWIBLH-CYBMUJFWSA-N	0	3	331.441	3.138	20	30		EGEDHN
CN(C)C[C@@H](NC(=O)Nc1ccc(C#N)cc1)c1ccc(F)cc1	ZINC000338359056	141106240	/nfs/dbraw/zinc/10/62/40/141106240.db2.gz	NQSTXGGSMCFAPJ-QGZVFWFLSA-N	0	3	326.375	3.122	20	30		EGEDHN
C[C@@H]1CC[C@@H](CC(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)C1	ZINC000122102059	152390002	/nfs/dbraw/zinc/39/00/02/152390002.db2.gz	JVVHYAVPRYKTGT-VQIMIIECSA-N	0	3	327.472	3.275	20	30		EGEDHN
Cc1cc(C)c(CN[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)cc1C	ZINC000192244382	153247387	/nfs/dbraw/zinc/24/73/87/153247387.db2.gz	JKQGOEPNOUFJEK-OAQYLSRUSA-N	0	3	347.462	3.374	20	30		EGEDHN
C[C@H](CNC(=O)N[C@@H](C)c1ccc(C#N)cc1)N1CCCC[C@H]1C	ZINC000337383445	154323244	/nfs/dbraw/zinc/32/32/44/154323244.db2.gz	VYVRMHHCROVXQW-OAGGEKHMSA-N	0	3	328.460	3.181	20	30		EGEDHN
CN(C)Cc1c2ccccc2oc1C(=O)NCCc1cccc(C#N)c1	ZINC000340107870	155100299	/nfs/dbraw/zinc/10/02/99/155100299.db2.gz	ZQNZKLPCIFDYMP-UHFFFAOYSA-N	0	3	347.418	3.339	20	30		EGEDHN
COc1cc(CN(CCN(C)C)Cc2ccc(F)cc2)ccc1C#N	ZINC000349077827	156344026	/nfs/dbraw/zinc/34/40/26/156344026.db2.gz	QHKUWTPVSSKICT-UHFFFAOYSA-N	0	3	341.430	3.270	20	30		EGEDHN
N#Cc1ncccc1N1CC[C@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000368667841	157257136	/nfs/dbraw/zinc/25/71/36/157257136.db2.gz	TUFSBYHWCNLNRC-OAQYLSRUSA-N	0	3	332.451	3.446	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N1CCC[C@@H](CNC(=O)c2ccco2)C1	ZINC000338354170	163219665	/nfs/dbraw/zinc/21/96/65/163219665.db2.gz	MACMFABQXNMHII-WBVHZDCISA-N	0	3	337.423	3.354	20	30		EGEDHN
CC(C)CN(Cc1ccc(C#N)cc1)C(=O)C1CCN(C2CC2)CC1	ZINC000338799043	163351093	/nfs/dbraw/zinc/35/10/93/163351093.db2.gz	DGTGLKXCBQKPFO-UHFFFAOYSA-N	0	3	339.483	3.417	20	30		EGEDHN
C[C@H](N[C@@H]1CC(=O)N([C@H]2C[C@@H]2c2ccccc2)C1)c1ccc(C#N)cc1	ZINC000344316530	164154628	/nfs/dbraw/zinc/15/46/28/164154628.db2.gz	DTXZLRIBECEQBI-NOOVBMIQSA-N	0	3	345.446	3.366	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)c1sccc1Cl	ZINC000351590489	165101700	/nfs/dbraw/zinc/10/17/00/165101700.db2.gz	VOELOADHXCALBY-UHFFFAOYSA-N	0	3	347.871	3.477	20	30		EGEDHN
N#Cc1ccc(OC[C@@H]2CN(Cc3ccccc3)CCCO2)c(F)c1	ZINC000351902792	165143542	/nfs/dbraw/zinc/14/35/42/165143542.db2.gz	KLBXFLIZPIYJQX-SFHVURJKSA-N	0	3	340.398	3.367	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@H](NCc1ccccc1N1CCOCC1)CC2	ZINC000353241705	165690473	/nfs/dbraw/zinc/69/04/73/165690473.db2.gz	LWBNAENAQRQAJL-HXUWFJFHSA-N	0	3	333.435	3.172	20	30		EGEDHN
COc1ccc(CN2CCC[C@@]2(CO)Cc2ccccc2)cc1C#N	ZINC000355349677	166171620	/nfs/dbraw/zinc/17/16/20/166171620.db2.gz	IYNRIZISIBXUGL-NRFANRHFSA-N	0	3	336.435	3.136	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)NCCN1CCCC[C@H]1CC	ZINC000355372676	166177662	/nfs/dbraw/zinc/17/76/62/166177662.db2.gz	SMIILTATXFUXMC-MRXNPFEDSA-N	0	3	344.459	3.343	20	30		EGEDHN
N#Cc1c(F)cccc1Oc1ccc(C(=O)N2CCCOCC2)cc1	ZINC000358868863	166989657	/nfs/dbraw/zinc/98/96/57/166989657.db2.gz	DNONJDNCPLUJHY-UHFFFAOYSA-N	0	3	340.354	3.352	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)[C@H]1CCC(C)(C)C1	ZINC000358996408	167032123	/nfs/dbraw/zinc/03/21/23/167032123.db2.gz	WZVZJQQZKWQKLT-SFHVURJKSA-N	0	3	327.472	3.275	20	30		EGEDHN
N#Cc1ccc(C(=O)N(CCN2CCCCCC2)C2CCC2)s1	ZINC000359784061	167230529	/nfs/dbraw/zinc/23/05/29/167230529.db2.gz	DCKODUSBBOJLNN-UHFFFAOYSA-N	0	3	331.485	3.490	20	30		EGEDHN
CC(C)Oc1ccccc1CNC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000279444229	270039644	/nfs/dbraw/zinc/03/96/44/270039644.db2.gz	YVRCDXPFMHRVDM-LJQANCHMSA-N	0	3	347.418	3.344	20	30		EGEDHN
N#Cc1c(Cl)cccc1NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000294921912	270042348	/nfs/dbraw/zinc/04/23/48/270042348.db2.gz	INCOLZDKADTCTK-MRXNPFEDSA-N	0	3	341.842	3.390	20	30		EGEDHN
CCN1CCN([C@@H](C)CNc2ccc(C(F)(F)F)cc2C#N)CC1	ZINC000301630190	270044020	/nfs/dbraw/zinc/04/40/20/270044020.db2.gz	SMUMOTZRRXGLOK-ZDUSSCGKSA-N	0	3	340.393	3.015	20	30		EGEDHN
N#Cc1ccc([C@@H](NC2CCC3(CCOCC3)CC2)C(N)=O)cc1	ZINC000333114778	270045281	/nfs/dbraw/zinc/04/52/81/270045281.db2.gz	YITQUUAYDIBBSB-QGZVFWFLSA-N	0	3	327.428	3.464	20	30		EGEDHN
CCc1ccccc1[C@H](N)CNC(=O)N[C@@H](C)c1ccc(C#N)cc1	ZINC000417107999	270047729	/nfs/dbraw/zinc/04/77/29/270047729.db2.gz	IDBNVHQKKOLVHX-IFXJQAMLSA-N	0	3	336.439	3.181	20	30		EGEDHN
CCCN(C)[C@@H](CNc1cncc(C#N)n1)c1ccc(Cl)cc1	ZINC000420607534	270048585	/nfs/dbraw/zinc/04/85/85/270048585.db2.gz	CDKQSJYMULJJJO-INIZCTEOSA-N	0	3	329.835	3.497	20	30		EGEDHN
N#Cc1ccccc1COc1cccc(CN(CCO)C2CCC2)c1	ZINC000439767440	270051980	/nfs/dbraw/zinc/05/19/80/270051980.db2.gz	JRDQJOATPDIZFI-UHFFFAOYSA-N	0	3	336.435	3.484	20	30		EGEDHN
N#Cc1nn(CCCN2CCN(c3ccccc3)CC2)c2ccccc12	ZINC000506396217	270058985	/nfs/dbraw/zinc/05/89/85/270058985.db2.gz	RAGQKRJRQCOLEU-UHFFFAOYSA-N	0	3	345.450	3.120	20	30		EGEDHN
CC(C)(CNCc1ccc(C#N)cc1F)c1ccc2c(c1)OCO2	ZINC000533449306	270060868	/nfs/dbraw/zinc/06/08/68/270060868.db2.gz	XYUIPSPDOFMWJD-UHFFFAOYSA-N	0	3	326.371	3.493	20	30		EGEDHN
CN(CCCc1ccccc1)[C@H]1CCN(c2ccc(C#N)cc2)C1=O	ZINC000534601198	270061047	/nfs/dbraw/zinc/06/10/47/270061047.db2.gz	CCXUXDZLRPBTRC-FQEVSTJZSA-N	0	3	333.435	3.228	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)Cc1ccc(C#N)cc1)c1ccsc1	ZINC000194858440	266119903	/nfs/dbraw/zinc/11/99/03/266119903.db2.gz	LUFUGXRFQUETAL-SFHVURJKSA-N	0	3	341.480	3.362	20	30		EGEDHN
CCO[C@H]1C[C@@H](NCC(=O)Nc2sc(C)c(C)c2C#N)C12CCC2	ZINC000296169863	266302288	/nfs/dbraw/zinc/30/22/88/266302288.db2.gz	KXRGLHKQCGMJFB-CABCVRRESA-N	0	3	347.484	3.112	20	30		EGEDHN
CC[C@H](NCCNC(=O)c1cccc(OC)c1)c1ccc(C#N)cc1	ZINC000278862865	266407857	/nfs/dbraw/zinc/40/78/57/266407857.db2.gz	WKAPXHBHFLYSOE-IBGZPJMESA-N	0	3	337.423	3.038	20	30		EGEDHN
CCCCNC(=O)[C@@H]1CC[C@@H](C)N(Cc2ccc(C#N)c(OC)c2)C1	ZINC000442800397	267009658	/nfs/dbraw/zinc/00/96/58/267009658.db2.gz	JVLHUWQIOBISMO-CRAIPNDOSA-N	0	3	343.471	3.084	20	30		EGEDHN
C[C@@H]1CN(C(=O)Nc2ccc(C#N)c(F)c2)CCN(C2CCC2)C1	ZINC000297423965	267040370	/nfs/dbraw/zinc/04/03/70/267040370.db2.gz	OIEMONOVGPWZCI-ZDUSSCGKSA-N	0	3	330.407	3.035	20	30		EGEDHN
CCOC(=O)N1CCC[C@H]([C@H](C)NCc2ccc(C#N)cc2F)C1	ZINC000495544240	267123801	/nfs/dbraw/zinc/12/38/01/267123801.db2.gz	VHBBEHLJMKKHDS-BBRMVZONSA-N	0	3	333.407	3.044	20	30		EGEDHN
C[C@H](C1CCN(C)CC1)N(C)C(=O)Nc1cc(C#N)cn1C(C)(C)C	ZINC000272086382	267143717	/nfs/dbraw/zinc/14/37/17/267143717.db2.gz	CEKAWGBECDFKPI-CQSZACIVSA-N	0	3	345.491	3.309	20	30		EGEDHN
CCO[C@@H]1CCCC[C@H]1N[C@@H](C)C(=O)Nc1oc(C)c(C)c1C#N	ZINC000452038857	267146383	/nfs/dbraw/zinc/14/63/83/267146383.db2.gz	YXTMPUMTGVHIPM-APHBMKBZSA-N	0	3	333.432	3.032	20	30		EGEDHN
C[C@H](CCc1ccccc1)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000279504474	267153341	/nfs/dbraw/zinc/15/33/41/267153341.db2.gz	QTKZUUNZNAWMIJ-OXQOHEQNSA-N	0	3	331.419	3.378	20	30		EGEDHN
CC[C@@H](C)N1CCN(c2c(C#N)cnc3c(F)c(F)c(F)cc32)CC1	ZINC000450854266	267184889	/nfs/dbraw/zinc/18/48/89/267184889.db2.gz	DBEZJWGWOLQURE-LLVKDONJSA-N	0	3	348.372	3.444	20	30		EGEDHN
CN(C)CC(C)(C)NC(=O)Nc1ccc(C#N)c(C(F)(F)F)c1	ZINC000454896757	267278350	/nfs/dbraw/zinc/27/83/50/267278350.db2.gz	PSKWUDPVWQFUKA-UHFFFAOYSA-N	0	3	328.338	3.039	20	30		EGEDHN
CN(C)CCc1ccccc1NC(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1	ZINC000412284980	267281368	/nfs/dbraw/zinc/28/13/68/267281368.db2.gz	ZLNNQRUSRXOKPB-RBUKOAKNSA-N	0	3	333.435	3.405	20	30		EGEDHN
CN(C)C[C@H]1CCc2ccccc2N1C(=O)Cc1cccc(C#N)c1	ZINC000520571692	267281784	/nfs/dbraw/zinc/28/17/84/267281784.db2.gz	FOZOSMQUBXPCDU-LJQANCHMSA-N	0	3	333.435	3.010	20	30		EGEDHN
CN(C)C[C@@H]1CCc2ccccc2N1C(=O)CCc1ccc(C#N)cc1	ZINC000425630562	267282673	/nfs/dbraw/zinc/28/26/73/267282673.db2.gz	RZAVXMIKAHUPPI-FQEVSTJZSA-N	0	3	347.462	3.400	20	30		EGEDHN
CN(C)Cc1ccc(C(=O)N[C@H]2CCCc3cc(C#N)ccc32)cc1	ZINC000416101475	267284200	/nfs/dbraw/zinc/28/42/00/267284200.db2.gz	NFCNHUPZKZUMCI-FQEVSTJZSA-N	0	3	333.435	3.427	20	30		EGEDHN
Cc1c(C#N)cccc1NC(=O)N(CCN(C)C)Cc1ccco1	ZINC000178542249	267284999	/nfs/dbraw/zinc/28/49/99/267284999.db2.gz	HQZXWLQTLZFVHY-UHFFFAOYSA-N	0	3	326.400	3.055	20	30		EGEDHN
Cc1cc(C#N)cc(NC(=O)N2CCN(C3CCCCC3)CC2)c1	ZINC000332499163	267304503	/nfs/dbraw/zinc/30/45/03/267304503.db2.gz	VGITVLDIRJXUIH-UHFFFAOYSA-N	0	3	326.444	3.349	20	30		EGEDHN
CN(C[C@H]1CCCN1C)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1	ZINC000421056796	267310068	/nfs/dbraw/zinc/31/00/68/267310068.db2.gz	HBHFTEIFXOYTTQ-CYBMUJFWSA-N	0	3	340.349	3.135	20	30		EGEDHN
Cc1cc(C)n(CCN2CCC(Oc3ccc(C#N)cc3F)CC2)n1	ZINC000285548732	267323040	/nfs/dbraw/zinc/32/30/40/267323040.db2.gz	RGOMGEDVWFKFKW-UHFFFAOYSA-N	0	3	342.418	3.054	20	30		EGEDHN
CN1CCC[C@]2(CCN(C(=O)C(C)(C)Cc3ccc(C#N)cc3)C2)C1	ZINC000456040637	267337292	/nfs/dbraw/zinc/33/72/92/267337292.db2.gz	XIEXAKXECPCHMA-NRFANRHFSA-N	0	3	339.483	3.071	20	30		EGEDHN
CN1CC[C@@H]2CN(c3c(C#N)cnc4c(F)ccc(Cl)c43)C[C@@H]21	ZINC000450784559	267339625	/nfs/dbraw/zinc/33/96/25/267339625.db2.gz	BZKYXALYCHDQKL-YGRLFVJLSA-N	0	3	330.794	3.039	20	30		EGEDHN
Cc1cc([C@H](C)NC[C@@H](O)COc2ccc(C#N)cc2)c(C)s1	ZINC000193131559	267363985	/nfs/dbraw/zinc/36/39/85/267363985.db2.gz	GQIOCWKOPSUWQK-XJKSGUPXSA-N	0	3	330.453	3.327	20	30		EGEDHN
COC(=O)COc1ccc([C@H](C)NCc2ccc(C#N)c(C)c2)cc1	ZINC000488337252	267365054	/nfs/dbraw/zinc/36/50/54/267365054.db2.gz	WCVCQLVJQQDTIF-HNNXBMFYSA-N	0	3	338.407	3.269	20	30		EGEDHN
COC(=O)[C@H]1CN(Cc2ccc(C#N)s2)C[C@H]1c1ccccc1	ZINC000449752230	267391158	/nfs/dbraw/zinc/39/11/58/267391158.db2.gz	BSTOZMKCLXYYTF-IRXDYDNUSA-N	0	3	326.421	3.008	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)NC[C@H](C1CC1)N(C)Cc1ccccc1	ZINC000281292187	267724427	/nfs/dbraw/zinc/72/44/27/267724427.db2.gz	MVWZJMISHJASTG-LJQANCHMSA-N	0	3	337.423	3.100	20	30		EGEDHN
Cc1ccc([N-]S(=O)(=O)c2ccc(C#N)c(C)c2)c(C[NH+](C)C)c1	ZINC000278548773	268037308	/nfs/dbraw/zinc/03/73/08/268037308.db2.gz	YRRKFCRRHGNPHA-UHFFFAOYSA-N	0	3	343.452	3.038	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)Nc2ccc(F)cc2C#N)N(C)C)cc1	ZINC000435166043	268046084	/nfs/dbraw/zinc/04/60/84/268046084.db2.gz	PJSDISLGSCFAGM-SFHVURJKSA-N	0	3	340.402	3.430	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NC2CC(c3ccccc3)C2)cc1	ZINC000280940333	268085380	/nfs/dbraw/zinc/08/53/80/268085380.db2.gz	PRXDDRKAWNQGDS-GPJFCIFZSA-N	0	3	329.403	3.303	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@@H]2CCCc3sccc32)cc1	ZINC000280175219	268086937	/nfs/dbraw/zinc/08/69/37/268086937.db2.gz	XVXOITQAPHGZBZ-DOTOQJQBSA-N	0	3	335.432	3.496	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCc2coc3ccccc23)cc1	ZINC000352387558	268091338	/nfs/dbraw/zinc/09/13/38/268091338.db2.gz	ZPVBPBZLKRQLQQ-MRXNPFEDSA-N	0	3	329.359	3.303	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN[C@@H](c2ccccc2)C2(CO)CCC2)cc1	ZINC000292553211	268215200	/nfs/dbraw/zinc/21/52/00/268215200.db2.gz	ALCMWCFAXFABKN-UXHICEINSA-N	0	3	336.435	3.085	20	30		EGEDHN
N#Cc1ccc(CNC2CCN(Cc3ccc(C#N)cc3)CC2)s1	ZINC000421349898	268232395	/nfs/dbraw/zinc/23/23/95/268232395.db2.gz	KDUMGBLZGSCRPY-UHFFFAOYSA-N	0	3	336.464	3.246	20	30		EGEDHN
N#Cc1ccc(CNC[C@@]2(O)CCC[C@@H](C(F)(F)F)C2)c(F)c1	ZINC000436398782	268233530	/nfs/dbraw/zinc/23/35/30/268233530.db2.gz	BALJGQHSNDXNBM-UKRRQHHQSA-N	0	3	330.325	3.271	20	30		EGEDHN
N#Cc1cccc(Cl)c1NCc1ccccc1CN1CC[C@H](O)C1	ZINC000273222321	268256885	/nfs/dbraw/zinc/25/68/85/268256885.db2.gz	QPJBTNHMGCNCOZ-KRWDZBQOSA-N	0	3	341.842	3.390	20	30		EGEDHN
N#Cc1ccccc1N1CCN(CCCCC2CCOCC2)CC1	ZINC000410336652	268276885	/nfs/dbraw/zinc/27/68/85/268276885.db2.gz	IGJPNEVARRTTTN-UHFFFAOYSA-N	0	3	327.472	3.277	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CN[C@H]1CCCc2ccc(F)cc21	ZINC000530233826	268298556	/nfs/dbraw/zinc/29/85/56/268298556.db2.gz	IIMFYPJABZGRRS-HKUYNNGSSA-N	0	3	340.398	3.104	20	30		EGEDHN
N#Cc1cnc(N2C[C@H]3CN(Cc4ccccc4)CC[C@@H]3C2)c(F)c1	ZINC000413295345	268313025	/nfs/dbraw/zinc/31/30/25/268313025.db2.gz	DLGWTSKSKQPBPE-QZTJIDSGSA-N	0	3	336.414	3.051	20	30		EGEDHN
COc1cc(CN2CCCN3c4ccccc4C[C@H]3C2)ccc1C#N	ZINC000356373429	274093763	/nfs/dbraw/zinc/09/37/63/274093763.db2.gz	VPRSMUGWQQQTHQ-IBGZPJMESA-N	0	3	333.435	3.204	20	30		EGEDHN
CC(C)(C)N1C[C@H](N[C@H]2CCCCc3cc(C#N)ccc32)CC1=O	ZINC000360664318	275514973	/nfs/dbraw/zinc/51/49/73/275514973.db2.gz	PAQBXWRXSYBUTA-AEFFLSMTSA-N	0	3	325.456	3.315	20	30		EGEDHN
CC[C@@H](C)C[C@@H](C)NC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000074788169	307395863	/nfs/dbraw/zinc/39/58/63/307395863.db2.gz	ATPNZMFISQZPRS-IAGOWNOFSA-N	0	3	344.503	3.456	20	30		EGEDHN
C[C@H](C(=O)NCCSCc1ccccc1C#N)N1[C@H](C)CC[C@H]1C	ZINC000249907751	308029106	/nfs/dbraw/zinc/02/91/06/308029106.db2.gz	VGZYKYDZKDNPNE-BZUAXINKSA-N	0	3	345.512	3.169	20	30		EGEDHN
CCOC(=O)COc1ccc(CN[C@@H](C)c2ccc(C#N)cc2)cc1	ZINC000537295143	314172872	/nfs/dbraw/zinc/17/28/72/314172872.db2.gz	NICYVRLHKRHMNZ-HNNXBMFYSA-N	0	3	338.407	3.351	20	30		EGEDHN
CN(C)Cc1ccccc1CNC(=O)c1ccc(Cl)c(C#N)c1	ZINC000539783313	314336452	/nfs/dbraw/zinc/33/64/52/314336452.db2.gz	MLNZNLYJBKDSGG-UHFFFAOYSA-N	0	3	327.815	3.203	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)N(C)[C@@H]1CCN(C)C[C@@H]1C	ZINC000551409242	315153260	/nfs/dbraw/zinc/15/32/60/315153260.db2.gz	MLDFVNDQTBFOSM-BLLLJJGKSA-N	0	3	341.480	3.494	20	30		EGEDHN
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCc1ccc(C#N)c(F)c1	ZINC000556514730	315439521	/nfs/dbraw/zinc/43/95/21/315439521.db2.gz	HZZCXUVTUMEIRM-KBXCAEBGSA-N	0	3	340.398	3.207	20	30		EGEDHN
C[C@@H](NCCNc1ccc2ccccc2n1)c1ccc(C#N)c(F)c1	ZINC000561769808	315782213	/nfs/dbraw/zinc/78/22/13/315782213.db2.gz	JYRJZVAKSJAQDX-CQSZACIVSA-N	0	3	334.398	3.430	20	30		EGEDHN
C=CCNC(=O)CN[C@H](C)[C@@H](C)Oc1ccc(Cl)cc1Cl	ZINC000180028996	455118341	/nfs/dbraw/zinc/11/83/41/455118341.db2.gz	RGJSCGLKNBTTLQ-GHMZBOCLSA-N	0	3	331.243	3.041	20	30		EGEDHN
N#Cc1csc(CNCCc2nc(-c3ccccn3)cs2)c1	ZINC000177703930	323344775	/nfs/dbraw/zinc/34/47/75/323344775.db2.gz	NNUIIJGOAGPHAQ-UHFFFAOYSA-N	0	3	326.450	3.471	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1Nc1ccc(C#N)c([N+](=O)[O-])c1	ZINC000389832264	324279952	/nfs/dbraw/zinc/27/99/52/324279952.db2.gz	IDEPGKNGFFKJAI-KDOFPFPSSA-N	0	3	336.395	3.399	20	30		EGEDHN
N#Cc1cc(F)c(N2CC[C@H](N3CCCC3)C2)cc1Br	ZINC000312734073	456593846	/nfs/dbraw/zinc/59/38/46/456593846.db2.gz	JYQXMNJEWJVPRB-LBPRGKRZSA-N	0	3	338.224	3.134	20	30		EGEDHN
Cc1ccc(Cl)c(OC[C@@H](O)CNCc2ccc(C#N)cc2)c1	ZINC000580183040	325214431	/nfs/dbraw/zinc/21/44/31/325214431.db2.gz	PDIWZFPLJJBXIP-INIZCTEOSA-N	0	3	330.815	3.050	20	30		EGEDHN
Cc1cc(C#N)cnc1C(=O)NCC1(N(C)Cc2ccccc2)CCC1	ZINC000581172886	325337174	/nfs/dbraw/zinc/33/71/74/325337174.db2.gz	IYXNBRZJVKTVOU-UHFFFAOYSA-N	0	3	348.450	3.046	20	30		EGEDHN
C[C@H](N[C@@H]1CCO[C@H](c2ccnn2C)C1)c1ccc(C#N)cc1F	ZINC000583363931	325517171	/nfs/dbraw/zinc/51/71/71/325517171.db2.gz	PUNCTZCVERWBIA-WRSAYESZSA-N	0	3	328.391	3.002	20	30		EGEDHN
N#CC(C(=O)c1ccnc(OC2CCC2)c1)c1nc2ccccc2[nH]1	ZINC000180774585	455243225	/nfs/dbraw/zinc/24/32/25/455243225.db2.gz	DPTFLVKATKKESH-CQSZACIVSA-N	0	3	332.363	3.379	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)c1ccnc(OC2CCC2)c1	ZINC000180774330	455243555	/nfs/dbraw/zinc/24/35/55/455243555.db2.gz	VOTSFRMGCTXQEP-OAHLLOKOSA-N	0	3	346.390	3.390	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC[C@H](c3ccccc3)[C@H](C)C2)CC1	ZINC000173199135	455245760	/nfs/dbraw/zinc/24/57/60/455245760.db2.gz	FEAIJVUGASOOSD-XLIONFOSSA-N	0	3	341.499	3.472	20	30		EGEDHN
C=CCN(CC1CCCCC1)C(=O)NC[C@@]1(N(C)C)CCSC1	ZINC000481789854	459273841	/nfs/dbraw/zinc/27/38/41/459273841.db2.gz	QOPFJWFJSYGRET-SFHVURJKSA-N	0	3	339.549	3.202	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCc1ccccc1CN1CCC[C@H]1CO	ZINC000180869232	455258579	/nfs/dbraw/zinc/25/85/79/455258579.db2.gz	KIOQHKKPIOSDSO-FQEVSTJZSA-N	0	3	342.483	3.028	20	30		EGEDHN
C[C@H](N[C@@H](C)c1ccc(-c2ccncc2)cc1)C(=O)N(C)CCC#N	ZINC000180910974	455262876	/nfs/dbraw/zinc/26/28/76/455262876.db2.gz	SFASHXQNLUCECB-HOTGVXAUSA-N	0	3	336.439	3.160	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCCN1CCN(C)C[C@@H]1c1ccccc1	ZINC000190378680	455305930	/nfs/dbraw/zinc/30/59/30/455305930.db2.gz	MMIREEGXEKJXKI-CTNGQTDRSA-N	0	3	343.515	3.084	20	30		EGEDHN
N#CCNC(=O)CN[C@@H](CCCCc1ccccc1)c1ccccc1	ZINC000181455478	455337763	/nfs/dbraw/zinc/33/77/63/455337763.db2.gz	CJXWIEIGNKMXCN-FQEVSTJZSA-N	0	3	335.451	3.370	20	30		EGEDHN
CCC1(CC)[C@H](N[C@H](C)C(=O)Nc2ccccc2C#N)[C@@H](C)[C@H]1OC	ZINC000245596988	455338037	/nfs/dbraw/zinc/33/80/37/455338037.db2.gz	IWGZCTNEZVNCDP-DTTOXWODSA-N	0	3	343.471	3.315	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CCC[C@](C)(C#N)C1)C(C)C	ZINC000612358103	460604638	/nfs/dbraw/zinc/60/46/38/460604638.db2.gz	PYABILOHIADFPI-IEBWSBKVSA-N	0	3	332.492	3.020	20	30		EGEDHN
CN(C(=O)C#Cc1ccccc1)C1CCN(Cc2ccccc2)CC1	ZINC000026994854	453809408	/nfs/dbraw/zinc/80/94/08/453809408.db2.gz	ZHMASNNAKDABGT-UHFFFAOYSA-N	0	3	332.447	3.161	20	30		EGEDHN
N#Cc1ccc(CCC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1	ZINC000029179091	453827039	/nfs/dbraw/zinc/82/70/39/453827039.db2.gz	LPXYJYCQEUPGRD-NRFANRHFSA-N	0	3	347.462	3.444	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)[C@H](C)N(C)CCCCc1ccccc1	ZINC000053079769	453856774	/nfs/dbraw/zinc/85/67/74/453856774.db2.gz	BCUGBCSLRMLOKK-FXAWDEMLSA-N	0	3	329.488	3.384	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(Oc3cccnc3)c(C)c2)CC1	ZINC000066922317	453885721	/nfs/dbraw/zinc/88/57/21/453885721.db2.gz	MTSOAPCQCXNNEU-UHFFFAOYSA-N	0	3	349.434	3.466	20	30		EGEDHN
C=CCN(CCc1nc2ccccc2c(=O)[nH]1)Cc1ccc(OC)cc1	ZINC000054273033	453919822	/nfs/dbraw/zinc/91/98/22/453919822.db2.gz	SOGGPCGCDQGOLG-UHFFFAOYSA-N	0	3	349.434	3.162	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccc(Br)cc2)nc(C)n1	ZINC000041574391	453972851	/nfs/dbraw/zinc/97/28/51/453972851.db2.gz	HKSLAIMYQGEPQM-CYBMUJFWSA-N	0	3	330.185	3.346	20	30		EGEDHN
C[C@H](N[C@H]1CCN(c2ncccc2F)C1)c1ccc(OCC#N)cc1	ZINC000181884903	455393729	/nfs/dbraw/zinc/39/37/29/455393729.db2.gz	MYHMYHHWFPMNQC-HOCLYGCPSA-N	0	3	340.402	3.053	20	30		EGEDHN
N#Cc1ccc(N2CCC(NCc3cc(F)c(F)c(F)c3)CC2)nc1	ZINC000076399445	453997197	/nfs/dbraw/zinc/99/71/97/453997197.db2.gz	WEOINGSPEGQABW-UHFFFAOYSA-N	0	3	346.356	3.129	20	30		EGEDHN
CC[C@@H](C)N(C)CC(=O)Nc1c(C#N)c(C)c(C)n1Cc1ccco1	ZINC000068450457	454027894	/nfs/dbraw/zinc/02/78/94/454027894.db2.gz	JHBHNSNYSZRVAK-CYBMUJFWSA-N	0	3	342.443	3.287	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H]2CCCC[C@H]2Cc2ccccc2)CC1	ZINC000077309578	454088643	/nfs/dbraw/zinc/08/86/43/454088643.db2.gz	INWMRASZADSSHH-SFTDATJTSA-N	0	3	338.495	3.249	20	30		EGEDHN
N#Cc1nnc2ccccc2c1N[C@H]1CCN(Cc2ccccc2)C1	ZINC000077486151	454112242	/nfs/dbraw/zinc/11/22/42/454112242.db2.gz	SLINKWHJLIDRFA-INIZCTEOSA-N	0	3	329.407	3.188	20	30		EGEDHN
CN(C(=O)[C@H]1CCCN(Cc2ccccc2)C1)c1cccc(C#N)c1	ZINC000070449742	454169630	/nfs/dbraw/zinc/16/96/30/454169630.db2.gz	CCUYPHMGVWSPBT-IBGZPJMESA-N	0	3	333.435	3.433	20	30		EGEDHN
CCc1ccc([C@@H](CNc2ncc([N+](=O)[O-])cc2C#N)N(C)C)cc1	ZINC000070791251	454176565	/nfs/dbraw/zinc/17/65/65/454176565.db2.gz	SVUSBZJYTKBSCS-QGZVFWFLSA-N	0	3	339.399	3.139	20	30		EGEDHN
Cc1nnc(NC[C@H](c2cccs2)N2CCCC2)c(C#N)c1C	ZINC000058295792	454181296	/nfs/dbraw/zinc/18/12/96/454181296.db2.gz	USPFWQBTECXEDJ-OAHLLOKOSA-N	0	3	327.457	3.276	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H]2CCCC[C@@H]2SCC)CC1	ZINC000078331649	454232615	/nfs/dbraw/zinc/23/26/15/454232615.db2.gz	ADOFBHZNTHCHMT-CVEARBPZSA-N	0	3	325.522	3.000	20	30		EGEDHN
C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@@H](C)CN1CCCCC1	ZINC000120230475	454274564	/nfs/dbraw/zinc/27/45/64/454274564.db2.gz	BGWNGOQVZHJHRS-KRWDZBQOSA-N	0	3	340.471	3.130	20	30		EGEDHN
Cc1nc(C(=O)N(CCN2CCCC2)c2ccccc2)ccc1C#N	ZINC000072292275	454288142	/nfs/dbraw/zinc/28/81/42/454288142.db2.gz	IVDMRLWTUMKUKD-UHFFFAOYSA-N	0	3	334.423	3.004	20	30		EGEDHN
N#CCN1CCN(CCCCc2cccc(C(F)(F)F)c2)CC1	ZINC000191073270	455437381	/nfs/dbraw/zinc/43/73/81/455437381.db2.gz	FOTSXVMTPPDOHO-UHFFFAOYSA-N	0	3	325.378	3.169	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)c1ccc2c(c1)CCC2	ZINC000047011020	454318668	/nfs/dbraw/zinc/31/86/68/454318668.db2.gz	AWVFYQCUQWQLRH-UHFFFAOYSA-N	0	3	347.462	3.251	20	30		EGEDHN
CCc1ccc([C@H](NCC(=O)N[C@@](C)(C#N)C2CC2)C(C)C)cc1	ZINC000072835427	454347691	/nfs/dbraw/zinc/34/76/91/454347691.db2.gz	RGSKWHLJDMDIIM-UXHICEINSA-N	0	3	327.472	3.344	20	30		EGEDHN
Cc1nn(C)c2ncc(C(=O)C(C#N)c3ccc4ccccc4n3)cc12	ZINC000047376290	454365442	/nfs/dbraw/zinc/36/54/42/454365442.db2.gz	IMPQSWIEKZQHPZ-MRXNPFEDSA-N	0	3	341.374	3.315	20	30		EGEDHN
Cc1ccc(C(=O)C(C#N)c2nc3cc(Cl)ccc3s2)c(=O)[nH]1	ZINC000062676450	454384365	/nfs/dbraw/zinc/38/43/65/454384365.db2.gz	ZAZMOAAOWCBICX-LLVKDONJSA-N	0	3	343.795	3.437	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)c2ccc(C#N)cc2)CCN1Cc1ccccc1	ZINC000079553080	454437841	/nfs/dbraw/zinc/43/78/41/454437841.db2.gz	NITNEYMCOGYBFK-JXFKEZNVSA-N	0	3	333.435	3.341	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H](O)COc1ccc(Cl)cc1	ZINC000073615747	454458402	/nfs/dbraw/zinc/45/84/02/454458402.db2.gz	YTBJDYDIXWSENI-KRWDZBQOSA-N	0	3	330.815	3.083	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)Nc2nnc(-c3ccccc3)s2)n1	ZINC000121705808	454467735	/nfs/dbraw/zinc/46/77/35/454467735.db2.gz	JVYSEUZCZKMJTL-NSHDSACASA-N	0	3	341.421	3.216	20	30		EGEDHN
CCCCn1ncc(C(=O)C(C#N)c2nc3ccccc3n2C)c1C	ZINC000121868101	454487392	/nfs/dbraw/zinc/48/73/92/454487392.db2.gz	LRGFNIPPXBQNBM-AWEZNQCLSA-N	0	3	335.411	3.368	20	30		EGEDHN
COC(=O)c1cccc(C(=O)C(C#N)c2ccc(C(F)(F)F)cn2)c1	ZINC000048829190	454517709	/nfs/dbraw/zinc/51/77/09/454517709.db2.gz	BYCSLCXOIIBXCS-CYBMUJFWSA-N	0	3	348.280	3.377	20	30		EGEDHN
CC(=O)c1cc(C(=O)C(C#N)c2ccc(C(F)(F)F)cn2)n(C)c1	ZINC000048828555	454518420	/nfs/dbraw/zinc/51/84/20/454518420.db2.gz	HLPVWCSIHVQXAG-GFCCVEGCSA-N	0	3	335.285	3.132	20	30		EGEDHN
N#Cc1ccc(SCC(=O)N2CCC[C@H]2CN2CCCCC2)cc1	ZINC000103085039	454536612	/nfs/dbraw/zinc/53/66/12/454536612.db2.gz	LCYJFHPOVCRDNX-KRWDZBQOSA-N	0	3	343.496	3.127	20	30		EGEDHN
CN(Cc1cn(CCC#N)nc1-c1ccccc1)C[C@@H]1CCCCO1	ZINC000092427494	454564933	/nfs/dbraw/zinc/56/49/33/454564933.db2.gz	MWHSUXIPZCSWJE-IBGZPJMESA-N	0	3	338.455	3.465	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cnn(C(C)C)c1C)C(C)C	ZINC000092457538	454569183	/nfs/dbraw/zinc/56/91/83/454569183.db2.gz	XIRAQKNWOHHSDF-GOSISDBHSA-N	0	3	332.492	3.201	20	30		EGEDHN
N#Cc1c(CN2CC[C@H]3[C@H](CCCN3C3CC3)C2)cn2ccccc12	ZINC000134877266	454602370	/nfs/dbraw/zinc/60/23/70/454602370.db2.gz	UMCHJBSJFCPOMG-UZLBHIALSA-N	0	3	334.467	3.260	20	30		EGEDHN
N#Cc1cccnc1N1CC[C@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000080685983	454619420	/nfs/dbraw/zinc/61/94/20/454619420.db2.gz	LUEDSKJQAQCNFV-OAQYLSRUSA-N	0	3	332.451	3.446	20	30		EGEDHN
Cc1cccc(NC(=O)N(CCN(C)C)Cc2cccc(C#N)c2)c1	ZINC000065987106	454647549	/nfs/dbraw/zinc/64/75/49/454647549.db2.gz	DRRCHWKSCTVWSN-UHFFFAOYSA-N	0	3	336.439	3.462	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CCC(N2CCCCC2=O)CC1	ZINC000135291328	454659226	/nfs/dbraw/zinc/65/92/26/454659226.db2.gz	YXWZCMZYZKXSMK-UHFFFAOYSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCc2ccc(Cl)s2)CC1	ZINC000106035978	454674386	/nfs/dbraw/zinc/67/43/86/454674386.db2.gz	VPEKCPSQSGJPMX-UHFFFAOYSA-N	0	3	326.893	3.491	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccccc2OCC2CC2)CC1	ZINC000106035416	454674812	/nfs/dbraw/zinc/67/48/12/454674812.db2.gz	IQZLTNNNBBSGLE-UHFFFAOYSA-N	0	3	328.456	3.246	20	30		EGEDHN
CN(C)[C@@H](CNc1ccc([N+](=O)[O-])cc1C#N)c1ccc(F)cc1	ZINC000052486042	454676884	/nfs/dbraw/zinc/67/68/84/454676884.db2.gz	AGKSVKJXYDIBJI-KRWDZBQOSA-N	0	3	328.347	3.320	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cc(C3CCCCCC3)[nH]n2)CC1	ZINC000135719234	454699998	/nfs/dbraw/zinc/69/99/98/454699998.db2.gz	SWZCJKMVMCZEHF-UHFFFAOYSA-N	0	3	328.460	3.131	20	30		EGEDHN
CN(Cc1cn(CCC#N)nc1-c1ccccc1)CC1(O)CCCC1	ZINC000093503002	454719678	/nfs/dbraw/zinc/71/96/78/454719678.db2.gz	CKSDNZSFRYDRJK-UHFFFAOYSA-N	0	3	338.455	3.201	20	30		EGEDHN
COc1ccc(CN2CCC[C@@H]2C[C@@H](C)O)cc1OCCCC#N	ZINC000093483154	454719978	/nfs/dbraw/zinc/71/99/78/454719978.db2.gz	ZAZWNMZJHRISTA-NVXWUHKLSA-N	0	3	332.444	3.113	20	30		EGEDHN
CCC1(CO)CCN(Cc2ccc(OC)c(OCCCC#N)c2)CC1	ZINC000093592408	454722643	/nfs/dbraw/zinc/72/26/43/454722643.db2.gz	NKVZPOYUGQIMHG-UHFFFAOYSA-N	0	3	346.471	3.362	20	30		EGEDHN
N#Cc1ccc([C@@H](NCC2(Cc3ccccc3)CCC2)C(N)=O)cc1	ZINC000124397946	454728038	/nfs/dbraw/zinc/72/80/38/454728038.db2.gz	VEUTUIBCXJCFFW-LJQANCHMSA-N	0	3	333.435	3.087	20	30		EGEDHN
CCOC[C@@H]1CCN(Cc2ccc(OC)c(OCCCC#N)c2)C1	ZINC000093839334	454738801	/nfs/dbraw/zinc/73/88/01/454738801.db2.gz	VSVUVUQJDQIAQU-QGZVFWFLSA-N	0	3	332.444	3.236	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN2C[C@@H]3CCC[C@@H]3C2)cc1	ZINC000153071876	454757229	/nfs/dbraw/zinc/75/72/29/454757229.db2.gz	VMNFHMRJDPIVCR-CALCHBBNSA-N	0	3	341.455	3.064	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)c1ccc2[nH]ccc2c1	ZINC000107559587	454762586	/nfs/dbraw/zinc/76/25/86/454762586.db2.gz	VFZOIFBSAAEANY-UHFFFAOYSA-N	0	3	346.434	3.244	20	30		EGEDHN
CCCN(CC(=O)N[C@@](C)(C#N)C1CC1)[C@@H]1CCc2ccccc2C1	ZINC000142384109	454836243	/nfs/dbraw/zinc/83/62/43/454836243.db2.gz	HHOVNPNFZKHZHV-CTNGQTDRSA-N	0	3	339.483	3.064	20	30		EGEDHN
CCN(CCN1C(=O)c2ccccc2C1=O)[C@@H](C)c1ccc(C#N)cc1	ZINC000125777454	454845214	/nfs/dbraw/zinc/84/52/14/454845214.db2.gz	GCLMZATXTBALFH-HNNXBMFYSA-N	0	3	347.418	3.237	20	30		EGEDHN
C=CCN(Cc1cccc(C#N)c1)C(=O)NC[C@H]1CCCCN1CC	ZINC000111882984	454877580	/nfs/dbraw/zinc/87/75/80/454877580.db2.gz	PEWPXVVDRWMYDK-LJQANCHMSA-N	0	3	340.471	3.130	20	30		EGEDHN
C[C@@H](N[C@@H](C)c1cccc(NS(C)(=O)=O)c1)c1ccc(C#N)cc1	ZINC000154345586	454887588	/nfs/dbraw/zinc/88/75/88/454887588.db2.gz	ROLPKGNHXPYYPM-KGLIPLIRSA-N	0	3	343.452	3.342	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1ccc(NC(C)=O)cc1)C(C)C	ZINC000112919942	454906400	/nfs/dbraw/zinc/90/64/00/454906400.db2.gz	XXYVWSZSHNBGIB-LJQANCHMSA-N	0	3	343.471	3.073	20	30		EGEDHN
CN(CCOCc1ccccc1)CCC(=O)Nc1cccc(C#N)c1	ZINC000154552021	454906484	/nfs/dbraw/zinc/90/64/84/454906484.db2.gz	XUHRNOLUJBBWJH-UHFFFAOYSA-N	0	3	337.423	3.035	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCCc2cc(C)cc(C)c2)CC1	ZINC000126781962	454918213	/nfs/dbraw/zinc/91/82/13/454918213.db2.gz	VWWLYHPRTZMTCL-UHFFFAOYSA-N	0	3	329.488	3.186	20	30		EGEDHN
CCC(CC)[C@@H](O)CNCc1cn(CCC#N)nc1-c1ccccc1	ZINC000113341567	454924028	/nfs/dbraw/zinc/92/40/28/454924028.db2.gz	UHEHICRBIAFLIM-IBGZPJMESA-N	0	3	340.471	3.350	20	30		EGEDHN
C[C@H](N[C@@H]1CCN(C(=O)C2CCCCC2)C1)c1ccc(C#N)cc1	ZINC000151058540	454931602	/nfs/dbraw/zinc/93/16/02/454931602.db2.gz	NKXSRGFJAVZTJX-HNAYVOBHSA-N	0	3	325.456	3.390	20	30		EGEDHN
N#CCCCCNC(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000178199599	454942805	/nfs/dbraw/zinc/94/28/05/454942805.db2.gz	ITGLZCBXZUAROP-UHFFFAOYSA-N	0	3	344.459	3.367	20	30		EGEDHN
CN(C(=O)c1cccc(Nc2ccc(C#N)cc2)c1)[C@H]1CCCN(C)C1	ZINC000151200299	454952255	/nfs/dbraw/zinc/95/22/55/454952255.db2.gz	SUXYFROVOKCXJX-FQEVSTJZSA-N	0	3	348.450	3.468	20	30		EGEDHN
Cc1c(C#N)cccc1NC(=O)N1CCN(CCC(C)(C)C)CC1	ZINC000178578061	454962780	/nfs/dbraw/zinc/96/27/80/454962780.db2.gz	HZIUZTSELCQVFP-UHFFFAOYSA-N	0	3	328.460	3.452	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)[C@H]2CCc3ccccc3C2)CC1	ZINC000114596603	454963497	/nfs/dbraw/zinc/96/34/97/454963497.db2.gz	IBIGEPYFAAJMTA-FQEVSTJZSA-N	0	3	341.499	3.226	20	30		EGEDHN
C#CCCCCNC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1	ZINC000155104669	454963616	/nfs/dbraw/zinc/96/36/16/454963616.db2.gz	GHCDOOSZKCFMEZ-SFHVURJKSA-N	0	3	327.472	3.096	20	30		EGEDHN
CCN1CCC(n2nccc2NC(=O)/C=C/c2cccc(C#N)c2)CC1	ZINC000170765866	454973758	/nfs/dbraw/zinc/97/37/58/454973758.db2.gz	WONHGCIEDXLYIE-VOTSOKGWSA-N	0	3	349.438	3.063	20	30		EGEDHN
CCCCN(C)CCNC(=O)Nc1cc(C#N)ccc1OC(F)F	ZINC000151436129	454984855	/nfs/dbraw/zinc/98/48/55/454984855.db2.gz	CWDKAPLDIRQFKR-UHFFFAOYSA-N	0	3	340.374	3.013	20	30		EGEDHN
CN(C)[C@]1(CNC(=O)Nc2ccc(C(C)(C)C#N)cc2)CCSC1	ZINC000267117019	455504049	/nfs/dbraw/zinc/50/40/49/455504049.db2.gz	AEEZWLZDDILNNN-SFHVURJKSA-N	0	3	346.500	3.047	20	30		EGEDHN
C=CCN1CCC(N[C@@H](C)c2ncc(Br)s2)CC1	ZINC000179226840	455022566	/nfs/dbraw/zinc/02/25/66/455022566.db2.gz	ODHGBAPSJHJFOF-JTQLQIEISA-N	0	3	330.295	3.207	20	30		EGEDHN
Cn1c(CNCCSCc2ccccc2C#N)nc2ccccc21	ZINC000171131556	455034520	/nfs/dbraw/zinc/03/45/20/455034520.db2.gz	WGGGMPIVDFELAM-UHFFFAOYSA-N	0	3	336.464	3.468	20	30		EGEDHN
CC[C@@H](Cc1ccccc1)N(C)CC(=O)NC1(C#N)CCCCC1	ZINC000128674159	455076175	/nfs/dbraw/zinc/07/61/75/455076175.db2.gz	FKBUUDRRBQRCHC-SFHVURJKSA-N	0	3	327.472	3.282	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](CCC)Cc2ccccc2)CC1	ZINC000171733545	455090233	/nfs/dbraw/zinc/09/02/33/455090233.db2.gz	POFIKFNZYKJBDU-IBGZPJMESA-N	0	3	329.488	3.347	20	30		EGEDHN
CCOc1cc(CNCc2ccc(OCC#N)cc2)ccc1OC	ZINC000171769800	455093063	/nfs/dbraw/zinc/09/30/63/455093063.db2.gz	FBNIZZTZLXXICD-UHFFFAOYSA-N	0	3	326.396	3.286	20	30		EGEDHN
C=CC[C@H](C)NC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C	ZINC000172050791	455113453	/nfs/dbraw/zinc/11/34/53/455113453.db2.gz	WRACTRVAGIUEPV-INIZCTEOSA-N	0	3	330.476	3.223	20	30		EGEDHN
CC[C@H](NCC(=O)N(CC)C[C@H](C)C#N)C(C)(C)c1ccccc1	ZINC000180008321	455114868	/nfs/dbraw/zinc/11/48/68/455114868.db2.gz	BIEOAUYTNJTDPB-AEFFLSMTSA-N	0	3	329.488	3.341	20	30		EGEDHN
C[C@H]1C[C@H]1[C@H](NCC(=O)N[C@@](C)(C#N)C1CC1)c1ccc(Cl)cc1	ZINC000180025267	455118505	/nfs/dbraw/zinc/11/85/05/455118505.db2.gz	JZURBRWCTHFZNH-GJGHSUIPSA-N	0	3	345.874	3.435	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cc(Cl)ccc2N(C)C)CC1	ZINC000172422079	455153179	/nfs/dbraw/zinc/15/31/79/455153179.db2.gz	YNOYNTMYMDIALR-UHFFFAOYSA-N	0	3	336.867	3.178	20	30		EGEDHN
C=CCOc1ccc(CNC[C@H](O)c2ccc(C)cc2)cc1OC	ZINC000237271258	455166787	/nfs/dbraw/zinc/16/67/87/455166787.db2.gz	NGMWAQQJKSDECT-SFHVURJKSA-N	0	3	327.424	3.392	20	30		EGEDHN
CCS[C@H]1CCCC[C@H]1NCC(=O)N(C)C1(C#N)CCCCC1	ZINC000189506155	455208979	/nfs/dbraw/zinc/20/89/79/455208979.db2.gz	OWNFGUJKJGQTND-CVEARBPZSA-N	0	3	337.533	3.325	20	30		EGEDHN
CCS[C@@H]1CCCC[C@H]1NCC(=O)Nc1oc(C)c(C)c1C#N	ZINC000189512723	455211731	/nfs/dbraw/zinc/21/17/31/455211731.db2.gz	HPRFZNRYBDIKMF-HUUCEWRRSA-N	0	3	335.473	3.361	20	30		EGEDHN
CC1CCN([C@@H](CNC(=O)c2c[nH]c(C#N)c2)c2ccccc2)CC1	ZINC000181242216	455306555	/nfs/dbraw/zinc/30/65/55/455306555.db2.gz	WFSKEJDIGMNELW-IBGZPJMESA-N	0	3	336.439	3.089	20	30		EGEDHN
C[C@H](c1ccccc1)[C@H](C)NCC(=O)N(C)C1(C#N)CCCCC1	ZINC000181542850	455352408	/nfs/dbraw/zinc/35/24/08/455352408.db2.gz	SQMPFQDHTOWOHI-IRXDYDNUSA-N	0	3	327.472	3.453	20	30		EGEDHN
COc1cccc(CN(C)CCOc2ccc(C#N)cc2OC)c1	ZINC000265824891	455387914	/nfs/dbraw/zinc/38/79/14/455387914.db2.gz	JCHGNBVNUPKIPI-UHFFFAOYSA-N	0	3	326.396	3.086	20	30		EGEDHN
CSc1cc(C(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)co1	ZINC000600999932	460670186	/nfs/dbraw/zinc/67/01/86/460670186.db2.gz	JYINDRMURMHBPO-UHFFFAOYSA-N	0	3	343.452	3.077	20	30		EGEDHN
CN(C[C@H]1CCCN(C)C1)C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000174906483	455417740	/nfs/dbraw/zinc/41/77/40/455417740.db2.gz	BRWQZXOYZUWURL-HNNXBMFYSA-N	0	3	328.460	3.293	20	30		EGEDHN
CCCC[C@@H](NCC(=O)N[C@@](C)(C#N)C1CC1)c1ccc(OC)cc1	ZINC000182141071	455445917	/nfs/dbraw/zinc/44/59/17/455445917.db2.gz	VSFZHVKSLSWTKN-QUCCMNQESA-N	0	3	343.471	3.325	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H](CC)Oc2ccccc2F)CC1	ZINC000175588313	455467715	/nfs/dbraw/zinc/46/77/15/455467715.db2.gz	GRGBDBFZCTWVCC-KRWDZBQOSA-N	0	3	334.435	3.140	20	30		EGEDHN
C[C@H](CNC(=O)c1cccc(SCC#N)c1)N1CCC[C@@H](C)C1	ZINC000246412850	455486781	/nfs/dbraw/zinc/48/67/81/455486781.db2.gz	BHXYEPLMFINCFW-HUUCEWRRSA-N	0	3	331.485	3.152	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/CC(=O)N(C)C2CCCCC2)c([O-])c1	ZINC000267128378	455505156	/nfs/dbraw/zinc/50/51/56/455505156.db2.gz	VGNYVKYFFDELDV-KGENOOAVSA-N	0	3	345.487	3.448	20	30		EGEDHN
CCN(CC)c1ccc(/C=N/CC(=O)N(C)C2CCCCC2)c(O)c1	ZINC000267128378	455505160	/nfs/dbraw/zinc/50/51/60/455505160.db2.gz	VGNYVKYFFDELDV-KGENOOAVSA-N	0	3	345.487	3.448	20	30		EGEDHN
C=CCNC(=O)NC(=O)CN[C@H](C)c1ccc(Cl)c2ccccc21	ZINC000185395386	455553642	/nfs/dbraw/zinc/55/36/42/455553642.db2.gz	ZPIAIIGEZQRZHC-GFCCVEGCSA-N	0	3	345.830	3.156	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2c(C)noc2-c2ccccc2)CC1	ZINC000185465426	455561993	/nfs/dbraw/zinc/56/19/93/455561993.db2.gz	MCLVFTYGZORSNN-UHFFFAOYSA-N	0	3	340.427	3.422	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H]2CN(Cc3ccc(C#N)cc3)CC[C@@H]21	ZINC000292259531	455611027	/nfs/dbraw/zinc/61/10/27/455611027.db2.gz	PJDQCJRGBBSXGO-MSOLQXFVSA-N	0	3	341.455	3.390	20	30		EGEDHN
C[C@@H](c1ccc(C#N)cc1)N1C[C@@H](C)[C@H](NC(=O)OC(C)(C)C)C1	ZINC000277632510	455619415	/nfs/dbraw/zinc/61/94/15/455619415.db2.gz	BJSMWRTZUKRVPU-JKIFEVAISA-N	0	3	329.444	3.464	20	30		EGEDHN
C=CCN1CCC(NCc2cnn(Cc3ccccc3)c2Cl)CC1	ZINC000284015098	455624026	/nfs/dbraw/zinc/62/40/26/455624026.db2.gz	QFJVPIRWLOLSSP-UHFFFAOYSA-N	0	3	344.890	3.325	20	30		EGEDHN
N#Cc1nc(NCC2CCN(c3ccncc3)CC2)ccc1Cl	ZINC000271439781	455636653	/nfs/dbraw/zinc/63/66/53/455636653.db2.gz	OBSJLFPHUYFNGZ-UHFFFAOYSA-N	0	3	327.819	3.330	20	30		EGEDHN
N#C[C@H]1CCC[C@@H](N[C@H]2CCN(c3ccc(F)c(Cl)c3)C2=O)C1	ZINC000185879741	455640719	/nfs/dbraw/zinc/64/07/19/455640719.db2.gz	XIFJLEHDFIBMFW-OZVIIMIRSA-N	0	3	335.810	3.256	20	30		EGEDHN
C#CCC(C)(C)C(=O)N(CC)C[C@H]1CCN(Cc2ccccc2)C1	ZINC000185949265	455660146	/nfs/dbraw/zinc/66/01/46/455660146.db2.gz	ZJVZDLZYFDEYHP-IBGZPJMESA-N	0	3	326.484	3.407	20	30		EGEDHN
CN(C(=O)/C=C/c1cccc(C#N)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000268514936	455703843	/nfs/dbraw/zinc/70/38/43/455703843.db2.gz	FBUGPVACVUXVOT-ZJVMWOEPSA-N	0	3	345.446	3.304	20	30		EGEDHN
COc1ccc(CN[C@H](C)c2ccc(OCC#N)cc2)cc1OC	ZINC000192934764	455721528	/nfs/dbraw/zinc/72/15/28/455721528.db2.gz	NCAHHTDUSCTJGF-CQSZACIVSA-N	0	3	326.396	3.457	20	30		EGEDHN
Cn1cnc2cc(CN3CCCN(c4ccccc4C#N)CC3)ccc21	ZINC000271694970	455724925	/nfs/dbraw/zinc/72/49/25/455724925.db2.gz	ANHXBWSVNILKKX-UHFFFAOYSA-N	0	3	345.450	3.157	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)C1(C#N)CCCCC1	ZINC000248777656	455730288	/nfs/dbraw/zinc/73/02/88/455730288.db2.gz	HSCRKGYOCFJHMT-FUHWJXTLSA-N	0	3	325.456	3.097	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCCN1CCN(C)C[C@H]1c1ccccc1	ZINC000248931368	455739186	/nfs/dbraw/zinc/73/91/86/455739186.db2.gz	MMIREEGXEKJXKI-PZJWPPBQSA-N	0	3	343.515	3.084	20	30		EGEDHN
N#C[C@@H]1CCC[C@H](N[C@@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)C1	ZINC000249051553	455742751	/nfs/dbraw/zinc/74/27/51/455742751.db2.gz	XNTFRIFVHFPBKE-BFQNTYOBSA-N	0	3	335.810	3.256	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000186335892	455745950	/nfs/dbraw/zinc/74/59/50/455745950.db2.gz	MGJPHMKQOMZBCJ-MJGOQNOKSA-N	0	3	330.472	3.091	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCc1ccc(OC2CCN(C)CC2)cc1	ZINC000284812231	455746427	/nfs/dbraw/zinc/74/64/27/455746427.db2.gz	XBUHPCDDPRRUSQ-HXUWFJFHSA-N	0	3	330.472	3.378	20	30		EGEDHN
C[C@H](NCCC(=O)N(C)CCC#N)c1ccc(OCC2CC2)c(F)c1	ZINC000271778801	455756202	/nfs/dbraw/zinc/75/62/02/455756202.db2.gz	KNDBUFUFELNTRC-AWEZNQCLSA-N	0	3	347.434	3.027	20	30		EGEDHN
CCOC(=O)N1CCC([C@@H](C)NCC#Cc2ccc(F)cc2)CC1	ZINC000186411719	455762771	/nfs/dbraw/zinc/76/27/71/455762771.db2.gz	WWTJLOPOMYPFGK-OAHLLOKOSA-N	0	3	332.419	3.024	20	30		EGEDHN
COc1cc(C)c([C@@H](C)NC[C@H](O)c2ccc(C#N)cc2)cc1OC	ZINC000271817019	455771973	/nfs/dbraw/zinc/77/19/73/455771973.db2.gz	VDGYMPQPZHFIHV-KDOFPFPSSA-N	0	3	340.423	3.268	20	30		EGEDHN
Cn1cc(CN2CCC[C@@H]2[C@H]2CCCO2)c(-c2ccc(C#N)cc2)n1	ZINC000284990018	455773255	/nfs/dbraw/zinc/77/32/55/455773255.db2.gz	YJRJVWBJKQXBRO-RTBURBONSA-N	0	3	336.439	3.102	20	30		EGEDHN
CCc1ccc([C@H](C#N)NC(=O)C2C[C@H](c3ccccc3)OC2=O)cc1	ZINC000293406831	455785504	/nfs/dbraw/zinc/78/55/04/455785504.db2.gz	MXTVJJJLBNCIRN-CEXWTWQISA-N	0	3	348.402	3.234	20	30		EGEDHN
C=CCSCCNCc1c(Cl)cccc1N1CCOCC1	ZINC000293531618	455790150	/nfs/dbraw/zinc/79/01/50/455790150.db2.gz	JLEFATWRXUJLGM-UHFFFAOYSA-N	0	3	326.893	3.185	20	30		EGEDHN
C=C(C)COc1cccc(NC(=O)Nc2ccn(CCN(C)C)n2)c1	ZINC000186594265	455800905	/nfs/dbraw/zinc/80/09/05/455800905.db2.gz	MONKYIOZEJWTEV-UHFFFAOYSA-N	0	3	343.431	3.044	20	30		EGEDHN
COc1cccc(OC)c1OC1CCN([C@H]2CC[C@@H](C#N)C2)CC1	ZINC000278692993	455843873	/nfs/dbraw/zinc/84/38/73/455843873.db2.gz	SHTKRYLTZWOMCI-CABCVRRESA-N	0	3	330.428	3.239	20	30		EGEDHN
CC[C@H](NC[C@@H](O)COc1ccc(F)c(F)c1)c1ccc(C#N)cc1	ZINC000278672691	455844051	/nfs/dbraw/zinc/84/40/51/455844051.db2.gz	JGKZNHSALKIBLI-BEFAXECRSA-N	0	3	346.377	3.317	20	30		EGEDHN
CCCCO[C@@H]1C[C@@H](N[C@H](C)C(=O)NC2(C#N)CCCCC2)C1(C)C	ZINC000253430356	455847487	/nfs/dbraw/zinc/84/74/87/455847487.db2.gz	QMAXBBCALVFHAA-BRWVUGGUSA-N	0	3	349.519	3.291	20	30		EGEDHN
Cc1ccncc1CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000269610850	455849813	/nfs/dbraw/zinc/84/98/13/455849813.db2.gz	KDIXGMOOWZRQNB-UHFFFAOYSA-N	0	3	334.423	3.112	20	30		EGEDHN
CN(Cc1ccc(OCC#N)cc1)[C@H](CO)c1ccc(Cl)cc1	ZINC000296094588	455869860	/nfs/dbraw/zinc/86/98/60/455869860.db2.gz	DEQKDXTVTIYELQ-GOSISDBHSA-N	0	3	330.815	3.408	20	30		EGEDHN
C[C@@H](NC(=O)c1ccccc1OCC#N)[C@H](c1ccccc1)N(C)C	ZINC000187214350	455882009	/nfs/dbraw/zinc/88/20/09/455882009.db2.gz	FSSVGZZDJXBHMS-DNVCBOLYSA-N	0	3	337.423	3.010	20	30		EGEDHN
CC(C)(C(=O)N1CC[C@@H](N2CCCCC2)C1)c1cc(F)cc(C#N)c1	ZINC000285623434	455883765	/nfs/dbraw/zinc/88/37/65/455883765.db2.gz	ZPVITANFQIPVGD-GOSISDBHSA-N	0	3	343.446	3.062	20	30		EGEDHN
CN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(C(C)(C)C#N)cc2)C1	ZINC000280084697	455887419	/nfs/dbraw/zinc/88/74/19/455887419.db2.gz	YJELIIUTXBYLLX-AEFFLSMTSA-N	0	3	325.456	3.044	20	30		EGEDHN
C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000285656776	455891041	/nfs/dbraw/zinc/89/10/41/455891041.db2.gz	FAPPQISBODCULP-CRAIPNDOSA-N	0	3	325.456	3.187	20	30		EGEDHN
CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1ccc(CC#N)cc1	ZINC000270235214	455908546	/nfs/dbraw/zinc/90/85/46/455908546.db2.gz	BAUBAOUJYAYNSC-UHFFFAOYSA-N	0	3	339.414	3.096	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2nc3cc(Cl)ccc3s2)CC1	ZINC000296369100	455919360	/nfs/dbraw/zinc/91/93/60/455919360.db2.gz	RFHWYNCXDRBGBN-UHFFFAOYSA-N	0	3	335.860	3.330	20	30		EGEDHN
C#CCOc1ccc([C@H](C)N2CCC[C@@H](CC(C)(C)C(N)=O)C2)cc1	ZINC000296473779	455948614	/nfs/dbraw/zinc/94/86/14/455948614.db2.gz	NWTQJFIZVUDHPL-IRXDYDNUSA-N	0	3	342.483	3.373	20	30		EGEDHN
C=C(C)[C@@H](NC(=O)NCCN(CC)C1CC1)c1ccc(F)c(F)c1	ZINC000187818738	455957169	/nfs/dbraw/zinc/95/71/69/455957169.db2.gz	OCLBUJREJLYXSF-QGZVFWFLSA-N	0	3	337.414	3.366	20	30		EGEDHN
N#Cc1ccc(C(=O)N2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)cc1	ZINC000286012829	455960583	/nfs/dbraw/zinc/96/05/83/455960583.db2.gz	ZAQIOTLNXHESPJ-JOCHJYFZSA-N	0	3	345.446	3.296	20	30		EGEDHN
CCOC[C@@H](N[C@@H](C)C(=O)N(CCC#N)c1ccc(F)cc1)C(C)C	ZINC000286072926	455972725	/nfs/dbraw/zinc/97/27/25/455972725.db2.gz	JQXDBMIEEQLMBJ-MAUKXSAKSA-N	0	3	349.450	3.112	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)N(C)C[C@@H]1CCN(Cc2ccccc2)C1	ZINC000280559824	455999801	/nfs/dbraw/zinc/99/98/01/455999801.db2.gz	FQCSAVURWMILKU-KRWDZBQOSA-N	0	3	337.423	3.054	20	30		EGEDHN
CCOc1ccc(CN(C)CCC(=O)Nc2ccccc2C#N)cc1	ZINC000198382526	456005710	/nfs/dbraw/zinc/00/57/10/456005710.db2.gz	RDARHDWTXFJBQX-UHFFFAOYSA-N	0	3	337.423	3.418	20	30		EGEDHN
C=C(C)COc1cc(CNCC2([S@](C)=O)CCC2)ccc1OC	ZINC000280653687	456023690	/nfs/dbraw/zinc/02/36/90/456023690.db2.gz	OJNCQRVPFOMHHY-QHCPKHFHSA-N	0	3	337.485	3.041	20	30		EGEDHN
C[C@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)C1=CCN(C)CC1	ZINC000272759031	456062890	/nfs/dbraw/zinc/06/28/90/456062890.db2.gz	FRSWRUQAOBSETM-AWEZNQCLSA-N	0	3	326.444	3.260	20	30		EGEDHN
C=CCNC(=O)[C@@H](C)N[C@H](C)c1ccc(Oc2cccnc2)cc1	ZINC000287245347	456064799	/nfs/dbraw/zinc/06/47/99/456064799.db2.gz	PCADSRQITZBOFG-HUUCEWRRSA-N	0	3	325.412	3.215	20	30		EGEDHN
CN(CCCSCC#N)[C@H](CO)c1cccc(Br)c1	ZINC000270995465	456090365	/nfs/dbraw/zinc/09/03/65/456090365.db2.gz	UVBNLWWHTALYLQ-CQSZACIVSA-N	0	3	343.290	3.061	20	30		EGEDHN
C=CCOc1ccc(CN[C@H](C)[C@@H](O)c2ccccc2)cc1OC	ZINC000288528575	456098641	/nfs/dbraw/zinc/09/86/41/456098641.db2.gz	KATJLRKYIPFRAX-FOIQADDNSA-N	0	3	327.424	3.472	20	30		EGEDHN
CC(C)c1nnc2n1C[C@@H](N[C@H](C)c1ccc(C#N)cc1F)CC2	ZINC000332696966	456112253	/nfs/dbraw/zinc/11/22/53/456112253.db2.gz	XIRDFIORZPEJRF-OCCSQVGLSA-N	0	3	327.407	3.078	20	30		EGEDHN
C#Cc1ccc(CN2CCC[C@H](c3nnc4n3CCCCC4)C2)cc1	ZINC000289128366	456116158	/nfs/dbraw/zinc/11/61/58/456116158.db2.gz	OHBGRSHRVPMCSW-IBGZPJMESA-N	0	3	334.467	3.365	20	30		EGEDHN
Cn1cc(CN[C@@H]2c3ccccc3CC[C@H]2n2ccnc2)cc1C#N	ZINC000289242734	456119302	/nfs/dbraw/zinc/11/93/02/456119302.db2.gz	AALVGQFUGSQLNZ-WOJBJXKFSA-N	0	3	331.423	3.112	20	30		EGEDHN
C=CCOc1ccc(CNCC[C@H](O)c2ccccc2)cc1OC	ZINC000289411866	456124333	/nfs/dbraw/zinc/12/43/33/456124333.db2.gz	HXQGPDOZJBVPIQ-SFHVURJKSA-N	0	3	327.424	3.473	20	30		EGEDHN
C=CCn1c(C)nnc1N(C)[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000289667298	456135044	/nfs/dbraw/zinc/13/50/44/456135044.db2.gz	MNBTXODCZVLBJR-LPHOPBHVSA-N	0	3	339.487	3.262	20	30		EGEDHN
N#CCCCNCc1cn(Cc2ccccc2)nc1-c1cccnc1	ZINC000273074701	456168211	/nfs/dbraw/zinc/16/82/11/456168211.db2.gz	PESABSPQRBQLGQ-UHFFFAOYSA-N	0	3	331.423	3.387	20	30		EGEDHN
N#Cc1ccc(N2CCC(NCc3ccccc3[N+](=O)[O-])CC2)cc1	ZINC000263694004	456194576	/nfs/dbraw/zinc/19/45/76/456194576.db2.gz	POPMPTBGPBCPRY-UHFFFAOYSA-N	0	3	336.395	3.225	20	30		EGEDHN
N#CCN(C(=O)[C@H]1CCCN(Cc2ccccc2)C1)c1ccccc1	ZINC000263720628	456201791	/nfs/dbraw/zinc/20/17/91/456201791.db2.gz	CMHUVNYYXQXPMA-IBGZPJMESA-N	0	3	333.435	3.455	20	30		EGEDHN
C[C@H]1CN(C(=O)Nc2ccc(C#N)c(F)c2)CCN(C2CCC2)C1	ZINC000297423959	456217655	/nfs/dbraw/zinc/21/76/55/456217655.db2.gz	OIEMONOVGPWZCI-CYBMUJFWSA-N	0	3	330.407	3.035	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1CNC(=O)c1ccc(CN2CCCCC2)cc1	ZINC000281447396	456237702	/nfs/dbraw/zinc/23/77/02/456237702.db2.gz	OJWASKJFLJGSGU-PMACEKPBSA-N	0	3	342.483	3.384	20	30		EGEDHN
CN(Cc1ccccc1)[C@H](CNC(=O)c1ccc(CC#N)cc1)C1CC1	ZINC000275110218	456270163	/nfs/dbraw/zinc/27/01/63/456270163.db2.gz	XWIKOBRTAJWFSM-OAQYLSRUSA-N	0	3	347.462	3.393	20	30		EGEDHN
C=CCN1CC[C@H](N(Cc2ccc3c(c2)CCO3)C2CCCC2)C1=O	ZINC000337144101	456330880	/nfs/dbraw/zinc/33/08/80/456330880.db2.gz	WGGGDASFAVRIGL-IBGZPJMESA-N	0	3	340.467	3.153	20	30		EGEDHN
CCC[C@@H](NCCCC1(C#N)CCOCC1)c1nnc2ccccn21	ZINC000337205858	456338724	/nfs/dbraw/zinc/33/87/24/456338724.db2.gz	LJFRHPYEQXJWHQ-MRXNPFEDSA-N	0	3	341.459	3.261	20	30		EGEDHN
CCOC1(C)CCN(Cc2cn(C)nc2-c2ccc(C#N)cc2)CC1	ZINC000298219095	456395178	/nfs/dbraw/zinc/39/51/78/456395178.db2.gz	FSHGYACWBMENLS-UHFFFAOYSA-N	0	3	338.455	3.350	20	30		EGEDHN
C[C@@H](NC(=O)C(C#N)Cc1ccc(C#N)cc1)c1ccc(F)cc1F	ZINC000348009351	456436225	/nfs/dbraw/zinc/43/62/25/456436225.db2.gz	YSXSOAOURXBANA-IUODEOHRSA-N	0	3	339.345	3.396	20	30		EGEDHN
N#Cc1cc(NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)ccc1F	ZINC000343171910	456451837	/nfs/dbraw/zinc/45/18/37/456451837.db2.gz	KCRHCKYZZRLYQM-KRWDZBQOSA-N	0	3	338.386	3.093	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1C[C@@H](F)CN1Cc1nccs1	ZINC000348108642	456486253	/nfs/dbraw/zinc/48/62/53/456486253.db2.gz	ULDFBSWCOOHWRC-SJORKVTESA-N	0	3	344.459	3.059	20	30		EGEDHN
CCN1CCN(c2ccc(F)cc2[C@H](C)N[C@@H](C)CCC#N)CC1	ZINC000276364712	456457254	/nfs/dbraw/zinc/45/72/54/456457254.db2.gz	ZQOZHTSSRHDBDC-HOTGVXAUSA-N	0	3	332.467	3.310	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)NC[C@H](C)N1CCC(C)CC1	ZINC000303510623	456465296	/nfs/dbraw/zinc/46/52/96/456465296.db2.gz	WVWDWOWVDFLJKV-KRWDZBQOSA-N	0	3	345.487	3.171	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N(CC)Cc1ccncc1)C(C)C	ZINC000298669993	456512399	/nfs/dbraw/zinc/51/23/99/456512399.db2.gz	MDTAFTOOQSQDCJ-LJQANCHMSA-N	0	3	344.503	3.312	20	30		EGEDHN
C[C@@H](C(=O)N(C)CCC#N)N1CCC(C)(c2ccc(Cl)cc2)CC1	ZINC000348192857	456527559	/nfs/dbraw/zinc/52/75/59/456527559.db2.gz	JXDJRRABJCOQLA-HNNXBMFYSA-N	0	3	347.890	3.454	20	30		EGEDHN
C=CCn1c(-c2ccccc2)nnc1N1CC[C@@H](N2CCCCC2)C1	ZINC000282541617	456546887	/nfs/dbraw/zinc/54/68/87/456546887.db2.gz	IBTBQWQSYSVATI-GOSISDBHSA-N	0	3	337.471	3.196	20	30		EGEDHN
C=CCn1c(C)nnc1N1CCN(Cc2cccc3ccccc32)CC1	ZINC000337803698	456557453	/nfs/dbraw/zinc/55/74/53/456557453.db2.gz	GFKSZALENNHSFE-UHFFFAOYSA-N	0	3	347.466	3.248	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(-c3nccs3)cc2)CC1	ZINC000299158380	456623424	/nfs/dbraw/zinc/62/34/24/456623424.db2.gz	PTZFJGIDBZMCNS-UHFFFAOYSA-N	0	3	325.437	3.094	20	30		EGEDHN
CC1(C)CN(Cc2cn(CCC#N)nc2-c2ccncc2)[C@@H]1C1CC1	ZINC000291481415	456655420	/nfs/dbraw/zinc/65/54/20/456655420.db2.gz	FWHBIFAVTSTOEL-LJQANCHMSA-N	0	3	335.455	3.479	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CCC(N2CCc3ccccc3C2)CC1	ZINC000299332902	456660160	/nfs/dbraw/zinc/66/01/60/456660160.db2.gz	JXYVITHGYJUWPL-QGZVFWFLSA-N	0	3	342.483	3.017	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CCN(C(=O)C2(C#N)CCCCC2)C1	ZINC000324095656	456660366	/nfs/dbraw/zinc/66/03/66/456660366.db2.gz	CIZVUPWTLKXYLY-SFHVURJKSA-N	0	3	339.483	3.441	20	30		EGEDHN
N#CCOc1ccc(CN[C@H]2CCO[C@H]2c2ccc(F)c(F)c2)cc1	ZINC000277074016	456672580	/nfs/dbraw/zinc/67/25/80/456672580.db2.gz	PFAKGLFPYSDJKP-OALUTQOASA-N	0	3	344.361	3.487	20	30		EGEDHN
CCCN(CC(=O)N[C@](C)(C#N)C1CC1)[C@H]1CCc2ccccc21	ZINC000299450264	456697170	/nfs/dbraw/zinc/69/71/70/456697170.db2.gz	ZHCGFEWZPPTGNX-AZUAARDMSA-N	0	3	325.456	3.194	20	30		EGEDHN
N#Cc1ccccc1-c1ccc(CN2CC[C@H](N3CCCC3=O)C2)cc1	ZINC000299548264	456725210	/nfs/dbraw/zinc/72/52/10/456725210.db2.gz	FWUDIUVJUZVXSL-FQEVSTJZSA-N	0	3	345.446	3.422	20	30		EGEDHN
Cc1cc(C)cc(NC(=O)[C@H](C)N2CCC[C@@H]2[C@H]2COCC[C@H]2O)c1	ZINC000328693857	456737661	/nfs/dbraw/zinc/73/76/61/456737661.db2.gz	CSMTWECORMUIFB-JCHJZTRSSA-N	0	3	346.471	3.142	20	30		EGEDHN
C[C@H](N[C@@H](C)[C@H]1CCOC1)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000328814250	456767259	/nfs/dbraw/zinc/76/72/59/456767259.db2.gz	NJVKJOWKFRETKM-SRVKXCTJSA-N	0	3	333.457	3.100	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2ccc(C#N)cc2)C1	ZINC000338316355	456768244	/nfs/dbraw/zinc/76/82/44/456768244.db2.gz	PPGFTGDBKKBEIT-OXQOHEQNSA-N	0	3	348.450	3.193	20	30		EGEDHN
CC(=O)N1CC[C@H](NC(=O)CN2[C@H](C)CC[C@@H]2C)c2ccccc21	ZINC000328831174	456770664	/nfs/dbraw/zinc/77/06/64/456770664.db2.gz	UVDOKJONHXFYIC-VBQJREDUSA-N	0	3	329.444	3.314	20	30		EGEDHN
CC[C@H](CNC(=O)[C@H]1CCCC(=O)N1)N1CCc2ccccc2C1	ZINC000328834558	456770959	/nfs/dbraw/zinc/77/09/59/456770959.db2.gz	WUODZEUQSHCTES-IAGOWNOFSA-N	0	3	329.444	3.289	20	30		EGEDHN
CC(C)(C)c1cc(NC(=O)CN[C@H]2CCC(=O)N[C@@H]2C2CC2)on1	ZINC000328913076	456789727	/nfs/dbraw/zinc/78/97/27/456789727.db2.gz	PHZBBVOSHWSSFP-MEDUHNTESA-N	0	3	334.420	3.047	20	30		EGEDHN
C[C@@H]1CC=CC[C@@H]1C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000340970535	456791010	/nfs/dbraw/zinc/79/10/10/456791010.db2.gz	IOMVXUXDRILRNQ-APWZRJJASA-N	0	3	325.456	3.051	20	30		EGEDHN
Cc1nc2ccc(NC(=O)N3CCCC34CCN(C)CC4)cc2o1	ZINC000329082465	456830839	/nfs/dbraw/zinc/83/08/39/456830839.db2.gz	SHMWYHWAQHQHJT-UHFFFAOYSA-N	0	3	328.416	3.242	20	30		EGEDHN
CC(C)C(=O)Nc1cc(C(=O)C(C#N)c2nc3ccccc3[nH]2)ccn1	ZINC000344644409	456842381	/nfs/dbraw/zinc/84/23/81/456842381.db2.gz	XUZFZQJVDBZCQP-CYBMUJFWSA-N	0	3	347.378	3.042	20	30		EGEDHN
C[C@H]1CN(C(=O)C[C@H](CC#N)c2ccccc2)CCN(C2CCC2)C1	ZINC000344721999	456852536	/nfs/dbraw/zinc/85/25/36/456852536.db2.gz	IQDVMJNCNLAWQU-MJGOQNOKSA-N	0	3	339.483	3.407	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@H](C#N)CCc2ccccc2)CCN(C2CCC2)C1	ZINC000344770954	456857649	/nfs/dbraw/zinc/85/76/49/456857649.db2.gz	JIBRQVZFBRKSEF-HKUYNNGSSA-N	0	3	339.483	3.092	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2ccc(OC3CCCC3)nc2)CN1C1CC1	ZINC000329288041	456866698	/nfs/dbraw/zinc/86/66/98/456866698.db2.gz	HMOJMDMQTJGZLZ-UKRRQHHQSA-N	0	3	329.444	3.333	20	30		EGEDHN
C[C@@H]1C[C@H](C(=O)NCC2CCN(c3ccncc3)CC2)CC(=O)N1	ZINC000329440596	456890796	/nfs/dbraw/zinc/89/07/96/456890796.db2.gz	MWOAZCZTKLNBQK-HIFRSBDPSA-N	0	3	330.432	3.010	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2COc3ccc(Cl)cc32)CC1	ZINC000353765274	456897015	/nfs/dbraw/zinc/89/70/15/456897015.db2.gz	IEYBARSMMZBYOE-MRXNPFEDSA-N	0	3	349.862	3.113	20	30		EGEDHN
CC1(C)CCCc2sc(NC(=O)N[C@@H]3CCc4nc[nH]c4C3)nc21	ZINC000329559456	456908627	/nfs/dbraw/zinc/90/86/27/456908627.db2.gz	ILQZGQKCCQTQKX-SNVBAGLBSA-N	0	3	345.472	3.364	20	30		EGEDHN
C[C@@H]1CC[C@H](C)N1CC(=O)N1CCC(NC(=O)CC2CCCC2)CC1	ZINC000329878784	456954772	/nfs/dbraw/zinc/95/47/72/456954772.db2.gz	LGTUMURVKCSMPH-IYBDPMFKSA-N	0	3	349.519	3.387	20	30		EGEDHN
CN1CCC2(CC1)C[C@@H](NC(=O)Cc1ccon1)c1ccccc1O2	ZINC000329883502	456955606	/nfs/dbraw/zinc/95/56/06/456955606.db2.gz	RDTHMZNXEKREAX-MRXNPFEDSA-N	0	3	341.411	3.162	20	30		EGEDHN
C[C@@H]1C[NH+](Cc2ccccc2)C[C@@H](C)C1NC(=O)c1csc(=O)[n-]1	ZINC000329913788	456960122	/nfs/dbraw/zinc/96/01/22/456960122.db2.gz	OVJKIAANWFVWEA-CHWSQXEVSA-N	0	3	345.468	3.310	20	30		EGEDHN
CC1(C)CCCN(CCNC(=O)c2ccc3c(c2)NC(=O)CO3)C1	ZINC000329923066	456961643	/nfs/dbraw/zinc/96/16/43/456961643.db2.gz	UGFWSIRTEXDYEP-UHFFFAOYSA-N	0	3	331.416	3.094	20	30		EGEDHN
CCN1CCC[C@@H]1CNC(=O)N[C@@H]1CCCO[C@@H]1c1ccc(C)cc1	ZINC000329936160	456963963	/nfs/dbraw/zinc/96/39/63/456963963.db2.gz	CXHQWGKDJFYBOH-GUDVDZBRSA-N	0	3	345.487	3.203	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)[C@@](C)(C#N)CC)c1cccc(OC)c1	ZINC000349520786	456981039	/nfs/dbraw/zinc/98/10/39/456981039.db2.gz	JEEYHNAPGHJNEX-IEBWSBKVSA-N	0	3	331.460	3.134	20	30		EGEDHN
CC(C(=O)N[C@H]1CCC(C)(C)C[C@H]1C)S(=O)(=O)C1CCOCC1	ZINC000330071993	456981529	/nfs/dbraw/zinc/98/15/29/456981529.db2.gz	JIWKDPBWVLLUNW-NFAWXSAZSA-N	0	3	345.505	3.140	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)CC1(N2CCOCC2)CCCC1	ZINC000345645975	456985710	/nfs/dbraw/zinc/98/57/10/456985710.db2.gz	JWHZIAZSDIPPIH-UHFFFAOYSA-N	0	3	348.512	3.298	20	30		EGEDHN
CCN(C(=O)C(C)C#N)[C@@H](c1cccnc1)c1ccc(F)c(F)c1	ZINC000345642672	456986011	/nfs/dbraw/zinc/98/60/11/456986011.db2.gz	MXZVHZBCCOBLHY-SJKOYZFVSA-N	0	3	329.350	3.457	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NC[C@H]1CCCN1Cc1ccccc1)OCC	ZINC000339220855	456998440	/nfs/dbraw/zinc/99/84/40/456998440.db2.gz	VATUGKNBNNDKJS-MOPGFXCFSA-N	0	3	330.472	3.139	20	30		EGEDHN
CC1(C)CN(C2(CNc3cccc(C#N)n3)CCCCC2)CCO1	ZINC000339220362	456998546	/nfs/dbraw/zinc/99/85/46/456998546.db2.gz	UWKLFLIBYNCDAD-UHFFFAOYSA-N	0	3	328.460	3.179	20	30		EGEDHN
[O-]C(NC[C@@H]1CCc2nccn2C1)=[NH+]C[C@@H]1CCCCC(F)(F)C1	ZINC000330202362	457001560	/nfs/dbraw/zinc/00/15/60/457001560.db2.gz	ZEUDLJSPFDOCLZ-KGLIPLIRSA-N	0	3	340.418	3.165	20	30		EGEDHN
[O-]C(NC[C@@H]1CCCCC(F)(F)C1)=[NH+]C[C@@H]1CCc2nccn2C1	ZINC000330202362	457001563	/nfs/dbraw/zinc/00/15/63/457001563.db2.gz	ZEUDLJSPFDOCLZ-KGLIPLIRSA-N	0	3	340.418	3.165	20	30		EGEDHN
C[C@@H](CN(C)C)NC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1	ZINC000346135263	457019658	/nfs/dbraw/zinc/01/96/58/457019658.db2.gz	CZUMCSWKWWUOQP-HNNXBMFYSA-N	0	3	337.423	3.225	20	30		EGEDHN
CCCCOc1cc(OC)ccc1C(=O)C(C#N)c1ccncn1	ZINC000346365795	457036801	/nfs/dbraw/zinc/03/68/01/457036801.db2.gz	DBBUVIPYKYLIFO-OAHLLOKOSA-N	0	3	325.368	3.154	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1c1nc(-c2ccccc2OCCN(C)C)no1	ZINC000346396990	457040058	/nfs/dbraw/zinc/04/00/58/457040058.db2.gz	UTLQMRFDQQGHDA-RDJZCZTQSA-N	0	3	343.427	3.126	20	30		EGEDHN
C[C@H]1[C@H](NC(=O)Nc2cccc(C#N)c2)CCN1Cc1ccccc1	ZINC000359006097	457045402	/nfs/dbraw/zinc/04/54/02/457045402.db2.gz	HEGGYKKXNJMLRI-HNAYVOBHSA-N	0	3	334.423	3.343	20	30		EGEDHN
CNC(=O)c1cccc(NC(=O)[C@@H](C(C)C)N2CCCCC2)c1C	ZINC000330609415	457060746	/nfs/dbraw/zinc/06/07/46/457060746.db2.gz	RZWDMCFRYAWUFW-QGZVFWFLSA-N	0	3	331.460	3.378	20	30		EGEDHN
CCS[C@@H]1CCCC[C@@H]1N[C@@H](C)C(=O)N[C@](C)(C#N)C(C)C	ZINC000346601708	457070827	/nfs/dbraw/zinc/07/08/27/457070827.db2.gz	HNXSBLRMVFVCJA-LJIGWXMPSA-N	0	3	325.522	3.083	20	30		EGEDHN
C=C(C)CN1CCC(Nc2cc(C(=O)OCC)c(Cl)cn2)CC1	ZINC000359492002	457088727	/nfs/dbraw/zinc/08/87/27/457088727.db2.gz	MMWSUYJBIRNUFN-UHFFFAOYSA-N	0	3	337.851	3.364	20	30		EGEDHN
CC[C@@H](C)n1ncc(NC(=O)N(C)[C@@H](C)C2CCN(C)CC2)c1C	ZINC000331166152	457141292	/nfs/dbraw/zinc/14/12/92/457141292.db2.gz	YFAISHPFRSFJOG-KGLIPLIRSA-N	0	3	335.496	3.370	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C(=O)NC[C@H]1N(C)CCCC1(C)C	ZINC000331326145	457167541	/nfs/dbraw/zinc/16/75/41/457167541.db2.gz	ONSIGRXAHVXBLR-QGZVFWFLSA-N	0	3	328.460	3.024	20	30		EGEDHN
N#Cc1ccc(C(=O)NC[C@@H]2CCCN(Cc3cccs3)C2)s1	ZINC000363002223	457192217	/nfs/dbraw/zinc/19/22/17/457192217.db2.gz	SJTMBZXFNPOGMW-ZDUSSCGKSA-N	0	3	345.493	3.323	20	30		EGEDHN
N#C[C@@H](NC(=O)[C@H]1CCCN(Cc2ccccc2)C1)C1CCCCC1	ZINC000331495835	457195683	/nfs/dbraw/zinc/19/56/83/457195683.db2.gz	VXWHKOMYRPXNGX-VQTJNVASSA-N	0	3	339.483	3.487	20	30		EGEDHN
COc1ccc(Br)cc1[C@@H]1CCCN1C(=O)C(C)C#N	ZINC000347099643	457228872	/nfs/dbraw/zinc/22/88/72/457228872.db2.gz	DWVOLOTWPHPCGM-MFKMUULPSA-N	0	3	337.217	3.281	20	30		EGEDHN
Cc1nc(NCCCCN2C[C@H](C)O[C@@H](C)C2)c(Cl)cc1C#N	ZINC000360068973	457235796	/nfs/dbraw/zinc/23/57/96/457235796.db2.gz	BYDOMKAYBVUISC-STQMWFEESA-N	0	3	336.867	3.216	20	30		EGEDHN
CC(C#N)C(=O)N1CCc2c(cccc2NC(=O)Nc2ccccc2)C1	ZINC000347118440	457239362	/nfs/dbraw/zinc/23/93/62/457239362.db2.gz	VHURZGLGWAUXOI-AWEZNQCLSA-N	0	3	348.406	3.375	20	30		EGEDHN
Cn1c(C(=O)C(C#N)c2ccncn2)cc2cc(C(F)(F)F)ccc21	ZINC000354477039	457247241	/nfs/dbraw/zinc/24/72/41/457247241.db2.gz	SPWCVIFYRYXXFT-LBPRGKRZSA-N	0	3	344.296	3.477	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CCC2(CCOCC2)CC1	ZINC000356999262	457266530	/nfs/dbraw/zinc/26/65/30/457266530.db2.gz	BJUCCHGIDLEGEZ-SFHVURJKSA-N	0	3	326.440	3.178	20	30		EGEDHN
C=CCOCCCC(=O)NC1CCN(Cc2cccc(C)c2)CC1	ZINC000360482079	457314332	/nfs/dbraw/zinc/31/43/32/457314332.db2.gz	CIBQXUNDBKIRAZ-UHFFFAOYSA-N	0	3	330.472	3.058	20	30		EGEDHN
CC1CCN([C@H](CNC(=O)NCC(C)(C)C#N)c2ccccc2)CC1	ZINC000351765175	457317155	/nfs/dbraw/zinc/31/71/55/457317155.db2.gz	SRADUOMARZCCKW-GOSISDBHSA-N	0	3	342.487	3.309	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1)OCC	ZINC000354733622	457318118	/nfs/dbraw/zinc/31/81/18/457318118.db2.gz	DEFADNKEAALKBV-WOJBJXKFSA-N	0	3	344.499	3.481	20	30		EGEDHN
C=CCNC(=O)NC(=O)[C@H](C)N[C@@H](C)c1ccc(F)c2ccccc21	ZINC000352277430	457353623	/nfs/dbraw/zinc/35/36/23/457353623.db2.gz	BXGYZWGEQWBNDL-STQMWFEESA-N	0	3	343.402	3.030	20	30		EGEDHN
C=CCNC(=O)NC(=O)[C@@H](C)N[C@@H](c1ccc(Cl)cc1)C(C)C	ZINC000357196764	457369858	/nfs/dbraw/zinc/36/98/58/457369858.db2.gz	DPUCNILSBUQHBG-IUODEOHRSA-N	0	3	337.851	3.027	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1	ZINC000425000818	457398815	/nfs/dbraw/zinc/39/88/15/457398815.db2.gz	CBGYSEFVWYRQGW-PZJWPPBQSA-N	0	3	345.446	3.213	20	30		EGEDHN
CC1CC(C#N)(C(=O)NCC2(N(C)Cc3ccccc3)CCC2)C1	ZINC000386702905	457431921	/nfs/dbraw/zinc/43/19/21/457431921.db2.gz	VGRXOCXHWYZWEY-UHFFFAOYSA-N	0	3	325.456	3.097	20	30		EGEDHN
CCCN(C)CC(=O)N(Cc1cccc(C(F)(F)F)c1)[C@H](C)C#N	ZINC000425085913	457433616	/nfs/dbraw/zinc/43/36/16/457433616.db2.gz	MMJWVRBOSJMNKP-CYBMUJFWSA-N	0	3	341.377	3.288	20	30		EGEDHN
Cc1cccc(CN(CCN(C)C)c2nccc(C#N)c2Cl)c1	ZINC000342662621	457438731	/nfs/dbraw/zinc/43/87/31/457438731.db2.gz	ITTTVAVVKKAVRK-UHFFFAOYSA-N	0	3	328.847	3.483	20	30		EGEDHN
CN(C)CCN(C(=O)c1ccc(C(C)(C)C#N)cc1)C1CCCC1	ZINC000356097585	457446665	/nfs/dbraw/zinc/44/66/65/457446665.db2.gz	PBRACXIUCBNXQM-UHFFFAOYSA-N	0	3	327.472	3.434	20	30		EGEDHN
N#CCc1ccc(CN2CCN(CCc3cccs3)CC2)cc1	ZINC000342693075	457460055	/nfs/dbraw/zinc/46/00/55/457460055.db2.gz	LPGDFZNDKPKLDS-UHFFFAOYSA-N	0	3	325.481	3.174	20	30		EGEDHN
Cc1cc(NCC2CCN(Cc3cccs3)CC2)c(C#N)cn1	ZINC000425221815	457465457	/nfs/dbraw/zinc/46/54/57/457465457.db2.gz	KTURRLARGJSKSQ-UHFFFAOYSA-N	0	3	326.469	3.069	20	30		EGEDHN
Cc1cc(C)c(C#N)c(N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)n1	ZINC000425271029	457477849	/nfs/dbraw/zinc/47/78/49/457477849.db2.gz	BTOOXBJBMIJWLT-AZUAARDMSA-N	0	3	332.451	3.281	20	30		EGEDHN
CN(C)CCN(Cc1ccsc1)c1ncc2c(c1C#N)CCC2	ZINC000425270060	457478030	/nfs/dbraw/zinc/47/80/30/457478030.db2.gz	SKPCEBDHVORREE-UHFFFAOYSA-N	0	3	326.469	3.072	20	30		EGEDHN
N#Cc1cccc(OCCN2CCC(CCCn3ccnc3)CC2)c1	ZINC000361044692	457538115	/nfs/dbraw/zinc/53/81/15/457538115.db2.gz	JGINILHHADNUQI-UHFFFAOYSA-N	0	3	338.455	3.326	20	30		EGEDHN
C=CCCOCCCCC(=O)N1C[C@H](N(C)C)Cc2ccccc21	ZINC000342833328	457546552	/nfs/dbraw/zinc/54/65/52/457546552.db2.gz	YUAISGAJEAHNES-GOSISDBHSA-N	0	3	330.472	3.269	20	30		EGEDHN
C=CCCCCNC(=O)N1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1	ZINC000425498491	457577534	/nfs/dbraw/zinc/57/75/34/457577534.db2.gz	GHHMUKIEJPYQAF-RBUKOAKNSA-N	0	3	327.472	3.259	20	30		EGEDHN
N#Cc1ccc(CN(CCO)[C@H]2CCCSC2)c(C(F)(F)F)c1	ZINC000356398097	457605119	/nfs/dbraw/zinc/60/51/19/457605119.db2.gz	QXYKRNFSPYXZKY-AWEZNQCLSA-N	0	3	344.402	3.267	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C2(c3ccc(OC)cc3)CCC2)CC1	ZINC000357588710	457609072	/nfs/dbraw/zinc/60/90/72/457609072.db2.gz	MNZHNJYKRZUPKF-UHFFFAOYSA-N	0	3	342.483	3.274	20	30		EGEDHN
C=CCC[C@@H](NC(=O)N1CCC[C@H]2CN(C)C[C@H]21)c1ccccc1	ZINC000425721921	457636553	/nfs/dbraw/zinc/63/65/53/457636553.db2.gz	AVEAIVYXAUXYGC-IPMKNSEASA-N	0	3	327.472	3.430	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NC[C@@]1(C)CCN(Cc2ccccc2)C1	ZINC000370590355	457678387	/nfs/dbraw/zinc/67/83/87/457678387.db2.gz	WAAXADLTGBVUIH-RTWAWAEBSA-N	0	3	344.499	3.244	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)c1ccc(C#N)cc1	ZINC000361390501	457715655	/nfs/dbraw/zinc/71/56/55/457715655.db2.gz	GDZWEKUFFWHJKO-UZLBHIALSA-N	0	3	333.435	3.199	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@@H]1CCO[C@@H]1C1CC1	ZINC000365340326	457744342	/nfs/dbraw/zinc/74/43/42/457744342.db2.gz	ARKIBPMBYABKFX-CRAIPNDOSA-N	0	3	332.469	3.060	20	30		EGEDHN
CC(C)Oc1ccc(CNC(=O)C(C#N)CCc2ccccc2)cn1	ZINC000433219117	457782305	/nfs/dbraw/zinc/78/23/05/457782305.db2.gz	LEBXXIFUBSYWAI-GOSISDBHSA-N	0	3	337.423	3.258	20	30		EGEDHN
CCCOc1ccc(C(C)(C)NCC(=O)N(CC)CCC#N)cc1	ZINC000361561473	457797972	/nfs/dbraw/zinc/79/79/72/457797972.db2.gz	FMQNQYKFWIVCTD-UHFFFAOYSA-N	0	3	331.460	3.062	20	30		EGEDHN
C[C@H]1Cc2ccccc2N1CCNC(=O)C(C#N)CCc1ccccc1	ZINC000433307171	457806106	/nfs/dbraw/zinc/80/61/06/457806106.db2.gz	UDEQCNJMOFZXKI-FXAWDEMLSA-N	0	3	347.462	3.326	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CCCC[C@@H]1CN1CCCC1=O	ZINC000366369920	457807964	/nfs/dbraw/zinc/80/79/64/457807964.db2.gz	AQJWIWCLNAHJDO-GOSISDBHSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=CC[C@H](C(=O)NCC1(SC)CCN(C)CC1)c1ccccc1	ZINC000358170275	457832814	/nfs/dbraw/zinc/83/28/14/457832814.db2.gz	QPWGYTVIHMMYQK-KRWDZBQOSA-N	0	3	332.513	3.290	20	30		EGEDHN
Cc1cc(C)cc(N(CCC#N)C(=O)CN2CC[C@@H]3CCC[C@@H]32)c1	ZINC000426479264	457838725	/nfs/dbraw/zinc/83/87/25/457838725.db2.gz	IJZOGLCKZODSFT-HKUYNNGSSA-N	0	3	325.456	3.425	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cnn(C3CCCCC3)c2C)CC1	ZINC000358189981	457848384	/nfs/dbraw/zinc/84/83/84/457848384.db2.gz	WDXPJKGGFPHARC-UHFFFAOYSA-N	0	3	330.476	3.077	20	30		EGEDHN
CN(CCN1C(=O)c2ccccc2C1=O)CCC1(C#N)CCCCC1	ZINC000411403622	457877207	/nfs/dbraw/zinc/87/72/07/457877207.db2.gz	VHLPFOOBKUOJKJ-UHFFFAOYSA-N	0	3	339.439	3.079	20	30		EGEDHN
C=CC[C@@H]1N(CCn2cnc3ccccc3c2=O)CCCC1(C)C	ZINC000444777451	457974879	/nfs/dbraw/zinc/97/48/79/457974879.db2.gz	FSJVZLOBRWFBJR-SFHVURJKSA-N	0	3	325.456	3.463	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN2CCC[C@@](O)(C(F)(F)F)CC2)cc1	ZINC000368051454	458007925	/nfs/dbraw/zinc/00/79/25/458007925.db2.gz	MVFWKWHQFBUOJJ-BBRMVZONSA-N	0	3	342.361	3.257	20	30		EGEDHN
CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000369099118	458080188	/nfs/dbraw/zinc/08/01/88/458080188.db2.gz	HIVLWFDFZBFHJA-MSOLQXFVSA-N	0	3	325.456	3.187	20	30		EGEDHN
CC(C)(C)O[C@@H]1C[C@H](NCC(=O)Nc2cccc(C#N)c2)C1(C)C	ZINC000412086427	458085463	/nfs/dbraw/zinc/08/54/63/458085463.db2.gz	VWLKGHNZCWKVDK-JKSUJKDBSA-N	0	3	329.444	3.069	20	30		EGEDHN
CS[C@@H]1CN(c2nc3c(cc2C#N)CCCC3(C)C)C[C@@H]1N(C)C	ZINC000428167670	458089847	/nfs/dbraw/zinc/08/98/47/458089847.db2.gz	RPMYNMOAAWYHHG-JKSUJKDBSA-N	0	3	344.528	3.049	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CC[C@@H](n2cc(Cl)cn2)C1	ZINC000428508201	458160363	/nfs/dbraw/zinc/16/03/63/458160363.db2.gz	UDSSYCBYSKKEOF-DOTOQJQBSA-N	0	3	342.830	3.082	20	30		EGEDHN
N#Cc1csc(CNC[C@@H]2CSCCN2Cc2ccccc2)c1	ZINC000428534971	458164931	/nfs/dbraw/zinc/16/49/31/458164931.db2.gz	KHUUEULRCLLDIG-QGZVFWFLSA-N	0	3	343.521	3.327	20	30		EGEDHN
C=C(C)CCNC(=O)N1C[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C1	ZINC000459007388	458241770	/nfs/dbraw/zinc/24/17/70/458241770.db2.gz	SOZOPZLPZHQTRS-RBUKOAKNSA-N	0	3	327.472	3.116	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@@H](N2CCCCC2)C1	ZINC000413822513	458307301	/nfs/dbraw/zinc/30/73/01/458307301.db2.gz	LACZSZJVMJDQSA-VQTJNVASSA-N	0	3	341.499	3.444	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)NC(=O)N(C)[C@@H]1CCN(C(C)C)C1	ZINC000413843215	458311033	/nfs/dbraw/zinc/31/10/33/458311033.db2.gz	ZKDFAOCHQBWOTQ-RBUKOAKNSA-N	0	3	329.488	3.298	20	30		EGEDHN
CN(C)CCN(Cc1ccsc1)C(=O)Nc1cccc(C#N)c1	ZINC000459306174	458323188	/nfs/dbraw/zinc/32/31/88/458323188.db2.gz	NGICRBIBFMSLEV-UHFFFAOYSA-N	0	3	328.441	3.215	20	30		EGEDHN
COc1cc(CN2CCNC[C@H]2c2cccc(Cl)c2)ccc1C#N	ZINC000414735162	458325327	/nfs/dbraw/zinc/32/53/27/458325327.db2.gz	LYNUWCBPPAKBNY-SFHVURJKSA-N	0	3	341.842	3.367	20	30		EGEDHN
C[C@H](C#N)CSc1ccccc1NC(=O)N1C[C@@H](C)NC[C@H]1C	ZINC000415152867	458328584	/nfs/dbraw/zinc/32/85/84/458328584.db2.gz	CGRZJNCCSOXZKK-MGPQQGTHSA-N	0	3	332.473	3.152	20	30		EGEDHN
CN(C)C1(CNC(=O)c2cccc(Nc3ccc(C#N)cc3)c2)CC1	ZINC000416301362	458341929	/nfs/dbraw/zinc/34/19/29/458341929.db2.gz	LHHYMGCFOVIDRU-UHFFFAOYSA-N	0	3	334.423	3.126	20	30		EGEDHN
CC(C)N1CC[C@@H](N(C)C(=O)N[C@H]2CCCc3cc(C#N)ccc32)C1	ZINC000419606483	458387187	/nfs/dbraw/zinc/38/71/87/458387187.db2.gz	FYLKOLXAGXEBRF-MJGOQNOKSA-N	0	3	340.471	3.060	20	30		EGEDHN
C=CCc1cc(CN2CCOC[C@@H](C3CCC3)C2)cc(OC)c1O	ZINC000430127348	458406878	/nfs/dbraw/zinc/40/68/78/458406878.db2.gz	WNSTWHXNUMCNAN-SFHVURJKSA-N	0	3	331.456	3.378	20	30		EGEDHN
C=CC(C)(C)C(=O)Nc1cccc(N2CCN(CC3CC3)CC2)c1	ZINC000448784243	458410903	/nfs/dbraw/zinc/41/09/03/458410903.db2.gz	APVWAAODLXGGIN-UHFFFAOYSA-N	0	3	327.472	3.369	20	30		EGEDHN
CN(C)CCN(Cc1ccc(F)cc1)Cc1ccc(C#N)c(F)c1	ZINC000421357852	458412028	/nfs/dbraw/zinc/41/20/28/458412028.db2.gz	RFNONUNAIZTFEY-UHFFFAOYSA-N	0	3	329.394	3.400	20	30		EGEDHN
CC1(C)Cc2cc(CN3CC[C@H](Oc4ccc(C#N)cn4)C3)ccc2O1	ZINC000430170658	458415441	/nfs/dbraw/zinc/41/54/41/458415441.db2.gz	QXNCZHYWYLGGAH-SFHVURJKSA-N	0	3	349.434	3.320	20	30		EGEDHN
C=CC(C)(C)C(=O)NCC1(N[C@H](C)c2ccccc2)CCOCC1	ZINC000448985999	458418355	/nfs/dbraw/zinc/41/83/55/458418355.db2.gz	XYEBDGATOSGMIK-MRXNPFEDSA-N	0	3	330.472	3.215	20	30		EGEDHN
CC(C)C[C@H]([NH2+]C1CCC(C)(C#N)CC1)c1nc(-c2nc[n-]n2)no1	ZINC000449202166	458422110	/nfs/dbraw/zinc/42/21/10/458422110.db2.gz	IBXKJEAPZLFQJV-JZLYGMAVSA-N	0	3	343.435	3.004	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCc1cnn(-c2ccc(Br)cc2)c1	ZINC000449517912	458425916	/nfs/dbraw/zinc/42/59/16/458425916.db2.gz	HVFLDFSSFDKFLH-CVEARBPZSA-N	0	3	348.244	3.068	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)NCC(C)(C)CCC#N	ZINC000376977377	458434078	/nfs/dbraw/zinc/43/40/78/458434078.db2.gz	YUVDJYKGFNEVQF-SJLPKXTDSA-N	0	3	342.487	3.136	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000449909201	458434490	/nfs/dbraw/zinc/43/44/90/458434490.db2.gz	YYHCYCAMOVLRLA-FFGOWVMKSA-N	0	3	342.483	3.089	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000449909203	458434534	/nfs/dbraw/zinc/43/45/34/458434534.db2.gz	YYHCYCAMOVLRLA-NBYUQASBSA-N	0	3	342.483	3.089	20	30		EGEDHN
CCCN(CCN1CCCC1)c1ncc(Br)cc1C#N	ZINC000450528950	458451313	/nfs/dbraw/zinc/45/13/13/458451313.db2.gz	LOYMZXXCCHODKY-UHFFFAOYSA-N	0	3	337.265	3.028	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@@H]1CNC(=O)c1ccc(CN(CC)C2CC2)cc1	ZINC000437519984	458461369	/nfs/dbraw/zinc/46/13/69/458461369.db2.gz	WYCIBUOPDBKRNY-UYAOXDASSA-N	0	3	342.483	3.382	20	30		EGEDHN
C[C@@H]1[C@@H](NC(=O)CCc2ccc(C#N)cc2)CCN1Cc1ccccc1	ZINC000377106468	458463476	/nfs/dbraw/zinc/46/34/76/458463476.db2.gz	SIOHFYPJBHICPW-UTKZUKDTSA-N	0	3	347.462	3.270	20	30		EGEDHN
CO[C@@H]1C[C@@H](N[C@H](C)C(=O)Nc2ccc(C#N)c(Cl)c2)C12CCC2	ZINC000459766866	458472760	/nfs/dbraw/zinc/47/27/60/458472760.db2.gz	PYIXMRVJKWNFMA-HFBAOOFYSA-N	0	3	347.846	3.086	20	30		EGEDHN
C[C@@H](N[C@@H](c1ccc(F)c(Cl)c1)C1CC1)C(=O)N(C)CCC#N	ZINC000451351134	458475067	/nfs/dbraw/zinc/47/50/67/458475067.db2.gz	FBHSFNWAXIAGMA-BDJLRTHQSA-N	0	3	337.826	3.280	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCC(=O)N[C@@H](C)c1ccc(Cl)cc1Cl	ZINC000451605870	458482356	/nfs/dbraw/zinc/48/23/56/458482356.db2.gz	KTSKKPTVPCCFKC-VQISRLSMSA-N	0	3	343.254	3.104	20	30		EGEDHN
CCCN(C)[C@H](CNC(=O)[C@]1(C#N)C[C@H]1C)c1ccc(Cl)cc1	ZINC000451655350	458484296	/nfs/dbraw/zinc/48/42/96/458484296.db2.gz	XRULJUOXBFKXPW-QBIMZIAESA-N	0	3	333.863	3.389	20	30		EGEDHN
CC(C#N)C(=O)N1CCC[C@H](Nc2cccc(Br)c2)C1	ZINC000468575910	458528135	/nfs/dbraw/zinc/52/81/35/458528135.db2.gz	OQMLSIMFPDDLNO-FZMZJTMJSA-N	0	3	336.233	3.012	20	30		EGEDHN
Cc1sc(NC(=O)[C@@H](N)CCCC#N)nc1-c1ccc(F)cc1	ZINC000424070310	458550608	/nfs/dbraw/zinc/55/06/08/458550608.db2.gz	AFIJOQCJDAYTSU-ZDUSSCGKSA-N	0	3	332.404	3.217	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N(Cc1ccccc1)Cc1ccccc1F	ZINC000424100712	458558052	/nfs/dbraw/zinc/55/80/52/458558052.db2.gz	XPPJNLXPTJQBLJ-LJQANCHMSA-N	0	3	339.414	3.376	20	30		EGEDHN
CC(C)Cc1ccc([C@@H](NC(=O)[C@H](N)CCCC#N)C2CC2)cc1	ZINC000424109739	458560949	/nfs/dbraw/zinc/56/09/49/458560949.db2.gz	BDQPDOVJSMCJGG-RTBURBONSA-N	0	3	327.472	3.474	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N[C@H]1CCOc2c(-c3ccccc3)cccc21	ZINC000424116176	458561730	/nfs/dbraw/zinc/56/17/30/458561730.db2.gz	XAOYFEJFBSLBNV-OALUTQOASA-N	0	3	349.434	3.315	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N[C@@H](Cc1ccccc1)c1ccccc1F	ZINC000424116483	458562363	/nfs/dbraw/zinc/56/23/63/458562363.db2.gz	BUAAUEQZJONLFN-MOPGFXCFSA-N	0	3	339.414	3.247	20	30		EGEDHN
C[C@@H](C#N)CSc1ccccc1NC(=O)N1C[C@@H]2CCN(C)[C@@H]2C1	ZINC000454749023	458573190	/nfs/dbraw/zinc/57/31/90/458573190.db2.gz	IVZLJSZPAPLDIU-OFQRWUPVSA-N	0	3	344.484	3.106	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1c(F)cccc1OC)C(C)C	ZINC000469500954	458577090	/nfs/dbraw/zinc/57/70/90/458577090.db2.gz	DCPOCTWNKOFAHT-MRXNPFEDSA-N	0	3	334.435	3.263	20	30		EGEDHN
CN(C(=O)[C@H](N)CCCC#N)c1ccc(OCc2ccccc2)cc1	ZINC000424194382	458581042	/nfs/dbraw/zinc/58/10/42/458581042.db2.gz	WJZLPWHDLXVNSV-LJQANCHMSA-N	0	3	337.423	3.250	20	30		EGEDHN
C[C@H](C(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1)c1cccc(C#N)c1	ZINC000462197860	458602823	/nfs/dbraw/zinc/60/28/23/458602823.db2.gz	HQIRFTISPOQJSM-LLGFUMIMSA-N	0	3	347.462	3.441	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1cccc(CC#N)c1	ZINC000455911623	458621957	/nfs/dbraw/zinc/62/19/57/458621957.db2.gz	WJQCXKDUQZVPDI-OXJNMPFZSA-N	0	3	348.450	3.395	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Nc1cccc(CC#N)c1	ZINC000455911625	458621993	/nfs/dbraw/zinc/62/19/93/458621993.db2.gz	WJQCXKDUQZVPDI-UZLBHIALSA-N	0	3	348.450	3.395	20	30		EGEDHN
Cc1cc(N(CCC#N)C(=O)CN[C@@]2(C)CCO[C@@H]2C)ccc1Cl	ZINC000494257520	458648963	/nfs/dbraw/zinc/64/89/63/458648963.db2.gz	RPVIICOIZUIDLT-KDOFPFPSSA-N	0	3	349.862	3.052	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)CCOCC1	ZINC000424604537	458678637	/nfs/dbraw/zinc/67/86/37/458678637.db2.gz	HHQXAKNGYQCGTR-HKUYNNGSSA-N	0	3	342.483	3.311	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CC(COc2ccccc2)C1	ZINC000494802467	458747095	/nfs/dbraw/zinc/74/70/95/458747095.db2.gz	ZUXAWFKJRBFYCW-IBGZPJMESA-N	0	3	334.419	3.296	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCc3cc(F)cc(C)c3C2)CC1	ZINC000507173694	458752694	/nfs/dbraw/zinc/75/26/94/458752694.db2.gz	ANFLKUOKZZACBG-UHFFFAOYSA-N	0	3	345.462	3.242	20	30		EGEDHN
C=CCn1c(-c2sccc2C)nnc1N1CCN(CC(C)C)CC1	ZINC000508497233	458760184	/nfs/dbraw/zinc/76/01/84/458760184.db2.gz	JZRONWKNRCQJIM-UHFFFAOYSA-N	0	3	345.516	3.279	20	30		EGEDHN
C=CCn1c(CC(C)(C)C)nnc1N1CC[C@@H](N2CCCCC2)C1	ZINC000508993378	458769061	/nfs/dbraw/zinc/76/90/61/458769061.db2.gz	COIKCVBIJIDFNC-MRXNPFEDSA-N	0	3	331.508	3.117	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCOc2ccccc2CC)CC1	ZINC000510314744	458774327	/nfs/dbraw/zinc/77/43/27/458774327.db2.gz	MFORASIKOQAECB-UHFFFAOYSA-N	0	3	330.472	3.175	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N[C@@H](C)[C@@H](c1ccccc1C)N(C)C)OCC	ZINC000510551135	458775115	/nfs/dbraw/zinc/77/51/15/458775115.db2.gz	OHNFWHZAZCXANA-QRFRQXIXSA-N	0	3	332.488	3.474	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1C(=O)N[C@H](C)[C@H](c1ccccc1C)N(C)C	ZINC000510516019	458775289	/nfs/dbraw/zinc/77/52/89/458775289.db2.gz	ZCIBSDDKBRADEP-NXWXRZEISA-N	0	3	330.472	3.084	20	30		EGEDHN
C=C(CNC(=O)N(CCN(C)C)Cc1ccccc1)c1ccccc1	ZINC000512667710	458786654	/nfs/dbraw/zinc/78/66/54/458786654.db2.gz	QYUOFRSJXPDKNK-UHFFFAOYSA-N	0	3	337.467	3.473	20	30		EGEDHN
Cc1ccccc1C[C@H]1CCCN1CC(=O)NCc1cccc(C#N)c1	ZINC000514189669	458798370	/nfs/dbraw/zinc/79/83/70/458798370.db2.gz	NASTUDGICKXFSG-OAQYLSRUSA-N	0	3	347.462	3.190	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN[C@@H]1CC[C@@H](c2ccccc2)C[C@@H]1OC	ZINC000515443351	458809398	/nfs/dbraw/zinc/80/93/98/458809398.db2.gz	HWYIECIIUBWJJF-AQNXPRMDSA-N	0	3	344.499	3.352	20	30		EGEDHN
N#CCSc1ccccc1NC(=O)CN(CC1CC1)CC1CC1	ZINC000440469243	458815102	/nfs/dbraw/zinc/81/51/02/458815102.db2.gz	KRBXECQQAHIULS-UHFFFAOYSA-N	0	3	329.469	3.363	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)[C@H](C)SCCN(C)Cc1ccccc1	ZINC000433018641	458826962	/nfs/dbraw/zinc/82/69/62/458826962.db2.gz	IIZIEZUUEDBMEZ-QFBILLFUSA-N	0	3	347.528	3.295	20	30		EGEDHN
N#CCC1(CNCCC(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000517556312	458829450	/nfs/dbraw/zinc/82/94/50/458829450.db2.gz	JKXNWRDGFLHXHP-UHFFFAOYSA-N	0	3	325.334	3.317	20	30		EGEDHN
COc1ccc(O[C@H](C)CNCc2ccc(C#N)c(OC)c2)cc1	ZINC000440823486	458858528	/nfs/dbraw/zinc/85/85/28/458858528.db2.gz	WBCNFIBPWBQRQA-CQSZACIVSA-N	0	3	326.396	3.133	20	30		EGEDHN
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NCC#Cc1ccc(F)cc1	ZINC000551418022	458888550	/nfs/dbraw/zinc/88/85/50/458888550.db2.gz	AGUYNWRBFZVXBJ-JXFKEZNVSA-N	0	3	339.410	3.187	20	30		EGEDHN
CC(C)NC(=O)OC[C@H]1CCCCN1Cc1ccc(CC#N)cc1	ZINC000495619633	458899734	/nfs/dbraw/zinc/89/97/34/458899734.db2.gz	POLJVJSPGWEWIA-GOSISDBHSA-N	0	3	329.444	3.242	20	30		EGEDHN
CC(C)NC(=O)OC[C@@H]1CCCCN1Cc1ccc(CC#N)cc1	ZINC000495619634	458899812	/nfs/dbraw/zinc/89/98/12/458899812.db2.gz	POLJVJSPGWEWIA-SFHVURJKSA-N	0	3	329.444	3.242	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@H](CCNC[C@H](C#N)CCC#N)C1	ZINC000495645690	458907691	/nfs/dbraw/zinc/90/76/91/458907691.db2.gz	UNCYRSJDSATVLX-CVEARBPZSA-N	0	3	334.464	3.057	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N1CCC[C@H](c2nc3ccccc3s2)C1	ZINC000519391525	458943054	/nfs/dbraw/zinc/94/30/54/458943054.db2.gz	DXKSCSHMIRXQAW-UONOGXRCSA-N	0	3	342.468	3.023	20	30		EGEDHN
C[C@]1(Cc2ccccc2)CCCN1CC(=O)NCc1ccc(C#N)cc1	ZINC000467235586	458960198	/nfs/dbraw/zinc/96/01/98/458960198.db2.gz	APMXLFAKQVAPTH-JOCHJYFZSA-N	0	3	347.462	3.272	20	30		EGEDHN
C=C(C)Cn1c([C@@H](C)CC)nnc1N1CCN(C2CCCC2)CC1	ZINC000577194791	458996280	/nfs/dbraw/zinc/99/62/80/458996280.db2.gz	OQMMCFMNSSYUJX-INIZCTEOSA-N	0	3	331.508	3.432	20	30		EGEDHN
C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NCC#Cc1ccc(F)cc1	ZINC000495949948	459016092	/nfs/dbraw/zinc/01/60/92/459016092.db2.gz	ZLVUXIDGLKUKQB-QAPCUYQASA-N	0	3	346.446	3.412	20	30		EGEDHN
C[C@@H](N[C@H](CN1CCN(C)CC1)c1ccccc1)c1ccc(C#N)cc1	ZINC000532022417	459019486	/nfs/dbraw/zinc/01/94/86/459019486.db2.gz	MGQSVUYAVAWZAD-XMSQKQJNSA-N	0	3	348.494	3.198	20	30		EGEDHN
CC(C)c1cc(NC(=O)[C@H](N)CCCC#N)n(Cc2ccccc2)n1	ZINC000594456957	459053384	/nfs/dbraw/zinc/05/33/84/459053384.db2.gz	TVAVKTJCUSWTDC-MRXNPFEDSA-N	0	3	339.443	3.014	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)Cc2ccc(OCC)cc2)CC1	ZINC000520693550	459084413	/nfs/dbraw/zinc/08/44/13/459084413.db2.gz	DFFQBCCBNJRCLR-UHFFFAOYSA-N	0	3	345.487	3.267	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1CCN([C@@H]2C[C@H]2C)C[C@H](C)C1	ZINC000558023832	459126503	/nfs/dbraw/zinc/12/65/03/459126503.db2.gz	FRBTWKYMWMPTLR-LZLYRXPVSA-N	0	3	328.456	3.054	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@H]1CCC[C@H](CNC[C@H](C#N)CCC#N)C1	ZINC000496329135	459152251	/nfs/dbraw/zinc/15/22/51/459152251.db2.gz	SIRBSLRTRXCHSF-HRCADAONSA-N	0	3	334.464	3.103	20	30		EGEDHN
CNC(=O)CCCN(Cc1ccc(C#N)cc1)Cc1cccc(F)c1	ZINC000590603006	459159262	/nfs/dbraw/zinc/15/92/62/459159262.db2.gz	KJSIFHTZQLHRGL-UHFFFAOYSA-N	0	3	339.414	3.226	20	30		EGEDHN
N#Cc1csc(CN[C@@H]2CCCC[C@H]2NC(=O)c2ccccc2)c1	ZINC000594995614	459210509	/nfs/dbraw/zinc/21/05/09/459210509.db2.gz	QSARIVHFWIQVAK-QZTJIDSGSA-N	0	3	339.464	3.451	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccc3[nH]c(C(F)F)nc3c2)nc(C)n1	ZINC000522103226	459215105	/nfs/dbraw/zinc/21/51/05/459215105.db2.gz	OMKBOHBGMMHMSF-LLVKDONJSA-N	0	3	341.321	3.397	20	30		EGEDHN
C[C@H](N[C@H]1CCC[C@H](S(C)(=O)=O)C1)c1ccc(C#N)cc1Cl	ZINC000578588194	459225088	/nfs/dbraw/zinc/22/50/88/459225088.db2.gz	WQKFOCPZYMJHEV-UBHSHLNASA-N	0	3	340.876	3.218	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Nc1cnc(C2CC2)nc1)C(C)C	ZINC000590827482	459236043	/nfs/dbraw/zinc/23/60/43/459236043.db2.gz	RWWRTCBEIHUCPJ-KRWDZBQOSA-N	0	3	343.475	3.174	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@H]1CCC[C@H]1NCc1ccc(C#N)c(F)c1	ZINC000496602837	459255558	/nfs/dbraw/zinc/25/55/58/459255558.db2.gz	ISRKGRQQXPOVNG-CVEARBPZSA-N	0	3	333.407	3.233	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN[C@@H](C)C1(c2ccccc2)CCCC1	ZINC000481825667	459277262	/nfs/dbraw/zinc/27/72/62/459277262.db2.gz	PULVOLWHSQXMTE-ROUUACIJSA-N	0	3	341.499	3.485	20	30		EGEDHN
C[C@@H]1CCN(C(=O)Nc2cccc(C#N)n2)CCN1Cc1ccccc1	ZINC000568509046	459299182	/nfs/dbraw/zinc/29/91/82/459299182.db2.gz	YBCNVNVSYXFQOC-MRXNPFEDSA-N	0	3	349.438	3.082	20	30		EGEDHN
CC(C)(C)[C@@H]1CCCN([C@@H]2CCN(c3ccc(C#N)cc3)C2=O)C1	ZINC000483243790	459352533	/nfs/dbraw/zinc/35/25/33/459352533.db2.gz	YKYIXOAEANSJTD-SJLPKXTDSA-N	0	3	325.456	3.422	20	30		EGEDHN
N#CC[C@@H]1CCCN(CCC(=O)N[C@@H]2CCCc3ccccc32)C1	ZINC000595612435	459367590	/nfs/dbraw/zinc/36/75/90/459367590.db2.gz	WQKSDEVHJCPIFO-QFBILLFUSA-N	0	3	325.456	3.196	20	30		EGEDHN
CC#CCCNC(=O)N1CC[C@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000483423528	459367742	/nfs/dbraw/zinc/36/77/42/459367742.db2.gz	ZLLAUEITAAOREW-OAQYLSRUSA-N	0	3	339.483	3.098	20	30		EGEDHN
N#CC[C@@H]1CCCN(C[C@@H](O)COc2cccc(C(F)(F)F)c2)C1	ZINC000595613779	459369123	/nfs/dbraw/zinc/36/91/23/459369123.db2.gz	HIZDXCLXTCTCNJ-DZGCQCFKSA-N	0	3	342.361	3.071	20	30		EGEDHN
N#CCc1ccc(NC(=O)N2CC[C@@H](N3CCCC3)C2)c(Cl)c1	ZINC000582469971	459370148	/nfs/dbraw/zinc/37/01/48/459370148.db2.gz	GKJUEPBZDYEPIP-CQSZACIVSA-N	0	3	332.835	3.108	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC(=O)N[C@H](C)c1cccc2ccccc21	ZINC000582468184	459370295	/nfs/dbraw/zinc/37/02/95/459370295.db2.gz	UYYXXGCIDNVXIX-YSGRDPCXSA-N	0	3	338.451	3.340	20	30		EGEDHN
C=CCN(CC=C)C(=O)NC[C@@H](C1CC1)N(C)Cc1ccccc1	ZINC000483691316	459384365	/nfs/dbraw/zinc/38/43/65/459384365.db2.gz	TWPZBYKVMJBPIY-IBGZPJMESA-N	0	3	327.472	3.281	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(c3ccc(F)cc3F)C2)cc1F	ZINC000591503733	459392791	/nfs/dbraw/zinc/39/27/91/459392791.db2.gz	PEAHDEJOCRBUEG-HNNXBMFYSA-N	0	3	331.341	3.344	20	30		EGEDHN
C[C@@H](Nc1ccc(C(F)(F)F)c(C#N)n1)[C@H](c1ccccc1)N(C)C	ZINC000569233764	459418343	/nfs/dbraw/zinc/41/83/43/459418343.db2.gz	AVYBGKHFWBYUMJ-SJKOYZFVSA-N	0	3	348.372	3.497	20	30		EGEDHN
COC(=O)Nc1cccc(CNCc2ccc(O[C@H](C)C#N)cc2)c1	ZINC000497074976	459428068	/nfs/dbraw/zinc/42/80/68/459428068.db2.gz	XANIGKTVPOQSHE-CQSZACIVSA-N	0	3	339.395	3.446	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Nc1ccnn1C(C)(C)C)C(C)C	ZINC000484749270	459429972	/nfs/dbraw/zinc/42/99/72/459429972.db2.gz	HPDXHANRHSPLCT-INIZCTEOSA-N	0	3	347.507	3.458	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@H]1[C@H]1CCCCC1=Nn1cnnc1	ZINC000497080941	459431211	/nfs/dbraw/zinc/43/12/11/459431211.db2.gz	UXVSYSLNLDBBBR-ZFWWWQNUSA-N	0	3	333.436	3.072	20	30		EGEDHN
Cc1ccc(OC[C@H](O)CNCc2ccc(C#N)c(Cl)c2)c(C)c1	ZINC000591765854	459431366	/nfs/dbraw/zinc/43/13/66/459431366.db2.gz	LNYGOHGNAMUPKR-QGZVFWFLSA-N	0	3	344.842	3.358	20	30		EGEDHN
N#CCC[C@@H](NC(=O)NC[C@@H]1NCCc2ccccc21)c1ccccc1	ZINC000582954102	459457245	/nfs/dbraw/zinc/45/72/45/459457245.db2.gz	SJDPAMNLAOLHTR-UXHICEINSA-N	0	3	348.450	3.218	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN2CCC[C@H](c3ccncc3)C2)c1	ZINC000583125158	459485994	/nfs/dbraw/zinc/48/59/94/459485994.db2.gz	OPVKSUKNPDGXMD-SFHVURJKSA-N	0	3	334.423	3.161	20	30		EGEDHN
Cc1ccc(Cl)c(OC[C@@H](O)CNCc2cccc(C#N)c2)c1	ZINC000583139117	459490240	/nfs/dbraw/zinc/49/02/40/459490240.db2.gz	WAMDWRODLUVIBD-INIZCTEOSA-N	0	3	330.815	3.050	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CNCC1(C(F)(F)F)CC1	ZINC000583139777	459490260	/nfs/dbraw/zinc/49/02/60/459490260.db2.gz	BKAFCQNGTTZLHQ-CQSZACIVSA-N	0	3	329.362	3.087	20	30		EGEDHN
CCC(CC)(CN[C@@H](C)C(=O)NC1(C#N)CCC1)c1ccc(F)cc1	ZINC000596047764	459501542	/nfs/dbraw/zinc/50/15/42/459501542.db2.gz	AGKOHMCQPQYZJP-HNNXBMFYSA-N	0	3	345.462	3.424	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@@H](N[C@H]3CCc4ccc(F)cc43)C2=O)cc1	ZINC000541881668	459504638	/nfs/dbraw/zinc/50/46/38/459504638.db2.gz	YKKGFOFOEHQMAJ-VQTJNVASSA-N	0	3	349.409	3.470	20	30		EGEDHN
N#CC1(NC(=O)CN[C@@H](c2ccc(Cl)cc2)C2CCC2)CCC1	ZINC000525893457	459513097	/nfs/dbraw/zinc/51/30/97/459513097.db2.gz	ISZUKMDZECXRIW-QGZVFWFLSA-N	0	3	331.847	3.333	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)N2CCC[C@H](CC#N)C2)N(C)C)cc1	ZINC000596093837	459516820	/nfs/dbraw/zinc/51/68/20/459516820.db2.gz	YDASRQSEGOJGDJ-MJGOQNOKSA-N	0	3	342.487	3.187	20	30		EGEDHN
CCc1nc(C#N)cc(N(C)[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)n1	ZINC000596132981	459531355	/nfs/dbraw/zinc/53/13/55/459531355.db2.gz	AALFPAUUGLWRKP-APWZRJJASA-N	0	3	349.482	3.400	20	30		EGEDHN
C=C(C)CN(Cc1ccc(CO)o1)C(=O)c1ccccc1CN(C)C	ZINC000487746331	459533203	/nfs/dbraw/zinc/53/32/03/459533203.db2.gz	CXTHQSJEIDSNFM-UHFFFAOYSA-N	0	3	342.439	3.052	20	30		EGEDHN
Cc1cc(CN2CCC(CN3CCCCC3=O)CC2)ccc1C#N	ZINC000488227634	459540854	/nfs/dbraw/zinc/54/08/54/459540854.db2.gz	DHXGSYAZNWSMSV-UHFFFAOYSA-N	0	3	325.456	3.091	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)c1ccc(C#N)s1	ZINC000488482237	459544363	/nfs/dbraw/zinc/54/43/63/459544363.db2.gz	FUZVKKMXQGJFGF-PBHICJAKSA-N	0	3	339.464	3.260	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)c1ccc(C#N)s1	ZINC000488482240	459544728	/nfs/dbraw/zinc/54/47/28/459544728.db2.gz	FUZVKKMXQGJFGF-YOEHRIQHSA-N	0	3	339.464	3.260	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](CC(F)(F)F)C(C)C)CC1	ZINC000526099824	459548627	/nfs/dbraw/zinc/54/86/27/459548627.db2.gz	VVFBOWXBZFXQIC-CQSZACIVSA-N	0	3	335.414	3.303	20	30		EGEDHN
C[C@@H](NCC(=O)NC1(C#N)CCC1)C(c1ccccc1)c1ccccc1	ZINC000526135870	459554958	/nfs/dbraw/zinc/55/49/58/459554958.db2.gz	MGKPYPKSPTWRED-QGZVFWFLSA-N	0	3	347.462	3.359	20	30		EGEDHN
N#CCc1ccc(OC[C@@H](O)CN[C@H]2CCCc3sccc32)cc1	ZINC000583689422	459581986	/nfs/dbraw/zinc/58/19/86/459581986.db2.gz	QBFMGDXVDYEBLR-YJBOKZPZSA-N	0	3	342.464	3.221	20	30		EGEDHN
N#CC(C(=O)c1cnc(C2CC2)nc1)c1ccc(C(F)(F)F)cn1	ZINC000583794745	459597884	/nfs/dbraw/zinc/59/78/84/459597884.db2.gz	SMTDBNKQGKQMHM-LBPRGKRZSA-N	0	3	332.285	3.258	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCc2ccc(OC(C)(C)C)cc2)CC1	ZINC000592508848	459618077	/nfs/dbraw/zinc/61/80/77/459618077.db2.gz	UKZDPKKEGQTGHG-UHFFFAOYSA-N	0	3	345.487	3.314	20	30		EGEDHN
C=CCN(CCc1ccco1)C[C@@H](O)COc1ccccc1Cl	ZINC000491424157	459626168	/nfs/dbraw/zinc/62/61/68/459626168.db2.gz	RSDZXOKBEFKFFL-OAHLLOKOSA-N	0	3	335.831	3.403	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)/C=C\c2ccccc2OCC)CC1	ZINC000491550473	459636038	/nfs/dbraw/zinc/63/60/38/459636038.db2.gz	ZPVUJIUHVRDJIP-KTKRTIGZSA-N	0	3	328.456	3.255	20	30		EGEDHN
N#CC1(NC(=O)CN[C@@H](Cc2ccccc2)c2ccccc2)CCC1	ZINC000527384883	459639576	/nfs/dbraw/zinc/63/95/76/459639576.db2.gz	RVRAYMHMWSMYQR-IBGZPJMESA-N	0	3	333.435	3.122	20	30		EGEDHN
C=CCN1CC[C@H](NC(C)(C)Cc2ccc(C(F)(F)F)cc2)C1=O	ZINC000499722617	459649797	/nfs/dbraw/zinc/64/97/97/459649797.db2.gz	YKYYAMWKFMFYLC-HNNXBMFYSA-N	0	3	340.389	3.403	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N(C)[C@H](C)c1cc2ccccc2o1	ZINC000491794897	459675623	/nfs/dbraw/zinc/67/56/23/459675623.db2.gz	TUQJOWCUUXIULT-OAHLLOKOSA-N	0	3	327.428	3.090	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1ccc([C@@H](C)C(F)(F)F)cc1	ZINC000491807493	459677433	/nfs/dbraw/zinc/67/74/33/459677433.db2.gz	BZKLCRRQBXPMOF-CYBMUJFWSA-N	0	3	326.362	3.037	20	30		EGEDHN
C/C=C(/C=C/C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1)CC	ZINC000492173533	459695251	/nfs/dbraw/zinc/69/52/51/459695251.db2.gz	ZCNNOKHHTPSWBW-CVFDFBFVSA-N	0	3	325.456	3.361	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)CCc2ccc(C#N)cc2)C1	ZINC000501231850	459718406	/nfs/dbraw/zinc/71/84/06/459718406.db2.gz	ZOIBNRCGNRKDJX-LAUBAEHRSA-N	0	3	347.462	3.443	20	30		EGEDHN
N#Cc1ccc([C@H](N[C@H]2CCC[C@H]2Cc2ccccc2)C(N)=O)cc1	ZINC000493494763	459747213	/nfs/dbraw/zinc/74/72/13/459747213.db2.gz	AJQIALSSDGRKFT-UFYCRDLUSA-N	0	3	333.435	3.086	20	30		EGEDHN
CN(C(=O)C(C[C@H]1CCCO1)C(F)(F)F)c1ccccc1C#N	ZINC000593095903	459772189	/nfs/dbraw/zinc/77/21/89/459772189.db2.gz	IUSOWFMTQMAIRR-OLZOCXBDSA-N	0	3	326.318	3.269	20	30		EGEDHN
CN(C[C@@H](O)CNc1ccc(Oc2cccc(C#N)c2)cc1)C1CC1	ZINC000566124139	459810298	/nfs/dbraw/zinc/81/02/98/459810298.db2.gz	DCSKXRSHMXTLCQ-SFHVURJKSA-N	0	3	337.423	3.218	20	30		EGEDHN
C[C@@H]1C[C@@H](c2ccccc2)CCN1Cc1cnc2c(C#N)cnn2c1	ZINC000584840284	459811585	/nfs/dbraw/zinc/81/15/85/459811585.db2.gz	VFIVEMQJGWHWKA-QAPCUYQASA-N	0	3	331.423	3.369	20	30		EGEDHN
N#Cc1cc(F)ccc1NC(=O)NC[C@H]1CCN1C1CCCCC1	ZINC000529008407	459820730	/nfs/dbraw/zinc/82/07/30/459820730.db2.gz	HHIIBPLPRACURO-MRXNPFEDSA-N	0	3	330.407	3.226	20	30		EGEDHN
CN(c1ccccc1)[C@@H]1CCN(C(=O)C(C#N)CCc2ccccc2)C1	ZINC000598378051	459883183	/nfs/dbraw/zinc/88/31/83/459883183.db2.gz	FHOJNCNVVXOYTI-PZJWPPBQSA-N	0	3	347.462	3.496	20	30		EGEDHN
Cc1ccnc(N2CCN(c3ccnc4ccccc43)CC2)c1C#N	ZINC000593477707	459900961	/nfs/dbraw/zinc/90/09/61/459900961.db2.gz	IEDSXBLRDIUTRD-UHFFFAOYSA-N	0	3	329.407	3.137	20	30		EGEDHN
Cc1cc(F)ccc1N(CC#N)C(=O)C1Oc2ccccc2O[C@H]1C	ZINC000602393720	459913565	/nfs/dbraw/zinc/91/35/65/459913565.db2.gz	HKYZIJMNICDNIH-UGSOOPFHSA-N	0	3	340.354	3.219	20	30		EGEDHN
CN(C)CCN(C(=O)c1cc2ccccc2n1CC#N)c1ccccc1	ZINC000609170606	459917556	/nfs/dbraw/zinc/91/75/56/459917556.db2.gz	WWJLYQPXFLNIHJ-UHFFFAOYSA-N	0	3	346.434	3.373	20	30		EGEDHN
COc1ccc([C@H](CNC(=O)CCCCCC#N)N2CCCC2)cc1	ZINC000588146970	459918662	/nfs/dbraw/zinc/91/86/62/459918662.db2.gz	UYQKCMHIMAQDLD-IBGZPJMESA-N	0	3	343.471	3.422	20	30		EGEDHN
COC[C@H](CC(C)(C)C)N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000593614867	459933505	/nfs/dbraw/zinc/93/35/05/459933505.db2.gz	XVLOJHQJCBJHTK-WMZOPIPTSA-N	0	3	343.471	3.094	20	30		EGEDHN
CN(Cc1ccc(Br)cc1)C[C@H](O)CC(C)(C)C#N	ZINC000598586196	459953514	/nfs/dbraw/zinc/95/35/14/459953514.db2.gz	FDQJPIZQRODVDN-CQSZACIVSA-N	0	3	325.250	3.182	20	30		EGEDHN
CC(C)n1cc(CNC2CCN(Cc3cccc(C#N)c3)CC2)cn1	ZINC000593692759	459953990	/nfs/dbraw/zinc/95/39/90/459953990.db2.gz	JNIQQFSYOFORBD-UHFFFAOYSA-N	0	3	337.471	3.090	20	30		EGEDHN
CN(Cc1ccc(Br)cc1)C[C@@H](O)CC(C)(C)C#N	ZINC000598586195	459953937	/nfs/dbraw/zinc/95/39/37/459953937.db2.gz	FDQJPIZQRODVDN-AWEZNQCLSA-N	0	3	325.250	3.182	20	30		EGEDHN
CC(C)(C)N(CC(=O)Nc1ccc(F)cc1)C[C@@H](O)CC(C)(C)C#N	ZINC000598597520	459957093	/nfs/dbraw/zinc/95/70/93/459957093.db2.gz	GFMRRTXXBHVSHH-INIZCTEOSA-N	0	3	349.450	3.165	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN1CCC(Oc2ccccc2Cl)CC1	ZINC000598596549	459957837	/nfs/dbraw/zinc/95/78/37/459957837.db2.gz	LAJMZFZLPVACQB-AWEZNQCLSA-N	0	3	336.863	3.484	20	30		EGEDHN
C[C@@H](c1ccncc1)N1CCC(NC(=O)CCCCCC#N)CC1	ZINC000588654219	459961123	/nfs/dbraw/zinc/96/11/23/459961123.db2.gz	JKZZOIXDFXNZHU-INIZCTEOSA-N	0	3	328.460	3.197	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN[C@](C)(CO)c1cc(Cl)cc(Cl)c1	ZINC000598620186	459964203	/nfs/dbraw/zinc/96/42/03/459964203.db2.gz	JGOZEMTXWUKMEY-GDBMZVCRSA-N	0	3	345.270	3.091	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN1CCC[C@@H]2O[C@H](c3ccccc3)C[C@@H]21	ZINC000598621690	459966777	/nfs/dbraw/zinc/96/67/77/459966777.db2.gz	BOUHWUVPSNXQNS-XWSJACJDSA-N	0	3	328.456	3.282	20	30		EGEDHN
Cc1ccccc1[C@H]([C@H](C)NC(=O)N1CCC[C@@](C)(C#N)C1)N(C)C	ZINC000588722070	459975659	/nfs/dbraw/zinc/97/56/59/459975659.db2.gz	SWSJBRJNBCRKEH-QRFRQXIXSA-N	0	3	342.487	3.322	20	30		EGEDHN
C[C@H](CC1(C#N)CCOCC1)NCc1ccc(OCC2CC2)nc1	ZINC000602531578	459984741	/nfs/dbraw/zinc/98/47/41/459984741.db2.gz	UWMBVWAZMKVBRS-OAHLLOKOSA-N	0	3	329.444	3.059	20	30		EGEDHN
N#Cc1cccc(CNCC2(c3cccc(Cl)c3)CCOCC2)n1	ZINC000602529923	459985604	/nfs/dbraw/zinc/98/56/04/459985604.db2.gz	PYOYQSFQJQOTHX-UHFFFAOYSA-N	0	3	341.842	3.445	20	30		EGEDHN
CN1CCC2(CCCN2C(=O)Nc2cc(C#N)cn2C(C)(C)C)CC1	ZINC000575735981	459992639	/nfs/dbraw/zinc/99/26/39/459992639.db2.gz	VXTPJUMHHIQYBA-UHFFFAOYSA-N	0	3	343.475	3.207	20	30		EGEDHN
CC(C#N)C(=O)N1CC2(CCCC2)c2cc3c(cc2[C@@H]1C)OCCO3	ZINC000609620021	459995873	/nfs/dbraw/zinc/99/58/73/459995873.db2.gz	ASPRQUVZRDQIKP-KBPBESRZSA-N	0	3	340.423	3.332	20	30		EGEDHN
C[C@H](Cc1ccccc1Br)NCc1cccc(C#N)n1	ZINC000602572331	460002660	/nfs/dbraw/zinc/00/26/60/460002660.db2.gz	YLKUKDXNOJKBSU-GFCCVEGCSA-N	0	3	330.229	3.437	20	30		EGEDHN
C[C@H](CC1(C#N)CCOCC1)N[C@H](C)c1ccc([S@@](C)=O)cc1	ZINC000602575149	460004522	/nfs/dbraw/zinc/00/45/22/460004522.db2.gz	CBDGJGWNANHKIO-GGOJBBCOSA-N	0	3	334.485	3.174	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CNCc1ccnc(OC2CCCCC2)c1	ZINC000598718904	460005334	/nfs/dbraw/zinc/00/53/34/460005334.db2.gz	DWEXFRBLPHJUHP-INIZCTEOSA-N	0	3	331.460	3.183	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccnn2CCc2ccccc2)nc(C)n1	ZINC000621706153	460014092	/nfs/dbraw/zinc/01/40/92/460014092.db2.gz	KSCZMNFVVBDNBV-KRWDZBQOSA-N	0	3	345.406	3.023	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)C(=O)N(CCN(C)C)C1CCCCC1	ZINC000593969250	460033940	/nfs/dbraw/zinc/03/39/40/460033940.db2.gz	ZJADXZJKAMILMJ-QGZVFWFLSA-N	0	3	341.499	3.460	20	30		EGEDHN
CC(C#N)C(=O)N(C)CCOc1ccc(OCc2ccccc2)cc1	ZINC000609921476	460040247	/nfs/dbraw/zinc/04/02/47/460040247.db2.gz	ACINBNLJLZREIU-INIZCTEOSA-N	0	3	338.407	3.262	20	30		EGEDHN
CC[C@@H](C)[C@H]1CN(CC2(CC#N)CC2)CCN1CC1(CC#N)CC1	ZINC000602802477	460135743	/nfs/dbraw/zinc/13/57/43/460135743.db2.gz	USKUOAUCGROPSE-QZTJIDSGSA-N	0	3	328.504	3.406	20	30		EGEDHN
CN(Cc1ccccc1)[C@H]1CCN(CCOc2cccc(C#N)c2)C1	ZINC000610433586	460150898	/nfs/dbraw/zinc/15/08/98/460150898.db2.gz	VIKQSQHNVASUEK-FQEVSTJZSA-N	0	3	335.451	3.143	20	30		EGEDHN
Cc1cc(N2CC[C@@H](Oc3ccc(C#N)cn3)C2)c2ccccc2n1	ZINC000589871342	460154267	/nfs/dbraw/zinc/15/42/67/460154267.db2.gz	XOJNSZVFLRLPHR-MRXNPFEDSA-N	0	3	330.391	3.468	20	30		EGEDHN
C[C@H](NCC[C@@H](O)COCc1ccccc1)c1ccc(C#N)cc1F	ZINC000599091128	460157444	/nfs/dbraw/zinc/15/74/44/460157444.db2.gz	XWFHEKZRFHHLFL-MAUKXSAKSA-N	0	3	342.414	3.316	20	30		EGEDHN
Cc1ncc(CNC(=O)CCN(C)[C@@H](C)c2cccc(C#N)c2)s1	ZINC000602846125	460157717	/nfs/dbraw/zinc/15/77/17/460157717.db2.gz	MSBANTBAZUGGDU-ZDUSSCGKSA-N	0	3	342.468	3.023	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)C(=O)N1CCCN(C(C)(C)C)CC1	ZINC000594258590	460175143	/nfs/dbraw/zinc/17/51/43/460175143.db2.gz	OTJIQAJVXVGZAU-MRXNPFEDSA-N	0	3	327.472	3.070	20	30		EGEDHN
CC(C)(C)N1CCCN(C(=O)N[C@@H]2CCc3cc(C#N)ccc32)CC1	ZINC000618845537	460194685	/nfs/dbraw/zinc/19/46/85/460194685.db2.gz	DOQUTYXPXLXFDW-GOSISDBHSA-N	0	3	340.471	3.061	20	30		EGEDHN
C[C@@H](CC(=O)N(CCN(C)C)Cc1cccc(C#N)c1)c1ccco1	ZINC000599197954	460197658	/nfs/dbraw/zinc/19/76/58/460197658.db2.gz	DPPYQBKFTIKNJM-INIZCTEOSA-N	0	3	339.439	3.235	20	30		EGEDHN
CC(C)[C@H](C(=O)N[C@H]1CCc2cc(C#N)ccc21)N1CCCCC1	ZINC000618892795	460211044	/nfs/dbraw/zinc/21/10/44/460211044.db2.gz	QGEWINGRNHAENA-RBUKOAKNSA-N	0	3	325.456	3.172	20	30		EGEDHN
N#CCCCC[C@H](N)C(=O)Nc1cccc(OCc2cccnc2)c1	ZINC000594441283	460220903	/nfs/dbraw/zinc/22/09/03/460220903.db2.gz	QKXRCZKUTSVNRI-SFHVURJKSA-N	0	3	338.411	3.010	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)NCCCc1c(Cl)cccc1Cl	ZINC000594448253	460223802	/nfs/dbraw/zinc/22/38/02/460223802.db2.gz	DAUOLRKLMZQVIW-CQSZACIVSA-N	0	3	328.243	3.063	20	30		EGEDHN
C[C@@H](CC(=O)NCCc1ccccc1)N[C@@H](C)c1cccc(C#N)c1	ZINC000610830493	460245209	/nfs/dbraw/zinc/24/52/09/460245209.db2.gz	XCSKOGISLUXLHF-IRXDYDNUSA-N	0	3	335.451	3.346	20	30		EGEDHN
C[C@H](N[C@@H](C)c1cccc(NS(C)(=O)=O)c1)c1cccc(C#N)c1	ZINC000610830414	460245314	/nfs/dbraw/zinc/24/53/14/460245314.db2.gz	RKAMBOMYYSFVAT-KBPBESRZSA-N	0	3	343.452	3.342	20	30		EGEDHN
C[C@@H](N[C@H](C)c1cccc(C#N)c1)c1ccc(NS(C)(=O)=O)cc1	ZINC000610829953	460245567	/nfs/dbraw/zinc/24/55/67/460245567.db2.gz	TVVFHEQJXLKLDQ-ZIAGYGMSSA-N	0	3	343.452	3.342	20	30		EGEDHN
CCN(Cc1ccc(CN(C)C)cc1)C(=O)Nc1ccnc(C#N)c1	ZINC000603133786	460250518	/nfs/dbraw/zinc/25/05/18/460250518.db2.gz	YSLLDXJDOPEICY-UHFFFAOYSA-N	0	3	337.427	3.069	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CCC(NC(=O)Nc2ccnc(C#N)c2)CC1	ZINC000603133353	460250696	/nfs/dbraw/zinc/25/06/96/460250696.db2.gz	YLALMNIUTUFQHL-HNNXBMFYSA-N	0	3	349.438	3.300	20	30		EGEDHN
C[C@H]1CN(CCc2ccc(C#N)cc2)CC[C@@H]1C(=O)OC(C)(C)C	ZINC000599585127	460281433	/nfs/dbraw/zinc/28/14/33/460281433.db2.gz	XGVAYAPXCXYHLA-YJBOKZPZSA-N	0	3	328.456	3.400	20	30		EGEDHN
CN(Cc1ccccc1)C[C@H](O)COc1cc(Cl)ccc1C#N	ZINC000611113056	460290174	/nfs/dbraw/zinc/29/01/74/460290174.db2.gz	FNNQYKMYZCYINU-KRWDZBQOSA-N	0	3	330.815	3.083	20	30		EGEDHN
Cc1nc(N(C)CCCN(C)Cc2ccncc2)c(Cl)cc1C#N	ZINC000603403109	460297681	/nfs/dbraw/zinc/29/76/81/460297681.db2.gz	URTLLUOKSSOECG-UHFFFAOYSA-N	0	3	343.862	3.268	20	30		EGEDHN
CC(C)(C)CN(CCO)Cc1cn(CCC#N)nc1-c1ccccc1	ZINC000611269727	460323247	/nfs/dbraw/zinc/32/32/47/460323247.db2.gz	VFBBZRCBPAHXNI-UHFFFAOYSA-N	0	3	340.471	3.304	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2N[C@H]1CCN(Cc2ccccc2)C1=O	ZINC000611393763	460353738	/nfs/dbraw/zinc/35/37/38/460353738.db2.gz	VULDIWFSBIULTL-SFTDATJTSA-N	0	3	345.446	3.326	20	30		EGEDHN
N#CCC[C@@H](NC[C@@H](O)COc1ccc(F)cc1)c1ccccc1	ZINC000611406931	460356862	/nfs/dbraw/zinc/35/68/62/460356862.db2.gz	CLKHUFPQMWKFRK-IEBWSBKVSA-N	0	3	328.387	3.200	20	30		EGEDHN
C=CCN(Cc1ccccc1F)C(=O)NCCN1CCC[C@@H](C)C1	ZINC000615672556	460370935	/nfs/dbraw/zinc/37/09/35/460370935.db2.gz	ZEGILSVFXBJRKV-MRXNPFEDSA-N	0	3	333.451	3.255	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN(C)C2(CO)CCC2)cc1OC	ZINC000628353355	460378841	/nfs/dbraw/zinc/37/88/41/460378841.db2.gz	SNDOSPBOBOYQML-UHFFFAOYSA-N	0	3	325.836	3.260	20	30		EGEDHN
N#CCC1CCN(C[C@H](O)COc2ccc(Cl)c(Cl)c2)CC1	ZINC000611687980	460428755	/nfs/dbraw/zinc/42/87/55/460428755.db2.gz	VBZWNJNBNHCQPJ-ZDUSSCGKSA-N	0	3	343.254	3.359	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccccc1CC#N	ZINC000601447108	460813111	/nfs/dbraw/zinc/81/31/11/460813111.db2.gz	HIZYMCMXAAHSED-UZLBHIALSA-N	0	3	333.435	3.003	20	30		EGEDHN
CN(Cc1ccccc1)[C@H](CNC(=O)c1ccccc1CC#N)C1CC1	ZINC000601465147	460816181	/nfs/dbraw/zinc/81/61/81/460816181.db2.gz	SMPAMDSGFDIIES-OAQYLSRUSA-N	0	3	347.462	3.393	20	30		EGEDHN
N#Cc1cc(F)cc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)c1	ZINC000601714186	460881566	/nfs/dbraw/zinc/88/15/66/460881566.db2.gz	SVYMEAIEYIAQGN-QWHCGFSZSA-N	0	3	330.281	3.383	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN(Cc1ccccn1)C(C)C	ZINC000613378621	460929143	/nfs/dbraw/zinc/92/91/43/460929143.db2.gz	HGSKCSVFFSAGLQ-FQEVSTJZSA-N	0	3	340.467	3.460	20	30		EGEDHN
CC#CC[C@@H](CO)NCc1ccc(OCc2cccs2)c(OC)c1	ZINC000641768560	461361333	/nfs/dbraw/zinc/36/13/33/461361333.db2.gz	CBJOOHUIDBTPSK-INIZCTEOSA-N	0	3	345.464	3.200	20	30		EGEDHN
C=CCN(C(=O)N[C@@H](CN)c1ccc2ccccc2c1)[C@H](C)COC	ZINC000659528896	461373117	/nfs/dbraw/zinc/37/31/17/461373117.db2.gz	YRURLLLZHDZLJT-BEFAXECRSA-N	0	3	341.455	3.072	20	30		EGEDHN
C=CCC1(CNC(=O)N2CCN(c3ccncc3)CC2)CCCC1	ZINC000653201874	461556133	/nfs/dbraw/zinc/55/61/33/461556133.db2.gz	XDWDMCSZPNFUHH-UHFFFAOYSA-N	0	3	328.460	3.050	20	30		EGEDHN
N#CC(C(=O)c1cccc2ccncc21)c1nnc2n1CCCCC2	ZINC000647195395	461557613	/nfs/dbraw/zinc/55/76/13/461557613.db2.gz	OJOQEMGBEVVTSH-HNNXBMFYSA-N	0	3	331.379	3.043	20	30		EGEDHN
C=CCC[C@@H](CO)NCc1cc(OC)c(Br)cc1F	ZINC000631154268	461594332	/nfs/dbraw/zinc/59/43/32/461594332.db2.gz	UBTGSQSPAAODNK-NSHDSACASA-N	0	3	332.213	3.014	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@]2(c3ccccc3)CC2(C)C)CC1	ZINC000664020395	461916581	/nfs/dbraw/zinc/91/65/81/461916581.db2.gz	SARILXYGIZMXIK-FQEVSTJZSA-N	0	3	327.472	3.261	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCc2ccc(Cl)c(Cl)c2)CC1	ZINC000660705292	461931774	/nfs/dbraw/zinc/93/17/74/461931774.db2.gz	UVYHDZIXKCVCAU-UHFFFAOYSA-N	0	3	342.270	3.443	20	30		EGEDHN
C=CCN(C(=O)NCC(C)(C)N[C@H](C)c1ccccc1)[C@H](C)COC	ZINC000664106700	461943767	/nfs/dbraw/zinc/94/37/67/461943767.db2.gz	BTDAZTSZBHNRMI-IAGOWNOFSA-N	0	3	347.503	3.348	20	30		EGEDHN
C=CCN(Cc1ccccc1)C(=O)N[C@H]1CCCN2CCCC[C@H]12	ZINC000654726586	462354639	/nfs/dbraw/zinc/35/46/39/462354639.db2.gz	WRZYCKIUBNFLFR-RBUKOAKNSA-N	0	3	327.472	3.401	20	30		EGEDHN
C[C@@H](CN(C)CCC(=O)Nc1ccccc1C#N)c1nccs1	ZINC000184013733	533739174	/nfs/dbraw/zinc/73/91/74/533739174.db2.gz	MQWWZVCMGVVNDN-ZDUSSCGKSA-N	0	3	328.441	3.079	20	30		EGEDHN
CCc1ccc(OCC(=O)C(C#N)c2nc3ccccc3n2C)cc1	ZINC000012564879	524005333	/nfs/dbraw/zinc/00/53/33/524005333.db2.gz	QSTWIYHSTDSFHM-MRXNPFEDSA-N	0	3	333.391	3.391	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](N[C@H]3CCCc4ccccc43)C2=O)cc1	ZINC000190616124	534782999	/nfs/dbraw/zinc/78/29/99/534782999.db2.gz	PLAAQQFNPGDTKN-LEWJYISDSA-N	0	3	345.446	3.326	20	30		EGEDHN
C=CCN(CCc1ccccc1)C(=O)NC1CCN(CC=C)CC1	ZINC000171737798	526309445	/nfs/dbraw/zinc/30/94/45/526309445.db2.gz	QEUZZGAJDLGZOC-UHFFFAOYSA-N	0	3	327.472	3.077	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@@H](C)N(C)C[C@@H]1CCCOC1	ZINC000174148533	526373335	/nfs/dbraw/zinc/37/33/35/526373335.db2.gz	HSHPSCAVBNHDIR-CVEARBPZSA-N	0	3	336.501	3.010	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H]2CCSc3c(F)cccc32)CC1	ZINC000171713719	526439852	/nfs/dbraw/zinc/43/98/52/526439852.db2.gz	DOWMIEWHTJAWNL-INIZCTEOSA-N	0	3	349.475	3.312	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc3ccccc3c(Cl)n2)CC1	ZINC000178668921	526446671	/nfs/dbraw/zinc/44/66/71/526446671.db2.gz	UIYPKEDOKUAUFP-UHFFFAOYSA-N	0	3	329.831	3.268	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(-c3cccs3)nc2C)CC1	ZINC000171722302	526447973	/nfs/dbraw/zinc/44/79/73/526447973.db2.gz	BYUHGEDFBQVAQZ-UHFFFAOYSA-N	0	3	341.480	3.499	20	30		EGEDHN
CN(C)Cc1cccc(NC(=O)c2ccn(-c3cccc(C#N)c3)n2)c1	ZINC000347899008	536040336	/nfs/dbraw/zinc/04/03/36/536040336.db2.gz	DOCIVVBFERYAQV-UHFFFAOYSA-N	0	3	345.406	3.058	20	30		EGEDHN
Cc1c(Cl)cccc1C(=O)C(C#N)c1nnc2n1CCCCC2	ZINC000193820076	547216504	/nfs/dbraw/zinc/21/65/04/547216504.db2.gz	PURLTIRFLSCVGY-ZDUSSCGKSA-N	0	3	328.803	3.456	20	30		EGEDHN
COc1ccc(NC(=O)NC(=O)CN2CCC[C@@H](C3CC3)C2)cc1	ZINC000329673845	547504458	/nfs/dbraw/zinc/50/44/58/547504458.db2.gz	VCKBVPMCWCGWGY-CQSZACIVSA-N	0	3	331.416	3.306	20	30		EGEDHN
C[C@@H](NC(=O)C1CCCCC1)C(=O)N1CCCN(C2CCCC2)CC1	ZINC000329689813	547504556	/nfs/dbraw/zinc/50/45/56/547504556.db2.gz	VWGFLTDUUVAKSZ-MRXNPFEDSA-N	0	3	349.519	3.389	20	30		EGEDHN
C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)c1ccc2c(c1)C(C)(C)C(=O)N2	ZINC000330212058	547515658	/nfs/dbraw/zinc/51/56/58/547515658.db2.gz	DJWFMONMJRDKMV-BZNIZROVSA-N	0	3	327.428	3.353	20	30		EGEDHN
C=CCC[C@@H](O)CN1CCC(c2c(OC)cc(OC)cc2OC)CC1	ZINC000675487305	548928210	/nfs/dbraw/zinc/92/82/10/548928210.db2.gz	HATWGDHPSAZEHX-MRXNPFEDSA-N	0	3	349.471	3.219	20	30		EGEDHN
CCC#C[C@@H](C)N(C)C[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000677479680	549277736	/nfs/dbraw/zinc/27/77/36/549277736.db2.gz	LOLQUQJGSXKKKT-ZIAGYGMSSA-N	0	3	329.362	3.179	20	30		EGEDHN
CCCCCCCCCN(C)C(=O)NC[C@@H]1CN2CCC[C@H]2CO1	ZINC000729504351	574866346	/nfs/dbraw/zinc/86/63/46/574866346.db2.gz	HREPRMHGMUGSFC-ZWKOTPCHSA-N	0	3	339.524	3.242	20	30		EGEDHN
C=C(C)CN1CCC(NC(=S)NC23CC4CC(CC(C4)C2)C3)CC1	ZINC000729942842	574897932	/nfs/dbraw/zinc/89/79/32/574897932.db2.gz	UUGSNJCWMRBPMN-UHFFFAOYSA-N	0	3	347.572	3.460	20	30		EGEDHN
C=CCN1CCC(NC(=S)Nc2ccc(OC)c(Cl)c2)CC1	ZINC000729943562	574897986	/nfs/dbraw/zinc/89/79/86/574897986.db2.gz	XMNRJODIKUVWBB-UHFFFAOYSA-N	0	3	339.892	3.285	20	30		EGEDHN
CC(C)(C)C(=O)NCCC(=O)C(C#N)c1nc2cc(F)ccc2s1	ZINC000730418783	574984628	/nfs/dbraw/zinc/98/46/28/574984628.db2.gz	ZVOVXXTYRBWUMI-LLVKDONJSA-N	0	3	347.415	3.164	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)CCc1nc2cc(Cl)ccc2s1	ZINC000730687547	575010491	/nfs/dbraw/zinc/01/04/91/575010491.db2.gz	OWQRJGUEGVOTOY-LLVKDONJSA-N	0	3	349.843	3.116	20	30		EGEDHN
C#Cc1cccc(NC(=S)N2C[C@@H](N(C)C)Cc3ccccc32)c1	ZINC000731489895	575076636	/nfs/dbraw/zinc/07/66/36/575076636.db2.gz	HWAOZEICPSYLET-SFHVURJKSA-N	0	3	335.476	3.358	20	30		EGEDHN
C#Cc1cccc(NC(=S)NC[C@H](C)N(C)Cc2ccccc2)c1	ZINC000731941190	575221104	/nfs/dbraw/zinc/22/11/04/575221104.db2.gz	OVSWTFGBSACXIG-INIZCTEOSA-N	0	3	337.492	3.475	20	30		EGEDHN
N#CC(C(=O)C[C@@H]1CCc2ccccc2C1)C(=O)NCc1ccccc1	ZINC000732593228	575278665	/nfs/dbraw/zinc/27/86/65/575278665.db2.gz	HSULQKGKLXZQDI-XLIONFOSSA-N	0	3	346.430	3.207	20	30		EGEDHN
CN(C)CCOc1ccc(C=NNc2cnnc3ccccc32)cc1	ZINC000733749846	575388172	/nfs/dbraw/zinc/38/81/72/575388172.db2.gz	BOJSAUYDJKNXHD-UHFFFAOYSA-N	0	3	335.411	3.016	20	30		EGEDHN
CCCCCCCCCC(=O)N1CCN([C@H]2CCCN(C)C2)CC1	ZINC000734454066	575490763	/nfs/dbraw/zinc/49/07/63/575490763.db2.gz	SHEYANGBAKGDLJ-IBGZPJMESA-N	0	3	337.552	3.366	20	30		EGEDHN
C=CC[C@H](NC(=O)NC[C@@H](C)N1CCC[C@@H](C)C1)c1ccncc1	ZINC000734658558	575532820	/nfs/dbraw/zinc/53/28/20/575532820.db2.gz	JJNWOMABWVLMHW-NUJGCVRESA-N	0	3	330.476	3.118	20	30		EGEDHN
C=CC[C@H](NC(=O)N[C@H](C)CN1CCC[C@@H](C)C1)c1ccncc1	ZINC000734661782	575533618	/nfs/dbraw/zinc/53/36/18/575533618.db2.gz	QJKYHGINCKYMHW-NUJGCVRESA-N	0	3	330.476	3.118	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)cn1	ZINC000737680856	576260828	/nfs/dbraw/zinc/26/08/28/576260828.db2.gz	YIYCJUJJBCRDJK-DYESRHJHSA-N	0	3	347.462	3.188	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1nc(C)n2ccccc12)C(C)C	ZINC000741215949	576667113	/nfs/dbraw/zinc/66/71/13/576667113.db2.gz	OGEWMIQJTCEGIE-SFHVURJKSA-N	0	3	340.471	3.071	20	30		EGEDHN
COc1ccc(CNC[C@@H](O)c2c(F)cccc2Cl)cc1C#N	ZINC000742372491	576775139	/nfs/dbraw/zinc/77/51/39/576775139.db2.gz	NMWBLTNWAYAJTQ-OAHLLOKOSA-N	0	3	334.778	3.183	20	30		EGEDHN
N#CC(C(=O)NC1CCCCC1)C(=O)[C@H]1C[C@]12CCc1ccccc12	ZINC000744027149	576819107	/nfs/dbraw/zinc/81/91/07/576819107.db2.gz	KEVLLVPFANWQSJ-CDXJDZJCSA-N	0	3	336.435	3.048	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1)C(=O)[C@H]1C[C@@]12CCc1ccccc12	ZINC000744028517	576819173	/nfs/dbraw/zinc/81/91/73/576819173.db2.gz	JCWVIUCPMTYIJP-YRISNDGFSA-N	0	3	330.387	3.238	20	30		EGEDHN
C[C@@H]1CN(CC(=O)C(C#N)c2nc3ccccc3s2)C[C@@H](C)S1	ZINC000744413028	576827751	/nfs/dbraw/zinc/82/77/51/576827751.db2.gz	MCMBGQCUAWFDKS-UPJWGTAASA-N	0	3	345.493	3.298	20	30		EGEDHN
C#CCN(Cc1ccc(F)cc1)C(=O)NC[C@@H](C)N1CCC[C@@H](C)C1	ZINC000744843326	576835457	/nfs/dbraw/zinc/83/54/57/576835457.db2.gz	HPZFEZGGUJJQQI-IAGOWNOFSA-N	0	3	345.462	3.091	20	30		EGEDHN
CC(C)(CCC#N)C[N@H+]1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1	ZINC000824152941	608856352	/nfs/dbraw/zinc/85/63/52/608856352.db2.gz	VDDOVXMCZZBNPD-UHFFFAOYSA-N	0	3	336.443	3.286	20	30		EGEDHN
CC(C)(CCC#N)C[N@@H+]1CC=C(c2ccc(-c3nnn[n-]3)cc2)CC1	ZINC000824152941	608856356	/nfs/dbraw/zinc/85/63/56/608856356.db2.gz	VDDOVXMCZZBNPD-UHFFFAOYSA-N	0	3	336.443	3.286	20	30		EGEDHN
CC(C)(CCC#N)C[N@H+]1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1	ZINC000824152941	608856359	/nfs/dbraw/zinc/85/63/59/608856359.db2.gz	VDDOVXMCZZBNPD-UHFFFAOYSA-N	0	3	336.443	3.286	20	30		EGEDHN
CC(C)(CCC#N)C[N@@H+]1CC=C(c2ccc(-c3nn[n-]n3)cc2)CC1	ZINC000824152941	608856362	/nfs/dbraw/zinc/85/63/62/608856362.db2.gz	VDDOVXMCZZBNPD-UHFFFAOYSA-N	0	3	336.443	3.286	20	30		EGEDHN
Cc1cc(Br)c(NC(=O)[C@@H](N)CCCC#N)cc1Cl	ZINC000691524441	1298134221	/nfs/dbraw/zinc/13/42/21/1298134221.db2.gz	BTLALVCGJJARTF-NSHDSACASA-N	0	3	344.640	3.371	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@H](C)CCc1ccccc1F	ZINC000076819047	1292444035	/nfs/dbraw/zinc/44/40/35/1292444035.db2.gz	SZPMWPZZURGMNS-GDBMZVCRSA-N	0	3	332.419	3.410	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@H](C)CCc1cccc(F)c1	ZINC000076818805	1292444323	/nfs/dbraw/zinc/44/43/23/1292444323.db2.gz	KPZMTTVDEQRWFK-PBHICJAKSA-N	0	3	332.419	3.410	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2cc(C#N)ccc2F)CN1Cc1ccccc1	ZINC000830009982	1292653276	/nfs/dbraw/zinc/65/32/76/1292653276.db2.gz	KDSUFBDDWYCQRC-PBHICJAKSA-N	0	3	337.398	3.090	20	30		EGEDHN
C=CCc1cc(CN2CCC(O)(C(F)(F)F)CC2)c(O)c(OC)c1	ZINC000089652142	1292774658	/nfs/dbraw/zinc/77/46/58/1292774658.db2.gz	ORWDXNMBORCRPK-UHFFFAOYSA-N	0	3	345.361	3.019	20	30		EGEDHN
COc1ccc(CCNC(=O)C(C#N)C(=O)CCCC(C)(C)C)cc1	ZINC000103640039	1293010623	/nfs/dbraw/zinc/01/06/23/1293010623.db2.gz	YAPLNIKDUDUAFW-KRWDZBQOSA-N	0	3	344.455	3.279	20	30		EGEDHN
CCO[C@@H]1CCC[C@H]1N[C@H](C)C(=O)N(CCC#N)c1ccc(C)cc1	ZINC000832569206	1293022896	/nfs/dbraw/zinc/02/28/96/1293022896.db2.gz	APULBKHSDXWQQX-BHIYHBOVSA-N	0	3	343.471	3.177	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ncoc2-c2cccs2)CC1	ZINC000107597055	1293070446	/nfs/dbraw/zinc/07/04/46/1293070446.db2.gz	BAHZACAUTRGEEY-UHFFFAOYSA-N	0	3	331.441	3.173	20	30		EGEDHN
CC[C@H](NCc1ccc(C#N)cn1)[C@H]1CCCN1C(=O)OC(C)(C)C	ZINC000834773600	1293145473	/nfs/dbraw/zinc/14/54/73/1293145473.db2.gz	HVEAHZUVQBRDKM-DLBZAZTESA-N	0	3	344.459	3.221	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)CO[C@@H]2CCCC[C@@H]2C)cc1	ZINC000113652915	1293153939	/nfs/dbraw/zinc/15/39/39/1293153939.db2.gz	MLXAECFQWSBDGH-POZUXBRTSA-N	0	3	342.439	3.492	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)Cc1cc(F)c(C)cc1F	ZINC000835057081	1293194939	/nfs/dbraw/zinc/19/49/39/1293194939.db2.gz	LDCINQNOYXRECW-AWEZNQCLSA-N	0	3	336.382	3.221	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)CO[C@@H](C)CC)cc1	ZINC000152323617	1293964345	/nfs/dbraw/zinc/96/43/45/1293964345.db2.gz	BGXZVNWSLGZDAS-YOEHRIQHSA-N	0	3	330.428	3.492	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)C(=O)Nc1ccccn1)c1ccc(F)cc1F	ZINC000152703663	1293982487	/nfs/dbraw/zinc/98/24/87/1293982487.db2.gz	FMKFWKIFMYHKQN-SMDDNHRTSA-N	0	3	343.333	3.201	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@](C)(NCc1ccc(C#N)cc1F)C1CC1	ZINC000156293131	1294136993	/nfs/dbraw/zinc/13/69/93/1294136993.db2.gz	UAILZVVHDTVZGM-LJQANCHMSA-N	0	3	347.434	3.480	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1)C(=O)c1cnc(-c2ccccc2)nc1	ZINC000159767187	1294246323	/nfs/dbraw/zinc/24/63/23/1294246323.db2.gz	CKPWNLZTODODOU-KRWDZBQOSA-N	0	3	342.358	3.105	20	30		EGEDHN
Cc1cn2c(CNCc3ccc(OCC#N)cc3)c(C)nc2s1	ZINC000171769411	1294416922	/nfs/dbraw/zinc/41/69/22/1294416922.db2.gz	RUCSWXWDYKHVNW-UHFFFAOYSA-N	0	3	326.425	3.205	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)CCC(F)(F)F)cc1Cl	ZINC000173980511	1294475373	/nfs/dbraw/zinc/47/53/73/1294475373.db2.gz	DHVUTQCNMBRUCK-VIFPVBQESA-N	0	3	348.708	3.338	20	30		EGEDHN
CC[C@@H](NC(C)=O)C(=O)C(C#N)c1nc2cc(Cl)ccc2s1	ZINC000870161091	1295710964	/nfs/dbraw/zinc/71/09/64/1295710964.db2.gz	WXDKMGOZBWZRBP-GHMZBOCLSA-N	0	3	335.816	3.041	20	30		EGEDHN
C[C@H](CCc1ccc(F)cc1)C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000870162503	1295712668	/nfs/dbraw/zinc/71/26/68/1295712668.db2.gz	IVOBSVRNTFTXNV-CZUORRHYSA-N	0	3	339.370	3.137	20	30		EGEDHN
N#CC(C(=O)Cc1c(F)cccc1Cl)C(=O)NCc1ccccc1	ZINC000193406020	1295863794	/nfs/dbraw/zinc/86/37/94/1295863794.db2.gz	GRIHKPPRPPABNE-CQSZACIVSA-N	0	3	344.773	3.047	20	30		EGEDHN
CCO[C@@H]1C[C@H]1C(=O)C(C#N)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000193482116	1295875628	/nfs/dbraw/zinc/87/56/28/1295875628.db2.gz	XGSSOMZOYOMXGV-JHJVBQTASA-N	0	3	341.194	3.066	20	30		EGEDHN
N#CC(C(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)c1cccnc1	ZINC000193480386	1295874606	/nfs/dbraw/zinc/87/46/06/1295874606.db2.gz	ODXOVZMLAFDSEG-CYBMUJFWSA-N	0	3	334.162	3.350	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)CC[C@@H]2CC[C@@H](C)O2)cc1	ZINC000246468714	1296356007	/nfs/dbraw/zinc/35/60/07/1296356007.db2.gz	ASPOIJXVXLYAFR-XOKHGSTOSA-N	0	3	328.412	3.244	20	30		EGEDHN
N#CC(C(=O)NC1CCCCC1)C(=O)[C@H]1C[C@@H]1c1c(F)cccc1F	ZINC000247010076	1296380584	/nfs/dbraw/zinc/38/05/84/1296380584.db2.gz	MHQAZSZFZMZVDR-IHRRRGAJSA-N	0	3	346.377	3.226	20	30		EGEDHN
CCCc1nc(CON=Cc2ccc(N3CCOCC3)cc2)cs1	ZINC000254965508	1296482946	/nfs/dbraw/zinc/48/29/46/1296482946.db2.gz	OCODJDFFGDOPQC-UHFFFAOYSA-N	0	3	345.468	3.483	20	30		EGEDHN
Cc1nn(C)c2nc(Cl)cc(N=NC3CCCN4CCCC[C@H]34)c12	ZINC000872422287	1296952899	/nfs/dbraw/zinc/95/28/99/1296952899.db2.gz	KHWBXFBXKZJSQI-CQSZACIVSA-N	0	3	346.866	3.346	20	30		EGEDHN
C[C@@H]1CCN(Cc2ccccc2)C[C@H]1NC(=O)Cc1ccc(C#N)cc1	ZINC000716273159	1298295590	/nfs/dbraw/zinc/29/55/90/1298295590.db2.gz	UJKVPJBNGCEHLS-DYESRHJHSA-N	0	3	347.462	3.128	20	30		EGEDHN
CCc1cccc(CC)c1NC(=O)C(C#N)C(=O)CCCCOC	ZINC000747018673	1298711087	/nfs/dbraw/zinc/71/10/87/1298711087.db2.gz	SFPCYHUZLIJTFO-INIZCTEOSA-N	0	3	330.428	3.275	20	30		EGEDHN
CCCCCCNC(=O)[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC000748320495	1298983632	/nfs/dbraw/zinc/98/36/32/1298983632.db2.gz	WYVFXOCGBLGLQR-LJQANCHMSA-N	0	3	327.472	3.467	20	30		EGEDHN
CC(C)N1CCN(c2ccc(C(=O)OCCCCC#N)cc2)CC1	ZINC000749282896	1299185710	/nfs/dbraw/zinc/18/57/10/1299185710.db2.gz	JPXBWEVPSBKTMB-UHFFFAOYSA-N	0	3	329.444	3.068	20	30		EGEDHN
CC(=O)[C@](C#N)(CCN1CCC([C@@H]2CCOC2)CC1)c1ccccc1	ZINC000878403155	1299976288	/nfs/dbraw/zinc/97/62/88/1299976288.db2.gz	VTPSOBHHXUSQHO-TZIWHRDSSA-N	0	3	340.467	3.176	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=S)Nc2ccc(C#N)c(Cl)c2)CN1C1CC1	ZINC000753958828	1300053040	/nfs/dbraw/zinc/05/30/40/1300053040.db2.gz	AOXRPKOTPYLPTE-MFKMUULPSA-N	0	3	334.876	3.123	20	30		EGEDHN
CC(=O)[C@](C#N)(CCN1CCCC[C@H]1C[C@@H](C)O)c1ccccc1	ZINC000878532611	1300054725	/nfs/dbraw/zinc/05/47/25/1300054725.db2.gz	UQZLTWHFPQHOGH-LSTHTHJFSA-N	0	3	328.456	3.052	20	30		EGEDHN
COc1ccc(C#N)cc1COC(=O)C(C)(C)N(C)C1CCCC1	ZINC000754871178	1300235926	/nfs/dbraw/zinc/23/59/26/1300235926.db2.gz	ZZNSEVHPOSGLMO-UHFFFAOYSA-N	0	3	330.428	3.263	20	30		EGEDHN
COCCC1CCN(CC[C@](C#N)(C(C)=O)c2ccccc2)CC1	ZINC000879030212	1300329779	/nfs/dbraw/zinc/32/97/79/1300329779.db2.gz	GGOQUKIZMRHVBH-FQEVSTJZSA-N	0	3	328.456	3.176	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)Cc3ccc4c(c3)COC4)nc21	ZINC000755695292	1300379283	/nfs/dbraw/zinc/37/92/83/1300379283.db2.gz	GRLAPTLAGNXMIK-MRXNPFEDSA-N	0	3	331.375	3.321	20	30		EGEDHN
COc1ccc([C@H]2CN(Cc3ccc(C#N)cc3Cl)CCN2)cc1	ZINC000879520561	1300577723	/nfs/dbraw/zinc/57/77/23/1300577723.db2.gz	BQWKMHNLNDVXMB-LJQANCHMSA-N	0	3	341.842	3.367	20	30		EGEDHN
C#CC[C@@H](NC(=O)N(CCN(C)C)C1CCCC1)c1ccccc1	ZINC000757765061	1300726525	/nfs/dbraw/zinc/72/65/25/1300726525.db2.gz	ZTQSHJMUJDZUDT-LJQANCHMSA-N	0	3	327.472	3.267	20	30		EGEDHN
C=CC[C@@H](NC(=O)N(CCN(C)C)C1CCCC1)c1ccncc1	ZINC000758781508	1300955065	/nfs/dbraw/zinc/95/50/65/1300955065.db2.gz	XGOMUZZIHSHGGN-GOSISDBHSA-N	0	3	330.476	3.215	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cccc(O[C@@H](C)CC)n2)CC1	ZINC000880895147	1301319165	/nfs/dbraw/zinc/31/91/65/1301319165.db2.gz	UXJIYCTVPQPDRX-AWEZNQCLSA-N	0	3	332.448	3.031	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)[C@@H]2C[C@@]23CCOC3)cc1	ZINC000764762181	1302129520	/nfs/dbraw/zinc/12/95/20/1302129520.db2.gz	RKOXFHCSYRDBDR-FUHIMQAGSA-N	0	3	340.423	3.103	20	30		EGEDHN
C#CCOc1ccccc1CNC[C@](C)(O)c1cccc(Cl)c1	ZINC000764978386	1302180388	/nfs/dbraw/zinc/18/03/88/1302180388.db2.gz	IEVSXVPHXRFNHJ-IBGZPJMESA-N	0	3	329.827	3.349	20	30		EGEDHN
C#CC[C@H](CO)NCc1cc(Cl)c(OCCC)c(OCC)c1	ZINC000883123331	1302260516	/nfs/dbraw/zinc/26/05/16/1302260516.db2.gz	UTMXOAMBIXFNGL-CQSZACIVSA-N	0	3	325.836	3.001	20	30		EGEDHN
C#CC[C@@H](CO)NCc1ccc(OCc2ccccc2)c(OCC)c1	ZINC000883122884	1302261199	/nfs/dbraw/zinc/26/11/99/1302261199.db2.gz	CWKKUXUTECCIQA-IBGZPJMESA-N	0	3	339.435	3.138	20	30		EGEDHN
C=C(C)COc1cc(CN[C@@H]2CCCC23OCCO3)ccc1OC	ZINC000883179704	1302289448	/nfs/dbraw/zinc/28/94/48/1302289448.db2.gz	GPABZLLMPYSMGY-GOSISDBHSA-N	0	3	333.428	3.035	20	30		EGEDHN
C#CCCC[N@@H+](C)Cc1cccc([N-]S(=O)(=O)c2ccccc2)c1	ZINC000766894499	1302540843	/nfs/dbraw/zinc/54/08/43/1302540843.db2.gz	GBORMAMRZAHERR-UHFFFAOYSA-N	0	3	342.464	3.333	20	30		EGEDHN
C#CCCC[N@H+](C)Cc1cccc([N-]S(=O)(=O)c2ccccc2)c1	ZINC000766894499	1302540855	/nfs/dbraw/zinc/54/08/55/1302540855.db2.gz	GBORMAMRZAHERR-UHFFFAOYSA-N	0	3	342.464	3.333	20	30		EGEDHN
Cc1cccc(C)c1[C@H]1CCCN1C(=O)C1CC2(C1)CNC[C@@H]2C#N	ZINC000884398034	1302841925	/nfs/dbraw/zinc/84/19/25/1302841925.db2.gz	UMHPAWRRXWITCJ-UISNHOIMSA-N	0	3	337.467	3.106	20	30		EGEDHN
C#CC[C@H](NC[C@H](O)COc1ccc(OCC)cc1)c1ccccc1	ZINC000775397738	1303956384	/nfs/dbraw/zinc/95/63/84/1303956384.db2.gz	ATRZHHRZUJMIRU-RXVVDRJESA-N	0	3	339.435	3.179	20	30		EGEDHN
C#C[C@H](NCc1ccc(OCc2ccccc2)cc1O)[C@H]1CCCO1	ZINC000775998191	1304077200	/nfs/dbraw/zinc/07/72/00/1304077200.db2.gz	DTBZVLDYANQFRV-PZJWPPBQSA-N	0	3	337.419	3.242	20	30		EGEDHN
C#C[C@H]([NH2+]Cc1ccc(OCc2ccccc2)cc1[O-])[C@H]1CCCO1	ZINC000775998191	1304077202	/nfs/dbraw/zinc/07/72/02/1304077202.db2.gz	DTBZVLDYANQFRV-PZJWPPBQSA-N	0	3	337.419	3.242	20	30		EGEDHN
Cc1ccc(NC(=S)NN=Cc2cnccc2N(C)C)c(C)c1	ZINC000776183614	1304108656	/nfs/dbraw/zinc/10/86/56/1304108656.db2.gz	OTASSHDRRJDFKP-UHFFFAOYSA-N	0	3	327.457	3.085	20	30		EGEDHN
CN(C)Cc1ccc(-c2noc(Cc3ccccc3CC#N)n2)cc1	ZINC000776801216	1304200869	/nfs/dbraw/zinc/20/08/69/1304200869.db2.gz	RGORBRVYYUCCAD-UHFFFAOYSA-N	0	3	332.407	3.455	20	30		EGEDHN
CN1CCC(N(Cc2ccccc2)C(=O)Nc2ccc(C#N)cn2)CC1	ZINC000889228417	1304420078	/nfs/dbraw/zinc/42/00/78/1304420078.db2.gz	POOQDIZJYUMAMT-UHFFFAOYSA-N	0	3	349.438	3.082	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)c2cc(C)nc(Cl)c2)c1	ZINC000778605527	1304472771	/nfs/dbraw/zinc/47/27/71/1304472771.db2.gz	RHVXAEOVEOPZHH-AWEZNQCLSA-N	0	3	343.770	3.013	20	30		EGEDHN
C#CCCCCCC(=O)Nc1ccc(N2CCN(CC)CC2)cc1	ZINC000779742830	1304599160	/nfs/dbraw/zinc/59/91/60/1304599160.db2.gz	SNCBYDFCLKBESY-UHFFFAOYSA-N	0	3	327.472	3.351	20	30		EGEDHN
CC[C@H](C#N)OC(=O)C1CCN(c2cc(Cl)ccc2Cl)C1=O	ZINC000781167726	1304782374	/nfs/dbraw/zinc/78/23/74/1304782374.db2.gz	RJSYDXQIEJNXFT-MNOVXSKESA-N	0	3	341.194	3.192	20	30		EGEDHN
C=C(C)CCN1CC[C@H](C)[C@H](NC(=O)c2scnc2Cl)C1	ZINC000968651044	1335996413	/nfs/dbraw/zinc/99/64/13/1335996413.db2.gz	COAFSRIRCNECDB-NWDGAFQWSA-N	0	3	327.881	3.203	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)CCCc1ccsc1	ZINC000783353685	1305083164	/nfs/dbraw/zinc/08/31/64/1305083164.db2.gz	YLMWAVRIFAWBGX-AWEZNQCLSA-N	0	3	342.420	3.427	20	30		EGEDHN
C=CCS(=O)(=O)CCN[C@@H](Cc1ccccc1)c1ccccc1	ZINC000783530535	1305104020	/nfs/dbraw/zinc/10/40/20/1305104020.db2.gz	AYZZYRBEFPACJX-IBGZPJMESA-N	0	3	329.465	3.161	20	30		EGEDHN
CC[C@@H](NC(=O)C(C#N)C(=O)CCc1nccs1)c1ccccc1	ZINC000787040481	1305681875	/nfs/dbraw/zinc/68/18/75/1305681875.db2.gz	LRGMUYLXPCANAC-LSDHHAIUSA-N	0	3	341.436	3.052	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)CCC(F)(F)F)c1ccccc1	ZINC000787039410	1305682004	/nfs/dbraw/zinc/68/20/04/1305682004.db2.gz	RVIIJARHLYLIER-OLZOCXBDSA-N	0	3	326.318	3.305	20	30		EGEDHN
CC(C)(C)OCCCCON=Cc1ccc(N2CCOCC2)cc1	ZINC000788783877	1306016109	/nfs/dbraw/zinc/01/61/09/1306016109.db2.gz	JBJQJIORHAXMFT-UHFFFAOYSA-N	0	3	334.460	3.469	20	30		EGEDHN
C#C[C@H](CCC)NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1	ZINC000791060054	1308919358	/nfs/dbraw/zinc/91/93/58/1308919358.db2.gz	YHQCAFQISUZFMA-PKOBYXMFSA-N	0	3	327.472	3.094	20	30		EGEDHN
CC(C)[C@H](CNCc1cc(C#N)cs1)ONC(=O)OC(C)(C)C	ZINC000895026017	1309162208	/nfs/dbraw/zinc/16/22/08/1309162208.db2.gz	MUDQDAIIDCLVGC-AWEZNQCLSA-N	0	3	339.461	3.190	20	30		EGEDHN
CC(=O)N[C@H](CC1CCC1)C(=O)C(C#N)c1ncc(C(C)(C)C)s1	ZINC000797566986	1310212054	/nfs/dbraw/zinc/21/20/54/1310212054.db2.gz	CGDMMWNKHSBCCY-UONOGXRCSA-N	0	3	347.484	3.312	20	30		EGEDHN
N#Cc1ccc(NCCNCc2ccc(C(F)(F)F)s2)nc1	ZINC000897396069	1310318387	/nfs/dbraw/zinc/31/83/87/1310318387.db2.gz	GGXCXGUENLRMDB-UHFFFAOYSA-N	0	3	326.347	3.235	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](CN(C)Cc3scnc3C)C2)CC1	ZINC000897478761	1310347842	/nfs/dbraw/zinc/34/78/42/1310347842.db2.gz	FDFPJZXVXGRVMN-MRXNPFEDSA-N	0	3	347.528	3.478	20	30		EGEDHN
C=CCOc1cccc(CN2CCC[C@@H](Cc3nc(C)no3)C2)c1	ZINC000897578912	1310392953	/nfs/dbraw/zinc/39/29/53/1310392953.db2.gz	JVLYBBQXYBJRNN-KRWDZBQOSA-N	0	3	327.428	3.398	20	30		EGEDHN
CCN1CCN(c2ccc(NC(=O)c3cc(C#N)ccc3C)cc2)CC1	ZINC000929395621	1328587752	/nfs/dbraw/zinc/58/77/52/1328587752.db2.gz	IKSRBFZFFPYTEL-UHFFFAOYSA-N	0	3	348.450	3.261	20	30		EGEDHN
CCc1ccc(C(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)s1	ZINC001019104730	1317046996	/nfs/dbraw/zinc/04/69/96/1317046996.db2.gz	FPFYSCLMDCZBTD-LBPRGKRZSA-N	0	3	345.493	3.248	20	30		EGEDHN
CC(C)c1ccoc1C(=O)N1CC[C@H](NCc2ccc(C#N)s2)C1	ZINC001019279450	1317143528	/nfs/dbraw/zinc/14/35/28/1317143528.db2.gz	CDRRMSAQAXAYPS-ZDUSSCGKSA-N	0	3	343.452	3.340	20	30		EGEDHN
C#CCCCNC(=O)NC[C@H](c1ccc(CC(C)C)cc1)N(C)C	ZINC000806877582	1317534312	/nfs/dbraw/zinc/53/43/12/1317534312.db2.gz	BBHIQGLADWOMQM-LJQANCHMSA-N	0	3	329.488	3.200	20	30		EGEDHN
C=C(Cl)CNC(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000807589805	1317573348	/nfs/dbraw/zinc/57/33/48/1317573348.db2.gz	YFBKRQYAWKYWIC-INIZCTEOSA-N	0	3	339.867	3.128	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2nc(C(C)(C)C)cs2)C1	ZINC001020259489	1317612918	/nfs/dbraw/zinc/61/29/18/1317612918.db2.gz	DRCXRWCGEKAYAC-XYPYZODXSA-N	0	3	327.881	3.044	20	30		EGEDHN
CC[C@@H](N[C@@H]1CCN(c2ccccc2OC)C1=O)c1cccc(C#N)c1	ZINC000902879434	1317626418	/nfs/dbraw/zinc/62/64/18/1317626418.db2.gz	VKNASSNPAQQELM-QZTJIDSGSA-N	0	3	349.434	3.413	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)[C@@]2(C)CCC[C@@H]2CC)C1	ZINC001020295138	1317631543	/nfs/dbraw/zinc/63/15/43/1317631543.db2.gz	MGHKBNKEZKVXTB-YXWQFLTLSA-N	0	3	343.309	3.348	20	30		EGEDHN
C#C[C@@H](NC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C)C(C)(C)C	ZINC000808313677	1317659782	/nfs/dbraw/zinc/65/97/82/1317659782.db2.gz	ZTGLTEYVJGUFCW-PKOBYXMFSA-N	0	3	341.499	3.340	20	30		EGEDHN
C#C[C@H](NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C)C(C)(C)C	ZINC000808313676	1317660195	/nfs/dbraw/zinc/66/01/95/1317660195.db2.gz	ZTGLTEYVJGUFCW-MJGOQNOKSA-N	0	3	341.499	3.340	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2coc3ccc(OC)cc23)C1	ZINC001020379734	1317670351	/nfs/dbraw/zinc/67/03/51/1317670351.db2.gz	GSVZSTSHPDXVNJ-HAQNSBGRSA-N	0	3	334.803	3.044	20	30		EGEDHN
C[C@H]1CCCC[C@@H]1C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001020526162	1317745898	/nfs/dbraw/zinc/74/58/98/1317745898.db2.gz	SNSQTFSMLQKESA-MGHWNKPDSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)CC2CCCCCC2)C1	ZINC001020638388	1317821513	/nfs/dbraw/zinc/82/15/13/1317821513.db2.gz	QDLZFAGHGYMCJV-SHTZXODSSA-N	0	3	343.309	3.492	20	30		EGEDHN
CCCCOc1ccc(/C=C2\C(=O)c3ncnn3C2C)cc1OC	ZINC000905080916	1317921053	/nfs/dbraw/zinc/92/10/53/1317921053.db2.gz	OFOBKHVPMDSBJC-OJLMPMFISA-N	0	3	327.384	3.307	20	30		EGEDHN
CCCOc1c(/C=C2/C(=O)c3ncnn3C2C)cccc1OCC	ZINC000905081938	1317922312	/nfs/dbraw/zinc/92/23/12/1317922312.db2.gz	UTTJQPPNEIRQKE-LQELWAHVSA-N	0	3	327.384	3.307	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)C[C@H]2CCCc3ccccc32)C1	ZINC001020956205	1318013628	/nfs/dbraw/zinc/01/36/28/1318013628.db2.gz	DNCCMXVJKOGDFS-BRWVUGGUSA-N	0	3	332.875	3.486	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)cc1	ZINC001020972345	1318024057	/nfs/dbraw/zinc/02/40/57/1318024057.db2.gz	QDLMHNVROVQFEI-IYARVYRRSA-N	0	3	337.398	3.056	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc(F)c(F)cc2Cl)C1	ZINC001021007092	1318042066	/nfs/dbraw/zinc/04/20/66/1318042066.db2.gz	CKQHTWOFIWKXEG-KYZUINATSA-N	0	3	335.181	3.221	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)c2ccc(C3CC3)cc2)C1	ZINC001021078953	1318070489	/nfs/dbraw/zinc/07/04/89/1318070489.db2.gz	RFXXOVVSTPRKCJ-WKILWMFISA-N	0	3	349.272	3.323	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C2C[C@@H](C)C[C@H](C)C2)C1	ZINC001021102411	1318084505	/nfs/dbraw/zinc/08/45/05/1318084505.db2.gz	KYEFGSRAWAURSF-GVARAGBVSA-N	0	3	343.309	3.204	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2ccsc2C#N)CN1Cc1ccccc1	ZINC000906971163	1318170506	/nfs/dbraw/zinc/17/05/06/1318170506.db2.gz	HESAXRWXZUWCIP-UKRRQHHQSA-N	0	3	325.437	3.013	20	30		EGEDHN
CCCCN(CCCCC1(C#N)CCC1)[C@H]1CCS(=O)(=O)C1	ZINC000929969486	1328752832	/nfs/dbraw/zinc/75/28/32/1328752832.db2.gz	BFMFIYPLNSKTIQ-INIZCTEOSA-N	0	3	326.506	3.140	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCCC[C@H]1CNCc1cccc(Cl)c1F	ZINC000959926916	1318269723	/nfs/dbraw/zinc/26/97/23/1318269723.db2.gz	YBAGYXPUMHYJDR-OCCSQVGLSA-N	0	3	337.826	3.109	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)C2=CCCC2)cc1F	ZINC000959959063	1318289787	/nfs/dbraw/zinc/28/97/87/1318289787.db2.gz	VQWGFOMGUNRKJV-SFHVURJKSA-N	0	3	341.430	3.278	20	30		EGEDHN
C#C[C@H](C)N(C)C(=O)NC[C@H](c1cccs1)N1CCC(C)CC1	ZINC000811993290	1318303489	/nfs/dbraw/zinc/30/34/89/1318303489.db2.gz	SOJAWNUQEAFMAS-JKSUJKDBSA-N	0	3	333.501	3.184	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@H]2CN(Cc3ccc(C#N)cc3)CC[C@@H]21	ZINC001021512112	1318334096	/nfs/dbraw/zinc/33/40/96/1318334096.db2.gz	UYIUKSNNMLHVON-PMACEKPBSA-N	0	3	337.467	3.337	20	30		EGEDHN
C=C1CCC(C(=O)N2CCCC[C@H]2CNCc2ccns2)CC1	ZINC000960110669	1318361309	/nfs/dbraw/zinc/36/13/09/1318361309.db2.gz	AVBMNTWANOLZOD-INIZCTEOSA-N	0	3	333.501	3.360	20	30		EGEDHN
C#C[C@H](C)N(C)C(=O)NC[C@H](c1ccc(CC(C)C)cc1)N(C)C	ZINC000812390265	1318380015	/nfs/dbraw/zinc/38/00/15/1318380015.db2.gz	ZFUXCZKTRCSCFA-QFBILLFUSA-N	0	3	329.488	3.151	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@H](CCCN3C(=O)C3=CCCC3)C2)c1	ZINC001021564224	1318414050	/nfs/dbraw/zinc/41/40/50/1318414050.db2.gz	XOHYOUXMQVIXHE-NHCUHLMSSA-N	0	3	349.478	3.481	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cccc3c2CCCC3)C1	ZINC001021593275	1318437595	/nfs/dbraw/zinc/43/75/95/1318437595.db2.gz	VLTUKRLQEBHUGP-GHTZIAJQSA-N	0	3	336.479	3.125	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@@H]1CCC(F)(F)C1	ZINC000960271630	1318437913	/nfs/dbraw/zinc/43/79/13/1318437913.db2.gz	RISYHGHANXRWHY-DJIMGWMZSA-N	0	3	334.410	3.370	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc2c(cn1)CCCC2	ZINC000960279221	1318440822	/nfs/dbraw/zinc/44/08/22/1318440822.db2.gz	BGMNXHXOKLWBDU-TZIWHRDSSA-N	0	3	347.462	3.132	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@H]1Cc2ccccc21	ZINC000960301623	1318451929	/nfs/dbraw/zinc/45/19/29/1318451929.db2.gz	FLYRHPPYDIOJBY-PWRODBHTSA-N	0	3	332.447	3.274	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2coc3c2cccc3C)C1	ZINC001021607841	1318454223	/nfs/dbraw/zinc/45/42/23/1318454223.db2.gz	XUBUBPVMHJAZBQ-APWZRJJASA-N	0	3	336.435	3.301	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ncoc1C(C)(C)C	ZINC000960322834	1318461470	/nfs/dbraw/zinc/46/14/70/1318461470.db2.gz	COPWRFNFFABNQT-HZPDHXFCSA-N	0	3	339.439	3.144	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)Cc2ccc(C)c(Cl)c2)C1	ZINC001021614692	1318462893	/nfs/dbraw/zinc/46/28/93/1318462893.db2.gz	QZHSFCRORNNOJX-IEBWSBKVSA-N	0	3	344.886	3.137	20	30		EGEDHN
COC[C@H](C)[C@H](C)C(=O)C(C#N)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000813059722	1318492570	/nfs/dbraw/zinc/49/25/70/1318492570.db2.gz	GTCLSLKCXPJZNW-NHCYSSNCSA-N	0	3	340.782	3.045	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(C)c3cccnc23)C1	ZINC001021638932	1318496202	/nfs/dbraw/zinc/49/62/02/1318496202.db2.gz	KZGDKYORDMARSO-FXAWDEMLSA-N	0	3	347.462	3.103	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccn(C(C)C)c2C)C1	ZINC001021656263	1318519011	/nfs/dbraw/zinc/51/90/11/1318519011.db2.gz	SQKFARHNNYLPNB-ICSRJNTNSA-N	0	3	341.499	3.327	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cccc3[nH]ccc32)C1	ZINC001021673808	1318538442	/nfs/dbraw/zinc/53/84/42/1318538442.db2.gz	MAKMBMCKGXVWQY-OXQOHEQNSA-N	0	3	335.451	3.118	20	30		EGEDHN
Cc1ccoc1C(=O)N1CCC[C@@H]1CN(C)Cc1cccc(C#N)c1	ZINC000960420062	1318545859	/nfs/dbraw/zinc/54/58/59/1318545859.db2.gz	XSNFYXDZDXDSPZ-GOSISDBHSA-N	0	3	337.423	3.196	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2oc(C(C)C)nc2C)C1	ZINC001021686990	1318560439	/nfs/dbraw/zinc/56/04/39/1318560439.db2.gz	DNBZBDBBDSVJCN-DLBZAZTESA-N	0	3	343.471	3.056	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(C(C)C)oc2C)C1	ZINC001021703638	1318573641	/nfs/dbraw/zinc/57/36/41/1318573641.db2.gz	ANXNKANGZBIXCQ-AEFFLSMTSA-N	0	3	328.456	3.271	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cccc3ccsc32)C1	ZINC001021708331	1318583562	/nfs/dbraw/zinc/58/35/62/1318583562.db2.gz	CRSMMLAKGDVOFU-SJLPKXTDSA-N	0	3	338.476	3.461	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc3cnccc3c2)C1	ZINC001021709789	1318586629	/nfs/dbraw/zinc/58/66/29/1318586629.db2.gz	LISYNMCCUJTCOX-SFTDATJTSA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(Cl)cc2)C1	ZINC001021720695	1318604563	/nfs/dbraw/zinc/60/45/63/1318604563.db2.gz	YQCPFUWEADVGLW-WMZOPIPTSA-N	0	3	330.859	3.290	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)Cc2cc(C)ccc2F)C1	ZINC001021720916	1318606078	/nfs/dbraw/zinc/60/60/78/1318606078.db2.gz	ZUVMEBKYERWKMI-YLJYHZDGSA-N	0	3	342.458	3.013	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)Cc2sc(C)cc2C)C1	ZINC001021725762	1318615969	/nfs/dbraw/zinc/61/59/69/1318615969.db2.gz	VZDZNPDSTFIQPS-ROUUACIJSA-N	0	3	344.524	3.244	20	30		EGEDHN
CCCCCCCS(=O)(=O)N1CCN(C2CCC2)C[C@@H](C)C1	ZINC000813752831	1318626250	/nfs/dbraw/zinc/62/62/50/1318626250.db2.gz	YPAYMUOKEFIEIT-MRXNPFEDSA-N	0	3	330.538	3.093	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(C)n(C(C)C)c2C)C1	ZINC001021731575	1318633870	/nfs/dbraw/zinc/63/38/70/1318633870.db2.gz	WMTDUBRMDXMAGM-ICSRJNTNSA-N	0	3	341.499	3.246	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2sccc2CC)C1	ZINC001021738595	1318645655	/nfs/dbraw/zinc/64/56/55/1318645655.db2.gz	APUNPNODPINDQY-IRXDYDNUSA-N	0	3	330.497	3.260	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(C)c(F)c(C)c2)C1	ZINC001021737969	1318645780	/nfs/dbraw/zinc/64/57/80/1318645780.db2.gz	XTDAEYBLAXETTF-IEBWSBKVSA-N	0	3	342.458	3.392	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2c[nH]c3ccc(C)cc23)C1	ZINC001021738677	1318646079	/nfs/dbraw/zinc/64/60/79/1318646079.db2.gz	CPHFIVPBHYHLOQ-UTKZUKDTSA-N	0	3	349.478	3.426	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N1CCC[C@@H]1CN(C)Cc1ccccc1	ZINC000960645016	1318763403	/nfs/dbraw/zinc/76/34/03/1318763403.db2.gz	DWUDOSBJLYGJRT-AQNXPRMDSA-N	0	3	342.483	3.091	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)C1(C2CC2)CC1	ZINC000960698536	1318799248	/nfs/dbraw/zinc/79/92/48/1318799248.db2.gz	FFXWCDFEFSGJRP-IBGZPJMESA-N	0	3	337.467	3.171	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N(C)Cc1ccc(Br)s1	ZINC000912076447	1318804234	/nfs/dbraw/zinc/80/42/34/1318804234.db2.gz	UNFNUWRPDHSTOG-LLVKDONJSA-N	0	3	331.279	3.153	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H]1CN(C)Cc1cccc(C#N)c1)C1CCC1	ZINC000960701554	1318802847	/nfs/dbraw/zinc/80/28/47/1318802847.db2.gz	LTDHYWHXCODENN-OXJNMPFZSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2snc(Cl)c2Cl)C1	ZINC001022142333	1318816885	/nfs/dbraw/zinc/81/68/85/1318816885.db2.gz	BVFMJRYVJMOSDH-KNVOCYPGSA-N	0	3	340.663	3.053	20	30		EGEDHN
C=CCNC(=O)Nc1ccc(NC(=O)[C@@H](N)C2CCCCCC2)cc1	ZINC000912209765	1318849574	/nfs/dbraw/zinc/84/95/74/1318849574.db2.gz	YQINSQSBELMKIL-KRWDZBQOSA-N	0	3	344.459	3.230	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)Nc1cc(C(=O)NC)ccc1OC	ZINC000912314705	1318867055	/nfs/dbraw/zinc/86/70/55/1318867055.db2.gz	UNGWCQVNUDTLSO-HNNXBMFYSA-N	0	3	349.475	3.071	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]1CN(C)Cc1ccccc1N(C)C	ZINC000960792269	1318898560	/nfs/dbraw/zinc/89/85/60/1318898560.db2.gz	UORBPVLUCHEJKV-GOSISDBHSA-N	0	3	343.515	3.388	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc(OC)c(C(C)C)c2)C1	ZINC001022374570	1318909493	/nfs/dbraw/zinc/90/94/93/1318909493.db2.gz	HHPMGXJTYUKWHZ-GASCZTMLSA-N	0	3	336.863	3.422	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)c2cc(C)sc2C)C1	ZINC001022381072	1318912689	/nfs/dbraw/zinc/91/26/89/1318912689.db2.gz	GXMFHJPTXBLZNZ-TXEJJXNPSA-N	0	3	343.290	3.124	20	30		EGEDHN
C=CCC(F)(F)C(=O)Nc1ccc(CCN2CCSCC2)cc1	ZINC000815150665	1318914422	/nfs/dbraw/zinc/91/44/22/1318914422.db2.gz	LCNFTVQRTCINIS-UHFFFAOYSA-N	0	3	340.439	3.428	20	30		EGEDHN
CC(N=Nc1ncccn1)c1ccc([O-])c(C[NH+]2CCCCC2)c1	ZINC000912973952	1318958387	/nfs/dbraw/zinc/95/83/87/1318958387.db2.gz	CJVPHHAIZLUBCB-UHFFFAOYSA-N	0	3	325.416	3.004	20	30		EGEDHN
C[C@@H]1CCN(Cc2ccccc2)C[C@H]1NC(=O)CCCCCC#N	ZINC000913096036	1318973392	/nfs/dbraw/zinc/97/33/92/1318973392.db2.gz	BKBLTUSEAKYJHL-IEBWSBKVSA-N	0	3	327.472	3.487	20	30		EGEDHN
C[C@@H]1CC[C@@H](CC(=O)N[C@H]2C[C@@H](NCc3cc(C#N)ccc3F)C2)C1	ZINC001022563179	1318993159	/nfs/dbraw/zinc/99/31/59/1318993159.db2.gz	FQXYWGZZLSOJTI-DTDBQYNISA-N	0	3	343.446	3.260	20	30		EGEDHN
CC1(C)CC[C@H](C(=O)N[C@H]2C[C@@H](NCc3ccc(C#N)cc3F)C2)C1	ZINC001022675642	1319061718	/nfs/dbraw/zinc/06/17/18/1319061718.db2.gz	MZWCCPBBZFQHDD-BHYGNILZSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)c2csc(Cl)c2)C1	ZINC001022810568	1319121779	/nfs/dbraw/zinc/12/17/79/1319121779.db2.gz	YRUXDTYTLMODRC-AOOOYVTPSA-N	0	3	349.681	3.161	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)C[C@@H]2CCCc3ccccc32)C1	ZINC001023002408	1319211099	/nfs/dbraw/zinc/21/10/99/1319211099.db2.gz	DNCCMXVJKOGDFS-YESZJQIVSA-N	0	3	332.875	3.486	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc3c(s2)CC[C@H](C)C3)C1	ZINC001023075073	1319254568	/nfs/dbraw/zinc/25/45/68/1319254568.db2.gz	VZVIAMQYCYHFSL-LEWSCRJBSA-N	0	3	338.904	3.476	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2c[nH]cc2-c2ccccc2)C1	ZINC001023086770	1319257437	/nfs/dbraw/zinc/25/74/37/1319257437.db2.gz	WSXXITZRGZOSLG-GASCZTMLSA-N	0	3	329.831	3.285	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2oc3ccc(F)cc3c2C)C1	ZINC001023415040	1319519677	/nfs/dbraw/zinc/51/96/77/1319519677.db2.gz	GSUDFZLXCOSOEU-HNNXBMFYSA-N	0	3	342.414	3.345	20	30		EGEDHN
C#CCN(C)CCCNC(=O)CC(C)(C)Cc1ccc(Cl)cc1	ZINC000818589357	1319563805	/nfs/dbraw/zinc/56/38/05/1319563805.db2.gz	YPFCAGPXLNVBEU-UHFFFAOYSA-N	0	3	334.891	3.370	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1[nH]c2ccc(Cl)cc2c1Cl	ZINC000818593056	1319565167	/nfs/dbraw/zinc/56/51/67/1319565167.db2.gz	JNDACQXSYBFIPV-UHFFFAOYSA-N	0	3	338.238	3.160	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1ccccc1CCc1ccccc1	ZINC000818606326	1319568237	/nfs/dbraw/zinc/56/82/37/1319568237.db2.gz	MTSOXFDXSPCVJT-UHFFFAOYSA-N	0	3	334.463	3.157	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc(-c3ccco3)o2)C1	ZINC001023481890	1319585609	/nfs/dbraw/zinc/58/56/09/1319585609.db2.gz	RRQYRVRGFMETJT-HNNXBMFYSA-N	0	3	326.396	3.005	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2nsc3ccc(C)cc32)C1	ZINC001023529414	1319636034	/nfs/dbraw/zinc/63/60/34/1319636034.db2.gz	DDLRAAYJVUBNKK-OAHLLOKOSA-N	0	3	341.480	3.070	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1Cl)C(=O)c1cccc([N+](=O)[O-])c1	ZINC000916907535	1319722353	/nfs/dbraw/zinc/72/23/53/1319722353.db2.gz	BSLPHUIWRHKFEC-GFCCVEGCSA-N	0	3	343.726	3.209	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc(-c3ccccc3)nc2)C1	ZINC001023669513	1319781964	/nfs/dbraw/zinc/78/19/64/1319781964.db2.gz	BYZHYYPJGOVVEU-GOSISDBHSA-N	0	3	347.462	3.214	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cccn2C2CCCC2)C1	ZINC001023671611	1319786796	/nfs/dbraw/zinc/78/67/96/1319786796.db2.gz	KXWHENKMMUVQBM-QGZVFWFLSA-N	0	3	327.472	3.068	20	30		EGEDHN
CC(C)(C(=O)NC1CC(CNCc2ccccc2C#N)C1)C1CCC1	ZINC000962124117	1319827332	/nfs/dbraw/zinc/82/73/32/1319827332.db2.gz	GSYNPNBZMICZGG-UHFFFAOYSA-N	0	3	339.483	3.369	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@@H]1CCCN(C(=O)C2CCCC2)C1	ZINC001023795966	1319940601	/nfs/dbraw/zinc/94/06/01/1319940601.db2.gz	AAYPVDLRIMPVMA-HNNXBMFYSA-N	0	3	343.446	3.216	20	30		EGEDHN
N#Cc1ccc(F)c(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)c1	ZINC000820889859	1319975829	/nfs/dbraw/zinc/97/58/29/1319975829.db2.gz	UZPWBSMAZVHNDJ-IBGZPJMESA-N	0	3	337.398	3.264	20	30		EGEDHN
C#CC[C@@H](CO)NCc1cccc(NC(=O)c2ccccc2Cl)c1	ZINC000821207372	1320003446	/nfs/dbraw/zinc/00/34/46/1320003446.db2.gz	OOZOEYXWOOOKTH-INIZCTEOSA-N	0	3	342.826	3.066	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)=C([O-])c2cccc(C[NH+](C)C)c2)cc1	ZINC000821620096	1320023494	/nfs/dbraw/zinc/02/34/94/1320023494.db2.gz	XXJQWCQVVDJYFF-LJQANCHMSA-N	0	3	349.434	3.272	20	30		EGEDHN
C[C@@H]1CCN(Cc2cc(=O)n3c4ccccc4[nH]c3c2C#N)[C@H](C)C1	ZINC000823515533	1320184883	/nfs/dbraw/zinc/18/48/83/1320184883.db2.gz	LURUTUSSVBTKHR-FMKPAKJESA-N	0	3	334.423	3.344	20	30		EGEDHN
C#CC1CCN(C(=O)NC[C@@H](c2ccsc2)N(CC)CC)CC1	ZINC000825638542	1320352469	/nfs/dbraw/zinc/35/24/69/1320352469.db2.gz	CZDGDLZMMSHYPB-KRWDZBQOSA-N	0	3	333.501	3.186	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N1CC[C@@H](C)C[C@@H]1c1ccc(C)o1	ZINC000838622794	1320795927	/nfs/dbraw/zinc/79/59/27/1320795927.db2.gz	NLUCKQKNDZQBPS-NVXWUHKLSA-N	0	3	331.460	3.026	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/CC(C)(C)C2(O)CCOCC2)c([O-])c1	ZINC000841482721	1321278054	/nfs/dbraw/zinc/27/80/54/1321278054.db2.gz	VVSOWJHXLRSPLU-KGENOOAVSA-N	0	3	348.487	3.225	20	30		EGEDHN
N#CC(C(=O)NC1CCCC1)C(=O)[C@@H]1CCSc2ccccc21	ZINC000842291248	1321368026	/nfs/dbraw/zinc/36/80/26/1321368026.db2.gz	GJWXROBSJCMGFO-HUUCEWRRSA-N	0	3	328.437	3.034	20	30		EGEDHN
CC1(C)C[C@@H](C(=O)C(C#N)C(=O)NC2CCCC2)c2ccccc2O1	ZINC000842292313	1321368733	/nfs/dbraw/zinc/36/87/33/1321368733.db2.gz	SJIMAFJQRLTVCM-HZPDHXFCSA-N	0	3	340.423	3.099	20	30		EGEDHN
Cc1cccc(C(=O)OCC2(C#N)CCN(Cc3ccccc3)CC2)n1	ZINC000847745926	1321900383	/nfs/dbraw/zinc/90/03/83/1321900383.db2.gz	ROQHQJRGPUIQFR-UHFFFAOYSA-N	0	3	349.434	3.353	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NCC[C@@H]1CN(CC(=C)Cl)C[C@H]1C	ZINC001103274833	1365466287	/nfs/dbraw/zinc/46/62/87/1365466287.db2.gz	WXGFASGRYCFJCF-KYJSFNMBSA-N	0	3	342.911	3.042	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN[C@H]2CCc3ccccc3NC2=O)cc1	ZINC000848561039	1321976416	/nfs/dbraw/zinc/97/64/16/1321976416.db2.gz	OKARNAXLSKZWLF-LIRRHRJNSA-N	0	3	335.407	3.021	20	30		EGEDHN
CC(C)(C)O[C@@H]1C[C@H]1C(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1	ZINC000850755609	1322285088	/nfs/dbraw/zinc/28/50/88/1322285088.db2.gz	GOMOTPKYDDMJRN-HZSPNIEDSA-N	0	3	334.803	3.191	20	30		EGEDHN
COc1cc(Cl)c(C)cc1NC(=O)C(C#N)C(=O)CCCF	ZINC000850759816	1322285860	/nfs/dbraw/zinc/28/58/60/1322285860.db2.gz	OGIXWNDLYCOPLE-JTQLQIEISA-N	0	3	326.755	3.054	20	30		EGEDHN
C[C@@H](CC(C)(C)C#N)OC(=O)C1CCN(c2ccc(F)cc2)C1=O	ZINC000851210941	1323001636	/nfs/dbraw/zinc/00/16/36/1323001636.db2.gz	WEXMKPQXJZUHGV-WFASDCNBSA-N	0	3	332.375	3.050	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)CCCCCOCC)C1	ZINC001103768001	1365773935	/nfs/dbraw/zinc/77/39/35/1365773935.db2.gz	PDHCEAKBHYRDQA-NVXWUHKLSA-N	0	3	344.927	3.410	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC[C@H](CNCc2cnc(C)o2)C1	ZINC001024002530	1323073516	/nfs/dbraw/zinc/07/35/16/1323073516.db2.gz	DXJMYCJWDAFJMM-CQSZACIVSA-N	0	3	339.867	3.090	20	30		EGEDHN
Cc1coc(C(=O)N2CCC[C@H](CNCc3ccccc3C#N)C2)c1	ZINC001024111057	1323142891	/nfs/dbraw/zinc/14/28/91/1323142891.db2.gz	FKQFGLVJWMKXSQ-MRXNPFEDSA-N	0	3	337.423	3.102	20	30		EGEDHN
C#C[C@](C)(CC)NCC(=O)N[C@H](c1cccs1)c1ccccc1	ZINC000852098196	1323145557	/nfs/dbraw/zinc/14/55/57/1323145557.db2.gz	HFKYONOAUIRPPY-RBUKOAKNSA-N	0	3	326.465	3.345	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H](CNCc2cc(C3CC3)no2)C1	ZINC001024137549	1323163129	/nfs/dbraw/zinc/16/31/29/1323163129.db2.gz	NOUNKIQQHRDWIT-FOIQADDNSA-N	0	3	345.487	3.483	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCN(C(=O)[C@@H]2CC23CCC3)C1	ZINC001024182816	1323194265	/nfs/dbraw/zinc/19/42/65/1323194265.db2.gz	YDVIEZRYXHKYNE-LPHOPBHVSA-N	0	3	337.467	3.077	20	30		EGEDHN
C=C(C)C[N@@H+]1CCC[C@@H]1[C@H]1CCCN(C(=O)c2ccccc2[O-])C1	ZINC000963248526	1323258146	/nfs/dbraw/zinc/25/81/46/1323258146.db2.gz	CJWMXCIMTODPRX-FUHWJXTLSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=C(C)C[N@H+]1CCC[C@@H]1[C@H]1CCCN(C(=O)c2ccccc2[O-])C1	ZINC000963248526	1323258159	/nfs/dbraw/zinc/25/81/59/1323258159.db2.gz	CJWMXCIMTODPRX-FUHWJXTLSA-N	0	3	328.456	3.285	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1cscc1C(F)F	ZINC001024442600	1323403961	/nfs/dbraw/zinc/40/39/61/1323403961.db2.gz	SHXWZODNZLPSJR-GFCCVEGCSA-N	0	3	326.412	3.293	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1cc(C)n(C(CC)CC)n1	ZINC001024519637	1323469604	/nfs/dbraw/zinc/46/96/04/1323469604.db2.gz	VYIVEWPZXSEYRD-SFHVURJKSA-N	0	3	344.503	3.160	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1cc(C)nn1C(CC)CC	ZINC001024521183	1323471946	/nfs/dbraw/zinc/47/19/46/1323471946.db2.gz	PWWHSKXYXWPPKA-GOSISDBHSA-N	0	3	344.503	3.160	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)[C@@H]1CCc2c1cccc2Cl	ZINC001024557347	1323497313	/nfs/dbraw/zinc/49/73/13/1323497313.db2.gz	RUTAUGIFBDENKP-CRAIPNDOSA-N	0	3	344.886	3.364	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccc2c(c1)[C@@H](C)CO2	ZINC001024617903	1323547546	/nfs/dbraw/zinc/54/75/46/1323547546.db2.gz	NCCRJSMWOWVOBX-RDJZCZTQSA-N	0	3	328.456	3.343	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)NC[C@@H]1CCCCN1Cc1ccc(C)cc1	ZINC001024660200	1323576352	/nfs/dbraw/zinc/57/63/52/1323576352.db2.gz	KLJNJNXBPWVMQS-ZCNNSNEGSA-N	0	3	342.483	3.057	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@@H]1CCCc2sc(C)nc21	ZINC001024756727	1323656094	/nfs/dbraw/zinc/65/60/94/1323656094.db2.gz	UVJLOIOFNNJWQD-HZPDHXFCSA-N	0	3	347.528	3.418	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1cccc(OCC(C)C)c1	ZINC001024793133	1323699940	/nfs/dbraw/zinc/69/99/40/1323699940.db2.gz	RIEBIVLRBQETGH-LJQANCHMSA-N	0	3	342.483	3.329	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1coc(C2CCCCC2)n1	ZINC001024819008	1323724125	/nfs/dbraw/zinc/72/41/25/1323724125.db2.gz	KETMZPHVPLOEBC-KRWDZBQOSA-N	0	3	343.471	3.330	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccc(N(C)CC)cc1	ZINC001024824957	1323728550	/nfs/dbraw/zinc/72/85/50/1323728550.db2.gz	NPEGEJVEKWGPRE-IBGZPJMESA-N	0	3	329.488	3.303	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)C1CC(c2cccc(F)c2)C1	ZINC001024825027	1323728934	/nfs/dbraw/zinc/72/89/34/1323728934.db2.gz	OWXLVDFJLGQJGZ-QLOJAFMTSA-N	0	3	342.458	3.313	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccc(OC(C)C)cn1	ZINC001024834621	1323735612	/nfs/dbraw/zinc/73/56/12/1323735612.db2.gz	ZNCFILJULJEEAO-INIZCTEOSA-N	0	3	331.460	3.029	20	30		EGEDHN
C=C1CCC(C(=O)N2CCCC[C@@H]2CNCc2cncs2)CC1	ZINC001025069254	1323869180	/nfs/dbraw/zinc/86/91/80/1323869180.db2.gz	FNOIKXDYDGUYCC-MRXNPFEDSA-N	0	3	333.501	3.360	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCCC[C@H]1CNCc1cncc(C)c1	ZINC001025069876	1323870081	/nfs/dbraw/zinc/87/00/81/1323870081.db2.gz	RHIDTQXBBVJYMW-ICSRJNTNSA-N	0	3	329.488	3.463	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCCC[C@@H]2CNCc2cncc(C)c2)C1	ZINC001025075227	1323878398	/nfs/dbraw/zinc/87/83/98/1323878398.db2.gz	YKFWTSLDELVQLP-GOSISDBHSA-N	0	3	327.472	3.217	20	30		EGEDHN
O=C(C#CC1CC1)N1CCCC[C@H]1[C@H]1CCCN1CCC(F)(F)F	ZINC001025229611	1324015997	/nfs/dbraw/zinc/01/59/97/1324015997.db2.gz	NCDGULZKLYTBAF-CVEARBPZSA-N	0	3	342.405	3.198	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)Cc1c(C)cccc1C	ZINC001025236130	1324024625	/nfs/dbraw/zinc/02/46/25/1324024625.db2.gz	DIIGEUQKBQXOND-RTWAWAEBSA-N	0	3	338.495	3.325	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(F)ccc1F	ZINC001025239878	1324032533	/nfs/dbraw/zinc/03/25/33/1324032533.db2.gz	JSXQBFBZPJFYIK-RBUKOAKNSA-N	0	3	346.421	3.447	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)Cc1ccccc1CC	ZINC001025242304	1324037447	/nfs/dbraw/zinc/03/74/47/1324037447.db2.gz	HZPYXNMZWXDHBW-SFTDATJTSA-N	0	3	338.495	3.270	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1[nH]c(C)cc1C	ZINC001025244046	1324040553	/nfs/dbraw/zinc/04/05/53/1324040553.db2.gz	GKZGPTKXFDPAGT-MSOLQXFVSA-N	0	3	327.472	3.114	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccn2ccccc12	ZINC001025249361	1324049728	/nfs/dbraw/zinc/04/97/28/1324049728.db2.gz	BHKZLXLVYXHUQN-RTWAWAEBSA-N	0	3	349.478	3.422	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccnc2ccccc21	ZINC001025251338	1324054002	/nfs/dbraw/zinc/05/40/02/1324054002.db2.gz	RTWZXVFOHLBADV-RTWAWAEBSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cccc2ncccc21	ZINC001025256702	1324064597	/nfs/dbraw/zinc/06/45/97/1324064597.db2.gz	ZLAMPIZJJPPYTA-RTWAWAEBSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc(F)c(C)c1	ZINC001025261893	1324073332	/nfs/dbraw/zinc/07/33/32/1324073332.db2.gz	YZLHMNPRDNZCTE-MOPGFXCFSA-N	0	3	328.431	3.226	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccn(C(C)C)c1C	ZINC001025263658	1324074821	/nfs/dbraw/zinc/07/48/21/1324074821.db2.gz	PEDXUCYRBKCQDH-VQTJNVASSA-N	0	3	341.499	3.470	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc2[nH]ccc2c1	ZINC001025263807	1324075410	/nfs/dbraw/zinc/07/54/10/1324075410.db2.gz	RNBSTHUNLHNOIZ-VQTJNVASSA-N	0	3	335.451	3.260	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)Cc1ccsc1C	ZINC001025273618	1324088815	/nfs/dbraw/zinc/08/88/15/1324088815.db2.gz	FUHZVIBLRWMBQA-ZWKOTPCHSA-N	0	3	330.497	3.078	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1csc2cncn21	ZINC001025273270	1324089379	/nfs/dbraw/zinc/08/93/79/1324089379.db2.gz	CFKUFZIRCJRRBE-HUUCEWRRSA-N	0	3	344.484	3.041	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(C(C)C)n[nH]1	ZINC001025274152	1324090307	/nfs/dbraw/zinc/09/03/07/1324090307.db2.gz	UPJLJNZIRKJUEZ-MOPGFXCFSA-N	0	3	342.487	3.016	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc2sccc2[nH]1	ZINC001025283981	1324104995	/nfs/dbraw/zinc/10/49/95/1324104995.db2.gz	DAPCDWOZFNZFPT-IRXDYDNUSA-N	0	3	341.480	3.322	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)C(C)(C)c1ccccc1	ZINC001025295485	1324125825	/nfs/dbraw/zinc/12/58/25/1324125825.db2.gz	GKIBDZOUZCVAPS-UXHICEINSA-N	0	3	338.495	3.443	20	30		EGEDHN
C#CCCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cnc(CC)s1	ZINC001025301559	1324134834	/nfs/dbraw/zinc/13/48/34/1324134834.db2.gz	LTGVICPTBCEXJD-JKSUJKDBSA-N	0	3	345.512	3.188	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)Cc1ccc(C)s1	ZINC001025301681	1324135522	/nfs/dbraw/zinc/13/55/22/1324135522.db2.gz	OBNVBLXYQOEJHV-OALUTQOASA-N	0	3	344.524	3.468	20	30		EGEDHN
N#CC1(CCCCN2CCN(Cc3ccc(O)cc3)CC2)CCC1	ZINC000931518038	1329134582	/nfs/dbraw/zinc/13/45/82/1329134582.db2.gz	LHVRSZVTWQFVGE-UHFFFAOYSA-N	0	3	327.472	3.374	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC001025426551	1324260674	/nfs/dbraw/zinc/26/06/74/1324260674.db2.gz	XDVBKJCEQKZBNM-GXTWGEPZSA-N	0	3	338.373	3.227	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccccc2-c2ccncc2)C1	ZINC001025455368	1324296473	/nfs/dbraw/zinc/29/64/73/1324296473.db2.gz	CHEOGUNGOQZBML-MJGOQNOKSA-N	0	3	347.462	3.212	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2coc3cc(F)ccc23)C1	ZINC001025461935	1324307967	/nfs/dbraw/zinc/30/79/67/1324307967.db2.gz	YMNDLJBLDUEFAY-LSDHHAIUSA-N	0	3	342.414	3.426	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cccc3cccnc32)C1	ZINC001025473020	1324319855	/nfs/dbraw/zinc/31/98/55/1324319855.db2.gz	YAQNPHAHSHRDEB-SJLPKXTDSA-N	0	3	335.451	3.088	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(OC)c(C(C)C)c2)C1	ZINC001025475989	1324320933	/nfs/dbraw/zinc/32/09/33/1324320933.db2.gz	WDWQLAMCBMYWAG-AEFFLSMTSA-N	0	3	342.483	3.282	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(C)c(Cl)c2F)C1	ZINC001025489026	1324340687	/nfs/dbraw/zinc/34/06/87/1324340687.db2.gz	NKAGDRIRBUSMQV-KGLIPLIRSA-N	0	3	336.838	3.251	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccccc2OCC(C)C)C1	ZINC001025565616	1324411700	/nfs/dbraw/zinc/41/17/00/1324411700.db2.gz	SOTQSALVFVIHEK-ZWKOTPCHSA-N	0	3	342.483	3.185	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(-c3ccco3)s2)C1	ZINC001025582224	1324423142	/nfs/dbraw/zinc/42/31/42/1324423142.db2.gz	PZXRQUMQNYSUHK-GJZGRUSLSA-N	0	3	342.464	3.472	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cccc(Cl)c2Cl)C1	ZINC001025606867	1324457066	/nfs/dbraw/zinc/45/70/66/1324457066.db2.gz	GVUZWGFBAUHXPA-OLZOCXBDSA-N	0	3	339.266	3.457	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(Cl)cc(Cl)c2)C1	ZINC001025609249	1324460598	/nfs/dbraw/zinc/46/05/98/1324460598.db2.gz	NGMLCPIHKMRSQB-CHWSQXEVSA-N	0	3	339.266	3.457	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2csc3c2CCCC3)C1	ZINC001025612384	1324464051	/nfs/dbraw/zinc/46/40/51/1324464051.db2.gz	STPOCIPCHXMOLJ-LSDHHAIUSA-N	0	3	330.497	3.090	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(F)c3occc32)C1	ZINC001025624581	1324475268	/nfs/dbraw/zinc/47/52/68/1324475268.db2.gz	NROLOLNQKLLKEN-KGLIPLIRSA-N	0	3	328.387	3.035	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cnc(C(C)(C)C)s2)C1	ZINC001025630245	1324482377	/nfs/dbraw/zinc/48/23/77/1324482377.db2.gz	RRKXJXIUFAFDAT-HUUCEWRRSA-N	0	3	347.528	3.294	20	30		EGEDHN
CC(C)CC(=O)N1C[C@@H]2CC[C@@H](NCc3cc(F)ccc3C#N)[C@@H]2C1	ZINC001026179613	1324647055	/nfs/dbraw/zinc/64/70/55/1324647055.db2.gz	ZCQUYVREDBPAAB-KFKAGJAMSA-N	0	3	343.446	3.070	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H]3CC[C@H](NCc4cc(C)no4)[C@H]3C2)CC1	ZINC001026347789	1324743414	/nfs/dbraw/zinc/74/34/14/1324743414.db2.gz	IILPLUXGXFPOHT-WDSOQIARSA-N	0	3	343.471	3.056	20	30		EGEDHN
N#Cc1ccccc1CNC1CCC(NC(=O)Cc2ccccc2)CC1	ZINC001026517296	1324863424	/nfs/dbraw/zinc/86/34/24/1324863424.db2.gz	ZWRWLAYYCSRITN-UHFFFAOYSA-N	0	3	347.462	3.318	20	30		EGEDHN
CC1(C)C(C(=O)N2CC[C@@H](CNCc3ccccc3C#N)C2)C1(C)C	ZINC001026757688	1325005348	/nfs/dbraw/zinc/00/53/48/1325005348.db2.gz	FBSFNDCNEDXMTE-HNNXBMFYSA-N	0	3	339.483	3.179	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)c2ccoc2Cl)C1	ZINC001026806245	1325029804	/nfs/dbraw/zinc/02/98/04/1325029804.db2.gz	KILRVYSUCVKSBF-ZDUSSCGKSA-N	0	3	343.814	3.057	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)[C@@H]2C[C@@H]3C=C[C@H]2CC3)C1	ZINC001026856625	1325045594	/nfs/dbraw/zinc/04/55/94/1325045594.db2.gz	GPQJBALLKBMMOO-OEMYIYORSA-N	0	3	349.478	3.099	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)Cc2cccnc2)C1	ZINC000963289173	1325075231	/nfs/dbraw/zinc/07/52/31/1325075231.db2.gz	GVTICFTVJJXZKH-QZTJIDSGSA-N	0	3	347.890	3.080	20	30		EGEDHN
OC1CCN(c2ccc(C=NNCCCc3ccccc3)cc2)CC1	ZINC000853303484	1325078178	/nfs/dbraw/zinc/07/81/78/1325078178.db2.gz	WNWOLVXJHWPWMO-UHFFFAOYSA-N	0	3	337.467	3.204	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](CNCc3oc(C(C)C)nc3C)C2)C1	ZINC001027050613	1325188621	/nfs/dbraw/zinc/18/86/21/1325188621.db2.gz	HBGJRKDUDXAWMF-MRXNPFEDSA-N	0	3	345.487	3.401	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H]1C(=O)N1CC[C@H](CNCc2ccccc2C#N)C1	ZINC001027078155	1325206108	/nfs/dbraw/zinc/20/61/08/1325206108.db2.gz	YXKXTTGKQVXLOY-NSISKUIASA-N	0	3	339.483	3.179	20	30		EGEDHN
CCC(C)(CC)C(=O)N1CC[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001027227180	1325320415	/nfs/dbraw/zinc/32/04/15/1325320415.db2.gz	WBTJLXRFYIWKBL-OAHLLOKOSA-N	0	3	345.462	3.462	20	30		EGEDHN
CN(Cc1ccc(F)c(C#N)c1)[C@H]1CCCN(C(=O)C2CCCC2)C1	ZINC001027268326	1325370435	/nfs/dbraw/zinc/37/04/35/1325370435.db2.gz	OHYVRFOTWTVODX-SFHVURJKSA-N	0	3	343.446	3.310	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)c(F)c2)C1	ZINC001027305108	1325449034	/nfs/dbraw/zinc/44/90/34/1325449034.db2.gz	HTMYYZCXEYACET-PBHICJAKSA-N	0	3	331.435	3.166	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@@H](N(C)Cc2ccc(F)c(Cl)c2)C1	ZINC001027335080	1325493422	/nfs/dbraw/zinc/49/34/22/1325493422.db2.gz	BNFXZWXTRHCVJB-TZMCWYRMSA-N	0	3	337.826	3.062	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)cc2)C1)C1CC1	ZINC001027352536	1325522105	/nfs/dbraw/zinc/52/21/05/1325522105.db2.gz	XACPVAKFVBJAOH-HNAYVOBHSA-N	0	3	325.456	3.027	20	30		EGEDHN
CC(C(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)cc2)C1)=C1CCC1	ZINC001027404269	1327629154	/nfs/dbraw/zinc/62/91/54/1327629154.db2.gz	YEWZKQHGQLYKTK-FQEVSTJZSA-N	0	3	337.467	3.481	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)c2oc3ccc(F)cc3c2C)C1	ZINC001027443764	1327683570	/nfs/dbraw/zinc/68/35/70/1327683570.db2.gz	NRTGXACLKDRBBW-HNNXBMFYSA-N	0	3	328.387	3.050	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)C2(C3CC3)CC2)C1	ZINC001027456354	1327697095	/nfs/dbraw/zinc/69/70/95/1327697095.db2.gz	XMYNARGUGKHILX-LJQANCHMSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](N(C)Cc2ccc(F)c(C#N)c2)C1	ZINC001027521689	1327793438	/nfs/dbraw/zinc/79/34/38/1327793438.db2.gz	JIOCSSRGILDDOH-KRWDZBQOSA-N	0	3	343.446	3.332	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)C2CC3(CC3)C2)C1	ZINC001027570369	1327900931	/nfs/dbraw/zinc/90/09/31/1327900931.db2.gz	CZKNBJQJJYWDEJ-LJQANCHMSA-N	0	3	337.467	3.171	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)[C@H]2CC23CCC3)C1	ZINC001027596595	1327945507	/nfs/dbraw/zinc/94/55/07/1327945507.db2.gz	XBNQCRORJYZRJE-RTBURBONSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=C(C)CCN1CC[C@H](C)[C@H](NC(=O)c2cn3cc(C)nc3s2)C1	ZINC000966718359	1328391633	/nfs/dbraw/zinc/39/16/33/1328391633.db2.gz	CIVMKXXCHBSILV-DZGCQCFKSA-N	0	3	346.500	3.111	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2cccc3c2CCCCC3)C1	ZINC000966888436	1328455380	/nfs/dbraw/zinc/45/53/80/1328455380.db2.gz	RNRJAQLFECHACU-DYESRHJHSA-N	0	3	338.495	3.419	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc3c(cccc3N(C)C)s2)CC1	ZINC000932144099	1329788540	/nfs/dbraw/zinc/78/85/40/1329788540.db2.gz	MPQRNOAHWLVVON-UHFFFAOYSA-N	0	3	343.496	3.348	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC2(C(F)(F)F)CCCCC2)CC1	ZINC000933431223	1329889084	/nfs/dbraw/zinc/88/90/84/1329889084.db2.gz	SFDFBXNRMOBCDP-UHFFFAOYSA-N	0	3	333.398	3.201	20	30		EGEDHN
CNC(=O)c1cccc(CN2CCC(c3ccc(C#N)cc3)CC2)c1	ZINC000933613049	1329905983	/nfs/dbraw/zinc/90/59/83/1329905983.db2.gz	PYMGLKLVSQZUHE-UHFFFAOYSA-N	0	3	333.435	3.297	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2sc(Cl)nc2Cl)CC1	ZINC001052939073	1348757723	/nfs/dbraw/zinc/75/77/23/1348757723.db2.gz	JUGPQMXUDYRETK-SNVBAGLBSA-N	0	3	346.283	3.058	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H](C)[C@H](NCc3cc(C)ns3)C2)CC1	ZINC000939059912	1330366932	/nfs/dbraw/zinc/36/69/32/1330366932.db2.gz	VUOYTBDLRLIEAY-CXAGYDPISA-N	0	3	333.501	3.134	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cncc(-c3ccccc3)c2)[C@H](C)C1	ZINC000942105712	1331832090	/nfs/dbraw/zinc/83/20/90/1331832090.db2.gz	IVYUXCKBMXOCCS-UZLBHIALSA-N	0	3	335.451	3.375	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cncc(-c3ccccc3)c2)[C@@H](C)C1	ZINC000942106238	1331832546	/nfs/dbraw/zinc/83/25/46/1331832546.db2.gz	MTOIDHIPNOMKOG-LAUBAEHRSA-N	0	3	347.462	3.212	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccccc2-c2ccncc2)[C@H](C)C1	ZINC000942176392	1331861994	/nfs/dbraw/zinc/86/19/94/1331861994.db2.gz	OXPWFYLVWGZFKZ-DYESRHJHSA-N	0	3	347.462	3.212	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2[nH]c3ccccc3c2Cl)[C@H](C)C1	ZINC000942260254	1331891019	/nfs/dbraw/zinc/89/10/19/1331891019.db2.gz	XYHZMWLVNKTGDL-UKRRQHHQSA-N	0	3	343.858	3.285	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3c(o2)c(F)ccc3C)[C@@H](C)C1	ZINC000942526885	1331955768	/nfs/dbraw/zinc/95/57/68/1331955768.db2.gz	CTZJLOMDHWTPNY-YOEHRIQHSA-N	0	3	342.414	3.344	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3c(cc(C)cc3C)[nH]2)[C@@H](C)C1	ZINC000942538625	1331963948	/nfs/dbraw/zinc/96/39/48/1331963948.db2.gz	TUHVGUCCUXVBPK-WMZOPIPTSA-N	0	3	337.467	3.248	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2nc(Cl)sc2Cl)[C@H](C)C1	ZINC000942561006	1331975557	/nfs/dbraw/zinc/97/55/57/1331975557.db2.gz	ZYTRFELHGBZDKV-BDAKNGLRSA-N	0	3	334.272	3.076	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2csc(-c3ccco3)n2)[C@H](C)C1	ZINC000942584337	1331989765	/nfs/dbraw/zinc/98/97/65/1331989765.db2.gz	WDORGRRSSOFXOE-CHWSQXEVSA-N	0	3	331.441	3.029	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCN(Cc3cnccc3C)C[C@H]2C)CC1	ZINC000942599629	1331996385	/nfs/dbraw/zinc/99/63/85/1331996385.db2.gz	BZQPFWZXZQMWHF-YLJYHZDGSA-N	0	3	341.499	3.463	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)cc2)CC[C@@H]1NC(=O)C1CC2(CC2)C1	ZINC000942701592	1332022943	/nfs/dbraw/zinc/02/29/43/1332022943.db2.gz	SMZUVHSIKSGOCK-BEFAXECRSA-N	0	3	337.467	3.075	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccccc2OC2CCC2)[C@@H](C)C1	ZINC000942703333	1332023580	/nfs/dbraw/zinc/02/35/80/1332023580.db2.gz	XTWLUKPRFDQDQQ-YJBOKZPZSA-N	0	3	328.456	3.244	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C(F)F)cc2F)[C@@H](C)C1	ZINC000943756862	1332255436	/nfs/dbraw/zinc/25/54/36/1332255436.db2.gz	XAKWBORQBOFEML-LRDDRELGSA-N	0	3	338.373	3.227	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(-c3ccco3)s2)[C@@H](C)C1	ZINC000943814697	1332272450	/nfs/dbraw/zinc/27/24/50/1332272450.db2.gz	JHXHHZTVZHYIGH-LSDHHAIUSA-N	0	3	342.464	3.472	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccsc2C(F)(F)F)[C@@H](C)C1	ZINC000944345293	1332379930	/nfs/dbraw/zinc/37/99/30/1332379930.db2.gz	FJUKIUABJKFURU-AAEUAGOBSA-N	0	3	344.402	3.230	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(-c3cccs3)o2)[C@H](C)C1	ZINC000944531857	1332414902	/nfs/dbraw/zinc/41/49/02/1332414902.db2.gz	KESYGZANAUVWFI-CABCVRRESA-N	0	3	342.464	3.472	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(OC3CCC3)cc2)[C@@H](C)C1	ZINC000945029277	1332481552	/nfs/dbraw/zinc/48/15/52/1332481552.db2.gz	RGZTWAHKWOVVHM-OXJNMPFZSA-N	0	3	340.467	3.081	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3cccc(F)c3o2)[C@@H](C)C1	ZINC000945061991	1332491182	/nfs/dbraw/zinc/49/11/82/1332491182.db2.gz	KPSLONGXBKQTKC-BBRMVZONSA-N	0	3	328.387	3.035	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)/C=C\c3ccco3)CC[C@@H]2C1	ZINC000946454644	1332833983	/nfs/dbraw/zinc/83/39/83/1332833983.db2.gz	QLKMSMHMXKHIOY-RLPXRCBWSA-N	0	3	334.847	3.216	20	30		EGEDHN
Cc1cccc(C(=O)N[C@H]2CCN(Cc3ccc(C#N)cc3)[C@H](C)C2)n1	ZINC000947075287	1333003230	/nfs/dbraw/zinc/00/32/30/1333003230.db2.gz	ORSKFLLBVFYXQV-APWZRJJASA-N	0	3	348.450	3.045	20	30		EGEDHN
Cc1cccnc1C(=O)N[C@@H]1CCN(Cc2cccc(C#N)c2)[C@@H](C)C1	ZINC000947157462	1333028651	/nfs/dbraw/zinc/02/86/51/1333028651.db2.gz	PLLUKTHJSORXFY-QFBILLFUSA-N	0	3	348.450	3.045	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)C2C=CC=CC=C2)CCN1Cc1cccc(C#N)c1	ZINC000947360574	1333102564	/nfs/dbraw/zinc/10/25/64/1333102564.db2.gz	HBVSQQWTSRCGLD-UTKZUKDTSA-N	0	3	347.462	3.326	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3ccccc3nc2C)C[C@H]1C	ZINC000947365058	1333104732	/nfs/dbraw/zinc/10/47/32/1333104732.db2.gz	HGYXYIYVFMUCLM-QAPCUYQASA-N	0	3	335.451	3.149	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(C)n(C(CC)CC)n2)C[C@H]1C	ZINC000947472583	1333141731	/nfs/dbraw/zinc/14/17/31/1333141731.db2.gz	HQMDYULWBMSGKA-GDBMZVCRSA-N	0	3	332.492	3.321	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2CCc3ccccc3CC2)C[C@@H]1C	ZINC000947474734	1333142398	/nfs/dbraw/zinc/14/23/98/1333142398.db2.gz	YLQOIECNFHSJIL-LAUBAEHRSA-N	0	3	338.495	3.174	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2ccc(CCCC)cc2)C[C@@H]1C	ZINC000947509888	1333150367	/nfs/dbraw/zinc/15/03/67/1333150367.db2.gz	HZFDEHKIXZIAPC-PXNSSMCTSA-N	0	3	326.484	3.174	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2cc3ccccc3s2)C[C@H]1C	ZINC000947540352	1333164215	/nfs/dbraw/zinc/16/42/15/1333164215.db2.gz	RZWSTEZMIQOOLH-GDBMZVCRSA-N	0	3	326.465	3.046	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2c(C)occ2C(F)(F)F)C[C@@H]1C	ZINC000947547672	1333167606	/nfs/dbraw/zinc/16/76/06/1333167606.db2.gz	SWVWVGHPXNIARR-JQWIXIFHSA-N	0	3	330.350	3.376	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C)c(Cl)c2F)C[C@H]1C	ZINC000947569275	1333175422	/nfs/dbraw/zinc/17/54/22/1333175422.db2.gz	VFAIKQHVFWSARG-KGLIPLIRSA-N	0	3	336.838	3.394	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)C2(C)CCC2)CCN1Cc1cccc(C#N)c1	ZINC000947612720	1333192652	/nfs/dbraw/zinc/19/26/52/1333192652.db2.gz	XNFIITHCSRZECQ-QAPCUYQASA-N	0	3	325.456	3.218	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc(F)c3ccncc23)C[C@H]1C	ZINC000947647274	1333207692	/nfs/dbraw/zinc/20/76/92/1333207692.db2.gz	BINPANBVUXFHCJ-KGLIPLIRSA-N	0	3	327.403	3.143	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C(C)(C)c2cccc(F)c2)C[C@@H]1C	ZINC000947718814	1333239423	/nfs/dbraw/zinc/23/94/23/1333239423.db2.gz	CGRDWURVTQXTOL-MAUKXSAKSA-N	0	3	330.447	3.096	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C(F)F)c(F)c2)C[C@@H]1C	ZINC000947720076	1333240351	/nfs/dbraw/zinc/24/03/51/1333240351.db2.gz	XKXHTORKWDUWMD-JSGCOSHPSA-N	0	3	338.373	3.369	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(F)cc3cccnc32)C[C@H]1C	ZINC000947767178	1333255293	/nfs/dbraw/zinc/25/52/93/1333255293.db2.gz	METCKJUPNJGIGL-CZUORRHYSA-N	0	3	327.403	3.143	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2scnc2C(C)(C)C)C[C@@H]1C	ZINC000947792391	1333263196	/nfs/dbraw/zinc/26/31/96/1333263196.db2.gz	LTXSOMIKFXNETA-UONOGXRCSA-N	0	3	333.501	3.047	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccccc2OCC(C)C)C[C@@H]1C	ZINC000947818893	1333270520	/nfs/dbraw/zinc/27/05/20/1333270520.db2.gz	BPBXQVRDMMLTPF-IRXDYDNUSA-N	0	3	330.472	3.490	20	30		EGEDHN
Cc1cc(C(=O)N[C@H]2CCN(Cc3cccc(C#N)c3)[C@@H](C)C2)ccn1	ZINC000947818875	1333270647	/nfs/dbraw/zinc/27/06/47/1333270647.db2.gz	BMALZKBDDFBANU-JXFKEZNVSA-N	0	3	348.450	3.045	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2c[nH]c3cccc(C)c23)C[C@H]1C	ZINC000947934276	1333311439	/nfs/dbraw/zinc/31/14/39/1333311439.db2.gz	KBBYXNONCYKODW-AEFFLSMTSA-N	0	3	337.467	3.011	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2coc(-c3ccccc3)n2)C[C@@H]1C	ZINC000947940981	1333313268	/nfs/dbraw/zinc/31/32/68/1333313268.db2.gz	VTGGMGVKBLHTHH-GOEBONIOSA-N	0	3	325.412	3.110	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3ccccc3C)CCC2)C[C@H]1C	ZINC000947974839	1333328631	/nfs/dbraw/zinc/32/86/31/1333328631.db2.gz	HJMJMUVDFUJRKO-RTBURBONSA-N	0	3	338.495	3.409	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2sccc2C(F)F)C[C@@H]1C	ZINC000947984208	1333330868	/nfs/dbraw/zinc/33/08/68/1333330868.db2.gz	GCORKOTUAWLEDA-NWDGAFQWSA-N	0	3	326.412	3.292	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2sc(Cl)nc2Cl)C[C@@H]1C	ZINC000948044345	1333352264	/nfs/dbraw/zinc/35/22/64/1333352264.db2.gz	PHHNETUOSWBYKV-IUCAKERBSA-N	0	3	334.272	3.219	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)CC2C3CC4CC(C3)CC2C4)C[C@@H]1C	ZINC000948056097	1333357807	/nfs/dbraw/zinc/35/78/07/1333357807.db2.gz	HBZFWIUDSAEWQG-UEPQMJSGSA-N	0	3	342.527	3.441	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2coc(C3CCCCC3)n2)C[C@H]1C	ZINC000948072669	1333365260	/nfs/dbraw/zinc/36/52/60/1333365260.db2.gz	AWLHZWNTGQDJIZ-ZBFHGGJFSA-N	0	3	331.460	3.491	20	30		EGEDHN
CN(C(=O)C(C)(C)F)[C@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948142833	1333390629	/nfs/dbraw/zinc/39/06/29/1333390629.db2.gz	QZRSMJMXFQHDSA-KRWDZBQOSA-N	0	3	331.435	3.119	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)C[C@H]2CCC(F)(F)C2)CC1	ZINC000948424077	1333519947	/nfs/dbraw/zinc/51/99/47/1333519947.db2.gz	GFZWUSNUFMDZGO-CVEARBPZSA-N	0	3	326.431	3.148	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2cc(F)cc3ccoc32)CC1	ZINC000948570617	1333580946	/nfs/dbraw/zinc/58/09/46/1333580946.db2.gz	NHLZTXQRVBXVIL-INIZCTEOSA-N	0	3	328.387	3.132	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)[C@H]2CCc3c2cccc3Cl)CC1	ZINC000948621079	1333599464	/nfs/dbraw/zinc/59/94/64/1333599464.db2.gz	LQILIZRQVWAJBN-YJBOKZPZSA-N	0	3	344.886	3.316	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cc3ncccc3s2)CC1	ZINC000948674392	1333623782	/nfs/dbraw/zinc/62/37/82/1333623782.db2.gz	VZIPENIDYWBRIX-HNNXBMFYSA-N	0	3	341.480	3.246	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2nccc3ccccc32)CC1	ZINC000948725866	1333647724	/nfs/dbraw/zinc/64/77/24/1333647724.db2.gz	JPBQDGDDZCFLJR-GOSISDBHSA-N	0	3	335.451	3.185	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@@H]2CCCN(Cc3oc(C)nc3C)CC2)C1	ZINC000948753753	1333662853	/nfs/dbraw/zinc/66/28/53/1333662853.db2.gz	PJNCQEBZNHRSGB-QGZVFWFLSA-N	0	3	345.487	3.461	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2ccc(C(C)C)nc2C)CC1	ZINC000948779544	1333676579	/nfs/dbraw/zinc/67/65/79/1333676579.db2.gz	OSHKFMNCOOUNQY-QGZVFWFLSA-N	0	3	327.472	3.073	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cc(F)ccc2Cl)CC1	ZINC000948809605	1333691467	/nfs/dbraw/zinc/69/14/67/1333691467.db2.gz	QBOKNKZWYULGAJ-HNNXBMFYSA-N	0	3	336.838	3.429	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cc([C@H](C)CC)no2)CC1	ZINC000948836261	1333704321	/nfs/dbraw/zinc/70/43/21/1333704321.db2.gz	AHZQBQTWWMIXMV-HZPDHXFCSA-N	0	3	331.460	3.138	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2scnc2C(C)(C)C)CC1	ZINC000948840835	1333705251	/nfs/dbraw/zinc/70/52/51/1333705251.db2.gz	NODOJWABSIGEMV-AWEZNQCLSA-N	0	3	333.501	3.000	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2c3ccccc3CCN2C(C)C)cc1	ZINC000948947229	1333743684	/nfs/dbraw/zinc/74/36/84/1333743684.db2.gz	VRIQPIHDAJMRKY-NRFANRHFSA-N	0	3	332.447	3.406	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2c3ccccc3CCN2CC2CC2)cc1	ZINC000948947062	1333743949	/nfs/dbraw/zinc/74/39/49/1333743949.db2.gz	UBCCAOZYNCEXHK-QFIPXVFZSA-N	0	3	344.458	3.407	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@]1(C)CC=C(C)CC1)CCO2	ZINC000949247759	1333802893	/nfs/dbraw/zinc/80/28/93/1333802893.db2.gz	DGRLPUKPDVSRGG-LJQANCHMSA-N	0	3	332.488	3.002	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@@]3(C)CCC[C@@H]3CC)CC2)C1	ZINC000949398644	1333837112	/nfs/dbraw/zinc/83/71/12/1333837112.db2.gz	NCOGKMDWVUUFGB-ICSRJNTNSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@]3(C)CCC[C@H]3CC)CC2)C1	ZINC000949398646	1333837973	/nfs/dbraw/zinc/83/79/73/1333837973.db2.gz	NCOGKMDWVUUFGB-UYAOXDASSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3c(C)oc(C)c3C)CC2)C1	ZINC000949411839	1333841349	/nfs/dbraw/zinc/84/13/49/1333841349.db2.gz	DLGKLLGOUJPZCF-UHFFFAOYSA-N	0	3	346.471	3.088	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@H]3CCCC[C@@H]3C)CC2)C1	ZINC000949450748	1333850675	/nfs/dbraw/zinc/85/06/75/1333850675.db2.gz	ITBJPMDCXWPHLX-OALUTQOASA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC2(CC1)CN(CCC1CC1)CCO2	ZINC000949463462	1333853920	/nfs/dbraw/zinc/85/39/20/1333853920.db2.gz	NNTBRRAKLNQPSI-LJQANCHMSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@]3(C)CCC[C@@H]3C)CC2)C1	ZINC000949463177	1333854032	/nfs/dbraw/zinc/85/40/32/1333854032.db2.gz	KXQXQZULMVIZSY-AZUAARDMSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@]3(C)CC=C(C)CC3)CC2)C1	ZINC000949529471	1333868593	/nfs/dbraw/zinc/86/85/93/1333868593.db2.gz	VPMFUUIYZFKTQE-HXUWFJFHSA-N	0	3	346.515	3.392	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C[C@@H]3CCCC[C@@H]3C)CC2)C1	ZINC000949533698	1333869948	/nfs/dbraw/zinc/86/99/48/1333869948.db2.gz	DRWIQZWABVWWDV-OALUTQOASA-N	0	3	348.531	3.472	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2cc(C)n(C(CC)CC)n2)C1	ZINC000967082585	1335657904	/nfs/dbraw/zinc/65/79/04/1335657904.db2.gz	DJIIFWLEJMQWDX-DNVCBOLYSA-N	0	3	344.503	3.016	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2cc(C)nn2C(CC)CC)C1	ZINC000967091271	1335660581	/nfs/dbraw/zinc/66/05/81/1335660581.db2.gz	UXCOJQGHIGDNGD-CRAIPNDOSA-N	0	3	344.503	3.016	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](C)[C@H](NC(=O)c2conc2C(F)(F)F)C1	ZINC000967397578	1335726543	/nfs/dbraw/zinc/72/65/43/1335726543.db2.gz	QAKHFNBYXOMITP-DGCLKSJQSA-N	0	3	345.365	3.100	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)Cc2cc3ccccc3o2)C1	ZINC000967620199	1335794509	/nfs/dbraw/zinc/79/45/09/1335794509.db2.gz	DLQKYHPUJUOPOB-QAPCUYQASA-N	0	3	326.440	3.378	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2cncc3sccc32)C1	ZINC000967919657	1335830307	/nfs/dbraw/zinc/83/03/07/1335830307.db2.gz	MANJFTJHIPHUPW-CJNGLKHVSA-N	0	3	329.469	3.313	20	30		EGEDHN
C=C(C)CCN1CC[C@H](C)[C@@H](NC(=O)c2ocnc2C(F)F)C1	ZINC000968331097	1335891885	/nfs/dbraw/zinc/89/18/85/1335891885.db2.gz	KCLLFDIUAVDNHF-RYUDHWBXSA-N	0	3	327.375	3.019	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2cnc(-c3ccoc3)s2)C1	ZINC000968400156	1335920332	/nfs/dbraw/zinc/92/03/32/1335920332.db2.gz	MVYACYWCPJCNAI-UKRRQHHQSA-N	0	3	345.468	3.419	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cc3cccnc3s2)C1	ZINC000968501700	1335944048	/nfs/dbraw/zinc/94/40/48/1335944048.db2.gz	ZEKYYHJRXLZFMY-HIFRSBDPSA-N	0	3	329.469	3.313	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CN(CC3=CCCCC3)CC[C@H]2C)nc1	ZINC000968549420	1335960057	/nfs/dbraw/zinc/96/00/57/1335960057.db2.gz	QNGKEAMKYILDCO-OXQOHEQNSA-N	0	3	337.467	3.004	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)Cc2cccc3ccccc32)C1	ZINC000968568544	1335962815	/nfs/dbraw/zinc/96/28/15/1335962815.db2.gz	ASDSZMSPSNEVBF-LAUBAEHRSA-N	0	3	334.463	3.232	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cc(Cl)cc(Cl)c2)C1	ZINC000968583925	1335973435	/nfs/dbraw/zinc/97/34/35/1335973435.db2.gz	RBXHVLRUOLHUHF-WBMJQRKESA-N	0	3	339.266	3.457	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2cc(Cl)cc(Cl)c2)C1	ZINC000968583922	1335973496	/nfs/dbraw/zinc/97/34/96/1335973496.db2.gz	RBXHVLRUOLHUHF-BLLLJJGKSA-N	0	3	339.266	3.457	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N[C@@H]2CN(CC(=C)C)CC[C@H]2C)cc1	ZINC000968685251	1336010945	/nfs/dbraw/zinc/01/09/45/1336010945.db2.gz	PJXSGLARGVYHOZ-YLJYHZDGSA-N	0	3	342.483	3.197	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N[C@H]2CN(CC(=C)C)CC[C@@H]2C)cc1	ZINC000968685249	1336011158	/nfs/dbraw/zinc/01/11/58/1336011158.db2.gz	PJXSGLARGVYHOZ-PXNSSMCTSA-N	0	3	342.483	3.197	20	30		EGEDHN
N#Cc1ccc(CN2CCCCC[C@@H]2CNC(=O)c2ccc[nH]2)cc1	ZINC000968754204	1336039031	/nfs/dbraw/zinc/03/90/31/1336039031.db2.gz	YKBMHHLHRXTMQE-GOSISDBHSA-N	0	3	336.439	3.061	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1cc(C(C)C)n(C)n1	ZINC000968847314	1336066639	/nfs/dbraw/zinc/06/66/39/1336066639.db2.gz	URVLATZTKYNQPT-INIZCTEOSA-N	0	3	332.492	3.094	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1cc(C(C)C)n(C)n1	ZINC000968847316	1336066993	/nfs/dbraw/zinc/06/69/93/1336066993.db2.gz	URVLATZTKYNQPT-MRXNPFEDSA-N	0	3	332.492	3.094	20	30		EGEDHN
C#CCCN1CCCCC[C@H]1CNC(=O)c1nc(C(C)(C)C)cs1	ZINC000968898688	1336084747	/nfs/dbraw/zinc/08/47/47/1336084747.db2.gz	HRQOCZVRAVRYSR-HNNXBMFYSA-N	0	3	347.528	3.438	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@H]2CCCCCN2CC#CC)cc1	ZINC000968923183	1336090443	/nfs/dbraw/zinc/09/04/43/1336090443.db2.gz	MUJDEEGUAYRJBF-LJQANCHMSA-N	0	3	340.467	3.249	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)[C@@H]1CCc2ccc(F)cc2O1	ZINC000968952654	1336101527	/nfs/dbraw/zinc/10/15/27/1336101527.db2.gz	VUKHNMOHKFVADQ-ROUUACIJSA-N	0	3	346.446	3.066	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)[C@@H]1CCCCC1(F)F	ZINC000968967817	1336104489	/nfs/dbraw/zinc/10/44/89/1336104489.db2.gz	BKFWHPZYYWRLEJ-CVEARBPZSA-N	0	3	326.431	3.196	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1ncoc1[C@H]1CCCO1	ZINC000968972956	1336105650	/nfs/dbraw/zinc/10/56/50/1336105650.db2.gz	BJCDOYADOKBWLL-JKSUJKDBSA-N	0	3	347.459	3.077	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1cc2cc(C)ccc2[nH]1	ZINC000968977085	1336107199	/nfs/dbraw/zinc/10/71/99/1336107199.db2.gz	ODSZSBDDEQIARK-GOSISDBHSA-N	0	3	337.467	3.474	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1cc2cc(F)ccc2[nH]1	ZINC000968977415	1336107780	/nfs/dbraw/zinc/10/77/80/1336107780.db2.gz	UTKJZLXELOOBJC-QGZVFWFLSA-N	0	3	341.430	3.305	20	30		EGEDHN
C#CCCN1CCCCC[C@H]1CNC(=O)c1oc(CC(C)C)nc1C	ZINC000969062553	1336134980	/nfs/dbraw/zinc/13/49/80/1336134980.db2.gz	ONJKPCYTYLGZTP-KRWDZBQOSA-N	0	3	345.487	3.179	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1ccc(F)cc1	ZINC000969164075	1336168566	/nfs/dbraw/zinc/16/85/66/1336168566.db2.gz	JPLALDLMZHUPLH-CEXWTWQISA-N	0	3	330.447	3.476	20	30		EGEDHN
CC(C)(C)[C@@H]1C[C@H]1C(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC000969307806	1336197436	/nfs/dbraw/zinc/19/74/36/1336197436.db2.gz	ZQCQTSGABMFZLE-BRWVUGGUSA-N	0	3	343.446	3.070	20	30		EGEDHN
CC1(C)CCC[C@H]1C(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C1	ZINC000969623131	1336229897	/nfs/dbraw/zinc/22/98/97/1336229897.db2.gz	QMUAXUKWDLVKMJ-CJNGLKHVSA-N	0	3	331.485	3.137	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](C)C2CN(CC3CC(F)(F)C3)C2)CC1	ZINC000970376340	1336300134	/nfs/dbraw/zinc/30/01/34/1336300134.db2.gz	KGUFTVWPNUSPGF-CYBMUJFWSA-N	0	3	326.431	3.215	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2nc(Cl)sc2Cl)CC1	ZINC001005819274	1336404428	/nfs/dbraw/zinc/40/44/28/1336404428.db2.gz	VBWKWSZDAPJUGP-UHFFFAOYSA-N	0	3	334.272	3.172	20	30		EGEDHN
CN(C(=O)C(C)(C)C1CC1)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001005855014	1336410903	/nfs/dbraw/zinc/41/09/03/1336410903.db2.gz	XJCUVDWTQZDOPE-UHFFFAOYSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccc(F)c(F)c2F)CC1	ZINC001005899838	1336418335	/nfs/dbraw/zinc/41/83/35/1336418335.db2.gz	AKXVVFWCAAZXNK-UHFFFAOYSA-N	0	3	326.362	3.216	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2ncoc2-c2cccs2)CC1	ZINC001006149861	1336460610	/nfs/dbraw/zinc/46/06/10/1336460610.db2.gz	DZYFTJDSJVIWPO-UHFFFAOYSA-N	0	3	331.441	3.126	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)[C@@]2(c3ccccc3)CC2(C)C)CC1	ZINC001006185476	1336463864	/nfs/dbraw/zinc/46/38/64/1336463864.db2.gz	XLBPXVYVRVIONW-NRFANRHFSA-N	0	3	326.484	3.463	20	30		EGEDHN
CC[C@@]1(C)C[C@@H]1C(=O)N(C)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001006224483	1336470704	/nfs/dbraw/zinc/47/07/04/1336470704.db2.gz	JUEDHTMKRXDBCB-CTNGQTDRSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cccc(NC(C)=O)c2C)CC1	ZINC001006293150	1336484596	/nfs/dbraw/zinc/48/45/96/1336484596.db2.gz	WWNMNWDAQFRZMA-UHFFFAOYSA-N	0	3	343.471	3.066	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)[C@@]2(c3ccccc3)C[C@H](F)C2)CC1	ZINC001006356133	1336493932	/nfs/dbraw/zinc/49/39/32/1336493932.db2.gz	LOQDPNMPCNHURS-IRJFHVNHSA-N	0	3	330.447	3.165	20	30		EGEDHN
CC[C@H](c1ccccc1)N1CCC[C@H](NC(=O)c2cc(C#N)c[nH]2)C1	ZINC001007031036	1336628365	/nfs/dbraw/zinc/62/83/65/1336628365.db2.gz	UOHPBKVXRUBEKP-PKOBYXMFSA-N	0	3	336.439	3.232	20	30		EGEDHN
Cc1cccc([C@@H](C)N2CCC[C@H](NC(=O)c3cc(C#N)c[nH]3)C2)c1	ZINC001007030018	1336628724	/nfs/dbraw/zinc/62/87/24/1336628724.db2.gz	PNEPUWKDHHNOJO-QAPCUYQASA-N	0	3	336.439	3.150	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2c(Cl)cncc2Cl)C1	ZINC001008411445	1336845274	/nfs/dbraw/zinc/84/52/74/1336845274.db2.gz	MRNKEDVTQVNWOL-LLVKDONJSA-N	0	3	328.243	3.159	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N[C@@H]1CCCN(Cc2ccccc2C)C1	ZINC001008845710	1336933096	/nfs/dbraw/zinc/93/30/96/1336933096.db2.gz	LLGFRECGDVRVOX-AABGKKOBSA-N	0	3	342.483	3.057	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N[C@H]1CCCN(Cc2ccc(C)cc2)C1	ZINC001008858560	1336933500	/nfs/dbraw/zinc/93/35/00/1336933500.db2.gz	YZUTYCWDCGMLCA-UFYCRDLUSA-N	0	3	342.483	3.057	20	30		EGEDHN
C#CCCN1CCC[C@H](NC(=O)c2ccc(O[C@@H](C)CC)cc2)C1	ZINC001009105708	1336970063	/nfs/dbraw/zinc/97/00/63/1336970063.db2.gz	COPNELHXTSQRHY-WMZOPIPTSA-N	0	3	328.456	3.081	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2cnn(C(CC)CC)c2C)C1	ZINC001009121738	1336972482	/nfs/dbraw/zinc/97/24/82/1336972482.db2.gz	BTCCQRFTIGMQEP-MRXNPFEDSA-N	0	3	332.492	3.323	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2cnn(C(CC)CC)c2C)C1	ZINC001009121737	1336972513	/nfs/dbraw/zinc/97/25/13/1336972513.db2.gz	BTCCQRFTIGMQEP-INIZCTEOSA-N	0	3	332.492	3.323	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2cnn(C(C)C)c2C2CC2)C1	ZINC001009139529	1336975328	/nfs/dbraw/zinc/97/53/28/1336975328.db2.gz	IZVWWCQXRXPUNA-INIZCTEOSA-N	0	3	330.476	3.112	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](NC(=O)c2ccc(-c3ccncc3)o2)C1	ZINC001014716168	1337880559	/nfs/dbraw/zinc/88/05/59/1337880559.db2.gz	JSGKTQPCUSIFRW-MRXNPFEDSA-N	0	3	325.412	3.112	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(Cc3cccc(CC)c3)C2)cc1	ZINC001015482608	1338155310	/nfs/dbraw/zinc/15/53/10/1338155310.db2.gz	NVQSHWQRHXZMEB-OAQYLSRUSA-N	0	3	332.447	3.235	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3cc(C)cc(C)c3)C2)cc1	ZINC001015483417	1338155954	/nfs/dbraw/zinc/15/59/54/1338155954.db2.gz	WIXTTZACKRJRLH-NRFANRHFSA-N	0	3	332.447	3.289	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(CCCc3ccccc3OC)C2)C1	ZINC001015676002	1338252933	/nfs/dbraw/zinc/25/29/33/1338252933.db2.gz	HBYHANRLRRPAFJ-GOSISDBHSA-N	0	3	342.483	3.175	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@H]1CCN(Cc2cc(C)cc(C)c2)C1	ZINC001016108757	1338465728	/nfs/dbraw/zinc/46/57/28/1338465728.db2.gz	WPOJFFFNQPKHSP-QFIPXVFZSA-N	0	3	346.474	3.218	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N[C@H]1CC12CCN(Cc1cccc(C#N)c1)CC2	ZINC001016577690	1338654204	/nfs/dbraw/zinc/65/42/04/1338654204.db2.gz	YOVNKDQHNBYXQT-ROUUACIJSA-N	0	3	337.467	3.075	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)Cc2ccc(C)c(Cl)c2)CC1	ZINC001016687024	1338689788	/nfs/dbraw/zinc/68/97/88/1338689788.db2.gz	CBSBGLTWLYMXAG-GOSISDBHSA-N	0	3	344.886	3.185	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2[nH]c3ccccc3c2Cl)CC1	ZINC001016706873	1338697441	/nfs/dbraw/zinc/69/74/41/1338697441.db2.gz	NNXWDWMEWVAZQJ-HNNXBMFYSA-N	0	3	341.842	3.039	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(OC)c(C(C)C)c2)CC1	ZINC001016711321	1338699382	/nfs/dbraw/zinc/69/93/82/1338699382.db2.gz	FJDJVTJMWRQWQM-IBGZPJMESA-N	0	3	340.467	3.036	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cn(CC)c3ccccc23)CC1	ZINC001016718944	1338701288	/nfs/dbraw/zinc/70/12/88/1338701288.db2.gz	ITQYURGTCDUMNK-HXUWFJFHSA-N	0	3	349.478	3.269	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cc3c(cc(C)cc3C)[nH]2)CC1	ZINC001016753199	1338712319	/nfs/dbraw/zinc/71/23/19/1338712319.db2.gz	IPEKQGMMRIMGNU-HXUWFJFHSA-N	0	3	349.478	3.392	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CC23CCN(C[C@H](F)CC)CC3)cc1	ZINC001016760718	1338715315	/nfs/dbraw/zinc/71/53/15/1338715315.db2.gz	CIRQOJOIVGLKHI-QZTJIDSGSA-N	0	3	328.431	3.000	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)Cc2ccc(F)cc2Cl)CC1	ZINC001016810155	1338734261	/nfs/dbraw/zinc/73/42/61/1338734261.db2.gz	HXVKBDSKKKHHGU-QGZVFWFLSA-N	0	3	348.849	3.016	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cc3occc3s2)CC1	ZINC001016821598	1338738668	/nfs/dbraw/zinc/73/86/68/1338738668.db2.gz	AKNVLTYAQWWAPH-INIZCTEOSA-N	0	3	328.437	3.102	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2coc3ccc(F)cc32)CC1	ZINC001016947211	1338780548	/nfs/dbraw/zinc/78/05/48/1338780548.db2.gz	LOKVKFDQOAGQFZ-GOSISDBHSA-N	0	3	340.398	3.180	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)C23CC(C(C)(C)C)(C2)C3)CC1	ZINC001016993930	1338797362	/nfs/dbraw/zinc/79/73/62/1338797362.db2.gz	QGVPKUZCWZLBMW-YMTQGWHGSA-N	0	3	328.500	3.197	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCCN(C(=O)C(C)(C)F)C1	ZINC001017016359	1338809000	/nfs/dbraw/zinc/80/90/00/1338809000.db2.gz	BULCMAOTCXAILT-CYBMUJFWSA-N	0	3	337.464	3.038	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1C[C@H]1c1ccsc1	ZINC001017661894	1339386661	/nfs/dbraw/zinc/38/66/61/1339386661.db2.gz	CGFQIVQFSBZLDZ-XWTMOSNGSA-N	0	3	330.497	3.493	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2c(c1)[C@H](C)CO2	ZINC001017834432	1339428239	/nfs/dbraw/zinc/42/82/39/1339428239.db2.gz	PBOSRULZEFVGNA-NXHRZFHOSA-N	0	3	340.467	3.438	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)Cc1ccccc1F	ZINC001017937536	1339459916	/nfs/dbraw/zinc/45/99/16/1339459916.db2.gz	RBSHZASPIQKJMG-NXHRZFHOSA-N	0	3	330.447	3.256	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cnc2ccccc2c1	ZINC001017997858	1339478966	/nfs/dbraw/zinc/47/89/66/1339478966.db2.gz	FXZFDFCZCNYTMD-KDURUIRLSA-N	0	3	335.451	3.490	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1C[C@H]1c1ccccc1OC	ZINC001018045916	1339490316	/nfs/dbraw/zinc/49/03/16/1339490316.db2.gz	RSWLMOXHERIRSH-OGWHTMIXSA-N	0	3	340.467	3.050	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)COc1c(C)cccc1C	ZINC001018241758	1339545879	/nfs/dbraw/zinc/54/58/79/1339545879.db2.gz	KEISHKYMFSDDHX-KDURUIRLSA-N	0	3	342.483	3.324	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)COc1ccc(C)cc1	ZINC001018241677	1339546019	/nfs/dbraw/zinc/54/60/19/1339546019.db2.gz	GTISXAGSWPQEPT-HDICACEKSA-N	0	3	328.456	3.015	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)C(F)=C3CCCC3)C2)cc1F	ZINC001018709084	1339708041	/nfs/dbraw/zinc/70/80/41/1339708041.db2.gz	CYBOIIPUMCXKMR-INIZCTEOSA-N	0	3	345.393	3.185	20	30		EGEDHN
C[C@]1(C(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)CC=CCC1	ZINC001018906344	1339749605	/nfs/dbraw/zinc/74/96/05/1339749605.db2.gz	LLNPPCBXOJQRAV-KSSFIOAISA-N	0	3	329.469	3.057	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@H]2CCCN2Cc2ccc(C)c(C)c2)c1	ZINC001028127350	1340446097	/nfs/dbraw/zinc/44/60/97/1340446097.db2.gz	VUTLGEJSBZNSSF-OAQYLSRUSA-N	0	3	347.462	3.074	20	30		EGEDHN
C=CCCN1CCC[C@@H]1CNC(=O)c1sc(CC2CC2)nc1C	ZINC001028225816	1340492992	/nfs/dbraw/zinc/49/29/92/1340492992.db2.gz	BUDMEQHSUDTSQA-OAHLLOKOSA-N	0	3	333.501	3.174	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1ncc(Cl)cc1Cl	ZINC001028226623	1340493803	/nfs/dbraw/zinc/49/38/03/1340493803.db2.gz	RUPAZPUMYXZLMA-GFCCVEGCSA-N	0	3	328.243	3.159	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1ccc(C(F)(F)F)cc1	ZINC001028281958	1340536458	/nfs/dbraw/zinc/53/64/58/1340536458.db2.gz	SBVJIBHEXGXGOU-HNNXBMFYSA-N	0	3	326.362	3.476	20	30		EGEDHN
Cc1cc(C(=O)NC[C@H]2CCN(Cc3ccc(C#N)cc3)C2)oc1C	ZINC001028478760	1340664661	/nfs/dbraw/zinc/66/46/61/1340664661.db2.gz	SMIPTRUTQXXTJS-GOSISDBHSA-N	0	3	337.423	3.020	20	30		EGEDHN
Cc1sccc1C(=O)NC[C@@H]1CCN(Cc2ccc(C#N)cc2)C1	ZINC001028532863	1340691615	/nfs/dbraw/zinc/69/16/15/1340691615.db2.gz	RIKGJDOEFHBZNU-KRWDZBQOSA-N	0	3	339.464	3.180	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)c2cc3cccc(C)c3s2)C1	ZINC001028643553	1340739177	/nfs/dbraw/zinc/73/91/77/1340739177.db2.gz	PVHLFYLPCDIXNI-HNNXBMFYSA-N	0	3	326.465	3.285	20	30		EGEDHN
CC(C)(C)[C@@H]1C[C@H]1C(=O)NC[C@@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC001028683843	1340756471	/nfs/dbraw/zinc/75/64/71/1340756471.db2.gz	HDNYWZYNCHULHP-IPMKNSEASA-N	0	3	339.483	3.179	20	30		EGEDHN
CC1(C)CCC[C@H]1C(=O)NC[C@@H]1CCN(Cc2ccc(C#N)cc2)C1	ZINC001028745581	1340786232	/nfs/dbraw/zinc/78/62/32/1340786232.db2.gz	DUULDXAGYHEBLI-OALUTQOASA-N	0	3	339.483	3.323	20	30		EGEDHN
CC1(C)CC[C@H](C(=O)NC[C@H]2CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001028782028	1340813450	/nfs/dbraw/zinc/81/34/50/1340813450.db2.gz	ADKROZDXSYITGU-MOPGFXCFSA-N	0	3	339.483	3.323	20	30		EGEDHN
CS[C@H](C)C(=O)N1CCC([C@@H](C)NCc2ccccc2C#N)CC1	ZINC001029054493	1340920125	/nfs/dbraw/zinc/92/01/25/1340920125.db2.gz	WEVPVDSNFWNWOH-HUUCEWRRSA-N	0	3	345.512	3.026	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)C1CCN(C(=O)CC2CCC2)CC1	ZINC001029078792	1340925486	/nfs/dbraw/zinc/92/54/86/1340925486.db2.gz	SRUVLWKPDDJKRC-INIZCTEOSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)C1CCN(C(=O)CC2(C)CC2)CC1	ZINC001029118859	1340934572	/nfs/dbraw/zinc/93/45/72/1340934572.db2.gz	MOUDQOGERQRGBE-INIZCTEOSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC([C@@H](C)NCc2nccn2CC)CC1	ZINC001029136746	1340939754	/nfs/dbraw/zinc/93/97/54/1340939754.db2.gz	KYMXWSPWHYWSTN-OXQOHEQNSA-N	0	3	346.519	3.222	20	30		EGEDHN
O=C(C#CC1CC1)N1C[C@H]2CC[C@@H](C1)N2CC[C@H]1CCc2ccccc21	ZINC001029302884	1340969209	/nfs/dbraw/zinc/96/92/09/1340969209.db2.gz	VOUSFZAMYXLHJD-NJYVYQBISA-N	0	3	348.490	3.195	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CC[C@@H](C1)N2CC1CC(F)(F)C1	ZINC001029419833	1340986160	/nfs/dbraw/zinc/98/61/60/1340986160.db2.gz	KSPWNHZGYBBGME-GASCZTMLSA-N	0	3	326.431	3.309	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H](CN(C)Cc2cccnc2)C1	ZINC001029749195	1341062735	/nfs/dbraw/zinc/06/27/35/1341062735.db2.gz	UEQPZCGIFLWXNT-INIZCTEOSA-N	0	3	335.879	3.141	20	30		EGEDHN
C#CCCN1CCC[C@@H](N(Cc2ccccc2)C(=O)[C@H]2CC23CC3)C1	ZINC001029920856	1341120231	/nfs/dbraw/zinc/12/02/31/1341120231.db2.gz	AIRPNMYYTVLIDW-WOJBJXKFSA-N	0	3	336.479	3.303	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC(CN(C)Cc2ccc(C#N)cc2F)CC1	ZINC001029954001	1341133582	/nfs/dbraw/zinc/13/35/82/1341133582.db2.gz	OUDPFZCBKZTDQT-SYZQJQIISA-N	0	3	343.446	3.334	20	30		EGEDHN
CN(Cc1ccc(F)cc1F)CC1CCN(C(=O)C#CC2CC2)CC1	ZINC001029965029	1341136902	/nfs/dbraw/zinc/13/69/02/1341136902.db2.gz	IXCNMCDZXPXKDI-UHFFFAOYSA-N	0	3	346.421	3.049	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC(CN(C)Cc2cnc(C)cn2)CC1	ZINC001029992307	1341149415	/nfs/dbraw/zinc/14/94/15/1341149415.db2.gz	SFOZYJNBUVAAKB-HXUWFJFHSA-N	0	3	344.503	3.058	20	30		EGEDHN
C=C(Cl)CN1C[C@H](NC(=O)c2cccc3nc(C)[nH]c32)CC[C@@H]1C	ZINC001071968389	1355050492	/nfs/dbraw/zinc/05/04/92/1355050492.db2.gz	UOLQSAWEXIVDHN-GXTWGEPZSA-N	0	3	346.862	3.207	20	30		EGEDHN
C=CCn1cccc1C(=O)NCC1CN(Cc2cc(C)cc(C)c2)C1	ZINC001031731239	1341394631	/nfs/dbraw/zinc/39/46/31/1341394631.db2.gz	PWWXNXNGGDZAOI-UHFFFAOYSA-N	0	3	337.467	3.153	20	30		EGEDHN
C#Cc1ccc(C(=O)NCC2CN(Cc3c(C)cccc3C)C2)cc1	ZINC001031892736	1341417797	/nfs/dbraw/zinc/41/77/97/1341417797.db2.gz	QDARQADMIXXCBW-UHFFFAOYSA-N	0	3	332.447	3.147	20	30		EGEDHN
C#CCOc1ccc(C(=O)NCC2CN([C@H](C)c3ccccc3)C2)cc1	ZINC001032030726	1341442638	/nfs/dbraw/zinc/44/26/38/1341442638.db2.gz	DVNGOZCVMNEXGI-QGZVFWFLSA-N	0	3	348.446	3.121	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cccc(-n2cccc2)c1	ZINC001032504100	1341524769	/nfs/dbraw/zinc/52/47/69/1341524769.db2.gz	ILNKDSDCNWXLFE-PMACEKPBSA-N	0	3	335.451	3.342	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H]2C[C@H]1CN2C[C@@H](OC)C1CCCC1	ZINC001032557857	1341539575	/nfs/dbraw/zinc/53/95/75/1341539575.db2.gz	SZZURSCBKFALDD-OKZBNKHCSA-N	0	3	334.504	3.079	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cncc2sccc21	ZINC001032585624	1341550052	/nfs/dbraw/zinc/55/00/52/1341550052.db2.gz	PDHNUWPBCKPJAS-KBPBESRZSA-N	0	3	327.453	3.161	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1csc(C(C)(C)C)n1	ZINC001032684515	1341581646	/nfs/dbraw/zinc/58/16/46/1341581646.db2.gz	AOZGXDREMKPYSW-HOTGVXAUSA-N	0	3	347.528	3.234	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H](c1cccnc1)C(C)C	ZINC001032699915	1341585384	/nfs/dbraw/zinc/58/53/84/1341585384.db2.gz	BXXYTJCPUVZMBU-FHWLQOOXSA-N	0	3	327.472	3.073	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)CCc1cc(C)cc(C)c1	ZINC001032715989	1341589791	/nfs/dbraw/zinc/58/97/91/1341589791.db2.gz	KUDHJJFKJNTJRP-PMACEKPBSA-N	0	3	326.484	3.487	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cnn(CCCC)c1CC	ZINC001032723448	1341591579	/nfs/dbraw/zinc/59/15/79/1341591579.db2.gz	IBFUMUSZCGDVLS-IRXDYDNUSA-N	0	3	344.503	3.111	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)C[C@H](C)c1ccccc1OC	ZINC001032739210	1341596316	/nfs/dbraw/zinc/59/63/16/1341596316.db2.gz	LUCGZBJIECUKLO-ULQDDVLXSA-N	0	3	328.456	3.050	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H](C)Cc1ccc(C)cc1	ZINC001032806032	1341620069	/nfs/dbraw/zinc/62/00/69/1341620069.db2.gz	FBRHIZJRJHSIJO-IHPCNDPISA-N	0	3	326.484	3.425	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(N(C)C(C)C)cc1	ZINC001032814570	1341625016	/nfs/dbraw/zinc/62/50/16/1341625016.db2.gz	DAWKAYYMLKJSHH-OALUTQOASA-N	0	3	327.472	3.006	20	30		EGEDHN
C=CCOc1ccc(C(=O)N(C)[C@@H]2CCN(CC=C(C)C)C2)cc1	ZINC001033204235	1341751713	/nfs/dbraw/zinc/75/17/13/1341751713.db2.gz	QDBGNVGGCYSBOW-GOSISDBHSA-N	0	3	328.456	3.364	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2cc(C)nn2C(CC)CC)C1	ZINC001033214397	1341754233	/nfs/dbraw/zinc/75/42/33/1341754233.db2.gz	MTQFMXSAGLUCQL-QGZVFWFLSA-N	0	3	332.492	3.275	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@@H]2CCN(CCOc3cccc(C)c3)C2)C1	ZINC001033394547	1341811249	/nfs/dbraw/zinc/81/12/49/1341811249.db2.gz	WHTKUOHFADXWMJ-GOSISDBHSA-N	0	3	342.483	3.263	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2ccc3nc(C)sc3c2)C1	ZINC001033560079	1341872601	/nfs/dbraw/zinc/87/26/01/1341872601.db2.gz	WOZUWQRBLZJASQ-OAHLLOKOSA-N	0	3	329.469	3.327	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2csc([C@H]3CCCO3)n2)C1	ZINC001033828805	1342029001	/nfs/dbraw/zinc/02/90/01/1342029001.db2.gz	RMGMVOKLPLPBPB-GOEBONIOSA-N	0	3	349.500	3.107	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC001033830570	1342030837	/nfs/dbraw/zinc/03/08/37/1342030837.db2.gz	KNWGWYKLCXBFKS-CQSZACIVSA-N	0	3	338.373	3.323	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@@H]2CCc3ccc(OC)cc32)C1	ZINC001033860648	1342048436	/nfs/dbraw/zinc/04/84/36/1342048436.db2.gz	GLRKMVHOBUWZGM-IEBWSBKVSA-N	0	3	342.483	3.224	20	30		EGEDHN
CC(C)(C)C(=O)N[C@@H]1C[C@@H](NCc2ccc(C#N)cc2F)C12CCC2	ZINC001078788810	1357084487	/nfs/dbraw/zinc/08/44/87/1357084487.db2.gz	MIUCLNOCZXAXHQ-IAGOWNOFSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@@H]2C[C@H]2c2ccccc2F)C1	ZINC001033979650	1342127411	/nfs/dbraw/zinc/12/74/11/1342127411.db2.gz	KMCGYKUNWGLLSB-RYQLBKOJSA-N	0	3	330.447	3.428	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccnc(O[C@H](C)CC)c2)C1	ZINC001034014174	1342150626	/nfs/dbraw/zinc/15/06/26/1342150626.db2.gz	YSKTVCDIKASUCG-SJLPKXTDSA-N	0	3	345.487	3.371	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2cnn(C(CC)CC)c2C)C1	ZINC001034017069	1342153980	/nfs/dbraw/zinc/15/39/80/1342153980.db2.gz	PIUQEXRIMKNSPR-GOSISDBHSA-N	0	3	344.503	3.112	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2csc3c2CCCC3)C1	ZINC001034035390	1342175501	/nfs/dbraw/zinc/17/55/01/1342175501.db2.gz	KSSHEBLMAPIZHK-HNNXBMFYSA-N	0	3	330.497	3.187	20	30		EGEDHN
C=CCCN1CC[C@@H](N(CC)C(=O)c2ccc(P(C)(C)=O)cc2)C1	ZINC001034047299	1342186886	/nfs/dbraw/zinc/18/68/86/1342186886.db2.gz	FWMNYAAERFZKNR-QGZVFWFLSA-N	0	3	348.427	3.047	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2coc(Br)c2)C1	ZINC001034233977	1342336631	/nfs/dbraw/zinc/33/66/31/1342336631.db2.gz	JVKARTFQRAKTFF-CYBMUJFWSA-N	0	3	341.249	3.203	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@@H]2CCOc3c(F)cccc32)C1	ZINC001034296261	1342379851	/nfs/dbraw/zinc/37/98/51/1342379851.db2.gz	NLPPMCWUPRWSMD-DOTOQJQBSA-N	0	3	346.446	3.239	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)c2nsc3ccc(C)cc32)C1	ZINC001034346522	1342417409	/nfs/dbraw/zinc/41/74/09/1342417409.db2.gz	STEXQORTGSGAGK-AWEZNQCLSA-N	0	3	329.469	3.375	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc(F)c(F)c2F)C1	ZINC001034374070	1342442118	/nfs/dbraw/zinc/44/21/18/1342442118.db2.gz	XMYKWBYWQMJXAY-LBPRGKRZSA-N	0	3	326.362	3.264	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cc3cc(OC)ccc3[nH]2)C1	ZINC001034377960	1342447515	/nfs/dbraw/zinc/44/75/15/1342447515.db2.gz	HITMPFJVOOZTFL-INIZCTEOSA-N	0	3	341.455	3.337	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H]1CCCCN(Cc2csc(C)c2)C1	ZINC001034409263	1342471283	/nfs/dbraw/zinc/47/12/83/1342471283.db2.gz	QKQMLMDJCSQEAA-KURKYZTESA-N	0	3	348.512	3.118	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2c[nH]c(=O)c3ccccc23)C1	ZINC001034429737	1342491297	/nfs/dbraw/zinc/49/12/97/1342491297.db2.gz	AMVJSPQKYWRYDF-HNNXBMFYSA-N	0	3	339.439	3.101	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@@H]2OCC[C@@H]2c2ccccc2)C1	ZINC001034441304	1342503084	/nfs/dbraw/zinc/50/30/84/1342503084.db2.gz	FHBCACWXHDEFJY-VAMGGRTRSA-N	0	3	342.483	3.106	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cccc(-n3ccnc3)c2)C1	ZINC001034467662	1342522161	/nfs/dbraw/zinc/52/21/61/1342522161.db2.gz	MSWIPVOVKVXICQ-SFHVURJKSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cnn(CCCC)c2C)C1	ZINC001034482981	1342540168	/nfs/dbraw/zinc/54/01/68/1342540168.db2.gz	IADUSUWDTWUBOI-QGZVFWFLSA-N	0	3	332.492	3.152	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cnn(CCC(C)C)c2C)C1	ZINC001034483510	1342540989	/nfs/dbraw/zinc/54/09/89/1342540989.db2.gz	LHBHJUNADNESOR-SFHVURJKSA-N	0	3	346.519	3.398	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@]2(c3ccccc3)CCCO2)C1	ZINC001034501708	1342559466	/nfs/dbraw/zinc/55/94/66/1342559466.db2.gz	ZJIFKRATIJCVHV-TZIWHRDSSA-N	0	3	342.483	3.239	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2ccsc2C(F)F)C1	ZINC001034506373	1342564379	/nfs/dbraw/zinc/56/43/79/1342564379.db2.gz	OYTJYEFKXRCXJJ-LBPRGKRZSA-N	0	3	326.412	3.293	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2cc3cccc(F)c3o2)C1	ZINC001034543108	1342604078	/nfs/dbraw/zinc/60/40/78/1342604078.db2.gz	VUWQLEOEXXAAFC-OAHLLOKOSA-N	0	3	328.387	3.180	20	30		EGEDHN
C=C(Cl)CN1CCCC[C@@H](NC(=O)c2ccccc2CN(C)C)C1	ZINC001034545069	1342607318	/nfs/dbraw/zinc/60/73/18/1342607318.db2.gz	XRBXREUNVSDKHI-QGZVFWFLSA-N	0	3	349.906	3.085	20	30		EGEDHN
N#Cc1ccc(F)cc1CN[C@H]1CC[C@H](NC(=O)CC2CC2)CC1	ZINC001034579874	1342625729	/nfs/dbraw/zinc/62/57/29/1342625729.db2.gz	LRQFJHDGMAOIOB-IYARVYRRSA-N	0	3	329.419	3.014	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC[C@H](NCc3cc(C4CC4)no3)CC2)C1	ZINC001034730140	1342725505	/nfs/dbraw/zinc/72/55/05/1342725505.db2.gz	RGLLXICSMBHDLT-WKILWMFISA-N	0	3	343.471	3.425	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cccc(N(C)C)c2)C12CCC2	ZINC001078794415	1357088240	/nfs/dbraw/zinc/08/82/40/1357088240.db2.gz	HOMFQFFHGHOAEN-DLBZAZTESA-N	0	3	347.890	3.136	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2ccc(N(C)C)cc2)C12CCC2	ZINC001078795544	1357089012	/nfs/dbraw/zinc/08/90/12/1357089012.db2.gz	RSRAJLJILCVPGL-IAGOWNOFSA-N	0	3	347.890	3.136	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)Cc2cccs2)s1	ZINC001034843491	1342797100	/nfs/dbraw/zinc/79/71/00/1342797100.db2.gz	NBHYKFQPRPODRO-CYBMUJFWSA-N	0	3	345.493	3.005	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)c2ccsc2)cc1F	ZINC001034854035	1342805538	/nfs/dbraw/zinc/80/55/38/1342805538.db2.gz	TZMWVOCVWJZLDY-MRXNPFEDSA-N	0	3	343.427	3.153	20	30		EGEDHN
CC(C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)c(F)c1)=C1CCC1	ZINC001034932900	1342842580	/nfs/dbraw/zinc/84/25/80/1342842580.db2.gz	POTSIHCTOHLYCL-GOSISDBHSA-N	0	3	341.430	3.278	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H]1CNCc1ccc(Cl)nc1	ZINC001035035210	1342888775	/nfs/dbraw/zinc/88/87/75/1342888775.db2.gz	GZCLMDVWSJLENG-QAPCUYQASA-N	0	3	335.879	3.418	20	30		EGEDHN
C[C@@H](CC(=O)N1CCC[C@@H]1CNCc1ccc(C#N)c(F)c1)C1CC1	ZINC001035136301	1342951917	/nfs/dbraw/zinc/95/19/17/1342951917.db2.gz	XGHFVHGXOHGHPK-KBXCAEBGSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc3oc(C)nc3c1)CC2	ZINC001035729557	1343156672	/nfs/dbraw/zinc/15/66/72/1343156672.db2.gz	ADJGPQRNPYPMJW-UHFFFAOYSA-N	0	3	339.439	3.250	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cccc(C(C)C)n1)CC2	ZINC001035743752	1343164705	/nfs/dbraw/zinc/16/47/05/1343164705.db2.gz	PRIJKROVCDTUCM-UHFFFAOYSA-N	0	3	327.472	3.319	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cc3c(cc(C)cc3C)[nH]1)CC2	ZINC001035762313	1343175670	/nfs/dbraw/zinc/17/56/70/1343175670.db2.gz	VLBCFLAMBIKFJP-UHFFFAOYSA-N	0	3	349.478	3.346	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC2(CN(C[C@@H]3CC[C@H](C)O3)C2)CC1	ZINC001035767726	1343179531	/nfs/dbraw/zinc/17/95/31/1343179531.db2.gz	VOJAVFJOCYELDH-IRXDYDNUSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc(F)c(F)cc1F)CC2	ZINC001035778974	1343190049	/nfs/dbraw/zinc/19/00/49/1343190049.db2.gz	IDQJCUSOQPBSOJ-UHFFFAOYSA-N	0	3	338.373	3.218	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc3ncccc3c1)CC2	ZINC001035785344	1343196418	/nfs/dbraw/zinc/19/64/18/1343196418.db2.gz	HRYYOJXOZZUMPJ-UHFFFAOYSA-N	0	3	335.451	3.349	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C[C@H](C)c1cccnc1)CC2	ZINC001035808980	1343209143	/nfs/dbraw/zinc/20/91/43/1343209143.db2.gz	GTBPPVQFTGFFOM-KRWDZBQOSA-N	0	3	327.472	3.076	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C[C@@H](C)c1cccnc1)CC2	ZINC001035808981	1343209338	/nfs/dbraw/zinc/20/93/38/1343209338.db2.gz	GTBPPVQFTGFFOM-QGZVFWFLSA-N	0	3	327.472	3.076	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C1(c3cccc(F)c3)CC1)CC2	ZINC001035812827	1343211569	/nfs/dbraw/zinc/21/15/69/1343211569.db2.gz	RTAPDKSATZFBQY-UHFFFAOYSA-N	0	3	342.458	3.358	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)C1(C3CCCCC3)CC1)CC2	ZINC001035844065	1343225985	/nfs/dbraw/zinc/22/59/85/1343225985.db2.gz	NJBZYGVGJBWFJA-UHFFFAOYSA-N	0	3	328.500	3.295	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cc(C)c(F)c(C)c1)CC2	ZINC001035853878	1343231122	/nfs/dbraw/zinc/23/11/22/1343231122.db2.gz	VGKFQCOJDPEMTQ-UHFFFAOYSA-N	0	3	328.431	3.004	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H](C)Cc1ccccc1)CC2	ZINC001035856046	1343232234	/nfs/dbraw/zinc/23/22/34/1343232234.db2.gz	IQVPGPZZPQVDNE-SFHVURJKSA-N	0	3	326.484	3.366	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CCCC2)CC[C@H]1NCc1cc(F)ccc1C#N	ZINC001035872966	1343241672	/nfs/dbraw/zinc/24/16/72/1343241672.db2.gz	ABRPCRQQSHVORD-AUUYWEPGSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@H]1CN(C(=O)CC(C)(C)C)CC[C@@H]1NCc1ccccc1C#N	ZINC001035907906	1343263750	/nfs/dbraw/zinc/26/37/50/1343263750.db2.gz	FIGUCNOHVLQEKM-YJBOKZPZSA-N	0	3	327.472	3.321	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@@H](NCc2cc(F)ccc2C#N)[C@@H](C)C1	ZINC001035920045	1343273122	/nfs/dbraw/zinc/27/31/22/1343273122.db2.gz	NEZFWLRQVMASOG-IFXJQAMLSA-N	0	3	345.462	3.460	20	30		EGEDHN
C/C(=C/C(=O)N1CC[C@H](NCc2ccccc2C#N)[C@H](C)C1)C1CC1	ZINC001035938599	1343280516	/nfs/dbraw/zinc/28/05/16/1343280516.db2.gz	DSLLHYLFDAZEHA-OUAFYBQWSA-N	0	3	337.467	3.241	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2CCC2)CC[C@@H]1NCc1ccccc1C#N	ZINC001035977770	1343296635	/nfs/dbraw/zinc/29/66/35/1343296635.db2.gz	OKDFTUHDSVPGSK-BEFAXECRSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2CCC2)CC[C@H]1NCc1cc(F)ccc1C#N	ZINC001035978316	1343297574	/nfs/dbraw/zinc/29/75/74/1343297574.db2.gz	REUQJBQTYGBSBS-AUUYWEPGSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](NCc2nc(C)cs2)[C@@H](C)C1	ZINC001036139636	1343324506	/nfs/dbraw/zinc/32/45/06/1343324506.db2.gz	ZXGJZKADFCXEIN-DZGCQCFKSA-N	0	3	335.517	3.380	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@@H]([C@H](C)NCc2ccccc2C#N)C1	ZINC001036343939	1343430439	/nfs/dbraw/zinc/43/04/39/1343430439.db2.gz	JKRVZCFGFLPTPH-QFBILLFUSA-N	0	3	327.472	3.321	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCCN(C(=O)c2ccco2)C1	ZINC001036346749	1343433512	/nfs/dbraw/zinc/43/35/12/1343433512.db2.gz	WZHQJKNPIMVJGP-QAPCUYQASA-N	0	3	337.423	3.182	20	30		EGEDHN
C[C@@H](NCc1cc(F)ccc1C#N)[C@@H]1CCCN(C(=O)C(C)(C)F)C1	ZINC001036357705	1343440351	/nfs/dbraw/zinc/44/03/51/1343440351.db2.gz	OZKGUMCCBRJMOW-UKRRQHHQSA-N	0	3	349.425	3.162	20	30		EGEDHN
CC(C)(C)CC(=O)N1CC[C@H]2[C@@H](CCN2CC#Cc2ccccc2)C1	ZINC001036639791	1343594777	/nfs/dbraw/zinc/59/47/77/1343594777.db2.gz	BANWNHGFGJOGBD-PMACEKPBSA-N	0	3	338.495	3.397	20	30		EGEDHN
CC(C)C(=O)N1CC[C@H]2[C@@H](CCN2CC#Cc2ccc(Cl)cc2)C1	ZINC001036649171	1343599238	/nfs/dbraw/zinc/59/92/38/1343599238.db2.gz	SRECQZBIAGUUTO-HKUYNNGSSA-N	0	3	344.886	3.270	20	30		EGEDHN
C/C=C(/C)C(=O)N1CC[C@@H]2[C@@H](CCN2CC#Cc2ccc(F)cc2)C1	ZINC001036683600	1343626587	/nfs/dbraw/zinc/62/65/87/1343626587.db2.gz	VGCUXRVZLPRAOC-HVINZIIVSA-N	0	3	340.442	3.066	20	30		EGEDHN
C/C=C(\C)C(=O)N1CC[C@@H]2[C@@H](CCN2CC#Cc2ccc(F)cc2)C1	ZINC001036683602	1343626590	/nfs/dbraw/zinc/62/65/90/1343626590.db2.gz	VGCUXRVZLPRAOC-QRQSVOEDSA-N	0	3	340.442	3.066	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@@H]2[C@@H](CCN2Cc2cccc(Cl)c2)C1	ZINC001036713814	1343646403	/nfs/dbraw/zinc/64/64/03/1343646403.db2.gz	OSOBBSKZWLXASW-PKOBYXMFSA-N	0	3	342.870	3.176	20	30		EGEDHN
CC1(CC(=O)N2CC[C@H]3[C@@H](CCN3Cc3ccccc3C#N)C2)CC1	ZINC001036775752	1343705307	/nfs/dbraw/zinc/70/53/07/1343705307.db2.gz	ACCKGVPFFFUPGI-OALUTQOASA-N	0	3	337.467	3.171	20	30		EGEDHN
Cc1cocc1C(=O)N1CC[C@H]2[C@@H](CCN2CC#Cc2ccccc2)C1	ZINC001036787424	1343717330	/nfs/dbraw/zinc/71/73/30/1343717330.db2.gz	LAVSHQNCLSROHZ-FPOVZHCZSA-N	0	3	348.446	3.176	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2oc(CC)nc2C)C1	ZINC001036789130	1343718337	/nfs/dbraw/zinc/71/83/37/1343718337.db2.gz	MSGGQYQWNHCFEW-JKSUJKDBSA-N	0	3	345.487	3.180	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2[C@H](CCN2Cc2cnc(C)s2)C1	ZINC001036789306	1343719772	/nfs/dbraw/zinc/71/97/72/1343719772.db2.gz	PEPCIQGOYWAENU-ZBFHGGJFSA-N	0	3	333.501	3.087	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]2[C@H](CCN2Cc2cnc(C)o2)C1	ZINC001036793496	1343725573	/nfs/dbraw/zinc/72/55/73/1343725573.db2.gz	GIGMQDPOHZJTAV-NVXWUHKLSA-N	0	3	331.460	3.008	20	30		EGEDHN
Cc1coc(C(=O)N2CC[C@@H]3[C@H](CCN3CC#Cc3ccccc3)C2)c1	ZINC001036796750	1343730557	/nfs/dbraw/zinc/73/05/57/1343730557.db2.gz	IHMUQXQMEGKMMC-WOJBJXKFSA-N	0	3	348.446	3.176	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H]3[C@H](CCN3Cc3cnoc3C)C2)CC1	ZINC001036810513	1343745179	/nfs/dbraw/zinc/74/51/79/1343745179.db2.gz	DQAYDGXIKVRJAU-MJGOQNOKSA-N	0	3	343.471	3.152	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H]3[C@@H](CCN3Cc3cc(C)no3)C2)CC1	ZINC001036810710	1343745930	/nfs/dbraw/zinc/74/59/30/1343745930.db2.gz	GZRZEFULFZWZET-PKOBYXMFSA-N	0	3	343.471	3.152	20	30		EGEDHN
CC(F)(F)CC(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccccc2C#N)C1	ZINC001036811123	1343746047	/nfs/dbraw/zinc/74/60/47/1343746047.db2.gz	LWQASZHFHOJXGB-DLBZAZTESA-N	0	3	347.409	3.026	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H]3[C@H](CCN3Cc3cc(C)no3)C2)CC1	ZINC001036810709	1343746532	/nfs/dbraw/zinc/74/65/32/1343746532.db2.gz	GZRZEFULFZWZET-MJGOQNOKSA-N	0	3	343.471	3.152	20	30		EGEDHN
CCC1(C(=O)N2CC[C@@H]3[C@@H](CCN3Cc3ccccc3C#N)C2)CC1	ZINC001036813641	1343749770	/nfs/dbraw/zinc/74/97/70/1343749770.db2.gz	AJLVCORHFWRIEB-RBUKOAKNSA-N	0	3	337.467	3.171	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001036875909	1343814871	/nfs/dbraw/zinc/81/48/71/1343814871.db2.gz	IDEMQHKSSFCKDT-CZUORRHYSA-N	0	3	331.485	3.089	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCC[C@@H]1NC(=O)c1cccs1	ZINC001036933894	1343877685	/nfs/dbraw/zinc/87/76/85/1343877685.db2.gz	GAIHCVQLKATMIU-SJORKVTESA-N	0	3	339.464	3.308	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@@H]1CCC[C@H]1NC(=O)C1=CCCC1	ZINC001036981389	1343908465	/nfs/dbraw/zinc/90/84/65/1343908465.db2.gz	WRTWVAIDLHGGIN-QFBILLFUSA-N	0	3	341.430	3.182	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCC[C@H]2CNCc2ccn(CC)n2)CC1	ZINC001037070427	1343963628	/nfs/dbraw/zinc/96/36/28/1343963628.db2.gz	RBPCIAFDSLHBSV-HKUYNNGSSA-N	0	3	344.503	3.024	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCC[C@H]1NC(=O)C1CC2(CC2)C1	ZINC001037075528	1343968685	/nfs/dbraw/zinc/96/86/85/1343968685.db2.gz	QVNPUNBXPPAUOM-IEBWSBKVSA-N	0	3	337.467	3.123	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCC[C@H]2CNCc2cc(C3CC3)no2)C1	ZINC001037075557	1343968746	/nfs/dbraw/zinc/96/87/46/1343968746.db2.gz	RGOMJSHIKRTTCL-RDJZCZTQSA-N	0	3	343.471	3.283	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCC[C@@H]1NC(=O)C1CC=CC1	ZINC001037180329	1344023400	/nfs/dbraw/zinc/02/34/00/1344023400.db2.gz	FZHIPDWDLKTBPF-UXHICEINSA-N	0	3	337.467	3.289	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCCC[C@@H]2CNCc2ccn(CC)n2)C1	ZINC001037243270	1344064718	/nfs/dbraw/zinc/06/47/18/1344064718.db2.gz	VHUOWNMCTHQWPG-AEFFLSMTSA-N	0	3	344.503	3.024	20	30		EGEDHN
CCCC(=O)N1CC[C@H](NCc2cc(F)ccc2C#N)[C@@H](CC)C1	ZINC001037762518	1344076665	/nfs/dbraw/zinc/07/66/65/1344076665.db2.gz	ACNLRTWTYZAKEF-KSSFIOAISA-N	0	3	331.435	3.214	20	30		EGEDHN
CC[C@H]1CN(C(=O)C(C)C)CC[C@@H]1NCc1cc(F)ccc1C#N	ZINC001037781917	1344092707	/nfs/dbraw/zinc/09/27/07/1344092707.db2.gz	AYJQRXSWCKTICA-KSSFIOAISA-N	0	3	331.435	3.070	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1ccn(C2CCCCC2)n1	ZINC001038250143	1344344369	/nfs/dbraw/zinc/34/43/69/1344344369.db2.gz	LICNFVOBPXMEHW-QGZVFWFLSA-N	0	3	330.476	3.159	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1cc(C2CCCCC2)n[nH]1	ZINC001038344614	1344389090	/nfs/dbraw/zinc/38/90/90/1344389090.db2.gz	JAZXFTKWUMVCPV-MRXNPFEDSA-N	0	3	330.476	3.228	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@@H]2CCN2CC2CC(C)(C)C2)cc1	ZINC001038427139	1344423294	/nfs/dbraw/zinc/42/32/94/1344423294.db2.gz	DXPAZJUBKISPQL-SFHVURJKSA-N	0	3	342.483	3.492	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)NC[C@H]1CCN1CCCC1CCC1	ZINC001038800980	1344589963	/nfs/dbraw/zinc/58/99/63/1344589963.db2.gz	WPYJDBJIBAACNR-QYZOEREBSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1cnc2ccc(F)cc2c1	ZINC001038880293	1344627180	/nfs/dbraw/zinc/62/71/80/1344627180.db2.gz	FBFTZASCZAPKIF-KRWDZBQOSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1ccnc(O[C@@H](C)CC)c1	ZINC001038895404	1344637624	/nfs/dbraw/zinc/63/76/24/1344637624.db2.gz	VJMSIDPQRFMWFH-DOTOQJQBSA-N	0	3	331.460	3.029	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2ccsc2C)C[C@H]1c1cccc(F)c1	ZINC001079182396	1357203397	/nfs/dbraw/zinc/20/33/97/1357203397.db2.gz	GVMCWLMBXWMLPI-ZWKOTPCHSA-N	0	3	342.439	3.027	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)Cc3ccoc3)CC2)C1	ZINC001039129230	1344807432	/nfs/dbraw/zinc/80/74/32/1344807432.db2.gz	IPBFGQCWZQEEFA-KRWDZBQOSA-N	0	3	336.863	3.135	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)[C@]34C[C@H]3CCC4)CC2)C1	ZINC001039146933	1344829903	/nfs/dbraw/zinc/82/99/03/1344829903.db2.gz	SWHSKRPCXXSQJS-ZHALLVOQSA-N	0	3	336.907	3.490	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)CC(C)(F)F)CC2)C1	ZINC001039154288	1344839404	/nfs/dbraw/zinc/83/94/04/1344839404.db2.gz	TVVBVUYRGAXGEE-AWEZNQCLSA-N	0	3	334.838	3.345	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2sccc2C)C1	ZINC001039178339	1344872904	/nfs/dbraw/zinc/87/29/04/1344872904.db2.gz	OSKWNFICCLKDME-IRXDYDNUSA-N	0	3	330.497	3.396	20	30		EGEDHN
CC(C)C(=O)N1CCCC[C@H]1[C@H]1CCN(CC#Cc2ccccc2)C1	ZINC001039185241	1344884365	/nfs/dbraw/zinc/88/43/65/1344884365.db2.gz	DPSSKXQCSUQNCM-SFTDATJTSA-N	0	3	338.495	3.397	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc(C)c(C)o2)C1	ZINC001039197454	1344906123	/nfs/dbraw/zinc/90/61/23/1344906123.db2.gz	OKBMEIWOBRHIRY-ROUUACIJSA-N	0	3	328.456	3.236	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccc(C(C)C)nc2)C1	ZINC001039212519	1344927741	/nfs/dbraw/zinc/92/77/41/1344927741.db2.gz	GXXJGBYRMKWUSX-AZUAARDMSA-N	0	3	339.483	3.155	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(F)c(C)c2)C1	ZINC001039226705	1344945513	/nfs/dbraw/zinc/94/55/13/1344945513.db2.gz	ZLCZBIWAQUACCJ-MJGOQNOKSA-N	0	3	328.431	3.084	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc(C)cc(F)c2)C1	ZINC001039233809	1344954368	/nfs/dbraw/zinc/95/43/68/1344954368.db2.gz	OJEPBZCIMGAUBK-LPHOPBHVSA-N	0	3	328.431	3.084	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)CCc2cccs2)C1	ZINC001039237617	1344960894	/nfs/dbraw/zinc/96/08/94/1344960894.db2.gz	DHHAARUMDXFULY-SJLPKXTDSA-N	0	3	330.497	3.017	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc(C)ccc2F)C1	ZINC001039238790	1344963074	/nfs/dbraw/zinc/96/30/74/1344963074.db2.gz	PJYYKFPWACRPOC-LPHOPBHVSA-N	0	3	328.431	3.084	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2nc(C)c(C)s2)C1	ZINC001039242500	1344969128	/nfs/dbraw/zinc/96/91/28/1344969128.db2.gz	PDTSCDILGGNDDJ-IRXDYDNUSA-N	0	3	345.512	3.100	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)CCc2ccc(C)o2)C1	ZINC001039250421	1344981457	/nfs/dbraw/zinc/98/14/57/1344981457.db2.gz	KJCOJQSNWRTXEV-AZUAARDMSA-N	0	3	342.483	3.247	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc3ccccc3o2)C1	ZINC001039250829	1344982377	/nfs/dbraw/zinc/98/23/77/1344982377.db2.gz	QJBOBARWEWVCSN-MSOLQXFVSA-N	0	3	336.435	3.383	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2coc3ccccc23)C1	ZINC001039253563	1344984959	/nfs/dbraw/zinc/98/49/59/1344984959.db2.gz	JYHXLHZGBLTNNI-LPHOPBHVSA-N	0	3	336.435	3.383	20	30		EGEDHN
N#Cc1ccccc1CNC1C[C@H]2CCC[C@@H](C1)N2C(=O)[C@H]1CC12CC2	ZINC001039301296	1345003691	/nfs/dbraw/zinc/00/36/91/1345003691.db2.gz	HAKOJWIUJDIJCM-RAFMOHDBSA-N	0	3	349.478	3.360	20	30		EGEDHN
Cc1cccc(CN2CC[C@H]3CC[C@@H](C2)N3C(=O)c2c[nH]c(C#N)c2)c1	ZINC001039358465	1345027610	/nfs/dbraw/zinc/02/76/10/1345027610.db2.gz	NFIPCDAZXVBFAJ-UXHICEINSA-N	0	3	348.450	3.074	20	30		EGEDHN
C=CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1oc(CC2CC2)nc1C	ZINC001039374489	1345033210	/nfs/dbraw/zinc/03/32/10/1345033210.db2.gz	YCZPHCQXFXPJNN-SJORKVTESA-N	0	3	343.471	3.191	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C(C)(C)c1cc(C)ccn1	ZINC001039392713	1345042311	/nfs/dbraw/zinc/04/23/11/1345042311.db2.gz	BBEFVULDLZGOGG-MSOLQXFVSA-N	0	3	341.499	3.309	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccc2c1O[C@@H](C)C2	ZINC001039408671	1345052459	/nfs/dbraw/zinc/05/24/59/1345052459.db2.gz	XUMJYMHHCWRQAA-JQHSSLGASA-N	0	3	340.467	3.265	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(C(C)C)nc1C	ZINC001039436817	1345067049	/nfs/dbraw/zinc/06/70/49/1345067049.db2.gz	INZSVBLOLJRJKF-MSOLQXFVSA-N	0	3	339.483	3.216	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C1(c2cccc(F)c2)CC1	ZINC001039447696	1345072423	/nfs/dbraw/zinc/07/24/23/1345072423.db2.gz	ZIMSPIJJBKUTQQ-MOPGFXCFSA-N	0	3	342.458	3.499	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)Cc1c(C)noc1C	ZINC001039449452	1345073687	/nfs/dbraw/zinc/07/36/87/1345073687.db2.gz	UPYRHFDFQBMQAO-QGTPRVQTSA-N	0	3	345.487	3.111	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C1(C2CCCCC2)CC1	ZINC001039463685	1345081798	/nfs/dbraw/zinc/08/17/98/1345081798.db2.gz	BQSJLAHBLHSDDF-MOPGFXCFSA-N	0	3	328.500	3.436	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1	ZINC001039476425	1345091300	/nfs/dbraw/zinc/09/13/00/1345091300.db2.gz	SABVRWLCNCEGBJ-FUMNGEBKSA-N	0	3	340.442	3.018	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC1CCC1	ZINC001039941472	1345254333	/nfs/dbraw/zinc/25/43/33/1345254333.db2.gz	UFCISSMDMXMQCN-YRPNKDGESA-N	0	3	346.515	3.223	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC1CC(C)C1	ZINC001039944945	1345255652	/nfs/dbraw/zinc/25/56/52/1345255652.db2.gz	HPQNOIAYOKVTQO-SMUYKIOZSA-N	0	3	346.515	3.079	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@]3(CCN(C(=O)C4=CCCC4)C3)C2)c1	ZINC001040158757	1345360433	/nfs/dbraw/zinc/36/04/33/1345360433.db2.gz	SFDARDKAPIEILZ-JOCHJYFZSA-N	0	3	349.478	3.483	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3c(C)noc3C(F)F)C2)C1	ZINC001040254098	1345396627	/nfs/dbraw/zinc/39/66/27/1345396627.db2.gz	MTZJRPDSNYHCDJ-QGZVFWFLSA-N	0	3	339.386	3.035	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3nc(Cl)sc3C)C2)C1	ZINC001040288989	1345413571	/nfs/dbraw/zinc/41/35/71/1345413571.db2.gz	AMPLSSGEXFVUFN-INIZCTEOSA-N	0	3	339.892	3.219	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)Cc3ccc(C(F)F)cc3)C2)C1	ZINC001040291362	1345415284	/nfs/dbraw/zinc/41/52/84/1345415284.db2.gz	MJPBXDCHADAFLY-FQEVSTJZSA-N	0	3	346.421	3.114	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@H](C)c3c(F)cccc3F)C2)C1	ZINC001040292068	1345416136	/nfs/dbraw/zinc/41/61/36/1345416136.db2.gz	KQZMFCCBNNYYLB-FOIQADDNSA-N	0	3	346.421	3.016	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3nc4ccccc4cc3C)C2)C1	ZINC001040302550	1345422397	/nfs/dbraw/zinc/42/23/97/1345422397.db2.gz	KGMZSZUYGUXCQX-JOCHJYFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@@H]3CC[C@@H]4C[C@@H]4CC3)C2)C1	ZINC001040308892	1345424522	/nfs/dbraw/zinc/42/45/22/1345424522.db2.gz	DZPCRQGKSNDFSR-HUUJSLGLSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3c(F)ccc(C)c3F)C2)C1	ZINC001040371949	1345460601	/nfs/dbraw/zinc/46/06/01/1345460601.db2.gz	MVNWMRMQCWTQFC-HXUWFJFHSA-N	0	3	346.421	3.225	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cc4occc4s3)C2)C1	ZINC001040391909	1345473070	/nfs/dbraw/zinc/47/30/70/1345473070.db2.gz	RMJCYONGKQOKIN-LJQANCHMSA-N	0	3	342.464	3.446	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(C)c(F)c3F)C2)C1	ZINC001040416510	1345485526	/nfs/dbraw/zinc/48/55/26/1345485526.db2.gz	WOIKIFHXMMBGDZ-HXUWFJFHSA-N	0	3	346.421	3.225	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3oc(C(C)C)nc3C)C2)C1	ZINC001040437276	1345499955	/nfs/dbraw/zinc/49/99/55/1345499955.db2.gz	YPPSJAWMUWPFQT-IBGZPJMESA-N	0	3	331.460	3.221	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3scnc3C3CC3)C2)C1	ZINC001040443810	1345502978	/nfs/dbraw/zinc/50/29/78/1345502978.db2.gz	MQIHNGNVVUZGRO-SFHVURJKSA-N	0	3	331.485	3.135	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cccc4c3ccn4C)C2)C1	ZINC001040452273	1345507264	/nfs/dbraw/zinc/50/72/64/1345507264.db2.gz	HLYSFXYTBNKWMV-QFIPXVFZSA-N	0	3	349.478	3.130	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@H](F)CC3CCCCC3)C2)C1	ZINC001040494242	1345519608	/nfs/dbraw/zinc/51/96/08/1345519608.db2.gz	UZCFDPVIDKLVBX-UYAOXDASSA-N	0	3	334.479	3.243	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@@H](F)CC3CCCCC3)C2)C1	ZINC001040494240	1345519636	/nfs/dbraw/zinc/51/96/36/1345519636.db2.gz	UZCFDPVIDKLVBX-ICSRJNTNSA-N	0	3	334.479	3.243	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@@H]3C[C@H]3c3ccccc3)C2)C1	ZINC001040501433	1345521804	/nfs/dbraw/zinc/52/18/04/1345521804.db2.gz	YTRYBCFOVKQRIZ-VWPQPMDRSA-N	0	3	336.479	3.128	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3c(F)cccc3Cl)C2)C1	ZINC001040504290	1345524293	/nfs/dbraw/zinc/52/42/93/1345524293.db2.gz	YARQJPRBXGNEPM-IBGZPJMESA-N	0	3	348.849	3.431	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3ccc(C4CC4)cn3)C2)C1	ZINC001040514536	1345528374	/nfs/dbraw/zinc/52/83/74/1345528374.db2.gz	UYANNFSFWOAMEO-HXUWFJFHSA-N	0	3	325.456	3.073	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cc(C)n(C(C)(C)C)n3)C2)C1	ZINC001040533763	1345535744	/nfs/dbraw/zinc/53/57/44/1345535744.db2.gz	FRPDUNBFSUZBTC-FQEVSTJZSA-N	0	3	344.503	3.061	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cnc(CC(C)C)s3)C2)C1	ZINC001040550804	1345542778	/nfs/dbraw/zinc/54/27/78/1345542778.db2.gz	FUSXPGMXVOSACQ-LJQANCHMSA-N	0	3	347.528	3.456	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3c(C)cccc3F)C2)C1	ZINC001040552223	1345543906	/nfs/dbraw/zinc/54/39/06/1345543906.db2.gz	YNHCZHAYMOJLCV-FQEVSTJZSA-N	0	3	328.431	3.086	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)C3CC(c4ccccc4)C3)C2)C1	ZINC001040551983	1345544083	/nfs/dbraw/zinc/54/40/83/1345544083.db2.gz	UIXUBDUQLXWSDI-QETWGEEDSA-N	0	3	336.479	3.128	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cnc(C(C)C)s3)C2)C1	ZINC001040557003	1345545610	/nfs/dbraw/zinc/54/56/10/1345545610.db2.gz	UTCMBDUROUFTRI-SFHVURJKSA-N	0	3	333.501	3.381	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@H](CC)OC3CCCCC3)C2)CC1	ZINC001040704526	1345568167	/nfs/dbraw/zinc/56/81/67/1345568167.db2.gz	ZMFKEFSOIZLWSX-IBGZPJMESA-N	0	3	346.515	3.062	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cc(C)n(CC)c3C)C2)CC1	ZINC001040763152	1345576174	/nfs/dbraw/zinc/57/61/74/1345576174.db2.gz	GOIPZLRSQBFNKC-UHFFFAOYSA-N	0	3	341.499	3.076	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cc(F)ccc3C)C2)CC1	ZINC001040791192	1345578488	/nfs/dbraw/zinc/57/84/88/1345578488.db2.gz	HNEFLXBVCMUDEI-UHFFFAOYSA-N	0	3	328.431	3.086	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccc(C)nc3C(C)C)C2)CC1	ZINC001040790922	1345578568	/nfs/dbraw/zinc/57/85/68/1345578568.db2.gz	DTFNYNGYEIZUIY-UHFFFAOYSA-N	0	3	339.483	3.075	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC2(C1)CCN(Cc1cnc(C)s1)CC2	ZINC001040801356	1345579404	/nfs/dbraw/zinc/57/94/04/1345579404.db2.gz	VEYSGONXEWPRTF-UHFFFAOYSA-N	0	3	347.528	3.478	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cc(F)cc(Cl)c3)C2)CC1	ZINC001040861026	1345588537	/nfs/dbraw/zinc/58/85/37/1345588537.db2.gz	CRKZNDYQZMNBFS-UHFFFAOYSA-N	0	3	334.822	3.040	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cccc(OCC)c3)C2)CC1	ZINC001040869887	1345590614	/nfs/dbraw/zinc/59/06/14/1345590614.db2.gz	QZXUNWWEHLGBNG-UHFFFAOYSA-N	0	3	340.467	3.037	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cccn3C3CCCC3)C2)CC1	ZINC001040895555	1345595259	/nfs/dbraw/zinc/59/52/59/1345595259.db2.gz	YGQZXLLGZYPCTM-UHFFFAOYSA-N	0	3	339.483	3.165	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@H](C)c3ccc(F)cc3F)C2)CC1	ZINC001040944243	1345606452	/nfs/dbraw/zinc/60/64/52/1345606452.db2.gz	FFBUYFXVANFCKL-OAHLLOKOSA-N	0	3	346.421	3.016	20	30		EGEDHN
C/C(=C/C(=O)N1CC[C@]2(CCN(Cc3ccc(C#N)cc3)C2)C1)C1CC1	ZINC001041098320	1345651812	/nfs/dbraw/zinc/65/18/12/1345651812.db2.gz	RXTXIHCXLCDBJC-SJAXDAAESA-N	0	3	349.478	3.339	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1)C1CC1	ZINC001041174039	1345666629	/nfs/dbraw/zinc/66/66/29/1345666629.db2.gz	NMGPFYPIUJCXFJ-IERDGZPVSA-N	0	3	337.467	3.029	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)C3(CC)CCC(F)(F)CC3)C2)C1	ZINC001041414284	1345723175	/nfs/dbraw/zinc/72/31/75/1345723175.db2.gz	HIXAPHXCAWCFJJ-QGZVFWFLSA-N	0	3	338.442	3.150	20	30		EGEDHN
C=CCN1CC[C@]2(CCN(C(=O)c3cc(-c4ccccc4)on3)C2)C1	ZINC001041452280	1345731442	/nfs/dbraw/zinc/73/14/42/1345731442.db2.gz	BLGUFEKSHXFQRS-FQEVSTJZSA-N	0	3	337.423	3.066	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3c(C)[nH]c4ccccc43)C2)C1	ZINC001041455305	1345732555	/nfs/dbraw/zinc/73/25/55/1345732555.db2.gz	QPHLTDVIGYTTBW-NRFANRHFSA-N	0	3	335.451	3.038	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)CCc3ccc(C(C)C)cc3)C2)C1	ZINC001041468684	1345737120	/nfs/dbraw/zinc/73/71/20/1345737120.db2.gz	VPSPCOUGQUDBHT-QFIPXVFZSA-N	0	3	338.495	3.300	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@]2(CCN(Cc3cnccc3C)C2)C1	ZINC001041536389	1345755497	/nfs/dbraw/zinc/75/54/97/1345755497.db2.gz	NICSVZNGAAKCGZ-NRFANRHFSA-N	0	3	341.499	3.417	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cc(F)cc(Cl)c3)C2)C1	ZINC001041709058	1345825922	/nfs/dbraw/zinc/82/59/22/1345825922.db2.gz	QYXRHWYLDXNSDC-GOSISDBHSA-N	0	3	334.822	3.040	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3ccccc3O[C@H](C)CC)C2)C1	ZINC001041718159	1345829932	/nfs/dbraw/zinc/82/99/32/1345829932.db2.gz	WYSCPHPVPWCLRS-DYESRHJHSA-N	0	3	340.467	3.035	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cccc4ccsc43)C2)C1	ZINC001041772297	1345845020	/nfs/dbraw/zinc/84/50/20/1345845020.db2.gz	JTFUKROMIUCUBF-FQEVSTJZSA-N	0	3	338.476	3.463	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001041799958	1345854325	/nfs/dbraw/zinc/85/43/25/1345854325.db2.gz	GLHUGNSDWOOYGS-FQEVSTJZSA-N	0	3	325.456	3.029	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3cc4cc(F)ccc4s3)C2)C1	ZINC001041822828	1345863730	/nfs/dbraw/zinc/86/37/30/1345863730.db2.gz	SXCZITBIZSLLRU-LJQANCHMSA-N	0	3	342.439	3.212	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cc4cccc(F)c4o3)C2)C1	ZINC001041838227	1345868223	/nfs/dbraw/zinc/86/82/23/1345868223.db2.gz	UXZTYXMURMTKRP-FQEVSTJZSA-N	0	3	340.398	3.133	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3ccc(C(C)(C)C)s3)C2)C1	ZINC001041842011	1345869732	/nfs/dbraw/zinc/86/97/32/1345869732.db2.gz	YSYMTFALMOSLCL-IBGZPJMESA-N	0	3	330.497	3.217	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)CC[C@@H]3CCc4ccccc43)C2)C1	ZINC001041842951	1345870086	/nfs/dbraw/zinc/87/00/86/1345870086.db2.gz	KPWVFWLMAZSXJX-SIKLNZKXSA-N	0	3	336.479	3.054	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CCN(C(=O)CC4CCC4)C[C@H]32)cc1	ZINC001041998259	1345917848	/nfs/dbraw/zinc/91/78/48/1345917848.db2.gz	XFHFKUHRUNQFSX-WOJBJXKFSA-N	0	3	337.467	3.171	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CCN(C(=O)C=C4CCC4)C[C@@H]32)c1	ZINC001042006894	1345922600	/nfs/dbraw/zinc/92/26/00/1345922600.db2.gz	RMLZGKUMVRDYCD-UXHICEINSA-N	0	3	335.451	3.091	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@H]2C1	ZINC001042014417	1345925618	/nfs/dbraw/zinc/92/56/18/1345925618.db2.gz	RLYSEXHTRQAVOS-ROUUACIJSA-N	0	3	341.430	3.244	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cccc4scnc43)C[C@@H]21	ZINC001042060111	1345933071	/nfs/dbraw/zinc/93/30/71/1345933071.db2.gz	HUTGTGKTGVKMAU-HIFRSBDPSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cccc(OCCC)c3)C[C@@H]21	ZINC001042079509	1345939536	/nfs/dbraw/zinc/93/95/36/1345939536.db2.gz	DSBXWZMAWGHXPQ-LPHOPBHVSA-N	0	3	328.456	3.198	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C3C4CC5CC(C4)CC3C5)C[C@@H]21	ZINC001042095861	1345943078	/nfs/dbraw/zinc/94/30/78/1345943078.db2.gz	RBXMJPNFQMAQLC-YETXIRRSSA-N	0	3	340.511	3.005	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)Cc3ccc(C)cc3Cl)C[C@H]21	ZINC001042119798	1345949160	/nfs/dbraw/zinc/94/91/60/1345949160.db2.gz	JQIMOUGJRWVXBE-QFBILLFUSA-N	0	3	344.886	3.137	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3cc(COC)cs3)C[C@H]21	ZINC001042134967	1345952865	/nfs/dbraw/zinc/95/28/65/1345952865.db2.gz	RMAVPOBAZCYUNM-JKSUJKDBSA-N	0	3	334.485	3.007	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3coc4ccc(OC)cc43)C[C@H]21	ZINC001042147926	1345957064	/nfs/dbraw/zinc/95/70/64/1345957064.db2.gz	HTIVQBBUBPXZEM-KBXCAEBGSA-N	0	3	340.423	3.164	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3cc(-c4ccco4)on3)C[C@@H]21	ZINC001042171617	1345965881	/nfs/dbraw/zinc/96/58/81/1345965881.db2.gz	XLJPCUOUOSUXOI-ZBFHGGJFSA-N	0	3	341.411	3.047	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3sccc3-n3cccc3)C[C@H]21	ZINC001042175239	1345966463	/nfs/dbraw/zinc/96/64/63/1345966463.db2.gz	AHIJWJUPNFLASZ-NVXWUHKLSA-N	0	3	341.480	3.261	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C3(c4ccc(F)cc4)CCC3)C[C@H]21	ZINC001042177103	1345967978	/nfs/dbraw/zinc/96/79/78/1345967978.db2.gz	UJTVORZJMHOHSX-QFBILLFUSA-N	0	3	342.458	3.356	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3sc(C)nc3C)[C@@H]2C1	ZINC001042183541	1345971212	/nfs/dbraw/zinc/97/12/12/1345971212.db2.gz	KYHIOFXEWMIWQK-JKSUJKDBSA-N	0	3	347.528	3.395	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cc4c(ccc(C)c4C)[nH]3)C[C@@H]21	ZINC001042188721	1345975975	/nfs/dbraw/zinc/97/59/75/1345975975.db2.gz	WKTIMIDXHSKAOF-UTKZUKDTSA-N	0	3	349.478	3.344	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)Cc3c(C)cc(C)cc3C)C[C@@H]21	ZINC001042212296	1345987847	/nfs/dbraw/zinc/98/78/47/1345987847.db2.gz	BBFVQQDJWLADBK-CTNGQTDRSA-N	0	3	338.495	3.100	20	30		EGEDHN
CC(F)(F)CC(=O)N1CC[C@@H]2CCN(Cc3cccc(C#N)c3)[C@@H]2C1	ZINC001042221855	1345992721	/nfs/dbraw/zinc/99/27/21/1345992721.db2.gz	NMNQUTWNMPBTMN-DLBZAZTESA-N	0	3	347.409	3.026	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]3CCN(Cc4ncccc4C)[C@H]3C2)C1	ZINC001042228074	1345996450	/nfs/dbraw/zinc/99/64/50/1345996450.db2.gz	PLZYHDCDZAKNAP-MJGOQNOKSA-N	0	3	339.483	3.169	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3scnc3C(C)(C)C)C[C@@H]21	ZINC001042262224	1346010107	/nfs/dbraw/zinc/01/01/07/1346010107.db2.gz	HZSMURCLDJZHEE-GJZGRUSLSA-N	0	3	345.512	3.000	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc(C(F)F)cc3)C[C@@H]21	ZINC001042269189	1346013294	/nfs/dbraw/zinc/01/32/94/1346013294.db2.gz	IROSHRUXEIRNPH-PBHICJAKSA-N	0	3	332.394	3.184	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc4nc(C)ccc4c3)C[C@H]21	ZINC001042278474	1346014892	/nfs/dbraw/zinc/01/48/92/1346014892.db2.gz	VVTUAAPKLGGNFT-DYESRHJHSA-N	0	3	347.462	3.103	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3[nH]ccc3-c3ccccc3)C[C@@H]21	ZINC001042308073	1346026628	/nfs/dbraw/zinc/02/66/28/1346026628.db2.gz	DJBYEQNTGPXDMQ-QUCCMNQESA-N	0	3	347.462	3.241	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C3(c4ccccc4F)CCC3)C[C@H]21	ZINC001042310184	1346027607	/nfs/dbraw/zinc/02/76/07/1346027607.db2.gz	RMIXMTRQEFMMFA-QFBILLFUSA-N	0	3	342.458	3.356	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)Cc3cccc4ccccc43)C[C@@H]21	ZINC001042323093	1346032670	/nfs/dbraw/zinc/03/26/70/1346032670.db2.gz	RAAWTTNPCLJSNM-KNQAVFIVSA-N	0	3	346.474	3.328	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccccc3C(F)(F)F)C[C@H]21	ZINC001042327200	1346036026	/nfs/dbraw/zinc/03/60/26/1346036026.db2.gz	MCUTYNYQKWCMPM-XJKSGUPXSA-N	0	3	338.373	3.428	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc(F)c4occc43)C[C@H]21	ZINC001042362713	1346056656	/nfs/dbraw/zinc/05/66/56/1346056656.db2.gz	MCIBLNSYJZINBN-KBXCAEBGSA-N	0	3	340.398	3.132	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3cc4cccc(F)c4o3)C[C@H]21	ZINC001042362483	1346056742	/nfs/dbraw/zinc/05/67/42/1346056742.db2.gz	KNGNWFSCQCYKHN-RHSMWYFYSA-N	0	3	340.398	3.132	20	30		EGEDHN
C#CCN1CC[C@H]2CCN(C(=O)CC3C4CC5CC(C4)CC3C5)C[C@H]21	ZINC001042366840	1346058565	/nfs/dbraw/zinc/05/85/65/1346058565.db2.gz	YJKSWHMKAVUOGZ-SXBLOZSBSA-N	0	3	340.511	3.005	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3cnc(C(C)(C)C)s3)C[C@@H]21	ZINC001042371723	1346061422	/nfs/dbraw/zinc/06/14/22/1346061422.db2.gz	VMMGGOWXPMCRGP-GJZGRUSLSA-N	0	3	345.512	3.000	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C34CC(c5ccccc5)(C3)C4)C[C@H]21	ZINC001042376047	1346063201	/nfs/dbraw/zinc/06/32/01/1346063201.db2.gz	NSKFPGUNJGJDLU-FIFAKTGDSA-N	0	3	336.479	3.217	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)C34CC(c5ccccc5)(C3)C4)C[C@H]21	ZINC001042376332	1346064015	/nfs/dbraw/zinc/06/40/15/1346064015.db2.gz	QHXGXKAZWWVXML-JIQWGDGWSA-N	0	3	348.490	3.054	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)C3(C(F)(F)F)CCCC3)C[C@@H]21	ZINC001042379156	1346064599	/nfs/dbraw/zinc/06/45/99/1346064599.db2.gz	HFRSTOSQEOGUDK-GJZGRUSLSA-N	0	3	342.405	3.055	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)/C=C/c1ccco1	ZINC001044430958	1346328292	/nfs/dbraw/zinc/32/82/92/1346328292.db2.gz	KKAMLHBANLDIRN-UHMOSQCASA-N	0	3	349.434	3.334	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)c1ccsc1	ZINC001044436784	1346331277	/nfs/dbraw/zinc/33/12/77/1346331277.db2.gz	IXKXTSKNVYAIGF-KDOFPFPSSA-N	0	3	339.464	3.403	20	30		EGEDHN
C[C@@H]1C[C@H]([NH2+]Cc2ccccc2C#N)CCN1C(=O)c1ccccc1[O-]	ZINC001044476183	1346343573	/nfs/dbraw/zinc/34/35/73/1346343573.db2.gz	PLCDQBYMJMWRBU-CRAIPNDOSA-N	0	3	349.434	3.047	20	30		EGEDHN
Cc1cccc(C(=O)N2CC[C@H](NCc3ccccc3C#N)C[C@H]2C)n1	ZINC001044480468	1346344568	/nfs/dbraw/zinc/34/45/68/1346344568.db2.gz	BOBFMWSULHYNLW-APWZRJJASA-N	0	3	348.450	3.045	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2cc(F)ccc2C#N)CCN1C(=O)/C=C/C1CC1	ZINC001044523456	1346356153	/nfs/dbraw/zinc/35/61/53/1346356153.db2.gz	ORQPVZSOVLPYLU-AODLVJTGSA-N	0	3	341.430	3.133	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)CC1(C)CC1	ZINC001044690788	1346404411	/nfs/dbraw/zinc/40/44/11/1346404411.db2.gz	XRZWCVJRVLRQIR-QAPCUYQASA-N	0	3	325.456	3.218	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@H]1CNCc1ccc(Cl)cc1Cl	ZINC001044959715	1346470119	/nfs/dbraw/zinc/47/01/19/1346470119.db2.gz	CKTCLAQBFBUWFT-RISCZKNCSA-N	0	3	340.254	3.234	20	30		EGEDHN
CC(C)(C)CC(=O)N1CCC[C@H]1CNCc1ccc(C#N)cc1F	ZINC001044928072	1346465208	/nfs/dbraw/zinc/46/52/08/1346465208.db2.gz	PCBUWXMQQPNJCT-INIZCTEOSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]1CNCc1cnc(Cl)s1	ZINC001045149528	1346506464	/nfs/dbraw/zinc/50/64/64/1346506464.db2.gz	GSEOVLHWYMZACX-NSHDSACASA-N	0	3	327.881	3.089	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H]1CNCc1cc(CO)ccc1F	ZINC001045185452	1346521295	/nfs/dbraw/zinc/52/12/95/1346521295.db2.gz	CXBLWRYBVQHYRZ-FXAWDEMLSA-N	0	3	348.462	3.001	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H]1CNCc1cn(C(C)C)nc1C	ZINC001045185435	1346521390	/nfs/dbraw/zinc/52/13/90/1346521390.db2.gz	COBCNFBDDXHXIV-AZUAARDMSA-N	0	3	346.519	3.455	20	30		EGEDHN
CC(C)C1(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)cc2F)CC1	ZINC001045190313	1346524368	/nfs/dbraw/zinc/52/43/68/1346524368.db2.gz	ANJJQDXSDMSYSG-KRWDZBQOSA-N	0	3	343.446	3.214	20	30		EGEDHN
Cc1cc(C(=O)NC2(C)CCN(Cc3ccc(C#N)cc3)CC2)co1	ZINC001045413476	1346588111	/nfs/dbraw/zinc/58/81/11/1346588111.db2.gz	XPQHELXKQKRXJL-UHFFFAOYSA-N	0	3	337.423	3.244	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NC1(C)CCN(Cc2ccsc2)CC1	ZINC001045443469	1346595153	/nfs/dbraw/zinc/59/51/53/1346595153.db2.gz	PNEMABUDLIXSCV-SJORKVTESA-N	0	3	348.512	3.200	20	30		EGEDHN
CC1(NC(=O)[C@@H]2CC23CCC3)CCN(Cc2cccc(C#N)c2)CC1	ZINC001045572367	1346632586	/nfs/dbraw/zinc/63/25/86/1346632586.db2.gz	WLBIQDVJKJLMAI-SFHVURJKSA-N	0	3	337.467	3.219	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2cc3ccccc3n2CC)CC1	ZINC001045646758	1346657911	/nfs/dbraw/zinc/65/79/11/1346657911.db2.gz	NDZWZOLRVZCPCA-UHFFFAOYSA-N	0	3	337.467	3.269	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc(C)oc1C)C2	ZINC001045914559	1346751930	/nfs/dbraw/zinc/75/19/30/1346751930.db2.gz	QXRMCOVTURJXPJ-FQEVSTJZSA-N	0	3	328.456	3.238	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1sc(C)cc1C)C2	ZINC001045940622	1346776379	/nfs/dbraw/zinc/77/63/79/1346776379.db2.gz	BWTMMPAXZZOXQY-LJQANCHMSA-N	0	3	330.497	3.316	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@H](C)c1ccco1)C2	ZINC001045965422	1346800570	/nfs/dbraw/zinc/80/05/70/1346800570.db2.gz	HAXFOJYFOZHIMN-YLJYHZDGSA-N	0	3	328.456	3.111	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H](C)Cc1cccs1)C2	ZINC001045968598	1346803200	/nfs/dbraw/zinc/80/32/00/1346803200.db2.gz	DHCYFEQIKRZWEZ-FXAWDEMLSA-N	0	3	344.524	3.265	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccncc1Cl)C2	ZINC001045968908	1346803739	/nfs/dbraw/zinc/80/37/39/1346803739.db2.gz	JENWPTRTHYOLBK-LJQANCHMSA-N	0	3	345.874	3.077	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)Cc1ccc(F)cc1)C2	ZINC001045982989	1346822728	/nfs/dbraw/zinc/82/27/28/1346822728.db2.gz	HODNONRPXCLJGF-NRFANRHFSA-N	0	3	342.458	3.096	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccccc1OCC)C2	ZINC001045983157	1346823105	/nfs/dbraw/zinc/82/31/05/1346823105.db2.gz	JIHNWBNXAHPLAZ-NRFANRHFSA-N	0	3	340.467	3.037	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cccn1C(C)C)C2	ZINC001045985392	1346825990	/nfs/dbraw/zinc/82/59/90/1346825990.db2.gz	UBYWPECXCPYNSS-FQEVSTJZSA-N	0	3	327.472	3.020	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)C1(C)C(C)(C)C1(C)C)C2	ZINC001045987528	1346829005	/nfs/dbraw/zinc/82/90/05/1346829005.db2.gz	USNKXZTUHKNBFK-OAQYLSRUSA-N	0	3	330.516	3.397	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2ocnc2-c2ccccc2)C1	ZINC001046365982	1346951333	/nfs/dbraw/zinc/95/13/33/1346951333.db2.gz	PMGLRCCFCBAQEF-LJQANCHMSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)C2CCc3ccccc3CC2)C1	ZINC001046432065	1346974564	/nfs/dbraw/zinc/97/45/64/1346974564.db2.gz	JBHFIRSELOLAAV-NRFANRHFSA-N	0	3	326.484	3.338	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@]2(C)CCN(Cc3cc(C)cc(C)c3)C2)cn1	ZINC001046779476	1347096603	/nfs/dbraw/zinc/09/66/03/1347096603.db2.gz	UGAJTDOHXMOMOL-JOCHJYFZSA-N	0	3	347.462	3.074	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@@H](CNC(=O)[C@H]2CCC=CCCC2)C1	ZINC001046951828	1347161658	/nfs/dbraw/zinc/16/16/58/1347161658.db2.gz	OLZZTLZDMULKJP-IRXDYDNUSA-N	0	3	338.442	3.220	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2cc(C(C)C)no2)C1	ZINC001046977750	1347174754	/nfs/dbraw/zinc/17/47/54/1347174754.db2.gz	MABZITMTRIACNK-ZDUSSCGKSA-N	0	3	341.402	3.061	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2ccc(F)s2)C1	ZINC001046994581	1347177053	/nfs/dbraw/zinc/17/70/53/1347177053.db2.gz	ALZBNFWXUXPZRD-LLVKDONJSA-N	0	3	332.391	3.150	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@H](CNC(=O)[C@@H]2CCCCC2(C)C)C1	ZINC001046995572	1347178534	/nfs/dbraw/zinc/17/85/34/1347178534.db2.gz	PNAPBXZJOKJYGF-CVEARBPZSA-N	0	3	340.458	3.300	20	30		EGEDHN
Cc1ccoc1C(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1ccccc1)C2	ZINC001047027841	1347191596	/nfs/dbraw/zinc/19/15/96/1347191596.db2.gz	YOJVPTWZYALBQY-ZCNNSNEGSA-N	0	3	348.446	3.222	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3oc(C)cc3C)C2)CC1	ZINC001047232908	1347261486	/nfs/dbraw/zinc/26/14/86/1347261486.db2.gz	QPLJFSAGWVCDLO-SFHVURJKSA-N	0	3	328.456	3.094	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3sccc3F)C2)CC1	ZINC001047236144	1347263495	/nfs/dbraw/zinc/26/34/95/1347263495.db2.gz	GIVHTMDTEUOJHZ-OAHLLOKOSA-N	0	3	334.460	3.085	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3ccsc3C)C2)CC1	ZINC001047240175	1347266454	/nfs/dbraw/zinc/26/64/54/1347266454.db2.gz	DFFNUWCLQGSDRP-QGZVFWFLSA-N	0	3	330.497	3.254	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)C3(C4CC4)CCC3)C2)CC1	ZINC001047247837	1347273219	/nfs/dbraw/zinc/27/32/19/1347273219.db2.gz	MWNWAWGGDITBMW-GOSISDBHSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)[C@]3(C)C[C@H]4C[C@H]4C3)C2)CC1	ZINC001047250435	1347275232	/nfs/dbraw/zinc/27/52/32/1347275232.db2.gz	GQVLRCJLQVMEPF-KEZQHZCBSA-N	0	3	342.527	3.397	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3ccc(C)c(F)c3)C2)CC1	ZINC001047251137	1347275683	/nfs/dbraw/zinc/27/56/83/1347275683.db2.gz	OXKIMDARHXSBAV-LJQANCHMSA-N	0	3	342.458	3.332	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3c(C)cccc3F)C2)CC1	ZINC001047265661	1347286509	/nfs/dbraw/zinc/28/65/09/1347286509.db2.gz	LBDOJFCKKXDOEF-SFHVURJKSA-N	0	3	342.458	3.332	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@H]([C@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001047680324	1347326974	/nfs/dbraw/zinc/32/69/74/1347326974.db2.gz	ATTHSZDMIJQZNF-HOCLYGCPSA-N	0	3	331.435	3.070	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)CC2CCCC2)C1	ZINC001047695097	1347335680	/nfs/dbraw/zinc/33/56/80/1347335680.db2.gz	QCLFIYJUBSHHPZ-OXJNMPFZSA-N	0	3	339.483	3.465	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@H]([C@H](C)NCc3ccccc3C#N)C2)o1	ZINC001047697411	1347337617	/nfs/dbraw/zinc/33/76/17/1347337617.db2.gz	GSUCPGHSHPVNRR-YJBOKZPZSA-N	0	3	337.423	3.100	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)Cc2coc3cc(F)ccc23)C1	ZINC001079682559	1357347102	/nfs/dbraw/zinc/34/71/02/1357347102.db2.gz	JJYILDJCBBUGSO-CXAGYDPISA-N	0	3	330.403	3.127	20	30		EGEDHN
CC(C(=O)N1CC[C@@H]([C@@H](C)NCc2ccccc2C#N)C1)=C1CCC1	ZINC001047840519	1347386365	/nfs/dbraw/zinc/38/63/65/1347386365.db2.gz	KKZSKBWIFWQCAH-OXQOHEQNSA-N	0	3	337.467	3.385	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]([C@H](C)NCc2nc(C)oc2C)C1	ZINC001047924311	1347411394	/nfs/dbraw/zinc/41/13/94/1347411394.db2.gz	MXWSDIQJTPMKFT-XJKSGUPXSA-N	0	3	333.476	3.220	20	30		EGEDHN
CCC1(C(=O)N2CC[C@H]([C@@H](C)NCc3ccccc3C#N)C2)CCC1	ZINC001047935804	1347416012	/nfs/dbraw/zinc/41/60/12/1347416012.db2.gz	JGZKSMJEGRPYRN-APWZRJJASA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]([C@H](C)NCc3nc(C)c(C)s3)C2)C1	ZINC001047964702	1347426493	/nfs/dbraw/zinc/42/64/93/1347426493.db2.gz	BPQSHJJSBUUYIT-GOEBONIOSA-N	0	3	347.528	3.443	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]([C@@H](C)NCc3ccccc3C#N)C2)C1	ZINC001047966206	1347427199	/nfs/dbraw/zinc/42/71/99/1347427199.db2.gz	QQRMCFVXNULWAH-APWZRJJASA-N	0	3	337.467	3.241	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H](C)[C@H](CNCc2nc(C)sc2C)C1	ZINC001048339025	1347523167	/nfs/dbraw/zinc/52/31/67/1347523167.db2.gz	AIXQJLJTOVHORR-SWLSCSKDSA-N	0	3	335.517	3.156	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H](C)[C@@H](CNCc3csc(C)n3)C2)CC1	ZINC001048375738	1347535759	/nfs/dbraw/zinc/53/57/59/1347535759.db2.gz	XBTHFEQOEGOMIY-YOEHRIQHSA-N	0	3	347.528	3.382	20	30		EGEDHN
C[C@H](c1cccc(Cl)c1)N1C[C@@H]2CN(C(=O)C#CC3CC3)C[C@@H]2C1	ZINC001048810005	1347663290	/nfs/dbraw/zinc/66/32/90/1347663290.db2.gz	DQIKDUBHORBHNM-OLMNPRSZSA-N	0	3	342.870	3.205	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc(Cl)sc3Cl)C[C@@H]2C1	ZINC001048864071	1347673102	/nfs/dbraw/zinc/67/31/02/1347673102.db2.gz	RQPWJOKZLYKBMF-PHIMTYICSA-N	0	3	343.279	3.082	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CN(Cc3ccccc3F)C[C@H]2C1	ZINC001049026722	1347709785	/nfs/dbraw/zinc/70/97/85/1347709785.db2.gz	XXIWNZNNRWYFJL-QKLQHJQFSA-N	0	3	330.447	3.318	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C[C@@H]3C[C@@H](C)CC(C)(C)C3)C[C@@H]2C1	ZINC001049117818	1347729109	/nfs/dbraw/zinc/72/91/09/1347729109.db2.gz	KHTBQVPQCMSLFA-HCXYKTFWSA-N	0	3	330.516	3.252	20	30		EGEDHN
C=C[C@H](C(=O)N1C[C@H]2CN(C[C@H](F)CC)C[C@H]2C1)c1ccccc1	ZINC001049229818	1347751937	/nfs/dbraw/zinc/75/19/37/1347751937.db2.gz	RAFLZYITFMLTTA-HCXYKTFWSA-N	0	3	330.447	3.095	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1coc(C(C)(C)C)n1	ZINC001049469945	1347864626	/nfs/dbraw/zinc/86/46/26/1347864626.db2.gz	PAMZKDVLYVKJGE-JKSUJKDBSA-N	0	3	331.460	3.227	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](CC)OC1CCCCC1	ZINC001049472685	1347865859	/nfs/dbraw/zinc/86/58/59/1347865859.db2.gz	GAHJBLCFNIFDMI-GUDVDZBRSA-N	0	3	334.504	3.366	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1coc2c1cccc2OC	ZINC001049475734	1347867958	/nfs/dbraw/zinc/86/79/58/1347867958.db2.gz	VPVNWJCQXLNGQC-IAGOWNOFSA-N	0	3	340.423	3.306	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(-c2ccncc2)o1	ZINC001049517286	1347887708	/nfs/dbraw/zinc/88/77/08/1347887708.db2.gz	IHYRLUPDJYUGHK-MSOLQXFVSA-N	0	3	349.434	3.044	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)C1C2CC3CC(C2)CC1C3	ZINC001049521755	1347889818	/nfs/dbraw/zinc/88/98/18/1347889818.db2.gz	MWTMMWONTUTPTF-FMRHEXRGSA-N	0	3	340.511	3.147	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@H]2CCCN3C(=O)C2(C3CC3)CC2)cc1	ZINC001049541687	1347898863	/nfs/dbraw/zinc/89/88/63/1347898863.db2.gz	ONRHXXHHFKXETA-UXHICEINSA-N	0	3	349.478	3.314	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H]1CCCc2ccccc21	ZINC001049550967	1347903707	/nfs/dbraw/zinc/90/37/07/1347903707.db2.gz	CXVXBJNASGMNFV-PWRODBHTSA-N	0	3	336.479	3.195	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cccc([C@@H]2CCOC2)c1	ZINC001049561480	1347910481	/nfs/dbraw/zinc/91/04/81/1347910481.db2.gz	LIIXAXACBZEGFW-VAMGGRTRSA-N	0	3	340.467	3.055	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cccc(-n2cccc2)c1	ZINC001049575503	1347916993	/nfs/dbraw/zinc/91/69/93/1347916993.db2.gz	GXNRLPDGVQOCBB-RTWAWAEBSA-N	0	3	347.462	3.180	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1nc2ccccc2cc1C	ZINC001049606703	1347934148	/nfs/dbraw/zinc/93/41/48/1347934148.db2.gz	URIMXWJSMHVOEP-MOPGFXCFSA-N	0	3	335.451	3.408	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1cccc2cccnc21	ZINC001049626747	1347941146	/nfs/dbraw/zinc/94/11/46/1347941146.db2.gz	SBEJLJSAGCYNAD-OALUTQOASA-N	0	3	335.451	3.029	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1cc2ccccc2o1	ZINC001049631573	1347943763	/nfs/dbraw/zinc/94/37/63/1347943763.db2.gz	WRBQAEKXJJGVRL-RBUKOAKNSA-N	0	3	336.435	3.064	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cnc2ccsc2c1	ZINC001049638029	1347947718	/nfs/dbraw/zinc/94/77/18/1347947718.db2.gz	JSDLGQCGZDAQHJ-HOTGVXAUSA-N	0	3	327.453	3.161	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1ncsc1C1CC1	ZINC001049724768	1347991719	/nfs/dbraw/zinc/99/17/19/1347991719.db2.gz	TZAIZSDFMNZHAG-CABCVRRESA-N	0	3	331.485	3.276	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1c[nH]c2cc(C)ccc12	ZINC001049778060	1348017347	/nfs/dbraw/zinc/01/73/47/1348017347.db2.gz	MOSFKMGZDGCQFL-LEWJYISDSA-N	0	3	349.478	3.107	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)C(C)(C)c1cccc(OC)c1	ZINC001049830234	1348044811	/nfs/dbraw/zinc/04/48/11/1348044811.db2.gz	DZLIGBMOIYAODW-MOPGFXCFSA-N	0	3	342.483	3.224	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1sccc1COC	ZINC001049838797	1348051500	/nfs/dbraw/zinc/05/15/00/1348051500.db2.gz	FNOKRFVDLCAXKR-HZPDHXFCSA-N	0	3	334.485	3.150	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1[nH]ccc1-c1ccccc1	ZINC001049840186	1348052127	/nfs/dbraw/zinc/05/21/27/1348052127.db2.gz	GKJWGMGKWKRDJA-PMACEKPBSA-N	0	3	347.462	3.384	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H]1CCCc2sc(C)nc21	ZINC001049844544	1348054638	/nfs/dbraw/zinc/05/46/38/1348054638.db2.gz	QVLKFSVZFOIJGH-BZUAXINKSA-N	0	3	345.512	3.123	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccccc1OC(C)C	ZINC001049854940	1348061570	/nfs/dbraw/zinc/06/15/70/1348061570.db2.gz	OUCVSPYDYGRIOC-MSOLQXFVSA-N	0	3	328.456	3.339	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1coc2ccc(F)cc12	ZINC001049868000	1348073900	/nfs/dbraw/zinc/07/39/00/1348073900.db2.gz	QKPTXVOSROCJMD-SJORKVTESA-N	0	3	328.387	3.437	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1CCC[C@@H]2[C@H]1CCN2C[C@H](F)CC	ZINC001049868239	1348074239	/nfs/dbraw/zinc/07/42/39/1348074239.db2.gz	RTMFLFKNDUMPPX-VAMGGRTRSA-N	0	3	342.458	3.024	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1CCC[C@@H]2[C@@H]1CCN2C[C@@H](F)CC	ZINC001049868241	1348074249	/nfs/dbraw/zinc/07/42/49/1348074249.db2.gz	RTMFLFKNDUMPPX-ZCNNSNEGSA-N	0	3	342.458	3.024	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](C)Cc1ccc(OC)cc1	ZINC001049910914	1348107128	/nfs/dbraw/zinc/10/71/28/1348107128.db2.gz	WOWGQNWZXAKSGB-PWIZWCRZSA-N	0	3	342.483	3.125	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](C)Cc1ccc(F)cc1	ZINC001049926890	1348118151	/nfs/dbraw/zinc/11/81/51/1348118151.db2.gz	SJGGXNWYZVQJCU-FFZOFVMBSA-N	0	3	342.458	3.093	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cccc2c1OCC2(C)C	ZINC001049933615	1348120792	/nfs/dbraw/zinc/12/07/92/1348120792.db2.gz	MDYHJVCALVHVJR-QZTJIDSGSA-N	0	3	340.467	3.222	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cc(C4CCCCC4)n[nH]3)[C@@H]2C1	ZINC001050065314	1348170929	/nfs/dbraw/zinc/17/09/29/1348170929.db2.gz	PVFYZBIRHBSHTB-QFBILLFUSA-N	0	3	342.487	3.180	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)[C@H]3CCCc4ccccc43)[C@@H]2C1	ZINC001050077268	1348174817	/nfs/dbraw/zinc/17/48/17/1348174817.db2.gz	POYSIBFGEINQPI-SESVDKBCSA-N	0	3	336.479	3.053	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cc(C)cc(OC)c3C)[C@@H]2C1	ZINC001050086081	1348177399	/nfs/dbraw/zinc/17/73/99/1348177399.db2.gz	SRPJYCRCMDLTKC-FUHWJXTLSA-N	0	3	328.456	3.034	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)C[C@H](C)c3ccccc3F)[C@@H]2C1	ZINC001050164320	1348201366	/nfs/dbraw/zinc/20/13/66/1348201366.db2.gz	BPHVFMYXOIFPER-TXPKVOOTSA-N	0	3	330.447	3.428	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)C[C@H]3CCc4ccccc43)[C@@H]2C1	ZINC001050167075	1348202022	/nfs/dbraw/zinc/20/20/22/1348202022.db2.gz	LBHGZVCMZACNSF-SVFBPWRDSA-N	0	3	336.479	3.053	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3cc4cccc(C)c4s3)C2)CC1	ZINC001050569930	1348291628	/nfs/dbraw/zinc/29/16/28/1348291628.db2.gz	PFVCAJSTDPGQOA-UHFFFAOYSA-N	0	3	338.476	3.381	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cc(C)cc(Cl)c3)C2)CC1	ZINC001050591255	1348295802	/nfs/dbraw/zinc/29/58/02/1348295802.db2.gz	DQIAOSAAPDGTLK-UHFFFAOYSA-N	0	3	330.859	3.210	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3coc4cc(C)c(C)cc34)C2)CC1	ZINC001050604824	1348298595	/nfs/dbraw/zinc/29/85/95/1348298595.db2.gz	PQRDWTOTZFQDOL-UHFFFAOYSA-N	0	3	336.435	3.221	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc(F)c(Cl)c3)C2)CC1	ZINC001050639234	1348311610	/nfs/dbraw/zinc/31/16/10/1348311610.db2.gz	RLMYLCRVGFKZTE-UHFFFAOYSA-N	0	3	334.822	3.040	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc(C)cc3Cl)C2)CC1	ZINC001050675321	1348322879	/nfs/dbraw/zinc/32/28/79/1348322879.db2.gz	MMUUQGFJDOLOQE-UHFFFAOYSA-N	0	3	330.859	3.210	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H]3C[C@H]3c3ccc(C)s3)C2)CC1	ZINC001050692759	1348329096	/nfs/dbraw/zinc/32/90/96/1348329096.db2.gz	NIEXGQWHFTYNDH-IAGOWNOFSA-N	0	3	342.508	3.108	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H](C)c3ccc(CC)cc3)C2)CC1	ZINC001050700492	1348330981	/nfs/dbraw/zinc/33/09/81/1348330981.db2.gz	IPICIISDBWYODB-SFHVURJKSA-N	0	3	338.495	3.300	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)[C@@H]3CCC[C@@H](F)C3)cccc2C1	ZINC001051288239	1348419584	/nfs/dbraw/zinc/41/95/84/1348419584.db2.gz	NNIRWKXAHZIUSE-VQIMIIECSA-N	0	3	342.458	3.213	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3ncccc3F)cccc2C1	ZINC001051303633	1348426320	/nfs/dbraw/zinc/42/63/20/1348426320.db2.gz	MLFGSOSVAQININ-UHFFFAOYSA-N	0	3	339.414	3.085	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3c[nH]cc3C3CC3)cccc2C1	ZINC001051306330	1348427564	/nfs/dbraw/zinc/42/75/64/1348427564.db2.gz	SZNDDRZZIYRSRR-UHFFFAOYSA-N	0	3	347.462	3.204	20	30		EGEDHN
Cc1cccc(C(=O)N[C@H]2CCCN(Cc3ccc(C#N)cc3)CC2)n1	ZINC001052209647	1348512368	/nfs/dbraw/zinc/51/23/68/1348512368.db2.gz	ZRNDEXPGFFXNAA-IBGZPJMESA-N	0	3	348.450	3.046	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@H](NC(=O)C3(F)CCCC3)CC2)c1	ZINC001052507725	1348562039	/nfs/dbraw/zinc/56/20/39/1348562039.db2.gz	XMVPUBVYAMWBCN-GOSISDBHSA-N	0	3	343.446	3.311	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2ccc3c4c(cccc42)CC3)CC1	ZINC001052540559	1348572367	/nfs/dbraw/zinc/57/23/67/1348572367.db2.gz	INVBGPPXGPMHTA-SFHVURJKSA-N	0	3	332.447	3.156	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCN(Cc3cccnc3C)CC2)cc1	ZINC001052614060	1348597003	/nfs/dbraw/zinc/59/70/03/1348597003.db2.gz	KCQKRKODYUWPPO-NRFANRHFSA-N	0	3	347.462	3.156	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)C(C)(C)c2cccc(F)c2)CC1	ZINC001052707139	1348643526	/nfs/dbraw/zinc/64/35/26/1348643526.db2.gz	YXFQFVDHPYPUKX-GOSISDBHSA-N	0	3	330.447	3.097	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccccc2O[C@H](C)CC)CC1	ZINC001052755589	1348664613	/nfs/dbraw/zinc/66/46/13/1348664613.db2.gz	WOKZRBRQVPQCHD-QZTJIDSGSA-N	0	3	342.483	3.472	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cc(-c3ccccc3)ccn2)CC1	ZINC001052824470	1348691241	/nfs/dbraw/zinc/69/12/41/1348691241.db2.gz	YKCSKFLUNOYLBR-HXUWFJFHSA-N	0	3	347.462	3.356	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2ccc(O[C@@H](C)CC)cc2)CC1	ZINC001052848961	1348700500	/nfs/dbraw/zinc/70/05/00/1348700500.db2.gz	JEFHVQCLNHGBQL-FUHWJXTLSA-N	0	3	328.456	3.081	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cnn(C(CC)CC)c2C)CC1	ZINC001052851268	1348701880	/nfs/dbraw/zinc/70/18/80/1348701880.db2.gz	YPPUOAVWSPGWAB-QGZVFWFLSA-N	0	3	344.503	3.160	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2c(Cl)cccc2Cl)CC1	ZINC001052891281	1348728517	/nfs/dbraw/zinc/72/85/17/1348728517.db2.gz	ONGNXUXBQKTPGM-GFCCVEGCSA-N	0	3	325.239	3.211	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)C[C@@H]2CCc3ccccc3C2)CC1	ZINC001052893854	1348731010	/nfs/dbraw/zinc/73/10/10/1348731010.db2.gz	FIEWDUAVKKIPIG-WIYYLYMNSA-N	0	3	338.495	3.176	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cnc(C(C)(C)C)s2)CC1	ZINC001052962199	1348773791	/nfs/dbraw/zinc/77/37/91/1348773791.db2.gz	XPLAORAKKJQWJT-AWEZNQCLSA-N	0	3	333.501	3.048	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2coc(C3CCCCC3)n2)CC1	ZINC001052964172	1348775945	/nfs/dbraw/zinc/77/59/45/1348775945.db2.gz	DTXRXSZMBILOBX-KRWDZBQOSA-N	0	3	343.471	3.330	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc(N(C)CCC)cc2)CC1	ZINC001052973898	1348782144	/nfs/dbraw/zinc/78/21/44/1348782144.db2.gz	FTLHXOAKRGLYJY-IBGZPJMESA-N	0	3	341.499	3.140	20	30		EGEDHN
CC(=O)N1CCC[C@H]([C@@H]2CCCN(Cc3ccc(F)c(C#N)c3)C2)C1	ZINC001052998074	1348795172	/nfs/dbraw/zinc/79/51/72/1348795172.db2.gz	UVQUFIKRYYABBV-MSOLQXFVSA-N	0	3	343.446	3.168	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)Cc2cccs2)C1	ZINC001053060121	1348869050	/nfs/dbraw/zinc/86/90/50/1348869050.db2.gz	CZCYNORIDHSICE-MJGOQNOKSA-N	0	3	344.524	3.407	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccc(C)s2)C1	ZINC001053061844	1348871644	/nfs/dbraw/zinc/87/16/44/1348871644.db2.gz	VFFMUNOWOFMTFB-DLBZAZTESA-N	0	3	330.497	3.396	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)C2CC(F)(F)C2)C1	ZINC001053075696	1348893152	/nfs/dbraw/zinc/89/31/52/1348893152.db2.gz	IZZUNTYOPUBYGV-RDJZCZTQSA-N	0	3	338.442	3.148	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)C2C(C)(C)C2(C)C)C1	ZINC001053076554	1348894394	/nfs/dbraw/zinc/89/43/94/1348894394.db2.gz	PPUHJELNFKCUJV-IRXDYDNUSA-N	0	3	330.516	3.395	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2scnc2CC)C1	ZINC001053088621	1348914203	/nfs/dbraw/zinc/91/42/03/1348914203.db2.gz	YFCNSALMHPVXPW-NVXWUHKLSA-N	0	3	345.512	3.045	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cccc(F)c2F)C1	ZINC001053093895	1348922524	/nfs/dbraw/zinc/92/25/24/1348922524.db2.gz	ATJWWHZXMWKDCR-QAPCUYQASA-N	0	3	346.421	3.305	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)[C@H]2C[C@H]3C[C@H]3C2)C1	ZINC001053094288	1348924094	/nfs/dbraw/zinc/92/40/94/1348924094.db2.gz	DBLALVSFRTVVJL-SLHNCBLASA-N	0	3	328.500	3.149	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccoc2C2CC2)C1	ZINC001053095209	1348924880	/nfs/dbraw/zinc/92/48/80/1348924880.db2.gz	IHYUARXPCXBWMO-MJGOQNOKSA-N	0	3	340.467	3.497	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccn(CC)c2C)C1	ZINC001053095918	1348925652	/nfs/dbraw/zinc/92/56/52/1348925652.db2.gz	MIZKKXWRVLBEAU-QUCCMNQESA-N	0	3	341.499	3.156	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccncc2Cl)C1	ZINC001053098004	1348929258	/nfs/dbraw/zinc/92/92/58/1348929258.db2.gz	JBODSKXJRFBBFP-MAUKXSAKSA-N	0	3	345.874	3.075	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccncc2Cl)C1	ZINC001053098002	1348929332	/nfs/dbraw/zinc/92/93/32/1348929332.db2.gz	JBODSKXJRFBBFP-CRAIPNDOSA-N	0	3	345.874	3.075	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2sc(C)nc2C)C1	ZINC001053104185	1348939340	/nfs/dbraw/zinc/93/93/40/1348939340.db2.gz	CSNHHSOXQZCXDZ-DLBZAZTESA-N	0	3	345.512	3.100	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)Cc2cccc(F)c2)C1	ZINC001053104400	1348939556	/nfs/dbraw/zinc/93/95/56/1348939556.db2.gz	GCMCIJVRTPNDIQ-UYAOXDASSA-N	0	3	342.458	3.095	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(F)cc2F)C1	ZINC001053106955	1348945053	/nfs/dbraw/zinc/94/50/53/1348945053.db2.gz	XYNDCIPJMFSTKK-DNVCBOLYSA-N	0	3	346.421	3.305	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)Cc2ccccc2F)C1	ZINC001053107083	1348945171	/nfs/dbraw/zinc/94/51/71/1348945171.db2.gz	YZMXGFWFMQUPHV-AZUAARDMSA-N	0	3	342.458	3.095	20	30		EGEDHN
C=CCCN1Cc2ccccc2C[C@@H]1CNC(=O)c1ccc(Cl)[nH]1	ZINC001054052440	1349140431	/nfs/dbraw/zinc/14/04/31/1349140431.db2.gz	XIPWUKVBXAIPIB-MRXNPFEDSA-N	0	3	343.858	3.401	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001054074897	1349147247	/nfs/dbraw/zinc/14/72/47/1349147247.db2.gz	CHBIHISJHCZTGB-OAQYLSRUSA-N	0	3	339.483	3.419	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc3ccccc3s1)C2	ZINC001054160931	1349162786	/nfs/dbraw/zinc/16/27/86/1349162786.db2.gz	SIZDYWZYGQDWOK-HXUWFJFHSA-N	0	3	338.476	3.463	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(Cl)cc1F)C2	ZINC001054162133	1349165018	/nfs/dbraw/zinc/16/50/18/1349165018.db2.gz	XXHOOFDIVGYDGO-LJQANCHMSA-N	0	3	348.849	3.431	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)[C@H](C)c1c(F)cccc1F)C2	ZINC001054164347	1349167525	/nfs/dbraw/zinc/16/75/25/1349167525.db2.gz	HLJKGGJNSVHMQN-QRWLVFNGSA-N	0	3	346.421	3.016	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1c(C)cc(F)cc1C)C2	ZINC001054173808	1349175644	/nfs/dbraw/zinc/17/56/44/1349175644.db2.gz	GPYZCHNDFYACNR-OAQYLSRUSA-N	0	3	342.458	3.394	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@]2(CCN(Cc3cccnc3C)C2)C1	ZINC001054175747	1349177881	/nfs/dbraw/zinc/17/78/81/1349177881.db2.gz	UIZTUDLPHAJTKE-OAQYLSRUSA-N	0	3	341.499	3.417	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@]2(CCN(Cc3cnccc3C)C2)C1	ZINC001054177654	1349179342	/nfs/dbraw/zinc/17/93/42/1349179342.db2.gz	PQUWBWGDLKJHFV-OAQYLSRUSA-N	0	3	341.499	3.417	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)C(C)(C)c1cccc(F)c1)C2	ZINC001054195881	1349198483	/nfs/dbraw/zinc/19/84/83/1349198483.db2.gz	FMRMINWNFFOZKA-NRFANRHFSA-N	0	3	342.458	3.051	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc3occc3s1)C2	ZINC001054195734	1349198710	/nfs/dbraw/zinc/19/87/10/1349198710.db2.gz	CKKCSKOLSSQGEF-SFHVURJKSA-N	0	3	328.437	3.056	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc3occc3s1)C2	ZINC001054195733	1349198876	/nfs/dbraw/zinc/19/88/76/1349198876.db2.gz	CKKCSKOLSSQGEF-GOSISDBHSA-N	0	3	328.437	3.056	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)C1[C@@H]3CCCCCC[C@@H]13)C2	ZINC001054203965	1349205406	/nfs/dbraw/zinc/20/54/06/1349205406.db2.gz	MNFKENKMRREHTD-DBXWQHBBSA-N	0	3	328.500	3.151	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@]3(C2)CCCN(C(=O)[C@H]2CC24CC4)C3)cc1	ZINC001054204097	1349205434	/nfs/dbraw/zinc/20/54/34/1349205434.db2.gz	NJSYRRLPYBMEIU-CTNGQTDRSA-N	0	3	349.478	3.173	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc(C)c(CC)o1)C2	ZINC001054226972	1349220873	/nfs/dbraw/zinc/22/08/73/1349220873.db2.gz	GLPIGYVWWKOPJJ-HXUWFJFHSA-N	0	3	328.456	3.102	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)C[C@@H](C)c1ccco1)C2	ZINC001054229031	1349222460	/nfs/dbraw/zinc/22/24/60/1349222460.db2.gz	IIGBFQXMDDUKFJ-YLJYHZDGSA-N	0	3	328.456	3.111	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1csc3c1CCCC3)C2	ZINC001054237086	1349230279	/nfs/dbraw/zinc/23/02/79/1349230279.db2.gz	UKOOFMMKOJLARQ-HXUWFJFHSA-N	0	3	342.508	3.188	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(CC(C)C)cc1)C2	ZINC001054239982	1349234577	/nfs/dbraw/zinc/23/45/77/1349234577.db2.gz	YHQZBGXVLUXYKS-QFIPXVFZSA-N	0	3	338.495	3.446	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H](C)n1c(C)ccc1C)C2	ZINC001054244247	1349237563	/nfs/dbraw/zinc/23/75/63/1349237563.db2.gz	BCMIZHFMWCHVRP-TZIWHRDSSA-N	0	3	341.499	3.004	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccccc1CC(C)C)C2	ZINC001054246759	1349242010	/nfs/dbraw/zinc/24/20/10/1349242010.db2.gz	ISTWLEIBAXWDPQ-JOCHJYFZSA-N	0	3	338.495	3.446	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)C1(C)C(C)(C)C1(C)C)C2	ZINC001054248697	1349243557	/nfs/dbraw/zinc/24/35/57/1349243557.db2.gz	AZPRCYDLACSICP-NRFANRHFSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(-c3ccccc3)[nH]1)C2	ZINC001054248899	1349244616	/nfs/dbraw/zinc/24/46/16/1349244616.db2.gz	GPESJTDNHQJQOO-QFIPXVFZSA-N	0	3	347.462	3.243	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@@H]3CCO[C@@H](C)C3)cc2C1	ZINC001054287114	1349290151	/nfs/dbraw/zinc/29/01/51/1349290151.db2.gz	ZMXAXNKAOOGGKO-FUHWJXTLSA-N	0	3	342.483	3.400	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccccc2F)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054341033	1349321091	/nfs/dbraw/zinc/32/10/91/1349321091.db2.gz	LIMOLXJXGJXHHW-PXAZEXFGSA-N	0	3	343.427	3.009	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2=CCCCCC2)C[C@H]1NCc1ccc(C#N)s1	ZINC001054599220	1349411008	/nfs/dbraw/zinc/41/10/08/1349411008.db2.gz	MXPRCQPKQUESQJ-RDTXWAMCSA-N	0	3	343.496	3.447	20	30		EGEDHN
CCc1ccc(C(=O)N2C[C@H](C)[C@H](NCc3ccc(C#N)s3)C2)o1	ZINC001054812401	1349473777	/nfs/dbraw/zinc/47/37/77/1349473777.db2.gz	JNBTZHKHUWNAPN-BLLLJJGKSA-N	0	3	343.452	3.025	20	30		EGEDHN
C#Cc1ccc(C(=O)N2C[C@H](NCc3ccccc3F)[C@@H](C)C2)cc1	ZINC001054960853	1349528675	/nfs/dbraw/zinc/52/86/75/1349528675.db2.gz	FPTQFEIYPZZCMV-YWZLYKJASA-N	0	3	336.410	3.057	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2CC(C)(C)C2)C[C@@H]1NCc1ccc(C#N)s1	ZINC001055001382	1349546066	/nfs/dbraw/zinc/54/60/66/1349546066.db2.gz	HEGZMQZIWKSRRX-DYVFJYSZSA-N	0	3	345.512	3.383	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@@H]2CCc3c2cccc3Cl)C1	ZINC001080142474	1357499570	/nfs/dbraw/zinc/49/95/70/1357499570.db2.gz	WFUYKUYZMHSSLN-MZMPZRCHSA-N	0	3	332.875	3.382	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CN(Cc3cccc(N(C)C)c3)C[C@H]2C)C1	ZINC001080404666	1357608121	/nfs/dbraw/zinc/60/81/21/1357608121.db2.gz	SRSIZHCJPVLJRS-VQIMIIECSA-N	0	3	341.499	3.045	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)[C@@H]2CCC(C)=C(C)C2)C1	ZINC001070410204	1354340428	/nfs/dbraw/zinc/34/04/28/1354340428.db2.gz	XTMWWALFQCNUQU-IAGOWNOFSA-N	0	3	342.487	3.138	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCO[C@H]1C1CCN(C(=O)CC(C)(C)C)CC1	ZINC001071035522	1354441024	/nfs/dbraw/zinc/44/10/24/1354441024.db2.gz	YJQFKZAKAXZPQP-WBVHZDCISA-N	0	3	342.911	3.161	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)O[C@@]2(CCN(Cc3ccccc3)C2)C1	ZINC001071197486	1354499179	/nfs/dbraw/zinc/49/91/79/1354499179.db2.gz	UBQJNIZUWNVDLO-DYESRHJHSA-N	0	3	342.483	3.091	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1ccoc1C1CC1)C[C@H](C)O2	ZINC001071204017	1354504043	/nfs/dbraw/zinc/50/40/43/1354504043.db2.gz	LQMJAJATBXBYLU-YWZLYKJASA-N	0	3	344.455	3.039	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C(CC)(CC)CC)C[C@H](C)O2	ZINC001071226047	1354513706	/nfs/dbraw/zinc/51/37/06/1354513706.db2.gz	UMHCYMQPJRMGTB-FXAWDEMLSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C1CCC(C)(C)CC1)C[C@H](C)O2	ZINC001071246183	1354526567	/nfs/dbraw/zinc/52/65/67/1354526567.db2.gz	QCLYUHVYZUKMSK-UWJYYQICSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc(C)c(OC)c(C)c2)CC[C@H]1C	ZINC001071523005	1354744433	/nfs/dbraw/zinc/74/44/33/1354744433.db2.gz	VZHXVMBNABZXLR-SJLPKXTDSA-N	0	3	330.472	3.471	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2ccc(OC)cc2C)CC[C@H]1C	ZINC001071530871	1354749570	/nfs/dbraw/zinc/74/95/70/1354749570.db2.gz	BWJXRZJVIQLXEO-AEFFLSMTSA-N	0	3	330.472	3.091	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccnn2C(CC)CC)CC[C@@H]1C	ZINC001071568244	1354768290	/nfs/dbraw/zinc/76/82/90/1354768290.db2.gz	KZCJPOSNULQPPQ-HOTGVXAUSA-N	0	3	332.492	3.403	20	30		EGEDHN
C=C(C)CCN1C[C@H](NC(=O)c2nc3cccnc3s2)CC[C@H]1C	ZINC001071571926	1354771093	/nfs/dbraw/zinc/77/10/93/1354771093.db2.gz	NRTVERXYBGAXRF-ZIAGYGMSSA-N	0	3	344.484	3.240	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc3oc(C)nc3c2)CC[C@@H]1C	ZINC001071602109	1354788688	/nfs/dbraw/zinc/78/86/88/1354788688.db2.gz	GWOXIWBYZAFMHL-XJKSGUPXSA-N	0	3	327.428	3.295	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2c(C)noc2C(F)F)CC[C@@H]1C	ZINC001071601463	1354788739	/nfs/dbraw/zinc/78/87/39/1354788739.db2.gz	AGNOINFAELOSHC-CMPLNLGQSA-N	0	3	327.375	3.079	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2CCc3ccccc3CC2)CC[C@H]1C	ZINC001071621687	1354804502	/nfs/dbraw/zinc/80/45/02/1354804502.db2.gz	BPYPETJVLOMNAH-DYESRHJHSA-N	0	3	338.495	3.174	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)Cc2cc3ccccc3s2)CC[C@H]1C	ZINC001071681152	1354848126	/nfs/dbraw/zinc/84/81/26/1354848126.db2.gz	ZAQRRQAHRMQHRI-NVXWUHKLSA-N	0	3	340.492	3.436	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc3ccc(OC)cc3[nH]2)CC[C@H]1C	ZINC001071728471	1354883755	/nfs/dbraw/zinc/88/37/55/1354883755.db2.gz	NGPKOCBQBRCFEL-GDBMZVCRSA-N	0	3	341.455	3.335	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cccc(-n3cccn3)c2)CC[C@H]1C	ZINC001071898189	1355013969	/nfs/dbraw/zinc/01/39/69/1355013969.db2.gz	WZTTZHTUTIGCJX-SJLPKXTDSA-N	0	3	338.455	3.031	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc3ccn(C)c3c2)CC[C@@H]1C	ZINC001071962911	1355047294	/nfs/dbraw/zinc/04/72/94/1355047294.db2.gz	CIXAKZUFBFKGCU-YJBOKZPZSA-N	0	3	325.456	3.337	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc(C)nc3ccccc32)CC[C@H]1C	ZINC001072049638	1355103707	/nfs/dbraw/zinc/10/37/07/1355103707.db2.gz	QFMMFLAMVVDNED-SJORKVTESA-N	0	3	335.451	3.149	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)Cc2ccc3c(c2)CCCC3)CC[C@H]1C	ZINC001072065322	1355110051	/nfs/dbraw/zinc/11/00/51/1355110051.db2.gz	BYHDVWZJZWLBTG-UZLBHIALSA-N	0	3	326.484	3.263	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cnc(C2CC2)nc1	ZINC001089705021	1360607548	/nfs/dbraw/zinc/60/75/48/1360607548.db2.gz	AYVBBVDSWUUARH-KRWDZBQOSA-N	0	3	342.487	3.151	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2cc3ccccc3n2C)CC[C@@H]1C	ZINC001072101278	1355130530	/nfs/dbraw/zinc/13/05/30/1355130530.db2.gz	FOUKCVMTSODZOL-WMZOPIPTSA-N	0	3	339.483	3.266	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2(c3ccc(C)cc3)CCC2)CC[C@H]1C	ZINC001072101937	1355131317	/nfs/dbraw/zinc/13/13/17/1355131317.db2.gz	LQGNPPGHDFJZPA-UYAOXDASSA-N	0	3	338.495	3.409	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc(NC(C)=O)ccc2C)CC[C@H]1C	ZINC001072120701	1355141469	/nfs/dbraw/zinc/14/14/69/1355141469.db2.gz	XWFRJULTAFJKAC-QAPCUYQASA-N	0	3	343.471	3.112	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)Cc2c(C)oc3ccccc32)CC[C@H]1C	ZINC001072128626	1355144261	/nfs/dbraw/zinc/14/42/61/1355144261.db2.gz	CZHUPAHDDAGKCO-WBVHZDCISA-N	0	3	338.451	3.276	20	30		EGEDHN
C=CCN1CC[C@H](CN(Cc2scnc2C)C(=O)c2ccco2)C1	ZINC001072132595	1355146874	/nfs/dbraw/zinc/14/68/74/1355146874.db2.gz	QYPLNGORBCWRKG-HNNXBMFYSA-N	0	3	345.468	3.195	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@H](C)[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001072176896	1355171425	/nfs/dbraw/zinc/17/14/25/1355171425.db2.gz	RTOIDDUFUWGQCJ-YJBOKZPZSA-N	0	3	345.462	3.318	20	30		EGEDHN
C[C@@H]1CCN(C(=O)CCC2CC2)C[C@H]1CNCc1ccccc1C#N	ZINC001072231675	1355196050	/nfs/dbraw/zinc/19/60/50/1355196050.db2.gz	LEQSSWUXOCBIKD-OXQOHEQNSA-N	0	3	339.483	3.323	20	30		EGEDHN
C/C=C(\C)C(=O)N1CC[C@H](C)[C@@H](CNCc2ccccc2C#N)C1	ZINC001072240548	1355200603	/nfs/dbraw/zinc/20/06/03/1355200603.db2.gz	JIUANBHWQDINFF-WIMZTDEYSA-N	0	3	325.456	3.099	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)CC(C)(C)c3ccc(F)cc3)C2)C1	ZINC001072817152	1355450172	/nfs/dbraw/zinc/45/01/72/1355450172.db2.gz	SVXUZBWKLLGRGF-UHFFFAOYSA-N	0	3	330.447	3.214	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3ccccc3-c3ccncc3)C2)C1	ZINC001072852637	1355466097	/nfs/dbraw/zinc/46/60/97/1355466097.db2.gz	IZUDDDJERJCNNR-UHFFFAOYSA-N	0	3	333.435	3.083	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CN(C(=O)C45CCC(CC4)C5)C3)C2)cc1	ZINC001072857160	1355468786	/nfs/dbraw/zinc/46/87/86/1355468786.db2.gz	NDVOZUXKVWKBRD-UHFFFAOYSA-N	0	3	349.478	3.173	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@H]3CCC[C@H](C(F)(F)F)C3)C2)C1	ZINC001072884451	1355483658	/nfs/dbraw/zinc/48/36/58/1355483658.db2.gz	VFPMGAYPGQVRHB-KBPBESRZSA-N	0	3	330.394	3.075	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)Cc3ccc(CCCC)cc3)C2)C1	ZINC001072899837	1355488440	/nfs/dbraw/zinc/48/84/40/1355488440.db2.gz	OTQZUAVMCZYQBB-UHFFFAOYSA-N	0	3	338.495	3.129	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)C3CC(c4cccc(F)c4)C3)C2)C1	ZINC001073489973	1355819173	/nfs/dbraw/zinc/81/91/73/1355819173.db2.gz	FRKUQYHTGLYKIH-UHFFFAOYSA-N	0	3	328.431	3.040	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2ccc(Cl)cc2C)C1	ZINC001073753317	1355889021	/nfs/dbraw/zinc/88/90/21/1355889021.db2.gz	UCMOZNAKNGONCL-MRXNPFEDSA-N	0	3	336.863	3.045	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)[C@H]2CC[C@H](C(C)C)CC2)C1	ZINC001073831889	1355911608	/nfs/dbraw/zinc/91/16/08/1355911608.db2.gz	HXYDRZBXGQAHSD-FHWLQOOXSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2oc3ccccc3c2C)C1	ZINC001073877883	1355934350	/nfs/dbraw/zinc/93/43/50/1355934350.db2.gz	CYHPEIRCENMKDS-MRXNPFEDSA-N	0	3	342.439	3.138	20	30		EGEDHN
C[C@@H](C(=O)N1CCCC[C@@H]1CN(C)Cc1cccc(C#N)c1)C1CC1	ZINC001073981695	1356010757	/nfs/dbraw/zinc/01/07/57/1356010757.db2.gz	LMQRFYVBVKVXHC-OXQOHEQNSA-N	0	3	339.483	3.417	20	30		EGEDHN
C[C@@H]1CN(C(=O)C(C)(C)C)C[C@@]1(C)CNCc1cc(F)ccc1C#N	ZINC001183248842	1387284794	/nfs/dbraw/zinc/28/47/94/1387284794.db2.gz	WSLJUNBDKVRWHW-JLTOFOAXSA-N	0	3	345.462	3.318	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3c3sccc3C)[C@@H]2C1	ZINC001075787592	1356422453	/nfs/dbraw/zinc/42/24/53/1356422453.db2.gz	RTPYOLBXAJUIGQ-YLFCFFPRSA-N	0	3	330.497	3.269	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3oc4c(cccc4F)c3C)[C@@H]2C1	ZINC001075884047	1356439220	/nfs/dbraw/zinc/43/92/20/1356439220.db2.gz	GMLHVSJBNLMSDR-WMLDXEAASA-N	0	3	340.398	3.050	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3[nH]ccc3-c3ccccc3)[C@@H]2C1	ZINC001076451909	1356580747	/nfs/dbraw/zinc/58/07/47/1356580747.db2.gz	SGFRQGBWOPWJFN-PKOBYXMFSA-N	0	3	335.451	3.404	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3cc(CCC)c(C)s3)[C@@H]2C1	ZINC001076545217	1356614710	/nfs/dbraw/zinc/61/47/10/1356614710.db2.gz	PELTYHZDAWLXFD-DLBZAZTESA-N	0	3	330.497	3.179	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3c3cccc(F)c3F)[C@@H]2C1	ZINC001076590600	1356625865	/nfs/dbraw/zinc/62/58/65/1356625865.db2.gz	RSMVLHCTSFFQSJ-KMANFZQXSA-N	0	3	346.421	3.177	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)C[C@H](C)c1c(C)n[nH]c1C	ZINC001099126662	1363639464	/nfs/dbraw/zinc/63/94/64/1363639464.db2.gz	YBCBKXODMPUNED-YOEHRIQHSA-N	0	3	346.519	3.313	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)C2[C@H]3CCCCCC[C@H]23)C[C@H]1C(F)(F)F	ZINC001099314407	1363745575	/nfs/dbraw/zinc/74/55/75/1363745575.db2.gz	MUBJTQWDLQRIJG-BYNSBNAKSA-N	0	3	344.421	3.368	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)C[C@H](C)C1CC1	ZINC001099359591	1363772449	/nfs/dbraw/zinc/77/24/49/1363772449.db2.gz	RSYYXTPFDYYTSI-FUHWJXTLSA-N	0	3	336.520	3.232	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2C[C@@H](NC(=O)C3CCC3)C23CCC3)c(F)c1	ZINC001078523451	1356992699	/nfs/dbraw/zinc/99/26/99/1356992699.db2.gz	KZUAFJQCAXFELM-QZTJIDSGSA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@@H](NC(=O)C2CCCC2)C12CCC2	ZINC001078529226	1356996658	/nfs/dbraw/zinc/99/66/58/1356996658.db2.gz	NRZZLXNUAVTSOB-ZIAGYGMSSA-N	0	3	341.293	3.102	20	30		EGEDHN
C#CCCN1C[C@@H](C)[C@H](NC(=O)c2ccc(-c3cccs3)o2)C1	ZINC001080875270	1357755052	/nfs/dbraw/zinc/75/50/52/1357755052.db2.gz	XLXHEWBQZDCRDG-ZIAGYGMSSA-N	0	3	328.437	3.082	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc(C)ccc2OC)C12CCC2	ZINC001078676628	1357050702	/nfs/dbraw/zinc/05/07/02/1357050702.db2.gz	ZOYCWMUOXSGFLR-DLBZAZTESA-N	0	3	348.874	3.387	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2c(C)cncc2C)C12CCC2	ZINC001078680279	1357052466	/nfs/dbraw/zinc/05/24/66/1357052466.db2.gz	NQWAAQQDWAPILX-CABCVRRESA-N	0	3	333.863	3.082	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc3ncccc3o2)C12CCC2	ZINC001078683880	1357053761	/nfs/dbraw/zinc/05/37/61/1357053761.db2.gz	XXABNACDDOOCPF-HOTGVXAUSA-N	0	3	345.830	3.211	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2c[nH]cc2C2CC2)C12CCC2	ZINC001078766330	1357073161	/nfs/dbraw/zinc/07/31/61/1357073161.db2.gz	CORHFLPPEVVNEF-JKSUJKDBSA-N	0	3	333.863	3.275	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2ccc(C)c(C)c2)C[C@H]1c1ccccc1	ZINC001081219669	1357850296	/nfs/dbraw/zinc/85/02/96/1357850296.db2.gz	LEQKYZJFIPBSOB-LEWJYISDSA-N	0	3	332.447	3.134	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)[C@]2(C)CC[C@H](C)C2(C)C)[C@H](OC)C1	ZINC001082202212	1357975500	/nfs/dbraw/zinc/97/55/00/1357975500.db2.gz	MDGFDGFSGLKNJW-XLSPSMHOSA-N	0	3	336.520	3.230	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)[C@H](C)c2ccc(CC)cc2)[C@H](OC)C1	ZINC001082243545	1357990798	/nfs/dbraw/zinc/99/07/98/1357990798.db2.gz	GCEZJXVZQPQIFN-NSISKUIASA-N	0	3	344.499	3.134	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H](C)[C@H](NCc2cc(F)ccc2OC)C1	ZINC001082722712	1358080924	/nfs/dbraw/zinc/08/09/24/1358080924.db2.gz	DNRLFZCUIMOJDW-WIBUTAKZSA-N	0	3	348.462	3.373	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@]23C[C@H]2CCCC3)C[C@H]1NCc1ccc(C#N)s1	ZINC001082727558	1358082456	/nfs/dbraw/zinc/08/24/56/1358082456.db2.gz	FCMRITRLOUNZOZ-BCXHYRKLSA-N	0	3	343.496	3.137	20	30		EGEDHN
Cc1ccccc1[C@H](C)N1CC[C@@H]2CN(C(=O)c3cc(C#N)c[nH]3)[C@@H]2C1	ZINC001084261304	1358176159	/nfs/dbraw/zinc/17/61/59/1358176159.db2.gz	CVLXCGPYYWOQMW-XAUMDUMWSA-N	0	3	348.450	3.102	20	30		EGEDHN
Cc1cccc([C@@H](C)N2CC[C@@H]3CN(C(=O)c4cc(C#N)c[nH]4)[C@@H]3C2)c1	ZINC001084261515	1358176722	/nfs/dbraw/zinc/17/67/22/1358176722.db2.gz	NDPRQHDWZPTBKS-XFQXTVEOSA-N	0	3	348.450	3.102	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CCN(CC3CC(F)(F)C3)C[C@H]21	ZINC001084574069	1358241883	/nfs/dbraw/zinc/24/18/83/1358241883.db2.gz	OYSAIEWAIOSCKF-HUUCEWRRSA-N	0	3	326.431	3.167	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3c(F)ccc(F)c3Cl)[C@@H]2C1	ZINC001084680709	1358277423	/nfs/dbraw/zinc/27/74/23/1358277423.db2.gz	ZFOCKVLRACIJSR-BXUZGUMPSA-N	0	3	340.801	3.341	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)c3ccc(Cl)c4occc43)[C@@H]2C1	ZINC001084770699	1358305726	/nfs/dbraw/zinc/30/57/26/1358305726.db2.gz	YFIGFUZDAGWPRT-CXAGYDPISA-N	0	3	342.826	3.256	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3oc(CCC)nc3C)[C@@H]2C1	ZINC001084777375	1358306713	/nfs/dbraw/zinc/30/67/13/1358306713.db2.gz	VMVCSUDRGSTDPM-HZPDHXFCSA-N	0	3	331.460	3.048	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)Cc3c[nH]c4cccc(C)c34)[C@@H]2C1	ZINC001084781187	1358307625	/nfs/dbraw/zinc/30/76/25/1358307625.db2.gz	NOWQGNQVSNCQEB-VQIMIIECSA-N	0	3	337.467	3.128	20	30		EGEDHN
C[C@]1(C(=O)N2CC[C@H]3CCN(Cc4cccc(C#N)c4)[C@H]3C2)C=CCC1	ZINC001085010030	1358364904	/nfs/dbraw/zinc/36/49/04/1358364904.db2.gz	JVYZTJKMJOPHKJ-URVUXULASA-N	0	3	349.478	3.337	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCCC[C@H]2NC(=O)C2=CCCC2)c(F)c1	ZINC001085168477	1358421868	/nfs/dbraw/zinc/42/18/68/1358421868.db2.gz	OZEGOYXDCMNMPH-RTBURBONSA-N	0	3	341.430	3.325	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1scnc1CC	ZINC001085218632	1358436076	/nfs/dbraw/zinc/43/60/76/1358436076.db2.gz	JIBLGNLJPYCZOE-CHWSQXEVSA-N	0	3	327.881	3.089	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)C1(C)CCC1	ZINC001085298910	1358456434	/nfs/dbraw/zinc/45/64/34/1358456434.db2.gz	TYNPVEZTDFFLIR-CHWSQXEVSA-N	0	3	329.282	3.102	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCC[C@H]2NCc2ncccc2C)C1	ZINC001085324822	1358467470	/nfs/dbraw/zinc/46/74/70/1358467470.db2.gz	NDNUFHAQPDPFGN-IAGOWNOFSA-N	0	3	327.472	3.263	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCC[C@H]2N[C@@H](C)c2cnc(C)cn2)C1	ZINC001085325305	1358468054	/nfs/dbraw/zinc/46/80/54/1358468054.db2.gz	HGOXCMBFGHXNSV-GVDBMIGSSA-N	0	3	342.487	3.219	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cccc(NC(C)=O)c1	ZINC001085420641	1358494894	/nfs/dbraw/zinc/49/48/94/1358494894.db2.gz	QHLNLKKROFGMNV-IAGOWNOFSA-N	0	3	349.862	3.028	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cnn(CC(C)C)c1CC	ZINC001085591817	1358618899	/nfs/dbraw/zinc/61/88/99/1358618899.db2.gz	TYWAZMFLTPEYRR-QGZVFWFLSA-N	0	3	346.519	3.214	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N(C)C[C@@H]1CCN1CCC1=CCCCC1	ZINC001085601543	1358626697	/nfs/dbraw/zinc/62/66/97/1358626697.db2.gz	ZREWPLCSHHYDJG-ZCNNSNEGSA-N	0	3	346.515	3.391	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc(C)c(NC(C)=O)c1	ZINC001085614031	1358635695	/nfs/dbraw/zinc/63/56/95/1358635695.db2.gz	DFSGQXBBONRJBP-SFHVURJKSA-N	0	3	343.471	3.066	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1ncoc1-c1ccccc1	ZINC001085630129	1358647241	/nfs/dbraw/zinc/64/72/41/1358647241.db2.gz	MKCKESOSQXPLIH-INIZCTEOSA-N	0	3	325.412	3.064	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@H]1CCCN1c1ccccc1	ZINC001085634551	1358650306	/nfs/dbraw/zinc/65/03/06/1358650306.db2.gz	SSEOCECKFUBWAG-VQTJNVASSA-N	0	3	341.499	3.154	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1ccccc1-c1ccncc1	ZINC001085670640	1358675491	/nfs/dbraw/zinc/67/54/91/1358675491.db2.gz	BHOOGROWZGMCOT-GOSISDBHSA-N	0	3	335.451	3.471	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)[C@@H]1CCCC[C@@H]1C(F)(F)F	ZINC001085671252	1358675962	/nfs/dbraw/zinc/67/59/62/1358675962.db2.gz	RXUQPMBJQSUSBK-KFWWJZLASA-N	0	3	332.410	3.464	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N(C)C[C@@H]1CCN1CCC(=C)C	ZINC001085678083	1358681598	/nfs/dbraw/zinc/68/15/98/1358681598.db2.gz	AVCUYDGKQMLXJU-KRWDZBQOSA-N	0	3	328.456	3.364	20	30		EGEDHN
CCC(CC)[C@@H](C)C(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001183818029	1387353398	/nfs/dbraw/zinc/35/33/98/1387353398.db2.gz	TYWRYLSXPTXNEM-RDTXWAMCSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cnoc1-c1ccccc1	ZINC001085901448	1358859581	/nfs/dbraw/zinc/85/95/81/1358859581.db2.gz	FRKJNCYNGZRLJO-QGZVFWFLSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cnn(CCC(C)C)c1C	ZINC001085915707	1358875060	/nfs/dbraw/zinc/87/50/60/1358875060.db2.gz	IVHDBDQNMSNNCJ-GOSISDBHSA-N	0	3	346.519	3.350	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C[C@@H]2CCN2[C@H](CC)c2ccccc2)nc1	ZINC001085934078	1358888923	/nfs/dbraw/zinc/88/89/23/1358888923.db2.gz	RCJAKRSSYUEIAJ-PZJWPPBQSA-N	0	3	347.462	3.361	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc3ccncc3s2)C1	ZINC001086107071	1358999239	/nfs/dbraw/zinc/99/92/39/1358999239.db2.gz	JUSYVMXPACKHQR-BJHJDKERSA-N	0	3	335.860	3.147	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cccc(F)c2Cl)C1	ZINC001086210656	1359028085	/nfs/dbraw/zinc/02/80/85/1359028085.db2.gz	PHZLDRXJFKOHRT-PHIMTYICSA-N	0	3	331.218	3.330	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)NC[C@H]2C[C@@H](NCc3ccc(C#N)cc3F)C2)C1	ZINC001086216244	1359030089	/nfs/dbraw/zinc/03/00/89/1359030089.db2.gz	NKJYMTZVCXFYRD-OWIUFQIYSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cnc3c(F)cccc3c2)C1	ZINC001086429380	1359095377	/nfs/dbraw/zinc/09/53/77/1359095377.db2.gz	ORKNBSYQPHCARC-NNUKFRKNSA-N	0	3	347.821	3.224	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc3cc(F)ccc3o2)C1	ZINC001086493556	1359118439	/nfs/dbraw/zinc/11/84/39/1359118439.db2.gz	MTSIRGFOILKFNE-YEORSEQZSA-N	0	3	336.794	3.422	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)NC[C@H]2C[C@H](NCc3ccc(C#N)cc3F)C2)C1	ZINC001086496108	1359119806	/nfs/dbraw/zinc/11/98/06/1359119806.db2.gz	NKJYMTZVCXFYRD-MBGYTDRXSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2scnc2C(C)C)C1	ZINC001086499572	1359121114	/nfs/dbraw/zinc/12/11/14/1359121114.db2.gz	NOXQFCMXVCTQNV-HAQNSBGRSA-N	0	3	327.881	3.117	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cnn([C@H](C)CC)c2C)C1	ZINC001086530210	1359133823	/nfs/dbraw/zinc/13/38/23/1359133823.db2.gz	MIZUSOMJFLTBEJ-BPLDGKMQSA-N	0	3	338.883	3.013	20	30		EGEDHN
C=CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2coc(CC)n2)C1	ZINC001086584939	1359156631	/nfs/dbraw/zinc/15/66/31/1359156631.db2.gz	WNJVHMXZWHQQSS-DLBZAZTESA-N	0	3	339.439	3.011	20	30		EGEDHN
C=C(C)CN1C[C@@H](c2ccccc2)[C@H](NC(=O)[C@H]2C[C@@H]2C(F)F)C1	ZINC001086586803	1359156751	/nfs/dbraw/zinc/15/67/51/1359156751.db2.gz	NAXALCBPIMFGLC-LUKYLMHMSA-N	0	3	334.410	3.048	20	30		EGEDHN
C=C(Br)CN[C@@H]1CC[C@H](CNC(=O)c2ccsc2)C1	ZINC001086637535	1359173496	/nfs/dbraw/zinc/17/34/96/1359173496.db2.gz	MKDUCTVCNAPEHC-WCQYABFASA-N	0	3	343.290	3.145	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2oc(C(C)C)nc2C)C1	ZINC001086824069	1359208668	/nfs/dbraw/zinc/20/86/68/1359208668.db2.gz	MYTZWQJDNLBTNB-UONOGXRCSA-N	0	3	339.867	3.347	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccc(N(C)CC)cc2)C1	ZINC001086887848	1359221595	/nfs/dbraw/zinc/22/15/95/1359221595.db2.gz	SMAUVEXUGLKFMC-DOTOQJQBSA-N	0	3	349.906	3.383	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)C[C@H]3CC=CCC3)C2)CC1	ZINC001086937530	1359260000	/nfs/dbraw/zinc/26/00/00/1359260000.db2.gz	RKBKPXIFBHFLBB-OALUTQOASA-N	0	3	328.500	3.459	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc[nH]c3C(C)C)C2)CC1	ZINC001086938025	1359260503	/nfs/dbraw/zinc/26/05/03/1359260503.db2.gz	GFNIIUFTEQYOMZ-QGZVFWFLSA-N	0	3	341.499	3.478	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3coc(C(F)F)c3)C2)CC1	ZINC001086939502	1359262005	/nfs/dbraw/zinc/26/20/05/1359262005.db2.gz	RZTYWOARORHIQF-ZDUSSCGKSA-N	0	3	336.382	3.167	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc4cnccc4c3)C2)CC1	ZINC001086952074	1359272095	/nfs/dbraw/zinc/27/20/95/1359272095.db2.gz	ZLXQJANJTNBTLA-KRWDZBQOSA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)CCc3ccc(C)o3)C2)CC1	ZINC001086957377	1359278170	/nfs/dbraw/zinc/27/81/70/1359278170.db2.gz	LGXNPQZRZZGAME-KRWDZBQOSA-N	0	3	342.483	3.247	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H]3CC4CCC3CC4)C2)CC1	ZINC001086958510	1359279182	/nfs/dbraw/zinc/27/91/82/1359279182.db2.gz	SXSCZABIBVLYPZ-MKCYZYCBSA-N	0	3	328.500	3.149	20	30		EGEDHN
C/C=C(/C)C(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccc(C#N)s1	ZINC001087145282	1359305707	/nfs/dbraw/zinc/30/57/07/1359305707.db2.gz	OTJYWJXTHRTOCJ-WKJJTJTDSA-N	0	3	331.485	3.303	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1c(C)coc1C	ZINC001087286263	1359365079	/nfs/dbraw/zinc/36/50/79/1359365079.db2.gz	OPDKCBKBTPQYFN-BPQIPLTHSA-N	0	3	328.456	3.139	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3c(C)coc3C)C(C)(C)[C@H]21	ZINC001087286266	1359365111	/nfs/dbraw/zinc/36/51/11/1359365111.db2.gz	OPDKCBKBTPQYFN-NXHRZFHOSA-N	0	3	328.456	3.139	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3sccc3Cl)C(C)(C)[C@H]21	ZINC001087287618	1359365940	/nfs/dbraw/zinc/36/59/40/1359365940.db2.gz	KCHREIWIZJNJEP-UGFHNGPFSA-N	0	3	336.888	3.254	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc(F)c(F)c3)C(C)(C)[C@H]21	ZINC001087290132	1359369281	/nfs/dbraw/zinc/36/92/81/1359369281.db2.gz	XSNMBHBNTXLMEP-JLSDUUJJSA-N	0	3	346.421	3.207	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(CC)o3)C(C)(C)[C@H]21	ZINC001087291923	1359372410	/nfs/dbraw/zinc/37/24/10/1359372410.db2.gz	CJAVDOABBFGDGR-NXHRZFHOSA-N	0	3	328.456	3.084	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)Cc1cccc(CC)c1	ZINC001087293189	1359373412	/nfs/dbraw/zinc/37/34/12/1359373412.db2.gz	ZTNKHKWWHHPLPL-HLAWJBBLSA-N	0	3	338.495	3.030	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)Cc3ccc(C)cc3)C(C)(C)[C@H]21	ZINC001087294760	1359374823	/nfs/dbraw/zinc/37/48/23/1359374823.db2.gz	XXBKNCNMKDCAHE-GIVPXCGWSA-N	0	3	338.495	3.166	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(C(C)C)on3)C(C)(C)[C@H]21	ZINC001087297450	1359379792	/nfs/dbraw/zinc/37/97/92/1359379792.db2.gz	OYECDQAXQCBIKK-OLMNPRSZSA-N	0	3	343.471	3.040	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc4[nH]ccc4c3)C(C)(C)[C@H]21	ZINC001087300091	1359382291	/nfs/dbraw/zinc/38/22/91/1359382291.db2.gz	GSJYRNRSRDJBRI-NEWSRXKRSA-N	0	3	335.451	3.020	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc(C(F)F)cc3)C(C)(C)[C@H]21	ZINC001087308694	1359395308	/nfs/dbraw/zinc/39/53/08/1359395308.db2.gz	UTFFKYCTJPRUOW-IKGGRYGDSA-N	0	3	346.421	3.476	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3oc(CC)cc3C)C(C)(C)[C@@H]21	ZINC001087313426	1359402062	/nfs/dbraw/zinc/40/20/62/1359402062.db2.gz	UYRWALIYJHFMRH-BHIYHBOVSA-N	0	3	342.483	3.393	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc4c(s3)CCC4)C(C)(C)[C@H]21	ZINC001087316862	1359407192	/nfs/dbraw/zinc/40/71/92/1359407192.db2.gz	YNXTXKRDENPNIF-JLSDUUJJSA-N	0	3	342.508	3.089	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3nc(C)c(C)s3)C(C)(C)[C@H]21	ZINC001087317601	1359409015	/nfs/dbraw/zinc/40/90/15/1359409015.db2.gz	KMGFIFBRCZUIMX-PMPSAXMXSA-N	0	3	345.512	3.002	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccn3C(C)C)C(C)(C)[C@@H]21	ZINC001087319658	1359412560	/nfs/dbraw/zinc/41/25/60/1359412560.db2.gz	ROGXCSPYUBLWRI-BHIYHBOVSA-N	0	3	341.499	3.311	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3c(C)nsc3C)C(C)(C)[C@H]21	ZINC001087319580	1359412595	/nfs/dbraw/zinc/41/25/95/1359412595.db2.gz	QBKCBMODBCZDFC-OIISXLGYSA-N	0	3	345.512	3.002	20	30		EGEDHN
C=CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)[C@@H]2CCCCO2)C1	ZINC001087425515	1359461181	/nfs/dbraw/zinc/46/11/81/1359461181.db2.gz	ZSCMEFCKGNJHAS-AQNXPRMDSA-N	0	3	342.483	3.106	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2nsc3ccc(C)cc32)[C@H]1CC	ZINC001087686346	1359589757	/nfs/dbraw/zinc/58/97/57/1359589757.db2.gz	YXIBJXWNJQTPAG-LSDHHAIUSA-N	0	3	329.469	3.373	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2scnc2C(C)(C)C)[C@H]1CC	ZINC001087754589	1359628980	/nfs/dbraw/zinc/62/89/80/1359628980.db2.gz	PBNNTHVYPDVRST-UONOGXRCSA-N	0	3	333.501	3.047	20	30		EGEDHN
C/C(=C\C(=O)N1C[C@H]2CCN(Cc3cccc(C#N)c3)C[C@H]2C1)C1CC1	ZINC001087898563	1359702037	/nfs/dbraw/zinc/70/20/37/1359702037.db2.gz	SUKKRXVRMLQGSM-DNZFNRSKSA-N	0	3	349.478	3.195	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)C[C@@H](C)C3CCCCC3)C[C@@H]2C1	ZINC001088137772	1359770069	/nfs/dbraw/zinc/77/00/69/1359770069.db2.gz	CPKQVXLRHIWCNZ-RLLQIKCJSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)CC(C)(C)c3ccc(C)cc3)C[C@@H]2C1	ZINC001088194337	1359790694	/nfs/dbraw/zinc/79/06/94/1359790694.db2.gz	ZFKVNASXPVXTMN-MOPGFXCFSA-N	0	3	338.495	3.076	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3cc(CC)c(CCC)s3)C[C@@H]2C1	ZINC001088196381	1359791183	/nfs/dbraw/zinc/79/11/83/1359791183.db2.gz	FDMSNVRRDBBQMK-SJORKVTESA-N	0	3	344.524	3.290	20	30		EGEDHN
C=CCN1CC[C@H](OCC2CCN(C(=O)[C@H]3CC[C@H](C)CC3)CC2)C1	ZINC001088240193	1359811866	/nfs/dbraw/zinc/81/18/66/1359811866.db2.gz	RHBZCQLXUVMLDC-IHPCNDPISA-N	0	3	348.531	3.328	20	30		EGEDHN
C=CCN1CC[C@@H](OCC2CCN(C(=O)C3CCC=CCC3)CC2)C1	ZINC001088241218	1359812575	/nfs/dbraw/zinc/81/25/75/1359812575.db2.gz	SUBMUUFVFINESH-HXUWFJFHSA-N	0	3	346.515	3.248	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCCC[C@H](NCc2cncc(F)c2)C1	ZINC001088360471	1359844612	/nfs/dbraw/zinc/84/46/12/1359844612.db2.gz	ZNUCFDCNJKJAAD-KRWDZBQOSA-N	0	3	333.451	3.294	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2ccncc2Cl)C1	ZINC001088387888	1359866739	/nfs/dbraw/zinc/86/67/39/1359866739.db2.gz	HOTYGXVHSZKAJR-ZDUSSCGKSA-N	0	3	342.270	3.462	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)[C@H]2CCO[C@H]2C(=C)C)C1	ZINC001088397937	1359873345	/nfs/dbraw/zinc/87/33/45/1359873345.db2.gz	VORHZQVLOABDLH-IKGGRYGDSA-N	0	3	340.895	3.081	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)CC[C@H]2CCCOC2)C1	ZINC001088407016	1359879200	/nfs/dbraw/zinc/87/92/00/1359879200.db2.gz	KCWXRBLUZWCUOH-SJORKVTESA-N	0	3	342.911	3.307	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2ccccc2OC)C1	ZINC001088416757	1359886534	/nfs/dbraw/zinc/88/65/34/1359886534.db2.gz	XEDHUNPSVCEQPP-HNNXBMFYSA-N	0	3	336.863	3.422	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](CNCc2nc(C)c(C)s2)[C@H](C)C1	ZINC001184302772	1387424601	/nfs/dbraw/zinc/42/46/01/1387424601.db2.gz	WIYNKFKJKYDZIN-RHSMWYFYSA-N	0	3	347.528	3.138	20	30		EGEDHN
C=C(C)CCN1CC[C@H](NC(=O)c2cnc([C@H](C)OC)s2)[C@H]1C	ZINC001088569468	1359976235	/nfs/dbraw/zinc/97/62/35/1359976235.db2.gz	VOXVKVQSLOVCQB-RDBSUJKOSA-N	0	3	337.489	3.009	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2ccccc2CC(C)(C)C)[C@H]1C	ZINC001088649380	1360001382	/nfs/dbraw/zinc/00/13/82/1360001382.db2.gz	ZASMKRWYBIVSDT-APWZRJJASA-N	0	3	326.484	3.491	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)Cn2cc(C)c3ccccc32)[C@H]1C	ZINC001088915231	1360102015	/nfs/dbraw/zinc/10/20/15/1360102015.db2.gz	QHIKBTVCPWNUBK-AEFFLSMTSA-N	0	3	325.456	3.105	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCCC[C@H]1CN(C)Cc1ccc(C#N)cc1	ZINC001089153552	1360208377	/nfs/dbraw/zinc/20/83/77/1360208377.db2.gz	VKPIUXOEBIJUFH-YDIVSAOHSA-N	0	3	325.456	3.337	20	30		EGEDHN
C[C@@H]1CN(C(=O)C#CC(C)(C)C)CC[C@@H]1CNC/C(Cl)=C\Cl	ZINC001184369499	1387441623	/nfs/dbraw/zinc/44/16/23/1387441623.db2.gz	FZFUYLLLCQHPLM-OMZQKGCKSA-N	0	3	345.314	3.429	20	30		EGEDHN
N#C[C@H]1CCCN(C(=O)[C@@H]2CCCN(Cc3ccc(Cl)cc3)C2)C1	ZINC001184401215	1387448819	/nfs/dbraw/zinc/44/88/19/1387448819.db2.gz	HRNWQVMKYDLLKP-IAGOWNOFSA-N	0	3	345.874	3.314	20	30		EGEDHN
N#C[C@H]1CCCN(C(=O)[C@H]2CCCN(Cc3ccc(Cl)cc3)C2)C1	ZINC001184401217	1387449300	/nfs/dbraw/zinc/44/93/00/1387449300.db2.gz	HRNWQVMKYDLLKP-SJORKVTESA-N	0	3	345.874	3.314	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C2(c3ccccc3)CCC2)CC(C)(C)C1	ZINC001089434997	1360426303	/nfs/dbraw/zinc/42/63/03/1360426303.db2.gz	AYZVYHZWTDIWGB-LJQANCHMSA-N	0	3	338.495	3.348	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C[C@@H]2CCCC2(F)F)CC(C)(C)C1	ZINC001089478230	1360460549	/nfs/dbraw/zinc/46/05/49/1360460549.db2.gz	SDRWJAQUMISAEI-GJZGRUSLSA-N	0	3	326.431	3.052	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(C(C)C)nc2C)CC(C)(C)C1	ZINC001089490977	1360469924	/nfs/dbraw/zinc/46/99/24/1360469924.db2.gz	HBCGOUYFLSSYQO-KRWDZBQOSA-N	0	3	341.499	3.367	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C2[C@H]3CCCCCC[C@H]23)CC(C)(C)C1	ZINC001089502043	1360475463	/nfs/dbraw/zinc/47/54/63/1360475463.db2.gz	LDVABRCIJGSXHV-BZSNNMDCSA-N	0	3	330.516	3.443	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cnc3ccccc3c2)CC(C)(C)C1	ZINC001089504316	1360477250	/nfs/dbraw/zinc/47/72/50/1360477250.db2.gz	BFEBDLMRPXWKPZ-GOSISDBHSA-N	0	3	335.451	3.088	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(C)c(OCC)c2)CC(C)(C)C1	ZINC001089504015	1360477353	/nfs/dbraw/zinc/47/73/53/1360477353.db2.gz	XEPSIOCRQPUHJV-SFHVURJKSA-N	0	3	342.483	3.247	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2ccc(CC)cc2)CC(C)(C)C1	ZINC001089505012	1360477830	/nfs/dbraw/zinc/47/78/30/1360477830.db2.gz	FLDJKUHEPKQRJN-LJQANCHMSA-N	0	3	326.484	3.032	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc(C(CC)CC)no2)CC(C)(C)C1	ZINC001089511300	1360482847	/nfs/dbraw/zinc/48/28/47/1360482847.db2.gz	PVSVVOJPVSZYBG-MRXNPFEDSA-N	0	3	345.487	3.432	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@@]2(C)C[C@@H]2c2ccccc2)CC(C)(C)C1	ZINC001089517688	1360487505	/nfs/dbraw/zinc/48/75/05/1360487505.db2.gz	SNFQOSTZTPVVTL-KNKQGSTJSA-N	0	3	338.495	3.420	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2nc(C3CC3)oc2C)CC(C)(C)C1	ZINC001089531787	1360492899	/nfs/dbraw/zinc/49/28/99/1360492899.db2.gz	QBMWRRAHGOCHDF-MRXNPFEDSA-N	0	3	343.471	3.104	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(C/C=C/Cl)CC(C)(C)C2)cn1	ZINC001089544612	1360499765	/nfs/dbraw/zinc/49/97/65/1360499765.db2.gz	WETIXQMRUFDOCD-MPNRVQBSSA-N	0	3	345.874	3.036	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2ccccc2Cl)CC(C)(C)C1	ZINC001089555976	1360506387	/nfs/dbraw/zinc/50/63/87/1360506387.db2.gz	OMCHKCGOHZGYAD-MRXNPFEDSA-N	0	3	332.875	3.123	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2csc3c2CCCC3)CC(C)(C)C1	ZINC001089557231	1360506521	/nfs/dbraw/zinc/50/65/21/1360506521.db2.gz	YMCUZBVBEMYUKG-OAHLLOKOSA-N	0	3	344.524	3.481	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2ccccc2Cl)CC(C)(C)C1	ZINC001089555973	1360506728	/nfs/dbraw/zinc/50/67/28/1360506728.db2.gz	OMCHKCGOHZGYAD-INIZCTEOSA-N	0	3	332.875	3.123	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccnn1[C@H](C)CC	ZINC001089647100	1360559965	/nfs/dbraw/zinc/55/99/65/1360559965.db2.gz	SCSRYANLTDKBOM-SJORKVTESA-N	0	3	344.503	3.098	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1c(C)noc1C(C)C	ZINC001089654163	1360566599	/nfs/dbraw/zinc/56/65/99/1360566599.db2.gz	VEGUPUBOLFKYPB-INIZCTEOSA-N	0	3	345.487	3.350	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(C)nnc1CC	ZINC001089661643	1360572548	/nfs/dbraw/zinc/57/25/48/1360572548.db2.gz	XOCVLKZDRYEHMC-INIZCTEOSA-N	0	3	344.503	3.144	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ccncc1CC	ZINC001089661216	1360572764	/nfs/dbraw/zinc/57/27/64/1360572764.db2.gz	UMASNRWCDIIJRB-KRWDZBQOSA-N	0	3	329.488	3.441	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cccnc1C1CC1	ZINC001089665093	1360574977	/nfs/dbraw/zinc/57/49/77/1360574977.db2.gz	TYHPBTJISMPKRY-KRWDZBQOSA-N	0	3	339.483	3.203	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc2cnccc2o1	ZINC001089664429	1360575109	/nfs/dbraw/zinc/57/51/09/1360575109.db2.gz	KOGHZPAUQQMTRG-INIZCTEOSA-N	0	3	339.439	3.072	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ncc2ccccn21	ZINC001089666802	1360576859	/nfs/dbraw/zinc/57/68/59/1360576859.db2.gz	XCYNUCOUDQICSC-INIZCTEOSA-N	0	3	340.471	3.131	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc2[nH]nc(C)c2c1	ZINC001089669218	1360579609	/nfs/dbraw/zinc/57/96/09/1360579609.db2.gz	ISLRZIQZPOPGRC-MRXNPFEDSA-N	0	3	340.471	3.278	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccn2ccccc12	ZINC001089670166	1360580141	/nfs/dbraw/zinc/58/01/41/1360580141.db2.gz	ZWOPUOOQMOOUAV-MRXNPFEDSA-N	0	3	325.456	3.346	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(C)nc(OC)c1	ZINC001089688624	1360594996	/nfs/dbraw/zinc/59/49/96/1360594996.db2.gz	XEAIYRYDMASLKI-KRWDZBQOSA-N	0	3	345.487	3.195	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@@H]2CCC(C)(C)CN2CC=C(C)C)c1	ZINC001089692719	1360598194	/nfs/dbraw/zinc/59/81/94/1360598194.db2.gz	BFIQOUABOLVDKY-IBGZPJMESA-N	0	3	339.483	3.250	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(C(C)C)cn1	ZINC001089692873	1360598278	/nfs/dbraw/zinc/59/82/78/1360598278.db2.gz	CZWPYFDIOWFUTF-GOSISDBHSA-N	0	3	341.499	3.449	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cnc2ccccc2c1	ZINC001089706603	1360609098	/nfs/dbraw/zinc/60/90/98/1360609098.db2.gz	UZKAFNOMHKPISF-IBGZPJMESA-N	0	3	349.478	3.479	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc2c(c1)CCN2C	ZINC001089722028	1360625269	/nfs/dbraw/zinc/62/52/69/1360625269.db2.gz	PENIAOXJANSKDF-SFHVURJKSA-N	0	3	341.499	3.085	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(C(F)F)o1	ZINC001089725242	1360628419	/nfs/dbraw/zinc/62/84/19/1360628419.db2.gz	CPDDDUNPGLOTCW-ZDUSSCGKSA-N	0	3	338.398	3.461	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(F)cc(F)c1	ZINC001089728901	1360631551	/nfs/dbraw/zinc/63/15/51/1360631551.db2.gz	FPRZMNVZYASQFZ-QGZVFWFLSA-N	0	3	334.410	3.209	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1cccs1	ZINC001089762028	1360653834	/nfs/dbraw/zinc/65/38/34/1360653834.db2.gz	CGRGONYHUCSMBB-XGUBFFRZSA-N	0	3	336.888	3.283	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C(C)(C)C1CC1	ZINC001089849469	1360696487	/nfs/dbraw/zinc/69/64/87/1360696487.db2.gz	FJBQGDANJCVKTM-ORQFMDKSSA-N	0	3	336.907	3.344	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C(C)(C)C2CCC2)CC2(CCOCC2)C1	ZINC001089950001	1360760072	/nfs/dbraw/zinc/76/00/72/1360760072.db2.gz	MXZDSWKRJQXTRX-SFHVURJKSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](CNCc2ncc(C)s2)[C@H](C)C1	ZINC001184497994	1387473106	/nfs/dbraw/zinc/47/31/06/1387473106.db2.gz	OHOAQVKVEJVILW-GDBMZVCRSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(C(C)C)nc2C)C1	ZINC001091234312	1361016446	/nfs/dbraw/zinc/01/64/46/1361016446.db2.gz	DOJIDNHHHYNZCI-UHFFFAOYSA-N	0	3	335.879	3.364	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc3ncsc3c2)C1	ZINC001091352853	1361056960	/nfs/dbraw/zinc/05/69/60/1361056960.db2.gz	HTVVYDXZMKVCMU-UHFFFAOYSA-N	0	3	335.860	3.147	20	30		EGEDHN
C=CCOc1ccc(-c2nc([C@H]3CN4CCC3CC4)no2)cc1OC	ZINC001323913535	1387494990	/nfs/dbraw/zinc/49/49/90/1387494990.db2.gz	ANUZQSHONCEYSA-HNNXBMFYSA-N	0	3	341.411	3.119	20	30		EGEDHN
Cc1cccc(Cl)c1CN1C[C@@H]2CN(C(=O)[C@@H](C)C#N)C[C@]2(C)C1	ZINC001091544565	1361140854	/nfs/dbraw/zinc/14/08/54/1361140854.db2.gz	BLKGANSOIBVDTK-KHYOSLBOSA-N	0	3	345.874	3.088	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C3(C)CCC(F)(F)CC3)C[C@]2(C)C1	ZINC001091795104	1361221954	/nfs/dbraw/zinc/22/19/54/1361221954.db2.gz	JVCRJZUNVIFUCQ-QAPCUYQASA-N	0	3	338.442	3.006	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CN(Cc3c(C)noc3C)C[C@H]2C)CC1	ZINC001092940710	1361491736	/nfs/dbraw/zinc/49/17/36/1361491736.db2.gz	YGLMZNNTJBAZPI-RDTXWAMCSA-N	0	3	345.487	3.222	20	30		EGEDHN
C#CCN1C[C@@H](CNC(=O)c2cc3cccc(Cl)c3o2)[C@H](C)C1	ZINC001093263110	1361555898	/nfs/dbraw/zinc/55/58/98/1361555898.db2.gz	LYISEPDECRVEDE-TZMCWYRMSA-N	0	3	330.815	3.017	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C2CCCCC2)CC1	ZINC001093352846	1361566579	/nfs/dbraw/zinc/56/65/79/1361566579.db2.gz	MYMYQOGYFRQSBX-LJQANCHMSA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)/C=C(/C)C2CC2)CC1	ZINC001093359850	1361572114	/nfs/dbraw/zinc/57/21/14/1361572114.db2.gz	VOKXYEKWXBJTLP-HZMYXVCSSA-N	0	3	326.484	3.069	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@@](C)(C=C)CC)CC1	ZINC001093377914	1361588470	/nfs/dbraw/zinc/58/84/70/1361588470.db2.gz	YRPWRSWROLANBH-ICSRJNTNSA-N	0	3	328.500	3.315	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@@H](C)C(C)(F)F)CC1	ZINC001093380077	1361590407	/nfs/dbraw/zinc/59/04/07/1361590407.db2.gz	QAOITFDBNSOAKE-ZBFHGGJFSA-N	0	3	338.442	3.004	20	30		EGEDHN
N#Cc1ccc(NC(=O)N2CC[C@H]3CN(Cc4ccccc4)C[C@H]32)cc1	ZINC001184742202	1387524606	/nfs/dbraw/zinc/52/46/06/1387524606.db2.gz	FRIVCXYDLWTNOU-AZUAARDMSA-N	0	3	346.434	3.296	20	30		EGEDHN
N#Cc1ccc(NC(=O)N2CC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)cc1	ZINC001184742205	1387524712	/nfs/dbraw/zinc/52/47/12/1387524712.db2.gz	FRIVCXYDLWTNOU-QUCCMNQESA-N	0	3	346.434	3.296	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001094015325	1361724441	/nfs/dbraw/zinc/72/44/41/1361724441.db2.gz	DATRJSCOWQQWKU-OZOXKJRCSA-N	0	3	339.483	3.345	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H](CNCc2ncc(C)s2)[C@H](C)C1	ZINC001094018575	1361725319	/nfs/dbraw/zinc/72/53/19/1361725319.db2.gz	UZABGOWGZOLTMK-DDUZABMNSA-N	0	3	335.517	3.238	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cccc4ccc(C)nc43)CCC[C@@H]12	ZINC001094444789	1361803258	/nfs/dbraw/zinc/80/32/58/1361803258.db2.gz	IJPIPJXSSYNVME-DENIHFKCSA-N	0	3	347.462	3.151	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1C[C@H]2C[C@@H](C1)N(C(=O)CC1CCC1)C2	ZINC001094887711	1361934199	/nfs/dbraw/zinc/93/41/99/1361934199.db2.gz	JVYRUXSLHBRVLD-DBVUQKKJSA-N	0	3	337.467	3.218	20	30		EGEDHN
CN(CCC(F)(F)F)CC(=O)C(C#N)c1nc2ccccc2s1	ZINC001324184013	1387552696	/nfs/dbraw/zinc/55/26/96/1387552696.db2.gz	LLMNIXIPUXJDNO-JTQLQIEISA-N	0	3	341.358	3.357	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H]1COc3ccc(Cl)cc31)C2	ZINC001095760841	1362222879	/nfs/dbraw/zinc/22/28/79/1362222879.db2.gz	ALZROVVHGYGUGB-IWCQGFGOSA-N	0	3	346.858	3.114	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](CNCc2cc(C)no2)[C@@H](C)C1	ZINC001184935447	1387565180	/nfs/dbraw/zinc/56/51/80/1387565180.db2.gz	XAIKUHIPGDSCQC-FUHWJXTLSA-N	0	3	345.487	3.141	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](CNCc2nccs2)[C@@H](C)C1	ZINC001184943914	1387566932	/nfs/dbraw/zinc/56/69/32/1387566932.db2.gz	BIGIHYURFAMFCZ-IRXDYDNUSA-N	0	3	347.528	3.301	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@H]1CCCc3ccccc31)C2	ZINC001096405371	1362492490	/nfs/dbraw/zinc/49/24/90/1362492490.db2.gz	YAMZOHWUDDFGDB-QCFAMHMHSA-N	0	3	336.479	3.241	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(OCC(C)C)cc1)C2	ZINC001096485302	1362532171	/nfs/dbraw/zinc/53/21/71/1362532171.db2.gz	NDJZIRHNGFYSBX-HOJAQTOUSA-N	0	3	340.467	3.080	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CC1CC(F)(F)C1	ZINC001097225243	1362893109	/nfs/dbraw/zinc/89/31/09/1362893109.db2.gz	VWFWUECBRCMCNW-OAGGEKHMSA-N	0	3	349.425	3.055	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C1CCc3ccccc3CC1)C2	ZINC001097392960	1362968925	/nfs/dbraw/zinc/96/89/25/1362968925.db2.gz	BWBAWCDFYLWLIF-NJYVYQBISA-N	0	3	338.495	3.479	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(OC)c(C(C)C)c1)C2	ZINC001097451974	1362998086	/nfs/dbraw/zinc/99/80/86/1362998086.db2.gz	WGOKGZGRAOBVAQ-QRQLOZEOSA-N	0	3	340.467	3.177	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](CNCc2nc(C)cs2)[C@H](C)C1	ZINC001185061348	1387604263	/nfs/dbraw/zinc/60/42/63/1387604263.db2.gz	LSUZEELKKGTYGY-GDBMZVCRSA-N	0	3	335.517	3.382	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cn(CC)c3ccccc13)C2	ZINC001097484057	1363015521	/nfs/dbraw/zinc/01/55/21/1363015521.db2.gz	PRSVEKWXZGTZMI-ZTNFWEORSA-N	0	3	335.451	3.020	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc3c4c(cccc41)CC3)C2	ZINC001097496734	1363021342	/nfs/dbraw/zinc/02/13/42/1363021342.db2.gz	YNKCUHNENUGFET-UIFIKXQLSA-N	0	3	344.458	3.297	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](CNCc2oc(C)nc2C)[C@H](C)C1	ZINC001185062782	1387605215	/nfs/dbraw/zinc/60/52/15/1387605215.db2.gz	VLALCVACNTZNMD-RHSMWYFYSA-N	0	3	333.476	3.222	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cnccc1C(F)(F)F)C2	ZINC001097932729	1363170388	/nfs/dbraw/zinc/17/03/88/1363170388.db2.gz	LYIZGTQMUVUXCW-DFBGVHRSSA-N	0	3	339.361	3.012	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(C(F)F)cc1F)C2	ZINC001098103664	1363223006	/nfs/dbraw/zinc/22/30/06/1363223006.db2.gz	PTNIUGHENOJDPD-WQVCFCJDSA-N	0	3	336.357	3.122	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3[C@@H](C)c2ccccc2)cn1	ZINC001098244971	1363267735	/nfs/dbraw/zinc/26/77/35/1363267735.db2.gz	XOPXWWNELOMEBR-NOOVBMIQSA-N	0	3	345.446	3.159	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](C)c1cccc(Cl)c1)C2	ZINC001098443200	1363326683	/nfs/dbraw/zinc/32/66/83/1363326683.db2.gz	FSAYTKINORNDON-LIRZEXBASA-N	0	3	330.859	3.188	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@@H]1CC=CCC1)C[C@@H](C)O2	ZINC001098623771	1363403979	/nfs/dbraw/zinc/40/39/79/1363403979.db2.gz	QJXORSXYZWIEJC-QZTJIDSGSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](n2cc(CNCCCCCC)nn2)C1	ZINC001098710706	1363444832	/nfs/dbraw/zinc/44/48/32/1363444832.db2.gz	JXYIBLBYDINJKU-SFHVURJKSA-N	0	3	347.507	3.078	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CCC[C@]3(NC(=O)[C@@H]3CC=CCC3)C2)c1	ZINC001098725657	1363450739	/nfs/dbraw/zinc/45/07/39/1363450739.db2.gz	JQDAKIHKJKZBNG-URVUXULASA-N	0	3	349.478	3.385	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2ccsc2COC)C1	ZINC001098902600	1363512890	/nfs/dbraw/zinc/51/28/90/1363512890.db2.gz	IEAFCZFMXFLGPW-KSSFIOAISA-N	0	3	334.485	3.055	20	30		EGEDHN
C#CCN1C[C@@H]2CCC[C@]2(NC(=O)CC2CC(c3ccccc3)C2)C1	ZINC001098911916	1363517606	/nfs/dbraw/zinc/51/76/06/1363517606.db2.gz	YJKOQAUIWICKEZ-XHXISMBCSA-N	0	3	336.479	3.174	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3CCC[C@]3(NC(=O)[C@@H]3CC34CCC4)C2)cc1	ZINC001099055773	1363598096	/nfs/dbraw/zinc/59/80/96/1363598096.db2.gz	RLGIODYNINVSPD-IPJJNNNSSA-N	0	3	349.478	3.219	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(C)c(OCC)c2)C1	ZINC001099061392	1363602121	/nfs/dbraw/zinc/60/21/21/1363602121.db2.gz	ADYSBRPOZGDVHN-RXVVDRJESA-N	0	3	340.467	3.001	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)C(C)(C)[C@H]1CCCCO1	ZINC001099080497	1363612343	/nfs/dbraw/zinc/61/23/43/1363612343.db2.gz	QPCSKLLSZDDZCG-ZWKOTPCHSA-N	0	3	348.531	3.212	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H](C)c2ccc(CC)cc2)C1	ZINC001099081396	1363612936	/nfs/dbraw/zinc/61/29/36/1363612936.db2.gz	RFQOKMILECZSJN-XJABCFGWSA-N	0	3	338.495	3.347	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)c2[nH]ccc2-c2ccccc2)C1	ZINC001099115975	1363632306	/nfs/dbraw/zinc/63/23/06/1363632306.db2.gz	GCCSDCLQKFKEDU-AVRDEDQJSA-N	0	3	347.462	3.289	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)C12CCC(CC1)C2	ZINC001099122059	1363635685	/nfs/dbraw/zinc/63/56/85/1363635685.db2.gz	TXXNKIIKOPYBPF-WBTXTPOCSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)C1(C)CCCC1	ZINC001099158636	1363662819	/nfs/dbraw/zinc/66/28/19/1363662819.db2.gz	JLTJLZBQPUZQFI-KRWDZBQOSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(C)n(C(C)(C)C)n2)C1	ZINC001099165782	1363665897	/nfs/dbraw/zinc/66/58/97/1363665897.db2.gz	RRBIDSVDISUOIT-JXFKEZNVSA-N	0	3	344.503	3.107	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)C1(C(C)C)CC1	ZINC001099230075	1363703259	/nfs/dbraw/zinc/70/32/59/1363703259.db2.gz	QJYCSCYWAYLGHC-QGZVFWFLSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H](C)c1ccco1	ZINC001099230554	1363703644	/nfs/dbraw/zinc/70/36/44/1363703644.db2.gz	UOEBOBYHLACFAN-DLBZAZTESA-N	0	3	348.487	3.193	20	30		EGEDHN
C=CC1(CC(=O)NC[C@H]2CCC(C)(C)CN2CCO)CCCCC1	ZINC001099269898	1363724712	/nfs/dbraw/zinc/72/47/12/1363724712.db2.gz	GMEKEERUBSMUJF-QGZVFWFLSA-N	0	3	336.520	3.112	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)C2(C3CC3)CCC2)C[C@H]1C(F)(F)F	ZINC001099284657	1363731654	/nfs/dbraw/zinc/73/16/54/1363731654.db2.gz	ASYZIUAKSWXPTG-ZIAGYGMSSA-N	0	3	330.394	3.122	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)C2CCC(=C)CC2)C[C@H]1C(F)(F)F	ZINC001099301721	1363738538	/nfs/dbraw/zinc/73/85/38/1363738538.db2.gz	OZOQXKMINJFPLJ-HUUCEWRRSA-N	0	3	330.394	3.288	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2csc(Cl)c2)C[C@H]1C(F)(F)F	ZINC001099317548	1363746292	/nfs/dbraw/zinc/74/62/92/1363746292.db2.gz	HAFYQKIAQUFATA-NXEZZACHSA-N	0	3	338.782	3.180	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)Cc1cccc(OC)c1	ZINC001099324489	1363750850	/nfs/dbraw/zinc/75/08/50/1363750850.db2.gz	MTXVGFYYYDDGTL-KRWDZBQOSA-N	0	3	330.472	3.031	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2cc(C)c(F)c(C)c2)C[C@H]1C(F)(F)F	ZINC001099342726	1363761224	/nfs/dbraw/zinc/76/12/24/1363761224.db2.gz	VLOJHTOSSODZRW-ZIAGYGMSSA-N	0	3	344.352	3.221	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)[C@H](C)n1c(C)ccc1C	ZINC001099353587	1363767846	/nfs/dbraw/zinc/76/78/46/1363767846.db2.gz	COHZQAFKWMAERQ-ROUUACIJSA-N	0	3	331.504	3.459	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@H](C)n1c(C)ccc1C	ZINC001099354277	1363767927	/nfs/dbraw/zinc/76/79/27/1363767927.db2.gz	QCRPVQQPBMTXAA-OALUTQOASA-N	0	3	343.515	3.296	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H](C)OCCC(C)C	ZINC001099360668	1363773464	/nfs/dbraw/zinc/77/34/64/1363773464.db2.gz	ZSWJDMKAHOUCIB-QZTJIDSGSA-N	0	3	336.520	3.068	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2cnc(C)o2)C1	ZINC001099473674	1363810652	/nfs/dbraw/zinc/81/06/52/1363810652.db2.gz	HMDBFOHEPJTSKO-JXFKEZNVSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCC2CCC2)CC2(CCOCC2)C1	ZINC001099574228	1363859293	/nfs/dbraw/zinc/85/92/93/1363859293.db2.gz	BDMMOXCGBNZGTN-SFHVURJKSA-N	0	3	334.504	3.130	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1CN(CC=C(C)C)CC2(CCOCC2)C1	ZINC001099578960	1363861108	/nfs/dbraw/zinc/86/11/08/1363861108.db2.gz	GOGHRXYULVISPV-LJQANCHMSA-N	0	3	346.515	3.134	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CN(CC=C(C)C)CC2(CCOCC2)C1	ZINC001099588479	1363870320	/nfs/dbraw/zinc/87/03/20/1363870320.db2.gz	BZYWOGAZQHTEJE-IBGZPJMESA-N	0	3	346.515	3.134	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)[C@@H](CC)CCC)CC2(CCOCC2)C1	ZINC001099594936	1363876880	/nfs/dbraw/zinc/87/68/80/1363876880.db2.gz	OGQLDDHHYLGVFN-ZWKOTPCHSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)[C@H](CC)CCC)CC2(CCOCC2)C1	ZINC001099594933	1363877173	/nfs/dbraw/zinc/87/71/73/1363877173.db2.gz	OGQLDDHHYLGVFN-MSOLQXFVSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)[C@@H](CC)CC(C)C)CC2(CCOCC2)C1	ZINC001099597042	1363879844	/nfs/dbraw/zinc/87/98/44/1363879844.db2.gz	RDXONZVAEJYZBA-ZWKOTPCHSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCCC(=O)NCC1CC(NCc2cc(OC)ccc2Cl)C1	ZINC001100176801	1364036336	/nfs/dbraw/zinc/03/63/36/1364036336.db2.gz	FVBPTINTRPLZEM-UHFFFAOYSA-N	0	3	336.863	3.299	20	30		EGEDHN
Cc1cscc1C(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100221472	1364048379	/nfs/dbraw/zinc/04/83/79/1364048379.db2.gz	GMYHVKNWOALZLF-UHFFFAOYSA-N	0	3	338.476	3.206	20	30		EGEDHN
CCC(=CC(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1)CC	ZINC001100242926	1364055229	/nfs/dbraw/zinc/05/52/29/1364055229.db2.gz	QIDFNTXOXGDZAX-UHFFFAOYSA-N	0	3	343.446	3.428	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)NCC1CC(NCC#Cc2cccc(Cl)c2)C1	ZINC001100245984	1364056743	/nfs/dbraw/zinc/05/67/43/1364056743.db2.gz	MIHWXLZRNMLAHZ-VMWRSERWSA-N	0	3	344.886	3.222	20	30		EGEDHN
CC1(CC(=O)NCC2CC(NCC#Cc3cccc(Cl)c3)C2)CC1	ZINC001100519275	1364144648	/nfs/dbraw/zinc/14/46/48/1364144648.db2.gz	YSESLOMFMAYQJM-UHFFFAOYSA-N	0	3	344.886	3.366	20	30		EGEDHN
CC1(CC(=O)NCC2CC(NCC#Cc3ccccc3Cl)C2)CC1	ZINC001100518917	1364144733	/nfs/dbraw/zinc/14/47/33/1364144733.db2.gz	HSYDIRISZKCNHU-UHFFFAOYSA-N	0	3	344.886	3.366	20	30		EGEDHN
C=CC(C)(C)C(=O)NCC1CC(NCc2cccc(C(C)C)n2)C1	ZINC001100564536	1364164196	/nfs/dbraw/zinc/16/41/96/1364164196.db2.gz	KAWQZGKNYBIDMG-UHFFFAOYSA-N	0	3	329.488	3.402	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C[C@@H]2CCOc3ccccc32)C1	ZINC001100564619	1364164387	/nfs/dbraw/zinc/16/43/87/1364164387.db2.gz	OPORZXMBDDDPMG-PCKAHOCUSA-N	0	3	348.874	3.180	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100587535	1364176213	/nfs/dbraw/zinc/17/62/13/1364176213.db2.gz	SRLIBVLGNRSGDX-VQSBYGRUSA-N	0	3	342.458	3.264	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100587534	1364176342	/nfs/dbraw/zinc/17/63/42/1364176342.db2.gz	SRLIBVLGNRSGDX-PPDQVPDSSA-N	0	3	342.458	3.264	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCC1CC(NCc2cc(F)ccc2OC)C1	ZINC001100594654	1364179916	/nfs/dbraw/zinc/17/99/16/1364179916.db2.gz	CPHICQJISCOCLX-SYJJWHGVSA-N	0	3	348.462	3.421	20	30		EGEDHN
O=C(NCC1CC(NCC#Cc2ccccc2)C1)c1cc[nH]c1C1CC1	ZINC001100612925	1364188363	/nfs/dbraw/zinc/18/83/63/1364188363.db2.gz	JEFAVLPVXOVKRP-UHFFFAOYSA-N	0	3	347.462	3.042	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)Cc2ccc(F)cc2Cl)C1	ZINC001100637076	1364199432	/nfs/dbraw/zinc/19/94/32/1364199432.db2.gz	ATXHOXDGDNPCHR-UHFFFAOYSA-N	0	3	345.245	3.259	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC1CC(NCc2ccncc2Cl)C1	ZINC001100645242	1364202723	/nfs/dbraw/zinc/20/27/23/1364202723.db2.gz	ZUBNGDMKGCMJAH-LEHRNKBSSA-N	0	3	335.879	3.322	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C2(CCOCC)CCCC2)C1	ZINC001100791479	1364263419	/nfs/dbraw/zinc/26/34/19/1364263419.db2.gz	KWFQTEJKSNEURL-UHFFFAOYSA-N	0	3	342.911	3.210	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@H](C)c2ccc(C)s2)C1	ZINC001100867539	1364301188	/nfs/dbraw/zinc/30/11/88/1364301188.db2.gz	ZBNOJWKOSKYSBP-IYXRBSQSSA-N	0	3	326.893	3.397	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C[C@H]2CCc3ccccc3C2)C1	ZINC001100913070	1364328730	/nfs/dbraw/zinc/32/87/30/1364328730.db2.gz	XZMHVOIIWQAFQD-LYGPFTKASA-N	0	3	346.902	3.419	20	30		EGEDHN
O=C(NCC1CC(NCC#Cc2ccccc2)C1)C1CCC=CCC1	ZINC001100992646	1364360546	/nfs/dbraw/zinc/36/05/46/1364360546.db2.gz	DSRPWFJSVFHIGT-UHFFFAOYSA-N	0	3	336.479	3.269	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@H]2CN([C@@H](C)c3cccc(F)c3)C[C@@]2(C)C1	ZINC001101230917	1364476301	/nfs/dbraw/zinc/47/63/01/1364476301.db2.gz	OZCUAYYVWWBWJM-CDXJDZJCSA-N	0	3	342.458	3.326	20	30		EGEDHN
COCC#CCN1C[C@@H]2CN(C(=O)CCCCC(C)(C)C)C[C@]2(C)C1	ZINC001101247247	1364484503	/nfs/dbraw/zinc/48/45/03/1364484503.db2.gz	AFZASKQRSGRJBN-NQIIRXRSSA-N	0	3	348.531	3.023	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@H]2CN(CCC(F)(F)F)C[C@@]2(C)C1	ZINC001101336750	1364515467	/nfs/dbraw/zinc/51/54/67/1364515467.db2.gz	OMOXJPWXFKVFNU-LZWOXQAQSA-N	0	3	332.410	3.321	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)C[C@@H](CC)c3ccc(C)cc3)C[C@]2(C)C1	ZINC001101363335	1364528320	/nfs/dbraw/zinc/52/83/20/1364528320.db2.gz	SPGSTYBVOBUENO-UZKOGDIHSA-N	0	3	338.495	3.292	20	30		EGEDHN
C=CCC[C@H](C)N1CC2(C1)C[C@@H](NC(=O)C(C)(C)CC)c1nccn12	ZINC001101642941	1364667504	/nfs/dbraw/zinc/66/75/04/1364667504.db2.gz	QFMNPJBCQKEQIZ-JKSUJKDBSA-N	0	3	344.503	3.246	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CNC(=O)C1(F)CCCC1	ZINC001102112683	1364864918	/nfs/dbraw/zinc/86/49/18/1364864918.db2.gz	BGMBEHFHWPFPIU-ZIAGYGMSSA-N	0	3	349.475	3.086	20	30		EGEDHN
C=C/C(C)=C/CC(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001102244393	1364959182	/nfs/dbraw/zinc/95/91/82/1364959182.db2.gz	GZDDATAZQCYRCM-LVKIJNIGSA-N	0	3	343.496	3.326	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@@H]1CN(Cc2c(C)onc2CC)C[C@H]1C	ZINC001102263065	1364975572	/nfs/dbraw/zinc/97/55/72/1364975572.db2.gz	UGYQLIWGUBFUHW-HYVNUMGLSA-N	0	3	347.503	3.332	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@@H]1CN(Cc2oc(CC)nc2C)C[C@H]1C	ZINC001102410295	1365043482	/nfs/dbraw/zinc/04/34/82/1365043482.db2.gz	VISAHVSZGFNKAC-GDBMZVCRSA-N	0	3	347.503	3.332	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)cc2F)C[C@H]1CCNC(=O)C1CCC1	ZINC001102632352	1365144837	/nfs/dbraw/zinc/14/48/37/1365144837.db2.gz	SDRFNXSAAMHWAN-RHSMWYFYSA-N	0	3	343.446	3.072	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1CCNC(=O)CC1CC1	ZINC001102633806	1365145566	/nfs/dbraw/zinc/14/55/66/1365145566.db2.gz	ILFNWGBSESKXJF-VQIMIIECSA-N	0	3	342.458	3.052	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](NCc3c(C)nsc3C)C2)CCC1	ZINC001185463627	1387721848	/nfs/dbraw/zinc/72/18/48/1387721848.db2.gz	VLZNIRHTPMOGRW-OAHLLOKOSA-N	0	3	333.501	3.197	20	30		EGEDHN
CC(C)C(=O)NCC[C@@H]1CN(CC#Cc2ccc(Cl)cc2)C[C@H]1C	ZINC001102674600	1365165427	/nfs/dbraw/zinc/16/54/27/1365165427.db2.gz	XRLKEQJUNRURTR-SJLPKXTDSA-N	0	3	346.902	3.422	20	30		EGEDHN
C/C=C(\C)C(=O)NCC[C@@H]1CN(Cc2cc(C#N)ccc2F)C[C@H]1C	ZINC001102841589	1365247131	/nfs/dbraw/zinc/24/71/31/1365247131.db2.gz	KIXJZSKSXDIGQQ-FZGIQDKVSA-N	0	3	343.446	3.238	20	30		EGEDHN
C=C(C)CCC(=O)NCC[C@@H]1CN(Cc2cc(C3CC3)no2)C[C@H]1C	ZINC001103040240	1365350779	/nfs/dbraw/zinc/35/07/79/1365350779.db2.gz	LYMQRSRDRSHEKV-NVXWUHKLSA-N	0	3	345.487	3.483	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2ccn3c2CCCC3)C1	ZINC001103096798	1365378472	/nfs/dbraw/zinc/37/84/72/1365378472.db2.gz	JPUOWUPFULJEBM-GDBMZVCRSA-N	0	3	349.906	3.265	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2ncc(C)cc2C)C1	ZINC001103255658	1365459372	/nfs/dbraw/zinc/45/93/72/1365459372.db2.gz	LYMDTOZIZFQQPI-GDBMZVCRSA-N	0	3	335.879	3.139	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2csc(Cl)n2)C1	ZINC001103617823	1365681295	/nfs/dbraw/zinc/68/12/95/1365681295.db2.gz	SISGDBXMYPZZEU-MWLCHTKSSA-N	0	3	348.299	3.237	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2ncoc2C(C)C)C1	ZINC001103619973	1365682386	/nfs/dbraw/zinc/68/23/86/1365682386.db2.gz	ZFEVEXNBNZZZSB-TZMCWYRMSA-N	0	3	339.867	3.238	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cccc(OC)c2)C1	ZINC001103672148	1365719816	/nfs/dbraw/zinc/71/98/16/1365719816.db2.gz	OQBGLAMKQRYSCH-CZUORRHYSA-N	0	3	336.863	3.136	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CN(C(=O)[C@H](C)C2CC2)C[C@H]1C	ZINC001104041424	1365886735	/nfs/dbraw/zinc/88/67/35/1365886735.db2.gz	CPJSBZAGIVSFOM-UXIGCNINSA-N	0	3	343.309	3.015	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@@H](C)[C@H](CCNCc2c(C)noc2C)C1	ZINC001104562824	1366077455	/nfs/dbraw/zinc/07/74/55/1366077455.db2.gz	GUANXFPYCTYALL-FHLIZLRMSA-N	0	3	347.503	3.468	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@@H](C)[C@H](CCNCc2nccn2CC)C1	ZINC001104563603	1366078470	/nfs/dbraw/zinc/07/84/70/1366078470.db2.gz	OMIYKYPIODFJGF-KZNAEPCWSA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](C)[C@H](CCNCc2nccn2CC)C1	ZINC001104563868	1366078697	/nfs/dbraw/zinc/07/86/97/1366078697.db2.gz	XPPSGTAXDYSLTD-RCCFBDPRSA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)[C@@H]2Cc3ccccc32)C[C@H]1C	ZINC001104605777	1366098541	/nfs/dbraw/zinc/09/85/41/1366098541.db2.gz	SFONLJWSPPGUGU-MZMPZRCHSA-N	0	3	332.875	3.153	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](C)[C@H](CCNCc3conc3C)C2)CCC1	ZINC001104639231	1366114768	/nfs/dbraw/zinc/11/47/68/1366114768.db2.gz	MACQZBCUQOMSAV-NVXWUHKLSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2occc2Cl)C[C@H]1C	ZINC001104641228	1366115624	/nfs/dbraw/zinc/11/56/24/1366115624.db2.gz	FZXSRINLGPSPMH-ZYHUDNBSSA-N	0	3	331.243	3.373	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](C)[C@H](CCNCc3nc(C)cs3)C2)C1	ZINC001104654520	1366119415	/nfs/dbraw/zinc/11/94/15/1366119415.db2.gz	IBVWZNFPHZOXIH-GDBMZVCRSA-N	0	3	347.528	3.382	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2ncccc2Cl)C[C@H]1C	ZINC001104931272	1366229044	/nfs/dbraw/zinc/22/90/44/1366229044.db2.gz	OTXUKSNZXRUAIP-DGCLKSJQSA-N	0	3	342.270	3.175	20	30		EGEDHN
CC[C@H](C)CC(=O)N1C[C@@H](CNCc2cc(F)ccc2C#N)[C@H](C)C1	ZINC001106061525	1366608153	/nfs/dbraw/zinc/60/81/53/1366608153.db2.gz	GWLUCQOJGOVATH-HDMKZQKVSA-N	0	3	345.462	3.318	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H](CNCc2nc(C)cs2)[C@H](C)C1	ZINC001106175486	1366616547	/nfs/dbraw/zinc/61/65/47/1366616547.db2.gz	GMLSAKJCYPKVKK-RHSMWYFYSA-N	0	3	347.528	3.404	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001106564116	1366737188	/nfs/dbraw/zinc/73/71/88/1366737188.db2.gz	SXCMDWCGFOQISN-MBOZVWFJSA-N	0	3	339.483	3.345	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCC2(C)CC2)C[C@H]1CNCc1ccccc1C#N	ZINC001106831744	1366810946	/nfs/dbraw/zinc/81/09/46/1366810946.db2.gz	OGJZNRFSIAJKMG-VQIMIIECSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=CCCC(=O)NC[C@]12CCC[C@H]1N(Cc1cc(C)ns1)CC2	ZINC001107327041	1366929265	/nfs/dbraw/zinc/92/92/65/1366929265.db2.gz	PFQBZYONIIRBCF-SJLPKXTDSA-N	0	3	333.501	3.279	20	30		EGEDHN
C=CCCC(=O)NC[C@]12CCC[C@H]1N(Cc1ccc(C#N)s1)CC2	ZINC001107327147	1366929429	/nfs/dbraw/zinc/92/94/29/1366929429.db2.gz	RPHFCEGIBKSFJE-IEBWSBKVSA-N	0	3	343.496	3.447	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@]12CCC[C@H]1N(Cc1conc1CC)CC2	ZINC001107422744	1366960030	/nfs/dbraw/zinc/96/00/30/1366960030.db2.gz	MOJFAQOKGLMYDI-UYAOXDASSA-N	0	3	345.487	3.454	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](N(C)CCOc2cccc(CC)c2)C1	ZINC001189317797	1366987227	/nfs/dbraw/zinc/98/72/27/1366987227.db2.gz	FONIOCYNLBBQFZ-GOSISDBHSA-N	0	3	330.472	3.127	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC[C@@H](N(C)C/C=C/c2ccc(Cl)cc2)C1	ZINC001189400599	1367012964	/nfs/dbraw/zinc/01/29/64/1367012964.db2.gz	MGBZHHAMURGEGT-LMIZRQEKSA-N	0	3	331.847	3.046	20	30		EGEDHN
C=CCCCC(=O)NC[C@]12CCC[C@H]1N(Cc1conc1CC)CC2	ZINC001107524160	1367018113	/nfs/dbraw/zinc/01/81/13/1367018113.db2.gz	KWNYGVXNOUTRJQ-UYAOXDASSA-N	0	3	345.487	3.454	20	30		EGEDHN
C=CCCCC(=O)NC[C@]12CCC[C@H]1N(Cc1cc(C)no1)CC2	ZINC001107524407	1367019083	/nfs/dbraw/zinc/01/90/83/1367019083.db2.gz	YBUJEBJGGHUIKC-IEBWSBKVSA-N	0	3	331.460	3.200	20	30		EGEDHN
CCC[C@@H](C(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1)C(C)C	ZINC001186019166	1387848191	/nfs/dbraw/zinc/84/81/91/1387848191.db2.gz	MQAQGEBMZQSPFL-QZTJIDSGSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)c3cc(C(C)C)oc3C)[C@@H]2C1	ZINC001189605310	1367066291	/nfs/dbraw/zinc/06/62/91/1367066291.db2.gz	LJWJHSFHTYUDQE-FUHWJXTLSA-N	0	3	346.471	3.060	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCCOC(C)C	ZINC001109346051	1367072807	/nfs/dbraw/zinc/07/28/07/1367072807.db2.gz	ZJLBBEIQMQSWQS-PMPSAXMXSA-N	0	3	342.911	3.302	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](N(C)Cc2cc(F)ccc2C)C1	ZINC001189744663	1367100815	/nfs/dbraw/zinc/10/08/15/1367100815.db2.gz	WWAMXGOBHQESRU-LJQANCHMSA-N	0	3	330.447	3.360	20	30		EGEDHN
CCCCCCCCC(=O)N1CC[C@H]2CN(CCn3cccn3)C[C@H]21	ZINC001189936822	1367134616	/nfs/dbraw/zinc/13/46/16/1367134616.db2.gz	KWXKSJRQLUNUTK-RBUKOAKNSA-N	0	3	346.519	3.166	20	30		EGEDHN
Cc1cc(Cl)ccc1CN(C)[C@H]1CCN(C(=O)C#CC(C)C)C1	ZINC001190045690	1367159920	/nfs/dbraw/zinc/15/99/20/1367159920.db2.gz	ARFZEXMXEPDOGO-SFHVURJKSA-N	0	3	332.875	3.341	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2oc(C)cc2C)C1	ZINC001107853163	1367176249	/nfs/dbraw/zinc/17/62/49/1367176249.db2.gz	MTQNCLQKDGKPPE-KXBFYZLASA-N	0	3	334.460	3.072	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)CC(C)(C)C2CC2)C1	ZINC001107922017	1367203306	/nfs/dbraw/zinc/20/33/06/1367203306.db2.gz	KLTRHWIKLHXWMD-OXQOHEQNSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@@]1(C)CN(C[C@@H](C)CC(C)C)CCO1	ZINC001107970891	1367224619	/nfs/dbraw/zinc/22/46/19/1367224619.db2.gz	KWIOQVBVSXYYLL-PXNSSMCTSA-N	0	3	338.536	3.478	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](N(C)CCOc2cccc(F)c2)C1	ZINC001190388010	1367248586	/nfs/dbraw/zinc/24/85/86/1367248586.db2.gz	JXRRSOTTYZWDDA-QGZVFWFLSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](N(C)Cc2ccccc2N(C)C)C1	ZINC001190398448	1367253975	/nfs/dbraw/zinc/25/39/75/1367253975.db2.gz	VWAKZNGPFVHOIO-SFHVURJKSA-N	0	3	343.515	3.388	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CC[C@H](N(C)Cc2cccc(F)c2)C1)OCC	ZINC001190443144	1367267714	/nfs/dbraw/zinc/26/77/14/1367267714.db2.gz	FGYPMIKVQUEXFG-RBUKOAKNSA-N	0	3	348.462	3.230	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2ccc(C3CCC3)cc2)C1	ZINC001190527797	1367285993	/nfs/dbraw/zinc/28/59/93/1367285993.db2.gz	JTFSEDKBTXUPQJ-FQEVSTJZSA-N	0	3	342.483	3.303	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2cc[nH]c2CCC)C1	ZINC001108154930	1367315526	/nfs/dbraw/zinc/31/55/26/1367315526.db2.gz	KGELVYKDNTVPMW-OXJNMPFZSA-N	0	3	347.503	3.143	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2ccoc2C2CC2)C1	ZINC001108162065	1367317105	/nfs/dbraw/zinc/31/71/05/1367317105.db2.gz	OHKCMRRZFXDHGT-QRWLVFNGSA-N	0	3	346.471	3.332	20	30		EGEDHN
C=CCC1(C(=O)NC[C@]2(C)CN(CCC(C)(C)C)CCO2)CCC1	ZINC001108188546	1367330998	/nfs/dbraw/zinc/33/09/98/1367330998.db2.gz	UXRNFWGBJVSHMP-LJQANCHMSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@]2(C)CN(C[C@@H](C)CC(C)C)CCO2)C1	ZINC001108201819	1367340262	/nfs/dbraw/zinc/34/02/62/1367340262.db2.gz	SHOWTGBJYBQYJK-JXFKEZNVSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2c(C)cccc2C)C1	ZINC001108236381	1367354392	/nfs/dbraw/zinc/35/43/92/1367354392.db2.gz	KQJJSGQXJAQSLB-NQIIRXRSSA-N	0	3	344.499	3.479	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2ccc(CC)cc2)C1	ZINC001108374388	1367422375	/nfs/dbraw/zinc/42/23/75/1367422375.db2.gz	KUIUYGFDUIPSCW-DYESRHJHSA-N	0	3	344.499	3.424	20	30		EGEDHN
C#CCC1(C(=O)NC[C@@]2(C)CN(C[C@@H](C)CC)CCO2)CCCCC1	ZINC001108429700	1367453306	/nfs/dbraw/zinc/45/33/06/1367453306.db2.gz	MODQUJMCNZXNDT-ICSRJNTNSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2csc3ccccc23)C1	ZINC001191596116	1367539584	/nfs/dbraw/zinc/53/95/84/1367539584.db2.gz	VAFMURZMKUZQKE-OAHLLOKOSA-N	0	3	344.480	3.250	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1c(C)cccc1C	ZINC001110183195	1367551653	/nfs/dbraw/zinc/55/16/53/1367551653.db2.gz	NEJCDOHQOKWDAW-HNJRGHQBSA-N	0	3	342.483	3.116	20	30		EGEDHN
C#CC[C@H](CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCCF)c1ccccc1	ZINC001110206296	1367563032	/nfs/dbraw/zinc/56/30/32/1367563032.db2.gz	JFECXSBORDOOQU-ZRNYENFQSA-N	0	3	342.458	3.265	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](N(C)Cc2cccc(OC)c2C)C1	ZINC001191867797	1367620453	/nfs/dbraw/zinc/62/04/53/1367620453.db2.gz	ITDNEPVGJZAAMD-LJQANCHMSA-N	0	3	342.483	3.230	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@@H](N(C)CCOc2cccc(F)c2)C1	ZINC001191891029	1367628434	/nfs/dbraw/zinc/62/84/34/1367628434.db2.gz	WDWBKXVAMGEJOL-SJLPKXTDSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](N(C)CCc2scnc2C)C1	ZINC001191902930	1367630810	/nfs/dbraw/zinc/63/08/10/1367630810.db2.gz	UDQWRHMNIVUVKW-HOCLYGCPSA-N	0	3	335.517	3.129	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@H](N(C)Cc2ccc(OC)cc2)C1	ZINC001191913287	1367637463	/nfs/dbraw/zinc/63/74/63/1367637463.db2.gz	VRCGZSQLFDLLPN-WMZOPIPTSA-N	0	3	330.472	3.330	20	30		EGEDHN
Cc1cccc([C@H](C)N2[C@@H]3CC[C@H]2[C@@H](NC(=O)CSCC#N)C3)c1	ZINC001108952405	1367680408	/nfs/dbraw/zinc/68/04/08/1367680408.db2.gz	YPUYZJUXGDVGDL-RANZSIQMSA-N	0	3	343.496	3.034	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@H](N(C)CCOc2cccc(F)c2)C1	ZINC001192161923	1367704340	/nfs/dbraw/zinc/70/43/40/1367704340.db2.gz	LUPZHQKQGNNRDN-XLIONFOSSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)C(C)(C)C2CCCCC2)C1	ZINC001192748617	1367865918	/nfs/dbraw/zinc/86/59/18/1367865918.db2.gz	CMQVGHAGRGDDFT-SFHVURJKSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccccc1)OCC	ZINC001110616939	1367873378	/nfs/dbraw/zinc/87/33/78/1367873378.db2.gz	WMCYHWHOBZFFCK-ZRNYENFQSA-N	0	3	342.483	3.279	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)c2ccc3occc3c2)C1	ZINC001193129837	1367950530	/nfs/dbraw/zinc/95/05/30/1367950530.db2.gz	AMQOQCODNFELMK-QZTJIDSGSA-N	0	3	344.455	3.178	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)[C@H](F)CCCCCC)C1	ZINC001193479400	1368042624	/nfs/dbraw/zinc/04/26/24/1368042624.db2.gz	VAGUDRBTLWBUIH-DLBZAZTESA-N	0	3	328.472	3.030	20	30		EGEDHN
C=CC1(CC(=O)N2CC[C@@H](NCc3cncc(F)c3)C2)CCCCC1	ZINC001186295693	1387916704	/nfs/dbraw/zinc/91/67/04/1387916704.db2.gz	JHSLVCUPZUUADZ-GOSISDBHSA-N	0	3	345.462	3.438	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCCOc1ccccc1C)C2	ZINC001110881280	1368055472	/nfs/dbraw/zinc/05/54/72/1368055472.db2.gz	MINMHNPUBJYWPA-QRVBRYPASA-N	0	3	342.483	3.452	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2ccc3ccccc3c2)C1	ZINC001193664602	1368088263	/nfs/dbraw/zinc/08/82/63/1368088263.db2.gz	XOYNQPDPMGCHAS-FQEVSTJZSA-N	0	3	338.451	3.189	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](C)Cc1ccccc1Cl)C2	ZINC001111081407	1368154400	/nfs/dbraw/zinc/15/44/00/1368154400.db2.gz	UHCWURRAHLNVFH-OPNNQBFTSA-N	0	3	344.886	3.263	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)CC1(C=C)CCCCC1)C2	ZINC001111135177	1368163710	/nfs/dbraw/zinc/16/37/10/1368163710.db2.gz	FIPGCHQZDKFMMN-QRVBRYPASA-N	0	3	346.515	3.437	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)[C@@H](CC=C)c2ccccc2)C1	ZINC001194174362	1368198568	/nfs/dbraw/zinc/19/85/68/1368198568.db2.gz	RWPHVIFXGLEZSN-PMACEKPBSA-N	0	3	342.483	3.082	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](CC)Cc1ccccc1C)C2	ZINC001111279170	1368246878	/nfs/dbraw/zinc/24/68/78/1368246878.db2.gz	URTIKCCIWFWQKX-WLRLJWMZSA-N	0	3	338.495	3.309	20	30		EGEDHN
C=CCCOCC(=O)N1CC[C@H](N(C)[C@@H](C)c2cccc(F)c2)C1	ZINC001194396540	1368251173	/nfs/dbraw/zinc/25/11/73/1368251173.db2.gz	FBRKJYPCJQJVCA-YJBOKZPZSA-N	0	3	334.435	3.012	20	30		EGEDHN
C=C[C@@H](CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCCF)c1ccccc1	ZINC001111440329	1368307916	/nfs/dbraw/zinc/30/79/16/1368307916.db2.gz	KHJVWVMPGRBBMB-AITUJVMLSA-N	0	3	330.447	3.427	20	30		EGEDHN
C=C[C@@H](C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCOC(C)C)c1ccccc1	ZINC001111443399	1368308845	/nfs/dbraw/zinc/30/88/45/1368308845.db2.gz	JPEOWLFVZURQDJ-WTGUMLROSA-N	0	3	342.483	3.103	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](CCC)CC(C)C)C2	ZINC001111480214	1368317291	/nfs/dbraw/zinc/31/72/91/1368317291.db2.gz	LELYTOOZSJZGOI-MANSERQUSA-N	0	3	336.520	3.373	20	30		EGEDHN
C=CCC[C@H](C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCOC)c1ccccc1	ZINC001111521312	1368324649	/nfs/dbraw/zinc/32/46/49/1368324649.db2.gz	TVVVZAVLHQVCFK-WCIQWLHISA-N	0	3	342.483	3.104	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)C[C@@H](NC(=O)CSC)c1ccccc1O2	ZINC001111529905	1368329627	/nfs/dbraw/zinc/32/96/27/1368329627.db2.gz	RMRRCZCNTAYVOP-APWZRJJASA-N	0	3	346.496	3.010	20	30		EGEDHN
CC/C=C(/C)C(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(C#N)cc1)C2	ZINC001111632732	1368395242	/nfs/dbraw/zinc/39/52/42/1368395242.db2.gz	XOVLSKKAFVPZLV-VUMRDRDLSA-N	0	3	337.467	3.385	20	30		EGEDHN
C=CCCC(=O)N[C@]12CCC[C@H]1CN(CCOc1ccccc1F)C2	ZINC001111648698	1368411595	/nfs/dbraw/zinc/41/15/95/1368411595.db2.gz	KMXIMEKWBRTYHU-JXFKEZNVSA-N	0	3	346.446	3.141	20	30		EGEDHN
C=CCOCC(=O)N[C@]12CCC[C@H]1CN([C@@H](C)c1cccc(F)c1)C2	ZINC001111662077	1368414478	/nfs/dbraw/zinc/41/44/78/1368414478.db2.gz	FDCZTBRBJJNYPS-KNBMTAEXSA-N	0	3	346.446	3.060	20	30		EGEDHN
CCC[C@@H](C)C(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(C#N)cc1)C2	ZINC001111672770	1368418660	/nfs/dbraw/zinc/41/86/60/1368418660.db2.gz	LYWBBGIRSQKPOI-PBEJRMEISA-N	0	3	339.483	3.465	20	30		EGEDHN
O=C(C#CC1CC1)N[C@]12CCC[C@H]1CN(Cc1ccc(CF)cc1)C2	ZINC001111740597	1368437499	/nfs/dbraw/zinc/43/74/99/1368437499.db2.gz	FRYZIFMFDOLCQU-FPOVZHCZSA-N	0	3	340.442	3.040	20	30		EGEDHN
C[C@H](c1cccc(F)c1)N1C[C@@H]2CCC[C@]2(NC(=O)C#CC2CC2)C1	ZINC001111741922	1368439057	/nfs/dbraw/zinc/43/90/57/1368439057.db2.gz	WARSDOOSVOFLEE-YWMUFLPLSA-N	0	3	340.442	3.271	20	30		EGEDHN
C=CCCOCCCCC(=O)N1CCCN(CCCCCF)CC1	ZINC001195838796	1368501298	/nfs/dbraw/zinc/50/12/98/1368501298.db2.gz	DHDXGMQFXCFXSV-UHFFFAOYSA-N	0	3	342.499	3.424	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCCN(C[C@@H](O)C2CCCCC2)CC1	ZINC001195966734	1368524973	/nfs/dbraw/zinc/52/49/73/1368524973.db2.gz	UXMNUGOAYGSGMJ-HXUWFJFHSA-N	0	3	348.531	3.230	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H](C)Cc2ccc(C)cc2)C1	ZINC001112012766	1368616447	/nfs/dbraw/zinc/61/64/47/1368616447.db2.gz	KEIPPMRWPYXNKP-CBQOVEMMSA-N	0	3	338.495	3.168	20	30		EGEDHN
C=CCC1(C(=O)N2CCCN(C[C@H](O)C3CCCCC3)CC2)CCC1	ZINC001197076229	1368740941	/nfs/dbraw/zinc/74/09/41/1368740941.db2.gz	DJFUBCROFDVSLR-IBGZPJMESA-N	0	3	348.531	3.208	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cn(CC)nc2C)CC1	ZINC001197282983	1368779259	/nfs/dbraw/zinc/77/92/59/1368779259.db2.gz	AEGIIALMVWIOAS-UHFFFAOYSA-N	0	3	332.492	3.106	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cnn(CC(C)C)c2)CC1	ZINC001197560164	1368840512	/nfs/dbraw/zinc/84/05/12/1368840512.db2.gz	KVCPLYZSFNTOGO-UHFFFAOYSA-N	0	3	346.519	3.433	20	30		EGEDHN
C=C(C)CN1CCCN(C(=O)CCOc2ccccc2CC)CC1	ZINC001197787535	1368895988	/nfs/dbraw/zinc/89/59/88/1368895988.db2.gz	SOSXFVIWZDUBPJ-UHFFFAOYSA-N	0	3	330.472	3.128	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cncnc2C2CC2)CC1	ZINC001197996022	1368938598	/nfs/dbraw/zinc/93/85/98/1368938598.db2.gz	YBJACLNOPVPEKW-UHFFFAOYSA-N	0	3	342.487	3.248	20	30		EGEDHN
C=CCC[C@@H](C)N1CCCN(C(=O)c2scnc2Cl)CC1	ZINC001198122010	1368964256	/nfs/dbraw/zinc/96/42/56/1368964256.db2.gz	WDIIHLBSESRACM-GFCCVEGCSA-N	0	3	327.881	3.299	20	30		EGEDHN
O=C(CC#Cc1ccccc1)N1CCCN(CCCCCF)CC1	ZINC001198214210	1368981374	/nfs/dbraw/zinc/98/13/74/1368981374.db2.gz	NNZUHBHYFJFMNQ-UHFFFAOYSA-N	0	3	330.447	3.102	20	30		EGEDHN
C=C[C@H](CC(=O)N1CCCN(C[C@H](CC)OC)CC1)c1ccccc1	ZINC001198214574	1368982195	/nfs/dbraw/zinc/98/21/95/1368982195.db2.gz	QXYMWPMGSGLFCR-QUCCMNQESA-N	0	3	344.499	3.306	20	30		EGEDHN
C#CCCN1CCCN(C(=O)CCCCc2ccc(C)cc2)CC1	ZINC001198337388	1369011296	/nfs/dbraw/zinc/01/12/96/1369011296.db2.gz	PQTZOJGSKUDOQG-UHFFFAOYSA-N	0	3	326.484	3.265	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N1CCCN(Cc2ccccc2C(C)C)CC1	ZINC001198344983	1369013544	/nfs/dbraw/zinc/01/35/44/1369013544.db2.gz	YDJVWENUHISILT-GOSISDBHSA-N	0	3	344.499	3.435	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)c1ccccn1)c1ccccc1OC	ZINC001198492816	1369045564	/nfs/dbraw/zinc/04/55/64/1369045564.db2.gz	WFVBCAMRFKNANA-SFHVURJKSA-N	0	3	339.439	3.117	20	30		EGEDHN
C=CCC[NH2+][C@@H](CNC(=O)c1ccccc1[O-])c1ccccc1OC	ZINC001198542953	1369057031	/nfs/dbraw/zinc/05/70/31/1369057031.db2.gz	PKYCJGJPAPOFKB-KRWDZBQOSA-N	0	3	340.423	3.038	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC[C@@H](NCC(C)C)c1ccccc1OC	ZINC001198596599	1369068748	/nfs/dbraw/zinc/06/87/48/1369068748.db2.gz	SRWQJEVYIJYIQM-SJLPKXTDSA-N	0	3	348.487	3.079	20	30		EGEDHN
CCC/C=C/CCN[C@H](CNC(=O)[C@H](C)C#N)c1ccccc1OC	ZINC001198616544	1369073481	/nfs/dbraw/zinc/07/34/81/1369073481.db2.gz	IPLZEBXBDSMJAN-WXYTYNPNSA-N	0	3	343.471	3.348	20	30		EGEDHN
C=C(C)CCC(=O)N1CCN(C[C@H]2CCc3ccccc3C2)CC1	ZINC001112901233	1369080510	/nfs/dbraw/zinc/08/05/10/1369080510.db2.gz	CGIBGAOVSBUOAV-SFHVURJKSA-N	0	3	326.484	3.292	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)c1cc[nH]c1C)c1ccccc1OC	ZINC001198648165	1369081155	/nfs/dbraw/zinc/08/11/55/1369081155.db2.gz	SMOSIJXWIUYXCG-SFHVURJKSA-N	0	3	341.455	3.359	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@H](C)n1cccc1)c1ccccc1OC	ZINC001198669210	1369087045	/nfs/dbraw/zinc/08/70/45/1369087045.db2.gz	XSFVVBSUJMOLDI-WMZOPIPTSA-N	0	3	341.455	3.081	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)/C=C/c1ccc[nH]1)c1ccccc1OC	ZINC001198686147	1369091418	/nfs/dbraw/zinc/09/14/18/1369091418.db2.gz	LEUBYKRUYMNLMQ-DXRVJIQQSA-N	0	3	339.439	3.060	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)C(C)(C)COC)c1ccccc1OC	ZINC001198798027	1369117428	/nfs/dbraw/zinc/11/74/28/1369117428.db2.gz	YYRTZSUBHMCKEZ-QGZVFWFLSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@@H](NCC1CC1)c1ccccc1OC	ZINC001198856491	1369130648	/nfs/dbraw/zinc/13/06/48/1369130648.db2.gz	IMKPOMRXTVCFJH-MAUKXSAKSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@@H](NCC1CC1)c1ccccc1OC	ZINC001198856859	1369131018	/nfs/dbraw/zinc/13/10/18/1369131018.db2.gz	KUADVIQGLDJYAD-MAUKXSAKSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)[C@@H]1C[C@H]1CC)c1ccccc1OC	ZINC001198908889	1369146697	/nfs/dbraw/zinc/14/66/97/1369146697.db2.gz	PNKKVRYJSLIBQH-NXHRZFHOSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)C[C@@H](C)c2c(C)noc2C)CC1	ZINC001113030081	1369150906	/nfs/dbraw/zinc/15/09/06/1369150906.db2.gz	JQMHEAZYLFXJMS-CABCVRRESA-N	0	3	333.476	3.284	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)c1nocc1C)c1ccccc1OC	ZINC001198953982	1369157895	/nfs/dbraw/zinc/15/78/95/1369157895.db2.gz	YHOBKUBKBILGRU-MRXNPFEDSA-N	0	3	343.427	3.019	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)CCCOc2ccc(F)cc2)CC1	ZINC001113179775	1369248674	/nfs/dbraw/zinc/24/86/74/1369248674.db2.gz	NHLVYIKRHSCIQC-KRWDZBQOSA-N	0	3	348.462	3.484	20	30		EGEDHN
C=CCCC(=O)N1CCCO[C@H](CN[C@@H](C)c2ccccc2F)C1	ZINC001200101274	1369315871	/nfs/dbraw/zinc/31/58/71/1369315871.db2.gz	TWLOKRJURXDVGE-JKSUJKDBSA-N	0	3	334.435	3.060	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC(NCc2nc(C(C)(C)C)cs2)CC1	ZINC001200456360	1369372426	/nfs/dbraw/zinc/37/24/26/1369372426.db2.gz	RYBQJMMANDKFCL-UHFFFAOYSA-N	0	3	347.528	3.181	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC(NCC(=C)Br)CC1	ZINC001200782741	1369427097	/nfs/dbraw/zinc/42/70/97/1369427097.db2.gz	BNPRGARNTGSKGY-UHFFFAOYSA-N	0	3	329.282	3.078	20	30		EGEDHN
C=CCCCC(=O)N1CCCO[C@H](CNCc2cc(C)ccc2F)C1	ZINC001201294111	1369512267	/nfs/dbraw/zinc/51/22/67/1369512267.db2.gz	RCSYZPDHZZODRD-GOSISDBHSA-N	0	3	348.462	3.198	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)Cc2cc3ccccc3n2C)CC1	ZINC001113699887	1369573486	/nfs/dbraw/zinc/57/34/86/1369573486.db2.gz	ZHEOGJSUWNVTQR-QGZVFWFLSA-N	0	3	339.483	3.220	20	30		EGEDHN
COc1ccc(C#N)cc1Nc1ccc(N2CCN(C)CC2)cc1C	ZINC001201584493	1369582861	/nfs/dbraw/zinc/58/28/61/1369582861.db2.gz	WTPKQWZRGBPNMP-UHFFFAOYSA-N	0	3	336.439	3.371	20	30		EGEDHN
CCCCCCCN1CCCn2c(=O)cc(CN3CCCC3)nc2C1	ZINC001201776851	1369622786	/nfs/dbraw/zinc/62/27/86/1369622786.db2.gz	OBUATGRAKCCYEH-UHFFFAOYSA-N	0	3	346.519	3.015	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)N1CCC(NCc2nc(C)sc2C)CC1	ZINC001202084681	1369684223	/nfs/dbraw/zinc/68/42/23/1369684223.db2.gz	HRBQQCMCQLWWQQ-STQMWFEESA-N	0	3	335.517	3.299	20	30		EGEDHN
CCCC(=O)N[C@@H]1C[C@@H](NCc2cc(C#N)ccc2F)C12CCC2	ZINC001202337663	1369741859	/nfs/dbraw/zinc/74/18/59/1369741859.db2.gz	UMKUJHSBXAHFBG-IAGOWNOFSA-N	0	3	329.419	3.014	20	30		EGEDHN
CC(C)=C(F)C(=O)N[C@@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202736467	1369873471	/nfs/dbraw/zinc/87/34/71/1369873471.db2.gz	QGUAOFMGZWCZSR-ZWKOTPCHSA-N	0	3	340.442	3.319	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202786275	1369891467	/nfs/dbraw/zinc/89/14/67/1369891467.db2.gz	UKKABTSJJXIJPF-NHCUHLMSSA-N	0	3	348.490	3.249	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H]1[C@H]2CN(Cc3csc(C)c3)C[C@H]21	ZINC001114335785	1369898533	/nfs/dbraw/zinc/89/85/33/1369898533.db2.gz	BNZLMAMPSJUKOH-FICVDOATSA-N	0	3	338.904	3.382	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1C[C@@H](NCc2ccccc2F)C12CCC2	ZINC001202830756	1369904103	/nfs/dbraw/zinc/90/41/03/1369904103.db2.gz	ACVHNFVFJFDRBX-QZTJIDSGSA-N	0	3	328.431	3.146	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1C[C@H](NCc2ccc(F)cc2F)C12CCC2	ZINC001202845191	1369906008	/nfs/dbraw/zinc/90/60/08/1369906008.db2.gz	BSPNUTSBHSYSMV-ROUUACIJSA-N	0	3	346.421	3.285	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1[C@H]2CN(Cc3cccc(OCCC)c3)C[C@H]21	ZINC001114353645	1369907849	/nfs/dbraw/zinc/90/78/49/1369907849.db2.gz	XBCHACKWIAKGOW-KXTWHKPSSA-N	0	3	342.483	3.378	20	30		EGEDHN
C[C@H](c1ccccc1)N(Cc1ccc(C#N)cc1)C[C@H]1CCC(=O)N1	ZINC001202898826	1369921051	/nfs/dbraw/zinc/92/10/51/1369921051.db2.gz	IRIWVDXYOMZAID-OXQOHEQNSA-N	0	3	333.435	3.400	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@@H]1C[C@@H](NCC=C(Cl)Cl)C12CCC2	ZINC001202919621	1369926629	/nfs/dbraw/zinc/92/66/29/1369926629.db2.gz	GDDRQIQTMRAPDT-CHWSQXEVSA-N	0	3	343.298	3.372	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H]1C[C@H](NCc2ccccn2)C12CCC2	ZINC001202960707	1369937278	/nfs/dbraw/zinc/93/72/78/1369937278.db2.gz	QGQIXFFMLTZJOA-JKSUJKDBSA-N	0	3	347.890	3.377	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1C[C@@H](NCc2cnc(C)o2)C12CCC2	ZINC001202967795	1369939114	/nfs/dbraw/zinc/93/91/14/1369939114.db2.gz	GSTHEZOTGAJHLU-HZPDHXFCSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1C[C@@H](NCc2c(C)noc2C)C12CCC2	ZINC001202978795	1369944371	/nfs/dbraw/zinc/94/43/71/1369944371.db2.gz	IYMGODPOFKBNAJ-SJORKVTESA-N	0	3	331.460	3.165	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1[C@H]2CN(CCCCC(F)(F)F)C[C@H]21	ZINC001114680082	1370022050	/nfs/dbraw/zinc/02/20/50/1370022050.db2.gz	DNXMLHGBDPJODZ-WDNDVIMCSA-N	0	3	332.410	3.368	20	30		EGEDHN
CC(C)(C)C(C)(C)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001114689291	1370025973	/nfs/dbraw/zinc/02/59/73/1370025973.db2.gz	HDRQPSWRXIVNPT-PIIMJCKOSA-N	0	3	339.483	3.177	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1[C@H]2CN(Cc3cc(C)ccc3OC)C[C@H]21	ZINC001114719619	1370044533	/nfs/dbraw/zinc/04/45/33/1370044533.db2.gz	JDHMSEXHAFFLBW-OCQZMCQHSA-N	0	3	342.483	3.152	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1[C@H]2CN(CCCCC(F)(F)F)C[C@H]21	ZINC001114792409	1370083265	/nfs/dbraw/zinc/08/32/65/1370083265.db2.gz	SGTHZTRAAVKHQK-NHIYQJMISA-N	0	3	332.410	3.368	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C(C)(C)CC)C12CCC2	ZINC001203332838	1370086135	/nfs/dbraw/zinc/08/61/35/1370086135.db2.gz	QAEQKRLFYYZYBJ-STQMWFEESA-N	0	3	343.309	3.348	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@@H](NCc3cncs3)C23CCC3)CCC1	ZINC001203366549	1370100608	/nfs/dbraw/zinc/10/06/08/1370100608.db2.gz	NUNSHDQGJWQWJH-CVEARBPZSA-N	0	3	345.512	3.407	20	30		EGEDHN
CN1CCN(Cc2cccc(Nc3cc(F)c(C#N)c(F)c3)c2)CC1	ZINC001203677961	1370214113	/nfs/dbraw/zinc/21/41/13/1370214113.db2.gz	HBAVJHNZVJSWSR-UHFFFAOYSA-N	0	3	342.393	3.327	20	30		EGEDHN
N#Cc1ccc(CN2CCC(c3nc(-c4cccnc4)no3)CC2)cc1	ZINC001203904155	1370308968	/nfs/dbraw/zinc/30/89/68/1370308968.db2.gz	YXMWIVRWDOSSOP-UHFFFAOYSA-N	0	3	345.406	3.383	20	30		EGEDHN
COc1cc(C#N)ccc1OC1CCN(Cc2ccc(O)cc2)CC1	ZINC001204095765	1370377430	/nfs/dbraw/zinc/37/74/30/1370377430.db2.gz	FYBNOKXEJGNRKB-UHFFFAOYSA-N	0	3	338.407	3.316	20	30		EGEDHN
O=C(NCC1(NCC#Cc2ccc(F)cc2)CCCCC1)C1CCC1	ZINC001115376121	1370416358	/nfs/dbraw/zinc/41/63/58/1370416358.db2.gz	HLVIPPLRWBPQSC-UHFFFAOYSA-N	0	3	342.458	3.386	20	30		EGEDHN
CC(C)(F)C(=O)NCC1(NCC#Cc2ccccc2)CCCCC1	ZINC001115379903	1370418807	/nfs/dbraw/zinc/41/88/07/1370418807.db2.gz	ACVFVEARUCARAC-UHFFFAOYSA-N	0	3	330.447	3.195	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)NCC1(NCc2cc(C#N)ccc2F)CCCCC1	ZINC001115389323	1370425949	/nfs/dbraw/zinc/42/59/49/1370425949.db2.gz	OGAPIMCMAWTVCF-RHSMWYFYSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3ccc(F)c(Cl)c3)C2)C1=O	ZINC001204282518	1370430985	/nfs/dbraw/zinc/43/09/85/1370430985.db2.gz	URHKPWVWKLBMMU-SFHVURJKSA-N	0	3	336.838	3.480	20	30		EGEDHN
C=CCOc1ccc(CN2CC[C@@]3(C[C@H](OCC4CC4)CO3)C2)cc1	ZINC001204300387	1370436246	/nfs/dbraw/zinc/43/62/46/1370436246.db2.gz	QKDVGSANCPQSAH-LEWJYISDSA-N	0	3	343.467	3.411	20	30		EGEDHN
C=CCOc1ccc(CN2CC[C@]3(C[C@H](OCC4CC4)CO3)C2)cc1	ZINC001204300397	1370436570	/nfs/dbraw/zinc/43/65/70/1370436570.db2.gz	QKDVGSANCPQSAH-SFTDATJTSA-N	0	3	343.467	3.411	20	30		EGEDHN
C=CCCC(=O)NCC1(NCc2cc(CO)ccc2F)CCCCC1	ZINC001115442677	1370455255	/nfs/dbraw/zinc/45/52/55/1370455255.db2.gz	KYJFUTWNVKTZBA-UHFFFAOYSA-N	0	3	348.462	3.193	20	30		EGEDHN
N#Cc1ccccc1CN1CCCC2(CCN(c3ncccn3)CC2)C1	ZINC001204367686	1370455440	/nfs/dbraw/zinc/45/54/40/1370455440.db2.gz	PAKNSAPZDLTBML-UHFFFAOYSA-N	0	3	347.466	3.231	20	30		EGEDHN
C[C@H](C#N)C(=O)NCC1(NCc2cccc(F)c2F)CCCCC1	ZINC001115451931	1370459443	/nfs/dbraw/zinc/45/94/43/1370459443.db2.gz	LBHGNEYJQJGLDM-CYBMUJFWSA-N	0	3	335.398	3.033	20	30		EGEDHN
C=C[C@@](C)(O)CC(=O)NCC1(NCC=C(Cl)Cl)CCCCC1	ZINC001115508771	1370507751	/nfs/dbraw/zinc/50/77/51/1370507751.db2.gz	BOPIENQDPOCNAL-OAHLLOKOSA-N	0	3	349.302	3.041	20	30		EGEDHN
Cc1cc(C#N)c(F)cc1Nc1cccc(CN2CCN(C)CC2)c1	ZINC001204574914	1370520795	/nfs/dbraw/zinc/52/07/95/1370520795.db2.gz	SCNZWTHHTVGLCD-UHFFFAOYSA-N	0	3	338.430	3.497	20	30		EGEDHN
CN1CCN(Cc2ccc(Nc3c(F)cc(C#N)cc3F)cc2)CC1	ZINC001204751208	1370564880	/nfs/dbraw/zinc/56/48/80/1370564880.db2.gz	MFAGBAWOGSSDIU-UHFFFAOYSA-N	0	3	342.393	3.327	20	30		EGEDHN
C#CCCCCC(=O)N1CCC(CNC/C(Cl)=C/Cl)CC1	ZINC001205027777	1370633514	/nfs/dbraw/zinc/63/35/14/1370633514.db2.gz	ZPZQXXHMSCAQPR-PTNGSMBKSA-N	0	3	331.287	3.327	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCC1(NCc2cnc(C)nc2)CCCCC1	ZINC001115685232	1370668935	/nfs/dbraw/zinc/66/89/35/1370668935.db2.gz	YUKVRIXVPYGDQL-MRXNPFEDSA-N	0	3	344.503	3.296	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CCC(CNC/C(Cl)=C/Cl)CC1	ZINC001205236121	1370690447	/nfs/dbraw/zinc/69/04/47/1370690447.db2.gz	NJQHFFSXZAXFEM-UVTDQMKNSA-N	0	3	331.287	3.183	20	30		EGEDHN
CC(F)(F)CC(=O)NCC1(NCC#Cc2ccccc2)CCCCC1	ZINC001115715721	1370695521	/nfs/dbraw/zinc/69/55/21/1370695521.db2.gz	TVUAIHAXVRHYQK-UHFFFAOYSA-N	0	3	348.437	3.492	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C[C@@H](C)C(C)C)C[C@H]1c1cccc(F)c1	ZINC001205386494	1370738541	/nfs/dbraw/zinc/73/85/41/1370738541.db2.gz	SBXCUUVOWDSTAY-AYOQOUSVSA-N	0	3	330.447	3.025	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C[C@H](C)C(C)C)C[C@H]1c1cccc(F)c1	ZINC001205387396	1370739375	/nfs/dbraw/zinc/73/93/75/1370739375.db2.gz	AYAOTFUNPVALOK-FFZOFVMBSA-N	0	3	344.474	3.415	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC(CNCc2nc(C)c(C)s2)CC1	ZINC001205404873	1370745706	/nfs/dbraw/zinc/74/57/06/1370745706.db2.gz	RRNHKVHNEXANAM-UHFFFAOYSA-N	0	3	335.517	3.444	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC(CNCc2ccncc2Cl)CC1	ZINC001205404785	1370746209	/nfs/dbraw/zinc/74/62/09/1370746209.db2.gz	NKPSJVVZIPXMIA-UHFFFAOYSA-N	0	3	335.879	3.420	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)CC[C@@H](C)CC)C[C@H]1c1cccc(F)c1	ZINC001205446263	1370758076	/nfs/dbraw/zinc/75/80/76/1370758076.db2.gz	YNRVADRZMIMXPW-ZYSHUDEJSA-N	0	3	330.447	3.169	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@H](CC)CC(C)C)[C@@H]3COC[C@@H]32)CC1	ZINC001205516588	1370778214	/nfs/dbraw/zinc/77/82/14/1370778214.db2.gz	MCCNNSUHQTYRKO-CEXWTWQISA-N	0	3	348.531	3.184	20	30		EGEDHN
Cc1ccc(CN2CCCN(c3nc4c(cc3C#N)CCC4)CC2)cc1	ZINC001115858990	1370798111	/nfs/dbraw/zinc/79/81/11/1370798111.db2.gz	JRNYMAPXGKETFW-UHFFFAOYSA-N	0	3	346.478	3.463	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CN([C@H](C)c2cccc(OC)c2)C[C@H]1C	ZINC001206886941	1371208131	/nfs/dbraw/zinc/20/81/31/1371208131.db2.gz	OIZPVRZMOIUVJZ-MBOZVWFJSA-N	0	3	342.483	3.386	20	30		EGEDHN
O=C(c1cccs1)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207136305	1371305997	/nfs/dbraw/zinc/30/59/97/1371305997.db2.gz	QQJYMPQFPOYVFA-QGZVFWFLSA-N	0	3	342.439	3.133	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CN(CCOc2ccccc2C)C[C@H]1C	ZINC001207172078	1371318967	/nfs/dbraw/zinc/31/89/67/1371318967.db2.gz	ONUPNWUNPGXJEQ-QZTJIDSGSA-N	0	3	344.499	3.413	20	30		EGEDHN
N#Cc1ccc(N2CCN(C[C@@H]3CCOc4ccccc43)CC2)cc1	ZINC001207175293	1371322236	/nfs/dbraw/zinc/32/22/36/1371322236.db2.gz	SQJUVCODAKUQSM-SFHVURJKSA-N	0	3	333.435	3.247	20	30		EGEDHN
C=CCN(CC=C)C[C@@H]1C[C@H](CC(=O)OC(C)(C)C)OC(C)(C)O1	ZINC001207388092	1371381875	/nfs/dbraw/zinc/38/18/75/1371381875.db2.gz	FOEYWGGUKQEKOY-CVEARBPZSA-N	0	3	339.476	3.302	20	30		EGEDHN
C=CCOC[C@H]1CCC[C@@]12CN(CCc1ccc(OC)cc1)CCO2	ZINC001207475451	1371406257	/nfs/dbraw/zinc/40/62/57/1371406257.db2.gz	BWVWVDZJSZVASN-TZIWHRDSSA-N	0	3	345.483	3.311	20	30		EGEDHN
CC/C=C(/C)C(=O)N1CCC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001207567372	1371438262	/nfs/dbraw/zinc/43/82/62/1371438262.db2.gz	ZHIVFNYCFQVGEC-OTMHGDBASA-N	0	3	329.419	3.134	20	30		EGEDHN
CC(C)[C@@H](C)CC(=O)N1CCC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001207646363	1371462710	/nfs/dbraw/zinc/46/27/10/1371462710.db2.gz	SPCUWORJOITGTL-MAUKXSAKSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)COC(C)(C)C)C1	ZINC001120362371	1371548036	/nfs/dbraw/zinc/54/80/36/1371548036.db2.gz	FHJICTXMGLMANP-HZPDHXFCSA-N	0	3	342.911	3.257	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC[C@H]([C@@H]2CCCN2Cc2cncs2)C1	ZINC001120382553	1371555862	/nfs/dbraw/zinc/55/58/62/1371555862.db2.gz	PTCHSDUFWGXROG-WMZOPIPTSA-N	0	3	345.512	3.006	20	30		EGEDHN
CC[C@H](CC(F)F)C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001208321922	1371717545	/nfs/dbraw/zinc/71/75/45/1371717545.db2.gz	NWJYANQYLBIWCI-MSOLQXFVSA-N	0	3	348.437	3.300	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CN(CCOc2ccc(C)cc2)C[C@H]1C	ZINC001208391666	1371749872	/nfs/dbraw/zinc/74/98/72/1371749872.db2.gz	SLIGAJYOPOMKJV-QWFCFKBJSA-N	0	3	344.499	3.413	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1)C(C)(C)C	ZINC001208424461	1371762797	/nfs/dbraw/zinc/76/27/97/1371762797.db2.gz	ZFMIDWHWXMRBNK-HKUYNNGSSA-N	0	3	326.484	3.301	20	30		EGEDHN
CC(F)(F)CCC(=O)N1CCC[C@@H](NCc2ccc(C#N)s2)C1	ZINC001208443284	1371768309	/nfs/dbraw/zinc/76/83/09/1371768309.db2.gz	BEDPMMUHNOFHEP-GFCCVEGCSA-N	0	3	341.427	3.136	20	30		EGEDHN
N#Cc1ccccc1CNC1CC2(C1)CC(NC(=O)/C=C\C1CC1)C2	ZINC001120907216	1371802765	/nfs/dbraw/zinc/80/27/65/1371802765.db2.gz	GPYUFBYJECCSPI-FPLPWBNLSA-N	0	3	335.451	3.041	20	30		EGEDHN
CC(C)C#CC(=O)NC1CC2(CC(NCc3cccc(F)c3F)C2)C1	ZINC001121077500	1371849617	/nfs/dbraw/zinc/84/96/17/1371849617.db2.gz	SPMRPCBTGMXIJZ-UHFFFAOYSA-N	0	3	346.421	3.141	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CN(Cc2cccc(N(C)C)c2)C[C@H]1C	ZINC001208963189	1371963357	/nfs/dbraw/zinc/96/33/57/1371963357.db2.gz	HVXMSMOLCDLEGE-VQIMIIECSA-N	0	3	343.515	3.291	20	30		EGEDHN
C=CCN(CCN1CCC[C@@H]1c1ccc(OC)cc1)C(=O)OCC	ZINC001209022255	1371976466	/nfs/dbraw/zinc/97/64/66/1371976466.db2.gz	SXDRZHYWCPXZSQ-GOSISDBHSA-N	0	3	332.444	3.477	20	30		EGEDHN
CC(C)[C@H](F)C(=O)NC1CC2(CC(NCc3ccccc3C#N)C2)C1	ZINC001121588439	1372017992	/nfs/dbraw/zinc/01/79/92/1372017992.db2.gz	RQEJKRSPDSIGLP-WZXTXQKWSA-N	0	3	343.446	3.069	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NC1CC2(CC(NCc3conc3CC)C2)C1	ZINC001121610726	1372023972	/nfs/dbraw/zinc/02/39/72/1372023972.db2.gz	MEWRALSDFMMAPL-BJHGUXOKSA-N	0	3	345.487	3.212	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)C1(C(F)F)CCC1)C2	ZINC001121638070	1372032211	/nfs/dbraw/zinc/03/22/11/1372032211.db2.gz	DWVSFLNLCQCHJY-UHFFFAOYSA-N	0	3	332.822	3.191	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC1CC2(CC(NCc3conc3CC)C2)C1	ZINC001121713764	1372056074	/nfs/dbraw/zinc/05/60/74/1372056074.db2.gz	NTHMKQFUTVSAAQ-PUFPBPQXSA-N	0	3	345.487	3.356	20	30		EGEDHN
CCOC(=O)CCCCCCN1CCN(c2ccc(C#N)cc2)CC1	ZINC001209350143	1372074477	/nfs/dbraw/zinc/07/44/77/1372074477.db2.gz	CZCYIFZSYUGMJY-UHFFFAOYSA-N	0	3	343.471	3.194	20	30		EGEDHN
C=CCCCCCN1CCO[C@H]2[C@H](OCC3CCOCC3)CC[C@@H]21	ZINC001209423028	1372102006	/nfs/dbraw/zinc/10/20/06/1372102006.db2.gz	MMXDLHKDMUHUIT-XUVXKRRUSA-N	0	3	337.504	3.408	20	30		EGEDHN
C=CCCCCCCN1CC[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C1	ZINC001209436532	1372106202	/nfs/dbraw/zinc/10/62/02/1372106202.db2.gz	UCSGUFZXYZGOOU-HZPDHXFCSA-N	0	3	326.481	3.083	20	30		EGEDHN
C=CCCCCCCCCN1CCN(c2ncccc2C(N)=O)CC1	ZINC001209445787	1372108223	/nfs/dbraw/zinc/10/82/23/1372108223.db2.gz	NPSPFBFZWPDZGR-UHFFFAOYSA-N	0	3	344.503	3.219	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC[C@@H](NCc3scnc3C)C2)CC1	ZINC001209493210	1372120347	/nfs/dbraw/zinc/12/03/47/1372120347.db2.gz	KOWNQJRCGYSAAD-OAHLLOKOSA-N	0	3	333.501	3.279	20	30		EGEDHN
COc1cc(CN2CCC3SC(=O)C=C3C2)c(F)cc1Cl	ZINC001209666336	1372165613	/nfs/dbraw/zinc/16/56/13/1372165613.db2.gz	TUCIVCPKRXUYMN-AWEZNQCLSA-N	0	3	327.808	3.262	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)COCCCCCC)C2	ZINC001122117945	1372179034	/nfs/dbraw/zinc/17/90/34/1372179034.db2.gz	HKYVHLPJCGPMGX-UHFFFAOYSA-N	0	3	342.911	3.353	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N[C@@H]1C[C@@H](c2ccccc2)Oc2ccccc21	ZINC001122227958	1372206473	/nfs/dbraw/zinc/20/64/73/1372206473.db2.gz	STCMDQMMORZXCL-NSHGMRRFSA-N	0	3	349.434	3.389	20	30		EGEDHN
N#Cc1ccc(C2CCN(C(=O)[C@H]3CNCc4ccccc43)CC2)cc1	ZINC001122278692	1372219712	/nfs/dbraw/zinc/21/97/12/1372219712.db2.gz	XKXWQGXVOKEYCT-NRFANRHFSA-N	0	3	345.446	3.151	20	30		EGEDHN
O=C(C(C1CC1)C1CC1)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001210552619	1372376934	/nfs/dbraw/zinc/37/69/34/1372376934.db2.gz	MFYMEMBMEGURCS-HXUWFJFHSA-N	0	3	336.479	3.055	20	30		EGEDHN
CCN1CCN(Cc2ccc(NC3=CC(=O)C[C@@H](C)C3)cc2)CC1	ZINC001210775795	1372424634	/nfs/dbraw/zinc/42/46/34/1372424634.db2.gz	MBNBCCVZGVYRGU-INIZCTEOSA-N	0	3	327.472	3.119	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)CCCOc2ccc(C)cc2)C1	ZINC001210800879	1372429772	/nfs/dbraw/zinc/42/97/72/1372429772.db2.gz	FPRHIGCXTPBMFP-IEBWSBKVSA-N	0	3	330.472	3.167	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)Cc1ccc(C)c(Br)c1	ZINC001123337716	1372431438	/nfs/dbraw/zinc/43/14/38/1372431438.db2.gz	TUTQMEDFWUDUDV-ZDUSSCGKSA-N	0	3	346.228	3.393	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2ccc(OCCCC)cc2)C1	ZINC001210979066	1372465521	/nfs/dbraw/zinc/46/55/21/1372465521.db2.gz	CHMWAFGPGSUPRY-VQIMIIECSA-N	0	3	330.472	3.492	20	30		EGEDHN
C=CC[C@H](C(=O)N[C@@H]1CN(CCOC(C)C)C[C@H]1C)c1ccccc1	ZINC001211200242	1372499979	/nfs/dbraw/zinc/49/99/79/1372499979.db2.gz	PZYJAKXCHZFLFZ-YZGWKJHDSA-N	0	3	344.499	3.208	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NCCNCc1cc(Cl)cc(Cl)c1	ZINC001124488893	1372706552	/nfs/dbraw/zinc/70/65/52/1372706552.db2.gz	VXQRXTLHOVJSRK-GFCCVEGCSA-N	0	3	345.270	3.180	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@@H]2CCCC23CC3)[C@H](OC)C1	ZINC001212454647	1372709145	/nfs/dbraw/zinc/70/91/45/1372709145.db2.gz	AJOPMUDAEBPVHA-RCCFBDPRSA-N	0	3	336.520	3.353	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2[nH]c(C)cc2C)[C@H](OC)C1	ZINC001212465505	1372710439	/nfs/dbraw/zinc/71/04/39/1372710439.db2.gz	KLWDEXLOCRYYRS-IAGOWNOFSA-N	0	3	335.492	3.031	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H]2CN(CCOCCCC)C[C@H]21	ZINC001188033696	1388222625	/nfs/dbraw/zinc/22/26/25/1388222625.db2.gz	NACBBYUAOPXXMC-RBUKOAKNSA-N	0	3	334.504	3.104	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CN(Cc2c(C)cccc2C)C[C@H]1OC	ZINC001213258416	1372868998	/nfs/dbraw/zinc/86/89/98/1372868998.db2.gz	PHUSPGVUGHASJK-RTBURBONSA-N	0	3	344.499	3.221	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1CN(CCCc2ccccc2)C[C@H]1OC	ZINC001213380024	1372896893	/nfs/dbraw/zinc/89/68/93/1372896893.db2.gz	IZQGUXSKKLUGBI-SFHLNBCPSA-N	0	3	344.499	3.037	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CCCC3CCC3)C[C@H]2OC)CCC1	ZINC001213397235	1372900565	/nfs/dbraw/zinc/90/05/65/1372900565.db2.gz	CUXSBVCOOPHYBB-QZTJIDSGSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@@H](C)Cc2ccco2)[C@H](OC)C1	ZINC001213569397	1372928053	/nfs/dbraw/zinc/92/80/53/1372928053.db2.gz	KXKOTVWIIFWAGH-QXAKKESOSA-N	0	3	348.487	3.020	20	30		EGEDHN
CN(C)Cc1ccc(-c2noc(-c3ccc(C#N)c(Cl)n3)n2)cc1	ZINC001213768328	1372958477	/nfs/dbraw/zinc/95/84/77/1372958477.db2.gz	BBCSHSLCHOWXGS-UHFFFAOYSA-N	0	3	339.786	3.385	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)Cc2ccccc2C)[C@H](OC)C1	ZINC001213833481	1372968760	/nfs/dbraw/zinc/96/87/60/1372968760.db2.gz	PVMDJPZRRQIOKE-WOJBJXKFSA-N	0	3	346.515	3.323	20	30		EGEDHN
C=CCC[C@@H](C(=O)N[C@@H]1CN(CCC=C)C[C@H]1OC)c1ccccc1	ZINC001214001986	1372993110	/nfs/dbraw/zinc/99/31/10/1372993110.db2.gz	QXRUTXBKVHLRFR-VAMGGRTRSA-N	0	3	342.483	3.128	20	30		EGEDHN
CCCCCC(=O)N1C[C@@H](C)[C@H](NCc2cc(C#N)ccc2OC)C1	ZINC001214148401	1373015787	/nfs/dbraw/zinc/01/57/87/1373015787.db2.gz	QJZXBPSWQICINH-CRAIPNDOSA-N	0	3	343.471	3.084	20	30		EGEDHN
CC[C@@H](C)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001214158614	1373016525	/nfs/dbraw/zinc/01/65/25/1373016525.db2.gz	PPDQJVFTWYTFGF-IIDMSEBBSA-N	0	3	332.875	3.174	20	30		EGEDHN
CC[C@H](C)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001214156445	1373016530	/nfs/dbraw/zinc/01/65/30/1373016530.db2.gz	STXODDLFLLJRLT-HDMKZQKVSA-N	0	3	332.875	3.174	20	30		EGEDHN
C[C@@H]1CN(C(=O)/C=C\C(C)(C)C)C[C@H]1NCc1ccc(C#N)s1	ZINC001214355769	1373048350	/nfs/dbraw/zinc/04/83/50/1373048350.db2.gz	HVVGCDJZDLTRNO-RDIZVCBXSA-N	0	3	331.485	3.159	20	30		EGEDHN
C=CCCOCCCCC(=O)NCCNCc1cccc(Cl)c1	ZINC001127124282	1373091420	/nfs/dbraw/zinc/09/14/20/1373091420.db2.gz	AVVHNRZMNBAZFK-UHFFFAOYSA-N	0	3	338.879	3.309	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2(C)CCC2)C[C@H]1NCC#Cc1cccc(Cl)c1	ZINC001215325055	1373198162	/nfs/dbraw/zinc/19/81/62/1373198162.db2.gz	YWORPTBHTJWKNX-CRAIPNDOSA-N	0	3	344.886	3.318	20	30		EGEDHN
CCCc1ccc(C(=O)NCCNCc2ccc(F)c(C#N)c2)s1	ZINC001128327573	1373252086	/nfs/dbraw/zinc/25/20/86/1373252086.db2.gz	JXJNMYUIXDKFNX-UHFFFAOYSA-N	0	3	345.443	3.231	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCC2(C)CC2)C[C@H]1NCc1ccc(C#N)s1	ZINC001216197283	1373278383	/nfs/dbraw/zinc/27/83/83/1373278383.db2.gz	OUAFHHHABQCKTI-CZUORRHYSA-N	0	3	331.485	3.137	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)C2(Cc3ccccc3)CCC2)cc1	ZINC001129640095	1373406938	/nfs/dbraw/zinc/40/69/38/1373406938.db2.gz	DZSBPPWSNZCZAG-UHFFFAOYSA-N	0	3	347.462	3.177	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)c3cccc(C)c3)[C@H]2C1	ZINC001217219209	1373408302	/nfs/dbraw/zinc/40/83/02/1373408302.db2.gz	KTDMLMZJQVJBKL-VQTJNVASSA-N	0	3	342.483	3.267	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)Cc3ccc(C)o3)[C@H]2C1	ZINC001217648842	1373482296	/nfs/dbraw/zinc/48/22/96/1373482296.db2.gz	DPJOWRXLOTWHCD-RBUKOAKNSA-N	0	3	348.487	3.013	20	30		EGEDHN
C=CCCC(=O)NCc1ccncc1O[C@H]1CCN(CC=C(C)C)C1	ZINC001130315287	1373490611	/nfs/dbraw/zinc/49/06/11/1373490611.db2.gz	QPOPCHBEDVCPMD-SFHVURJKSA-N	0	3	343.471	3.083	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)C(C)=C3CCC3)[C@H]2C1	ZINC001217834129	1373506240	/nfs/dbraw/zinc/50/62/40/1373506240.db2.gz	DJIPXONMGCNTTH-RBUKOAKNSA-N	0	3	334.504	3.369	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)C(C)(C)C(C)(C)C)C1	ZINC001130415899	1373528228	/nfs/dbraw/zinc/52/82/28/1373528228.db2.gz	RVNYMMXYPASLIL-CQSZACIVSA-N	0	3	332.492	3.074	20	30		EGEDHN
CCC[C@@H]1CCC[C@H]1C(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001130567336	1373560785	/nfs/dbraw/zinc/56/07/85/1373560785.db2.gz	UJDHMARHLMMXAH-NVXWUHKLSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)C[C@@H](C)CCCCC)C[C@H]1c1cn(C)cn1	ZINC001130687559	1373580340	/nfs/dbraw/zinc/58/03/40/1373580340.db2.gz	GAEBPGSYKLLXPL-JENIJYKNSA-N	0	3	346.519	3.097	20	30		EGEDHN
C=C[C@@H](C#CC(C)(C)C)Oc1nc2onc(C)c2c2c1CNCC2	ZINC001218414479	1373610308	/nfs/dbraw/zinc/61/03/08/1373610308.db2.gz	ZAZGAZWDQYUVSS-ZDUSSCGKSA-N	0	3	325.412	3.160	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCO[C@@H]2CN(CCC3CCCCC3)C[C@@H]21	ZINC001218516481	1373628154	/nfs/dbraw/zinc/62/81/54/1373628154.db2.gz	BUYSRSRIHRWDNR-YZGWKJHDSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)[C@H]3[C@@H]4CCCCCC[C@@H]43)[C@H]2C1	ZINC001218688338	1373643658	/nfs/dbraw/zinc/64/36/58/1373643658.db2.gz	CZBIUQXHNYIFRT-PXTPFGJHSA-N	0	3	346.515	3.081	20	30		EGEDHN
N#Cc1ccc(NC(=O)[C@@H](N)C2CCCCC2)c(OC(F)(F)F)c1	ZINC001218839586	1373659675	/nfs/dbraw/zinc/65/96/75/1373659675.db2.gz	GIZQYGMORCJHKC-AWEZNQCLSA-N	0	3	341.333	3.303	20	30		EGEDHN
N#Cc1cccc(C(F)(F)F)c1NC(=O)[C@@H](N)C1CCCCC1	ZINC001218953757	1373670611	/nfs/dbraw/zinc/67/06/11/1373670611.db2.gz	SQGQMATXDYMNOE-ZDUSSCGKSA-N	0	3	325.334	3.423	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)[C@H](C)CCC(C)(C)C)[C@H]2C1	ZINC001218977040	1373673851	/nfs/dbraw/zinc/67/38/51/1373673851.db2.gz	YCLGUHKKZHRMMO-FGTMMUONSA-N	0	3	336.520	3.327	20	30		EGEDHN
C=C[C@@H]1C[C@]1(N)C(=O)Nc1ccc(Cl)cc1C#C[Si](C)(C)C	ZINC001219482684	1373711634	/nfs/dbraw/zinc/71/16/34/1373711634.db2.gz	IAOMXGAVXKFVSY-CXAGYDPISA-N	0	3	332.907	3.411	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC([C@@H]2OCC[C@H]2NCC(=C)Cl)CC1	ZINC001131510520	1373713689	/nfs/dbraw/zinc/71/36/89/1373713689.db2.gz	NSAZXMTVNNONQS-AEFFLSMTSA-N	0	3	340.895	3.081	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)CN(C(=O)CCCCCC(C)C)C[C@@H](C)O2	ZINC001131688015	1373763298	/nfs/dbraw/zinc/76/32/98/1373763298.db2.gz	GNPUFDFWHGOLJG-TZIWHRDSSA-N	0	3	348.531	3.308	20	30		EGEDHN
Cc1ccc(C(=O)NCCNCc2cccc(C#N)c2)c(F)c1Cl	ZINC001131696180	1373767586	/nfs/dbraw/zinc/76/75/86/1373767586.db2.gz	MEVJNZQUSQEQOM-UHFFFAOYSA-N	0	3	345.805	3.179	20	30		EGEDHN
CC(C)(C)CC(=O)NCC1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001222387249	1373832792	/nfs/dbraw/zinc/83/27/92/1373832792.db2.gz	RACHGRWMHDMNFN-UHFFFAOYSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H]2CCN(CCc3ccns3)[C@H]2C1	ZINC001222775643	1373881222	/nfs/dbraw/zinc/88/12/22/1373881222.db2.gz	GITHSHYUOPGFEL-WBVHZDCISA-N	0	3	347.528	3.211	20	30		EGEDHN
COc1ccc(NC(=O)N2CCC3SC(=O)C=C3C2)cc1Cl	ZINC001188453410	1388311237	/nfs/dbraw/zinc/31/12/37/1388311237.db2.gz	ACTBWRAIFJMECX-CYBMUJFWSA-N	0	3	338.816	3.155	20	30		EGEDHN
CC[C@@H](C)CC(=O)NCC1(NCc2ccc(OC)c(C#N)c2)CCC1	ZINC001326809980	1388318499	/nfs/dbraw/zinc/31/84/99/1388318499.db2.gz	PAVRQZNMCVYMSG-OAHLLOKOSA-N	0	3	343.471	3.132	20	30		EGEDHN
C=CCOCCN1CC[C@@H]2CCN(C(=O)c3ccc(CC)s3)C[C@@H]21	ZINC001223063412	1375030522	/nfs/dbraw/zinc/03/05/22/1375030522.db2.gz	GVMPDFCFJVTGMZ-WBVHZDCISA-N	0	3	348.512	3.050	20	30		EGEDHN
C=CCOCC(=O)N[C@@H]1CC[C@@H](C)N(Cc2ccc(CCC)cc2)C1	ZINC001131946048	1375061700	/nfs/dbraw/zinc/06/17/00/1375061700.db2.gz	GAIYYRGDWPZWGX-YLJYHZDGSA-N	0	3	344.499	3.311	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CC[C@H](C)N(Cc2ccc(OC)c(C)c2)C1	ZINC001132003247	1375093536	/nfs/dbraw/zinc/09/35/36/1375093536.db2.gz	RTUWIBNQLXIFJZ-HKUYNNGSSA-N	0	3	342.483	3.276	20	30		EGEDHN
Cc1cc(CN2C[C@H](NC(=O)C#CC(C)C)CC[C@@H]2C)c(C)s1	ZINC001132025845	1375105832	/nfs/dbraw/zinc/10/58/32/1375105832.db2.gz	WLPVSHRXVKINFO-KBXCAEBGSA-N	0	3	332.513	3.493	20	30		EGEDHN
C[C@H]1CC[C@@H](NC(=O)C#CC2CC2)CN1Cc1cccc2cccnc21	ZINC001132047404	1375115590	/nfs/dbraw/zinc/11/55/90/1375115590.db2.gz	XBHQRCUQZZZMGM-OXJNMPFZSA-N	0	3	347.462	3.117	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2ccc3occc3c2)CC[C@@H]1C	ZINC001132051197	1375118884	/nfs/dbraw/zinc/11/88/84/1375118884.db2.gz	YUSVRCHOWIGTDQ-MAUKXSAKSA-N	0	3	342.439	3.218	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1CC[C@@H](C)N(CCOC2CCC2)C1	ZINC001132057309	1375123061	/nfs/dbraw/zinc/12/30/61/1375123061.db2.gz	NAJPWFAOMIDZTB-AEFFLSMTSA-N	0	3	334.504	3.293	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCc2ncc(C(C)(C)C)o2)CC[C@@H]1C	ZINC001132117046	1375156835	/nfs/dbraw/zinc/15/68/35/1375156835.db2.gz	ZIWDRDWBVSWNNA-GJZGRUSLSA-N	0	3	333.476	3.060	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCc2cccc(OC)c2)CC[C@H]1C	ZINC001132168975	1375183933	/nfs/dbraw/zinc/18/39/33/1375183933.db2.gz	ITIWUBGOCZUAGH-AEFFLSMTSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCc2ccc(OC)c(F)c2)CC[C@H]1C	ZINC001132168948	1375184141	/nfs/dbraw/zinc/18/41/41/1375184141.db2.gz	HQYOUIAMHDDWIP-NVXWUHKLSA-N	0	3	348.462	3.312	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1	ZINC001226134042	1375209000	/nfs/dbraw/zinc/20/90/00/1375209000.db2.gz	PDCZRUCMPFHGFE-WOJBJXKFSA-N	0	3	336.479	3.105	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@@H]1CCCC[C@H]1NCC=C(Cl)Cl	ZINC001226143230	1375210243	/nfs/dbraw/zinc/21/02/43/1375210243.db2.gz	GGEJQQILVJFBFF-CHWSQXEVSA-N	0	3	331.287	3.372	20	30		EGEDHN
CC#CCCCC(=O)N[C@H]1CC[C@@H](C)N(CCOc2ccccc2)C1	ZINC001132223377	1375220306	/nfs/dbraw/zinc/22/03/06/1375220306.db2.gz	CLZQBGZCHZPEFL-MOPGFXCFSA-N	0	3	342.483	3.228	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1CC[C@@H](C)N(CCOCc2ccccc2)C1	ZINC001132228181	1375224075	/nfs/dbraw/zinc/22/40/75/1375224075.db2.gz	NKMCVYGPYZBEBT-MJGOQNOKSA-N	0	3	344.499	3.385	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1CC[C@@H](C)N(CCn2nc(C)cc2C)C1	ZINC001132332533	1375312916	/nfs/dbraw/zinc/31/29/16/1375312916.db2.gz	VJNQRAIILDPHDN-AEFFLSMTSA-N	0	3	346.519	3.071	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2c[nH]c(C)cc2=O)CC[C@H]1C	ZINC001132403373	1375355882	/nfs/dbraw/zinc/35/58/82/1375355882.db2.gz	VZHXFYBWYNDALX-SJORKVTESA-N	0	3	345.487	3.012	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)NC1CCN(Cc2ccc(C(C)C)cc2)CC1	ZINC001227124185	1375393825	/nfs/dbraw/zinc/39/38/25/1375393825.db2.gz	OOEVURANIMSHKZ-NRFANRHFSA-N	0	3	344.499	3.218	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COc2ccc(OCC)cc2)CC[C@@H]1C	ZINC001132460205	1375403361	/nfs/dbraw/zinc/40/33/61/1375403361.db2.gz	HGOJISLKDWSKAJ-DLBZAZTESA-N	0	3	346.471	3.009	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCc2ccc(OC)cc2)CC[C@@H]1C	ZINC001132464557	1375407666	/nfs/dbraw/zinc/40/76/66/1375407666.db2.gz	VXVQFURDZTYSFT-WMZOPIPTSA-N	0	3	330.472	3.173	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)COc2ccccc2C(C)C)CC[C@H]1C	ZINC001132469881	1375411277	/nfs/dbraw/zinc/41/12/77/1375411277.db2.gz	YHFBVEVTZQHZIZ-MSOLQXFVSA-N	0	3	342.483	3.181	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@@H]1Oc1ccc([N+](=O)[O-])cc1C#N	ZINC001227311069	1375418773	/nfs/dbraw/zinc/41/87/73/1375418773.db2.gz	BYNQBHGXPZLHNG-LIRRHRJNSA-N	0	3	337.379	3.366	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCc2cc(F)ccc2F)CC[C@@H]1C	ZINC001132524834	1375440492	/nfs/dbraw/zinc/44/04/92/1375440492.db2.gz	MMMBZVQNDORPNT-YOEHRIQHSA-N	0	3	336.426	3.443	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2CC[C@H](C)N(CCOCC=C)C2)CCCCC1	ZINC001132529623	1375444037	/nfs/dbraw/zinc/44/40/37/1375444037.db2.gz	PCNKKXKBQDXTRL-RBUKOAKNSA-N	0	3	346.515	3.132	20	30		EGEDHN
C=C(C)CCC(=O)NC1CCN(CCOc2ccc(C)cc2)CC1	ZINC001227607537	1375452679	/nfs/dbraw/zinc/45/26/79/1375452679.db2.gz	UBPVLEHEKITNOI-UHFFFAOYSA-N	0	3	330.472	3.311	20	30		EGEDHN
CC#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)[C@H](F)CC)CC1	ZINC001132555179	1375461869	/nfs/dbraw/zinc/46/18/69/1375461869.db2.gz	QYPYZMWJSMYWFQ-RBUKOAKNSA-N	0	3	345.462	3.036	20	30		EGEDHN
CC#CCN1CC[C@H](CN(Cc2scnc2C)C(=O)[C@H](C)CC)C1	ZINC001132559077	1375466445	/nfs/dbraw/zinc/46/64/45/1375466445.db2.gz	SNVMPAWEGQOCFY-WBVHZDCISA-N	0	3	347.528	3.171	20	30		EGEDHN
N#Cc1ccc2c(cccc2O[C@H]2CC[C@@H](N3CCOCC3)CC2)n1	ZINC001227799033	1375477393	/nfs/dbraw/zinc/47/73/93/1375477393.db2.gz	DPONHOVBAKEVPX-CALCHBBNSA-N	0	3	337.423	3.129	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CCCC[C@H]1NCc1cccc(OC)n1	ZINC001227917334	1375490620	/nfs/dbraw/zinc/49/06/20/1375490620.db2.gz	SFXUNPVMKDBRRY-IAGOWNOFSA-N	0	3	345.487	3.210	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)C[C@H](C)C(F)(F)F	ZINC001228334552	1375550136	/nfs/dbraw/zinc/55/01/36/1375550136.db2.gz	OSODPJBGQBYZAE-MVWJERBFSA-N	0	3	326.790	3.344	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](C)[C@H](CNCc2nc(C)c(C)s2)C1	ZINC001132785767	1375564115	/nfs/dbraw/zinc/56/41/15/1375564115.db2.gz	LDWYBSQURYOKKK-RHSMWYFYSA-N	0	3	347.528	3.138	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](C)[C@@H](CNCc2ocnc2C)C1	ZINC001132843010	1375594557	/nfs/dbraw/zinc/59/45/57/1375594557.db2.gz	GXKPMHPIZQPGNV-YJBOKZPZSA-N	0	3	345.487	3.326	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CCN(CCOc2cc(C)ccc2C)CC1	ZINC001228631839	1375621819	/nfs/dbraw/zinc/62/18/19/1375621819.db2.gz	WHIPQQCDRNXHSB-UHFFFAOYSA-N	0	3	344.499	3.475	20	30		EGEDHN
CC#CCCCC(=O)NC1CCN(C[C@@H](OC)c2ccccc2)CC1	ZINC001228770307	1375670936	/nfs/dbraw/zinc/67/09/36/1375670936.db2.gz	HNBJUUPHNOCZBQ-HXUWFJFHSA-N	0	3	342.483	3.148	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC1CCN(C[C@H](O)c2ccc(F)cc2)CC1	ZINC001228810355	1375685250	/nfs/dbraw/zinc/68/52/50/1375685250.db2.gz	TXNCMUUAZYYDIA-BEFAXECRSA-N	0	3	348.462	3.042	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](C)[C@H](CNCc2nc(C)cs2)C1	ZINC001133069893	1375756811	/nfs/dbraw/zinc/75/68/11/1375756811.db2.gz	YYXPYLQTMDOOJT-NVXWUHKLSA-N	0	3	347.528	3.219	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](C)[C@H](CNCc3cnc(C)o3)C2)CC1	ZINC001133104721	1375777700	/nfs/dbraw/zinc/77/77/00/1375777700.db2.gz	JBSXZROMDGDGJB-NVXWUHKLSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](C)[C@@H](CNCc3ocnc3C)C2)CCC1	ZINC001133105317	1375778296	/nfs/dbraw/zinc/77/82/96/1375778296.db2.gz	SBXMTWBSTJBDBB-WBVHZDCISA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](C)[C@@H](CNCc3cscn3)C2)CCC1	ZINC001133105764	1375778332	/nfs/dbraw/zinc/77/83/32/1375778332.db2.gz	XIIAYSBPBNTLSQ-CVEARBPZSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@H]2CN(Cc3cccc(OC)c3)C[C@H]21	ZINC001188883882	1388399851	/nfs/dbraw/zinc/39/98/51/1388399851.db2.gz	ASSVKYDTBHFZDV-XKGZKEIXSA-N	0	3	342.483	3.330	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](C)[C@H](CNCc2cscn2)C1	ZINC001133143707	1375805531	/nfs/dbraw/zinc/80/55/31/1375805531.db2.gz	WTQJXVLKTPQXIM-HUUCEWRRSA-N	0	3	335.517	3.320	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)CCCc1cccnc1	ZINC001229364612	1375819400	/nfs/dbraw/zinc/81/94/00/1375819400.db2.gz	PQQIHWIVDXJPES-IAGOWNOFSA-N	0	3	335.879	3.174	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)CCc1scnc1C	ZINC001229466204	1375841654	/nfs/dbraw/zinc/84/16/54/1375841654.db2.gz	VHJSGEJEHAPXBB-ZIAGYGMSSA-N	0	3	341.908	3.154	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)CC[C@H](C)c2ccccc2)CC1	ZINC001229476723	1375842815	/nfs/dbraw/zinc/84/28/15/1375842815.db2.gz	NQQBQYGZNGGYKX-SFHVURJKSA-N	0	3	344.499	3.354	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)Cc1cccs1	ZINC001133377307	1375957673	/nfs/dbraw/zinc/95/76/73/1375957673.db2.gz	QRKBPXPDMBGSRS-UHFFFAOYSA-N	0	3	346.883	3.196	20	30		EGEDHN
C[C@@H](C#N)C(=O)N(CCNC/C=C\Cl)Cc1cccc(Cl)c1	ZINC001133392639	1375976894	/nfs/dbraw/zinc/97/68/94/1375976894.db2.gz	HCLIITHSQGEMGY-RJNRQISESA-N	0	3	340.254	3.170	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@](C)(C=C)CC	ZINC001133403648	1375987809	/nfs/dbraw/zinc/98/78/09/1375987809.db2.gz	CCYQKJLFFCGAGE-LJQANCHMSA-N	0	3	332.875	3.494	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)C(=O)NC1CCN(CCOCC)CC1	ZINC001230321628	1375995640	/nfs/dbraw/zinc/99/56/40/1375995640.db2.gz	OTJOICNJAVNFHX-LJQANCHMSA-N	0	3	344.499	3.039	20	30		EGEDHN
C#CCC1(C(=O)NC2CCN(CCOCC(C)C)CC2)CCCCC1	ZINC001230404186	1376021222	/nfs/dbraw/zinc/02/12/22/1376021222.db2.gz	DSABJOKRSZVUEJ-UHFFFAOYSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1C1CCN(C(=O)CO[C@@H](C)CC)CC1	ZINC001230547953	1376068203	/nfs/dbraw/zinc/06/82/03/1376068203.db2.gz	DEMYZVWZMBUYMZ-DOTOQJQBSA-N	0	3	342.911	3.257	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1C1CCN(C(=O)C(C)(C)COC)CC1	ZINC001230581088	1376082248	/nfs/dbraw/zinc/08/22/48/1376082248.db2.gz	VHPNZFBDBQYJPU-INIZCTEOSA-N	0	3	342.911	3.115	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)c1cccs1)NCc1ccccc1C#N	ZINC001133576499	1376101846	/nfs/dbraw/zinc/10/18/46/1376101846.db2.gz	HWIHDLXJQYRUKI-KBPBESRZSA-N	0	3	327.453	3.306	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H](C)C[C@H](C)NCc2ccccc2C#N)o1	ZINC001133653622	1376139551	/nfs/dbraw/zinc/13/95/51/1376139551.db2.gz	TWBBAYIQFYXOLT-KBPBESRZSA-N	0	3	325.412	3.146	20	30		EGEDHN
C#Cc1cccc(CN(C)[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)c1	ZINC001231658372	1376297863	/nfs/dbraw/zinc/29/78/63/1376297863.db2.gz	VBFLGFFUCDZSFA-GOSISDBHSA-N	0	3	328.456	3.499	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)/C=C/C1CC1)NCc1cc(F)ccc1C#N	ZINC001134009869	1376311474	/nfs/dbraw/zinc/31/14/74/1376311474.db2.gz	YRHDJDGNPVBRSK-QLNSKBQOSA-N	0	3	329.419	3.036	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)CCc1ccoc1)NCc1ccccc1C#N	ZINC001134057220	1376336677	/nfs/dbraw/zinc/33/66/77/1376336677.db2.gz	WOYCXBSHIIMYAD-HZPDHXFCSA-N	0	3	339.439	3.157	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](C)C[C@H](C)NCc2ccccc2C#N)oc1C	ZINC001134089310	1376362304	/nfs/dbraw/zinc/36/23/04/1376362304.db2.gz	DGTWILREOGSIQZ-LSDHHAIUSA-N	0	3	339.439	3.455	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)C=C1CCC1)NCc1cc(F)ccc1C#N	ZINC001134113775	1376374253	/nfs/dbraw/zinc/37/42/53/1376374253.db2.gz	FQEBAERWCJAHOS-KBPBESRZSA-N	0	3	329.419	3.181	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)c1ccoc1Cl)NCc1ccccc1C#N	ZINC001134252714	1376437262	/nfs/dbraw/zinc/43/72/62/1376437262.db2.gz	UEBHWEDLLADEKO-OLZOCXBDSA-N	0	3	345.830	3.491	20	30		EGEDHN
CCCc1nc(C)c(CN[C@@H](C)C[C@H](C)NC(=O)C#CC(C)(C)C)o1	ZINC001134328544	1376478079	/nfs/dbraw/zinc/47/80/79/1376478079.db2.gz	DESYKDJWVDOCNU-GJZGRUSLSA-N	0	3	347.503	3.358	20	30		EGEDHN
CCCc1nc(C)c(CN[C@H](C)C[C@@H](C)NC(=O)C#CC(C)(C)C)o1	ZINC001134328545	1376478047	/nfs/dbraw/zinc/47/80/47/1376478047.db2.gz	DESYKDJWVDOCNU-HUUCEWRRSA-N	0	3	347.503	3.358	20	30		EGEDHN
N#Cc1ccc([O-])c(C[N@@H+]2CC[C@]3(CCN(Cc4ccccc4)C3)C2)c1	ZINC001232678928	1376500577	/nfs/dbraw/zinc/50/05/77/1376500577.db2.gz	VDTGZWKGTDDTJD-QFIPXVFZSA-N	0	3	347.462	3.362	20	30		EGEDHN
N#Cc1ccc([O-])c(C[N@H+]2CC[C@]3(CCN(Cc4ccccc4)C3)C2)c1	ZINC001232678928	1376500581	/nfs/dbraw/zinc/50/05/81/1376500581.db2.gz	VDTGZWKGTDDTJD-QFIPXVFZSA-N	0	3	347.462	3.362	20	30		EGEDHN
N#Cc1ccc([O-])c(CN2CC[C@]3(CC[N@H+](Cc4ccccc4)C3)C2)c1	ZINC001232678928	1376500584	/nfs/dbraw/zinc/50/05/84/1376500584.db2.gz	VDTGZWKGTDDTJD-QFIPXVFZSA-N	0	3	347.462	3.362	20	30		EGEDHN
N#Cc1ccc([O-])c(CN2CC[C@]3(CC[N@@H+](Cc4ccccc4)C3)C2)c1	ZINC001232678928	1376500595	/nfs/dbraw/zinc/50/05/95/1376500595.db2.gz	VDTGZWKGTDDTJD-QFIPXVFZSA-N	0	3	347.462	3.362	20	30		EGEDHN
C=CCO[C@H]1CO[C@]2(C1)CCCN(Cc1ccc(C#N)cc1C)C2	ZINC001233081197	1376566720	/nfs/dbraw/zinc/56/67/20/1376566720.db2.gz	SIAFSAXBTOHHGN-UXHICEINSA-N	0	3	326.440	3.193	20	30		EGEDHN
C=CCN1C(=O)CCC[C@]12CCCN(Cc1cnc(C)c(C)c1)C2	ZINC001233159564	1376577292	/nfs/dbraw/zinc/57/72/92/1376577292.db2.gz	XUDCRUJICWTCQX-HXUWFJFHSA-N	0	3	327.472	3.232	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2cc(C3CC3)no2)CCC1	ZINC001134566497	1376598548	/nfs/dbraw/zinc/59/85/48/1376598548.db2.gz	FWIMTGBDSNMSOW-GJZGRUSLSA-N	0	3	343.471	3.119	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2ncc(C)s2)CCC1	ZINC001134594183	1376617147	/nfs/dbraw/zinc/61/71/47/1376617147.db2.gz	YBASVZNXTUPOPV-KGLIPLIRSA-N	0	3	333.501	3.018	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H](C)C[C@@H](C)NC/C(Cl)=C/Cl	ZINC001134638737	1376637095	/nfs/dbraw/zinc/63/70/95/1376637095.db2.gz	UETFTRKLKVVDIP-OFLZDLGMSA-N	0	3	344.286	3.480	20	30		EGEDHN
Cc1ccccc1[C@@H](C)CC(=O)NCCNCc1ccc(C#N)s1	ZINC001134727951	1376681185	/nfs/dbraw/zinc/68/11/85/1376681185.db2.gz	ZUOQGWZVDOHAAU-HNNXBMFYSA-N	0	3	341.480	3.328	20	30		EGEDHN
CCc1ccc(C(=O)N[C@H](C)C[C@H](C)NCc2ccccc2C#N)o1	ZINC001134752686	1376699333	/nfs/dbraw/zinc/69/93/33/1376699333.db2.gz	RNUMPNHIHGFRNB-LSDHHAIUSA-N	0	3	339.439	3.400	20	30		EGEDHN
CC[C@H](Cc1cccc(C)c1)C(=O)NCCNCc1cccc(C#N)c1	ZINC001134846626	1376751173	/nfs/dbraw/zinc/75/11/73/1376751173.db2.gz	BFWLWJSZUCSLJX-OAQYLSRUSA-N	0	3	349.478	3.341	20	30		EGEDHN
Cc1cccc(C)c1CN1CC[C@@H]1CN(C)C(=O)C#CC(C)(C)C	ZINC001234195030	1376784869	/nfs/dbraw/zinc/78/48/69/1376784869.db2.gz	HVHHRWDXKNAIMF-GOSISDBHSA-N	0	3	326.484	3.386	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)C1(C)CCCC1	ZINC001135114492	1376908651	/nfs/dbraw/zinc/90/86/51/1376908651.db2.gz	ARWFZJHBELOSSA-STQMWFEESA-N	0	3	331.298	3.348	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](C)C[C@@H](C)NCc1cc2n(n1)CCCC2	ZINC001135181673	1376954933	/nfs/dbraw/zinc/95/49/33/1376954933.db2.gz	SVUOCCQAMYBQMZ-CVEARBPZSA-N	0	3	346.519	3.195	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H](C)C[C@@H](C)NCC(=C)Br)cc1	ZINC001135184401	1376957348	/nfs/dbraw/zinc/95/73/48/1376957348.db2.gz	HFYWECVYDQKZKI-KGLIPLIRSA-N	0	3	349.272	3.063	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc3c(c2)C=CCC3)cc1	ZINC001135196671	1376966957	/nfs/dbraw/zinc/96/69/57/1376966957.db2.gz	DEGVFZHUKOEKEH-UHFFFAOYSA-N	0	3	331.419	3.037	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)C1(C(F)F)CCC1)NCc1ccccc1C#N	ZINC001135288728	1377022435	/nfs/dbraw/zinc/02/24/35/1377022435.db2.gz	JKNYQHNXSXTISP-KBPBESRZSA-N	0	3	349.425	3.367	20	30		EGEDHN
C[C@H](CC(=O)NCCNCc1cccc(C#N)c1)c1ccccc1F	ZINC001135391318	1377070325	/nfs/dbraw/zinc/07/03/25/1377070325.db2.gz	UTNSQCTUQZYYAP-OAHLLOKOSA-N	0	3	339.414	3.097	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2conc2CC)CCC1	ZINC001135393913	1377071309	/nfs/dbraw/zinc/07/13/09/1377071309.db2.gz	ABCWGFZPGUFDBE-CABCVRRESA-N	0	3	333.476	3.356	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H](C)C[C@H](C)NCc1cc2n(n1)CCCC2	ZINC001135565113	1377148155	/nfs/dbraw/zinc/14/81/55/1377148155.db2.gz	PKVXJIBYNBPKBE-JKSUJKDBSA-N	0	3	346.519	3.195	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)C(C1CC1)C1CC1)NCc1ccccc1C#N	ZINC001135904291	1377256396	/nfs/dbraw/zinc/25/63/96/1377256396.db2.gz	AMPFCXHABISNGV-HUUCEWRRSA-N	0	3	339.483	3.367	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CC[C@@H](N(C)Cc2csc(C)c2)C1	ZINC001189241572	1388493623	/nfs/dbraw/zinc/49/36/23/1388493623.db2.gz	AMNWWACSCBFPPR-NVXWUHKLSA-N	0	3	336.501	3.070	20	30		EGEDHN
C=CCOC(=O)N[C@@H]1CCCN(Cc2c[nH]c3cc(C)ccc23)C1	ZINC001136976672	1377448821	/nfs/dbraw/zinc/44/88/21/1377448821.db2.gz	KMGQDCDVCMMPNS-MRXNPFEDSA-N	0	3	327.428	3.353	20	30		EGEDHN
CC(C)C[C@@H](CNCc1ccc(F)c(C#N)c1)NC(=O)C1CCC1	ZINC001268101314	1377486453	/nfs/dbraw/zinc/48/64/53/1377486453.db2.gz	GNZPYARLFRZFEG-KRWDZBQOSA-N	0	3	331.435	3.118	20	30		EGEDHN
C(#Cc1ccc(CN2CCC3(CC2)OCCO3)cc1)c1ccccc1	ZINC001138335552	1377704432	/nfs/dbraw/zinc/70/44/32/1377704432.db2.gz	VYRFPKGENBDVFG-UHFFFAOYSA-N	0	3	333.431	3.425	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCCN(Cc3ccncc3)CC2)c1[O-]	ZINC001138625894	1377756087	/nfs/dbraw/zinc/75/60/87/1377756087.db2.gz	WAHNEDQQOLNFJJ-UHFFFAOYSA-N	0	3	337.467	3.224	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCCN(Cc3ccncc3)CC2)c1[O-]	ZINC001138625894	1377756089	/nfs/dbraw/zinc/75/60/89/1377756089.db2.gz	WAHNEDQQOLNFJJ-UHFFFAOYSA-N	0	3	337.467	3.224	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@@](O)(C(F)(F)F)[C@@H](C)C2)c1[O-]	ZINC001138626067	1377756222	/nfs/dbraw/zinc/75/62/22/1377756222.db2.gz	ZNHXWBRPVZDIKS-LRDDRELGSA-N	0	3	329.362	3.256	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@@](O)(C(F)(F)F)[C@@H](C)C2)c1[O-]	ZINC001138626067	1377756223	/nfs/dbraw/zinc/75/62/23/1377756223.db2.gz	ZNHXWBRPVZDIKS-LRDDRELGSA-N	0	3	329.362	3.256	20	30		EGEDHN
C=CCc1cccc(CN2Cc3cnn(CC)c3[C@@H](COC)C2)c1O	ZINC001138626903	1377756244	/nfs/dbraw/zinc/75/62/44/1377756244.db2.gz	SGBHEZAPFLUXBG-GOSISDBHSA-N	0	3	341.455	3.083	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@H](Oc3nccnc3C)C2)c1[O-]	ZINC001138631265	1377758157	/nfs/dbraw/zinc/75/81/57/1377758157.db2.gz	MXIROJYKBOOQSH-SFHVURJKSA-N	0	3	339.439	3.263	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@H](Oc3nccnc3C)C2)c1[O-]	ZINC001138631265	1377758162	/nfs/dbraw/zinc/75/81/62/1377758162.db2.gz	MXIROJYKBOOQSH-SFHVURJKSA-N	0	3	339.439	3.263	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)Cc1ccccc1N1CCC(O)CC1	ZINC001138760980	1377781194	/nfs/dbraw/zinc/78/11/94/1377781194.db2.gz	XVVDPVJIYOWKPV-UHFFFAOYSA-N	0	3	335.451	3.151	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3c[nH]c4cccc(C)c34)C2)C1=O	ZINC001139195232	1377848231	/nfs/dbraw/zinc/84/82/31/1377848231.db2.gz	RSOWVDSSWOWDAW-NRFANRHFSA-N	0	3	337.467	3.477	20	30		EGEDHN
N#Cc1ccc(Oc2ccc(CN3CCN4CCCC[C@H]4C3)cn2)cc1	ZINC001139425613	1377882451	/nfs/dbraw/zinc/88/24/51/1377882451.db2.gz	SBNZUTXKOHTMRX-IBGZPJMESA-N	0	3	348.450	3.416	20	30		EGEDHN
Cc1nccnc1O[C@@H]1CCCN(Cc2c[nH]c3c2cccc3C#N)C1	ZINC001139706900	1377938040	/nfs/dbraw/zinc/93/80/40/1377938040.db2.gz	BZKZKAUWTIRIGT-QGZVFWFLSA-N	0	3	347.422	3.181	20	30		EGEDHN
C=CCOC(=O)N1CCCC2(CCN(Cc3ccc(C)nc3)CC2)C1	ZINC001139926904	1377977798	/nfs/dbraw/zinc/97/77/98/1377977798.db2.gz	FFSHZWIYMKGCPF-UHFFFAOYSA-N	0	3	343.471	3.391	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(CCCN2Cc2cccc3cnccc32)C1=O	ZINC001273303717	1378095771	/nfs/dbraw/zinc/09/57/71/1378095771.db2.gz	DBUPPWUJSBTHQH-NRFANRHFSA-N	0	3	335.451	3.378	20	30		EGEDHN
C=CCN1C(=O)CC[C@@]12CCCN(Cc1cc(Cl)ccc1N)CC2	ZINC001140715312	1378122717	/nfs/dbraw/zinc/12/27/17/1378122717.db2.gz	LLARBPHAGKWBKS-LJQANCHMSA-N	0	3	347.890	3.455	20	30		EGEDHN
C=CCOC(=O)N1CCCC2(CCN(Cc3cnccc3C)CC2)C1	ZINC001141031561	1378214132	/nfs/dbraw/zinc/21/41/32/1378214132.db2.gz	RHYZKWSTFQBPAZ-UHFFFAOYSA-N	0	3	343.471	3.391	20	30		EGEDHN
C=CCO[C@@H]1CO[C@]2(C1)CCCN(Cc1cnc(CCCC)[nH]1)C2	ZINC001141069918	1378230017	/nfs/dbraw/zinc/23/00/17/1378230017.db2.gz	IPGYDKWEXMPJRH-HKUYNNGSSA-N	0	3	333.476	3.078	20	30		EGEDHN
COc1ccc(C(F)(F)F)cc1CN1CCC2SC(=O)C=C2C1	ZINC001141201186	1378266970	/nfs/dbraw/zinc/26/69/70/1378266970.db2.gz	BCFJMUXDTWFBFM-CQSZACIVSA-N	0	3	343.370	3.488	20	30		EGEDHN
CC(C)(C)C(=O)NC1CCN(Cc2c[nH]c3cc(C#N)ccc23)CC1	ZINC001142926749	1378509903	/nfs/dbraw/zinc/50/99/03/1378509903.db2.gz	ZSRMZURTNPJMQQ-UHFFFAOYSA-N	0	3	338.455	3.166	20	30		EGEDHN
COC(=O)c1ccc2[nH]cc(CN(C)Cc3cccc(C#N)c3)c2c1	ZINC001143241129	1378567891	/nfs/dbraw/zinc/56/78/91/1378567891.db2.gz	OSGUJWJCHDYNIG-UHFFFAOYSA-N	0	3	333.391	3.458	20	30		EGEDHN
C=CCN1C(=O)CCC[C@@]12CCCN(Cc1cccc(O)c1C)C2	ZINC001144110325	1378683102	/nfs/dbraw/zinc/68/31/02/1378683102.db2.gz	KNCSKCYWGLLKLJ-FQEVSTJZSA-N	0	3	328.456	3.234	20	30		EGEDHN
N#Cc1ccc(CN2CCN([C@H]3CCCc4ccccc43)CC2)nc1	ZINC001144163631	1378689747	/nfs/dbraw/zinc/68/97/47/1378689747.db2.gz	OCDRMZOPUAYHMH-NRFANRHFSA-N	0	3	332.451	3.148	20	30		EGEDHN
Cc1c2cc(C)ccc2[nH]c1C(=O)NCCNCc1ccc(C#N)cc1	ZINC001146280434	1378808402	/nfs/dbraw/zinc/80/84/02/1378808402.db2.gz	HOSTWXWRNCKKLS-UHFFFAOYSA-N	0	3	346.434	3.176	20	30		EGEDHN
CC[C@@H](CC(=O)NCCNCc1ccc(C#N)s1)c1ccccc1	ZINC001147476444	1379030151	/nfs/dbraw/zinc/03/01/51/1379030151.db2.gz	YOCMNOTYGHARCG-HNNXBMFYSA-N	0	3	341.480	3.409	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2[nH]ccc2-c2ccccc2)cc1	ZINC001147562514	1379043010	/nfs/dbraw/zinc/04/30/10/1379043010.db2.gz	OXJKTSBAEYZWGY-UHFFFAOYSA-N	0	3	344.418	3.073	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC2(C1)CCN(CCc1csc(C)n1)C2	ZINC001148146568	1379124605	/nfs/dbraw/zinc/12/46/05/1379124605.db2.gz	ICARADDZHBBFOV-OAHLLOKOSA-N	0	3	347.528	3.131	20	30		EGEDHN
C[C@H](CN(C)C(=O)[C@@H]1CC[C@@H](C)CC1)NCc1ccc(C#N)s1	ZINC001283703569	1379128267	/nfs/dbraw/zinc/12/82/67/1379128267.db2.gz	HUJMQKZTJNUZMK-RBSFLKMASA-N	0	3	333.501	3.383	20	30		EGEDHN
C=CCC1(C(=O)N2CC3(C2)CCN(Cc2ncccc2C)C3)CCC1	ZINC001148226252	1379135804	/nfs/dbraw/zinc/13/58/04/1379135804.db2.gz	AEFLKONXIMUVRS-UHFFFAOYSA-N	0	3	339.483	3.171	20	30		EGEDHN
C=CCCC1(C(=O)N2CC3(C2)CCN(CCOCC2CCC2)C3)CC1	ZINC001148262058	1379140721	/nfs/dbraw/zinc/14/07/21/1379140721.db2.gz	FIWWTGWNJBVLIM-UHFFFAOYSA-N	0	3	346.515	3.084	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@@H](C)CCCc3ccccc3)C2)C1	ZINC001148851324	1379284116	/nfs/dbraw/zinc/28/41/16/1379284116.db2.gz	RBHNNDUDDUAAEF-SFHVURJKSA-N	0	3	326.484	3.366	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccccc2C2CCC2)cc1	ZINC001149364431	1379370026	/nfs/dbraw/zinc/37/00/26/1379370026.db2.gz	FWXHZCFZVWAUOA-UHFFFAOYSA-N	0	3	333.435	3.345	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H]1CN([C@H](C)c2ccccc2)CCCO1	ZINC001149580827	1379407338	/nfs/dbraw/zinc/40/73/38/1379407338.db2.gz	YJBWXHDBWRZKEP-UYAOXDASSA-N	0	3	342.483	3.148	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H]1CN(Cc2cc(C)ccc2C)CCCO1	ZINC001149788321	1379446428	/nfs/dbraw/zinc/44/64/28/1379446428.db2.gz	FEFAPUMZPKTZIO-HXUWFJFHSA-N	0	3	344.499	3.367	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@H]1CN(Cc2cc(C)cc(C)c2)CCCO1	ZINC001149789046	1379446719	/nfs/dbraw/zinc/44/67/19/1379446719.db2.gz	KXAMAIJNTYMZGJ-FQEVSTJZSA-N	0	3	344.499	3.367	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)C/C=C/c2ccc(F)cc2)C1	ZINC001149882164	1379459350	/nfs/dbraw/zinc/45/93/50/1379459350.db2.gz	YGERIKSZWAHBES-MEDHRJKHSA-N	0	3	346.446	3.012	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@H]1CN(Cc2cc(C)cc(C)c2)CCCO1	ZINC001150085071	1379491951	/nfs/dbraw/zinc/49/19/51/1379491951.db2.gz	JCKWLPLSFRQTSH-IBGZPJMESA-N	0	3	344.499	3.223	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H]1CN(Cc2ccc(C)c(C)c2)CCCO1	ZINC001150203615	1379514491	/nfs/dbraw/zinc/51/44/91/1379514491.db2.gz	UOTZSJUPEWQGIT-HXUWFJFHSA-N	0	3	344.499	3.367	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H]1CN(Cc2cccc(C)c2)CCCO1	ZINC001150211630	1379515865	/nfs/dbraw/zinc/51/58/65/1379515865.db2.gz	KCJXVDGKXZOZKZ-LJQANCHMSA-N	0	3	330.472	3.058	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H]1CN(Cc2cccc(CC)c2)CCCO1	ZINC001150225787	1379518062	/nfs/dbraw/zinc/51/80/62/1379518062.db2.gz	VBMRAOCLPXVUAA-HXUWFJFHSA-N	0	3	344.499	3.312	20	30		EGEDHN
C=CCCC1(C(=O)NC[C@H]2CN(CC3=CCCCC3)CCCO2)CC1	ZINC001150254231	1379522858	/nfs/dbraw/zinc/52/28/58/1379522858.db2.gz	LKIHEUYQUBNRSF-IBGZPJMESA-N	0	3	346.515	3.440	20	30		EGEDHN
C#CCCN1CCCO[C@H](CNC(=O)[C@](C)(CC)CCCCC)C1	ZINC001150796856	1379617114	/nfs/dbraw/zinc/61/71/14/1379617114.db2.gz	XVIAGOSZWKAHLY-UYAOXDASSA-N	0	3	336.520	3.213	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@@H]2CCC[C@@H]2CC)CC1	ZINC001151294584	1379694708	/nfs/dbraw/zinc/69/47/08/1379694708.db2.gz	MEXPTGPJPXHJAV-ZWKOTPCHSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)C(=O)NCCNCc1cccnc1C	ZINC001151922977	1379816174	/nfs/dbraw/zinc/81/61/74/1379816174.db2.gz	LFNNMFJLCSQNGV-IBGZPJMESA-N	0	3	337.467	3.031	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC[C@@H](C)N(CC)Cc1csc(C)c1	ZINC001152259411	1379894334	/nfs/dbraw/zinc/89/43/34/1379894334.db2.gz	CQJIEQQVCFIBRJ-ZBFHGGJFSA-N	0	3	338.517	3.364	20	30		EGEDHN
C=CCOCCCC(=O)NC[C@@H](C)N(CC)Cc1ccc(F)cc1	ZINC001152585254	1379953588	/nfs/dbraw/zinc/95/35/88/1379953588.db2.gz	SLYBMUZYYFEDIO-MRXNPFEDSA-N	0	3	336.451	3.135	20	30		EGEDHN
C=CCOCCCC(=O)NC[C@@H](C)N(CC)Cc1cccc(OC)c1	ZINC001152584965	1379953713	/nfs/dbraw/zinc/95/37/13/1379953713.db2.gz	HOVRQHCATHJKHV-QGZVFWFLSA-N	0	3	348.487	3.005	20	30		EGEDHN
Cc1cccc2cc(C(=O)NCCNCc3ccc(C#N)cc3)oc21	ZINC001152639068	1379960530	/nfs/dbraw/zinc/96/05/30/1379960530.db2.gz	AOYKQRHPYPGHTI-UHFFFAOYSA-N	0	3	333.391	3.133	20	30		EGEDHN
CCCC[C@H](C(=O)NCCNCc1ccc(OC)c(C#N)c1)C(C)C	ZINC001152653207	1379963283	/nfs/dbraw/zinc/96/32/83/1379963283.db2.gz	SUHBJJXSAZUTRH-SFHVURJKSA-N	0	3	345.487	3.235	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H](C)N(CC)CCOc1ccccc1F	ZINC001152842169	1379986077	/nfs/dbraw/zinc/98/60/77/1379986077.db2.gz	PUSYGJSFOWUSLQ-QGZVFWFLSA-N	0	3	348.462	3.225	20	30		EGEDHN
CC(C)(C)[C@@H](CNCc1cc(C#N)ccc1F)NC(=O)C1(C)CC1	ZINC001284591549	1379992612	/nfs/dbraw/zinc/99/26/12/1379992612.db2.gz	UHBPBFBWBNGJFI-MRXNPFEDSA-N	0	3	331.435	3.118	20	30		EGEDHN
CCc1c2ccccc2oc1C(=O)NCCNCc1ccc(C#N)cc1	ZINC001152963467	1379999645	/nfs/dbraw/zinc/99/96/45/1379999645.db2.gz	MLYRKGFPPQSLTD-UHFFFAOYSA-N	0	3	347.418	3.386	20	30		EGEDHN
CC(C)(C)C12CC(C(=O)NCCNCc3ccc(C#N)c(F)c3)(C1)C2	ZINC001152969743	1380000948	/nfs/dbraw/zinc/00/09/48/1380000948.db2.gz	GMXMZLQYZNMAPA-UHFFFAOYSA-N	0	3	343.446	3.120	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)c1[nH]c(C)cc1C	ZINC001154039383	1380188922	/nfs/dbraw/zinc/18/89/22/1380188922.db2.gz	WBTCMMPHUGQMQC-MRXNPFEDSA-N	0	3	338.455	3.144	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)C1(F)CCCC1	ZINC001154100024	1380207901	/nfs/dbraw/zinc/20/79/01/1380207901.db2.gz	XXIKJYDMBJNCCX-OAHLLOKOSA-N	0	3	331.435	3.167	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H](C)N(CC)Cc2ccc(C)nc2C)cc1	ZINC001154561853	1380306367	/nfs/dbraw/zinc/30/63/67/1380306367.db2.gz	VZAYWUIXTLUEOP-QGZVFWFLSA-N	0	3	349.478	3.320	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@H](C)N(CC)Cc1ccc(F)c(F)c1	ZINC001154720361	1380339515	/nfs/dbraw/zinc/33/95/15/1380339515.db2.gz	YQQWXJYDIPLISD-OAHLLOKOSA-N	0	3	336.426	3.485	20	30		EGEDHN
C[C@H](N)c1nc2ccccc2n1-c1nc(-c2ccncc2)ccc1C#N	ZINC001155259319	1380429798	/nfs/dbraw/zinc/42/97/98/1380429798.db2.gz	XISIMPPTAHKIDZ-ZDUSSCGKSA-N	0	3	340.390	3.374	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NCCCNCc1cccc(Cl)c1F	ZINC001155426369	1380450906	/nfs/dbraw/zinc/45/09/06/1380450906.db2.gz	ALYABPQHGCCXJD-ZDUSSCGKSA-N	0	3	342.842	3.056	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NCCCNCc1cccc(F)c1Cl	ZINC001155445833	1380454701	/nfs/dbraw/zinc/45/47/01/1380454701.db2.gz	FMFJGEUFXOBXDT-ZDUSSCGKSA-N	0	3	342.842	3.056	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@H](C)c1cc2ccccc2o1	ZINC001156277448	1380552120	/nfs/dbraw/zinc/55/21/20/1380552120.db2.gz	UUHRMZLXFUCPAA-HZPDHXFCSA-N	0	3	326.440	3.386	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@@H](C)CCc1cccc(F)c1	ZINC001157013549	1380751392	/nfs/dbraw/zinc/75/13/92/1380751392.db2.gz	LKLCRTYMKKNGKT-DLBZAZTESA-N	0	3	332.463	3.244	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1c[nH]c2c1cccc2CC	ZINC001157158563	1380790275	/nfs/dbraw/zinc/79/02/75/1380790275.db2.gz	CZNWXVGMKZHUBD-OAHLLOKOSA-N	0	3	325.456	3.194	20	30		EGEDHN
CN1CCC[C@H]2CN(c3nc4ccccc4c(Cl)c3C#N)C[C@H]21	ZINC001157271873	1380829078	/nfs/dbraw/zinc/82/90/78/1380829078.db2.gz	KJVXFUDVHGWMHU-BLLLJJGKSA-N	0	3	326.831	3.290	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)N1CC[C@@H](OC(=O)OC(C)(C)C)C1	ZINC001157592879	1380975299	/nfs/dbraw/zinc/97/52/99/1380975299.db2.gz	RFLUQIVYKNRKPN-CABCVRRESA-N	0	3	340.464	3.003	20	30		EGEDHN
O=C(C#CC1CC1)NCCCNCc1cc(Cl)ccc1Cl	ZINC001157682687	1381000529	/nfs/dbraw/zinc/00/05/29/1381000529.db2.gz	MLLXIPXKHUHVFQ-UHFFFAOYSA-N	0	3	325.239	3.003	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCCC[C@@H]1CN(C)C/C=C/c1ccccc1	ZINC001157695488	1381005284	/nfs/dbraw/zinc/00/52/84/1381005284.db2.gz	BELWGRCDRPEGSW-ZNOOQZCJSA-N	0	3	325.456	3.172	20	30		EGEDHN
C=C(C)CCC(=O)N1CCCC[C@@H]1CN(C)C[C@@H](O)c1ccccc1	ZINC001158018825	1381104104	/nfs/dbraw/zinc/10/41/04/1381104104.db2.gz	KYESRAIUXUETBF-WOJBJXKFSA-N	0	3	344.499	3.389	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc(-c2cnco2)cc1	ZINC001158135866	1381138246	/nfs/dbraw/zinc/13/82/46/1381138246.db2.gz	LZJOPHLFAAJGKL-GOSISDBHSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)CCc1cccc(N(C)C)c1	ZINC001158397803	1381230600	/nfs/dbraw/zinc/23/06/00/1381230600.db2.gz	POWSQVJHWQIMQP-HXUWFJFHSA-N	0	3	343.515	3.184	20	30		EGEDHN
C=C(Cl)CN(C)C[C@H]1CCCCN1C(=O)c1cc(C(C)C)[nH]n1	ZINC001158507406	1381271910	/nfs/dbraw/zinc/27/19/10/1381271910.db2.gz	FIPRUAWRUXKVQT-CQSZACIVSA-N	0	3	338.883	3.212	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccn(C(CC)CC)n1	ZINC001158549818	1381293766	/nfs/dbraw/zinc/29/37/66/1381293766.db2.gz	LDWJFUFBEPCNAP-QGZVFWFLSA-N	0	3	332.492	3.357	20	30		EGEDHN
CCN1CCN(c2ccc([C@@H](C#N)c3ccc(C)cc3)nn2)C(C)(C)C1	ZINC001158561784	1381301018	/nfs/dbraw/zinc/30/10/18/1381301018.db2.gz	WCAXSXKNHKPOIJ-SFHVURJKSA-N	0	3	349.482	3.361	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NCCCNCc1cc(O)ccc1Cl	ZINC001158850101	1381433875	/nfs/dbraw/zinc/43/38/75/1381433875.db2.gz	PYGQCHQLERETMD-UHFFFAOYSA-N	0	3	345.270	3.420	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1csc(CC(C)C)n1	ZINC001158955570	1381484611	/nfs/dbraw/zinc/48/46/11/1381484611.db2.gz	LZVWEOMAISPBQZ-OAHLLOKOSA-N	0	3	335.517	3.454	20	30		EGEDHN
C=C(C)CCC(=O)NCCCNCc1cc(-c2ccccc2)no1	ZINC001159032877	1381525529	/nfs/dbraw/zinc/52/55/29/1381525529.db2.gz	YWVMDUKGRXHJPR-UHFFFAOYSA-N	0	3	327.428	3.294	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCC1=CCN([C@@H]2CCc3ccc(F)cc32)CC1	ZINC001159593583	1381839627	/nfs/dbraw/zinc/83/96/27/1381839627.db2.gz	HACXWHGDJJJORD-AUUYWEPGSA-N	0	3	341.430	3.111	20	30		EGEDHN
C#CCC1(C(=O)NCCCNCc2cccc(Cl)c2F)CCC1	ZINC001159638620	1381856213	/nfs/dbraw/zinc/85/62/13/1381856213.db2.gz	XJAIXAITRZWRGU-UHFFFAOYSA-N	0	3	336.838	3.269	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)NCCC1=CCN(Cc2ccc(C#N)cc2)CC1	ZINC001159827842	1381912772	/nfs/dbraw/zinc/91/27/72/1381912772.db2.gz	NUIUCGCASJKJGF-IBGZPJMESA-N	0	3	337.467	3.243	20	30		EGEDHN
C=CCn1cccc1C(=O)NCCCNCc1oc(C(C)C)nc1C	ZINC001159974377	1381955199	/nfs/dbraw/zinc/95/51/99/1381955199.db2.gz	AAFPHUYXZQZKMU-UHFFFAOYSA-N	0	3	344.459	3.004	20	30		EGEDHN
C=CCn1cccc1C(=O)NCCCNCc1cccc(Cl)c1F	ZINC001159974462	1381955284	/nfs/dbraw/zinc/95/52/84/1381955284.db2.gz	DWIUHHXGZKWMHD-UHFFFAOYSA-N	0	3	349.837	3.376	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@]2(C)[C@@H]3Cc4ccccc4[C@@H]32)CC1	ZINC001160550436	1382139443	/nfs/dbraw/zinc/13/94/43/1382139443.db2.gz	BMIYAOWYPACLCC-RZUBCFFCSA-N	0	3	336.479	3.287	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@H](c2ccccc2)C2CC2)CC1	ZINC001160671468	1382166398	/nfs/dbraw/zinc/16/63/98/1382166398.db2.gz	JRQSWUUMBYVYRA-OAQYLSRUSA-N	0	3	336.479	3.342	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)Cc2cccc3ncccc23)CC1	ZINC001160672593	1382167171	/nfs/dbraw/zinc/16/71/71/1382167171.db2.gz	ZUCYRKLJMUXYOA-UHFFFAOYSA-N	0	3	335.451	3.102	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@H](C)c2c(F)cccc2F)CC1	ZINC001160699941	1382174390	/nfs/dbraw/zinc/17/43/90/1382174390.db2.gz	NRSZUJGIBBTWTD-OAHLLOKOSA-N	0	3	346.421	3.230	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc3ccc(C)cc3[nH]2)CC1	ZINC001160810392	1382204977	/nfs/dbraw/zinc/20/49/77/1382204977.db2.gz	QBIGPJPWZXZVBL-UHFFFAOYSA-N	0	3	335.451	3.252	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@@]1(C)CCC[C@@H]1CC	ZINC001160980055	1382260304	/nfs/dbraw/zinc/26/03/04/1382260304.db2.gz	YCZHPHVVWMGNIA-ZFWWWQNUSA-N	0	3	331.298	3.207	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCC1=CCN(CCOCC2CC2)CC1	ZINC001160860638	1382218132	/nfs/dbraw/zinc/21/81/32/1382218132.db2.gz	KXKUOFZTIBJKMO-UHFFFAOYSA-N	0	3	334.504	3.154	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCC1=CCN(CCOCC2CCC2)CC1	ZINC001160940709	1382243615	/nfs/dbraw/zinc/24/36/15/1382243615.db2.gz	FXBYDBYPQQKWMD-MSOLQXFVSA-N	0	3	348.531	3.400	20	30		EGEDHN
N#Cc1c[nH]c2nc(NC3CCN(Cc4ccc(O)cc4)CC3)ccc12	ZINC001161132053	1382311876	/nfs/dbraw/zinc/31/18/76/1382311876.db2.gz	XLYUJSWTQLBTRV-UHFFFAOYSA-N	0	3	347.422	3.217	20	30		EGEDHN
Cc1cc(C#N)c(NC2CCN(Cc3ccc(O)cc3)CC2)nc1C	ZINC001161131435	1382312540	/nfs/dbraw/zinc/31/25/40/1382312540.db2.gz	LPFFEYQYCCNYBK-UHFFFAOYSA-N	0	3	336.439	3.352	20	30		EGEDHN
N#Cc1cnc(NC2CCN(Cc3ccc(O)cc3)CC2)c(Cl)c1	ZINC001161129231	1382312670	/nfs/dbraw/zinc/31/26/70/1382312670.db2.gz	ATULRYMSQHJVFI-UHFFFAOYSA-N	0	3	342.830	3.389	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H](C)OC2CCCCCC2)CC1	ZINC001161178573	1382327875	/nfs/dbraw/zinc/32/78/75/1382327875.db2.gz	VQVMAYVUZYSPHW-GOSISDBHSA-N	0	3	346.515	3.276	20	30		EGEDHN
COc1cc(CN(C)C)ccc1NC(=O)c1cc(F)c(C#N)c(F)c1	ZINC001161203913	1382339172	/nfs/dbraw/zinc/33/91/72/1382339172.db2.gz	BVYFXGOOBUWLLR-UHFFFAOYSA-N	0	3	345.349	3.159	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)Cc2c[nH]c3c2cccc3C)CC1	ZINC001161392000	1382397503	/nfs/dbraw/zinc/39/75/03/1382397503.db2.gz	ZXTDHTHYSGXSHJ-UHFFFAOYSA-N	0	3	349.478	3.181	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2scnc2C(C)(C)C)CC1	ZINC001161422032	1382404369	/nfs/dbraw/zinc/40/43/69/1382404369.db2.gz	FPCHIWLQPSIZBR-UHFFFAOYSA-N	0	3	345.512	3.216	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc3cccnc3s2)CC1	ZINC001161640039	1382467536	/nfs/dbraw/zinc/46/75/36/1382467536.db2.gz	QFQJFYOHZWHNSK-UHFFFAOYSA-N	0	3	327.453	3.234	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@H](C)c2ccc(C)s2)CC1	ZINC001161699271	1382483790	/nfs/dbraw/zinc/48/37/90/1382483790.db2.gz	QLCMJTKABZHVCL-MRXNPFEDSA-N	0	3	330.497	3.322	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)Cc2c(F)cccc2Cl)CC1	ZINC001161766718	1382499957	/nfs/dbraw/zinc/49/99/57/1382499957.db2.gz	YXDSUEOROFTXAV-UHFFFAOYSA-N	0	3	336.838	3.346	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)COC[C@H](C)c2ccccc2)CC1	ZINC001161796490	1382507999	/nfs/dbraw/zinc/50/79/99/1382507999.db2.gz	KJPQQKHJXMRMAR-SFHVURJKSA-N	0	3	342.483	3.131	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc(C)n(C(C)C)c2C)CC1	ZINC001161844120	1382526584	/nfs/dbraw/zinc/52/65/84/1382526584.db2.gz	GZYWGCYKOBKJJS-UHFFFAOYSA-N	0	3	341.499	3.461	20	30		EGEDHN
COc1nc(NC[C@@H]2CCCN2Cc2ccccc2)c(F)cc1C#N	ZINC001161885947	1382540501	/nfs/dbraw/zinc/54/05/01/1382540501.db2.gz	IQPMBXHXRMVMNB-INIZCTEOSA-N	0	3	340.402	3.177	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H](C)c2ccc(F)c(F)c2)CC1	ZINC001161904341	1382545324	/nfs/dbraw/zinc/54/53/24/1382545324.db2.gz	QUIZZTLNMITAJY-HNNXBMFYSA-N	0	3	346.421	3.230	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H](C)c2ccc(F)c(F)c2)CC1	ZINC001161904435	1382545391	/nfs/dbraw/zinc/54/53/91/1382545391.db2.gz	WACOBAMWHVIWJL-AWEZNQCLSA-N	0	3	334.410	3.393	20	30		EGEDHN
Cc1cc(C(=O)NCCCNCc2ccccc2C#N)c(C)s1	ZINC001161978678	1382585575	/nfs/dbraw/zinc/58/55/75/1382585575.db2.gz	WPNRGZILSVCYIL-UHFFFAOYSA-N	0	3	327.453	3.146	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2csc(CC(C)C)n2)CC1	ZINC001161986432	1382588731	/nfs/dbraw/zinc/58/87/31/1382588731.db2.gz	FEMUFSDPNPXLAT-UHFFFAOYSA-N	0	3	345.512	3.117	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)CC1(C)CCCCC1	ZINC001162240457	1382665214	/nfs/dbraw/zinc/66/52/14/1382665214.db2.gz	BGIXPJVFBPNKIV-UHFFFAOYSA-N	0	3	331.298	3.351	20	30		EGEDHN
C#CC1(Nc2nccnc2C(C#N)C(=O)OC(C)(C)C)CCCCC1	ZINC001162479532	1382769257	/nfs/dbraw/zinc/76/92/57/1382769257.db2.gz	IPAWTYIRWRZOKG-CQSZACIVSA-N	0	3	340.427	3.173	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)c1cccc(F)c1	ZINC001162678576	1382831476	/nfs/dbraw/zinc/83/14/76/1382831476.db2.gz	UDZJMQITWMRYMQ-UHFFFAOYSA-N	0	3	338.426	3.124	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)c1ccsc1	ZINC001162688115	1382834076	/nfs/dbraw/zinc/83/40/76/1382834076.db2.gz	BZTGIXXDCPZKRN-UHFFFAOYSA-N	0	3	326.465	3.046	20	30		EGEDHN
C[C@@H](N)c1nc2ccccc2n1-c1nc(Cl)nc(Cl)c1C#N	ZINC001162759318	1382861901	/nfs/dbraw/zinc/86/19/01/1382861901.db2.gz	CKBBZBCLJWAYTF-SSDOTTSWSA-N	0	3	333.182	3.014	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)c1cscc1C	ZINC001162763394	1382862891	/nfs/dbraw/zinc/86/28/91/1382862891.db2.gz	FRZNUPWRRAOYAE-UHFFFAOYSA-N	0	3	340.492	3.354	20	30		EGEDHN
CC[C@H](F)CNCCN(CCc1ccccc1)C(=O)C#CC(C)(C)C	ZINC001162806703	1382879390	/nfs/dbraw/zinc/87/93/90/1382879390.db2.gz	JPWWLBDSXXZGLV-IBGZPJMESA-N	0	3	346.490	3.445	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C1CCC2(CC2)CC1	ZINC001162859979	1382898072	/nfs/dbraw/zinc/89/80/72/1382898072.db2.gz	QIYNASSNCZDPDX-UHFFFAOYSA-N	0	3	338.495	3.251	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C1(CCC)CCC1	ZINC001162891926	1382907041	/nfs/dbraw/zinc/90/70/41/1382907041.db2.gz	AJDONVAZCMXVNK-UHFFFAOYSA-N	0	3	326.484	3.251	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)[C@@H]2CC[C@@H]3C[C@@H]3CC2)c(F)c1	ZINC001163006892	1382945916	/nfs/dbraw/zinc/94/59/16/1382945916.db2.gz	ODBUJUGFYSPAHN-OSYLJGHBSA-N	0	3	343.446	3.120	20	30		EGEDHN
CC(C)(C)CC(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001163446809	1383053102	/nfs/dbraw/zinc/05/31/02/1383053102.db2.gz	DNLGBADJTGJTOD-UHFFFAOYSA-N	0	3	327.472	3.371	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NCCC1(CNCC=C(Cl)Cl)CC1	ZINC001163707043	1383110284	/nfs/dbraw/zinc/11/02/84/1383110284.db2.gz	NPAXZJHUXIQHEC-CYBMUJFWSA-N	0	3	349.302	3.163	20	30		EGEDHN
C=CCCC(=O)NCCC1(CNCc2cc(F)ccc2OC)CC1	ZINC001163752107	1383117878	/nfs/dbraw/zinc/11/78/78/1383117878.db2.gz	NJYQZNKPVLIEAL-UHFFFAOYSA-N	0	3	334.435	3.177	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)[C@H](C)CCC)CC1	ZINC001163842445	1383128330	/nfs/dbraw/zinc/12/83/30/1383128330.db2.gz	ZSWUKJXFOXFTQW-GFCCVEGCSA-N	0	3	331.298	3.207	20	30		EGEDHN
C#CCCCCCC(=O)NCCCNCc1nsc2ccccc21	ZINC001163969554	1383141475	/nfs/dbraw/zinc/14/14/75/1383141475.db2.gz	MVWQDLCRUAIKBN-UHFFFAOYSA-N	0	3	343.496	3.476	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)C[C@@H]2CC=CCC2)c(F)c1	ZINC001164001698	1383145209	/nfs/dbraw/zinc/14/52/09/1383145209.db2.gz	SWANBSSJYSJBRD-OAHLLOKOSA-N	0	3	329.419	3.040	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCCNCc1c(Cl)cccc1OC	ZINC001164221558	1383167685	/nfs/dbraw/zinc/16/76/85/1383167685.db2.gz	CDKAACATCFGJRP-UONOGXRCSA-N	0	3	338.879	3.403	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCCNCc1cc(-c2ccccc2)no1	ZINC001164234385	1383169649	/nfs/dbraw/zinc/16/96/49/1383169649.db2.gz	WTZPYSCQDSTYQR-HOTGVXAUSA-N	0	3	341.455	3.396	20	30		EGEDHN
CC1(C)CC(C(=O)NCCC2(CNCc3ccccc3C#N)CC2)C1	ZINC001164403112	1383184742	/nfs/dbraw/zinc/18/47/42/1383184742.db2.gz	PHPPFVQDSITRDV-UHFFFAOYSA-N	0	3	339.483	3.371	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2coc(C(C)(C)C)n2)CC1	ZINC001164523909	1383195973	/nfs/dbraw/zinc/19/59/73/1383195973.db2.gz	JQBTYSNJAXLGGM-UHFFFAOYSA-N	0	3	339.867	3.214	20	30		EGEDHN
C=C(C)CCC(=O)NCCC1(CNCc2cccc(OCC)n2)CC1	ZINC001165258560	1383259468	/nfs/dbraw/zinc/25/94/68/1383259468.db2.gz	FJMPKBDCSURTHJ-UHFFFAOYSA-N	0	3	345.487	3.213	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cc3cnccc3o2)CC1	ZINC001165993132	1383374514	/nfs/dbraw/zinc/37/45/14/1383374514.db2.gz	RMTIBBGVUYMHIB-UHFFFAOYSA-N	0	3	333.819	3.070	20	30		EGEDHN
C[C@H](C(=O)NCCCNCc1ccccc1C#N)c1cccs1	ZINC001166510588	1383430884	/nfs/dbraw/zinc/43/08/84/1383430884.db2.gz	PRDGQFVODJUXAM-AWEZNQCLSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001166696172	1383462714	/nfs/dbraw/zinc/46/27/14/1383462714.db2.gz	XJNNQXKNSGPQGW-SJORKVTESA-N	0	3	339.483	3.393	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCCC1(CNCc2ccc(F)cn2)CC1	ZINC001166746996	1383470346	/nfs/dbraw/zinc/47/03/46/1383470346.db2.gz	JRKPTLHBPZTBID-OAHLLOKOSA-N	0	3	333.451	3.199	20	30		EGEDHN
CC1(C)CC[C@H]1C(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001166747805	1383470864	/nfs/dbraw/zinc/47/08/64/1383470864.db2.gz	SKLSBQZJHHWNLB-SFHVURJKSA-N	0	3	339.483	3.371	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCCC1(CN[C@H](C)c2cnc(C)cn2)CC1	ZINC001166765693	1383474329	/nfs/dbraw/zinc/47/43/29/1383474329.db2.gz	VTZWLFMVRONVCV-IAGOWNOFSA-N	0	3	344.503	3.324	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc3c(c2)[C@H](C)CO3)CC1	ZINC001166765178	1383474500	/nfs/dbraw/zinc/47/45/00/1383474500.db2.gz	HHROWJPOYZRQRL-CYBMUJFWSA-N	0	3	348.874	3.425	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCC1(CNCc2ccc(F)cn2)CC1	ZINC001167025476	1383522064	/nfs/dbraw/zinc/52/20/64/1383522064.db2.gz	IAHWPLLBTSVXHA-GOSISDBHSA-N	0	3	333.451	3.199	20	30		EGEDHN
C=CCCC1(C(=O)NCCC2(CNCc3cnoc3C)CC2)CC1	ZINC001167025828	1383522118	/nfs/dbraw/zinc/52/21/18/1383522118.db2.gz	ORIHKYKUHDRFDU-UHFFFAOYSA-N	0	3	331.460	3.106	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)Cc2cccc(F)c2F)CC1	ZINC001167331412	1383600057	/nfs/dbraw/zinc/60/00/57/1383600057.db2.gz	JMVOJNQFZJJLIR-UHFFFAOYSA-N	0	3	342.817	3.136	20	30		EGEDHN
CC(C)[C@@H]1C[C@H]1C(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001167578589	1383675803	/nfs/dbraw/zinc/67/58/03/1383675803.db2.gz	KDDVQMAMYUBCQU-RBUKOAKNSA-N	0	3	339.483	3.226	20	30		EGEDHN
C[C@@H](C(=O)NCCCNCc1ccccc1C#N)[C@@H](C)C(C)(C)C	ZINC001168163761	1383830755	/nfs/dbraw/zinc/83/07/55/1383830755.db2.gz	BJOYHZSLCRCCPM-HZPDHXFCSA-N	0	3	329.488	3.472	20	30		EGEDHN
C=CC1(CC(=O)NCCCNCc2cccnc2OC)CCCCC1	ZINC001168182944	1383836559	/nfs/dbraw/zinc/83/65/59/1383836559.db2.gz	UGZJPJSRNCMPSK-UHFFFAOYSA-N	0	3	345.487	3.213	20	30		EGEDHN
C=CC1(CC(=O)NCCCNCc2oc(C)nc2C)CCCCC1	ZINC001168182904	1383836654	/nfs/dbraw/zinc/83/66/54/1383836654.db2.gz	RPMUVCQQIVXYLB-UHFFFAOYSA-N	0	3	333.476	3.414	20	30		EGEDHN
C=CCC1(C(=O)NCCC2(CNCc3cnc(C)o3)CC2)CCCC1	ZINC001168590514	1383943552	/nfs/dbraw/zinc/94/35/52/1383943552.db2.gz	SDYPUBBCXZGFQD-UHFFFAOYSA-N	0	3	345.487	3.496	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1ccc2cccnc2c1	ZINC001168747290	1383990507	/nfs/dbraw/zinc/99/05/07/1383990507.db2.gz	GRNPJIFSPFPBSP-UHFFFAOYSA-N	0	3	344.418	3.016	20	30		EGEDHN
C/C=C(\C)C(=O)N[C@@H](C)CCCCNCc1cc(F)ccc1C#N	ZINC001170067239	1384228587	/nfs/dbraw/zinc/22/85/87/1384228587.db2.gz	JLEHEQNXTWMVLE-DOCFVWFQSA-N	0	3	331.435	3.428	20	30		EGEDHN
C[C@H](CCCCNC/C(Cl)=C/Cl)NC(=O)c1c[nH]c(C#N)c1	ZINC001170283747	1384282594	/nfs/dbraw/zinc/28/25/94/1384282594.db2.gz	YDNJQVXZQCTOTN-NUBYWOLOSA-N	0	3	343.258	3.084	20	30		EGEDHN
N#CC1(c2ccccc2)CCC(N[C@@H]2c3ccccc3CNC2=O)CC1	ZINC001170367552	1384301917	/nfs/dbraw/zinc/30/19/17/1384301917.db2.gz	JRJXJQDCFPRHDG-AATLZSDMSA-N	0	3	345.446	3.351	20	30		EGEDHN
CC[C@@H](CC(C)C)C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001170511558	1384332409	/nfs/dbraw/zinc/33/24/09/1384332409.db2.gz	SWOAKCVPPGDDJV-INIZCTEOSA-N	0	3	333.451	3.366	20	30		EGEDHN
N=C(Nc1cccc(CCC(N)=O)c1)c1ccc2cc(O)ccc2c1	ZINC001171182918	1384462208	/nfs/dbraw/zinc/46/22/08/1384462208.db2.gz	WPNSLELZXZUWSQ-UHFFFAOYSA-N	0	3	333.391	3.000	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H](C)CCCCNCc1ocnc1C	ZINC001171260866	1384481070	/nfs/dbraw/zinc/48/10/70/1384481070.db2.gz	NOUNDDZBJPIXRU-HNNXBMFYSA-N	0	3	344.459	3.049	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@@]2(C)CCc3ccccc32)C1	ZINC001316625696	1384490963	/nfs/dbraw/zinc/49/09/63/1384490963.db2.gz	YCOZDHRLICQCHC-GMBSWORKSA-N	0	3	332.875	3.127	20	30		EGEDHN
CC[C@H]1CC[C@H](C(=O)NCCCNCc2ccccc2C#N)CC1	ZINC001171668011	1384595977	/nfs/dbraw/zinc/59/59/77/1384595977.db2.gz	XHQXFJDXXDCAGA-QAQDUYKDSA-N	0	3	327.472	3.371	20	30		EGEDHN
C=CCN(Cc1ccccc1)[C@H]1CC(=O)N(C(=O)OC(C)(C)C)C1	ZINC001171718814	1384612114	/nfs/dbraw/zinc/61/21/14/1384612114.db2.gz	ZSUKSPWXBVOQKX-INIZCTEOSA-N	0	3	330.428	3.211	20	30		EGEDHN
CCCCCCCCCC(=O)NCCCNCc1cnns1	ZINC001171865170	1384665330	/nfs/dbraw/zinc/66/53/30/1384665330.db2.gz	VWDAHBFQESZAIO-UHFFFAOYSA-N	0	3	326.510	3.275	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)N1CCN(c2cccc(C#N)c2)CC1	ZINC001172310602	1384766154	/nfs/dbraw/zinc/76/61/54/1384766154.db2.gz	GRCVKYZXVNRMAB-KRWDZBQOSA-N	0	3	330.435	3.183	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)N1CCCN(C(=O)c2ccccc2)CC1	ZINC001172311691	1384766478	/nfs/dbraw/zinc/76/64/78/1384766478.db2.gz	WALAKBATYIMXQG-GOSISDBHSA-N	0	3	347.462	3.337	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)N1CCCN(C(=O)OC(C)(C)C)CC1	ZINC001172316555	1384767861	/nfs/dbraw/zinc/76/78/61/1384767861.db2.gz	UQPKXVBPXQIVPD-INIZCTEOSA-N	0	3	343.471	3.432	20	30		EGEDHN
C=CCOC[C@H]1CCC[C@@]12CN([C@H](C)CCOC(C)C)CCO2	ZINC001172451869	1384795223	/nfs/dbraw/zinc/79/52/23/1384795223.db2.gz	VNMPUICUPMGXOO-GUDVDZBRSA-N	0	3	325.493	3.264	20	30		EGEDHN
C[C@@H](CCCC#N)N1CCN(c2ccc(Br)cn2)CC1	ZINC001172493484	1384804182	/nfs/dbraw/zinc/80/41/82/1384804182.db2.gz	MJFZQZBXZNTAQG-ZDUSSCGKSA-N	0	3	337.265	3.048	20	30		EGEDHN
CCOC(=O)C1(C#N)CCN([C@@H]2CC[C@@H](c3ccccc3)C2)CC1	ZINC001172568419	1384812947	/nfs/dbraw/zinc/81/29/47/1384812947.db2.gz	LZDGIGKQGGHNRJ-QZTJIDSGSA-N	0	3	326.440	3.492	20	30		EGEDHN
CC[C@H](N[C@H]1CCN(C(=O)OC(C)(C)C)[C@H](C#N)C1)c1ccccn1	ZINC001172972540	1384893237	/nfs/dbraw/zinc/89/32/37/1384893237.db2.gz	BAVJIZAJVFMFMB-JYJNAYRXSA-N	0	3	344.459	3.414	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H](N2CCC[C@H](C(F)F)C2)C[C@H]1C#N	ZINC001172983842	1384895720	/nfs/dbraw/zinc/89/57/20/1384895720.db2.gz	HOOOVVXQNHYJOL-IHRRRGAJSA-N	0	3	343.418	3.255	20	30		EGEDHN
N#Cc1nccnc1N1CCN(C2CCC3(CCCCC3)CC2)CC1	ZINC001173118643	1384918198	/nfs/dbraw/zinc/91/81/98/1384918198.db2.gz	ADSXRFFUVCMFES-UHFFFAOYSA-N	0	3	339.487	3.363	20	30		EGEDHN
C=CCOC1CCC(N2CCc3cccc(C(=O)OC)c3C2)CC1	ZINC001173321075	1384957534	/nfs/dbraw/zinc/95/75/34/1384957534.db2.gz	AAUYFJOKKCSPHC-UHFFFAOYSA-N	0	3	329.440	3.345	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](NCc3c(C)nsc3C)C2)CCC1	ZINC001317306332	1385073325	/nfs/dbraw/zinc/07/33/25/1385073325.db2.gz	VLZNIRHTPMOGRW-HNNXBMFYSA-N	0	3	333.501	3.197	20	30		EGEDHN
Cc1cc(C)cc(C(=O)NCCCNCc2cc(C#N)ccc2F)c1	ZINC001174564332	1385120278	/nfs/dbraw/zinc/12/02/78/1385120278.db2.gz	ZTWASGPVIGDWFO-UHFFFAOYSA-N	0	3	339.414	3.224	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H](C)CCCCNCc1cn(C(C)(C)C)nn1	ZINC001174683074	1385133889	/nfs/dbraw/zinc/13/38/89/1385133889.db2.gz	PJQIATQIBAUIFH-OAHLLOKOSA-N	0	3	349.523	3.010	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H](C)CCCCNCc1nccn1CC	ZINC001174694683	1385135397	/nfs/dbraw/zinc/13/53/97/1385135397.db2.gz	VOGVSGUWTHBGSQ-SFHVURJKSA-N	0	3	346.519	3.251	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)c1cc2c(s1)CCCCC2	ZINC001175274194	1385238686	/nfs/dbraw/zinc/23/86/86/1385238686.db2.gz	QZWAHYWZLPJUKP-UHFFFAOYSA-N	0	3	326.893	3.479	20	30		EGEDHN
CN(CCCN1CCN(c2ccc(C#N)cc2)CC1)c1ccccc1	ZINC001175453048	1385296101	/nfs/dbraw/zinc/29/61/01/1385296101.db2.gz	HVTSAYVNCBEUSK-UHFFFAOYSA-N	0	3	334.467	3.207	20	30		EGEDHN
C=CCC1(C(=O)NCCCNCc2cc(OC)ccn2)CCCCC1	ZINC001176785451	1385696643	/nfs/dbraw/zinc/69/66/43/1385696643.db2.gz	FJBUJABWIXLSEL-UHFFFAOYSA-N	0	3	345.487	3.213	20	30		EGEDHN
CCCCCCCC[C@H](C)C(=O)NCCCNCc1ccn(C)n1	ZINC001176707013	1385665932	/nfs/dbraw/zinc/66/59/32/1385665932.db2.gz	PFFUTARYEDNDBF-KRWDZBQOSA-N	0	3	336.524	3.403	20	30		EGEDHN
C=C[C@H](C(=O)NCCCNCc1ccccc1C#N)c1ccccc1	ZINC001176777510	1385692744	/nfs/dbraw/zinc/69/27/44/1385692744.db2.gz	CCDICXUFSNFNTC-FQEVSTJZSA-N	0	3	333.435	3.124	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2cc(C(C)C)no2)CCCC1	ZINC001318656416	1385820584	/nfs/dbraw/zinc/82/05/84/1385820584.db2.gz	STEZCVDJOQXIDS-UHFFFAOYSA-N	0	3	325.840	3.183	20	30		EGEDHN
C=CCCC(=O)N(CCCNCc1cc(C)no1)CC1CCCC1	ZINC001177241992	1385881269	/nfs/dbraw/zinc/88/12/69/1385881269.db2.gz	DGEAXRMWUINLHM-UHFFFAOYSA-N	0	3	333.476	3.448	20	30		EGEDHN
C=CCCCC(=O)N(CCCNCc1nccn1C)CC1CCCC1	ZINC001177397783	1385942496	/nfs/dbraw/zinc/94/24/96/1385942496.db2.gz	FNFVZWMBMWKSPN-UHFFFAOYSA-N	0	3	346.519	3.275	20	30		EGEDHN
Cc1ccccc1C1(C(=O)NCCCNCc2ccccc2C#N)CC1	ZINC001177441248	1385958207	/nfs/dbraw/zinc/95/82/07/1385958207.db2.gz	XJBFRJWICLUOQI-UHFFFAOYSA-N	0	3	347.462	3.194	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@@H]1CNCc1cccc(Cl)n1	ZINC001319102285	1385960829	/nfs/dbraw/zinc/96/08/29/1385960829.db2.gz	RDRWLZLWXZTWOK-MRXNPFEDSA-N	0	3	333.863	3.009	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)C1(C)C(C)(C)C1(C)C	ZINC001177540941	1385990153	/nfs/dbraw/zinc/99/01/53/1385990153.db2.gz	XHWGLVUHEXEVTN-UHFFFAOYSA-N	0	3	331.298	3.063	20	30		EGEDHN
CC(C)=CC(=O)NCCCCCCNCc1cc(F)ccc1C#N	ZINC001177824325	1386057741	/nfs/dbraw/zinc/05/77/41/1386057741.db2.gz	JBHDECSEGHQOGL-UHFFFAOYSA-N	0	3	331.435	3.430	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2cccc(Cl)c2)CCN1C(=O)C(C)(C)F	ZINC001178026649	1386111036	/nfs/dbraw/zinc/11/10/36/1386111036.db2.gz	WNTBBVITVQYALL-BBRMVZONSA-N	0	3	336.838	3.019	20	30		EGEDHN
C#CCCCC(=O)NCCCCCCNCc1nc(C)c(C)s1	ZINC001178327623	1386189880	/nfs/dbraw/zinc/18/98/80/1386189880.db2.gz	LOYOAVQJHLHVNJ-UHFFFAOYSA-N	0	3	335.517	3.330	20	30		EGEDHN
N#Cc1ccccc1CNCCCCCCNC(=O)[C@H]1C[C@@H]1C(F)F	ZINC001178377663	1386201702	/nfs/dbraw/zinc/20/17/02/1386201702.db2.gz	ZROAHBPRCPOCMQ-IRXDYDNUSA-N	0	3	349.425	3.226	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2cnn(C(C)C)c2C)CCCC1	ZINC001698635586	1406280021	/nfs/dbraw/zinc/28/00/21/1406280021.db2.gz	QXTUUECTHDQXFS-UHFFFAOYSA-N	0	3	338.883	3.157	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccc(Cl)cc2)CCN1C(=O)[C@@H]1CC1(C)C	ZINC001178481932	1386230718	/nfs/dbraw/zinc/23/07/18/1386230718.db2.gz	SMGHIQUNMVNIQG-WBAXXEDZSA-N	0	3	344.886	3.317	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](NCc2ccnc(Cl)c2)[C@@H]1C	ZINC001178503744	1386237788	/nfs/dbraw/zinc/23/77/88/1386237788.db2.gz	OFIBVQOVHOSOHJ-HOCLYGCPSA-N	0	3	333.863	3.008	20	30		EGEDHN
CC[C@H](C)CC(=O)N1CC[C@H](NCc2cc(C#N)ccc2OC)[C@@H]1C	ZINC001178566540	1386250023	/nfs/dbraw/zinc/25/00/23/1386250023.db2.gz	GDZNMKNVPGJZMS-MPGHIAIKSA-N	0	3	343.471	3.082	20	30		EGEDHN
C#CCOCCC(=O)N1CC[C@H](N[C@H](C)c2ccccc2Cl)[C@@H]1C	ZINC001178689208	1386278724	/nfs/dbraw/zinc/27/87/24/1386278724.db2.gz	NRCVBXCBKVIVQJ-VKJFTORMSA-N	0	3	348.874	3.020	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)Cc2ccc(OC)cc2)CCCC1	ZINC001698637907	1406284524	/nfs/dbraw/zinc/28/45/24/1406284524.db2.gz	AIUQPYCORUYTII-UHFFFAOYSA-N	0	3	336.863	3.009	20	30		EGEDHN
CCC(C)(C)CC(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C	ZINC001178781703	1386302031	/nfs/dbraw/zinc/30/20/31/1386302031.db2.gz	QMYANYMABFYFNP-HKUYNNGSSA-N	0	3	326.484	3.443	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](NCc2cccc(Cl)n2)[C@@H]1C	ZINC001178791812	1386305816	/nfs/dbraw/zinc/30/58/16/1386305816.db2.gz	UWFNHFNXXWMLAN-ZFWWWQNUSA-N	0	3	335.879	3.416	20	30		EGEDHN
CC(C)[C@H](CNC(=O)C1(C)CCC1)NCc1cc(C#N)ccc1F	ZINC001319936589	1386403484	/nfs/dbraw/zinc/40/34/84/1386403484.db2.gz	QMGBNLUIMPTSTA-KRWDZBQOSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCCCCCNCc1nccn1CC	ZINC001179307046	1386445827	/nfs/dbraw/zinc/44/58/27/1386445827.db2.gz	PMFTYZQFXUDZRR-SJORKVTESA-N	0	3	334.508	3.127	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCCCCCCN[C@H](C)c1nnc(CC)[nH]1	ZINC001179339576	1386455287	/nfs/dbraw/zinc/45/52/87/1386455287.db2.gz	HUPFBLQWYHBPAB-JKSUJKDBSA-N	0	3	349.523	3.297	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCCCCCCN[C@@H](C)c1nnc(CC)[nH]1	ZINC001179339574	1386455813	/nfs/dbraw/zinc/45/58/13/1386455813.db2.gz	HUPFBLQWYHBPAB-HOTGVXAUSA-N	0	3	349.523	3.297	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)CCCC(F)(F)F)C1CC1	ZINC001698648296	1406297317	/nfs/dbraw/zinc/29/73/17/1406297317.db2.gz	CSWMCXIKXNROSJ-ZDUSSCGKSA-N	0	3	326.790	3.346	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](NCc2cccc(NC(C)=O)c2)[C@@H]1C	ZINC001179451941	1386484664	/nfs/dbraw/zinc/48/46/64/1386484664.db2.gz	KQKNIVVEQXCUER-KXBFYZLASA-N	0	3	343.471	3.080	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1ccc(F)cc1F)C1CC1	ZINC001698654991	1406304954	/nfs/dbraw/zinc/30/49/54/1406304954.db2.gz	YKMOICIMLALVPF-INIZCTEOSA-N	0	3	328.790	3.205	20	30		EGEDHN
C#CCCCCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2cnc(C)o2)C1	ZINC001182207942	1387121068	/nfs/dbraw/zinc/12/10/68/1387121068.db2.gz	KFQZVXLDFKRKFB-OXQOHEQNSA-N	0	3	345.487	3.141	20	30		EGEDHN
CCCCN(CC)[C@@H](C(=O)NC1(C#N)CCOCC1)c1ccccc1	ZINC001182235337	1387128421	/nfs/dbraw/zinc/12/84/21/1387128421.db2.gz	IOWWBPGUJSMYRE-GOSISDBHSA-N	0	3	343.471	3.039	20	30		EGEDHN
CC#CCCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2nc(C)cs2)C1	ZINC001182293623	1387140465	/nfs/dbraw/zinc/14/04/65/1387140465.db2.gz	DLTKKQRTRNBIKH-DNVCBOLYSA-N	0	3	347.528	3.219	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H](C)CN(C)Cc2ccc(C#N)cc2)c(C)c1	ZINC001322285834	1387141203	/nfs/dbraw/zinc/14/12/03/1387141203.db2.gz	PSPJFYWBVZMYJT-KRWDZBQOSA-N	0	3	335.451	3.425	20	30		EGEDHN
C=Cc1ccc(C(=O)NC[C@@H](C)N(C)Cc2ccc(C#N)cc2)cc1	ZINC001329562786	1389159105	/nfs/dbraw/zinc/15/91/05/1389159105.db2.gz	YUTMWWBNKXMNLR-MRXNPFEDSA-N	0	3	333.435	3.452	20	30		EGEDHN
CCCC[C@H](CNCc1ccc(C#N)s1)NC(=O)c1ccoc1	ZINC001329873635	1389240672	/nfs/dbraw/zinc/24/06/72/1389240672.db2.gz	ABGJYMBWIDZNSZ-CQSZACIVSA-N	0	3	331.441	3.291	20	30		EGEDHN
O=C(C1CCC=CCC1)N1CCC[C@@H]1CNCC#Cc1ccccc1	ZINC001698734301	1406383183	/nfs/dbraw/zinc/38/31/83/1406383183.db2.gz	LKBWTXCSUICHCJ-OAQYLSRUSA-N	0	3	336.479	3.365	20	30		EGEDHN
C=CCC[C@@H]1CCCN1C(=O)[C@@H]1CCCN(Cc2cccnc2)C1	ZINC001339281408	1389973062	/nfs/dbraw/zinc/97/30/62/1389973062.db2.gz	QWXGUKUPYGZJNA-RTBURBONSA-N	0	3	327.472	3.251	20	30		EGEDHN
C=CCN(CC=C)C(=O)c1ccc(NC(=O)[C@H](N)C[C@H](C)CC)cc1	ZINC001339858874	1390177236	/nfs/dbraw/zinc/17/72/36/1390177236.db2.gz	VIVHRDOQBDKUMN-CRAIPNDOSA-N	0	3	343.471	3.203	20	30		EGEDHN
COc1ccc(-c2nc(C)c([C@H](C)NC[C@H](O)CC#N)s2)cc1	ZINC001332854915	1390201015	/nfs/dbraw/zinc/20/10/15/1390201015.db2.gz	URINNFGKHFBIMO-SMDDNHRTSA-N	0	3	331.441	3.052	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)NCc1ccc(OC)c(OC2CCCC2)c1	ZINC001340048346	1390215518	/nfs/dbraw/zinc/21/55/18/1390215518.db2.gz	WQSUGXKGSBSOBY-KRWDZBQOSA-N	0	3	346.471	3.316	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N[C@@H](c1c(F)cccc1F)C(F)(F)F	ZINC001340428013	1390287476	/nfs/dbraw/zinc/28/74/76/1390287476.db2.gz	FCZBKDNONZRHAW-AAEUAGOBSA-N	0	3	336.304	3.368	20	30		EGEDHN
N#Cc1cccnc1NCCNCc1cc(F)cc(C(F)(F)F)c1	ZINC001340817964	1390375870	/nfs/dbraw/zinc/37/58/70/1390375870.db2.gz	KYLRHICNAPSTCQ-UHFFFAOYSA-N	0	3	338.308	3.313	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)Nc1cccc2c1N(C)C(=O)CO2	ZINC001340868722	1390389681	/nfs/dbraw/zinc/38/96/81/1390389681.db2.gz	RTYNSUXOHBANNU-CQSZACIVSA-N	0	3	347.459	3.058	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1cccc(C[S@@](=O)C(C)(C)C)c1	ZINC001341568130	1390503806	/nfs/dbraw/zinc/50/38/06/1390503806.db2.gz	WUMLJPLNFLCEGF-WAIKUNEKSA-N	0	3	336.501	3.356	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)CCc1ccc2c(c1)CCO2	ZINC001341924348	1390550391	/nfs/dbraw/zinc/55/03/91/1390550391.db2.gz	ISDHTPPNDOSXAA-INIZCTEOSA-N	0	3	345.402	3.317	20	30		EGEDHN
CC(C)Cn1c([C@@H](C)CCC#N)nnc1N1CCN(C(C)(C)C)CC1	ZINC001344846543	1390818779	/nfs/dbraw/zinc/81/87/79/1390818779.db2.gz	BHUAFELULBSMDQ-INIZCTEOSA-N	0	3	346.523	3.262	20	30		EGEDHN
CCn1ncc(C(=O)C(C#N)c2nc3c(cccc3Cl)[nH]2)c1C	ZINC001345673345	1390874770	/nfs/dbraw/zinc/87/47/70/1390874770.db2.gz	MDNILMWNYYBUOD-SNVBAGLBSA-N	0	3	327.775	3.231	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)C[C@H](C)Cc1ccccc1OC	ZINC001346096552	1390907266	/nfs/dbraw/zinc/90/72/66/1390907266.db2.gz	QVLQYHNRGNNKAZ-ZBFHGGJFSA-N	0	3	325.412	3.357	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCSc1ccc(OC)cc1	ZINC001346096555	1390907273	/nfs/dbraw/zinc/90/72/73/1390907273.db2.gz	RAWVRFRXBDGDML-HNNXBMFYSA-N	0	3	329.425	3.270	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CNCc1cc(Cl)ccc1Br	ZINC001346289093	1390920020	/nfs/dbraw/zinc/92/00/20/1390920020.db2.gz	SAZJJYVHNIUJJF-LBPRGKRZSA-N	0	3	345.668	3.493	20	30		EGEDHN
CCc1ccc(CC(=O)C(C#N)C(=O)N[C@H](CC)c2ccccc2)nc1	ZINC001348268637	1391196463	/nfs/dbraw/zinc/19/64/63/1391196463.db2.gz	BCICXRJIPWBFOB-RTBURBONSA-N	0	3	349.434	3.163	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CCc2scnc2C)CCCC1	ZINC001698806702	1406488815	/nfs/dbraw/zinc/48/88/15/1406488815.db2.gz	HEKKBXVSZUOMNB-UHFFFAOYSA-N	0	3	341.908	3.155	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)NCc1ccc(Oc2cccc(F)c2)nc1	ZINC001353526968	1392031880	/nfs/dbraw/zinc/03/18/80/1392031880.db2.gz	QOVVSLIMYOJAFB-KRWDZBQOSA-N	0	3	343.402	3.313	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)[C@@](C)(F)CCCC)C1	ZINC001479377419	1392228357	/nfs/dbraw/zinc/22/83/57/1392228357.db2.gz	MXNOVJLXSAOWDU-YDHLFZDLSA-N	0	3	349.288	3.298	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1cnc2ccccn21	ZINC001479828010	1392415452	/nfs/dbraw/zinc/41/54/52/1392415452.db2.gz	VGRYUBSPGOHXOW-CABCVRRESA-N	0	3	346.862	3.060	20	30		EGEDHN
CCC1(C(=O)NC2C[C@H]3CC[C@@H](C2)N3Cc2cccc(C#N)c2)CC1	ZINC001480181186	1392613125	/nfs/dbraw/zinc/61/31/25/1392613125.db2.gz	QASIFWXOSYALIE-YQQQUEKLSA-N	0	3	337.467	3.360	20	30		EGEDHN
COc1ccc(CN[C@@H](C)CNC(=O)CC2CCCCC2)cc1C#N	ZINC001480420134	1392750374	/nfs/dbraw/zinc/75/03/74/1392750374.db2.gz	FPTSHOLLLFFPBA-HNNXBMFYSA-N	0	3	343.471	3.132	20	30		EGEDHN
C[C@@H](CNC(=O)c1cccc(C(F)F)c1)NCc1ccc(C#N)s1	ZINC001480575147	1392797833	/nfs/dbraw/zinc/79/78/33/1392797833.db2.gz	MOMDYBBFJZSQNS-NSHDSACASA-N	0	3	349.406	3.465	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)CCc1ccc(F)cc1F	ZINC001480801423	1392942030	/nfs/dbraw/zinc/94/20/30/1392942030.db2.gz	WZYNXGRQIKDPQD-GFCCVEGCSA-N	0	3	330.806	3.134	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCN(C(=O)CCCC2CC2)C1	ZINC001481493633	1394338775	/nfs/dbraw/zinc/33/87/75/1394338775.db2.gz	CSKNXLIFLFOGKM-INIZCTEOSA-N	0	3	345.512	3.480	20	30		EGEDHN
N#Cc1ccc(CNCC2(NC(=O)[C@H]3CC34CC4)CCCC2)c(F)c1	ZINC001481906777	1394590707	/nfs/dbraw/zinc/59/07/07/1394590707.db2.gz	SAXDIQCFGQJCCN-MRXNPFEDSA-N	0	3	341.430	3.016	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@@H]1CNCc1cc(F)ccc1OC	ZINC001482061851	1394722504	/nfs/dbraw/zinc/72/25/04/1394722504.db2.gz	PDHRBVLBYKJGTR-GOSISDBHSA-N	0	3	346.446	3.109	20	30		EGEDHN
Cc1cccc(CCC(=O)NC[C@H](C)CNCc2ccccc2C#N)c1	ZINC001482126874	1394759494	/nfs/dbraw/zinc/75/94/94/1394759494.db2.gz	DBIJIRWHIATFJF-GOSISDBHSA-N	0	3	349.478	3.341	20	30		EGEDHN
CCC(C)(C)C(=O)NC[C@@H](NCc1cc(C#N)ccc1F)C(C)C	ZINC001698975582	1406744186	/nfs/dbraw/zinc/74/41/86/1406744186.db2.gz	NDLLWRLLKBKEPD-QGZVFWFLSA-N	0	3	333.451	3.364	20	30		EGEDHN
CCCC[C@@H](CNCc1ccc(C#N)s1)NC(=O)c1ccccn1	ZINC001485460129	1395934856	/nfs/dbraw/zinc/93/48/56/1395934856.db2.gz	ITWDUCWCWVFHIA-AWEZNQCLSA-N	0	3	342.468	3.093	20	30		EGEDHN
CC(C)CCC(=O)N1CC[C@H](NCc2ccccc2C#N)[C@H](C)C1	ZINC001496329504	1396652460	/nfs/dbraw/zinc/65/24/60/1396652460.db2.gz	JBHCNWMQYDGNNA-APWZRJJASA-N	0	3	327.472	3.321	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1sc(C)nc1C	ZINC001689912097	1404205723	/nfs/dbraw/zinc/20/57/23/1404205723.db2.gz	QCMLJQQAKBELCU-FZMZJTMJSA-N	0	3	341.908	3.485	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1CCN(Cc2cccc(OC)c2C)C1	ZINC001690100661	1404300014	/nfs/dbraw/zinc/30/00/14/1404300014.db2.gz	VYEITSFRUFOOQQ-IBGZPJMESA-N	0	3	342.483	3.278	20	30		EGEDHN
CC(C)CC1(C(=O)NC[C@H](C)NCc2ccc(C#N)s2)CCC1	ZINC001690599827	1404646374	/nfs/dbraw/zinc/64/63/74/1404646374.db2.gz	INWFQKMKINQOMT-AWEZNQCLSA-N	0	3	333.501	3.430	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)[C@@H](CC)CCC)C1	ZINC001691120432	1405062495	/nfs/dbraw/zinc/06/24/95/1405062495.db2.gz	UMXAJZNLVQITCJ-MELADBBJSA-N	0	3	331.298	3.206	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@H](CC)Cc2ccccc2)C1	ZINC001691742830	1405464026	/nfs/dbraw/zinc/46/40/26/1405464026.db2.gz	MCBVGQNQFIKFAL-KURKYZTESA-N	0	3	334.891	3.492	20	30		EGEDHN
CCC(CC)C(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1	ZINC001692332259	1405951121	/nfs/dbraw/zinc/95/11/21/1405951121.db2.gz	NQFGKHINAVZYPN-UHFFFAOYSA-N	0	3	331.435	3.118	20	30		EGEDHN
COc1ccc(Cl)c(CNCC2(NC(=O)[C@H](C)C#N)CCCC2)c1	ZINC001732227552	1428475379	/nfs/dbraw/zinc/47/53/79/1428475379.db2.gz	XBPIGWUUDNVHLL-CYBMUJFWSA-N	0	3	349.862	3.027	20	30		EGEDHN
C=C(Br)CNCC1(NC(=O)c2cc(C)co2)CCCC1	ZINC001732233019	1428479812	/nfs/dbraw/zinc/47/98/12/1428479812.db2.gz	QJVPVWWALJTPIM-UHFFFAOYSA-N	0	3	341.249	3.129	20	30		EGEDHN
Cc1cccc(C(=O)N[C@@H](C)CN(C)Cc2ccc(C#N)cc2)c1F	ZINC001699441952	1412771499	/nfs/dbraw/zinc/77/14/99/1412771499.db2.gz	NCBXTACYHDWFPO-HNNXBMFYSA-N	0	3	339.414	3.256	20	30		EGEDHN
C[C@H](CN(C)Cc1cccc(C#N)c1)NC(=O)c1ccc(F)c(F)c1	ZINC001699445933	1412779943	/nfs/dbraw/zinc/77/99/43/1412779943.db2.gz	JEDADWAPCRASSH-CYBMUJFWSA-N	0	3	343.377	3.087	20	30		EGEDHN
CC(F)(F)CC(=O)NC[C@]1(C)CCCN(Cc2ccc(C#N)cc2)C1	ZINC001699875644	1413331828	/nfs/dbraw/zinc/33/18/28/1413331828.db2.gz	WETUXOQJYGGCLQ-SFHVURJKSA-N	0	3	349.425	3.322	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cc(C)c(OC)c(C)c1)C(C)C	ZINC001732559239	1428748296	/nfs/dbraw/zinc/74/82/96/1428748296.db2.gz	PTGKLKBWMYIWIU-MRXNPFEDSA-N	0	3	338.879	3.409	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1ccc2cccnc2c1)C(C)C	ZINC001732567560	1428761211	/nfs/dbraw/zinc/76/12/11/1428761211.db2.gz	JAFKAGXRYOFFQA-QGZVFWFLSA-N	0	3	331.847	3.331	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cc2c(cccc2OC)[nH]1)C(C)C	ZINC001732570968	1428765712	/nfs/dbraw/zinc/76/57/12/1428765712.db2.gz	UPLMSWKZCPKZFH-MRXNPFEDSA-N	0	3	349.862	3.273	20	30		EGEDHN
CN(C(=O)C1(C)CCC1)[C@H](CNCc1cc(C#N)ccc1F)C1CC1	ZINC001700729946	1414393148	/nfs/dbraw/zinc/39/31/48/1414393148.db2.gz	YLOKYSANGDTMGC-GOSISDBHSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)Cc2cccc(C)c2Cl)C1	ZINC001707084666	1417191960	/nfs/dbraw/zinc/19/19/60/1417191960.db2.gz	YJFXBGKCHYIETM-CTYIDZIISA-N	0	3	341.282	3.428	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)C(C)(C)Cc2ccccc2)C1	ZINC001707087249	1417194386	/nfs/dbraw/zinc/19/43/86/1417194386.db2.gz	GFGYCSFAQVAQAL-QAQDUYKDSA-N	0	3	334.891	3.492	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)Cc2c[nH]c3ccc(F)cc23)C1	ZINC001707091012	1417197060	/nfs/dbraw/zinc/19/70/60/1417197060.db2.gz	OATBJBTTYZUKNA-NNUKFRKNSA-N	0	3	349.837	3.086	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1ccccc1OC	ZINC001707439036	1417343194	/nfs/dbraw/zinc/34/31/94/1417343194.db2.gz	CCEHTLXDFLRMFU-ZBFHGGJFSA-N	0	3	336.863	3.421	20	30		EGEDHN
CCN(CCNC(=O)CCc1ccccc1)Cc1ccc(C#N)cc1	ZINC001713495596	1418202442	/nfs/dbraw/zinc/20/24/42/1418202442.db2.gz	OVSIVDOZCXZBJT-UHFFFAOYSA-N	0	3	335.451	3.129	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](CCNC(=O)C3CC4(CC4)C3)C2)s1	ZINC001713736902	1418532177	/nfs/dbraw/zinc/53/21/77/1418532177.db2.gz	UNRICXDMLFVNHP-AWEZNQCLSA-N	0	3	343.496	3.138	20	30		EGEDHN
CC(C)CCC(=O)N(C)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001713781543	1418597187	/nfs/dbraw/zinc/59/71/87/1418597187.db2.gz	IZZULIONVRCUDE-UHFFFAOYSA-N	0	3	327.472	3.417	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@H](NC(=O)CCC3CCC3)C2)c(F)c1	ZINC001713945567	1418732506	/nfs/dbraw/zinc/73/25/06/1418732506.db2.gz	HIRSHMBVEJHOCP-QAQDUYKDSA-N	0	3	329.419	3.014	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2ccc(F)c(OC)c2)CCCC1	ZINC001714141076	1418943490	/nfs/dbraw/zinc/94/34/90/1418943490.db2.gz	GCRPFZLDCAWHKV-UHFFFAOYSA-N	0	3	340.826	3.219	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1ccc(OC)cc1C)C1CC1	ZINC001714170798	1418978879	/nfs/dbraw/zinc/97/88/79/1418978879.db2.gz	YEKBTTBOKDUEIR-GOSISDBHSA-N	0	3	336.863	3.244	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)Cc1cc(C)cc(C)c1)C1CC1	ZINC001714172103	1418980151	/nfs/dbraw/zinc/98/01/51/1418980151.db2.gz	QEZZKFGRBSZRGV-LJQANCHMSA-N	0	3	334.891	3.473	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1cc2nc(C)ccc2o1)C1CC1	ZINC001714175250	1418982504	/nfs/dbraw/zinc/98/25/04/1418982504.db2.gz	ZWPHRHPQBZNELR-SFHVURJKSA-N	0	3	347.846	3.377	20	30		EGEDHN
COc1ccc(CN[C@H](C)CNC(=O)C(C)(C)CC(C)C)cc1C#N	ZINC001714290550	1419068897	/nfs/dbraw/zinc/06/88/97/1419068897.db2.gz	IFELWOMFGNVCRR-OAHLLOKOSA-N	0	3	345.487	3.233	20	30		EGEDHN
CC(F)(F)CC(=O)N[C@@H]1CCC[C@@H](NCc2ccccc2C#N)C1	ZINC001714410015	1419149450	/nfs/dbraw/zinc/14/94/50/1419149450.db2.gz	CNCSVVBWUGJXFY-HZPDHXFCSA-N	0	3	335.398	3.121	20	30		EGEDHN
CCc1ccsc1C(=O)NCC[C@@H](C)NCc1ccccc1C#N	ZINC001714500651	1419226838	/nfs/dbraw/zinc/22/68/38/1419226838.db2.gz	POWGYMSDJWCVDE-CQSZACIVSA-N	0	3	341.480	3.480	20	30		EGEDHN
CCN(CCNC(=O)[C@@H]1C[C@H]1CC(C)C)Cc1ccc(C#N)cc1	ZINC001714596769	1419349947	/nfs/dbraw/zinc/34/99/47/1419349947.db2.gz	QIOYQYPNIFSCPJ-RTBURBONSA-N	0	3	327.472	3.179	20	30		EGEDHN
CCCC(C)(C)C(=O)N(C)[C@@H](C)CNCc1ccc(F)c(C#N)c1	ZINC001714741614	1419489863	/nfs/dbraw/zinc/48/98/63/1419489863.db2.gz	BGJPIORFDCNFSY-AWEZNQCLSA-N	0	3	333.451	3.460	20	30		EGEDHN
CCc1ccc(C(=O)N(C)[C@H](C)CNCc2ccc(C#N)s2)cc1	ZINC001714845532	1419557556	/nfs/dbraw/zinc/55/75/56/1419557556.db2.gz	JQZVWGLTQKEOFT-CQSZACIVSA-N	0	3	341.480	3.432	20	30		EGEDHN
COc1ccc(C#N)cc1CN[C@@H](CNC(=O)CC(C)(C)C)C(C)C	ZINC001715487420	1420168639	/nfs/dbraw/zinc/16/86/39/1420168639.db2.gz	BJINWSQZYGPLIQ-KRWDZBQOSA-N	0	3	345.487	3.233	20	30		EGEDHN
CC(C)c1ccoc1C(=O)N[C@@H](C)CNCc1ccc(C#N)s1	ZINC001716449975	1420666026	/nfs/dbraw/zinc/66/60/26/1420666026.db2.gz	HRIYSAQLTGXPMX-LBPRGKRZSA-N	0	3	331.441	3.244	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@@H]1CNCc1c(C)nsc1C	ZINC001716777933	1420917831	/nfs/dbraw/zinc/91/78/31/1420917831.db2.gz	AUAYYKQYFGDKFV-OAHLLOKOSA-N	0	3	335.517	3.443	20	30		EGEDHN
CC(C)(C)CC(=O)N[C@@]1(C)CCN(Cc2ccc(OCC#N)cc2)C1	ZINC001716833755	1420960582	/nfs/dbraw/zinc/96/05/82/1420960582.db2.gz	FQPQPJBISHPSAU-FQEVSTJZSA-N	0	3	343.471	3.106	20	30		EGEDHN
Cc1ccc(C)c(C(=O)NC[C@H](C)N(C)Cc2cccc(C#N)c2)c1	ZINC001717496605	1421437999	/nfs/dbraw/zinc/43/79/99/1421437999.db2.gz	MTQKEHLXTJAZQP-KRWDZBQOSA-N	0	3	335.451	3.425	20	30		EGEDHN
CC1(CCC(=O)N2CC[C@](C)(CNCc3ccccc3C#N)C2)CC1	ZINC001733440479	1429647860	/nfs/dbraw/zinc/64/78/60/1429647860.db2.gz	AYKPIIXJANMGCB-OAQYLSRUSA-N	0	3	339.483	3.467	20	30		EGEDHN
CC[C@@H](SC)C(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001724001637	1424622888	/nfs/dbraw/zinc/62/28/88/1424622888.db2.gz	NMQSRZOCWDDQHF-QGZVFWFLSA-N	0	3	345.512	3.171	20	30		EGEDHN
C[C@@]1(CNCc2ccccc2C#N)CCN(C(=O)C2CCCC2)C1	ZINC001724190462	1424722867	/nfs/dbraw/zinc/72/28/67/1424722867.db2.gz	VCMPEMJJIMDIAQ-FQEVSTJZSA-N	0	3	325.456	3.077	20	30		EGEDHN
CC1(C(=O)NCC2(NCc3ccc(F)c(C#N)c3)CCC2)CCCC1	ZINC001724790432	1425156840	/nfs/dbraw/zinc/15/68/40/1425156840.db2.gz	DLKIDUVNLJRXKS-UHFFFAOYSA-N	0	3	343.446	3.406	20	30		EGEDHN
C[C@H](CNC(=O)C1(F)CCCCC1)N(C)Cc1cccc(C#N)c1	ZINC001725189954	1425731684	/nfs/dbraw/zinc/73/16/84/1425731684.db2.gz	WONZOFRCJWDKSH-OAHLLOKOSA-N	0	3	331.435	3.167	20	30		EGEDHN
CCCC1(C(=O)N(C)C[C@H](C)NCc2ccc(F)c(C#N)c2)CC1	ZINC001725506318	1426189138	/nfs/dbraw/zinc/18/91/38/1426189138.db2.gz	LZHNVQNKJDOQIK-AWEZNQCLSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=C(Cl)CNC1CC(N(C)C(=O)CCc2cc(F)ccc2F)C1	ZINC001725789138	1426474918	/nfs/dbraw/zinc/47/49/18/1426474918.db2.gz	GMHGWRWKYHQQNR-UHFFFAOYSA-N	0	3	342.817	3.229	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H](CNC(=O)CCC2CCC2)C2CC2)c1	ZINC001731400847	1427361162	/nfs/dbraw/zinc/36/11/62/1427361162.db2.gz	UMKXPXYDKHURBL-LJQANCHMSA-N	0	3	343.446	3.262	20	30		EGEDHN
Cc1cc(C(=O)NC[C@H](C)NCc2ccc(C#N)s2)c(C)s1	ZINC001731604489	1427648453	/nfs/dbraw/zinc/64/84/53/1427648453.db2.gz	RWDWKUROTGULSE-JTQLQIEISA-N	0	3	333.482	3.206	20	30		EGEDHN
C[C@@H](CNC(=O)C1(C(F)F)CCCC1)N(C)Cc1cccc(C#N)c1	ZINC001734051763	1437841444	/nfs/dbraw/zinc/84/14/44/1437841444.db2.gz	QMRYRPIKJIQZSI-AWEZNQCLSA-N	0	3	349.425	3.320	20	30		EGEDHN
CCCC[C@@H](CNCc1ccc(C#N)s1)NC(=O)c1ccn(C)c1	ZINC001734094192	1437878668	/nfs/dbraw/zinc/87/86/68/1437878668.db2.gz	GNDYLDZULBPFPU-HNNXBMFYSA-N	0	3	344.484	3.037	20	30		EGEDHN
C#CCCCCC(=O)N1CCCC[C@H]1[C@@H](C)NCc1c(C)noc1C	ZINC001752143559	1440145250	/nfs/dbraw/zinc/14/52/50/1440145250.db2.gz	UDQLWMXTXOEQRZ-APWZRJJASA-N	0	3	345.487	3.344	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1cc(C(F)F)n[nH]1	ZINC001752156591	1440147411	/nfs/dbraw/zinc/14/74/11/1440147411.db2.gz	HRTQXDIWQBLFRU-MFKMUULPSA-N	0	3	346.809	3.073	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)CCc1cscn1	ZINC001752159261	1440148543	/nfs/dbraw/zinc/14/85/43/1440148543.db2.gz	ZEZLABUOSFIKMT-DZGCQCFKSA-N	0	3	341.908	3.187	20	30		EGEDHN
CCN(CCCNC(=O)[C@H]1CC[C@H](F)C1)Cc1ccc(C#N)s1	ZINC001752208363	1440154430	/nfs/dbraw/zinc/15/44/30/1440154430.db2.gz	VVYJFSLTTUVDCY-KBPBESRZSA-N	0	3	337.464	3.086	20	30		EGEDHN
C=C(C)CN1CCN(CCCNC(=O)C[C@@H]2CCCCC2(C)C)CC1	ZINC001752361007	1440172143	/nfs/dbraw/zinc/17/21/43/1440172143.db2.gz	RPQJBLTZOFVIQH-IBGZPJMESA-N	0	3	349.563	3.293	20	30		EGEDHN
C[C@@H](C#N)C(=O)N[C@@H]1CC12CCN(Cc1cccc(C(F)F)c1)CC2	ZINC001752424189	1440176533	/nfs/dbraw/zinc/17/65/33/1440176533.db2.gz	SSQIBNXNKWKQGX-XJKSGUPXSA-N	0	3	347.409	3.255	20	30		EGEDHN
Cc1cc(C(=O)N[C@H]2C[C@@H](NCC#Cc3ccccc3)C2)c(C)s1	ZINC001752741353	1440204548	/nfs/dbraw/zinc/20/45/48/1440204548.db2.gz	SOBIZSPYUWSPIK-HDICACEKSA-N	0	3	338.476	3.267	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)CCCOc2ccccc2C)C1	ZINC001752751450	1440204920	/nfs/dbraw/zinc/20/49/20/1440204920.db2.gz	UNBUFFKHSPDWEG-IYBDPMFKSA-N	0	3	336.863	3.143	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)CCOc2ccccc2CC)C1	ZINC001752772635	1440206170	/nfs/dbraw/zinc/20/61/70/1440206170.db2.gz	HPGWRMXSYJKWKR-IYBDPMFKSA-N	0	3	336.863	3.007	20	30		EGEDHN
CC[C@@H](SC)C(=O)NC[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001752780214	1440208740	/nfs/dbraw/zinc/20/87/40/1440208740.db2.gz	UPHVIZICMMOODL-ZWKOTPCHSA-N	0	3	345.512	3.028	20	30		EGEDHN
C[C@H](C(=O)NC[C@@H]1CCCN(Cc2ccc(C#N)cc2)C1)C(C)(F)F	ZINC001752786941	1440211668	/nfs/dbraw/zinc/21/16/68/1440211668.db2.gz	CMDKLIGCWGUXEL-PBHICJAKSA-N	0	3	349.425	3.178	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)Cc2c(C)oc3ccccc32)C1	ZINC001752792186	1440213953	/nfs/dbraw/zinc/21/39/53/1440213953.db2.gz	IUFIETJNZJSZDT-KRWDZBQOSA-N	0	3	338.451	3.135	20	30		EGEDHN
CCc1ccc(CN2CCCC[C@H]2CNC(=O)C#CC(C)C)cc1	ZINC001752818726	1440219235	/nfs/dbraw/zinc/21/92/35/1440219235.db2.gz	IGTZLKONTVAZLC-FQEVSTJZSA-N	0	3	326.484	3.379	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](CNCc2csc(C3CC3)n2)C1	ZINC001752935906	1440250399	/nfs/dbraw/zinc/25/03/99/1440250399.db2.gz	VPRIZINZEIRSIU-OAHLLOKOSA-N	0	3	345.512	3.152	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)c1occc1C(C)C	ZINC001753011996	1440267210	/nfs/dbraw/zinc/26/72/10/1440267210.db2.gz	JVMCJGKZBPQKLY-GFCCVEGCSA-N	0	3	343.265	3.410	20	30		EGEDHN
C[C@H](CCNC(=O)c1cc(F)cc(F)c1)NCc1ccccc1C#N	ZINC001753018533	1440269216	/nfs/dbraw/zinc/26/92/16/1440269216.db2.gz	NVHGWZJCWPCVDY-CYBMUJFWSA-N	0	3	343.377	3.135	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)NCCN(C)[C@@H](C)c1ccc(Cl)cc1	ZINC001753064764	1440284920	/nfs/dbraw/zinc/28/49/20/1440284920.db2.gz	VUCFECJVPWKMRJ-XKQJLSEDSA-N	0	3	336.863	3.040	20	30		EGEDHN
CCN(CCNC(=O)c1ccc(C)cc1C)Cc1cccc(C#N)c1	ZINC001753093664	1440301070	/nfs/dbraw/zinc/30/10/70/1440301070.db2.gz	DSTIQTUFNOVTPY-UHFFFAOYSA-N	0	3	335.451	3.427	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NC[C@H]1CCN(Cc2ccccc2F)C1)OCC	ZINC001753129557	1440316147	/nfs/dbraw/zinc/31/61/47/1440316147.db2.gz	OLHCHLSNYBNPHQ-VQIMIIECSA-N	0	3	348.462	3.135	20	30		EGEDHN
CCCN(CCNC(=O)[C@@H]1CC=CCC1)Cc1ccc(C#N)c(F)c1	ZINC001753141895	1440321648	/nfs/dbraw/zinc/32/16/48/1440321648.db2.gz	IIWXUUITASYOTI-QGZVFWFLSA-N	0	3	343.446	3.382	20	30		EGEDHN
CCCN(CCNC(=O)c1cc(Cl)c[nH]1)Cc1cccc(C#N)c1	ZINC001753141816	1440321729	/nfs/dbraw/zinc/32/17/29/1440321729.db2.gz	GIUUNCQWPRVGFT-UHFFFAOYSA-N	0	3	344.846	3.182	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCN(CCC)Cc2ccc(C#N)cc2)C1	ZINC001753147856	1440325616	/nfs/dbraw/zinc/32/56/16/1440325616.db2.gz	QJJDXKDHSPLVHG-UHFFFAOYSA-N	0	3	325.456	3.243	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NCCN(CC1=CCCCC1)C1CC1	ZINC001753162675	1440334808	/nfs/dbraw/zinc/33/48/08/1440334808.db2.gz	PFBHGSVUBPLZOE-UHFFFAOYSA-N	0	3	336.479	3.291	20	30		EGEDHN
Cc1scc(C(=O)N(C)CCNCc2ccc(F)c(C#N)c2)c1C	ZINC001753192646	1440337661	/nfs/dbraw/zinc/33/76/61/1440337661.db2.gz	QRHAMVROVUHGKW-UHFFFAOYSA-N	0	3	345.443	3.238	20	30		EGEDHN
C#CCCN[C@@H](CNC(=O)c1cc(C(C)(C)C)on1)c1ccccc1	ZINC001753299781	1440353613	/nfs/dbraw/zinc/35/36/13/1440353613.db2.gz	HNHMUOXZZRMZHP-KRWDZBQOSA-N	0	3	339.439	3.056	20	30		EGEDHN
C#CCCN[C@@H](CNC(=O)Cc1cc(C)ccc1F)c1ccccc1	ZINC001753302897	1440354765	/nfs/dbraw/zinc/35/47/65/1440354765.db2.gz	LYKKNBPVKVFBCL-FQEVSTJZSA-N	0	3	338.426	3.147	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)NCC[C@H]1CCN(Cc2ccc(C#N)c(F)c2)C1	ZINC001753326107	1440366623	/nfs/dbraw/zinc/36/66/23/1440366623.db2.gz	GZXIGXPBCZKPEF-YOEHRIQHSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=C(C)CCC(=O)NCC[C@H]1CCN(Cc2ccc(F)c(C#N)c2)C1	ZINC001753332860	1440370336	/nfs/dbraw/zinc/37/03/36/1440370336.db2.gz	XCWPDVOBJSDXPQ-INIZCTEOSA-N	0	3	343.446	3.382	20	30		EGEDHN
C=C(C)CCC(=O)NCC[C@H]1CCN(Cc2cnn(C(C)(C)C)c2)C1	ZINC001753332574	1440370463	/nfs/dbraw/zinc/37/04/63/1440370463.db2.gz	QJYXOOHDKOSMJZ-KRWDZBQOSA-N	0	3	346.519	3.323	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCC[C@@H]1CCN(Cc2ccccc2C#N)C1	ZINC001753336639	1440372860	/nfs/dbraw/zinc/37/28/60/1440372860.db2.gz	XKRSYDUTSUAFRU-ZWKOTPCHSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](CN(C)Cc3oc(C)nc3C)C2)CCC1	ZINC001753355657	1440379882	/nfs/dbraw/zinc/37/98/82/1440379882.db2.gz	RQRCLGDDMMBHDI-QGZVFWFLSA-N	0	3	345.487	3.318	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H]2C[C@H]1CN2C(=O)c1c(C)noc1C(C)C	ZINC001753421981	1440395633	/nfs/dbraw/zinc/39/56/33/1440395633.db2.gz	DXVHEFIDVQQNNT-KBMXLJTQSA-N	0	3	331.460	3.360	20	30		EGEDHN
C=CCCCN1C[C@@H]2C[C@H]1CN2C(=O)C[C@@H](C)c1ccccc1OC	ZINC001753426753	1440397141	/nfs/dbraw/zinc/39/71/41/1440397141.db2.gz	OGUSOEBJBKRKDG-SQNIBIBYSA-N	0	3	342.483	3.440	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)[C@H](CC)OC2CCCCC2)C1	ZINC001753455380	1440407972	/nfs/dbraw/zinc/40/79/72/1440407972.db2.gz	JHDSNQPFOVHNAA-MJGOQNOKSA-N	0	3	334.504	3.060	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)Cc2csc(C(C)(C)C)n2)C1	ZINC001753459755	1440410018	/nfs/dbraw/zinc/41/00/18/1440410018.db2.gz	SVAFXKMBLTVPFO-MRXNPFEDSA-N	0	3	349.544	3.482	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)CCCc2sccc2C)C1	ZINC001753462628	1440411660	/nfs/dbraw/zinc/41/16/60/1440411660.db2.gz	YDTCYWSAYOETGJ-KRWDZBQOSA-N	0	3	332.513	3.325	20	30		EGEDHN
CC[C@@H](CNC(=O)[C@@H]1CC=CCC1)NCc1ccc(C#N)c(F)c1	ZINC001753466429	1440412920	/nfs/dbraw/zinc/41/29/20/1440412920.db2.gz	KQBIGHIVCFDWAR-WBVHZDCISA-N	0	3	329.419	3.038	20	30		EGEDHN
CC[C@@H](CNC(=O)c1cc(C)c(C)o1)NCC#Cc1ccc(F)cc1	ZINC001753469825	1440413739	/nfs/dbraw/zinc/41/37/39/1440413739.db2.gz	HFKNDMAXSYUFEE-SFHVURJKSA-N	0	3	342.414	3.185	20	30		EGEDHN
CC[C@@H](CNC(=O)C1(C2CC2)CC1)NCC#Cc1cccc(Cl)c1	ZINC001753478541	1440415870	/nfs/dbraw/zinc/41/58/70/1440415870.db2.gz	LQJKBYMEFULBGD-SFHVURJKSA-N	0	3	344.886	3.366	20	30		EGEDHN
CCCC1(C(=O)NC[C@H](CC)NCC#Cc2ccc(F)cc2)CC1	ZINC001753488266	1440418528	/nfs/dbraw/zinc/41/85/28/1440418528.db2.gz	CTECXIMDFGAMOM-SFHVURJKSA-N	0	3	330.447	3.242	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H](CC)NCc2c(C)nsc2C)CCC1	ZINC001753490007	1440419132	/nfs/dbraw/zinc/41/91/32/1440419132.db2.gz	OBFQFZNYVMRRET-OAHLLOKOSA-N	0	3	335.517	3.491	20	30		EGEDHN
CC[C@H](CNC(=O)c1cc(F)cc(F)c1)NCC#Cc1ccccc1	ZINC001753493237	1440420469	/nfs/dbraw/zinc/42/04/69/1440420469.db2.gz	HRBSGOPOEULPAA-LJQANCHMSA-N	0	3	342.389	3.115	20	30		EGEDHN
Cc1nsc(C)c1CNCC1(NC(=O)C#CC(C)(C)C)CCCC1	ZINC001753502791	1440423748	/nfs/dbraw/zinc/42/37/48/1440423748.db2.gz	LRVNTBNBKPIOGN-UHFFFAOYSA-N	0	3	347.528	3.328	20	30		EGEDHN
CCC(CC)C(=O)N[C@](C)(CNCC#Cc1ccccc1)C1CC1	ZINC001753513759	1440426803	/nfs/dbraw/zinc/42/68/03/1440426803.db2.gz	VUPHCTMNPZHPRY-OAQYLSRUSA-N	0	3	326.484	3.349	20	30		EGEDHN
C#CCCCCC(=O)N[C@]1(CNCc2conc2C)CCCC[C@H]1C	ZINC001753531953	1440431300	/nfs/dbraw/zinc/43/13/00/1440431300.db2.gz	PCKMECYORHCVGV-UZLBHIALSA-N	0	3	345.487	3.331	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@@H](CCNCc2nccnc2C)C1	ZINC001753549388	1440434772	/nfs/dbraw/zinc/43/47/72/1440434772.db2.gz	VUPWMDPIHDYTRM-KRWDZBQOSA-N	0	3	344.503	3.106	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CC(F)(F)C(F)(F)F)CCCC1	ZINC001753671417	1440462232	/nfs/dbraw/zinc/46/22/32/1440462232.db2.gz	YTMYDYFZVHYWLP-UHFFFAOYSA-N	0	3	348.743	3.345	20	30		EGEDHN
CC#CCCCC(=O)N(C)[C@@H](C)CNCc1cccc(C(C)C)n1	ZINC001753705853	1440469517	/nfs/dbraw/zinc/46/95/17/1440469517.db2.gz	HNGBGRGCEPZKMZ-KRWDZBQOSA-N	0	3	329.488	3.335	20	30		EGEDHN
CCC1(C(=O)N(C)[C@H](C)CNCC#Cc2ccccc2Cl)CC1	ZINC001753711452	1440470781	/nfs/dbraw/zinc/47/07/81/1440470781.db2.gz	QCSRUYYCGWDYNS-OAHLLOKOSA-N	0	3	332.875	3.318	20	30		EGEDHN
C[C@@H](C(=O)N(C)[C@@H](C)CNCC#Cc1ccccc1)C1CCCC1	ZINC001753719692	1440472787	/nfs/dbraw/zinc/47/27/87/1440472787.db2.gz	LFFYQSFYFANYCH-ZWKOTPCHSA-N	0	3	326.484	3.301	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](CNCc2cn(C)nc2C)CC(C)C)CC1	ZINC001753742319	1440479649	/nfs/dbraw/zinc/47/96/49/1440479649.db2.gz	PZDSUAIWSVPXGI-LJQANCHMSA-N	0	3	346.519	3.095	20	30		EGEDHN
Cc1[nH]ccc1C(=O)N1CCC[C@H](C)[C@H]1CNCC#Cc1ccccc1	ZINC001753805903	1440491744	/nfs/dbraw/zinc/49/17/44/1440491744.db2.gz	SVZNNFBMEOHGAK-LAUBAEHRSA-N	0	3	349.478	3.205	20	30		EGEDHN
CCN(CCNCc1ccc(C#N)cc1)C(=O)CC1CCCCC1	ZINC001754032642	1440533912	/nfs/dbraw/zinc/53/39/12/1440533912.db2.gz	ZSVFSANETYIQBL-UHFFFAOYSA-N	0	3	327.472	3.467	20	30		EGEDHN
C=C[C@@H](C(=O)N(CC)CCNCc1cncc(F)c1)c1ccccc1	ZINC001754085288	1440540040	/nfs/dbraw/zinc/54/00/40/1440540040.db2.gz	WPFQVFNYDHMHGL-LJQANCHMSA-N	0	3	341.430	3.129	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC/C=C\CNCc1cccc2c1CCOC2	ZINC001754166600	1440546499	/nfs/dbraw/zinc/54/64/99/1440546499.db2.gz	PDZMVMUMIKFVST-IZRJCCQOSA-N	0	3	342.483	3.124	20	30		EGEDHN
N#Cc1ccc(CNC/C=C\CNC(=O)c2cc(Cl)cs2)cc1	ZINC001754179845	1440548045	/nfs/dbraw/zinc/54/80/45/1440548045.db2.gz	PVDPURCUPFIWGN-UPHRSURJSA-N	0	3	345.855	3.349	20	30		EGEDHN
CCc1ccccc1C(=O)N[C@@H](C)CN(C)Cc1cccc(C#N)c1	ZINC001754324449	1440579791	/nfs/dbraw/zinc/57/97/91/1440579791.db2.gz	VNBBLLYHSPFRIT-INIZCTEOSA-N	0	3	335.451	3.371	20	30		EGEDHN
C[C@H](C(=O)N[C@@H](C)CN(C)Cc1ccc(C#N)cc1)c1cccs1	ZINC001754324558	1440579883	/nfs/dbraw/zinc/57/98/83/1440579883.db2.gz	ACTSXBLSSUIXGJ-GJZGRUSLSA-N	0	3	341.480	3.360	20	30		EGEDHN
C=C(Cl)CNCCCN(C)C(=O)[C@@]1(C)CCc2ccccc2C1	ZINC001754419859	1440597171	/nfs/dbraw/zinc/59/71/71/1440597171.db2.gz	XMYMXVINIWUHEI-IBGZPJMESA-N	0	3	334.891	3.372	20	30		EGEDHN
CC(C(=O)N[C@@H](CNCc1ccc(C#N)s1)C1CC1)=C1CCC1	ZINC001754440119	1440598859	/nfs/dbraw/zinc/59/88/59/1440598859.db2.gz	UGHYCPFTTSJHJT-KRWDZBQOSA-N	0	3	329.469	3.105	20	30		EGEDHN
CCC(C)(CC)C(=O)N[C@@H](CNCC#Cc1ccc(F)cc1)C1CC1	ZINC001754459827	1440603078	/nfs/dbraw/zinc/60/30/78/1440603078.db2.gz	GICFGQYJEAUMCZ-IBGZPJMESA-N	0	3	344.474	3.488	20	30		EGEDHN
C=C[C@H](C(=O)N[C@H](CNCc1ccns1)C1CC1)c1ccccc1	ZINC001754461300	1440603501	/nfs/dbraw/zinc/60/35/01/1440603501.db2.gz	KKYNUMOCFUXELW-ZWKOTPCHSA-N	0	3	341.480	3.097	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@@H]1CCN1CC1CCC(C(F)(F)F)CC1	ZINC001754484377	1440608329	/nfs/dbraw/zinc/60/83/29/1440608329.db2.gz	ZZVSFFKPXXIWIL-GPANFISMSA-N	0	3	344.421	3.205	20	30		EGEDHN
CCCCCCCN1CC[C@H]1CNC(=O)c1cccc2[nH]cnc21	ZINC001754498625	1440613168	/nfs/dbraw/zinc/61/31/68/1440613168.db2.gz	YDFNVOAYZGGLHH-HNNXBMFYSA-N	0	3	328.460	3.337	20	30		EGEDHN
C=CCC[C@H](C)N1CC[C@@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1	ZINC001754504202	1440615726	/nfs/dbraw/zinc/61/57/26/1440615726.db2.gz	GSSYUDLIZFXXLW-XJKSGUPXSA-N	0	3	343.431	3.008	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NCC1(N[C@@H]2CCc3c2cccc3F)CC1	ZINC001754509244	1440617034	/nfs/dbraw/zinc/61/70/34/1440617034.db2.gz	CKFKELKXIBONLI-RDTXWAMCSA-N	0	3	346.446	3.033	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NCC1(N[C@@H]2CCc3c2cccc3F)CC1	ZINC001754509241	1440617087	/nfs/dbraw/zinc/61/70/87/1440617087.db2.gz	CKFKELKXIBONLI-KBXCAEBGSA-N	0	3	346.446	3.033	20	30		EGEDHN
N#Cc1cccc(CNC2(CNC(=O)c3ccc(CF)cc3)CC2)c1	ZINC001754535989	1440624556	/nfs/dbraw/zinc/62/45/56/1440624556.db2.gz	SFUQEXZVXJFDOH-UHFFFAOYSA-N	0	3	337.398	3.080	20	30		EGEDHN
C=C(Cl)CN(CC1CC1)C1CCN(C(=O)c2cccn2C)CC1	ZINC001754547735	1440628336	/nfs/dbraw/zinc/62/83/36/1440628336.db2.gz	OSMJOSWUNWGCAR-UHFFFAOYSA-N	0	3	335.879	3.094	20	30		EGEDHN
CC#CCN(CCOC)C1CCN(C(=O)C2C[C@H](C)C[C@@H](C)C2)CC1	ZINC001754550842	1440629715	/nfs/dbraw/zinc/62/97/15/1440629715.db2.gz	GLYWOOZPHYCBAO-QZTJIDSGSA-N	0	3	348.531	3.021	20	30		EGEDHN
CC#CCN(CCOC)C1CCN(C(=O)C[C@@H](C)CC(C)C)CC1	ZINC001754550744	1440629878	/nfs/dbraw/zinc/62/98/78/1440629878.db2.gz	BWQVFUUACZDNOQ-SFHVURJKSA-N	0	3	336.520	3.021	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1C[C@H]2CCC[C@@H](C1)N2CCCC(C)C	ZINC001754550596	1440629899	/nfs/dbraw/zinc/62/98/99/1440629899.db2.gz	WOEBWJXQCVLDLF-QRVBRYPASA-N	0	3	336.520	3.469	20	30		EGEDHN
CC#CCN(CCOC)C1CCN(C(=O)[C@](C)(CC)CCC)CC1	ZINC001754550994	1440630067	/nfs/dbraw/zinc/63/00/67/1440630067.db2.gz	MJIJLMRPPCSDRC-HXUWFJFHSA-N	0	3	336.520	3.166	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@]2(CCN(CCC(F)(F)F)C2)C1	ZINC001754565801	1440635424	/nfs/dbraw/zinc/63/54/24/1440635424.db2.gz	NFNLQVHNFRLBDU-ZBFHGGJFSA-N	0	3	332.410	3.466	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](NCc2nc(C)c(C)s2)C[C@@H]1C	ZINC001754597715	1440641913	/nfs/dbraw/zinc/64/19/13/1440641913.db2.gz	FGOSTVPDSJNLPY-YOEHRIQHSA-N	0	3	347.528	3.423	20	30		EGEDHN
CCC[C@H](C)C(=O)N1CCC[C@H]1CNCc1cc(C#N)ccc1OC	ZINC001754606947	1440643357	/nfs/dbraw/zinc/64/33/57/1440643357.db2.gz	KEQCUAOKBMJSDJ-YJBOKZPZSA-N	0	3	343.471	3.084	20	30		EGEDHN
C#CCCCC(=O)NC1(C)CCN(Cc2sc(C)nc2C)CC1	ZINC001754625860	1440646398	/nfs/dbraw/zinc/64/63/98/1440646398.db2.gz	JEIZIRFUXIFVGE-UHFFFAOYSA-N	0	3	333.501	3.034	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)[C@H](C)c2ccc(F)c(F)c2)CC1	ZINC001754630338	1440647583	/nfs/dbraw/zinc/64/75/83/1440647583.db2.gz	XOPYALFWGIXSID-CQSZACIVSA-N	0	3	334.410	3.062	20	30		EGEDHN
C#CCN(C(=O)[C@@H]1C[C@H]1C(C)(C)C)C1CCN(CCOC(C)C)CC1	ZINC001754637875	1440648743	/nfs/dbraw/zinc/64/87/43/1440648743.db2.gz	BODGVBZLNUSNNG-RTBURBONSA-N	0	3	348.531	3.020	20	30		EGEDHN
C#CCN(C(=O)c1ccc(-c2cnco2)cc1)C1CCN(CC=C)CC1	ZINC001754638948	1440648931	/nfs/dbraw/zinc/64/89/31/1440648931.db2.gz	QAVYHNGHYFLMSV-UHFFFAOYSA-N	0	3	349.434	3.067	20	30		EGEDHN
C#CCNC[C@@H](NC(=O)c1ccc(C)n1C)c1ccc2ccccc2c1	ZINC001754644072	1440649724	/nfs/dbraw/zinc/64/97/24/1440649724.db2.gz	NJYRSZSWOXVPMS-HXUWFJFHSA-N	0	3	345.446	3.181	20	30		EGEDHN
CC#CCNC[C@H](NC(=O)C(C)(C)F)c1ccc2ccccc2c1	ZINC001754644928	1440649988	/nfs/dbraw/zinc/64/99/88/1440649988.db2.gz	YVLDIDNXBHLWGR-SFHVURJKSA-N	0	3	326.415	3.358	20	30		EGEDHN
C=CCCOCC(=O)N1CCCC[C@]2(CCN(C/C=C\Cl)C2)C1	ZINC001754661727	1440655070	/nfs/dbraw/zinc/65/50/70/1440655070.db2.gz	KEECUFLPMAYMBN-OTIVFRFGSA-N	0	3	340.895	3.036	20	30		EGEDHN
C[C@]1(CNCc2ccccc2C#N)CCN(C(=O)C2CC3(CC3)C2)C1	ZINC001754705616	1440669046	/nfs/dbraw/zinc/66/90/46/1440669046.db2.gz	HRDOHINVJNTMAY-HXUWFJFHSA-N	0	3	337.467	3.077	20	30		EGEDHN
C#CCCCCC(=O)NCC1(C)CCN(CCC(F)(F)F)CC1	ZINC001754717284	1440671976	/nfs/dbraw/zinc/67/19/76/1440671976.db2.gz	NCXLPJAJZKVROC-UHFFFAOYSA-N	0	3	332.410	3.351	20	30		EGEDHN
C=CCN1CCC[C@](C)(CNC(=O)c2ccncc2C(F)(F)F)C1	ZINC001754730962	1440679093	/nfs/dbraw/zinc/67/90/93/1440679093.db2.gz	AGNMOVNCGUADDG-MRXNPFEDSA-N	0	3	341.377	3.118	20	30		EGEDHN
CC#CCN1CCC[C@](C)(CNC(=O)[C@@H](CC)c2c(C)noc2C)C1	ZINC001754732079	1440680064	/nfs/dbraw/zinc/68/00/64/1440680064.db2.gz	NDUYILINRCTXCB-FXAWDEMLSA-N	0	3	345.487	3.027	20	30		EGEDHN
CC#CCN1CCC[C@](C)(CNC(=O)c2ccc(F)c3occc32)C1	ZINC001754732874	1440680673	/nfs/dbraw/zinc/68/06/73/1440680673.db2.gz	DRAVURJBZZMBDF-HXUWFJFHSA-N	0	3	342.414	3.427	20	30		EGEDHN
C=C(C)CN[C@H](CNC(=O)[C@@H]1CCCOCC1)c1ccccc1CC	ZINC001754786301	1440687929	/nfs/dbraw/zinc/68/79/29/1440687929.db2.gz	WTJITXQFKQZRMU-UYAOXDASSA-N	0	3	344.499	3.389	20	30		EGEDHN
CC/C=C(/C)C(=O)N1CC[C@H]([C@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001754787936	1440688176	/nfs/dbraw/zinc/68/81/76/1440688176.db2.gz	PWSHBRIKBCVHOW-UAEPRRAXSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H]([C@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001754798952	1440690157	/nfs/dbraw/zinc/69/01/57/1440690157.db2.gz	JBXWWRNICJEULM-RDJZCZTQSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@H](C)[C@H](CNCc2ccn(C(C)C)n2)C1	ZINC001754816617	1440692344	/nfs/dbraw/zinc/69/23/44/1440692344.db2.gz	HHAGUOLXFPBPMU-DLBZAZTESA-N	0	3	332.492	3.004	20	30		EGEDHN
C#CCNCCN(Cc1ccccc1)C(=O)[C@]1(C)CCc2ccccc21	ZINC001754839134	1440697512	/nfs/dbraw/zinc/69/75/12/1440697512.db2.gz	DZGNGNRTQYOGDU-HSZRJFAPSA-N	0	3	346.474	3.142	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@H](CCNCc3ccccc3C#N)C2)co1	ZINC001754912382	1440708149	/nfs/dbraw/zinc/70/81/49/1440708149.db2.gz	LEKZNQAHUXEWKO-INIZCTEOSA-N	0	3	337.423	3.102	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCN(C(=O)c2ccnn2[C@H](C)CC)C1	ZINC001754917722	1440708981	/nfs/dbraw/zinc/70/89/81/1440708981.db2.gz	WDLPSWQNTBMXGG-HUUCEWRRSA-N	0	3	338.883	3.048	20	30		EGEDHN
CC1(C(=O)N2CC[C@H](CCNCc3cc(C#N)ccc3F)C2)CCC1	ZINC001754925612	1440709812	/nfs/dbraw/zinc/70/98/12/1440709812.db2.gz	IXLNOEOKMYSJRT-HNNXBMFYSA-N	0	3	343.446	3.216	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCN(C(=O)Cc2cccc(Cl)c2)C1	ZINC001754929566	1440710336	/nfs/dbraw/zinc/71/03/36/1440710336.db2.gz	ODCHVLAMYYAWJS-AWEZNQCLSA-N	0	3	341.282	3.463	20	30		EGEDHN
C=C(C)CN(C)Cc1ccccc1CNC(=O)c1c(Cl)cnn1C	ZINC001754945945	1440712796	/nfs/dbraw/zinc/71/27/96/1440712796.db2.gz	ONBOOILDYQPUDP-UHFFFAOYSA-N	0	3	346.862	3.011	20	30		EGEDHN
C=CCN(C)Cc1ccccc1CNC(=O)c1c(C)noc1C(F)F	ZINC001754945885	1440712903	/nfs/dbraw/zinc/71/29/03/1440712903.db2.gz	MKHPSXNTIJNVIX-UHFFFAOYSA-N	0	3	349.381	3.468	20	30		EGEDHN
COCC#CCN[C@H](C)c1ccc(CNC(=O)CCC2CCC2)cc1	ZINC001754948089	1440713993	/nfs/dbraw/zinc/71/39/93/1440713993.db2.gz	VVWRMJXWZQTNSU-QGZVFWFLSA-N	0	3	342.483	3.184	20	30		EGEDHN
CC#CCN[C@H](C)c1ccc(CNC(=O)CC(C)(C)COC)cc1	ZINC001754948917	1440714460	/nfs/dbraw/zinc/71/44/60/1440714460.db2.gz	RWUZOVKMCFMJLJ-MRXNPFEDSA-N	0	3	330.472	3.039	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC2(NCc3ccc(C#N)c(F)c3)CCC2)C1	ZINC001754987031	1440723100	/nfs/dbraw/zinc/72/31/00/1440723100.db2.gz	DAXQJLMPQBOMQI-UHFFFAOYSA-N	0	3	341.430	3.182	20	30		EGEDHN
CC(F)(F)CC(=O)N[C@@H]1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC001755030294	1440731181	/nfs/dbraw/zinc/73/11/81/1440731181.db2.gz	XILQSZJJLRXZRC-MRXNPFEDSA-N	0	3	335.398	3.074	20	30		EGEDHN
CC[C@H](c1ccc(F)cc1F)N(C)CCCN(C)C(=O)[C@@H](C)C#N	ZINC001755035142	1440733762	/nfs/dbraw/zinc/73/37/62/1440733762.db2.gz	JTPUHXCTQQMNCD-SUMWQHHRSA-N	0	3	337.414	3.356	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCCCCC1CCN(Cc2ccccn2)CC1	ZINC001755075052	1440748158	/nfs/dbraw/zinc/74/81/58/1440748158.db2.gz	WARSPVMIGPSUJM-QGZVFWFLSA-N	0	3	342.487	3.130	20	30		EGEDHN
C=CCOCCCC(=O)N1CCC[C@]2(CCN(C/C=C/Cl)C2)C1	ZINC001755077082	1440749118	/nfs/dbraw/zinc/74/91/18/1440749118.db2.gz	NOYTZUGELRULQO-QKYXPGDISA-N	0	3	340.895	3.036	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)CCCC(C)=O)cc2C1	ZINC001755101217	1440752524	/nfs/dbraw/zinc/75/25/24/1440752524.db2.gz	WIPJIKGEKVSIAQ-UHFFFAOYSA-N	0	3	328.456	3.344	20	30		EGEDHN
C=CCCCN1Cc2ccc(CNC(=O)[C@@H]3C[C@@H](C)CO3)cc2C1	ZINC001755102036	1440753101	/nfs/dbraw/zinc/75/31/01/1440753101.db2.gz	GCWSOKXBIYDTPK-BEFAXECRSA-N	0	3	328.456	3.010	20	30		EGEDHN
Cc1csc(C(=O)N2C[C@@H](C)[C@@H](NCC#Cc3ccccc3)C2)c1	ZINC001755108388	1440753969	/nfs/dbraw/zinc/75/39/69/1440753969.db2.gz	DYDDPOWLGKVESS-AEFFLSMTSA-N	0	3	338.476	3.158	20	30		EGEDHN
CC(C)=C(C)CC(=O)N1C[C@H](NCc2ccc(C#N)c(F)c2)[C@@H](C)C1	ZINC001755113593	1440754494	/nfs/dbraw/zinc/75/44/94/1440754494.db2.gz	JVJHMBAGKSESRN-KXBFYZLASA-N	0	3	343.446	3.380	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@H](C)[C@H](NCc3ncccc3C)C2)CCC1	ZINC001755117100	1440755162	/nfs/dbraw/zinc/75/51/62/1440755162.db2.gz	ZVJVVAQYCHIUQI-FUHWJXTLSA-N	0	3	327.472	3.073	20	30		EGEDHN
C=CCCCCCN1CCOC2(CCN(C(=O)CCC=C)CC2)C1	ZINC001755173730	1440770202	/nfs/dbraw/zinc/77/02/02/1440770202.db2.gz	HDAJUIPHHQYSEF-UHFFFAOYSA-N	0	3	334.504	3.392	20	30		EGEDHN
C=C(C)CCC(=O)NC1(CO)CCN(Cc2cc(C)cc(C)c2)CC1	ZINC001755177874	1440770942	/nfs/dbraw/zinc/77/09/42/1440770942.db2.gz	GFJAYCPPTZYOMU-UHFFFAOYSA-N	0	3	344.499	3.103	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)/C=C/c2ccc[nH]2)CC1	ZINC001755181988	1440771210	/nfs/dbraw/zinc/77/12/10/1440771210.db2.gz	GBIYLLKAJKARCX-VOTSOKGWSA-N	0	3	335.879	3.341	20	30		EGEDHN
C=CCN(C)C[C@@H]1CCCN1C(=O)c1cc(F)c2ncccc2c1	ZINC001755209233	1440782767	/nfs/dbraw/zinc/78/27/67/1440782767.db2.gz	LCQGCULYKPHVGY-INIZCTEOSA-N	0	3	327.403	3.096	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](C)[C@@H](C)NCC#Cc2cccc(Cl)c2)co1	ZINC001755235122	1440787944	/nfs/dbraw/zinc/78/79/44/1440787944.db2.gz	YMYZQHHLXUPDNN-HUUCEWRRSA-N	0	3	344.842	3.390	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H](C)[C@@H](C)NCc1cccc(C(C)C)n1	ZINC001755247511	1440791072	/nfs/dbraw/zinc/79/10/72/1440791072.db2.gz	BHVLGNPRAAUAFQ-SJORKVTESA-N	0	3	329.488	3.381	20	30		EGEDHN
Cc1coc(C(=O)N[C@H](C)[C@H](C)NCC#Cc2ccccc2Cl)c1	ZINC001755248799	1440791377	/nfs/dbraw/zinc/79/13/77/1440791377.db2.gz	LHJIFMCYAUYQFN-LSDHHAIUSA-N	0	3	344.842	3.390	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1cc(C(C)(C)C)n[nH]1	ZINC001755281881	1440800794	/nfs/dbraw/zinc/80/07/94/1440800794.db2.gz	YBAHSVZKIMRUJX-UHFFFAOYSA-N	0	3	340.899	3.148	20	30		EGEDHN
C[C@H](CNC(=O)c1cccc(F)c1F)N(C)Cc1cccc(C#N)c1	ZINC001755313748	1440814683	/nfs/dbraw/zinc/81/46/83/1440814683.db2.gz	OPXJTKDOGDQLAL-CYBMUJFWSA-N	0	3	343.377	3.087	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)[C@H](OC)[C@H](C)CC)CCCCC1	ZINC001755352581	1440828339	/nfs/dbraw/zinc/82/83/39/1440828339.db2.gz	GKFJVTMGUSGYEH-UKRRQHHQSA-N	0	3	330.900	3.209	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2cnoc2CC)CCCCC1	ZINC001755354418	1440829068	/nfs/dbraw/zinc/82/90/68/1440829068.db2.gz	LECFPOXDRSEKQC-UHFFFAOYSA-N	0	3	325.840	3.012	20	30		EGEDHN
CCCC[C@H](CNCC#Cc1ccccc1)NC(=O)[C@H]1CCC1(F)F	ZINC001755357361	1440830140	/nfs/dbraw/zinc/83/01/40/1440830140.db2.gz	DUWMEWBJAXYNAI-QZTJIDSGSA-N	0	3	348.437	3.348	20	30		EGEDHN
CCCC[C@@H](CNCc1ccc(Cl)nc1)NC(=O)C#CC(C)C	ZINC001755357598	1440830371	/nfs/dbraw/zinc/83/03/71/1440830371.db2.gz	JICGIUMLFVWVIG-INIZCTEOSA-N	0	3	335.879	3.159	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)[C@H](C)CCc2cccc(F)c2)C1	ZINC001755392311	1440842266	/nfs/dbraw/zinc/84/22/66/1440842266.db2.gz	STWHSQKGQPACKI-HZPDHXFCSA-N	0	3	332.463	3.407	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@]2(CCN(C(=O)CC(C)(C)CC)C2)C1	ZINC001755401617	1440843129	/nfs/dbraw/zinc/84/31/29/1440843129.db2.gz	JLRSOKQASQZVPJ-FXAWDEMLSA-N	0	3	336.520	3.471	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1CN(CCOc2ccccc2)CC1(C)C	ZINC001755405592	1440843995	/nfs/dbraw/zinc/84/39/95/1440843995.db2.gz	MWDQPQZDPRGXRH-IBGZPJMESA-N	0	3	342.483	3.086	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)C2CCC(C)(C)CC2)C(C)(C)C1	ZINC001755416619	1440849263	/nfs/dbraw/zinc/84/92/63/1440849263.db2.gz	VREOMPOKXHVAMW-KRWDZBQOSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC[C@@H]1[C@H]2CN(Cc3scnc3C)C[C@H]21	ZINC001755422256	1440850159	/nfs/dbraw/zinc/85/01/59/1440850159.db2.gz	AFCCNLBFMZYJGR-OSYLJGHBSA-N	0	3	345.512	3.014	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CC[C@@H](NC(=O)CCc3ccoc3)C[C@H]2C1	ZINC001755449169	1440852722	/nfs/dbraw/zinc/85/27/22/1440852722.db2.gz	CNJWAHVZBPLRPM-YESZJQIVSA-N	0	3	336.863	3.181	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@H]2CN(Cc3ccnc(Cl)c3)C[C@@H]2C1	ZINC001755449241	1440852880	/nfs/dbraw/zinc/85/28/80/1440852880.db2.gz	DDNPLXHFPCPCRU-YESZJQIVSA-N	0	3	347.890	3.418	20	30		EGEDHN
C=C(Cl)CNCCC[C@H](C)NC(=O)c1cn(C(C)(C)C)nc1C	ZINC001755499036	1440862436	/nfs/dbraw/zinc/86/24/36/1440862436.db2.gz	SXJFAGLWAWFRDW-ZDUSSCGKSA-N	0	3	340.899	3.187	20	30		EGEDHN
C=C(Cl)CNCCC[C@H](C)NC(=O)c1c[nH]c(Br)c1	ZINC001755507943	1440863170	/nfs/dbraw/zinc/86/31/70/1440863170.db2.gz	LCXVFDUSZAKEEJ-JTQLQIEISA-N	0	3	348.672	3.018	20	30		EGEDHN
C[C@H](CCCNCc1ccccc1C#N)NC(=O)C1(C)CC=CC1	ZINC001755515012	1440864136	/nfs/dbraw/zinc/86/41/36/1440864136.db2.gz	QWHJQVRBRPAZMH-MRXNPFEDSA-N	0	3	325.456	3.289	20	30		EGEDHN
C=C(Cl)CNCCC[C@@H](C)NC(=O)[C@H]1CCc2ccccc2C1	ZINC001755518163	1440864559	/nfs/dbraw/zinc/86/45/59/1440864559.db2.gz	JNMSTZFESMHPFW-QAPCUYQASA-N	0	3	334.891	3.419	20	30		EGEDHN
CN(C(=O)CC1CCC1)[C@H](CNCC#Cc1ccc(F)cc1)C1CC1	ZINC001755555568	1440873139	/nfs/dbraw/zinc/87/31/39/1440873139.db2.gz	MAOQZQYJHUFUQC-HXUWFJFHSA-N	0	3	342.458	3.194	20	30		EGEDHN
C[C@@H](NC[C@H](C1CC1)N(C)C(=O)C#CC1CC1)c1ccccc1F	ZINC001755572917	1440877425	/nfs/dbraw/zinc/87/74/25/1440877425.db2.gz	SENRYMRWQKGHIP-AUUYWEPGSA-N	0	3	328.431	3.127	20	30		EGEDHN
C[C@@H]1[C@@H](NCC#Cc2ccccc2Cl)CCN1C(=O)C(C)(C)F	ZINC001755648797	1440891174	/nfs/dbraw/zinc/89/11/74/1440891174.db2.gz	JRXHRWCAGHZJHM-CJNGLKHVSA-N	0	3	336.838	3.019	20	30		EGEDHN
CCC(CC)CC(=O)N1CC[C@@H](NCC#Cc2ccccc2)[C@@H]1C	ZINC001755662708	1440893038	/nfs/dbraw/zinc/89/30/38/1440893038.db2.gz	BLQWBVPUYZJXGO-FXAWDEMLSA-N	0	3	326.484	3.443	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](NCc2ccc(F)c(Cl)c2)C[C@@H]1C	ZINC001755673520	1440894201	/nfs/dbraw/zinc/89/42/01/1440894201.db2.gz	ILGTXPXAVDQPEF-ZFWWWQNUSA-N	0	3	336.838	3.362	20	30		EGEDHN
C[C@H]1C[C@H](NCc2cc(F)cc(F)c2)CN1C(=O)C#CC(C)(C)C	ZINC001755677989	1440894833	/nfs/dbraw/zinc/89/48/33/1440894833.db2.gz	FBQQERNUZWKYRA-GUYCJALGSA-N	0	3	334.410	3.093	20	30		EGEDHN
C=CCCCC(=O)N1C[C@H](NCc2cnn(C(C)(C)C)c2)C[C@@H]1C	ZINC001755680255	1440895089	/nfs/dbraw/zinc/89/50/89/1440895089.db2.gz	CNISDPTXOWMFSO-DOTOQJQBSA-N	0	3	332.492	3.073	20	30		EGEDHN
C[C@H]1C[C@@H](NCC#Cc2ccccc2)CN1C(=O)[C@@H]1CC[C@@H](C)CC1	ZINC001755689107	1440896505	/nfs/dbraw/zinc/89/65/05/1440896505.db2.gz	MSEOVJKDMCAQMX-JYAXBFRTSA-N	0	3	338.495	3.443	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1CCCN(Cc2ccc(CO)cc2)[C@@H]1C	ZINC001755716931	1440905425	/nfs/dbraw/zinc/90/54/25/1440905425.db2.gz	CUUOMQVJHFUCRC-APWZRJJASA-N	0	3	330.472	3.004	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)COc2cc(C)cc(C)c2)[C@@H]1C	ZINC001755720290	1440907063	/nfs/dbraw/zinc/90/70/63/1440907063.db2.gz	HDEKJPXQDNGUQV-PKOBYXMFSA-N	0	3	330.472	3.227	20	30		EGEDHN
C=C(Cl)CN[C@@H](CCNC(=O)c1ccns1)Cc1ccccc1	ZINC001755724545	1440909024	/nfs/dbraw/zinc/90/90/24/1440909024.db2.gz	XYBNXPJVJQCPTJ-HNNXBMFYSA-N	0	3	349.887	3.216	20	30		EGEDHN
CC(C)(C)[C@@H](CNCc1cc(C#N)ccc1F)NC(=O)C1=CCCC1	ZINC001755820945	1440925570	/nfs/dbraw/zinc/92/55/70/1440925570.db2.gz	VXMZXRSAIBCJPI-GOSISDBHSA-N	0	3	343.446	3.428	20	30		EGEDHN
C=C(Br)CNC[C@@H](NC(=O)[C@@H](C)C(C)C)C(C)(C)C	ZINC001755833081	1440929239	/nfs/dbraw/zinc/92/92/39/1440929239.db2.gz	FJMGTWXPEPZHOP-QWHCGFSZSA-N	0	3	333.314	3.308	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H](CNCc2ccc(OC)nc2)C(C)(C)C)C1	ZINC001755832793	1440929320	/nfs/dbraw/zinc/92/93/20/1440929320.db2.gz	RWKLZPVKJTUYSQ-INIZCTEOSA-N	0	3	345.487	3.067	20	30		EGEDHN
C#CCCCC(=O)N[C@H](C)C1CCN(Cc2sc(C)nc2C)CC1	ZINC001755842829	1440932281	/nfs/dbraw/zinc/93/22/81/1440932281.db2.gz	LDABMAREKYQTJU-CQSZACIVSA-N	0	3	347.528	3.280	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N(C)C1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001755859419	1440936369	/nfs/dbraw/zinc/93/63/69/1440936369.db2.gz	RQYNIRGGTNCYQV-UHFFFAOYSA-N	0	3	342.458	3.359	20	30		EGEDHN
CN(CCC(=O)N1CCc2sccc2C1)Cc1cccc(C#N)c1	ZINC000055901767	214347027	/nfs/dbraw/zinc/34/70/27/214347027.db2.gz	WLQATEKVSDDUDU-UHFFFAOYSA-N	0	3	339.464	3.027	20	30		EGEDHN
CN(C)Cc1ccccc1CNC(=O)CSc1ccc(C#N)cc1	ZINC000103064345	219251046	/nfs/dbraw/zinc/25/10/46/219251046.db2.gz	IFUWUWJEPCXXTO-UHFFFAOYSA-N	0	3	339.464	3.028	20	30		EGEDHN
C[C@@H](NC[C@H](O)COc1ccc(C#N)cc1)c1ccccc1Cl	ZINC000068046226	215271902	/nfs/dbraw/zinc/27/19/02/215271902.db2.gz	SBVGWGSNWNGODI-HIFRSBDPSA-N	0	3	330.815	3.302	20	30		EGEDHN
COc1ccc(CCC(=O)C(C#N)C(=O)Nc2cccc(C)c2)cc1	ZINC000103504081	219308190	/nfs/dbraw/zinc/30/81/90/219308190.db2.gz	XNXAGZYRTAGDPK-SFHVURJKSA-N	0	3	336.391	3.284	20	30		EGEDHN
N#Cc1c(NC(=O)C2CCN(C3CC3)CC2)sc2c1CCCC2	ZINC000195263755	283080932	/nfs/dbraw/zinc/08/09/32/283080932.db2.gz	XXFCDQWCHACHEY-UHFFFAOYSA-N	0	3	329.469	3.311	20	30		EGEDHN
CON(C)C(=O)CCN[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000377547116	169039427	/nfs/dbraw/zinc/03/94/27/169039427.db2.gz	ZULHYIXAWNPGQG-HNNXBMFYSA-N	0	3	337.423	3.286	20	30		EGEDHN
CN(CCC1CCN(c2ccncc2)CC1)C(=O)c1cccc(C#N)c1	ZINC000092515495	218145988	/nfs/dbraw/zinc/14/59/88/218145988.db2.gz	UWENJVPKJBLQKV-UHFFFAOYSA-N	0	3	348.450	3.332	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN2CCC(COc3ccccc3)CC2)cc1	ZINC000268645548	252099541	/nfs/dbraw/zinc/09/95/41/252099541.db2.gz	FKTSLCZTEKYVGK-OAQYLSRUSA-N	0	3	336.435	3.383	20	30		EGEDHN
C=CCN1CCC(N[C@H](C)c2nnn(-c3ccc(C)cc3)c2C)CC1	ZINC000268860097	252308455	/nfs/dbraw/zinc/30/84/55/252308455.db2.gz	HRGALZMGPFOMKG-MRXNPFEDSA-N	0	3	339.487	3.185	20	30		EGEDHN
COCCC1(CN[C@@H](C)C(=O)Nc2cccc(C#N)c2)CCCCC1	ZINC000184718217	533210844	/nfs/dbraw/zinc/21/08/44/533210844.db2.gz	DBHQPDSZPVHNBL-INIZCTEOSA-N	0	3	343.471	3.462	20	30		EGEDHN
C[C@H]1SCCN(CCC(=O)Nc2ccc(C#N)c(Cl)c2)[C@@H]1C	ZINC000118414067	221147842	/nfs/dbraw/zinc/14/78/42/221147842.db2.gz	UMHZVJTZPQSKPG-VXGBXAGGSA-N	0	3	337.876	3.366	20	30		EGEDHN
C[C@@H](NC[C@H](c1cccs1)N1CCOCC1)c1cccc(C#N)c1	ZINC000181397917	533433021	/nfs/dbraw/zinc/43/30/21/533433021.db2.gz	JTSQAFJXBCMFNN-CRAIPNDOSA-N	0	3	341.480	3.344	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN(C)C[C@H](C)c1nccs1	ZINC000183942722	533503839	/nfs/dbraw/zinc/50/38/39/533503839.db2.gz	OQARQEMWTWIBLH-ZDUSSCGKSA-N	0	3	331.441	3.138	20	30		EGEDHN
COc1cccc([C@@H](C)NCCC(=O)Nc2sccc2C#N)c1	ZINC000341215232	141139782	/nfs/dbraw/zinc/13/97/82/141139782.db2.gz	DVSKRBLTXIMFGW-GFCCVEGCSA-N	0	3	329.425	3.308	20	30		EGEDHN
CN1CCN(CCCNc2ccc(C#N)cc2)[C@H](c2ccccc2)C1	ZINC000356852166	141354465	/nfs/dbraw/zinc/35/44/65/141354465.db2.gz	WFFZELYPYWWSGD-NRFANRHFSA-N	0	3	334.467	3.349	20	30		EGEDHN
C[C@H]1CCC[C@@H](C(=O)N(CCN(C)C)Cc2cccc(C#N)c2)C1	ZINC000172849767	144030100	/nfs/dbraw/zinc/03/01/00/144030100.db2.gz	FAWGGKNPNOBCCT-QFBILLFUSA-N	0	3	327.472	3.275	20	30		EGEDHN
CC(C)CN1CCN(Cc2ccc(Br)cc2C#N)CC1	ZINC000336841575	154217344	/nfs/dbraw/zinc/21/73/44/154217344.db2.gz	RZFFCWUULQUAKZ-UHFFFAOYSA-N	0	3	336.277	3.094	20	30		EGEDHN
CCc1nc(CN(CCN(C)C)Cc2ccc(C#N)cc2)cs1	ZINC000348896038	156278614	/nfs/dbraw/zinc/27/86/14/156278614.db2.gz	SFNSBSIQIWOBRV-UHFFFAOYSA-N	0	3	328.485	3.141	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)Nc2ccc(F)c(C#N)c2)N(C)C)cc1	ZINC000077499103	161744326	/nfs/dbraw/zinc/74/43/26/161744326.db2.gz	UYWDXDKTPGLCNO-SFHVURJKSA-N	0	3	340.402	3.430	20	30		EGEDHN
Cc1n[nH]c(C)c1[C@H]1CCCN1CCC(=O)Nc1ccc(C#N)cc1	ZINC000130663349	162375899	/nfs/dbraw/zinc/37/58/99/162375899.db2.gz	DFVJOMYVRXOZMW-QGZVFWFLSA-N	0	3	337.427	3.064	20	30		EGEDHN
C[C@H](c1ccccc1)[C@H](C)N[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000248953007	163047275	/nfs/dbraw/zinc/04/72/75/163047275.db2.gz	BHFQNSFPQNDDLZ-FIKGOQFSSA-N	0	3	347.462	3.441	20	30		EGEDHN
COCC1(C)CCN(Cc2cn(C)nc2-c2ccc(C#N)cc2)CC1	ZINC000354800072	166035378	/nfs/dbraw/zinc/03/53/78/166035378.db2.gz	WOWAAEXNCYRAIS-UHFFFAOYSA-N	0	3	338.455	3.207	20	30		EGEDHN
CC(C)N(CCN1CCCCCC1)C(=O)Cc1c(F)cccc1C#N	ZINC000345917485	164294683	/nfs/dbraw/zinc/29/46/83/164294683.db2.gz	XZPAYJASRXIZJE-UHFFFAOYSA-N	0	3	345.462	3.353	20	30		EGEDHN
CC(C)CN(Cc1ccc(C#N)cc1)Cc1ccc2c(c1)nnn2C	ZINC000350659394	165063206	/nfs/dbraw/zinc/06/32/06/165063206.db2.gz	MICQIYUNHDKHLA-UHFFFAOYSA-N	0	3	333.439	3.498	20	30		EGEDHN
CCN1C[C@H](C)N(Cc2ccc(C#N)cc2Br)C[C@H]1C	ZINC000350991618	165089267	/nfs/dbraw/zinc/08/92/67/165089267.db2.gz	ONFJQCIERDDERV-OLZOCXBDSA-N	0	3	336.277	3.235	20	30		EGEDHN
C[C@H]1CN(c2nccnc2C#N)CCN1CC1CCC(C)(C)CC1	ZINC000354995233	166082094	/nfs/dbraw/zinc/08/20/94/166082094.db2.gz	TVQJNYBBZIRZHZ-HNNXBMFYSA-N	0	3	327.476	3.075	20	30		EGEDHN
CC[C@@H](C)N[C@@H](CNC(=O)c1ncc(C#N)cc1Cl)c1ccco1	ZINC000359535410	167183553	/nfs/dbraw/zinc/18/35/53/167183553.db2.gz	CTMQTOKHKAJXTR-RISCZKNCSA-N	0	3	346.818	3.059	20	30		EGEDHN
CC[C@H](C)N[C@H](CNC(=O)Cc1c(F)cccc1C#N)c1ccco1	ZINC000359540109	167185583	/nfs/dbraw/zinc/18/55/83/167185583.db2.gz	JCMSNSBUUBMQJK-SUMWQHHRSA-N	0	3	343.402	3.078	20	30		EGEDHN
CC[C@@H](C)N[C@@H](CNC(=O)CCc1ccc(C#N)cc1)c1ccco1	ZINC000359540568	167186056	/nfs/dbraw/zinc/18/60/56/167186056.db2.gz	CJIYGCKWGWZZSW-QAPCUYQASA-N	0	3	339.439	3.329	20	30		EGEDHN
N#Cc1ccc2c(c1)CCCC[C@H]2NCc1ccccc1OCCO	ZINC000360658175	167381619	/nfs/dbraw/zinc/38/16/19/167381619.db2.gz	RPYUVCWAGAQXPF-HXUWFJFHSA-N	0	3	336.435	3.487	20	30		EGEDHN
N#Cc1ccccc1OCCN1CC[C@H](n2ncc3ccccc32)C1	ZINC000367998811	168293829	/nfs/dbraw/zinc/29/38/29/168293829.db2.gz	IHLIVENNVMDGEB-SFHVURJKSA-N	0	3	332.407	3.234	20	30		EGEDHN
COCCN1CCC(Nc2cc(C#N)ccc2C(F)(F)F)CC1	ZINC000122356881	222070311	/nfs/dbraw/zinc/07/03/11/222070311.db2.gz	ANUCBQPXZBWEDA-UHFFFAOYSA-N	0	3	327.350	3.100	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)c2ccc(C#N)s2)CCN1Cc1ccccc1	ZINC000430662527	269895533	/nfs/dbraw/zinc/89/55/33/269895533.db2.gz	JRDJHUYAWOUEDV-GOEBONIOSA-N	0	3	339.464	3.403	20	30		EGEDHN
CC[C@H](C)[C@@H](CNCc1cn(C)nc1-c1ccc(C#N)cc1)OC	ZINC000294915648	270042383	/nfs/dbraw/zinc/04/23/83/270042383.db2.gz	YHYWDEBZADFEOG-KBXCAEBGSA-N	0	3	326.444	3.109	20	30		EGEDHN
N#Cc1ccccc1OCCN[C@H](c1ccccc1)C1(CO)CCC1	ZINC000433313278	270050887	/nfs/dbraw/zinc/05/08/87/270050887.db2.gz	USWWJHUBMDPSQM-HXUWFJFHSA-N	0	3	336.435	3.431	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N(CCN(C)C)Cc1ccsc1	ZINC000458235341	270054232	/nfs/dbraw/zinc/05/42/32/270054232.db2.gz	YZYUHRJCXMLAOP-UHFFFAOYSA-N	0	3	327.453	3.132	20	30		EGEDHN
CCc1ccc(CN[C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)cc1	ZINC000485292954	270055760	/nfs/dbraw/zinc/05/57/60/270055760.db2.gz	WRPAJVNUQUANCO-HXUWFJFHSA-N	0	3	333.435	3.406	20	30		EGEDHN
Cc1ccc2c(c1)[C@H](NC[C@H](O)COc1ccccc1C#N)CCC2	ZINC000530234778	270060372	/nfs/dbraw/zinc/06/03/72/270060372.db2.gz	UOZVOOHVCSYDHS-AZUAARDMSA-N	0	3	336.435	3.274	20	30		EGEDHN
CCN(CCC(=O)Nc1ccc(C#N)c(Cl)c1)Cc1ccncc1	ZINC000299723489	266123200	/nfs/dbraw/zinc/12/32/00/266123200.db2.gz	TUBPCHMROQCABL-UHFFFAOYSA-N	0	3	342.830	3.457	20	30		EGEDHN
CCN(Cc1cccc(F)c1)C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000348011200	266135339	/nfs/dbraw/zinc/13/53/39/266135339.db2.gz	LNOXLQMJBVFWLI-GOSISDBHSA-N	0	3	335.382	3.428	20	30		EGEDHN
CCO[C@@H]1C[C@@H](NCC(=O)Nc2sc(C)c(C)c2C#N)C12CCC2	ZINC000296169877	266294391	/nfs/dbraw/zinc/29/43/91/266294391.db2.gz	KXRGLHKQCGMJFB-HUUCEWRRSA-N	0	3	347.484	3.112	20	30		EGEDHN
CCO[C@H]1C[C@@H](NCC(=O)Nc2sccc2C#N)C12CCCCC2	ZINC000279247149	266301861	/nfs/dbraw/zinc/30/18/61/266301861.db2.gz	KTQOQQOKEWAEMJ-CABCVRRESA-N	0	3	347.484	3.276	20	30		EGEDHN
C[C@@H]1CN(CCCCNc2nc3c(cc2C#N)CCCC3)C[C@@H](C)O1	ZINC000301901103	267052006	/nfs/dbraw/zinc/05/20/06/267052006.db2.gz	VISTYBURNZFTGB-HZPDHXFCSA-N	0	3	342.487	3.133	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1Nc1cc(C#N)ccc1[N+](=O)[O-]	ZINC000302211477	267055158	/nfs/dbraw/zinc/05/51/58/267055158.db2.gz	MNEAFKTXKBUQPV-KDOFPFPSSA-N	0	3	336.395	3.399	20	30		EGEDHN
C[C@@H]1c2ccccc2CCN1C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000280544551	267113297	/nfs/dbraw/zinc/11/32/97/267113297.db2.gz	TYAMPOLHHDOMQM-BEFAXECRSA-N	0	3	329.403	3.386	20	30		EGEDHN
CC[C@@H](C)N[C@H](CNC(=O)NCc1ccc(C#N)s1)c1ccco1	ZINC000422205115	267186372	/nfs/dbraw/zinc/18/63/72/267186372.db2.gz	ONJGBNRBYKGXBE-IUODEOHRSA-N	0	3	346.456	3.141	20	30		EGEDHN
CC[C@H](CN[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O)c1ccccc1	ZINC000488556679	267212842	/nfs/dbraw/zinc/21/28/42/267212842.db2.gz	JVBAUUNUPMXIHJ-TZIWHRDSSA-N	0	3	347.462	3.443	20	30		EGEDHN
C[C@H]1CN(CCC2CCN(c3cccc(F)c3C#N)CC2)C[C@H](C)O1	ZINC000301528662	267229337	/nfs/dbraw/zinc/22/93/37/267229337.db2.gz	GWRXQQRAUPKQIP-HOTGVXAUSA-N	0	3	345.462	3.413	20	30		EGEDHN
CN(C(=O)CSCc1ccc(C#N)cc1)C(C)(C)CN1CCCC1	ZINC000416100583	267273210	/nfs/dbraw/zinc/27/32/10/267273210.db2.gz	WTDKZODFFQUITK-UHFFFAOYSA-N	0	3	345.512	3.124	20	30		EGEDHN
CN(C)CCOc1ccc(NC(=O)c2ccc(C#N)s2)cc1Cl	ZINC000487026981	267281595	/nfs/dbraw/zinc/28/15/95/267281595.db2.gz	DNTZSFGOZWXXGW-UHFFFAOYSA-N	0	3	349.843	3.466	20	30		EGEDHN
CN(C)[C@@H](CNc1ncc([N+](=O)[O-])cc1C#N)c1ccc(Cl)cc1	ZINC000530617935	267285719	/nfs/dbraw/zinc/28/57/19/267285719.db2.gz	JJJAVGIMFYDOMW-HNNXBMFYSA-N	0	3	345.790	3.230	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@]12C[C@@H]1CN(C(=O)OC(C)(C)C)C2	ZINC000496148537	267314869	/nfs/dbraw/zinc/31/48/69/267314869.db2.gz	DINIPSARUWEXQU-YLJYHZDGSA-N	0	3	341.455	3.247	20	30		EGEDHN
COC(=O)COc1ccc(CN(C)Cc2ccc(C#N)c(C)c2)cc1	ZINC000488085329	267365619	/nfs/dbraw/zinc/36/56/19/267365619.db2.gz	DFLIWTBDQPYFGF-UHFFFAOYSA-N	0	3	338.407	3.051	20	30		EGEDHN
C[C@H](CNC(=O)N(C)[C@@H](C)c1cccc(C#N)c1)N1CCC(C)CC1	ZINC000425471675	267820609	/nfs/dbraw/zinc/82/06/09/267820609.db2.gz	HVZJCWGIWSEKME-SJORKVTESA-N	0	3	342.487	3.381	20	30		EGEDHN
Cc1cccc(CCN[C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)c1	ZINC000485227786	268052217	/nfs/dbraw/zinc/05/22/17/268052217.db2.gz	CWDHYICVPSHXLY-HXUWFJFHSA-N	0	3	333.435	3.194	20	30		EGEDHN
N#Cc1ccc(CNC[C@]2(Cc3ccc(F)cc3)CCC[C@H]2O)o1	ZINC000277423361	268074453	/nfs/dbraw/zinc/07/44/53/268074453.db2.gz	GVLMGXXZAPWHRS-RTBURBONSA-N	0	3	328.387	3.154	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NC[C@H]2CCCc3ccccc32)cc1	ZINC000279700978	268090498	/nfs/dbraw/zinc/09/04/98/268090498.db2.gz	JJTVNGJQRHPUCC-WOJBJXKFSA-N	0	3	343.430	3.477	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000349286083	268090678	/nfs/dbraw/zinc/09/06/78/268090678.db2.gz	RQYQAKAUSGKIMM-GOSISDBHSA-N	0	3	342.402	3.081	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@H]2C[C@H]2c2ccc(F)cc2)cc1	ZINC000348504417	268092305	/nfs/dbraw/zinc/09/23/05/268092305.db2.gz	CFTZNEOVOKPFTR-NEWSRXKRSA-N	0	3	333.366	3.052	20	30		EGEDHN
N#Cc1ccc([C@H](NC2CCC3(CCOCC3)CC2)C(N)=O)cc1	ZINC000333114777	268214315	/nfs/dbraw/zinc/21/43/15/268214315.db2.gz	YITQUUAYDIBBSB-KRWDZBQOSA-N	0	3	327.428	3.464	20	30		EGEDHN
N#Cc1ccccc1OCCN[C@H](CCO)c1ccc(Cl)cc1	ZINC000287116792	268283778	/nfs/dbraw/zinc/28/37/78/268283778.db2.gz	YUJJBOKKSFFXFR-QGZVFWFLSA-N	0	3	330.815	3.304	20	30		EGEDHN
N#Cc1cccc(OCCN[C@H](c2ccccc2)C2(CO)CCC2)c1	ZINC000433318273	268284662	/nfs/dbraw/zinc/28/46/62/268284662.db2.gz	KZCYYULDUSPDRS-HXUWFJFHSA-N	0	3	336.435	3.431	20	30		EGEDHN
Cc1ccc([C@H](O)CN2CCCN(c3ccccc3C#N)CC2)cc1	ZINC000266378463	275235173	/nfs/dbraw/zinc/23/51/73/275235173.db2.gz	ANAVTCGZDUZBGG-OAQYLSRUSA-N	0	3	335.451	3.112	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N[C@@H]1CCOC2(CCC2)C1)C(C)C	ZINC000269183488	275744518	/nfs/dbraw/zinc/74/45/18/275744518.db2.gz	CENJJNCVCKBPKN-QZTJIDSGSA-N	0	3	349.519	3.086	20	30		EGEDHN
CS[C@@H]1CN(c2ccc(C(F)(F)F)cc2C#N)C[C@H]1N(C)C	ZINC000340737098	277524908	/nfs/dbraw/zinc/52/49/08/277524908.db2.gz	CXBXKVVTEZUIRL-ZIAGYGMSSA-N	0	3	329.391	3.059	20	30		EGEDHN
C[C@H](C(=O)NCCSCc1ccccc1C#N)N1CCCCCC1	ZINC000357940670	279223623	/nfs/dbraw/zinc/22/36/23/279223623.db2.gz	VDRZNVSHOSRNPO-MRXNPFEDSA-N	0	3	345.512	3.172	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@@H](N[C@H]1CC(=O)N(c3ccccc3F)C1)CC2	ZINC000521712222	312556818	/nfs/dbraw/zinc/55/68/18/312556818.db2.gz	RWFGFKSWDWIFHO-YJBOKZPZSA-N	0	3	335.382	3.080	20	30		EGEDHN
CCC(CC)[C@H](CN[C@H](C)c1ccc(C#N)c(F)c1)N1CCOCC1	ZINC000538510641	314251200	/nfs/dbraw/zinc/25/12/00/314251200.db2.gz	AFWRUBGJGVSOCB-QRWLVFNGSA-N	0	3	347.478	3.485	20	30		EGEDHN
C[C@@H]1CN(c2nccnc2C#N)CCN1C[C@@H]1CCCC(C)(C)C1	ZINC000538808965	314277527	/nfs/dbraw/zinc/27/75/27/314277527.db2.gz	DIBGWTPKVBXMOE-HZPDHXFCSA-N	0	3	327.476	3.075	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)NCC1CC(C)(C)C1	ZINC000548702323	315036761	/nfs/dbraw/zinc/03/67/61/315036761.db2.gz	GFNIDCVHBZKKKK-UHFFFAOYSA-N	0	3	342.487	3.068	20	30		EGEDHN
N#Cc1csc(CN[C@@H]2CCN(C(=O)Nc3ccccc3)C2)c1	ZINC000549011910	315069078	/nfs/dbraw/zinc/06/90/78/315069078.db2.gz	IBKKCOGRIUAECY-OAHLLOKOSA-N	0	3	326.425	3.016	20	30		EGEDHN
CC(C)(C)c1ccc(OCCNCc2cnc3c(C#N)cnn3c2)cc1	ZINC000549764877	315103380	/nfs/dbraw/zinc/10/33/80/315103380.db2.gz	WLPRSJSPUHXLKT-UHFFFAOYSA-N	0	3	349.438	3.067	20	30		EGEDHN
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCc1ccc(C#N)cc1F	ZINC000551721731	315165485	/nfs/dbraw/zinc/16/54/85/315165485.db2.gz	GHTHJDYDISDLKE-KBXCAEBGSA-N	0	3	340.398	3.207	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@@H](N[C@H]1CCCN(C3CCCCC3)C1=O)CC2	ZINC000555002989	315361491	/nfs/dbraw/zinc/36/14/91/315361491.db2.gz	MQECROHOUUXEDX-PMACEKPBSA-N	0	3	337.467	3.459	20	30		EGEDHN
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCc1ccc(F)c(C#N)c1	ZINC000560182616	315666034	/nfs/dbraw/zinc/66/60/34/315666034.db2.gz	NFCUZOOXMIYFTE-KBXCAEBGSA-N	0	3	340.398	3.207	20	30		EGEDHN
Cn1ccnc1[C@H](NC1CCN(c2ccc(C#N)cc2)CC1)C1CC1	ZINC000560575172	315708966	/nfs/dbraw/zinc/70/89/66/315708966.db2.gz	VMTLRVFAUSCEBO-LJQANCHMSA-N	0	3	335.455	3.001	20	30		EGEDHN
CC1(C)C[C@H](NC[C@@H](O)COc2ccc(C#N)cc2)c2ccccc21	ZINC000564854046	316218934	/nfs/dbraw/zinc/21/89/34/316218934.db2.gz	KJSAYLRUFYNWSK-UZLBHIALSA-N	0	3	336.435	3.310	20	30		EGEDHN
CC1(C(=O)Nc2cccc(C#N)n2)CCN(Cc2ccccc2)CC1	ZINC000565010192	316248087	/nfs/dbraw/zinc/24/80/87/316248087.db2.gz	JSQFIWZHKLOAKZ-UHFFFAOYSA-N	0	3	334.423	3.194	20	30		EGEDHN
C[C@@H](NC[C@H]1CNc2c(C#N)cnn2C1)c1cc2cccc(F)c2o1	ZINC000566243266	316440668	/nfs/dbraw/zinc/44/06/68/316440668.db2.gz	RSEOTPOAEGDHAX-NEPJUHHUSA-N	0	3	339.374	3.033	20	30		EGEDHN
Cc1cc(NC[C@@H]2CCCN(C)[C@@H]2c2cccs2)c(C#N)cn1	ZINC000571635482	317226821	/nfs/dbraw/zinc/22/68/21/317226821.db2.gz	HMJCPCFNIHCSFP-KSSFIOAISA-N	0	3	326.469	3.240	20	30		EGEDHN
N#Cc1ccccc1-c1ccc(CN[C@H]2CCC(=O)N[C@@H]2C2CC2)cc1	ZINC000572003912	317277848	/nfs/dbraw/zinc/27/78/48/317277848.db2.gz	XRKAKZGVZNCVPA-RBBKRZOGSA-N	0	3	345.446	3.372	20	30		EGEDHN
COc1ccc(Cl)cc1NC(=O)CCNCc1cccc(C#N)c1	ZINC000176749377	323333543	/nfs/dbraw/zinc/33/35/43/323333543.db2.gz	XMGGWWYTDDUOGA-UHFFFAOYSA-N	0	3	343.814	3.339	20	30		EGEDHN
C=CCOc1ccc(CN[C@H]2CCOC[C@H]2OCC)cc1Cl	ZINC000353197956	456554262	/nfs/dbraw/zinc/55/42/62/456554262.db2.gz	ZUVFTMCQRYNVPW-DOTOQJQBSA-N	0	3	325.836	3.188	20	30		EGEDHN
O[C@@H](CNCc1cc(C(F)(F)F)cc(C(F)(F)F)c1)C(F)F	ZINC000319147928	456621193	/nfs/dbraw/zinc/62/11/93/456621193.db2.gz	GJQWAJYRAKMCEC-VIFPVBQESA-N	0	3	337.210	3.440	20	30		EGEDHN
N#Cc1cnc2c(Cl)cccc2c1NCCCN1CCC(O)CC1	ZINC000578863214	325029993	/nfs/dbraw/zinc/02/99/93/325029993.db2.gz	IHJPUFBTCBPCQQ-UHFFFAOYSA-N	0	3	344.846	3.019	20	30		EGEDHN
C=CCN1CCC(NC(=O)/C=C/c2ccc(OCCC)cc2)CC1	ZINC000264474304	455220363	/nfs/dbraw/zinc/22/03/63/455220363.db2.gz	JNWRMMMSPOZLNS-JXMROGBWSA-N	0	3	328.456	3.255	20	30		EGEDHN
CC(C)(C#N)CCN1CCC(C(=O)NCc2ccc(F)cc2)CC1	ZINC000157710848	455223621	/nfs/dbraw/zinc/22/36/21/455223621.db2.gz	RWFHMXZVAFZEDX-UHFFFAOYSA-N	0	3	331.435	3.094	20	30		EGEDHN
Cc1ncc(CO)c(/C=N/C[C@@H]2CCC[N@@H+]2CC2CCCCC2)c1[O-]	ZINC000264515443	455228595	/nfs/dbraw/zinc/22/85/95/455228595.db2.gz	BKKYQCPOTSTDBE-IUOVYFEOSA-N	0	3	345.487	3.052	20	30		EGEDHN
Cc1ncc(CO)c(/C=N/C[C@@H]2CCC[N@H+]2CC2CCCCC2)c1[O-]	ZINC000264515443	455228601	/nfs/dbraw/zinc/22/86/01/455228601.db2.gz	BKKYQCPOTSTDBE-IUOVYFEOSA-N	0	3	345.487	3.052	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)c1ccnc(OC2CCC2)c1	ZINC000180774315	455243332	/nfs/dbraw/zinc/24/33/32/455243332.db2.gz	VOTSFRMGCTXQEP-HNNXBMFYSA-N	0	3	346.390	3.390	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC[C@H](C)Sc2ccccc2)CC1	ZINC000173198753	455246081	/nfs/dbraw/zinc/24/60/81/455246081.db2.gz	RDRRMTFYQVTNHD-HNNXBMFYSA-N	0	3	333.501	3.117	20	30		EGEDHN
C#CCCCNC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000173318328	455264572	/nfs/dbraw/zinc/26/45/72/455264572.db2.gz	FMIURECGSYJRGX-IEBWSBKVSA-N	0	3	327.472	3.094	20	30		EGEDHN
C[C@@](C#N)(NC(=O)CN[C@H](c1cccc(F)c1)C1CCCC1)C1CC1	ZINC000181000485	455274365	/nfs/dbraw/zinc/27/43/65/455274365.db2.gz	LADPLQXHAAUZQZ-PMACEKPBSA-N	0	3	343.446	3.455	20	30		EGEDHN
COCCN(CCCCCn1cc(C)cn1)Cc1ccc(C#N)cc1	ZINC000264750178	455275352	/nfs/dbraw/zinc/27/53/52/455275352.db2.gz	WCBKGCAZMFXZMC-UHFFFAOYSA-N	0	3	340.471	3.382	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2c[nH]cc2-c2ccc(F)cc2)CC1	ZINC000173578583	455309151	/nfs/dbraw/zinc/30/91/51/455309151.db2.gz	VQXXKEWVKMTWPW-UHFFFAOYSA-N	0	3	327.403	3.201	20	30		EGEDHN
CN(C(=O)CN[C@H](Cc1ccccc1)C1CC1)C1(C#N)CCCCC1	ZINC000181559401	455355951	/nfs/dbraw/zinc/35/59/51/455355951.db2.gz	YEBGOPDLKAXPOH-LJQANCHMSA-N	0	3	339.483	3.282	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(Cc3cccc(C#N)c3)CC2)cc1	ZINC000022850385	453700396	/nfs/dbraw/zinc/70/03/96/453700396.db2.gz	RMIQAUFFUDITRJ-UHFFFAOYSA-N	0	3	330.435	3.138	20	30		EGEDHN
C[C@H](NC[C@@H](O)COc1ccc(C#N)cc1)c1ccc(Cl)cc1	ZINC000023410141	453710102	/nfs/dbraw/zinc/71/01/02/453710102.db2.gz	WZRTZXXLUFGPCL-SUMWQHHRSA-N	0	3	330.815	3.302	20	30		EGEDHN
CC[C@H](NC[C@H](O)COc1ccc(C#N)cc1)c1ccc(OC)cc1	ZINC000024590875	453739022	/nfs/dbraw/zinc/73/90/22/453739022.db2.gz	MDHVSUBUBBFZAD-PXNSSMCTSA-N	0	3	340.423	3.047	20	30		EGEDHN
Cc1ccc([C@H](CNCc2ccc(C#N)cc2)N2CCOCC2)s1	ZINC000075603928	453909815	/nfs/dbraw/zinc/90/98/15/453909815.db2.gz	SVNOKAMFVJQOLJ-SFHVURJKSA-N	0	3	341.480	3.091	20	30		EGEDHN
CN(C)CCOc1ccccc1CNc1c(C#N)nnc2ccccc21	ZINC000265837762	455390832	/nfs/dbraw/zinc/39/08/32/455390832.db2.gz	MMFCFTJVKCNPCL-UHFFFAOYSA-N	0	3	347.422	3.054	20	30		EGEDHN
CN(C)CCOc1ccc(NC(=O)c2cc(C#N)cs2)cc1Cl	ZINC000084189618	453976439	/nfs/dbraw/zinc/97/64/39/453976439.db2.gz	XILCVNDEBXBEAS-UHFFFAOYSA-N	0	3	349.843	3.466	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cccc(N3CCCCCC3)c2)CC1	ZINC000076373819	453995029	/nfs/dbraw/zinc/99/50/29/453995029.db2.gz	AYDUSEBKVOQACZ-UHFFFAOYSA-N	0	3	339.483	3.351	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)N1CCC(OCc2ccccc2)CC1	ZINC000042563701	454013856	/nfs/dbraw/zinc/01/38/56/454013856.db2.gz	KJXKUFOHTXORGZ-SFHVURJKSA-N	0	3	342.483	3.257	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2C[C@H](c3ccc(F)cc3)C[C@@H]2C)CC1	ZINC000076984264	454056357	/nfs/dbraw/zinc/05/63/57/454056357.db2.gz	XEIPVYZAYBYTCJ-DOTOQJQBSA-N	0	3	345.462	3.364	20	30		EGEDHN
N#Cc1cccc(CN[C@H]2CCCN(c3ccc(C#N)cc3F)C2)c1	ZINC000068991209	454070991	/nfs/dbraw/zinc/07/09/91/454070991.db2.gz	URXAPAYCZKPLLV-SFHVURJKSA-N	0	3	334.398	3.328	20	30		EGEDHN
CN(C)[C@@H](CNc1c(C#N)nnc2ccccc21)Cc1ccccc1	ZINC000077486092	454111962	/nfs/dbraw/zinc/11/19/62/454111962.db2.gz	OXFLFVGXSKUBDC-MRXNPFEDSA-N	0	3	331.423	3.086	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H]2C[C@H]2c2cc(F)ccc2F)CC1	ZINC000119279133	454183749	/nfs/dbraw/zinc/18/37/49/454183749.db2.gz	STSIWIYWIZLBFG-DOTOQJQBSA-N	0	3	334.410	3.225	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H]2C[C@H]2c2cccc(F)c2F)CC1	ZINC000119278554	454183980	/nfs/dbraw/zinc/18/39/80/454183980.db2.gz	OSQJLYNKRAMMGT-JKSUJKDBSA-N	0	3	334.410	3.225	20	30		EGEDHN
N#CCc1ccc(OC[C@@H](O)CN2CCC[C@H]2c2ccsc2)cc1	ZINC000058581563	454218848	/nfs/dbraw/zinc/21/88/48/454218848.db2.gz	NJIYNNWZBCJOOY-HKUYNNGSSA-N	0	3	342.464	3.391	20	30		EGEDHN
C[C@H](C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1)c1ccccc1	ZINC000119809568	454221986	/nfs/dbraw/zinc/22/19/86/454221986.db2.gz	FVIWWVQAVSYXHQ-KRWDZBQOSA-N	0	3	335.451	3.252	20	30		EGEDHN
CC[C@H](c1ccccc1)[C@@H]1CCCN1CC(=O)N(CC)CCC#N	ZINC000058959282	454248497	/nfs/dbraw/zinc/24/84/97/454248497.db2.gz	RYYFUHWCUMVNGV-MOPGFXCFSA-N	0	3	327.472	3.407	20	30		EGEDHN
N#Cc1cc([N+](=O)[O-])ccc1NCCCN1CCc2ccccc2C1	ZINC000046479000	454255023	/nfs/dbraw/zinc/25/50/23/454255023.db2.gz	DFRYLVZYTXFSJE-UHFFFAOYSA-N	0	3	336.395	3.327	20	30		EGEDHN
N#Cc1ccccc1OCCN1CCC(C(=O)Nc2ccccc2)CC1	ZINC000060465597	454292220	/nfs/dbraw/zinc/29/22/20/454292220.db2.gz	NUOYCWNEKWUOCY-UHFFFAOYSA-N	0	3	349.434	3.288	20	30		EGEDHN
N#CCCCOc1cccc(CNC[C@]2(O)CCc3ccccc32)c1	ZINC000132118073	454314367	/nfs/dbraw/zinc/31/43/67/454314367.db2.gz	QPCUSWZDYGVVEL-OAQYLSRUSA-N	0	3	336.435	3.293	20	30		EGEDHN
N#CCNC(=O)CNC1(c2cccc(C(F)(F)F)c2)CCCCC1	ZINC000132144077	454317143	/nfs/dbraw/zinc/31/71/43/454317143.db2.gz	FTQZTOJOOQVRFD-UHFFFAOYSA-N	0	3	339.361	3.094	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H]2CCc3c2cccc3OC)CC1	ZINC000120594010	454323194	/nfs/dbraw/zinc/32/31/94/454323194.db2.gz	RCGNYJIJFOAAPP-SFHVURJKSA-N	0	3	343.471	3.022	20	30		EGEDHN
N#Cc1ccccc1-c1ccccc1C(=O)NCCN1CCCCC1	ZINC000047140226	454332607	/nfs/dbraw/zinc/33/26/07/454332607.db2.gz	URTLEXWZJMGYKW-UHFFFAOYSA-N	0	3	333.435	3.441	20	30		EGEDHN
C=CCC[C@H](CC)[NH2+]CC[N-]S(=O)(=O)c1ccc(Cl)s1	ZINC000090724822	454339648	/nfs/dbraw/zinc/33/96/48/454339648.db2.gz	IOWRWLGAGAOMOU-NSHDSACASA-N	0	3	336.910	3.014	20	30		EGEDHN
CCc1ccc([C@H](NCC(=O)N[C@](C)(C#N)C2CC2)C(C)C)cc1	ZINC000072835432	454347780	/nfs/dbraw/zinc/34/77/80/454347780.db2.gz	RGSKWHLJDMDIIM-WOJBJXKFSA-N	0	3	327.472	3.344	20	30		EGEDHN
C[C@@H]1CCCN(CC#Cc2ccc(OC(F)(F)F)cc2)[C@@H]1CO	ZINC000132778791	454365314	/nfs/dbraw/zinc/36/53/14/454365314.db2.gz	ZBVKBVPXZDRCBS-CZUORRHYSA-N	0	3	327.346	3.030	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1)C(=O)Nc1ccc(F)cc1C#N	ZINC000097036695	454392450	/nfs/dbraw/zinc/39/24/50/454392450.db2.gz	NUBXCOGHMLDGDU-UHFFFAOYSA-N	0	3	340.402	3.293	20	30		EGEDHN
C[C@@H]1CN(CC2CCN(c3ccc(C#N)cc3F)CC2)C[C@@H](C)O1	ZINC000091478807	454440010	/nfs/dbraw/zinc/44/00/10/454440010.db2.gz	XUIDBMGYFZMOIC-HUUCEWRRSA-N	0	3	331.435	3.023	20	30		EGEDHN
CN(C(=O)CNC1(c2ccccc2)CCC1)C1(C#N)CCCCC1	ZINC000064343709	454475682	/nfs/dbraw/zinc/47/56/82/454475682.db2.gz	UQDAZDMZQXAQLO-UHFFFAOYSA-N	0	3	325.456	3.340	20	30		EGEDHN
CCN(CCC#N)C(=O)CN(Cc1ccc(OC)cc1)[C@@H](C)C1CC1	ZINC000064641611	454495785	/nfs/dbraw/zinc/49/57/85/454495785.db2.gz	OGQIXOIKTZVQQE-INIZCTEOSA-N	0	3	343.471	3.058	20	30		EGEDHN
COc1ccc([C@H](NCC(=O)NC2(C#N)CCCCC2)C(C)C)cc1	ZINC000102693452	454516386	/nfs/dbraw/zinc/51/63/86/454516386.db2.gz	WODHOYALZUVABG-LJQANCHMSA-N	0	3	343.471	3.325	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cn(C)nc1C(C)(C)C)C(C)C	ZINC000092237453	454539795	/nfs/dbraw/zinc/53/97/95/454539795.db2.gz	VXGQJODCAXTAGU-QGZVFWFLSA-N	0	3	346.519	3.146	20	30		EGEDHN
C=CCNC(=O)c1ccc(NC(=O)[C@@H](C(C)C)N2CCCCC2)cc1	ZINC000104287797	454581719	/nfs/dbraw/zinc/58/17/19/454581719.db2.gz	BTRQXNWVEZICAV-GOSISDBHSA-N	0	3	343.471	3.051	20	30		EGEDHN
CC(C)Oc1ccc(C(=O)C(C#N)c2nc3ccccc3n2C)cn1	ZINC000123066474	454598055	/nfs/dbraw/zinc/59/80/55/454598055.db2.gz	WLMUCMSKNUPWBZ-CQSZACIVSA-N	0	3	334.379	3.246	20	30		EGEDHN
Cc1nnc(NC[C@H](c2ccc(Cl)cc2)N(C)C)c(C#N)c1C	ZINC000080676700	454617355	/nfs/dbraw/zinc/61/73/55/454617355.db2.gz	KIOJKOZVQZRPOP-MRXNPFEDSA-N	0	3	329.835	3.333	20	30		EGEDHN
CCCCNC(=O)[C@H]1CC[C@H](C)N(Cc2ccc(OC)c(C#N)c2)C1	ZINC000135005323	454622877	/nfs/dbraw/zinc/62/28/77/454622877.db2.gz	CIBOQHCVIJVEGX-RDJZCZTQSA-N	0	3	343.471	3.084	20	30		EGEDHN
CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1cccc(C#N)c1	ZINC000065937124	454640502	/nfs/dbraw/zinc/64/05/02/454640502.db2.gz	HNBYSTZEJCWKOJ-UHFFFAOYSA-N	0	3	341.842	3.416	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)/C=C/c1cccs1	ZINC000065931191	454640523	/nfs/dbraw/zinc/64/05/23/454640523.db2.gz	BNYRODGRTUKWTF-CMDGGOBGSA-N	0	3	339.464	3.223	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N(CCN(C)C)Cc1cccc(Cl)c1	ZINC000065936595	454640963	/nfs/dbraw/zinc/64/09/63/454640963.db2.gz	ZYQSKTUWBDIHGA-HNNXBMFYSA-N	0	3	338.879	3.211	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)c1ccc(Cl)cc1	ZINC000065931202	454641109	/nfs/dbraw/zinc/64/11/09/454641109.db2.gz	AAZJTCWTJFURBW-UHFFFAOYSA-N	0	3	341.842	3.416	20	30		EGEDHN
CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1cccc(C#N)c1	ZINC000065938729	454642682	/nfs/dbraw/zinc/64/26/82/454642682.db2.gz	GQPCYLNIZCCYHM-UHFFFAOYSA-N	0	3	343.377	3.040	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCCOCc2ccccc2)CC1	ZINC000106035515	454674410	/nfs/dbraw/zinc/67/44/10/454674410.db2.gz	VPXZGBVUNIYZAA-UHFFFAOYSA-N	0	3	330.472	3.140	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(Br)cc2)CC1	ZINC000106040025	454675721	/nfs/dbraw/zinc/67/57/21/454675721.db2.gz	KQYKMPUCIJRKQT-UHFFFAOYSA-N	0	3	337.261	3.219	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H]2COc3ccc(Cl)cc3C2)CC1	ZINC000106038436	454675939	/nfs/dbraw/zinc/67/59/39/454675939.db2.gz	ZFHTXTZMRFRKTH-HNNXBMFYSA-N	0	3	348.874	3.048	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(Br)s2)CC1	ZINC000106039341	454676060	/nfs/dbraw/zinc/67/60/60/454676060.db2.gz	UEOVNLOMZRPPCF-UHFFFAOYSA-N	0	3	343.290	3.281	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2nc3ccccc3s2)CC1	ZINC000106252890	454689020	/nfs/dbraw/zinc/68/90/20/454689020.db2.gz	HHUDXMISRCYJOX-UHFFFAOYSA-N	0	3	330.457	3.458	20	30		EGEDHN
CCN(C[C@H]1CCN(Cc2cccc(C#N)c2)C1)CC(F)(F)F	ZINC000176401603	454739996	/nfs/dbraw/zinc/73/99/96/454739996.db2.gz	JVLGVRIGDVVEQJ-MRXNPFEDSA-N	0	3	325.378	3.264	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NCC1CCN(Cc2ccccc2F)CC1	ZINC000107267262	454748808	/nfs/dbraw/zinc/74/88/08/454748808.db2.gz	VYRLMVZRSGFUSD-INIZCTEOSA-N	0	3	348.462	3.135	20	30		EGEDHN
C=C(Cl)COc1ccc([C@@H](C)N[C@H]2CCc3nc(C)nn3C2)cc1	ZINC000160566000	455474819	/nfs/dbraw/zinc/47/48/19/455474819.db2.gz	CSXBJEWEKXVAKP-CJNGLKHVSA-N	0	3	346.862	3.383	20	30		EGEDHN
FC(F)(F)c1ccc(C#CCN2CCC[C@H](C3OCCO3)C2)cc1	ZINC000177100886	454822953	/nfs/dbraw/zinc/82/29/53/454822953.db2.gz	JNTHNIVUKJOZHM-HNNXBMFYSA-N	0	3	339.357	3.142	20	30		EGEDHN
CC(C)(C#N)CCCN[C@](C)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000177381667	454858666	/nfs/dbraw/zinc/85/86/66/454858666.db2.gz	OVKKLZUGBJAXHB-INIZCTEOSA-N	0	3	341.377	3.325	20	30		EGEDHN
C[C@H]1CN(CCC2CCN(Cc3ccccc3C#N)CC2)C[C@H](C)O1	ZINC000177482253	454868939	/nfs/dbraw/zinc/86/89/39/454868939.db2.gz	DSHGRLYXKXIMIG-ROUUACIJSA-N	0	3	341.499	3.270	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)c2cc(C#N)cs2)CCN1Cc1ccccc1	ZINC000177510962	454872135	/nfs/dbraw/zinc/87/21/35/454872135.db2.gz	SOEUPHDWDHVICF-WMLDXEAASA-N	0	3	339.464	3.403	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCc3c(Cl)cccc3C2)CC1	ZINC000154186934	454872461	/nfs/dbraw/zinc/87/24/61/454872461.db2.gz	UOQVLKICRMLVNV-UHFFFAOYSA-N	0	3	347.890	3.448	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H](CCNCc2cc(C#N)cs2)C1	ZINC000177698052	454893597	/nfs/dbraw/zinc/89/35/97/454893597.db2.gz	PMYAFOZXUWRXIC-ZDUSSCGKSA-N	0	3	335.473	3.356	20	30		EGEDHN
CC(C)(NCCCOc1cccc(C#N)c1)C(=O)NCC1CCCC1	ZINC000155138314	454966813	/nfs/dbraw/zinc/96/68/13/454966813.db2.gz	MZCBRJZCZQKZRU-UHFFFAOYSA-N	0	3	343.471	3.002	20	30		EGEDHN
COC(=O)c1ccccc1NC(=O)C(C#N)c1nc(C(C)C)cs1	ZINC000128584190	455069438	/nfs/dbraw/zinc/06/94/38/455069438.db2.gz	LXMSAAWCSAJPKR-LBPRGKRZSA-N	0	3	343.408	3.299	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN[C@H](CCCO)c1ccccc1	ZINC000179760596	455075216	/nfs/dbraw/zinc/07/52/16/455075216.db2.gz	LNQOQPRSHGBDCE-GOSISDBHSA-N	0	3	340.423	3.049	20	30		EGEDHN
C=CC[C@@H](C)NC(=O)NC[C@@H](c1cccc(OC)c1)N1CCCC1	ZINC000117026303	455077809	/nfs/dbraw/zinc/07/78/09/455077809.db2.gz	JNRMXZZOYDHUEQ-QAPCUYQASA-N	0	3	331.460	3.096	20	30		EGEDHN
C#CCCOc1ccc(CN[C@H](CCO)c2ccc(OC)cc2)cc1	ZINC000128785386	455083289	/nfs/dbraw/zinc/08/32/89/455083289.db2.gz	LGSDMYRZARQHGE-OAQYLSRUSA-N	0	3	339.435	3.311	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCCOc2ccc(C(C)C)cc2)CC1	ZINC000171717493	455088512	/nfs/dbraw/zinc/08/85/12/455088512.db2.gz	HBJGPSKJBLCECW-UHFFFAOYSA-N	0	3	345.487	3.138	20	30		EGEDHN
C=CC1CCN(C(=O)c2ccc(N3CCN(C(C)C)CC3)cc2)CC1	ZINC000171882217	455099717	/nfs/dbraw/zinc/09/97/17/455099717.db2.gz	NJTDYWZQOPJACL-UHFFFAOYSA-N	0	3	341.499	3.255	20	30		EGEDHN
CC[C@@H](NCC(=O)N[C@](C)(C#N)C1CC1)C(C)(C)c1ccccc1	ZINC000180008528	455115644	/nfs/dbraw/zinc/11/56/44/455115644.db2.gz	MRUXLORHFBTNTL-YLJYHZDGSA-N	0	3	327.472	3.141	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCCc2ccc(F)cc2C)CC1	ZINC000119126459	455127266	/nfs/dbraw/zinc/12/72/66/455127266.db2.gz	BOGNXAIMGWCOKX-UHFFFAOYSA-N	0	3	333.451	3.016	20	30		EGEDHN
Cc1cc(NC(=O)C2(C#N)CCCC2)ccc1OCCN1CCCC1	ZINC000119158737	455129134	/nfs/dbraw/zinc/12/91/34/455129134.db2.gz	ZZBOMOWNNWCMBX-UHFFFAOYSA-N	0	3	341.455	3.492	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccccc2OC(F)(F)F)CC1	ZINC000180178806	455144802	/nfs/dbraw/zinc/14/48/02/455144802.db2.gz	BLYSFCYPPHCYQQ-UHFFFAOYSA-N	0	3	342.361	3.356	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H]2CCC[C@@H]2Cc2ccccc2)CC1	ZINC000172384106	455150267	/nfs/dbraw/zinc/15/02/67/455150267.db2.gz	IROADYXAFMMBQV-QUCCMNQESA-N	0	3	341.499	3.347	20	30		EGEDHN
CS[C@@H]1CCCCN([C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)C1	ZINC000182914591	455190344	/nfs/dbraw/zinc/19/03/44/455190344.db2.gz	UBBMHZAVPHJEDD-QZTJIDSGSA-N	0	3	343.496	3.271	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cc(NC(C)=O)ccc2C)CC1	ZINC000264367026	455199336	/nfs/dbraw/zinc/19/93/36/455199336.db2.gz	IOZMAOWTLIEMDN-UHFFFAOYSA-N	0	3	344.459	3.115	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H]2CCSc3ccc(F)cc32)CC1	ZINC000264379409	455201659	/nfs/dbraw/zinc/20/16/59/455201659.db2.gz	IFJCUWNCVQSCQP-MRXNPFEDSA-N	0	3	349.475	3.312	20	30		EGEDHN
CC[C@H](NCCOc1ccccc1C#N)c1ccc2c(c1)OCCO2	ZINC000180646528	455217601	/nfs/dbraw/zinc/21/76/01/455217601.db2.gz	WTPKSLAZFZLKGT-KRWDZBQOSA-N	0	3	338.407	3.449	20	30		EGEDHN
N#Cc1ccc(NC(=O)CN[C@H](C[C@H]2CCOC2)c2ccccc2)cc1	ZINC000181215557	455304059	/nfs/dbraw/zinc/30/40/59/455304059.db2.gz	AUXCSWHIYYHLKI-YLJYHZDGSA-N	0	3	349.434	3.254	20	30		EGEDHN
C=CCCCN(C)CC(=O)N[C@@H](C)c1ccc(OCC)c(OC)c1	ZINC000265493682	455334794	/nfs/dbraw/zinc/33/47/94/455334794.db2.gz	CVLSOXTYTXOKCM-HNNXBMFYSA-N	0	3	334.460	3.169	20	30		EGEDHN
C[C@@H](NCCOc1ccccc1C#N)c1cccc(N2CCCC2=O)c1	ZINC000181446563	455336115	/nfs/dbraw/zinc/33/61/15/455336115.db2.gz	PRWWNDCFWBNKAA-MRXNPFEDSA-N	0	3	349.434	3.415	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC000190645029	455358925	/nfs/dbraw/zinc/35/89/25/455358925.db2.gz	IJYNHFKUIWLGTC-GOSISDBHSA-N	0	3	327.472	3.130	20	30		EGEDHN
C[C@@H](N[C@@H]1CC(=O)N(c2ccccc2)C1)c1ccc(OCC#N)cc1	ZINC000181589948	455358951	/nfs/dbraw/zinc/35/89/51/455358951.db2.gz	AQTRRBWLZNZJCR-NVXWUHKLSA-N	0	3	335.407	3.045	20	30		EGEDHN
C[C@H](N[C@@H]1CC(=O)N(c2ccccc2)C1)c1ccc(OCC#N)cc1	ZINC000181589932	455358987	/nfs/dbraw/zinc/35/89/87/455358987.db2.gz	AQTRRBWLZNZJCR-DOTOQJQBSA-N	0	3	335.407	3.045	20	30		EGEDHN
COc1cccc2c1OC[C@H](N[C@@H](C)c1ccc(OCC#N)cc1)C2	ZINC000181679751	455371249	/nfs/dbraw/zinc/37/12/49/455371249.db2.gz	NLKNSXWPDGBODQ-WMLDXEAASA-N	0	3	338.407	3.252	20	30		EGEDHN
C[C@H](N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)c1cccc(C#N)c1	ZINC000181890238	455395033	/nfs/dbraw/zinc/39/50/33/455395033.db2.gz	WCHHAMWSTYFWEE-LAUBAEHRSA-N	0	3	347.462	3.443	20	30		EGEDHN
COc1ccc(CN[C@@H]2CCCC[C@@H]2OC)cc1OCCCC#N	ZINC000266129634	455423707	/nfs/dbraw/zinc/42/37/07/455423707.db2.gz	CJDPZHKWPSLWPC-SJORKVTESA-N	0	3	332.444	3.425	20	30		EGEDHN
C=C(C)[C@H](NC(=O)NC[C@@H]1CCCN(C)C1)c1ccc(F)c(F)c1	ZINC000184697469	455430758	/nfs/dbraw/zinc/43/07/58/455430758.db2.gz	MUQZOVXHELXVHN-GUYCJALGSA-N	0	3	337.414	3.223	20	30		EGEDHN
COc1cc(NC(=O)C(C#N)c2nc(C)c(C)s2)cc(OC)c1	ZINC000160148966	455433277	/nfs/dbraw/zinc/43/32/77/455433277.db2.gz	DKYIXYIDWSLFIX-CQSZACIVSA-N	0	3	331.397	3.023	20	30		EGEDHN
CCN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)C1(C#N)CCCC1	ZINC000175291317	455434600	/nfs/dbraw/zinc/43/46/00/455434600.db2.gz	GEKNLHLYZMPMNV-LJQANCHMSA-N	0	3	339.483	3.441	20	30		EGEDHN
C[C@H](NC[C@@H]1COC2(CCCCC2)O1)c1ccc(OCC#N)cc1	ZINC000182130620	455442646	/nfs/dbraw/zinc/44/26/46/455442646.db2.gz	YCCTYMDXEVNKPY-MAUKXSAKSA-N	0	3	330.428	3.315	20	30		EGEDHN
CN(CCC#N)C(=O)CCN1CCc2ccc(C(C)(C)C)cc2C1	ZINC000182254310	455472486	/nfs/dbraw/zinc/47/24/86/455472486.db2.gz	RFHJVEHVQVNVNQ-UHFFFAOYSA-N	0	3	327.472	3.104	20	30		EGEDHN
C[C@H]1C[C@H](N(C)C(=O)c2cc(C#N)c[nH]2)CCN1Cc1ccccc1	ZINC000175731879	455489359	/nfs/dbraw/zinc/48/93/59/455489359.db2.gz	KFSSDBSEUMIDDO-MAUKXSAKSA-N	0	3	336.439	3.011	20	30		EGEDHN
CN(Cc1ccccc1)[C@H](CNC(=O)C1(C#N)CCCCC1)C1CC1	ZINC000185296649	455535813	/nfs/dbraw/zinc/53/58/13/455535813.db2.gz	WQNKDBDCNRDVCR-LJQANCHMSA-N	0	3	339.483	3.487	20	30		EGEDHN
CC#CCCCC(=O)N1CCCN(CCCc2ccccc2)CC1	ZINC000185402275	455555107	/nfs/dbraw/zinc/55/51/07/455555107.db2.gz	UJQUDBFNODRVBO-UHFFFAOYSA-N	0	3	326.484	3.347	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H](C)C2(c3ccccc3)CCCC2)CC1	ZINC000185470545	455561888	/nfs/dbraw/zinc/56/18/88/455561888.db2.gz	OPJWJKVLQIAGRT-GOSISDBHSA-N	0	3	338.495	3.348	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2c(OC)cnc3ccccc32)CC1	ZINC000283933115	455612706	/nfs/dbraw/zinc/61/27/06/455612706.db2.gz	KNUCIOLKQLZLCD-UHFFFAOYSA-N	0	3	339.439	3.014	20	30		EGEDHN
C[C@H](NC(=O)c1ccc(F)c(C#N)c1)[C@H](c1ccccc1)N(C)C	ZINC000284594996	455711373	/nfs/dbraw/zinc/71/13/73/455711373.db2.gz	HDWHZVNRSCYSRD-SCLBCKFNSA-N	0	3	325.387	3.119	20	30		EGEDHN
CC[C@H](CSC)N(C)[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000248733538	455728361	/nfs/dbraw/zinc/72/83/61/455728361.db2.gz	KCCRNNCLYGQJGS-WBVHZDCISA-N	0	3	331.485	3.127	20	30		EGEDHN
C[C@@H](CC#N)Sc1ccccc1NC(=O)CN[C@H](CO)C(C)(C)C	ZINC000193107448	455741667	/nfs/dbraw/zinc/74/16/67/455741667.db2.gz	CLFNMNXMPCPUGD-XJKSGUPXSA-N	0	3	349.500	3.016	20	30		EGEDHN
N#C[C@@H]1CCC[C@@H](N[C@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)C1	ZINC000249051558	455742522	/nfs/dbraw/zinc/74/25/22/455742522.db2.gz	XNTFRIFVHFPBKE-HSMVNMDESA-N	0	3	335.810	3.256	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CCC[C@H]1[C@@H](O)C(F)(F)F	ZINC000268960469	455745313	/nfs/dbraw/zinc/74/53/13/455745313.db2.gz	ICRXFMAEAMFNLM-LSDHHAIUSA-N	0	3	326.362	3.375	20	30		EGEDHN
C=CCCCCCN1CCC(NS(=O)(=O)c2cccs2)CC1	ZINC000193294205	455752003	/nfs/dbraw/zinc/75/20/03/455752003.db2.gz	LRPGGJHLDKULJO-UHFFFAOYSA-N	0	3	342.530	3.237	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC[C@@H](c2ccccc2)C2CC2)CC1	ZINC000292765756	455752345	/nfs/dbraw/zinc/75/23/45/455752345.db2.gz	SFSXOHKXGFJIMD-IBGZPJMESA-N	0	3	327.472	3.130	20	30		EGEDHN
CCN1CCN(c2ccc(NC(=O)[C@@](C)(C#N)CC)c(C)c2)CC1	ZINC000284867029	455755006	/nfs/dbraw/zinc/75/50/06/455755006.db2.gz	DXPNXIKPZPCYSC-LJQANCHMSA-N	0	3	328.460	3.015	20	30		EGEDHN
C[C@H]1C[C@@H](O)CCN1Cc1cccc(OCc2cccc(C#N)c2)c1	ZINC000292779397	455755774	/nfs/dbraw/zinc/75/57/74/455755774.db2.gz	LIHBLIUBMXAEDQ-JXFKEZNVSA-N	0	3	336.435	3.482	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)N1CC[C@@H](c2ccc(OC)cc2)C1	ZINC000249861666	455779276	/nfs/dbraw/zinc/77/92/76/455779276.db2.gz	GFMSGKGWUCTHBI-FUHWJXTLSA-N	0	3	328.456	3.074	20	30		EGEDHN
CSc1ccc([C@H](CNCc2cc(C#N)n(C)c2)N(C)C)cc1	ZINC000293399644	455784873	/nfs/dbraw/zinc/78/48/73/455784873.db2.gz	LMLWEKVYHPUCNS-SFHVURJKSA-N	0	3	328.485	3.011	20	30		EGEDHN
Cc1c(C(=O)C(C#N)c2nc3ccccc3n2C)cnn1C(C)(C)C	ZINC000194085273	455800598	/nfs/dbraw/zinc/80/05/98/455800598.db2.gz	NJGVIAVVWLEODP-ZDUSSCGKSA-N	0	3	335.411	3.323	20	30		EGEDHN
COc1ccc(CN(CCOCCC#N)CC2CCC2)c(OC)c1	ZINC000294084316	455804747	/nfs/dbraw/zinc/80/47/47/455804747.db2.gz	LLTSNAUQGHKPNK-UHFFFAOYSA-N	0	3	332.444	3.236	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(OCCC)cc2OC)CC1	ZINC000294752962	455826284	/nfs/dbraw/zinc/82/62/84/455826284.db2.gz	XPKGGKHBIBKQHF-UHFFFAOYSA-N	0	3	346.471	3.254	20	30		EGEDHN
Cn1cc(CN[C@H]2CCN(C)[C@H]2c2ccc(Cl)cc2)cc1C#N	ZINC000253350803	455833107	/nfs/dbraw/zinc/83/31/07/455833107.db2.gz	BINCBMQJNFZCFW-ROUUACIJSA-N	0	3	328.847	3.085	20	30		EGEDHN
Cc1cc([C@@H](NCC(=O)N[C@](C)(C#N)C(C)C)C2CC2)ccc1F	ZINC000272059920	455835047	/nfs/dbraw/zinc/83/50/47/455835047.db2.gz	HPVQXFTYEWKTQD-RBUKOAKNSA-N	0	3	331.435	3.229	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Cc2nc(C(C)C)c(C)s2)CC1	ZINC000279206820	455860599	/nfs/dbraw/zinc/86/05/99/455860599.db2.gz	KPIQNVRZYJKSMX-UHFFFAOYSA-N	0	3	335.517	3.274	20	30		EGEDHN
Cc1ccc2c(c1)CC[C@H]2NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000279281366	455862698	/nfs/dbraw/zinc/86/26/98/455862698.db2.gz	KGCPJMVFEPEYHE-UYAOXDASSA-N	0	3	329.403	3.353	20	30		EGEDHN
C[C@@H](Cc1ccccc1F)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000279378174	455863076	/nfs/dbraw/zinc/86/30/76/455863076.db2.gz	SMMWNTDGARUGJF-KSSFIOAISA-N	0	3	335.382	3.127	20	30		EGEDHN
N#CC1(NC(=O)c2ccc(CN3CCCCC3)cc2)CCSCC1	ZINC000270055804	455867435	/nfs/dbraw/zinc/86/74/35/455867435.db2.gz	FPRZROPKRXAYTL-UHFFFAOYSA-N	0	3	343.496	3.192	20	30		EGEDHN
Cc1cccc2c1CN(C(=O)C(C#N)Cc1ccc(C#N)cc1)CC2	ZINC000279968494	455879423	/nfs/dbraw/zinc/87/94/23/455879423.db2.gz	IUEUJZBHQDSMTO-LJQANCHMSA-N	0	3	329.403	3.134	20	30		EGEDHN
C[C@H](N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O)c1cccc(C#N)c1	ZINC000272255750	455893574	/nfs/dbraw/zinc/89/35/74/455893574.db2.gz	WCPQQVIREOJLHH-YWZLYKJASA-N	0	3	344.418	3.276	20	30		EGEDHN
CN1CC[C@H]2CCN(C(=O)Nc3ccc(C(C)(C)C#N)cc3)[C@@H]2C1	ZINC000272270783	455896934	/nfs/dbraw/zinc/89/69/34/455896934.db2.gz	LLBKICZOYIYLOG-WMLDXEAASA-N	0	3	326.444	3.046	20	30		EGEDHN
N#Cc1ccc(CN(C[C@H](O)COc2ccc(F)cc2)C2CC2)cc1	ZINC000194961383	455905277	/nfs/dbraw/zinc/90/52/77/455905277.db2.gz	WHQXBNNUAVHVFG-IBGZPJMESA-N	0	3	340.398	3.102	20	30		EGEDHN
CC(C)(CNC(=O)c1ccc(CC#N)cc1)N1CCc2ccccc2C1	ZINC000270221099	455905848	/nfs/dbraw/zinc/90/58/48/455905848.db2.gz	GUEXMGPBQSSDNK-UHFFFAOYSA-N	0	3	347.462	3.319	20	30		EGEDHN
C=CCn1c(SC[C@@H]2CCN(C)C2)nnc1-c1ccc(OC)cc1	ZINC000187667355	455935481	/nfs/dbraw/zinc/93/54/81/455935481.db2.gz	XIJFJFWXJBPBIT-CQSZACIVSA-N	0	3	344.484	3.184	20	30		EGEDHN
C=CCn1c(SC[C@@H]2CCN(C)C2)nnc1-c1ccccc1OC	ZINC000187667148	455935788	/nfs/dbraw/zinc/93/57/88/455935788.db2.gz	LSXBFEBJUWFUMD-CQSZACIVSA-N	0	3	344.484	3.184	20	30		EGEDHN
CCO[C@@H]1C[C@@H](NCC#Cc2ccc(Cl)cc2)C12CCOCC2	ZINC000286129484	455984962	/nfs/dbraw/zinc/98/49/62/455984962.db2.gz	MORLCRFRXSZKMU-QZTJIDSGSA-N	0	3	333.859	3.255	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@@H](C)N[C@H](C)c1ccc(OC)c(OC)c1C	ZINC000286671026	456050915	/nfs/dbraw/zinc/05/09/15/456050915.db2.gz	BNFHJRQGRIIOOX-HZPDHXFCSA-N	0	3	348.487	3.476	20	30		EGEDHN
C=CCN1CC[C@@H](N[C@H](C)c2ccc(Oc3cccnc3)cc2)C1=O	ZINC000287284401	456065896	/nfs/dbraw/zinc/06/58/96/456065896.db2.gz	RRIZKHMLRZFLNB-DNVCBOLYSA-N	0	3	337.423	3.311	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)N(C)[C@H](C)C2CCN(C)CC2)cc1	ZINC000287982245	456083555	/nfs/dbraw/zinc/08/35/55/456083555.db2.gz	HQJGBJFZRFUODC-MRXNPFEDSA-N	0	3	345.487	3.123	20	30		EGEDHN
C#Cc1ccc(CN2CCC(C(=O)Nc3ccccc3O)CC2)cc1	ZINC000288989579	456111598	/nfs/dbraw/zinc/11/15/98/456111598.db2.gz	CYYZILFYUCXMQT-UHFFFAOYSA-N	0	3	334.419	3.224	20	30		EGEDHN
C=CCOc1ccc(CNCc2cccc(OC)c2O)cc1OC	ZINC000289374039	456123449	/nfs/dbraw/zinc/12/34/49/456123449.db2.gz	BOPQXKFBUNCATA-UHFFFAOYSA-N	0	3	329.396	3.264	20	30		EGEDHN
CC(C)Oc1ccc(C#N)cc1NC(=O)N[C@H](C)C1=CCN(C)CC1	ZINC000272981450	456134614	/nfs/dbraw/zinc/13/46/14/456134614.db2.gz	PCCJKBPURCGJPY-CQSZACIVSA-N	0	3	342.443	3.117	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000289653603	456134950	/nfs/dbraw/zinc/13/49/50/456134950.db2.gz	VOAWLYLEYUOZDT-UHFFFAOYSA-N	0	3	346.474	3.034	20	30		EGEDHN
N#Cc1cc(Cl)ccc1NC[C@@H](O)CN1CCc2ccccc2C1	ZINC000301517512	456135871	/nfs/dbraw/zinc/13/58/71/456135871.db2.gz	KEJOQEOFAGYPDC-GOSISDBHSA-N	0	3	341.842	3.043	20	30		EGEDHN
CC[C@H]1CN(CCC(=O)Nc2ccc(C#N)c(Cl)c2)CCCO1	ZINC000281284791	456189153	/nfs/dbraw/zinc/18/91/53/456189153.db2.gz	GONPIZGTSYGLJW-HNNXBMFYSA-N	0	3	335.835	3.041	20	30		EGEDHN
N#CC1(CCCN2CCC(O)(c3ccccc3)CC2)CCOCC1	ZINC000281298956	456193973	/nfs/dbraw/zinc/19/39/73/456193973.db2.gz	JUIMXISITWPXMI-UHFFFAOYSA-N	0	3	328.456	3.071	20	30		EGEDHN
C=CCC[C@@H](CCC)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000273386433	456226874	/nfs/dbraw/zinc/22/68/74/456226874.db2.gz	CWENXLZJCAOTME-CQSZACIVSA-N	0	3	340.445	3.093	20	30		EGEDHN
CC(C)(C#N)c1ccc(C(=O)NC[C@@H]2CCCCN2C2CC2)cc1	ZINC000281461415	456241129	/nfs/dbraw/zinc/24/11/29/456241129.db2.gz	CYOOMASOYKOMOJ-SFHVURJKSA-N	0	3	325.456	3.234	20	30		EGEDHN
C[C@]12CN(Cc3nnc(-c4ccc(C#N)cc4)o3)C[C@@H]1[C@@H]1CC[C@H]2C1	ZINC000333711576	456252614	/nfs/dbraw/zinc/25/26/14/456252614.db2.gz	PXXGLZBXJIQAPS-AXVVYFOYSA-N	0	3	334.423	3.476	20	30		EGEDHN
CCOC(=O)N1CCC(N[C@@H](CCC#N)c2ccc(OC)cc2)CC1	ZINC000274221811	456252915	/nfs/dbraw/zinc/25/29/15/456252915.db2.gz	QMEDZEVHXZXCPT-SFHVURJKSA-N	0	3	345.443	3.251	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)NCC2CCC(C#N)CC2)N(C)C)cc1	ZINC000281610877	456275232	/nfs/dbraw/zinc/27/52/32/456275232.db2.gz	GWIVHJGDOONTLI-TVPLGVNVSA-N	0	3	342.487	3.227	20	30		EGEDHN
CC[C@@H](NCc1ccc(C#N)c(OC)c1)[C@H](O)c1c(F)cccc1F	ZINC000281674546	456289666	/nfs/dbraw/zinc/28/96/66/456289666.db2.gz	LWGWIMXLKJLZFZ-APWZRJJASA-N	0	3	346.377	3.447	20	30		EGEDHN
C=CCN1CC[C@H](N[C@H](Cc2ccccc2)c2cccs2)C1=O	ZINC000337205215	456337668	/nfs/dbraw/zinc/33/76/68/456337668.db2.gz	KAQIPWXDBJCBPR-DLBZAZTESA-N	0	3	326.465	3.408	20	30		EGEDHN
Cc1oc([N-]C(=O)[C@@H](C)[NH2+][C@@H]2CCCC23CCOCC3)c(C#N)c1C	ZINC000282064951	456404879	/nfs/dbraw/zinc/40/48/79/456404879.db2.gz	MURWDVCUSNBZCM-CZUORRHYSA-N	0	3	345.443	3.034	20	30		EGEDHN
C=CCCN(C)C(=O)Nc1ccc(CCN2CCSCC2)cc1	ZINC000276172388	456404947	/nfs/dbraw/zinc/40/49/47/456404947.db2.gz	UCMPPIXZZMBSHQ-UHFFFAOYSA-N	0	3	333.501	3.318	20	30		EGEDHN
C=CCN1CC[C@H](N2CCCCC[C@H]2C[C@H](O)c2cccs2)C1=O	ZINC000282134143	456421877	/nfs/dbraw/zinc/42/18/77/456421877.db2.gz	YYRMEZUIXKOFGO-ULQDDVLXSA-N	0	3	348.512	3.203	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2c3c(nn2C(C)C)CCC3)CC1	ZINC000352972128	456426638	/nfs/dbraw/zinc/42/66/38/456426638.db2.gz	RPRIDTSEMJCXCN-UHFFFAOYSA-N	0	3	345.491	3.115	20	30		EGEDHN
C=CCC[C@H](NC[C@H](O)CN1CCc2ccccc2C1)c1ccco1	ZINC000340505214	456498437	/nfs/dbraw/zinc/49/84/37/456498437.db2.gz	NJZTWLADWZCFRX-PMACEKPBSA-N	0	3	340.467	3.296	20	30		EGEDHN
COc1cc(CN2CC[C@@H]3[C@H](CCCN3C3CC3)C2)ccc1C#N	ZINC000282518481	456539491	/nfs/dbraw/zinc/53/94/91/456539491.db2.gz	ZLITXYRXSZLPOF-IEBWSBKVSA-N	0	3	325.456	3.016	20	30		EGEDHN
C[C@@H]1[C@H](NC(=O)c2ccccc2-c2ccccc2C#N)CCCN1C	ZINC000343431093	456615680	/nfs/dbraw/zinc/61/56/80/456615680.db2.gz	JPHAJIMSEDGLCP-FOIQADDNSA-N	0	3	333.435	3.438	20	30		EGEDHN
COCCN(C)CC[C@@H](Nc1nccc(C)c1C#N)c1ccccc1	ZINC000343438899	456622192	/nfs/dbraw/zinc/62/21/92/456622192.db2.gz	NLTICWLCHXDUMC-LJQANCHMSA-N	0	3	338.455	3.383	20	30		EGEDHN
N#CC1(NC(=O)[C@@H]2CCCN(Cc3ccccc3)C2)CCCCC1	ZINC000299167619	456625114	/nfs/dbraw/zinc/62/51/14/456625114.db2.gz	VBEHZTIJIYYPGJ-GOSISDBHSA-N	0	3	325.456	3.241	20	30		EGEDHN
N#Cc1ccccc1OCCN1CCCN(Cc2ccccc2)CC1	ZINC000323645231	456655108	/nfs/dbraw/zinc/65/51/08/456655108.db2.gz	HVKCEOXAXNRQDZ-UHFFFAOYSA-N	0	3	335.451	3.145	20	30		EGEDHN
CO[C@@H]1CCCC[C@@H]1NCC(=O)N(CCC#N)c1cccc(Cl)c1	ZINC000277065362	456667580	/nfs/dbraw/zinc/66/75/80/456667580.db2.gz	WLSXAYOFRWPIDP-DLBZAZTESA-N	0	3	349.862	3.134	20	30		EGEDHN
Cc1noc(C[C@H](NCCOc2cccc(C#N)c2)c2ccccc2)n1	ZINC000277156826	456700352	/nfs/dbraw/zinc/70/03/52/456700352.db2.gz	JXXFMEXUAYRMJQ-IBGZPJMESA-N	0	3	348.406	3.202	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN(Cc1ccccc1)CC1CCC1	ZINC000353493527	456713501	/nfs/dbraw/zinc/71/35/01/456713501.db2.gz	UECLWBXCKUTVBX-QGZVFWFLSA-N	0	3	327.472	3.297	20	30		EGEDHN
CCN(CCc1ccccc1)[C@@H]1CCN(c2ccc(C#N)cc2)C1=O	ZINC000343587925	456725981	/nfs/dbraw/zinc/72/59/81/456725981.db2.gz	HTPBPEXEBQJNCR-HXUWFJFHSA-N	0	3	333.435	3.228	20	30		EGEDHN
CC[C@H](N[C@@H]1CCN(c2ccc(C#N)cc2)C1=O)c1ccc(OC)cc1	ZINC000299555431	456727024	/nfs/dbraw/zinc/72/70/24/456727024.db2.gz	GIPFHZYLKSUPLZ-VQTJNVASSA-N	0	3	349.434	3.413	20	30		EGEDHN
Cc1n[nH]c(C)c1[C@@H]1CCCN1CCC(=O)Nc1ccccc1C#N	ZINC000299582540	456734205	/nfs/dbraw/zinc/73/42/05/456734205.db2.gz	HUCZBRPWTATQDW-KRWDZBQOSA-N	0	3	337.427	3.064	20	30		EGEDHN
CCCN(CCN1CCCCC1)C(=O)Nc1ccc(C#N)c(F)c1	ZINC000353533816	456740281	/nfs/dbraw/zinc/74/02/81/456740281.db2.gz	UEIWGJDXFBOOMF-UHFFFAOYSA-N	0	3	332.423	3.427	20	30		EGEDHN
CC(C)c1nnc2ccc(NC(=O)N[C@@H](C)CN3CCCCC3)cn21	ZINC000328761352	456754726	/nfs/dbraw/zinc/75/47/26/456754726.db2.gz	YFFVQLVZSPOWDV-AWEZNQCLSA-N	0	3	344.463	3.053	20	30		EGEDHN
O=C(CCC(=O)N1CCN(C2CCCCC2)CC1)NC1CCCC1	ZINC000328784862	456759698	/nfs/dbraw/zinc/75/96/98/456759698.db2.gz	OBQFATBMGKPKQO-UHFFFAOYSA-N	0	3	335.492	3.143	20	30		EGEDHN
COc1cccc(CNC(=O)[C@H](C)N2CC[C@H](C3CCOCC3)C2)c1	ZINC000328872857	456781795	/nfs/dbraw/zinc/78/17/95/456781795.db2.gz	YSFUHYXDQVFRDV-YJBOKZPZSA-N	0	3	346.471	3.289	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000283468063	456787290	/nfs/dbraw/zinc/78/72/90/456787290.db2.gz	IIZLTWKIAMEZIX-IBGZPJMESA-N	0	3	333.435	3.152	20	30		EGEDHN
CC(C)(C)c1cc(NC(=O)CN[C@H]2CCC(=O)N[C@H]2C2CC2)on1	ZINC000328913077	456789912	/nfs/dbraw/zinc/78/99/12/456789912.db2.gz	PHZBBVOSHWSSFP-ZBEGNZNMSA-N	0	3	334.420	3.047	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN1C[C@@H](C)C[C@H]1c1cccc(OC)c1	ZINC000344023689	456790408	/nfs/dbraw/zinc/79/04/08/456790408.db2.gz	BDNWJPSLBWSEDW-LPHOPBHVSA-N	0	3	328.456	3.279	20	30		EGEDHN
Cc1cc(C)n([C@H](C)C(=O)N[C@@H]2CN(C)C[C@@H]2c2ccccc2)n1	ZINC000328993238	456808394	/nfs/dbraw/zinc/80/83/94/456808394.db2.gz	VTYVCKHNSQPGOL-KBAYOESNSA-N	0	3	326.444	3.115	20	30		EGEDHN
Cc1cc(NC(=O)[C@@H]2CCCN2C2CCOCC2)cc2n[nH]cc21	ZINC000328999966	456809211	/nfs/dbraw/zinc/80/92/11/456809211.db2.gz	HHWWPQMYCLOGOE-KRWDZBQOSA-N	0	3	328.416	3.103	20	30		EGEDHN
C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H]1CCN(C)[C@H](C)C1	ZINC000353643833	456823373	/nfs/dbraw/zinc/82/33/73/456823373.db2.gz	PUFQETOFYAPXOS-AEFFLSMTSA-N	0	3	347.507	3.034	20	30		EGEDHN
C=CCSCCNC(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1	ZINC000338493287	456833248	/nfs/dbraw/zinc/83/32/48/456833248.db2.gz	CHSDQTPZFIPJPH-SFHVURJKSA-N	0	3	347.528	3.350	20	30		EGEDHN
CC(C)c1noc2ncc(C(=O)N[C@@H](C)C3=CCN(C)CC3)cc21	ZINC000329316545	456871782	/nfs/dbraw/zinc/87/17/82/456871782.db2.gz	HNRHGYJIQMWDKT-LBPRGKRZSA-N	0	3	328.416	3.301	20	30		EGEDHN
CCC(CC)[C@@H]1C[C@H](NC(=O)N[C@H](C)C2=CCN(C)CC2)CCO1	ZINC000329354735	456877497	/nfs/dbraw/zinc/87/74/97/456877497.db2.gz	VMYLYQOHTYUBJU-OLMNPRSZSA-N	0	3	337.508	3.124	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H]2C[C@@H]2c2c(F)cccc2F)CC1	ZINC000341596696	456879762	/nfs/dbraw/zinc/87/97/62/456879762.db2.gz	DJMJUBRWYNZXPT-YOEHRIQHSA-N	0	3	349.425	3.160	20	30		EGEDHN
C[C@H](Cn1cccn1)N[C@H](C)C(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000329409690	456886163	/nfs/dbraw/zinc/88/61/63/456886163.db2.gz	CSJLTJPIDRRBMD-HQLMBJAVSA-N	0	3	330.476	3.175	20	30		EGEDHN
CN(C)[C@H](CNC(=O)C[C@H](CC#N)c1ccccc1)Cc1ccccc1	ZINC000353820338	456922387	/nfs/dbraw/zinc/92/23/87/456922387.db2.gz	YEOWPWUSTWWRNN-SFTDATJTSA-N	0	3	349.478	3.363	20	30		EGEDHN
CCc1nccn1[C@@H]1CCCN(C([O-])=[NH+]CC[C@@H]2CCO[C@@H](C)C2)C1	ZINC000329754358	456935911	/nfs/dbraw/zinc/93/59/11/456935911.db2.gz	KSMZPZFRNUKWQB-GVDBMIGSSA-N	0	3	348.491	3.202	20	30		EGEDHN
CC[C@@H]1C[C@H](C(=O)NCC2(N(C)C)Cc3ccccc3C2)CC(=O)N1	ZINC000329757364	456936815	/nfs/dbraw/zinc/93/68/15/456936815.db2.gz	MWQRVZBWVBNDPT-DLBZAZTESA-N	0	3	343.471	3.187	20	30		EGEDHN
CC(C)(C)CN1CCC[C@H](N2CCC[C@@H](C(=O)NCC3CC3)C2)C1=O	ZINC000329757683	456936925	/nfs/dbraw/zinc/93/69/25/456936925.db2.gz	ZMGWORKNJVTVPO-SJORKVTESA-N	0	3	349.519	3.102	20	30		EGEDHN
C[C@H]1C[C@H](N(C)C(=O)Nc2csc(-c3ccccn3)n2)CCN1C	ZINC000329831367	456947630	/nfs/dbraw/zinc/94/76/30/456947630.db2.gz	KCBQIIIRAGLVJC-QWHCGFSZSA-N	0	3	345.472	3.165	20	30		EGEDHN
C[C@@H]1CC[C@@H](N(CCO)CC(=O)NC23CC4CC(CC(C4)C2)C3)C1	ZINC000329848716	456950132	/nfs/dbraw/zinc/95/01/32/456950132.db2.gz	PSKNNAUZCZALOV-MVJVIOSPSA-N	0	3	334.504	3.395	20	30		EGEDHN
C=C[C@@H](CC(=O)Nc1ccnc(OCCN(C)C)c1)c1ccccc1	ZINC000345299999	456974002	/nfs/dbraw/zinc/97/40/02/456974002.db2.gz	KWLIBSYAYHZSTH-INIZCTEOSA-N	0	3	339.439	3.320	20	30		EGEDHN
CN1CCC(C(=O)N[C@H](C#N)c2c(Cl)cccc2Cl)CC1	ZINC000345523588	456980896	/nfs/dbraw/zinc/98/08/96/456980896.db2.gz	NOBRDMBYQUUYRO-CYBMUJFWSA-N	0	3	326.227	3.016	20	30		EGEDHN
Cc1nccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)n1	ZINC000330123075	456988198	/nfs/dbraw/zinc/98/81/98/456988198.db2.gz	KPGSKQQOWZOWFI-WMLDXEAASA-N	0	3	339.443	3.164	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NC[C@H]1CCCN(Cc2cccs2)C1	ZINC000345749162	456990998	/nfs/dbraw/zinc/99/09/98/456990998.db2.gz	AADCHIGHVDEHGN-NJAFHUGGSA-N	0	3	348.512	3.058	20	30		EGEDHN
C[C@@H](c1ccc(C#N)cc1)N1CCC(c2nnc3n2CCCC3)CC1	ZINC000330166985	456994931	/nfs/dbraw/zinc/99/49/31/456994931.db2.gz	VLRDIRIKAAYHFP-HNNXBMFYSA-N	0	3	335.455	3.427	20	30		EGEDHN
C=CCC[C@H](NCC(=O)NCc1cccc(C#N)c1)c1ccccc1	ZINC000341925014	457004503	/nfs/dbraw/zinc/00/45/03/457004503.db2.gz	IDOINPRZCGJYNY-FQEVSTJZSA-N	0	3	333.435	3.472	20	30		EGEDHN
COCC1(C#N)CCN(CCCC(=O)Nc2c(C)cccc2C)CC1	ZINC000341985887	457043010	/nfs/dbraw/zinc/04/30/10/457043010.db2.gz	XYEWNHJQPVKNHK-UHFFFAOYSA-N	0	3	343.471	3.274	20	30		EGEDHN
N#C[C@H]1CC[C@H](NCc2cc(Br)c3c(c2)OCCO3)C1	ZINC000349831171	457069474	/nfs/dbraw/zinc/06/94/74/457069474.db2.gz	UYUDXJDPWIQJOM-JQWIXIFHSA-N	0	3	337.217	3.002	20	30		EGEDHN
C[C@@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1F)N1CCC[C@@H](C)C1	ZINC000330848989	457094413	/nfs/dbraw/zinc/09/44/13/457094413.db2.gz	MMKMPMHXADGZSU-NEPJUHHUSA-N	0	3	338.383	3.180	20	30		EGEDHN
COc1c(C(=O)NCC(C)(C)N2CCC[C@H](C)C2)cccc1[N+](=O)[O-]	ZINC000331052470	457125992	/nfs/dbraw/zinc/12/59/92/457125992.db2.gz	JCQLRUYEXLNSDN-ZDUSSCGKSA-N	0	3	349.431	3.419	20	30		EGEDHN
N#Cc1ccc(CC(=O)N(CCN2CCCCCC2)C2CCC2)cc1	ZINC000359790197	457129743	/nfs/dbraw/zinc/12/97/43/457129743.db2.gz	JCCDOKHLNOFAMC-UHFFFAOYSA-N	0	3	339.483	3.358	20	30		EGEDHN
C=CCCC1(C(=O)NCc2ccccc2CN2CCC[C@@H]2CO)CC1	ZINC000356749252	457147859	/nfs/dbraw/zinc/14/78/59/457147859.db2.gz	WOSDUKBTSXORJK-LJQANCHMSA-N	0	3	342.483	3.006	20	30		EGEDHN
CC[C@@H]1CCCCN1CCNC(=O)CSc1ccc(C#N)cc1	ZINC000354384134	457190213	/nfs/dbraw/zinc/19/02/13/457190213.db2.gz	HDPLFCUPKUQTGV-MRXNPFEDSA-N	0	3	331.485	3.031	20	30		EGEDHN
N#Cc1ccc(C(=O)NC[C@H]2CCCN(Cc3cccs3)C2)s1	ZINC000363002222	457192036	/nfs/dbraw/zinc/19/20/36/457192036.db2.gz	SJTMBZXFNPOGMW-CYBMUJFWSA-N	0	3	345.493	3.323	20	30		EGEDHN
N#C[C@H](NC(=O)[C@H]1CCCN(Cc2ccccc2)C1)C1CCCCC1	ZINC000331495827	457195117	/nfs/dbraw/zinc/19/51/17/457195117.db2.gz	VXWHKOMYRPXNGX-PMACEKPBSA-N	0	3	339.483	3.487	20	30		EGEDHN
COc1ccc(C[C@@H](NC(=O)C(C)C#N)c2ccc(OC)cc2)cc1	ZINC000347070529	457215376	/nfs/dbraw/zinc/21/53/76/457215376.db2.gz	OBVGAUIDFQMRFJ-AUUYWEPGSA-N	0	3	338.407	3.263	20	30		EGEDHN
C=CCn1c(Cc2ccsc2)nnc1N1C[C@H](C)N(CC)C[C@H]1C	ZINC000351074223	457218596	/nfs/dbraw/zinc/21/85/96/457218596.db2.gz	MDCVZDAEPMHHDP-LSDHHAIUSA-N	0	3	345.516	3.035	20	30		EGEDHN
C=CCn1c(Cc2ccsc2)nnc1N1C[C@H](C)N(CC)C[C@@H]1C	ZINC000351074221	457218803	/nfs/dbraw/zinc/21/88/03/457218803.db2.gz	MDCVZDAEPMHHDP-GJZGRUSLSA-N	0	3	345.516	3.035	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cnn2ccc(C)cc12)C(C)C	ZINC000347129604	457245974	/nfs/dbraw/zinc/24/59/74/457245974.db2.gz	XWXVXTSVKBKMTN-LJQANCHMSA-N	0	3	340.471	3.071	20	30		EGEDHN
N#CC1(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)CCCCC1	ZINC000331777507	457249464	/nfs/dbraw/zinc/24/94/64/457249464.db2.gz	GPSSZNNBDSLEQD-UHFFFAOYSA-N	0	3	341.455	3.056	20	30		EGEDHN
C=C(C)CN(Cc1ccc(CO)o1)C(=O)c1cccc(CN(C)C)c1	ZINC000342390840	457275691	/nfs/dbraw/zinc/27/56/91/457275691.db2.gz	FDYMZGSCEGELRG-UHFFFAOYSA-N	0	3	342.439	3.052	20	30		EGEDHN
CN(C)CC1(NC(=O)c2cn(CCCC#N)c3ccccc23)CCC1	ZINC000351623789	457307021	/nfs/dbraw/zinc/30/70/21/457307021.db2.gz	UAYYPVJITHXHFJ-UHFFFAOYSA-N	0	3	338.455	3.159	20	30		EGEDHN
C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)C1CCN(C2CC2)CC1	ZINC000342450974	457310776	/nfs/dbraw/zinc/31/07/76/457310776.db2.gz	FTQGPQBPLUDVHD-UHFFFAOYSA-N	0	3	344.503	3.243	20	30		EGEDHN
CN(CCCOc1cccc(C#N)c1)C[C@@H]1COc2ccccc2O1	ZINC000357166550	457355462	/nfs/dbraw/zinc/35/54/62/457355462.db2.gz	HTXLBYVYHAESDH-GOSISDBHSA-N	0	3	338.407	3.099	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)N1CCCC12CCN(C)CC2	ZINC000378334817	457390336	/nfs/dbraw/zinc/39/03/36/457390336.db2.gz	NLNWENOTOHOIKR-UHFFFAOYSA-N	0	3	343.471	3.021	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NC[C@]1(C)CCN(Cc2ccccc2)C1)OCC	ZINC000374254044	457544959	/nfs/dbraw/zinc/54/49/59/457544959.db2.gz	CIHPUJXKCOCJBB-FPOVZHCZSA-N	0	3	344.499	3.386	20	30		EGEDHN
CCN1CCCC[C@H]1CNC(=O)N(C)[C@@H](C)c1cccc(C#N)c1	ZINC000425449059	457558157	/nfs/dbraw/zinc/55/81/57/457558157.db2.gz	WHYNZWHWUQOFMG-YJBOKZPZSA-N	0	3	328.460	3.135	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N(C)CCC(=O)Nc1cccc(C#N)c1	ZINC000425532744	457588234	/nfs/dbraw/zinc/58/82/34/457588234.db2.gz	KBCQJGQJEWOKIE-HNNXBMFYSA-N	0	3	332.407	3.452	20	30		EGEDHN
CC[C@H](C)N[C@@H](CNC(=O)NCC(C)(C)CCC#N)c1ccco1	ZINC000357549285	457589529	/nfs/dbraw/zinc/58/95/29/457589529.db2.gz	USLGMINIMAUWPO-GJZGRUSLSA-N	0	3	334.464	3.338	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1c2ccccc2CC[C@@H]1CN(C)C)OCC	ZINC000425599771	457608843	/nfs/dbraw/zinc/60/88/43/457608843.db2.gz	AEHJBAPPOMQOSB-IEBWSBKVSA-N	0	3	330.472	3.267	20	30		EGEDHN
CC(=O)N[C@@H](C)C1CCN(Cc2cccc(OCCCC#N)c2)CC1	ZINC000361150270	457615125	/nfs/dbraw/zinc/61/51/25/457615125.db2.gz	AGLMILNXIMKSDM-INIZCTEOSA-N	0	3	343.471	3.106	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@@H]2Cc2ccc(F)cc2)CC1	ZINC000365185300	457729165	/nfs/dbraw/zinc/72/91/65/457729165.db2.gz	ISPRAXHOFBNJST-LJQANCHMSA-N	0	3	345.462	3.193	20	30		EGEDHN
COCCN(Cc1ccccc1)C(=O)C(C#N)CCc1ccccc1	ZINC000433217920	457782549	/nfs/dbraw/zinc/78/25/49/457782549.db2.gz	HEKNCGHYSNIKNV-FQEVSTJZSA-N	0	3	336.435	3.434	20	30		EGEDHN
CC(C)O[C@@H]1C[C@H](N[C@@H](C)C(=O)Nc2cccc(C#N)c2)C1(C)C	ZINC000361547271	457786596	/nfs/dbraw/zinc/78/65/96/457786596.db2.gz	DDQGJHJWELGMQP-RRQGHBQHSA-N	0	3	329.444	3.067	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCCCc1nc2ccccc2[nH]1	ZINC000433300146	457802555	/nfs/dbraw/zinc/80/25/55/457802555.db2.gz	SFCMNIBYTDLOBO-QGZVFWFLSA-N	0	3	346.434	3.384	20	30		EGEDHN
CCCOc1ncccc1CNC(=O)C(C#N)CCc1ccccc1	ZINC000433311949	457806560	/nfs/dbraw/zinc/80/65/60/457806560.db2.gz	JOGZKABOOOSVGX-KRWDZBQOSA-N	0	3	337.423	3.259	20	30		EGEDHN
CN(CC(C)(C)C#N)C(=O)N[C@@H](CN1CCCC1)c1ccccc1	ZINC000457765259	457820764	/nfs/dbraw/zinc/82/07/64/457820764.db2.gz	XKRFMCUJCKCWGN-KRWDZBQOSA-N	0	3	328.460	3.015	20	30		EGEDHN
N#CC1(CCN2CC[C@H]3[C@@H](CCC(=O)N3C3CC3)C2)CCCCC1	ZINC000411398486	457874754	/nfs/dbraw/zinc/87/47/54/457874754.db2.gz	OSTGPRUXBFSPND-WMZOPIPTSA-N	0	3	329.488	3.326	20	30		EGEDHN
C=CCN(C)CCN(CC)CCc1nc(-c2cccc(Cl)c2)no1	ZINC000411647376	457938718	/nfs/dbraw/zinc/93/87/18/457938718.db2.gz	XVVOQHCUMFCZTE-UHFFFAOYSA-N	0	3	348.878	3.372	20	30		EGEDHN
C=CCCCNC(=O)N1C[C@@H]2CCN(Cc3ccccc3)C[C@H]2C1	ZINC000367906945	457995526	/nfs/dbraw/zinc/99/55/26/457995526.db2.gz	LZWNMQSLHOJNEE-OALUTQOASA-N	0	3	327.472	3.116	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccc(C(=O)c3cc[nH]c3)cc2)nc(C)n1	ZINC000361995697	457997206	/nfs/dbraw/zinc/99/72/06/457997206.db2.gz	HKQFSOMFMWDBFQ-QGZVFWFLSA-N	0	3	344.374	3.143	20	30		EGEDHN
C[C@@H](NC(C)(C)CNC(=O)N(C)CC(C)(C)C#N)c1ccccc1	ZINC000458372098	458028094	/nfs/dbraw/zinc/02/80/94/458028094.db2.gz	MGZBPUCLGSBQSZ-OAHLLOKOSA-N	0	3	330.476	3.307	20	30		EGEDHN
CN(CCC#N)c1ccc(CN2CCC[C@@H](OCC3CC3)C2)cc1	ZINC000368728524	458053709	/nfs/dbraw/zinc/05/37/09/458053709.db2.gz	MUXWSUSBFRAQNU-HXUWFJFHSA-N	0	3	327.472	3.427	20	30		EGEDHN
C=CCC1(NC(=O)NC[C@]2(N(C)C)CCSC2)CCCCC1	ZINC000458503630	458073095	/nfs/dbraw/zinc/07/30/95/458073095.db2.gz	KITBYIPVVCLVOY-QGZVFWFLSA-N	0	3	325.522	3.002	20	30		EGEDHN
CN(CCCNC(=O)C1(c2cccc(C#N)c2)CC1)Cc1ccccc1	ZINC000435040418	458082112	/nfs/dbraw/zinc/08/21/12/458082112.db2.gz	LNYHMWXUKAEGRB-UHFFFAOYSA-N	0	3	347.462	3.228	20	30		EGEDHN
C=CC[C@H](C)NC(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000358629265	458118102	/nfs/dbraw/zinc/11/81/02/458118102.db2.gz	TUSWVINDIQTRCP-MAUKXSAKSA-N	0	3	333.476	3.340	20	30		EGEDHN
COC(=O)[C@@]1(c2ccccc2)CCN([C@H](C)c2cccc(C#N)c2)C1	ZINC000428802731	458215944	/nfs/dbraw/zinc/21/59/44/458215944.db2.gz	HQWPIPJHKXFPCH-IERDGZPVSA-N	0	3	334.419	3.436	20	30		EGEDHN
CN(CC(C)(C)C#N)C(=O)NCC1(N(C)Cc2ccccc2)CCC1	ZINC000458980255	458234699	/nfs/dbraw/zinc/23/46/99/458234699.db2.gz	RWSJPLJNZSPCMI-UHFFFAOYSA-N	0	3	342.487	3.232	20	30		EGEDHN
C=C(CC)CNC(=O)N1C[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C1	ZINC000459103874	458266491	/nfs/dbraw/zinc/26/64/91/458266491.db2.gz	UYAXVINHRVDFPM-RBUKOAKNSA-N	0	3	327.472	3.116	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1SC[C@H](CC)OC	ZINC000416901083	458356935	/nfs/dbraw/zinc/35/69/35/458356935.db2.gz	JSSKBDWWYKRZAK-HNNXBMFYSA-N	0	3	338.521	3.010	20	30		EGEDHN
C=CC1CCN(C(=O)Nc2ccc(OCCN(C)C)c(OC)c2)CC1	ZINC000417653252	458366618	/nfs/dbraw/zinc/36/66/18/458366618.db2.gz	QQMGBMAJJPVTAH-UHFFFAOYSA-N	0	3	347.459	3.066	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1CNC(=O)NC[C@H](N)c1ccc(C(C)C)cc1	ZINC000418130951	458371473	/nfs/dbraw/zinc/37/14/73/458371473.db2.gz	GYAYQKAOFIRFEU-QYZOEREBSA-N	0	3	345.487	3.090	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1CCSC[C@H]1C1CCC1	ZINC000419365699	458380761	/nfs/dbraw/zinc/38/07/61/458380761.db2.gz	RCFSKUFIZWRGBX-INIZCTEOSA-N	0	3	332.469	3.163	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1CCSC[C@@H]1C1CCC1	ZINC000419365700	458380772	/nfs/dbraw/zinc/38/07/72/458380772.db2.gz	RCFSKUFIZWRGBX-MRXNPFEDSA-N	0	3	332.469	3.163	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)N1C[C@H](N2CCCC2)C[C@@H]1C	ZINC000376791825	458389794	/nfs/dbraw/zinc/38/97/94/458389794.db2.gz	IKNKOTPTGNTJLL-GOEBONIOSA-N	0	3	342.443	3.047	20	30		EGEDHN
C=CCC[C@@H]1NC(=O)N(CC(C)(C)N[C@@H](C)c2ccccc2)C1=O	ZINC000419994621	458395277	/nfs/dbraw/zinc/39/52/77/458395277.db2.gz	HLHRHPNEZHJLRP-HOCLYGCPSA-N	0	3	329.444	3.002	20	30		EGEDHN
CC1(C)[C@@H](c2ccccc2)CCN1CC(=O)NCc1ccc(C#N)cc1	ZINC000421008968	458406448	/nfs/dbraw/zinc/40/64/48/458406448.db2.gz	BGLMXOFTQYOFCV-HXUWFJFHSA-N	0	3	347.462	3.443	20	30		EGEDHN
C[C@H]1C[C@@H](O)CCN1Cc1cccc(OCc2ccccc2C#N)c1	ZINC000430140182	458409491	/nfs/dbraw/zinc/40/94/91/458409491.db2.gz	NKAJKNHHAAQDDK-JXFKEZNVSA-N	0	3	336.435	3.482	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCC1=Cc2cc(Br)ccc2OC1	ZINC000449523291	458426614	/nfs/dbraw/zinc/42/66/14/458426614.db2.gz	XJLKLTCGLSURHX-CABCVRRESA-N	0	3	336.229	3.158	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCc1cc(Br)c(OC)s1	ZINC000449548849	458426688	/nfs/dbraw/zinc/42/66/88/458426688.db2.gz	RGYHNMQRRSCIHH-NEPJUHHUSA-N	0	3	332.263	3.342	20	30		EGEDHN
C=CCc1cc(CN2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)cc(OC)c1O	ZINC000449558236	458427098	/nfs/dbraw/zinc/42/70/98/458427098.db2.gz	WCYXIMZQXAVZNF-NJAFHUGGSA-N	0	3	331.456	3.112	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)CCCC1	ZINC000449824899	458431783	/nfs/dbraw/zinc/43/17/83/458431783.db2.gz	FZEVTALIKBCDSW-QZTJIDSGSA-N	0	3	348.531	3.471	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)[C@]2(C#N)C[C@H]2C)N(CC)CC)cc1	ZINC000452134065	458495258	/nfs/dbraw/zinc/49/52/58/458495258.db2.gz	SLJUFDNKCBGRDK-BPAFIMBUSA-N	0	3	327.472	3.298	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)[C@]2(C#N)C[C@@H]2C)N(CC)CC)cc1	ZINC000452134067	458495311	/nfs/dbraw/zinc/49/53/11/458495311.db2.gz	SLJUFDNKCBGRDK-QSFXBCCZSA-N	0	3	327.472	3.298	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NCC1(N(C)Cc2ccccc2)CCC1	ZINC000452730081	458508856	/nfs/dbraw/zinc/50/88/56/458508856.db2.gz	LPMSIWIVSUIHFC-KRWDZBQOSA-N	0	3	330.472	3.139	20	30		EGEDHN
CC(C)[C@@H](CN[C@@H](C(N)=O)c1ccc(C#N)cc1)Cc1ccccc1	ZINC000468851476	458539811	/nfs/dbraw/zinc/53/98/11/458539811.db2.gz	DMGKBMFBDRLBHJ-WOJBJXKFSA-N	0	3	335.451	3.189	20	30		EGEDHN
CCc1cccc(Cc2cnc(NC(=O)[C@H](N)CCCC#N)s2)c1	ZINC000424083268	458554495	/nfs/dbraw/zinc/55/44/95/458554495.db2.gz	AUFHSJDPKXUOHZ-MRXNPFEDSA-N	0	3	342.468	3.256	20	30		EGEDHN
Cc1cc(-c2csc(NC(=O)[C@@H](N)CCCC#N)n2)ccc1F	ZINC000424082975	458554675	/nfs/dbraw/zinc/55/46/75/458554675.db2.gz	MHYXFFWOXIJPLJ-ZDUSSCGKSA-N	0	3	332.404	3.217	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N1Cc2ccccc2[C@@H](c2ccccc2)C1	ZINC000424085351	458556190	/nfs/dbraw/zinc/55/61/90/458556190.db2.gz	PLDXHDBHOGXQHA-WOJBJXKFSA-N	0	3	333.435	3.182	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N[C@H](Cc1ccccc1)c1cccs1	ZINC000424120854	458562750	/nfs/dbraw/zinc/56/27/50/458562750.db2.gz	HKGWPTKMBNMLES-JKSUJKDBSA-N	0	3	327.453	3.169	20	30		EGEDHN
CCN(C(=O)[C@@H](N)CCCC#N)[C@@H](Cc1ccc(F)cc1)C(C)C	ZINC000424122265	458563034	/nfs/dbraw/zinc/56/30/34/458563034.db2.gz	IRCFCHICOIWQEV-ROUUACIJSA-N	0	3	333.451	3.262	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N[C@@H](Cc1ccccc1)c1cccs1	ZINC000424120847	458563053	/nfs/dbraw/zinc/56/30/53/458563053.db2.gz	HKGWPTKMBNMLES-CVEARBPZSA-N	0	3	327.453	3.169	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1ccc(SCc2cccnc2)cc1	ZINC000424137861	458567625	/nfs/dbraw/zinc/56/76/25/458567625.db2.gz	PLQPOAVMIMJMCQ-KRWDZBQOSA-N	0	3	340.452	3.334	20	30		EGEDHN
CN(Cc1ccccc1)c1ccccc1NC(=O)[C@H](N)CCCC#N	ZINC000424158633	458573967	/nfs/dbraw/zinc/57/39/67/458573967.db2.gz	RKSZHBNGWBCLKI-QGZVFWFLSA-N	0	3	336.439	3.283	20	30		EGEDHN
CC(C)CCN1Cc2cccc(NC(=O)[C@H](N)CCCC#N)c2C1	ZINC000424163964	458574775	/nfs/dbraw/zinc/57/47/75/458574775.db2.gz	YKCXHHGMAWAMCL-QGZVFWFLSA-N	0	3	328.460	3.008	20	30		EGEDHN
CCN(Cc1cccc(-c2ccncc2)c1)C(=O)[C@@H](N)CCCC#N	ZINC000424168554	458575930	/nfs/dbraw/zinc/57/59/30/458575930.db2.gz	GBZHXVCYLKYVKR-IBGZPJMESA-N	0	3	336.439	3.118	20	30		EGEDHN
C[C@H](C(=O)N1CCN(C2CCC(C)CC2)CC1)c1cccc(C#N)c1	ZINC000462071050	458592612	/nfs/dbraw/zinc/59/26/12/458592612.db2.gz	MYXRMDJCJHFZNP-GNZRSQJKSA-N	0	3	339.483	3.385	20	30		EGEDHN
CC(C)N1CCCN(C(=O)Nc2ccc(CC#N)cc2Cl)CC1	ZINC000455701628	458608287	/nfs/dbraw/zinc/60/82/87/458608287.db2.gz	KCDAUHHNJXOZLT-UHFFFAOYSA-N	0	3	334.851	3.354	20	30		EGEDHN
CC1CCC(N2CCN(C(=O)Nc3cccc(CC#N)c3)CC2)CC1	ZINC000455918626	458621930	/nfs/dbraw/zinc/62/19/30/458621930.db2.gz	LJZXAMQXWBABQQ-UHFFFAOYSA-N	0	3	340.471	3.481	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NC(=O)c1ccc(CN2CCCCC2)cc1	ZINC000456270822	458636043	/nfs/dbraw/zinc/63/60/43/458636043.db2.gz	WPKYZWNCRYUWEL-MOPGFXCFSA-N	0	3	328.456	3.136	20	30		EGEDHN
C[C@H](C#N)CSc1ccccc1NC(=O)CN[C@]1(C)CCO[C@H]1C	ZINC000494246504	458647335	/nfs/dbraw/zinc/64/73/35/458647335.db2.gz	BLYVUOVYWYNRBQ-QWQRMKEZSA-N	0	3	347.484	3.034	20	30		EGEDHN
Cc1c(C#N)cccc1NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000432259843	458706695	/nfs/dbraw/zinc/70/66/95/458706695.db2.gz	VBGFVMPYTNVJRF-SFHVURJKSA-N	0	3	334.423	3.263	20	30		EGEDHN
C=CCCCCNC(=O)CCCN1CCN(c2ccccc2)CC1	ZINC000471703342	458716078	/nfs/dbraw/zinc/71/60/78/458716078.db2.gz	UNFYNHRBPPBIFC-UHFFFAOYSA-N	0	3	329.488	3.061	20	30		EGEDHN
C=C[C@H]1CCCCN1C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000494704261	458733410	/nfs/dbraw/zinc/73/34/10/458733410.db2.gz	SVAULXVWRWYFNA-OALUTQOASA-N	0	3	327.472	3.401	20	30		EGEDHN
CCN1CCN(c2ccccc2CNc2ccc(F)c(C#N)c2)CC1	ZINC000432411710	458734584	/nfs/dbraw/zinc/73/45/84/458734584.db2.gz	AHRBPOKIMUFNHT-UHFFFAOYSA-N	0	3	338.430	3.451	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@H](C)N1CC[C@H](c2ccc(OC)cc2)C1	ZINC000504488613	458739110	/nfs/dbraw/zinc/73/91/10/458739110.db2.gz	MUZXOKQNZPFMSM-WMZOPIPTSA-N	0	3	330.472	3.298	20	30		EGEDHN
Cc1ccccc1[C@@H]1C[C@@H](C)N([C@H](C)C(=O)NC2(C#N)CCC2)C1	ZINC000530334474	458749504	/nfs/dbraw/zinc/74/95/04/458749504.db2.gz	CLBPGLNOXXNPNL-BRWVUGGUSA-N	0	3	325.456	3.124	20	30		EGEDHN
Cc1ccccc1[C@H]([C@H](C)NC(=O)N1CCC(C)(C#N)CC1)N(C)C	ZINC000508878941	458766027	/nfs/dbraw/zinc/76/60/27/458766027.db2.gz	IMSFXRRNDHVDET-WMZOPIPTSA-N	0	3	342.487	3.322	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NC[C@@H](CO)C1CCCCC1	ZINC000509887821	458773487	/nfs/dbraw/zinc/77/34/87/458773487.db2.gz	ZCTYBZPXZDRVSQ-OALUTQOASA-N	0	3	328.456	3.064	20	30		EGEDHN
CC(C)CN1CCN([C@@H](C#N)c2ccc(Br)cc2)CC1	ZINC000512450158	458784506	/nfs/dbraw/zinc/78/45/06/458784506.db2.gz	PALNRCQCROUZJP-INIZCTEOSA-N	0	3	336.277	3.287	20	30		EGEDHN
C[C@H]1CN(CCCNc2ccc(C(F)(F)F)c(C#N)c2)CCCO1	ZINC000432846229	458799347	/nfs/dbraw/zinc/79/93/47/458799347.db2.gz	IUCCJOCLMXHGSL-ZDUSSCGKSA-N	0	3	341.377	3.490	20	30		EGEDHN
Cn1cc([C@H]2CN(CCCOc3cccc(C#N)c3)CC2(C)C)cn1	ZINC000515586594	458810987	/nfs/dbraw/zinc/81/09/87/458810987.db2.gz	CDARJMDLYYPZCB-LJQANCHMSA-N	0	3	338.455	3.186	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(CC#N)cc2)CC[C@H]1NC(=O)OC(C)(C)C	ZINC000495291314	458828170	/nfs/dbraw/zinc/82/81/70/458828170.db2.gz	HAILJXFLJRQMGY-CRAIPNDOSA-N	0	3	343.471	3.488	20	30		EGEDHN
CN(C)[C@H]1CCCN(C(=O)c2ccc(C#Cc3ccccc3)cc2)C1	ZINC000517348119	458828709	/nfs/dbraw/zinc/82/87/09/458828709.db2.gz	KSWGEVJLWLBARM-NRFANRHFSA-N	0	3	332.447	3.253	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCCCOc2ccccc2C)CC1	ZINC000517997254	458835195	/nfs/dbraw/zinc/83/51/95/458835195.db2.gz	BRSCMTCCKGDXBY-UHFFFAOYSA-N	0	3	345.487	3.104	20	30		EGEDHN
CCCCN(C)CCNC(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1	ZINC000465914399	458861587	/nfs/dbraw/zinc/86/15/87/458861587.db2.gz	AUQFMJOWQRVCJJ-RBUKOAKNSA-N	0	3	342.487	3.200	20	30		EGEDHN
CC(C)N1CC[C@@H](N(C)C(=O)CCCCOc2cccc(C#N)c2)C1	ZINC000457102594	458868609	/nfs/dbraw/zinc/86/86/09/458868609.db2.gz	ACKOTUIRYOADQE-GOSISDBHSA-N	0	3	343.471	3.048	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(Oc3ccccc3)cn2)CC1	ZINC000548826705	458874559	/nfs/dbraw/zinc/87/45/59/458874559.db2.gz	SFRPOESJKVQDTN-UHFFFAOYSA-N	0	3	337.423	3.254	20	30		EGEDHN
CC1(C)CN(CC(=O)NCc2ccc(C#N)cc2)C[C@H]1c1ccccc1	ZINC000441068846	458884133	/nfs/dbraw/zinc/88/41/33/458884133.db2.gz	VUELRRPKSSFLAK-FQEVSTJZSA-N	0	3	347.462	3.300	20	30		EGEDHN
C=CCn1c(CC2CCCC2)nnc1N1C[C@H](C)N(CC)C[C@H]1C	ZINC000554924332	458902151	/nfs/dbraw/zinc/90/21/51/458902151.db2.gz	KAWISFFHZIASGQ-JKSUJKDBSA-N	0	3	331.508	3.116	20	30		EGEDHN
N#Cc1ccccc1NC(=O)CCN1CCC=C(c2cccnc2)C1	ZINC000519105705	458915422	/nfs/dbraw/zinc/91/54/22/458915422.db2.gz	YCFQIOTYPCXNMZ-UHFFFAOYSA-N	0	3	332.407	3.071	20	30		EGEDHN
CC(C)CN(Cc1cnn(C)c1)C(=O)C(C#N)CCc1ccccc1	ZINC000457340121	458925293	/nfs/dbraw/zinc/92/52/93/458925293.db2.gz	HFTVWIXGXSIADJ-LJQANCHMSA-N	0	3	338.455	3.177	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)[C@@H]1OCCc2ccccc21)C(C)C	ZINC000441492531	458954884	/nfs/dbraw/zinc/95/48/84/458954884.db2.gz	VQIUJWGSPBMUSL-WOJBJXKFSA-N	0	3	342.483	3.115	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000457453657	458962762	/nfs/dbraw/zinc/96/27/62/458962762.db2.gz	SMGNHTBOUPCWCW-AABGKKOBSA-N	0	3	342.483	3.139	20	30		EGEDHN
C=CCCN(C)CCc1nc2sc3c(c2c(N)n1)CC[C@@H](C)C3	ZINC000467293733	458966243	/nfs/dbraw/zinc/96/62/43/458966243.db2.gz	OKSGWXQZPSZDKF-GFCCVEGCSA-N	0	3	330.501	3.449	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1CCC[C@H]1NCC1(C#N)CC1	ZINC000495957354	459018441	/nfs/dbraw/zinc/01/84/41/459018441.db2.gz	NHXGMAIEAVDBLJ-BZUAXINKSA-N	0	3	333.476	3.448	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)C[C@H](O)Cc1ccc(F)cc1	ZINC000566986795	459033156	/nfs/dbraw/zinc/03/31/56/459033156.db2.gz	LYEXKRHABDXZDB-LJQANCHMSA-N	0	3	329.415	3.426	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2CN[C@@H]2CC[C@@H](C#N)C2)C[C@@H](C)O1	ZINC000442781596	459035650	/nfs/dbraw/zinc/03/56/50/459035650.db2.gz	JKUQNASMLAFRIN-WOCWXWTJSA-N	0	3	327.472	3.078	20	30		EGEDHN
C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NCc1cc(C#N)ccc1F	ZINC000496144521	459085391	/nfs/dbraw/zinc/08/53/91/459085391.db2.gz	YMVMMVJHEYAQOD-CXAGYDPISA-N	0	3	347.434	3.432	20	30		EGEDHN
C[C@@H](O)CN(Cc1cccc(OCc2cccc(C#N)c2)c1)C1CC1	ZINC000594614479	459115543	/nfs/dbraw/zinc/11/55/43/459115543.db2.gz	HNWLUOJZMCWMNW-MRXNPFEDSA-N	0	3	336.435	3.482	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2cnc3onc(C(C)(C)C)c3c2)nc(C)n1	ZINC000590388862	459121948	/nfs/dbraw/zinc/12/19/48/459121948.db2.gz	ZQHOSCULSSZUAZ-AWEZNQCLSA-N	0	3	349.394	3.417	20	30		EGEDHN
CCOc1ccc([N+](=O)[O-])cc1CNCCc1ccc(C#N)cc1	ZINC000594954167	459191047	/nfs/dbraw/zinc/19/10/47/459191047.db2.gz	CZBLQTWAIXPPMB-UHFFFAOYSA-N	0	3	325.368	3.197	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cc(C)nn2C(C)(C)C)CC1	ZINC000522084812	459211813	/nfs/dbraw/zinc/21/18/13/459211813.db2.gz	FEVQRZIAILKEAH-UHFFFAOYSA-N	0	3	333.480	3.109	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)N1CCCN(C(C)(C)C)CC1	ZINC000522101982	459213210	/nfs/dbraw/zinc/21/32/10/459213210.db2.gz	PXHBXJRSBURILK-UHFFFAOYSA-N	0	3	345.487	3.267	20	30		EGEDHN
COc1ccc2c(c1)C[C@@H](NCc1ccc(C#N)c(Cl)c1)CO2	ZINC000590778621	459214120	/nfs/dbraw/zinc/21/41/20/459214120.db2.gz	JJWZSIPBUMQGEU-OAHLLOKOSA-N	0	3	328.799	3.314	20	30		EGEDHN
Cc1c([C@@H](C)NCCc2ccc(C#N)cc2)nnn1-c1ccccc1	ZINC000595055473	459228927	/nfs/dbraw/zinc/22/89/27/459228927.db2.gz	FDPCNSQBFCYLSY-OAHLLOKOSA-N	0	3	331.423	3.341	20	30		EGEDHN
C=CCCSCCN[C@H](C)c1ccc(S(C)(=O)=O)c(F)c1	ZINC000595059888	459232385	/nfs/dbraw/zinc/23/23/85/459232385.db2.gz	RBNPJCAAICMINW-GFCCVEGCSA-N	0	3	331.478	3.189	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1Nc1cc(N[C@@H]2CCCO[C@H]2C=C)nc(C)n1	ZINC000568182742	459241064	/nfs/dbraw/zinc/24/10/64/459241064.db2.gz	CKSPGKQLERZGQO-NCOADZHNSA-N	0	3	344.459	3.076	20	30		EGEDHN
N#CCc1ccc(OC[C@H](O)CNCc2coc3ccccc23)cc1	ZINC000579947949	459253833	/nfs/dbraw/zinc/25/38/33/459253833.db2.gz	KWZBHNRJSUFJOO-QGZVFWFLSA-N	0	3	336.391	3.028	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@H](N[C@@H]1CCc2ccc(C#N)cc21)C1CC1	ZINC000496604205	459256651	/nfs/dbraw/zinc/25/66/51/459256651.db2.gz	LSTNFFCTARYKGF-QZTJIDSGSA-N	0	3	341.455	3.438	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)NC[C@@H](C)N1CCCC1	ZINC000559593182	459267344	/nfs/dbraw/zinc/26/73/44/459267344.db2.gz	KKVJTUYWDFVACB-GFCCVEGCSA-N	0	3	327.453	3.296	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@H]2C[C@H](c3ccc(F)cc3)C2)cc1	ZINC000481662051	459267494	/nfs/dbraw/zinc/26/74/94/459267494.db2.gz	YIYIXYCSJAQOJB-BJLQDIEVSA-N	0	3	347.393	3.442	20	30		EGEDHN
Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@H]2NCC2(CC#N)CC2)cc1	ZINC000581980373	459285661	/nfs/dbraw/zinc/28/56/61/459285661.db2.gz	SYTXNUHVLUCIPB-QZTJIDSGSA-N	0	3	346.496	3.363	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN(C)C[C@@H](C)Cc1ccc(OC)cc1	ZINC000534170307	459296193	/nfs/dbraw/zinc/29/61/93/459296193.db2.gz	YKABCDADHRBRDC-KRWDZBQOSA-N	0	3	332.488	3.230	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCN2CCSC[C@H]2C2CC2)cc1Cl	ZINC000591039245	459299083	/nfs/dbraw/zinc/29/90/83/459299083.db2.gz	JNGOMLGGPRVNKB-INIZCTEOSA-N	0	3	349.887	3.368	20	30		EGEDHN
Cc1ccc([C@]2(C)CCN(Cc3cnc4c(C#N)cnn4c3)C2)cc1	ZINC000582181796	459322024	/nfs/dbraw/zinc/32/20/24/459322024.db2.gz	RNQBPDCEMIPBNN-HXUWFJFHSA-N	0	3	331.423	3.073	20	30		EGEDHN
C[C@]12CN(Cc3nnc(-c4cccc(C#N)c4)o3)C[C@@H]1[C@@H]1CC[C@H]2C1	ZINC000568833568	459352030	/nfs/dbraw/zinc/35/20/30/459352030.db2.gz	ZNLBFUYWNFXXSU-XNWPKKHHSA-N	0	3	334.423	3.476	20	30		EGEDHN
C/C=C\c1ccc(OC[C@H](O)CN2CCC[C@H](CC#N)C2)c(OC)c1	ZINC000595609773	459364850	/nfs/dbraw/zinc/36/48/50/459364850.db2.gz	OWSFFRGPPHXKEP-MXNAJAOXSA-N	0	3	344.455	3.094	20	30		EGEDHN
CN1CC[C@@H]2CCN(C(=O)c3ccc(C#Cc4ccccc4)cc3)[C@@H]2C1	ZINC000538713896	459373846	/nfs/dbraw/zinc/37/38/46/459373846.db2.gz	BWLQKXPUERVWCF-IFMALSPDSA-N	0	3	344.458	3.253	20	30		EGEDHN
C[C@@H]1CCN(CCNC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)C1	ZINC000524721468	459383269	/nfs/dbraw/zinc/38/32/69/459383269.db2.gz	MFJVDHMGFOOXPM-MRXNPFEDSA-N	0	3	349.434	3.422	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@@H](N[C@H]3CCc4c3cccc4F)C2=O)cc1	ZINC000540953412	459410420	/nfs/dbraw/zinc/41/04/20/459410420.db2.gz	BDFYAHSMYXUCSW-VQTJNVASSA-N	0	3	349.409	3.470	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)[C@@H](C)N1CCC(Cc2ccccc2)CC1	ZINC000484286576	459411255	/nfs/dbraw/zinc/41/12/55/459411255.db2.gz	BFPOVFAIJLUPEX-ZWKOTPCHSA-N	0	3	341.499	3.338	20	30		EGEDHN
N#CCC1CCN(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)CC1	ZINC000540985802	459415167	/nfs/dbraw/zinc/41/51/67/459415167.db2.gz	BINFIZLYSPLIBK-IBGZPJMESA-N	0	3	340.471	3.159	20	30		EGEDHN
CCN1CCN(c2ccc(Nc3nc(C)ccc3C#N)c(C)c2)CC1	ZINC000561100186	459419853	/nfs/dbraw/zinc/41/98/53/459419853.db2.gz	JIVYCLSSTFEGIS-UHFFFAOYSA-N	0	3	335.455	3.456	20	30		EGEDHN
CN(CCC#N)C[C@H](O)CN[C@H]1CCc2ccc(-c3ccccc3)cc21	ZINC000591761371	459430357	/nfs/dbraw/zinc/43/03/57/459430357.db2.gz	FMHFTQDDGSMYBC-IRLDBZIGSA-N	0	3	349.478	3.137	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3ccc(F)cc32)cc1	ZINC000591763972	459431141	/nfs/dbraw/zinc/43/11/41/459431141.db2.gz	ADNKEPLIVFVJKE-FXAWDEMLSA-N	0	3	340.398	3.104	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC000497080976	459431204	/nfs/dbraw/zinc/43/12/04/459431204.db2.gz	VCUUDOCTHPPLJC-UHFFFAOYSA-N	0	3	341.455	3.391	20	30		EGEDHN
N#Cc1ccc2c(c1)CC[C@@H]2NC[C@H](O)COc1ccccc1Cl	ZINC000591764223	459431762	/nfs/dbraw/zinc/43/17/62/459431762.db2.gz	XSZCNFWQTGCNLY-YJBOKZPZSA-N	0	3	342.826	3.228	20	30		EGEDHN
Cc1ccc(OC[C@@H](O)CN[C@@H]2CCc3cc(C#N)ccc32)c(C)c1	ZINC000591763950	459431866	/nfs/dbraw/zinc/43/18/66/459431866.db2.gz	SOGJLNFLTRKOOW-AZUAARDMSA-N	0	3	336.435	3.192	20	30		EGEDHN
C=CCC1(NCC(=O)Nc2sccc2C(=O)OCC)CCCC1	ZINC000595779710	459437306	/nfs/dbraw/zinc/43/73/06/459437306.db2.gz	FKZQOXXJEIXICO-UHFFFAOYSA-N	0	3	336.457	3.342	20	30		EGEDHN
Cc1ccccc1[C@H]([C@@H](C)Nc1nccc(C#N)c1Cl)N(C)C	ZINC000561408590	459449697	/nfs/dbraw/zinc/44/96/97/459449697.db2.gz	PLTNWDXQJYDGFO-DYVFJYSZSA-N	0	3	328.847	3.440	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CCC=C(c2ccncc2)C1	ZINC000561427691	459451967	/nfs/dbraw/zinc/45/19/67/459451967.db2.gz	XSFKTYJWFLPOBT-LJQANCHMSA-N	0	3	331.419	3.470	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CCC(F)(F)[C@@H](C)C1	ZINC000562046953	459505952	/nfs/dbraw/zinc/50/59/52/459505952.db2.gz	RRHWRGBVXJEECS-GOEBONIOSA-N	0	3	325.399	3.132	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@H](N[C@@H]3CCc4cc(F)ccc43)C2=O)cc1	ZINC000541881727	459506323	/nfs/dbraw/zinc/50/63/23/459506323.db2.gz	NCQLGEUAEQGVKG-UXHICEINSA-N	0	3	349.409	3.470	20	30		EGEDHN
Clc1cccc(C#CCN2CCC(CCN3CCOCC3)CC2)c1	ZINC000583302064	459516467	/nfs/dbraw/zinc/51/64/67/459516467.db2.gz	HUELQKQBUQJTHF-UHFFFAOYSA-N	0	3	346.902	3.126	20	30		EGEDHN
C[C@@H](N[C@@H]1CCCN(C)C1=O)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000542004674	459518952	/nfs/dbraw/zinc/51/89/52/459518952.db2.gz	LYWBLFQYAUMWAQ-FOIQADDNSA-N	0	3	333.435	3.497	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccccc2Oc2cccnc2)CC1	ZINC000592069263	459519577	/nfs/dbraw/zinc/51/95/77/459519577.db2.gz	VWIIJLUEMMKSJK-UHFFFAOYSA-N	0	3	337.423	3.254	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN1CCC[C@@H]1CCCc1ccccc1	ZINC000486809501	459522636	/nfs/dbraw/zinc/52/26/36/459522636.db2.gz	OAMSGQLLBSSIKX-ICSRJNTNSA-N	0	3	341.499	3.482	20	30		EGEDHN
C=CCn1c(C2CCCC2)nnc1N1CCN([C@@H]2C[C@@H]2C)C[C@@H](C)C1	ZINC000569901406	459526708	/nfs/dbraw/zinc/52/67/08/459526708.db2.gz	LXFXJPGFPIRDNJ-SOLBZPMBSA-N	0	3	343.519	3.288	20	30		EGEDHN
CCc1nc(C#N)cc(N(CC)C[C@H]2CCN(Cc3ccccc3)C2)n1	ZINC000596145080	459536430	/nfs/dbraw/zinc/53/64/30/459536430.db2.gz	QHYRAWGBANRDSZ-SFHVURJKSA-N	0	3	349.482	3.259	20	30		EGEDHN
COCCN(CC(=O)N(CCC#N)c1ccccc1)[C@@H]1CCC[C@@H]1C	ZINC000487962086	459536965	/nfs/dbraw/zinc/53/69/65/459536965.db2.gz	OJYYKFMBHVQHSM-PKOBYXMFSA-N	0	3	343.471	3.070	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N1CC[C@H](C(=O)NCc2ccccc2)C1	ZINC000592154775	459538322	/nfs/dbraw/zinc/53/83/22/459538322.db2.gz	JLZXXECIRAGKNB-JXFKEZNVSA-N	0	3	333.435	3.258	20	30		EGEDHN
Cc1cc(CN2CCC(OC[C@H]3CCCCO3)CC2)ccc1C#N	ZINC000488175258	459541083	/nfs/dbraw/zinc/54/10/83/459541083.db2.gz	JASZVEUPEJKGEU-HXUWFJFHSA-N	0	3	328.456	3.417	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cccc(F)c2C#N)C1	ZINC000488699574	459548285	/nfs/dbraw/zinc/54/82/85/459548285.db2.gz	DDLDIIKPIFHYOB-GOEBONIOSA-N	0	3	337.398	3.263	20	30		EGEDHN
CCc1nc(C#N)cc(N2C[C@H](C)N(Cc3ccccc3)C[C@@H]2C)n1	ZINC000596176265	459549184	/nfs/dbraw/zinc/54/91/84/459549184.db2.gz	BWCUSRAXNHEZOQ-HOTGVXAUSA-N	0	3	335.455	3.010	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000488742368	459550748	/nfs/dbraw/zinc/55/07/48/459550748.db2.gz	FAQIIIFNCYKFMV-MJGOQNOKSA-N	0	3	337.467	3.457	20	30		EGEDHN
N#Cc1nc(N2C[C@H]3CN(Cc4ccccc4)C[C@H]3C2)sc1Cl	ZINC000596220857	459564690	/nfs/dbraw/zinc/56/46/90/459564690.db2.gz	DAJHWSKDJJKZHG-OKILXGFUSA-N	0	3	344.871	3.236	20	30		EGEDHN
C=CCc1ccc(OC[C@@H](O)CN2CCCC[C@@H]2C=C)c(OC)c1	ZINC000489486439	459566271	/nfs/dbraw/zinc/56/62/71/459566271.db2.gz	YPDRDENQAYSAMO-ROUUACIJSA-N	0	3	331.456	3.204	20	30		EGEDHN
C=CCn1cccc1C(=O)Nc1ccccc1NC1CCN(C)CC1	ZINC000489996855	459574590	/nfs/dbraw/zinc/57/45/90/459574590.db2.gz	XICOOSAXQRVYFW-UHFFFAOYSA-N	0	3	338.455	3.433	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N[C@@H](c1cccs1)c1ccc(F)cc1	ZINC000583687812	459580329	/nfs/dbraw/zinc/58/03/29/459580329.db2.gz	YTULPMLUGPMMNP-GOEBONIOSA-N	0	3	331.416	3.114	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N[C@H](c1cccs1)c1ccc(F)cc1	ZINC000583687813	459580432	/nfs/dbraw/zinc/58/04/32/459580432.db2.gz	YTULPMLUGPMMNP-HOCLYGCPSA-N	0	3	331.416	3.114	20	30		EGEDHN
C#C[C@@H](NC(=O)NC1CCN(C2CC2)CC1)c1ccc(Cl)cc1F	ZINC000491095855	459597560	/nfs/dbraw/zinc/59/75/60/459597560.db2.gz	MYCQKVQUJYCTRF-QGZVFWFLSA-N	0	3	349.837	3.079	20	30		EGEDHN
C[C@@H](N[C@@H](C)c1ccc2c(c1)CCCC2)C(=O)NC1(C#N)CCC1	ZINC000527298911	459624433	/nfs/dbraw/zinc/62/44/33/459624433.db2.gz	SGYOBCQKVSUNQA-LSDHHAIUSA-N	0	3	325.456	3.167	20	30		EGEDHN
CCN(CCSC)Cc1cn(CCC#N)nc1-c1ccncc1	ZINC000592530241	459626712	/nfs/dbraw/zinc/62/67/12/459626712.db2.gz	PCXSEPRDFDTDIM-UHFFFAOYSA-N	0	3	329.473	3.044	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cnn(CCC(C)C)c2C(C)C)CC1	ZINC000491438451	459627134	/nfs/dbraw/zinc/62/71/34/459627134.db2.gz	CLLHKCIXVNDAAO-UHFFFAOYSA-N	0	3	344.503	3.336	20	30		EGEDHN
C=CCN1CC[C@@H](NC(C)(C)c2ccc(OC(F)(F)F)cc2)C1=O	ZINC000499702255	459648587	/nfs/dbraw/zinc/64/85/87/459648587.db2.gz	CZUAHZWHQSMBOS-CQSZACIVSA-N	0	3	342.361	3.197	20	30		EGEDHN
CC(C)n1cc([C@H](C)NCCC(=O)Nc2sccc2C#N)cn1	ZINC000543502937	459663829	/nfs/dbraw/zinc/66/38/29/459663829.db2.gz	BLZBSHJAGVHMDI-LBPRGKRZSA-N	0	3	331.445	3.077	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H]2C[C@H](C)C[C@H](c3ccccc3)C2)CC1	ZINC000491771766	459670285	/nfs/dbraw/zinc/67/02/85/459670285.db2.gz	PHWDLSLYCWRCHL-JRGCBEDISA-N	0	3	338.495	3.420	20	30		EGEDHN
C#CCNC(=O)C1CCN(Cc2ccc(Cl)c3ccccc23)CC1	ZINC000491790091	459674053	/nfs/dbraw/zinc/67/40/53/459674053.db2.gz	XHOWDGQJUFAQNN-UHFFFAOYSA-N	0	3	340.854	3.455	20	30		EGEDHN
C[C@H](NC(=O)N1CCC[C@@H](CC#N)C1)[C@@H](c1ccccc1)N(C)C	ZINC000596596989	459690867	/nfs/dbraw/zinc/69/08/67/459690867.db2.gz	HWWXIOGUVAPEDZ-BQFCYCMXSA-N	0	3	328.460	3.013	20	30		EGEDHN
CC[C@H](C)N[C@H](CNC(=O)N1CCC[C@@H](CC#N)C1)c1ccco1	ZINC000596599315	459692478	/nfs/dbraw/zinc/69/24/78/459692478.db2.gz	TXAGFGFRUQMKDN-HRCADAONSA-N	0	3	332.448	3.044	20	30		EGEDHN
C[C@H](NC(=O)c1ccc(C#Cc2ccccc2)cc1)C1=CCN(C)CC1	ZINC000543754365	459695443	/nfs/dbraw/zinc/69/54/43/459695443.db2.gz	IKZZNVKFLIMTOK-SFHVURJKSA-N	0	3	344.458	3.467	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)N2CCC(CC#N)CC2)N(C)C)cc1	ZINC000543822331	459703592	/nfs/dbraw/zinc/70/35/92/459703592.db2.gz	SALJCOPPPGXUAG-IBGZPJMESA-N	0	3	342.487	3.187	20	30		EGEDHN
C[C@H](NC(=O)OC(C)(C)C)[C@H](Cc1ccccc1)NCCCC#N	ZINC000492791628	459720712	/nfs/dbraw/zinc/72/07/12/459720712.db2.gz	NROKCLMEFTZVJX-RDJZCZTQSA-N	0	3	331.460	3.404	20	30		EGEDHN
COc1cccc([C@@H](CNCc2ccc(C#N)c(OC)c2)OC)c1	ZINC000527739762	459721562	/nfs/dbraw/zinc/72/15/62/459721562.db2.gz	SYGUMXACNNFLKW-LJQANCHMSA-N	0	3	326.396	3.053	20	30		EGEDHN
CN(Cc1ccccc1)C1(CNC(=O)Nc2cccc(C#N)n2)CCC1	ZINC000573719447	459723517	/nfs/dbraw/zinc/72/35/17/459723517.db2.gz	PQOWWDBLSRRLMR-UHFFFAOYSA-N	0	3	349.438	3.129	20	30		EGEDHN
N#C[C@@H]1CC[C@@H](N[C@@H]2CC(=O)N(c3cccc(C(F)(F)F)c3)C2)C1	ZINC000584389686	459723780	/nfs/dbraw/zinc/72/37/80/459723780.db2.gz	RHJWJGMWCFMUJS-MRVWCRGKSA-N	0	3	337.345	3.093	20	30		EGEDHN
Cc1nc(COc2ccc(CN3CCC(CCC#N)CC3)cc2)no1	ZINC000563158571	459726522	/nfs/dbraw/zinc/72/65/22/459726522.db2.gz	RSVUXHHXPIVSEV-UHFFFAOYSA-N	0	3	340.427	3.473	20	30		EGEDHN
N#Cc1ccc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)cc1C#N	ZINC000593068521	459763215	/nfs/dbraw/zinc/76/32/15/459763215.db2.gz	PNANKQHACSJOFB-KGLIPLIRSA-N	0	3	337.301	3.116	20	30		EGEDHN
N#CC(C(=O)c1ccc2cnccc2c1)c1nnc2n1CCCCC2	ZINC000564777436	459776779	/nfs/dbraw/zinc/77/67/79/459776779.db2.gz	DOEGPNNKKZDNDK-INIZCTEOSA-N	0	3	331.379	3.043	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CC[C@H](c2ccncc2)C1	ZINC000574098569	459778919	/nfs/dbraw/zinc/77/89/19/459778919.db2.gz	QQRRADLCCMRAGY-VQTJNVASSA-N	0	3	338.451	3.039	20	30		EGEDHN
O[C@@H](CNCC#Cc1ccccc1)CO[C@@H]1CCCc2ccccc21	ZINC000565475863	459784699	/nfs/dbraw/zinc/78/46/99/459784699.db2.gz	GUHULEGWVLWJBZ-RBBKRZOGSA-N	0	3	335.447	3.083	20	30		EGEDHN
C[C@H]1O[C@@H](C)[C@@H](C)[C@H]1C(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1	ZINC000528917782	459817475	/nfs/dbraw/zinc/81/74/75/459817475.db2.gz	HPXVTKWXRKHJLB-SPSJUYOASA-N	0	3	334.803	3.047	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2nccn2-c2ccccc2)CC1	ZINC000574504867	459828068	/nfs/dbraw/zinc/82/80/68/459828068.db2.gz	AYNFOJWDFJPBOV-UHFFFAOYSA-N	0	3	339.443	3.034	20	30		EGEDHN
COC(=O)[C@@H](Cc1ccccc1)[C@H](C)NCc1ccc(C#N)cc1C	ZINC000585755337	459842430	/nfs/dbraw/zinc/84/24/30/459842430.db2.gz	HIMGIIYWMOHVCO-JXFKEZNVSA-N	0	3	336.435	3.377	20	30		EGEDHN
CC[C@H](C#N)C(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1	ZINC000593426841	459885305	/nfs/dbraw/zinc/88/53/05/459885305.db2.gz	OWOORTDJPCLVDB-CQSZACIVSA-N	0	3	341.377	3.145	20	30		EGEDHN
N#Cc1ccsc1NC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000608931112	459894680	/nfs/dbraw/zinc/89/46/80/459894680.db2.gz	KRXGWRSPIRXGTF-UHFFFAOYSA-N	0	3	325.437	3.470	20	30		EGEDHN
N#CCN1CCC(NCc2csc(-c3ccc(F)cc3)n2)CC1	ZINC000609334755	459946320	/nfs/dbraw/zinc/94/63/20/459946320.db2.gz	FSKVADKFLWCVFB-UHFFFAOYSA-N	0	3	330.432	3.027	20	30		EGEDHN
Cc1ccc(C)c(OC2CCN(C[C@H](O)CC(C)(C)C#N)CC2)c1	ZINC000598586324	459953793	/nfs/dbraw/zinc/95/37/93/459953793.db2.gz	FTXDJPLIEKXLBI-QGZVFWFLSA-N	0	3	330.472	3.447	20	30		EGEDHN
CCCN(CCN1CCCC1)C(=O)N[C@@H](C)c1cccc(C#N)c1	ZINC000588375658	459954468	/nfs/dbraw/zinc/95/44/68/459954468.db2.gz	QXNBPZVHNMANIV-INIZCTEOSA-N	0	3	328.460	3.137	20	30		EGEDHN
C[C@H]1Cc2ccccc2N1C1CCN(C[C@@H](O)CC(C)(C)C#N)CC1	ZINC000598594033	459957156	/nfs/dbraw/zinc/95/71/56/459957156.db2.gz	FENXQRUUULCMQL-LPHOPBHVSA-N	0	3	341.499	3.203	20	30		EGEDHN
COCCCN(CCc1ccc(OC)cc1)Cc1cccc(C#N)n1	ZINC000602476895	459957869	/nfs/dbraw/zinc/95/78/69/459957869.db2.gz	ZOJCIHVFMLSYSW-UHFFFAOYSA-N	0	3	339.439	3.043	20	30		EGEDHN
CCC[C@@H]1CN(C[C@H](O)CC(C)(C)C#N)CCN1Cc1ccccc1	ZINC000598600882	459959197	/nfs/dbraw/zinc/95/91/97/459959197.db2.gz	HOVARKUQUCOPKW-WOJBJXKFSA-N	0	3	343.515	3.274	20	30		EGEDHN
CCCN(CCN1CCCC1)C(=O)N[C@H]1CCc2cc(C#N)ccc21	ZINC000588666954	459962572	/nfs/dbraw/zinc/96/25/72/459962572.db2.gz	YVPRPJARIKKLIT-IBGZPJMESA-N	0	3	340.471	3.063	20	30		EGEDHN
COc1ccc(CN(C)C)cc1N[C@H](C)CC1(C#N)CCOCC1	ZINC000602489922	459965602	/nfs/dbraw/zinc/96/56/02/459965602.db2.gz	BFYBISZFWIYPCD-OAHLLOKOSA-N	0	3	331.460	3.268	20	30		EGEDHN
CCOc1ccc(CN[C@H](C)CC2(C#N)CCOCC2)cc1OC	ZINC000602508293	459975044	/nfs/dbraw/zinc/97/50/44/459975044.db2.gz	AXEFAMGUBVGFAM-OAHLLOKOSA-N	0	3	332.444	3.282	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CC1(C#N)CCCCC1	ZINC000597515648	459982150	/nfs/dbraw/zinc/98/21/50/459982150.db2.gz	CTAQOGJWYZCQCN-PKOBYXMFSA-N	0	3	339.483	3.487	20	30		EGEDHN
Cc1ccc(Br)c(CNC[C@H](O)CC(C)(C)C#N)c1	ZINC000598727109	460007837	/nfs/dbraw/zinc/00/78/37/460007837.db2.gz	CLKHTFWMHMOBFH-CYBMUJFWSA-N	0	3	325.250	3.148	20	30		EGEDHN
COc1cc(Br)c(CNC[C@@H](C)CCC#N)cc1OC	ZINC000602542958	459990670	/nfs/dbraw/zinc/99/06/70/459990670.db2.gz	BTCQEARYDNVKNX-NSHDSACASA-N	0	3	341.249	3.496	20	30		EGEDHN
N#Cc1cccc(CN[C@H]2CCCN(c3ccccc3Cl)C2)n1	ZINC000602549845	459991871	/nfs/dbraw/zinc/99/18/71/459991871.db2.gz	GDVIQZSFBZWZEL-INIZCTEOSA-N	0	3	326.831	3.365	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CNCc1ccc(OCC(F)(F)F)cc1	ZINC000598699918	459998646	/nfs/dbraw/zinc/99/86/46/459998646.db2.gz	JKFDOCSIOIUIBF-CYBMUJFWSA-N	0	3	330.350	3.018	20	30		EGEDHN
CCOc1cc(CNC[C@@H](O)CC(C)(C)C#N)ccc1OC(F)F	ZINC000598715077	460003087	/nfs/dbraw/zinc/00/30/87/460003087.db2.gz	MJXPUUHOGXLFPX-ZDUSSCGKSA-N	0	3	342.386	3.077	20	30		EGEDHN
Cc1cc(CNC[C@H](O)CC(C)(C)C#N)ccc1Br	ZINC000598727464	460008209	/nfs/dbraw/zinc/00/82/09/460008209.db2.gz	IFLDDLIOSDIZJC-CYBMUJFWSA-N	0	3	325.250	3.148	20	30		EGEDHN
Cn1nccc1[C@H]1CCCCN1C(=O)C(C#N)CCc1ccccc1	ZINC000597612331	460008529	/nfs/dbraw/zinc/00/85/29/460008529.db2.gz	WACJOSJOVYXYAJ-PKOBYXMFSA-N	0	3	336.439	3.246	20	30		EGEDHN
C[C@H](CCC#N)CN[C@@H](CCO)c1ccccc1Br	ZINC000602596091	460015531	/nfs/dbraw/zinc/01/55/31/460015531.db2.gz	GMZDIPKNGZBNIW-DOMZBBRYSA-N	0	3	325.250	3.402	20	30		EGEDHN
CN1CCN(CCCOc2cccc(C#N)c2)CC12CCCCC2	ZINC000593998206	460048195	/nfs/dbraw/zinc/04/81/95/460048195.db2.gz	KAMGUROMJKXJCH-UHFFFAOYSA-N	0	3	327.472	3.277	20	30		EGEDHN
C[C@@H](N[C@@H](C)CC1(C#N)CCOCC1)c1ccc2c(c1)CCC(=O)N2	ZINC000602658460	460049010	/nfs/dbraw/zinc/04/90/10/460049010.db2.gz	YERKRDWNXOFGQA-LSDHHAIUSA-N	0	3	341.455	3.321	20	30		EGEDHN
N#Cc1cccc(OCCN2CC[C@]3(C2)CCc2ccccc2O3)c1	ZINC000589278728	460066241	/nfs/dbraw/zinc/06/62/41/460066241.db2.gz	REXNDPLAXWJQPG-NRFANRHFSA-N	0	3	334.419	3.407	20	30		EGEDHN
C[C@@H](CCC#N)CN1CCN(c2cc(-c3ccc(C#N)cc3)[nH]n2)CC1	ZINC000602710375	460077971	/nfs/dbraw/zinc/07/79/71/460077971.db2.gz	UDSXQONHDDJHOF-INIZCTEOSA-N	0	3	348.454	3.010	20	30		EGEDHN
COc1cccc([C@H](CN[C@@H](C)CC2(C#N)CCOCC2)OC)c1	ZINC000602720665	460084524	/nfs/dbraw/zinc/08/45/24/460084524.db2.gz	KPGRONPGVMOBEV-YJBOKZPZSA-N	0	3	332.444	3.071	20	30		EGEDHN
CC[C@H](Cc1ccccc1)N(C)CC(=O)NCc1ccc(C#N)cc1	ZINC000610215784	460085313	/nfs/dbraw/zinc/08/53/13/460085313.db2.gz	WYKAHHNDZAWQLA-HXUWFJFHSA-N	0	3	335.451	3.128	20	30		EGEDHN
C[C@@H]1c2ccccc2OCCN1C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000598894084	460087557	/nfs/dbraw/zinc/08/75/57/460087557.db2.gz	QMKYNLAHBCCPGX-QAPCUYQASA-N	0	3	345.402	3.223	20	30		EGEDHN
C[C@H](NC(=O)[C@H]1CCCN(Cc2cccnc2)C1)c1cccc(C#N)c1	ZINC000610363354	460135076	/nfs/dbraw/zinc/13/50/76/460135076.db2.gz	FSEVASMCAZIIMC-JXFKEZNVSA-N	0	3	348.450	3.043	20	30		EGEDHN
CC(C)(C#N)c1ccc(C(=O)N[C@@H]2CCCN3CCCC[C@@H]23)cc1	ZINC000594196807	460144087	/nfs/dbraw/zinc/14/40/87/460144087.db2.gz	NGMMVLCAHHBPQA-MSOLQXFVSA-N	0	3	325.456	3.234	20	30		EGEDHN
Cc1cc(N2CC[C@H](Oc3ccc(C#N)cn3)C2)c2ccccc2n1	ZINC000589871341	460154218	/nfs/dbraw/zinc/15/42/18/460154218.db2.gz	XOJNSZVFLRLPHR-INIZCTEOSA-N	0	3	330.391	3.468	20	30		EGEDHN
C[C@@H](NC(=O)N1CCN(C2CCC2)C[C@H](C)C1)c1cccc(C#N)c1	ZINC000589893154	460156851	/nfs/dbraw/zinc/15/68/51/460156851.db2.gz	LJHQUNVWAOZYIQ-JKSUJKDBSA-N	0	3	340.471	3.135	20	30		EGEDHN
N#Cc1cc(Cl)ccc1CN1CCCN(c2ccncc2)CC1	ZINC000602849976	460156841	/nfs/dbraw/zinc/15/68/41/460156841.db2.gz	SMNMKMRTTWVSEQ-UHFFFAOYSA-N	0	3	326.831	3.319	20	30		EGEDHN
C[C@@]1(NC(=O)c2ccc(F)c(C#N)c2)CCN(Cc2ccccc2)C1	ZINC000576522031	460159896	/nfs/dbraw/zinc/15/98/96/460159896.db2.gz	XXWGVAQKKVDWQN-HXUWFJFHSA-N	0	3	337.398	3.092	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)C(=O)NC[C@H](Cc1ccccc1)N(C)C	ZINC000594227021	460160400	/nfs/dbraw/zinc/16/04/00/460160400.db2.gz	QSNGQPRXSOBESQ-UTKZUKDTSA-N	0	3	349.478	3.026	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)C(=O)NC[C@@H](Cc1ccccc1)N(C)C	ZINC000594227019	460161221	/nfs/dbraw/zinc/16/12/21/460161221.db2.gz	QSNGQPRXSOBESQ-DYESRHJHSA-N	0	3	349.478	3.026	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N[C@@H]1COc2cc(F)ccc2C1	ZINC000598222347	460211179	/nfs/dbraw/zinc/21/11/79/460211179.db2.gz	XDWFUHFLQZFVRH-AEFFLSMTSA-N	0	3	338.382	3.018	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N1CCC(CCc2ccc(F)cc2F)CC1	ZINC000594448829	460223986	/nfs/dbraw/zinc/22/39/86/460223986.db2.gz	PRADOSOXYQMIRD-GOSISDBHSA-N	0	3	349.425	3.157	20	30		EGEDHN
Cc1ccc(CN2CC[C@@H](NC(=O)Nc3cccc(CC#N)c3)C2)cc1	ZINC000603034676	460225631	/nfs/dbraw/zinc/22/56/31/460225631.db2.gz	YRUMYKLNPQVTSA-HXUWFJFHSA-N	0	3	348.450	3.457	20	30		EGEDHN
CC(C)[C@@H](NC[C@H](O)COc1ccccc1C#N)c1ccc(F)cc1	ZINC000599312482	460226877	/nfs/dbraw/zinc/22/68/77/460226877.db2.gz	UTNVBZZOPKKFNA-AZUAARDMSA-N	0	3	342.414	3.424	20	30		EGEDHN
N#CCCn1cc(CN[C@@H]2CCC(F)(F)C2)c(-c2ccncc2)n1	ZINC000618966622	460236283	/nfs/dbraw/zinc/23/62/83/460236283.db2.gz	QMVVHJTVZPOTIJ-OAHLLOKOSA-N	0	3	331.370	3.136	20	30		EGEDHN
C[C@@H](NC[C@H](O)CC1(C#N)CCOCC1)c1cc2ccccc2o1	ZINC000599358130	460237620	/nfs/dbraw/zinc/23/76/20/460237620.db2.gz	FABQCHHOBCIJEA-GDBMZVCRSA-N	0	3	328.412	3.155	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N[C@H](C)CN2CCC(C)CC2)cc1	ZINC000618983982	460242695	/nfs/dbraw/zinc/24/26/95/460242695.db2.gz	OISQHNAYJRMLHQ-QGZVFWFLSA-N	0	3	330.472	3.031	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)Nc1ccnc(C#N)c1)c1ccsc1	ZINC000603140471	460252042	/nfs/dbraw/zinc/25/20/42/460252042.db2.gz	VPBQUBGMRFPYAL-MRXNPFEDSA-N	0	3	343.456	3.219	20	30		EGEDHN
C=CCC1(NC(=O)[C@@H]2CCCN(Cc3cccnc3)C2)CCCC1	ZINC000619104783	460270150	/nfs/dbraw/zinc/27/01/50/460270150.db2.gz	WKLYENMIAZXEDT-GOSISDBHSA-N	0	3	327.472	3.299	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN[C@H](CCO)c1cc(Cl)cc(Cl)c1	ZINC000599676281	460306651	/nfs/dbraw/zinc/30/66/51/460306651.db2.gz	DFGZKKXDSIGQNH-LSDHHAIUSA-N	0	3	345.270	3.307	20	30		EGEDHN
COc1cc(C#N)ccc1CN1CC[C@@H](N(C)Cc2ccccc2)C1	ZINC000611235956	460313395	/nfs/dbraw/zinc/31/33/95/460313395.db2.gz	KOBSWENQJPOKAD-HXUWFJFHSA-N	0	3	335.451	3.273	20	30		EGEDHN
Cc1ccc(S(=O)(=O)CCCN[C@H](C)c2cccc(C#N)c2)cc1	ZINC000611387091	460350227	/nfs/dbraw/zinc/35/02/27/460350227.db2.gz	ZFHMTCHFVHMOMQ-MRXNPFEDSA-N	0	3	342.464	3.381	20	30		EGEDHN
CN(C(=O)CN[C@@H]1CCCc2cc(C#N)ccc21)C1CCCCC1	ZINC000611393743	460353471	/nfs/dbraw/zinc/35/34/71/460353471.db2.gz	LLZPTDIMZVJWAG-LJQANCHMSA-N	0	3	325.456	3.316	20	30		EGEDHN
C[C@H](N[C@H]1CCCc2cc(C#N)ccc21)C(=O)NCc1ccccc1	ZINC000611392466	460354195	/nfs/dbraw/zinc/35/41/95/460354195.db2.gz	RKQYUFLFHMWCKH-YWZLYKJASA-N	0	3	333.435	3.230	20	30		EGEDHN
Cc1cccc(C(C)(C)NC[C@@H](O)COc2ccc(CC#N)cc2)c1	ZINC000611396300	460354698	/nfs/dbraw/zinc/35/46/98/460354698.db2.gz	IESYJYQHTXQCJA-LJQANCHMSA-N	0	3	338.451	3.326	20	30		EGEDHN
COC(=O)[C@H](C)Oc1ccc(CN[C@@H](C)c2cccc(C#N)c2)cc1	ZINC000611442126	460366989	/nfs/dbraw/zinc/36/69/89/460366989.db2.gz	XHJVEUXYRUNPBY-GJZGRUSLSA-N	0	3	338.407	3.349	20	30		EGEDHN
Cc1cccc(C)c1OC[C@@H](O)CN[C@@H](C)c1ccc(C#N)c(F)c1	ZINC000611465532	460370274	/nfs/dbraw/zinc/37/02/74/460370274.db2.gz	LIEMZMWROJTPTL-YJBOKZPZSA-N	0	3	342.414	3.405	20	30		EGEDHN
CC1CCN([C@H](CNC(=O)NCC(C)(C)C#N)c2cccs2)CC1	ZINC000611622971	460417899	/nfs/dbraw/zinc/41/78/99/460417899.db2.gz	PWWZOAPYKOZNIZ-OAHLLOKOSA-N	0	3	348.516	3.370	20	30		EGEDHN
C[C@@H](CNC(=O)NCc1ccc(C#N)c(Cl)c1)N1CCC[C@@H](C)C1	ZINC000619757459	460433481	/nfs/dbraw/zinc/43/34/81/460433481.db2.gz	BQKQULGFUJOZDG-KGLIPLIRSA-N	0	3	348.878	3.131	20	30		EGEDHN
CC(C)(NC(=O)C(C#N)CCc1ccccc1)C(=O)Nc1ccccc1	ZINC000600225777	460448690	/nfs/dbraw/zinc/44/86/90/460448690.db2.gz	AEEAGQSIWVWNNT-KRWDZBQOSA-N	0	3	349.434	3.292	20	30		EGEDHN
Cc1cccc2c1CC[C@H]2N[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000617099080	460743376	/nfs/dbraw/zinc/74/33/76/460743376.db2.gz	PWGHAOKUTZYXNR-NHCUHLMSSA-N	0	3	345.446	3.245	20	30		EGEDHN
C[C@H](Oc1ccc(C#N)cc1)c1nc(C2C[C@H]3CC[C@@H](C2)N3C)no1	ZINC000612955085	460782672	/nfs/dbraw/zinc/78/26/72/460782672.db2.gz	RYQLAKHEBUSRKP-WWTUQBGBSA-N	0	3	338.411	3.421	20	30		EGEDHN
Cc1ccc(CN2CC[C@@H](NC(=O)NCC(C)(C)CCC#N)C2)cc1	ZINC000601604390	460844001	/nfs/dbraw/zinc/84/40/01/460844001.db2.gz	SOCMEOWVOOVTAF-GOSISDBHSA-N	0	3	342.487	3.199	20	30		EGEDHN
CN(C(=O)[C@@H]1CN(C(C)(C)C)C[C@H]1C(F)(F)F)[C@H]1CCC[C@@H]1C#N	ZINC000601823158	460912683	/nfs/dbraw/zinc/91/26/83/460912683.db2.gz	XZGLMEPALCLDOS-SYQHCUMBSA-N	0	3	345.409	3.046	20	30		EGEDHN
C=CCCCCCN(C)Cc1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000638095914	461237695	/nfs/dbraw/zinc/23/76/95/461237695.db2.gz	XFTAEACYSDMWTO-UHFFFAOYSA-N	0	3	330.881	3.166	20	30		EGEDHN
C=C(C)Cn1c([C@@H]2CCCCO2)nnc1N(C)CCN1CCCCC1	ZINC000652626675	461306471	/nfs/dbraw/zinc/30/64/71/461306471.db2.gz	HDNNRLNSPHJSNA-KRWDZBQOSA-N	0	3	347.507	3.018	20	30		EGEDHN
C=C(C)Cn1c(CC2CC2)nnc1N1CCN(C(C)(C)CC)CC1	ZINC000655640060	461342612	/nfs/dbraw/zinc/34/26/12/461342612.db2.gz	ZRQGYNMLXZYWFE-UHFFFAOYSA-N	0	3	331.508	3.117	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC2CCN(Cc3ccc(OC)cc3)CC2)C1	ZINC000630847581	461361676	/nfs/dbraw/zinc/36/16/76/461361676.db2.gz	JFZWISOLVUOWSY-UHFFFAOYSA-N	0	3	342.483	3.380	20	30		EGEDHN
C=CC[C@@H]1N(C(=O)NC2CCN([C@@H]3CCOC3)CC2)CCCC1(C)C	ZINC000666977157	461895309	/nfs/dbraw/zinc/89/53/09/461895309.db2.gz	XJMIWFQTZUCOBG-MSOLQXFVSA-N	0	3	349.519	3.016	20	30		EGEDHN
C=CCCn1cc(CNC[C@H]2CCCN(C)[C@@H]2c2cccs2)nn1	ZINC000657374871	462080724	/nfs/dbraw/zinc/08/07/24/462080724.db2.gz	TZQSZNONMNTDAM-QAPCUYQASA-N	0	3	345.516	3.088	20	30		EGEDHN
C=CCN(CCc1nc(-c2cccc(Cl)c2)no1)[C@@H](C)COC	ZINC000661244788	462168516	/nfs/dbraw/zinc/16/85/16/462168516.db2.gz	YGALAEXWUOPPEH-ZDUSSCGKSA-N	0	3	335.835	3.455	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)N[C@@H]2CCCN3CCCC[C@@H]23)cc1	ZINC000654561294	462286583	/nfs/dbraw/zinc/28/65/83/462286583.db2.gz	HMFMFJCEEARVCQ-MOPGFXCFSA-N	0	3	343.471	3.068	20	30		EGEDHN
CSC[C@@H]1CCCN1Cc1cn(C)nc1-c1ccc(C#N)cc1	ZINC000180219701	533750032	/nfs/dbraw/zinc/75/00/32/533750032.db2.gz	WWQCGODUQKVKPA-KRWDZBQOSA-N	0	3	326.469	3.286	20	30		EGEDHN
C=CCN1CCC(NC(=O)Cc2ccc(Cl)c(Cl)c2)CC1	ZINC000171725101	526424637	/nfs/dbraw/zinc/42/46/37/526424637.db2.gz	JNTNZMKCERHYOB-UHFFFAOYSA-N	0	3	327.255	3.303	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCCSc2ccc(C)cc2)CC1	ZINC000171703242	526434579	/nfs/dbraw/zinc/43/45/79/526434579.db2.gz	VUEREMAEEIWODS-UHFFFAOYSA-N	0	3	333.501	3.037	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2csc(-c3ccccc3C)n2)CC1	ZINC000171715399	526449562	/nfs/dbraw/zinc/44/95/62/526449562.db2.gz	WPFTVYLZOQLYMJ-UHFFFAOYSA-N	0	3	341.480	3.499	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2csc(-c3ccc(C)o3)n2)CC1	ZINC000171718732	526449937	/nfs/dbraw/zinc/44/99/37/526449937.db2.gz	BKTJEVYBTVBMCO-UHFFFAOYSA-N	0	3	331.441	3.092	20	30		EGEDHN
C=C(C)CN(CC)C(=O)C(=O)Nc1cccc(CN2CCCCC2)c1	ZINC000154671079	526517254	/nfs/dbraw/zinc/51/72/54/526517254.db2.gz	DETORQKKOJMXOK-UHFFFAOYSA-N	0	3	343.471	3.036	20	30		EGEDHN
C#CCCCCNC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C	ZINC000155113405	526697422	/nfs/dbraw/zinc/69/74/22/526697422.db2.gz	LCNKGFYCSQSSIF-GOSISDBHSA-N	0	3	327.472	3.096	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)cc1)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000153796859	528939804	/nfs/dbraw/zinc/93/98/04/528939804.db2.gz	BVDNHWATXHEFMY-IBGZPJMESA-N	0	3	339.395	3.410	20	30		EGEDHN
CCC1(CC)[C@H](N[C@@H](C)C(=O)Nc2ccccc2C#N)C[C@H]1OC	ZINC000178363536	529111270	/nfs/dbraw/zinc/11/12/70/529111270.db2.gz	YGECSTIFTRQMNG-IAOVAPTHSA-N	0	3	329.444	3.069	20	30		EGEDHN
CC[C@H](c1ccncc1)N(C)CCOc1ccc(C#N)cc1OC	ZINC000130274865	529186573	/nfs/dbraw/zinc/18/65/73/529186573.db2.gz	JRFRPOPOXOEZMZ-QGZVFWFLSA-N	0	3	325.412	3.424	20	30		EGEDHN
CCN1CCCC[C@H]1CNC(=O)CCCCOc1cccc(C#N)c1	ZINC000264696820	535503647	/nfs/dbraw/zinc/50/36/47/535503647.db2.gz	IWRBMPWUMPBJQX-SFHVURJKSA-N	0	3	343.471	3.098	20	30		EGEDHN
CN(CCC(=O)Nc1sccc1C#N)CCN(C)c1ccccc1	ZINC000341218915	536307455	/nfs/dbraw/zinc/30/74/55/536307455.db2.gz	MAKGNCNEZUFBDW-UHFFFAOYSA-N	0	3	342.468	3.017	20	30		EGEDHN
COc1cc(OC)c2ncc(C#N)c(N[C@H]3CCCN(C)[C@H]3C)c2c1	ZINC000342829659	536869572	/nfs/dbraw/zinc/86/95/72/536869572.db2.gz	FCAUWJZIHCRZFS-LRDDRELGSA-N	0	3	340.427	3.018	20	30		EGEDHN
C=CC1CCN(Cc2c[nH]nc2-c2ccc3c(c2)OCCO3)CC1	ZINC000093359339	546684319	/nfs/dbraw/zinc/68/43/19/546684319.db2.gz	XLUIPRHOYHJKMI-UHFFFAOYSA-N	0	3	325.412	3.246	20	30		EGEDHN
COCCOc1cc(C(=O)C(C#N)c2ccc3ccccc3n2)ccn1	ZINC000679090055	549632443	/nfs/dbraw/zinc/63/24/43/549632443.db2.gz	PJPPVGACNSDICN-MRXNPFEDSA-N	0	3	347.374	3.145	20	30		EGEDHN
C=CCN(CCOC)C(=O)N[C@H](CN1CCCCC1)c1ccccc1	ZINC000682868823	550156359	/nfs/dbraw/zinc/15/63/59/550156359.db2.gz	OWXKWSRYACIRJX-LJQANCHMSA-N	0	3	345.487	3.058	20	30		EGEDHN
C#Cc1cccc(NC(=S)NCCCN2CCc3ccccc3C2)c1	ZINC000726457400	574556724	/nfs/dbraw/zinc/55/67/24/574556724.db2.gz	PAEJDRXOVQLOGA-UHFFFAOYSA-N	0	3	349.503	3.403	20	30		EGEDHN
C[C@H](CC(=O)C(C#N)C(=O)NC1CCCCC1)c1ccccc1F	ZINC000726858726	574574309	/nfs/dbraw/zinc/57/43/09/574574309.db2.gz	UAFPKAJBNCHIHH-CZUORRHYSA-N	0	3	330.403	3.477	20	30		EGEDHN
COC(=O)CCCN1CCC(N=Nc2nc3ccccc3s2)CC1	ZINC000727057720	574638058	/nfs/dbraw/zinc/63/80/58/574638058.db2.gz	FWRLGPGGUJGKQR-UHFFFAOYSA-N	0	3	346.456	3.113	20	30		EGEDHN
C#Cc1cccc(N(CC)C(=O)[C@H]2CCCN(Cc3cccnc3)C2)c1	ZINC000728539961	574757951	/nfs/dbraw/zinc/75/79/51/574757951.db2.gz	VJMNPXGKOFKALX-FQEVSTJZSA-N	0	3	347.462	3.328	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN[C@@H](C)c2ccc3c(c2)CC(=O)N3C)cc1	ZINC000728714825	574767703	/nfs/dbraw/zinc/76/77/03/574767703.db2.gz	ABHPTUXUBYHSBQ-CABCVRRESA-N	0	3	349.434	3.347	20	30		EGEDHN
C#CCOc1ccc(NC(=O)NC[C@@H](C)N2CCCC[C@@H]2C)cc1	ZINC000731114607	575055498	/nfs/dbraw/zinc/05/54/98/575055498.db2.gz	IYTDXNPXMAMHKI-JKSUJKDBSA-N	0	3	329.444	3.083	20	30		EGEDHN
C=CC[C@@H](NC(=O)NC[C@H](c1ccccc1)N(C)C)c1ccncc1	ZINC000734652859	575531871	/nfs/dbraw/zinc/53/18/71/575531871.db2.gz	UOHZNALVIVSNNS-RTBURBONSA-N	0	3	338.455	3.301	20	30		EGEDHN
C=CC[C@H](NC(=O)NCCN(C)Cc1ccccc1)c1ccncc1	ZINC000734661827	575534044	/nfs/dbraw/zinc/53/40/44/575534044.db2.gz	RQPXKKDQOHVECE-IBGZPJMESA-N	0	3	338.455	3.130	20	30		EGEDHN
Cc1ncc2c(n1)CCC[C@@H]2NCc1ccc(N(C)CCC#N)cc1	ZINC000734851893	575560783	/nfs/dbraw/zinc/56/07/83/575560783.db2.gz	KUEVJMQGOMGFFT-IBGZPJMESA-N	0	3	335.455	3.302	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)C(=O)NC1CCCCC1)c1cccc(F)c1	ZINC000734964741	575582176	/nfs/dbraw/zinc/58/21/76/575582176.db2.gz	ZUXYGGYOINCEOO-GUYCJALGSA-N	0	3	330.403	3.477	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]\Cc2cccc(-n3cncn3)c2)c([O-])c1	ZINC000735414352	575656699	/nfs/dbraw/zinc/65/66/99/575656699.db2.gz	FNMMEBPHICPBMJ-BKUYFWCQSA-N	0	3	349.438	3.438	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2nc(-c3ccccc3F)oc2C)CC1	ZINC000737842105	576266526	/nfs/dbraw/zinc/26/65/26/576266526.db2.gz	VGCPSRTUEOVAJC-UHFFFAOYSA-N	0	3	343.402	3.169	20	30		EGEDHN
C#CCOc1ccc(C(=O)N(CCN2CCCC2)c2ccccc2)cc1	ZINC000741570550	576702300	/nfs/dbraw/zinc/70/23/00/576702300.db2.gz	UQQVCTNLCSJEKI-UHFFFAOYSA-N	0	3	348.446	3.441	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2ccc(OCCCC)cc2)CC1	ZINC000742179721	576756033	/nfs/dbraw/zinc/75/60/33/576756033.db2.gz	HZFFUEJMEWNCPA-UHFFFAOYSA-N	0	3	328.456	3.083	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2cc(Cl)ccc2Cl)CC1	ZINC000742179767	576756091	/nfs/dbraw/zinc/75/60/91/576756091.db2.gz	KZCBBNZACPRQSQ-UHFFFAOYSA-N	0	3	325.239	3.211	20	30		EGEDHN
C#CCCN1CCC(NC(=O)CCCCCc2cccs2)CC1	ZINC000743489638	576810254	/nfs/dbraw/zinc/81/02/54/576810254.db2.gz	IYQKJULGGVEJEE-UHFFFAOYSA-N	0	3	332.513	3.455	20	30		EGEDHN
C#Cc1ccc(C(=O)N(CC)C[C@H]2CCN(Cc3ccccc3)C2)cn1	ZINC000743781142	576815839	/nfs/dbraw/zinc/81/58/39/576815839.db2.gz	BUPJVKNLRNJISB-IBGZPJMESA-N	0	3	347.462	3.047	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)[C@@H](C)c1ccccc1C(F)(F)F	ZINC000744032089	576819271	/nfs/dbraw/zinc/81/92/71/576819271.db2.gz	BZIUEEBZLSNDEK-CMPLNLGQSA-N	0	3	326.318	3.042	20	30		EGEDHN
CC[C@@H]1CN(CC(=O)C(C#N)c2nc3ccccc3s2)CCS1	ZINC000744424799	576827869	/nfs/dbraw/zinc/82/78/69/576827869.db2.gz	VTDRNGNUXWIDOD-CHWSQXEVSA-N	0	3	345.493	3.300	20	30		EGEDHN
CCOc1ccc(/C=N/CCN(C)Cc2ccc(F)cc2)c(O)c1	ZINC000749007540	1299126102	/nfs/dbraw/zinc/12/61/02/1299126102.db2.gz	IENIQLACNDGWJG-FYJGNVAPSA-N	0	3	330.403	3.481	20	30		EGEDHN
C=CCn1c(COc2ccccc2)nnc1SCCN1CCCC1	ZINC000768407513	1302896329	/nfs/dbraw/zinc/89/63/29/1302896329.db2.gz	QFLHSIBFPOHCGC-UHFFFAOYSA-N	0	3	344.484	3.231	20	30		EGEDHN
C#CCOc1ccc(Br)cc1CNC[C@@H]1CCCCO1	ZINC000042815853	1291446119	/nfs/dbraw/zinc/44/61/19/1291446119.db2.gz	BMWXGSLMOKGAOR-HNNXBMFYSA-N	0	3	338.245	3.120	20	30		EGEDHN
Cc1ccc(CCC(=O)C(C#N)C(=O)NC2CCCCC2)c(C)c1	ZINC000050680253	1291654339	/nfs/dbraw/zinc/65/43/39/1291654339.db2.gz	CACSRLWKTMMJBE-GOSISDBHSA-N	0	3	326.440	3.394	20	30		EGEDHN
CCCC(=O)N1CCC[C@H](C(=O)C(C#N)c2nc3ccccc3o2)C1	ZINC000066516608	1292120174	/nfs/dbraw/zinc/12/01/74/1292120174.db2.gz	YFFRTJNRYOPVFP-KBPBESRZSA-N	0	3	339.395	3.043	20	30		EGEDHN
COC(=O)c1ccc(CCC(=O)C(C#N)c2nc3ccccc3o2)cc1	ZINC000069581652	1292245852	/nfs/dbraw/zinc/24/58/52/1292245852.db2.gz	FJRGGAUOIQRVFY-OAHLLOKOSA-N	0	3	348.358	3.423	20	30		EGEDHN
CCOC(=O)N[C@@H](C(=O)C(C#N)c1nc(C(C)C)cs1)C(C)C	ZINC000080458220	1292603867	/nfs/dbraw/zinc/60/38/67/1292603867.db2.gz	CIRCYIRDEMOENB-WCQYABFASA-N	0	3	337.445	3.213	20	30		EGEDHN
CCOC(=O)N[C@H](C(=O)C(C#N)c1nc(C(C)C)cs1)C(C)C	ZINC000080458217	1292604220	/nfs/dbraw/zinc/60/42/20/1292604220.db2.gz	CIRCYIRDEMOENB-AAEUAGOBSA-N	0	3	337.445	3.213	20	30		EGEDHN
C#CCOc1ccc(CN2CCC[C@H](CNC(=O)C(C)(C)C)C2)cc1	ZINC000093281712	1292914143	/nfs/dbraw/zinc/91/41/43/1292914143.db2.gz	FCGFPVKFQGHNKA-GOSISDBHSA-N	0	3	342.483	3.073	20	30		EGEDHN
C=CCC[C@H](CO)[NH2+][C@H](C)c1cc(Br)cc(C)c1[O-]	ZINC000834903959	1293171153	/nfs/dbraw/zinc/17/11/53/1293171153.db2.gz	LTTIWAWRELEHIV-DGCLKSJQSA-N	0	3	328.250	3.441	20	30		EGEDHN
CC(=O)N[C@H](C(=O)C(C#N)c1ncc(C(C)(C)C)s1)C(C)(C)C	ZINC000835387178	1293280007	/nfs/dbraw/zinc/28/00/07/1293280007.db2.gz	FMFULFWHDKRFTE-BXUZGUMPSA-N	0	3	335.473	3.168	20	30		EGEDHN
COCCCNC(=O)C(C#N)C(=O)C[C@@H](C)c1ccc(C(C)C)cc1	ZINC000121595898	1293379617	/nfs/dbraw/zinc/37/96/17/1293379617.db2.gz	KSSSSDPOEOGIRG-QAPCUYQASA-N	0	3	344.455	3.165	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)[C@@H](C)Cc1cccc(C(F)(F)F)c1	ZINC000121770672	1293388641	/nfs/dbraw/zinc/38/86/41/1293388641.db2.gz	GJQUWUCPJDGMQE-SMDDNHRTSA-N	0	3	340.345	3.117	20	30		EGEDHN
CCc1ccc([C@H](C)CC(=O)C(C#N)C(=O)Nc2ccccn2)cc1	ZINC000121866864	1293393656	/nfs/dbraw/zinc/39/36/56/1293393656.db2.gz	NSAWQELJFDIYLU-PBHICJAKSA-N	0	3	335.407	3.485	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)c1ccnc(Cl)c1	ZINC000123431151	1293444006	/nfs/dbraw/zinc/44/40/06/1293444006.db2.gz	UOACRVNHSBFWKM-GFCCVEGCSA-N	0	3	343.770	3.095	20	30		EGEDHN
C#CCOc1cccc(NC(=O)N2CCN(C3CCCCC3)CC2)c1	ZINC000124882629	1293487656	/nfs/dbraw/zinc/48/76/56/1293487656.db2.gz	HOSNSFQXUSDIEX-UHFFFAOYSA-N	0	3	341.455	3.181	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)COc1ccc(C)c(C)c1	ZINC000125588054	1293512013	/nfs/dbraw/zinc/51/20/13/1293512013.db2.gz	TUATWTGUZKIPCK-KRWDZBQOSA-N	0	3	330.428	3.088	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)CCn1ccc2ccccc21	ZINC000125612052	1293512742	/nfs/dbraw/zinc/51/27/42/1293512742.db2.gz	WPFPRXXCMXNMDQ-QGZVFWFLSA-N	0	3	339.439	3.437	20	30		EGEDHN
CC[C@](C)(CC(=O)OC)NCC#Cc1ccc(OC(F)(F)F)cc1	ZINC000130033152	1293642360	/nfs/dbraw/zinc/64/23/60/1293642360.db2.gz	MYVWKUOFPLOYLA-MRXNPFEDSA-N	0	3	343.345	3.258	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)c2occc2C)cc1Cl	ZINC000130348338	1293653537	/nfs/dbraw/zinc/65/35/37/1293653537.db2.gz	BPFQOBWYXCJOKM-LLVKDONJSA-N	0	3	332.743	3.211	20	30		EGEDHN
C[C@H](CC(=O)C(C#N)C(=O)NC1CCCC1)c1ccc(F)cc1F	ZINC000152459283	1293969955	/nfs/dbraw/zinc/96/99/55/1293969955.db2.gz	AFYDQVORIIKACR-IAQYHMDHSA-N	0	3	334.366	3.226	20	30		EGEDHN
C#CCN(C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCc2ccccc21	ZINC000153763331	1294027558	/nfs/dbraw/zinc/02/75/58/1294027558.db2.gz	AKHQBGAYHWCTNJ-UXHICEINSA-N	0	3	336.391	3.251	20	30		EGEDHN
C=CCN(CCc1ccccc1)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000153785897	1294028370	/nfs/dbraw/zinc/02/83/70/1294028370.db2.gz	LLOKWHICUYEFCA-IBGZPJMESA-N	0	3	326.396	3.359	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)C[C@@H](C)c1ccccc1C(F)(F)F	ZINC000173983795	1294475354	/nfs/dbraw/zinc/47/53/54/1294475354.db2.gz	UGBBGRIKUPDGLK-YPMHNXCESA-N	0	3	340.345	3.432	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)C(=O)NC1CC1)c1ccccc1C(F)(F)F	ZINC000173975029	1294475588	/nfs/dbraw/zinc/47/55/88/1294475588.db2.gz	TZFIPNALVIWGJP-GWCFXTLKSA-N	0	3	338.329	3.186	20	30		EGEDHN
C#CCCCCNC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C	ZINC000177126024	1294655753	/nfs/dbraw/zinc/65/57/53/1294655753.db2.gz	ULVAOJRZCXQIQJ-UHFFFAOYSA-N	0	3	342.487	3.062	20	30		EGEDHN
N#Cc1csc(CNCc2ccc(N3CCSCC3)cc2)c1	ZINC000177686860	1294686492	/nfs/dbraw/zinc/68/64/92/1294686492.db2.gz	BUQWBKDTLOUWDK-UHFFFAOYSA-N	0	3	329.494	3.463	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)COc1cccc(C(C)C)c1	ZINC000193379980	1295860848	/nfs/dbraw/zinc/86/08/48/1295860848.db2.gz	CBDRWAWSCVBICR-QGZVFWFLSA-N	0	3	330.428	3.204	20	30		EGEDHN
C[C@@H](Oc1ccccc1)C(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1	ZINC000193392390	1295862996	/nfs/dbraw/zinc/86/29/96/1295862996.db2.gz	JVRSDKKOIOVWCL-MLGOLLRUSA-N	0	3	342.782	3.455	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)CCc1cccs1	ZINC000193457714	1295872846	/nfs/dbraw/zinc/87/28/46/1295872846.db2.gz	YVVOHRNMMAKESQ-CQSZACIVSA-N	0	3	342.420	3.427	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(F)c(Cl)c1)C(=O)c1cc(C2CC2)[nH]n1	ZINC000193475871	1295875558	/nfs/dbraw/zinc/87/55/58/1295875558.db2.gz	KGNPQIPGZTYUIQ-SNVBAGLBSA-N	0	3	346.749	3.041	20	30		EGEDHN
N#CC(C(=O)Nc1ccccn1)C(=O)[C@H]1C[C@@]12CCCc1ccccc12	ZINC000246461954	1296354155	/nfs/dbraw/zinc/35/41/55/1296354155.db2.gz	ADWBJJKHNAJVAJ-LUQKVYGDSA-N	0	3	345.402	3.023	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN1CCCCC[C@H]1C[C@@H](O)c1ccco1	ZINC000247794416	1296400854	/nfs/dbraw/zinc/40/08/54/1296400854.db2.gz	ZLUJTQNWBGNBCH-ZWKOTPCHSA-N	0	3	346.471	3.148	20	30		EGEDHN
C[C@@H](NC[C@H](O)COc1ccccc1C#N)c1ccc(Cl)s1	ZINC000315440784	1297136876	/nfs/dbraw/zinc/13/68/76/1297136876.db2.gz	ZBZNEWKTOWLFQX-YPMHNXCESA-N	0	3	336.844	3.364	20	30		EGEDHN
N#CCCCCNCc1cccc(F)c1I	ZINC000873042497	1297241555	/nfs/dbraw/zinc/24/15/55/1297241555.db2.gz	OUMXTNLPNDXIEU-UHFFFAOYSA-N	0	3	332.160	3.214	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)C#Cc1ccccc1	ZINC000747401006	1298776665	/nfs/dbraw/zinc/77/66/65/1298776665.db2.gz	BLJTYRPIQDFDCU-IBGZPJMESA-N	0	3	332.447	3.161	20	30		EGEDHN
COc1ncnc(N)c1C=NN=c1cc(C)c2cc(Cl)ccc2[nH]1	ZINC000747629953	1298812887	/nfs/dbraw/zinc/81/28/87/1298812887.db2.gz	KQEYMRODIHAOPV-UHFFFAOYSA-N	0	3	342.790	3.023	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@H]2C[C@@H](O)c2ccc(F)cc2)n1	ZINC000876808999	1299003362	/nfs/dbraw/zinc/00/33/62/1299003362.db2.gz	OQONPGILVLFZQK-RBUKOAKNSA-N	0	3	325.387	3.180	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1SC[Si](C)(C)C	ZINC000750002284	1299320154	/nfs/dbraw/zinc/32/01/54/1299320154.db2.gz	DSQPFMREBXSABK-UHFFFAOYSA-N	0	3	338.597	3.462	20	30		EGEDHN
CCOC[C@@H]1CCCN(CC[C@](C#N)(C(C)=O)c2ccccc2)C1	ZINC000878106591	1299751636	/nfs/dbraw/zinc/75/16/36/1299751636.db2.gz	JALMAPOJLZFSME-QUCCMNQESA-N	0	3	328.456	3.176	20	30		EGEDHN
C[C@H](NCc1ccc(-n2ccnc2)nc1)c1ccc(OCC#N)cc1	ZINC000753367348	1299922904	/nfs/dbraw/zinc/92/29/04/1299922904.db2.gz	HBLADZJPVZYSFS-HNNXBMFYSA-N	0	3	333.395	3.020	20	30		EGEDHN
C=CC[C@H](NC(=O)N(CCN(C)C)Cc1ccco1)c1ccncc1	ZINC000756038283	1300429661	/nfs/dbraw/zinc/42/96/61/1300429661.db2.gz	NFNAQRMMCZNIKJ-SFHVURJKSA-N	0	3	342.443	3.065	20	30		EGEDHN
C#CC[C@@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1	ZINC000757059182	1300626887	/nfs/dbraw/zinc/62/68/87/1300626887.db2.gz	NNRFFSALZGUZES-LEWJYISDSA-N	0	3	347.462	3.325	20	30		EGEDHN
C=CCC[C@H](O)CN[C@@H](COC)c1cccc(Br)c1	ZINC000879662983	1300659721	/nfs/dbraw/zinc/65/97/21/1300659721.db2.gz	RIGKLHYFWXHJAJ-GJZGRUSLSA-N	0	3	328.250	3.053	20	30		EGEDHN
CC[C@@H]1CC[C@@H](C(=O)C(C#N)C(=O)Nc2ccc(F)c(Cl)c2)O1	ZINC000757304692	1300663428	/nfs/dbraw/zinc/66/34/28/1300663428.db2.gz	MKPSIPZWLNCVGC-SUNKGSAMSA-N	0	3	338.766	3.084	20	30		EGEDHN
COc1ccc(C(C)=NNC2CCOCC2)cc1CN1CCCCC1	ZINC000757590829	1300689999	/nfs/dbraw/zinc/68/99/99/1300689999.db2.gz	AZTWWYAFSNXFQQ-UHFFFAOYSA-N	0	3	345.487	3.174	20	30		EGEDHN
C[C@@H](c1ccc(C#N)cc1)N1CC[C@H](N2CC(=O)Nc3ccccc32)C1	ZINC000759892058	1301185280	/nfs/dbraw/zinc/18/52/80/1301185280.db2.gz	FKHHDJVHCMIGFD-YJBOKZPZSA-N	0	3	346.434	3.152	20	30		EGEDHN
CCS(=O)(=O)Nc1ccc([C@@H](C)NCc2ccc(C#N)cc2)cc1	ZINC000765015066	1302184471	/nfs/dbraw/zinc/18/44/71/1302184471.db2.gz	NTOUDCKLMGKFPN-CQSZACIVSA-N	0	3	343.452	3.171	20	30		EGEDHN
C#C[C@@H](CC)OC(=O)C1CCN(c2cc(Cl)ccc2Cl)C1=O	ZINC000768059821	1302814152	/nfs/dbraw/zinc/81/41/52/1302814152.db2.gz	AHXWENYTZCBLEO-RYUDHWBXSA-N	0	3	340.206	3.301	20	30		EGEDHN
C=CCC1(O)CCN(Cc2cc(=O)oc3cc(CC)ccc23)CC1	ZINC000886768725	1303591549	/nfs/dbraw/zinc/59/15/49/1303591549.db2.gz	GZRUKFKPNBFWPL-UHFFFAOYSA-N	0	3	327.424	3.258	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)c2nc(C)c(C)s2)cc1	ZINC000774049540	1303768543	/nfs/dbraw/zinc/76/85/43/1303768543.db2.gz	BDIZDOPZTALNPS-AWEZNQCLSA-N	0	3	327.409	3.284	20	30		EGEDHN
C[C@@H](N[C@H](C)c1ccc(N(C)C)cc1)C(=O)Nc1ccccc1C#N	ZINC000774482870	1303815133	/nfs/dbraw/zinc/81/51/33/1303815133.db2.gz	IHHDNJZTXKHCIS-HUUCEWRRSA-N	0	3	336.439	3.302	20	30		EGEDHN
CN(CCC#N)c1ccc(CNCc2nnc(-c3ccccc3)[nH]2)cc1	ZINC000774814851	1303862702	/nfs/dbraw/zinc/86/27/02/1303862702.db2.gz	ODRQTUGQXRIKQF-UHFFFAOYSA-N	0	3	346.438	3.111	20	30		EGEDHN
CN(CCC#N)c1ccc(C[NH2+]Cc2nnc(-c3ccccc3)[n-]2)cc1	ZINC000774814851	1303862710	/nfs/dbraw/zinc/86/27/10/1303862710.db2.gz	ODRQTUGQXRIKQF-UHFFFAOYSA-N	0	3	346.438	3.111	20	30		EGEDHN
N#CCC[C@H](NC[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1	ZINC000775553382	1303983747	/nfs/dbraw/zinc/98/37/47/1303983747.db2.gz	NQLHVEQMHWDZMU-ROUUACIJSA-N	0	3	325.368	3.263	20	30		EGEDHN
C#CCOc1ccccc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000776085824	1304092856	/nfs/dbraw/zinc/09/28/56/1304092856.db2.gz	VEMSGBWDFWNBPV-GOSISDBHSA-N	0	3	349.434	3.095	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Cc2ccccc2CC#N)C1	ZINC000776842241	1304209038	/nfs/dbraw/zinc/20/90/38/1304209038.db2.gz	UEOQVNHTUQKNNM-DYESRHJHSA-N	0	3	347.462	3.247	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CNCCc1ccc(O)c(OC)c1	ZINC000778168411	1304409151	/nfs/dbraw/zinc/40/91/51/1304409151.db2.gz	DCSIVTQUYDGKBU-UHFFFAOYSA-N	0	3	345.826	3.399	20	30		EGEDHN
N#CCc1ccc(CN2CCC(Oc3cncc(Cl)n3)CC2)cc1	ZINC000778189636	1304412893	/nfs/dbraw/zinc/41/28/93/1304412893.db2.gz	IIWSIRRHCRUCNX-UHFFFAOYSA-N	0	3	342.830	3.239	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)c1cc(C)nc(Cl)c1	ZINC000778604564	1304473005	/nfs/dbraw/zinc/47/30/05/1304473005.db2.gz	CKAJRZSTSMPWTM-GFCCVEGCSA-N	0	3	343.770	3.013	20	30		EGEDHN
COCC1(C(=O)C(C#N)c2nc(-c3ccc(OC)cc3)cs2)CC1	ZINC000779194875	1304540560	/nfs/dbraw/zinc/54/05/60/1304540560.db2.gz	PCCCZGATFVRMAC-CQSZACIVSA-N	0	3	342.420	3.422	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CN(Cc3ccccc3)CCCO2)CC1	ZINC000890215061	1304711063	/nfs/dbraw/zinc/71/10/63/1304711063.db2.gz	HWVMZMHHVPLAIK-FQEVSTJZSA-N	0	3	342.483	3.140	20	30		EGEDHN
Cc1nc(C)c(CC(=O)C(C#N)C(=O)Nc2ccccc2Cl)s1	ZINC000892490060	1305402452	/nfs/dbraw/zinc/40/24/52/1305402452.db2.gz	OWVQVLQIASLVDM-NSHDSACASA-N	0	3	347.827	3.303	20	30		EGEDHN
CN(C)Cc1ccnc(NCc2cc(C#N)ccc2Br)c1	ZINC000893436042	1305895298	/nfs/dbraw/zinc/89/52/98/1305895298.db2.gz	XCQBLXREAUMFBF-UHFFFAOYSA-N	0	3	345.244	3.389	20	30		EGEDHN
CCn1cc([C@@H](O)CN(CCC(C)(C)C#N)Cc2ccccc2)cn1	ZINC000792377297	1309167846	/nfs/dbraw/zinc/16/78/46/1309167846.db2.gz	UCBDGSBKJHGXEM-IBGZPJMESA-N	0	3	340.471	3.378	20	30		EGEDHN
C(=NNC1CCOCC1)c1ccc2c(c1)CCN2Cc1ccccc1	ZINC000794919394	1309620842	/nfs/dbraw/zinc/62/08/42/1309620842.db2.gz	XPEOQDKGJZHDOW-UHFFFAOYSA-N	0	3	335.451	3.352	20	30		EGEDHN
CN(C)c1ccccc1CNN=Cc1ccc(N(C)CCC#N)cc1	ZINC000794955948	1309631984	/nfs/dbraw/zinc/63/19/84/1309631984.db2.gz	CERCQQNWZBCIDQ-UHFFFAOYSA-N	0	3	335.455	3.226	20	30		EGEDHN
C[C@H](NC(=O)c1ccco1)C(=O)C(C#N)c1ncc(C(C)(C)C)s1	ZINC000797567406	1310212271	/nfs/dbraw/zinc/21/22/71/1310212271.db2.gz	HSBWEKZAPCNYET-QWRGUYRKSA-N	0	3	345.424	3.028	20	30		EGEDHN
C#CCC[C@H](O)CNc1c(C)c(C)nc2ccc(Br)cc21	ZINC000798419992	1310359026	/nfs/dbraw/zinc/35/90/26/1310359026.db2.gz	YDRHBKFFMJQIQT-AWEZNQCLSA-N	0	3	347.256	3.222	20	30		EGEDHN
COc1ccc(C(C)=NNCC(C)(C)CO)cc1CN1CCCCC1	ZINC000799115144	1310488922	/nfs/dbraw/zinc/48/89/22/1310488922.db2.gz	RKRFAZMCUSIUAY-UHFFFAOYSA-N	0	3	347.503	3.013	20	30		EGEDHN
Cc1cccc(CN2CCN(CCCOc3ccc(C#N)cc3)CC2)c1	ZINC000916976499	1319729955	/nfs/dbraw/zinc/72/99/55/1319729955.db2.gz	PTLFYGHXNXLHFZ-UHFFFAOYSA-N	0	3	349.478	3.453	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc(Cl)c(Cl)c2)C1	ZINC001023717106	1319851487	/nfs/dbraw/zinc/85/14/87/1319851487.db2.gz	CDTPPXQMWKJLJF-ZDUSSCGKSA-N	0	3	339.266	3.459	20	30		EGEDHN
C#CCCOc1ccc(C(=O)NC[C@@H](c2ccccc2)N(C)C)cc1	ZINC000822199589	1320061386	/nfs/dbraw/zinc/06/13/86/1320061386.db2.gz	ZRUZJCWSGLMFDT-FQEVSTJZSA-N	0	3	336.435	3.121	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CCN(C(=O)C#Cc2cccs2)C1	ZINC000836919403	1320554593	/nfs/dbraw/zinc/55/45/93/1320554593.db2.gz	IOQRNELSCKVAHV-QGZVFWFLSA-N	0	3	338.476	3.080	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)COC(C)(C)CC)c1ccccc1	ZINC000838866452	1320826198	/nfs/dbraw/zinc/82/61/98/1320826198.db2.gz	PIOQJHFRXUVDRZ-CVEARBPZSA-N	0	3	330.428	3.168	20	30		EGEDHN
C#C[C@@H](NCCC(=O)Nc1cc(Cl)ccc1Cl)[C@@H]1CCCO1	ZINC000839565556	1320938711	/nfs/dbraw/zinc/93/87/11/1320938711.db2.gz	YRHDXVDPMCLCOJ-HIFRSBDPSA-N	0	3	341.238	3.092	20	30		EGEDHN
N#Cc1ccc(C(=O)COC(=O)c2ccc(CN3CCCC3)cc2)cc1	ZINC000801869839	1316959585	/nfs/dbraw/zinc/95/95/85/1316959585.db2.gz	KJFLCZUPJDOUQE-UHFFFAOYSA-N	0	3	348.402	3.194	20	30		EGEDHN
CC(C)(C(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)C1)C1CCC1	ZINC001019198179	1317097847	/nfs/dbraw/zinc/09/78/47/1317097847.db2.gz	PLRZVXKBOVFGKK-KRWDZBQOSA-N	0	3	343.446	3.214	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)ccc1F	ZINC001019310472	1317162362	/nfs/dbraw/zinc/16/23/62/1317162362.db2.gz	QPRJELCYALZVJM-AWEZNQCLSA-N	0	3	343.427	3.072	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C=C2CCCCC2)C1	ZINC001020014977	1317500307	/nfs/dbraw/zinc/50/03/07/1317500307.db2.gz	IZJUAHUVRRHUJW-HDJSIYSDSA-N	0	3	327.266	3.022	20	30		EGEDHN
CCCC(=O)N1CCC(CN(CC)Cc2ccccc2C#N)CC1	ZINC000957664523	1317535362	/nfs/dbraw/zinc/53/53/62/1317535362.db2.gz	AGXLVDLITWWWRO-UHFFFAOYSA-N	0	3	327.472	3.419	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc3nccc(C)c3c2)C1	ZINC001020196634	1317589549	/nfs/dbraw/zinc/58/95/49/1317589549.db2.gz	NCMXZZFAAXVVIK-SHTZXODSSA-N	0	3	329.831	3.146	20	30		EGEDHN
C#C[C@H](NC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F)C(C)(C)C	ZINC000807879130	1317597403	/nfs/dbraw/zinc/59/74/03/1317597403.db2.gz	OJYVZSPEURQQFA-IRXDYDNUSA-N	0	3	348.437	3.308	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC(CN(CC)Cc2ccns2)CC1	ZINC000957737632	1317601950	/nfs/dbraw/zinc/60/19/50/1317601950.db2.gz	QQFFAWNSJPZUIG-UHFFFAOYSA-N	0	3	335.517	3.416	20	30		EGEDHN
Cc1cc(C)cc(NN=C2c3ccccc3N(CCN(C)C)C2=O)c1	ZINC000807955397	1317603972	/nfs/dbraw/zinc/60/39/72/1317603972.db2.gz	WAHYGYFLDRTQLV-UHFFFAOYSA-N	0	3	336.439	3.028	20	30		EGEDHN
CC[C@H](F)C(=O)N1CCC(CN(CC)Cc2ccccc2C#N)CC1	ZINC000957740584	1317606185	/nfs/dbraw/zinc/60/61/85/1317606185.db2.gz	UTWNFNUSDVMHGO-IBGZPJMESA-N	0	3	345.462	3.367	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@H]2CCC[C@H](C(F)(F)F)C2)C1	ZINC001020335993	1317651900	/nfs/dbraw/zinc/65/19/00/1317651900.db2.gz	PISKDCDCTFXZJP-CYDGBPFRSA-N	0	3	338.801	3.344	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc3c(o2)c(F)ccc3C)C1	ZINC001020427831	1317692124	/nfs/dbraw/zinc/69/21/24/1317692124.db2.gz	WZIKTLFMZFSNHK-HAQNSBGRSA-N	0	3	336.794	3.483	20	30		EGEDHN
C#Cc1ccc(CNCc2cc3c(c(Br)c2)OCO3)cc1	ZINC000809634019	1317851897	/nfs/dbraw/zinc/85/18/97/1317851897.db2.gz	ZNLYDWJKSCTFOA-UHFFFAOYSA-N	0	3	344.208	3.449	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@]2(C)CCCc3ccccc32)C1	ZINC001020755233	1317907249	/nfs/dbraw/zinc/90/72/49/1317907249.db2.gz	DAGGAMVEWXUUGC-GPMSIDNRSA-N	0	3	332.875	3.270	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C	ZINC000810431161	1318008209	/nfs/dbraw/zinc/00/82/09/1318008209.db2.gz	MLSDRRAYUVQVLR-IBGZPJMESA-N	0	3	346.474	3.333	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cnc(-c3ccco3)s2)C1	ZINC001020954443	1318012977	/nfs/dbraw/zinc/01/29/77/1318012977.db2.gz	VCAZQZVBWAGGAI-XYPYZODXSA-N	0	3	337.832	3.006	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C2C[C@H](C)C[C@@H](C)C2)C1	ZINC001021102424	1318084252	/nfs/dbraw/zinc/08/42/52/1318084252.db2.gz	KYEFGSRAWAURSF-YIKOMLBNSA-N	0	3	343.309	3.204	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)C2CCCC2)s1	ZINC000959843556	1318220884	/nfs/dbraw/zinc/22/08/84/1318220884.db2.gz	DKWSOOQVXNIJTK-HNNXBMFYSA-N	0	3	331.485	3.281	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)C2CCCC2)c(F)c1	ZINC000959847011	1318223887	/nfs/dbraw/zinc/22/38/87/1318223887.db2.gz	VRXPXAOXXHLENY-SFHVURJKSA-N	0	3	343.446	3.358	20	30		EGEDHN
C#C[C@@H](NC(=O)NC[C@H](c1cccs1)N1CCCC1)C(C)(C)C	ZINC000811992714	1318303962	/nfs/dbraw/zinc/30/39/62/1318303962.db2.gz	LSDKHJCZKHVJKT-GDBMZVCRSA-N	0	3	333.501	3.232	20	30		EGEDHN
C[C@@H]1[C@H](NC(=O)c2ccsc2C#N)CCN1Cc1ccccc1	ZINC000908230726	1318316249	/nfs/dbraw/zinc/31/62/49/1318316249.db2.gz	SXXMNKCXNHUOQF-CZUORRHYSA-N	0	3	325.437	3.013	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@@H]2CN(Cc3ccc(C#N)cc3)CC[C@@H]21	ZINC001021528608	1318365662	/nfs/dbraw/zinc/36/56/62/1318365662.db2.gz	ZISQIJFEEQMZQT-MOPGFXCFSA-N	0	3	325.456	3.027	20	30		EGEDHN
C=CCCC(=O)[C@H]1CCCN1C(=O)c1ccc(CN2CCCC2)cc1	ZINC000908642545	1318377684	/nfs/dbraw/zinc/37/76/84/1318377684.db2.gz	AAYGKQDYVKIOQE-LJQANCHMSA-N	0	3	340.467	3.422	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC[C@@H]2CN(Cc3ccc(C#N)cc3)CC[C@@H]21	ZINC001021554637	1318400182	/nfs/dbraw/zinc/40/01/82/1318400182.db2.gz	ODIYTTWHZZIBHA-BVYKZDMASA-N	0	3	337.467	3.337	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1nc(C(C)C)oc1C	ZINC000960266892	1318435959	/nfs/dbraw/zinc/43/59/59/1318435959.db2.gz	GXFNFLJQEYDHSH-SJLPKXTDSA-N	0	3	339.439	3.278	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)CC1CC(F)(F)C1	ZINC000960276576	1318439566	/nfs/dbraw/zinc/43/95/66/1318439566.db2.gz	ZCWUUEIXDYHTHK-SJLPKXTDSA-N	0	3	334.410	3.370	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cccc(Cl)c2C)C1	ZINC001021594923	1318439757	/nfs/dbraw/zinc/43/97/57/1318439757.db2.gz	RPLMZRABXYATFM-QAPCUYQASA-N	0	3	330.859	3.208	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2sc(C)cc2C)C1	ZINC001021595589	1318441150	/nfs/dbraw/zinc/44/11/50/1318441150.db2.gz	BSJFYYMZGZWIFB-DLBZAZTESA-N	0	3	330.497	3.315	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)CCc2ccsc2)C1	ZINC001021603915	1318448601	/nfs/dbraw/zinc/44/86/01/1318448601.db2.gz	SPZJSKPLIHYKOU-QZTJIDSGSA-N	0	3	330.497	3.017	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1c[nH]c2ncccc12	ZINC000960331017	1318464386	/nfs/dbraw/zinc/46/43/86/1318464386.db2.gz	ZPZCSETYTSMPAL-RTBURBONSA-N	0	3	346.434	3.124	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(C)c(Cl)c2F)C1	ZINC001021637073	1318491043	/nfs/dbraw/zinc/49/10/43/1318491043.db2.gz	WYUVAQSTKPPDGZ-ZBFHGGJFSA-N	0	3	348.849	3.347	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)CCc2ccc(Cl)cc2)C1	ZINC001021638549	1318494367	/nfs/dbraw/zinc/49/43/67/1318494367.db2.gz	FWYHYXTYFOJYHZ-IEBWSBKVSA-N	0	3	344.886	3.219	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccoc2C2CC2)C1	ZINC001021659833	1318522233	/nfs/dbraw/zinc/52/22/33/1318522233.db2.gz	VTRWMZUEWMPXOC-SJLPKXTDSA-N	0	3	326.440	3.107	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(Cl)c(C)c2)C1	ZINC001021665464	1318526554	/nfs/dbraw/zinc/52/65/54/1318526554.db2.gz	KNXSXBYIVROTNT-SJLPKXTDSA-N	0	3	330.859	3.208	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cnc3ccccc3c2)C1	ZINC001021679306	1318549978	/nfs/dbraw/zinc/54/99/78/1318549978.db2.gz	NJPKDZPVZDVPIF-GHTZIAJQSA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc3cccnc3c2)C1	ZINC001021693876	1318568469	/nfs/dbraw/zinc/56/84/69/1318568469.db2.gz	RVURTYHTNBWJAA-CTNGQTDRSA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc3ccn(C)c3c2)C1	ZINC001021710906	1318585419	/nfs/dbraw/zinc/58/54/19/1318585419.db2.gz	RACULBLXHIMAIU-PMACEKPBSA-N	0	3	349.478	3.128	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2cccc3ccccc32)C1	ZINC001021716164	1318595156	/nfs/dbraw/zinc/59/51/56/1318595156.db2.gz	CJXOUWLCKYPWMX-RBBKRZOGSA-N	0	3	346.474	3.328	20	30		EGEDHN
Cc1cc(Cl)ccc1CN(C)C[C@H]1CCCN1C(=O)[C@@H](C)C#N	ZINC000960502891	1318612294	/nfs/dbraw/zinc/61/22/94/1318612294.db2.gz	ONMQRTWIVMQPCG-WMLDXEAASA-N	0	3	333.863	3.231	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccsc2C(F)F)C1	ZINC001021724931	1318617322	/nfs/dbraw/zinc/61/73/22/1318617322.db2.gz	PJDIFAXHOOFYKK-OCCSQVGLSA-N	0	3	338.423	3.245	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(C)n(C(C)C)c2C)C1	ZINC001021731577	1318635138	/nfs/dbraw/zinc/63/51/38/1318635138.db2.gz	WMTDUBRMDXMAGM-UYAOXDASSA-N	0	3	341.499	3.246	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cccn2C(C)C)C1	ZINC001021744092	1318659224	/nfs/dbraw/zinc/65/92/24/1318659224.db2.gz	URAQDIBNIHJNDK-QZTJIDSGSA-N	0	3	327.472	3.019	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cccn2C(C)C)C1	ZINC001021744095	1318659705	/nfs/dbraw/zinc/65/97/05/1318659705.db2.gz	URAQDIBNIHJNDK-ZWKOTPCHSA-N	0	3	327.472	3.019	20	30		EGEDHN
CC[C@@H](SC)C(=O)N1CCC[C@H]1CN(C)Cc1ccc(C#N)cc1	ZINC000960557111	1318687755	/nfs/dbraw/zinc/68/77/55/1318687755.db2.gz	OVXNNQITWLVZMZ-ZWKOTPCHSA-N	0	3	345.512	3.123	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)CC2CCCCC2)C1	ZINC001021809297	1318693203	/nfs/dbraw/zinc/69/32/03/1318693203.db2.gz	KRBHZXCKMHUOON-OKILXGFUSA-N	0	3	329.282	3.102	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@@H](NC(=O)CC3=CCCCC3)C2)c(F)c1	ZINC001021902064	1318725763	/nfs/dbraw/zinc/72/57/63/1318725763.db2.gz	FPPCRWXQBAMCDE-HDICACEKSA-N	0	3	341.430	3.325	20	30		EGEDHN
CC1(C)C(C(=O)N[C@H]2C[C@@H](NCc3cc(C#N)ccc3F)C2)C1(C)C	ZINC001021944434	1318740790	/nfs/dbraw/zinc/74/07/90/1318740790.db2.gz	LWFJYTLTXAGVEI-GASCZTMLSA-N	0	3	343.446	3.116	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC[C@@H]1CN(C)C[C@@H]1CCCCO1	ZINC000960645553	1318765164	/nfs/dbraw/zinc/76/51/64/1318765164.db2.gz	ACWCXXWBOKHATA-CVEARBPZSA-N	0	3	342.911	3.257	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1cc(Cl)ccc1C(=O)NC(C)C	ZINC000912312308	1318866206	/nfs/dbraw/zinc/86/62/06/1318866206.db2.gz	VCJBKYRHKRKRCK-CQSZACIVSA-N	0	3	337.851	3.100	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@@H]2CCC[C@H](C(F)(F)F)C2)C1	ZINC001022343536	1318900616	/nfs/dbraw/zinc/90/06/16/1318900616.db2.gz	PISKDCDCTFXZJP-XQHKEYJVSA-N	0	3	338.801	3.344	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)C1(C)CCC1	ZINC000960804685	1318915155	/nfs/dbraw/zinc/91/51/55/1318915155.db2.gz	VCMIPSFHUKRMGL-GOSISDBHSA-N	0	3	325.456	3.171	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)[C@H]1CCC1(C)C	ZINC000960814404	1318934434	/nfs/dbraw/zinc/93/44/34/1318934434.db2.gz	JAPNZRCDQCEVJR-RBUKOAKNSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H]1CN(C)Cc1ccc(CO)cc1	ZINC000960828128	1318955693	/nfs/dbraw/zinc/95/56/93/1318955693.db2.gz	RMSNYEQGZNNKEE-PZJWPPBQSA-N	0	3	344.499	3.204	20	30		EGEDHN
CCC(C)(C)C(=O)N1CCC[C@@H]1CN(C)Cc1cccc(C#N)c1	ZINC000960840362	1318974859	/nfs/dbraw/zinc/97/48/59/1318974859.db2.gz	NCJMAZATRLCHSM-GOSISDBHSA-N	0	3	327.472	3.417	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2C[C@@H](NCc3ccccc3Cl)C2)cc1	ZINC001022527332	1318977939	/nfs/dbraw/zinc/97/79/39/1318977939.db2.gz	UVLHGYGUDRPVKP-HDICACEKSA-N	0	3	338.838	3.372	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]2CN(C)Cc2cccc(OC)c2)C1	ZINC000960846407	1318984634	/nfs/dbraw/zinc/98/46/34/1318984634.db2.gz	KRSMUPSUBNIWLF-GOSISDBHSA-N	0	3	342.483	3.474	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc(C(CC)CC)no2)C1	ZINC001022824110	1319126824	/nfs/dbraw/zinc/12/68/24/1319126824.db2.gz	PSOQIZHCMHUEDR-BETUJISGSA-N	0	3	325.840	3.181	20	30		EGEDHN
Cc1cc(C(=O)N[C@H]2C[C@@H](NCc3cc(C#N)ccc3F)C2)cs1	ZINC001022853698	1319137172	/nfs/dbraw/zinc/13/71/72/1319137172.db2.gz	MPARFSKYZDEKED-IYBDPMFKSA-N	0	3	343.427	3.118	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@@H](NC(=O)[C@@H]3CC34CCCC4)C2)c1	ZINC001022936848	1319179212	/nfs/dbraw/zinc/17/92/12/1319179212.db2.gz	XAXMMMVFASFQCD-BBWFWOEESA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)Cc2ccc3c(c2)CCCC3)C1	ZINC001023073277	1319253206	/nfs/dbraw/zinc/25/32/06/1319253206.db2.gz	AYVRMULCNHFYHL-HDICACEKSA-N	0	3	332.875	3.097	20	30		EGEDHN
N#Cc1ccccc1/C=C\C(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000915264544	1319457048	/nfs/dbraw/zinc/45/70/48/1319457048.db2.gz	QLJVGUWBOQNCTQ-SQZREULQSA-N	0	3	345.446	3.352	20	30		EGEDHN
CC(=O)N1CCC([C@H]2CCCN(CC#Cc3ccc(F)cc3)C2)CC1	ZINC000961296597	1319459676	/nfs/dbraw/zinc/45/96/76/1319459676.db2.gz	HZNBBKQHRHYWFG-FQEVSTJZSA-N	0	3	342.458	3.148	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cccc(C(F)F)c2F)C1	ZINC001023371366	1319484104	/nfs/dbraw/zinc/48/41/04/1319484104.db2.gz	YHVCJDBXJCRCDP-CYBMUJFWSA-N	0	3	338.373	3.228	20	30		EGEDHN
C=CCN1CCC[C@H](CNC(=O)c2snc(Cl)c2Cl)C1	ZINC001023394149	1319500616	/nfs/dbraw/zinc/50/06/16/1319500616.db2.gz	ODHMCJROQMDYQD-SECBINFHSA-N	0	3	334.272	3.078	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc(CC(C)C)s2)C1	ZINC001023415173	1319521375	/nfs/dbraw/zinc/52/13/75/1319521375.db2.gz	JIMDTSBGZLCBBH-INIZCTEOSA-N	0	3	332.513	3.412	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)[C@H]2CC[C@H](C3CCC3)CC2)C1	ZINC001023424373	1319525407	/nfs/dbraw/zinc/52/54/07/1319525407.db2.gz	WJSYQIBOYNYJAV-IHPCNDPISA-N	0	3	330.516	3.444	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC([C@H]3CCCN(CCF)C3)CC2)cc1	ZINC000961394513	1319550359	/nfs/dbraw/zinc/55/03/59/1319550359.db2.gz	RZUHFFGFTUBAOB-FQEVSTJZSA-N	0	3	342.458	3.202	20	30		EGEDHN
C#CCN(C)CCCNC(=O)[C@@H](C)c1c(Cl)cccc1Cl	ZINC000818588965	1319563069	/nfs/dbraw/zinc/56/30/69/1319563069.db2.gz	KZAMOCPLHUTZOF-LBPRGKRZSA-N	0	3	327.255	3.168	20	30		EGEDHN
C#CCN(C)CCCNC(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000818615347	1319569744	/nfs/dbraw/zinc/56/97/44/1319569744.db2.gz	JQWWZUKMSVZAQS-UONOGXRCSA-N	0	3	339.266	3.168	20	30		EGEDHN
Fc1ccc(CCN2CCC(N=Nc3cncc(Cl)n3)CC2)cc1	ZINC000915959639	1319571237	/nfs/dbraw/zinc/57/12/37/1319571237.db2.gz	UMIIJMGELNWBKF-UHFFFAOYSA-N	0	3	347.825	3.376	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2[C@H]3CN([C@@H](C)c4cccc(F)c4)C[C@H]32)cc1	ZINC000961432584	1319585306	/nfs/dbraw/zinc/58/53/06/1319585306.db2.gz	OULZDBUBEOQCCM-CCARFGRDSA-N	0	3	348.421	3.228	20	30		EGEDHN
CCCC(=O)Nc1cccc(CNC[C@@H](O)c2ccc(C#N)cc2)c1	ZINC000818961049	1319591943	/nfs/dbraw/zinc/59/19/43/1319591943.db2.gz	NMPOIMCKZDRGDE-LJQANCHMSA-N	0	3	337.423	3.120	20	30		EGEDHN
C[C@@H]1C[C@H](C)CN(CC(=O)C(C#N)c2nc3ccccc3s2)C1	ZINC000916622792	1319685900	/nfs/dbraw/zinc/68/59/00/1319685900.db2.gz	LOCDRXJCGRMXGH-MJBXVCDLSA-N	0	3	327.453	3.450	20	30		EGEDHN
Cc1cc(C)n([C@H](C)CC(=O)C(C#N)C(=O)Nc2cccc(C)c2)n1	ZINC000916898423	1319721876	/nfs/dbraw/zinc/72/18/76/1319721876.db2.gz	CSRWFPYSFMLPHA-NVXWUHKLSA-N	0	3	338.411	3.107	20	30		EGEDHN
N#CC(C(=O)COC1CCCCC1)C(=O)Nc1ccccc1Cl	ZINC000916909483	1319723128	/nfs/dbraw/zinc/72/31/28/1319723128.db2.gz	BVHZHDFSENHMNL-CYBMUJFWSA-N	0	3	334.803	3.337	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@H](CNC(=O)[C@H]3CC34CCC4)C2)c1	ZINC001023620466	1319738161	/nfs/dbraw/zinc/73/81/61/1319738161.db2.gz	VFDWSYGNAGHUHP-RBUKOAKNSA-N	0	3	337.467	3.077	20	30		EGEDHN
C=CCN1CCC[C@@H](CNC(=O)c2cnc(-c3ccoc3)s2)C1	ZINC001023635831	1319755257	/nfs/dbraw/zinc/75/52/57/1319755257.db2.gz	HXZZXVARWFHZDY-ZDUSSCGKSA-N	0	3	331.441	3.031	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc(-c3ccco3)s2)C1	ZINC001023677708	1319790825	/nfs/dbraw/zinc/79/08/25/1319790825.db2.gz	NCXBKXPNECECOW-OAHLLOKOSA-N	0	3	342.464	3.473	20	30		EGEDHN
C=CCN1CCC[C@H](CNC(=O)c2cnc(-c3ccco3)s2)C1	ZINC001023713224	1319841259	/nfs/dbraw/zinc/84/12/59/1319841259.db2.gz	XBUBPSNFGBTTNZ-CYBMUJFWSA-N	0	3	331.441	3.031	20	30		EGEDHN
N#Cc1ccccc1CNCC1CC(NC(=O)C[C@H]2CC=CCC2)C1	ZINC000962177313	1319843671	/nfs/dbraw/zinc/84/36/71/1319843671.db2.gz	OTIZCLGBIICKPS-VXESANQCSA-N	0	3	337.467	3.289	20	30		EGEDHN
C=C1CC(C)(C(=O)NC2CC(CNCc3oc(CCC)nc3C)C2)C1	ZINC000962267175	1319891645	/nfs/dbraw/zinc/89/16/45/1319891645.db2.gz	KXECFBXBHCRWNA-UHFFFAOYSA-N	0	3	345.487	3.276	20	30		EGEDHN
CO[C@@H](C)C(=O)C(C#N)C(=O)Nc1ccccc1Oc1ccccc1	ZINC000918488203	1319956515	/nfs/dbraw/zinc/95/65/15/1319956515.db2.gz	XBEIVLDOIPRRIW-DZGCQCFKSA-N	0	3	338.363	3.161	20	30		EGEDHN
CC(C)(C)CC(=O)N1CCC[C@@H](CNCc2ccccc2C#N)C1	ZINC001023841614	1319982218	/nfs/dbraw/zinc/98/22/18/1319982218.db2.gz	WFTSARSTDREDTF-INIZCTEOSA-N	0	3	327.472	3.323	20	30		EGEDHN
CN(C)CCN(Cc1cccc(Cl)c1)C(=O)C#Cc1cccs1	ZINC000825480908	1320341702	/nfs/dbraw/zinc/34/17/02/1320341702.db2.gz	BKXHYUDIAPHMMW-UHFFFAOYSA-N	0	3	346.883	3.343	20	30		EGEDHN
C#C[C@H](NC(=O)NC[C@@H](N[C@H](C)CC)c1ccco1)c1ccccc1	ZINC000827067703	1320424707	/nfs/dbraw/zinc/42/47/07/1320424707.db2.gz	QTJFIACWYJQYOX-BPQIPLTHSA-N	0	3	339.439	3.383	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCN(C3CC(OCc4ccccc4)C3)C2)nc1	ZINC000930543134	1328891215	/nfs/dbraw/zinc/89/12/15/1328891215.db2.gz	MFCLGHXZJZIBDA-GPJFCIFZSA-N	0	3	349.434	3.154	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1ccccc1OC1CCCC1	ZINC000838622773	1320796098	/nfs/dbraw/zinc/79/60/98/1320796098.db2.gz	MCNHJVQFHDIRRM-UHFFFAOYSA-N	0	3	329.444	3.085	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N(Cc1ccc([C@H]2C[C@@H]2C)o1)C1CC1	ZINC000838624299	1320796126	/nfs/dbraw/zinc/79/61/26/1320796126.db2.gz	QIOAKCVTPZZNBS-YJBOKZPZSA-N	0	3	343.471	3.032	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1ccccc1SC(F)F	ZINC000838623234	1320796387	/nfs/dbraw/zinc/79/63/87/1320796387.db2.gz	WVRPXAXKOCCYKX-UHFFFAOYSA-N	0	3	327.400	3.078	20	30		EGEDHN
N#C[C@@H]1CCC[C@H](OC(=O)C2CCN(c3ccc(Cl)cc3)C2=O)C1	ZINC000839049303	1320857789	/nfs/dbraw/zinc/85/77/89/1320857789.db2.gz	QKRCJORQZZOZRR-UHOFOFEASA-N	0	3	346.814	3.318	20	30		EGEDHN
C=CCc1cc(C[N@@H+]2CCC[C@@H]2[C@H]2CCC[C@H]2O)c([O-])c(OC)c1	ZINC000840121014	1321031894	/nfs/dbraw/zinc/03/18/94/1321031894.db2.gz	QDJHYHWYMNUYEC-KZNAEPCWSA-N	0	3	331.456	3.255	20	30		EGEDHN
C=CCc1cc(C[N@H+]2CCC[C@@H]2[C@H]2CCC[C@H]2O)c([O-])c(OC)c1	ZINC000840121014	1321031903	/nfs/dbraw/zinc/03/19/03/1321031903.db2.gz	QDJHYHWYMNUYEC-KZNAEPCWSA-N	0	3	331.456	3.255	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)NCc1ncc(C2OCCO2)s1	ZINC000840970495	1321190934	/nfs/dbraw/zinc/19/09/34/1321190934.db2.gz	AHPGTDDSYFIUAM-HNNXBMFYSA-N	0	3	330.453	3.466	20	30		EGEDHN
CC[C@H](OC1CCCC1)C(=O)C(C#N)C(=O)Nc1ccc(OC)cc1	ZINC000842290479	1321367915	/nfs/dbraw/zinc/36/79/15/1321367915.db2.gz	ZFJCMDMNLBRELS-IRXDYDNUSA-N	0	3	344.411	3.080	20	30		EGEDHN
CSc1ccc(CCCC(=O)C(C#N)C(=O)N2CCCC2)cc1	ZINC000842682059	1321417929	/nfs/dbraw/zinc/41/79/29/1321417929.db2.gz	YIVXGPREELSTDW-INIZCTEOSA-N	0	3	330.453	3.062	20	30		EGEDHN
N#CC(C(=O)NCc1cccc(Cl)c1)C(=O)C1CC2(CCC2)C1	ZINC000842772675	1321430566	/nfs/dbraw/zinc/43/05/66/1321430566.db2.gz	ZBVZHWBJWUZKPC-HNNXBMFYSA-N	0	3	330.815	3.245	20	30		EGEDHN
N#CC(C(=O)NCc1cccc(Cl)c1)C(=O)C1CC2(CCC2)C1	ZINC000842772679	1321430671	/nfs/dbraw/zinc/43/06/71/1321430671.db2.gz	ZBVZHWBJWUZKPC-OAHLLOKOSA-N	0	3	330.815	3.245	20	30		EGEDHN
C#CCOc1ccccc1NC(=O)C(C[C@H]1CCCO1)C(F)(F)F	ZINC000845956830	1321758834	/nfs/dbraw/zinc/75/88/34/1321758834.db2.gz	JMTPDHBTNSHOGI-OLZOCXBDSA-N	0	3	341.329	3.385	20	30		EGEDHN
C[C@H](C(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1)C1CC1	ZINC000847748718	1321900221	/nfs/dbraw/zinc/90/02/21/1321900221.db2.gz	GXBUHSBZSSWNLS-INIZCTEOSA-N	0	3	326.440	3.382	20	30		EGEDHN
C[C@@H](COC(=O)C(C)(C)Oc1ccc(C#N)cc1)N1CCCCC1	ZINC000847961159	1321916788	/nfs/dbraw/zinc/91/67/88/1321916788.db2.gz	STWDCAWVCAIQOY-HNNXBMFYSA-N	0	3	330.428	3.133	20	30		EGEDHN
COC[C@@H](C)Oc1ccc(CNCc2ccc(OC)c(C#N)c2)cc1	ZINC000850222286	1322209433	/nfs/dbraw/zinc/20/94/33/1322209433.db2.gz	UQNPSJWJFSZHGP-OAHLLOKOSA-N	0	3	340.423	3.270	20	30		EGEDHN
C[C@@H](NCc1ccc(N2CCCNC2=O)cc1)c1cccc(C#N)c1	ZINC000850574588	1322271182	/nfs/dbraw/zinc/27/11/82/1322271182.db2.gz	GZJOAJZCBYRJTG-OAHLLOKOSA-N	0	3	334.423	3.329	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cc(C(C)(C)C)ccc2OC)CC1	ZINC000921298794	1322288731	/nfs/dbraw/zinc/28/87/31/1322288731.db2.gz	BJWJNJNQORASNX-UHFFFAOYSA-N	0	3	328.456	3.276	20	30		EGEDHN
Cc1ccc([C@@H]2C[C@H]2C(=O)C(C#N)C(=O)Nc2ccccn2)cc1C	ZINC000850783101	1322291703	/nfs/dbraw/zinc/29/17/03/1322291703.db2.gz	WDVRDRVHAHROGS-BBWFWOEESA-N	0	3	333.391	3.150	20	30		EGEDHN
Cc1nc(CCNCc2cc(C#N)ccc2Br)cs1	ZINC000921521359	1322338079	/nfs/dbraw/zinc/33/80/79/1322338079.db2.gz	YESREGZUHCXOGQ-UHFFFAOYSA-N	0	3	336.258	3.418	20	30		EGEDHN
C[C@H](Cc1ccncc1)NCc1cc(C#N)ccc1Br	ZINC000921819050	1322404821	/nfs/dbraw/zinc/40/48/21/1322404821.db2.gz	USSBKRGXTOMTRK-GFCCVEGCSA-N	0	3	330.229	3.437	20	30		EGEDHN
CCOCC(C)(C)CNCc1cc(C#N)ccc1Br	ZINC000922135200	1322463764	/nfs/dbraw/zinc/46/37/64/1322463764.db2.gz	WFKUWEJMJKSUOJ-UHFFFAOYSA-N	0	3	325.250	3.473	20	30		EGEDHN
CC[C@H](NCc1cc(C#N)ccc1Br)[C@@H](O)C(C)C	ZINC000922186114	1322474598	/nfs/dbraw/zinc/47/45/98/1322474598.db2.gz	SXQXKARTTVEWSJ-GJZGRUSLSA-N	0	3	325.250	3.206	20	30		EGEDHN
CC[C@H](SC)C(=O)N1CCC[C@H](CNCc2ccccc2C#N)C1	ZINC001023937733	1323042727	/nfs/dbraw/zinc/04/27/27/1323042727.db2.gz	OMGNJVMDASYJFV-QAPCUYQASA-N	0	3	345.512	3.028	20	30		EGEDHN
Cc1cc(C(=O)N2CCC[C@H](CNCc3ccccc3C#N)C2)co1	ZINC001023953797	1323050723	/nfs/dbraw/zinc/05/07/23/1323050723.db2.gz	QLRBJHAESAJHMM-MRXNPFEDSA-N	0	3	337.423	3.102	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@H]1CCCN(CCc2ccc(C#N)cc2)C1	ZINC000851734634	1323076255	/nfs/dbraw/zinc/07/62/55/1323076255.db2.gz	VPOFJPPLFAWMPG-KRWDZBQOSA-N	0	3	329.444	3.090	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@@H](CNCc2ccccc2C#N)C1)C1CCC1	ZINC001024037281	1323089643	/nfs/dbraw/zinc/08/96/43/1323089643.db2.gz	ZQIIPLOWCHKJPZ-SJORKVTESA-N	0	3	339.483	3.323	20	30		EGEDHN
CN(C(=O)OC(C)(C)C)[C@@H]1CCN(CCc2ccc(C#N)cc2)C1	ZINC000851804698	1323093330	/nfs/dbraw/zinc/09/33/30/1323093330.db2.gz	TVUKXJZHNBUNSY-QGZVFWFLSA-N	0	3	329.444	3.042	20	30		EGEDHN
CCN(C)C(=O)OC[C@H]1CCCCN1CCc1ccc(C#N)cc1	ZINC000852047833	1323138937	/nfs/dbraw/zinc/13/89/37/1323138937.db2.gz	IUHGVTHTMICSMK-GOSISDBHSA-N	0	3	329.444	3.044	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@H](CNCc3ccccc3C#N)C2)CCC1	ZINC001024108935	1323140303	/nfs/dbraw/zinc/14/03/03/1323140303.db2.gz	COUUWUBGLZZKTG-QGZVFWFLSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H](CNCc2oc(CC)nc2C)C1	ZINC001024137966	1323162832	/nfs/dbraw/zinc/16/28/32/1323162832.db2.gz	WTCPMHSLZDLIEC-JXFKEZNVSA-N	0	3	347.503	3.476	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCN(C(=O)[C@H]2CC23CCC3)C1	ZINC001024182817	1323194857	/nfs/dbraw/zinc/19/48/57/1323194857.db2.gz	YDVIEZRYXHKYNE-QFBILLFUSA-N	0	3	337.467	3.077	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCC[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001024186098	1323197210	/nfs/dbraw/zinc/19/72/10/1323197210.db2.gz	LAFRBTBXEJQIIG-JKSUJKDBSA-N	0	3	345.462	3.318	20	30		EGEDHN
CN(CC(=O)C(C#N)c1nc2ccccc2s1)CC1=CCSC1	ZINC000852747570	1323236866	/nfs/dbraw/zinc/23/68/66/1323236866.db2.gz	OIWNGRCLMRTRRU-CYBMUJFWSA-N	0	3	343.477	3.078	20	30		EGEDHN
CCC(=O)N1CCC[C@@H]([C@H]2CCCN2Cc2ccc(C#N)cc2F)C1	ZINC000963213637	1323238881	/nfs/dbraw/zinc/23/88/81/1323238881.db2.gz	BYCGENKYJFSDEM-IEBWSBKVSA-N	0	3	343.446	3.310	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1oc2c(cccc2F)c1C	ZINC001024481381	1323436451	/nfs/dbraw/zinc/43/64/51/1323436451.db2.gz	YCBIAGOOGCGIQV-HNNXBMFYSA-N	0	3	342.414	3.488	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@H]1CCN(C)c2ccccc21	ZINC001024484003	1323438085	/nfs/dbraw/zinc/43/80/85/1323438085.db2.gz	IFQWHEYFBTZSKJ-HKUYNNGSSA-N	0	3	341.499	3.157	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cccc([C@H]2CCOC2)c1	ZINC001024515587	1323465272	/nfs/dbraw/zinc/46/52/72/1323465272.db2.gz	WEIAIWROSVZWLU-PMACEKPBSA-N	0	3	342.483	3.351	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cc(C(C)C)nn1CC	ZINC001024528815	1323475603	/nfs/dbraw/zinc/47/56/03/1323475603.db2.gz	MTSKWBNXILOXBJ-INIZCTEOSA-N	0	3	332.492	3.187	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@H]1CCc2ccc(F)cc2O1	ZINC001024554398	1323495732	/nfs/dbraw/zinc/49/57/32/1323495732.db2.gz	LSCXSYAYXMXQSC-ZWKOTPCHSA-N	0	3	346.446	3.066	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1cc2c(cc(C)cc2C)[nH]1	ZINC001024580181	1323517780	/nfs/dbraw/zinc/51/77/80/1323517780.db2.gz	RSQVBQXEVOPMCV-KRWDZBQOSA-N	0	3	337.467	3.392	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1cc(C)oc1C(F)(F)F	ZINC001024686008	1323601797	/nfs/dbraw/zinc/60/17/97/1323601797.db2.gz	TWQLSUUHPBZALI-CYBMUJFWSA-N	0	3	342.361	3.214	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)[C@@H]1C[C@H]1c1ccc(C)s1	ZINC001024700572	1323615596	/nfs/dbraw/zinc/61/55/96/1323615596.db2.gz	CCGCHKVELPOGDC-GVDBMIGSSA-N	0	3	330.497	3.154	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@@H]1CCOc2ccccc21	ZINC001024712379	1323618847	/nfs/dbraw/zinc/61/88/47/1323618847.db2.gz	WINMZLVIQZARNS-FUHWJXTLSA-N	0	3	328.456	3.100	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCCCN2Cc2cccc(C)c2)nc1	ZINC001024763517	1323663531	/nfs/dbraw/zinc/66/35/31/1323663531.db2.gz	HRUIFZRDZCEEIO-FQEVSTJZSA-N	0	3	347.462	3.156	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1cc(C)c(F)cc1Cl	ZINC001024781575	1323684443	/nfs/dbraw/zinc/68/44/43/1323684443.db2.gz	YIXVUBDUIOMAHE-CQSZACIVSA-N	0	3	336.838	3.395	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccc2[nH]c(C)c(C)c2c1	ZINC001024795289	1323701197	/nfs/dbraw/zinc/70/11/97/1323701197.db2.gz	DSZGYMVRQAIOJX-SFHVURJKSA-N	0	3	337.467	3.392	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)C2CCCC2)s1	ZINC001024841896	1323740297	/nfs/dbraw/zinc/74/02/97/1323740297.db2.gz	DKWSOOQVXNIJTK-OAHLLOKOSA-N	0	3	331.485	3.281	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)CCC2CC2)c(F)c1	ZINC001024906658	1323774557	/nfs/dbraw/zinc/77/45/57/1323774557.db2.gz	OBIRTCLVUOXICQ-GOSISDBHSA-N	0	3	343.446	3.358	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)C=C2CCC2)cc1F	ZINC001024923093	1323785846	/nfs/dbraw/zinc/78/58/46/1323785846.db2.gz	KZVWMMLJGWHUNH-GOSISDBHSA-N	0	3	341.430	3.278	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@H]1CNCc1cnc(Cl)s1	ZINC001025040815	1323843619	/nfs/dbraw/zinc/84/36/19/1323843619.db2.gz	MPAIWXVEBWTPBP-LBPRGKRZSA-N	0	3	341.908	3.479	20	30		EGEDHN
CCC1(C(=O)N2CCCC[C@@H]2CNCc2ccc(C#N)c(F)c2)CC1	ZINC001025071158	1323872486	/nfs/dbraw/zinc/87/24/86/1323872486.db2.gz	DCKAEGAGOKDGCM-QGZVFWFLSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCCC[C@@H]2CNCc2cncc(F)c2)C1	ZINC001025074190	1323876421	/nfs/dbraw/zinc/87/64/21/1323876421.db2.gz	INNPHZGJMFDARI-QGZVFWFLSA-N	0	3	331.435	3.048	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCCC[C@H]2CNCc2cnc(C)s2)C1	ZINC001025074945	1323876678	/nfs/dbraw/zinc/87/66/78/1323876678.db2.gz	VCUCPHWOOMBTCG-HNNXBMFYSA-N	0	3	333.501	3.279	20	30		EGEDHN
CC(=O)N1CCCC[C@H]1[C@@H]1CCCN1Cc1ccc(C#N)c(F)c1	ZINC001025178521	1323943946	/nfs/dbraw/zinc/94/39/46/1323943946.db2.gz	DCYSRLQZZQIMHE-OALUTQOASA-N	0	3	329.419	3.063	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(C)oc1C	ZINC001025202545	1323987796	/nfs/dbraw/zinc/98/77/96/1323987796.db2.gz	YZQANGGKPUGDII-MOPGFXCFSA-N	0	3	328.456	3.379	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCCC[C@@H]1[C@@H]1CCCN1CC#CC	ZINC001025240256	1324034296	/nfs/dbraw/zinc/03/42/96/1324034296.db2.gz	MRAZUEWADYRUFA-RBUKOAKNSA-N	0	3	339.483	3.157	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)Cc1ccccc1CC	ZINC001025242303	1324038044	/nfs/dbraw/zinc/03/80/44/1324038044.db2.gz	HZPYXNMZWXDHBW-RTWAWAEBSA-N	0	3	338.495	3.270	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)Cc1ccccc1CC	ZINC001025242302	1324038249	/nfs/dbraw/zinc/03/82/49/1324038249.db2.gz	HZPYXNMZWXDHBW-NHCUHLMSSA-N	0	3	338.495	3.270	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1c[nH]nc1C(C)C	ZINC001025245485	1324043854	/nfs/dbraw/zinc/04/38/54/1324043854.db2.gz	NDICJTJRMURLKM-ZWKOTPCHSA-N	0	3	342.487	3.016	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1snnc1CC	ZINC001025250627	1324052023	/nfs/dbraw/zinc/05/20/23/1324052023.db2.gz	MBXUQEAVRGZTOE-JKSUJKDBSA-N	0	3	348.516	3.136	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)C1CCC2(CC2)CC1	ZINC001025252688	1324058555	/nfs/dbraw/zinc/05/85/55/1324058555.db2.gz	PZHDPTVQFGXUMX-RTBURBONSA-N	0	3	328.500	3.436	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc[nH]c1CCC	ZINC001025263554	1324075360	/nfs/dbraw/zinc/07/53/60/1324075360.db2.gz	NQYPVKNVYBUNAI-RBUKOAKNSA-N	0	3	327.472	3.060	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(C(C)C)n[nH]1	ZINC001025274155	1324091777	/nfs/dbraw/zinc/09/17/77/1324091777.db2.gz	UPJLJNZIRKJUEZ-RTBURBONSA-N	0	3	342.487	3.016	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(C(C)C)n[nH]1	ZINC001025274154	1324091909	/nfs/dbraw/zinc/09/19/09/1324091909.db2.gz	UPJLJNZIRKJUEZ-RBUKOAKNSA-N	0	3	342.487	3.016	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cccc2c1ccn2C	ZINC001025276232	1324098009	/nfs/dbraw/zinc/09/80/09/1324098009.db2.gz	HLUIMWLLMYXKAW-NHCUHLMSSA-N	0	3	349.478	3.271	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ncoc1C1CC1	ZINC001025288158	1324111210	/nfs/dbraw/zinc/11/12/10/1324111210.db2.gz	SLHZXJSHXUXZHE-HZPDHXFCSA-N	0	3	329.444	3.197	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)Cn1ccc2ccccc21	ZINC001025293573	1324120651	/nfs/dbraw/zinc/12/06/51/1324120651.db2.gz	DQFMXMRCHMFUMW-SFTDATJTSA-N	0	3	349.478	3.120	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc(C2CC2)cn1	ZINC001025296313	1324126683	/nfs/dbraw/zinc/12/66/83/1324126683.db2.gz	JJTUNUWHAZIGLH-UXHICEINSA-N	0	3	337.467	3.051	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1c(C)noc1CC	ZINC001025297574	1324131023	/nfs/dbraw/zinc/13/10/23/1324131023.db2.gz	YSEDWQKFGLZDON-HZPDHXFCSA-N	0	3	331.460	3.191	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccccc1OCC	ZINC001025298478	1324133286	/nfs/dbraw/zinc/13/32/86/1324133286.db2.gz	XEKXLZVHOVTONR-RTBURBONSA-N	0	3	340.467	3.178	20	30		EGEDHN
C[C@@H](NC(=O)C1CCCC1)[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001025318519	1324155005	/nfs/dbraw/zinc/15/50/05/1324155005.db2.gz	BDZUOBCUHHEXQZ-OXQOHEQNSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(-n3cccc3)cc2)C1	ZINC001025474768	1324320102	/nfs/dbraw/zinc/32/01/02/1324320102.db2.gz	NRDONNRWTMLNDW-QUCCMNQESA-N	0	3	349.478	3.331	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(Cl)cc2F)C1	ZINC001025478336	1324324069	/nfs/dbraw/zinc/32/40/69/1324324069.db2.gz	LWCJFOVEAHOABZ-KBPBESRZSA-N	0	3	336.838	3.333	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc3cc(F)ccc3[nH]2)C1	ZINC001025503255	1324352045	/nfs/dbraw/zinc/35/20/45/1324352045.db2.gz	PSAZZPNSCPHZJI-CABCVRRESA-N	0	3	341.430	3.161	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(C(F)F)cc2F)C1	ZINC001025567225	1324412789	/nfs/dbraw/zinc/41/27/89/1324412789.db2.gz	QSKCZRIXNGVLRO-TZMCWYRMSA-N	0	3	338.373	3.227	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc3sccc3c2)C1	ZINC001025582180	1324422692	/nfs/dbraw/zinc/42/26/92/1324422692.db2.gz	PHQQOPAKXBJEFJ-RHSMWYFYSA-N	0	3	326.465	3.365	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2coc3ccc(F)cc23)C1	ZINC001025607901	1324458838	/nfs/dbraw/zinc/45/88/38/1324458838.db2.gz	JEUNHGBEEYXIEW-HUUCEWRRSA-N	0	3	342.414	3.426	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc3ncsc3c2)C1	ZINC001025609958	1324461177	/nfs/dbraw/zinc/46/11/77/1324461177.db2.gz	IOMNWAUNKCISFA-HOCLYGCPSA-N	0	3	341.480	3.150	20	30		EGEDHN
C/C(=C/C(=O)N1C[C@@H]2CC[C@H](NCc3ccccc3C#N)[C@H]2C1)C1CC1	ZINC001026207433	1324663098	/nfs/dbraw/zinc/66/30/98/1324663098.db2.gz	UNAZYSWAKFONQP-AGESDOKJSA-N	0	3	349.478	3.241	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H]2CC[C@@H](NCc3csc(CC)n3)[C@@H]2C1	ZINC001026328216	1324729850	/nfs/dbraw/zinc/72/98/50/1324729850.db2.gz	LLCKWBYNSLYGMB-NUEKZKHPSA-N	0	3	347.528	3.244	20	30		EGEDHN
CCC(C)(C)C(=O)N1C[C@@H]2CC[C@H](NCc3ccccc3C#N)[C@@H]2C1	ZINC001026344542	1324742330	/nfs/dbraw/zinc/74/23/30/1324742330.db2.gz	SFISTTWUGLDIEG-OTWHNJEPSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H]3CC[C@H](NCc4cc(C)no4)[C@@H]3C2)CC1	ZINC001026347788	1324743354	/nfs/dbraw/zinc/74/33/54/1324743354.db2.gz	IILPLUXGXFPOHT-UHOSZYNNSA-N	0	3	343.471	3.056	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)C=C2CCCCC2)C1	ZINC001026718340	1324990716	/nfs/dbraw/zinc/99/07/16/1324990716.db2.gz	XPHUNDFOOICQJR-SFHVURJKSA-N	0	3	337.467	3.387	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCN(C(=O)C(F)=C2CCCC2)C1	ZINC001026777713	1325017422	/nfs/dbraw/zinc/01/74/22/1325017422.db2.gz	GBFJVMMBTVQUKM-OAHLLOKOSA-N	0	3	341.430	3.294	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)C2CC(F)(F)C2)C1	ZINC000963281257	1325062191	/nfs/dbraw/zinc/06/21/91/1325062191.db2.gz	HOAQJSWMZWMFRL-ZFWWWQNUSA-N	0	3	346.849	3.487	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)c2ncccc2C)C1	ZINC000963282975	1325064214	/nfs/dbraw/zinc/06/42/14/1325064214.db2.gz	RNWFWKMXLAGQQO-DLBZAZTESA-N	0	3	347.890	3.459	20	30		EGEDHN
CC1(C(=O)N2CC[C@H](CNCc3ccccc3C#N)C2)CCCCC1	ZINC001027035684	1325170032	/nfs/dbraw/zinc/17/00/32/1325170032.db2.gz	JHYIVBNKRDWGHP-QGZVFWFLSA-N	0	3	339.483	3.467	20	30		EGEDHN
CCc1ccc(C(=O)N2CC[C@H](CNCc3ccccc3C#N)C2)cc1	ZINC001027199225	1325297668	/nfs/dbraw/zinc/29/76/68/1325297668.db2.gz	QYDZYKWQATYUAL-GOSISDBHSA-N	0	3	347.462	3.373	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1ccoc1Cl)C2	ZINC000963725657	1325388252	/nfs/dbraw/zinc/38/82/52/1325388252.db2.gz	WODQTQQWRIATAI-UHFFFAOYSA-N	0	3	329.227	3.316	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)c(F)c2)C1	ZINC001027279569	1325402817	/nfs/dbraw/zinc/40/28/17/1325402817.db2.gz	AGIGECDTYKAKJT-KRWDZBQOSA-N	0	3	329.419	3.086	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)c2cccs2)C1	ZINC001027280744	1325404930	/nfs/dbraw/zinc/40/49/30/1325404930.db2.gz	BPFDCGGCKACDAQ-KRWDZBQOSA-N	0	3	339.464	3.356	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)C[C@@H]2C=CCC2)C1	ZINC001027290124	1325422933	/nfs/dbraw/zinc/42/29/33/1325422933.db2.gz	PISZZDSLWUEYQX-XLIONFOSSA-N	0	3	337.467	3.337	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)C(C)(C)C(=C)Cl)C1	ZINC001107971058	1367224496	/nfs/dbraw/zinc/22/44/96/1367224496.db2.gz	NHYFUDJACUUAMT-KBXCAEBGSA-N	0	3	342.911	3.327	20	30		EGEDHN
CCCOc1cccc(CN(C)[C@@H]2CCCN(C(=O)[C@@H](C)C#N)C2)c1	ZINC001027335066	1325493213	/nfs/dbraw/zinc/49/32/13/1325493213.db2.gz	BKWOSMLKLXZQKC-FUHWJXTLSA-N	0	3	343.471	3.058	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@@H](N(C)Cc2cccc(C#N)c2)C1)C1CC1	ZINC001027350324	1325515815	/nfs/dbraw/zinc/51/58/15/1325515815.db2.gz	AOBFCVYBSQKVDX-DNVCBOLYSA-N	0	3	325.456	3.027	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)c(F)c2)C1	ZINC001027365373	1325554931	/nfs/dbraw/zinc/55/49/31/1325554931.db2.gz	SDZVQFUGWOGWGK-INIZCTEOSA-N	0	3	347.409	3.384	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)[C@@H]2CC2(C)C)C1	ZINC001027374775	1325571940	/nfs/dbraw/zinc/57/19/40/1325571940.db2.gz	JGFSEBHKTYYYBD-MSOLQXFVSA-N	0	3	325.456	3.027	20	30		EGEDHN
Cc1ccccc1C[C@@H](C)C(=O)C(C#N)C(=O)NC1CCCCC1	ZINC000860468029	1329320876	/nfs/dbraw/zinc/32/08/76/1329320876.db2.gz	HWZWGKYEHMQJPC-QAPCUYQASA-N	0	3	326.440	3.331	20	30		EGEDHN
C[C@H](CC(=O)C(C#N)C(=O)NCc1cccc(Cl)c1)c1ccco1	ZINC000860692040	1329344929	/nfs/dbraw/zinc/34/49/29/1329344929.db2.gz	WZBOCXVXUKBBRS-IUODEOHRSA-N	0	3	344.798	3.452	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)[C@@H]1[C@H](C)O[C@H](C)[C@H]1C)c1ccccc1	ZINC000860695940	1329345252	/nfs/dbraw/zinc/34/52/52/1329345252.db2.gz	WVPQBBCRWNCCAW-WNIVTNPTSA-N	0	3	342.439	3.022	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N1CCC[C@H](N(C)Cc2ccsc2)C1	ZINC001027415308	1327642796	/nfs/dbraw/zinc/64/27/96/1327642796.db2.gz	JFWCPIPSJHXCKG-KSZLIROESA-N	0	3	348.512	3.152	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)C2(C3CC3)CC2)C1	ZINC001027455958	1327697489	/nfs/dbraw/zinc/69/74/89/1327697489.db2.gz	NBKFZTGLRUYKDW-LJQANCHMSA-N	0	3	337.467	3.171	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)cc2)C1)C1CCC1	ZINC001027461020	1327707466	/nfs/dbraw/zinc/70/74/66/1327707466.db2.gz	SVFMKMZRHUAEBE-UZLBHIALSA-N	0	3	339.483	3.417	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H](N(C)Cc2cccc(C#N)c2)C1)C1CCC1	ZINC001027460837	1327707838	/nfs/dbraw/zinc/70/78/38/1327707838.db2.gz	PJTIYXWZFREQOF-JXFKEZNVSA-N	0	3	339.483	3.417	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)CCc2ccc(C)c(Cl)c2)C1	ZINC001027510772	1327777476	/nfs/dbraw/zinc/77/74/76/1327777476.db2.gz	GBVBGKMQWNIVEH-KRWDZBQOSA-N	0	3	332.875	3.137	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](N(C)Cc2cccc(OC)c2)C1	ZINC001027521800	1327794919	/nfs/dbraw/zinc/79/49/19/1327794919.db2.gz	LLDMQFCMGQYRMP-QGZVFWFLSA-N	0	3	330.472	3.330	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)C(C)(C)c2cccc(Cl)c2)C1	ZINC001027595656	1327942812	/nfs/dbraw/zinc/94/28/12/1327942812.db2.gz	FRCIOQKCYQTLCF-KRWDZBQOSA-N	0	3	332.875	3.174	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)CC23CC4CC(CC(C4)C2)C3)C1	ZINC001027662628	1328052850	/nfs/dbraw/zinc/05/28/50/1328052850.db2.gz	PQMDBHGVMHFBJV-VJJCQHNBSA-N	0	3	328.500	3.149	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2cccc(OCCC)c2)C1	ZINC000966393181	1328288839	/nfs/dbraw/zinc/28/88/39/1328288839.db2.gz	YGRIAZJXZOISBJ-QFBILLFUSA-N	0	3	330.472	3.492	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NC[C@@H]1CCCN1Cc1csc(C)c1	ZINC001027891521	1328359276	/nfs/dbraw/zinc/35/92/76/1328359276.db2.gz	ZQFZUHSSEPDSCY-KSZLIROESA-N	0	3	348.512	3.118	20	30		EGEDHN
Cc1cccc(C(=O)N2CC[C@@H](NCc3ccc(F)c(C#N)c3)C2)c1	ZINC000966688170	1328381539	/nfs/dbraw/zinc/38/15/39/1328381539.db2.gz	PHGICZBIPDGTFK-GOSISDBHSA-N	0	3	337.398	3.010	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](C)[C@@H](NC(=O)c2cc(C(F)(F)F)no2)C1	ZINC000966889385	1328455066	/nfs/dbraw/zinc/45/50/66/1328455066.db2.gz	YAVIVQWOGBLXHR-NEPJUHHUSA-N	0	3	345.365	3.100	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2ccc(-c3cnco3)cc2)C1	ZINC000966946278	1328490118	/nfs/dbraw/zinc/49/01/18/1328490118.db2.gz	WZJYTBNDFMJWMC-MAUKXSAKSA-N	0	3	339.439	3.358	20	30		EGEDHN
C#CCCN1CCC[C@@H]1CNC(=O)c1cc(C2CC2)oc1C1CC1	ZINC001028037518	1328502442	/nfs/dbraw/zinc/50/24/42/1328502442.db2.gz	ZNCDXGOPUDIUQF-MRXNPFEDSA-N	0	3	326.440	3.252	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC2(C1)CCN(Cc1cnc(C)s1)CC2	ZINC001050618159	1348304154	/nfs/dbraw/zinc/30/41/54/1348304154.db2.gz	RVDYTSMMCPRDMA-UHFFFAOYSA-N	0	3	333.501	3.088	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC2(C1)CCN(Cc1scnc1C)CC2	ZINC001050618384	1348304338	/nfs/dbraw/zinc/30/43/38/1348304338.db2.gz	VNTYCXYHTKNZLP-UHFFFAOYSA-N	0	3	333.501	3.088	20	30		EGEDHN
CC(C)(C)OC(=O)NCC[C@@H]1CCN(Cc2ccc(F)c(C#N)c2)C1	ZINC000932698070	1329834521	/nfs/dbraw/zinc/83/45/21/1329834521.db2.gz	BMQTZDPZQZSDHA-CQSZACIVSA-N	0	3	347.434	3.434	20	30		EGEDHN
CN(Cc1ccc(OCC#N)cc1)C[C@H]1CCN1C(=O)OC(C)(C)C	ZINC000933469203	1329891802	/nfs/dbraw/zinc/89/18/02/1329891802.db2.gz	MGLSBQQGQFOUDO-MRXNPFEDSA-N	0	3	345.443	3.030	20	30		EGEDHN
CSCC(C)(C)NCC(=O)N(CCC#N)c1cccc(Cl)c1	ZINC000934677751	1329999192	/nfs/dbraw/zinc/99/91/92/1329999192.db2.gz	QYGOMQBBJKRRPW-UHFFFAOYSA-N	0	3	339.892	3.318	20	30		EGEDHN
N#C[C@@H]1CC[C@@H](N2CCC(NC(=O)OCc3ccccc3)CC2)C1	ZINC000866592632	1330130607	/nfs/dbraw/zinc/13/06/07/1330130607.db2.gz	RHYLLNKYVNQDQX-SJLPKXTDSA-N	0	3	327.428	3.069	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001054699160	1349441803	/nfs/dbraw/zinc/44/18/03/1349441803.db2.gz	FEIQJBGULYZHFV-CZUORRHYSA-N	0	3	333.501	3.238	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@@H]2CC[C@@H](C)CC2)C[C@H]1NCc1ccc(C#N)s1	ZINC000939576580	1330460369	/nfs/dbraw/zinc/46/03/69/1330460369.db2.gz	LICCLVXCAXYROE-ATNYBXOESA-N	0	3	345.512	3.383	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2oc3ccc(F)cc3c2C)[C@H](C)C1	ZINC000942122008	1331838054	/nfs/dbraw/zinc/83/80/54/1331838054.db2.gz	JTIKTNCZBPMNEN-DYVFJYSZSA-N	0	3	342.414	3.344	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2c(C)c(F)ccc2Cl)[C@H](C)C1	ZINC000942194170	1331873466	/nfs/dbraw/zinc/87/34/66/1331873466.db2.gz	ZSTVMXCLWYBMOI-MLGOLLRUSA-N	0	3	336.838	3.251	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)n(C(CC)CC)n2)[C@@H](C)C1	ZINC000942209286	1331880423	/nfs/dbraw/zinc/88/04/23/1331880423.db2.gz	UZDKWLSKAQZRNU-MAUKXSAKSA-N	0	3	344.503	3.016	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3ccccc3s2)[C@H](C)C1	ZINC000942315201	1331901667	/nfs/dbraw/zinc/90/16/67/1331901667.db2.gz	SPTOENFJAXXKLW-ZBFHGGJFSA-N	0	3	326.465	3.365	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc3c4c(cccc42)CC3)[C@H](C)C1	ZINC000942393897	1331923409	/nfs/dbraw/zinc/92/34/09/1331923409.db2.gz	QGKYEOKKUVSASW-QRWLVFNGSA-N	0	3	332.447	3.012	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2sccc2-n2cccc2)[C@@H](C)C1	ZINC000942546355	1331967613	/nfs/dbraw/zinc/96/76/13/1331967613.db2.gz	SVHREGOMJFJPQF-LSDHHAIUSA-N	0	3	329.469	3.165	20	30		EGEDHN
C[C@@H]1CN(Cc2cccc(C#N)c2)CC[C@H]1NC(=O)C(C)(C)C1CC1	ZINC000942572557	1331983098	/nfs/dbraw/zinc/98/30/98/1331983098.db2.gz	VLDSKCUQHBHMHZ-DNVCBOLYSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCN(Cc3cncc(C)c3)C[C@@H]2C)CC1	ZINC000942599887	1331996880	/nfs/dbraw/zinc/99/68/80/1331996880.db2.gz	HEGPFDBMELJXAN-PXNSSMCTSA-N	0	3	341.499	3.463	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3cnccc3C)C[C@@H]2C)C1	ZINC000942602080	1331999236	/nfs/dbraw/zinc/99/92/36/1331999236.db2.gz	CTDBJEJFDQEODD-FUHWJXTLSA-N	0	3	327.472	3.073	20	30		EGEDHN
C[C@@H]1CN(Cc2cccc(C#N)c2)CC[C@H]1NC(=O)C1CC2(CC2)C1	ZINC000942698493	1332021401	/nfs/dbraw/zinc/02/14/01/1332021401.db2.gz	HRSIEKNZJJOVKE-DNVCBOLYSA-N	0	3	337.467	3.075	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(-c3ccccc3)nc2)[C@@H](C)C1	ZINC000943757026	1332255369	/nfs/dbraw/zinc/25/53/69/1332255369.db2.gz	ZDAGKEGSQBUKFV-PXNSSMCTSA-N	0	3	347.462	3.212	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C(F)F)cc2F)[C@H](C)C1	ZINC000943756863	1332255572	/nfs/dbraw/zinc/25/55/72/1332255572.db2.gz	XAKWBORQBOFEML-MLGOLLRUSA-N	0	3	338.373	3.227	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2[nH]c3ccc(C)cc3c2C)[C@@H](C)C1	ZINC000943813794	1332271810	/nfs/dbraw/zinc/27/18/10/1332271810.db2.gz	FKJNYNVROMZXAM-MAUKXSAKSA-N	0	3	337.467	3.248	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(-c3ccco3)s2)[C@H](C)C1	ZINC000943814696	1332272331	/nfs/dbraw/zinc/27/23/31/1332272331.db2.gz	JHXHHZTVZHYIGH-HUUCEWRRSA-N	0	3	342.464	3.472	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(OC3CCC3)cc2)[C@H](C)C1	ZINC000945029278	1332481424	/nfs/dbraw/zinc/48/14/24/1332481424.db2.gz	RGZTWAHKWOVVHM-OXQOHEQNSA-N	0	3	340.467	3.081	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2oc3ccccc3c2CC)[C@H](C)C1	ZINC000945365872	1332568201	/nfs/dbraw/zinc/56/82/01/1332568201.db2.gz	MGGGPXAZRCISFN-CRAIPNDOSA-N	0	3	338.451	3.459	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C(C)(C)c2ccccc2C)[C@@H](C)C1	ZINC000945806513	1332678683	/nfs/dbraw/zinc/67/86/83/1332678683.db2.gz	DRYRXCVWMZPESC-PKOBYXMFSA-N	0	3	326.484	3.123	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)C3(C(C)(F)F)CC3)CC[C@@H]2C1	ZINC000946784296	1332898528	/nfs/dbraw/zinc/89/85/28/1332898528.db2.gz	FUTDTPGASIRQLG-OKILXGFUSA-N	0	3	346.849	3.345	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@H](C)c3cccnc3)CC[C@@H]2C1	ZINC000946858927	1332917966	/nfs/dbraw/zinc/91/79/66/1332917966.db2.gz	GYCGPZRPTJJIDB-NXHRZFHOSA-N	0	3	347.890	3.108	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(F)c(C(F)F)c2)C[C@H]1C	ZINC000947319711	1333087147	/nfs/dbraw/zinc/08/71/47/1333087147.db2.gz	UNOZWTPMYXVIOB-TZMCWYRMSA-N	0	3	338.373	3.369	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(F)c(C(F)F)c2)C[C@@H]1C	ZINC000947319709	1333087298	/nfs/dbraw/zinc/08/72/98/1333087298.db2.gz	UNOZWTPMYXVIOB-JSGCOSHPSA-N	0	3	338.373	3.369	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2coc3ccc(C)cc23)C[C@@H]1C	ZINC000947356075	1333101489	/nfs/dbraw/zinc/10/14/89/1333101489.db2.gz	HETFOHDNYKQDEW-FUHWJXTLSA-N	0	3	338.451	3.276	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3cccc(Cl)c3)CC2)C[C@H]1C	ZINC000947370981	1333107133	/nfs/dbraw/zinc/10/71/33/1333107133.db2.gz	XDXWPNSIDIAMIN-QAPCUYQASA-N	0	3	344.886	3.364	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)n(C(CC)CC)n2)C[C@@H]1C	ZINC000947471643	1333141860	/nfs/dbraw/zinc/14/18/60/1333141860.db2.gz	DUTWRSXAOHECQQ-DOTOQJQBSA-N	0	3	344.503	3.159	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2coc3cc(F)ccc23)C[C@@H]1C	ZINC000947473913	1333142455	/nfs/dbraw/zinc/14/24/55/1333142455.db2.gz	PLTIRPLHTUPVAW-DZGCQCFKSA-N	0	3	328.387	3.178	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(-c3ccccc3)on2)C[C@H]1C	ZINC000947523524	1333156916	/nfs/dbraw/zinc/15/69/16/1333156916.db2.gz	DSGGJJGXJLNXGG-GDBMZVCRSA-N	0	3	325.412	3.110	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc(F)cc2Cl)C[C@H]1C	ZINC000947690418	1333225101	/nfs/dbraw/zinc/22/51/01/1333225101.db2.gz	WMQNDEQXEBYYHW-CZUORRHYSA-N	0	3	336.838	3.014	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C(C)C)nc2CC)C[C@@H]1C	ZINC000947725595	1333241123	/nfs/dbraw/zinc/24/11/23/1333241123.db2.gz	BJEAYXMRZXDDCX-IRXDYDNUSA-N	0	3	341.499	3.373	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2c[nH]c3c2cccc3C)C[C@H]1C	ZINC000947776863	1333258273	/nfs/dbraw/zinc/25/82/73/1333258273.db2.gz	ZSMYUXCUVMMCHZ-AEFFLSMTSA-N	0	3	337.467	3.011	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cnc(-c3ccoc3)s2)C[C@H]1C	ZINC000947779797	1333259313	/nfs/dbraw/zinc/25/93/13/1333259313.db2.gz	SYMPAABGTKGUIY-HIFRSBDPSA-N	0	3	343.452	3.009	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc3nc(C)sc3c2)C[C@H]1C	ZINC000947894451	1333295152	/nfs/dbraw/zinc/29/51/52/1333295152.db2.gz	AGSVTEMEDMHMQA-DOMZBBRYSA-N	0	3	329.469	3.373	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnn(C3CCCC3)c2C)C[C@H]1C	ZINC000947912611	1333304183	/nfs/dbraw/zinc/30/41/83/1333304183.db2.gz	NUEJHKXWFYNLEI-ZBFHGGJFSA-N	0	3	330.476	3.075	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2c[nH]c3cccc(C)c23)C[C@@H]1C	ZINC000947934277	1333311271	/nfs/dbraw/zinc/31/12/71/1333311271.db2.gz	KBBYXNONCYKODW-FUHWJXTLSA-N	0	3	337.467	3.011	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(Cl)c(Cl)c2)C[C@H]1C	ZINC000947967447	1333325028	/nfs/dbraw/zinc/32/50/28/1333325028.db2.gz	PAJUCLSFBSOZRV-DGCLKSJQSA-N	0	3	325.239	3.209	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2c(C)oc3ccccc32)C[C@H]1C	ZINC000948104004	1333375166	/nfs/dbraw/zinc/37/51/66/1333375166.db2.gz	JCQGEUUMIKSYAA-NVXWUHKLSA-N	0	3	338.451	3.276	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cc3ccccc3nc2C)CC1	ZINC000948416984	1333517530	/nfs/dbraw/zinc/51/75/30/1333517530.db2.gz	ULIBQVPHHTXQNL-IBGZPJMESA-N	0	3	349.478	3.493	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cc3ccncc3s2)CC1	ZINC000948435193	1333523642	/nfs/dbraw/zinc/52/36/42/1333523642.db2.gz	IMGDYRDLOAAHAX-MRXNPFEDSA-N	0	3	341.480	3.246	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cccc3ccc(C)nc32)CC1	ZINC000948471591	1333539022	/nfs/dbraw/zinc/53/90/22/1333539022.db2.gz	XXYQRCIYOUVDKL-LJQANCHMSA-N	0	3	349.478	3.493	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)Cc2ccc(C)cc2Cl)CC1	ZINC000948553379	1333571911	/nfs/dbraw/zinc/57/19/11/1333571911.db2.gz	GRBYWRJDAJEZSS-QGZVFWFLSA-N	0	3	332.875	3.137	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2cc3ccccc3s2)CC1	ZINC000948590144	1333587785	/nfs/dbraw/zinc/58/77/85/1333587785.db2.gz	JFYOUVULKLMVFU-MRXNPFEDSA-N	0	3	326.465	3.461	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2scnc2C(F)F)CC1	ZINC000948608322	1333594883	/nfs/dbraw/zinc/59/48/83/1333594883.db2.gz	MYQSHMHCVFLMNI-GFCCVEGCSA-N	0	3	341.427	3.031	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)C2(c3ccc(F)cc3)CCC2)CC1	ZINC000948666018	1333621857	/nfs/dbraw/zinc/62/18/57/1333621857.db2.gz	YPAQZPANACVUOO-LJQANCHMSA-N	0	3	342.458	3.194	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2ccc(C(F)F)c(F)c2)CC1	ZINC000948775340	1333673569	/nfs/dbraw/zinc/67/35/69/1333673569.db2.gz	GFPRDIMUEXDJTN-CQSZACIVSA-N	0	3	338.373	3.323	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)Cc2ccc(C(C)(C)C)cc2)CC1	ZINC000948804655	1333686659	/nfs/dbraw/zinc/68/66/59/1333686659.db2.gz	PYRHDOGPLMVVEQ-FQEVSTJZSA-N	0	3	340.511	3.473	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2ccc(Cl)c(F)c2)CC1	ZINC000948804510	1333687258	/nfs/dbraw/zinc/68/72/58/1333687258.db2.gz	PDGDQGJWVBFXPS-OAHLLOKOSA-N	0	3	336.838	3.429	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)[C@]2(C)CCCc3ccccc32)CC1	ZINC000948852130	1333709557	/nfs/dbraw/zinc/70/95/57/1333709557.db2.gz	IHPYNMVFTDAHOI-DENIHFKCSA-N	0	3	338.495	3.227	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@H]1CNC(=O)c1ccsn1	ZINC000948932745	1333738813	/nfs/dbraw/zinc/73/88/13/1333738813.db2.gz	OIDLVDQUQGAESG-GOSISDBHSA-N	0	3	341.480	3.439	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@@H]1CNC(=O)[C@H]1CCC1(F)F	ZINC000948933060	1333739567	/nfs/dbraw/zinc/73/95/67/1333739567.db2.gz	TYDZAYWWVSYRES-SJORKVTESA-N	0	3	334.410	3.323	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NC[C@H]1c2ccccc2CCN1C(C)C	ZINC000948970491	1333751607	/nfs/dbraw/zinc/75/16/07/1333751607.db2.gz	YVYSZOHNFNXEGL-UFYCRDLUSA-N	0	3	342.483	3.092	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccccc1C(C)C)CCO2	ZINC000949108235	1333779122	/nfs/dbraw/zinc/77/91/22/1333779122.db2.gz	FMCISQVUPURMIH-UHFFFAOYSA-N	0	3	342.483	3.303	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccc(C(C)C)cc1)CCO2	ZINC000949236424	1333801108	/nfs/dbraw/zinc/80/11/08/1333801108.db2.gz	XTGPGSZBOIBFSE-UHFFFAOYSA-N	0	3	342.483	3.303	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1cccc(C3CC3)c1)CCO2	ZINC000949251914	1333804041	/nfs/dbraw/zinc/80/40/41/1333804041.db2.gz	ZVVGPSRFIDASMV-UHFFFAOYSA-N	0	3	340.467	3.057	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@@H]1CCCC[C@@H]1C)CCO2	ZINC000949253867	1333804583	/nfs/dbraw/zinc/80/45/83/1333804583.db2.gz	OYORILXLNNNYOD-ROUUACIJSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C[C@@H]3CC[C@@H](C)C3)CC2)C1	ZINC000949444689	1333848757	/nfs/dbraw/zinc/84/87/57/1333848757.db2.gz	KZVXZPFJEHJPTF-QZTJIDSGSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC3(CC2)CN(CC(C)C)CCO3)CC1	ZINC000949458536	1333852676	/nfs/dbraw/zinc/85/26/76/1333852676.db2.gz	GEUJWOPNKABODQ-UHFFFAOYSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@H]3CCCC[C@H]3CC)CC2)C1	ZINC000949504784	1333862637	/nfs/dbraw/zinc/86/26/37/1333862637.db2.gz	UTQPYTSQOVCIRJ-MOPGFXCFSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3ccc(Cl)cc3)CC2)C1	ZINC000949515264	1333864727	/nfs/dbraw/zinc/86/47/27/1333864727.db2.gz	IIDCXCWJCCOKDI-UHFFFAOYSA-N	0	3	348.874	3.223	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3ccccc3Cl)CC2)C1	ZINC000949515500	1333865057	/nfs/dbraw/zinc/86/50/57/1333865057.db2.gz	VCULJKIVXRJTEV-UHFFFAOYSA-N	0	3	348.874	3.223	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@@H]3CCCC(C)(C)C3)CC2)C1	ZINC000949534257	1333870689	/nfs/dbraw/zinc/87/06/89/1333870689.db2.gz	SYZIVAOIKICJAF-GOSISDBHSA-N	0	3	348.531	3.472	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2cc(C)nn2C(CC)CC)C1	ZINC000967091273	1335660485	/nfs/dbraw/zinc/66/04/85/1335660485.db2.gz	UXCOJQGHIGDNGD-MAUKXSAKSA-N	0	3	344.503	3.016	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](C)[C@@H](NC(=O)c2conc2C(F)(F)F)C1	ZINC000967397580	1335726124	/nfs/dbraw/zinc/72/61/24/1335726124.db2.gz	QAKHFNBYXOMITP-YPMHNXCESA-N	0	3	345.365	3.100	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC[C@@H](NCc2ccccc2Oc2ccccc2)C1	ZINC000967727598	1335808686	/nfs/dbraw/zinc/80/86/86/1335808686.db2.gz	GAFXKUGUERQUSL-SJLPKXTDSA-N	0	3	349.434	3.329	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(F)c(Cl)c2F)C1	ZINC000968216102	1335874146	/nfs/dbraw/zinc/87/41/46/1335874146.db2.gz	ZRRXBFKUNLLZKY-RISCZKNCSA-N	0	3	340.801	3.082	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(C(F)F)c(F)c2)C1	ZINC000968327978	1335891408	/nfs/dbraw/zinc/89/14/08/1335891408.db2.gz	VPSRUQXRMYLEPQ-WBMJQRKESA-N	0	3	338.373	3.227	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)Cc2ccc(F)c(Cl)c2)C1	ZINC000968354387	1335899365	/nfs/dbraw/zinc/89/93/65/1335899365.db2.gz	RYNVLXBYNNIRHI-DYVFJYSZSA-N	0	3	338.854	3.424	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2cccc(-c3cnco3)c2)C1	ZINC000968492536	1335940698	/nfs/dbraw/zinc/94/06/98/1335940698.db2.gz	JMSNKCLNNXTOJK-MAUKXSAKSA-N	0	3	339.439	3.358	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cccc(-c3ccoc3)c2)C1	ZINC000968517909	1335951053	/nfs/dbraw/zinc/95/10/53/1335951053.db2.gz	VAYNADQNRCCUAQ-UZLBHIALSA-N	0	3	336.435	3.410	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2cc(F)c(F)c(F)c2F)C1	ZINC000968568766	1335962180	/nfs/dbraw/zinc/96/21/80/1335962180.db2.gz	CJJKZEIYBNNIBU-ZWNOBZJWSA-N	0	3	344.352	3.259	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(Br)o2)C1	ZINC000968584209	1335972888	/nfs/dbraw/zinc/97/28/88/1335972888.db2.gz	VAOXIOQHZKCUED-NEPJUHHUSA-N	0	3	341.249	3.058	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2cc(C)c(F)cc2Cl)C1	ZINC000968592492	1335975900	/nfs/dbraw/zinc/97/59/00/1335975900.db2.gz	NHPRWSDQIDZHLT-SJCJKPOMSA-N	0	3	336.838	3.251	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@H]1CN(Cc2ccccc2)CC[C@H]1C	ZINC000968592092	1335975965	/nfs/dbraw/zinc/97/59/65/1335975965.db2.gz	KKFBPNFCWJSLCF-GCJKJVERSA-N	0	3	346.474	3.237	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)C2(c3ccccc3C)CCC2)C1	ZINC000968592160	1335976170	/nfs/dbraw/zinc/97/61/70/1335976170.db2.gz	LHOBPBYMUNDTCG-ICSRJNTNSA-N	0	3	338.495	3.267	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)[C@@]2(c3ccccc3)C[C@H](F)C2)C1	ZINC000968598486	1335979420	/nfs/dbraw/zinc/97/94/20/1335979420.db2.gz	GNHPQKKLJHPOAV-ROPHOZQPSA-N	0	3	344.474	3.459	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@@H](NC2c3ccccc3-c3ccccc32)C1	ZINC000968627076	1335989425	/nfs/dbraw/zinc/98/94/25/1335989425.db2.gz	LQNIKQPJHZADHG-QGZVFWFLSA-N	0	3	342.442	3.360	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)Cc2ccc3c(c2)CCC3)C1	ZINC000968631015	1335990199	/nfs/dbraw/zinc/99/01/99/1335990199.db2.gz	FCZFKBHXLFWLRD-OXQOHEQNSA-N	0	3	326.484	3.121	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2c[nH]cc2-c2ccccc2)C1	ZINC000968646606	1335995030	/nfs/dbraw/zinc/99/50/30/1335995030.db2.gz	FHTMOWGXCCPJLK-UZLBHIALSA-N	0	3	335.451	3.145	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)C2(c3ccc(C)cc3)CCC2)C1	ZINC000968691607	1336013376	/nfs/dbraw/zinc/01/33/76/1336013376.db2.gz	HSVHGDZDBJMEHU-ICSRJNTNSA-N	0	3	338.495	3.267	20	30		EGEDHN
Cc1cc(C)c(C(=O)N2CC[C@@H](NCc3ccc(C#N)s3)C2)s1	ZINC000968807576	1336057524	/nfs/dbraw/zinc/05/75/24/1336057524.db2.gz	GAYSGYZQOJJJLZ-CYBMUJFWSA-N	0	3	345.493	3.302	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccn(C2CCCC2)n1	ZINC000968874631	1336075229	/nfs/dbraw/zinc/07/52/29/1336075229.db2.gz	OQQMWIVVDMJSPM-KRWDZBQOSA-N	0	3	330.476	3.159	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1c(C)nn(C(C)(C)C)c1C	ZINC000968879962	1336078109	/nfs/dbraw/zinc/07/81/09/1336078109.db2.gz	UJCSTGODOISUNS-KRWDZBQOSA-N	0	3	346.519	3.415	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)[C@@H]1CCN(C)c2ccccc21	ZINC000968893851	1336083297	/nfs/dbraw/zinc/08/32/97/1336083297.db2.gz	SAASIMWWERTFSX-PKOBYXMFSA-N	0	3	341.499	3.157	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000968914632	1336087710	/nfs/dbraw/zinc/08/77/10/1336087710.db2.gz	YDEBHBQFRJFHMN-AZUAARDMSA-N	0	3	341.499	3.060	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cc(C)cc(OC)c1C	ZINC000968936651	1336096214	/nfs/dbraw/zinc/09/62/14/1336096214.db2.gz	NEOHOPYFSKPZRZ-KRWDZBQOSA-N	0	3	330.472	3.472	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1cc(C)n(CC)c1C	ZINC000968936916	1336096548	/nfs/dbraw/zinc/09/65/48/1336096548.db2.gz	VAAHSTKDGVSYBK-SFHVURJKSA-N	0	3	329.488	3.123	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1ccc2ncccc2c1	ZINC000969011012	1336117848	/nfs/dbraw/zinc/11/78/48/1336117848.db2.gz	IRGJUICISVVZOV-LJQANCHMSA-N	0	3	335.451	3.233	20	30		EGEDHN
C#CCCN1CCCCC[C@H]1CNC(=O)c1scnc1C(C)(C)C	ZINC000969062183	1336134472	/nfs/dbraw/zinc/13/44/72/1336134472.db2.gz	LAUBGSWDLYCKGK-HNNXBMFYSA-N	0	3	347.528	3.438	20	30		EGEDHN
C#CCCN1CCCCC[C@H]1CNC(=O)c1sc(CC)nc1C	ZINC000969065626	1336136318	/nfs/dbraw/zinc/13/63/18/1336136318.db2.gz	VKSKPKGJQNZOGT-HNNXBMFYSA-N	0	3	333.501	3.012	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cccc2c1ccn2C	ZINC000969072943	1336137859	/nfs/dbraw/zinc/13/78/59/1336137859.db2.gz	UTWCDCCYSHOZPA-MRXNPFEDSA-N	0	3	325.456	3.339	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccoc1Br	ZINC000969105808	1336145852	/nfs/dbraw/zinc/14/58/52/1336145852.db2.gz	OQNRJYWBQHHQEY-GFCCVEGCSA-N	0	3	341.249	3.203	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1c(C)nn(CC)c1Cl	ZINC000969153578	1336164475	/nfs/dbraw/zinc/16/44/75/1336164475.db2.gz	KLSBEUBDBJUKEI-AWEZNQCLSA-N	0	3	338.883	3.025	20	30		EGEDHN
C#CCN1CCCCC[C@H]1CNC(=O)c1c[nH]c2c1cccc2CC	ZINC000969156376	1336166104	/nfs/dbraw/zinc/16/61/04/1336166104.db2.gz	RHQFZMSYHYQUPT-KRWDZBQOSA-N	0	3	337.467	3.338	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N[C@@H](C)C1CN(CC=C(C)C)C1	ZINC000969989376	1336269502	/nfs/dbraw/zinc/26/95/02/1336269502.db2.gz	OGVMVXLRZXYSRM-INIZCTEOSA-N	0	3	328.456	3.268	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)c2c[nH]nc2C2CCCCC2)C1	ZINC000970714269	1336334877	/nfs/dbraw/zinc/33/48/77/1336334877.db2.gz	OLZPUNVVUOHLPQ-CQSZACIVSA-N	0	3	330.476	3.084	20	30		EGEDHN
C=CCn1cccc1C(=O)N(C)C1CCN(Cc2ccsc2)CC1	ZINC001005509584	1336364329	/nfs/dbraw/zinc/36/43/29/1336364329.db2.gz	CYBPDGMWCCMVLL-UHFFFAOYSA-N	0	3	343.496	3.472	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2sc(CC3CC3)nc2C)CC1	ZINC001006200912	1336466137	/nfs/dbraw/zinc/46/61/37/1336466137.db2.gz	IDTIIYDDEYKBPP-UHFFFAOYSA-N	0	3	333.501	3.126	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cnn(C(C)C)c2C2CC2)CC1	ZINC001006274809	1336479832	/nfs/dbraw/zinc/47/98/32/1336479832.db2.gz	LMFHAYLRCSJLIO-UHFFFAOYSA-N	0	3	330.476	3.064	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2ocnc2-c2ccccc2)C1	ZINC001007478746	1336654753	/nfs/dbraw/zinc/65/47/53/1336654753.db2.gz	YMNMVGHFAJPPGE-INIZCTEOSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2ccc(F)c(Cl)c2F)C1	ZINC001008428915	1336850420	/nfs/dbraw/zinc/85/04/20/1336850420.db2.gz	OGXHZYZGQDKNMO-NSHDSACASA-N	0	3	328.790	3.389	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H](NC(=O)c2oc(CC(C)C)nc2C)C1	ZINC001008791981	1336926057	/nfs/dbraw/zinc/92/60/57/1336926057.db2.gz	CQFSVYQLXFTURN-MRXNPFEDSA-N	0	3	333.476	3.342	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN([C@H](C)c3cccc(C)c3)C2)nc1	ZINC001009272001	1336994772	/nfs/dbraw/zinc/99/47/72/1336994772.db2.gz	WSGNGVCXQKJBQG-YLJYHZDGSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN([C@@H](C)c3cccc(C)c3)C2)nc1	ZINC001009271992	1336995101	/nfs/dbraw/zinc/99/51/01/1336995101.db2.gz	WSGNGVCXQKJBQG-FXAWDEMLSA-N	0	3	347.462	3.327	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H](NC(=O)c2c(F)ccc(OC)c2F)C1	ZINC001009297534	1337000745	/nfs/dbraw/zinc/00/07/45/1337000745.db2.gz	OQZSXWIGPIVSIR-CYBMUJFWSA-N	0	3	338.398	3.134	20	30		EGEDHN
C#CCCN1CCC[C@@H](NC(=O)c2ccc(Cl)c(Cl)c2)C1	ZINC001009311043	1337003308	/nfs/dbraw/zinc/00/33/08/1337003308.db2.gz	BKDSMOOSBSUDPT-CYBMUJFWSA-N	0	3	325.239	3.211	20	30		EGEDHN
N#Cc1c[nH]c(C(=O)N[C@@H]2CCN(Cc3cccc4ccccc43)C2)c1	ZINC001010456768	1337199475	/nfs/dbraw/zinc/19/94/75/1337199475.db2.gz	IKJOBSMMDUVXDC-GOSISDBHSA-N	0	3	344.418	3.044	20	30		EGEDHN
N#Cc1ccc(C(=O)N[C@H]2CCN(Cc3cccc4ccccc43)C2)[nH]1	ZINC001010647473	1337235060	/nfs/dbraw/zinc/23/50/60/1337235060.db2.gz	ZODPJWOENDVHDB-SFHVURJKSA-N	0	3	344.418	3.044	20	30		EGEDHN
C=C(C)CCN1CC[C@H](NC(=O)c2ccc(-c3ccncc3)o2)C1	ZINC001014716167	1337880691	/nfs/dbraw/zinc/88/06/91/1337880691.db2.gz	JSGKTQPCUSIFRW-INIZCTEOSA-N	0	3	325.412	3.112	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(CCc3ccccc3CC)C2)cc1	ZINC001015481809	1338155247	/nfs/dbraw/zinc/15/52/47/1338155247.db2.gz	IHONDCYBWVXGRV-QFIPXVFZSA-N	0	3	346.474	3.277	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N[C@H]1CCN(Cc2ccccc2C)C1	ZINC001015816386	1338325112	/nfs/dbraw/zinc/32/51/12/1338325112.db2.gz	KSYRHEBRHGYMIU-UFYCRDLUSA-N	0	3	342.483	3.057	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@@H]3NC(=O)C[C@@H]3C=CCC3)CC2)c1	ZINC001016501400	1338628173	/nfs/dbraw/zinc/62/81/73/1338628173.db2.gz	ZQZRDFCNXZIFBJ-XLIONFOSSA-N	0	3	349.478	3.385	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2coc3c2cccc3C)CC1	ZINC001016663421	1338683882	/nfs/dbraw/zinc/68/38/82/1338683882.db2.gz	QSQYWBNVPXVCLK-GOSISDBHSA-N	0	3	336.435	3.349	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccc(OCC)c(C)c2)CC1	ZINC001016854724	1338748619	/nfs/dbraw/zinc/74/86/19/1338748619.db2.gz	CCLMRAYADYONFJ-LJQANCHMSA-N	0	3	340.467	3.001	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)C(C)(C)c2ccccc2F)CC1	ZINC001016876544	1338756204	/nfs/dbraw/zinc/75/62/04/1338756204.db2.gz	HGTIPJDDHKHLSW-GOSISDBHSA-N	0	3	342.458	3.097	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)C[C@@H]2CCc3ccccc32)CC1	ZINC001016886645	1338759358	/nfs/dbraw/zinc/75/93/58/1338759358.db2.gz	SYIUMMRFQPANJQ-AZUAARDMSA-N	0	3	336.479	3.101	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(-c3ccco3)s2)CC1	ZINC001016910538	1338767142	/nfs/dbraw/zinc/76/71/42/1338767142.db2.gz	VSJIPTPEGFCWDC-KRWDZBQOSA-N	0	3	340.448	3.226	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)C2CCC(C(F)F)CC2)CC1	ZINC001016956217	1338783669	/nfs/dbraw/zinc/78/36/69/1338783669.db2.gz	SHWUYAZTBMYICN-GPANFISMSA-N	0	3	338.442	3.052	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2cc3cccc(Cl)c3o2)CC1	ZINC001017008159	1338802736	/nfs/dbraw/zinc/80/27/36/1338802736.db2.gz	LDPKCYPFZSULEH-MRXNPFEDSA-N	0	3	342.826	3.304	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCCN(C(=O)C2CCCC2)C1	ZINC001017013045	1338806075	/nfs/dbraw/zinc/80/60/75/1338806075.db2.gz	GGKBWOJSDHFCJI-HNNXBMFYSA-N	0	3	345.512	3.480	20	30		EGEDHN
CC(C)c1cccc(CN(C)C[C@H]2CCCN(C(=O)[C@H](C)C#N)C2)n1	ZINC001017076145	1338849813	/nfs/dbraw/zinc/84/98/13/1338849813.db2.gz	FLWWCAGMRUNWEG-IAGOWNOFSA-N	0	3	342.487	3.035	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C(C)(C)[C@@H]1CCCCO1	ZINC001017558280	1339367723	/nfs/dbraw/zinc/36/77/23/1339367723.db2.gz	CIOPIRXXRAZVJC-KSZLIROESA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(N(C)C)cc1F	ZINC001017617118	1339377613	/nfs/dbraw/zinc/37/76/13/1339377613.db2.gz	LRLDHESKWIAKBS-CALCHBBNSA-N	0	3	345.462	3.147	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(C(C)C)nc1	ZINC001017618704	1339377914	/nfs/dbraw/zinc/37/79/14/1339377914.db2.gz	UYBANOVCNBVHJJ-HDICACEKSA-N	0	3	327.472	3.460	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CCc1ccc(F)cc1	ZINC001017712432	1339398388	/nfs/dbraw/zinc/39/83/88/1339398388.db2.gz	UVRFUDJPPGTWAW-KDURUIRLSA-N	0	3	330.447	3.400	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)Oc1ccc(F)cc1	ZINC001018249651	1339549339	/nfs/dbraw/zinc/54/93/39/1339549339.db2.gz	QCLIDDXPIPNATH-NXHRZFHOSA-N	0	3	346.446	3.234	20	30		EGEDHN
CC1(CC(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)CCCC1	ZINC001018804781	1339730436	/nfs/dbraw/zinc/73/04/36/1339730436.db2.gz	JMABHDCSJIOOPP-AWEZNQCLSA-N	0	3	331.485	3.281	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCCN2Cc2ccc(C)cc2)cc1	ZINC001028067602	1340406762	/nfs/dbraw/zinc/40/67/62/1340406762.db2.gz	XWTOIBUNUDHWID-OAQYLSRUSA-N	0	3	332.447	3.371	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@@H]2CCCN2Cc2cccc(CC)c2)c1	ZINC001028126796	1340445465	/nfs/dbraw/zinc/44/54/65/1340445465.db2.gz	PXLDBSLUCYNQRW-NRFANRHFSA-N	0	3	347.462	3.020	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@@H]2CCCN2Cc2ccc(CC)cc2)c1	ZINC001028130106	1340447429	/nfs/dbraw/zinc/44/74/29/1340447429.db2.gz	YFKNZPSHUVYKKQ-NRFANRHFSA-N	0	3	347.462	3.020	20	30		EGEDHN
C=C(C)CCN1CCC[C@H]1CNC(=O)c1cnc([C@@H]2CCCO2)s1	ZINC001028187444	1340474873	/nfs/dbraw/zinc/47/48/73/1340474873.db2.gz	JZSFXHAQRQMPBT-GJZGRUSLSA-N	0	3	349.500	3.155	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1cc(F)c2ncccc2c1	ZINC001028204415	1340483094	/nfs/dbraw/zinc/48/30/94/1340483094.db2.gz	UJWZDTGHVAVNTA-MRXNPFEDSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1ccnc(O[C@H](C)CC)c1	ZINC001028250058	1340510467	/nfs/dbraw/zinc/51/04/67/1340510467.db2.gz	PKKGBROHEYCHJW-WBVHZDCISA-N	0	3	331.460	3.029	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCCN2Cc2cc(C)cc(C)c2)nc1	ZINC001028268816	1340523706	/nfs/dbraw/zinc/52/37/06/1340523706.db2.gz	AXNCQNFFOBVBSN-HXUWFJFHSA-N	0	3	347.462	3.074	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H](CNC(=O)c3ccoc3Cl)C2)c1	ZINC001028502526	1340674862	/nfs/dbraw/zinc/67/48/62/1340674862.db2.gz	YVEONRFJYDTJAR-HNNXBMFYSA-N	0	3	343.814	3.057	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H](CNC(=O)c3[nH]ccc3C3CC3)C2)c1	ZINC001028588435	1340716374	/nfs/dbraw/zinc/71/63/74/1340716374.db2.gz	FGJIVRAGZPSVIK-KRWDZBQOSA-N	0	3	348.450	3.016	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)c2ccccc2C(C)(C)CC)C1	ZINC001028616834	1340725829	/nfs/dbraw/zinc/72/58/29/1340725829.db2.gz	BNTGVUXQIYBSRB-KRWDZBQOSA-N	0	3	326.484	3.449	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H](CNC(=O)c3occc3Cl)C2)c1	ZINC001028781883	1340814119	/nfs/dbraw/zinc/81/41/19/1340814119.db2.gz	HXONQXCONHVQNI-HNNXBMFYSA-N	0	3	343.814	3.057	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](CNC(=O)c3c[nH]cc3C3CC3)C2)cc1	ZINC001028900478	1340878489	/nfs/dbraw/zinc/87/84/89/1340878489.db2.gz	DQEHGVCHLCRZTN-KRWDZBQOSA-N	0	3	348.450	3.016	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)C1CCN(C(=O)C2CCC2)CC1	ZINC001029036553	1340913859	/nfs/dbraw/zinc/91/38/59/1340913859.db2.gz	NEIXVCOYLYDBOS-OAHLLOKOSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@@H](NCc1cc(F)ccc1C#N)C1CCN(C(=O)C2CCC2)CC1	ZINC001029036831	1340914168	/nfs/dbraw/zinc/91/41/68/1340914168.db2.gz	SRUCGGKQGBNGPJ-CQSZACIVSA-N	0	3	343.446	3.214	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC([C@H](C)NCc2cc(F)ccc2C#N)CC1	ZINC001029076901	1340924573	/nfs/dbraw/zinc/92/45/73/1340924573.db2.gz	BWFBTNWLPQSDQY-DOCFVWFQSA-N	0	3	343.446	3.380	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)C1CCN(C(=O)[C@@H]2CC2(C)C)CC1	ZINC001029084219	1340927152	/nfs/dbraw/zinc/92/71/52/1340927152.db2.gz	QSIKZXKLPBJFLX-KXBFYZLASA-N	0	3	339.483	3.321	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC([C@H](C)NCc2cc(OC)no2)CC1	ZINC001029139567	1340940473	/nfs/dbraw/zinc/94/04/73/1340940473.db2.gz	GGYVYNFLKNVMIK-LIRRHRJNSA-N	0	3	349.475	3.002	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC([C@H](C)NCc3ocnc3C)CC2)C1	ZINC001029142844	1340941924	/nfs/dbraw/zinc/94/19/24/1340941924.db2.gz	ZDOXBWYBIOTBPL-AWEZNQCLSA-N	0	3	331.460	3.056	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CC[C@@H](C1)N2CC[C@@H]1CCCCO1	ZINC001029453735	1340993573	/nfs/dbraw/zinc/99/35/73/1340993573.db2.gz	JTQIDQXSRWGCCM-DMUMMCEESA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CC[C@@H](C1)N2C[C@@H](OC)C1CCCC1	ZINC001029456988	1340994677	/nfs/dbraw/zinc/99/46/77/1340994677.db2.gz	WAKOWYUSNOPOOG-HDAAZOAOSA-N	0	3	348.531	3.469	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H](CN(C)Cc2cnoc2C)C1	ZINC001029748921	1341063089	/nfs/dbraw/zinc/06/30/89/1341063089.db2.gz	OZVWSSDRVDHIRD-AWEZNQCLSA-N	0	3	339.867	3.042	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@H](CN(C)Cc2ccccn2)C1	ZINC001029749404	1341063145	/nfs/dbraw/zinc/06/31/45/1341063145.db2.gz	WTYPWHZDKOYGAS-OAHLLOKOSA-N	0	3	335.879	3.141	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCN(C(=O)C2(C)CCCC2)C1	ZINC001029794415	1341075139	/nfs/dbraw/zinc/07/51/39/1341075139.db2.gz	CNRDTJKTIVKOPZ-HNNXBMFYSA-N	0	3	345.512	3.480	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](CN(C)Cc2oc(CC)nc2C)C1	ZINC001029800306	1341077120	/nfs/dbraw/zinc/07/71/20/1341077120.db2.gz	OVACWNJZDYCYSF-INIZCTEOSA-N	0	3	347.503	3.428	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](CN(C)Cc3cnoc3C)C2)CC1	ZINC001029825785	1341086974	/nfs/dbraw/zinc/08/69/74/1341086974.db2.gz	IGTRRTNUIKEZSL-INIZCTEOSA-N	0	3	331.460	3.010	20	30		EGEDHN
C#CCCN1CCC[C@H](N(Cc2ccccc2)C(=O)c2cccnc2)C1	ZINC001029918779	1341118384	/nfs/dbraw/zinc/11/83/84/1341118384.db2.gz	IUMDBMZYIZDBSX-NRFANRHFSA-N	0	3	347.462	3.212	20	30		EGEDHN
CN(Cc1ccccc1Cl)CC1CCN(C(=O)C#CC2CC2)CC1	ZINC001029964823	1341136878	/nfs/dbraw/zinc/13/68/78/1341136878.db2.gz	BNMXRFPVNDEWBV-UHFFFAOYSA-N	0	3	344.886	3.424	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC(CN(C)Cc3cc(C)no3)CC2)CC1	ZINC001029991461	1341148700	/nfs/dbraw/zinc/14/87/00/1341148700.db2.gz	ZSFLXYAUDUABQO-UHFFFAOYSA-N	0	3	345.487	3.400	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC(CN(C)Cc3oc(C)nc3C)CC2)C1	ZINC001029993287	1341150179	/nfs/dbraw/zinc/15/01/79/1341150179.db2.gz	ALZMGLINXSVLPN-UHFFFAOYSA-N	0	3	345.487	3.318	20	30		EGEDHN
C#Cc1ccc(C(=O)NCC2CN(Cc3cc(C)ccc3C)C2)cc1	ZINC001031892166	1341417490	/nfs/dbraw/zinc/41/74/90/1341417490.db2.gz	PBQVFSGYJBAPRX-UHFFFAOYSA-N	0	3	332.447	3.147	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(OC)cc1Cl	ZINC001032689216	1341583050	/nfs/dbraw/zinc/58/30/50/1341583050.db2.gz	SYFHEOHGXMAAQV-KBPBESRZSA-N	0	3	334.847	3.214	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cc(C)nc2ccccc21	ZINC001032765971	1341607393	/nfs/dbraw/zinc/60/73/93/1341607393.db2.gz	MIRYDFAIKDNYIX-IRXDYDNUSA-N	0	3	335.451	3.408	20	30		EGEDHN
C=CCn1cccc1C(=O)N(C)[C@@H]1CCN(Cc2ccccc2C)C1	ZINC001033144778	1341738684	/nfs/dbraw/zinc/73/86/84/1341738684.db2.gz	BRDMWZPDAMKWFN-LJQANCHMSA-N	0	3	337.467	3.329	20	30		EGEDHN
C=CCn1cccc1C(=O)N(C)[C@@H]1CCN(Cc2ccc(C)cc2)C1	ZINC001033146149	1341739780	/nfs/dbraw/zinc/73/97/80/1341739780.db2.gz	NYBYUXXSJVPISN-LJQANCHMSA-N	0	3	337.467	3.329	20	30		EGEDHN
C#CCCN1CC[C@@H](N(C)C(=O)c2cc(Cl)sc2Cl)C1	ZINC001033149016	1341740107	/nfs/dbraw/zinc/74/01/07/1341740107.db2.gz	HBFNECUZVLXRBL-SNVBAGLBSA-N	0	3	331.268	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)Cc2ccccc2OC(C)C)C1	ZINC001033504373	1341850000	/nfs/dbraw/zinc/85/00/00/1341850000.db2.gz	HCAPABHXFJYOKR-SFHVURJKSA-N	0	3	330.472	3.125	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)[C@@]2(c3ccccc3)CC2(C)C)C1	ZINC001033523030	1341858101	/nfs/dbraw/zinc/85/81/01/1341858101.db2.gz	VZMDCUNUONFHQH-RXVVDRJESA-N	0	3	326.484	3.463	20	30		EGEDHN
C#CCCN1CC[C@@H](N(C)C(=O)c2ccc(O[C@@H](C)CC)cc2)C1	ZINC001033566914	1341876715	/nfs/dbraw/zinc/87/67/15/1341876715.db2.gz	MAIAKZCBNLCMOA-FUHWJXTLSA-N	0	3	328.456	3.034	20	30		EGEDHN
C#CCCN1CC[C@H](N(C)C(=O)c2ccc(Cl)c(Cl)c2)C1	ZINC001033604933	1341895129	/nfs/dbraw/zinc/89/51/29/1341895129.db2.gz	AKROSEYCHZDUDH-ZDUSSCGKSA-N	0	3	325.239	3.163	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N(C)[C@@H]1CCN(Cc2ccc(C)cc2)C1	ZINC001033615886	1341903961	/nfs/dbraw/zinc/90/39/61/1341903961.db2.gz	CPSVTYKBCIQEEK-JOCHJYFZSA-N	0	3	346.474	3.252	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC001033830569	1342031156	/nfs/dbraw/zinc/03/11/56/1342031156.db2.gz	KNWGWYKLCXBFKS-AWEZNQCLSA-N	0	3	338.373	3.323	20	30		EGEDHN
C=CCCN1CC[C@H](N(CC)C(=O)c2sc(Cl)nc2C)C1	ZINC001033846029	1342041860	/nfs/dbraw/zinc/04/18/60/1342041860.db2.gz	KFHQJUZXRKAJHA-LBPRGKRZSA-N	0	3	327.881	3.217	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@H]2CCc3ccc(OC)cc32)C1	ZINC001033860649	1342048921	/nfs/dbraw/zinc/04/89/21/1342048921.db2.gz	GLRKMVHOBUWZGM-MJGOQNOKSA-N	0	3	342.483	3.224	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2cn(CC)c3ccccc23)C1	ZINC001033890720	1342063651	/nfs/dbraw/zinc/06/36/51/1342063651.db2.gz	SAAALCRIMCWTMA-QGZVFWFLSA-N	0	3	337.467	3.221	20	30		EGEDHN
C#Cc1cncc(C(=O)N(CC)[C@@H]2CCN(Cc3ccc(C)cc3)C2)c1	ZINC001033946594	1342106756	/nfs/dbraw/zinc/10/67/56/1342106756.db2.gz	ICOVDIBINKAMBC-OAQYLSRUSA-N	0	3	347.462	3.108	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2cc(C(C)(C)C)oc2C)C1	ZINC001033969734	1342120455	/nfs/dbraw/zinc/12/04/55/1342120455.db2.gz	YKJQIMKZAAVYQO-INIZCTEOSA-N	0	3	330.472	3.445	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cccc(N3CC=CC3)c2)C1	ZINC001033972437	1342122859	/nfs/dbraw/zinc/12/28/59/1342122859.db2.gz	QRVOQQMIXADUJG-FQEVSTJZSA-N	0	3	339.483	3.175	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)[C@@H]2C[C@H]2c2ccc(C)s2)C1	ZINC001033985219	1342130402	/nfs/dbraw/zinc/13/04/02/1342130402.db2.gz	KAQCCRRXNKZRKL-GVDBMIGSSA-N	0	3	330.497	3.106	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccnc(C(F)(F)F)c2)C1	ZINC001034007288	1342144423	/nfs/dbraw/zinc/14/44/23/1342144423.db2.gz	KGZAFWNLWHBVAK-CQSZACIVSA-N	0	3	341.377	3.213	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cnn(CCC(C)C)c2C)C1	ZINC001034010633	1342147893	/nfs/dbraw/zinc/14/78/93/1342147893.db2.gz	AZZYNJYFIRLESW-GOSISDBHSA-N	0	3	346.519	3.350	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2ccc(CC(C)C)cc2)C1	ZINC001034040419	1342180326	/nfs/dbraw/zinc/18/03/26/1342180326.db2.gz	VJLANBHYCNJGNK-HXUWFJFHSA-N	0	3	326.484	3.445	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@H]2Cc3cc(C)c(C)cc3O2)C1	ZINC001034047767	1342186896	/nfs/dbraw/zinc/18/68/96/1342186896.db2.gz	KHXKKQMKTWNSMJ-AZUAARDMSA-N	0	3	342.483	3.106	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2cncc(-c3ccccc3)c2)C1	ZINC001034239761	1342340692	/nfs/dbraw/zinc/34/06/92/1342340692.db2.gz	MILLIGYTHGLWJZ-OAQYLSRUSA-N	0	3	347.462	3.356	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc3c(c2)OCCCO3)C1	ZINC001034247972	1342345710	/nfs/dbraw/zinc/34/57/10/1342345710.db2.gz	VPHQEKBAEDECQT-KRWDZBQOSA-N	0	3	344.455	3.008	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)c2cc3c([nH]2)c(F)ccc3C)C1	ZINC001034285598	1342373285	/nfs/dbraw/zinc/37/32/85/1342373285.db2.gz	SWINOAWPLLHESW-AWEZNQCLSA-N	0	3	329.419	3.386	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@@H]2CCc3cc(F)ccc32)C1	ZINC001034312640	1342393760	/nfs/dbraw/zinc/39/37/60/1342393760.db2.gz	RAJMNNBBMVFCGG-IEBWSBKVSA-N	0	3	330.447	3.402	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2c[nH]nc2-c2ccccc2)C1	ZINC001034330789	1342405105	/nfs/dbraw/zinc/40/51/05/1342405105.db2.gz	RXFTZUBXLJYXMZ-KRWDZBQOSA-N	0	3	338.455	3.237	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@H]2CCCc3cccnc32)C1	ZINC001034366488	1342436740	/nfs/dbraw/zinc/43/67/40/1342436740.db2.gz	AITKSPRHHFFJGD-MSOLQXFVSA-N	0	3	327.472	3.048	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N[C@H]1CCCCN(Cc2csc(C)c2)C1	ZINC001034409262	1342471704	/nfs/dbraw/zinc/47/17/04/1342471704.db2.gz	QKQMLMDJCSQEAA-KSZLIROESA-N	0	3	348.512	3.118	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2c(F)cc(OC)cc2F)C1	ZINC001034415549	1342477364	/nfs/dbraw/zinc/47/73/64/1342477364.db2.gz	WDZFGBHCHQBVKQ-CYBMUJFWSA-N	0	3	338.398	3.134	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2ncoc2-c2cccs2)C1	ZINC001034447741	1342508169	/nfs/dbraw/zinc/50/81/69/1342508169.db2.gz	KOFFOLUEXDPXFH-CQSZACIVSA-N	0	3	343.452	3.011	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc3ccn(C)c3c2)C1	ZINC001034471134	1342525966	/nfs/dbraw/zinc/52/59/66/1342525966.db2.gz	FBFHENUEYSKJRE-GOSISDBHSA-N	0	3	325.456	3.339	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cc3c(C)cccn3c2)C1	ZINC001034488538	1342546506	/nfs/dbraw/zinc/54/65/06/1342546506.db2.gz	XKSGMESXQZQSRN-SFHVURJKSA-N	0	3	325.456	3.408	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc(COC)c(F)c2)C1	ZINC001034499026	1342556704	/nfs/dbraw/zinc/55/67/04/1342556704.db2.gz	AJBFXVVIRKHMIZ-KRWDZBQOSA-N	0	3	334.435	3.133	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2cc3c(s2)CCCC3)C1	ZINC001034514888	1342573078	/nfs/dbraw/zinc/57/30/78/1342573078.db2.gz	NWPQAYWPSKPRLR-INIZCTEOSA-N	0	3	330.497	3.235	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)c2cc3ccccc3n2CC)C1	ZINC001034540909	1342599658	/nfs/dbraw/zinc/59/96/58/1342599658.db2.gz	LQHHSNRKWLFJDC-QGZVFWFLSA-N	0	3	325.456	3.432	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)C2(F)CCCC2)CC1	ZINC001034675407	1342686102	/nfs/dbraw/zinc/68/61/02/1342686102.db2.gz	FXPIWALRMAGZRY-JOCQHMNTSA-N	0	3	347.272	3.194	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)c2cc(C)co2)CC1	ZINC001034712600	1342708717	/nfs/dbraw/zinc/70/87/17/1342708717.db2.gz	UFNJLHZARCTTKU-JOCQHMNTSA-N	0	3	341.249	3.127	20	30		EGEDHN
C[C@@H]1C[C@@H]1CC(=O)N[C@H]1CC[C@H](NCc2cc(F)ccc2C#N)CC1	ZINC001034724411	1342718153	/nfs/dbraw/zinc/71/81/53/1342718153.db2.gz	MABZYDYDRWZUIK-SVYNMNNPSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)[C@H]2C[C@]2(C)CC)CC1	ZINC001034765688	1342745145	/nfs/dbraw/zinc/74/51/45/1342745145.db2.gz	GWJHLFNYEYGNDN-KQTLUZQSSA-N	0	3	343.309	3.348	20	30		EGEDHN
CC(C)(C)C(=O)N[C@H]1CC[C@H](NCc2cc(F)ccc2C#N)CC1	ZINC001034782729	1342758192	/nfs/dbraw/zinc/75/81/92/1342758192.db2.gz	QGFANVFMUQNRNU-QAQDUYKDSA-N	0	3	331.435	3.260	20	30		EGEDHN
CC1(C)CC(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)cc2F)C1	ZINC001034926098	1342839267	/nfs/dbraw/zinc/83/92/67/1342839267.db2.gz	UFFGTPAOFXWYLB-QGZVFWFLSA-N	0	3	343.446	3.214	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)C[C@@H]2CC=CCC2)s1	ZINC001035014677	1342876937	/nfs/dbraw/zinc/87/69/37/1342876937.db2.gz	RSJQLCFACZQALX-HZPDHXFCSA-N	0	3	343.496	3.447	20	30		EGEDHN
CCC(C)(C)C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)c(F)c1	ZINC001035032541	1342887612	/nfs/dbraw/zinc/88/76/12/1342887612.db2.gz	AQXLKMHAZKRROU-MRXNPFEDSA-N	0	3	331.435	3.214	20	30		EGEDHN
CCC(=O)N1CCC2(CCN(CC#Cc3ccc(Cl)cc3)C2)CC1	ZINC001035146729	1342959221	/nfs/dbraw/zinc/95/92/21/1342959221.db2.gz	MFLXHDDDRNHIJS-UHFFFAOYSA-N	0	3	344.886	3.416	20	30		EGEDHN
CC(C)(C)C(=O)N1CCC2(CCN(Cc3ccccc3C#N)C2)CC1	ZINC001035249063	1343072791	/nfs/dbraw/zinc/07/27/91/1343072791.db2.gz	GUBUTCZYEKHZBO-UHFFFAOYSA-N	0	3	339.483	3.419	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC2(CN(Cc3ccc4ccccc4c3)C2)CC1	ZINC001035668526	1343129024	/nfs/dbraw/zinc/12/90/24/1343129024.db2.gz	HPFSNTOOPCOIMG-KRWDZBQOSA-N	0	3	347.462	3.424	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cccc(OCCC)c1)CC2	ZINC001035715620	1343149038	/nfs/dbraw/zinc/14/90/38/1343149038.db2.gz	MKCIQTAPWWXUAJ-UHFFFAOYSA-N	0	3	340.467	3.037	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C[C@@H]1CCC(C)(C)CO1)CC2	ZINC001035752305	1343171107	/nfs/dbraw/zinc/17/11/07/1343171107.db2.gz	FYCNQOMXGZUEMH-KRWDZBQOSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc(Cl)c(Cl)[nH]1)CC2	ZINC001035762817	1343176003	/nfs/dbraw/zinc/17/60/03/1343176003.db2.gz	FQYMAXOWGHSWEN-UHFFFAOYSA-N	0	3	342.270	3.436	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1csc3ccccc13)CC2	ZINC001035763654	1343176305	/nfs/dbraw/zinc/17/63/05/1343176305.db2.gz	LVYFOIHKUFAHSM-UHFFFAOYSA-N	0	3	338.476	3.463	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@@H]1C[C@H]1c1ccc(C)s1)CC2	ZINC001035813844	1343212419	/nfs/dbraw/zinc/21/24/19/1343212419.db2.gz	JRIVHNAKQURBCN-IAGOWNOFSA-N	0	3	342.508	3.108	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cccn1C1CCCC1)CC2	ZINC001035829761	1343218219	/nfs/dbraw/zinc/21/82/19/1343218219.db2.gz	VOKOYQIXPZXNGY-UHFFFAOYSA-N	0	3	339.483	3.165	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C[C@H]1CCO[C@@H](CC)C1)CC2	ZINC001035832663	1343220210	/nfs/dbraw/zinc/22/02/10/1343220210.db2.gz	NTOZVELVYQSGEP-ROUUACIJSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H](C)Oc1ccc(F)cc1)CC2	ZINC001035849619	1343229528	/nfs/dbraw/zinc/22/95/28/1343229528.db2.gz	FVGRJHCTPIQKAU-MRXNPFEDSA-N	0	3	346.446	3.094	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1csc(C3CC3)n1)CC2	ZINC001035860609	1343236391	/nfs/dbraw/zinc/23/63/91/1343236391.db2.gz	AGQNRMYSFVMFOI-UHFFFAOYSA-N	0	3	331.485	3.135	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@H](NCc2ccccc2C#N)[C@@H](C)C1	ZINC001035918867	1343272499	/nfs/dbraw/zinc/27/24/99/1343272499.db2.gz	KIMSDBTVOIMIKR-KXBFYZLASA-N	0	3	327.472	3.321	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@H](NCc2ccccc2C#N)[C@@H](C)C1	ZINC001036175680	1343347405	/nfs/dbraw/zinc/34/74/05/1343347405.db2.gz	SOPLVKQIYGGVJG-YJBOKZPZSA-N	0	3	327.472	3.321	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3nc(C)oc3C)[C@H](C)C2)CC1	ZINC001036176071	1343347493	/nfs/dbraw/zinc/34/74/93/1343347493.db2.gz	VOSHVKBXCSKXST-RDTXWAMCSA-N	0	3	345.487	3.364	20	30		EGEDHN
CCC1(C(=O)N2CC[C@H](NCc3ccccc3C#N)[C@H](C)C2)CC1	ZINC001036189375	1343353647	/nfs/dbraw/zinc/35/36/47/1343353647.db2.gz	YHQUHDUGURUBCR-QAPCUYQASA-N	0	3	325.456	3.075	20	30		EGEDHN
CCCC(=O)N1CCC[C@H]([C@@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001036337032	1343422066	/nfs/dbraw/zinc/42/20/66/1343422066.db2.gz	WYTFPSXBLOPBDO-ZBFHGGJFSA-N	0	3	331.435	3.214	20	30		EGEDHN
C[C@H](NCc1cc(F)ccc1C#N)[C@H]1CCCN(C(=O)C2(C)CC2)C1	ZINC001036408389	1343469301	/nfs/dbraw/zinc/46/93/01/1343469301.db2.gz	IMIGKEMFFHYRAP-HOCLYGCPSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@@H](NCc1cc(F)ccc1C#N)[C@@H]1CCCN(C(=O)C(C)(C)C)C1	ZINC001036464623	1343500382	/nfs/dbraw/zinc/50/03/82/1343500382.db2.gz	KQHXYOGWOAIPHO-GDBMZVCRSA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCCN(C(=O)C(C)(C)C)C1	ZINC001036466039	1343500736	/nfs/dbraw/zinc/50/07/36/1343500736.db2.gz	PEBYKBSFPYIKKT-CRAIPNDOSA-N	0	3	327.472	3.321	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@H]2[C@H](CCN2Cc2ccc(F)c(C#N)c2)C1	ZINC001036628199	1343585633	/nfs/dbraw/zinc/58/56/33/1343585633.db2.gz	XQVVAEROHCHJQR-APWZRJJASA-N	0	3	343.446	3.166	20	30		EGEDHN
CC(C)(C)CC(=O)N1CC[C@H]2[C@H](CCN2CC#Cc2ccccc2)C1	ZINC001036639792	1343594982	/nfs/dbraw/zinc/59/49/82/1343594982.db2.gz	BANWNHGFGJOGBD-UXHICEINSA-N	0	3	338.495	3.397	20	30		EGEDHN
O=C(CC1CCC1)N1CC[C@@H]2[C@H](CCN2CC#Cc2ccccc2)C1	ZINC001036677664	1343618010	/nfs/dbraw/zinc/61/80/10/1343618010.db2.gz	FOTHNISOSFCLPC-NHCUHLMSSA-N	0	3	336.479	3.151	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@H]2[C@@H](CCN2Cc2cccc(Cl)c2)C1	ZINC001036713811	1343646752	/nfs/dbraw/zinc/64/67/52/1343646752.db2.gz	OSOBBSKZWLXASW-HKUYNNGSSA-N	0	3	342.870	3.176	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2[C@@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001036791682	1343722061	/nfs/dbraw/zinc/72/20/61/1343722061.db2.gz	CKEFXFAAGFKBKX-YOEHRIQHSA-N	0	3	343.496	3.255	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2cnc(C)s2)C1	ZINC001036792463	1343724095	/nfs/dbraw/zinc/72/40/95/1343724095.db2.gz	PPKINKCEWWTPIX-DOTOQJQBSA-N	0	3	347.528	3.477	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H]3[C@H](CCN3Cc3cnc(C)o3)C2)CC1	ZINC001036811937	1343746917	/nfs/dbraw/zinc/74/69/17/1343746917.db2.gz	YZTWGEPWJBTIIJ-MJGOQNOKSA-N	0	3	343.471	3.152	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H]3[C@H](CCN3Cc3ocnc3C)C2)CC1	ZINC001036811579	1343747073	/nfs/dbraw/zinc/74/70/73/1343747073.db2.gz	SPXYSWDHDVPOFK-MSOLQXFVSA-N	0	3	343.471	3.152	20	30		EGEDHN
CC1(C(=O)N2CC[C@@H]3[C@H](CCN3Cc3ccccc3C#N)C2)CC=CC1	ZINC001036812818	1343748998	/nfs/dbraw/zinc/74/89/98/1343748998.db2.gz	MTWSHAXWNHBVAW-WOJBJXKFSA-N	0	3	349.478	3.337	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCC[C@@H]2CNCc2cc(C3CC3)no2)C1	ZINC001037075556	1343968381	/nfs/dbraw/zinc/96/83/81/1343968381.db2.gz	RGOMJSHIKRTTCL-NVXWUHKLSA-N	0	3	343.471	3.283	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCC[C@H]1NC(=O)C1CCC1	ZINC001037138493	1343988074	/nfs/dbraw/zinc/98/80/74/1343988074.db2.gz	KVDDEVHTGUGMOE-RBUKOAKNSA-N	0	3	325.456	3.123	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCC[C@@H]1NC(=O)c1ccoc1	ZINC001037147370	1343997750	/nfs/dbraw/zinc/99/77/50/1343997750.db2.gz	DZSUZFFIKBUAGR-HKUYNNGSSA-N	0	3	337.423	3.230	20	30		EGEDHN
CC(C)(F)C(=O)N[C@H]1CCCC[C@H]1CNCc1cc(F)ccc1C#N	ZINC001037155432	1344006871	/nfs/dbraw/zinc/00/68/71/1344006871.db2.gz	IQTFSEQKPIXJHZ-YOEHRIQHSA-N	0	3	349.425	3.210	20	30		EGEDHN
CC[C@@H]1CN(C(=O)CC2CC2)CC[C@H]1NCc1cc(F)ccc1C#N	ZINC001037756905	1344073188	/nfs/dbraw/zinc/07/31/88/1344073188.db2.gz	FTUZDONDPPMXLO-DNVCBOLYSA-N	0	3	343.446	3.214	20	30		EGEDHN
CCCC(=O)N1CC[C@@H](NCc2cc(F)ccc2C#N)[C@@H](CC)C1	ZINC001037762515	1344076574	/nfs/dbraw/zinc/07/65/74/1344076574.db2.gz	ACNLRTWTYZAKEF-KBXCAEBGSA-N	0	3	331.435	3.214	20	30		EGEDHN
N#Cc1cc(C(=O)NC[C@H]2CCN2CCC2CCCCCC2)c[nH]1	ZINC001038175220	1344311377	/nfs/dbraw/zinc/31/13/77/1344311377.db2.gz	MZSKCECHIWEZAF-GOSISDBHSA-N	0	3	328.460	3.051	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@H]2CCN2CC2CC(C)(C)C2)cc1	ZINC001038427138	1344423056	/nfs/dbraw/zinc/42/30/56/1344423056.db2.gz	DXPAZJUBKISPQL-GOSISDBHSA-N	0	3	342.483	3.492	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@@H]2CCN2CC2CC(C)C2)cc1	ZINC001038429165	1344424875	/nfs/dbraw/zinc/42/48/75/1344424875.db2.gz	WSDZRJJCPPNIHC-HTWSVDAQSA-N	0	3	328.456	3.102	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1nsc2ccc(C)cc21	ZINC001038585833	1344495530	/nfs/dbraw/zinc/49/55/30/1344495530.db2.gz	LXGCDOIELLEQGH-CQSZACIVSA-N	0	3	329.469	3.375	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C(C)(C)C2CC2)CC[C@H]1c1ccc(F)cc1	ZINC001079156937	1357197710	/nfs/dbraw/zinc/19/77/10/1357197710.db2.gz	PGVMFLWIHWXEDK-RBUKOAKNSA-N	0	3	342.458	3.169	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC([C@@H]2CCN(Cc3nocc3C)C2)CC1	ZINC001039148914	1344831456	/nfs/dbraw/zinc/83/14/56/1344831456.db2.gz	ADNYZZYDMDUVOR-QGZVFWFLSA-N	0	3	345.487	3.256	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)[C@H](F)C(C)C)CC2)C1	ZINC001039150919	1344834403	/nfs/dbraw/zinc/83/44/03/1344834403.db2.gz	CXWZGPLEPIOFNB-JKSUJKDBSA-N	0	3	330.875	3.294	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccc(Cl)o2)C1	ZINC001039193472	1344899338	/nfs/dbraw/zinc/89/93/38/1344899338.db2.gz	NRVLHDRAUIFPNI-LSDHHAIUSA-N	0	3	334.847	3.273	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)Cc2ccsc2)C1	ZINC001039206197	1344917099	/nfs/dbraw/zinc/91/70/99/1344917099.db2.gz	GMIOOIOQKGWSRF-ROUUACIJSA-N	0	3	330.497	3.017	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccc3occc3c2)C1	ZINC001039209240	1344921751	/nfs/dbraw/zinc/92/17/51/1344921751.db2.gz	IQPWETUUCSCZNO-OALUTQOASA-N	0	3	336.435	3.383	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2sc(C)cc2C)C1	ZINC001039208908	1344921963	/nfs/dbraw/zinc/92/19/63/1344921963.db2.gz	GLNHKNTUBMDQQN-IAGOWNOFSA-N	0	3	330.497	3.315	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cccc(C)c2F)C1	ZINC001039210210	1344923635	/nfs/dbraw/zinc/92/36/35/1344923635.db2.gz	OPTCMDFSOHGJRZ-PKOBYXMFSA-N	0	3	342.458	3.474	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)CC2CC(F)(F)C2)C1	ZINC001039211975	1344926774	/nfs/dbraw/zinc/92/67/74/1344926774.db2.gz	HRNIJMMXVDNUEG-DLBZAZTESA-N	0	3	338.442	3.148	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(CC)o2)C1	ZINC001039215689	1344932422	/nfs/dbraw/zinc/93/24/22/1344932422.db2.gz	YFKQQJFFVNXQTI-AEFFLSMTSA-N	0	3	328.456	3.182	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)C2CCC3(CC3)CC2)C1	ZINC001039217104	1344933777	/nfs/dbraw/zinc/93/37/77/1344933777.db2.gz	SMBAVSJWBYOJCB-OALUTQOASA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc(C)sc2C)C1	ZINC001039219953	1344937878	/nfs/dbraw/zinc/93/78/78/1344937878.db2.gz	WNFAJAPJPJTQFW-WMZOPIPTSA-N	0	3	330.497	3.315	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)Cc2cccc(C)c2)C1	ZINC001039225703	1344944402	/nfs/dbraw/zinc/94/44/02/1344944402.db2.gz	QMQCPQWMTZBXLI-RTWAWAEBSA-N	0	3	338.495	3.264	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cccc3ncccc32)C1	ZINC001039226900	1344945523	/nfs/dbraw/zinc/94/55/23/1344945523.db2.gz	ZRXAGGIISVXPLL-LAUBAEHRSA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2csc(C)c2)C1	ZINC001039232232	1344952428	/nfs/dbraw/zinc/95/24/28/1344952428.db2.gz	URZLRMYTDPYUEM-SJLPKXTDSA-N	0	3	330.497	3.396	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccc3cc[nH]c3c2)C1	ZINC001039236477	1344958035	/nfs/dbraw/zinc/95/80/35/1344958035.db2.gz	CQQWCSKDXZHSHU-ICSRJNTNSA-N	0	3	335.451	3.118	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)Cc2ccc(CC)cc2)C1	ZINC001039236377	1344958256	/nfs/dbraw/zinc/95/82/56/1344958256.db2.gz	BCACOYGQISAHBO-NHCUHLMSSA-N	0	3	338.495	3.128	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(C)ccc2F)C1	ZINC001039238787	1344963309	/nfs/dbraw/zinc/96/33/09/1344963309.db2.gz	PJYYKFPWACRPOC-APWZRJJASA-N	0	3	328.431	3.084	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(C)cc2F)C1	ZINC001039240521	1344965854	/nfs/dbraw/zinc/96/58/54/1344965854.db2.gz	XMLRIAQRJHUFBG-VQIMIIECSA-N	0	3	328.431	3.084	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)C2CCC=CCC2)C1	ZINC001039241678	1344967086	/nfs/dbraw/zinc/96/70/86/1344967086.db2.gz	GNJAFLGTGWFONA-PMACEKPBSA-N	0	3	328.500	3.459	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cccc3c2CCC3)C1	ZINC001039241424	1344967134	/nfs/dbraw/zinc/96/71/34/1344967134.db2.gz	AWXXYIYXYZDLIV-RXVVDRJESA-N	0	3	336.479	3.125	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cncc3ccccc32)C1	ZINC001039242019	1344967794	/nfs/dbraw/zinc/96/77/94/1344967794.db2.gz	MTQUAZRNFVXTEY-NQIIRXRSSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc3cccnc3c2)C1	ZINC001039248131	1344978096	/nfs/dbraw/zinc/97/80/96/1344978096.db2.gz	RFZXSVCDSOEGSX-CTNGQTDRSA-N	0	3	347.462	3.185	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(C(C)C)nn1CC	ZINC001039400003	1345046248	/nfs/dbraw/zinc/04/62/48/1345046248.db2.gz	GIQPPCOBAJPECW-SJORKVTESA-N	0	3	344.503	3.281	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccnc1C1CC1	ZINC001039399174	1345046514	/nfs/dbraw/zinc/04/65/14/1345046514.db2.gz	KVDMIZOIAZTAFM-SJORKVTESA-N	0	3	325.456	3.214	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2c(c1)[C@H](C)CO2	ZINC001039421342	1345059942	/nfs/dbraw/zinc/05/99/42/1345059942.db2.gz	AVOGXVAOTZWCBO-NXHRZFHOSA-N	0	3	340.467	3.438	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(F)c(COC)c1	ZINC001039433092	1345065575	/nfs/dbraw/zinc/06/55/75/1345065575.db2.gz	UHLBTWHJZMAEFX-MSOLQXFVSA-N	0	3	346.446	3.227	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccn(C(CC)CC)n1	ZINC001039447796	1345072492	/nfs/dbraw/zinc/07/24/92/1345072492.db2.gz	KGGFZPLIYPAIGY-MSOLQXFVSA-N	0	3	344.503	3.499	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccccc1OC(C)C	ZINC001039451406	1345074823	/nfs/dbraw/zinc/07/48/23/1345074823.db2.gz	VTKQDTVOHWPMNW-MOPGFXCFSA-N	0	3	342.483	3.268	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)c1cc(C)oc1C	ZINC001039453466	1345075966	/nfs/dbraw/zinc/07/59/66/1345075966.db2.gz	DLZPMKMYUWXRKL-NXHRZFHOSA-N	0	3	328.456	3.089	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc2sccc2[nH]1	ZINC001039457843	1345077237	/nfs/dbraw/zinc/07/72/37/1345077237.db2.gz	QKZNSJKXGMAVGM-KGLIPLIRSA-N	0	3	329.469	3.484	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)c1ccc(C)s1	ZINC001039459669	1345078919	/nfs/dbraw/zinc/07/89/19/1345078919.db2.gz	HTOVEHROGGESQH-ZACQAIPSSA-N	0	3	330.497	3.249	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)COc1c(C)cccc1C	ZINC001039465851	1345083685	/nfs/dbraw/zinc/08/36/85/1345083685.db2.gz	DATKUDSRHQHZEW-MOPGFXCFSA-N	0	3	342.483	3.324	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)Cc1cccc(F)c1	ZINC001039476465	1345091540	/nfs/dbraw/zinc/09/15/40/1345091540.db2.gz	VBRICFDOZCPXPM-DBVUQKKJSA-N	0	3	342.458	3.093	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC1CCOCC1	ZINC001039822877	1345199896	/nfs/dbraw/zinc/19/98/96/1345199896.db2.gz	KBYAKXYMPCKKDD-HDICACEKSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3ccnc4ccccc43)C2)C1	ZINC001040284607	1345412371	/nfs/dbraw/zinc/41/23/71/1345412371.db2.gz	WMBJKHJKMUIIEG-NRFANRHFSA-N	0	3	335.451	3.349	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3coc(C(F)F)c3)C2)C1	ZINC001040354448	1345450698	/nfs/dbraw/zinc/45/06/98/1345450698.db2.gz	PLGGJEODIRHQBA-GOSISDBHSA-N	0	3	336.382	3.169	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@@H](CC)Cc3ccccc3)C2)C1	ZINC001040431559	1345494404	/nfs/dbraw/zinc/49/44/04/1345494404.db2.gz	PPMGQSXRWLPPIQ-UNMCSNQZSA-N	0	3	338.495	3.203	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(C(F)F)cc3)C2)C1	ZINC001040446075	1345504156	/nfs/dbraw/zinc/50/41/56/1345504156.db2.gz	IQUJFYPVFBANBF-LJQANCHMSA-N	0	3	332.394	3.186	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3coc(C4CCC4)n3)C2)C1	ZINC001040485179	1345515890	/nfs/dbraw/zinc/51/58/90/1345515890.db2.gz	XLBVDPNZNLTTAG-LJQANCHMSA-N	0	3	329.444	3.056	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3oc(CCC)nc3C)C2)C1	ZINC001040496530	1345520298	/nfs/dbraw/zinc/52/02/98/1345520298.db2.gz	JIKJWNNDDYQECA-IBGZPJMESA-N	0	3	331.460	3.050	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)C(C)(C)c3ccc(F)cc3)C2)C1	ZINC001040498008	1345521091	/nfs/dbraw/zinc/52/10/91/1345521091.db2.gz	XJUHFYYLIGPESJ-NRFANRHFSA-N	0	3	342.458	3.051	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)C3CCC(C(F)F)CC3)C2)C1	ZINC001040513018	1345527406	/nfs/dbraw/zinc/52/74/06/1345527406.db2.gz	KIANMRXRPIXSTL-LADRWXRNSA-N	0	3	338.442	3.006	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ccccc3OCC)C2)C1	ZINC001040515220	1345528186	/nfs/dbraw/zinc/52/81/86/1345528186.db2.gz	HRYZACUJGFDKPT-OAQYLSRUSA-N	0	3	340.467	3.037	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)C3CC(c4ccccc4)C3)C2)C1	ZINC001040551982	1345543446	/nfs/dbraw/zinc/54/34/46/1345543446.db2.gz	UIXUBDUQLXWSDI-AOMIVXANSA-N	0	3	336.479	3.128	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CCN(C(=O)c4ccoc4)C3)CC2)c1	ZINC001040607006	1345554612	/nfs/dbraw/zinc/55/46/12/1345554612.db2.gz	PWLYSWAQICUGDF-UHFFFAOYSA-N	0	3	349.434	3.280	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)C[C@@H]3C[C@H]3c3ccccc3)C2)CC1	ZINC001040703358	1345567854	/nfs/dbraw/zinc/56/78/54/1345567854.db2.gz	BSEQLBHDEKJXFG-PMACEKPBSA-N	0	3	336.479	3.128	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccc(C)c(Cl)c3F)C2)CC1	ZINC001040787691	1345578075	/nfs/dbraw/zinc/57/80/75/1345578075.db2.gz	SLNIUPMZTUBNRS-UHFFFAOYSA-N	0	3	348.849	3.349	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@H]3C[C@@H]3c3ccccc3)C2)CC1	ZINC001040875537	1345592521	/nfs/dbraw/zinc/59/25/21/1345592521.db2.gz	BJAUOBOHBKLXBD-UXHICEINSA-N	0	3	336.479	3.128	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)CCc3ccccc3F)C2)CC1	ZINC001040936576	1345605213	/nfs/dbraw/zinc/60/52/13/1345605213.db2.gz	MOTGJFCNHTXXPU-UHFFFAOYSA-N	0	3	342.458	3.096	20	30		EGEDHN
C[C@@H](c1cccc(F)c1)N1CC[C@]2(CCN(C(=O)C#CC3CC3)C2)C1	ZINC001041266711	1345690576	/nfs/dbraw/zinc/69/05/76/1345690576.db2.gz	VGOKSWZBBNHHRE-KKSFZXQISA-N	0	3	340.442	3.225	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3cc4sccc4s3)C2)C1	ZINC001041407461	1345719942	/nfs/dbraw/zinc/71/99/42/1345719942.db2.gz	HNVARRYJFDXROX-KRWDZBQOSA-N	0	3	330.478	3.134	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)Cc3cccc(C(C)C)c3)C2)C1	ZINC001041441445	1345728278	/nfs/dbraw/zinc/72/82/78/1345728278.db2.gz	YSGSBUWIJYSWFA-JOCHJYFZSA-N	0	3	338.495	3.300	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccc4cc(C)ccc4n3)C2)C1	ZINC001041460299	1345734488	/nfs/dbraw/zinc/73/44/88/1345734488.db2.gz	DBOAWKGXWJYLTP-JOCHJYFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)CCc3cccc(Cl)c3)C2)C1	ZINC001041514036	1345749385	/nfs/dbraw/zinc/74/93/85/1345749385.db2.gz	CQHFTEORJRJPNR-FQEVSTJZSA-N	0	3	344.886	3.220	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cc4cc(C)ccc4[nH]3)C2)C1	ZINC001041528896	1345752881	/nfs/dbraw/zinc/75/28/81/1345752881.db2.gz	ZQEVUHKSLNASPG-NRFANRHFSA-N	0	3	335.451	3.038	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@]2(CCN(Cc3cccc(F)c3)C2)C1	ZINC001041541155	1345756473	/nfs/dbraw/zinc/75/64/73/1345756473.db2.gz	TZHZOYUYIZPVBY-FQEVSTJZSA-N	0	3	330.447	3.462	20	30		EGEDHN
C[C@@]1(C(=O)N2CC[C@]3(CCN(Cc4cccc(C#N)c4)C3)C2)C=CCC1	ZINC001041557050	1345766986	/nfs/dbraw/zinc/76/69/86/1345766986.db2.gz	CUDFNGLAUNDKHZ-YADHBBJMSA-N	0	3	349.478	3.339	20	30		EGEDHN
CC1(C(=O)N2CC[C@@]3(CCN(Cc4ccc(C#N)cc4)C3)C2)CCC1	ZINC001041557322	1345767846	/nfs/dbraw/zinc/76/78/46/1345767846.db2.gz	VJVGCJFWPZQFKL-OAQYLSRUSA-N	0	3	337.467	3.173	20	30		EGEDHN
Cc1coc(C(=O)N2CC[C@@]3(CCN(Cc4ccc(C#N)cc4)C3)C2)c1	ZINC001041581669	1345781018	/nfs/dbraw/zinc/78/10/18/1345781018.db2.gz	LBTQFHKKRSQBKF-OAQYLSRUSA-N	0	3	349.434	3.198	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)[C@H](C)c3ccc(Cl)cc3)C2)C1	ZINC001041629577	1345802074	/nfs/dbraw/zinc/80/20/74/1345802074.db2.gz	BMMCBQJVEZNWHO-UZLBHIALSA-N	0	3	344.886	3.391	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)[C@H](C)c3ccc(Cl)cc3)C2)C1	ZINC001041633860	1345803986	/nfs/dbraw/zinc/80/39/86/1345803986.db2.gz	ZSHNSNGXKSZONM-BEFAXECRSA-N	0	3	330.859	3.001	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)C[C@H]3CCCc4ccccc43)C2)C1	ZINC001041798517	1345854383	/nfs/dbraw/zinc/85/43/83/1345854383.db2.gz	YHHSMFCLECSMPX-DENIHFKCSA-N	0	3	336.479	3.054	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3ccc(Cl)c(Cl)c3)C2)C1	ZINC001041800936	1345855295	/nfs/dbraw/zinc/85/52/95/1345855295.db2.gz	BTOFFLWSOZYTJV-KRWDZBQOSA-N	0	3	337.250	3.165	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3cc4cc(F)ccc4s3)C2)C1	ZINC001041822826	1345863874	/nfs/dbraw/zinc/86/38/74/1345863874.db2.gz	SXCZITBIZSLLRU-IBGZPJMESA-N	0	3	342.439	3.212	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3coc4cc(F)ccc34)C[C@H]21	ZINC001042124250	1345950165	/nfs/dbraw/zinc/95/01/65/1345950165.db2.gz	DKLBLKBJETVHCT-CXAGYDPISA-N	0	3	328.387	3.294	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3cc4ccccc4s3)C[C@H]21	ZINC001042142887	1345955447	/nfs/dbraw/zinc/95/54/47/1345955447.db2.gz	PFIORFWOYNGLKI-NVXWUHKLSA-N	0	3	338.476	3.461	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3cccnc3C(F)F)C[C@@H]21	ZINC001042146476	1345956724	/nfs/dbraw/zinc/95/67/24/1345956724.db2.gz	QBCUZKXYPYMUGV-HIFRSBDPSA-N	0	3	335.398	3.132	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc(C)c4cccnc34)C[C@H]21	ZINC001042154860	1345957789	/nfs/dbraw/zinc/95/77/89/1345957789.db2.gz	GHEMGIYIYLWZNS-FXAWDEMLSA-N	0	3	347.462	3.103	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3cccc(OC)c3)[C@H]2C1	ZINC001042184463	1345972306	/nfs/dbraw/zinc/97/23/06/1345972306.db2.gz	WSTGLFBCVFNBSH-HKUYNNGSSA-N	0	3	342.483	3.330	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cnc4ccsc4c3)C[C@@H]21	ZINC001042189045	1345975647	/nfs/dbraw/zinc/97/56/47/1345975647.db2.gz	ZSCFSSQTRNKREM-BBRMVZONSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3csc(-c4ccco4)n3)C[C@H]21	ZINC001042206655	1345985113	/nfs/dbraw/zinc/98/51/13/1345985113.db2.gz	HVSQRHXVFUKYDQ-UKRRQHHQSA-N	0	3	343.452	3.126	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc(Cl)cc3C)C[C@@H]21	ZINC001042216701	1345990042	/nfs/dbraw/zinc/99/00/42/1345990042.db2.gz	QTLRCKOXKDIPSM-YJBOKZPZSA-N	0	3	330.859	3.208	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C3(Cc4ccc(F)cc4)CC3)C[C@H]21	ZINC001042262077	1346010099	/nfs/dbraw/zinc/01/00/99/1346010099.db2.gz	FKTGKIBZSZSWCD-PKOBYXMFSA-N	0	3	342.458	3.257	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)Cc3csc(C(C)(C)C)n3)C[C@H]21	ZINC001042265193	1346010863	/nfs/dbraw/zinc/01/08/63/1346010863.db2.gz	DEDFHCFSOGNVTG-GDBMZVCRSA-N	0	3	347.528	3.092	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(-c4ccccc4)nc3)C[C@@H]21	ZINC001042282506	1346015784	/nfs/dbraw/zinc/01/57/84/1346015784.db2.gz	DYYICXCRXMAYML-NQIIRXRSSA-N	0	3	347.462	3.471	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(-c4ccccc4)nc3)C[C@H]21	ZINC001042282505	1346016026	/nfs/dbraw/zinc/01/60/26/1346016026.db2.gz	DYYICXCRXMAYML-GHTZIAJQSA-N	0	3	347.462	3.471	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(Cl)cc(OC)c3)C[C@@H]21	ZINC001042283551	1346016395	/nfs/dbraw/zinc/01/63/95/1346016395.db2.gz	LGAJHBKUVUDRGY-DYVFJYSZSA-N	0	3	334.847	3.071	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3oc(CCC)nc3C)C[C@H]21	ZINC001042315002	1346030112	/nfs/dbraw/zinc/03/01/12/1346030112.db2.gz	YFCYYKPFGDBRPQ-JKSUJKDBSA-N	0	3	331.460	3.048	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccsc3C(F)F)C[C@H]21	ZINC001042334549	1346041566	/nfs/dbraw/zinc/04/15/66/1346041566.db2.gz	GJQRMONTUKXXRJ-WCQYABFASA-N	0	3	326.412	3.408	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3cc(C)c(CC)s3)C[C@H]21	ZINC001042341014	1346045782	/nfs/dbraw/zinc/04/57/82/1346045782.db2.gz	JQFFTZBWBJQKDP-HZPDHXFCSA-N	0	3	330.497	3.179	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc4ccccc4n3CC)C[C@@H]21	ZINC001042367390	1346058407	/nfs/dbraw/zinc/05/84/07/1346058407.db2.gz	GTGMQQUXFOWAOY-UZLBHIALSA-N	0	3	337.467	3.384	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3c[nH]c4c3cccc4CC)C[C@@H]21	ZINC001042367168	1346058592	/nfs/dbraw/zinc/05/85/92/1346058592.db2.gz	BVPGVBQMAMKKIH-PXNSSMCTSA-N	0	3	349.478	3.290	20	30		EGEDHN
C[C@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)c1ccccc1	ZINC001044424953	1346325849	/nfs/dbraw/zinc/32/58/49/1346325849.db2.gz	HPYRCORPQVAIBP-OXJNMPFZSA-N	0	3	333.435	3.341	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@H](NCc2ccccc2C#N)C[C@H]1C	ZINC001044471507	1346342304	/nfs/dbraw/zinc/34/23/04/1346342304.db2.gz	OMSMJPUMPDTZJT-BEFAXECRSA-N	0	3	327.472	3.464	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2cc(F)ccc2C#N)CCN1C(=O)CCC1CC1	ZINC001044511160	1346353017	/nfs/dbraw/zinc/35/30/17/1346353017.db2.gz	UZKSBBDOFKTRFJ-KUHUBIRLSA-N	0	3	343.446	3.357	20	30		EGEDHN
C[C@H]1C[C@H](NCc2cc(F)ccc2C#N)CCN1C(=O)C=C1CCC1	ZINC001044540880	1346363944	/nfs/dbraw/zinc/36/39/44/1346363944.db2.gz	WVVIOHWERFSZGW-IFXJQAMLSA-N	0	3	341.430	3.277	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@H]1CNCc1c(Cl)oc2ccccc21	ZINC001044960941	1346470301	/nfs/dbraw/zinc/47/03/01/1346470301.db2.gz	ISBSZGCULDVLBB-OLZOCXBDSA-N	0	3	345.830	3.326	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC001045186022	1346522263	/nfs/dbraw/zinc/52/22/63/1346522263.db2.gz	UQXOYMOPHCGVNQ-PXNSSMCTSA-N	0	3	343.446	3.380	20	30		EGEDHN
CC1(NC(=O)c2cc(C#N)c[nH]2)CCN(C/C=C/c2ccccc2)CC1	ZINC001045401904	1346584382	/nfs/dbraw/zinc/58/43/82/1346584382.db2.gz	RWGWDLIWLLNSRI-VMPITWQZSA-N	0	3	348.450	3.184	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2ccn(C3CCCCC3)n2)CC1	ZINC001045437778	1346593427	/nfs/dbraw/zinc/59/34/27/1346593427.db2.gz	BCBJEQJUCDPSGI-UHFFFAOYSA-N	0	3	330.476	3.159	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2snc(Cl)c2Cl)CC1	ZINC001045451355	1346596994	/nfs/dbraw/zinc/59/69/94/1346596994.db2.gz	OBPGGUYFGORHOP-UHFFFAOYSA-N	0	3	334.272	3.220	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1	ZINC001045545252	1346625420	/nfs/dbraw/zinc/62/54/20/1346625420.db2.gz	WLBIZENOSSPGDX-RTBURBONSA-N	0	3	339.483	3.465	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@H]2CC[C@@H](C1)N2C/C=C\c1ccccc1	ZINC001045775636	1346695376	/nfs/dbraw/zinc/69/53/76/1346695376.db2.gz	NBQIRHRUNHPLMT-RMBIOTAASA-N	0	3	334.463	3.179	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1cccc(OC)c1	ZINC001045826048	1346709597	/nfs/dbraw/zinc/70/95/97/1346709597.db2.gz	GAQCTGBRRGLRNL-MSOLQXFVSA-N	0	3	342.483	3.473	20	30		EGEDHN
C[C@@]1(C(=O)N2CC[C@H]3CC[C@@H](C2)N3Cc2ccc(C#N)cc2)C=CCC1	ZINC001045830121	1346712716	/nfs/dbraw/zinc/71/27/16/1346712716.db2.gz	VRAJOYYFLSCXSW-RZUBCFFCSA-N	0	3	349.478	3.480	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccoc1CC)C2	ZINC001045935183	1346772544	/nfs/dbraw/zinc/77/25/44/1346772544.db2.gz	JREDSZRNPAJHOF-HXUWFJFHSA-N	0	3	328.456	3.184	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc(CC)s1)C2	ZINC001045951104	1346786327	/nfs/dbraw/zinc/78/63/27/1346786327.db2.gz	UFHRGWLKTPMROP-LJQANCHMSA-N	0	3	330.497	3.262	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H]1CC[C@H](C)N(CCOCC(C)C)C1	ZINC001132079378	1375136162	/nfs/dbraw/zinc/13/61/62/1375136162.db2.gz	XOXXPAWITKKVRN-GOEBONIOSA-N	0	3	344.927	3.407	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc(F)c(C)c1)C2	ZINC001045960767	1346796375	/nfs/dbraw/zinc/79/63/75/1346796375.db2.gz	SAELPZJRBCUEFL-OAQYLSRUSA-N	0	3	342.458	3.476	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc(Cl)cc1)C2	ZINC001045980507	1346818357	/nfs/dbraw/zinc/81/83/57/1346818357.db2.gz	AGLWOEWHDKHDMW-IBGZPJMESA-N	0	3	330.859	3.291	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc(F)cc1C)C2	ZINC001045981130	1346819647	/nfs/dbraw/zinc/81/96/47/1346819647.db2.gz	POFQHHYQZCQSCP-OAQYLSRUSA-N	0	3	342.458	3.476	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)Cc1cc(C)ccc1F)C2	ZINC001045981744	1346820459	/nfs/dbraw/zinc/82/04/59/1346820459.db2.gz	ZGAQLVGXHBITCV-OAQYLSRUSA-N	0	3	342.458	3.014	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)Cc1ccccc1C)C2	ZINC001045984143	1346824824	/nfs/dbraw/zinc/82/48/24/1346824824.db2.gz	VWLHCFSDJOJSNK-QFIPXVFZSA-N	0	3	338.495	3.265	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2coc3ccc(OC)cc23)C1	ZINC001046474183	1346987099	/nfs/dbraw/zinc/98/70/99/1346987099.db2.gz	RTKFZGZQERTAHQ-LJQANCHMSA-N	0	3	328.412	3.212	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2ccnc(O[C@@H](C)CC)c2)C1	ZINC001046760912	1347089079	/nfs/dbraw/zinc/08/90/79/1347089079.db2.gz	UJWYJPSFDLLTST-HNAYVOBHSA-N	0	3	331.460	3.029	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2ccc(OC3CCC3)cc2)C1	ZINC001046851141	1347129326	/nfs/dbraw/zinc/12/93/26/1347129326.db2.gz	CXFHUYHVWDSGPF-FQEVSTJZSA-N	0	3	328.456	3.388	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2c(C)coc2C)C1	ZINC001046938643	1347157737	/nfs/dbraw/zinc/15/77/37/1347157737.db2.gz	XPWKZCXOCBRBME-AWEZNQCLSA-N	0	3	326.387	3.160	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2cccc(F)c2C)C1	ZINC001046940478	1347158039	/nfs/dbraw/zinc/15/80/39/1347158039.db2.gz	VPQKSCXEFOOTKJ-CQSZACIVSA-N	0	3	340.389	3.397	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2cc[nH]c2C2CC2)C1	ZINC001046971861	1347172211	/nfs/dbraw/zinc/17/22/11/1347172211.db2.gz	SQOITMWTYXUJQI-AWEZNQCLSA-N	0	3	337.414	3.155	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2cc(C(C)C)no2)C1	ZINC001046977747	1347174718	/nfs/dbraw/zinc/17/47/18/1347174718.db2.gz	MABZITMTRIACNK-CYBMUJFWSA-N	0	3	341.402	3.061	20	30		EGEDHN
CC1(C(=O)N[C@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2C#N)C3)CC=CC1	ZINC001047140157	1347218582	/nfs/dbraw/zinc/21/85/82/1347218582.db2.gz	HYEPYRFRIKZCMP-VDGAXYAQSA-N	0	3	349.478	3.384	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3cc(F)ccc3F)C2)CC1	ZINC001047244215	1347269892	/nfs/dbraw/zinc/26/98/92/1347269892.db2.gz	QPDDNCUHJBZANE-MRXNPFEDSA-N	0	3	346.421	3.162	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@H]3CC[C@@H]4C[C@@H]4CC3)C2)CC1	ZINC001047251654	1347276552	/nfs/dbraw/zinc/27/65/52/1347276552.db2.gz	UPPJIXQSTRGMFQ-WOZUAGRISA-N	0	3	342.527	3.397	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)CC(C)(F)F)C2)CC1	ZINC001047254170	1347278193	/nfs/dbraw/zinc/27/81/93/1347278193.db2.gz	OFVOQJVJDHHHFK-INIZCTEOSA-N	0	3	326.431	3.006	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)C3(F)CCCCC3)C2)CC1	ZINC001047261766	1347283338	/nfs/dbraw/zinc/28/33/38/1347283338.db2.gz	IINYUPKQGXUGNA-SFHVURJKSA-N	0	3	334.479	3.243	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3cc(C)c(CC)o3)C2)CC1	ZINC001047264565	1347285625	/nfs/dbraw/zinc/28/56/25/1347285625.db2.gz	PGZMYXDVQXSVIN-GOSISDBHSA-N	0	3	342.483	3.348	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)C3CCC=CCC3)C2)CC1	ZINC001047266075	1347286942	/nfs/dbraw/zinc/28/69/42/1347286942.db2.gz	PPAPLAPPCHKLRI-FQEVSTJZSA-N	0	3	328.500	3.317	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)CC2CCCC2)C1	ZINC001047695102	1347335907	/nfs/dbraw/zinc/33/59/07/1347335907.db2.gz	QCLFIYJUBSHHPZ-UZLBHIALSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)CCC2CCC2)C1	ZINC001047787968	1347371666	/nfs/dbraw/zinc/37/16/66/1347371666.db2.gz	VAPGQHUHNCEHFY-OXQOHEQNSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)CC2(C)CC2)C1	ZINC001047909874	1347406150	/nfs/dbraw/zinc/40/61/50/1347406150.db2.gz	ONOBAOMLVXZNHY-MAUKXSAKSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]([C@H](C)NCc2ccccc2C#N)C1	ZINC001047924436	1347411190	/nfs/dbraw/zinc/41/11/90/1347411190.db2.gz	NOXFIFCPDKKVBO-YJBOKZPZSA-N	0	3	325.456	3.097	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]([C@@H](C)NCc3csc(C)n3)C2)C1	ZINC001047967857	1347427857	/nfs/dbraw/zinc/42/78/57/1347427857.db2.gz	YTLJNOXEHNNPLN-UKRRQHHQSA-N	0	3	333.501	3.134	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]([C@H](C)NCc3ncc(C)s3)C2)C1	ZINC001047967810	1347428100	/nfs/dbraw/zinc/42/81/00/1347428100.db2.gz	YDQLWNXJKJBPMH-LSDHHAIUSA-N	0	3	333.501	3.134	20	30		EGEDHN
C[C@H]1CN(C(=O)CC(C)(C)C)C[C@@H]1CNCc1ccccc1C#N	ZINC001048147601	1347481140	/nfs/dbraw/zinc/48/11/40/1347481140.db2.gz	NIYLGMQXEVOWFF-YJBOKZPZSA-N	0	3	327.472	3.179	20	30		EGEDHN
C[C@H]1CN(C(=O)CCC2CC2)C[C@@H]1CNCc1cc(F)ccc1C#N	ZINC001048181414	1347487443	/nfs/dbraw/zinc/48/74/43/1347487443.db2.gz	DZUAGGBCIYOZNK-KSSFIOAISA-N	0	3	343.446	3.072	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](C)[C@H](CNCc2csc(CC)n2)C1	ZINC001048337705	1347522477	/nfs/dbraw/zinc/52/24/77/1347522477.db2.gz	FIVNOUJZGSOUFC-LSDHHAIUSA-N	0	3	349.544	3.492	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](C)[C@H](CNCc2ccn(C(C)C)n2)C1	ZINC001048340024	1347523324	/nfs/dbraw/zinc/52/33/24/1347523324.db2.gz	NWQMZUSVEKITPE-DLBZAZTESA-N	0	3	346.519	3.250	20	30		EGEDHN
C[C@H]1CN(C(=O)C2(C)CCC2)C[C@@H]1CNCc1cc(F)ccc1C#N	ZINC001048345770	1347525386	/nfs/dbraw/zinc/52/53/86/1347525386.db2.gz	WSVIYGQYGWUZBI-YOEHRIQHSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H](CNCc3ncc(C)s3)[C@H](C)C2)CC1	ZINC001048373024	1347534014	/nfs/dbraw/zinc/53/40/14/1347534014.db2.gz	JAFJMQMJZSEFCX-RHSMWYFYSA-N	0	3	347.528	3.382	20	30		EGEDHN
C#CCCN1CCC(N(Cc2ccccn2)C(=O)c2ccccc2)CC1	ZINC001048623632	1347622717	/nfs/dbraw/zinc/62/27/17/1347622717.db2.gz	DRBLYYJZFOLARA-UHFFFAOYSA-N	0	3	347.462	3.212	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@H]2CN(CCC(F)(F)F)C[C@H]2C1	ZINC001048841261	1347669514	/nfs/dbraw/zinc/66/95/14/1347669514.db2.gz	OGHVFZKLUZCGSC-TXEJJXNPSA-N	0	3	338.801	3.108	20	30		EGEDHN
C[C@@]1(C(=O)N2C[C@H]3CN(Cc4cccc(C#N)c4)C[C@H]3C2)CC=CCC1	ZINC001048839184	1347669697	/nfs/dbraw/zinc/66/96/97/1347669697.db2.gz	ZMJJRNFPMJURDI-RZUBCFFCSA-N	0	3	349.478	3.195	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CN(Cc3cccc(F)c3)C[C@H]2C1	ZINC001048976894	1347695761	/nfs/dbraw/zinc/69/57/61/1347695761.db2.gz	SUBSYKMMDSLDOU-CALCHBBNSA-N	0	3	330.447	3.318	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3oc4ccccc4c3Cl)C[C@@H]2C1	ZINC001049169884	1347738297	/nfs/dbraw/zinc/73/82/97/1347738297.db2.gz	XSTNRIQDQKXPLL-OKILXGFUSA-N	0	3	342.826	3.113	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@@H](CC)c3ccc(Cl)cc3)C[C@@H]2C1	ZINC001049228461	1347751799	/nfs/dbraw/zinc/75/17/99/1347751799.db2.gz	CXARSGOYPGAEOJ-SCTDSRPQSA-N	0	3	344.886	3.247	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1ccc(C(F)F)cc1	ZINC001049373202	1347809937	/nfs/dbraw/zinc/80/99/37/1347809937.db2.gz	QUVIZUPRKSRVDZ-XYPHTWIQSA-N	0	3	347.409	3.349	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)C=C2CCC2)cc1	ZINC001049410334	1347832472	/nfs/dbraw/zinc/83/24/72/1347832472.db2.gz	AVBWFOVIIGGDTQ-WOJBJXKFSA-N	0	3	335.451	3.234	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@@H]2CCCN3C(=O)C2=CCCC2)cc1	ZINC001049417084	1347839285	/nfs/dbraw/zinc/83/92/85/1347839285.db2.gz	ZUYMLKHZNDWFBV-PMACEKPBSA-N	0	3	335.451	3.234	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](CC)OC1CCCCC1	ZINC001049472687	1347866053	/nfs/dbraw/zinc/86/60/53/1347866053.db2.gz	GAHJBLCFNIFDMI-OTWHNJEPSA-N	0	3	334.504	3.366	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)C1(c2ccc(F)cc2)CC1	ZINC001049509763	1347884267	/nfs/dbraw/zinc/88/42/67/1347884267.db2.gz	YVBIWTKTAPVNAE-MSOLQXFVSA-N	0	3	328.431	3.109	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1ccc(C)c(Cl)c1	ZINC001049547492	1347901863	/nfs/dbraw/zinc/90/18/63/1347901863.db2.gz	ZOJUHOTZNMXNKQ-RTBURBONSA-N	0	3	344.886	3.280	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1CCC[C@H]2[C@H]1CCN2CC=C	ZINC001049554607	1347906767	/nfs/dbraw/zinc/90/67/67/1347906767.db2.gz	GUNRQDVIYGGWTQ-ZWKOTPCHSA-N	0	3	326.440	3.116	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1CCC[C@@H]2[C@H]1CCN2CC=C	ZINC001049554601	1347906911	/nfs/dbraw/zinc/90/69/11/1347906911.db2.gz	GUNRQDVIYGGWTQ-QZTJIDSGSA-N	0	3	326.440	3.116	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C1(C)CCC(F)(F)CC1	ZINC001049556881	1347907666	/nfs/dbraw/zinc/90/76/66/1347907666.db2.gz	ZWKQNNSKYVQXPO-LSDHHAIUSA-N	0	3	326.431	3.453	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(C)n(C(CC)CC)n1	ZINC001049563134	1347911226	/nfs/dbraw/zinc/91/12/26/1347911226.db2.gz	CIQKDNPDCDDMMT-MOPGFXCFSA-N	0	3	344.503	3.418	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(C)n([C@H](C)C2CC2)n1	ZINC001049565025	1347912566	/nfs/dbraw/zinc/91/25/66/1347912566.db2.gz	RNCCQIXRPAQMKD-ATZDWAIDSA-N	0	3	342.487	3.027	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1coc2cc(F)ccc12	ZINC001049565640	1347913151	/nfs/dbraw/zinc/91/31/51/1347913151.db2.gz	VVVQLAKCCYHAOH-DLBZAZTESA-N	0	3	328.387	3.437	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cccc(-n2cccc2)c1	ZINC001049575501	1347917199	/nfs/dbraw/zinc/91/71/99/1347917199.db2.gz	GXNRLPDGVQOCBB-LEWJYISDSA-N	0	3	347.462	3.180	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cn1c(C)cc2ccccc21	ZINC001049579398	1347919349	/nfs/dbraw/zinc/91/93/49/1347919349.db2.gz	GMAZSZMZHRODEP-UXHICEINSA-N	0	3	337.467	3.201	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cnc2ccccc2c1C	ZINC001049598469	1347929794	/nfs/dbraw/zinc/92/97/94/1347929794.db2.gz	NUVAIGIHKDIFQX-PMACEKPBSA-N	0	3	335.451	3.408	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc2ncccc2o1	ZINC001049600490	1347930353	/nfs/dbraw/zinc/93/03/53/1347930353.db2.gz	AUOKKSDFHUIXGE-JKSUJKDBSA-N	0	3	325.412	3.083	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1sccc1-n1cccc1	ZINC001049629024	1347943099	/nfs/dbraw/zinc/94/30/99/1347943099.db2.gz	ITISONVOYYHDHN-HOTGVXAUSA-N	0	3	341.480	3.404	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](c1ccncc1)C(C)C	ZINC001049673819	1347967056	/nfs/dbraw/zinc/96/70/56/1347967056.db2.gz	ZZDZRRKRDZZLJP-OTWHNJEPSA-N	0	3	327.472	3.073	20	30		EGEDHN
CC1(C(=O)N2CCC[C@H]3[C@@H]2CCN3Cc2cccc(C#N)c2)CC=CC1	ZINC001049690299	1347973506	/nfs/dbraw/zinc/97/35/06/1347973506.db2.gz	OVVHPQHKOSDUOS-PMACEKPBSA-N	0	3	349.478	3.480	20	30		EGEDHN
CC1(C(=O)N2CCC[C@H]3[C@H]2CCN3Cc2ccc(C#N)cc2)CC=CC1	ZINC001049690874	1347973750	/nfs/dbraw/zinc/97/37/50/1347973750.db2.gz	RTGSJYYJGFFKMJ-VQTJNVASSA-N	0	3	349.478	3.480	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccc(OC)cc1	ZINC001049777105	1348016247	/nfs/dbraw/zinc/01/62/47/1348016247.db2.gz	OCUASNGGURAVMM-MTQWCTHYSA-N	0	3	340.467	3.050	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccccc1F	ZINC001049782198	1348019272	/nfs/dbraw/zinc/01/92/72/1348019272.db2.gz	OOBYVRBFOLXSMX-HNJRGHQBSA-N	0	3	340.442	3.018	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1noc2c1C[C@@H](C)CC2	ZINC001049824475	1348041175	/nfs/dbraw/zinc/04/11/75/1348041175.db2.gz	WLKNDWXMFUCADT-BHYGNILZSA-N	0	3	343.471	3.054	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1coc(C2CCCC2)n1	ZINC001049828884	1348044075	/nfs/dbraw/zinc/04/40/75/1348044075.db2.gz	RCWLUOMUABLSNW-ZWKOTPCHSA-N	0	3	341.455	3.034	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc2c(c1)CCC=C2	ZINC001049846472	1348055867	/nfs/dbraw/zinc/05/58/67/1348055867.db2.gz	INECKVSJORFFLD-SFTDATJTSA-N	0	3	334.463	3.348	20	30		EGEDHN
CC(C)(C)C(=O)N1CCC[C@H]2[C@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049860102	1348066512	/nfs/dbraw/zinc/06/65/12/1348066512.db2.gz	ZECDRYDTIQMANH-ZWKOTPCHSA-N	0	3	325.456	3.170	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(Cl)ccc1OC	ZINC001049878391	1348083098	/nfs/dbraw/zinc/08/30/98/1348083098.db2.gz	TUTFQNCGKJDDQV-CVEARBPZSA-N	0	3	334.847	3.214	20	30		EGEDHN
Cc1c[nH]cc1C(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049889516	1348094691	/nfs/dbraw/zinc/09/46/91/1348094691.db2.gz	GPESKWREOWPKKF-PMACEKPBSA-N	0	3	348.450	3.074	20	30		EGEDHN
C=CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1scnc1Cl	ZINC001049899235	1348100095	/nfs/dbraw/zinc/10/00/95/1348100095.db2.gz	CUYHGBOCGVOALW-NEPJUHHUSA-N	0	3	325.865	3.052	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](C)c1ccc(F)c(F)c1	ZINC001049904814	1348103256	/nfs/dbraw/zinc/10/32/56/1348103256.db2.gz	RWJOYYGNKWDWLY-MDASCCDHSA-N	0	3	346.421	3.157	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc2cc(C)ccc2o1	ZINC001049915168	1348109841	/nfs/dbraw/zinc/10/98/41/1348109841.db2.gz	TYXLRJKPVSIQGP-MSOLQXFVSA-N	0	3	336.435	3.443	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(C)n(C(C)C)n1	ZINC001049934853	1348121375	/nfs/dbraw/zinc/12/13/75/1348121375.db2.gz	WFJYCYNAOYFKPJ-ZWKOTPCHSA-N	0	3	330.476	3.027	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CCCN(C(=O)C[C@H]4C=CCC4)[C@@H]3C2)c1	ZINC001049965109	1348136606	/nfs/dbraw/zinc/13/66/06/1348136606.db2.gz	COHAIHQJFMIPLF-DZFGPLHGSA-N	0	3	349.478	3.337	20	30		EGEDHN
C/C(=C/C(=O)N1CCC[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21)C1CC1	ZINC001049987636	1348145464	/nfs/dbraw/zinc/14/54/64/1348145464.db2.gz	OVZZEYVYSYOQRP-RXZAAINWSA-N	0	3	349.478	3.337	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)CCc3ccc4[nH]ccc4c3)[C@@H]2C1	ZINC001050096759	1348181724	/nfs/dbraw/zinc/18/17/24/1348181724.db2.gz	WPJUYPZWUWKGBK-AZUAARDMSA-N	0	3	337.467	3.209	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3cccc4c3O[C@@H](C)C4)[C@@H]2C1	ZINC001050098378	1348183001	/nfs/dbraw/zinc/18/30/01/1348183001.db2.gz	NILNRPHVDAPNOJ-VDZJLULYSA-N	0	3	340.467	3.123	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CCCN(C(=O)[C@@H]4CC45CCC5)[C@@H]3C2)c1	ZINC001050153665	1348198711	/nfs/dbraw/zinc/19/87/11/1348198711.db2.gz	YSFMHBHTLPGGRD-SLFFLAALSA-N	0	3	349.478	3.171	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)Cc3ccccc3OC(C)C)[C@@H]2C1	ZINC001050161766	1348200272	/nfs/dbraw/zinc/20/02/72/1348200272.db2.gz	HBQPNADEORYCQX-RBUKOAKNSA-N	0	3	342.483	3.125	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)C[C@@H](C)c3ccccc3F)[C@@H]2C1	ZINC001050164319	1348201549	/nfs/dbraw/zinc/20/15/49/1348201549.db2.gz	BPHVFMYXOIFPER-JTDSTZFVSA-N	0	3	330.447	3.428	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cnn(C(CC)CC)c3C)[C@@H]2C1	ZINC001050180017	1348203348	/nfs/dbraw/zinc/20/33/48/1348203348.db2.gz	VDSOOFWODPLHFC-QFBILLFUSA-N	0	3	344.503	3.275	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CN(Cc2cccc(C)c2)C[C@H]1C	ZINC001079850870	1357400603	/nfs/dbraw/zinc/40/06/03/1357400603.db2.gz	TVQLRJRTVXIQSG-IEBWSBKVSA-N	0	3	337.467	3.233	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC3(C2)CCN(Cc2cnccc2C)CC3)C1	ZINC001050656775	1348319484	/nfs/dbraw/zinc/31/94/84/1348319484.db2.gz	JASDMIOLYCBFDB-UHFFFAOYSA-N	0	3	339.483	3.171	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)[C@@H]4CC45CCC5)C3)CC2)c1	ZINC001050682660	1348325584	/nfs/dbraw/zinc/32/55/84/1348325584.db2.gz	JYUSLQCAZKFZFJ-IBGZPJMESA-N	0	3	349.478	3.173	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@@H](C)c3ccc(Cl)s3)C2)CC1	ZINC001050723635	1348338483	/nfs/dbraw/zinc/33/84/83/1348338483.db2.gz	UFYAQOONQYPREX-ZDUSSCGKSA-N	0	3	336.888	3.063	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@@H](C)c3cc4ccccc4o3)C2)CC1	ZINC001050726003	1348338911	/nfs/dbraw/zinc/33/89/11/1348338911.db2.gz	PDLJJHUTUUJXJB-INIZCTEOSA-N	0	3	336.435	3.094	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3ccc(Cl)c(Cl)c3)C2)CC1	ZINC001050737741	1348343246	/nfs/dbraw/zinc/34/32/46/1348343246.db2.gz	JBCXDPAJZXXSQE-UHFFFAOYSA-N	0	3	337.250	3.165	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H](CC)c3ccc(F)cc3)C2)CC1	ZINC001050768496	1348353331	/nfs/dbraw/zinc/35/33/31/1348353331.db2.gz	WORRDTASODHIPO-LJQANCHMSA-N	0	3	342.458	3.267	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)[C@H]3CCCO[C@@H]3C)cccc2C1	ZINC001051285044	1348418592	/nfs/dbraw/zinc/41/85/92/1348418592.db2.gz	WKELDMLJAQFVHA-APWZRJJASA-N	0	3	342.483	3.052	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3cc(Cl)no3)cccc2C1	ZINC001051305901	1348427371	/nfs/dbraw/zinc/42/73/71/1348427371.db2.gz	XTTQGAVQOVAQQN-UHFFFAOYSA-N	0	3	345.830	3.192	20	30		EGEDHN
C=C(C)CCN1CCN([C@H]2CCN(C(=O)C3(C)CCCCC3)C2)CC1	ZINC001052074493	1348501272	/nfs/dbraw/zinc/50/12/72/1348501272.db2.gz	FLJJNOHWZBRQPS-IBGZPJMESA-N	0	3	347.547	3.142	20	30		EGEDHN
C[C@H](C(=O)N[C@H]1CCCN(Cc2ccc(C#N)cc2)CC1)C1CC1	ZINC001052283089	1348517156	/nfs/dbraw/zinc/51/71/56/1348517156.db2.gz	VGJQFVMLNAKWQM-KXBFYZLASA-N	0	3	325.456	3.075	20	30		EGEDHN
CC1(C)CC[C@@H]1C(=O)N[C@@H]1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC001052636813	1348605970	/nfs/dbraw/zinc/60/59/70/1348605970.db2.gz	YJYMQOAZWWISKU-RTBURBONSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)Cc2cccc3sccc32)CC1	ZINC001052762670	1348668289	/nfs/dbraw/zinc/66/82/89/1348668289.db2.gz	AGESWHGMWCUKBJ-KRWDZBQOSA-N	0	3	340.492	3.438	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@H](NC(=O)[C@@H]3C[C@H]3C3CC3)CC2)c1	ZINC001052778858	1348676065	/nfs/dbraw/zinc/67/60/65/1348676065.db2.gz	SQXOXZBGGPKJES-SLFFLAALSA-N	0	3	337.467	3.075	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@]2(c3ccccc3)CC2(C)C)CC1	ZINC001052818574	1348688851	/nfs/dbraw/zinc/68/88/51/1348688851.db2.gz	UHYFMYDPLZVELV-DENIHFKCSA-N	0	3	338.495	3.348	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cnc(-c3ccco3)s2)CC1	ZINC001052880212	1348716704	/nfs/dbraw/zinc/71/67/04/1348716704.db2.gz	LVMIBIRTBVAOIB-AWEZNQCLSA-N	0	3	343.452	3.011	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)C[C@H]2CCCc3ccccc32)CC1	ZINC001052885276	1348722473	/nfs/dbraw/zinc/72/24/73/1348722473.db2.gz	QILRLHSZAAEREB-WOJBJXKFSA-N	0	3	338.495	3.491	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2c[nH]c3c2cccc3CC)CC1	ZINC001052957787	1348771115	/nfs/dbraw/zinc/77/11/15/1348771115.db2.gz	JAILVQFTGFZPGL-QGZVFWFLSA-N	0	3	337.467	3.338	20	30		EGEDHN
CCC(=O)N1CCC[C@H]([C@@H]2CCCN(Cc3ccccc3C#N)C2)C1	ZINC001052998363	1348796619	/nfs/dbraw/zinc/79/66/19/1348796619.db2.gz	YCZJABABOQQJAB-UXHICEINSA-N	0	3	339.483	3.419	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)Cc2cccs2)C1	ZINC001053060895	1348870307	/nfs/dbraw/zinc/87/03/07/1348870307.db2.gz	KFDXEPLOEKLVKW-SJLPKXTDSA-N	0	3	330.497	3.017	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccsc2)C1	ZINC001053063649	1348875525	/nfs/dbraw/zinc/87/55/25/1348875525.db2.gz	POBZTMFTEHGMMN-FUHWJXTLSA-N	0	3	330.497	3.478	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2occc2C)C1	ZINC001053067555	1348881376	/nfs/dbraw/zinc/88/13/76/1348881376.db2.gz	RUAYUFKHDKKDMU-QZTJIDSGSA-N	0	3	328.456	3.318	20	30		EGEDHN
C#CCC[N@H+]1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001053068857	1348882092	/nfs/dbraw/zinc/88/20/92/1348882092.db2.gz	WPGWXARDWZOXDE-PKOBYXMFSA-N	0	3	340.467	3.122	20	30		EGEDHN
C#CCC[N@@H+]1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001053068857	1348882097	/nfs/dbraw/zinc/88/20/97/1348882097.db2.gz	WPGWXARDWZOXDE-PKOBYXMFSA-N	0	3	340.467	3.122	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cc(C)cs2)C1	ZINC001053082775	1348904411	/nfs/dbraw/zinc/90/44/11/1348904411.db2.gz	GPJTWFCKJILJPO-IRXDYDNUSA-N	0	3	330.497	3.396	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cocc2C)C1	ZINC001053093257	1348920382	/nfs/dbraw/zinc/92/03/82/1348920382.db2.gz	XKODKOBPCKJQTI-HKUYNNGSSA-N	0	3	328.456	3.318	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)Cc2cccc(C)c2)C1	ZINC001053093425	1348921475	/nfs/dbraw/zinc/92/14/75/1348921475.db2.gz	MRHQAGOWTMQPBZ-NHCUHLMSSA-N	0	3	338.495	3.264	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccn(CC)c2C)C1	ZINC001053095919	1348926325	/nfs/dbraw/zinc/92/63/25/1348926325.db2.gz	MIZKKXWRVLBEAU-UYAOXDASSA-N	0	3	341.499	3.156	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(OC)cc2)C1	ZINC001053105640	1348943451	/nfs/dbraw/zinc/94/34/51/1348943451.db2.gz	QCGAJZHAUOTRKV-QUCCMNQESA-N	0	3	340.467	3.035	20	30		EGEDHN
CC(F)(F)C(=O)N1CCC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001054071451	1349144863	/nfs/dbraw/zinc/14/48/63/1349144863.db2.gz	CDBPJLDIAWNZJW-IBGZPJMESA-N	0	3	347.409	3.028	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc(C)c(F)cc1F)C2	ZINC001054150321	1349155773	/nfs/dbraw/zinc/15/57/73/1349155773.db2.gz	YBCMSKHJPOJUJP-FQEVSTJZSA-N	0	3	346.421	3.225	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1c(C)c(F)ccc1Cl)C2	ZINC001054155712	1349159082	/nfs/dbraw/zinc/15/90/82/1349159082.db2.gz	XYGNCAMBGYHRMG-LJQANCHMSA-N	0	3	348.849	3.349	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(-n3cccc3)cc1)C2	ZINC001054160560	1349162639	/nfs/dbraw/zinc/16/26/39/1349162639.db2.gz	ILYAZEFCLXTPCD-JOCHJYFZSA-N	0	3	347.462	3.039	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@]2(CCN(Cc3ncccc3C)C2)C1	ZINC001054177504	1349180005	/nfs/dbraw/zinc/18/00/05/1349180005.db2.gz	NDHKZMSVFOGWFG-OAQYLSRUSA-N	0	3	341.499	3.417	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(Cl)cc1C)C2	ZINC001054188784	1349191451	/nfs/dbraw/zinc/19/14/51/1349191451.db2.gz	UNPFOPABHJAIFD-LJQANCHMSA-N	0	3	330.859	3.210	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)[C@H](C)c1ccc(Cl)cc1)C2	ZINC001054188684	1349191758	/nfs/dbraw/zinc/19/17/58/1349191758.db2.gz	RCFGDNOXFBKLRW-UZLBHIALSA-N	0	3	344.886	3.391	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1c(C)cccc1Cl)C2	ZINC001054189851	1349192328	/nfs/dbraw/zinc/19/23/28/1349192328.db2.gz	VFJFEMGYLLSMJD-LJQANCHMSA-N	0	3	330.859	3.210	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@]2(CCN(Cc3ocnc3C)C2)C1	ZINC001054191280	1349193179	/nfs/dbraw/zinc/19/31/79/1349193179.db2.gz	DXMNJWZHSUGCAH-UXHICEINSA-N	0	3	345.487	3.400	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H](C)c1cccs1)C2	ZINC001054196564	1349198357	/nfs/dbraw/zinc/19/83/57/1349198357.db2.gz	JKOOKKHOETXHQK-LPHOPBHVSA-N	0	3	330.497	3.189	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@H]1C[C@@H]1c1ccccc1)C2	ZINC001054209275	1349210288	/nfs/dbraw/zinc/21/02/88/1349210288.db2.gz	MWVOUBNXPSHLIL-URVUXULASA-N	0	3	336.479	3.128	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc3nc(C)ccc3c1)C2	ZINC001054217620	1349215558	/nfs/dbraw/zinc/21/55/58/1349215558.db2.gz	ZURJRTHDGGZHQH-QFIPXVFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccsc1C(F)F)C2	ZINC001054234929	1349226761	/nfs/dbraw/zinc/22/67/61/1349226761.db2.gz	MYVCORRGQWIKRW-KRWDZBQOSA-N	0	3	338.423	3.247	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1sc(C(C)C)nc1C)C2	ZINC001054239083	1349233574	/nfs/dbraw/zinc/23/35/74/1349233574.db2.gz	JAIVEFDMISBPHR-LJQANCHMSA-N	0	3	345.512	3.136	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@H](C)n1c(C)ccc1C)C2	ZINC001054244246	1349237403	/nfs/dbraw/zinc/23/74/03/1349237403.db2.gz	BCMIZHFMWCHVRP-PZJWPPBQSA-N	0	3	341.499	3.004	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)C13CC(c4ccccc4)(C1)C3)C2	ZINC001054246322	1349240924	/nfs/dbraw/zinc/24/09/24/1349240924.db2.gz	WBKGDIVXWVPLQE-UVKLAMSESA-N	0	3	348.490	3.056	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H](C)Cc1ccccc1C)C2	ZINC001054247432	1349243094	/nfs/dbraw/zinc/24/30/94/1349243094.db2.gz	WKGBQWUCBNCXHM-UGKGYDQZSA-N	0	3	338.495	3.121	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@@H]3CCCOCC3)cc2C1	ZINC001054263668	1349261574	/nfs/dbraw/zinc/26/15/74/1349261574.db2.gz	YLGLMUGZLTUXRL-QGZVFWFLSA-N	0	3	328.456	3.011	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@H]3OCC[C@H]3C(C)C)cc2C1	ZINC001054265403	1349262818	/nfs/dbraw/zinc/26/28/18/1349262818.db2.gz	NDCIIGVFBJHOFQ-PMACEKPBSA-N	0	3	342.483	3.256	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@@H]3OC[C@@H]4CCC[C@@H]43)cc2C1	ZINC001054274823	1349275052	/nfs/dbraw/zinc/27/50/52/1349275052.db2.gz	UCRGCMJKJIIJDL-YSIASYRMSA-N	0	3	340.467	3.010	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3nccc4[nH]ccc43)cc2C1	ZINC001054281488	1349283146	/nfs/dbraw/zinc/28/31/46/1349283146.db2.gz	MXRVIQGOMJDPPU-UHFFFAOYSA-N	0	3	346.434	3.385	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3[nH]c(C)nc3C)cc2C1	ZINC001054281793	1349283391	/nfs/dbraw/zinc/28/33/91/1349283391.db2.gz	CIGJCQDEOVYCAF-UHFFFAOYSA-N	0	3	338.455	3.238	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3oncc3C)cc2C1	ZINC001054288131	1349291503	/nfs/dbraw/zinc/29/15/03/1349291503.db2.gz	LHNHGGKUHZWQRO-UHFFFAOYSA-N	0	3	325.412	3.195	20	30		EGEDHN
CCC(CC)C(=O)N1C[C@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001054410459	1349353292	/nfs/dbraw/zinc/35/32/92/1349353292.db2.gz	JFNQJIVSQAMMFE-SCLBCKFNSA-N	0	3	331.435	3.070	20	30		EGEDHN
CCC(CC)C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001054410456	1349353311	/nfs/dbraw/zinc/35/33/11/1349353311.db2.gz	JFNQJIVSQAMMFE-FZKQIMNGSA-N	0	3	331.435	3.070	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2(C3CC3)CCC2)C[C@H]1NCc1ccc(C#N)s1	ZINC001054933587	1349517685	/nfs/dbraw/zinc/51/76/85/1349517685.db2.gz	BQQNWXHAABFCSV-CXAGYDPISA-N	0	3	343.496	3.137	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](NCc2ccnc(Cl)c2)[C@@H](C)C1	ZINC001054970411	1349531304	/nfs/dbraw/zinc/53/13/04/1349531304.db2.gz	CIMLYWNLKAPVCM-ZFWWWQNUSA-N	0	3	335.879	3.274	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2ccc(C(F)F)cc2F)C1	ZINC001080671105	1357720702	/nfs/dbraw/zinc/72/07/02/1357720702.db2.gz	QITSLSJLJDNZBY-IAQYHMDHSA-N	0	3	326.362	3.390	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C(C)(C)C1CCCC1)C[C@@H](C)O2	ZINC001071178650	1354488612	/nfs/dbraw/zinc/48/86/12/1354488612.db2.gz	UGULKUZCDMBEGO-DYESRHJHSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1ccc(CC)s1)C[C@@H](C)O2	ZINC001071185164	1354491665	/nfs/dbraw/zinc/49/16/65/1354491665.db2.gz	BMKPDOGPUSXHET-DNVCBOLYSA-N	0	3	348.512	3.192	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1cc[nH]c1C(C)C)C[C@H](C)O2	ZINC001071201511	1354501988	/nfs/dbraw/zinc/50/19/88/1354501988.db2.gz	FXGMOTJSGLHISV-JXFKEZNVSA-N	0	3	345.487	3.020	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H](C)O[C@@]3(CCN(CC=C(C)C)C3)C2)C1	ZINC001071211567	1354507633	/nfs/dbraw/zinc/50/76/33/1354507633.db2.gz	KEDISUAVWXOSBM-FXAWDEMLSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1c(C)cccc1C)C[C@H](C)O2	ZINC001071211363	1354507964	/nfs/dbraw/zinc/50/79/64/1354507964.db2.gz	GRLSPYJGEUSWKJ-GHTZIAJQSA-N	0	3	342.483	3.185	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)[C@H]1CC[C@H](CC)CC1)C[C@@H](C)O2	ZINC001071233300	1354517011	/nfs/dbraw/zinc/51/70/11/1354517011.db2.gz	GYGDYIDUCDNOAH-ANTGDGSKSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1ccc(C)c(C)c1)C[C@H](C)O2	ZINC001071236449	1354520794	/nfs/dbraw/zinc/52/07/94/1354520794.db2.gz	VEQJCZWNJVGGSS-GHTZIAJQSA-N	0	3	342.483	3.185	20	30		EGEDHN
C#CCCN1C[C@@H](C)[C@H](NC(=O)c2ccc(Cl)c(CCC)c2)C1	ZINC001080780787	1357736926	/nfs/dbraw/zinc/73/69/26/1357736926.db2.gz	CEMDAENYZVHUPI-RDTXWAMCSA-N	0	3	332.875	3.366	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(F)c(C(F)F)c2)CC[C@H]1C	ZINC001071515186	1354738364	/nfs/dbraw/zinc/73/83/64/1354738364.db2.gz	RYEDHJAOCBMHBP-TZMCWYRMSA-N	0	3	338.373	3.369	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)CC[C@H]2CCCO2)C1	ZINC001088268405	1359822854	/nfs/dbraw/zinc/82/28/54/1359822854.db2.gz	NSWJNXSYHCYUDR-HZPDHXFCSA-N	0	3	328.884	3.059	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cccc(NC(=O)CC)c2)CC[C@H]1C	ZINC001071544321	1354757745	/nfs/dbraw/zinc/75/77/45/1354757745.db2.gz	WWOYUZLKXXYOSJ-QAPCUYQASA-N	0	3	343.471	3.194	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)c2cn(C)c3ccc(F)cc23)CC[C@@H]1C	ZINC001071572431	1354771170	/nfs/dbraw/zinc/77/11/70/1354771170.db2.gz	VVCPIDVHOUABJA-DZGCQCFKSA-N	0	3	329.419	3.086	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2ccc(-c3cc[nH]n3)s2)CC[C@H]1C	ZINC001071594404	1354783494	/nfs/dbraw/zinc/78/34/94/1354783494.db2.gz	QGFJRQZBVPMYAC-KGLIPLIRSA-N	0	3	344.484	3.297	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccnn2-c2ccccc2)CC[C@@H]1C	ZINC001071610737	1354794989	/nfs/dbraw/zinc/79/49/89/1354794989.db2.gz	WLLLBVWWYZJEFZ-IRXDYDNUSA-N	0	3	338.455	3.031	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2c3c[nH]nc3ccc2C)CC[C@H]1C	ZINC001071624271	1354806871	/nfs/dbraw/zinc/80/68/71/1354806871.db2.gz	GNLZVBNKXKBGEV-CABCVRRESA-N	0	3	326.444	3.030	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2coc3ccc(OC)cc32)CC[C@H]1C	ZINC001071676027	1354843255	/nfs/dbraw/zinc/84/32/55/1354843255.db2.gz	JHCJCIXFEPGEMW-CABCVRRESA-N	0	3	340.423	3.047	20	30		EGEDHN
C=C(C)CCN1C[C@H](NC(=O)c2nc3c(s2)CCC3)CC[C@H]1C	ZINC001071683162	1354850338	/nfs/dbraw/zinc/85/03/38/1354850338.db2.gz	YDWVWAHXOCWKPX-ZIAGYGMSSA-N	0	3	333.501	3.181	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cncc(OC(C)C)c2)CC[C@@H]1C	ZINC001071739027	1354889521	/nfs/dbraw/zinc/88/95/21/1354889521.db2.gz	MAYWJCWGYPEQGY-DOTOQJQBSA-N	0	3	331.460	3.028	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2nsc3ccc(C)cc32)CC[C@H]1C	ZINC001071742645	1354893533	/nfs/dbraw/zinc/89/35/33/1354893533.db2.gz	RWXNREGUSUEHCG-HUUCEWRRSA-N	0	3	341.480	3.211	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2csc(-c3ccco3)n2)CC[C@H]1C	ZINC001071775438	1354921770	/nfs/dbraw/zinc/92/17/70/1354921770.db2.gz	CFXGIMVLRQGDSA-ZIAGYGMSSA-N	0	3	343.452	3.009	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C(C)(C)c2cccc(F)c2)CC[C@H]1C	ZINC001071825541	1354963862	/nfs/dbraw/zinc/96/38/62/1354963862.db2.gz	YKGAPHJTFHAALI-QAPCUYQASA-N	0	3	330.447	3.096	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2snnc2C(C)C)CC[C@H]1C	ZINC001071919676	1355024538	/nfs/dbraw/zinc/02/45/38/1355024538.db2.gz	GCVKDUOYRFAKOT-KGLIPLIRSA-N	0	3	336.505	3.210	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cn(CCCC)nc2C)CC[C@H]1C	ZINC001071976782	1355056625	/nfs/dbraw/zinc/05/66/25/1355056625.db2.gz	IESBWIYPYQMVAS-WBVHZDCISA-N	0	3	332.492	3.150	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CC[C@@H](C)N(Cc3ccc(C)cc3)C2)cn1	ZINC001072002957	1355068261	/nfs/dbraw/zinc/06/82/61/1355068261.db2.gz	PZFCLSUZQQIQTP-UTKZUKDTSA-N	0	3	347.462	3.154	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)CC[C@H]1C	ZINC001072020152	1355082891	/nfs/dbraw/zinc/08/28/91/1355082891.db2.gz	UJBOOADNHISDIZ-CJNGLKHVSA-N	0	3	338.373	3.311	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@@H]1CC[C@@H](C)N(Cc2ccccc2)C1	ZINC001072023614	1355085751	/nfs/dbraw/zinc/08/57/51/1355085751.db2.gz	UFGFYJSVTMJVRS-XMSQKQJNSA-N	0	3	346.474	3.380	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cccc(OCC)c1	ZINC001089704045	1360607190	/nfs/dbraw/zinc/60/71/90/1360607190.db2.gz	SKXDISLCRFSHIA-SFHVURJKSA-N	0	3	342.483	3.329	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1csc2cncn21	ZINC001089704273	1360607216	/nfs/dbraw/zinc/60/72/16/1360607216.db2.gz	UTFPLWKWXWRGCI-AWEZNQCLSA-N	0	3	346.500	3.192	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(-c3ccccc3)[nH]2)CC[C@@H]1C	ZINC001072113010	1355138172	/nfs/dbraw/zinc/13/81/72/1355138172.db2.gz	LVZKXNUAEXWUMB-WMZOPIPTSA-N	0	3	335.451	3.288	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(OC(C)C)cn2)CC[C@H]1C	ZINC001072125914	1355142903	/nfs/dbraw/zinc/14/29/03/1355142903.db2.gz	HMRPMTBQVKDQBI-HZPDHXFCSA-N	0	3	331.460	3.028	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2N(Cc2ccsc2)C(=O)[C@@H]2C[C@H]2C)CC1	ZINC001072137559	1355149682	/nfs/dbraw/zinc/14/96/82/1355149682.db2.gz	QEPJFAAGMNMFGZ-KBAYOESNSA-N	0	3	342.508	3.220	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](C)[C@H](CNCc3nc(C)cs3)C2)C1	ZINC001072359862	1355255952	/nfs/dbraw/zinc/25/59/52/1355255952.db2.gz	IHRGEWGXLVCOPX-GOEBONIOSA-N	0	3	347.528	3.382	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2c(F)ccc(F)c2Cl)C1	ZINC001091249229	1361021191	/nfs/dbraw/zinc/02/11/91/1361021191.db2.gz	FIRRIKWVNGFFCQ-UHFFFAOYSA-N	0	3	349.208	3.469	20	30		EGEDHN
Cc1cc(C)c(C(=O)N2CC3(C2)CCN(Cc2ccc(C#N)cc2)C3)o1	ZINC001072595627	1355350620	/nfs/dbraw/zinc/35/06/20/1355350620.db2.gz	BYHOKQKIVYDRKK-UHFFFAOYSA-N	0	3	349.434	3.116	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H]3CC[C@@H](c4ccccc4)C3)C2)C1	ZINC001072850044	1355465189	/nfs/dbraw/zinc/46/51/89/1355465189.db2.gz	PUSTVOAAKKQVAR-WOJBJXKFSA-N	0	3	336.479	3.128	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)C(C)(C)c3cccc(Cl)c3)C2)C1	ZINC001073021076	1355552922	/nfs/dbraw/zinc/55/29/22/1355552922.db2.gz	AQTCMIOPSHXTCS-UHFFFAOYSA-N	0	3	332.875	3.338	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)C(CC)(CC)c3ccccc3)C2)C1	ZINC001073450887	1355787329	/nfs/dbraw/zinc/78/73/29/1355787329.db2.gz	MJEOVRVNDRMPCR-UHFFFAOYSA-N	0	3	326.484	3.465	20	30		EGEDHN
CC(C)CC(=O)N1CCCC[C@@H]1CN(C)Cc1cccc(C#N)c1	ZINC001073934412	1355970188	/nfs/dbraw/zinc/97/01/88/1355970188.db2.gz	VVWZFYFPIQXGRA-LJQANCHMSA-N	0	3	327.472	3.417	20	30		EGEDHN
CC[C@H](F)C(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(C#N)cc1	ZINC001074051064	1356056124	/nfs/dbraw/zinc/05/61/24/1356056124.db2.gz	ZUBNWYLRRBJKHF-MSOLQXFVSA-N	0	3	331.435	3.119	20	30		EGEDHN
C[C@H]1[C@@H](NCc2ccc(C#N)s2)CCN1C(=O)C[C@H]1C=CCCC1	ZINC001074707984	1356227103	/nfs/dbraw/zinc/22/71/03/1356227103.db2.gz	ZZTGNZCVVWHFNS-MPGHIAIKSA-N	0	3	343.496	3.445	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCO[C@@H]1C1CCN(C(=O)C=C(C)C)CC1	ZINC001075400506	1356357629	/nfs/dbraw/zinc/35/76/29/1356357629.db2.gz	YMHUWNYLZNIIKY-SJLPKXTDSA-N	0	3	340.895	3.081	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@@H](CC)OC3CCCCC3)[C@@H]2C1	ZINC001075787640	1356422596	/nfs/dbraw/zinc/42/25/96/1356422596.db2.gz	TYMQMIYGFDXQKV-QXAKKESOSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)[C@@H](CC)Cc3cccc(C)c3)[C@@H]2C1	ZINC001076328084	1356549513	/nfs/dbraw/zinc/54/95/13/1356549513.db2.gz	DLTGLIFHXAWDHE-SLFFLAALSA-N	0	3	326.484	3.282	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3ccc(Cl)cc3Cl)[C@@H]2C1	ZINC001076490046	1356591993	/nfs/dbraw/zinc/59/19/93/1356591993.db2.gz	UMVOVAPHJHJYKU-BLLLJJGKSA-N	0	3	337.250	3.163	20	30		EGEDHN
C=CCCN1C[C@@H]2CCN(C(=O)c3cnc(CC(C)C)s3)[C@@H]2C1	ZINC001076626957	1356637681	/nfs/dbraw/zinc/63/76/81/1356637681.db2.gz	FWAOXPFAZWEWOY-LSDHHAIUSA-N	0	3	333.501	3.064	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)C1(C(F)(F)F)CCC1	ZINC001099120768	1363635054	/nfs/dbraw/zinc/63/50/54/1363635054.db2.gz	DZDHXNTXWLYIIJ-AWEZNQCLSA-N	0	3	344.421	3.349	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)CCc1csc(C)n1	ZINC001099257472	1363717967	/nfs/dbraw/zinc/71/79/67/1363717967.db2.gz	GAYATLPHXMWEKU-INIZCTEOSA-N	0	3	335.517	3.177	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2ccc(F)c(C)c2)C[C@H]1C(F)(F)F	ZINC001099297790	1363737068	/nfs/dbraw/zinc/73/70/68/1363737068.db2.gz	PYLWLVQJDVNCIA-UKRRQHHQSA-N	0	3	344.352	3.303	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCCO[C@@H](CNCc2cccc(F)c2)C1	ZINC001078460393	1356977551	/nfs/dbraw/zinc/97/75/51/1356977551.db2.gz	RUHVVVIPHFXOOO-ICSRJNTNSA-N	0	3	348.462	3.135	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2cnoc2C(C)C)C12CCC2	ZINC001078768276	1357074682	/nfs/dbraw/zinc/07/46/82/1357074682.db2.gz	ODURMFBBRQGHBZ-ZIAGYGMSSA-N	0	3	337.851	3.181	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cnoc2C(C)C)C12CCC2	ZINC001078768273	1357074787	/nfs/dbraw/zinc/07/47/87/1357074787.db2.gz	ODURMFBBRQGHBZ-KBPBESRZSA-N	0	3	337.851	3.181	20	30		EGEDHN
C=C(C)C[NH2+][C@@H]1CN(C(=O)c2ccccc2[O-])C[C@H]1c1ccccc1	ZINC001081090596	1357822154	/nfs/dbraw/zinc/82/21/54/1357822154.db2.gz	NLMVSPBWSIUXIF-RBUKOAKNSA-N	0	3	336.435	3.166	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2ccc(CC)s2)C[C@H]1c1ccccc1	ZINC001081141496	1357844623	/nfs/dbraw/zinc/84/46/23/1357844623.db2.gz	STZVMMYIRWANLC-ZWKOTPCHSA-N	0	3	338.476	3.142	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2ccc([C@@H](C)CC)cc2)[C@H](OC)C1	ZINC001082386330	1358024932	/nfs/dbraw/zinc/02/49/32/1358024932.db2.gz	BVZWRDXQRCXEDD-KFKAGJAMSA-N	0	3	330.472	3.205	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2ccc(C(C)C)s2)[C@H](OC)C1	ZINC001082389348	1358025360	/nfs/dbraw/zinc/02/53/60/1358025360.db2.gz	KGSBPWZUWKJTEO-HUUCEWRRSA-N	0	3	336.501	3.267	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001082722129	1358079901	/nfs/dbraw/zinc/07/99/01/1358079901.db2.gz	ZAYVWAVMDXSWGP-QBIMZIAESA-N	0	3	331.485	3.159	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)[C@H]3CCCC(C)(C)C3)[C@H]2C1	ZINC001083286971	1358129325	/nfs/dbraw/zinc/12/93/25/1358129325.db2.gz	LWYQCNRCCRGIFF-OKZBNKHCSA-N	0	3	334.504	3.081	20	30		EGEDHN
Cc1cccc([C@@H](C)N2CC[C@@H]3CN(C(=O)c4c[nH]c(C#N)c4)[C@@H]3C2)c1	ZINC001084294491	1358186833	/nfs/dbraw/zinc/18/68/33/1358186833.db2.gz	SQBBBMKFRLZQGA-WRWLIDTKSA-N	0	3	348.450	3.102	20	30		EGEDHN
C=CCn1cccc1C(=O)N1C[C@H]2CCN(Cc3ccccc3)C[C@H]21	ZINC001084409120	1358209151	/nfs/dbraw/zinc/20/91/51/1358209151.db2.gz	KGCQTNDNICGTBA-UYAOXDASSA-N	0	3	335.451	3.021	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3oc4ccccc4c3OC)[C@@H]2C1	ZINC001084573480	1358240621	/nfs/dbraw/zinc/24/06/21/1358240621.db2.gz	VSHMGZXRECJSLL-GDBMZVCRSA-N	0	3	340.423	3.164	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3coc(C4CCCC4)n3)[C@@H]2C1	ZINC001084747827	1358298124	/nfs/dbraw/zinc/29/81/24/1358298124.db2.gz	IRTVADLRQVQLHF-NVXWUHKLSA-N	0	3	329.444	3.055	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)c3cc(Cl)cc(Cl)c3)[C@@H]2C1	ZINC001084794561	1358313064	/nfs/dbraw/zinc/31/30/64/1358313064.db2.gz	JRFGULPFJUVPIM-MLGOLLRUSA-N	0	3	337.250	3.163	20	30		EGEDHN
Cc1cccc(Cl)c1CN1CC[C@@H]2CCN(C(=O)[C@H](C)C#N)C[C@@H]21	ZINC001084906695	1358343709	/nfs/dbraw/zinc/34/37/09/1358343709.db2.gz	CVWHPRJRJUDQGN-RKVPGOIHSA-N	0	3	345.874	3.231	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@H](CC)Oc3ccccc3F)C[C@@H]21	ZINC001085075168	1358384214	/nfs/dbraw/zinc/38/42/14/1358384214.db2.gz	SYJDTSAWTASQJU-BPQIPLTHSA-N	0	3	346.446	3.092	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)C[C@H]1C=CCC1	ZINC001085127449	1358404140	/nfs/dbraw/zinc/40/41/40/1358404140.db2.gz	CYVVJGXGPORSOK-RRFJBIMHSA-N	0	3	341.293	3.268	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cc(C)cn2ccnc12	ZINC001085283234	1358451165	/nfs/dbraw/zinc/45/11/65/1358451165.db2.gz	HIBHFCZWWZFZQZ-HZPDHXFCSA-N	0	3	346.862	3.026	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H]1OCCc2ccccc21	ZINC001085292709	1358455099	/nfs/dbraw/zinc/45/50/99/1358455099.db2.gz	AIFGKRPEMAIZBD-KURKYZTESA-N	0	3	348.874	3.070	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1OCCc2ccccc21	ZINC001085292710	1358455146	/nfs/dbraw/zinc/45/51/46/1358455146.db2.gz	AIFGKRPEMAIZBD-KZNAEPCWSA-N	0	3	348.874	3.070	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCC[C@H]2NCc2cnc(C)s2)C1	ZINC001085324901	1358467704	/nfs/dbraw/zinc/46/77/04/1358467704.db2.gz	PHPJNYGKOQNEIZ-HZPDHXFCSA-N	0	3	333.501	3.325	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)Cc1ccsc1C	ZINC001085353776	1358476276	/nfs/dbraw/zinc/47/62/76/1358476276.db2.gz	XIHZYHCJVWDDOF-HUUCEWRRSA-N	0	3	326.893	3.369	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccc2[nH]c(C)nc2c1	ZINC001085376737	1358481718	/nfs/dbraw/zinc/48/17/18/1358481718.db2.gz	RVSMBWFIUATLIO-HUUCEWRRSA-N	0	3	346.862	3.254	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1cc(C2CCCCC2)n[nH]1	ZINC001085644132	1358655927	/nfs/dbraw/zinc/65/59/27/1358655927.db2.gz	GVGHCJWTNZATDF-MRXNPFEDSA-N	0	3	330.476	3.180	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cnc(-c2ccccc2)o1	ZINC001085656910	1358662568	/nfs/dbraw/zinc/66/25/68/1358662568.db2.gz	CIVLYJNWQGZYFO-KRWDZBQOSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@H]1CCN(c2ccccc2)C1	ZINC001085668351	1358673177	/nfs/dbraw/zinc/67/31/77/1358673177.db2.gz	BCFHGRIDIKLTFB-ICSRJNTNSA-N	0	3	341.499	3.012	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc(C)n([C@H](C)C2CC2)n1	ZINC001085685321	1358686860	/nfs/dbraw/zinc/68/68/60/1358686860.db2.gz	OWEUWVZZTCALRZ-AEFFLSMTSA-N	0	3	344.503	3.275	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc2c(c1)[C@@H](C)CO2	ZINC001085775850	1358749146	/nfs/dbraw/zinc/74/91/46/1358749146.db2.gz	DCWKHHUXIQKTTN-DOTOQJQBSA-N	0	3	328.456	3.295	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N(C)C[C@H]1CCN1CCC1=CCCCC1	ZINC001085827043	1358795489	/nfs/dbraw/zinc/79/54/89/1358795489.db2.gz	GKZXYVQBSPTTJD-QRVBRYPASA-N	0	3	332.488	3.001	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N(C)C[C@@H]1CCN1CCCC1CCC1	ZINC001085864515	1358830085	/nfs/dbraw/zinc/83/00/85/1358830085.db2.gz	BNMBYSVZSUAAAB-UFYCRDLUSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccnc(OC2CCC2)c1	ZINC001085897212	1358856401	/nfs/dbraw/zinc/85/64/01/1358856401.db2.gz	YTYDJWDSLSBASY-KRWDZBQOSA-N	0	3	343.471	3.125	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccnc(C2CCCC2)n1	ZINC001085900138	1358857570	/nfs/dbraw/zinc/85/75/70/1358857570.db2.gz	XLACUINOTKKGEY-QGZVFWFLSA-N	0	3	342.487	3.247	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1cc(F)c(F)cc1Cl	ZINC001085956606	1358913666	/nfs/dbraw/zinc/91/36/66/1358913666.db2.gz	GXKDLOMPHIXMQN-LLVKDONJSA-N	0	3	328.790	3.341	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc(Cl)ccc1OC	ZINC001085959148	1358917155	/nfs/dbraw/zinc/91/71/55/1358917155.db2.gz	ULBYWUHYTNWOLV-HNNXBMFYSA-N	0	3	336.863	3.461	20	30		EGEDHN
CC1(C)CC(C(=O)NC[C@H]2C[C@@H](NCc3cc(C#N)ccc3F)C2)C1	ZINC001086077287	1358989092	/nfs/dbraw/zinc/98/90/92/1358989092.db2.gz	RDJFHARLOVUURY-KDYLLFBJSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(C(C)C)nc2C)C1	ZINC001086200024	1359025036	/nfs/dbraw/zinc/02/50/36/1359025036.db2.gz	DOJIDNHHHYNZCI-GASCZTMLSA-N	0	3	335.879	3.364	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc(CC)c(C)s2)C1	ZINC001086267411	1359048639	/nfs/dbraw/zinc/04/86/39/1359048639.db2.gz	DALRPXWVERBAHV-XBXGTLAGSA-N	0	3	326.893	3.469	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@H]2CCc3ccccc3C2)C1	ZINC001086490888	1359117270	/nfs/dbraw/zinc/11/72/70/1359117270.db2.gz	GYVWKHILHHVJMH-WBAXXEDZSA-N	0	3	332.875	3.028	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(OCC)c(C)c2)C1	ZINC001086495495	1359119583	/nfs/dbraw/zinc/11/95/83/1359119583.db2.gz	VKMDWHZYVOOTGN-KOMQPUFPSA-N	0	3	336.863	3.244	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2coc(C3CCCC3)n2)C1	ZINC001086518620	1359126761	/nfs/dbraw/zinc/12/67/61/1359126761.db2.gz	QIDZDTLUPKDOQT-MQMHXKEQSA-N	0	3	337.851	3.183	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@@H]2Cc3ccc(Cl)cc32)C1	ZINC001086544158	1359138424	/nfs/dbraw/zinc/13/84/24/1359138424.db2.gz	DXVFJSAKWRIHHA-DJSGYFEHSA-N	0	3	339.266	3.217	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc3ncsc3c2)C1	ZINC001086546912	1359140269	/nfs/dbraw/zinc/14/02/69/1359140269.db2.gz	HTVVYDXZMKVCMU-AULYBMBSSA-N	0	3	335.860	3.147	20	30		EGEDHN
CC(C)=CCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2ccc(C#N)[nH]2)C1	ZINC001086583943	1359155498	/nfs/dbraw/zinc/15/54/98/1359155498.db2.gz	VCSMKDONNQRVSQ-AZUAARDMSA-N	0	3	348.450	3.050	20	30		EGEDHN
C=C(C)CN1C[C@@H](c2ccccc2)[C@H](NC(=O)Cc2ccc(C)o2)C1	ZINC001086583739	1359155899	/nfs/dbraw/zinc/15/58/99/1359155899.db2.gz	CWQZUAPXVIDFRE-VQTJNVASSA-N	0	3	338.451	3.291	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)C2CC3(CCC3)C2)C1	ZINC001086603960	1359161546	/nfs/dbraw/zinc/16/15/46/1359161546.db2.gz	FCRGSFGWUZAJGW-VQTJNVASSA-N	0	3	336.479	3.174	20	30		EGEDHN
C=C(C)CN1C[C@@H](c2ccccc2)[C@H](NC(=O)[C@@H]2Cc3ccccc32)C1	ZINC001086607248	1359163111	/nfs/dbraw/zinc/16/31/11/1359163111.db2.gz	RRGHABVEGUJVCI-BHIFYINESA-N	0	3	346.474	3.487	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](CNCc2nc3ccccc3o2)[C@@H](C)C1	ZINC001184007227	1387380706	/nfs/dbraw/zinc/38/07/06/1387380706.db2.gz	BMFQBQCBYVREMU-HOTGVXAUSA-N	0	3	341.455	3.368	20	30		EGEDHN
Cc1cocc1C(=O)NC[C@H]1CC[C@@H](NCc2ccccc2C#N)C1	ZINC001086778677	1359199144	/nfs/dbraw/zinc/19/91/44/1359199144.db2.gz	ANCXVRPOAJPSTK-MAUKXSAKSA-N	0	3	337.423	3.148	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ncoc2C(C)C)C1	ZINC001086848095	1359212981	/nfs/dbraw/zinc/21/29/81/1359212981.db2.gz	ZTTTWGKQQQEFGF-QWHCGFSZSA-N	0	3	325.840	3.039	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H]3C[C@H]3c3ccsc3)C2)CC1	ZINC001086929457	1359254483	/nfs/dbraw/zinc/25/44/83/1359254483.db2.gz	IPWXQUUJNGQYAM-RYQLBKOJSA-N	0	3	342.508	3.188	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cc(C)n(CC)c3C)C2)CC1	ZINC001086931665	1359255746	/nfs/dbraw/zinc/25/57/46/1359255746.db2.gz	OFOIITAJHZXKGL-KRWDZBQOSA-N	0	3	341.499	3.075	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc4ncccc4c3)C2)CC1	ZINC001086941014	1359262628	/nfs/dbraw/zinc/26/26/28/1359262628.db2.gz	HFSDSGZWUOAFKF-QGZVFWFLSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cc(F)cc(Cl)c3)C2)CC1	ZINC001086945131	1359265743	/nfs/dbraw/zinc/26/57/43/1359265743.db2.gz	RZCGDMBGXJONFO-AWEZNQCLSA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc(C)ccc3F)C2)CC1	ZINC001086945182	1359266471	/nfs/dbraw/zinc/26/64/71/1359266471.db2.gz	UKVXRZNEQARLCA-QGZVFWFLSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc(Cl)cs3)C2)CC1	ZINC001086947214	1359268517	/nfs/dbraw/zinc/26/85/17/1359268517.db2.gz	RYPVMDBZNMGTLD-CYBMUJFWSA-N	0	3	336.888	3.351	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@H](C=C)c3ccccc3)C2)CC1	ZINC001086955963	1359276547	/nfs/dbraw/zinc/27/65/47/1359276547.db2.gz	AQWGHLHRRIHNTL-AZUAARDMSA-N	0	3	336.479	3.292	20	30		EGEDHN
C[C@@H]1CCN(C(=O)CC2CC2)[C@H](CNCc2ccc(C#N)c(F)c2)C1	ZINC001087109190	1359289017	/nfs/dbraw/zinc/28/90/17/1359289017.db2.gz	AZHSLLAYXXCQAR-KDOFPFPSSA-N	0	3	343.446	3.214	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC001087123561	1359297102	/nfs/dbraw/zinc/29/71/02/1359297102.db2.gz	RFMUHGWDLSPJHR-RKVPGOIHSA-N	0	3	345.462	3.460	20	30		EGEDHN
C/C=C(\C)C(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccc(C#N)s1	ZINC001087145281	1359305726	/nfs/dbraw/zinc/30/57/26/1359305726.db2.gz	OTJYWJXTHRTOCJ-PHEBABASSA-N	0	3	331.485	3.303	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(C)s3)C(C)(C)[C@@H]21	ZINC001087266583	1359338274	/nfs/dbraw/zinc/33/82/74/1359338274.db2.gz	NUIBVOGRXPLBJC-DJIMGWMZSA-N	0	3	330.497	3.299	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cscc1C	ZINC001087278289	1359354051	/nfs/dbraw/zinc/35/40/51/1359354051.db2.gz	FCDSZBOBLPTKEX-HYVNUMGLSA-N	0	3	330.497	3.299	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3[nH]ccc3C3CC3)C(C)(C)[C@H]21	ZINC001087289892	1359368445	/nfs/dbraw/zinc/36/84/45/1359368445.db2.gz	UATCIHXURCKDSD-NEWSRXKRSA-N	0	3	339.483	3.134	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3[nH]ccc3C3CC3)C(C)(C)[C@@H]21	ZINC001087289891	1359368464	/nfs/dbraw/zinc/36/84/64/1359368464.db2.gz	UATCIHXURCKDSD-BHIYHBOVSA-N	0	3	339.483	3.134	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(C)c(F)cc3F)C(C)(C)[C@@H]21	ZINC001087291205	1359370215	/nfs/dbraw/zinc/37/02/15/1359370215.db2.gz	QIOMZNCPWMLDLO-FSPWUOQZSA-N	0	3	346.421	3.125	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3c[nH]c4ccccc34)C(C)(C)[C@@H]21	ZINC001087293356	1359374660	/nfs/dbraw/zinc/37/46/60/1359374660.db2.gz	COIUQXVWULJFPZ-ATZDWAIDSA-N	0	3	335.451	3.020	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccn4ccccc34)C(C)(C)[C@@H]21	ZINC001087295565	1359376600	/nfs/dbraw/zinc/37/66/00/1359376600.db2.gz	KYURKNVBXAIXFW-MISYRCLQSA-N	0	3	349.478	3.181	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)Cc3cccc(C)c3)C(C)(C)[C@@H]21	ZINC001087299848	1359382499	/nfs/dbraw/zinc/38/24/99/1359382499.db2.gz	CIIVPUOTOGXEND-HMXCVIKNSA-N	0	3	338.495	3.166	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc[nH]c1CCC	ZINC001087300616	1359383482	/nfs/dbraw/zinc/38/34/82/1359383482.db2.gz	NYGWROJYEJPXLC-NZSAHSFTSA-N	0	3	341.499	3.209	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc(F)c(C)c3)C(C)(C)[C@H]21	ZINC001087300943	1359383806	/nfs/dbraw/zinc/38/38/06/1359383806.db2.gz	STZXTTNKKPOAFO-NEWSRXKRSA-N	0	3	342.458	3.376	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)C3CC4(CCC4)C3)C(C)(C)[C@@H]21	ZINC001087301116	1359384470	/nfs/dbraw/zinc/38/44/70/1359384470.db2.gz	WJBHEVZCGCHHHR-KZNAEPCWSA-N	0	3	328.500	3.195	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccoc3C3CC3)C(C)(C)[C@@H]21	ZINC001087302151	1359385339	/nfs/dbraw/zinc/38/53/39/1359385339.db2.gz	OGWPSMZEEPWFJA-KBAYOESNSA-N	0	3	326.440	3.009	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3occc3CC)C(C)(C)[C@H]21	ZINC001087303902	1359386631	/nfs/dbraw/zinc/38/66/31/1359386631.db2.gz	UTDNNUXOJCTPFQ-NJAFHUGGSA-N	0	3	328.456	3.084	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1csc(C)c1	ZINC001087308267	1359395341	/nfs/dbraw/zinc/39/53/41/1359395341.db2.gz	NSERDKGWYKICFC-IXDOHACOSA-N	0	3	330.497	3.299	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(C)c(CC)o3)C(C)(C)[C@H]21	ZINC001087312532	1359400842	/nfs/dbraw/zinc/40/08/42/1359400842.db2.gz	GSEUHLASIZTJHQ-LZQZEXGQSA-N	0	3	342.483	3.393	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc4ccn(C)c4c3)C(C)(C)[C@H]21	ZINC001087313768	1359402831	/nfs/dbraw/zinc/40/28/31/1359402831.db2.gz	ZZSSSGHCIYKKDQ-RLLQIKCJSA-N	0	3	349.478	3.030	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc(C(F)F)o1	ZINC001087316417	1359407045	/nfs/dbraw/zinc/40/70/45/1359407045.db2.gz	RFOHYZFBAVZCIB-BYCMXARLSA-N	0	3	336.382	3.069	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(C4CC4)cc3)C(C)(C)[C@H]21	ZINC001087317863	1359409325	/nfs/dbraw/zinc/40/93/25/1359409325.db2.gz	NZOXNWMOXFIRNY-AQNXPRMDSA-N	0	3	336.479	3.416	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)Cc3ccccc3C)C(C)(C)[C@H]21	ZINC001087317941	1359409944	/nfs/dbraw/zinc/40/99/44/1359409944.db2.gz	OYGKZNGIZGSVFM-NRSPTQNISA-N	0	3	338.495	3.166	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)C2CC(F)(F)C2)C1	ZINC001087424555	1359460094	/nfs/dbraw/zinc/46/00/94/1359460094.db2.gz	FGGJVOQQKCFCOE-QZTJIDSGSA-N	0	3	346.421	3.029	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)CC2CCC2)CCN1Cc1cccc(C#N)c1	ZINC001087530147	1359513130	/nfs/dbraw/zinc/51/31/30/1359513130.db2.gz	LKSRSMKBMAVXTK-RBUKOAKNSA-N	0	3	325.456	3.218	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cncc(OC(C)C)c2)[C@H]1CC	ZINC001087686347	1359589123	/nfs/dbraw/zinc/58/91/23/1359589123.db2.gz	YXTPELLANXPXCB-ZWKOTPCHSA-N	0	3	331.460	3.028	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)C2(c3ccccc3F)CC2)[C@H]1CC	ZINC001087781741	1359641208	/nfs/dbraw/zinc/64/12/08/1359641208.db2.gz	BXBGBHHCDWFTHM-ZWKOTPCHSA-N	0	3	330.447	3.403	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CN(C(=O)C[C@H]4C=CCC4)C[C@@H]3C2)c1	ZINC001087879545	1359694464	/nfs/dbraw/zinc/69/44/64/1359694464.db2.gz	UAJZGXAEOCQZFS-WMQCIHAUSA-N	0	3	349.478	3.195	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)C(C)(C)c3ccc(Cl)cc3)C[C@@H]2C1	ZINC001088088351	1359751872	/nfs/dbraw/zinc/75/18/72/1359751872.db2.gz	PKQYRDPXRZFWLN-CVEARBPZSA-N	0	3	344.886	3.031	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3cc4cc(C)ccc4o3)C[C@@H]2C1	ZINC001088212564	1359797750	/nfs/dbraw/zinc/79/77/50/1359797750.db2.gz	ZGKLKGYPVJOJMP-AEFFLSMTSA-N	0	3	336.435	3.158	20	30		EGEDHN
C=CCN1CC[C@@H](OCC2CCN(C(=O)[C@@H]3CCC(C)(C)C3)CC2)C1	ZINC001088238282	1359809846	/nfs/dbraw/zinc/80/98/46/1359809846.db2.gz	QHCYSJPLKXWJJB-RTBURBONSA-N	0	3	348.531	3.328	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCCCC[C@H](NCC(=C)Cl)C2)cc1	ZINC001088357574	1359841786	/nfs/dbraw/zinc/84/17/86/1359841786.db2.gz	FLOGURXIRWPFBT-SFHVURJKSA-N	0	3	330.859	3.395	20	30		EGEDHN
C=C(Br)CN[C@H]1CCCCCN(C(=O)C2(CC)CC2)C1	ZINC001088376569	1359859262	/nfs/dbraw/zinc/85/92/62/1359859262.db2.gz	KJLLUQCBMVZAID-AWEZNQCLSA-N	0	3	343.309	3.446	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2c[nH]c3cccnc23)C1	ZINC001088413914	1359884704	/nfs/dbraw/zinc/88/47/04/1359884704.db2.gz	RWKQRGMQKOMMDC-CQSZACIVSA-N	0	3	346.862	3.290	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)Cc2ccccc2F)C1	ZINC001088421336	1359890956	/nfs/dbraw/zinc/89/09/56/1359890956.db2.gz	NFAXLAUGRSXYBJ-MRXNPFEDSA-N	0	3	338.854	3.482	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C2(c3ccc(F)cc3)CC2)CC(C)(C)C1	ZINC001089398668	1360398766	/nfs/dbraw/zinc/39/87/66/1360398766.db2.gz	KJXHPZGNBTTWSK-GOSISDBHSA-N	0	3	342.458	3.097	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2coc3cc(F)ccc23)CC(C)(C)C1	ZINC001089426881	1360419901	/nfs/dbraw/zinc/41/99/01/1360419901.db2.gz	LZVNKNMANQYRSW-OAHLLOKOSA-N	0	3	342.414	3.426	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(-c3ccco3)o2)CC(C)(C)C1	ZINC001089438864	1360428945	/nfs/dbraw/zinc/42/89/45/1360428945.db2.gz	MSXQDFQGRJWZJL-OAHLLOKOSA-N	0	3	340.423	3.393	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CCN(C/C=C/Cl)CC(C)(C)C2)c1	ZINC001089488530	1360468295	/nfs/dbraw/zinc/46/82/95/1360468295.db2.gz	VOGRRLGQKXPBBQ-UABRLCRWSA-N	0	3	345.874	3.036	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(OC)cc2Cl)CC(C)(C)C1	ZINC001089520856	1360488853	/nfs/dbraw/zinc/48/88/53/1360488853.db2.gz	AQEXYURMSXWKDK-AWEZNQCLSA-N	0	3	348.874	3.202	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ncoc2C(C)C)CC(C)(C)C1	ZINC001089535989	1360495048	/nfs/dbraw/zinc/49/50/48/1360495048.db2.gz	ZJLAQSCBKDHGLA-OAHLLOKOSA-N	0	3	331.460	3.042	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc(CC)c(CC)o2)CC(C)(C)C1	ZINC001089540730	1360497974	/nfs/dbraw/zinc/49/79/74/1360497974.db2.gz	XATYNVRLRJUELA-MRXNPFEDSA-N	0	3	330.472	3.258	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C(F)F)o2)CC(C)(C)C1	ZINC001089548681	1360502459	/nfs/dbraw/zinc/50/24/59/1360502459.db2.gz	OWSNFLIZEKNRSZ-CYBMUJFWSA-N	0	3	338.398	3.461	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@H]2Cc3ccc(Cl)cc32)CC(C)(C)C1	ZINC001089553571	1360505191	/nfs/dbraw/zinc/50/51/91/1360505191.db2.gz	WQBZRZJEPYKRRV-AEFFLSMTSA-N	0	3	344.886	3.220	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2c(C)nsc2C)CC(C)(C)C1	ZINC001089564713	1360511415	/nfs/dbraw/zinc/51/14/15/1360511415.db2.gz	AWPYZOHWNUWTSO-HNNXBMFYSA-N	0	3	333.501	3.004	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)[C@H]1CCCc2n[nH]cc21	ZINC001089641809	1360554397	/nfs/dbraw/zinc/55/43/97/1360554397.db2.gz	UEKYMTWTJGMTSQ-HOTGVXAUSA-N	0	3	344.503	3.013	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1c[nH]nc1-c1ccoc1	ZINC001089671431	1360581366	/nfs/dbraw/zinc/58/13/66/1360581366.db2.gz	RUBOFPCYTVSJPA-HNNXBMFYSA-N	0	3	342.443	3.076	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1cccc(OC)c1C	ZINC001089703658	1360606170	/nfs/dbraw/zinc/60/61/70/1360606170.db2.gz	NNJUSRSXUSNPJH-INIZCTEOSA-N	0	3	330.472	3.410	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)[C@H]1CCCO[C@H]1C(=C)C	ZINC001089708034	1360611878	/nfs/dbraw/zinc/61/18/78/1360611878.db2.gz	AGNFIBMEBHPPSD-BZSNNMDCSA-N	0	3	334.504	3.151	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc2c(c1)C[C@@H](C)O2	ZINC001089711729	1360615329	/nfs/dbraw/zinc/61/53/29/1360615329.db2.gz	ZNMZSUKPBUKCPT-QAPCUYQASA-N	0	3	342.483	3.416	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc2nccn2c1	ZINC001089721771	1360624185	/nfs/dbraw/zinc/62/41/85/1360624185.db2.gz	KVIBBONDRMKTCA-KRWDZBQOSA-N	0	3	340.471	3.131	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C(C)=C1CCC1	ZINC001089805753	1360671598	/nfs/dbraw/zinc/67/15/98/1360671598.db2.gz	LGPIKTJCJBVTDP-MLHJIOFPSA-N	0	3	334.891	3.408	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1CC2(CCC2)C1	ZINC001089849596	1360696500	/nfs/dbraw/zinc/69/65/00/1360696500.db2.gz	HENHKMSJTYLALQ-HPBDAGMYSA-N	0	3	348.918	3.488	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C(C1CC1)C1CC1	ZINC001089885403	1360718862	/nfs/dbraw/zinc/71/88/62/1360718862.db2.gz	GBABMVOWMNVEMP-MLHJIOFPSA-N	0	3	348.918	3.344	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)[C@@H]2CCC=CCCC2)CC2(CCOCC2)C1	ZINC001089945003	1360757561	/nfs/dbraw/zinc/75/75/61/1360757561.db2.gz	JFPVHXXWWNMWJI-MOPGFXCFSA-N	0	3	346.515	3.296	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](CNCc2oc(CC)nc2C)[C@@H](C)C1	ZINC001184497797	1387473137	/nfs/dbraw/zinc/47/31/37/1387473137.db2.gz	NBPZIKWNAAJSLI-RDJZCZTQSA-N	0	3	347.503	3.476	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)[C@@H](C)c2ccsc2)CC2(CCOCC2)C1	ZINC001089959913	1360767294	/nfs/dbraw/zinc/76/72/94/1360767294.db2.gz	UKIIDUHVUAXTKZ-DOTOQJQBSA-N	0	3	348.512	3.025	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](CNCc2nc(C)cs2)[C@@H](C)C1	ZINC001184499447	1387474856	/nfs/dbraw/zinc/47/48/56/1387474856.db2.gz	ZSYUAFRHFRJXLY-GOEBONIOSA-N	0	3	335.517	3.382	20	30		EGEDHN
CC[C@H](C(=O)N[C@H](C)CCCCNc1cccc(F)c1C#N)N(C)C	ZINC001090103453	1360826434	/nfs/dbraw/zinc/82/64/34/1360826434.db2.gz	OTMOSRZANJUDKP-RDTXWAMCSA-N	0	3	348.466	3.124	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccnc(-c3ccco3)c2)C1	ZINC001091089954	1360990155	/nfs/dbraw/zinc/99/01/55/1360990155.db2.gz	BTPJZZIDBGKYBR-UHFFFAOYSA-N	0	3	345.830	3.192	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cnn([C@H](C)CC)c2C)C1	ZINC001091318750	1361042404	/nfs/dbraw/zinc/04/24/04/1361042404.db2.gz	MIZUSOMJFLTBEJ-LRVUVFPRSA-N	0	3	338.883	3.013	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc3cccc(F)c3o2)C1	ZINC001091375104	1361067191	/nfs/dbraw/zinc/06/71/91/1361067191.db2.gz	OBCSKVJXZXTSAE-UHFFFAOYSA-N	0	3	336.794	3.422	20	30		EGEDHN
C[C@@]12CN(Cc3ccc(C#N)cc3)C[C@@H]1CN(C(=O)CCC1CC1)C2	ZINC001091553151	1361142575	/nfs/dbraw/zinc/14/25/75/1361142575.db2.gz	ZQLIBETYQLWHTJ-CTNGQTDRSA-N	0	3	337.467	3.029	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N1CC[C@@H](NCc2cc(C)ccc2F)C1	ZINC001184646231	1387502866	/nfs/dbraw/zinc/50/28/66/1387502866.db2.gz	SVLCHFTUZFNBDE-XLIONFOSSA-N	0	3	348.462	3.053	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@H](C)c3ccc(Cl)cc3)C[C@]2(C)C1	ZINC001091974904	1361264473	/nfs/dbraw/zinc/26/44/73/1361264473.db2.gz	XYOCUZOSMTZUFR-MDYRTPRTSA-N	0	3	344.886	3.247	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)CC(C)(C)C3CCCCC3)C[C@]2(C)C1	ZINC001092199432	1361321412	/nfs/dbraw/zinc/32/14/12/1361321412.db2.gz	KJCRFTAGJUWOSV-NQIIRXRSSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@@H](CC)c3ccc(F)cc3)C[C@]2(C)C1	ZINC001092308160	1361360941	/nfs/dbraw/zinc/36/09/41/1361360941.db2.gz	FZJLNLDORKHUJD-LMNJBCLMSA-N	0	3	342.458	3.123	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc(C(C)C)s3)C[C@]2(C)C1	ZINC001092310044	1361361406	/nfs/dbraw/zinc/36/14/06/1361361406.db2.gz	HRYXLDGMEMXGOV-BEFAXECRSA-N	0	3	330.497	3.289	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)c2sccc2C)CC1	ZINC001093353055	1361567815	/nfs/dbraw/zinc/56/78/15/1361567815.db2.gz	PXETUWXBWPNHNR-SFHVURJKSA-N	0	3	342.508	3.396	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)c2sccc2F)CC1	ZINC001093370300	1361579382	/nfs/dbraw/zinc/57/93/82/1361579382.db2.gz	RJFWWKCMRXMVOI-KRWDZBQOSA-N	0	3	346.471	3.227	20	30		EGEDHN
CC[C@@H](F)CN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C#CC2CC2)CC1	ZINC001093370757	1361580110	/nfs/dbraw/zinc/58/01/10/1361580110.db2.gz	YWWKKUZNUNUMBO-QUCCMNQESA-N	0	3	346.490	3.241	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)[C@@H](C)C(C)(C)C)CC1	ZINC001093372374	1361581701	/nfs/dbraw/zinc/58/17/01/1361581701.db2.gz	CEYQNWGPJDAVSV-SJLPKXTDSA-N	0	3	330.516	3.395	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)[C@H]2Cc3ccccc32)CC1	ZINC001093377088	1361587816	/nfs/dbraw/zinc/58/78/16/1361587816.db2.gz	PXBCGUARFHJUKY-LEWJYISDSA-N	0	3	348.490	3.053	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@H]2Cc3ccccc32)CC1	ZINC001093377092	1361587906	/nfs/dbraw/zinc/58/79/06/1361587906.db2.gz	PXBCGUARFHJUKY-SFTDATJTSA-N	0	3	348.490	3.053	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)[C@@H](C)c2ccco2)CC1	ZINC001093378500	1361588918	/nfs/dbraw/zinc/58/89/18/1361588918.db2.gz	PWRFSTYRZJTIHI-QFBILLFUSA-N	0	3	340.467	3.109	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@@H](C)c2ccco2)CC1	ZINC001093378499	1361589040	/nfs/dbraw/zinc/58/90/40/1361589040.db2.gz	PWRFSTYRZJTIHI-LPHOPBHVSA-N	0	3	340.467	3.109	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C[C@@H](C)C2CC2)CC1	ZINC001093383029	1361595028	/nfs/dbraw/zinc/59/50/28/1361595028.db2.gz	HMQDEWYXCWNLOX-UZLBHIALSA-N	0	3	328.500	3.149	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H](CNCc2ccn(C(C)C)n2)[C@H](C)C1	ZINC001094018201	1361725168	/nfs/dbraw/zinc/72/51/68/1361725168.db2.gz	KZOLMZJWEKERHK-HLIPFELVSA-N	0	3	346.519	3.250	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3ccc(C)cc3Cl)CCC[C@@H]12	ZINC001094519279	1361841151	/nfs/dbraw/zinc/84/11/51/1361841151.db2.gz	DHFIYRHTWZCEIK-IEBWSBKVSA-N	0	3	330.859	3.256	20	30		EGEDHN
O=C(NC[C@]12CCC[C@H]1N(CC#Cc1ccccc1)CC2)[C@@H]1CC12CC2	ZINC001094522662	1361842663	/nfs/dbraw/zinc/84/26/63/1361842663.db2.gz	CDYUOTACTNENRN-MIZPHKNDSA-N	0	3	348.490	3.199	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cccc(C(F)F)c1F)C2	ZINC001095428070	1362137482	/nfs/dbraw/zinc/13/74/82/1362137482.db2.gz	FTSJSXGMHGSBFK-UGFHNGPFSA-N	0	3	336.357	3.122	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3CC[C@@H](C)F)cc1	ZINC001095634619	1362191774	/nfs/dbraw/zinc/19/17/74/1362191774.db2.gz	XIYAGSFNDMRSDY-JZGRTCEGSA-N	0	3	346.446	3.335	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1ccc(C)cc1Cl)C2	ZINC001095637437	1362192906	/nfs/dbraw/zinc/19/29/06/1362192906.db2.gz	SLDLORQOVVCTCV-NJAFHUGGSA-N	0	3	332.875	3.489	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1c(C)cccc1Cl)C2	ZINC001095687528	1362202179	/nfs/dbraw/zinc/20/21/79/1362202179.db2.gz	ICUVHISCUHWNSA-JLSDUUJJSA-N	0	3	332.875	3.489	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1occc1-c1ccccc1)C2	ZINC001095722228	1362212268	/nfs/dbraw/zinc/21/22/68/1362212268.db2.gz	WUEBWDJLVWQTBF-NEWSRXKRSA-N	0	3	334.419	3.305	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](CNCc2cnc(C)o2)[C@@H](C)C1	ZINC001184943917	1387567019	/nfs/dbraw/zinc/56/70/19/1387567019.db2.gz	BKOLMJAMZKWQKF-FUHWJXTLSA-N	0	3	345.487	3.141	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc([C@@H](C)CC)no1)C2	ZINC001096124872	1362395684	/nfs/dbraw/zinc/39/56/84/1362395684.db2.gz	BWYUMDHAQMPRPK-FSDCSDTHSA-N	0	3	331.460	3.489	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](C)c1ccc(Cl)s1)C2	ZINC001096303847	1362457342	/nfs/dbraw/zinc/45/73/42/1362457342.db2.gz	NJPCAGYRJPSYOS-MQYQWHSLSA-N	0	3	336.888	3.250	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](C)c1cccc(OC)c1)C2	ZINC001096615354	1362598497	/nfs/dbraw/zinc/59/84/97/1362598497.db2.gz	LINXISSNTIJLRU-FXECBMLZSA-N	0	3	328.456	3.096	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1cc3ccccc3n1C)C2	ZINC001096635280	1362609251	/nfs/dbraw/zinc/60/92/51/1362609251.db2.gz	LJHRUJMLBMIEPF-KPFFTGBYSA-N	0	3	337.467	3.018	20	30		EGEDHN
Cc1cccc([C@H](C)N2[C@@H]3CC[C@H]2[C@H](NC(=O)c2ccc(C#N)[nH]2)C3)c1	ZINC001096971829	1362799030	/nfs/dbraw/zinc/79/90/30/1362799030.db2.gz	XHMFHCSSKAEIIZ-GVXRKXQCSA-N	0	3	348.450	3.291	20	30		EGEDHN
Cc1ccc(C)c(CN2[C@@H]3CC[C@H]2[C@H](NC(=O)c2ccc(C#N)[nH]2)C3)c1	ZINC001096971145	1362799065	/nfs/dbraw/zinc/79/90/65/1362799065.db2.gz	DAEVSAOTVSEFFN-RLLQIKCJSA-N	0	3	348.450	3.039	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1c(C)noc1CCC)C2	ZINC001097065357	1362831001	/nfs/dbraw/zinc/83/10/01/1362831001.db2.gz	XCBKATBZMIFGKM-OAGGEKHMSA-N	0	3	331.460	3.237	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1c(F)c(F)cc(F)c1F)C2	ZINC001097119162	1362849335	/nfs/dbraw/zinc/84/93/35/1362849335.db2.gz	VWFBGEOAHNVQRM-WQAKAFBOSA-N	0	3	342.336	3.154	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1cc3ccccc3s1)C2	ZINC001097527529	1363041038	/nfs/dbraw/zinc/04/10/38/1363041038.db2.gz	GNPMJJILQYEGPK-NXHRZFHOSA-N	0	3	338.476	3.189	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ncsc1C(F)(F)F)C2	ZINC001097536674	1363045233	/nfs/dbraw/zinc/04/52/33/1363045233.db2.gz	ONUJENBFCMMVGO-MXWKQRLJSA-N	0	3	345.390	3.073	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1noc3c1CC(C)(C)CC3)C2	ZINC001097578764	1363059589	/nfs/dbraw/zinc/05/95/89/1363059589.db2.gz	UEWXQCWGAQCRNJ-BMFZPTHFSA-N	0	3	343.471	3.101	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1ccc(Cl)c(F)c1)C2	ZINC001097924285	1363167782	/nfs/dbraw/zinc/16/77/82/1363167782.db2.gz	IMVCJYSQWOAYCU-XYPHTWIQSA-N	0	3	336.838	3.319	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3[C@H](C)c2ccccc2)cn1	ZINC001098244970	1363267990	/nfs/dbraw/zinc/26/79/90/1363267990.db2.gz	XOPXWWNELOMEBR-DOVSJBTNSA-N	0	3	345.446	3.159	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C1CC(c3cccc(F)c3)C1)C2	ZINC001098504057	1363345617	/nfs/dbraw/zinc/34/56/17/1363345617.db2.gz	UFKRXHSSTRDBHD-XZJNCXDESA-N	0	3	340.442	3.064	20	30		EGEDHN
C=CC(C)(C)C(=O)N1Cc2ccccc2OC2(CCN(CC)CC2)C1	ZINC001098538573	1363359496	/nfs/dbraw/zinc/35/94/96/1363359496.db2.gz	JGLJFVXKFHWNSK-UHFFFAOYSA-N	0	3	342.483	3.474	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)C[C@H](NC(=O)C(C)C)c1ccccc1O2	ZINC001098541908	1363364464	/nfs/dbraw/zinc/36/44/64/1363364464.db2.gz	TVRQOXCSZLWKMA-PXNSSMCTSA-N	0	3	328.456	3.303	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)CCC1CCCC1)C[C@H](C)O2	ZINC001098559513	1363376618	/nfs/dbraw/zinc/37/66/18/1363376618.db2.gz	IVMCRCXIWTVDDO-KRWDZBQOSA-N	0	3	334.504	3.225	20	30		EGEDHN
CCCCCCCNCc1cn([C@@H]2CCN(C(=O)CCCC)C2)nn1	ZINC001098618964	1363401447	/nfs/dbraw/zinc/40/14/47/1363401447.db2.gz	PTJAYKOWXGOURT-GOSISDBHSA-N	0	3	349.523	3.302	20	30		EGEDHN
C/C=C(\C)C(=O)N1CC[C@H](n2cc(CNCCCCCCC)nn2)C1	ZINC001098650117	1363416905	/nfs/dbraw/zinc/41/69/05/1363416905.db2.gz	YKDNDDBBMGDURS-VIHDGPTJSA-N	0	3	347.507	3.078	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccoc1C(C)C)C[C@H](C)O2	ZINC001098663182	1363425052	/nfs/dbraw/zinc/42/50/52/1363425052.db2.gz	YJQCPRARZSQCTJ-INIZCTEOSA-N	0	3	346.471	3.285	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(C(C)(C)C)cn2)C1	ZINC001098841909	1363488987	/nfs/dbraw/zinc/48/89/87/1363488987.db2.gz	RMLYPLMNNLQASS-JXFKEZNVSA-N	0	3	327.472	3.149	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cccc(C)c1	ZINC001098869516	1363499215	/nfs/dbraw/zinc/49/92/15/1363499215.db2.gz	XAGYQOLFNCFLAI-LJQANCHMSA-N	0	3	344.499	3.418	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(C)oc1C	ZINC001098879656	1363502907	/nfs/dbraw/zinc/50/29/07/1363502907.db2.gz	DFFWYWVBRURGLI-QGZVFWFLSA-N	0	3	348.487	3.319	20	30		EGEDHN
C#CCN1C[C@@H]2CCC[C@]2(NC(=O)Cc2ccc(CC(C)C)cc2)C1	ZINC001098929216	1363525015	/nfs/dbraw/zinc/52/50/15/1363525015.db2.gz	MDZYKDIIJJFTLL-UNMCSNQZSA-N	0	3	338.495	3.032	20	30		EGEDHN
C[C@H](C#N)C(=O)NC[C@@H]1CCC(C)(C)CN1CCc1ccccc1F	ZINC001098981893	1363555356	/nfs/dbraw/zinc/55/53/56/1363555356.db2.gz	GTJPLOVTKWXDHP-WBVHZDCISA-N	0	3	345.462	3.135	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(F)c(F)c(F)c2)C1	ZINC001099044806	1363591086	/nfs/dbraw/zinc/59/10/86/1363591086.db2.gz	UYIGTYWRSXGITD-UGSOOPFHSA-N	0	3	338.373	3.264	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@@H]1CCC(C)(C)CN1CCOCC1CCC1	ZINC001099064666	1363603109	/nfs/dbraw/zinc/60/31/09/1363603109.db2.gz	GXOPDNRHUMBNGE-IBGZPJMESA-N	0	3	348.531	3.069	20	30		EGEDHN
C#CCCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(CC)c(CC)o2)C1	ZINC001099123101	1363636670	/nfs/dbraw/zinc/63/66/70/1363636670.db2.gz	RYXMQGPNKKEUAI-JXFKEZNVSA-N	0	3	328.456	3.012	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccsc2C(F)F)C1	ZINC001099138569	1363648250	/nfs/dbraw/zinc/64/82/50/1363648250.db2.gz	DOPCBKRKIUYSHI-ZBEGNZNMSA-N	0	3	326.412	3.456	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)[C@H](C)Oc1cccnc1	ZINC001099221316	1363699408	/nfs/dbraw/zinc/69/94/08/1363699408.db2.gz	ZKWPWZPYGDUYLZ-IRXDYDNUSA-N	0	3	345.487	3.032	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H](C)c1ccco1	ZINC001099230555	1363703740	/nfs/dbraw/zinc/70/37/40/1363703740.db2.gz	UOEBOBYHLACFAN-IAGOWNOFSA-N	0	3	348.487	3.193	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)C[C@@H](C)c1cccnc1	ZINC001099258486	1363719462	/nfs/dbraw/zinc/71/94/62/1363719462.db2.gz	RIERBVFRISMCOY-AEFFLSMTSA-N	0	3	329.488	3.368	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H](C)c1c(C)noc1C	ZINC001099271362	1363725377	/nfs/dbraw/zinc/72/53/77/1363725377.db2.gz	XEEXFZLSYGJXJB-RHSMWYFYSA-N	0	3	345.487	3.025	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2ccccc2CC)C[C@H]1C(F)(F)F	ZINC001099300269	1363738851	/nfs/dbraw/zinc/73/88/51/1363738851.db2.gz	WRNRMAUVTSJGKY-HZPDHXFCSA-N	0	3	340.389	3.418	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)C23CCC(CC2)C3(C)C)C[C@H]1C(F)(F)F	ZINC001099318164	1363747044	/nfs/dbraw/zinc/74/70/44/1363747044.db2.gz	HXKKIAGHCQRYJQ-YXXKGXSTSA-N	0	3	344.421	3.368	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2cccc(C)c2C)C[C@H]1C(F)(F)F	ZINC001099335888	1363757567	/nfs/dbraw/zinc/75/75/67/1363757567.db2.gz	FHTINYRXMHLDFH-HUUCEWRRSA-N	0	3	326.362	3.082	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@H](C)c2ccccc2C)C[C@H]1C(F)(F)F	ZINC001099346808	1363763322	/nfs/dbraw/zinc/76/33/22/1363763322.db2.gz	UAXUMZGNZHWPNZ-FVQBIDKESA-N	0	3	340.389	3.263	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2cnc(C)o2)C1	ZINC001099488796	1363816962	/nfs/dbraw/zinc/81/69/62/1363816962.db2.gz	BYXXXDBQMAJBOM-VDGAXYAQSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2cscn2)C1	ZINC001099489888	1363817964	/nfs/dbraw/zinc/81/79/64/1363817964.db2.gz	VRBUBPGZMGMBSO-SNRMKQJTSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CC(C)(C)C2CC2)CC2(CCOCC2)C1	ZINC001099579315	1363862149	/nfs/dbraw/zinc/86/21/49/1363862149.db2.gz	OUNJZMGOWIQSFB-GOSISDBHSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CCN(Cc2ccccc2C(C)C)C[C@@H]1O	ZINC001099973786	1363994661	/nfs/dbraw/zinc/99/46/61/1363994661.db2.gz	JGHZJTFJNIGJRM-UXHICEINSA-N	0	3	344.499	3.218	20	30		EGEDHN
CCC[C@@H](C)CC(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100180594	1364037596	/nfs/dbraw/zinc/03/75/96/1364037596.db2.gz	AXLMVPYCGXBFAV-QHGAOEGBSA-N	0	3	326.484	3.349	20	30		EGEDHN
C/C=C(/C)C(=O)NCC1CC(NCC#Cc2ccc(Cl)cc2)C1	ZINC001100228783	1364050620	/nfs/dbraw/zinc/05/06/20/1364050620.db2.gz	ZYFUWMZZIQAIKG-BNNQUZSASA-N	0	3	330.859	3.142	20	30		EGEDHN
C#CCCCC(=O)NCC1CC(NCc2cc(Cl)ccc2F)C1	ZINC001100283327	1364067244	/nfs/dbraw/zinc/06/72/44/1364067244.db2.gz	JITRMGAIBQKSID-UHFFFAOYSA-N	0	3	336.838	3.267	20	30		EGEDHN
CC(C)C#CC(=O)NCC1CC(N[C@H](C)c2cc(F)ccc2F)C1	ZINC001100304518	1364073572	/nfs/dbraw/zinc/07/35/72/1364073572.db2.gz	BGJXEWAVGOIAHY-VQCLRJIVSA-N	0	3	334.410	3.170	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCC1CC(NCc2ncccc2C)C1	ZINC001100358178	1364089852	/nfs/dbraw/zinc/08/98/52/1364089852.db2.gz	KHSPWFBZPXGFAB-UHFFFAOYSA-N	0	3	327.472	3.143	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C2(c3ccc(F)cc3)CC2)C1	ZINC001100387090	1364098442	/nfs/dbraw/zinc/09/84/42/1364098442.db2.gz	MNGBCNAYRYYVMD-UHFFFAOYSA-N	0	3	336.838	3.094	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)Cc2cncc3ccccc32)C1	ZINC001100418367	1364107888	/nfs/dbraw/zinc/10/78/88/1364107888.db2.gz	PAMBHMMPODMGTB-UHFFFAOYSA-N	0	3	343.858	3.014	20	30		EGEDHN
O=C(NCC1CC(NCC#Cc2ccccc2)C1)[C@H]1CCCC12CC2	ZINC001100442433	1364116625	/nfs/dbraw/zinc/11/66/25/1364116625.db2.gz	HGYOMIYSXBHMSQ-SOAGJPPSSA-N	0	3	336.479	3.103	20	30		EGEDHN
CC#CCCCC(=O)NCC1CC(NCc2oc(C(C)C)nc2C)C1	ZINC001100591401	1364178172	/nfs/dbraw/zinc/17/81/72/1364178172.db2.gz	WYJPEWFEOMPQLD-UHFFFAOYSA-N	0	3	345.487	3.284	20	30		EGEDHN
C=CCC1(C(=O)NCC2CC(NCC(=C)Br)C2)CCC1	ZINC001100648576	1364204496	/nfs/dbraw/zinc/20/44/96/1364204496.db2.gz	JHKVEYSWDGBRFK-UHFFFAOYSA-N	0	3	341.293	3.126	20	30		EGEDHN
CC(C)[C@H](C)C(=O)NCC1CC(NCC#Cc2ccc(Cl)cc2)C1	ZINC001100721278	1364234875	/nfs/dbraw/zinc/23/48/75/1364234875.db2.gz	JLNYAQGHKXUAEN-DMKPSLHHSA-N	0	3	346.902	3.468	20	30		EGEDHN
CCC(CC)CC(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100794266	1364263971	/nfs/dbraw/zinc/26/39/71/1364263971.db2.gz	NSNONWXAFVEMIL-UHFFFAOYSA-N	0	3	326.484	3.349	20	30		EGEDHN
C[C@H](C(=O)NCC1CC(NCC#Cc2ccccc2)C1)c1ccccc1	ZINC001100879663	1364308185	/nfs/dbraw/zinc/30/81/85/1364308185.db2.gz	PTQKMZWSDGDMIY-NLMOZGTASA-N	0	3	346.474	3.326	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](N[C@@H]2CCc3c2cc(F)cc3F)C1	ZINC001185304966	1387675959	/nfs/dbraw/zinc/67/59/59/1387675959.db2.gz	QRWBUZWFHYAVTL-RDTXWAMCSA-N	0	3	334.410	3.499	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](NCc2ccc(Cl)cc2OC)C1	ZINC001185305578	1387676292	/nfs/dbraw/zinc/67/62/92/1387676292.db2.gz	WZDDKWQCQAZEPD-MRXNPFEDSA-N	0	3	336.863	3.395	20	30		EGEDHN
C=CCN1CC[C@H](Oc2ccnc(CNC(=O)[C@H](C)CC(C)C)c2)C1	ZINC001101097757	1364413663	/nfs/dbraw/zinc/41/36/63/1364413663.db2.gz	ZGZXIDBYSDFCRD-APWZRJJASA-N	0	3	345.487	3.019	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@H]2CN(Cc3cnc(C)s3)C[C@@]2(C)C1	ZINC001101251807	1364486534	/nfs/dbraw/zinc/48/65/34/1364486534.db2.gz	LVSHFKIBMJPXEO-BEFAXECRSA-N	0	3	347.528	3.334	20	30		EGEDHN
CCCC(C)(C)C(=O)N1CC[C@@H](NCc2ccc(OC)c(C#N)c2)C1	ZINC001185328539	1387684467	/nfs/dbraw/zinc/68/44/67/1387684467.db2.gz	RTBKXMMVPUTPOQ-QGZVFWFLSA-N	0	3	343.471	3.084	20	30		EGEDHN
C#CCC1(C(=O)N2C[C@H]3CN(C[C@H](F)CC)C[C@@]3(C)C2)CCCCC1	ZINC001101482632	1364578353	/nfs/dbraw/zinc/57/83/53/1364578353.db2.gz	HEJDBARYQYYFAH-GGPKGHCWSA-N	0	3	348.506	3.489	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)CCCCc3ccc(C)cc3)C[C@]2(C)C1	ZINC001101484586	1364578744	/nfs/dbraw/zinc/57/87/44/1364578744.db2.gz	AENONBOVYRFORF-IRLDBZIGSA-N	0	3	338.495	3.121	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC(C(C)(C)CNCc3ccon3)CC2)C1	ZINC001101572700	1364626913	/nfs/dbraw/zinc/62/69/13/1364626913.db2.gz	IYXFEDBKCAPEKE-UHFFFAOYSA-N	0	3	345.487	3.385	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CC2(CN(CCC(C)(C)C)C2)n2ccnc21	ZINC001101637479	1364664605	/nfs/dbraw/zinc/66/46/05/1364664605.db2.gz	MUXCEROHFXOGGX-OAHLLOKOSA-N	0	3	344.503	3.103	20	30		EGEDHN
C/C(=C\C(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C)C1CC1	ZINC001101772486	1364721597	/nfs/dbraw/zinc/72/15/97/1364721597.db2.gz	GPDJLRIFIZIRLH-YSEVPJSQSA-N	0	3	336.479	3.079	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H]1CN(Cc2c(C)noc2C)C[C@H]1C	ZINC001102218154	1364939771	/nfs/dbraw/zinc/93/97/71/1364939771.db2.gz	WCQKTPGWMOOOQD-CZUORRHYSA-N	0	3	333.476	3.078	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CNC(=O)[C@@]1(C)C=CCC1	ZINC001102247573	1364962559	/nfs/dbraw/zinc/96/25/59/1364962559.db2.gz	YHCPTMNCQNTBCH-CLCXKQKWSA-N	0	3	343.496	3.160	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@@H]1CN(Cc2c(C)noc2C)C[C@H]1C	ZINC001102263025	1364975638	/nfs/dbraw/zinc/97/56/38/1364975638.db2.gz	SDYXABXEAUUZOY-XOKHGSTOSA-N	0	3	333.476	3.078	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@@H]1CN(Cc2conc2CC)C[C@H]1C	ZINC001102262948	1364975832	/nfs/dbraw/zinc/97/58/32/1364975832.db2.gz	QEQPVVMUADVGEN-OWCLPIDISA-N	0	3	333.476	3.023	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1CNC(=O)C1(C)CC=CC1	ZINC001102318628	1364999267	/nfs/dbraw/zinc/99/92/67/1364999267.db2.gz	BLJLCDVFZZBYOH-UYAOXDASSA-N	0	3	336.479	3.079	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](NCc3ccc(C#N)c(F)c3)C2)CC1	ZINC001185439186	1387717398	/nfs/dbraw/zinc/71/73/98/1387717398.db2.gz	OHXSBXZRECHPII-QGZVFWFLSA-N	0	3	341.430	3.134	20	30		EGEDHN
CCCCCCCCC(=O)NC[C@@H]1CN(Cc2ccnn2C)C[C@H]1C	ZINC001102527030	1365100036	/nfs/dbraw/zinc/10/00/36/1365100036.db2.gz	CFIUHFSVWWIMJO-QZTJIDSGSA-N	0	3	348.535	3.355	20	30		EGEDHN
CCC(=O)NCC[C@@H]1CN(CC#Cc2cccc(Cl)c2)C[C@H]1C	ZINC001102625560	1365141808	/nfs/dbraw/zinc/14/18/08/1365141808.db2.gz	RLXFNFYOPVVWSV-NVXWUHKLSA-N	0	3	332.875	3.176	20	30		EGEDHN
CC(C)CC(=O)NCC[C@@H]1CN(Cc2ccc(C#N)cc2F)C[C@H]1C	ZINC001102642832	1365151277	/nfs/dbraw/zinc/15/12/77/1365151277.db2.gz	SKYZPRSWBJDBTO-NVXWUHKLSA-N	0	3	345.462	3.318	20	30		EGEDHN
C[C@@H](C(=O)NCC[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1C)C1CC1	ZINC001102826576	1365240077	/nfs/dbraw/zinc/24/00/77/1365240077.db2.gz	QTXXHWDOXSABLA-GPMSIDNRSA-N	0	3	339.483	3.179	20	30		EGEDHN
Cc1cnc([C@@H](C)N2C[C@@H](C)[C@H](CCNC(=O)C#CC(C)(C)C)C2)o1	ZINC001102964634	1365318966	/nfs/dbraw/zinc/31/89/66/1365318966.db2.gz	PUYAICBORUPLOL-DJIMGWMZSA-N	0	3	345.487	3.168	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cc3occc3[nH]2)C1	ZINC001103045150	1365353272	/nfs/dbraw/zinc/35/32/72/1365353272.db2.gz	HQGBWFLPQRUSTO-DGCLKSJQSA-N	0	3	335.835	3.201	20	30		EGEDHN
C#CCCCCCC(=O)NCC[C@@H]1CN(Cc2cncs2)C[C@H]1C	ZINC001103311811	1365487506	/nfs/dbraw/zinc/48/75/06/1365487506.db2.gz	MJTNVQRNMZDCEH-IAGOWNOFSA-N	0	3	347.528	3.301	20	30		EGEDHN
C=CCCCC(=O)NCC[C@@H]1CN(Cc2cccnc2OC)C[C@H]1C	ZINC001103382652	1365526968	/nfs/dbraw/zinc/52/69/68/1365526968.db2.gz	PMUINWSWYSRTFO-IAGOWNOFSA-N	0	3	345.487	3.021	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)[C@H](C)Cc2ccco2)C1	ZINC001103523767	1365612104	/nfs/dbraw/zinc/61/21/04/1365612104.db2.gz	LEXBYQCLTHJJHY-IIAWOOMASA-N	0	3	338.879	3.285	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2oc(C)nc2C)C1	ZINC001104091913	1365907710	/nfs/dbraw/zinc/90/77/10/1365907710.db2.gz	DUNHCHVGGHKQDW-CRAIPNDOSA-N	0	3	345.487	3.059	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2c(F)cccc2F)C1	ZINC001104126641	1365918948	/nfs/dbraw/zinc/91/89/48/1365918948.db2.gz	UKIYMORXTZOHQO-HZPDHXFCSA-N	0	3	348.437	3.343	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cnc3cc[nH]c3c2)C[C@H]1C	ZINC001104337118	1365981008	/nfs/dbraw/zinc/98/10/08/1365981008.db2.gz	GKYMDYUSPCGLQB-TZMCWYRMSA-N	0	3	346.862	3.003	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@H](CCNCc2cnoc2C)C1	ZINC001104485614	1366044926	/nfs/dbraw/zinc/04/49/26/1366044926.db2.gz	FCZBXCBNZBXRLK-GDBMZVCRSA-N	0	3	333.476	3.160	20	30		EGEDHN
CC[C@@H](F)C(=O)N1C[C@@H](C)[C@H](CCNCc2cc(C#N)ccc2F)C1	ZINC001104500607	1366051261	/nfs/dbraw/zinc/05/12/61/1366051261.db2.gz	XGUNQLGTRCFIPF-FRFSOERESA-N	0	3	349.425	3.020	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@@H](C)[C@H](CCNCc2oc(C)nc2C)C1	ZINC001104563080	1366078149	/nfs/dbraw/zinc/07/81/49/1366078149.db2.gz	JAPRUUXOZUFWGM-FHLIZLRMSA-N	0	3	347.503	3.468	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H](C)[C@H](CCNCc2cc(C)no2)C1	ZINC001104631627	1366110718	/nfs/dbraw/zinc/11/07/18/1366110718.db2.gz	VIWSNEQLNCPCKI-OGWOLHLISA-N	0	3	333.476	3.160	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H](C)[C@H](CCNCc2oc(C)nc2C)C1	ZINC001104731578	1366149334	/nfs/dbraw/zinc/14/93/34/1366149334.db2.gz	PHDXMAAAOYLPRD-RHSMWYFYSA-N	0	3	347.503	3.468	20	30		EGEDHN
CC[C@H](C)C(=O)NCC1(C)CCN(Cc2cccc(C#N)c2)CC1	ZINC001324845218	1387789789	/nfs/dbraw/zinc/78/97/89/1387789789.db2.gz	HXVVLQYXVUJUGT-INIZCTEOSA-N	0	3	327.472	3.323	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C=C(CC)CC)CC1	ZINC001105391807	1366440001	/nfs/dbraw/zinc/44/00/01/1366440001.db2.gz	MQTFYNQXVCEGBS-FQEVSTJZSA-N	0	3	328.500	3.459	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(c2ccccc2)C[C@H](NC(=O)c2ccco2)C1	ZINC001105402336	1366449586	/nfs/dbraw/zinc/44/95/86/1366449586.db2.gz	YDJJAXUDUCGYIZ-UWUNEBHHSA-N	0	3	344.842	3.452	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@H]1C[C@@](CNCCF)(c2ccccc2)C1	ZINC001105435296	1366466720	/nfs/dbraw/zinc/46/67/20/1366466720.db2.gz	HGMXWAIHRPBXJU-XKGZKEIXSA-N	0	3	332.463	3.364	20	30		EGEDHN
CCC(=CC(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1)CC	ZINC001106010861	1366605940	/nfs/dbraw/zinc/60/59/40/1366605940.db2.gz	CNSHOFHSTYDNGY-OXQOHEQNSA-N	0	3	339.483	3.489	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@@H](CNC/C(Cl)=C\Cl)[C@H](C)C1	ZINC001106025869	1366606888	/nfs/dbraw/zinc/60/68/88/1366606888.db2.gz	LHUKKTDPJXFINR-RNRBBCFGSA-N	0	3	331.287	3.183	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](CNCc2nc(C)sc2C)[C@H](C)C1	ZINC001106193582	1366620612	/nfs/dbraw/zinc/62/06/12/1366620612.db2.gz	MUUMEVGINVHBCK-CZUORRHYSA-N	0	3	335.517	3.300	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H](CNCc2nc(C)cs2)[C@H](C)C1	ZINC001106708695	1366777435	/nfs/dbraw/zinc/77/74/35/1366777435.db2.gz	GPIYQRNDKGOFTK-UKRRQHHQSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=CCCC(=O)NC[C@]12CCC[C@H]1N(CC#Cc1ccccc1)CC2	ZINC001107326567	1366928631	/nfs/dbraw/zinc/92/86/31/1366928631.db2.gz	AATUDMYWSJVRLF-IFMALSPDSA-N	0	3	336.479	3.365	20	30		EGEDHN
Cc1ccc(F)c(CN2CC[C@@]3(CNC(=O)[C@H](C)C#N)CCC[C@@H]23)c1	ZINC001107336069	1366931769	/nfs/dbraw/zinc/93/17/69/1366931769.db2.gz	GWGBEOOISJDXQM-XFQXTVEOSA-N	0	3	343.446	3.155	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@]12CCC[C@H]1N(Cc1ocnc1C)CC2	ZINC001107533755	1367025370	/nfs/dbraw/zinc/02/53/70/1367025370.db2.gz	FEETXIZCQMCIHL-MISYRCLQSA-N	0	3	345.487	3.446	20	30		EGEDHN
CCC[C@H](C(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1)C(C)C	ZINC001186019165	1387847653	/nfs/dbraw/zinc/84/76/53/1387847653.db2.gz	MQAQGEBMZQSPFL-MSOLQXFVSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=CCOCCCC(=O)N1CC[C@@H](N(C)C/C=C/c2ccccc2)C1	ZINC001189564639	1367055567	/nfs/dbraw/zinc/05/55/67/1367055567.db2.gz	FOPKGLSSFIKFFC-WUTDNEBXSA-N	0	3	342.483	3.215	20	30		EGEDHN
C#CCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3CC2=CCCCC2)CCC1	ZINC001109391925	1367101257	/nfs/dbraw/zinc/10/12/57/1367101257.db2.gz	ILDKQLMIVSFFNC-QYZOEREBSA-N	0	3	326.484	3.402	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2ccccc2F)C1	ZINC001107701253	1367110550	/nfs/dbraw/zinc/11/05/50/1367110550.db2.gz	YWGKAAJRXDZRMH-HNAYVOBHSA-N	0	3	334.435	3.001	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2ccccc2C)C1	ZINC001107706743	1367113249	/nfs/dbraw/zinc/11/32/49/1367113249.db2.gz	XKRKFQMAKQSWGR-YLJYHZDGSA-N	0	3	330.472	3.170	20	30		EGEDHN
Cc1cc(Cl)ccc1CN(C)[C@@H]1CCN(C(=O)C#CC(C)C)C1	ZINC001190045685	1367159575	/nfs/dbraw/zinc/15/95/75/1367159575.db2.gz	ARFZEXMXEPDOGO-GOSISDBHSA-N	0	3	332.875	3.341	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)C2C(C)(C)C2(C)C)C1	ZINC001107846206	1367171723	/nfs/dbraw/zinc/17/17/23/1367171723.db2.gz	QNFWJNFPUWZZRA-QRWLVFNGSA-N	0	3	336.520	3.230	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCc1cccc(Cl)c1)C2	ZINC001109576304	1367208368	/nfs/dbraw/zinc/20/83/68/1367208368.db2.gz	XBGNVTRKYITWJQ-SQNIBIBYSA-N	0	3	330.859	3.017	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCCOc1ccccc1	ZINC001109605570	1367227972	/nfs/dbraw/zinc/22/79/72/1367227972.db2.gz	ILGJSLXHDZIRPK-NEWSRXKRSA-N	0	3	342.483	3.389	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001190398619	1367253674	/nfs/dbraw/zinc/25/36/74/1367253674.db2.gz	ZGBDCYUWVCXXKM-GOSISDBHSA-N	0	3	325.456	3.193	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3C[C@@H]2CC(C)(C)CO2)CC1	ZINC001109682043	1367279210	/nfs/dbraw/zinc/27/92/10/1367279210.db2.gz	QZXSNLJWPGJZJY-OWSLCNJRSA-N	0	3	346.515	3.269	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](C)CCc1ccccc1F)C2	ZINC001109716002	1367291434	/nfs/dbraw/zinc/29/14/34/1367291434.db2.gz	NGGWIOAPNHQGJK-RKOGWWSCSA-N	0	3	342.458	3.139	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@]1(C)CN(CC2CC(C)(C)C2)CCO1	ZINC001108188512	1367331466	/nfs/dbraw/zinc/33/14/66/1367331466.db2.gz	UEUJDRHNEUUVBP-WOJBJXKFSA-N	0	3	336.520	3.232	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3CC/C=C/CCC)nc1	ZINC001109997554	1367451776	/nfs/dbraw/zinc/45/17/76/1367451776.db2.gz	AYZZSOCOSIGUAW-BVALFMRESA-N	0	3	337.467	3.144	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)COc1ccccc1C(C)C)C2	ZINC001110074239	1367494789	/nfs/dbraw/zinc/49/47/89/1367494789.db2.gz	JQLUNMITFJSSKI-NEWSRXKRSA-N	0	3	342.483	3.486	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](N(C)CCOc2ccccc2)C1	ZINC001191694072	1367561951	/nfs/dbraw/zinc/56/19/51/1367561951.db2.gz	ABPSQFAFQZTBLJ-KRWDZBQOSA-N	0	3	330.472	3.200	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H](N(C)Cc2cccc(COC)c2)C1	ZINC001191867838	1367620848	/nfs/dbraw/zinc/62/08/48/1367620848.db2.gz	JMXMYZAOYFPFLX-XLIONFOSSA-N	0	3	344.499	3.468	20	30		EGEDHN
C=CCN1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)[C@@H](F)CC)C1	ZINC001186196518	1387894241	/nfs/dbraw/zinc/89/42/41/1387894241.db2.gz	LAYZUURBXSQNND-NXHRZFHOSA-N	0	3	336.426	3.282	20	30		EGEDHN
C=CCN1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)C2(CF)CC2)C1	ZINC001186196327	1387894663	/nfs/dbraw/zinc/89/46/63/1387894663.db2.gz	HRQOOGCVMWIUMN-SJLPKXTDSA-N	0	3	348.437	3.283	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](N(C)Cc3ccc(C#N)cc3)C2)CCC1	ZINC001192216965	1367720302	/nfs/dbraw/zinc/72/03/02/1367720302.db2.gz	APJPXPDYWVKHPN-IBGZPJMESA-N	0	3	337.467	3.337	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](N(C)CCOc2ccccc2F)C1	ZINC001192577962	1367822360	/nfs/dbraw/zinc/82/23/60/1367822360.db2.gz	KKLHTHJTJWXLOZ-MRXNPFEDSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](N(C)Cc2cccc(COC)c2)C1	ZINC001192586789	1367826393	/nfs/dbraw/zinc/82/63/93/1367826393.db2.gz	WABWCZMPNAWVCL-IBGZPJMESA-N	0	3	344.499	3.468	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)C[C@@H](C)c2ccccc2F)C1	ZINC001192877436	1367893597	/nfs/dbraw/zinc/89/35/97/1367893597.db2.gz	LKXOWRCQJZCYQS-IAGOWNOFSA-N	0	3	348.462	3.055	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3Cc2ccccc2C)CCC1	ZINC001110652535	1367896835	/nfs/dbraw/zinc/89/68/35/1367896835.db2.gz	JARUGLQLWJURLW-AQNXPRMDSA-N	0	3	336.479	3.410	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)C(C)(C)c2ccc(C)cc2)C1	ZINC001193531543	1368055624	/nfs/dbraw/zinc/05/56/24/1368055624.db2.gz	CGPXEJNYRVCBLG-IBGZPJMESA-N	0	3	344.499	3.008	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCCOCc1ccccc1)C2	ZINC001110961654	1368125622	/nfs/dbraw/zinc/12/56/22/1368125622.db2.gz	CXIZVQAZTUURRF-AQNXPRMDSA-N	0	3	342.483	3.281	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3CCCOC(C)C)CCC1	ZINC001110987482	1368134760	/nfs/dbraw/zinc/13/47/60/1368134760.db2.gz	RJWKVCGMOIOQQR-KURKYZTESA-N	0	3	334.504	3.269	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1scnc1C1CC1)C2	ZINC001111117420	1368161919	/nfs/dbraw/zinc/16/19/19/1368161919.db2.gz	VKZMVVPDCYBZJT-KFWWJZLASA-N	0	3	331.485	3.322	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@@H]2CCC=CCCC2)C1	ZINC001194030305	1368169623	/nfs/dbraw/zinc/16/96/23/1368169623.db2.gz	AUADUDYLTYSXOH-GUDVDZBRSA-N	0	3	336.520	3.255	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@@H](C)c1ccccc1F)C2	ZINC001111158785	1368169700	/nfs/dbraw/zinc/16/97/00/1368169700.db2.gz	CMMCMCHZRPHNPT-RGCFKVTRSA-N	0	3	328.431	3.064	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@@H](C)c1ccccc1)C2	ZINC001111357565	1368271229	/nfs/dbraw/zinc/27/12/29/1368271229.db2.gz	KIORPXZJVMZACT-AFYVEPGGSA-N	0	3	342.483	3.104	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](N(C)C[C@@H]3CC(C)(C)CO3)C2)CCCC1	ZINC001194565791	1368287978	/nfs/dbraw/zinc/28/79/78/1368287978.db2.gz	ADJWCCITHKODHO-ROUUACIJSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)CC2(C)CCCCC2)C1	ZINC001194626100	1368299306	/nfs/dbraw/zinc/29/93/06/1368299306.db2.gz	YDJUJLYBRLLIIN-QZTJIDSGSA-N	0	3	336.520	3.255	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](C)Cc1ccccc1C)C2	ZINC001111478108	1368316420	/nfs/dbraw/zinc/31/64/20/1368316420.db2.gz	MQRSVUIZIMEQEL-NBYUQASBSA-N	0	3	326.484	3.471	20	30		EGEDHN
C#CCCCC(=O)N1Cc2ccccc2OC2(CCN(CC)CC2)C1	ZINC001111528011	1368325617	/nfs/dbraw/zinc/32/56/17/1368325617.db2.gz	OKHKQCLAGBLUBH-UHFFFAOYSA-N	0	3	340.467	3.066	20	30		EGEDHN
CC[C@@H](C)C(=O)N[C@]12CCC[C@H]1CN(Cc1cccc(C#N)c1)C2	ZINC001111592171	1368357287	/nfs/dbraw/zinc/35/72/87/1368357287.db2.gz	NKGCLHIAXXAEKF-BPAFIMBUSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN([C@@H](CC)c3ccccc3)C[C@H]2O)CCC1	ZINC001195940371	1368520496	/nfs/dbraw/zinc/52/04/96/1368520496.db2.gz	SSLNEPJDTGOULF-CEXWTWQISA-N	0	3	342.483	3.045	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCCN(C[C@@H]2CC(C)(C)CO2)CC1	ZINC001195966644	1368524957	/nfs/dbraw/zinc/52/49/57/1368524957.db2.gz	PJBWVBIRAMTAAF-SFHVURJKSA-N	0	3	334.504	3.104	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)C[C@@H](C)c2ccccc2C)C1	ZINC001111892075	1368536328	/nfs/dbraw/zinc/53/63/28/1368536328.db2.gz	MPLJHOLLPBXPFT-DXIQSLLYSA-N	0	3	338.495	3.483	20	30		EGEDHN
C=C(C)CCN1C[C@@H](O)[C@H](NC(=O)C[C@H](CC)c2ccc(C)cc2)C1	ZINC001196177012	1368563004	/nfs/dbraw/zinc/56/30/04/1368563004.db2.gz	QAGNKWARFYPLAJ-DFQSSKMNSA-N	0	3	344.499	3.006	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2cc(C)n([C@@H](C)CC)n2)CC1	ZINC001196381846	1368602007	/nfs/dbraw/zinc/60/20/07/1368602007.db2.gz	GHHNZXAZNRPKSG-INIZCTEOSA-N	0	3	332.492	3.277	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H](C)Cc2ccc(F)cc2)C1	ZINC001112020636	1368623331	/nfs/dbraw/zinc/62/33/31/1368623331.db2.gz	QURJXBXSGOEFDR-SYNHAJSKSA-N	0	3	330.447	3.161	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)[C@H](CC)CCCC)C[C@H]1C(F)(F)F	ZINC001112051701	1368636786	/nfs/dbraw/zinc/63/67/86/1368636786.db2.gz	GPQANJGLALRAJA-RBSFLKMASA-N	0	3	332.410	3.205	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H](C(F)(F)F)[C@H](NCC(=C)C)C1	ZINC001112107017	1368661011	/nfs/dbraw/zinc/66/10/11/1368661011.db2.gz	LGVUXLYVMMJVQZ-HUUCEWRRSA-N	0	3	330.394	3.310	20	30		EGEDHN
CC#CCCCC(=O)N1CCCN(Cc2ccccc2CC)CC1	ZINC001196846389	1368696959	/nfs/dbraw/zinc/69/69/59/1368696959.db2.gz	DHOGOKQKQFOSSU-UHFFFAOYSA-N	0	3	326.484	3.477	20	30		EGEDHN
CC#CCCCC(=O)N1CCCN(Cc2cccc3cccnc32)CC1	ZINC001196847194	1368697533	/nfs/dbraw/zinc/69/75/33/1368697533.db2.gz	WKGXTEZARFWZEC-UHFFFAOYSA-N	0	3	349.478	3.463	20	30		EGEDHN
CC(C)CCC(=O)N1CC[C@H]([C@@H](C)NCc2ccccc2C#N)C1	ZINC001325381657	1387956333	/nfs/dbraw/zinc/95/63/33/1387956333.db2.gz	VTMKRUKWFMMFQA-APWZRJJASA-N	0	3	327.472	3.321	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2cnc(C)nc2C(C)C)CC1	ZINC001197331113	1368789399	/nfs/dbraw/zinc/78/93/99/1368789399.db2.gz	HPJHIWRBMCAILP-UHFFFAOYSA-N	0	3	330.476	3.023	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@H](C)CCC(C)(C)C)C1	ZINC001197800057	1368900237	/nfs/dbraw/zinc/90/02/37/1368900237.db2.gz	WFJMLUWNKNXRCO-KZNAEPCWSA-N	0	3	338.536	3.357	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H]2CCC[C@]2(CNCc2cscn2)C1	ZINC001112519855	1368911917	/nfs/dbraw/zinc/91/19/17/1368911917.db2.gz	CVAQVDOLBFCRBQ-YJBOKZPZSA-N	0	3	333.501	3.218	20	30		EGEDHN
C=C(C)CN1CCCN(C(=O)CCCOc2ccc(C)cc2)CC1	ZINC001198026891	1368945554	/nfs/dbraw/zinc/94/55/54/1368945554.db2.gz	APWMWWXEVNRNLQ-UHFFFAOYSA-N	0	3	330.472	3.264	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cccnc2N(C)C)CC1	ZINC001198091932	1368958677	/nfs/dbraw/zinc/95/86/77/1368958677.db2.gz	HWLCEJXXJRRINP-UHFFFAOYSA-N	0	3	346.519	3.266	20	30		EGEDHN
C=C(C)CN1CCCN(C(=O)CCCOc2ccccc2F)CC1	ZINC001198229473	1368984516	/nfs/dbraw/zinc/98/45/16/1368984516.db2.gz	JQWOVIYGULOLAS-UHFFFAOYSA-N	0	3	334.435	3.095	20	30		EGEDHN
C=CCCOCC(=O)N1CCCN(Cc2c(C)cc(C)cc2C)CC1	ZINC001198316270	1369007534	/nfs/dbraw/zinc/00/75/34/1369007534.db2.gz	ZAVUSOQMFQWEIP-UHFFFAOYSA-N	0	3	344.499	3.239	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N1CCCN([C@@H](CC)c2ccccc2)CC1	ZINC001198343013	1369012416	/nfs/dbraw/zinc/01/24/16/1369012416.db2.gz	FBVAQBWHSFBRTC-MJGOQNOKSA-N	0	3	330.472	3.263	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)CCSCC)c1ccccc1OC	ZINC001198568586	1369062833	/nfs/dbraw/zinc/06/28/33/1369062833.db2.gz	USZZDQKLKTUBFB-INIZCTEOSA-N	0	3	336.501	3.161	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)c1ncoc1C)c1ccccc1OC	ZINC001198584959	1369067201	/nfs/dbraw/zinc/06/72/01/1369067201.db2.gz	ONLXEZRPQXXJIM-MRXNPFEDSA-N	0	3	343.427	3.019	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)/C=C\C1CC1)c1ccccc1OC	ZINC001198635274	1369078094	/nfs/dbraw/zinc/07/80/94/1369078094.db2.gz	DTDBUVKDBCAXNS-RXQFDZFGSA-N	0	3	328.456	3.375	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)C1CC=CC1)c1ccccc1OC	ZINC001198638522	1369080145	/nfs/dbraw/zinc/08/01/45/1369080145.db2.gz	YIQMDUZCAAGETA-GOSISDBHSA-N	0	3	328.456	3.375	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)[C@H]1[C@@H]2CCC[C@@H]21)c1ccccc1OC	ZINC001198647426	1369081363	/nfs/dbraw/zinc/08/13/63/1369081363.db2.gz	NVDKZCHSYZBDAO-HNAWSFBYSA-N	0	3	342.483	3.454	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)COC(C)(C)C)c1ccccc1OC	ZINC001198676916	1369088906	/nfs/dbraw/zinc/08/89/06/1369088906.db2.gz	DQQMNLQVNVIEMU-QGZVFWFLSA-N	0	3	348.487	3.223	20	30		EGEDHN
C#CCCCC(=O)NC[C@H](NCCC1CC1)c1ccccc1OC	ZINC001198693759	1369091983	/nfs/dbraw/zinc/09/19/83/1369091983.db2.gz	CBPYQKBNXNILSO-SFHVURJKSA-N	0	3	328.456	3.046	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)c1cc[nH]c1CC)c1ccccc1OC	ZINC001198703635	1369094457	/nfs/dbraw/zinc/09/44/57/1369094457.db2.gz	HUOUOXQKCMPXMW-SFHVURJKSA-N	0	3	341.455	3.223	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)c1ccoc1CC)c1ccccc1OC	ZINC001198705934	1369094937	/nfs/dbraw/zinc/09/49/37/1369094937.db2.gz	TXYMYNOLSMOAJB-KRWDZBQOSA-N	0	3	342.439	3.487	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@@H](C)C1CCC1)c1ccccc1OC	ZINC001198777279	1369112139	/nfs/dbraw/zinc/11/21/39/1369112139.db2.gz	XTJOHBXWGAERBB-MAUKXSAKSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)C(C)(C)CC(C)(C)C)C1	ZINC001198924265	1369150113	/nfs/dbraw/zinc/15/01/13/1369150113.db2.gz	FLBARJJTUHVKDK-IAGOWNOFSA-N	0	3	338.536	3.357	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)C2(C)C(C)(C)C2(C)C)C1	ZINC001199514527	1369233567	/nfs/dbraw/zinc/23/35/67/1369233567.db2.gz	FLFAKQBCPKQLLO-HZPDHXFCSA-N	0	3	338.536	3.190	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)Cc2cccc3cccnc32)CC1	ZINC001113174538	1369244803	/nfs/dbraw/zinc/24/48/03/1369244803.db2.gz	PCFFDJSQPQWZRD-QGZVFWFLSA-N	0	3	337.467	3.276	20	30		EGEDHN
N#Cc1ccc(NC(=S)NCCN2CCCCC2)c2ccccc12	ZINC001200418854	1369363817	/nfs/dbraw/zinc/36/38/17/1369363817.db2.gz	KYQIWTJHBFYZNF-UHFFFAOYSA-N	0	3	338.480	3.484	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001200783950	1369427705	/nfs/dbraw/zinc/42/77/05/1369427705.db2.gz	ZRRORBHMNRMANX-UHFFFAOYSA-N	0	3	325.456	3.241	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC(NCc2nc(C)c(C)s2)CC1	ZINC001201998983	1369663644	/nfs/dbraw/zinc/66/36/44/1369663644.db2.gz	XMQDSTGTASDZJF-UHFFFAOYSA-N	0	3	347.528	3.424	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC(NCc2cc(C3CC3)no2)CC1	ZINC001202137666	1369698411	/nfs/dbraw/zinc/69/84/11/1369698411.db2.gz	ITWMRLXGSRPOHP-CQSZACIVSA-N	0	3	331.460	3.235	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)Nc1ccccc1C(F)(F)F	ZINC001202170615	1369706367	/nfs/dbraw/zinc/70/63/67/1369706367.db2.gz	XIHIEHQVFZRCTH-LBPRGKRZSA-N	0	3	327.350	3.477	20	30		EGEDHN
O=C(N[C@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2)C1CCCC1	ZINC001202290853	1369731811	/nfs/dbraw/zinc/73/18/11/1369731811.db2.gz	PQPSFPDWGIXUEM-UXHICEINSA-N	0	3	336.479	3.245	20	30		EGEDHN
O=C(CC1CCC1)N[C@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202696379	1369855008	/nfs/dbraw/zinc/85/50/08/1369855008.db2.gz	YZSCEFMMUHKGLV-UXHICEINSA-N	0	3	336.479	3.245	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1[C@H]2CN(CCc3ccccc3F)C[C@H]21	ZINC001114325562	1369886039	/nfs/dbraw/zinc/88/60/39/1369886039.db2.gz	BIDLZVPERMPWEV-RUYXUALKSA-N	0	3	342.458	3.183	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1[C@H]2CN(CCc3ccc(F)c(F)c3)C[C@H]21	ZINC001114341557	1369901794	/nfs/dbraw/zinc/90/17/94/1369901794.db2.gz	YHTRPRUJDFDNJB-QWHZDKJVSA-N	0	3	348.437	3.156	20	30		EGEDHN
Cc1cc[nH]c1C(=O)N[C@@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202824753	1369902745	/nfs/dbraw/zinc/90/27/45/1369902745.db2.gz	SSYRRKKYQYAANO-RTBURBONSA-N	0	3	347.462	3.005	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1C[C@@H](NCc2cncs2)C12CCC2	ZINC001202959493	1369936847	/nfs/dbraw/zinc/93/68/47/1369936847.db2.gz	FTBVVEHEWDMBRO-SJORKVTESA-N	0	3	345.512	3.429	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1[C@H]2CN(CCOc3ccccc3C)C[C@H]21	ZINC001114681069	1370022352	/nfs/dbraw/zinc/02/23/52/1370022352.db2.gz	PWEZZRYWFWBOMJ-DZFIZOCASA-N	0	3	342.483	3.023	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1C[C@H](NCc2conc2C)C12CCC2	ZINC001203258974	1370045840	/nfs/dbraw/zinc/04/58/40/1370045840.db2.gz	UFIKLYJPCVYRFU-HOTGVXAUSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1[C@H]2CN(CCOc3ccc(C)cc3)C[C@H]21	ZINC001114724969	1370047411	/nfs/dbraw/zinc/04/74/11/1370047411.db2.gz	WKJAIUZACGRTQC-LMCOJAPRSA-N	0	3	342.483	3.023	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001203280450	1370059603	/nfs/dbraw/zinc/05/96/03/1370059603.db2.gz	HIRPVNBUJSLLFJ-NHCUHLMSSA-N	0	3	348.490	3.249	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1C[C@H](NCc2conc2C)C12CCC2	ZINC001203295268	1370066806	/nfs/dbraw/zinc/06/68/06/1370066806.db2.gz	JCXSVHRXQVRAKX-ZWKOTPCHSA-N	0	3	343.471	3.084	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1C[C@H](NCc2ccns2)C12CCC2	ZINC001203295572	1370067515	/nfs/dbraw/zinc/06/75/15/1370067515.db2.gz	LXBITSOWULXZNM-IRXDYDNUSA-N	0	3	345.512	3.244	20	30		EGEDHN
Cc1ccc(CN2CC[C@]3(CC(=O)N(c4cccc(C#N)c4)C3)C2)o1	ZINC001203295956	1370068318	/nfs/dbraw/zinc/06/83/18/1370068318.db2.gz	HCIWPNJRCUCBAV-FQEVSTJZSA-N	0	3	335.407	3.089	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1[C@H]2CN(CCOC3CCCCCC3)C[C@H]21	ZINC001114794371	1370084680	/nfs/dbraw/zinc/08/46/80/1370084680.db2.gz	HHNPAVNZTWQIPT-XODKDNOYSA-N	0	3	348.531	3.375	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2C[C@@H](NCc3ocnc3C)C23CCC3)CCC1	ZINC001203367770	1370101181	/nfs/dbraw/zinc/10/11/81/1370101181.db2.gz	VREMDWHGTNNEAO-IAGOWNOFSA-N	0	3	343.471	3.246	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1C[C@H](NCc2oc(C)nc2C)C12CCC2	ZINC001203451596	1370131159	/nfs/dbraw/zinc/13/11/59/1370131159.db2.gz	KCTGMZLLGGGYCI-DLBZAZTESA-N	0	3	345.487	3.411	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1C[C@@H](NCc2ccns2)C12CCC2	ZINC001203453503	1370131879	/nfs/dbraw/zinc/13/18/79/1370131879.db2.gz	SPQUODUKFBXYPI-HUUCEWRRSA-N	0	3	333.501	3.262	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1[C@H]2CN(CCOc3ccc(C)cc3)C[C@H]21	ZINC001114897016	1370135901	/nfs/dbraw/zinc/13/59/01/1370135901.db2.gz	UXNBJTBIMWAHTJ-BWTSREIZSA-N	0	3	342.483	3.023	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)CCc2ccc(C)o2)C12CCC2	ZINC001203779886	1370260986	/nfs/dbraw/zinc/26/09/86/1370260986.db2.gz	CGZFUDZFVDQFJR-HOTGVXAUSA-N	0	3	336.863	3.290	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)CCCCCOCC)C12CCC2	ZINC001203804422	1370271599	/nfs/dbraw/zinc/27/15/99/1370271599.db2.gz	SXQQUUOFPFKULQ-CVEARBPZSA-N	0	3	342.911	3.353	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3ccnc4ccccc34)C2)C1=O	ZINC001204083354	1370371076	/nfs/dbraw/zinc/37/10/76/1370371076.db2.gz	ODUQLNAIHJEOHO-OAQYLSRUSA-N	0	3	335.451	3.235	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(NCc3conc3CC)CC2)CCCC1	ZINC001204140472	1370388237	/nfs/dbraw/zinc/38/82/37/1370388237.db2.gz	SGFWRHGLWRKCAX-UHFFFAOYSA-N	0	3	345.487	3.454	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2[C@H]3CN(Cc4ccsc4)C[C@H]32)CCCC1	ZINC001115365401	1370410691	/nfs/dbraw/zinc/41/06/91/1370410691.db2.gz	WSWZEMKMAAYWRW-FVQHAEBGSA-N	0	3	330.497	3.431	20	30		EGEDHN
CC[C@@H](C)C(=O)NCC1(NCC#Cc2ccccc2)CCCCC1	ZINC001115414505	1370443160	/nfs/dbraw/zinc/44/31/60/1370443160.db2.gz	YOLSHGZDNUQMMQ-GOSISDBHSA-N	0	3	326.484	3.493	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CC2(OC)CCC2)CCCCC1	ZINC001115506945	1370507293	/nfs/dbraw/zinc/50/72/93/1370507293.db2.gz	VVNGKIQPMDNNJC-UHFFFAOYSA-N	0	3	328.884	3.107	20	30		EGEDHN
CN1CCN(Cc2cccc(Nc3c(F)cc(C#N)cc3F)c2)CC1	ZINC001204564545	1370517080	/nfs/dbraw/zinc/51/70/80/1370517080.db2.gz	LDFFLEHSVGSCBH-UHFFFAOYSA-N	0	3	342.393	3.327	20	30		EGEDHN
Cc1cc(CNC2(CNC(=O)C#CC(C)(C)C)CCCCC2)sn1	ZINC001115529268	1370528100	/nfs/dbraw/zinc/52/81/00/1370528100.db2.gz	JALOMQWYMGPNBJ-UHFFFAOYSA-N	0	3	347.528	3.410	20	30		EGEDHN
C=CCCC(=O)N1CCC(CNCc2oc(C(C)C)nc2C)CC1	ZINC001204748897	1370564517	/nfs/dbraw/zinc/56/45/17/1370564517.db2.gz	VBQPZXDUPIXYIL-UHFFFAOYSA-N	0	3	333.476	3.401	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H]2CCCO[C@@H]2CC)CCCCC1	ZINC001115567511	1370567944	/nfs/dbraw/zinc/56/79/44/1370567944.db2.gz	KBLZVVVGIFMIRM-JKSUJKDBSA-N	0	3	342.911	3.353	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H]2CCO[C@H]2C(C)C)CCCCC1	ZINC001115567957	1370569142	/nfs/dbraw/zinc/56/91/42/1370569142.db2.gz	XPCQVMITSQOOMK-CVEARBPZSA-N	0	3	342.911	3.209	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)C[C@H]2CC(C)(C)CO2)CCCCC1	ZINC001115626034	1370619819	/nfs/dbraw/zinc/61/98/19/1370619819.db2.gz	CQZDJBUPDOAZIM-HNNXBMFYSA-N	0	3	342.911	3.353	20	30		EGEDHN
CC#CCCCC(=O)NCC1(NCc2conc2CC)CCCCC1	ZINC001115679334	1370661840	/nfs/dbraw/zinc/66/18/40/1370661840.db2.gz	ANFVZUCLNVXPEI-UHFFFAOYSA-N	0	3	345.487	3.339	20	30		EGEDHN
CC#CCCCC(=O)NCC1(NCc2ccc(F)cn2)CCCCC1	ZINC001115681179	1370663537	/nfs/dbraw/zinc/66/35/37/1370663537.db2.gz	ADPDJXOIYYOBER-UHFFFAOYSA-N	0	3	345.462	3.323	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H](CCC)OCC)CCCCC1	ZINC001115681662	1370664735	/nfs/dbraw/zinc/66/47/35/1370664735.db2.gz	URYQTACTXCGRIQ-HNNXBMFYSA-N	0	3	330.900	3.353	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCC1(NCc2cnc(C)nc2)CCCCC1	ZINC001115684704	1370667625	/nfs/dbraw/zinc/66/76/25/1370667625.db2.gz	FHSGBOFXMGOFBX-QGZVFWFLSA-N	0	3	344.503	3.296	20	30		EGEDHN
CC(C)(C)c1ccc(-c2noc([C@H]3CCNC[C@@H]3F)n2)c(C#N)c1	ZINC001205218768	1370685095	/nfs/dbraw/zinc/68/50/95/1370685095.db2.gz	ITQHNVAPJGLXPW-GJZGRUSLSA-N	0	3	328.391	3.321	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)/C(C)=C\C)CC[C@H]1c1ccc(F)cc1	ZINC001205269740	1370700977	/nfs/dbraw/zinc/70/09/77/1370700977.db2.gz	CFUJWBJNNUSFQP-MPHFOSDZSA-N	0	3	328.431	3.089	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C[C@H](C)CC)CC[C@H]1c1ccc(F)cc1	ZINC001205276466	1370704144	/nfs/dbraw/zinc/70/41/44/1370704144.db2.gz	ZCCZWFBYKQXTFI-AYOQOUSVSA-N	0	3	330.447	3.169	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)Cc2cccnc2C)CCCCC1	ZINC001115729471	1370711037	/nfs/dbraw/zinc/71/10/37/1370711037.db2.gz	HNNFJKWFRGJYKS-UHFFFAOYSA-N	0	3	335.879	3.094	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@@H]2C[C@H]2CC)CC[C@H]1c1ccc(F)cc1	ZINC001205313027	1370717834	/nfs/dbraw/zinc/71/78/34/1370717834.db2.gz	OAVROWITLVYNHG-XWPNQZOQSA-N	0	3	342.458	3.169	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](c2cccc(F)c2)[C@H](NC[C@@H](F)CC)C1	ZINC001205386038	1370738573	/nfs/dbraw/zinc/73/85/73/1370738573.db2.gz	CHWWOGJANLSYNT-RYQLBKOJSA-N	0	3	336.426	3.424	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](c2cccc(F)c2)[C@H](NC/C=C/Cl)C1	ZINC001205401374	1370744631	/nfs/dbraw/zinc/74/46/31/1370744631.db2.gz	AMNUYOVRSAUAIR-FWOBMTDDSA-N	0	3	348.849	3.266	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@](C)(F)CCCC)C[C@H]1c1cccc(F)c1	ZINC001205417224	1370748546	/nfs/dbraw/zinc/74/85/46/1370748546.db2.gz	VNUSIGOFJDIUFL-NSHGMRRFSA-N	0	3	348.437	3.261	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C2(CCC=C)CC2)C[C@H]1c1cccc(F)c1	ZINC001205434739	1370754390	/nfs/dbraw/zinc/75/43/90/1370754390.db2.gz	QBSKHQNUCNREOE-RBUKOAKNSA-N	0	3	340.442	3.089	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@H](NCc3ccc4c(c3)CCC4)C2=O)cc1	ZINC001116511592	1370927026	/nfs/dbraw/zinc/92/70/26/1370927026.db2.gz	ICXNKVMDSWBYNQ-NRFANRHFSA-N	0	3	345.446	3.332	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC(CNCc2ccccc2C#N)CC1	ZINC001205989509	1370931461	/nfs/dbraw/zinc/93/14/61/1370931461.db2.gz	VWVPDBCJTIHRSZ-QGZVFWFLSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC(CNCc2cc(C3CC3)no2)CC1	ZINC001205998255	1370933798	/nfs/dbraw/zinc/93/37/98/1370933798.db2.gz	MDLRJBIMWCVJSI-OAHLLOKOSA-N	0	3	345.487	3.483	20	30		EGEDHN
C=C(CN1CCCC1)c1nc(-c2cncc(Br)c2)no1	ZINC001206100701	1370960407	/nfs/dbraw/zinc/96/04/07/1370960407.db2.gz	SFJVLEAAINZFJL-UHFFFAOYSA-N	0	3	335.205	3.003	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1ccncc1OC)[C@@H]2CC	ZINC001206457439	1371060861	/nfs/dbraw/zinc/06/08/61/1371060861.db2.gz	ASIPGIFPYHJQEL-QUCCMNQESA-N	0	3	343.471	3.012	20	30		EGEDHN
O=C(CC1CC1)N1CCC[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207046765	1371276408	/nfs/dbraw/zinc/27/64/08/1371276408.db2.gz	GINIKWMLAQARPF-SFHVURJKSA-N	0	3	330.859	3.072	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1CN(Cc2ccc(OC)cc2)C[C@H]1C	ZINC001207093817	1371291510	/nfs/dbraw/zinc/29/15/10/1371291510.db2.gz	PKLVEDXFWPJTFC-OXQOHEQNSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1CN(CCOCCC(C)C)C[C@H]1C	ZINC001207108037	1371295292	/nfs/dbraw/zinc/29/52/92/1371295292.db2.gz	VFYFHPFNCJJQPJ-IEBWSBKVSA-N	0	3	336.520	3.254	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1c(C)noc1C)[C@H]2CC	ZINC001207133907	1371305133	/nfs/dbraw/zinc/30/51/33/1371305133.db2.gz	BAGRWIWBYKRWKE-HKUYNNGSSA-N	0	3	331.460	3.213	20	30		EGEDHN
CN1CC[C@@H]2CN(C(=O)Nc3scc(C(C)(C)C)c3C#N)C[C@@H]21	ZINC001119446967	1371344233	/nfs/dbraw/zinc/34/42/33/1371344233.db2.gz	CPHVJVJWMJHBNJ-RISCZKNCSA-N	0	3	332.473	3.085	20	30		EGEDHN
C=CCOCc1nn(C)c2c1CN(CC1CCC(F)(F)CC1)CC2	ZINC001207345799	1371366462	/nfs/dbraw/zinc/36/64/62/1371366462.db2.gz	MQECRRXGXLOEIV-UHFFFAOYSA-N	0	3	339.430	3.306	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC[C@@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207362432	1371374554	/nfs/dbraw/zinc/37/45/54/1371374554.db2.gz	HKMUYQHDAJRESJ-CRAIPNDOSA-N	0	3	332.875	3.318	20	30		EGEDHN
C=CCOCc1nn(C)c2c1CN(CCCc1ccccc1F)CC2	ZINC001207495791	1371413766	/nfs/dbraw/zinc/41/37/66/1371413766.db2.gz	SNMVABJHAZCMQN-UHFFFAOYSA-N	0	3	343.446	3.253	20	30		EGEDHN
COc1ccc(CCCN2CCN(c3ccc(C#N)cc3)CC2)cc1	ZINC001207582534	1371442576	/nfs/dbraw/zinc/44/25/76/1371442576.db2.gz	JFOZYLZAANQYRX-UHFFFAOYSA-N	0	3	335.451	3.322	20	30		EGEDHN
O=C(/C=C\C1CC1)N1CCC[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207742264	1371490870	/nfs/dbraw/zinc/49/08/70/1371490870.db2.gz	UIZNWQDKWAVNOC-GDWUOILNSA-N	0	3	342.870	3.238	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CC[C@H]2CC[C@@H](C)O2)CCCCC1	ZINC001120176319	1371500140	/nfs/dbraw/zinc/50/01/40/1371500140.db2.gz	KHYHUDQTHSRFOC-HZPDHXFCSA-N	0	3	342.911	3.495	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H]2COc3ccccc32)CCCCC1	ZINC001120255109	1371516443	/nfs/dbraw/zinc/51/64/43/1371516443.db2.gz	VVBKASOMYGXVLL-INIZCTEOSA-N	0	3	348.874	3.324	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H](NCC#Cc2ccccc2Cl)C1	ZINC001207934980	1371542999	/nfs/dbraw/zinc/54/29/99/1371542999.db2.gz	LVYRZGUNBGXFDU-GOSISDBHSA-N	0	3	342.870	3.076	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H]([C@@H]2CCCN2Cc2ccc(F)cn2)C1	ZINC001120348038	1371543334	/nfs/dbraw/zinc/54/33/34/1371543334.db2.gz	ONYFATJVURWVPE-LPHOPBHVSA-N	0	3	345.462	3.390	20	30		EGEDHN
CCc1occc1C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001207959368	1371551397	/nfs/dbraw/zinc/55/13/97/1371551397.db2.gz	SQXNHUURKBQXSL-SFHVURJKSA-N	0	3	336.435	3.088	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)C#CC(C)(C)C)C1	ZINC001120372798	1371551693	/nfs/dbraw/zinc/55/16/93/1371551693.db2.gz	JFKIHEHGEBWYDI-DLBZAZTESA-N	0	3	336.907	3.491	20	30		EGEDHN
CC1(C)CC(C(=O)N2CCC[C@@H](NCC#Cc3ccc(F)cc3)C2)C1	ZINC001207966361	1371554649	/nfs/dbraw/zinc/55/46/49/1371554649.db2.gz	VNFGGHVDHSGVAM-LJQANCHMSA-N	0	3	342.458	3.194	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC[C@H]([C@H]2CCCN2Cc2ccns2)C1	ZINC001120383107	1371556394	/nfs/dbraw/zinc/55/63/94/1371556394.db2.gz	UBESJJXQGDSDMY-FUHWJXTLSA-N	0	3	345.512	3.006	20	30		EGEDHN
CC(C(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1)=C1CCC1	ZINC001207998680	1371563234	/nfs/dbraw/zinc/56/32/34/1371563234.db2.gz	NQIJCRBUTJLSMO-HXUWFJFHSA-N	0	3	340.442	3.258	20	30		EGEDHN
CC/C(C)=C\C(=O)N1CCC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001208001819	1371564313	/nfs/dbraw/zinc/56/43/13/1371564313.db2.gz	JOZRLABEVFFPGQ-CRPZLVSXSA-N	0	3	329.419	3.134	20	30		EGEDHN
C=CCCOCCCCC(=O)N1CCC[C@@H](NC[C@H](F)CC)C1	ZINC001208032708	1371575073	/nfs/dbraw/zinc/57/50/73/1371575073.db2.gz	XBWVEBQMAIWGJZ-IAGOWNOFSA-N	0	3	328.472	3.078	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC[C@@H](NCc2cncc(F)c2)C1	ZINC001208194278	1371635235	/nfs/dbraw/zinc/63/52/35/1371635235.db2.gz	OZTWSLHLLYYBGW-GOSISDBHSA-N	0	3	331.435	3.070	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC[C@@H](NCc2cnn(C(C)(C)C)c2)C1	ZINC001208258366	1371686860	/nfs/dbraw/zinc/68/68/60/1371686860.db2.gz	IDWZNNGGMKGRGC-QGZVFWFLSA-N	0	3	332.492	3.075	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1CN(Cc2ccc(COC)cc2)C[C@H]1C	ZINC001208393878	1371752065	/nfs/dbraw/zinc/75/20/65/1371752065.db2.gz	YYZRJLFZMRRTBE-FUHIMQAGSA-N	0	3	344.499	3.372	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1CN(CCOCc2ccccc2)C[C@H]1C	ZINC001208393198	1371752182	/nfs/dbraw/zinc/75/21/82/1371752182.db2.gz	KKYDETREXIFGTD-WSTZPKSXSA-N	0	3	344.499	3.242	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1)C1CCC1	ZINC001208400364	1371754405	/nfs/dbraw/zinc/75/44/05/1371754405.db2.gz	KJCHGQROZADCKR-JXFKEZNVSA-N	0	3	342.458	3.194	20	30		EGEDHN
O=C(C[C@H]1C=CCCC1)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001208403805	1371755582	/nfs/dbraw/zinc/75/55/82/1371755582.db2.gz	MWZJZZJFSFXDPW-LEWJYISDSA-N	0	3	336.479	3.365	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1CN(Cc2cccc(COC)c2)C[C@H]1C	ZINC001208509187	1371793639	/nfs/dbraw/zinc/79/36/39/1371793639.db2.gz	VWYPRTJEHFXLGW-OZOXKJRCSA-N	0	3	344.499	3.372	20	30		EGEDHN
C=C(C)CCC(=O)NC1CC2(C1)CC(N[C@H](C)c1cnc(C)cn1)C2	ZINC001121183871	1371881465	/nfs/dbraw/zinc/88/14/65/1371881465.db2.gz	PMOKYEPRDVWKEB-UEBDJUODSA-N	0	3	342.487	3.219	20	30		EGEDHN
CC1(C(=O)N2CCC[C@@H](NCC#Cc3ccc(F)cc3)C2)CCCC1	ZINC001208818274	1371904690	/nfs/dbraw/zinc/90/46/90/1371904690.db2.gz	WRSREXSFXCGALJ-LJQANCHMSA-N	0	3	342.458	3.338	20	30		EGEDHN
COc1cccc(CN2CCN(CCCc3cccc(C#N)c3)CC2)c1	ZINC001208850561	1371917401	/nfs/dbraw/zinc/91/74/01/1371917401.db2.gz	DKTNYXNHFUJWLH-UHFFFAOYSA-N	0	3	349.478	3.317	20	30		EGEDHN
N#Cc1cccc(CCCN2CCN(CCOc3ccccc3)CC2)c1	ZINC001208852884	1371918231	/nfs/dbraw/zinc/91/82/31/1371918231.db2.gz	VQNJMGPKINRIBK-UHFFFAOYSA-N	0	3	349.478	3.187	20	30		EGEDHN
N#Cc1cccc(CCCN2CCN(CCc3ccccc3)CC2)c1	ZINC001208853176	1371918298	/nfs/dbraw/zinc/91/82/98/1371918298.db2.gz	FHBVTDNIBLVLMK-UHFFFAOYSA-N	0	3	333.479	3.351	20	30		EGEDHN
COc1cccc(N2CCN(CCCc3ccc(C#N)cc3)CC2)c1	ZINC001208860671	1371921931	/nfs/dbraw/zinc/92/19/31/1371921931.db2.gz	RNWDGFRGINCTRM-UHFFFAOYSA-N	0	3	335.451	3.322	20	30		EGEDHN
CC(C)(C)OC(=O)NCC1(C)CN(CCCc2ccc(C#N)cc2)C1	ZINC001208864744	1371924930	/nfs/dbraw/zinc/92/49/30/1371924930.db2.gz	RJTXNGCZKUDPJU-UHFFFAOYSA-N	0	3	343.471	3.337	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)OC(C)(C)C)CN(CCc2ccc(C#N)cc2)C1	ZINC001208927426	1371948434	/nfs/dbraw/zinc/94/84/34/1371948434.db2.gz	HSTZDQNHKDJMII-YJBOKZPZSA-N	0	3	343.471	3.336	20	30		EGEDHN
C[C@@]1(C(=O)N2CCC[C@@H](NCC#Cc3ccc(F)cc3)C2)C=CCC1	ZINC001209040654	1371980956	/nfs/dbraw/zinc/98/09/56/1371980956.db2.gz	XNPGWDCLTGYPFV-TZIWHRDSSA-N	0	3	340.442	3.114	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCCN(C(=O)CCCC3CC3)C2)s1	ZINC001209145960	1372013865	/nfs/dbraw/zinc/01/38/65/1372013865.db2.gz	JWXYGUPYQFLMAF-OAHLLOKOSA-N	0	3	331.485	3.281	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NC1CC2(CC(NCc3oc(C)nc3C)C2)C1	ZINC001121611061	1372023694	/nfs/dbraw/zinc/02/36/94/1372023694.db2.gz	OUPJFSCAXYKXPT-BQIUBHQYSA-N	0	3	345.487	3.267	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NC1CC2(CC(NCc3oc(C)nc3C)C2)C1	ZINC001121611066	1372023771	/nfs/dbraw/zinc/02/37/71/1372023771.db2.gz	OUPJFSCAXYKXPT-YYKRIWSCSA-N	0	3	345.487	3.267	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC1CC2(CC(NCc3conc3C)C2)C1	ZINC001121616181	1372025838	/nfs/dbraw/zinc/02/58/38/1372025838.db2.gz	CGVKUKCSSXTDIV-UNSYWJDTSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC1CC2(CC(NCc3ccn(CC)n3)C2)C1	ZINC001121616995	1372026583	/nfs/dbraw/zinc/02/65/83/1372026583.db2.gz	ROSOVJOQHODCHU-YUCHZMFVSA-N	0	3	344.503	3.022	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC1CC2(CC(NCc3cnoc3C)C2)C1	ZINC001121618191	1372027791	/nfs/dbraw/zinc/02/77/91/1372027791.db2.gz	ZTQKWSGYQSMUPL-SZVPOOPASA-N	0	3	331.460	3.102	20	30		EGEDHN
C=CCCCCN1Cc2cncn2C[C@H](COc2ccccn2)C1	ZINC001209202527	1372036062	/nfs/dbraw/zinc/03/60/62/1372036062.db2.gz	KEUSAVGMRNUDPB-QGZVFWFLSA-N	0	3	326.444	3.145	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC1CC2(CC(NCc3cnoc3C)C2)C1	ZINC001121714115	1372056585	/nfs/dbraw/zinc/05/65/85/1372056585.db2.gz	VOIQPMLQAFNLDG-VCCMTOOWSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1	ZINC001121882203	1372112534	/nfs/dbraw/zinc/11/25/34/1372112534.db2.gz	WOJIGIQPIUUHFA-SECBINFHSA-N	0	3	332.288	3.013	20	30		EGEDHN
C=CCC1(C(=O)N2CCC[C@@H](NCC#Cc3ccccc3)C2)CCC1	ZINC001209502987	1372122298	/nfs/dbraw/zinc/12/22/98/1372122298.db2.gz	DTSLWIHZDJUKMD-HXUWFJFHSA-N	0	3	336.479	3.365	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)C[C@H](C)n1cccc1)C2	ZINC001122087590	1372172186	/nfs/dbraw/zinc/17/21/86/1372172186.db2.gz	LBXWCEUPLGJLPD-JFPDKAJLSA-N	0	3	335.879	3.209	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H]1C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001209716797	1372176860	/nfs/dbraw/zinc/17/68/60/1372176860.db2.gz	YLMXXZLMACRSKC-QHAWAJNXSA-N	0	3	338.495	3.301	20	30		EGEDHN
N#CC(C(=O)Cc1cccnc1)C(=O)Nc1ccc(Cl)cc1Cl	ZINC001122406323	1372243363	/nfs/dbraw/zinc/24/33/63/1372243363.db2.gz	JOFQYZLAQSZIEJ-GFCCVEGCSA-N	0	3	348.189	3.278	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CCCN(C)C2)nnc1N1CC[C@@H](C)[C@@H]1CC	ZINC001122631298	1372288061	/nfs/dbraw/zinc/28/80/61/1372288061.db2.gz	PSUILXLYMTZXIE-IKGGRYGDSA-N	0	3	331.508	3.288	20	30		EGEDHN
Cn1c(Cl)cnc1C(C#N)C(=O)c1ccc(OC(C)(C)C)cn1	ZINC001123336204	1372430767	/nfs/dbraw/zinc/43/07/67/1372430767.db2.gz	DUKPMJGRTDLKTP-NSHDSACASA-N	0	3	332.791	3.136	20	30		EGEDHN
Cn1c(Cl)cnc1C(C#N)=C([O-])c1ccc(OC(C)(C)C)cn1	ZINC001123336204	1372430765	/nfs/dbraw/zinc/43/07/65/1372430765.db2.gz	DUKPMJGRTDLKTP-NSHDSACASA-N	0	3	332.791	3.136	20	30		EGEDHN
O=C(C1CCC=CCC1)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001211112814	1372486843	/nfs/dbraw/zinc/48/68/43/1372486843.db2.gz	MKVKVEKVZWVGNY-OAQYLSRUSA-N	0	3	336.479	3.365	20	30		EGEDHN
C=C[C@H](C(=O)N[C@@H]1CN(CCOCC(C)C)C[C@H]1C)c1ccccc1	ZINC001211235143	1372508952	/nfs/dbraw/zinc/50/89/52/1372508952.db2.gz	IWZLSBRMUOPADO-YZGWKJHDSA-N	0	3	344.499	3.065	20	30		EGEDHN
C#CCCN1C[C@@H](C)[C@H](NC(=O)[C@@H](C)CCCc2ccccc2)C1	ZINC001211396936	1372550664	/nfs/dbraw/zinc/55/06/64/1372550664.db2.gz	GPPDGYTZXBMAIT-NLWGTHIKSA-N	0	3	326.484	3.105	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@@H]2C[C@H]2C2CCC2)C[C@H]1c1ccccc1	ZINC001211686018	1372602729	/nfs/dbraw/zinc/60/27/29/1372602729.db2.gz	QVWKLIJIBWRENI-JSXRDJHFSA-N	0	3	336.479	3.030	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C[C@@H](C)n2cccc2)C[C@H]1c1ccccc1	ZINC001211711813	1372606942	/nfs/dbraw/zinc/60/69/42/1372606942.db2.gz	UHCPWSGLXNVJTP-HLAWJBBLSA-N	0	3	349.478	3.047	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2c(C)coc2C)[C@H](OC)C1	ZINC001212203337	1372670263	/nfs/dbraw/zinc/67/02/63/1372670263.db2.gz	KHXCFHPSEGMIOZ-IAGOWNOFSA-N	0	3	334.460	3.072	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H]1CN(CCCC(C)C)C[C@H]1OC	ZINC001212337367	1372690538	/nfs/dbraw/zinc/69/05/38/1372690538.db2.gz	JZHUYBKJMUDBOJ-HUUCEWRRSA-N	0	3	330.900	3.017	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2coc3c2cccc3C)[C@H](OC)C1	ZINC001212410899	1372702590	/nfs/dbraw/zinc/70/25/90/1372702590.db2.gz	YHYJNCUWUYZYSW-QZTJIDSGSA-N	0	3	342.439	3.136	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)Cc2ccc(C)cc2)[C@H](OC)C1	ZINC001213135027	1372846795	/nfs/dbraw/zinc/84/67/95/1372846795.db2.gz	LXZOOTKTZAVGGM-WOJBJXKFSA-N	0	3	346.515	3.323	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)C2(C(F)F)CCC2)[C@H](OC)C1	ZINC001213333775	1372886678	/nfs/dbraw/zinc/88/66/78/1372886678.db2.gz	PDASRADKCJCQJG-HUUCEWRRSA-N	0	3	346.462	3.208	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN([C@H]2CCCc3ccccc32)C[C@H]1OC	ZINC001213357299	1372891215	/nfs/dbraw/zinc/89/12/15/1372891215.db2.gz	NVIOAIVUIGEFTH-HSALFYBXSA-N	0	3	342.483	3.236	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN(CCCc2cccc(C)c2)C[C@H]1OC	ZINC001213357361	1372891894	/nfs/dbraw/zinc/89/18/94/1372891894.db2.gz	RFMDGNGJQIOZOG-WOJBJXKFSA-N	0	3	344.499	3.099	20	30		EGEDHN
C#CCCCCC(=O)NCCNCc1ccccc1C(F)(F)F	ZINC001125938769	1372895930	/nfs/dbraw/zinc/89/59/30/1372895930.db2.gz	JLZBXMHSFWKEIV-UHFFFAOYSA-N	0	3	326.362	3.105	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@@H]2CC23CCCC3)[C@H](OC)C1	ZINC001213673572	1372943740	/nfs/dbraw/zinc/94/37/40/1372943740.db2.gz	IHFCZNGAEPJIEH-RCCFBDPRSA-N	0	3	334.504	3.129	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CCCC2)C[C@H]1NCC#Cc1ccc(Cl)cc1	ZINC001214025653	1372995844	/nfs/dbraw/zinc/99/58/44/1372995844.db2.gz	DXGNHDKJLVDMAS-DNVCBOLYSA-N	0	3	344.886	3.318	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H]2CN(Cc3sc(C)nc3C)C[C@H]21	ZINC001188080966	1388237174	/nfs/dbraw/zinc/23/71/74/1388237174.db2.gz	SBXOHEXUMSZXFU-JKSUJKDBSA-N	0	3	333.501	3.149	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CC=CC2)C[C@H]1NCC#Cc1ccccc1Cl	ZINC001214377700	1373051044	/nfs/dbraw/zinc/05/10/44/1373051044.db2.gz	HLZAMTAKZZHYQI-DNVCBOLYSA-N	0	3	342.870	3.094	20	30		EGEDHN
CCCC[C@H](C)C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001214551003	1373079145	/nfs/dbraw/zinc/07/91/45/1373079145.db2.gz	YOMVXTFGLADZJH-JJRVBVJISA-N	0	3	333.501	3.383	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H](C)[C@H](NCc2cccc(Cl)n2)C1	ZINC001214707497	1373105824	/nfs/dbraw/zinc/10/58/24/1373105824.db2.gz	OPGBRWCPQVHXMK-RHSMWYFYSA-N	0	3	347.890	3.440	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)[C@H](NCc2cccc(C(C)C)n2)C1	ZINC001214741272	1373113450	/nfs/dbraw/zinc/11/34/50/1373113450.db2.gz	CWAWHDIQDDGFON-VQIMIIECSA-N	0	3	329.488	3.498	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001214741423	1373113602	/nfs/dbraw/zinc/11/36/02/1373113602.db2.gz	KMJBXXQDYPDETM-VQIMIIECSA-N	0	3	344.886	3.484	20	30		EGEDHN
C=C(C)CNCc1ccncc1O[C@H]1CCN(C(=O)C[C@H](C)CC)C1	ZINC001127878277	1373194705	/nfs/dbraw/zinc/19/47/05/1373194705.db2.gz	FUBRGSIUZQAXES-AEFFLSMTSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001215427473	1373206228	/nfs/dbraw/zinc/20/62/28/1373206228.db2.gz	ADIAGKAQVRKRGM-VQIMIIECSA-N	0	3	344.886	3.484	20	30		EGEDHN
CC(C)C[C@H](C)C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001216099632	1373263330	/nfs/dbraw/zinc/26/33/30/1373263330.db2.gz	WCWQETCFCNJFLT-JJRVBVJISA-N	0	3	333.501	3.238	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NCCN[C@@H](C)c1ccc(F)c(F)c1)OCC	ZINC001128539814	1373285927	/nfs/dbraw/zinc/28/59/27/1373285927.db2.gz	LAXBGPILXZOXHF-SUMWQHHRSA-N	0	3	340.414	3.103	20	30		EGEDHN
C#CCC1(C(=O)N2C[C@@H](C)[C@H](NCc3ccns3)C2)CCCCC1	ZINC001216894557	1373360200	/nfs/dbraw/zinc/36/02/00/1373360200.db2.gz	SIMQYEKXPYBQQG-NVXWUHKLSA-N	0	3	345.512	3.053	20	30		EGEDHN
COCC#CCN[C@@H]1CCN(C(=O)CC2CCC(C(C)(C)C)CC2)C1	ZINC001188186975	1388259440	/nfs/dbraw/zinc/25/94/40/1388259440.db2.gz	AZAIINYSHCFYKW-CTWPCTMYSA-N	0	3	348.531	3.069	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)C2(Cc3ccccc3)CCC2)c1	ZINC001129640175	1373406365	/nfs/dbraw/zinc/40/63/65/1373406365.db2.gz	GWIWKNHQTIVBAH-UHFFFAOYSA-N	0	3	347.462	3.177	20	30		EGEDHN
C#CCCCCC(=O)N1CCO[C@@H]2CN(CCCC3CCCC3)C[C@@H]21	ZINC001217668787	1373485230	/nfs/dbraw/zinc/48/52/30/1373485230.db2.gz	ACCHHWVAGUNITA-VQTJNVASSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)CCCC2CCCC2)C1	ZINC001130449862	1373543934	/nfs/dbraw/zinc/54/39/34/1373543934.db2.gz	HGQWMGDXFIWKFV-KRWDZBQOSA-N	0	3	344.503	3.362	20	30		EGEDHN
C=C(C)CCC(=O)N1CCO[C@@H]2CN([C@@H](C)c3ccccc3C)C[C@@H]21	ZINC001218036800	1373544541	/nfs/dbraw/zinc/54/45/41/1373544541.db2.gz	CYGMCMQYCDONTR-YSIASYRMSA-N	0	3	342.483	3.324	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)[C@H](CCCC)C(C)C)C1	ZINC001130450405	1373544797	/nfs/dbraw/zinc/54/47/97/1373544797.db2.gz	NTPHTPGSQPIXKG-FUHWJXTLSA-N	0	3	346.519	3.464	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)C2(CC)CCCCC2)C1	ZINC001130452856	1373546099	/nfs/dbraw/zinc/54/60/99/1373546099.db2.gz	OHEUVTFAAHBWBG-MRXNPFEDSA-N	0	3	344.503	3.362	20	30		EGEDHN
CCC[C@@H]1CCC[C@@H]1C(=O)NCCNCc1ccc(C#N)c(F)c1	ZINC001130566745	1373561275	/nfs/dbraw/zinc/56/12/75/1373561275.db2.gz	KFFKTTVWHXPKOX-WBVHZDCISA-N	0	3	331.435	3.120	20	30		EGEDHN
O=C(/C=C\c1ccc(O[C@H]2CC[C@@H]3NCCO[C@@H]32)cc1)c1ccccc1	ZINC001218116882	1373563290	/nfs/dbraw/zinc/56/32/90/1373563290.db2.gz	SKXTVYITAQPFAM-AWYIDISESA-N	0	3	349.430	3.481	20	30		EGEDHN
O=C(/C=C\c1ccccc1)c1ccc(O[C@H]2CC[C@@H]3NCCO[C@@H]32)cc1	ZINC001218119154	1373564228	/nfs/dbraw/zinc/56/42/28/1373564228.db2.gz	IRVPCPKTKWWDIM-CPIKMWJPSA-N	0	3	349.430	3.481	20	30		EGEDHN
C#CCCCCCC(=O)N1CCO[C@@H]2CN(CCCCCCC)C[C@@H]21	ZINC001218454898	1373616869	/nfs/dbraw/zinc/61/68/69/1373616869.db2.gz	KASAQCICDGDHDH-VQTJNVASSA-N	0	3	348.531	3.452	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2OCCN(C(=O)c3ccc(CC)cc3)[C@H]2C1	ZINC001219014548	1373679065	/nfs/dbraw/zinc/67/90/65/1373679065.db2.gz	GGBKTYMPYZNKMF-LSTHTHJFSA-N	0	3	342.483	3.129	20	30		EGEDHN
C=CCCC1(C(=O)N2C[C@H](C)O[C@@]3(CCN(CC=C(C)C)C3)C2)CC1	ZINC001131688477	1373764296	/nfs/dbraw/zinc/76/42/96/1373764296.db2.gz	MRZDQLGGDCJWQL-GHTZIAJQSA-N	0	3	346.515	3.391	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@H](C)O[C@]2(CCN(CC=C(C)C)C2)C1	ZINC001131688994	1373764361	/nfs/dbraw/zinc/76/43/61/1373764361.db2.gz	VQKWDNUKUVCWBW-PXNSSMCTSA-N	0	3	334.504	3.247	20	30		EGEDHN
C#CCCN1CC[C@]2(C1)CN(C(=O)C(C)(C)CC(C)(C)C)C[C@@H](C)O2	ZINC001131701155	1373770734	/nfs/dbraw/zinc/77/07/34/1373770734.db2.gz	PREIWORNPMRFIF-UTKZUKDTSA-N	0	3	348.531	3.164	20	30		EGEDHN
C=CCCCN1CC[C@@H]2CN(C(=O)c3ncoc3C(C)(C)C)[C@@H]2C1	ZINC001221925829	1373805024	/nfs/dbraw/zinc/80/50/24/1373805024.db2.gz	BHMMXMSEOAGSMP-HUUCEWRRSA-N	0	3	331.460	3.085	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCC1CCN(Cc2cccc(C#N)c2)CC1	ZINC001224165098	1375058075	/nfs/dbraw/zinc/05/80/75/1375058075.db2.gz	GIARQYJBFWAPHE-IRXDYDNUSA-N	0	3	339.483	3.345	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@@H](C)N(Cc2ccc(COC)cc2)C1	ZINC001132001939	1375092191	/nfs/dbraw/zinc/09/21/91/1375092191.db2.gz	FRUHEEDEARTSHX-YLJYHZDGSA-N	0	3	342.483	3.106	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@@H](C)N(Cc2ccc(CF)cc2)C1	ZINC001132002426	1375092201	/nfs/dbraw/zinc/09/22/01/1375092201.db2.gz	JRLFFZGLJBWUDD-VQIMIIECSA-N	0	3	330.447	3.429	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)/C(C)=C/CC	ZINC001225147526	1375095756	/nfs/dbraw/zinc/09/57/56/1375095756.db2.gz	UPIVYMHQOQAPSW-VAZNYKRKSA-N	0	3	329.282	3.268	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1CC[C@H](C)N(CCCc2ccsc2)C1	ZINC001132022146	1375103384	/nfs/dbraw/zinc/10/33/84/1375103384.db2.gz	VOQDELFBVYZGSF-FUHWJXTLSA-N	0	3	332.513	3.309	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2ccc3occc3c2)CC[C@H]1C	ZINC001132051198	1375118776	/nfs/dbraw/zinc/11/87/76/1375118776.db2.gz	YUSVRCHOWIGTDQ-QAPCUYQASA-N	0	3	342.439	3.218	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1CC[C@H](C)N(Cc2ccc(CO)cc2)C1	ZINC001132060783	1375126073	/nfs/dbraw/zinc/12/60/73/1375126073.db2.gz	LAGLGTOLQMCYIJ-LPHOPBHVSA-N	0	3	344.499	3.250	20	30		EGEDHN
C=CCCOCC(=O)NCC1CCN(Cc2cc(C)ccc2F)CC1	ZINC001225626066	1375134840	/nfs/dbraw/zinc/13/48/40/1375134840.db2.gz	RBAOUCYFUIESCH-UHFFFAOYSA-N	0	3	348.462	3.055	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCc2cccc(OC)c2F)CC[C@H]1C	ZINC001132082119	1375136948	/nfs/dbraw/zinc/13/69/48/1375136948.db2.gz	FQXMXBQWKQOQGO-WBVHZDCISA-N	0	3	348.462	3.312	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCOc2cccc(C)c2C)CC[C@H]1C	ZINC001132094149	1375142335	/nfs/dbraw/zinc/14/23/35/1375142335.db2.gz	HUYZTARMJUHKHI-SJLPKXTDSA-N	0	3	330.472	3.227	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COC/C=C/c2ccccc2)CC[C@H]1C	ZINC001132124054	1375158621	/nfs/dbraw/zinc/15/86/21/1375158621.db2.gz	LYKUCYRVWBJZBY-MRRRUUNJSA-N	0	3	342.483	3.262	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2cc(F)ccc2CC)CC[C@@H]1C	ZINC001132148968	1375170510	/nfs/dbraw/zinc/17/05/10/1375170510.db2.gz	DRUMLZVJSXOBPL-MAUKXSAKSA-N	0	3	348.462	3.173	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2nc3cnccc3s2)CC[C@@H]1C	ZINC001132164884	1375180772	/nfs/dbraw/zinc/18/07/72/1375180772.db2.gz	LGTRYUSUQFWCQH-KBPBESRZSA-N	0	3	344.484	3.240	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCc2ccc(OC)c(F)c2)CC[C@H]1C	ZINC001132168950	1375184157	/nfs/dbraw/zinc/18/41/57/1375184157.db2.gz	HQYOUIAMHDDWIP-WBVHZDCISA-N	0	3	348.462	3.312	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@H](C)OCc3ccc(C)cc3)[C@@H]2C1	ZINC001188697925	1388362386	/nfs/dbraw/zinc/36/23/86/1388362386.db2.gz	IKAQGRFUXFNUIJ-YSIASYRMSA-N	0	3	342.483	3.009	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CC[C@@H](C)N(CCOCCCC)C2)cc1	ZINC001132214877	1375213635	/nfs/dbraw/zinc/21/36/35/1375213635.db2.gz	OTRVJNUJZMALAO-XLIONFOSSA-N	0	3	342.483	3.067	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CC[C@H](C)N(CCOCCCC)C2)cc1	ZINC001132214875	1375214181	/nfs/dbraw/zinc/21/41/81/1375214181.db2.gz	OTRVJNUJZMALAO-FXAWDEMLSA-N	0	3	342.483	3.067	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCCc2ccc(OC)cc2)CC[C@@H]1C	ZINC001132265589	1375254801	/nfs/dbraw/zinc/25/48/01/1375254801.db2.gz	PGRIKOZKFFPFBO-FUHWJXTLSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCc2cc(Cl)cs2)CC[C@H]1C	ZINC001132330394	1375309917	/nfs/dbraw/zinc/30/99/17/1375309917.db2.gz	GOKFOQLMMDEFPA-TZMCWYRMSA-N	0	3	326.893	3.489	20	30		EGEDHN
C#CCCCCC(=O)NC1CCN(C[C@@H](OC)c2ccccc2)CC1	ZINC001226952089	1375369366	/nfs/dbraw/zinc/36/93/66/1375369366.db2.gz	RFHJXNFHVZOQGH-HXUWFJFHSA-N	0	3	342.483	3.148	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2cccc(Cl)c2)CC[C@@H]1C	ZINC001132437497	1375382662	/nfs/dbraw/zinc/38/26/62/1375382662.db2.gz	VKQWIXYOJBTWLB-WMLDXEAASA-N	0	3	336.863	3.125	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2ccc(CC)cc2)CC[C@@H]1C	ZINC001132458317	1375401398	/nfs/dbraw/zinc/40/13/98/1375401398.db2.gz	TZOSTPMROFGQMN-LPHOPBHVSA-N	0	3	330.472	3.034	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCc2ccc(OC)cc2)CC[C@H]1C	ZINC001132464554	1375407269	/nfs/dbraw/zinc/40/72/69/1375407269.db2.gz	VXVQFURDZTYSFT-AEFFLSMTSA-N	0	3	330.472	3.173	20	30		EGEDHN
Cc1cc(CN2CCC(NC(=O)C#CC(C)(C)C)CC2)c(C)s1	ZINC001227244056	1375411116	/nfs/dbraw/zinc/41/11/16/1375411116.db2.gz	HAOMSBPTJKERKC-UHFFFAOYSA-N	0	3	332.513	3.495	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2ccc(CCC)s2)CC1	ZINC001227561728	1375443502	/nfs/dbraw/zinc/44/35/02/1375443502.db2.gz	DNYACUIZFIPGFO-UHFFFAOYSA-N	0	3	336.501	3.097	20	30		EGEDHN
C=C(C)CCC(=O)NC1CCN(C[C@H](O)c2ccc(CC)cc2)CC1	ZINC001227596394	1375449879	/nfs/dbraw/zinc/44/98/79/1375449879.db2.gz	CLJYFFFUZFGZSO-FQEVSTJZSA-N	0	3	344.499	3.219	20	30		EGEDHN
C=C(C)CCC(=O)NC1CCN(Cc2cc(C)ccc2OC)CC1	ZINC001227607116	1375453003	/nfs/dbraw/zinc/45/30/03/1375453003.db2.gz	KKPVCHAYSJTMHR-UHFFFAOYSA-N	0	3	330.472	3.441	20	30		EGEDHN
C#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)CC2CCC2)CC1	ZINC001132554814	1375462080	/nfs/dbraw/zinc/46/20/80/1375462080.db2.gz	MUOIRKBBWASKGQ-FQEVSTJZSA-N	0	3	339.483	3.088	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCNCc1cc(C(C)C)ccc1OC	ZINC001132573505	1375472118	/nfs/dbraw/zinc/47/21/18/1375472118.db2.gz	OMFWMBLDWUWUCB-JKSUJKDBSA-N	0	3	332.488	3.483	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H](OCC)C1CCCC1	ZINC001227768883	1375473740	/nfs/dbraw/zinc/47/37/40/1375473740.db2.gz	UYKBXWHHBMLBOM-BRWVUGGUSA-N	0	3	342.911	3.351	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](C)[C@H](CNCc2nc(C)c(C)s2)C1	ZINC001132696337	1375518354	/nfs/dbraw/zinc/51/83/54/1375518354.db2.gz	JUHPIYVCTQJADG-XJKSGUPXSA-N	0	3	335.517	3.300	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CCN(Cc2ccc3c(c2)COC3)CC1	ZINC001228622107	1375620831	/nfs/dbraw/zinc/62/08/31/1375620831.db2.gz	MJVPQTZZIZPJJX-UHFFFAOYSA-N	0	3	328.456	3.010	20	30		EGEDHN
CC#CCCCC(=O)NC1CCN(Cc2cccc(N(C)C)c2)CC1	ZINC001228717339	1375652167	/nfs/dbraw/zinc/65/21/67/1375652167.db2.gz	FPYYDMNFTDBWHG-UHFFFAOYSA-N	0	3	341.499	3.027	20	30		EGEDHN
C=CCCCC(=O)NC1CCN(Cc2cccc(OC)c2C)CC1	ZINC001228927827	1375718494	/nfs/dbraw/zinc/71/84/94/1375718494.db2.gz	LQBSERDXWHSVGO-UHFFFAOYSA-N	0	3	330.472	3.441	20	30		EGEDHN
N#Cc1ccc(OC[C@@H]2CN(Cc3ccccc3)CCCO2)c(C#N)c1	ZINC001229033641	1375747643	/nfs/dbraw/zinc/74/76/43/1375747643.db2.gz	DLQFLQYDORBUJL-FQEVSTJZSA-N	0	3	347.418	3.100	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](C)[C@H](CNCc2ccn(CC)n2)C1	ZINC001133141326	1375802298	/nfs/dbraw/zinc/80/22/98/1375802298.db2.gz	BZWIHJHBUCUAOT-IAGOWNOFSA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@H]2CN(CCOCCC(C)C)C[C@H]21	ZINC001188896185	1388404210	/nfs/dbraw/zinc/40/42/10/1388404210.db2.gz	LAUWJAFEPOXQDN-CEXWTWQISA-N	0	3	336.520	3.184	20	30		EGEDHN
CCCCCC(=O)N1CC[C@H](N(C)Cc2ccc(OC)c(C#N)c2)C1	ZINC001188907497	1388406963	/nfs/dbraw/zinc/40/69/63/1388406963.db2.gz	ZIYBGUYQYQBFIF-SFHVURJKSA-N	0	3	343.471	3.180	20	30		EGEDHN
CCCCCCCCCCC(=O)N[C@@H]1CCCC[C@H]1NCC(N)=O	ZINC001229883920	1375911544	/nfs/dbraw/zinc/91/15/44/1375911544.db2.gz	UGLDEZHWHIXHMC-IAGOWNOFSA-N	0	3	339.524	3.020	20	30		EGEDHN
C=C1CCC(C(=O)NCCN[C@@H]2CCc3c2cc(F)cc3F)CC1	ZINC001133365460	1375948169	/nfs/dbraw/zinc/94/81/69/1375948169.db2.gz	RUOPURGWNCXSFC-GOSISDBHSA-N	0	3	334.410	3.404	20	30		EGEDHN
C=CCCC1(C(=O)NCCN[C@H]2CCc3c2cc(F)cc3F)CC1	ZINC001133368814	1375950784	/nfs/dbraw/zinc/95/07/84/1375950784.db2.gz	IJRTZOYCWUWJIN-KRWDZBQOSA-N	0	3	334.410	3.404	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2c(C)cc(C)cc2C)CC1	ZINC001230188988	1375961207	/nfs/dbraw/zinc/96/12/07/1375961207.db2.gz	QIQUNVCAZGAFAS-UHFFFAOYSA-N	0	3	330.472	3.009	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H](C)SC	ZINC001133385560	1375968990	/nfs/dbraw/zinc/96/89/90/1375968990.db2.gz	PHEHHEWXMMCFAC-CQSZACIVSA-N	0	3	338.904	3.033	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)C#CC(C)(C)C	ZINC001133395946	1375979546	/nfs/dbraw/zinc/97/95/46/1375979546.db2.gz	JMVLACMCUNLVAZ-UHFFFAOYSA-N	0	3	344.886	3.331	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H]1CCC[C@@H]2C[C@@H]21	ZINC001133399871	1375985356	/nfs/dbraw/zinc/98/53/56/1375985356.db2.gz	XSHLAHUVDPYZFL-QRQLOZEOSA-N	0	3	344.886	3.328	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)c1ccc(C)s1	ZINC001133536196	1376068765	/nfs/dbraw/zinc/06/87/65/1376068765.db2.gz	RTBZRBLXGCVCFR-MNOVXSKESA-N	0	3	345.306	3.452	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)Cc1ccsc1	ZINC001133564935	1376092643	/nfs/dbraw/zinc/09/26/43/1376092643.db2.gz	TVFBZVHXGMJIST-RYUDHWBXSA-N	0	3	345.306	3.072	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)c1cccc(C)c1	ZINC001133567827	1376093113	/nfs/dbraw/zinc/09/31/13/1376093113.db2.gz	CDERXIGVXYVJSK-KBPBESRZSA-N	0	3	339.277	3.390	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1ccccc1C#N)NC(=O)c1cccc(F)c1	ZINC001133576314	1376101672	/nfs/dbraw/zinc/10/16/72/1376101672.db2.gz	GEGULSCCIOWZIB-LSDHHAIUSA-N	0	3	339.414	3.384	20	30		EGEDHN
CC/C=C(\C)C(=O)N[C@H](C)C[C@@H](C)NCc1cc(F)ccc1C#N	ZINC001133839338	1376226317	/nfs/dbraw/zinc/22/63/17/1376226317.db2.gz	FHKHEUHOEKGSKT-KUYFCZACSA-N	0	3	331.435	3.427	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)/C=C(\C)C1CC1	ZINC001133868249	1376242738	/nfs/dbraw/zinc/24/27/38/1376242738.db2.gz	WYOLAHLBQJTQKZ-HKCLJGFPSA-N	0	3	329.282	3.124	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H]2CN(Cc3ccc(OC)cc3)C[C@H]21	ZINC001188999747	1388432483	/nfs/dbraw/zinc/43/24/83/1388432483.db2.gz	ZPTDZRPJSZIJKE-PKOBYXMFSA-N	0	3	328.456	3.084	20	30		EGEDHN
COCCCOc1cc(CN2CCC(S)CC2)ccc1OC	ZINC001231609592	1376281287	/nfs/dbraw/zinc/28/12/87/1376281287.db2.gz	BLOQNSVMLLNVDE-UHFFFAOYSA-N	0	3	325.474	3.005	20	30		EGEDHN
C#Cc1cccc(CN2CCC3(CC2)NC(=O)C[C@H]3c2ccccc2)c1	ZINC001231656656	1376296618	/nfs/dbraw/zinc/29/66/18/1376296618.db2.gz	CVRZLGDREPJOMB-NRFANRHFSA-N	0	3	344.458	3.306	20	30		EGEDHN
COc1cc(Cl)c(CN2CCC3SC(=O)C=C3C2)c(OC)c1	ZINC001231698127	1376301928	/nfs/dbraw/zinc/30/19/28/1376301928.db2.gz	ORJAEHXSBSRCTI-OAHLLOKOSA-N	0	3	339.844	3.131	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)CCC(F)(F)F)NCc1ccccc1C#N	ZINC001134003624	1376306916	/nfs/dbraw/zinc/30/69/16/1376306916.db2.gz	LCOGDQUECGKFRB-OLZOCXBDSA-N	0	3	341.377	3.274	20	30		EGEDHN
N#Cc1ccccc1OC1CCN(Cc2cccc3c[nH]nc32)CC1	ZINC001231973633	1376365841	/nfs/dbraw/zinc/36/58/41/1376365841.db2.gz	BCYKAMNVERZBCB-UHFFFAOYSA-N	0	3	332.407	3.478	20	30		EGEDHN
Cc1ccc(C(=O)NCCNCc2ccc(C#N)cc2)c(Cl)c1	ZINC001134164865	1376395541	/nfs/dbraw/zinc/39/55/41/1376395541.db2.gz	GAKNBVQAIXUQSB-UHFFFAOYSA-N	0	3	327.815	3.040	20	30		EGEDHN
CN(C)Cc1cc(F)cc(CN(CCC#N)Cc2cccnc2)c1	ZINC001232143700	1376409104	/nfs/dbraw/zinc/40/91/04/1376409104.db2.gz	BTHNPQJEAIXNSN-UHFFFAOYSA-N	0	3	326.419	3.198	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](C)C[C@@H](C)NCc2ccccc2C#N)ns1	ZINC001134214376	1376421330	/nfs/dbraw/zinc/42/13/30/1376421330.db2.gz	OSBGRUZLWPQDAQ-CHWSQXEVSA-N	0	3	342.468	3.010	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)c1ccoc1Cl)NCc1ccccc1C#N	ZINC001134252713	1376437163	/nfs/dbraw/zinc/43/71/63/1376437163.db2.gz	UEBHWEDLLADEKO-CHWSQXEVSA-N	0	3	345.830	3.491	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)[C@H]2[C@@H]3CCCCCC[C@@H]32)ccc1F	ZINC001134314190	1376469578	/nfs/dbraw/zinc/46/95/78/1376469578.db2.gz	CDCUNPSGMLVFDO-DZFIZOCASA-N	0	3	343.446	3.120	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H](C)C[C@H](C)NCc1ccn(C2CCCC2)n1	ZINC001134341568	1376484548	/nfs/dbraw/zinc/48/45/48/1376484548.db2.gz	QJXQTFIXMIEQJC-DLBZAZTESA-N	0	3	344.503	3.031	20	30		EGEDHN
COc1ccc(CNCCNC(=O)CC2CCCCCC2)cc1C#N	ZINC001134410417	1376515337	/nfs/dbraw/zinc/51/53/37/1376515337.db2.gz	PQRNBGQHJJZWET-UHFFFAOYSA-N	0	3	343.471	3.133	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CCN(Cc3cc(C)cc(O)c3)C2)C1	ZINC001232879141	1376529111	/nfs/dbraw/zinc/52/91/11/1376529111.db2.gz	BSODFJQJPAWPER-FQEVSTJZSA-N	0	3	344.455	3.311	20	30		EGEDHN
C=CCO[C@@H]1CO[C@]2(C1)CCCN(Cc1ccc3ncoc3c1)C2	ZINC001232940786	1376543020	/nfs/dbraw/zinc/54/30/20/1376543020.db2.gz	GPWZGQIBZJIVDX-LPHOPBHVSA-N	0	3	328.412	3.154	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2nc(C)cs2)CCC1	ZINC001134587190	1376610231	/nfs/dbraw/zinc/61/02/31/1376610231.db2.gz	BERTYWSEEXXIRM-ZIAGYGMSSA-N	0	3	333.501	3.018	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)C[C@H](C)NCc2nc(C)cs2)CCC1	ZINC001134587189	1376610546	/nfs/dbraw/zinc/61/05/46/1376610546.db2.gz	BERTYWSEEXXIRM-UONOGXRCSA-N	0	3	333.501	3.018	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)C1(F)CCCC1	ZINC001134792142	1376725913	/nfs/dbraw/zinc/72/59/13/1376725913.db2.gz	ZAEPCCNZLZKIJV-RYUDHWBXSA-N	0	3	335.261	3.050	20	30		EGEDHN
C=CCCCN1CC[C@H]1CN(C)C(=O)c1c(C)nn(C(C)(C)C)c1C	ZINC001235037352	1376836859	/nfs/dbraw/zinc/83/68/59/1376836859.db2.gz	RAMCOTISPLSQHF-KRWDZBQOSA-N	0	3	346.519	3.367	20	30		EGEDHN
CCCCCCCN1CC[C@H]1CN(C)C(=O)C1(F)CCOCC1	ZINC001235123178	1376852641	/nfs/dbraw/zinc/85/26/41/1376852641.db2.gz	LBMRUISUSYONNH-INIZCTEOSA-N	0	3	328.472	3.008	20	30		EGEDHN
COc1ccc(CNCCNC(=O)[C@@H](C)[C@@H](C)C(C)(C)C)cc1C#N	ZINC001135177688	1376949859	/nfs/dbraw/zinc/94/98/59/1376949859.db2.gz	KBJJDWWCIDMFTR-LSDHHAIUSA-N	0	3	345.487	3.091	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](C)C[C@H](C)NCc1ccn(C(C)C)n1	ZINC001135182190	1376954166	/nfs/dbraw/zinc/95/41/66/1376954166.db2.gz	ZGYGSNNXWSAAGT-HOTGVXAUSA-N	0	3	334.508	3.439	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H](C)C[C@@H](C)NCc2nc(C)cs2)cc1	ZINC001135185363	1376958204	/nfs/dbraw/zinc/95/82/04/1376958204.db2.gz	YJFWPWWXQCRZTC-ZIAGYGMSSA-N	0	3	341.480	3.120	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H](C)C[C@H](C)NCc1conc1CC	ZINC001135188235	1376961135	/nfs/dbraw/zinc/96/11/35/1376961135.db2.gz	IGJYXHRADBLDMY-JKSUJKDBSA-N	0	3	333.476	3.194	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H](C)C[C@@H](C)NCc1ncc(C)s1	ZINC001135193345	1376964403	/nfs/dbraw/zinc/96/44/03/1376964403.db2.gz	HSRZDWTTZQKXMS-HUUCEWRRSA-N	0	3	335.517	3.408	20	30		EGEDHN
Cc1coc(C(=O)N[C@H](C)C[C@@H](C)NCc2cc(F)ccc2C#N)c1	ZINC001135269830	1377013145	/nfs/dbraw/zinc/01/31/45/1377013145.db2.gz	HSXJSJQYBCBEQP-ZIAGYGMSSA-N	0	3	343.402	3.286	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2oc(C)nc2C)CC1	ZINC001135384131	1377066828	/nfs/dbraw/zinc/06/68/28/1377066828.db2.gz	ZLTLLCYFBVYTEG-ZIAGYGMSSA-N	0	3	333.476	3.411	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H](C)C[C@H](C)NCc2conc2CC)CC1	ZINC001135383806	1377066910	/nfs/dbraw/zinc/06/69/10/1377066910.db2.gz	WMUUACOXOWLYOC-LSDHHAIUSA-N	0	3	333.476	3.356	20	30		EGEDHN
C=CCO[C@H]1CO[C@@]2(C1)CCCN(Cc1ccc3c(c1)COC3)C2	ZINC001137025371	1377460337	/nfs/dbraw/zinc/46/03/37/1377460337.db2.gz	BTLYCOCPEDJNQF-WOJBJXKFSA-N	0	3	329.440	3.043	20	30		EGEDHN
N#Cc1ccc(N2CCCN(Cc3c[nH]c4c3cccc4F)CC2)nc1	ZINC001137057741	1377469467	/nfs/dbraw/zinc/46/94/67/1377469467.db2.gz	NYVPYTRSWWQRMN-UHFFFAOYSA-N	0	3	349.413	3.286	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](N(C)[C@H]2CCc3c2cc(F)cc3F)C1	ZINC001189278750	1388505538	/nfs/dbraw/zinc/50/55/38/1388505538.db2.gz	BJVLRTQPVNBTOP-KDOFPFPSSA-N	0	3	334.410	3.451	20	30		EGEDHN
C=CCO[C@H]1CO[C@@]2(C1)CCCN(Cc1cc(C)ccc1OC)C2	ZINC001138486788	1377731628	/nfs/dbraw/zinc/73/16/28/1377731628.db2.gz	XRCOYMDTHRZRSU-UYAOXDASSA-N	0	3	331.456	3.330	20	30		EGEDHN
C#CCOc1ccc(CN(CC)CCNC(=O)OC(C)(C)C)cc1	ZINC001138560459	1377741962	/nfs/dbraw/zinc/74/19/62/1377741962.db2.gz	VMSDJGJGKGQMPV-UHFFFAOYSA-N	0	3	332.444	3.045	20	30		EGEDHN
C#CCOc1ccc(CN2CCC[C@@]3(C[C@@H](OCC=C)CO3)C2)cc1	ZINC001138558756	1377742056	/nfs/dbraw/zinc/74/20/56/1377742056.db2.gz	IFVPYGRESKQFSR-NHCUHLMSSA-N	0	3	341.451	3.025	20	30		EGEDHN
C=CCN1C(=O)CCC[C@@]12CCCN(Cc1c[nH]nc1C(C)(C)C)C2	ZINC001138576902	1377745750	/nfs/dbraw/zinc/74/57/50/1377745750.db2.gz	GTQMOPCDYYOWNF-FQEVSTJZSA-N	0	3	344.503	3.240	20	30		EGEDHN
C=C(C)COc1ccccc1CN1CC[C@@H]2[C@H](CCC(=O)N2C)C1	ZINC001138666178	1377765215	/nfs/dbraw/zinc/76/52/15/1377765215.db2.gz	LAPFPAOFECHZEL-SJLPKXTDSA-N	0	3	328.456	3.084	20	30		EGEDHN
Cn1ccc2c1cccc2CN1CCN(c2cccc(C#N)c2)CC1	ZINC001139162645	1377842089	/nfs/dbraw/zinc/84/20/89/1377842089.db2.gz	WZUGZXWVGKPWEO-UHFFFAOYSA-N	0	3	330.435	3.372	20	30		EGEDHN
O=C1C=C2CN(Cc3sccc3Br)CCC2S1	ZINC001139310909	1377866071	/nfs/dbraw/zinc/86/60/71/1377866071.db2.gz	GCECSZPRNLIDES-JTQLQIEISA-N	0	3	330.272	3.285	20	30		EGEDHN
N#Cc1ccnc(-c2ccc(CN3CCC4(CCOC4=O)CC3)cc2)c1	ZINC001139406588	1377879862	/nfs/dbraw/zinc/87/98/62/1377879862.db2.gz	VJCNPAMWCRJVOD-UHFFFAOYSA-N	0	3	347.418	3.149	20	30		EGEDHN
N#Cc1cccc2c(CN3CCC[C@](O)(C(F)(F)F)CC3)c[nH]c21	ZINC001139701255	1377937471	/nfs/dbraw/zinc/93/74/71/1377937471.db2.gz	DFUFWUZYXJDOLM-MRXNPFEDSA-N	0	3	337.345	3.319	20	30		EGEDHN
Cc1cnccc1O[C@H]1CCN(Cc2c[nH]c3c2cccc3C#N)C1	ZINC001139707725	1377938229	/nfs/dbraw/zinc/93/82/29/1377938229.db2.gz	QTNFCOPCGAICKI-KRWDZBQOSA-N	0	3	332.407	3.396	20	30		EGEDHN
COc1ccnc(O[C@H]2CCN(Cc3c[nH]c4ccc(C#N)cc34)C2)c1	ZINC001140117411	1378012021	/nfs/dbraw/zinc/01/20/21/1378012021.db2.gz	PQHHLYMTVIOMQX-KRWDZBQOSA-N	0	3	348.406	3.096	20	30		EGEDHN
CCCCN(CCC#N)Cc1ccc(N2CCN(CC)CC2)cc1	ZINC001140305316	1378042907	/nfs/dbraw/zinc/04/29/07/1378042907.db2.gz	UYPYGFBRSQSTEY-UHFFFAOYSA-N	0	3	328.504	3.344	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CCC3(CCN(CC=C)C3=O)CC2)c1[O-]	ZINC001273360469	1378098866	/nfs/dbraw/zinc/09/88/66/1378098866.db2.gz	OIDJITNZVKGZTD-UHFFFAOYSA-N	0	3	340.467	3.121	20	30		EGEDHN
C=C(C)CN1CC2(CCC1=O)CCN(Cc1cnc(C)c(C)c1)CC2	ZINC001274085711	1378115743	/nfs/dbraw/zinc/11/57/43/1378115743.db2.gz	DDPKFMKDOCLTTA-UHFFFAOYSA-N	0	3	341.499	3.479	20	30		EGEDHN
CCCN(Cc1cccc(C#N)c1Cl)C1CCN(C(C)=O)CC1	ZINC001140812955	1378147829	/nfs/dbraw/zinc/14/78/29/1378147829.db2.gz	PRYSPQVBNZWJHB-UHFFFAOYSA-N	0	3	333.863	3.435	20	30		EGEDHN
N#Cc1c(N)sc(CN2CCN(CC3CCCC3)CC2)c1Cl	ZINC001141111910	1378241862	/nfs/dbraw/zinc/24/18/62/1378241862.db2.gz	IFCRSKGIEWJHHE-UHFFFAOYSA-N	0	3	338.908	3.163	20	30		EGEDHN
C[C@@]1(CNCc2ccccc2C#N)CCN(C(=O)c2ccsc2)C1	ZINC001278457143	1378274057	/nfs/dbraw/zinc/27/40/57/1378274057.db2.gz	XALCXXWNQOKGSK-IBGZPJMESA-N	0	3	339.464	3.262	20	30		EGEDHN
Cc1ccc(C#N)c(NC(=O)[C@@H]2CC23CN(CCc2ccccc2)C3)c1	ZINC001280261210	1378338026	/nfs/dbraw/zinc/33/80/26/1378338026.db2.gz	VDCSNAYRMBIFCR-IBGZPJMESA-N	0	3	345.446	3.370	20	30		EGEDHN
N#Cc1ccc(Br)cc1CN1CCC2SC(=O)C=C2C1	ZINC001141896993	1378391391	/nfs/dbraw/zinc/39/13/91/1378391391.db2.gz	DQCHZSYMCJXYID-AWEZNQCLSA-N	0	3	349.253	3.095	20	30		EGEDHN
Cc1cc(Cl)ccc1CN(C)[C@H](C)CNC(=O)c1cc(C#N)c[nH]1	ZINC001282365337	1378502305	/nfs/dbraw/zinc/50/23/05/1378502305.db2.gz	DSCYEVGFQNWUJT-CYBMUJFWSA-N	0	3	344.846	3.099	20	30		EGEDHN
COc1cccc(O[C@H]2CCN(Cc3c[nH]c4cc(C#N)ccc34)C2)n1	ZINC001142930479	1378511274	/nfs/dbraw/zinc/51/12/74/1378511274.db2.gz	KBSWETARFDVTGM-INIZCTEOSA-N	0	3	348.406	3.096	20	30		EGEDHN
C#Cc1ccc(CN2CCC3(CCCN3c3ncccn3)CC2)cc1	ZINC001144569167	1378745676	/nfs/dbraw/zinc/74/56/76/1378745676.db2.gz	MEKRPMPZLUDCIM-UHFFFAOYSA-N	0	3	332.451	3.093	20	30		EGEDHN
C#Cc1ccc(CN2C[C@@H]3CCN(C(=O)OC(C)(C)C)[C@@H]3C2)cc1	ZINC001144568051	1378746147	/nfs/dbraw/zinc/74/61/47/1378746147.db2.gz	JDODSTDAZSEJRO-ZWKOTPCHSA-N	0	3	326.440	3.109	20	30		EGEDHN
C#Cc1ccc(CN2CCC3(CC2)C(=O)N(C)[C@@H]3c2ccccc2)cc1	ZINC001144572023	1378746408	/nfs/dbraw/zinc/74/64/08/1378746408.db2.gz	NBHHPUNOIGAFPN-OAQYLSRUSA-N	0	3	344.458	3.463	20	30		EGEDHN
C#Cc1ccc(CN2C[C@H]3CC[C@@H](C2)N(C(=O)OC(C)(C)C)C3)cc1	ZINC001144578782	1378747494	/nfs/dbraw/zinc/74/74/94/1378747494.db2.gz	PJAXJYAHCUEVBQ-MOPGFXCFSA-N	0	3	340.467	3.499	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)c1ccc(F)s1	ZINC001146712449	1378905049	/nfs/dbraw/zinc/90/50/49/1378905049.db2.gz	BMDWMNOMZZUVPB-ZJUUUORDSA-N	0	3	349.269	3.282	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N1CC2(C1)CCN(Cc1ccsc1)C2	ZINC001147991627	1379103940	/nfs/dbraw/zinc/10/39/40/1379103940.db2.gz	CULJAAOJPCIIJW-GOSISDBHSA-N	0	3	348.512	3.011	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC2(C1)CCN(Cc1sc(C)nc1C)C2	ZINC001148147685	1379125557	/nfs/dbraw/zinc/12/55/57/1379125557.db2.gz	XQVAAKRQXXGCAZ-CQSZACIVSA-N	0	3	347.528	3.397	20	30		EGEDHN
CC(C)(C)c1ccc(C(=O)NCCNCc2cccc(C#N)c2)cc1	ZINC001148751797	1379260314	/nfs/dbraw/zinc/26/03/14/1379260314.db2.gz	RKFFEJFTWTZMLO-UHFFFAOYSA-N	0	3	335.451	3.375	20	30		EGEDHN
CC(C)(CC(=O)NCCNCc1cccc(C#N)c1)CC(F)(F)F	ZINC001149166552	1379338342	/nfs/dbraw/zinc/33/83/42/1379338342.db2.gz	GYPBSDUKTMMQAZ-UHFFFAOYSA-N	0	3	341.377	3.133	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2coc3ccc(F)cc32)s1	ZINC001149267857	1379356953	/nfs/dbraw/zinc/35/69/53/1379356953.db2.gz	FOIIXPJHRBRYRJ-UHFFFAOYSA-N	0	3	343.383	3.025	20	30		EGEDHN
C=CCCC(=O)NC[C@@H]1CN(Cc2ccccc2C(C)C)CCCO1	ZINC001149362783	1379369320	/nfs/dbraw/zinc/36/93/20/1379369320.db2.gz	UCGHHMHIMIVTPQ-LJQANCHMSA-N	0	3	344.499	3.483	20	30		EGEDHN
C#CCCCCC(=O)NC[C@H]1CN([C@@H](C)c2ccccc2)CCCO1	ZINC001149580825	1379406896	/nfs/dbraw/zinc/40/68/96/1379406896.db2.gz	YJBWXHDBWRZKEP-ICSRJNTNSA-N	0	3	342.483	3.148	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CCCO[C@@H](CNC(=O)C#CC(C)(C)C)C1	ZINC001149686655	1379427925	/nfs/dbraw/zinc/42/79/25/1379427925.db2.gz	FYDTUXPECPXQAV-HKUYNNGSSA-N	0	3	342.483	3.004	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H]1CN([C@H](C)c2ccccc2)CCCO1	ZINC001149797034	1379448947	/nfs/dbraw/zinc/44/89/47/1379448947.db2.gz	QFEHBVWKZYYBNH-IEBWSBKVSA-N	0	3	330.472	3.311	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H]1CN(Cc2cc(C)ccc2C)CCCO1	ZINC001150084756	1379492062	/nfs/dbraw/zinc/49/20/62/1379492062.db2.gz	GUHGKLDRVNWKME-LJQANCHMSA-N	0	3	344.499	3.223	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@H]1CN(CC2=CCCCC2)CCCO1	ZINC001150138768	1379501093	/nfs/dbraw/zinc/50/10/93/1379501093.db2.gz	DVABAEWKYCDENF-MJGOQNOKSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@@H]1CN(CC2=CCCCC2)CCCO1	ZINC001150159590	1379504964	/nfs/dbraw/zinc/50/49/64/1379504964.db2.gz	KUVKMTATPZMYFR-PKOBYXMFSA-N	0	3	334.504	3.296	20	30		EGEDHN
Cc1ccc2c(CC(=O)NCCNCc3cccc(C#N)c3)coc2c1	ZINC001150225963	1379518682	/nfs/dbraw/zinc/51/86/82/1379518682.db2.gz	CGRFVNSZKKGYHK-UHFFFAOYSA-N	0	3	347.418	3.061	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@H]1CN(Cc2ccccc2C)CCCO1	ZINC001150245974	1379522022	/nfs/dbraw/zinc/52/20/22/1379522022.db2.gz	BMCYOBMPMBMPRC-PZJWPPBQSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@@H]1CN(Cc2ccc(C)cc2)CCCO1	ZINC001150253702	1379523428	/nfs/dbraw/zinc/52/34/28/1379523428.db2.gz	FREBXONIGBONQC-TZIWHRDSSA-N	0	3	344.499	3.304	20	30		EGEDHN
CCCc1cc(C(=O)NCCNCc2ccc(C#N)s2)sc1C	ZINC001150349923	1379536081	/nfs/dbraw/zinc/53/60/81/1379536081.db2.gz	MTGUOJNUKYZHLR-UHFFFAOYSA-N	0	3	347.509	3.462	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)C[C@H](CC)c2ccccc2)C1	ZINC001150579129	1379572605	/nfs/dbraw/zinc/57/26/05/1379572605.db2.gz	KMKDSHYHDYOTHN-ICSRJNTNSA-N	0	3	344.499	3.354	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)C[C@@H](C)c2ccc(F)cc2)C1	ZINC001150754396	1379607765	/nfs/dbraw/zinc/60/77/65/1379607765.db2.gz	ZOOUEOUQFDIGOQ-APWZRJJASA-N	0	3	348.462	3.103	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)[C@]2(C)CCC(C)=C(C)C2)C1	ZINC001150818374	1379618631	/nfs/dbraw/zinc/61/86/31/1379618631.db2.gz	QBUBQVAXWCEYRF-AZUAARDMSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)C/C=C/c2ccc(C)cc2)C1	ZINC001150848071	1379621270	/nfs/dbraw/zinc/62/12/70/1379621270.db2.gz	DFHANTUMPOBWEZ-XXIDSNJLSA-N	0	3	342.483	3.182	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)Cc2cc(C)ccc2C)CC1	ZINC001151288014	1379694280	/nfs/dbraw/zinc/69/42/80/1379694280.db2.gz	IEULPHCZCQLOFQ-UHFFFAOYSA-N	0	3	344.499	3.019	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)C[C@H]2CCCC[C@H]2C)CC1	ZINC001151412376	1379714334	/nfs/dbraw/zinc/71/43/34/1379714334.db2.gz	AQWARRISYZQXFO-QZTJIDSGSA-N	0	3	336.520	3.376	20	30		EGEDHN
CCCCCCCC[C@H](C)C(=O)NCCN[C@H](CCCC)C(N)=O	ZINC001151847908	1379798937	/nfs/dbraw/zinc/79/89/37/1379798937.db2.gz	BZULRJORWTZTQT-DLBZAZTESA-N	0	3	341.540	3.123	20	30		EGEDHN
C=C[C@@H](CC(=O)NCCNCc1ccc(C#N)s1)c1ccccc1	ZINC001151942494	1379821387	/nfs/dbraw/zinc/82/13/87/1379821387.db2.gz	IEWLQXLWNDFCRN-HNNXBMFYSA-N	0	3	339.464	3.185	20	30		EGEDHN
CCC(CC)C(=O)NC[C@@H](C)N(CC)Cc1ccc(OC)c(C#N)c1	ZINC001151980616	1379829231	/nfs/dbraw/zinc/82/92/31/1379829231.db2.gz	DHBWLLQQWVHKLH-OAHLLOKOSA-N	0	3	345.487	3.330	20	30		EGEDHN
C=C[C@@H](C(=O)NCCNCc1ccc(OC)c(F)c1)c1ccccc1	ZINC001151990934	1379833446	/nfs/dbraw/zinc/83/34/46/1379833446.db2.gz	SQWXEZMYQLTOBP-QGZVFWFLSA-N	0	3	342.414	3.010	20	30		EGEDHN
Cc1ccc2oc(C(=O)NCCNCc3ccc(C#N)cc3)cc2c1	ZINC001152388906	1379924615	/nfs/dbraw/zinc/92/46/15/1379924615.db2.gz	HDMDZGWKIQTQSP-UHFFFAOYSA-N	0	3	333.391	3.133	20	30		EGEDHN
CCC[C@@H](C)C(=O)NC[C@@H](C)N(CC)Cc1ccc(OC)c(C#N)c1	ZINC001152459516	1379936915	/nfs/dbraw/zinc/93/69/15/1379936915.db2.gz	FFTIVLHJXUFOEV-HZPDHXFCSA-N	0	3	345.487	3.330	20	30		EGEDHN
CCC[C@H](C)C(=O)NC[C@@H](C)N(CC)Cc1ccc(F)c(C#N)c1	ZINC001152459628	1379937020	/nfs/dbraw/zinc/93/70/20/1379937020.db2.gz	HLJTVNRAQXUZBN-LSDHHAIUSA-N	0	3	333.451	3.460	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)C1CC(C)C1	ZINC001152729148	1379976417	/nfs/dbraw/zinc/97/64/17/1379976417.db2.gz	IIETZVIABSENQN-NPCAHTBFSA-N	0	3	331.435	3.070	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)[C@@H]1CC1(C)C	ZINC001152801714	1379982148	/nfs/dbraw/zinc/98/21/48/1379982148.db2.gz	BWSRHSUVIKUSOK-CJNGLKHVSA-N	0	3	331.435	3.070	20	30		EGEDHN
C#CCC1(C(=O)NCCNCc2ccc(C)c(F)c2)CCCCC1	ZINC001153009151	1380007568	/nfs/dbraw/zinc/00/75/68/1380007568.db2.gz	HQIINOAZFHCIJP-UHFFFAOYSA-N	0	3	330.447	3.314	20	30		EGEDHN
Cc1ccc(/C=C/CC(=O)NCCNCc2cccc(C#N)c2)cc1	ZINC001153974194	1380166052	/nfs/dbraw/zinc/16/60/52/1380166052.db2.gz	LHVWKFJQQAKSDG-ONEGZZNKSA-N	0	3	333.435	3.176	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)[C@H]1CCCC12CC2	ZINC001154009365	1380177660	/nfs/dbraw/zinc/17/76/60/1380177660.db2.gz	LRVQNZOXKATUPO-VQIMIIECSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C1CCc2ccccc2CC1	ZINC001154126996	1380213709	/nfs/dbraw/zinc/21/37/09/1380213709.db2.gz	HCLLQRVATCLGDC-QGZVFWFLSA-N	0	3	326.484	3.032	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)c1cocc1C	ZINC001154649398	1380324100	/nfs/dbraw/zinc/32/41/00/1380324100.db2.gz	OEGPLNOQFULTTE-OAHLLOKOSA-N	0	3	325.412	3.100	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@H](C)N(CC)Cc1ccc(OC)c(F)c1	ZINC001154715509	1380338526	/nfs/dbraw/zinc/33/85/26/1380338526.db2.gz	JOKAJBHFZPDOLS-MRXNPFEDSA-N	0	3	348.462	3.355	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H](C)N(CC)C[C@H]1COc2ccccc2O1	ZINC001154958021	1380381083	/nfs/dbraw/zinc/38/10/83/1380381083.db2.gz	WOOHANTYPAELHW-SJORKVTESA-N	0	3	346.471	3.009	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C(C)(C)c1ccc(Cl)cc1	ZINC001154973066	1380383200	/nfs/dbraw/zinc/38/32/00/1380383200.db2.gz	IRJJZBHKCZXRKL-OAHLLOKOSA-N	0	3	334.891	3.468	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NCCCN[C@@H](C)c1cc(F)ccc1F	ZINC001155438348	1380453333	/nfs/dbraw/zinc/45/33/33/1380453333.db2.gz	AMBORKYTYWYQMU-KBPBESRZSA-N	0	3	340.414	3.103	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)[C@@H]1CC12CCC2	ZINC001155504732	1380462143	/nfs/dbraw/zinc/46/21/43/1380462143.db2.gz	YYVSYTCXXKGNGJ-QAPCUYQASA-N	0	3	325.456	3.075	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)CC2=CCCCC2)c(F)c1	ZINC001155748479	1380488652	/nfs/dbraw/zinc/48/86/52/1380488652.db2.gz	JBEWVGZOTJXUII-UHFFFAOYSA-N	0	3	329.419	3.184	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)[C@@H]1C[C@H]1C1CCC1	ZINC001155757231	1380489474	/nfs/dbraw/zinc/48/94/74/1380489474.db2.gz	CIQNXABOPZADQW-UIAACRFSSA-N	0	3	339.483	3.321	20	30		EGEDHN
CCN(CC#CCOC)[C@H](C)CNC(=O)C[C@H]1CCCC(C)(C)C1	ZINC001156390059	1380570106	/nfs/dbraw/zinc/57/01/06/1380570106.db2.gz	GDBUWFIHUWYSGF-QZTJIDSGSA-N	0	3	336.520	3.069	20	30		EGEDHN
C=C(Br)CNCC1CC(NC(=O)[C@@]2(C)CC=CCC2)C1	ZINC001755211131	1440783055	/nfs/dbraw/zinc/78/30/55/1440783055.db2.gz	IHWHMLXCXKZNNT-XUJLQICISA-N	0	3	341.293	3.126	20	30		EGEDHN
C#CCCCCC(=O)NCCCNCc1c(Cl)cccc1OC	ZINC001156815969	1380644866	/nfs/dbraw/zinc/64/48/66/1380644866.db2.gz	GAQVAGMCBJXTNY-UHFFFAOYSA-N	0	3	336.863	3.138	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@@H](C)Cc1cccc(Cl)c1	ZINC001157363964	1380853502	/nfs/dbraw/zinc/85/35/02/1380853502.db2.gz	BFGJDXDGHLABQN-JKSUJKDBSA-N	0	3	334.891	3.369	20	30		EGEDHN
O=C(C#CC1CC1)NCCCNCc1ccc(Cl)cc1Cl	ZINC001157683086	1381000606	/nfs/dbraw/zinc/00/06/06/1381000606.db2.gz	YVURDGGKCNUBHE-UHFFFAOYSA-N	0	3	325.239	3.003	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCCC[C@@H]1CN(C)CCOC1CCCCCC1	ZINC001157717758	1381013121	/nfs/dbraw/zinc/01/31/21/1381013121.db2.gz	FBYBSVZGADNSNM-QZTJIDSGSA-N	0	3	349.519	3.198	20	30		EGEDHN
N#Cc1nc(Cl)ccc1C(F)(F)N1CCN[C@H](c2ccccc2)C1	ZINC001157758717	1381024742	/nfs/dbraw/zinc/02/47/42/1381024742.db2.gz	DQKMNAWJUNOUKK-HNNXBMFYSA-N	0	3	348.784	3.302	20	30		EGEDHN
N#Cc1c(Cl)cc(Cl)nc1N1CCN[C@H](c2ccccc2)C1	ZINC001157767390	1381028214	/nfs/dbraw/zinc/02/82/14/1381028214.db2.gz	XHYHYVIVFWXYDB-AWEZNQCLSA-N	0	3	333.222	3.411	20	30		EGEDHN
C[C@@H]1C[C@@H]1c1ccc(C(=O)NCCCNCc2ccccc2C#N)o1	ZINC001157919262	1381070187	/nfs/dbraw/zinc/07/01/87/1381070187.db2.gz	PGHDCARULRQHMA-PBHICJAKSA-N	0	3	337.423	3.184	20	30		EGEDHN
CCCCCCO[C@@H](C)C(=O)NCCCNCc1ccccc1C#N	ZINC001157924061	1381072740	/nfs/dbraw/zinc/07/27/40/1381072740.db2.gz	DPYMCPAPZUCZEK-KRWDZBQOSA-N	0	3	345.487	3.140	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc(C)c(OC)c(C)c1	ZINC001157981262	1381092030	/nfs/dbraw/zinc/09/20/30/1381092030.db2.gz	DICOJSIAKPMWLD-GOSISDBHSA-N	0	3	330.472	3.425	20	30		EGEDHN
C=C(C)CCC(=O)N1CCCC[C@@H]1CN(C)CCn1nc(C)cc1C	ZINC001158019207	1381105504	/nfs/dbraw/zinc/10/55/04/1381105504.db2.gz	UXRWCRDXOJIBBY-LJQANCHMSA-N	0	3	346.519	3.169	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc(-c2ccncc2)o1	ZINC001158067132	1381119255	/nfs/dbraw/zinc/11/92/55/1381119255.db2.gz	VNIFVVBDHBYPEP-QGZVFWFLSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)[C@H]1CCCC12CC2	ZINC001158123849	1381134910	/nfs/dbraw/zinc/13/49/10/1381134910.db2.gz	FUIKPILYQGWECU-QZTJIDSGSA-N	0	3	334.504	3.082	20	30		EGEDHN
CN1CCN(C(F)(F)c2ccnc(Cl)c2C#N)C2(CCCC2)C1	ZINC001158408749	1381233729	/nfs/dbraw/zinc/23/37/29/1381233729.db2.gz	OQHAYWVFLCEWQX-UHFFFAOYSA-N	0	3	340.805	3.216	20	30		EGEDHN
CN1CCC(N(Cc2ccc(F)cc2)c2ncc(F)cc2C#N)CC1	ZINC001158446321	1381248235	/nfs/dbraw/zinc/24/82/35/1381248235.db2.gz	PVNPDPAJKKXIFO-UHFFFAOYSA-N	0	3	342.393	3.332	20	30		EGEDHN
Cc1ccc([C@@H](C#N)c2ccc(N3CCN(C(C)C)[C@@H](C)C3)nn2)cc1	ZINC001158494185	1381267716	/nfs/dbraw/zinc/26/77/16/1381267716.db2.gz	VSXXVZUQTAVQRP-PKOBYXMFSA-N	0	3	349.482	3.359	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H]1CCc2ccccc2C1	ZINC001158522118	1381280033	/nfs/dbraw/zinc/28/00/33/1381280033.db2.gz	MHTFLZPBDRPMIM-VQTJNVASSA-N	0	3	326.484	3.290	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)[C@@H](C)c1ccc(C)o1	ZINC001158565570	1381302941	/nfs/dbraw/zinc/30/29/41/1381302941.db2.gz	RLHMMPJCIDTPOO-ZWKOTPCHSA-N	0	3	348.487	3.207	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1C[C@H]1c1ccccc1F	ZINC001158588062	1381308948	/nfs/dbraw/zinc/30/89/48/1381308948.db2.gz	NNWPQTBQQBJIAP-BPQIPLTHSA-N	0	3	330.447	3.428	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)CCCOc1ccccc1	ZINC001158825058	1381420242	/nfs/dbraw/zinc/42/02/42/1381420242.db2.gz	KJXJJZHUTOXFGB-GOSISDBHSA-N	0	3	330.472	3.345	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NCCCNCc1cccc(F)c1F	ZINC001158857821	1381436936	/nfs/dbraw/zinc/43/69/36/1381436936.db2.gz	VMRMBIPUORYYDO-UHFFFAOYSA-N	0	3	330.806	3.339	20	30		EGEDHN
C=CCCC(=O)NCCC1=CCN(Cc2cccc(OC)c2)CC1	ZINC001159544235	1381823998	/nfs/dbraw/zinc/82/39/98/1381823998.db2.gz	MKIRUYPPIZDVEC-UHFFFAOYSA-N	0	3	328.456	3.300	20	30		EGEDHN
C#CCCCCC(=O)NCCC1=CCN(Cc2cnccc2C)CC1	ZINC001159880594	1381927244	/nfs/dbraw/zinc/92/72/44/1381927244.db2.gz	MYTUTUIYTIWBLY-UHFFFAOYSA-N	0	3	339.483	3.222	20	30		EGEDHN
C=CCn1cccc1C(=O)NCCCNCc1cc(F)ccc1Cl	ZINC001159974989	1381955501	/nfs/dbraw/zinc/95/55/01/1381955501.db2.gz	PJEMHZASQZSQNY-UHFFFAOYSA-N	0	3	349.837	3.376	20	30		EGEDHN
CC(C)C#CC(=O)NCCC1=CCN(C/C=C/c2ccccc2)CC1	ZINC001160055024	1381983601	/nfs/dbraw/zinc/98/36/01/1381983601.db2.gz	RDHTVLSYDPKACZ-RMKNXTFCSA-N	0	3	336.479	3.498	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccoc2C(F)(F)F)CC1	ZINC001160253108	1382049820	/nfs/dbraw/zinc/04/98/20/1382049820.db2.gz	LEZNCRRJYFCKJK-UHFFFAOYSA-N	0	3	328.334	3.236	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc3ccncc3s2)CC1	ZINC001160379639	1382088144	/nfs/dbraw/zinc/08/81/44/1382088144.db2.gz	MJGAUHGZJFUFBQ-UHFFFAOYSA-N	0	3	339.464	3.072	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2scnc2C(F)(F)F)CC1	ZINC001160379534	1382088197	/nfs/dbraw/zinc/08/81/97/1382088197.db2.gz	HZULBNHNKFNUDN-UHFFFAOYSA-N	0	3	345.390	3.100	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cnc(-c3ccccc3)o2)CC1	ZINC001160415752	1382098436	/nfs/dbraw/zinc/09/84/36/1382098436.db2.gz	CTSLJOKHGMSWFQ-UHFFFAOYSA-N	0	3	337.423	3.280	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C/C=C\c2ccc(F)cc2)CC1	ZINC001160472854	1382115757	/nfs/dbraw/zinc/11/57/57/1382115757.db2.gz	BMMJNUCCEHROQC-PLNGDYQASA-N	0	3	340.442	3.391	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCC1=CCN(Cc2cccnc2C)CC1	ZINC001160942463	1382245514	/nfs/dbraw/zinc/24/55/14/1382245514.db2.gz	YYKHFMQISSMYMY-SJORKVTESA-N	0	3	341.499	3.487	20	30		EGEDHN
CC#CCCCC(=O)NCCC1=CCN(Cc2ncccc2C)CC1	ZINC001160946390	1382248249	/nfs/dbraw/zinc/24/82/49/1382248249.db2.gz	CIGFUXOWDVUCPX-UHFFFAOYSA-N	0	3	339.483	3.222	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCC1=CCN(CCOCC2CC2)CC1	ZINC001161343552	1382375992	/nfs/dbraw/zinc/37/59/92/1382375992.db2.gz	IYMJKZWTNMKDAX-UHFFFAOYSA-N	0	3	334.504	3.154	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C2(Cc3ccccc3F)CC2)CC1	ZINC001161422766	1382405179	/nfs/dbraw/zinc/40/51/79/1382405179.db2.gz	YHRZPZOIOLLQEH-UHFFFAOYSA-N	0	3	342.458	3.473	20	30		EGEDHN
CCc1ccc(F)cc1C(=O)NCCCNCc1ccccc1C#N	ZINC001161804329	1382511823	/nfs/dbraw/zinc/51/18/23/1382511823.db2.gz	UZQYVHQDQYDPFO-UHFFFAOYSA-N	0	3	339.414	3.169	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H](C)Oc2cccc(C)c2)CC1	ZINC001161824697	1382521964	/nfs/dbraw/zinc/52/19/64/1382521964.db2.gz	NTDGAIGVZPIIOL-QGZVFWFLSA-N	0	3	328.456	3.087	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc(OC)c(Cl)c2)CC1	ZINC001161845249	1382527251	/nfs/dbraw/zinc/52/72/51/1382527251.db2.gz	ZSAJBEYREVVTRL-UHFFFAOYSA-N	0	3	346.858	3.124	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H](C)c2ccc(F)cc2F)CC1	ZINC001161904036	1382546151	/nfs/dbraw/zinc/54/61/51/1382546151.db2.gz	AJFQDAKVAJNXJC-AWEZNQCLSA-N	0	3	334.410	3.393	20	30		EGEDHN
C#CCC1(C(=O)NCCC2=CCN(CC#CC)CC2)CCCCC1	ZINC001161972547	1382578510	/nfs/dbraw/zinc/57/85/10/1382578510.db2.gz	FRQFXOONBVEASD-UHFFFAOYSA-N	0	3	326.484	3.122	20	30		EGEDHN
CCCCc1cc(N2CCCN(Cc3ccc(C#N)cc3)CC2)ncn1	ZINC001162032304	1382609168	/nfs/dbraw/zinc/60/91/68/1382609168.db2.gz	MPKIFOQJZCQHSX-UHFFFAOYSA-N	0	3	349.482	3.403	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1ccc(-c2ccco2)o1	ZINC001162257900	1382700540	/nfs/dbraw/zinc/70/05/40/1382700540.db2.gz	WDSNSJAPKNZCAX-UHFFFAOYSA-N	0	3	349.390	3.321	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC1(COC)CCN(C[C@@H](F)CC)CC1	ZINC001162464794	1382765127	/nfs/dbraw/zinc/76/51/27/1382765127.db2.gz	VDPQOBUBLVBNNJ-WMZOPIPTSA-N	0	3	342.499	3.182	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)C(CC)(CC)CC)(COC)CC1	ZINC001162546349	1382785808	/nfs/dbraw/zinc/78/58/08/1382785808.db2.gz	XAWYYLCCUPIFHK-UHFFFAOYSA-N	0	3	336.520	3.071	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C[C@H](C)C(C)C	ZINC001162737695	1382852411	/nfs/dbraw/zinc/85/24/11/1382852411.db2.gz	MNVRJYXWYIUJKM-IBGZPJMESA-N	0	3	328.500	3.353	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)Cc1c(C)cccc1C	ZINC001162822410	1382887116	/nfs/dbraw/zinc/88/71/16/1382887116.db2.gz	OPCHKBPOPRTRIX-UHFFFAOYSA-N	0	3	348.490	3.140	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C[C@@H]1CCC(F)(F)C1	ZINC001162826264	1382887415	/nfs/dbraw/zinc/88/74/15/1382887415.db2.gz	BOABVWLWMNIJFF-SFHVURJKSA-N	0	3	348.437	3.106	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)CC(C)=C(C)C	ZINC001162886893	1382905031	/nfs/dbraw/zinc/90/50/31/1382905031.db2.gz	FFNDYHLGMUQCLM-UHFFFAOYSA-N	0	3	326.484	3.417	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C[C@@H]1CCCC1(F)F	ZINC001162906269	1382911533	/nfs/dbraw/zinc/91/15/33/1382911533.db2.gz	HOKNGOQRIQEMNF-SFHVURJKSA-N	0	3	348.437	3.106	20	30		EGEDHN
C=C(C)CCC(=O)NCc1ccc(CN2CCN(CCC)CC2)cc1	ZINC001163024801	1382951366	/nfs/dbraw/zinc/95/13/66/1382951366.db2.gz	UNDHOWYIQBTPFP-UHFFFAOYSA-N	0	3	343.515	3.187	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@H]1CCCC[C@H]1C1CC1	ZINC001163173259	1382984484	/nfs/dbraw/zinc/98/44/84/1382984484.db2.gz	WTIMTWNYXDLKOA-GJZGRUSLSA-N	0	3	343.309	3.207	20	30		EGEDHN
C[Si](C)(C)C#Cc1ccc(N[C@H]2CCCC[C@@]23CNCCO3)nc1	ZINC001163645060	1383093980	/nfs/dbraw/zinc/09/39/80/1383093980.db2.gz	YSOXPNQIBWOQBM-PKOBYXMFSA-N	0	3	343.547	3.024	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCCNCc1cscc1Br	ZINC001163953042	1383139270	/nfs/dbraw/zinc/13/92/70/1383139270.db2.gz	FUTXSXDXRPLHIS-UHFFFAOYSA-N	0	3	345.306	3.319	20	30		EGEDHN
CC#CCCCC(=O)NCCCNCc1cnc(-c2ccccc2)o1	ZINC001164244536	1383170770	/nfs/dbraw/zinc/17/07/70/1383170770.db2.gz	GXXYAGAAAGMYFK-UHFFFAOYSA-N	0	3	339.439	3.131	20	30		EGEDHN
CC#CCCCC(=O)NCCCNCc1nc2cc(C)ccc2s1	ZINC001164245223	1383170774	/nfs/dbraw/zinc/17/07/74/1383170774.db2.gz	XCVGTHICBRLCJC-UHFFFAOYSA-N	0	3	343.496	3.394	20	30		EGEDHN
C#CCCCC(=O)NCCC1(CNCc2cccc(F)c2F)CC1	ZINC001164297992	1383175599	/nfs/dbraw/zinc/17/55/99/1383175599.db2.gz	YTNNUTBZBSIGPP-UHFFFAOYSA-N	0	3	334.410	3.144	20	30		EGEDHN
CC(C(=O)NCCC1(CNCc2ccccc2C#N)CC1)=C1CCC1	ZINC001164476549	1383190587	/nfs/dbraw/zinc/19/05/87/1383190587.db2.gz	LBTUIVSQFLYGGH-UHFFFAOYSA-N	0	3	337.467	3.435	20	30		EGEDHN
O=C(C#CC1CC1)NCCC1(CNCc2cc(F)ccc2Cl)CC1	ZINC001164487526	1383192220	/nfs/dbraw/zinc/19/22/20/1383192220.db2.gz	VRAYFGDLPVBFCT-UHFFFAOYSA-N	0	3	348.849	3.269	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCC1(CNCc2cnoc2C)CC1	ZINC001164647747	1383213452	/nfs/dbraw/zinc/21/34/52/1383213452.db2.gz	HRFQDZULSXCJHB-UHFFFAOYSA-N	0	3	331.460	3.128	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)C(C1CCC1)C1CCC1	ZINC001165214605	1383250533	/nfs/dbraw/zinc/25/05/33/1383250533.db2.gz	QXZTYXLTNVBLES-UHFFFAOYSA-N	0	3	339.483	3.371	20	30		EGEDHN
C=CCCCC(=O)NCCCNCc1sccc1Br	ZINC001165559199	1383310078	/nfs/dbraw/zinc/31/00/78/1383310078.db2.gz	DRQIDOGKZMDHRA-UHFFFAOYSA-N	0	3	345.306	3.463	20	30		EGEDHN
C=CCC1(C(=O)NCCCNCc2cnc(Cl)s2)CCC1	ZINC001165998375	1383375949	/nfs/dbraw/zinc/37/59/49/1383375949.db2.gz	SWQFORINFYSVCC-UHFFFAOYSA-N	0	3	327.881	3.139	20	30		EGEDHN
C[C@]1(C(=O)NCCC2(CNCc3ccccc3C#N)CC2)C=CCC1	ZINC001166655221	1383454147	/nfs/dbraw/zinc/45/41/47/1383454147.db2.gz	LZZVWCMVXCAHFR-FQEVSTJZSA-N	0	3	337.467	3.291	20	30		EGEDHN
C=C/C(C)=C/CC(=O)NCCC1(CNCC(=C)Br)CC1	ZINC001166678762	1383458558	/nfs/dbraw/zinc/45/85/58/1383458558.db2.gz	JIDZIOGSWFAELD-WLRTZDKTSA-N	0	3	341.293	3.294	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCCC1(CNCc2cccnc2OC)CC1	ZINC001166746539	1383470311	/nfs/dbraw/zinc/47/03/11/1383470311.db2.gz	GRGQMKVNAIVBQT-MRXNPFEDSA-N	0	3	345.487	3.069	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCCC1(CN[C@H](C)c2cnc(C)cn2)CC1	ZINC001166755601	1383472369	/nfs/dbraw/zinc/47/23/69/1383472369.db2.gz	MFZOHSCIKPQBSH-DOTOQJQBSA-N	0	3	344.503	3.324	20	30		EGEDHN
CCC(C)(C)C(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001166940565	1383502376	/nfs/dbraw/zinc/50/23/76/1383502376.db2.gz	KTMLRHRMIAIUTC-UHFFFAOYSA-N	0	3	327.472	3.371	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCC1(CNCc2cc(OC)ccn2)CC1	ZINC001167026259	1383522795	/nfs/dbraw/zinc/52/27/95/1383522795.db2.gz	XICBLMHDWVFICW-LJQANCHMSA-N	0	3	345.487	3.069	20	30		EGEDHN
C=Cc1ccc(C(=O)NCCCNCc2cc(C#N)ccc2F)cc1	ZINC001167230628	1383571185	/nfs/dbraw/zinc/57/11/85/1383571185.db2.gz	STIYROUJDFEMJS-UHFFFAOYSA-N	0	3	337.398	3.250	20	30		EGEDHN
C[C@H](C(=O)NCCC1(CNCc2ccccc2C#N)CC1)C(C)(F)F	ZINC001167251564	1383576321	/nfs/dbraw/zinc/57/63/21/1383576321.db2.gz	WECXOYIRKBFHOP-CQSZACIVSA-N	0	3	349.425	3.226	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)CCN(C)c2ccccc2)CC1	ZINC001167469148	1383642731	/nfs/dbraw/zinc/64/27/31/1383642731.db2.gz	URSGOENTVIEYBT-UHFFFAOYSA-N	0	3	349.906	3.142	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)CCc2scnc2C)CC1	ZINC001167590670	1383682791	/nfs/dbraw/zinc/68/27/91/1383682791.db2.gz	ABKLKKACUROETP-UHFFFAOYSA-N	0	3	341.908	3.013	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@]1(C)CC[C@H](C)C1(C)C	ZINC001167666794	1383704924	/nfs/dbraw/zinc/70/49/24/1383704924.db2.gz	BVWFPCQSUPQTQF-LRDDRELGSA-N	0	3	345.325	3.453	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cnc(C3CC3)s2)CC1	ZINC001167815692	1383747080	/nfs/dbraw/zinc/74/70/80/1383747080.db2.gz	YOZWYSPFHKHIFX-UHFFFAOYSA-N	0	3	339.892	3.263	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1	ZINC001167949840	1383777140	/nfs/dbraw/zinc/77/71/40/1383777140.db2.gz	JZCCNRLTSRFQRD-LSDHHAIUSA-N	0	3	327.255	3.292	20	30		EGEDHN
C=C[C@@H](C(=O)NCCC1(CNCc2ccccn2)CC1)c1ccccc1	ZINC001168276837	1383860511	/nfs/dbraw/zinc/86/05/11/1383860511.db2.gz	IXWDMNXKNPKPPM-HXUWFJFHSA-N	0	3	349.478	3.428	20	30		EGEDHN
C[C@H](CCCCNCc1cc(F)ccc1C#N)NC(=O)C(C)(F)F	ZINC001168768856	1383997775	/nfs/dbraw/zinc/99/77/75/1383997775.db2.gz	KBAUUHVEYZLTFI-GFCCVEGCSA-N	0	3	341.377	3.117	20	30		EGEDHN
CC(C)=CC(=O)N[C@@H](C)CCCCNCc1cc(F)ccc1C#N	ZINC001168950614	1384068437	/nfs/dbraw/zinc/06/84/37/1384068437.db2.gz	FHJUOXJRRCQJOC-HNNXBMFYSA-N	0	3	331.435	3.428	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)c1cc(-c2ccccc2)ccn1	ZINC001169177461	1384119638	/nfs/dbraw/zinc/11/96/38/1384119638.db2.gz	CPEGATJLTIZKIT-UHFFFAOYSA-N	0	3	329.831	3.211	20	30		EGEDHN
C[C@H](CCCCNCc1cc(F)ccc1C#N)NC(=O)/C=C\C1CC1	ZINC001169981540	1384209923	/nfs/dbraw/zinc/20/99/23/1384209923.db2.gz	GDBSRQWFMZVERS-YYRKOSNBSA-N	0	3	343.446	3.428	20	30		EGEDHN
CC[C@H](C)OCC(=O)N[C@H](C)CCCCNCc1ccccc1C#N	ZINC001170233567	1384272406	/nfs/dbraw/zinc/27/24/06/1384272406.db2.gz	SNHHQXVVQGUZJS-SJORKVTESA-N	0	3	345.487	3.138	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H](C)CCCCNCc1nc(C)cs1	ZINC001170283769	1384282310	/nfs/dbraw/zinc/28/23/10/1384282310.db2.gz	YIDBXRKRPMPVCQ-HNNXBMFYSA-N	0	3	335.517	3.410	20	30		EGEDHN
C(#Cc1ccccc1)CNc1cccc2cc([C@@H]3CNCCO3)cn21	ZINC001170429956	1384316965	/nfs/dbraw/zinc/31/69/65/1384316965.db2.gz	TUOUAEDKASHJHE-FQEVSTJZSA-N	0	3	331.419	3.064	20	30		EGEDHN
CC(C)CC(C)(C)C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001170555715	1384341076	/nfs/dbraw/zinc/34/10/76/1384341076.db2.gz	IHHWGHSTXYKSRA-UHFFFAOYSA-N	0	3	333.451	3.366	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H](C)CCCCNCc1nccn1CC	ZINC001171010727	1384429364	/nfs/dbraw/zinc/42/93/64/1384429364.db2.gz	UQKGFHSDMVCZNO-MRXNPFEDSA-N	0	3	334.508	3.270	20	30		EGEDHN
N=C(Nc1cccc(N2CCNC2=O)c1)c1ccc2cc(O)ccc2c1	ZINC001171184538	1384462459	/nfs/dbraw/zinc/46/24/59/1384462459.db2.gz	MRXHNEWMISUENK-UHFFFAOYSA-N	0	3	346.390	3.112	20	30		EGEDHN
COc1cccnc1O[C@@H]1CCN([C@@H](C)Cc2cccc(C#N)c2)C1	ZINC001171230399	1384474674	/nfs/dbraw/zinc/47/46/74/1384474674.db2.gz	DINHKHZSNIWQHX-MAUKXSAKSA-N	0	3	337.423	3.046	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)Cc2cccc3cccnc32)C1	ZINC001316619964	1384485595	/nfs/dbraw/zinc/48/55/95/1384485595.db2.gz	WWBCIAIIDVNNPL-KDYLLFBJSA-N	0	3	343.858	3.014	20	30		EGEDHN
COc1ccc(Cl)c2c1C[C@H](NC(=N)c1ccc(F)cn1)CC2	ZINC001171287160	1384486050	/nfs/dbraw/zinc/48/60/50/1384486050.db2.gz	CHOSRRARJNTKKH-LLVKDONJSA-N	0	3	333.794	3.146	20	30		EGEDHN
CC[C@@H](CC(F)(F)F)C(=O)NCCCNCc1ccccc1C#N	ZINC001171354939	1384500369	/nfs/dbraw/zinc/50/03/69/1384500369.db2.gz	SIFMDEWNXWCOAW-ZDUSSCGKSA-N	0	3	341.377	3.133	20	30		EGEDHN
C[C@H](C(=O)NCCCNCc1ccc(C#N)cc1F)c1ccccc1	ZINC001171423859	1384520107	/nfs/dbraw/zinc/52/01/07/1384520107.db2.gz	VWWKPCHUVIZVBD-HNNXBMFYSA-N	0	3	339.414	3.097	20	30		EGEDHN
O=C1C=C2CN([C@@H]3CCc4cc(F)c(F)c(F)c4C3)CCC2S1	ZINC001171534057	1384554784	/nfs/dbraw/zinc/55/47/84/1384554784.db2.gz	DKMSDVYRQYSBLU-BXUZGUMPSA-N	0	3	339.382	3.235	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1ccc2ccccc2c1	ZINC001171913925	1384680147	/nfs/dbraw/zinc/68/01/47/1384680147.db2.gz	YANKTNDXTNSEFA-UHFFFAOYSA-N	0	3	347.256	3.458	20	30		EGEDHN
CC(C)C[C@H]([NH2+][C@H](C)Cc1ccc(C(F)(F)F)cc1)C(=O)N[O-]	ZINC001171970410	1384698007	/nfs/dbraw/zinc/69/80/07/1384698007.db2.gz	NYXZDEXWDMQJRR-RISCZKNCSA-N	0	3	332.366	3.146	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)N1C[C@@H]2CN(C(=O)OC(C)(C)C)[C@H]2C1	ZINC001172312597	1384767434	/nfs/dbraw/zinc/76/74/34/1384767434.db2.gz	HLJOXGPVZOYBOY-OLMNPRSZSA-N	0	3	341.455	3.040	20	30		EGEDHN
C=CCOC[C@@H]1CCC[C@@]12CN([C@H](C)CCOC(C)C)CCO2	ZINC001172452830	1384795712	/nfs/dbraw/zinc/79/57/12/1384795712.db2.gz	VNMPUICUPMGXOO-CEXWTWQISA-N	0	3	325.493	3.264	20	30		EGEDHN
C[C@H](CCCC#N)N1CCO[C@]2(CCCN(c3ccccc3)C2)C1	ZINC001172494657	1384804206	/nfs/dbraw/zinc/80/42/06/1384804206.db2.gz	IKQHBRYYZPNCGV-UYAOXDASSA-N	0	3	327.472	3.440	20	30		EGEDHN
CCCCCCCC[C@H](CC)N1CCN(CC(=O)N(C)C)CC1	ZINC001172505837	1384806898	/nfs/dbraw/zinc/80/68/98/1384806898.db2.gz	VXIXZPSBTSARJE-SFHVURJKSA-N	0	3	325.541	3.221	20	30		EGEDHN
CCOc1cccc(N2CCN(C3CCC(CC#N)CC3)CC2)n1	ZINC001173337635	1384961563	/nfs/dbraw/zinc/96/15/63/1384961563.db2.gz	RHMMJSGOMLCFQS-UHFFFAOYSA-N	0	3	328.460	3.075	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@]1(F)CCN(C2CCC(CC#N)CC2)C1	ZINC001173339131	1384961815	/nfs/dbraw/zinc/96/18/15/1384961815.db2.gz	DNOQTZOPFGIHPV-JMLCCBQJSA-N	0	3	339.455	3.398	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1cnc2ccccc2c1C	ZINC001317401642	1385116274	/nfs/dbraw/zinc/11/62/74/1385116274.db2.gz	SBFNLJIOUYLEDP-ZDUSSCGKSA-N	0	3	331.847	3.394	20	30		EGEDHN
CC[C@H](F)C(=O)N[C@H](C)CCCCNCc1cc(F)ccc1C#N	ZINC001174725399	1385140477	/nfs/dbraw/zinc/14/04/77/1385140477.db2.gz	OPCZFMXSDHBYAB-DYVFJYSZSA-N	0	3	337.414	3.210	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@H](C)CCCCNCc1cc(C)n(C)n1	ZINC001174850155	1385160266	/nfs/dbraw/zinc/16/02/66/1385160266.db2.gz	UYLRVESECZGPDY-NVXWUHKLSA-N	0	3	334.508	3.095	20	30		EGEDHN
CCCN(CCNC(=O)[C@H](C)C#N)Cc1cc(Cl)cc(Cl)c1	ZINC001317538501	1385271574	/nfs/dbraw/zinc/27/15/74/1385271574.db2.gz	KVYQOXSKJPKFQF-GFCCVEGCSA-N	0	3	342.270	3.481	20	30		EGEDHN
CCCN(CCNC(=O)C1(CC)CC1)Cc1ccc(F)c(C#N)c1	ZINC001317546972	1385297559	/nfs/dbraw/zinc/29/75/59/1385297559.db2.gz	LMDWUVMYAXSRNT-UHFFFAOYSA-N	0	3	331.435	3.216	20	30		EGEDHN
C=CCC1(C(=O)NCCCNCc2ccc(F)cn2)CCCCC1	ZINC001176786317	1385697136	/nfs/dbraw/zinc/69/71/36/1385697136.db2.gz	XOPBOXMWXKYFBU-UHFFFAOYSA-N	0	3	333.451	3.343	20	30		EGEDHN
C=C[C@@H](C(=O)NCCCNCc1c(C)noc1CC)c1ccccc1	ZINC001176785834	1385696463	/nfs/dbraw/zinc/69/64/63/1385696463.db2.gz	OZRNIDQYPNQHTF-QGZVFWFLSA-N	0	3	341.455	3.111	20	30		EGEDHN
CCCCCCCC[C@@H](C)C(=O)NCCCNCc1ccn(C)n1	ZINC001176707014	1385666063	/nfs/dbraw/zinc/66/60/63/1385666063.db2.gz	PFFUTARYEDNDBF-QGZVFWFLSA-N	0	3	336.524	3.403	20	30		EGEDHN
C=C[C@@H](C(=O)NCCCNCc1oc(CC)nc1C)c1ccccc1	ZINC001176781899	1385695162	/nfs/dbraw/zinc/69/51/62/1385695162.db2.gz	OIHHCDDRPXXMRB-QGZVFWFLSA-N	0	3	341.455	3.111	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N[C@@H](C)CCCCNC/C(Cl)=C\Cl	ZINC001176802029	1385706024	/nfs/dbraw/zinc/70/60/24/1385706024.db2.gz	WPTTYWSHDLOFKP-NNQLKGDCSA-N	0	3	337.291	3.161	20	30		EGEDHN
CC[C@H](CNC(=O)C(C1CC1)C1CC1)NCc1ccc(C#N)s1	ZINC001698617273	1406251464	/nfs/dbraw/zinc/25/14/64/1406251464.db2.gz	NHFFSUCAGPUQHY-CQSZACIVSA-N	0	3	331.485	3.040	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)C[C@H]1CCCC[C@@H]1C	ZINC001177310468	1385908246	/nfs/dbraw/zinc/90/82/46/1385908246.db2.gz	XDNLUMGEZWBMQY-GXTWGEPZSA-N	0	3	331.298	3.207	20	30		EGEDHN
C=CCCC(=O)N(CCCNCc1nccn1CC)CC1CCCC1	ZINC001177242420	1385882034	/nfs/dbraw/zinc/88/20/34/1385882034.db2.gz	NWHOIDDZSQBSOK-UHFFFAOYSA-N	0	3	346.519	3.368	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@H](C)COC	ZINC001177257870	1385886973	/nfs/dbraw/zinc/88/69/73/1385886973.db2.gz	VIWJDOFIXFSFSW-CQSZACIVSA-N	0	3	330.900	3.020	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@H]1CO[C@H](C)C1	ZINC001177353378	1385926683	/nfs/dbraw/zinc/92/66/83/1385926683.db2.gz	ZQTGRTNZHVRQRL-NVXWUHKLSA-N	0	3	342.911	3.162	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@H]1C[C@H](C)CO1	ZINC001177368805	1385932248	/nfs/dbraw/zinc/93/22/48/1385932248.db2.gz	XZLHNNRXNNXLMI-WMLDXEAASA-N	0	3	342.911	3.162	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)c1nc(C)c[nH]1	ZINC001177440671	1385958613	/nfs/dbraw/zinc/95/86/13/1385958613.db2.gz	PGXKTYROMRJJGJ-UHFFFAOYSA-N	0	3	338.883	3.083	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@@H]1CCO[C@H]1C	ZINC001177448653	1385959682	/nfs/dbraw/zinc/95/96/82/1385959682.db2.gz	QJLREXZNJKCHFG-DOTOQJQBSA-N	0	3	342.911	3.162	20	30		EGEDHN
CC(C)(CNCc1cccc(-c2ccc(C#N)s2)c1)S(C)(=O)=O	ZINC001319278984	1386039437	/nfs/dbraw/zinc/03/94/37/1386039437.db2.gz	LJHAVVXLFSEQNI-UHFFFAOYSA-N	0	3	348.493	3.200	20	30		EGEDHN
C[C@@H]1C[C@@H]1C(=O)NCCCCCCNCc1cc(F)ccc1C#N	ZINC001177819799	1386056323	/nfs/dbraw/zinc/05/63/23/1386056323.db2.gz	QYBYSZKJFMCZAH-KDOFPFPSSA-N	0	3	331.435	3.120	20	30		EGEDHN
CCOC(=O)c1c(NC(=O)C(C#N)Cc2cccs2)ccn1CC	ZINC001177905174	1386079475	/nfs/dbraw/zinc/07/94/75/1386079475.db2.gz	WQMGFUVKXDTMIP-LBPRGKRZSA-N	0	3	345.424	3.067	20	30		EGEDHN
CCCCOCC(=O)NCCCCCCNCc1ccccc1C#N	ZINC001178076027	1386123158	/nfs/dbraw/zinc/12/31/58/1386123158.db2.gz	LTNUTIMPMXGGKN-UHFFFAOYSA-N	0	3	345.487	3.141	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](NCc2cc(Cl)ccc2OC)[C@@H]1C	ZINC001178311632	1386185903	/nfs/dbraw/zinc/18/59/03/1386185903.db2.gz	GWIOEXDDEYGZDE-BBRMVZONSA-N	0	3	336.863	3.394	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2Cl)CCN1C(=O)C=C1CCC1	ZINC001178451980	1386221948	/nfs/dbraw/zinc/22/19/48/1386221948.db2.gz	LWLQBLDXTXIKGW-KXBFYZLASA-N	0	3	342.870	3.381	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](NCc2cccc(C(C)C)n2)[C@@H]1C	ZINC001178599500	1386259491	/nfs/dbraw/zinc/25/94/91/1386259491.db2.gz	GJFJTEAJHVDWGB-LPHOPBHVSA-N	0	3	327.472	3.088	20	30		EGEDHN
C#CCCCCCC(=O)NCCCCCCNCc1cnc(C)o1	ZINC001179239695	1386429698	/nfs/dbraw/zinc/42/96/98/1386429698.db2.gz	JYTXGVMEALFILO-UHFFFAOYSA-N	0	3	333.476	3.333	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)C1CC2(CCC2)C1	ZINC001179342163	1386457463	/nfs/dbraw/zinc/45/74/63/1386457463.db2.gz	WEJSWBRUEQTUFQ-PXNSSMCTSA-N	0	3	336.479	3.197	20	30		EGEDHN
C=CCCC1(C(=O)NCCCCCCN[C@H](C)c2nnc(C)[nH]2)CC1	ZINC001179482504	1386495046	/nfs/dbraw/zinc/49/50/46/1386495046.db2.gz	VOLWKUPQFQHPFS-OAHLLOKOSA-N	0	3	347.507	3.187	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCCCCCN[C@@H](C)c1nnc(C)[nH]1	ZINC001179692089	1386554843	/nfs/dbraw/zinc/55/48/43/1386554843.db2.gz	AZGSFZKAQMSGPC-AWEZNQCLSA-N	0	3	335.496	3.043	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1ccc(F)cc1F)C1CC1	ZINC001698654992	1406304979	/nfs/dbraw/zinc/30/49/79/1406304979.db2.gz	YKMOICIMLALVPF-MRXNPFEDSA-N	0	3	328.790	3.205	20	30		EGEDHN
N#Cc1ccccc1CNCCCCCCNC(=O)[C@@H]1C[C@H]1C1CC1	ZINC001179783914	1386583781	/nfs/dbraw/zinc/58/37/81/1386583781.db2.gz	MXZPWKYELJGPSD-VQTJNVASSA-N	0	3	339.483	3.371	20	30		EGEDHN
CCOC(=O)[C@H]1CCC[C@H]1N(Cc1ccc(F)cc1)C(=O)C(C)C#N	ZINC001179897524	1386622028	/nfs/dbraw/zinc/62/20/28/1386622028.db2.gz	YXLLBQIEUGLUHL-XOKHGSTOSA-N	0	3	346.402	3.046	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)Cc1cccc2ccc(OC)cc21	ZINC001181240852	1386966154	/nfs/dbraw/zinc/96/61/54/1386966154.db2.gz	YAKSCUCCNZTWDX-SFHVURJKSA-N	0	3	338.451	3.158	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](C)[C@](C)(CNC/C(Cl)=C\Cl)C1	ZINC001181314853	1386975769	/nfs/dbraw/zinc/97/57/69/1386975769.db2.gz	HTQIGGRQAGISPK-DPXMASKKSA-N	0	3	331.287	3.183	20	30		EGEDHN
C[C@H](CNCc1ccc(F)c(C#N)c1)NC(=O)CC(C1CC1)C1CC1	ZINC001321757238	1386976998	/nfs/dbraw/zinc/97/69/98/1386976998.db2.gz	ZKPZTKAGEMPFKL-CYBMUJFWSA-N	0	3	343.446	3.118	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2(C)CC2)C[C@@]1(C)CNCc1cc(F)ccc1C#N	ZINC001181548632	1387014584	/nfs/dbraw/zinc/01/45/84/1387014584.db2.gz	KGPNYPDQVOQZQD-JLTOFOAXSA-N	0	3	343.446	3.072	20	30		EGEDHN
CCCc1ccc(CN(C)C[C@H](C)NC(=O)c2cc(C#N)c[nH]2)cc1	ZINC001322137030	1387070770	/nfs/dbraw/zinc/07/07/70/1387070770.db2.gz	VUWBXGSLHHHWNO-HNNXBMFYSA-N	0	3	338.455	3.089	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](NCc2ccccc2OC(C)C)C1	ZINC001182108787	1387106245	/nfs/dbraw/zinc/10/62/45/1387106245.db2.gz	WHJYRXWVYOYYKS-LJQANCHMSA-N	0	3	342.483	3.358	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2csc(CC)n2)C1	ZINC001182208633	1387120904	/nfs/dbraw/zinc/12/09/04/1387120904.db2.gz	YCAQWHSGDAKVKA-AUUYWEPGSA-N	0	3	349.544	3.492	20	30		EGEDHN
CCCC[C@H](C)C(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001182277498	1387136206	/nfs/dbraw/zinc/13/62/06/1387136206.db2.gz	GYCQAMQUBLOJMO-WMLDXEAASA-N	0	3	331.435	3.214	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)Cc1cc(C)cc(C(F)(F)F)c1	ZINC001182676493	1387205709	/nfs/dbraw/zinc/20/57/09/1387205709.db2.gz	PXJYFQRRTYBERI-INIZCTEOSA-N	0	3	340.389	3.323	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](NCc2ccccc2N(C)C)C1	ZINC001182818750	1387229641	/nfs/dbraw/zinc/22/96/41/1387229641.db2.gz	OWMIVMMGKDKPMQ-LJQANCHMSA-N	0	3	341.499	3.212	20	30		EGEDHN
Cc1ccccc1CCC(=O)NC[C@H](C)CNCc1ccccc1C#N	ZINC001698760324	1406414686	/nfs/dbraw/zinc/41/46/86/1406414686.db2.gz	AIHWBZUPAPXQFH-QGZVFWFLSA-N	0	3	349.478	3.341	20	30		EGEDHN
CCC1(C(=O)N[C@H](CNCc2ccc(C#N)s2)C(C)(C)C)CC1	ZINC001332856036	1390201642	/nfs/dbraw/zinc/20/16/42/1390201642.db2.gz	GERQLTXKVSKDFA-OAHLLOKOSA-N	0	3	333.501	3.430	20	30		EGEDHN
CN(C(=O)CCCC1CC1)C1CC(NCc2cc(C#N)ccc2F)C1	ZINC001333107839	1390250352	/nfs/dbraw/zinc/25/03/52/1390250352.db2.gz	NNRCRAGPJKTMKK-UHFFFAOYSA-N	0	3	343.446	3.357	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccc(C(=O)N2CCCCCC2)cc1	ZINC001341483379	1390492557	/nfs/dbraw/zinc/49/25/57/1390492557.db2.gz	WFZIFCMTYHEZDQ-GOSISDBHSA-N	0	3	343.471	3.325	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N(CCc1ccccc1)Cc1cccnc1	ZINC001341805036	1390531165	/nfs/dbraw/zinc/53/11/65/1390531165.db2.gz	HMDIQVPKMYVOTI-HXUWFJFHSA-N	0	3	337.467	3.337	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)Nc1cn(C)nc1C(F)(F)F	ZINC001341878917	1390543951	/nfs/dbraw/zinc/54/39/51/1390543951.db2.gz	WUSMODMZFDBGDV-LLVKDONJSA-N	0	3	334.386	3.455	20	30		EGEDHN
CC(C)(C)c1ccc(CSCC(=O)C(C#N)C(=O)NC2CC2)cc1	ZINC001342722235	1390645256	/nfs/dbraw/zinc/64/52/56/1390645256.db2.gz	LOYGHQRCAJJGJI-MRXNPFEDSA-N	0	3	344.480	3.205	20	30		EGEDHN
Cn1ccnc1C(C#N)C(=O)CCc1ccccc1OC(F)(F)F	ZINC001342924112	1390673098	/nfs/dbraw/zinc/67/30/98/1390673098.db2.gz	JVEIELPOEQXQPY-GFCCVEGCSA-N	0	3	337.301	3.128	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)[C@@H](C)OC2CCCCC2)cc1	ZINC001343337127	1390708013	/nfs/dbraw/zinc/70/80/13/1390708013.db2.gz	WZELENZNVLMSSJ-DYVFJYSZSA-N	0	3	344.411	3.080	20	30		EGEDHN
C=C(C)Cn1c([C@H](C)SC)nnc1N1CCN([C@H](C)CC)CC1	ZINC001343669620	1390729911	/nfs/dbraw/zinc/72/99/11/1390729911.db2.gz	OXQZLQOJRDRCAR-CABCVRRESA-N	0	3	337.537	3.199	20	30		EGEDHN
Cn1ccnc1C(C#N)C(=O)c1c(Cl)cccc1OCC1CC1	ZINC001343705301	1390732155	/nfs/dbraw/zinc/73/21/55/1390732155.db2.gz	QJBPMLXDDYIXHE-LBPRGKRZSA-N	0	3	329.787	3.352	20	30		EGEDHN
CC(=O)N[C@](C)(C(=O)C(C#N)c1ncc(C(C)(C)C)s1)C(C)C	ZINC001344603681	1390802480	/nfs/dbraw/zinc/80/24/80/1390802480.db2.gz	KDFRSTVQZZFYNJ-PXAZEXFGSA-N	0	3	335.473	3.168	20	30		EGEDHN
N#CC(C(=O)[C@H]1C[C@H]2CC(=O)[C@@H]1C2)c1nc2c(cccc2Cl)[nH]1	ZINC001345673790	1390874835	/nfs/dbraw/zinc/87/48/35/1390874835.db2.gz	WNEOZWAYBUWFKN-ZRUFSTJUSA-N	0	3	327.771	3.008	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)Cc1cccc(OC(F)(F)F)c1	ZINC001346095998	1390907257	/nfs/dbraw/zinc/90/72/57/1390907257.db2.gz	MEGOWXCVMBKOAM-CYBMUJFWSA-N	0	3	337.301	3.221	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc3c(nc(C)cc3C)s2)CC1	ZINC001351165815	1391606247	/nfs/dbraw/zinc/60/62/47/1391606247.db2.gz	QLBSSXICJRVIQF-UHFFFAOYSA-N	0	3	329.469	3.293	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc(NC[C@H]2CCCO2)c(F)c1	ZINC001353559879	1392039550	/nfs/dbraw/zinc/03/95/50/1392039550.db2.gz	PAIBOSUOFPBFGU-ZBFHGGJFSA-N	0	3	335.423	3.039	20	30		EGEDHN
CN1CCCC[C@@H]1CNC(=O)c1ccccc1-c1ccccc1C#N	ZINC001353894917	1392106355	/nfs/dbraw/zinc/10/63/55/1392106355.db2.gz	RLZLMFCWTSRANZ-QGZVFWFLSA-N	0	3	333.435	3.439	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)Nc1nnc([C@@H]2CCCO2)s1	ZINC001354536589	1392151109	/nfs/dbraw/zinc/15/11/09/1392151109.db2.gz	OMTSNRSAYJTLAE-STQMWFEESA-N	0	3	340.493	3.406	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@@H](C)Cc2ccc(F)cc2)C1	ZINC001479418762	1392240035	/nfs/dbraw/zinc/24/00/35/1392240035.db2.gz	WBPLSUSFHVWBTK-NUTKFTJISA-N	0	3	338.854	3.241	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)N(C)C(=O)C1CC2(CCC2)C1	ZINC001698851752	1406555428	/nfs/dbraw/zinc/55/54/28/1406555428.db2.gz	JOAFMKSILAELFG-CYBMUJFWSA-N	0	3	331.485	3.137	20	30		EGEDHN
CCC1(C(=O)N[C@H]2C[C@H](NCc3ccc(C#N)cc3F)C2)CCCC1	ZINC001480164212	1392606018	/nfs/dbraw/zinc/60/60/18/1392606018.db2.gz	DJRLNBPOFZGXIN-QAQDUYKDSA-N	0	3	343.446	3.405	20	30		EGEDHN
CC(C)C[C@@H](CNCc1ccc(C#N)s1)NC(=O)CC1(C)CC1	ZINC001698875720	1406599779	/nfs/dbraw/zinc/59/97/79/1406599779.db2.gz	OBSYHBDWSYFTKX-AWEZNQCLSA-N	0	3	333.501	3.430	20	30		EGEDHN
C=C(Br)CNCC1(NC(=O)C2CC3(CC3)C2)CCCC1	ZINC001481903354	1394588313	/nfs/dbraw/zinc/58/83/13/1394588313.db2.gz	DISDWXCAFYOTBU-UHFFFAOYSA-N	0	3	341.293	3.104	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H](F)Cc2ccccc2)CCCC1	ZINC001482238469	1394834843	/nfs/dbraw/zinc/83/48/43/1394834843.db2.gz	QZJMYIWCZKDLDQ-MRXNPFEDSA-N	0	3	338.854	3.338	20	30		EGEDHN
CN(CCC1CCN(C(=O)CC2CC2)CC1)Cc1ccc(C#N)s1	ZINC001698975210	1406742602	/nfs/dbraw/zinc/74/26/02/1406742602.db2.gz	WAWYGTYOIBSBSD-UHFFFAOYSA-N	0	3	345.512	3.480	20	30		EGEDHN
C[C@@]1(CNC(=O)CC2CC2)CCCN(Cc2cccc(C#N)c2)C1	ZINC001484148057	1395284915	/nfs/dbraw/zinc/28/49/15/1395284915.db2.gz	GOAFBOMSIVNVRB-FQEVSTJZSA-N	0	3	325.456	3.077	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2csc(C3CC3)n2)CCCC1	ZINC001495965744	1396580550	/nfs/dbraw/zinc/58/05/50/1396580550.db2.gz	SYNXRTPDOPYFPM-UHFFFAOYSA-N	0	3	339.892	3.405	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CCCN(CCc2ccc(Cl)cc2)C1	ZINC001690037987	1404274115	/nfs/dbraw/zinc/27/41/15/1404274115.db2.gz	YRUJYWYMSLISMY-GOSISDBHSA-N	0	3	332.875	3.267	20	30		EGEDHN
Cc1ccccc1C(=O)NCC[C@@H](C)NCc1cc(C#N)ccc1F	ZINC001690829620	1404766099	/nfs/dbraw/zinc/76/60/99/1404766099.db2.gz	BYVFVGZVTBESKX-OAHLLOKOSA-N	0	3	339.414	3.304	20	30		EGEDHN
Cc1cccc(C)c1C(=O)N(C)C[C@H](C)NCc1ccc(C#N)s1	ZINC001725503224	1426185138	/nfs/dbraw/zinc/18/51/38/1426185138.db2.gz	FLTDJVGSGAGZKD-HNNXBMFYSA-N	0	3	341.480	3.487	20	30		EGEDHN
Cc1cccc(C)c1C(=O)N(C)C[C@@H](C)NCc1ccc(C#N)s1	ZINC001725503227	1426185253	/nfs/dbraw/zinc/18/52/53/1426185253.db2.gz	FLTDJVGSGAGZKD-OAHLLOKOSA-N	0	3	341.480	3.487	20	30		EGEDHN
CC1(C(=O)NCC[C@@H]2CCN(Cc3ccccc3C#N)C2)CCC1	ZINC001691900985	1405624099	/nfs/dbraw/zinc/62/40/99/1405624099.db2.gz	JZENKDMPNAADDA-MRXNPFEDSA-N	0	3	325.456	3.077	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)CCc1cccs1)C1CC1	ZINC001732254751	1428495788	/nfs/dbraw/zinc/49/57/88/1428495788.db2.gz	WEUAOYSGLQBGNY-MRXNPFEDSA-N	0	3	326.893	3.308	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2csnc2C)CCCC[C@H]1C	ZINC001732262355	1428502767	/nfs/dbraw/zinc/50/27/67/1428502767.db2.gz	VHXAVVDCGQPSKV-BZNIZROVSA-N	0	3	341.908	3.472	20	30		EGEDHN
C[C@@H](CNCc1ccccc1C#N)CNC(=O)C1CCC(F)(F)CC1	ZINC001732363776	1428549267	/nfs/dbraw/zinc/54/92/67/1428549267.db2.gz	JHMDJQULMJFSSK-AWEZNQCLSA-N	0	3	349.425	3.226	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cccc3c2CCOC3)CCCC1	ZINC001732393230	1428561787	/nfs/dbraw/zinc/56/17/87/1428561787.db2.gz	HNHUAVFGJIHJEO-UHFFFAOYSA-N	0	3	348.874	3.144	20	30		EGEDHN
CC(C)CC(C)(C)C(=O)NCC1(NCc2cccc(C#N)c2)CC1	ZINC001699668742	1413056914	/nfs/dbraw/zinc/05/69/14/1413056914.db2.gz	KFUHMDAJWAIKGI-UHFFFAOYSA-N	0	3	327.472	3.369	20	30		EGEDHN
C[C@@H](CC(=O)NCC1(NCc2ccc(C#N)cc2)CC1)c1ccco1	ZINC001699669337	1413058247	/nfs/dbraw/zinc/05/82/47/1413058247.db2.gz	BTUHZIWFVUFOSY-HNNXBMFYSA-N	0	3	337.423	3.083	20	30		EGEDHN
C=C(Br)CN[C@@H](CNC(=O)c1ccc(F)cc1)C(C)C	ZINC001732552657	1428737947	/nfs/dbraw/zinc/73/79/47/1428737947.db2.gz	ZTPQSAHEJPFPAE-AWEZNQCLSA-N	0	3	343.240	3.078	20	30		EGEDHN
C=C(Br)CN[C@H](CNC(=O)C1(CCC)CC1)C(C)C	ZINC001732567050	1428760352	/nfs/dbraw/zinc/76/03/52/1428760352.db2.gz	OXZULOBQHMJZMC-CYBMUJFWSA-N	0	3	331.298	3.206	20	30		EGEDHN
C=C(Br)CNCC(C)(C)CN(C)C(=O)C[C@@H](C)C1CC1	ZINC001700448666	1414028557	/nfs/dbraw/zinc/02/85/57/1414028557.db2.gz	TYRVXDXVZMEYHE-GFCCVEGCSA-N	0	3	345.325	3.405	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)Cc2cc(F)c(C)cc2F)C1	ZINC001707085212	1417192463	/nfs/dbraw/zinc/19/24/63/1417192463.db2.gz	MUXOAJWUVIVAMN-MQMHXKEQSA-N	0	3	342.817	3.053	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(CCCOc3ccc(F)cc3)C2)C1	ZINC001713086331	1417632703	/nfs/dbraw/zinc/63/27/03/1417632703.db2.gz	JWOBRCWEUATKRJ-QGZVFWFLSA-N	0	3	346.446	3.141	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCN(C(=O)CCCC2CC2)C1	ZINC001713239999	1417826150	/nfs/dbraw/zinc/82/61/50/1417826150.db2.gz	ZNJUFJMMVREZBW-GOSISDBHSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1ccc(OC)c(C2CC2)c1	ZINC001713419725	1418043975	/nfs/dbraw/zinc/04/39/75/1418043975.db2.gz	GIHRSUIGMXCACO-CYBMUJFWSA-N	0	3	336.863	3.423	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCN(C1CC1)[C@H]1CCc2c1cccc2Cl	ZINC001713555067	1418345488	/nfs/dbraw/zinc/34/54/88/1418345488.db2.gz	LSDXSTOESBPURM-SJCJKPOMSA-N	0	3	331.847	3.068	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](NC(=O)CC2CCCC2)C2CC2)s1	ZINC001733163827	1429266066	/nfs/dbraw/zinc/26/60/66/1429266066.db2.gz	QBDJCIOBHCTFEZ-QGZVFWFLSA-N	0	3	331.485	3.184	20	30		EGEDHN
CCC1(C(=O)N[C@H](CNCc2ccc(C#N)cc2F)C2CC2)CCC1	ZINC001733181118	1429282725	/nfs/dbraw/zinc/28/27/25/1429282725.db2.gz	WRWLGSKSPAJZED-GOSISDBHSA-N	0	3	343.446	3.262	20	30		EGEDHN
CC(C)c1ncc(C(=O)NC[C@@H](C)NCc2ccc(C#N)s2)s1	ZINC001714312279	1419092818	/nfs/dbraw/zinc/09/28/18/1419092818.db2.gz	SOBMGSWQWCXYPB-LLVKDONJSA-N	0	3	348.497	3.108	20	30		EGEDHN
CCCN(CCNC(=O)[C@@H](C)C(C)C)Cc1ccc(F)c(C#N)c1	ZINC001714659809	1419444112	/nfs/dbraw/zinc/44/41/12/1419444112.db2.gz	VVERBMGJEUBSOS-HNNXBMFYSA-N	0	3	333.451	3.318	20	30		EGEDHN
CC(C)SCC(=O)N1CC[C@@H](NCc2ccccc2C#N)[C@@H](C)C1	ZINC001714998224	1419729958	/nfs/dbraw/zinc/72/99/58/1419729958.db2.gz	GBFHCEMVGFQQHY-MAUKXSAKSA-N	0	3	345.512	3.026	20	30		EGEDHN
C[C@H]1CCCC[C@@]1(CNCc1ccc(C#N)cc1F)NC(=O)C1CC1	ZINC001715133737	1419882963	/nfs/dbraw/zinc/88/29/63/1419882963.db2.gz	WZKUWZOXUIYJPG-XOBRGWDASA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1sc(Cl)nc1C)C(C)C	ZINC001715491262	1420172712	/nfs/dbraw/zinc/17/27/12/1420172712.db2.gz	DNCCBYHZUSBCKZ-JTQLQIEISA-N	0	3	336.288	3.201	20	30		EGEDHN
CCc1ccccc1C(=O)N[C@H](C)CNCc1ccc(F)c(C#N)c1	ZINC001715946427	1420414614	/nfs/dbraw/zinc/41/46/14/1420414614.db2.gz	WQVDWABRVJPGPI-CQSZACIVSA-N	0	3	339.414	3.168	20	30		EGEDHN
CC(C)CCC(=O)N[C@@H]1CCC[C@H]1CNCc1ccccc1C#N	ZINC001716054858	1420518629	/nfs/dbraw/zinc/51/86/29/1420518629.db2.gz	NHHGQFGKJQDMHW-RBUKOAKNSA-N	0	3	327.472	3.369	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N[C@@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001716613189	1420778218	/nfs/dbraw/zinc/77/82/18/1420778218.db2.gz	UFYSFFRUUQIOID-INIZCTEOSA-N	0	3	333.501	3.286	20	30		EGEDHN
CC(C)CC(=O)N[C@@H]1CCN(Cc2ccc(OCC#N)cc2)[C@@H](C)C1	ZINC001717325920	1421260962	/nfs/dbraw/zinc/26/09/62/1421260962.db2.gz	ITXGKHIMWQUCKH-FUHWJXTLSA-N	0	3	343.471	3.104	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)c2cscn2)CC1	ZINC001717355113	1421290230	/nfs/dbraw/zinc/29/02/30/1421290230.db2.gz	XPYJPEBKVPQJIA-UHFFFAOYSA-N	0	3	327.881	3.070	20	30		EGEDHN
CCCC1(C(=O)NC[C@H](C)N(C)Cc2ccc(C#N)cc2)CCC1	ZINC001717482563	1421418809	/nfs/dbraw/zinc/41/88/09/1421418809.db2.gz	CQUFNHSRGXYKHS-INIZCTEOSA-N	0	3	327.472	3.465	20	30		EGEDHN
Cc1ccc(C(=O)N(C)C[C@H](C)NCc2ccc(C#N)s2)cc1	ZINC001717751293	1421613964	/nfs/dbraw/zinc/61/39/64/1421613964.db2.gz	RSJJQOQWSGXJCI-AWEZNQCLSA-N	0	3	327.453	3.179	20	30		EGEDHN
N#Cc1cccc(CNC2(CNC(=O)c3ccsc3Cl)CC2)c1	ZINC001723572132	1424470371	/nfs/dbraw/zinc/47/03/71/1424470371.db2.gz	UFMXLGFEOFUEHM-UHFFFAOYSA-N	0	3	345.855	3.325	20	30		EGEDHN
C[C@]1(CNC(=O)C2CCCC2)CCCN(Cc2ccc(C#N)cc2)C1	ZINC001724311593	1424795656	/nfs/dbraw/zinc/79/56/56/1424795656.db2.gz	QGZAVGZWOJDANL-OAQYLSRUSA-N	0	3	339.483	3.467	20	30		EGEDHN
CC1(C(=O)NC[C@H]2C[C@H]3CC[C@@H](C2)N3Cc2ccc(C#N)s2)CC1	ZINC001733563493	1429762782	/nfs/dbraw/zinc/76/27/82/1429762782.db2.gz	PYRSEMJNWXOGEX-QDMKHBRRSA-N	0	3	343.496	3.279	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1c(F)c(F)cc(F)c1F	ZINC001725002098	1425411889	/nfs/dbraw/zinc/41/18/89/1425411889.db2.gz	AQOPMMUKNZJSCK-QMMMGPOBSA-N	0	3	338.732	3.094	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1nc(C)n2ccccc12	ZINC001725143840	1425623761	/nfs/dbraw/zinc/62/37/61/1425623761.db2.gz	FSPCLJLGBDJJNK-UHFFFAOYSA-N	0	3	348.878	3.083	20	30		EGEDHN
Cc1sccc1C(=O)N(C)C[C@@H](C)NCc1ccc(C#N)s1	ZINC001725483924	1426160298	/nfs/dbraw/zinc/16/02/98/1426160298.db2.gz	UMCRXTMBEIYWLY-LLVKDONJSA-N	0	3	333.482	3.240	20	30		EGEDHN
CC(C)CC(=O)N[C@H](CNCc1ccc(C#N)cc1F)C(C)(C)C	ZINC001725739944	1426415666	/nfs/dbraw/zinc/41/56/66/1426415666.db2.gz	ZGWWQJGMDSWSHZ-QGZVFWFLSA-N	0	3	333.451	3.364	20	30		EGEDHN
Cc1ccsc1C(=O)NC[C@H](NCc1ccc(C#N)s1)C1CC1	ZINC001731388633	1427338377	/nfs/dbraw/zinc/33/83/77/1427338377.db2.gz	IMRBLYBXJXLWHU-HNNXBMFYSA-N	0	3	345.493	3.288	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1cccc(F)c1OCC	ZINC001731737002	1427819116	/nfs/dbraw/zinc/81/91/16/1427819116.db2.gz	SDENOUXKZHKBER-LBPRGKRZSA-N	0	3	328.815	3.075	20	30		EGEDHN
CCN(CCNC(=O)[C@@H](C)c1ccsc1)Cc1cccc(C#N)c1	ZINC001731812091	1427995840	/nfs/dbraw/zinc/99/58/40/1427995840.db2.gz	VUAPINQZYKPFHI-HNNXBMFYSA-N	0	3	341.480	3.362	20	30		EGEDHN
CCN(CCNC(=O)c1ccc(C)cc1C)Cc1ccc(C#N)cc1	ZINC001731814851	1428006905	/nfs/dbraw/zinc/00/69/05/1428006905.db2.gz	DBXRXUZXJYFILP-UHFFFAOYSA-N	0	3	335.451	3.427	20	30		EGEDHN
CCN(CCNC(=O)c1ccc(CF)cc1)Cc1cccc(C#N)c1	ZINC001731817157	1428013914	/nfs/dbraw/zinc/01/39/14/1428013914.db2.gz	ZPPDQWIRZSTXAI-UHFFFAOYSA-N	0	3	339.414	3.280	20	30		EGEDHN
C[C@H]1CN(C(=O)CCCC2CC2)C[C@@H]1NCc1ccc(C#N)s1	ZINC001733850590	1430117581	/nfs/dbraw/zinc/11/75/81/1430117581.db2.gz	UHFIEORNDOSNOY-GUYCJALGSA-N	0	3	331.485	3.137	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)CC2(C)CC2)CCN1Cc1cccc(C#N)c1	ZINC001733902549	1437720272	/nfs/dbraw/zinc/72/02/72/1437720272.db2.gz	VKCIHKYEGHWYOE-QAPCUYQASA-N	0	3	325.456	3.218	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1cccc(-n2cccc2)c1	ZINC001733905292	1437723377	/nfs/dbraw/zinc/72/33/77/1437723377.db2.gz	NILNPZMLMSQJGR-HNNXBMFYSA-N	0	3	331.847	3.328	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCCN(C)Cc1ccc(OC)c(F)c1	ZINC001752039904	1440134565	/nfs/dbraw/zinc/13/45/65/1440134565.db2.gz	RRDRVYMHOBHNBY-UHFFFAOYSA-N	0	3	336.451	3.375	20	30		EGEDHN
CC#CCCCC(=O)N1CCCC[C@H]1[C@@H](C)NCc1ccns1	ZINC001752143468	1440145225	/nfs/dbraw/zinc/14/52/25/1440145225.db2.gz	MSCLFLGAUOYXMK-WBVHZDCISA-N	0	3	333.501	3.196	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1CC12CCN(CCC(F)(F)F)CC2	ZINC001752426812	1440177201	/nfs/dbraw/zinc/17/72/01/1440177201.db2.gz	ZVBDXGWRSWKQEZ-HNNXBMFYSA-N	0	3	344.421	3.493	20	30		EGEDHN
N#Cc1ccc(CN[C@@H](CNC(=O)c2sccc2F)C2CC2)s1	ZINC001752458970	1440183469	/nfs/dbraw/zinc/18/34/69/1440183469.db2.gz	OYUQAJXNQQNCQY-AWEZNQCLSA-N	0	3	349.456	3.119	20	30		EGEDHN
C=CCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccnn1C(CC)CC	ZINC001752535615	1440194184	/nfs/dbraw/zinc/19/41/84/1440194184.db2.gz	IDVDZHOWYWZHPY-HDICACEKSA-N	0	3	344.503	3.499	20	30		EGEDHN
C=CCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1[C@@H]2c3ccccc3C[C@H]12	ZINC001752564713	1440195472	/nfs/dbraw/zinc/19/54/72/1440195472.db2.gz	JMIXRKNYUWSNNN-GBMAXXPESA-N	0	3	336.479	3.214	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)Cc1ccco1	ZINC001752567500	1440195535	/nfs/dbraw/zinc/19/55/35/1440195535.db2.gz	RZSDBGXQFUPVFT-XWTMOSNGSA-N	0	3	330.472	3.488	20	30		EGEDHN
C=CCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C1(CCOC)CCCC1	ZINC001752568790	1440195542	/nfs/dbraw/zinc/19/55/42/1440195542.db2.gz	UAMKCMVEOIRRQW-HDICACEKSA-N	0	3	334.504	3.225	20	30		EGEDHN
O=C(C#CC1CC1)NC1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1Cl	ZINC001752693660	1440200766	/nfs/dbraw/zinc/20/07/66/1440200766.db2.gz	FONMDHILIYJSCW-AYHJJNSGSA-N	0	3	342.870	3.365	20	30		EGEDHN
C=CCOCCCC(=O)N1CCC[C@@H]2CN(C/C=C\Cl)CC[C@H]21	ZINC001752704289	1440202135	/nfs/dbraw/zinc/20/21/35/1440202135.db2.gz	CXADECYBTDTAPH-VANPALJFSA-N	0	3	340.895	3.035	20	30		EGEDHN
Cc1cc(C)cc(CC(=O)N[C@H]2C[C@@H](NCC#Cc3ccccc3)C2)c1	ZINC001752758100	1440205248	/nfs/dbraw/zinc/20/52/48/1440205248.db2.gz	NKILPYFWFBDETA-SZPZYZBQSA-N	0	3	346.474	3.134	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC[C@H](CNCc2cnc(C)o2)C1	ZINC001752800321	1440214859	/nfs/dbraw/zinc/21/48/59/1440214859.db2.gz	XLBMOAFKOCLMSX-MRXNPFEDSA-N	0	3	331.460	3.080	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)NC[C@@H]1CCCCN1Cc1cccc(CC)c1	ZINC001752819423	1440219809	/nfs/dbraw/zinc/21/98/09/1440219809.db2.gz	VLNOEZBXAXNPAW-FPOVZHCZSA-N	0	3	344.499	3.047	20	30		EGEDHN
C=CCOCCN1CCCC[C@@H]1CNC(=O)c1c(C)cc(C)cc1C	ZINC001752824976	1440223188	/nfs/dbraw/zinc/22/31/88/1440223188.db2.gz	IVQBQTCKXIPEGK-LJQANCHMSA-N	0	3	344.499	3.399	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@H](C)c1cccc(OC)c1	ZINC001752825125	1440223198	/nfs/dbraw/zinc/22/31/98/1440223198.db2.gz	LWMNALBVCGUFEB-SJLPKXTDSA-N	0	3	330.472	3.346	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)CC(C)(C)CC(F)F)C1	ZINC001752838275	1440228840	/nfs/dbraw/zinc/22/88/40/1440228840.db2.gz	ZYDJVLSJBLILEF-HUUCEWRRSA-N	0	3	328.447	3.298	20	30		EGEDHN
C[C@@H](CNC(=O)CC1(C)CCCC1)NCc1ccc(C#N)c(F)c1	ZINC001752871363	1440237195	/nfs/dbraw/zinc/23/71/95/1440237195.db2.gz	YWPMYBBWGKXMSH-AWEZNQCLSA-N	0	3	331.435	3.262	20	30		EGEDHN
Cc1ccc(F)c(C(=O)NC[C@H](C)NCc2ccc(C#N)c(F)c2)c1	ZINC001752903267	1440243637	/nfs/dbraw/zinc/24/36/37/1440243637.db2.gz	HAZYNTHXNARYIB-ZDUSSCGKSA-N	0	3	343.377	3.053	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CCC[C@H](NCc2csc(CCC)n2)C1	ZINC001752969452	1440254682	/nfs/dbraw/zinc/25/46/82/1440254682.db2.gz	ROUAKIPDWGYFKO-HOTGVXAUSA-N	0	3	347.528	3.416	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CCC[C@@H](NCc2csc(CCC)n2)C1	ZINC001752969453	1440254692	/nfs/dbraw/zinc/25/46/92/1440254692.db2.gz	ROUAKIPDWGYFKO-HZPDHXFCSA-N	0	3	347.528	3.416	20	30		EGEDHN
CC#CCN(C)[C@@H]1CCCN(C(=O)Cc2c(C)cccc2Cl)C1	ZINC001752993677	1440260962	/nfs/dbraw/zinc/26/09/62/1440260962.db2.gz	LQAQZRKVJYVKQA-MRXNPFEDSA-N	0	3	332.875	3.137	20	30		EGEDHN
C[C@H](CCNC(=O)[C@@H](C)C1CCC1)NCc1cc(C#N)ccc1F	ZINC001753010134	1440266768	/nfs/dbraw/zinc/26/67/68/1440266768.db2.gz	OUKDBHMLXBIYHZ-KGLIPLIRSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)[C@@H](C)OC1CCCCCC1	ZINC001753013540	1440267690	/nfs/dbraw/zinc/26/76/90/1440267690.db2.gz	OCLYHJSYRWBUDJ-HUUCEWRRSA-N	0	3	330.900	3.351	20	30		EGEDHN
CCCC(=O)NCCC[C@H]1CCCN1Cc1ccc(F)c(C#N)c1	ZINC001753022620	1440270424	/nfs/dbraw/zinc/27/04/24/1440270424.db2.gz	MGWBKFQPPZSKFI-KRWDZBQOSA-N	0	3	331.435	3.358	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1CCCNC(=O)CN(C)c1ccccc1	ZINC001753040460	1440276127	/nfs/dbraw/zinc/27/61/27/1440276127.db2.gz	XWUQSCHDATYRKG-GOSISDBHSA-N	0	3	349.906	3.236	20	30		EGEDHN
CCN(CCNC(=O)[C@@H]1CCC[C@@H](C)C1)Cc1cccc(C#N)c1	ZINC001753087831	1440297332	/nfs/dbraw/zinc/29/73/32/1440297332.db2.gz	RZCCMQOSXALBEO-VQIMIIECSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NCCN(CC)[C@@H](C)c1ccc(F)cc1	ZINC001753091114	1440299047	/nfs/dbraw/zinc/29/90/47/1440299047.db2.gz	JCFRPHBSOYWSIY-SNRMKQJTSA-N	0	3	348.462	3.306	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NC[C@H]1CCN(Cc2cccc(F)c2)C1)OCC	ZINC001753128939	1440315824	/nfs/dbraw/zinc/31/58/24/1440315824.db2.gz	KWPKFTFIUXXLPE-IEBWSBKVSA-N	0	3	348.462	3.135	20	30		EGEDHN
C=C(C)CCC(=O)N(C)CCNCc1cc(=O)oc2cc(C)ccc12	ZINC001753193457	1440337792	/nfs/dbraw/zinc/33/77/92/1440337792.db2.gz	WEAHBJNGAVDKAF-UHFFFAOYSA-N	0	3	342.439	3.006	20	30		EGEDHN
CN(CCNCc1cccc(C#N)c1)C(=O)c1ccc(F)c(Cl)c1	ZINC001753223435	1440340348	/nfs/dbraw/zinc/34/03/48/1440340348.db2.gz	GKBIPCUYDTUVPN-UHFFFAOYSA-N	0	3	345.805	3.213	20	30		EGEDHN
CN(CCNCc1ccc(F)c(C#N)c1)C(=O)CC(C1CC1)C1CC1	ZINC001753265478	1440344793	/nfs/dbraw/zinc/34/47/93/1440344793.db2.gz	YZBXYBFIQSGOTE-UHFFFAOYSA-N	0	3	343.446	3.072	20	30		EGEDHN
C#CCCN[C@@H](CNC(=O)c1coc(C(C)(C)C)n1)c1ccccc1	ZINC001753298923	1440353342	/nfs/dbraw/zinc/35/33/42/1440353342.db2.gz	PDOYCDXGISMGOS-INIZCTEOSA-N	0	3	339.439	3.056	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CCC)C(=O)CCc2nc(C)cs2)C1	ZINC001753319026	1440361810	/nfs/dbraw/zinc/36/18/10/1440361810.db2.gz	WAYKTXBJOGAZAP-INIZCTEOSA-N	0	3	335.517	3.273	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@H](CCNC(=O)CCC2CC2)C1	ZINC001753325634	1440366254	/nfs/dbraw/zinc/36/62/54/1440366254.db2.gz	YOLQPGDBFJHTCK-KRWDZBQOSA-N	0	3	325.456	3.077	20	30		EGEDHN
C=CCC1(C(=O)NCC[C@@H]2CCN(Cc3cnc(C)o3)C2)CCC1	ZINC001753336489	1440372408	/nfs/dbraw/zinc/37/24/08/1440372408.db2.gz	UORPIDCOYUISSQ-MRXNPFEDSA-N	0	3	331.460	3.058	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N1CC[C@@H](CN(C)CC#Cc2ccc(Cl)cc2)C1	ZINC001753352919	1440378720	/nfs/dbraw/zinc/37/87/20/1440378720.db2.gz	SONUDCNFXIGOLO-IEZWGBDMSA-N	0	3	344.886	3.128	20	30		EGEDHN
CC(C)C#CC(=O)NCC1CN(CCc2ccc3ccccc3c2)C1	ZINC001753401893	1440391260	/nfs/dbraw/zinc/39/12/60/1440391260.db2.gz	UWMLMDOUCQGCQD-UHFFFAOYSA-N	0	3	334.463	3.090	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H]2C[C@H]1CN2CCCCC1CCOCC1	ZINC001753424148	1440396098	/nfs/dbraw/zinc/39/60/98/1440396098.db2.gz	MRVDLQYBTHNAKM-OALUTQOASA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)N(C)[C@@H]1CCN(Cc2ccc(C(C)C)cc2)C1	ZINC001753434170	1440399499	/nfs/dbraw/zinc/39/94/99/1440399499.db2.gz	AZMBATBDGXILPI-CTNGQTDRSA-N	0	3	344.499	3.170	20	30		EGEDHN
C=CCCCC(=O)N(C)[C@H]1CCN(CC[C@H]2CC2(Cl)Cl)C1	ZINC001753442116	1440401938	/nfs/dbraw/zinc/40/19/38/1440401938.db2.gz	WAGXNDQBVHTUMN-KBPBESRZSA-N	0	3	333.303	3.459	20	30		EGEDHN
C=CC(C)(C)C(=O)N(C)[C@@H]1CCN(Cc2ccc3c(c2)CCC3)C1	ZINC001753442907	1440402630	/nfs/dbraw/zinc/40/26/30/1440402630.db2.gz	MGOJBFZHECBHJZ-LJQANCHMSA-N	0	3	326.484	3.420	20	30		EGEDHN
CC[C@@H](CNC(=O)CC1CCCC1)NCc1ccc(C#N)c(F)c1	ZINC001753464898	1440412536	/nfs/dbraw/zinc/41/25/36/1440412536.db2.gz	UPFREJUGYRLQPL-KRWDZBQOSA-N	0	3	331.435	3.262	20	30		EGEDHN
CC[C@@H](CNC(=O)c1cc(F)ccc1F)NCC#Cc1ccccc1	ZINC001753475910	1440415220	/nfs/dbraw/zinc/41/52/20/1440415220.db2.gz	BHJUFMAFNVVXOQ-KRWDZBQOSA-N	0	3	342.389	3.115	20	30		EGEDHN
O=C(C[C@H]1C=CCC1)NC1(CNCC#Cc2ccccc2)CCCC1	ZINC001753499526	1440422897	/nfs/dbraw/zinc/42/28/97/1440422897.db2.gz	XOOAZQHUEGVIGI-FQEVSTJZSA-N	0	3	336.479	3.413	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC[C@H](CCNCc2oc(C)nc2C)C1	ZINC001753547459	1440434415	/nfs/dbraw/zinc/43/44/15/1440434415.db2.gz	DPJYBUKRZOIOLS-QGZVFWFLSA-N	0	3	333.476	3.366	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H](CCNCc2cnoc2C)C1	ZINC001753551173	1440435086	/nfs/dbraw/zinc/43/50/86/1440435086.db2.gz	GJYPLQNTUBDIPU-MRXNPFEDSA-N	0	3	333.476	3.304	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC(CCNCc2cc(C)no2)CC1	ZINC001753572728	1440438712	/nfs/dbraw/zinc/43/87/12/1440438712.db2.gz	DDCXVYYHEKHBNA-LJQANCHMSA-N	0	3	333.476	3.304	20	30		EGEDHN
CC#CCNCc1ccc(CNC(=O)[C@H]2C[C@@H]2c2ccccc2)cc1	ZINC001753591782	1440443073	/nfs/dbraw/zinc/44/30/73/1440443073.db2.gz	OAMUFGWVQPMXTA-RTWAWAEBSA-N	0	3	332.447	3.219	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCC1CCN(Cc2ccc(OC)nc2)CC1	ZINC001753597127	1440444953	/nfs/dbraw/zinc/44/49/53/1440444953.db2.gz	KHWFUFQAIQGCEA-UHFFFAOYSA-N	0	3	345.487	3.021	20	30		EGEDHN
C=C1CCC(C(=O)NCCC2CCN(Cc3cnoc3C)CC2)CC1	ZINC001753597477	1440445175	/nfs/dbraw/zinc/44/51/75/1440445175.db2.gz	VHYAYPFLJZUVNR-UHFFFAOYSA-N	0	3	345.487	3.448	20	30		EGEDHN
C#CCCCC(=O)N1CCC2(CCN(Cc3ccccc3C#N)C2)CC1	ZINC001753603644	1440447359	/nfs/dbraw/zinc/44/73/59/1440447359.db2.gz	IHSGANIXKBNEIB-UHFFFAOYSA-N	0	3	349.478	3.176	20	30		EGEDHN
Cc1ccsc1C(=O)NC[C@@H](C)CNCc1cc(F)ccc1C#N	ZINC001753615961	1440449690	/nfs/dbraw/zinc/44/96/90/1440449690.db2.gz	YKPLIWILABROGT-LBPRGKRZSA-N	0	3	345.443	3.223	20	30		EGEDHN
O=C(NCC1(NCC#Cc2ccccc2)CCCC1)C1(CF)CCC1	ZINC001753668615	1440461033	/nfs/dbraw/zinc/46/10/33/1440461033.db2.gz	MVZBEVHZUGQPBO-UHFFFAOYSA-N	0	3	342.458	3.197	20	30		EGEDHN
Cc1cc(C)c(C(=O)N(C)[C@@H](C)CNCc2ccc(C#N)c(F)c2)o1	ZINC001753686267	1440465539	/nfs/dbraw/zinc/46/55/39/1440465539.db2.gz	DZQNTGCVNBGRBJ-ZDUSSCGKSA-N	0	3	343.402	3.158	20	30		EGEDHN
C[C@H](CNCC#Cc1ccc(Cl)cc1)N(C)C(=O)[C@H]1[C@@H]2CCC[C@@H]21	ZINC001753687371	1440465776	/nfs/dbraw/zinc/46/57/76/1440465776.db2.gz	MNLAHXPKNOERNB-OAOYMFHYSA-N	0	3	344.886	3.174	20	30		EGEDHN
CC(C)C[C@H](CNCc1ccc(C#N)s1)NC(=O)C1CCCC1	ZINC001753731293	1440475901	/nfs/dbraw/zinc/47/59/01/1440475901.db2.gz	ONLNEZZFSCJARJ-OAHLLOKOSA-N	0	3	333.501	3.430	20	30		EGEDHN
CC(C)C[C@@H](CNCc1ccc(C#N)c(F)c1)NC(=O)C1CC(C)C1	ZINC001753732649	1440476618	/nfs/dbraw/zinc/47/66/18/1440476618.db2.gz	IMKIOMXVKWELFD-UYJHFMRCSA-N	0	3	345.462	3.364	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](NCc2csc(C)n2)[C@H](C)C1	ZINC001753755721	1440483041	/nfs/dbraw/zinc/48/30/41/1440483041.db2.gz	VUYDOGHLDVAWNC-CJNGLKHVSA-N	0	3	335.517	3.380	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](NCc2csc(C)n2)[C@@H](C)C1	ZINC001753755720	1440483080	/nfs/dbraw/zinc/48/30/80/1440483080.db2.gz	VUYDOGHLDVAWNC-BBRMVZONSA-N	0	3	335.517	3.380	20	30		EGEDHN
C=C1CCC(C(=O)N2CCCC[C@H]2CCNCc2nccn2C)CC1	ZINC001753796039	1440489808	/nfs/dbraw/zinc/48/98/08/1440489808.db2.gz	JIDCPOIBKCCKMZ-SFHVURJKSA-N	0	3	344.503	3.027	20	30		EGEDHN
C=C(Br)CN[C@H](CNC(=O)[C@@H]1C[C@H]1C(C)(C)C)C(C)C	ZINC001753835031	1440500740	/nfs/dbraw/zinc/50/07/40/1440500740.db2.gz	QLGCXIYISIVWNS-MGPQQGTHSA-N	0	3	345.325	3.308	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)[C@H]1CCOc2ccccc21)C(C)C	ZINC001753839876	1440502201	/nfs/dbraw/zinc/50/22/01/1440502201.db2.gz	RHLWFBOHQRDYOM-JKSUJKDBSA-N	0	3	336.863	3.036	20	30		EGEDHN
CC(C)[C@H](CNC(=O)CCc1ccccc1)NCC#Cc1ccccc1	ZINC001753845414	1440504356	/nfs/dbraw/zinc/50/43/56/1440504356.db2.gz	ZMKCHQGYIRYNBP-QFIPXVFZSA-N	0	3	348.490	3.401	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2CCC[C@@H]2CNCc2ccn(CC)n2)CCC1	ZINC001753893693	1440522404	/nfs/dbraw/zinc/52/24/04/1440522404.db2.gz	LBALYNMKRUOBRI-AEFFLSMTSA-N	0	3	344.503	3.024	20	30		EGEDHN
C=C(Cl)CNCC[C@H](C)NC(=O)c1c(F)ccc(F)c1Cl	ZINC001754001609	1440530169	/nfs/dbraw/zinc/53/01/69/1440530169.db2.gz	HMBAJZXXWXTVJQ-VIFPVBQESA-N	0	3	337.197	3.469	20	30		EGEDHN
C=CC1(CC(=O)N[C@H](C)CCNCc2cc(C)ncn2)CCCCC1	ZINC001754014140	1440531514	/nfs/dbraw/zinc/53/15/14/1440531514.db2.gz	ADZLPXGGRSDCEF-MRXNPFEDSA-N	0	3	344.503	3.296	20	30		EGEDHN
CCN(CCNCc1ccc(C#N)c(F)c1)C(=O)[C@H]1CCC(C)(C)C1	ZINC001754065576	1440537365	/nfs/dbraw/zinc/53/73/65/1440537365.db2.gz	KBTSLQBSTZXBRR-INIZCTEOSA-N	0	3	345.462	3.462	20	30		EGEDHN
CCc1ccccc1CC(=O)NC/C=C/CNCc1ccc(C#N)cc1	ZINC001754138879	1440544073	/nfs/dbraw/zinc/54/40/73/1440544073.db2.gz	WQXAIDUNBVNZCF-AATRIKPKSA-N	0	3	347.462	3.125	20	30		EGEDHN
C[C@H](CNCC#Cc1cccc(Cl)c1)NC(=O)Cc1ccsc1	ZINC001754216067	1440551949	/nfs/dbraw/zinc/55/19/49/1440551949.db2.gz	ISAWYBCBZPGPDA-CQSZACIVSA-N	0	3	346.883	3.090	20	30		EGEDHN
C=CCCC(=O)N[C@@H](C)CN(C)CCc1c(F)cccc1Cl	ZINC001754307329	1440571509	/nfs/dbraw/zinc/57/15/09/1440571509.db2.gz	ZPJZWRPOLIEDHH-ZDUSSCGKSA-N	0	3	326.843	3.424	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)c1cccnc1C1CC1	ZINC001754313717	1440574366	/nfs/dbraw/zinc/57/43/66/1440574366.db2.gz	CASFIVDUYHOYHO-HNNXBMFYSA-N	0	3	348.450	3.081	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H](C)CN(C)Cc2cc(F)ccc2C)cc1	ZINC001754318921	1440576915	/nfs/dbraw/zinc/57/69/15/1440576915.db2.gz	KTJMDTXHRBBLAV-MRXNPFEDSA-N	0	3	338.426	3.366	20	30		EGEDHN
CN(CCCNCc1ccc(C#N)cc1F)C(=O)[C@@H]1C[C@H]1C1CCC1	ZINC001754402523	1440595328	/nfs/dbraw/zinc/59/53/28/1440595328.db2.gz	KWACMTQPQBBDHS-ZWKOTPCHSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=C(Cl)CNCCCN(C)C(=O)Cc1ccc2c(c1)CCCC2	ZINC001754412238	1440596465	/nfs/dbraw/zinc/59/64/65/1440596465.db2.gz	AUIUYPKSTQESAU-UHFFFAOYSA-N	0	3	334.891	3.299	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@H]1CCN1CCCc1ccc(C)cc1	ZINC001754491485	1440610233	/nfs/dbraw/zinc/61/02/33/1440610233.db2.gz	KFHUEVSDYARNFY-FQEVSTJZSA-N	0	3	326.484	3.312	20	30		EGEDHN
CCCCCCCN1CC[C@H]1CNC(=O)c1c(C)cc(C)[nH]c1=O	ZINC001754503276	1440615158	/nfs/dbraw/zinc/61/51/58/1440615158.db2.gz	UGJTWYOTHTWSCK-INIZCTEOSA-N	0	3	333.476	3.179	20	30		EGEDHN
C=CCC[C@@H](C)N1CC[C@@H]1CNC(=O)c1ccc(N=NC(N)=O)cc1	ZINC001754504201	1440615688	/nfs/dbraw/zinc/61/56/88/1440615688.db2.gz	GSSYUDLIZFXXLW-CZUORRHYSA-N	0	3	343.431	3.008	20	30		EGEDHN
CCCCC1(C(=O)NCC2(NCc3cccc(C#N)c3)CC2)CC1	ZINC001754523641	1440620357	/nfs/dbraw/zinc/62/03/57/1440620357.db2.gz	CUXSYBCIVHITGZ-UHFFFAOYSA-N	0	3	325.456	3.267	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)NCC1(NCc2ccc(C(C)C)cc2)CC1	ZINC001754525290	1440620747	/nfs/dbraw/zinc/62/07/47/1440620747.db2.gz	KDLQUGHZQZJQDQ-MOPGFXCFSA-N	0	3	342.483	3.140	20	30		EGEDHN
CC[C@@H](C)[C@H](C)C(=O)NCC1(NCc2ccc(F)c(C#N)c2)CC1	ZINC001754530624	1440622378	/nfs/dbraw/zinc/62/23/78/1440622378.db2.gz	YNRPDPZLNAMNAT-KGLIPLIRSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@]2(CCN(CCc3c(F)cccc3F)C2)C1	ZINC001754563981	1440634645	/nfs/dbraw/zinc/63/46/45/1440634645.db2.gz	SNIDIOPCLVPVFA-HXUWFJFHSA-N	0	3	348.437	3.398	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@]2(CCN(Cc3cnc(C)s3)C2)C1	ZINC001754565684	1440635514	/nfs/dbraw/zinc/63/55/14/1440635514.db2.gz	MYXSCQNVEFQTGN-GOSISDBHSA-N	0	3	333.501	3.232	20	30		EGEDHN
CCCCCC(=O)N1CCC[C@H]1CNCc1ccc(C#N)cc1F	ZINC001754606044	1440643255	/nfs/dbraw/zinc/64/32/55/1440643255.db2.gz	ASMWBLCBUIMMLG-KRWDZBQOSA-N	0	3	331.435	3.358	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)CCOc2c(C)cccc2C)CC1	ZINC001754626915	1440646512	/nfs/dbraw/zinc/64/65/12/1440646512.db2.gz	RRKDPKOLNBNZEW-UHFFFAOYSA-N	0	3	330.472	3.229	20	30		EGEDHN
C#CCN(C(=O)CCC)C1CCN(Cc2ccc(CF)cc2)CC1	ZINC001754633669	1440648290	/nfs/dbraw/zinc/64/82/90/1440648290.db2.gz	GALFHBLXILTDDN-UHFFFAOYSA-N	0	3	330.447	3.382	20	30		EGEDHN
CC(C)CC(=O)N[C@H](CNCC#Cc1ccccc1)C1CCCC1	ZINC001754647848	1440650911	/nfs/dbraw/zinc/65/09/11/1440650911.db2.gz	TWBGESWMQYIOTD-HXUWFJFHSA-N	0	3	326.484	3.349	20	30		EGEDHN
CC(C)CC(=O)N[C@@H](CNCC#Cc1ccccc1)C1CCCC1	ZINC001754647847	1440650967	/nfs/dbraw/zinc/65/09/67/1440650967.db2.gz	TWBGESWMQYIOTD-FQEVSTJZSA-N	0	3	326.484	3.349	20	30		EGEDHN
CC1(C(=O)N[C@H](CNCc2ccc(C#N)s2)C2CCCC2)CC1	ZINC001754650632	1440651731	/nfs/dbraw/zinc/65/17/31/1440651731.db2.gz	QUYLDIAZIDMNDL-MRXNPFEDSA-N	0	3	331.485	3.184	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H](CNCc1ccnc(OC)c1)C1CCCC1	ZINC001754653030	1440652614	/nfs/dbraw/zinc/65/26/14/1440652614.db2.gz	RUZUPDCTEHJNCJ-QGZVFWFLSA-N	0	3	345.487	3.067	20	30		EGEDHN
CC/C=C(\C)C(=O)N1CC[C@](C)(CNCc2ccccc2C#N)C1	ZINC001754688765	1440665734	/nfs/dbraw/zinc/66/57/34/1440665734.db2.gz	BQGQXNBTADMYOE-FALBMNKOSA-N	0	3	325.456	3.243	20	30		EGEDHN
CC[C@@H](F)C(=O)NC[C@@]1(C)CCCN(Cc2cccc(C#N)c2)C1	ZINC001754730928	1440679286	/nfs/dbraw/zinc/67/92/86/1440679286.db2.gz	ZMUKZZRCLQVRAC-IEBWSBKVSA-N	0	3	331.435	3.025	20	30		EGEDHN
C=CCN1CCC[C@](C)(CNC(=O)[C@]2(C)CCc3ccccc32)C1	ZINC001754733683	1440681236	/nfs/dbraw/zinc/68/12/36/1440681236.db2.gz	FIZHWBXYMWAXKW-NHCUHLMSSA-N	0	3	326.484	3.295	20	30		EGEDHN
C=CCN1CCC[C@](C)(CNC(=O)[C@H](C)CCOc2ccccc2)C1	ZINC001754734670	1440681679	/nfs/dbraw/zinc/68/16/79/1440681679.db2.gz	PDOHERPKRUQKNM-WIYYLYMNSA-N	0	3	344.499	3.496	20	30		EGEDHN
CC#CCN1CCC[C@@](C)(CNC(=O)c2ccc(C)nc2C(C)C)C1	ZINC001754736890	1440682486	/nfs/dbraw/zinc/68/24/86/1440682486.db2.gz	VITFEGMWIHCOLJ-NRFANRHFSA-N	0	3	341.499	3.369	20	30		EGEDHN
CC(C)=CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(Cc1ccc(F)c(C#N)c1)C2	ZINC001754778729	1440685784	/nfs/dbraw/zinc/68/57/84/1440685784.db2.gz	CTQALBVJENISHD-JQHSSLGASA-N	0	3	341.430	3.133	20	30		EGEDHN
C#CCCN[C@H](CNC(=O)c1ccccc1F)c1ccccc1CC	ZINC001754785863	1440687723	/nfs/dbraw/zinc/68/77/23/1440687723.db2.gz	QYFWSHPBVWCDQI-HXUWFJFHSA-N	0	3	338.426	3.472	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CCC[C@H]2CN(Cc3ccsc3)C[C@H]21	ZINC001754870863	1440704963	/nfs/dbraw/zinc/70/49/63/1440704963.db2.gz	NAPAZAJRERFNBF-BPQIPLTHSA-N	0	3	348.512	3.152	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@H](CCNCc2ncc(C)s2)C1	ZINC001754928406	1440710253	/nfs/dbraw/zinc/71/02/53/1440710253.db2.gz	PHNLQMZHDHKOPQ-CVEARBPZSA-N	0	3	335.517	3.382	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)CCCc3sccc3C)C2)CC1	ZINC001754962740	1440717998	/nfs/dbraw/zinc/71/79/98/1440717998.db2.gz	MRUXDDZJAFRWKI-UHFFFAOYSA-N	0	3	344.524	3.327	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1CCCN(C[C@@H](O)c2ccccc2F)CC1	ZINC001755028804	1440730448	/nfs/dbraw/zinc/73/04/48/1440730448.db2.gz	PUYMLXBRVMYEIE-MAUKXSAKSA-N	0	3	348.462	3.042	20	30		EGEDHN
CN(CCCN(C)C(=O)C1(CF)CCC1)Cc1ccc(F)c(C#N)c1	ZINC001755043342	1440738757	/nfs/dbraw/zinc/73/87/57/1440738757.db2.gz	SMBPOOXTPDQTFQ-UHFFFAOYSA-N	0	3	349.425	3.117	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC(CC)(NCc2cnns2)CC1	ZINC001755070332	1440746333	/nfs/dbraw/zinc/74/63/33/1440746333.db2.gz	BFJYYCDHPNSQMB-UHFFFAOYSA-N	0	3	336.505	3.001	20	30		EGEDHN
C=CCCCN1Cc2ccc(CNC(=O)c3cc(C)on3)cc2C1	ZINC001755100229	1440751982	/nfs/dbraw/zinc/75/19/82/1440751982.db2.gz	KZJFFYXLYCKVNC-UHFFFAOYSA-N	0	3	325.412	3.195	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NCc1ccc2c(c1)CN(CC1CC1)C2)OCC	ZINC001755102276	1440753314	/nfs/dbraw/zinc/75/33/14/1440753314.db2.gz	OXFKMAZJMDCHNB-HXUWFJFHSA-N	0	3	342.483	3.400	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccoc2Cl)C[C@@H]1NCC#Cc1ccccc1	ZINC001755108955	1440754046	/nfs/dbraw/zinc/75/40/46/1440754046.db2.gz	OEVMCPISJMCRIO-PBHICJAKSA-N	0	3	342.826	3.035	20	30		EGEDHN
C[C@H]1CN(C(=O)c2ccoc2C2CC2)C[C@@H]1NCC#Cc1ccccc1	ZINC001755113435	1440754535	/nfs/dbraw/zinc/75/45/35/1440754535.db2.gz	HKIULAZUNOENJE-JXFKEZNVSA-N	0	3	348.446	3.259	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@H](NCc2cnn(C(C)(C)C)c2)[C@@H](C)C1	ZINC001755115873	1440754964	/nfs/dbraw/zinc/75/49/64/1440754964.db2.gz	DNKRPCGKTADQBP-RDJZCZTQSA-N	0	3	346.519	3.177	20	30		EGEDHN
Cc1nc(CNC2(C)CCN(C(=O)C#CC(C)(C)C)CC2)c(C)s1	ZINC001755128122	1440756594	/nfs/dbraw/zinc/75/65/94/1440756594.db2.gz	SUVWHHJXUYITGT-UHFFFAOYSA-N	0	3	347.528	3.280	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1CCN(CCn2nc(C)cc2C)CC1(C)C	ZINC001755139314	1440759633	/nfs/dbraw/zinc/75/96/33/1440759633.db2.gz	VSCWTSFHVTXBRM-SFHVURJKSA-N	0	3	346.519	3.073	20	30		EGEDHN
C=CCOCC(=O)N[C@H]1CCN([C@H](C)c2ccc(F)cc2)CC1(C)C	ZINC001755139883	1440759760	/nfs/dbraw/zinc/75/97/60/1440759760.db2.gz	NJTJVEUJTCOKLG-QAPCUYQASA-N	0	3	348.462	3.306	20	30		EGEDHN
C=CCOCC(=O)N[C@@H]1CCN([C@@H](C)c2ccc(F)cc2)CC1(C)C	ZINC001755139882	1440759845	/nfs/dbraw/zinc/75/98/45/1440759845.db2.gz	NJTJVEUJTCOKLG-MAUKXSAKSA-N	0	3	348.462	3.306	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)[C@@H](C)OCc2ccc(F)cc2)C(C)(C)C1	ZINC001755142968	1440761921	/nfs/dbraw/zinc/76/19/21/1440761921.db2.gz	FWXOJURGFCLSIL-QAPCUYQASA-N	0	3	348.462	3.134	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1CCN(Cc2ncccc2C)[C@H](C)C1	ZINC001755166901	1440767540	/nfs/dbraw/zinc/76/75/40/1440767540.db2.gz	HOCABAYSPLDTCS-SJORKVTESA-N	0	3	329.488	3.461	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CCN(CCOc2ccccc2C)[C@H](C)C1	ZINC001755168438	1440767984	/nfs/dbraw/zinc/76/79/84/1440767984.db2.gz	BTXZHUAMIMYAPF-MSOLQXFVSA-N	0	3	330.472	3.309	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)CCC(C)(F)F)CC2)C1	ZINC001755174045	1440770241	/nfs/dbraw/zinc/77/02/41/1440770241.db2.gz	HONOIJYDZZQMJI-UHFFFAOYSA-N	0	3	344.446	3.081	20	30		EGEDHN
C=CCCCN1CCOC2(CCN(C(=O)[C@H]3CCCC[C@@H]3C)CC2)C1	ZINC001755174317	1440770409	/nfs/dbraw/zinc/77/04/09/1440770409.db2.gz	NUJINPJBKNGXRO-OALUTQOASA-N	0	3	348.531	3.472	20	30		EGEDHN
C#CCCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc(CC(C)C)c[nH]1	ZINC001755188114	1440773789	/nfs/dbraw/zinc/77/37/89/1440773789.db2.gz	YXROJEGOIOYXGN-TZIWHRDSSA-N	0	3	349.478	3.222	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]2CN(C)CCOc2ccccc2)C1	ZINC001755199457	1440778657	/nfs/dbraw/zinc/77/86/57/1440778657.db2.gz	WWYZCGXXXCGXBI-SFHVURJKSA-N	0	3	342.483	3.345	20	30		EGEDHN
COc1ccc(C#N)cc1CN[C@@H](C)[C@H](C)NC(=O)C(C)(C)C(C)C	ZINC001755238949	1440789001	/nfs/dbraw/zinc/78/90/01/1440789001.db2.gz	YUSKPGCLGNRHCA-GJZGRUSLSA-N	0	3	345.487	3.232	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H](C)[C@H](C)NCC#Cc1ccc(Cl)cc1	ZINC001755249571	1440791474	/nfs/dbraw/zinc/79/14/74/1440791474.db2.gz	QXWBTXDVRVXMKC-LSDHHAIUSA-N	0	3	332.875	3.387	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](C)[C@@H](C)NCC#Cc2ccccc2)ccc1F	ZINC001755250196	1440791692	/nfs/dbraw/zinc/79/16/92/1440791692.db2.gz	QMOHBHUXNLEPKJ-IAGOWNOFSA-N	0	3	338.426	3.282	20	30		EGEDHN
CCCc1[nH]ccc1C(=O)N[C@@H](C)[C@@H](C)NCC#Cc1ccccc1	ZINC001755251123	1440791932	/nfs/dbraw/zinc/79/19/32/1440791932.db2.gz	WFTKJYIITVMTSM-SJORKVTESA-N	0	3	337.467	3.115	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1ccc2n[nH]cc2c1	ZINC001755284315	1440801499	/nfs/dbraw/zinc/80/14/99/1440801499.db2.gz	NXJZVCGBFGIUOF-UHFFFAOYSA-N	0	3	334.851	3.003	20	30		EGEDHN
C=CCOCCN(C)[C@@H](C)CNC(=O)c1cc2ccccc2cc1F	ZINC001755307835	1440811937	/nfs/dbraw/zinc/81/19/37/1440811937.db2.gz	OVEWYAUZDKQBOL-HNNXBMFYSA-N	0	3	344.430	3.232	20	30		EGEDHN
C[C@@H](CNC(=O)C1CC2(CCC2)C1)N(C)Cc1ccc(C#N)cc1	ZINC001755312739	1440814178	/nfs/dbraw/zinc/81/41/78/1440814178.db2.gz	INCCVQUFTNSLQF-HNNXBMFYSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@@H](CNC(=O)c1cccc(F)c1F)N(C)Cc1cccc(C#N)c1	ZINC001755313750	1440814638	/nfs/dbraw/zinc/81/46/38/1440814638.db2.gz	OPXJTKDOGDQLAL-ZDUSSCGKSA-N	0	3	343.377	3.087	20	30		EGEDHN
N#Cc1cccc(CN2CCCCC[C@@H]2CNC(=O)CCC(F)F)c1	ZINC001755366876	1440835019	/nfs/dbraw/zinc/83/50/19/1440835019.db2.gz	ZSKSYMJODFTCOZ-QGZVFWFLSA-N	0	3	349.425	3.464	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)C(C)(C)c1ccccc1	ZINC001755369036	1440836547	/nfs/dbraw/zinc/83/65/47/1440836547.db2.gz	ZUQMBEXQOAFBDV-IBGZPJMESA-N	0	3	326.484	3.348	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H](C)C1CN(Cc2cc(C)sc2C)C1	ZINC001755383078	1440839862	/nfs/dbraw/zinc/83/98/62/1440839862.db2.gz	HLUFTJZTOHGRSR-HNNXBMFYSA-N	0	3	332.513	3.495	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@]2(CCN(C(=O)c3cccc(F)c3)C2)C1	ZINC001755399794	1440842730	/nfs/dbraw/zinc/84/27/30/1440842730.db2.gz	QIROMPMNZUDCDP-OXQOHEQNSA-N	0	3	346.446	3.097	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@]2(CCN(C(=O)c3sccc3C)C2)C1	ZINC001755399829	1440842871	/nfs/dbraw/zinc/84/28/71/1440842871.db2.gz	RLILLVVZXGSNPW-LPHOPBHVSA-N	0	3	348.512	3.328	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@H]2CN(Cc3ccccc3C#N)C[C@H]2C1	ZINC001755453752	1440854679	/nfs/dbraw/zinc/85/46/79/1440854679.db2.gz	SDTMUYJCTINPLY-PWRODBHTSA-N	0	3	349.478	3.078	20	30		EGEDHN
C=CCCC(=O)N1C[C@@]2(C)CN(Cc3sc(C)nc3C)C[C@@]2(C)C1	ZINC001755460034	1440857009	/nfs/dbraw/zinc/85/70/09/1440857009.db2.gz	KZEUHSDNNHJLJA-KDURUIRLSA-N	0	3	347.528	3.397	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H]1C[C@H](CNCc2cc(F)ccc2Cl)C1	ZINC001755471337	1440858802	/nfs/dbraw/zinc/85/88/02/1440858802.db2.gz	TUFGDWNGPZJDFZ-SAZUREKKSA-N	0	3	336.838	3.123	20	30		EGEDHN
C[C@@H](CCCNCc1ccccc1C#N)NC(=O)[C@@H]1CCC1(C)C	ZINC001755513878	1440863854	/nfs/dbraw/zinc/86/38/54/1440863854.db2.gz	XASQQQYIQRQAGO-YJBOKZPZSA-N	0	3	327.472	3.369	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N(C)[C@@H](CNCC#Cc1ccc(F)cc1)C1CC1	ZINC001755568863	1440876489	/nfs/dbraw/zinc/87/64/89/1440876489.db2.gz	FIUMRCQKVIAGNJ-UZLBHIALSA-N	0	3	344.474	3.296	20	30		EGEDHN
C=C(Br)CNC[C@H](C1CC1)N(C)C(=O)C[C@H](C)CC	ZINC001755572221	1440877226	/nfs/dbraw/zinc/87/72/26/1440877226.db2.gz	RMDINYVUZPPYLM-BXUZGUMPSA-N	0	3	331.298	3.158	20	30		EGEDHN
Cc1ccccc1C(=O)N(C)C[C@@H](C)NCc1ccc(C#N)c(F)c1	ZINC001755576357	1440878196	/nfs/dbraw/zinc/87/81/96/1440878196.db2.gz	UXAHXWRRXHEMSF-OAHLLOKOSA-N	0	3	339.414	3.256	20	30		EGEDHN
C[C@H](CN(C)C(=O)[C@@H](C)C(C)(C)C)NCc1ccc(C#N)c(F)c1	ZINC001755592256	1440881735	/nfs/dbraw/zinc/88/17/35/1440881735.db2.gz	BAKTUSSVOXTSDP-ZIAGYGMSSA-N	0	3	333.451	3.316	20	30		EGEDHN
C#Cc1cncc(C(=O)N(C)C[C@@H](C)N[C@@H](C)c2ccccc2F)c1	ZINC001755604337	1440885060	/nfs/dbraw/zinc/88/50/60/1440885060.db2.gz	UJQPDFFEHLCGOW-CABCVRRESA-N	0	3	339.414	3.013	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@]3(NC(=O)CCC(F)F)CCC[C@@H]23)cc1	ZINC001755700910	1440899900	/nfs/dbraw/zinc/89/99/00/1440899900.db2.gz	HNMRIDVMYOLOGR-VQIMIIECSA-N	0	3	347.409	3.217	20	30		EGEDHN
C=CCCCC(=O)N[C@]12CCC[C@@H]1N(CCc1ccns1)CC2	ZINC001755702644	1440900928	/nfs/dbraw/zinc/90/09/28/1440900928.db2.gz	WZQPYAQWFWRCAT-WMZOPIPTSA-N	0	3	333.501	3.155	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CCCN(Cc2ccc(CO)cc2)[C@@H]1C	ZINC001755716934	1440905362	/nfs/dbraw/zinc/90/53/62/1440905362.db2.gz	CUUOMQVJHFUCRC-VQIMIIECSA-N	0	3	330.472	3.004	20	30		EGEDHN
C=CCOCCN1CCC[C@H](NC(=O)c2cc(C)sc2C)[C@H]1C	ZINC001755717899	1440905978	/nfs/dbraw/zinc/90/59/78/1440905978.db2.gz	WFIAJZHUUVJJJA-PBHICJAKSA-N	0	3	336.501	3.150	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)CC(F)(F)C(F)(F)F)[C@@H]1C	ZINC001755721790	1440907812	/nfs/dbraw/zinc/90/78/12/1440907812.db2.gz	CYHFAKFJNICQMF-WDEREUQCSA-N	0	3	328.325	3.119	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1CC[C@H](CNCc2nc(C)cs2)C1	ZINC001755726226	1440909483	/nfs/dbraw/zinc/90/94/83/1440909483.db2.gz	FJBATZKIPWZPMW-HOTGVXAUSA-N	0	3	333.501	3.020	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC[C@H](CNCc2cc(O)ccc2Cl)C1	ZINC001755730862	1440910066	/nfs/dbraw/zinc/91/00/66/1440910066.db2.gz	NYXMCOFKFWFOEL-ZFWWWQNUSA-N	0	3	336.863	3.386	20	30		EGEDHN
Cc1nsc(C)c1CNC[C@H](NC(=O)C#CC(C)(C)C)C(C)(C)C	ZINC001755821811	1440925884	/nfs/dbraw/zinc/92/58/84/1440925884.db2.gz	JREBNICWWLDIBU-INIZCTEOSA-N	0	3	349.544	3.430	20	30		EGEDHN
CC(C)(C)[C@H](CNCC#Cc1ccccc1)NC(=O)C1(F)CCCC1	ZINC001755827316	1440927631	/nfs/dbraw/zinc/92/76/31/1440927631.db2.gz	JLJFVMPWXXZPHD-SFHVURJKSA-N	0	3	344.474	3.441	20	30		EGEDHN
CC(C)(C)C#CC(=O)NC1(C2CCN(CCC(F)(F)F)CC2)CC1	ZINC001755868202	1440938331	/nfs/dbraw/zinc/93/83/31/1440938331.db2.gz	LXVWBZSLSIXWIP-UHFFFAOYSA-N	0	3	344.421	3.349	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC1=CCN(CCc2scnc2C)CC1	ZINC001755892759	1440941839	/nfs/dbraw/zinc/94/18/39/1440941839.db2.gz	UWLUONLHDNLUHK-LJQANCHMSA-N	0	3	347.528	3.345	20	30		EGEDHN
CN(C(=O)c1ccccc1-c1ccccc1C#N)C1CCN(C)CC1	ZINC000178658233	232346696	/nfs/dbraw/zinc/34/66/96/232346696.db2.gz	LEPDQBBRMGFDIK-UHFFFAOYSA-N	0	3	333.435	3.391	20	30		EGEDHN
N#Cc1cc(CN2CCC[C@@H](c3nc(C4CC4)n[nH]3)C2)ccc1F	ZINC000179512722	233119329	/nfs/dbraw/zinc/11/93/29/233119329.db2.gz	PHUZXUSUXHLTGP-CQSZACIVSA-N	0	3	325.391	3.072	20	30		EGEDHN
N#Cc1cc(CN2CCC[C@@H](c3n[nH]c(C4CC4)n3)C2)ccc1F	ZINC000179512722	233119334	/nfs/dbraw/zinc/11/93/34/233119334.db2.gz	PHUZXUSUXHLTGP-CQSZACIVSA-N	0	3	325.391	3.072	20	30		EGEDHN
N#Cc1cccc(C(=O)N2CCC(N3CCc4ccccc4C3)CC2)c1	ZINC000072435171	216229064	/nfs/dbraw/zinc/22/90/64/216229064.db2.gz	GTWGTXAPHCXBPR-UHFFFAOYSA-N	0	3	345.446	3.221	20	30		EGEDHN
Cn1cc(CN[C@H]2CCN(c3ccc(F)c(Cl)c3)C2)cc1C#N	ZINC000191568345	239192019	/nfs/dbraw/zinc/19/20/19/239192019.db2.gz	UTRKLAKRUQDSHS-ZDUSSCGKSA-N	0	3	332.810	3.058	20	30		EGEDHN
COc1cc([C@@H](C)NCc2cccc(C#N)c2)cc(OC)c1OC	ZINC000079720667	217250374	/nfs/dbraw/zinc/25/03/74/217250374.db2.gz	BWENAVFOJJVARF-CYBMUJFWSA-N	0	3	326.396	3.435	20	30		EGEDHN
C[C@@H](O)CN(Cc1nnc(-c2ccc(C#N)cc2)o1)C1CCCCC1	ZINC000266533019	248349117	/nfs/dbraw/zinc/34/91/17/248349117.db2.gz	MVLDEVSEJMNESL-CQSZACIVSA-N	0	3	340.427	3.124	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN2CC[C@@]3(C2)CCc2ccccc2O3)cc1	ZINC000377657924	169056297	/nfs/dbraw/zinc/05/62/97/169056297.db2.gz	IRRVDCFYOUFLIY-TZIWHRDSSA-N	0	3	334.419	3.061	20	30		EGEDHN
CCOCCN(C)CCC(=O)Nc1sc2c(c1C#N)CCCCC2	ZINC000093314364	218213340	/nfs/dbraw/zinc/21/33/40/218213340.db2.gz	VTULQFAWGYDGKN-UHFFFAOYSA-N	0	3	349.500	3.186	20	30		EGEDHN
Cc1csc(C2(NC[C@H](O)c3ccc(C#N)cc3)CCCC2)n1	ZINC000268638310	252090958	/nfs/dbraw/zinc/09/09/58/252090958.db2.gz	GONMBWDYJOCRIV-INIZCTEOSA-N	0	3	327.453	3.416	20	30		EGEDHN
COc1ccccc1[C@@H](CNCc1cc(C#N)n(C)c1)OC(C)C	ZINC000191613487	532973878	/nfs/dbraw/zinc/97/38/78/532973878.db2.gz	HNMAJUXNPVNUHH-LJQANCHMSA-N	0	3	327.428	3.161	20	30		EGEDHN
C[C@@H]1[C@H](C)SCCN1CCC(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000118414060	221147343	/nfs/dbraw/zinc/14/73/43/221147343.db2.gz	UMHZVJTZPQSKPG-NEPJUHHUSA-N	0	3	337.876	3.366	20	30		EGEDHN
COc1ccc(CNC[C@H](c2ccc(F)cc2)N(C)C)cc1C#N	ZINC000174282323	533670281	/nfs/dbraw/zinc/67/02/81/533670281.db2.gz	SKRCPHUXMUWUAF-GOSISDBHSA-N	0	3	327.403	3.098	20	30		EGEDHN
N#Cc1cc(F)ccc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000344473463	141160348	/nfs/dbraw/zinc/16/03/48/141160348.db2.gz	LQEFUUZDUJXAPV-QGZVFWFLSA-N	0	3	338.386	3.093	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN[C@@H]2CCCc3c(O)cccc32)c1	ZINC000192368490	144173832	/nfs/dbraw/zinc/17/38/32/144173832.db2.gz	PYEBYVCJSZVCOZ-GOSISDBHSA-N	0	3	335.407	3.260	20	30		EGEDHN
COCC#CCN[C@H](Cc1ccc(OC)cc1)c1ccc(OC)cc1	ZINC000677818642	549336764	/nfs/dbraw/zinc/33/67/64/549336764.db2.gz	FHVLZEBXBGECFO-OAQYLSRUSA-N	0	3	339.435	3.227	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CCN1CCOc1cccc(C#N)c1	ZINC000303706640	154054637	/nfs/dbraw/zinc/05/46/37/154054637.db2.gz	BVZGGQKIBVQSBS-SFHVURJKSA-N	0	3	335.451	3.143	20	30		EGEDHN
Cc1cc(F)cc2c1CN(CCC(=O)Nc1ccc(C#N)cc1)CC2	ZINC000337462523	154364778	/nfs/dbraw/zinc/36/47/78/154364778.db2.gz	QJCPRKFRWFXLBW-UHFFFAOYSA-N	0	3	337.398	3.393	20	30		EGEDHN
Cc1ccn2c(CN(CCN(C)C)Cc3ccc(C#N)cc3)cnc2c1	ZINC000348920227	156288104	/nfs/dbraw/zinc/28/81/04/156288104.db2.gz	JIOSFDPSHGPBOS-UHFFFAOYSA-N	0	3	347.466	3.078	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)Cc1ccc(F)cc1F	ZINC000349063896	156340410	/nfs/dbraw/zinc/34/04/10/156340410.db2.gz	SFNCPIIDVMZGBR-UHFFFAOYSA-N	0	3	329.394	3.400	20	30		EGEDHN
CN(Cc1cn(C)nc1-c1ccc(C#N)cc1)[C@H](CO)c1ccccc1	ZINC000360011545	156880399	/nfs/dbraw/zinc/88/03/99/156880399.db2.gz	WPHIKNSEUHXNCH-HXUWFJFHSA-N	0	3	346.434	3.124	20	30		EGEDHN
CN(C)Cc1c2ccccc2oc1C(=O)NCc1cccc(C#N)c1	ZINC000114232736	162224198	/nfs/dbraw/zinc/22/41/98/162224198.db2.gz	DNEOZQPSQPTOBE-UHFFFAOYSA-N	0	3	333.391	3.296	20	30		EGEDHN
C[C@@H](NC(=O)Cc1c(F)cccc1C#N)[C@H](c1ccccc1)N(C)C	ZINC000354768779	166027339	/nfs/dbraw/zinc/02/73/39/166027339.db2.gz	YJYIVUUJEBGDIM-JLTOFOAXSA-N	0	3	339.414	3.047	20	30		EGEDHN
COc1ccc(CN(C)CCC(=O)Nc2sccc2C#N)cc1C	ZINC000343656692	164005447	/nfs/dbraw/zinc/00/54/47/164005447.db2.gz	AENBMEXFGVVELZ-UHFFFAOYSA-N	0	3	343.452	3.397	20	30		EGEDHN
C[C@@H](NCCNC(=O)c1ccccc1Cl)c1ccc(C#N)c(F)c1	ZINC000346177082	164357479	/nfs/dbraw/zinc/35/74/79/164357479.db2.gz	IHQJOTAZYULXAW-GFCCVEGCSA-N	0	3	345.805	3.431	20	30		EGEDHN
N#Cc1c(F)cccc1OC[C@@H]1CN(Cc2ccccc2)CCCO1	ZINC000351912919	165147334	/nfs/dbraw/zinc/14/73/34/165147334.db2.gz	MZYCMJBGKVLUAT-KRWDZBQOSA-N	0	3	340.398	3.367	20	30		EGEDHN
CC(C)Cc1ccc([C@@H](CNC(=O)c2c[nH]c(C#N)c2)N(C)C)cc1	ZINC000359884303	167257369	/nfs/dbraw/zinc/25/73/69/167257369.db2.gz	XMMHBWFRDCTSER-LJQANCHMSA-N	0	3	338.455	3.118	20	30		EGEDHN
CNC(=O)c1cccc(CN[C@@H]2CCCCc3cc(C#N)ccc32)c1	ZINC000360645346	167377411	/nfs/dbraw/zinc/37/74/11/167377411.db2.gz	DKYYZZZUVISBPA-HXUWFJFHSA-N	0	3	333.435	3.475	20	30		EGEDHN
Cc1cccc(O[C@@H](C)CNC(=O)C(C#N)Cc2ccc(C#N)cc2)c1	ZINC000280441128	270039991	/nfs/dbraw/zinc/03/99/91/270039991.db2.gz	NAYWMJBLJBZSAJ-QFBILLFUSA-N	0	3	347.418	3.133	20	30		EGEDHN
N#Cc1ccc(CNc2cccc(CN3CCC(O)CC3)c2)cc1F	ZINC000421339431	270048906	/nfs/dbraw/zinc/04/89/06/270048906.db2.gz	RYMCQTRKNQIULQ-UHFFFAOYSA-N	0	3	339.414	3.266	20	30		EGEDHN
CC(C)CSCCCN1CCN(Cc2ccc(C#N)cc2)CC1	ZINC000443628908	270052390	/nfs/dbraw/zinc/05/23/90/270052390.db2.gz	SHMUZVZKRLFYMT-UHFFFAOYSA-N	0	3	331.529	3.455	20	30		EGEDHN
N#Cc1cccc(C(=O)NCC2(N3CCSCC3)CCCCC2)c1	ZINC000524156682	270059596	/nfs/dbraw/zinc/05/95/96/270059596.db2.gz	FJIRCIDYXHTTPD-UHFFFAOYSA-N	0	3	343.496	3.040	20	30		EGEDHN
COc1ccc(CN[C@@H](C)c2ccc3c(c2)CCC(=O)N3)cc1C#N	ZINC000174276199	533686754	/nfs/dbraw/zinc/68/67/54/533686754.db2.gz	ZTPBTYIAQOBIIH-ZDUSSCGKSA-N	0	3	335.407	3.302	20	30		EGEDHN
CCN(C[C@H](O)COCc1ccco1)[C@@H](C)c1ccc(C#N)cc1	ZINC000193726946	266134134	/nfs/dbraw/zinc/13/41/34/266134134.db2.gz	PRAIWGFBDZGIEW-YJBOKZPZSA-N	0	3	328.412	3.112	20	30		EGEDHN
CCN(C[C@H]1CCN(Cc2ccc(C#N)c(F)c2)C1)CC(F)(F)F	ZINC000192055494	266134417	/nfs/dbraw/zinc/13/44/17/266134417.db2.gz	YAAIXPJNOSVCQY-CQSZACIVSA-N	0	3	343.368	3.403	20	30		EGEDHN
CCO[C@@H]1C[C@H](NCC(=O)Nc2sc(C)c(C)c2C#N)C12CCC2	ZINC000296169885	266298045	/nfs/dbraw/zinc/29/80/45/266298045.db2.gz	KXRGLHKQCGMJFB-LSDHHAIUSA-N	0	3	347.484	3.112	20	30		EGEDHN
CCS[C@@H]1CCC[C@H]1NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000280499893	266346963	/nfs/dbraw/zinc/34/69/63/266346963.db2.gz	QTPTXUSJJMDNTJ-BRWVUGGUSA-N	0	3	327.453	3.031	20	30		EGEDHN
C[C@@H](NCc1ccc(N2CCOCC2)c(F)c1)c1cccc(C#N)c1	ZINC000174429916	266967741	/nfs/dbraw/zinc/96/77/41/266967741.db2.gz	YGTBZZNVDFYYQP-OAHLLOKOSA-N	0	3	339.414	3.385	20	30		EGEDHN
CCCCN(C)CCNC(=O)Nc1ccc(C#N)c(C(F)(F)F)c1	ZINC000438653043	267005984	/nfs/dbraw/zinc/00/59/84/267005984.db2.gz	QPLFBYZRTLHQLV-UHFFFAOYSA-N	0	3	342.365	3.430	20	30		EGEDHN
CCCCO[C@@H]1C[C@@H](NCC(=O)Nc2oc(C)c(C)c2C#N)C1(C)C	ZINC000450976675	267010625	/nfs/dbraw/zinc/01/06/25/267010625.db2.gz	ZVVAKFXZSZVAFS-HZPDHXFCSA-N	0	3	347.459	3.280	20	30		EGEDHN
CCCN(CCc1cccs1)[C@H](C(N)=O)c1ccc(C#N)cc1	ZINC000411546592	267011976	/nfs/dbraw/zinc/01/19/76/267011976.db2.gz	BEIFABFDWUMLOS-KRWDZBQOSA-N	0	3	327.453	3.101	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@H]1Nc1ccc([N+](=O)[O-])c(C#N)c1	ZINC000302195618	267056461	/nfs/dbraw/zinc/05/64/61/267056461.db2.gz	OKWOWJARLKPTIY-RDTXWAMCSA-N	0	3	336.395	3.399	20	30		EGEDHN
C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)Nc1ccc(C#N)cc1Cl	ZINC000287292235	267080370	/nfs/dbraw/zinc/08/03/70/267080370.db2.gz	ZAQIRMYRNTYWTP-TZMCWYRMSA-N	0	3	332.835	3.302	20	30		EGEDHN
CCO[C@@H]1CCN(Cc2cn(C)nc2-c2ccc(C#N)cc2)C[C@@H]1C	ZINC000449500268	267147409	/nfs/dbraw/zinc/14/74/09/267147409.db2.gz	MVRRDXIZZBHXDQ-HNAYVOBHSA-N	0	3	338.455	3.206	20	30		EGEDHN
CCO[C@@H]1C[C@@H](NCC(=O)Nc2ccc(C#N)c(Cl)c2)C12CCC2	ZINC000451480296	267150224	/nfs/dbraw/zinc/15/02/24/267150224.db2.gz	OLQCQBVLGCOIES-HZPDHXFCSA-N	0	3	347.846	3.087	20	30		EGEDHN
C[C@H](CN1CCC[C@H](C)C1)NC(=O)C(C)(C)c1cc(F)cc(C#N)c1	ZINC000285250718	267154808	/nfs/dbraw/zinc/15/48/08/267154808.db2.gz	ZSLZGQNQJXOUKM-LSDHHAIUSA-N	0	3	345.462	3.212	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)NCCN1CCCC(C)(C)C1	ZINC000445242820	267166710	/nfs/dbraw/zinc/16/67/10/267166710.db2.gz	VECQVYHDODGCDZ-UHFFFAOYSA-N	0	3	344.459	3.200	20	30		EGEDHN
CC[C@@H](NC1CCC(Oc2ncccc2C#N)CC1)c1ccn(C)n1	ZINC000437086740	267193488	/nfs/dbraw/zinc/19/34/88/267193488.db2.gz	LPFVDCUAPQTFRD-OFLPRAFFSA-N	0	3	339.443	3.118	20	30		EGEDHN
CC[C@@H]1CCC[C@H]1C(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000448816194	267202232	/nfs/dbraw/zinc/20/22/32/267202232.db2.gz	NDONCXHRVBYVKL-RTBURBONSA-N	0	3	327.472	3.275	20	30		EGEDHN
C[C@]1(NCc2ccc(C#N)cc2Br)CCO[C@H]1C1CC1	ZINC000273097788	267263823	/nfs/dbraw/zinc/26/38/23/267263823.db2.gz	UXXRPFIPVLUTDV-HOTGVXAUSA-N	0	3	335.245	3.368	20	30		EGEDHN
CN(C)[C@H](CNC(=O)C1(c2cccc(C#N)c2)CC1)c1ccccc1	ZINC000435032415	267289001	/nfs/dbraw/zinc/28/90/01/267289001.db2.gz	FOISPTRPVIBXCP-LJQANCHMSA-N	0	3	333.435	3.009	20	30		EGEDHN
CN(CCC(=O)Nc1ccc(C#N)cc1)Cc1cc(C(C)(C)C)[nH]n1	ZINC000447404090	267303869	/nfs/dbraw/zinc/30/38/69/267303869.db2.gz	IGFVHDDVTBCRBG-UHFFFAOYSA-N	0	3	339.443	3.039	20	30		EGEDHN
CN(Cc1ccc(C#N)cn1)[C@@H]1CCO[C@H](c2ccc(F)cc2)C1	ZINC000514870512	267314205	/nfs/dbraw/zinc/31/42/05/267314205.db2.gz	LPDFTCINZDQVFW-MOPGFXCFSA-N	0	3	325.387	3.444	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C1CCN(CCC(F)(F)F)CC1	ZINC000449786941	267315476	/nfs/dbraw/zinc/31/54/76/267315476.db2.gz	RHYDQIRDJQLAAO-UHFFFAOYSA-N	0	3	331.407	3.468	20	30		EGEDHN
CN(Cc1cccc(F)c1C#N)CC1CCN(c2ccncc2)CC1	ZINC000428302740	267319366	/nfs/dbraw/zinc/31/93/66/267319366.db2.gz	NMGYVPVFLCERLI-UHFFFAOYSA-N	0	3	338.430	3.441	20	30		EGEDHN
Cc1cc(F)cc2c1CN(C(=O)C(C#N)Cc1ccc(C#N)cc1)CC2	ZINC000337237294	267327614	/nfs/dbraw/zinc/32/76/14/267327614.db2.gz	CARHQGCMUIQFMP-GOSISDBHSA-N	0	3	347.393	3.273	20	30		EGEDHN
Cc1cc(N2CCN(CC3CC3)CC2)n2c3ccccc3nc2c1C#N	ZINC000301117531	267338974	/nfs/dbraw/zinc/33/89/74/267338974.db2.gz	YCRHQSIBDLYXIP-UHFFFAOYSA-N	0	3	345.450	3.200	20	30		EGEDHN
CN(C)CCc1ccccc1NC(=O)N(C)Cc1cccc(C#N)c1	ZINC000275656428	267401813	/nfs/dbraw/zinc/40/18/13/267401813.db2.gz	NQQJGBQAOMALBZ-UHFFFAOYSA-N	0	3	336.439	3.326	20	30		EGEDHN
Cc1[nH]c(C#N)cc1C(=O)N(CCN(C)C)Cc1cccc(Cl)c1	ZINC000448815784	267917298	/nfs/dbraw/zinc/91/72/98/267917298.db2.gz	INOBKPFDUOYTBD-UHFFFAOYSA-N	0	3	344.846	3.052	20	30		EGEDHN
Cc1cc(NC(=O)Cc2c(F)cccc2C#N)ccc1CN(C)C	ZINC000458266761	268006597	/nfs/dbraw/zinc/00/65/97/268006597.db2.gz	OJDCNARWYCCLEJ-UHFFFAOYSA-N	0	3	325.387	3.249	20	30		EGEDHN
Cc1ccc([C@@H](CNC(=O)CCc2ccc(C#N)cc2)N(C)C)cc1	ZINC000499142601	268044310	/nfs/dbraw/zinc/04/43/10/268044310.db2.gz	GGOQGWNKJVQNFH-HXUWFJFHSA-N	0	3	335.451	3.218	20	30		EGEDHN
Cc1cccc(C)c1OCCN1CC[C@H](Oc2ccc(C#N)cn2)C1	ZINC000428821870	268051264	/nfs/dbraw/zinc/05/12/64/268051264.db2.gz	VIEWRPLUMDBRJZ-SFHVURJKSA-N	0	3	337.423	3.102	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCCSc2ccccc2)cc1	ZINC000347982929	268084774	/nfs/dbraw/zinc/08/47/74/268084774.db2.gz	FUANANZUUGJKSV-KRWDZBQOSA-N	0	3	335.432	3.149	20	30		EGEDHN
N#Cc1ccc(Cl)cc1NC[C@@H]1C[C@@H](O)CN1Cc1ccccc1	ZINC000301879336	268101874	/nfs/dbraw/zinc/10/18/74/268101874.db2.gz	OSHKAZVEQCYVAP-ZWKOTPCHSA-N	0	3	341.842	3.259	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3C[C@H](O)CC[C@@H]3C2)c(OC(F)F)c1	ZINC000451692699	268222688	/nfs/dbraw/zinc/22/26/88/268222688.db2.gz	GELSLJXBWHGGLX-IIAWOOMASA-N	0	3	336.382	3.143	20	30		EGEDHN
N#Cc1ccc([C@H](NC[C@H]2CCC[C@H](C(F)(F)F)C2)C(N)=O)cc1	ZINC000437155644	268263364	/nfs/dbraw/zinc/26/33/64/268263364.db2.gz	PWTYYXNGTAUFNU-QEJZJMRPSA-N	0	3	339.361	3.043	20	30		EGEDHN
N#Cc1ccccc1NC(=O)CCN1CCCN(c2ccccc2)CC1	ZINC000298786599	268278459	/nfs/dbraw/zinc/27/84/59/268278459.db2.gz	OKGDWZWCRACMSJ-UHFFFAOYSA-N	0	3	348.450	3.099	20	30		EGEDHN
N#Cc1cccc([N+](=O)[O-])c1NCC1CCN(c2ccncc2)CC1	ZINC000425251291	268293236	/nfs/dbraw/zinc/29/32/36/268293236.db2.gz	XFBKOBFJVAUCMO-UHFFFAOYSA-N	0	3	337.383	3.190	20	30		EGEDHN
N#Cc1ccnc(SC[C@H]2CN(Cc3ccccc3)CCCO2)c1	ZINC000278586046	268299808	/nfs/dbraw/zinc/29/98/08/268299808.db2.gz	PIMKNTXYYPOLIG-GOSISDBHSA-N	0	3	339.464	3.336	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CN[C@H]1CCCc2ccc(F)cc21	ZINC000530233829	268304661	/nfs/dbraw/zinc/30/46/61/268304661.db2.gz	IIMFYPJABZGRRS-MJGOQNOKSA-N	0	3	340.398	3.104	20	30		EGEDHN
N#Cc1nccnc1N1CCN(Cc2ccccc2)C2(CCCCC2)C1	ZINC000301542750	268332229	/nfs/dbraw/zinc/33/22/29/268332229.db2.gz	CWECAGDAJJVFRX-UHFFFAOYSA-N	0	3	347.466	3.373	20	30		EGEDHN
CCCO[C@H]1CCCN(C(=O)C(C#N)Cc2ccc(C#N)cc2)CC1	ZINC000280555308	269654222	/nfs/dbraw/zinc/65/42/22/269654222.db2.gz	UOINVWVQZSDYGR-OALUTQOASA-N	0	3	339.439	3.048	20	30		EGEDHN
CS(=O)(=O)C1(CN[C@H]2CCCCc3cc(C#N)ccc32)CCCC1	ZINC000353948610	278104135	/nfs/dbraw/zinc/10/41/35/278104135.db2.gz	VZDBPRHGNLCDEH-SFHVURJKSA-N	0	3	346.496	3.273	20	30		EGEDHN
C[C@H](CNC(=O)C(C)(C)Oc1ccc(C#N)cc1)N1CCCC[C@@H]1C	ZINC000360073261	279326618	/nfs/dbraw/zinc/32/66/18/279326618.db2.gz	UXDAGOWYTGDPFP-JKSUJKDBSA-N	0	3	343.471	3.095	20	30		EGEDHN
CN(C)CCN(C(=O)c1c(F)cc(C#N)cc1F)c1ccccc1	ZINC000129257417	307612118	/nfs/dbraw/zinc/61/21/18/307612118.db2.gz	PIIUKIGBTDPASE-UHFFFAOYSA-N	0	3	329.350	3.045	20	30		EGEDHN
CN(C)CCOc1ccc(NC(=O)c2ccc(C#N)c(Cl)c2)cc1	ZINC000155117172	307807815	/nfs/dbraw/zinc/80/78/15/307807815.db2.gz	QQBRURYTTWKSRB-UHFFFAOYSA-N	0	3	343.814	3.404	20	30		EGEDHN
CN(C)Cc1ccccc1CNC(=O)c1ccc(C#N)c(Cl)c1	ZINC000159566888	307876004	/nfs/dbraw/zinc/87/60/04/307876004.db2.gz	XXOQEYSBSIGDGI-UHFFFAOYSA-N	0	3	327.815	3.203	20	30		EGEDHN
Cc1nccnc1[C@H](C)N[C@@H]1CCCN(c2ccc(C#N)cc2F)C1	ZINC000364735188	308897814	/nfs/dbraw/zinc/89/78/14/308897814.db2.gz	CZGCRGLRUSHCGD-GOEBONIOSA-N	0	3	339.418	3.115	20	30		EGEDHN
Cc1cc(N(CCN(C)C)Cc2ccc(C#N)cc2)ccc1[N+](=O)[O-]	ZINC000536639680	314133332	/nfs/dbraw/zinc/13/33/32/314133332.db2.gz	VFPDRAFVRAMIDV-UHFFFAOYSA-N	0	3	338.411	3.343	20	30		EGEDHN
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NCc1ccc(C#N)cc1F	ZINC000551721732	315165422	/nfs/dbraw/zinc/16/54/22/315165422.db2.gz	GHTHJDYDISDLKE-KDOFPFPSSA-N	0	3	340.398	3.207	20	30		EGEDHN
CN(C)Cc1ccccc1NC(=O)CSc1ccc(C#N)cc1	ZINC000560327702	315674365	/nfs/dbraw/zinc/67/43/65/315674365.db2.gz	HXKSROBAPJPVEM-UHFFFAOYSA-N	0	3	325.437	3.351	20	30		EGEDHN
N#Cc1cccc(CNC[C@H](O)CO[C@@H]2CCCc3ccccc32)c1	ZINC000564844045	316215518	/nfs/dbraw/zinc/21/55/18/316215518.db2.gz	HSYFGJOMYNUCLZ-PZJWPPBQSA-N	0	3	336.435	3.103	20	30		EGEDHN
N#Cc1cccc(C2(NC[C@H]3CN(c4ccccc4)CCO3)CC2)c1	ZINC000565154515	316275788	/nfs/dbraw/zinc/27/57/88/316275788.db2.gz	BHEUQXWZTDMHQF-FQEVSTJZSA-N	0	3	333.435	3.042	20	30		EGEDHN
CCN(C[C@H]1CCCN1CC)C(=O)C(C)(C)c1cc(F)cc(C#N)c1	ZINC000571789979	317248043	/nfs/dbraw/zinc/24/80/43/317248043.db2.gz	ZHFAWIFFXJUYLZ-GOSISDBHSA-N	0	3	345.462	3.308	20	30		EGEDHN
N#Cc1ccc(N2CCN(CCCc3ccc(Cl)cc3)CC2)nc1	ZINC000574680645	317625245	/nfs/dbraw/zinc/62/52/45/317625245.db2.gz	DFLPHYFOXLINHG-UHFFFAOYSA-N	0	3	340.858	3.361	20	30		EGEDHN
C=CCNC(=O)CN[C@H](C)[C@H](C)Oc1ccc(Cl)cc1Cl	ZINC000180029029	455118379	/nfs/dbraw/zinc/11/83/79/455118379.db2.gz	RGJSCGLKNBTTLQ-MNOVXSKESA-N	0	3	331.243	3.041	20	30		EGEDHN
N#C[C@H]1CCC[C@@H](NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000295027587	455835437	/nfs/dbraw/zinc/83/54/37/455835437.db2.gz	OEZXVADJJAGPNP-DZGCQCFKSA-N	0	3	340.876	3.176	20	30		EGEDHN
N#Cc1ccc(S(=O)(=O)CCN[C@@H]2CC[C@H]3CCCC[C@@H]3C2)cc1	ZINC000579303503	325089586	/nfs/dbraw/zinc/08/95/86/325089586.db2.gz	KVFNRXIYWLPAQA-KZNAEPCWSA-N	0	3	346.496	3.280	20	30		EGEDHN
N#Cc1ccc([C@H](N[C@@H]2CC[C@H](c3ccc(F)cc3)C2)C(N)=O)cc1	ZINC000580987022	325317281	/nfs/dbraw/zinc/31/72/81/325317281.db2.gz	BQSBMUIDSKDECO-UHOSZYNNSA-N	0	3	337.398	3.150	20	30		EGEDHN
C[C@H](C#N)CSc1ccccc1NC(=O)NC1CCN(C)CC1	ZINC000264502524	455225256	/nfs/dbraw/zinc/22/52/56/455225256.db2.gz	CUBKWTYHTMOJRH-CYBMUJFWSA-N	0	3	332.473	3.154	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCSc2ccc(F)cc2)CC1	ZINC000264507901	455226470	/nfs/dbraw/zinc/22/64/70/455226470.db2.gz	SFAKZMQKDSWHND-UHFFFAOYSA-N	0	3	336.476	3.465	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H]2CC[C@@H](Cc3ccccc3)C2)CC1	ZINC000189887512	455250572	/nfs/dbraw/zinc/25/05/72/455250572.db2.gz	NPNDFZKBHRJBQX-ICSRJNTNSA-N	0	3	341.499	3.347	20	30		EGEDHN
N#CCN1CCC(NCc2ccc(-c3cccc(F)c3F)o2)CC1	ZINC000616473425	460565555	/nfs/dbraw/zinc/56/55/55/460565555.db2.gz	BBGMHNNNBRDZHG-UHFFFAOYSA-N	0	3	331.366	3.302	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@@H]2C[C@@H](O)C2(C)C)cc1OC	ZINC000623496764	460581149	/nfs/dbraw/zinc/58/11/49/460581149.db2.gz	JLXOAFWJMGRSGE-HUUCEWRRSA-N	0	3	325.836	3.162	20	30		EGEDHN
Cc1cc(CNC[C@H](O)COc2ccccc2C#N)ccc1Cl	ZINC000600738134	460585547	/nfs/dbraw/zinc/58/55/47/460585547.db2.gz	YLPLDHLLOMSUSK-INIZCTEOSA-N	0	3	330.815	3.050	20	30		EGEDHN
CCCN(C(=O)NCCCC#N)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000612380534	460612413	/nfs/dbraw/zinc/61/24/13/460612413.db2.gz	YQPMMAGKZWOXDO-IBGZPJMESA-N	0	3	342.487	3.376	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(OC)c(OC(C)C)c2)CC1	ZINC000184224804	455363362	/nfs/dbraw/zinc/36/33/62/455363362.db2.gz	XDWANHBHZXPXDK-UHFFFAOYSA-N	0	3	347.459	3.254	20	30		EGEDHN
CCOc1ccc(OC[C@H](O)CN[C@@H](C)c2ccc(C#N)cc2)cc1	ZINC000030532885	453836378	/nfs/dbraw/zinc/83/63/78/453836378.db2.gz	RNGRSADPFMJMPU-MAUKXSAKSA-N	0	3	340.423	3.047	20	30		EGEDHN
CCOc1ccc(OC[C@@H](O)CN[C@H](C)c2ccc(C#N)cc2)cc1	ZINC000030532887	453836443	/nfs/dbraw/zinc/83/64/43/453836443.db2.gz	RNGRSADPFMJMPU-QAPCUYQASA-N	0	3	340.423	3.047	20	30		EGEDHN
C[C@@H]1C[C@@H]1c1ccc(CNC2CCN(c3ccc(C#N)cn3)CC2)o1	ZINC000067011020	453893770	/nfs/dbraw/zinc/89/37/70/453893770.db2.gz	CWOMLGRSMVEOKJ-KDOFPFPSSA-N	0	3	336.439	3.428	20	30		EGEDHN
CN(C)CCOc1ccc(CNc2ccc(Cl)c(C#N)n2)cc1	ZINC000067368415	453925822	/nfs/dbraw/zinc/92/58/22/453925822.db2.gz	BXFHLQPBQSBIBU-UHFFFAOYSA-N	0	3	330.819	3.159	20	30		EGEDHN
FC(F)(F)c1ccc(C#CCN2CCC(c3nc[nH]n3)CC2)cc1	ZINC000083444399	453949022	/nfs/dbraw/zinc/94/90/22/453949022.db2.gz	TWFOMHFEDDIOBC-UHFFFAOYSA-N	0	3	334.345	3.055	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccc(OC(F)(F)F)cc2)nc(C)n1	ZINC000041574091	453972955	/nfs/dbraw/zinc/97/29/55/453972955.db2.gz	HZWRAXAPDFJFPD-CYBMUJFWSA-N	0	3	335.285	3.482	20	30		EGEDHN
Cc1ccccc1CN1CCC(NC(=O)c2cccc(C#N)c2)CC1	ZINC000042127185	453996212	/nfs/dbraw/zinc/99/62/12/453996212.db2.gz	NJTAWFOXMKGFNY-UHFFFAOYSA-N	0	3	333.435	3.261	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2CCC[C@@H]2CN2CCCCC2)cc1	ZINC000068133201	454000236	/nfs/dbraw/zinc/00/02/36/454000236.db2.gz	LVYGWNLGGJXPRX-GOSISDBHSA-N	0	3	328.456	3.342	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCC(C)(C)c2ccc(C)cn2)CC1	ZINC000623578940	460622765	/nfs/dbraw/zinc/62/27/65/460622765.db2.gz	FXKYYRLGEFXEPZ-UHFFFAOYSA-N	0	3	344.503	3.007	20	30		EGEDHN
CCN(CCOc1ccc(C#N)cc1OC)Cc1ccc(OC)cc1	ZINC000077266919	454083491	/nfs/dbraw/zinc/08/34/91/454083491.db2.gz	JQWNBYQVOHMYDS-UHFFFAOYSA-N	0	3	340.423	3.476	20	30		EGEDHN
C#CCN1CCC(C(=O)NCC2(c3ccc(F)cc3)CCCC2)CC1	ZINC000057172678	454108936	/nfs/dbraw/zinc/10/89/36/454108936.db2.gz	CXKSDTGIASIGKC-UHFFFAOYSA-N	0	3	342.458	3.099	20	30		EGEDHN
CN(C)Cc1cccc(CNC(=O)c2ccc(C#N)c(Cl)c2)c1	ZINC000159983664	455420302	/nfs/dbraw/zinc/42/03/02/455420302.db2.gz	SECMFYLCAMDSBX-UHFFFAOYSA-N	0	3	327.815	3.203	20	30		EGEDHN
N#Cc1ccc(C(=O)NC[C@@H]2CCCN(Cc3cccs3)C2)cc1	ZINC000058267185	454176046	/nfs/dbraw/zinc/17/60/46/454176046.db2.gz	XQAFFXBCGYBXKL-INIZCTEOSA-N	0	3	339.464	3.262	20	30		EGEDHN
CCc1ccc([C@@H](NCC(=O)N(CCC#N)CCC#N)C(C)C)cc1	ZINC000071122717	454200451	/nfs/dbraw/zinc/20/04/51/454200451.db2.gz	ZYYHZIZWRJIYBO-FQEVSTJZSA-N	0	3	340.471	3.192	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(C3CCCCC3)n[nH]2)CC1	ZINC000130897556	454224899	/nfs/dbraw/zinc/22/48/99/454224899.db2.gz	TXFSMACLJYXDBQ-UHFFFAOYSA-N	0	3	330.476	3.228	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)c1c(F)cc(C#N)cc1F)N1CCC(C)CC1	ZINC000119837805	454225531	/nfs/dbraw/zinc/22/55/31/454225531.db2.gz	UUPKIFMZJZGTJT-QGZVFWFLSA-N	0	3	349.425	3.323	20	30		EGEDHN
C=C(C)CN(CC)C[C@H](O)COc1ccc(Br)cc1	ZINC000046342167	454243141	/nfs/dbraw/zinc/24/31/41/454243141.db2.gz	RTKRDMUNKNFDIX-AWEZNQCLSA-N	0	3	328.250	3.087	20	30		EGEDHN
N#Cc1ccc(OCCNC2(c3ccc(F)cc3)CCOCC2)cc1	ZINC000071886832	454243658	/nfs/dbraw/zinc/24/36/58/454243658.db2.gz	KKQIRISFXDBEJX-UHFFFAOYSA-N	0	3	340.398	3.372	20	30		EGEDHN
N#CCc1ccccc1C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000600889970	460630221	/nfs/dbraw/zinc/63/02/21/460630221.db2.gz	POQIENDYJSHBRP-UHFFFAOYSA-N	0	3	333.435	3.147	20	30		EGEDHN
N#Cc1cccc(NC(=O)C2CCN(CCOc3ccccc3)CC2)c1	ZINC000060330085	454277684	/nfs/dbraw/zinc/27/76/84/454277684.db2.gz	BOPCCFGBLCMNRW-UHFFFAOYSA-N	0	3	349.434	3.288	20	30		EGEDHN
C[C@@H](C(=O)N(C)C1(C#N)CCC(C)CC1)N(C)CCC1CCOCC1	ZINC000120669713	454333017	/nfs/dbraw/zinc/33/30/17/454333017.db2.gz	ZJYIYSRZXREFNW-GNZRSQJKSA-N	0	3	349.519	3.054	20	30		EGEDHN
C[C@@H]1CN(CCC(=O)Nc2ccc(C#N)c(Cl)c2)C[C@H](C)S1	ZINC000072768853	454337470	/nfs/dbraw/zinc/33/74/70/454337470.db2.gz	SCMSXTUUBPRRNY-TXEJJXNPSA-N	0	3	337.876	3.366	20	30		EGEDHN
C[C@@H](N[C@H]1CC(C)(C)OC1(C)C)C(=O)N(CCC#N)c1ccccc1	ZINC000132492387	454344218	/nfs/dbraw/zinc/34/42/18/454344218.db2.gz	ZRSGEANPVOLRPU-WBVHZDCISA-N	0	3	343.471	3.257	20	30		EGEDHN
N#Cc1cccc(CNC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)c1	ZINC000061915208	454363255	/nfs/dbraw/zinc/36/32/55/454363255.db2.gz	CHRDNDAKKXMKQC-FQEVSTJZSA-N	0	3	348.450	3.022	20	30		EGEDHN
Cc1ccc(NC(=O)Nc2ccc(C#N)cc2)c(OCCN(C)C)c1	ZINC000121367128	454426151	/nfs/dbraw/zinc/42/61/51/454426151.db2.gz	RDBTUWOXLJYDLN-UHFFFAOYSA-N	0	3	338.411	3.451	20	30		EGEDHN
COCCN(CCOc1ccccc1F)Cc1ccc(C#N)cc1	ZINC000063754436	454445165	/nfs/dbraw/zinc/44/51/65/454445165.db2.gz	SJJRHWGPJABGGH-UHFFFAOYSA-N	0	3	328.387	3.225	20	30		EGEDHN
C=CCN(Cc1ccccc1F)C(=O)N[C@@H](C)CN1CCCCC1	ZINC000079610563	454449988	/nfs/dbraw/zinc/44/99/88/454449988.db2.gz	ZSKBTMSPWORQOL-INIZCTEOSA-N	0	3	333.451	3.398	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN(C)Cc1ccc(C#N)cc1	ZINC000073649446	454462989	/nfs/dbraw/zinc/46/29/89/454462989.db2.gz	KFGPZUVAPLYHLA-HXUWFJFHSA-N	0	3	336.435	3.158	20	30		EGEDHN
COc1ccc(C#N)cc1NC(=O)c1cccc(CN2CCCC2)c1	ZINC000064533403	454489621	/nfs/dbraw/zinc/48/96/21/454489621.db2.gz	BLDOULQRWXGWTN-UHFFFAOYSA-N	0	3	335.407	3.415	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)CNC1(c2ccccc2)CCCCC1	ZINC000134032701	454494966	/nfs/dbraw/zinc/49/49/66/454494966.db2.gz	GMJMJQQYFSUOFW-LJQANCHMSA-N	0	3	327.472	3.490	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(CNCc3ccc(C#N)cc3)cc2)C[C@@H](C)O1	ZINC000048710002	454509691	/nfs/dbraw/zinc/50/96/91/454509691.db2.gz	YVYMFYUFTIMUJE-QZTJIDSGSA-N	0	3	349.478	3.457	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cccc(-c3csc(C)n3)c2)CC1	ZINC000080079588	454529132	/nfs/dbraw/zinc/52/91/32/454529132.db2.gz	WYKVZCLAAGVVBV-UHFFFAOYSA-N	0	3	341.480	3.499	20	30		EGEDHN
C[C@H]1CN(CC2CCN(Cc3ccc(F)cc3C#N)CC2)C[C@H](C)O1	ZINC000103142421	454540011	/nfs/dbraw/zinc/54/00/11/454540011.db2.gz	APHSXHWQBNXDFV-HOTGVXAUSA-N	0	3	345.462	3.019	20	30		EGEDHN
N#CCc1ccc(NC(=O)N2CCN(CC3CCCCC3)CC2)cc1	ZINC000065359340	454554329	/nfs/dbraw/zinc/55/43/29/454554329.db2.gz	NSDVDIYWSKMZFA-UHFFFAOYSA-N	0	3	340.471	3.482	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc3oc(C(C)C)nc3c2)CC1	ZINC000050029961	454569110	/nfs/dbraw/zinc/56/91/10/454569110.db2.gz	AVYQLFAXIJTQQS-UHFFFAOYSA-N	0	3	325.412	3.235	20	30		EGEDHN
O=C(C#Cc1ccccc1)NCC1CCN(Cc2cccs2)CC1	ZINC000080610576	454606222	/nfs/dbraw/zinc/60/62/22/454606222.db2.gz	YYQQHTPBSUYVOP-UHFFFAOYSA-N	0	3	338.476	3.128	20	30		EGEDHN
CC(C)CCSCC(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000065930194	454641242	/nfs/dbraw/zinc/64/12/42/454641242.db2.gz	WDIJVAOIHJLSSO-UHFFFAOYSA-N	0	3	347.528	3.228	20	30		EGEDHN
CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1cccc(C#N)c1	ZINC000065938096	454641976	/nfs/dbraw/zinc/64/19/76/454641976.db2.gz	HHZKENRQRPUCAJ-UHFFFAOYSA-N	0	3	343.377	3.040	20	30		EGEDHN
N#Cc1ccsc1C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000052050529	454651537	/nfs/dbraw/zinc/65/15/37/454651537.db2.gz	IQASJVSQIOXFJC-MRXNPFEDSA-N	0	3	339.464	3.262	20	30		EGEDHN
C=CCCOCC(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000606310180	460646723	/nfs/dbraw/zinc/64/67/23/460646723.db2.gz	KYTRLLQYARRAGD-HKUYNNGSSA-N	0	3	330.472	3.091	20	30		EGEDHN
COc1cc(CN(C)CCCSCC#N)ccc1OC(F)F	ZINC000074981375	454669107	/nfs/dbraw/zinc/66/91/07/454669107.db2.gz	YSGJCKDSQUCQHN-UHFFFAOYSA-N	0	3	330.400	3.375	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(-c3ccccc3F)on2)CC1	ZINC000106037658	454675195	/nfs/dbraw/zinc/67/51/95/454675195.db2.gz	NWMBHZLUDKTYLB-UHFFFAOYSA-N	0	3	343.402	3.251	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](CC)c2c(C)noc2C)CC1	ZINC000123851895	454682274	/nfs/dbraw/zinc/68/22/74/454682274.db2.gz	NTQIDBKEQVMPPQ-MRXNPFEDSA-N	0	3	334.464	3.082	20	30		EGEDHN
C#CCOc1ccc(CN2CCC(OC[C@H]3CCCCO3)CC2)cc1	ZINC000093842315	454738870	/nfs/dbraw/zinc/73/88/70/454738870.db2.gz	BUZNWOSBSYJJJJ-OAQYLSRUSA-N	0	3	343.467	3.249	20	30		EGEDHN
C=CCOc1ccc(CN2CC[C@@H](Cc3cnn(C)c3)C2)cc1OC	ZINC000093870298	454742753	/nfs/dbraw/zinc/74/27/53/454742753.db2.gz	QOHGUOMBJHPIRL-KRWDZBQOSA-N	0	3	341.455	3.058	20	30		EGEDHN
CCOC(=O)CC[C@H]1CCCN(Cc2cc(C#N)ccc2OC)C1	ZINC000162096511	454751314	/nfs/dbraw/zinc/75/13/14/454751314.db2.gz	LHBHTWQXALJSIA-OAHLLOKOSA-N	0	3	330.428	3.122	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2C[C@H](C)[C@H]2c2ccccc2)CC1	ZINC000176498516	454752592	/nfs/dbraw/zinc/75/25/92/454752592.db2.gz	WAQZAUZOJXQMLT-LPHOPBHVSA-N	0	3	327.472	3.430	20	30		EGEDHN
N#Cc1ccc(NC(=O)N2CCC(N3CC=CC3)CC2)cc1Cl	ZINC000136726560	454753793	/nfs/dbraw/zinc/75/37/93/454753793.db2.gz	WTQLSORYECSXMF-UHFFFAOYSA-N	0	3	330.819	3.080	20	30		EGEDHN
CCN1CCN([C@@H](C)CNc2ccc(C(F)(F)F)c(C#N)c2)CC1	ZINC000136933580	454762110	/nfs/dbraw/zinc/76/21/10/454762110.db2.gz	WSJCCLMEEZUZMF-ZDUSSCGKSA-N	0	3	340.393	3.015	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(CCC(F)(F)F)cc2)CC1	ZINC000177441172	454864238	/nfs/dbraw/zinc/86/42/38/454864238.db2.gz	NZTFXTKBSUUBFG-UHFFFAOYSA-N	0	3	338.373	3.465	20	30		EGEDHN
C[C@H](CNC(=O)Nc1ccc(CC#N)cc1)N(C)Cc1ccccc1	ZINC000111715163	454873246	/nfs/dbraw/zinc/87/32/46/454873246.db2.gz	XKQUGZSTTSMHNL-MRXNPFEDSA-N	0	3	336.439	3.395	20	30		EGEDHN
C=CC1CCN(C(=O)NC[C@H](c2ccccc2)N2CCCC2)CC1	ZINC000111789673	454875978	/nfs/dbraw/zinc/87/59/78/454875978.db2.gz	QBQKAXXOQAQMSS-LJQANCHMSA-N	0	3	327.472	3.431	20	30		EGEDHN
Cc1ccc(Cl)cc1C(=O)C(C#N)c1nnc2n1CCCCC2	ZINC000126305736	454884300	/nfs/dbraw/zinc/88/43/00/454884300.db2.gz	XCXJXJPGYKDOOT-CQSZACIVSA-N	0	3	328.803	3.456	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cccc(C)c1[N+](=O)[O-])C(C)C	ZINC000112919902	454905815	/nfs/dbraw/zinc/90/58/15/454905815.db2.gz	JWPHCQNGEXMMKT-KRWDZBQOSA-N	0	3	345.443	3.332	20	30		EGEDHN
C[C@@H](NCC(=O)N(CCC#N)CCC#N)c1cccc2ccccc21	ZINC000126665322	454909474	/nfs/dbraw/zinc/90/94/74/454909474.db2.gz	IFIUDXZUFIVOPP-MRXNPFEDSA-N	0	3	334.423	3.146	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1Nc1ccc([N+](=O)[O-])c(C#N)c1	ZINC000167522680	454921287	/nfs/dbraw/zinc/92/12/87/454921287.db2.gz	OKWOWJARLKPTIY-KDOFPFPSSA-N	0	3	336.395	3.399	20	30		EGEDHN
CC[S@@](=O)[C@@H]1CCC[C@H](NC2CC(C#N)(c3ccccc3)C2)C1	ZINC000127543769	454975027	/nfs/dbraw/zinc/97/50/27/454975027.db2.gz	DUSQDIZEOHFUDQ-KTRQDESSSA-N	0	3	330.497	3.280	20	30		EGEDHN
C=CC[C@@H](C)NC(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000116951211	455075637	/nfs/dbraw/zinc/07/56/37/455075637.db2.gz	LRUWBWRBZASUBY-MRXNPFEDSA-N	0	3	345.487	3.171	20	30		EGEDHN
CC(C)(CCC#N)CN1CCC(n2c3ccccc3[nH]c2=O)CC1	ZINC000179783394	455078521	/nfs/dbraw/zinc/07/85/21/455078521.db2.gz	SIVWWJYCZVCMML-UHFFFAOYSA-N	0	3	326.444	3.296	20	30		EGEDHN
C=C(C)COc1cc(CN2CCC[C@H]2CC(=O)OC)ccc1OC	ZINC000179897072	455096186	/nfs/dbraw/zinc/09/61/86/455096186.db2.gz	FUOGMRPASIDVSR-INIZCTEOSA-N	0	3	333.428	3.178	20	30		EGEDHN
C=CC1CCN(C(=O)NC2CCN(CCc3ccccc3)CC2)CC1	ZINC000171830996	455096830	/nfs/dbraw/zinc/09/68/30/455096830.db2.gz	LFYBVQKUIPVOSR-UHFFFAOYSA-N	0	3	341.499	3.301	20	30		EGEDHN
COc1cc(CN(C)Cc2ccc(N(C)CCC#N)cc2)ccc1O	ZINC000179944640	455103136	/nfs/dbraw/zinc/10/31/36/455103136.db2.gz	JJVYMWPYXVBEBM-UHFFFAOYSA-N	0	3	339.439	3.383	20	30		EGEDHN
C=CC[C@@H](C)NC(=O)NC[C@H](c1ccc(OC)cc1)N1CCCC1	ZINC000172077966	455118355	/nfs/dbraw/zinc/11/83/55/455118355.db2.gz	NSRWQYBDQOPXSV-CRAIPNDOSA-N	0	3	331.460	3.096	20	30		EGEDHN
Cc1cccc(OCCNCc2cn(C)nc2-c2ccc(C#N)cc2)c1	ZINC000180033001	455119195	/nfs/dbraw/zinc/11/91/95/455119195.db2.gz	COAKFFQMIRATIL-UHFFFAOYSA-N	0	3	346.434	3.436	20	30		EGEDHN
CC[C@@H](N[C@H](C)C(=O)NC1(C#N)CCCCC1)c1ccc(OC)cc1	ZINC000157030019	455161876	/nfs/dbraw/zinc/16/18/76/455161876.db2.gz	QLCLWSRJGHHWQT-CRAIPNDOSA-N	0	3	343.471	3.467	20	30		EGEDHN
C=CCN(CCc1ccccc1)C(=O)NC1CCN(CC(=C)C)CC1	ZINC000264364726	455198778	/nfs/dbraw/zinc/19/87/78/455198778.db2.gz	HPTKBQQLBIXBMZ-UHFFFAOYSA-N	0	3	341.499	3.467	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](c2ccc(OC)cc2)C2CC2)CC1	ZINC000264428912	455211308	/nfs/dbraw/zinc/21/13/08/455211308.db2.gz	TWMUVQAUZCBTBB-IBGZPJMESA-N	0	3	343.471	3.096	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CC[C@@H](c3ccccc3F)C2)CC1	ZINC000264460771	455217438	/nfs/dbraw/zinc/21/74/38/455217438.db2.gz	RITLLOWHSCBYSC-MRXNPFEDSA-N	0	3	345.462	3.365	20	30		EGEDHN
CC(C)(C)[C@@H](NCC(=O)N[C@](C)(C#N)C1CC1)c1cccc(F)c1	ZINC000181057454	455281488	/nfs/dbraw/zinc/28/14/88/455281488.db2.gz	ANKJQJJBKWOBIA-PKOBYXMFSA-N	0	3	331.435	3.311	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN[C@H](C[C@H]1CCOC1)c1ccccc1	ZINC000181203948	455301472	/nfs/dbraw/zinc/30/14/72/455301472.db2.gz	NUFRKGPWBBRABS-IEBWSBKVSA-N	0	3	330.472	3.169	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN[C@H](C)c1cccc(O)c1	ZINC000181512342	455346949	/nfs/dbraw/zinc/34/69/49/455346949.db2.gz	ZYPPJIXMNPTSGR-BEFAXECRSA-N	0	3	327.424	3.211	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](N[C@@H]3CCCc4ccccc43)C2=O)cc1	ZINC000190616186	455354752	/nfs/dbraw/zinc/35/47/52/455354752.db2.gz	PLAAQQFNPGDTKN-RTWAWAEBSA-N	0	3	345.446	3.326	20	30		EGEDHN
C[C@H](NCC(=O)N(CCC#N)CCC#N)c1cc2ccccc2s1	ZINC000184379313	455375188	/nfs/dbraw/zinc/37/51/88/455375188.db2.gz	VYDFHHNPCHAGJL-AWEZNQCLSA-N	0	3	340.452	3.208	20	30		EGEDHN
C[C@H](N[C@H]1CCN(C(=O)CCc2ccccc2)C1)c1ccc(C#N)cc1	ZINC000181890104	455395337	/nfs/dbraw/zinc/39/53/37/455395337.db2.gz	BCDFSCFBFHPKPH-UWJYYQICSA-N	0	3	347.462	3.443	20	30		EGEDHN
COc1ccc([C@H](CCO)N[C@H](C)c2ccc(OCC#N)cc2)cc1	ZINC000181911512	455399161	/nfs/dbraw/zinc/39/91/61/455399161.db2.gz	RELYYPIBWOGUJT-QRWLVFNGSA-N	0	3	340.423	3.372	20	30		EGEDHN
CC(C)(C)C[C@H](NCCNC(=O)C1N=CC=CC1=O)c1ccccc1	ZINC000181964290	455405980	/nfs/dbraw/zinc/40/59/80/455405980.db2.gz	UNXLDOJYCQXOPL-NXDJFEHLSA-N	0	3	341.455	3.280	20	30		EGEDHN
C[C@H](N[C@H]1C[C@@H](C)N(c2ccccc2)C1=O)c1ccc(OCC#N)cc1	ZINC000181995614	455412239	/nfs/dbraw/zinc/41/22/39/455412239.db2.gz	ZPAQWQFQIDHZHR-GUXCAODWSA-N	0	3	349.434	3.434	20	30		EGEDHN
C[C@@H](NCCOc1ncccc1Cl)c1ccc(OCC#N)cc1	ZINC000182016591	455417484	/nfs/dbraw/zinc/41/74/84/455417484.db2.gz	KFOONQFVBXROIX-CYBMUJFWSA-N	0	3	331.803	3.367	20	30		EGEDHN
CC1CCN([C@@H](CNC(=O)c2ccc(C#N)[nH]2)c2ccccc2)CC1	ZINC000160408368	455455874	/nfs/dbraw/zinc/45/58/74/455455874.db2.gz	TZXZVKKSRHRMJF-IBGZPJMESA-N	0	3	336.439	3.089	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN1CCC[C@H]1c1cc(C)ccc1C	ZINC000246651785	455514104	/nfs/dbraw/zinc/51/41/04/455514104.db2.gz	ZLSILJBGTPZCPG-LPHOPBHVSA-N	0	3	327.472	3.449	20	30		EGEDHN
C=C(C)CN(C)Cc1ccc(Br)cc1N1CCOCC1	ZINC000191781686	455518946	/nfs/dbraw/zinc/51/89/46/455518946.db2.gz	FZZCJEFOSKZTNL-UHFFFAOYSA-N	0	3	339.277	3.294	20	30		EGEDHN
C=CCNC(=O)NC(=O)CN[C@@H](C)c1ccc(Cl)c2ccccc21	ZINC000185395365	455553607	/nfs/dbraw/zinc/55/36/07/455553607.db2.gz	ZPIAIIGEZQRZHC-LBPRGKRZSA-N	0	3	345.830	3.156	20	30		EGEDHN
COc1cc(CNCc2cccc(C#N)c2)ccc1OC(=O)C1CC1	ZINC000182758191	455581812	/nfs/dbraw/zinc/58/18/12/455581812.db2.gz	VTFYDEXJNDRJEV-UHFFFAOYSA-N	0	3	336.391	3.172	20	30		EGEDHN
C=C(C)COc1cc(CNCCNc2ccccn2)ccc1OC	ZINC000268126748	455596220	/nfs/dbraw/zinc/59/62/20/455596220.db2.gz	OBBICZCPKUOQCT-UHFFFAOYSA-N	0	3	327.428	3.247	20	30		EGEDHN
Cc1ccc2c(c1)[C@H]1CN(C)CC[C@H]1N2C(=O)c1ccc(F)c(C#N)c1	ZINC000283812200	455598524	/nfs/dbraw/zinc/59/85/24/455598524.db2.gz	IPPUZPRQAVNTBD-YLJYHZDGSA-N	0	3	349.409	3.454	20	30		EGEDHN
CCOc1cc(N2CCN(C)CC2)ccc1N[C@@H]1CCC[C@@H](C#N)C1	ZINC000185731075	455608969	/nfs/dbraw/zinc/60/89/69/455608969.db2.gz	QNWPVPAVIHETJT-IAGOWNOFSA-N	0	3	342.487	3.331	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN2CCC[C@H]2c2cccs2)cc1	ZINC000247652258	455634241	/nfs/dbraw/zinc/63/42/41/455634241.db2.gz	NSQNREJSIXMHHZ-WBVHZDCISA-N	0	3	328.437	3.197	20	30		EGEDHN
C[C@@H](NCCOc1ccc(C#N)cc1)[C@@H]1OCCc2sccc21	ZINC000292415255	455656555	/nfs/dbraw/zinc/65/65/55/455656555.db2.gz	MJGDHOKOYDLXDP-ACJLOTCBSA-N	0	3	328.437	3.291	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCc3cccc(F)c3[C@@H]2C)CC1	ZINC000606501385	460687169	/nfs/dbraw/zinc/68/71/69/460687169.db2.gz	ZSMGUNYACUSNKT-HNNXBMFYSA-N	0	3	345.462	3.495	20	30		EGEDHN
C[C@@H](NC[C@H]1CN(Cc2ccccc2)CCO1)c1ccc(C#N)cc1	ZINC000271703246	455727798	/nfs/dbraw/zinc/72/77/98/455727798.db2.gz	UJRKOKYPYPHCKE-UTKZUKDTSA-N	0	3	335.451	3.110	20	30		EGEDHN
Cc1ccc(NC(=O)C2CCN(Cc3ccc(C#N)cc3C)CC2)nc1	ZINC000186267829	455730180	/nfs/dbraw/zinc/73/01/80/455730180.db2.gz	BXKFYZVHLQBWJA-UHFFFAOYSA-N	0	3	348.450	3.421	20	30		EGEDHN
CC(C)[C@H](NCCNC(=O)C1N=CC=CC1=O)c1ccc(Cl)cc1	ZINC000271726598	455736229	/nfs/dbraw/zinc/73/62/29/455736229.db2.gz	OMURCLKEBIDHRT-QCPHZMBFSA-N	0	3	347.846	3.153	20	30		EGEDHN
C[C@H](C(=O)N(CCC#N)c1ccc(F)cc1)N1C[C@H](C)C[C@H](C)C1	ZINC000249327261	455749064	/nfs/dbraw/zinc/74/90/64/455749064.db2.gz	OBPDZLYQEOFRFK-OWCLPIDISA-N	0	3	331.435	3.439	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N1CCC[C@@H](CNC(=O)C(C)(C)C)C1	ZINC000249390476	455752620	/nfs/dbraw/zinc/75/26/20/455752620.db2.gz	RIZUFLNELOWTNA-RDJZCZTQSA-N	0	3	327.472	3.494	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(OC(F)F)c(F)c2)CC1	ZINC000293051073	455771998	/nfs/dbraw/zinc/77/19/98/455771998.db2.gz	KRMKTSNDQZVTJX-UHFFFAOYSA-N	0	3	342.361	3.197	20	30		EGEDHN
COCCN(CCN[C@H](C)c1ccc(C#N)cc1)C(=O)OC(C)(C)C	ZINC000271890226	455798610	/nfs/dbraw/zinc/79/86/10/455798610.db2.gz	RSDZQCRAWMEQBC-OAHLLOKOSA-N	0	3	347.459	3.092	20	30		EGEDHN
N#Cc1ccc(NC(=O)N2CC[C@H](N3CCCCC3)C2)c(Cl)c1	ZINC000269158563	455799987	/nfs/dbraw/zinc/79/99/87/455799987.db2.gz	SWGUZQQUCZPJCT-AWEZNQCLSA-N	0	3	332.835	3.304	20	30		EGEDHN
CC[C@@H](N[C@H]1CCCN(Cc2ccccn2)C1=O)c1ccc(C#N)cc1	ZINC000278367269	455830731	/nfs/dbraw/zinc/83/07/31/455830731.db2.gz	BVNBHMVSFYFCFO-UXHICEINSA-N	0	3	348.450	3.185	20	30		EGEDHN
CN(CCc1nc(-c2ccccc2)no1)Cc1ccc(OCC#N)cc1	ZINC000285385900	455833496	/nfs/dbraw/zinc/83/34/96/455833496.db2.gz	AFVHPJRBPVRVLX-UHFFFAOYSA-N	0	3	348.406	3.313	20	30		EGEDHN
CC1(C)[C@H](NCc2ccc(Br)cc2C#N)[C@H]2CCO[C@H]21	ZINC000295094917	455838802	/nfs/dbraw/zinc/83/88/02/455838802.db2.gz	AKQMSVJUTCEBIF-RBSFLKMASA-N	0	3	335.245	3.224	20	30		EGEDHN
N#Cc1cccc(COc2cccc(CN3CCC[C@@H](CO)C3)c2)c1	ZINC000269375732	455845637	/nfs/dbraw/zinc/84/56/37/455845637.db2.gz	VRWIUPOLSNNOKL-HXUWFJFHSA-N	0	3	336.435	3.342	20	30		EGEDHN
CC(C)n1nccc1CN1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC000279576908	455868323	/nfs/dbraw/zinc/86/83/23/455868323.db2.gz	GLMZZDDCISROTN-UHFFFAOYSA-N	0	3	337.471	3.044	20	30		EGEDHN
COCCCOc1ccc(CNCc2ccc(C#N)c(OC)c2)cc1	ZINC000285564623	455871442	/nfs/dbraw/zinc/87/14/42/455871442.db2.gz	NHBIAFOQJJPYRN-UHFFFAOYSA-N	0	3	340.423	3.272	20	30		EGEDHN
CCOC(=O)CCCCN1CCC(Oc2ccc(C#N)cc2F)CC1	ZINC000285598063	455878529	/nfs/dbraw/zinc/87/85/29/455878529.db2.gz	WLAOKVMZXVSEDU-UHFFFAOYSA-N	0	3	348.418	3.274	20	30		EGEDHN
C[C@H](N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O)c1cccc(C#N)c1	ZINC000272255746	455893782	/nfs/dbraw/zinc/89/37/82/455893782.db2.gz	WCPQQVIREOJLHH-MGPUTAFESA-N	0	3	344.418	3.276	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](CCOC)c2ccc(C)o2)CC1	ZINC000272287320	455902411	/nfs/dbraw/zinc/90/24/11/455902411.db2.gz	FHNHMADMMANPPP-KRWDZBQOSA-N	0	3	349.475	3.005	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)c2ccc(CC#N)cc2)N(C)C)cc1	ZINC000270227972	455906680	/nfs/dbraw/zinc/90/66/80/455906680.db2.gz	NWFJAKKRSCPCNG-FQEVSTJZSA-N	0	3	335.451	3.348	20	30		EGEDHN
C=CCN(CCC(=O)Nc1cc(N)ccc1F)CCc1ccco1	ZINC000272306363	455908591	/nfs/dbraw/zinc/90/85/91/455908591.db2.gz	QQCHIQHKCMNEPK-UHFFFAOYSA-N	0	3	331.391	3.060	20	30		EGEDHN
CCc1nc([C@@H](C)NC(=O)C(C#N)Cc2ccc(C#N)cc2)cs1	ZINC000280219570	455919524	/nfs/dbraw/zinc/91/95/24/455919524.db2.gz	AMFOUDZXLHVOCG-IUODEOHRSA-N	0	3	338.436	3.137	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)c1ccc(CC#N)cc1	ZINC000270381753	455943288	/nfs/dbraw/zinc/94/32/88/455943288.db2.gz	PUCXIGOWDJKCQA-LAUBAEHRSA-N	0	3	347.462	3.393	20	30		EGEDHN
C#CC[C@H](NC(=O)N1CC[C@@H](N2CCCCC2)C1)c1ccccc1	ZINC000270403824	455947352	/nfs/dbraw/zinc/94/73/52/455947352.db2.gz	KAWORPDATHNZGS-MOPGFXCFSA-N	0	3	325.456	3.021	20	30		EGEDHN
C#CC[C@@H](NC(=O)N1CC[C@@H](N2CCCCC2)C1)c1ccccc1	ZINC000270403827	455947791	/nfs/dbraw/zinc/94/77/91/455947791.db2.gz	KAWORPDATHNZGS-RTBURBONSA-N	0	3	325.456	3.021	20	30		EGEDHN
CC(C)N1CCN(C2CCN(c3ccc(Cl)cc3C#N)CC2)CC1	ZINC000270441158	455955929	/nfs/dbraw/zinc/95/59/29/455955929.db2.gz	FZILSHWXUPUIDG-UHFFFAOYSA-N	0	3	346.906	3.206	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)CCc2ccccc2C)CC1	ZINC000296614446	455989184	/nfs/dbraw/zinc/98/91/84/455989184.db2.gz	KTSOFTAIAHQRQM-UHFFFAOYSA-N	0	3	329.488	3.219	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NCC(C)(C)N1CCC[C@H](C)C1	ZINC000195612070	455990435	/nfs/dbraw/zinc/99/04/35/455990435.db2.gz	YZGKOTDDMBQUSR-INIZCTEOSA-N	0	3	330.472	3.492	20	30		EGEDHN
CCCO[C@H]1CCCN(C(=O)C(C#N)Cc2ccc(C#N)cc2)CC1	ZINC000280555307	455998632	/nfs/dbraw/zinc/99/86/32/455998632.db2.gz	UOINVWVQZSDYGR-MOPGFXCFSA-N	0	3	339.439	3.048	20	30		EGEDHN
CCCN(CCCCC#N)CC(=O)Nc1ccc(F)c(F)c1F	ZINC000198673436	456010236	/nfs/dbraw/zinc/01/02/36/456010236.db2.gz	ADVOQTKCGBQTGT-UHFFFAOYSA-N	0	3	327.350	3.448	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@H](C)N[C@@H](C)c1ccc(OC)c(OC)c1C	ZINC000286671023	456051095	/nfs/dbraw/zinc/05/10/95/456051095.db2.gz	BNFHJRQGRIIOOX-HOTGVXAUSA-N	0	3	348.487	3.476	20	30		EGEDHN
C[C@@H](NC(=O)Nc1ccc(C(C)(C)C#N)cc1)C1=CCN(C)CC1	ZINC000272759036	456063114	/nfs/dbraw/zinc/06/31/14/456063114.db2.gz	FRSWRUQAOBSETM-CQSZACIVSA-N	0	3	326.444	3.260	20	30		EGEDHN
CN(C)CCN(Cc1cccs1)c1nc(Cl)c(C#N)s1	ZINC000287867230	456080195	/nfs/dbraw/zinc/08/01/95/456080195.db2.gz	NFXQAPLCEAKPRT-UHFFFAOYSA-N	0	3	326.878	3.298	20	30		EGEDHN
CC(C)Oc1ccc([C@@H](CNCc2cc(C#N)n(C)c2)N(C)C)cc1	ZINC000288495009	456097253	/nfs/dbraw/zinc/09/72/53/456097253.db2.gz	RJMUBCNBVFACOW-HXUWFJFHSA-N	0	3	340.471	3.076	20	30		EGEDHN
CN1CCC[C@]2(CCN(C(=O)N[C@H](CCC#N)c3ccccc3)C2)C1	ZINC000297095286	456116923	/nfs/dbraw/zinc/11/69/23/456116923.db2.gz	ADKDADGOXCXJOR-QUCCMNQESA-N	0	3	340.471	3.159	20	30		EGEDHN
CC(C)Oc1ccc(C#N)cc1NC(=O)N[C@@H](C)C1=CCN(C)CC1	ZINC000272981447	456134261	/nfs/dbraw/zinc/13/42/61/456134261.db2.gz	PCCJKBPURCGJPY-AWEZNQCLSA-N	0	3	342.443	3.117	20	30		EGEDHN
C=CCn1c(C)nnc1N(C)[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000289667300	456135412	/nfs/dbraw/zinc/13/54/12/456135412.db2.gz	MNBTXODCZVLBJR-VQIMIIECSA-N	0	3	339.487	3.262	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@](C)(NCc1ccc(C#N)cc1)C1CC1	ZINC000236800797	456185220	/nfs/dbraw/zinc/18/52/20/456185220.db2.gz	PVBJRIOBIRRLBE-IBGZPJMESA-N	0	3	329.444	3.341	20	30		EGEDHN
COc1cc(C#N)ccc1CN1CC[C@@H](C(=O)N(C)c2ccccc2)C1	ZINC000281275792	456186419	/nfs/dbraw/zinc/18/64/19/456186419.db2.gz	VYORKUQGKLKWAA-GOSISDBHSA-N	0	3	349.434	3.052	20	30		EGEDHN
CCN(CC(=O)N(CCC#N)c1ccccc1)[C@@H]1CCOC(C)(C)C1	ZINC000289947062	456191915	/nfs/dbraw/zinc/19/19/15/456191915.db2.gz	VUFMDPDZFKLVFY-GOSISDBHSA-N	0	3	343.471	3.213	20	30		EGEDHN
C=CCc1ccc(OCC(=O)Nc2ccccc2CNC)c(OC)c1	ZINC000237129512	456237896	/nfs/dbraw/zinc/23/78/96/456237896.db2.gz	ITOBAXDCXMCDBF-UHFFFAOYSA-N	0	3	340.423	3.161	20	30		EGEDHN
C=C(C)[C@@H](NC(=O)NC1CCN(CC)CC1)c1ccc(F)c(F)c1	ZINC000274842515	456265888	/nfs/dbraw/zinc/26/58/88/456265888.db2.gz	BNYUBVKLUJVLDX-QGZVFWFLSA-N	0	3	337.414	3.366	20	30		EGEDHN
C=C(C)CCN1CCCN(C(=O)CCc2ccc(OC)cc2)CC1	ZINC000274826016	456266133	/nfs/dbraw/zinc/26/61/33/456266133.db2.gz	ZTEQWSJOCZRKRP-UHFFFAOYSA-N	0	3	330.472	3.128	20	30		EGEDHN
CC[C@H](CN(CC)CC(=O)N(CCC#N)CCC#N)c1ccccc1	ZINC000274895090	456267596	/nfs/dbraw/zinc/26/75/96/456267596.db2.gz	KXNIMEJHPDWVFR-GOSISDBHSA-N	0	3	340.471	3.158	20	30		EGEDHN
C=CC[C@H](C(=O)NCCCCN1C[C@@H](C)O[C@@H](C)C1)c1ccccc1	ZINC000275099898	456270018	/nfs/dbraw/zinc/27/00/18/456270018.db2.gz	CTPUPESAEPFOOW-NSHGMRRFSA-N	0	3	344.499	3.352	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)c2cccc(Nc3cnn(C)c3)c2)n1	ZINC000342902793	456304464	/nfs/dbraw/zinc/30/44/64/456304464.db2.gz	IDZRZPKHVQWWQC-OAHLLOKOSA-N	0	3	337.408	3.419	20	30		EGEDHN
C[C@@H]1CC[C@H](C)N1CC(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1	ZINC000347751339	456348926	/nfs/dbraw/zinc/34/89/26/456348926.db2.gz	FJPDAHSNTTVURB-JFRXWTBNSA-N	0	3	325.456	3.158	20	30		EGEDHN
COc1ccc([C@H](N[C@H](C)C(=O)N[C@@](C)(C#N)C(C)C)C2CC2)cc1	ZINC000343007986	456352431	/nfs/dbraw/zinc/35/24/31/456352431.db2.gz	LFYQLUWXBJCUTN-DJKXOVBDSA-N	0	3	343.471	3.179	20	30		EGEDHN
COc1ccc([C@@H](CNc2ccc(C#N)cc2F)N(C)C)cc1OC	ZINC000302544308	456357995	/nfs/dbraw/zinc/35/79/95/456357995.db2.gz	IGXQBANIWNHBEU-QGZVFWFLSA-N	0	3	343.402	3.429	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000290623143	456385677	/nfs/dbraw/zinc/38/56/77/456385677.db2.gz	SGQFZVAMLLMVOW-QFBILLFUSA-N	0	3	348.487	3.174	20	30		EGEDHN
Cc1cccc(CN2CCN(CCCC3(C#N)CCOCC3)CC2)c1	ZINC000282096944	456411693	/nfs/dbraw/zinc/41/16/93/456411693.db2.gz	VSWYRIBAMFTXOU-UHFFFAOYSA-N	0	3	341.499	3.213	20	30		EGEDHN
C=CCOc1cccc(NC(=O)NCC2(SC)CCN(C)CC2)c1	ZINC000352944256	456423078	/nfs/dbraw/zinc/42/30/78/456423078.db2.gz	RJXLJQNLOHIXAO-UHFFFAOYSA-N	0	3	349.500	3.200	20	30		EGEDHN
C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCN(C)CC[C@@H]1C	ZINC000340385839	456431215	/nfs/dbraw/zinc/43/12/15/456431215.db2.gz	YUNUXLFWOZSYLM-GJZGRUSLSA-N	0	3	346.500	3.496	20	30		EGEDHN
CCCN(CC(=O)NC1(C#N)CCCCC1)[C@@H]1C[C@H](OCC)C1(C)C	ZINC000303928175	456495792	/nfs/dbraw/zinc/49/57/92/456495792.db2.gz	WUSDWSNJNBUDCJ-SJORKVTESA-N	0	3	349.519	3.245	20	30		EGEDHN
C=CCC[C@@H](NC[C@@H](O)CN1CCc2ccccc2C1)c1ccco1	ZINC000340505226	456497980	/nfs/dbraw/zinc/49/79/80/456497980.db2.gz	NJZTWLADWZCFRX-WOJBJXKFSA-N	0	3	340.467	3.296	20	30		EGEDHN
C=CC1CCN(C[C@@H](O)COc2ccc(/C=C/C)cc2OC)CC1	ZINC000348179772	456517756	/nfs/dbraw/zinc/51/77/56/456517756.db2.gz	HISAKNAIWNHXAE-MJICGBHWSA-N	0	3	331.456	3.366	20	30		EGEDHN
C[C@@H](NCCC(=O)Nc1ccc(C#N)cc1)c1ccc2n[nH]cc2c1	ZINC000353198539	456554252	/nfs/dbraw/zinc/55/42/52/456554252.db2.gz	ZMYLBNFOETVHHD-CYBMUJFWSA-N	0	3	333.395	3.114	20	30		EGEDHN
CCc1nc(C#N)cc(N[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)n1	ZINC000308170304	456571444	/nfs/dbraw/zinc/57/14/44/456571444.db2.gz	QEUJBZVRTUBYQO-RDJZCZTQSA-N	0	3	335.455	3.376	20	30		EGEDHN
CCc1nc(C#N)cc(NC[C@@H]2CCCN(Cc3ccccc3)C2)n1	ZINC000308169744	456572272	/nfs/dbraw/zinc/57/22/72/456572272.db2.gz	PQMJDGZDFWFEGN-KRWDZBQOSA-N	0	3	335.455	3.235	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1C	ZINC000310009542	456577573	/nfs/dbraw/zinc/57/75/73/456577573.db2.gz	JNGJGSKXIHKJAH-CMPLNLGQSA-N	0	3	333.270	3.130	20	30		EGEDHN
C[C@@H](N[C@@H]1CCN(C(=O)Cc2ccccc2)C1)c1ccc(C#N)cc1	ZINC000340628683	456584284	/nfs/dbraw/zinc/58/42/84/456584284.db2.gz	ZEGSQFKBRZAINI-OXQOHEQNSA-N	0	3	333.435	3.052	20	30		EGEDHN
C=CCc1ccc(OC[C@@H](O)CN2CCCC(C)(C)C2)c(OC)c1	ZINC000353249980	456587367	/nfs/dbraw/zinc/58/73/67/456587367.db2.gz	AQINEOMTRHOSOV-KRWDZBQOSA-N	0	3	333.472	3.285	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N[C@@H](CN1CCCC1)c1ccccc1	ZINC000337905314	456595236	/nfs/dbraw/zinc/59/52/36/456595236.db2.gz	UKCVBCKTHRKFHM-FQEVSTJZSA-N	0	3	333.435	3.434	20	30		EGEDHN
COc1cc(CN[C@H]2CCc3ccc(C#N)cc32)cc(OC)c1OC	ZINC000353268218	456599670	/nfs/dbraw/zinc/59/96/70/456599670.db2.gz	QTGUXZXGZSUGBN-KRWDZBQOSA-N	0	3	338.407	3.361	20	30		EGEDHN
CN(Cc1cccc(Cl)c1)C[C@@H](O)COc1ccccc1C#N	ZINC000320369072	456628418	/nfs/dbraw/zinc/62/84/18/456628418.db2.gz	IORNGHVJSUXYKX-QGZVFWFLSA-N	0	3	330.815	3.083	20	30		EGEDHN
COc1cccc2c1CC[C@H]2NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000348344166	456636660	/nfs/dbraw/zinc/63/66/60/456636660.db2.gz	QHPIOBBBSZVVJB-VQIMIIECSA-N	0	3	345.402	3.053	20	30		EGEDHN
CCCN(CC(=O)N(CCC#N)CCC#N)[C@@H]1CCc2ccccc21	ZINC000299383536	456676354	/nfs/dbraw/zinc/67/63/54/456676354.db2.gz	HSNZDFIDPZRBKW-LJQANCHMSA-N	0	3	338.455	3.042	20	30		EGEDHN
Cc1nc(NC(=O)[C@@H](C)N[C@H]2CCC(=O)NC23CCC3)sc1C	ZINC000328703726	456741599	/nfs/dbraw/zinc/74/15/99/456741599.db2.gz	OIQNBUUMTWVJLC-PWSUYJOCSA-N	0	3	336.461	3.368	20	30		EGEDHN
COc1cccc([C@H](CNc2ccc(Cl)c(C#N)n2)N(C)C)c1	ZINC000299625205	456747042	/nfs/dbraw/zinc/74/70/42/456747042.db2.gz	KGBMJPPRFBXNJQ-INIZCTEOSA-N	0	3	330.819	3.330	20	30		EGEDHN
C[C@H](c1cccnc1)N1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000299678973	456762502	/nfs/dbraw/zinc/76/25/02/456762502.db2.gz	WRJJTJIVLYMWSI-OAHLLOKOSA-N	0	3	334.423	3.365	20	30		EGEDHN
C[C@@H](CC#N)Sc1ccccc1NC(=O)NC[C@H]1CCCN1C	ZINC000343653735	456763381	/nfs/dbraw/zinc/76/33/81/456763381.db2.gz	SRNGFLNATXQIRR-UONOGXRCSA-N	0	3	332.473	3.297	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(Nc3ccccc3)nc2)CC1	ZINC000299716853	456771991	/nfs/dbraw/zinc/77/19/91/456771991.db2.gz	UENPCQVIMGBGHU-UHFFFAOYSA-N	0	3	334.423	3.109	20	30		EGEDHN
C[C@@H](C(=O)N(CCC#N)c1ccccc1)N1CCC[C@H](C2CC2)C1	ZINC000344079394	456794454	/nfs/dbraw/zinc/79/44/54/456794454.db2.gz	YDZSERJWKPMNOK-WMZOPIPTSA-N	0	3	325.456	3.444	20	30		EGEDHN
COc1cc2c(cc1OC)[C@H](NCc1ccc(C#N)c(OC)c1)CC2	ZINC000353615704	456804769	/nfs/dbraw/zinc/80/47/69/456804769.db2.gz	ZQBJMLJSPDXTAZ-QGZVFWFLSA-N	0	3	338.407	3.361	20	30		EGEDHN
COc1ccc([C@@H](C)N[C@H](C)C(=O)NC2(C#N)CCCCC2)cc1	ZINC000341231297	456823855	/nfs/dbraw/zinc/82/38/55/456823855.db2.gz	VMALJYQMKOWNJP-HUUCEWRRSA-N	0	3	329.444	3.077	20	30		EGEDHN
COc1ccc([C@H](C)N[C@H](C)C(=O)NC2(C#N)CCCCC2)cc1	ZINC000341231298	456824372	/nfs/dbraw/zinc/82/43/72/456824372.db2.gz	VMALJYQMKOWNJP-LSDHHAIUSA-N	0	3	329.444	3.077	20	30		EGEDHN
CC(=O)N1CCC(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)CC1	ZINC000329143962	456842497	/nfs/dbraw/zinc/84/24/97/456842497.db2.gz	VYNMZRAUVKJTLD-DNVCBOLYSA-N	0	3	343.471	3.037	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cccc([N+](=O)[O-])c1)C(C)C	ZINC000344789874	456859241	/nfs/dbraw/zinc/85/92/41/456859241.db2.gz	PPUGODXGSSLWNY-KRWDZBQOSA-N	0	3	331.416	3.023	20	30		EGEDHN
C=CC[C@H](CC)NC(=O)N(C)C[C@H]1CCN(C)[C@H]1c1cccnc1	ZINC000341485872	456868332	/nfs/dbraw/zinc/86/83/32/456868332.db2.gz	WGRKQENWPFQIGF-SQNIBIBYSA-N	0	3	330.476	3.071	20	30		EGEDHN
O=C(NCc1ccccc1OC1CCCC1)N[C@H]1CCN(C2CC2)C1	ZINC000329320381	456871365	/nfs/dbraw/zinc/87/13/65/456871365.db2.gz	UCBNZHMCKRNXIW-INIZCTEOSA-N	0	3	343.471	3.248	20	30		EGEDHN
CC(=O)N[C@H](CC(=O)N1CC[C@@H](N2CCCCC2)C1)c1cccs1	ZINC000329331236	456873729	/nfs/dbraw/zinc/87/37/29/456873729.db2.gz	VZYKBGHZNMQWJU-HZPDHXFCSA-N	0	3	349.500	3.243	20	30		EGEDHN
N#CC1(N(C(=O)[C@@H]2CCCN(Cc3ccccc3)C2)C2CC2)CCC1	ZINC000341592998	456878109	/nfs/dbraw/zinc/87/81/09/456878109.db2.gz	ZGGOFLMDKGVYNN-GOSISDBHSA-N	0	3	337.467	3.336	20	30		EGEDHN
Cn1cc(NC(=O)NC2CCN(C3CC3)CC2)c(-c2ccccc2)n1	ZINC000329380571	456882161	/nfs/dbraw/zinc/88/21/61/456882161.db2.gz	NJZZGYUPWZGGDY-UHFFFAOYSA-N	0	3	339.443	3.040	20	30		EGEDHN
COCCN(C)CC[C@@H](NCc1ccc(C#N)cc1)c1ccccc1	ZINC000348847951	456882708	/nfs/dbraw/zinc/88/27/08/456882708.db2.gz	IPQXQXGOUXYZHR-OAQYLSRUSA-N	0	3	337.467	3.357	20	30		EGEDHN
O=C(NCc1ccc2c(c1)C(=O)NCC2)[C@@H]1CCCN1C1CCCC1	ZINC000329430252	456889543	/nfs/dbraw/zinc/88/95/43/456889543.db2.gz	KEBPUDGDVVLFLJ-SFHVURJKSA-N	0	3	341.455	3.411	20	30		EGEDHN
C[C@H](C(=O)NCc1ccc2c(c1)C(=O)NCC2)N1CCCCCC1	ZINC000329438740	456890510	/nfs/dbraw/zinc/89/05/10/456890510.db2.gz	MKLCRKWDRRWOIJ-CQSZACIVSA-N	0	3	329.444	3.268	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CN1C(=O)N[C@H](c2ccsc2)C1=O)C(C)C	ZINC000349234813	456918831	/nfs/dbraw/zinc/91/88/31/456918831.db2.gz	RBKXFNFETZCVDS-JKSUJKDBSA-N	0	3	347.484	3.040	20	30		EGEDHN
Cc1cc2cc(CNC(=O)N3CCCC34CCN(C)CC4)ccc2[nH]1	ZINC000329692355	456928170	/nfs/dbraw/zinc/92/81/70/456928170.db2.gz	CEHYKDVRGFNWKN-UHFFFAOYSA-N	0	3	340.471	3.451	20	30		EGEDHN
CCO[C@@H]1C[C@H](NC(=O)N[C@@H](C)C2=CCN(C)CC2)C12CCCCC2	ZINC000329712751	456930800	/nfs/dbraw/zinc/93/08/00/456930800.db2.gz	QMDIDKQCDQVCIM-RYQLBKOJSA-N	0	3	349.519	3.268	20	30		EGEDHN
Cc1n[nH]c(C)c1[C@@H]1CCCCCN1C(=O)N[C@H]1CCN(C2CC2)C1	ZINC000329713988	456931029	/nfs/dbraw/zinc/93/10/29/456931029.db2.gz	SHVHXEADQIQZDD-RDJZCZTQSA-N	0	3	345.491	3.094	20	30		EGEDHN
C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)CSc1nccn1C(C)(C)C	ZINC000329809111	456944421	/nfs/dbraw/zinc/94/44/21/456944421.db2.gz	AWRFLCOQNHQQDJ-TZMCWYRMSA-N	0	3	336.505	3.169	20	30		EGEDHN
CC[C@H]1CCCCN1CCNC(=O)[C@H]1CCO[C@@H]1c1cnn(C)c1C	ZINC000329909200	456959514	/nfs/dbraw/zinc/95/95/14/456959514.db2.gz	UWFLWPJKRPIRRU-BQFCYCMXSA-N	0	3	348.491	3.027	20	30		EGEDHN
C=C[C@H](C)NC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1	ZINC000362613617	457005383	/nfs/dbraw/zinc/00/53/83/457005383.db2.gz	KUEPBJSTPFNGFF-BBRMVZONSA-N	0	3	326.362	3.132	20	30		EGEDHN
C=CCC[C@H](NCC(=O)NCC(=O)c1cccs1)c1ccccc1	ZINC000341930412	457009118	/nfs/dbraw/zinc/00/91/18/457009118.db2.gz	MKCJVTIXIISPKK-INIZCTEOSA-N	0	3	342.464	3.344	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cnc(C)nc1C(C)C)C(C)C	ZINC000358886488	457024043	/nfs/dbraw/zinc/02/40/43/457024043.db2.gz	MBQDEGBVIZHKAC-SFHVURJKSA-N	0	3	344.503	3.337	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)NC[C@@H](c1ccc(Cl)cc1)N(C)CCC	ZINC000358925620	457037443	/nfs/dbraw/zinc/03/74/43/457037443.db2.gz	DUDCNYZDNJZMBP-WMZOPIPTSA-N	0	3	338.879	3.166	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N[C@H]1CCCN(Cc2ccccc2)C1)OCC	ZINC000339374009	457074225	/nfs/dbraw/zinc/07/42/25/457074225.db2.gz	DEXGHRMOEKERHI-RBUKOAKNSA-N	0	3	330.472	3.139	20	30		EGEDHN
CCCCn1ncc(NC(=O)N(C)[C@H](C)C2CCN(C)CC2)c1C	ZINC000330884159	457099131	/nfs/dbraw/zinc/09/91/31/457099131.db2.gz	KLMBGMWCYCQRDY-CQSZACIVSA-N	0	3	335.496	3.199	20	30		EGEDHN
COc1cc(C)c(C(=O)NCCN2CCCC(C)(C)C2)cc1OC	ZINC000331011795	457120568	/nfs/dbraw/zinc/12/05/68/457120568.db2.gz	ZQWVKDDYFOSMBZ-UHFFFAOYSA-N	0	3	334.460	3.439	20	30		EGEDHN
CC(C)Cc1ccc([C@@H](CNC(=O)c2cc(C#N)c[nH]2)N(C)C)cc1	ZINC000359919475	457147984	/nfs/dbraw/zinc/14/79/84/457147984.db2.gz	DSHGNGKHTUKJIZ-LJQANCHMSA-N	0	3	338.455	3.118	20	30		EGEDHN
COc1ccc(OC(F)(F)F)c(C(=O)N[C@@H]2CCN(C)[C@H](C)C2)c1	ZINC000331322265	457166700	/nfs/dbraw/zinc/16/67/00/457166700.db2.gz	MGKCWXIRHSBPNR-GHMZBOCLSA-N	0	3	346.349	3.381	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H](CC)N(C)Cc2ccccc2)CC1	ZINC000354280853	457170460	/nfs/dbraw/zinc/17/04/60/457170460.db2.gz	OXVFHSXTZLEQMK-FQEVSTJZSA-N	0	3	343.515	3.054	20	30		EGEDHN
CC(C)(CCC#N)CNC(=O)NCCCN1CCc2ccccc2C1	ZINC000350473667	457183811	/nfs/dbraw/zinc/18/38/11/457183811.db2.gz	AONKKNFAGFXNDU-UHFFFAOYSA-N	0	3	342.487	3.064	20	30		EGEDHN
N#C[C@H](NC(=O)[C@@H]1CCCN(Cc2ccccc2)C1)C1CCCCC1	ZINC000331495830	457194947	/nfs/dbraw/zinc/19/49/47/457194947.db2.gz	VXWHKOMYRPXNGX-UXHICEINSA-N	0	3	339.483	3.487	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N2CCC(C)(C)CC2)cc1	ZINC000350916557	457211015	/nfs/dbraw/zinc/21/10/15/457211015.db2.gz	FDPIUBBZIPASOP-ZDUSSCGKSA-N	0	3	349.456	3.026	20	30		EGEDHN
N#CC1(NC(=O)CN2CCC[C@H]2CCCc2ccccc2)CCC1	ZINC000347062205	457211088	/nfs/dbraw/zinc/21/10/88/457211088.db2.gz	WXOGVROFYJMPMK-GOSISDBHSA-N	0	3	325.456	3.036	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1c1nc(-c2ccc3c(c2)C(SC)C(=O)N3)no1	ZINC000351126330	457226613	/nfs/dbraw/zinc/22/66/13/457226613.db2.gz	ZELWYZHPXPQSIW-DDTOSNHZSA-N	0	3	343.408	3.151	20	30		EGEDHN
C=CCOc1ccccc1CNCCN1CCc2ccccc2C1=O	ZINC000342331919	457241326	/nfs/dbraw/zinc/24/13/26/457241326.db2.gz	OCFIBSSPUAOASS-UHFFFAOYSA-N	0	3	336.435	3.040	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1CCC[C@H]1Cc1ccc(C)cc1	ZINC000354556117	457288041	/nfs/dbraw/zinc/28/80/41/457288041.db2.gz	SEVXYEIVKPWKLL-MJGOQNOKSA-N	0	3	327.472	3.010	20	30		EGEDHN
CN(CC1CCN(c2ccncc2)CC1)c1nccc(C#N)c1Cl	ZINC000342468547	457320392	/nfs/dbraw/zinc/32/03/92/457320392.db2.gz	DXJMBJWEJGOMPS-UHFFFAOYSA-N	0	3	341.846	3.354	20	30		EGEDHN
C=CCCCCCN(C)[C@H](C)C(=O)NC[C@@H]1COc2ccccc2O1	ZINC000351913953	457323047	/nfs/dbraw/zinc/32/30/47/457323047.db2.gz	XOHJLNAZNTZPLL-IAGOWNOFSA-N	0	3	346.471	3.009	20	30		EGEDHN
C=CCCCCCN(C)[C@@H](C)C(=O)NC[C@@H]1COc2ccccc2O1	ZINC000351913952	457323529	/nfs/dbraw/zinc/32/35/29/457323529.db2.gz	XOHJLNAZNTZPLL-DLBZAZTESA-N	0	3	346.471	3.009	20	30		EGEDHN
C=CCCN(C)Cc1ccc(Br)cc1N1CCOCC1	ZINC000355067698	457339674	/nfs/dbraw/zinc/33/96/74/457339674.db2.gz	XZXSCBAVKQIEIH-UHFFFAOYSA-N	0	3	339.277	3.294	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN[C@@H](c2cccs2)C2CC2)cc1	ZINC000342513958	457344814	/nfs/dbraw/zinc/34/48/14/457344814.db2.gz	RHYOWMSSXOQKCZ-CRAIPNDOSA-N	0	3	328.437	3.100	20	30		EGEDHN
Cc1cc(C(=O)C(C#N)c2cc(C)nc(C)n2)c2cnn(C(C)C)c2n1	ZINC000347347571	457367245	/nfs/dbraw/zinc/36/72/45/457367245.db2.gz	UNZVNXSCBIHPAU-HNNXBMFYSA-N	0	3	348.410	3.218	20	30		EGEDHN
C#CC[C@H](NC(=O)N1CCC[C@@H]1CN1CCCCC1)c1ccccc1	ZINC000378277611	457387720	/nfs/dbraw/zinc/38/77/20/457387720.db2.gz	OIGPWMHNYYAHHT-UXHICEINSA-N	0	3	339.483	3.411	20	30		EGEDHN
CC1CC(C#N)(C(=O)N[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)C1	ZINC000379718142	457417527	/nfs/dbraw/zinc/41/75/27/457417527.db2.gz	QEIUEERHSQSWPA-WXNRQPJFSA-N	0	3	325.456	3.096	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H]2COc3c2cccc3Cl)CC1	ZINC000360912390	457430011	/nfs/dbraw/zinc/43/00/11/457430011.db2.gz	LKJLPXSHYGIFHF-INIZCTEOSA-N	0	3	349.862	3.113	20	30		EGEDHN
CN(CCOc1ccccc1C#N)CCc1ccccc1[N+](=O)[O-]	ZINC000352542985	457452651	/nfs/dbraw/zinc/45/26/51/457452651.db2.gz	ASTLGBMLEVMVDR-UHFFFAOYSA-N	0	3	325.368	3.020	20	30		EGEDHN
COc1cccc([C@@H](CNc2c(C#N)cccc2[N+](=O)[O-])N(C)C)c1	ZINC000425199172	457460508	/nfs/dbraw/zinc/46/05/08/457460508.db2.gz	HGYMCSQXKKSZIM-QGZVFWFLSA-N	0	3	340.383	3.190	20	30		EGEDHN
N#CCc1ccc(CN2CCC(NC(=O)c3ccsc3)CC2)cc1	ZINC000342719875	457477617	/nfs/dbraw/zinc/47/76/17/457477617.db2.gz	YBELWVSAMUZYBN-UHFFFAOYSA-N	0	3	339.464	3.209	20	30		EGEDHN
COC[C@H]1CCCCN([C@H](C)C(=O)N(C)C2(C#N)CCC(C)CC2)C1	ZINC000342740475	457491428	/nfs/dbraw/zinc/49/14/28/457491428.db2.gz	KSMOERKKMDEZIH-NNVNDSJASA-N	0	3	349.519	3.054	20	30		EGEDHN
Cc1ccc(C(=O)N2C[C@H]3CCCN3Cc3ccccc32)cc1C#N	ZINC000374150570	457497459	/nfs/dbraw/zinc/49/74/59/457497459.db2.gz	ZDGLACLMXXOXLL-LJQANCHMSA-N	0	3	331.419	3.492	20	30		EGEDHN
C=CCCCCCN1CCCN(Cc2nc([C@@H](C)OC)no2)CC1	ZINC000370094702	457541322	/nfs/dbraw/zinc/54/13/22/457541322.db2.gz	ZTQWSEDSSUTGAZ-MRXNPFEDSA-N	0	3	336.480	3.031	20	30		EGEDHN
C[C@H](CC#N)N(C)C(=O)[C@H](C)N1CCC(Cc2ccccc2)CC1	ZINC000347623374	457555849	/nfs/dbraw/zinc/55/58/49/457555849.db2.gz	XRZTVBVULBNQCH-SJORKVTESA-N	0	3	327.472	3.090	20	30		EGEDHN
CN(C)CCN(C(=O)c1cn(CCCC#N)c2ccccc12)C1CC1	ZINC000356276406	457557764	/nfs/dbraw/zinc/55/77/64/457557764.db2.gz	HORNOSWMTXSPMO-UHFFFAOYSA-N	0	3	338.455	3.111	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)CCC(=O)Nc1cccc(C#N)c1	ZINC000425532745	457588838	/nfs/dbraw/zinc/58/88/38/457588838.db2.gz	KBCQJGQJEWOKIE-OAHLLOKOSA-N	0	3	332.407	3.452	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)CCC(=O)Nc1ccc(C#N)cc1	ZINC000425537210	457589674	/nfs/dbraw/zinc/58/96/74/457589674.db2.gz	QAEPMRVJRCFVQL-OAHLLOKOSA-N	0	3	332.407	3.452	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)NCc1cccc(F)c1)C(C)C	ZINC000410169226	457632948	/nfs/dbraw/zinc/63/29/48/457632948.db2.gz	CFQNUAMIHGMXPI-GOSISDBHSA-N	0	3	333.451	3.324	20	30		EGEDHN
C=CCN1CC[C@H](N2CCCCC[C@@H]2c2ccc(OC)cc2)C1=O	ZINC000410309673	457637398	/nfs/dbraw/zinc/63/73/98/457637398.db2.gz	ATIXTHPQNDFKDK-MOPGFXCFSA-N	0	3	328.456	3.399	20	30		EGEDHN
C[C@@H](NCCCS(C)(=O)=O)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000374664827	457683018	/nfs/dbraw/zinc/68/30/18/457683018.db2.gz	PXYZILREKUUQES-OAHLLOKOSA-N	0	3	342.464	3.311	20	30		EGEDHN
Cc1ccc([C@H](CN2CCOCC2)N[C@H]2CCC[C@@H](C#N)C2)cc1	ZINC000361464610	457739831	/nfs/dbraw/zinc/73/98/31/457739831.db2.gz	RCPHDVAEZPCIMK-HOJAQTOUSA-N	0	3	327.472	3.040	20	30		EGEDHN
CN(CCOc1ccccc1F)C(=O)C(C#N)CCc1ccccc1	ZINC000433232362	457785098	/nfs/dbraw/zinc/78/50/98/457785098.db2.gz	LXKFKTJHZYUXNA-QGZVFWFLSA-N	0	3	340.398	3.435	20	30		EGEDHN
C=C[C@H]1CCCCN1C(=O)NCC1CCN(c2ccncc2)CC1	ZINC000426205916	457786190	/nfs/dbraw/zinc/78/61/90/457786190.db2.gz	BSMSDPRSJGHGHA-KRWDZBQOSA-N	0	3	328.460	3.048	20	30		EGEDHN
CO[C@@H](CNCc1cn(CCC#N)nc1-c1ccncc1)C(C)(C)C	ZINC000433324665	457811438	/nfs/dbraw/zinc/81/14/38/457811438.db2.gz	FILPVYFJKBDESL-KRWDZBQOSA-N	0	3	341.459	3.009	20	30		EGEDHN
CN(C)Cc1ccc(CNC(=O)[C@@H]2C[C@H]2c2cccc(C#N)c2)cc1	ZINC000411180862	457821778	/nfs/dbraw/zinc/82/17/78/457821778.db2.gz	FIJSLMTVKIFYID-VQTJNVASSA-N	0	3	333.435	3.040	20	30		EGEDHN
C[C@H](CN(C)C(=O)C(C#N)CCc1ccccc1)c1nccs1	ZINC000433382797	457826235	/nfs/dbraw/zinc/82/62/35/457826235.db2.gz	PXJXBMFONFOPQL-ZBFHGGJFSA-N	0	3	327.453	3.478	20	30		EGEDHN
CCCN(CC(F)(F)F)C(=O)[C@@H]1CCCN([C@@H](C)CCC#N)C1	ZINC000411287815	457849560	/nfs/dbraw/zinc/84/95/60/457849560.db2.gz	BGMTWSGMMKAYEP-UONOGXRCSA-N	0	3	333.398	3.192	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCC(C)(C)CC#N)C1	ZINC000457945092	457877646	/nfs/dbraw/zinc/87/76/46/457877646.db2.gz	ZSRMPWLVTLGLHZ-RDJZCZTQSA-N	0	3	328.460	3.061	20	30		EGEDHN
CNS(=O)(=O)c1cccc([C@@H](C)NCCC2(C#N)CCCCC2)c1	ZINC000411463982	457895211	/nfs/dbraw/zinc/89/52/11/457895211.db2.gz	MBXHBRRMBBNORV-OAHLLOKOSA-N	0	3	349.500	3.109	20	30		EGEDHN
CCCN(CCN1CCCCC1)[C@@H](C)C(=O)Nc1ccccc1C#N	ZINC000411730215	457963869	/nfs/dbraw/zinc/96/38/69/457963869.db2.gz	ZJTAQGUHNLXSBP-KRWDZBQOSA-N	0	3	342.487	3.083	20	30		EGEDHN
Cc1cc(NC(=O)c2cccc(C#N)c2C)ccc1OCCN(C)C	ZINC000458222033	457976780	/nfs/dbraw/zinc/97/67/80/457976780.db2.gz	VARNIVRWYFMRIT-UHFFFAOYSA-N	0	3	337.423	3.368	20	30		EGEDHN
C[C@H](CCCc1cccnc1)N[C@@H]1CCN(c2ccc(C#N)cc2)C1=O	ZINC000411826792	457986615	/nfs/dbraw/zinc/98/66/15/457986615.db2.gz	SVZNLTCRFSNGTD-OXQOHEQNSA-N	0	3	348.450	3.060	20	30		EGEDHN
CC(C)n1cnnc1[C@H]1CCCN(CCCC2(C#N)CCOCC2)C1	ZINC000375611103	457989963	/nfs/dbraw/zinc/98/99/63/457989963.db2.gz	FEMPMLPMMXVPCI-KRWDZBQOSA-N	0	3	345.491	3.139	20	30		EGEDHN
CC1(C)CCCN(CCNC(=O)N[C@H](CCC#N)c2ccccc2)C1	ZINC000445218208	458027145	/nfs/dbraw/zinc/02/71/45/458027145.db2.gz	ICBNTDUPLCHMOH-GOSISDBHSA-N	0	3	342.487	3.453	20	30		EGEDHN
C[C@H]1CN(CCCC2(C#N)CCOCC2)CCN1Cc1ccccc1	ZINC000411986044	458032759	/nfs/dbraw/zinc/03/27/59/458032759.db2.gz	QSHVGVKUINAMNV-IBGZPJMESA-N	0	3	341.499	3.293	20	30		EGEDHN
C[C@H](CN(C)C(=O)C(C#N)CCc1ccccc1)C(=O)OC(C)(C)C	ZINC000458390387	458032816	/nfs/dbraw/zinc/03/28/16/458032816.db2.gz	MWUMBCBEACLOQW-WBVHZDCISA-N	0	3	344.455	3.195	20	30		EGEDHN
N#CC(C(=O)c1ccc2c(c1)OCO2)c1cc(C(F)(F)F)ccn1	ZINC000362129741	458033377	/nfs/dbraw/zinc/03/33/77/458033377.db2.gz	NZKWUMGAGZAGMP-NSHDSACASA-N	0	3	334.253	3.319	20	30		EGEDHN
CN1CCC2(CCCN2C(=O)N[C@H](CCC#N)c2ccccc2)CC1	ZINC000375837433	458088845	/nfs/dbraw/zinc/08/88/45/458088845.db2.gz	CDFGFEXAISHWRI-GOSISDBHSA-N	0	3	340.471	3.301	20	30		EGEDHN
CC(C)[C@@H](CC(F)(F)F)NCC(=O)N(CCC#N)c1ccccc1	ZINC000445890863	458111390	/nfs/dbraw/zinc/11/13/90/458111390.db2.gz	QDKWCHOJNRFAJT-OAHLLOKOSA-N	0	3	341.377	3.500	20	30		EGEDHN
CN(CCOCc1ccccc1)CCC(=O)Nc1sccc1C#N	ZINC000362445707	458183348	/nfs/dbraw/zinc/18/33/48/458183348.db2.gz	FBOMUEKTJLBRAN-UHFFFAOYSA-N	0	3	343.452	3.097	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCN(CCSC3CCCCC3)C2)nc1	ZINC000428789900	458211698	/nfs/dbraw/zinc/21/16/98/458211698.db2.gz	PSPVYYDDSPGTNY-MRXNPFEDSA-N	0	3	331.485	3.472	20	30		EGEDHN
CC(C)Oc1ccc(CN2CC[C@H](Oc3ccc(C#N)cn3)C2)cc1	ZINC000428821444	458217234	/nfs/dbraw/zinc/21/72/34/458217234.db2.gz	VAWVHHZOUZHVNA-IBGZPJMESA-N	0	3	337.423	3.394	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1CN[C@H](C)c1nnn(-c2ccccc2)c1C	ZINC000436281022	458282171	/nfs/dbraw/zinc/28/21/71/458282171.db2.gz	CWUXBYNRYBPYIY-ALKREAHSSA-N	0	3	326.444	3.208	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1CN[C@@H](C)c1nnn(-c2ccccc2)c1C	ZINC000436281027	458282683	/nfs/dbraw/zinc/28/26/83/458282683.db2.gz	CWUXBYNRYBPYIY-QOKNQOGYSA-N	0	3	326.444	3.208	20	30		EGEDHN
O=C1Nc2ccccc2[C@@]12CCN(CC#Cc1ccc(Cl)cc1)C2	ZINC000372361235	458289586	/nfs/dbraw/zinc/28/95/86/458289586.db2.gz	SZKHPEOCZJCRJK-FQEVSTJZSA-N	0	3	336.822	3.287	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CCN(C(=O)NCC(C)(C)CC#N)C1	ZINC000459212088	458292220	/nfs/dbraw/zinc/29/22/20/458292220.db2.gz	AJPYFJZUSKSMJJ-QGZVFWFLSA-N	0	3	342.487	3.090	20	30		EGEDHN
Cc1cccc(CN(CCN(C)C)C(=O)NCC(C)(C)CC#N)c1	ZINC000459257142	458304101	/nfs/dbraw/zinc/30/41/01/458304101.db2.gz	JSIDVFNBSPCAGS-UHFFFAOYSA-N	0	3	330.476	3.008	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@H](N2CCCCC2)C1	ZINC000413822510	458306886	/nfs/dbraw/zinc/30/68/86/458306886.db2.gz	LACZSZJVMJDQSA-PMACEKPBSA-N	0	3	341.499	3.444	20	30		EGEDHN
Cc1ccc([C@@H]2CCC[C@@H]2N(C)CC(=O)NC2(C#N)CCC2)cc1	ZINC000372613597	458308851	/nfs/dbraw/zinc/30/88/51/458308851.db2.gz	ZQXKZDOOBWBMAD-ROUUACIJSA-N	0	3	325.456	3.125	20	30		EGEDHN
CN(C)CCN(Cc1ccsc1)C(=O)Nc1ccc(C#N)cc1	ZINC000459281020	458314036	/nfs/dbraw/zinc/31/40/36/458314036.db2.gz	BNEHZEKMNFGSIJ-UHFFFAOYSA-N	0	3	328.441	3.215	20	30		EGEDHN
CN(CCC#N)C[C@@H](O)CN1CC2(CCCCC2)[C@H]1c1ccccc1	ZINC000414135690	458315218	/nfs/dbraw/zinc/31/52/18/458315218.db2.gz	DOGKVSJRCAPJHO-WOJBJXKFSA-N	0	3	341.499	3.200	20	30		EGEDHN
CC[C@@](CNCc1cc(C#N)cs1)(C(=O)OC)c1ccccc1	ZINC000414574815	458323797	/nfs/dbraw/zinc/32/37/97/458323797.db2.gz	AUHASSUPYPXVCF-SFHVURJKSA-N	0	3	328.437	3.230	20	30		EGEDHN
C=CCN1CCC(NC(=O)Cc2cccc(OCC=C(C)C)c2)CC1	ZINC000416149467	458339973	/nfs/dbraw/zinc/33/99/73/458339973.db2.gz	HFYIATRWFWFARB-UHFFFAOYSA-N	0	3	342.483	3.341	20	30		EGEDHN
C=CCOc1cccc(CN2CCC(n3ccc([N+](=O)[O-])n3)CC2)c1	ZINC000376650048	458361693	/nfs/dbraw/zinc/36/16/93/458361693.db2.gz	BHDWEJZZDHRUAS-UHFFFAOYSA-N	0	3	342.399	3.193	20	30		EGEDHN
C[C@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)c1ccc(C#N)cc1	ZINC000436711757	458364430	/nfs/dbraw/zinc/36/44/30/458364430.db2.gz	BGMKXKSMSPDZJU-HNNXBMFYSA-N	0	3	349.434	3.219	20	30		EGEDHN
N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)NC[C@H](N)c1ccccc1	ZINC000418429475	458375054	/nfs/dbraw/zinc/37/50/54/458375054.db2.gz	NPOSMPBQWXXTTO-AABGKKOBSA-N	0	3	348.450	3.168	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCC[C@@H](CC(F)(F)F)C2)CC1	ZINC000420784670	458401547	/nfs/dbraw/zinc/40/15/47/458401547.db2.gz	HJGWJMOLUXVOHK-AWEZNQCLSA-N	0	3	347.425	3.401	20	30		EGEDHN
CN(CCCNC(=O)[C@@]1(C#N)CC12CCCC2)Cc1ccccc1	ZINC000448605615	458402365	/nfs/dbraw/zinc/40/23/65/458402365.db2.gz	QYEHSSWBZRWLMX-FQEVSTJZSA-N	0	3	325.456	3.099	20	30		EGEDHN
CN(C[C@@H]1CCCN1C)C(=O)c1ccccc1-c1ccccc1C#N	ZINC000421706805	458420031	/nfs/dbraw/zinc/42/00/31/458420031.db2.gz	VSAAOWQKPQBBBS-KRWDZBQOSA-N	0	3	333.435	3.391	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)s1)c1ccc(OCCN(C)C)cc1	ZINC000421893918	458423526	/nfs/dbraw/zinc/42/35/26/458423526.db2.gz	XLSQEURQBLRKSY-CQSZACIVSA-N	0	3	329.469	3.411	20	30		EGEDHN
Cc1[nH]c(C#N)cc1C(=O)N[C@@H](CN(C)Cc1ccccc1)C(C)C	ZINC000450677373	458454778	/nfs/dbraw/zinc/45/47/78/458454778.db2.gz	FZHYLHJKSYYYTH-IBGZPJMESA-N	0	3	338.455	3.081	20	30		EGEDHN
CN(CCC#N)C(=O)CCN1CCc2ccc(-c3ccccc3)cc2C1	ZINC000451157458	458468361	/nfs/dbraw/zinc/46/83/61/458468361.db2.gz	IBSPPTYBCOPWRR-UHFFFAOYSA-N	0	3	347.462	3.474	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCC[C@H](OC)C(CC)CC)CC1	ZINC000437599302	458472490	/nfs/dbraw/zinc/47/24/90/458472490.db2.gz	CLPIISGJNVBDTA-SFHVURJKSA-N	0	3	339.524	3.167	20	30		EGEDHN
CO[C@H]1C[C@H](NCc2cc(C#N)ccc2Br)C12CCC2	ZINC000459768661	458472842	/nfs/dbraw/zinc/47/28/42/458472842.db2.gz	QNLKIOKIIAUUKX-GJZGRUSLSA-N	0	3	335.245	3.368	20	30		EGEDHN
CC1(C)[C@H](NCc2ccc(C#N)cc2OC(F)F)[C@H]2CCCO[C@H]21	ZINC000451478000	458478977	/nfs/dbraw/zinc/47/89/77/458478977.db2.gz	JIFAOXIYHWPOCU-FVQBIDKESA-N	0	3	336.382	3.453	20	30		EGEDHN
O=C(NCC#Cc1cccc(F)c1)[C@@H]1CCCCN1C1CCCC1	ZINC000451512203	458479844	/nfs/dbraw/zinc/47/98/44/458479844.db2.gz	QXSLKICWDVJLFS-IBGZPJMESA-N	0	3	328.431	3.091	20	30		EGEDHN
CO[C@@H]1CCC[C@H]1NCC(=O)Nc1ccccc1S[C@@H](C)CC#N	ZINC000451628883	458484363	/nfs/dbraw/zinc/48/43/63/458484363.db2.gz	GGHKQDATIRVHAE-SQWLQELKSA-N	0	3	347.484	3.176	20	30		EGEDHN
COc1ccc(Cl)cc1NC(=O)C[C@@H](C)NCC1(CC#N)CC1	ZINC000430751027	458487496	/nfs/dbraw/zinc/48/74/96/458487496.db2.gz	ROXQTVSXJOHXDM-GFCCVEGCSA-N	0	3	335.835	3.349	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)[C@H]2CC[C@@H](C(F)(F)F)CC2)CC1	ZINC000460262394	458508083	/nfs/dbraw/zinc/50/80/83/458508083.db2.gz	DTTVHKTWJUFFDH-OTVXOJSOSA-N	0	3	347.425	3.399	20	30		EGEDHN
CC(=O)NCCc1ccc([C@H](C)NCc2ccc(C#N)c(F)c2)cc1	ZINC000453362423	458524953	/nfs/dbraw/zinc/52/49/53/458524953.db2.gz	BAOBQQVUTYRZOQ-AWEZNQCLSA-N	0	3	339.414	3.227	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)c(F)c1)c1cccc(OCCN(C)C)c1	ZINC000453391230	458525768	/nfs/dbraw/zinc/52/57/68/458525768.db2.gz	SVRLZFXFQJLKII-OAHLLOKOSA-N	0	3	341.430	3.489	20	30		EGEDHN
C=CCN1CC[C@H](NCC2(c3ccc(F)cc3F)CCCC2)C1=O	ZINC000493739244	458551215	/nfs/dbraw/zinc/55/12/15/458551215.db2.gz	WWVKSANDXBAQJX-KRWDZBQOSA-N	0	3	334.410	3.153	20	30		EGEDHN
CCOc1ccc(-c2csc(NC(=O)[C@H](N)CCCC#N)n2)cc1	ZINC000424098403	458558187	/nfs/dbraw/zinc/55/81/87/458558187.db2.gz	KUJAYQTZIHWMML-CQSZACIVSA-N	0	3	344.440	3.168	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)NCc1ccc(OC2CCCCC2)cc1	ZINC000424114823	458561535	/nfs/dbraw/zinc/56/15/35/458561535.db2.gz	SFQOLIPUAYCABN-GOSISDBHSA-N	0	3	329.444	3.035	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1cc(Cl)ccc1N1CCCCC1	ZINC000424127112	458565769	/nfs/dbraw/zinc/56/57/69/458565769.db2.gz	AMDNHTYQOKPWMZ-CQSZACIVSA-N	0	3	334.851	3.290	20	30		EGEDHN
Cc1cccc(Oc2ccccc2CNC(=O)[C@@H](N)CCCC#N)c1	ZINC000424141840	458569063	/nfs/dbraw/zinc/56/90/63/458569063.db2.gz	PDPNKNYVHLTYGS-SFHVURJKSA-N	0	3	337.423	3.425	20	30		EGEDHN
C=CC(C)(C)CNC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000454623953	458569233	/nfs/dbraw/zinc/56/92/33/458569233.db2.gz	SABGNAGUASYLMQ-AEFFLSMTSA-N	0	3	329.488	3.408	20	30		EGEDHN
CC[C@H](C(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1)N(CC)CC	ZINC000461757890	458571899	/nfs/dbraw/zinc/57/18/99/458571899.db2.gz	YADOUYPKUZBQJF-IPMKNSEASA-N	0	3	327.472	3.405	20	30		EGEDHN
C[C@H](C(=O)N[C@H]1CCCN(Cc2ccccc2)C1)c1cccc(C#N)c1	ZINC000461903818	458578235	/nfs/dbraw/zinc/57/82/35/458578235.db2.gz	UYTBKUVKRQFXAT-UWJYYQICSA-N	0	3	347.462	3.443	20	30		EGEDHN
CC#CCN(C)C(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000454983284	458581511	/nfs/dbraw/zinc/58/15/11/458581511.db2.gz	GGBZEVSHWVYRAI-UHFFFAOYSA-N	0	3	329.444	3.038	20	30		EGEDHN
CC(C)C[C@H](CN(C)C)NC(=O)C(C)(C)Cc1ccc(C#N)cc1	ZINC000455021339	458582922	/nfs/dbraw/zinc/58/29/22/458582922.db2.gz	TYRCJNMOOSQFQT-GOSISDBHSA-N	0	3	329.488	3.219	20	30		EGEDHN
C=C(C)Cn1c([C@@H]2CCCS2)nnc1N1CCN(C)[C@H](C(C)C)C1	ZINC000424232148	458589219	/nfs/dbraw/zinc/58/92/19/458589219.db2.gz	BUIRPSNZWQBNQK-HOTGVXAUSA-N	0	3	349.548	3.199	20	30		EGEDHN
C[C@H](NC(=O)[C@@H](C)c1cccc(C#N)c1)[C@H](c1ccccc1)N(C)C	ZINC000462494969	458626064	/nfs/dbraw/zinc/62/60/64/458626064.db2.gz	BWQDBLAZVMXEBD-TWOQFEAHSA-N	0	3	335.451	3.469	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N1CCN(Cc2ccccc2)C[C@@H](C)C1	ZINC000456321514	458637713	/nfs/dbraw/zinc/63/77/13/458637713.db2.gz	CUTGRXYYYOEKGY-NQIIRXRSSA-N	0	3	344.499	3.196	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000424504884	458651737	/nfs/dbraw/zinc/65/17/37/458651737.db2.gz	ZUBNJFAQZYGUOT-AQNXPRMDSA-N	0	3	342.483	3.139	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)NC[C@@H](C)N1CCCC[C@H]1C	ZINC000463503761	458706878	/nfs/dbraw/zinc/70/68/78/458706878.db2.gz	YJUFTMGKWCAYPQ-HZPDHXFCSA-N	0	3	346.471	3.253	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Nc1ccc(C#N)cc1)C(C)C	ZINC000503435560	458708635	/nfs/dbraw/zinc/70/86/35/458708635.db2.gz	MUNADELQZOZLBK-SFHVURJKSA-N	0	3	326.444	3.378	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N1CCc2ccccc2C1)C(C)C	ZINC000503443059	458708778	/nfs/dbraw/zinc/70/87/78/458708778.db2.gz	VLFXBORFZFUFMN-FQEVSTJZSA-N	0	3	341.499	3.453	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCc2cc3ccccc3[nH]2)cc1	ZINC000471968090	458758117	/nfs/dbraw/zinc/75/81/17/458758117.db2.gz	FDTJCEYCJLBTCL-KRWDZBQOSA-N	0	3	328.375	3.038	20	30		EGEDHN
C=CCSCCNC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1	ZINC000509166517	458770696	/nfs/dbraw/zinc/77/06/96/458770696.db2.gz	MEJMGQPMLHGJKC-KRWDZBQOSA-N	0	3	347.528	3.212	20	30		EGEDHN
C[C@@](C#N)(NC(=O)CN1CCC[C@](C)(c2ccccc2)CC1)C1CC1	ZINC000510123224	458774643	/nfs/dbraw/zinc/77/46/43/458774643.db2.gz	HRYMETNRSXRXFH-SFTDATJTSA-N	0	3	339.483	3.239	20	30		EGEDHN
CC[C@@H](CNC(=O)c1cccc(C#N)c1C)N1CCc2ccccc2C1	ZINC000510465920	458775169	/nfs/dbraw/zinc/77/51/69/458775169.db2.gz	SZFQMUQJUQJEMZ-FQEVSTJZSA-N	0	3	347.462	3.433	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)C(=O)[C@@H](C)N1CCCCCC1	ZINC000510425642	458775445	/nfs/dbraw/zinc/77/54/45/458775445.db2.gz	OQXSMPLUVMKDOD-QGZVFWFLSA-N	0	3	330.472	3.474	20	30		EGEDHN
C=CCOc1cccc(NC(=O)N[C@H](C)CN2CCC[C@H](C)C2)c1	ZINC000510954717	458777719	/nfs/dbraw/zinc/77/77/19/458777719.db2.gz	YETYTFBMZBMINA-JKSUJKDBSA-N	0	3	331.460	3.493	20	30		EGEDHN
C[C@H]1[C@@H](Cc2ccccc2)CCN1CC(=O)Nc1cccc(C#N)c1	ZINC000472343266	458788088	/nfs/dbraw/zinc/78/80/88/458788088.db2.gz	JUXFIBDDFWMLDZ-QFBILLFUSA-N	0	3	333.435	3.450	20	30		EGEDHN
C[C@H]1[C@H](Cc2ccccc2)CCN1CC(=O)NCc1ccc(C#N)cc1	ZINC000472349978	458788684	/nfs/dbraw/zinc/78/86/84/458788684.db2.gz	PHLCBJDNRIXULU-UWJYYQICSA-N	0	3	347.462	3.128	20	30		EGEDHN
C=CC[C@H](CC)NC(=O)C(=O)Nc1cccc(CN2CCCCC2)c1	ZINC000440255156	458798952	/nfs/dbraw/zinc/79/89/52/458798952.db2.gz	LGHURAHCRKVRCO-KRWDZBQOSA-N	0	3	343.471	3.082	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNCc1cn2cc(C)ccc2n1)C(C)C	ZINC000515168135	458806872	/nfs/dbraw/zinc/80/68/72/458806872.db2.gz	DUBSUCNRSZFPOO-LJQANCHMSA-N	0	3	326.488	3.431	20	30		EGEDHN
CC(=O)Nc1ccc(CN(C)CCOCc2ccc(C#N)cc2)cc1	ZINC000515254065	458807275	/nfs/dbraw/zinc/80/72/75/458807275.db2.gz	HAPSERYPQJHZHI-UHFFFAOYSA-N	0	3	337.423	3.165	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCCC[C@@H]2Cc2ccccc2)CC1	ZINC000518024203	458837970	/nfs/dbraw/zinc/83/79/70/458837970.db2.gz	XXTLNNXEXIYNEG-HXUWFJFHSA-N	0	3	341.499	3.444	20	30		EGEDHN
COC(=O)N1CCC[C@H]([C@@H](C)N[C@@H](C)c2ccc(C#N)cc2F)C1	ZINC000495509116	458870760	/nfs/dbraw/zinc/87/07/60/458870760.db2.gz	DIEIZQMZRZDTGH-IPYPFGDCSA-N	0	3	333.407	3.215	20	30		EGEDHN
CCC(CC)(CCO)NCC#Cc1ccc(OC(F)(F)F)cc1	ZINC000549179060	458878421	/nfs/dbraw/zinc/87/84/21/458878421.db2.gz	RVYIRMJXKUFDOE-UHFFFAOYSA-N	0	3	329.362	3.468	20	30		EGEDHN
CN(C)[C@@H](CNC(=O)c1ccc(C(C)(C)C#N)cc1)Cc1ccccc1	ZINC000474392804	458882134	/nfs/dbraw/zinc/88/21/34/458882134.db2.gz	CVXBBXMYTNXCAG-HXUWFJFHSA-N	0	3	349.478	3.390	20	30		EGEDHN
C[C@H]1CN(Cc2cn(CCC#N)nc2-c2ccncc2)C[C@H](C)S1	ZINC000518671368	458883810	/nfs/dbraw/zinc/88/38/10/458883810.db2.gz	OMIAUUFHIUGZQR-GJZGRUSLSA-N	0	3	341.484	3.185	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1c[nH]nc1C(C)(C)C)C(C)C	ZINC000551099319	458888108	/nfs/dbraw/zinc/88/81/08/458888108.db2.gz	IKXBBFLCEKQHOD-MRXNPFEDSA-N	0	3	332.492	3.136	20	30		EGEDHN
C=CC[C@H](CC)NC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1	ZINC000466378759	458896610	/nfs/dbraw/zinc/89/66/10/458896610.db2.gz	RQKCUWWDEDWJDN-HNNXBMFYSA-N	0	3	339.430	3.393	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@]2(C)CCCc3ccccc32)CC1	ZINC000519271071	458930011	/nfs/dbraw/zinc/93/00/11/458930011.db2.gz	NVZBFWKKTGMFGP-NRFANRHFSA-N	0	3	326.484	3.437	20	30		EGEDHN
CC(C)(CC#N)CNC(=O)NC[C@H](c1ccccc1)N1CCCC1	ZINC000457369592	458933563	/nfs/dbraw/zinc/93/35/63/458933563.db2.gz	CENNIXGSNMNJHR-QGZVFWFLSA-N	0	3	328.460	3.063	20	30		EGEDHN
C=CCc1ccc(OCC(=O)Nc2cc(C)cc(CN)c2)c(OC)c1	ZINC000457389105	458939808	/nfs/dbraw/zinc/93/98/08/458939808.db2.gz	ZOPXROQVUQGDFC-UHFFFAOYSA-N	0	3	340.423	3.208	20	30		EGEDHN
C=CCCN(C)C(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000467010566	458942456	/nfs/dbraw/zinc/94/24/56/458942456.db2.gz	JLTHQLBYLRVSIJ-UHFFFAOYSA-N	0	3	345.487	3.125	20	30		EGEDHN
C=CCN(CCc1ccccc1)C(=O)NCCN1CCC[C@@H](C)C1	ZINC000519505558	458953266	/nfs/dbraw/zinc/95/32/66/458953266.db2.gz	BKUBJFAKIHHABI-GOSISDBHSA-N	0	3	329.488	3.159	20	30		EGEDHN
C[C@H]1C[C@H](Nc2c(C#N)cnc3c(F)cc(F)cc32)CN1C1CC1	ZINC000566770343	458996874	/nfs/dbraw/zinc/99/68/74/458996874.db2.gz	RWBITBBDVSQQQZ-GWCFXTLKSA-N	0	3	328.366	3.422	20	30		EGEDHN
C[C@H]1OCC[C@@]1(O)CN(Cc1ccccc1)Cc1cccc(C#N)c1	ZINC000566882178	459015556	/nfs/dbraw/zinc/01/55/56/459015556.db2.gz	JFONJFZCBNDCRK-DYESRHJHSA-N	0	3	336.435	3.100	20	30		EGEDHN
C=CCN(CCc1ccccc1)C(=O)NCCN1CCC(C)CC1	ZINC000520130516	459033207	/nfs/dbraw/zinc/03/32/07/459033207.db2.gz	JHUVKSVGSZAWJD-UHFFFAOYSA-N	0	3	329.488	3.159	20	30		EGEDHN
C[C@@H]1CN(C(=O)C(C#N)Cc2ccc(C#N)cc2)[C@@H]1c1ccccc1	ZINC000577517806	459045395	/nfs/dbraw/zinc/04/53/95/459045395.db2.gz	RVFYGZJGXZVEQO-XPGWFJOJSA-N	0	3	329.403	3.460	20	30		EGEDHN
COC(=O)c1ccc(CN(C)CCCOc2cccc(C#N)c2)cc1	ZINC000477754010	459058654	/nfs/dbraw/zinc/05/86/54/459058654.db2.gz	HFNYMKACVFBVCH-UHFFFAOYSA-N	0	3	338.407	3.246	20	30		EGEDHN
N#CCN1CCC(NCc2oc3ccccc3c2Br)CC1	ZINC000594498934	459063846	/nfs/dbraw/zinc/06/38/46/459063846.db2.gz	NQLFEUTUMUPJAJ-UHFFFAOYSA-N	0	3	348.244	3.273	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCN(Cc3nccc4ccccc43)C2)nc1	ZINC000590053358	459073525	/nfs/dbraw/zinc/07/35/25/459073525.db2.gz	SUSQTTXHOQQEHZ-KRWDZBQOSA-N	0	3	330.391	3.155	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(CCOC)C[C@H]2CC=CCC2)CC1	ZINC000478623653	459101171	/nfs/dbraw/zinc/10/11/71/459101171.db2.gz	PJUJJZKWUQFPMW-SFHVURJKSA-N	0	3	349.519	3.041	20	30		EGEDHN
N#Cc1c(N[C@@H]2CCCN3CCCC[C@H]23)nc2cc(Cl)ccn21	ZINC000594600007	459104594	/nfs/dbraw/zinc/10/45/94/459104594.db2.gz	KYWANCYDFJQASW-ZIAGYGMSSA-N	0	3	329.835	3.288	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC1CCN(C[C@H]2CCCO2)CC1	ZINC000594605212	459108796	/nfs/dbraw/zinc/10/87/96/459108796.db2.gz	HRBSCIAQCXCZAQ-QGZVFWFLSA-N	0	3	329.444	3.012	20	30		EGEDHN
CC(C)CCO[C@@H]1CCCC[C@H]1NCc1cnc2c(C#N)cnn2c1	ZINC000577870843	459111356	/nfs/dbraw/zinc/11/13/56/459111356.db2.gz	UEKUSWDFHVIXHL-QZTJIDSGSA-N	0	3	341.459	3.064	20	30		EGEDHN
C=CCCCCCN(C)[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000532573476	459111532	/nfs/dbraw/zinc/11/15/32/459111532.db2.gz	MTILFBAERRXHIO-QGZVFWFLSA-N	0	3	331.416	3.378	20	30		EGEDHN
CN(CCCCc1ccccc1)CC(=O)NCc1cccc(C#N)c1	ZINC000521187187	459127416	/nfs/dbraw/zinc/12/74/16/459127416.db2.gz	AFQJWAGHGPLOAC-UHFFFAOYSA-N	0	3	335.451	3.129	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CC[C@H](c2cccnc2)C1	ZINC000578010076	459131318	/nfs/dbraw/zinc/13/13/18/459131318.db2.gz	VVQWAXBQTKPCIK-PMACEKPBSA-N	0	3	338.451	3.039	20	30		EGEDHN
CC(C)(CO)[C@H](NCCCOc1cccc(C#N)c1)c1cccnc1	ZINC000590599697	459158183	/nfs/dbraw/zinc/15/81/83/459158183.db2.gz	FVNCCHLQDHDYCO-LJQANCHMSA-N	0	3	339.439	3.072	20	30		EGEDHN
C=C(C)Cn1c(C2CCCC2)nnc1N1C[C@@H](C)N(CC)C[C@H]1C	ZINC000558626333	459183752	/nfs/dbraw/zinc/18/37/52/459183752.db2.gz	XGYANKYKAAZYEG-HZPDHXFCSA-N	0	3	331.508	3.431	20	30		EGEDHN
CC(C)n1ccnc1CNC1CCC(Oc2ncccc2C#N)CC1	ZINC000594940975	459184743	/nfs/dbraw/zinc/18/47/43/459184743.db2.gz	XFWBDMQVORAXMA-UHFFFAOYSA-N	0	3	339.443	3.210	20	30		EGEDHN
C=CCN1CC[C@H](N2CCC(c3ccnc4ccccc43)CC2)C1=O	ZINC000578335458	459185041	/nfs/dbraw/zinc/18/50/41/459185041.db2.gz	ICPMYSHFXHCKQA-FQEVSTJZSA-N	0	3	335.451	3.201	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN2CCC=C(c3ccccn3)C2)c1	ZINC000578451075	459204662	/nfs/dbraw/zinc/20/46/62/459204662.db2.gz	UUDFVXMTLHQFRT-UHFFFAOYSA-N	0	3	332.407	3.071	20	30		EGEDHN
Cc1cc(C#N)ccc1CN(CCC(N)=O)[C@@H]1CCOc2ccccc21	ZINC000590759536	459207979	/nfs/dbraw/zinc/20/79/79/459207979.db2.gz	MILKFLAGAFTIPE-LJQANCHMSA-N	0	3	349.434	3.068	20	30		EGEDHN
N#CCc1ccc(OC[C@@H](O)CN[C@H](c2cccs2)C2CC2)cc1	ZINC000578538095	459218721	/nfs/dbraw/zinc/21/87/21/459218721.db2.gz	LNYNYQRNAIOIOE-LPHOPBHVSA-N	0	3	342.464	3.295	20	30		EGEDHN
CC(C#N)C(=O)N1CCC([C@H]2N(C(=O)OC(C)(C)C)CC2(C)C)CC1	ZINC000496507130	459220622	/nfs/dbraw/zinc/22/06/22/459220622.db2.gz	ILAVVJVWNNPGSD-UKRRQHHQSA-N	0	3	349.475	3.030	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@@H](N2CCCC2)C1	ZINC000579086348	459242794	/nfs/dbraw/zinc/24/27/94/459242794.db2.gz	TWJLBMBKMNFDAL-RBUKOAKNSA-N	0	3	327.472	3.054	20	30		EGEDHN
C[C@@H](COc1cccc(F)c1)NC(=O)C(C#N)CCc1ccccc1	ZINC000559279079	459247509	/nfs/dbraw/zinc/24/75/09/459247509.db2.gz	OOJWUUSPCSYEGN-DOTOQJQBSA-N	0	3	340.398	3.482	20	30		EGEDHN
CC(C)C[C@@]1(CO)CCCN1C(=O)C(C#N)CCc1ccccc1	ZINC000559297420	459250296	/nfs/dbraw/zinc/25/02/96/459250296.db2.gz	GYRNESOLIVQEHM-UYAOXDASSA-N	0	3	328.456	3.159	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1N[C@H](C)C(=O)N[C@@H](C)c1cccc2ccccc21	ZINC000579917351	459253207	/nfs/dbraw/zinc/25/32/07/459253207.db2.gz	UEFXVUOTUFEETR-BWMZKYQQSA-N	0	3	338.451	3.339	20	30		EGEDHN
CCc1ccccc1[C@H](CNC(=O)C(C)C#N)NC(=O)OC(C)(C)C	ZINC000496638187	459269132	/nfs/dbraw/zinc/26/91/32/459269132.db2.gz	BAWDKQIGWHOPNL-BBRMVZONSA-N	0	3	345.443	3.091	20	30		EGEDHN
N#Cc1ccc(CCN2CCC(NC(=O)c3ccsc3)CC2)cc1	ZINC000595295454	459269161	/nfs/dbraw/zinc/26/91/61/459269161.db2.gz	YRGSZXOOVWSRBC-UHFFFAOYSA-N	0	3	339.464	3.057	20	30		EGEDHN
CN(C)CCN(Cc1cnc(C2CC2)s1)Cc1ccc(C#N)cc1	ZINC000568328024	459269470	/nfs/dbraw/zinc/26/94/70/459269470.db2.gz	BYBDOCXAGTZJKM-UHFFFAOYSA-N	0	3	340.496	3.456	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN1[C@@H]2CC[C@H]1CCN(C)C2	ZINC000559641368	459269888	/nfs/dbraw/zinc/26/98/88/459269888.db2.gz	WOIRJYPBHRANEI-JKSUJKDBSA-N	0	3	345.512	3.072	20	30		EGEDHN
C=C(C)Cn1c(CC(C)C)nnc1N1CCN(C2CCCC2)CC1	ZINC000581714199	459276964	/nfs/dbraw/zinc/27/69/64/459276964.db2.gz	HYFZCXMCOKZAMV-UHFFFAOYSA-N	0	3	331.508	3.117	20	30		EGEDHN
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCc1cccc(C#N)c1F	ZINC000560178448	459309602	/nfs/dbraw/zinc/30/96/02/459309602.db2.gz	OAHCBCPDDHHFDV-RDTXWAMCSA-N	0	3	340.398	3.207	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)CC2	ZINC000496758007	459314149	/nfs/dbraw/zinc/31/41/49/459314149.db2.gz	MTHIAIRKERMGQC-UHFFFAOYSA-N	0	3	341.455	3.391	20	30		EGEDHN
CCCN(CC(=O)Nc1cc(Cl)ccc1Cl)C(=O)C(C)C#N	ZINC000523686490	459322866	/nfs/dbraw/zinc/32/28/66/459322866.db2.gz	NILFGQYCLKJHHG-JTQLQIEISA-N	0	3	342.226	3.330	20	30		EGEDHN
N#Cc1ccncc1N1CCN(CC[C@H]2CCc3ccccc32)CC1	ZINC000595502921	459327851	/nfs/dbraw/zinc/32/78/51/459327851.db2.gz	XLBYNAPDZFEJEI-GOSISDBHSA-N	0	3	332.451	3.195	20	30		EGEDHN
N#Cc1ccc2c(c1)CCN2C(=O)c1ccc(CN2CCCC2)cc1	ZINC000591312906	459351396	/nfs/dbraw/zinc/35/13/96/459351396.db2.gz	VZHXXLUAMOAISE-UHFFFAOYSA-N	0	3	331.419	3.357	20	30		EGEDHN
COC1(CN2CCN(c3ccc(C#N)cc3F)CC2)CCCCC1	ZINC000483262693	459354661	/nfs/dbraw/zinc/35/46/61/459354661.db2.gz	QUOMBOMYLXMPBR-UHFFFAOYSA-N	0	3	331.435	3.169	20	30		EGEDHN
CC(C)(C)N1C[C@@H](C(=O)N2CCC(CC#N)CC2)[C@H](C(F)(F)F)C1	ZINC000582375665	459355894	/nfs/dbraw/zinc/35/58/94/459355894.db2.gz	APZFUTLEUTVUSF-ZIAGYGMSSA-N	0	3	345.409	3.047	20	30		EGEDHN
C[C@]1(C#N)CCCN(C(=O)N[C@H](CN)c2ccc3ccccc3c2)C1	ZINC000591360003	459361596	/nfs/dbraw/zinc/36/15/96/459361596.db2.gz	BUTANVHFSXEQJN-UYAOXDASSA-N	0	3	336.439	3.175	20	30		EGEDHN
C=CC[C@H](CC)NC(=O)NC[C@@H](c1cccc(OC)c1)N1CCCC1	ZINC000537401413	459364755	/nfs/dbraw/zinc/36/47/55/459364755.db2.gz	SDJQKFAUWFABKD-HKUYNNGSSA-N	0	3	345.487	3.486	20	30		EGEDHN
N#CC[C@@H]1CCCN(C[C@@H](O)CO[C@@H]2CCCc3ccccc32)C1	ZINC000595611910	459366449	/nfs/dbraw/zinc/36/64/49/459366449.db2.gz	OXNFWIJARGWGMM-ILZDJORESA-N	0	3	328.456	3.067	20	30		EGEDHN
C[C@@H](Nc1ccc(C(F)(F)F)c(C#N)n1)[C@@H](c1ccccc1)N(C)C	ZINC000569233762	459418489	/nfs/dbraw/zinc/41/84/89/459418489.db2.gz	AVYBGKHFWBYUMJ-PXAZEXFGSA-N	0	3	348.372	3.497	20	30		EGEDHN
CC(C)(C)c1ccc(OC[C@H](O)CN2CCC(CC#N)CC2)cc1	ZINC000541020799	459419588	/nfs/dbraw/zinc/41/95/88/459419588.db2.gz	QHYNQKHHGCSTFX-GOSISDBHSA-N	0	3	330.472	3.349	20	30		EGEDHN
Cc1ccc(C)c(OC[C@H](O)CN[C@@H]2CCc3cc(C#N)ccc32)c1	ZINC000591763856	459430429	/nfs/dbraw/zinc/43/04/29/459430429.db2.gz	MYBCCKSSLXLKHI-UYAOXDASSA-N	0	3	336.435	3.192	20	30		EGEDHN
Cc1ccc(OC[C@H](O)CN[C@@H]2CCc3cc(C#N)ccc32)c(C)c1	ZINC000591763953	459431163	/nfs/dbraw/zinc/43/11/63/459431163.db2.gz	SOGJLNFLTRKOOW-UYAOXDASSA-N	0	3	336.435	3.192	20	30		EGEDHN
N#Cc1cc(N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)ccn1	ZINC000561228584	459433242	/nfs/dbraw/zinc/43/32/42/459433242.db2.gz	DGFRAHDZJJWMIG-MRXNPFEDSA-N	0	3	346.356	3.080	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN1CCC([C@H]2CCCCO2)CC1	ZINC000595790511	459443288	/nfs/dbraw/zinc/44/32/88/459443288.db2.gz	WIEKFRZHIRQXEM-MRXNPFEDSA-N	0	3	347.484	3.229	20	30		EGEDHN
CN(Cc1ccccc1)[C@H]1CCN(c2c(C#N)cccc2[N+](=O)[O-])C1	ZINC000591820755	459447723	/nfs/dbraw/zinc/44/77/23/459447723.db2.gz	NXXHKGVPYWGILF-KRWDZBQOSA-N	0	3	336.395	3.177	20	30		EGEDHN
CN1CCN(c2ccc3cc(C#N)ccc3n2)C[C@@H]1Cc1ccccc1	ZINC000561426343	459451325	/nfs/dbraw/zinc/45/13/25/459451325.db2.gz	VHFQTXJWZVASOC-FQEVSTJZSA-N	0	3	342.446	3.470	20	30		EGEDHN
Cc1ccccc1OC[C@@H](O)CN[C@@H]1CCCc2cc(C#N)ccc21	ZINC000569569173	459473100	/nfs/dbraw/zinc/47/31/00/459473100.db2.gz	WOSYYBDNRTVKQX-AZUAARDMSA-N	0	3	336.435	3.274	20	30		EGEDHN
CCCN(C(=O)N[C@@H](CCC#N)c1ccccc1)[C@@H]1CCN(C)C1	ZINC000591992389	459507790	/nfs/dbraw/zinc/50/77/90/459507790.db2.gz	LGGSXOKCNVNADQ-MSOLQXFVSA-N	0	3	328.460	3.157	20	30		EGEDHN
N#CC[C@@]1(O)CCN(CCC(=O)Nc2ccccc2-c2ccccc2)C1	ZINC000592149547	459537759	/nfs/dbraw/zinc/53/77/59/459537759.db2.gz	QUCWGMRCVBKWJH-OAQYLSRUSA-N	0	3	349.434	3.033	20	30		EGEDHN
CN(C)CCN(Cc1cccs1)c1nc(C#N)c(Cl)s1	ZINC000596161717	459543598	/nfs/dbraw/zinc/54/35/98/459543598.db2.gz	ZCEAVBWDCHPSQD-UHFFFAOYSA-N	0	3	326.878	3.298	20	30		EGEDHN
Cc1ccc(C)c(OC[C@@H](O)CN(C)Cc2ccc(C#N)cc2)c1C	ZINC000497586128	459545375	/nfs/dbraw/zinc/54/53/75/459545375.db2.gz	WQUMXUZMAVQRTR-FQEVSTJZSA-N	0	3	338.451	3.355	20	30		EGEDHN
COc1ccc([C@@H](CCC#N)NC[C@@H](CO)Cc2ccco2)cc1	ZINC000562499114	459572335	/nfs/dbraw/zinc/57/23/35/459572335.db2.gz	YUZISRUPVKFRRL-HNAYVOBHSA-N	0	3	328.412	3.074	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H](c2ccc(Cl)cc2)C2CC2)CC1	ZINC000490575675	459580385	/nfs/dbraw/zinc/58/03/85/459580385.db2.gz	SYIUAYAJVQWBMN-SFHVURJKSA-N	0	3	330.859	3.253	20	30		EGEDHN
C[C@H](NC(C)(C)CNC(=O)N1CCC[C@@H](CC#N)C1)c1ccccc1	ZINC000596305423	459589686	/nfs/dbraw/zinc/58/96/86/459589686.db2.gz	UQVDRQHSCWJTOK-IRXDYDNUSA-N	0	3	342.487	3.451	20	30		EGEDHN
C[C@@H]1C[C@@H](c2ccc(F)cc2)CN1Cc1cnc2c(C#N)cnn2c1	ZINC000572961601	459603040	/nfs/dbraw/zinc/60/30/40/459603040.db2.gz	MJHSYVRFJJDCFE-CZUORRHYSA-N	0	3	335.386	3.118	20	30		EGEDHN
COC(=O)c1cc2c(o1)c(OC)ccc2CN1CCC(CC#N)CC1	ZINC000542854845	459604426	/nfs/dbraw/zinc/60/44/26/459604426.db2.gz	WPMHZTUOOAPVFP-UHFFFAOYSA-N	0	3	342.395	3.354	20	30		EGEDHN
CC(C)(C)c1ccc(OC[C@@H](O)CNCc2ccc(C#N)s2)cc1	ZINC000572993312	459608957	/nfs/dbraw/zinc/60/89/57/459608957.db2.gz	XPHNDEPBFHIWFY-HNNXBMFYSA-N	0	3	344.480	3.447	20	30		EGEDHN
C[C@@H](C#N)CN[C@H](C)CCc1ccc(I)cc1	ZINC000527526561	459655620	/nfs/dbraw/zinc/65/56/20/459655620.db2.gz	IOBRMVPBUOERKN-NWDGAFQWSA-N	0	3	342.224	3.362	20	30		EGEDHN
C#C[C@H](CCC)NC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C	ZINC000491430951	459626361	/nfs/dbraw/zinc/62/63/61/459626361.db2.gz	ZWPWCLUGZNAAPR-QGZVFWFLSA-N	0	3	342.487	3.060	20	30		EGEDHN
C=CCN1CC[C@H](N[C@H]2CCCC[C@@H]2Oc2ccccc2C)C1=O	ZINC000499647631	459644430	/nfs/dbraw/zinc/64/44/30/459644430.db2.gz	QPDWKCYCINGDHE-LNLFQRSKSA-N	0	3	328.456	3.062	20	30		EGEDHN
CN(C)C/C=C\C(=O)Nc1ccc(OCc2cccc(C#N)c2)cc1	ZINC000491883624	459683582	/nfs/dbraw/zinc/68/35/82/459683582.db2.gz	LCWABAYYFQHSER-DAXSKMNVSA-N	0	3	335.407	3.194	20	30		EGEDHN
N#CCC[C@@H](C#N)CN[C@@H]1CCCN(Cc2ccc(F)cc2Cl)C1	ZINC000562993756	459688632	/nfs/dbraw/zinc/68/86/32/459688632.db2.gz	NLHNNIJVPYACQN-WMLDXEAASA-N	0	3	348.853	3.477	20	30		EGEDHN
COc1cccc([C@H](CNCc2ccc(OC)c(C#N)c2)OC)c1	ZINC000527732917	459717546	/nfs/dbraw/zinc/71/75/46/459717546.db2.gz	BPJQJAORPRYZGN-IBGZPJMESA-N	0	3	326.396	3.053	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC(=O)N[C@H](C)c1ccc2c(c1)CCCC2	ZINC000565992038	459790200	/nfs/dbraw/zinc/79/02/00/459790200.db2.gz	UTKIBKUGPPMGCN-YSGRDPCXSA-N	0	3	342.483	3.066	20	30		EGEDHN
N#Cc1nn(C[C@@H]2CN(Cc3ccccc3)CCCO2)c2ccccc12	ZINC000584735548	459794118	/nfs/dbraw/zinc/79/41/18/459794118.db2.gz	QVMBUOGTPSYSLA-SFHVURJKSA-N	0	3	346.434	3.199	20	30		EGEDHN
CCC(C#N)(CC)c1nc(-c2cccc(OCCN(C)C)c2)no1	ZINC000528142748	459799941	/nfs/dbraw/zinc/79/99/41/459799941.db2.gz	XOGMZHMUMPFXAA-UHFFFAOYSA-N	0	3	328.416	3.258	20	30		EGEDHN
CN(CCC#N)C[C@@H](O)CN[C@@H](CC(C)(C)C)c1ccc(F)cc1	ZINC000566106284	459806229	/nfs/dbraw/zinc/80/62/29/459806229.db2.gz	LYKIPTWCQBDICS-ROUUACIJSA-N	0	3	335.467	3.099	20	30		EGEDHN
Cc1cc(NC(=O)[C@@]2(C#N)C[C@H]2C)cc(N2CCN(C(C)C)CC2)c1	ZINC000584821247	459807664	/nfs/dbraw/zinc/80/76/64/459807664.db2.gz	ZMTPIQPQJYNORG-OXQOHEQNSA-N	0	3	340.471	3.014	20	30		EGEDHN
C[C@H]1C[C@H](c2ccccc2)CCN1Cc1cnc2c(C#N)cnn2c1	ZINC000584840283	459811702	/nfs/dbraw/zinc/81/17/02/459811702.db2.gz	VFIVEMQJGWHWKA-MAUKXSAKSA-N	0	3	331.423	3.369	20	30		EGEDHN
COCc1ccc(NC(=O)NC[C@H](C)N2CCCC[C@@H]2C)cc1C#N	ZINC000529211934	459825723	/nfs/dbraw/zinc/82/57/23/459825723.db2.gz	QCEUYVKXGOAGTO-GJZGRUSLSA-N	0	3	344.459	3.089	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CCC(SC)CC1)C(C)C	ZINC000602234040	459873950	/nfs/dbraw/zinc/87/39/50/459873950.db2.gz	LUXIPQNDDHEHND-QGZVFWFLSA-N	0	3	339.549	3.222	20	30		EGEDHN
C[C@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccc2c(c1)OCC(=O)N2	ZINC000586793866	459875215	/nfs/dbraw/zinc/87/52/15/459875215.db2.gz	JMHZVYBSBFQYIC-SJCJKPOMSA-N	0	3	333.391	3.227	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)c(Cl)c1)c1ccc2c(c1)OCC(=O)N2	ZINC000586794330	459875286	/nfs/dbraw/zinc/87/52/86/459875286.db2.gz	ZSEQMEJTCRWFON-NSHDSACASA-N	0	3	341.798	3.393	20	30		EGEDHN
N#Cc1ccc(CNC(=O)CN2CCC[C@@H](c3ccccc3)CC2)cc1	ZINC000608977449	459897748	/nfs/dbraw/zinc/89/77/48/459897748.db2.gz	LACPZAWXLNQNEE-OAQYLSRUSA-N	0	3	347.462	3.444	20	30		EGEDHN
CO[C@H](CNC(=O)C(C#N)CCc1ccccc1)C1CCCCC1	ZINC000598437841	459898801	/nfs/dbraw/zinc/89/88/01/459898801.db2.gz	QJMDTWFINVRZPQ-RBUKOAKNSA-N	0	3	328.456	3.470	20	30		EGEDHN
CN(C)[C@@H](CNC(=O)c1cc2ccccc2n1CC#N)c1ccccc1	ZINC000609160025	459915297	/nfs/dbraw/zinc/91/52/97/459915297.db2.gz	WMWWHQYVYCDVMW-FQEVSTJZSA-N	0	3	346.434	3.198	20	30		EGEDHN
CN(C)Cc1ccc(NC(=O)c2cc3ccccc3n2CC#N)cc1	ZINC000609161436	459916660	/nfs/dbraw/zinc/91/66/60/459916660.db2.gz	RKLQWRBQEFUEPG-UHFFFAOYSA-N	0	3	332.407	3.479	20	30		EGEDHN
C[C@@H](CNC(=O)c1cc2ccccc2n1CC#N)N1CCC[C@H](C)C1	ZINC000609163463	459916908	/nfs/dbraw/zinc/91/69/08/459916908.db2.gz	MHDJDQYDKCRCEK-HOTGVXAUSA-N	0	3	338.455	3.015	20	30		EGEDHN
C=CCn1c(-c2cc(C)cs2)nnc1N1CCCN(C(C)C)CC1	ZINC000624853157	459934676	/nfs/dbraw/zinc/93/46/76/459934676.db2.gz	CQWYNESEJGFLKR-UHFFFAOYSA-N	0	3	345.516	3.422	20	30		EGEDHN
CC[C@@H]1CCCCN1CCNC(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1	ZINC000575149720	459938462	/nfs/dbraw/zinc/93/84/62/459938462.db2.gz	QLRGGVJBMOGKHQ-CEXWTWQISA-N	0	3	325.456	3.042	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCN2CCCc3sccc3C2)cc1	ZINC000609322627	459943827	/nfs/dbraw/zinc/94/38/27/459943827.db2.gz	HRARQCKMUYVUAO-UHFFFAOYSA-N	0	3	325.437	3.397	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN1CCCN(Cc2ccc(Cl)cc2)CC1	ZINC000598585976	459953471	/nfs/dbraw/zinc/95/34/71/459953471.db2.gz	CIIKFVXUSJPTOA-GOSISDBHSA-N	0	3	349.906	3.148	20	30		EGEDHN
CCCOc1ccc([C@H](C)NC[C@@H](O)CC(C)(C)C#N)cc1OC	ZINC000598603658	459960375	/nfs/dbraw/zinc/96/03/75/459960375.db2.gz	YDNNXROTBAXMBK-HOCLYGCPSA-N	0	3	334.460	3.435	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)c1ncc(C#N)cc1C)c1ccccc1	ZINC000575334483	459962207	/nfs/dbraw/zinc/96/22/07/459962207.db2.gz	QUQKQEOGJLBGHY-SFHVURJKSA-N	0	3	336.439	3.075	20	30		EGEDHN
C[C@@H]1C[C@H](NC2CCN(Cc3cccc(C#N)c3)CC2)c2nccn21	ZINC000593724686	459964150	/nfs/dbraw/zinc/96/41/50/459964150.db2.gz	GOSAKHWOQCROMA-BEFAXECRSA-N	0	3	335.455	3.015	20	30		EGEDHN
CN(Cc1ccc(OCC(F)(F)F)cc1)C[C@@H](O)CC(C)(C)C#N	ZINC000598617490	459965592	/nfs/dbraw/zinc/96/55/92/459965592.db2.gz	SKCUJDKACXINIZ-AWEZNQCLSA-N	0	3	344.377	3.360	20	30		EGEDHN
COc1ccc(CN(C)C)cc1N[C@@H](C)CC1(C#N)CCOCC1	ZINC000602489907	459965628	/nfs/dbraw/zinc/96/56/28/459965628.db2.gz	BFYBISZFWIYPCD-HNNXBMFYSA-N	0	3	331.460	3.268	20	30		EGEDHN
CC(C)[C@H](NC[C@@H]1CNc2c(C#N)cnn2C1)c1ccc(F)cc1F	ZINC000575399356	459969345	/nfs/dbraw/zinc/96/93/45/459969345.db2.gz	QHSDJFDITIDUHY-PXAZEXFGSA-N	0	3	345.397	3.062	20	30		EGEDHN
CC(C)CN(Cc1ccc(C#N)cc1)C(=O)c1cccc2c1CNC2	ZINC000602525582	459982805	/nfs/dbraw/zinc/98/28/05/459982805.db2.gz	APIJRYDKXGFVPY-UHFFFAOYSA-N	0	3	333.435	3.460	20	30		EGEDHN
CN1CCC(N(C(=O)Cc2ccc(C#N)cc2)c2ccccc2)CC1	ZINC000609566653	459983383	/nfs/dbraw/zinc/98/33/83/459983383.db2.gz	AKRUIZMKNOBIGF-UHFFFAOYSA-N	0	3	333.435	3.228	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)C(=O)NC[C@H](c1ccccc1)N(C)C	ZINC000593943174	460022231	/nfs/dbraw/zinc/02/22/31/460022231.db2.gz	KFGVTSOVNDJKDO-OXQOHEQNSA-N	0	3	335.451	3.156	20	30		EGEDHN
CN(C)CCN(Cc1cccc(Cl)c1)Cc1cccc(C#N)n1	ZINC000602656014	460046681	/nfs/dbraw/zinc/04/66/81/460046681.db2.gz	KCPGRXHLLVDOOH-UHFFFAOYSA-N	0	3	328.847	3.170	20	30		EGEDHN
N#Cc1ccc(CC(=O)N(CCN2CCCC2)c2ccccc2)cc1	ZINC000610051056	460054242	/nfs/dbraw/zinc/05/42/42/460054242.db2.gz	BDKQEEWAACNBTK-UHFFFAOYSA-N	0	3	333.435	3.230	20	30		EGEDHN
Cc1cc(CNC2CCN(Cc3cccc(C#N)c3)CC2)sn1	ZINC000602707998	460077237	/nfs/dbraw/zinc/07/72/37/460077237.db2.gz	VSXYHBZMQMBKLK-UHFFFAOYSA-N	0	3	326.469	3.077	20	30		EGEDHN
N#Cc1ccc(NC(=O)N[C@@H]2CCCN3CCCC[C@H]23)cc1Cl	ZINC000594058753	460080466	/nfs/dbraw/zinc/08/04/66/460080466.db2.gz	QTBZWLHUKVVIAM-HZPDHXFCSA-N	0	3	332.835	3.350	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccc3c(c2)CCCCC3=O)nc(C)n1	ZINC000576199894	460088367	/nfs/dbraw/zinc/08/83/67/460088367.db2.gz	UASXPJVTCJMZMU-QGZVFWFLSA-N	0	3	333.391	3.493	20	30		EGEDHN
N#CC[C@H](CC(=O)N[C@@H]1CCCN2CCCC[C@@H]12)c1ccccc1	ZINC000594199012	460145449	/nfs/dbraw/zinc/14/54/49/460145449.db2.gz	XTHOMJQFIQPPFM-QRVBRYPASA-N	0	3	325.456	3.207	20	30		EGEDHN
COc1ccc(CN(Cc2ccc(OC)cc2)C(=O)C(C)C#N)cc1	ZINC000610426033	460148315	/nfs/dbraw/zinc/14/83/15/460148315.db2.gz	QWJIHFCOCMXRPH-OAHLLOKOSA-N	0	3	338.407	3.392	20	30		EGEDHN
N#CC[C@H]1CCCN(C[C@H](O)COc2cc(Cl)cc(Cl)c2)C1	ZINC000602883754	460169273	/nfs/dbraw/zinc/16/92/73/460169273.db2.gz	MGLJBQQFUQECHB-DOMZBBRYSA-N	0	3	343.254	3.359	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)C(=O)N1CCN(CCC(C)(C)C)CC1	ZINC000594245218	460170641	/nfs/dbraw/zinc/17/06/41/460170641.db2.gz	QICOHHNKZCYXFO-QGZVFWFLSA-N	0	3	341.499	3.317	20	30		EGEDHN
CN(CCc1ccccc1)[C@@H]1CCN(C(=O)c2ccc(CC#N)cc2)C1	ZINC000598195628	460200235	/nfs/dbraw/zinc/20/02/35/460200235.db2.gz	PWFFOTFFADYFKF-OAQYLSRUSA-N	0	3	347.462	3.142	20	30		EGEDHN
Cc1ccc([C@@H]2C[C@H]2NC(=O)C(C#N)Cc2ccc(C#N)cc2)cc1	ZINC000576825071	460220533	/nfs/dbraw/zinc/22/05/33/460220533.db2.gz	JQXUNAVXJZVIAF-HSALFYBXSA-N	0	3	329.403	3.221	20	30		EGEDHN
Cc1nc(C)c([C@H](C)N(C)C[C@H](O)COc2ccccc2C#N)s1	ZINC000599294732	460220736	/nfs/dbraw/zinc/22/07/36/460220736.db2.gz	HNPYLGXHIRIGBD-BBRMVZONSA-N	0	3	345.468	3.064	20	30		EGEDHN
CC(C)(NC(=O)[C@@H](N)CCCCC#N)c1cccc(Cl)c1F	ZINC000594446995	460223585	/nfs/dbraw/zinc/22/35/85/460223585.db2.gz	CWCDERDAFDQHCX-ZDUSSCGKSA-N	0	3	325.815	3.242	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CNC1(c2ccc(Cl)cc2)CC1	ZINC000599359929	460238934	/nfs/dbraw/zinc/23/89/34/460238934.db2.gz	JYACOWKKACUIQC-QGZVFWFLSA-N	0	3	342.826	3.230	20	30		EGEDHN
N#CCc1ccc(CN[C@@H](Cc2ccccc2)[C@H](O)C(F)(F)F)cc1	ZINC000603146470	460254076	/nfs/dbraw/zinc/25/40/76/460254076.db2.gz	SGJDDOFSRMZWFJ-ROUUACIJSA-N	0	3	348.368	3.377	20	30		EGEDHN
CC[C@H](CN1CCCC1)NC(=O)Nc1ccc(OC(C)C)c(C#N)c1	ZINC000610936281	460263213	/nfs/dbraw/zinc/26/32/13/460263213.db2.gz	NPVFHHHNWNSCNC-MRXNPFEDSA-N	0	3	344.459	3.341	20	30		EGEDHN
COc1cc(C#N)ccc1CN1C[C@@H]2CN(c3ccccc3)C[C@@H]2C1	ZINC000611235478	460313614	/nfs/dbraw/zinc/31/36/14/460313614.db2.gz	GXQDBZFKCFTFFN-KDURUIRLSA-N	0	3	333.435	3.135	20	30		EGEDHN
CCC[C@H](C#N)NC(=O)c1ccccc1OCCN1CCCC[C@@H]1C	ZINC000611286022	460328710	/nfs/dbraw/zinc/32/87/10/460328710.db2.gz	AJIVDHGJPZWTAK-DLBZAZTESA-N	0	3	343.471	3.362	20	30		EGEDHN
Cc1cc2ncn(C[C@H](O)CN[C@H](C)c3cccc(C#N)c3)c2cc1C	ZINC000611386857	460349962	/nfs/dbraw/zinc/34/99/62/460349962.db2.gz	AXPJGJYCBHYIDK-VQIMIIECSA-N	0	3	348.450	3.237	20	30		EGEDHN
C[C@@H](NC[C@@H](O)COCc1ccc(Cl)cc1)c1cccc(C#N)c1	ZINC000611388004	460351949	/nfs/dbraw/zinc/35/19/49/460351949.db2.gz	WCGMJPRBQIUDBW-AUUYWEPGSA-N	0	3	344.842	3.440	20	30		EGEDHN
C[C@H](NCCCS(=O)(=O)c1ccc(F)cc1)c1cccc(C#N)c1	ZINC000611389115	460352226	/nfs/dbraw/zinc/35/22/26/460352226.db2.gz	XGHCKGGFTLFIFO-AWEZNQCLSA-N	0	3	346.427	3.212	20	30		EGEDHN
COCCOc1ccc(CN[C@@H]2CCCc3cc(C#N)ccc32)cn1	ZINC000611390893	460352733	/nfs/dbraw/zinc/35/27/33/460352733.db2.gz	WBHNCMJOYQVGEK-LJQANCHMSA-N	0	3	337.423	3.146	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CNC2(c3ccc(F)cc3)CCC2)cc1	ZINC000604564427	460449426	/nfs/dbraw/zinc/44/94/26/460449426.db2.gz	HEVMZMZTNBRULD-SFHVURJKSA-N	0	3	340.398	3.106	20	30		EGEDHN
N#Cc1ccc2c(c1)CCCC[C@@H]2NC[C@H](n1cncn1)C(F)(F)F	ZINC000601294680	460780319	/nfs/dbraw/zinc/78/03/19/460780319.db2.gz	PNATZFLGZIKWBF-HOTGVXAUSA-N	0	3	349.360	3.310	20	30		EGEDHN
Cc1ccccc1[C@@H]([C@@H](C)NC(=O)c1ccccc1CC#N)N(C)C	ZINC000601521819	460824616	/nfs/dbraw/zinc/82/46/16/460824616.db2.gz	XYYRUNUYDRYCPK-OXQOHEQNSA-N	0	3	335.451	3.482	20	30		EGEDHN
C=CC[C@H]1CCCN(Cc2c(C)nn(C)c2OCC(F)(F)F)C1	ZINC000668493589	461302493	/nfs/dbraw/zinc/30/24/93/461302493.db2.gz	PHYVDZBTVUGOFJ-ZDUSSCGKSA-N	0	3	331.382	3.458	20	30		EGEDHN
CO[C@H](CNCC#Cc1ccc(C(F)(F)F)cc1)C1CCOCC1	ZINC000638898467	461642592	/nfs/dbraw/zinc/64/25/92/461642592.db2.gz	OWLLXDYGRKMEBS-QGZVFWFLSA-N	0	3	341.373	3.088	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2nc3c(s2)CCC3(C)C)CC1	ZINC000643266485	461658112	/nfs/dbraw/zinc/65/81/12/461658112.db2.gz	FQCGZWGAJOKBAY-UHFFFAOYSA-N	0	3	334.489	3.139	20	30		EGEDHN
C=CCN(CCc1ccco1)C(=O)N[C@H](C)CN1CCC(C)CC1	ZINC000666756146	461790661	/nfs/dbraw/zinc/79/06/61/461790661.db2.gz	HCVPGVAWMOBBDY-QGZVFWFLSA-N	0	3	333.476	3.140	20	30		EGEDHN
C=CCC1(NC(=O)Nc2ccccc2CCN(C)C)CCOCC1	ZINC000666839096	461826730	/nfs/dbraw/zinc/82/67/30/461826730.db2.gz	MPOKZKCMHRQVKQ-UHFFFAOYSA-N	0	3	331.460	3.038	20	30		EGEDHN
OC[C@@H]1CCCCCN1CC#Cc1ccc(OC(F)(F)F)cc1	ZINC000653783624	461857383	/nfs/dbraw/zinc/85/73/83/461857383.db2.gz	MUAUSKHRHMIITC-HNNXBMFYSA-N	0	3	327.346	3.174	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCC([C@@H]3CCCCO3)CC2)CC1	ZINC000660597499	461871109	/nfs/dbraw/zinc/87/11/09/461871109.db2.gz	QDWDVVGVOHOWSU-IBGZPJMESA-N	0	3	349.519	3.018	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)NCCS(=O)(=O)c1ccccc1	ZINC000644672204	462031609	/nfs/dbraw/zinc/03/16/09/462031609.db2.gz	DJGCMJLBODMPNA-SFHVURJKSA-N	0	3	329.465	3.237	20	30		EGEDHN
C=CCN(CCC(=O)Nc1ccc(Cl)cc1F)[C@H](C)COC	ZINC000661242627	462167835	/nfs/dbraw/zinc/16/78/35/462167835.db2.gz	DHOXLHJBGASRGE-GFCCVEGCSA-N	0	3	328.815	3.331	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCN(CCOc3cccc(Cl)c3)C2)nc1	ZINC000428786988	518196711	/nfs/dbraw/zinc/19/67/11/518196711.db2.gz	SYOLUOKOGXPMOL-KRWDZBQOSA-N	0	3	343.814	3.139	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(Cc2ccccc2)CC(F)F)CC1	ZINC000177820973	526424992	/nfs/dbraw/zinc/42/49/92/526424992.db2.gz	RGXDITZZLWJSRX-UHFFFAOYSA-N	0	3	337.414	3.114	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](C)c2cccc(OC(C)C)c2)CC1	ZINC000171712316	526438720	/nfs/dbraw/zinc/43/87/20/526438720.db2.gz	ZPKUVCMJORTECB-MRXNPFEDSA-N	0	3	345.487	3.484	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](c2ccc(OC)cc2)C(C)C)CC1	ZINC000171704277	526440330	/nfs/dbraw/zinc/44/03/30/526440330.db2.gz	XLCMNTYYTXGZNY-IBGZPJMESA-N	0	3	345.487	3.342	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(OC(F)(F)F)cc2)CC1	ZINC000171738758	526441555	/nfs/dbraw/zinc/44/15/55/526441555.db2.gz	SXYIGPIHMQOCAO-UHFFFAOYSA-N	0	3	343.349	3.357	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)COc2cccc3ccccc32)CC1	ZINC000171730129	526581871	/nfs/dbraw/zinc/58/18/71/526581871.db2.gz	SRWYGTPDPPDBLN-UHFFFAOYSA-N	0	3	338.451	3.375	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H]2CCCOc3cc(Cl)ccc32)CC1	ZINC000179629856	526932093	/nfs/dbraw/zinc/93/20/93/526932093.db2.gz	KYBKLARMWWMRGZ-KRWDZBQOSA-N	0	3	346.858	3.015	20	30		EGEDHN
COc1cc(OC)c2ncc(C#N)c(N[C@H]3CCCN(C)[C@@H]3C)c2c1	ZINC000342829661	536869862	/nfs/dbraw/zinc/86/98/62/536869862.db2.gz	FCAUWJZIHCRZFS-WBMJQRKESA-N	0	3	340.427	3.018	20	30		EGEDHN
C=CCC[C@@H](NC(=O)NCCN1CCC(OC)CC1)c1ccccc1	ZINC000131037043	546801989	/nfs/dbraw/zinc/80/19/89/546801989.db2.gz	IERWHTNOKUCYIS-LJQANCHMSA-N	0	3	345.487	3.104	20	30		EGEDHN
CC#CCCN1CCC[C@H](c2nnc3ccc(C(F)(F)F)cn32)C1	ZINC000156513767	546912331	/nfs/dbraw/zinc/91/23/31/546912331.db2.gz	BDTQGWZAPMYPQD-ZDUSSCGKSA-N	0	3	336.361	3.341	20	30		EGEDHN
O=C(NCc1ccc(CN2CCC(O)CC2)cc1)C1CCSCC1	ZINC000329468857	547498260	/nfs/dbraw/zinc/49/82/60/547498260.db2.gz	XQFRLYONTQKSCT-UHFFFAOYSA-N	0	3	348.512	3.243	20	30		EGEDHN
C=C(C)CN1CCC(Nc2nn3c(C)nnc3c3ccccc32)CC1	ZINC000672210091	548408578	/nfs/dbraw/zinc/40/85/78/548408578.db2.gz	RUOHBUQVATXPAQ-UHFFFAOYSA-N	0	3	336.443	3.038	20	30		EGEDHN
C=C(CNC(=O)[C@H]1CCCN(Cc2cccnc2)C1)c1ccccc1	ZINC000673341748	548550242	/nfs/dbraw/zinc/55/02/42/548550242.db2.gz	QISJIFLEZYMANW-FQEVSTJZSA-N	0	3	335.451	3.123	20	30		EGEDHN
C=C(C)COCCNC(=O)N[C@H](CN1CCCCC1)c1ccccc1	ZINC000675575318	548939910	/nfs/dbraw/zinc/93/99/10/548939910.db2.gz	QOEWQMGGMFOXMT-LJQANCHMSA-N	0	3	345.487	3.106	20	30		EGEDHN
C[C@H](NC(=O)C(C)(C)C)C(=O)C(C#N)c1nc2cc(F)ccc2s1	ZINC000730416494	574984509	/nfs/dbraw/zinc/98/45/09/574984509.db2.gz	DPWOQGGRVJNXMY-ONGXEEELSA-N	0	3	347.415	3.162	20	30		EGEDHN
Cc1nn(C)c(C)c1CC(=O)C(C#N)c1nc2cc(F)ccc2s1	ZINC000730416784	574984581	/nfs/dbraw/zinc/98/45/81/574984581.db2.gz	ILTXKIGEGOTKGX-ZDUSSCGKSA-N	0	3	342.399	3.205	20	30		EGEDHN
C=CC[C@H](NC(=O)NC[C@H](C)N1CCCC[C@@H]1C)c1ccncc1	ZINC000734658887	575533117	/nfs/dbraw/zinc/53/31/17/575533117.db2.gz	NDFWHCDCZCNHHX-BQFCYCMXSA-N	0	3	330.476	3.261	20	30		EGEDHN
C#CCCN1CCC(NC(=O)[C@H](C)Oc2cc(C)ccc2Cl)CC1	ZINC000740738805	576621963	/nfs/dbraw/zinc/62/19/63/576621963.db2.gz	NJVMTOUQANTMKE-HNNXBMFYSA-N	0	3	348.874	3.020	20	30		EGEDHN
C#CCCCNC(=O)c1ccccc1OCCN1CCCC[C@@H]1C	ZINC000742787089	576795455	/nfs/dbraw/zinc/79/54/55/576795455.db2.gz	HYFAMVVMMRCJMR-KRWDZBQOSA-N	0	3	328.456	3.083	20	30		EGEDHN
C#CCOc1ccc(F)cc1NC(=O)NC[C@H](C)N1CCC(C)CC1	ZINC000743201369	576803235	/nfs/dbraw/zinc/80/32/35/576803235.db2.gz	PDYJVCSXQQDXKW-HNNXBMFYSA-N	0	3	347.434	3.080	20	30		EGEDHN
C#CCCN1CCC(NC(=O)C[C@H](C)c2ccc(CC)cc2)CC1	ZINC000743490510	576810314	/nfs/dbraw/zinc/81/03/14/576810314.db2.gz	QMILJFCVXXQEKH-KRWDZBQOSA-N	0	3	326.484	3.347	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2c[nH]cc2-c2ccc(F)cc2)CC1	ZINC000743493550	576810369	/nfs/dbraw/zinc/81/03/69/576810369.db2.gz	YXCRLUFMBYQXKG-UHFFFAOYSA-N	0	3	339.414	3.038	20	30		EGEDHN
C=CCNC(=O)C(C#N)C(=O)C[C@H](C)c1ccccc1C(F)(F)F	ZINC000744030855	576819182	/nfs/dbraw/zinc/81/91/82/576819182.db2.gz	NEFMSPMTFWVWJQ-WCQYABFASA-N	0	3	338.329	3.210	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)c1nc2ccccc2o1)NC(=O)c1ccccc1	ZINC000041542773	1291418740	/nfs/dbraw/zinc/41/87/40/1291418740.db2.gz	OTBNVGKFKGQANB-DZGCQCFKSA-N	0	3	347.374	3.213	20	30		EGEDHN
N#CC(C(=O)CCc1ccc(Cl)s1)C(=O)NC1CCCCC1	ZINC000050685339	1291655988	/nfs/dbraw/zinc/65/59/88/1291655988.db2.gz	HAEYKFKYPNCMHA-CYBMUJFWSA-N	0	3	338.860	3.492	20	30		EGEDHN
C#CCCN(CCOC)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000827823242	1292383609	/nfs/dbraw/zinc/38/36/09/1292383609.db2.gz	LZPBODTXXGPUIR-UHFFFAOYSA-N	0	3	328.368	3.327	20	30		EGEDHN
C[C@H](NC[C@@H]1CN(C2CCCCC2)C(=O)O1)c1cccc(C#N)c1	ZINC000828155452	1292437400	/nfs/dbraw/zinc/43/74/00/1292437400.db2.gz	NIRXBPJCVPDFCI-KBXCAEBGSA-N	0	3	327.428	3.362	20	30		EGEDHN
Cc1ccc(O)c(CN2CCN(c3cccc(F)c3C#N)CC2)c1	ZINC000091918268	1292848284	/nfs/dbraw/zinc/84/82/84/1292848284.db2.gz	QOIACIIUMCEWCC-UHFFFAOYSA-N	0	3	325.387	3.034	20	30		EGEDHN
COc1cc(Cl)c(C)cc1NC(=O)C(C#N)C(=O)[C@H](C)SC	ZINC000103330094	1293002056	/nfs/dbraw/zinc/00/20/56/1293002056.db2.gz	PXOVDBUITBSDCY-UWVGGRQHSA-N	0	3	340.832	3.056	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl	ZINC000107409398	1293066756	/nfs/dbraw/zinc/06/67/56/1293066756.db2.gz	HECABHIFSKPFOL-FRRDWIJNSA-N	0	3	339.222	3.330	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)CO[C@@H]2CCCC[C@@H]2C)c1	ZINC000113652639	1293154058	/nfs/dbraw/zinc/15/40/58/1293154058.db2.gz	ZQFWGZQCHAJFQC-YXJHDRRASA-N	0	3	328.412	3.238	20	30		EGEDHN
CC[C@H](C)[C@H](NC(=O)OC)C(=O)C(C#N)c1nc(C(C)C)cs1	ZINC000835200474	1293232426	/nfs/dbraw/zinc/23/24/26/1293232426.db2.gz	KHVIODBBILNRCC-GVXVVHGQSA-N	0	3	337.445	3.213	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)CCc1ccc(C#N)cc1	ZINC000122967862	1293430444	/nfs/dbraw/zinc/43/04/44/1293430444.db2.gz	ALGSFXJUGXSITK-MRXNPFEDSA-N	0	3	328.375	3.254	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CNCc2ccc(C3OCCO3)cc2)cc1	ZINC000123141593	1293435485	/nfs/dbraw/zinc/43/54/85/1293435485.db2.gz	QSVMWPCZIYNDAT-HNNXBMFYSA-N	0	3	338.407	3.313	20	30		EGEDHN
Cc1cccc(CSCC(=O)C(C#N)C(=O)NC2CCCCC2)c1	ZINC000127368664	1293561841	/nfs/dbraw/zinc/56/18/41/1293561841.db2.gz	CSVHQRHCZWAOTL-KRWDZBQOSA-N	0	3	344.480	3.386	20	30		EGEDHN
C[C@](O)(CNC1CC(C#N)(c2ccccc2)C1)c1ccc(F)cc1F	ZINC000127929718	1293577523	/nfs/dbraw/zinc/57/75/23/1293577523.db2.gz	KITHGPKQZPISQK-AJPWXKBRSA-N	0	3	342.389	3.386	20	30		EGEDHN
C[C@@H](Oc1cccc(Cl)c1)C(=O)C(C#N)C(=O)Nc1ccccc1	ZINC000127951937	1293578467	/nfs/dbraw/zinc/57/84/67/1293578467.db2.gz	UDSILVDKGLAIIC-WBMJQRKESA-N	0	3	342.782	3.455	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/C2CCC3(CC2)OCCO3)c([O-])c1	ZINC000127970581	1293579334	/nfs/dbraw/zinc/57/93/34/1293579334.db2.gz	DTHXDNXFXDBNGF-XSFVSMFZSA-N	0	3	332.444	3.343	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)C[C@H]2C=CCC2)cc1Cl	ZINC000130319226	1293652916	/nfs/dbraw/zinc/65/29/16/1293652916.db2.gz	NHQLPSHXQZEBHB-AAEUAGOBSA-N	0	3	332.787	3.352	20	30		EGEDHN
CCOCCCC(=O)C(C#N)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000130498875	1293659081	/nfs/dbraw/zinc/65/90/81/1293659081.db2.gz	WDZYZJQUTGHVLK-ZDUSSCGKSA-N	0	3	343.210	3.457	20	30		EGEDHN
COCCCC(=O)C(C#N)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000130498434	1293659460	/nfs/dbraw/zinc/65/94/60/1293659460.db2.gz	MMOBJYKYLNOBQB-LBPRGKRZSA-N	0	3	329.183	3.067	20	30		EGEDHN
N#CC(C(=O)C=CSCc1ccco1)c1nnc2n1CCCCC2	ZINC000151029060	1293903548	/nfs/dbraw/zinc/90/35/48/1293903548.db2.gz	PIOBBMMCOVPJLS-RNVIBTMRSA-N	0	3	342.424	3.221	20	30		EGEDHN
CN(C)Cc1cccc(C(=O)Nc2ccc(F)cc2OCC#N)c1	ZINC000159556950	1294240121	/nfs/dbraw/zinc/24/01/21/1294240121.db2.gz	GEAFPRIDTWCCQU-UHFFFAOYSA-N	0	3	327.359	3.042	20	30		EGEDHN
C#CCOc1ccc([C@@H](C)N[C@@H](C)C(=O)NCc2ccccc2)cc1	ZINC000161190158	1294286549	/nfs/dbraw/zinc/28/65/49/1294286549.db2.gz	MHFIYMKOBRYKAD-SJORKVTESA-N	0	3	336.435	3.054	20	30		EGEDHN
C[C@@H](OC1CCCCCC1)C(=O)C(C#N)C(=O)Nc1ccccc1	ZINC000162419137	1294314438	/nfs/dbraw/zinc/31/44/38/1294314438.db2.gz	KXWOERJDYZDZKA-PBHICJAKSA-N	0	3	328.412	3.462	20	30		EGEDHN
C[C@@H]1CC[C@H](CCC(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)O1	ZINC000173952281	1294474714	/nfs/dbraw/zinc/47/47/14/1294474714.db2.gz	JMMUOGWXPCQNQN-KCPJHIHWSA-N	0	3	334.803	3.335	20	30		EGEDHN
COc1ccc([C@@H](C)CC(=O)C(C#N)C(=O)NC2CCCCC2)cc1	ZINC000175103583	1294539239	/nfs/dbraw/zinc/53/92/39/1294539239.db2.gz	PRYXCNZNFBKTSN-KBXCAEBGSA-N	0	3	342.439	3.347	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)C[C@H](C)C(=O)c1cccc(F)c1	ZINC000177594948	1294678466	/nfs/dbraw/zinc/67/84/66/1294678466.db2.gz	XXQLPRVCPLMYKK-XJKSGUPXSA-N	0	3	346.402	3.050	20	30		EGEDHN
Cc1cc(C(=O)CON=C(N)C2CCCC2)c(C)n1Cc1ccco1	ZINC000177758000	1294691673	/nfs/dbraw/zinc/69/16/73/1294691673.db2.gz	KJVBHKVMLPXBDX-UHFFFAOYSA-N	0	3	343.427	3.408	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN(C)C[C@@H]2COc3ccccc3O2)cc1	ZINC000179634008	1294809984	/nfs/dbraw/zinc/80/99/84/1294809984.db2.gz	GZLQTLIISDEYMT-CRAIPNDOSA-N	0	3	338.407	3.249	20	30		EGEDHN
CC[C@@H](NCC(=O)N(CCC#N)c1ccc(C)c(C)c1)[C@@H]1CCCO1	ZINC000182241708	1295029829	/nfs/dbraw/zinc/02/98/29/1295029829.db2.gz	KYAQHXPJBSGOFP-MOPGFXCFSA-N	0	3	343.471	3.097	20	30		EGEDHN
Cc1csc(CCNCc2cc(C#N)ccc2Br)n1	ZINC000921525497	1322340026	/nfs/dbraw/zinc/34/00/26/1322340026.db2.gz	SPMPOFQICACYBU-UHFFFAOYSA-N	0	3	336.258	3.418	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1F	ZINC000246353510	1296348573	/nfs/dbraw/zinc/34/85/73/1296348573.db2.gz	KASLVFXBFFEIIS-RRFJBIMHSA-N	0	3	334.366	3.084	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)CC[C@H]2CC[C@@H](C)O2)cc1	ZINC000246468698	1296355547	/nfs/dbraw/zinc/35/55/47/1296355547.db2.gz	ASPOIJXVXLYAFR-KBRIMQKVSA-N	0	3	328.412	3.244	20	30		EGEDHN
N#CCc1ccnc(NC(=O)NC[C@@H](c2ccccc2)N2CCCC2)c1	ZINC000871719228	1296498409	/nfs/dbraw/zinc/49/84/09/1296498409.db2.gz	USCVLLLMDDSQCH-SFHVURJKSA-N	0	3	349.438	3.106	20	30		EGEDHN
C#CCSCCNCc1ccc(OC(F)F)cc1OC(F)F	ZINC000320240166	1297161615	/nfs/dbraw/zinc/16/16/15/1297161615.db2.gz	UYGSMAATMSIUCM-UHFFFAOYSA-N	0	3	337.338	3.345	20	30		EGEDHN
N#CC(C(=O)NCc1ccc(F)cc1F)C(=O)C1CCC=CCC1	ZINC000873522492	1297559829	/nfs/dbraw/zinc/55/98/29/1297559829.db2.gz	AFVPKWSOQLJXOU-HNNXBMFYSA-N	0	3	332.350	3.036	20	30		EGEDHN
C#CCCCNCc1cc(Cl)ccc1I	ZINC000405318768	1297764941	/nfs/dbraw/zinc/76/49/41/1297764941.db2.gz	XZGDYNBYRXZUIV-UHFFFAOYSA-N	0	3	333.600	3.448	20	30		EGEDHN
C[C@H]1CC[C@@H](NCc2ccc(C#N)s2)CN1C(=O)OC(C)(C)C	ZINC000690966932	1298132209	/nfs/dbraw/zinc/13/22/09/1298132209.db2.gz	NGEPXZACOQOISR-QWHCGFSZSA-N	0	3	335.473	3.497	20	30		EGEDHN
C[C@H]1CC[C@H](NCc2ccc(C#N)s2)CN1C(=O)OC(C)(C)C	ZINC000690966934	1298132507	/nfs/dbraw/zinc/13/25/07/1298132507.db2.gz	NGEPXZACOQOISR-STQMWFEESA-N	0	3	335.473	3.497	20	30		EGEDHN
C=C(Cl)C[C@@H](N)C(=O)N(C)Cc1cccc(OC(F)(F)F)c1	ZINC000876704322	1298932005	/nfs/dbraw/zinc/93/20/05/1298932005.db2.gz	YFVOWCKYVJXPTM-GFCCVEGCSA-N	0	3	336.741	3.014	20	30		EGEDHN
CCOc1cc(N2CCN(C)CC2)ccc1NC[C@@H](C)CCC#N	ZINC000876828113	1299019242	/nfs/dbraw/zinc/01/92/42/1299019242.db2.gz	LWODFLKXCJBFDW-INIZCTEOSA-N	0	3	330.476	3.189	20	30		EGEDHN
C=C(Cl)C[C@@H](N)C(=O)N1CCCC[C@@H]1Cc1ccc(OC)cc1	ZINC000876949577	1299082627	/nfs/dbraw/zinc/08/26/27/1299082627.db2.gz	ZBPOEOZRQIRUEC-NVXWUHKLSA-N	0	3	336.863	3.089	20	30		EGEDHN
C=C(Cl)C[C@@H](N)C(=O)NCC1(c2cccc(Cl)c2)CCC1	ZINC000877240366	1299218504	/nfs/dbraw/zinc/21/85/04/1299218504.db2.gz	WDKZQJAFUUJPKN-CQSZACIVSA-N	0	3	327.255	3.348	20	30		EGEDHN
N#Cc1cccc(CNCC[C@H](O)c2ccc(Cl)c(Cl)c2)n1	ZINC000877528447	1299370176	/nfs/dbraw/zinc/37/01/76/1299370176.db2.gz	ACOFFFCHYCZRPD-INIZCTEOSA-N	0	3	336.222	3.473	20	30		EGEDHN
CCOC[C@H]1CCCN(CC[C@](C#N)(C(C)=O)c2ccccc2)C1	ZINC000878106590	1299751748	/nfs/dbraw/zinc/75/17/48/1299751748.db2.gz	JALMAPOJLZFSME-ICSRJNTNSA-N	0	3	328.456	3.176	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(F)c(Cl)c1)C(=O)C1CC(F)(F)C1	ZINC000753801554	1300022367	/nfs/dbraw/zinc/02/23/67/1300022367.db2.gz	KCTBJLKSEXDDDB-SECBINFHSA-N	0	3	330.693	3.172	20	30		EGEDHN
COCCC1CCN(CC[C@@](C#N)(C(C)=O)c2ccccc2)CC1	ZINC000879030213	1300328970	/nfs/dbraw/zinc/32/89/70/1300328970.db2.gz	GGOQUKIZMRHVBH-HXUWFJFHSA-N	0	3	328.456	3.176	20	30		EGEDHN
C#CC[C@@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1	ZINC000757059183	1300626414	/nfs/dbraw/zinc/62/64/14/1300626414.db2.gz	NNRFFSALZGUZES-NHCUHLMSSA-N	0	3	347.462	3.325	20	30		EGEDHN
CC[C@]1(C)CCN(Cc2cc(=O)n3c4ccccc4[nH]c3c2C#N)C1	ZINC000758738125	1300947741	/nfs/dbraw/zinc/94/77/41/1300947741.db2.gz	ANTRGHRLOHTKBV-FOIQADDNSA-N	0	3	334.423	3.346	20	30		EGEDHN
CCO[C@H](CC(=O)C(C#N)C(=O)Nc1ccc(CC)cc1)C(C)C	ZINC000761037755	1301385602	/nfs/dbraw/zinc/38/56/02/1301385602.db2.gz	OEJKJQZQGXRHEU-FUHWJXTLSA-N	0	3	330.428	3.348	20	30		EGEDHN
CCO[C@@H](CC(=O)C(C#N)C(=O)Nc1ccc(CC)cc1)C(C)C	ZINC000761037754	1301386769	/nfs/dbraw/zinc/38/67/69/1301386769.db2.gz	OEJKJQZQGXRHEU-AEFFLSMTSA-N	0	3	330.428	3.348	20	30		EGEDHN
C=C(C)CN1CCC(N2C(=O)N[C@@](C)(CCCCCC)C2=O)CC1	ZINC000761251493	1301427949	/nfs/dbraw/zinc/42/79/49/1301427949.db2.gz	GVARERUGCVHHQW-IBGZPJMESA-N	0	3	335.492	3.308	20	30		EGEDHN
C[C@@H]1CN(C[C@H](O)COc2ccc(CC#N)cc2)Cc2ccccc21	ZINC000763628386	1301936726	/nfs/dbraw/zinc/93/67/26/1301936726.db2.gz	JHXMRATWOAJNCL-APWZRJJASA-N	0	3	336.435	3.112	20	30		EGEDHN
C#CC[C@H](NC(=O)NC[C@@H]1CCCCN1C1CC1)c1ccccc1	ZINC000764799895	1302137966	/nfs/dbraw/zinc/13/79/66/1302137966.db2.gz	MWQQSFREZIAENE-OALUTQOASA-N	0	3	325.456	3.067	20	30		EGEDHN
CSC[C@@H]1CCCN1CC(=O)C(C#N)c1nc2ccccc2s1	ZINC000767905513	1302783001	/nfs/dbraw/zinc/78/30/01/1302783001.db2.gz	HJXKHEDSDRKHDU-STQMWFEESA-N	0	3	345.493	3.300	20	30		EGEDHN
C#CCOc1ccc(CN(C)[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1	ZINC000769334343	1303095429	/nfs/dbraw/zinc/09/54/29/1303095429.db2.gz	NLLWRHWTIUEDAB-KRWDZBQOSA-N	0	3	344.455	3.140	20	30		EGEDHN
C#C[C@H](C)N(C)C[C@@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000769962065	1303198474	/nfs/dbraw/zinc/19/84/74/1303198474.db2.gz	PVJDROYXGXPYQA-DLBZAZTESA-N	0	3	325.408	3.172	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)cc1	ZINC000770042882	1303211430	/nfs/dbraw/zinc/21/14/30/1303211430.db2.gz	BJUBIZZUGFOKIR-UZLBHIALSA-N	0	3	336.435	3.120	20	30		EGEDHN
C#CCOc1ccccc1CN[C@@H](C)CC(=O)N(C)c1ccccc1	ZINC000772987493	1303603120	/nfs/dbraw/zinc/60/31/20/1303603120.db2.gz	IRWQMGMQBIZXQM-KRWDZBQOSA-N	0	3	336.435	3.230	20	30		EGEDHN
C=C(C)[C@@H](NC(=S)NC1CCN(C)CC1)c1ccc(F)c(F)c1	ZINC000774206201	1303786788	/nfs/dbraw/zinc/78/67/88/1303786788.db2.gz	NGHYJKIZIIACEO-MRXNPFEDSA-N	0	3	339.455	3.140	20	30		EGEDHN
C[C@@H](N[C@H]1CCN(c2ccc(C#N)cc2)C1=O)c1ccc(N(C)C)cc1	ZINC000774487388	1303816058	/nfs/dbraw/zinc/81/60/58/1303816058.db2.gz	ZZNOQVLOLIKDRC-QRWLVFNGSA-N	0	3	348.450	3.080	20	30		EGEDHN
C#CC[C@@H](NC[C@@H](O)COc1ccc(Cl)cc1)c1ccccc1	ZINC000775400885	1303957406	/nfs/dbraw/zinc/95/74/06/1303957406.db2.gz	SVRJAJBTBWDVKY-IEBWSBKVSA-N	0	3	329.827	3.434	20	30		EGEDHN
C[C@@H](NCc1ccc(N2CCOCC2)cc1)c1ccc(C#N)c(F)c1	ZINC000776731283	1304189416	/nfs/dbraw/zinc/18/94/16/1304189416.db2.gz	WONBWYNJPYBLRB-OAHLLOKOSA-N	0	3	339.414	3.385	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)Cc2ccccc2CC#N)CN1Cc1ccccc1	ZINC000777409000	1304291498	/nfs/dbraw/zinc/29/14/98/1304291498.db2.gz	FBBOQMHFJKRUOJ-UTKZUKDTSA-N	0	3	347.462	3.074	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)Nc2ccc(C#N)cn2)N2CCCC2)cc1	ZINC000889223626	1304417829	/nfs/dbraw/zinc/41/78/29/1304417829.db2.gz	GPFOWCKNUHZNFK-SFHVURJKSA-N	0	3	349.438	3.220	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccc(C#N)cn1	ZINC000889226770	1304419274	/nfs/dbraw/zinc/41/92/74/1304419274.db2.gz	OGEBYPJDXBARTH-MRXNPFEDSA-N	0	3	349.438	3.082	20	30		EGEDHN
Fc1ccc(CON=C2CCN3CCC[C@@H]23)c(Br)c1	ZINC000780288500	1304673097	/nfs/dbraw/zinc/67/30/97/1304673097.db2.gz	VXVIEFSXHWUUNS-AWEZNQCLSA-N	0	3	327.197	3.329	20	30		EGEDHN
C[C@]1(COC(=O)c2ccc(C#N)[nH]2)CCCCN1Cc1ccccc1	ZINC000782147895	1304920752	/nfs/dbraw/zinc/92/07/52/1304920752.db2.gz	GEVMUUFVFMJHJD-HXUWFJFHSA-N	0	3	337.423	3.488	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H](c2ccc(N(C)C)cc2)N(C)C)CC1	ZINC000891243506	1304998572	/nfs/dbraw/zinc/99/85/72/1304998572.db2.gz	OZZXQMXCIHKFQW-LJQANCHMSA-N	0	3	329.488	3.218	20	30		EGEDHN
N#CCC[C@H](NC(=O)NC[C@H]1Cc2ccccc2CN1)c1ccccc1	ZINC000891703676	1305140547	/nfs/dbraw/zinc/14/05/47/1305140547.db2.gz	DLXGCEQYNHYVBF-UXHICEINSA-N	0	3	348.450	3.045	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC000785408990	1305347214	/nfs/dbraw/zinc/34/72/14/1305347214.db2.gz	REIXHAGCPCIXNN-FQEVSTJZSA-N	0	3	330.472	3.378	20	30		EGEDHN
CC(C)c1csc(C(C#N)C(=O)c2c3c(nn2C)CCCC3)n1	ZINC000892803602	1305559218	/nfs/dbraw/zinc/55/92/18/1305559218.db2.gz	USUCDGIOAPTDBY-LBPRGKRZSA-N	0	3	328.441	3.369	20	30		EGEDHN
CC(C)(C#N)CC(=O)O[C@@H]1CCN(Cc2ccc3c(c2)CCC3)C1	ZINC000786477851	1305582696	/nfs/dbraw/zinc/58/26/96/1305582696.db2.gz	JNMXHOKGCBNWKF-GOSISDBHSA-N	0	3	326.440	3.233	20	30		EGEDHN
C#C[C@@H](NC1CC(c2ccc(Br)cc2)C1)[C@@H]1CCCO1	ZINC000786921318	1305659026	/nfs/dbraw/zinc/65/90/26/1305659026.db2.gz	XNQFSWLJGZLRJG-BNICSPFPSA-N	0	3	334.257	3.466	20	30		EGEDHN
CN(Cc1ccc(F)c(C#N)c1)[C@@H](CNC(=O)OC(C)(C)C)C1CC1	ZINC000790079055	1306258863	/nfs/dbraw/zinc/25/88/63/1306258863.db2.gz	IKKLODCCVVAYPG-KRWDZBQOSA-N	0	3	347.434	3.432	20	30		EGEDHN
C#C[C@H](CCC)NC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1	ZINC000791060051	1308918416	/nfs/dbraw/zinc/91/84/16/1308918416.db2.gz	YHQCAFQISUZFMA-IEBWSBKVSA-N	0	3	327.472	3.094	20	30		EGEDHN
C#C[C@@H](CCC)NC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1	ZINC000791060050	1308918931	/nfs/dbraw/zinc/91/89/31/1308918931.db2.gz	YHQCAFQISUZFMA-HKUYNNGSSA-N	0	3	327.472	3.094	20	30		EGEDHN
C#C[C@@H](CCC)NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C	ZINC000791068735	1308920184	/nfs/dbraw/zinc/92/01/84/1308920184.db2.gz	BPVTVVPGQRGITH-MJGOQNOKSA-N	0	3	327.472	3.094	20	30		EGEDHN
CC(C)(C)S(=O)(=O)CCN[C@@H]1CCCCc2cc(C#N)ccc21	ZINC000795803483	1309837120	/nfs/dbraw/zinc/83/71/20/1309837120.db2.gz	PYRZUUZIQNJSHG-QGZVFWFLSA-N	0	3	334.485	3.129	20	30		EGEDHN
C=C1CCC(C(=O)NCc2ccccc2CN2CCC(O)CC2)CC1	ZINC000896711242	1309984415	/nfs/dbraw/zinc/98/44/15/1309984415.db2.gz	BLVYZCZIAAXIKC-UHFFFAOYSA-N	0	3	342.483	3.006	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)[C@@H]1CCC(F)(F)C1	ZINC000796638030	1310053399	/nfs/dbraw/zinc/05/33/99/1310053399.db2.gz	YNCDTAGUUDCDNF-VXGBXAGGSA-N	0	3	336.338	3.168	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@H](C)Cn1ccc2ccccc21	ZINC000796779977	1310086811	/nfs/dbraw/zinc/08/68/11/1310086811.db2.gz	QXZRPJJFOAXPRL-WBVHZDCISA-N	0	3	339.439	3.293	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)CCCOC(C)(C)C)cc1	ZINC000796799549	1310089569	/nfs/dbraw/zinc/08/95/69/1310089569.db2.gz	QTPRNEUBGPDXFB-MRXNPFEDSA-N	0	3	330.428	3.492	20	30		EGEDHN
CC(=O)N[C@@H](CC(C)C)C(=O)C(C#N)c1ncc(C(C)(C)C)s1	ZINC000797570834	1310212336	/nfs/dbraw/zinc/21/23/36/1310212336.db2.gz	LCFJWMKYSIPVRL-STQMWFEESA-N	0	3	335.473	3.168	20	30		EGEDHN
CC(C)[C@H](C(=O)C(C#N)c1ncc(C(C)(C)C)s1)N1CCCC1=O	ZINC000797572441	1310213571	/nfs/dbraw/zinc/21/35/71/1310213571.db2.gz	ZSJVNEXQBFCMHK-IUODEOHRSA-N	0	3	347.484	3.264	20	30		EGEDHN
Cc1ccc(C(=O)N(CCN(C)C)Cc2cccc(F)c2)cc1C#N	ZINC000799337218	1310527998	/nfs/dbraw/zinc/52/79/98/1310527998.db2.gz	DZZDHDCOHBXQTI-UHFFFAOYSA-N	0	3	339.414	3.210	20	30		EGEDHN
C[C@H](N[C@H]1CC[C@H](C#N)C1)c1cc(F)ccc1N1CCC(O)CC1	ZINC000799717689	1310604974	/nfs/dbraw/zinc/60/49/74/1310604974.db2.gz	SSAXGCYIEOXYKD-DZKIICNBSA-N	0	3	331.435	3.130	20	30		EGEDHN
C#CCN1CCC[C@H](CNC(=O)c2ccc(-c3cccs3)o2)C1	ZINC001023728115	1319867112	/nfs/dbraw/zinc/86/71/12/1319867112.db2.gz	ZPVYTKZRRLWNBM-CQSZACIVSA-N	0	3	328.437	3.083	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)Cc2ccc(Cl)s2)c1	ZINC000802040722	1316975979	/nfs/dbraw/zinc/97/59/79/1316975979.db2.gz	QUCIFZXPOVBSCP-CYBMUJFWSA-N	0	3	348.811	3.300	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)[C@@H]3C[C@@H]4CCCC[C@H]34)C2)s1	ZINC001019183117	1317089830	/nfs/dbraw/zinc/08/98/30/1317089830.db2.gz	YZQJZMAEBBJSOO-DFEHZGFQSA-N	0	3	343.496	3.137	20	30		EGEDHN
CC1(C)CCC[C@@H]1C(=O)N1CC[C@H](NCc2ccc(C#N)s2)C1	ZINC001019256183	1317129489	/nfs/dbraw/zinc/12/94/89/1317129489.db2.gz	QMUAXUKWDLVKMJ-XJKSGUPXSA-N	0	3	331.485	3.137	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CC2)CCN(C(=O)C2CC2)CC3)s1	ZINC000957486987	1317395363	/nfs/dbraw/zinc/39/53/63/1317395363.db2.gz	PZZOAAKRPUZBCC-UHFFFAOYSA-N	0	3	343.496	3.234	20	30		EGEDHN
C[C@H](N[C@H]1C[C@H](NC(=O)c2ccc(C#N)[nH]2)C1)c1ccccc1Cl	ZINC001020079820	1317536740	/nfs/dbraw/zinc/53/67/40/1317536740.db2.gz	IQOIGLXJJTZWSG-UBHSHLNASA-N	0	3	342.830	3.151	20	30		EGEDHN
CCN(Cc1cccc(F)c1F)CC1CCN(C(=O)[C@@H](C)C#N)CC1	ZINC000957692449	1317559921	/nfs/dbraw/zinc/55/99/21/1317559921.db2.gz	TVNIVVPXBLDRMA-AWEZNQCLSA-N	0	3	349.425	3.185	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC(CN(CC)Cc2cnc(C)cn2)CC1	ZINC000957737371	1317601255	/nfs/dbraw/zinc/60/12/55/1317601255.db2.gz	CNPRCVFRVXRAKC-UHFFFAOYSA-N	0	3	344.503	3.058	20	30		EGEDHN
CC[C@H](N[C@@H]1CCN(Cc2ccccc2)C1=O)c1cccc(C#N)c1	ZINC000902853079	1317624176	/nfs/dbraw/zinc/62/41/76/1317624176.db2.gz	JBXCYARCSREIIV-VQTJNVASSA-N	0	3	333.435	3.400	20	30		EGEDHN
CC[C@@H](N[C@@H]1CCCN(Cc2ccccn2)C1=O)c1cccc(C#N)c1	ZINC000902950702	1317632883	/nfs/dbraw/zinc/63/28/83/1317632883.db2.gz	KCQWIMSQLDRWGA-WOJBJXKFSA-N	0	3	348.450	3.185	20	30		EGEDHN
CC[C@@H](NCc1ccc(N2CCNC2=O)cc1)c1cccc(C#N)c1	ZINC000903088798	1317650330	/nfs/dbraw/zinc/65/03/30/1317650330.db2.gz	SXOKFPAMSMQUMQ-LJQANCHMSA-N	0	3	334.423	3.329	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@H]1C[C@@H](NCC1(C#N)CC1)C1CC1	ZINC000903106364	1317654646	/nfs/dbraw/zinc/65/46/46/1317654646.db2.gz	OKNNGBZURSPOHC-JKSUJKDBSA-N	0	3	333.476	3.448	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc(C)c(Cl)c2F)C1	ZINC001020426792	1317690646	/nfs/dbraw/zinc/69/06/46/1317690646.db2.gz	ZJBHZWHDRWCTSQ-XYPYZODXSA-N	0	3	331.218	3.390	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2C[C@H](NCc3cc(C)ccc3F)C2)cc1	ZINC001020456528	1317704940	/nfs/dbraw/zinc/70/49/40/1317704940.db2.gz	UIRCVPBMWWKYJH-WGSAOQKQSA-N	0	3	336.410	3.166	20	30		EGEDHN
C#C[C@H](NCc1cnn(-c2ccc(Br)cc2)c1)C(C)C	ZINC000809685097	1317863011	/nfs/dbraw/zinc/86/30/11/1317863011.db2.gz	ZFTROVABLDKNRF-INIZCTEOSA-N	0	3	332.245	3.382	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CNCc1cc(Br)ccc1Cl	ZINC000905526208	1317965883	/nfs/dbraw/zinc/96/58/83/1317965883.db2.gz	UPYGXUFIVLEDRQ-LBPRGKRZSA-N	0	3	345.668	3.493	20	30		EGEDHN
C[C@@H](C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1)C1CCCC1	ZINC001020907570	1317993764	/nfs/dbraw/zinc/99/37/64/1317993764.db2.gz	HCUXSKFIDPTKBH-FSPWUOQZSA-N	0	3	343.446	3.260	20	30		EGEDHN
C#CCC1(OC(=O)C2CCN(c3ccc(Cl)cc3)C2=O)CCC1	ZINC000810749876	1318053479	/nfs/dbraw/zinc/05/34/79/1318053479.db2.gz	XKHRMQQUVFYROR-OAHLLOKOSA-N	0	3	331.799	3.182	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@H]2C[C@H]2c2cc(F)ccc2F)C1	ZINC001021069879	1318066768	/nfs/dbraw/zinc/06/67/68/1318066768.db2.gz	NRGNPJKVOCTPSC-ABHRYQDASA-N	0	3	340.801	3.058	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2c(C)onc2-c2cccc(F)c2)CC1	ZINC000906592391	1318122713	/nfs/dbraw/zinc/12/27/13/1318122713.db2.gz	NBHLZVIZXRBXLL-UHFFFAOYSA-N	0	3	343.402	3.169	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1cccc(C#N)c1	ZINC001021231420	1318151446	/nfs/dbraw/zinc/15/14/46/1318151446.db2.gz	KYQIJUROSAWYIN-IPQPSQTFSA-N	0	3	337.467	3.216	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)c2cccs2)s1	ZINC000959862461	1318235346	/nfs/dbraw/zinc/23/53/46/1318235346.db2.gz	PXDIZKTVHYQCDF-ZDUSSCGKSA-N	0	3	345.493	3.466	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)c2ccoc2)c(F)c1	ZINC000959877034	1318246712	/nfs/dbraw/zinc/24/67/12/1318246712.db2.gz	QTBZKXZCVRLESN-KRWDZBQOSA-N	0	3	341.386	3.075	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCCC[C@H]1CNCc1cc2ccccc2o1	ZINC000959925522	1318267798	/nfs/dbraw/zinc/26/77/98/1318267798.db2.gz	OOTLTIHQGDNVEQ-HOCLYGCPSA-N	0	3	325.412	3.063	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCCC[C@H]1CNCc1cccc(Cl)c1F	ZINC000959926910	1318269740	/nfs/dbraw/zinc/26/97/40/1318269740.db2.gz	YBAGYXPUMHYJDR-JSGCOSHPSA-N	0	3	337.826	3.109	20	30		EGEDHN
Cc1coc(C(=O)N2CCCC[C@H]2CNCc2ccc(C#N)s2)c1	ZINC000960098867	1318353779	/nfs/dbraw/zinc/35/37/79/1318353779.db2.gz	YQBYQNDIIOJLDS-AWEZNQCLSA-N	0	3	343.452	3.306	20	30		EGEDHN
C=CCCC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000908658620	1318383719	/nfs/dbraw/zinc/38/37/19/1318383719.db2.gz	FTHIELLFAKZYQC-MOPGFXCFSA-N	0	3	340.467	3.035	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@@H]2CN(Cc3cccc(F)c3)CC[C@H]21	ZINC001021582136	1318426378	/nfs/dbraw/zinc/42/63/78/1318426378.db2.gz	TYECKOUDLODHFK-UYAOXDASSA-N	0	3	340.442	3.052	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2c(C)oc3ccccc32)C1	ZINC001021590380	1318434048	/nfs/dbraw/zinc/43/40/48/1318434048.db2.gz	FHHLJBUHLLMABC-WMZOPIPTSA-N	0	3	336.435	3.301	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@@H]1C[C@H]1c1ccncc1	ZINC000960267461	1318435677	/nfs/dbraw/zinc/43/56/77/1318435677.db2.gz	FKASADWGRCCQQB-DOIPELPJSA-N	0	3	347.462	3.133	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc2cc(C)cn2c1	ZINC000960270088	1318436171	/nfs/dbraw/zinc/43/61/71/1318436171.db2.gz	DQESQPOBVOTUNY-NHCUHLMSSA-N	0	3	345.446	3.419	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)Cc1c(F)cccc1F	ZINC000960299294	1318450624	/nfs/dbraw/zinc/45/06/24/1318450624.db2.gz	JDPXQJLHYOFXMV-UYAOXDASSA-N	0	3	342.389	3.065	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(C)c(F)cc2F)C1	ZINC001021609894	1318455997	/nfs/dbraw/zinc/45/59/97/1318455997.db2.gz	BDKLWGUHJUUTEZ-HNAYVOBHSA-N	0	3	346.421	3.223	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cccc(C(C)C)n2)C1	ZINC001021621786	1318471920	/nfs/dbraw/zinc/47/19/20/1318471920.db2.gz	DGIQYLFRUMVEER-PXNSSMCTSA-N	0	3	339.483	3.155	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc3ccccc3s2)C1	ZINC001021626309	1318476963	/nfs/dbraw/zinc/47/69/63/1318476963.db2.gz	FHUYVTSWRREXHT-IAGOWNOFSA-N	0	3	338.476	3.461	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc3ccccc3s2)C1	ZINC001021626305	1318477041	/nfs/dbraw/zinc/47/70/41/1318477041.db2.gz	FHUYVTSWRREXHT-DLBZAZTESA-N	0	3	338.476	3.461	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)Cc2cccc(C)c2Cl)C1	ZINC001021633281	1318486998	/nfs/dbraw/zinc/48/69/98/1318486998.db2.gz	PVNGMTFDNUBAEL-MSOLQXFVSA-N	0	3	344.886	3.137	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)CCc2ccc3[nH]ccc3c2)C1	ZINC001021636374	1318492220	/nfs/dbraw/zinc/49/22/20/1318492220.db2.gz	PYAIBZHOFPZIAN-CTNGQTDRSA-N	0	3	349.478	3.047	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(-c3ccco3)on2)C1	ZINC001021645794	1318504675	/nfs/dbraw/zinc/50/46/75/1318504675.db2.gz	MWBBCQCUCAPNRS-GOEBONIOSA-N	0	3	341.411	3.047	20	30		EGEDHN
N#Cc1cccc(OCC(=O)C(C#N)c2cc(C(F)(F)F)ccn2)c1	ZINC000813217548	1318515672	/nfs/dbraw/zinc/51/56/72/1318515672.db2.gz	MMJWEAOJAQAXGL-AWEZNQCLSA-N	0	3	345.280	3.227	20	30		EGEDHN
Cc1occc1C(=O)N1CCC[C@@H]1CN(C)Cc1cccc(C#N)c1	ZINC000960395195	1318521856	/nfs/dbraw/zinc/52/18/56/1318521856.db2.gz	BDQWKGIHMFGRQF-GOSISDBHSA-N	0	3	337.423	3.196	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cccc(Cl)c2F)C1	ZINC001021667028	1318530095	/nfs/dbraw/zinc/53/00/95/1318530095.db2.gz	YMGQJUFDAQJQPM-CJNGLKHVSA-N	0	3	334.822	3.039	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(Cl)c(F)c2)C1	ZINC001021678357	1318547570	/nfs/dbraw/zinc/54/75/70/1318547570.db2.gz	XHWLQPACKHECHT-CRAIPNDOSA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cnc3ccccc3c2)C1	ZINC001021679308	1318550091	/nfs/dbraw/zinc/55/00/91/1318550091.db2.gz	NJPKDZPVZDVPIF-NQIIRXRSSA-N	0	3	347.462	3.185	20	30		EGEDHN
C/C(=C\C(=O)N1CCC[C@H]1CN(C)Cc1cccc(C#N)c1)C1CC1	ZINC000960444897	1318565700	/nfs/dbraw/zinc/56/57/00/1318565700.db2.gz	NHXAJQLNRLPODI-PRDNPTHXSA-N	0	3	337.467	3.337	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2[nH]c3ccc(C)cc3c2C)C1	ZINC001021703693	1318576930	/nfs/dbraw/zinc/57/69/30/1318576930.db2.gz	AYNKTJWWILUOPF-YLJYHZDGSA-N	0	3	349.478	3.344	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc3cnccc3c2)C1	ZINC001021709788	1318585555	/nfs/dbraw/zinc/58/55/55/1318585555.db2.gz	LISYNMCCUJTCOX-RTWAWAEBSA-N	0	3	347.462	3.185	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)CCC1CC1	ZINC000960509794	1318624205	/nfs/dbraw/zinc/62/42/05/1318624205.db2.gz	QFBTZHZIBLJCSB-IBGZPJMESA-N	0	3	325.456	3.171	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(C)c(CC)s2)C1	ZINC001021728589	1318626554	/nfs/dbraw/zinc/62/65/54/1318626554.db2.gz	APMNCUITGLSBQA-HZPDHXFCSA-N	0	3	330.497	3.179	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc3[nH]c(C)c(C)c3c2)C1	ZINC001021733882	1318640058	/nfs/dbraw/zinc/64/00/58/1318640058.db2.gz	SLDPSQLUCOBHFZ-WIYYLYMNSA-N	0	3	349.478	3.344	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H]1CN(C)Cc1ccc(C#N)cc1)C1CC1	ZINC000960529154	1318645637	/nfs/dbraw/zinc/64/56/37/1318645637.db2.gz	MUENBYOKYIDXQX-HNAYVOBHSA-N	0	3	325.456	3.027	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(Cl)cn2CC)C1	ZINC001021738847	1318646013	/nfs/dbraw/zinc/64/60/13/1318646013.db2.gz	CKPOJYZSRLMSHF-WBVHZDCISA-N	0	3	347.890	3.111	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(C)c3c2CCC3)C1	ZINC001021742049	1318655101	/nfs/dbraw/zinc/65/51/01/1318655101.db2.gz	BNRIUXVUTZPNGF-DYESRHJHSA-N	0	3	336.479	3.043	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(C(C)C)s2)C1	ZINC001021743701	1318656384	/nfs/dbraw/zinc/65/63/84/1318656384.db2.gz	QVQFAKRKVPNBHW-HOTGVXAUSA-N	0	3	330.497	3.431	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(F)c3occc32)C1	ZINC001021745061	1318661725	/nfs/dbraw/zinc/66/17/25/1318661725.db2.gz	YMNVZEZJMRSYCO-KSSFIOAISA-N	0	3	340.398	3.132	20	30		EGEDHN
CC[C@@H](SC)C(=O)N1CCC[C@@H]1CN(C)Cc1cccc(C#N)c1	ZINC000960558339	1318688906	/nfs/dbraw/zinc/68/89/06/1318688906.db2.gz	SRCZAQHALSDYAL-QZTJIDSGSA-N	0	3	345.512	3.123	20	30		EGEDHN
Cc1cc(CN(C)C[C@@H]2CCCN2C(=O)C#CC2CC2)c(C)s1	ZINC000960624048	1318750249	/nfs/dbraw/zinc/75/02/49/1318750249.db2.gz	MPAVDAASBOYPCF-SFHVURJKSA-N	0	3	330.497	3.201	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N(C)Cc1ccc(Br)s1	ZINC000912076448	1318803822	/nfs/dbraw/zinc/80/38/22/1318803822.db2.gz	UNFNUWRPDHSTOG-NSHDSACASA-N	0	3	331.279	3.153	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)Nc1cccc(N2CCNC2=O)c1	ZINC000912476276	1318891924	/nfs/dbraw/zinc/89/19/24/1318891924.db2.gz	NCZFSMACFHYOTK-KRWDZBQOSA-N	0	3	346.475	3.233	20	30		EGEDHN
C#CCNC(=O)CCN1CCC[C@@H]1c1ccc(Br)c(C)c1	ZINC000815106315	1318893862	/nfs/dbraw/zinc/89/38/62/1318893862.db2.gz	XNRGGWRISPJVQE-MRXNPFEDSA-N	0	3	349.272	3.034	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@H]2CN(C)Cc2cccc(C#N)c2)CC1	ZINC000960826036	1318950459	/nfs/dbraw/zinc/95/04/59/1318950459.db2.gz	IDUWFHVYAKRVJS-SFHVURJKSA-N	0	3	325.456	3.171	20	30		EGEDHN
C[C@@H]1CCN(Cc2ccccc2)C[C@H]1NC(=O)c1ccccc1CC#N	ZINC000913101194	1318974200	/nfs/dbraw/zinc/97/42/00/1318974200.db2.gz	CABLVMQXWFNWNU-DYESRHJHSA-N	0	3	347.462	3.393	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@@H](NC(=O)C[C@H]3CC=CCC3)C2)c(F)c1	ZINC001022550136	1318982926	/nfs/dbraw/zinc/98/29/26/1318982926.db2.gz	VBWKZACKECCXSD-JCGIZDLHSA-N	0	3	341.430	3.181	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@@H](NCc3cc(F)ccc3F)C2)CC1	ZINC001022648630	1319040250	/nfs/dbraw/zinc/04/02/50/1319040250.db2.gz	LFEGSCQXOBUSAH-CALCHBBNSA-N	0	3	334.410	3.448	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@@H](NCc3ccc(Cl)cc3OC)C2)C1	ZINC001022675414	1319061833	/nfs/dbraw/zinc/06/18/33/1319061833.db2.gz	WUJICAGLLHGMQG-IYBDPMFKSA-N	0	3	348.874	3.442	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1CCC[C@@H]1CN(C)Cc1ccccc1	ZINC000960991427	1319123102	/nfs/dbraw/zinc/12/31/02/1319123102.db2.gz	KTSHMJCUHQDHPU-JOCHJYFZSA-N	0	3	346.474	3.333	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc(O[C@@H](C)CC)cc2)C1	ZINC001022940030	1319182397	/nfs/dbraw/zinc/18/23/97/1319182397.db2.gz	KKNNWRCDBLVRCR-CWRNSKLLSA-N	0	3	336.863	3.467	20	30		EGEDHN
C[C@@H](C(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1)C1CCCC1	ZINC001022958083	1319187067	/nfs/dbraw/zinc/18/70/67/1319187067.db2.gz	AMAJCHROQIFEMY-XWIAVFTESA-N	0	3	343.446	3.260	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@@H]([C@H]2CCCN(C(=O)C3CC3)C2)C1	ZINC000961082271	1319194513	/nfs/dbraw/zinc/19/45/13/1319194513.db2.gz	RKLNIZNGFGBJKH-VQTJNVASSA-N	0	3	337.467	3.029	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@@H]([C@@H]2CCCN(C(=O)C3CC3)C2)C1	ZINC000961082273	1319194802	/nfs/dbraw/zinc/19/48/02/1319194802.db2.gz	RKLNIZNGFGBJKH-WOJBJXKFSA-N	0	3	337.467	3.029	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@@H](NC(=O)C3CCC=CCC3)C2)c(F)c1	ZINC001023100223	1319260691	/nfs/dbraw/zinc/26/06/91/1319260691.db2.gz	DDSDFEDTMRLILN-HDICACEKSA-N	0	3	341.430	3.181	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccccc2OCC2CC2)C1	ZINC001023125942	1319274711	/nfs/dbraw/zinc/27/47/11/1319274711.db2.gz	AENAWYBMQFDBSN-GASCZTMLSA-N	0	3	334.847	3.078	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)C[C@H]2CCCC[C@H]2C)C1	ZINC001023152220	1319297232	/nfs/dbraw/zinc/29/72/32/1319297232.db2.gz	QYDYWDKODGLSCC-NGFQHRJXSA-N	0	3	343.309	3.348	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cccc3c(C)c(C)[nH]c32)C1	ZINC001023447110	1319548078	/nfs/dbraw/zinc/54/80/78/1319548078.db2.gz	GDZJRZNQCFPRRI-QGZVFWFLSA-N	0	3	337.467	3.250	20	30		EGEDHN
C#CCN(C)CCCNC(=O)[C@H]1C[C@H]1c1cc(Cl)cc(Cl)c1	ZINC000818584102	1319564043	/nfs/dbraw/zinc/56/40/43/1319564043.db2.gz	FEKJWHIEOANVQV-HOTGVXAUSA-N	0	3	339.266	3.168	20	30		EGEDHN
C#CCN(C)CCCNC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl	ZINC000818593342	1319564985	/nfs/dbraw/zinc/56/49/85/1319564985.db2.gz	VFMWETHSTUGKKS-CABCVRRESA-N	0	3	339.266	3.168	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1cc(-c2ccco2)nc2ccccc21	ZINC000818606205	1319568915	/nfs/dbraw/zinc/56/89/15/1319568915.db2.gz	GWUZWICWNJARNP-UHFFFAOYSA-N	0	3	347.418	3.180	20	30		EGEDHN
C=CCN1CCC[C@@H](CNC(=O)c2oc3ccccc3c2OC)C1	ZINC001023528358	1319633296	/nfs/dbraw/zinc/63/32/96/1319633296.db2.gz	KKCAAAIEQMSNKB-AWEZNQCLSA-N	0	3	328.412	3.069	20	30		EGEDHN
CCC(CC)=NNC(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000916307193	1319636373	/nfs/dbraw/zinc/63/63/73/1319636373.db2.gz	VYQMXRRFJQEFHB-UHFFFAOYSA-N	0	3	332.517	3.291	20	30		EGEDHN
N#Cc1ccc(F)c(CNCC2CC(NC(=O)[C@@H]3CC=CCC3)C2)c1	ZINC000961544639	1319644656	/nfs/dbraw/zinc/64/46/56/1319644656.db2.gz	IOHPKQAFHGEYHP-UPTPFMHGSA-N	0	3	341.430	3.038	20	30		EGEDHN
Cc1ccc(OC(F)F)c(CNC[C@H](O)c2ccc(C#N)cc2)c1	ZINC000819150099	1319649783	/nfs/dbraw/zinc/64/97/83/1319649783.db2.gz	PRQMSBBRIZTECU-INIZCTEOSA-N	0	3	332.350	3.291	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)CCc1nc2ccccc2o1	ZINC000916876233	1319718881	/nfs/dbraw/zinc/71/88/81/1319718881.db2.gz	SZFGWLFUKKDBIS-CQSZACIVSA-N	0	3	341.411	3.166	20	30		EGEDHN
C=CCNC(=O)C(C#N)C(=O)CCCOc1ccc(C(C)(C)C)cc1	ZINC000916917262	1319724722	/nfs/dbraw/zinc/72/47/22/1319724722.db2.gz	BXQJRDHSKPBGFD-QGZVFWFLSA-N	0	3	342.439	3.154	20	30		EGEDHN
C=CCNC(=O)C(C#N)C(=O)CCCOc1ccc(C(C)(C)C)cc1	ZINC000916917260	1319724749	/nfs/dbraw/zinc/72/47/49/1319724749.db2.gz	BXQJRDHSKPBGFD-KRWDZBQOSA-N	0	3	342.439	3.154	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)CSC(C)C)cc1Cl	ZINC000916941646	1319725887	/nfs/dbraw/zinc/72/58/87/1319725887.db2.gz	ZYVDJCUSNOOJQY-NSHDSACASA-N	0	3	340.832	3.138	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)CCC(C)(F)F)cc1Cl	ZINC000916938588	1319726545	/nfs/dbraw/zinc/72/65/45/1319726545.db2.gz	BQUFDTBJJLZTCX-SNVBAGLBSA-N	0	3	344.745	3.431	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)CCn1c2ccccc2c2ccccc21	ZINC000916951608	1319727315	/nfs/dbraw/zinc/72/73/15/1319727315.db2.gz	LMBPMYFGVLCKNW-QGZVFWFLSA-N	0	3	347.418	3.418	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccccc2O[C@H](C)CC)C1	ZINC001023620962	1319741368	/nfs/dbraw/zinc/74/13/68/1319741368.db2.gz	CTOBYNABLBXVID-QZTJIDSGSA-N	0	3	342.483	3.329	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cnc(CC(C)(C)C)s2)C1	ZINC001023689950	1319809702	/nfs/dbraw/zinc/80/97/02/1319809702.db2.gz	VELPGEAVWSKVPW-HNNXBMFYSA-N	0	3	347.528	3.197	20	30		EGEDHN
C=C1CCC(C(=O)NC2CC(CNCc3cc(C4CC4)no3)C2)CC1	ZINC000962265471	1319891429	/nfs/dbraw/zinc/89/14/29/1319891429.db2.gz	SFGIACVOTZLRPE-UHFFFAOYSA-N	0	3	343.471	3.283	20	30		EGEDHN
C=C1CCC(C(=O)NC2CC(CN[C@@H](C)c3cnc(C)cn3)C2)CC1	ZINC000962266248	1319891741	/nfs/dbraw/zinc/89/17/41/1319891741.db2.gz	XFDRUGVQCYSFEF-HJOIGYKYSA-N	0	3	342.487	3.077	20	30		EGEDHN
C=CCN(C(=O)NC[C@H](CC)N1CCc2ccccc2C1)C(C)C	ZINC000918065977	1319912428	/nfs/dbraw/zinc/91/24/28/1319912428.db2.gz	WWIWWSIAOILLCJ-IBGZPJMESA-N	0	3	329.488	3.429	20	30		EGEDHN
C=C(C)CN(Cc1ccc(CO)o1)C[C@@H]1CCCC[C@H]1C(=O)OC	ZINC000930455405	1328859639	/nfs/dbraw/zinc/85/96/39/1328859639.db2.gz	NXCRGDUOGIOMOW-MAUKXSAKSA-N	0	3	335.444	3.129	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc(C(F)(F)F)s2)C1	ZINC001023773260	1319923701	/nfs/dbraw/zinc/92/37/01/1319923701.db2.gz	PMVCXSDJLMNBCJ-LBPRGKRZSA-N	0	3	344.402	3.232	20	30		EGEDHN
COC(=O)C1(C#N)CCN([C@@H]2CC[C@@](C)(c3ccccc3)C2)CC1	ZINC000824871437	1320293097	/nfs/dbraw/zinc/29/30/97/1320293097.db2.gz	GTNIPEONUWWEOC-IEBWSBKVSA-N	0	3	326.440	3.276	20	30		EGEDHN
C#CCOc1ccc(CNCc2ccc(OCOCC)cc2)cc1	ZINC000824926775	1320296800	/nfs/dbraw/zinc/29/68/00/1320296800.db2.gz	SVUXJTFSNIWPHT-UHFFFAOYSA-N	0	3	325.408	3.361	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1ccc(N2CCCCCC2)cc1	ZINC000838623278	1320795953	/nfs/dbraw/zinc/79/59/53/1320795953.db2.gz	YMNYEJXEJMDSCC-UHFFFAOYSA-N	0	3	342.487	3.144	20	30		EGEDHN
CN(C)Cc1ccc(NC(=O)Cc2ccccc2CC#N)c(F)c1	ZINC000839824633	1320980391	/nfs/dbraw/zinc/98/03/91/1320980391.db2.gz	SXAKQZYIRLRMSE-UHFFFAOYSA-N	0	3	325.387	3.135	20	30		EGEDHN
N#CC(C(=O)NC1CCCCC1)C(=O)[C@@H]1CCSc2ccccc21	ZINC000842289509	1321368054	/nfs/dbraw/zinc/36/80/54/1321368054.db2.gz	RIGNXFBPOZWNJU-HZPDHXFCSA-N	0	3	342.464	3.424	20	30		EGEDHN
C=C[C@@H](C)ONC(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1	ZINC000844283930	1321585034	/nfs/dbraw/zinc/58/50/34/1321585034.db2.gz	KDJIHXAPJZJCJW-CABCVRRESA-N	0	3	337.489	3.326	20	30		EGEDHN
CCn1ccc(CC(=O)C(C#N)c2nc3cc(F)ccc3s2)n1	ZINC000845463139	1321710382	/nfs/dbraw/zinc/71/03/82/1321710382.db2.gz	SLYJLRXPLVLPSQ-GFCCVEGCSA-N	0	3	328.372	3.071	20	30		EGEDHN
C=C(C)[C@H](CC(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-])OCC	ZINC000845872932	1321747156	/nfs/dbraw/zinc/74/71/56/1321747156.db2.gz	AWXJSMHBOACPDJ-ISTRZQFTSA-N	0	3	339.363	3.447	20	30		EGEDHN
C#CCOc1ccccc1NC(=O)C(C[C@@H]1CCCO1)C(F)(F)F	ZINC000845956831	1321758893	/nfs/dbraw/zinc/75/88/93/1321758893.db2.gz	JMTPDHBTNSHOGI-QWHCGFSZSA-N	0	3	341.329	3.385	20	30		EGEDHN
C/C(=C/c1ccco1)C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000846822279	1321813405	/nfs/dbraw/zinc/81/34/05/1321813405.db2.gz	XRAHANZXQSBDFJ-SSZFMOIBSA-N	0	3	337.423	3.145	20	30		EGEDHN
CC(C)(C#N)CC(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847747926	1321900506	/nfs/dbraw/zinc/90/05/06/1321900506.db2.gz	SOWFPBCKHVSFPR-UHFFFAOYSA-N	0	3	339.439	3.275	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@H](NCc1ccc(N3CCCNC3=O)cc1)CC2	ZINC000850575197	1322270648	/nfs/dbraw/zinc/27/06/48/1322270648.db2.gz	RXNKTQVOWMLNOB-HXUWFJFHSA-N	0	3	346.434	3.255	20	30		EGEDHN
N#CC(C(=O)CCCF)C(=O)Nc1ccc(SC(F)F)cc1	ZINC000850755116	1322284190	/nfs/dbraw/zinc/28/41/90/1322284190.db2.gz	BOYRHQZMFHKFHB-NSHDSACASA-N	0	3	330.331	3.398	20	30		EGEDHN
CCOC(=O)c1c[nH]nc1[C@H]1CCN([C@H](C)c2ccc(C#N)cc2)C1	ZINC000931010898	1329027358	/nfs/dbraw/zinc/02/73/58/1329027358.db2.gz	REPCKCOTIRQSAR-CJNGLKHVSA-N	0	3	338.411	3.009	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H](CNCc2cc(F)ccc2C#N)C1)C1CC1	ZINC001023914911	1323022084	/nfs/dbraw/zinc/02/20/84/1323022084.db2.gz	DVKXOONCEIIQGB-HUUCEWRRSA-N	0	3	343.446	3.072	20	30		EGEDHN
Cc1cccc(C(=O)NC2CC(CNCc3ccccc3C#N)C2)c1C	ZINC000962630296	1323033769	/nfs/dbraw/zinc/03/37/69/1323033769.db2.gz	AVSOKLRVNFVXDD-UHFFFAOYSA-N	0	3	347.462	3.473	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCN(C(=O)C2(C3CC3)CC2)C1	ZINC001024031297	1323083626	/nfs/dbraw/zinc/08/36/26/1323083626.db2.gz	QBIPEXGLAMOHQS-MRXNPFEDSA-N	0	3	337.467	3.077	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H](CNCc2oc(CC)nc2C)C1	ZINC001024090677	1323122697	/nfs/dbraw/zinc/12/26/97/1323122697.db2.gz	ODEBARYERGSSNZ-INIZCTEOSA-N	0	3	347.503	3.476	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@H](CNCc3cc(F)ccc3C#N)C2)CC1	ZINC001024138529	1323163770	/nfs/dbraw/zinc/16/37/70/1323163770.db2.gz	MUDZIIPMUNGUHV-OAHLLOKOSA-N	0	3	343.446	3.216	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1ccccc1-c1csc(C)n1	ZINC000931219204	1329073555	/nfs/dbraw/zinc/07/35/55/1329073555.db2.gz	LYHIOPCMYUOAIF-UHFFFAOYSA-N	0	3	342.468	3.195	20	30		EGEDHN
CN(C(=O)c1cccnc1)C1CCC(NCc2ccccc2C#N)CC1	ZINC000963004168	1323184542	/nfs/dbraw/zinc/18/45/42/1323184542.db2.gz	XZDBSXIUEZBEGO-UHFFFAOYSA-N	0	3	348.450	3.126	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccnc(-n2cccc2)c1	ZINC001024495125	1323444494	/nfs/dbraw/zinc/44/44/94/1323444494.db2.gz	FAEZZHVHBGVFOA-SFHVURJKSA-N	0	3	338.455	3.033	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1cc2c([nH]1)c(F)ccc2C	ZINC001024517040	1323467576	/nfs/dbraw/zinc/46/75/76/1323467576.db2.gz	QHLHXEHOWXEETJ-OAHLLOKOSA-N	0	3	341.430	3.223	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccc(OC)c(C(C)C)c1	ZINC001024534300	1323478034	/nfs/dbraw/zinc/47/80/34/1323478034.db2.gz	GUGWTKUCQOPTOL-GOSISDBHSA-N	0	3	342.483	3.426	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@@H]1Cc2cc(Cl)ccc2O1	ZINC001024537540	1323479041	/nfs/dbraw/zinc/47/90/41/1323479041.db2.gz	HEBLOLGGFDYIGN-AEFFLSMTSA-N	0	3	348.874	3.190	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@@H]1CCc2ccc(F)cc2O1	ZINC001024554397	1323495195	/nfs/dbraw/zinc/49/51/95/1323495195.db2.gz	LSCXSYAYXMXQSC-ROUUACIJSA-N	0	3	346.446	3.066	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cncc(OC(C)C)c1	ZINC001024596021	1323527824	/nfs/dbraw/zinc/52/78/24/1323527824.db2.gz	NNPAPFZXSHZJEE-KRWDZBQOSA-N	0	3	331.460	3.029	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@@H]2CCCCN2Cc2ccccc2C)c1	ZINC001024643655	1323569223	/nfs/dbraw/zinc/56/92/23/1323569223.db2.gz	FWVJUCVGCOWHHY-NRFANRHFSA-N	0	3	347.462	3.156	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccc(-c2ccccc2)nc1	ZINC001024727475	1323629582	/nfs/dbraw/zinc/62/95/82/1323629582.db2.gz	LJAUBNIMUVSBHB-HXUWFJFHSA-N	0	3	347.462	3.356	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cccc(N2CCCC2)c1	ZINC001024728136	1323630156	/nfs/dbraw/zinc/63/01/56/1323630156.db2.gz	RXNLWNPAGGKAEX-FQEVSTJZSA-N	0	3	341.499	3.447	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccnc(OC2CCC2)c1	ZINC001024731745	1323632321	/nfs/dbraw/zinc/63/23/21/1323632321.db2.gz	KZTHQLHBIPAUJE-QGZVFWFLSA-N	0	3	343.471	3.173	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccc2ccn(C)c2c1	ZINC001024738599	1323638968	/nfs/dbraw/zinc/63/89/68/1323638968.db2.gz	AXCHVBXLBJIPRD-GOSISDBHSA-N	0	3	325.456	3.339	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1cnn(C(CC)CC)c1C	ZINC001024750334	1323652870	/nfs/dbraw/zinc/65/28/70/1323652870.db2.gz	PLXATZJTMSILJI-SFHVURJKSA-N	0	3	344.503	3.160	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cc2c(C)cccn2c1	ZINC001024755972	1323657188	/nfs/dbraw/zinc/65/71/88/1323657188.db2.gz	LOQYTAKISCIWKM-GOSISDBHSA-N	0	3	325.456	3.408	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccc(COC)c(F)c1	ZINC001024775380	1323676216	/nfs/dbraw/zinc/67/62/16/1323676216.db2.gz	BBXAJOHZDWMEBZ-QGZVFWFLSA-N	0	3	334.435	3.133	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cnn(CC(C)C)c1C	ZINC001024781457	1323684052	/nfs/dbraw/zinc/68/40/52/1323684052.db2.gz	USRSKPCRJFCWDP-QGZVFWFLSA-N	0	3	332.492	3.008	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccc(N(C)C(C)C)cc1	ZINC001024824589	1323728400	/nfs/dbraw/zinc/72/84/00/1323728400.db2.gz	RBQHRAIZAGLOKF-FQEVSTJZSA-N	0	3	341.499	3.139	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)[C@H]2[C@@H]3CCC[C@@H]32)s1	ZINC001024916845	1323780687	/nfs/dbraw/zinc/78/06/87/1323780687.db2.gz	YRHOWOMINHYZQK-ZSGPHXLJSA-N	0	3	343.496	3.137	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCCC[C@@H]1CNCc1cccc(OC)n1	ZINC001025038122	1323840839	/nfs/dbraw/zinc/84/08/39/1323840839.db2.gz	RUDHIIXEYHDVQN-QGZVFWFLSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCCC[C@H]1CNCc1ccc(OC)nc1	ZINC001025069228	1323869129	/nfs/dbraw/zinc/86/91/29/1323869129.db2.gz	DVYXWMMMKHPWLJ-FXAWDEMLSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCCC[C@@H]2CNCc2c(C)noc2CC)C1	ZINC001025076769	1323879161	/nfs/dbraw/zinc/87/91/61/1323879161.db2.gz	UEJBEEOPOCEMJL-MRXNPFEDSA-N	0	3	345.487	3.372	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)[C@H]2CC23CCC3)s1	ZINC001025100505	1323894805	/nfs/dbraw/zinc/89/48/05/1323894805.db2.gz	KRPNUQJQSXFISL-RHSMWYFYSA-N	0	3	343.496	3.281	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc[nH]c1CC	ZINC001025230183	1324016800	/nfs/dbraw/zinc/01/68/00/1324016800.db2.gz	VIWPCLHZKRSONK-RTBURBONSA-N	0	3	327.472	3.060	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccn(CC(C)C)n1	ZINC001025236811	1324027116	/nfs/dbraw/zinc/02/71/16/1324027116.db2.gz	HYQXZAONHFPMHU-RBUKOAKNSA-N	0	3	344.503	3.184	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(C2CC2)on1	ZINC001025254587	1324061439	/nfs/dbraw/zinc/06/14/39/1324061439.db2.gz	LEMOZJOJQALFAC-DLBZAZTESA-N	0	3	329.444	3.197	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc[nH]c1C(C)C	ZINC001025262911	1324074007	/nfs/dbraw/zinc/07/40/07/1324074007.db2.gz	GYISMTRHOJMBBQ-ROUUACIJSA-N	0	3	327.472	3.230	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ocnc1C(F)F	ZINC001025265973	1324077826	/nfs/dbraw/zinc/07/78/26/1324077826.db2.gz	HKKHLHFDXGWVRN-OLZOCXBDSA-N	0	3	339.386	3.257	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cnc2ccccc2c1	ZINC001025270586	1324086706	/nfs/dbraw/zinc/08/67/06/1324086706.db2.gz	DUNUUARRDDBEKE-SFTDATJTSA-N	0	3	347.462	3.327	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1coc(C2CC2)n1	ZINC001025273929	1324090695	/nfs/dbraw/zinc/09/06/95/1324090695.db2.gz	IKDPQFAQVRWWKD-ROUUACIJSA-N	0	3	341.455	3.034	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cccc2c1ccn2C	ZINC001025276231	1324097890	/nfs/dbraw/zinc/09/78/90/1324097890.db2.gz	HLUIMWLLMYXKAW-LEWJYISDSA-N	0	3	349.478	3.271	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc(OC)c(C)c1	ZINC001025278087	1324099023	/nfs/dbraw/zinc/09/90/23/1324099023.db2.gz	QTWRSASBQFYCII-OALUTQOASA-N	0	3	340.467	3.096	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc(OC)c(C)c1	ZINC001025278086	1324099939	/nfs/dbraw/zinc/09/99/39/1324099939.db2.gz	QTWRSASBQFYCII-MOPGFXCFSA-N	0	3	340.467	3.096	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc(C)nc1OC	ZINC001025277799	1324100168	/nfs/dbraw/zinc/10/01/68/1324100168.db2.gz	PQYZEFDYPUJKJQ-QZTJIDSGSA-N	0	3	343.471	3.044	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cccc(Cl)c1	ZINC001025292428	1324117336	/nfs/dbraw/zinc/11/73/36/1324117336.db2.gz	INFNRPGIAANOQN-QZTJIDSGSA-N	0	3	330.859	3.432	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cccc(OC)c1	ZINC001025292954	1324119244	/nfs/dbraw/zinc/11/92/44/1324119244.db2.gz	NOLMJADFDNQMJI-PMACEKPBSA-N	0	3	340.467	3.178	20	30		EGEDHN
C#CCCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cnc(CC)s1	ZINC001025301557	1324134718	/nfs/dbraw/zinc/13/47/18/1324134718.db2.gz	LTGVICPTBCEXJD-HOTGVXAUSA-N	0	3	345.512	3.188	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc3nccc(C)c3c2)C1	ZINC001025428034	1324263037	/nfs/dbraw/zinc/26/30/37/1324263037.db2.gz	KDWLCHALUANXKO-IEBWSBKVSA-N	0	3	349.478	3.397	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc3cc(C)cn3c2)C1	ZINC001025437034	1324276328	/nfs/dbraw/zinc/27/63/28/1324276328.db2.gz	RQNGBCWBNLFWQD-ZWKOTPCHSA-N	0	3	337.467	3.101	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H](C)[C@H]1CCCN(C/C=C\Cl)C1	ZINC001025438149	1324278346	/nfs/dbraw/zinc/27/83/46/1324278346.db2.gz	DBRVJRQODRNVGV-GSNCDVCBSA-N	0	3	335.879	3.257	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cccc3c(C)c(C)[nH]c32)C1	ZINC001025459826	1324303963	/nfs/dbraw/zinc/30/39/63/1324303963.db2.gz	SVHHRXQQHXLQMU-SJORKVTESA-N	0	3	337.467	3.248	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2[nH]c3ccccc3c2Cl)C1	ZINC001025469488	1324315761	/nfs/dbraw/zinc/31/57/61/1324315761.db2.gz	PVHLSRGHCFFZQQ-KGLIPLIRSA-N	0	3	343.858	3.285	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cn(CC)c3ccccc23)C1	ZINC001025478168	1324323087	/nfs/dbraw/zinc/32/30/87/1324323087.db2.gz	KKQCBCDMHSNOSF-SJORKVTESA-N	0	3	337.467	3.125	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(Cl)cc2F)C1	ZINC001025478338	1324323446	/nfs/dbraw/zinc/32/34/46/1324323446.db2.gz	LWCJFOVEAHOABZ-UONOGXRCSA-N	0	3	336.838	3.333	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(C)nc2C2CC2)C1	ZINC001025494611	1324345397	/nfs/dbraw/zinc/34/53/97/1324345397.db2.gz	ZBSQCJUGFHEUQG-WMZOPIPTSA-N	0	3	339.483	3.121	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](C)[C@H]2CCCN(Cc3cnoc3C)C2)CC1	ZINC001025523313	1324367830	/nfs/dbraw/zinc/36/78/30/1324367830.db2.gz	OOXKREDASSAMKD-QAPCUYQASA-N	0	3	345.487	3.446	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(C)oc2C(F)(F)F)C1	ZINC001025546674	1324394607	/nfs/dbraw/zinc/39/46/07/1324394607.db2.gz	SMWORNTUVPJUPO-OLZOCXBDSA-N	0	3	342.361	3.070	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(C(F)F)cc2F)C1	ZINC001025567224	1324412498	/nfs/dbraw/zinc/41/24/98/1324412498.db2.gz	QSKCZRIXNGVLRO-OCCSQVGLSA-N	0	3	338.373	3.227	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cccc(F)c2OCC)C1	ZINC001025577584	1324417274	/nfs/dbraw/zinc/41/72/74/1324417274.db2.gz	CYEFQKQMMCASSA-CVEARBPZSA-N	0	3	346.446	3.078	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc3c(C)cccn3c2)C1	ZINC001025595428	1324443591	/nfs/dbraw/zinc/44/35/91/1324443591.db2.gz	OCFMLHWOHSRSBM-ZWKOTPCHSA-N	0	3	337.467	3.101	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccsc2C(F)F)C1	ZINC001025607886	1324458727	/nfs/dbraw/zinc/45/87/27/1324458727.db2.gz	YDJBMOMKDQQFLQ-NWDGAFQWSA-N	0	3	326.412	3.149	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2c(C)cc(C)cc2C)C1	ZINC001025611571	1324463357	/nfs/dbraw/zinc/46/33/57/1324463357.db2.gz	MLLIXDGEWYUHGS-RBUKOAKNSA-N	0	3	326.484	3.465	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc3c(s2)CCCC3)C1	ZINC001025614606	1324468224	/nfs/dbraw/zinc/46/82/24/1324468224.db2.gz	MNJJEVWMDJLOIX-GOEBONIOSA-N	0	3	330.497	3.090	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(C3CCCC3)no2)C1	ZINC001025624210	1324475291	/nfs/dbraw/zinc/47/52/91/1324475291.db2.gz	BTHDKIOUYZTCIS-WBVHZDCISA-N	0	3	343.471	3.186	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(C)c3c2CCC3)C1	ZINC001025629769	1324481406	/nfs/dbraw/zinc/48/14/06/1324481406.db2.gz	KJYIYAFXFDWSCN-ZWKOTPCHSA-N	0	3	338.495	3.337	20	30		EGEDHN
C/C(=C/C(=O)N1C[C@@H]2CC[C@H](NCc3ccccc3C#N)[C@@H]2C1)C1CC1	ZINC001026207434	1324663495	/nfs/dbraw/zinc/66/34/95/1324663495.db2.gz	UNAZYSWAKFONQP-GPDVEZRDSA-N	0	3	349.478	3.241	20	30		EGEDHN
CC(C(=O)N1C[C@@H]2CC[C@H](NCc3ccccc3C#N)[C@H]2C1)=C1CCC1	ZINC001026264091	1324690985	/nfs/dbraw/zinc/69/09/85/1324690985.db2.gz	QXKZSOKFQOWIQY-ACRUOGEOSA-N	0	3	349.478	3.385	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H]2CC[C@@H](NCc3nc(C)cs3)[C@H]2C1	ZINC001026325971	1324727972	/nfs/dbraw/zinc/72/79/72/1324727972.db2.gz	FVZFXWLCXBLYGV-HRCADAONSA-N	0	3	347.528	3.380	20	30		EGEDHN
Cc1ncccc1C(=O)NC1CCC(NCc2ccccc2C#N)CC1	ZINC001026551625	1324888467	/nfs/dbraw/zinc/88/84/67/1324888467.db2.gz	FUCGGWYOZARPFI-UHFFFAOYSA-N	0	3	348.450	3.093	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)CC2=CCCCC2)C1	ZINC001026733744	1324996731	/nfs/dbraw/zinc/99/67/31/1324996731.db2.gz	BNMXNJDPPCXQPL-SFHVURJKSA-N	0	3	337.467	3.387	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@@H]1CCN(C(=O)CCC2CCC2)C1	ZINC001026759545	1325007044	/nfs/dbraw/zinc/00/70/44/1325007044.db2.gz	KBYUZFAPWBJYPS-INIZCTEOSA-N	0	3	343.446	3.216	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)c2ncccc2C)C1	ZINC000963282978	1325063966	/nfs/dbraw/zinc/06/39/66/1325063966.db2.gz	RNWFWKMXLAGQQO-IRXDYDNUSA-N	0	3	347.890	3.459	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)[C@@H]2CCCC23CC3)C1	ZINC001026918047	1325080088	/nfs/dbraw/zinc/08/00/88/1325080088.db2.gz	MPRKZLVTLSSEQS-LPHOPBHVSA-N	0	3	337.467	3.077	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](CNCc2nc(C)sc2C)C1	ZINC001026988847	1325128459	/nfs/dbraw/zinc/12/84/59/1325128459.db2.gz	QQNSMILGJRIDBM-HNNXBMFYSA-N	0	3	335.517	3.300	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)[C@H]2C[C@H]3C[C@H]3C2)C1	ZINC000963349024	1325140549	/nfs/dbraw/zinc/14/05/49/1325140549.db2.gz	NIMMWZQUJSEJRX-DFBDCSAJSA-N	0	3	336.907	3.488	20	30		EGEDHN
CCC1(C(=O)N2CC[C@H](CNCc3ccccc3C#N)C2)CCC1	ZINC001027004323	1325143984	/nfs/dbraw/zinc/14/39/84/1325143984.db2.gz	ROVCHADPXIQGFX-MRXNPFEDSA-N	0	3	325.456	3.077	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@H](CNCc2nc(C)c(C)s2)C1	ZINC001027039075	1325173759	/nfs/dbraw/zinc/17/37/59/1325173759.db2.gz	VGBGZZBKXFFCRV-YJBOKZPZSA-N	0	3	335.517	3.300	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](CNCc3nc(C)sc3C)C2)CC1	ZINC001027040503	1325175501	/nfs/dbraw/zinc/17/55/01/1325175501.db2.gz	DJZBIOQAUKHEIY-INIZCTEOSA-N	0	3	347.528	3.444	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](CNCc3oc(CCC)nc3C)C2)C1	ZINC001027050531	1325188932	/nfs/dbraw/zinc/18/89/32/1325188932.db2.gz	DLUVLPXDMKVTIH-MRXNPFEDSA-N	0	3	345.487	3.230	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](CNCc3c(F)cccc3F)C2)C1	ZINC001027051305	1325190641	/nfs/dbraw/zinc/19/06/41/1325190641.db2.gz	WSDCQASPLXAEQB-CQSZACIVSA-N	0	3	334.410	3.259	20	30		EGEDHN
C[C@@H](CC(C)(C)C#N)N[C@@H](CO)c1ccc(Br)cc1	ZINC000925674589	1325258062	/nfs/dbraw/zinc/25/80/62/1325258062.db2.gz	SFCMLBICKOHQJV-FZMZJTMJSA-N	0	3	325.250	3.400	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)/C=C\c2ccco2)C1	ZINC001027276325	1325389248	/nfs/dbraw/zinc/38/92/48/1325389248.db2.gz	HHPACHMUUWEZGO-ZBTAVZRMSA-N	0	3	349.434	3.287	20	30		EGEDHN
CCC(CC)C(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001027301104	1325443118	/nfs/dbraw/zinc/44/31/18/1325443118.db2.gz	HNASRURCQIVFIC-IBGZPJMESA-N	0	3	327.472	3.417	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)[C@H](OCC)C2CC2)cc1	ZINC000860468935	1329321120	/nfs/dbraw/zinc/32/11/20/1329321120.db2.gz	GLKVRROMEITYNC-PKOBYXMFSA-N	0	3	342.439	3.492	20	30		EGEDHN
Cc1cc(CN(C)[C@@H]2CCCN(C(=O)C#CC3CC3)C2)c(C)s1	ZINC001027401112	1327623291	/nfs/dbraw/zinc/62/32/91/1327623291.db2.gz	AVQXEYDEJYLPBX-GOSISDBHSA-N	0	3	330.497	3.201	20	30		EGEDHN
Cc1coc(C(=O)N2CCC[C@@H](N(C)Cc3cccc(C#N)c3)C2)c1	ZINC001027538544	1327834891	/nfs/dbraw/zinc/83/48/91/1327834891.db2.gz	FOWHGJFAEUKVMR-GOSISDBHSA-N	0	3	337.423	3.196	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H](N(C)CCn2nc(C)cc2C)C1	ZINC001027560104	1327874514	/nfs/dbraw/zinc/87/45/14/1327874514.db2.gz	PUMHOXJLBDFOIK-AZUAARDMSA-N	0	3	346.519	3.025	20	30		EGEDHN
COc1cc(Cl)ccc1[C@H](C)NCCNc1ccc(C#N)cn1	ZINC000927167305	1327904262	/nfs/dbraw/zinc/90/42/62/1327904262.db2.gz	IOYLJKZNRGOECJ-LBPRGKRZSA-N	0	3	330.819	3.378	20	30		EGEDHN
Cc1cc(Cl)cc([C@H](C)[NH2+]CCNc2ccc(C#N)cn2)c1[O-]	ZINC000927167744	1327905180	/nfs/dbraw/zinc/90/51/80/1327905180.db2.gz	NHLBAIKJQUBHDD-LBPRGKRZSA-N	0	3	330.819	3.383	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2ccc3ccccc3c2)C1	ZINC001027619108	1327985218	/nfs/dbraw/zinc/98/52/18/1327985218.db2.gz	CLIKMUHKOZKGEV-FDFHNCONSA-N	0	3	346.474	3.499	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)[C@H](CC)Cc2ccccc2C)C1	ZINC001027650079	1328031256	/nfs/dbraw/zinc/03/12/56/1328031256.db2.gz	AKTNTOGKXOOZAS-QUCCMNQESA-N	0	3	326.484	3.120	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)[C@H](C)n1c(C)ccc1C)C2	ZINC000965928736	1328113259	/nfs/dbraw/zinc/11/32/59/1328113259.db2.gz	KXYDJLZLQOIZOK-KZIPQDEESA-N	0	3	349.906	3.435	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2cscc2C(F)F)C1	ZINC000966165154	1328211759	/nfs/dbraw/zinc/21/17/59/1328211759.db2.gz	DLYFSYKATFULTQ-FZMZJTMJSA-N	0	3	326.412	3.149	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCc2sc(CNCCCC#N)cc2C1	ZINC000865526147	1329709080	/nfs/dbraw/zinc/70/90/80/1329709080.db2.gz	MFLOAQCANCIRQD-UHFFFAOYSA-N	0	3	335.473	3.435	20	30		EGEDHN
CC(C)[C@H](N[C@H](C)c1ccc(OCC#N)cc1)[C@H](O)C(F)(F)F	ZINC000866464528	1330115931	/nfs/dbraw/zinc/11/59/31/1330115931.db2.gz	WHAANYZFZUUDBL-UGFHNGPFSA-N	0	3	330.350	3.187	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CCC=CCC2)C[C@H]1NCc1ccc(C#N)s1	ZINC000939774532	1330981330	/nfs/dbraw/zinc/98/13/30/1330981330.db2.gz	CZKWEZLZTHSZLY-RDTXWAMCSA-N	0	3	343.496	3.303	20	30		EGEDHN
CC1(C)CN(Cc2ccc(C#N)cc2)CC[C@@H]1NC(=O)C1=CCCC1	ZINC000940673172	1331152443	/nfs/dbraw/zinc/15/24/43/1331152443.db2.gz	MPJFUPYKQPAKDQ-IBGZPJMESA-N	0	3	337.467	3.385	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)cc2)CC[C@@H]1NC(=O)C1C=CC=CC=C1	ZINC000942093238	1331826787	/nfs/dbraw/zinc/82/67/87/1331826787.db2.gz	ZBMRZLWMNXZHDD-UTKZUKDTSA-N	0	3	347.462	3.183	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)cc2)CC[C@@H]1NC(=O)C1(C2CC2)CC1	ZINC000942159649	1331852583	/nfs/dbraw/zinc/85/25/83/1331852583.db2.gz	HRBKFOOZGZABBH-BEFAXECRSA-N	0	3	337.467	3.075	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2csc(C(F)(F)F)c2)[C@H](C)C1	ZINC000942260037	1331889906	/nfs/dbraw/zinc/88/99/06/1331889906.db2.gz	WFBWGOOTFNLFHV-DGCLKSJQSA-N	0	3	344.402	3.230	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2scnc2C2CCCC2)[C@H](C)C1	ZINC000942304779	1331899090	/nfs/dbraw/zinc/89/90/90/1331899090.db2.gz	RLYGULGAWWHAOY-HIFRSBDPSA-N	0	3	333.501	3.427	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2coc3ccc(OC)cc32)[C@@H](C)C1	ZINC000942431109	1331932873	/nfs/dbraw/zinc/93/28/73/1331932873.db2.gz	KYRXMCMIXKICRS-SUMWQHHRSA-N	0	3	328.412	3.068	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C)c3cccnc23)[C@H](C)C1	ZINC000942522984	1331954305	/nfs/dbraw/zinc/95/43/05/1331954305.db2.gz	JSRXWGICQKOHMQ-APWZRJJASA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2c(C)cc(C)cc2C)[C@H](C)C1	ZINC000942597569	1331996202	/nfs/dbraw/zinc/99/62/02/1331996202.db2.gz	LRJRWRUUORVMMJ-UYAOXDASSA-N	0	3	326.484	3.004	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(F)c(Cl)c2F)[C@H](C)C1	ZINC000942602395	1331999434	/nfs/dbraw/zinc/99/94/34/1331999434.db2.gz	ILNGHNBITKDTJN-BXUZGUMPSA-N	0	3	340.801	3.082	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C(C)C)nc2CC)[C@H](C)C1	ZINC000942859899	1332049625	/nfs/dbraw/zinc/04/96/25/1332049625.db2.gz	OWOBHWKJVPOKEL-UZLBHIALSA-N	0	3	341.499	3.231	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccn2C2CCCC2)[C@@H](C)C1	ZINC000943772083	1332261356	/nfs/dbraw/zinc/26/13/56/1332261356.db2.gz	QAIJWYBHFSMNMY-FUHWJXTLSA-N	0	3	327.472	3.067	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc3nc(C)sc3c2)[C@@H](C)C1	ZINC000943985995	1332303896	/nfs/dbraw/zinc/30/38/96/1332303896.db2.gz	CCYMCFSSFJDFPQ-WFASDCNBSA-N	0	3	329.469	3.231	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnc(CC(C)(C)C)s2)[C@@H](C)C1	ZINC000944033768	1332312758	/nfs/dbraw/zinc/31/27/58/1332312758.db2.gz	PLGABFMMFCRJFG-UONOGXRCSA-N	0	3	335.517	3.358	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C(C)(C)c2ccccc2Cl)[C@H](C)C1	ZINC000944215821	1332347518	/nfs/dbraw/zinc/34/75/18/1332347518.db2.gz	VSSZSSFCOQLNQA-RHSMWYFYSA-N	0	3	332.875	3.077	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(Cl)cc(Cl)c2)[C@@H](C)C1	ZINC000944318371	1332372552	/nfs/dbraw/zinc/37/25/52/1332372552.db2.gz	PGXLZJCUKUTHNO-BLLLJJGKSA-N	0	3	339.266	3.457	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3ccc(Cl)cc3)CC2)[C@H](C)C1	ZINC000944655461	1332421751	/nfs/dbraw/zinc/42/17/51/1332421751.db2.gz	QNPFTCYDAHQLNE-QAPCUYQASA-N	0	3	344.886	3.222	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3ccccc3)CCCC2)[C@@H](C)C1	ZINC000944697069	1332422779	/nfs/dbraw/zinc/42/27/79/1332422779.db2.gz	BDHVPEDXMKOAFN-AZUAARDMSA-N	0	3	338.495	3.348	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2c[nH]cc2-c2ccccc2)[C@H](C)C1	ZINC000944921054	1332454634	/nfs/dbraw/zinc/45/46/34/1332454634.db2.gz	XXQZTUXJWBCZDQ-UZLBHIALSA-N	0	3	335.451	3.145	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)CC2C3CC4CC(C3)CC2C4)[C@H](C)C1	ZINC000945006087	1332475254	/nfs/dbraw/zinc/47/52/54/1332475254.db2.gz	GYQDJZALBBWLFB-KBDFJOJTSA-N	0	3	342.527	3.299	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3ccc(C)cc3)CCC2)[C@H](C)C1	ZINC000945365622	1332568025	/nfs/dbraw/zinc/56/80/25/1332568025.db2.gz	LHJVIVNDJVIUKI-QUCCMNQESA-N	0	3	338.495	3.267	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3oc(C)cc3C)CC[C@@H]2C1	ZINC000946542274	1332850667	/nfs/dbraw/zinc/85/06/67/1332850667.db2.gz	KCQFHKQJYFCLPO-IYBDPMFKSA-N	0	3	336.863	3.433	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)C34CCC(CC3)C4)CC[C@@H]2C1	ZINC000946645346	1332870102	/nfs/dbraw/zinc/87/01/02/1332870102.db2.gz	RWZGZRMNYVPYLZ-RJSVMHHESA-N	0	3	336.907	3.490	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CN(Cc3ccc(F)cn3)C[C@H]2CC1	ZINC000946714377	1332882455	/nfs/dbraw/zinc/88/24/55/1332882455.db2.gz	RKGYXLXSLCFJCU-IYBDPMFKSA-N	0	3	345.462	3.103	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)C3CC4(CCC4)C3)CC[C@@H]2C1	ZINC000946726378	1332885079	/nfs/dbraw/zinc/88/50/79/1332885079.db2.gz	PEOATNHKQIVXQC-IYBDPMFKSA-N	0	3	336.907	3.490	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@H](C)C(C)(F)F)CC[C@@H]2C1	ZINC000946784275	1332898625	/nfs/dbraw/zinc/89/86/25/1332898625.db2.gz	FNPAHIQFCHYFAP-MELADBBJSA-N	0	3	334.838	3.201	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@H]3CC34CCCC4)CC[C@@H]2C1	ZINC000946845926	1332913527	/nfs/dbraw/zinc/91/35/27/1332913527.db2.gz	MCUDBKNGBIXSRS-IXDOHACOSA-N	0	3	336.907	3.490	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H]2CCN(Cc3ccc(C#N)cc3)[C@H](C)C2)cn1	ZINC000947053235	1332992113	/nfs/dbraw/zinc/99/21/13/1332992113.db2.gz	WSBIKWQQODCWNX-UZLBHIALSA-N	0	3	348.450	3.045	20	30		EGEDHN
Cc1ccncc1C(=O)N[C@H]1CCN(Cc2ccc(C#N)cc2)[C@@H](C)C1	ZINC000947163238	1333030901	/nfs/dbraw/zinc/03/09/01/1333030901.db2.gz	SOKVRWSGBUYDJO-LPHOPBHVSA-N	0	3	348.450	3.045	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H]2CCN(Cc3cccc(C#N)c3)[C@H](C)C2)co1	ZINC000947244674	1333063272	/nfs/dbraw/zinc/06/32/72/1333063272.db2.gz	NXYJTQQYMUYFLB-AUUYWEPGSA-N	0	3	337.423	3.243	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(F)cc3ccncc32)C[C@@H]1C	ZINC000947318230	1333086728	/nfs/dbraw/zinc/08/67/28/1333086728.db2.gz	FVSBVSDILJVYIK-XJKSGUPXSA-N	0	3	327.403	3.143	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc(C(F)F)c2F)C[C@@H]1C	ZINC000947319875	1333087138	/nfs/dbraw/zinc/08/71/38/1333087138.db2.gz	VLGOEPOAKARUTP-STQMWFEESA-N	0	3	338.373	3.369	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3cccc(Cl)c3)CC2)C[C@H]1C	ZINC000947370979	1333106991	/nfs/dbraw/zinc/10/69/91/1333106991.db2.gz	XDXWPNSIDIAMIN-CRAIPNDOSA-N	0	3	344.886	3.364	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cncc(-c3ccccc3)c2)C[C@@H]1C	ZINC000947371539	1333107123	/nfs/dbraw/zinc/10/71/23/1333107123.db2.gz	ZUJQBTWFLBRPND-UWJYYQICSA-N	0	3	347.462	3.355	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C3CC3)[nH]c2C2CC2)C[C@@H]1C	ZINC000947440552	1333128046	/nfs/dbraw/zinc/12/80/46/1333128046.db2.gz	BOTINAIWIAXAGO-WMLDXEAASA-N	0	3	339.483	3.376	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C3CC3)[nH]c2C2CC2)C[C@@H]1C	ZINC000947440553	1333128409	/nfs/dbraw/zinc/12/84/09/1333128409.db2.gz	BOTINAIWIAXAGO-YOEHRIQHSA-N	0	3	339.483	3.376	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)nn2C(CC)CC)C[C@H]1C	ZINC000947471388	1333141650	/nfs/dbraw/zinc/14/16/50/1333141650.db2.gz	BNJDMXDNJKVMNZ-SJORKVTESA-N	0	3	344.503	3.159	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2[nH]c3ccccc3c2Cl)C[C@H]1C	ZINC000947479295	1333143235	/nfs/dbraw/zinc/14/32/35/1333143235.db2.gz	LXYNZAJRLOZJCG-CHWSQXEVSA-N	0	3	329.831	3.037	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2scnc2C2CCCC2)C[C@H]1C	ZINC000947505995	1333149905	/nfs/dbraw/zinc/14/99/05/1333149905.db2.gz	ICACXLSBBPXWHL-GDBMZVCRSA-N	0	3	345.512	3.407	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2ccc(CC(C)C)cc2)C[C@H]1C	ZINC000947520660	1333155979	/nfs/dbraw/zinc/15/59/79/1333155979.db2.gz	QPHZFPHRZYJOAN-XLIONFOSSA-N	0	3	326.484	3.030	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2coc3ccc(OC)cc23)C[C@H]1C	ZINC000947536990	1333161757	/nfs/dbraw/zinc/16/17/57/1333161757.db2.gz	KPXNDQQHXHOEMZ-CABCVRRESA-N	0	3	340.423	3.047	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C)nc2C(C)C)C[C@H]1C	ZINC000947584262	1333181836	/nfs/dbraw/zinc/18/18/36/1333181836.db2.gz	HFAKBSHOGUTKDG-SJORKVTESA-N	0	3	327.472	3.119	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(C3CCC3)cc2)C[C@H]1C	ZINC000947584025	1333182401	/nfs/dbraw/zinc/18/24/01/1333182401.db2.gz	COYXXGBIOUEVHB-UTKZUKDTSA-N	0	3	338.495	3.489	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3cc(Cl)ccc3[nH]2)C[C@@H]1C	ZINC000947606100	1333190312	/nfs/dbraw/zinc/19/03/12/1333190312.db2.gz	BNUUGFYJPMMJFW-XJKSGUPXSA-N	0	3	343.858	3.427	20	30		EGEDHN
Cc1cocc1C(=O)N[C@@H]1CCN(Cc2cccc(C#N)c2)[C@@H](C)C1	ZINC000947623488	1333197077	/nfs/dbraw/zinc/19/70/77/1333197077.db2.gz	BMBAQXUJAZRSIW-MAUKXSAKSA-N	0	3	337.423	3.243	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)[C@H]2C[C@H]3C[C@H]3C2)CCN1Cc1cccc(C#N)c1	ZINC000947639132	1333204076	/nfs/dbraw/zinc/20/40/76/1333204076.db2.gz	MOKVSVZJGQHWSE-IGGMLHCZSA-N	0	3	337.467	3.073	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C(C)(C)c2ccc(Cl)cc2)C[C@H]1C	ZINC000947670642	1333217558	/nfs/dbraw/zinc/21/75/58/1333217558.db2.gz	HBSLCCPMQUEOEL-RHSMWYFYSA-N	0	3	332.875	3.220	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3ncccc3C)[C@@H](C)C2)C1	ZINC000947703161	1333234158	/nfs/dbraw/zinc/23/41/58/1333234158.db2.gz	VYBMYPWXUWSFIL-DLBZAZTESA-N	0	3	327.472	3.215	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc(Cl)c(F)c2)C[C@H]1C	ZINC000947750084	1333250185	/nfs/dbraw/zinc/25/01/85/1333250185.db2.gz	LOGOCHHVQNOUDU-UKRRQHHQSA-N	0	3	336.838	3.014	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2ccc(C(C)(C)C)cc2)C[C@@H]1C	ZINC000947751265	1333250813	/nfs/dbraw/zinc/25/08/13/1333250813.db2.gz	WPCMEBULZNJANV-LPHOPBHVSA-N	0	3	326.484	3.129	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cnc(-c3ccoc3)s2)C[C@@H]1C	ZINC000947779799	1333259231	/nfs/dbraw/zinc/25/92/31/1333259231.db2.gz	SYMPAABGTKGUIY-ZFWWWQNUSA-N	0	3	343.452	3.009	20	30		EGEDHN
Cc1cc(C(=O)N[C@H]2CCN(Cc3ccc(C#N)cc3)[C@H](C)C2)ccn1	ZINC000947833487	1333273237	/nfs/dbraw/zinc/27/32/37/1333273237.db2.gz	UKJRBZCZTIXPAF-UZLBHIALSA-N	0	3	348.450	3.045	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cccc3ccccc32)C[C@H]1C	ZINC000947956896	1333319479	/nfs/dbraw/zinc/31/94/79/1333319479.db2.gz	GFXDZRIFJSLYMC-XLIONFOSSA-N	0	3	334.463	3.375	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2c(F)cccc2Cl)C[C@H]1C	ZINC000947967237	1333324770	/nfs/dbraw/zinc/32/47/70/1333324770.db2.gz	NBODQMZGPVOKRX-ZIAGYGMSSA-N	0	3	336.838	3.014	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2c[nH]c3c2cccc3CC)C[C@@H]1C	ZINC000948071413	1333364461	/nfs/dbraw/zinc/36/44/61/1333364461.db2.gz	XXNLDVKDBJTVMR-HOCLYGCPSA-N	0	3	325.456	3.499	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C(C)(F)F)cc2)C[C@H]1C	ZINC000948105918	1333376250	/nfs/dbraw/zinc/37/62/50/1333376250.db2.gz	ZELHRCLYKIDNAM-RHSMWYFYSA-N	0	3	334.410	3.404	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cc3c(o2)CCCC3)CC1	ZINC000948432472	1333522472	/nfs/dbraw/zinc/52/24/72/1333522472.db2.gz	HGHZYOBGCXNUKI-KRWDZBQOSA-N	0	3	328.456	3.108	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2ccc(C(C)C)nc2)CC1	ZINC000948438882	1333525087	/nfs/dbraw/zinc/52/50/87/1333525087.db2.gz	BRJCOWDQZSEKCW-SFHVURJKSA-N	0	3	327.472	3.155	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)Cc2ccccc2CC)CC1	ZINC000948540959	1333562505	/nfs/dbraw/zinc/56/25/05/1333562505.db2.gz	BCEKXYXCOATJMN-HXUWFJFHSA-N	0	3	326.484	3.128	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)[C@@H]2CC=CC[C@H]2C(F)(F)F)CC1	ZINC000948554309	1333573240	/nfs/dbraw/zinc/57/32/40/1333573240.db2.gz	ULXWUUURTXZYNZ-ARFHVFGLSA-N	0	3	342.405	3.077	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2sc(C)nc2CC(C)C)CC1	ZINC000948590625	1333587381	/nfs/dbraw/zinc/58/73/81/1333587381.db2.gz	MTVMDGMHIMSYDZ-MRXNPFEDSA-N	0	3	347.528	3.210	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2cc3c(ccc(C)c3C)[nH]2)CC1	ZINC000948670265	1333622646	/nfs/dbraw/zinc/62/26/46/1333622646.db2.gz	OCMVQRWRAZLPCM-KRWDZBQOSA-N	0	3	337.467	3.344	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccc(C)s2)CC1	ZINC000948841718	1333706322	/nfs/dbraw/zinc/70/63/22/1333706322.db2.gz	YYHPFYNAIXQVOB-GVDBMIGSSA-N	0	3	330.497	3.106	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2ccc3nc(C)ccc3c2)CC1	ZINC000948873587	1333716590	/nfs/dbraw/zinc/71/65/90/1333716590.db2.gz	MDVQMUYKIQHHRR-HXUWFJFHSA-N	0	3	349.478	3.493	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@H]1CNC(=O)c1ccn(C)c1	ZINC000948906168	1333728095	/nfs/dbraw/zinc/72/80/95/1333728095.db2.gz	KHLYTUVPGZTPOQ-HXUWFJFHSA-N	0	3	337.467	3.321	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2c3ccccc3CCN2CCC)cc1	ZINC000948945649	1333743447	/nfs/dbraw/zinc/74/34/47/1333743447.db2.gz	AFPBMWDKBYKQKA-OAQYLSRUSA-N	0	3	332.447	3.407	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccc(CCC)cc1)CCO2	ZINC000949174519	1333788903	/nfs/dbraw/zinc/78/89/03/1333788903.db2.gz	VSTQUCKXYPUJQJ-UHFFFAOYSA-N	0	3	342.483	3.132	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H](C)CC1CCCCC1)CCO2	ZINC000949202957	1333795633	/nfs/dbraw/zinc/79/56/33/1333795633.db2.gz	VTXICMKEOZZZHE-GOSISDBHSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)c3cccs3)CC2)C1	ZINC000949285466	1333815635	/nfs/dbraw/zinc/81/56/35/1333815635.db2.gz	GMNCNPYKDBLQCE-UHFFFAOYSA-N	0	3	334.485	3.021	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)CCC3CCC3)CC2)C1	ZINC000949336122	1333826551	/nfs/dbraw/zinc/82/65/51/1333826551.db2.gz	PKLPLTGGJYSZFL-UHFFFAOYSA-N	0	3	334.504	3.226	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C[C@@H]3C=CCCC3)CC2)C1	ZINC000949394702	1333835935	/nfs/dbraw/zinc/83/59/35/1333835935.db2.gz	AHPACDDBRARPKF-GOSISDBHSA-N	0	3	332.488	3.002	20	30		EGEDHN
C=C(C)CCN1CC(N(CC)C(=O)c2cnc(-c3ccccc3)[nH]2)C1	ZINC000952378162	1334440756	/nfs/dbraw/zinc/44/07/56/1334440756.db2.gz	CBFUPCZXJVHCTG-UHFFFAOYSA-N	0	3	338.455	3.189	20	30		EGEDHN
CCCCCCCN1CCN(C(=O)CN(C)CC(C)(C)C)CC1	ZINC001113355879	1369367089	/nfs/dbraw/zinc/36/70/89/1369367089.db2.gz	UWWIGJRBWGHILH-UHFFFAOYSA-N	0	3	325.541	3.079	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2[nH]c3ccccc3c2Cl)C1	ZINC000967231589	1335677466	/nfs/dbraw/zinc/67/74/66/1335677466.db2.gz	QPAUMCFDQNMRJJ-XJKSGUPXSA-N	0	3	343.858	3.285	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2cnn3cccc(Cl)c23)C1	ZINC000967287681	1335690333	/nfs/dbraw/zinc/69/03/33/1335690333.db2.gz	IKGZKEZWZSKCLM-BBRMVZONSA-N	0	3	346.862	3.004	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cc3ccccc3cc2F)C1	ZINC000967307632	1335695275	/nfs/dbraw/zinc/69/52/75/1335695275.db2.gz	AIFJITVHPDZZIE-QRWLVFNGSA-N	0	3	338.426	3.442	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2ncsc2C(F)(F)F)C1	ZINC000967358558	1335712827	/nfs/dbraw/zinc/71/28/27/1335712827.db2.gz	RYCCIZUWLJRNDN-WDEREUQCSA-N	0	3	347.406	3.178	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](C)[C@@H](NC(=O)c2ocnc2C(F)(F)F)C1	ZINC000967435885	1335738442	/nfs/dbraw/zinc/73/84/42/1335738442.db2.gz	OSSXDTXEKMSCBN-NEPJUHHUSA-N	0	3	345.365	3.100	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2cc3ccc(C)cc3[nH]2)C1	ZINC000967467657	1335750324	/nfs/dbraw/zinc/75/03/24/1335750324.db2.gz	PMCGGYJVJNXBAC-DNVCBOLYSA-N	0	3	325.456	3.493	20	30		EGEDHN
C=C(C)CCN1CC[C@H](C)[C@H](NC(=O)c2nc(Cl)cs2)C1	ZINC000968016714	1335844630	/nfs/dbraw/zinc/84/46/30/1335844630.db2.gz	MEKUHMHLVARUKT-NWDGAFQWSA-N	0	3	327.881	3.203	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CN(CC3CC(F)(F)C3)CC[C@H]2C)C1	ZINC000968273659	1335882423	/nfs/dbraw/zinc/88/24/23/1335882423.db2.gz	IJVBFDMVZCUTSM-HIFRSBDPSA-N	0	3	326.431	3.215	20	30		EGEDHN
O=C1C=C2CN(Cc3cc(Br)ccc3F)CCC2S1	ZINC001204496168	1370492833	/nfs/dbraw/zinc/49/28/33/1370492833.db2.gz	JAEAGAZJSMRDNA-CYBMUJFWSA-N	0	3	342.233	3.362	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)Cc2cccc(Cl)c2F)C1	ZINC000968354153	1335899756	/nfs/dbraw/zinc/89/97/56/1335899756.db2.gz	NQPCNAWPUXCPLX-XJKSGUPXSA-N	0	3	338.854	3.424	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(C(=O)C3=CCCCCC3)C2)cc1F	ZINC000968494496	1335941631	/nfs/dbraw/zinc/94/16/31/1335941631.db2.gz	HOIRNEGKCWYLNJ-GOSISDBHSA-N	0	3	341.430	3.278	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)Cc2cccc(OCCC)c2)C1	ZINC000968517010	1335949970	/nfs/dbraw/zinc/94/99/70/1335949970.db2.gz	HLOYYJVXZAXOBV-PXNSSMCTSA-N	0	3	344.499	3.421	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2cc(F)c(F)c(F)c2F)C1	ZINC000968568764	1335962211	/nfs/dbraw/zinc/96/22/11/1335962211.db2.gz	CJJKZEIYBNNIBU-GXFFZTMASA-N	0	3	344.352	3.259	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)Cc2c[nH]c3ccccc23)C1	ZINC000968569510	1335963264	/nfs/dbraw/zinc/96/32/64/1335963264.db2.gz	JTHUNYCKSWPYPB-BEFAXECRSA-N	0	3	325.456	3.113	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2cc(Cl)ccc2Cl)C1	ZINC000968584063	1335972844	/nfs/dbraw/zinc/97/28/44/1335972844.db2.gz	RWBICIQIVQGYNO-MLGOLLRUSA-N	0	3	339.266	3.457	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccc(Br)o2)C1	ZINC000968584211	1335972916	/nfs/dbraw/zinc/97/29/16/1335972916.db2.gz	VAOXIOQHZKCUED-RYUDHWBXSA-N	0	3	341.249	3.058	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)CC23CC4CC(CC(C4)C2)C3)C1	ZINC000968584462	1335974361	/nfs/dbraw/zinc/97/43/61/1335974361.db2.gz	XFSVKFGWQRMVKT-YWOLTOGESA-N	0	3	342.527	3.443	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)Cc2ccc(OCC)cc2)C1	ZINC000968618677	1335985205	/nfs/dbraw/zinc/98/52/05/1335985205.db2.gz	HWLXYJSXEGLNRC-QFBILLFUSA-N	0	3	330.472	3.031	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)C2(c3ccccc3)CCCC2)C1	ZINC000968623009	1335986681	/nfs/dbraw/zinc/98/66/81/1335986681.db2.gz	DJODEDURYYYKOB-ICSRJNTNSA-N	0	3	338.495	3.348	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(C(=O)[C@@H]3CCCC4(CC4)C3)C2)s1	ZINC000968663398	1336001576	/nfs/dbraw/zinc/00/15/76/1336001576.db2.gz	IZDQDFJQDBVEIW-HUUCEWRRSA-N	0	3	343.496	3.281	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2ccc(N(C)CC)cc2)C1	ZINC000968701298	1336017467	/nfs/dbraw/zinc/01/74/67/1336017467.db2.gz	FOYQDBJJPANGFG-VQIMIIECSA-N	0	3	329.488	3.159	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1cnc2ccccc2n1	ZINC000968887818	1336080907	/nfs/dbraw/zinc/08/09/07/1336080907.db2.gz	NFQDIGDPQRXGDK-INIZCTEOSA-N	0	3	338.455	3.180	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1cnc(C)nc1C(C)C	ZINC000969056487	1336131890	/nfs/dbraw/zinc/13/18/90/1336131890.db2.gz	GZOMISPXCCQNMN-KRWDZBQOSA-N	0	3	344.503	3.459	20	30		EGEDHN
C#CCCN1CCCCC[C@H]1CNC(=O)c1scnc1C1CC1	ZINC000969062109	1336134183	/nfs/dbraw/zinc/13/41/83/1336134183.db2.gz	JAMIFXHXQWNUMS-HNNXBMFYSA-N	0	3	331.485	3.018	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1noc2c1C[C@@H](C)CC2	ZINC000969097448	1336141667	/nfs/dbraw/zinc/14/16/67/1336141667.db2.gz	LPJWKYFYJXEPPR-HOTGVXAUSA-N	0	3	345.487	3.350	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1ncccc1OC(C)C	ZINC000969132577	1336154860	/nfs/dbraw/zinc/15/48/60/1336154860.db2.gz	DJOCOZPVVLWUCO-QGZVFWFLSA-N	0	3	345.487	3.419	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cc(-c2ccc(C)o2)n[nH]1	ZINC000969144022	1336160592	/nfs/dbraw/zinc/16/05/92/1336160592.db2.gz	AXBRUGAUEMPREF-HNNXBMFYSA-N	0	3	342.443	3.139	20	30		EGEDHN
C#CCC1(C(=O)N2CCC(CNC/C(Cl)=C/Cl)CC2)CCC1	ZINC001205451007	1370759683	/nfs/dbraw/zinc/75/96/83/1370759683.db2.gz	AOWYDBCSVSPMHZ-PTNGSMBKSA-N	0	3	343.298	3.327	20	30		EGEDHN
C[C@H](NC(=O)c1c[nH]c(C#N)c1)C1CN(Cc2ccc(C3CC3)cc2)C1	ZINC000969526477	1336220466	/nfs/dbraw/zinc/22/04/66/1336220466.db2.gz	MOIFHOBRHBQONV-AWEZNQCLSA-N	0	3	348.450	3.014	20	30		EGEDHN
CCc1ccccc1C(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C1	ZINC000969751910	1336243051	/nfs/dbraw/zinc/24/30/51/1336243051.db2.gz	KMEKPWNBYNOUCN-OAHLLOKOSA-N	0	3	339.464	3.186	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)c2ccccc2OC2CCC2)C1	ZINC000970393449	1336303326	/nfs/dbraw/zinc/30/33/26/1336303326.db2.gz	NWNWCKLLMQKPIA-OAHLLOKOSA-N	0	3	328.456	3.244	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)[C@@H]2CC[C@@H]2c2ccc(F)cc2)CC1	ZINC001005753703	1336398939	/nfs/dbraw/zinc/39/89/39/1336398939.db2.gz	GLFNGIGVBQTTIL-RTBURBONSA-N	0	3	330.447	3.428	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)C[C@H]2CCOc3ccccc32)CC1	ZINC001005816003	1336403876	/nfs/dbraw/zinc/40/38/76/1336403876.db2.gz	ZWVAIGYWNIWETB-MRXNPFEDSA-N	0	3	328.456	3.052	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)Cn2cc(C)c3ccccc32)CC1	ZINC001006115906	1336454571	/nfs/dbraw/zinc/45/45/71/1336454571.db2.gz	JFYHDKMSYCVQTK-UHFFFAOYSA-N	0	3	325.456	3.059	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cnc(CC(C)(C)C)s2)CC1	ZINC001006255853	1336477644	/nfs/dbraw/zinc/47/76/44/1336477644.db2.gz	SVLVAACSSHHELX-UHFFFAOYSA-N	0	3	335.517	3.454	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)[C@H]2C[C@H]2c2cc(F)ccc2F)CC1	ZINC001006429499	1336504214	/nfs/dbraw/zinc/50/42/14/1336504214.db2.gz	POGSUJHAIZKRDM-RDJZCZTQSA-N	0	3	334.410	3.177	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@@H]2CCCN(CC[C@@H](C)F)C2)cc1	ZINC001007668614	1336686511	/nfs/dbraw/zinc/68/65/11/1336686511.db2.gz	JKBRQBAFVXLFOG-NVXWUHKLSA-N	0	3	334.435	3.194	20	30		EGEDHN
C#CCCN1CCC[C@H](NC(=O)Cc2cc3ccccc3s2)C1	ZINC001007913540	1336731823	/nfs/dbraw/zinc/73/18/23/1336731823.db2.gz	JEKPUYGSYVYGPE-INIZCTEOSA-N	0	3	326.465	3.048	20	30		EGEDHN
C=C(C)CCN1CCC[C@H](NC(=O)c2cnc(CC3CC3)s2)C1	ZINC001008034024	1336753734	/nfs/dbraw/zinc/75/37/34/1336753734.db2.gz	FXZAKXXROKOXJN-HNNXBMFYSA-N	0	3	333.501	3.256	20	30		EGEDHN
C=C(C)CCN1CCC[C@H](NC(=O)c2c(F)cc(F)cc2F)C1	ZINC001008385379	1336839279	/nfs/dbraw/zinc/83/92/79/1336839279.db2.gz	PXGAIMSXTHMFJX-ZDUSSCGKSA-N	0	3	326.362	3.264	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N[C@H]1CCCN(CC2=CCCCC2)C1	ZINC001008795754	1336926353	/nfs/dbraw/zinc/92/63/53/1336926353.db2.gz	RTEVYRWPHGAGIU-UFYCRDLUSA-N	0	3	346.515	3.439	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H](NC(=O)c2csc(C(F)(F)F)n2)C1	ZINC001009096305	1336969008	/nfs/dbraw/zinc/96/90/08/1336969008.db2.gz	MDTAMOGNFDDWNV-LLVKDONJSA-N	0	3	347.406	3.322	20	30		EGEDHN
C#CCCN1CCC[C@H](NC(=O)C(C)(C)c2ccc(CC)cc2)C1	ZINC001009134395	1336974475	/nfs/dbraw/zinc/97/44/75/1336974475.db2.gz	TYFCMVTYEMHTDP-IBGZPJMESA-N	0	3	326.484	3.131	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H](NC(=O)c2ccc(P(C)(C)=O)cc2)C1	ZINC001009611941	1337047330	/nfs/dbraw/zinc/04/73/30/1337047330.db2.gz	OTIOYLKXTJKAMH-QGZVFWFLSA-N	0	3	348.427	3.095	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3cccc(CC)c3)C2)cc1	ZINC001015482605	1338155523	/nfs/dbraw/zinc/15/55/23/1338155523.db2.gz	NVQSHWQRHXZMEB-NRFANRHFSA-N	0	3	332.447	3.235	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCN(C[C@@H](OC)c3ccccc3)C2)CC1	ZINC001015660297	1338239319	/nfs/dbraw/zinc/23/93/19/1338239319.db2.gz	XBRYONAWEUKWFO-VQTJNVASSA-N	0	3	342.483	3.311	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N[C@@H]1CCN(Cc2ccccc2C)C1	ZINC001015816385	1338325212	/nfs/dbraw/zinc/32/52/12/1338325212.db2.gz	KSYRHEBRHGYMIU-AABGKKOBSA-N	0	3	342.483	3.057	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2cc(F)c3ccccc3c2)CC1	ZINC001016654504	1338680444	/nfs/dbraw/zinc/68/04/44/1338680444.db2.gz	NPBMMQWZOOSCDF-IBGZPJMESA-N	0	3	336.410	3.196	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2oc3ccc(F)cc3c2C)CC1	ZINC001016661541	1338682199	/nfs/dbraw/zinc/68/21/99/1338682199.db2.gz	FTPMETAEOYKWLP-KRWDZBQOSA-N	0	3	340.398	3.098	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2cc3cccc(C)c3s2)CC1	ZINC001016691776	1338692648	/nfs/dbraw/zinc/69/26/48/1338692648.db2.gz	WLJRURWOFNFXTF-KRWDZBQOSA-N	0	3	338.476	3.427	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)Cc2ccc(C)cc2Cl)CC1	ZINC001016695352	1338694212	/nfs/dbraw/zinc/69/42/12/1338694212.db2.gz	JYWOMPPVDMPGRG-SFHVURJKSA-N	0	3	344.886	3.185	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2cc3c(o2)c(F)ccc3C)CC1	ZINC001016746464	1338710526	/nfs/dbraw/zinc/71/05/26/1338710526.db2.gz	USAJHTJIFWZFPR-QGZVFWFLSA-N	0	3	340.398	3.098	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cc(F)cc(Cl)c2)CC1	ZINC001016841715	1338743399	/nfs/dbraw/zinc/74/33/99/1338743399.db2.gz	DSAZDJFQJYMOLC-MRXNPFEDSA-N	0	3	334.822	3.087	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cccc(F)c2Cl)CC1	ZINC001016846612	1338745781	/nfs/dbraw/zinc/74/57/81/1338745781.db2.gz	DEICBFZDHZWHCB-OAHLLOKOSA-N	0	3	334.822	3.087	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)[C@@H](C)c2ccc(CC)cc2)CC1	ZINC001016880310	1338757776	/nfs/dbraw/zinc/75/77/76/1338757776.db2.gz	SHUVMRYZVHRLQQ-FXAWDEMLSA-N	0	3	338.495	3.347	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)C[C@@H]2CCc3ccccc32)CC1	ZINC001016886646	1338759350	/nfs/dbraw/zinc/75/93/50/1338759350.db2.gz	SYIUMMRFQPANJQ-ICSRJNTNSA-N	0	3	336.479	3.101	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(O[C@H](C)CC)cc2)CC1	ZINC001016912419	1338767465	/nfs/dbraw/zinc/76/74/65/1338767465.db2.gz	BLIGFFDNLOEISQ-APWZRJJASA-N	0	3	340.467	3.081	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2coc3ccc(Cl)cc32)CC1	ZINC001016954305	1338782854	/nfs/dbraw/zinc/78/28/54/1338782854.db2.gz	HSOTUMHRRWCBQD-KRWDZBQOSA-N	0	3	342.826	3.304	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2c[nH]cc2-c2ccccc2)CC1	ZINC001016969635	1338787538	/nfs/dbraw/zinc/78/75/38/1338787538.db2.gz	NEVKAFZTHZPMGJ-FQEVSTJZSA-N	0	3	347.462	3.289	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)[C@@H](C)c2ccc(F)c(F)c2)CC1	ZINC001016985879	1338793161	/nfs/dbraw/zinc/79/31/61/1338793161.db2.gz	LITJEKPCIXANSU-KSSFIOAISA-N	0	3	346.421	3.062	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)[C@H]2CCCCc3ccccc32)CC1	ZINC001016990936	1338795926	/nfs/dbraw/zinc/79/59/26/1338795926.db2.gz	WCWBBYAXUZJPEA-PMACEKPBSA-N	0	3	336.479	3.101	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(C(C)(F)F)cc2)CC1	ZINC001017005302	1338801737	/nfs/dbraw/zinc/80/17/37/1338801737.db2.gz	WBMGHZBJZPHTQN-KRWDZBQOSA-N	0	3	346.421	3.406	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H](CN(C)Cc2ccc(F)cn2)C1	ZINC001017179698	1338924199	/nfs/dbraw/zinc/92/41/99/1338924199.db2.gz	MVRQEMUELPJDAR-INIZCTEOSA-N	0	3	347.478	3.493	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H](CN(C)Cc3cnc(C)s3)C2)C1	ZINC001017207797	1338954006	/nfs/dbraw/zinc/95/40/06/1338954006.db2.gz	OWCBYLGBTUUVSM-MRXNPFEDSA-N	0	3	347.528	3.478	20	30		EGEDHN
C[C@H]1CCC[C@@H](CCN2C[C@H]3CC[C@@H](C2)N3C(=O)C#CC2CC2)C1	ZINC001017536601	1339363744	/nfs/dbraw/zinc/36/37/44/1339363744.db2.gz	WJMSLQGEXRRKID-FRYIKTPZSA-N	0	3	328.500	3.291	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H](C)n1ccnc1CC	ZINC001017565882	1339368617	/nfs/dbraw/zinc/36/86/17/1339368617.db2.gz	YVVLUIQVFSTTTO-KURKYZTESA-N	0	3	344.503	3.038	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)CCc1ccc2[nH]ccc2c1	ZINC001017739548	1339408131	/nfs/dbraw/zinc/40/81/31/1339408131.db2.gz	PZSXNSYLLGMPOW-KDURUIRLSA-N	0	3	337.467	3.352	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CCO[C@@H](CCC)C1	ZINC001018106543	1339502508	/nfs/dbraw/zinc/50/25/08/1339502508.db2.gz	CFHSBMOPGFVZNE-YRXWBPOGSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(N(C)C)cc1	ZINC001018213021	1339535634	/nfs/dbraw/zinc/53/56/34/1339535634.db2.gz	KVMYSGCXOBACSH-KDURUIRLSA-N	0	3	327.472	3.008	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1C[C@H]1c1cc(F)ccc1F	ZINC001018291727	1339564855	/nfs/dbraw/zinc/56/48/55/1339564855.db2.gz	LYTURDGFMLHNAE-DFGXFYAUSA-N	0	3	346.421	3.320	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1C[C@@H]1c1cc(F)ccc1F	ZINC001018291729	1339565016	/nfs/dbraw/zinc/56/50/16/1339565016.db2.gz	LYTURDGFMLHNAE-KYHPRHEASA-N	0	3	346.421	3.320	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)c1cccc(OC)c1	ZINC001018315502	1339573204	/nfs/dbraw/zinc/57/32/04/1339573204.db2.gz	ZMOMXXBHCUVPGF-YTQUADARSA-N	0	3	342.483	3.440	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(N(C)CC)cc1	ZINC001018334877	1339581841	/nfs/dbraw/zinc/58/18/41/1339581841.db2.gz	LYZLDUMTIBETJW-BGYRXZFFSA-N	0	3	341.499	3.398	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@H](NC2c3ccccc3-c3ccccc32)C1	ZINC001018826840	1339735213	/nfs/dbraw/zinc/73/52/13/1339735213.db2.gz	LQNIKQPJHZADHG-KRWDZBQOSA-N	0	3	342.442	3.360	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CCCN2CCc2scnc2C)CC1	ZINC001028116060	1340437609	/nfs/dbraw/zinc/43/76/09/1340437609.db2.gz	BUTNNBVQVRGLSC-KRWDZBQOSA-N	0	3	347.528	3.321	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1c[nH]nc1C1CCCCC1	ZINC001028252740	1340513964	/nfs/dbraw/zinc/51/39/64/1340513964.db2.gz	BDUVOLMPUXPLDZ-INIZCTEOSA-N	0	3	330.476	3.228	20	30		EGEDHN
C#CCCN1CCC[C@H]1CNC(=O)c1cc2c(s1)CC[C@H](C)C2	ZINC001028306155	1340555156	/nfs/dbraw/zinc/55/51/56/1340555156.db2.gz	DJBDBQMFNOBFMO-HOCLYGCPSA-N	0	3	330.497	3.090	20	30		EGEDHN
Cc1cc(C)c(C(=O)NC[C@H]2CCN(Cc3ccc(C#N)cc3)C2)o1	ZINC001028461776	1340652883	/nfs/dbraw/zinc/65/28/83/1340652883.db2.gz	BTWNRQHGSYQLIR-GOSISDBHSA-N	0	3	337.423	3.020	20	30		EGEDHN
CC1(C)C(C(=O)NC[C@@H]2CCN(Cc3cccc(C#N)c3)C2)C1(C)C	ZINC001028467371	1340655711	/nfs/dbraw/zinc/65/57/11/1340655711.db2.gz	BTNDOKNBJNIGHZ-KRWDZBQOSA-N	0	3	339.483	3.179	20	30		EGEDHN
Cc1cccc(C)c1C(=O)NC[C@@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC001028820932	1340835670	/nfs/dbraw/zinc/83/56/70/1340835670.db2.gz	LDLBNJZRQZEVED-FQEVSTJZSA-N	0	3	347.462	3.427	20	30		EGEDHN
Cc1cc(C(=O)NC[C@@H]2CCN(Cc3cccc(C#N)c3)C2)cs1	ZINC001028865819	1340868351	/nfs/dbraw/zinc/86/83/51/1340868351.db2.gz	AXIWXUMVHPAXEV-KRWDZBQOSA-N	0	3	339.464	3.180	20	30		EGEDHN
C#CCN1CC[C@H](CNC(=O)[C@@H]2C[C@H]2c2ccc3ccccc3c2)C1	ZINC001028873989	1340873590	/nfs/dbraw/zinc/87/35/90/1340873590.db2.gz	NDNVZJKFDLBCQR-TYCQWZJGSA-N	0	3	332.447	3.015	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)[C@@H]2C[C@H]2c2ccc3ccccc3c2)C1	ZINC001028874014	1340873637	/nfs/dbraw/zinc/87/36/37/1340873637.db2.gz	PGTWWNARSIBFOA-BULFRSBZSA-N	0	3	346.474	3.405	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)c2cc3c(s2)CCCCC3)C1	ZINC001028968404	1340896569	/nfs/dbraw/zinc/89/65/69/1340896569.db2.gz	QCPIIUFBHFFDAP-HNNXBMFYSA-N	0	3	330.497	3.092	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](CNC(=O)c3ccc(F)s3)C2)cc1	ZINC001029015640	1340910139	/nfs/dbraw/zinc/91/01/39/1340910139.db2.gz	DRACYHAIZZZIQP-HNNXBMFYSA-N	0	3	343.427	3.011	20	30		EGEDHN
CS[C@@H](C)C(=O)N1CCC([C@@H](C)NCc2ccccc2C#N)CC1	ZINC001029054491	1340920107	/nfs/dbraw/zinc/92/01/07/1340920107.db2.gz	WEVPVDSNFWNWOH-CABCVRRESA-N	0	3	345.512	3.026	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)C1CCN(C(=O)C2CC=CC2)CC1	ZINC001029072233	1340923269	/nfs/dbraw/zinc/92/32/69/1340923269.db2.gz	HUAWQOGHORXPAU-INIZCTEOSA-N	0	3	337.467	3.241	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC([C@@H](C)NCc2cc(F)ccc2C#N)CC1	ZINC001029076903	1340924584	/nfs/dbraw/zinc/92/45/84/1340924584.db2.gz	BWFBTNWLPQSDQY-PSGIOISBSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC([C@@H](C)NCc2cc(C)no2)CC1	ZINC001029136613	1340939845	/nfs/dbraw/zinc/93/98/45/1340939845.db2.gz	JLTQKRSKPSTPED-DNVCBOLYSA-N	0	3	333.476	3.302	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2C[C@H]3CC[C@@H](C2)N3CC[C@@H](C)F)cc1	ZINC001029364565	1340978279	/nfs/dbraw/zinc/97/82/79/1340978279.db2.gz	DIOJXFJCSILTBQ-NXHRZFHOSA-N	0	3	346.446	3.288	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CC[C@@H](C1)N2CCCC1CCOCC1	ZINC001029454299	1340993819	/nfs/dbraw/zinc/99/38/19/1340993819.db2.gz	YDLNVWAPLLTIOI-SVFBPWRDSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@H](CN(C)Cc2cccnc2)C1	ZINC001029749196	1341063101	/nfs/dbraw/zinc/06/31/01/1341063101.db2.gz	UEQPZCGIFLWXNT-MRXNPFEDSA-N	0	3	335.879	3.141	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCN(C(=O)C2(C)CCC2)C1	ZINC001029809656	1341081323	/nfs/dbraw/zinc/08/13/23/1341081323.db2.gz	YGOCJXLZKJEYDE-AWEZNQCLSA-N	0	3	331.485	3.090	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](CN(C)Cc3ocnc3C)C2)CC1	ZINC001029825817	1341087071	/nfs/dbraw/zinc/08/70/71/1341087071.db2.gz	ILMVHFPKNWCGBU-INIZCTEOSA-N	0	3	331.460	3.010	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](CN(C)Cc3ccccn3)C2)CC1	ZINC001029826718	1341087610	/nfs/dbraw/zinc/08/76/10/1341087610.db2.gz	USFXSEAKKPMQMM-QGZVFWFLSA-N	0	3	327.472	3.108	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](N(Cc2ccccc2)C(=O)c2cc[nH]n2)C1	ZINC001029918140	1341117965	/nfs/dbraw/zinc/11/79/65/1341117965.db2.gz	XZZMXSLYUSUKBR-GOSISDBHSA-N	0	3	338.455	3.093	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](N(Cc2ccccc2)C(=O)c2ccn[nH]2)C1	ZINC001029918140	1341117967	/nfs/dbraw/zinc/11/79/67/1341117967.db2.gz	XZZMXSLYUSUKBR-GOSISDBHSA-N	0	3	338.455	3.093	20	30		EGEDHN
C#CCCN1CCC[C@H](N(Cc2ccccc2)C(=O)[C@H]2CC2(F)F)C1	ZINC001029920000	1341119339	/nfs/dbraw/zinc/11/93/39/1341119339.db2.gz	LWUAJKSRNWEHQX-ZWKOTPCHSA-N	0	3	346.421	3.158	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC(CN(C)[C@@H](C)c2cc(F)ccc2F)CC1	ZINC001029945455	1341130474	/nfs/dbraw/zinc/13/04/74/1341130474.db2.gz	ISMFVRQZZPFQKF-KGLIPLIRSA-N	0	3	349.425	3.356	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2c(F)ccc(F)c2Cl)CC[C@H]1C	ZINC001071845078	1354975798	/nfs/dbraw/zinc/97/57/98/1354975798.db2.gz	WOHKJUYQWYCFNO-VXGBXAGGSA-N	0	3	340.801	3.224	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC(CN(C)Cc2cc(C#N)ccc2F)CC1	ZINC001029954262	1341133653	/nfs/dbraw/zinc/13/36/53/1341133653.db2.gz	XHFIJXMDEMFRDF-TVPGTPATSA-N	0	3	343.446	3.334	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC(CN(C)Cc2cnc(C)cn2)CC1	ZINC001029983106	1341143919	/nfs/dbraw/zinc/14/39/19/1341143919.db2.gz	VXBLICBOAHPONE-UHFFFAOYSA-N	0	3	344.503	3.058	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC(CN(C)Cc2ccc(F)cn2)CC1	ZINC001029983853	1341143925	/nfs/dbraw/zinc/14/39/25/1341143925.db2.gz	QLTXEUUUXHMVKD-UHFFFAOYSA-N	0	3	333.451	3.103	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC(CN(C)Cc2ccc(F)cn2)CC1	ZINC001029990431	1341148382	/nfs/dbraw/zinc/14/83/82/1341148382.db2.gz	MBCRPHBXLWEHMB-HXUWFJFHSA-N	0	3	347.478	3.493	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC(CN(C)Cc2ocnc2C)CC1	ZINC001029992383	1341149457	/nfs/dbraw/zinc/14/94/57/1341149457.db2.gz	VZZYBIOSFQVAAO-LJQANCHMSA-N	0	3	333.476	3.256	20	30		EGEDHN
C#Cc1ccc(C(=O)NCC2CN([C@H](C)c3ccccc3C)C2)cc1	ZINC001031892107	1341417624	/nfs/dbraw/zinc/41/76/24/1341417624.db2.gz	MRTHYJCNVLNVIO-QGZVFWFLSA-N	0	3	332.447	3.399	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NCC1CN([C@H](C)c2ccccc2C)C1	ZINC001032047168	1341445346	/nfs/dbraw/zinc/44/53/46/1341445346.db2.gz	CAGUKLGEYGOCES-UXPWSPDFSA-N	0	3	342.483	3.085	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cc(C)cc(OC)c1C	ZINC001032499241	1341523490	/nfs/dbraw/zinc/52/34/90/1341523490.db2.gz	VFVXYJOSJCJDFV-IRXDYDNUSA-N	0	3	328.456	3.177	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H]2C[C@H]1CN2CCCC1CCOCC1	ZINC001032606640	1341556371	/nfs/dbraw/zinc/55/63/71/1341556371.db2.gz	YGWLAJCPDJWDMZ-BJLQDIEVSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C1(c2ccccc2F)CCC1	ZINC001032726944	1341593486	/nfs/dbraw/zinc/59/34/86/1341593486.db2.gz	XLNZFZMYQHOECL-IRXDYDNUSA-N	0	3	342.458	3.499	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H](C)Cc1ccc(F)cc1	ZINC001032812353	1341624633	/nfs/dbraw/zinc/62/46/33/1341624633.db2.gz	ZLISHWMEVPPHEQ-SNRMKQJTSA-N	0	3	330.447	3.256	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N(C)[C@@H]1CCN(CC=C(C)C)C1	ZINC001033205679	1341752412	/nfs/dbraw/zinc/75/24/12/1341752412.db2.gz	ZRBOHOYXXZARLT-QGZVFWFLSA-N	0	3	328.456	3.364	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2ccc(C(F)F)c(F)c2)C1	ZINC001033419691	1341821463	/nfs/dbraw/zinc/82/14/63/1341821463.db2.gz	DCXPPTYJQHCQKN-ZDUSSCGKSA-N	0	3	326.362	3.486	20	30		EGEDHN
C=CCCN1CC[C@@H](N(C)C(=O)c2sc(CC3CC3)nc2C)C1	ZINC001033542796	1341864568	/nfs/dbraw/zinc/86/45/68/1341864568.db2.gz	GTBVMDZBJKAZCE-OAHLLOKOSA-N	0	3	333.501	3.126	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@H]2CCN(Cc3ccc(C)cc3C)C2)nc1	ZINC001033595119	1341889500	/nfs/dbraw/zinc/88/95/00/1341889500.db2.gz	ATFZNPKUIHLEOW-FQEVSTJZSA-N	0	3	347.462	3.026	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2ccc(C(F)(F)F)cc2)C1	ZINC001033605081	1341895372	/nfs/dbraw/zinc/89/53/72/1341895372.db2.gz	BWRVYOFCGUDSGV-OAHLLOKOSA-N	0	3	326.362	3.428	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)Cc2coc3cc(C)ccc23)C1	ZINC001033639056	1341921815	/nfs/dbraw/zinc/92/18/15/1341921815.db2.gz	ZRHNALBGERKJDC-KRWDZBQOSA-N	0	3	326.440	3.393	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2cc3c([nH]2)c(F)ccc3C)C1	ZINC001033876965	1342054674	/nfs/dbraw/zinc/05/46/74/1342054674.db2.gz	GANTXAFCJGACQC-HNNXBMFYSA-N	0	3	341.430	3.175	20	30		EGEDHN
C=CCOc1ccc(C(=O)N(CC)[C@H]2CCN(CC(=C)C)C2)cc1	ZINC001033881366	1342057343	/nfs/dbraw/zinc/05/73/43/1342057343.db2.gz	QCCTUSTXVWPRHB-SFHVURJKSA-N	0	3	328.456	3.364	20	30		EGEDHN
C=C(C)CCN1CC[C@H](N(CC)C(=O)c2ncc(Cl)s2)C1	ZINC001033896261	1342068803	/nfs/dbraw/zinc/06/88/03/1342068803.db2.gz	HCLOBSHJDCAFFA-LBPRGKRZSA-N	0	3	327.881	3.299	20	30		EGEDHN
C=C(C)CCN1CC[C@H](N(CC)C(=O)c2nc(Cl)cs2)C1	ZINC001033938133	1342100608	/nfs/dbraw/zinc/10/06/08/1342100608.db2.gz	SXZKFXGZAZZBTR-LBPRGKRZSA-N	0	3	327.881	3.299	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2c[nH]c(=O)c3ccccc23)C1	ZINC001033973977	1342123685	/nfs/dbraw/zinc/12/36/85/1342123685.db2.gz	KZUAQTCKVDRGTM-HNNXBMFYSA-N	0	3	339.439	3.053	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@@H]2CCc3cccc(OC)c32)C1	ZINC001033979071	1342127533	/nfs/dbraw/zinc/12/75/33/1342127533.db2.gz	FTVHNSVMTBJPOT-ZWKOTPCHSA-N	0	3	342.483	3.224	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2cc(-c3ccccc3)ccn2)C1	ZINC001033997689	1342137794	/nfs/dbraw/zinc/13/77/94/1342137794.db2.gz	DTCJGIVTBILXKE-FQEVSTJZSA-N	0	3	347.462	3.308	20	30		EGEDHN
C=CCCN1CC[C@H](N(CC)C(=O)c2ccc(P(C)(C)=O)cc2)C1	ZINC001034047298	1342187484	/nfs/dbraw/zinc/18/74/84/1342187484.db2.gz	FWMNYAAERFZKNR-KRWDZBQOSA-N	0	3	348.427	3.047	20	30		EGEDHN
C=CCCN1CCCC[C@@H](NC(=O)c2cnc([C@@H](C)OC)s2)C1	ZINC001034209994	1342320454	/nfs/dbraw/zinc/32/04/54/1342320454.db2.gz	ILDRPKIWEYGJDB-ZIAGYGMSSA-N	0	3	337.489	3.011	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2cc(C(F)F)ccc2F)C1	ZINC001034210114	1342320463	/nfs/dbraw/zinc/32/04/63/1342320463.db2.gz	MZESKOFUKACPGC-AWEZNQCLSA-N	0	3	338.373	3.371	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2csc([C@@H](C)OC)n2)C1	ZINC001034212636	1342321454	/nfs/dbraw/zinc/32/14/54/1342321454.db2.gz	ZJPAXDREXYQPIR-KGLIPLIRSA-N	0	3	337.489	3.011	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)c2ncoc2-c2ccccc2)C1	ZINC001034230032	1342334649	/nfs/dbraw/zinc/33/46/49/1342334649.db2.gz	ANWRKBIOBJOEIR-INIZCTEOSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc3c(c2)OCCCO3)C1	ZINC001034247973	1342345977	/nfs/dbraw/zinc/34/59/77/1342345977.db2.gz	VPHQEKBAEDECQT-QGZVFWFLSA-N	0	3	344.455	3.008	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cc(C)n([C@H](C)CC)n2)C1	ZINC001034281790	1342370977	/nfs/dbraw/zinc/37/09/77/1342370977.db2.gz	KIXMNMNXDUNYLN-NVXWUHKLSA-N	0	3	332.492	3.323	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2noc3c2CC(C)(C)CC3)C1	ZINC001034323246	1342399404	/nfs/dbraw/zinc/39/94/04/1342399404.db2.gz	MHVJRIJDMJAWMR-HNNXBMFYSA-N	0	3	345.487	3.350	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2nc(Cl)sc2Cl)C1	ZINC001034342813	1342415513	/nfs/dbraw/zinc/41/55/13/1342415513.db2.gz	VAFPQFMOEBOGGF-JTQLQIEISA-N	0	3	346.283	3.058	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc3c(c2)[C@H](C)CO3)C1	ZINC001034357876	1342428915	/nfs/dbraw/zinc/42/89/15/1342428915.db2.gz	FLTBPPUIGUUUME-NVXWUHKLSA-N	0	3	328.456	3.343	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCCCN(CCc3ccns3)C2)C1	ZINC001034388611	1342457556	/nfs/dbraw/zinc/45/75/56/1342457556.db2.gz	HFTKHGDKBQVJHV-HNNXBMFYSA-N	0	3	333.501	3.013	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2ccc(C(C)C)nc2CC)C1	ZINC001034395634	1342464102	/nfs/dbraw/zinc/46/41/02/1342464102.db2.gz	AICVNPRBKXMNKH-KRWDZBQOSA-N	0	3	341.499	3.375	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cn(CC)nc2C(C)C)C1	ZINC001034422667	1342484229	/nfs/dbraw/zinc/48/42/29/1342484229.db2.gz	XLGVHRGZRGAJGV-INIZCTEOSA-N	0	3	332.492	3.187	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)c2cc(F)c3ncccc3c2)C1	ZINC001034446722	1342507237	/nfs/dbraw/zinc/50/72/37/1342507237.db2.gz	WOLMGZIJBLKSGX-MRXNPFEDSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2c(C)nn(CCC)c2C)C1	ZINC001034476172	1342532175	/nfs/dbraw/zinc/53/21/75/1342532175.db2.gz	GRSOENCCDJMPQJ-KRWDZBQOSA-N	0	3	332.492	3.070	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cn(CCCC)nc2C)C1	ZINC001034483988	1342541708	/nfs/dbraw/zinc/54/17/08/1342541708.db2.gz	PKANQJDJQXZPQK-QGZVFWFLSA-N	0	3	332.492	3.152	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cccc(NC(C)=O)c2C)C1	ZINC001034483839	1342541826	/nfs/dbraw/zinc/54/18/26/1342541826.db2.gz	HANACXOPWUATSR-QGZVFWFLSA-N	0	3	343.471	3.114	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)[C@H]2CCCc3sc(C)nc32)C1	ZINC001034493874	1342550334	/nfs/dbraw/zinc/55/03/34/1342550334.db2.gz	VZMRUFRSHBCVQB-CABCVRRESA-N	0	3	333.501	3.028	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)[C@]2(C)C=CCC2)CC1	ZINC001034707833	1342703438	/nfs/dbraw/zinc/70/34/38/1342703438.db2.gz	SXJZKBGPPFRKGE-IIAWOOMASA-N	0	3	341.293	3.268	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC[C@@H]1CNCc1cnc(C)s1	ZINC001034947652	1342848902	/nfs/dbraw/zinc/84/89/02/1342848902.db2.gz	UJLBRUKJXBOLGN-CYBMUJFWSA-N	0	3	341.908	3.311	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)c(F)c1	ZINC001035036033	1342889676	/nfs/dbraw/zinc/88/96/76/1342889676.db2.gz	UQXOYMOPHCGVNQ-YLJYHZDGSA-N	0	3	343.446	3.380	20	30		EGEDHN
CC(C)(F)C(=O)N1CCC2(CCN(Cc3ccccc3C#N)C2)CC1	ZINC001035150612	1342964470	/nfs/dbraw/zinc/96/44/70/1342964470.db2.gz	YWYPKZKAMVUYDK-UHFFFAOYSA-N	0	3	343.446	3.121	20	30		EGEDHN
CC(C)=CC(=O)N1CCC2(CCN(CC#Cc3ccccc3)C2)CC1	ZINC001035152581	1342966675	/nfs/dbraw/zinc/96/66/75/1342966675.db2.gz	DIQIJNKBZDYJNP-UHFFFAOYSA-N	0	3	336.479	3.319	20	30		EGEDHN
N#Cc1ccccc1CN1CCC2(C1)CCN(C(=O)C=C1CCC1)CC2	ZINC001035173752	1342990649	/nfs/dbraw/zinc/99/06/49/1342990649.db2.gz	JLHUOMJJWRTHTK-UHFFFAOYSA-N	0	3	349.478	3.483	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC2(CCN(Cc3cnc(C)o3)C2)CC1	ZINC001035212054	1343030684	/nfs/dbraw/zinc/03/06/84/1343030684.db2.gz	PRSCVAXVVVWDIC-UHFFFAOYSA-N	0	3	331.460	3.010	20	30		EGEDHN
CC[C@H](F)C(=O)N1CCC2(CCN(CC#Cc3ccccc3)C2)CC1	ZINC001035218488	1343038519	/nfs/dbraw/zinc/03/85/19/1343038519.db2.gz	QSSDUSCYWWEBSS-IBGZPJMESA-N	0	3	342.458	3.101	20	30		EGEDHN
CC[C@H](F)C(=O)N1CCC2(CCN(Cc3ccccc3C#N)C2)CC1	ZINC001035218215	1343038685	/nfs/dbraw/zinc/03/86/85/1343038685.db2.gz	MOHNYXUVWHPHDZ-SFHVURJKSA-N	0	3	343.446	3.121	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1c(C)cc(F)cc1C)CC2	ZINC001035764980	1343177547	/nfs/dbraw/zinc/17/75/47/1343177547.db2.gz	YVFMJFKNPVQRLK-UHFFFAOYSA-N	0	3	328.431	3.004	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1c(F)ccc(F)c1F)CC2	ZINC001035779367	1343189978	/nfs/dbraw/zinc/18/99/78/1343189978.db2.gz	MQANKGSUNMGZGC-UHFFFAOYSA-N	0	3	338.373	3.218	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC3(CN(CCOC4CCC4)C3)CC2)CC1	ZINC001035787452	1343199236	/nfs/dbraw/zinc/19/92/36/1343199236.db2.gz	PHZQSAVHLSOYKW-UHFFFAOYSA-N	0	3	346.515	3.226	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)C[C@H](C)c1cccc(F)c1)CC2	ZINC001035792015	1343202286	/nfs/dbraw/zinc/20/22/86/1343202286.db2.gz	LKZDTWKIQQZKTR-KRWDZBQOSA-N	0	3	342.458	3.267	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H](C)Cc1cccs1)CC2	ZINC001035806068	1343207718	/nfs/dbraw/zinc/20/77/18/1343207718.db2.gz	RARPBJSUOOWIQW-INIZCTEOSA-N	0	3	332.513	3.427	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@H]1CCO[C@H](CCC)C1)CC2	ZINC001035827963	1343217341	/nfs/dbraw/zinc/21/73/41/1343217341.db2.gz	DHHJIGXLVLPADH-ZWKOTPCHSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cc1cc(C)ccc1F)CC2	ZINC001035841081	1343223200	/nfs/dbraw/zinc/22/32/00/1343223200.db2.gz	KDDDPISTZJGQNK-UHFFFAOYSA-N	0	3	330.447	3.177	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccc(CC(C)C)cc1)CC2	ZINC001035849018	1343228814	/nfs/dbraw/zinc/22/88/14/1343228814.db2.gz	OIOSNZNXBKCRRL-UHFFFAOYSA-N	0	3	338.495	3.446	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@H](C)Oc1ccc(C)cc1)CC2	ZINC001035849088	1343228962	/nfs/dbraw/zinc/22/89/62/1343228962.db2.gz	RUTBYKSTVYKCFR-SFHVURJKSA-N	0	3	342.483	3.263	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccc(C)c3c1CCC3)CC2	ZINC001035858272	1343234720	/nfs/dbraw/zinc/23/47/20/1343234720.db2.gz	GELRLFMIKDZUKD-UHFFFAOYSA-N	0	3	336.479	3.045	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@H]1Oc3ccccc3[C@H]1C)CC2	ZINC001035867156	1343239625	/nfs/dbraw/zinc/23/96/25/1343239625.db2.gz	YDAPPOPDPYYLDO-APWZRJJASA-N	0	3	340.467	3.052	20	30		EGEDHN
C[C@H]1CN(C(=O)C2CCCC2)CC[C@H]1NCc1ccccc1C#N	ZINC001035881326	1343245847	/nfs/dbraw/zinc/24/58/47/1343245847.db2.gz	VWBSPARTDVKXKA-HNAYVOBHSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2cccs2)CC[C@H]1NCc1ccccc1C#N	ZINC001035901586	1343259359	/nfs/dbraw/zinc/25/93/59/1343259359.db2.gz	KBAZOXFCINUMPA-RHSMWYFYSA-N	0	3	339.464	3.260	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](NCc2ccn(C(C)C)n2)[C@H](C)C1	ZINC001036133280	1343320980	/nfs/dbraw/zinc/32/09/80/1343320980.db2.gz	AGHPAKKMEMETOX-SJLPKXTDSA-N	0	3	346.519	3.393	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](NCc2nc(C)cs2)[C@H](C)C1	ZINC001036139637	1343324109	/nfs/dbraw/zinc/32/41/09/1343324109.db2.gz	ZXGJZKADFCXEIN-HIFRSBDPSA-N	0	3	335.517	3.380	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2(C)CCC2)CC[C@H]1NCc1ccccc1C#N	ZINC001036141222	1343325266	/nfs/dbraw/zinc/32/52/66/1343325266.db2.gz	GRQWVAAXBGBQRJ-CRAIPNDOSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@H]1CN(C(=O)C(C)(C)C(F)F)CC[C@H]1NCc1ccccc1C#N	ZINC001036167687	1343340931	/nfs/dbraw/zinc/34/09/31/1343340931.db2.gz	BQTUJUCDDCZBTC-XJKSGUPXSA-N	0	3	349.425	3.176	20	30		EGEDHN
CC(C)C1(C(=O)N2CC[C@@H](NCc3ccccc3C#N)[C@@H](C)C2)CC1	ZINC001036169043	1343342178	/nfs/dbraw/zinc/34/21/78/1343342178.db2.gz	KSUTWWHPSSKNGO-QFBILLFUSA-N	0	3	339.483	3.321	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCCN(C(=O)C2CCC2)C1	ZINC001036341697	1343427837	/nfs/dbraw/zinc/42/78/37/1343427837.db2.gz	WBTJZPXXOLDYDK-DNVCBOLYSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCCN(C(=O)CC2(C)CC2)C1	ZINC001036425562	1343478979	/nfs/dbraw/zinc/47/89/79/1343478979.db2.gz	LTLVWSZDACTKPN-VQIMIIECSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H]([C@@H](C)NCc2cscn2)C1	ZINC001036443625	1343491394	/nfs/dbraw/zinc/49/13/94/1343491394.db2.gz	WBWXQPFXUGNQAS-CABCVRRESA-N	0	3	335.517	3.462	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]([C@@H](C)NCc2nccn2CC)C1	ZINC001036444320	1343491641	/nfs/dbraw/zinc/49/16/41/1343491641.db2.gz	YPEZCFWAWXFETO-IAGOWNOFSA-N	0	3	346.519	3.222	20	30		EGEDHN
C[C@H]1CCCN(C(=O)C2CCC2)[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001036490930	1343513594	/nfs/dbraw/zinc/51/35/94/1343513594.db2.gz	WYZZELDNIRDXHT-IFXJQAMLSA-N	0	3	343.446	3.214	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@@H](C)[C@H]1CNCc1ccc(C#N)s1	ZINC001036503590	1343521535	/nfs/dbraw/zinc/52/15/35/1343521535.db2.gz	ODUGIDZWYIJLSY-RHSMWYFYSA-N	0	3	331.485	3.303	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@H]2[C@@H](CCN2Cc2ccccc2C#N)C1	ZINC001036652399	1343602250	/nfs/dbraw/zinc/60/22/50/1343602250.db2.gz	RSOKFAILHFGDFU-PMACEKPBSA-N	0	3	339.483	3.417	20	30		EGEDHN
C/C(=C/C(=O)N1CC[C@@H]2[C@@H](CCN2CC#Cc2ccccc2)C1)C1CC1	ZINC001036659475	1343606283	/nfs/dbraw/zinc/60/62/83/1343606283.db2.gz	ZSDWERSNUWKANO-KQLRGSPRSA-N	0	3	348.490	3.317	20	30		EGEDHN
CC1(C(=O)N2CC[C@@H]3[C@@H](CCN3CC#Cc3ccccc3)C2)CC=CC1	ZINC001036813507	1343750259	/nfs/dbraw/zinc/75/02/59/1343750259.db2.gz	YINYVNMQYWESOY-LEWJYISDSA-N	0	3	348.490	3.317	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]3[C@H](CCN3Cc3ccccc3C#N)C2)C1	ZINC001036815938	1343753124	/nfs/dbraw/zinc/75/31/24/1343753124.db2.gz	NEUMHVHEXKLPGQ-WOJBJXKFSA-N	0	3	349.478	3.337	20	30		EGEDHN
O=C(C1CC2(CC2)C1)N1CC[C@@H]2[C@@H](CCN2CC#Cc2ccccc2)C1	ZINC001036818541	1343756825	/nfs/dbraw/zinc/75/68/25/1343756825.db2.gz	CVVFUZZDYBEQRU-PZJWPPBQSA-N	0	3	348.490	3.151	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccc(F)c(C#N)c2)C1	ZINC001036876700	1343816242	/nfs/dbraw/zinc/81/62/42/1343816242.db2.gz	UKKHLIVRJHSKQC-MAUKXSAKSA-N	0	3	343.446	3.166	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@H]2[C@@H](CCN2Cc2ccc(F)c(C#N)c2)C1	ZINC001036876702	1343816595	/nfs/dbraw/zinc/81/65/95/1343816595.db2.gz	UKKHLIVRJHSKQC-YJBOKZPZSA-N	0	3	343.446	3.166	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H]2CCC[C@@H]2CNCc2ccccc2C#N)o1	ZINC001036938536	1343881837	/nfs/dbraw/zinc/88/18/37/1343881837.db2.gz	WTJGMBLUCVHIKU-QZTJIDSGSA-N	0	3	337.423	3.148	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCC[C@@H]1NC(=O)c1ccsc1	ZINC001036939114	1343882398	/nfs/dbraw/zinc/88/23/98/1343882398.db2.gz	FRGZQAKQUIJJMN-WMZOPIPTSA-N	0	3	339.464	3.308	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@@H]1CCC[C@H]1NC(=O)C=C1CCC1	ZINC001036980217	1343907397	/nfs/dbraw/zinc/90/73/97/1343907397.db2.gz	FJMDGBOIEVVALR-QFBILLFUSA-N	0	3	341.430	3.182	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCC[C@@H]2CNCc2ocnc2C)CC1	ZINC001037070798	1343963612	/nfs/dbraw/zinc/96/36/12/1343963612.db2.gz	WXIOWQJLBCQQDW-SJORKVTESA-N	0	3	331.460	3.104	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCC[C@@H]2CNCc2ccn(C(C)C)n2)C1	ZINC001037071719	1343965652	/nfs/dbraw/zinc/96/56/52/1343965652.db2.gz	KZVHMCGMEWEDHS-AEFFLSMTSA-N	0	3	344.503	3.195	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@@H]1CCCC[C@@H]1NC(=O)C1CCC1	ZINC001037139171	1343989377	/nfs/dbraw/zinc/98/93/77/1343989377.db2.gz	MIODYIYHDRABJK-LPHOPBHVSA-N	0	3	343.446	3.262	20	30		EGEDHN
CC1(C(=O)N[C@H]2CCCC[C@@H]2CNCc2cc(F)ccc2C#N)CC1	ZINC001037189781	1344028788	/nfs/dbraw/zinc/02/87/88/1344028788.db2.gz	FAICPIJEDGXJNN-QAPCUYQASA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](NCc2nccn2CC)[C@H](CC)C1	ZINC001037908361	1344171623	/nfs/dbraw/zinc/17/16/23/1344171623.db2.gz	XKLUVWFKQTUTTQ-IAGOWNOFSA-N	0	3	346.519	3.222	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](NCc3nccs3)[C@@H](CC)C2)C1	ZINC001037914292	1344174754	/nfs/dbraw/zinc/17/47/54/1344174754.db2.gz	KMQUSRIRNNGQDI-LSDHHAIUSA-N	0	3	333.501	3.216	20	30		EGEDHN
N#Cc1ccc(C(=O)NC[C@@H]2CCN2CCC2CCCCCC2)[nH]1	ZINC001038173701	1344311887	/nfs/dbraw/zinc/31/18/87/1344311887.db2.gz	PVMKDBJQURDKGP-KRWDZBQOSA-N	0	3	328.460	3.051	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NC[C@@H]1CCN1CCC1=CCCCC1	ZINC001038807450	1344590663	/nfs/dbraw/zinc/59/06/63/1344590663.db2.gz	IJKHSRWLCNPWJU-FHWLQOOXSA-N	0	3	332.488	3.049	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C(C)=C2CCC2)CC[C@H]1c1ccc(F)cc1	ZINC001079152304	1357197359	/nfs/dbraw/zinc/19/73/59/1357197359.db2.gz	FTKLGECDBMWHEB-VQTJNVASSA-N	0	3	340.442	3.233	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1ccccc1C(F)(F)F	ZINC001038945573	1344669269	/nfs/dbraw/zinc/66/92/69/1344669269.db2.gz	QDTQXFSILSXGJV-ZDUSSCGKSA-N	0	3	326.362	3.476	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)CCC2CCCC2)C[C@H]1c1cccc(F)c1	ZINC001079170046	1357199673	/nfs/dbraw/zinc/19/96/73/1357199673.db2.gz	VORYZIDGEXEHPV-VQTJNVASSA-N	0	3	342.458	3.313	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1ccc(OCC2CC2)cc1	ZINC001039024778	1344721620	/nfs/dbraw/zinc/72/16/20/1344721620.db2.gz	GDJJIQYQRIWOTG-SFHVURJKSA-N	0	3	328.456	3.246	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)c3cncc(C)c3)CC2)C1	ZINC001039114822	1344786481	/nfs/dbraw/zinc/78/64/81/1344786481.db2.gz	HRPXBUBNKYLECW-QGZVFWFLSA-N	0	3	347.890	3.317	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)[C@H]3[C@@H]4CCC[C@@H]43)CC2)C1	ZINC001039116734	1344788477	/nfs/dbraw/zinc/78/84/77/1344788477.db2.gz	PPQABHMGXLQGBH-WNRNVDISSA-N	0	3	336.907	3.346	20	30		EGEDHN
CC(=O)N1CCCC[C@H]1[C@@H]1CCN(CC#Cc2cccc(Cl)c2)C1	ZINC001039188381	1344890451	/nfs/dbraw/zinc/89/04/51/1344890451.db2.gz	KRQZEPVLNFVQGO-QUCCMNQESA-N	0	3	344.886	3.414	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2nc(C(C)C)oc2C)C1	ZINC001039200763	1344910304	/nfs/dbraw/zinc/91/03/04/1344910304.db2.gz	REPQTPSWAUUBNQ-DLBZAZTESA-N	0	3	343.471	3.056	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccc3occc3c2)C1	ZINC001039209242	1344921866	/nfs/dbraw/zinc/92/18/66/1344921866.db2.gz	IQPWETUUCSCZNO-RTBURBONSA-N	0	3	336.435	3.383	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2c(C)oc(C)c2C)C1	ZINC001039216475	1344933025	/nfs/dbraw/zinc/93/30/25/1344933025.db2.gz	PGDHBEFWWVUWQI-ROUUACIJSA-N	0	3	328.456	3.155	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(C)c(F)c2)C1	ZINC001039216502	1344933087	/nfs/dbraw/zinc/93/30/87/1344933087.db2.gz	PQFYUIAQWYNHRP-QUCCMNQESA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc(C)n(CC)c2C)C1	ZINC001039219761	1344937037	/nfs/dbraw/zinc/93/70/37/1344937037.db2.gz	VHROLZXOTLXFCO-UYAOXDASSA-N	0	3	341.499	3.075	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc3ccsc3[nH]2)C1	ZINC001039224338	1344942076	/nfs/dbraw/zinc/94/20/76/1344942076.db2.gz	DSSWKTUBYKZKSX-WBVHZDCISA-N	0	3	341.480	3.179	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc(F)ccc2Cl)C1	ZINC001039236431	1344958054	/nfs/dbraw/zinc/95/80/54/1344958054.db2.gz	BXPREALPDDGSPG-RDTXWAMCSA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cccc3cc[nH]c32)C1	ZINC001039236414	1344958472	/nfs/dbraw/zinc/95/84/72/1344958472.db2.gz	BTHLDGKXXSLKPQ-MJGOQNOKSA-N	0	3	335.451	3.118	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc3ccccc3[nH]2)C1	ZINC001039238857	1344963105	/nfs/dbraw/zinc/96/31/05/1344963105.db2.gz	KVZQRCLQLTVEKJ-XLIONFOSSA-N	0	3	335.451	3.118	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc3ccccc3[nH]2)C1	ZINC001039238858	1344963369	/nfs/dbraw/zinc/96/33/69/1344963369.db2.gz	KVZQRCLQLTVEKJ-YLJYHZDGSA-N	0	3	335.451	3.118	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)C2CC3(CCC3)C2)C1	ZINC001039244730	1344972923	/nfs/dbraw/zinc/97/29/23/1344972923.db2.gz	MCIVUBAGTOSYKT-MJGOQNOKSA-N	0	3	328.500	3.293	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc(OC)cs2)C1	ZINC001039245315	1344974132	/nfs/dbraw/zinc/97/41/32/1344974132.db2.gz	NTQCDLPRMMEHEB-NVXWUHKLSA-N	0	3	346.496	3.097	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc[nH]c2CCC)C1	ZINC001039246805	1344976175	/nfs/dbraw/zinc/97/61/75/1344976175.db2.gz	URYUGZZBHHJBKE-FXAWDEMLSA-N	0	3	341.499	3.307	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)Cc2ccc(C)s2)C1	ZINC001039250409	1344981118	/nfs/dbraw/zinc/98/11/18/1344981118.db2.gz	KHNUYBPDPGLQOR-MJGOQNOKSA-N	0	3	344.524	3.325	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)Cc2cc(C)ccc2F)C1	ZINC001039256053	1344986091	/nfs/dbraw/zinc/98/60/91/1344986091.db2.gz	HPGHGHWHMVKKNQ-FXAWDEMLSA-N	0	3	342.458	3.013	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(Cl)cn2)C1	ZINC001039258697	1344986761	/nfs/dbraw/zinc/98/67/61/1344986761.db2.gz	ZCTOPPYZSRSXLV-YJBOKZPZSA-N	0	3	345.874	3.075	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cscc1C(F)F	ZINC001039376502	1345033501	/nfs/dbraw/zinc/03/35/01/1345033501.db2.gz	XDNXKYULQXOUTB-OLZOCXBDSA-N	0	3	338.423	3.388	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1cncc2ccccc21	ZINC001039388178	1345040302	/nfs/dbraw/zinc/04/03/02/1345040302.db2.gz	DQPBKKUNPCZMOR-MOPGFXCFSA-N	0	3	335.451	3.029	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccc(Cl)c1F	ZINC001039444161	1345070449	/nfs/dbraw/zinc/07/04/49/1345070449.db2.gz	UDRPVHMMGALGNJ-CABCVRRESA-N	0	3	336.838	3.273	20	30		EGEDHN
C=C(C)CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cnc(CC)s1	ZINC001039476335	1345091430	/nfs/dbraw/zinc/09/14/30/1345091430.db2.gz	NSAWLCBAGHIHLX-CABCVRRESA-N	0	3	333.501	3.351	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC1CC1	ZINC001039695728	1345163144	/nfs/dbraw/zinc/16/31/44/1345163144.db2.gz	NWZPPDAEHIQPQF-HDICACEKSA-N	0	3	340.467	3.340	20	30		EGEDHN
CC(F)(F)C(=O)N1CC[C@@]2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001040037489	1345302928	/nfs/dbraw/zinc/30/29/28/1345302928.db2.gz	ZPLRYKQOQBWTKE-IBGZPJMESA-N	0	3	347.409	3.028	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CC[C@@]2(C1)CCCN(C[C@@H](F)CC)C2	ZINC001040241594	1345391545	/nfs/dbraw/zinc/39/15/45/1345391545.db2.gz	PRTRNQLTZPMUJY-PXNSSMCTSA-N	0	3	347.478	3.350	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3cccc4ccc(C)nc43)C2)C1	ZINC001040258431	1345398692	/nfs/dbraw/zinc/39/86/92/1345398692.db2.gz	ODTLENGUCRSGFY-QFIPXVFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@@H]3CCCc4ccccc43)C2)C1	ZINC001040264822	1345402349	/nfs/dbraw/zinc/40/23/49/1345402349.db2.gz	SEKWVNNRZMPXEI-IFMALSPDSA-N	0	3	336.479	3.054	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3ccnc4ccccc43)C2)C1	ZINC001040284610	1345412236	/nfs/dbraw/zinc/41/22/36/1345412236.db2.gz	WMBJKHJKMUIIEG-OAQYLSRUSA-N	0	3	335.451	3.349	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3c[nH]c4ccccc34)C2)C1	ZINC001040284514	1345412398	/nfs/dbraw/zinc/41/23/98/1345412398.db2.gz	VYMMFRMRAKJAJN-NRFANRHFSA-N	0	3	335.451	3.119	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3cnc4ccccc4c3C)C2)C1	ZINC001040299040	1345420167	/nfs/dbraw/zinc/42/01/67/1345420167.db2.gz	BLQXCXUQXZMQEB-JOCHJYFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cc4cc(C)ccc4[nH]3)C2)C1	ZINC001040322218	1345430785	/nfs/dbraw/zinc/43/07/85/1345430785.db2.gz	IBRUSSZDDOJVLG-QFIPXVFZSA-N	0	3	349.478	3.428	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cc4ncccc4s3)C2)C1	ZINC001040324182	1345432547	/nfs/dbraw/zinc/43/25/47/1345432547.db2.gz	UFIBZKFJAMKAQG-LJQANCHMSA-N	0	3	341.480	3.410	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cc4ccccc4n3C)C2)C1	ZINC001040355363	1345450729	/nfs/dbraw/zinc/45/07/29/1345450729.db2.gz	AXNCYRMGKDTRPN-JOCHJYFZSA-N	0	3	349.478	3.130	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@@H](C)Cc3cccs3)C2)C1	ZINC001040424245	1345490632	/nfs/dbraw/zinc/49/06/32/1345490632.db2.gz	YHLRCEYJZXKJDI-FXAWDEMLSA-N	0	3	344.524	3.265	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@H](C)Cc3cccs3)C2)C1	ZINC001040424251	1345491061	/nfs/dbraw/zinc/49/10/61/1345491061.db2.gz	YHLRCEYJZXKJDI-YLJYHZDGSA-N	0	3	344.524	3.265	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3ccn(C(CC)CC)n3)C2)C1	ZINC001040433042	1345495500	/nfs/dbraw/zinc/49/55/00/1345495500.db2.gz	RKVTYBWJEIWJGX-FQEVSTJZSA-N	0	3	344.503	3.358	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@@H]3C[C@H]3c3ccc(C)s3)C2)C1	ZINC001040444890	1345503628	/nfs/dbraw/zinc/50/36/28/1345503628.db2.gz	XGHZVWGCNQVTRL-HLIPFELVSA-N	0	3	342.508	3.108	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)C(C)(C)c3ccccc3F)C2)C1	ZINC001040453665	1345508138	/nfs/dbraw/zinc/50/81/38/1345508138.db2.gz	QCJRROJQODQMRB-NRFANRHFSA-N	0	3	342.458	3.051	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ccc4cccnc4c3)C2)C1	ZINC001040456829	1345509047	/nfs/dbraw/zinc/50/90/47/1345509047.db2.gz	SEHAOJHPGYLLOQ-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cc4cccnc4s3)C2)C1	ZINC001040478016	1345513480	/nfs/dbraw/zinc/51/34/80/1345513480.db2.gz	FCNUYAUQIUPBJJ-IBGZPJMESA-N	0	3	341.480	3.410	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3ncsc3C(C)C)C2)C1	ZINC001040492237	1345517702	/nfs/dbraw/zinc/51/77/02/1345517702.db2.gz	MYKWSOUXCRDNOV-SFHVURJKSA-N	0	3	333.501	3.381	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)Cc3ccc(Cl)cc3)C2)C1	ZINC001040513480	1345527726	/nfs/dbraw/zinc/52/77/26/1345527726.db2.gz	MUYOBOODACGYPN-HXUWFJFHSA-N	0	3	344.886	3.220	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@H](C)n3c(C)ccc3C)C2)C1	ZINC001040543332	1345538522	/nfs/dbraw/zinc/53/85/22/1345538522.db2.gz	OXJICGLPNOFEOW-PZJWPPBQSA-N	0	3	341.499	3.004	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3ccc(-c4ccccc4)[nH]3)C2)C1	ZINC001040552174	1345544094	/nfs/dbraw/zinc/54/40/94/1345544094.db2.gz	XLSYQBXDCDOPJY-QFIPXVFZSA-N	0	3	347.462	3.243	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CCN(C(=O)C4CCC4)C3)CC2)c1	ZINC001040573093	1345547718	/nfs/dbraw/zinc/54/77/18/1345547718.db2.gz	QBSNYOUJAVBYEO-UHFFFAOYSA-N	0	3	337.467	3.173	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3c[nH]c4ccccc34)C2)CC1	ZINC001040762960	1345576328	/nfs/dbraw/zinc/57/63/28/1345576328.db2.gz	CQCMLSMRKDPCFQ-UHFFFAOYSA-N	0	3	335.451	3.119	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3c(C)[nH]c4ccccc43)C2)CC1	ZINC001040764957	1345576534	/nfs/dbraw/zinc/57/65/34/1345576534.db2.gz	CAKVUCWIWWGGJY-UHFFFAOYSA-N	0	3	349.478	3.428	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)Cc3cc(C)cc(C)c3)C2)CC1	ZINC001040829285	1345584003	/nfs/dbraw/zinc/58/40/03/1345584003.db2.gz	AMJMIRYHEBIWQK-UHFFFAOYSA-N	0	3	338.495	3.184	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@@H](C)c3ccc(Cl)cc3)C2)CC1	ZINC001040829723	1345584095	/nfs/dbraw/zinc/58/40/95/1345584095.db2.gz	GBTKCZFNFZPSSX-INIZCTEOSA-N	0	3	344.886	3.391	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)C[C@H](C)c3cccc(F)c3)C2)CC1	ZINC001040841909	1345587046	/nfs/dbraw/zinc/58/70/46/1345587046.db2.gz	OLAXQJDVLCGSOR-KRWDZBQOSA-N	0	3	342.458	3.267	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3oc(C(C)C)nc3C)C2)CC1	ZINC001040876965	1345593573	/nfs/dbraw/zinc/59/35/73/1345593573.db2.gz	PHSWLXPVDZRTTH-UHFFFAOYSA-N	0	3	343.471	3.058	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@H](C)c3ccccc3F)C2)CC1	ZINC001040889390	1345594511	/nfs/dbraw/zinc/59/45/11/1345594511.db2.gz	BBOXTYYXGXEHJY-QGZVFWFLSA-N	0	3	342.458	3.267	20	30		EGEDHN
C=C[C@H](C(=O)N1CCC2(C1)CCN(CC#CC)CC2)c1ccccc1	ZINC001040946786	1345607132	/nfs/dbraw/zinc/60/71/32/1345607132.db2.gz	IVLYXOYGQIFKGX-FQEVSTJZSA-N	0	3	336.479	3.294	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3sccc3C(C)C)C2)CC1	ZINC001040947008	1345607146	/nfs/dbraw/zinc/60/71/46/1345607146.db2.gz	LTWGNMCPVCBTMU-UHFFFAOYSA-N	0	3	330.497	3.433	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@]3(CCN(C(=O)C[C@H]4C=CCC4)C3)C2)cc1	ZINC001041053388	1345637802	/nfs/dbraw/zinc/63/78/02/1345637802.db2.gz	JBPLHWKDOXDCFL-PGRDOPGGSA-N	0	3	349.478	3.339	20	30		EGEDHN
C/C(=C/C(=O)N1CC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1)C1CC1	ZINC001041096407	1345652260	/nfs/dbraw/zinc/65/22/60/1345652260.db2.gz	DGKLOBXRFNEMIX-AAKHDSTQSA-N	0	3	349.478	3.339	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC[C@]2(CCN(Cc3cccc(C(F)F)c3)C2)C1	ZINC001041136670	1345658479	/nfs/dbraw/zinc/65/84/79/1345658479.db2.gz	NFFSJYSIJJNNPR-KUHUBIRLSA-N	0	3	347.409	3.208	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3occc3-c3ccccc3)C2)C1	ZINC001041453466	1345732779	/nfs/dbraw/zinc/73/27/79/1345732779.db2.gz	DZGXTZAOVPUTQZ-OAQYLSRUSA-N	0	3	334.419	3.118	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccc4cc(C)ccc4n3)C2)C1	ZINC001041460300	1345734115	/nfs/dbraw/zinc/73/41/15/1345734115.db2.gz	DBOAWKGXWJYLTP-QFIPXVFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cc(C)cc(Cl)c3)C2)C1	ZINC001041474237	1345738979	/nfs/dbraw/zinc/73/89/79/1345738979.db2.gz	AARGRLGIISUYIO-IBGZPJMESA-N	0	3	330.859	3.210	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@]2(CCN(CCC(F)(F)F)C2)C1	ZINC001041537276	1345755547	/nfs/dbraw/zinc/75/55/47/1345755547.db2.gz	VKFSSUSWQREOSX-MRXNPFEDSA-N	0	3	332.410	3.466	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@]2(CCN(Cc3c(C)noc3CC)C2)C1	ZINC001041540985	1345756533	/nfs/dbraw/zinc/75/65/33/1345756533.db2.gz	RSAMUEYNVFDRHU-FQEVSTJZSA-N	0	3	345.487	3.182	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@]2(CCN(Cc3cccnc3)C2)C1	ZINC001041627072	1345801500	/nfs/dbraw/zinc/80/15/00/1345801500.db2.gz	ZSYZZKBDGLERTJ-VQTJNVASSA-N	0	3	327.472	3.108	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@]3(CCN(C(=O)C4CC5(CC5)C4)C3)C2)c1	ZINC001041664502	1345815601	/nfs/dbraw/zinc/81/56/01/1345815601.db2.gz	NDTZHJQVVQDRDS-JOCHJYFZSA-N	0	3	349.478	3.173	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cc4occc4s3)C2)C1	ZINC001041672571	1345817922	/nfs/dbraw/zinc/81/79/22/1345817922.db2.gz	QSKSWIUBABDENF-GOSISDBHSA-N	0	3	328.437	3.056	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)Cc3cccc4sccc43)C2)C1	ZINC001041724531	1345833233	/nfs/dbraw/zinc/83/32/33/1345833233.db2.gz	ZUTPYPLYVJDYAL-HXUWFJFHSA-N	0	3	338.476	3.001	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)[C@@H](CC)Cc3cccc(C)c3)C2)C1	ZINC001041727619	1345833633	/nfs/dbraw/zinc/83/36/33/1345833633.db2.gz	KXWHGGZYGDTGCO-UNMCSNQZSA-N	0	3	338.495	3.121	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3ccc(-c4ccco4)s3)C2)C1	ZINC001041766737	1345843148	/nfs/dbraw/zinc/84/31/48/1345843148.db2.gz	AERZGBRHVXWQSX-LJQANCHMSA-N	0	3	340.448	3.179	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3c(Cl)cccc3Cl)C2)C1	ZINC001041801010	1345855555	/nfs/dbraw/zinc/85/55/55/1345855555.db2.gz	DNISQTCKMYCTEI-QGZVFWFLSA-N	0	3	337.250	3.165	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3cc4c(s3)CCCCC4)C2)C1	ZINC001041816155	1345861121	/nfs/dbraw/zinc/86/11/21/1345861121.db2.gz	LHXHBMWJPWGNND-HXUWFJFHSA-N	0	3	342.508	3.188	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3oc4ccccc4c3C)C2)C1	ZINC001041817301	1345861354	/nfs/dbraw/zinc/86/13/54/1345861354.db2.gz	DUSIZNJSXVVEAW-OAQYLSRUSA-N	0	3	336.435	3.303	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)[C@H](CC)c3ccc(Cl)cc3)C2)C1	ZINC001041842078	1345870289	/nfs/dbraw/zinc/87/02/89/1345870289.db2.gz	AKGFFWLFTODPRX-UYAOXDASSA-N	0	3	344.886	3.391	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3CCN(C(=O)C4CCCC4)C[C@@H]32)cc1	ZINC001041886140	1345882944	/nfs/dbraw/zinc/88/29/44/1345882944.db2.gz	WEOXJZAIMWVDGT-ICSRJNTNSA-N	0	3	337.467	3.171	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@H]2CCN(Cc3cccc(C#N)c3)[C@H]2C1	ZINC001041906188	1345890000	/nfs/dbraw/zinc/89/00/00/1345890000.db2.gz	FOVXBRNWNNDXSD-MOPGFXCFSA-N	0	3	325.456	3.027	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CCN(C(=O)c4ccccc4)C[C@H]32)c1	ZINC001041909999	1345892657	/nfs/dbraw/zinc/89/26/57/1345892657.db2.gz	LIQPXURCBLFEKZ-TZIWHRDSSA-N	0	3	345.446	3.295	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CCN(C(=O)CC4CCC4)C[C@@H]32)c1	ZINC001041997936	1345917951	/nfs/dbraw/zinc/91/79/51/1345917951.db2.gz	WDTYHOGWMPKIMM-UXHICEINSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3coc4c3cccc4OC)C[C@H]21	ZINC001042064782	1345933599	/nfs/dbraw/zinc/93/35/99/1345933599.db2.gz	JLVXFQUOZRJGKP-WMLDXEAASA-N	0	3	340.423	3.164	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cscc3C(F)F)C[C@@H]21	ZINC001042065631	1345934584	/nfs/dbraw/zinc/93/45/84/1345934584.db2.gz	XHVACJPDFOUQBM-RISCZKNCSA-N	0	3	326.412	3.408	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3nc(C(C)(C)C)cs3)C[C@@H]21	ZINC001042103001	1345944738	/nfs/dbraw/zinc/94/47/38/1345944738.db2.gz	QTFUXSFQTJGEFG-GJZGRUSLSA-N	0	3	345.512	3.000	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(C4CC4)[nH]c3C3CC3)C[C@@H]21	ZINC001042114332	1345947655	/nfs/dbraw/zinc/94/76/55/1345947655.db2.gz	JWNZQMGSEHRWNB-KXBFYZLASA-N	0	3	339.483	3.492	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)Cn3c(C)cc4ccccc43)C[C@H]21	ZINC001042140757	1345954065	/nfs/dbraw/zinc/95/40/65/1345954065.db2.gz	ANZUCTBUDNIJQL-FXAWDEMLSA-N	0	3	337.467	3.059	20	30		EGEDHN
CC1(CC(=O)N2CC[C@@H]3CCN(Cc4ccc(C#N)cc4)[C@H]3C2)CC1	ZINC001042160012	1345959981	/nfs/dbraw/zinc/95/99/81/1345959981.db2.gz	JWLWRUYTYOCBRF-OALUTQOASA-N	0	3	337.467	3.171	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3csc4ccccc34)C[C@H]21	ZINC001042169702	1345965163	/nfs/dbraw/zinc/96/51/63/1345965163.db2.gz	LADRHUUEOZOUPW-CRAIPNDOSA-N	0	3	338.476	3.461	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2CCN(Cc3cccnc3C)[C@@H]2C1	ZINC001042183844	1345971163	/nfs/dbraw/zinc/97/11/63/1345971163.db2.gz	NXGKJKWVPDZZSS-IEBWSBKVSA-N	0	3	341.499	3.415	20	30		EGEDHN
CCC1(C(=O)N2CC[C@@H]3CCN(Cc4ccc(C#N)cc4)[C@H]3C2)CC1	ZINC001042220328	1345991285	/nfs/dbraw/zinc/99/12/85/1345991285.db2.gz	BOKSBYZFAQLFQR-OALUTQOASA-N	0	3	337.467	3.171	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]3CCN(CCC(F)(F)F)[C@H]3C2)C1	ZINC001042224608	1345995455	/nfs/dbraw/zinc/99/54/55/1345995455.db2.gz	PUNMXSBQTYNEHZ-KBPBESRZSA-N	0	3	330.394	3.218	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@H]3CC[C@H](C(C)C)CC3)C[C@@H]21	ZINC001042288073	1346017897	/nfs/dbraw/zinc/01/78/97/1346017897.db2.gz	ALEPRYQFFMDSEU-WTGUMLROSA-N	0	3	330.516	3.395	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C(C)(C)c3cccc(OC)c3)C[C@@H]21	ZINC001042297786	1346022149	/nfs/dbraw/zinc/02/21/49/1346022149.db2.gz	VLEKWFWVUVKBLD-LPHOPBHVSA-N	0	3	342.483	3.082	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C(C)(C)Cc3ccccc3)C[C@H]21	ZINC001042303493	1346024842	/nfs/dbraw/zinc/02/48/42/1346024842.db2.gz	HQJXWRDGQJCRQX-WOJBJXKFSA-N	0	3	338.495	3.201	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3ccc(C4CC4)s3)C[C@@H]21	ZINC001042314051	1346029503	/nfs/dbraw/zinc/02/95/03/1346029503.db2.gz	XDFNJHGVFMYYRQ-ZBFHGGJFSA-N	0	3	328.481	3.185	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(OC(C)C)cc3)C[C@@H]21	ZINC001042331237	1346039456	/nfs/dbraw/zinc/03/94/56/1346039456.db2.gz	ADPBUHHRNOVYRO-LPHOPBHVSA-N	0	3	328.456	3.196	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C3(C4CCCCC4)CC3)C[C@@H]21	ZINC001042336112	1346041799	/nfs/dbraw/zinc/04/17/99/1346041799.db2.gz	RZPITZDQCRGWTR-MJGOQNOKSA-N	0	3	328.500	3.293	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3c[nH]cc3-c3ccccc3)C[C@H]21	ZINC001042358758	1346053936	/nfs/dbraw/zinc/05/39/36/1346053936.db2.gz	USIXFCVXIUZIOV-WIYYLYMNSA-N	0	3	347.462	3.241	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccccc3OCC3CC3)C[C@H]21	ZINC001042367834	1346059428	/nfs/dbraw/zinc/05/94/28/1346059428.db2.gz	MBOISDIVMHMWEL-IEBWSBKVSA-N	0	3	340.467	3.198	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3ccc(C(C)C)s3)C[C@H]21	ZINC001042369828	1346060021	/nfs/dbraw/zinc/06/00/21/1346060021.db2.gz	AYGJSKQPLZSWDR-JKSUJKDBSA-N	0	3	330.497	3.431	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(-c4ccccc4)[nH]3)C[C@H]21	ZINC001042375664	1346063575	/nfs/dbraw/zinc/06/35/75/1346063575.db2.gz	ZOCBYFNOJGMCJM-FXAWDEMLSA-N	0	3	335.451	3.404	20	30		EGEDHN
Cc1ccncc1C(=O)N1CC[C@H](NCc2ccccc2C#N)C[C@@H]1C	ZINC001044516963	1346354352	/nfs/dbraw/zinc/35/43/52/1346354352.db2.gz	GESOGMBTOGPBMM-LPHOPBHVSA-N	0	3	348.450	3.045	20	30		EGEDHN
C/C=C(/C)C(=O)N1CC[C@H](NCc2cc(F)ccc2C#N)C[C@@H]1C	ZINC001044528520	1346358243	/nfs/dbraw/zinc/35/82/43/1346358243.db2.gz	AVLDQOYHTNVLPA-GCYFVRRBSA-N	0	3	329.419	3.133	20	30		EGEDHN
Cc1cccnc1C(=O)N1CC[C@H](NCc2ccccc2C#N)C[C@H]1C	ZINC001044539999	1346363598	/nfs/dbraw/zinc/36/35/98/1346363598.db2.gz	QUZITNPFNLAPCW-APWZRJJASA-N	0	3	348.450	3.045	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)c2ccccc2)s1	ZINC001044903600	1346458472	/nfs/dbraw/zinc/45/84/72/1346458472.db2.gz	UVOOOAHMQNRONV-HNNXBMFYSA-N	0	3	325.437	3.014	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H]1CNCc1ccc(C#N)cc1F)C(C)(C)C	ZINC001045093327	1346493469	/nfs/dbraw/zinc/49/34/69/1346493469.db2.gz	UVGVEXZRKPMTLC-YOEHRIQHSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC1(C)CC[C@@H]1C(=O)N1CCC[C@H]1CNCc1ccc(C#N)s1	ZINC001045159876	1346510304	/nfs/dbraw/zinc/51/03/04/1346510304.db2.gz	HPLNXALWZNQLNR-XJKSGUPXSA-N	0	3	331.485	3.137	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H]1CNCc1cnn(C(C)(C)C)c1	ZINC001045185908	1346522191	/nfs/dbraw/zinc/52/21/91/1346522191.db2.gz	OVRWJOZGOKWJPH-PXNSSMCTSA-N	0	3	346.519	3.321	20	30		EGEDHN
CC1(NC(=O)[C@H]2[C@@H]3CCC[C@@H]32)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045394931	1346581661	/nfs/dbraw/zinc/58/16/61/1346581661.db2.gz	UXQPRDBKBDGLMK-BWTSREIZSA-N	0	3	337.467	3.075	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)[C@@H]2C[C@H]2c2sccc2C)CC1	ZINC001045437600	1346593359	/nfs/dbraw/zinc/59/33/59/1346593359.db2.gz	CPYBXEXDCPDLCZ-HZPDHXFCSA-N	0	3	330.497	3.154	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)[C@@H]2CCCc3sc(C)nc32)CC1	ZINC001045618751	1346649789	/nfs/dbraw/zinc/64/97/89/1346649789.db2.gz	SEPHDJHSDAKIGF-CQSZACIVSA-N	0	3	333.501	3.028	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1cccc(C#N)c1	ZINC001045758625	1346691477	/nfs/dbraw/zinc/69/14/77/1346691477.db2.gz	ZASMJMPJPWCLCO-QYZOEREBSA-N	0	3	337.467	3.170	20	30		EGEDHN
CCC1(C(=O)N2CC[C@H]3CC[C@@H](C2)N3Cc2ccc(C#N)cc2)CC1	ZINC001045841843	1346717282	/nfs/dbraw/zinc/71/72/82/1346717282.db2.gz	OQVYWWBNYCPIQM-MOPGFXCFSA-N	0	3	337.467	3.314	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCCC[C@@]2(CCN(CC#CC)C2)C1	ZINC001045942555	1346778582	/nfs/dbraw/zinc/77/85/82/1346778582.db2.gz	ZYLWKAOEUSUHHR-IBGZPJMESA-N	0	3	336.907	3.493	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)CCc1ccsc1)C2	ZINC001045944067	1346779870	/nfs/dbraw/zinc/77/98/70/1346779870.db2.gz	WCLCHNHUOIJNSZ-HXUWFJFHSA-N	0	3	344.524	3.409	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cscc1Cl)C2	ZINC001045946170	1346782039	/nfs/dbraw/zinc/78/20/39/1346782039.db2.gz	KNFDUPGZPJWLHC-KRWDZBQOSA-N	0	3	336.888	3.353	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1c(F)cc(C)cc1F)C2	ZINC001045953192	1346787821	/nfs/dbraw/zinc/78/78/21/1346787821.db2.gz	UTBVRZNEGKOCTA-HXUWFJFHSA-N	0	3	346.421	3.225	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@@]2(CCN(Cc3cnoc3C)C2)C1	ZINC001045958102	1346793660	/nfs/dbraw/zinc/79/36/60/1346793660.db2.gz	KTZJUWSAOQYAPA-FQEVSTJZSA-N	0	3	345.487	3.400	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cccc(OCC)c1)C2	ZINC001045968894	1346804169	/nfs/dbraw/zinc/80/41/69/1346804169.db2.gz	IYWJVSMXULBRNA-OAQYLSRUSA-N	0	3	340.467	3.037	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@H](C)c1ccc(C)o1)C2	ZINC001045973314	1346809683	/nfs/dbraw/zinc/80/96/83/1346809683.db2.gz	OLYPAPKBPIHLBQ-WIYYLYMNSA-N	0	3	342.483	3.419	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc(C)c(CC)o1)C2	ZINC001045979528	1346816975	/nfs/dbraw/zinc/81/69/75/1346816975.db2.gz	HDWRKISHKRZVNV-FQEVSTJZSA-N	0	3	328.456	3.102	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1c(F)cccc1F)C2	ZINC001045981055	1346818922	/nfs/dbraw/zinc/81/89/22/1346818922.db2.gz	BZMOSOFHFSYHLA-FQEVSTJZSA-N	0	3	346.421	3.306	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@H](C)c1ccc(C)cc1)C2	ZINC001045981169	1346819873	/nfs/dbraw/zinc/81/98/73/1346819873.db2.gz	QJUSRCUCTHPBGT-DENIHFKCSA-N	0	3	338.495	3.436	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc3ccccc3o1)C2	ZINC001045984044	1346824438	/nfs/dbraw/zinc/82/44/38/1346824438.db2.gz	VTSUENNBCDLTJW-NRFANRHFSA-N	0	3	336.435	3.384	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@H](C)Cc1ccccc1)C2	ZINC001045986646	1346828365	/nfs/dbraw/zinc/82/83/65/1346828365.db2.gz	WXHLOMITWQDTSA-KNQAVFIVSA-N	0	3	338.495	3.203	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@]2(C)CCN(C[C@@H](O)c3ccccc3)C2)CC1	ZINC001046594722	1347031491	/nfs/dbraw/zinc/03/14/91/1347031491.db2.gz	NUVRQUVNADLNQH-CTNGQTDRSA-N	0	3	342.483	3.047	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2cnn(C3CCCC3)c2C)C1	ZINC001046756974	1347087182	/nfs/dbraw/zinc/08/71/82/1347087182.db2.gz	BVDLHLWSAGTEJO-LJQANCHMSA-N	0	3	330.476	3.077	20	30		EGEDHN
C#CCCN1CC[C@@](C)(NC(=O)c2cc3c(s2)CC[C@H](C)C3)C1	ZINC001046826636	1347120934	/nfs/dbraw/zinc/12/09/34/1347120934.db2.gz	FLYALYRUNXZNCM-IFXJQAMLSA-N	0	3	330.497	3.090	20	30		EGEDHN
C#CCCN1CC[C@](C)(NC(=O)c2cc3c(s2)CC[C@H](C)C3)C1	ZINC001046826638	1347121571	/nfs/dbraw/zinc/12/15/71/1347121571.db2.gz	FLYALYRUNXZNCM-LIRRHRJNSA-N	0	3	330.497	3.090	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2ccccc2F)C1	ZINC001046908793	1347148535	/nfs/dbraw/zinc/14/85/35/1347148535.db2.gz	PTEDEFZGOGDRJW-ZDUSSCGKSA-N	0	3	326.362	3.089	20	30		EGEDHN
O=C(C=C1CCC1)N[C@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1ccccc1)C2	ZINC001047048904	1347196060	/nfs/dbraw/zinc/19/60/60/1347196060.db2.gz	BFQQRCZLNGKAEN-ACRUOGEOSA-N	0	3	334.463	3.118	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@@H]3CCC(F)(F)C3)C2)CC1	ZINC001047243966	1347269341	/nfs/dbraw/zinc/26/93/41/1347269341.db2.gz	OHHJFNNMYGAFGV-IAGOWNOFSA-N	0	3	338.442	3.006	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)C3CC4(CC4)C3)C2)CC1	ZINC001047256995	1347279999	/nfs/dbraw/zinc/27/99/99/1347279999.db2.gz	OJCDSRFRCNMGHV-SFHVURJKSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)CCc3cccs3)C2)CC1	ZINC001047264669	1347285336	/nfs/dbraw/zinc/28/53/36/1347285336.db2.gz	LKJAQJVZQYUVNL-GOSISDBHSA-N	0	3	344.524	3.265	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@@H]([C@H](C)NCc2ccccc2C#N)C1	ZINC001047723538	1347350756	/nfs/dbraw/zinc/35/07/56/1347350756.db2.gz	BHRGVIZBTRBDEF-HNAYVOBHSA-N	0	3	327.472	3.321	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)CCC2CC2)C1	ZINC001047766266	1347365064	/nfs/dbraw/zinc/36/50/64/1347365064.db2.gz	NUPUMTUGPYQIEQ-BEFAXECRSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H]([C@H](C)NCc2cnc(C)o2)C1	ZINC001047856062	1347390588	/nfs/dbraw/zinc/39/05/88/1347390588.db2.gz	QNYWNXZNGKCFLK-SMDDNHRTSA-N	0	3	339.867	3.088	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2coc3c2cccc3OC)C1	ZINC001079705977	1357351596	/nfs/dbraw/zinc/35/15/96/1357351596.db2.gz	JALAGLXBYMSGLN-CZUORRHYSA-N	0	3	328.412	3.068	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)C2(C)CCCC2)C1	ZINC001047925319	1347411559	/nfs/dbraw/zinc/41/15/59/1347411559.db2.gz	LTBBVZZIUHZKEJ-LPHOPBHVSA-N	0	3	339.483	3.465	20	30		EGEDHN
Cc1coc(C(=O)N2CC[C@H]([C@@H](C)NCc3ccccc3C#N)C2)c1	ZINC001047938584	1347417432	/nfs/dbraw/zinc/41/74/32/1347417432.db2.gz	YAQRFLYPVWVJBG-QAPCUYQASA-N	0	3	337.423	3.100	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]([C@@H](C)NCc3nc(C)c(C)s3)C2)C1	ZINC001047964701	1347426426	/nfs/dbraw/zinc/42/64/26/1347426426.db2.gz	BPQSHJJSBUUYIT-GDBMZVCRSA-N	0	3	347.528	3.443	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]([C@@H](C)NCc3cc(C4CC4)no3)C2)C1	ZINC001047965296	1347427050	/nfs/dbraw/zinc/42/70/50/1347427050.db2.gz	LVPGAUAOUHHFTB-ZBFHGGJFSA-N	0	3	343.471	3.235	20	30		EGEDHN
C[C@H](NCc1cc(F)ccc1C#N)[C@H]1CCN(C(=O)C(C)(C)C)C1	ZINC001048039135	1347447743	/nfs/dbraw/zinc/44/77/43/1347447743.db2.gz	ZPZCNQCDCKEUFE-ZFWWWQNUSA-N	0	3	331.435	3.070	20	30		EGEDHN
C[C@H]1CN(C(=O)C2CCCC2)C[C@@H]1CNCc1cc(F)ccc1C#N	ZINC001048098479	1347465495	/nfs/dbraw/zinc/46/54/95/1347465495.db2.gz	XJSULAJOULNAHM-KSSFIOAISA-N	0	3	343.446	3.072	20	30		EGEDHN
C[C@H]1CN(C(=O)C#CC2CC2)C[C@@H]1CNCc1c(F)cccc1Cl	ZINC001048246113	1347501549	/nfs/dbraw/zinc/50/15/49/1347501549.db2.gz	MDZBVHVOOXZBCR-ZFWWWQNUSA-N	0	3	348.849	3.077	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2(C)CC2)C[C@H]1CNCc1cc(F)ccc1C#N	ZINC001048318953	1347517446	/nfs/dbraw/zinc/51/74/46/1347517446.db2.gz	XKMCZQFTRRWXLI-RHSMWYFYSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H](C)[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001048345468	1347525433	/nfs/dbraw/zinc/52/54/33/1347525433.db2.gz	UEGXMBFMHWHIIJ-YOEHRIQHSA-N	0	3	343.446	3.094	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](C)[C@@H](CNCc3ccccc3C#N)C2)C1	ZINC001048372568	1347533948	/nfs/dbraw/zinc/53/39/48/1347533948.db2.gz	ABOPUPXAGIJWQD-APWZRJJASA-N	0	3	337.467	3.099	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H](C)[C@H](CNCc3nc(C)sc3C)C2)C1	ZINC001048375505	1347535763	/nfs/dbraw/zinc/53/57/63/1347535763.db2.gz	YCJXAAQKIRBCKF-XJKSGUPXSA-N	0	3	347.528	3.300	20	30		EGEDHN
C[C@H]1CN(C(=O)C(C)(C)C(F)F)C[C@@H]1CNCc1ccccc1C#N	ZINC001048382060	1347538148	/nfs/dbraw/zinc/53/81/48/1347538148.db2.gz	IPDXWKGVIKPJIT-BBRMVZONSA-N	0	3	349.425	3.034	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CN(Cc4ccccc4F)C[C@H]3C2)C1	ZINC001049044476	1347714349	/nfs/dbraw/zinc/71/43/49/1347714349.db2.gz	IESAQVNOLIGOHZ-CALCHBBNSA-N	0	3	328.431	3.072	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049293568	1347775456	/nfs/dbraw/zinc/77/54/56/1347775456.db2.gz	UNZTXUBMLFRXMX-OALUTQOASA-N	0	3	325.456	3.170	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1cc2ccccc2o1	ZINC001049380761	1347811665	/nfs/dbraw/zinc/81/16/65/1347811665.db2.gz	GZIFQLVUSKMGEE-ZTFGCOKTSA-N	0	3	337.423	3.158	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)C2CC=CC2)cc1	ZINC001049390699	1347816428	/nfs/dbraw/zinc/81/64/28/1347816428.db2.gz	BOZIEEIWFWMWGK-VQTJNVASSA-N	0	3	335.451	3.090	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)C=C2CCC2)c1	ZINC001049414655	1347836640	/nfs/dbraw/zinc/83/66/40/1347836640.db2.gz	WOWHFTLPSXBPII-WOJBJXKFSA-N	0	3	335.451	3.234	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@H]2[C@@H]1CCN2Cc1cc2ccccc2o1	ZINC001049466174	1347861750	/nfs/dbraw/zinc/86/17/50/1347861750.db2.gz	BQPFKCOTDBJLDY-PMACEKPBSA-N	0	3	348.446	3.412	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccn(C2CCCCC2)n1	ZINC001049476134	1347867742	/nfs/dbraw/zinc/86/77/42/1347867742.db2.gz	WNWIEICNPJZPBW-MOPGFXCFSA-N	0	3	342.487	3.253	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1c(F)ccc2ccncc21	ZINC001049490139	1347873973	/nfs/dbraw/zinc/87/39/73/1347873973.db2.gz	ICVOHXPGLFXKQK-QZTJIDSGSA-N	0	3	339.414	3.239	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1scc(C)c1Cl	ZINC001049495179	1347877030	/nfs/dbraw/zinc/87/70/30/1347877030.db2.gz	OGQDRMCDBNJRCT-KBPBESRZSA-N	0	3	336.888	3.412	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(C)n(C(CC)CC)n1	ZINC001049563139	1347910954	/nfs/dbraw/zinc/91/09/54/1347910954.db2.gz	CIQKDNPDCDDMMT-RBUKOAKNSA-N	0	3	344.503	3.418	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cccc(C(C)C)n1	ZINC001049572840	1347916563	/nfs/dbraw/zinc/91/65/63/1347916563.db2.gz	OYZJVSFYAGPBII-RBUKOAKNSA-N	0	3	327.472	3.460	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(-c2ccccc2)no1	ZINC001049576681	1347917756	/nfs/dbraw/zinc/91/77/56/1347917756.db2.gz	VRNLPZJDCLXLEF-MOPGFXCFSA-N	0	3	349.434	3.044	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(-n2cccc2)cc1	ZINC001049579894	1347920058	/nfs/dbraw/zinc/92/00/58/1347920058.db2.gz	PJMVVXRMMIAEIS-WOJBJXKFSA-N	0	3	335.451	3.342	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc2ncccc2o1	ZINC001049600487	1347930450	/nfs/dbraw/zinc/93/04/50/1347930450.db2.gz	AUOKKSDFHUIXGE-HOTGVXAUSA-N	0	3	325.412	3.083	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1c(C)noc1C1CC1	ZINC001049602609	1347931976	/nfs/dbraw/zinc/93/19/76/1347931976.db2.gz	NPKDDNAIZNBDNH-HZPDHXFCSA-N	0	3	329.444	3.115	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)[C@]23C[C@H]2CCC3)c1	ZINC001049605865	1347934280	/nfs/dbraw/zinc/93/42/80/1347934280.db2.gz	RUDIIHWYWHLXNW-NXLVEIQXSA-N	0	3	349.478	3.314	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1F	ZINC001049611788	1347935839	/nfs/dbraw/zinc/93/58/39/1347935839.db2.gz	KOROLUWPYLLWJC-OGWHTMIXSA-N	0	3	346.421	3.320	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1noc2c1CC(C)(C)CC2	ZINC001049614178	1347936204	/nfs/dbraw/zinc/93/62/04/1347936204.db2.gz	WDIBDYMIMFIQDC-HZPDHXFCSA-N	0	3	343.471	3.054	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(Cl)c(Cl)[nH]1	ZINC001049626820	1347941220	/nfs/dbraw/zinc/94/12/20/1347941220.db2.gz	SZXDUECYWCEWPR-QWHCGFSZSA-N	0	3	328.243	3.186	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C1(c2ccc(F)cc2)CCC1	ZINC001049629865	1347943073	/nfs/dbraw/zinc/94/30/73/1347943073.db2.gz	MSFFWDCSGYVEMV-RBUKOAKNSA-N	0	3	342.458	3.499	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc2ccc(OC)cc2[nH]1	ZINC001049632627	1347944564	/nfs/dbraw/zinc/94/45/64/1347944564.db2.gz	ZLNATUJGDURGRO-RBUKOAKNSA-N	0	3	339.439	3.041	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(F)c2ccncc12	ZINC001049661794	1347961517	/nfs/dbraw/zinc/96/15/17/1347961517.db2.gz	ZVDRBCRCJWBMCN-OALUTQOASA-N	0	3	339.414	3.239	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1c(C)cc(C)cc1C	ZINC001049691864	1347974387	/nfs/dbraw/zinc/97/43/87/1347974387.db2.gz	CDKSQXHJOQVURY-SFTDATJTSA-N	0	3	338.495	3.243	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](C)OC1CCCCCC1	ZINC001049710102	1347985553	/nfs/dbraw/zinc/98/55/53/1347985553.db2.gz	UISFGCPVFFEAKW-QXAKKESOSA-N	0	3	334.504	3.366	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)C1(c2cccc(F)c2)CC1	ZINC001049762522	1348007977	/nfs/dbraw/zinc/00/79/77/1348007977.db2.gz	PSQIIOWBORUAGL-ROUUACIJSA-N	0	3	328.431	3.109	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1oc(C2CC2)nc1C	ZINC001049773987	1348014925	/nfs/dbraw/zinc/01/49/25/1348014925.db2.gz	ULCCHRGQHZYXNL-CVEARBPZSA-N	0	3	329.444	3.115	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1ccccc1OC(C)C	ZINC001049783083	1348020227	/nfs/dbraw/zinc/02/02/27/1348020227.db2.gz	NWYABICUFAYWGF-MOPGFXCFSA-N	0	3	342.483	3.268	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1csc(-c2ccoc2)n1	ZINC001049792704	1348024471	/nfs/dbraw/zinc/02/44/71/1348024471.db2.gz	JNDABXIVFMOTHZ-HOTGVXAUSA-N	0	3	343.452	3.268	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1csc(Cl)n1	ZINC001049823442	1348039952	/nfs/dbraw/zinc/03/99/52/1348039952.db2.gz	BMDJVSVCFZYWKB-OLZOCXBDSA-N	0	3	325.865	3.052	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cnn(CCC)c1C1CC1	ZINC001049834355	1348048032	/nfs/dbraw/zinc/04/80/32/1348048032.db2.gz	AMRIWTVXTVDSEI-QZTJIDSGSA-N	0	3	342.487	3.035	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ncoc1C(C)(C)C	ZINC001049835250	1348048722	/nfs/dbraw/zinc/04/87/22/1348048722.db2.gz	PJPPFUORGSAUKE-HUUCEWRRSA-N	0	3	331.460	3.227	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H]1CCCc2sc(C)nc21	ZINC001049844546	1348054428	/nfs/dbraw/zinc/05/44/28/1348054428.db2.gz	QVLKFSVZFOIJGH-OWCLPIDISA-N	0	3	345.512	3.123	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(C)n(CC2CC2)c1C	ZINC001049848237	1348057204	/nfs/dbraw/zinc/05/72/04/1348057204.db2.gz	KJWPDHFLBUXOBN-PMACEKPBSA-N	0	3	341.499	3.380	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(C)nc2ccccc21	ZINC001049869498	1348075185	/nfs/dbraw/zinc/07/51/85/1348075185.db2.gz	CENQPSDHRUETME-SFTDATJTSA-N	0	3	347.462	3.245	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1sccc1C(F)F	ZINC001049875303	1348080854	/nfs/dbraw/zinc/08/08/54/1348080854.db2.gz	IQHZWIQBZVRSLO-KGLIPLIRSA-N	0	3	338.423	3.388	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(C)c(F)c(C)c1	ZINC001049901729	1348101759	/nfs/dbraw/zinc/10/17/59/1348101759.db2.gz	AUIFOJJNRDZHTK-QZTJIDSGSA-N	0	3	328.431	3.145	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](C)c1ccc(F)cc1F	ZINC001049903187	1348102589	/nfs/dbraw/zinc/10/25/89/1348102589.db2.gz	GGKWUGLUDNHZDS-DOPJRALCSA-N	0	3	334.410	3.320	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](CC)c1ccc(OC)cc1	ZINC001049907251	1348104903	/nfs/dbraw/zinc/10/49/03/1348104903.db2.gz	CBTRNFKRBZYVAT-SLFFLAALSA-N	0	3	342.483	3.440	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(OC2CCC2)cc1	ZINC001049909697	1348106634	/nfs/dbraw/zinc/10/66/34/1348106634.db2.gz	RWJAOZBVSIWKMI-PMACEKPBSA-N	0	3	340.467	3.483	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](CC)c1ccc(F)cc1	ZINC001049917662	1348111816	/nfs/dbraw/zinc/11/18/16/1348111816.db2.gz	NPCJWDILNHFHGY-XUVXKRRUSA-N	0	3	342.458	3.408	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(OC(C)C)cn1	ZINC001049938698	1348123829	/nfs/dbraw/zinc/12/38/29/1348123829.db2.gz	ADJQWYAIGHXPSK-RBUKOAKNSA-N	0	3	343.471	3.124	20	30		EGEDHN
C[C@@H](c1cccc(F)c1)N1C[C@@H]2CCCN(C(=O)C#CC3CC3)[C@@H]2C1	ZINC001050046333	1348164712	/nfs/dbraw/zinc/16/47/12/1348164712.db2.gz	WXQZDDAFBUOQFB-ZAAXVRCTSA-N	0	3	340.442	3.223	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)C[C@@H]3C[C@H]3c3ccccc3)[C@@H]2C1	ZINC001050048189	1348165491	/nfs/dbraw/zinc/16/54/91/1348165491.db2.gz	JIDMTJZHDLWKFC-XSDIEEQYSA-N	0	3	336.479	3.126	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3cc([C@H](C)CC)no3)[C@@H]2C1	ZINC001050160130	1348199888	/nfs/dbraw/zinc/19/98/88/1348199888.db2.gz	RHMGJFAUBGECIK-HLLBOEOZSA-N	0	3	331.460	3.301	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)[C@H](CC)Oc3cccc(C)c3)[C@@H]2C1	ZINC001050164065	1348201627	/nfs/dbraw/zinc/20/16/27/1348201627.db2.gz	ZPIFBUHNMBUWSD-SXLOBPIMSA-N	0	3	342.483	3.261	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3occ4c3CCCC4)[C@@H]2C1	ZINC001050191901	1348207005	/nfs/dbraw/zinc/20/70/05/1348207005.db2.gz	OGBCUCYXWFVCSS-MAUKXSAKSA-N	0	3	328.456	3.271	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CC[C@H](CNCc3coc(C)n3)CC2)CC1	ZINC001050361957	1348238344	/nfs/dbraw/zinc/23/83/44/1348238344.db2.gz	APZUTERIAZETFB-SAABIXHNSA-N	0	3	345.487	3.494	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC[C@H](CNCc3cscn3)CC2)C1	ZINC001050362772	1348238696	/nfs/dbraw/zinc/23/86/96/1348238696.db2.gz	IUQAJODZCQFDKD-SHTZXODSSA-N	0	3	333.501	3.264	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC2(C1)CCN([C@@H](C)c1ccc(Cl)cc1)CC2	ZINC001050458993	1348270866	/nfs/dbraw/zinc/27/08/66/1348270866.db2.gz	GQFHKYXOGRRSIQ-CABCVRRESA-N	0	3	345.874	3.485	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3c(C)[nH]c4ccccc43)C2)CC1	ZINC001050585507	1348294110	/nfs/dbraw/zinc/29/41/10/1348294110.db2.gz	LJCQZEAWDPYVQB-UHFFFAOYSA-N	0	3	335.451	3.038	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)CCc3ccc4[nH]ccc4c3)C2)CC1	ZINC001050591807	1348295633	/nfs/dbraw/zinc/29/56/33/1348295633.db2.gz	DMCNDAYWHIGBEL-UHFFFAOYSA-N	0	3	349.478	3.048	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc(C)nc3C(C)C)C2)CC1	ZINC001050608334	1348299669	/nfs/dbraw/zinc/29/96/69/1348299669.db2.gz	SNYAJUZIURTIKD-UHFFFAOYSA-N	0	3	339.483	3.075	20	30		EGEDHN
CC1(C(=O)N2CC3(C2)CCN(Cc2cccc(C#N)c2)CC3)CCC1	ZINC001050620401	1348304824	/nfs/dbraw/zinc/30/48/24/1348304824.db2.gz	BJBBQFNFRVAAKB-UHFFFAOYSA-N	0	3	337.467	3.173	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C(C)(C)c3cccc(F)c3)C2)CC1	ZINC001050664155	1348321309	/nfs/dbraw/zinc/32/13/09/1348321309.db2.gz	YPLCJGKHSZFSHA-UHFFFAOYSA-N	0	3	342.458	3.051	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H](c3ccccc3)C(C)C)C2)CC1	ZINC001050678336	1348323884	/nfs/dbraw/zinc/32/38/84/1348323884.db2.gz	LWRCLUBBVGHVQI-HXUWFJFHSA-N	0	3	338.495	3.374	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)[C@H]4CC45CCC5)C3)CC2)c1	ZINC001050682661	1348325411	/nfs/dbraw/zinc/32/54/11/1348325411.db2.gz	JYUSLQCAZKFZFJ-LJQANCHMSA-N	0	3	349.478	3.173	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001050685079	1348326501	/nfs/dbraw/zinc/32/65/01/1348326501.db2.gz	WYJDUVBNOBTTDU-KRWDZBQOSA-N	0	3	339.483	3.275	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc4sccc4c3)C2)CC1	ZINC001050716445	1348335001	/nfs/dbraw/zinc/33/50/01/1348335001.db2.gz	GJZPSCJRPKOHIU-UHFFFAOYSA-N	0	3	338.476	3.463	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H](C)Cc3ccc(C)cc3)C2)CC1	ZINC001050767444	1348353045	/nfs/dbraw/zinc/35/30/45/1348353045.db2.gz	DJWYXRITHKPYSF-LJQANCHMSA-N	0	3	338.495	3.121	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3cccc(C)n3)cccc2C1	ZINC001051279032	1348415861	/nfs/dbraw/zinc/41/58/61/1348415861.db2.gz	PIHXKYRVXPLCIR-UHFFFAOYSA-N	0	3	335.451	3.254	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)[C@H]3CC34CCCC4)cccc2C1	ZINC001051306027	1348427860	/nfs/dbraw/zinc/42/78/60/1348427860.db2.gz	ISHATVNLAPYOLU-HXUWFJFHSA-N	0	3	336.479	3.265	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3ccccc3OC)cccc2C1	ZINC001051306538	1348427927	/nfs/dbraw/zinc/42/79/27/1348427927.db2.gz	DBAZGQSVDOFEQE-UHFFFAOYSA-N	0	3	348.446	3.007	20	30		EGEDHN
C=C(C)CCN1CCN([C@@H]2CCN(C(=O)C=C3CCCCC3)C2)CC1	ZINC001051992355	1348494999	/nfs/dbraw/zinc/49/49/99/1348494999.db2.gz	WYIUJLZXYIUUCA-HXUWFJFHSA-N	0	3	345.531	3.062	20	30		EGEDHN
CC1CC(C(=O)N[C@@H]2CCCN(Cc3ccc(C#N)cc3)CC2)C1	ZINC001052295149	1348517600	/nfs/dbraw/zinc/51/76/00/1348517600.db2.gz	FASFSYNSHJEQSK-XUJQIHCRSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@H](C)c2ccc(Cl)cc2)CC1	ZINC001052676487	1348625388	/nfs/dbraw/zinc/62/53/88/1348625388.db2.gz	HESCQXVWULABFW-QAPCUYQASA-N	0	3	332.875	3.438	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N[C@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC001052726331	1348648637	/nfs/dbraw/zinc/64/86/37/1348648637.db2.gz	JXKBPSNCNABHNF-CEXWTWQISA-N	0	3	325.456	3.075	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H](NC(=O)[C@@H]3CC34CCC4)CC2)cc1	ZINC001052753801	1348663607	/nfs/dbraw/zinc/66/36/07/1348663607.db2.gz	IMWSXPGUNITWAY-MOPGFXCFSA-N	0	3	337.467	3.219	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cnc(-c3ccoc3)s2)CC1	ZINC001052774333	1348674177	/nfs/dbraw/zinc/67/41/77/1348674177.db2.gz	YATRYHICMZGDRE-OAHLLOKOSA-N	0	3	343.452	3.011	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)Cc2cccc3ccccc32)CC1	ZINC001052890257	1348726349	/nfs/dbraw/zinc/72/63/49/1348726349.db2.gz	XUKDHSHBTJVKMK-HXUWFJFHSA-N	0	3	334.463	3.376	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2cc3c(cccc3F)s2)CC1	ZINC001052921813	1348749120	/nfs/dbraw/zinc/74/91/20/1348749120.db2.gz	KQUOZWWIPRDVTI-ZDUSSCGKSA-N	0	3	330.428	3.258	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)CC2C3CC4CC(C3)CC2C4)CC1	ZINC001052947036	1348762872	/nfs/dbraw/zinc/76/28/72/1348762872.db2.gz	HCJIIDUDPJNVKL-RDOIFFKNSA-N	0	3	328.500	3.053	20	30		EGEDHN
C=CC[N@H+]1CCC[C@H]([C@@H]2CCCN(C(=O)c3ccccc3[O-])C2)C1	ZINC001053008635	1348807586	/nfs/dbraw/zinc/80/75/86/1348807586.db2.gz	SMXLENYYHZWVKJ-DLBZAZTESA-N	0	3	328.456	3.142	20	30		EGEDHN
C=CC[N@@H+]1CCC[C@H]([C@@H]2CCCN(C(=O)c3ccccc3[O-])C2)C1	ZINC001053008635	1348807588	/nfs/dbraw/zinc/80/75/88/1348807588.db2.gz	SMXLENYYHZWVKJ-DLBZAZTESA-N	0	3	328.456	3.142	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)Cc2ccsc2)C1	ZINC001053063072	1348873896	/nfs/dbraw/zinc/87/38/96/1348873896.db2.gz	GZPFFWCXTPEOTH-ROUUACIJSA-N	0	3	330.497	3.017	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cncc(C)c2)C1	ZINC001053078184	1348896883	/nfs/dbraw/zinc/89/68/83/1348896883.db2.gz	OPIDKLDLAQEPFB-AZUAARDMSA-N	0	3	339.483	3.120	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cc(C)c(C)o2)C1	ZINC001053079687	1348900150	/nfs/dbraw/zinc/90/01/50/1348900150.db2.gz	KSBDKGFTIWIPPX-ZWKOTPCHSA-N	0	3	328.456	3.236	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccncc2C)C1	ZINC001053081737	1348903174	/nfs/dbraw/zinc/90/31/74/1348903174.db2.gz	XRNQZXZCTFFTBG-UYAOXDASSA-N	0	3	339.483	3.120	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cc(C)c(C)cn2)C1	ZINC001053092294	1348918868	/nfs/dbraw/zinc/91/88/68/1348918868.db2.gz	QSLFXZOADOTGCB-UYAOXDASSA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ncccc2Cl)C1	ZINC001053103950	1348938318	/nfs/dbraw/zinc/93/83/18/1348938318.db2.gz	MARMGOHBEIXESN-RDJZCZTQSA-N	0	3	345.874	3.075	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cc(Cl)no2)C1	ZINC001053104339	1348939102	/nfs/dbraw/zinc/93/91/02/1348939102.db2.gz	OFRRTMUXZYEXFR-GJZGRUSLSA-N	0	3	349.862	3.058	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(F)cc2C)C1	ZINC001053105302	1348941819	/nfs/dbraw/zinc/94/18/19/1348941819.db2.gz	TYGMIXMTDSDTRL-YLJYHZDGSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)C2(F)CCCCC2)C1	ZINC001053105539	1348942980	/nfs/dbraw/zinc/94/29/80/1348942980.db2.gz	UORJVOUEPWOTRI-ZWKOTPCHSA-N	0	3	334.479	3.385	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc(Cl)ccc1F)C2	ZINC001054161481	1349163403	/nfs/dbraw/zinc/16/34/03/1349163403.db2.gz	GWVSFGUXWSJFEI-GOSISDBHSA-N	0	3	334.822	3.040	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(Cl)cc1F)C2	ZINC001054162041	1349164056	/nfs/dbraw/zinc/16/40/56/1349164056.db2.gz	VWENYRXXNPKPGL-GOSISDBHSA-N	0	3	334.822	3.040	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(-c3ccco3)o1)C2	ZINC001054161781	1349164083	/nfs/dbraw/zinc/16/40/83/1349164083.db2.gz	OJYZENHSWGSOFN-FQEVSTJZSA-N	0	3	338.407	3.101	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N1CCC[C@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001054179939	1349182665	/nfs/dbraw/zinc/18/26/65/1349182665.db2.gz	KUHZOSADVMSAMU-NBHGPNQESA-N	0	3	337.467	3.029	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccn(C(C)C)c1C)C2	ZINC001054181845	1349184327	/nfs/dbraw/zinc/18/43/27/1349184327.db2.gz	AAVYXLZXDXFSIP-OAQYLSRUSA-N	0	3	341.499	3.329	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)C1(C(F)F)CCCC1)C2	ZINC001054183174	1349185592	/nfs/dbraw/zinc/18/55/92/1349185592.db2.gz	AXPANBYDVWCFBK-SFHVURJKSA-N	0	3	338.442	3.150	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@]3(CCN(Cc4ocnc4C)C3)C2)C1	ZINC001054194556	1349197161	/nfs/dbraw/zinc/19/71/61/1349197161.db2.gz	SJMPQNAPKFYUTA-HXUWFJFHSA-N	0	3	343.471	3.154	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc3cccnc3c1)C2	ZINC001054215705	1349214949	/nfs/dbraw/zinc/21/49/49/1349214949.db2.gz	CARQOFNQHBIMEY-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccoc1CCC)C2	ZINC001054226907	1349221087	/nfs/dbraw/zinc/22/10/87/1349221087.db2.gz	GEKZLDORQSNBAL-FQEVSTJZSA-N	0	3	328.456	3.184	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1cccc3ccccc31)C2	ZINC001054235912	1349228552	/nfs/dbraw/zinc/22/85/52/1349228552.db2.gz	DLHUXLWIJBAZHB-QFIPXVFZSA-N	0	3	332.447	3.401	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)CCc1c[nH]c3ccccc13)C2	ZINC001054237386	1349230976	/nfs/dbraw/zinc/23/09/76/1349230976.db2.gz	VOZKHAGAIJJVDW-QFIPXVFZSA-N	0	3	349.478	3.048	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@H](C)c1ccc(F)cc1F)C2	ZINC001054241970	1349235333	/nfs/dbraw/zinc/23/53/33/1349235333.db2.gz	CDTHRVRMKOELOH-FOIQADDNSA-N	0	3	346.421	3.016	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(F)c3occc31)C2	ZINC001054241995	1349235410	/nfs/dbraw/zinc/23/54/10/1349235410.db2.gz	CNVSFCQTDLTLHP-HXUWFJFHSA-N	0	3	340.398	3.133	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(CC)c(CC)c1)C2	ZINC001054250450	1349246390	/nfs/dbraw/zinc/24/63/90/1349246390.db2.gz	UIAOKZQADYXNMR-QFIPXVFZSA-N	0	3	338.495	3.373	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cncc(F)c3)cc2C1	ZINC001054260594	1349256887	/nfs/dbraw/zinc/25/68/87/1349256887.db2.gz	TXZIWUVVYYOOBJ-UHFFFAOYSA-N	0	3	325.387	3.042	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3c[nH]c(C#N)c3)cc2C1	ZINC001054261130	1349257930	/nfs/dbraw/zinc/25/79/30/1349257930.db2.gz	RJHAHENVSPKPNR-UHFFFAOYSA-N	0	3	334.423	3.098	20	30		EGEDHN
CC1CC(CN2Cc3ccc(CNC(=O)c4ccc(C#N)[nH]4)cc3C2)C1	ZINC001054261862	1349259229	/nfs/dbraw/zinc/25/92/29/1349259229.db2.gz	YMUPCCQSIPHTJW-UHFFFAOYSA-N	0	3	348.450	3.178	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@@H]3CC[C@H](CC)O3)cc2C1	ZINC001054267493	1349264968	/nfs/dbraw/zinc/26/49/68/1349264968.db2.gz	XMRBZKUGEAYQJO-OALUTQOASA-N	0	3	328.456	3.152	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3ccncc3CC)cc2C1	ZINC001054271906	1349270849	/nfs/dbraw/zinc/27/08/49/1349270849.db2.gz	WYAJKUPOUKVYHV-UHFFFAOYSA-N	0	3	335.451	3.466	20	30		EGEDHN
Cc1cccc(C(=O)N2C[C@@H](C)[C@H](NCc3ccc(C#N)s3)C2)c1	ZINC001054354403	1349331876	/nfs/dbraw/zinc/33/18/76/1349331876.db2.gz	AFGDDCMNPWNGSA-RDTXWAMCSA-N	0	3	339.464	3.179	20	30		EGEDHN
C[C@H]1CN(C(=O)CC2=CCCCC2)C[C@H]1NCc1ccc(C#N)s1	ZINC001054476982	1349369855	/nfs/dbraw/zinc/36/98/55/1349369855.db2.gz	AUTDWKUJYYOEFW-KBXCAEBGSA-N	0	3	343.496	3.447	20	30		EGEDHN
C[C@@H]1CN(C(=O)C(C)(C)C2CCC2)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054936539	1349519892	/nfs/dbraw/zinc/51/98/92/1349519892.db2.gz	MAGFCMJUOLYLBS-DYVFJYSZSA-N	0	3	345.512	3.383	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@@H](NCc2cccc(Cl)n2)C1	ZINC001054970807	1349531234	/nfs/dbraw/zinc/53/12/34/1349531234.db2.gz	ITNYGPPTEOUGOG-HIFRSBDPSA-N	0	3	335.879	3.274	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](NCc2cn(C(C)C)nc2C)[C@@H](C)C1	ZINC001054971377	1349532100	/nfs/dbraw/zinc/53/21/00/1349532100.db2.gz	POXKRBWOXUWGQN-YJBOKZPZSA-N	0	3	346.519	3.311	20	30		EGEDHN
CCC(C)(C)C(=O)N1C[C@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001055026290	1349555900	/nfs/dbraw/zinc/55/59/00/1349555900.db2.gz	MMUZUDZNIZQILS-SUMWQHHRSA-N	0	3	331.435	3.070	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](NC(=O)CCC2CCC2)C2CC2)s1	ZINC001322976541	1387259111	/nfs/dbraw/zinc/25/91/11/1387259111.db2.gz	RGIWKHPGDGOYAG-QGZVFWFLSA-N	0	3	331.485	3.184	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C=C1CCCCC1)C[C@H](C)O2	ZINC001071144418	1354475379	/nfs/dbraw/zinc/47/53/79/1354475379.db2.gz	NCNXNMAFWSFXRX-PXNSSMCTSA-N	0	3	332.488	3.145	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C(C)=C1CCCC1)C[C@H](C)O2	ZINC001071155216	1354480094	/nfs/dbraw/zinc/48/00/94/1354480094.db2.gz	XNWIVSDHLMUNJF-JXFKEZNVSA-N	0	3	332.488	3.145	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1cc(C)c(CC)o1)C[C@@H](C)O2	ZINC001071227713	1354514808	/nfs/dbraw/zinc/51/48/08/1354514808.db2.gz	IWGPDIOTAYWMQM-UZLBHIALSA-N	0	3	346.471	3.032	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1sccc1CC)C[C@H](C)O2	ZINC001071244496	1354524268	/nfs/dbraw/zinc/52/42/68/1354524268.db2.gz	WGRNAWCHKSNQRZ-HNAYVOBHSA-N	0	3	348.512	3.192	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cccc(C(F)F)c2F)CC[C@H]1C	ZINC001071513642	1354737181	/nfs/dbraw/zinc/73/71/81/1354737181.db2.gz	GYOMJMAQVWJIKF-OLZOCXBDSA-N	0	3	338.373	3.369	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2c(F)c(F)cc(F)c2F)CC[C@@H]1C	ZINC001071526854	1354747070	/nfs/dbraw/zinc/74/70/70/1354747070.db2.gz	VGPHPBXGHVAWEQ-WDEREUQCSA-N	0	3	344.352	3.402	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C2(c3ccc(F)cc3)CC2)CC[C@H]1C	ZINC001071543983	1354756843	/nfs/dbraw/zinc/75/68/43/1354756843.db2.gz	QXVGTMXGUBCCDO-CRAIPNDOSA-N	0	3	330.447	3.403	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCCC[C@H](N[C@H](C)c2n[nH]c(CC)n2)C1	ZINC001088359541	1359843297	/nfs/dbraw/zinc/84/32/97/1359843297.db2.gz	AWGLXQNATDFVHQ-CABCVRRESA-N	0	3	347.507	3.001	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2conc2C2CCCC2)CC[C@@H]1C	ZINC001071561704	1354765411	/nfs/dbraw/zinc/76/54/11/1354765411.db2.gz	TXISZMHQFLIUIL-GOEBONIOSA-N	0	3	331.460	3.491	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cccc3ccc(C)nc32)CC[C@@H]1C	ZINC001071599989	1354787870	/nfs/dbraw/zinc/78/78/70/1354787870.db2.gz	CPRRVURZGZTIMP-FUHWJXTLSA-N	0	3	335.451	3.149	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccncc2OC(C)C)CC[C@H]1C	ZINC001071701865	1354862013	/nfs/dbraw/zinc/86/20/13/1354862013.db2.gz	PLUUSCJIEYVNGY-HZPDHXFCSA-N	0	3	331.460	3.028	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2cc3ncccc3s2)CC[C@@H]1C	ZINC001071734747	1354887504	/nfs/dbraw/zinc/88/75/04/1354887504.db2.gz	AADCBINNUGDVBI-KBPBESRZSA-N	0	3	329.469	3.455	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)Cc2c(C)[nH]c3ccccc32)CC[C@H]1C	ZINC001071783450	1354931584	/nfs/dbraw/zinc/93/15/84/1354931584.db2.gz	OSYWIWPBSJHVIR-ZBFHGGJFSA-N	0	3	325.456	3.174	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccn(C(C)C)c2C)CC(C)(C)C1	ZINC001089470063	1360453214	/nfs/dbraw/zinc/45/32/14/1360453214.db2.gz	JRIHLANAKDOEOX-QGZVFWFLSA-N	0	3	329.488	3.231	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cn2cc(C)c3ccccc32)CC[C@H]1C	ZINC001071883356	1355005244	/nfs/dbraw/zinc/00/52/44/1355005244.db2.gz	JYWOHCQKAMHGQZ-QZTJIDSGSA-N	0	3	339.483	3.495	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cccc3c2ccn3C)CC[C@@H]1C	ZINC001071900586	1355014192	/nfs/dbraw/zinc/01/41/92/1355014192.db2.gz	KKQFEYOQGDXHCD-JKSUJKDBSA-N	0	3	325.456	3.337	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C2(c3ccccc3F)CC2)CC[C@@H]1C	ZINC001071957818	1355043429	/nfs/dbraw/zinc/04/34/29/1355043429.db2.gz	NZWSOPJTVSXNTQ-JKSUJKDBSA-N	0	3	330.447	3.403	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc(-n3cccc3)ccn2)CC[C@@H]1C	ZINC001071966543	1355048781	/nfs/dbraw/zinc/04/87/81/1355048781.db2.gz	FWUZMWRKABAABQ-DLBZAZTESA-N	0	3	338.455	3.031	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)[C@@]2(c3ccccc3)C[C@H](F)C2)CC[C@H]1C	ZINC001072030627	1355091394	/nfs/dbraw/zinc/09/13/94/1355091394.db2.gz	SHXKEZRPJMVMIU-RDPOXOKHSA-N	0	3	342.458	3.049	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2ccc3c(c2)CCC3)CC[C@@H]1C	ZINC001072070647	1355111562	/nfs/dbraw/zinc/11/15/62/1355111562.db2.gz	RJTPWAXWQLWCPO-JXFKEZNVSA-N	0	3	326.484	3.263	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(N(C)C)c(F)c2)CC[C@H]1C	ZINC001072103018	1355131170	/nfs/dbraw/zinc/13/11/70/1355131170.db2.gz	SLWJREPXSIRXRU-ZBFHGGJFSA-N	0	3	333.451	3.051	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(N(C)C)c(F)c2)CC[C@@H]1C	ZINC001072103016	1355131607	/nfs/dbraw/zinc/13/16/07/1355131607.db2.gz	SLWJREPXSIRXRU-GOEBONIOSA-N	0	3	333.451	3.051	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)Cc2cccc(OC(C)C)c2)CC[C@@H]1C	ZINC001072102660	1355131650	/nfs/dbraw/zinc/13/16/50/1355131650.db2.gz	QHKWNOMSRSVRBW-FUHWJXTLSA-N	0	3	330.472	3.171	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2[nH]c3ccccc3c2OC)CC[C@@H]1C	ZINC001072104948	1355133035	/nfs/dbraw/zinc/13/30/35/1355133035.db2.gz	FIYSLUIWUVVTOP-LSDHHAIUSA-N	0	3	341.455	3.335	20	30		EGEDHN
C[C@H]1CCN(C(=O)c2ccco2)C[C@@H]1CNCc1ccccc1C#N	ZINC001072167376	1355163107	/nfs/dbraw/zinc/16/31/07/1355163107.db2.gz	PPFCAUPWFVAMNF-YJBOKZPZSA-N	0	3	337.423	3.039	20	30		EGEDHN
C[C@@H]1CCN(C(=O)CC2(C)CC2)C[C@@H]1CNCc1ccccc1C#N	ZINC001072322901	1355236781	/nfs/dbraw/zinc/23/67/81/1355236781.db2.gz	QAHLHUDOBLLTHJ-APWZRJJASA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](C)[C@H](CNCc2cscn2)C1	ZINC001072334523	1355243840	/nfs/dbraw/zinc/24/38/40/1355243840.db2.gz	CPIFVNRXSFISKT-HUUCEWRRSA-N	0	3	335.517	3.320	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](C)[C@@H](CNCc2cnc(C)o2)C1	ZINC001072334512	1355243919	/nfs/dbraw/zinc/24/39/19/1355243919.db2.gz	CIPBDPRVJNDLMH-ZBFHGGJFSA-N	0	3	333.476	3.160	20	30		EGEDHN
C[C@@H]1CCN(C(=O)C2(C)CCC2)C[C@H]1CNCc1ccccc1C#N	ZINC001072338585	1355246253	/nfs/dbraw/zinc/24/62/53/1355246253.db2.gz	DMOGIULRVRZLTO-VQIMIIECSA-N	0	3	339.483	3.323	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H](CC)C3CCC(C)CC3)C2)C1	ZINC001072805771	1355446242	/nfs/dbraw/zinc/44/62/42/1355446242.db2.gz	MXTLMQAMODGTSM-ACBHZAAOSA-N	0	3	330.516	3.397	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1cccc(OC)c1)C2	ZINC001072944501	1355512574	/nfs/dbraw/zinc/51/25/74/1355512574.db2.gz	DRPPYCRJWPEVAB-FQEVSTJZSA-N	0	3	342.483	3.332	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H](C)Cc3ccccc3Cl)C2)C1	ZINC001073021643	1355552988	/nfs/dbraw/zinc/55/29/88/1355552988.db2.gz	JSKDOAZXKFJNMT-INIZCTEOSA-N	0	3	344.886	3.076	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@@H](N[C@@H](C)c3ccc(F)c(F)c3)C2)CCC1	ZINC001183200258	1387277453	/nfs/dbraw/zinc/27/74/53/1387277453.db2.gz	MKWIGXJLSRWQRY-GOEBONIOSA-N	0	3	346.421	3.410	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H](C)c3cccc(Cl)c3)C2)C1	ZINC001073447590	1355783498	/nfs/dbraw/zinc/78/34/98/1355783498.db2.gz	ZDJZGKFKCVNPJP-OAHLLOKOSA-N	0	3	330.859	3.001	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2ccc(CC)c(CC)c2)C1	ZINC001073911631	1355951194	/nfs/dbraw/zinc/95/11/94/1355951194.db2.gz	WXBIYTCVOUQLLG-HXUWFJFHSA-N	0	3	344.499	3.208	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCCN1C(=O)c1ccccn1	ZINC001073925494	1355958749	/nfs/dbraw/zinc/95/87/49/1355958749.db2.gz	DSGUOEBTAGJMEW-LJQANCHMSA-N	0	3	348.450	3.080	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCO[C@@H]1C1CCN(C(=O)/C(C)=C\C)CC1	ZINC001075408979	1356359995	/nfs/dbraw/zinc/35/99/95/1356359995.db2.gz	PPYOFFNBADZYST-YEIGZOCQSA-N	0	3	340.895	3.081	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](C)c1ccc(Cl)cc1)C2	ZINC001097773920	1363118117	/nfs/dbraw/zinc/11/81/17/1363118117.db2.gz	HMPJXLJCVWWDRK-LIRZEXBASA-N	0	3	330.859	3.188	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cn1cc(C)c3ccccc31)C2	ZINC001098022758	1363199849	/nfs/dbraw/zinc/19/98/49/1363199849.db2.gz	GDMPXBWXGBMVCU-POAQFYNOSA-N	0	3	337.467	3.247	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CC[C@H]3CN(Cc4cccc(C)c4)C[C@H]32)cc1	ZINC001076117858	1356495415	/nfs/dbraw/zinc/49/54/15/1356495415.db2.gz	WOQFJIKVZWAXJB-FCHUYYIVSA-N	0	3	344.458	3.323	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3cc(C)c(C)cc3Cl)[C@@H]2C1	ZINC001076128424	1356497063	/nfs/dbraw/zinc/49/70/63/1356497063.db2.gz	XMFUIRJOLCVZTK-MAUKXSAKSA-N	0	3	330.859	3.126	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccc4nc(C)sc4c3)[C@@H]2C1	ZINC001076427255	1356575563	/nfs/dbraw/zinc/57/55/63/1356575563.db2.gz	NPOQFRNEUWRFAO-DOTOQJQBSA-N	0	3	341.480	3.327	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@H](CC)Oc3ccccc3F)[C@@H]2C1	ZINC001076461237	1356583623	/nfs/dbraw/zinc/58/36/23/1356583623.db2.gz	XJZJVFAEEYOVTK-JQHSSLGASA-N	0	3	346.446	3.092	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccc(F)c4occc43)[C@@H]2C1	ZINC001076590427	1356626027	/nfs/dbraw/zinc/62/60/27/1356626027.db2.gz	KJAZDZWEJODZDR-SUMWQHHRSA-N	0	3	328.387	3.294	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)C3CC(c4cccc(F)c4)C3)[C@@H]2C1	ZINC001076637256	1356639533	/nfs/dbraw/zinc/63/95/33/1356639533.db2.gz	QPICALWDRRHHAF-USWSCHJFSA-N	0	3	342.458	3.428	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)CC(C)(C)C=C	ZINC001099094238	1363618990	/nfs/dbraw/zinc/61/89/90/1363618990.db2.gz	XXBQUDRBTBUOLN-QGZVFWFLSA-N	0	3	336.520	3.398	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2C[C@H](NCc3c(C)noc3C)C23CCC3)C1	ZINC001078720446	1357064912	/nfs/dbraw/zinc/06/49/12/1357064912.db2.gz	LCQDEPCEDKTABR-DLBZAZTESA-N	0	3	343.471	3.165	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2c[nH]c3c2cccc3CC)C1	ZINC001080999671	1357777346	/nfs/dbraw/zinc/77/73/46/1357777346.db2.gz	BWFDBGPXNHNJQY-RDTXWAMCSA-N	0	3	325.456	3.357	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H](C)c2cccc(C)c2)C[C@H]1c1ccccc1	ZINC001081189219	1357848209	/nfs/dbraw/zinc/84/82/09/1357848209.db2.gz	PCDCWJHBQHUKRZ-YUXAGFNASA-N	0	3	346.474	3.316	20	30		EGEDHN
CC(C)[C@H](C(=O)Nc1ccc(N2CCCCC2)c(C#N)c1)N(C)C	ZINC001183362271	1387303354	/nfs/dbraw/zinc/30/33/54/1387303354.db2.gz	GZOWYARJYYSCAL-GOSISDBHSA-N	0	3	328.460	3.073	20	30		EGEDHN
C[C@@H](C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1)C(C)(C)C	ZINC001082594811	1358065605	/nfs/dbraw/zinc/06/56/05/1358065605.db2.gz	LRUZICITTMUXJG-QWQRMKEZSA-N	0	3	345.462	3.316	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H](C)[C@H](NCc2cn(C(C)C)nc2C)C1	ZINC001082722890	1358080849	/nfs/dbraw/zinc/08/08/49/1358080849.db2.gz	MKNWVTWKVJMSQM-ZTNFWEORSA-N	0	3	346.519	3.311	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)Cc3coc4ccc(C)cc34)[C@@H]2C1	ZINC001084380310	1358204725	/nfs/dbraw/zinc/20/47/25/1358204725.db2.gz	ODPMUBZZXYAGLY-VQIMIIECSA-N	0	3	338.451	3.393	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3cc(C)c4ccccc4n3)[C@@H]2C1	ZINC001084458357	1358219227	/nfs/dbraw/zinc/21/92/27/1358219227.db2.gz	SXXSIVQMJFWSGS-OXQOHEQNSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)Cc3cccc(C(F)F)c3)[C@@H]2C1	ZINC001084514331	1358229279	/nfs/dbraw/zinc/22/92/79/1358229279.db2.gz	NBFRQYTXIRQIJB-IAGOWNOFSA-N	0	3	334.410	3.276	20	30		EGEDHN
C#Cc1ccc(C(=O)N2C[C@H]3CCN(Cc4cccc(C)c4)C[C@H]32)cc1	ZINC001084567718	1358239642	/nfs/dbraw/zinc/23/96/42/1358239642.db2.gz	GEMHHXPPECONOJ-FGZHOGPDSA-N	0	3	344.458	3.323	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@H](CC)Cc3ccccc3)[C@@H]2C1	ZINC001084695229	1358282516	/nfs/dbraw/zinc/28/25/16/1358282516.db2.gz	KVLMGHLYSDADLY-VAMGGRTRSA-N	0	3	326.484	3.364	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)C[C@H]3CCCc4ccccc43)[C@@H]2C1	ZINC001084788897	1358310469	/nfs/dbraw/zinc/31/04/69/1358310469.db2.gz	HUSCWUGVWQLIIF-SFHLNBCPSA-N	0	3	336.479	3.053	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)C[C@H]3CCc4ccccc4C3)[C@@H]2C1	ZINC001084795817	1358313031	/nfs/dbraw/zinc/31/30/31/1358313031.db2.gz	VVKNCPPLFJHSCC-IOMROCGXSA-N	0	3	338.495	3.290	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)CC3C4CC5CC(C4)CC3C5)[C@@H]2C1	ZINC001084844293	1358326623	/nfs/dbraw/zinc/32/66/23/1358326623.db2.gz	NOAVEDMUGXOALV-OFCVNSCPSA-N	0	3	340.511	3.005	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CCN(C(=O)C[C@@H]4C=CCC4)C[C@@H]32)cc1	ZINC001084886893	1358339543	/nfs/dbraw/zinc/33/95/43/1358339543.db2.gz	IWAZDIJNVWQFFZ-UIFIKXQLSA-N	0	3	349.478	3.337	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3c3ccccc3F)C[C@@H]21	ZINC001085052868	1358378975	/nfs/dbraw/zinc/37/89/75/1358378975.db2.gz	PPVPCVUHMMWTQZ-XZKMEQPCSA-N	0	3	328.431	3.038	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@H](C)c3ccc(F)c(F)c3)C[C@@H]21	ZINC001085097418	1358389897	/nfs/dbraw/zinc/38/98/97/1358389897.db2.gz	GQPOQDVRDILAIL-CLCXKQKWSA-N	0	3	346.421	3.014	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)c1cc(C)co1	ZINC001085303370	1358459751	/nfs/dbraw/zinc/45/97/51/1358459751.db2.gz	HHGULEVPWUGTOE-CHWSQXEVSA-N	0	3	341.249	3.127	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccc(F)c(F)c1F	ZINC001085314950	1358463518	/nfs/dbraw/zinc/46/35/18/1358463518.db2.gz	WDTDNUQYEGSYSK-CHWSQXEVSA-N	0	3	346.780	3.487	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)C1(C)CC=CC1	ZINC001085320525	1358465109	/nfs/dbraw/zinc/46/51/09/1358465109.db2.gz	BHDBZCWVMDVHRS-ZIAGYGMSSA-N	0	3	341.293	3.268	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H]1CCc2ccccc2O1	ZINC001085366945	1358480081	/nfs/dbraw/zinc/48/00/81/1358480081.db2.gz	MLGOFBHMSCBXKF-JFIYKMOQSA-N	0	3	348.874	3.150	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cnc(C2CC2)s1	ZINC001085401116	1358490054	/nfs/dbraw/zinc/49/00/54/1358490054.db2.gz	YRCGBMGEZCOJRY-CHWSQXEVSA-N	0	3	339.892	3.404	20	30		EGEDHN
CC(C)(C)C(=O)N[C@@H]1CCCC[C@H]1NCc1cc(C#N)ccc1F	ZINC001085402661	1358490473	/nfs/dbraw/zinc/49/04/73/1358490473.db2.gz	XOJSLEHBMNMBNZ-IAGOWNOFSA-N	0	3	331.435	3.260	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1csc([C@H]2CCCO2)n1	ZINC001085594465	1358621667	/nfs/dbraw/zinc/62/16/67/1358621667.db2.gz	HJRNWETUASZXKQ-GOEBONIOSA-N	0	3	349.500	3.107	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1cc(C(F)F)ccc1F	ZINC001085599376	1358624752	/nfs/dbraw/zinc/62/47/52/1358624752.db2.gz	PRCQSDNQVWVWJP-CYBMUJFWSA-N	0	3	326.362	3.486	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc2nc(C)oc2c1	ZINC001085651696	1358660268	/nfs/dbraw/zinc/66/02/68/1358660268.db2.gz	AVVRXGRCTGIQPN-MRXNPFEDSA-N	0	3	327.428	3.249	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)[C@@H]1C[C@H]1c1ccccc1CC	ZINC001085787485	1358761996	/nfs/dbraw/zinc/76/19/96/1358761996.db2.gz	PWQIZUXTAJTBDZ-YZGWKJHDSA-N	0	3	326.484	3.461	20	30		EGEDHN
C=C1CCC(C(=O)N(C)C[C@H]2CCN2C[C@H](O)C2CCCCC2)CC1	ZINC001085800999	1358776588	/nfs/dbraw/zinc/77/65/88/1358776588.db2.gz	HQFZBQWSXUYREN-UXHICEINSA-N	0	3	348.531	3.207	20	30		EGEDHN
C#Cc1cncc(C(=O)N(C)C[C@H]2CCN2CCC2=CCCCC2)c1	ZINC001085809715	1358787435	/nfs/dbraw/zinc/78/74/35/1358787435.db2.gz	MAWOAENEZBBDOQ-HXUWFJFHSA-N	0	3	337.467	3.100	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N(C)C[C@H]1CCN1CCC1=CCCCC1	ZINC001085869512	1358835830	/nfs/dbraw/zinc/83/58/30/1358835830.db2.gz	SIHKTORDXFEZOD-AABGKKOBSA-N	0	3	346.515	3.391	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1csc(C(F)(F)F)n1	ZINC001085909156	1358867915	/nfs/dbraw/zinc/86/79/15/1358867915.db2.gz	BSUFDHWAPJSFLN-NSHDSACASA-N	0	3	347.406	3.274	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cn(CCCC)nc1C	ZINC001085917501	1358877185	/nfs/dbraw/zinc/87/71/85/1358877185.db2.gz	BHRUMNNDHHEBCH-KRWDZBQOSA-N	0	3	332.492	3.104	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc(OCC)c(OC)c1	ZINC001085966092	1358923085	/nfs/dbraw/zinc/92/30/85/1358923085.db2.gz	ANWWUVFLEICPBE-KRWDZBQOSA-N	0	3	346.471	3.206	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1c[nH]c2c1cccc2CC	ZINC001085988475	1358940000	/nfs/dbraw/zinc/94/00/00/1358940000.db2.gz	KOGMGTPUMSWDMX-INIZCTEOSA-N	0	3	325.456	3.453	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1cccc2c1OCC2(C)C	ZINC001086005304	1358957943	/nfs/dbraw/zinc/95/79/43/1358957943.db2.gz	CAUJEGHPBZXULM-OAHLLOKOSA-N	0	3	328.456	3.079	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@@H]2C[C@H]2c2ccccc2F)C1	ZINC001086221447	1359031622	/nfs/dbraw/zinc/03/16/22/1359031622.db2.gz	SXLLBLVIRPLGIR-LQKXBSAESA-N	0	3	336.838	3.166	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccccc2OC(C)C)C1	ZINC001086257323	1359044022	/nfs/dbraw/zinc/04/40/22/1359044022.db2.gz	WDJSQBHAGSAEPC-GASCZTMLSA-N	0	3	336.863	3.324	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2sc(CCC)nc2C)C1	ZINC001086270941	1359049900	/nfs/dbraw/zinc/04/99/00/1359049900.db2.gz	ZWYBYYSMAWFUPD-BETUJISGSA-N	0	3	341.908	3.255	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)C2CCCCCC2)C1	ZINC001086320573	1359066205	/nfs/dbraw/zinc/06/62/05/1359066205.db2.gz	XBUBJMWPOFBHLE-CTYIDZIISA-N	0	3	343.309	3.350	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2sc(C3CC3)nc2C)C1	ZINC001086364754	1359078706	/nfs/dbraw/zinc/07/87/06/1359078706.db2.gz	QFJBOGYFWSGDPE-AULYBMBSSA-N	0	3	339.892	3.179	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc(F)cc3ccncc32)C1	ZINC001086369028	1359079241	/nfs/dbraw/zinc/07/92/41/1359079241.db2.gz	LSLLJCOKKMUVKJ-NNUKFRKNSA-N	0	3	347.821	3.224	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc3nccc(C)c3c2)C1	ZINC001086376731	1359081329	/nfs/dbraw/zinc/08/13/29/1359081329.db2.gz	ATTOTPBDJPZWDA-KOMQPUFPSA-N	0	3	343.858	3.394	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc3c(c2)C=CCC3)C1	ZINC001086502911	1359122284	/nfs/dbraw/zinc/12/22/84/1359122284.db2.gz	SUCVIWGNCZRBHF-PPUGGXLSSA-N	0	3	330.859	3.497	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2csc(C(C)C)n2)C1	ZINC001086506342	1359123176	/nfs/dbraw/zinc/12/31/76/1359123176.db2.gz	SQNSZRGLWBGHST-HAQNSBGRSA-N	0	3	327.881	3.117	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)C2C(C)(C)C2(C)C)C1	ZINC001086581002	1359154329	/nfs/dbraw/zinc/15/43/29/1359154329.db2.gz	CVQJHUCKUVZKDA-ZWKOTPCHSA-N	0	3	338.495	3.276	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CC[C@H](CNC(=O)c2ccsc2)C1	ZINC001086640029	1359174311	/nfs/dbraw/zinc/17/43/11/1359174311.db2.gz	SZFBEKIFQMBDEM-KBXCAEBGSA-N	0	3	339.464	3.308	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@H]2CC[C@@H](NCC(=C)Cl)C2)cc1	ZINC001086735965	1359193540	/nfs/dbraw/zinc/19/35/40/1359193540.db2.gz	VNQUYCFUZRWLEM-DOTOQJQBSA-N	0	3	348.874	3.492	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cccc3c2CCC3)C1	ZINC001086886524	1359221603	/nfs/dbraw/zinc/22/16/03/1359221603.db2.gz	HWSIRFMWBLIDJL-GOEBONIOSA-N	0	3	332.875	3.416	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc(Cl)o3)C2)CC1	ZINC001086903827	1359233215	/nfs/dbraw/zinc/23/32/15/1359233215.db2.gz	PBCIGGPBCYGGMO-AWEZNQCLSA-N	0	3	334.847	3.273	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)C[C@H]3CCC(F)(F)C3)C2)CC1	ZINC001086925714	1359250812	/nfs/dbraw/zinc/25/08/12/1359250812.db2.gz	FMZXFYCDSRMLPY-HZPDHXFCSA-N	0	3	338.442	3.148	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)Cc3ccccc3CC)C2)CC1	ZINC001086928322	1359253169	/nfs/dbraw/zinc/25/31/69/1359253169.db2.gz	BEBUNGYPDOVRML-SFHVURJKSA-N	0	3	338.495	3.128	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cccc(C(C)C)n3)C2)CC1	ZINC001086931549	1359255196	/nfs/dbraw/zinc/25/51/96/1359255196.db2.gz	LMWSOERPZWMMCH-KRWDZBQOSA-N	0	3	339.483	3.155	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc(Cl)cc3F)C2)CC1	ZINC001086931629	1359255737	/nfs/dbraw/zinc/25/57/37/1359255737.db2.gz	MZNIJYSHEPIJMO-AWEZNQCLSA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cccc4ncccc43)C2)CC1	ZINC001086935665	1359258588	/nfs/dbraw/zinc/25/85/88/1359258588.db2.gz	XTBFUJBKIQSOAC-QGZVFWFLSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)Cc3cc(C)cc(C)c3)C2)CC1	ZINC001086941450	1359263183	/nfs/dbraw/zinc/26/31/83/1359263183.db2.gz	USFJIYHQRHHIEI-LJQANCHMSA-N	0	3	338.495	3.182	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc(C)cc3F)C2)CC1	ZINC001086944613	1359265896	/nfs/dbraw/zinc/26/58/96/1359265896.db2.gz	CTOJDLNESGUOTQ-INIZCTEOSA-N	0	3	328.431	3.084	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)[C@H](F)c3ccccc3)C2)CC1	ZINC001086945980	1359266808	/nfs/dbraw/zinc/26/68/08/1359266808.db2.gz	MTLTWYZKMPLDCG-PKOBYXMFSA-N	0	3	342.458	3.424	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@H](C)c3ccccc3F)C2)CC1	ZINC001086948716	1359269511	/nfs/dbraw/zinc/26/95/11/1359269511.db2.gz	GKUTVEJOSGFQKU-IAGOWNOFSA-N	0	3	342.458	3.265	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc4cnccc4c3)C2)CC1	ZINC001086952075	1359272066	/nfs/dbraw/zinc/27/20/66/1359272066.db2.gz	ZLXQJANJTNBTLA-QGZVFWFLSA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3ncccc3Cl)C2)CC1	ZINC001086953245	1359273299	/nfs/dbraw/zinc/27/32/99/1359273299.db2.gz	BOJNZPBBBXAFLD-OAHLLOKOSA-N	0	3	345.874	3.075	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc(CC)c(CC)o3)C2)CC1	ZINC001086953645	1359273621	/nfs/dbraw/zinc/27/36/21/1359273621.db2.gz	OWADZQWTXCWEEI-MRXNPFEDSA-N	0	3	342.483	3.354	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc(F)cc3C)C2)CC1	ZINC001086953542	1359273743	/nfs/dbraw/zinc/27/37/43/1359273743.db2.gz	LMVUSLDLMVNZKR-INIZCTEOSA-N	0	3	328.431	3.084	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)CCc3ccccc3)C2)CC1	ZINC001086954242	1359274782	/nfs/dbraw/zinc/27/47/82/1359274782.db2.gz	GASMRVPBWLOOME-LJQANCHMSA-N	0	3	338.495	3.346	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cccc(Cl)c3)C2)CC1	ZINC001086954624	1359275090	/nfs/dbraw/zinc/27/50/90/1359275090.db2.gz	PZVZISDZJRWMFG-OAHLLOKOSA-N	0	3	330.859	3.290	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@H](C=C)c3ccccc3)C2)CC1	ZINC001086955966	1359276683	/nfs/dbraw/zinc/27/66/83/1359276683.db2.gz	AQWGHLHRRIHNTL-UYAOXDASSA-N	0	3	336.479	3.292	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cc4ccccc4[nH]3)C2)CC1	ZINC001086956667	1359277571	/nfs/dbraw/zinc/27/75/71/1359277571.db2.gz	TXZVSBCUKHMHJK-INIZCTEOSA-N	0	3	335.451	3.118	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3cnc(CC)s3)C2)CC1	ZINC001086958164	1359279174	/nfs/dbraw/zinc/27/91/74/1359279174.db2.gz	FZSRSXNVRYLUEH-OAHLLOKOSA-N	0	3	345.512	3.045	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3c[nH]c4ccc(C)cc34)C2)CC1	ZINC001086958382	1359279234	/nfs/dbraw/zinc/27/92/34/1359279234.db2.gz	OOYJWCCQQOIIPA-QGZVFWFLSA-N	0	3	349.478	3.426	20	30		EGEDHN
C[C@@H]1CCN(C(=O)C#CC2CC2)[C@H](CNCc2ccc(F)c(F)c2)C1	ZINC001087163977	1359311860	/nfs/dbraw/zinc/31/18/60/1359311860.db2.gz	ADPJLAYBUPBICY-PBHICJAKSA-N	0	3	346.421	3.095	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccc(C#N)cc1F	ZINC001087198833	1359318147	/nfs/dbraw/zinc/31/81/47/1359318147.db2.gz	DBCBIDFZMRLRRK-KJWYOANISA-N	0	3	343.446	3.070	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](CNCc2csc(CC)n2)[C@H](C)C1	ZINC001184079116	1387389950	/nfs/dbraw/zinc/38/99/50/1387389950.db2.gz	TYZQIVHIIJLPBT-HUUCEWRRSA-N	0	3	335.517	3.246	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001184078856	1387389967	/nfs/dbraw/zinc/38/99/67/1387389967.db2.gz	RCTBDKSOMKXMEY-AEFFLSMTSA-N	0	3	325.456	3.099	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3oc(C)cc3C)C(C)(C)[C@H]21	ZINC001087278315	1359354146	/nfs/dbraw/zinc/35/41/46/1359354146.db2.gz	FGDFUPDXASXNHU-NXHRZFHOSA-N	0	3	328.456	3.139	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(C)c(C)o3)C(C)(C)[C@H]21	ZINC001087282806	1359362130	/nfs/dbraw/zinc/36/21/30/1359362130.db2.gz	DZRHJVTVKWKQOM-NXHRZFHOSA-N	0	3	328.456	3.139	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(F)c(F)c3)C(C)(C)[C@H]21	ZINC001087290133	1359369498	/nfs/dbraw/zinc/36/94/98/1359369498.db2.gz	XSNMBHBNTXLMEP-OLMNPRSZSA-N	0	3	346.421	3.207	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc(C)c(F)c1	ZINC001087295594	1359376724	/nfs/dbraw/zinc/37/67/24/1359376724.db2.gz	LHOXQDXPXRCALC-NZSAHSFTSA-N	0	3	342.458	3.376	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc4ncccc4c3)C(C)(C)[C@H]21	ZINC001087302272	1359385243	/nfs/dbraw/zinc/38/52/43/1359385243.db2.gz	QBBYWXRZTYXTQO-RLLQIKCJSA-N	0	3	347.462	3.087	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3nccc4ccccc43)C(C)(C)[C@@H]21	ZINC001087302311	1359385353	/nfs/dbraw/zinc/38/53/53/1359385353.db2.gz	QQMJPIXTLCSCRQ-MISYRCLQSA-N	0	3	347.462	3.087	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc4cc[nH]c4c3)C(C)(C)[C@@H]21	ZINC001087305989	1359392278	/nfs/dbraw/zinc/39/22/78/1359392278.db2.gz	BOURPVQSZBZNNW-MISYRCLQSA-N	0	3	349.478	3.410	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)[C@H]3CC[C@H](C)CC3)C(C)(C)[C@H]21	ZINC001087314157	1359402737	/nfs/dbraw/zinc/40/27/37/1359402737.db2.gz	GKKUSPITSYENAW-QQXKLLMISA-N	0	3	330.516	3.441	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc(CF)cc1	ZINC001087319430	1359411582	/nfs/dbraw/zinc/41/15/82/1359411582.db2.gz	NOMSITHMRHMCJR-FGTMMUONSA-N	0	3	328.431	3.008	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(CF)cc3)C(C)(C)[C@H]21	ZINC001087319056	1359411685	/nfs/dbraw/zinc/41/16/85/1359411685.db2.gz	HZFVMRAZZLQPMC-QRVBRYPASA-N	0	3	342.458	3.398	20	30		EGEDHN
CCCC(=O)N1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1Cc1ccc(C#N)s1	ZINC001087329614	1359419094	/nfs/dbraw/zinc/41/90/94/1359419094.db2.gz	RPDXBCKACJXPMI-LIRZEXBASA-N	0	3	343.496	3.089	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CN(C(C)C)CC[C@@H]2c2ccccc2)cn1	ZINC001087441922	1359466943	/nfs/dbraw/zinc/46/69/43/1359466943.db2.gz	GMYCRLFWFJQSBG-NHCUHLMSSA-N	0	3	347.462	3.059	20	30		EGEDHN
C=CCCN1CC[C@H](c2cccc(F)c2)[C@H](NC(=O)C2(C)CC2)C1	ZINC001087455701	1359475312	/nfs/dbraw/zinc/47/53/12/1359475312.db2.gz	IVLVRWKBAYNVJD-QZTJIDSGSA-N	0	3	330.447	3.476	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cn(-c3ccccc3)cn2)[C@H]1CC	ZINC001087580774	1359540390	/nfs/dbraw/zinc/54/03/90/1359540390.db2.gz	XGPVYSOXRCSIBF-PKOBYXMFSA-N	0	3	338.455	3.031	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ncoc2-c2ccccc2)[C@H]1CC	ZINC001087593060	1359546881	/nfs/dbraw/zinc/54/68/81/1359546881.db2.gz	NAMJMJNIUOLQCZ-JKSUJKDBSA-N	0	3	325.412	3.110	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(C)nn2C(CC)CC)[C@H]1CC	ZINC001087634413	1359565151	/nfs/dbraw/zinc/56/51/51/1359565151.db2.gz	DKPZZYYQZYOBRB-DLBZAZTESA-N	0	3	332.492	3.321	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2cc(-c3cccs3)on2)[C@H]1CC	ZINC001087677437	1359585083	/nfs/dbraw/zinc/58/50/83/1359585083.db2.gz	QAQBDKUMLVRZFP-DZGCQCFKSA-N	0	3	343.452	3.009	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)n(CC3CC3)c2C)[C@H]1CC	ZINC001087799947	1359651385	/nfs/dbraw/zinc/65/13/85/1359651385.db2.gz	WQIQYHGNKNQVFU-VQTJNVASSA-N	0	3	341.499	3.121	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cccc(OC(C)C)c2)[C@H]1CC	ZINC001087845387	1359678444	/nfs/dbraw/zinc/67/84/44/1359678444.db2.gz	XVRDNGKVKVKXQJ-VQTJNVASSA-N	0	3	342.483	3.009	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CN(C(=O)[C@H]4CC=CCC4)C[C@@H]3C2)c1	ZINC001087881720	1359694567	/nfs/dbraw/zinc/69/45/67/1359694567.db2.gz	PGTONUHVXBLKCF-HBMCJLEFSA-N	0	3	349.478	3.195	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3cccc(C)c3Cl)C[C@@H]2C1	ZINC001088143699	1359771656	/nfs/dbraw/zinc/77/16/56/1359771656.db2.gz	XWYAWWZEDZPLOC-CVEARBPZSA-N	0	3	330.859	3.066	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3sccc3C(F)F)C[C@@H]2C1	ZINC001088186124	1359786065	/nfs/dbraw/zinc/78/60/65/1359786065.db2.gz	ISYIITHUSAAALM-OLZOCXBDSA-N	0	3	338.423	3.103	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2ccc3[nH]ccc3n2)C1	ZINC001088346332	1359833713	/nfs/dbraw/zinc/83/37/13/1359833713.db2.gz	MHWYMTRVNRKAGE-CQSZACIVSA-N	0	3	346.862	3.290	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2ocnc2C2CC2)C1	ZINC001088380451	1359864332	/nfs/dbraw/zinc/86/43/32/1359864332.db2.gz	IIXNKOVZTJWNOF-AWEZNQCLSA-N	0	3	337.851	3.279	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCCCN(C(=O)C(C)(C)C)C1	ZINC001088416747	1359885663	/nfs/dbraw/zinc/88/56/63/1359885663.db2.gz	WTBGAIFHSRXJQF-CYBMUJFWSA-N	0	3	331.298	3.302	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N2CCCCC[C@@H](NCCF)C2)cc1	ZINC001088432333	1359901194	/nfs/dbraw/zinc/90/11/94/1359901194.db2.gz	RRKLAQPCXLRGJH-GOSISDBHSA-N	0	3	348.462	3.124	20	30		EGEDHN
C=C(C)CCN1CC[C@H](NC(=O)c2cnc([C@@H](C)OC)s2)[C@H]1C	ZINC001088569467	1359976331	/nfs/dbraw/zinc/97/63/31/1359976331.db2.gz	VOXVKVQSLOVCQB-MCIONIFRSA-N	0	3	337.489	3.009	20	30		EGEDHN
C=C(C)CCN1CC[C@H](NC(=O)c2cc3c(C)nn(C)c3s2)[C@H]1C	ZINC001088782013	1360042209	/nfs/dbraw/zinc/04/22/09/1360042209.db2.gz	VJAQUPRMVWOCBA-HIFRSBDPSA-N	0	3	346.500	3.102	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ncoc2-c2cccs2)[C@H]1C	ZINC001088927364	1360105859	/nfs/dbraw/zinc/10/58/59/1360105859.db2.gz	QIFCRBDJEMHRCJ-OLZOCXBDSA-N	0	3	331.441	3.172	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)Cc2cccc(OCCC)c2)[C@H]1C	ZINC001088966373	1360118204	/nfs/dbraw/zinc/11/82/04/1360118204.db2.gz	DKJOYKLLIKIBRR-APWZRJJASA-N	0	3	330.472	3.173	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cnn(CCC(C)C)c2C)[C@H]1C	ZINC001088969495	1360119596	/nfs/dbraw/zinc/11/95/96/1360119596.db2.gz	ZVHPSKMBOCWAOX-AEFFLSMTSA-N	0	3	332.492	3.006	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2cc(CC)c(CCC)s2)[C@H]1C	ZINC001089031971	1360142884	/nfs/dbraw/zinc/14/28/84/1360142884.db2.gz	MMNCLAAKKHOLGB-ZBFHGGJFSA-N	0	3	332.513	3.479	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCCN1C(=O)C1CCC1	ZINC001089098356	1360166382	/nfs/dbraw/zinc/16/63/82/1360166382.db2.gz	JJWDFASKZPOSMZ-IBGZPJMESA-N	0	3	325.456	3.171	20	30		EGEDHN
C[C@@H]1CN(C(=O)C#CC(C)(C)C)CC[C@@H]1CNC/C(Cl)=C/Cl	ZINC001184369497	1387441653	/nfs/dbraw/zinc/44/16/53/1387441653.db2.gz	FZFUYLLLCQHPLM-OFGWCQOXSA-N	0	3	345.314	3.429	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2coc(C(C)(C)C)n2)CC(C)(C)C1	ZINC001089384063	1360385139	/nfs/dbraw/zinc/38/51/39/1360385139.db2.gz	NJZDDZRJSBEOCJ-OAHLLOKOSA-N	0	3	345.487	3.216	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(C(C)C)nc2)CC(C)(C)C1	ZINC001089403297	1360402584	/nfs/dbraw/zinc/40/25/84/1360402584.db2.gz	QONKLZBURKTFIC-KRWDZBQOSA-N	0	3	327.472	3.059	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3cnccc3o2)CC(C)(C)C1	ZINC001089430814	1360422758	/nfs/dbraw/zinc/42/27/58/1360422758.db2.gz	USNWERUJIMHRKY-MRXNPFEDSA-N	0	3	339.439	3.072	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2c(F)cc(C)cc2F)CC(C)(C)C1	ZINC001089435548	1360426579	/nfs/dbraw/zinc/42/65/79/1360426579.db2.gz	LVAURNFWZYWMPI-CQSZACIVSA-N	0	3	334.410	3.127	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@H](c2ccccc2)C2CC2)CC(C)(C)C1	ZINC001089439820	1360430317	/nfs/dbraw/zinc/43/03/17/1360430317.db2.gz	UHQVTIIZMGICSO-WOJBJXKFSA-N	0	3	338.495	3.420	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@H](C)c2ccccc2F)CC(C)(C)C1	ZINC001089521065	1360488813	/nfs/dbraw/zinc/48/88/13/1360488813.db2.gz	DPVCFLQRSHKSLA-CVEARBPZSA-N	0	3	330.447	3.169	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@H](C)c2ccc(F)cc2F)CC(C)(C)C1	ZINC001089560944	1360509234	/nfs/dbraw/zinc/50/92/34/1360509234.db2.gz	KPMQYVYLQKNJLU-ZBFHGGJFSA-N	0	3	348.437	3.308	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cccc(F)c1C	ZINC001089641357	1360554664	/nfs/dbraw/zinc/55/46/64/1360554664.db2.gz	LPGLZRLNOQDEQD-MRXNPFEDSA-N	0	3	330.447	3.378	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccn(C(F)F)n1	ZINC001089647595	1360560815	/nfs/dbraw/zinc/56/08/15/1360560815.db2.gz	XJOLRURSNQOQII-CYBMUJFWSA-N	0	3	340.418	3.075	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](CNCc2cnc(C)o2)[C@H](C)C1	ZINC001184447623	1387462765	/nfs/dbraw/zinc/46/27/65/1387462765.db2.gz	JVLSKONVGJNQGZ-QAPCUYQASA-N	0	3	345.487	3.326	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccncc1CC	ZINC001089661219	1360572495	/nfs/dbraw/zinc/57/24/95/1360572495.db2.gz	UMASNRWCDIIJRB-QGZVFWFLSA-N	0	3	329.488	3.441	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1ncn2ccc(C)cc12	ZINC001089664112	1360574148	/nfs/dbraw/zinc/57/41/48/1360574148.db2.gz	ZWQMJJJESXBFMQ-INIZCTEOSA-N	0	3	340.471	3.049	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1cccc(OCC)c1	ZINC001089706208	1360609421	/nfs/dbraw/zinc/60/94/21/1360609421.db2.gz	PIYVSIBELJYSJX-KRWDZBQOSA-N	0	3	330.472	3.492	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1oc(C2CC2)nc1C	ZINC001089707483	1360610621	/nfs/dbraw/zinc/61/06/21/1360610621.db2.gz	LFBRPOPDCXUUEF-MRXNPFEDSA-N	0	3	343.471	3.104	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cnn(CC)c1C	ZINC001089716781	1360618418	/nfs/dbraw/zinc/61/84/18/1360618418.db2.gz	RIKCHIPPOJHDMG-MRXNPFEDSA-N	0	3	332.492	3.008	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cnn2c1CCCC2	ZINC001089718814	1360620777	/nfs/dbraw/zinc/62/07/77/1360620777.db2.gz	URLBRLWIKPKGNY-MRXNPFEDSA-N	0	3	344.503	3.016	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1sccc1OC	ZINC001089723504	1360626727	/nfs/dbraw/zinc/62/67/27/1360626727.db2.gz	KWZWACFLUAGJNA-AWEZNQCLSA-N	0	3	334.485	3.000	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cccc(OC)c1	ZINC001089725186	1360628828	/nfs/dbraw/zinc/62/88/28/1360628828.db2.gz	BKXNQKZKNDCMGF-QGZVFWFLSA-N	0	3	330.472	3.492	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCC(C)(C)CN2CC=C(C)C)cn1	ZINC001089726118	1360629366	/nfs/dbraw/zinc/62/93/66/1360629366.db2.gz	NESOKCRFZLOILV-IBGZPJMESA-N	0	3	339.483	3.250	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ncccc1OCC	ZINC001089741636	1360645498	/nfs/dbraw/zinc/64/54/98/1360645498.db2.gz	FANAIGZNYHHOHT-INIZCTEOSA-N	0	3	345.487	3.277	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)c2[nH]c(C)cc2C)C1	ZINC001089825541	1360682014	/nfs/dbraw/zinc/68/20/14/1360682014.db2.gz	CKVCCJFGIVHUON-QAETUUGQSA-N	0	3	347.890	3.166	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C2CC3(CCC3)C2)CC2(CCOCC2)C1	ZINC001089950913	1360760328	/nfs/dbraw/zinc/76/03/28/1360760328.db2.gz	CYMVHORCUGAOIT-GOSISDBHSA-N	0	3	346.515	3.130	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](CNCc2ccn(C(C)C)n2)[C@@H](C)C1	ZINC001184509952	1387478630	/nfs/dbraw/zinc/47/86/30/1387478630.db2.gz	BQZMCRPFWPONKW-ROUUACIJSA-N	0	3	346.519	3.395	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccccc2CC(C)(C)C)[C@H](O)C1	ZINC001090347316	1360893729	/nfs/dbraw/zinc/89/37/29/1360893729.db2.gz	POKHQRXARNSICG-RBUKOAKNSA-N	0	3	344.499	3.016	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2csc(C(C)(C)C)n2)C1	ZINC001091283346	1361030869	/nfs/dbraw/zinc/03/08/69/1361030869.db2.gz	FRAPEMQNTBYHHT-UHFFFAOYSA-N	0	3	341.908	3.291	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(N(CC)CC)cc2)C1	ZINC001091342413	1361052500	/nfs/dbraw/zinc/05/25/00/1361052500.db2.gz	HNSJMUSNPHLXMF-UHFFFAOYSA-N	0	3	349.906	3.383	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)C2CCC=CCC2)C1	ZINC001091369582	1361064490	/nfs/dbraw/zinc/06/44/90/1361064490.db2.gz	ZPLMKTVGHDVHCZ-UHFFFAOYSA-N	0	3	341.293	3.126	20	30		EGEDHN
C[C@@]1(C(=O)N2C[C@H]3CN(Cc4ccc(C#N)cc4)C[C@@]3(C)C2)C=CCC1	ZINC001091929345	1361252410	/nfs/dbraw/zinc/25/24/10/1361252410.db2.gz	IXYMTSBYZHDERO-FCEUIQTBSA-N	0	3	349.478	3.195	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CN(Cc4cnccc4C)C[C@@]3(C)C2)C1	ZINC001091995247	1361269656	/nfs/dbraw/zinc/26/96/56/1361269656.db2.gz	CUOOSMHEOPGXRQ-NQIIRXRSSA-N	0	3	339.483	3.027	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@@H](CC)CC3CCCC3)C[C@]2(C)C1	ZINC001092065017	1361286351	/nfs/dbraw/zinc/28/63/51/1361286351.db2.gz	HZYPOCVFKMLZBI-ZVDOUQERSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)c2ccc(C#C)cc2)CC1	ZINC001093374883	1361584960	/nfs/dbraw/zinc/58/49/60/1361584960.db2.gz	MYAZQCKLUYMXBJ-OAQYLSRUSA-N	0	3	346.474	3.008	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)c2csc(C)c2)CC1	ZINC001093380964	1361592099	/nfs/dbraw/zinc/59/20/99/1361592099.db2.gz	CCDIIPWUSJSUJM-GOSISDBHSA-N	0	3	342.508	3.396	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cscc3C(F)F)CCC[C@@H]12	ZINC001094416410	1361791756	/nfs/dbraw/zinc/79/17/56/1361791756.db2.gz	RSVFWURULGWHAZ-RHSMWYFYSA-N	0	3	338.423	3.293	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cc(C)c4ccccc4n3)CCC[C@@H]12	ZINC001094450464	1361806299	/nfs/dbraw/zinc/80/62/99/1361806299.db2.gz	PWZDLHPCUWROPL-IFMALSPDSA-N	0	3	347.462	3.151	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3c(C)[nH]c4ccccc43)CCC[C@@H]12	ZINC001094463977	1361812492	/nfs/dbraw/zinc/81/24/92/1361812492.db2.gz	BJEAYZLAJVJOGT-WIYYLYMNSA-N	0	3	335.451	3.084	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cn(CC)c4ccccc34)CCC[C@@H]12	ZINC001094464975	1361813639	/nfs/dbraw/zinc/81/36/39/1361813639.db2.gz	YNQLIFQUKCAHCT-IFMALSPDSA-N	0	3	349.478	3.269	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cc(C)nc4ccccc43)CCC[C@@H]12	ZINC001094573721	1361866316	/nfs/dbraw/zinc/86/63/16/1361866316.db2.gz	JFBWNWJFKYPHMF-IFMALSPDSA-N	0	3	347.462	3.151	20	30		EGEDHN
CC[C@@H](C(=O)NCCCCCCNc1cccc(F)c1C#N)N(C)C	ZINC001094964497	1361965254	/nfs/dbraw/zinc/96/52/54/1361965254.db2.gz	GVAHTHKKMAFCMU-SFHVURJKSA-N	0	3	348.466	3.126	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1sc(C3CC3)nc1C)C2	ZINC001095408132	1362131287	/nfs/dbraw/zinc/13/12/87/1362131287.db2.gz	DTUYOGOIKVQEDH-ILXRZTDVSA-N	0	3	331.485	3.240	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccccc1-c1ccncc1)C2	ZINC001095615993	1362187166	/nfs/dbraw/zinc/18/71/66/1362187166.db2.gz	QPMRNCFPOFPZLI-QMMLZNLJSA-N	0	3	345.446	3.107	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1cccc(C(F)F)c1)C2	ZINC001095749344	1362220787	/nfs/dbraw/zinc/22/07/87/1362220787.db2.gz	FEPHAAQMCUIDFH-IKGGRYGDSA-N	0	3	334.410	3.464	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1cccc(C)c1Cl)C2	ZINC001095751111	1362221333	/nfs/dbraw/zinc/22/13/33/1362221333.db2.gz	YTDOQMMMXIDZBS-IKGGRYGDSA-N	0	3	332.875	3.489	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](C)c1c(F)cccc1F)C2	ZINC001095765451	1362223917	/nfs/dbraw/zinc/22/39/17/1362223917.db2.gz	DUABMLACDFFVFJ-OMNBBPDLSA-N	0	3	334.410	3.366	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](CNCc2cc(C)no2)[C@H](C)C1	ZINC001184935446	1387565535	/nfs/dbraw/zinc/56/55/35/1387565535.db2.gz	XAIKUHIPGDSCQC-AEFFLSMTSA-N	0	3	345.487	3.141	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](CNCc2ocnc2C)[C@@H](C)C1	ZINC001184945444	1387568297	/nfs/dbraw/zinc/56/82/97/1387568297.db2.gz	NQLFCHAHLQRNML-WMZOPIPTSA-N	0	3	345.487	3.141	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1sc(C)cc1OC)C2	ZINC001096099846	1362381938	/nfs/dbraw/zinc/38/19/38/1362381938.db2.gz	GMMFQSOOQFGQCU-ILXRZTDVSA-N	0	3	334.485	3.366	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@]1(C)CCCc3ccccc31)C2	ZINC001096173147	1362413893	/nfs/dbraw/zinc/41/38/93/1362413893.db2.gz	DLIPOQMPISZCPX-XBZUYWNMSA-N	0	3	336.479	3.025	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1coc(C3CCCC3)n1)C2	ZINC001096259643	1362451207	/nfs/dbraw/zinc/45/12/07/1362451207.db2.gz	YAIZXMXCMQNOSB-VYDXJSESSA-N	0	3	329.444	3.243	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](CNCc2nc(C)cs2)[C@H](C)C1	ZINC001184977864	1387578140	/nfs/dbraw/zinc/57/81/40/1387578140.db2.gz	FSBXRBOTEUMZEQ-NVXWUHKLSA-N	0	3	347.528	3.219	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1c(Cl)oc3ccccc31)C2	ZINC001097693760	1363102607	/nfs/dbraw/zinc/10/26/07/1363102607.db2.gz	GVDOWAIPDZFTIK-YUELXQCFSA-N	0	3	342.826	3.445	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1oc(CC(C)C)nc1C)C2	ZINC001097999828	1363193727	/nfs/dbraw/zinc/19/37/27/1363193727.db2.gz	POTWZQXRVNUSFD-OAGGEKHMSA-N	0	3	331.460	3.093	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](CNCc3cnc(C)o3)[C@H](C)C2)CCC1	ZINC001185093803	1387617180	/nfs/dbraw/zinc/61/71/80/1387617180.db2.gz	DAFUWAGLTPJYPK-NVXWUHKLSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1cc(C)ccc1C)C[C@H](C)O2	ZINC001098660317	1363423301	/nfs/dbraw/zinc/42/33/01/1363423301.db2.gz	RQDOQYWOIXJUCP-SFHVURJKSA-N	0	3	342.483	3.185	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cccc3ccc(C)nc32)C1	ZINC001098894398	1363508331	/nfs/dbraw/zinc/50/83/31/1363508331.db2.gz	QVFJOEKZPGTLDM-UWJYYQICSA-N	0	3	335.451	3.314	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)Cc2ccc(C(F)F)cc2)C1	ZINC001098940837	1363531098	/nfs/dbraw/zinc/53/10/98/1363531098.db2.gz	LLERFUNUQZAJSK-PXNSSMCTSA-N	0	3	346.421	3.161	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H](C)c2c(F)cccc2F)C1	ZINC001098945497	1363534142	/nfs/dbraw/zinc/53/41/42/1363534142.db2.gz	ZSLFTVKBPBGITB-NJSLBKSFSA-N	0	3	334.410	3.225	20	30		EGEDHN
C=CCOCC(=O)NC[C@H]1CCC(C)(C)CN1Cc1cccc(C)c1	ZINC001098971119	1363547256	/nfs/dbraw/zinc/54/72/56/1363547256.db2.gz	KESGVDLEWYGODG-LJQANCHMSA-N	0	3	344.499	3.304	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC[C@H]1CCC(C)(C)CN1Cc1ccc(CF)cc1	ZINC001098977000	1363551927	/nfs/dbraw/zinc/55/19/27/1363551927.db2.gz	YTDGKTHXRSLBSF-MAUKXSAKSA-N	0	3	345.462	3.423	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC[C@@H]1CCC(C)(C)CN1Cc1ccc(CF)cc1	ZINC001098977003	1363552053	/nfs/dbraw/zinc/55/20/53/1363552053.db2.gz	YTDGKTHXRSLBSF-YJBOKZPZSA-N	0	3	345.462	3.423	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)c1oc(C)cc1C	ZINC001099011717	1363572394	/nfs/dbraw/zinc/57/23/94/1363572394.db2.gz	BUNSGPGZSKACBI-KRWDZBQOSA-N	0	3	348.487	3.319	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)Cc1ccc(OC)c(F)c1	ZINC001099135192	1363646893	/nfs/dbraw/zinc/64/68/93/1363646893.db2.gz	JOENUIBFDXCJKS-MRXNPFEDSA-N	0	3	348.462	3.170	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(-c3ccccc3)[nH]2)C1	ZINC001099184013	1363679462	/nfs/dbraw/zinc/67/94/62/1363679462.db2.gz	UDTAKRHPDGSOEY-UWJYYQICSA-N	0	3	335.451	3.452	20	30		EGEDHN
C=CCC1(C(=O)NC[C@H]2CCC(C)(C)CN2CCOCC)CCC1	ZINC001099225469	1363701013	/nfs/dbraw/zinc/70/10/13/1363701013.db2.gz	VYASUZAIEKLJRL-QGZVFWFLSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H](C)c1c(C)n[nH]c1C	ZINC001099269933	1363724523	/nfs/dbraw/zinc/72/45/23/1363724523.db2.gz	HETIQWBMTIKGAG-YOEHRIQHSA-N	0	3	346.519	3.313	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2cccc3ncccc32)C[C@H]1C(F)(F)F	ZINC001099287863	1363733563	/nfs/dbraw/zinc/73/35/63/1363733563.db2.gz	QBLNCFHTKJGERS-GDBMZVCRSA-N	0	3	349.356	3.013	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@H]2CCCC2(C)C)C[C@H]1C(F)(F)F	ZINC001099292152	1363735125	/nfs/dbraw/zinc/73/51/25/1363735125.db2.gz	IQWGXQAJSWRNBU-MGPQQGTHSA-N	0	3	332.410	3.368	20	30		EGEDHN
CCCCCCCCC(=O)NC[C@@H]1CCC(C)(C)CN1CCO	ZINC001099316664	1363746455	/nfs/dbraw/zinc/74/64/55/1363746455.db2.gz	ZCUYIIUSENJWTH-KRWDZBQOSA-N	0	3	326.525	3.336	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)Cc1ccc(OC)cc1	ZINC001099321413	1363749309	/nfs/dbraw/zinc/74/93/09/1363749309.db2.gz	WDEDHASNAMFMEN-KRWDZBQOSA-N	0	3	330.472	3.031	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2cccc(C)c2Cl)C[C@H]1C(F)(F)F	ZINC001099323206	1363750068	/nfs/dbraw/zinc/75/00/68/1363750068.db2.gz	ZHQICXWXILWPOM-CHWSQXEVSA-N	0	3	346.780	3.427	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)CCOc1ccccc1F	ZINC001099329526	1363753901	/nfs/dbraw/zinc/75/39/01/1363753901.db2.gz	PTBFNMKMCOCGMI-INIZCTEOSA-N	0	3	348.462	3.387	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2oc(CC)cc2C)C[C@H]1C(F)(F)F	ZINC001099332661	1363754974	/nfs/dbraw/zinc/75/49/74/1363754974.db2.gz	GXRZPTRFQZUPJN-ZIAGYGMSSA-N	0	3	344.377	3.319	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2cc3[nH]ccc3s2)C[C@H]1C(F)(F)F	ZINC001099337144	1363757859	/nfs/dbraw/zinc/75/78/59/1363757859.db2.gz	JGGSBRWSCAGBJY-MWLCHTKSSA-N	0	3	343.374	3.008	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)C1(CCOC)CCCC1	ZINC001099358624	1363771779	/nfs/dbraw/zinc/77/17/79/1363771779.db2.gz	JJIDGENINRHYQX-QGZVFWFLSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)CC(F)(F)C(F)(F)F	ZINC001099379431	1363780741	/nfs/dbraw/zinc/78/07/41/1363780741.db2.gz	KBWJOHHXWDTWSN-NSHDSACASA-N	0	3	342.352	3.367	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCCC2CC2)CC2(CCOCC2)C1	ZINC001099588918	1363870623	/nfs/dbraw/zinc/87/06/23/1363870623.db2.gz	LWVMUPRECVWNLM-SFHVURJKSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)[C@H](C)CC2CCCC2)CC2(CCOCC2)C1	ZINC001099594482	1363877421	/nfs/dbraw/zinc/87/74/21/1363877421.db2.gz	DSTAQTOLURDQAN-IEBWSBKVSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1CCN(Cc2ccc(C(C)C)cc2)C[C@@H]1O	ZINC001099944623	1363989043	/nfs/dbraw/zinc/98/90/43/1363989043.db2.gz	OXFMDZOGQBNBTF-OALUTQOASA-N	0	3	344.499	3.074	20	30		EGEDHN
CC(C(=O)NCC1CC(NCC#Cc2ccccc2)C1)=C1CCCC1	ZINC001100229445	1364050542	/nfs/dbraw/zinc/05/05/42/1364050542.db2.gz	JXIBBRKJNYKTNI-UHFFFAOYSA-N	0	3	336.479	3.413	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](CNCc2nccs2)[C@H](C)C1	ZINC001185227001	1387656746	/nfs/dbraw/zinc/65/67/46/1387656746.db2.gz	ULXVEQKCVLOOTJ-HUUCEWRRSA-N	0	3	335.517	3.320	20	30		EGEDHN
C#CCCCCC(=O)NCC1CC(NCc2ccc(F)cc2F)C1	ZINC001100259406	1364060537	/nfs/dbraw/zinc/06/05/37/1364060537.db2.gz	KHTMRKCODGILQU-UHFFFAOYSA-N	0	3	334.410	3.143	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCC1CC(NCc2c(C)onc2CC)C1	ZINC001100358252	1364090079	/nfs/dbraw/zinc/09/00/79/1364090079.db2.gz	NINABNFREQLLEG-UHFFFAOYSA-N	0	3	345.487	3.298	20	30		EGEDHN
CC(C)C(C)(C)C(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100365992	1364093379	/nfs/dbraw/zinc/09/33/79/1364093379.db2.gz	XHJXLJCCRGSMGK-UHFFFAOYSA-N	0	3	344.474	3.344	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NCC1CC(NCC=C(Cl)Cl)C1)OCC	ZINC001100376456	1364095771	/nfs/dbraw/zinc/09/57/71/1364095771.db2.gz	IWTXUOUXVLELNA-RUXDESIVSA-N	0	3	349.302	3.161	20	30		EGEDHN
CCCC[C@](C)(F)C(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100460909	1364122826	/nfs/dbraw/zinc/12/28/26/1364122826.db2.gz	DUPNARXKPDYXSU-GRERDSQWSA-N	0	3	344.474	3.441	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1	ZINC001100561392	1364163224	/nfs/dbraw/zinc/16/32/24/1364163224.db2.gz	ZJVCBFFALMCRSD-UHFFFAOYSA-N	0	3	343.446	3.284	20	30		EGEDHN
C=CC(C)(C)C(=O)NCC1CC(NCC#Cc2ccc(Cl)cc2)C1	ZINC001100564767	1364164343	/nfs/dbraw/zinc/16/43/43/1364164343.db2.gz	WSRGQIBSYYNPQB-UHFFFAOYSA-N	0	3	344.886	3.388	20	30		EGEDHN
CC(C)c1[nH]ccc1C(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100595984	1364181282	/nfs/dbraw/zinc/18/12/82/1364181282.db2.gz	KLMSQHPNOSMZEW-UHFFFAOYSA-N	0	3	349.478	3.288	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCC1CC(NCc2cc(F)ccc2OC)C1	ZINC001100596774	1364181884	/nfs/dbraw/zinc/18/18/84/1364181884.db2.gz	CXQQUOANTHLACZ-SYJJWHGVSA-N	0	3	348.462	3.421	20	30		EGEDHN
CCC(C)(C)C(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100624346	1364194274	/nfs/dbraw/zinc/19/42/74/1364194274.db2.gz	GUJQKTVNACHBCU-UHFFFAOYSA-N	0	3	330.447	3.098	20	30		EGEDHN
C=CCC1(C(=O)NCC2CC(NCc3ccncc3Cl)C2)CCC1	ZINC001100648716	1364204687	/nfs/dbraw/zinc/20/46/87/1364204687.db2.gz	TWZFRRNLXANKAH-UHFFFAOYSA-N	0	3	347.890	3.466	20	30		EGEDHN
CCCC1(C(=O)NCC2CC(NCc3ccc(C#N)cc3F)C2)CC1	ZINC001100654123	1364206032	/nfs/dbraw/zinc/20/60/32/1364206032.db2.gz	OLCNFTFNELRYJC-UHFFFAOYSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H](C)OC2CCCCCC2)C1	ZINC001100659140	1364207167	/nfs/dbraw/zinc/20/71/67/1364207167.db2.gz	IMJHTJDSMXLFSK-QQFBHYJXSA-N	0	3	342.911	3.351	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)[C@@H](C)CC(C)(C)C)C1	ZINC001100734101	1364240904	/nfs/dbraw/zinc/24/09/04/1364240904.db2.gz	MSGICQLWLUTOGJ-XGNXJENSSA-N	0	3	345.325	3.452	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)COc2ccsc2Cl)C1	ZINC001100748186	1364245906	/nfs/dbraw/zinc/24/59/06/1364245906.db2.gz	AVKQHVMWKZQMIY-UHFFFAOYSA-N	0	3	349.283	3.017	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)[C@H](CC)CC(C)C)C1	ZINC001100839490	1364284701	/nfs/dbraw/zinc/28/47/01/1364284701.db2.gz	NZNKCVWNLQCMRY-SHARSMKWSA-N	0	3	345.325	3.452	20	30		EGEDHN
C=CCN1CC[C@@H](Oc2ccnc(CNC(=O)[C@@H](C)CCCC)c2)C1	ZINC001101093936	1364410886	/nfs/dbraw/zinc/41/08/86/1364410886.db2.gz	NCOHMAVLKRRAFF-QFBILLFUSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@H]2CN(Cc3scnc3C)C[C@@]2(C)C1	ZINC001101378358	1364535617	/nfs/dbraw/zinc/53/56/17/1364535617.db2.gz	WFZVPKQHKDWLSQ-BEFAXECRSA-N	0	3	347.528	3.334	20	30		EGEDHN
CCCC(C)(C)C(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001185328508	1387684215	/nfs/dbraw/zinc/68/42/15/1387684215.db2.gz	QIODNTJABMFYEC-MRXNPFEDSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=CCCC(=O)N1CCC(C(C)(C)CNCc2cc(C)n(C)n2)CC1	ZINC001101519391	1364595383	/nfs/dbraw/zinc/59/53/83/1364595383.db2.gz	CUOBTZNSPBDVSS-UHFFFAOYSA-N	0	3	346.519	3.049	20	30		EGEDHN
CC(C)=C(F)C(=O)NC[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1C	ZINC001101876376	1364761224	/nfs/dbraw/zinc/76/12/24/1364761224.db2.gz	NVWGWKZEAQOVDA-NVXWUHKLSA-N	0	3	346.421	3.125	20	30		EGEDHN
CC/C(C)=C\C(=O)NC[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1C	ZINC001101940502	1364783053	/nfs/dbraw/zinc/78/30/53/1364783053.db2.gz	GYMHSQCGPHENNM-UITAXRJMSA-N	0	3	342.458	3.218	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@@H]1CN(Cc2cccc(Cl)c2)C[C@H]1C	ZINC001101946655	1364786532	/nfs/dbraw/zinc/78/65/32/1364786532.db2.gz	DCKZRPZRHPGVAO-NVXWUHKLSA-N	0	3	332.875	3.184	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@@H]1CN(Cc2c(C)noc2CC)C[C@H]1C	ZINC001102006470	1364809281	/nfs/dbraw/zinc/80/92/81/1364809281.db2.gz	DIXRUWWDGLNOHG-GDBMZVCRSA-N	0	3	347.503	3.332	20	30		EGEDHN
CCCCC1(C(=O)N2CC[C@@H](NCc3ccc(C#N)s3)C2)CC1	ZINC001185423794	1387711452	/nfs/dbraw/zinc/71/14/52/1387711452.db2.gz	ATFVOGQEGHOYAJ-CQSZACIVSA-N	0	3	331.485	3.281	20	30		EGEDHN
CCC(C)(C)C(=O)NC[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1C	ZINC001102299070	1364989884	/nfs/dbraw/zinc/98/98/84/1364989884.db2.gz	KGQSFQLLDNYPDQ-RHSMWYFYSA-N	0	3	345.462	3.318	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@@H]1CN(Cc2c(C)noc2C)C[C@H]1C	ZINC001102326385	1365002305	/nfs/dbraw/zinc/00/23/05/1365002305.db2.gz	PROGPHZXBFENLP-VVFCZOMOSA-N	0	3	333.476	3.078	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C	ZINC001102328318	1365003972	/nfs/dbraw/zinc/00/39/72/1365003972.db2.gz	DPANYXHCWTYZRA-SYYKKAFVSA-N	0	3	338.495	3.325	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H]2CN(Cc3oc(C)nc3C)C[C@H]2C)CCC1	ZINC001102331699	1365005899	/nfs/dbraw/zinc/00/58/99/1365005899.db2.gz	ONQARKRXQRHAHI-RHSMWYFYSA-N	0	3	345.487	3.222	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C	ZINC001102423442	1365048814	/nfs/dbraw/zinc/04/88/14/1365048814.db2.gz	XGSFGHIXSYJZOL-QWFCFKBJSA-N	0	3	326.484	3.014	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](NCc3ccc(F)c(F)c3)C2)CC1	ZINC001185438547	1387717514	/nfs/dbraw/zinc/71/75/14/1387717514.db2.gz	DWROJWHXKFEXJR-OAHLLOKOSA-N	0	3	334.410	3.402	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)C(=O)NC[C@@H]1CN(CCF)C[C@H]1C	ZINC001102592005	1365128129	/nfs/dbraw/zinc/12/81/29/1365128129.db2.gz	ISMUBQFCONTPJU-BHIYHBOVSA-N	0	3	332.463	3.075	20	30		EGEDHN
CC(C)=CC(=O)NCC[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1C	ZINC001102647976	1365154264	/nfs/dbraw/zinc/15/42/64/1365154264.db2.gz	KQQYVKYWWVYLQB-CRAIPNDOSA-N	0	3	343.446	3.238	20	30		EGEDHN
CC[C@@H](C)C(=O)NCC[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1C	ZINC001102678689	1365167210	/nfs/dbraw/zinc/16/72/10/1365167210.db2.gz	YFNBBEHJMOQGBK-IIDMSEBBSA-N	0	3	345.462	3.318	20	30		EGEDHN
CC[C@H](C)C(=O)NCC[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1C	ZINC001102679859	1365167317	/nfs/dbraw/zinc/16/73/17/1365167317.db2.gz	NMFUXMBDDWYJCP-LZLYRXPVSA-N	0	3	327.472	3.179	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1CCNC(=O)[C@H]1CC1(C)C	ZINC001102870327	1365262140	/nfs/dbraw/zinc/26/21/40/1365262140.db2.gz	YUAILLQCWYMGMT-SZVBFZGTSA-N	0	3	339.483	3.179	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2c(C)cc(C)nc2C)C1	ZINC001103252532	1365457256	/nfs/dbraw/zinc/45/72/56/1365457256.db2.gz	SGVZTQYKGVLNDJ-CXAGYDPISA-N	0	3	349.906	3.447	20	30		EGEDHN
C#CC[C@@H](CC(=O)NCC[C@@H]1CN(CCF)C[C@H]1C)c1ccccc1	ZINC001103784741	1365782491	/nfs/dbraw/zinc/78/24/91/1365782491.db2.gz	NRNIOKPJPFSRGN-YZGWKJHDSA-N	0	3	344.474	3.227	20	30		EGEDHN
CC(C)=CC(=O)N1C[C@@H](C)[C@H](CCNCc2cc(C#N)ccc2F)C1	ZINC001103844308	1365810335	/nfs/dbraw/zinc/81/03/35/1365810335.db2.gz	ATMOVFGTXJWLRE-NVXWUHKLSA-N	0	3	343.446	3.238	20	30		EGEDHN
CC(C)=CC(=O)N1C[C@@H](C)[C@H](CCNCc2ccccc2C#N)C1	ZINC001103844697	1365810636	/nfs/dbraw/zinc/81/06/36/1365810636.db2.gz	VQDUTAGXIXUEMX-VQIMIIECSA-N	0	3	325.456	3.099	20	30		EGEDHN
CCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2cc(C#N)ccc2F)C1	ZINC001103892912	1365826380	/nfs/dbraw/zinc/82/63/80/1365826380.db2.gz	ZNFCKUJEAGQFPY-NVXWUHKLSA-N	0	3	345.462	3.462	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](C)[C@H](CCNCc2ccc(F)cn2)C1	ZINC001104238337	1365965586	/nfs/dbraw/zinc/96/55/86/1365965586.db2.gz	CPLUACONKSPNMV-HZPDHXFCSA-N	0	3	347.478	3.397	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)[C@H](CCNCc2ccc(F)cn2)C1	ZINC001104245521	1365966875	/nfs/dbraw/zinc/96/68/75/1365966875.db2.gz	NAKMWDJXUHULIC-HZPDHXFCSA-N	0	3	333.451	3.151	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)C(C)(C)c2cccnc2)C[C@H]1C	ZINC001104371691	1365992004	/nfs/dbraw/zinc/99/20/04/1365992004.db2.gz	BGFHUTDAVPZKMX-GDBMZVCRSA-N	0	3	349.906	3.186	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@H](CCNCc2conc2C)C1	ZINC001104485860	1366045680	/nfs/dbraw/zinc/04/56/80/1366045680.db2.gz	RDJNKDLYWUSWGI-GDBMZVCRSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](C)[C@H](CCNCc2ocnc2C)C1	ZINC001104562646	1366077396	/nfs/dbraw/zinc/07/73/96/1366077396.db2.gz	CZYMSJAKKFDEEC-ZMSDIMECSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](C)[C@H](CCNCc2cnc(C)o2)C1	ZINC001104563928	1366078748	/nfs/dbraw/zinc/07/87/48/1366078748.db2.gz	ZFTZVQVZYKHSHY-ZMSDIMECSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2ccn(C(C)C)n2)C1	ZINC001104606712	1366098548	/nfs/dbraw/zinc/09/85/48/1366098548.db2.gz	BSWSGMXDWBTVIC-QZTJIDSGSA-N	0	3	346.519	3.395	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H](C)[C@H](CCNCc3ocnc3C)C2)CC1	ZINC001104631752	1366110523	/nfs/dbraw/zinc/11/05/23/1366110523.db2.gz	ZSOBCKUEMGYKAA-CRAIPNDOSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2c(F)cccc2F)C[C@H]1C	ZINC001104947584	1366237001	/nfs/dbraw/zinc/23/70/01/1366237001.db2.gz	XVTWHVCVNCSSEW-DGCLKSJQSA-N	0	3	342.817	3.405	20	30		EGEDHN
CCCCCCCNCc1cn(C2CN(C(=O)[C@@H](C)C(C)C)C2)nn1	ZINC001105336285	1366423338	/nfs/dbraw/zinc/42/33/38/1366423338.db2.gz	BOFQCXJTQURUPT-INIZCTEOSA-N	0	3	349.523	3.014	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(c2ccccc2)C[C@H](NC(=O)c2ccoc2)C1	ZINC001105404573	1366449961	/nfs/dbraw/zinc/44/99/61/1366449961.db2.gz	GKWCDFDNXQGEMS-IZAXUBKRSA-N	0	3	344.842	3.452	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](NCc2cn(C(C)C)nc2C)C1	ZINC001185958841	1387836253	/nfs/dbraw/zinc/83/62/53/1387836253.db2.gz	CJPQIGUCOXIIIH-QGZVFWFLSA-N	0	3	332.492	3.065	20	30		EGEDHN
CCCC(=O)NC[C@]12CCC[C@H]1N(Cc1ccc(C#N)s1)CC2	ZINC001107261887	1366908624	/nfs/dbraw/zinc/90/86/24/1366908624.db2.gz	ZKUYGGXXICVPTD-SJLPKXTDSA-N	0	3	331.485	3.281	20	30		EGEDHN
C=CCCC(=O)NC[C@]12CCC[C@H]1N(Cc1cnc(C)s1)CC2	ZINC001107319863	1366926378	/nfs/dbraw/zinc/92/63/78/1366926378.db2.gz	TUUPNSHKNKUOAA-SJLPKXTDSA-N	0	3	333.501	3.279	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@]12CCC[C@H]1N(Cc1cccnc1)CC2	ZINC001107422427	1366959895	/nfs/dbraw/zinc/95/98/95/1366959895.db2.gz	FZKFTECGMOTVQS-UYAOXDASSA-N	0	3	327.472	3.299	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@@H](n2cc(CNCCCCC)nn2)C1	ZINC001185992060	1387843420	/nfs/dbraw/zinc/84/34/20/1387843420.db2.gz	BXPMHHQNUGAGIH-GOSISDBHSA-N	0	3	347.507	3.078	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@]12CCC[C@H]1N(Cc1conc1C)CC2	ZINC001107496979	1366996246	/nfs/dbraw/zinc/99/62/46/1366996246.db2.gz	OTVQWYONVLUODN-YLJYHZDGSA-N	0	3	345.487	3.446	20	30		EGEDHN
C=CCCCC(=O)NC[C@]12CCC[C@H]1N(Cc1cnoc1C)CC2	ZINC001107524395	1367018758	/nfs/dbraw/zinc/01/87/58/1367018758.db2.gz	XPVKPBVTJVLZPY-IEBWSBKVSA-N	0	3	331.460	3.200	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCCc1ccsc1	ZINC001109246385	1367024649	/nfs/dbraw/zinc/02/46/49/1367024649.db2.gz	XPSJEWVOJSKKDG-SQNIBIBYSA-N	0	3	330.497	3.062	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@H](OCC)C1=CCCC1)C2	ZINC001109289734	1367040843	/nfs/dbraw/zinc/04/08/43/1367040843.db2.gz	NGJWSJLCBCIABE-XWSJACJDSA-N	0	3	332.488	3.190	20	30		EGEDHN
C=CCOCCCC(=O)N1CC[C@H](N(C)[C@H](C)c2ccc(F)cc2)C1	ZINC001189526850	1367044535	/nfs/dbraw/zinc/04/45/35/1367044535.db2.gz	KFIWIYQKCJCQPE-APWZRJJASA-N	0	3	348.462	3.402	20	30		EGEDHN
C=CCOCCCC(=O)N1CC[C@@H](N(C)[C@@H](C)c2cccc(F)c2)C1	ZINC001189539258	1367048976	/nfs/dbraw/zinc/04/89/76/1367048976.db2.gz	YSRCLCPZVJTKPY-QFBILLFUSA-N	0	3	348.462	3.402	20	30		EGEDHN
C=CCOCCCC(=O)N1CC[C@H](N(C)Cc2cc(F)ccc2C)C1	ZINC001189565378	1367055821	/nfs/dbraw/zinc/05/58/21/1367055821.db2.gz	QDPGRHIVXASRBB-IBGZPJMESA-N	0	3	348.462	3.150	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](N(C)Cc2cccc(COC)c2)C1	ZINC001189704310	1367090657	/nfs/dbraw/zinc/09/06/57/1367090657.db2.gz	AEUYMBXRZCEFPA-FQEVSTJZSA-N	0	3	342.483	3.059	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cn3cc(C)nc3s1)C2	ZINC001109399281	1367104305	/nfs/dbraw/zinc/10/43/05/1367104305.db2.gz	FEWZPXQMMOCFQO-ILXRZTDVSA-N	0	3	344.484	3.006	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](N(C)[C@@H](C)c2ccc(F)c(F)c2)C1	ZINC001189925984	1367131956	/nfs/dbraw/zinc/13/19/56/1367131956.db2.gz	JLJQFYDBUASGRQ-GOEBONIOSA-N	0	3	334.410	3.362	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)Cc2ccc(C)cc2)C1	ZINC001108058690	1367261217	/nfs/dbraw/zinc/26/12/17/1367261217.db2.gz	FIBBADRSJMDVQH-WIYYLYMNSA-N	0	3	344.499	3.099	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](N(C)Cc2cccc3nsnc32)C1	ZINC001190429171	1367263273	/nfs/dbraw/zinc/26/32/73/1367263273.db2.gz	VYFDXAARRLZEQC-OAHLLOKOSA-N	0	3	344.484	3.080	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)CCC(C)(C)c3ccccc3)[C@@H]2C1	ZINC001190459030	1367270206	/nfs/dbraw/zinc/27/02/06/1367270206.db2.gz	SBYYOLYWOVBWAO-PKOBYXMFSA-N	0	3	326.484	3.463	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@]1(C)CN(C[C@@H](C)CC(C)C)CCO1	ZINC001108114519	1367288114	/nfs/dbraw/zinc/28/81/14/1367288114.db2.gz	FYARAGFPRAYLGY-PXNSSMCTSA-N	0	3	338.536	3.478	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@H](C)c1ccc(CC)cc1)C2	ZINC001109716232	1367290903	/nfs/dbraw/zinc/29/09/03/1367290903.db2.gz	YRVBDNVEMPOYKS-CZGNIMDHSA-N	0	3	338.495	3.487	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCN(C(=O)C(C)(C)CC(F)F)C1	ZINC001190603951	1367304379	/nfs/dbraw/zinc/30/43/79/1367304379.db2.gz	LOTLLGGTUJWYNM-MRXNPFEDSA-N	0	3	349.425	3.272	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCCc1ccc(F)cc1)C2	ZINC001109757388	1367304637	/nfs/dbraw/zinc/30/46/37/1367304637.db2.gz	CDSOQVNWLDYSIU-QYZOEREBSA-N	0	3	330.447	3.446	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)CC2CC(C)(C)C2)C1	ZINC001108156758	1367314828	/nfs/dbraw/zinc/31/48/28/1367314828.db2.gz	JIQGPQNSUHXYGO-OXJNMPFZSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2ccccc2CC)C1	ZINC001108166310	1367319825	/nfs/dbraw/zinc/31/98/25/1367319825.db2.gz	ZDDZNUOYARXQEO-UWJYYQICSA-N	0	3	344.499	3.424	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)Cc2cccc(C)c2)C1	ZINC001108176703	1367325143	/nfs/dbraw/zinc/32/51/43/1367325143.db2.gz	CVFPRMRJITWVMW-RXVVDRJESA-N	0	3	344.499	3.099	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)C2CCC(=C)CC2)C1	ZINC001108186381	1367330374	/nfs/dbraw/zinc/33/03/74/1367330374.db2.gz	OMXIOYACLIURCK-YLJYHZDGSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](c1cccnc1)C(C)C)C2	ZINC001109885541	1367382489	/nfs/dbraw/zinc/38/24/89/1367382489.db2.gz	NGKLHRNLAWZYNL-YDZRNGNQSA-N	0	3	327.472	3.119	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2oc(CC)cc2C)C1	ZINC001108344269	1367401978	/nfs/dbraw/zinc/40/19/78/1367401978.db2.gz	KSBPPANCICUKIX-OXJNMPFZSA-N	0	3	348.487	3.326	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C(C)(C)CC1CCOCC1)C2	ZINC001109917043	1367402972	/nfs/dbraw/zinc/40/29/72/1367402972.db2.gz	KYEBNWQOMZCBCN-SQNIBIBYSA-N	0	3	334.504	3.127	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)[C@H]2CC[C@H](C)CC2)C1	ZINC001108353911	1367406459	/nfs/dbraw/zinc/40/64/59/1367406459.db2.gz	RWBNQJMLFMSIPL-CGBFIWBNSA-N	0	3	336.520	3.375	20	30		EGEDHN
CCCCCCCNC(=O)N1C[C@H]2CN(Cc3cccnc3)C[C@@H]2C1	ZINC001191091890	1367422530	/nfs/dbraw/zinc/42/25/30/1367422530.db2.gz	VVDAYXUXLXIOFT-RTBURBONSA-N	0	3	344.503	3.125	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2ccc(C)cc2C)C1	ZINC001108377107	1367424084	/nfs/dbraw/zinc/42/40/84/1367424084.db2.gz	WYACCONAVQUWFC-GHTZIAJQSA-N	0	3	344.499	3.479	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2cc3ccccc3s2)C1	ZINC001191187626	1367440946	/nfs/dbraw/zinc/44/09/46/1367440946.db2.gz	ASFFQZHZZHWOQZ-MRXNPFEDSA-N	0	3	344.480	3.250	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc3c(s1)CCOC3)C2	ZINC001109992319	1367449371	/nfs/dbraw/zinc/44/93/71/1367449371.db2.gz	UGLZSMZVVSOVOF-PMPSAXMXSA-N	0	3	346.496	3.122	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2c(C)cccc2F)C1	ZINC001108440797	1367458166	/nfs/dbraw/zinc/45/81/66/1367458166.db2.gz	FHPIPJUFDWYJDY-JXFKEZNVSA-N	0	3	348.462	3.310	20	30		EGEDHN
CC[C@H](C#N)Oc1cccc(CNCc2cccc(C(=O)OC)c2)c1	ZINC001325036990	1387879904	/nfs/dbraw/zinc/87/99/04/1387879904.db2.gz	YGPJKYXJTZENCW-GOSISDBHSA-N	0	3	338.407	3.444	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](C)Cc1ccccc1C)C2	ZINC001110174108	1367546024	/nfs/dbraw/zinc/54/60/24/1367546024.db2.gz	MQRSVUIZIMEQEL-LMCOJAPRSA-N	0	3	326.484	3.471	20	30		EGEDHN
C=CCC[C@@H](C)N1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cnc(CC)s1)C2	ZINC001110179981	1367549159	/nfs/dbraw/zinc/54/91/59/1367549159.db2.gz	MXHLZDDEFUGMQA-KBXIAJHMSA-N	0	3	333.501	3.395	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1cc(C)cc(C)c1	ZINC001110182981	1367551539	/nfs/dbraw/zinc/55/15/39/1367551539.db2.gz	HDIGWFYJCAPOKZ-LMCOJAPRSA-N	0	3	342.483	3.116	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](N(C)C[C@H](OC)c2ccccc2)C1	ZINC001191718879	1367568872	/nfs/dbraw/zinc/56/88/72/1367568872.db2.gz	HTECOHKECDDMMQ-ROUUACIJSA-N	0	3	330.472	3.119	20	30		EGEDHN
CC#CCN1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)CC2CC2)C1	ZINC001186157151	1387884419	/nfs/dbraw/zinc/88/44/19/1387884419.db2.gz	UKEIHWZDTYZWPW-UYAOXDASSA-N	0	3	342.458	3.171	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](N(C)CCOc2ccccc2C)C1	ZINC001191726835	1367571373	/nfs/dbraw/zinc/57/13/73/1367571373.db2.gz	CRVHWZXWRLRJJE-KRWDZBQOSA-N	0	3	330.472	3.119	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](N(C)CCOc2c(C)cccc2C)C1	ZINC001191726899	1367571625	/nfs/dbraw/zinc/57/16/25/1367571625.db2.gz	DJCATTYFBCUJSO-GOSISDBHSA-N	0	3	344.499	3.427	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCN(C(=O)CCCC2CC2)C1	ZINC001191858615	1367615724	/nfs/dbraw/zinc/61/57/24/1367615724.db2.gz	BSSQEXQXBBJLJH-IBGZPJMESA-N	0	3	325.456	3.171	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H](N(C)Cc2ccc(OC)cc2)C1	ZINC001191867633	1367619004	/nfs/dbraw/zinc/61/90/04/1367619004.db2.gz	GAFQUVGHFHOMES-FUHWJXTLSA-N	0	3	330.472	3.330	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@@H](N(C)CCc2csc(C)n2)C1	ZINC001191868101	1367620340	/nfs/dbraw/zinc/62/03/40/1367620340.db2.gz	NZOVHPJYZQFNEF-RHSMWYFYSA-N	0	3	335.517	3.129	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@@H](N(C)CCOc2ccc(F)cc2)C1	ZINC001191891325	1367628199	/nfs/dbraw/zinc/62/81/99/1367628199.db2.gz	XTLGCQUKJMIIDL-SJLPKXTDSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCCOc1ccccc1	ZINC001110371765	1367673279	/nfs/dbraw/zinc/67/32/79/1367673279.db2.gz	ZLMWCDWGIYNYON-QRQLOZEOSA-N	0	3	328.456	3.143	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](N(C)Cc2ccc(C)c(OC)c2)C1	ZINC001192093779	1367685984	/nfs/dbraw/zinc/68/59/84/1367685984.db2.gz	NEJSMZJZDOLHOC-SFHVURJKSA-N	0	3	330.472	3.393	20	30		EGEDHN
CC#CCN1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)C(C)(C)C)C1	ZINC001186203425	1387895453	/nfs/dbraw/zinc/89/54/53/1387895453.db2.gz	LNVDBCJEGRNAJU-IEBWSBKVSA-N	0	3	344.474	3.417	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](N(C)CCOc3ccccc3)C2)CCC1	ZINC001192189493	1367711149	/nfs/dbraw/zinc/71/11/49/1367711149.db2.gz	FLWAVCYIPXDYPK-SFHVURJKSA-N	0	3	342.483	3.345	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@H](N(C)C[C@@H]3CC(C)(C)CO3)C2)CC1	ZINC001192217703	1367720525	/nfs/dbraw/zinc/72/05/25/1367720525.db2.gz	HYFVAGOFHIXAMF-IRXDYDNUSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)CC(C2CCC2)C2CCC2)C1	ZINC001192377907	1367767723	/nfs/dbraw/zinc/76/77/23/1367767723.db2.gz	OUSUJPFVULPMMH-LJQANCHMSA-N	0	3	348.531	3.328	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)CC[C@@H](C)c2ccccc2)C1	ZINC001192687792	1367851397	/nfs/dbraw/zinc/85/13/97/1367851397.db2.gz	LTKMWIKFATVKPZ-QUCCMNQESA-N	0	3	344.499	3.306	20	30		EGEDHN
CC(C)C[C@H](C)C(=O)N1CC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001193088171	1367941099	/nfs/dbraw/zinc/94/10/99/1367941099.db2.gz	RVYMQHYKSIBURE-LPHOPBHVSA-N	0	3	327.472	3.273	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2cc(C(C)C)oc2C)C1	ZINC001193205376	1367965712	/nfs/dbraw/zinc/96/57/12/1367965712.db2.gz	SNNCWLCNUFYKKX-MRXNPFEDSA-N	0	3	334.460	3.060	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCc1ccc(C(C)C)cc1)C2	ZINC001110804839	1368001788	/nfs/dbraw/zinc/00/17/88/1368001788.db2.gz	TVAFQWJLZGYXQC-NJYVYQBISA-N	0	3	338.495	3.487	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2ccc(CC(C)C)cc2)C1	ZINC001193921265	1368147754	/nfs/dbraw/zinc/14/77/54/1368147754.db2.gz	JQUMKKFTMXXIQV-HXUWFJFHSA-N	0	3	344.499	3.234	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](C)c1cccc(C)c1)C2	ZINC001111071075	1368151583	/nfs/dbraw/zinc/15/15/83/1368151583.db2.gz	PCXBZNVMADDHAQ-AFYVEPGGSA-N	0	3	342.483	3.023	20	30		EGEDHN
C=C[C@@H](C(=O)N1CC[C@@H](N(C)CCOCCCC)C1)c1ccccc1	ZINC001194182618	1368201239	/nfs/dbraw/zinc/20/12/39/1368201239.db2.gz	BWBUTYCVTRRCFP-WOJBJXKFSA-N	0	3	344.499	3.306	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)[C@@H](CC)c2ccc(F)cc2)C1	ZINC001194324255	1368230907	/nfs/dbraw/zinc/23/09/07/1368230907.db2.gz	BABWFOYCVHYGPI-MOPGFXCFSA-N	0	3	348.462	3.055	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H]1CC[C@H](CC)CC1)C2	ZINC001111299953	1368259646	/nfs/dbraw/zinc/25/96/46/1368259646.db2.gz	ROXYGARZPJYPID-NNIGNNQHSA-N	0	3	334.504	3.127	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCc1c[nH]c3ccccc13)C2	ZINC001111354525	1368271896	/nfs/dbraw/zinc/27/18/96/1368271896.db2.gz	ASOTYZLDIHUCQI-AHRSYUTCSA-N	0	3	337.467	3.398	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](CC=C)Cc1ccccc1)C2	ZINC001111436696	1368306304	/nfs/dbraw/zinc/30/63/04/1368306304.db2.gz	UAJJACMIBYKOIP-BQJUDKOJSA-N	0	3	336.479	3.166	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1cc(C)sc1C	ZINC001111490074	1368320174	/nfs/dbraw/zinc/32/01/74/1368320174.db2.gz	SUKHVCHMHPDWCS-KURKYZTESA-N	0	3	348.512	3.179	20	30		EGEDHN
Cc1cc(C#N)cc(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)c1	ZINC001195437796	1368436802	/nfs/dbraw/zinc/43/68/02/1368436802.db2.gz	XGOFKCOXZXZKRL-FQEVSTJZSA-N	0	3	333.435	3.261	20	30		EGEDHN
C#CCCCC(=O)N1CCCN(CCCOc2ccccc2C)CC1	ZINC001195645342	1368464468	/nfs/dbraw/zinc/46/44/68/1368464468.db2.gz	PWQGIVQLZCVPTB-UHFFFAOYSA-N	0	3	342.483	3.102	20	30		EGEDHN
C#CCN1C[C@@H]2CCC[C@]2(NC(=O)CCc2ccc(C(C)C)cc2)C1	ZINC001111806904	1368473196	/nfs/dbraw/zinc/47/31/96/1368473196.db2.gz	CWQVKMCHANXGTG-UNMCSNQZSA-N	0	3	338.495	3.347	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2c(Cl)n[nH]c2C2CC2)CC1	ZINC001196107831	1368550631	/nfs/dbraw/zinc/55/06/31/1368550631.db2.gz	SUTKIIZQFWELFH-UHFFFAOYSA-N	0	3	336.867	3.055	20	30		EGEDHN
C#CCC1(C(=O)N2CCCN(CCCc3ccccc3)CC2)CCC1	ZINC001196107416	1368550700	/nfs/dbraw/zinc/55/07/00/1368550700.db2.gz	NJXWCRFCAPLELQ-UHFFFAOYSA-N	0	3	338.495	3.347	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2ccc3cc[nH]c3n2)CC1	ZINC001196223564	1368571222	/nfs/dbraw/zinc/57/12/22/1368571222.db2.gz	YEICHXSWMLGMIR-UHFFFAOYSA-N	0	3	340.471	3.457	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cnn(C)c2CC)CC1	ZINC001196408530	1368609445	/nfs/dbraw/zinc/60/94/45/1368609445.db2.gz	ANGJTHGKKWJDPU-UHFFFAOYSA-N	0	3	334.508	3.101	20	30		EGEDHN
C#CCN1C[C@@H]2CCC[C@]2(NC(=O)C[C@H](C)CCc2ccccc2)C1	ZINC001112017656	1368621262	/nfs/dbraw/zinc/62/12/62/1368621262.db2.gz	OFQUZYLRONIUMC-CBQOVEMMSA-N	0	3	338.495	3.249	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)[C@H](CC)CC(C)C)C[C@H]1C(F)(F)F	ZINC001112191439	1368706986	/nfs/dbraw/zinc/70/69/86/1368706986.db2.gz	YWFOBCVNLXSEDX-RBSFLKMASA-N	0	3	332.410	3.061	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)[C@H]2CCCC(C)(C)C2)C[C@H]1C(F)(F)F	ZINC001112213601	1368721765	/nfs/dbraw/zinc/72/17/65/1368721765.db2.gz	POJBIIDTNJZMSJ-RRFJBIMHSA-N	0	3	344.421	3.205	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2ncn(C(C)(C)C)n2)CC1	ZINC001197149892	1368755539	/nfs/dbraw/zinc/75/55/39/1368755539.db2.gz	JWHPUKWIGPJJOO-UHFFFAOYSA-N	0	3	349.523	3.151	20	30		EGEDHN
CCc1cc(C(=O)N(C)CCN(C)Cc2ccccc2)ccc1C#N	ZINC001197293098	1368781688	/nfs/dbraw/zinc/78/16/88/1368781688.db2.gz	UHPAZLOPBNZANJ-UHFFFAOYSA-N	0	3	335.451	3.325	20	30		EGEDHN
C#CCCN1CCCN(C(=O)[C@H](CC(C)C)c2ccccc2)CC1	ZINC001197378746	1368801568	/nfs/dbraw/zinc/80/15/68/1368801568.db2.gz	DQVJBDNWBKYJGX-HXUWFJFHSA-N	0	3	326.484	3.374	20	30		EGEDHN
C=CCC[C@H](C)N1CCCN(C(=O)c2cc3c(s2)CCOC3)CC1	ZINC001197849531	1368911902	/nfs/dbraw/zinc/91/19/02/1368911902.db2.gz	JZCCVINNJNNTET-HNNXBMFYSA-N	0	3	348.512	3.323	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cccnc2OCC)CC1	ZINC001198009873	1368941430	/nfs/dbraw/zinc/94/14/30/1368941430.db2.gz	VHTQCZPDIPLLQS-UHFFFAOYSA-N	0	3	345.487	3.375	20	30		EGEDHN
O=C(CC#Cc1ccccc1)N1CCCN(CC2CC(F)(F)C2)CC1	ZINC001198214579	1368982825	/nfs/dbraw/zinc/98/28/25/1368982825.db2.gz	QZMLURSDHWIHJY-UHFFFAOYSA-N	0	3	346.421	3.008	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N2CCN(CC3CCCC3)CC2)cc1	ZINC001112837533	1369036964	/nfs/dbraw/zinc/03/69/64/1369036964.db2.gz	LKKWBFMBELCVDK-UHFFFAOYSA-N	0	3	340.467	3.037	20	30		EGEDHN
C=CCC[C@H](C)N[C@@H](CNC(=O)C(C)(F)F)c1ccccc1OC	ZINC001198482541	1369042435	/nfs/dbraw/zinc/04/24/35/1369042435.db2.gz	PXVSPASPSOMCOW-ZFWWWQNUSA-N	0	3	340.414	3.452	20	30		EGEDHN
C#CCCCCC(=O)N1CCC([C@H]2CCCN(CCF)CC2)CC1	ZINC001186591160	1387977808	/nfs/dbraw/zinc/97/78/08/1387977808.db2.gz	XKSTYSKHLXWQCJ-SFHVURJKSA-N	0	3	336.495	3.490	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)C1=COCCC1)c1ccccc1OC	ZINC001198606858	1369072189	/nfs/dbraw/zinc/07/21/89/1369072189.db2.gz	WFSOHJHWLYJOEP-SFHVURJKSA-N	0	3	344.455	3.103	20	30		EGEDHN
C=CCOCCCC(=O)NC[C@@H](NCCCC)c1ccccc1OC	ZINC001198635907	1369078559	/nfs/dbraw/zinc/07/85/59/1369078559.db2.gz	ITVQUWOSLGPBRT-GOSISDBHSA-N	0	3	348.487	3.225	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)CCc1ccoc1)c1ccccc1OC	ZINC001198655386	1369083604	/nfs/dbraw/zinc/08/36/04/1369083604.db2.gz	DDBPFLAUYWOSSU-GOSISDBHSA-N	0	3	342.439	3.244	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CCN(CC2CCC(C)CC2)CC1)OCC	ZINC001112906597	1369084705	/nfs/dbraw/zinc/08/47/05/1369084705.db2.gz	JBAIHTHUWJPHIG-ACBHZAAOSA-N	0	3	336.520	3.328	20	30		EGEDHN
COc1ccccc1[C@@H](CNC(=O)C#CC1CC1)NCCC(C)(C)C	ZINC001198723872	1369099694	/nfs/dbraw/zinc/09/96/94/1369099694.db2.gz	LQEUTAVCZGERGQ-GOSISDBHSA-N	0	3	342.483	3.292	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@@H](NC(C)C)c1ccccc1OC	ZINC001198759444	1369106719	/nfs/dbraw/zinc/10/67/19/1369106719.db2.gz	GZCFBJAXINQYKP-QGZVFWFLSA-N	0	3	341.455	3.152	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@H](NCCCCOC)c1ccccc1OC	ZINC001198835627	1369126799	/nfs/dbraw/zinc/12/67/99/1369126799.db2.gz	VBPACUZXXHTMDA-KRWDZBQOSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@H]1CCC1(C)C)c1ccccc1OC	ZINC001198855637	1369130879	/nfs/dbraw/zinc/13/08/79/1369130879.db2.gz	DNWWECYNXCMHCS-SJORKVTESA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)[C@H]1C[C@H]2C[C@H]2C1)c1ccccc1OC	ZINC001198856893	1369130989	/nfs/dbraw/zinc/13/09/89/1369130989.db2.gz	LJQDTLZDHIUQBW-VUHPKUFZSA-N	0	3	342.483	3.454	20	30		EGEDHN
C=CCCCC(=O)NC[C@H](NCCCOCC)c1ccccc1OC	ZINC001198875518	1369135986	/nfs/dbraw/zinc/13/59/86/1369135986.db2.gz	BKJMMZGUZHUEDA-SFHVURJKSA-N	0	3	348.487	3.225	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@H](NCCCOC)c1ccccc1OC	ZINC001198885111	1369139008	/nfs/dbraw/zinc/13/90/08/1369139008.db2.gz	AWUUJKALKDCEER-FXAWDEMLSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)C(C)(C)C(F)F)c1ccccc1OC	ZINC001198893959	1369141945	/nfs/dbraw/zinc/14/19/45/1369141945.db2.gz	CISOIERNLYPKDO-AWEZNQCLSA-N	0	3	340.414	3.310	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)C1(C)CC(=C)C1)c1ccccc1OC	ZINC001198895180	1369142233	/nfs/dbraw/zinc/14/22/33/1369142233.db2.gz	OUZKSCYNMSRPPO-QGZVFWFLSA-N	0	3	328.456	3.375	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)[C@@H](C)CCOC)c1ccccc1OC	ZINC001198994123	1369168572	/nfs/dbraw/zinc/16/85/72/1369168572.db2.gz	UNKJZHWADCEXQB-FUHWJXTLSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)c2cc3ccccc3[nH]c2=O)CC1	ZINC001113174620	1369244825	/nfs/dbraw/zinc/24/48/25/1369244825.db2.gz	SUYHVLHSAIDRHU-HNNXBMFYSA-N	0	3	339.439	3.053	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)CCc2cccc(N(C)C)c2)CC1	ZINC001113248183	1369290685	/nfs/dbraw/zinc/29/06/85/1369290685.db2.gz	UHNRGDSSGYBJNZ-SFHVURJKSA-N	0	3	343.515	3.184	20	30		EGEDHN
C=CCCC(=O)N1CCCO[C@@H](CNCc2cc3ccccc3o2)C1	ZINC001200074412	1369312981	/nfs/dbraw/zinc/31/29/81/1369312981.db2.gz	OCESDOCLZNSEJY-SFHVURJKSA-N	0	3	342.439	3.106	20	30		EGEDHN
C#CCCCC(=O)N1CCC(NCc2nsc3ccccc32)CC1	ZINC001200325182	1369349202	/nfs/dbraw/zinc/34/92/02/1369349202.db2.gz	QAWDUWPPQDZKDJ-UHFFFAOYSA-N	0	3	341.480	3.180	20	30		EGEDHN
CCCC[C@H](C)C(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001200382111	1369358564	/nfs/dbraw/zinc/35/85/64/1369358564.db2.gz	UZCFVIGLNYKRTB-INIZCTEOSA-N	0	3	327.472	3.465	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)Cc2ccc3c(c2)CCC3)CC1	ZINC001113623434	1369525686	/nfs/dbraw/zinc/52/56/86/1369525686.db2.gz	HEMACAXCOULMHE-KRWDZBQOSA-N	0	3	326.484	3.217	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)Cc2ccc3c(c2)CCC3)CC1	ZINC001113623435	1369525895	/nfs/dbraw/zinc/52/58/95/1369525895.db2.gz	HEMACAXCOULMHE-QGZVFWFLSA-N	0	3	326.484	3.217	20	30		EGEDHN
O=C(CC#Cc1ccccc1)N1CCN(C[C@@H]2CC[C@@H]3C[C@@H]3C2)CC1	ZINC001113668628	1369556386	/nfs/dbraw/zinc/55/63/86/1369556386.db2.gz	QWGLBHGHGUPIHR-NJYVYQBISA-N	0	3	336.479	3.009	20	30		EGEDHN
CCCCCCCCN1CC[C@@H](O)[C@H](NC(=O)OC(C)(C)C)C1	ZINC001201825922	1369630012	/nfs/dbraw/zinc/63/00/12/1369630012.db2.gz	IOYCFOHUXTVKHR-HZPDHXFCSA-N	0	3	328.497	3.307	20	30		EGEDHN
CCCCCCCCCN1CCCn2cnc(CNC(C)=O)c2C1	ZINC001201847372	1369633754	/nfs/dbraw/zinc/63/37/54/1369633754.db2.gz	VLDURTSHTFKNMP-UHFFFAOYSA-N	0	3	334.508	3.476	20	30		EGEDHN
CCCCCCCCCCN1CCN(CCN2CCOCC2)CC1	ZINC001201875143	1369637973	/nfs/dbraw/zinc/63/79/73/1369637973.db2.gz	QRRWRIGXTJBKIF-UHFFFAOYSA-N	0	3	339.568	3.077	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001202108618	1369688770	/nfs/dbraw/zinc/68/87/70/1369688770.db2.gz	LVQDGEPRQRSPSE-INIZCTEOSA-N	0	3	325.456	3.241	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC(NCc2nc(C)c(C)s2)CC1	ZINC001202131468	1369696828	/nfs/dbraw/zinc/69/68/28/1369696828.db2.gz	YONBCHZXJYWRNH-HNNXBMFYSA-N	0	3	335.517	3.443	20	30		EGEDHN
C=CCOCC(=O)N[C@@H]1[C@H]2CN([C@@H](CC)c3ccc(Cl)cc3)C[C@H]21	ZINC001114047671	1369701608	/nfs/dbraw/zinc/70/16/08/1369701608.db2.gz	KWTIPIBEZVUFSW-MJQMVNBJSA-N	0	3	348.874	3.040	20	30		EGEDHN
CC#CCNC[C@@H]1CN(C(=O)c2ccc([C@H](C)CC)cc2)CCCO1	ZINC001202174541	1369707599	/nfs/dbraw/zinc/70/75/99/1369707599.db2.gz	VYJZBEWFZZXBBE-YLJYHZDGSA-N	0	3	342.483	3.044	20	30		EGEDHN
C=CCCCC(=O)N1CCC(NCc2nc3ccc(F)cc3o2)CC1	ZINC001202261349	1369724758	/nfs/dbraw/zinc/72/47/58/1369724758.db2.gz	ZCGLHHXYPUHIDG-UHFFFAOYSA-N	0	3	345.418	3.404	20	30		EGEDHN
CC(C)CC(=O)N[C@@H]1C[C@@H](NCC#Cc2ccc(F)cc2)C12CCC2	ZINC001202341043	1369742873	/nfs/dbraw/zinc/74/28/73/1369742873.db2.gz	MAFAIWPFVBQPMF-RTBURBONSA-N	0	3	342.458	3.240	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC(NCc3nc(C)cs3)CC2)CC1	ZINC001202358954	1369749119	/nfs/dbraw/zinc/74/91/19/1369749119.db2.gz	JACGUUITFHCMJT-UHFFFAOYSA-N	0	3	333.501	3.279	20	30		EGEDHN
CC(C)C(=O)N[C@@H]1C[C@@H](NCC#Cc2ccccc2Cl)C12CCC2	ZINC001202458182	1369777519	/nfs/dbraw/zinc/77/75/19/1369777519.db2.gz	BLEHDADESVKWSB-QZTJIDSGSA-N	0	3	344.886	3.365	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C)nc3C)C[C@H]21	ZINC001114336930	1369898835	/nfs/dbraw/zinc/89/88/35/1369898835.db2.gz	XZEUTTAYMXKOQQ-FVQHAEBGSA-N	0	3	347.890	3.024	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1[C@H]2CN([C@@H]3CCc4c3c(F)ccc4F)C[C@H]21	ZINC001114348862	1369905552	/nfs/dbraw/zinc/90/55/52/1369905552.db2.gz	RSLGYADXKMPTBL-QRKDATQKSA-N	0	3	346.421	3.355	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1C[C@@H](NCC=C(Cl)Cl)C12CCC2	ZINC001202846372	1369906689	/nfs/dbraw/zinc/90/66/89/1369906689.db2.gz	KALYOYKTGYQJAT-CHWSQXEVSA-N	0	3	329.271	3.126	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H]1C[C@@H](NCc2cc(F)ccc2F)C12CCC2	ZINC001202867364	1369912182	/nfs/dbraw/zinc/91/21/82/1369912182.db2.gz	QHZRAADQTZTYTA-MSOLQXFVSA-N	0	3	346.421	3.141	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@H]1C[C@H](NCc2ccccn2)C12CCC2	ZINC001202960705	1369937198	/nfs/dbraw/zinc/93/71/98/1369937198.db2.gz	QGQIXFFMLTZJOA-HOTGVXAUSA-N	0	3	347.890	3.377	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1C[C@@H](NCc2c(C)noc2C)C12CCC2	ZINC001202960244	1369937270	/nfs/dbraw/zinc/93/72/70/1369937270.db2.gz	LNXSTOLBDVIAIQ-IAGOWNOFSA-N	0	3	345.487	3.411	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1C[C@@H](NCc2ocnc2C)C12CCC2	ZINC001202969075	1369940709	/nfs/dbraw/zinc/94/07/09/1369940709.db2.gz	NCCLXCHRRZVJEE-HZPDHXFCSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)CCc2ccsc2)C12CCC2	ZINC001203036293	1369962612	/nfs/dbraw/zinc/96/26/12/1369962612.db2.gz	NIIWIFHPKQYTQH-GJZGRUSLSA-N	0	3	338.904	3.450	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1[C@H]2CN(Cc3csc(C)c3)C[C@H]21	ZINC001114687213	1370024914	/nfs/dbraw/zinc/02/49/14/1370024914.db2.gz	ZHQHQYADKJBSPE-DZFIZOCASA-N	0	3	330.497	3.187	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1[C@H]2CN(CCc3ccccc3Cl)C[C@H]21	ZINC001114686678	1370025033	/nfs/dbraw/zinc/02/50/33/1370025033.db2.gz	PZCBVUCFQHLZRY-QLPKVWCKSA-N	0	3	332.875	3.141	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1[C@H]2CN(CCc3ccc(F)c(F)c3)C[C@H]21	ZINC001114722631	1370045863	/nfs/dbraw/zinc/04/58/63/1370045863.db2.gz	LCBDZXZJZHJBNJ-RGPZOAQRSA-N	0	3	348.437	3.156	20	30		EGEDHN
CC#CCCCC(=O)N[C@H]1C[C@@H](NCc2c(C)noc2C)C12CCC2	ZINC001203274294	1370054848	/nfs/dbraw/zinc/05/48/48/1370054848.db2.gz	MYPUSRSMHPHMLL-MSOLQXFVSA-N	0	3	343.471	3.002	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1[C@H]2CN(CCCc3c(F)cccc3F)C[C@H]21	ZINC001114756870	1370064280	/nfs/dbraw/zinc/06/42/80/1370064280.db2.gz	BEYYLACEYHFAOC-IGOJGBNBSA-N	0	3	348.437	3.300	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1C[C@@H](NCc2c(C)onc2CC)C12CCC2	ZINC001203341126	1370089847	/nfs/dbraw/zinc/08/98/47/1370089847.db2.gz	OPFLTNPJEWCHLS-MSOLQXFVSA-N	0	3	345.487	3.419	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2C[C@@H](NCc3ocnc3C)C23CCC3)CC1	ZINC001203375607	1370104683	/nfs/dbraw/zinc/10/46/83/1370104683.db2.gz	RJXVILHQVAJLMM-IAGOWNOFSA-N	0	3	343.471	3.246	20	30		EGEDHN
CCN(C)C(C)(C)C(=O)N[C@H](C)CCCNc1cccc(F)c1C#N	ZINC001115030360	1370224978	/nfs/dbraw/zinc/22/49/78/1370224978.db2.gz	WLMBVGKLTYWBES-CQSZACIVSA-N	0	3	348.466	3.124	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC001203762636	1370254611	/nfs/dbraw/zinc/25/46/11/1370254611.db2.gz	MPPXGNQMXIMMEG-KRWDZBQOSA-N	0	3	329.444	3.437	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)C[C@@H]1CN(Cc2ccccc2)CCO1	ZINC001203763551	1370255353	/nfs/dbraw/zinc/25/53/53/1370255353.db2.gz	BVFUPJPMPPALOG-JOCHJYFZSA-N	0	3	349.478	3.281	20	30		EGEDHN
CC(C)C[C@H](C)CC(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001115107543	1370283335	/nfs/dbraw/zinc/28/33/35/1370283335.db2.gz	DNZBDRZIKMQDJU-XJRBWHPUSA-N	0	3	339.483	3.177	20	30		EGEDHN
C=CCO[C@@H]1CO[C@@]2(C1)CCCN(Cc1ccc(OCC)cc1)C2	ZINC001203967032	1370334056	/nfs/dbraw/zinc/33/40/56/1370334056.db2.gz	AJBAPPOQERBLLX-VQTJNVASSA-N	0	3	331.456	3.411	20	30		EGEDHN
N#Cc1cccc(N2C[C@]3(CCN(Cc4ccsc4)C3)CC2=O)c1	ZINC001204037312	1370355458	/nfs/dbraw/zinc/35/54/58/1370355458.db2.gz	GSDUSIWNZSFLJW-LJQANCHMSA-N	0	3	337.448	3.249	20	30		EGEDHN
C=CCOc1ccc(CN2CC3(C2)CCN(Cc2cccnc2)C3)cc1	ZINC001204299929	1370436582	/nfs/dbraw/zinc/43/65/82/1370436582.db2.gz	HHYCRRFUWDZNLL-UHFFFAOYSA-N	0	3	349.478	3.354	20	30		EGEDHN
CCCc1nc(C)c(CNC2(CNC(=O)[C@@H](C)C#N)CCCCC2)o1	ZINC001115452407	1370460150	/nfs/dbraw/zinc/46/01/50/1370460150.db2.gz	ZSSFHDLKKPJBDO-AWEZNQCLSA-N	0	3	346.475	3.004	20	30		EGEDHN
CC(C)c1cccc(CNC2(CNC(=O)[C@@H](C)C#N)CCCCC2)n1	ZINC001115452291	1370460378	/nfs/dbraw/zinc/46/03/78/1370460378.db2.gz	WHDYIUIWQMYVLE-INIZCTEOSA-N	0	3	342.487	3.273	20	30		EGEDHN
O=C1C=C2CN(Cc3ccccc3OC(F)(F)F)CCC2S1	ZINC001204424353	1370473324	/nfs/dbraw/zinc/47/33/24/1370473324.db2.gz	GYHUNOIERCCLNN-ZDUSSCGKSA-N	0	3	329.343	3.359	20	30		EGEDHN
Cc1nn(-c2ccccc2)c(C)c1CN1CCC2SC(=O)C=C2C1	ZINC001204446965	1370479217	/nfs/dbraw/zinc/47/92/17/1370479217.db2.gz	YJAYMEXJNFVUES-SFHVURJKSA-N	0	3	339.464	3.263	20	30		EGEDHN
Cc1[nH]ccc1C(=O)NCC1(NCC#Cc2ccccc2)CCCCC1	ZINC001115473443	1370479417	/nfs/dbraw/zinc/47/94/17/1370479417.db2.gz	ZCURLIHVMVKLDZ-UHFFFAOYSA-N	0	3	349.478	3.397	20	30		EGEDHN
C#CCCCC(=O)NCC1(NCc2cc(C)ns2)CCCCC1	ZINC001115506270	1370506206	/nfs/dbraw/zinc/50/62/06/1370506206.db2.gz	AVDDZAAFMYJDJO-UHFFFAOYSA-N	0	3	333.501	3.164	20	30		EGEDHN
COc1cc(Nc2cccc(CN3CCN(C)CC3)c2)ccc1C#N	ZINC001204564101	1370517044	/nfs/dbraw/zinc/51/70/44/1370517044.db2.gz	IHTZHZDLLFJAAP-UHFFFAOYSA-N	0	3	336.439	3.058	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H](C)[C@H](C)COC)CCCCC1	ZINC001115567531	1370568202	/nfs/dbraw/zinc/56/82/02/1370568202.db2.gz	KRSHONUVQYEKNF-UKRRQHHQSA-N	0	3	330.900	3.066	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CCc2cccnc2)CCCCC1	ZINC001115617465	1370614188	/nfs/dbraw/zinc/61/41/88/1370614188.db2.gz	XRONEJNYKUQAEL-UHFFFAOYSA-N	0	3	335.879	3.175	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cncc(CC)c2)CCCCC1	ZINC001115630206	1370623319	/nfs/dbraw/zinc/62/33/19/1370623319.db2.gz	FCRAZLTYPGBKAB-UHFFFAOYSA-N	0	3	335.879	3.419	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)CCCF)CCCCC1	ZINC001115671090	1370652851	/nfs/dbraw/zinc/65/28/51/1370652851.db2.gz	SMDYBHCOUBDACP-UHFFFAOYSA-N	0	3	335.261	3.053	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)NCC1(NCC#Cc2ccccc2)CCCCC1	ZINC001115679281	1370661541	/nfs/dbraw/zinc/66/15/41/1370661541.db2.gz	ZHHRIGBXTZIIDW-LJQANCHMSA-N	0	3	344.474	3.441	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCC1(NCc2cnc(C)cn2)CCCCC1	ZINC001115679655	1370662609	/nfs/dbraw/zinc/66/26/09/1370662609.db2.gz	LTBIDSRZPPBYFQ-DOTOQJQBSA-N	0	3	344.503	3.152	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCC1(NCc2cnoc2C)CCCCC1	ZINC001115680226	1370663709	/nfs/dbraw/zinc/66/37/09/1370663709.db2.gz	WBMNRRAUUKMWOZ-GJZGRUSLSA-N	0	3	333.476	3.350	20	30		EGEDHN
CC/C(C)=C/C(=O)N1CCC(CNCc2ccccc2C#N)CC1	ZINC001205202123	1370677746	/nfs/dbraw/zinc/67/77/46/1370677746.db2.gz	BTHRAUPBYQVCAH-FOWTUZBSSA-N	0	3	325.456	3.243	20	30		EGEDHN
CN(C)Cc1ccc(C(=O)Nc2ccc(C#N)c3ncccc23)cc1	ZINC001187294994	1388090371	/nfs/dbraw/zinc/09/03/71/1388090371.db2.gz	IPLLDGPQYOQFSU-UHFFFAOYSA-N	0	3	330.391	3.420	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)NCC1(NCC#Cc2ccccc2)CCCCC1	ZINC001115738889	1370720256	/nfs/dbraw/zinc/72/02/56/1370720256.db2.gz	IIJTUSDCJCAZCP-WOJBJXKFSA-N	0	3	338.495	3.493	20	30		EGEDHN
O=C(NCC1(NCC#Cc2ccccc2)CCCCC1)[C@@H]1CC12CC2	ZINC001115747537	1370728205	/nfs/dbraw/zinc/72/82/05/1370728205.db2.gz	PZNJDKQNNAYJEP-IBGZPJMESA-N	0	3	336.479	3.247	20	30		EGEDHN
C=CCN(CC=C)CCN1CCN(Cc2sccc2Cl)CC1	ZINC001205353721	1370730434	/nfs/dbraw/zinc/73/04/34/1370730434.db2.gz	IAAUCWZZFSZOEN-UHFFFAOYSA-N	0	3	339.936	3.193	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C=C(CC)CC)C[C@H]1c1cccc(F)c1	ZINC001205398307	1370743890	/nfs/dbraw/zinc/74/38/90/1370743890.db2.gz	DLLKZLBQPFHOIW-VQTJNVASSA-N	0	3	342.458	3.479	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C2(F)CCCC2)C[C@H]1c1cccc(F)c1	ZINC001205417198	1370748622	/nfs/dbraw/zinc/74/86/22/1370748622.db2.gz	UHMHHJCNDXDKDC-ZWKOTPCHSA-N	0	3	346.421	3.015	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)CCCC2CC2)C[C@H]1c1cccc(F)c1	ZINC001205428709	1370752356	/nfs/dbraw/zinc/75/23/56/1370752356.db2.gz	IYVPQXSRBCOQBI-VQTJNVASSA-N	0	3	342.458	3.313	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H](c2cccc(F)c2)[C@H](NCC#CC)C1	ZINC001205432076	1370753263	/nfs/dbraw/zinc/75/32/63/1370753263.db2.gz	BDHHMOGNVMECES-QKNQBKEWSA-N	0	3	342.458	3.335	20	30		EGEDHN
C=C(CN1CCCC1)c1nc(-c2ncc(C)cc2Br)no1	ZINC001206100907	1370960373	/nfs/dbraw/zinc/96/03/73/1370960373.db2.gz	YASKYUWUUOPKFM-UHFFFAOYSA-N	0	3	349.232	3.312	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC(CN[C@@H](C)c3cnccn3)CC2)CC1	ZINC001206181775	1370983112	/nfs/dbraw/zinc/98/31/12/1370983112.db2.gz	RFPLHIAHUJYFFF-INIZCTEOSA-N	0	3	342.487	3.112	20	30		EGEDHN
C[C@@H]1CN(CCCc2ccccc2Cl)C[C@H]1NC(=O)C#CC1CC1	ZINC001206948425	1371241161	/nfs/dbraw/zinc/24/11/61/1371241161.db2.gz	JXJOSNQPDYEVEP-DNVCBOLYSA-N	0	3	344.886	3.123	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H]2CN(Cc3csc(C)c3)C[C@H]21	ZINC001187591112	1388128854	/nfs/dbraw/zinc/12/88/54/1388128854.db2.gz	BILZEERZDDWITL-ZWKOTPCHSA-N	0	3	330.497	3.283	20	30		EGEDHN
COc1ccc(CCCN2CCN(c3cccc(C#N)c3)CC2)cc1	ZINC001207585870	1371443223	/nfs/dbraw/zinc/44/32/23/1371443223.db2.gz	QZMGOZWHRRUMHT-UHFFFAOYSA-N	0	3	335.451	3.322	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207653117	1371464691	/nfs/dbraw/zinc/46/46/91/1371464691.db2.gz	DGCRGKUOPNOQCH-GOSISDBHSA-N	0	3	330.859	3.238	20	30		EGEDHN
CCOC(=O)C1(C#N)CCN(CC[C@H](C)CCCC(C)(C)O)CC1	ZINC001207684348	1371474018	/nfs/dbraw/zinc/47/40/18/1371474018.db2.gz	ZWLKXSWVXXVOEZ-MRXNPFEDSA-N	0	3	338.492	3.123	20	30		EGEDHN
CC(C)(C)/C=C/C(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207710832	1371481513	/nfs/dbraw/zinc/48/15/13/1371481513.db2.gz	SHEMPHAOVJMBEJ-JXOMPUQVSA-N	0	3	342.458	3.360	20	30		EGEDHN
CC1CC(C(=O)N2CCC[C@@H](NCC#Cc3ccccc3Cl)C2)C1	ZINC001207783247	1371501996	/nfs/dbraw/zinc/50/19/96/1371501996.db2.gz	XRNDCEKAGRMBIX-VMWRSERWSA-N	0	3	344.886	3.318	20	30		EGEDHN
O=C(C(F)=C1CCCC1)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001207801535	1371508616	/nfs/dbraw/zinc/50/86/16/1371508616.db2.gz	SUERBIWVGLAYIK-LJQANCHMSA-N	0	3	340.442	3.416	20	30		EGEDHN
C=CCOCc1nn(C)c2c1CN(C[C@H](C)c1ccccc1)CC2	ZINC001207907711	1371534724	/nfs/dbraw/zinc/53/47/24/1371534724.db2.gz	WGADJEUGYWJJJP-INIZCTEOSA-N	0	3	325.456	3.285	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H]([C@@H]2CCCN2Cc2ccns2)C1	ZINC001120382765	1371555221	/nfs/dbraw/zinc/55/52/21/1371555221.db2.gz	RERHUTPECZVOFH-WMZOPIPTSA-N	0	3	345.512	3.150	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001208212621	1371653163	/nfs/dbraw/zinc/65/31/63/1371653163.db2.gz	KPUWIKXPESADHO-IBGZPJMESA-N	0	3	326.484	3.301	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CN([C@@H](C)c2cccc(OC)c2)C[C@H]1C	ZINC001208374567	1371741260	/nfs/dbraw/zinc/74/12/60/1371741260.db2.gz	NFPPKDAQJKETJE-FUHIMQAGSA-N	0	3	342.483	3.386	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1CN(Cc2ccc(COC)cc2)C[C@H]1C	ZINC001208393879	1371751669	/nfs/dbraw/zinc/75/16/69/1371751669.db2.gz	YYZRJLFZMRRTBE-MBOZVWFJSA-N	0	3	344.499	3.372	20	30		EGEDHN
C=C(Br)CNC1CC2(C1)CC(NC(=O)C(F)=C(C)C)C2	ZINC001120942235	1371817989	/nfs/dbraw/zinc/81/79/89/1371817989.db2.gz	MYFZLCIARZGDIY-UHFFFAOYSA-N	0	3	345.256	3.175	20	30		EGEDHN
Cc1cnc(CNC2CC3(C2)CC(NC(=O)C#CC(C)(C)C)C3)s1	ZINC001121091500	1371852195	/nfs/dbraw/zinc/85/21/95/1371852195.db2.gz	HUQRABONJPFBJV-UHFFFAOYSA-N	0	3	345.512	3.018	20	30		EGEDHN
COc1ccccc1CN1CCN(CCCc2ccc(C#N)cc2)CC1	ZINC001208856188	1371920423	/nfs/dbraw/zinc/92/04/23/1371920423.db2.gz	CJARWYGIZBVIJW-UHFFFAOYSA-N	0	3	349.478	3.317	20	30		EGEDHN
N#Cc1ccc(CCCN2CCN(c3ccc(C#N)cc3)CC2)cc1	ZINC001208857412	1371920868	/nfs/dbraw/zinc/92/08/68/1371920868.db2.gz	DPOAKOYTIFEJDD-UHFFFAOYSA-N	0	3	330.435	3.185	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001208962678	1371963854	/nfs/dbraw/zinc/96/38/54/1371963854.db2.gz	OXDPWMMSOFVULY-GOSISDBHSA-N	0	3	344.886	3.484	20	30		EGEDHN
CC[C@H](F)C(=O)N1CCC[C@@H](NCC#Cc2ccccc2Cl)C1	ZINC001209017399	1371976224	/nfs/dbraw/zinc/97/62/24/1371976224.db2.gz	KYOFJMQQUATCMS-WBVHZDCISA-N	0	3	336.838	3.020	20	30		EGEDHN
C[C@@]1(C(=O)N2CCC[C@H](NCC#Cc3ccc(F)cc3)C2)C=CCC1	ZINC001209040653	1371980670	/nfs/dbraw/zinc/98/06/70/1371980670.db2.gz	XNPGWDCLTGYPFV-PZJWPPBQSA-N	0	3	340.442	3.114	20	30		EGEDHN
O=C(CCCF)N1CCC[C@@H](NCC#Cc2ccccc2Cl)C1	ZINC001209071108	1371989662	/nfs/dbraw/zinc/98/96/62/1371989662.db2.gz	BFAWZQQELWBAPP-MRXNPFEDSA-N	0	3	336.838	3.022	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@H](NCc2cccc(C(C)C)n2)C1	ZINC001209112862	1372001342	/nfs/dbraw/zinc/00/13/42/1372001342.db2.gz	WRXGFONRNUBHMP-IBGZPJMESA-N	0	3	341.499	3.479	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@H](NCc2c(C)nsc2C)C1	ZINC001209147141	1372014745	/nfs/dbraw/zinc/01/47/45/1372014745.db2.gz	SUZLUWVKFXQHKQ-XJKSGUPXSA-N	0	3	335.517	3.443	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@@H](NCc2c(C)nsc2C)C1	ZINC001209146965	1372015073	/nfs/dbraw/zinc/01/50/73/1372015073.db2.gz	SKPMDXWZUWINBM-MRXNPFEDSA-N	0	3	333.501	3.034	20	30		EGEDHN
C=CC1(CC(=O)N[C@@H]2CN(CCOCC3CC3)C[C@H]2C)CCCCC1	ZINC001209406807	1372096958	/nfs/dbraw/zinc/09/69/58/1372096958.db2.gz	UYOCCFXSBIKQJN-IEBWSBKVSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=CCCCCCN1CCO[C@H]2[C@H](OCCCn3cccn3)CC[C@@H]21	ZINC001209427596	1372104013	/nfs/dbraw/zinc/10/40/13/1372104013.db2.gz	UXXZCZJRGGVZBN-XUVXKRRUSA-N	0	3	347.503	3.268	20	30		EGEDHN
C=CCCCCCCN1CCN(C(=O)OC(C)(C)C)C[C@@H](O)C1	ZINC001209431094	1372104452	/nfs/dbraw/zinc/10/44/52/1372104452.db2.gz	HFGWIDRRSDBVIN-INIZCTEOSA-N	0	3	326.481	3.037	20	30		EGEDHN
C=CCOC(=O)N1CCCC2(CCN(Cc3ccc(C)[nH]3)CC2)C1	ZINC001209566433	1372138512	/nfs/dbraw/zinc/13/85/12/1372138512.db2.gz	LXMORRWWUHWQDY-UHFFFAOYSA-N	0	3	331.460	3.324	20	30		EGEDHN
N#Cc1ccc(C2CCN(C(=O)[C@@H]3CNCc4ccccc43)CC2)cc1	ZINC001122278697	1372219363	/nfs/dbraw/zinc/21/93/63/1372219363.db2.gz	XKXWQGXVOKEYCT-OAQYLSRUSA-N	0	3	345.446	3.151	20	30		EGEDHN
C=CC1(CC(=O)N2CCC[C@@H](NCc3cnn(C)c3)C2)CCCCC1	ZINC001210106871	1372272731	/nfs/dbraw/zinc/27/27/31/1372272731.db2.gz	LHNPPSRYEGHITN-GOSISDBHSA-N	0	3	344.503	3.027	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CCCN(C)C2)nnc1N1CC[C@H](C)[C@@H]1CC	ZINC001122631300	1372288053	/nfs/dbraw/zinc/28/80/53/1372288053.db2.gz	PSUILXLYMTZXIE-ULQDDVLXSA-N	0	3	331.508	3.288	20	30		EGEDHN
CC(C)C[C@@H](C)C(=O)N1CCC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001210358884	1372331974	/nfs/dbraw/zinc/33/19/74/1372331974.db2.gz	QISCAOBNXNPUNO-QAPCUYQASA-N	0	3	345.462	3.460	20	30		EGEDHN
Cn1c(Cl)cnc1C(C#N)C(=O)CCCOc1ccc(F)cc1	ZINC001123232868	1372403232	/nfs/dbraw/zinc/40/32/32/1372403232.db2.gz	CYPGAYXZNKODQZ-ZDUSSCGKSA-N	0	3	335.766	3.248	20	30		EGEDHN
N#CC(C(=O)CCCn1cccn1)c1nc2c(cccc2Cl)[nH]1	ZINC001123247405	1372406904	/nfs/dbraw/zinc/40/69/04/1372406904.db2.gz	KNDUUJJLGNVMHJ-LLVKDONJSA-N	0	3	327.775	3.069	20	30		EGEDHN
CCCCCCCCC(=O)N1CCC[C@H](NCc2cnn(C)c2)C1	ZINC001210803942	1372429908	/nfs/dbraw/zinc/42/99/08/1372429908.db2.gz	CJCYVQQFWHYGDN-SFHVURJKSA-N	0	3	334.508	3.251	20	30		EGEDHN
Cn1c(Cl)cnc1C(C#N)C(=O)CCCOCc1ccccc1	ZINC001123336553	1372430642	/nfs/dbraw/zinc/43/06/42/1372430642.db2.gz	IPYLDWBMEJWOTN-CQSZACIVSA-N	0	3	331.803	3.247	20	30		EGEDHN
O=C(CCc1ccccc1)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001210823966	1372433567	/nfs/dbraw/zinc/43/35/67/1372433567.db2.gz	HGZWVZSJIUQYNZ-JOCHJYFZSA-N	0	3	346.474	3.252	20	30		EGEDHN
C#CCC1(C(=O)N2CCC[C@H](NCc3ccccn3)C2)CCCCC1	ZINC001211360297	1372540042	/nfs/dbraw/zinc/54/00/42/1372540042.db2.gz	IFHYDXYTHFVCFQ-IBGZPJMESA-N	0	3	339.483	3.136	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N[C@@H]1CN(Cc2ccc(CCC)cc2)C[C@H]1C	ZINC001211426105	1372556689	/nfs/dbraw/zinc/55/66/89/1372556689.db2.gz	ZBFQAENMDKFIPE-FUHIMQAGSA-N	0	3	344.499	3.167	20	30		EGEDHN
C=C(CN1CCCCC1)c1nc(-c2ccc3c(c2)OCCO3)no1	ZINC001211436461	1372558822	/nfs/dbraw/zinc/55/88/22/1372558822.db2.gz	MGKCDNZZUBVRDT-UHFFFAOYSA-N	0	3	327.384	3.007	20	30		EGEDHN
C=CCCCN1C[C@@H](C)[C@H](NC(=O)c2cnc(CC(C)C)s2)C1	ZINC001211456574	1372562478	/nfs/dbraw/zinc/56/24/78/1372562478.db2.gz	IMNAXXJRQIIOHY-HUUCEWRRSA-N	0	3	335.517	3.358	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](c2ccccc2)[C@H](NC[C@H](F)CC)C1	ZINC001211590870	1372586960	/nfs/dbraw/zinc/58/69/60/1372586960.db2.gz	WHNLIACUEKYJAH-CEXWTWQISA-N	0	3	330.447	3.122	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2cc(C)cs2)C[C@H]1c1ccccc1	ZINC001211593066	1372586999	/nfs/dbraw/zinc/58/69/99/1372586999.db2.gz	LWKVJCJJOSWQHA-ZWKOTPCHSA-N	0	3	338.476	3.278	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@](C)(F)CCCC)C[C@H]1c1ccccc1	ZINC001211625941	1372592620	/nfs/dbraw/zinc/59/26/20/1372592620.db2.gz	ZMSPPQVUXPWBFF-NLWGTHIKSA-N	0	3	330.447	3.122	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H](C)CC(C)(C)C)C[C@H]1c1ccccc1	ZINC001211683778	1372602013	/nfs/dbraw/zinc/60/20/13/1372602013.db2.gz	AVEAAILOYJZEPB-NZSAHSFTSA-N	0	3	326.484	3.276	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)Cc2ccccc2C)C[C@H]1c1ccccc1	ZINC001211720815	1372607678	/nfs/dbraw/zinc/60/76/78/1372607678.db2.gz	QAUYRMJSAAUBOP-FCHUYYIVSA-N	0	3	346.474	3.145	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)C(=O)N1CC[C@@H](NC/C=C/Cl)C1	ZINC001188009152	1388211856	/nfs/dbraw/zinc/21/18/56/1388211856.db2.gz	FBQQQUUWCOWEEE-GCYIJFDNSA-N	0	3	332.875	3.364	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)C(F)=C2CCCC2)[C@H](OC)C1	ZINC001212114682	1372659535	/nfs/dbraw/zinc/65/95/35/1372659535.db2.gz	BEOBFOVBINWOFZ-IAGOWNOFSA-N	0	3	338.467	3.346	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)C2=CCCCCC2)[C@H](OC)C1	ZINC001212163743	1372665911	/nfs/dbraw/zinc/66/59/11/1372665911.db2.gz	JEQHCFRENQFXNA-RTBURBONSA-N	0	3	334.504	3.439	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)C2(CC(C)C)CC2)[C@H](OC)C1	ZINC001212390901	1372699076	/nfs/dbraw/zinc/69/90/76/1372699076.db2.gz	HWHDUKVQFPSIMF-QZTJIDSGSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CN([C@H]2CCc3ccccc32)C[C@H]1OC	ZINC001213260711	1372870396	/nfs/dbraw/zinc/87/03/96/1372870396.db2.gz	PZFKQXVOBNEPSH-CEXWTWQISA-N	0	3	342.483	3.092	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1CN(CCCC2CCCC2)C[C@H]1OC	ZINC001213322421	1372884239	/nfs/dbraw/zinc/88/42/39/1372884239.db2.gz	IUCDBXIWKUOULV-QXAKKESOSA-N	0	3	336.520	3.375	20	30		EGEDHN
CCCN1CCc2c(N)sc(Nc3ccc(C#N)cc3N)c2C1	ZINC001213355706	1372890513	/nfs/dbraw/zinc/89/05/13/1372890513.db2.gz	QPZWNLDVNYBUPS-UHFFFAOYSA-N	0	3	327.457	3.296	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2cc(C)cc(F)c2)[C@H](OC)C1	ZINC001213477740	1372911261	/nfs/dbraw/zinc/91/12/61/1372911261.db2.gz	YLSMGIVBYZZOGV-RTBURBONSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)[C@@H](CC)CC2CCCCC2)[C@H](OC)C1	ZINC001213525247	1372919853	/nfs/dbraw/zinc/91/98/53/1372919853.db2.gz	XLIBRSZSBUXSQN-IPMKNSEASA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2cccc(C(C)C)c2)[C@H](OC)C1	ZINC001213669664	1372943028	/nfs/dbraw/zinc/94/30/28/1372943028.db2.gz	LWFYHSFGAWFMBI-RTBURBONSA-N	0	3	330.472	3.205	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2cccn2C(C)C)[C@H](OC)C1	ZINC001213861178	1372972069	/nfs/dbraw/zinc/97/20/69/1372972069.db2.gz	IREFXEQBSFKEII-IEBWSBKVSA-N	0	3	349.519	3.468	20	30		EGEDHN
CCC[C@@H](C)CC(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2)C1	ZINC001214297650	1373040249	/nfs/dbraw/zinc/04/02/49/1373040249.db2.gz	ZWPPRFPSFMRQCP-QWFCFKBJSA-N	0	3	326.484	3.301	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@@H]2CC2(C)C)C[C@H]1NCC#Cc1ccccc1Cl	ZINC001214445422	1373062757	/nfs/dbraw/zinc/06/27/57/1373062757.db2.gz	BUXBZLJJVDONDE-UWWQBHOKSA-N	0	3	344.886	3.174	20	30		EGEDHN
CC[C@H](C)CC(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001214516735	1373072304	/nfs/dbraw/zinc/07/23/04/1373072304.db2.gz	YTYBLQJDBUFLAB-FRQCXROJSA-N	0	3	330.447	3.050	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CC(C)(C)C2)C[C@H]1NCC#Cc1ccc(F)cc1	ZINC001214545944	1373077650	/nfs/dbraw/zinc/07/76/50/1373077650.db2.gz	SBRPHJPIRAECQR-DNVCBOLYSA-N	0	3	342.458	3.050	20	30		EGEDHN
CCCC[C@@H](C)C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001214551002	1373078940	/nfs/dbraw/zinc/07/89/40/1373078940.db2.gz	YOMVXTFGLADZJH-CKEIUWERSA-N	0	3	333.501	3.383	20	30		EGEDHN
CCCC[C@@H](C)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2)C1	ZINC001214550416	1373079051	/nfs/dbraw/zinc/07/90/51/1373079051.db2.gz	FSIRZBRBFKUYLD-QWFCFKBJSA-N	0	3	326.484	3.301	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@@H](C)[C@H](NCc2cc(Cl)ccc2F)C1	ZINC001214582288	1373085135	/nfs/dbraw/zinc/08/51/35/1373085135.db2.gz	NARROFBHWLFPGM-CXAGYDPISA-N	0	3	336.838	3.075	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](C)[C@H](NCc2ccnc(Cl)c2)C1	ZINC001214727757	1373110537	/nfs/dbraw/zinc/11/05/37/1373110537.db2.gz	QLDUNQOZEXJFQI-UKRRQHHQSA-N	0	3	335.879	3.274	20	30		EGEDHN
CCCC[C@](C)(F)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2)C1	ZINC001215007966	1373155323	/nfs/dbraw/zinc/15/53/23/1373155323.db2.gz	BRUVCSSKTJWGQE-QFUCXCTJSA-N	0	3	344.474	3.393	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](C)[C@H](NCc2c(C)nsc2C)C1	ZINC001215367174	1373203578	/nfs/dbraw/zinc/20/35/78/1373203578.db2.gz	GTKPUHCBHRAVFX-OGHNNQOOSA-N	0	3	335.517	3.299	20	30		EGEDHN
CC(C)CCCC(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2)C1	ZINC001215633547	1373221413	/nfs/dbraw/zinc/22/14/13/1373221413.db2.gz	FGWFMMFPJUMWFE-UYAOXDASSA-N	0	3	326.484	3.301	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCNCc1ccc(Br)s1	ZINC001128264469	1373243101	/nfs/dbraw/zinc/24/31/01/1373243101.db2.gz	ROPSYAKEYXKSLB-UHFFFAOYSA-N	0	3	345.306	3.319	20	30		EGEDHN
CC(C)C[C@@H](C)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2)C1	ZINC001216099797	1373263293	/nfs/dbraw/zinc/26/32/93/1373263293.db2.gz	ZULXWQCETNGEBS-QWFCFKBJSA-N	0	3	326.484	3.157	20	30		EGEDHN
C=C(C)CCC(=O)NCCNCc1csc(Br)c1	ZINC001128418708	1373264547	/nfs/dbraw/zinc/26/45/47/1373264547.db2.gz	RVKMXBNBBVMXJX-UHFFFAOYSA-N	0	3	331.279	3.073	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)/C=C/C(C)(C)C)[C@H]2C1	ZINC001217572844	1373465558	/nfs/dbraw/zinc/46/55/58/1373465558.db2.gz	FASPRZIFTXDUNY-WFJXPABVSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)CCCCC(C)(C)C)[C@H]2C1	ZINC001217976606	1373523075	/nfs/dbraw/zinc/52/30/75/1373523075.db2.gz	OLJWYBQRQAAPJM-ZWKOTPCHSA-N	0	3	336.520	3.471	20	30		EGEDHN
COc1ccc(/C=C\C(=O)c2ccccc2O[C@@H]2CNC[C@@H]2F)cc1	ZINC001217998888	1373531186	/nfs/dbraw/zinc/53/11/86/1373531186.db2.gz	BKZLICAJXIYIST-XTIRWZRGSA-N	0	3	341.382	3.280	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)[C@H](C)CC2CCCC2)C1	ZINC001130430970	1373536259	/nfs/dbraw/zinc/53/62/59/1373536259.db2.gz	NLTRCCVXMAIETB-NVXWUHKLSA-N	0	3	344.503	3.218	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)C[C@H](CC)C(C)C)C1	ZINC001130443199	1373543274	/nfs/dbraw/zinc/54/32/74/1373543274.db2.gz	RJOZEZBRNIWYKJ-JKSUJKDBSA-N	0	3	332.492	3.074	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)CC2CC(c3ccccc3)C2)cc1	ZINC001130573461	1373563950	/nfs/dbraw/zinc/56/39/50/1373563950.db2.gz	PPBCONQOTSDPLW-UHFFFAOYSA-N	0	3	347.462	3.348	20	30		EGEDHN
O=C(/C=C/c1ccccc1)c1ccccc1O[C@@H]1CC[C@@H]2NCCO[C@@H]12	ZINC001218128094	1373566499	/nfs/dbraw/zinc/56/64/99/1373566499.db2.gz	ZYGZZKJNPQLXTK-FQTYGPBGSA-N	0	3	349.430	3.481	20	30		EGEDHN
CC(C)c1cccc(CC(=O)NCCNCc2ccc(C#N)s2)c1	ZINC001130827433	1373596210	/nfs/dbraw/zinc/59/62/10/1373596210.db2.gz	FFUAQYNGWHYLBA-UHFFFAOYSA-N	0	3	341.480	3.192	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)c2cc(Cl)ccc2F)ccc1F	ZINC001131029092	1373627544	/nfs/dbraw/zinc/62/75/44/1373627544.db2.gz	AKOHCSJKZVEWLR-UHFFFAOYSA-N	0	3	349.768	3.009	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)CC3CC(C)(C)C3)[C@H]2C1	ZINC001218517583	1373628722	/nfs/dbraw/zinc/62/87/22/1373628722.db2.gz	NCQUATINEDFUBW-RBUKOAKNSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCO[C@@H]2CN(CCCC3CCC3)C[C@@H]21	ZINC001218522495	1373630161	/nfs/dbraw/zinc/63/01/61/1373630161.db2.gz	AGICMOXDJWGOLT-NZSAHSFTSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C1CCC(C(=O)N2CCO[C@@H]3CN(CC/C=C\CC)C[C@@H]32)CC1	ZINC001218591053	1373634584	/nfs/dbraw/zinc/63/45/84/1373634584.db2.gz	TVBUOGMRHYLRNR-WFRZBGSESA-N	0	3	332.488	3.001	20	30		EGEDHN
CCCc1ccccc1C(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001131120837	1373646122	/nfs/dbraw/zinc/64/61/22/1373646122.db2.gz	YOJUPRWBLFPJRQ-UHFFFAOYSA-N	0	3	339.414	3.169	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2OCCN(C(=O)c3cc(C)c(C)s3)[C@H]2C1	ZINC001219022985	1373680405	/nfs/dbraw/zinc/68/04/05/1373680405.db2.gz	CRPUFRXSJIXBEP-BHYGNILZSA-N	0	3	348.512	3.245	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)C(CC(C)C)CC(C)C)[C@H]2C1	ZINC001219058781	1373684585	/nfs/dbraw/zinc/68/45/85/1373684585.db2.gz	KYWCHIFBAIABSA-RBUKOAKNSA-N	0	3	336.520	3.183	20	30		EGEDHN
C=C[C@@H]1C[C@]1(N)C(=O)Nc1cc(OC(C)C)cc(C(F)(F)F)c1	ZINC001219172228	1373691401	/nfs/dbraw/zinc/69/14/01/1373691401.db2.gz	IESQQIZBOSCUCM-MEBBXXQBSA-N	0	3	328.334	3.335	20	30		EGEDHN
C=C[C@@H]1C[C@]1(N)C(=O)Nc1cc(F)cc2c1-c1ccc(F)cc1C2	ZINC001219548107	1373715827	/nfs/dbraw/zinc/71/58/27/1373715827.db2.gz	LCHWTBZOBWUEMK-CWTRNNRKSA-N	0	3	326.346	3.378	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@H](C)O[C@]2(CCN(Cc3ccccc3)C2)C1	ZINC001131666766	1373752138	/nfs/dbraw/zinc/75/21/38/1373752138.db2.gz	RQNOMGXRHFFNKP-RXVVDRJESA-N	0	3	342.483	3.235	20	30		EGEDHN
Cc1cc(C)cc(CN2C[C@@H](NC(=O)CSCC#N)CC[C@H]2C)c1	ZINC001131831291	1373828662	/nfs/dbraw/zinc/82/86/62/1373828662.db2.gz	ZEOLYFPTHMBVTP-AEFFLSMTSA-N	0	3	345.512	3.029	20	30		EGEDHN
C[C@]1(NC(=O)c2csc(C#N)c2)CCN(Cc2ccccc2)C1	ZINC001326728972	1388292412	/nfs/dbraw/zinc/29/24/12/1388292412.db2.gz	SBASYWXFDKYHNJ-SFHVURJKSA-N	0	3	325.437	3.014	20	30		EGEDHN
C=CCOCC(=O)N[C@H]1CC[C@@H](C)N(Cc2ccc(C3CC3)cc2)C1	ZINC001131945940	1375061562	/nfs/dbraw/zinc/06/15/62/1375061562.db2.gz	DGBFMYBVJLHLBV-UZLBHIALSA-N	0	3	342.483	3.236	20	30		EGEDHN
C=CCC1(C(=O)NCC2CCN(Cc3cncc(C)c3)CC2)CCC1	ZINC001224402796	1375066450	/nfs/dbraw/zinc/06/64/50/1375066450.db2.gz	QLNVLOZVWHPSIU-UHFFFAOYSA-N	0	3	341.499	3.465	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CC[C@H](C)N(Cc2ccc(CF)cc2)C1	ZINC001132002424	1375092484	/nfs/dbraw/zinc/09/24/84/1375092484.db2.gz	JRLFFZGLJBWUDD-LPHOPBHVSA-N	0	3	330.447	3.429	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CCCC[C@H]1NCc1cc(F)ccc1OC	ZINC001225307518	1375102759	/nfs/dbraw/zinc/10/27/59/1375102759.db2.gz	JEXPHUGPZLXJBW-IAGOWNOFSA-N	0	3	334.435	3.318	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@@H]1CCCC[C@H]1NCc1cc(Cl)ccc1F	ZINC001225395853	1375107718	/nfs/dbraw/zinc/10/77/18/1375107718.db2.gz	UBOJDHASAZECQY-HFBAOOFYSA-N	0	3	337.826	3.156	20	30		EGEDHN
C[C@@H]1CC[C@H](NC(=O)C#CC2CC2)CN1Cc1ccc2c(c1)CCC2	ZINC001132034179	1375108859	/nfs/dbraw/zinc/10/88/59/1375108859.db2.gz	PEJIONRPUKJOLJ-IERDGZPVSA-N	0	3	336.479	3.058	20	30		EGEDHN
C[C@@H]1CC[C@@H](NC(=O)C#CC2CC2)CN1CCc1ccc(Cl)cc1	ZINC001132046052	1375114974	/nfs/dbraw/zinc/11/49/74/1375114974.db2.gz	MAWMTTCGTVLFTP-DNVCBOLYSA-N	0	3	344.886	3.265	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1CC[C@@H](C)N(CCOCC2CCC2)C1	ZINC001132060530	1375125356	/nfs/dbraw/zinc/12/53/56/1375125356.db2.gz	HAHDUAZQZWSXRP-AEFFLSMTSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CC[C@H](C)N(Cc2ccc(CO)cc2)C1	ZINC001132060784	1375125948	/nfs/dbraw/zinc/12/59/48/1375125948.db2.gz	LAGLGTOLQMCYIJ-QFBILLFUSA-N	0	3	344.499	3.250	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1CC[C@@H](C)N(Cc2ccc(CO)cc2)C1	ZINC001132073357	1375133731	/nfs/dbraw/zinc/13/37/31/1375133731.db2.gz	VHKJINGNYJHUMH-APWZRJJASA-N	0	3	330.472	3.004	20	30		EGEDHN
C=CCCCN1C[C@H](NC(=O)c2nc3cccnc3s2)CC[C@@H]1C	ZINC001132110848	1375153330	/nfs/dbraw/zinc/15/33/30/1375153330.db2.gz	MFVUAZXASQSSDI-UONOGXRCSA-N	0	3	344.484	3.240	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)COc2ccc(C(C)C)cc2)CC[C@H]1C	ZINC001132160017	1375177967	/nfs/dbraw/zinc/17/79/67/1375177967.db2.gz	HSGKLCRUQAKRGS-IEBWSBKVSA-N	0	3	342.483	3.181	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCCOc2ccc(F)cc2)CC[C@H]1C	ZINC001132214148	1375212567	/nfs/dbraw/zinc/21/25/67/1375212567.db2.gz	CLIDPOZZKFUUNW-NVXWUHKLSA-N	0	3	334.435	3.140	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CC[C@H](C)N(CCOCCCC)C2)cc1	ZINC001132214876	1375213984	/nfs/dbraw/zinc/21/39/84/1375213984.db2.gz	OTRVJNUJZMALAO-PXNSSMCTSA-N	0	3	342.483	3.067	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2c(C)cc(F)cc2C)CC[C@@H]1C	ZINC001132215560	1375214503	/nfs/dbraw/zinc/21/45/03/1375214503.db2.gz	ZSSKKGQGUPSBOY-FUHWJXTLSA-N	0	3	348.462	3.228	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)CCCc2ccccc2)CC[C@H]1C	ZINC001132260734	1375251793	/nfs/dbraw/zinc/25/17/93/1375251793.db2.gz	HJRUZGXAKQVTCA-QUCCMNQESA-N	0	3	344.499	3.181	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2CC[C@@H](C)N(CCOC3CCC3)C2)CCC1	ZINC001132283011	1375264717	/nfs/dbraw/zinc/26/47/17/1375264717.db2.gz	PTLMEYVFFYYLAP-SJORKVTESA-N	0	3	334.504	3.271	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC1CCN(C/C=C\c2ccc(Cl)cc2)CC1	ZINC001226640785	1375298244	/nfs/dbraw/zinc/29/82/44/1375298244.db2.gz	PPIBHONWMNIYDL-SFAKSCPVSA-N	0	3	331.847	3.093	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2cc(C)ccc2C)CC[C@H]1C	ZINC001132444722	1375387810	/nfs/dbraw/zinc/38/78/10/1375387810.db2.gz	FEZOHZALHBKFKL-MSOLQXFVSA-N	0	3	330.472	3.089	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2ccc(CC)cc2)CC[C@H]1C	ZINC001132458319	1375400828	/nfs/dbraw/zinc/40/08/28/1375400828.db2.gz	TZOSTPMROFGQMN-VQIMIIECSA-N	0	3	330.472	3.034	20	30		EGEDHN
C[C@H](c1ccccn1)N1CCC[C@@H](Oc2nc3cc(C#N)ccc3[nH]2)C1	ZINC001227218923	1375407717	/nfs/dbraw/zinc/40/77/17/1375407717.db2.gz	JBFNXXLBSHHBJF-GDBMZVCRSA-N	0	3	347.422	3.434	20	30		EGEDHN
O=C(C#CC1CC1)NC1CCN(Cc2cc3ccccc3s2)CC1	ZINC001227290423	1375416455	/nfs/dbraw/zinc/41/64/55/1375416455.db2.gz	WEOTVWIYDFXDDC-UHFFFAOYSA-N	0	3	338.476	3.395	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCOc2cccc(OC)c2)CC[C@@H]1C	ZINC001132521662	1375437936	/nfs/dbraw/zinc/43/79/36/1375437936.db2.gz	GWGBVHBHZNWBON-DLBZAZTESA-N	0	3	346.471	3.009	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1CC[C@H](C)N(Cc2ccc(CF)cc2)C1	ZINC001132529118	1375443566	/nfs/dbraw/zinc/44/35/66/1375443566.db2.gz	IUNRCFKODPHRQO-LPHOPBHVSA-N	0	3	348.462	3.218	20	30		EGEDHN
O=C(N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1)[C@]12C[C@H]1CCC2	ZINC001227630526	1375456803	/nfs/dbraw/zinc/45/68/03/1375456803.db2.gz	JDFHLBDWXCWYGC-NXLVEIQXSA-N	0	3	336.479	3.245	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2N(Cc2ccsc2)C(=O)CC)CC1	ZINC001132562765	1375468811	/nfs/dbraw/zinc/46/88/11/1375468811.db2.gz	MWXGFZHONXIIEK-KRWDZBQOSA-N	0	3	330.497	3.365	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CCCC[C@H]1N[C@@H](C)c1cnc(C)cn1	ZINC001227973544	1375496921	/nfs/dbraw/zinc/49/69/21/1375496921.db2.gz	SJTXMUBGDLJIGG-ARFHVFGLSA-N	0	3	330.476	3.075	20	30		EGEDHN
Cc1cocc1C(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1	ZINC001227991808	1375499459	/nfs/dbraw/zinc/49/94/59/1375499459.db2.gz	YPYOKAPSPBSGAO-WOJBJXKFSA-N	0	3	336.435	3.270	20	30		EGEDHN
COc1ccc(CN(C)[C@H]2CCN(C(=O)CCC(C)C)C2)cc1C#N	ZINC001188821666	1388384482	/nfs/dbraw/zinc/38/44/82/1388384482.db2.gz	SQKQWOCRAZNUJI-SFHVURJKSA-N	0	3	343.471	3.036	20	30		EGEDHN
Cc1nc(CNC[C@@H]2CN(C(=O)C#CC(C)(C)C)CC[C@@H]2C)cs1	ZINC001132831315	1375588372	/nfs/dbraw/zinc/58/83/72/1375588372.db2.gz	MXVRHTISAFSODR-GOEBONIOSA-N	0	3	347.528	3.075	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](C)[C@@H](CNCc2ocnc2C)C1	ZINC001132846886	1375598941	/nfs/dbraw/zinc/59/89/41/1375598941.db2.gz	NVRPHJRQBJGPDP-ZBFHGGJFSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](C)[C@@H](CNCc2cscn2)C1	ZINC001132847135	1375599814	/nfs/dbraw/zinc/59/98/14/1375599814.db2.gz	SLIXLLAWBGFFRA-CABCVRRESA-N	0	3	335.517	3.320	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](C)[C@@H](CNCc2cscn2)C1	ZINC001132847136	1375599827	/nfs/dbraw/zinc/59/98/27/1375599827.db2.gz	SLIXLLAWBGFFRA-GJZGRUSLSA-N	0	3	335.517	3.320	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](C)[C@H](CNCc2ncc(C)s2)C1	ZINC001132865440	1375609392	/nfs/dbraw/zinc/60/93/92/1375609392.db2.gz	NAFJCPOSFGQVCK-GDBMZVCRSA-N	0	3	335.517	3.382	20	30		EGEDHN
CC#CCCCC(=O)NC1CCN(Cc2ccc(CF)cc2)CC1	ZINC001228717008	1375650130	/nfs/dbraw/zinc/65/01/30/1375650130.db2.gz	CCIDEDDYEVXDCV-UHFFFAOYSA-N	0	3	330.447	3.430	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NC1CCN(Cc2cccc(N(C)C)c2)CC1	ZINC001228760349	1375668273	/nfs/dbraw/zinc/66/82/73/1375668273.db2.gz	LCNSFZKAQSNHHF-DLBZAZTESA-N	0	3	343.515	3.291	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC1CCN(CCOCc2ccccc2)CC1	ZINC001228809254	1375683902	/nfs/dbraw/zinc/68/39/02/1375683902.db2.gz	GVWNZRNOJMGNIA-GOSISDBHSA-N	0	3	344.499	3.386	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](C)[C@@H](CNCc2ccn(C(C)C)n2)C1	ZINC001133072545	1375758790	/nfs/dbraw/zinc/75/87/90/1375758790.db2.gz	ITJWHFOCVYNSAJ-ROUUACIJSA-N	0	3	346.519	3.395	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC1CCN(Cc2sc(C)nc2C)CC1	ZINC001229376814	1375821882	/nfs/dbraw/zinc/82/18/82/1375821882.db2.gz	KZTUEVWKOOWDEJ-UHFFFAOYSA-N	0	3	335.517	3.443	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)CC[C@@H]1CC(C)(C)CO1	ZINC001229933518	1375920520	/nfs/dbraw/zinc/92/05/20/1375920520.db2.gz	QTSZPPASKJZMMF-BZUAXINKSA-N	0	3	342.911	3.351	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)Cc1ccsc1	ZINC001133377049	1375957764	/nfs/dbraw/zinc/95/77/64/1375957764.db2.gz	KVIWBNBRDZXRDD-UHFFFAOYSA-N	0	3	346.883	3.196	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)CSCCC	ZINC001133385473	1375968726	/nfs/dbraw/zinc/96/87/26/1375968726.db2.gz	NCKAQMOJIWZZEW-UHFFFAOYSA-N	0	3	338.904	3.035	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@]12C[C@@H]1CCCC2	ZINC001133403850	1375988520	/nfs/dbraw/zinc/98/85/20/1375988520.db2.gz	MWPCORIJTLVZJF-PXNSSMCTSA-N	0	3	344.886	3.472	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C[C@@H](C)C1CC1	ZINC001133410755	1375995784	/nfs/dbraw/zinc/99/57/84/1375995784.db2.gz	ZRINVBSCUVTMDT-OAHLLOKOSA-N	0	3	332.875	3.328	20	30		EGEDHN
C=CCCOCC(=O)NC1CCN([C@@H](C)c2ccc(F)cc2)CC1	ZINC001230406770	1376021460	/nfs/dbraw/zinc/02/14/60/1376021460.db2.gz	CSIOKDGMMQGPKY-HNNXBMFYSA-N	0	3	334.435	3.060	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1C1CCN(C(=O)[C@@H](CCC)OC)CC1	ZINC001230584727	1376087690	/nfs/dbraw/zinc/08/76/90/1376087690.db2.gz	TZNANADWBYCLDP-DLBZAZTESA-N	0	3	342.911	3.257	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)c1cccc(C)c1	ZINC001133567830	1376093085	/nfs/dbraw/zinc/09/30/85/1376093085.db2.gz	CDERXIGVXYVJSK-ZIAGYGMSSA-N	0	3	339.277	3.390	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)CC1CCCC1	ZINC001133572737	1376098326	/nfs/dbraw/zinc/09/83/26/1376098326.db2.gz	KGCFNMVYNCYBQQ-OLZOCXBDSA-N	0	3	331.298	3.348	20	30		EGEDHN
C#CCCN(CCCNC(=O)c1ccccc1C)Cc1cccnc1	ZINC001230655801	1376117673	/nfs/dbraw/zinc/11/76/73/1376117673.db2.gz	ATLSZNFIKQLGOA-UHFFFAOYSA-N	0	3	335.451	3.035	20	30		EGEDHN
C#CCCN(CCCNC(=O)[C@@H](C)[C@H](C)CC)Cc1cccnc1	ZINC001230883554	1376177931	/nfs/dbraw/zinc/17/79/31/1376177931.db2.gz	XKGZXWGIPAGHCV-MSOLQXFVSA-N	0	3	329.488	3.095	20	30		EGEDHN
C=CCCC(=O)N(C)C[C@@H]1CCN1CCCOCCc1ccccc1	ZINC001231123899	1376208416	/nfs/dbraw/zinc/20/84/16/1376208416.db2.gz	XLKBDMHGASKLJG-FQEVSTJZSA-N	0	3	344.499	3.135	20	30		EGEDHN
CCCSCC(=O)N[C@@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001133821877	1376218429	/nfs/dbraw/zinc/21/84/29/1376218429.db2.gz	WAOUGVIEWZHION-CABCVRRESA-N	0	3	333.501	3.074	20	30		EGEDHN
C=CCCC(=O)N[C@@H](C)C[C@H](C)NCc1ccn(C2CCCC2)n1	ZINC001133888014	1376250663	/nfs/dbraw/zinc/25/06/63/1376250663.db2.gz	FDJIXHHLGVOZNR-HOTGVXAUSA-N	0	3	332.492	3.337	20	30		EGEDHN
COC(=O)C[C@H]1CCN(Cc2ccccc2C#Cc2ccccc2)C1	ZINC001231578960	1376268544	/nfs/dbraw/zinc/26/85/44/1376268544.db2.gz	VPANPVWXIKUEQC-LJQANCHMSA-N	0	3	333.431	3.471	20	30		EGEDHN
CNC(=O)C1CCN(Cc2ccccc2C#Cc2ccccc2)CC1	ZINC001231579135	1376270539	/nfs/dbraw/zinc/27/05/39/1376270539.db2.gz	QVAOXKCWJPXSSJ-UHFFFAOYSA-N	0	3	332.447	3.044	20	30		EGEDHN
COc1cc(C#N)ccc1CN1CCC2(CCn3c(C)cnc32)CC1	ZINC001231618472	1376283122	/nfs/dbraw/zinc/28/31/22/1376283122.db2.gz	IIEVLESWHHKTKG-UHFFFAOYSA-N	0	3	336.439	3.009	20	30		EGEDHN
CC(C)=C(F)C(=O)N[C@@H](C)C[C@H](C)NCc1cc(F)ccc1C#N	ZINC001134080646	1376354445	/nfs/dbraw/zinc/35/44/45/1376354445.db2.gz	APXJCYZNENKBKB-STQMWFEESA-N	0	3	335.398	3.334	20	30		EGEDHN
C#CCCCC(=O)N[C@@H](C)C[C@H](C)NCc1nc2ccccc2o1	ZINC001134201713	1376415682	/nfs/dbraw/zinc/41/56/82/1376415682.db2.gz	SPFNQFQRSUQKRA-GJZGRUSLSA-N	0	3	327.428	3.004	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)c1ccoc1Cl	ZINC001134250795	1376434178	/nfs/dbraw/zinc/43/41/78/1376434178.db2.gz	AYJAKRGLDZEKNK-UWVGGRQHSA-N	0	3	349.656	3.328	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)c2cc(F)cc(Cl)c2)ccc1F	ZINC001134272770	1376447862	/nfs/dbraw/zinc/44/78/62/1376447862.db2.gz	JVQUNNGDXMOBSH-UHFFFAOYSA-N	0	3	349.768	3.009	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H]3CN(CCOCCCC)C[C@H]32)CC1	ZINC001189040988	1388444587	/nfs/dbraw/zinc/44/45/87/1388444587.db2.gz	MYZVNPNHQQMUDX-RBUKOAKNSA-N	0	3	334.504	3.082	20	30		EGEDHN
CCCCCCC[NH2+][C@@H](C)C[C@@H](C)NC(=O)c1cccc2n[n-]nc21	ZINC001134419755	1376525524	/nfs/dbraw/zinc/52/55/24/1376525524.db2.gz	ZTDZOOBJRFIVFS-LSDHHAIUSA-N	0	3	345.491	3.415	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCNCc1csc(Br)c1	ZINC001134428748	1376529677	/nfs/dbraw/zinc/52/96/77/1376529677.db2.gz	ZVHLVCZWOMSADV-UHFFFAOYSA-N	0	3	345.306	3.319	20	30		EGEDHN
Cc1ccc(CN2CCN3C[C@H](Oc4ccccc4)C[C@H]3C2)c(C#N)c1	ZINC001232966643	1376550626	/nfs/dbraw/zinc/55/06/26/1376550626.db2.gz	UXHUMWSRKJHEDL-RBBKRZOGSA-N	0	3	347.462	3.204	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1C[C@@H]2C[C@H]1C[C@@H]2NC(=O)OC(C)(C)C	ZINC001233080418	1376566461	/nfs/dbraw/zinc/56/64/61/1376566461.db2.gz	XSCHOHXTLFYNPO-BZSNNMDCSA-N	0	3	341.455	3.354	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCC2(CC1)C(=O)N[C@H]2c1ccccc1	ZINC001233081469	1376567554	/nfs/dbraw/zinc/56/75/54/1376567554.db2.gz	XORKQRAYZWHWII-FQEVSTJZSA-N	0	3	345.446	3.320	20	30		EGEDHN
CCCCCCCCN(C)Cc1ccc(OC)c(S(N)(=O)=O)c1	ZINC001233303361	1376607838	/nfs/dbraw/zinc/60/78/38/1376607838.db2.gz	VNVCHVDMXTYRKA-UHFFFAOYSA-N	0	3	342.505	3.135	20	30		EGEDHN
C=CCOCCCC(=O)N(C)C[C@H]1CCN1[C@H]1CCc2ccccc21	ZINC001233489611	1376654368	/nfs/dbraw/zinc/65/43/68/1376654368.db2.gz	KYYPXVFSQBNCIE-QUCCMNQESA-N	0	3	342.483	3.189	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)Cc1ccccc1	ZINC001134765495	1376708461	/nfs/dbraw/zinc/70/84/61/1376708461.db2.gz	ZJGRTUYDGBQQDU-UONOGXRCSA-N	0	3	339.277	3.011	20	30		EGEDHN
Cc1ccc([C@@H]2C[C@H]2C(=O)NCCNCc2cccc(C#N)c2)cc1C	ZINC001135023201	1376853385	/nfs/dbraw/zinc/85/33/85/1376853385.db2.gz	SDSRJWXJAMRAOC-LEWJYISDSA-N	0	3	347.462	3.185	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@](C)(OC)c1ccccc1F	ZINC001235124082	1376855097	/nfs/dbraw/zinc/85/50/97/1376855097.db2.gz	OIANYKVYIZVBRO-OXJNMPFZSA-N	0	3	348.462	3.186	20	30		EGEDHN
CN1CCC[C@@H]2CN(C(=O)c3ccc(C#C[Si](C)(C)C)cc3)C[C@@H]21	ZINC001189169969	1388471553	/nfs/dbraw/zinc/47/15/53/1388471553.db2.gz	PEBMVFWWMLCISL-MOPGFXCFSA-N	0	3	340.543	3.082	20	30		EGEDHN
C[C@@H](C(=O)NCCNCc1ccc(F)c(C#N)c1)[C@@H](C)C(C)(C)C	ZINC001135178335	1376951595	/nfs/dbraw/zinc/95/15/95/1376951595.db2.gz	TWFWRZWGTLQCNF-ZIAGYGMSSA-N	0	3	333.451	3.221	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H](C)C[C@@H](C)NCc1ncc(Cl)n1C	ZINC001135181083	1376953317	/nfs/dbraw/zinc/95/33/17/1376953317.db2.gz	MCUFEGOKHGFTKY-CHWSQXEVSA-N	0	3	340.899	3.049	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)C(C)(C)C(=C)C	ZINC001135183977	1376956781	/nfs/dbraw/zinc/95/67/81/1376956781.db2.gz	AEBLHBCIDPGRTI-OLZOCXBDSA-N	0	3	331.298	3.370	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H](C)C[C@H](C)NCC(=C)Br	ZINC001135188587	1376962013	/nfs/dbraw/zinc/96/20/13/1376962013.db2.gz	MTEOGGSCFDQKAF-LSDHHAIUSA-N	0	3	343.309	3.352	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H](C)C[C@H](C)NCc1ncc(C)s1	ZINC001135193344	1376964566	/nfs/dbraw/zinc/96/45/66/1376964566.db2.gz	HSRZDWTTZQKXMS-GJZGRUSLSA-N	0	3	335.517	3.408	20	30		EGEDHN
Cc1cocc1C(=O)N[C@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001135202237	1376972168	/nfs/dbraw/zinc/97/21/68/1376972168.db2.gz	CJRLXKNTGBWZDL-LSDHHAIUSA-N	0	3	325.412	3.146	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)c2ccc(C(F)F)cc2)ccc1F	ZINC001135384954	1377066497	/nfs/dbraw/zinc/06/64/97/1377066497.db2.gz	PYVYIRIFMOIZMY-UHFFFAOYSA-N	0	3	347.340	3.155	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2nccn2CC)CC1	ZINC001135383897	1377066919	/nfs/dbraw/zinc/06/69/19/1377066919.db2.gz	XGHCDQNNJRYHDH-HOTGVXAUSA-N	0	3	332.492	3.022	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)C1CC2(CC2)C1)NCc1ccccc1C#N	ZINC001135452396	1377102847	/nfs/dbraw/zinc/10/28/47/1377102847.db2.gz	SXILFEQVFMDNDK-GJZGRUSLSA-N	0	3	325.456	3.121	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H](C)C[C@H](C)NCc2ccccc2C#N)c(C)[nH]1	ZINC001135561549	1377145378	/nfs/dbraw/zinc/14/53/78/1377145378.db2.gz	SMULNLWBYXFEQA-KBPBESRZSA-N	0	3	338.455	3.190	20	30		EGEDHN
CC(C)(C)c1cccc(C(=O)NCCNCc2cccc(C#N)c2)c1	ZINC001135620441	1377165800	/nfs/dbraw/zinc/16/58/00/1377165800.db2.gz	VWFUKDBECGIXOG-UHFFFAOYSA-N	0	3	335.451	3.375	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](CNC(=O)CCCC3CC3)C2)cc1	ZINC001266525674	1377326230	/nfs/dbraw/zinc/32/62/30/1377326230.db2.gz	LHPWPOHVQILLQC-LJQANCHMSA-N	0	3	325.456	3.077	20	30		EGEDHN
CC(C)[C@H](C(=O)Nc1ccc(Oc2ccc(C#N)cn2)cc1)N(C)C	ZINC001136450382	1377394364	/nfs/dbraw/zinc/39/43/64/1377394364.db2.gz	SEBSOOCJWRRKFZ-GOSISDBHSA-N	0	3	338.411	3.270	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)CCCCc3ccc(F)cc3)[C@@H]2C1	ZINC001189253012	1388497903	/nfs/dbraw/zinc/49/79/03/1388497903.db2.gz	HMPJVLSFIUYMJP-PKOBYXMFSA-N	0	3	330.447	3.257	20	30		EGEDHN
COc1ccccc1O[C@H]1CCN(Cc2ccc(OCC#N)cc2)C1	ZINC001137119313	1377481505	/nfs/dbraw/zinc/48/15/05/1377481505.db2.gz	GCULAKZLQJIGMJ-SFHVURJKSA-N	0	3	338.407	3.251	20	30		EGEDHN
O=C1CCN(Cc2ccc(C#Cc3ccccc3)cc2)C[C@@H]2CCCN12	ZINC001138336074	1377704869	/nfs/dbraw/zinc/70/48/69/1377704869.db2.gz	JRAFYDDVYYUDDO-QFIPXVFZSA-N	0	3	344.458	3.283	20	30		EGEDHN
C#CCOc1ccc(CN(C)Cc2ccc(N(C)C)cc2)cc1OC	ZINC001138346512	1377706635	/nfs/dbraw/zinc/70/66/35/1377706635.db2.gz	GDNNTYBZCDVMMH-UHFFFAOYSA-N	0	3	338.451	3.405	20	30		EGEDHN
C#CCOc1ccc(CN2CCC[C@@H](c3nc(CCC)no3)C2)cc1	ZINC001138557926	1377741886	/nfs/dbraw/zinc/74/18/86/1377741886.db2.gz	WYKXCJHJLDYIOV-QGZVFWFLSA-N	0	3	339.439	3.414	20	30		EGEDHN
C#CCOc1ccc(CN2CC[C@H](Oc3cccc(F)c3)C2)cc1	ZINC001138560797	1377742816	/nfs/dbraw/zinc/74/28/16/1377742816.db2.gz	OJJFZUXOMBCBOH-FQEVSTJZSA-N	0	3	325.383	3.491	20	30		EGEDHN
C=C(C)COc1ccccc1CN1CCC(C(=O)N2CCCC2)CC1	ZINC001138664664	1377764972	/nfs/dbraw/zinc/76/49/72/1377764972.db2.gz	UHXRSASDNRVYKV-UHFFFAOYSA-N	0	3	342.483	3.476	20	30		EGEDHN
Cn1ccc2c1cccc2CN1CCN(c2ccccc2C#N)CC1	ZINC001139157305	1377841578	/nfs/dbraw/zinc/84/15/78/1377841578.db2.gz	OHTIALLPPCPIHX-UHFFFAOYSA-N	0	3	330.435	3.372	20	30		EGEDHN
Cc1ccc(CN2CC[C@@H]3[C@@H]2CCN3Cc2ccc(C#N)c(F)c2)o1	ZINC001139527373	1377897233	/nfs/dbraw/zinc/89/72/33/1377897233.db2.gz	ATHLLOSAQQOQPS-UXHICEINSA-N	0	3	339.414	3.448	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3c[nH]c4c3cccc4C#N)C2)C1=O	ZINC001139704186	1377937557	/nfs/dbraw/zinc/93/75/57/1377937557.db2.gz	UASWPEYZYWVAJM-OAQYLSRUSA-N	0	3	348.450	3.040	20	30		EGEDHN
CN(CCN(C)C(=O)OC(C)(C)C)Cc1c[nH]c2c1cccc2C#N	ZINC001139701883	1377937724	/nfs/dbraw/zinc/93/77/24/1377937724.db2.gz	RRCBIZDYODBPDG-UHFFFAOYSA-N	0	3	342.443	3.338	20	30		EGEDHN
COc1cc(O[C@H]2CCN(Cc3c[nH]c4c3cccc4C#N)C2)ccn1	ZINC001139707813	1377939164	/nfs/dbraw/zinc/93/91/64/1377939164.db2.gz	ULPICGCOLBYAHJ-KRWDZBQOSA-N	0	3	348.406	3.096	20	30		EGEDHN
Cc1ccc(CN2CC[C@@]3(CCCN3C(=O)C(C)C)C2)cc1C#N	ZINC001139724503	1377941400	/nfs/dbraw/zinc/94/14/00/1377941400.db2.gz	UPGXNGKJZZLNRY-FQEVSTJZSA-N	0	3	325.456	3.090	20	30		EGEDHN
Cc1ccc(CN2CCC3(CC2)c2ccccc2NC3=O)cc1C#N	ZINC001139724821	1377941982	/nfs/dbraw/zinc/94/19/82/1377941982.db2.gz	RCQMKYYOCLTYCM-UHFFFAOYSA-N	0	3	331.419	3.353	20	30		EGEDHN
Cc1ccc(CN2CCC3(CCN(C(C)C)C3=O)CC2)cc1C#N	ZINC001139727282	1377942770	/nfs/dbraw/zinc/94/27/70/1377942770.db2.gz	MAHWLTDPDMMQGG-UHFFFAOYSA-N	0	3	325.456	3.090	20	30		EGEDHN
C=CCn1cc(CN(C)C[C@@H]2CCCN(C(=O)OC(C)(C)C)C2)cn1	ZINC001139772575	1377949002	/nfs/dbraw/zinc/94/90/02/1377949002.db2.gz	LINOTANRIGSJJC-INIZCTEOSA-N	0	3	348.491	3.148	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCC[N@@H+](Cc3cc(F)ccc3[O-])C2)cc1	ZINC001140059912	1377998459	/nfs/dbraw/zinc/99/84/59/1377998459.db2.gz	ANFMVZHIQCLHIW-GOSISDBHSA-N	0	3	326.371	3.446	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCC[N@H+](Cc3cc(F)ccc3[O-])C2)cc1	ZINC001140059912	1377998460	/nfs/dbraw/zinc/99/84/60/1377998460.db2.gz	ANFMVZHIQCLHIW-GOSISDBHSA-N	0	3	326.371	3.446	20	30		EGEDHN
N#Cc1ccc(Cl)c(CN2CC[C@@H](O)[C@@H]2Cc2ccccc2)c1	ZINC001140599233	1378094728	/nfs/dbraw/zinc/09/47/28/1378094728.db2.gz	UIXVGDDVZVAQFI-RBUKOAKNSA-N	0	3	326.827	3.390	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(CCCN2CCCc2ccccc2OC)C1=O	ZINC001273439905	1378101472	/nfs/dbraw/zinc/10/14/72/1378101472.db2.gz	UWQGUUDSTLUUSM-NRFANRHFSA-N	0	3	342.483	3.271	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CN(Cc3cc(C)c(O)c(C)c3)C2)CC1	ZINC001140655086	1378106256	/nfs/dbraw/zinc/10/62/56/1378106256.db2.gz	XHWZVVWJPMYMFJ-UHFFFAOYSA-N	0	3	344.455	3.229	20	30		EGEDHN
CN1CC[C@@]2(CCCN(Cc3ccc(C#N)c(Cl)c3)CC2)C1=O	ZINC001274492894	1378128447	/nfs/dbraw/zinc/12/84/47/1378128447.db2.gz	WJDCVCCRJUJIFA-GOSISDBHSA-N	0	3	331.847	3.046	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CCN(Cc3cnccc3C)C2)C1	ZINC001141031617	1378214175	/nfs/dbraw/zinc/21/41/75/1378214175.db2.gz	VEZYGTPPXSXVIV-IBGZPJMESA-N	0	3	329.444	3.001	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@]3(CCC[C@H]3C(=O)N(C)C)C2)c1[O-]	ZINC001277463807	1378224259	/nfs/dbraw/zinc/22/42/59/1378224259.db2.gz	OSEUIBMJQBECIW-GHTZIAJQSA-N	0	3	342.483	3.201	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@]3(CCC[C@H]3C(=O)N(C)C)C2)c1[O-]	ZINC001277463807	1378224261	/nfs/dbraw/zinc/22/42/61/1378224261.db2.gz	OSEUIBMJQBECIW-GHTZIAJQSA-N	0	3	342.483	3.201	20	30		EGEDHN
CCc1ccccc1CN1C[C@H]2CC[C@@H](C1)N2Cc1cc(C#N)n(C)c1	ZINC001278769591	1378287805	/nfs/dbraw/zinc/28/78/05/1378287805.db2.gz	XGIFLPNXNQBUKA-OYRHEFFESA-N	0	3	348.494	3.308	20	30		EGEDHN
O[C@@H]1CCN(Cc2ccc(C#Cc3ccccc3)s2)CC[C@@H]1F	ZINC001141972460	1378400285	/nfs/dbraw/zinc/40/02/85/1378400285.db2.gz	KRQDFGRXYFRPHV-RBUKOAKNSA-N	0	3	329.440	3.443	20	30		EGEDHN
CCN(CCNC(=O)OC(C)(C)C)Cc1c[nH]c2cc(C#N)ccc12	ZINC001142926552	1378509957	/nfs/dbraw/zinc/50/99/57/1378509957.db2.gz	VLCISNRMLQLRMS-UHFFFAOYSA-N	0	3	342.443	3.386	20	30		EGEDHN
C=CCN1C(=O)CCC[C@]12CCCN(Cc1ccc3cc[nH]c3n1)C2	ZINC001144171562	1378692427	/nfs/dbraw/zinc/69/24/27/1378692427.db2.gz	CVHSCAJWFDBGDM-HXUWFJFHSA-N	0	3	338.455	3.096	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)C[C@H](C)NCc2cc(C)no2)CCCCC1	ZINC001146664762	1378893463	/nfs/dbraw/zinc/89/34/63/1378893463.db2.gz	SZTMFMTWYQHTNK-JKSUJKDBSA-N	0	3	345.487	3.330	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2conc2C)CCCC1	ZINC001146823386	1378929273	/nfs/dbraw/zinc/92/92/73/1378929273.db2.gz	ZAXYFOLPFBUAAG-CABCVRRESA-N	0	3	333.476	3.492	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2cccc(-c3ccoc3)c2)c1	ZINC001146948158	1378946176	/nfs/dbraw/zinc/94/61/76/1378946176.db2.gz	FXPRSXBWUYGWBH-UHFFFAOYSA-N	0	3	345.402	3.338	20	30		EGEDHN
C=CCCC(=O)N1CC2(C1)CCN(CCOc1cccc(CC)c1)C2	ZINC001147187171	1378984444	/nfs/dbraw/zinc/98/44/44/1378984444.db2.gz	HDNNDIUIQPQSME-UHFFFAOYSA-N	0	3	342.483	3.128	20	30		EGEDHN
C=CCOCC(=O)N1CC2(C1)CCN([C@H](C)c1cccc(Cl)c1)C2	ZINC001147255974	1378998186	/nfs/dbraw/zinc/99/81/86/1378998186.db2.gz	GGVVPWZSEVZDMH-OAHLLOKOSA-N	0	3	348.874	3.138	20	30		EGEDHN
CC[C@H](CC(=O)NCCNCc1ccc(OC)c(C#N)c1)C(C)(C)C	ZINC001147466773	1379025836	/nfs/dbraw/zinc/02/58/36/1379025836.db2.gz	VYIVBTZLGMGOAI-QGZVFWFLSA-N	0	3	345.487	3.235	20	30		EGEDHN
CCc1occc1C(=O)N(C)C[C@H](C)NCc1ccc(F)c(C#N)c1	ZINC001283605670	1379048194	/nfs/dbraw/zinc/04/81/94/1379048194.db2.gz	ICSNUFKLGNDVOQ-ZDUSSCGKSA-N	0	3	343.402	3.103	20	30		EGEDHN
COc1ccc(CNCCNC(=O)[C@H](C)CCC(C)(C)C)cc1C#N	ZINC001147787407	1379078589	/nfs/dbraw/zinc/07/85/89/1379078589.db2.gz	USBSYLWNRQUYEI-OAHLLOKOSA-N	0	3	345.487	3.235	20	30		EGEDHN
COc1ccc(CNCCNC(=O)[C@@H](C)CCC(C)(C)C)cc1C#N	ZINC001147787406	1379078608	/nfs/dbraw/zinc/07/86/08/1379078608.db2.gz	USBSYLWNRQUYEI-HNNXBMFYSA-N	0	3	345.487	3.235	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2cccc(C3CCC3)c2)c1	ZINC001147834177	1379087105	/nfs/dbraw/zinc/08/71/05/1379087105.db2.gz	DROVWGCIHDUCBG-UHFFFAOYSA-N	0	3	333.435	3.345	20	30		EGEDHN
C#CCCCCCC(=O)N1CC2(C1)CCN(CCC(F)(F)F)C2	ZINC001148059529	1379111229	/nfs/dbraw/zinc/11/12/29/1379111229.db2.gz	BAQUGRKKQAXHHH-UHFFFAOYSA-N	0	3	330.394	3.057	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001148089435	1379115921	/nfs/dbraw/zinc/11/59/21/1379115921.db2.gz	WCLCKFDURULIAV-IAGOWNOFSA-N	0	3	337.467	3.051	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC2(C1)CCN(Cc1ncccc1C)C2	ZINC001148146483	1379124585	/nfs/dbraw/zinc/12/45/85/1379124585.db2.gz	DRRYCLFKLCEECJ-QGZVFWFLSA-N	0	3	327.472	3.027	20	30		EGEDHN
CC[C@@H](C)[C@H](C)C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001148500824	1379193476	/nfs/dbraw/zinc/19/34/76/1379193476.db2.gz	LRJJFVFZFAEODN-SJORKVTESA-N	0	3	339.483	3.275	20	30		EGEDHN
CCCCCCCCC(=O)NCCNCc1ccc(C(=O)NC)cc1	ZINC001148727733	1379255261	/nfs/dbraw/zinc/25/52/61/1379255261.db2.gz	ITKYOXJFQGXDBI-UHFFFAOYSA-N	0	3	347.503	3.003	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2cc(Cl)ccc2Cl)c1	ZINC001148903909	1379295376	/nfs/dbraw/zinc/29/53/76/1379295376.db2.gz	LCWIKSBVDRXESC-UHFFFAOYSA-N	0	3	348.233	3.385	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cc(Cl)cc(Cl)c2)cc1	ZINC001148910674	1379297240	/nfs/dbraw/zinc/29/72/40/1379297240.db2.gz	ZAJRMXOAGNKVCA-UHFFFAOYSA-N	0	3	348.233	3.385	20	30		EGEDHN
Cc1ccsc1CCCC(=O)NCCNCc1cccc(C#N)c1	ZINC001149230857	1379352579	/nfs/dbraw/zinc/35/25/79/1379352579.db2.gz	JEMUABFQYPVXMS-UHFFFAOYSA-N	0	3	341.480	3.157	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@H]1CN(Cc2ccccc2CC)CCCO1	ZINC001149787924	1379445753	/nfs/dbraw/zinc/44/57/53/1379445753.db2.gz	BGXPMFBIJOZIKF-FQEVSTJZSA-N	0	3	344.499	3.312	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H]1CN(Cc2cc(C)cc(C)c2)CCCO1	ZINC001150085072	1379491943	/nfs/dbraw/zinc/49/19/43/1379491943.db2.gz	JCKWLPLSFRQTSH-LJQANCHMSA-N	0	3	344.499	3.223	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@H]1CN(Cc2ccccc2C)CCCO1	ZINC001150141280	1379501289	/nfs/dbraw/zinc/50/12/89/1379501289.db2.gz	ZEBHSXYEUWHEAA-ICSRJNTNSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@H]1CN(Cc2ccc(C)cc2)CCCO1	ZINC001150140166	1379501341	/nfs/dbraw/zinc/50/13/41/1379501341.db2.gz	QMFNAMLJUZULML-ICSRJNTNSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@H]1CN(CC2=CCCCC2)CCCO1	ZINC001150379984	1379542012	/nfs/dbraw/zinc/54/20/12/1379542012.db2.gz	NGFJBLSFXAMAFE-SFHVURJKSA-N	0	3	334.504	3.296	20	30		EGEDHN
C#CCCN1CCCO[C@H](CNC(=O)[C@H](CC2CCCC2)C(C)C)C1	ZINC001150404310	1379549870	/nfs/dbraw/zinc/54/98/70/1379549870.db2.gz	XVGPCBVQOJRIEO-WOJBJXKFSA-N	0	3	348.531	3.069	20	30		EGEDHN
C#CCC1(C(=O)NC[C@H]2CN(CC=C(C)C)CCCO2)CCCCC1	ZINC001150795876	1379617196	/nfs/dbraw/zinc/61/71/96/1379617196.db2.gz	QSLVRVREFVDCHL-IBGZPJMESA-N	0	3	346.515	3.134	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2cc3sccc3[nH]2)CC1	ZINC001151387275	1379709388	/nfs/dbraw/zinc/70/93/88/1379709388.db2.gz	GKJZEPRPHZESGT-UHFFFAOYSA-N	0	3	347.484	3.016	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)C[C@@H](C)c2ccco2)CC1	ZINC001151392945	1379710921	/nfs/dbraw/zinc/71/09/21/1379710921.db2.gz	UIHPYSPRABPNGT-QGZVFWFLSA-N	0	3	348.487	3.337	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@H](C)Cc2ccccc2)CC1	ZINC001151409850	1379713553	/nfs/dbraw/zinc/71/35/53/1379713553.db2.gz	JNDPSLACZRQVML-GOSISDBHSA-N	0	3	344.499	3.039	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)[C@H]1CC=CCC1	ZINC001151828971	1379789652	/nfs/dbraw/zinc/78/96/52/1379789652.db2.gz	BQEZFXRTBLHDJP-APWZRJJASA-N	0	3	325.456	3.241	20	30		EGEDHN
CC(C)c1ccsc1C(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001152125767	1379867951	/nfs/dbraw/zinc/86/79/51/1379867951.db2.gz	HUCHGRIPCVCXDU-UHFFFAOYSA-N	0	3	345.443	3.402	20	30		EGEDHN
CCN(C/C=C\c1ccccc1)[C@H](C)CNC(=O)c1cc(C#N)c[nH]1	ZINC001152619311	1379957920	/nfs/dbraw/zinc/95/79/20/1379957920.db2.gz	BLXGMHAFORUKJI-BSDKJSHOSA-N	0	3	336.439	3.040	20	30		EGEDHN
CCN(Cc1cc(C)sc1C)[C@H](C)CNC(=O)c1cc(C#N)c[nH]1	ZINC001152641398	1379962305	/nfs/dbraw/zinc/96/23/05/1379962305.db2.gz	KEZIOYYVBKRHAW-GFCCVEGCSA-N	0	3	344.484	3.205	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)[C@H]2CCCCc3ccccc32)c1	ZINC001152754546	1379978722	/nfs/dbraw/zinc/97/87/22/1379978722.db2.gz	QOSHQGNNYROFEV-NRFANRHFSA-N	0	3	347.462	3.274	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H](C)N(CC)CCc1csc(C)n1	ZINC001152867134	1379988287	/nfs/dbraw/zinc/98/82/87/1379988287.db2.gz	JBDHXYYNSWRNMK-OAHLLOKOSA-N	0	3	335.517	3.014	20	30		EGEDHN
Cc1ccccc1C(C)(C)C(=O)NCCNCc1cccc(C#N)c1	ZINC001153649260	1380110368	/nfs/dbraw/zinc/11/03/68/1380110368.db2.gz	MACOHBIODYKUAR-UHFFFAOYSA-N	0	3	335.451	3.050	20	30		EGEDHN
CCc1ccc(C(=O)NC[C@@H](C)N(CC)Cc2cccc(C#N)c2)o1	ZINC001154049714	1380191605	/nfs/dbraw/zinc/19/16/05/1380191605.db2.gz	ATWLEQGHGOFNMX-OAHLLOKOSA-N	0	3	339.439	3.354	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)CCC(C)(F)F	ZINC001154058907	1380193668	/nfs/dbraw/zinc/19/36/68/1380193668.db2.gz	IPNSYDCXEKOIOW-CQSZACIVSA-N	0	3	337.414	3.320	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)C1(F)CCCC1	ZINC001154099817	1380207577	/nfs/dbraw/zinc/20/75/77/1380207577.db2.gz	RVJNXPCTQRPTGD-CQSZACIVSA-N	0	3	349.425	3.306	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)Cc1ccc(CC(C)C)cc1	ZINC001154216176	1380231216	/nfs/dbraw/zinc/23/12/16/1380231216.db2.gz	WDEZHDCWCROKIK-GOSISDBHSA-N	0	3	328.500	3.278	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1sccc1-n1cccc1	ZINC001154533046	1380300205	/nfs/dbraw/zinc/30/02/05/1380300205.db2.gz	JPUGCXHXLCQHMN-OAHLLOKOSA-N	0	3	329.469	3.002	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)c1cc(C)co1	ZINC001154735342	1380342813	/nfs/dbraw/zinc/34/28/13/1380342813.db2.gz	CTBVVVSVPQHZJH-OAHLLOKOSA-N	0	3	325.412	3.100	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@@H](C)N(CC)Cc1ccnc(N(C)C)c1	ZINC001154751405	1380345924	/nfs/dbraw/zinc/34/59/24/1380345924.db2.gz	VRZPFKRVDZCNAR-IAGOWNOFSA-N	0	3	346.519	3.077	20	30		EGEDHN
CCC[C@H](OCC)C(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)cc1	ZINC001154757969	1380347336	/nfs/dbraw/zinc/34/73/36/1380347336.db2.gz	WVHDIUVBNIAJEL-APWZRJJASA-N	0	3	345.487	3.090	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)[C@@H]1Cc2ccccc21	ZINC001154921987	1380376797	/nfs/dbraw/zinc/37/67/97/1380376797.db2.gz	UYZUQSZDGONKQS-IIBYNOLFSA-N	0	3	347.462	3.225	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)C1(C(C)(F)F)CC1	ZINC001155279194	1380432715	/nfs/dbraw/zinc/43/27/15/1380432715.db2.gz	JLEQRCSPRZEKOZ-CQSZACIVSA-N	0	3	349.425	3.320	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)NC[C@@H](C)N(CC)Cc1cc(F)ccc1C	ZINC001155325876	1380437037	/nfs/dbraw/zinc/43/70/37/1380437037.db2.gz	JFLDXEXBYJQGQJ-LZQZEXGQSA-N	0	3	348.462	3.052	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@@H](C)N(CC)Cc1cccc(C#N)c1	ZINC001155490125	1380459788	/nfs/dbraw/zinc/45/97/88/1380459788.db2.gz	VJJYIQSGSGOBML-MRXNPFEDSA-N	0	3	327.472	3.487	20	30		EGEDHN
C=CCCC(=O)NCCCNCc1ncc(-c2ccccc2)s1	ZINC001155587166	1380470867	/nfs/dbraw/zinc/47/08/67/1380470867.db2.gz	ZXXZUVVXAQNDMP-UHFFFAOYSA-N	0	3	329.469	3.372	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H](C)N(CC)Cc2csc(C)c2)nc1	ZINC001156460685	1380579152	/nfs/dbraw/zinc/57/91/52/1380579152.db2.gz	SABPSRPRVYJZDN-CQSZACIVSA-N	0	3	341.480	3.073	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C[C@H]1CCc2ccccc2C1	ZINC001156606407	1380599309	/nfs/dbraw/zinc/59/93/09/1380599309.db2.gz	ITQUQFHDIYAZFO-MSOLQXFVSA-N	0	3	326.484	3.032	20	30		EGEDHN
C#CCCCCC(=O)NCCCNCc1nc2cc(C)ccc2s1	ZINC001156827928	1380665230	/nfs/dbraw/zinc/66/52/30/1380665230.db2.gz	NWHVIRIXCVKQEO-UHFFFAOYSA-N	0	3	343.496	3.394	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)CC[C@@H]1CCc2ccccc21	ZINC001157053179	1380762314	/nfs/dbraw/zinc/76/23/14/1380762314.db2.gz	OEYLLDCSAZTNLH-MJGOQNOKSA-N	0	3	326.484	3.347	20	30		EGEDHN
C=CCCOCC(=O)NC[C@@H](C)N(CC)Cc1ccc(Cl)cc1	ZINC001157203606	1380810099	/nfs/dbraw/zinc/81/00/99/1380810099.db2.gz	WWXVOTZPPSPGMZ-OAHLLOKOSA-N	0	3	338.879	3.259	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)Cc1c(C)oc2ccccc21	ZINC001157384667	1380861713	/nfs/dbraw/zinc/86/17/13/1380861713.db2.gz	ZCUZOMLSVWDPLJ-OAHLLOKOSA-N	0	3	326.440	3.134	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1ccsc1C	ZINC001157931013	1381075486	/nfs/dbraw/zinc/07/54/86/1381075486.db2.gz	VKGFLRXVTDPOCF-MRXNPFEDSA-N	0	3	336.501	3.186	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc(F)cc2ccncc21	ZINC001157967769	1381086144	/nfs/dbraw/zinc/08/61/44/1381086144.db2.gz	SDLLRKNZHXMGJE-QGZVFWFLSA-N	0	3	341.430	3.486	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N1CCCC[C@@H]1CN(C)CC=C(C)C	ZINC001157967587	1381086537	/nfs/dbraw/zinc/08/65/37/1381086537.db2.gz	NQRHZYYNHLIXNW-QRVBRYPASA-N	0	3	334.504	3.247	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ncn2cc(Cl)ccc12	ZINC001157977378	1381091101	/nfs/dbraw/zinc/09/11/01/1381091101.db2.gz	BGRQAJCHKRFNGF-OAHLLOKOSA-N	0	3	346.862	3.100	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cn(C)c2ccc(F)cc12	ZINC001158076694	1381121145	/nfs/dbraw/zinc/12/11/45/1381121145.db2.gz	CIKGYORVFLHOEF-MRXNPFEDSA-N	0	3	343.446	3.430	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1CCc2ccc(OC)cc21	ZINC001158077538	1381122290	/nfs/dbraw/zinc/12/22/90/1381122290.db2.gz	SFOKZDYGVGBCPP-IEBWSBKVSA-N	0	3	342.483	3.224	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)Cc1ccc(C)cc1	ZINC001158194233	1381154911	/nfs/dbraw/zinc/15/49/11/1381154911.db2.gz	BRJFQQZPGDDYLI-HXUWFJFHSA-N	0	3	344.499	3.053	20	30		EGEDHN
C[C@@H](N)c1ccn(C(F)(F)c2cc(Cl)nc(Cl)c2C#N)n1	ZINC001158344365	1381209541	/nfs/dbraw/zinc/20/95/41/1381209541.db2.gz	AFYKEPQQHINECM-ZCFIWIBFSA-N	0	3	332.141	3.074	20	30		EGEDHN
C[C@@H](N)c1ccn(-c2nc3cc(F)c(F)cc3c(Cl)c2C#N)n1	ZINC001158356681	1381214807	/nfs/dbraw/zinc/21/48/07/1381214807.db2.gz	YUJIHBBNFMEBGI-SSDOTTSWSA-N	0	3	333.729	3.243	20	30		EGEDHN
C=CCCCC(=O)N1CCCC[C@@H]1CN(C)CCO[C@@H]1CC1(F)F	ZINC001158418969	1381239848	/nfs/dbraw/zinc/23/98/48/1381239848.db2.gz	DXJGSRFVFDEIEQ-HZPDHXFCSA-N	0	3	344.446	3.080	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1CCC(C)(C)C1	ZINC001158456810	1381250934	/nfs/dbraw/zinc/25/09/34/1381250934.db2.gz	CDTQEFNGVXWHFJ-QZTJIDSGSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H]1CCc2cccc(OC)c21	ZINC001158565697	1381302733	/nfs/dbraw/zinc/30/27/33/1381302733.db2.gz	YWQUHGJYSYVHKD-MSOLQXFVSA-N	0	3	342.483	3.224	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)Cc1csc(C(C)(C)C)n1	ZINC001158604962	1381316060	/nfs/dbraw/zinc/31/60/60/1381316060.db2.gz	HBONUUPSTVHLRF-MRXNPFEDSA-N	0	3	349.544	3.482	20	30		EGEDHN
CC1=C(C)C[C@H](C(=O)NCCCNCc2ccc(C#N)cc2F)CC1	ZINC001158721944	1381367295	/nfs/dbraw/zinc/36/72/95/1381367295.db2.gz	VBSNPNDDULVHSA-QGZVFWFLSA-N	0	3	343.446	3.430	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1CC12CCCC2	ZINC001158723967	1381368415	/nfs/dbraw/zinc/36/84/15/1381368415.db2.gz	SEJZNVKWTFTOAF-MSOLQXFVSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1ccoc1CCC	ZINC001158739409	1381376078	/nfs/dbraw/zinc/37/60/78/1381376078.db2.gz	JOPFVKDHYDWDMD-QGZVFWFLSA-N	0	3	348.487	3.361	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H](C)COc1ccccc1	ZINC001158866539	1381440968	/nfs/dbraw/zinc/44/09/68/1381440968.db2.gz	QJWDGUOCHVGVBX-ZWKOTPCHSA-N	0	3	330.472	3.200	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)COc1ccc(C)c(C)c1	ZINC001158866144	1381441640	/nfs/dbraw/zinc/44/16/40/1381441640.db2.gz	LQHSAUOBOJACEC-GOSISDBHSA-N	0	3	330.472	3.181	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)CCOc1ccccc1C	ZINC001158877268	1381447994	/nfs/dbraw/zinc/44/79/94/1381447994.db2.gz	WXGHZSHIQURHGH-GOSISDBHSA-N	0	3	330.472	3.263	20	30		EGEDHN
C=C(C)CCC(=O)NCCCNCc1sccc1Br	ZINC001159040105	1381535020	/nfs/dbraw/zinc/53/50/20/1381535020.db2.gz	HFLCTSSFEQOTQQ-UHFFFAOYSA-N	0	3	345.306	3.463	20	30		EGEDHN
CC(C)CC(=O)NCCC1=CCN(Cc2ccc(C#N)cc2)CC1	ZINC001159111057	1381597336	/nfs/dbraw/zinc/59/73/36/1381597336.db2.gz	AJVVXSUMHKNRLD-UHFFFAOYSA-N	0	3	325.456	3.243	20	30		EGEDHN
CCc1c(C)nc2sc(C#N)c(Nc3ccncc3CN)c2c1C	ZINC001159399401	1381786247	/nfs/dbraw/zinc/78/62/47/1381786247.db2.gz	BMTLLKRFMRRRPF-UHFFFAOYSA-N	0	3	337.452	3.366	20	30		EGEDHN
CC(C)CC1(C(=O)NCCCNCc2ccc(C#N)cc2F)CC1	ZINC001159592165	1381838560	/nfs/dbraw/zinc/83/85/60/1381838560.db2.gz	BYLSSUPWKUQDGN-UHFFFAOYSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=CCOc1cc(C)nc(-n2c(-c3ccccc3)cnc2[C@H](C)N)n1	ZINC001159594232	1381840511	/nfs/dbraw/zinc/84/05/11/1381840511.db2.gz	AHJSHBXIEFIARX-AWEZNQCLSA-N	0	3	335.411	3.222	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc(-c3ccccc3)no2)CC1	ZINC001160580405	1382147705	/nfs/dbraw/zinc/14/77/05/1382147705.db2.gz	OBRMOOGDUYBWKO-UHFFFAOYSA-N	0	3	337.423	3.280	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2nc3ccccc3cc2C)CC1	ZINC001160714967	1382176985	/nfs/dbraw/zinc/17/69/85/1382176985.db2.gz	WEHQXQFGHFXULH-UHFFFAOYSA-N	0	3	347.462	3.319	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCC1=CCN(Cc2cnccc2C)CC1	ZINC001160882876	1382224032	/nfs/dbraw/zinc/22/40/32/1382224032.db2.gz	VYESQRCMEBTVGR-UHFFFAOYSA-N	0	3	327.472	3.241	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCC1=CCN(Cc2ncccc2C)CC1	ZINC001160941792	1382244944	/nfs/dbraw/zinc/24/49/44/1382244944.db2.gz	PZHGHAZISSVGBE-SJLPKXTDSA-N	0	3	341.499	3.487	20	30		EGEDHN
CC#CCCCC(=O)NCCC1=CCN(CCOCC2CCC2)CC1	ZINC001160954392	1382250139	/nfs/dbraw/zinc/25/01/39/1382250139.db2.gz	SIOSWPJLXGWHJV-UHFFFAOYSA-N	0	3	346.515	3.135	20	30		EGEDHN
C#CC[C@H](N)C(=O)N(C)[C@H](C)[C@@H](Oc1ccccc1)c1ccccc1	ZINC001160998956	1382267115	/nfs/dbraw/zinc/26/71/15/1382267115.db2.gz	VQRRPWJVIGTDIL-LSTHTHJFSA-N	0	3	336.435	3.004	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C(C2CCC2)C2CCC2)CC1	ZINC001161035860	1382279455	/nfs/dbraw/zinc/27/94/55/1382279455.db2.gz	CVFJWLRPZIQCPT-UHFFFAOYSA-N	0	3	328.500	3.365	20	30		EGEDHN
C=CCCCC(=O)NCCC1=CCN(CCc2csc(C)n2)CC1	ZINC001161056277	1382284656	/nfs/dbraw/zinc/28/46/56/1382284656.db2.gz	BNRBDVXSMKHWBM-UHFFFAOYSA-N	0	3	347.528	3.489	20	30		EGEDHN
N#Cc1cc(Cl)nc(NCC2CCN(Cc3ccccn3)CC2)c1	ZINC001161240799	1382351669	/nfs/dbraw/zinc/35/16/69/1382351669.db2.gz	CODPULNJZYPVEM-UHFFFAOYSA-N	0	3	341.846	3.326	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@H]2[C@@H]3CCCCCC[C@@H]32)CC1	ZINC001161314407	1382368658	/nfs/dbraw/zinc/36/86/58/1382368658.db2.gz	YCPKQLPCJRCNMP-PMOLBWCYSA-N	0	3	328.500	3.365	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccn(C(CC)CC)n2)CC1	ZINC001161383280	1382392032	/nfs/dbraw/zinc/39/20/32/1382392032.db2.gz	PCXPPUYWTJDZHQ-UHFFFAOYSA-N	0	3	330.476	3.182	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H]2CCc3cccc(OC)c32)CC1	ZINC001161427696	1382406596	/nfs/dbraw/zinc/40/65/96/1382406596.db2.gz	NQCHBOYIILLUNS-GOSISDBHSA-N	0	3	340.467	3.049	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)Cn2cc(C)c3ccccc32)CC1	ZINC001161451885	1382414717	/nfs/dbraw/zinc/41/47/17/1382414717.db2.gz	JSUWLDGHKHPXHE-UHFFFAOYSA-N	0	3	349.478	3.111	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C[C@@H]2CCO[C@@H](C(C)C)C2)CC1	ZINC001161656060	1382472291	/nfs/dbraw/zinc/47/22/91/1382472291.db2.gz	PTCLYNFFXGBUCN-RTBURBONSA-N	0	3	334.504	3.152	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc3ccccc3n2)CC1	ZINC001161762949	1382497969	/nfs/dbraw/zinc/49/79/69/1382497969.db2.gz	GAKLAENBYAYOKP-UHFFFAOYSA-N	0	3	333.435	3.010	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H](C)c2ccc(F)c(F)c2)CC1	ZINC001161904436	1382546113	/nfs/dbraw/zinc/54/61/13/1382546113.db2.gz	WACOBAMWHVIWJL-CQSZACIVSA-N	0	3	334.410	3.393	20	30		EGEDHN
CCc1ccc(C(=O)NCCCNCc2ccc(C#N)cc2F)s1	ZINC001161986011	1382588526	/nfs/dbraw/zinc/58/85/26/1382588526.db2.gz	KSYUDPZUIYYKNK-UHFFFAOYSA-N	0	3	345.443	3.231	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H](OCC)c2ccccc2)CC1	ZINC001161986941	1382589805	/nfs/dbraw/zinc/58/98/05/1382589805.db2.gz	OMHRSIBTSHEVOC-LJQANCHMSA-N	0	3	328.456	3.089	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CCC[C@@H](F)C1	ZINC001162807166	1382879311	/nfs/dbraw/zinc/87/93/11/1382879311.db2.gz	ZCJMQDBCJREFTO-VQTJNVASSA-N	0	3	344.474	3.199	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CCC(C)=C(C)C1	ZINC001162816875	1382883788	/nfs/dbraw/zinc/88/37/88/1382883788.db2.gz	FUBHJNXSJZJKFC-NRFANRHFSA-N	0	3	338.495	3.417	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N(CCNCC#CC)CCc1ccccc1	ZINC001162897625	1382908298	/nfs/dbraw/zinc/90/82/98/1382908298.db2.gz	DPNUVDIJQMFVMK-LJQANCHMSA-N	0	3	326.484	3.273	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CCC[C@H](C)C1	ZINC001162906300	1382911389	/nfs/dbraw/zinc/91/13/89/1382911389.db2.gz	JDOGZOCSKHNCGJ-AZUAARDMSA-N	0	3	326.484	3.107	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CCCC[C@H]1C	ZINC001162906552	1382911653	/nfs/dbraw/zinc/91/16/53/1382911653.db2.gz	NHTICAZDQGDQNH-TZIWHRDSSA-N	0	3	340.511	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1cc[nH]c1C1CCC1	ZINC001162929202	1382919098	/nfs/dbraw/zinc/91/90/98/1382919098.db2.gz	SDMGLAVNDASHLV-UHFFFAOYSA-N	0	3	349.478	3.190	20	30		EGEDHN
N#Cc1ccccc1CNCC1(CCNC(=O)c2ccccc2)CC1	ZINC001163196316	1382989967	/nfs/dbraw/zinc/98/99/67/1382989967.db2.gz	KUGBPAUFVLJOED-UHFFFAOYSA-N	0	3	333.435	3.248	20	30		EGEDHN
CC(C)CCC(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001163324191	1383022532	/nfs/dbraw/zinc/02/25/32/1383022532.db2.gz	COEGEIJXMVIECJ-UHFFFAOYSA-N	0	3	327.472	3.371	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)/C=C\C(C)(C)C)CC1	ZINC001163831262	1383126730	/nfs/dbraw/zinc/12/67/30/1383126730.db2.gz	SBPNKVFWCLEASF-WAYWQWQTSA-N	0	3	343.309	3.373	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCC1(CNCc2ccc(Cl)cc2F)CC1	ZINC001163854095	1383129824	/nfs/dbraw/zinc/12/98/24/1383129824.db2.gz	JNOBVGLWCGVFJF-GFCCVEGCSA-N	0	3	337.826	3.015	20	30		EGEDHN
C=CCOCCCC(=O)NCCC1(CNCC=C(Cl)Cl)CC1	ZINC001163950316	1383138794	/nfs/dbraw/zinc/13/87/94/1383138794.db2.gz	BQLVJYWLWGKEFU-UHFFFAOYSA-N	0	3	349.302	3.164	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCCNCc1cc(-c2ccccc2)no1	ZINC001163957553	1383139467	/nfs/dbraw/zinc/13/94/67/1383139467.db2.gz	MZAJTPJLMHPEEA-UHFFFAOYSA-N	0	3	327.428	3.150	20	30		EGEDHN
CC(C)(C)C#CC(=O)NCCC1(CNCc2cccc(Cl)n2)CC1	ZINC001164482736	1383191083	/nfs/dbraw/zinc/19/10/83/1383191083.db2.gz	HSDJNHSZAYVKLB-UHFFFAOYSA-N	0	3	347.890	3.161	20	30		EGEDHN
CC(C)(C)C#CC(=O)NCCC1(CNCc2cc(F)ccc2F)CC1	ZINC001164482914	1383191330	/nfs/dbraw/zinc/19/13/30/1383191330.db2.gz	RAGBQUKSIQVGTC-UHFFFAOYSA-N	0	3	348.437	3.390	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1	ZINC001164544338	1383198072	/nfs/dbraw/zinc/19/80/72/1383198072.db2.gz	TUJFBZONWPBHHE-GHMZBOCLSA-N	0	3	333.284	3.353	20	30		EGEDHN
N#Cc1ccccc1CNCC1(CCNC(=O)C2C=CC=CC=C2)CC1	ZINC001165273647	1383263899	/nfs/dbraw/zinc/26/38/99/1383263899.db2.gz	VHWPKARSCRSSRF-UHFFFAOYSA-N	0	3	347.462	3.233	20	30		EGEDHN
C=CCCCC(=O)NCCCNCc1cc(-c2ccccc2)no1	ZINC001165530876	1383307167	/nfs/dbraw/zinc/30/71/67/1383307167.db2.gz	MEHCBBJFXQVQKQ-UHFFFAOYSA-N	0	3	327.428	3.294	20	30		EGEDHN
Cc1cc(C)cc(CC(=O)NCCCNCc2ccccc2C#N)c1	ZINC001165701937	1383327572	/nfs/dbraw/zinc/32/75/72/1383327572.db2.gz	AFWRCXKTHSZOLY-UHFFFAOYSA-N	0	3	335.451	3.014	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cc(F)ccc2OC)CC1	ZINC001166481962	1383427741	/nfs/dbraw/zinc/42/77/41/1383427741.db2.gz	YRACATKGHRGFNN-UHFFFAOYSA-N	0	3	340.826	3.077	20	30		EGEDHN
C=CCC1(C(=O)NCCC2(CNCc3ocnc3C)CC2)CCC1	ZINC001167035265	1383524689	/nfs/dbraw/zinc/52/46/89/1383524689.db2.gz	FAGRYFNENOOYCU-UHFFFAOYSA-N	0	3	331.460	3.106	20	30		EGEDHN
C=CCC1(C(=O)NCCC2(CNCc3conc3C)CC2)CCC1	ZINC001167035967	1383525186	/nfs/dbraw/zinc/52/51/86/1383525186.db2.gz	RZDSVGOPFNOHHH-UHFFFAOYSA-N	0	3	331.460	3.106	20	30		EGEDHN
C=CCC1(C(=O)NCCC2(CNCc3oc(C)nc3C)CC2)CCC1	ZINC001167035739	1383525241	/nfs/dbraw/zinc/52/52/41/1383525241.db2.gz	OJJBWKFYNMLMMD-UHFFFAOYSA-N	0	3	345.487	3.414	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)[C@@H]2C[C@]2(C)CC)CC1	ZINC001167583371	1383678882	/nfs/dbraw/zinc/67/88/82/1383678882.db2.gz	KUCMFCHSCBBARI-ZFWWWQNUSA-N	0	3	343.309	3.207	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@H](C)Cc2ccccc2)CC1	ZINC001168256874	1383855322	/nfs/dbraw/zinc/85/53/22/1383855322.db2.gz	ZINJOPPKDBMCBL-OAHLLOKOSA-N	0	3	334.891	3.494	20	30		EGEDHN
N#Cc1cccc(N2CCN([C@@H]3CCc4cc(F)ccc4C3)CC2)c1	ZINC001168448114	1383908828	/nfs/dbraw/zinc/90/88/28/1383908828.db2.gz	ZVWLKMFRHOWWSN-OAQYLSRUSA-N	0	3	335.426	3.377	20	30		EGEDHN
CN(C[C@H]1CCCN1C)c1nc2c(c(C#N)c1C#N)CCCCCC2	ZINC001307145978	1383944951	/nfs/dbraw/zinc/94/49/51/1383944951.db2.gz	RUNZQSBZLUQZIM-OAHLLOKOSA-N	0	3	337.471	3.014	20	30		EGEDHN
C[C@H]1C[C@H](N(C)Cc2cccc(C#N)c2)CN1C(=O)OC(C)(C)C	ZINC001168886476	1384046947	/nfs/dbraw/zinc/04/69/47/1384046947.db2.gz	YODCNYLPSXKABY-YOEHRIQHSA-N	0	3	329.444	3.388	20	30		EGEDHN
[NH3+]CCCc1nc2ccc(Cl)cc2n1-c1cccc(/C=N/[O-])c1	ZINC001168999543	1384083076	/nfs/dbraw/zinc/08/30/76/1384083076.db2.gz	MOIMIFDSMVKVSN-RGVLZGJSSA-N	0	3	328.803	3.378	20	30		EGEDHN
Cc1cccn2cc(CNc3ccc(/N=C/N(C)C)c(C#N)c3)nc12	ZINC001169021820	1384091575	/nfs/dbraw/zinc/09/15/75/1384091575.db2.gz	ABJMNLBWRLJLCG-LPYMAVHISA-N	0	3	332.411	3.348	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)Cc1coc2ccccc12	ZINC001169185069	1384120366	/nfs/dbraw/zinc/12/03/66/1384120366.db2.gz	PINVQUFKXNDVID-UHFFFAOYSA-N	0	3	347.418	3.143	20	30		EGEDHN
C[C@@H]1CCN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(CC#N)cc1	ZINC001169527865	1384156524	/nfs/dbraw/zinc/15/65/24/1384156524.db2.gz	QZZCZSDHCJPUER-DYESRHJHSA-N	0	3	347.462	3.393	20	30		EGEDHN
CC[C@H]1CCCC[C@H]1C(=O)NCCCNCc1ccccc1C#N	ZINC001169729618	1384179510	/nfs/dbraw/zinc/17/95/10/1384179510.db2.gz	NMTGVXKUHNGUBZ-QFBILLFUSA-N	0	3	327.472	3.371	20	30		EGEDHN
C[C@H](CCCCNCc1nsc2ccccc12)NC(=O)[C@@H](C)C#N	ZINC001169822189	1384188948	/nfs/dbraw/zinc/18/89/48/1384188948.db2.gz	RRKWCHCQSUGXHP-UONOGXRCSA-N	0	3	344.484	3.221	20	30		EGEDHN
CC(C)(Cc1ccccc1)C(=O)NCCCNCc1ccccc1C#N	ZINC001170352314	1384297885	/nfs/dbraw/zinc/29/78/85/1384297885.db2.gz	DPPQPGBIPLWDBT-UHFFFAOYSA-N	0	3	349.478	3.423	20	30		EGEDHN
CO[C@@H]1[C@@H](C)[C@H](NCc2cc(C#N)ccc2Br)C1(C)C	ZINC001170399143	1384307692	/nfs/dbraw/zinc/30/76/92/1384307692.db2.gz	HPRZORFWZHFFJC-NZVBXONLSA-N	0	3	337.261	3.470	20	30		EGEDHN
COc1nc(C)c(-n2c(-c3ccccc3)cnc2[C@H](C)N)c(C)c1C#N	ZINC001170681014	1384363841	/nfs/dbraw/zinc/36/38/41/1384363841.db2.gz	BQPJWPZUIIXNFX-ZDUSSCGKSA-N	0	3	347.422	3.451	20	30		EGEDHN
CCc1nnc(-n2c(-c3ccccc3)cnc2[C@H](C)N)c(C#N)c1CC	ZINC001170680596	1384364374	/nfs/dbraw/zinc/36/43/74/1384364374.db2.gz	AJXHXZPJVPHPNH-ZDUSSCGKSA-N	0	3	346.438	3.345	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)c1ccns1	ZINC001171077118	1384442216	/nfs/dbraw/zinc/44/22/16/1384442216.db2.gz	NYJWGHPMOHABNA-AWEZNQCLSA-N	0	3	342.468	3.093	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1CC[C@](O)(C(F)(F)F)[C@@H](C)C1	ZINC001171208837	1384469021	/nfs/dbraw/zinc/46/90/21/1384469021.db2.gz	FRTCZKDKTGJJMN-WOSRLPQWSA-N	0	3	326.362	3.124	20	30		EGEDHN
COC(=O)c1cccc2c1CCN([C@@H](C)Cc1cccc(C#N)c1)C2	ZINC001171232559	1384475680	/nfs/dbraw/zinc/47/56/80/1384475680.db2.gz	UCSARZODXFRDMF-HNNXBMFYSA-N	0	3	334.419	3.334	20	30		EGEDHN
N#Cc1coc(CNC2C[C@H]3CC[C@@H](C2)N3C(=O)c2ccccc2)c1	ZINC001171257559	1384480502	/nfs/dbraw/zinc/48/05/02/1384480502.db2.gz	USHZZHJKXWJNJC-AYHJJNSGSA-N	0	3	335.407	3.077	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)C(C)(C)c1ccccc1Cl	ZINC001171610587	1384579423	/nfs/dbraw/zinc/57/94/23/1384579423.db2.gz	TYUKQKAKJJBTHR-UHFFFAOYSA-N	0	3	329.271	3.466	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)c2ccccc2Cl)c(F)c1	ZINC001171813239	1384647961	/nfs/dbraw/zinc/64/79/61/1384647961.db2.gz	FFLHZEMFZOQWLF-UHFFFAOYSA-N	0	3	345.805	3.260	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)N1CC[C@H](N2CCCCC2)[C@@H](F)C1	ZINC001172317127	1384768548	/nfs/dbraw/zinc/76/85/48/1384768548.db2.gz	PNQBJMRBXFIQDK-VDGAXYAQSA-N	0	3	329.463	3.388	20	30		EGEDHN
Cc1nc(CO[C@@H]2CC[C@H]3[C@H]2OCCN3[C@H](C)CCCC#N)cs1	ZINC001172499982	1384805994	/nfs/dbraw/zinc/80/59/94/1384805994.db2.gz	VXFDCOXIRSPLDW-BVPBIZIASA-N	0	3	349.500	3.282	20	30		EGEDHN
CCn1c2ccccc2nc1N1CCN([C@@H](C)CCCC#N)CC1	ZINC001172508448	1384807522	/nfs/dbraw/zinc/80/75/22/1384807522.db2.gz	DDUXHORMWSSFKU-INIZCTEOSA-N	0	3	325.460	3.261	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H](NCc2ccc(F)cc2)C[C@H]1C#N	ZINC001172967094	1384891753	/nfs/dbraw/zinc/89/17/53/1384891753.db2.gz	GCNSFOVXNCSWPF-CVEARBPZSA-N	0	3	333.407	3.207	20	30		EGEDHN
CSC1CCN([C@H]2CCN(C(=O)OC(C)(C)C)[C@H](C#N)C2)CC1	ZINC001172983918	1384894939	/nfs/dbraw/zinc/89/49/39/1384894939.db2.gz	IADNHOSKVLHTGJ-KBPBESRZSA-N	0	3	339.505	3.105	20	30		EGEDHN
CCC(C)(C)C(=O)NC[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001317135465	1384898287	/nfs/dbraw/zinc/89/82/87/1384898287.db2.gz	KVYWKDYGIZHVJV-SFHVURJKSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=CCN1CCN([C@H](C)Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC001173083813	1384910063	/nfs/dbraw/zinc/91/00/63/1384910063.db2.gz	QKWORPIRAPOWDH-CQSZACIVSA-N	0	3	328.378	3.320	20	30		EGEDHN
C[C@H](CNC(=O)Cc1cccc(Cl)c1)NCc1ccc(C#N)s1	ZINC001317263367	1385032574	/nfs/dbraw/zinc/03/25/74/1385032574.db2.gz	CTEXPBISICFDBS-GFCCVEGCSA-N	0	3	347.871	3.110	20	30		EGEDHN
Cc1cnccc1Nc1ccc(I)cc1C#N	ZINC001174539213	1385117626	/nfs/dbraw/zinc/11/76/26/1385117626.db2.gz	YFRGSYFPXHHNFD-UHFFFAOYSA-N	0	3	335.148	3.032	20	30		EGEDHN
C=C[C@H](C(=O)NCC[C@H](C)NCc1nc(C)oc1C)c1ccccc1	ZINC001317415531	1385125530	/nfs/dbraw/zinc/12/55/30/1385125530.db2.gz	LPFDJTRKLXYVAT-KSSFIOAISA-N	0	3	341.455	3.246	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](C)CCCCNCc1cc(C)n(C)n1	ZINC001174651325	1385130593	/nfs/dbraw/zinc/13/05/93/1385130593.db2.gz	WMYIYSUOMDQAEN-HNNXBMFYSA-N	0	3	334.508	3.095	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H](C)CCCCN[C@H](C)c1nnc(C)[nH]1	ZINC001174694413	1385135702	/nfs/dbraw/zinc/13/57/02/1385135702.db2.gz	ODJXRADIKHDHQY-JKSUJKDBSA-N	0	3	347.507	3.022	20	30		EGEDHN
C=CCCCC(=O)N[C@H](C)CCCCNCc1cn(C(C)(C)C)nn1	ZINC001174979032	1385178051	/nfs/dbraw/zinc/17/80/51/1385178051.db2.gz	SSEZURNFTPRAPP-MRXNPFEDSA-N	0	3	349.523	3.154	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H](C)CCCCNCc1nccn1CC	ZINC001175083136	1385191965	/nfs/dbraw/zinc/19/19/65/1385191965.db2.gz	WFEMVYYVWAVKLT-QFBILLFUSA-N	0	3	334.508	3.270	20	30		EGEDHN
CCCN(CCNC(=O)[C@@H](C)C(F)(F)F)Cc1cccc(C#N)c1	ZINC001317543110	1385284091	/nfs/dbraw/zinc/28/40/91/1385284091.db2.gz	PBUSAZAMODSWMR-CYBMUJFWSA-N	0	3	341.377	3.085	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H](C)CCCCN[C@@H](C)c1nnc(CC)[nH]1	ZINC001175469038	1385302134	/nfs/dbraw/zinc/30/21/34/1385302134.db2.gz	MGYMCUOHZFKYBR-GJZGRUSLSA-N	0	3	349.523	3.295	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)[C@@H]1C[C@H]1C1CC1	ZINC001175643689	1385361380	/nfs/dbraw/zinc/36/13/80/1385361380.db2.gz	FOZJIVHRAUNHFU-RYGJVYDSSA-N	0	3	339.483	3.369	20	30		EGEDHN
Cc1[nH]nc2cc(Nc3ccc(N4CCN(C)CC4)c(C#N)c3)ccc12	ZINC001175662372	1385367003	/nfs/dbraw/zinc/36/70/03/1385367003.db2.gz	JJCQDJHDBGDKJC-UHFFFAOYSA-N	0	3	346.438	3.238	20	30		EGEDHN
CCN1CCN(c2ccc(Nc3nc(Cl)ccc3C#N)cc2)CC1	ZINC001175783462	1385404423	/nfs/dbraw/zinc/40/44/23/1385404423.db2.gz	LGAUQHLPDMHOFK-UHFFFAOYSA-N	0	3	341.846	3.492	20	30		EGEDHN
Cc1ncc(Nc2ccc(S(=O)(=O)OCC(C)(C)C)cc2)n1C	ZINC001176261561	1385530648	/nfs/dbraw/zinc/53/06/48/1385530648.db2.gz	DAZBIFKXZMQJSY-UHFFFAOYSA-N	0	3	337.445	3.224	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@@]1(C)CC=C(C)CC1	ZINC001176751767	1385682580	/nfs/dbraw/zinc/68/25/80/1385682580.db2.gz	FNYADJUZIRNPHE-HNNXBMFYSA-N	0	3	329.282	3.127	20	30		EGEDHN
C=C[C@@H](CC(=O)NCCCNCc1ccc(F)cn1)c1ccccc1	ZINC001176762418	1385687738	/nfs/dbraw/zinc/68/77/38/1385687738.db2.gz	BEUWIGICSXRWCX-INIZCTEOSA-N	0	3	341.430	3.177	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H](C)CCCCNC/C(Cl)=C\Cl	ZINC001176801697	1385706177	/nfs/dbraw/zinc/70/61/77/1385706177.db2.gz	PRJZSTWQXBJOJV-LFGHMXSPSA-N	0	3	337.291	3.163	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@H](C)OCC	ZINC001177225268	1385874346	/nfs/dbraw/zinc/87/43/46/1385874346.db2.gz	GKJKEEZPVPFHJR-HNNXBMFYSA-N	0	3	330.900	3.162	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)CC1(O)CCC1	ZINC001177311629	1385909143	/nfs/dbraw/zinc/90/91/43/1385909143.db2.gz	HYKSDZWXZCOUKW-UHFFFAOYSA-N	0	3	342.911	3.043	20	30		EGEDHN
Cc1cccc(F)c1C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001177459196	1385964140	/nfs/dbraw/zinc/96/41/40/1385964140.db2.gz	SFMVTYWOGOJFRX-UHFFFAOYSA-N	0	3	343.377	3.055	20	30		EGEDHN
N#CC(Cc1cccs1)C(=O)Nc1csc(Br)n1	ZINC001177903242	1386078355	/nfs/dbraw/zinc/07/83/55/1386078355.db2.gz	GHSLIRPFCBCODI-ZETCQYMHSA-N	0	3	342.243	3.288	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccc(F)cc2)CCN1C(=O)CC1CCCC1	ZINC001178046952	1386116078	/nfs/dbraw/zinc/11/60/78/1386116078.db2.gz	SCADOBWNEOLDTQ-JXFKEZNVSA-N	0	3	342.458	3.337	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccc(F)cc2)CCN1C(=O)[C@H]1CC=CCC1	ZINC001178099236	1386127998	/nfs/dbraw/zinc/12/79/98/1386127998.db2.gz	KFEPEKZDGNSBMS-QRFRQXIXSA-N	0	3	340.442	3.113	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](NCc2cccc(OC)c2Cl)[C@@H]1C	ZINC001178312240	1386185764	/nfs/dbraw/zinc/18/57/64/1386185764.db2.gz	UEOWYHSWSPJYBP-ZFWWWQNUSA-N	0	3	336.863	3.394	20	30		EGEDHN
C#CCCCC(=O)NCCCCCCNCc1ccccc1C#N	ZINC001178327901	1386190327	/nfs/dbraw/zinc/19/03/27/1386190327.db2.gz	SYSDOTVNSBMFGX-UHFFFAOYSA-N	0	3	325.456	3.128	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](N[C@H]2CCc3c2c(F)ccc3F)[C@@H]1C	ZINC001178576785	1386254334	/nfs/dbraw/zinc/25/43/34/1386254334.db2.gz	ABXFWIMTXWJAMX-KKXDTOCCSA-N	0	3	346.421	3.335	20	30		EGEDHN
C=C(C)CCC(=O)NCCCCCCNCc1cc2n(n1)CCCC2	ZINC001178599070	1386259639	/nfs/dbraw/zinc/25/96/39/1386259639.db2.gz	RKAKCZBIGUNWPV-UHFFFAOYSA-N	0	3	346.519	3.342	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@H](NCc2ccc(Cl)cc2F)[C@@H]1C	ZINC001178645153	1386267213	/nfs/dbraw/zinc/26/72/13/1386267213.db2.gz	GPHDWMOLWVNJOT-GUYCJALGSA-N	0	3	336.838	3.218	20	30		EGEDHN
C=CCn1cccc1C(=O)NCCCCCCNCc1cc(C)no1	ZINC001178701771	1386283563	/nfs/dbraw/zinc/28/35/63/1386283563.db2.gz	CZZBSVSBEASXTI-UHFFFAOYSA-N	0	3	344.459	3.051	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](NCc2cn(C(C)C)nc2C)[C@@H]1C	ZINC001178805990	1386311712	/nfs/dbraw/zinc/31/17/12/1386311712.db2.gz	QVSXQPLBPCSPCI-WMZOPIPTSA-N	0	3	332.492	3.208	20	30		EGEDHN
C#CCCCCCC(=O)NCCCCCCNCc1ocnc1C	ZINC001179239527	1386428887	/nfs/dbraw/zinc/42/88/87/1386428887.db2.gz	GICVSXPNYWKAPJ-UHFFFAOYSA-N	0	3	333.476	3.333	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)C[C@@H]1CC=CCC1	ZINC001179322619	1386451410	/nfs/dbraw/zinc/45/14/10/1386451410.db2.gz	RXPHJHLZWKHKTN-TYPHKJRUSA-N	0	3	336.479	3.364	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](NCc2cn(C(C)C)nc2C)[C@@H]1C	ZINC001179360107	1386462400	/nfs/dbraw/zinc/46/24/00/1386462400.db2.gz	OJOQEEHQBXHVGD-HKUYNNGSSA-N	0	3	344.503	3.045	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)CCCC(F)(F)F)C1CC1	ZINC001698648295	1406297252	/nfs/dbraw/zinc/29/72/52/1406297252.db2.gz	CSWMCXIKXNROSJ-CYBMUJFWSA-N	0	3	326.790	3.346	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](NCc2cc(F)ccc2OC)[C@@H]1C	ZINC001179391972	1386473071	/nfs/dbraw/zinc/47/30/71/1386473071.db2.gz	AWEMIZPWZODGAP-YJBOKZPZSA-N	0	3	346.446	3.107	20	30		EGEDHN
C=CCCC1(C(=O)NCCCCCCNCc2ccn(CC)n2)CC1	ZINC001179481869	1386494235	/nfs/dbraw/zinc/49/42/35/1386494235.db2.gz	NFKGSPCOHCBVEH-UHFFFAOYSA-N	0	3	346.519	3.416	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCCCCCNCc2nccn2CC)C1	ZINC001179533047	1386507889	/nfs/dbraw/zinc/50/78/89/1386507889.db2.gz	HCZYMUCAIBGLCO-UHFFFAOYSA-N	0	3	332.492	3.026	20	30		EGEDHN
N#Cc1ccc(F)cc1CNCCCCCCNC(=O)C1(CF)CC1	ZINC001179551938	1386512246	/nfs/dbraw/zinc/51/22/46/1386512246.db2.gz	AAMUFYSYQZLCPN-UHFFFAOYSA-N	0	3	349.425	3.213	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H]1C(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C	ZINC001179561874	1386515113	/nfs/dbraw/zinc/51/51/13/1386515113.db2.gz	UWIXVSTVISIUFC-KCLUMXDGSA-N	0	3	338.495	3.299	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCCCCCNCc1cn(C(C)C)nn1	ZINC001179693322	1386556618	/nfs/dbraw/zinc/55/66/18/1386556618.db2.gz	WVDFQUXIULJUKW-UHFFFAOYSA-N	0	3	349.523	3.228	20	30		EGEDHN
CCCCCCCCC(=O)N1CC[C@H](NCc2cncn2C)[C@@H]1C	ZINC001179994469	1386662530	/nfs/dbraw/zinc/66/25/30/1386662530.db2.gz	PZOGBHGKMSAJBZ-WMZOPIPTSA-N	0	3	334.508	3.250	20	30		EGEDHN
CCN(CCN[C@H](C)c1ccc(F)c(Cl)c1)C(=O)[C@H](C)C#N	ZINC001320694504	1386694400	/nfs/dbraw/zinc/69/44/00/1386694400.db2.gz	NUCHZYFZDBWMQX-VXGBXAGGSA-N	0	3	325.815	3.138	20	30		EGEDHN
CCN(CCN[C@@H](C)c1ccc(F)c(Cl)c1)C(=O)[C@H](C)C#N	ZINC001320694501	1386694487	/nfs/dbraw/zinc/69/44/87/1386694487.db2.gz	NUCHZYFZDBWMQX-NEPJUHHUSA-N	0	3	325.815	3.138	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)Cc2cncs2)CCCC[C@@H]1C	ZINC001698662503	1406313449	/nfs/dbraw/zinc/31/34/49/1406313449.db2.gz	RWYMKFOSOGTLHG-LRDDRELGSA-N	0	3	341.908	3.093	20	30		EGEDHN
C=CCCOCC(=O)N1CC[C@H](N[C@@H](C)c2ccccc2F)[C@@H]1C	ZINC001180264326	1386750495	/nfs/dbraw/zinc/75/04/95/1386750495.db2.gz	HTBUWYZVDUMDHX-MPGHIAIKSA-N	0	3	334.435	3.058	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2nc(C)sc2C)C1	ZINC001180846367	1386883041	/nfs/dbraw/zinc/88/30/41/1386883041.db2.gz	JXYKRRCUGVMFMD-FZKQIMNGSA-N	0	3	335.517	3.300	20	30		EGEDHN
CC(C)c1ccc(C(=O)N[C@H](C)CNCc2ccc(C#N)s2)nc1	ZINC001321645078	1386948287	/nfs/dbraw/zinc/94/82/87/1386948287.db2.gz	GJMRFXGMAUFXGM-CYBMUJFWSA-N	0	3	342.468	3.046	20	30		EGEDHN
C[C@@H](CNCc1ccc(F)c(C#N)c1)NC(=O)CCC1CCCC1	ZINC001321780395	1386983514	/nfs/dbraw/zinc/98/35/14/1386983514.db2.gz	ZGKDPMAKDNAKET-AWEZNQCLSA-N	0	3	331.435	3.262	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CC[C@@H](NCc2ccc(Cl)s2)C1	ZINC001181468979	1387000118	/nfs/dbraw/zinc/00/01/18/1387000118.db2.gz	GTSVWSPLNVZBHM-CHWSQXEVSA-N	0	3	342.892	3.073	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CC[C@@H](NCc2cc3ccccc3o2)C1	ZINC001181476853	1387001443	/nfs/dbraw/zinc/00/14/43/1387001443.db2.gz	UWKJLIMWLHRUBW-DOTOQJQBSA-N	0	3	342.439	3.105	20	30		EGEDHN
CCC[C@H](C)CC(=O)N1CC[C@@H](NCc2ccc(OC)c(C#N)c2)C1	ZINC001181502171	1387006451	/nfs/dbraw/zinc/00/64/51/1387006451.db2.gz	OCYOZLIQNDEXTK-MAUKXSAKSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](C)[C@](C)(CNCc2nccn2CC)C1	ZINC001181594355	1387022529	/nfs/dbraw/zinc/02/25/29/1387022529.db2.gz	NYRCKOYAHQSDIP-OXQOHEQNSA-N	0	3	346.519	3.080	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C1	ZINC001182841058	1387233195	/nfs/dbraw/zinc/23/31/95/1387233195.db2.gz	FXCKISPKTDUDGO-OAHLLOKOSA-N	0	3	329.469	3.079	20	30		EGEDHN
C=C(Br)CNC[C@H](C1CC1)N(C)C(=O)c1ccsc1	ZINC001331251247	1389667969	/nfs/dbraw/zinc/66/79/69/1389667969.db2.gz	APEXHVBTMCIYQL-CYBMUJFWSA-N	0	3	343.290	3.097	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccccc2-c2nccs2)CC1	ZINC001338526377	1389700765	/nfs/dbraw/zinc/70/07/65/1389700765.db2.gz	CEKIBBXSPAHAAL-UHFFFAOYSA-N	0	3	325.437	3.094	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N1CCC[C@@H]1C1CCC1	ZINC001338692949	1389734013	/nfs/dbraw/zinc/73/40/13/1389734013.db2.gz	HWUYRBLGDUMLQR-DLBZAZTESA-N	0	3	329.492	3.042	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N[C@H](COC)c1cccc(C(F)(F)F)c1	ZINC001339954749	1390198396	/nfs/dbraw/zinc/19/83/96/1390198396.db2.gz	HPYZDDVSDIPATN-HUUCEWRRSA-N	0	3	344.377	3.193	20	30		EGEDHN
COc1ccc(-c2nc(C)c([C@@H](C)NC[C@H](O)CC#N)s2)cc1	ZINC001332854858	1390201109	/nfs/dbraw/zinc/20/11/09/1390201109.db2.gz	URINNFGKHFBIMO-BXUZGUMPSA-N	0	3	331.441	3.052	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1nn(-c2ccc(Cl)cc2)cc1C	ZINC001340453535	1390291300	/nfs/dbraw/zinc/29/13/00/1390291300.db2.gz	SJOAUGXVKXDDIA-OAHLLOKOSA-N	0	3	332.835	3.456	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1Cl)C(=O)c1ccc(Cl)nc1	ZINC001343469792	1390716130	/nfs/dbraw/zinc/71/61/30/1390716130.db2.gz	IPABZJNIJNZGQH-SNVBAGLBSA-N	0	3	334.162	3.350	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)[C@@H]2CCC[C@H]2OC)cc1	ZINC001343590164	1390724801	/nfs/dbraw/zinc/72/48/01/1390724801.db2.gz	LODGWTMBSOKVMN-KZNAEPCWSA-N	0	3	342.439	3.492	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCc1cccc(OC(C)(C)C)n1	ZINC001344875169	1390821069	/nfs/dbraw/zinc/82/10/69/1390821069.db2.gz	NNIMONSAQJMIIF-HNNXBMFYSA-N	0	3	340.427	3.284	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)Cc1cccc(Br)c1	ZINC001345646935	1390871849	/nfs/dbraw/zinc/87/18/49/1390871849.db2.gz	QYHDQCPBNSLQCV-CYBMUJFWSA-N	0	3	332.201	3.084	20	30		EGEDHN
Cn1c(Cl)cnc1C(C#N)=C([O-])c1ccc(C[NH+]2CCCC2)cc1	ZINC001346095761	1390907066	/nfs/dbraw/zinc/90/70/66/1390907066.db2.gz	IMXLRAHAWPRAPJ-OAHLLOKOSA-N	0	3	342.830	3.159	20	30		EGEDHN
Cn1c(Cl)cnc1[C@H](C#N)C(=O)c1ccc(CN2CCCC2)cc1	ZINC001346095761	1390907068	/nfs/dbraw/zinc/90/70/68/1390907068.db2.gz	IMXLRAHAWPRAPJ-OAHLLOKOSA-N	0	3	342.830	3.159	20	30		EGEDHN
CCCN1CCCC[C@@H]1C(=O)N[C@@H]1CCCc2cc(C#N)ccc21	ZINC001348538142	1391234260	/nfs/dbraw/zinc/23/42/60/1391234260.db2.gz	UTSFFIAFEBFOHF-RTBURBONSA-N	0	3	325.456	3.316	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCCc1ccc(OC)c(OC)c1	ZINC001349702995	1391355841	/nfs/dbraw/zinc/35/58/41/1391355841.db2.gz	UNFVAUKUIPFEEM-HNNXBMFYSA-N	0	3	341.411	3.119	20	30		EGEDHN
N#CC(C(=O)CCc1ccc2c(c1)CCO2)c1nc2ccccc2[nH]1	ZINC001353991595	1392111814	/nfs/dbraw/zinc/11/18/14/1392111814.db2.gz	YCALHSNXOFBHJH-HNNXBMFYSA-N	0	3	331.375	3.307	20	30		EGEDHN
Cc1ccc(C(=O)N(C)[C@@H](C)CNCc2ccc(C#N)s2)cc1C	ZINC001698857754	1406566376	/nfs/dbraw/zinc/56/63/76/1406566376.db2.gz	XZHVHMYCDGZWPJ-HNNXBMFYSA-N	0	3	341.480	3.487	20	30		EGEDHN
C[C@H](NC(=O)C(C)(C)C)[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001480388663	1392733919	/nfs/dbraw/zinc/73/39/19/1392733919.db2.gz	ZKKAAYGFXXUNMW-YJBOKZPZSA-N	0	3	327.472	3.321	20	30		EGEDHN
CCC[C@H](CC)C(=O)N1CC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001480622266	1392825832	/nfs/dbraw/zinc/82/58/32/1392825832.db2.gz	IDRBZZBJUTWZHK-RDJZCZTQSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)Cc1c[nH]c2ccc(F)cc12	ZINC001480795619	1392939037	/nfs/dbraw/zinc/93/90/37/1392939037.db2.gz	WFYJSPHBHWDPNC-GFCCVEGCSA-N	0	3	337.826	3.086	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1cc(C)nc2ccccc21	ZINC001480809910	1392947861	/nfs/dbraw/zinc/94/78/61/1392947861.db2.gz	MAPFGUJXTJOADB-CYBMUJFWSA-N	0	3	331.847	3.394	20	30		EGEDHN
C[C@H](C#N)C(=O)N(C)C1CCN(CCCc2ccccc2Cl)CC1	ZINC001490402814	1394215897	/nfs/dbraw/zinc/21/58/97/1394215897.db2.gz	WIZMYLIROINZBI-OAHLLOKOSA-N	0	3	347.890	3.355	20	30		EGEDHN
CC1(C(=O)NCC[C@@H]2CCN(Cc3ccc(F)c(C#N)c3)C2)CCC1	ZINC001481447941	1394301326	/nfs/dbraw/zinc/30/13/26/1394301326.db2.gz	UPPGVHRLLJXSRZ-OAHLLOKOSA-N	0	3	343.446	3.216	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2ccc(C)c(OC)c2)CCCC1	ZINC001481901515	1394586760	/nfs/dbraw/zinc/58/67/60/1394586760.db2.gz	GMBJHGPGPADTBW-UHFFFAOYSA-N	0	3	336.863	3.388	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)Cc2noc3ccccc32)CCCC1	ZINC001481901398	1394586952	/nfs/dbraw/zinc/58/69/52/1394586952.db2.gz	FEWKFPVVDMTINS-UHFFFAOYSA-N	0	3	347.846	3.141	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1ccc(C(F)F)nc1)C1CC1	ZINC001481931329	1394601204	/nfs/dbraw/zinc/60/12/04/1394601204.db2.gz	SRLPQLSFHZDSMV-INIZCTEOSA-N	0	3	343.805	3.260	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)N(C)C(=O)C(C)(C)C1CCC1	ZINC001482314003	1394886084	/nfs/dbraw/zinc/88/60/84/1394886084.db2.gz	NYOJKPJEACQXAE-ZDUSSCGKSA-N	0	3	333.501	3.383	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)NCC1(NCc2ccc(F)c(C#N)c2)CCC1	ZINC001484654135	1395464044	/nfs/dbraw/zinc/46/40/44/1395464044.db2.gz	ZFUUFOCRUUDZSI-CQSZACIVSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](C2CCN(C(=O)CCCF)CC2)C1	ZINC001485085274	1395654513	/nfs/dbraw/zinc/65/45/13/1395654513.db2.gz	SYTINKJBSMKHEU-INIZCTEOSA-N	0	3	330.875	3.439	20	30		EGEDHN
C=C(Br)CNCC(C)(C)CN(C)C(=O)CCC(C)C	ZINC001485244845	1395737818	/nfs/dbraw/zinc/73/78/18/1395737818.db2.gz	NJFPDGVNDWGMPF-UHFFFAOYSA-N	0	3	333.314	3.405	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)C(C)(C)C(F)F)CCN1Cc1ccc(C#N)cc1	ZINC001502989849	1396238456	/nfs/dbraw/zinc/23/84/56/1396238456.db2.gz	QNYUYQTVJPKWLM-BBRMVZONSA-N	0	3	349.425	3.319	20	30		EGEDHN
C#CCCCCC(=O)N1CCCC[C@H]1CNCc1c(C)nsc1C	ZINC001505403871	1396290454	/nfs/dbraw/zinc/29/04/54/1396290454.db2.gz	SKGHVGWRONIAQS-KRWDZBQOSA-N	0	3	347.528	3.424	20	30		EGEDHN
CCN(CCNC(=O)Cc1cccc(C)c1)Cc1cccc(C#N)c1	ZINC001493010892	1396331999	/nfs/dbraw/zinc/33/19/99/1396331999.db2.gz	HHFKEUFZQYLQJU-UHFFFAOYSA-N	0	3	335.451	3.048	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2cc(-c3ccco3)on2)CCCC1	ZINC001495193713	1396522532	/nfs/dbraw/zinc/52/25/32/1396522532.db2.gz	CFEMLIGGXMRJNU-UHFFFAOYSA-N	0	3	349.818	3.319	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2ncccc2F)CCCC[C@@H]1C	ZINC001495325060	1396533195	/nfs/dbraw/zinc/53/31/95/1396533195.db2.gz	LDZQONURXLKHOL-SJCJKPOMSA-N	0	3	339.842	3.242	20	30		EGEDHN
CCC(CC)C(=O)NC[C@@H](NCc1ccc(C#N)cc1F)C(C)C	ZINC001496532318	1396714041	/nfs/dbraw/zinc/71/40/41/1396714041.db2.gz	IUOXDZWABGQAEJ-GOSISDBHSA-N	0	3	333.451	3.364	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)NC(=O)CCCc1ccccc1	ZINC001497896239	1396876441	/nfs/dbraw/zinc/87/64/41/1396876441.db2.gz	VJFYEAHEPNRXGU-OAHLLOKOSA-N	0	3	341.480	3.237	20	30		EGEDHN
C=C(Br)CN[C@H](C)[C@H]1CCCCN1C(=O)c1ccco1	ZINC001689897359	1404192620	/nfs/dbraw/zinc/19/26/20/1404192620.db2.gz	XCQIXZKUMGJEAS-CHWSQXEVSA-N	0	3	341.249	3.161	20	30		EGEDHN
CCC1(C(=O)NC[C@H](NCc2cc(C#N)ccc2F)C2CC2)CCC1	ZINC001690164807	1404363416	/nfs/dbraw/zinc/36/34/16/1404363416.db2.gz	NKUQDLRLQQOPOZ-SFHVURJKSA-N	0	3	343.446	3.262	20	30		EGEDHN
Cc1ccc(C)c(C(=O)NC[C@@H](C)NCc2ccc(F)c(C#N)c2)c1	ZINC001690641609	1404673784	/nfs/dbraw/zinc/67/37/84/1404673784.db2.gz	NOLSFDSJEHZTRY-OAHLLOKOSA-N	0	3	339.414	3.222	20	30		EGEDHN
C=C(Br)CN[C@@H](C)CCNC(=O)c1cc(C)cs1	ZINC001690841064	1404771883	/nfs/dbraw/zinc/77/18/83/1404771883.db2.gz	DQLPMIJAVKXNMB-NSHDSACASA-N	0	3	331.279	3.063	20	30		EGEDHN
C[C@H](CCNC(=O)C(C)(C)C(F)(F)F)NCc1ccccc1C#N	ZINC001690875773	1404789992	/nfs/dbraw/zinc/78/99/92/1404789992.db2.gz	AHPSZKPCSNYQTA-GFCCVEGCSA-N	0	3	341.377	3.131	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)C[C@@H]2CCc3ccccc3C2)C1	ZINC001691124843	1405065648	/nfs/dbraw/zinc/06/56/48/1405065648.db2.gz	XZMHVOIIWQAFQD-MDZRGWNJSA-N	0	3	346.902	3.419	20	30		EGEDHN
CCC(C)(C)C(=O)NCC[C@H]1CCN(Cc2ccc(F)c(C#N)c2)C1	ZINC001691905699	1405631074	/nfs/dbraw/zinc/63/10/74/1405631074.db2.gz	ZLWHNFINOYWQMC-HNNXBMFYSA-N	0	3	345.462	3.462	20	30		EGEDHN
CC(C)CCC(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1	ZINC001692332094	1405951312	/nfs/dbraw/zinc/95/13/12/1405951312.db2.gz	GISUYFUMQNBVDY-UHFFFAOYSA-N	0	3	331.435	3.118	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@H]1CC[C@H](N[C@H](C)c2nc3ccccc3o2)CC1	ZINC001732305895	1428521726	/nfs/dbraw/zinc/52/17/26/1428521726.db2.gz	JEQWEUVRBOBFOF-KBUPBQIOSA-N	0	3	340.427	3.065	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccnc3ccncc32)CCCC1	ZINC001732394443	1428562626	/nfs/dbraw/zinc/56/26/26/1428562626.db2.gz	WXPBNVGLIAKDII-UHFFFAOYSA-N	0	3	344.846	3.015	20	30		EGEDHN
CC(C)(CC(=O)NCC1(NCc2ccc(F)c(C#N)c2)CC1)C1CC1	ZINC001699652660	1413035058	/nfs/dbraw/zinc/03/50/58/1413035058.db2.gz	WUJDYOCPNJHODV-UHFFFAOYSA-N	0	3	343.446	3.262	20	30		EGEDHN
CC1(C)CC(C(=O)NCC2(NCc3ccc(C#N)s3)CCC2)C1	ZINC001700131260	1413547059	/nfs/dbraw/zinc/54/70/59/1413547059.db2.gz	PJKWIVBPKGRGIT-UHFFFAOYSA-N	0	3	331.485	3.184	20	30		EGEDHN
CCC(C)(C)C(=O)N(C)CCCN(C)Cc1ccc(OC)c(C#N)c1	ZINC001700191400	1413621086	/nfs/dbraw/zinc/62/10/86/1413621086.db2.gz	ATERKWLHAMWNEO-UHFFFAOYSA-N	0	3	345.487	3.283	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1c[nH]c2ncccc12	ZINC001707434456	1417338768	/nfs/dbraw/zinc/33/87/68/1417338768.db2.gz	KOCADIIDOYNZLQ-XJKSGUPXSA-N	0	3	346.862	3.288	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1scnc1C	ZINC001712995298	1417546433	/nfs/dbraw/zinc/54/64/33/1417546433.db2.gz	XAJKOVHAACYAFH-DGCLKSJQSA-N	0	3	327.881	3.177	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1ccc2cc[nH]c2n1	ZINC001712998399	1417550330	/nfs/dbraw/zinc/55/03/30/1417550330.db2.gz	GTQODNVVUSIZOV-CZUORRHYSA-N	0	3	346.862	3.288	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)C[C@@H](C)c2cccc(OC)c2)C1	ZINC001713065635	1417623377	/nfs/dbraw/zinc/62/33/77/1417623377.db2.gz	YEOGJEPYJIUDES-AEFFLSMTSA-N	0	3	330.472	3.346	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCN(C(=O)CCCC2CC2)C1	ZINC001713240000	1417826317	/nfs/dbraw/zinc/82/63/17/1417826317.db2.gz	ZNJUFJMMVREZBW-SFHVURJKSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)Cc1ccc(C)c(Cl)c1	ZINC001713410064	1418033228	/nfs/dbraw/zinc/03/32/28/1418033228.db2.gz	FDOCKOOYUWJWDM-ZDUSSCGKSA-N	0	3	329.271	3.428	20	30		EGEDHN
CCCN(CCNC(=O)C1(F)CCCC1)Cc1ccc(F)c(C#N)c1	ZINC001713547541	1418320816	/nfs/dbraw/zinc/32/08/16/1418320816.db2.gz	AOTJDKIIPROPFR-UHFFFAOYSA-N	0	3	349.425	3.308	20	30		EGEDHN
Cc1cc(C(=O)NCC[C@@H]2CCN(Cc3ccc(C#N)s3)C2)co1	ZINC001713729649	1418514939	/nfs/dbraw/zinc/51/49/39/1418514939.db2.gz	ZQXSQAVWBADHTO-CQSZACIVSA-N	0	3	343.452	3.163	20	30		EGEDHN
CC[C@H](CNC(=O)c1cc(C#N)c[nH]1)N[C@@H](C)c1ccccc1Cl	ZINC001714065323	1418861867	/nfs/dbraw/zinc/86/18/67/1418861867.db2.gz	MEWIFJJAJXOGID-GXTWGEPZSA-N	0	3	344.846	3.399	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1cc(C(C)(C)C)on1)C1CC1	ZINC001714167739	1418976680	/nfs/dbraw/zinc/97/66/80/1418976680.db2.gz	YAQOCCJGKUURCX-QGZVFWFLSA-N	0	3	339.867	3.213	20	30		EGEDHN
Cc1cc(C)cc(C(=O)NC[C@@H](C)NCc2ccc(C#N)s2)c1	ZINC001714295576	1419074506	/nfs/dbraw/zinc/07/45/06/1419074506.db2.gz	RXOKLVKZTSOTRH-CQSZACIVSA-N	0	3	327.453	3.145	20	30		EGEDHN
CC(F)(F)CC(=O)N[C@H]1CCC[C@@H](NCc2ccccc2C#N)C1	ZINC001714410013	1419149602	/nfs/dbraw/zinc/14/96/02/1419149602.db2.gz	CNCSVVBWUGJXFY-CVEARBPZSA-N	0	3	335.398	3.121	20	30		EGEDHN
Cc1ccc(F)c(C(=O)NC[C@H](C)CNCc2ccccc2C#N)c1	ZINC001714434537	1419167605	/nfs/dbraw/zinc/16/76/05/1419167605.db2.gz	RQBHXBNBJHUPGU-OAHLLOKOSA-N	0	3	339.414	3.162	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)COC2CCCCC2)CCCC1	ZINC001714495588	1419219577	/nfs/dbraw/zinc/21/95/77/1419219577.db2.gz	IJDJNHGDANRMMG-UHFFFAOYSA-N	0	3	328.884	3.107	20	30		EGEDHN
CCCC1(C(=O)N(C)[C@H](C)CNCc2ccc(F)c(C#N)c2)CC1	ZINC001714745500	1419491366	/nfs/dbraw/zinc/49/13/66/1419491366.db2.gz	IIJQLXYOWCUGFA-CQSZACIVSA-N	0	3	331.435	3.214	20	30		EGEDHN
CC1(C)CC(C(=O)NCC[C@@H]2CCN(Cc3ccccc3C#N)C2)C1	ZINC001714871004	1419600997	/nfs/dbraw/zinc/60/09/97/1419600997.db2.gz	HYFDZKSQPDTKJB-MRXNPFEDSA-N	0	3	339.483	3.323	20	30		EGEDHN
CC(C)(C(=O)NCC[C@H]1CCN(Cc2ccccc2C#N)C1)C(F)F	ZINC001714876152	1419609926	/nfs/dbraw/zinc/60/99/26/1419609926.db2.gz	LLPKGZXZHGTPIR-AWEZNQCLSA-N	0	3	349.425	3.178	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)[C@@H](CC)OC2CCCC2)CCCC1	ZINC001715107027	1419849062	/nfs/dbraw/zinc/84/90/62/1419849062.db2.gz	UTNDEHPTWLFVEU-MRXNPFEDSA-N	0	3	342.911	3.495	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1cccc2[nH]c(C)nc21)C1CC1	ZINC001715117105	1419861422	/nfs/dbraw/zinc/86/14/22/1419861422.db2.gz	AMICJVKQRNAVQC-SFHVURJKSA-N	0	3	346.862	3.112	20	30		EGEDHN
Cc1cc(CNCc2ccc(CNC(=O)[C@H](C)C#N)cc2)c(C)s1	ZINC001715196525	1419928185	/nfs/dbraw/zinc/92/81/85/1419928185.db2.gz	ZSPOKDFUKXRNML-CYBMUJFWSA-N	0	3	341.480	3.431	20	30		EGEDHN
CCc1ccccc1CC(=O)NC[C@H](C)CNCc1ccccc1C#N	ZINC001715231405	1419963515	/nfs/dbraw/zinc/96/35/15/1419963515.db2.gz	AMXFEMYHMKYLHX-QGZVFWFLSA-N	0	3	349.478	3.205	20	30		EGEDHN
C=C(Br)CNC[C@H]1[C@H](C)CCCN1C(=O)CCC1CC1	ZINC001715350505	1420051478	/nfs/dbraw/zinc/05/14/78/1420051478.db2.gz	BJEJNSKVRPYBKR-DOMZBBRYSA-N	0	3	343.309	3.302	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1ncccc1C(F)(F)F)C(C)C	ZINC001715693133	1420297757	/nfs/dbraw/zinc/29/77/57/1420297757.db2.gz	VMAKPDLVKFWRKE-GFCCVEGCSA-N	0	3	349.784	3.197	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccccc1C1CC1)NC(=O)c1cc(C#N)c[nH]1	ZINC001716017666	1420472210	/nfs/dbraw/zinc/47/22/10/1420472210.db2.gz	TYIMZNQNCVGXCD-AWEZNQCLSA-N	0	3	336.439	3.014	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC1(C)CCN(C/C=C\c2ccc(Cl)cc2)CC1	ZINC001716794578	1420927516	/nfs/dbraw/zinc/92/75/16/1420927516.db2.gz	ODZVLBKBTKOREF-JZIMQPMSSA-N	0	3	345.874	3.484	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC1(C)CCN(Cc2cc3ccccc3o2)CC1	ZINC001716794551	1420927680	/nfs/dbraw/zinc/92/76/80/1420927680.db2.gz	NBNJNNAAVDVGST-AWEZNQCLSA-N	0	3	325.412	3.063	20	30		EGEDHN
C[C@H]1C[C@H](NCc2ccc(F)c(C#N)c2)CN1C(=O)CCC1(C)CC1	ZINC001717825136	1421640152	/nfs/dbraw/zinc/64/01/52/1421640152.db2.gz	BEUGHVNQODPQDL-YOEHRIQHSA-N	0	3	343.446	3.357	20	30		EGEDHN
Cc1coc(C(=O)N2CC[C@@](C)(CNCc3ccccc3C#N)C2)c1	ZINC001733434368	1429641612	/nfs/dbraw/zinc/64/16/12/1429641612.db2.gz	GASHKNBMDPZUSI-FQEVSTJZSA-N	0	3	337.423	3.102	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)c1ccc(F)cc1F	ZINC001722915212	1424249107	/nfs/dbraw/zinc/24/91/07/1424249107.db2.gz	VMUPWDROYRCUDU-CYBMUJFWSA-N	0	3	343.377	3.087	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)CCCc3ccccc3)CC2)cc1	ZINC001723554163	1424462435	/nfs/dbraw/zinc/46/24/35/1424462435.db2.gz	GYKUHTHGDZXHOC-UHFFFAOYSA-N	0	3	347.462	3.320	20	30		EGEDHN
CC(C)SCC(=O)N1CC[C@@H]([C@H](C)NCc2ccccc2C#N)C1	ZINC001733523307	1429731500	/nfs/dbraw/zinc/73/15/00/1429731500.db2.gz	BASJTOVNKMNVIJ-MAUKXSAKSA-N	0	3	345.512	3.026	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)CCC2CC2)CCN1Cc1cccc(C#N)c1	ZINC001724988171	1425388172	/nfs/dbraw/zinc/38/81/72/1425388172.db2.gz	FNKNLCKQPAMWAK-KXBFYZLASA-N	0	3	325.456	3.218	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1cnn(C2CCC2)c1	ZINC001725183940	1425713289	/nfs/dbraw/zinc/71/32/89/1425713289.db2.gz	PLGBVFRBLGUGPT-UHFFFAOYSA-N	0	3	338.883	3.048	20	30		EGEDHN
CCc1ccc(C(=O)NC[C@@H](C)N(C)Cc2cccc(C#N)c2)cc1	ZINC001725195394	1425748119	/nfs/dbraw/zinc/74/81/19/1425748119.db2.gz	MYUDHEGJDHJCPG-MRXNPFEDSA-N	0	3	335.451	3.371	20	30		EGEDHN
C[C@H]1[C@H](NCc2ccc(C#N)s2)CCN1C(=O)CCC(C)(F)F	ZINC001725567830	1426228865	/nfs/dbraw/zinc/22/88/65/1426228865.db2.gz	UQFLDZOJDAKYHB-SMDDNHRTSA-N	0	3	341.427	3.134	20	30		EGEDHN
CN(C(=O)C(C)(C)C(F)F)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001731349558	1427287989	/nfs/dbraw/zinc/28/79/89/1427287989.db2.gz	JVMBBNOQUJAUGP-UHFFFAOYSA-N	0	3	349.425	3.272	20	30		EGEDHN
C#CCCN1CCC[C@H](NC(=O)[C@H](c2ccc(F)cc2)C(C)C)C1	ZINC001731372734	1427302209	/nfs/dbraw/zinc/30/22/09/1427302209.db2.gz	IATGAGBDXMDGFM-OALUTQOASA-N	0	3	330.447	3.169	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@H](CNC(=O)CC3CCCC3)C2)c1	ZINC001731495527	1427471147	/nfs/dbraw/zinc/47/11/47/1427471147.db2.gz	VMABXMCDQICCIJ-FQEVSTJZSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)Cc2occc2C)CC1	ZINC001733919463	1437732518	/nfs/dbraw/zinc/73/25/18/1437732518.db2.gz	BZUQWFNSJLQSNF-UHFFFAOYSA-N	0	3	338.879	3.444	20	30		EGEDHN
COc1ccc(CN[C@@H]2C[C@@H](C)N(C(=O)CCC(C)C)C2)cc1C#N	ZINC001734407129	1438085020	/nfs/dbraw/zinc/08/50/20/1438085020.db2.gz	SZFLERHMFCBMQP-CRAIPNDOSA-N	0	3	343.471	3.082	20	30		EGEDHN
C=C(Br)CNC[C@@H](NC(=O)c1occc1C)C(C)(C)C	ZINC001734557164	1438155894	/nfs/dbraw/zinc/15/58/94/1438155894.db2.gz	FWQXNUJFFMOUJW-GFCCVEGCSA-N	0	3	343.265	3.231	20	30		EGEDHN
CN(CCCNC(=O)[C@@H]1CCC(C)(C)C1)Cc1ccc(C#N)c(F)c1	ZINC001752057733	1440136843	/nfs/dbraw/zinc/13/68/43/1440136843.db2.gz	ADUZOUGJPLNEHJ-MRXNPFEDSA-N	0	3	345.462	3.462	20	30		EGEDHN
C#CCCCC(=O)N1CCCC[C@H]1[C@H](C)NCC=C(Cl)Cl	ZINC001752144191	1440145454	/nfs/dbraw/zinc/14/54/54/1440145454.db2.gz	CFTJLDKTUPEVFP-KBPBESRZSA-N	0	3	331.287	3.468	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N2CCCC[C@@H]2[C@@H](C)NCCF)cc1	ZINC001752146456	1440145996	/nfs/dbraw/zinc/14/59/96/1440145996.db2.gz	LULGLKQDFLHMRK-VQIMIIECSA-N	0	3	346.446	3.031	20	30		EGEDHN
C=C(C)CCC(=O)N1CCCC[C@@H]1[C@H](C)NCc1cccnc1OC	ZINC001752146102	1440146076	/nfs/dbraw/zinc/14/60/76/1440146076.db2.gz	IXDWOJKQBWHWMC-FUHWJXTLSA-N	0	3	345.487	3.306	20	30		EGEDHN
CC(C)C#CC(=O)N(C)C1CCN([C@@H]2CCc3c2cccc3F)CC1	ZINC001752299559	1440167232	/nfs/dbraw/zinc/16/72/32/1440167232.db2.gz	HKKHDILCJAZHDG-HXUWFJFHSA-N	0	3	342.458	3.395	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2CC23CCN(Cc2ccccn2)CC3)CCC1	ZINC001752426301	1440177266	/nfs/dbraw/zinc/17/72/66/1440177266.db2.gz	VVWXODPKACOMKH-SFHVURJKSA-N	0	3	339.483	3.299	20	30		EGEDHN
C=CCN1CCC(N(CCC)C(=O)Cc2sc(C)nc2C)CC1	ZINC001752440404	1440181266	/nfs/dbraw/zinc/18/12/66/1440181266.db2.gz	WKPCTYNJVHJMGE-UHFFFAOYSA-N	0	3	335.517	3.191	20	30		EGEDHN
C=C(C)CN1CCC(N(CCC)C(=O)CCc2cscn2)CC1	ZINC001752441248	1440181410	/nfs/dbraw/zinc/18/14/10/1440181410.db2.gz	CEMMXYNYGRARLF-UHFFFAOYSA-N	0	3	335.517	3.355	20	30		EGEDHN
CC(C)C(C)(C)C(=O)NC[C@@H](NCC#Cc1ccccc1)C1CC1	ZINC001752458697	1440183501	/nfs/dbraw/zinc/18/35/01/1440183501.db2.gz	HBQWLLOMFMUXLE-LJQANCHMSA-N	0	3	326.484	3.205	20	30		EGEDHN
C=C[C@H](C(=O)NC[C@@H](NCc1cncs1)C1CC1)c1ccccc1	ZINC001752500668	1440188369	/nfs/dbraw/zinc/18/83/69/1440188369.db2.gz	XLNAESSJFRWWOV-ZWKOTPCHSA-N	0	3	341.480	3.097	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@H](NCc1ccc(Cl)nc1)C1CC1	ZINC001752509019	1440190115	/nfs/dbraw/zinc/19/01/15/1440190115.db2.gz	BIDXRDHYBXPDDW-HNNXBMFYSA-N	0	3	335.879	3.322	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)c1cc2c([nH]1)CCC2	ZINC001752543022	1440194662	/nfs/dbraw/zinc/19/46/62/1440194662.db2.gz	JMOVFSDNDCYADW-BHYGNILZSA-N	0	3	327.472	3.147	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1C[C@H](NCc2cccc(F)c2Cl)C1	ZINC001752626517	1440196987	/nfs/dbraw/zinc/19/69/87/1440196987.db2.gz	SFHTXTIEIXRLRL-SHTZXODSSA-N	0	3	336.838	3.410	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N[C@H]1C[C@H](N[C@@H](C)c2ccccc2F)C1)OCC	ZINC001752634853	1440197272	/nfs/dbraw/zinc/19/72/72/1440197272.db2.gz	QYYVMFNQIVHVJJ-FPXQBCRKSA-N	0	3	348.462	3.495	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@H]2CN(Cc3ccccn3)CC[C@@H]21	ZINC001752704252	1440202186	/nfs/dbraw/zinc/20/21/86/1440202186.db2.gz	CPCPZZKMPJWOHP-HKUYNNGSSA-N	0	3	341.499	3.497	20	30		EGEDHN
CC[C@H]1CCC[C@]1(C)C(=O)N[C@H]1C[C@@H](NCC#Cc2ccccc2)C1	ZINC001752738556	1440204457	/nfs/dbraw/zinc/20/44/57/1440204457.db2.gz	ZEJCRSOFUSZSHI-KEZQHZCBSA-N	0	3	338.495	3.491	20	30		EGEDHN
CCCCCCCN1CCCC[C@H]1CNC(=O)c1c[nH]c(C)cc1=O	ZINC001752823923	1440222477	/nfs/dbraw/zinc/22/24/77/1440222477.db2.gz	MSTUAKJDMMWSET-KRWDZBQOSA-N	0	3	347.503	3.238	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)Cc2cccc(C(F)F)c2)C1	ZINC001752836433	1440227910	/nfs/dbraw/zinc/22/79/10/1440227910.db2.gz	NDZPUQSFNXPXMP-QAPCUYQASA-N	0	3	348.437	3.407	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H](C)[C@H]1CCCN(Cc2cncc(C)c2)C1	ZINC001752839196	1440229581	/nfs/dbraw/zinc/22/95/81/1440229581.db2.gz	CGFFABHFJMIWDY-WMZOPIPTSA-N	0	3	329.488	3.319	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)C2(C(F)F)CCCC2)C1	ZINC001752840936	1440230537	/nfs/dbraw/zinc/23/05/37/1440230537.db2.gz	NGIWOJNHFOEXOJ-LSDHHAIUSA-N	0	3	326.431	3.052	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC1CCC(N[C@H](C)c2cnc(C)cn2)CC1	ZINC001752850160	1440233441	/nfs/dbraw/zinc/23/34/41/1440233441.db2.gz	MVKOBGNFCFMPED-KLAILNCOSA-N	0	3	344.503	3.465	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)[C@H](C)C(C)C)CC1	ZINC001752852890	1440233982	/nfs/dbraw/zinc/23/39/82/1440233982.db2.gz	VJMWSIQTHMRATA-IYXRBSQSSA-N	0	3	331.298	3.204	20	30		EGEDHN
C[C@H](CNC(=O)[C@H]1CCC=CCCC1)NCc1ccc(C#N)s1	ZINC001752883917	1440239540	/nfs/dbraw/zinc/23/95/40/1440239540.db2.gz	NAETYMFKCTYOCQ-CABCVRRESA-N	0	3	331.485	3.351	20	30		EGEDHN
C[C@H](CNC(=O)[C@@H]1CC[C@@H]2C[C@@H]2CC1)NCc1ccc(C#N)s1	ZINC001752889359	1440240440	/nfs/dbraw/zinc/24/04/40/1440240440.db2.gz	PMCAVQLAXCUCLZ-TUVASFSCSA-N	0	3	331.485	3.040	20	30		EGEDHN
Cc1ccc(F)c(C(=O)NC[C@@H](C)NCc2ccc(C#N)c(F)c2)c1	ZINC001752903265	1440243554	/nfs/dbraw/zinc/24/35/54/1440243554.db2.gz	HAZYNTHXNARYIB-CYBMUJFWSA-N	0	3	343.377	3.053	20	30		EGEDHN
Cc1cc(C)cc(C(=O)NC[C@@H](C)NCc2ccc(F)c(C#N)c2)c1	ZINC001752913895	1440246433	/nfs/dbraw/zinc/24/64/33/1440246433.db2.gz	MUWPDZHFIHBDBM-OAHLLOKOSA-N	0	3	339.414	3.222	20	30		EGEDHN
Cc1csc(CN[C@H]2CCC[C@@H](NC(=O)C#CC(C)(C)C)C2)n1	ZINC001752970034	1440254840	/nfs/dbraw/zinc/25/48/40/1440254840.db2.gz	XAFNYMLMGGUMOU-LSDHHAIUSA-N	0	3	333.501	3.018	20	30		EGEDHN
CC/C=C(\C)C(=O)N1CCC[C@@H](N(C)Cc2ccc(F)c(C#N)c2)C1	ZINC001752988124	1440258687	/nfs/dbraw/zinc/25/86/87/1440258687.db2.gz	HNOAEVJOLYCYDH-PRWGNSRSSA-N	0	3	343.446	3.476	20	30		EGEDHN
C[C@H](CCNC(=O)c1ccc(Cl)o1)NCc1ccccc1C#N	ZINC001753003365	1440265228	/nfs/dbraw/zinc/26/52/28/1440265228.db2.gz	NSXHWUYNJXTNGX-GFCCVEGCSA-N	0	3	331.803	3.103	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCN(C)CCOc2cc(C)cc(C)c2)C1	ZINC001753064888	1440285107	/nfs/dbraw/zinc/28/51/07/1440285107.db2.gz	WCZLEJJANMCALG-UHFFFAOYSA-N	0	3	330.472	3.087	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCN(CC)[C@@H](C)c2cccc(F)c2)nc1	ZINC001753092828	1440300385	/nfs/dbraw/zinc/30/03/85/1440300385.db2.gz	JOHGHSWDAAAXNE-HNNXBMFYSA-N	0	3	339.414	3.015	20	30		EGEDHN
CCN(CCNC(=O)CCc1cccs1)Cc1ccc(C#N)cc1	ZINC001753095156	1440302110	/nfs/dbraw/zinc/30/21/10/1440302110.db2.gz	YQJDDQFROKNCAP-UHFFFAOYSA-N	0	3	341.480	3.191	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@H]1CCCN1CCOc1ccccc1C	ZINC001753108167	1440307173	/nfs/dbraw/zinc/30/71/73/1440307173.db2.gz	JJJBCPQJWAXDPK-QGZVFWFLSA-N	0	3	330.472	3.167	20	30		EGEDHN
CC[C@H](CC(F)F)C(=O)NC[C@@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC001753126990	1440315247	/nfs/dbraw/zinc/31/52/47/1440315247.db2.gz	GCJGFGWZDSNYLE-DLBZAZTESA-N	0	3	349.425	3.178	20	30		EGEDHN
CCCN(CCNC(=O)c1cccn1CC)Cc1cccc(C#N)c1	ZINC001753149995	1440327341	/nfs/dbraw/zinc/32/73/41/1440327341.db2.gz	YFUGMMUWOMVMFP-UHFFFAOYSA-N	0	3	338.455	3.022	20	30		EGEDHN
CC[C@@H]1CCC[C@@H]1C(=O)N(C)CCNCc1ccc(F)c(C#N)c1	ZINC001753227977	1440340754	/nfs/dbraw/zinc/34/07/54/1440340754.db2.gz	HBKNLURAMUCRBT-WBVHZDCISA-N	0	3	331.435	3.072	20	30		EGEDHN
Cc1ccc(C[C@@H](C)C(=O)N(C)CCNCc2cccc(C#N)c2)cc1	ZINC001753265502	1440344736	/nfs/dbraw/zinc/34/47/36/1440344736.db2.gz	ZNKJMSYHWURNHF-GOSISDBHSA-N	0	3	349.478	3.294	20	30		EGEDHN
C=C(C)CN[C@@H](CNC(=O)c1cc(C)n(C(C)C)n1)c1ccccc1	ZINC001753302554	1440354610	/nfs/dbraw/zinc/35/46/10/1440354610.db2.gz	FDMYYGUQMWPXKB-IBGZPJMESA-N	0	3	340.471	3.409	20	30		EGEDHN
C#CCCN[C@H](CNC(=O)c1ccc2c(c1)C[C@@H](C)O2)c1ccccc1	ZINC001753309021	1440356132	/nfs/dbraw/zinc/35/61/32/1440356132.db2.gz	AUQANVWPZGXOGY-OXQOHEQNSA-N	0	3	348.446	3.094	20	30		EGEDHN
C#CCCN[C@@H](CNC(=O)c1csc(Cl)c1)c1ccccc1	ZINC001753312498	1440357197	/nfs/dbraw/zinc/35/71/97/1440357197.db2.gz	SGUDDCPOBTVHKL-HNNXBMFYSA-N	0	3	332.856	3.486	20	30		EGEDHN
C=CCOCCN1CC[C@H](N(CCC)C(=O)c2ccc(F)cc2C)C1	ZINC001753319445	1440362154	/nfs/dbraw/zinc/36/21/54/1440362154.db2.gz	FEJKXEUUZSUBSO-SFHVURJKSA-N	0	3	348.462	3.263	20	30		EGEDHN
C=CCOCCN1CC[C@@H](N(CCC)C(=O)[C@@H]2CC23CCCC3)C1	ZINC001753319878	1440362811	/nfs/dbraw/zinc/36/28/11/1440362811.db2.gz	OPHXWZLUOINJLS-MSOLQXFVSA-N	0	3	334.504	3.082	20	30		EGEDHN
C#CCCN1CC[C@H](N(CCC)C(=O)CC(C)(C)C(F)(F)F)C1	ZINC001753321698	1440363868	/nfs/dbraw/zinc/36/38/68/1440363868.db2.gz	CALPKQUSFMBSSP-AWEZNQCLSA-N	0	3	332.410	3.301	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@@H](CN(C)Cc2c(C)noc2C)C1	ZINC001753355299	1440379767	/nfs/dbraw/zinc/37/97/67/1440379767.db2.gz	PEDSNMDWXRDOJY-SJORKVTESA-N	0	3	333.476	3.174	20	30		EGEDHN
C=CCCCC(=O)N1CCC(CN(C)[C@@H](C)c2cnccn2)CC1	ZINC001753365324	1440384746	/nfs/dbraw/zinc/38/47/46/1440384746.db2.gz	CJAMLIWRUODOMC-INIZCTEOSA-N	0	3	330.476	3.064	20	30		EGEDHN
C=C[C@@H](C(=O)N1C[C@@H]2C[C@H]1CN2CCCCCOC)c1ccccc1	ZINC001753428168	1440397721	/nfs/dbraw/zinc/39/77/21/1440397721.db2.gz	ZBTRLQONDUAINR-SLFFLAALSA-N	0	3	342.483	3.058	20	30		EGEDHN
C=CCOCCN1CC[C@@H](N(C)C(=O)C[C@H](C)c2cccc(F)c2)C1	ZINC001753444864	1440403232	/nfs/dbraw/zinc/40/32/32/1440403232.db2.gz	ZSDWUWWOXHXRAA-QFBILLFUSA-N	0	3	348.462	3.055	20	30		EGEDHN
C=CCN1CC[C@@H](N(CC)C(=O)CCOc2c(C)cccc2C)C1	ZINC001753457130	1440408775	/nfs/dbraw/zinc/40/87/75/1440408775.db2.gz	KLAOZNVWWAPUEW-GOSISDBHSA-N	0	3	330.472	3.181	20	30		EGEDHN
C=CCOCCN1CC[C@H](N(CC)C(=O)C2CC(C(C)(C)C)C2)C1	ZINC001753465184	1440412379	/nfs/dbraw/zinc/41/23/79/1440412379.db2.gz	XCMJRDJNGGBAOK-ABHNRTSZSA-N	0	3	336.520	3.184	20	30		EGEDHN
CC[C@@H](CNC(=O)[C@H]1C[C@@H]1c1ccccc1)NCC#Cc1ccccc1	ZINC001753486730	1440418008	/nfs/dbraw/zinc/41/80/08/1440418008.db2.gz	BGKKEEOAMUAMMR-BDTNDASRSA-N	0	3	346.474	3.326	20	30		EGEDHN
CC[C@H](CNC(=O)[C@H]1C[C@@H]1c1ccccc1)NCC#Cc1ccccc1	ZINC001753486732	1440418025	/nfs/dbraw/zinc/41/80/25/1440418025.db2.gz	BGKKEEOAMUAMMR-VSKRKVRLSA-N	0	3	346.474	3.326	20	30		EGEDHN
CC[C@H](CNC(=O)Cc1ccccc1C)NCC#Cc1ccccc1	ZINC001753495851	1440421422	/nfs/dbraw/zinc/42/14/22/1440421422.db2.gz	ZHSJBDJLXSCAPQ-OAQYLSRUSA-N	0	3	334.463	3.074	20	30		EGEDHN
C#CCCCCC(=O)NC1(CNCc2cc(C)ns2)CCCC1	ZINC001753502349	1440423694	/nfs/dbraw/zinc/42/36/94/1440423694.db2.gz	OSBUIMDNTBSKRS-UHFFFAOYSA-N	0	3	333.501	3.164	20	30		EGEDHN
C#CCCCC(=O)NC1(CNCc2cc(C)ccc2F)CCCC1	ZINC001753503103	1440423927	/nfs/dbraw/zinc/42/39/27/1440423927.db2.gz	VHMSABCNWRVUPO-UHFFFAOYSA-N	0	3	330.447	3.456	20	30		EGEDHN
C[C@@H](CC(=O)NC1(CNCC#Cc2ccccc2)CCCC1)C1CC1	ZINC001753511249	1440426018	/nfs/dbraw/zinc/42/60/18/1440426018.db2.gz	DIJKJLLGMPHOEI-SFHVURJKSA-N	0	3	338.495	3.493	20	30		EGEDHN
Cc1nocc1CNC[C@@]1(NC(=O)C#CC(C)(C)C)CCCC[C@H]1C	ZINC001753531684	1440431303	/nfs/dbraw/zinc/43/13/03/1440431303.db2.gz	LLYRHCOHMDCPCF-QRWLVFNGSA-N	0	3	345.487	3.187	20	30		EGEDHN
C#CCNCc1ccc(CNC(=O)c2cc(C)c3ccccc3n2)cc1	ZINC001753588828	1440442159	/nfs/dbraw/zinc/44/21/59/1440442159.db2.gz	CJZKRRTVHOSFEE-UHFFFAOYSA-N	0	3	343.430	3.196	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)CC1(C)CCCC1	ZINC001753609917	1440448781	/nfs/dbraw/zinc/44/87/81/1440448781.db2.gz	AIRNGFODOPAYKJ-MRXNPFEDSA-N	0	3	327.472	3.371	20	30		EGEDHN
COc1ccc(C)cc1CNC1(CNC(=O)C#CC(C)C)CCCC1	ZINC001753664164	1440459594	/nfs/dbraw/zinc/45/95/94/1440459594.db2.gz	QIDZWJUOORQXFO-UHFFFAOYSA-N	0	3	342.483	3.182	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)C[C@@H]2CCC(C)(C)CO2)CCCC1	ZINC001753666415	1440460435	/nfs/dbraw/zinc/46/04/35/1440460435.db2.gz	HJEOEWADWGFNTB-HNNXBMFYSA-N	0	3	342.911	3.353	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N(C)[C@H](C)CNCc1ccc(C#N)c(F)c1	ZINC001753709383	1440470193	/nfs/dbraw/zinc/47/01/93/1440470193.db2.gz	XSVUORICRXALEP-CABCVRRESA-N	0	3	331.435	3.236	20	30		EGEDHN
C=CC[C@@H](C(=O)N(C)[C@@H](C)CNCc1ccccn1)c1ccccc1	ZINC001753729182	1440475098	/nfs/dbraw/zinc/47/50/98/1440475098.db2.gz	HWNKNPSSHXMFEA-FXAWDEMLSA-N	0	3	337.467	3.378	20	30		EGEDHN
Cc1cccnc1CNC[C@H](NC(=O)C#CC(C)C)C1CCCCC1	ZINC001753746316	1440481090	/nfs/dbraw/zinc/48/10/90/1440481090.db2.gz	SSDXMOGJRRDPBJ-FQEVSTJZSA-N	0	3	341.499	3.204	20	30		EGEDHN
CC[C@@H](C)C(=O)NC[C@H](NCC#Cc1cccc(Cl)c1)C(C)C	ZINC001753825291	1440498073	/nfs/dbraw/zinc/49/80/73/1440498073.db2.gz	VCDZEBVKMLTFJF-QAPCUYQASA-N	0	3	334.891	3.468	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1nc(C(C)C)oc1C)C(C)C	ZINC001753829582	1440499324	/nfs/dbraw/zinc/49/93/24/1440499324.db2.gz	PDUXDHILWQNBCB-CYBMUJFWSA-N	0	3	327.856	3.203	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)COc1cc(C)ccc1C)C(C)C	ZINC001753842403	1440503246	/nfs/dbraw/zinc/50/32/46/1440503246.db2.gz	KIKCWNJRXVPNRP-INIZCTEOSA-N	0	3	338.879	3.165	20	30		EGEDHN
C=C(Br)CN[C@H](CNC(=O)[C@H]1CC[C@H](C)CC1)C(C)C	ZINC001753843193	1440503432	/nfs/dbraw/zinc/50/34/32/1440503432.db2.gz	FNLVIXYRSHLDGY-BPLDGKMQSA-N	0	3	345.325	3.452	20	30		EGEDHN
CCCCC(=O)N1CC[C@H]2[C@H](CCN2CC#Cc2ccc(F)cc2)C1	ZINC001753886293	1440521393	/nfs/dbraw/zinc/52/13/93/1440521393.db2.gz	UXLATHXMIKMKMC-QUCCMNQESA-N	0	3	342.458	3.290	20	30		EGEDHN
C[C@H](CCN[C@H](C)c1c(F)cccc1F)NC(=O)c1cc(C#N)c[nH]1	ZINC001753956366	1440525734	/nfs/dbraw/zinc/52/57/34/1440525734.db2.gz	SJMJSRBFELDREJ-VXGBXAGGSA-N	0	3	346.381	3.024	20	30		EGEDHN
C[C@@H](CCN[C@@H](C)c1c(F)cccc1F)NC(=O)c1cc(C#N)c[nH]1	ZINC001753956365	1440525763	/nfs/dbraw/zinc/52/57/63/1440525763.db2.gz	SJMJSRBFELDREJ-RYUDHWBXSA-N	0	3	346.381	3.024	20	30		EGEDHN
CCc1cccc(CC(=O)NC/C=C/CNCc2ccc(C#N)cc2)c1	ZINC001754141545	1440544255	/nfs/dbraw/zinc/54/42/55/1440544255.db2.gz	GZHKNMMKGYZDNL-ONEGZZNKSA-N	0	3	347.462	3.125	20	30		EGEDHN
N#Cc1ccc(CNC/C=C/CNC(=O)c2ccc3[nH]ccc3c2)cc1	ZINC001754163006	1440546201	/nfs/dbraw/zinc/54/62/01/1440546201.db2.gz	AVQAMYQRUXTJRG-OWOJBTEDSA-N	0	3	344.418	3.115	20	30		EGEDHN
C[C@H](CNCC#Cc1ccccc1)NC(=O)C1(C)CCCCCC1	ZINC001754229516	1440553800	/nfs/dbraw/zinc/55/38/00/1440553800.db2.gz	HOWSDINPNMYOKZ-GOSISDBHSA-N	0	3	326.484	3.493	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)c(F)c1)NC(=O)[C@H](C)c1ccccc1	ZINC001754249257	1440557601	/nfs/dbraw/zinc/55/76/01/1440557601.db2.gz	DIWOSYJTDNOBGY-HUUCEWRRSA-N	0	3	339.414	3.095	20	30		EGEDHN
CC1=CC[C@@](C)(C(=O)N[C@H](C)CNCc2ccc(C#N)s2)CC1	ZINC001754254852	1440558876	/nfs/dbraw/zinc/55/88/76/1440558876.db2.gz	QHKOXOIMUMRDHV-RDTXWAMCSA-N	0	3	331.485	3.351	20	30		EGEDHN
C[C@H](CNCc1ccc(F)c(C#N)c1)NC(=O)C1(C)C(C)(C)C1(C)C	ZINC001754256889	1440559532	/nfs/dbraw/zinc/55/95/32/1440559532.db2.gz	UNHZYEUMZXXRQL-CYBMUJFWSA-N	0	3	345.462	3.364	20	30		EGEDHN
CC(C)c1ncc(C(=O)N[C@H](C)CNCC#Cc2ccccc2)s1	ZINC001754256975	1440559545	/nfs/dbraw/zinc/55/95/45/1440559545.db2.gz	XJTGAMAEEXWZNZ-OAHLLOKOSA-N	0	3	341.480	3.026	20	30		EGEDHN
Cc1c(Cl)cccc1C(=O)N[C@@H](C)CNCC#Cc1ccccc1	ZINC001754267872	1440561021	/nfs/dbraw/zinc/56/10/21/1440561021.db2.gz	ANSNGFVHGLACNZ-HNNXBMFYSA-N	0	3	340.854	3.408	20	30		EGEDHN
C=CCCC(=O)N[C@H](C)CN(C)CCc1c(F)cccc1Cl	ZINC001754307328	1440571560	/nfs/dbraw/zinc/57/15/60/1440571560.db2.gz	ZPJZWRPOLIEDHH-CYBMUJFWSA-N	0	3	326.843	3.424	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H](C)CN(C)C[C@H](O)c1ccc(CC)cc1	ZINC001754317768	1440576397	/nfs/dbraw/zinc/57/63/97/1440576397.db2.gz	BHHSRYXFAMLYLA-APWZRJJASA-N	0	3	346.515	3.321	20	30		EGEDHN
C=CCC[C@H](C)N1CC[C@H]1CNC(=O)c1c(C)nn(CCC)c1C	ZINC001754498016	1440613055	/nfs/dbraw/zinc/61/30/55/1440613055.db2.gz	RNUYATIVTOPHNT-YOEHRIQHSA-N	0	3	332.492	3.069	20	30		EGEDHN
CCCCCCCN1CC[C@@H]1CNC(=O)c1c(C)cc(C)[nH]c1=O	ZINC001754503279	1440615273	/nfs/dbraw/zinc/61/52/73/1440615273.db2.gz	UGJTWYOTHTWSCK-MRXNPFEDSA-N	0	3	333.476	3.179	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC1(NCc2cccc(COC)c2)CC1	ZINC001754521289	1440619906	/nfs/dbraw/zinc/61/99/06/1440619906.db2.gz	ADFJLKJJPIJIGE-UHFFFAOYSA-N	0	3	330.472	3.174	20	30		EGEDHN
Cc1ccccc1[C@@H](C)C(=O)NCC1(NCc2ccc(C#N)cc2)CC1	ZINC001754533998	1440623514	/nfs/dbraw/zinc/62/35/14/1440623514.db2.gz	BOWIIXFXQUAFJJ-QGZVFWFLSA-N	0	3	347.462	3.409	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@H]2CCC[C@@H](C1)N2CCC[C@@H]1CCOC1	ZINC001754553070	1440630451	/nfs/dbraw/zinc/63/04/51/1440630451.db2.gz	STWAYKYTUOMYJZ-ZGXWSNOMSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC1CCC1	ZINC001754553124	1440630468	/nfs/dbraw/zinc/63/04/68/1440630468.db2.gz	VPQBMWOSJHJWIA-WSTZPKSXSA-N	0	3	334.504	3.081	20	30		EGEDHN
CC#CCCCC(=O)N1C[C@H]2CCC[C@@H](C1)N2C[C@@H](OCC)C1CC1	ZINC001754553060	1440630487	/nfs/dbraw/zinc/63/04/87/1440630487.db2.gz	SLLLBYDVYMQZQU-HSALFYBXSA-N	0	3	346.515	3.060	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@]2(C1)CCCN(Cc1ccsc1)C2	ZINC001754557388	1440632272	/nfs/dbraw/zinc/63/22/72/1440632272.db2.gz	OEUAKZSIRIFVLE-LJQANCHMSA-N	0	3	330.497	3.222	20	30		EGEDHN
C[C@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)CCC(C)(F)F	ZINC001754596296	1440641584	/nfs/dbraw/zinc/64/15/84/1440641584.db2.gz	DVZUBVUCTLSWRR-YOEHRIQHSA-N	0	3	349.425	3.463	20	30		EGEDHN
CC(C)c1cccc(CNC[C@@H]2CCCN2C(=O)C#CC(C)(C)C)n1	ZINC001754610629	1440643791	/nfs/dbraw/zinc/64/37/91/1440643791.db2.gz	PPIHHXZYXSFAOO-SFHVURJKSA-N	0	3	341.499	3.335	20	30		EGEDHN
C#CCN(C(=O)[C@@H](C)CC)C1CCN(Cc2cccc(OC)c2)CC1	ZINC001754633389	1440648181	/nfs/dbraw/zinc/64/81/81/1440648181.db2.gz	WEGRXVOMFWUGLT-KRWDZBQOSA-N	0	3	342.483	3.168	20	30		EGEDHN
C#CCN(C(=O)[C@H]1CC[C@@H](F)C1)C1CCN(Cc2ccccc2)CC1	ZINC001754640180	1440649057	/nfs/dbraw/zinc/64/90/57/1440649057.db2.gz	JRKRDRVYBYWUOW-RBUKOAKNSA-N	0	3	342.458	3.251	20	30		EGEDHN
C#CCNC[C@@H](NC(=O)COC(C)(C)C)c1ccc2ccccc2c1	ZINC001754644802	1440649908	/nfs/dbraw/zinc/64/99/08/1440649908.db2.gz	XMSDMSSDKJVJNF-LJQANCHMSA-N	0	3	338.451	3.035	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]3CC[C@@H](C2)N3CCOCC(C)C)C1	ZINC001754659750	1440654434	/nfs/dbraw/zinc/65/44/34/1440654434.db2.gz	CURJQZUVOMJFTH-MSOLQXFVSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@]1(C)CCN(CCOc2ccccc2C)C1	ZINC001754673461	1440659070	/nfs/dbraw/zinc/65/90/70/1440659070.db2.gz	ASVHJLIXRUZGCI-FQEVSTJZSA-N	0	3	330.472	3.311	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)CCCOC(C)C)C2)CC1	ZINC001754785869	1440687812	/nfs/dbraw/zinc/68/78/12/1440687812.db2.gz	RAGGDVDLZMQGJK-HXUWFJFHSA-N	0	3	348.531	3.166	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H]([C@@H](C)NCc2csc(C3CC3)n2)C1	ZINC001754787643	1440688165	/nfs/dbraw/zinc/68/81/65/1440688165.db2.gz	MYFXORYWEZTVEZ-HIFRSBDPSA-N	0	3	333.501	3.313	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H]([C@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001754798950	1440690164	/nfs/dbraw/zinc/69/01/64/1440690164.db2.gz	JBXWWRNICJEULM-DOTOQJQBSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@H](C)[C@@H](CNCc2ccn(C(C)C)n2)C1	ZINC001754816618	1440692357	/nfs/dbraw/zinc/69/23/57/1440692357.db2.gz	HHAGUOLXFPBPMU-IRXDYDNUSA-N	0	3	332.492	3.004	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@]1(CO)CCCN(Cc2cccc(C)c2)C1	ZINC001754857299	1440700596	/nfs/dbraw/zinc/70/05/96/1440700596.db2.gz	DIFNYDWBZRWOCU-WIYYLYMNSA-N	0	3	344.499	3.040	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCN(C(=O)c2scnc2C(C)C)C1	ZINC001754934103	1440710983	/nfs/dbraw/zinc/71/09/83/1440710983.db2.gz	IXLYBZVOGFCGMG-ZDUSSCGKSA-N	0	3	341.908	3.461	20	30		EGEDHN
C#CCN[C@H](C)c1ccc(CNC(=O)c2oc(C(C)C)nc2C)cc1	ZINC001754947859	1440713926	/nfs/dbraw/zinc/71/39/26/1440713926.db2.gz	CRZFPRMCWBUIML-CQSZACIVSA-N	0	3	339.439	3.320	20	30		EGEDHN
C#CCN[C@H](C)c1ccc(CNC(=O)[C@H]2Cc3ccc(F)cc32)cc1	ZINC001754948594	1440714344	/nfs/dbraw/zinc/71/43/44/1440714344.db2.gz	LDNNGAQQNUHHCT-VLIAUNLRSA-N	0	3	336.410	3.066	20	30		EGEDHN
CC#CCN[C@@H](C)c1ccc(CNC(=O)Cc2cccc(F)c2)cc1	ZINC001754951537	1440715011	/nfs/dbraw/zinc/71/50/11/1440715011.db2.gz	XGFIKVAEOOQGDY-INIZCTEOSA-N	0	3	338.426	3.359	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CCCN(Cc2oc(CCC)nc2C)CC1	ZINC001755020612	1440726660	/nfs/dbraw/zinc/72/66/60/1440726660.db2.gz	IDJFUOIGLUBTLJ-INIZCTEOSA-N	0	3	333.476	3.372	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)C2(Cc3ccccc3)CCC2)CC1	ZINC001755024755	1440728106	/nfs/dbraw/zinc/72/81/06/1440728106.db2.gz	HTHZDXXKLVJRDD-HXUWFJFHSA-N	0	3	338.495	3.393	20	30		EGEDHN
C=CCCCN1Cc2ccccc2C[C@H]1CNC(=O)Cc1cccnc1	ZINC001755075631	1440748505	/nfs/dbraw/zinc/74/85/05/1440748505.db2.gz	KSGFSRNRAWEGOG-NRFANRHFSA-N	0	3	349.478	3.133	20	30		EGEDHN
C=CCCCN1Cc2ccccc2C[C@@H]1CNC(=O)c1ccsn1	ZINC001755076144	1440748923	/nfs/dbraw/zinc/74/89/23/1440748923.db2.gz	UXJIRBFKNQNZLH-QGZVFWFLSA-N	0	3	341.480	3.266	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC[C@](CO)(NCc2ccc(C)cc2)C1	ZINC001755087348	1440751092	/nfs/dbraw/zinc/75/10/92/1440751092.db2.gz	BZNXIQJWDDZQCW-NQIIRXRSSA-N	0	3	344.499	3.040	20	30		EGEDHN
C=CCCCN1Cc2ccc(CNC(=O)c3c[nH]nc3CC)cc2C1	ZINC001755102598	1440753467	/nfs/dbraw/zinc/75/34/67/1440753467.db2.gz	ZXLVFSJAMVRUDI-UHFFFAOYSA-N	0	3	338.455	3.184	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)COc2cccc(C(C)C)c2)C[C@@H]1C	ZINC001755161111	1440764827	/nfs/dbraw/zinc/76/48/27/1440764827.db2.gz	UTSJHUYDVUUACG-HKUYNNGSSA-N	0	3	342.483	3.181	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CCN(Cc2ccc(C#N)cc2)[C@@H](C)C1	ZINC001755161766	1440764928	/nfs/dbraw/zinc/76/49/28/1440764928.db2.gz	ZLHILROHXNYYIG-QFBILLFUSA-N	0	3	325.456	3.384	20	30		EGEDHN
C=CCOCCCC(=O)N[C@@H]1CCN(Cc2cccc(F)c2)[C@@H](C)C1	ZINC001755168512	1440768091	/nfs/dbraw/zinc/76/80/91/1440768091.db2.gz	CJLUXEVFAXRZGZ-QFBILLFUSA-N	0	3	348.462	3.278	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CCN(CCOc2ccccc2C)[C@@H](C)C1	ZINC001755168441	1440768107	/nfs/dbraw/zinc/76/81/07/1440768107.db2.gz	BTXZHUAMIMYAPF-ZWKOTPCHSA-N	0	3	330.472	3.309	20	30		EGEDHN
C=CCCCN1CCc2ccccc2[C@H]1CNC(=O)C1=COCCC1	ZINC001755172789	1440769821	/nfs/dbraw/zinc/76/98/21/1440769821.db2.gz	XVMAAXZMYIIQEY-HXUWFJFHSA-N	0	3	340.467	3.363	20	30		EGEDHN
C=CCCCC(=O)N1CCC(CN(CC)Cc2cnc(C)o2)CC1	ZINC001755184311	1440772445	/nfs/dbraw/zinc/77/24/45/1440772445.db2.gz	TWVMRTPSLVRPTD-UHFFFAOYSA-N	0	3	333.476	3.400	20	30		EGEDHN
C=C(Cl)CNCC1CC(NC(=O)C/C=C\c2ccc(F)cc2)C1	ZINC001755213880	1440783702	/nfs/dbraw/zinc/78/37/02/1440783702.db2.gz	XSRNDCIJIABZGO-IHWYPQMZSA-N	0	3	336.838	3.466	20	30		EGEDHN
C[C@@H](NCC#Cc1ccccc1)[C@@H](C)NC(=O)CC1CCCCC1	ZINC001755226337	1440786082	/nfs/dbraw/zinc/78/60/82/1440786082.db2.gz	NBQGFYBJMWCOMQ-QZTJIDSGSA-N	0	3	326.484	3.491	20	30		EGEDHN
Cc1occc1C(=O)N[C@@H](C)[C@H](C)NCC#Cc1ccccc1Cl	ZINC001755228140	1440786393	/nfs/dbraw/zinc/78/63/93/1440786393.db2.gz	ZJZYUWJKFIYIDU-KBPBESRZSA-N	0	3	344.842	3.390	20	30		EGEDHN
Cc1cscc1C(=O)N[C@H](C)[C@@H](C)NCC#Cc1ccccc1	ZINC001755229600	1440786688	/nfs/dbraw/zinc/78/66/88/1440786688.db2.gz	DNDGEBGFJABEAB-HZPDHXFCSA-N	0	3	326.465	3.205	20	30		EGEDHN
C[C@@H](NCC#Cc1ccc(F)cc1)[C@H](C)NC(=O)c1sccc1F	ZINC001755234905	1440787971	/nfs/dbraw/zinc/78/79/71/1440787971.db2.gz	VWKNMPJDGJURKY-OLZOCXBDSA-N	0	3	348.418	3.174	20	30		EGEDHN
CC(C)c1ccc(CN(C)[C@@H](C)CNC(=O)c2cc(C#N)c[nH]2)cc1	ZINC001755298667	1440807554	/nfs/dbraw/zinc/80/75/54/1440807554.db2.gz	VQBXZWUTBSNPRK-HNNXBMFYSA-N	0	3	338.455	3.260	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@H](C)N(C)[C@H]1CCc2c1cccc2F	ZINC001755314989	1440815182	/nfs/dbraw/zinc/81/51/82/1440815182.db2.gz	ZUUHQKCRUJLSJF-BEFAXECRSA-N	0	3	330.447	3.443	20	30		EGEDHN
C#CCN1CCCCC[C@@H]1CNC(=O)[C@H](CC)c1ccc(OC)cc1	ZINC001755367322	1440835407	/nfs/dbraw/zinc/83/54/07/1440835407.db2.gz	FSESBPBRIWLHFZ-UYAOXDASSA-N	0	3	342.483	3.183	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@]3(C2)CN(CCC(C)C)CCO3)CCCC1	ZINC001755403029	1440843444	/nfs/dbraw/zinc/84/34/44/1440843444.db2.gz	FRBVPWCJKISKOD-NRFANRHFSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCOCC(=O)N[C@H]1CN([C@H](CC)c2ccc(F)cc2)CC1(C)C	ZINC001755406122	1440844255	/nfs/dbraw/zinc/84/42/55/1440844255.db2.gz	KFKSZNIAVCLHGR-MSOLQXFVSA-N	0	3	348.462	3.306	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)[C@H](OCC)c2ccccc2)C(C)(C)C1	ZINC001755416574	1440849074	/nfs/dbraw/zinc/84/90/74/1440849074.db2.gz	UWGNTFUMTAZWMI-QZTJIDSGSA-N	0	3	330.472	3.167	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](C)CCCN[C@@H](C)c2cnccn2)CC1	ZINC001755515430	1440864100	/nfs/dbraw/zinc/86/41/00/1440864100.db2.gz	SKAHXZWZKCHQFD-HOTGVXAUSA-N	0	3	330.476	3.159	20	30		EGEDHN
C[C@@H](CCCNCc1ccccc1C#N)NC(=O)C1(C)CC=CC1	ZINC001755515011	1440864232	/nfs/dbraw/zinc/86/42/32/1440864232.db2.gz	QWHJQVRBRPAZMH-INIZCTEOSA-N	0	3	325.456	3.289	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC(N(C)[C@@H](C)c2cnccn2)CC1	ZINC001755534110	1440868525	/nfs/dbraw/zinc/86/85/25/1440868525.db2.gz	BOOVEEKWFAJTRV-HNNXBMFYSA-N	0	3	330.476	3.063	20	30		EGEDHN
C#CCC[NH2+]CCC[C@@H](NC(=O)c1ccccc1[O-])c1ccccc1	ZINC001755547342	1440870928	/nfs/dbraw/zinc/87/09/28/1440870928.db2.gz	PZBHIOGWYDRBHY-LJQANCHMSA-N	0	3	336.435	3.256	20	30		EGEDHN
C=C1CCC(C(=O)N(C)[C@@H](CNCc2ccns2)C2CC2)CC1	ZINC001755566258	1440875873	/nfs/dbraw/zinc/87/58/73/1440875873.db2.gz	PLANMCRKZGJXDE-KRWDZBQOSA-N	0	3	333.501	3.216	20	30		EGEDHN
CC(C)n1cccc1C(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@H]1C	ZINC001755666373	1440893462	/nfs/dbraw/zinc/89/34/62/1440893462.db2.gz	CGWRRQRUCRDKRX-QUCCMNQESA-N	0	3	349.478	3.313	20	30		EGEDHN
CCCCCC(=O)N1C[C@@H](NCc2ccc(F)c(C#N)c2)C[C@@H]1C	ZINC001755670385	1440893916	/nfs/dbraw/zinc/89/39/16/1440893916.db2.gz	QMSVWRSPSNINMB-YOEHRIQHSA-N	0	3	331.435	3.357	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](NCc2ccc(C)nc2C)C[C@@H]1C	ZINC001755674818	1440894455	/nfs/dbraw/zinc/89/44/55/1440894455.db2.gz	HNBGAMDSVGIIEP-YJBOKZPZSA-N	0	3	329.488	3.380	20	30		EGEDHN
C[C@@H]1C[C@H](NCC#Cc2ccc(F)cc2)CN1C(=O)C1(F)CCCC1	ZINC001755680165	1440895012	/nfs/dbraw/zinc/89/50/12/1440895012.db2.gz	DJLHDFBZOWXDIG-QAPCUYQASA-N	0	3	346.421	3.039	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N[C@]12CCC[C@@H]1N(Cc1ccsc1)CC2	ZINC001755697507	1440898608	/nfs/dbraw/zinc/89/86/08/1440898608.db2.gz	YSJYDOWJBHMLOD-AYBZRNKSSA-N	0	3	348.512	3.343	20	30		EGEDHN
C#CCN1CC[C@]2(NC(=O)CC(C3CCC3)C3CCC3)CCC[C@H]12	ZINC001755700813	1440900042	/nfs/dbraw/zinc/90/00/42/1440900042.db2.gz	LACZUMPKMCECLM-PZJWPPBQSA-N	0	3	328.500	3.339	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CCCN(CCOCC2CCC2)[C@H]1C	ZINC001755718728	1440906393	/nfs/dbraw/zinc/90/63/93/1440906393.db2.gz	OZWRQAHLXOYNSF-FUHWJXTLSA-N	0	3	336.520	3.375	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CCCN(Cc2ccc3c(c2)CCC3)[C@H]1C	ZINC001755730732	1440910146	/nfs/dbraw/zinc/91/01/46/1440910146.db2.gz	NCZNWCZMCNSOCK-LAUBAEHRSA-N	0	3	338.495	3.448	20	30		EGEDHN
Cc1nc(C(C)C)oc1CNC[C@H]1CC[C@H](NC(=O)C#CC(C)C)C1	ZINC001755734845	1440910698	/nfs/dbraw/zinc/91/06/98/1440910698.db2.gz	XDRJOEKMUJGVGU-IRXDYDNUSA-N	0	3	345.487	3.140	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H](NCc2cnccc2C)C(C)(C)C1	ZINC001755759048	1440914572	/nfs/dbraw/zinc/91/45/72/1440914572.db2.gz	KAQHCUZTXXLOOW-LJQANCHMSA-N	0	3	341.499	3.485	20	30		EGEDHN
CC1(C)CN(C(=O)C2(CCF)CC2)C[C@H]1NCc1ccc(C#N)s1	ZINC001755760572	1440914773	/nfs/dbraw/zinc/91/47/73/1440914773.db2.gz	PXWMKXWBOYUYPW-OAHLLOKOSA-N	0	3	349.475	3.086	20	30		EGEDHN
CC(C)N(CCN(C)[C@@H](C)c1ccc(F)cc1)C(=O)C#CC1CC1	ZINC001755810844	1440920097	/nfs/dbraw/zinc/92/00/97/1440920097.db2.gz	PFXNOKSEUXCJQK-INIZCTEOSA-N	0	3	330.447	3.469	20	30		EGEDHN
C[C@H](C(=O)N[C@H](CNCC#Cc1ccccc1)C(C)(C)C)C1CC1	ZINC001755820955	1440925708	/nfs/dbraw/zinc/92/57/08/1440925708.db2.gz	VYRRSFGWCFNPCZ-QFBILLFUSA-N	0	3	326.484	3.205	20	30		EGEDHN
CC(C)(C)[C@H](CNCc1ccc(C#N)s1)NC(=O)CCC1CC1	ZINC001755821605	1440925886	/nfs/dbraw/zinc/92/58/86/1440925886.db2.gz	OXLPPAMVKGUCFR-INIZCTEOSA-N	0	3	333.501	3.430	20	30		EGEDHN
C=C(Br)CNC[C@@H](NC(=O)[C@]1(C)C=CCC1)C(C)(C)C	ZINC001755829521	1440928193	/nfs/dbraw/zinc/92/81/93/1440928193.db2.gz	DIKQCALQONULOR-CZUORRHYSA-N	0	3	343.309	3.372	20	30		EGEDHN
C=C(Br)CNC[C@H](NC(=O)[C@@H](C)C(C)C)C(C)(C)C	ZINC001755833082	1440929295	/nfs/dbraw/zinc/92/92/95/1440929295.db2.gz	FJMGTWXPEPZHOP-STQMWFEESA-N	0	3	333.314	3.308	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H](CNCc2ccc(OC)nc2)C(C)(C)C)C1	ZINC001755832794	1440929223	/nfs/dbraw/zinc/92/92/23/1440929223.db2.gz	RWKLZPVKJTUYSQ-MRXNPFEDSA-N	0	3	345.487	3.067	20	30		EGEDHN
CC#CCCCC(=O)N[C@H](C)C1CCN(Cc2c(C)noc2C)CC1	ZINC001755844041	1440932603	/nfs/dbraw/zinc/93/26/03/1440932603.db2.gz	GENFMXVXEXRWEN-OAHLLOKOSA-N	0	3	345.487	3.202	20	30		EGEDHN
Cc1cncc(CN2CCC([C@H](C)NC(=O)C#CC(C)(C)C)CC2)c1	ZINC001755848615	1440934292	/nfs/dbraw/zinc/93/42/92/1440934292.db2.gz	IVSSGVJWVJLLPY-KRWDZBQOSA-N	0	3	341.499	3.156	20	30		EGEDHN
CN(C(=O)C1=CCCC1)C1CC(NCC#Cc2ccc(Cl)cc2)C1	ZINC001755855369	1440935766	/nfs/dbraw/zinc/93/57/66/1440935766.db2.gz	OANBNXORLQYUQO-UHFFFAOYSA-N	0	3	342.870	3.381	20	30		EGEDHN
Cc1cc(C#N)ccc1CN[C@@H](Cc1ccccc1)[C@@H](O)C(F)(F)F	ZINC001648156200	1126250205	/nfs/dbraw/zinc/25/02/05/1126250205.db2.gz	RHOVQLZYRFMZAV-ZWKOTPCHSA-N	0	3	348.368	3.491	20	30		EGEDHN
Cc1nsc(N2C[C@H]3CCN(Cc4ccccc4)C[C@H]3C2)c1C#N	ZINC000368185115	168321944	/nfs/dbraw/zinc/32/19/44/168321944.db2.gz	QBFVMPDXIPBEEI-SJORKVTESA-N	0	3	338.480	3.282	20	30		EGEDHN
COc1ccc([C@H](CNCc2cccc(C#N)c2)N2CCCC2)cc1	ZINC000053095686	214163770	/nfs/dbraw/zinc/16/37/70/214163770.db2.gz	QQQYPKYXZOHTIF-NRFANRHFSA-N	0	3	335.451	3.494	20	30		EGEDHN
CS[C@@H](C)C(=O)C(C#N)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000100819223	219108130	/nfs/dbraw/zinc/10/81/30/219108130.db2.gz	FIQAVPGWTHTJHJ-CPCISQLKSA-N	0	3	331.224	3.392	20	30		EGEDHN
Cn1cc(CN2CCSC(C)(C)C2)c(-c2ccc(C#N)cc2)n1	ZINC000180172878	233771449	/nfs/dbraw/zinc/77/14/49/233771449.db2.gz	PVCLJPFOLGPLJD-UHFFFAOYSA-N	0	3	326.469	3.286	20	30		EGEDHN
N#Cc1ccc(C(F)(F)F)nc1N1CCC[C@H]1CN1CCCCC1	ZINC000189067939	283136017	/nfs/dbraw/zinc/13/60/17/283136017.db2.gz	XYMHFLMLTRIVOW-AWEZNQCLSA-N	0	3	338.377	3.427	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCN2CCS[C@@H]3CCCC[C@H]32)cc1	ZINC000246153852	283175139	/nfs/dbraw/zinc/17/51/39/283175139.db2.gz	PPEQEFOXKJVUPC-IAGOWNOFSA-N	0	3	329.469	3.247	20	30		EGEDHN
C[C@H](NC(=O)OC(C)(C)C)C1CCN(Cc2cc(C#N)n(C)c2)CC1	ZINC000191311683	239033735	/nfs/dbraw/zinc/03/37/35/239033735.db2.gz	OCURXHPPFHSKQC-AWEZNQCLSA-N	0	3	346.475	3.022	20	30		EGEDHN
C[C@H](N[C@H]1CC(C)(C)OC1(C)C)C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000132628308	223349557	/nfs/dbraw/zinc/34/95/57/223349557.db2.gz	HIOUBSXVICJKLE-NHYWBVRUSA-N	0	3	349.862	3.474	20	30		EGEDHN
C[C@H](N[C@@H]1CC(C)(C)OC1(C)C)C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000132627920	223349704	/nfs/dbraw/zinc/34/97/04/223349704.db2.gz	HIOUBSXVICJKLE-XHDPSFHLSA-N	0	3	349.862	3.474	20	30		EGEDHN
Cc1ccc(NC(=O)[C@@H]2CCCN(Cc3cccc(C#N)c3)C2)nc1	ZINC000080927306	217340942	/nfs/dbraw/zinc/34/09/42/217340942.db2.gz	HRCFHPJLZIDMNX-GOSISDBHSA-N	0	3	334.423	3.112	20	30		EGEDHN
CC(C)Oc1ccc(C#N)cc1NC(=O)N1CC[C@@H]2CC[C@H](C1)N2C	ZINC000081064001	217358143	/nfs/dbraw/zinc/35/81/43/217358143.db2.gz	BJOXVIYZTXYBHJ-JKSUJKDBSA-N	0	3	342.443	3.046	20	30		EGEDHN
C[C@H]1C[C@H](c2ccccc2)CN1CC(=O)NCc1ccc(C#N)cc1	ZINC000265258521	247345718	/nfs/dbraw/zinc/34/57/18/247345718.db2.gz	XSJNGDVZLHLXNT-JXFKEZNVSA-N	0	3	333.435	3.052	20	30		EGEDHN
CN(CCOc1ccccc1Cl)C[C@@H](O)c1ccc(C#N)cc1	ZINC000268605483	252061807	/nfs/dbraw/zinc/06/18/07/252061807.db2.gz	JOQUMLTUPKIPGA-QGZVFWFLSA-N	0	3	330.815	3.256	20	30		EGEDHN
C=CCN1CCC(N[C@@H](C)c2nnn(-c3ccc(C)cc3)c2C)CC1	ZINC000268860094	252309040	/nfs/dbraw/zinc/30/90/40/252309040.db2.gz	HRGALZMGPFOMKG-INIZCTEOSA-N	0	3	339.487	3.185	20	30		EGEDHN
C#CCOc1ccccc1CNC(=O)Nc1cccc(CN(C)C)c1	ZINC000265184797	533195673	/nfs/dbraw/zinc/19/56/73/533195673.db2.gz	NSIKVQVWRJPCLX-UHFFFAOYSA-N	0	3	337.423	3.082	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1CCC(OCCC(C)C)CC1	ZINC000172650909	533503279	/nfs/dbraw/zinc/50/32/79/533503279.db2.gz	CMUXYOZJZBWYOB-UHFFFAOYSA-N	0	3	346.471	3.473	20	30		EGEDHN
COc1ccc(CNC[C@@H](c2ccc(F)cc2)N(C)C)cc1C#N	ZINC000174282311	533666192	/nfs/dbraw/zinc/66/61/92/533666192.db2.gz	SKRCPHUXMUWUAF-SFHVURJKSA-N	0	3	327.403	3.098	20	30		EGEDHN
COc1ccc(CNC[C@H](c2ccc(C)o2)N2CCCC2)cc1C#N	ZINC000174332087	533669375	/nfs/dbraw/zinc/66/93/75/533669375.db2.gz	NRHRNQNGQGICNC-GOSISDBHSA-N	0	3	339.439	3.395	20	30		EGEDHN
Cc1nsc(N(C)[C@H]2CCCN(Cc3ccccc3)C2)c1C#N	ZINC000342793587	141149087	/nfs/dbraw/zinc/14/90/87/141149087.db2.gz	VTXHJDJTCPYMKJ-INIZCTEOSA-N	0	3	326.469	3.424	20	30		EGEDHN
CC1CCN([C@@H](CNC(=O)c2cc(C#N)c[nH]2)c2ccccc2)CC1	ZINC000175396683	144063680	/nfs/dbraw/zinc/06/36/80/144063680.db2.gz	NJVKEGGAAHGLKT-IBGZPJMESA-N	0	3	336.439	3.089	20	30		EGEDHN
CN(Cc1ccccc1)[C@H](CNC(=O)c1cccc(C#N)c1)C1CC1	ZINC000185324318	144111311	/nfs/dbraw/zinc/11/13/11/144111311.db2.gz	RRPMFFGGYJUDPA-HXUWFJFHSA-N	0	3	333.435	3.199	20	30		EGEDHN
N#Cc1cccc(OCCCN2CC[C@@]3(C2)OCc2ccccc23)c1	ZINC000186693479	144141012	/nfs/dbraw/zinc/14/10/12/144141012.db2.gz	CYGIAZYXUHVTSY-NRFANRHFSA-N	0	3	334.419	3.459	20	30		EGEDHN
N#Cc1nc(-c2ccco2)oc1N1CCN(C[C@H]2CC=CCC2)CC1	ZINC000119629072	152217728	/nfs/dbraw/zinc/21/77/28/152217728.db2.gz	CLTRMMJNRZWUQB-HNNXBMFYSA-N	0	3	338.411	3.285	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CCN1CCOc1ccc(C#N)cc1	ZINC000303902629	154059024	/nfs/dbraw/zinc/05/90/24/154059024.db2.gz	SVJMDKPZPNZYCJ-GOSISDBHSA-N	0	3	335.451	3.143	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)N(C)CC(C)(C)C	ZINC000337945496	154575725	/nfs/dbraw/zinc/57/57/25/154575725.db2.gz	KBAFFBZMZYTOKO-UHFFFAOYSA-N	0	3	330.476	3.020	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1F)Cc1ccc(C#N)cc1F	ZINC000348902371	156281210	/nfs/dbraw/zinc/28/12/10/156281210.db2.gz	BPQZRQYIZMTFRM-UHFFFAOYSA-N	0	3	329.394	3.400	20	30		EGEDHN
Cc1ccc2c(c1)[C@H]1CN(C)CC[C@H]1N2C(=O)c1ccc(C#N)cc1	ZINC000106028292	292370014	/nfs/dbraw/zinc/37/00/14/292370014.db2.gz	QYMDIFHQTYTRQT-UYAOXDASSA-N	0	3	331.419	3.315	20	30		EGEDHN
Cn1cc(CNCCOc2ccccc2)c(-c2ccc(C#N)cc2)n1	ZINC000180030921	162720195	/nfs/dbraw/zinc/72/01/95/162720195.db2.gz	CBOMNFCTQVQOGP-UHFFFAOYSA-N	0	3	332.407	3.127	20	30		EGEDHN
Cc1ncsc1CNC1CCN(Cc2ccc(C#N)cc2)CC1	ZINC000344101549	164103656	/nfs/dbraw/zinc/10/36/56/164103656.db2.gz	MABLWOBVMPCYMK-UHFFFAOYSA-N	0	3	326.469	3.077	20	30		EGEDHN
C[C@H](CN(C)C)NC(=O)Nc1ccc(Oc2ccccc2)c(C#N)c1	ZINC000351589973	165101315	/nfs/dbraw/zinc/10/13/15/165101315.db2.gz	MXNJHVAUIQAHKF-CQSZACIVSA-N	0	3	338.411	3.422	20	30		EGEDHN
C[C@@H](CN(C)C)NC(=O)Nc1ccc(Oc2ccccc2)c(C#N)c1	ZINC000351589972	165101921	/nfs/dbraw/zinc/10/19/21/165101921.db2.gz	MXNJHVAUIQAHKF-AWEZNQCLSA-N	0	3	338.411	3.422	20	30		EGEDHN
N#Cc1ccc(CNc2ccccc2CN2CCC(O)CC2)c(F)c1	ZINC000355388875	166182590	/nfs/dbraw/zinc/18/25/90/166182590.db2.gz	GGZUPTXBBHMBDS-UHFFFAOYSA-N	0	3	339.414	3.266	20	30		EGEDHN
N#Cc1ccc(CNCCCOc2ccc(C(F)(F)F)cn2)o1	ZINC000359820750	167241275	/nfs/dbraw/zinc/24/12/75/167241275.db2.gz	UXCJRMPNVDKHCM-UHFFFAOYSA-N	0	3	325.290	3.124	20	30		EGEDHN
Cc1cccc2nc(CNC3CCN(c4ccc(C#N)cc4)CC3)cn21	ZINC000367598746	168246892	/nfs/dbraw/zinc/24/68/92/168246892.db2.gz	GGJFOOOGGLXVQW-UHFFFAOYSA-N	0	3	345.450	3.273	20	30		EGEDHN
CN(Cc1ccccc1)[C@H]1CCN(C(=O)c2ccc(F)c(C#N)c2)C1	ZINC000367602432	168248352	/nfs/dbraw/zinc/24/83/52/168248352.db2.gz	SUXKDNOPEIDUJB-SFHVURJKSA-N	0	3	337.398	3.044	20	30		EGEDHN
CC[C@@H](N[C@@H]1CCCN(c2ccc(C#N)cc2F)C1)c1nccn1C	ZINC000367746118	168265686	/nfs/dbraw/zinc/26/56/86/168265686.db2.gz	FASLQGDGRSQWBL-NVXWUHKLSA-N	0	3	341.434	3.141	20	30		EGEDHN
COc1cc(CNC[C@]2(C)OCCc3sccc32)ccc1C#N	ZINC000367988816	168292793	/nfs/dbraw/zinc/29/27/93/168292793.db2.gz	VEDBJLZMJPQXDC-SFHVURJKSA-N	0	3	328.437	3.206	20	30		EGEDHN
N#Cc1cccc(NC(=O)C2CCN(C3CC3)CC2)c1Br	ZINC000416081476	269972502	/nfs/dbraw/zinc/97/25/02/269972502.db2.gz	QICRMKTVHPROLH-UHFFFAOYSA-N	0	3	348.244	3.134	20	30		EGEDHN
N#Cc1cccc(CN[C@H](c2ccccc2)C2(CO)CCOCC2)c1	ZINC000412010242	270046732	/nfs/dbraw/zinc/04/67/32/270046732.db2.gz	PXZGGJVDEGYLLD-HXUWFJFHSA-N	0	3	336.435	3.178	20	30		EGEDHN
CCC[C@@]1(CO)CCCN1Cc1ccc(C#N)cc1Br	ZINC000444774878	270052421	/nfs/dbraw/zinc/05/24/21/270052421.db2.gz	KZCKWKSPNOIZKF-INIZCTEOSA-N	0	3	337.261	3.448	20	30		EGEDHN
CCc1ccc2nccc(N3CCN(c4cc(C#N)ccn4)CC3)c2c1	ZINC000450241813	270052883	/nfs/dbraw/zinc/05/28/83/270052883.db2.gz	KCBJTPLHLVMAPR-UHFFFAOYSA-N	0	3	343.434	3.390	20	30		EGEDHN
CCc1ccc(CN(C)C(=O)C(C#N)Cc2ccc(C#N)cc2)cc1	ZINC000470731102	270055068	/nfs/dbraw/zinc/05/50/68/270055068.db2.gz	CCYFPFGXGCXCQG-HXUWFJFHSA-N	0	3	331.419	3.462	20	30		EGEDHN
Cc1cccc(OC[C@H](O)CN2CC=C(c3ccc(C#N)cc3)CC2)c1	ZINC000502505964	270058807	/nfs/dbraw/zinc/05/88/07/270058807.db2.gz	IQPMMCMSHWBDAM-OAQYLSRUSA-N	0	3	348.446	3.396	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CN1CCC[C@@H]1c1ccc(F)cc1	ZINC000528336389	270060072	/nfs/dbraw/zinc/06/00/72/270060072.db2.gz	BGTPRQMRXURENE-RBUKOAKNSA-N	0	3	340.398	3.274	20	30		EGEDHN
CCC1(CC)CN(C(=O)C(C#N)Cc2ccc(C#N)cc2)CCS1	ZINC000280210708	266010770	/nfs/dbraw/zinc/01/07/70/266010770.db2.gz	GAWRCVFHKSMHLY-QGZVFWFLSA-N	0	3	341.480	3.375	20	30		EGEDHN
CCC1(CC)[C@H](NCC(=O)Nc2cc(Cl)ccc2C#N)C[C@H]1OC	ZINC000191382661	266012375	/nfs/dbraw/zinc/01/23/75/266012375.db2.gz	OTXNQUSBYDYXIA-HZPDHXFCSA-N	0	3	349.862	3.333	20	30		EGEDHN
CCO[C@@H]1C[C@H](NCC(=O)Nc2cc(Cl)ccc2C#N)C12CCC2	ZINC000296328581	266297765	/nfs/dbraw/zinc/29/77/65/266297765.db2.gz	QOXCDCXGBJZZLF-JKSUJKDBSA-N	0	3	347.846	3.087	20	30		EGEDHN
CCCCNC(=O)[C@H]1CC[C@@H](C)N(Cc2ccc(C#N)c(OC)c2)C1	ZINC000442800404	267008985	/nfs/dbraw/zinc/00/89/85/267008985.db2.gz	JVLHUWQIOBISMO-QAPCUYQASA-N	0	3	343.471	3.084	20	30		EGEDHN
C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC000272496858	267175892	/nfs/dbraw/zinc/17/58/92/267175892.db2.gz	NKWIIYZPTFRSIV-WMLDXEAASA-N	0	3	329.444	3.293	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC000274210981	267199760	/nfs/dbraw/zinc/19/97/60/267199760.db2.gz	WMTLUWXGUYZBFY-FQEVSTJZSA-N	0	3	341.455	3.391	20	30		EGEDHN
CN(C)C[C@@H]1CCCCN1C(=O)CCCCOc1cccc(C#N)c1	ZINC000517680896	267282782	/nfs/dbraw/zinc/28/27/82/267282782.db2.gz	LBUDMZVBXPLBCP-SFHVURJKSA-N	0	3	343.471	3.050	20	30		EGEDHN
Cc1cc(NC(=O)N[C@H](C)CN2CCCCC2)c(C#N)cc1N(C)C	ZINC000331230659	267334270	/nfs/dbraw/zinc/33/42/70/267334270.db2.gz	HIFUQJIDZJGYHA-OAHLLOKOSA-N	0	3	343.475	3.133	20	30		EGEDHN
CO[C@@H]1CCCC[C@@H]1N[C@@H](C)C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000275253302	267335946	/nfs/dbraw/zinc/33/59/46/267335946.db2.gz	QLPVSHCICZGPCI-KNXALSJPSA-N	0	3	335.835	3.086	20	30		EGEDHN
Cc1ccc([C@@H]2CCCN2C[C@@H](O)COc2ccccc2C#N)cc1	ZINC000528337086	268044168	/nfs/dbraw/zinc/04/41/68/268044168.db2.gz	HNOHVXPWRRFUSS-UXHICEINSA-N	0	3	336.435	3.444	20	30		EGEDHN
Cc1ccc([C@@H]2C[C@H](C)N(CC(=O)NCc3cccc(C#N)c3)C2)cc1	ZINC000490101027	268045235	/nfs/dbraw/zinc/04/52/35/268045235.db2.gz	QSJVIUKNKNHCSA-LAUBAEHRSA-N	0	3	347.462	3.361	20	30		EGEDHN
N#Cc1ccc(CNC2CCN(C(=O)c3ccccc3)CC2)c(F)c1	ZINC000269470577	268072742	/nfs/dbraw/zinc/07/27/42/268072742.db2.gz	ZYCZHHCRGDAZQE-UHFFFAOYSA-N	0	3	337.398	3.092	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCN(c3ccccc3F)C2)c(F)c1	ZINC000291080337	268073853	/nfs/dbraw/zinc/07/38/53/268073853.db2.gz	UUUZDXBBBLBQRI-HNNXBMFYSA-N	0	3	327.378	3.453	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CCC(c3ccncc3)CC2)cc1	ZINC000281361866	268083330	/nfs/dbraw/zinc/08/33/30/268083330.db2.gz	YLCZJLSWWMIBRX-FQEVSTJZSA-N	0	3	344.418	3.042	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CC=C(c3ccccc3)C2)cc1	ZINC000370027336	268084250	/nfs/dbraw/zinc/08/42/50/268084250.db2.gz	AQYCZPOCDFFCAO-FQEVSTJZSA-N	0	3	327.387	3.166	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CC[C@H](c3ccccc3)C2)cc1	ZINC000279421008	268084276	/nfs/dbraw/zinc/08/42/76/268084276.db2.gz	WXBOWNUENVBRSV-PMACEKPBSA-N	0	3	329.403	3.257	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@@H]2CSc3ccccc32)cc1	ZINC000348294154	268086932	/nfs/dbraw/zinc/08/69/32/268086932.db2.gz	QJWWOHOPKHPPOH-DOTOQJQBSA-N	0	3	333.416	3.204	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@H]2CCOc3c(F)cccc32)cc1	ZINC000280075876	268092251	/nfs/dbraw/zinc/09/22/51/268092251.db2.gz	QSWLUQKFMXYNTJ-QAPCUYQASA-N	0	3	349.365	3.020	20	30		EGEDHN
N#Cc1cc(NC(=O)N2CCN(CC3CCCCC3)CC2)ccc1F	ZINC000481623932	268187616	/nfs/dbraw/zinc/18/76/16/268187616.db2.gz	KQVFAVAPVQAQIB-UHFFFAOYSA-N	0	3	344.434	3.427	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CSCCN2Cc2ccccc2)cc1	ZINC000428551790	268233488	/nfs/dbraw/zinc/23/34/88/268233488.db2.gz	XXNAXDCCBYGFCJ-HXUWFJFHSA-N	0	3	337.492	3.265	20	30		EGEDHN
N#Cc1cccc(C#N)c1NC[C@H]1CN(Cc2ccccc2)CCCO1	ZINC000302886384	268236308	/nfs/dbraw/zinc/23/63/08/268236308.db2.gz	MZLJOZBCECCXNK-FQEVSTJZSA-N	0	3	346.434	3.133	20	30		EGEDHN
N#Cc1cccc(C2(NC[C@H](O)COc3cccc4[nH]ccc43)CC2)c1	ZINC000271792392	268240878	/nfs/dbraw/zinc/24/08/78/268240878.db2.gz	NNSSWDVVRIWUBM-KRWDZBQOSA-N	0	3	347.418	3.058	20	30		EGEDHN
N#Cc1ccccc1-c1ccc(CN2C[C@@H]3CCC[C@@H]3[C@H]2C(N)=O)cc1	ZINC000527056171	268295404	/nfs/dbraw/zinc/29/54/04/268295404.db2.gz	SQDDHLOHOULSTF-JBACZVJFSA-N	0	3	345.446	3.311	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CN1CCC[C@H]1c1cccs1	ZINC000528339809	268296057	/nfs/dbraw/zinc/29/60/57/268296057.db2.gz	QHAWAWIRLOLFDT-HOTGVXAUSA-N	0	3	328.437	3.197	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CN[C@@H]1CCc2sc(Cl)cc21	ZINC000530234650	268298530	/nfs/dbraw/zinc/29/85/30/268298530.db2.gz	SFJJGHBGTAEOBA-GXTWGEPZSA-N	0	3	348.855	3.290	20	30		EGEDHN
CS[C@H]1CN(c2ccc(C(F)(F)F)c(C#N)c2)C[C@@H]1N(C)C	ZINC000361704078	274186566	/nfs/dbraw/zinc/18/65/66/274186566.db2.gz	FLHBBUWQTWRNOC-KBPBESRZSA-N	0	3	329.391	3.059	20	30		EGEDHN
CC(C)(CO)[C@H](NCCOc1cccc(C#N)c1)c1cccs1	ZINC000289366934	276328586	/nfs/dbraw/zinc/32/85/86/276328586.db2.gz	OSOUHGLZWHUNHV-QGZVFWFLSA-N	0	3	330.453	3.348	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)c1nc2cc(F)ccc2o1	ZINC000161946076	307907895	/nfs/dbraw/zinc/90/78/95/307907895.db2.gz	OGSWGZITVKTSDA-UHFFFAOYSA-N	0	3	338.386	3.407	20	30		EGEDHN
C[C@H](N[C@@H](C)[C@H]1CN(Cc2ccccc2)CCO1)c1cccc(C#N)c1	ZINC000537293995	314172943	/nfs/dbraw/zinc/17/29/43/314172943.db2.gz	POVZINNLPJRJBO-NPPFBWRTSA-N	0	3	349.478	3.498	20	30		EGEDHN
C[C@H](N[C@@H](C)[C@@H]1CN(Cc2ccccc2)CCO1)c1cccc(C#N)c1	ZINC000537293996	314173224	/nfs/dbraw/zinc/17/32/24/314173224.db2.gz	POVZINNLPJRJBO-SPEDKVCISA-N	0	3	349.478	3.498	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@H](NCc1ccccc1CN1CCCC1=O)CC2	ZINC000558499228	315574380	/nfs/dbraw/zinc/57/43/80/315574380.db2.gz	QTWWDOGKTLEOQO-OAQYLSRUSA-N	0	3	345.446	3.458	20	30		EGEDHN
COc1ccc(C#N)cc1NC(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000565434749	316324427	/nfs/dbraw/zinc/32/44/27/316324427.db2.gz	XAABFYLOXQQNKU-QGZVFWFLSA-N	0	3	335.407	3.027	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)Nc1cccc(C#N)n1)c1ccsc1	ZINC000568999230	316852775	/nfs/dbraw/zinc/85/27/75/316852775.db2.gz	VHGMGRZZYZPTEL-HNNXBMFYSA-N	0	3	343.456	3.219	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2NC[C@H](O)COc1ccccc1F	ZINC000569232092	316885742	/nfs/dbraw/zinc/88/57/42/316885742.db2.gz	ITVPCUXWICPZOW-LPHOPBHVSA-N	0	3	340.398	3.104	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](O)CO[C@@H]2CCCc3ccccc32)s1	ZINC000570564025	317074275	/nfs/dbraw/zinc/07/42/75/317074275.db2.gz	FJBLZMHGFIPYGK-DNVCBOLYSA-N	0	3	342.464	3.164	20	30		EGEDHN
N#Cc1ccc2c(c1)CCCC[C@@H]2NCCC(=O)N1CCCCC1	ZINC000571139498	317155544	/nfs/dbraw/zinc/15/55/44/317155544.db2.gz	LKVPEWRQXDVCME-IBGZPJMESA-N	0	3	325.456	3.318	20	30		EGEDHN
CC[C@@H](CSc1ccccc1)NCc1cnc2c(C#N)cnn2c1	ZINC000572722088	317381776	/nfs/dbraw/zinc/38/17/76/317381776.db2.gz	POKKTJFQJVHTIX-INIZCTEOSA-N	0	3	337.452	3.261	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)CC1	ZINC000573729240	317522653	/nfs/dbraw/zinc/52/26/53/317522653.db2.gz	CTEGCLFNEMNMNZ-RUCARUNLSA-N	0	3	327.472	3.275	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C	ZINC000294428730	455815247	/nfs/dbraw/zinc/81/52/47/455815247.db2.gz	NQDXWCSXVJSPDJ-RHSMWYFYSA-N	0	3	336.501	3.109	20	30		EGEDHN
COc1ccc([C@@H](CNCc2cc(C#N)cs2)N(C)C)cc1OC	ZINC000177680904	323343803	/nfs/dbraw/zinc/34/38/03/323343803.db2.gz	DNWFNDNOEHRSIM-MRXNPFEDSA-N	0	3	345.468	3.029	20	30		EGEDHN
CC(C)NC(=O)Nc1ccc(CNCc2cc(C#N)cs2)cc1	ZINC000177687915	323344308	/nfs/dbraw/zinc/34/43/08/323344308.db2.gz	BIJGRLBTUPUWCN-UHFFFAOYSA-N	0	3	328.441	3.439	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCNC1(c2cccc(F)c2)CC1	ZINC000179686555	323400844	/nfs/dbraw/zinc/40/08/44/323400844.db2.gz	GLYHHKRCTHHSGS-UHFFFAOYSA-N	0	3	329.400	3.366	20	30		EGEDHN
CSc1cc(C)ccc1CNC[C@H](O)COc1ccc(C#N)cc1	ZINC000582959441	325483670	/nfs/dbraw/zinc/48/36/70/325483670.db2.gz	AJSSQCZPPUZTLK-KRWDZBQOSA-N	0	3	342.464	3.118	20	30		EGEDHN
C[S@@](=O)C[C@@H](NCCCOc1cccc(C#N)c1)c1ccccc1	ZINC000183086323	455225042	/nfs/dbraw/zinc/22/50/42/455225042.db2.gz	RQQFFKHPJRIBPA-NTKDMRAZSA-N	0	3	342.464	3.037	20	30		EGEDHN
Cc1cccc(C)c1CC(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000180767595	455241723	/nfs/dbraw/zinc/24/17/23/455241723.db2.gz	OCFMCXDTCMTFPL-UHFFFAOYSA-N	0	3	349.478	3.308	20	30		EGEDHN
C[C@@H](N[C@@H](C)C(=O)N(C)CCC#N)c1ccc(-c2ccncc2)cc1	ZINC000180910995	455262838	/nfs/dbraw/zinc/26/28/38/455262838.db2.gz	SFASHXQNLUCECB-CVEARBPZSA-N	0	3	336.439	3.160	20	30		EGEDHN
N#Cc1ccccc1OCCN1CC[C@H](Oc2cccc(F)c2)C1	ZINC000612174704	460561540	/nfs/dbraw/zinc/56/15/40/460561540.db2.gz	MIHPLHMFADLPOV-SFHVURJKSA-N	0	3	326.371	3.229	20	30		EGEDHN
N#Cc1ccccc1OCCN1CC[C@@H](Oc2cccc(F)c2)C1	ZINC000612174703	460561716	/nfs/dbraw/zinc/56/17/16/460561716.db2.gz	MIHPLHMFADLPOV-GOSISDBHSA-N	0	3	326.371	3.229	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCCN1CCN(C)C[C@@H]1c1ccccc1	ZINC000190378660	455305907	/nfs/dbraw/zinc/30/59/07/455305907.db2.gz	MMIREEGXEKJXKI-TZIWHRDSSA-N	0	3	343.515	3.084	20	30		EGEDHN
C=CCOc1c(Cl)cc(CNCC2(CO)CCC2)cc1OC	ZINC000623490560	460577229	/nfs/dbraw/zinc/57/72/29/460577229.db2.gz	ONPRYKBDHZHIRE-UHFFFAOYSA-N	0	3	325.836	3.166	20	30		EGEDHN
C[C@H](NCCC(=O)NC1CCCCC1)c1ccc(OCC#N)cc1	ZINC000181546370	455353617	/nfs/dbraw/zinc/35/36/17/455353617.db2.gz	VPWLABMWURVCHX-HNNXBMFYSA-N	0	3	329.444	3.079	20	30		EGEDHN
CN(C(=O)CN1CCC[C@H]1Cc1ccccc1)C1(C#N)CCCCC1	ZINC000025358819	453767843	/nfs/dbraw/zinc/76/78/43/453767843.db2.gz	INMKKERLUATNBZ-IBGZPJMESA-N	0	3	339.483	3.378	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CN(Cc2cccs2)C2CC2)cc1	ZINC000027108971	453810978	/nfs/dbraw/zinc/81/09/78/453810978.db2.gz	XHUZTQWYCGLRPN-INIZCTEOSA-N	0	3	328.437	3.024	20	30		EGEDHN
C[C@@H](c1ccc(F)c(F)c1)N(C)C[C@@H](O)COc1ccc(C#N)cc1	ZINC000028275525	453822969	/nfs/dbraw/zinc/82/29/69/453822969.db2.gz	RDYCDNRIMOXPPU-XJKSGUPXSA-N	0	3	346.377	3.269	20	30		EGEDHN
CCN1CCC(NC(=O)c2ccccc2-c2ccccc2C#N)CC1	ZINC000029608899	453830204	/nfs/dbraw/zinc/83/02/04/453830204.db2.gz	YBXBEMGYIDMYGJ-UHFFFAOYSA-N	0	3	333.435	3.439	20	30		EGEDHN
CSc1ccc([C@@H](C)NC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000030534648	453836387	/nfs/dbraw/zinc/83/63/87/453836387.db2.gz	BLCCNPSERVJKTG-PBHICJAKSA-N	0	3	342.464	3.371	20	30		EGEDHN
CN(CC#Cc1ccc(OC(F)(F)F)cc1)C[C@H]1CCC[C@@H]1O	ZINC000159523025	455382673	/nfs/dbraw/zinc/38/26/73/455382673.db2.gz	YINARAFSTUNFJK-ZBFHGGJFSA-N	0	3	327.346	3.030	20	30		EGEDHN
N#Cc1ccc(SCC(=O)N[C@@H]2CCN(CC3CCCC3)C2)cc1	ZINC000081290297	453856651	/nfs/dbraw/zinc/85/66/51/453856651.db2.gz	QDNAOXJOVCLHRZ-QGZVFWFLSA-N	0	3	343.496	3.031	20	30		EGEDHN
C=CCC[C@@H](O)CN1CCN(c2ccc(C(F)(F)F)cc2)CC1	ZINC000034912042	453920935	/nfs/dbraw/zinc/92/09/35/453920935.db2.gz	WIKVRRYQXCYOLK-MRXNPFEDSA-N	0	3	328.378	3.155	20	30		EGEDHN
COc1ccc(CN2CCCN(c3cccc(F)c3C#N)CC2)cc1	ZINC000054370350	453925829	/nfs/dbraw/zinc/92/58/29/453925829.db2.gz	WSCJZUWIORGUJY-UHFFFAOYSA-N	0	3	339.414	3.418	20	30		EGEDHN
C=CCN(CCC(=O)Nc1ccc2c(c1)OCO2)Cc1cccs1	ZINC000054427176	453929575	/nfs/dbraw/zinc/92/95/75/453929575.db2.gz	IOWDQTSMWZHVNW-UHFFFAOYSA-N	0	3	344.436	3.494	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN1CCC[C@@H]1c1cccc(N(C)C)c1	ZINC000075838511	453930243	/nfs/dbraw/zinc/93/02/43/453930243.db2.gz	VQXNAJXTNHCRMN-LJQANCHMSA-N	0	3	327.472	3.090	20	30		EGEDHN
CC[C@H](Cc1ccc(C)cc1)N(C)CC(=O)N[C@@](C)(C#N)C1CC1	ZINC000075885873	453935508	/nfs/dbraw/zinc/93/55/08/453935508.db2.gz	TXIKTXIWBGMUHI-QUCCMNQESA-N	0	3	327.472	3.056	20	30		EGEDHN
N#Cc1cccc(NC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)c1	ZINC000075984681	453945507	/nfs/dbraw/zinc/94/55/07/453945507.db2.gz	MOHWDLRFGCPWKF-IBGZPJMESA-N	0	3	334.423	3.344	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1)C(=O)Nc1ccc(CC#N)cc1	ZINC000076084992	453960920	/nfs/dbraw/zinc/96/09/20/453960920.db2.gz	BUFJTOJEDFKIAD-UHFFFAOYSA-N	0	3	336.439	3.348	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)c2cccc(CC#N)c2)N(C)C)cc1	ZINC000042379224	454008765	/nfs/dbraw/zinc/00/87/65/454008765.db2.gz	IYACECVEERGAOY-FQEVSTJZSA-N	0	3	335.451	3.348	20	30		EGEDHN
CN(C)[C@@H]1CCCN(C(=O)c2ccccc2-c2ccccc2C#N)C1	ZINC000068487073	454030642	/nfs/dbraw/zinc/03/06/42/454030642.db2.gz	ASSWVPSGTXTOMU-QGZVFWFLSA-N	0	3	333.435	3.391	20	30		EGEDHN
CN(C)[C@H](CNc1c(C#N)nnc2ccccc21)c1cccc(F)c1	ZINC000077165594	454069316	/nfs/dbraw/zinc/06/93/16/454069316.db2.gz	DFCPMRRLOXDYLP-GOSISDBHSA-N	0	3	335.386	3.355	20	30		EGEDHN
CC(C)CCN(C)CC(=O)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000077211781	454075907	/nfs/dbraw/zinc/07/59/07/454075907.db2.gz	UGPAKKUBKKTPJU-UHFFFAOYSA-N	0	3	340.389	3.151	20	30		EGEDHN
C=CCOc1ccc(CNCc2ccc(C(=O)NC3CC3)cc2)cc1	ZINC000069063722	454076541	/nfs/dbraw/zinc/07/65/41/454076541.db2.gz	PJMKJPQEIVNNMZ-UHFFFAOYSA-N	0	3	336.435	3.433	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cnc(Cc3ccccc3)s2)CC1	ZINC000087318078	454076808	/nfs/dbraw/zinc/07/68/08/454076808.db2.gz	QHPVUYADCBUDMP-UHFFFAOYSA-N	0	3	341.480	3.114	20	30		EGEDHN
N#CC(C(=O)c1cccc(-n2cccn2)c1)c1cnc2ccccc2n1	ZINC000190902123	455401161	/nfs/dbraw/zinc/40/11/61/455401161.db2.gz	NKYLNXIQIRDLDL-MRXNPFEDSA-N	0	3	339.358	3.306	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@H]1CCCN(Cc2ccc(C#N)cc2)C1	ZINC000058225098	454172845	/nfs/dbraw/zinc/17/28/45/454172845.db2.gz	WUOFWERWMTYAGT-QGZVFWFLSA-N	0	3	329.444	3.295	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)c2ccsc2)cc1Cl	ZINC000130317289	454190907	/nfs/dbraw/zinc/19/09/07/454190907.db2.gz	DJFCMZVPLWUWPH-LLVKDONJSA-N	0	3	334.784	3.371	20	30		EGEDHN
CN(Cc1cn(CCC#N)nc1-c1ccccc1)[C@H]1CCSC1	ZINC000130500790	454201804	/nfs/dbraw/zinc/20/18/04/454201804.db2.gz	RGKHUPODDJNLIR-KRWDZBQOSA-N	0	3	326.469	3.401	20	30		EGEDHN
Cc1cccc(OCCN2CCCN(c3ccccc3C#N)CC2)c1	ZINC000058580574	454218067	/nfs/dbraw/zinc/21/80/67/454218067.db2.gz	UEJWTXGLWQHVOX-UHFFFAOYSA-N	0	3	335.451	3.458	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)CCCc1ccccc1	ZINC000047011563	454318109	/nfs/dbraw/zinc/31/81/09/454318109.db2.gz	QGKRZXJMHUGPIR-UHFFFAOYSA-N	0	3	349.478	3.471	20	30		EGEDHN
CCSCC[C@@H](C)N(C)CC(=O)N(C)C1(C#N)CCCCC1	ZINC000072900362	454361820	/nfs/dbraw/zinc/36/18/20/454361820.db2.gz	OQMSMUXDRHKLTJ-OAHLLOKOSA-N	0	3	325.522	3.135	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCCN2CCN(c3ccccc3)CC2)cc1	ZINC000079094799	454368011	/nfs/dbraw/zinc/36/80/11/454368011.db2.gz	BHNDAWXRAREIRZ-UHFFFAOYSA-N	0	3	348.450	3.099	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)c2cccc(Nc3cnccn3)c2)n1	ZINC000097034275	454391540	/nfs/dbraw/zinc/39/15/40/454391540.db2.gz	SSPNCJSIJANOEA-CQSZACIVSA-N	0	3	335.392	3.475	20	30		EGEDHN
CC(C)N(CCc1nc2ccccc2c(=O)[nH]1)Cc1ccc(C#N)cc1	ZINC000063750284	454445008	/nfs/dbraw/zinc/44/50/08/454445008.db2.gz	UVOIYVJXGDGXRG-UHFFFAOYSA-N	0	3	346.434	3.248	20	30		EGEDHN
C=CCN(Cc1ccccc1F)C(=O)N[C@H](C)CN1CCCCC1	ZINC000079610567	454450098	/nfs/dbraw/zinc/45/00/98/454450098.db2.gz	ZSKBTMSPWORQOL-MRXNPFEDSA-N	0	3	333.451	3.398	20	30		EGEDHN
CCCn1nc(C)c(C(=O)C(C#N)c2nc3ccccc3n2C)c1C	ZINC000134118058	454504976	/nfs/dbraw/zinc/50/49/76/454504976.db2.gz	XJXJDLZPDPYHEU-AWEZNQCLSA-N	0	3	335.411	3.287	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(F)cc2C(F)(F)F)CC1	ZINC000102737954	454518368	/nfs/dbraw/zinc/51/83/68/454518368.db2.gz	QOVYVSKRIZTEAG-UHFFFAOYSA-N	0	3	328.309	3.128	20	30		EGEDHN
CC[C@H](c1ccncc1)N(C)CCC(=O)Nc1sccc1C#N	ZINC000092224880	454538919	/nfs/dbraw/zinc/53/89/19/454538919.db2.gz	XYMBMQVHNGJLCW-OAHLLOKOSA-N	0	3	328.441	3.426	20	30		EGEDHN
COc1ccc(CN(C)CCC(=O)Nc2ccc(C#N)cc2)cc1C	ZINC000103145451	454541111	/nfs/dbraw/zinc/54/11/11/454541111.db2.gz	MHFQGSSXNDWQLS-UHFFFAOYSA-N	0	3	337.423	3.336	20	30		EGEDHN
C#CCNC(=O)[C@H](C)N[C@H](Cc1ccccc1)c1sccc1C	ZINC000122766516	454566590	/nfs/dbraw/zinc/56/65/90/454566590.db2.gz	KKGZHEBELTULGO-DOTOQJQBSA-N	0	3	326.465	3.068	20	30		EGEDHN
Cc1cccc(C2(NCC(=O)N[C@@](C)(C#N)C(C)C)CCCC2)c1	ZINC000104076752	454574016	/nfs/dbraw/zinc/57/40/16/454574016.db2.gz	ZEDFGNFPDFXPRS-IBGZPJMESA-N	0	3	327.472	3.408	20	30		EGEDHN
C#CCCOc1ccc(CN2CCC(OC[C@@H]3CCCO3)CC2)cc1	ZINC000092662045	454604816	/nfs/dbraw/zinc/60/48/16/454604816.db2.gz	ZGCYSFDZBJBJOS-NRFANRHFSA-N	0	3	343.467	3.249	20	30		EGEDHN
C=C(C)COc1cc(CNC[C@H](O)Cc2ccccc2)ccc1OC	ZINC000105493116	454641050	/nfs/dbraw/zinc/64/10/50/454641050.db2.gz	TZPTVSPBAADTEC-LJQANCHMSA-N	0	3	341.451	3.343	20	30		EGEDHN
Cc1ccc(C(=O)N(CCN(C)C)Cc2cccc(C#N)c2)s1	ZINC000065931219	454641204	/nfs/dbraw/zinc/64/12/04/454641204.db2.gz	DQWIIYDDKDQBEC-UHFFFAOYSA-N	0	3	327.453	3.132	20	30		EGEDHN
C[C@H](NC(=O)N1CCC[C@H]1CN1CCCCC1)c1cccc(C#N)c1	ZINC000074917436	454658137	/nfs/dbraw/zinc/65/81/37/454658137.db2.gz	BSVPMBKSPYUBFI-LPHOPBHVSA-N	0	3	340.471	3.279	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C2(c3ccc(F)cc3)CCC2)CC1	ZINC000106037182	454675127	/nfs/dbraw/zinc/67/51/27/454675127.db2.gz	PXKYVDWWPMWTEI-UHFFFAOYSA-N	0	3	330.447	3.404	20	30		EGEDHN
C=CCNC(=O)[C@H](C)N1CCC(c2c(C)[nH]c3ccccc32)CC1	ZINC000052464671	454675415	/nfs/dbraw/zinc/67/54/15/454675415.db2.gz	OSYRSQDHCUJHRQ-HNNXBMFYSA-N	0	3	325.456	3.346	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Cc2coc(-c3ccccc3)n2)CC1	ZINC000106038174	454675481	/nfs/dbraw/zinc/67/54/81/454675481.db2.gz	QILYOIWEMGRMLY-UHFFFAOYSA-N	0	3	339.439	3.041	20	30		EGEDHN
C=C(C)CN1CCC(NCc2c(C)nn(CC(C)C)c2OCC)CC1	ZINC000106245645	454687697	/nfs/dbraw/zinc/68/76/97/454687697.db2.gz	ZOUKDOBYHMAHRS-UHFFFAOYSA-N	0	3	348.535	3.376	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC[C@H]2CCCc3ccccc32)CC1	ZINC000106256959	454688606	/nfs/dbraw/zinc/68/86/06/454688606.db2.gz	LOLDDILNRVIGQT-GOSISDBHSA-N	0	3	341.499	3.446	20	30		EGEDHN
C#CCOc1ccc(CN2CCC(OC[C@@H]3CCCCO3)CC2)cc1	ZINC000093842314	454740026	/nfs/dbraw/zinc/74/00/26/454740026.db2.gz	BUZNWOSBSYJJJJ-NRFANRHFSA-N	0	3	343.467	3.249	20	30		EGEDHN
Cn1cc(C[C@H]2CCN(Cc3cccc(OCCCC#N)c3)C2)cn1	ZINC000093870137	454742899	/nfs/dbraw/zinc/74/28/99/454742899.db2.gz	GNHMRPURCSSWEZ-GOSISDBHSA-N	0	3	338.455	3.167	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CC[C@@H](Cc3ccccc3)C2)CC1	ZINC000176501076	454753051	/nfs/dbraw/zinc/75/30/51/454753051.db2.gz	VPKFQAQODGRXSM-IBGZPJMESA-N	0	3	341.499	3.301	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2C[C@@H](C)[C@@H]2c2ccccc2)CC1	ZINC000176498530	454753156	/nfs/dbraw/zinc/75/31/56/454753156.db2.gz	WAQZAUZOJXQMLT-VQIMIIECSA-N	0	3	327.472	3.430	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1CCC(OC(C)(C)C)CC1	ZINC000162386375	454771460	/nfs/dbraw/zinc/77/14/60/454771460.db2.gz	VVZUMQMYKOTCME-UHFFFAOYSA-N	0	3	332.444	3.225	20	30		EGEDHN
CCN(CC)Cc1cccc(NC(=O)CNc2ccc(C#N)cc2)c1	ZINC000138525071	454794519	/nfs/dbraw/zinc/79/45/19/454794519.db2.gz	KSVNEYNNLGXSDO-UHFFFAOYSA-N	0	3	336.439	3.451	20	30		EGEDHN
C#CCOc1cccc(NC(=O)NCc2cccc(CN(C)C)c2)c1	ZINC000108519223	454801821	/nfs/dbraw/zinc/80/18/21/454801821.db2.gz	QVWFMKUIQJCVKC-UHFFFAOYSA-N	0	3	337.423	3.082	20	30		EGEDHN
N#Cc1ccc(OC2CCC(NCc3cn4ccccc4n3)CC2)nc1	ZINC000125425234	454820396	/nfs/dbraw/zinc/82/03/96/454820396.db2.gz	MHAIOPDONBFRJX-UHFFFAOYSA-N	0	3	347.422	3.081	20	30		EGEDHN
COCCN1CCC(Nc2ccc(C#N)c(C(F)(F)F)c2)CC1	ZINC000109129148	454821889	/nfs/dbraw/zinc/82/18/89/454821889.db2.gz	IQPJLFZBSOVZNS-UHFFFAOYSA-N	0	3	327.350	3.100	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN1CCC[C@H]1c1ccncc1	ZINC000154033095	454858677	/nfs/dbraw/zinc/85/86/77/454858677.db2.gz	QIEURHGLSPTPKH-HNNXBMFYSA-N	0	3	326.425	3.180	20	30		EGEDHN
C[C@@H](N[C@@H](C)C(=O)NC1(C#N)CCCCC1)[C@H](C)c1ccccc1	ZINC000177481731	454868569	/nfs/dbraw/zinc/86/85/69/454868569.db2.gz	VASGPOWVADEIQG-BBWFWOEESA-N	0	3	327.472	3.499	20	30		EGEDHN
CC1(C)CN(CCC(=O)Nc2ccc(C#N)c(Cl)c2)CCS1	ZINC000177509732	454872177	/nfs/dbraw/zinc/87/21/77/454872177.db2.gz	NSVIVAMQBPOKJG-UHFFFAOYSA-N	0	3	337.876	3.368	20	30		EGEDHN
CCS[C@H]1CCCCN([C@@H](C)C(=O)NC2(C#N)CCCCC2)C1	ZINC000112088082	454879974	/nfs/dbraw/zinc/87/99/74/454879974.db2.gz	VUYSQTIKEDCRKV-HOTGVXAUSA-N	0	3	337.533	3.325	20	30		EGEDHN
C[C@H](NCC1(c2cccc(F)c2)CCCCC1)C(=O)N(C)CCC#N	ZINC000112536029	454888952	/nfs/dbraw/zinc/88/89/52/454888952.db2.gz	KQKMSQWXINIZLP-INIZCTEOSA-N	0	3	345.462	3.378	20	30		EGEDHN
C#CCSCCNCc1nc2cc(C(F)(F)F)ccc2n1C	ZINC000150816997	454896412	/nfs/dbraw/zinc/89/64/12/454896412.db2.gz	CQQQDBXDMNGGDF-UHFFFAOYSA-N	0	3	327.375	3.048	20	30		EGEDHN
C=CCCOCCNC(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1	ZINC000127266438	454949845	/nfs/dbraw/zinc/94/98/45/454949845.db2.gz	RVZBYFNJYFUYEL-IBGZPJMESA-N	0	3	345.487	3.024	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)CN[C@@H](C)c1ccc2c(c1)CCCC2	ZINC000128209186	455034699	/nfs/dbraw/zinc/03/46/99/455034699.db2.gz	JFIVHRNYLIRIHE-MGPUTAFESA-N	0	3	327.472	3.270	20	30		EGEDHN
Cc1ccc(F)c(C(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)c1	ZINC000171273068	455055159	/nfs/dbraw/zinc/05/51/59/455055159.db2.gz	LDRKRQJSICMVFR-UHFFFAOYSA-N	0	3	339.414	3.210	20	30		EGEDHN
C=CCC[C@H](NC(=O)Nc1ccn(CCN(C)C)n1)c1ccccc1	ZINC000155885211	455057430	/nfs/dbraw/zinc/05/74/30/455057430.db2.gz	USPBIBGUBVVYDK-KRWDZBQOSA-N	0	3	341.459	3.274	20	30		EGEDHN
COC(=O)[C@@H](C)[C@@H](NCCOc1ccccc1C#N)c1ccccc1	ZINC000152136830	455077452	/nfs/dbraw/zinc/07/74/52/455077452.db2.gz	IKOQSSQMQGMLOA-HNAYVOBHSA-N	0	3	338.407	3.077	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(-c3ncco3)cc2)CC1	ZINC000179836475	455086723	/nfs/dbraw/zinc/08/67/23/455086723.db2.gz	WOZAJQQNHGYZPW-UHFFFAOYSA-N	0	3	326.400	3.114	20	30		EGEDHN
C[C@H](N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O)c1cccs1	ZINC000179963849	455107703	/nfs/dbraw/zinc/10/77/03/455107703.db2.gz	OBZVVLQSVQTGIZ-BBRMVZONSA-N	0	3	325.437	3.466	20	30		EGEDHN
CCCCNC(=O)[C@@H]1CC[C@@H](C)N(CC#Cc2ccc(F)cc2)C1	ZINC000156357942	455109208	/nfs/dbraw/zinc/10/92/08/455109208.db2.gz	WESXCWKXEJHAEL-SJLPKXTDSA-N	0	3	330.447	3.194	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H](CC)CSc2ccccc2)CC1	ZINC000156362645	455109261	/nfs/dbraw/zinc/10/92/61/455109261.db2.gz	WTQVBPXRRDGXTK-QGZVFWFLSA-N	0	3	330.497	3.019	20	30		EGEDHN
CCCCNC(=O)[C@H]1CC[C@@H](C)N(Cc2cc(C#N)ccc2OC)C1	ZINC000156360022	455109291	/nfs/dbraw/zinc/10/92/91/455109291.db2.gz	ZODFPCYJFKEHLP-WBVHZDCISA-N	0	3	343.471	3.084	20	30		EGEDHN
CC[C@@H](NCC(=O)N[C@@](C)(C#N)C1CC1)C(C)(C)c1ccccc1	ZINC000180008503	455115674	/nfs/dbraw/zinc/11/56/74/455115674.db2.gz	MRUXLORHFBTNTL-XLIONFOSSA-N	0	3	327.472	3.141	20	30		EGEDHN
C[C@H]1C[C@@H]1[C@H](NCCC(=O)N(C)CCC#N)c1ccc(Cl)cc1	ZINC000180016351	455116580	/nfs/dbraw/zinc/11/65/80/455116580.db2.gz	CPGRNMVXDALQSD-QANKJYHBSA-N	0	3	333.863	3.389	20	30		EGEDHN
C[C@H](N[C@H](c1ccc(Cl)cc1)[C@@H]1C[C@@H]1C)C(=O)N(C)CCC#N	ZINC000180022000	455117941	/nfs/dbraw/zinc/11/79/41/455117941.db2.gz	RLORCBSTKASKOR-WRFANHODSA-N	0	3	333.863	3.387	20	30		EGEDHN
C=CCNC(=O)NC(=O)[C@H](C)N[C@H](c1ccc(Cl)cc1)[C@H]1C[C@@H]1C	ZINC000180022096	455118127	/nfs/dbraw/zinc/11/81/27/455118127.db2.gz	MPWJGJPVMGWHDU-GVAFMPQTSA-N	0	3	349.862	3.027	20	30		EGEDHN
C=CCNC(=O)CN[C@@H](C)[C@H](C)Oc1ccc(Cl)cc1Cl	ZINC000180029010	455118524	/nfs/dbraw/zinc/11/85/24/455118524.db2.gz	RGJSCGLKNBTTLQ-QWRGUYRKSA-N	0	3	331.243	3.041	20	30		EGEDHN
N#CC(C(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ccccn1	ZINC000156473200	455122423	/nfs/dbraw/zinc/12/24/23/455122423.db2.gz	ZAERPXJQQFGIIU-LBPRGKRZSA-N	0	3	335.241	3.499	20	30		EGEDHN
C=CCC[C@@H](N[C@@H]1CCN(CC(F)(F)F)C1=O)c1ccccc1	ZINC000180050448	455122694	/nfs/dbraw/zinc/12/26/94/455122694.db2.gz	YGEUWCJPMXQDDO-HUUCEWRRSA-N	0	3	326.362	3.447	20	30		EGEDHN
CCN(C[C@H]1CCN(Cc2ccc(C#N)s2)C1)CC(F)(F)F	ZINC000180048241	455122856	/nfs/dbraw/zinc/12/28/56/455122856.db2.gz	LDMPXVZXCCMDNR-GFCCVEGCSA-N	0	3	331.407	3.326	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)Nc2ccc(C#N)cc2)CN1Cc1ccccc1	ZINC000152580618	455139309	/nfs/dbraw/zinc/13/93/09/455139309.db2.gz	GBVSDPGEZMTFJE-HNAYVOBHSA-N	0	3	334.423	3.343	20	30		EGEDHN
C[C@@](C#N)(NC(=O)CN[C@@H](c1ccc(F)cc1)C1CCCC1)C1CC1	ZINC000180283015	455154694	/nfs/dbraw/zinc/15/46/94/455154694.db2.gz	XOZOGUICUFMWKB-UXHICEINSA-N	0	3	343.446	3.455	20	30		EGEDHN
C[C@@H](NCCC(=O)Nc1cccc(C#N)c1)c1cccc([N+](=O)[O-])c1	ZINC000180448210	455171772	/nfs/dbraw/zinc/17/17/72/455171772.db2.gz	RRLRLMGIZKJRBV-CYBMUJFWSA-N	0	3	338.367	3.146	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CNCc2ccccc2-n2ccnc2)cc1	ZINC000237493042	455188718	/nfs/dbraw/zinc/18/87/18/455188718.db2.gz	XXJWMXJTFONUML-INIZCTEOSA-N	0	3	332.407	3.453	20	30		EGEDHN
COc1ccc(CNc2cccc(N(C)C)n2)cc1OCCCC#N	ZINC000180528112	455189590	/nfs/dbraw/zinc/18/95/90/455189590.db2.gz	JWHOMSCNFKEHJK-UHFFFAOYSA-N	0	3	340.427	3.451	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCc3sccc3[C@H]2CC)CC1	ZINC000264352767	455197580	/nfs/dbraw/zinc/19/75/80/455197580.db2.gz	MPDCHTFSBOWJQH-MRXNPFEDSA-N	0	3	333.501	3.417	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc(F)c(F)c2F)CC1	ZINC000264368901	455200139	/nfs/dbraw/zinc/20/01/39/455200139.db2.gz	JGIMCMKFJXSOLF-UHFFFAOYSA-N	0	3	327.350	3.266	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc(C(=O)OCC)cc2)CC1	ZINC000264369313	455200256	/nfs/dbraw/zinc/20/02/56/455200256.db2.gz	IPIZYJLKHRFTCC-UHFFFAOYSA-N	0	3	345.443	3.025	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](C)c2cc(C)ccc2OC)CC1	ZINC000264377011	455200518	/nfs/dbraw/zinc/20/05/18/455200518.db2.gz	KEVHCMDNPWYLGP-MRXNPFEDSA-N	0	3	345.487	3.404	20	30		EGEDHN
N#CCOc1ccc(CN(CCO)[C@@H]2CCCc3ccccc32)cc1	ZINC000265220120	455302174	/nfs/dbraw/zinc/30/21/74/455302174.db2.gz	NGCWIMDSNZLYOL-OAQYLSRUSA-N	0	3	336.435	3.461	20	30		EGEDHN
C[C@@H](C#N)CNC1CCN(Cc2ccccc2Br)CC1	ZINC000183836376	455331536	/nfs/dbraw/zinc/33/15/36/455331536.db2.gz	MHFUIFXZMSMFOM-ZDUSSCGKSA-N	0	3	336.277	3.163	20	30		EGEDHN
CCN(CCC#N)C(=O)CNC1(c2cccc(Cl)c2)CCCC1	ZINC000181456361	455337125	/nfs/dbraw/zinc/33/71/25/455337125.db2.gz	CWGDYOWJXRPWHU-UHFFFAOYSA-N	0	3	333.863	3.461	20	30		EGEDHN
C[C@@H](NCC(=O)N(C)C1(C#N)CCCCC1)[C@@H](C)c1ccccc1	ZINC000181542798	455351742	/nfs/dbraw/zinc/35/17/42/455351742.db2.gz	SQMPFQDHTOWOHI-IAGOWNOFSA-N	0	3	327.472	3.453	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CC2(CCN(C)CC2)Oc2ccccc21	ZINC000184352742	455372763	/nfs/dbraw/zinc/37/27/63/455372763.db2.gz	KYHFXCMGBXHNJX-GOSISDBHSA-N	0	3	340.467	3.284	20	30		EGEDHN
COc1ccc(CN[C@H]2CCCC[C@H]2OC)cc1OCCCC#N	ZINC000266128483	455423690	/nfs/dbraw/zinc/42/36/90/455423690.db2.gz	CJDPZHKWPSLWPC-DLBZAZTESA-N	0	3	332.444	3.425	20	30		EGEDHN
Cc1ccc(CN(C)C)cc1NC(=O)[C@H](C)Oc1ccc(C#N)cc1	ZINC000267175809	455511163	/nfs/dbraw/zinc/51/11/63/455511163.db2.gz	WOTUTSFMIHKCJD-HNNXBMFYSA-N	0	3	337.423	3.334	20	30		EGEDHN
CC[C@@H](NCC(=O)N(CCC#N)CCC#N)c1cccc(Cl)c1	ZINC000182603849	455550614	/nfs/dbraw/zinc/55/06/14/455550614.db2.gz	JIZILZMUZCRDMJ-MRXNPFEDSA-N	0	3	332.835	3.037	20	30		EGEDHN
N#Cc1cccnc1NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000267908601	455563144	/nfs/dbraw/zinc/56/31/44/455563144.db2.gz	FBLDHGZDQXIBSN-UHFFFAOYSA-N	0	3	340.402	3.048	20	30		EGEDHN
COC(=O)COc1ccc([C@H](C)NCc2ccc(F)c(C#N)c2)cc1	ZINC000185645906	455589167	/nfs/dbraw/zinc/58/91/67/455589167.db2.gz	WFQGYJICEGOEBK-ZDUSSCGKSA-N	0	3	342.370	3.100	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H](CCC)c2ccc(F)cc2F)CC1	ZINC000268229741	455625010	/nfs/dbraw/zinc/62/50/10/455625010.db2.gz	DTHPXVRRNUULPG-SFHVURJKSA-N	0	3	334.410	3.267	20	30		EGEDHN
C=CCOc1ccc(CN2CCC[C@H](c3n[nH]c(C)n3)C2)cc1OC	ZINC000271405012	455625350	/nfs/dbraw/zinc/62/53/50/455625350.db2.gz	WMWIKGCSBDFGQB-INIZCTEOSA-N	0	3	342.443	3.066	20	30		EGEDHN
C=CCOc1ccc(CN2CCC[C@H](c3nc(C)n[nH]3)C2)cc1OC	ZINC000271405012	455625354	/nfs/dbraw/zinc/62/53/54/455625354.db2.gz	WMWIKGCSBDFGQB-INIZCTEOSA-N	0	3	342.443	3.066	20	30		EGEDHN
CCC[C@H](N[C@@H]1CCC[C@H](C#N)C1)C(=O)N1CCc2sccc2C1	ZINC000185810579	455626411	/nfs/dbraw/zinc/62/64/11/455626411.db2.gz	FKWLEUNNHXKCFP-UAGQMJEPSA-N	0	3	345.512	3.473	20	30		EGEDHN
CCC[C@H](N[C@H]1CCC[C@H](C#N)C1)C(=O)N1CCc2sccc2C1	ZINC000185810620	455626607	/nfs/dbraw/zinc/62/66/07/455626607.db2.gz	FKWLEUNNHXKCFP-XIRDDKMYSA-N	0	3	345.512	3.473	20	30		EGEDHN
N#CCC[C@H](NC(=O)NC[C@@H]1CCCCN1C1CC1)c1ccccc1	ZINC000277669305	455628950	/nfs/dbraw/zinc/62/89/50/455628950.db2.gz	ZUIJHPFMLXPZST-OALUTQOASA-N	0	3	340.471	3.348	20	30		EGEDHN
C=CCN(C(=O)NC1CCN(CCc2ccccc2)CC1)C1CC1	ZINC000271443053	455637861	/nfs/dbraw/zinc/63/78/61/455637861.db2.gz	MWADCOHURPVWLF-UHFFFAOYSA-N	0	3	327.472	3.054	20	30		EGEDHN
C#CC[C@@H](N[C@@H](C)c1ccc(NS(C)(=O)=O)cc1)c1ccccc1	ZINC000271445331	455639244	/nfs/dbraw/zinc/63/92/44/455639244.db2.gz	FQTWYGTXCJRBRI-HNAYVOBHSA-N	0	3	342.464	3.473	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)[C@@H]1CCCc2cccnc21)C(C)C	ZINC000192554764	455641755	/nfs/dbraw/zinc/64/17/55/455641755.db2.gz	FQPKLQZVFVRYFD-RTBURBONSA-N	0	3	341.499	3.316	20	30		EGEDHN
N#CCN(C[C@@H]1CN(Cc2ccccc2)CCCO1)C1CCCC1	ZINC000284286557	455662994	/nfs/dbraw/zinc/66/29/94/455662994.db2.gz	YHRGYBDXJBMAFD-FQEVSTJZSA-N	0	3	327.472	3.046	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCC(C(=O)N2CCC(C)CC2)CC1	ZINC000186170775	455708740	/nfs/dbraw/zinc/70/87/40/455708740.db2.gz	UPOALINTPANIOQ-UHFFFAOYSA-N	0	3	339.483	3.337	20	30		EGEDHN
Cc1ccc(S(=O)(=O)CCCN[C@H](C)c2ccc(C#N)cc2)cc1	ZINC000271642968	455710241	/nfs/dbraw/zinc/71/02/41/455710241.db2.gz	HHRPJBVJMNPHCH-MRXNPFEDSA-N	0	3	342.464	3.381	20	30		EGEDHN
N#C[C@@H]1CC[C@@H]([NH+]2CCC(C(=O)Nc3cc(Cl)ccc3[O-])CC2)C1	ZINC000292668544	455727340	/nfs/dbraw/zinc/72/73/40/455727340.db2.gz	AYIIBXIQSBVYFL-IUODEOHRSA-N	0	3	347.846	3.388	20	30		EGEDHN
C[C@H](NC[C@H]1CN(Cc2ccccc2)CCO1)c1ccc(C#N)cc1	ZINC000271703248	455728023	/nfs/dbraw/zinc/72/80/23/455728023.db2.gz	UJRKOKYPYPHCKE-UWJYYQICSA-N	0	3	335.451	3.110	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@@H](C)CN2CCCCCC2)cc1OC	ZINC000186317150	455740936	/nfs/dbraw/zinc/74/09/36/455740936.db2.gz	CTEKJGQBPGLPPH-INIZCTEOSA-N	0	3	346.471	3.254	20	30		EGEDHN
CC(C)C[C@@H]1OCCC[C@@H]1NCC(=O)N(CCC#N)c1ccccc1	ZINC000186358525	455751178	/nfs/dbraw/zinc/75/11/78/455751178.db2.gz	FFVMAYMJVLKLNM-OALUTQOASA-N	0	3	343.471	3.117	20	30		EGEDHN
[O-]c1ccc2ccccc2c1/C=N/C1CC[NH+]([C@@H]2CCC[C@@H]2O)CC1	ZINC000269035731	455770201	/nfs/dbraw/zinc/77/02/01/455770201.db2.gz	OJAOWAFMOMOJLR-MLKBUXGZSA-N	0	3	338.451	3.342	20	30		EGEDHN
N#CCOc1ccc(CN2CCC(CO)(c3ccccc3)CC2)cc1	ZINC000293441562	455787095	/nfs/dbraw/zinc/78/70/95/455787095.db2.gz	VEGKWVMVLWSBKH-UHFFFAOYSA-N	0	3	336.435	3.115	20	30		EGEDHN
N#CCCN(CCC#N)C(=O)CN1CCCCC[C@@H]1c1ccccc1	ZINC000193971639	455788950	/nfs/dbraw/zinc/78/89/50/455788950.db2.gz	LMTYDRRYXTYFFD-LJQANCHMSA-N	0	3	338.455	3.260	20	30		EGEDHN
COc1cc(C#N)ccc1OCCNC1(c2cccc(C#N)c2)CC1	ZINC000271862119	455791480	/nfs/dbraw/zinc/79/14/80/455791480.db2.gz	ZSESKZSLHOOJPH-UHFFFAOYSA-N	0	3	333.391	3.096	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1C(=O)NC[C@@H]1CCCN(Cc2cccs2)C1	ZINC000278263022	455801637	/nfs/dbraw/zinc/80/16/37/455801637.db2.gz	AADCHIGHVDEHGN-CGTJXYLNSA-N	0	3	348.512	3.058	20	30		EGEDHN
CSc1ccc([C@H](CNC(=O)c2ccc(C#N)cc2)N(C)C)cc1	ZINC000294401978	455814514	/nfs/dbraw/zinc/81/45/14/455814514.db2.gz	MLAWVQKMJLGRKH-SFHVURJKSA-N	0	3	339.464	3.313	20	30		EGEDHN
C[C@@H](CNC(=O)[C@@]1(C#N)CC12CCCC2)N(C)Cc1ccccc1	ZINC000294774332	455827123	/nfs/dbraw/zinc/82/71/23/455827123.db2.gz	ZHTZTVULZZVJKF-JXFKEZNVSA-N	0	3	325.456	3.097	20	30		EGEDHN
CC[C@@H](NCc1ccnc(OCCN(C)C)c1)c1ccc(C#N)cc1	ZINC000278886597	455851478	/nfs/dbraw/zinc/85/14/78/455851478.db2.gz	YHPJCVACYNEIHK-LJQANCHMSA-N	0	3	338.455	3.135	20	30		EGEDHN
C=CC[C@H](C(=O)N1CCN(C2CCOCC2)C[C@H]1C)c1ccccc1	ZINC000278898543	455852830	/nfs/dbraw/zinc/85/28/30/455852830.db2.gz	RIGYWYWRDPZPAS-XLIONFOSSA-N	0	3	342.483	3.058	20	30		EGEDHN
CCC[C@]1(NCC(=O)N(CCC#N)c2ccc(C)c(C)c2)CCOC1	ZINC000285484184	455855931	/nfs/dbraw/zinc/85/59/31/455855931.db2.gz	IFVXXCPXCOVLLP-FQEVSTJZSA-N	0	3	343.471	3.099	20	30		EGEDHN
CN(CCSc1ncc([N+](=O)[O-])cc1C#N)Cc1ccccc1	ZINC000279068016	455856788	/nfs/dbraw/zinc/85/67/88/455856788.db2.gz	LKTAGDNIQZPENY-UHFFFAOYSA-N	0	3	328.397	3.086	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)N[C@@H](C[C@H]1CCOC1)c1ccccc1	ZINC000279131122	455859088	/nfs/dbraw/zinc/85/90/88/455859088.db2.gz	WBRLYPIUSLIKHX-NSHGMRRFSA-N	0	3	342.483	3.333	20	30		EGEDHN
CC1(C)C[C@@H](O)CCN(CC#Cc2ccc(OC(F)(F)F)cc2)C1	ZINC000295931845	455863116	/nfs/dbraw/zinc/86/31/16/455863116.db2.gz	FZUGEYNGLSSSAI-HNNXBMFYSA-N	0	3	341.373	3.420	20	30		EGEDHN
C[C@H]1CSCCN(Cc2cn(CCC#N)nc2-c2ccncc2)C1	ZINC000279503072	455866669	/nfs/dbraw/zinc/86/66/69/455866669.db2.gz	ZLXPVOFSJGEFNP-OAHLLOKOSA-N	0	3	341.484	3.044	20	30		EGEDHN
Cc1oc(NC(=O)[C@H](C)N[C@H]2C[C@@H](OC(C)C)C2(C)C)c(C#N)c1C	ZINC000296047520	455867770	/nfs/dbraw/zinc/86/77/70/455867770.db2.gz	FNRGNTKENVESRF-VBNZEHGJSA-N	0	3	347.459	3.277	20	30		EGEDHN
Cc1ccccc1OCCN(C)C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000279585645	455868487	/nfs/dbraw/zinc/86/84/87/455868487.db2.gz	CVHKGIWVACHWQX-IBGZPJMESA-N	0	3	347.418	3.086	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NC1CCN(CCc2ccccc2)CC1)OCC	ZINC000270069714	455870767	/nfs/dbraw/zinc/87/07/67/455870767.db2.gz	XCDSAWJFRNQOKU-FQEVSTJZSA-N	0	3	344.499	3.181	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@@H](C)N1CCN([C@H](C)CC)CC1	ZINC000296254650	455891464	/nfs/dbraw/zinc/89/14/64/455891464.db2.gz	XNVASJIWNNAWGH-IAGOWNOFSA-N	0	3	349.544	3.067	20	30		EGEDHN
C=CCCOCCNCc1cc(OC)ccc1OCc1ccccn1	ZINC000270194815	455899580	/nfs/dbraw/zinc/89/95/80/455899580.db2.gz	LHZMSGPTCGFMNP-UHFFFAOYSA-N	0	3	342.439	3.352	20	30		EGEDHN
C=CCC[C@@H](NC[C@@H](O)COc1ccc2c(c1)OCO2)c1ccco1	ZINC000285904234	455938893	/nfs/dbraw/zinc/93/88/93/455938893.db2.gz	CVYJMSKIFQKUFA-GDBMZVCRSA-N	0	3	345.395	3.045	20	30		EGEDHN
C=CCC[C@H](NC[C@H](O)COc1ccc2c(c1)OCO2)c1ccco1	ZINC000285904237	455938956	/nfs/dbraw/zinc/93/89/56/455938956.db2.gz	CVYJMSKIFQKUFA-HOCLYGCPSA-N	0	3	345.395	3.045	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H](c2ccc(F)c(C)c2)C2CC2)CC1	ZINC000270419931	455951732	/nfs/dbraw/zinc/95/17/32/455951732.db2.gz	OJGBQWDYSMUUND-LJQANCHMSA-N	0	3	328.431	3.047	20	30		EGEDHN
CC(C)C[C@@H](CN1CCCC1)NC(=O)Nc1cccc(OCC#N)c1	ZINC000296591946	455983076	/nfs/dbraw/zinc/98/30/76/455983076.db2.gz	JBRPXAUPDLVFCG-KRWDZBQOSA-N	0	3	344.459	3.221	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](C)c2cc3ccccc3o2)CC1	ZINC000188155481	456011206	/nfs/dbraw/zinc/01/12/06/456011206.db2.gz	ZMGYGSWLNZVUHM-AWEZNQCLSA-N	0	3	327.428	3.443	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1CNCc1cc([N+](=O)[O-])ccc1OC(F)F	ZINC000280697949	456034304	/nfs/dbraw/zinc/03/43/04/456034304.db2.gz	SDFULNWJHUTAHO-ABAIWWIYSA-N	0	3	342.342	3.267	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN[C@@H](C)c1ccc([N+](=O)[O-])cc1	ZINC000296794432	456039889	/nfs/dbraw/zinc/03/98/89/456039889.db2.gz	SYYCVVLKYLCDLA-ZDUSSCGKSA-N	0	3	341.367	3.205	20	30		EGEDHN
C=CCN1CC[C@@H](N2CCC(c3c[nH]c4ccc(F)cc43)CC2)C1=O	ZINC000286949448	456058115	/nfs/dbraw/zinc/05/81/15/456058115.db2.gz	MNDSNDGNVHHWMX-LJQANCHMSA-N	0	3	341.430	3.273	20	30		EGEDHN
C=CCOc1ccc(CNCc2cc(C(=O)OCC)c(C)[nH]2)cc1	ZINC000296900948	456063550	/nfs/dbraw/zinc/06/35/50/456063550.db2.gz	QXEJUEICSPZONN-UHFFFAOYSA-N	0	3	328.412	3.354	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1CNCc1c(Cl)n(C)nc1C(F)(F)F	ZINC000280839836	456063721	/nfs/dbraw/zinc/06/37/21/456063721.db2.gz	YBWLKXJTOMRLPC-KOLCDFICSA-N	0	3	337.773	3.163	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1CN[C@@H](C)c1nnn(-c2ccc(F)cc2)c1C	ZINC000280928457	456085822	/nfs/dbraw/zinc/08/58/22/456085822.db2.gz	UWKNGJIVCLRUEC-RFUYNDQBSA-N	0	3	344.434	3.347	20	30		EGEDHN
Cn1cc(CN[C@H]2c3ccccc3CC[C@@H]2n2ccnc2)cc1C#N	ZINC000289242715	456119436	/nfs/dbraw/zinc/11/94/36/456119436.db2.gz	AALVGQFUGSQLNZ-PMACEKPBSA-N	0	3	331.423	3.112	20	30		EGEDHN
C=CCOc1ccc(CNCc2cc(OC)c(OC)cc2O)cc1	ZINC000289530943	456128544	/nfs/dbraw/zinc/12/85/44/456128544.db2.gz	PXPBOVBVJFTONE-UHFFFAOYSA-N	0	3	329.396	3.264	20	30		EGEDHN
C=CCOc1ccc(C[NH2+]Cc2cc(OC)c(OC)cc2[O-])cc1	ZINC000289530943	456128548	/nfs/dbraw/zinc/12/85/48/456128548.db2.gz	PXPBOVBVJFTONE-UHFFFAOYSA-N	0	3	329.396	3.264	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@]1(C)CCO[C@@H]1C1CC1	ZINC000273077419	456170268	/nfs/dbraw/zinc/17/02/68/456170268.db2.gz	PVRUTALQZWKRSC-RTBURBONSA-N	0	3	346.496	3.450	20	30		EGEDHN
CN(C)CCOc1cccc(-c2noc(-c3cccc(CC#N)c3)n2)c1	ZINC000273783474	456245383	/nfs/dbraw/zinc/24/53/83/456245383.db2.gz	FZCFTAMTEZGXFS-UHFFFAOYSA-N	0	3	348.406	3.410	20	30		EGEDHN
N#C[C@@H]1CCC[C@H](NCc2cccc(C(=O)NCc3ccco3)c2)C1	ZINC000274205014	456252119	/nfs/dbraw/zinc/25/21/19/456252119.db2.gz	MBHDZOVMMINWID-QAPCUYQASA-N	0	3	337.423	3.382	20	30		EGEDHN
CO[C@@H]1CCCC[C@@H]1NCC(=O)N(CCC#N)c1cc(C)cc(C)c1	ZINC000275241120	456272152	/nfs/dbraw/zinc/27/21/52/456272152.db2.gz	OMBKFTGHDQJSNH-RBUKOAKNSA-N	0	3	343.471	3.097	20	30		EGEDHN
CC[C@H](NCc1ccc(C#N)c(OC)c1)[C@H](O)c1c(F)cccc1F	ZINC000281674549	456289976	/nfs/dbraw/zinc/28/99/76/456289976.db2.gz	LWGWIMXLKJLZFZ-LPHOPBHVSA-N	0	3	346.377	3.447	20	30		EGEDHN
C[C@@H](CNc1nc2ccccn2c1C#N)N1CCc2ccccc2C1	ZINC000302110234	456290053	/nfs/dbraw/zinc/29/00/53/456290053.db2.gz	UAIOKTGJJMDJLF-HNNXBMFYSA-N	0	3	331.423	3.065	20	30		EGEDHN
CC(C)OC(=O)C[C@@H]1CCCN(CCCC2(C#N)CCOCC2)C1	ZINC000337214598	456338113	/nfs/dbraw/zinc/33/81/13/456338113.db2.gz	XQAHASJHGCCGQQ-KRWDZBQOSA-N	0	3	336.476	3.141	20	30		EGEDHN
C=CC[C@@H](CC)NC(=O)NCC1(N2CCSCC2)CCCC1	ZINC000347746953	456346730	/nfs/dbraw/zinc/34/67/30/456346730.db2.gz	PWPYPBQTIMDNSP-OAHLLOKOSA-N	0	3	325.522	3.002	20	30		EGEDHN
C[S@](=O)c1ccc(CNCCSCc2ccccc2C#N)cc1	ZINC000343035446	456365124	/nfs/dbraw/zinc/36/51/24/456365124.db2.gz	RZXGGYHLZVFJRB-QHCPKHFHSA-N	0	3	344.505	3.319	20	30		EGEDHN
C#C[C@H](NC(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@H](C)C1)C(C)C	ZINC000298134157	456370912	/nfs/dbraw/zinc/37/09/12/456370912.db2.gz	YZBFWCCFHBUGEA-HOJAQTOUSA-N	0	3	341.499	3.339	20	30		EGEDHN
C[C@@H]1CN(CC2CCN(Cc3cccc(C#N)c3F)CC2)C[C@H](C)O1	ZINC000352886258	456390300	/nfs/dbraw/zinc/39/03/00/456390300.db2.gz	GIAPMXPKSBKXMR-IYBDPMFKSA-N	0	3	345.462	3.019	20	30		EGEDHN
C=CCOCCCN(C)Cc1cc(Br)ccc1OC	ZINC000347975908	456433414	/nfs/dbraw/zinc/43/34/14/456433414.db2.gz	XBKPKZHQIMNOKC-UHFFFAOYSA-N	0	3	328.250	3.482	20	30		EGEDHN
COC(=O)[C@@H](C)Oc1ccc(CN[C@H](C)c2ccc(C#N)cc2)cc1	ZINC000343156054	456440202	/nfs/dbraw/zinc/44/02/02/456440202.db2.gz	XBIFUTZLGZWIPX-HUUCEWRRSA-N	0	3	338.407	3.349	20	30		EGEDHN
CN(CC(=O)N(C)C1(C#N)CCCCC1)[C@@H]1CCc2ccccc2C1	ZINC000303627284	456472091	/nfs/dbraw/zinc/47/20/91/456472091.db2.gz	XYBBTZALXVQFFO-LJQANCHMSA-N	0	3	339.483	3.161	20	30		EGEDHN
Cc1nc(C(=O)NCCN2CCC3(CCCCC3)CC2)ccc1C#N	ZINC000337738006	456515577	/nfs/dbraw/zinc/51/55/77/456515577.db2.gz	QOKXMVADECTXOU-UHFFFAOYSA-N	0	3	340.471	3.038	20	30		EGEDHN
COc1cc(CN[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)ccc1C#N	ZINC000353215014	456566080	/nfs/dbraw/zinc/56/60/80/456566080.db2.gz	VQNQFBOQYJBYKF-OXQOHEQNSA-N	0	3	335.451	3.319	20	30		EGEDHN
COCC[C@H](N[C@@H](C)C(=O)N(CCC#N)c1ccccc1)C(C)(C)C	ZINC000337857518	456572608	/nfs/dbraw/zinc/57/26/08/456572608.db2.gz	LZDWYQPYATYMEW-WMZOPIPTSA-N	0	3	345.487	3.363	20	30		EGEDHN
C=CCOc1cccc(CN[C@H]2CCO[C@H]2c2nccn2CC)c1	ZINC000343389616	456584034	/nfs/dbraw/zinc/58/40/34/456584034.db2.gz	LHLJCYPOIVCEDG-ZWKOTPCHSA-N	0	3	327.428	3.088	20	30		EGEDHN
N#CCCCOc1cccc(CN[C@@H]2CCO[C@H]2c2cccnc2)c1	ZINC000343392785	456586653	/nfs/dbraw/zinc/58/66/53/456586653.db2.gz	VQVMDXKGCYEJLG-UXHICEINSA-N	0	3	337.423	3.384	20	30		EGEDHN
CCN(CCC#N)C(=O)CN(Cc1ccc(OC)cc1)[C@H](C)C1CC1	ZINC000299045209	456592208	/nfs/dbraw/zinc/59/22/08/456592208.db2.gz	OGQIXOIKTZVQQE-MRXNPFEDSA-N	0	3	343.471	3.058	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@@H](NCCNC(=O)c1ccccc1Cl)CC2	ZINC000353262879	456595391	/nfs/dbraw/zinc/59/53/91/456595391.db2.gz	DRSQPBFAVPLLLM-SFHVURJKSA-N	0	3	339.826	3.219	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN[C@H]2CCCc3sccc32)cc1	ZINC000321185269	456636034	/nfs/dbraw/zinc/63/60/34/456636034.db2.gz	DANBVAUWHWIUCN-PBHICJAKSA-N	0	3	328.437	3.027	20	30		EGEDHN
COc1cccc2c1CC[C@@H]2NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000348344161	456636979	/nfs/dbraw/zinc/63/69/79/456636979.db2.gz	QHPIOBBBSZVVJB-LPHOPBHVSA-N	0	3	345.402	3.053	20	30		EGEDHN
CC(C)CN(CCS(=O)(=O)c1ccc(C#N)cc1)C1CCCC1	ZINC000321989358	456643069	/nfs/dbraw/zinc/64/30/69/456643069.db2.gz	VOCMKEVBSSKOIZ-UHFFFAOYSA-N	0	3	334.485	3.233	20	30		EGEDHN
Cc1cccc(CN(CCN(C)C)C(=O)c2ccc(F)c(C#N)c2)c1	ZINC000340768315	456674749	/nfs/dbraw/zinc/67/47/49/456674749.db2.gz	KSLCWQMBIAKMRC-UHFFFAOYSA-N	0	3	339.414	3.210	20	30		EGEDHN
CO[C@]1(C)C[C@@H](N[C@@H](C)C(=O)Nc2ccc(C#N)c(Cl)c2)C1(C)C	ZINC000340820532	456701732	/nfs/dbraw/zinc/70/17/32/456701732.db2.gz	LQKFBXKGRNNGPF-BKGUAONASA-N	0	3	349.862	3.332	20	30		EGEDHN
C[C@@H](NC(=O)N1CCN(C2CCC2)C[C@@H](C)C1)c1ccc(C#N)cc1	ZINC000291682677	456720191	/nfs/dbraw/zinc/72/01/91/456720191.db2.gz	RLGRAOAFSQHPQS-HZPDHXFCSA-N	0	3	340.471	3.135	20	30		EGEDHN
N#Cc1ccc(NC(=O)CN[C@@H]2CCC[C@H]2OCc2ccccc2)cc1	ZINC000348523262	456734602	/nfs/dbraw/zinc/73/46/02/456734602.db2.gz	CNRVCMXFIADBJT-WOJBJXKFSA-N	0	3	349.434	3.224	20	30		EGEDHN
Cc1nc(NC(=O)[C@H](C)N[C@@H]2[C@@H]3CCO[C@H]3C23CCC3)sc1C	ZINC000328676112	456735236	/nfs/dbraw/zinc/73/52/36/456735236.db2.gz	LEOFYWXIHXKRGW-SCUASFONSA-N	0	3	335.473	3.284	20	30		EGEDHN
CC[C@H](NCC(=O)Nc1c(C#N)cnn1-c1ccccc1)C(C)(C)C	ZINC000343611936	456742782	/nfs/dbraw/zinc/74/27/82/456742782.db2.gz	PNKDQDBKBFAXGT-INIZCTEOSA-N	0	3	339.443	3.097	20	30		EGEDHN
CC(C)c1nnc2ccc(NC(=O)N[C@H](C)CN3CCCCC3)cn21	ZINC000328761353	456754415	/nfs/dbraw/zinc/75/44/15/456754415.db2.gz	YFFVQLVZSPOWDV-CQSZACIVSA-N	0	3	344.463	3.053	20	30		EGEDHN
Cc1cccc(C)c1NC(=O)[C@H](C)N1CCC[C@@H]1[C@@H]1COCC[C@@H]1O	ZINC000328765568	456756282	/nfs/dbraw/zinc/75/62/82/456756282.db2.gz	FBJJBXVQUKRWAM-FJIDUMEYSA-N	0	3	346.471	3.142	20	30		EGEDHN
Cc1cccc(NC(=O)[C@H](C)N2CCC[C@@H]2[C@H]2COCC[C@@H]2O)c1C	ZINC000328829725	456769874	/nfs/dbraw/zinc/76/98/74/456769874.db2.gz	QXZKSEPNWHCEMY-ISARSNTHSA-N	0	3	346.471	3.142	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)CCCC#N	ZINC000291837401	456772385	/nfs/dbraw/zinc/77/23/85/456772385.db2.gz	FGVCOZIUDZSMRE-UHFFFAOYSA-N	0	3	341.377	3.289	20	30		EGEDHN
C=CCC(C)(C)c1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1	ZINC000291836494	456773289	/nfs/dbraw/zinc/77/32/89/456773289.db2.gz	FNFCHGYOCKSCJJ-UHFFFAOYSA-N	0	3	341.459	3.127	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1SCc1ccncc1	ZINC000340944738	456775354	/nfs/dbraw/zinc/77/53/54/456775354.db2.gz	ZPUYUEDBYNMQTP-UHFFFAOYSA-N	0	3	343.500	3.180	20	30		EGEDHN
CNC(=O)[C@@H]1CCC[C@@H]1N[C@H]1CCCN(c2ccccc2Cl)C1=O	ZINC000328929471	456794141	/nfs/dbraw/zinc/79/41/41/456794141.db2.gz	AFMTXNQJMJQBAW-SNPRPXQTSA-N	0	3	349.862	3.180	20	30		EGEDHN
Cc1noc2nc(C(C)C)cc(C(=O)N[C@H]3CCN(C4CC4)C3)c12	ZINC000329081883	456830474	/nfs/dbraw/zinc/83/04/74/456830474.db2.gz	RWSRXQLKKOGCIN-LBPRGKRZSA-N	0	3	328.416	3.196	20	30		EGEDHN
CC1CCC(N2CCN(c3ccc([N+](=O)[O-])cc3C#N)CC2)CC1	ZINC000301247365	456831755	/nfs/dbraw/zinc/83/17/55/456831755.db2.gz	BBCADRORBSHGFW-UHFFFAOYSA-N	0	3	328.416	3.167	20	30		EGEDHN
C[C@@](C#N)(NC(=O)CN1CCC[C@H]1[C@H]1CCCC[C@]1(C)O)C1CC1	ZINC000329131670	456840695	/nfs/dbraw/zinc/84/06/95/456840695.db2.gz	OXIWXFNLSCRHKE-NEPXVJNWSA-N	0	3	333.476	3.041	20	30		EGEDHN
C[C@H]1CN(C(=O)[C@@H](C#N)CCc2ccccc2)CCN(C2CCC2)C1	ZINC000344770955	456857351	/nfs/dbraw/zinc/85/73/51/456857351.db2.gz	JIBRQVZFBRKSEF-IEBWSBKVSA-N	0	3	339.483	3.092	20	30		EGEDHN
CC[C@@H](C(=O)N1CC=C(c2ccc(C#N)cc2)CC1)N(CC)CC	ZINC000348788758	456858225	/nfs/dbraw/zinc/85/82/25/456858225.db2.gz	YZIMTENFAHMGJA-IBGZPJMESA-N	0	3	325.456	3.294	20	30		EGEDHN
CCN1CCCC[C@@H]1CNC(=O)[C@@H]1CC(=O)N(c2ccccc2F)C1	ZINC000329395269	456884247	/nfs/dbraw/zinc/88/42/47/456884247.db2.gz	WZLZOHNCZPUUNO-HUUCEWRRSA-N	0	3	347.434	3.010	20	30		EGEDHN
C=CCOc1ccc(CNCc2cccc(C(=O)OC)c2)cc1OC	ZINC000348935415	456889038	/nfs/dbraw/zinc/88/90/38/456889038.db2.gz	PIGVTMFQBWRBKD-UHFFFAOYSA-N	0	3	341.407	3.336	20	30		EGEDHN
COc1ccc(C2(NCCOc3ccc(C#N)cc3OC)CC2)cc1	ZINC000341680529	456896857	/nfs/dbraw/zinc/89/68/57/456896857.db2.gz	DLBWPICWSXKNGV-UHFFFAOYSA-N	0	3	338.407	3.233	20	30		EGEDHN
Cc1cc(C)c(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)c(=O)[nH]1	ZINC000329618177	456916524	/nfs/dbraw/zinc/91/65/24/456916524.db2.gz	LWMOJTHFQUJTIL-RHSMWYFYSA-N	0	3	339.439	3.229	20	30		EGEDHN
CC[C@@H]1c2ccsc2CCN1C(=O)N[C@@H]1CCc2nc[nH]c2C1	ZINC000329749936	456935851	/nfs/dbraw/zinc/93/58/51/456935851.db2.gz	URJJVWDCRKTLCP-IAQYHMDHSA-N	0	3	330.457	3.252	20	30		EGEDHN
CC[C@@H]1c2ccsc2CCN1C(=O)N[C@@H]1CCc2[nH]cnc2C1	ZINC000329749936	456935853	/nfs/dbraw/zinc/93/58/53/456935853.db2.gz	URJJVWDCRKTLCP-IAQYHMDHSA-N	0	3	330.457	3.252	20	30		EGEDHN
Cc1cccc(C)c1[C@H](C)NC([O-])=[NH+]C[C@@H]1CCc2nccn2C1	ZINC000329873915	456954622	/nfs/dbraw/zinc/95/46/22/456954622.db2.gz	CMDDWRDPFCXTCZ-HOTGVXAUSA-N	0	3	326.444	3.327	20	30		EGEDHN
Cn1cc(-c2ncc(CN[C@@H](CCCC#N)c3ccccc3)cn2)cn1	ZINC000353902349	456958684	/nfs/dbraw/zinc/95/86/84/456958684.db2.gz	STFBAQYJWDKWKH-IBGZPJMESA-N	0	3	346.438	3.402	20	30		EGEDHN
C[C@H](N[C@@H]1CCC[C@@]1(C)CO)C(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000329957836	456966204	/nfs/dbraw/zinc/96/62/04/456966204.db2.gz	QINIMQWBXUDUES-RYGJSOEZSA-N	0	3	334.504	3.441	20	30		EGEDHN
CC(C)(C#N)CCN1CCC[C@@H](C(=O)Nc2ccc(Cl)cn2)C1	ZINC000345716513	456989134	/nfs/dbraw/zinc/98/91/34/456989134.db2.gz	SUOPOISNAKDTOF-CYBMUJFWSA-N	0	3	334.851	3.325	20	30		EGEDHN
CC(C#N)C(=O)NCc1ccccc1-c1ccc(Cn2ccnc2)cc1	ZINC000345802416	456996599	/nfs/dbraw/zinc/99/65/99/456996599.db2.gz	NGJKGIOQCQZHKJ-INIZCTEOSA-N	0	3	344.418	3.374	20	30		EGEDHN
C=CCC[C@@H](NCC(=O)NCc1ccc(C#N)cc1)c1ccccc1	ZINC000341934204	457011169	/nfs/dbraw/zinc/01/11/69/457011169.db2.gz	WMQKWCAZCBMNEA-HXUWFJFHSA-N	0	3	333.435	3.472	20	30		EGEDHN
Cc1nn(C)c(C)c1[C@H]1OCC[C@@H]1NC(=O)[C@@H](C)N1CCCCCC1	ZINC000330285112	457022074	/nfs/dbraw/zinc/02/20/74/457022074.db2.gz	YJPGTAGXIIEZAV-RYRKJORJSA-N	0	3	348.491	3.088	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1c1nc(-c2ccccc2OCCN(C)C)no1	ZINC000346396992	457040703	/nfs/dbraw/zinc/04/07/03/457040703.db2.gz	UTLQMRFDQQGHDA-WBVHZDCISA-N	0	3	343.427	3.126	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N(CCN(C)C)Cc1cccc(C)c1)OCC	ZINC000339353313	457063458	/nfs/dbraw/zinc/06/34/58/457063458.db2.gz	VXKYMGJLSNLMOQ-LJQANCHMSA-N	0	3	332.488	3.257	20	30		EGEDHN
COc1c(CNC2CCC(C#N)(c3ccccc3)CC2)c(C)nn1C	ZINC000359427904	457082756	/nfs/dbraw/zinc/08/27/56/457082756.db2.gz	RJRCMVIXVOLXGZ-UHFFFAOYSA-N	0	3	338.455	3.231	20	30		EGEDHN
N#CCSCCCN1CCC([C@@H]2C(=O)Nc3ccccc32)CC1	ZINC000362898618	457146329	/nfs/dbraw/zinc/14/63/29/457146329.db2.gz	KLJGZICAKAMVMU-KRWDZBQOSA-N	0	3	329.469	3.081	20	30		EGEDHN
CC(C#N)C(=O)N1CCSC[C@@H]1c1cccc(C(F)(F)F)c1	ZINC000354248455	457153613	/nfs/dbraw/zinc/15/36/13/457153613.db2.gz	TVEPLRKZDYACKT-ZWNOBZJWSA-N	0	3	328.359	3.482	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N2CCC(C)(C#N)CC2)C1	ZINC000331501391	457195322	/nfs/dbraw/zinc/19/53/22/457195322.db2.gz	BMZXDUWHOAFWJR-AEFFLSMTSA-N	0	3	340.471	3.157	20	30		EGEDHN
C[C@H](c1ccccc1)N(CC(=O)NC1(C#N)CCC1)CC1CCC1	ZINC000347058779	457208925	/nfs/dbraw/zinc/20/89/25/457208925.db2.gz	QZBLREKXXISRIC-MRXNPFEDSA-N	0	3	325.456	3.412	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1)OCC	ZINC000354733617	457318243	/nfs/dbraw/zinc/31/82/43/457318243.db2.gz	DEFADNKEAALKBV-VQTJNVASSA-N	0	3	344.499	3.481	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCC(C)(C)CCC#N)C1	ZINC000351825773	457318885	/nfs/dbraw/zinc/31/88/85/457318885.db2.gz	ALTMVHDCOANFMG-WMZOPIPTSA-N	0	3	342.487	3.451	20	30		EGEDHN
CNC(=O)c1cccc(CN[C@H]2CCCCc3cc(C#N)ccc32)c1	ZINC000360645345	457322352	/nfs/dbraw/zinc/32/23/52/457322352.db2.gz	DKYYZZZUVISBPA-FQEVSTJZSA-N	0	3	333.435	3.475	20	30		EGEDHN
C=CCCCCCN(C)[C@H](C)C(=O)Nc1ccc2c(c1)OCCO2	ZINC000351897661	457323120	/nfs/dbraw/zinc/32/31/20/457323120.db2.gz	MPRBHZOKUDXUDT-OAHLLOKOSA-N	0	3	332.444	3.463	20	30		EGEDHN
CC[C@H](CNC(=O)c1ccc(CC#N)cc1)N1CCc2ccccc2C1	ZINC000340072382	457326923	/nfs/dbraw/zinc/32/69/23/457326923.db2.gz	HXKXHPTZUGIXNR-OAQYLSRUSA-N	0	3	347.462	3.319	20	30		EGEDHN
CCN(Cc1ccc(OC)c(C#N)c1)C[C@@H]1COc2ccccc2O1	ZINC000340124033	457337935	/nfs/dbraw/zinc/33/79/35/457337935.db2.gz	BVUUXQJZAXUBMK-QGZVFWFLSA-N	0	3	338.407	3.229	20	30		EGEDHN
C[C@H](CNC(=O)C[C@@H](CC#N)c1ccccc1)N1CCC(C)CC1	ZINC000355272328	457352441	/nfs/dbraw/zinc/35/24/41/457352441.db2.gz	HGWCLWJJVOALDP-IEBWSBKVSA-N	0	3	327.472	3.311	20	30		EGEDHN
N#C[C@@H](c1cccc(Cl)c1)N1CCN(C[C@@H]2CCSC2)CC1	ZINC000355291901	457355094	/nfs/dbraw/zinc/35/50/94/457355094.db2.gz	OGFMXMZCNAKGTE-YOEHRIQHSA-N	0	3	335.904	3.275	20	30		EGEDHN
CC(C#N)C(=O)N[C@@H](c1ccc(OC(F)(F)F)cc1)C(F)(F)F	ZINC000360800016	457360385	/nfs/dbraw/zinc/36/03/85/457360385.db2.gz	VDFZVXLMZNWAFP-XCBNKYQSSA-N	0	3	340.223	3.464	20	30		EGEDHN
C=C[C@@H](CO)NCc1cn(-c2ccccc2)nc1-c1ccccc1C	ZINC000352453280	457379283	/nfs/dbraw/zinc/37/92/83/457379283.db2.gz	LNCGCNWDJCVIRA-SFHVURJKSA-N	0	3	333.435	3.484	20	30		EGEDHN
COc1ccc(C#N)cc1CN1CC[C@H](C(=O)N(C)c2ccccc2)C1	ZINC000374045667	457454924	/nfs/dbraw/zinc/45/49/24/457454924.db2.gz	NYQWYCCQUYPJFW-KRWDZBQOSA-N	0	3	349.434	3.052	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000363859818	457456037	/nfs/dbraw/zinc/45/60/37/457456037.db2.gz	WLDATYKVMOANFP-CTNGQTDRSA-N	0	3	344.499	3.244	20	30		EGEDHN
C[C@H](CCC1CC1)NC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000347500478	457470036	/nfs/dbraw/zinc/47/00/36/457470036.db2.gz	UATJRTYMJIHJQF-MRXNPFEDSA-N	0	3	342.487	3.210	20	30		EGEDHN
C=CCSCCNC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000357372654	457479196	/nfs/dbraw/zinc/47/91/96/457479196.db2.gz	KOSUDTGPFABREQ-FUHWJXTLSA-N	0	3	347.528	3.115	20	30		EGEDHN
C[C@H](CNC(=O)N(C)[C@H](C)c1cccc(C#N)c1)N1CCC[C@@H](C)C1	ZINC000425450306	457559926	/nfs/dbraw/zinc/55/99/26/457559926.db2.gz	XZLOQUAVSZAKGC-BRWVUGGUSA-N	0	3	342.487	3.381	20	30		EGEDHN
CC(C)[C@H]1CN(C)CCN1CC#Cc1ccc(OC(F)(F)F)cc1	ZINC000425484129	457573482	/nfs/dbraw/zinc/57/34/82/457573482.db2.gz	SDCYFWPRFRMHCO-QGZVFWFLSA-N	0	3	340.389	3.209	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)N[C@@H]2CC[C@H](C#N)C2)CCN1Cc1ccccc1	ZINC000425497016	457577436	/nfs/dbraw/zinc/57/74/36/457577436.db2.gz	WEZXTLIVBQHFMQ-QXCFHYIPSA-N	0	3	340.471	3.031	20	30		EGEDHN
CCOc1ncc(C(=O)C(C#N)c2cc(C)nc(C)n2)cc1Cl	ZINC000352751899	457582015	/nfs/dbraw/zinc/58/20/15/457582015.db2.gz	HZGXIZIQEIIAQM-GFCCVEGCSA-N	0	3	330.775	3.031	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN[C@@H](C)c1cncc(F)c1	ZINC000361132626	457601756	/nfs/dbraw/zinc/60/17/56/457601756.db2.gz	QXIWXDJXQPFFTI-KBXCAEBGSA-N	0	3	330.403	3.040	20	30		EGEDHN
N#CCCn1cc(CN2CCC3(CCO3)CC2)c(-c2ccccc2)n1	ZINC000374370490	457602254	/nfs/dbraw/zinc/60/22/54/457602254.db2.gz	DMWDJTWJIKDAIQ-UHFFFAOYSA-N	0	3	336.439	3.219	20	30		EGEDHN
C=CCN1CC[C@@H](N2CCCCC[C@H]2c2ccc(OC)cc2)C1=O	ZINC000410309679	457637256	/nfs/dbraw/zinc/63/72/56/457637256.db2.gz	ATIXTHPQNDFKDK-RBUKOAKNSA-N	0	3	328.456	3.399	20	30		EGEDHN
Cc1noc(C2(C)CCN(Cc3ccc(O[C@H](C)C#N)cc3)CC2)n1	ZINC000374744640	457699964	/nfs/dbraw/zinc/69/99/64/457699964.db2.gz	SKBSXGJOCTYMPT-CQSZACIVSA-N	0	3	340.427	3.223	20	30		EGEDHN
CC(C#N)C(=O)N[C@@H](Cn1cnc2ccccc21)c1ccc(F)cc1	ZINC000357830208	457703404	/nfs/dbraw/zinc/70/34/04/457703404.db2.gz	PLPUKYOQCJHAKY-DYVFJYSZSA-N	0	3	336.370	3.193	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Nc1cnn(C(F)F)c1)C(C)C	ZINC000357834040	457705502	/nfs/dbraw/zinc/70/55/02/457705502.db2.gz	YGAIPOQCTJKQEZ-CQSZACIVSA-N	0	3	341.406	3.098	20	30		EGEDHN
CN(CCOc1ccccc1F)C(=O)C(C#N)CCc1ccccc1	ZINC000433232361	457786071	/nfs/dbraw/zinc/78/60/71/457786071.db2.gz	LXKFKTJHZYUXNA-KRWDZBQOSA-N	0	3	340.398	3.435	20	30		EGEDHN
CC[C@H](CNC(=O)NCC(C)(C)CC#N)N1CCc2ccccc2C1	ZINC000457703761	457800191	/nfs/dbraw/zinc/80/01/91/457800191.db2.gz	XLZRHLLEYXOQEX-GOSISDBHSA-N	0	3	342.487	3.062	20	30		EGEDHN
CN(C)Cc1ccccc1CNC(=O)[C@@H](C#N)CCc1ccccc1	ZINC000433340663	457814970	/nfs/dbraw/zinc/81/49/70/457814970.db2.gz	FPVFAASJNOARQG-GOSISDBHSA-N	0	3	335.451	3.137	20	30		EGEDHN
CC(=O)Nc1ccc(CCNC(=O)C(C#N)CCc2ccccc2)cc1	ZINC000433350823	457818760	/nfs/dbraw/zinc/81/87/60/457818760.db2.gz	GFEUJCPJLPIXJC-LJQANCHMSA-N	0	3	349.434	3.076	20	30		EGEDHN
CCN1CCC[C@@H]1CNC(=O)c1cn(CCCC#N)c2ccccc12	ZINC000443915520	457823707	/nfs/dbraw/zinc/82/37/07/457823707.db2.gz	JNAYGHGZWGAASY-MRXNPFEDSA-N	0	3	338.455	3.159	20	30		EGEDHN
Cc1cc(C)cc(N(CCC#N)C(=O)CN2CC[C@H]3CCC[C@@H]32)c1	ZINC000426479266	457837956	/nfs/dbraw/zinc/83/79/56/457837956.db2.gz	IJZOGLCKZODSFT-MJGOQNOKSA-N	0	3	325.456	3.425	20	30		EGEDHN
C[C@@H](CCC#N)N(C)C[C@H](O)COc1ccc(C(F)(F)F)cc1	ZINC000411265735	457844191	/nfs/dbraw/zinc/84/41/91/457844191.db2.gz	PBLFNMTVYXWIPW-JSGCOSHPSA-N	0	3	330.350	3.069	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)Cc2cc(C)ccc2F)CC1	ZINC000444190664	457865717	/nfs/dbraw/zinc/86/57/17/457865717.db2.gz	IGSHFXVZOCSRIA-UHFFFAOYSA-N	0	3	333.451	3.316	20	30		EGEDHN
CNS(=O)(=O)c1ccc([C@H](C)NCCC2(C#N)CCCCC2)cc1	ZINC000411455954	457893388	/nfs/dbraw/zinc/89/33/88/457893388.db2.gz	MAMWVZDIAOSHQQ-HNNXBMFYSA-N	0	3	349.500	3.109	20	30		EGEDHN
CC[C@H](NCCC1(C#N)CCCCC1)c1cccc(S(N)(=O)=O)c1	ZINC000411457037	457893545	/nfs/dbraw/zinc/89/35/45/457893545.db2.gz	CXONAERQNWUMNU-KRWDZBQOSA-N	0	3	349.500	3.239	20	30		EGEDHN
CC(CCN1CCC(F)(C#N)CC1)CCN1CCC(F)(C#N)CC1	ZINC000411722543	457961872	/nfs/dbraw/zinc/96/18/72/457961872.db2.gz	QWBFWCZNZYYHHM-UHFFFAOYSA-N	0	3	338.446	3.058	20	30		EGEDHN
C=CCCCCCCNC(=O)N1CCN(C2CCOCC2)C[C@H]1C	ZINC000367897701	457994550	/nfs/dbraw/zinc/99/45/50/457994550.db2.gz	VNKZXHAJJWUXFN-QGZVFWFLSA-N	0	3	337.508	3.018	20	30		EGEDHN
C#Cc1ccc(CN2CCC(NC(=O)c3ccc(C)s3)CC2)cc1	ZINC000368031420	458005016	/nfs/dbraw/zinc/00/50/16/458005016.db2.gz	SWGZBNVSDGSOMM-UHFFFAOYSA-N	0	3	338.476	3.432	20	30		EGEDHN
CCN(CCC#N)C(=O)CN[C@@H]1CCCC[C@@H]1Oc1ccccc1C	ZINC000362017207	458006319	/nfs/dbraw/zinc/00/63/19/458006319.db2.gz	BSDDVZLIOUWGAQ-MJGOQNOKSA-N	0	3	343.471	3.037	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@](C)(Cc2ccccc2)C2CC2)CC1	ZINC000458337552	458017733	/nfs/dbraw/zinc/01/77/33/458017733.db2.gz	QWEOVPSPMNIQBX-OAQYLSRUSA-N	0	3	341.499	3.347	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CNC1(C2CC2)CCOCC1	ZINC000375700518	458027344	/nfs/dbraw/zinc/02/73/44/458027344.db2.gz	GLQKERYGZAZXIZ-UHFFFAOYSA-N	0	3	346.496	3.452	20	30		EGEDHN
CCN(CCC#N)C(=O)CN(C)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000412007431	458043418	/nfs/dbraw/zinc/04/34/18/458043418.db2.gz	JDFSLMCJQVKZKV-RTBURBONSA-N	0	3	327.472	3.407	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@@H](C)C1(OC)CCC1	ZINC000412017290	458046529	/nfs/dbraw/zinc/04/65/29/458046529.db2.gz	CVXGYIBOSCNBKR-AWEZNQCLSA-N	0	3	334.485	3.450	20	30		EGEDHN
C=CCN(C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1)C1CC1	ZINC000362306606	458095651	/nfs/dbraw/zinc/09/56/51/458095651.db2.gz	YXVKDXOPOORJCN-SFHVURJKSA-N	0	3	327.472	3.259	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1CNCc1c(C)nn(CC(C)C)c1OCC	ZINC000435751265	458196419	/nfs/dbraw/zinc/19/64/19/458196419.db2.gz	QNKRLDOOSQDJQI-FUHWJXTLSA-N	0	3	335.492	3.317	20	30		EGEDHN
CSc1ccc([C@@H](CNC(=O)NCC(C)(C)CC#N)N(C)C)cc1	ZINC000458879005	458202552	/nfs/dbraw/zinc/20/25/52/458202552.db2.gz	BZZNSCAYWNNZAO-MRXNPFEDSA-N	0	3	348.516	3.250	20	30		EGEDHN
C=CCN(CC=C)C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C	ZINC000458907514	458210704	/nfs/dbraw/zinc/21/07/04/458210704.db2.gz	XBBCWXPBTADAGQ-QGZVFWFLSA-N	0	3	333.501	3.395	20	30		EGEDHN
CC(=O)N1CC[C@@H](NCc2ccc(OCC#N)cc2)c2ccccc2C1	ZINC000376176478	458223738	/nfs/dbraw/zinc/22/37/38/458223738.db2.gz	BJEUMLFLHIHRPH-OAQYLSRUSA-N	0	3	349.434	3.172	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCc2cc3ccccc3s2)CC1	ZINC000358806505	458229598	/nfs/dbraw/zinc/22/95/98/458229598.db2.gz	CDPJGMSEUYSNBG-UHFFFAOYSA-N	0	3	329.469	3.351	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000369489952	458234836	/nfs/dbraw/zinc/23/48/36/458234836.db2.gz	LLPFQMFGAMEKCL-UHFFFAOYSA-N	0	3	326.362	3.428	20	30		EGEDHN
C=C(C)CCNC(=O)N(Cc1ccncc1)C[C@H]1CCCN1CC	ZINC000459014339	458243508	/nfs/dbraw/zinc/24/35/08/458243508.db2.gz	ZTIUFRVRWVETDK-GOSISDBHSA-N	0	3	330.476	3.044	20	30		EGEDHN
C=CCN(CCC(=O)Nc1ccc(C)cn1)Cc1ccc(OC)cc1	ZINC000446990226	458255690	/nfs/dbraw/zinc/25/56/90/458255690.db2.gz	JDEFLUKPKXOOKF-UHFFFAOYSA-N	0	3	339.439	3.415	20	30		EGEDHN
C=C(CC)CNC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1	ZINC000459073639	458260407	/nfs/dbraw/zinc/26/04/07/458260407.db2.gz	JVEIICXJAQSJOM-UHFFFAOYSA-N	0	3	325.403	3.004	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1CN[C@@H](c1cnn(C)c1)c1cccc(F)c1	ZINC000436310579	458287728	/nfs/dbraw/zinc/28/77/28/458287728.db2.gz	QLNGWMXJMGJUFY-IPELMVKDSA-N	0	3	329.419	3.219	20	30		EGEDHN
C=CCC[C@@H](O)CN1CCN(c2cccc3cnccc32)C[C@H]1C	ZINC000447380752	458289898	/nfs/dbraw/zinc/28/98/98/458289898.db2.gz	FXCKHPLZUPEDQB-SJLPKXTDSA-N	0	3	325.456	3.072	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NC(=O)N1CC[C@H]2CC[C@@H](C1)N2C	ZINC000413836221	458309683	/nfs/dbraw/zinc/30/96/83/458309683.db2.gz	PASGEUILNXNZQY-QRVBRYPASA-N	0	3	327.472	3.052	20	30		EGEDHN
C=CCSCCNC(=O)N[C@H](CN)c1ccc2ccccc2c1	ZINC000417342828	458362340	/nfs/dbraw/zinc/36/23/40/458362340.db2.gz	NIDXYKNZAASXRU-QGZVFWFLSA-N	0	3	329.469	3.058	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)NCC1(C#N)CCC1)c1ccccc1	ZINC000419407976	458381845	/nfs/dbraw/zinc/38/18/45/458381845.db2.gz	XETLPYCJZXHDIJ-KRWDZBQOSA-N	0	3	328.460	3.063	20	30		EGEDHN
C=CCC[C@@H]1NC(=O)N(C[C@H](c2ccsc2)N(CC)CC)C1=O	ZINC000419930082	458393724	/nfs/dbraw/zinc/39/37/24/458393724.db2.gz	XLHXXRNHDNISAS-LSDHHAIUSA-N	0	3	335.473	3.018	20	30		EGEDHN
C=CCC[C@@H]1NC(=O)N(C2CCN([C@@H](C)c3ccccc3)CC2)C1=O	ZINC000420006298	458395099	/nfs/dbraw/zinc/39/50/99/458395099.db2.gz	XVNFEYNTGAXNNE-YJBOKZPZSA-N	0	3	341.455	3.099	20	30		EGEDHN
CN(CCCNC(=O)[C@]1(C#N)CC12CCCC2)Cc1ccccc1	ZINC000448605620	458401827	/nfs/dbraw/zinc/40/18/27/458401827.db2.gz	QYEHSSWBZRWLMX-HXUWFJFHSA-N	0	3	325.456	3.099	20	30		EGEDHN
C=CCc1cc(CN2CCOC[C@H](C3CCC3)C2)cc(OC)c1O	ZINC000430127345	458406863	/nfs/dbraw/zinc/40/68/63/458406863.db2.gz	WNSTWHXNUMCNAN-GOSISDBHSA-N	0	3	331.456	3.378	20	30		EGEDHN
CCN1CCN(c2ccccc2CNCc2ccc(C#N)s2)CC1	ZINC000421354982	458412140	/nfs/dbraw/zinc/41/21/40/458412140.db2.gz	SRQRGQGFPXIYLB-UHFFFAOYSA-N	0	3	340.496	3.051	20	30		EGEDHN
CN(CCC#N)C(=O)CCN1CC2(CCCC2)[C@H]1c1ccccc1	ZINC000459574144	458414986	/nfs/dbraw/zinc/41/49/86/458414986.db2.gz	JHKFSOWSLLBFCU-LJQANCHMSA-N	0	3	325.456	3.366	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)NCC(C)(C)CCC#N)CN1Cc1ccccc1	ZINC000376916681	458421093	/nfs/dbraw/zinc/42/10/93/458421093.db2.gz	IMQPQZWFQPXIMV-SJLPKXTDSA-N	0	3	342.487	3.279	20	30		EGEDHN
C=CCNC(=O)Nc1ccc(NC(=O)[C@@H](N)CC2CCCCC2)cc1	ZINC000422957731	458429656	/nfs/dbraw/zinc/42/96/56/458429656.db2.gz	VGUIOHPFQPENAD-KRWDZBQOSA-N	0	3	344.459	3.230	20	30		EGEDHN
C[C@@H]1C[C@@]1(C#N)C(=O)N1CC[C@@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000450024714	458437058	/nfs/dbraw/zinc/43/70/58/458437058.db2.gz	QNFIUICEBUBJDQ-QMMLZNLJSA-N	0	3	337.467	3.051	20	30		EGEDHN
CC(C)O[C@H]1C[C@@H](NCC(=O)N(CCC#N)c2ccccc2)C1(C)C	ZINC000451492993	458478916	/nfs/dbraw/zinc/47/89/16/458478916.db2.gz	IVKLXYBHOFTOQR-MSOLQXFVSA-N	0	3	343.471	3.115	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1C[C@H](C)C[C@H]1c1cccnc1	ZINC000373411846	458485992	/nfs/dbraw/zinc/48/59/92/458485992.db2.gz	HPRZGUQWMJWZQC-QAPCUYQASA-N	0	3	337.423	3.424	20	30		EGEDHN
C=CCC1(NS(=O)(=O)c2ccc(CN(C)C)cc2)CCCCC1	ZINC000451943541	458491530	/nfs/dbraw/zinc/49/15/30/458491530.db2.gz	WIEDKXMDUAUQMA-UHFFFAOYSA-N	0	3	336.501	3.306	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NC[C@H]2CSc3ccccc32)cc1	ZINC000452214729	458497085	/nfs/dbraw/zinc/49/70/85/458497085.db2.gz	OGIHSXCGEBCCJT-SJORKVTESA-N	0	3	347.443	3.246	20	30		EGEDHN
CC(C)C[C@@H](CN1CCCC1)NC(=O)CSc1ccc(C#N)cc1	ZINC000452346057	458500160	/nfs/dbraw/zinc/50/01/60/458500160.db2.gz	UJCWYBOKPOWURP-KRWDZBQOSA-N	0	3	345.512	3.277	20	30		EGEDHN
CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)NCC1(CC#N)CC1	ZINC000430904264	458503064	/nfs/dbraw/zinc/50/30/64/458503064.db2.gz	PZKDWPNCMVRHJB-SFHVURJKSA-N	0	3	342.487	3.136	20	30		EGEDHN
C=C(C)Cn1c(CC(C)C)nnc1N1CCN([C@@H]2C[C@@H]2C)C[C@@H](C)C1	ZINC000453452107	458532041	/nfs/dbraw/zinc/53/20/41/458532041.db2.gz	LONQDNNPSPOYIC-FGTMMUONSA-N	0	3	345.535	3.219	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CCCCO2)nnc1N1CCN([C@H](C)CC)CC1	ZINC000453464879	458533549	/nfs/dbraw/zinc/53/35/49/458533549.db2.gz	MEPLQYHDXBGCDJ-IAGOWNOFSA-N	0	3	347.507	3.016	20	30		EGEDHN
CCOc1cccc2cc([C@@H](C)NC(=O)[C@H](N)CCCC#N)oc21	ZINC000424063843	458548880	/nfs/dbraw/zinc/54/88/80/458548880.db2.gz	JGAMQANIZOXDPG-TZMCWYRMSA-N	0	3	329.400	3.030	20	30		EGEDHN
CCc1ccc(-c2csc(NC(=O)[C@H](N)CCCC#N)n2)s1	ZINC000424066444	458549093	/nfs/dbraw/zinc/54/90/93/458549093.db2.gz	NHYKCAUZXKNUOJ-LLVKDONJSA-N	0	3	334.470	3.394	20	30		EGEDHN
COc1ccc(C)cc1-c1csc(NC(=O)[C@H](N)CCCC#N)n1	ZINC000424064428	458549695	/nfs/dbraw/zinc/54/96/95/458549695.db2.gz	KCVBKRIBZOGAML-CYBMUJFWSA-N	0	3	344.440	3.087	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1ncc(Cc2ccccc2Cl)s1	ZINC000424068937	458550566	/nfs/dbraw/zinc/55/05/66/458550566.db2.gz	OJEPSFCBYKNNAY-AWEZNQCLSA-N	0	3	348.859	3.347	20	30		EGEDHN
Cc1nc(-c2ccc([C@H](C)NC(=O)[C@@H](N)CCCC#N)cc2)cs1	ZINC000424088068	458556222	/nfs/dbraw/zinc/55/62/22/458556222.db2.gz	IVQQRWYCTOUKDA-LRDDRELGSA-N	0	3	342.468	3.317	20	30		EGEDHN
C=CC(C)(C)CNC(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000454316272	458558151	/nfs/dbraw/zinc/55/81/51/458558151.db2.gz	OJJAYFXMOUFMRT-UHFFFAOYSA-N	0	3	329.488	3.471	20	30		EGEDHN
CC(C)(NC(=O)[C@H](N)CCCC#N)c1ccc(Cl)c(Cl)c1	ZINC000424115568	458562052	/nfs/dbraw/zinc/56/20/52/458562052.db2.gz	VONGOKYUVLKWSF-CYBMUJFWSA-N	0	3	328.243	3.366	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)NCCCc1ccc(Cl)cc1Cl	ZINC000424124688	458563996	/nfs/dbraw/zinc/56/39/96/458563996.db2.gz	PILCKPUGZQCSED-CQSZACIVSA-N	0	3	328.243	3.063	20	30		EGEDHN
COc1ccc(CN[C@@H]2CC[C@H](C#N)C2)cc1OCc1cccnc1	ZINC000424193988	458581967	/nfs/dbraw/zinc/58/19/67/458581967.db2.gz	LCJKOTLLYSTVAB-MAUKXSAKSA-N	0	3	337.423	3.451	20	30		EGEDHN
C[C@H](C(=O)N1CCCN(C2CCCC2)CC1)c1cccc(C#N)c1	ZINC000462133637	458597709	/nfs/dbraw/zinc/59/77/09/458597709.db2.gz	ZJLARTUMJZOXIC-INIZCTEOSA-N	0	3	325.456	3.139	20	30		EGEDHN
C[C@@H]1C[C@@H](CNC(=O)OC(C)(C)C)CN1Cc1ccc(C#N)cc1	ZINC000493915071	458599154	/nfs/dbraw/zinc/59/91/54/458599154.db2.gz	RKLQVSWZYWXADD-PBHICJAKSA-N	0	3	329.444	3.293	20	30		EGEDHN
C[C@H](C(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1)c1cccc(C#N)c1	ZINC000462198150	458602927	/nfs/dbraw/zinc/60/29/27/458602927.db2.gz	HQIRFTISPOQJSM-XGHQBKJUSA-N	0	3	347.462	3.441	20	30		EGEDHN
CN1CCC[C@]2(CCN(C(=O)Nc3ccc(CC#N)cc3Cl)C2)C1	ZINC000455730251	458609659	/nfs/dbraw/zinc/60/96/59/458609659.db2.gz	KPIRIMYRECXMCT-SFHVURJKSA-N	0	3	346.862	3.356	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCN(Cc2ccccc2)C[C@H](C)C1	ZINC000456351421	458641713	/nfs/dbraw/zinc/64/17/13/458641713.db2.gz	WXGIQICGUKQZSX-SFHVURJKSA-N	0	3	337.467	3.268	20	30		EGEDHN
CC(C)[C@@H](NCC(=O)NCc1cccc(C#N)c1)c1ccc(F)cc1	ZINC000502560630	458657102	/nfs/dbraw/zinc/65/71/02/458657102.db2.gz	RZDCWAQIROGDAY-HXUWFJFHSA-N	0	3	339.414	3.300	20	30		EGEDHN
CCCN(CCN1CCCCC1)C(=O)NCCc1cccc(C#N)c1	ZINC000503888584	458727974	/nfs/dbraw/zinc/72/79/74/458727974.db2.gz	CQVOTDZTKCYJLQ-UHFFFAOYSA-N	0	3	342.487	3.008	20	30		EGEDHN
Cn1cc2c(n1)CCC[C@H]2NCCSCc1ccccc1C#N	ZINC000530352011	458753184	/nfs/dbraw/zinc/75/31/84/458753184.db2.gz	MAKIOEURCAWZMG-QGZVFWFLSA-N	0	3	326.469	3.192	20	30		EGEDHN
CCC(CC)CN1CCN(c2oc(-c3ccco3)nc2C#N)CC1	ZINC000508668392	458761928	/nfs/dbraw/zinc/76/19/28/458761928.db2.gz	XSIMJMQKQWDWCJ-UHFFFAOYSA-N	0	3	328.416	3.364	20	30		EGEDHN
C[C@H](C(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H]1C)c1cccc(C#N)c1	ZINC000464640416	458763431	/nfs/dbraw/zinc/76/34/31/458763431.db2.gz	SIBOXZDDBFECJU-FVJLSDCUSA-N	0	3	347.462	3.441	20	30		EGEDHN
C=CCn1c(CC2CCCC2)nnc1N1CCN(C2CCCC2)CC1	ZINC000508833745	458763728	/nfs/dbraw/zinc/76/37/28/458763728.db2.gz	QQFQBZLKMWEFMC-UHFFFAOYSA-N	0	3	343.519	3.261	20	30		EGEDHN
C=CCn1c(CC(C)C)nnc1N1CCN(CCC(C)(C)C)CC1	ZINC000508882218	458766159	/nfs/dbraw/zinc/76/61/59/458766159.db2.gz	WFFUOLQYGQNCRC-UHFFFAOYSA-N	0	3	333.524	3.221	20	30		EGEDHN
C=CCN(C/C=C/c1ccncc1)[C@H](C)c1cccc(-n2cnnn2)c1	ZINC000494929671	458768395	/nfs/dbraw/zinc/76/83/95/458768395.db2.gz	JNESQHAROLIHTK-FUTAKVPZSA-N	0	3	346.438	3.320	20	30		EGEDHN
C=CCSCCNC(=O)N(CCN(C)C)CC1CCCCC1	ZINC000509217417	458770593	/nfs/dbraw/zinc/77/05/93/458770593.db2.gz	KCUOBORYOIXBRK-UHFFFAOYSA-N	0	3	327.538	3.059	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N[C@H](C)[C@@H](c1ccccc1C)N(C)C)OCC	ZINC000510551132	458775398	/nfs/dbraw/zinc/77/53/98/458775398.db2.gz	OHNFWHZAZCXANA-KPFFTGBYSA-N	0	3	332.488	3.474	20	30		EGEDHN
CCC[C@@]1(NCC#Cc2ccc(OC(F)(F)F)cc2)CCOC1	ZINC000512280847	458784534	/nfs/dbraw/zinc/78/45/34/458784534.db2.gz	XYLLPQQHLGYJRQ-MRXNPFEDSA-N	0	3	327.346	3.486	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CCS[C@@H](C)CC1)C(C)C	ZINC000495050371	458788354	/nfs/dbraw/zinc/78/83/54/458788354.db2.gz	URVISIKADVCXOB-DLBZAZTESA-N	0	3	339.549	3.222	20	30		EGEDHN
CC(C)(C)OC(=O)NC1(CNCc2ccc(C#N)cc2F)CCC1	ZINC000495151605	458803086	/nfs/dbraw/zinc/80/30/86/458803086.db2.gz	AXAOSXRAPOJNLQ-UHFFFAOYSA-N	0	3	333.407	3.234	20	30		EGEDHN
CN1CCC[C@]2(CCN(C(=O)Nc3ccc(C(C)(C)C#N)cc3)C2)C1	ZINC000515038349	458804447	/nfs/dbraw/zinc/80/44/47/458804447.db2.gz	AVRHMLKLFTTXLE-FQEVSTJZSA-N	0	3	340.471	3.437	20	30		EGEDHN
COCCN(CCC(=O)Nc1cccc(C#N)c1)Cc1cccs1	ZINC000432950390	458818384	/nfs/dbraw/zinc/81/83/84/458818384.db2.gz	OUIUVYBXCDBJOL-UHFFFAOYSA-N	0	3	343.452	3.097	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC[C@H](CN(C)C)c1ccc(Cl)cc1	ZINC000516557318	458818739	/nfs/dbraw/zinc/81/87/39/458818739.db2.gz	IQJDKMXRLKADLT-GOEBONIOSA-N	0	3	338.879	3.083	20	30		EGEDHN
CC(C)c1cccc(CNC[C@H](O)COc2ccc(CC#N)cc2)c1	ZINC000516862805	458821998	/nfs/dbraw/zinc/82/19/98/458821998.db2.gz	IHNVUSYKJODIAX-FQEVSTJZSA-N	0	3	338.451	3.406	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccnc(N3CCC[C@H](C)C3)c2)nc(C)n1	ZINC000517004090	458825574	/nfs/dbraw/zinc/82/55/74/458825574.db2.gz	JOFOFCPORRKAPX-GUYCJALGSA-N	0	3	349.438	3.215	20	30		EGEDHN
C[C@@H]1CN(Cc2cn(CCC#N)nc2-c2ccncc2)C[C@H](C)S1	ZINC000518671367	458884678	/nfs/dbraw/zinc/88/46/78/458884678.db2.gz	OMIAUUFHIUGZQR-GASCZTMLSA-N	0	3	341.484	3.185	20	30		EGEDHN
N#CCC[C@H](C#N)CNC1CCN(c2nc3ccccc3s2)CC1	ZINC000554552408	458899689	/nfs/dbraw/zinc/89/96/89/458899689.db2.gz	XBKAIDSSUBENHM-CQSZACIVSA-N	0	3	339.468	3.298	20	30		EGEDHN
C[C@@H](C(=O)N(C)CCC#N)N1CCC[C@@H](CCCc2ccccc2)C1	ZINC000441215018	458900917	/nfs/dbraw/zinc/90/09/17/458900917.db2.gz	ZGXZGMBOYCSJMC-AZUAARDMSA-N	0	3	341.499	3.482	20	30		EGEDHN
CCCN(CCN(C)C)C(=O)c1sc2ccc(C#N)cc2c1C	ZINC000555889734	458917463	/nfs/dbraw/zinc/91/74/63/458917463.db2.gz	JGXNSTBTXLUPJZ-UHFFFAOYSA-N	0	3	329.469	3.495	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1c2ccccc2nn1C)C(C)C	ZINC000475296464	458933204	/nfs/dbraw/zinc/93/32/04/458933204.db2.gz	LSSQFJUBDZYXFT-SFHVURJKSA-N	0	3	340.471	3.002	20	30		EGEDHN
C[C@H](CNC(=O)N1CCC(CCC#N)CC1)N(C)Cc1ccccc1	ZINC000519537097	458958352	/nfs/dbraw/zinc/95/83/52/458958352.db2.gz	HEBKXUBQTRPKFH-QGZVFWFLSA-N	0	3	342.487	3.232	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cccc(N(C)C)c1)C(C)C	ZINC000441872897	458979920	/nfs/dbraw/zinc/97/99/20/458979920.db2.gz	LTYDRPYEPZUUFS-IBGZPJMESA-N	0	3	329.488	3.181	20	30		EGEDHN
Cc1cc(C)c(CNC[C@@H](O)COc2ccc(CC#N)cc2)c(C)c1	ZINC000566733006	458990464	/nfs/dbraw/zinc/99/04/64/458990464.db2.gz	KLFIMXUHULXGFZ-LJQANCHMSA-N	0	3	338.451	3.207	20	30		EGEDHN
C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NCC#Cc1ccc(F)cc1	ZINC000495949946	459016079	/nfs/dbraw/zinc/01/60/79/459016079.db2.gz	ZLVUXIDGLKUKQB-CRAIPNDOSA-N	0	3	346.446	3.412	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cc(F)ccc1OC)C(C)C	ZINC000495967907	459021929	/nfs/dbraw/zinc/02/19/29/459021929.db2.gz	YAYXHXRSKMPFRR-QGZVFWFLSA-N	0	3	334.435	3.263	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CCSC3(CCC3)CC2)cc1	ZINC000577361183	459022253	/nfs/dbraw/zinc/02/22/53/459022253.db2.gz	SYIDUQGIUIMVKA-QGZVFWFLSA-N	0	3	339.464	3.129	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1ccc(C)c([N+](=O)[O-])c1)C(C)C	ZINC000495966804	459022699	/nfs/dbraw/zinc/02/26/99/459022699.db2.gz	SAYOBGVSZWADCI-GOSISDBHSA-N	0	3	345.443	3.332	20	30		EGEDHN
CC(C)[C@H](CNC(=O)C1(C#N)CC(C)C1)N1CCc2ccccc2C1	ZINC000532066917	459025308	/nfs/dbraw/zinc/02/53/08/459025308.db2.gz	YJBPIUMJFJZLEM-BSLVTKGXSA-N	0	3	339.483	3.125	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1CCC[C@@H](Cc2ccc(C)cc2)C1	ZINC000566991949	459033260	/nfs/dbraw/zinc/03/32/60/459033260.db2.gz	DUEBDVFZJZLAAK-QUCCMNQESA-N	0	3	341.499	3.258	20	30		EGEDHN
CCC[C@H](N[C@H]1CC[C@H](C#N)C1)C(=O)N1CCc2sccc2C1	ZINC000442785681	459035818	/nfs/dbraw/zinc/03/58/18/459035818.db2.gz	SHIZWUAIFHCSPL-BPUTZDHNSA-N	0	3	331.485	3.083	20	30		EGEDHN
C=C(C)CS(=O)(=O)NC[C@@H](CC(C)C)N[C@H](C)c1ccccc1	ZINC000477600481	459050615	/nfs/dbraw/zinc/05/06/15/459050615.db2.gz	IFYVKKKKRLYAPA-SJLPKXTDSA-N	0	3	338.517	3.247	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)NC1CCN(C2CC2)CC1	ZINC000590031148	459069383	/nfs/dbraw/zinc/06/93/83/459069383.db2.gz	GWDJCHQNXLFIGV-UHFFFAOYSA-N	0	3	339.464	3.438	20	30		EGEDHN
N#CCCCN1CCC([C@@H]2C[C@@H]2NC(=O)OCc2ccccc2)CC1	ZINC000496128006	459077297	/nfs/dbraw/zinc/07/72/97/459077297.db2.gz	JOLVZKFLTUHYOD-OALUTQOASA-N	0	3	341.455	3.317	20	30		EGEDHN
Cc1ccc(Cl)c(OC[C@@H](O)CNCc2ccc(C#N)c(F)c2)c1	ZINC000520797165	459096209	/nfs/dbraw/zinc/09/62/09/459096209.db2.gz	APNYNPBWLJSRCE-HNNXBMFYSA-N	0	3	348.805	3.189	20	30		EGEDHN
COc1ccc(F)c(CNC2CCN(c3ccc(C#N)cc3)CC2)c1	ZINC000590184430	459099040	/nfs/dbraw/zinc/09/90/40/459099040.db2.gz	PUCPAJLEEGUVAC-UHFFFAOYSA-N	0	3	339.414	3.465	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc3c(c2)nn(C)c3C)CC1	ZINC000578061811	459139340	/nfs/dbraw/zinc/13/93/40/459139340.db2.gz	PNHSMKUIXZSTAP-UHFFFAOYSA-N	0	3	341.459	3.044	20	30		EGEDHN
Cn1cc[nH+]c1[N-]N=Cc1cccc2c1N(C(=O)OC(C)(C)C)CC2	ZINC000496337736	459156360	/nfs/dbraw/zinc/15/63/60/459156360.db2.gz	DSFLQZJQLUHYHW-UHFFFAOYSA-N	0	3	341.415	3.164	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@]2(CCN([C@@H]3CC[C@H](C#N)C3)C2)C1	ZINC000496375906	459169884	/nfs/dbraw/zinc/16/98/84/459169884.db2.gz	AWHRLDCFCCNTJX-FRQCXROJSA-N	0	3	333.476	3.402	20	30		EGEDHN
N#Cc1cccc(CN[C@@H]2CCCC[C@H]2NC(=O)c2ccccc2)c1	ZINC000594994207	459209322	/nfs/dbraw/zinc/20/93/22/459209322.db2.gz	IPJPVFCDVKHNHF-WOJBJXKFSA-N	0	3	333.435	3.389	20	30		EGEDHN
C=CC1CCN(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)CC1	ZINC000522277218	459233868	/nfs/dbraw/zinc/23/38/68/459233868.db2.gz	BGWZRMSDFWRBPC-IBGZPJMESA-N	0	3	327.472	3.259	20	30		EGEDHN
N#Cc1ccc(C2(NC(=O)C[C@H]3NCc4ccccc43)CCC2)cc1	ZINC000595250982	459262436	/nfs/dbraw/zinc/26/24/36/459262436.db2.gz	SPRUTWDWOQCORY-LJQANCHMSA-N	0	3	331.419	3.288	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1ccc(NCCc2ccccc2)cc1	ZINC000580642983	459262445	/nfs/dbraw/zinc/26/24/45/459262445.db2.gz	PSGIWUFBXDTDIX-IBGZPJMESA-N	0	3	336.439	3.301	20	30		EGEDHN
C=CCCSCCNC(=O)N[C@H](CN)c1ccc2ccccc2c1	ZINC000595265091	459264076	/nfs/dbraw/zinc/26/40/76/459264076.db2.gz	JPUXYLIAIQPMDP-GOSISDBHSA-N	0	3	343.496	3.448	20	30		EGEDHN
N#Cc1ccc(CCN2CCN(CCc3cccs3)CC2)cc1	ZINC000595294983	459269335	/nfs/dbraw/zinc/26/93/35/459269335.db2.gz	DWXCOETXGOFIKC-UHFFFAOYSA-N	0	3	325.481	3.023	20	30		EGEDHN
N#CCCn1cc(CN2CC[C@@H]3OCC[C@@H]3C2)c(-c2ccccc2)n1	ZINC000581490044	459274266	/nfs/dbraw/zinc/27/42/66/459274266.db2.gz	UFTTZQGGXXVXEX-MJGOQNOKSA-N	0	3	336.439	3.075	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)N1CCC[C@@H](CC#N)C1)c1ccsc1	ZINC000595451283	459307408	/nfs/dbraw/zinc/30/74/08/459307408.db2.gz	ZONIRJCMMCCDON-RDJZCZTQSA-N	0	3	348.516	3.466	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC(F)(F)CC1=CNNc1ncccc1F	ZINC000496750202	459310345	/nfs/dbraw/zinc/31/03/45/459310345.db2.gz	FEYHBCKOHLIBQB-SNVBAGLBSA-N	0	3	344.337	3.263	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC(F)(F)CC1=CNNc1ncccc1F	ZINC000496750201	459310794	/nfs/dbraw/zinc/31/07/94/459310794.db2.gz	FEYHBCKOHLIBQB-JTQLQIEISA-N	0	3	344.337	3.263	20	30		EGEDHN
N#Cc1ccc(CCN2CCC(Oc3ncccc3F)CC2)cc1	ZINC000595461387	459311024	/nfs/dbraw/zinc/31/10/24/459311024.db2.gz	NLQLHNPYRATFCA-UHFFFAOYSA-N	0	3	325.387	3.178	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cc(F)cc([N+](=O)[O-])c1)C(C)C	ZINC000523655477	459319964	/nfs/dbraw/zinc/31/99/64/459319964.db2.gz	HGSVFTICKZPEED-QGZVFWFLSA-N	0	3	349.406	3.162	20	30		EGEDHN
N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cccc(CN)c1	ZINC000591309990	459350176	/nfs/dbraw/zinc/35/01/76/459350176.db2.gz	XVADPWPZDFUHQW-MOPGFXCFSA-N	0	3	334.423	3.449	20	30		EGEDHN
C[C@H](N[C@H]1CCCc2cc(C#N)ccc21)c1cccc(-n2cnnn2)c1	ZINC000591348829	459358522	/nfs/dbraw/zinc/35/85/22/459358522.db2.gz	FLINLJVMVUPYEF-XOBRGWDASA-N	0	3	344.422	3.262	20	30		EGEDHN
CC(C)(C)OC(=O)NCCNCc1ccc(C#N)cc1C(F)(F)F	ZINC000496939358	459379279	/nfs/dbraw/zinc/37/92/79/459379279.db2.gz	CYYHVSHXXFLKDQ-UHFFFAOYSA-N	0	3	343.349	3.191	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC[C@H]2CCCC[C@H]2C(F)(F)F)CC1	ZINC000483740506	459388079	/nfs/dbraw/zinc/38/80/79/459388079.db2.gz	GNCWBPIDVVTOMT-UKRRQHHQSA-N	0	3	347.425	3.305	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CNCc2cc3ccccc3s2)cc1	ZINC000560860500	459402370	/nfs/dbraw/zinc/40/23/70/459402370.db2.gz	SPSPYXWIWZGEBL-INIZCTEOSA-N	0	3	338.432	3.302	20	30		EGEDHN
N#Cc1ccccc1OCCN1CC[C@H](c2ccccc2)[C@H](CO)C1	ZINC000595747503	459424076	/nfs/dbraw/zinc/42/40/76/459424076.db2.gz	KMHFOGRPKAIGHZ-VQTJNVASSA-N	0	3	336.435	3.035	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](O)CO[C@H]2CCCc3ccccc32)cc1	ZINC000591725151	459425499	/nfs/dbraw/zinc/42/54/99/459425499.db2.gz	DTFQVZXMINMMCF-CTNGQTDRSA-N	0	3	336.435	3.103	20	30		EGEDHN
Cc1ccccc1[C@H]1C[C@@H](C)N(Cc2cnc3c(C#N)cnn3c2)C1	ZINC000582786970	459427106	/nfs/dbraw/zinc/42/71/06/459427106.db2.gz	RZRBLLBEFQMHDE-WBVHZDCISA-N	0	3	331.423	3.287	20	30		EGEDHN
C=CCC1(NCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)CCCC1	ZINC000595779607	459437605	/nfs/dbraw/zinc/43/76/05/459437605.db2.gz	BZCWPDWHADNZLS-UHFFFAOYSA-N	0	3	333.388	3.020	20	30		EGEDHN
C=C[C@H]1CCCCN1C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000485592677	459461954	/nfs/dbraw/zinc/46/19/54/459461954.db2.gz	PZHIWMSTPCTUPM-IBGZPJMESA-N	0	3	327.472	3.401	20	30		EGEDHN
COCCN1CCC[C@@H](Nc2c(C#N)cnc3c(Cl)cccc32)C1	ZINC000591912644	459481220	/nfs/dbraw/zinc/48/12/20/459481220.db2.gz	QEJWNLDTJBXOQA-CQSZACIVSA-N	0	3	344.846	3.283	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H]2CN(Cc3ccc(C#N)cc3)C[C@@H]2C1	ZINC000497215256	459490016	/nfs/dbraw/zinc/49/00/16/459490016.db2.gz	QJHPBNOCVBVYLF-QZTJIDSGSA-N	0	3	341.455	3.247	20	30		EGEDHN
CN1CCC(CC(=O)N[C@H](C#N)c2ccc(C(C)(C)C)cc2)CC1	ZINC000486237277	459494094	/nfs/dbraw/zinc/49/40/94/459494094.db2.gz	VUWDTPBTSRAKOR-GOSISDBHSA-N	0	3	327.472	3.397	20	30		EGEDHN
CN(Cc1ccccc1)[C@H]1CCN(c2nc(C#N)c(Cl)s2)C1	ZINC000596139253	459533546	/nfs/dbraw/zinc/53/35/46/459533546.db2.gz	KQGUMCHHPIVAPQ-ZDUSSCGKSA-N	0	3	332.860	3.379	20	30		EGEDHN
Cc1ccc2nc(CNC(=O)C(C#N)CCc3ccccc3)cn2c1	ZINC000487976663	459537123	/nfs/dbraw/zinc/53/71/23/459537123.db2.gz	ZOMTWQPFNKBFFV-KRWDZBQOSA-N	0	3	332.407	3.032	20	30		EGEDHN
C[C@@H]1C[C@H]1N1CCN(c2nc3cc(Cl)ccn3c2C#N)C[C@@H](C)C1	ZINC000488735814	459550170	/nfs/dbraw/zinc/55/01/70/459550170.db2.gz	PLMBUIKKJMCUEY-GZBFAFLISA-N	0	3	343.862	3.026	20	30		EGEDHN
C[C@@H](C(=O)NC1(C#N)CCC1)N1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2	ZINC000571227922	459566159	/nfs/dbraw/zinc/56/61/59/459566159.db2.gz	IMUXSCRWUCXXCD-KANFNMMFSA-N	0	3	337.467	3.348	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1C[C@H](c2ccc(C)cc2)C[C@@H]1C	ZINC000490041023	459576142	/nfs/dbraw/zinc/57/61/42/459576142.db2.gz	YKPHOAUGARKRDV-ZIFCJYIRSA-N	0	3	327.472	3.181	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(Cc2ccc(C)o2)C2CC2)CC1	ZINC000592351816	459577472	/nfs/dbraw/zinc/57/74/72/459577472.db2.gz	BQNOUHGOLCOZEP-UHFFFAOYSA-N	0	3	331.460	3.303	20	30		EGEDHN
CCN1C[C@@H](C)N(CC#Cc2ccc(OC(F)(F)F)cc2)C[C@H]1C	ZINC000498904890	459610165	/nfs/dbraw/zinc/61/01/65/459610165.db2.gz	LNIKHHXCAFRAED-HUUCEWRRSA-N	0	3	340.389	3.351	20	30		EGEDHN
C#CCN1C(=O)c2ccccc2N[C@@]12CCN(C)[C@@H](c1ccccc1)C2	ZINC000491295322	459613525	/nfs/dbraw/zinc/61/35/25/459613525.db2.gz	GRUIGJSIPQCPTK-IRLDBZIGSA-N	0	3	345.446	3.351	20	30		EGEDHN
C#C[C@H](C)N(C)CCC(=O)N[C@H](c1cccs1)c1ccccc1	ZINC000491339680	459617887	/nfs/dbraw/zinc/61/78/87/459617887.db2.gz	RPLKITCQTLKNOE-KXBFYZLASA-N	0	3	326.465	3.297	20	30		EGEDHN
C=CCCC[C@@H](C)N[C@@H](Cc1ccc(C(F)(F)F)cc1)C(N)=O	ZINC000543138724	459626644	/nfs/dbraw/zinc/62/66/44/459626644.db2.gz	LTSNOHUCMXYCGN-DOMZBBRYSA-N	0	3	328.378	3.436	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2CCc3ccc(C)cc32)CC1	ZINC000592530685	459627907	/nfs/dbraw/zinc/62/79/07/459627907.db2.gz	VIDYLHFEALTAFV-LJQANCHMSA-N	0	3	327.472	3.322	20	30		EGEDHN
C=CCN1CCC(NC(=O)/C=C\c2ccc(OCCC)cc2)CC1	ZINC000491545729	459635579	/nfs/dbraw/zinc/63/55/79/459635579.db2.gz	JNWRMMMSPOZLNS-YFHOEESVSA-N	0	3	328.456	3.255	20	30		EGEDHN
C#C[C@H](CC)NCc1cn(Cc2ccccc2)nc1-c1cccnc1	ZINC000491711130	459658835	/nfs/dbraw/zinc/65/88/35/459658835.db2.gz	SZGVMOHONBQOJU-HXUWFJFHSA-N	0	3	330.435	3.495	20	30		EGEDHN
C=CCCSCCNC(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000596596981	459690620	/nfs/dbraw/zinc/69/06/20/459690620.db2.gz	HRIZZVWVXIRODI-WBVHZDCISA-N	0	3	335.517	3.286	20	30		EGEDHN
COC(=O)N1CCC[C@H]([C@@H](C)NCc2ccc(C#N)cc2Cl)C1	ZINC000492392066	459702272	/nfs/dbraw/zinc/70/22/72/459702272.db2.gz	RRBVJWXMLUEYSM-DOMZBBRYSA-N	0	3	335.835	3.168	20	30		EGEDHN
CC(C)Cn1nccc1C([O-])=C(C#N)c1ccc(C(F)(F)F)cn1	ZINC000563119315	459717968	/nfs/dbraw/zinc/71/79/68/459717968.db2.gz	QDAYXWMWQVLGBF-LBPRGKRZSA-N	0	3	336.317	3.443	20	30		EGEDHN
CC(C)Cn1nccc1C(=O)C(C#N)c1ccc(C(F)(F)F)cn1	ZINC000563119315	459717972	/nfs/dbraw/zinc/71/79/72/459717972.db2.gz	QDAYXWMWQVLGBF-LBPRGKRZSA-N	0	3	336.317	3.443	20	30		EGEDHN
Cc1cc(C)cc(N(CCC#N)C(=O)[C@H](C)NC2(C3CC3)CC2)c1	ZINC000544413593	459758273	/nfs/dbraw/zinc/75/82/73/459758273.db2.gz	GSEXZPDRNLYTIH-INIZCTEOSA-N	0	3	325.456	3.471	20	30		EGEDHN
N#Cc1cc(F)ccc1NC(=O)C(C[C@@H]1CCCO1)C(F)(F)F	ZINC000593083877	459768058	/nfs/dbraw/zinc/76/80/58/459768058.db2.gz	CQZWBLFVQQTFBV-NWDGAFQWSA-N	0	3	330.281	3.383	20	30		EGEDHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)N1CCC(CCC#N)CC1	ZINC000564900663	459778734	/nfs/dbraw/zinc/77/87/34/459778734.db2.gz	VNQBRXPERQXELP-QGZVFWFLSA-N	0	3	342.487	3.232	20	30		EGEDHN
N#Cc1ccc2c(c1)CCN2C(=O)C(C[C@H]1CCCO1)C(F)(F)F	ZINC000593174243	459796807	/nfs/dbraw/zinc/79/68/07/459796807.db2.gz	UGYJXVYGLYULQJ-KGLIPLIRSA-N	0	3	338.329	3.195	20	30		EGEDHN
CC(C)c1ccc(O[C@H](C)CNCc2cnc3c(C#N)cnn3c2)cc1	ZINC000574813025	459876092	/nfs/dbraw/zinc/87/60/92/459876092.db2.gz	MWLQDMVWFZZVPY-OAHLLOKOSA-N	0	3	349.438	3.281	20	30		EGEDHN
CC(C)C[C@H](C#N)NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000608822124	459886811	/nfs/dbraw/zinc/88/68/11/459886811.db2.gz	GOTIEZHRNDIJHH-SJLPKXTDSA-N	0	3	331.435	3.092	20	30		EGEDHN
CC(C)CCN(CCC#N)C(=O)[C@H]1CCCN(Cc2cccnc2)C1	ZINC000609142960	459910008	/nfs/dbraw/zinc/91/00/08/459910008.db2.gz	BDJUQSBIPVBAPD-IBGZPJMESA-N	0	3	342.487	3.082	20	30		EGEDHN
Cc1cc(CN[C@@H](Cc2ccccc2)[C@H](O)C(F)(F)F)ccc1C#N	ZINC000618193480	459928706	/nfs/dbraw/zinc/92/87/06/459928706.db2.gz	ILDSIDUKMSDCEV-ROUUACIJSA-N	0	3	348.368	3.491	20	30		EGEDHN
C[C@H](N[C@H]1CCc2cc(C#N)ccc21)c1cccc(-n2ccnn2)c1	ZINC000588230265	459934881	/nfs/dbraw/zinc/93/48/81/459934881.db2.gz	QFBIZUKFKNSYQY-XOBRGWDASA-N	0	3	329.407	3.477	20	30		EGEDHN
C[C@H]1c2ccccc2CCN1C[C@H](O)COc1ccc(CC#N)cc1	ZINC000609316939	459942900	/nfs/dbraw/zinc/94/29/00/459942900.db2.gz	DWDITGJYBHXVCZ-LPHOPBHVSA-N	0	3	336.435	3.112	20	30		EGEDHN
COc1ccc(OC)c([C@H]2CCCN2C[C@@H](O)CC(C)(C)C#N)c1	ZINC000598587182	459953443	/nfs/dbraw/zinc/95/34/43/459953443.db2.gz	OMGGLCVDWYYOQQ-WMLDXEAASA-N	0	3	332.444	3.141	20	30		EGEDHN
C[C@@H]1Cc2ccccc2N1C1CCN(C[C@@H](O)CC(C)(C)C#N)CC1	ZINC000598594032	459957435	/nfs/dbraw/zinc/95/74/35/459957435.db2.gz	FENXQRUUULCMQL-APWZRJJASA-N	0	3	341.499	3.203	20	30		EGEDHN
C[C@H]1CN(c2cccc(Cl)c2)CCN1C[C@H](O)CC(C)(C)C#N	ZINC000598618302	459964775	/nfs/dbraw/zinc/96/47/75/459964775.db2.gz	OOIVIDFYOHPPFP-WMLDXEAASA-N	0	3	335.879	3.151	20	30		EGEDHN
N#CC1(CC(=O)NCC2CCN(c3ccncc3)CC2)CCCCC1	ZINC000597470616	459965775	/nfs/dbraw/zinc/96/57/75/459965775.db2.gz	ZOFMOULYWLDUBQ-UHFFFAOYSA-N	0	3	340.471	3.278	20	30		EGEDHN
C[C@@H](CC1(C#N)CCOCC1)NC[C@H](c1ccco1)N1CCCCC1	ZINC000602500313	459970483	/nfs/dbraw/zinc/97/04/83/459970483.db2.gz	YUVPDDCBVILHMO-ZWKOTPCHSA-N	0	3	345.487	3.495	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CC[C@@H](N(C)CCc2ccccc2)C1)OCC	ZINC000618354025	459980577	/nfs/dbraw/zinc/98/05/77/459980577.db2.gz	SATYWJDMMDTQRO-UXHICEINSA-N	0	3	344.499	3.133	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCc1ccncc1C(F)(F)F	ZINC000597576734	459998458	/nfs/dbraw/zinc/99/84/58/459998458.db2.gz	DKPVRWKOLKRYLB-AWEZNQCLSA-N	0	3	347.340	3.489	20	30		EGEDHN
C=CCSCCNC(=O)N[C@H](CN1CCCCC1)c1ccccc1	ZINC000609639600	460001141	/nfs/dbraw/zinc/00/11/41/460001141.db2.gz	MLMFJCFWAYCAKA-GOSISDBHSA-N	0	3	347.528	3.432	20	30		EGEDHN
Cc1ccc(Br)c(CNC[C@@H](O)CC(C)(C)C#N)c1	ZINC000598727110	460007194	/nfs/dbraw/zinc/00/71/94/460007194.db2.gz	CLKHTFWMHMOBFH-ZDUSSCGKSA-N	0	3	325.250	3.148	20	30		EGEDHN
Cc1nc(SCC(=O)Nc2cccc(CN)c2)c(C#N)c(C)c1C	ZINC000593900282	460013929	/nfs/dbraw/zinc/01/39/29/460013929.db2.gz	MXVHWHOWTDJDLW-UHFFFAOYSA-N	0	3	340.452	3.068	20	30		EGEDHN
Cc1cc(NCc2cccc(C#N)n2)cc(N2CCN(C(C)C)CC2)c1	ZINC000602633940	460034508	/nfs/dbraw/zinc/03/45/08/460034508.db2.gz	MTDNODOHQHZFDU-UHFFFAOYSA-N	0	3	349.482	3.404	20	30		EGEDHN
N#Cc1cccc(CNCCc2cnc(SC3CCCC3)nc2)n1	ZINC000602676513	460059515	/nfs/dbraw/zinc/05/95/15/460059515.db2.gz	NSJZKUBBSYDZMT-UHFFFAOYSA-N	0	3	339.468	3.110	20	30		EGEDHN
C[C@H](CC1(C#N)CCOCC1)NCc1cnccc1C(F)(F)F	ZINC000602713918	460082696	/nfs/dbraw/zinc/08/26/96/460082696.db2.gz	GTRNOEAZJVWRBO-GFCCVEGCSA-N	0	3	327.350	3.289	20	30		EGEDHN
CSC1CCN(Cc2cn(CCC#N)nc2-c2ccncc2)CC1	ZINC000602725096	460087119	/nfs/dbraw/zinc/08/71/19/460087119.db2.gz	JBOFGVCNFPOLFT-UHFFFAOYSA-N	0	3	341.484	3.186	20	30		EGEDHN
COc1ccc(F)c(CNC(=O)C(C#N)CCc2ccccc2)c1	ZINC000598909283	460090746	/nfs/dbraw/zinc/09/07/46/460090746.db2.gz	ICYNNIIGMDSRIE-HNNXBMFYSA-N	0	3	326.371	3.223	20	30		EGEDHN
N#Cc1ccc(CCNC(=O)C2CCN(Cc3ccccc3)CC2)cc1	ZINC000597891575	460096567	/nfs/dbraw/zinc/09/65/67/460096567.db2.gz	OQAPFVBXXUNSJV-UHFFFAOYSA-N	0	3	347.462	3.129	20	30		EGEDHN
COc1cc([C@H](C)NCc2ccc(C#N)cc2C)ccc1OCCO	ZINC000614407413	460133753	/nfs/dbraw/zinc/13/37/53/460133753.db2.gz	QEJJGVLKCZRNNW-HNNXBMFYSA-N	0	3	340.423	3.097	20	30		EGEDHN
N#CCC1CCN(C[C@@H](O)COc2cc(Cl)cc(Cl)c2)CC1	ZINC000602805973	460137415	/nfs/dbraw/zinc/13/74/15/460137415.db2.gz	KNFUVQSBYUHBCM-OAHLLOKOSA-N	0	3	343.254	3.359	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H]1CCN(CCOc2ccc(C#N)cc2)C1	ZINC000610433473	460150941	/nfs/dbraw/zinc/15/09/41/460150941.db2.gz	MRCQSZHHEXBEGU-HXUWFJFHSA-N	0	3	335.451	3.143	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H]1CCN(CCOc2ccccc2C#N)C1	ZINC000610433439	460151412	/nfs/dbraw/zinc/15/14/12/460151412.db2.gz	KSLBBJOVBSALEH-HXUWFJFHSA-N	0	3	335.451	3.143	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]([C@@H]2CCCO2)C2(CO)CCC2)c(Cl)c1	ZINC000602889872	460173681	/nfs/dbraw/zinc/17/36/81/460173681.db2.gz	FLOUXZVXFRUKCX-IRXDYDNUSA-N	0	3	334.847	3.011	20	30		EGEDHN
CN(C)[C@H](CNC(=O)N[C@H]1CCc2cc(C#N)ccc21)c1ccccc1	ZINC000618795257	460178166	/nfs/dbraw/zinc/17/81/66/460178166.db2.gz	LRVUBWRMIXSTTR-VQTJNVASSA-N	0	3	348.450	3.148	20	30		EGEDHN
C[C@@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccc(-n2cncn2)cc1	ZINC000618806206	460184127	/nfs/dbraw/zinc/18/41/27/460184127.db2.gz	PZMQAXSLLZRFOV-VLIAUNLRSA-N	0	3	329.407	3.477	20	30		EGEDHN
CC[C@H]1CCCCN1CCNC(=O)N[C@H]1CCc2cc(C#N)ccc21	ZINC000618816223	460187011	/nfs/dbraw/zinc/18/70/11/460187011.db2.gz	KDVPRIHWNSFCSC-HKUYNNGSSA-N	0	3	340.471	3.109	20	30		EGEDHN
CC[C@@](C)(NCC(=O)NCc1cccc(C#N)c1)c1ccc(F)cc1	ZINC000602927982	460191017	/nfs/dbraw/zinc/19/10/17/460191017.db2.gz	UYLUSZOINYVCTQ-HXUWFJFHSA-N	0	3	339.414	3.229	20	30		EGEDHN
C[C@@H](NC(=O)[C@H](N)CCCCC#N)c1nc(-c2ccccc2)cs1	ZINC000594434795	460218192	/nfs/dbraw/zinc/21/81/92/460218192.db2.gz	TVAMQNMLIBIWOH-UKRRQHHQSA-N	0	3	342.468	3.399	20	30		EGEDHN
CC(C)CCN1Cc2cccc(NC(=O)[C@H](N)CCCCC#N)c2C1	ZINC000594437217	460220480	/nfs/dbraw/zinc/22/04/80/460220480.db2.gz	JHAPSPPYHYTKQV-GOSISDBHSA-N	0	3	342.487	3.398	20	30		EGEDHN
CC[C@H](NC[C@H](O)COc1ccccc1C#N)c1ccc(OC)cc1	ZINC000599344209	460232512	/nfs/dbraw/zinc/23/25/12/460232512.db2.gz	AOGCRPYZEJJEAW-HKUYNNGSSA-N	0	3	340.423	3.047	20	30		EGEDHN
N#CC[C@H](CC(=O)N1CCCN(c2ccncc2)CC1)c1ccccc1	ZINC000603084982	460240196	/nfs/dbraw/zinc/24/01/96/460240196.db2.gz	YZGHEMLWXFLLFK-LJQANCHMSA-N	0	3	348.450	3.208	20	30		EGEDHN
CN(CCOC(C)(C)C)CCC(=O)Nc1sc2c(c1C#N)CCC2	ZINC000610859715	460249876	/nfs/dbraw/zinc/24/98/76/460249876.db2.gz	JRNQVBGMZJOLID-UHFFFAOYSA-N	0	3	349.500	3.184	20	30		EGEDHN
CCN(CCC#N)C(=O)c1ccccc1OCCN1CCCC[C@H]1C	ZINC000611211668	460309327	/nfs/dbraw/zinc/30/93/27/460309327.db2.gz	IZENSMIHTKIDSR-QGZVFWFLSA-N	0	3	343.471	3.316	20	30		EGEDHN
C[C@@H]1CC[C@@H](C(F)(F)F)CN1C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000619306664	460325617	/nfs/dbraw/zinc/32/56/17/460325617.db2.gz	QMVDXRDSMGFABF-DAXOMENPSA-N	0	3	349.356	3.430	20	30		EGEDHN
N#CCN1CCC(NCc2c(Cl)cccc2N2CCCC2)CC1	ZINC000611292717	460330603	/nfs/dbraw/zinc/33/06/03/460330603.db2.gz	LQZGUTLSGCRGAE-UHFFFAOYSA-N	0	3	332.879	3.018	20	30		EGEDHN
C[C@@H](N[C@H](CCC#N)c1ccccc1)c1cccc(-n2cnnn2)c1	ZINC000611337082	460339611	/nfs/dbraw/zinc/33/96/11/460339611.db2.gz	VJPLRMGTZZDAFX-DNVCBOLYSA-N	0	3	332.411	3.358	20	30		EGEDHN
Cc1cc2ncn(C[C@@H](O)CN[C@@H](C)c3cccc(C#N)c3)c2cc1C	ZINC000611386855	460350371	/nfs/dbraw/zinc/35/03/71/460350371.db2.gz	AXPJGJYCBHYIDK-LPHOPBHVSA-N	0	3	348.450	3.237	20	30		EGEDHN
N#Cc1ccc2c(c1)CCCC[C@H]2NC[C@@H](O)COc1ccccc1	ZINC000619508175	460371491	/nfs/dbraw/zinc/37/14/91/460371491.db2.gz	FOSQGBVUCCSYDQ-WIYYLYMNSA-N	0	3	336.435	3.355	20	30		EGEDHN
COc1ccc(CN(C)CCOc2ccccc2C#N)cc1OC	ZINC000604271932	460399267	/nfs/dbraw/zinc/39/92/67/460399267.db2.gz	BQYFMPASAZHEQA-UHFFFAOYSA-N	0	3	326.396	3.086	20	30		EGEDHN
CCN1C[C@H](CN(C)Cc2ccc(CC#N)cc2)Oc2ccccc21	ZINC000612058571	460522491	/nfs/dbraw/zinc/52/24/91/460522491.db2.gz	FNIUWLYJFKQNSF-IBGZPJMESA-N	0	3	335.451	3.472	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@@H]2CCN(C3CC3)C2)cc1OC	ZINC000623403524	460530322	/nfs/dbraw/zinc/53/03/22/460530322.db2.gz	ZFZNAJUITAUQOI-CQSZACIVSA-N	0	3	336.863	3.240	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)N1CCC[C@](C)(C#N)C1)c1ccsc1	ZINC000612100117	460541184	/nfs/dbraw/zinc/54/11/84/460541184.db2.gz	ZDQRUDISBCRQNJ-SJLPKXTDSA-N	0	3	348.516	3.466	20	30		EGEDHN
CC1CCC(N2CCN(C(=O)c3ccccc3CC#N)CC2)CC1	ZINC000601181867	460742506	/nfs/dbraw/zinc/74/25/06/460742506.db2.gz	OJAJUNYELRQFFK-UHFFFAOYSA-N	0	3	325.456	3.089	20	30		EGEDHN
N#Cc1ccc2c(c1)CCCC[C@H]2NC[C@H](n1cncn1)C(F)(F)F	ZINC000601294679	460779744	/nfs/dbraw/zinc/77/97/44/460779744.db2.gz	PNATZFLGZIKWBF-CVEARBPZSA-N	0	3	349.360	3.310	20	30		EGEDHN
Cc1cccc(CN2CC[C@@H](NC(=O)c3cccc(CC#N)c3)C2)c1	ZINC000601849297	460925067	/nfs/dbraw/zinc/92/50/67/460925067.db2.gz	HEGAYCWLRIQEBN-HXUWFJFHSA-N	0	3	333.435	3.065	20	30		EGEDHN
N#CCC[C@@H](NC[C@]1(O)CCN(Cc2ccccc2)C1)c1ccccc1	ZINC000601964625	460964303	/nfs/dbraw/zinc/96/43/03/460964303.db2.gz	JMZZYTMMHCEQML-FGZHOGPDSA-N	0	3	349.478	3.258	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN1CCC[C@@H]1CC(=O)c1ccc(F)cc1	ZINC000621269077	460968856	/nfs/dbraw/zinc/96/88/56/460968856.db2.gz	IVRNUSTWWPGJFH-IAGOWNOFSA-N	0	3	332.419	3.164	20	30		EGEDHN
CCc1ccc(F)cc1C(=O)C(C#N)c1nnc2n1CCCCC2	ZINC000633900663	461320021	/nfs/dbraw/zinc/32/00/21/461320021.db2.gz	SBOVGOALCKEWRI-HNNXBMFYSA-N	0	3	326.375	3.196	20	30		EGEDHN
CC#CC[C@H](CO)NCc1c(C)nn(Cc2ccccc2Cl)c1C	ZINC000641768798	461361248	/nfs/dbraw/zinc/36/12/48/461361248.db2.gz	IKEVYGHNHYNZMH-QGZVFWFLSA-N	0	3	345.874	3.066	20	30		EGEDHN
C=CCC1(NC(=O)NCc2ccccc2OCCN(C)C)CCCC1	ZINC000663867204	461847886	/nfs/dbraw/zinc/84/78/86/461847886.db2.gz	JHOFFNOQBAIMAB-UHFFFAOYSA-N	0	3	345.487	3.315	20	30		EGEDHN
C=CCCc1ccccc1NC(=O)NC1CCN([C@H]2CCOC2)CC1	ZINC000667029015	461919089	/nfs/dbraw/zinc/91/90/89/461919089.db2.gz	NDWJARUQNBEHRU-SFHVURJKSA-N	0	3	343.471	3.180	20	30		EGEDHN
C=CCN(C(=O)NCC(C)(C)N[C@@H](C)c1ccccc1)[C@@H](C)COC	ZINC000664106701	461942911	/nfs/dbraw/zinc/94/29/11/461942911.db2.gz	BTDAZTSZBHNRMI-IRXDYDNUSA-N	0	3	347.503	3.348	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)c1cccc2c1OCCCO2	ZINC000651259073	462157917	/nfs/dbraw/zinc/15/79/17/462157917.db2.gz	FGPOLPJCHQGZPX-AWEZNQCLSA-N	0	3	347.374	3.225	20	30		EGEDHN
C=CC[C@H]1CCCN(CC(=O)N[C@@H](C)c2cc(OC)ccc2OC)C1	ZINC000661377759	462223451	/nfs/dbraw/zinc/22/34/51/462223451.db2.gz	UCAJOCXJAUAFBX-HOTGVXAUSA-N	0	3	346.471	3.169	20	30		EGEDHN
C=CCN(CC(=O)N1CCO[C@@H](c2ccc(F)cc2)C1)C(C)(C)C	ZINC000661756598	462399418	/nfs/dbraw/zinc/39/94/18/462399418.db2.gz	SCJBYADKKGVJHO-QGZVFWFLSA-N	0	3	334.435	3.012	20	30		EGEDHN
Cc1nc(NCCCN2CCN(C)C[C@@H]2c2ccccc2)ccc1C#N	ZINC000487911327	468059765	/nfs/dbraw/zinc/05/97/65/468059765.db2.gz	PORKBQZAXOJHDJ-HXUWFJFHSA-N	0	3	349.482	3.052	20	30		EGEDHN
Cc1ccc(CN2CCSCC2)cc1NCc1cc(C#N)n(C)c1	ZINC000191418714	533941230	/nfs/dbraw/zinc/94/12/30/533941230.db2.gz	QASPXUHRDAZDGU-UHFFFAOYSA-N	0	3	340.496	3.366	20	30		EGEDHN
C[C@H](N[C@H](Cc1ccccc1)C(=O)N1CCCC1)c1ccc(C#N)cc1	ZINC000181638412	533997809	/nfs/dbraw/zinc/99/78/09/533997809.db2.gz	DXRMVUYGPKPROO-LAUBAEHRSA-N	0	3	347.462	3.443	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC=C(CNCc2cccc(C#N)c2)CC1	ZINC000189497944	526393346	/nfs/dbraw/zinc/39/33/46/526393346.db2.gz	IGBAVPHWPJEEAX-UHFFFAOYSA-N	0	3	327.428	3.215	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCC(C)(C)c2ccccc2C)CC1	ZINC000171730932	526432401	/nfs/dbraw/zinc/43/24/01/526432401.db2.gz	LXNQQATZPHZNKI-UHFFFAOYSA-N	0	3	329.488	3.222	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCc2cccc(OCCCC)c2)CC1	ZINC000171709845	526435120	/nfs/dbraw/zinc/43/51/20/526435120.db2.gz	WANXIMCPESPTNB-UHFFFAOYSA-N	0	3	345.487	3.315	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](c2ccccc2)C2CCC2)CC1	ZINC000171734653	526436918	/nfs/dbraw/zinc/43/69/18/526436918.db2.gz	CLHMHDYTGBJWLM-IBGZPJMESA-N	0	3	327.472	3.477	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cccc(OC(F)(F)F)c2)CC1	ZINC000171738141	526441940	/nfs/dbraw/zinc/44/19/40/526441940.db2.gz	CKJQARVYUABDGA-UHFFFAOYSA-N	0	3	343.349	3.357	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(Cl)ncc2Cl)CC1	ZINC000153028490	526598936	/nfs/dbraw/zinc/59/89/36/526598936.db2.gz	DNZTZKXVPWSOOJ-UHFFFAOYSA-N	0	3	328.243	3.159	20	30		EGEDHN
C=CCOc1ccc(CNC[C@@](C)(O)c2cc(C)oc2C)cc1OC	ZINC000174444257	526885524	/nfs/dbraw/zinc/88/55/24/526885524.db2.gz	RRBYALCAMRITPP-HXUWFJFHSA-N	0	3	345.439	3.467	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)N1[C@@H]2CC[C@H]1CN(CC)CC2	ZINC000177800290	528379161	/nfs/dbraw/zinc/37/91/61/528379161.db2.gz	IVCWOQGHYTWHCY-CVEARBPZSA-N	0	3	342.443	3.047	20	30		EGEDHN
CC[C@](C)(COc1ncccc1Cl)NCc1cc(C#N)n(C)c1	ZINC000191448547	529366226	/nfs/dbraw/zinc/36/62/26/529366226.db2.gz	OUKLRLIWDYKQLP-QGZVFWFLSA-N	0	3	332.835	3.282	20	30		EGEDHN
CC[C@H](C)N[C@@H](CNC(=O)Nc1cccc(C#N)c1)c1ccco1	ZINC000353353377	536173002	/nfs/dbraw/zinc/17/30/02/536173002.db2.gz	MUKZSDJWTUEXLS-BBRMVZONSA-N	0	3	326.400	3.402	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2Cc3ccccc3C(F)(F)C2)CC1	ZINC000676358611	549075513	/nfs/dbraw/zinc/07/55/13/549075513.db2.gz	UIPRWDYQWQHUCA-UHFFFAOYSA-N	0	3	349.425	3.344	20	30		EGEDHN
C=CCN(CCc1nc(C)c(C(C)=O)[nH]1)Cc1ccc(OC)cc1	ZINC000677477637	549277471	/nfs/dbraw/zinc/27/74/71/549277471.db2.gz	PJNAYZNMTVBSSU-UHFFFAOYSA-N	0	3	327.428	3.160	20	30		EGEDHN
COCCOc1cc(C(=O)C(C#N)c2ccc3ccccc3n2)ccn1	ZINC000679090019	549632653	/nfs/dbraw/zinc/63/26/53/549632653.db2.gz	PJPPVGACNSDICN-INIZCTEOSA-N	0	3	347.374	3.145	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N[C@H]1CCN(CC2CC2)C1)c1ccc(F)c(F)c1	ZINC000681311061	549981245	/nfs/dbraw/zinc/98/12/45/549981245.db2.gz	NJDIRORNTVKZRT-YJBOKZPZSA-N	0	3	349.425	3.366	20	30		EGEDHN
CCCN1CCC(NC(=S)Nc2ccc(C#N)c(Cl)c2)CC1	ZINC000726447682	574554261	/nfs/dbraw/zinc/55/42/61/574554261.db2.gz	FXNKILINODNADL-UHFFFAOYSA-N	0	3	336.892	3.372	20	30		EGEDHN
CN(C)CCOc1ccc(C=NNCCCc2ccccc2)cc1	ZINC000729145750	574818401	/nfs/dbraw/zinc/81/84/01/574818401.db2.gz	COXYWVCLCXBYKV-UHFFFAOYSA-N	0	3	325.456	3.183	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2cccc(OC(C)C)c2)CC1	ZINC000730026277	574907351	/nfs/dbraw/zinc/90/73/51/574907351.db2.gz	MSYYDVYLPAMGFX-UHFFFAOYSA-N	0	3	345.487	3.314	20	30		EGEDHN
C#CCN(C(=O)NC[C@H](C)N(C)Cc1ccccc1)C1CCCCC1	ZINC000732470079	575271430	/nfs/dbraw/zinc/27/14/30/575271430.db2.gz	QINQFINZWHCJIA-SFHVURJKSA-N	0	3	341.499	3.484	20	30		EGEDHN
C#CCOc1ccc(CNCc2ccc(C(=O)N3CCCC3)cc2)cc1	ZINC000733322185	575327599	/nfs/dbraw/zinc/32/75/99/575327599.db2.gz	BMZHEMJMHNCVCU-UHFFFAOYSA-N	0	3	348.446	3.224	20	30		EGEDHN
N#CC(C(=O)CCc1cscn1)C(=O)Nc1ccccc1Cl	ZINC000733679061	575381285	/nfs/dbraw/zinc/38/12/85/575381285.db2.gz	SQUHSEAVSFWOFF-LLVKDONJSA-N	0	3	333.800	3.077	20	30		EGEDHN
CC(N=Nc1cnnc2ccccc12)c1cccc(OCCN(C)C)c1	ZINC000733747155	575387727	/nfs/dbraw/zinc/38/77/27/575387727.db2.gz	HCDWPUDNULCXNI-UHFFFAOYSA-N	0	3	349.438	3.406	20	30		EGEDHN
Cc1ncc2c(n1)CCC[C@H]2NCc1ccc(N(C)CCC#N)cc1	ZINC000734851894	575560772	/nfs/dbraw/zinc/56/07/72/575560772.db2.gz	KUEVJMQGOMGFFT-LJQANCHMSA-N	0	3	335.455	3.302	20	30		EGEDHN
C#CCSCCNCC1=Cc2cc(Br)ccc2OC1	ZINC000740015046	576532433	/nfs/dbraw/zinc/53/24/33/576532433.db2.gz	RTIKPSTVOGFXCL-UHFFFAOYSA-N	0	3	338.270	3.181	20	30		EGEDHN
COc1ccc(C(C)=NNCC(F)F)cc1CN1CCCCC1	ZINC000740618265	576607377	/nfs/dbraw/zinc/60/73/77/576607377.db2.gz	MRVUKMOJRJKGLA-UHFFFAOYSA-N	0	3	325.403	3.260	20	30		EGEDHN
C#CCOc1ccc(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)cc1	ZINC000741565598	576701545	/nfs/dbraw/zinc/70/15/45/576701545.db2.gz	LDBNDIOYCZKONX-FQEVSTJZSA-N	0	3	348.446	3.093	20	30		EGEDHN
C#CCOc1ccc(F)cc1NC(=O)NC[C@H](C)N1CCC[C@@H](C)C1	ZINC000743201513	576803297	/nfs/dbraw/zinc/80/32/97/576803297.db2.gz	XAGKIYFCXFBAKJ-CABCVRRESA-N	0	3	347.434	3.080	20	30		EGEDHN
C#CCN(C[C@H](O)COc1ccc(OCC)cc1)C1CCCCC1	ZINC000744211495	576823128	/nfs/dbraw/zinc/82/31/28/576823128.db2.gz	TZWYBTRPRLSOFQ-SFHVURJKSA-N	0	3	331.456	3.093	20	30		EGEDHN
C#CCOc1ccc([C@@H](C)[NH2+][C@H](C)c2cccc(-c3nnn[n-]3)c2)cc1	ZINC000819709823	607085402	/nfs/dbraw/zinc/08/54/02/607085402.db2.gz	QOKIBDFVRVRIMX-HUUCEWRRSA-N	0	3	347.422	3.291	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)c2cc(C#N)ccc2F)CN1Cc1ccccc1	ZINC000830009985	1292652630	/nfs/dbraw/zinc/65/26/30/1292652630.db2.gz	KDSUFBDDWYCQRC-YOEHRIQHSA-N	0	3	337.398	3.090	20	30		EGEDHN
C=C(Br)CN(C)C1CCN(CCC(F)(F)F)CC1	ZINC000832778987	1293043929	/nfs/dbraw/zinc/04/39/29/1293043929.db2.gz	ROKLDKHUDRNVQT-UHFFFAOYSA-N	0	3	329.204	3.244	20	30		EGEDHN
CO[C@](C)(C(=O)C(C#N)c1nc2ccccc2n1C)c1ccccc1	ZINC000106982434	1293055458	/nfs/dbraw/zinc/05/54/58/1293055458.db2.gz	BSKIHZQJUCPCAU-YWZLYKJASA-N	0	3	333.391	3.311	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)[C@H](C)c1ccccc1F	ZINC000109038811	1293086056	/nfs/dbraw/zinc/08/60/56/1293086056.db2.gz	OUBNIDOCHZPDJT-OCCSQVGLSA-N	0	3	340.354	3.285	20	30		EGEDHN
C#CCN1CCC(C(=O)NCC(C)(C)CCCc2ccccc2)CC1	ZINC000113857648	1293158800	/nfs/dbraw/zinc/15/88/00/1293158800.db2.gz	VMPOARJPGXFULG-UHFFFAOYSA-N	0	3	340.511	3.497	20	30		EGEDHN
C=CCC[C@H](CO)[NH2+][C@@H](C)c1cc(Br)cc(C)c1[O-]	ZINC000834903961	1293171129	/nfs/dbraw/zinc/17/11/29/1293171129.db2.gz	LTTIWAWRELEHIV-WCQYABFASA-N	0	3	328.250	3.441	20	30		EGEDHN
C#CCOc1ccccc1CNC[C@H](O)c1ccc(OC(C)C)cc1	ZINC000116373529	1293204035	/nfs/dbraw/zinc/20/40/35/1293204035.db2.gz	VONVXCVSGQWDNW-FQEVSTJZSA-N	0	3	339.435	3.309	20	30		EGEDHN
Cc1ccccc1[C@@H](C)CC(=O)C(C#N)C(=O)NCCCOC(C)C	ZINC000116591927	1293208171	/nfs/dbraw/zinc/20/81/71/1293208171.db2.gz	XPTURKKOQIVGGM-FUHWJXTLSA-N	0	3	344.455	3.129	20	30		EGEDHN
C[C@H](COc1cccc(C#N)c1)OC(=O)c1cccc(CN(C)C)c1	ZINC000835161455	1293223090	/nfs/dbraw/zinc/22/30/90/1293223090.db2.gz	QLBRVJKEYQBQNJ-OAHLLOKOSA-N	0	3	338.407	3.244	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)Cc2c(F)cccc2F)cc1	ZINC000120026985	1293299464	/nfs/dbraw/zinc/29/94/64/1293299464.db2.gz	SHUQAXLIMHUOPK-OAHLLOKOSA-N	0	3	342.345	3.417	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)CCCc1nc(C2CC2)no1	ZINC000123804133	1293456643	/nfs/dbraw/zinc/45/66/43/1293456643.db2.gz	DIESRURDZXSONF-CYBMUJFWSA-N	0	3	349.394	3.033	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/[C@@H]2CCN(CC(F)(F)F)C2)c([O-])c1	ZINC000126704879	1293541915	/nfs/dbraw/zinc/54/19/15/1293541915.db2.gz	LEZKQEHEMUSDDZ-YVJZOELXSA-N	0	3	343.393	3.294	20	30		EGEDHN
CCc1ccccc1OCC(=O)C(C#N)C(=O)Nc1cccc(C)c1	ZINC000127665233	1293570435	/nfs/dbraw/zinc/57/04/35/1293570435.db2.gz	AIXHEMHDXDWJPV-KRWDZBQOSA-N	0	3	336.391	3.284	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)c2sc(C)nc2C)cc1	ZINC000128414385	1293592012	/nfs/dbraw/zinc/59/20/12/1293592012.db2.gz	QJUWEPMLEZJLLT-CQSZACIVSA-N	0	3	327.409	3.284	20	30		EGEDHN
COCCCC(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000129781243	1293634090	/nfs/dbraw/zinc/63/40/90/1293634090.db2.gz	UURMAXMEKSPZAF-JTQLQIEISA-N	0	3	329.183	3.067	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)CCC2CCCC2)cc1OC	ZINC000130029697	1293642858	/nfs/dbraw/zinc/64/28/58/1293642858.db2.gz	KZGAXGYPPFNUOF-OAHLLOKOSA-N	0	3	344.411	3.322	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)c2occc2C)cc1Cl	ZINC000130348527	1293653406	/nfs/dbraw/zinc/65/34/06/1293653406.db2.gz	BPFQOBWYXCJOKM-NSHDSACASA-N	0	3	332.743	3.211	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)C[C@@H](C)c1ccc(F)cc1F	ZINC000152188446	1293957495	/nfs/dbraw/zinc/95/74/95/1293957495.db2.gz	DPUKPFZPNHEADL-DOMZBBRYSA-N	0	3	336.382	3.474	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@@H](C)Oc1ccc(SC)cc1	ZINC000158679950	1294210691	/nfs/dbraw/zinc/21/06/91/1294210691.db2.gz	ULRATGVGYUQHIC-CJNGLKHVSA-N	0	3	348.468	3.191	20	30		EGEDHN
N#CC(C(=O)CC[C@@H]1CCOC1)C(=O)Nc1cccc2ccccc21	ZINC000176092468	1294590924	/nfs/dbraw/zinc/59/09/24/1294590924.db2.gz	KALBUSSCGOSTFT-PBHICJAKSA-N	0	3	336.391	3.304	20	30		EGEDHN
CC(C)c1cc(C(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)nn1C	ZINC000177596574	1294679080	/nfs/dbraw/zinc/67/90/80/1294679080.db2.gz	GDSFXWIMXXDJOX-CYBMUJFWSA-N	0	3	344.802	3.158	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)COc1ccc(Cl)c(C)c1	ZINC000193376936	1295858105	/nfs/dbraw/zinc/85/81/05/1295858105.db2.gz	GEGYGCYBDUQBPQ-AWEZNQCLSA-N	0	3	336.819	3.043	20	30		EGEDHN
N#CC(C(=O)Nc1cc(Cl)cc(Cl)c1)C(=O)c1cccnc1	ZINC000193480401	1295873933	/nfs/dbraw/zinc/87/39/33/1295873933.db2.gz	ODXOVZMLAFDSEG-ZDUSSCGKSA-N	0	3	334.162	3.350	20	30		EGEDHN
CC[C@H](C)c1ccc(NC(=O)C(C#N)C(=O)C[C@@H]2CCCO2)cc1	ZINC000193492707	1295877432	/nfs/dbraw/zinc/87/74/32/1295877432.db2.gz	QZONXRVNYMZEGY-JQFCIGGWSA-N	0	3	328.412	3.417	20	30		EGEDHN
CO[C@@H](C)CC(=O)C(C#N)C(=O)Nc1ccc(SC(F)F)cc1	ZINC000195491976	1296072521	/nfs/dbraw/zinc/07/25/21/1296072521.db2.gz	JEJFRXXYWQHIRN-CABZTGNLSA-N	0	3	342.367	3.074	20	30		EGEDHN
CC[C@H](C)c1ccc(NC(=O)C(C#N)C(=O)[C@H]2CCCOC2)cc1	ZINC000246098273	1296336569	/nfs/dbraw/zinc/33/65/69/1296336569.db2.gz	IZUBECNOLRJXNN-QRTARXTBSA-N	0	3	328.412	3.274	20	30		EGEDHN
C(=NOCCN1CCCCC1)c1cccc(OCc2ccncc2)c1	ZINC000588596066	1298090664	/nfs/dbraw/zinc/09/06/64/1298090664.db2.gz	QEEGOEQAEKCRRL-UHFFFAOYSA-N	0	3	339.439	3.497	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]\Cc2csc(N(C)C)n2)c([O-])c1	ZINC000746815543	1298664268	/nfs/dbraw/zinc/66/42/68/1298664268.db2.gz	KIYIIXWABRFPHK-ZDLGFXPLSA-N	0	3	332.473	3.380	20	30		EGEDHN
CN(C)CCN(CCCc1ccccc1)C(=O)C#Cc1ccccc1	ZINC000747212200	1298742679	/nfs/dbraw/zinc/74/26/79/1298742679.db2.gz	WYRJFIJFUKHHCU-UHFFFAOYSA-N	0	3	334.463	3.061	20	30		EGEDHN
C=C(Cl)C[C@@H](N)C(=O)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000876880356	1299047843	/nfs/dbraw/zinc/04/78/43/1299047843.db2.gz	IKELQVIUFBGAHF-MRXNPFEDSA-N	0	3	342.817	3.216	20	30		EGEDHN
C=C(Cl)C[C@@H](N)C(=O)N1CCC(c2c[nH]c3ccccc32)CC1	ZINC000876942282	1299079671	/nfs/dbraw/zinc/07/96/71/1299079671.db2.gz	TUTIOKDUKYUKJC-MRXNPFEDSA-N	0	3	331.847	3.344	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN2CC[C@@H](OCc3ccccn3)C2)cc1	ZINC000877645745	1299452828	/nfs/dbraw/zinc/45/28/28/1299452828.db2.gz	VGFGZIQCSIDOJA-OXJNMPFZSA-N	0	3	337.423	3.164	20	30		EGEDHN
CC(C)CN(CCC#N)C(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000751373417	1299543229	/nfs/dbraw/zinc/54/32/29/1299543229.db2.gz	GGHOVKUBJKQPGE-GOSISDBHSA-N	0	3	345.462	3.436	20	30		EGEDHN
CC[C@@H]1CN(C(C)=O)[C@H](CC)CN1CCCOc1ccc(C#N)cc1	ZINC000752090844	1299692894	/nfs/dbraw/zinc/69/28/94/1299692894.db2.gz	DKYJHDPOCKQXHJ-RTBURBONSA-N	0	3	343.471	3.048	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)C2CC(F)(F)C2)cc1Cl	ZINC000753800716	1300022003	/nfs/dbraw/zinc/02/20/03/1300022003.db2.gz	FFUALKDQPBCJHT-SNVBAGLBSA-N	0	3	342.729	3.041	20	30		EGEDHN
CCn1cc([C@@H](O)CN(Cc2ccccc2)CC2(CC#N)CC2)cn1	ZINC000878500612	1300038967	/nfs/dbraw/zinc/03/89/67/1300038967.db2.gz	BNJCZKPFOMSYCA-IBGZPJMESA-N	0	3	338.455	3.132	20	30		EGEDHN
C#CC[C@@H](NC(=O)NC[C@H](c1ccccc1)N(C)C)c1ccccc1	ZINC000757064708	1300628578	/nfs/dbraw/zinc/62/85/78/1300628578.db2.gz	MXNSJPPSQKJMBN-WOJBJXKFSA-N	0	3	335.451	3.353	20	30		EGEDHN
CCOC(=O)c1sc(C2CCN([C@H]3CC[C@@H](C#N)C3)CC2)nc1C	ZINC000879679274	1300672529	/nfs/dbraw/zinc/67/25/29/1300672529.db2.gz	JCJYGWFDAQEYBW-HIFRSBDPSA-N	0	3	347.484	3.500	20	30		EGEDHN
C[C@H](c1ccccc1)N1CCN(Cc2ccc(OCC#N)cc2)CC1	ZINC000880247878	1301002425	/nfs/dbraw/zinc/00/24/25/1301002425.db2.gz	NBPUEHMJGIDOIS-GOSISDBHSA-N	0	3	335.451	3.468	20	30		EGEDHN
C[C@H](c1ccc(C#N)cc1)N1CC[C@@H](N2CC(=O)Nc3ccccc32)C1	ZINC000759892055	1301184833	/nfs/dbraw/zinc/18/48/33/1301184833.db2.gz	FKHHDJVHCMIGFD-CRAIPNDOSA-N	0	3	346.434	3.152	20	30		EGEDHN
C#CCOc1ccccc1CNCc1cc(Cl)cc(OC)c1O	ZINC000761205382	1301420262	/nfs/dbraw/zinc/42/02/62/1301420262.db2.gz	BSJRQZRMIRCZAC-UHFFFAOYSA-N	0	3	331.799	3.356	20	30		EGEDHN
C#CCCc1noc([C@]2(C(F)(F)F)CCN(Cc3ccccc3)C2)n1	ZINC000762013180	1301589784	/nfs/dbraw/zinc/58/97/84/1301589784.db2.gz	BOMMGRLDWCBKIG-KRWDZBQOSA-N	0	3	349.356	3.341	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN[C@@H]2CCCOc3ccc(F)cc32)cc1	ZINC000763236742	1301854509	/nfs/dbraw/zinc/85/45/09/1301854509.db2.gz	SOROIYZXUWLJCZ-MSOLQXFVSA-N	0	3	326.371	3.234	20	30		EGEDHN
Cc1nc(C#N)cc(NC[C@@H](c2cccc(C(F)(F)F)c2)N(C)C)n1	ZINC000882197018	1301875284	/nfs/dbraw/zinc/87/52/84/1301875284.db2.gz	JOVFRSNLCWABIC-HNNXBMFYSA-N	0	3	349.360	3.390	20	30		EGEDHN
C#CCOc1cccc(NC(=O)[C@@H]2CCCCN2C2CCCC2)c1	ZINC000764506147	1302077693	/nfs/dbraw/zinc/07/76/93/1302077693.db2.gz	VPUOYPTVQDPHMV-IBGZPJMESA-N	0	3	326.440	3.434	20	30		EGEDHN
C=CC[C@@H](NC(=O)NC[C@H]1CCCCN1C1CC1)c1ccncc1	ZINC000765498890	1302273405	/nfs/dbraw/zinc/27/34/05/1302273405.db2.gz	JVXQEDLXVRXPPS-QZTJIDSGSA-N	0	3	328.460	3.015	20	30		EGEDHN
C=CC[C@H](NC(=O)NC[C@@H]1CCCCN1C1CC1)c1ccncc1	ZINC000765498894	1302273424	/nfs/dbraw/zinc/27/34/24/1302273424.db2.gz	JVXQEDLXVRXPPS-ROUUACIJSA-N	0	3	328.460	3.015	20	30		EGEDHN
Cc1cc(CN[C@@H]2CCCN(Cc3ccccc3)C2=O)ccc1C#N	ZINC000767684095	1302744678	/nfs/dbraw/zinc/74/46/78/1302744678.db2.gz	MGWWNMQXIAGASN-HXUWFJFHSA-N	0	3	333.435	3.148	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ncc(Cl)cc2Cl)C[C@H]1C	ZINC000947857166	1333281716	/nfs/dbraw/zinc/28/17/16/1333281716.db2.gz	HPJNPPQDROAGQQ-ZYHUDNBSSA-N	0	3	328.243	3.157	20	30		EGEDHN
CCC[N@H+](Cc1ccc(C#N)cc1)Cc1cc2c(cc1[O-])OC[C@H]2O	ZINC000768439037	1302900434	/nfs/dbraw/zinc/90/04/34/1302900434.db2.gz	FKPCXXYIAQFYFS-LJQANCHMSA-N	0	3	338.407	3.102	20	30		EGEDHN
CCC[N@@H+](Cc1ccc(C#N)cc1)Cc1cc2c(cc1[O-])OC[C@H]2O	ZINC000768439037	1302900447	/nfs/dbraw/zinc/90/04/47/1302900447.db2.gz	FKPCXXYIAQFYFS-LJQANCHMSA-N	0	3	338.407	3.102	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)Cc1cc2c(cc1O)OC[C@@H]2O	ZINC000768442816	1302904636	/nfs/dbraw/zinc/90/46/36/1302904636.db2.gz	OAMZQKMLBNZWAV-IBGZPJMESA-N	0	3	341.407	3.015	20	30		EGEDHN
C=CC[N@@H+](Cc1ccc(OC)cc1)Cc1cc2c(cc1[O-])OC[C@@H]2O	ZINC000768442816	1302904646	/nfs/dbraw/zinc/90/46/46/1302904646.db2.gz	OAMZQKMLBNZWAV-IBGZPJMESA-N	0	3	341.407	3.015	20	30		EGEDHN
C=CC[N@H+](Cc1ccc(OC)cc1)Cc1cc2c(cc1[O-])OC[C@@H]2O	ZINC000768442816	1302904652	/nfs/dbraw/zinc/90/46/52/1302904652.db2.gz	OAMZQKMLBNZWAV-IBGZPJMESA-N	0	3	341.407	3.015	20	30		EGEDHN
N#CC(C(=O)CCC(=O)c1ccccn1)c1ccc2ccccc2n1	ZINC000770842237	1303320952	/nfs/dbraw/zinc/32/09/52/1303320952.db2.gz	IBLBWBFCCJZBAD-OAHLLOKOSA-N	0	3	329.359	3.469	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]\C[C@@H]2COC3(CCCC3)O2)c([O-])c1	ZINC000773146804	1303633199	/nfs/dbraw/zinc/63/31/99/1303633199.db2.gz	CMMHWBMZRCZANG-SYERDGIWSA-N	0	3	332.444	3.343	20	30		EGEDHN
C#CC[C@@H](NCCCS(=O)(=O)c1ccc(F)cc1)c1ccccc1	ZINC000775405033	1303958621	/nfs/dbraw/zinc/95/86/21/1303958621.db2.gz	UAHXZEKYFSGGNG-LJQANCHMSA-N	0	3	345.439	3.344	20	30		EGEDHN
Cc1cccc(NC(=S)NN=Cc2cnccc2N(C)C)c1C	ZINC000776183958	1304108055	/nfs/dbraw/zinc/10/80/55/1304108055.db2.gz	UOXMVDBQWZMLDU-UHFFFAOYSA-N	0	3	327.457	3.085	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1Cl)C(=O)c1cccc(Cl)n1	ZINC000780306163	1304674977	/nfs/dbraw/zinc/67/49/77/1304674977.db2.gz	RJFWUABLDUITPA-SECBINFHSA-N	0	3	334.162	3.350	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(F)c(Cl)c1)C(=O)[C@H]1CCCCS1	ZINC000783353135	1305083065	/nfs/dbraw/zinc/08/30/65/1305083065.db2.gz	PLPIAORMCIEBFS-ZWNOBZJWSA-N	0	3	340.807	3.412	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)CCCc1ccsc1	ZINC000783353686	1305083232	/nfs/dbraw/zinc/08/32/32/1305083232.db2.gz	YLMWAVRIFAWBGX-CQSZACIVSA-N	0	3	342.420	3.427	20	30		EGEDHN
Cc1cc(CN2CCCN(Cc3ccc(C#N)cc3)CC2)cnc1F	ZINC000891540171	1305084193	/nfs/dbraw/zinc/08/41/93/1305084193.db2.gz	JQRXYLBWJHTLKI-UHFFFAOYSA-N	0	3	338.430	3.109	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(Cc3cnn(C4CCC4)c3)CC2)cc1	ZINC000891540273	1305084694	/nfs/dbraw/zinc/08/46/94/1305084694.db2.gz	JZEFLSSPAJEYGU-UHFFFAOYSA-N	0	3	349.482	3.188	20	30		EGEDHN
CS[C@H](C)CCC(=O)C(C#N)C(=O)NCc1cccc(Cl)c1	ZINC000786531292	1305591713	/nfs/dbraw/zinc/59/17/13/1305591713.db2.gz	OEBCLTLJFHHPBV-RISCZKNCSA-N	0	3	338.860	3.197	20	30		EGEDHN
C[C@@H](NC1(c2cccc(C#N)c2)CC1)c1ccc(N2CCNC2=O)cc1	ZINC000786888756	1305650562	/nfs/dbraw/zinc/65/05/62/1305650562.db2.gz	JVKIUHFKJWBVBH-OAHLLOKOSA-N	0	3	346.434	3.428	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]\Cc2cnc3n2CCCC3)c([O-])c1	ZINC000790575155	1306355125	/nfs/dbraw/zinc/35/51/25/1306355125.db2.gz	PHFXYQVFYFFHRC-NDENLUEZSA-N	0	3	326.444	3.390	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)COC2CCC(C)CC2)c1	ZINC000796633105	1310050707	/nfs/dbraw/zinc/05/07/07/1310050707.db2.gz	MNMYTSMDSDBALJ-QWFMPGPPSA-N	0	3	328.412	3.238	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(Cl)cc1)C(=O)[C@@H]1CCC(F)(F)C1	ZINC000796633745	1310052056	/nfs/dbraw/zinc/05/20/56/1310052056.db2.gz	RNIAPHLDIAUECH-SKDRFNHKSA-N	0	3	326.730	3.423	20	30		EGEDHN
CC(=O)N[C@H](C(=O)C(C#N)c1ncc(C(C)(C)C)s1)C1CCCC1	ZINC000797567239	1310212805	/nfs/dbraw/zinc/21/28/05/1310212805.db2.gz	DZCVLGQRYWAGJF-HIFRSBDPSA-N	0	3	347.484	3.312	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](CN(C)Cc3scnc3C)C2)CC1	ZINC000897478760	1310347811	/nfs/dbraw/zinc/34/78/11/1310347811.db2.gz	FDFPJZXVXGRVMN-INIZCTEOSA-N	0	3	347.528	3.478	20	30		EGEDHN
COc1ccc([C@H](NC(C)C)C(=O)NCC2CCC(C#N)CC2)cc1	ZINC000897659898	1310426013	/nfs/dbraw/zinc/42/60/13/1310426013.db2.gz	PPYDXKRAIRAQQB-RJYAGPCLSA-N	0	3	343.471	3.180	20	30		EGEDHN
COc1cc(CN2CCC(C#N)(c3ccccn3)CC2)c(O)cc1C	ZINC000799942650	1310641705	/nfs/dbraw/zinc/64/17/05/1310641705.db2.gz	FPPITNAHUXJZHG-UHFFFAOYSA-N	0	3	337.423	3.162	20	30		EGEDHN
N#Cc1ccc(N2CCN(CCc3ccc4ccccc4c3)CC2)cn1	ZINC000801552324	1310964274	/nfs/dbraw/zinc/96/42/74/1310964274.db2.gz	IAUQSLNFRSISFH-UHFFFAOYSA-N	0	3	342.446	3.471	20	30		EGEDHN
CCCC[N@H+](Cc1ccccc1[O-])[C@H](C)C(=O)N[C@@](C)(C#N)C(C)C	ZINC000801597516	1310970876	/nfs/dbraw/zinc/97/08/76/1310970876.db2.gz	JAYWPIUINYRPHA-UZLBHIALSA-N	0	3	345.487	3.437	20	30		EGEDHN
CCCC[N@@H+](Cc1ccccc1[O-])[C@H](C)C(=O)N[C@@](C)(C#N)C(C)C	ZINC000801597516	1310970887	/nfs/dbraw/zinc/97/08/87/1310970887.db2.gz	JAYWPIUINYRPHA-UZLBHIALSA-N	0	3	345.487	3.437	20	30		EGEDHN
CCCCN(CC(=O)N[C@@](C)(C#N)C(C)C)Cc1ccccc1O	ZINC000801598402	1310972399	/nfs/dbraw/zinc/97/23/99/1310972399.db2.gz	ZDHWPCMJTXHECA-IBGZPJMESA-N	0	3	331.460	3.049	20	30		EGEDHN
C[C@H](N[C@H]1CCc2ccccc2NC1=O)c1ccc(OCC#N)cc1	ZINC000839539408	1320935176	/nfs/dbraw/zinc/93/51/76/1320935176.db2.gz	MRKCHWRYVWTBCV-LIRRHRJNSA-N	0	3	335.407	3.193	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](NCc2cn(C(C)C)nc2C)C1	ZINC001019232329	1317114439	/nfs/dbraw/zinc/11/44/39/1317114439.db2.gz	VHHQCVGJCZNLTK-KRWDZBQOSA-N	0	3	332.492	3.065	20	30		EGEDHN
C#CCOc1ccc(C(=O)N(CCC)CCN2CCCCC2)cc1	ZINC000804567241	1317261521	/nfs/dbraw/zinc/26/15/21/1317261521.db2.gz	NKFOLVRXGPKSOV-UHFFFAOYSA-N	0	3	328.456	3.037	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@H](NCc2ccc(C#N)s2)C1)c1ccccc1	ZINC001019682025	1317329318	/nfs/dbraw/zinc/32/93/18/1317329318.db2.gz	KKFUUVZYXJQTHU-ZBFHGGJFSA-N	0	3	339.464	3.114	20	30		EGEDHN
C[C@@H]1CCC[C@H]1CC(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001020185757	1317580680	/nfs/dbraw/zinc/58/06/80/1317580680.db2.gz	BLEWJTKJDVNSMS-AETAKHFUSA-N	0	3	343.446	3.260	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@H](c2ccc(CC(C)C)cc2)N(C)C)c1	ZINC000807858435	1317592730	/nfs/dbraw/zinc/59/27/30/1317592730.db2.gz	JSZUSVXEXDQMEU-OAQYLSRUSA-N	0	3	349.478	3.294	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2oc3c(cccc3F)c2C)C1	ZINC001020240819	1317605098	/nfs/dbraw/zinc/60/50/98/1317605098.db2.gz	MLIDIZQQNALYFK-HAQNSBGRSA-N	0	3	336.794	3.483	20	30		EGEDHN
C#C[C@H](NC(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1)C(C)(C)C	ZINC000808243808	1317649920	/nfs/dbraw/zinc/64/99/20/1317649920.db2.gz	PPASRAYBUIJHMV-NXHRZFHOSA-N	0	3	327.472	3.169	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@@H]1C[C@@H](NCC1(C#N)CC1)C1CC1	ZINC000903106363	1317655175	/nfs/dbraw/zinc/65/51/75/1317655175.db2.gz	OKNNGBZURSPOHC-HZPDHXFCSA-N	0	3	333.476	3.448	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc(OC)c(C(C)C)c2)C1	ZINC001020356218	1317658216	/nfs/dbraw/zinc/65/82/16/1317658216.db2.gz	HHPMGXJTYUKWHZ-SHTZXODSSA-N	0	3	336.863	3.422	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)c2ccnc(C(F)(F)F)c2)c1	ZINC000808979471	1317756222	/nfs/dbraw/zinc/75/62/22/1317756222.db2.gz	IYQWBGDHFUUQQM-CYBMUJFWSA-N	0	3	347.296	3.370	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)Cc2ccc(F)cc2Cl)C1	ZINC001020544720	1317758024	/nfs/dbraw/zinc/75/80/24/1317758024.db2.gz	VZHHBKVZLVUYNV-JOCQHMNTSA-N	0	3	331.218	3.011	20	30		EGEDHN
C[C@H]1CCC[C@]1(C)C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001020555776	1317769429	/nfs/dbraw/zinc/76/94/29/1317769429.db2.gz	RGWAZDZRVZWEDY-FDRFZEDHSA-N	0	3	343.446	3.260	20	30		EGEDHN
C#Cc1ccc(CN2CC[C@](C)(CNC(=O)OC(C)(C)C)C2)cc1	ZINC000809662134	1317859452	/nfs/dbraw/zinc/85/94/52/1317859452.db2.gz	AWMIFVPLPGMXSH-HXUWFJFHSA-N	0	3	328.456	3.405	20	30		EGEDHN
CCN1CCN(c2ccc(NC(=O)c3ccsc3C#N)cc2)CC1	ZINC000905306898	1317947408	/nfs/dbraw/zinc/94/74/08/1317947408.db2.gz	OGPKGNFCXZYGFV-UHFFFAOYSA-N	0	3	340.452	3.014	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)[C@H]2C[C@]2(CC)C(C)C)C1	ZINC001020853562	1317956827	/nfs/dbraw/zinc/95/68/27/1317956827.db2.gz	RUXOXTHUCJWINC-IXYNUQLISA-N	0	3	343.309	3.204	20	30		EGEDHN
CC(C)[C@]1(C)C[C@H]1C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001020859653	1317967933	/nfs/dbraw/zinc/96/79/33/1317967933.db2.gz	CTJPMWKTAHKTSH-BOSXTWCSSA-N	0	3	343.446	3.116	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cnc(CC(C)(C)C)s2)C1	ZINC001020888839	1317985303	/nfs/dbraw/zinc/98/53/03/1317985303.db2.gz	JUSIPCHUEIDHDG-HAQNSBGRSA-N	0	3	341.908	3.335	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)/C=C/C2CC2)s1	ZINC000959937294	1318275839	/nfs/dbraw/zinc/27/58/39/1318275839.db2.gz	MLXQXAHWLRSXLI-PPYMECGQSA-N	0	3	329.469	3.057	20	30		EGEDHN
CC(C)c1cccc(CNC[C@@H]2CCCCN2C(=O)C#CC2CC2)n1	ZINC000960002808	1318307767	/nfs/dbraw/zinc/30/77/67/1318307767.db2.gz	IZEJCGRBFVBQSI-IBGZPJMESA-N	0	3	339.483	3.089	20	30		EGEDHN
O=C(C#CC1CC1)N1CCCC[C@H]1CNCc1cccc(Cl)c1F	ZINC000960003478	1318308847	/nfs/dbraw/zinc/30/88/47/1318308847.db2.gz	OMOQWVLHRCCUNC-INIZCTEOSA-N	0	3	348.849	3.363	20	30		EGEDHN
C[C@H](NC[C@@H]1CCCCN1C(=O)C#CC1CC1)c1ccc(F)cc1F	ZINC000960005794	1318309582	/nfs/dbraw/zinc/30/95/82/1318309582.db2.gz	BTCXNMCOUOZFGF-YOEHRIQHSA-N	0	3	346.421	3.410	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@H]2CN(Cc3cccc(C#N)c3)CC[C@H]21	ZINC001021505292	1318319573	/nfs/dbraw/zinc/31/95/73/1318319573.db2.gz	JSFDTUMBMBSHDM-VQTJNVASSA-N	0	3	339.483	3.417	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@H](CCCN3C(=O)c3cc[nH]c3)C2)cc1	ZINC001021587198	1318430751	/nfs/dbraw/zinc/43/07/51/1318430751.db2.gz	BAVHFSIQKKDFIF-WOJBJXKFSA-N	0	3	348.450	3.013	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1conc1C(C)C	ZINC000960271632	1318437609	/nfs/dbraw/zinc/43/76/09/1318437609.db2.gz	RLWCCVBXRBKIPD-IEBWSBKVSA-N	0	3	339.439	3.360	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(CCC)s2)C1	ZINC001021595515	1318439399	/nfs/dbraw/zinc/43/93/99/1318439399.db2.gz	ZHHUCJPZFUTJMA-RDJZCZTQSA-N	0	3	330.497	3.260	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@H](C)c1ccsc1	ZINC000960304844	1318452014	/nfs/dbraw/zinc/45/20/14/1318452014.db2.gz	AEFPDIGKJUOXRM-FSPWUOQZSA-N	0	3	326.465	3.409	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@H](C)c1ccccc1F	ZINC000960314161	1318456577	/nfs/dbraw/zinc/45/65/77/1318456577.db2.gz	KAUURVCGXFDGQB-JSNMRZPZSA-N	0	3	338.426	3.487	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cccc2[nH]cnc21	ZINC000960322167	1318459944	/nfs/dbraw/zinc/45/99/44/1318459944.db2.gz	ZDTOUHPBVWETEE-RTBURBONSA-N	0	3	346.434	3.124	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc3cc(C)ccc3n2)C1	ZINC001021627028	1318479003	/nfs/dbraw/zinc/47/90/03/1318479003.db2.gz	KJMRWRDKZJXLBB-RXVVDRJESA-N	0	3	347.462	3.103	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(Cl)ccc2F)C1	ZINC001021627300	1318479263	/nfs/dbraw/zinc/47/92/63/1318479263.db2.gz	NHBYKGYIGPAALY-KSSFIOAISA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(C)sc2C)C1	ZINC001021628017	1318480954	/nfs/dbraw/zinc/48/09/54/1318480954.db2.gz	RWCMPKVHFYQUHK-AEFFLSMTSA-N	0	3	330.497	3.315	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2cccc(C(F)F)c2)C1	ZINC001021633338	1318487362	/nfs/dbraw/zinc/48/73/62/1318487362.db2.gz	QINHUPHJYOZPQT-ZWKOTPCHSA-N	0	3	346.421	3.113	20	30		EGEDHN
COC[C@H](C)[C@@H](C)C(=O)C(C#N)C(=O)Nc1cccc2ccccc21	ZINC000813059518	1318493130	/nfs/dbraw/zinc/49/31/30/1318493130.db2.gz	BBYNRRHVPNNEKK-VBQJREDUSA-N	0	3	338.407	3.406	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc3cc(C)ccc3[nH]2)C1	ZINC001021647854	1318506056	/nfs/dbraw/zinc/50/60/56/1318506056.db2.gz	GYONPDGHYSVMDQ-DYESRHJHSA-N	0	3	349.478	3.426	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2cc(C)ccc2C)C1	ZINC001021661817	1318526171	/nfs/dbraw/zinc/52/61/71/1318526171.db2.gz	RSACPPKUYPEIAC-PZJWPPBQSA-N	0	3	338.495	3.182	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc3occc3s2)C1	ZINC001021667060	1318529144	/nfs/dbraw/zinc/52/91/44/1318529144.db2.gz	FSUHUDUBSJQOQX-HUUCEWRRSA-N	0	3	342.464	3.444	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(F)cc(Cl)c2)C1	ZINC001021678583	1318547622	/nfs/dbraw/zinc/54/76/22/1318547622.db2.gz	YYJZABUYPNMDRG-CXAGYDPISA-N	0	3	334.822	3.039	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)CC(C)(C)C	ZINC000960428429	1318551032	/nfs/dbraw/zinc/55/10/32/1318551032.db2.gz	NYLJILCXPJWLPM-GOSISDBHSA-N	0	3	327.472	3.417	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc3nc(C)ccc3c2)C1	ZINC001021697050	1318571605	/nfs/dbraw/zinc/57/16/05/1318571605.db2.gz	NMMDDQOBSYDKHB-TZIWHRDSSA-N	0	3	347.462	3.103	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC[C@H]1CN(C)Cc1ccc(OC)c(C#N)c1	ZINC000960452251	1318573779	/nfs/dbraw/zinc/57/37/79/1318573779.db2.gz	SBZFYMCZXFVRPG-QAPCUYQASA-N	0	3	343.471	3.036	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)[C@H]2CC[C@H](C(C)C)CC2)C1	ZINC001021701940	1318574308	/nfs/dbraw/zinc/57/43/08/1318574308.db2.gz	DMAKPQAIAJYKOB-UAFMIMERSA-N	0	3	330.516	3.395	20	30		EGEDHN
C/C(=C\C(=O)N1CCC[C@@H]1CN(C)Cc1ccc(C#N)cc1)C1CC1	ZINC000960465430	1318583690	/nfs/dbraw/zinc/58/36/90/1318583690.db2.gz	LXKHOWDKDAKIMW-ZRNYNZGJSA-N	0	3	337.467	3.337	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2coc3ccc(F)cc32)C1	ZINC001021725314	1318616861	/nfs/dbraw/zinc/61/68/61/1318616861.db2.gz	RLZTZDGPLBBNHT-KBXCAEBGSA-N	0	3	340.398	3.132	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccsc2C(F)F)C1	ZINC001021724929	1318617132	/nfs/dbraw/zinc/61/71/32/1318617132.db2.gz	PJDIFAXHOOFYKK-GXTWGEPZSA-N	0	3	338.423	3.245	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2c[nH]c3ccc(C)cc23)C1	ZINC001021738675	1318645757	/nfs/dbraw/zinc/64/57/57/1318645757.db2.gz	CPHFIVPBHYHLOQ-DYESRHJHSA-N	0	3	349.478	3.426	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc3cccc(F)c3o2)C1	ZINC001021740980	1318650680	/nfs/dbraw/zinc/65/06/80/1318650680.db2.gz	XTUNATGCWFYFMA-RDJZCZTQSA-N	0	3	340.398	3.132	20	30		EGEDHN
CC1CC(C(=O)N2CCC[C@H]2CN(C)Cc2ccc(C#N)cc2)C1	ZINC000960533706	1318653132	/nfs/dbraw/zinc/65/31/32/1318653132.db2.gz	IMSDCMNRXGGDCM-PPSBMQLTSA-N	0	3	325.456	3.027	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)CC(C)(C)c2ccccc2)C1	ZINC001021743965	1318659998	/nfs/dbraw/zinc/65/99/98/1318659998.db2.gz	STLGYTORMONRJO-UYAOXDASSA-N	0	3	338.495	3.300	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cnc(C(C)C)s2)C1	ZINC001021746333	1318663360	/nfs/dbraw/zinc/66/33/60/1318663360.db2.gz	KRQAGCDQZQRWBA-HZPDHXFCSA-N	0	3	345.512	3.216	20	30		EGEDHN
Cc1ccccc1C(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001021787943	1318683618	/nfs/dbraw/zinc/68/36/18/1318683618.db2.gz	LOVHSSGKZSFBOA-CALCHBBNSA-N	0	3	337.398	3.056	20	30		EGEDHN
Cc1cccc(C(=O)N[C@H]2C[C@@H](NCc3ccc(C#N)cc3F)C2)c1	ZINC001021800900	1318692434	/nfs/dbraw/zinc/69/24/34/1318692434.db2.gz	KNMZCJBZGMATLB-HDICACEKSA-N	0	3	337.398	3.056	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)Nc1ccc(C(=O)N(C)C)cc1	ZINC000912039485	1318797605	/nfs/dbraw/zinc/79/76/05/1318797605.db2.gz	GWHWAJASQNPSHB-QGZVFWFLSA-N	0	3	333.476	3.405	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccc(Sc2nccn2C)cc1	ZINC000912172243	1318837052	/nfs/dbraw/zinc/83/70/52/1318837052.db2.gz	UHUVZQBHDBPNIS-OAHLLOKOSA-N	0	3	330.457	3.193	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@H]2CCC[C@H](C(F)(F)F)C2)C1	ZINC001022343537	1318900386	/nfs/dbraw/zinc/90/03/86/1318900386.db2.gz	PISKDCDCTFXZJP-ZDEQEGDKSA-N	0	3	338.801	3.344	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H]1CN(C)Cc1ccc(CO)cc1	ZINC000960828125	1318954566	/nfs/dbraw/zinc/95/45/66/1318954566.db2.gz	RMSNYEQGZNNKEE-CTNGQTDRSA-N	0	3	344.499	3.204	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@H]1CN(C)Cc1cccc(C#N)c1	ZINC000960894298	1319032774	/nfs/dbraw/zinc/03/27/74/1319032774.db2.gz	HUNKTVYWOYCIJO-CEXWTWQISA-N	0	3	325.456	3.027	20	30		EGEDHN
C[C@H]1CCC[C@]1(C)C(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001022667280	1319057790	/nfs/dbraw/zinc/05/77/90/1319057790.db2.gz	XGFQJNNEQUEYSD-NYYTWLDWSA-N	0	3	343.446	3.260	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)[C@@H]1CCC[C@@H](OC)C1)c1ccccc1	ZINC000816038851	1319091863	/nfs/dbraw/zinc/09/18/63/1319091863.db2.gz	ISAPYRMEEPOVMX-TVFCKZIOSA-N	0	3	342.439	3.168	20	30		EGEDHN
Cc1cc(C(=O)N[C@H]2C[C@@H](NCc3ccc(C#N)cc3F)C2)cs1	ZINC001022853620	1319137538	/nfs/dbraw/zinc/13/75/38/1319137538.db2.gz	JLZKMWBKVOVQAS-IYBDPMFKSA-N	0	3	343.427	3.118	20	30		EGEDHN
CC(C)[C@]1(C)C[C@@H]1C(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001022917168	1319169206	/nfs/dbraw/zinc/16/92/06/1319169206.db2.gz	QXLFELFJVALJMN-YZLZLFLDSA-N	0	3	343.446	3.116	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc(C)nc3ccccc32)C1	ZINC001023054201	1319241340	/nfs/dbraw/zinc/24/13/40/1319241340.db2.gz	ZCIJATOQXZPEOI-OKILXGFUSA-N	0	3	329.831	3.146	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@H]([C@@H]2CCN(Cc3ccccc3C#N)C2)C1	ZINC000961132643	1319247637	/nfs/dbraw/zinc/24/76/37/1319247637.db2.gz	FEUJHMQVDRWYGQ-VQTJNVASSA-N	0	3	339.483	3.275	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)c2sccc2CC)C1	ZINC001023126206	1319274009	/nfs/dbraw/zinc/27/40/09/1319274009.db2.gz	MONWTNZDKLLLEQ-TXEJJXNPSA-N	0	3	343.290	3.070	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]([C@@H]2CCN(Cc3ccns3)C2)C1	ZINC000961233313	1319365158	/nfs/dbraw/zinc/36/51/58/1319365158.db2.gz	VZTSYBQWIIEJBM-HZPDHXFCSA-N	0	3	347.528	3.416	20	30		EGEDHN
C=CC[C@H](CO)CN[C@H](c1nc(Br)cs1)C1CC1	ZINC000817581224	1319403966	/nfs/dbraw/zinc/40/39/66/1319403966.db2.gz	QRJKYUYAAZMRKL-CABZTGNLSA-N	0	3	331.279	3.131	20	30		EGEDHN
N#Cc1c[nH]c(C(=O)NC[C@H]2CCCN(C/C=C\c3ccccc3)C2)c1	ZINC001023296496	1319423605	/nfs/dbraw/zinc/42/36/05/1319423605.db2.gz	YQRGLZBSPDNOGI-MPYGFJLXSA-N	0	3	348.450	3.042	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](C2CCN(C(=O)c3ccc[nH]3)CC2)C1	ZINC000961320499	1319477445	/nfs/dbraw/zinc/47/74/45/1319477445.db2.gz	DFVSWYGSMJYUKJ-MRXNPFEDSA-N	0	3	335.879	3.331	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N1CCC[C@@H]1c1ccccc1C(F)(F)F	ZINC000818109452	1319501859	/nfs/dbraw/zinc/50/18/59/1319501859.db2.gz	CPIXJISCPLOGSO-LSDHHAIUSA-N	0	3	339.361	3.390	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](C2CCN(C(=O)c3ccn(C)c3)CC2)C1	ZINC000961347968	1319504117	/nfs/dbraw/zinc/50/41/17/1319504117.db2.gz	BXXOPKLMTAPXJO-QGZVFWFLSA-N	0	3	349.906	3.342	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc3ccccc3nc2C)C1	ZINC001023402016	1319508586	/nfs/dbraw/zinc/50/85/86/1319508586.db2.gz	DBHODAZYUIGZNT-QGZVFWFLSA-N	0	3	335.451	3.008	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](C2CCN(C(=O)[C@@H](F)CC)CC2)C1	ZINC000961400379	1319555191	/nfs/dbraw/zinc/55/51/91/1319555191.db2.gz	IZGLJCMPIXFLKI-CVEARBPZSA-N	0	3	330.875	3.438	20	30		EGEDHN
C=CCN1CCC[C@H](CNC(=O)c2cc(-c3cccs3)on2)C1	ZINC001023511939	1319616593	/nfs/dbraw/zinc/61/65/93/1319616593.db2.gz	BTVNZILEHMHCFX-CYBMUJFWSA-N	0	3	331.441	3.031	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc(C)c(Cl)cc2C)C1	ZINC001023524849	1319631492	/nfs/dbraw/zinc/63/14/92/1319631492.db2.gz	CKTHOXVWXAWKCB-INIZCTEOSA-N	0	3	332.875	3.422	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCCN(Cc3ccsc3)C2)cc1	ZINC001023527605	1319634648	/nfs/dbraw/zinc/63/46/48/1319634648.db2.gz	YQAFRKQWZAYPBI-KRWDZBQOSA-N	0	3	338.476	3.371	20	30		EGEDHN
CCCCCn1cc(CNC[C@@H](O)c2ccc(C#N)cc2)c(C)n1	ZINC000819201256	1319666699	/nfs/dbraw/zinc/66/66/99/1319666699.db2.gz	KZGMHOSHVWFGQW-LJQANCHMSA-N	0	3	326.444	3.077	20	30		EGEDHN
C=CCN1CCC[C@@H](CNC(=O)c2c(F)ccc(F)c2Cl)C1	ZINC001023608733	1319722173	/nfs/dbraw/zinc/72/21/73/1319722173.db2.gz	FAUNETPVCBCPGE-NSHDSACASA-N	0	3	328.790	3.246	20	30		EGEDHN
C=CCNC(=O)C(C#N)C(=O)CCCOc1cccc2ccccc21	ZINC000916921679	1319726756	/nfs/dbraw/zinc/72/67/56/1319726756.db2.gz	WVDCMGGYWUMKRA-KRWDZBQOSA-N	0	3	336.391	3.010	20	30		EGEDHN
N#Cc1ccc(NC(=O)NC[C@H]2CCCCN2C2CC2)c(Cl)c1	ZINC000930433802	1328853684	/nfs/dbraw/zinc/85/36/84/1328853684.db2.gz	CMWIUTIRRFBWBY-CQSZACIVSA-N	0	3	332.835	3.350	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc(C)c(C)c2Cl)C1	ZINC001023700276	1319829764	/nfs/dbraw/zinc/82/97/64/1319829764.db2.gz	LSBLCFFWDSSXIR-MRXNPFEDSA-N	0	3	332.875	3.422	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc(CC(C)C)cc2)C1	ZINC001023740727	1319887092	/nfs/dbraw/zinc/88/70/92/1319887092.db2.gz	LPMKJGTZMBWQGI-LJQANCHMSA-N	0	3	326.484	3.350	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)[C@@H]2CCCCc3ccccc32)C1	ZINC001023764342	1319910585	/nfs/dbraw/zinc/91/05/85/1319910585.db2.gz	BAVAHLBLYDFSPJ-WIYYLYMNSA-N	0	3	338.495	3.348	20	30		EGEDHN
C#CCNC(=O)[C@H](C)N[C@H](Cc1ccc(Cl)cc1)c1ccccc1	ZINC000918198467	1319932727	/nfs/dbraw/zinc/93/27/27/1319932727.db2.gz	KOYBLHHXTCNLBT-HNAYVOBHSA-N	0	3	340.854	3.351	20	30		EGEDHN
CC(C)(C)CC(=O)N1CCC[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001023840751	1319981719	/nfs/dbraw/zinc/98/17/19/1319981719.db2.gz	ISIQQINEUGZHGC-OAHLLOKOSA-N	0	3	345.462	3.462	20	30		EGEDHN
C=CC(C)(C)CNC(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000840794815	1321149308	/nfs/dbraw/zinc/14/93/08/1321149308.db2.gz	NQJFITQXGNNMNS-UHFFFAOYSA-N	0	3	331.529	3.327	20	30		EGEDHN
CC1(C)OCC[C@@H]1NN=C1CCN(C2CC2)[C@@H](c2ccccc2)C1	ZINC000841641848	1321290694	/nfs/dbraw/zinc/29/06/94/1321290694.db2.gz	XGFICTMHDMGVMN-MOPGFXCFSA-N	0	3	327.472	3.499	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1	ZINC000842284463	1321367437	/nfs/dbraw/zinc/36/74/37/1321367437.db2.gz	KRXZBEWNUIDVPD-RCCFBDPRSA-N	0	3	337.423	3.067	20	30		EGEDHN
CC[C@@H](OC1CCCC1)C(=O)C(C#N)C(=O)NCc1cccc(C)c1	ZINC000842344050	1321375650	/nfs/dbraw/zinc/37/56/50/1321375650.db2.gz	XCMLCQZPIMRPOH-ZWKOTPCHSA-N	0	3	342.439	3.058	20	30		EGEDHN
Cc1ccc([C@@H](C)NCC#CCN2C(=O)c3ccccc3C2=O)s1	ZINC000859249144	1328954877	/nfs/dbraw/zinc/95/48/77/1328954877.db2.gz	SYTGMBXHBXLOSQ-CQSZACIVSA-N	0	3	338.432	3.007	20	30		EGEDHN
C[C@@H](NC(=O)c1cccs1)C(=O)C(C#N)c1nc(C2CC2)cs1	ZINC000842938172	1321451418	/nfs/dbraw/zinc/45/14/18/1321451418.db2.gz	IYIGMYQMJGYHBX-KOLCDFICSA-N	0	3	345.449	3.077	20	30		EGEDHN
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@H](NCC3(C#N)CCC3)C[C@@H]2C1	ZINC000843413318	1321513975	/nfs/dbraw/zinc/51/39/75/1321513975.db2.gz	LCXUWBBRWJOICQ-ARFHVFGLSA-N	0	3	333.476	3.305	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2snc(Cl)c2Cl)CC1	ZINC000845448653	1321709105	/nfs/dbraw/zinc/70/91/05/1321709105.db2.gz	LBZYDOQPYHNHFP-UHFFFAOYSA-N	0	3	334.272	3.220	20	30		EGEDHN
N#CC(C(=O)CCCc1ccc(F)cc1)C(=O)NCc1ccccc1	ZINC000847623222	1321884943	/nfs/dbraw/zinc/88/49/43/1321884943.db2.gz	GLAPHCGUAUFWSF-SFHVURJKSA-N	0	3	338.382	3.174	20	30		EGEDHN
CS[C@@H](C)C(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847745350	1321899749	/nfs/dbraw/zinc/89/97/49/1321899749.db2.gz	HKIPXLMEHIITSP-HNNXBMFYSA-N	0	3	332.469	3.087	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)Cc2cc3ccccc3o2)cc1	ZINC000920112184	1322138074	/nfs/dbraw/zinc/13/80/74/1322138074.db2.gz	XVVHRCYGLATNBC-QGZVFWFLSA-N	0	3	348.358	3.331	20	30		EGEDHN
CC(=O)N[C@@H](CCC(C)C)C(=O)C(C#N)c1nc(C(C)C)cs1	ZINC000850872819	1322304753	/nfs/dbraw/zinc/30/47/53/1322304753.db2.gz	GNFQOHNIIXXZQF-KGLIPLIRSA-N	0	3	335.473	3.384	20	30		EGEDHN
CC[C@@H](C)[C@](C)(O)CNCc1cc(C#N)ccc1Br	ZINC000921732523	1322386344	/nfs/dbraw/zinc/38/63/44/1322386344.db2.gz	LCHHSYLOXUDJHV-IAQYHMDHSA-N	0	3	325.250	3.207	20	30		EGEDHN
CCOC(=O)c1c[nH]nc1[C@@H]1CCN([C@@H](C)c2cccc(C#N)c2)C1	ZINC000931009834	1329027764	/nfs/dbraw/zinc/02/77/64/1329027764.db2.gz	IWSPXMUURHVXKJ-XJKSGUPXSA-N	0	3	338.411	3.009	20	30		EGEDHN
C=CCOc1ccc(CN[C@H](c2cnn(C)c2)C(C)C)cc1OC	ZINC000922891520	1322642525	/nfs/dbraw/zinc/64/25/25/1322642525.db2.gz	JIOZTONCHUKYDH-IBGZPJMESA-N	0	3	329.444	3.480	20	30		EGEDHN
C[C@@H](C(=O)NC1CC(CNCc2ccccc2C#N)C1)c1ccccc1	ZINC000962562652	1323008258	/nfs/dbraw/zinc/00/82/58/1323008258.db2.gz	YJDHZMXIBCYYAO-ZGGTZUKQSA-N	0	3	347.462	3.346	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC[C@H](CNCc2ocnc2C)C1	ZINC001024002389	1323072453	/nfs/dbraw/zinc/07/24/53/1323072453.db2.gz	CCLYNURTGWZSST-CQSZACIVSA-N	0	3	339.867	3.090	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H](CNCc2ccccc2C#N)C1	ZINC001024090765	1323122594	/nfs/dbraw/zinc/12/25/94/1323122594.db2.gz	QARMDEWMYKFJRH-KRWDZBQOSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](CNCc2ccn(C(C)C)n2)C1	ZINC001024092879	1323123797	/nfs/dbraw/zinc/12/37/97/1323123797.db2.gz	KJSFGMYFUKYDGR-INIZCTEOSA-N	0	3	332.492	3.004	20	30		EGEDHN
C#C[C@@](C)(CC)NCC(=O)N[C@@H](C)c1ccc(Br)cc1	ZINC000852098929	1323145896	/nfs/dbraw/zinc/14/58/96/1323145896.db2.gz	ZKCNPPQHUDEHMY-LRDDRELGSA-N	0	3	337.261	3.018	20	30		EGEDHN
C#C[C@](C)(CC)N[C@H](C)C(=O)N(C)Cc1nc2ccccc2s1	ZINC000852101350	1323147635	/nfs/dbraw/zinc/14/76/35/1323147635.db2.gz	PKKGVTHNEWKHPU-FZKQIMNGSA-N	0	3	329.469	3.035	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@H](CNCc3cc(C)no3)C2)CC1	ZINC001024132750	1323155688	/nfs/dbraw/zinc/15/56/88/1323155688.db2.gz	DUJSXLYPUBTDOW-MRXNPFEDSA-N	0	3	331.460	3.058	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@H](CNCc3ocnc3C)C2)CC1	ZINC001024133217	1323157585	/nfs/dbraw/zinc/15/75/85/1323157585.db2.gz	JONSVPWOLHLUDT-MRXNPFEDSA-N	0	3	331.460	3.058	20	30		EGEDHN
C=CCN(C[C@H](O)c1ccccc1Br)[C@H](C)COC	ZINC000852356446	1323182150	/nfs/dbraw/zinc/18/21/50/1323182150.db2.gz	FFJPAMOSERAZCU-DOMZBBRYSA-N	0	3	328.250	3.005	20	30		EGEDHN
C[C@@H](C(=O)N(C)C1CCC(NCc2ccccc2C#N)CC1)C1CC1	ZINC000963201161	1323229238	/nfs/dbraw/zinc/22/92/38/1323229238.db2.gz	IHOBVJNQPTWZPN-APMMTJHUSA-N	0	3	339.483	3.464	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)c2cccn2C)C1	ZINC000963258079	1323266209	/nfs/dbraw/zinc/26/62/09/1323266209.db2.gz	CAYZLCSEZTUHHK-CVEARBPZSA-N	0	3	335.879	3.094	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)c2ncoc2C)C1	ZINC000963269150	1323283011	/nfs/dbraw/zinc/28/30/11/1323283011.db2.gz	BFPJHRYZXVNQNO-LSDHHAIUSA-N	0	3	337.851	3.052	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1cncc(-c2ccccc2)c1	ZINC001024467543	1323423247	/nfs/dbraw/zinc/42/32/47/1323423247.db2.gz	GLKBNTKVUZKUMK-OAQYLSRUSA-N	0	3	347.462	3.356	20	30		EGEDHN
C=CCN1CCCC[C@@H]1CNC(=O)c1cn(C)c2ccc(F)cc12	ZINC001024479158	1323431166	/nfs/dbraw/zinc/43/11/66/1323431166.db2.gz	APSRDFRJLYYZCI-OAHLLOKOSA-N	0	3	329.419	3.088	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cc(C)n([C@H](C)C2CC2)n1	ZINC001024518007	1323467139	/nfs/dbraw/zinc/46/71/39/1323467139.db2.gz	DYMXZRBUMFZAOO-SJLPKXTDSA-N	0	3	344.503	3.323	20	30		EGEDHN
C=CCCN1CCCC[C@@H]1CNC(=O)c1scnc1C(F)F	ZINC001024549448	1323491806	/nfs/dbraw/zinc/49/18/06/1323491806.db2.gz	WAYSPXLOBPVJQQ-LLVKDONJSA-N	0	3	329.416	3.241	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@H]1COc2cc(C)c(C)cc21	ZINC001024576265	1323514090	/nfs/dbraw/zinc/51/40/90/1323514090.db2.gz	QHGOPPRCOOOFOI-MJGOQNOKSA-N	0	3	342.483	3.326	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccccc1-n1cccn1	ZINC001024673403	1323587429	/nfs/dbraw/zinc/58/74/29/1323587429.db2.gz	LLKRXKCHGYMRNS-QGZVFWFLSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccc(C)nc1OCCC	ZINC001024733898	1323635156	/nfs/dbraw/zinc/63/51/56/1323635156.db2.gz	QCVWKHGNRFEGHT-KRWDZBQOSA-N	0	3	345.487	3.339	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1c[nH]nc1-c1ccsc1	ZINC001024734720	1323636077	/nfs/dbraw/zinc/63/60/77/1323636077.db2.gz	ZFJUKOJJBIUKIH-HNNXBMFYSA-N	0	3	344.484	3.299	20	30		EGEDHN
C=C(Cl)CN1CCCC[C@@H]1CNC(=O)c1cccc2nc(C)[nH]c21	ZINC001024748621	1323651675	/nfs/dbraw/zinc/65/16/75/1323651675.db2.gz	LGQFAYLIVUDJLU-CQSZACIVSA-N	0	3	346.862	3.208	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCCC[C@H]1CNCc1ncccc1C	ZINC001025070279	1323872366	/nfs/dbraw/zinc/87/23/66/1323872366.db2.gz	WYGYHCWQHIKGDW-FXAWDEMLSA-N	0	3	329.488	3.463	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1oc(C)cc1C	ZINC001025215757	1324007866	/nfs/dbraw/zinc/00/78/66/1324007866.db2.gz	CIZYZESWFAFUNP-ROUUACIJSA-N	0	3	328.456	3.379	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(C)cc(C)n1	ZINC001025245702	1324044885	/nfs/dbraw/zinc/04/48/85/1324044885.db2.gz	PEGUVVOCJVVOEX-PMACEKPBSA-N	0	3	339.483	3.181	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(OCC)no1	ZINC001025252409	1324057483	/nfs/dbraw/zinc/05/74/83/1324057483.db2.gz	OMOYFTOZLKUZTK-CVEARBPZSA-N	0	3	347.459	3.109	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(C2CC2)on1	ZINC001025254588	1324061733	/nfs/dbraw/zinc/06/17/33/1324061733.db2.gz	LEMOZJOJQALFAC-IAGOWNOFSA-N	0	3	329.444	3.197	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)C1(c2cc(C)no2)CC1	ZINC001025259488	1324069607	/nfs/dbraw/zinc/06/96/07/1324069607.db2.gz	NWNVIQFOMYXMKL-SJORKVTESA-N	0	3	343.471	3.046	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc2ccccc2n1C	ZINC001025261899	1324073430	/nfs/dbraw/zinc/07/34/30/1324073430.db2.gz	ZAHHOYLNQJJZNK-VQTJNVASSA-N	0	3	349.478	3.271	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccn(CC)c1C	ZINC001025263599	1324075064	/nfs/dbraw/zinc/07/50/64/1324075064.db2.gz	OMUPIZQLAAWCOZ-WOJBJXKFSA-N	0	3	341.499	3.299	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccncc1Cl	ZINC001025270970	1324086486	/nfs/dbraw/zinc/08/64/86/1324086486.db2.gz	FOMNDGPJUANPCK-IAGOWNOFSA-N	0	3	333.863	3.380	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc(C)nc1OC	ZINC001025277800	1324099610	/nfs/dbraw/zinc/09/96/10/1324099610.db2.gz	PQYZEFDYPUJKJQ-ROUUACIJSA-N	0	3	343.471	3.044	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(CCC)on1	ZINC001025283876	1324104630	/nfs/dbraw/zinc/10/46/30/1324104630.db2.gz	BYIYENYOMUDZEA-ROUUACIJSA-N	0	3	331.460	3.272	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1coc(CCC)n1	ZINC001025288197	1324111384	/nfs/dbraw/zinc/11/13/84/1324111384.db2.gz	JJNZCUIJGZZHEE-QZTJIDSGSA-N	0	3	343.471	3.110	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)Cc1c[nH]c2ccccc12	ZINC001025293674	1324121509	/nfs/dbraw/zinc/12/15/09/1324121509.db2.gz	UFFUMNHKRPDHAI-LEWJYISDSA-N	0	3	349.478	3.189	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)C1(c2ccccc2)CC1	ZINC001025295453	1324125845	/nfs/dbraw/zinc/12/58/45/1324125845.db2.gz	FZUQDJFPQCIXQO-UXHICEINSA-N	0	3	336.479	3.197	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)Cc1ccc(C)c(C)c1	ZINC001025298249	1324131558	/nfs/dbraw/zinc/13/15/58/1324131558.db2.gz	VNGPJXKXPHOIMC-RTWAWAEBSA-N	0	3	338.495	3.325	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc3ccccc3nc2C)C1	ZINC001025432208	1324270134	/nfs/dbraw/zinc/27/01/34/1324270134.db2.gz	GXJDJMZXMPCBKW-CRAIPNDOSA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(F)cc3ccoc32)C1	ZINC001025465876	1324311007	/nfs/dbraw/zinc/31/10/07/1324311007.db2.gz	WVVSJXMSDBAOMG-GDBMZVCRSA-N	0	3	342.414	3.426	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(C)cc(OC)c2C)C1	ZINC001025472185	1324317571	/nfs/dbraw/zinc/31/75/71/1324317571.db2.gz	NXXRZKQBWPBMDQ-QZTJIDSGSA-N	0	3	342.483	3.166	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cn(C)c3ccccc23)C1	ZINC001025480131	1324325851	/nfs/dbraw/zinc/32/58/51/1324325851.db2.gz	QEZGZLXOTRMXLL-DLBZAZTESA-N	0	3	337.467	3.032	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cn(C)c3ccccc23)C1	ZINC001025480132	1324326577	/nfs/dbraw/zinc/32/65/77/1324326577.db2.gz	QEZGZLXOTRMXLL-IAGOWNOFSA-N	0	3	337.467	3.032	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc3cscc3s2)C1	ZINC001025484274	1324332266	/nfs/dbraw/zinc/33/22/66/1324332266.db2.gz	BNCUWMVWTJZRSZ-STQMWFEESA-N	0	3	332.494	3.426	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc3c(o2)c(F)ccc3C)C1	ZINC001025487136	1324337842	/nfs/dbraw/zinc/33/78/42/1324337842.db2.gz	BATVRBMSTASSQN-HUUCEWRRSA-N	0	3	342.414	3.344	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2csc3ccccc23)C1	ZINC001025495928	1324347809	/nfs/dbraw/zinc/34/78/09/1324347809.db2.gz	LIMRGWDEHJVJFO-LSDHHAIUSA-N	0	3	326.465	3.365	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc3nc(C)ccc3c2)C1	ZINC001025564977	1324411133	/nfs/dbraw/zinc/41/11/33/1324411133.db2.gz	OBXSHFVSAUDGFV-LPHOPBHVSA-N	0	3	335.451	3.007	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc3nc(C)ccc3c2)C1	ZINC001025564979	1324411143	/nfs/dbraw/zinc/41/11/43/1324411143.db2.gz	OBXSHFVSAUDGFV-VQIMIIECSA-N	0	3	335.451	3.007	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cccc(C(C)(C)C)c2)C1	ZINC001025576609	1324415401	/nfs/dbraw/zinc/41/54/01/1324415401.db2.gz	LMMZEMGEAQOUJV-FUHWJXTLSA-N	0	3	326.484	3.448	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cccc3ccsc32)C1	ZINC001025588407	1324433189	/nfs/dbraw/zinc/43/31/89/1324433189.db2.gz	VPAJGKBITPDOKC-GOEBONIOSA-N	0	3	326.465	3.365	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(CC(C)C)c[nH]2)C1	ZINC001025597245	1324446521	/nfs/dbraw/zinc/44/65/21/1324446521.db2.gz	OXRDIVUVTXJLLB-FUHWJXTLSA-N	0	3	329.488	3.067	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(C)nc3ccccc32)C1	ZINC001025609138	1324459648	/nfs/dbraw/zinc/45/96/48/1324459648.db2.gz	DSSCBNOFLKTNKJ-ROUUACIJSA-N	0	3	349.478	3.397	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2sc(C(C)C)nc2C)C1	ZINC001025618426	1324470938	/nfs/dbraw/zinc/47/09/38/1324470938.db2.gz	BGQYNDSRFDSLLF-DZGCQCFKSA-N	0	3	333.501	3.038	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2c[nH]c3c2cccc3CC)C1	ZINC001025630392	1324482092	/nfs/dbraw/zinc/48/20/92/1324482092.db2.gz	SEFSOHQLADWVIY-NVXWUHKLSA-N	0	3	337.467	3.194	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CC[C@H]2CN(C(=O)C3(C4CC4)CC3)C[C@H]21	ZINC001026291706	1324706905	/nfs/dbraw/zinc/70/69/05/1324706905.db2.gz	UUJCCPGFQNTRPE-DFQSSKMNSA-N	0	3	349.478	3.075	20	30		EGEDHN
CC1(C(=O)N2C[C@@H]3CC[C@H](NCc4ccccc4C#N)[C@@H]3C2)CC=CC1	ZINC001026348265	1324743915	/nfs/dbraw/zinc/74/39/15/1324743915.db2.gz	DSQSIACDOBDKOK-ZCNNSNEGSA-N	0	3	349.478	3.241	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)c2ccoc2C)CC1	ZINC001026449289	1324812886	/nfs/dbraw/zinc/81/28/86/1324812886.db2.gz	HDBWLZARDVBIJY-UHFFFAOYSA-N	0	3	341.249	3.127	20	30		EGEDHN
Cc1[nH]ccc1C(=O)NC1CCC(NCc2ccccc2C#N)CC1	ZINC001026473159	1324831174	/nfs/dbraw/zinc/83/11/74/1324831174.db2.gz	DJNKEYCMXYKCTO-UHFFFAOYSA-N	0	3	336.439	3.026	20	30		EGEDHN
C=C1CC(C)(C(=O)NC2CCC(NCc3conc3CC)CC2)C1	ZINC001026555196	1324891856	/nfs/dbraw/zinc/89/18/56/1324891856.db2.gz	OFOQJXWNWPYDCY-UHFFFAOYSA-N	0	3	331.460	3.110	20	30		EGEDHN
C[C@]1(C(=O)N2CC[C@H](CNCc3ccccc3C#N)C2)CC=CCC1	ZINC001026863788	1325051890	/nfs/dbraw/zinc/05/18/90/1325051890.db2.gz	RLFVYIREWSDPGD-UTKZUKDTSA-N	0	3	337.467	3.243	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H]1C(=O)N1CC[C@@H](CNCc2ccccc2C#N)C1	ZINC001027078156	1325205939	/nfs/dbraw/zinc/20/59/39/1325205939.db2.gz	YXKXTTGKQVXLOY-PWIZWCRZSA-N	0	3	339.483	3.179	20	30		EGEDHN
N#Cc1ccc(F)c(C(=O)NC[C@H](c2ccccc2)N2CCCC2)c1	ZINC000854310634	1325241879	/nfs/dbraw/zinc/24/18/79/1325241879.db2.gz	WHBSPYYPZJFERV-LJQANCHMSA-N	0	3	337.398	3.264	20	30		EGEDHN
N#Cc1ccccc1CNC1CC2(C1)CC(NC(=O)[C@H]1[C@@H]3CCC[C@@H]31)C2	ZINC000963668466	1325368058	/nfs/dbraw/zinc/36/80/58/1325368058.db2.gz	MHUDMJZSVZRONY-UCWWMVTNSA-N	0	3	349.478	3.121	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)/C=C\c2ccco2)C1	ZINC001027275549	1325388361	/nfs/dbraw/zinc/38/83/61/1325388361.db2.gz	SJUARMYOQRKENC-GDWUOILNSA-N	0	3	349.434	3.287	20	30		EGEDHN
CC1CC(C(=O)N2CCC[C@H](N(C)Cc3ccc(C#N)cc3)C2)C1	ZINC001027361378	1325545956	/nfs/dbraw/zinc/54/59/56/1325545956.db2.gz	HJDAPKPMXTYAFI-PPSBMQLTSA-N	0	3	325.456	3.027	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)/C=C\c2ccc[nH]2)C1	ZINC001027381777	1325579257	/nfs/dbraw/zinc/57/92/57/1325579257.db2.gz	HKGRLSDJLJIUKO-QJRAZLAKSA-N	0	3	348.450	3.023	20	30		EGEDHN
CCO[C@@H](C(=O)C(C#N)C(=O)Nc1cccc2ccccc21)C1CC1	ZINC000860469316	1329320889	/nfs/dbraw/zinc/32/08/89/1329320889.db2.gz	HWANWEHWIUZEBP-VQIMIIECSA-N	0	3	336.391	3.302	20	30		EGEDHN
CC(=O)N[C@@H](C(=O)C(C#N)c1nc2cc(Cl)ccc2s1)C(C)C	ZINC000860479291	1329322506	/nfs/dbraw/zinc/32/25/06/1329322506.db2.gz	MLNBECZNAYPVTM-SMDDNHRTSA-N	0	3	349.843	3.287	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)C2(F)CCCC2)C1	ZINC001027469696	1327725358	/nfs/dbraw/zinc/72/53/58/1327725358.db2.gz	HRALLFOYGLQRCB-SFHVURJKSA-N	0	3	343.446	3.263	20	30		EGEDHN
C[C@@H](NC[C@@H]1CCN1C(=O)OC(C)(C)C)c1ccc(C#N)c(F)c1	ZINC000927000932	1327814298	/nfs/dbraw/zinc/81/42/98/1327814298.db2.gz	NJJWLEGRMBTJLI-DOMZBBRYSA-N	0	3	333.407	3.357	20	30		EGEDHN
C[C@@H](NCCNc1ccc(C#N)cn1)c1ccc(C(F)(F)F)cn1	ZINC000927168410	1327904690	/nfs/dbraw/zinc/90/46/90/1327904690.db2.gz	SFZGPGIEMBPYMB-LLVKDONJSA-N	0	3	335.333	3.130	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2C2CC2)C1	ZINC001027608762	1327969737	/nfs/dbraw/zinc/96/97/37/1327969737.db2.gz	LHUOKZVSUSLDSL-HSALFYBXSA-N	0	3	337.467	3.027	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)c2ccc(O[C@@H](C)CC)cc2)C1	ZINC001027640340	1328014185	/nfs/dbraw/zinc/01/41/85/1328014185.db2.gz	QURIQGSZEXXWMH-WMZOPIPTSA-N	0	3	328.456	3.034	20	30		EGEDHN
COc1ccc(CN(C)[C@@H]2CCCN(C(=O)C(C)(C)C)C2)cc1C#N	ZINC001027658481	1328045712	/nfs/dbraw/zinc/04/57/12/1328045712.db2.gz	KWCYJAKYHNCSLG-QGZVFWFLSA-N	0	3	343.471	3.036	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1ccc(Cl)cn1)C2	ZINC000965861920	1328057752	/nfs/dbraw/zinc/05/77/52/1328057752.db2.gz	UVBULYKREFYXQF-UHFFFAOYSA-N	0	3	340.254	3.118	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)c2csc3c2CC[C@H](C)C3)C1	ZINC001027669840	1328064906	/nfs/dbraw/zinc/06/49/06/1328064906.db2.gz	DJLRMRGAGDOGMY-GJZGRUSLSA-N	0	3	330.497	3.043	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)c2cc(CC)c(CCC)s2)C1	ZINC001027675520	1328071827	/nfs/dbraw/zinc/07/18/27/1328071827.db2.gz	FDJNDAVUOADABB-MRXNPFEDSA-N	0	3	332.513	3.433	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2cccc3scnc32)C1	ZINC000966077638	1328171082	/nfs/dbraw/zinc/17/10/82/1328171082.db2.gz	QORHBGYSARDEPD-HIFRSBDPSA-N	0	3	329.469	3.313	20	30		EGEDHN
N#Cc1ccc(C(=O)NC[C@H]2CCCN2Cc2ccc(C3CC3)cc2)[nH]1	ZINC001027830721	1328287039	/nfs/dbraw/zinc/28/70/39/1328287039.db2.gz	HJUDZWZUZJSOSI-LJQANCHMSA-N	0	3	348.450	3.158	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cc3ccccc3nc2C)C1	ZINC000966494445	1328323724	/nfs/dbraw/zinc/32/37/24/1328323724.db2.gz	XFEWLCHVNXLWNF-QRWLVFNGSA-N	0	3	335.451	3.007	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1coc2c1cccc2OC	ZINC001027884676	1328352726	/nfs/dbraw/zinc/35/27/26/1328352726.db2.gz	OGUHHADGPNMBOR-AWEZNQCLSA-N	0	3	328.412	3.212	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccc(-c3cc[nH]n3)s2)C1	ZINC000966884372	1328451246	/nfs/dbraw/zinc/45/12/46/1328451246.db2.gz	LDZLZNNZAIVDJT-ZFWWWQNUSA-N	0	3	344.484	3.155	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)Cc2ccc3cccnc3c2)C1	ZINC000966903356	1328465939	/nfs/dbraw/zinc/46/59/39/1328465939.db2.gz	FNGBRKKLGGLROA-JXFKEZNVSA-N	0	3	337.467	3.180	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2ccc(-c3cnco3)cc2)C1	ZINC000966946284	1328490062	/nfs/dbraw/zinc/49/00/62/1328490062.db2.gz	WZJYTBNDFMJWMC-YJBOKZPZSA-N	0	3	339.439	3.358	20	30		EGEDHN
CCN(CCNC(=O)OC(C)(C)C)Cc1ccc(O[C@@H](C)C#N)cc1	ZINC000862468244	1329488953	/nfs/dbraw/zinc/48/89/53/1329488953.db2.gz	DAKRLFOGPUQLSF-HNNXBMFYSA-N	0	3	347.459	3.324	20	30		EGEDHN
CCN(CCNC(=O)OC(C)(C)C)Cc1ccc(O[C@H](C)C#N)cc1	ZINC000862468245	1329489301	/nfs/dbraw/zinc/48/93/01/1329489301.db2.gz	DAKRLFOGPUQLSF-OAHLLOKOSA-N	0	3	347.459	3.324	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(-c3cccc(C)c3)cn2)CC1	ZINC000863935380	1329589978	/nfs/dbraw/zinc/58/99/78/1329589978.db2.gz	TYXNWRBNZPCITM-UHFFFAOYSA-N	0	3	333.435	3.341	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3ccccc3CC(C)(C)C)C2)CC1	ZINC001050556969	1348288635	/nfs/dbraw/zinc/28/86/35/1348288635.db2.gz	SEFUORPJFYLVJE-UHFFFAOYSA-N	0	3	338.495	3.446	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)C4(C5CC5)CC4)C3)CC2)c1	ZINC001050555571	1348288800	/nfs/dbraw/zinc/28/88/00/1348288800.db2.gz	QNDSCTYAWQKBQD-UHFFFAOYSA-N	0	3	349.478	3.173	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)CN[C@H]1CCc2cccc3cccc1c32	ZINC000931807144	1329763101	/nfs/dbraw/zinc/76/31/01/1329763101.db2.gz	SLBAKJNVICJVFO-GHTZIAJQSA-N	0	3	335.451	3.471	20	30		EGEDHN
Cc1ccc(C#N)cc1C(=O)N(Cc1ccco1)C1CCN(C)CC1	ZINC000932692410	1329833704	/nfs/dbraw/zinc/83/37/04/1329833704.db2.gz	DQQRVHIYIXVCHT-UHFFFAOYSA-N	0	3	337.423	3.196	20	30		EGEDHN
C[C@@H](Cc1cccnc1)NCc1ccc(Br)cc1C#N	ZINC000934229579	1329957121	/nfs/dbraw/zinc/95/71/21/1329957121.db2.gz	JGFUTYPHQWJSCI-LBPRGKRZSA-N	0	3	330.229	3.437	20	30		EGEDHN
CSCC(C)(C)NCC(=O)N(CCC#N)c1cccc(C)c1C	ZINC000934675840	1329998905	/nfs/dbraw/zinc/99/89/05/1329998905.db2.gz	VGAUXYABULEYGT-UHFFFAOYSA-N	0	3	333.501	3.281	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)C2(c3cc(C)cc(C)c3)CC2)CC1	ZINC001052939139	1348757766	/nfs/dbraw/zinc/75/77/66/1348757766.db2.gz	LNDHFISBBMYEBY-HXUWFJFHSA-N	0	3	338.495	3.329	20	30		EGEDHN
CCN1CCN(c2cccc(NC(=O)c3cc(C#N)ccc3C)c2)CC1	ZINC000935445847	1330053787	/nfs/dbraw/zinc/05/37/87/1330053787.db2.gz	HNUFLVRYMUQENP-UHFFFAOYSA-N	0	3	348.450	3.261	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H](C)[C@H](NCc3scnc3C)C2)CC1	ZINC000939054136	1330365335	/nfs/dbraw/zinc/36/53/35/1330365335.db2.gz	FGEAOXREIZMORK-CZUORRHYSA-N	0	3	333.501	3.134	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](C)[C@H](NCc3cccc(Cl)n3)C2)C1	ZINC000939103133	1330377086	/nfs/dbraw/zinc/37/70/86/1330377086.db2.gz	NLUWLMGSRQUUTL-UKRRQHHQSA-N	0	3	333.863	3.028	20	30		EGEDHN
CC1(C)CN(Cc2cccc(C#N)c2)CC[C@H]1NC(=O)C1=CCCC1	ZINC000940674673	1331152587	/nfs/dbraw/zinc/15/25/87/1331152587.db2.gz	VVFDWGGDKMPFHP-LJQANCHMSA-N	0	3	337.467	3.385	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2ccc(CCCC)cc2)[C@H](C)C1	ZINC000942274830	1331893152	/nfs/dbraw/zinc/89/31/52/1331893152.db2.gz	YLYJGHWALYLRLV-YLJYHZDGSA-N	0	3	326.484	3.032	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnc3c(F)cccc3c2)[C@@H](C)C1	ZINC000942497700	1331946865	/nfs/dbraw/zinc/94/68/65/1331946865.db2.gz	ULOBPCWDBTUKDB-GUYCJALGSA-N	0	3	327.403	3.000	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3c(o2)c(F)ccc3C)[C@@H](C)C1	ZINC000942526884	1331955761	/nfs/dbraw/zinc/95/57/61/1331955761.db2.gz	CTZJLOMDHWTPNY-WMLDXEAASA-N	0	3	342.414	3.344	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C3CC3)oc2C2CC2)[C@H](C)C1	ZINC000942525593	1331956089	/nfs/dbraw/zinc/95/60/89/1331956089.db2.gz	RPUUZFTZVTWONP-RDTXWAMCSA-N	0	3	340.467	3.498	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C)c(Cl)c2F)[C@H](C)C1	ZINC000942527800	1331957769	/nfs/dbraw/zinc/95/77/69/1331957769.db2.gz	RRYYEPVPHOPMLT-UKRRQHHQSA-N	0	3	336.838	3.251	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(C3CCC3)cc2)[C@@H](C)C1	ZINC000942535592	1331961533	/nfs/dbraw/zinc/96/15/33/1331961533.db2.gz	LHXVVSQOHZBVPS-UWJYYQICSA-N	0	3	338.495	3.347	20	30		EGEDHN
C[C@H]1CN(Cc2cccc(C#N)c2)CC[C@H]1NC(=O)C1(C)CCCC1	ZINC000942540210	1331964590	/nfs/dbraw/zinc/96/45/90/1331964590.db2.gz	HWGLMLXJVCVEQY-QFBILLFUSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2csc3ccccc23)[C@@H](C)C1	ZINC000942541205	1331965758	/nfs/dbraw/zinc/96/57/58/1331965758.db2.gz	WXCVYFCBDIXMSU-YOEHRIQHSA-N	0	3	326.465	3.365	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(Cc3cnccc3C)C[C@H]2C)cc1	ZINC000942553941	1331970972	/nfs/dbraw/zinc/97/09/72/1331970972.db2.gz	WFHAPUVYUZOGEB-DYESRHJHSA-N	0	3	347.462	3.012	20	30		EGEDHN
C[C@H]1CN(Cc2ccc(C#N)cc2)CC[C@H]1NC(=O)C1(C)CCC1	ZINC000942560595	1331975212	/nfs/dbraw/zinc/97/52/12/1331975212.db2.gz	SMVJBZYZLCSQDE-MAUKXSAKSA-N	0	3	325.456	3.075	20	30		EGEDHN
Cc1coc(C(=O)N[C@H]2CCN(Cc3ccc(C#N)cc3)C[C@@H]2C)c1	ZINC000942565353	1331978730	/nfs/dbraw/zinc/97/87/30/1331978730.db2.gz	KNNKLQOOBNVRQZ-YJBOKZPZSA-N	0	3	337.423	3.100	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2csc(-c3ccco3)n2)[C@@H](C)C1	ZINC000942584339	1331990321	/nfs/dbraw/zinc/99/03/21/1331990321.db2.gz	WDORGRRSSOFXOE-QWHCGFSZSA-N	0	3	331.441	3.029	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc(F)c(Cl)c2F)[C@@H](C)C1	ZINC000942602931	1332000672	/nfs/dbraw/zinc/00/06/72/1332000672.db2.gz	PQUFYGVZYNWBAC-GWCFXTLKSA-N	0	3	328.790	3.244	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C(C)C)nc2CC)[C@@H](C)C1	ZINC000942859897	1332049763	/nfs/dbraw/zinc/04/97/63/1332049763.db2.gz	OWOBHWKJVPOKEL-OXJNMPFZSA-N	0	3	341.499	3.231	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(F)cc3cccnc32)[C@@H](C)C1	ZINC000943210779	1332122396	/nfs/dbraw/zinc/12/23/96/1332122396.db2.gz	VWCFAQYBYNHAQV-GUYCJALGSA-N	0	3	327.403	3.000	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cnc(CC(C)(C)C)s2)[C@H](C)C1	ZINC000944031768	1332311588	/nfs/dbraw/zinc/31/15/88/1332311588.db2.gz	DFYYNFPUUDGFTD-CABCVRRESA-N	0	3	347.528	3.195	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C23CC4CC(CC(C4)C2)C3)[C@H](C)C1	ZINC000944282795	1332362919	/nfs/dbraw/zinc/36/29/19/1332362919.db2.gz	YZVRJHTZPAMGMP-CYSNLQCGSA-N	0	3	328.500	3.053	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(-c3cccs3)o2)[C@@H](C)C1	ZINC000944531859	1332415164	/nfs/dbraw/zinc/41/51/64/1332415164.db2.gz	KESYGZANAUVWFI-GJZGRUSLSA-N	0	3	342.464	3.472	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(CC(C)C)cc2)[C@H](C)C1	ZINC000944789217	1332423980	/nfs/dbraw/zinc/42/39/80/1332423980.db2.gz	KJLPVHGFFLVTPQ-YLJYHZDGSA-N	0	3	326.484	3.349	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(CCC)c(C)s2)[C@@H](C)C1	ZINC000944789931	1332424396	/nfs/dbraw/zinc/42/43/96/1332424396.db2.gz	MNEGXPQVRSXZIS-WMLDXEAASA-N	0	3	332.513	3.473	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2c[nH]c3c2cccc3CC)[C@H](C)C1	ZINC000945180130	1332526307	/nfs/dbraw/zinc/52/63/07/1332526307.db2.gz	KRWUSTMCGICUFT-DNVCBOLYSA-N	0	3	337.467	3.194	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)CCc3ccco3)CC[C@@H]2C1	ZINC000946477201	1332839241	/nfs/dbraw/zinc/83/92/41/1332839241.db2.gz	ABUDJMHKSYFYNG-IYBDPMFKSA-N	0	3	336.863	3.135	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@H]3Cc4ccccc43)CC[C@@H]2C1	ZINC000946743394	1332889627	/nfs/dbraw/zinc/88/96/27/1332889627.db2.gz	SHSCJUKEAKPWFZ-SCTDSRPQSA-N	0	3	344.886	3.249	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)c2ccsc2)CCN1Cc1cccc(C#N)c1	ZINC000947000676	1332964526	/nfs/dbraw/zinc/96/45/26/1332964526.db2.gz	JRAFFYPTDXGTGY-KBXCAEBGSA-N	0	3	339.464	3.403	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2ccsc2)CCN1Cc1cccc(C#N)c1	ZINC000947000679	1332964551	/nfs/dbraw/zinc/96/45/51/1332964551.db2.gz	JRAFFYPTDXGTGY-RDTXWAMCSA-N	0	3	339.464	3.403	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccnc(-c3ccco3)c2)C[C@@H]1C	ZINC000947429286	1333124773	/nfs/dbraw/zinc/12/47/73/1333124773.db2.gz	GXOUWHAOZSLUIS-HOCLYGCPSA-N	0	3	325.412	3.110	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2CCc3ccccc3CC2)C[C@@H]1C	ZINC000947474736	1333142304	/nfs/dbraw/zinc/14/23/04/1333142304.db2.gz	YLQOIECNFHSJIL-UWJYYQICSA-N	0	3	338.495	3.174	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc3cc(C)ccc3n2)C[C@@H]1C	ZINC000947532766	1333160743	/nfs/dbraw/zinc/16/07/43/1333160743.db2.gz	MPLYTUBXIYCTHW-WMZOPIPTSA-N	0	3	335.451	3.149	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(-c3ccco3)o2)C[C@@H]1C	ZINC000947538147	1333163785	/nfs/dbraw/zinc/16/37/85/1333163785.db2.gz	VWLSGWQURDLJCP-LSDHHAIUSA-N	0	3	326.396	3.146	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cnc3ccccc3c2C)C[C@H]1C	ZINC000947556937	1333170992	/nfs/dbraw/zinc/17/09/92/1333170992.db2.gz	UTXCGFANMOMCBI-WBVHZDCISA-N	0	3	335.451	3.149	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2oc3ccccc3c2OC)C[C@H]1C	ZINC000947611833	1333192478	/nfs/dbraw/zinc/19/24/78/1333192478.db2.gz	QUPWGRXJYHLQPX-ZIAGYGMSSA-N	0	3	328.412	3.210	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(F)c(Cl)cc2F)C[C@H]1C	ZINC000947676485	1333219552	/nfs/dbraw/zinc/21/95/52/1333219552.db2.gz	XIVLXJKWWCCJAS-VXGBXAGGSA-N	0	3	340.801	3.224	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3cncc(C)c3)[C@@H](C)C2)C1	ZINC000947702606	1333233128	/nfs/dbraw/zinc/23/31/28/1333233128.db2.gz	QFZVPOBMHPOVTC-FUHWJXTLSA-N	0	3	327.472	3.215	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C(C)(C)c2ccccc2F)C[C@H]1C	ZINC000947811367	1333268725	/nfs/dbraw/zinc/26/87/25/1333268725.db2.gz	ZHPHERABDJBABC-HZPDHXFCSA-N	0	3	330.447	3.096	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3ccccc3F)CCC2)C[C@H]1C	ZINC000947917340	1333306848	/nfs/dbraw/zinc/30/68/48/1333306848.db2.gz	VYOAFPVVJGUPIC-IAGOWNOFSA-N	0	3	342.458	3.240	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)nc3ccccc32)C[C@H]1C	ZINC000947997651	1333336343	/nfs/dbraw/zinc/33/63/43/1333336343.db2.gz	FAMUAYYOGAASLD-IAGOWNOFSA-N	0	3	335.451	3.149	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc(OCC(C)C)c2)C[C@H]1C	ZINC000948017982	1333344016	/nfs/dbraw/zinc/34/40/16/1333344016.db2.gz	YHPXPLAKNAIVSZ-MJGOQNOKSA-N	0	3	342.483	3.327	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2sc(Cl)nc2Cl)C[C@H]1C	ZINC000948044343	1333351822	/nfs/dbraw/zinc/35/18/22/1333351822.db2.gz	PHHNETUOSWBYKV-BDAKNGLRSA-N	0	3	334.272	3.219	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2coc(C3CCCCC3)n2)C[C@@H]1C	ZINC000948072668	1333365145	/nfs/dbraw/zinc/36/51/45/1333365145.db2.gz	AWLHZWNTGQDJIZ-HOCLYGCPSA-N	0	3	331.460	3.491	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C(F)(F)F)s2)C[C@H]1C	ZINC000948083345	1333370194	/nfs/dbraw/zinc/37/01/94/1333370194.db2.gz	ROUNKKRSECNNHL-VXGBXAGGSA-N	0	3	344.402	3.373	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2c(C)oc3ccccc32)C[C@@H]1C	ZINC000948104002	1333375270	/nfs/dbraw/zinc/37/52/70/1333375270.db2.gz	JCQGEUUMIKSYAA-DOTOQJQBSA-N	0	3	338.451	3.276	20	30		EGEDHN
CN(C(=O)[C@H]1CC1(C)C)[C@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948295216	1333468463	/nfs/dbraw/zinc/46/84/63/1333468463.db2.gz	PKOZTYIOTWVTAI-RBUKOAKNSA-N	0	3	339.483	3.417	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2nc(C(C)(C)C)cs2)CC1	ZINC000948457448	1333533973	/nfs/dbraw/zinc/53/39/73/1333533973.db2.gz	VMMPRTJOEVBTPN-OAHLLOKOSA-N	0	3	347.528	3.390	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cc(C)c(F)cc2F)CC1	ZINC000948467859	1333537927	/nfs/dbraw/zinc/53/79/27/1333537927.db2.gz	ZRDQRFVPAKWNFX-HNNXBMFYSA-N	0	3	334.410	3.223	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)C2(C)CCC(F)(F)CC2)CC1	ZINC000948560850	1333576771	/nfs/dbraw/zinc/57/67/71/1333576771.db2.gz	GMLXHECHKMCGPG-OAHLLOKOSA-N	0	3	326.431	3.148	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)Cc2ccc3cnccc3c2)CC1	ZINC000948611953	1333595492	/nfs/dbraw/zinc/59/54/92/1333595492.db2.gz	HYZZRZPVWWHNSP-OAQYLSRUSA-N	0	3	349.478	3.114	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)Cc2ccc3cnccc3c2)CC1	ZINC000948611952	1333595697	/nfs/dbraw/zinc/59/56/97/1333595697.db2.gz	HYZZRZPVWWHNSP-NRFANRHFSA-N	0	3	349.478	3.114	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)[C@@H](C)c2c(F)cccc2F)CC1	ZINC000948620811	1333599397	/nfs/dbraw/zinc/59/93/97/1333599397.db2.gz	IQFHQXIZFMOKKL-LSDHHAIUSA-N	0	3	334.410	3.014	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)Cc2cccc(C3CC3)c2)CC1	ZINC000948643668	1333609628	/nfs/dbraw/zinc/60/96/28/1333609628.db2.gz	XQYXRVCERYZEIA-NRFANRHFSA-N	0	3	338.495	3.443	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)C2(c3cccc(F)c3)CCC2)CC1	ZINC000948664980	1333620101	/nfs/dbraw/zinc/62/01/01/1333620101.db2.gz	CBSWQHZEZYYWIS-IBGZPJMESA-N	0	3	342.458	3.194	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2cc3c(ccc(C)c3C)[nH]2)CC1	ZINC000948670266	1333622581	/nfs/dbraw/zinc/62/25/81/1333622581.db2.gz	OCMVQRWRAZLPCM-QGZVFWFLSA-N	0	3	337.467	3.344	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2ccc(C)c(OCC)c2)CC1	ZINC000948829355	1333701361	/nfs/dbraw/zinc/70/13/61/1333701361.db2.gz	LICZUPAXOMAZHB-LJQANCHMSA-N	0	3	342.483	3.344	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@H]3CCCC3(C)C)CC2)C1	ZINC000949444831	1333848367	/nfs/dbraw/zinc/84/83/67/1333848367.db2.gz	NFSPDWSMXMFAHK-QGZVFWFLSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@@H]3CCCC[C@H]3C)CC2)C1	ZINC000949450750	1333850576	/nfs/dbraw/zinc/85/05/76/1333850576.db2.gz	ITBJPMDCXWPHLX-RTBURBONSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@H]3CCC[C@H]3CC)CC2)C1	ZINC000949466992	1333855724	/nfs/dbraw/zinc/85/57/24/1333855724.db2.gz	YHNSWWPATFWDCC-MOPGFXCFSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@H]3C[C@@H]3C3CCCC3)CC2)C1	ZINC000949503257	1333862050	/nfs/dbraw/zinc/86/20/50/1333862050.db2.gz	AXSHFIGIXHDASN-MOPGFXCFSA-N	0	3	346.515	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C[C@H]3CCCC[C@@H]3C)CC2)C1	ZINC000949533699	1333869567	/nfs/dbraw/zinc/86/95/67/1333869567.db2.gz	DRWIQZWABVWWDV-RBUKOAKNSA-N	0	3	348.531	3.472	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2cc(C)nn2C(CC)CC)C1	ZINC000967091279	1335660500	/nfs/dbraw/zinc/66/05/00/1335660500.db2.gz	UXCOJQGHIGDNGD-YJBOKZPZSA-N	0	3	344.503	3.016	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2coc3cc(F)ccc23)C1	ZINC000967093111	1335661483	/nfs/dbraw/zinc/66/14/83/1335661483.db2.gz	YQNPGFOFRFNLHH-SUMWQHHRSA-N	0	3	328.387	3.035	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2coc3ccc(OC)cc23)C1	ZINC000967308156	1335695230	/nfs/dbraw/zinc/69/52/30/1335695230.db2.gz	CKPCJUUXWYWTRD-KSSFIOAISA-N	0	3	342.439	3.458	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)Cc2cccc(C)c2Cl)C1	ZINC000967340516	1335707135	/nfs/dbraw/zinc/70/71/35/1335707135.db2.gz	WOEASKITYHYMIY-YOEHRIQHSA-N	0	3	332.875	3.041	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC[C@@H](NCc2sc3ccccc3c2Cl)C1	ZINC000967727558	1335808653	/nfs/dbraw/zinc/80/86/53/1335808653.db2.gz	FLUVWGYXKGPLDD-VXGBXAGGSA-N	0	3	347.871	3.405	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CN(CCc3scnc3C)CC[C@@H]2C)C1	ZINC000968272082	1335881440	/nfs/dbraw/zinc/88/14/40/1335881440.db2.gz	DWOMQQFMBZSUMG-GOEBONIOSA-N	0	3	347.528	3.177	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)Cc2c[nH]c3ccc(F)cc23)C1	ZINC000968354697	1335900574	/nfs/dbraw/zinc/90/05/74/1335900574.db2.gz	VMRMVBGNAPSPKU-AUUYWEPGSA-N	0	3	343.446	3.252	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2ccc3scnc3c2)C1	ZINC000968498256	1335942095	/nfs/dbraw/zinc/94/20/95/1335942095.db2.gz	YUUMTYGDGKRBEU-CJNGLKHVSA-N	0	3	329.469	3.313	20	30		EGEDHN
C=C(C)CCN1CC[C@H](C)[C@H](NC(=O)c2sccc2COC)C1	ZINC000968539986	1335956997	/nfs/dbraw/zinc/95/69/97/1335956997.db2.gz	RYPOHFMFPSBZLN-GOEBONIOSA-N	0	3	336.501	3.301	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CN(Cc3cccc(C)c3)CC[C@@H]2C)nc1	ZINC000968548537	1335959509	/nfs/dbraw/zinc/95/95/09/1335959509.db2.gz	GLGAEBGVLKFFFC-UWJYYQICSA-N	0	3	347.462	3.012	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2cc3nc(C)ccc3o2)C1	ZINC000968565155	1335961901	/nfs/dbraw/zinc/96/19/01/1335961901.db2.gz	FHFGYSYUSDLDNQ-XJKSGUPXSA-N	0	3	327.428	3.153	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccc(Cl)cc2Cl)C1	ZINC000968578652	1335968867	/nfs/dbraw/zinc/96/88/67/1335968867.db2.gz	GZFUHOZXVVDVGX-LRDDRELGSA-N	0	3	339.266	3.457	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2ccc(Cl)c(Cl)c2)C1	ZINC000968579943	1335970450	/nfs/dbraw/zinc/97/04/50/1335970450.db2.gz	QWDHXANTZORDPM-BLLLJJGKSA-N	0	3	339.266	3.457	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2cc(C)nc3ccccc32)C1	ZINC000968609441	1335982563	/nfs/dbraw/zinc/98/25/63/1335982563.db2.gz	HHTFOSPDNAMSHN-FOIQADDNSA-N	0	3	335.451	3.007	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccc(OCC(C)C)cc2)C1	ZINC000968620326	1335986149	/nfs/dbraw/zinc/98/61/49/1335986149.db2.gz	STPKBNYCLLEUGQ-YLJYHZDGSA-N	0	3	342.483	3.185	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2cc3ccccc3n2CC)C1	ZINC000968682222	1336008795	/nfs/dbraw/zinc/00/87/95/1336008795.db2.gz	PCAIVBXYVFXRBM-FUHWJXTLSA-N	0	3	337.467	3.125	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)NC[C@@H]1CCCCCN1Cc1ccc(C#N)cc1	ZINC000968819630	1336060223	/nfs/dbraw/zinc/06/02/23/1336060223.db2.gz	ULSUSJUJWIZFQY-OALUTQOASA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1oc(CC2CC2)nc1C	ZINC000968856502	1336069714	/nfs/dbraw/zinc/06/97/14/1336069714.db2.gz	JJTZKVKHCJVLMG-KRWDZBQOSA-N	0	3	345.487	3.486	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cnn(C(C)(C)C)c1C	ZINC000968883059	1336079997	/nfs/dbraw/zinc/07/99/97/1336079997.db2.gz	YVRWKAZTXUAJTI-MRXNPFEDSA-N	0	3	332.492	3.107	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cc(C)n([C@@H](C)C2CC2)n1	ZINC000968923595	1336091391	/nfs/dbraw/zinc/09/13/91/1336091391.db2.gz	XYFNCWMWBLGTRA-FUHWJXTLSA-N	0	3	344.503	3.323	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1noc2c1CC(C)(C)CC2	ZINC000968957768	1336102632	/nfs/dbraw/zinc/10/26/32/1336102632.db2.gz	RKAARMIDOMWAPC-OAHLLOKOSA-N	0	3	345.487	3.350	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)[C@@H]1CCCCC1(F)F	ZINC000968967818	1336104719	/nfs/dbraw/zinc/10/47/19/1336104719.db2.gz	BKFWHPZYYWRLEJ-HOTGVXAUSA-N	0	3	326.431	3.196	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1cc2cc(F)ccc2[nH]1	ZINC000968977414	1336107869	/nfs/dbraw/zinc/10/78/69/1336107869.db2.gz	UTKJZLXELOOBJC-KRWDZBQOSA-N	0	3	341.430	3.305	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cn(CC)nc1C(C)C	ZINC000969046723	1336126835	/nfs/dbraw/zinc/12/68/35/1336126835.db2.gz	TUVXENYEIKYLFH-MRXNPFEDSA-N	0	3	332.492	3.187	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cnc(-c2ccccc2)[nH]1	ZINC000969053891	1336130015	/nfs/dbraw/zinc/13/00/15/1336130015.db2.gz	NSXWNEBBYCNLIQ-KRWDZBQOSA-N	0	3	338.455	3.237	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1)C(C)(C)C	ZINC000969094462	1336140725	/nfs/dbraw/zinc/14/07/25/1336140725.db2.gz	ASKBKQSELNTZFY-XJKSGUPXSA-N	0	3	331.435	3.070	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1)C(C)(C)C	ZINC000969094444	1336141008	/nfs/dbraw/zinc/14/10/08/1336141008.db2.gz	ACPHQKFEVHOAQY-XJKSGUPXSA-N	0	3	331.435	3.070	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ncccc1C(F)(F)F	ZINC000969103511	1336144822	/nfs/dbraw/zinc/14/48/22/1336144822.db2.gz	VTXYDOCIHXEXOR-CYBMUJFWSA-N	0	3	341.377	3.261	20	30		EGEDHN
C#CCN1CCCCC[C@@H]1CNC(=O)c1[nH]ccc1-c1ccccc1	ZINC000969111840	1336148291	/nfs/dbraw/zinc/14/82/91/1336148291.db2.gz	URTIFSHTVBNZFY-GOSISDBHSA-N	0	3	335.451	3.289	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1cccnc1OCC	ZINC000969133775	1336155585	/nfs/dbraw/zinc/15/55/85/1336155585.db2.gz	SEHIGFOCNHPOLI-INIZCTEOSA-N	0	3	331.460	3.031	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)[C@@H]1Cc2ccc(Cl)cc21	ZINC000969136469	1336157227	/nfs/dbraw/zinc/15/72/27/1336157227.db2.gz	NBCDTOCUAYLRNZ-IEBWSBKVSA-N	0	3	344.886	3.364	20	30		EGEDHN
C=C(Cl)CN1CCCCC[C@H]1CNC(=O)c1n[nH]c2ccccc21	ZINC000969137366	1336157937	/nfs/dbraw/zinc/15/79/37/1336157937.db2.gz	YIIYCNIAQDTOTO-AWEZNQCLSA-N	0	3	346.862	3.290	20	30		EGEDHN
C#CCCN1CCCCC[C@H]1CNC(=O)c1cc2c(s1)CCC2	ZINC000969139880	1336158769	/nfs/dbraw/zinc/15/87/69/1336158769.db2.gz	SOQWHDWGDKCNFA-INIZCTEOSA-N	0	3	330.497	3.235	20	30		EGEDHN
C#CCCN1CCCCC[C@@H]1CNC(=O)c1cc2c(s1)CCC2	ZINC000969139881	1336158809	/nfs/dbraw/zinc/15/88/09/1336158809.db2.gz	SOQWHDWGDKCNFA-MRXNPFEDSA-N	0	3	330.497	3.235	20	30		EGEDHN
Cc1cccc([C@@H](C)N2CC([C@@H](C)NC(=O)c3ccc(C#N)[nH]3)C2)c1	ZINC000969506015	1336220185	/nfs/dbraw/zinc/22/01/85/1336220185.db2.gz	LDQSBEHFPJIEQB-HUUCEWRRSA-N	0	3	336.439	3.006	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H]1C(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC000970017289	1336272505	/nfs/dbraw/zinc/27/25/05/1336272505.db2.gz	RSQLMLINZCMXDP-KBAYOESNSA-N	0	3	343.446	3.070	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)[C@@H]2C[C@H]2c2c(F)cccc2F)C1	ZINC000970389214	1336302474	/nfs/dbraw/zinc/30/24/74/1336302474.db2.gz	DHMWCFGZBRLSOM-NWANDNLSSA-N	0	3	334.410	3.081	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(C(=O)c3ccc(Cl)cc3)C2)s1	ZINC000970542452	1336319235	/nfs/dbraw/zinc/31/92/35/1336319235.db2.gz	PNRZGQXKLBCKBG-CQSZACIVSA-N	0	3	345.855	3.277	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)c2ccc3nc(C)sc3c2)C1	ZINC000970690358	1336333777	/nfs/dbraw/zinc/33/37/77/1336333777.db2.gz	NRICCLYBCHVPPA-GFCCVEGCSA-N	0	3	329.469	3.231	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)[C@@H]2CCCC[C@@H]2C(F)(F)F)CC1	ZINC001005588884	1336376304	/nfs/dbraw/zinc/37/63/04/1336376304.db2.gz	ONKGBPUADMILLM-CABCVRRESA-N	0	3	332.410	3.464	20	30		EGEDHN
CN(C(=O)[C@]12C[C@H]1CCC2)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001005745861	1336398527	/nfs/dbraw/zinc/39/85/27/1336398527.db2.gz	CFXUVBDAUANSLJ-WIYYLYMNSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)Cc2csc(C(C)(C)C)n2)CC1	ZINC001006148986	1336460010	/nfs/dbraw/zinc/46/00/10/1336460010.db2.gz	WPBYXTVXOKCWIO-UHFFFAOYSA-N	0	3	335.517	3.092	20	30		EGEDHN
CC(C)[C@@H]1C[C@H]1C(=O)N(C)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001006219308	1336468407	/nfs/dbraw/zinc/46/84/07/1336468407.db2.gz	OFTMZGGZNVFOBO-VQTJNVASSA-N	0	3	339.483	3.273	20	30		EGEDHN
C=C(Cl)CN1CCC(N(C)C(=O)c2cccc(CN(C)C)c2)CC1	ZINC001006434786	1336505472	/nfs/dbraw/zinc/50/54/72/1336505472.db2.gz	MAAQOMCXQUJDBP-UHFFFAOYSA-N	0	3	349.906	3.037	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2c(C)nn(C(C)(C)C)c2C)C1	ZINC001007459410	1336652157	/nfs/dbraw/zinc/65/21/57/1336652157.db2.gz	HYTIYEAUXCVVBH-MRXNPFEDSA-N	0	3	332.492	3.025	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N[C@H]1CCCN(CC[C@H](C)F)C1	ZINC001007676221	1336687521	/nfs/dbraw/zinc/68/75/21/1336687521.db2.gz	WJUBRHDTFRLJBR-HOTGVXAUSA-N	0	3	334.435	3.194	20	30		EGEDHN
C#CCCN1CCC[C@@H](NC(=O)Cc2ccc(CCCC)cc2)C1	ZINC001007817533	1336706978	/nfs/dbraw/zinc/70/69/78/1336706978.db2.gz	NLDDVAXRBHTFPE-HXUWFJFHSA-N	0	3	326.484	3.176	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H](NC(=O)c2cc(-c3ccco3)on2)C1	ZINC001008112718	1336772081	/nfs/dbraw/zinc/77/20/81/1336772081.db2.gz	KIELLIAZSRTPND-CQSZACIVSA-N	0	3	329.400	3.095	20	30		EGEDHN
C#CCCN1CCC[C@@H](NC(=O)c2cc3cc(Cl)ccc3[nH]2)C1	ZINC001008137967	1336777656	/nfs/dbraw/zinc/77/76/56/1336777656.db2.gz	HORKGRRFSJKZSJ-OAHLLOKOSA-N	0	3	329.831	3.039	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)Cc2c[nH]c3cc(C)ccc23)C1	ZINC001008839679	1336932864	/nfs/dbraw/zinc/93/28/64/1336932864.db2.gz	KDNLENAZUPZTJW-KRWDZBQOSA-N	0	3	325.456	3.176	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2ncc(Cl)cc2Cl)C1	ZINC001008982333	1336952556	/nfs/dbraw/zinc/95/25/56/1336952556.db2.gz	QUWDMTOVYDDVPU-GFCCVEGCSA-N	0	3	328.243	3.159	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2coc(C3CCCCC3)n2)C1	ZINC001009686100	1337059541	/nfs/dbraw/zinc/05/95/41/1337059541.db2.gz	VJYRGRNAXKHMBE-INIZCTEOSA-N	0	3	331.460	3.493	20	30		EGEDHN
C=C(C)CCN1CC[C@H](NC(=O)c2cc(-c3cccs3)on2)C1	ZINC001015442097	1338143653	/nfs/dbraw/zinc/14/36/53/1338143653.db2.gz	QTZAJPPUOGXHMI-ZDUSSCGKSA-N	0	3	331.441	3.173	20	30		EGEDHN
C=C(C)CCN1CC[C@H](NC(=O)c2nc(Cl)sc2Cl)C1	ZINC001015486869	1338156613	/nfs/dbraw/zinc/15/66/13/1338156613.db2.gz	IXDZYKINKBCJHS-VIFPVBQESA-N	0	3	334.272	3.220	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@@H]3NC(=O)[C@H]3CC=CCC3)CC2)c1	ZINC001016500023	1338627133	/nfs/dbraw/zinc/62/71/33/1338627133.db2.gz	LVCDRRVDOHQXCY-PMACEKPBSA-N	0	3	349.478	3.385	20	30		EGEDHN
C[C@@H](C(=O)N[C@@H]1CC12CCN(Cc1cccc(C#N)c1)CC2)C1CC1	ZINC001016566093	1338649718	/nfs/dbraw/zinc/64/97/18/1338649718.db2.gz	RTTJUZFSTOQACF-DNVCBOLYSA-N	0	3	337.467	3.075	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@H]3NC(=O)C3=CCCC3)CC2)c1	ZINC001016568921	1338650738	/nfs/dbraw/zinc/65/07/38/1338650738.db2.gz	AGXVXQBXHPPHTB-LJQANCHMSA-N	0	3	335.451	3.139	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cscc2C(F)F)CC1	ZINC001016627519	1338669243	/nfs/dbraw/zinc/66/92/43/1338669243.db2.gz	MSUGPSBFJDKHPX-CQSZACIVSA-N	0	3	338.423	3.293	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2coc3cc(F)ccc32)CC1	ZINC001016703331	1338696371	/nfs/dbraw/zinc/69/63/71/1338696371.db2.gz	WYJZAYHUYXWKQH-SFHVURJKSA-N	0	3	340.398	3.180	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2cc3ccccc3cc2F)CC1	ZINC001016726518	1338704167	/nfs/dbraw/zinc/70/41/67/1338704167.db2.gz	NOHJWDCMVWDIQZ-LJQANCHMSA-N	0	3	336.410	3.196	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2ccc(C)c(Cl)c2F)CC1	ZINC001016744712	1338709989	/nfs/dbraw/zinc/70/99/89/1338709989.db2.gz	JEQPWXRMXWPGSH-CQSZACIVSA-N	0	3	334.822	3.005	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2cc(C(C)(C)C)oc2C)CC1	ZINC001016843289	1338743825	/nfs/dbraw/zinc/74/38/25/1338743825.db2.gz	OZYWZXUBPIEKMR-INIZCTEOSA-N	0	3	328.456	3.103	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)Cc2c(F)cccc2Cl)CC1	ZINC001016947352	1338780863	/nfs/dbraw/zinc/78/08/63/1338780863.db2.gz	WMCXXYKIPCRRQO-KRWDZBQOSA-N	0	3	348.849	3.016	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)C2(c3ccccc3)CCCC2)CC1	ZINC001016962409	1338785484	/nfs/dbraw/zinc/78/54/84/1338785484.db2.gz	YRUNQCAEDFWGAM-LJQANCHMSA-N	0	3	336.479	3.102	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2c[nH]c3c2cccc3CC)CC1	ZINC001016985670	1338793013	/nfs/dbraw/zinc/79/30/13/1338793013.db2.gz	MHAFJVGASJYAPH-LJQANCHMSA-N	0	3	349.478	3.338	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)[C@H](C)c2cccc(Cl)c2)CC1	ZINC001016987076	1338793809	/nfs/dbraw/zinc/79/38/09/1338793809.db2.gz	SBFMGSRYVFRUDV-CRAIPNDOSA-N	0	3	344.886	3.438	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@H](CN(C)Cc2ccccc2Cl)C1	ZINC001017071325	1338847773	/nfs/dbraw/zinc/84/77/73/1338847773.db2.gz	LEHZRMUOGIGJQV-HUUCEWRRSA-N	0	3	333.863	3.170	20	30		EGEDHN
Cc1cccc(Cl)c1CN(C)C[C@@H]1CCCN(C(=O)[C@H](C)C#N)C1	ZINC001017071546	1338847956	/nfs/dbraw/zinc/84/79/56/1338847956.db2.gz	NUCNVOOXDUZEOT-CVEARBPZSA-N	0	3	347.890	3.479	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC001017665820	1339387335	/nfs/dbraw/zinc/38/73/35/1339387335.db2.gz	WZSVZPVYTYJSPF-QKPAOTATSA-N	0	3	342.405	3.382	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H](C)c1c(C)n[nH]c1C	ZINC001017676795	1339388706	/nfs/dbraw/zinc/38/87/06/1339388706.db2.gz	PNUKKPQXWOQUQB-OLMNPRSZSA-N	0	3	344.503	3.162	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CCO[C@@H](C(C)C)C1	ZINC001018144857	1339513404	/nfs/dbraw/zinc/51/34/04/1339513404.db2.gz	UVZVDOUWSBGBRP-AKHDSKFASA-N	0	3	334.504	3.079	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H]1CCO[C@H](CC)C1	ZINC001018155984	1339517366	/nfs/dbraw/zinc/51/73/66/1339517366.db2.gz	IESPFPSAXCKJNG-AKHDSKFASA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@H]1CCC2(CCC2)CO1	ZINC001018203033	1339530835	/nfs/dbraw/zinc/53/08/35/1339530835.db2.gz	QPYPVEQSHADMFL-CEXWTWQISA-N	0	3	346.515	3.367	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1Cc2c1cccc2Cl	ZINC001018327348	1339578978	/nfs/dbraw/zinc/57/89/78/1339578978.db2.gz	ULVKABSRKMKOMC-JKIFEVAISA-N	0	3	330.859	3.231	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@@H]2CCCN2Cc2ccccc2CC)c1	ZINC001028126794	1340445541	/nfs/dbraw/zinc/44/55/41/1340445541.db2.gz	PUITVDPBQVPKQW-NRFANRHFSA-N	0	3	347.462	3.020	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1cccc(N2CCCC2)c1	ZINC001028223454	1340491970	/nfs/dbraw/zinc/49/19/70/1340491970.db2.gz	JHUKREZQZSZMPA-IBGZPJMESA-N	0	3	327.472	3.057	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1cnn(CCCC)c1CC	ZINC001028252108	1340512740	/nfs/dbraw/zinc/51/27/40/1340512740.db2.gz	DIBDYYKDZIXXKA-MRXNPFEDSA-N	0	3	332.492	3.016	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCCN2Cc2ccc(C)c(C)c2)nc1	ZINC001028269117	1340523157	/nfs/dbraw/zinc/52/31/57/1340523157.db2.gz	GMYJLIQDHHQLHM-FQEVSTJZSA-N	0	3	347.462	3.074	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1ccccc1OCC1CC1	ZINC001028332632	1340571750	/nfs/dbraw/zinc/57/17/50/1340571750.db2.gz	ZQJWPRNUAZOFOL-QGZVFWFLSA-N	0	3	328.456	3.246	20	30		EGEDHN
Cc1ccsc1C(=O)NC[C@H]1CCN(Cc2ccc(C#N)cc2)C1	ZINC001028369919	1340598901	/nfs/dbraw/zinc/59/89/01/1340598901.db2.gz	VNZVJGASARXSAT-QGZVFWFLSA-N	0	3	339.464	3.180	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H](CNC(=O)c3ccc(Cl)o3)C2)c1	ZINC001028408156	1340630234	/nfs/dbraw/zinc/63/02/34/1340630234.db2.gz	CQTJRZJCHRNLJP-HNNXBMFYSA-N	0	3	343.814	3.057	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](CNC(=O)[C@@H]3C[C@@H]4C=C[C@H]3CC4)C2)cc1	ZINC001028553493	1340698286	/nfs/dbraw/zinc/69/82/86/1340698286.db2.gz	IWKGIYQWWMPMMH-MBPVOVBZSA-N	0	3	349.478	3.099	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)c2sc3ccccc3c2C)C1	ZINC001028672525	1340751503	/nfs/dbraw/zinc/75/15/03/1340751503.db2.gz	JYFSCINDSUESDL-OAHLLOKOSA-N	0	3	326.465	3.285	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCN(Cc3ccc(F)cc3)C2)cc1	ZINC001028730496	1340779141	/nfs/dbraw/zinc/77/91/41/1340779141.db2.gz	KCELIEGCXSKLAY-SFHVURJKSA-N	0	3	336.410	3.059	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CCN(Cc3scnc3C)C2)CC1	ZINC001028780350	1340811200	/nfs/dbraw/zinc/81/12/00/1340811200.db2.gz	HRGJXTFQIKINIH-HNNXBMFYSA-N	0	3	333.501	3.136	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](CNC(=O)[C@@H]3CC34CCCC4)C2)cc1	ZINC001028909302	1340881408	/nfs/dbraw/zinc/88/14/08/1340881408.db2.gz	JAXRYOCMPHYXMP-MOPGFXCFSA-N	0	3	337.467	3.077	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)C1CCN(C(=O)C(C)(C)F)CC1	ZINC001029034699	1340913438	/nfs/dbraw/zinc/91/34/38/1340913438.db2.gz	DHFPCWYFCKXYGO-CQSZACIVSA-N	0	3	331.435	3.023	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)C1CCN(C(=O)/C=C/C2CC2)CC1	ZINC001029074303	1340923758	/nfs/dbraw/zinc/92/37/58/1340923758.db2.gz	LZNBWKZYLJVZIZ-ROJDOSBLSA-N	0	3	337.467	3.241	20	30		EGEDHN
C[C@@H](NCc1cc(F)ccc1C#N)C1CCN(C(=O)C(C)(C)C)CC1	ZINC001029168137	1340947288	/nfs/dbraw/zinc/94/72/88/1340947288.db2.gz	SASDQEWTNDPWGP-CQSZACIVSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](CN(C)Cc2c(C)onc2CC)C1	ZINC001029798373	1341076655	/nfs/dbraw/zinc/07/66/55/1341076655.db2.gz	JRUCPVJAULNJSP-INIZCTEOSA-N	0	3	347.503	3.428	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](CN(C)Cc2oc(CC)nc2C)C1	ZINC001029801060	1341076921	/nfs/dbraw/zinc/07/69/21/1341076921.db2.gz	GBABBWUGYISFGR-OAHLLOKOSA-N	0	3	333.476	3.038	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](CN(C)Cc2cc(F)cc(F)c2)C1	ZINC001029801056	1341076971	/nfs/dbraw/zinc/07/69/71/1341076971.db2.gz	FXVJTQHCNHKOAW-CQSZACIVSA-N	0	3	336.426	3.457	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](CN(C)Cc2c(C)noc2CC)C1	ZINC001029800250	1341077180	/nfs/dbraw/zinc/07/71/80/1341077180.db2.gz	NNUBIYTZYLXMJM-INIZCTEOSA-N	0	3	347.503	3.428	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@H](CN(C)Cc2ccc(F)cn2)C1	ZINC001029826304	1341087563	/nfs/dbraw/zinc/08/75/63/1341087563.db2.gz	OQHPAYOSHJUWAL-KXBFYZLASA-N	0	3	333.451	3.103	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@H](CN(C)Cc2c(C)onc2CC)C1	ZINC001029826795	1341087933	/nfs/dbraw/zinc/08/79/33/1341087933.db2.gz	VWZQDMOCIKZBIJ-JXFKEZNVSA-N	0	3	347.503	3.428	20	30		EGEDHN
C#CCCN1CCC[C@@H](N(Cc2ccccc2)C(=O)c2ccn(C)c2)C1	ZINC001029919808	1341119353	/nfs/dbraw/zinc/11/93/53/1341119353.db2.gz	IUHZEKFSYWFRDD-OAQYLSRUSA-N	0	3	349.478	3.155	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC(CN(C)Cc2ccc(F)cn2)CC1	ZINC001029982241	1341143395	/nfs/dbraw/zinc/14/33/95/1341143395.db2.gz	QZIGCZPSQOMGHK-UHFFFAOYSA-N	0	3	347.478	3.493	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC(CN(C)[C@H](C)c2cnccn2)CC1	ZINC001029989934	1341147609	/nfs/dbraw/zinc/14/76/09/1341147609.db2.gz	DHFNOAJZLUVQCQ-OXQOHEQNSA-N	0	3	344.503	3.310	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC(CN(C)Cc2cncs2)CC1	ZINC001029990726	1341148067	/nfs/dbraw/zinc/14/80/67/1341148067.db2.gz	QCHSCPXERAQYRX-SFHVURJKSA-N	0	3	335.517	3.416	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC(CN(C)Cc3ccc(F)cn3)CC2)C1	ZINC001029993570	1341150210	/nfs/dbraw/zinc/15/02/10/1341150210.db2.gz	JLWDQZMXEUBZBG-UHFFFAOYSA-N	0	3	345.462	3.247	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NCC1CN([C@H](C)c2cccc(C)c2)C1	ZINC001031680604	1341387360	/nfs/dbraw/zinc/38/73/60/1341387360.db2.gz	JRCRJNBSQZRVGQ-AHRSYUTCSA-N	0	3	342.483	3.085	20	30		EGEDHN
C=CCn1cccc1C(=O)NCC1CN([C@H](C)c2ccccc2C)C1	ZINC001031733318	1341394743	/nfs/dbraw/zinc/39/47/43/1341394743.db2.gz	TUSSNTWTEICZBU-QGZVFWFLSA-N	0	3	337.467	3.405	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1ccc2cnccc2c1	ZINC001032517297	1341529172	/nfs/dbraw/zinc/52/91/72/1341529172.db2.gz	LJYOYSHFJZINHP-PMACEKPBSA-N	0	3	335.451	3.029	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cnc2ccsc2c1	ZINC001032558363	1341540002	/nfs/dbraw/zinc/54/00/02/1341540002.db2.gz	SBNQDYAVKQYQSN-GJZGRUSLSA-N	0	3	327.453	3.161	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccnc(O[C@@H](C)CC)c1	ZINC001032722268	1341591633	/nfs/dbraw/zinc/59/16/33/1341591633.db2.gz	QZGVNCIWVPBNSO-SZMVWBNQSA-N	0	3	343.471	3.124	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1C[C@@H]2C[C@H]1CN2CCCC1CCC1	ZINC001032752156	1341603065	/nfs/dbraw/zinc/60/30/65/1341603065.db2.gz	DCDSMGNRNRFAJR-SFTDATJTSA-N	0	3	336.479	3.076	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@@H]2CCN(Cc3ccc(COC)cc3)C2)C1	ZINC001033398187	1341812608	/nfs/dbraw/zinc/81/26/08/1341812608.db2.gz	HFHSLDWTMNUCDU-LJQANCHMSA-N	0	3	342.483	3.222	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@H]2CCN(CC[C@H]3CC3(Cl)Cl)C2)C1	ZINC001033400787	1341814269	/nfs/dbraw/zinc/81/42/69/1341814269.db2.gz	XJXBTKOVZLVXSG-KBPBESRZSA-N	0	3	345.314	3.459	20	30		EGEDHN
C#CCCN1CC[C@H](N(C)C(=O)C(C)(C)c2cccc(Cl)c2)C1	ZINC001033457795	1341832531	/nfs/dbraw/zinc/83/25/31/1341832531.db2.gz	DDOIQNPCRLKMRV-KRWDZBQOSA-N	0	3	332.875	3.174	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2cc(F)cc3cccnc32)C1	ZINC001033470153	1341839049	/nfs/dbraw/zinc/83/90/49/1341839049.db2.gz	UNLHPSGALIJPQI-MRXNPFEDSA-N	0	3	327.403	3.096	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N(C)[C@@H]1CCN(Cc2ccc(C)cc2)C1	ZINC001033497151	1341847336	/nfs/dbraw/zinc/84/73/36/1341847336.db2.gz	KLBOEVKNADGVDY-AABGKKOBSA-N	0	3	342.483	3.009	20	30		EGEDHN
C#CCCN1CC[C@@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccc3ccccc3c2)C1	ZINC001033514227	1341854061	/nfs/dbraw/zinc/85/40/61/1341854061.db2.gz	ZYEQONUNGKHCCI-BHIFYINESA-N	0	3	346.474	3.499	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccnn2C(CC)CC)C1	ZINC001033853443	1342045452	/nfs/dbraw/zinc/04/54/52/1342045452.db2.gz	BFXPUHVZHPKVER-KRWDZBQOSA-N	0	3	332.492	3.357	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)C2CCc3ccccc3CC2)C1	ZINC001033877412	1342055792	/nfs/dbraw/zinc/05/57/92/1342055792.db2.gz	BUXGWJXCJZGMQL-NRFANRHFSA-N	0	3	338.495	3.128	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)[C@H](c1ccc(OC)cc1)C(C)C	ZINC001182994927	1387253611	/nfs/dbraw/zinc/25/36/11/1387253611.db2.gz	ZILYIGXXIQPAPI-HKUYNNGSSA-N	0	3	330.472	3.201	20	30		EGEDHN
C#Cc1ccc(C(=O)N(CC)[C@@H]2CCN(CC3=CCCCC3)C2)cn1	ZINC001034022087	1342159454	/nfs/dbraw/zinc/15/94/54/1342159454.db2.gz	CCECMLVKSWOTLA-HXUWFJFHSA-N	0	3	337.467	3.100	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2csc3c2CC[C@H](C)C3)C1	ZINC001034032631	1342171573	/nfs/dbraw/zinc/17/15/73/1342171573.db2.gz	UKSCTMUSTQELGU-JKSUJKDBSA-N	0	3	344.524	3.433	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](N(CC)C(=O)c2scnc2Cl)C1	ZINC001034041723	1342182403	/nfs/dbraw/zinc/18/24/03/1342182403.db2.gz	JNCUASKXFJZCTG-GFCCVEGCSA-N	0	3	327.881	3.299	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](N(CC)C(=O)c2cccc(CN(C)C)c2)C1	ZINC001034045849	1342185747	/nfs/dbraw/zinc/18/57/47/1342185747.db2.gz	NXDQQKJFIVIXCF-GOSISDBHSA-N	0	3	349.906	3.037	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2cc3ccccc3n2CC)C1	ZINC001034046062	1342186542	/nfs/dbraw/zinc/18/65/42/1342186542.db2.gz	PGDRSJXWXNAUQA-SFHVURJKSA-N	0	3	337.467	3.221	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)[C@H]2CCCCc3ccccc32)C1	ZINC001034047529	1342186872	/nfs/dbraw/zinc/18/68/72/1342186872.db2.gz	FJLADAIGMMGENJ-FPOVZHCZSA-N	0	3	338.495	3.443	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2coc(C3CCCCC3)n2)C1	ZINC001034052229	1342194117	/nfs/dbraw/zinc/19/41/17/1342194117.db2.gz	GCGUYXCJRFPLFJ-QGZVFWFLSA-N	0	3	343.471	3.282	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@H]2CCc3ccc(OC)cc32)C1	ZINC001034244441	1342344206	/nfs/dbraw/zinc/34/42/06/1342344206.db2.gz	BDZBXGYCYWMWAE-MJGOQNOKSA-N	0	3	342.483	3.272	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@@H]2CCN(c3ccccc3)C2)C1	ZINC001034267839	1342359458	/nfs/dbraw/zinc/35/94/58/1342359458.db2.gz	ZCSNRYOKEFKBGQ-MOPGFXCFSA-N	0	3	341.499	3.060	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)c2ccc(-c3cnco3)cc2)C1	ZINC001034277658	1342367914	/nfs/dbraw/zinc/36/79/14/1342367914.db2.gz	RTTAHVFFQNWHJE-QGZVFWFLSA-N	0	3	325.412	3.112	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2cc(C)nn2C(CC)CC)C1	ZINC001034281101	1342370331	/nfs/dbraw/zinc/37/03/31/1342370331.db2.gz	CJLPPFQRWSKCCN-KRWDZBQOSA-N	0	3	344.503	3.160	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cnn3cccc(Cl)c23)C1	ZINC001034298076	1342381417	/nfs/dbraw/zinc/38/14/17/1342381417.db2.gz	AIZAPTNJNDYTQN-CQSZACIVSA-N	0	3	346.862	3.148	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@H]2COc3cc(C)c(C)cc32)C1	ZINC001034330098	1342404835	/nfs/dbraw/zinc/40/48/35/1342404835.db2.gz	KRFKXVPABHSMOW-MJGOQNOKSA-N	0	3	342.483	3.326	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2cc3cc(F)ccc3o2)C1	ZINC001034424399	1342486267	/nfs/dbraw/zinc/48/62/67/1342486267.db2.gz	RNELBFGEUZEPQA-INIZCTEOSA-N	0	3	328.387	3.180	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccnc(OC3CCC3)c2)C1	ZINC001034461978	1342517714	/nfs/dbraw/zinc/51/77/14/1342517714.db2.gz	HCKRRJJDLWXSJG-QGZVFWFLSA-N	0	3	343.471	3.173	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)C2(c3ccccc3OC)CC2)C1	ZINC001034551901	1342614886	/nfs/dbraw/zinc/61/48/86/1342614886.db2.gz	IMVUKFTVQPHNAK-KRWDZBQOSA-N	0	3	342.483	3.274	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)[C@]2(C)CCc3ccccc3C2)C1	ZINC001034556822	1342617695	/nfs/dbraw/zinc/61/76/95/1342617695.db2.gz	IREYSGOHGOEMAF-PZJWPPBQSA-N	0	3	326.484	3.338	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CC[C@H](NCc3cc(C)no3)CC2)CC1	ZINC001034722575	1342715902	/nfs/dbraw/zinc/71/59/02/1342715902.db2.gz	AXYBDCMVBGGSJN-QAQDUYKDSA-N	0	3	331.460	3.246	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC[C@H](NCc3oc(CC)nc3C)CC2)C1	ZINC001034729376	1342723654	/nfs/dbraw/zinc/72/36/54/1342723654.db2.gz	KYCKPKYETVKVHR-WKILWMFISA-N	0	3	345.487	3.419	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N[C@H]1CC[C@H](NCc2cc(F)ccc2C#N)CC1	ZINC001034740280	1342730686	/nfs/dbraw/zinc/73/06/86/1342730686.db2.gz	HPIHRRGBYWSZET-BYNBJNPRSA-N	0	3	343.446	3.260	20	30		EGEDHN
N#Cc1cccc(CNCc2ccc(CNC(=O)c3ccc[nH]3)cc2)c1	ZINC001034807235	1342772830	/nfs/dbraw/zinc/77/28/30/1342772830.db2.gz	HWAWFHXKTWQUCH-UHFFFAOYSA-N	0	3	344.418	3.106	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)C[C@@H]2C=CCC2)s1	ZINC001034853754	1342805294	/nfs/dbraw/zinc/80/52/94/1342805294.db2.gz	JGKPEGYHXVAPLO-HUUCEWRRSA-N	0	3	329.469	3.057	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc(F)cc2F)C12CCC2	ZINC001078799362	1357090880	/nfs/dbraw/zinc/09/08/80/1357090880.db2.gz	ZYDQIZDRFHMCAC-GJZGRUSLSA-N	0	3	340.801	3.348	20	30		EGEDHN
Cc1cccc(Cl)c1CNC[C@H]1CCCN1C(=O)C#CC1CC1	ZINC001034935535	1342843635	/nfs/dbraw/zinc/84/36/35/1342843635.db2.gz	SSFIBTAOGUJPKV-MRXNPFEDSA-N	0	3	330.859	3.142	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]1CNCc1ccc(Cl)nc1	ZINC001035012067	1342874836	/nfs/dbraw/zinc/87/48/36/1342874836.db2.gz	QASPBECYHXSODV-OAHLLOKOSA-N	0	3	335.879	3.418	20	30		EGEDHN
CCc1ccoc1C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)s1	ZINC001035037076	1342890579	/nfs/dbraw/zinc/89/05/79/1342890579.db2.gz	LFZGKMFZHNEWEG-CQSZACIVSA-N	0	3	343.452	3.170	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cnn(C(C)(C)C)c1C)CC2	ZINC001035717765	1343150369	/nfs/dbraw/zinc/15/03/69/1343150369.db2.gz	RZARLARMXWKLHI-UHFFFAOYSA-N	0	3	344.503	3.061	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cc1cncc3ccccc31)CC2	ZINC001035726288	1343155005	/nfs/dbraw/zinc/15/50/05/1343155005.db2.gz	QCSDLRDFAOQXDZ-UHFFFAOYSA-N	0	3	349.478	3.278	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C[C@@H](C)c1ccncc1)CC2	ZINC001035732425	1343158500	/nfs/dbraw/zinc/15/85/00/1343158500.db2.gz	ASJZDMAJBAJPND-QGZVFWFLSA-N	0	3	327.472	3.076	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cnoc1-c1ccco1)CC2	ZINC001035736144	1343161061	/nfs/dbraw/zinc/16/10/61/1343161061.db2.gz	WNNSNHWWXXOEQH-UHFFFAOYSA-N	0	3	341.411	3.049	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C1([C@@H]3CCCCO3)CCC1)CC2	ZINC001035747723	1343167694	/nfs/dbraw/zinc/16/76/94/1343167694.db2.gz	BHDFILDLOYJZOI-SFHVURJKSA-N	0	3	346.515	3.226	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc3c(c1)[C@H](C)CO3)CC2	ZINC001035772063	1343184483	/nfs/dbraw/zinc/18/44/83/1343184483.db2.gz	MWPAIGDLPCRNBS-MRXNPFEDSA-N	0	3	340.467	3.297	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)CO[C@@H]1CCC[C@@H](C)C1)CC2	ZINC001035810171	1343210036	/nfs/dbraw/zinc/21/00/36/1343210036.db2.gz	UYDLNAKNSQCHTR-QZTJIDSGSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)CO[C@H]1CCC[C@H](C)C1)CC2	ZINC001035810176	1343210126	/nfs/dbraw/zinc/21/01/26/1343210126.db2.gz	UYDLNAKNSQCHTR-ROUUACIJSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@H](C)c1ccccc1F)CC2	ZINC001035819987	1343214295	/nfs/dbraw/zinc/21/42/95/1343214295.db2.gz	VFBSKSFYVFBTGA-MRXNPFEDSA-N	0	3	330.447	3.430	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccsc2)CC[C@H]1NCc1ccccc1C#N	ZINC001035901994	1343260179	/nfs/dbraw/zinc/26/01/79/1343260179.db2.gz	SFQGYVDEWKQGQH-RDTXWAMCSA-N	0	3	339.464	3.260	20	30		EGEDHN
CCC1(C(=O)N2CC[C@H](NCc3ccccc3C#N)[C@@H](C)C2)CCC1	ZINC001036160373	1343336338	/nfs/dbraw/zinc/33/63/38/1343336338.db2.gz	VGRAFWAXRBJKOY-LPHOPBHVSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@H]([C@@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001036338479	1343423758	/nfs/dbraw/zinc/42/37/58/1343423758.db2.gz	LOFVMCXESKHWAS-WBVHZDCISA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCCN(C(=O)CCC2CC2)C1	ZINC001036372362	1343449041	/nfs/dbraw/zinc/44/90/41/1343449041.db2.gz	WXNBTUUVMJFRIT-OXJNMPFZSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]([C@H](C)NCc2nc(C)cs2)C1	ZINC001036439701	1343488641	/nfs/dbraw/zinc/48/86/41/1343488641.db2.gz	LMSNPFNQDVEHAD-LSDHHAIUSA-N	0	3	335.517	3.380	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]([C@H](C)NCc3nccs3)C2)C1	ZINC001036444117	1343491532	/nfs/dbraw/zinc/49/15/32/1343491532.db2.gz	IJIAYWSITCHEEK-GJZGRUSLSA-N	0	3	333.501	3.216	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)C2CCC2)[C@H]1CNCc1ccc(C#N)s1	ZINC001036485339	1343509423	/nfs/dbraw/zinc/50/94/23/1343509423.db2.gz	HMZVBPGEBPEDHD-DYVFJYSZSA-N	0	3	331.485	3.137	20	30		EGEDHN
C[C@H]1CCCN(C(=O)C2CCC2)[C@@H]1CNCc1cc(C#N)ccc1F	ZINC001036487643	1343510653	/nfs/dbraw/zinc/51/06/53/1343510653.db2.gz	NCBBOSYCODVWNP-IFXJQAMLSA-N	0	3	343.446	3.214	20	30		EGEDHN
CC(C)(C)CC(=O)N1CC[C@@H]2[C@@H](CCN2CC#Cc2ccccc2)C1	ZINC001036639793	1343594942	/nfs/dbraw/zinc/59/49/42/1343594942.db2.gz	BANWNHGFGJOGBD-VQTJNVASSA-N	0	3	338.495	3.397	20	30		EGEDHN
CC(C)(C)CC(=O)N1CC[C@H]2[C@H](CCN2Cc2ccccc2C#N)C1	ZINC001036641855	1343595292	/nfs/dbraw/zinc/59/52/92/1343595292.db2.gz	HRDVWSYUDPGONB-MOPGFXCFSA-N	0	3	339.483	3.417	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@H]2CN(C(=O)CC3CCC3)CC[C@H]21	ZINC001036678401	1343618741	/nfs/dbraw/zinc/61/87/41/1343618741.db2.gz	PXQUTVIDBSPAPY-VQTJNVASSA-N	0	3	337.467	3.171	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@H]2[C@@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001036687243	1343630237	/nfs/dbraw/zinc/63/02/37/1343630237.db2.gz	ZOPBZDUNYKWLPE-BBRMVZONSA-N	0	3	347.459	3.306	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]2[C@H](CCN2Cc2ocnc2C)C1	ZINC001036794505	1343726413	/nfs/dbraw/zinc/72/64/13/1343726413.db2.gz	WFZTTXYVNSOCPN-HZPDHXFCSA-N	0	3	331.460	3.008	20	30		EGEDHN
Cc1coc(C(=O)N2CC[C@@H]3[C@@H](CCN3CC#Cc3ccccc3)C2)c1	ZINC001036796749	1343730415	/nfs/dbraw/zinc/73/04/15/1343730415.db2.gz	IHMUQXQMEGKMMC-VQTJNVASSA-N	0	3	348.446	3.176	20	30		EGEDHN
CCC1(C(=O)N2CC[C@H]3[C@H](CCN3Cc3ccccc3C#N)C2)CC1	ZINC001036813639	1343749688	/nfs/dbraw/zinc/74/96/88/1343749688.db2.gz	AJLVCORHFWRIEB-MOPGFXCFSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]3[C@@H](CCN3Cc3conc3CC)C2)C1	ZINC001036816084	1343753403	/nfs/dbraw/zinc/75/34/03/1343753403.db2.gz	PSEIKKFJGVVMEJ-MAUKXSAKSA-N	0	3	343.471	3.016	20	30		EGEDHN
Cc1ccoc1C(=O)N[C@H]1CCC[C@H]1CNCc1ccccc1C#N	ZINC001036948393	1343889354	/nfs/dbraw/zinc/88/93/54/1343889354.db2.gz	QARNEHOFILFXPK-ROUUACIJSA-N	0	3	337.423	3.148	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCC[C@H]1NC(=O)Cc1ccccc1	ZINC001037031655	1343939743	/nfs/dbraw/zinc/93/97/43/1343939743.db2.gz	NFXUFJVFUOPGKW-LEWJYISDSA-N	0	3	347.462	3.175	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCC[C@H]2CNCc2nccs2)CC1	ZINC001037070654	1343964015	/nfs/dbraw/zinc/96/40/15/1343964015.db2.gz	VCMTWOMFDJIRQV-JKSUJKDBSA-N	0	3	333.501	3.264	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCC[C@@H]2CNCc2ncc(C)s2)C1	ZINC001037074735	1343967954	/nfs/dbraw/zinc/96/79/54/1343967954.db2.gz	FZESKNFTPNGECF-CABCVRRESA-N	0	3	333.501	3.182	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCC[C@@H]1NC(=O)C1CC2(CC2)C1	ZINC001037075529	1343968652	/nfs/dbraw/zinc/96/86/52/1343968652.db2.gz	QVNPUNBXPPAUOM-MJGOQNOKSA-N	0	3	337.467	3.123	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@H]1CCCC[C@@H]1NC(=O)CC1CC1	ZINC001037148970	1344000060	/nfs/dbraw/zinc/00/00/60/1344000060.db2.gz	MDSYMDDYGAYKGU-APWZRJJASA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1cn(CC)c2ccccc12	ZINC001038478942	1344443033	/nfs/dbraw/zinc/44/30/33/1344443033.db2.gz	YCZGZLXFLFJEOD-MRXNPFEDSA-N	0	3	325.456	3.432	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1ccc(N(C)C)cc1	ZINC001038537994	1344472940	/nfs/dbraw/zinc/47/29/40/1344472940.db2.gz	SSDJEAUCFPVXOQ-HSALFYBXSA-N	0	3	341.499	3.013	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1nsc2ccc(C)cc21	ZINC001038585831	1344495589	/nfs/dbraw/zinc/49/55/89/1344495589.db2.gz	LXGCDOIELLEQGH-AWEZNQCLSA-N	0	3	329.469	3.375	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1cc(F)c2ncccc2c1	ZINC001038830429	1344600446	/nfs/dbraw/zinc/60/04/46/1344600446.db2.gz	UQMLFOMUXPWQLE-MRXNPFEDSA-N	0	3	327.403	3.144	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C2(CC)CCC2)CC[C@H]1c1ccc(F)cc1	ZINC001079156833	1357197652	/nfs/dbraw/zinc/19/76/52/1357197652.db2.gz	KNBLKEXEOXHEEO-RBUKOAKNSA-N	0	3	342.458	3.313	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)[C@@H](C)SC)CC2)C1	ZINC001039109905	1344781830	/nfs/dbraw/zinc/78/18/30/1344781830.db2.gz	OWZBGWQCFQZYMY-HIFRSBDPSA-N	0	3	330.925	3.051	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)C3(CF)CCC3)CC2)C1	ZINC001039162954	1344849175	/nfs/dbraw/zinc/84/91/75/1344849175.db2.gz	ASQWOZYLAZTDEA-MRXNPFEDSA-N	0	3	342.886	3.439	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2nc(C(C)C)oc2C)C1	ZINC001039200765	1344910115	/nfs/dbraw/zinc/91/01/15/1344910115.db2.gz	REPQTPSWAUUBNQ-IRXDYDNUSA-N	0	3	343.471	3.056	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)COC2CCCCC2)C1	ZINC001039214581	1344930674	/nfs/dbraw/zinc/93/06/74/1344930674.db2.gz	TWDYOSXYAOECCN-AZUAARDMSA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)C2CCC3(CC3)CC2)C1	ZINC001039217103	1344933881	/nfs/dbraw/zinc/93/38/81/1344933881.db2.gz	SMBAVSJWBYOJCB-MOPGFXCFSA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc3ccccc3n2C)C1	ZINC001039224529	1344941812	/nfs/dbraw/zinc/94/18/12/1344941812.db2.gz	HDMADCNZCLKHKO-QUCCMNQESA-N	0	3	349.478	3.128	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc3cc(C)ccc3[nH]2)C1	ZINC001039224857	1344943174	/nfs/dbraw/zinc/94/31/74/1344943174.db2.gz	IZSMXCDWAAGUKD-UTKZUKDTSA-N	0	3	349.478	3.426	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccn(C(C)C)c2C)C1	ZINC001039225451	1344943637	/nfs/dbraw/zinc/94/36/37/1344943637.db2.gz	OHNLKGZHTBDLOM-AZUAARDMSA-N	0	3	341.499	3.327	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2csc(C)c2)C1	ZINC001039232233	1344952577	/nfs/dbraw/zinc/95/25/77/1344952577.db2.gz	URZLRMYTDPYUEM-WMZOPIPTSA-N	0	3	330.497	3.396	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc[nH]c2C(C)C)C1	ZINC001039242136	1344967825	/nfs/dbraw/zinc/96/78/25/1344967825.db2.gz	ANCDADNFMCGGDJ-AEFFLSMTSA-N	0	3	327.472	3.088	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cncc3ccccc32)C1	ZINC001039242018	1344968270	/nfs/dbraw/zinc/96/82/70/1344968270.db2.gz	MTQUAZRNFVXTEY-GHTZIAJQSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2coc(C(F)F)c2)C1	ZINC001039245442	1344974514	/nfs/dbraw/zinc/97/45/14/1344974514.db2.gz	OJQFEEQDOYGEPL-DZGCQCFKSA-N	0	3	336.382	3.167	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc[nH]c2CCC)C1	ZINC001039246806	1344976237	/nfs/dbraw/zinc/97/62/37/1344976237.db2.gz	URYUGZZBHHJBKE-PXNSSMCTSA-N	0	3	341.499	3.307	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)Cc2ccc(C)s2)C1	ZINC001039250405	1344980976	/nfs/dbraw/zinc/98/09/76/1344980976.db2.gz	KHNUYBPDPGLQOR-HKUYNNGSSA-N	0	3	344.524	3.325	20	30		EGEDHN
Cc1cccc(CN2CC[C@H]3CC[C@@H](C2)N3C(=O)c2cc(C#N)c[nH]2)c1	ZINC001039355739	1345026327	/nfs/dbraw/zinc/02/63/27/1345026327.db2.gz	BYNKYCNRCIQIOK-MOPGFXCFSA-N	0	3	348.450	3.074	20	30		EGEDHN
Cc1cccc(CN2CC[C@H]3CC[C@@H](C2)N3C(=O)c2ccc(C#N)[nH]2)c1	ZINC001039357614	1345027170	/nfs/dbraw/zinc/02/71/70/1345027170.db2.gz	IFWWWVUJWBGOTC-MOPGFXCFSA-N	0	3	348.450	3.074	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H](C)c1c(C)n[nH]c1C	ZINC001039395709	1345044467	/nfs/dbraw/zinc/04/44/67/1345044467.db2.gz	GSPWCGVJNHLOCK-OLMNPRSZSA-N	0	3	344.503	3.162	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccc2c1O[C@H](C)C2	ZINC001039408672	1345052379	/nfs/dbraw/zinc/05/23/79/1345052379.db2.gz	XUMJYMHHCWRQAA-NXHRZFHOSA-N	0	3	340.467	3.265	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1nc2ccccc2cc1C	ZINC001039408254	1345052630	/nfs/dbraw/zinc/05/26/30/1345052630.db2.gz	GSZLHJUVEZXGSM-MOPGFXCFSA-N	0	3	347.462	3.245	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc(F)c(F)c1	ZINC001039424378	1345062015	/nfs/dbraw/zinc/06/20/15/1345062015.db2.gz	NSLORIUFJYZISX-CVEARBPZSA-N	0	3	334.410	3.149	20	30		EGEDHN
C=CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc([C@H](C)CC)no1	ZINC001039449236	1345073784	/nfs/dbraw/zinc/07/37/84/1345073784.db2.gz	OTPJFWIQBBYBSL-OAGGEKHMSA-N	0	3	331.460	3.443	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(C)cc2cn[nH]c21	ZINC001039451375	1345074741	/nfs/dbraw/zinc/07/47/41/1345074741.db2.gz	UCBZEAZODBKVPX-SJORKVTESA-N	0	3	338.455	3.126	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)Oc1ccc(C)cc1	ZINC001039467274	1345084544	/nfs/dbraw/zinc/08/45/44/1345084544.db2.gz	BOEMMCAMKMQSPJ-QRVBRYPASA-N	0	3	342.483	3.404	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)COc1ccccc1Cl	ZINC001039468965	1345086161	/nfs/dbraw/zinc/08/61/61/1345086161.db2.gz	OKJVOLYCOXXGEX-CVEARBPZSA-N	0	3	348.874	3.360	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)n1c(C)ccc1C	ZINC001039474434	1345089255	/nfs/dbraw/zinc/08/92/55/1345089255.db2.gz	IAMLJIFORCMJMC-QRVBRYPASA-N	0	3	329.488	3.307	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1Cc2c1cccc2Cl	ZINC001039476174	1345090952	/nfs/dbraw/zinc/09/09/52/1345090952.db2.gz	FQVIQULGRJBZKW-RVKKMQEKSA-N	0	3	342.870	3.068	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H]3CCC[C@@H](C2)N3CC[C@@H]2CCOC2)CC1	ZINC001039892022	1345235417	/nfs/dbraw/zinc/23/54/17/1345235417.db2.gz	RUBJXBHNSZBJRE-RLLQIKCJSA-N	0	3	346.515	3.225	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@]3(CCN(C(=O)C4CC=CC4)C3)C2)c1	ZINC001040130160	1345344307	/nfs/dbraw/zinc/34/43/07/1345344307.db2.gz	NAHLALOSGZVQIB-JOCHJYFZSA-N	0	3	349.478	3.339	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3cc4ccccc4nc3C)C2)C1	ZINC001040229753	1345385614	/nfs/dbraw/zinc/38/56/14/1345385614.db2.gz	WOYPRADWJOKZHM-JOCHJYFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3ccc(C(F)F)nc3)C2)C1	ZINC001040230589	1345385994	/nfs/dbraw/zinc/38/59/94/1345385994.db2.gz	DTSUFOIBEFGYAL-GOSISDBHSA-N	0	3	335.398	3.133	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@H]3CCC=CCCC3)C2)C1	ZINC001040256899	1345397745	/nfs/dbraw/zinc/39/77/45/1345397745.db2.gz	BEFJLAPJPSQDEJ-FPOVZHCZSA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(Cl)cc3F)C2)C1	ZINC001040281152	1345409983	/nfs/dbraw/zinc/40/99/83/1345409983.db2.gz	AJFYKLXAXPCIGN-GOSISDBHSA-N	0	3	334.822	3.040	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@H](C)c3c(F)cccc3F)C2)C1	ZINC001040292071	1345416001	/nfs/dbraw/zinc/41/60/01/1345416001.db2.gz	KQZMFCCBNNYYLB-QRWLVFNGSA-N	0	3	346.421	3.016	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)CCc3ccc(C)cc3C)C2)C1	ZINC001040320339	1345430038	/nfs/dbraw/zinc/43/00/38/1345430038.db2.gz	QOFAVKHPDPQGPM-QFIPXVFZSA-N	0	3	338.495	3.184	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3cc4c(ccc(C)c4C)[nH]3)C2)C1	ZINC001040322053	1345430956	/nfs/dbraw/zinc/43/09/56/1345430956.db2.gz	HGSHRUJRCRZHTJ-JOCHJYFZSA-N	0	3	349.478	3.346	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@]2(C1)CCCN(Cc1cccnc1)C2	ZINC001040323738	1345432731	/nfs/dbraw/zinc/43/27/31/1345432731.db2.gz	SUFFFUWAQPXGDA-NRFANRHFSA-N	0	3	341.499	3.498	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@]2(C1)CCCN(Cc1cnccc1C)C2	ZINC001040327668	1345434300	/nfs/dbraw/zinc/43/43/00/1345434300.db2.gz	GQCMRWHCCHEAKB-OAQYLSRUSA-N	0	3	341.499	3.417	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)C[C@@H](C)c3cccc(F)c3)C2)C1	ZINC001040383147	1345467944	/nfs/dbraw/zinc/46/79/44/1345467944.db2.gz	GFTPDSYRGTZJFU-DYESRHJHSA-N	0	3	342.458	3.267	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@@H]3CCCC(F)(F)C3)C2)C1	ZINC001040392048	1345472781	/nfs/dbraw/zinc/47/27/81/1345472781.db2.gz	SPZMINLTCXOOBJ-SJLPKXTDSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cccc(F)c3Cl)C2)C1	ZINC001040417125	1345485790	/nfs/dbraw/zinc/48/57/90/1345485790.db2.gz	BKRWAWKQZTVEAM-IBGZPJMESA-N	0	3	348.849	3.431	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@H](CC)OC3CCCC3)C2)C1	ZINC001040432296	1345494723	/nfs/dbraw/zinc/49/47/23/1345494723.db2.gz	RTMSQURBSAZAKM-FPOVZHCZSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3scnc3C3CC3)C2)C1	ZINC001040443808	1345502791	/nfs/dbraw/zinc/50/27/91/1345502791.db2.gz	MQIHNGNVVUZGRO-GOSISDBHSA-N	0	3	331.485	3.135	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@@]3(C)C[C@@H]3c3ccccc3)C2)C1	ZINC001040443980	1345503043	/nfs/dbraw/zinc/50/30/43/1345503043.db2.gz	OAZYAICTZGSCEJ-HJNYFJLDSA-N	0	3	336.479	3.128	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@H](C)c3ccccc3F)C2)C1	ZINC001040457552	1345509090	/nfs/dbraw/zinc/50/90/90/1345509090.db2.gz	XGDUVXLEASOKSD-UTKZUKDTSA-N	0	3	342.458	3.267	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3oc(CC)cc3C)C2)C1	ZINC001040493620	1345519888	/nfs/dbraw/zinc/51/98/88/1345519888.db2.gz	OVYWBVFWXSOLKY-HXUWFJFHSA-N	0	3	328.456	3.102	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cc(CC(C)C)c[nH]3)C2)C1	ZINC001040497451	1345520610	/nfs/dbraw/zinc/52/06/10/1345520610.db2.gz	SVAABJBXGJPFAY-NRFANRHFSA-N	0	3	341.499	3.165	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(OC(C)C)cc3)C2)C1	ZINC001040520254	1345531163	/nfs/dbraw/zinc/53/11/63/1345531163.db2.gz	SPQRNFJPOUFRBN-OAQYLSRUSA-N	0	3	340.467	3.035	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@@H](C)c3ccccc3C)C2)C1	ZINC001040539642	1345536747	/nfs/dbraw/zinc/53/67/47/1345536747.db2.gz	PXVWZAPMEMFADT-SIKLNZKXSA-N	0	3	338.495	3.436	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@@]3(C)CCC(C)=C(C)C3)C2)C1	ZINC001040548048	1345541947	/nfs/dbraw/zinc/54/19/47/1345541947.db2.gz	PFNLYEMGMZAYLW-SFTDATJTSA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@]3(C)CCC(C)=C(C)C3)C2)C1	ZINC001040548047	1345542275	/nfs/dbraw/zinc/54/22/75/1345542275.db2.gz	PFNLYEMGMZAYLW-RTWAWAEBSA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cc(F)cc4ccoc43)C2)CC1	ZINC001040754450	1345574722	/nfs/dbraw/zinc/57/47/22/1345574722.db2.gz	HPXOLBJSCFRRDM-UHFFFAOYSA-N	0	3	340.398	3.133	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)CCc3ccc(C)cc3C)C2)CC1	ZINC001040791246	1345578516	/nfs/dbraw/zinc/57/85/16/1345578516.db2.gz	IWZHFOJOAOJAOB-UHFFFAOYSA-N	0	3	338.495	3.184	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cc4c(cc(C)cc4C)[nH]3)C2)CC1	ZINC001040791412	1345578562	/nfs/dbraw/zinc/57/85/62/1345578562.db2.gz	LVSXKZCJGNMRFT-UHFFFAOYSA-N	0	3	349.478	3.346	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cc([C@@H](C)CC)no3)C2)CC1	ZINC001040875992	1345593185	/nfs/dbraw/zinc/59/31/85/1345593185.db2.gz	KUPPYRLZEVESAF-INIZCTEOSA-N	0	3	343.471	3.140	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccc(C(F)F)cc3)C2)CC1	ZINC001040882720	1345594123	/nfs/dbraw/zinc/59/41/23/1345594123.db2.gz	JBANTZKJPIZDOP-UHFFFAOYSA-N	0	3	332.394	3.186	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccc4cccnc4c3)C2)CC1	ZINC001040885876	1345594560	/nfs/dbraw/zinc/59/45/60/1345594560.db2.gz	XRFQBFOHSWOKRK-UHFFFAOYSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@@H](F)CC3CCCCC3)C2)CC1	ZINC001040914188	1345599135	/nfs/dbraw/zinc/59/91/35/1345599135.db2.gz	KYOQRKNPHNARIK-SFHVURJKSA-N	0	3	334.479	3.243	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccc(OCC)cc3)C2)CC1	ZINC001040929360	1345603255	/nfs/dbraw/zinc/60/32/55/1345603255.db2.gz	LUNXSVYORYZHHJ-UHFFFAOYSA-N	0	3	340.467	3.037	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@@H](C)n3c(C)ccc3C)C2)CC1	ZINC001040948772	1345607441	/nfs/dbraw/zinc/60/74/41/1345607441.db2.gz	ZYKLZYQRIBYKPS-LJQANCHMSA-N	0	3	341.499	3.004	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cc4cc(C)ccc4o3)C2)CC1	ZINC001040948619	1345607645	/nfs/dbraw/zinc/60/76/45/1345607645.db2.gz	VKEKZCUFDQFNAJ-UHFFFAOYSA-N	0	3	336.435	3.303	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)CC(C3CC3)C3CC3)C2)CC1	ZINC001040948290	1345607701	/nfs/dbraw/zinc/60/77/01/1345607701.db2.gz	NYCWDXHCSMRFPZ-UHFFFAOYSA-N	0	3	328.500	3.151	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@]3(CCN(C(=O)[C@@H]4CC=CCC4)C3)C2)c1	ZINC001041065138	1345641947	/nfs/dbraw/zinc/64/19/47/1345641947.db2.gz	YVRXNYDBFFMQJN-IFMALSPDSA-N	0	3	349.478	3.339	20	30		EGEDHN
C/C(=C/C(=O)N1CC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1)C1CC1	ZINC001041098321	1345651864	/nfs/dbraw/zinc/65/18/64/1345651864.db2.gz	RXTXIHCXLCDBJC-TWMGVTGTSA-N	0	3	349.478	3.339	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@]2(CCN(Cc3ccc(C#N)cc3)C2)C1)C1CC1	ZINC001041175168	1345666421	/nfs/dbraw/zinc/66/64/21/1345666421.db2.gz	RROZLDCVFNEZGP-IERDGZPVSA-N	0	3	337.467	3.029	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@]3(CCN(C(=O)[C@H]4[C@@H]5CCC[C@@H]54)C3)C2)c1	ZINC001041177315	1345667713	/nfs/dbraw/zinc/66/77/13/1345667713.db2.gz	FZRWSUIBPOTMTH-HIUFNZKISA-N	0	3	349.478	3.029	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3oc4ccc(F)cc4c3C)C2)C1	ZINC001041352772	1345708033	/nfs/dbraw/zinc/70/80/33/1345708033.db2.gz	BHYHLJYYGNSGLS-HXUWFJFHSA-N	0	3	340.398	3.052	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3cc4sccc4s3)C2)C1	ZINC001041407466	1345719862	/nfs/dbraw/zinc/71/98/62/1345719862.db2.gz	HNVARRYJFDXROX-QGZVFWFLSA-N	0	3	330.478	3.134	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)C3(CC)CCC(F)(F)CC3)C2)C1	ZINC001041414283	1345723214	/nfs/dbraw/zinc/72/32/14/1345723214.db2.gz	HIXAPHXCAWCFJJ-KRWDZBQOSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cc4ccccc4s3)C2)C1	ZINC001041447773	1345729787	/nfs/dbraw/zinc/72/97/87/1345729787.db2.gz	BZFJLJCMXNTALI-HXUWFJFHSA-N	0	3	338.476	3.463	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)Cc3cccc(C(F)F)c3)C2)C1	ZINC001041469141	1345736628	/nfs/dbraw/zinc/73/66/28/1345736628.db2.gz	XUGSTDCISPSMIE-HXUWFJFHSA-N	0	3	346.421	3.114	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@]3(CCN(Cc4cnccc4C)C3)C2)C1	ZINC001041652624	1345810994	/nfs/dbraw/zinc/81/09/94/1345810994.db2.gz	LXKQAIPOSFGIDY-NRFANRHFSA-N	0	3	339.483	3.171	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@]3(CCN(CCC(F)(F)F)C3)C2)C1	ZINC001041657720	1345813550	/nfs/dbraw/zinc/81/35/50/1345813550.db2.gz	TZGJUGUMNJETQZ-MRXNPFEDSA-N	0	3	330.394	3.220	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)[C@@H](CC)Cc3ccccc3C)C2)C1	ZINC001041785022	1345849505	/nfs/dbraw/zinc/84/95/05/1345849505.db2.gz	XFCFAZLMCPHKED-UGKGYDQZSA-N	0	3	338.495	3.121	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)[C@@H](C)c3ccc(F)cc3F)C2)C1	ZINC001041838764	1345868100	/nfs/dbraw/zinc/86/81/00/1345868100.db2.gz	BPALEKNAAUHDIX-MGPUTAFESA-N	0	3	346.421	3.016	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)[C@H](C)Cc3ccccc3C)C2)C1	ZINC001041850958	1345872832	/nfs/dbraw/zinc/87/28/32/1345872832.db2.gz	SDVPNXKEAUMNHW-DENIHFKCSA-N	0	3	338.495	3.121	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3oc4ccccc4c3CC)C2)C1	ZINC001041851544	1345873169	/nfs/dbraw/zinc/87/31/69/1345873169.db2.gz	HOEMGENEMMAOAB-OAQYLSRUSA-N	0	3	336.435	3.166	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CCN(C(=O)CCC4CC4)C[C@H]32)cc1	ZINC001041991167	1345914731	/nfs/dbraw/zinc/91/47/31/1345914731.db2.gz	YLDOSYOZBVEXFC-WOJBJXKFSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3oc(CC4CC4)nc3C)C[C@@H]21	ZINC001042064815	1345933580	/nfs/dbraw/zinc/93/35/80/1345933580.db2.gz	JUFIIBXNLXEJIS-SJORKVTESA-N	0	3	343.471	3.048	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(F)c(C(F)F)c3)C[C@@H]21	ZINC001042065588	1345934636	/nfs/dbraw/zinc/93/46/36/1345934636.db2.gz	WMIHKNYHCXXZLR-WBMJQRKESA-N	0	3	338.373	3.486	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3oc(C(F)F)cc3C)C[C@@H]21	ZINC001042100181	1345943696	/nfs/dbraw/zinc/94/36/96/1345943696.db2.gz	LLCCSAVFCRPWFZ-KBPBESRZSA-N	0	3	336.382	3.085	20	30		EGEDHN
C#CCN1CC[C@H]2CCN(C(=O)Cc3ccc(CCCC)cc3)C[C@H]21	ZINC001042138679	1345953883	/nfs/dbraw/zinc/95/38/83/1345953883.db2.gz	RHNXQRIEARDRTH-LEWJYISDSA-N	0	3	338.495	3.128	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(-c4ccccc4)on3)C[C@H]21	ZINC001042141708	1345954302	/nfs/dbraw/zinc/95/43/02/1345954302.db2.gz	IMUCSXYFASLICF-CRAIPNDOSA-N	0	3	337.423	3.064	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc4c(c3)C(C)(C)CO4)C[C@@H]21	ZINC001042147743	1345957029	/nfs/dbraw/zinc/95/70/29/1345957029.db2.gz	HJXCHUNWJMADOZ-QAPCUYQASA-N	0	3	340.467	3.079	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(-c4ccco4)o3)C[C@H]21	ZINC001042150450	1345957242	/nfs/dbraw/zinc/95/72/42/1345957242.db2.gz	VIBZZXKQRQUURR-LSDHHAIUSA-N	0	3	326.396	3.262	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3nc4ccccc4cc3C)C[C@H]21	ZINC001042155821	1345958543	/nfs/dbraw/zinc/95/85/43/1345958543.db2.gz	NJBYITOABKFVQC-QFBILLFUSA-N	0	3	335.451	3.266	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cc(C)ccc3C3CC3)C[C@@H]21	ZINC001042162503	1345961217	/nfs/dbraw/zinc/96/12/17/1345961217.db2.gz	IXGQYRRKPGWEFJ-NQIIRXRSSA-N	0	3	336.479	3.432	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2CCN(Cc3cnccc3C)[C@H]2C1	ZINC001042182170	1345970591	/nfs/dbraw/zinc/97/05/91/1345970591.db2.gz	CJEAFHHGXVIGSE-MJGOQNOKSA-N	0	3	341.499	3.415	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3ccc(F)cc3)[C@@H]2C1	ZINC001042184826	1345972823	/nfs/dbraw/zinc/97/28/23/1345972823.db2.gz	ZTDAPWSSLYKKBW-SJLPKXTDSA-N	0	3	330.447	3.461	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3ccc(OC)cc3)[C@@H]2C1	ZINC001042186199	1345973464	/nfs/dbraw/zinc/97/34/64/1345973464.db2.gz	DXBMMNJHOWDTSH-PKOBYXMFSA-N	0	3	342.483	3.330	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)C(C3CCC3)C3CCC3)C[C@H]21	ZINC001042201769	1345982031	/nfs/dbraw/zinc/98/20/31/1345982031.db2.gz	QOLKEQSAQLGTBE-QFBILLFUSA-N	0	3	328.500	3.149	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3c(F)cc(F)cc3F)C[C@@H]21	ZINC001042207530	1345985774	/nfs/dbraw/zinc/98/57/74/1345985774.db2.gz	PCPLGQILJZPQOD-WBMJQRKESA-N	0	3	338.373	3.216	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]3CCN(Cc4ccc(C#N)cc4)[C@@H]3C2)C1	ZINC001042224312	1345994392	/nfs/dbraw/zinc/99/43/92/1345994392.db2.gz	LKEMDJRSLCFCNI-VQTJNVASSA-N	0	3	349.478	3.337	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)Cc3ccc(C(C)(C)C)cc3)C[C@@H]21	ZINC001042247262	1346004679	/nfs/dbraw/zinc/00/46/79/1346004679.db2.gz	NLFGMIHQXIWMIU-QUCCMNQESA-N	0	3	338.495	3.083	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(F)cc4cccnc43)C[C@@H]21	ZINC001042254636	1346007680	/nfs/dbraw/zinc/00/76/80/1346007680.db2.gz	MUTPFTHUYZZNTN-KSSFIOAISA-N	0	3	339.414	3.096	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3oc(CC(C)C)nc3C)C[C@H]21	ZINC001042261866	1346009738	/nfs/dbraw/zinc/00/97/38/1346009738.db2.gz	AQMIGBHXVDLQJZ-DLBZAZTESA-N	0	3	345.487	3.294	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C3(Cc4ccccc4F)CC3)C[C@@H]21	ZINC001042266544	1346012225	/nfs/dbraw/zinc/01/22/25/1346012225.db2.gz	NHODBXPROZMDMP-LPHOPBHVSA-N	0	3	342.458	3.257	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc4nc(C)sc4c3)C[C@H]21	ZINC001042297130	1346021817	/nfs/dbraw/zinc/02/18/17/1346021817.db2.gz	AISDQHMIINZHBT-WMLDXEAASA-N	0	3	341.480	3.327	20	30		EGEDHN
C#CCN1CC[C@H]2CCN(C(=O)c3ccc(Cl)c4occc43)C[C@@H]21	ZINC001042309003	1346027630	/nfs/dbraw/zinc/02/76/30/1346027630.db2.gz	JFUFSGJUQHRLMI-GUYCJALGSA-N	0	3	342.826	3.256	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3sccc3C(F)F)C[C@@H]21	ZINC001042330873	1346038371	/nfs/dbraw/zinc/03/83/71/1346038371.db2.gz	IFQVRLUAWSKSBV-OCCSQVGLSA-N	0	3	338.423	3.245	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)COc3c(C)cc(C)cc3C)C[C@H]21	ZINC001042331907	1346039072	/nfs/dbraw/zinc/03/90/72/1346039072.db2.gz	GBVWQOFYVVYUKC-RTBURBONSA-N	0	3	342.483	3.099	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)CCc3c[nH]c4ccccc34)C[C@@H]21	ZINC001042337050	1346042987	/nfs/dbraw/zinc/04/29/87/1346042987.db2.gz	CSMKPVWOQFVOIS-UWJYYQICSA-N	0	3	349.478	3.047	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cc(C)nc4ccccc43)C[C@@H]21	ZINC001042339519	1346044131	/nfs/dbraw/zinc/04/41/31/1346044131.db2.gz	XUMXDYRGQLVYPC-UTKZUKDTSA-N	0	3	347.462	3.103	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc(OC(C)C)cc3)C[C@H]21	ZINC001042344687	1346048014	/nfs/dbraw/zinc/04/80/14/1346048014.db2.gz	ZMYKNHUZPHPMCX-YLJYHZDGSA-N	0	3	340.467	3.034	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3csc4c3CCCC4)C[C@@H]21	ZINC001042346295	1346048536	/nfs/dbraw/zinc/04/85/36/1346048536.db2.gz	RKUWFLQBJKBTND-YOEHRIQHSA-N	0	3	330.497	3.349	20	30		EGEDHN
Cc1occc1C(=O)N1CC[C@H](NCc2ccccc2C#N)C[C@H]1C	ZINC001044453549	1346336702	/nfs/dbraw/zinc/33/67/02/1346336702.db2.gz	VIKZBNAKBQQARJ-KDOFPFPSSA-N	0	3	337.423	3.243	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3nccn3CC)C[C@@H]2C)CC1	ZINC001044729886	1346414414	/nfs/dbraw/zinc/41/44/14/1346414414.db2.gz	LFMCDUMTTCFPFA-FUHWJXTLSA-N	0	3	344.503	3.119	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3nccs3)C[C@@H]2C)CC1	ZINC001044730061	1346414589	/nfs/dbraw/zinc/41/45/89/1346414589.db2.gz	MZZWOYHJAKKEPS-HOCLYGCPSA-N	0	3	333.501	3.359	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3ocnc3C)C[C@H]2C)CC1	ZINC001044732034	1346415425	/nfs/dbraw/zinc/41/54/25/1346415425.db2.gz	ZAVBQVZASWYNSF-RHSMWYFYSA-N	0	3	331.460	3.199	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@H]2CNCc2cncc(C)c2)CC1	ZINC001045181949	1346517297	/nfs/dbraw/zinc/51/72/97/1346517297.db2.gz	HFHAQEPEFCTVHX-IBGZPJMESA-N	0	3	327.472	3.217	20	30		EGEDHN
C[C@@H]1CC[C@@H](C(=O)NC2(C)CCN(Cc3ccc(C#N)cc3)CC2)C1	ZINC001045579484	1346635059	/nfs/dbraw/zinc/63/50/59/1346635059.db2.gz	DPZBYSYCMBZJGZ-VQIMIIECSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1ccc(C#N)cc1)C1CC1	ZINC001045747383	1346687074	/nfs/dbraw/zinc/68/70/74/1346687074.db2.gz	LZBSXRXXEZHHNK-BEVDRBHNSA-N	0	3	337.467	3.170	20	30		EGEDHN
Cc1cc[nH]c1C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1ccc(C#N)cc1	ZINC001045769952	1346693304	/nfs/dbraw/zinc/69/33/04/1346693304.db2.gz	ZQPDQNINRPLANH-MOPGFXCFSA-N	0	3	348.450	3.074	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc(Cl)o1)C2	ZINC001045912967	1346750352	/nfs/dbraw/zinc/75/03/52/1346750352.db2.gz	ODVWXFYASHMJPU-GOSISDBHSA-N	0	3	334.847	3.275	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1oc(C)cc1C)C2	ZINC001045932177	1346769767	/nfs/dbraw/zinc/76/97/67/1346769767.db2.gz	ZSLBOBMUWGTIPD-FQEVSTJZSA-N	0	3	328.456	3.238	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@]1(C)CC=CCC1)C2	ZINC001045940095	1346775515	/nfs/dbraw/zinc/77/55/15/1346775515.db2.gz	PZRNRFJBMDRLIN-RTWAWAEBSA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cscc1Cl)C2	ZINC001045946171	1346782320	/nfs/dbraw/zinc/78/23/20/1346782320.db2.gz	KNFDUPGZPJWLHC-QGZVFWFLSA-N	0	3	336.888	3.353	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)C13CCC(CC1)C3)C2	ZINC001045949176	1346784062	/nfs/dbraw/zinc/78/40/62/1346784062.db2.gz	ZHOLJFMDDQREDA-CKHPTIKVSA-N	0	3	328.500	3.295	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1c(C)[nH]c3ccccc31)C2	ZINC001045950889	1346786070	/nfs/dbraw/zinc/78/60/70/1346786070.db2.gz	OBNRBNTXVLCECW-JOCHJYFZSA-N	0	3	349.478	3.428	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1c(C)cncc1C)C2	ZINC001045952301	1346787536	/nfs/dbraw/zinc/78/75/36/1346787536.db2.gz	LGEDMGZVQBAZNK-OAQYLSRUSA-N	0	3	339.483	3.040	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc(OC)cs1)C2	ZINC001045956823	1346792258	/nfs/dbraw/zinc/79/22/58/1346792258.db2.gz	UESCHPQMBOKFAN-IBGZPJMESA-N	0	3	346.496	3.098	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H]1C[C@H]1CC(C)C)C2	ZINC001045968270	1346802812	/nfs/dbraw/zinc/80/28/12/1346802812.db2.gz	MGVYJHDSAYNPNM-SFHLNBCPSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H]1CC13CCCC3)C2	ZINC001045976150	1346812215	/nfs/dbraw/zinc/81/22/15/1346812215.db2.gz	SBGODJDDOXMAAT-AZUAARDMSA-N	0	3	328.500	3.295	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc3sccc3[nH]1)C2	ZINC001045979079	1346815761	/nfs/dbraw/zinc/81/57/61/1346815761.db2.gz	OXLNEMOYYQLADT-LJQANCHMSA-N	0	3	341.480	3.181	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ncsc1C(C)C)C2	ZINC001045978884	1346816064	/nfs/dbraw/zinc/81/60/64/1346816064.db2.gz	KJULDNGNTGVQTC-IBGZPJMESA-N	0	3	345.512	3.218	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)C[C@H](C)c1ccco1)C2	ZINC001045979843	1346817761	/nfs/dbraw/zinc/81/77/61/1346817761.db2.gz	KLWWTLIBHFBJEP-FXAWDEMLSA-N	0	3	328.456	3.111	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H](C)c1ccc(C)cc1)C2	ZINC001045981171	1346819879	/nfs/dbraw/zinc/81/98/79/1346819879.db2.gz	QJUSRCUCTHPBGT-SIKLNZKXSA-N	0	3	338.495	3.436	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc(Cl)s1)C2	ZINC001045982165	1346820802	/nfs/dbraw/zinc/82/08/02/1346820802.db2.gz	QBWBAVCGXPUKTO-KRWDZBQOSA-N	0	3	336.888	3.353	20	30		EGEDHN
C[C@@]1(NC(=O)c2cc(C#N)c[nH]2)CCN(Cc2ccc(C3CC3)cc2)C1	ZINC001046222749	1346897452	/nfs/dbraw/zinc/89/74/52/1346897452.db2.gz	CJPKFTATMDVVQX-OAQYLSRUSA-N	0	3	348.450	3.158	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2ccc(-c3cnco3)cc2)C1	ZINC001046426379	1346972749	/nfs/dbraw/zinc/97/27/49/1346972749.db2.gz	UDXRTXGXDVYBMA-IBGZPJMESA-N	0	3	325.412	3.112	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2nsc3ccc(C)cc32)C1	ZINC001046537138	1347007979	/nfs/dbraw/zinc/00/79/79/1347007979.db2.gz	IMQKEKPYHIRGDZ-SFHVURJKSA-N	0	3	329.469	3.375	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2ncc(Cl)cc2Cl)C1	ZINC001046727246	1347074801	/nfs/dbraw/zinc/07/48/01/1347074801.db2.gz	BDAQDUSPDHMLEG-HNNXBMFYSA-N	0	3	328.243	3.159	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@]2(C)CCN([C@@H](C)c3ccccc3)C2)cn1	ZINC001046778531	1347096311	/nfs/dbraw/zinc/09/63/11/1347096311.db2.gz	HDKJCTMSTVXUJF-HRAATJIYSA-N	0	3	333.435	3.018	20	30		EGEDHN
C#CCCN1CC[C@](C)(NC(=O)c2ccc(Cl)cc2Cl)C1	ZINC001046791575	1347104005	/nfs/dbraw/zinc/10/40/05/1347104005.db2.gz	JMLIUXXLPKOABW-INIZCTEOSA-N	0	3	325.239	3.211	20	30		EGEDHN
C#CCCN1CC[C@](C)(NC(=O)c2coc3ccc(Cl)cc23)C1	ZINC001046800736	1347110266	/nfs/dbraw/zinc/11/02/66/1347110266.db2.gz	AEUVDGKZZXMUGG-SFHVURJKSA-N	0	3	330.815	3.304	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2ccc(C)s2)C1	ZINC001046910829	1347149979	/nfs/dbraw/zinc/14/99/79/1347149979.db2.gz	RUEPGKIXEQPAER-CYBMUJFWSA-N	0	3	328.428	3.320	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2c[nH]c3ccccc23)C1	ZINC001046954894	1347163804	/nfs/dbraw/zinc/16/38/04/1347163804.db2.gz	VFSUZJYUWBFDEB-AWEZNQCLSA-N	0	3	347.409	3.431	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2ccc(CF)cc2)C1	ZINC001046993439	1347176348	/nfs/dbraw/zinc/17/63/48/1347176348.db2.gz	FDUFQQUBJGQYJP-INIZCTEOSA-N	0	3	340.389	3.419	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@@H](CNC(=O)[C@H]2CCCC(C)(C)C2)C1	ZINC001046995857	1347178348	/nfs/dbraw/zinc/17/83/48/1347178348.db2.gz	LXPPGTYBEPCAMS-HOTGVXAUSA-N	0	3	340.458	3.300	20	30		EGEDHN
CCC(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1ccc(Cl)cc1)C2	ZINC001047002120	1347181835	/nfs/dbraw/zinc/18/18/35/1347181835.db2.gz	UXXNWXAEEXOMLF-SZMVWBNQSA-N	0	3	330.859	3.071	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)N(Cc2conc2C)C3)CC1	ZINC001047139459	1347217930	/nfs/dbraw/zinc/21/79/30/1347217930.db2.gz	VMJDEHBIKWSQOI-IPELMVKDSA-N	0	3	343.471	3.199	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@H]3C[C@@H](C2)N(Cc2cc(C)ns2)C3)C1	ZINC001047142628	1347218883	/nfs/dbraw/zinc/21/88/83/1347218883.db2.gz	HAOMUIYYQISJQB-JYJNAYRXSA-N	0	3	345.512	3.277	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2C#N)C3)C1	ZINC001047144009	1347219546	/nfs/dbraw/zinc/21/95/46/1347219546.db2.gz	WTPNIHZFIBKZJF-VDGAXYAQSA-N	0	3	349.478	3.384	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)c3cc(Cl)c[nH]3)C2)CC1	ZINC001047223840	1347254324	/nfs/dbraw/zinc/25/43/24/1347254324.db2.gz	QZMMFCLLNCOTMU-INIZCTEOSA-N	0	3	347.890	3.256	20	30		EGEDHN
C=CC[NH+]1CCC([C@@H]2CCCN(C(=O)c3ccccc3[O-])C2)CC1	ZINC001047230199	1347259580	/nfs/dbraw/zinc/25/95/80/1347259580.db2.gz	SDRJBJRTFLQQDC-QGZVFWFLSA-N	0	3	328.456	3.142	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)CCc3ccoc3)C2)CC1	ZINC001047235161	1347263280	/nfs/dbraw/zinc/26/32/80/1347263280.db2.gz	VQGPTUGOEMWVKW-FQEVSTJZSA-N	0	3	342.483	3.186	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3ccc(F)c(F)c3)C2)CC1	ZINC001047244393	1347270043	/nfs/dbraw/zinc/27/00/43/1347270043.db2.gz	RFGYPFWHINUGLU-QGZVFWFLSA-N	0	3	346.421	3.162	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)C34CCC(CC3)C4)C2)CC1	ZINC001047245174	1347270341	/nfs/dbraw/zinc/27/03/41/1347270341.db2.gz	XDEIENANPGQJAN-MOMVYJMYSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@]3(C)C[C@H]4C[C@H]4C3)C2)CC1	ZINC001047249568	1347274043	/nfs/dbraw/zinc/27/40/43/1347274043.db2.gz	BDFMRBOIAHTPFX-WERVVEIQSA-N	0	3	328.500	3.006	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@H]3CCCC3(C)C)C2)CC1	ZINC001047250009	1347274775	/nfs/dbraw/zinc/27/47/75/1347274775.db2.gz	YWHNETQOZURXRL-RBUKOAKNSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3ccc(F)c(C)c3)C2)CC1	ZINC001047252871	1347277321	/nfs/dbraw/zinc/27/73/21/1347277321.db2.gz	LMMZOBRUWYQVHM-LJQANCHMSA-N	0	3	342.458	3.332	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@@H](C)c3cccs3)C2)CC1	ZINC001047254742	1347278861	/nfs/dbraw/zinc/27/88/61/1347278861.db2.gz	RPSXOWPNVWBNIX-WMZOPIPTSA-N	0	3	344.524	3.435	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3cccc4cc[nH]c43)C2)CC1	ZINC001047257599	1347280817	/nfs/dbraw/zinc/28/08/17/1347280817.db2.gz	ROOXYQYJMLFAMH-IBGZPJMESA-N	0	3	349.478	3.365	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@@H](C)Cc3ccco3)C2)CC1	ZINC001047257734	1347280890	/nfs/dbraw/zinc/28/08/90/1347280890.db2.gz	PNOLTEAVMYHKQU-PKOBYXMFSA-N	0	3	342.483	3.042	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)C3(CF)CCC3)C2)CC1	ZINC001047259195	1347281642	/nfs/dbraw/zinc/28/16/42/1347281642.db2.gz	MDDDYINYUNXOGG-GOSISDBHSA-N	0	3	334.479	3.100	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3csc(C)c3)C2)CC1	ZINC001047260772	1347282868	/nfs/dbraw/zinc/28/28/68/1347282868.db2.gz	WDUATODVKPYDRS-KRWDZBQOSA-N	0	3	330.497	3.254	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@H]3CC34CCCC4)C2)CC1	ZINC001047262507	1347283618	/nfs/dbraw/zinc/28/36/18/1347283618.db2.gz	QXRSVDZYAMBTGQ-RBUKOAKNSA-N	0	3	328.500	3.151	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)CC2CCCC2)C1	ZINC001047695099	1347335878	/nfs/dbraw/zinc/33/58/78/1347335878.db2.gz	QCLFIYJUBSHHPZ-OXQOHEQNSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2ccn(C3CCCCC3)n2)C1	ZINC001079695688	1357349480	/nfs/dbraw/zinc/34/94/80/1357349480.db2.gz	JTJGCZMWLGONTE-CRAIPNDOSA-N	0	3	330.476	3.015	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H]([C@H](C)NCc3nccs3)C2)CC1	ZINC001047958153	1347423862	/nfs/dbraw/zinc/42/38/62/1347423862.db2.gz	GUPFWMUHPWHZBT-GOEBONIOSA-N	0	3	333.501	3.216	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H]([C@H](C)NCc3cc(C)no3)C2)CC1	ZINC001047960596	1347424878	/nfs/dbraw/zinc/42/48/78/1347424878.db2.gz	UNXRFYWWYUHEAT-RDJZCZTQSA-N	0	3	331.460	3.056	20	30		EGEDHN
CC(C)C1(C(=O)N2CC[C@H]([C@H](C)NCc3ccccc3C#N)C2)CC1	ZINC001047969279	1347428549	/nfs/dbraw/zinc/42/85/49/1347428549.db2.gz	GONYANYGTNWFSE-LPHOPBHVSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@H](C)[C@@H](CNCc2cscn2)C1	ZINC001048272249	1347507652	/nfs/dbraw/zinc/50/76/52/1347507652.db2.gz	WZRDIUVZXQDCKH-AAEUAGOBSA-N	0	3	341.908	3.106	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H](C)[C@H](CNCc2csc(CC)n2)C1	ZINC001048340359	1347523073	/nfs/dbraw/zinc/52/30/73/1347523073.db2.gz	RGRSIUVVGVZTLZ-UONOGXRCSA-N	0	3	335.517	3.102	20	30		EGEDHN
CCC1(C(=O)N2C[C@@H](C)[C@@H](CNCc3ccccc3C#N)C2)CCC1	ZINC001048342059	1347524135	/nfs/dbraw/zinc/52/41/35/1347524135.db2.gz	GGVFAEYFMDYROR-APWZRJJASA-N	0	3	339.483	3.323	20	30		EGEDHN
CCC1(C(=O)N2C[C@H](C)[C@@H](CNCc3cc(F)ccc3C#N)C2)CC1	ZINC001048379472	1347536824	/nfs/dbraw/zinc/53/68/24/1347536824.db2.gz	PJORIBOFKILXKU-YOEHRIQHSA-N	0	3	343.446	3.072	20	30		EGEDHN
CC(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2CC#Cc1cccc(Cl)c1	ZINC001048493446	1347566104	/nfs/dbraw/zinc/56/61/04/1347566104.db2.gz	YNHKBBGHPRYZAS-GGPHIMKMSA-N	0	3	330.859	3.071	20	30		EGEDHN
C[C@@H](C(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@H]2C1)C(C)(C)C	ZINC001048893364	1347678552	/nfs/dbraw/zinc/67/85/52/1347678552.db2.gz	VGOHDCLSEPAPMH-ZYSHUDEJSA-N	0	3	339.483	3.131	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C(C)(C)c3ccc(Cl)cc3)C[C@@H]2C1	ZINC001049023209	1347708748	/nfs/dbraw/zinc/70/87/48/1347708748.db2.gz	QAYKXQHTUKTBSC-IYBDPMFKSA-N	0	3	344.886	3.031	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc(Cl)c4occc43)C[C@@H]2C1	ZINC001049166432	1347738099	/nfs/dbraw/zinc/73/80/99/1347738099.db2.gz	BKKDDQULPHKMIG-OKILXGFUSA-N	0	3	342.826	3.113	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N1CCC[C@H]2[C@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049415504	1347838567	/nfs/dbraw/zinc/83/85/67/1347838567.db2.gz	LKAIZHOVZJRDIQ-CEXWTWQISA-N	0	3	337.467	3.170	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1nc(C(C)C)oc1C	ZINC001049468407	1347864079	/nfs/dbraw/zinc/86/40/79/1347864079.db2.gz	HNGDMRLCFRVKPI-HZPDHXFCSA-N	0	3	331.460	3.361	20	30		EGEDHN
C=CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cnc([C@@H](C)OC)s1	ZINC001049472255	1347865559	/nfs/dbraw/zinc/86/55/59/1347865559.db2.gz	ADGQTFFWFLIIMS-RBSFLKMASA-N	0	3	349.500	3.106	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1sc(C2CC2)nc1C	ZINC001049475122	1347866866	/nfs/dbraw/zinc/86/68/66/1347866866.db2.gz	NFBPCZHSSFOVFL-JKSUJKDBSA-N	0	3	343.496	3.031	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc2ccccc2nc1C	ZINC001049514191	1347886725	/nfs/dbraw/zinc/88/67/25/1347886725.db2.gz	YHBOWDBOLUQYHY-PMACEKPBSA-N	0	3	335.451	3.408	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(C2CC2)n(CC)n1	ZINC001049516665	1347887716	/nfs/dbraw/zinc/88/77/16/1347887716.db2.gz	DZZCHFTXBGONOX-ROUUACIJSA-N	0	3	342.487	3.035	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(-c2ccncc2)o1	ZINC001049517288	1347888013	/nfs/dbraw/zinc/88/80/13/1347888013.db2.gz	IHYRLUPDJYUGHK-ROUUACIJSA-N	0	3	349.434	3.044	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cn(C)c2ccc(F)cc12	ZINC001049522151	1347890491	/nfs/dbraw/zinc/89/04/91/1347890491.db2.gz	DNIUJWUMYZAICJ-MOPGFXCFSA-N	0	3	341.430	3.182	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1c(C)noc1C(C)C	ZINC001049531246	1347894640	/nfs/dbraw/zinc/89/46/40/1347894640.db2.gz	IWILCAYKLPMIQO-HOTGVXAUSA-N	0	3	331.460	3.361	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1nccc2ccsc21	ZINC001049535820	1347896849	/nfs/dbraw/zinc/89/68/49/1347896849.db2.gz	KDEOTMRNGORJGF-GJZGRUSLSA-N	0	3	327.453	3.161	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(C)c2ccccc2n1	ZINC001049552324	1347905331	/nfs/dbraw/zinc/90/53/31/1347905331.db2.gz	NADSBXJICTZRPM-PMACEKPBSA-N	0	3	335.451	3.408	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cnoc1-c1ccco1	ZINC001049556889	1347907520	/nfs/dbraw/zinc/90/75/20/1347907520.db2.gz	CRLSNSGXZJWKAQ-JKSUJKDBSA-N	0	3	341.411	3.190	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(-c2ccccc2)on1	ZINC001049584886	1347922797	/nfs/dbraw/zinc/92/27/97/1347922797.db2.gz	XGOAXNQFPIHXJI-MOPGFXCFSA-N	0	3	349.434	3.044	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(F)ccc1OC	ZINC001049630536	1347943647	/nfs/dbraw/zinc/94/36/47/1347943647.db2.gz	QTJWDDOQWNROJC-IAGOWNOFSA-N	0	3	332.419	3.089	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(F)ccc1OC	ZINC001049630535	1347943811	/nfs/dbraw/zinc/94/38/11/1347943811.db2.gz	QTJWDDOQWNROJC-DLBZAZTESA-N	0	3	332.419	3.089	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C(C1CCC1)C1CCC1	ZINC001049674084	1347966954	/nfs/dbraw/zinc/96/69/54/1347966954.db2.gz	BOTDKUPBBAQZLH-RBUKOAKNSA-N	0	3	328.500	3.291	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(F)c(Cl)cc1F	ZINC001049678587	1347969026	/nfs/dbraw/zinc/96/90/26/1347969026.db2.gz	CAVZZMUVNZYZFZ-HZPDHXFCSA-N	0	3	340.801	3.483	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ncccc1OCCC	ZINC001049688766	1347972435	/nfs/dbraw/zinc/97/24/35/1347972435.db2.gz	WXFDOOKEPSRKAZ-DLBZAZTESA-N	0	3	343.471	3.125	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1c(C)cc(C)cc1C	ZINC001049691862	1347974304	/nfs/dbraw/zinc/97/43/04/1347974304.db2.gz	CDKSQXHJOQVURY-NHCUHLMSSA-N	0	3	338.495	3.243	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]3[C@@H]2CCN3Cc2cccnc2C)C1	ZINC001049707641	1347983861	/nfs/dbraw/zinc/98/38/61/1347983861.db2.gz	DSHIAWVPBHFSDH-OALUTQOASA-N	0	3	339.483	3.312	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C[C@@H](C)c1cccc(F)c1	ZINC001049710848	1347986000	/nfs/dbraw/zinc/98/60/00/1347986000.db2.gz	YKXFCFWIMLMAGA-ATZDWAIDSA-N	0	3	328.431	3.018	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C[C@H](C)c1cccc(F)c1	ZINC001049710851	1347986254	/nfs/dbraw/zinc/98/62/54/1347986254.db2.gz	YKXFCFWIMLMAGA-ZYSHUDEJSA-N	0	3	328.431	3.018	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C[C@@H](C)c1cccc(F)c1	ZINC001049710849	1347986269	/nfs/dbraw/zinc/98/62/69/1347986269.db2.gz	YKXFCFWIMLMAGA-AYOQOUSVSA-N	0	3	328.431	3.018	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]3[C@H]2CCN3Cc2ncccc2C)C1	ZINC001049712366	1347986412	/nfs/dbraw/zinc/98/64/12/1347986412.db2.gz	QBVWPYSOCFWIMZ-RBUKOAKNSA-N	0	3	339.483	3.312	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)[C@H]2CC23CCC3)c1	ZINC001049750932	1348000403	/nfs/dbraw/zinc/00/04/03/1348000403.db2.gz	AHVNTAPFIAAMNL-HSALFYBXSA-N	0	3	349.478	3.314	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](C)Cc1cccs1	ZINC001049761453	1348006501	/nfs/dbraw/zinc/00/65/01/1348006501.db2.gz	KIBSBBISLCPBIZ-KBAYOESNSA-N	0	3	330.497	3.015	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1ccc(Cl)s1	ZINC001049771061	1348013375	/nfs/dbraw/zinc/01/33/75/1348013375.db2.gz	VQOKCNKCWZVABQ-HUUCEWRRSA-N	0	3	336.888	3.033	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1oc(C(C)C)nc1C	ZINC001049774558	1348015190	/nfs/dbraw/zinc/01/51/90/1348015190.db2.gz	XIPJNXMWIFRLSM-JKSUJKDBSA-N	0	3	331.460	3.361	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)[C@@H]2C[C@H]2C2CC2)cc1	ZINC001049778954	1348017964	/nfs/dbraw/zinc/01/79/64/1348017964.db2.gz	ZYZXAIRGTWHDRU-JSXRDJHFSA-N	0	3	349.478	3.170	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1csc(C(C)(C)C)n1	ZINC001049784778	1348020768	/nfs/dbraw/zinc/02/07/68/1348020768.db2.gz	WRYXRQIHKCMOKB-GJZGRUSLSA-N	0	3	333.501	3.306	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H]1CCO[C@H]1c1ccccc1	ZINC001049785270	1348021260	/nfs/dbraw/zinc/02/12/60/1348021260.db2.gz	YINQTPDIUPLVRI-WTGUMLROSA-N	0	3	340.467	3.016	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](C)c1cc(C)oc1C	ZINC001049791269	1348024038	/nfs/dbraw/zinc/02/40/38/1348024038.db2.gz	RMMUBQDSQKOGST-KFKAGJAMSA-N	0	3	328.456	3.089	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(Cl)cc(OC)c1	ZINC001049800436	1348026395	/nfs/dbraw/zinc/02/63/95/1348026395.db2.gz	BHSQWQWCKUHFPT-IRXDYDNUSA-N	0	3	334.847	3.214	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cccn1C1CCCC1	ZINC001049812733	1348032425	/nfs/dbraw/zinc/03/24/25/1348032425.db2.gz	XNKJAPBTDQYZGE-QZTJIDSGSA-N	0	3	327.472	3.468	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)CCc1cc(C)cc(C)c1	ZINC001049832239	1348045699	/nfs/dbraw/zinc/04/56/99/1348045699.db2.gz	UTDBYYDWJJYSIV-LEWJYISDSA-N	0	3	338.495	3.325	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1c[nH]nc1C1CCCCC1	ZINC001049843257	1348054184	/nfs/dbraw/zinc/05/41/84/1348054184.db2.gz	OKZNPGOLAWZULD-QZTJIDSGSA-N	0	3	342.487	3.322	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1cccc2ccccc21	ZINC001049853079	1348059578	/nfs/dbraw/zinc/05/95/78/1348059578.db2.gz	CABLJABSYNKGOV-FCHUYYIVSA-N	0	3	346.474	3.471	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1oc2ccccc2c1C	ZINC001049877020	1348081759	/nfs/dbraw/zinc/08/17/59/1348081759.db2.gz	OTLRXJYSVJEPCM-ROUUACIJSA-N	0	3	336.435	3.443	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1oc2ccccc2c1C	ZINC001049877019	1348081975	/nfs/dbraw/zinc/08/19/75/1348081975.db2.gz	OTLRXJYSVJEPCM-QZTJIDSGSA-N	0	3	336.435	3.443	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1sccc1C1CC1	ZINC001049877882	1348083229	/nfs/dbraw/zinc/08/32/29/1348083229.db2.gz	SBYZPHVHLFIFPZ-IAGOWNOFSA-N	0	3	328.481	3.328	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc2c(c1)CCCC2	ZINC001049878822	1348083472	/nfs/dbraw/zinc/08/34/72/1348083472.db2.gz	VQKPPTODMUKNTB-LEWJYISDSA-N	0	3	336.479	3.268	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(OC)c(Cl)c1	ZINC001049888743	1348092912	/nfs/dbraw/zinc/09/29/12/1348092912.db2.gz	KBEBRIVXRDRPHI-CVEARBPZSA-N	0	3	334.847	3.214	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1ccc2ccccc2c1	ZINC001049890650	1348095032	/nfs/dbraw/zinc/09/50/32/1348095032.db2.gz	XOMMEFYJACIYBR-FCHUYYIVSA-N	0	3	346.474	3.471	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc2c(cccc2OC)[nH]1	ZINC001049892056	1348095833	/nfs/dbraw/zinc/09/58/33/1348095833.db2.gz	YZGXHGUPEVPVJD-ROUUACIJSA-N	0	3	339.439	3.041	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(C2CCCC2)no1	ZINC001049901642	1348101648	/nfs/dbraw/zinc/10/16/48/1348101648.db2.gz	ZYCGXVUMNFJXKA-ZWKOTPCHSA-N	0	3	341.455	3.034	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](C)c1ccc(F)cc1F	ZINC001049904182	1348102941	/nfs/dbraw/zinc/10/29/41/1348102941.db2.gz	NEOAECRJMKWWDI-ZOCIIQOWSA-N	0	3	346.421	3.157	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](C)c1cccc(F)c1	ZINC001049905184	1348103592	/nfs/dbraw/zinc/10/35/92/1348103592.db2.gz	VWFRMKJXQSQFGC-ATZDWAIDSA-N	0	3	328.431	3.018	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(F)c2occc21	ZINC001049907894	1348105814	/nfs/dbraw/zinc/10/58/14/1348105814.db2.gz	LBWMHUIHRNIZAU-IRXDYDNUSA-N	0	3	328.387	3.437	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](C)Cc1ccc(C)cc1	ZINC001049914107	1348109122	/nfs/dbraw/zinc/10/91/22/1348109122.db2.gz	MSRYHCDGIMKBHS-MISYRCLQSA-N	0	3	326.484	3.425	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(C)c2c1CCC2	ZINC001049918152	1348111352	/nfs/dbraw/zinc/11/13/52/1348111352.db2.gz	PZKFLTOYOWQMII-SFTDATJTSA-N	0	3	336.479	3.186	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1	ZINC001049924705	1348116396	/nfs/dbraw/zinc/11/63/96/1348116396.db2.gz	SZRBRXPPZPJRPS-WJFTUGDTSA-N	0	3	328.431	3.181	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1c[nH]c2ccc(F)cc12	ZINC001049938200	1348123467	/nfs/dbraw/zinc/12/34/67/1348123467.db2.gz	YJOGKCRZNZHQKU-QZTJIDSGSA-N	0	3	327.403	3.172	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3CCCN(C(=O)CCC4CC4)[C@@H]3C2)cc1	ZINC001050002672	1348149651	/nfs/dbraw/zinc/14/96/51/1348149651.db2.gz	VQLSQCDEKBWMLK-VQTJNVASSA-N	0	3	337.467	3.171	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3CCCN(C(=O)C=C4CCC4)[C@@H]3C2)cc1	ZINC001050016841	1348155645	/nfs/dbraw/zinc/15/56/45/1348155645.db2.gz	MDDQLZBPWDMTAG-VQTJNVASSA-N	0	3	335.451	3.091	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3ccc(F)c(C(F)F)c3)[C@@H]2C1	ZINC001050048254	1348165326	/nfs/dbraw/zinc/16/53/26/1348165326.db2.gz	MZRZEAWKLGPCJI-XJKSGUPXSA-N	0	3	338.373	3.486	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3coc4cc(F)ccc34)[C@@H]2C1	ZINC001050081373	1348176223	/nfs/dbraw/zinc/17/62/23/1348176223.db2.gz	VKJFWCYSXVYOEI-SUMWQHHRSA-N	0	3	328.387	3.294	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)Cc3ccc(C(F)F)cc3)[C@@H]2C1	ZINC001050093183	1348180874	/nfs/dbraw/zinc/18/08/74/1348180874.db2.gz	FIGMWJOUIVGYIE-ZWKOTPCHSA-N	0	3	346.421	3.113	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)[C@H](C)c3c(F)cccc3F)[C@@H]2C1	ZINC001050095143	1348181662	/nfs/dbraw/zinc/18/16/62/1348181662.db2.gz	ADQNLTVENXRXPM-JKIFEVAISA-N	0	3	334.410	3.177	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cncc4sccc43)[C@@H]2C1	ZINC001050123484	1348189511	/nfs/dbraw/zinc/18/95/11/1348189511.db2.gz	GQUIEQGTMMMTRJ-XJKSGUPXSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)Cc3c(C)cc(C)cc3C)[C@@H]2C1	ZINC001050129899	1348191372	/nfs/dbraw/zinc/19/13/72/1348191372.db2.gz	FAEOTYPCDDJAFL-AZUAARDMSA-N	0	3	326.484	3.263	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3cnc4ccccc4c3)[C@@H]2C1	ZINC001050153674	1348198460	/nfs/dbraw/zinc/19/84/60/1348198460.db2.gz	YVWLICSDUYHPDI-FXAWDEMLSA-N	0	3	335.451	3.347	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCC[C@H]2CN(Cc3cccc(C#N)c3)C[C@H]21	ZINC001050154027	1348198809	/nfs/dbraw/zinc/19/88/09/1348198809.db2.gz	JSCDPLYTCYSFQT-FFZOFVMBSA-N	0	3	339.483	3.273	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CCCN(C(=O)[C@@H]4C[C@H]4C4CC4)[C@@H]3C2)c1	ZINC001050162142	1348200366	/nfs/dbraw/zinc/20/03/66/1348200366.db2.gz	OSELMXSUVDTQMK-UWHLTILDSA-N	0	3	349.478	3.027	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3ccc(N(C)C(C)C)cc3)[C@@H]2C1	ZINC001050214015	1348212718	/nfs/dbraw/zinc/21/27/18/1348212718.db2.gz	XUHGOBYERISDJH-AZUAARDMSA-N	0	3	341.499	3.254	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)cc1)c1ccc(CNC(=O)C2CC2)cc1	ZINC001050256204	1348219666	/nfs/dbraw/zinc/21/96/66/1348219666.db2.gz	OUPXWVGDICNHKO-HNNXBMFYSA-N	0	3	333.435	3.435	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC2(C1)CCN([C@@H](C)c1ccccc1Cl)CC2	ZINC001050460290	1348271176	/nfs/dbraw/zinc/27/11/76/1348271176.db2.gz	UROCCFKFCKCLBS-CABCVRRESA-N	0	3	345.874	3.485	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C[C@@H]3C[C@H]3c3ccccc3)C2)CC1	ZINC001050519057	1348283051	/nfs/dbraw/zinc/28/30/51/1348283051.db2.gz	MTFUWBXEOVGNDP-PMACEKPBSA-N	0	3	336.479	3.128	20	30		EGEDHN
Cc1cocc1C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001050620849	1348305320	/nfs/dbraw/zinc/30/53/20/1348305320.db2.gz	PAMNQXBYAYCDFM-UHFFFAOYSA-N	0	3	349.434	3.198	20	30		EGEDHN
C[C@@H]1C[C@H]1CC(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001050647813	1348315228	/nfs/dbraw/zinc/31/52/28/1348315228.db2.gz	SBQVCWJEUHFCCR-APWZRJJASA-N	0	3	337.467	3.029	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1ocnc1C)CC2	ZINC001050651935	1348317286	/nfs/dbraw/zinc/31/72/86/1348317286.db2.gz	XCKRDRULRYTPEN-GOSISDBHSA-N	0	3	331.460	3.010	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C[C@H]3CCc4ccccc43)C2)CC1	ZINC001050703645	1348331820	/nfs/dbraw/zinc/33/18/20/1348331820.db2.gz	QWIOMBSFBJNIBD-LJQANCHMSA-N	0	3	336.479	3.054	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cc(CC)c(C)s3)C2)CC1	ZINC001050748620	1348347832	/nfs/dbraw/zinc/34/78/32/1348347832.db2.gz	UWRUEXWNRZZVNF-UHFFFAOYSA-N	0	3	330.497	3.180	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cc(C)c(F)c(C)c3)C2)CC1	ZINC001050759129	1348350208	/nfs/dbraw/zinc/35/02/08/1348350208.db2.gz	YEIGWSNBENOBBS-UHFFFAOYSA-N	0	3	328.431	3.004	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H](C)c3ccc(F)c(F)c3)C2)CC1	ZINC001050759758	1348350394	/nfs/dbraw/zinc/35/03/94/1348350394.db2.gz	SBRUGVSPUBVZHY-HNNXBMFYSA-N	0	3	346.421	3.016	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H](C)Cc3ccc(C)cc3)C2)CC1	ZINC001050767443	1348352743	/nfs/dbraw/zinc/35/27/43/1348352743.db2.gz	DJWYXRITHKPYSF-IBGZPJMESA-N	0	3	338.495	3.121	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@]3(C)CCC(C)=C(C)C3)C2)CC1	ZINC001050768742	1348353792	/nfs/dbraw/zinc/35/37/92/1348353792.db2.gz	CJCVKMDANWNWOF-FQEVSTJZSA-N	0	3	328.500	3.461	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1C1CCN(C(=O)[C@H](C)CSC)CC1	ZINC001230537785	1376060299	/nfs/dbraw/zinc/06/02/99/1376060299.db2.gz	KRVACQZPRSCNMF-CJNGLKHVSA-N	0	3	344.952	3.441	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3cncc(C)c3)cccc2C1	ZINC001051284253	1348417819	/nfs/dbraw/zinc/41/78/19/1348417819.db2.gz	MPHODFLARNDFFR-UHFFFAOYSA-N	0	3	335.451	3.254	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)[C@H]3CCCO[C@H]3C)cccc2C1	ZINC001051285045	1348418349	/nfs/dbraw/zinc/41/83/49/1348418349.db2.gz	WKELDMLJAQFVHA-LPHOPBHVSA-N	0	3	342.483	3.052	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3sccc3F)cccc2C1	ZINC001051286384	1348419094	/nfs/dbraw/zinc/41/90/94/1348419094.db2.gz	ILHWWKRKQSAVAB-UHFFFAOYSA-N	0	3	342.439	3.199	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)[C@@H]3C[C@@H]4C=C[C@H]3CC4)cccc2C1	ZINC001051289552	1348420107	/nfs/dbraw/zinc/42/01/07/1348420107.db2.gz	JIBMZLWVTJWFJC-KGVIQGDOSA-N	0	3	348.490	3.287	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)[C@@H]3CCC(F)(F)C3)cccc2C1	ZINC001051290923	1348421038	/nfs/dbraw/zinc/42/10/38/1348421038.db2.gz	VJESXJNZRJJGSX-OAHLLOKOSA-N	0	3	346.421	3.120	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3nccs3)cccc2C1	ZINC001051306349	1348427763	/nfs/dbraw/zinc/42/77/63/1348427763.db2.gz	UKUGXZWOZUETBI-UHFFFAOYSA-N	0	3	327.453	3.007	20	30		EGEDHN
C=CCCN1CCN([C@@H]2CCN(C(=O)CCC3CCCCC3)C2)CC1	ZINC001052113342	1348503401	/nfs/dbraw/zinc/50/34/01/1348503401.db2.gz	SEOZHSRKZKHCKX-HXUWFJFHSA-N	0	3	347.547	3.142	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2coc3ccc(OC)cc23)CC1	ZINC001052548361	1348575269	/nfs/dbraw/zinc/57/52/69/1348575269.db2.gz	ARURRKMRFXBDEM-OAHLLOKOSA-N	0	3	340.423	3.049	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@H](C)c2c(F)cccc2F)CC1	ZINC001052562300	1348580490	/nfs/dbraw/zinc/58/04/90/1348580490.db2.gz	OOSFWDPCNQVEDQ-CABCVRRESA-N	0	3	334.410	3.062	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2nc(Cl)sc2Cl)CC1	ZINC001052621677	1348598676	/nfs/dbraw/zinc/59/86/76/1348598676.db2.gz	GCLNDYADQKMANL-SNVBAGLBSA-N	0	3	346.283	3.058	20	30		EGEDHN
Cc1cocc1C(=O)N[C@@H]1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC001052628680	1348601459	/nfs/dbraw/zinc/60/14/59/1348601459.db2.gz	FEALWHYWIOVREX-GOSISDBHSA-N	0	3	337.423	3.244	20	30		EGEDHN
C[C@]1(C(=O)N[C@H]2CCCN(Cc3ccc(C#N)cc3)CC2)C=CCC1	ZINC001052629632	1348602483	/nfs/dbraw/zinc/60/24/83/1348602483.db2.gz	ORWMOICCSGOTQW-FPOVZHCZSA-N	0	3	337.467	3.385	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccsc2C(F)F)CC1	ZINC001052900853	1348734238	/nfs/dbraw/zinc/73/42/38/1348734238.db2.gz	LAEOEINBFVJRGE-GFCCVEGCSA-N	0	3	326.412	3.293	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cc3c(s2)CC[C@H](C)C3)CC1	ZINC001052924156	1348750915	/nfs/dbraw/zinc/75/09/15/1348750915.db2.gz	VPCWXABKGIQQKL-DOTOQJQBSA-N	0	3	344.524	3.481	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccccc2CC(C)C)CC1	ZINC001052966431	1348777781	/nfs/dbraw/zinc/77/77/81/1348777781.db2.gz	VMTWZBFSULEPSG-IBGZPJMESA-N	0	3	326.484	3.493	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccsc2C)C1	ZINC001053083468	1348904135	/nfs/dbraw/zinc/90/41/35/1348904135.db2.gz	LBJNDXGEVQABPL-AEFFLSMTSA-N	0	3	330.497	3.396	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cc(C)cs2)C1	ZINC001053082774	1348904556	/nfs/dbraw/zinc/90/45/56/1348904556.db2.gz	GPJTWFCKJILJPO-IAGOWNOFSA-N	0	3	330.497	3.396	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2onc(C)c2C)C1	ZINC001053088415	1348913006	/nfs/dbraw/zinc/91/30/06/1348913006.db2.gz	UYGGXRPTKQJFNW-ZWKOTPCHSA-N	0	3	343.471	3.021	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2[nH]c(C)cc2C)C1	ZINC001053090307	1348916605	/nfs/dbraw/zinc/91/66/05/1348916605.db2.gz	GNQHCMLMKOTSNC-RTBURBONSA-N	0	3	341.499	3.362	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cc3ccccn3c2)C1	ZINC001053100009	1348931977	/nfs/dbraw/zinc/93/19/77/1348931977.db2.gz	CJWUZGGRAHCQCV-WIYYLYMNSA-N	0	3	349.478	3.279	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)Cc2ccsc2C)C1	ZINC001053100789	1348934245	/nfs/dbraw/zinc/93/42/45/1348934245.db2.gz	IVSVSXGQLALWRM-RBUKOAKNSA-N	0	3	344.524	3.325	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)Cc2ccc(C)s2)C1	ZINC001053103857	1348938589	/nfs/dbraw/zinc/93/85/89/1348938589.db2.gz	AMTGAIYRDIEAMK-HKUYNNGSSA-N	0	3	344.524	3.325	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)Cc2ccccc2C)C1	ZINC001053104114	1348939367	/nfs/dbraw/zinc/93/93/67/1348939367.db2.gz	CBWYOZVHLBXUEM-NHCUHLMSSA-N	0	3	338.495	3.264	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccccc2OC)C1	ZINC001053106933	1348945127	/nfs/dbraw/zinc/94/51/27/1348945127.db2.gz	XELACKBJDPBBSG-PKOBYXMFSA-N	0	3	340.467	3.035	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)[C@H]2[C@H]3[C@@H]2[C@@H]2CC[C@H]3C2)C1	ZINC001053107905	1348947859	/nfs/dbraw/zinc/94/78/59/1348947859.db2.gz	NBPPUTAWWQEALD-OCZHUQCSSA-N	0	3	340.511	3.005	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@H]1CCC=CCCC1)C2	ZINC001054152637	1349156380	/nfs/dbraw/zinc/15/63/80/1349156380.db2.gz	FVOUIPUYDCSROK-FPOVZHCZSA-N	0	3	328.500	3.461	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)Cc1cccc(CC)c1)C2	ZINC001054155297	1349158019	/nfs/dbraw/zinc/15/80/19/1349158019.db2.gz	NVTQHWGZYQMHJP-JOCHJYFZSA-N	0	3	338.495	3.129	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(C)c3cccnc13)C2	ZINC001054166002	1349169123	/nfs/dbraw/zinc/16/91/23/1349169123.db2.gz	SKJSQGGEUMLTIK-JOCHJYFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@]2(CCN(Cc3cnc(C)s3)C2)C1	ZINC001054175920	1349178258	/nfs/dbraw/zinc/17/82/58/1349178258.db2.gz	YEODDEPELMIBEU-IBGZPJMESA-N	0	3	347.528	3.478	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc3[nH]ccc3c1)C2	ZINC001054185961	1349188360	/nfs/dbraw/zinc/18/83/60/1349188360.db2.gz	AUXMDPAFCQZLBK-OAQYLSRUSA-N	0	3	335.451	3.119	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@]2(CCN(Cc3cccnc3)C2)C1	ZINC001054192091	1349193981	/nfs/dbraw/zinc/19/39/81/1349193981.db2.gz	QWGXMCNKUIVYRE-SFTDATJTSA-N	0	3	341.499	3.498	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)[C@H](C)OC1CCCCCC1)C2	ZINC001054194310	1349196720	/nfs/dbraw/zinc/19/67/20/1349196720.db2.gz	NKSSFQUDBWXFKN-RXVVDRJESA-N	0	3	346.515	3.062	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc[nH]c1C1CCC1)C2	ZINC001054198464	1349200790	/nfs/dbraw/zinc/20/07/90/1349200790.db2.gz	XOOJTHGUUIXVQB-NRFANRHFSA-N	0	3	339.483	3.234	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)[C@H]1[C@@H]3CCCCCC[C@@H]31)C2	ZINC001054203966	1349205540	/nfs/dbraw/zinc/20/55/40/1349205540.db2.gz	MNFKENKMRREHTD-PXCRPINLSA-N	0	3	328.500	3.151	20	30		EGEDHN
C=C[C@H](C(=O)N1CCC[C@]2(CCN(CC#CC)C2)C1)c1ccccc1	ZINC001054244646	1349238551	/nfs/dbraw/zinc/23/85/51/1349238551.db2.gz	XGQWJJYVYKODCA-RBBKRZOGSA-N	0	3	336.479	3.294	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@@H]3CCCOC3)cc2C1	ZINC001054258636	1349255284	/nfs/dbraw/zinc/25/52/84/1349255284.db2.gz	VZKOHGDRRIJCCW-GOSISDBHSA-N	0	3	328.456	3.011	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@@H]3CC[C@H](OC)C3)cc2C1	ZINC001054270987	1349269843	/nfs/dbraw/zinc/26/98/43/1349269843.db2.gz	DQFWMCRCXSAPRJ-APWZRJJASA-N	0	3	328.456	3.010	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3ocnc3CC)cc2C1	ZINC001054281220	1349282105	/nfs/dbraw/zinc/28/21/05/1349282105.db2.gz	GQHMTCQXLTXOJL-UHFFFAOYSA-N	0	3	325.412	3.059	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cc(C4CC4)no3)cc2C1	ZINC001054284387	1349286190	/nfs/dbraw/zinc/28/61/90/1349286190.db2.gz	PYAXWSNGXBAEHB-UHFFFAOYSA-N	0	3	337.423	3.374	20	30		EGEDHN
C#Cc1ccc(C(=O)NCc2ccc3c(c2)CN(CCC(=C)C)C3)nc1	ZINC001054290495	1349295076	/nfs/dbraw/zinc/29/50/76/1349295076.db2.gz	QXWSOZQBQNSFFQ-UHFFFAOYSA-N	0	3	345.446	3.275	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2cccs2)C[C@H]1NCc1ccc(C#N)c(F)c1	ZINC001054350292	1349329855	/nfs/dbraw/zinc/32/98/55/1349329855.db2.gz	JNNCDINWAKCDSS-MLGOLLRUSA-N	0	3	343.427	3.009	20	30		EGEDHN
Cc1cc(C)c(C(=O)N2C[C@H](C)[C@H](NCc3ccc(C#N)s3)C2)o1	ZINC001054524956	1349383730	/nfs/dbraw/zinc/38/37/30/1349383730.db2.gz	MHBKYDZLRJUDAJ-BLLLJJGKSA-N	0	3	343.452	3.080	20	30		EGEDHN
C[C@H]1CN(C(=O)C2=CCCCCC2)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054599216	1349411243	/nfs/dbraw/zinc/41/12/43/1349411243.db2.gz	MXPRCQPKQUESQJ-KSSFIOAISA-N	0	3	343.496	3.447	20	30		EGEDHN
CCc1occc1C(=O)N1C[C@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001054615059	1349415243	/nfs/dbraw/zinc/41/52/43/1349415243.db2.gz	NZZMBBCOAGDHOZ-BLLLJJGKSA-N	0	3	343.452	3.025	20	30		EGEDHN
C=CCN1C[C@@H](C)[C@H](NC(=O)[C@@H]2CCCO[C@H]2c2ccc(C)cc2)C1	ZINC001080593212	1357690276	/nfs/dbraw/zinc/69/02/76/1357690276.db2.gz	OEMPEZCTTAYHFP-AFYVEPGGSA-N	0	3	342.483	3.085	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)C2CC(C(C)(C)C)C2)C1	ZINC001070435794	1354348786	/nfs/dbraw/zinc/34/87/86/1354348786.db2.gz	RQYUCBKNORIMCX-UQPPLGOBSA-N	0	3	344.503	3.074	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC001085668353	1358672715	/nfs/dbraw/zinc/67/27/15/1358672715.db2.gz	BCFHGRIDIKLTFB-UYAOXDASSA-N	0	3	341.499	3.012	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C=C1CCCCC1)C[C@@H](C)O2	ZINC001071144420	1354475167	/nfs/dbraw/zinc/47/51/67/1354475167.db2.gz	NCNXNMAFWSFXRX-YLJYHZDGSA-N	0	3	332.488	3.145	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C(F)=C1CCCC1)C[C@@H](C)O2	ZINC001071156171	1354480968	/nfs/dbraw/zinc/48/09/68/1354480968.db2.gz	CPPJTJSPPHPTTK-BEFAXECRSA-N	0	3	336.451	3.052	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C(C)(C)C(=C)Cl)C[C@H](C)O2	ZINC001071170904	1354486364	/nfs/dbraw/zinc/48/63/64/1354486364.db2.gz	DWGZOYMIPQWUQV-KBXCAEBGSA-N	0	3	340.895	3.033	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C1(C3CCC3)CCC1)C[C@H](C)O2	ZINC001071196807	1354498590	/nfs/dbraw/zinc/49/85/90/1354498590.db2.gz	IQOQGJJYJZNZHB-PXNSSMCTSA-N	0	3	346.515	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C1CCC(=C)CC1)C[C@@H](C)O2	ZINC001071201469	1354502050	/nfs/dbraw/zinc/50/20/50/1354502050.db2.gz	FMPQDTAJZQYAHW-XLIONFOSSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1ccccc1CC)C[C@@H](C)O2	ZINC001071201909	1354502629	/nfs/dbraw/zinc/50/26/29/1354502629.db2.gz	MPLKDGSVYFEDHK-UTKZUKDTSA-N	0	3	342.483	3.131	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](C)O[C@]3(CCN(CC=C(C)C)C3)C2)C1	ZINC001071211569	1354507999	/nfs/dbraw/zinc/50/79/99/1354507999.db2.gz	KEDISUAVWXOSBM-XLIONFOSSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc2c(cccc2OC)[nH]1	ZINC001085967421	1358924159	/nfs/dbraw/zinc/92/41/59/1358924159.db2.gz	LPFPSNJRZXZQOT-OAHLLOKOSA-N	0	3	341.455	3.289	20	30		EGEDHN
C#CCCN1CC[C@]2(C1)CN(C(=O)C1(CC)CCCCC1)C[C@H](C)O2	ZINC001071244396	1354524798	/nfs/dbraw/zinc/52/47/98/1354524798.db2.gz	UGYHTTMRWFJSLE-RXVVDRJESA-N	0	3	346.515	3.062	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)CC(C1CC1)C1CC1)C[C@H](C)O2	ZINC001071244342	1354524864	/nfs/dbraw/zinc/52/48/64/1354524864.db2.gz	SYNUMJYMHVBGIW-HRAATJIYSA-N	0	3	346.515	3.081	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3sccc3Cl)C2)CC1	ZINC001086924252	1359249984	/nfs/dbraw/zinc/24/99/84/1359249984.db2.gz	NRNPOWJZISDZLB-ZDUSSCGKSA-N	0	3	336.888	3.351	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2c(C)nn(C(C)(C)C)c2C)CC[C@H]1C	ZINC001071547604	1354760096	/nfs/dbraw/zinc/76/00/96/1354760096.db2.gz	WQOWXMDYBVOSBX-RHSMWYFYSA-N	0	3	346.519	3.414	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CC[C@@H](C)N(Cc2ccccc2)C1	ZINC001071571729	1354771781	/nfs/dbraw/zinc/77/17/81/1354771781.db2.gz	KZYGFTFRELCRAX-MJGOQNOKSA-N	0	3	337.467	3.457	20	30		EGEDHN
C=C(C)CCN1C[C@H](NC(=O)c2sc3nccn3c2C)CC[C@H]1C	ZINC001071574290	1354772100	/nfs/dbraw/zinc/77/21/00/1354772100.db2.gz	MXSGONOCYQUWDI-UKRRQHHQSA-N	0	3	346.500	3.253	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(OC)c(OC)c2C)CC[C@@H]1C	ZINC001071597420	1354785983	/nfs/dbraw/zinc/78/59/83/1354785983.db2.gz	JALJKWMEWGRUJX-GOEBONIOSA-N	0	3	346.471	3.171	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2csc(C(F)(F)F)c2)CC[C@H]1C	ZINC001071645880	1354824474	/nfs/dbraw/zinc/82/44/74/1354824474.db2.gz	ORBLECUWHVILDU-DGCLKSJQSA-N	0	3	344.402	3.373	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc(C)cc(OC)c2C)CC[C@@H]1C	ZINC001071647445	1354824680	/nfs/dbraw/zinc/82/46/80/1354824680.db2.gz	HCEVWFBKXBANPX-RDJZCZTQSA-N	0	3	330.472	3.471	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2cccc3ncccc23)CC[C@@H]1C	ZINC001071677154	1354844892	/nfs/dbraw/zinc/84/48/92/1354844892.db2.gz	RLYFMLGYUCUWTM-WMZOPIPTSA-N	0	3	337.467	3.323	20	30		EGEDHN
C=C(C)CCN1C[C@H](NC(=O)c2ncc(Cl)s2)CC[C@H]1C	ZINC001071683434	1354849938	/nfs/dbraw/zinc/84/99/38/1354849938.db2.gz	ZSRGDLILZQJVIT-VXGBXAGGSA-N	0	3	327.881	3.345	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(C)nc2C(C)C)CC[C@H]1C	ZINC001071715466	1354873185	/nfs/dbraw/zinc/87/31/85/1354873185.db2.gz	IBXLEUHRPXDDAO-SJORKVTESA-N	0	3	327.472	3.119	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc(-c3cccs3)n[nH]2)CC[C@@H]1C	ZINC001071831169	1354967593	/nfs/dbraw/zinc/96/75/93/1354967593.db2.gz	AOQOIRVJWDWKPU-UONOGXRCSA-N	0	3	344.484	3.297	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(OC)c(C3CC3)c2)CC[C@H]1C	ZINC001071946601	1355037431	/nfs/dbraw/zinc/03/74/31/1355037431.db2.gz	LBTDGIYIICDLOO-QAPCUYQASA-N	0	3	340.467	3.179	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C2(c3ccccc3F)CC2)CC[C@@H]1C	ZINC001071957816	1355042949	/nfs/dbraw/zinc/04/29/49/1355042949.db2.gz	NZWSOPJTVSXNTQ-HOTGVXAUSA-N	0	3	330.447	3.403	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2c(C)nn(CCC)c2C)CC[C@@H]1C	ZINC001071972518	1355052799	/nfs/dbraw/zinc/05/27/99/1355052799.db2.gz	WUPWTBJZNYPWCB-YOEHRIQHSA-N	0	3	332.492	3.069	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2sccc2COC)CC[C@H]1C	ZINC001071993658	1355063568	/nfs/dbraw/zinc/06/35/68/1355063568.db2.gz	VKPVBTUNYRWEOI-ZBFHGGJFSA-N	0	3	336.501	3.443	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CC[C@H](C)N(CC3=CCCCC3)C2)cn1	ZINC001072002008	1355067412	/nfs/dbraw/zinc/06/74/12/1355067412.db2.gz	IISWRIHLAMGHKM-OXJNMPFZSA-N	0	3	337.467	3.146	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C(C)(C)c2ccc(C)cc2)CC[C@H]1C	ZINC001072003172	1355068174	/nfs/dbraw/zinc/06/81/74/1355068174.db2.gz	SETZHTFTQYYHNY-IEBWSBKVSA-N	0	3	326.484	3.265	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)Cc2c(F)cccc2Cl)CC[C@@H]1C	ZINC001072019137	1355081208	/nfs/dbraw/zinc/08/12/08/1355081208.db2.gz	DBLSXLWOPBUEGP-UONOGXRCSA-N	0	3	336.838	3.014	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)Cc2ccc(OC(C)C)cc2)CC[C@@H]1C	ZINC001072088474	1355121714	/nfs/dbraw/zinc/12/17/14/1355121714.db2.gz	MARCKPYWUOGFJU-WMZOPIPTSA-N	0	3	330.472	3.171	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc(OC)c(OC)cc2C)CC[C@H]1C	ZINC001072091467	1355123417	/nfs/dbraw/zinc/12/34/17/1355123417.db2.gz	BMBLYNDTEDSXQA-CVEARBPZSA-N	0	3	346.471	3.171	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(OC3CCC3)cc2)CC[C@H]1C	ZINC001072095685	1355126688	/nfs/dbraw/zinc/12/66/88/1355126688.db2.gz	MTPYDDFPCKZMJM-SJLPKXTDSA-N	0	3	340.467	3.224	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](NC(=O)c2ccccc2CN(C)C)CC[C@@H]1C	ZINC001072099709	1355129810	/nfs/dbraw/zinc/12/98/10/1355129810.db2.gz	WIXSKLZMMYRNRS-RDJZCZTQSA-N	0	3	349.906	3.083	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(N(C)CC)cc2)CC[C@H]1C	ZINC001072112577	1355137972	/nfs/dbraw/zinc/13/79/72/1355137972.db2.gz	BZNBWNDYSASUMR-SJLPKXTDSA-N	0	3	329.488	3.302	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2c[nH]c3ccc(F)cc23)CC[C@@H]1C	ZINC001072119810	1355141504	/nfs/dbraw/zinc/14/15/04/1355141504.db2.gz	JZNNCMVARYNYPB-ZFWWWQNUSA-N	0	3	329.419	3.466	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1csc(C2CC2)n1	ZINC001089736191	1360641455	/nfs/dbraw/zinc/64/14/55/1360641455.db2.gz	LRQNGQOPSOVWJA-OAHLLOKOSA-N	0	3	345.512	3.264	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](C)[C@H](CNCc2ccn(CC)n2)C1	ZINC001072334617	1355244038	/nfs/dbraw/zinc/24/40/38/1355244038.db2.gz	DXMKRMWRYSZFMW-DLBZAZTESA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1cnccc1C)C2	ZINC001072945309	1355513203	/nfs/dbraw/zinc/51/32/03/1355513203.db2.gz	YQPCYLYJJGVLMW-IBGZPJMESA-N	0	3	327.472	3.027	20	30		EGEDHN
C[C@@H]1CC[C@H](C(=O)N2CC3(C2)CCN(Cc2cccc(C#N)c2)C3)C1	ZINC001073031948	1355560425	/nfs/dbraw/zinc/56/04/25/1355560425.db2.gz	VXQLALSGVNUNCE-APWZRJJASA-N	0	3	337.467	3.029	20	30		EGEDHN
CC[C@]1(C)C[C@H]1C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001073091448	1355589889	/nfs/dbraw/zinc/58/98/89/1355589889.db2.gz	KEXSKLQLHSWKQN-AZUAARDMSA-N	0	3	337.467	3.029	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CN(C(=O)[C@@H]4CC45CCCC5)C3)C2)cc1	ZINC001073102456	1355597582	/nfs/dbraw/zinc/59/75/82/1355597582.db2.gz	BBMQULKZHWXNLW-IBGZPJMESA-N	0	3	349.478	3.173	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)CC(C)(C)c3ccc(C)cc3)C2)C1	ZINC001073412125	1355764979	/nfs/dbraw/zinc/76/49/79/1355764979.db2.gz	BJCYGZJBIBTOQW-UHFFFAOYSA-N	0	3	326.484	3.383	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2ccc(CCC)s2)C1	ZINC001073623804	1355846804	/nfs/dbraw/zinc/84/68/04/1355846804.db2.gz	RVXHPVZRBVMZAS-OAHLLOKOSA-N	0	3	336.501	3.097	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2cc(C)cc(Cl)c2)C1	ZINC001073697877	1355869081	/nfs/dbraw/zinc/86/90/81/1355869081.db2.gz	SAZBCPWEGVQYDU-KRWDZBQOSA-N	0	3	336.863	3.045	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2cccc(C)c2Cl)C1	ZINC001073825580	1355909385	/nfs/dbraw/zinc/90/93/85/1355909385.db2.gz	OUQPDGSNWNPXBA-HNNXBMFYSA-N	0	3	336.863	3.045	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CCCC[C@@H]1CN(C)Cc1cccc(C#N)c1	ZINC001074050607	1356055787	/nfs/dbraw/zinc/05/57/87/1356055787.db2.gz	JIOKPHTVMKLLNY-QZTJIDSGSA-N	0	3	331.435	3.119	20	30		EGEDHN
C=C[C@H](C(=O)N1CC[C@H](NCc2cncs2)[C@@H]1C)c1ccccc1	ZINC001075125351	1356319754	/nfs/dbraw/zinc/31/97/54/1356319754.db2.gz	ZGKQDFACRNLCQJ-WBAXXEDZSA-N	0	3	341.480	3.192	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3coc4c3cccc4OC)[C@@H]2C1	ZINC001075795110	1356423232	/nfs/dbraw/zinc/42/32/32/1356423232.db2.gz	AMYOLMCVLCLHIV-WMLDXEAASA-N	0	3	340.423	3.164	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CC[C@H]2CN(Cc3ccc(C)cc3)C[C@H]21	ZINC001075885480	1356439391	/nfs/dbraw/zinc/43/93/91/1356439391.db2.gz	YOKNVLQTHMNHDV-PZJWPPBQSA-N	0	3	349.478	3.329	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@@H](C)OC3CCCCCC3)[C@@H]2C1	ZINC001076224266	1356524307	/nfs/dbraw/zinc/52/43/07/1356524307.db2.gz	KPZGUVSIVSWKPD-ZIFCJYIRSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccc(OCC)c(C)c3)[C@@H]2C1	ZINC001076310713	1356546092	/nfs/dbraw/zinc/54/60/92/1356546092.db2.gz	IXJAVXJXWNFGDQ-ZWKOTPCHSA-N	0	3	328.456	3.116	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3oc4ccccc4c3Cl)[C@@H]2C1	ZINC001076454277	1356580845	/nfs/dbraw/zinc/58/08/45/1356580845.db2.gz	WUXJEGHBCQQMDB-DZGCQCFKSA-N	0	3	342.826	3.256	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cccc(OCC(C)C)c3)[C@@H]2C1	ZINC001076549228	1356615382	/nfs/dbraw/zinc/61/53/82/1356615382.db2.gz	ZZTJOAWQRRRAQH-AZUAARDMSA-N	0	3	342.483	3.444	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@H](C)c3ccc(F)cc3F)[C@@H]2C1	ZINC001076590221	1356624721	/nfs/dbraw/zinc/62/47/21/1356624721.db2.gz	BQGBYXKRYVAOPR-QWQRMKEZSA-N	0	3	334.410	3.177	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3coc(C4CCCCC4)n3)[C@@H]2C1	ZINC001076623402	1356636556	/nfs/dbraw/zinc/63/65/56/1356636556.db2.gz	UOGOGHGGRLLMGC-FUHWJXTLSA-N	0	3	343.471	3.445	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@H]1CCC(C)(C)CN1CCn1cccn1	ZINC001099085234	1363615682	/nfs/dbraw/zinc/61/56/82/1363615682.db2.gz	LRBSRJSZBJITCC-QGZVFWFLSA-N	0	3	346.519	3.092	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)CC(C)(C)C=C	ZINC001099094237	1363619050	/nfs/dbraw/zinc/61/90/50/1363619050.db2.gz	XXBQUDRBTBUOLN-KRWDZBQOSA-N	0	3	336.520	3.398	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)CCOCc1ccccc1	ZINC001099344163	1363762406	/nfs/dbraw/zinc/76/24/06/1363762406.db2.gz	HIWCHZPQKWUAQT-LJQANCHMSA-N	0	3	344.499	3.386	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc(C)c(C)n2)C12CCC2	ZINC001078679492	1357052719	/nfs/dbraw/zinc/05/27/19/1357052719.db2.gz	CGOLRRFBVXZHLK-HOTGVXAUSA-N	0	3	333.863	3.082	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2ccc(OCC(C)C)cc2)C1	ZINC001080891588	1357759597	/nfs/dbraw/zinc/75/95/97/1357759597.db2.gz	TZZZSXZORGEGLR-VQIMIIECSA-N	0	3	330.472	3.348	20	30		EGEDHN
N#Cc1c(F)cccc1C(=O)NCCN1CCC2(CCCCC2)CC1	ZINC001183275488	1387289455	/nfs/dbraw/zinc/28/94/55/1387289455.db2.gz	MHIRHVQAYZLZKO-UHFFFAOYSA-N	0	3	343.446	3.473	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2ccccc2CCC)C[C@H]1c1ccccc1	ZINC001081143146	1357844634	/nfs/dbraw/zinc/84/46/34/1357844634.db2.gz	OBBRFJNKQSLKSZ-FCHUYYIVSA-N	0	3	346.474	3.470	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2ccc3c(c2)C=CCC3)[C@H](OC)C1	ZINC001082229900	1357984880	/nfs/dbraw/zinc/98/48/80/1357984880.db2.gz	BDJGTGCJLZATHC-WOJBJXKFSA-N	0	3	340.467	3.041	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001082727120	1358082407	/nfs/dbraw/zinc/08/24/07/1358082407.db2.gz	MFTQLDFPVGWSGI-LRCYWBKYSA-N	0	3	343.446	3.070	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)[C@H](CC)CC3CCCC3)[C@H]2C1	ZINC001083212923	1358124538	/nfs/dbraw/zinc/12/45/38/1358124538.db2.gz	GZPISRBGBSHCMK-CEXWTWQISA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)C[C@H](C)C3CCCCC3)[C@H]2C1	ZINC001083222010	1358124639	/nfs/dbraw/zinc/12/46/39/1358124639.db2.gz	BPVGHOJPBRCHPW-YTQUADARSA-N	0	3	334.504	3.081	20	30		EGEDHN
Cc1cccc([C@H](C)N2CC[C@@H]3CN(C(=O)c4cc(C#N)c[nH]4)[C@@H]3C2)c1	ZINC001084261513	1358176329	/nfs/dbraw/zinc/17/63/29/1358176329.db2.gz	NDPRQHDWZPTBKS-QKYXUNIQSA-N	0	3	348.450	3.102	20	30		EGEDHN
C[C@@H](c1ccc2c(c1)CCC2)N1CC[C@@H]2CN(C(=O)C#CC3CC3)[C@@H]2C1	ZINC001084334156	1358195215	/nfs/dbraw/zinc/19/52/15/1358195215.db2.gz	QYLRIXOGQCHULK-KNXBSLHKSA-N	0	3	348.490	3.182	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3c(C)noc3C(C)C)[C@@H]2C1	ZINC001084424220	1358210616	/nfs/dbraw/zinc/21/06/16/1358210616.db2.gz	XJOWRMDEPURDMH-HZPDHXFCSA-N	0	3	331.460	3.219	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)Cc3ccc(C)cc3Cl)[C@@H]2C1	ZINC001084461912	1358220033	/nfs/dbraw/zinc/22/00/33/1358220033.db2.gz	WZSICMBIJBQXDZ-SJLPKXTDSA-N	0	3	332.875	3.300	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)Cc3cccc(C(C)C)c3)[C@@H]2C1	ZINC001084485811	1358222768	/nfs/dbraw/zinc/22/27/68/1358222768.db2.gz	YZDJQGNCQXSWNY-WOJBJXKFSA-N	0	3	326.484	3.461	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3ccc(-c4ccco4)o3)[C@@H]2C1	ZINC001084508480	1358228698	/nfs/dbraw/zinc/22/86/98/1358228698.db2.gz	MJJJNGRYDWKGEH-HUUCEWRRSA-N	0	3	326.396	3.262	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)C[C@@H]3CCOc4ccccc43)[C@@H]2C1	ZINC001084574577	1358241725	/nfs/dbraw/zinc/24/17/25/1358241725.db2.gz	DEKXPOIMMOVBIL-YQVWRLOYSA-N	0	3	340.467	3.052	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)[C@H](C)c3ccc(Cl)s3)[C@@H]2C1	ZINC001084764574	1358303898	/nfs/dbraw/zinc/30/38/98/1358303898.db2.gz	NWAPULDKUIHLCE-MGPQQGTHSA-N	0	3	336.888	3.061	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3sccc3C(F)F)[C@@H]2C1	ZINC001084802565	1358314305	/nfs/dbraw/zinc/31/43/05/1358314305.db2.gz	FOWBYXVRBHQBMR-DGCLKSJQSA-N	0	3	326.412	3.408	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@@H](C)c3ccc(F)cc3F)[C@@H]2C1	ZINC001084842679	1358326654	/nfs/dbraw/zinc/32/66/54/1358326654.db2.gz	YUMGNLIRFUUXGK-PMUMKWKESA-N	0	3	334.410	3.177	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)CC[C@@H]3CCc4ccccc43)[C@@H]2C1	ZINC001084846998	1358327778	/nfs/dbraw/zinc/32/77/78/1358327778.db2.gz	HFSVBVJNTFPWTK-QKNQBKEWSA-N	0	3	336.479	3.053	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)CCc3cc(C)sc3C)[C@@H]2C1	ZINC001084859703	1358332106	/nfs/dbraw/zinc/33/21/06/1358332106.db2.gz	IITDAACMLGCJCN-QZTJIDSGSA-N	0	3	332.513	3.406	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CC[C@H]2CCN(Cc3cccc(C#N)c3)[C@H]2C1	ZINC001084892366	1358341117	/nfs/dbraw/zinc/34/11/17/1358341117.db2.gz	XLWCRYHOIJCUTJ-LZQZEXGQSA-N	0	3	325.456	3.027	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N1CC[C@H]2CCN(Cc3cccc(C#N)c3)[C@H]2C1	ZINC001084920596	1358349160	/nfs/dbraw/zinc/34/91/60/1358349160.db2.gz	MJGUEUQLUPUAMQ-QRVBRYPASA-N	0	3	337.467	3.027	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H]2CCN(Cc3cccnc3C)[C@H]2C1	ZINC001085023899	1358369417	/nfs/dbraw/zinc/36/94/17/1358369417.db2.gz	DIFSGQJVAHGKAN-LMNJBCLMSA-N	0	3	341.499	3.415	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CCN(C(=O)[C@H]4CC45CCC5)C[C@@H]32)c1	ZINC001085044430	1358375678	/nfs/dbraw/zinc/37/56/78/1358375678.db2.gz	UMZSPAAHEWTPMA-AQNXPRMDSA-N	0	3	349.478	3.171	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CC[C@H]2CCN(Cc3ccc(C#N)cc3)[C@H]2C1	ZINC001085048095	1358376964	/nfs/dbraw/zinc/37/69/64/1358376964.db2.gz	CXDCUSXVAYADBO-AHRSYUTCSA-N	0	3	339.483	3.273	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CCN(C(=O)[C@@H]4C[C@H]4C4CC4)C[C@@H]32)c1	ZINC001085053487	1358379346	/nfs/dbraw/zinc/37/93/46/1358379346.db2.gz	XQIVDCSTHQNKGH-MHTWAQMVSA-N	0	3	349.478	3.027	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@H](CC)Oc3ccccc3F)C[C@@H]21	ZINC001085075169	1358384665	/nfs/dbraw/zinc/38/46/65/1358384665.db2.gz	SYJDTSAWTASQJU-NJAFHUGGSA-N	0	3	346.446	3.092	20	30		EGEDHN
N#Cc1ccc(C[NH2+][C@@H]2CCCC[C@H]2NC(=O)c2ccccc2[O-])cc1	ZINC001085138245	1358409264	/nfs/dbraw/zinc/40/92/64/1358409264.db2.gz	WPIPYDOCNFMOBM-RTBURBONSA-N	0	3	349.434	3.095	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1Cc2ccc(F)cc21	ZINC001085311284	1358462420	/nfs/dbraw/zinc/46/24/20/1358462420.db2.gz	APQDKZYWHPWCLW-BRWVUGGUSA-N	0	3	336.838	3.235	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCCC[C@H]2NCc2ccc(F)cn2)CC1	ZINC001085321289	1358465827	/nfs/dbraw/zinc/46/58/27/1358465827.db2.gz	PRQODJXRRKMCDY-RTBURBONSA-N	0	3	345.462	3.484	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccc2nccnc2c1	ZINC001085416209	1358494492	/nfs/dbraw/zinc/49/44/92/1358494492.db2.gz	LTAOSLKLWKBXKJ-GDBMZVCRSA-N	0	3	344.846	3.013	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cnc(CC)s1	ZINC001085436976	1358499671	/nfs/dbraw/zinc/49/96/71/1358499671.db2.gz	LGPHQRVOWHPXIG-VXGBXAGGSA-N	0	3	327.881	3.089	20	30		EGEDHN
CC[C@H](c1ccccc1)N1CC[C@@H]1CN(C)C(=O)c1ccc(C#N)[nH]1	ZINC001085542545	1358582381	/nfs/dbraw/zinc/58/23/81/1358582381.db2.gz	ADSMXFAXYGIGOJ-IEBWSBKVSA-N	0	3	336.439	3.184	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@@H]1CCCN1c1ccccc1	ZINC001085634549	1358650449	/nfs/dbraw/zinc/65/04/49/1358650449.db2.gz	SSEOCECKFUBWAG-PMACEKPBSA-N	0	3	341.499	3.154	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@H]1CCc2ccc(OC)cc21	ZINC001085644393	1358657092	/nfs/dbraw/zinc/65/70/92/1358657092.db2.gz	MVVAFMYGENZJAM-HKUYNNGSSA-N	0	3	342.483	3.224	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc(C)cc(OC)c1C	ZINC001085698799	1358693549	/nfs/dbraw/zinc/69/35/49/1358693549.db2.gz	WWRVDMFDBGSHQH-KRWDZBQOSA-N	0	3	330.472	3.425	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc(C(F)(F)F)nc1	ZINC001085753928	1358734676	/nfs/dbraw/zinc/73/46/76/1358734676.db2.gz	UUWWUJWIHYHRIV-AWEZNQCLSA-N	0	3	341.377	3.213	20	30		EGEDHN
C=C1CCC(C(=O)N(C)C[C@H]2CCN2CCC[C@@H]2CCOC2)CC1	ZINC001085801485	1358776875	/nfs/dbraw/zinc/77/68/75/1358776875.db2.gz	UIOAVNOLPQYJHC-IEBWSBKVSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc(COC)c(F)c1	ZINC001085944634	1358903097	/nfs/dbraw/zinc/90/30/97/1358903097.db2.gz	OHXFAHZDIFEYQM-KRWDZBQOSA-N	0	3	334.435	3.085	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc(Cl)cc2c1OCC2	ZINC001085990770	1358942573	/nfs/dbraw/zinc/94/25/73/1358942573.db2.gz	XXBQJYKJPGDEPC-INIZCTEOSA-N	0	3	348.874	3.387	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)C2CCc3ccccc3CC2)C1	ZINC001086131277	1359005171	/nfs/dbraw/zinc/00/51/71/1359005171.db2.gz	OVFBBUWEAPRXDT-GLRZTSSQSA-N	0	3	346.902	3.419	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc3cccc(F)c3o2)C1	ZINC001086276388	1359051079	/nfs/dbraw/zinc/05/10/79/1359051079.db2.gz	OBCSKVJXZXTSAE-BJHJDKERSA-N	0	3	336.794	3.422	20	30		EGEDHN
Cc1cc(C(=O)NCC2(NCc3ccc(C#N)cc3)CC2)c(C)s1	ZINC001323482502	1387375098	/nfs/dbraw/zinc/37/50/98/1387375098.db2.gz	QXGOWQIYRIZBNZ-UHFFFAOYSA-N	0	3	339.464	3.289	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc(F)c(C)cc2F)C1	ZINC001086393340	1359085568	/nfs/dbraw/zinc/08/55/68/1359085568.db2.gz	CSPNYRNDZIQWHI-HAQNSBGRSA-N	0	3	328.790	3.124	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2c(F)cc(C)cc2F)C1	ZINC001086424142	1359093370	/nfs/dbraw/zinc/09/33/70/1359093370.db2.gz	LBFWNDKHILXEGK-HAQNSBGRSA-N	0	3	328.790	3.124	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@H]2COc3cc(C)c(C)cc32)C1	ZINC001086438942	1359097319	/nfs/dbraw/zinc/09/73/19/1359097319.db2.gz	KTOQFYIHSBVNJC-ZOBUZTSGSA-N	0	3	348.874	3.016	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)[C@@H]2CCCCC2(F)F)C1	ZINC001086766968	1359197700	/nfs/dbraw/zinc/19/77/00/1359197700.db2.gz	RLYCNLLKSFMBAB-MJBXVCDLSA-N	0	3	334.838	3.439	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cnoc2C(C)C)C1	ZINC001086844136	1359211839	/nfs/dbraw/zinc/21/18/39/1359211839.db2.gz	SKSQZHQYMTXTRR-QWHCGFSZSA-N	0	3	325.840	3.039	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3cc(C)oc3C)C2)CC1	ZINC001086902466	1359231853	/nfs/dbraw/zinc/23/18/53/1359231853.db2.gz	FPDRIUXEIGHSQO-HNNXBMFYSA-N	0	3	328.456	3.236	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)C[C@@H]3CCC(F)(F)C3)C2)CC1	ZINC001086925712	1359250913	/nfs/dbraw/zinc/25/09/13/1359250913.db2.gz	FMZXFYCDSRMLPY-CVEARBPZSA-N	0	3	338.442	3.148	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)CCc3ccsc3)C2)CC1	ZINC001086927159	1359251979	/nfs/dbraw/zinc/25/19/79/1359251979.db2.gz	UGIPUDDQJIOENQ-QGZVFWFLSA-N	0	3	344.524	3.407	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H]3CCC=CCCC3)C2)CC1	ZINC001086928612	1359253235	/nfs/dbraw/zinc/25/32/35/1359253235.db2.gz	JBSMLZGINHNCFY-RTBURBONSA-N	0	3	328.500	3.459	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)C3CCC4(CC4)CC3)C2)CC1	ZINC001086933638	1359257339	/nfs/dbraw/zinc/25/73/39/1359257339.db2.gz	RWFDLFVVYFGAGW-QGZVFWFLSA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3ccn(C(C)C)c3C)C2)CC1	ZINC001086938190	1359260674	/nfs/dbraw/zinc/26/06/74/1359260674.db2.gz	KTDIFFGBVRGFLP-KRWDZBQOSA-N	0	3	341.499	3.327	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc(C(C)C)cn3)C2)CC1	ZINC001086942372	1359264346	/nfs/dbraw/zinc/26/43/46/1359264346.db2.gz	PCWLAVKSNRNQRX-KRWDZBQOSA-N	0	3	339.483	3.155	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3csc(Cl)c3)C2)CC1	ZINC001086947100	1359268530	/nfs/dbraw/zinc/26/85/30/1359268530.db2.gz	PNLVAZHLEHZEMP-CYBMUJFWSA-N	0	3	336.888	3.351	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H](C)c3ccc(C)cc3)C2)CC1	ZINC001086952705	1359272483	/nfs/dbraw/zinc/27/24/83/1359272483.db2.gz	OBZZRJVOWDNPGW-MOPGFXCFSA-N	0	3	338.495	3.435	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)Cc3ccccc3C)C2)CC1	ZINC001086956122	1359276964	/nfs/dbraw/zinc/27/69/64/1359276964.db2.gz	FQKNYZDCTFVHCR-LJQANCHMSA-N	0	3	338.495	3.264	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3nc(C)c(C)s3)C2)CC1	ZINC001086956398	1359277054	/nfs/dbraw/zinc/27/70/54/1359277054.db2.gz	MUBMMZWCEUVOCR-CQSZACIVSA-N	0	3	345.512	3.100	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3sccc3CC)C2)CC1	ZINC001086958717	1359279691	/nfs/dbraw/zinc/27/96/91/1359279691.db2.gz	ZJTNFPFHMMABLN-HNNXBMFYSA-N	0	3	330.497	3.260	20	30		EGEDHN
C[C@@H]1CCN(C(=O)C(C)(C)F)[C@H](CNCc2ccc(C#N)s2)C1	ZINC001087108134	1359288262	/nfs/dbraw/zinc/28/82/62/1359288262.db2.gz	CAYSZRLRDGFRHX-OLZOCXBDSA-N	0	3	337.464	3.085	20	30		EGEDHN
C/C=C(/C)C(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccc(C#N)cc1F	ZINC001087145099	1359305774	/nfs/dbraw/zinc/30/57/74/1359305774.db2.gz	IZIOXVZWSYNLCX-ALJHWNEKSA-N	0	3	343.446	3.380	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC001087199685	1359317472	/nfs/dbraw/zinc/31/74/72/1359317472.db2.gz	WZXXOZLNRNIGFN-KJWYOANISA-N	0	3	343.446	3.070	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc(F)c3)C(C)(C)[C@H]21	ZINC001087270192	1359342714	/nfs/dbraw/zinc/34/27/14/1359342714.db2.gz	WIRHQPJBVVVXKR-KURKYZTESA-N	0	3	328.431	3.068	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc(Cl)o3)C(C)(C)[C@H]21	ZINC001087272308	1359346207	/nfs/dbraw/zinc/34/62/07/1359346207.db2.gz	FVUGBANEAMKIBH-KCXAZCMYSA-N	0	3	334.847	3.175	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3cscc3C)C(C)(C)[C@H]21	ZINC001087278291	1359354227	/nfs/dbraw/zinc/35/42/27/1359354227.db2.gz	FCDSZBOBLPTKEX-PVAVHDDUSA-N	0	3	330.497	3.299	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc(C)c3F)C(C)(C)[C@@H]21	ZINC001087287415	1359366135	/nfs/dbraw/zinc/36/61/35/1359366135.db2.gz	HGEHKMOVSAMPDE-BHIYHBOVSA-N	0	3	342.458	3.376	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc4cc(C)cn4c3)C(C)(C)[C@H]21	ZINC001087290100	1359369245	/nfs/dbraw/zinc/36/92/45/1359369245.db2.gz	XEVBRBLXWZJQED-AQNXPRMDSA-N	0	3	349.478	3.100	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(F)ccc3CC)C(C)(C)[C@@H]21	ZINC001087294036	1359373948	/nfs/dbraw/zinc/37/39/48/1359373948.db2.gz	NEJSAWZPWVLKDM-BHIYHBOVSA-N	0	3	342.458	3.240	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccccc3CC)C(C)(C)[C@H]21	ZINC001087301571	1359384829	/nfs/dbraw/zinc/38/48/29/1359384829.db2.gz	FHPZJRLECOPPQT-AQNXPRMDSA-N	0	3	338.495	3.491	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)Cc3cccc(Cl)c3)C(C)(C)[C@H]21	ZINC001087303065	1359385721	/nfs/dbraw/zinc/38/57/21/1359385721.db2.gz	FTNDAMARMKOESJ-NEWSRXKRSA-N	0	3	344.886	3.121	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)C3CCC(F)(F)CC3)C(C)(C)[C@H]21	ZINC001087305597	1359391564	/nfs/dbraw/zinc/39/15/64/1359391564.db2.gz	VVJWIWSPSLLUIN-OAGGEKHMSA-N	0	3	338.442	3.050	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(CC(C)C)c[nH]3)C(C)(C)[C@H]21	ZINC001087314694	1359404566	/nfs/dbraw/zinc/40/45/66/1359404566.db2.gz	PHXUIPBSPHZASG-QRQLOZEOSA-N	0	3	341.499	3.065	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc(F)cc3Cl)C(C)(C)[C@H]21	ZINC001087315916	1359406212	/nfs/dbraw/zinc/40/62/12/1359406212.db2.gz	KFZQSHWPOYXVBN-PVAVHDDUSA-N	0	3	348.849	3.331	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)C3CCC(C)(C)CC3)C(C)(C)[C@@H]21	ZINC001087318700	1359410777	/nfs/dbraw/zinc/41/07/77/1359410777.db2.gz	BKOAGZSNUFFGND-KZNAEPCWSA-N	0	3	330.516	3.441	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc4c3CCC4)C(C)(C)[C@H]21	ZINC001087320019	1359412790	/nfs/dbraw/zinc/41/27/90/1359412790.db2.gz	XSGANMDPIHTOSQ-AQNXPRMDSA-N	0	3	336.479	3.027	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2conc2C2CCCC2)[C@H]1CC	ZINC001087600051	1359549228	/nfs/dbraw/zinc/54/92/28/1359549228.db2.gz	HUTGQDLYXPABNA-DLBZAZTESA-N	0	3	331.460	3.491	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)C(C)(C)c2cc(C)ccn2)[C@H]1CC	ZINC001087622763	1359559485	/nfs/dbraw/zinc/55/94/85/1359559485.db2.gz	DOCINPHMSKWTDG-DLBZAZTESA-N	0	3	329.488	3.213	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)[C@H]2CCC2(C)C)CCN1Cc1ccc(C#N)cc1	ZINC001087693756	1359594619	/nfs/dbraw/zinc/59/46/19/1359594619.db2.gz	VEBVALMCESDMEQ-CEXWTWQISA-N	0	3	339.483	3.464	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2c[nH]c3cc(C)ccc23)[C@H]1CC	ZINC001087760129	1359631420	/nfs/dbraw/zinc/63/14/20/1359631420.db2.gz	XQVAPUQANFJIDG-AZUAARDMSA-N	0	3	337.467	3.011	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccoc2Br)[C@H]1CC	ZINC001087785436	1359643361	/nfs/dbraw/zinc/64/33/61/1359643361.db2.gz	HBAFGIWTGFBMPY-QWHCGFSZSA-N	0	3	341.249	3.201	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cnn(CCC)c2C2CC2)[C@H]1CC	ZINC001087790541	1359647334	/nfs/dbraw/zinc/64/73/34/1359647334.db2.gz	SNOMSRNSMBMMDO-ZWKOTPCHSA-N	0	3	344.503	3.329	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cccnc2OCC(C)C)[C@H]1CC	ZINC001087801507	1359652664	/nfs/dbraw/zinc/65/26/64/1359652664.db2.gz	SGAZHIWZCZARJA-ZWKOTPCHSA-N	0	3	345.487	3.275	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C[C@@H]2CCCc3ccccc32)[C@H]1CC	ZINC001087805674	1359655657	/nfs/dbraw/zinc/65/56/57/1359655657.db2.gz	QTRIDJYANGTCDM-SESVDKBCSA-N	0	3	338.495	3.489	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(Cl)cc3c2OCC3)[C@H]1CC	ZINC001087843106	1359676438	/nfs/dbraw/zinc/67/64/38/1359676438.db2.gz	DGFRFUYDLFMDPE-JKSUJKDBSA-N	0	3	334.847	3.044	20	30		EGEDHN
Cc1occc1C(=O)N1C[C@H]2CCN(Cc3cccc(C#N)c3)C[C@H]2C1	ZINC001087878340	1359693797	/nfs/dbraw/zinc/69/37/97/1359693797.db2.gz	SFGYVSYKWHJLGT-MOPGFXCFSA-N	0	3	349.434	3.054	20	30		EGEDHN
Cc1cc(Cl)ccc1CN1CC[C@@H]2CN(C(=O)[C@H](C)C#N)C[C@@H]2C1	ZINC001087911241	1359705049	/nfs/dbraw/zinc/70/50/49/1359705049.db2.gz	OIHZJGQQGRCPPW-OIISXLGYSA-N	0	3	345.874	3.088	20	30		EGEDHN
CC1(C(=O)N2C[C@H]3CCN(Cc4cccc(C#N)c4)C[C@H]3C2)CCC1	ZINC001088069189	1359743186	/nfs/dbraw/zinc/74/31/86/1359743186.db2.gz	NCFFCRJYJLHBAN-MOPGFXCFSA-N	0	3	337.467	3.029	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)C[C@H](C)C3CCCCC3)C[C@@H]2C1	ZINC001088137773	1359770560	/nfs/dbraw/zinc/77/05/60/1359770560.db2.gz	CPKQVXLRHIWCNZ-SXLOBPIMSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3ccc(CC(C)C)cc3)C[C@@H]2C1	ZINC001088196118	1359791268	/nfs/dbraw/zinc/79/12/68/1359791268.db2.gz	REGGIPBPTOWXHG-RTWAWAEBSA-N	0	3	338.495	3.302	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3ccc(C(C)(C)C)s3)C[C@@H]2C1	ZINC001088209315	1359795527	/nfs/dbraw/zinc/79/55/27/1359795527.db2.gz	QGUQMPKXBQOYSA-CVEARBPZSA-N	0	3	344.524	3.463	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](CNCc2oc(C)nc2C)[C@H](C)C1	ZINC001184231133	1387417114	/nfs/dbraw/zinc/41/71/14/1387417114.db2.gz	LHROPLGVCMHGKG-CRAIPNDOSA-N	0	3	345.487	3.059	20	30		EGEDHN
C=CCN1CC[C@H](OCC2CCN(C(=O)[C@H]3CC34CCCC4)CC2)C1	ZINC001088239687	1359810779	/nfs/dbraw/zinc/81/07/79/1359810779.db2.gz	CXJOFFYPKHUNHO-RBUKOAKNSA-N	0	3	346.515	3.082	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCCC[C@H](NCc2n[nH]c(C(C)C)n2)C1	ZINC001088360333	1359843727	/nfs/dbraw/zinc/84/37/27/1359843727.db2.gz	WDCCXYBQOFDOOL-HNNXBMFYSA-N	0	3	347.507	3.001	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)[C@@H]2CCc3cccnc32)C1	ZINC001088370099	1359852849	/nfs/dbraw/zinc/85/28/49/1359852849.db2.gz	AHGCJKREJDAZMB-DLBZAZTESA-N	0	3	347.890	3.225	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2coc(CCC)n2)C1	ZINC001088412213	1359883612	/nfs/dbraw/zinc/88/36/12/1359883612.db2.gz	BBJRBXIEWODFNP-AWEZNQCLSA-N	0	3	339.867	3.354	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2sccc2OC)C1	ZINC001088415441	1359885102	/nfs/dbraw/zinc/88/51/02/1359885102.db2.gz	JPZZUDMRTACYSM-CYBMUJFWSA-N	0	3	342.892	3.484	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)COc2ccccc2)C1	ZINC001088418804	1359888916	/nfs/dbraw/zinc/88/89/16/1359888916.db2.gz	ZKKFZTPFJKTREB-INIZCTEOSA-N	0	3	336.863	3.179	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)Cc2ccccc2F)C1	ZINC001088421335	1359891023	/nfs/dbraw/zinc/89/10/23/1359891023.db2.gz	NFAXLAUGRSXYBJ-INIZCTEOSA-N	0	3	338.854	3.482	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2c[nH]c3ncccc23)C1	ZINC001088426253	1359894597	/nfs/dbraw/zinc/89/45/97/1359894597.db2.gz	PETHLJYTMMHHHX-AWEZNQCLSA-N	0	3	346.862	3.290	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2cnc(CC)s2)C1	ZINC001088433049	1359901623	/nfs/dbraw/zinc/90/16/23/1359901623.db2.gz	KWKNVHTXRBBRME-CYBMUJFWSA-N	0	3	341.908	3.432	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](CNCc2nc(C)c(C)s2)[C@H](C)C1	ZINC001184302769	1387424745	/nfs/dbraw/zinc/42/47/45/1387424745.db2.gz	WIYNKFKJKYDZIN-PBHICJAKSA-N	0	3	347.528	3.138	20	30		EGEDHN
C[C@@H]1[C@@H](NC(=O)c2ccc(C#N)[nH]2)CCN1Cc1ccccc1C1CC1	ZINC001088529901	1359960903	/nfs/dbraw/zinc/96/09/03/1359960903.db2.gz	UQVMYAIHUBQLLP-KUHUBIRLSA-N	0	3	348.450	3.157	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)Cc2coc3cc(F)ccc23)[C@H]1C	ZINC001088560424	1359974273	/nfs/dbraw/zinc/97/42/73/1359974273.db2.gz	PCVCFWLSRWMASV-DYVFJYSZSA-N	0	3	330.403	3.270	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCN(C[C@H]3CC(C)(C)CO3)[C@@H]2C)CC1	ZINC001088838636	1360072939	/nfs/dbraw/zinc/07/29/39/1360072939.db2.gz	UCLCLRXYHPQUFX-NXHRZFHOSA-N	0	3	334.504	3.127	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2coc3ccc(Cl)cc23)[C@H]1C	ZINC001089011418	1360135463	/nfs/dbraw/zinc/13/54/63/1360135463.db2.gz	ZUYKILJICQCYEL-WBMJQRKESA-N	0	3	330.815	3.302	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCCN1C(=O)C=C1CCC1	ZINC001089154579	1360209370	/nfs/dbraw/zinc/20/93/70/1360209370.db2.gz	RAGRULCPCVWJEY-FQEVSTJZSA-N	0	3	337.467	3.481	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)N1CCCC[C@H]1CN(C)Cc1ccc(C#N)cc1	ZINC001089213994	1360259763	/nfs/dbraw/zinc/25/97/63/1360259763.db2.gz	TZJNKZAQRNMYBZ-RBUKOAKNSA-N	0	3	345.462	3.365	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2sc(C3CC3)nc2C)CC(C)(C)C1	ZINC001089379920	1360382750	/nfs/dbraw/zinc/38/27/50/1360382750.db2.gz	AOOPTDJYQXENQU-OAHLLOKOSA-N	0	3	345.512	3.183	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc(C)c3ccccc3n2)CC(C)(C)C1	ZINC001089419096	1360412886	/nfs/dbraw/zinc/41/28/86/1360412886.db2.gz	BRDNREUDQZQHDI-QGZVFWFLSA-N	0	3	349.478	3.397	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cccc(C(C)C)n2)CC(C)(C)C1	ZINC001089429564	1360421149	/nfs/dbraw/zinc/42/11/49/1360421149.db2.gz	CGIOETZXAMICEO-INIZCTEOSA-N	0	3	327.472	3.059	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ncsc2C2CC2)CC(C)(C)C1	ZINC001089490502	1360469334	/nfs/dbraw/zinc/46/93/34/1360469334.db2.gz	BPAOZXYOBARWQE-HNNXBMFYSA-N	0	3	345.512	3.264	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@@H]2C[C@H]2c2cccc(C)c2)CC(C)(C)C1	ZINC001089513970	1360485062	/nfs/dbraw/zinc/48/50/62/1360485062.db2.gz	GVDKPHQVFLDJDS-SLFFLAALSA-N	0	3	338.495	3.339	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@@H](C)c2ccccc2F)CC(C)(C)C1	ZINC001089521074	1360488448	/nfs/dbraw/zinc/48/84/48/1360488448.db2.gz	DPVCFLQRSHKSLA-JKSUJKDBSA-N	0	3	330.447	3.169	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(C3CC3)s2)CC(C)(C)C1	ZINC001089541668	1360498533	/nfs/dbraw/zinc/49/85/33/1360498533.db2.gz	MJUSFKJNLOGYHL-OAHLLOKOSA-N	0	3	330.497	3.479	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc(C)nc3ccccc32)CC(C)(C)C1	ZINC001089551257	1360502887	/nfs/dbraw/zinc/50/28/87/1360502887.db2.gz	FKKHUDDUQOAVQW-KRWDZBQOSA-N	0	3	349.478	3.397	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2occ3c2CCCC3)CC(C)(C)C1	ZINC001089549371	1360503103	/nfs/dbraw/zinc/50/31/03/1360503103.db2.gz	XJBJMVMFHBMSIK-INIZCTEOSA-N	0	3	328.456	3.012	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2c(Cl)cccc2OC)CC(C)(C)C1	ZINC001089560986	1360509134	/nfs/dbraw/zinc/50/91/34/1360509134.db2.gz	LRLQDJKVCPPLQK-CQSZACIVSA-N	0	3	348.874	3.202	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2c[nH]c3ccc(C)cc23)CC(C)(C)C1	ZINC001089564900	1360511763	/nfs/dbraw/zinc/51/17/63/1360511763.db2.gz	KPOFEWDFWPZSDG-INIZCTEOSA-N	0	3	337.467	3.330	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ccn(CC(C)C)n1	ZINC001089645990	1360557964	/nfs/dbraw/zinc/55/79/64/1360557964.db2.gz	GATFUNNAGDNRIR-KRWDZBQOSA-N	0	3	346.519	3.336	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ncc(OC)cc1F	ZINC001089650033	1360563611	/nfs/dbraw/zinc/56/36/11/1360563611.db2.gz	SATHDFITTDFKDP-AWEZNQCLSA-N	0	3	349.450	3.026	20	30		EGEDHN
C=CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1snnc1C1CC1	ZINC001089653196	1360566221	/nfs/dbraw/zinc/56/62/21/1360566221.db2.gz	NRGHHYJVGIWHFV-CQSZACIVSA-N	0	3	348.516	3.212	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccnc(C2CC2)c1	ZINC001089666861	1360577610	/nfs/dbraw/zinc/57/76/10/1360577610.db2.gz	ZNYFKDSGFCGTKR-SFHVURJKSA-N	0	3	339.483	3.203	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(C)c(F)c1	ZINC001089667923	1360577989	/nfs/dbraw/zinc/57/79/89/1360577989.db2.gz	OPDYYXOXTCIQLZ-QGZVFWFLSA-N	0	3	330.447	3.378	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1nncc2ccccc21	ZINC001089669602	1360579275	/nfs/dbraw/zinc/57/92/75/1360579275.db2.gz	PDORSPVUQJTHTF-MRXNPFEDSA-N	0	3	338.455	3.036	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(C)cn2ccnc12	ZINC001089671295	1360580514	/nfs/dbraw/zinc/58/05/14/1360580514.db2.gz	NUUQKVITEQIRMI-INIZCTEOSA-N	0	3	340.471	3.049	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)C1CCC(OC)CC1	ZINC001089689826	1360595270	/nfs/dbraw/zinc/59/52/70/1360595270.db2.gz	JMZDKKVZASHDCV-LXPRWKDFSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cccc2c1OCC2	ZINC001089696706	1360601086	/nfs/dbraw/zinc/60/10/86/1360601086.db2.gz	HNGYRYXMWHFHEI-KRWDZBQOSA-N	0	3	342.483	3.418	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1ccccc1F	ZINC001089760084	1360652489	/nfs/dbraw/zinc/65/24/89/1360652489.db2.gz	GYDMCNBDRFTFBI-SCNOPHJPSA-N	0	3	348.849	3.361	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)c2ccsc2)C1	ZINC001089764242	1360655096	/nfs/dbraw/zinc/65/50/96/1360655096.db2.gz	NUFILPYLAOPXCX-TUUVXOQKSA-N	0	3	336.888	3.283	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1c(C)coc1C	ZINC001089809200	1360672937	/nfs/dbraw/zinc/67/29/37/1360672937.db2.gz	NWNISFDUUSFVKB-NXOAAHMSSA-N	0	3	348.874	3.431	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1C=CC=CC=C1	ZINC001089812833	1360674288	/nfs/dbraw/zinc/67/42/88/1360674288.db2.gz	PDFPUAIGOFYPPR-MANSERQUSA-N	0	3	344.886	3.206	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](CNCc2ocnc2C)[C@@H](C)C1	ZINC001184472671	1387467741	/nfs/dbraw/zinc/46/77/41/1387467741.db2.gz	KMFLVQUUPZYRTL-HOCLYGCPSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1CC2(CC2)C1	ZINC001089865757	1360708981	/nfs/dbraw/zinc/70/89/81/1360708981.db2.gz	TXMJLDJIRZFQBR-LLLHUVSDSA-N	0	3	334.891	3.098	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)C2=CCCCCC2)CC2(CCOCC2)C1	ZINC001089935302	1360751998	/nfs/dbraw/zinc/75/19/98/1360751998.db2.gz	USCZNNSLFYDXOT-GOSISDBHSA-N	0	3	332.488	3.050	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)[C@]2(C)CC=CCC2)CC2(CCOCC2)C1	ZINC001089938763	1360754124	/nfs/dbraw/zinc/75/41/24/1360754124.db2.gz	HPPCUJOGWIFNEG-UYAOXDASSA-N	0	3	346.515	3.296	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](CNCc2oc(CC)nc2C)[C@H](C)C1	ZINC001184497798	1387472914	/nfs/dbraw/zinc/47/29/14/1387472914.db2.gz	NBPZIKWNAAJSLI-WBVHZDCISA-N	0	3	347.503	3.476	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc(C)c(F)cc2F)C1	ZINC001091094678	1360990981	/nfs/dbraw/zinc/99/09/81/1360990981.db2.gz	HYPRSXADWOOQQB-UHFFFAOYSA-N	0	3	328.790	3.124	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc(-c3ccccc3)no2)C1	ZINC001091115306	1360993844	/nfs/dbraw/zinc/99/38/44/1360993844.db2.gz	JOVYQWRFWCSNIU-UHFFFAOYSA-N	0	3	345.830	3.192	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H]2CCc3cc(F)ccc32)C1	ZINC001091145934	1360997807	/nfs/dbraw/zinc/99/78/07/1360997807.db2.gz	MFMSMDRJKYTSAL-MWHAMWOXSA-N	0	3	336.838	3.092	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)[C@H]2CCCC2(C)C)C1	ZINC001091187627	1361002156	/nfs/dbraw/zinc/00/21/56/1361002156.db2.gz	JHFORYLRUFXZFK-JXQTWKCFSA-N	0	3	343.309	3.206	20	30		EGEDHN
CC1(C)CC[C@H]1C(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1	ZINC001091192711	1361003338	/nfs/dbraw/zinc/00/33/38/1361003338.db2.gz	METXIHRBGOQYLP-PREGVCBESA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(OCC)c(C)c2)C1	ZINC001091264741	1361025871	/nfs/dbraw/zinc/02/58/71/1361025871.db2.gz	VKMDWHZYVOOTGN-UHFFFAOYSA-N	0	3	336.863	3.244	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc(Cl)ccc2C)C1	ZINC001091286915	1361031723	/nfs/dbraw/zinc/03/17/23/1361031723.db2.gz	ISHARCUCNBPBDK-UHFFFAOYSA-N	0	3	327.255	3.499	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc3c(c2)CCCC3)C1	ZINC001091354600	1361057749	/nfs/dbraw/zinc/05/77/49/1361057749.db2.gz	DVNAYJFRDFLKTG-UHFFFAOYSA-N	0	3	332.875	3.416	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(C)c3c2CCC3)C1	ZINC001091381104	1361070814	/nfs/dbraw/zinc/07/08/14/1361070814.db2.gz	BMPAZEDUFGBHCQ-UHFFFAOYSA-N	0	3	332.875	3.334	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CN(Cc4ncccc4C)C[C@@]3(C)C2)C1	ZINC001091995231	1361269645	/nfs/dbraw/zinc/26/96/45/1361269645.db2.gz	BUIUKBHYPMNKSM-UTKZUKDTSA-N	0	3	339.483	3.027	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CN(Cc4cncc(C)c4)C[C@@]3(C)C2)C1	ZINC001091995529	1361269698	/nfs/dbraw/zinc/26/96/98/1361269698.db2.gz	GMFMMHZCXMVPCV-NQIIRXRSSA-N	0	3	339.483	3.027	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc4c(s3)CCCC4)C[C@]2(C)C1	ZINC001092251057	1361342084	/nfs/dbraw/zinc/34/20/84/1361342084.db2.gz	OAUAGKKAMNYADB-UZLBHIALSA-N	0	3	342.508	3.044	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccc(Cl)cc2)C[C@H]1CNC(=O)C1CCC1	ZINC001092421396	1361376857	/nfs/dbraw/zinc/37/68/57/1361376857.db2.gz	IEEVAUXKXDDVFK-CRAIPNDOSA-N	0	3	344.886	3.176	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1CNC(=O)[C@@H]1CCC1(C)C	ZINC001092900081	1361481470	/nfs/dbraw/zinc/48/14/70/1361481470.db2.gz	MODCAYGFFVFKMP-RLLQIKCJSA-N	0	3	338.495	3.158	20	30		EGEDHN
C#CCN1C[C@@H](CNC(=O)c2coc3ccc(Cl)cc23)[C@H](C)C1	ZINC001093165105	1361546265	/nfs/dbraw/zinc/54/62/65/1361546265.db2.gz	UZIOYFHZRLXWSW-CHWSQXEVSA-N	0	3	330.815	3.017	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C(C)(C)C(=C)Cl)CC1	ZINC001093371992	1361581360	/nfs/dbraw/zinc/58/13/60/1361581360.db2.gz	XSPBARQOBRKFMN-KRWDZBQOSA-N	0	3	348.918	3.491	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)[C@H]2CCCC23CC3)CC1	ZINC001093372511	1361582212	/nfs/dbraw/zinc/58/22/12/1361582212.db2.gz	DYVLHGHZRBQIJO-RTBURBONSA-N	0	3	340.511	3.293	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cccc(-n4cccc4)c3)CCC[C@@H]12	ZINC001094463318	1361812441	/nfs/dbraw/zinc/81/24/41/1361812441.db2.gz	KMDLAEPCJOQOHY-IFMALSPDSA-N	0	3	347.462	3.085	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3sc(CCC)nc3C)CCC[C@@H]12	ZINC001094578213	1361868588	/nfs/dbraw/zinc/86/85/88/1361868588.db2.gz	RXDHPYUMFCRAOP-DNVCBOLYSA-N	0	3	345.512	3.012	20	30		EGEDHN
CN(CCC(F)(F)F)CC(=O)C(C#N)c1nc2ccccc2s1	ZINC001324184014	1387552399	/nfs/dbraw/zinc/55/23/99/1387552399.db2.gz	LLMNIXIPUXJDNO-SNVBAGLBSA-N	0	3	341.358	3.357	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H]1CCc3cc(OC)ccc31)C2	ZINC001095504347	1362158121	/nfs/dbraw/zinc/15/81/21/1362158121.db2.gz	RPKOWMOLIQBRQY-XCLNPWKQSA-N	0	3	340.467	3.023	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1cccc(Cl)c1F)C2	ZINC001096064794	1362360940	/nfs/dbraw/zinc/36/09/40/1362360940.db2.gz	AFSYFOVTKQLBHQ-KBMXLJTQSA-N	0	3	336.838	3.319	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1csc(-c3ccoc3)n1)C2	ZINC001096193502	1362424310	/nfs/dbraw/zinc/42/43/10/1362424310.db2.gz	SBWFXOSBMZEQAL-YCPHGPKFSA-N	0	3	343.452	3.314	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc3ccccc3n1CC)C2	ZINC001096605084	1362594379	/nfs/dbraw/zinc/59/43/79/1362594379.db2.gz	ZTGLGLUPYOVBBR-AOIWGVFYSA-N	0	3	335.451	3.020	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccoc1C(F)(F)F)C2	ZINC001097142535	1362864688	/nfs/dbraw/zinc/86/46/88/1362864688.db2.gz	PJYYTILSTKAEHQ-RTXFEEFZSA-N	0	3	328.334	3.210	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1cccc3cnccc31)C2	ZINC001097335056	1362939006	/nfs/dbraw/zinc/93/90/06/1362939006.db2.gz	IFUICVPUEGSRJH-RLLQIKCJSA-N	0	3	335.451	3.075	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc3c(c1)C(C)(C)CO3)C2	ZINC001097516589	1363034464	/nfs/dbraw/zinc/03/44/64/1363034464.db2.gz	YWJINUATHBQWOF-NXHRZFHOSA-N	0	3	340.467	3.268	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1sc(C)cc1C)C[C@H](C)O2	ZINC001098603260	1363395259	/nfs/dbraw/zinc/39/52/59/1363395259.db2.gz	MCUARUYSTOYWNM-HNNXBMFYSA-N	0	3	348.512	3.246	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C(C)(C)C(C)(C)C)C[C@H](C)O2	ZINC001098619522	1363402008	/nfs/dbraw/zinc/40/20/08/1363402008.db2.gz	GCUABPUQTVLRHJ-INIZCTEOSA-N	0	3	336.520	3.327	20	30		EGEDHN
CCCCCCCNCc1cn([C@@H]2CCN(C(=O)[C@@H](C)CC)C2)nn1	ZINC001098622441	1363403572	/nfs/dbraw/zinc/40/35/72/1363403572.db2.gz	JAWSVLXKBMXEFZ-FUHWJXTLSA-N	0	3	349.523	3.158	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1CCC(=C)CC1)C[C@H](C)O2	ZINC001098633192	1363408476	/nfs/dbraw/zinc/40/84/76/1363408476.db2.gz	FWVSWRYTLHMKFI-KRWDZBQOSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](n2cc(CNCCCCCCC)nn2)C1	ZINC001098633832	1363408736	/nfs/dbraw/zinc/40/87/36/1363408736.db2.gz	NCKOYSUCJDJYPO-GOSISDBHSA-N	0	3	347.507	3.078	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H](C)C1CCCC1)C[C@@H](C)O2	ZINC001098652419	1363418367	/nfs/dbraw/zinc/41/83/67/1363418367.db2.gz	CZEWSHWEPLKPFB-SJORKVTESA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1sccc1CC)C[C@@H](C)O2	ZINC001098662877	1363425221	/nfs/dbraw/zinc/42/52/21/1363425221.db2.gz	OFFIIFLHUFJQAY-OAHLLOKOSA-N	0	3	348.512	3.192	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)Cc2c(C)cccc2Cl)C1	ZINC001098920820	1363520462	/nfs/dbraw/zinc/52/04/62/1363520462.db2.gz	QSTYXIFKTMAYGN-JXFKEZNVSA-N	0	3	344.886	3.185	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(C)cc(OC)c2C)C1	ZINC001098923317	1363522658	/nfs/dbraw/zinc/52/26/58/1363522658.db2.gz	IJQHQUAAGISFEF-JXFKEZNVSA-N	0	3	328.456	3.082	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)COCc1ccc(C)cc1	ZINC001099101802	1363623208	/nfs/dbraw/zinc/62/32/08/1363623208.db2.gz	DTAYSGBRIYEQKE-IBGZPJMESA-N	0	3	344.499	3.304	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H](C)c2ccc(F)c(F)c2)C1	ZINC001099172292	1363670215	/nfs/dbraw/zinc/67/02/15/1363670215.db2.gz	USKBEJFIPGZOTR-RFUYNDQBSA-N	0	3	334.410	3.225	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H]2Cc3c2cccc3Cl)C1	ZINC001099180962	1363676308	/nfs/dbraw/zinc/67/63/08/1363676308.db2.gz	HHGWEUVOLIALER-AXHNFQJDSA-N	0	3	330.859	3.136	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@](C)(C=C)CC	ZINC001099214171	1363695022	/nfs/dbraw/zinc/69/50/22/1363695022.db2.gz	HPLJYTBXRJGUQI-XLIONFOSSA-N	0	3	336.520	3.398	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H](C)c1cccnc1	ZINC001099310509	1363743836	/nfs/dbraw/zinc/74/38/36/1363743836.db2.gz	OICGDSZGPPOZED-FUHWJXTLSA-N	0	3	329.488	3.368	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@@H](C)c2ccccc2F)C[C@H]1C(F)(F)F	ZINC001099322951	1363750334	/nfs/dbraw/zinc/75/03/34/1363750334.db2.gz	MQMFWGJUTGWATK-NJZAAPMLSA-N	0	3	344.352	3.094	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)C[C@@H](C)c2ccco2)C[C@H]1C(F)(F)F	ZINC001099333477	1363755547	/nfs/dbraw/zinc/75/55/47/1363755547.db2.gz	JGNKFEVOBGXSGV-MGPQQGTHSA-N	0	3	344.377	3.328	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2ccc(C)cc2)C[C@H]1C(F)(F)F	ZINC001099336847	1363757854	/nfs/dbraw/zinc/75/78/54/1363757854.db2.gz	UXOYINQBOWGMON-HUUCEWRRSA-N	0	3	326.362	3.164	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H](C)n1c(C)ccc1C	ZINC001099354279	1363768179	/nfs/dbraw/zinc/76/81/79/1363768179.db2.gz	QCRPVQQPBMTXAA-RTBURBONSA-N	0	3	343.515	3.296	20	30		EGEDHN
C#CCC1(C(=O)NC[C@H]2CCC(C)(C)CN2CCOC)CCCCC1	ZINC001099358161	1363770928	/nfs/dbraw/zinc/77/09/28/1363770928.db2.gz	FRIMITVTCFOPGJ-GOSISDBHSA-N	0	3	348.531	3.213	20	30		EGEDHN
N#Cc1ccccc1CNC[C@]12CCC[C@H]1CN(C(=O)c1ccoc1)C2	ZINC001099376858	1363779400	/nfs/dbraw/zinc/77/94/00/1363779400.db2.gz	OQEYWGHNWBBVNH-FPOVZHCZSA-N	0	3	349.434	3.183	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)[C@@H](CC)CCCC)CC2(CCOCC2)C1	ZINC001099566525	1363852924	/nfs/dbraw/zinc/85/29/24/1363852924.db2.gz	QVTICPDCHWNHKM-ROUUACIJSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)[C@@H](CCC)C(C)C)CC2(CCOCC2)C1	ZINC001099593421	1363875875	/nfs/dbraw/zinc/87/58/75/1363875875.db2.gz	YLGIAGMCTHXHNC-MSOLQXFVSA-N	0	3	336.520	3.232	20	30		EGEDHN
CCCCCCCCCCC(=O)N[C@H]1CCN(CCCF)C[C@H]1O	ZINC001100083621	1364011339	/nfs/dbraw/zinc/01/13/39/1364011339.db2.gz	UTWXLNGLQGHGNO-ZWKOTPCHSA-N	0	3	344.515	3.428	20	30		EGEDHN
CC(C)[C@H](C)CC(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100172885	1364035515	/nfs/dbraw/zinc/03/55/15/1364035515.db2.gz	IAMSUQMINDLXHD-QHGAOEGBSA-N	0	3	326.484	3.205	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCC1CC(NCc2ccc(Cl)cc2Cl)C1	ZINC001100196734	1364042024	/nfs/dbraw/zinc/04/20/24/1364042024.db2.gz	RNGSAUJEVXJGBF-IFQILLTASA-N	0	3	340.254	3.137	20	30		EGEDHN
O=C(CC1CCC1)NCC1CC(NCC#Cc2cccc(Cl)c2)C1	ZINC001100222688	1364048823	/nfs/dbraw/zinc/04/88/23/1364048823.db2.gz	KBJHQQSKKCRLKD-UHFFFAOYSA-N	0	3	344.886	3.366	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](CNCc2cnc(C)o2)[C@@H](C)C1	ZINC001185226507	1387656638	/nfs/dbraw/zinc/65/66/38/1387656638.db2.gz	PPLKTIDOJUUEBO-HOCLYGCPSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](CNCc2nccs2)[C@@H](C)C1	ZINC001185227002	1387656769	/nfs/dbraw/zinc/65/67/69/1387656769.db2.gz	ULXVEQKCVLOOTJ-LSDHHAIUSA-N	0	3	335.517	3.320	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)NCC1CC(NCC#Cc2ccccc2Cl)C1	ZINC001100246305	1364057539	/nfs/dbraw/zinc/05/75/39/1364057539.db2.gz	YPFYPWXXNWTTAP-BDVYOWHSSA-N	0	3	344.886	3.222	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)[C@@H](C)CCCC)C1	ZINC001100296421	1364071075	/nfs/dbraw/zinc/07/10/75/1364071075.db2.gz	CZVJHIRLYAMZLR-XGNXJENSSA-N	0	3	331.298	3.206	20	30		EGEDHN
CC/C(C)=C\C(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100306577	1364074586	/nfs/dbraw/zinc/07/45/86/1364074586.db2.gz	UQDKLZGGISGAJN-PTNGSMBKSA-N	0	3	328.431	3.018	20	30		EGEDHN
C#CCC1(C(=O)NCC2CC(NCc3ccc(F)cc3F)C2)CCC1	ZINC001100396418	1364101151	/nfs/dbraw/zinc/10/11/51/1364101151.db2.gz	APORNQRUPXIGQW-UHFFFAOYSA-N	0	3	346.421	3.143	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C/C=C/c2ccc(F)cc2)C1	ZINC001100441162	1364116030	/nfs/dbraw/zinc/11/60/30/1364116030.db2.gz	GHCMTXNRSDAMIL-NSCUHMNNSA-N	0	3	336.838	3.466	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)[C@H](C)C(C)(C)C)C1	ZINC001100448575	1364118660	/nfs/dbraw/zinc/11/86/60/1364118660.db2.gz	YPYXHEUESFTHQB-HIFPTAJRSA-N	0	3	331.298	3.062	20	30		EGEDHN
CC1(C(=O)NCC2CC(NCC#Cc3ccc(F)cc3)C2)CCCC1	ZINC001100548383	1364156534	/nfs/dbraw/zinc/15/65/34/1364156534.db2.gz	SMFPNXSTOPRATL-UHFFFAOYSA-N	0	3	342.458	3.242	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C(C)(C)c2cccs2)C1	ZINC001100569364	1364166389	/nfs/dbraw/zinc/16/63/89/1364166389.db2.gz	YEWOFAVBONGIBK-UHFFFAOYSA-N	0	3	326.893	3.263	20	30		EGEDHN
CC(C)(C(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1)C1CC1	ZINC001100597909	1364181759	/nfs/dbraw/zinc/18/17/59/1364181759.db2.gz	AFILEVQORKMAQS-UHFFFAOYSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)CC2CC(C)(C)C2)C1	ZINC001100604580	1364186106	/nfs/dbraw/zinc/18/61/06/1364186106.db2.gz	QAKPPZQMWHNCGD-UHFFFAOYSA-N	0	3	343.309	3.206	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100656864	1364206617	/nfs/dbraw/zinc/20/66/17/1364206617.db2.gz	PFIHOHXCWXMVPM-LNXHZJMOSA-N	0	3	342.458	3.098	20	30		EGEDHN
O=C(NCC1CC(NCC#Cc2ccccc2)C1)[C@]12C[C@H]1CCCC2	ZINC001100656897	1364206808	/nfs/dbraw/zinc/20/68/08/1364206808.db2.gz	QLCRLOFWWDOJNF-ZKNLVJASSA-N	0	3	336.479	3.103	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)C[C@@H](C)CC(C)C)C1	ZINC001100855155	1364293619	/nfs/dbraw/zinc/29/36/19/1364293619.db2.gz	SMQGPURINRQKLE-GRTSSRMGSA-N	0	3	345.325	3.452	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H](C)c2ccc(F)c(F)c2)C1	ZINC001101006380	1364367883	/nfs/dbraw/zinc/36/78/83/1364367883.db2.gz	HTJJSBOOFRMCEK-DCBWTQNWSA-N	0	3	342.817	3.305	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)CCc2cc(F)ccc2F)C1	ZINC001101036224	1364383951	/nfs/dbraw/zinc/38/39/51/1364383951.db2.gz	LEQNUXLCSYNYAW-UHFFFAOYSA-N	0	3	342.817	3.134	20	30		EGEDHN
C=CCN1CC[C@H](Oc2ccnc(CNC(=O)C=C(CC)CC)c2)C1	ZINC001101091766	1364409178	/nfs/dbraw/zinc/40/91/78/1364409178.db2.gz	HICBEWXTWLYYFE-IBGZPJMESA-N	0	3	343.471	3.083	20	30		EGEDHN
C#CCCCC(=O)N1CCC(C(C)(C)CNCc2coc(C)n2)CC1	ZINC001101534646	1364604042	/nfs/dbraw/zinc/60/40/42/1364604042.db2.gz	PVPWYYJMPJGJMC-UHFFFAOYSA-N	0	3	345.487	3.141	20	30		EGEDHN
CC(C)=CC(=O)NC[C@@H]1CN(CC#Cc2cccc(Cl)c2)C[C@H]1C	ZINC001101699508	1364694842	/nfs/dbraw/zinc/69/48/42/1364694842.db2.gz	DODXEBJFSJECRJ-SJLPKXTDSA-N	0	3	344.886	3.342	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1C	ZINC001102011639	1364811320	/nfs/dbraw/zinc/81/13/20/1364811320.db2.gz	KBSYXCQSVVSLFX-CRAIPNDOSA-N	0	3	343.446	3.238	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1CNC(=O)[C@@]1(C)C=CCC1	ZINC001102246440	1364960964	/nfs/dbraw/zinc/96/09/64/1364960964.db2.gz	GWBIZTFPDTTZGT-UZKOGDIHSA-N	0	3	336.479	3.079	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@@H]1CN(Cc2oc(CC)nc2C)C[C@H]1C	ZINC001102326718	1365002401	/nfs/dbraw/zinc/00/24/01/1365002401.db2.gz	ZPAQLUAFRGFNIC-KKVAFCGZSA-N	0	3	347.503	3.332	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001102328286	1365003834	/nfs/dbraw/zinc/00/38/34/1365003834.db2.gz	CQVPVXNHHCLOBQ-CLCXKQKWSA-N	0	3	345.512	3.406	20	30		EGEDHN
C=C[C@@H](C(=O)NC[C@@H]1CN(C/C=C/Cl)C[C@H]1C)c1ccccc1	ZINC001102592019	1365128307	/nfs/dbraw/zinc/12/83/07/1365128307.db2.gz	JENAJJZKUUSMBB-JZPQVBBNSA-N	0	3	332.875	3.393	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CCNC(=O)c1ccoc1	ZINC001102662270	1365160071	/nfs/dbraw/zinc/16/00/71/1365160071.db2.gz	QGWOUEZXQBBVFT-ZIAGYGMSSA-N	0	3	343.452	3.101	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)Cc2ccccc2C)C1	ZINC001103708692	1365743972	/nfs/dbraw/zinc/74/39/72/1365743972.db2.gz	OMTPYFNUDUUOFT-CRAIPNDOSA-N	0	3	334.891	3.364	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cc3n(c2)CCCC3)C1	ZINC001103792125	1365785473	/nfs/dbraw/zinc/78/54/73/1365785473.db2.gz	HHXNNDGQBBCVNH-GDBMZVCRSA-N	0	3	349.906	3.265	20	30		EGEDHN
C/C=C(/C)C(=O)N1C[C@@H](C)[C@H](CCNCc2ccccc2C#N)C1	ZINC001104053768	1365892343	/nfs/dbraw/zinc/89/23/43/1365892343.db2.gz	IZUHTBFEVDMXSN-NNNWFYCTSA-N	0	3	325.456	3.099	20	30		EGEDHN
CC(C)=C(F)C(=O)N1C[C@@H](C)[C@H](CCNCc2ccccc2C#N)C1	ZINC001104063283	1365896096	/nfs/dbraw/zinc/89/60/96/1365896096.db2.gz	VFSDORZSEJPIRV-CRAIPNDOSA-N	0	3	343.446	3.396	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CN(C(=O)[C@@H]2CC2(C)C)C[C@H]1C	ZINC001104078864	1365902373	/nfs/dbraw/zinc/90/23/73/1365902373.db2.gz	TYDSDILPOGOXDC-BNOWGMLFSA-N	0	3	343.309	3.015	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@@H](C)[C@H](CCNCc2cc(C)no2)C1	ZINC001104563633	1366078998	/nfs/dbraw/zinc/07/89/98/1366078998.db2.gz	PNOOSMMJVDMCKL-HYVNUMGLSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H](C)[C@H](CCNCc3cnc(C)o3)C2)CC1	ZINC001104631304	1366110099	/nfs/dbraw/zinc/11/00/99/1366110099.db2.gz	IPMNVOJLVBPFEI-CRAIPNDOSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCCC1(C(=O)N2C[C@@H](C)[C@H](CCNCc3ocnc3C)C2)CC1	ZINC001104631292	1366110240	/nfs/dbraw/zinc/11/02/40/1366110240.db2.gz	IDKPGFOYCNDZKH-NVXWUHKLSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H](C)[C@H](CCNCc2cnoc2C)C1	ZINC001104631181	1366110326	/nfs/dbraw/zinc/11/03/26/1366110326.db2.gz	CXORYGRSVGHMHX-OGWOLHLISA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2ocnc2C(F)F)C[C@H]1C	ZINC001104682992	1366129992	/nfs/dbraw/zinc/12/99/92/1366129992.db2.gz	FDQFWEFDEZSSLU-MWLCHTKSSA-N	0	3	347.793	3.053	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H](C)[C@H](CCNCc2ocnc2C)C1	ZINC001104731813	1366149084	/nfs/dbraw/zinc/14/90/84/1366149084.db2.gz	ZFSRREOPKPNPMK-GDBMZVCRSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2c[nH]c3cccnc32)C[C@H]1C	ZINC001104912169	1366220478	/nfs/dbraw/zinc/22/04/78/1366220478.db2.gz	NXONHGVWWHAGLS-TZMCWYRMSA-N	0	3	346.862	3.003	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2n[nH]c3ccccc32)C[C@H]1C	ZINC001104971359	1366249266	/nfs/dbraw/zinc/24/92/66/1366249266.db2.gz	HOFKVMYEUOJUGJ-TZMCWYRMSA-N	0	3	346.862	3.003	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)Cc2ccccc2C)C[C@H]1C	ZINC001104994106	1366262869	/nfs/dbraw/zinc/26/28/69/1366262869.db2.gz	HQIOKNHNBPLPTC-CRAIPNDOSA-N	0	3	334.891	3.364	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)[C@H](C)CC(C)C)CC1	ZINC001105396016	1366444439	/nfs/dbraw/zinc/44/44/39/1366444439.db2.gz	GZOJRHRZSGNYQD-IEBWSBKVSA-N	0	3	330.516	3.395	20	30		EGEDHN
C=CC[NH2+]CC1([C@@H]2CCCCN2C(=O)c2ccccc2[O-])CCC1	ZINC001105508467	1366499649	/nfs/dbraw/zinc/49/96/49/1366499649.db2.gz	CXEMDPWZPVBUSA-SFHVURJKSA-N	0	3	328.456	3.333	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](CNCc2nc(C)cs2)[C@H](C)C1	ZINC001106564393	1366737355	/nfs/dbraw/zinc/73/73/55/1366737355.db2.gz	ZMARMHHUNMJGGE-SQWLQELKSA-N	0	3	335.517	3.238	20	30		EGEDHN
C[C@H](C#N)C(=O)NC[C@]12CCC[C@H]1N(Cc1ccc(Cl)cc1)CC2	ZINC001107335894	1366931878	/nfs/dbraw/zinc/93/18/78/1366931878.db2.gz	DWUKSUVYZSIFTN-LSBZLQRGSA-N	0	3	345.874	3.360	20	30		EGEDHN
CCC(CC)[C@H](C)C(=O)NC[C@]12CCC[C@H]1N(CC#CCOC)CC2	ZINC001107458737	1366971158	/nfs/dbraw/zinc/97/11/58/1366971158.db2.gz	JRHDRGUHVWROGB-FBBABVLZSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@]12CCC[C@H]1N(Cc1cc(C)no1)CC2	ZINC001107495227	1366994339	/nfs/dbraw/zinc/99/43/39/1366994339.db2.gz	KSWKWFZNUAOCQL-VQIMIIECSA-N	0	3	331.460	3.056	20	30		EGEDHN
CC[C@@H](F)C(=O)NC[C@]12CCC[C@H]1N(CC#Cc1ccccc1)CC2	ZINC001107508107	1367008052	/nfs/dbraw/zinc/00/80/52/1367008052.db2.gz	WEGOKEXKTYALQK-SFHLNBCPSA-N	0	3	342.458	3.147	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@]12CCC[C@H]1N(Cc1cnoc1C)CC2	ZINC001107514681	1367012239	/nfs/dbraw/zinc/01/22/39/1367012239.db2.gz	QUEOVQFUDOUVEB-QKYXUNIQSA-N	0	3	345.487	3.446	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2ccc(F)cc2)C1	ZINC001107691751	1367104987	/nfs/dbraw/zinc/10/49/87/1367104987.db2.gz	CXWGPVLGKFLVJS-KXBFYZLASA-N	0	3	334.435	3.001	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2C[C@@H]1CC(C)(C)CO1	ZINC001109597239	1367221281	/nfs/dbraw/zinc/22/12/81/1367221281.db2.gz	FEROCKQTNGTGPY-QZWWFDLISA-N	0	3	334.504	3.125	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](CCC)c1ccccn1)C2	ZINC001109647107	1367261842	/nfs/dbraw/zinc/26/18/42/1367261842.db2.gz	LYCXXDAQRKKMDG-FPAYPSAMSA-N	0	3	327.472	3.263	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](N(C)Cc2ccc(OC)c(C)c2)C1	ZINC001190435930	1367264528	/nfs/dbraw/zinc/26/45/28/1367264528.db2.gz	MLTIRWSILFAKSR-GOSISDBHSA-N	0	3	330.472	3.393	20	30		EGEDHN
CN1CCC(N(C(=O)c2cccc(C#N)c2F)C2CCCC2)CC1	ZINC001190545110	1367289643	/nfs/dbraw/zinc/28/96/43/1367289643.db2.gz	IPSJYVXAJIPFHI-UHFFFAOYSA-N	0	3	329.419	3.176	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@@]1(C)CN([C@@H](C)CCC=C)CCO1	ZINC001108121729	1367291199	/nfs/dbraw/zinc/29/11/99/1367291199.db2.gz	FLZISQGCTBXHAF-ICSRJNTNSA-N	0	3	334.504	3.132	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2cc[nH]c2CCC)C1	ZINC001108154929	1367315182	/nfs/dbraw/zinc/31/51/82/1367315182.db2.gz	KGELVYKDNTVPMW-JXFKEZNVSA-N	0	3	347.503	3.143	20	30		EGEDHN
C=CCC1(C(=O)NC[C@]2(C)CN(CC(CC)CC)CCO2)CCC1	ZINC001108187243	1367329932	/nfs/dbraw/zinc/32/99/32/1367329932.db2.gz	CVMHRIGVAYGOPL-LJQANCHMSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)C2CCC(=C)CC2)C1	ZINC001108186380	1367330303	/nfs/dbraw/zinc/33/03/03/1367330303.db2.gz	OMXIOYACLIURCK-XLIONFOSSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2CC[C@@H](N(C)CC=C(C)C)C2)cc1	ZINC001190974497	1367391918	/nfs/dbraw/zinc/39/19/18/1367391918.db2.gz	ZSZBUHXKDBMPIN-GOSISDBHSA-N	0	3	328.456	3.364	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2c(C)cccc2F)C1	ZINC001108440800	1367458284	/nfs/dbraw/zinc/45/82/84/1367458284.db2.gz	FHPIPJUFDWYJDY-UZLBHIALSA-N	0	3	348.462	3.310	20	30		EGEDHN
CCCCCCN(C)CC(=O)N[C@@H](C)CNc1cccc(F)c1C#N	ZINC001108483224	1367473025	/nfs/dbraw/zinc/47/30/25/1367473025.db2.gz	WBSODSOENOJGOS-HNNXBMFYSA-N	0	3	348.466	3.126	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)COc1ccccc1Cl)C2	ZINC001110094171	1367500447	/nfs/dbraw/zinc/50/04/47/1367500447.db2.gz	OOYOUHWWRFZDEK-KBMXLJTQSA-N	0	3	334.847	3.016	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1cccc(OC)c1C	ZINC001110378862	1367678789	/nfs/dbraw/zinc/67/87/89/1367678789.db2.gz	LQDGCJUBMZVILZ-KURKYZTESA-N	0	3	328.456	3.191	20	30		EGEDHN
C=CCOCCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccccc1C	ZINC001110424166	1367708749	/nfs/dbraw/zinc/70/87/49/1367708749.db2.gz	ILGSBMHOPULIEC-AQNXPRMDSA-N	0	3	342.483	3.199	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](N(C)CCOCCC(C)C)C2)CCC1	ZINC001192189651	1367712149	/nfs/dbraw/zinc/71/21/49/1367712149.db2.gz	HFUQZAWKUSDBQW-SFHVURJKSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](N(C)C[C@@H]3CC(C)(C)CO3)C2)CCC1	ZINC001192227558	1367724103	/nfs/dbraw/zinc/72/41/03/1367724103.db2.gz	SBQVXLDFJIGXCT-SJORKVTESA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)[C@H](F)CC2CCCCC2)C1	ZINC001193468837	1368038456	/nfs/dbraw/zinc/03/84/56/1368038456.db2.gz	IUYKVDAHFRFZKY-ZWKOTPCHSA-N	0	3	340.483	3.030	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3C[C@H]2CCCCO2)CCC1	ZINC001110987604	1368134570	/nfs/dbraw/zinc/13/45/70/1368134570.db2.gz	WOOXTZBRYPRMSX-TVFCKZIOSA-N	0	3	332.488	3.023	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](Cc1ccccc1)C(C)C)C2	ZINC001111021603	1368145189	/nfs/dbraw/zinc/14/51/89/1368145189.db2.gz	AWHPYYUWDXZFNV-MHTWAQMVSA-N	0	3	338.495	3.246	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)C2(CC=C)CCCCC2)C1	ZINC001194192989	1368205758	/nfs/dbraw/zinc/20/57/58/1368205758.db2.gz	ZZUSCZOPQWDUKB-SFHVURJKSA-N	0	3	334.504	3.248	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C1CCC(C3CC3)CC1)C2	ZINC001111334381	1368268414	/nfs/dbraw/zinc/26/84/14/1368268414.db2.gz	YVNVNMPNAZQQNK-WKXIVMOISA-N	0	3	346.515	3.127	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)c2cc(C)sc2C)C1	ZINC001194469247	1368269158	/nfs/dbraw/zinc/26/91/58/1368269158.db2.gz	WXDQQYMVMFRJIS-IAGOWNOFSA-N	0	3	338.517	3.110	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](C)CCc1cccc(F)c1)C2	ZINC001111434546	1368307054	/nfs/dbraw/zinc/30/70/54/1368307054.db2.gz	SKLYOGHCIBRZCU-XLNTUCKNSA-N	0	3	342.458	3.139	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)C[C@H](NC(=O)C=C(C)C)c1ccccc1O2	ZINC001111530207	1368330282	/nfs/dbraw/zinc/33/02/82/1368330282.db2.gz	UVQFRNMDWCWRMF-RXVVDRJESA-N	0	3	338.451	3.060	20	30		EGEDHN
C#CCCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(C#N)cc1)C2	ZINC001111711317	1368426985	/nfs/dbraw/zinc/42/69/85/1368426985.db2.gz	MXLPXGTWRDTRSQ-UNMCSNQZSA-N	0	3	349.478	3.223	20	30		EGEDHN
Cc1cc(C#N)cc(C(=O)N(C2CCCC2)C2CCN(C)CC2)c1	ZINC001195419762	1368434419	/nfs/dbraw/zinc/43/44/19/1368434419.db2.gz	ULNXQXCRDAWVNE-UHFFFAOYSA-N	0	3	325.456	3.346	20	30		EGEDHN
C=CCOCCCC(=O)N1CCCN(Cc2ccc(C)cc2C)CC1	ZINC001195434879	1368436330	/nfs/dbraw/zinc/43/63/30/1368436330.db2.gz	UHQMTLYFHDIWPM-UHFFFAOYSA-N	0	3	344.499	3.321	20	30		EGEDHN
O=C(N[C@H]1CCCc2ccccc21)N1CCC2SC(=O)C=C2C1	ZINC001186430307	1387940808	/nfs/dbraw/zinc/94/08/08/1387940808.db2.gz	BQXTZUWJJFFHEJ-JKSUJKDBSA-N	0	3	328.437	3.048	20	30		EGEDHN
C#CCCCC(=O)N1CCCN(Cc2c(C)cc(C)cc2C)CC1	ZINC001195644815	1368464075	/nfs/dbraw/zinc/46/40/75/1368464075.db2.gz	AOMWMHCIEWETLB-UHFFFAOYSA-N	0	3	326.484	3.450	20	30		EGEDHN
C#CCCCC(=O)N1CCCN(CCc2ccc(CC)cc2)CC1	ZINC001195681581	1368471952	/nfs/dbraw/zinc/47/19/52/1368471952.db2.gz	GICBTTCEQUGNSN-UHFFFAOYSA-N	0	3	326.484	3.129	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)COc2ccccc2C(C)C)C1	ZINC001111969677	1368579535	/nfs/dbraw/zinc/57/95/35/1368579535.db2.gz	CHUBZHXIWVHLSX-UWJYYQICSA-N	0	3	342.483	3.346	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2c[nH]nc2CCC)CC1	ZINC001196395342	1368606525	/nfs/dbraw/zinc/60/65/25/1368606525.db2.gz	PQBQDBJGCDDGBB-UHFFFAOYSA-N	0	3	332.492	3.257	20	30		EGEDHN
C=CCCC1(C(=O)N2CCCN(C[C@@H](O)C3CCCCC3)CC2)CC1	ZINC001197061742	1368738004	/nfs/dbraw/zinc/73/80/04/1368738004.db2.gz	GPCAYQACBHMPLR-LJQANCHMSA-N	0	3	348.531	3.208	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@@](C)(CC)CCC)C1	ZINC001197215326	1368764320	/nfs/dbraw/zinc/76/43/20/1368764320.db2.gz	PVUWIZNYHQGPOA-LMMKCTJWSA-N	0	3	326.525	3.335	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H]2CCC[C@]2(CNCc2ocnc2C)C1	ZINC001112377602	1368804274	/nfs/dbraw/zinc/80/42/74/1368804274.db2.gz	ZLKJPZCHNKUTNC-LPHOPBHVSA-N	0	3	331.460	3.058	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@H](F)CCCCCC)C1	ZINC001197783743	1368896366	/nfs/dbraw/zinc/89/63/66/1368896366.db2.gz	QEYMCPUVRJPRBH-KZNAEPCWSA-N	0	3	344.515	3.427	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2ocnc2C)C1	ZINC001112537668	1368919262	/nfs/dbraw/zinc/91/92/62/1368919262.db2.gz	RYXBDLLAQBORPD-JXFKEZNVSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](C2CCN(C(=O)CCOC)CC2)CC1	ZINC001186569316	1387971207	/nfs/dbraw/zinc/97/12/07/1387971207.db2.gz	JLFKDUZNCLEEFL-INIZCTEOSA-N	0	3	342.911	3.116	20	30		EGEDHN
C=CC[C@H](C(=O)N1CCCN(CCCOCC)CC1)c1ccccc1	ZINC001198197349	1368978471	/nfs/dbraw/zinc/97/84/71/1368978471.db2.gz	LRTNQIQHFXRBQS-FQEVSTJZSA-N	0	3	344.499	3.307	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)c1cc(C)no1)c1ccccc1OC	ZINC001198522803	1369052600	/nfs/dbraw/zinc/05/26/00/1369052600.db2.gz	QTUVNDJXFXZPFZ-INIZCTEOSA-N	0	3	343.427	3.019	20	30		EGEDHN
C=CCC[C@@H](C)N[C@@H](CNC(=O)COC(C)C)c1ccccc1OC	ZINC001198584463	1369066110	/nfs/dbraw/zinc/06/61/10/1369066110.db2.gz	HRRFEKZMGBGGHM-AEFFLSMTSA-N	0	3	348.487	3.222	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)/C=C/C1CC1)c1ccccc1OC	ZINC001198637667	1369078965	/nfs/dbraw/zinc/07/89/65/1369078965.db2.gz	SHAOIVZROYARAL-HHNLSAEISA-N	0	3	328.456	3.375	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)[C@@H](C)C1CC1)c1ccccc1OC	ZINC001198647883	1369081773	/nfs/dbraw/zinc/08/17/73/1369081773.db2.gz	RCYYFOZLBYSJDQ-MAUKXSAKSA-N	0	3	330.472	3.454	20	30		EGEDHN
COc1ccccc1[C@H](CNC(=O)C#CC(C)(C)C)NCC[C@@H](C)F	ZINC001198723744	1369099485	/nfs/dbraw/zinc/09/94/85/1369099485.db2.gz	JUEHIIJHFJCTIE-WBVHZDCISA-N	0	3	348.462	3.240	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@@H](OCC)C(C)C)c1ccccc1OC	ZINC001198724132	1369100440	/nfs/dbraw/zinc/10/04/40/1369100440.db2.gz	PXFXVWLJMIESFN-HKUYNNGSSA-N	0	3	348.487	3.079	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H](NCCCOCC)c1ccccc1OC	ZINC001198834265	1369125290	/nfs/dbraw/zinc/12/52/90/1369125290.db2.gz	KMHQHKXURZWRGZ-QGZVFWFLSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@H](NCC(C)C)c2ccccc2OC)C1	ZINC001198895952	1369143171	/nfs/dbraw/zinc/14/31/71/1369143171.db2.gz	YYDOXMBOPKWDLU-QGZVFWFLSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)C[C@@H]2CCOc3ccccc32)CC1	ZINC001113184666	1369250813	/nfs/dbraw/zinc/25/08/13/1369250813.db2.gz	RSPFDTJOHYUVQI-ROUUACIJSA-N	0	3	342.483	3.442	20	30		EGEDHN
C=CCOc1ccccc1[C@@H](C)NC(=S)NCCN1CCCCC1	ZINC001200440700	1369369263	/nfs/dbraw/zinc/36/92/63/1369369263.db2.gz	UQFNKFUANOYDIB-MRXNPFEDSA-N	0	3	347.528	3.262	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CCC(NC/C(Cl)=C\Cl)CC1)OCC	ZINC001200849999	1369438737	/nfs/dbraw/zinc/43/87/37/1369438737.db2.gz	DPAJXLDPHLJTSQ-NRMKIYEFSA-N	0	3	349.302	3.257	20	30		EGEDHN
CC[C@H](CC(F)F)C(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001201002619	1369465401	/nfs/dbraw/zinc/46/54/01/1369465401.db2.gz	RWCKFODOIKZENQ-CQSZACIVSA-N	0	3	349.425	3.320	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCCO[C@H](CNCc2ccsc2)C1	ZINC001201232395	1369500717	/nfs/dbraw/zinc/50/07/17/1369500717.db2.gz	FYUXSYWYDIDADP-DOTOQJQBSA-N	0	3	336.501	3.058	20	30		EGEDHN
C=CCCC1(C(=O)N2CCCO[C@H](CNCc3ccsc3)C2)CC1	ZINC001201335369	1369522184	/nfs/dbraw/zinc/52/21/84/1369522184.db2.gz	NOGOVSVSQDDCJB-QGZVFWFLSA-N	0	3	348.512	3.202	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)Cc2cccc(OCC)c2)CC1	ZINC001113689447	1369565850	/nfs/dbraw/zinc/56/58/50/1369565850.db2.gz	PKORDNIKNIWGCL-QGZVFWFLSA-N	0	3	330.472	3.127	20	30		EGEDHN
CC#CCNC[C@H]1CN(C(=O)[C@H](CCC)CC2CCCC2)CCCO1	ZINC001201546705	1369572285	/nfs/dbraw/zinc/57/22/85/1369572285.db2.gz	MHUFCCMQKGHUAN-UXHICEINSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=C(Cl)CN1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)Cc1cccnc1C)C2	ZINC001325628420	1388014705	/nfs/dbraw/zinc/01/47/05/1388014705.db2.gz	DKWWJXIAHYDKIU-VBUUOAMHSA-N	0	3	347.890	3.044	20	30		EGEDHN
CCCCCCCCCCS(=O)(=O)N[C@H]1CCN(C)C[C@@H]1C	ZINC001201837830	1369631638	/nfs/dbraw/zinc/63/16/38/1369631638.db2.gz	VEMJFHYUFQDWLC-IRXDYDNUSA-N	0	3	332.554	3.387	20	30		EGEDHN
CC#CCNC[C@H]1CN(C(=O)C2CCC(CCCC)CC2)CCCO1	ZINC001202005718	1369665748	/nfs/dbraw/zinc/66/57/48/1369665748.db2.gz	IZEAZPSBUKSQPK-MHJFOBGBSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=C(Br)CNC1CCN(C(=O)CC(C)=C(C)C)CC1	ZINC001202020704	1369669263	/nfs/dbraw/zinc/66/92/63/1369669263.db2.gz	URJLAKREZQIKEM-UHFFFAOYSA-N	0	3	329.282	3.222	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC(N[C@H](C)c2cnc(C)cn2)CC1	ZINC001202122732	1369692671	/nfs/dbraw/zinc/69/26/71/1369692671.db2.gz	GGIOMFYPAXKBIN-GOEBONIOSA-N	0	3	330.476	3.029	20	30		EGEDHN
CC#CCNC[C@H]1CN(C(=O)c2ccc([C@H](C)CC)cc2)CCCO1	ZINC001202174539	1369707684	/nfs/dbraw/zinc/70/76/84/1369707684.db2.gz	VYJZBEWFZZXBBE-XLIONFOSSA-N	0	3	342.483	3.044	20	30		EGEDHN
CC(C)C(=O)N[C@H]1C[C@@H](NCC#Cc2ccccc2Cl)C12CCC2	ZINC001202458181	1369777430	/nfs/dbraw/zinc/77/74/30/1369777430.db2.gz	BLEHDADESVKWSB-MSOLQXFVSA-N	0	3	344.886	3.365	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1[C@H]2CN(CCCc3ccccc3Cl)C[C@H]21	ZINC001114198851	1369789693	/nfs/dbraw/zinc/78/96/93/1369789693.db2.gz	JUHVWBNTWDGWAZ-YRWFTTLQSA-N	0	3	344.886	3.123	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)CC(C)(C)C)C12CCC2	ZINC001202503619	1369792921	/nfs/dbraw/zinc/79/29/21/1369792921.db2.gz	YTMZVNAQYMGNEU-QWHCGFSZSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C(CC)CC)C12CCC2	ZINC001202520708	1369797634	/nfs/dbraw/zinc/79/76/34/1369797634.db2.gz	KLDOSEOENJSWSZ-KBPBESRZSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@@H](NCc2ccc(F)cc2F)C12CCC2	ZINC001202591140	1369815549	/nfs/dbraw/zinc/81/55/49/1369815549.db2.gz	NRDAUMUYVDLBAI-IAGOWNOFSA-N	0	3	334.410	3.448	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@@H](NCc2ccncc2Cl)C12CCC2	ZINC001202593289	1369816691	/nfs/dbraw/zinc/81/66/91/1369816691.db2.gz	ZMZGXYLVTJCXMZ-HZPDHXFCSA-N	0	3	333.863	3.218	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C12CCC2	ZINC001202598511	1369818235	/nfs/dbraw/zinc/81/82/35/1369818235.db2.gz	GZRSRBPPKGBDAR-ROUUACIJSA-N	0	3	341.430	3.181	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@@H](NCc2c(C)noc2CC)C12CCC2	ZINC001202618031	1369825937	/nfs/dbraw/zinc/82/59/37/1369825937.db2.gz	RPQCBLNYHRVQLO-IAGOWNOFSA-N	0	3	331.460	3.029	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC(NCc2nc(C)sc2C)CC1	ZINC001202694240	1369853808	/nfs/dbraw/zinc/85/38/08/1369853808.db2.gz	IVZOBJHORSILEG-UHFFFAOYSA-N	0	3	335.517	3.443	20	30		EGEDHN
N#Cc1cccc(NC(=O)N2CC[C@H]3CN(Cc4ccccc4)C[C@@H]32)c1	ZINC001202788410	1369893082	/nfs/dbraw/zinc/89/30/82/1369893082.db2.gz	NWQSUEUGKSVNPV-ICSRJNTNSA-N	0	3	346.434	3.296	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1[C@H]2CN(Cc3cc(C)ccc3OC)C[C@H]21	ZINC001114340184	1369900459	/nfs/dbraw/zinc/90/04/59/1369900459.db2.gz	BQKQFTQOTSYDCH-YRWFTTLQSA-N	0	3	342.483	3.152	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1C[C@@H](NCc2cccc(Cl)n2)C12CCC2	ZINC001202845731	1369906321	/nfs/dbraw/zinc/90/63/21/1369906321.db2.gz	DPWFLJJLNNFUBY-HZPDHXFCSA-N	0	3	345.874	3.056	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H]1C[C@@H](NCc2cccc(F)c2F)C12CCC2	ZINC001202868116	1369912985	/nfs/dbraw/zinc/91/29/85/1369912985.db2.gz	VSVZLNYJOYGIMR-SJORKVTESA-N	0	3	346.421	3.141	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1C[C@@H](NCc2conc2C)C12CCC2	ZINC001202959898	1369937354	/nfs/dbraw/zinc/93/73/54/1369937354.db2.gz	IAVWKQBBGIIZRT-HZPDHXFCSA-N	0	3	331.460	3.102	20	30		EGEDHN
CN1Cc2c(NC(=O)[C@@H]3C[C@@H]3C#N)cccc2[C@H](c2ccccc2)C1	ZINC001186976376	1388033758	/nfs/dbraw/zinc/03/37/58/1388033758.db2.gz	CAIQGPQATIDMNX-NXHRZFHOSA-N	0	3	331.419	3.362	20	30		EGEDHN
CC(C)(C)CCC(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001203010628	1369952925	/nfs/dbraw/zinc/95/29/25/1369952925.db2.gz	UXFDRMRHAVWNQM-UHFFFAOYSA-N	0	3	327.472	3.465	20	30		EGEDHN
C=C(Br)CNC1CCN(C(=O)CCC2(C)CC2)CC1	ZINC001203181847	1370013720	/nfs/dbraw/zinc/01/37/20/1370013720.db2.gz	LMTXUUCOKHJPQJ-UHFFFAOYSA-N	0	3	329.282	3.056	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1[C@H]2CN(Cc3cc(F)ccc3C)C[C@H]21	ZINC001114692621	1370029309	/nfs/dbraw/zinc/02/93/09/1370029309.db2.gz	LKCZDUFDTWMOEK-KXTWHKPSSA-N	0	3	342.458	3.264	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1C[C@@H](NCc2cncs2)C12CCC2	ZINC001203255503	1370043138	/nfs/dbraw/zinc/04/31/38/1370043138.db2.gz	BWGCKEUWGNFWLZ-HUUCEWRRSA-N	0	3	333.501	3.262	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1C[C@H](NCc2ocnc2C)C12CCC2	ZINC001203258606	1370045620	/nfs/dbraw/zinc/04/56/20/1370045620.db2.gz	SPOWMCNYIHLTMP-HOTGVXAUSA-N	0	3	331.460	3.102	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001203280448	1370059650	/nfs/dbraw/zinc/05/96/50/1370059650.db2.gz	HIRPVNBUJSLLFJ-LEWJYISDSA-N	0	3	348.490	3.249	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2C[C@@H](NCc3cnoc3C)C23CCC3)CCC1	ZINC001203365602	1370099751	/nfs/dbraw/zinc/09/97/51/1370099751.db2.gz	HZANPOMBKJPEIB-IAGOWNOFSA-N	0	3	343.471	3.246	20	30		EGEDHN
CC(F)(F)CC(=O)N[C@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001203372096	1370102852	/nfs/dbraw/zinc/10/28/52/1370102852.db2.gz	CJQJVGRIKQZWHQ-IRXDYDNUSA-N	0	3	346.421	3.100	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1C[C@H](NCc2conc2C)C12CCC2	ZINC001203453030	1370131977	/nfs/dbraw/zinc/13/19/77/1370131977.db2.gz	QWYPZNDCSVRXSW-JKSUJKDBSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1[C@H]2CN([C@H](C)c3cccc(OC)c3)C[C@H]21	ZINC001114897292	1370136483	/nfs/dbraw/zinc/13/64/83/1370136483.db2.gz	XYETVXGHMJGBNB-OAOYMFHYSA-N	0	3	342.483	3.405	20	30		EGEDHN
N#CC1(c2ccccc2)CC(NCc2ccc(Cn3cncn3)cc2)C1	ZINC001325871727	1388057759	/nfs/dbraw/zinc/05/77/59/1388057759.db2.gz	GIBAQUWLZHVQOW-UHFFFAOYSA-N	0	3	343.434	3.040	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)COc2ccc(C)cc2)C12CCC2	ZINC001203695094	1370223103	/nfs/dbraw/zinc/22/31/03/1370223103.db2.gz	PFHOJINCWNKLKW-DLBZAZTESA-N	0	3	348.874	3.143	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CCCN3C(=O)c3ccco3)CC2)c1	ZINC001203757375	1370250920	/nfs/dbraw/zinc/25/09/20/1370250920.db2.gz	KJKQQXVTTZFCFY-UHFFFAOYSA-N	0	3	349.434	3.422	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@H]1[C@@H]2CC[C@H]1CN(Cc1cccc(C#N)c1)C2	ZINC001203764262	1370255667	/nfs/dbraw/zinc/25/56/67/1370255667.db2.gz	IINQLMPSPLWSJW-BCDXTJNWSA-N	0	3	341.455	3.293	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC001203899802	1370305237	/nfs/dbraw/zinc/30/52/37/1370305237.db2.gz	BTGBLQOMRWXLDJ-QGZVFWFLSA-N	0	3	329.444	3.390	20	30		EGEDHN
C=CCOc1ccc(CN2CCC3(CCC(=O)N3CC=C)CC2)cc1	ZINC001204299555	1370435387	/nfs/dbraw/zinc/43/53/87/1370435387.db2.gz	ARDWFBUFZQSOLI-UHFFFAOYSA-N	0	3	340.467	3.394	20	30		EGEDHN
C=CCOc1ccc(CN2CC[C@H](Oc3cccc(OC)n3)C2)cc1	ZINC001204302939	1370438427	/nfs/dbraw/zinc/43/84/27/1370438427.db2.gz	XAZDXTCESACBAS-SFHVURJKSA-N	0	3	340.423	3.308	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)[C@@H](C)C2CC2)CCCCC1	ZINC001115466187	1370471977	/nfs/dbraw/zinc/47/19/77/1370471977.db2.gz	FLDFUDVXDSWHOZ-ZDUSSCGKSA-N	0	3	343.309	3.350	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)CCc1cc(F)ccc1F	ZINC001690881575	1404795167	/nfs/dbraw/zinc/79/51/67/1404795167.db2.gz	XECUUKNTYHJPRF-GFCCVEGCSA-N	0	3	330.806	3.134	20	30		EGEDHN
C#CCCCCC(=O)NCC1(NCc2ccccn2)CCCCC1	ZINC001115490748	1370494409	/nfs/dbraw/zinc/49/44/09/1370494409.db2.gz	NXAATMVFQNVGGM-UHFFFAOYSA-N	0	3	327.472	3.184	20	30		EGEDHN
CN1CCN(Cc2cccc(Nc3cc(Cl)cnc3C#N)c2)CC1	ZINC001204518853	1370501265	/nfs/dbraw/zinc/50/12/65/1370501265.db2.gz	VKROWIKVIWZTHK-UHFFFAOYSA-N	0	3	341.846	3.098	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H](OCC)C(C)C)CCCCC1	ZINC001115533958	1370531207	/nfs/dbraw/zinc/53/12/07/1370531207.db2.gz	ZQCXWCCWQDMZHC-HNNXBMFYSA-N	0	3	330.900	3.209	20	30		EGEDHN
CN1CCN(Cc2ccc(Nc3ccc(C(C)(C)C#N)nc3)cc2)CC1	ZINC001204734921	1370558758	/nfs/dbraw/zinc/55/87/58/1370558758.db2.gz	YYDXDIWVQJKLKX-UHFFFAOYSA-N	0	3	349.482	3.374	20	30		EGEDHN
COc1cccc(C#N)c1Nc1ccc(CN2CCN(C)CC2)cc1	ZINC001204750910	1370565668	/nfs/dbraw/zinc/56/56/68/1370565668.db2.gz	GCOGOFLVYVFXJQ-UHFFFAOYSA-N	0	3	336.439	3.058	20	30		EGEDHN
CN1CCN(Cc2ccc(Nc3c(F)cc(F)cc3C#N)cc2)CC1	ZINC001204758267	1370568906	/nfs/dbraw/zinc/56/89/06/1370568906.db2.gz	CNCVBRSHWDLUMC-UHFFFAOYSA-N	0	3	342.393	3.327	20	30		EGEDHN
N[C@H]1CN(Cc2cc(C(F)(F)F)ccc2C(F)(F)F)C[C@H]1F	ZINC001204830536	1370585741	/nfs/dbraw/zinc/58/57/41/1370585741.db2.gz	WAUMSOKJJRTJLV-MNOVXSKESA-N	0	3	330.247	3.205	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cn(C(C)C)cn2)CCCCC1	ZINC001115648539	1370637381	/nfs/dbraw/zinc/63/73/81/1370637381.db2.gz	WKIHODAOFUBKEK-UHFFFAOYSA-N	0	3	338.883	3.239	20	30		EGEDHN
O=C(CCCF)NCC1(NCC#Cc2ccc(F)cc2)CCCCC1	ZINC001115671051	1370652644	/nfs/dbraw/zinc/65/26/44/1370652644.db2.gz	RQELGALQCZIWGP-UHFFFAOYSA-N	0	3	348.437	3.336	20	30		EGEDHN
CN1CCN(C2(c3ccc(Nc4ccc(N)cc4C#N)cc3)CC2)CC1	ZINC001205119893	1370655505	/nfs/dbraw/zinc/65/55/05/1370655505.db2.gz	IKICXSYMSXDSTQ-UHFFFAOYSA-N	0	3	347.466	3.121	20	30		EGEDHN
CC#CCCCC(=O)NCC1(NCc2cnoc2C)CCCCC1	ZINC001115679492	1370662101	/nfs/dbraw/zinc/66/21/01/1370662101.db2.gz	GETRPBUGAAPXLQ-UHFFFAOYSA-N	0	3	331.460	3.085	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCC1(NCc2cnc(C)cn2)CCCCC1	ZINC001115679657	1370662879	/nfs/dbraw/zinc/66/28/79/1370662879.db2.gz	LTBIDSRZPPBYFQ-RDJZCZTQSA-N	0	3	344.503	3.152	20	30		EGEDHN
CC(C)(C)c1ccc(-c2noc([C@@H]3CCNC[C@@H]3F)n2)c(C#N)c1	ZINC001205218763	1370685165	/nfs/dbraw/zinc/68/51/65/1370685165.db2.gz	ITQHNVAPJGLXPW-CABCVRRESA-N	0	3	328.391	3.321	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC1(NCc2cnc(C)nc2)CCCCC1	ZINC001115712215	1370691416	/nfs/dbraw/zinc/69/14/16/1370691416.db2.gz	AXUVZKUCDUPEJE-IBGZPJMESA-N	0	3	344.503	3.296	20	30		EGEDHN
C[NH+](C)CCCOc1ccc(-c2ccc3c(c2)CC/C3=N/[O-])cn1	ZINC001205248575	1370694649	/nfs/dbraw/zinc/69/46/49/1370694649.db2.gz	OUZZJAQCHNQMRC-UZYVYHOESA-N	0	3	325.412	3.204	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@@H](C)CC)CC[C@H]1c1ccc(F)cc1	ZINC001205251792	1370696242	/nfs/dbraw/zinc/69/62/42/1370696242.db2.gz	NEQWJMISUJVOCT-ZYSHUDEJSA-N	0	3	330.447	3.169	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC2(NCc3ccccn3)CCCCC2)C1	ZINC001115723154	1370702054	/nfs/dbraw/zinc/70/20/54/1370702054.db2.gz	AOULFTNUZLKTOW-UHFFFAOYSA-N	0	3	327.472	3.347	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](c2ccc(F)cc2)[C@H](NCCF)C1	ZINC001205282716	1370705603	/nfs/dbraw/zinc/70/56/03/1370705603.db2.gz	KKLQSXZUHCHPEY-ZWKOTPCHSA-N	0	3	336.426	3.426	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)CC2(C)CC2)CC[C@H]1c1ccc(F)cc1	ZINC001205293236	1370709227	/nfs/dbraw/zinc/70/92/27/1370709227.db2.gz	VUZKCWSTMBEKDR-RBUKOAKNSA-N	0	3	342.458	3.313	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)CCC2CCC2)C[C@H]1c1cccc(F)c1	ZINC001205396580	1370743164	/nfs/dbraw/zinc/74/31/64/1370743164.db2.gz	XUVMNUDDFSASNC-VQTJNVASSA-N	0	3	342.458	3.313	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC(CNCc2cc(C3CC3)no2)CC1	ZINC001205407460	1370747029	/nfs/dbraw/zinc/74/70/29/1370747029.db2.gz	MTNFHKWUTAJCNL-UHFFFAOYSA-N	0	3	331.460	3.237	20	30		EGEDHN
C[NH+](C)[C@@H]1CCCC[C@H]1/N=C/c1cc(Br)ccc1[O-]	ZINC001116024304	1370821689	/nfs/dbraw/zinc/82/16/89/1370821689.db2.gz	PWKCGVCBTBQLEP-DPOBWDHUSA-N	0	3	325.250	3.446	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)N1CCC(CNCc2nc(C)cs2)CC1	ZINC001205956087	1370923252	/nfs/dbraw/zinc/92/32/52/1370923252.db2.gz	ZUCAMZNQGZESED-HIFRSBDPSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC(CNCc2csc(C)n2)CC1	ZINC001205975990	1370927836	/nfs/dbraw/zinc/92/78/36/1370927836.db2.gz	UNHXWMLAHOMWEL-HNNXBMFYSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N[C@@H]1CN(Cc2ccc(CC)cc2)C[C@H]1C	ZINC001206428745	1371052294	/nfs/dbraw/zinc/05/22/94/1371052294.db2.gz	DFKRLBZAOXOZTN-FUHIMQAGSA-N	0	3	344.499	3.167	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@@H]1CN(Cc2ccc(C3CCCC3)cc2)C[C@H]1C	ZINC001206659905	1371124393	/nfs/dbraw/zinc/12/43/93/1371124393.db2.gz	TVQQSSPDJJKQAN-JXXFODFXSA-N	0	3	339.483	3.440	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CN(CCOC2CCCCCC2)C[C@H]1C	ZINC001206887119	1371207964	/nfs/dbraw/zinc/20/79/64/1371207964.db2.gz	XDMQSGJUZBOQAD-UYAOXDASSA-N	0	3	348.531	3.356	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CN(Cc2ccc(C(F)F)cc2)C[C@H]1C	ZINC001206913751	1371223195	/nfs/dbraw/zinc/22/31/95/1371223195.db2.gz	WYTAOGTYYNMIFG-RHSMWYFYSA-N	0	3	334.410	3.364	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1CN([C@H](C)c2ccc3c(c2)CCC3)C[C@H]1C	ZINC001206947166	1371240090	/nfs/dbraw/zinc/24/00/90/1371240090.db2.gz	IOLXLKFKLCROTM-CBGDNZLLSA-N	0	3	338.495	3.332	20	30		EGEDHN
O=C(CC1CC1)N1CCC[C@@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207041519	1371275547	/nfs/dbraw/zinc/27/55/47/1371275547.db2.gz	MQAZEDZFALODGK-GOSISDBHSA-N	0	3	330.859	3.072	20	30		EGEDHN
O=C(c1ccccc1F)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001207091225	1371290666	/nfs/dbraw/zinc/29/06/66/1371290666.db2.gz	NICAYIBSWOJYRW-SFHVURJKSA-N	0	3	336.410	3.072	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CN(Cc2cccc(N(C)C)c2)C[C@H]1C	ZINC001207158223	1371315323	/nfs/dbraw/zinc/31/53/23/1371315323.db2.gz	MEJJHHNAMFJDFM-VQIMIIECSA-N	0	3	343.515	3.291	20	30		EGEDHN
CC/C=C(/C)C(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207566825	1371437255	/nfs/dbraw/zinc/43/72/55/1371437255.db2.gz	VIWRWOADSBDPAK-QIVUSQLPSA-N	0	3	328.431	3.114	20	30		EGEDHN
CC(C)[C@@H](C)CC(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001207645977	1371463035	/nfs/dbraw/zinc/46/30/35/1371463035.db2.gz	QIVPGZCZIHSYLO-ICSRJNTNSA-N	0	3	326.484	3.301	20	30		EGEDHN
O=C(CC1CCC1)N1CCC[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207737444	1371489311	/nfs/dbraw/zinc/48/93/11/1371489311.db2.gz	FNJAEOSEPGKXHC-IBGZPJMESA-N	0	3	344.886	3.462	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)CCSC)C1	ZINC001120320381	1371532261	/nfs/dbraw/zinc/53/22/61/1371532261.db2.gz	OCAKBKPNKCFDGS-LSDHHAIUSA-N	0	3	330.925	3.195	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)CCSC)C1	ZINC001120320380	1371532617	/nfs/dbraw/zinc/53/26/17/1371532617.db2.gz	OCAKBKPNKCFDGS-HUUCEWRRSA-N	0	3	330.925	3.195	20	30		EGEDHN
C=CCCCN1C[C@@H](C)[C@H](NC(=O)c2cnc(CC3CC3)s2)C1	ZINC001208063978	1371585701	/nfs/dbraw/zinc/58/57/01/1371585701.db2.gz	AHKOEYSGPBGMCY-UKRRQHHQSA-N	0	3	333.501	3.112	20	30		EGEDHN
C=C(C)[C@@H]1CC=C(CN2CCCC[C@H]2C(=O)N2CCOCC2)CC1	ZINC001208177571	1371618977	/nfs/dbraw/zinc/61/89/77/1371618977.db2.gz	VBMRDERTZKIYOQ-MOPGFXCFSA-N	0	3	332.488	3.002	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC[C@H](NCc2cc(C)ns2)C1	ZINC001208194692	1371634498	/nfs/dbraw/zinc/63/44/98/1371634498.db2.gz	UTLUNAOVZUQMDO-INIZCTEOSA-N	0	3	333.501	3.301	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001208255719	1371685726	/nfs/dbraw/zinc/68/57/26/1371685726.db2.gz	POIKHFKHMSGTSF-QGZVFWFLSA-N	0	3	329.419	3.134	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CCC[C@H](NCC=C(Cl)Cl)C1)OCC	ZINC001208264013	1371690028	/nfs/dbraw/zinc/69/00/28/1371690028.db2.gz	HNZAPIQVDMCJBO-KBPBESRZSA-N	0	3	349.302	3.257	20	30		EGEDHN
C=C(Br)CNC1CC2(C1)CC(NC(=O)C(CC)CC)C2	ZINC001120677974	1371705324	/nfs/dbraw/zinc/70/53/24/1371705324.db2.gz	UDTWHKSXOIZASB-UHFFFAOYSA-N	0	3	343.309	3.348	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1CN(CCOCCC(C)C)C[C@H]1C	ZINC001208321526	1371717596	/nfs/dbraw/zinc/71/75/96/1371717596.db2.gz	XBURXHVNIDWIRL-RTBURBONSA-N	0	3	336.520	3.069	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CN(Cc2cc(C)sc2C)C[C@H]1C	ZINC001208376451	1371742313	/nfs/dbraw/zinc/74/23/13/1371742313.db2.gz	FYKYILJDUQWCGD-RDTXWAMCSA-N	0	3	332.513	3.495	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN(CCOc2cc(C)cc(C)c2)C[C@H]1C	ZINC001208458475	1371774970	/nfs/dbraw/zinc/77/49/70/1371774970.db2.gz	KXVBWTSWOIGNRZ-UYAOXDASSA-N	0	3	344.499	3.475	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN(Cc2cccc3c2CCOC3)C[C@H]1C	ZINC001208458618	1371775011	/nfs/dbraw/zinc/77/50/11/1371775011.db2.gz	QNHJOJVRVAAODQ-OXQOHEQNSA-N	0	3	342.483	3.052	20	30		EGEDHN
C#CCCCC(=O)NC1CC2(CC(NC/C(Cl)=C\Cl)C2)C1	ZINC001121019740	1371836763	/nfs/dbraw/zinc/83/67/63/1371836763.db2.gz	GQRGGCFAASFNDF-ZRDIBKRKSA-N	0	3	329.271	3.126	20	30		EGEDHN
COC(=O)CCN(CCCc1cccc(C#N)c1)Cc1ccco1	ZINC001208852384	1371918352	/nfs/dbraw/zinc/91/83/52/1371918352.db2.gz	IMOGUWCWIQAMPP-UHFFFAOYSA-N	0	3	326.396	3.149	20	30		EGEDHN
CC(C)CC(=O)N1CCCN(CCCc2ccc(C#N)cc2)CC1	ZINC001208863657	1371923782	/nfs/dbraw/zinc/92/37/82/1371923782.db2.gz	BCAOXYAKEDFGGF-UHFFFAOYSA-N	0	3	327.472	3.071	20	30		EGEDHN
O=C(C[C@@H]1CC=CCC1)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001208993601	1371970176	/nfs/dbraw/zinc/97/01/76/1371970176.db2.gz	LVAWQXCIJWWWIK-RTWAWAEBSA-N	0	3	336.479	3.365	20	30		EGEDHN
C=CCN(CCN1CCC(Sc2ccncc2)CC1)C(=O)OCC	ZINC001209022454	1371977100	/nfs/dbraw/zinc/97/71/00/1371977100.db2.gz	KGXXYRUYKWDIIJ-UHFFFAOYSA-N	0	3	349.500	3.283	20	30		EGEDHN
CC(C)=C(C)CC(=O)N1CCC[C@@H](NCc2ccc(C#N)s2)C1	ZINC001209030124	1371977750	/nfs/dbraw/zinc/97/77/50/1371977750.db2.gz	MSQKDXWTTUJOHF-OAHLLOKOSA-N	0	3	331.485	3.447	20	30		EGEDHN
O=C(CCCF)N1CCC[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001209071107	1371989426	/nfs/dbraw/zinc/98/94/26/1371989426.db2.gz	BFAWZQQELWBAPP-INIZCTEOSA-N	0	3	336.838	3.022	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC1CC2(CC(NCc3conc3CC)C2)C1	ZINC001121527837	1372000692	/nfs/dbraw/zinc/00/06/92/1372000692.db2.gz	HACSNLCRXYTLNB-UHFFFAOYSA-N	0	3	345.487	3.356	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@@H](NCc2cc(F)cc(F)c2)C1	ZINC001209110627	1372001066	/nfs/dbraw/zinc/00/10/66/1372001066.db2.gz	CMZPYDIICPHNCV-GOSISDBHSA-N	0	3	334.410	3.239	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC1CC2(CC(NCc3nccn3CC)C2)C1	ZINC001121609528	1372023029	/nfs/dbraw/zinc/02/30/29/1372023029.db2.gz	DXFBMUDBTDTFBV-AKJOHPPZSA-N	0	3	344.503	3.022	20	30		EGEDHN
C=CCCCCN1Cc2cncn2C[C@@H](COc2cccnc2)C1	ZINC001209203668	1372037121	/nfs/dbraw/zinc/03/71/21/1372037121.db2.gz	SINFJVITQKGWBK-KRWDZBQOSA-N	0	3	326.444	3.145	20	30		EGEDHN
C=CCCCCN1CCN(c2ncccc2C(=O)N(CC)CC)CC1	ZINC001209206974	1372039219	/nfs/dbraw/zinc/03/92/19/1372039219.db2.gz	FJNHTPGRTRYLIM-UHFFFAOYSA-N	0	3	344.503	3.042	20	30		EGEDHN
COC(=O)C1(C#N)CCN(CCC23CC4CC(CC(C4)C2)C3)CC1	ZINC001209448461	1372107860	/nfs/dbraw/zinc/10/78/60/1372107860.db2.gz	ULSMZNQPVPMWBD-UHFFFAOYSA-N	0	3	330.472	3.372	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@@H](NCC#Cc3ccccc3)C2)CC1	ZINC001209484391	1372118422	/nfs/dbraw/zinc/11/84/22/1372118422.db2.gz	IEDUJZQRGXRFSN-OAQYLSRUSA-N	0	3	336.479	3.365	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)[C@H](OC)c1ccccc1)C2	ZINC001122087621	1372172093	/nfs/dbraw/zinc/17/20/93/1372172093.db2.gz	LRDWSDNAOQDNCH-APUKJBRXSA-N	0	3	348.874	3.144	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N[C@H](C)c1nc(-c2ccc(Cl)cc2)no1	ZINC001122111626	1372177104	/nfs/dbraw/zinc/17/71/04/1372177104.db2.gz	CHWWBSRFWJARJT-BXUZGUMPSA-N	0	3	348.834	3.251	20	30		EGEDHN
CN1C(=O)CCC[C@H]1C(=O)C(C#N)c1nc2cc(Cl)ccc2s1	ZINC001122474088	1372254791	/nfs/dbraw/zinc/25/47/91/1372254791.db2.gz	HMKVRNQCOWSWIB-PWSUYJOCSA-N	0	3	347.827	3.137	20	30		EGEDHN
C=C(C)Cn1c([C@@H](C)CCC#N)nnc1N1CCN([C@H](C)CC)CC1	ZINC001122530218	1372267942	/nfs/dbraw/zinc/26/79/42/1372267942.db2.gz	CNAXBJCLMAZFKB-DLBZAZTESA-N	0	3	344.507	3.182	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CCCN(C)C2)nnc1N1C[C@H](C)[C@@H](C)[C@@H]1C	ZINC001122544011	1372271194	/nfs/dbraw/zinc/27/11/94/1372271194.db2.gz	QXWGFUAUUKLLDX-YVSFHVDLSA-N	0	3	331.508	3.144	20	30		EGEDHN
C=CC1(CC(=O)N2CCC[C@H](NCc3cncn3C)C2)CCCCC1	ZINC001210105916	1372271472	/nfs/dbraw/zinc/27/14/72/1372271472.db2.gz	DKYILYGBPLNVEO-KRWDZBQOSA-N	0	3	344.503	3.027	20	30		EGEDHN
CC[C@@H](C)c1ccc(NC(=O)C(C#N)C(=O)COC(F)(F)F)cc1	ZINC001122547856	1372272677	/nfs/dbraw/zinc/27/26/77/1372272677.db2.gz	YMXWFEBDHBTONI-MFKMUULPSA-N	0	3	342.317	3.384	20	30		EGEDHN
CC(C)N1CCC[C@H]1C(=O)C(C#N)c1nc(-c2ccncc2)cs1	ZINC001122567813	1372276443	/nfs/dbraw/zinc/27/64/43/1372276443.db2.gz	GSDWGWWXEJDPPS-ZBFHGGJFSA-N	0	3	340.452	3.254	20	30		EGEDHN
N#CC(C(=O)c1cccnc1OCC(F)(F)F)c1cccc(F)n1	ZINC001122717542	1372305183	/nfs/dbraw/zinc/30/51/83/1372305183.db2.gz	KCIDYJOJHIXYHM-JTQLQIEISA-N	0	3	339.248	3.047	20	30		EGEDHN
CC[C@H](C)CCC(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001210263538	1372308843	/nfs/dbraw/zinc/30/88/43/1372308843.db2.gz	DNNCNFYXKUZHQB-ICSRJNTNSA-N	0	3	326.484	3.445	20	30		EGEDHN
CC(C)Cn1c([C@@H](C)CCC#N)nnc1N1CCN(CC(C)C)CC1	ZINC001122762619	1372316025	/nfs/dbraw/zinc/31/60/25/1372316025.db2.gz	HYIQLKFFNRTUOC-KRWDZBQOSA-N	0	3	346.523	3.119	20	30		EGEDHN
CCc1c(C(=O)C(C#N)c2ncc(Cl)n2C)cnn1CCC(C)C	ZINC001123232892	1372403319	/nfs/dbraw/zinc/40/33/19/1372403319.db2.gz	DKGDSMQBYWBOIC-LBPRGKRZSA-N	0	3	347.850	3.369	20	30		EGEDHN
CC#Cc1cncc(Nc2ccc(CN3CCN(CC)CC3)cc2)c1	ZINC001211058120	1372479474	/nfs/dbraw/zinc/47/94/74/1372479474.db2.gz	KBMMOPSOOJNMML-UHFFFAOYSA-N	0	3	334.467	3.334	20	30		EGEDHN
C#CCC1(C(=O)N2CCC[C@H](NCc3cccnc3)C2)CCCCC1	ZINC001211360262	1372539992	/nfs/dbraw/zinc/53/99/92/1372539992.db2.gz	HSYLWHXOLLVFAY-IBGZPJMESA-N	0	3	339.483	3.136	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2oc(C)cc2C)C[C@H]1c1ccccc1	ZINC001211567390	1372581668	/nfs/dbraw/zinc/58/16/68/1372581668.db2.gz	HGHOLLHLMYDHCU-RBUKOAKNSA-N	0	3	336.435	3.118	20	30		EGEDHN
C=CCCC1(C(=O)N2C[C@@H](c3ccccc3)[C@H](NCC#CC)C2)CC1	ZINC001211669114	1372599803	/nfs/dbraw/zinc/59/98/03/1372599803.db2.gz	JNVOCEDJRFLIKA-VQTJNVASSA-N	0	3	336.479	3.340	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2ccccc2C(C)C)[C@H](OC)C1	ZINC001212373432	1372695984	/nfs/dbraw/zinc/69/59/84/1372695984.db2.gz	NKSJYZYILBOUHD-RTBURBONSA-N	0	3	330.472	3.205	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NCCN[C@H](C)c1ccc(F)c(Cl)c1	ZINC001124496161	1372706923	/nfs/dbraw/zinc/70/69/23/1372706923.db2.gz	XCCUCZOSPNPYSY-OLZOCXBDSA-N	0	3	342.842	3.227	20	30		EGEDHN
N#Cc1ccc(-c2noc(-c3ccc(CN4CCCCC4)o3)n2)nc1	ZINC001212840177	1372783280	/nfs/dbraw/zinc/78/32/80/1372783280.db2.gz	ARHREGOGICPWCC-UHFFFAOYSA-N	0	3	335.367	3.249	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1CN(CCCc2ccccc2)C[C@H]1OC	ZINC001213315131	1372882847	/nfs/dbraw/zinc/88/28/47/1372882847.db2.gz	ZSEHHKYKQMIREQ-DFQSSKMNSA-N	0	3	344.499	3.037	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)Cc2cccc(C)c2)[C@H](OC)C1	ZINC001213352818	1372890846	/nfs/dbraw/zinc/89/08/46/1372890846.db2.gz	FKWJFYSOBWYGGL-WOJBJXKFSA-N	0	3	344.499	3.099	20	30		EGEDHN
C#CCCCCC(=O)NCCNCc1cnc(-c2ccccc2)s1	ZINC001125950918	1372898354	/nfs/dbraw/zinc/89/83/54/1372898354.db2.gz	DMEMXRRVZKOYTJ-UHFFFAOYSA-N	0	3	341.480	3.210	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2CN(CC/C=C\CCC)C[C@H]2OC)CC1	ZINC001213395166	1372899790	/nfs/dbraw/zinc/89/97/90/1372899790.db2.gz	PUODFRBIKNTWSC-MHEJJFAZSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@H](C)c2ccc(C)o2)[C@H](OC)C1	ZINC001213545288	1372923582	/nfs/dbraw/zinc/92/35/82/1372923582.db2.gz	LDCCVPZGYDZLOP-ZHALLVOQSA-N	0	3	348.487	3.253	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2ccc3c(c2)C=CCC3)[C@H](OC)C1	ZINC001213564707	1372927584	/nfs/dbraw/zinc/92/75/84/1372927584.db2.gz	FKCPRXMKGIOCHL-WOJBJXKFSA-N	0	3	340.467	3.041	20	30		EGEDHN
CCCCCCCCC(=O)N[C@@H]1CN(CC[C@H](C)F)C[C@H]1OC	ZINC001213771097	1372959443	/nfs/dbraw/zinc/95/94/43/1372959443.db2.gz	SUKCZISQLGSWFR-GVDBMIGSSA-N	0	3	330.488	3.301	20	30		EGEDHN
C[C@H](C(=O)N1C[C@@H](C)[C@H](NCC#Cc2cccc(Cl)c2)C1)C1CC1	ZINC001214400716	1373055213	/nfs/dbraw/zinc/05/52/13/1373055213.db2.gz	KFNHUFSAUVWDGJ-ZRGWGRIASA-N	0	3	344.886	3.174	20	30		EGEDHN
CC(C)=C(F)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001214427270	1373059253	/nfs/dbraw/zinc/05/92/53/1373059253.db2.gz	SGRUNAZSSINXQG-RHSMWYFYSA-N	0	3	348.849	3.391	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](C)[C@H](NCc2cccc(OC)c2Cl)C1	ZINC001214526994	1373074101	/nfs/dbraw/zinc/07/41/01/1373074101.db2.gz	CTBRJYVQLQUQFW-GDBMZVCRSA-N	0	3	348.874	3.089	20	30		EGEDHN
CCC1(C(=O)N2C[C@@H](C)[C@H](NCC#Cc3ccc(F)cc3)C2)CCC1	ZINC001215353574	1373201503	/nfs/dbraw/zinc/20/15/03/1373201503.db2.gz	RCWDXOVLZOJEJY-VQIMIIECSA-N	0	3	342.458	3.194	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@H]2CCC2(C)C)C[C@H]1NCC#Cc1ccc(F)cc1	ZINC001215356136	1373202597	/nfs/dbraw/zinc/20/25/97/1373202597.db2.gz	QIJFZFZLPBNLAS-ATZDWAIDSA-N	0	3	342.458	3.050	20	30		EGEDHN
Cc1ccc(C)c(C(=O)N2C[C@@H](C)[C@H](NCC#Cc3ccccc3)C2)c1	ZINC001216551140	1373315599	/nfs/dbraw/zinc/31/55/99/1373315599.db2.gz	MPAHTZUCQQVRGH-DENIHFKCSA-N	0	3	346.474	3.405	20	30		EGEDHN
C=CC[C@H](C(=O)N1C[C@@H](C)[C@H](NCc2ccccn2)C1)c1ccccc1	ZINC001216806192	1373345344	/nfs/dbraw/zinc/34/53/44/1373345344.db2.gz	FHSNRVCXCZYOCX-JRGCBEDISA-N	0	3	349.478	3.378	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)C/C=C/c2cccc(F)c2)cc1	ZINC001129730758	1373417349	/nfs/dbraw/zinc/41/73/49/1373417349.db2.gz	BSWQXOXEWMKODE-DUXPYHPUSA-N	0	3	337.398	3.007	20	30		EGEDHN
N#Cc1cc(F)cc(-c2noc(-c3cc4c(s3)CCNC4)n2)c1	ZINC001217294735	1373419558	/nfs/dbraw/zinc/41/95/58/1373419558.db2.gz	MHOVARDLSXTZMU-UHFFFAOYSA-N	0	3	326.356	3.122	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NCCNCc1ccc(C)c(F)c1	ZINC001130374401	1373509342	/nfs/dbraw/zinc/50/93/42/1373509342.db2.gz	PYPVLWQCYKZOMP-UHFFFAOYSA-N	0	3	342.414	3.219	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)C(C)(C)C(C)(C)C)C1	ZINC001130415898	1373529007	/nfs/dbraw/zinc/52/90/07/1373529007.db2.gz	RVNYMMXYPASLIL-AWEZNQCLSA-N	0	3	332.492	3.074	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)CC(C)(C)CC)[C@H]2C1	ZINC001218013455	1373537416	/nfs/dbraw/zinc/53/74/16/1373537416.db2.gz	DPLRYQBCBQPRHZ-ZWKOTPCHSA-N	0	3	336.520	3.471	20	30		EGEDHN
Cc1noc2nc(O[C@@H](CC#N)c3ccccc3)c3c(c12)CCNC3	ZINC001218316897	1373594594	/nfs/dbraw/zinc/59/45/94/1373594594.db2.gz	HTMMOLMCURKCGE-INIZCTEOSA-N	0	3	334.379	3.211	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)C[C@@H](CC)CCCC)[C@H]2C1	ZINC001218332416	1373598346	/nfs/dbraw/zinc/59/83/46/1373598346.db2.gz	IGAGHAREPUZFIH-GBESFXJTSA-N	0	3	336.520	3.471	20	30		EGEDHN
C[C@](N)(Cc1ccc(F)cc1)C(=O)Nc1c(C#N)oc2ccccc21	ZINC001218627289	1373637985	/nfs/dbraw/zinc/63/79/85/1373637985.db2.gz	RCINZGAGGNAROM-IBGZPJMESA-N	0	3	337.354	3.342	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2OCCN(C(=O)c3cc(C)ccc3F)[C@H]2C1	ZINC001218689187	1373644019	/nfs/dbraw/zinc/64/40/19/1373644019.db2.gz	VWLVBMDAFLOSMA-AYOQOUSVSA-N	0	3	346.446	3.014	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)[C@H]3CC[C@H](CC)CC3)[C@H]2C1	ZINC001218995176	1373675545	/nfs/dbraw/zinc/67/55/45/1373675545.db2.gz	BIHHHILMTMHGKC-CADBVGFASA-N	0	3	334.504	3.081	20	30		EGEDHN
C[C@](N)(Cc1ccc(F)cc1)C(=O)Nc1c(F)cc(C#N)cc1Cl	ZINC001218995906	1373676134	/nfs/dbraw/zinc/67/61/34/1373676134.db2.gz	TXOYJGRQTNEXHO-KRWDZBQOSA-N	0	3	349.768	3.388	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2OCCN(C(=O)c3cccc(Cl)c3)[C@H]2C1	ZINC001219004257	1373677288	/nfs/dbraw/zinc/67/72/88/1373677288.db2.gz	CMVWQNCAFXNCAE-FHLIZLRMSA-N	0	3	348.874	3.220	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)C[C@H](C)c3ccccc3)[C@H]2C1	ZINC001219017645	1373680962	/nfs/dbraw/zinc/68/09/62/1373680962.db2.gz	AGKVNSOVKKLDQG-YSIASYRMSA-N	0	3	342.483	3.058	20	30		EGEDHN
CC1CCC(N2CCN(C(=O)Nc3sccc3C#N)CC2)CC1	ZINC001219354363	1373703409	/nfs/dbraw/zinc/70/34/09/1373703409.db2.gz	FNEXDLISNQJHPI-UHFFFAOYSA-N	0	3	332.473	3.348	20	30		EGEDHN
N#Cc1ccc(NC(=O)C[C@@H]2Cc3ccccc3CN2)c2cccnc12	ZINC001219465287	1373710239	/nfs/dbraw/zinc/71/02/39/1373710239.db2.gz	POMMXXYPSFCTIL-KRWDZBQOSA-N	0	3	342.402	3.150	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@@H](NCc3ncccc3C)C2)CCCCC1	ZINC001188265454	1388278510	/nfs/dbraw/zinc/27/85/10/1388278510.db2.gz	ICZXMVHFPAUKHI-GOSISDBHSA-N	0	3	339.483	3.054	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C1(CCCC)CC1)C[C@H](C)O2	ZINC001131688666	1373764781	/nfs/dbraw/zinc/76/47/81/1373764781.db2.gz	QBEMCXCJIXTCNV-PXNSSMCTSA-N	0	3	334.504	3.225	20	30		EGEDHN
CCCCCCCN1CC[C@@H]2CN(C(=O)c3ncccc3OC)[C@@H]2C1	ZINC001221977451	1373811426	/nfs/dbraw/zinc/81/14/26/1373811426.db2.gz	SBJZBNNWIRCLON-IAGOWNOFSA-N	0	3	345.487	3.207	20	30		EGEDHN
CC[C@H](SC)C(=O)NCC1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001222857280	1373890392	/nfs/dbraw/zinc/89/03/92/1373890392.db2.gz	XXFUGMGHOPMGPE-SFHVURJKSA-N	0	3	345.512	3.028	20	30		EGEDHN
C[C@@]1(NC(=O)c2csc(C#N)c2)CCN(Cc2ccccc2)C1	ZINC001326728971	1388292315	/nfs/dbraw/zinc/29/23/15/1388292315.db2.gz	SBASYWXFDKYHNJ-GOSISDBHSA-N	0	3	325.437	3.014	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCC1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001224187474	1375060525	/nfs/dbraw/zinc/06/05/25/1375060525.db2.gz	QJUAVBQHQULZRM-QGZVFWFLSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=CCOCC(=O)N[C@H]1CC[C@H](C)N(Cc2ccccc2C2CC2)C1	ZINC001131947458	1375063393	/nfs/dbraw/zinc/06/33/93/1375063393.db2.gz	UPAYTKWWBLVVQV-LPHOPBHVSA-N	0	3	342.483	3.236	20	30		EGEDHN
C#CCN1CCC(CNC(=O)C(C)(C)c2ccc(Cl)cc2)CC1	ZINC001224318487	1375063818	/nfs/dbraw/zinc/06/38/18/1375063818.db2.gz	LBYYMDXWHRNUBA-UHFFFAOYSA-N	0	3	332.875	3.079	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1CC[C@H](C)N(CCOc2ccccc2)C1	ZINC001131975534	1375078396	/nfs/dbraw/zinc/07/83/96/1375078396.db2.gz	BCKHZHCJQPEOGJ-OALUTQOASA-N	0	3	342.483	3.228	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@@H](C)N(CCOc2ccc(C)cc2)C1	ZINC001131996916	1375089154	/nfs/dbraw/zinc/08/91/54/1375089154.db2.gz	ZSTPYCHNMALVJN-RTBURBONSA-N	0	3	342.483	3.146	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)C[C@@H](CC)c2ccccc2)CC1	ZINC001225148955	1375095619	/nfs/dbraw/zinc/09/56/19/1375095619.db2.gz	CRWBEAXBXDGZPG-LJQANCHMSA-N	0	3	326.484	3.422	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)C(C)(C)c2ccccc2Cl)CC1	ZINC001225220554	1375097331	/nfs/dbraw/zinc/09/73/31/1375097331.db2.gz	ARXMJZICHHIIOA-UHFFFAOYSA-N	0	3	346.902	3.469	20	30		EGEDHN
C[C@@H]1CC[C@@H](NC(=O)C#CC2CC2)CN1Cc1ccc2cc[nH]c2c1	ZINC001132034407	1375109258	/nfs/dbraw/zinc/10/92/58/1375109258.db2.gz	QVGNDFAAEXFMDE-DNVCBOLYSA-N	0	3	335.451	3.050	20	30		EGEDHN
C[C@H]1CC[C@@H](NC(=O)C#CC2CC2)CN1CCCc1ccsc1	ZINC001132045152	1375114550	/nfs/dbraw/zinc/11/45/50/1375114550.db2.gz	AUEGXYAROJOZKP-MAUKXSAKSA-N	0	3	330.497	3.063	20	30		EGEDHN
CCc1ccccc1CCN1C[C@@H](NC(=O)C#CC2CC2)CC[C@@H]1C	ZINC001132047106	1375115671	/nfs/dbraw/zinc/11/56/71/1375115671.db2.gz	UIYBGGSOZIBJOF-UWJYYQICSA-N	0	3	338.495	3.174	20	30		EGEDHN
C#CCN1CCC(CNC(=O)CCCc2cc(C)ccc2C)CC1	ZINC001225525845	1375118626	/nfs/dbraw/zinc/11/86/26/1375118626.db2.gz	PPMPWZWYTDXDRQ-UHFFFAOYSA-N	0	3	326.484	3.088	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@@H]2CCCC[C@H]2NC(=O)/C=C\C2CC2)c1	ZINC001225569231	1375126077	/nfs/dbraw/zinc/12/60/77/1375126077.db2.gz	HZXUDOTZGFBKBG-WXUGTPJSSA-N	0	3	341.430	3.181	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@@H](C)Cc2ccccc2C)CC1	ZINC001225604080	1375131283	/nfs/dbraw/zinc/13/12/83/1375131283.db2.gz	TXMLQSAFRLOIPD-SFHVURJKSA-N	0	3	326.484	3.025	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NCC1CCN([C@H](C)c2ccccc2F)CC1	ZINC001225632132	1375136007	/nfs/dbraw/zinc/13/60/07/1375136007.db2.gz	YBFRSLZJZDMQJS-HZPDHXFCSA-N	0	3	348.462	3.306	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCc2cccc(OC)c2F)CC[C@H]1C	ZINC001132082115	1375136903	/nfs/dbraw/zinc/13/69/03/1375136903.db2.gz	FQXMXBQWKQOQGO-NVXWUHKLSA-N	0	3	348.462	3.312	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NCC1CCN([C@H](C)c2cccc(F)c2)CC1	ZINC001225639505	1375137435	/nfs/dbraw/zinc/13/74/35/1375137435.db2.gz	RXWNUMSERVJDJI-CVEARBPZSA-N	0	3	348.462	3.306	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)C(C)(C)C2CCCC2)CC[C@H]1C	ZINC001132105047	1375149739	/nfs/dbraw/zinc/14/97/39/1375149739.db2.gz	ALPSEERPUYJLIZ-AEFFLSMTSA-N	0	3	336.520	3.375	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CCCC[C@H]1NCc1c(C)onc1CC	ZINC001225752445	1375152104	/nfs/dbraw/zinc/15/21/04/1375152104.db2.gz	IGTRRDPFMMMXIB-RTBURBONSA-N	0	3	345.487	3.256	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCc2ncc(C(C)(C)C)o2)CC[C@H]1C	ZINC001132114283	1375155378	/nfs/dbraw/zinc/15/53/78/1375155378.db2.gz	GRZLRRIBEIEIGN-CVEARBPZSA-N	0	3	347.503	3.450	20	30		EGEDHN
C=CCCCN1C[C@H](NC(=O)c2ncc(Cl)s2)CC[C@H]1C	ZINC001132170502	1375186159	/nfs/dbraw/zinc/18/61/59/1375186159.db2.gz	ZKBZMBLCHXVLOB-VXGBXAGGSA-N	0	3	327.881	3.345	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1CCCC[C@H]1NCc1cc(F)ccc1F	ZINC001226073569	1375199488	/nfs/dbraw/zinc/19/94/88/1375199488.db2.gz	VCOIPHSOFHKMOW-QZTJIDSGSA-N	0	3	334.410	3.141	20	30		EGEDHN
Cc1cc(C(=O)NCCNCc2ccc(C#N)cc2)c(C)cc1Cl	ZINC001132268502	1375256644	/nfs/dbraw/zinc/25/66/44/1375256644.db2.gz	JOXWHTXOYYPKOZ-UHFFFAOYSA-N	0	3	341.842	3.348	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1CCCC[C@H]1NCc1cnoc1C	ZINC001226435398	1375257334	/nfs/dbraw/zinc/25/73/34/1375257334.db2.gz	VTWKUPWRNZIDNF-QZTJIDSGSA-N	0	3	331.460	3.268	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CC[C@@H](C)N(CCOCC3CC3)C2)CCC1	ZINC001132281815	1375264206	/nfs/dbraw/zinc/26/42/06/1375264206.db2.gz	FUCPBBBRYAWLRE-SJLPKXTDSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCOCC(=O)NC1CCN([C@@H](CC)c2ccc(F)cc2)CC1	ZINC001226571319	1375284617	/nfs/dbraw/zinc/28/46/17/1375284617.db2.gz	RTSOWRNSGPAYMH-SFHVURJKSA-N	0	3	334.435	3.060	20	30		EGEDHN
C=CCOCCCC(=O)NC1CCN([C@@H](C)c2ccc(F)cc2)CC1	ZINC001226777820	1375331638	/nfs/dbraw/zinc/33/16/38/1375331638.db2.gz	HJQPJMBJOAYOSY-INIZCTEOSA-N	0	3	348.462	3.450	20	30		EGEDHN
C#CCCCCC(=O)NC1CCN(Cc2ccccc2N(C)C)CC1	ZINC001226951905	1375369310	/nfs/dbraw/zinc/36/93/10/1375369310.db2.gz	MQCKLMRFKASRTF-UHFFFAOYSA-N	0	3	341.499	3.027	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2cccc(C)c2C)CC[C@@H]1C	ZINC001132458527	1375401366	/nfs/dbraw/zinc/40/13/66/1375401366.db2.gz	WEPLTTSAEPJJQA-WMZOPIPTSA-N	0	3	330.472	3.089	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCCOc2ccc(C)cc2)CC[C@@H]1C	ZINC001132459654	1375402002	/nfs/dbraw/zinc/40/20/02/1375402002.db2.gz	CLHMFRJVGLUMFE-ROUUACIJSA-N	0	3	330.472	3.309	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COc2ccc(OCC)cc2)CC[C@@H]1C	ZINC001132460207	1375402835	/nfs/dbraw/zinc/40/28/35/1375402835.db2.gz	HGOJISLKDWSKAJ-IRXDYDNUSA-N	0	3	346.471	3.009	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COc2ccc(CC)cc2)CC[C@H]1C	ZINC001132462386	1375405578	/nfs/dbraw/zinc/40/55/78/1375405578.db2.gz	ZKHFDJPYYXCOKJ-AEFFLSMTSA-N	0	3	330.472	3.173	20	30		EGEDHN
C[C@@H]1CCCC[C@@H]1OCCN1CCC(NC(=O)C#CC(C)(C)C)CC1	ZINC001227243828	1375411219	/nfs/dbraw/zinc/41/12/19/1375411219.db2.gz	CUGYALDQKAFJJR-MJGOQNOKSA-N	0	3	348.531	3.212	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCCc2nc(C(C)C)no2)CC[C@H]1C	ZINC001132486931	1375420807	/nfs/dbraw/zinc/42/08/07/1375420807.db2.gz	QFOSSGMKPFAWTQ-HZPDHXFCSA-N	0	3	348.491	3.061	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CN(CC)c2ccccc2)CC[C@@H]1C	ZINC001132509549	1375432411	/nfs/dbraw/zinc/43/24/11/1375432411.db2.gz	WRLSXGCBYCUCKQ-ROUUACIJSA-N	0	3	329.488	3.058	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)C2CCC(C)(C)CC2)CC[C@@H]1C	ZINC001132522933	1375439774	/nfs/dbraw/zinc/43/97/74/1375439774.db2.gz	VEAMUESQJAQADK-WMZOPIPTSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)C2(C)C(C)(C)C2(C)C)CC[C@H]1C	ZINC001132546551	1375453042	/nfs/dbraw/zinc/45/30/42/1375453042.db2.gz	NVOXKIITVTWGDR-HZPDHXFCSA-N	0	3	336.520	3.230	20	30		EGEDHN
C#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)/C(C)=C/CC)CC1	ZINC001132551935	1375458037	/nfs/dbraw/zinc/45/80/37/1375458037.db2.gz	OVPSETZVYLTLDO-KHVWPYCOSA-N	0	3	339.483	3.254	20	30		EGEDHN
C#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)[C@@H](C)CCC)CC1	ZINC001132554200	1375459747	/nfs/dbraw/zinc/45/97/47/1375459747.db2.gz	DAGJZLMIKFKAFZ-AZUAARDMSA-N	0	3	341.499	3.334	20	30		EGEDHN
C#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)C[C@@H](C)CC)CC1	ZINC001132554730	1375460569	/nfs/dbraw/zinc/46/05/69/1375460569.db2.gz	LBTCDZAHXPJKJZ-ICSRJNTNSA-N	0	3	341.499	3.334	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)C(C)(C)C)CC1	ZINC001132555772	1375463468	/nfs/dbraw/zinc/46/34/68/1375463468.db2.gz	ZVEZQJGQRNNKKX-LJQANCHMSA-N	0	3	341.499	3.334	20	30		EGEDHN
C#CCN1CC[C@H](CN(Cc2scnc2C)C(=O)CCC(=C)C)C1	ZINC001132559316	1375467518	/nfs/dbraw/zinc/46/75/18/1375467518.db2.gz	WSGGIBFMIOGJRV-KRWDZBQOSA-N	0	3	345.512	3.092	20	30		EGEDHN
C#CCN1CC[C@@H](CN(Cc2scnc2C)C(=O)C(C)(C)CC)C1	ZINC001132562959	1375469332	/nfs/dbraw/zinc/46/93/32/1375469332.db2.gz	NSQSVRVEXISKRW-MRXNPFEDSA-N	0	3	347.528	3.171	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2N(Cc2nccs2)C(=O)[C@H](C)CC)CC1	ZINC001132566093	1375470332	/nfs/dbraw/zinc/47/03/32/1375470332.db2.gz	HTEOLYUBQDLPGN-HZPDHXFCSA-N	0	3	345.512	3.006	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCNCc1ccc(Br)s1	ZINC001132577303	1375473507	/nfs/dbraw/zinc/47/35/07/1375473507.db2.gz	SJHMUEZJLMIZSG-WDEREUQCSA-N	0	3	345.306	3.175	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](C)[C@H](CNCc2nc(C)sc2C)C1	ZINC001132697564	1375519606	/nfs/dbraw/zinc/51/96/06/1375519606.db2.gz	RXWDXJRBSRFTSH-XJKSGUPXSA-N	0	3	335.517	3.300	20	30		EGEDHN
CC(C)CCC(=O)N1CC[C@@H](N(C)Cc2ccc(OCC#N)cc2)C1	ZINC001188821832	1388384805	/nfs/dbraw/zinc/38/48/05/1388384805.db2.gz	VLODWXIHFMHUNK-GOSISDBHSA-N	0	3	343.471	3.058	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](C)[C@@H](CNC/C(Cl)=C\Cl)C1	ZINC001132786371	1375563303	/nfs/dbraw/zinc/56/33/03/1375563303.db2.gz	TYGFWRJVBUWOJL-CAMKDYJDSA-N	0	3	331.287	3.183	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CCN(CCOc2ccccc2C)CC1	ZINC001228631640	1375622285	/nfs/dbraw/zinc/62/22/85/1375622285.db2.gz	RSXOACLSOFXFSF-UHFFFAOYSA-N	0	3	330.472	3.167	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NC1CCN(Cc2sc(C)nc2C)CC1	ZINC001228759714	1375666502	/nfs/dbraw/zinc/66/65/02/1375666502.db2.gz	CCNCBDSNRARGGU-CHWSQXEVSA-N	0	3	335.517	3.299	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](C)[C@@H](CNCc2ccn(C(C)C)n2)C1	ZINC001133072543	1375758736	/nfs/dbraw/zinc/75/87/36/1375758736.db2.gz	ITJWHFOCVYNSAJ-MSOLQXFVSA-N	0	3	346.519	3.395	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](C)[C@@H](CNCc2ccccc2C#N)C1	ZINC001133090901	1375769218	/nfs/dbraw/zinc/76/92/18/1375769218.db2.gz	LPZZTQOJUVOQKM-XLIONFOSSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@H](C)[C@@H](CNCc3cnc(C)o3)C2)CC1	ZINC001133104722	1375777510	/nfs/dbraw/zinc/77/75/10/1375777510.db2.gz	JBSXZROMDGDGJB-RDJZCZTQSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2cccc(C(C)C)c2)CC1	ZINC001229879316	1375909987	/nfs/dbraw/zinc/90/99/87/1375909987.db2.gz	ZFGHQVJTYVJJMG-UHFFFAOYSA-N	0	3	330.472	3.207	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)CSC(C)C	ZINC001133382616	1375962836	/nfs/dbraw/zinc/96/28/36/1375962836.db2.gz	QZHADWYQKXZILG-UHFFFAOYSA-N	0	3	338.904	3.033	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@H](C)C1CC1	ZINC001133390786	1375974536	/nfs/dbraw/zinc/97/45/36/1375974536.db2.gz	JEAJPJGUWPCHEJ-OAHLLOKOSA-N	0	3	332.875	3.328	20	30		EGEDHN
C=CCC1(C(=O)NCCN[C@H]2CCc3c2cc(F)cc3F)CCC1	ZINC001133392055	1375977069	/nfs/dbraw/zinc/97/70/69/1375977069.db2.gz	FNDPIBZECPLXGL-KRWDZBQOSA-N	0	3	334.410	3.404	20	30		EGEDHN
C#CCCCC(=O)N(CCNCC#CC)Cc1cccc(Cl)c1	ZINC001133396009	1375980351	/nfs/dbraw/zinc/98/03/51/1375980351.db2.gz	MXXQHEMZQKOEMR-UHFFFAOYSA-N	0	3	330.859	3.085	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C(C)(C)CC=C	ZINC001133405501	1375989170	/nfs/dbraw/zinc/98/91/70/1375989170.db2.gz	AUJNMRDQCQIZEB-UHFFFAOYSA-N	0	3	332.875	3.494	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N[C@@H]1CCCC[C@H]1NCc1cc(C)ccc1F	ZINC001230324631	1375997833	/nfs/dbraw/zinc/99/78/33/1375997833.db2.gz	QRGZIXWSPIIAGV-ATZDWAIDSA-N	0	3	348.462	3.242	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)/C=C\c1ccco1)NCc1ccccc1C#N	ZINC001133520110	1376054402	/nfs/dbraw/zinc/05/44/02/1376054402.db2.gz	ICWNPYBYXMMDPG-SBKIPFDTSA-N	0	3	337.423	3.238	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)Cc1cccs1)NCc1ccccc1C#N	ZINC001133521502	1376055816	/nfs/dbraw/zinc/05/58/16/1376055816.db2.gz	SLFXIIKHIAKQJA-HUUCEWRRSA-N	0	3	341.480	3.235	20	30		EGEDHN
C=CCCC(=O)N1CCC([C@H]2CCCN2Cc2snnc2C)CC1	ZINC001230538574	1376062981	/nfs/dbraw/zinc/06/29/81/1376062981.db2.gz	WMTNFMXIIOQXNF-MRXNPFEDSA-N	0	3	348.516	3.016	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1C1CCN(C(=O)C(C)(C)COC)CC1	ZINC001230581089	1376083087	/nfs/dbraw/zinc/08/30/87/1376083087.db2.gz	VHPNZFBDBQYJPU-MRXNPFEDSA-N	0	3	342.911	3.115	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)c1ccccc1F)Cc1cccnc1	ZINC001230652882	1376115983	/nfs/dbraw/zinc/11/59/83/1376115983.db2.gz	DIFMCVPNJFKLIO-UHFFFAOYSA-N	0	3	341.430	3.419	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)c1ccsc1)NCc1ccccc1C#N	ZINC001133632341	1376127946	/nfs/dbraw/zinc/12/79/46/1376127946.db2.gz	FSDBAEMRIALKHF-KBPBESRZSA-N	0	3	327.453	3.306	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)C(C)(C)C1CC1)Cc1cccnc1	ZINC001230824551	1376161059	/nfs/dbraw/zinc/16/10/59/1376161059.db2.gz	FXUYXZOSSNPRSE-UHFFFAOYSA-N	0	3	329.488	3.402	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCCN(Cc1cccnc1)C[C@H](C)OC	ZINC001230859696	1376165906	/nfs/dbraw/zinc/16/59/06/1376165906.db2.gz	LQNVXVWKWXRPQZ-KRWDZBQOSA-N	0	3	347.503	3.027	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)c1ccccc1[O-])[NH2+]Cc1ccc(C#N)s1	ZINC001133723113	1376176551	/nfs/dbraw/zinc/17/65/51/1376176551.db2.gz	RFHGIXSOOVQLFC-OLZOCXBDSA-N	0	3	343.452	3.012	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)C(C)(C)CCOC)Cc1cccnc1	ZINC001230883599	1376177432	/nfs/dbraw/zinc/17/74/32/1376177432.db2.gz	XWJXGHWIOVVVBH-UHFFFAOYSA-N	0	3	347.503	3.029	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N(C)C[C@H]1CCN1CCC1=CCCCC1	ZINC001231093741	1376202941	/nfs/dbraw/zinc/20/29/41/1376202941.db2.gz	BWFXTWMXDAXGOC-IEBWSBKVSA-N	0	3	334.504	3.391	20	30		EGEDHN
C=CCOc1cccc(CN2CC[C@H](Oc3ccc(OC)cn3)C2)c1	ZINC001231625362	1376284904	/nfs/dbraw/zinc/28/49/04/1376284904.db2.gz	UPLUAJFUSIVOGU-IBGZPJMESA-N	0	3	340.423	3.308	20	30		EGEDHN
C=CCOc1cccc(CN2CCC(N(CC)C(=O)CC)CC2)c1	ZINC001231624278	1376285534	/nfs/dbraw/zinc/28/55/34/1376285534.db2.gz	LDGCTNJLIXDWHW-UHFFFAOYSA-N	0	3	330.472	3.474	20	30		EGEDHN
C#Cc1cccc(CN2C[C@@H]3C[C@H]2C[C@@H]3NC(=O)OC(C)(C)C)c1	ZINC001231657316	1376296759	/nfs/dbraw/zinc/29/67/59/1376296759.db2.gz	ISLRHNJSGCDQIL-BZSNNMDCSA-N	0	3	326.440	3.155	20	30		EGEDHN
N#Cc1ccccc1O[C@H]1CCCN(Cc2cccc3c[nH]nc32)C1	ZINC001231973898	1376366952	/nfs/dbraw/zinc/36/69/52/1376366952.db2.gz	NOEMSNTYTZAZTE-SFHVURJKSA-N	0	3	332.407	3.478	20	30		EGEDHN
Cc1[nH]ccc1C(=O)N[C@H](C)C[C@H](C)NCc1cc(F)ccc1C#N	ZINC001134104965	1376370117	/nfs/dbraw/zinc/37/01/17/1376370117.db2.gz	NROMIDWPVQLJRX-QWHCGFSZSA-N	0	3	342.418	3.021	20	30		EGEDHN
C[C@H](CC(=O)NCCNCc1ccc(F)c(C#N)c1)CC(C)(C)C	ZINC001134255368	1376438941	/nfs/dbraw/zinc/43/89/41/1376438941.db2.gz	XVHMFRHEXWXRBO-CQSZACIVSA-N	0	3	333.451	3.366	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)c1cc(C)cs1	ZINC001134281022	1376454888	/nfs/dbraw/zinc/45/48/88/1376454888.db2.gz	VKYYHKZRVXMXFC-VXGBXAGGSA-N	0	3	345.306	3.452	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H](C)C[C@@H](C)NCc1nsc2ccccc21	ZINC001134316666	1376471754	/nfs/dbraw/zinc/47/17/54/1376471754.db2.gz	ALLUWEQVPZVBDB-CABCVRRESA-N	0	3	343.496	3.329	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC001232845820	1376524413	/nfs/dbraw/zinc/52/44/13/1376524413.db2.gz	SNJHPXVJJSXBQU-CYBMUJFWSA-N	0	3	335.473	3.309	20	30		EGEDHN
C=CCO[C@H]1CO[C@]2(C1)CCCN(Cc1ccc3ncoc3c1)C2	ZINC001232940784	1376542857	/nfs/dbraw/zinc/54/28/57/1376542857.db2.gz	GPWZGQIBZJIVDX-APWZRJJASA-N	0	3	328.412	3.154	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@H](C)C[C@H](C)NCc1cnc(C)o1	ZINC001134449791	1376544305	/nfs/dbraw/zinc/54/43/05/1376544305.db2.gz	WZDZQRAVCKMROG-WDEREUQCSA-N	0	3	327.856	3.135	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@H](C)C[C@H](C)NCc1ocnc1C	ZINC001134449378	1376545036	/nfs/dbraw/zinc/54/50/36/1376545036.db2.gz	UCNZHZPJLJCBLO-WDEREUQCSA-N	0	3	327.856	3.135	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)C1C=CC=CC=C1)NCc1ccccc1C#N	ZINC001134476447	1376559782	/nfs/dbraw/zinc/55/97/82/1376559782.db2.gz	RUQMYNBWSFCINI-IRXDYDNUSA-N	0	3	335.451	3.230	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2ccn(C(C)C)n2)CCC1	ZINC001134566982	1376599617	/nfs/dbraw/zinc/59/96/17/1376599617.db2.gz	ITHZETQLCJTVSA-IRXDYDNUSA-N	0	3	344.503	3.031	20	30		EGEDHN
CCCCCCCN1CC[C@@H]1CN(C)C(=O)[C@H]1CCCc2n[nH]cc21	ZINC001234323555	1376809344	/nfs/dbraw/zinc/80/93/44/1376809344.db2.gz	QWXWNVDNSQLJCW-SJORKVTESA-N	0	3	346.519	3.333	20	30		EGEDHN
CCCCCCCN1CC[C@@H]1CN(C)C(=O)C1(F)CCOCC1	ZINC001235123179	1376852049	/nfs/dbraw/zinc/85/20/49/1376852049.db2.gz	LBMRUISUSYONNH-MRXNPFEDSA-N	0	3	328.472	3.008	20	30		EGEDHN
C=CC1(CC(=O)NCCNCc2cccc(C#N)c2)CCCCC1	ZINC001135187012	1376960115	/nfs/dbraw/zinc/96/01/15/1376960115.db2.gz	NQOCCZQSQIHGKI-UHFFFAOYSA-N	0	3	325.456	3.291	20	30		EGEDHN
C=CCOC(=O)N[C@H]1CCCN(Cc2ccc(C(C)C)cc2O)C1	ZINC001237051638	1376971953	/nfs/dbraw/zinc/97/19/53/1376971953.db2.gz	PNHBDVIPOGYJGH-KRWDZBQOSA-N	0	3	332.444	3.392	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H](C)C[C@H](C)NCc1nc2ccccc2n1C	ZINC001135231237	1376990887	/nfs/dbraw/zinc/99/08/87/1376990887.db2.gz	YDWTYBPHSBAIRN-GJZGRUSLSA-N	0	3	342.487	3.158	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H](C)C[C@@H](C)NCc1cc(F)ccc1C#N	ZINC001135231347	1376991106	/nfs/dbraw/zinc/99/11/06/1376991106.db2.gz	ZJGQQEPTZBPWLI-ZIAGYGMSSA-N	0	3	331.435	3.282	20	30		EGEDHN
CC#CCCCC(=O)N[C@H](C)C[C@H](C)NCc1nc(C)sc1C	ZINC001135238921	1376996022	/nfs/dbraw/zinc/99/60/22/1376996022.db2.gz	SDPQCAWIWOTMCK-UONOGXRCSA-N	0	3	335.517	3.326	20	30		EGEDHN
C=CCO[C@H]1CO[C@]2(C1)CCCN(Cc1ccc(C#N)c(CC)c1)C2	ZINC001238775813	1377001823	/nfs/dbraw/zinc/00/18/23/1377001823.db2.gz	PCKORSQGQHPTDE-RTWAWAEBSA-N	0	3	340.467	3.447	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2ccn(CC)n2)CCC1	ZINC001135395203	1377071582	/nfs/dbraw/zinc/07/15/82/1377071582.db2.gz	ORIWUHANAYLYOJ-HZPDHXFCSA-N	0	3	332.492	3.022	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H](C)C[C@H](C)NCc2ccn(C(C)C)n2)C1	ZINC001135428055	1377092441	/nfs/dbraw/zinc/09/24/41/1377092441.db2.gz	YHKMBMPNEKOWHD-HOTGVXAUSA-N	0	3	332.492	3.193	20	30		EGEDHN
C=C[C@@H](NC[C@H](O)COc1ccc(CCOC)cc1)c1ccccc1	ZINC001253076482	1377095960	/nfs/dbraw/zinc/09/59/60/1377095960.db2.gz	GGVKUCPFHFWGCM-PZJWPPBQSA-N	0	3	341.451	3.132	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)C1(F)CCCCC1	ZINC001135854307	1377235832	/nfs/dbraw/zinc/23/58/32/1377235832.db2.gz	CDOXFECFWSFZSY-QWHCGFSZSA-N	0	3	349.288	3.440	20	30		EGEDHN
C=C(Cl)CN[C@H](C)C[C@H](C)NC(=O)c1cc(=O)c2ccccc2o1	ZINC001136071583	1377326777	/nfs/dbraw/zinc/32/67/77/1377326777.db2.gz	PJPFDZMBJUFOJN-OLZOCXBDSA-N	0	3	348.830	3.032	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CC[C@H](N(C)Cc2ccc(CF)cc2)C1	ZINC001189242127	1388493610	/nfs/dbraw/zinc/49/36/10/1388493610.db2.gz	FLDAABUCGNYKJB-LPHOPBHVSA-N	0	3	348.462	3.170	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CC[C@H](N(C)Cc2ccc(C)c(F)c2)C1	ZINC001189251263	1388496809	/nfs/dbraw/zinc/49/68/09/1388496809.db2.gz	OUAYTDPYDBQKMS-WMZOPIPTSA-N	0	3	348.462	3.148	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@@H]1CCN(Cc1n[nH]c3ccccc31)C2	ZINC001137346396	1377527589	/nfs/dbraw/zinc/52/75/89/1377527589.db2.gz	VTWIPKWOGKXJMX-WOJBJXKFSA-N	0	3	341.455	3.137	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CCC(NC(=O)CC(C)C)CC2)c1[O-]	ZINC001138629263	1377756821	/nfs/dbraw/zinc/75/68/21/1377756821.db2.gz	SOJGZIOOCHGZON-UHFFFAOYSA-N	0	3	330.472	3.247	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@]3(C2)CCCCN3C(C)=O)c1[O-]	ZINC001138629333	1377756895	/nfs/dbraw/zinc/75/68/95/1377756895.db2.gz	UYLALZFEWDYLAE-FQEVSTJZSA-N	0	3	328.456	3.098	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@]3(C2)CCCCN3C(C)=O)c1[O-]	ZINC001138629333	1377756896	/nfs/dbraw/zinc/75/68/96/1377756896.db2.gz	UYLALZFEWDYLAE-FQEVSTJZSA-N	0	3	328.456	3.098	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@@]3(CCCCN3C(C)=O)C2)c1[O-]	ZINC001138627575	1377756947	/nfs/dbraw/zinc/75/69/47/1377756947.db2.gz	MJOXEXBPYRFTEA-NRFANRHFSA-N	0	3	342.483	3.488	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@@]3(CCCCN3C(C)=O)C2)c1[O-]	ZINC001138627575	1377756950	/nfs/dbraw/zinc/75/69/50/1377756950.db2.gz	MJOXEXBPYRFTEA-NRFANRHFSA-N	0	3	342.483	3.488	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CCC(Oc3ncncc3C)CC2)c1[O-]	ZINC001138630861	1377757812	/nfs/dbraw/zinc/75/78/12/1377757812.db2.gz	FQFOTSRFMWOVCA-UHFFFAOYSA-N	0	3	339.439	3.263	20	30		EGEDHN
C=CCO[C@H]1CO[C@@]2(C1)CCCN(Cc1ccc3c(c1)CCCO3)C2	ZINC001138715655	1377772670	/nfs/dbraw/zinc/77/26/70/1377772670.db2.gz	QODLUKHCYBOZCE-TZIWHRDSSA-N	0	3	343.467	3.338	20	30		EGEDHN
O=C1C=C2CN(Cc3sccc3Br)CCC2S1	ZINC001139310911	1377866076	/nfs/dbraw/zinc/86/60/76/1377866076.db2.gz	GCECSZPRNLIDES-SNVBAGLBSA-N	0	3	330.272	3.285	20	30		EGEDHN
C[C@]1(O)CCCCN(Cc2ccc(Oc3ccc(C#N)cc3)nc2)C1	ZINC001139425118	1377882293	/nfs/dbraw/zinc/88/22/93/1377882293.db2.gz	ZYLAFHXRYLZMEI-FQEVSTJZSA-N	0	3	337.423	3.482	20	30		EGEDHN
C=CCN1C(=O)CCC[C@@]12CCCN(Cc1ccc(C)c(C#N)c1)C2	ZINC001139723722	1377941434	/nfs/dbraw/zinc/94/14/34/1377941434.db2.gz	FGAIMECXDKIWMV-NRFANRHFSA-N	0	3	337.467	3.400	20	30		EGEDHN
Cc1ccc(CN2CCC3(CCCN3c3ncccn3)CC2)cc1C#N	ZINC001139724718	1377941618	/nfs/dbraw/zinc/94/16/18/1377941618.db2.gz	NPSYKPLFJVWIKO-UHFFFAOYSA-N	0	3	347.466	3.292	20	30		EGEDHN
C#CCN1C[C@]2(CC1=O)CCCCN2Cc1cccc(OC(C)C)c1	ZINC001272923150	1378083422	/nfs/dbraw/zinc/08/34/22/1378083422.db2.gz	CONRVNPUDASMSS-OAQYLSRUSA-N	0	3	340.467	3.064	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCCC[C@@]23CC(=O)N(CC=C)C3)c1[O-]	ZINC001273360852	1378098825	/nfs/dbraw/zinc/09/88/25/1378098825.db2.gz	WPVCUGPSAQWTAT-NRFANRHFSA-N	0	3	340.467	3.264	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCCC[C@@]23CC(=O)N(CC=C)C3)c1[O-]	ZINC001273360852	1378098827	/nfs/dbraw/zinc/09/88/27/1378098827.db2.gz	WPVCUGPSAQWTAT-NRFANRHFSA-N	0	3	340.467	3.264	20	30		EGEDHN
C=CCNC(=O)[C@@H]1CC12CC[NH+](Cc1cccc(CC=C)c1[O-])CC2	ZINC001273360899	1378098871	/nfs/dbraw/zinc/09/88/71/1378098871.db2.gz	XQJUPOIJCXNRLP-SFHVURJKSA-N	0	3	340.467	3.025	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1c(N)cccc1F)[C@@H]2CC	ZINC001140872850	1378164550	/nfs/dbraw/zinc/16/45/50/1378164550.db2.gz	IKLHZBCUDRXLEJ-QUCCMNQESA-N	0	3	345.462	3.330	20	30		EGEDHN
C=CCN1C(=O)CCC[C@@]12CCCN(Cc1sccc1OC)C2	ZINC001141321114	1378301665	/nfs/dbraw/zinc/30/16/65/1378301665.db2.gz	VNYJOTUOLKJVMG-SFHVURJKSA-N	0	3	334.485	3.290	20	30		EGEDHN
Cc1ccc([C@@H](CNC(=O)[C@@H](CC#N)c2ccccc2)N(C)C)cc1	ZINC001142539562	1378455661	/nfs/dbraw/zinc/45/56/61/1378455661.db2.gz	SWBABWNMKCELTQ-VQTJNVASSA-N	0	3	335.451	3.411	20	30		EGEDHN
C[C@H]1CN(Cc2c[nH]c3cc(C#N)ccc23)CC[C@]1(O)C(F)(F)F	ZINC001142911742	1378508005	/nfs/dbraw/zinc/50/80/05/1378508005.db2.gz	HTCKJRCZHVKWBY-MEDUHNTESA-N	0	3	337.345	3.175	20	30		EGEDHN
Cc1cnc(OC2CCN(Cc3c[nH]c4cc(C#N)ccc34)CC2)nc1	ZINC001142932336	1378511351	/nfs/dbraw/zinc/51/13/51/1378511351.db2.gz	YYHNIBKTBKCQNA-UHFFFAOYSA-N	0	3	347.422	3.181	20	30		EGEDHN
C=CCOC(=O)N1CC2(C1)CCN(Cc1cc(C)cc(F)c1)CC2	ZINC001143580231	1378619880	/nfs/dbraw/zinc/61/98/80/1378619880.db2.gz	AZSSNZVIVBTGNU-UHFFFAOYSA-N	0	3	332.419	3.355	20	30		EGEDHN
CCOc1ccc(F)c(CN2CCC3SC(=O)C=C3C2)c1F	ZINC001143934821	1378662365	/nfs/dbraw/zinc/66/23/65/1378662365.db2.gz	OHAMJHDFZWUQEE-AWEZNQCLSA-N	0	3	325.380	3.138	20	30		EGEDHN
C#Cc1ccc(CN2CC[C@@]3(CCN3C(=O)OC(C)(C)C)C2)cc1	ZINC001144568394	1378745963	/nfs/dbraw/zinc/74/59/63/1378745963.db2.gz	UBBFQLRLIHWDKZ-HXUWFJFHSA-N	0	3	326.440	3.253	20	30		EGEDHN
C#Cc1ccc(CN2C[C@@H](C)C[C@H](NC(=O)OC(C)(C)C)C2)cc1	ZINC001144578812	1378747862	/nfs/dbraw/zinc/74/78/62/1378747862.db2.gz	QLKVOIQYMWWZPA-YJBOKZPZSA-N	0	3	328.456	3.403	20	30		EGEDHN
C=CCCC(=O)N1CC2(C1)CCN(CCCc1c(F)cccc1F)C2	ZINC001147187652	1378984417	/nfs/dbraw/zinc/98/44/17/1378984417.db2.gz	LTBZAJXFFJCNCJ-UHFFFAOYSA-N	0	3	348.437	3.398	20	30		EGEDHN
C#CCCCCC(=O)N1CC2(C1)CCN(CCCCC(F)(F)F)C2	ZINC001147374426	1379011518	/nfs/dbraw/zinc/01/15/18/1379011518.db2.gz	MLHNWSWBAYDNQA-UHFFFAOYSA-N	0	3	344.421	3.447	20	30		EGEDHN
CC[C@H](CC(=O)NCCNCc1ccc(C#N)cc1)c1ccccc1	ZINC001147474960	1379028929	/nfs/dbraw/zinc/02/89/29/1379028929.db2.gz	MIJJUDIOVABCSS-LJQANCHMSA-N	0	3	335.451	3.348	20	30		EGEDHN
C#CCC1(C(=O)N2CC3(C2)CCN(C/C=C/c2ccccc2)C3)CCC1	ZINC001147710934	1379063657	/nfs/dbraw/zinc/06/36/57/1379063657.db2.gz	BVCFMLNXOLKIEE-UXBLZVDNSA-N	0	3	348.490	3.428	20	30		EGEDHN
C[C@@H](CN(C)C(=O)CCC(C)(F)F)NCc1ccc(F)c(C#N)c1	ZINC001283629573	1379065614	/nfs/dbraw/zinc/06/56/14/1379065614.db2.gz	KIBGULZCDWJMKS-LBPRGKRZSA-N	0	3	341.377	3.069	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC2(C1)CCN(Cc1cccnc1C)C2	ZINC001148357645	1379156176	/nfs/dbraw/zinc/15/61/76/1379156176.db2.gz	PGEGPIUTIBJWKF-UHFFFAOYSA-N	0	3	327.472	3.027	20	30		EGEDHN
CC(C)(C)CCC(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001148472192	1379179966	/nfs/dbraw/zinc/17/99/66/1379179966.db2.gz	ZXMTVYKRSOGSGN-UHFFFAOYSA-N	0	3	339.483	3.419	20	30		EGEDHN
CC[C@H]1CC[C@H](C(=O)NCCNCc2ccc(C#N)c(F)c2)CC1	ZINC001148501193	1379193537	/nfs/dbraw/zinc/19/35/37/1379193537.db2.gz	IHUOGBAQKFZNAC-KOMQPUFPSA-N	0	3	331.435	3.120	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C[C@H](c3ccccc3)C(C)C)C2)C1	ZINC001148598650	1379221628	/nfs/dbraw/zinc/22/16/28/1379221628.db2.gz	GHQGNNVXUOLEGP-FQEVSTJZSA-N	0	3	338.495	3.374	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)C[C@@H]2CCCc3ccccc32)c1	ZINC001148654837	1379235377	/nfs/dbraw/zinc/23/53/77/1379235377.db2.gz	BSEYSUUIMJTXBM-FQEVSTJZSA-N	0	3	347.462	3.274	20	30		EGEDHN
CC(C)(CC(=O)NCCNCc1ccc(C#N)cc1)CC(F)(F)F	ZINC001149166937	1379338199	/nfs/dbraw/zinc/33/81/99/1379338199.db2.gz	SXNZFLMTRLJPKB-UHFFFAOYSA-N	0	3	341.377	3.133	20	30		EGEDHN
C=CCCC(=O)NC[C@H]1CN([C@H](C)c2cccc(C)c2)CCCO1	ZINC001149376123	1379371976	/nfs/dbraw/zinc/37/19/76/1379371976.db2.gz	VPOXHGYKNVUZDH-MJGOQNOKSA-N	0	3	330.472	3.229	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)C2CCC(C3CC3)CC2)ccc1F	ZINC001149490868	1379390078	/nfs/dbraw/zinc/39/00/78/1379390078.db2.gz	YJCTZGRXZCPBEZ-UHFFFAOYSA-N	0	3	343.446	3.120	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@H]1CN(Cc2ccc(CC)cc2)CCCO1	ZINC001150084757	1379492059	/nfs/dbraw/zinc/49/20/59/1379492059.db2.gz	GUZVSBNUUGVIMA-IBGZPJMESA-N	0	3	344.499	3.168	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@H]1CN(Cc2ccccc2C)CCCO1	ZINC001150159347	1379505547	/nfs/dbraw/zinc/50/55/47/1379505547.db2.gz	GUOQWBPJSNJSFS-ICSRJNTNSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H]1CN(Cc2ccc(C)cc2C)CCCO1	ZINC001150210357	1379516214	/nfs/dbraw/zinc/51/62/14/1379516214.db2.gz	DAJROSZZAMDWEI-HXUWFJFHSA-N	0	3	344.499	3.367	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)CC/C=C\c2ccccc2)C1	ZINC001150318701	1379533305	/nfs/dbraw/zinc/53/33/05/1379533305.db2.gz	UDQOWMFJQYMFDW-HUQFFUELSA-N	0	3	342.483	3.263	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2ccc(CC)s2)CC1	ZINC001151209394	1379677486	/nfs/dbraw/zinc/67/74/86/1379677486.db2.gz	JLRZCOHYBCWKEH-UHFFFAOYSA-N	0	3	336.501	3.097	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)C(=O)NCCNCc1cnc(C)s1	ZINC001151906392	1379814114	/nfs/dbraw/zinc/81/41/14/1379814114.db2.gz	IEEYKYIOYZIIBJ-QGZVFWFLSA-N	0	3	343.496	3.092	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)C(=O)NCCNCc1cnccc1C	ZINC001151923239	1379816197	/nfs/dbraw/zinc/81/61/97/1379816197.db2.gz	SLLBTHQFAOCDGJ-LJQANCHMSA-N	0	3	337.467	3.031	20	30		EGEDHN
CCn1c(C(=O)NCCNCc2cccc(C#N)c2)cc2ccccc21	ZINC001152169818	1379877326	/nfs/dbraw/zinc/87/73/26/1379877326.db2.gz	NBZQNIOVPPKERD-UHFFFAOYSA-N	0	3	346.434	3.052	20	30		EGEDHN
C=CCOCC(=O)NC[C@@H](C)N(CC)Cc1ccc(C(C)C)nc1C	ZINC001152370622	1379921230	/nfs/dbraw/zinc/92/12/30/1379921230.db2.gz	KOQWBKTZZODJLW-MRXNPFEDSA-N	0	3	347.503	3.043	20	30		EGEDHN
Cc1ccc2oc(C(=O)NCCNCc3cccc(C#N)c3)cc2c1	ZINC001152389088	1379924702	/nfs/dbraw/zinc/92/47/02/1379924702.db2.gz	KORHPCOZTWVOPF-UHFFFAOYSA-N	0	3	333.391	3.133	20	30		EGEDHN
CC(C)c1ccc(C(=O)NCCNCc2ccc(F)c(C#N)c2)s1	ZINC001152777523	1379980672	/nfs/dbraw/zinc/98/06/72/1379980672.db2.gz	NZUBDSSRMNAOGA-UHFFFAOYSA-N	0	3	345.443	3.402	20	30		EGEDHN
Cc1ccccc1C[C@@H](C)C(=O)NCCNCc1ccc(C#N)s1	ZINC001152832236	1379985560	/nfs/dbraw/zinc/98/55/60/1379985560.db2.gz	XRBZNOWXWOWBJJ-OAHLLOKOSA-N	0	3	341.480	3.013	20	30		EGEDHN
CC1=C(C)C[C@@](C)(C(=O)NCCNCc2ccc(F)c(C#N)c2)CC1	ZINC001152934457	1379995980	/nfs/dbraw/zinc/99/59/80/1379995980.db2.gz	HVKFSWSGPKVTJF-FQEVSTJZSA-N	0	3	343.446	3.430	20	30		EGEDHN
CC/C(C)=C/C(=O)NC[C@@H](C)N(CC)Cc1ccc(OC)c(C#N)c1	ZINC001153187138	1380032145	/nfs/dbraw/zinc/03/21/45/1380032145.db2.gz	KDFJJMPAVFWYPO-AAGJOFLKSA-N	0	3	343.471	3.250	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1coc2ccc(CC)cc12	ZINC001153376677	1380067775	/nfs/dbraw/zinc/06/77/75/1380067775.db2.gz	VKJWSKXSFNEDOC-OAHLLOKOSA-N	0	3	326.440	3.459	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@@H](C)N(CC)C[C@@H](O)c1ccccc1	ZINC001153609067	1380102634	/nfs/dbraw/zinc/10/26/34/1380102634.db2.gz	WVDKNHMEWXCHSA-SJLPKXTDSA-N	0	3	332.488	3.149	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)[C@]12C[C@H]1CCC2	ZINC001154396239	1380269254	/nfs/dbraw/zinc/26/92/54/1380269254.db2.gz	BPEDJBAAGLHQPK-WIBUTAKZSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H](C)N(CC)C[C@@H](O)c1ccc(CC)cc1	ZINC001154606078	1380315771	/nfs/dbraw/zinc/31/57/71/1380315771.db2.gz	ZMDYLWUKHVQPIB-VQIMIIECSA-N	0	3	346.515	3.321	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1nsc2ccc(C)cc21	ZINC001154609332	1380315886	/nfs/dbraw/zinc/31/58/86/1380315886.db2.gz	DFJNSWTYJKJSCO-CQSZACIVSA-N	0	3	329.469	3.068	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)[C@@]1(C)C=CCC1	ZINC001154682057	1380330622	/nfs/dbraw/zinc/33/06/22/1380330622.db2.gz	DXEPTBJCCSTOPR-UZLBHIALSA-N	0	3	325.456	3.241	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)CC(C)(F)F	ZINC001155073204	1380403394	/nfs/dbraw/zinc/40/33/94/1380403394.db2.gz	SERWWCAWXKTILU-GFCCVEGCSA-N	0	3	341.377	3.069	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)C1(C(C)C)CC1	ZINC001155142672	1380415883	/nfs/dbraw/zinc/41/58/83/1380415883.db2.gz	ZKURQXLVDFMOAK-MRXNPFEDSA-N	0	3	327.472	3.321	20	30		EGEDHN
Cc1cc(N2CCC[C@@H](NCOCC[Si](C)(C)C)C2)ncc1C#N	ZINC001156466613	1380579662	/nfs/dbraw/zinc/57/96/62/1380579662.db2.gz	RYJMKDAJCZXQQW-QGZVFWFLSA-N	0	3	346.551	3.132	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H](C)N(CC)Cc2csc(C)c2)cn1	ZINC001156471165	1380580186	/nfs/dbraw/zinc/58/01/86/1380580186.db2.gz	VELVNFTXCKQSKN-CQSZACIVSA-N	0	3	341.480	3.073	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)C(F)=C2CCCC2)c1	ZINC001156540384	1380590516	/nfs/dbraw/zinc/59/05/16/1380590516.db2.gz	BNXZBIUXMYKYFD-UHFFFAOYSA-N	0	3	333.382	3.091	20	30		EGEDHN
CC1(C)CN(Cc2cccc(C#N)c2)CC[C@H]1NC(=O)CCCF	ZINC001328103948	1388675064	/nfs/dbraw/zinc/67/50/64/1388675064.db2.gz	YUKFQEVMVPIEBN-QGZVFWFLSA-N	0	3	331.435	3.025	20	30		EGEDHN
C=CCCOCC(=O)NC[C@@H](C)N(CC)Cc1ccc(F)cc1C	ZINC001157209815	1380811351	/nfs/dbraw/zinc/81/13/51/1380811351.db2.gz	LMSIYRCNCJGLTE-MRXNPFEDSA-N	0	3	336.451	3.053	20	30		EGEDHN
CN1CCC[C@H]2CN(c3nc4ccccc4c(Cl)c3C#N)C[C@@H]21	ZINC001157271874	1380829392	/nfs/dbraw/zinc/82/93/92/1380829392.db2.gz	KJVXFUDVHGWMHU-LRDDRELGSA-N	0	3	326.831	3.290	20	30		EGEDHN
CC(C)C#CC(=O)NCCCNCc1c(Cl)oc2ccccc21	ZINC001157638666	1380988500	/nfs/dbraw/zinc/98/85/00/1380988500.db2.gz	JAPMKBPFLRFHGJ-UHFFFAOYSA-N	0	3	332.831	3.342	20	30		EGEDHN
O=C(C#CC1CC1)NCCCNCc1cccc(Cl)c1Cl	ZINC001157682851	1381000683	/nfs/dbraw/zinc/00/06/83/1381000683.db2.gz	SKWKZEBNLWCNPN-UHFFFAOYSA-N	0	3	325.239	3.003	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCCC[C@@H]1CN(C)C[C@H]1CCCCO1	ZINC001158005423	1381100512	/nfs/dbraw/zinc/10/05/12/1381100512.db2.gz	UWAAZXZDDFPBJN-QZTJIDSGSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=C(C)CCC(=O)N1CCCC[C@@H]1CN(C)C[C@H]1CC(C)(C)CO1	ZINC001158011868	1381102292	/nfs/dbraw/zinc/10/22/92/1381102292.db2.gz	SIXBHLJIOBWFCD-QZTJIDSGSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)[C@@H](CC)CC(F)F	ZINC001158065570	1381117687	/nfs/dbraw/zinc/11/76/87/1381117687.db2.gz	JTTDVGXNXQXDPI-JKSUJKDBSA-N	0	3	346.462	3.183	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc(C)n([C@H](C)C2CC2)n1	ZINC001158155075	1381143378	/nfs/dbraw/zinc/14/33/78/1381143378.db2.gz	GKWUXPOYOSZQNY-SJLPKXTDSA-N	0	3	344.503	3.275	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cccc2c1O[C@H](C)C2	ZINC001158254578	1381174460	/nfs/dbraw/zinc/17/44/60/1381174460.db2.gz	NFPHIUGBYSMDLH-NVXWUHKLSA-N	0	3	328.456	3.123	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)C[C@H]1CCOc2ccccc21	ZINC001158310719	1381195268	/nfs/dbraw/zinc/19/52/68/1381195268.db2.gz	IMNKDHOIWJYDJF-QZTJIDSGSA-N	0	3	342.483	3.442	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc(-c2cn[nH]c2)cc1	ZINC001158597778	1381312994	/nfs/dbraw/zinc/31/29/94/1381312994.db2.gz	KTAVVXAIRJFJMS-LJQANCHMSA-N	0	3	338.455	3.189	20	30		EGEDHN
CC1=C(C)C[C@@H](C(=O)NCCCNCc2ccc(C#N)cc2F)CC1	ZINC001158721943	1381366968	/nfs/dbraw/zinc/36/69/68/1381366968.db2.gz	VBSNPNDDULVHSA-KRWDZBQOSA-N	0	3	343.446	3.430	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)COc1ccc(C)cc1C	ZINC001158847433	1381430559	/nfs/dbraw/zinc/43/05/59/1381430559.db2.gz	WWJNIPNGIFNEPS-GOSISDBHSA-N	0	3	330.472	3.181	20	30		EGEDHN
Cc1cc(C)c(C(=O)NCCCNCc2ccccc2C#N)s1	ZINC001158945305	1381478266	/nfs/dbraw/zinc/47/82/66/1381478266.db2.gz	PJVXUOAWOIXDMV-UHFFFAOYSA-N	0	3	327.453	3.146	20	30		EGEDHN
C[C@H](N)c1ncc(-c2ccccc2)n1-c1ccc2c(C#N)c[nH]c2n1	ZINC001159596249	1381842407	/nfs/dbraw/zinc/84/24/07/1381842407.db2.gz	VCSYBQPTIZKSGW-LBPRGKRZSA-N	0	3	328.379	3.307	20	30		EGEDHN
C=C(C)CCC(=O)NCCC1=CCN(CCOCC2CCC2)CC1	ZINC001160264079	1382053636	/nfs/dbraw/zinc/05/36/36/1382053636.db2.gz	BZXLRENSYJBOIL-UHFFFAOYSA-N	0	3	334.504	3.298	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc3c(c2)C(C)(C)CO3)CC1	ZINC001160645692	1382159168	/nfs/dbraw/zinc/15/91/68/1382159168.db2.gz	HEXOTVAAXLYWQU-UHFFFAOYSA-N	0	3	340.467	3.295	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H]2COc3cc(C)c(C)cc32)CC1	ZINC001160778847	1382193944	/nfs/dbraw/zinc/19/39/44/1382193944.db2.gz	QYESMPCDZOYJAR-IBGZPJMESA-N	0	3	340.467	3.104	20	30		EGEDHN
C=CCN1CCC[C@H]1CNc1nc(Cl)nc(-c2ccccc2)n1	ZINC001160952873	1382249896	/nfs/dbraw/zinc/24/98/96/1382249896.db2.gz	GJTJJQZFYKKCNG-AWEZNQCLSA-N	0	3	329.835	3.254	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCCC1=CCN(CCOCC(C)C)CC1	ZINC001160990513	1382263494	/nfs/dbraw/zinc/26/34/94/1382263494.db2.gz	BUWMDNKULFUGDD-SFHVURJKSA-N	0	3	336.520	3.400	20	30		EGEDHN
C[C@H]1C[C@H]1CC(=O)NCCC1=CCN(Cc2ccc(C#N)cc2)CC1	ZINC001161114538	1382303240	/nfs/dbraw/zinc/30/32/40/1382303240.db2.gz	ZXHVIIULJHZYSA-JXFKEZNVSA-N	0	3	337.467	3.243	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cccc(N3CC=CC3)c2)CC1	ZINC001161343586	1382376464	/nfs/dbraw/zinc/37/64/64/1382376464.db2.gz	KVRGZGIONIHMQI-UHFFFAOYSA-N	0	3	337.467	3.001	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@@H]1CCC[C@H]1CCC	ZINC001161419857	1382404743	/nfs/dbraw/zinc/40/47/43/1382404743.db2.gz	UPINRRPWHJZOCS-ZIAGYGMSSA-N	0	3	331.298	3.207	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H]2C[C@H]2c2cccc(C)c2)CC1	ZINC001161446072	1382413087	/nfs/dbraw/zinc/41/30/87/1382413087.db2.gz	WIFZZFQZLQXSGA-LEWJYISDSA-N	0	3	336.479	3.260	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2csc(C(C)(C)C)n2)CC1	ZINC001161478580	1382419536	/nfs/dbraw/zinc/41/95/36/1382419536.db2.gz	SDWBOTWXBJHQHB-UHFFFAOYSA-N	0	3	345.512	3.216	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc(C)nc2OCCC)CC1	ZINC001161610086	1382456391	/nfs/dbraw/zinc/45/63/91/1382456391.db2.gz	FEGATYKMAPWZMG-UHFFFAOYSA-N	0	3	343.471	3.117	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C2CCC(C(F)F)CC2)CC1	ZINC001161802007	1382510495	/nfs/dbraw/zinc/51/04/95/1382510495.db2.gz	WRXGUAVPIVWFJX-UHFFFAOYSA-N	0	3	326.431	3.382	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H](C)CCOc2ccccc2)CC1	ZINC001162003059	1382596028	/nfs/dbraw/zinc/59/60/28/1382596028.db2.gz	UUFGGVMPNLZNLS-SFHVURJKSA-N	0	3	342.483	3.416	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1ccc(Cl)cc1F	ZINC001162065380	1382618310	/nfs/dbraw/zinc/61/83/10/1382618310.db2.gz	NYDKDVBCPZZLJA-UHFFFAOYSA-N	0	3	349.631	3.097	20	30		EGEDHN
C#CCN1CCC(CNC(=O)CCC[C@H](C)CCC)(COC)CC1	ZINC001162283160	1382720692	/nfs/dbraw/zinc/72/06/92/1382720692.db2.gz	NUKRZOMLNBTKIU-GOSISDBHSA-N	0	3	336.520	3.071	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC1(COC)CCN(C[C@H](F)CC)CC1	ZINC001162393639	1382746870	/nfs/dbraw/zinc/74/68/70/1382746870.db2.gz	YYBQLHPPGWNLLA-MRXNPFEDSA-N	0	3	342.499	3.182	20	30		EGEDHN
C#CCN1CCC(CNC(=O)C[C@@H]2CCCC(C)(C)C2)(COC)CC1	ZINC001162576458	1382795424	/nfs/dbraw/zinc/79/54/24/1382795424.db2.gz	GJTVMINRPCSVGR-SFHVURJKSA-N	0	3	348.531	3.071	20	30		EGEDHN
N#Cc1cccnc1NCCNCc1csc(C(F)(F)F)c1	ZINC001328690115	1388809700	/nfs/dbraw/zinc/80/97/00/1388809700.db2.gz	URCSENUNZIUSHS-UHFFFAOYSA-N	0	3	326.347	3.235	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)C[C@H]2CCCC[C@@H]2C)(COC)CC1	ZINC001162623375	1382814175	/nfs/dbraw/zinc/81/41/75/1382814175.db2.gz	SQWOQDAKAODZRJ-RBUKOAKNSA-N	0	3	348.531	3.071	20	30		EGEDHN
C#CCCCC(=O)N(CCNC[C@@H](F)CC)CCc1ccccc1	ZINC001162791224	1382874570	/nfs/dbraw/zinc/87/45/70/1382874570.db2.gz	ZCMXGWIBGOJRBK-IBGZPJMESA-N	0	3	332.463	3.199	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N(CCNCC#CC)CCc1ccccc1	ZINC001162822621	1382886604	/nfs/dbraw/zinc/88/66/04/1382886604.db2.gz	VKCNICRLWBYWOC-UHFFFAOYSA-N	0	3	346.902	3.449	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)CCc1ccc(C)cc1	ZINC001162856824	1382897061	/nfs/dbraw/zinc/89/70/61/1382897061.db2.gz	POLLDSUINSKNKB-UHFFFAOYSA-N	0	3	348.490	3.222	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C[C@H]1CC[C@@H](C)C1	ZINC001162892068	1382907072	/nfs/dbraw/zinc/90/70/72/1382907072.db2.gz	GMUDCWKHVYBIII-CTNGQTDRSA-N	0	3	340.511	3.497	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N(CCNCC#CC)CCc1ccccc1	ZINC001162919303	1382916909	/nfs/dbraw/zinc/91/69/09/1382916909.db2.gz	PBXRWEHZGLGEHL-NRFANRHFSA-N	0	3	326.484	3.273	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H](C)CC(C)C	ZINC001162970724	1382931990	/nfs/dbraw/zinc/93/19/90/1382931990.db2.gz	IUBUFDAPWYUBFV-IBGZPJMESA-N	0	3	328.500	3.353	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)c1ccc(C)cc1	ZINC001162992852	1382941333	/nfs/dbraw/zinc/94/13/33/1382941333.db2.gz	ZBZNXLIXRIKAGB-UHFFFAOYSA-N	0	3	334.463	3.293	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1cc(C)ccc1C	ZINC001162992780	1382941443	/nfs/dbraw/zinc/94/14/43/1382941443.db2.gz	VPZXRMCTDNILBE-UHFFFAOYSA-N	0	3	334.463	3.211	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)[C@@H]2C[C@@H]3CCCC[C@H]23)c1	ZINC001163057485	1382957151	/nfs/dbraw/zinc/95/71/51/1382957151.db2.gz	OOWSMUYDAQPOBO-RYQLBKOJSA-N	0	3	343.446	3.120	20	30		EGEDHN
N#Cc1cc(Br)cc(N[C@H]2CNCc3ccsc32)n1	ZINC001163240859	1383003241	/nfs/dbraw/zinc/00/32/41/1383003241.db2.gz	XHUGYCRNYKLLSR-NSHDSACASA-N	0	3	335.230	3.034	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCCNCc1ccn(C(CC)CC)n1	ZINC001164223916	1383167902	/nfs/dbraw/zinc/16/79/02/1383167902.db2.gz	XVHCKQOIGGVORS-HOTGVXAUSA-N	0	3	334.508	3.298	20	30		EGEDHN
CN(CCN1CCCC1)C(F)(F)c1cc(Cl)nc(Cl)c1C#N	ZINC001165139432	1383235521	/nfs/dbraw/zinc/23/55/21/1383235521.db2.gz	IQVIQACSAAJJJE-UHFFFAOYSA-N	0	3	349.212	3.337	20	30		EGEDHN
C[C@H]1CCC[C@H](C(=O)NCCCNCc2cc(C#N)ccc2F)C1	ZINC001165423264	1383293161	/nfs/dbraw/zinc/29/31/61/1383293161.db2.gz	GKNZLUCPXBNZCQ-HOCLYGCPSA-N	0	3	331.435	3.120	20	30		EGEDHN
COC(=O)c1ccc(NCC2CN(Cc3ccccc3)C2)cc1CC#N	ZINC001165468868	1383299255	/nfs/dbraw/zinc/29/92/55/1383299255.db2.gz	ISFVMAGPQDDJGE-UHFFFAOYSA-N	0	3	349.434	3.083	20	30		EGEDHN
C=CCCCC(=O)NCCCNCc1cscc1Br	ZINC001165530948	1383307248	/nfs/dbraw/zinc/30/72/48/1383307248.db2.gz	NWBPRSWXZODFCU-UHFFFAOYSA-N	0	3	345.306	3.463	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cncc(Cl)c2C)CC1	ZINC001165622687	1383315715	/nfs/dbraw/zinc/31/57/15/1383315715.db2.gz	JGYWOENRLDDAEM-UHFFFAOYSA-N	0	3	342.270	3.286	20	30		EGEDHN
C=CCCC1(C(=O)NCCCNCc2ccn(C3CCCC3)n2)CC1	ZINC001165914004	1383364059	/nfs/dbraw/zinc/36/40/59/1383364059.db2.gz	STOWNZVIWMSSSS-UHFFFAOYSA-N	0	3	344.503	3.341	20	30		EGEDHN
C=CCC1(C(=O)NCCCNCc2ccn(C3CCCC3)n2)CCC1	ZINC001165998381	1383375639	/nfs/dbraw/zinc/37/56/39/1383375639.db2.gz	UEUIEMFSIYPUSS-UHFFFAOYSA-N	0	3	344.503	3.341	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@@H](OCC)C2CCCC2)CC1	ZINC001166408594	1383419068	/nfs/dbraw/zinc/41/90/68/1383419068.db2.gz	CIDLTYCKQDYYED-INIZCTEOSA-N	0	3	342.911	3.210	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCCC1(CN[C@@H](C)c2cnccn2)CC1	ZINC001166755885	1383472519	/nfs/dbraw/zinc/47/25/19/1383472519.db2.gz	PCUDFCVETHMYIL-HOTGVXAUSA-N	0	3	330.476	3.016	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCC2(CNCc3ccncc3Cl)CC2)C1	ZINC001167130675	1383547863	/nfs/dbraw/zinc/54/78/63/1383547863.db2.gz	UIVRORUIENHGAQ-UHFFFAOYSA-N	0	3	347.890	3.467	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc(F)c(OC)c2)CC1	ZINC001167303326	1383590545	/nfs/dbraw/zinc/59/05/45/1383590545.db2.gz	KLICWJOULZHOQW-UHFFFAOYSA-N	0	3	340.826	3.077	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCC1(CNCc2cccnc2OC)CC1	ZINC001167339804	1383603131	/nfs/dbraw/zinc/60/31/31/1383603131.db2.gz	NLWULTRSWCVLMT-UHFFFAOYSA-N	0	3	345.487	3.069	20	30		EGEDHN
CC(C)[C@H]1C[C@H]1C(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001167578591	1383676067	/nfs/dbraw/zinc/67/60/67/1383676067.db2.gz	KDDVQMAMYUBCQU-RTBURBONSA-N	0	3	339.483	3.226	20	30		EGEDHN
C=CCC1(C(=O)NCCC2(CNCc3cc(C)no3)CC2)CCCC1	ZINC001168565344	1383937964	/nfs/dbraw/zinc/93/79/64/1383937964.db2.gz	MOOQJIOPKNDCHH-UHFFFAOYSA-N	0	3	345.487	3.496	20	30		EGEDHN
C[C@H](COCC1CCCCC1)N[C@@H](C)C(=O)Nc1cccc(C#N)c1	ZINC001308093386	1384090398	/nfs/dbraw/zinc/09/03/98/1384090398.db2.gz	UEQHDFWBBFGMEA-CVEARBPZSA-N	0	3	343.471	3.460	20	30		EGEDHN
CC(C)C[C@H](Cc1ccccc1)N1CCN(c2nccnc2C#N)CC1	ZINC001169079209	1384104173	/nfs/dbraw/zinc/10/41/73/1384104173.db2.gz	QFGBDIKEBFURKI-LJQANCHMSA-N	0	3	349.482	3.128	20	30		EGEDHN
CC(C)OCCC(=O)N[C@H](C)CCCCNCc1ccccc1C#N	ZINC001169266104	1384129847	/nfs/dbraw/zinc/12/98/47/1384129847.db2.gz	CSFCHFDELYQUGK-QGZVFWFLSA-N	0	3	345.487	3.138	20	30		EGEDHN
Cc1cc(NC(=O)N[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)ncc1C#N	ZINC001311069911	1384255341	/nfs/dbraw/zinc/25/53/41/1384255341.db2.gz	BYVDDMPABOYTCT-MAUKXSAKSA-N	0	3	349.438	3.046	20	30		EGEDHN
N#Cc1ccc(CNc2cccc3cc([C@@H]4CNCCO4)cn32)s1	ZINC001170201457	1384262587	/nfs/dbraw/zinc/26/25/87/1384262587.db2.gz	FTLLATBKPUSWMR-KRWDZBQOSA-N	0	3	338.436	3.145	20	30		EGEDHN
Cc1cc(C)cc(CCC(=O)NCCCNCc2ccccc2C#N)c1	ZINC001170265387	1384278283	/nfs/dbraw/zinc/27/82/83/1384278283.db2.gz	DBNCTTUONUQHBH-UHFFFAOYSA-N	0	3	349.478	3.404	20	30		EGEDHN
N#CC1(c2ccccc2)CCC(n2c(=N)sc3c2CCNC3)CC1	ZINC001170389610	1384305531	/nfs/dbraw/zinc/30/55/31/1384305531.db2.gz	VTAQJOWMQSYDQF-UHFFFAOYSA-N	0	3	338.480	3.251	20	30		EGEDHN
C[C@H](N)c1ncc(-c2ccccc2)n1-c1ncnc2cc(C#N)ccc21	ZINC001170679513	1384363163	/nfs/dbraw/zinc/36/31/63/1384363163.db2.gz	HMSJALVBLGYKQP-ZDUSSCGKSA-N	0	3	340.390	3.374	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)c1cnn(C(CC)CC)c1C	ZINC001170689966	1384366854	/nfs/dbraw/zinc/36/68/54/1384366854.db2.gz	WHVNCKHTQUBWFW-UHFFFAOYSA-N	0	3	326.872	3.015	20	30		EGEDHN
C[C@@H](C(=O)NCCCNCc1cc(C#N)ccc1F)C1CCCC1	ZINC001170756782	1384380591	/nfs/dbraw/zinc/38/05/91/1384380591.db2.gz	QIRFCWVBHOXLSF-CQSZACIVSA-N	0	3	331.435	3.120	20	30		EGEDHN
CCOC(=O)[C@H](CC(C)(C)F)Nc1ccc(/N=C/N(C)C)c(C#N)c1	ZINC001170793263	1384386589	/nfs/dbraw/zinc/38/65/89/1384386589.db2.gz	SYEJNGILDSIDLN-GKXUUXLPSA-N	0	3	348.422	3.261	20	30		EGEDHN
N#Cc1c[nH]c2ncc(NC(=N)c3ccc4cc(O)ccc4c3)cc12	ZINC001171181745	1384462198	/nfs/dbraw/zinc/46/21/98/1384462198.db2.gz	BLBARLXZPGUGEJ-UHFFFAOYSA-N	0	3	327.347	3.330	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1CCN(c2ccc(C#N)cc2)CC1	ZINC001171221384	1384471967	/nfs/dbraw/zinc/47/19/67/1384471967.db2.gz	MBOBANFUFGPVMU-QGZVFWFLSA-N	0	3	330.435	3.183	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1CCN2CCc3ccccc3[C@H]2C1	ZINC001171227840	1384474269	/nfs/dbraw/zinc/47/42/69/1384474269.db2.gz	AYPMZWNCKTYRMF-VGOFRKELSA-N	0	3	331.463	3.404	20	30		EGEDHN
Cc1nccnc1O[C@H]1CCCN([C@H](C)Cc2cccc(C#N)c2)C1	ZINC001171231609	1384475466	/nfs/dbraw/zinc/47/54/66/1384475466.db2.gz	KLKKYOUSMAEQGM-BEFAXECRSA-N	0	3	336.439	3.131	20	30		EGEDHN
Cc1nccnc1O[C@H]1CCCN([C@@H](C)Cc2cccc(C#N)c2)C1	ZINC001171231626	1384475575	/nfs/dbraw/zinc/47/55/75/1384475575.db2.gz	KLKKYOUSMAEQGM-KXBFYZLASA-N	0	3	336.439	3.131	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN1CCC[C@@]1(C)Cc1ccc(F)cc1	ZINC001171307079	1384490779	/nfs/dbraw/zinc/49/07/79/1384490779.db2.gz	KPVHSVJEHILQKS-JXFKEZNVSA-N	0	3	345.462	3.231	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1nc(C)oc1C	ZINC001316879202	1384663961	/nfs/dbraw/zinc/66/39/61/1384663961.db2.gz	JREZTPJZDUWLME-SMDDNHRTSA-N	0	3	325.840	3.017	20	30		EGEDHN
CN1[C@@H]2CCC[C@H]1C[C@H](NC1=C(Cl)C(=O)c3ccccc3C1=O)C2	ZINC001172106866	1384728642	/nfs/dbraw/zinc/72/86/42/1384728642.db2.gz	QLZMEVJSIMKUKS-XYYAHUGASA-N	0	3	344.842	3.121	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)N1CC[C@](O)(C(F)(F)F)[C@H](C)C1	ZINC001172316543	1384767895	/nfs/dbraw/zinc/76/78/95/1384767895.db2.gz	ULQWCYXCFBKBDW-XJKCOSOUSA-N	0	3	326.362	3.124	20	30		EGEDHN
C[C@@H](CCCC#N)N1C[C@@H](N(C)Cc2ccco2)[C@H]2OCCC[C@H]2C1	ZINC001172493950	1384804070	/nfs/dbraw/zinc/80/40/70/1384804070.db2.gz	DTSCGONQRBVCTL-XEYPJELSSA-N	0	3	345.487	3.273	20	30		EGEDHN
C[C@H](CCCC#N)N1CCO[C@@H]2C[C@@H](COc3ccccn3)C[C@@H]21	ZINC001172500438	1384806891	/nfs/dbraw/zinc/80/68/91/1384806891.db2.gz	ZKZGSWAKVFLBHR-VSZNYVQBSA-N	0	3	329.444	3.022	20	30		EGEDHN
Cc1cc(C2CCN(C[C@H](O)CC#N)CC2)ccc1Br	ZINC001335837443	1388947866	/nfs/dbraw/zinc/94/78/66/1388947866.db2.gz	AYVJNAWDEKGAKA-OAHLLOKOSA-N	0	3	337.261	3.212	20	30		EGEDHN
N#CCC1(NC2CCN(C(=O)c3ccc(F)cc3)CC2)CCCC1	ZINC001173002254	1384897204	/nfs/dbraw/zinc/89/72/04/1384897204.db2.gz	TVJRXGPYAOJTOD-UHFFFAOYSA-N	0	3	329.419	3.246	20	30		EGEDHN
CCCC1(C(=O)NC[C@H]2CCCN(Cc3cccc(C#N)c3)C2)CC1	ZINC001317135825	1384898910	/nfs/dbraw/zinc/89/89/10/1384898910.db2.gz	RYQSAELYQXNPEL-LJQANCHMSA-N	0	3	339.483	3.467	20	30		EGEDHN
COc1ccc([N+](=O)[O-])c(C[C@@H](C)NCc2csc(C#N)c2)c1F	ZINC001173181792	1384932632	/nfs/dbraw/zinc/93/26/32/1384932632.db2.gz	QMXPPOCMIGOHTF-SNVBAGLBSA-N	0	3	349.387	3.396	20	30		EGEDHN
C[C@@H](CCCCNCc1cc(F)ccc1C#N)NC(=O)[C@H]1C[C@@H]1C	ZINC001174783543	1385148563	/nfs/dbraw/zinc/14/85/63/1385148563.db2.gz	MLUDYVOBFJXSQH-DEYYWGMASA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](C)CCCCNCc2cnns2)CC1	ZINC001175074445	1385190259	/nfs/dbraw/zinc/19/02/59/1385190259.db2.gz	RZGDRWMMNSOEAT-AWEZNQCLSA-N	0	3	336.505	3.049	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)CCCCN[C@H](C)c2nnc(C)[nH]2)CCC1	ZINC001175097388	1385194326	/nfs/dbraw/zinc/19/43/26/1385194326.db2.gz	JHWLABDHNZHVJY-LSDHHAIUSA-N	0	3	347.507	3.185	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H](C)CCCCN[C@@H](C)c2nnc(CC)[nH]2)C1	ZINC001175158987	1385208259	/nfs/dbraw/zinc/20/82/59/1385208259.db2.gz	MLLXVZKFTBYQFM-CABCVRRESA-N	0	3	347.507	3.049	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H](C)CCCCNCc1nccn1CC	ZINC001175469440	1385301514	/nfs/dbraw/zinc/30/15/14/1385301514.db2.gz	QJQNASMBVNNBPT-MRXNPFEDSA-N	0	3	334.508	3.270	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)c1nccs1	ZINC001175848099	1385420979	/nfs/dbraw/zinc/42/09/79/1385420979.db2.gz	LSROCFPZEDLADP-CQSZACIVSA-N	0	3	342.468	3.093	20	30		EGEDHN
C=CC[C@H](C(=O)NCCCNCc1ncc(C)s1)c1ccccc1	ZINC001176697267	1385662274	/nfs/dbraw/zinc/66/22/74/1385662274.db2.gz	IFNOAGSPKIDVIX-KRWDZBQOSA-N	0	3	343.496	3.407	20	30		EGEDHN
C=CC[C@@H](C(=O)NCCCNCc1c(C)noc1C)c1ccccc1	ZINC001176697806	1385662864	/nfs/dbraw/zinc/66/28/64/1385662864.db2.gz	NPYFOHXZBZTHOJ-GOSISDBHSA-N	0	3	341.455	3.247	20	30		EGEDHN
C=CCC1(C(=O)NCCCN[C@H](C)c2cnccn2)CCCCC1	ZINC001176790687	1385700594	/nfs/dbraw/zinc/70/05/94/1385700594.db2.gz	QHUJPNDVOHKBAP-MRXNPFEDSA-N	0	3	330.476	3.160	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)c2ccc(CF)cc2)c1	ZINC001177169576	1385842656	/nfs/dbraw/zinc/84/26/56/1385842656.db2.gz	ODIBFUPSROSPQR-UHFFFAOYSA-N	0	3	343.377	3.077	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)c1cc(C)no1	ZINC001177211926	1385865764	/nfs/dbraw/zinc/86/57/64/1385865764.db2.gz	ZRBQSTHFDZTXSM-UHFFFAOYSA-N	0	3	339.867	3.348	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@@H]1C[C@@H]1OCC	ZINC001177235909	1385879357	/nfs/dbraw/zinc/87/93/57/1385879357.db2.gz	PUNAFYJDZPKDDL-SJORKVTESA-N	0	3	342.911	3.162	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@@H]1CCCOC1	ZINC001177250335	1385884235	/nfs/dbraw/zinc/88/42/35/1385884235.db2.gz	OGKVDWXXRSYDMT-QGZVFWFLSA-N	0	3	342.911	3.164	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@H](OC)C1CC1	ZINC001177304910	1385905423	/nfs/dbraw/zinc/90/54/23/1385905423.db2.gz	OLQUTCOEGNMZSU-QGZVFWFLSA-N	0	3	342.911	3.162	20	30		EGEDHN
Cc1oncc1CNCCCN(CC1CCCC1)C(=O)C#CC(C)C	ZINC001177311935	1385909601	/nfs/dbraw/zinc/90/96/01/1385909601.db2.gz	PWVVMDFFBGITHH-UHFFFAOYSA-N	0	3	345.487	3.141	20	30		EGEDHN
C=C(C)CCC(=O)N(CCCNCc1nccn1C)CC1CCCC1	ZINC001177328577	1385916200	/nfs/dbraw/zinc/91/62/00/1385916200.db2.gz	PKCYLTFIJAQOJO-UHFFFAOYSA-N	0	3	346.519	3.275	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@@H]1CCO[C@@H]1C	ZINC001177448654	1385959597	/nfs/dbraw/zinc/95/95/97/1385959597.db2.gz	QJLREXZNJKCHFG-NVXWUHKLSA-N	0	3	342.911	3.162	20	30		EGEDHN
C=CCC1(C(=O)NCCCNCc2cccc(Cl)n2)CCCC1	ZINC001177552182	1385995178	/nfs/dbraw/zinc/99/51/78/1385995178.db2.gz	AHERQZSNORYFSF-UHFFFAOYSA-N	0	3	335.879	3.467	20	30		EGEDHN
CCO[C@H](CC)C(=O)NCCCCCCNCc1ccccc1C#N	ZINC001177970506	1386098634	/nfs/dbraw/zinc/09/86/34/1386098634.db2.gz	TZJVWUADNHEEKY-LJQANCHMSA-N	0	3	345.487	3.140	20	30		EGEDHN
N#Cc1ccccc1CNCCCCCCNC(=O)/C=C\C1CC1	ZINC001178111553	1386132406	/nfs/dbraw/zinc/13/24/06/1386132406.db2.gz	MKYZVIWKBLQBQC-QXMHVHEDSA-N	0	3	325.456	3.291	20	30		EGEDHN
CC(C)[C@@H](C)CC(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@@H]1C	ZINC001178307833	1386184672	/nfs/dbraw/zinc/18/46/72/1386184672.db2.gz	CEYVKRCYQGBOOB-ZWOKBUDYSA-N	0	3	344.474	3.438	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](NCc2cc(F)ccc2OC)[C@@H]1C	ZINC001178530158	1386241539	/nfs/dbraw/zinc/24/15/39/1386241539.db2.gz	UVOCABHOYHICDR-YJBOKZPZSA-N	0	3	346.446	3.107	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](NCc2cccc(OC)c2Cl)[C@@H]1C	ZINC001178582388	1386255478	/nfs/dbraw/zinc/25/54/78/1386255478.db2.gz	ZCYSXRRQUUEMDK-HOCLYGCPSA-N	0	3	348.874	3.231	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)c1ccoc1Cl	ZINC001178587649	1386256317	/nfs/dbraw/zinc/25/63/17/1386256317.db2.gz	RIUNODGWOGIJAN-YOEHRIQHSA-N	0	3	342.826	3.177	20	30		EGEDHN
CC/C(C)=C/C(=O)N1CC[C@H](NCc2cc(C#N)ccc2OC)[C@@H]1C	ZINC001178637241	1386265690	/nfs/dbraw/zinc/26/56/90/1386265690.db2.gz	MABBUBPZWXMGMD-WLIXIEMPSA-N	0	3	341.455	3.002	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@H](NCc2ccccc2OC(C)C)[C@@H]1C	ZINC001178645150	1386267132	/nfs/dbraw/zinc/26/71/32/1386267132.db2.gz	GIXUZHYMIVGPPI-HKUYNNGSSA-N	0	3	342.483	3.212	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@H](NCc2cccc(Cl)c2F)[C@@H]1C	ZINC001178645468	1386268173	/nfs/dbraw/zinc/26/81/73/1386268173.db2.gz	NLLOECGWGHFOCR-BBRMVZONSA-N	0	3	336.838	3.218	20	30		EGEDHN
C=CCn1cccc1C(=O)NCCCCCCNCc1ocnc1C	ZINC001178702431	1386283068	/nfs/dbraw/zinc/28/30/68/1386283068.db2.gz	PGIQAVTXZBNFNG-UHFFFAOYSA-N	0	3	344.459	3.051	20	30		EGEDHN
COc1ccc(CN2CCC[C@H]2CNc2cccc(C)n2)cc1C#N	ZINC001319823518	1386319159	/nfs/dbraw/zinc/31/91/59/1386319159.db2.gz	OFMFTZRUGGCFNC-SFHVURJKSA-N	0	3	336.439	3.347	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)[C@@H]1CCC(F)(F)C1	ZINC001178844726	1386327118	/nfs/dbraw/zinc/32/71/18/1386327118.db2.gz	VDHDVMVBILGVKG-JQHSSLGASA-N	0	3	346.421	3.053	20	30		EGEDHN
C=C(Br)CN[C@@H](CNC(=O)c1cc(C)cs1)C(C)C	ZINC001319910312	1386384542	/nfs/dbraw/zinc/38/45/42/1386384542.db2.gz	IAJJZCSPBOTAQG-LBPRGKRZSA-N	0	3	345.306	3.309	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCCCCCCNCc1cc(C)n(C)n1	ZINC001179335636	1386454689	/nfs/dbraw/zinc/45/46/89/1386454689.db2.gz	OKVPDIWWLSTMPO-MRXNPFEDSA-N	0	3	334.508	3.097	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@@H]1C	ZINC001179351829	1386460659	/nfs/dbraw/zinc/46/06/59/1386460659.db2.gz	VHCWFGYPPWDHHC-PHTWQNANSA-N	0	3	340.442	3.279	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)[C@@H]1C	ZINC001179384291	1386469068	/nfs/dbraw/zinc/46/90/68/1386469068.db2.gz	IWEGBLJBAJXQQT-DOXZYTNZSA-N	0	3	343.446	3.379	20	30		EGEDHN
C=C1CCC(C(=O)NCCCCCCN[C@@H](C)c2nnc(C)[nH]2)CC1	ZINC001179481205	1386493541	/nfs/dbraw/zinc/49/35/41/1386493541.db2.gz	AAFZDDHNSSXDHF-HNNXBMFYSA-N	0	3	347.507	3.187	20	30		EGEDHN
C=CCCC1(C(=O)NCCCCCCNCc2nccn2CC)CC1	ZINC001179481405	1386494407	/nfs/dbraw/zinc/49/44/07/1386494407.db2.gz	DWKUEKSHJQWFEM-UHFFFAOYSA-N	0	3	346.519	3.416	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)CCc1ccc(C(F)(F)F)cc1	ZINC001180919115	1386898706	/nfs/dbraw/zinc/89/87/06/1386898706.db2.gz	VLIBWDRRMRVLFI-INIZCTEOSA-N	0	3	340.389	3.405	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](C)CNCc2ccc(C#N)s2)ccc1Cl	ZINC001321640170	1386947017	/nfs/dbraw/zinc/94/70/17/1386947017.db2.gz	APIKZPOJGZTOAJ-GFCCVEGCSA-N	0	3	347.871	3.490	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)NC(=O)[C@H](C)c1ccccc1	ZINC001321714200	1386964071	/nfs/dbraw/zinc/96/40/71/1386964071.db2.gz	VDCJPWALNAECJS-ZIAGYGMSSA-N	0	3	327.453	3.018	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](C)[C@](C)(CNCc2oc(C)nc2C)C1	ZINC001181593935	1387021572	/nfs/dbraw/zinc/02/15/72/1387021572.db2.gz	CPUMBHOCWANMCV-JLTOFOAXSA-N	0	3	347.503	3.468	20	30		EGEDHN
CC(C)[C@H](F)C(=O)N1C[C@@H](C)[C@](C)(CNCc2ccccc2C#N)C1	ZINC001182275950	1387135556	/nfs/dbraw/zinc/13/55/56/1387135556.db2.gz	FKVBEWOWNOSAJD-MOXGXCLJSA-N	0	3	345.462	3.127	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)CC(C)(C)c1ccc(OC)cc1	ZINC001182440531	1387166967	/nfs/dbraw/zinc/16/69/67/1387166967.db2.gz	JNLKKKUENOEUAP-KRWDZBQOSA-N	0	3	330.472	3.130	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](NCc2cn(C(C)C)nc2C)C1	ZINC001182894440	1387241172	/nfs/dbraw/zinc/24/11/72/1387241172.db2.gz	XLUBFMDJXFPQBF-QGZVFWFLSA-N	0	3	332.492	3.065	20	30		EGEDHN
Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@H]1N2C(=O)c1ccc(C#N)cc1F	ZINC001337475103	1389362004	/nfs/dbraw/zinc/36/20/04/1389362004.db2.gz	PATSJHLLVNNMRC-FXAWDEMLSA-N	0	3	349.409	3.454	20	30		EGEDHN
N#CC1(c2ccccc2)CC(NCc2n[nH]c(-c3ccccc3)n2)C1	ZINC001338632920	1389719332	/nfs/dbraw/zinc/71/93/32/1389719332.db2.gz	ZBBZOARXHVMZFI-UHFFFAOYSA-N	0	3	329.407	3.185	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccc(OCc2ccncc2)cc1	ZINC001340077569	1390221960	/nfs/dbraw/zinc/22/19/60/1390221960.db2.gz	QHTYPLDBXVZLTM-GOSISDBHSA-N	0	3	325.412	3.283	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1cc(-c2nc(CC)no2)ccc1C	ZINC001340123070	1390231226	/nfs/dbraw/zinc/23/12/26/1390231226.db2.gz	SXIQYIMGAHTIHD-AWEZNQCLSA-N	0	3	328.416	3.230	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N(Cc1ccccc1)CC1CCOCC1	ZINC001340701965	1390348249	/nfs/dbraw/zinc/34/82/49/1390348249.db2.gz	RKNWDOFEKZZPHP-LJQANCHMSA-N	0	3	330.472	3.125	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)Nc1ccc2c(c1)OCC(=O)N2C	ZINC001340987611	1390420195	/nfs/dbraw/zinc/42/01/95/1390420195.db2.gz	XCOBBDODSGZTAK-OAHLLOKOSA-N	0	3	347.459	3.058	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N1CCC[C@@H](c2cncn2C(C)(C)C)C1	ZINC001342754947	1390650195	/nfs/dbraw/zinc/65/01/95/1390650195.db2.gz	NFTFLHOATYNHEY-CVEARBPZSA-N	0	3	332.492	3.028	20	30		EGEDHN
Cn1ccnc1C(C#N)C(=O)CCc1ccccc1OC(F)(F)F	ZINC001342924113	1390673134	/nfs/dbraw/zinc/67/31/34/1390673134.db2.gz	JVEIELPOEQXQPY-LBPRGKRZSA-N	0	3	337.301	3.128	20	30		EGEDHN
N#CC(C(=O)CC[C@H]1CCCCO1)c1nccn1Cc1ccccc1	ZINC001342924803	1390673365	/nfs/dbraw/zinc/67/33/65/1390673365.db2.gz	NZNMSBYYTANSHX-MSOLQXFVSA-N	0	3	337.423	3.457	20	30		EGEDHN
COc1ccc(OC(C)(C)C(=O)C(C#N)c2cccc(F)n2)cc1	ZINC001343384671	1390710383	/nfs/dbraw/zinc/71/03/83/1390710383.db2.gz	IDWBJDKYRYPDSB-CQSZACIVSA-N	0	3	328.343	3.263	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCCCOc1cccc(C#N)c1	ZINC001344325758	1390782375	/nfs/dbraw/zinc/78/23/75/1390782375.db2.gz	JHSVGGDHCSGCLS-KRWDZBQOSA-N	0	3	336.395	3.200	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)[C@H]1C[C@H]1c1cc(F)c(F)c(F)c1	ZINC001346095201	1390907061	/nfs/dbraw/zinc/90/70/61/1390907061.db2.gz	AKHXWZCGCNXHFY-SDDRHHMPSA-N	0	3	333.313	3.300	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)C2(C)CCC2)CCCC1	ZINC001698800270	1406474201	/nfs/dbraw/zinc/47/42/01/1406474201.db2.gz	JCIGGQLYBASKOM-UHFFFAOYSA-N	0	3	329.282	3.104	20	30		EGEDHN
CC(C)(C)C(=O)NCC1(NCc2cc(C#N)ccc2F)CCCC1	ZINC001698805556	1406486288	/nfs/dbraw/zinc/48/62/88/1406486288.db2.gz	HNFSCTFHVWNQTN-UHFFFAOYSA-N	0	3	331.435	3.262	20	30		EGEDHN
Cc1coc(C)c1C(=O)N(C)[C@@H](C)CNCc1ccc(C#N)s1	ZINC001698822314	1406514361	/nfs/dbraw/zinc/51/43/61/1406514361.db2.gz	KYPAZZRXKYFXAD-LBPRGKRZSA-N	0	3	331.441	3.080	20	30		EGEDHN
C#CC[C@H](CC)c1nnc(N2CCN([C@H](C)CC)CC2)n1CC1CC1	ZINC001351432740	1391639200	/nfs/dbraw/zinc/63/92/00/1391639200.db2.gz	CWKGSZXDELOUJG-AEFFLSMTSA-N	0	3	343.519	3.126	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@H](CNC(=O)CC3CCCC3)C2)c1	ZINC001488810748	1391727697	/nfs/dbraw/zinc/72/76/97/1391727697.db2.gz	YMPXQHSPZLXEFK-SAABIXHNSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N1CCC[C@@H](c2nc3c(s2)CCC3)C1	ZINC001354842109	1392172280	/nfs/dbraw/zinc/17/22/80/1392172280.db2.gz	RXQCEEALRVDCAX-KGLIPLIRSA-N	0	3	333.501	3.021	20	30		EGEDHN
Cc1cc(Cl)cc(C(=O)NC[C@H](C)NCc2ccc(C#N)s2)c1	ZINC001480503600	1392771959	/nfs/dbraw/zinc/77/19/59/1392771959.db2.gz	VASSPUWHMDYUAZ-LBPRGKRZSA-N	0	3	347.871	3.490	20	30		EGEDHN
C[C@@H](CNC(=O)CCCC(F)(F)F)NCc1ccc(F)c(C#N)c1	ZINC001480540437	1392784819	/nfs/dbraw/zinc/78/48/19/1392784819.db2.gz	RRSJMSVZGYTMKP-NSHDSACASA-N	0	3	345.340	3.024	20	30		EGEDHN
C[C@H](CNC(=O)c1coc2ccccc21)NCc1ccc(C#N)s1	ZINC001480605201	1392817310	/nfs/dbraw/zinc/81/73/10/1392817310.db2.gz	VPCIDPVUAXNTEH-GFCCVEGCSA-N	0	3	339.420	3.274	20	30		EGEDHN
C=C(Br)CN[C@@H](C)CCNC(=O)c1ccoc1CCC	ZINC001480804143	1392944278	/nfs/dbraw/zinc/94/42/78/1392944278.db2.gz	PUJUMJLNMPGHGT-LBPRGKRZSA-N	0	3	343.265	3.239	20	30		EGEDHN
CCN(CCNC(=O)Cc1cccc(C)c1)Cc1ccc(C#N)cc1	ZINC001480996549	1393075929	/nfs/dbraw/zinc/07/59/29/1393075929.db2.gz	APCFAHMHWAGOSG-UHFFFAOYSA-N	0	3	335.451	3.048	20	30		EGEDHN
CCCN(CCNC(=O)CCC(F)(F)F)Cc1ccc(C#N)cc1	ZINC001481132924	1393128790	/nfs/dbraw/zinc/12/87/90/1393128790.db2.gz	FBHLYWCHSXPCJV-UHFFFAOYSA-N	0	3	341.377	3.229	20	30		EGEDHN
C=CCCCN1CCC[C@H](NC(=O)c2noc3c2CCCCC3)C1	ZINC001481537487	1394397024	/nfs/dbraw/zinc/39/70/24/1394397024.db2.gz	HMCOCYRDMRTKPB-HNNXBMFYSA-N	0	3	331.460	3.104	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2sccc2OC)CCCC1	ZINC001481911638	1394592492	/nfs/dbraw/zinc/59/24/92/1394592492.db2.gz	KKYOFJZPSMIRDU-UHFFFAOYSA-N	0	3	328.865	3.141	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2oncc2C)CCCC[C@@H]1C	ZINC001481959849	1394620870	/nfs/dbraw/zinc/62/08/70/1394620870.db2.gz	CTNZZUNBNUUVOE-LRDDRELGSA-N	0	3	325.840	3.004	20	30		EGEDHN
CCCN(CCNC(=O)[C@@H](C)C#N)Cc1ccc(C(C)C)nc1C	ZINC001493280722	1396339071	/nfs/dbraw/zinc/33/90/71/1396339071.db2.gz	OLBCKIDEBTVXQI-HNNXBMFYSA-N	0	3	330.476	3.001	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cn(C)c2ccccc12)C(C)C	ZINC001496577358	1396717558	/nfs/dbraw/zinc/71/75/58/1396717558.db2.gz	DERCDFWOWGGQML-MRXNPFEDSA-N	0	3	333.863	3.275	20	30		EGEDHN
CCc1ccc(C(=O)N[C@H](C)CNCc2ccc(C#N)s2)cc1	ZINC001497975044	1396898145	/nfs/dbraw/zinc/89/81/45/1396898145.db2.gz	KRQAVRVPXYLBGF-CYBMUJFWSA-N	0	3	327.453	3.090	20	30		EGEDHN
CCC1(C(=O)N[C@@H](C)[C@H]2CCCN(Cc3cccc(C#N)c3)C2)CC1	ZINC001690501233	1404614244	/nfs/dbraw/zinc/61/42/44/1404614244.db2.gz	IGARRYKXGNNAJA-LPHOPBHVSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@H](CNC(=O)C1CCC(C)(C)CC1)NCc1ccc(C#N)s1	ZINC001690652862	1404684545	/nfs/dbraw/zinc/68/45/45/1404684545.db2.gz	WQLFDGPBRWYNAJ-CYBMUJFWSA-N	0	3	333.501	3.430	20	30		EGEDHN
C[C@@H](CNC(=O)C1CCC(C)(C)CC1)NCc1ccc(C#N)s1	ZINC001690652863	1404684361	/nfs/dbraw/zinc/68/43/61/1404684361.db2.gz	WQLFDGPBRWYNAJ-ZDUSSCGKSA-N	0	3	333.501	3.430	20	30		EGEDHN
C[C@@H](CCNC(=O)c1cccc(F)c1)NCc1cc(C#N)ccc1F	ZINC001690829995	1404765502	/nfs/dbraw/zinc/76/55/02/1404765502.db2.gz	NWPPPRHJXKKQBB-ZDUSSCGKSA-N	0	3	343.377	3.135	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1cc2c(cccc2OC)[nH]1	ZINC001690880009	1404794004	/nfs/dbraw/zinc/79/40/04/1404794004.db2.gz	YAXPGSROLCVGPA-LBPRGKRZSA-N	0	3	335.835	3.027	20	30		EGEDHN
CCN(CCNC(=O)c1cc(C)c(C)o1)Cc1ccc(C#N)cc1	ZINC001691013806	1404928606	/nfs/dbraw/zinc/92/86/06/1404928606.db2.gz	ADXNKNLJVGCQOD-UHFFFAOYSA-N	0	3	325.412	3.020	20	30		EGEDHN
C[C@H](C(=O)NC[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1)C(C)(C)C	ZINC001691100712	1405039957	/nfs/dbraw/zinc/03/99/57/1405039957.db2.gz	BMJSEHIFNKPROK-UNEWFSDZSA-N	0	3	345.462	3.364	20	30		EGEDHN
CC[C@H](C)CC(=O)NC[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001691494747	1405302279	/nfs/dbraw/zinc/30/22/79/1405302279.db2.gz	KHZWDUVNRHAWGD-QRTARXTBSA-N	0	3	331.435	3.118	20	30		EGEDHN
CC1(C(=O)NC[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)CCCC1	ZINC001691800660	1405514303	/nfs/dbraw/zinc/51/43/03/1405514303.db2.gz	UDZPOGBIPMBQMO-JCNLHEQBSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)CCc2ccncc2)CCCC[C@@H]1C	ZINC001732261172	1428501326	/nfs/dbraw/zinc/50/13/26/1428501326.db2.gz	XGXHZCUPQGXLDB-HNAYVOBHSA-N	0	3	349.906	3.421	20	30		EGEDHN
Cc1ccc(C)c(C(=O)NC[C@H](C)CNCc2ccccc2C#N)c1	ZINC001732369417	1428551655	/nfs/dbraw/zinc/55/16/55/1428551655.db2.gz	JWDKTGZBOQPKOA-MRXNPFEDSA-N	0	3	335.451	3.331	20	30		EGEDHN
CCCC1(C(=O)N[C@@H](C)CNCc2cc(C#N)ccc2OC)CCC1	ZINC001699418648	1412732720	/nfs/dbraw/zinc/73/27/20/1412732720.db2.gz	ZQNKHVFPYNPVPV-HNNXBMFYSA-N	0	3	343.471	3.132	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)C(C)(C)C1CCC1	ZINC001699452490	1412794416	/nfs/dbraw/zinc/79/44/16/1412794416.db2.gz	JEMSLKBXRKUCTG-HNNXBMFYSA-N	0	3	327.472	3.321	20	30		EGEDHN
CCC(C)(CC)C(=O)N[C@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001699602573	1412964710	/nfs/dbraw/zinc/96/47/10/1412964710.db2.gz	MYVKXMOWUZXHHS-MRXNPFEDSA-N	0	3	333.501	3.430	20	30		EGEDHN
CC(C)c1ccccc1CNC1(CNC(=O)c2cc(C#N)c[nH]2)CC1	ZINC001699648903	1413030908	/nfs/dbraw/zinc/03/09/08/1413030908.db2.gz	IQNGNZWAGPXRTN-UHFFFAOYSA-N	0	3	336.439	3.062	20	30		EGEDHN
CC(F)(F)CC(=O)N[C@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC001700181725	1413595465	/nfs/dbraw/zinc/59/54/65/1413595465.db2.gz	ZAIPEWALNBPWCF-INIZCTEOSA-N	0	3	335.398	3.074	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)COc1ccccc1F	ZINC001700448759	1414028045	/nfs/dbraw/zinc/02/80/45/1414028045.db2.gz	XRUUWZWUFSSCDO-UHFFFAOYSA-N	0	3	342.842	3.031	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCC[C@H]1NC(=O)CCC1CC1	ZINC001732615085	1428878152	/nfs/dbraw/zinc/87/81/52/1428878152.db2.gz	IRMKQYUBJWVGSN-RBUKOAKNSA-N	0	3	325.456	3.123	20	30		EGEDHN
CCc1ccccc1C(=O)N[C@@H](C)CNCc1ccc(C#N)s1	ZINC001733008930	1429128775	/nfs/dbraw/zinc/12/87/75/1429128775.db2.gz	BZJBLLWJQKILIB-ZDUSSCGKSA-N	0	3	327.453	3.090	20	30		EGEDHN
CC[C@H](C)CCC(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2OC)C1	ZINC001713171264	1417744554	/nfs/dbraw/zinc/74/45/54/1417744554.db2.gz	FYNPCOJDEJIGMQ-WBAXXEDZSA-N	0	3	343.471	3.130	20	30		EGEDHN
CC1(C(=O)NC[C@H]2CCN(Cc3ccc(C#N)cc3)C2)CCCCC1	ZINC001713535995	1418289692	/nfs/dbraw/zinc/28/96/92/1418289692.db2.gz	OBUMANBNTYIXHY-LJQANCHMSA-N	0	3	339.483	3.467	20	30		EGEDHN
CCCN(CCNC(=O)CC1CCCC1)Cc1ccc(C#N)cc1	ZINC001713545803	1418313949	/nfs/dbraw/zinc/31/39/49/1418313949.db2.gz	NOAZNTLTNSNLMK-UHFFFAOYSA-N	0	3	327.472	3.467	20	30		EGEDHN
CC(C)SCC(=O)NCC[C@@H]1CCN(Cc2ccccc2C#N)C1	ZINC001713725003	1418503549	/nfs/dbraw/zinc/50/35/49/1418503549.db2.gz	OWZJGIQMJPCSTD-MRXNPFEDSA-N	0	3	345.512	3.028	20	30		EGEDHN
CC(C)(C)CC(=O)N[C@H]1CC12CCN(Cc1cccc(C#N)c1)CC2	ZINC001713843766	1418640510	/nfs/dbraw/zinc/64/05/10/1418640510.db2.gz	MODLJBONVTXRSE-SFHVURJKSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@H](CNC(=O)c1cccc2cc[nH]c21)NCc1ccc(C#N)s1	ZINC001714276104	1419056255	/nfs/dbraw/zinc/05/62/55/1419056255.db2.gz	ZXYYBEOUIUCXLM-GFCCVEGCSA-N	0	3	338.436	3.009	20	30		EGEDHN
Cc1oc(C)c(C(=O)NCC[C@@H](C)NCc2ccccc2C#N)c1C	ZINC001714478097	1419201558	/nfs/dbraw/zinc/20/15/58/1419201558.db2.gz	PQDYAIZBXREYLX-CYBMUJFWSA-N	0	3	339.439	3.375	20	30		EGEDHN
CCCC1(C(=O)N(C)[C@@H](C)CNCc2ccc(F)c(C#N)c2)CC1	ZINC001714745499	1419491455	/nfs/dbraw/zinc/49/14/55/1419491455.db2.gz	IIJQLXYOWCUGFA-AWEZNQCLSA-N	0	3	331.435	3.214	20	30		EGEDHN
CCC(=O)N[C@]1(CNCc2cc(C#N)ccc2OC)CCCC[C@@H]1C	ZINC001715128605	1419876621	/nfs/dbraw/zinc/87/66/21/1419876621.db2.gz	MWCOLLAXDNWRKC-YWZLYKJASA-N	0	3	343.471	3.132	20	30		EGEDHN
CC(C)C(=O)N1CCC(CCN(C)Cc2cc(C#N)ccc2F)CC1	ZINC001715471864	1420151285	/nfs/dbraw/zinc/15/12/85/1420151285.db2.gz	QNNYBNBUWPKWNC-UHFFFAOYSA-N	0	3	345.462	3.414	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)NC(=O)c1ccc2cc[nH]c2c1	ZINC001716413810	1420643444	/nfs/dbraw/zinc/64/34/44/1420643444.db2.gz	FETADFMVVIGTPD-GFCCVEGCSA-N	0	3	338.436	3.009	20	30		EGEDHN
Cc1csc(C(=O)NCC2(NCc3ccc(F)c(C#N)c3)CC2)c1	ZINC001716680111	1420835374	/nfs/dbraw/zinc/83/53/74/1420835374.db2.gz	MJSYKSFXIKMCEU-UHFFFAOYSA-N	0	3	343.427	3.120	20	30		EGEDHN
C[C@H](C#N)C(=O)NCc1ccc2c(c1)CN(CCCC1CCC1)C2	ZINC001724923420	1425311599	/nfs/dbraw/zinc/31/15/99/1425311599.db2.gz	ZJKMBHJISHAJNV-OAHLLOKOSA-N	0	3	325.456	3.358	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1ccc(OC)c(C)c1	ZINC001725146741	1425629285	/nfs/dbraw/zinc/62/92/85/1425629285.db2.gz	MIMWYLMCGYKNEO-UHFFFAOYSA-N	0	3	338.879	3.444	20	30		EGEDHN
Cc1cc(C)c(C(=O)NC[C@@H](C)N(C)Cc2ccc(C#N)cc2)o1	ZINC001725166647	1425671274	/nfs/dbraw/zinc/67/12/74/1425671274.db2.gz	ZETQPZPEGGUTJN-CQSZACIVSA-N	0	3	325.412	3.018	20	30		EGEDHN
C[C@H]1C[C@@H](NCc2ccc(C#N)s2)CN1C(=O)CCC(F)(F)F	ZINC001725580089	1426235755	/nfs/dbraw/zinc/23/57/55/1426235755.db2.gz	FJSPHKAWQCTMMB-WDEREUQCSA-N	0	3	345.390	3.041	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1cc(F)c(F)c(F)c1F	ZINC001731738981	1427823342	/nfs/dbraw/zinc/82/33/42/1427823342.db2.gz	BFBPKASZQJQECR-QMMMGPOBSA-N	0	3	338.732	3.094	20	30		EGEDHN
CCN(CCNC(=O)c1ccc2[nH]ccc2c1)Cc1ccc(C#N)cc1	ZINC001731810273	1427990232	/nfs/dbraw/zinc/99/02/32/1427990232.db2.gz	YUHQYLCRWGVYSO-UHFFFAOYSA-N	0	3	346.434	3.291	20	30		EGEDHN
CCN(CCNC(=O)[C@@H](C)c1ccsc1)Cc1ccc(C#N)cc1	ZINC001731810693	1427991889	/nfs/dbraw/zinc/99/18/89/1427991889.db2.gz	HFRZZZOKYUSVNC-HNNXBMFYSA-N	0	3	341.480	3.362	20	30		EGEDHN
CC(C)SCC(=O)N[C@H]1CCN(Cc2cccc(C#N)c2)[C@H](C)C1	ZINC001733895241	1437712732	/nfs/dbraw/zinc/71/27/32/1437712732.db2.gz	OTPCXYRMOGSYAI-QAPCUYQASA-N	0	3	345.512	3.169	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1cc2ccccc2nc1C	ZINC001733905122	1437723431	/nfs/dbraw/zinc/72/34/31/1437723431.db2.gz	NEXRELXIXCWMAK-ZDUSSCGKSA-N	0	3	331.847	3.394	20	30		EGEDHN
C[C@H](CNC(=O)c1ccnc(C2CC2)c1)N(C)Cc1cccc(C#N)c1	ZINC001734046271	1437835086	/nfs/dbraw/zinc/83/50/86/1437835086.db2.gz	YDMYGEYWHNMERN-OAHLLOKOSA-N	0	3	348.450	3.081	20	30		EGEDHN
Cc1cc(C(=O)N(C)C[C@H](C)NCc2ccc(C#N)s2)c(C)o1	ZINC001734315416	1438045008	/nfs/dbraw/zinc/04/50/08/1438045008.db2.gz	UBCSGCJTIQDZLP-NSHDSACASA-N	0	3	331.441	3.080	20	30		EGEDHN
C=C(C)CCC(=O)N1CCCC[C@H]1[C@@H](C)NCc1cnc(C)nc1	ZINC001752145017	1440145569	/nfs/dbraw/zinc/14/55/69/1440145569.db2.gz	FDQISYLKOZJZFV-QAPCUYQASA-N	0	3	330.476	3.001	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)CN(C)c1ccccc1	ZINC001752153903	1440146404	/nfs/dbraw/zinc/14/64/04/1440146404.db2.gz	ADDIXZZXBKWCIT-AEFFLSMTSA-N	0	3	349.906	3.235	20	30		EGEDHN
C=CCOCC(=O)N(C)C1CCN([C@H](C)c2ccc(F)cc2)CC1	ZINC001752294933	1440166772	/nfs/dbraw/zinc/16/67/72/1440166772.db2.gz	KJYFWGCLIBPKBA-OAHLLOKOSA-N	0	3	334.435	3.012	20	30		EGEDHN
CCC(CC)CC(=O)NC[C@H](NCC#Cc1ccc(F)cc1)C1CC1	ZINC001752490367	1440186519	/nfs/dbraw/zinc/18/65/19/1440186519.db2.gz	KRQDAPXJVITFFN-FQEVSTJZSA-N	0	3	344.474	3.488	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)c1cc2cnccc2o1	ZINC001752538410	1440194538	/nfs/dbraw/zinc/19/45/38/1440194538.db2.gz	KGZDYDKNPLYSGS-OIISXLGYSA-N	0	3	339.439	3.471	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)N[C@H]2C[C@H](NCC#Cc3cccc(Cl)c3)C2)C1	ZINC001752670488	1440198952	/nfs/dbraw/zinc/19/89/52/1440198952.db2.gz	YKFDAZIQCBMJSW-CBVHJVASSA-N	0	3	344.886	3.365	20	30		EGEDHN
CC[C@H](SC)C(=O)NC[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001752780213	1440208610	/nfs/dbraw/zinc/20/86/10/1440208610.db2.gz	UPHVIZICMMOODL-ROUUACIJSA-N	0	3	345.512	3.028	20	30		EGEDHN
C[C@@H](C(=O)NC[C@@H]1CCCN(Cc2ccc(C#N)cc2)C1)C(C)(F)F	ZINC001752786944	1440211656	/nfs/dbraw/zinc/21/16/56/1440211656.db2.gz	CMDKLIGCWGUXEL-YOEHRIQHSA-N	0	3	349.425	3.178	20	30		EGEDHN
C#CCCCCC(=O)N1CCC[C@H](CNCc2csc(CC)n2)C1	ZINC001752796425	1440214495	/nfs/dbraw/zinc/21/44/95/1440214495.db2.gz	MIEOQSOPFOPWTG-MRXNPFEDSA-N	0	3	347.528	3.227	20	30		EGEDHN
C=CCN1CCCC[C@@H]1CNC(=O)Cc1coc2cc(F)ccc12	ZINC001752819379	1440219353	/nfs/dbraw/zinc/21/93/53/1440219353.db2.gz	USOOPDQJQXORSO-MRXNPFEDSA-N	0	3	330.403	3.271	20	30		EGEDHN
C=CCN1CCCC[C@@H]1CNC(=O)CCCOc1ccc(C)cc1	ZINC001752824867	1440223103	/nfs/dbraw/zinc/22/31/03/1440223103.db2.gz	GASADPVOIACQGC-GOSISDBHSA-N	0	3	330.472	3.311	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)Cc2ccc(CC(C)C)cc2)C1	ZINC001752837386	1440228406	/nfs/dbraw/zinc/22/84/06/1440228406.db2.gz	SRFYYFRCHGRCLG-NQIIRXRSSA-N	0	3	340.511	3.278	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)Cc2ccc(CC(C)C)cc2)C1	ZINC001752837385	1440228497	/nfs/dbraw/zinc/22/84/97/1440228497.db2.gz	SRFYYFRCHGRCLG-GHTZIAJQSA-N	0	3	340.511	3.278	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)[C@@H](C)CCC)CC1	ZINC001752849084	1440233087	/nfs/dbraw/zinc/23/30/87/1440233087.db2.gz	XJILGOZFWTVSGX-XGNXJENSSA-N	0	3	331.298	3.348	20	30		EGEDHN
C[C@H](CNC(=O)c1csc(Cl)c1)NCc1ccc(C#N)s1	ZINC001752902872	1440243478	/nfs/dbraw/zinc/24/34/78/1440243478.db2.gz	IYCXKLFTZOJWLS-SECBINFHSA-N	0	3	339.873	3.243	20	30		EGEDHN
Cc1csc(CN[C@H]2CCC[C@H](NC(=O)C#CC(C)(C)C)C2)n1	ZINC001752970032	1440254810	/nfs/dbraw/zinc/25/48/10/1440254810.db2.gz	XAFNYMLMGGUMOU-GJZGRUSLSA-N	0	3	333.501	3.018	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1CCC[C@H](NCc2ccn(C(C)C)n2)C1	ZINC001752976027	1440256070	/nfs/dbraw/zinc/25/60/70/1440256070.db2.gz	IHTICQXYJNNWEU-IRXDYDNUSA-N	0	3	332.492	3.337	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC[C@@H](N(C)CCc2ccns2)C1	ZINC001752992841	1440260173	/nfs/dbraw/zinc/26/01/73/1440260173.db2.gz	UMXNAMMDUMQJHZ-QGZVFWFLSA-N	0	3	347.528	3.377	20	30		EGEDHN
CC#CCN(C)[C@H]1CCCN(C(=O)c2ccc(-n3cccc3)cc2)C1	ZINC001752993658	1440260772	/nfs/dbraw/zinc/26/07/72/1440260772.db2.gz	LAKSTXOPYDRICA-FQEVSTJZSA-N	0	3	335.451	3.037	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1CCCNC(=O)c1cc2occc2[nH]1	ZINC001753027334	1440271763	/nfs/dbraw/zinc/27/17/63/1440271763.db2.gz	IRHANSQEILMGHP-ZDUSSCGKSA-N	0	3	335.835	3.488	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H]1CCN(Cc2ccc(C#N)cc2)C1	ZINC001753131481	1440316834	/nfs/dbraw/zinc/31/68/34/1440316834.db2.gz	WFSOZKQMUKDDHH-SFHVURJKSA-N	0	3	325.456	3.099	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)CCCc2cc(C)sc2C)C1	ZINC001753140619	1440320878	/nfs/dbraw/zinc/32/08/78/1440320878.db2.gz	OYCPJKCOSVHXKQ-QGZVFWFLSA-N	0	3	332.513	3.149	20	30		EGEDHN
CCCN(CCNC(=O)C1CC(C)(C)C1)Cc1cccc(C#N)c1	ZINC001753143829	1440323141	/nfs/dbraw/zinc/32/31/41/1440323141.db2.gz	AUBYYGQKMVQSRV-UHFFFAOYSA-N	0	3	327.472	3.323	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)NCCCN(CC#Cc1ccccc1)C(C)C	ZINC001753301059	1440354044	/nfs/dbraw/zinc/35/40/44/1440354044.db2.gz	WBYUBYHWLBZTDZ-WOJBJXKFSA-N	0	3	326.484	3.301	20	30		EGEDHN
C=CCOCCN1CC[C@@H](N(CCC)C(=O)c2ccc(F)cc2C)C1	ZINC001753319444	1440362237	/nfs/dbraw/zinc/36/22/37/1440362237.db2.gz	FEJKXEUUZSUBSO-GOSISDBHSA-N	0	3	348.462	3.263	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CCC)C(=O)C[C@H](C)n2nc(C)cc2C)C1	ZINC001753321758	1440364025	/nfs/dbraw/zinc/36/40/25/1440364025.db2.gz	DLOVBLXLRUSHGI-RBUKOAKNSA-N	0	3	346.519	3.340	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CCC)C(=O)[C@H](C)c2cccc(OC)c2)C1	ZINC001753323133	1440364903	/nfs/dbraw/zinc/36/49/03/1440364903.db2.gz	LVTPYXTUSUIDCG-IEBWSBKVSA-N	0	3	342.483	3.135	20	30		EGEDHN
COCC#CCN1CC[C@@H](CCNC(=O)C[C@H]2CCCCC2(C)C)C1	ZINC001753341361	1440375793	/nfs/dbraw/zinc/37/57/93/1440375793.db2.gz	WHKWFYLFKMSOEA-RTBURBONSA-N	0	3	348.531	3.071	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@H](CN(C)[C@@H](C)c2ccc(F)cc2F)C1	ZINC001753349542	1440377124	/nfs/dbraw/zinc/37/71/24/1440377124.db2.gz	RBWLJQSTHGSEJT-JKSUJKDBSA-N	0	3	348.437	3.466	20	30		EGEDHN
CC#CCCCC(=O)N1CCC(CN(C)Cc2oc(C)nc2C)CC1	ZINC001753364414	1440384231	/nfs/dbraw/zinc/38/42/31/1440384231.db2.gz	BRXNLJGVFZCXMB-UHFFFAOYSA-N	0	3	345.487	3.155	20	30		EGEDHN
C[C@@H](c1ccc2ccccc2c1)N1CC(CNC(=O)C#CC2CC2)C1	ZINC001753401482	1440391082	/nfs/dbraw/zinc/39/10/82/1440391082.db2.gz	HFTFEIRWGKHCTD-INIZCTEOSA-N	0	3	332.447	3.362	20	30		EGEDHN
C=CC[C@@H](C(=O)NCC1CN(CC2CC(F)(F)C2)C1)c1ccccc1	ZINC001753416747	1440394531	/nfs/dbraw/zinc/39/45/31/1440394531.db2.gz	FYYONBATHMWRAX-GOSISDBHSA-N	0	3	348.437	3.440	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H]2C[C@H]1CN2C(=O)c1c(C)noc1C(C)C	ZINC001753421980	1440395662	/nfs/dbraw/zinc/39/56/62/1440395662.db2.gz	DXVHEFIDVQQNNT-BPUTZDHNSA-N	0	3	331.460	3.360	20	30		EGEDHN
C=C(C)CCC(=O)N(C)[C@H]1CCN(CCOc2ccccc2C)C1	ZINC001753437441	1440400476	/nfs/dbraw/zinc/40/04/76/1440400476.db2.gz	WIIWSKZFOJPSQK-SFHVURJKSA-N	0	3	330.472	3.263	20	30		EGEDHN
C=CCOCCN1CC[C@H](N(C)C(=O)C[C@H](C)c2cccc(F)c2)C1	ZINC001753444863	1440403290	/nfs/dbraw/zinc/40/32/90/1440403290.db2.gz	ZSDWUWWOXHXRAA-LPHOPBHVSA-N	0	3	348.462	3.055	20	30		EGEDHN
C=CCOCCN1CC[C@@H](N(CC)C(=O)c2cc(C)cc(C)c2)C1	ZINC001753462467	1440411342	/nfs/dbraw/zinc/41/13/42/1440411342.db2.gz	WXMQXQSHKRRDNQ-LJQANCHMSA-N	0	3	330.472	3.042	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)CCCc2sccc2C)C1	ZINC001753462629	1440411579	/nfs/dbraw/zinc/41/15/79/1440411579.db2.gz	YDTCYWSAYOETGJ-QGZVFWFLSA-N	0	3	332.513	3.325	20	30		EGEDHN
CC[C@H](CNC(=O)[C@@H](C)C1CC1)NCC#Cc1ccccc1Cl	ZINC001753469102	1440413530	/nfs/dbraw/zinc/41/35/30/1440413530.db2.gz	TZBUXQLKTKAYJC-WMLDXEAASA-N	0	3	332.875	3.222	20	30		EGEDHN
CC[C@@H](CNC(=O)c1cc(F)cc(F)c1)NCC#Cc1ccccc1	ZINC001753493236	1440420482	/nfs/dbraw/zinc/42/04/82/1440420482.db2.gz	HRBSGOPOEULPAA-IBGZPJMESA-N	0	3	342.389	3.115	20	30		EGEDHN
CC[C@@H](CNC(=O)c1cccc2c1CCC2)NCC#Cc1ccccc1	ZINC001753498687	1440422581	/nfs/dbraw/zinc/42/25/81/1440422581.db2.gz	XKGMQDHFRVBZQY-FQEVSTJZSA-N	0	3	346.474	3.325	20	30		EGEDHN
CC(C)SCC(=O)NC1(CNCC#Cc2ccccc2)CCCC1	ZINC001753500246	1440423014	/nfs/dbraw/zinc/42/30/14/1440423014.db2.gz	YITNGFWXAKKTHH-UHFFFAOYSA-N	0	3	344.524	3.198	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC[C@H](CCNCc2cc(C#N)ccc2F)C1	ZINC001753541985	1440433694	/nfs/dbraw/zinc/43/36/94/1440433694.db2.gz	YOWZWIQECMGCRY-HZPDHXFCSA-N	0	3	345.462	3.462	20	30		EGEDHN
C#CCCCCC(=O)N1CCC[C@H](CCNCc2ncc(C)s2)C1	ZINC001753543299	1440433835	/nfs/dbraw/zinc/43/38/35/1440433835.db2.gz	GMVSRGDRMSHCAN-QGZVFWFLSA-N	0	3	347.528	3.363	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H](CCNCc2ccncc2Cl)C1	ZINC001753546606	1440434297	/nfs/dbraw/zinc/43/42/97/1440434297.db2.gz	OSPXSAPHQYGFCW-INIZCTEOSA-N	0	3	347.890	3.257	20	30		EGEDHN
CC1(C(=O)N2CCC[C@@H](CCNCc3ccccc3C#N)C2)CCC1	ZINC001753552800	1440435404	/nfs/dbraw/zinc/43/54/04/1440435404.db2.gz	HNAHBIXFVOHJKW-KRWDZBQOSA-N	0	3	339.483	3.467	20	30		EGEDHN
C#Cc1ccc(C(=O)NCc2ccc(CNC/C=C\Cl)cc2)cc1	ZINC001753589968	1440442607	/nfs/dbraw/zinc/44/26/07/1440442607.db2.gz	UZWINBDKEXXMTH-BASWHVEKSA-N	0	3	338.838	3.440	20	30		EGEDHN
C#CCNCc1ccc(CNC(=O)C2(CCc3ccccc3)CC2)cc1	ZINC001753592459	1440443226	/nfs/dbraw/zinc/44/32/26/1440443226.db2.gz	OBOSZWCTALDXHR-UHFFFAOYSA-N	0	3	346.474	3.439	20	30		EGEDHN
C#CCNCc1ccc(CNC(=O)c2cc3ccccc3n2CC)cc1	ZINC001753592301	1440443239	/nfs/dbraw/zinc/44/32/39/1440443239.db2.gz	IOBIOEWJSRJYMG-UHFFFAOYSA-N	0	3	345.446	3.314	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC2(CCN(Cc3cnc(C)o3)C2)CC1	ZINC001753603009	1440446876	/nfs/dbraw/zinc/44/68/76/1440446876.db2.gz	JPLZTRLIKJRLIN-UHFFFAOYSA-N	0	3	345.487	3.400	20	30		EGEDHN
C#Cc1ccc(C(=O)NCC2(NCc3ncccc3C)CCCC2)cc1	ZINC001753667224	1440460689	/nfs/dbraw/zinc/46/06/89/1440460689.db2.gz	UKDZZZBCJWCQDI-UHFFFAOYSA-N	0	3	347.462	3.204	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC1(NCc2cccnc2OC)CCCC1	ZINC001753669375	1440461410	/nfs/dbraw/zinc/46/14/10/1440461410.db2.gz	PPVQGPRLNLZXPY-UHFFFAOYSA-N	0	3	345.487	3.211	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H](CCC)c1ccccn1)CC2	ZINC001753674940	1440463049	/nfs/dbraw/zinc/46/30/49/1440463049.db2.gz	MCUHIBOZSNNYDI-SFHVURJKSA-N	0	3	341.499	3.466	20	30		EGEDHN
Cc1ccccc1C(=O)N(C)[C@H](C)CNCC#Cc1ccc(F)cc1	ZINC001753678019	1440463957	/nfs/dbraw/zinc/46/39/57/1440463957.db2.gz	VCYNMHQWVRQJJP-QGZVFWFLSA-N	0	3	338.426	3.236	20	30		EGEDHN
C[C@@H](CNCC#Cc1cccc(Cl)c1)N(C)C(=O)[C@@H](C)C1CC1	ZINC001753687667	1440466009	/nfs/dbraw/zinc/46/60/09/1440466009.db2.gz	RKBUJBPQOUSWOY-GJZGRUSLSA-N	0	3	332.875	3.174	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)N(C)C(=O)C[C@H]1CC=CCC1	ZINC001753706403	1440469797	/nfs/dbraw/zinc/46/97/97/1440469797.db2.gz	NEQOGAXNCSLDFR-GJZGRUSLSA-N	0	3	331.485	3.303	20	30		EGEDHN
C[C@@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)c1ccc(F)s1	ZINC001753727761	1440474915	/nfs/dbraw/zinc/47/49/15/1440474915.db2.gz	IDWCRZXFBYWCAS-NSHDSACASA-N	0	3	349.406	3.148	20	30		EGEDHN
N#Cc1ccccc1CNCC[C@H]1CCCCN1C(=O)c1cccnc1	ZINC001753766439	1440484850	/nfs/dbraw/zinc/48/48/50/1440484850.db2.gz	QGVJKEXKFNTISW-HXUWFJFHSA-N	0	3	348.450	3.128	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H](C)[C@@H]1CNCc1c(C)noc1CC	ZINC001753820692	1440495709	/nfs/dbraw/zinc/49/57/09/1440495709.db2.gz	ZYJDASOANDXXMN-QAPCUYQASA-N	0	3	345.487	3.066	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)C[C@@H](C)c1c(C)n[nH]c1C)C(C)C	ZINC001753834153	1440500359	/nfs/dbraw/zinc/50/03/59/1440500359.db2.gz	IVFNUGVVBXTSTA-ABAIWWIYSA-N	0	3	340.899	3.003	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cccc2cccnc21)C(C)C	ZINC001753833896	1440500433	/nfs/dbraw/zinc/50/04/33/1440500433.db2.gz	GJWFMWPEXZHADS-MRXNPFEDSA-N	0	3	331.847	3.331	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)NC[C@@H](NCc1ccc(C#N)cc1F)C(C)C	ZINC001753838168	1440501711	/nfs/dbraw/zinc/50/17/11/1440501711.db2.gz	OISQEAZJIWICCR-SZVBFZGTSA-N	0	3	345.462	3.364	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@H]2[C@H](CCN2Cc2ccccc2Cl)C1	ZINC001753872176	1440517662	/nfs/dbraw/zinc/51/76/62/1440517662.db2.gz	KKDKATPEPRAUNY-MJGOQNOKSA-N	0	3	344.886	3.422	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CCC[C@H]1CNCc1nc2ccc(F)cc2o1	ZINC001753882605	1440520646	/nfs/dbraw/zinc/52/06/46/1440520646.db2.gz	MESKWDQGSNZRBV-DZGCQCFKSA-N	0	3	345.418	3.308	20	30		EGEDHN
C=C(Cl)CNCC[C@@H](C)NC(=O)[C@H](CC)c1c(C)noc1C	ZINC001754006553	1440530854	/nfs/dbraw/zinc/53/08/54/1440530854.db2.gz	TVCPERWPAXTWRH-BXUZGUMPSA-N	0	3	327.856	3.022	20	30		EGEDHN
C[C@@H](CCNCc1ccccc1C#N)NC(=O)[C@@H](C)C1CCCC1	ZINC001754011900	1440531349	/nfs/dbraw/zinc/53/13/49/1440531349.db2.gz	FXEYROBXUHJNRO-HOTGVXAUSA-N	0	3	327.472	3.369	20	30		EGEDHN
CCN(CCNCc1ccc(C#N)c(F)c1)C(=O)C(F)=C1CCCC1	ZINC001754040999	1440534660	/nfs/dbraw/zinc/53/46/60/1440534660.db2.gz	WNDMNOCZCVUHTF-UHFFFAOYSA-N	0	3	347.409	3.433	20	30		EGEDHN
CCN(CCNCc1cccc(C#N)c1)C(=O)C1(C)CCCCC1	ZINC001754064938	1440537350	/nfs/dbraw/zinc/53/73/50/1440537350.db2.gz	LBXQVTUILAWFNP-UHFFFAOYSA-N	0	3	327.472	3.467	20	30		EGEDHN
CCN(CCNCc1ccc(F)c(C#N)c1)C(=O)[C@]1(C)CCC[C@@H]1C	ZINC001754065384	1440537500	/nfs/dbraw/zinc/53/75/00/1440537500.db2.gz	DDLGPBYKYVHSEG-MGPUTAFESA-N	0	3	345.462	3.462	20	30		EGEDHN
C=CCCC(=O)NC/C=C/CNCc1cccc(C(F)(F)F)c1	ZINC001754101577	1440541162	/nfs/dbraw/zinc/54/11/62/1440541162.db2.gz	PXDFVDMKULXPJF-SNAWJCMRSA-N	0	3	326.362	3.434	20	30		EGEDHN
CC(C)(C)/C=C\C(=O)NC/C=C/CNCc1ccc(F)c(C#N)c1	ZINC001754104618	1440541587	/nfs/dbraw/zinc/54/15/87/1440541587.db2.gz	VDEBJFOFNKGPQO-PXJZJIAOSA-N	0	3	329.419	3.062	20	30		EGEDHN
CC(C)c1[nH]ccc1C(=O)NC/C=C\CNCc1ccc(C#N)cc1	ZINC001754160916	1440546094	/nfs/dbraw/zinc/54/60/94/1440546094.db2.gz	STWKWCWIAIWLTM-ARJAWSKDSA-N	0	3	336.439	3.086	20	30		EGEDHN
Cc1cc(F)cc(C(=O)NC/C=C\CNCc2cccc(C#N)c2)c1	ZINC001754171334	1440547056	/nfs/dbraw/zinc/54/70/56/1440547056.db2.gz	CIDWCURQXVCXQJ-IHWYPQMZSA-N	0	3	337.398	3.082	20	30		EGEDHN
C=C[C@H](C(=O)NC/C=C/CNCCC(F)(F)F)c1ccccc1	ZINC001754210549	1440551114	/nfs/dbraw/zinc/55/11/14/1440551114.db2.gz	ZCKQOFYVRSWICO-LFAOLKIESA-N	0	3	326.362	3.171	20	30		EGEDHN
COc1ccc(C(C)C)cc1CNC[C@@H](C)NC(=O)C#CC(C)(C)C	ZINC001754226232	1440553433	/nfs/dbraw/zinc/55/34/33/1440553433.db2.gz	FEIXDYBJWDFBNA-MRXNPFEDSA-N	0	3	344.499	3.462	20	30		EGEDHN
C[C@@H](CNCC#Cc1cccc(Cl)c1)NC(=O)CCc1ccco1	ZINC001754262165	1440560102	/nfs/dbraw/zinc/56/01/02/1440560102.db2.gz	BIIPOMCGVNSXEE-HNNXBMFYSA-N	0	3	344.842	3.012	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H](C)CN[C@H](C)C(=O)Nc1ccc(C)c(C)c1	ZINC001754268331	1440560992	/nfs/dbraw/zinc/56/09/92/1440560992.db2.gz	CYIKTESBHHJYCK-DLBZAZTESA-N	0	3	345.487	3.081	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](C)CN(C)CCOc1ccccc1F	ZINC001754320449	1440577740	/nfs/dbraw/zinc/57/77/40/1440577740.db2.gz	WWMQZNJZACEOJH-HNNXBMFYSA-N	0	3	336.451	3.243	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](C)CN(C)Cc2ccccc2N(C)C)CC1	ZINC001754323059	1440578999	/nfs/dbraw/zinc/57/89/99/1440578999.db2.gz	LSYDLNHUPNBTFD-KRWDZBQOSA-N	0	3	343.515	3.436	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N(C)CCCNCc1cc(C#N)ccc1F	ZINC001754390456	1440594146	/nfs/dbraw/zinc/59/41/46/1440594146.db2.gz	TZTKLHDUNXNIMB-GIDUJCDVSA-N	0	3	329.419	3.158	20	30		EGEDHN
C=C(Cl)CNCCCN(C)C(=O)c1ccc(OC)cc1Cl	ZINC001754404205	1440595508	/nfs/dbraw/zinc/59/55/08/1440595508.db2.gz	UIZVJQGANKXNGK-UHFFFAOYSA-N	0	3	331.243	3.153	20	30		EGEDHN
CCC(C)(CC)C(=O)N[C@H](CNCC#Cc1ccc(F)cc1)C1CC1	ZINC001754459828	1440603126	/nfs/dbraw/zinc/60/31/26/1440603126.db2.gz	GICFGQYJEAUMCZ-LJQANCHMSA-N	0	3	344.474	3.488	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NC[C@H]1CCN1Cc1c(C)cccc1C)OCC	ZINC001754484403	1440608476	/nfs/dbraw/zinc/60/84/76/1440608476.db2.gz	AHSLPSHJBKDSNT-QUCCMNQESA-N	0	3	344.499	3.365	20	30		EGEDHN
C=CCC[C@@H](C)N1CC[C@@H]1CNC(=O)c1ccc(OC(C)C)nc1	ZINC001754485604	1440608586	/nfs/dbraw/zinc/60/85/86/1440608586.db2.gz	YQGFIBBYXSLEDE-NVXWUHKLSA-N	0	3	331.460	3.028	20	30		EGEDHN
CC#CCCCC(=O)NC[C@H]1CCN1CCCc1ccc(C)cc1	ZINC001754491486	1440610397	/nfs/dbraw/zinc/61/03/97/1440610397.db2.gz	KFHUEVSDYARNFY-HXUWFJFHSA-N	0	3	326.484	3.312	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)C[C@H]1CCc2ccccc2C1	ZINC001754499573	1440613514	/nfs/dbraw/zinc/61/35/14/1440613514.db2.gz	ATJBNXMEXSSUCL-FXAWDEMLSA-N	0	3	326.484	3.338	20	30		EGEDHN
C=CCC[C@H](C)N1CC[C@H]1CNC(=O)c1cnn(C2CCCC2)c1C	ZINC001754500819	1440614233	/nfs/dbraw/zinc/61/42/33/1440614233.db2.gz	SDUBKVJIYMAEPM-YJBOKZPZSA-N	0	3	344.503	3.465	20	30		EGEDHN
C=CCC1(C(=O)NCC2(NCc3ccc(C)nc3C)CC2)CCC1	ZINC001754524008	1440620527	/nfs/dbraw/zinc/62/05/27/1440620527.db2.gz	PPGMFLQEMBPRBH-UHFFFAOYSA-N	0	3	327.472	3.183	20	30		EGEDHN
C#Cc1cncc(C(=O)NCC2(NCc3ccc(C(C)C)cc3)CC2)c1	ZINC001754525052	1440620734	/nfs/dbraw/zinc/62/07/34/1440620734.db2.gz	ZULRQWKEPPNTBG-UHFFFAOYSA-N	0	3	347.462	3.239	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)C[C@@H](C=C)c3ccccc3)C2)CC1	ZINC001754561452	1440633808	/nfs/dbraw/zinc/63/38/08/1440633808.db2.gz	UHIWWGGDZIPKCR-LJQANCHMSA-N	0	3	336.479	3.294	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H](CNCc2ccccn2)C2CCCC2)C1	ZINC001754649868	1440651547	/nfs/dbraw/zinc/65/15/47/1440651547.db2.gz	JMFQEFGJIYTFST-SFHVURJKSA-N	0	3	327.472	3.203	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@@]1(C)CCN(Cc2ccc(C3CCC3)cc2)C1	ZINC001754668802	1440657275	/nfs/dbraw/zinc/65/72/75/1440657275.db2.gz	SHLKZXOOSMVNFK-QRWLVFNGSA-N	0	3	325.456	3.194	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@](C)(CNCc2cc(C3CC3)no2)C1	ZINC001754702059	1440668104	/nfs/dbraw/zinc/66/81/04/1440668104.db2.gz	MYIJEHVLJRKNHL-IBGZPJMESA-N	0	3	331.460	3.092	20	30		EGEDHN
C#CCN1CCC(C)(CNC(=O)C[C@@H](C)c2ccc(F)cc2)CC1	ZINC001754721979	1440673631	/nfs/dbraw/zinc/67/36/31/1440673631.db2.gz	HZWVMASCBMTKMR-MRXNPFEDSA-N	0	3	330.447	3.171	20	30		EGEDHN
C=CCCC(=O)NC[C@]1(C)CCCN(Cc2ccc3c(c2)COC3)C1	ZINC001754724514	1440675226	/nfs/dbraw/zinc/67/52/26/1440675226.db2.gz	SMFRSQBRVVQGBD-NRFANRHFSA-N	0	3	342.483	3.401	20	30		EGEDHN
C=CCN1CCC[C@@](C)(CNC(=O)c2cc3cccc(OC)c3o2)C1	ZINC001754729517	1440678174	/nfs/dbraw/zinc/67/81/74/1440678174.db2.gz	LJOANGIFCIMUSY-FQEVSTJZSA-N	0	3	342.439	3.459	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@H]1CN(CC[C@H](C)F)CCC1(F)F	ZINC001754743495	1440683781	/nfs/dbraw/zinc/68/37/81/1440683781.db2.gz	MJYJDWXEBDSSIN-KBPBESRZSA-N	0	3	334.426	3.410	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@@H](CNC(=O)[C@@H](C)c2ccccc2C)C1	ZINC001754744365	1440684211	/nfs/dbraw/zinc/68/42/11/1440684211.db2.gz	GPNLBEBNCGRPFR-IRXDYDNUSA-N	0	3	348.437	3.195	20	30		EGEDHN
CC(F)(F)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1ccccc1)C2	ZINC001754782854	1440686783	/nfs/dbraw/zinc/68/67/83/1440686783.db2.gz	HZAKFEOVJDKFII-BZSNNMDCSA-N	0	3	346.421	3.053	20	30		EGEDHN
CC1(CC(=O)N[C@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2C#N)C3)CC1	ZINC001754784892	1440687401	/nfs/dbraw/zinc/68/74/01/1440687401.db2.gz	HVMDTAFGFXKLDY-SNRMKQJTSA-N	0	3	337.467	3.218	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@H]2C[C@H]3CC[C@@H](C2)N3Cc2cnoc2C)C1	ZINC001754831323	1440695431	/nfs/dbraw/zinc/69/54/31/1440695431.db2.gz	XPQDULOJMQCFEB-VBUUOAMHSA-N	0	3	343.471	3.199	20	30		EGEDHN
C#CCNCCN(Cc1ccccc1)C(=O)c1ccc(Cl)cc1	ZINC001754839331	1440697481	/nfs/dbraw/zinc/69/74/81/1440697481.db2.gz	MBAIIWSTDFRRFC-UHFFFAOYSA-N	0	3	326.827	3.205	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@H]2CN(Cc3cnc(C)s3)C[C@H]2C1	ZINC001754842560	1440698347	/nfs/dbraw/zinc/69/83/47/1440698347.db2.gz	IKCDZCZJPICVRO-CALCHBBNSA-N	0	3	345.512	3.110	20	30		EGEDHN
C=CC[C@H](C(=O)N1C[C@H]2CN(C[C@H](F)CC)C[C@H]2C1)c1ccccc1	ZINC001754847887	1440699649	/nfs/dbraw/zinc/69/96/49/1440699649.db2.gz	KIOYXKIADKUQPL-WCIQWLHISA-N	0	3	344.474	3.485	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CCC[C@H]2CN(Cc3ccsc3)C[C@H]21	ZINC001754870864	1440705137	/nfs/dbraw/zinc/70/51/37/1440705137.db2.gz	NAPAZAJRERFNBF-RYQLBKOJSA-N	0	3	348.512	3.152	20	30		EGEDHN
N#Cc1ccc(F)c(CNCC[C@@H]2CCN(C(=O)CCC3CC3)C2)c1	ZINC001754907417	1440707608	/nfs/dbraw/zinc/70/76/08/1440707608.db2.gz	FEAFLKAAAHASTE-MRXNPFEDSA-N	0	3	343.446	3.216	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@@H](CCNCc3ccccc3C#N)C2)co1	ZINC001754912384	1440708151	/nfs/dbraw/zinc/70/81/51/1440708151.db2.gz	LEKZNQAHUXEWKO-MRXNPFEDSA-N	0	3	337.423	3.102	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)CC[C@@H](C)OC)cccc2C1	ZINC001754974736	1440719709	/nfs/dbraw/zinc/71/97/09/1440719709.db2.gz	SGKFCAOIJZCOAW-MRXNPFEDSA-N	0	3	330.472	3.052	20	30		EGEDHN
C=CCOCCN1CCc2c(CNC(=O)C3(CC)CC3)cccc2C1	ZINC001754975738	1440719831	/nfs/dbraw/zinc/71/98/31/1440719831.db2.gz	LRMVWLNXXZLNNZ-UHFFFAOYSA-N	0	3	342.483	3.054	20	30		EGEDHN
C=C(C)CCC(=O)N1CCO[C@H](CNCc2ccc(Cl)s2)C1	ZINC001754999558	1440725587	/nfs/dbraw/zinc/72/55/87/1440725587.db2.gz	BDKDXVIAQNEPPZ-CYBMUJFWSA-N	0	3	342.892	3.075	20	30		EGEDHN
C=CCCCN1CCN([C@H]2CCN(C(=O)CC3=CCCCC3)C2)CC1	ZINC001755017426	1440726324	/nfs/dbraw/zinc/72/63/24/1440726324.db2.gz	NBMOBASDVLPUMX-FQEVSTJZSA-N	0	3	345.531	3.062	20	30		EGEDHN
C=C[C@@H](C(=O)N(C)CCCN(C)Cc1cccnc1)c1ccccc1	ZINC001755046909	1440741491	/nfs/dbraw/zinc/74/14/91/1440741491.db2.gz	BTXCABDPUPVRGA-HXUWFJFHSA-N	0	3	337.467	3.332	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)C3(C)CCOCC3)cc2C1	ZINC001755101523	1440752534	/nfs/dbraw/zinc/75/25/34/1440752534.db2.gz	MQSYTUSFXSMWGM-UHFFFAOYSA-N	0	3	328.456	3.011	20	30		EGEDHN
C=CCCC(=O)N1CCC(CN(CC)Cc2c(C)noc2C)CC1	ZINC001755181855	1440771118	/nfs/dbraw/zinc/77/11/18/1440771118.db2.gz	DPVCMMJRPRLQHR-UHFFFAOYSA-N	0	3	333.476	3.318	20	30		EGEDHN
C#CCCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc(C)c(OC)c1	ZINC001755186532	1440773396	/nfs/dbraw/zinc/77/33/96/1440773396.db2.gz	XNPLYODONHZQNR-TZIWHRDSSA-N	0	3	348.446	3.012	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCN1C(=O)Cc1cccc(OCCC)c1	ZINC001755200296	1440779288	/nfs/dbraw/zinc/77/92/88/1440779288.db2.gz	FQKDCBAVAKGNKQ-GOSISDBHSA-N	0	3	330.472	3.127	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](C2CCN(C(=O)C[C@@H](C)OC)CC2)C1	ZINC001755205236	1440781881	/nfs/dbraw/zinc/78/18/81/1440781881.db2.gz	QUVRDOFCGHLSGN-WBVHZDCISA-N	0	3	342.911	3.115	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](C2CCN(C(=O)C[C@H](C)OC)CC2)C1	ZINC001755205233	1440782021	/nfs/dbraw/zinc/78/20/21/1440782021.db2.gz	QUVRDOFCGHLSGN-DOTOQJQBSA-N	0	3	342.911	3.115	20	30		EGEDHN
CCC[C@@H](C)C(=O)NC1CC(CNCc2cc(C#N)ccc2F)C1	ZINC001755206594	1440782374	/nfs/dbraw/zinc/78/23/74/1440782374.db2.gz	BZAVTTPJEDLITG-BZOOQXSSSA-N	0	3	331.435	3.118	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H](C)[C@H](C)NCc2sccc2Cl)c1	ZINC001755253013	1440792467	/nfs/dbraw/zinc/79/24/67/1440792467.db2.gz	NYXASIRTVJRKFE-NWDGAFQWSA-N	0	3	347.871	3.074	20	30		EGEDHN
CCc1cccc(OCCN(C)[C@H](C)CNC(=O)C#CC(C)(C)C)c1	ZINC001755300406	1440808226	/nfs/dbraw/zinc/80/82/26/1440808226.db2.gz	PJWVPGFQLUJXOR-QGZVFWFLSA-N	0	3	344.499	3.114	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H](C)N(C)[C@@H](C)c2cccc(F)c2)nc1	ZINC001755322230	1440819142	/nfs/dbraw/zinc/81/91/42/1440819142.db2.gz	DMZBMPGBYHSMNB-GJZGRUSLSA-N	0	3	339.414	3.013	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@]2(CCN(C(=O)CC(C)(C)CC)C2)C1	ZINC001755401619	1440843051	/nfs/dbraw/zinc/84/30/51/1440843051.db2.gz	JLRSOKQASQZVPJ-XLIONFOSSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CN(CCOc2cc(C)cc(C)c2)CC1(C)C	ZINC001755404975	1440843903	/nfs/dbraw/zinc/84/39/03/1440843903.db2.gz	CLDQYTORWQNKKO-LJQANCHMSA-N	0	3	344.499	3.475	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@H]1[C@H]2CN(Cc3ccccc3Cl)C[C@H]21	ZINC001755428884	1440850877	/nfs/dbraw/zinc/85/08/77/1440850877.db2.gz	ZEDYSTHNOPMJCG-NNZMDNLPSA-N	0	3	344.886	3.328	20	30		EGEDHN
C=C(Br)CNCCC[C@H](C)NC(=O)c1cc(Cl)c[nH]1	ZINC001755489237	1440861225	/nfs/dbraw/zinc/86/12/25/1440861225.db2.gz	XPNLYOGXLHUVNT-JTQLQIEISA-N	0	3	348.672	3.065	20	30		EGEDHN
C=C(Cl)CNCCC[C@@H](C)NC(=O)[C@@H]1CCc2ccccc2C1	ZINC001755518161	1440864607	/nfs/dbraw/zinc/86/46/07/1440864607.db2.gz	JNMSTZFESMHPFW-CRAIPNDOSA-N	0	3	334.891	3.419	20	30		EGEDHN
C=C1CCC(C(=O)NCC[C@@H](NCc2ccn(CC)n2)C(C)C)CC1	ZINC001755551712	1440872221	/nfs/dbraw/zinc/87/22/21/1440872221.db2.gz	IXQHIHKOYQIWBL-LJQANCHMSA-N	0	3	346.519	3.270	20	30		EGEDHN
CC#CCCCC(=O)N(C)[C@@H](CNCc1cc(F)ccc1F)C1CC1	ZINC001755564944	1440875465	/nfs/dbraw/zinc/87/54/65/1440875465.db2.gz	OSOPFAAOEYMYPL-IBGZPJMESA-N	0	3	348.437	3.485	20	30		EGEDHN
C=CCCC(=O)N(C)C[C@@H](C)NCc1ccc(Br)s1	ZINC001755579693	1440879123	/nfs/dbraw/zinc/87/91/23/1440879123.db2.gz	IVFMECMBJNXXKZ-LLVKDONJSA-N	0	3	345.306	3.413	20	30		EGEDHN
Cc1ccc(CC(=O)N(C)C[C@@H](C)NCC#Cc2ccccc2)cc1C	ZINC001755616622	1440888986	/nfs/dbraw/zinc/88/89/86/1440888986.db2.gz	UYFCJJPRPHRCDR-HXUWFJFHSA-N	0	3	348.490	3.334	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](NCc2ccc(F)c(F)c2)[C@@H]1C	ZINC001755650730	1440891317	/nfs/dbraw/zinc/89/13/17/1440891317.db2.gz	QPGXYFFUIHJBET-KBXCAEBGSA-N	0	3	334.410	3.237	20	30		EGEDHN
C[C@@H]1[C@H](NCC#Cc2cccc(Cl)c2)CCN1C(=O)CCCF	ZINC001755658965	1440892400	/nfs/dbraw/zinc/89/24/00/1440892400.db2.gz	NDTJORGUPGFRDQ-RHSMWYFYSA-N	0	3	336.838	3.020	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H](NCc2ccc(C#N)s2)C[C@H]1C	ZINC001755675590	1440894509	/nfs/dbraw/zinc/89/45/09/1440894509.db2.gz	KRGBAPPWQAHPNZ-ZBFHGGJFSA-N	0	3	343.496	3.467	20	30		EGEDHN
C[C@H]1C[C@H](NCC#Cc2ccccc2)CN1C(=O)[C@@H]1CC[C@@H](C)CC1	ZINC001755689108	1440896407	/nfs/dbraw/zinc/89/64/07/1440896407.db2.gz	MSEOVJKDMCAQMX-QIJZPMMNSA-N	0	3	338.495	3.443	20	30		EGEDHN
C#CCCCC(=O)N[C@@]12CCC[C@H]1N(Cc1c(C)nsc1C)CC2	ZINC001755697688	1440898396	/nfs/dbraw/zinc/89/83/96/1440898396.db2.gz	ARNNDFMYXBEAIR-IEBWSBKVSA-N	0	3	345.512	3.177	20	30		EGEDHN
C=CCCCC(=O)N[C@]12CCC[C@H]1N(CCc1ccns1)CC2	ZINC001755702641	1440901047	/nfs/dbraw/zinc/90/10/47/1440901047.db2.gz	WZQPYAQWFWRCAT-AEFFLSMTSA-N	0	3	333.501	3.155	20	30		EGEDHN
C=CCN1CC[C@]2(NC(=O)COC[C@@H](C)c3ccccc3)CCC[C@@H]12	ZINC001755704650	1440902173	/nfs/dbraw/zinc/90/21/73/1440902173.db2.gz	OIFDYRLXCPZSNY-YFVAEKQCSA-N	0	3	342.483	3.106	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H]2CCC[C@@H](NCc3nocc3C)[C@H]2C1	ZINC001755708698	1440903127	/nfs/dbraw/zinc/90/31/27/1440903127.db2.gz	NJUPXPZPTHOOPE-YESZJQIVSA-N	0	3	331.460	3.056	20	30		EGEDHN
C=CCN1CCC[C@H](NC(=O)CCCc2ccc(OC)cc2)[C@@H]1C	ZINC001755723546	1440908665	/nfs/dbraw/zinc/90/86/65/1440908665.db2.gz	RJBUUEYOIIZFSZ-LPHOPBHVSA-N	0	3	330.472	3.173	20	30		EGEDHN
CC1(C)CN(C(=O)CCCC2CC2)C[C@@H]1NCC#Cc1ccccc1	ZINC001755775753	1440917170	/nfs/dbraw/zinc/91/71/70/1440917170.db2.gz	QPXBHBFHHALFSP-FQEVSTJZSA-N	0	3	338.495	3.445	20	30		EGEDHN
C#CCCCCCC(=O)N1C[C@@H](NCc2cncc(F)c2)C(C)(C)C1	ZINC001755775879	1440917246	/nfs/dbraw/zinc/91/72/46/1440917246.db2.gz	SPHCJKJYHNXQLX-GOSISDBHSA-N	0	3	345.462	3.131	20	30		EGEDHN
C=CCCC(=O)N(C)C[C@H](O)CN(C)Cc1ccc(C(C)(C)C)cc1	ZINC001755800090	1440918055	/nfs/dbraw/zinc/91/80/55/1440918055.db2.gz	WGMMGJRPFHKLKM-LJQANCHMSA-N	0	3	346.515	3.201	20	30		EGEDHN
C=CCN(C)CCN(C(=O)[C@@H]1COc2cc(C)c(C)cc21)C(C)C	ZINC001755814089	1440922320	/nfs/dbraw/zinc/92/23/20/1440922320.db2.gz	NZRDESPYZKDMKN-GOSISDBHSA-N	0	3	330.472	3.134	20	30		EGEDHN
C=C(C)CN(C)CCN(C(=O)c1cnn(CC2CCCC2)c1)C(C)C	ZINC001755814948	1440923001	/nfs/dbraw/zinc/92/30/01/1440923001.db2.gz	VHRJCVGZYXNTTP-UHFFFAOYSA-N	0	3	346.519	3.432	20	30		EGEDHN
C#CCCN(C)CCN(C(=O)c1cnc2ccc(F)cc2c1)C(C)C	ZINC001755817560	1440924322	/nfs/dbraw/zinc/92/43/22/1440924322.db2.gz	PWXSZSBFJLAGCM-UHFFFAOYSA-N	0	3	341.430	3.180	20	30		EGEDHN
CC(C)(C)[C@H](CNCC#Cc1ccc(F)cc1)NC(=O)C1=CCCC1	ZINC001755819533	1440925247	/nfs/dbraw/zinc/92/52/47/1440925247.db2.gz	GHZSDMYUIXGFMS-IBGZPJMESA-N	0	3	342.458	3.408	20	30		EGEDHN
CC[C@H](F)C(=O)N[C@@H](C)C1CCN(Cc2cccc(C#N)c2)CC1	ZINC001755848647	1440934283	/nfs/dbraw/zinc/93/42/83/1440934283.db2.gz	WQUWYPSCKAYYAD-KSSFIOAISA-N	0	3	331.435	3.023	20	30		EGEDHN
CN(C(=O)C1CCCC1)C1CC(NCC#Cc2ccc(Cl)cc2)C1	ZINC001755849671	1440934481	/nfs/dbraw/zinc/93/44/81/1440934481.db2.gz	UYICFSYDKDIFKZ-UHFFFAOYSA-N	0	3	344.886	3.461	20	30		EGEDHN
CCC(CC)CC(=O)N(C)C1CC(NCC#Cc2ccccc2)C1	ZINC001755862937	1440937093	/nfs/dbraw/zinc/93/70/93/1440937093.db2.gz	CSMIETCBXBHYAC-UHFFFAOYSA-N	0	3	326.484	3.443	20	30		EGEDHN
C#CCN1CCC(C2(NC(=O)Cc3cccc(Cl)c3F)CC2)CC1	ZINC001755869330	1440938614	/nfs/dbraw/zinc/93/86/14/1440938614.db2.gz	BUVTTYFSYXGOHC-UHFFFAOYSA-N	0	3	348.849	3.016	20	30		EGEDHN
C=CCN1CC=C(CNC(=O)CCCOc2ccccc2C)CC1	ZINC001755890633	1440941224	/nfs/dbraw/zinc/94/12/24/1440941224.db2.gz	KILXAFXBJUVSEO-UHFFFAOYSA-N	0	3	328.456	3.088	20	30		EGEDHN
C=CCOCCN1CC=C(CNC(=O)[C@]2(C)CC=C(C)CC2)CC1	ZINC001755899209	1440943444	/nfs/dbraw/zinc/94/34/44/1440943444.db2.gz	FAHXIMMPYXLULJ-HXUWFJFHSA-N	0	3	332.488	3.074	20	30		EGEDHN
Cc1ccc([C@@H](C#N)c2ccc(N3CCN(CC(C)C)CC3)nn2)cc1	ZINC001164651316	719329403	/nfs/dbraw/zinc/32/94/03/719329403.db2.gz	FNGPXNWFYXUVFR-LJQANCHMSA-N	0	3	349.482	3.219	20	30		EGEDHN
COc1ccc(C[C@](C)(CO)NCc2ccc(C#N)cc2Cl)cc1	ZINC000933433242	1126139784	/nfs/dbraw/zinc/13/97/84/1126139784.db2.gz	TWIGZFZVYJGULH-LJQANCHMSA-N	0	3	344.842	3.304	20	30		EGEDHN
CC(C)(C)[C@H](NCC(=O)N[C@](C)(C#N)C1CC1)c1ccc(F)cc1	ZINC000053644250	214193102	/nfs/dbraw/zinc/19/31/02/214193102.db2.gz	XKJTVDUDSUGVND-IEBWSBKVSA-N	0	3	331.435	3.311	20	30		EGEDHN
CS[C@H](C)C(=O)C(C#N)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000100819222	219108194	/nfs/dbraw/zinc/10/81/94/219108194.db2.gz	FIQAVPGWTHTJHJ-RDDDGLTNSA-N	0	3	331.224	3.392	20	30		EGEDHN
C[C@H]1C[C@H](N(C)C(=O)c2c[nH]c(C#N)c2)CCN1Cc1ccccc1	ZINC000181306396	234149218	/nfs/dbraw/zinc/14/92/18/234149218.db2.gz	GHKIYDQAHJLRRS-HNAYVOBHSA-N	0	3	336.439	3.011	20	30		EGEDHN
Cc1ccc(C(=O)NCCN[C@H](C)c2cccc(C#N)c2)cc1F	ZINC000181466064	234195994	/nfs/dbraw/zinc/19/59/94/234195994.db2.gz	HDCDUZNRKQSBKA-CQSZACIVSA-N	0	3	325.387	3.086	20	30		EGEDHN
CN(C)Cc1cccc(NC(=O)C(C)(C)Oc2ccc(C#N)cc2)c1	ZINC000130467426	223154414	/nfs/dbraw/zinc/15/44/14/223154414.db2.gz	LCNQCDJNPSTEID-UHFFFAOYSA-N	0	3	337.423	3.416	20	30		EGEDHN
C[C@H](NC[C@H]1CN(Cc2ccccc2)CCCO1)c1cccc(C#N)c1	ZINC000191831380	239325952	/nfs/dbraw/zinc/32/59/52/239325952.db2.gz	CNBWTRPQTZUAQT-AVRDEDQJSA-N	0	3	349.478	3.500	20	30		EGEDHN
C[C@H](CNC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1)N(C)C	ZINC000264217268	246196953	/nfs/dbraw/zinc/19/69/53/246196953.db2.gz	IOUIJPOKWAQVLX-CQSZACIVSA-N	0	3	338.411	3.422	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](C)c2ccc(OC)cc2)CC1	ZINC000264319418	246347089	/nfs/dbraw/zinc/34/70/89/246347089.db2.gz	AGVNBZNCKOKTNB-OAHLLOKOSA-N	0	3	331.460	3.096	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2CCc3cc(C)ccc32)CC1	ZINC000264321334	246347828	/nfs/dbraw/zinc/34/78/28/246347828.db2.gz	AYXYAFZHRRKYHN-LJQANCHMSA-N	0	3	327.472	3.322	20	30		EGEDHN
COc1ccc(CNC[C@H](O)c2ccc(OC(C)C)cc2)cc1C#N	ZINC000266161694	248139738	/nfs/dbraw/zinc/13/97/38/248139738.db2.gz	NQFAOABMXJCWDZ-IBGZPJMESA-N	0	3	340.423	3.177	20	30		EGEDHN
C[C@H](N[C@@H]1CC(=O)N([C@H]2C[C@H]2c2ccccc2)C1)c1cccc(C#N)c1	ZINC000378449769	169123293	/nfs/dbraw/zinc/12/32/93/169123293.db2.gz	GIPCYQOFHNHTEM-ZFCZOSEKSA-N	0	3	345.446	3.366	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN2CCC(COc3ccccc3)CC2)cc1	ZINC000268645545	252099277	/nfs/dbraw/zinc/09/92/77/252099277.db2.gz	FKTSLCZTEKYVGK-NRFANRHFSA-N	0	3	336.435	3.383	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN2CCC([C@H](O)c3ccccc3)CC2)cc1	ZINC000268736555	252185820	/nfs/dbraw/zinc/18/58/20/252185820.db2.gz	YMKGQWZRRJVXKO-LEWJYISDSA-N	0	3	336.435	3.037	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN2CCC([C@H](O)c3ccccc3)CC2)cc1	ZINC000268736557	252186933	/nfs/dbraw/zinc/18/69/33/252186933.db2.gz	YMKGQWZRRJVXKO-NHCUHLMSSA-N	0	3	336.435	3.037	20	30		EGEDHN
C[C@H](NC(=O)N1CCN(C2CCCCC2)CC1)c1ccc(C#N)cc1	ZINC000268851259	252298218	/nfs/dbraw/zinc/29/82/18/252298218.db2.gz	CTFHHUQNFYZYRN-INIZCTEOSA-N	0	3	340.471	3.279	20	30		EGEDHN
C[C@H](CNC(=O)Nc1cc(C#N)cn1C(C)(C)C)N1CCCC[C@H]1C	ZINC000337863006	141068623	/nfs/dbraw/zinc/06/86/23/141068623.db2.gz	NMEJQYRYLIBVLU-HUUCEWRRSA-N	0	3	345.491	3.499	20	30		EGEDHN
C[C@@H](N[C@H]1CCCN(C(=O)Cc2ccccc2)C1)c1cccc(C#N)c1	ZINC000338014251	141073793	/nfs/dbraw/zinc/07/37/93/141073793.db2.gz	FCLMHKQOWDXBNR-UTKZUKDTSA-N	0	3	347.462	3.443	20	30		EGEDHN
C[C@H](NC(=O)c1ncc(C#N)cc1Cl)[C@H](c1ccccc1)N(C)C	ZINC000356236018	141325038	/nfs/dbraw/zinc/32/50/38/141325038.db2.gz	UWFHRNXANAHXQU-YVEFUNNKSA-N	0	3	342.830	3.028	20	30		EGEDHN
CCO[C@H]1C[C@@H](NCC(=O)Nc2sccc2C#N)C1(CC)CC	ZINC000187051022	144151284	/nfs/dbraw/zinc/15/12/84/144151284.db2.gz	MVMGXGBYNDCCNS-KGLIPLIRSA-N	0	3	335.473	3.132	20	30		EGEDHN
CS[C@@H]1CN(c2ccc(C(F)(F)F)c(C#N)c2)C[C@@H]1N(C)C	ZINC000361704080	144351824	/nfs/dbraw/zinc/35/18/24/144351824.db2.gz	FLHBBUWQTWRNOC-UONOGXRCSA-N	0	3	329.391	3.059	20	30		EGEDHN
COc1ccc(C2CCN(C[C@@H](O)c3ccc(C#N)cc3)CC2)cc1	ZINC000363836309	144370342	/nfs/dbraw/zinc/37/03/42/144370342.db2.gz	XOHKDCWEQTZEGQ-OAQYLSRUSA-N	0	3	336.435	3.480	20	30		EGEDHN
CCOc1ccc([N+](=O)[O-])cc1CNCCc1cccc(C#N)c1	ZINC000341466357	155309162	/nfs/dbraw/zinc/30/91/62/155309162.db2.gz	QRHMVKLDDVNWID-UHFFFAOYSA-N	0	3	325.368	3.197	20	30		EGEDHN
N#Cc1ccc(NC(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000193633475	153299288	/nfs/dbraw/zinc/29/92/88/153299288.db2.gz	WMTHBMBBEWQIKK-SFHVURJKSA-N	0	3	334.423	3.202	20	30		EGEDHN
Cc1cccc(OC[C@@H](O)CN[C@H](C)c2ccc(C#N)c(F)c2)c1	ZINC000271944333	154001363	/nfs/dbraw/zinc/00/13/63/154001363.db2.gz	PNQMIUXTHJMCQC-PBHICJAKSA-N	0	3	328.387	3.096	20	30		EGEDHN
Cc1cc(C)c(C#N)c(NCCc2ccc(OCCN(C)C)cc2)n1	ZINC000352632422	156390089	/nfs/dbraw/zinc/39/00/89/156390089.db2.gz	BSIXLSSBJXTEOX-UHFFFAOYSA-N	0	3	338.455	3.165	20	30		EGEDHN
CN(C)CCc1ccccc1NC(=O)c1c(F)cc(C#N)cc1F	ZINC000354193656	165982399	/nfs/dbraw/zinc/98/23/99/165982399.db2.gz	VVYTWXPILHJZBP-UHFFFAOYSA-N	0	3	329.350	3.193	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2cccc(C#N)c2)C1	ZINC000338331322	163213094	/nfs/dbraw/zinc/21/30/94/163213094.db2.gz	WHRCHIIBEIFKFF-OXQOHEQNSA-N	0	3	348.450	3.193	20	30		EGEDHN
C[C@H](N[C@@H]1CCN(C(=O)Cc2ccccc2)C1)c1ccc(C#N)cc1	ZINC000340628679	163627626	/nfs/dbraw/zinc/62/76/26/163627626.db2.gz	ZEGSQFKBRZAINI-OXJNMPFZSA-N	0	3	333.435	3.052	20	30		EGEDHN
CN(CCOCc1ccc(C#N)cc1)CCc1nc2ccccc2n1C	ZINC000344070002	164096456	/nfs/dbraw/zinc/09/64/56/164096456.db2.gz	MAILLTRSFJNLAT-UHFFFAOYSA-N	0	3	348.450	3.136	20	30		EGEDHN
COc1ccc(CN(C)CCOCc2ccc(C#N)cc2)cc1F	ZINC000344070673	164096758	/nfs/dbraw/zinc/09/67/58/164096758.db2.gz	MJMAESANRPYJEO-UHFFFAOYSA-N	0	3	328.387	3.355	20	30		EGEDHN
CC(=O)Nc1cccc(CN(C)CCOCc2ccc(C#N)cc2)c1	ZINC000344116674	164107117	/nfs/dbraw/zinc/10/71/17/164107117.db2.gz	OOEMADYTBYHKOA-UHFFFAOYSA-N	0	3	337.423	3.165	20	30		EGEDHN
CC(C)(C)OCCN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000345765954	164261388	/nfs/dbraw/zinc/26/13/88/164261388.db2.gz	XZLAJIPGWLAVQG-UHFFFAOYSA-N	0	3	329.444	3.024	20	30		EGEDHN
N#Cc1ccc(CNc2cccc(CN3CCC(O)CC3)c2)c(F)c1	ZINC000355396697	166183734	/nfs/dbraw/zinc/18/37/34/166183734.db2.gz	CNCNOAIAJXBOFD-UHFFFAOYSA-N	0	3	339.414	3.266	20	30		EGEDHN
C[C@@H](C(=O)N(CCN(C)C)Cc1cccs1)c1cccc(C#N)c1	ZINC000360302326	167294315	/nfs/dbraw/zinc/29/43/15/167294315.db2.gz	FKCFHRDKKBNJEV-OAHLLOKOSA-N	0	3	341.480	3.314	20	30		EGEDHN
N#Cc1ccc2c(c1)CCCC[C@H]2NCC(=O)NCCc1ccccc1	ZINC000360883693	167437983	/nfs/dbraw/zinc/43/79/83/167437983.db2.gz	KWXQXQVWRRTQTA-OAQYLSRUSA-N	0	3	347.462	3.274	20	30		EGEDHN
CCn1nc(C)c(CNCCSCc2ccccc2C#N)c1C	ZINC000171762020	227269018	/nfs/dbraw/zinc/26/90/18/227269018.db2.gz	NJPMTFUALNNSHB-UHFFFAOYSA-N	0	3	328.485	3.415	20	30		EGEDHN
C[C@@H](N[C@H](C)c1ccc2n[nH]cc2c1)C(=O)Nc1cccc(C#N)c1	ZINC000507267253	269845082	/nfs/dbraw/zinc/84/50/82/269845082.db2.gz	WWYKWFWEKJJNNP-CHWSQXEVSA-N	0	3	333.395	3.112	20	30		EGEDHN
N#Cc1cccc(NC(=O)c2ccc(CN3CCC(CO)CC3)cc2)c1	ZINC000299020556	270043401	/nfs/dbraw/zinc/04/34/01/270043401.db2.gz	GABWGAJWQMATPN-UHFFFAOYSA-N	0	3	349.434	3.015	20	30		EGEDHN
CN(C)CCOc1cc(CNc2c(Cl)cccc2C#N)ccn1	ZINC000301895145	270044549	/nfs/dbraw/zinc/04/45/49/270044549.db2.gz	TXUJXHNUIRKBKV-UHFFFAOYSA-N	0	3	330.819	3.159	20	30		EGEDHN
N#Cc1ccccc1NC(=O)CCN[C@H]1CCCc2c(O)cccc21	ZINC000411616892	270046914	/nfs/dbraw/zinc/04/69/14/270046914.db2.gz	FVMRHWLBUNTHCI-SFHVURJKSA-N	0	3	335.407	3.260	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@H](NCCNC(=O)CCCc1ccccc1)CC2	ZINC000424327022	270049023	/nfs/dbraw/zinc/04/90/23/270049023.db2.gz	NXEMNGJYJFFRDO-OAQYLSRUSA-N	0	3	347.462	3.274	20	30		EGEDHN
CCC[C@H](CCc1ccccc1)N[C@@H](C(N)=O)c1ccc(C#N)cc1	ZINC000439602077	270051933	/nfs/dbraw/zinc/05/19/33/270051933.db2.gz	FBOFVWYGDDTPQI-WOJBJXKFSA-N	0	3	335.451	3.476	20	30		EGEDHN
N#Cc1ccc(Br)c(CN2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)c1	ZINC000451419406	270053500	/nfs/dbraw/zinc/05/35/00/270053500.db2.gz	LGLLKRMLMQEFHY-UAGQMJEPSA-N	0	3	349.272	3.446	20	30		EGEDHN
Cc1cc(N(CCN(C)C)Cc2ccc(C#N)cc2)nc(C(C)C)n1	ZINC000471743893	270055318	/nfs/dbraw/zinc/05/53/18/270055318.db2.gz	AECYZYGOLIMHNR-UHFFFAOYSA-N	0	3	337.471	3.348	20	30		EGEDHN
CCCC[C@@H]1CCC[C@@H]1NCCS(=O)(=O)c1ccc(C#N)cc1	ZINC000184696623	266037938	/nfs/dbraw/zinc/03/79/38/266037938.db2.gz	BKBZKGRWEHNJHM-AEFFLSMTSA-N	0	3	334.485	3.280	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)Cc1ccc(C#N)cc1)c1ccccc1	ZINC000194714909	266139865	/nfs/dbraw/zinc/13/98/65/266139865.db2.gz	VUYALLUSDZNSJW-HXUWFJFHSA-N	0	3	335.451	3.300	20	30		EGEDHN
C[C@@H](C(=O)NCCSCc1ccccc1C#N)N1[C@H](C)CC[C@@H]1C	ZINC000195526804	266186735	/nfs/dbraw/zinc/18/67/35/266186735.db2.gz	VGZYKYDZKDNPNE-XHSDSOJGSA-N	0	3	345.512	3.169	20	30		EGEDHN
CCS[C@@H]1CCCCN(C(=O)C(C#N)Cc2ccc(C#N)cc2)C1	ZINC000280498097	266345908	/nfs/dbraw/zinc/34/59/08/266345908.db2.gz	QQEYRSTWISZVJR-ZWKOTPCHSA-N	0	3	341.480	3.375	20	30		EGEDHN
CCS[C@@H]1CCC[C@@H]1NCC(=O)Nc1sc(C)c(C)c1C#N	ZINC000286205129	266346466	/nfs/dbraw/zinc/34/64/66/266346466.db2.gz	QFTLRTDIHLNHSK-UONOGXRCSA-N	0	3	337.514	3.439	20	30		EGEDHN
CC[C@@H](NC(=O)C(C#N)Cc1ccc(C#N)cc1)c1c(C)noc1C	ZINC000348316217	266370397	/nfs/dbraw/zinc/37/03/97/266370397.db2.gz	DVXZZPGBNQPOBH-IAGOWNOFSA-N	0	3	336.395	3.113	20	30		EGEDHN
CCc1nnc(NC[C@@H](c2ccc(C)cc2)N(C)C)c(C#N)c1CC	ZINC000301638260	266457567	/nfs/dbraw/zinc/45/75/67/266457567.db2.gz	XOMVOADBAFDKMO-IBGZPJMESA-N	0	3	337.471	3.496	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)NCC1=CCCCC1	ZINC000297802503	266497909	/nfs/dbraw/zinc/49/79/09/266497909.db2.gz	YEUUMAKNKJFQLR-UHFFFAOYSA-N	0	3	340.471	3.132	20	30		EGEDHN
CCCCN1CCCC[C@H]1CNC(=O)[C@H](C)Oc1ccc(C#N)cc1	ZINC000523342979	267007575	/nfs/dbraw/zinc/00/75/75/267007575.db2.gz	XMIRSRMHSSKSIY-WMZOPIPTSA-N	0	3	343.471	3.096	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1Nc1ccc([N+](=O)[O-])cc1C#N	ZINC000302183786	267056007	/nfs/dbraw/zinc/05/60/07/267056007.db2.gz	SDESLMVUSSKKPI-KUHUBIRLSA-N	0	3	336.395	3.399	20	30		EGEDHN
CCO[C@H]1CCN(Cc2cn(C)nc2-c2ccc(C#N)cc2)C[C@@H]1C	ZINC000449500269	267156416	/nfs/dbraw/zinc/15/64/16/267156416.db2.gz	MVRRDXIZZBHXDQ-KXBFYZLASA-N	0	3	338.455	3.206	20	30		EGEDHN
C[C@H](CNC(=O)C(C)(C)c1cc(F)cc(C#N)c1)N1CCC[C@@H](C)C1	ZINC000285315142	267158647	/nfs/dbraw/zinc/15/86/47/267158647.db2.gz	XETHISOQXZYCBH-HUUCEWRRSA-N	0	3	345.462	3.212	20	30		EGEDHN
C[C@H](CNC(=O)C(C)(C)c1cc(F)cc(C#N)c1)N1CCC[C@H](C)C1	ZINC000285315145	267160022	/nfs/dbraw/zinc/16/00/22/267160022.db2.gz	XETHISOQXZYCBH-LSDHHAIUSA-N	0	3	345.462	3.212	20	30		EGEDHN
C[C@H](NCCOc1ccccc1C#N)c1ccc(Br)cn1	ZINC000280260785	267183378	/nfs/dbraw/zinc/18/33/78/267183378.db2.gz	CEEQQSAPMAKQNN-LBPRGKRZSA-N	0	3	346.228	3.445	20	30		EGEDHN
C[C@H](O)C[C@@H]1CCCCCN1Cc1nnc(-c2ccc(C#N)cc2)o1	ZINC000286059605	267191514	/nfs/dbraw/zinc/19/15/14/267191514.db2.gz	RLJPXOAKPNCCHG-YOEHRIQHSA-N	0	3	340.427	3.124	20	30		EGEDHN
CC[C@H](C)N[C@H](CNC(=O)NCc1ccc(C#N)s1)c1ccco1	ZINC000422205118	267204787	/nfs/dbraw/zinc/20/47/87/267204787.db2.gz	ONJGBNRBYKGXBE-SWLSCSKDSA-N	0	3	346.456	3.141	20	30		EGEDHN
CC[C@H]1CCC[C@H]1C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000448725302	267227568	/nfs/dbraw/zinc/22/75/68/267227568.db2.gz	KKQDQIKIHYYLDL-RBUKOAKNSA-N	0	3	327.472	3.275	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CCN(C(=O)Cc2ccc(C#N)cc2)C1	ZINC000324153959	267234377	/nfs/dbraw/zinc/23/43/77/267234377.db2.gz	OXGOGALWCHOLOG-SFHVURJKSA-N	0	3	347.462	3.081	20	30		EGEDHN
CCn1ccnc1[C@H](C)NC1CCN(Cc2ccc(C#N)cc2)CC1	ZINC000449562282	267259170	/nfs/dbraw/zinc/25/91/70/267259170.db2.gz	ISHKXQINKYJZCR-INIZCTEOSA-N	0	3	337.471	3.090	20	30		EGEDHN
CN(C)CCOc1ccc(NC(=O)/C=C\c2ccc(C#N)cc2)cc1	ZINC000491211839	267281541	/nfs/dbraw/zinc/28/15/41/267281541.db2.gz	HZXWQTJJODZMQY-GHXNOFRVSA-N	0	3	335.407	3.151	20	30		EGEDHN
CN(C)C[C@H](NC(=O)/C=C/c1ccc(C#N)cc1)c1ccc(F)cc1	ZINC000493379544	267282200	/nfs/dbraw/zinc/28/22/00/267282200.db2.gz	FLJDYNYEHNMGBK-UBIUBJKMSA-N	0	3	337.398	3.130	20	30		EGEDHN
CN(C)Cc1ccccc1C(=O)N[C@H]1CCCc2cc(C#N)ccc21	ZINC000416338122	267284177	/nfs/dbraw/zinc/28/41/77/267284177.db2.gz	CJGNVKRIHXVONK-FQEVSTJZSA-N	0	3	333.435	3.427	20	30		EGEDHN
CN(C)[C@H](CNC(=O)CSc1ccccc1C#N)c1ccccc1	ZINC000439695376	267288591	/nfs/dbraw/zinc/28/85/91/267288591.db2.gz	PYFFJQZXRKGKQL-QGZVFWFLSA-N	0	3	339.464	3.069	20	30		EGEDHN
CN(C)[C@H](CNc1ncc([N+](=O)[O-])cc1C#N)c1ccc(Cl)cc1	ZINC000530617943	267289056	/nfs/dbraw/zinc/28/90/56/267289056.db2.gz	JJJAVGIMFYDOMW-OAHLLOKOSA-N	0	3	345.790	3.230	20	30		EGEDHN
CN(CCC(=O)Nc1sccc1C#N)Cc1cc(F)cc(F)c1	ZINC000444711987	267303906	/nfs/dbraw/zinc/30/39/06/267303906.db2.gz	YFJFUQAZONMPFZ-UHFFFAOYSA-N	0	3	335.379	3.359	20	30		EGEDHN
CN(CCC(=O)Nc1ccc(C#N)cc1)Cc1cc(F)cc(F)c1	ZINC000444700686	267304465	/nfs/dbraw/zinc/30/44/65/267304465.db2.gz	GTIMQWHOORSFMK-UHFFFAOYSA-N	0	3	329.350	3.297	20	30		EGEDHN
CN1CC[C@@H]2CN(C(=O)c3ccccc3-c3ccccc3C#N)C[C@@H]21	ZINC000453044109	267339409	/nfs/dbraw/zinc/33/94/09/267339409.db2.gz	XPLWWSWDPNWVNR-UZLBHIALSA-N	0	3	331.419	3.001	20	30		EGEDHN
Cc1cc2ncn(C[C@@H](O)CN[C@@H](C)c3ccc(C#N)cc3)c2cc1C	ZINC000298750194	267367751	/nfs/dbraw/zinc/36/77/51/267367751.db2.gz	VVCNWRNXFONDMP-LPHOPBHVSA-N	0	3	348.450	3.237	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCC2(C(F)(F)F)CCC2)cc1	ZINC000343196570	268085902	/nfs/dbraw/zinc/08/59/02/268085902.db2.gz	METGLQPLZLDIKY-AWEZNQCLSA-N	0	3	335.329	3.089	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCc2nc3ccccc3s2)cc1	ZINC000347985300	268086982	/nfs/dbraw/zinc/08/69/82/268086982.db2.gz	IUHQLUHFCQUQSD-HNNXBMFYSA-N	0	3	346.415	3.167	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N(CCC(F)(F)F)CC2CC2)cc1	ZINC000280207355	268088684	/nfs/dbraw/zinc/08/86/84/268088684.db2.gz	UXKIISWKLMFPHE-MRXNPFEDSA-N	0	3	349.356	3.432	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2Cc3cccc(Cl)c3C2)cc1	ZINC000377080497	268089883	/nfs/dbraw/zinc/08/98/83/268089883.db2.gz	GGRYMAIKEXUAFE-MRXNPFEDSA-N	0	3	335.794	3.436	20	30		EGEDHN
N#Cc1ccc(Cl)cc1NCc1ccccc1CN1CC[C@H](O)C1	ZINC000302034879	268101428	/nfs/dbraw/zinc/10/14/28/268101428.db2.gz	DZHHYNOMMJYZTG-SFHVURJKSA-N	0	3	341.842	3.390	20	30		EGEDHN
N#Cc1ccc(F)c(CNC(=O)[C@H]2CCCCN2C2CCCC2)c1	ZINC000331708565	268102836	/nfs/dbraw/zinc/10/28/36/268102836.db2.gz	BZGKPBXKQONFOL-GOSISDBHSA-N	0	3	329.419	3.111	20	30		EGEDHN
Cc1sccc1C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000448727563	268109176	/nfs/dbraw/zinc/10/91/76/268109176.db2.gz	YRIJZJJSXSKWPN-UHFFFAOYSA-N	0	3	327.453	3.132	20	30		EGEDHN
N#Cc1c(Cl)cccc1NC[C@@H](O)CN1CCc2ccccc2C1	ZINC000450245565	268158667	/nfs/dbraw/zinc/15/86/67/268158667.db2.gz	YORSTCLYYVRPRQ-MRXNPFEDSA-N	0	3	341.842	3.043	20	30		EGEDHN
N#Cc1ccc(C(=O)NC[C@@H]2CCCN2CC2CCCCC2)s1	ZINC000487250203	268200100	/nfs/dbraw/zinc/20/01/00/268200100.db2.gz	AGDHGUOIDFZENP-HNNXBMFYSA-N	0	3	331.485	3.394	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(C/C=C\c3ccncc3)CC2)cc1	ZINC000495055655	268217066	/nfs/dbraw/zinc/21/70/66/268217066.db2.gz	ATKZWUDEXPOIED-IWQZZHSRSA-N	0	3	332.451	3.174	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(CCOCC3CCCC3)CC2)cc1	ZINC000459276468	268217075	/nfs/dbraw/zinc/21/70/75/268217075.db2.gz	FZEAUCBKUBIPHQ-UHFFFAOYSA-N	0	3	341.499	3.273	20	30		EGEDHN
N#Cc1ccc(CN2CCN(C3CCCC3)CC2)c(OC(F)F)c1	ZINC000437419180	268221012	/nfs/dbraw/zinc/22/10/12/268221012.db2.gz	NOAWLBAAGYGFOX-UHFFFAOYSA-N	0	3	335.398	3.220	20	30		EGEDHN
N#Cc1cccc(Oc2ccc(NC(=O)N3CCCNCC3)cc2)c1	ZINC000415153957	268286027	/nfs/dbraw/zinc/28/60/27/268286027.db2.gz	DGZSVNJNCMOVGC-UHFFFAOYSA-N	0	3	336.395	3.178	20	30		EGEDHN
N#Cc1cnn2cc(CN3CC[C@H](CSc4ccccc4)C3)cnc12	ZINC000517373244	268318349	/nfs/dbraw/zinc/31/83/49/268318349.db2.gz	OVXCADDUNUVZEZ-HNNXBMFYSA-N	0	3	349.463	3.215	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H]2SCCc3sccc32)CC1	ZINC000173102273	275417543	/nfs/dbraw/zinc/41/75/43/275417543.db2.gz	QMKGBWKUCHFIRY-INIZCTEOSA-N	0	3	336.526	3.235	20	30		EGEDHN
COc1ccc([C@H](CNc2snc(C)c2C#N)N(C)C)cc1OC	ZINC000287160498	276090676	/nfs/dbraw/zinc/09/06/76/276090676.db2.gz	YJDUMTFNNFOCAE-AWEZNQCLSA-N	0	3	346.456	3.055	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1)C(=O)c1ccc(C#N)c(Cl)c1	ZINC000153834920	307782129	/nfs/dbraw/zinc/78/21/29/307782129.db2.gz	DVZNXPYSPIHROB-UHFFFAOYSA-N	0	3	341.842	3.416	20	30		EGEDHN
CCc1ccc(C(C)(C)NC[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000538260246	314235642	/nfs/dbraw/zinc/23/56/42/314235642.db2.gz	YTFNFMUMXAKLKF-IBGZPJMESA-N	0	3	338.451	3.385	20	30		EGEDHN
CCC(CC)[C@H](CN[C@@H](C)c1ccc(C#N)c(F)c1)N1CCOCC1	ZINC000538510642	314251099	/nfs/dbraw/zinc/25/10/99/314251099.db2.gz	AFWRUBGJGVSOCB-YWZLYKJASA-N	0	3	347.478	3.485	20	30		EGEDHN
CC[C@@H](N[C@H]1CCCN(c2ccc(C#N)cc2F)C1)c1ccn(C)n1	ZINC000541734824	314483774	/nfs/dbraw/zinc/48/37/74/314483774.db2.gz	NVEPYCBQBSJECI-DOTOQJQBSA-N	0	3	341.434	3.141	20	30		EGEDHN
COc1ccc(CN(C)C)cc1NC(=O)c1ccc(F)c(C#N)c1	ZINC000551210543	315145206	/nfs/dbraw/zinc/14/52/06/315145206.db2.gz	IOHMQXZWXHWSQG-UHFFFAOYSA-N	0	3	327.359	3.020	20	30		EGEDHN
C[C@H]1CSC[C@@H]1NCC(=O)Nc1sc2c(c1C#N)CCCCC2	ZINC000552006363	315187475	/nfs/dbraw/zinc/18/74/75/315187475.db2.gz	LLKZEDYGHPOUKD-FZMZJTMJSA-N	0	3	349.525	3.168	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)c2c[nH]c(C#N)c2)N(CC)CC)cc1	ZINC000563736772	316063536	/nfs/dbraw/zinc/06/35/36/316063536.db2.gz	DRDNJFXJACTPSU-LJQANCHMSA-N	0	3	338.455	3.262	20	30		EGEDHN
CN(Cc1cnc2c(C#N)cnn2c1)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000565775161	316368413	/nfs/dbraw/zinc/36/84/13/316368413.db2.gz	IJYSKCPZCOBBNJ-RTBURBONSA-N	0	3	331.423	3.369	20	30		EGEDHN
CCN1CCCC[C@H]1CNC(=O)N[C@H]1CCCc2cc(C#N)ccc21	ZINC000570306032	317037909	/nfs/dbraw/zinc/03/79/09/317037909.db2.gz	FBUKBSKKGITZKO-HKUYNNGSSA-N	0	3	340.471	3.109	20	30		EGEDHN
C[C@H](N[C@H]1CCCN(C)c2ccccc21)C(=O)Nc1cccc(C#N)c1	ZINC000573177316	317446556	/nfs/dbraw/zinc/44/65/56/317446556.db2.gz	QQHUTRYDUGQWCZ-KXBFYZLASA-N	0	3	348.450	3.446	20	30		EGEDHN
CS(=O)(=O)[C@@H]1CCC[C@@H](N[C@H]2CCCCc3cc(C#N)ccc32)C1	ZINC000574858192	317643441	/nfs/dbraw/zinc/64/34/41/317643441.db2.gz	NWLLVXIWGPOEJZ-LMMKCTJWSA-N	0	3	346.496	3.271	20	30		EGEDHN
C[C@@H]1CN(CCC(=O)Nc2ccc(C#N)c(Cl)c2)CC2(CCC2)O1	ZINC000579708973	325149064	/nfs/dbraw/zinc/14/90/64/325149064.db2.gz	MHNNIKZGDHRDER-CYBMUJFWSA-N	0	3	347.846	3.184	20	30		EGEDHN
C[C@H](N[C@H]1CCN(CC(F)(F)F)C1)c1ccc(C#N)cc1Cl	ZINC000581921530	325398649	/nfs/dbraw/zinc/39/86/49/325398649.db2.gz	DXPNDMSJSIRCJQ-JQWIXIFHSA-N	0	3	331.769	3.499	20	30		EGEDHN
CC[C@]1(CO)CCCN1CC#Cc1ccc(OC(F)(F)F)cc1	ZINC000189634776	455224999	/nfs/dbraw/zinc/22/49/99/455224999.db2.gz	WAUVKTCVYYHECE-MRXNPFEDSA-N	0	3	327.346	3.174	20	30		EGEDHN
Cc1ncc(CO)c(/C=N/C[C@H]2CCC[N@@H+]2CC2CCCCC2)c1[O-]	ZINC000264515441	455228133	/nfs/dbraw/zinc/22/81/33/455228133.db2.gz	BKKYQCPOTSTDBE-AGKWGAAGSA-N	0	3	345.487	3.052	20	30		EGEDHN
Cc1ncc(CO)c(/C=N/C[C@H]2CCC[N@H+]2CC2CCCCC2)c1[O-]	ZINC000264515441	455228136	/nfs/dbraw/zinc/22/81/36/455228136.db2.gz	BKKYQCPOTSTDBE-AGKWGAAGSA-N	0	3	345.487	3.052	20	30		EGEDHN
CC(=O)NCCN(CCC1(C#N)CCCCC1)C1CCSCC1	ZINC000411693229	457951368	/nfs/dbraw/zinc/95/13/68/457951368.db2.gz	LWLCRANOFAMWKS-UHFFFAOYSA-N	0	3	337.533	3.184	20	30		EGEDHN
CCOc1cccc([C@@H](C)NC[C@@H](O)COc2ccc(C#N)cc2)c1	ZINC000180710371	455232585	/nfs/dbraw/zinc/23/25/85/455232585.db2.gz	NJFRQSWLPJJJSI-CRAIPNDOSA-N	0	3	340.423	3.047	20	30		EGEDHN
N#Cc1cccc(OCCN2CC[C@H](Oc3cccc(F)c3)C2)c1	ZINC000612174533	460561929	/nfs/dbraw/zinc/56/19/29/460561929.db2.gz	FBYGXYYVMVWRAC-IBGZPJMESA-N	0	3	326.371	3.229	20	30		EGEDHN
C=CCN(Cc1ccc(Cl)s1)C(=O)NCCN(C)C1CC1	ZINC000264877218	455297293	/nfs/dbraw/zinc/29/72/93/455297293.db2.gz	QDOAIJRVPKSISK-UHFFFAOYSA-N	0	3	327.881	3.193	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/CCN(C)CC(F)(F)F)c([O-])c1	ZINC000264807397	455284756	/nfs/dbraw/zinc/28/47/56/455284756.db2.gz	SAYHFCODJUFJTP-RGVLZGJSSA-N	0	3	331.382	3.151	20	30		EGEDHN
N#Cc1ccc(CN2CCC(Nc3cnn(CC4CC4)c3)CC2)cc1	ZINC000183429381	455291095	/nfs/dbraw/zinc/29/10/95/455291095.db2.gz	GDYDVDPXNSRRCM-UHFFFAOYSA-N	0	3	335.455	3.241	20	30		EGEDHN
CC[NH+](CC)Cc1ccccc1C/N=C/c1c([O-])c(C)ncc1CO	ZINC000005335305	452861438	/nfs/dbraw/zinc/86/14/38/452861438.db2.gz	QZMOOQXJWHWACA-CIAFOILYSA-N	0	3	341.455	3.049	20	30		EGEDHN
C[C@]1(C#N)CCCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000612369243	460607420	/nfs/dbraw/zinc/60/74/20/460607420.db2.gz	QOLXFIHEBAGQCF-HXUWFJFHSA-N	0	3	325.456	3.051	20	30		EGEDHN
C=CCN(CCC(=O)NC(=O)Nc1ccccc1)Cc1ccccc1	ZINC000028922725	453825472	/nfs/dbraw/zinc/82/54/72/453825472.db2.gz	HZBBKTKOCKESJF-UHFFFAOYSA-N	0	3	337.423	3.413	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)[C@@H](C)N(C)CCCCc1ccccc1	ZINC000053079762	453856760	/nfs/dbraw/zinc/85/67/60/453856760.db2.gz	BCUGBCSLRMLOKK-YLJYHZDGSA-N	0	3	329.488	3.384	20	30		EGEDHN
CC(C)CN(C(=O)CCc1ccc(C#N)cc1)C1CCN(C)CC1	ZINC000053231373	453866248	/nfs/dbraw/zinc/86/62/48/453866248.db2.gz	JFVRBEVNFHDMIN-UHFFFAOYSA-N	0	3	327.472	3.070	20	30		EGEDHN
CN(C)[C@H](CNc1ccc(C#N)cc1[N+](=O)[O-])c1cccc(F)c1	ZINC000032534030	453877939	/nfs/dbraw/zinc/87/79/39/453877939.db2.gz	PBPQLAOEJHUXIM-QGZVFWFLSA-N	0	3	328.347	3.320	20	30		EGEDHN
C[C@H]1C[C@@H]1c1ccc(CNC2CCN(c3ccc(C#N)cn3)CC2)o1	ZINC000067011021	453893811	/nfs/dbraw/zinc/89/38/11/453893811.db2.gz	CWOMLGRSMVEOKJ-KSSFIOAISA-N	0	3	336.439	3.428	20	30		EGEDHN
CN1CCC(N(Cc2ccco2)C(=O)/C=C/c2cccc(C#N)c2)CC1	ZINC000075555201	453904731	/nfs/dbraw/zinc/90/47/31/453904731.db2.gz	WAXBAHRLIJIMPY-BQYQJAHWSA-N	0	3	349.434	3.287	20	30		EGEDHN
N#Cc1ccccc1N1CCCN(CCc2ccc3c(c2)CCO3)CC1	ZINC000075626246	453911659	/nfs/dbraw/zinc/91/16/59/453911659.db2.gz	KKKSODITJTZBEI-UHFFFAOYSA-N	0	3	347.462	3.248	20	30		EGEDHN
Cc1ccc([C@@H]2CCC[C@H]2N(C)CC(=O)N[C@@](C)(C#N)C2CC2)cc1	ZINC000075886399	453935433	/nfs/dbraw/zinc/93/54/33/453935433.db2.gz	CQTFVQJFBRCBRW-ZVDOUQERSA-N	0	3	339.483	3.371	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCC#Cc2ccccc2)C1	ZINC000054717520	453944510	/nfs/dbraw/zinc/94/45/10/453944510.db2.gz	FTHFSPBPFIJFHF-RXVVDRJESA-N	0	3	347.462	3.173	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1CC[C@@H](OCCC(C)C)C1	ZINC000083247880	453946527	/nfs/dbraw/zinc/94/65/27/453946527.db2.gz	LSXZQLGWJIHDET-QGZVFWFLSA-N	0	3	332.444	3.083	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@](C)(NCc1cccc(C#N)c1)C1CC1	ZINC000083456033	453949086	/nfs/dbraw/zinc/94/90/86/453949086.db2.gz	SFALHHVNJLOYKO-LJQANCHMSA-N	0	3	329.444	3.341	20	30		EGEDHN
CCS[C@H]1CC[C@@H](N(C)CC(=O)N(C)C2(C#N)CCCCC2)C1	ZINC000076069640	453958032	/nfs/dbraw/zinc/95/80/32/453958032.db2.gz	YHDUICLCCGPIGX-CVEARBPZSA-N	0	3	337.533	3.277	20	30		EGEDHN
Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@@H]1N2C(=O)c1cc(C#N)cs1	ZINC000084073454	453967711	/nfs/dbraw/zinc/96/77/11/453967711.db2.gz	VBESFAKUVBVCNP-RDJZCZTQSA-N	0	3	337.448	3.376	20	30		EGEDHN
CC(C)C[C@@H](NCC(=O)NCC#N)c1cccc(C(F)(F)F)c1	ZINC000181882127	455393786	/nfs/dbraw/zinc/39/37/86/455393786.db2.gz	LODYRVCGDDPJFR-CQSZACIVSA-N	0	3	327.350	3.022	20	30		EGEDHN
C=CCN(CCc1ccccc1)C[C@@H](O)COc1ccc(C#N)cc1	ZINC000068334421	454017884	/nfs/dbraw/zinc/01/78/84/454017884.db2.gz	CBIXLNSEBXXUGI-HXUWFJFHSA-N	0	3	336.435	3.029	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN2CC[C@@H](Nc3ccccc3)C2)c1	ZINC000076757185	454033962	/nfs/dbraw/zinc/03/39/62/454033962.db2.gz	HKRIYVDRGUIBDN-LJQANCHMSA-N	0	3	334.423	3.073	20	30		EGEDHN
CC(C)CC[C@@H](C)NC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000042999295	454035980	/nfs/dbraw/zinc/03/59/80/454035980.db2.gz	KZXKJPVHJPUNQJ-QGZVFWFLSA-N	0	3	344.503	3.456	20	30		EGEDHN
CN(C)Cc1cccc(NC(=O)N(CCC#N)Cc2ccccn2)c1	ZINC000086163823	454042397	/nfs/dbraw/zinc/04/23/97/454042397.db2.gz	QXLBBARMMRNPEN-UHFFFAOYSA-N	0	3	337.427	3.091	20	30		EGEDHN
CN(Cc1cccc(Cl)c1)C[C@H](O)COc1ccc(C#N)cc1	ZINC000068845423	454060177	/nfs/dbraw/zinc/06/01/77/454060177.db2.gz	OBYMEHYDDNGEIE-KRWDZBQOSA-N	0	3	330.815	3.083	20	30		EGEDHN
C=CCC[C@H](O)CN(C)[C@@H]1c2cc(Cl)cc(Cl)c2C[C@H]1O	ZINC000245982028	455409536	/nfs/dbraw/zinc/40/95/36/455409536.db2.gz	DDVVHYPWYPWORV-IUIKQTSFSA-N	0	3	330.255	3.210	20	30		EGEDHN
CN(C)CCN(Cc1ccco1)C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000088338638	454099941	/nfs/dbraw/zinc/09/99/41/454099941.db2.gz	FRQMKUWIGZVUMU-UHFFFAOYSA-N	0	3	346.818	3.400	20	30		EGEDHN
COC[C@@H](N[C@H](C)C(=O)N(CCC#N)c1cc(C)cc(C)c1)C(C)C	ZINC000130281456	454187488	/nfs/dbraw/zinc/18/74/88/454187488.db2.gz	KNSVBQWOIJOZSO-IEBWSBKVSA-N	0	3	345.487	3.199	20	30		EGEDHN
CCc1ccc([C@H](NCC(=O)N(CCC#N)CCC#N)C(C)C)cc1	ZINC000071122716	454200614	/nfs/dbraw/zinc/20/06/14/454200614.db2.gz	ZYYHZIZWRJIYBO-HXUWFJFHSA-N	0	3	340.471	3.192	20	30		EGEDHN
C=CCC[C@H](O)CN(C)Cc1cc(OC)c(OC)cc1SC	ZINC000130804601	454219448	/nfs/dbraw/zinc/21/94/48/454219448.db2.gz	ULXIRORXMXRQIV-AWEZNQCLSA-N	0	3	325.474	3.185	20	30		EGEDHN
N#Cc1ccc(CNCc2ccc(N3CCC(CO)CC3)cc2)cc1	ZINC000071825311	454226043	/nfs/dbraw/zinc/22/60/43/454226043.db2.gz	AQARQMFDMQYPCF-UHFFFAOYSA-N	0	3	335.451	3.057	20	30		EGEDHN
CN(CC#Cc1ccc(OC(F)(F)F)cc1)C1CCC(CO)CC1	ZINC000089924630	454236208	/nfs/dbraw/zinc/23/62/08/454236208.db2.gz	LRLYHWMQDPUSHB-UHFFFAOYSA-N	0	3	341.373	3.420	20	30		EGEDHN
CN(CCC(=O)N(C)CCC#N)Cc1cc(Cl)cc(Cl)c1	ZINC000131169085	454239901	/nfs/dbraw/zinc/23/99/01/454239901.db2.gz	RQOKOCLNRCOWOQ-UHFFFAOYSA-N	0	3	328.243	3.187	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc(NC(=O)OC)cc2)CC1	ZINC000071880044	454241087	/nfs/dbraw/zinc/24/10/87/454241087.db2.gz	UXYCZTXSBNXEGS-UHFFFAOYSA-N	0	3	346.431	3.027	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@@H](C)N1CCC(c2ccc(O)cc2)CC1	ZINC000078682696	454299328	/nfs/dbraw/zinc/29/93/28/454299328.db2.gz	VPJUIAVCIGNRNX-MRXNPFEDSA-N	0	3	328.456	3.161	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)CCc1ccc(C#N)cc1	ZINC000182102163	455436370	/nfs/dbraw/zinc/43/63/70/455436370.db2.gz	URGNECOEXRYXIT-KRWDZBQOSA-N	0	3	335.451	3.128	20	30		EGEDHN
C[C@@H]1C[C@H](N(C)C(=O)C2(C#N)CCC2)CCN1Cc1ccccc1	ZINC000132303600	454328733	/nfs/dbraw/zinc/32/87/33/454328733.db2.gz	OOROTCVQSLKIAV-SJLPKXTDSA-N	0	3	325.456	3.192	20	30		EGEDHN
C#CCOc1ccc([C@H](C)NCc2c(CC)nn(C)c2CC)cc1	ZINC000090846431	454344940	/nfs/dbraw/zinc/34/49/40/454344940.db2.gz	JTOLKBKCFQVKBV-HNNXBMFYSA-N	0	3	325.456	3.408	20	30		EGEDHN
C=C(C)CN(CC)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000079167243	454377255	/nfs/dbraw/zinc/37/72/55/454377255.db2.gz	ASNMSQHBDFAJJG-UHFFFAOYSA-N	0	3	329.488	3.301	20	30		EGEDHN
CCN(CCC#N)C(=O)CN(CCc1ccccc1)C1CCCC1	ZINC000063754632	454444972	/nfs/dbraw/zinc/44/49/72/454444972.db2.gz	NBEVRWPNCIOQEF-UHFFFAOYSA-N	0	3	327.472	3.236	20	30		EGEDHN
CCn1nc(C(C)C)cc1C(=O)C(C#N)c1nc2ccccc2n1C	ZINC000122109009	454510006	/nfs/dbraw/zinc/51/00/06/454510006.db2.gz	DZCWMRGYTDIERL-ZDUSSCGKSA-N	0	3	335.411	3.403	20	30		EGEDHN
C[C@@H](NCc1cccc(C#N)c1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000048744895	454513114	/nfs/dbraw/zinc/51/31/14/454513114.db2.gz	CNGFZAOVTZMPGN-OAHLLOKOSA-N	0	3	349.434	3.066	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)[C@@H]1CCOc2ccccc21)C(C)C	ZINC000102941948	454527568	/nfs/dbraw/zinc/52/75/68/454527568.db2.gz	INEOBSBGZXISLU-RTBURBONSA-N	0	3	342.483	3.368	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@@H]2CCCO[C@H]2c2ccc(C)cc2)CC1	ZINC000080079614	454529185	/nfs/dbraw/zinc/52/91/85/454529185.db2.gz	JPHVITGTLAQYAY-UXHICEINSA-N	0	3	342.483	3.229	20	30		EGEDHN
C=CCSCCNC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000080104204	454533315	/nfs/dbraw/zinc/53/33/15/454533315.db2.gz	VOFHXMKRYDEZLE-FUHWJXTLSA-N	0	3	347.528	3.258	20	30		EGEDHN
C=CCOc1ccc(C(F)(F)F)cc1C(=O)NC[C@H]1CCCN1C	ZINC000122485285	454538334	/nfs/dbraw/zinc/53/83/34/454538334.db2.gz	XQWDJTKQYPTBMO-CYBMUJFWSA-N	0	3	342.361	3.094	20	30		EGEDHN
CC[C@@H](CNC(=O)c1cccc(CC#N)c1)N1CCc2ccccc2C1	ZINC000049676304	454555479	/nfs/dbraw/zinc/55/54/79/454555479.db2.gz	ZGFHGFOKNVYKHA-NRFANRHFSA-N	0	3	347.462	3.319	20	30		EGEDHN
COc1cccc(CC(=O)C(C#N)C(=O)Nc2ccccc2Cl)c1	ZINC000103504450	454561382	/nfs/dbraw/zinc/56/13/82/454561382.db2.gz	IIBRDUVJLJIDEO-CQSZACIVSA-N	0	3	342.782	3.239	20	30		EGEDHN
C#CCNC(=O)[C@H](C)N[C@@H](Cc1ccccc1)c1sccc1C	ZINC000122766720	454567187	/nfs/dbraw/zinc/56/71/87/454567187.db2.gz	KKGZHEBELTULGO-RDJZCZTQSA-N	0	3	326.465	3.068	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCCOc2ccccc2C)CC1	ZINC000106037217	454674976	/nfs/dbraw/zinc/67/49/76/454674976.db2.gz	BAVSQSMXVGCSHO-UHFFFAOYSA-N	0	3	330.472	3.311	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)Cc2ccc(F)c(F)c2)CC1	ZINC000106275891	454689845	/nfs/dbraw/zinc/68/98/45/454689845.db2.gz	IQQSMNKVWVKLQI-UHFFFAOYSA-N	0	3	337.414	3.147	20	30		EGEDHN
C=CCN(Cc1ccccc1)C(=O)NC1CCN(CC(=C)C)CC1	ZINC000106341100	454691754	/nfs/dbraw/zinc/69/17/54/454691754.db2.gz	NEIRSXWYKJIWHB-UHFFFAOYSA-N	0	3	327.472	3.425	20	30		EGEDHN
CC[C@]1(NCC(=O)Nc2ccccc2SC[C@H](C)C#N)CCOC1	ZINC000616866129	460648564	/nfs/dbraw/zinc/64/85/64/460648564.db2.gz	QGBCZNPWCACOBG-KDOFPFPSSA-N	0	3	347.484	3.036	20	30		EGEDHN
C#CCN(Cc1ccc(OCc2noc(C)n2)cc1)C1CCCC1	ZINC000093819826	454738627	/nfs/dbraw/zinc/73/86/27/454738627.db2.gz	YDJIHNAKZZSWAY-UHFFFAOYSA-N	0	3	325.412	3.335	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2C[C@H](OCC)C23CCCC3)CC1	ZINC000176500328	454752566	/nfs/dbraw/zinc/75/25/66/454752566.db2.gz	LKYANDLSVSJKMA-MSOLQXFVSA-N	0	3	349.519	3.064	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCC(C(F)(F)F)CC2)CC1	ZINC000176498035	454753190	/nfs/dbraw/zinc/75/31/90/454753190.db2.gz	HLOMDMNBFGEQND-UHFFFAOYSA-N	0	3	333.398	3.011	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)N1[C@@H]2CC[C@H]1CN(CC)CC2	ZINC000176510237	454753725	/nfs/dbraw/zinc/75/37/25/454753725.db2.gz	AQSSWRPIIIXOIO-MSOLQXFVSA-N	0	3	343.471	3.020	20	30		EGEDHN
C[C@H](CC#N)Sc1ccccc1NC(=O)CN[C@H](C)[C@@H]1CCOC1	ZINC000162755308	454798620	/nfs/dbraw/zinc/79/86/20/454798620.db2.gz	PNXSBMVFNGMXFD-RBSFLKMASA-N	0	3	347.484	3.034	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)c1cc(C#N)cs1)c1ccsc1	ZINC000177422893	454862615	/nfs/dbraw/zinc/86/26/15/454862615.db2.gz	WEZSQEWFTUTBKS-CQSZACIVSA-N	0	3	333.482	3.494	20	30		EGEDHN
C[C@@H]1CN(CCC2CCN(Cc3ccccc3C#N)CC2)C[C@@H](C)O1	ZINC000177482273	454869040	/nfs/dbraw/zinc/86/90/40/454869040.db2.gz	DSHGRLYXKXIMIG-QZTJIDSGSA-N	0	3	341.499	3.270	20	30		EGEDHN
C[C@H](Cn1cc(Br)cn1)N[C@@H](C)c1ccc(C#N)cc1	ZINC000154331958	454886495	/nfs/dbraw/zinc/88/64/95/454886495.db2.gz	IYXDCRCDXNIXON-NEPJUHHUSA-N	0	3	333.233	3.257	20	30		EGEDHN
Cc1cccc(C2(CN[C@@H](C)C(=O)N(C)CCC#N)CCCC2)c1	ZINC000112541711	454889075	/nfs/dbraw/zinc/88/90/75/454889075.db2.gz	LKXPZNRZUKFMFO-KRWDZBQOSA-N	0	3	327.472	3.157	20	30		EGEDHN
N#Cc1ccccc1COc1cccc(CN2CCC[C@@H](CO)C2)c1	ZINC000154577061	454909123	/nfs/dbraw/zinc/90/91/23/454909123.db2.gz	PYLPESCKXLQMGX-GOSISDBHSA-N	0	3	336.435	3.342	20	30		EGEDHN
C=CCOc1ccccc1CNCCC(=O)Nc1ccc(C)cn1	ZINC000113353442	454924133	/nfs/dbraw/zinc/92/41/33/454924133.db2.gz	XLWMTGAYALTRGD-UHFFFAOYSA-N	0	3	325.412	3.073	20	30		EGEDHN
C#CCOc1ccc([C@@H](C)N[C@H]2CCN(c3ncccc3F)C2)cc1	ZINC000168153081	454924541	/nfs/dbraw/zinc/92/45/41/454924541.db2.gz	XEGGNQYSYBOWLZ-WBVHZDCISA-N	0	3	339.414	3.162	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@H](CNC(=O)c3ccccc3)C2)c1	ZINC000178054741	454930787	/nfs/dbraw/zinc/93/07/87/454930787.db2.gz	WNUUXBQHWQAIMH-IBGZPJMESA-N	0	3	333.435	3.200	20	30		EGEDHN
COc1cc(OC)cc(OCCCNCc2ccc(C#N)s2)c1	ZINC000151148840	454945092	/nfs/dbraw/zinc/94/50/92/454945092.db2.gz	UJTNDKZNNBDGON-UHFFFAOYSA-N	0	3	332.425	3.196	20	30		EGEDHN
COc1ccc(CN2CCCN(Cc3ccccc3)CC2)cc1C#N	ZINC000127307503	454953016	/nfs/dbraw/zinc/95/30/16/454953016.db2.gz	XNDGULMCRUFHNZ-UHFFFAOYSA-N	0	3	335.451	3.275	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(C)cc(Br)c2)CC1	ZINC000127437075	454964409	/nfs/dbraw/zinc/96/44/09/454964409.db2.gz	RDABGDFEJJBHMA-UHFFFAOYSA-N	0	3	337.261	3.138	20	30		EGEDHN
CCN1CCN([C@@H](C)CNc2cc(C#N)ccc2C(F)(F)F)CC1	ZINC000127747574	454994138	/nfs/dbraw/zinc/99/41/38/454994138.db2.gz	HGAYEJFXIYWCPW-ZDUSSCGKSA-N	0	3	340.393	3.015	20	30		EGEDHN
C#CCCCCNC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000152019309	455062397	/nfs/dbraw/zinc/06/23/97/455062397.db2.gz	KVWFBVAVZBZQBP-PKOBYXMFSA-N	0	3	327.472	3.142	20	30		EGEDHN
C=CCN1CCC(NC(=O)Cc2c[nH]c3cc(Cl)ccc23)CC1	ZINC000171715152	455088397	/nfs/dbraw/zinc/08/83/97/455088397.db2.gz	NKSKWXDSTJUVKB-UHFFFAOYSA-N	0	3	331.847	3.130	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN(C)C1CCC(CO)CC1	ZINC000156257828	455098020	/nfs/dbraw/zinc/09/80/20/455098020.db2.gz	NWNFVQDQRJJPTP-UHFFFAOYSA-N	0	3	348.512	3.386	20	30		EGEDHN
CN(C)Cc1cccc(NC(=O)N(CCC#N)Cc2ccco2)c1	ZINC000172043332	455112848	/nfs/dbraw/zinc/11/28/48/455112848.db2.gz	ACBCULMDKACSLL-UHFFFAOYSA-N	0	3	326.400	3.289	20	30		EGEDHN
COc1cccc(CNCc2cn(C)nc2-c2ccc(C#N)cc2)c1	ZINC000180033686	455120447	/nfs/dbraw/zinc/12/04/47/455120447.db2.gz	LFWNHYUGZLIFMJ-UHFFFAOYSA-N	0	3	332.407	3.257	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)Nc1ccc(OCCN2CCCC2)c(C)c1	ZINC000119142776	455128020	/nfs/dbraw/zinc/12/80/20/455128020.db2.gz	SCBIZYYTRIFXMH-QGZVFWFLSA-N	0	3	346.471	3.389	20	30		EGEDHN
CC(C)(O)[C@@H]1CCCN1CC#Cc1ccc(OC(F)(F)F)cc1	ZINC000119136272	455128590	/nfs/dbraw/zinc/12/85/90/455128590.db2.gz	CRWBVMGIFXSMRO-HNNXBMFYSA-N	0	3	327.346	3.172	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@](C)(c3ccccc3)C2)CC1	ZINC000172265118	455141163	/nfs/dbraw/zinc/14/11/63/455141163.db2.gz	BQJIQVCUWXPDIR-NRFANRHFSA-N	0	3	341.499	3.400	20	30		EGEDHN
C=CCc1cc(CN(CCO)Cc2ccccc2)cc(OC)c1O	ZINC000158307427	455290345	/nfs/dbraw/zinc/29/03/45/455290345.db2.gz	DMTAHITWJOGWMW-UHFFFAOYSA-N	0	3	327.424	3.124	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN(C)CCc1ncc(C)s1	ZINC000157406050	455191606	/nfs/dbraw/zinc/19/16/06/455191606.db2.gz	YEXOILFMJNKEBL-KRWDZBQOSA-N	0	3	346.496	3.094	20	30		EGEDHN
CC[C@@H]1CN([C@@H](C)C(=O)N(C)CCC#N)CC[C@H]1c1ccccc1	ZINC000245411582	455291018	/nfs/dbraw/zinc/29/10/18/455291018.db2.gz	XNPINOIYKCZAAH-YQVWRLOYSA-N	0	3	327.472	3.263	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc(OC(F)F)cc2)CC1	ZINC000264382900	455201992	/nfs/dbraw/zinc/20/19/92/455201992.db2.gz	LPWNRCSFXFIHBO-UHFFFAOYSA-N	0	3	339.386	3.450	20	30		EGEDHN
COc1cccc([C@H](CNc2ccc([N+](=O)[O-])c(C#N)c2)N(C)C)c1	ZINC000157544787	455206254	/nfs/dbraw/zinc/20/62/54/455206254.db2.gz	OYVFECVUBRFBPZ-SFHVURJKSA-N	0	3	340.383	3.190	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc(F)cc2OCC)CC1	ZINC000264413956	455208511	/nfs/dbraw/zinc/20/85/11/455208511.db2.gz	RNDWQYXQSJIXIE-UHFFFAOYSA-N	0	3	335.423	3.386	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](c2ccc(C)cc2)C2CC2)CC1	ZINC000264425749	455210564	/nfs/dbraw/zinc/21/05/64/455210564.db2.gz	SKBKHAYERKIUPU-LJQANCHMSA-N	0	3	327.472	3.396	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(OCC(F)(F)F)cc2)CC1	ZINC000264456458	455217655	/nfs/dbraw/zinc/21/76/55/455217655.db2.gz	DSVQDGPCTFXSHC-UHFFFAOYSA-N	0	3	342.361	3.008	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2C[C@H](C)C[C@H]2c2cccnc2)CC1	ZINC000183344461	455279809	/nfs/dbraw/zinc/27/98/09/455279809.db2.gz	VMWIZHGZCJTYHO-APWZRJJASA-N	0	3	342.487	3.215	20	30		EGEDHN
COc1cccc(/C=N/C2CCN([C@H](C)c3ccncc3)CC2)c1O	ZINC000158274473	455286939	/nfs/dbraw/zinc/28/69/39/455286939.db2.gz	RLCIZVMRSFNBPK-QQHUYRGFSA-N	0	3	339.439	3.440	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN[C@H](C[C@@H]1CCOC1)c1ccccc1	ZINC000181203907	455301577	/nfs/dbraw/zinc/30/15/77/455301577.db2.gz	NUFRKGPWBBRABS-PKOBYXMFSA-N	0	3	330.472	3.169	20	30		EGEDHN
C=CCCC[C@H](C)NC(=O)NCC1CCN(c2ccncc2)CC1	ZINC000181397397	455329253	/nfs/dbraw/zinc/32/92/53/455329253.db2.gz	UTNCDYIKAASJOX-INIZCTEOSA-N	0	3	330.476	3.342	20	30		EGEDHN
Cc1ccc([C@@H](C)[NH2+][C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)c([O-])c1	ZINC000190605383	455352107	/nfs/dbraw/zinc/35/21/07/455352107.db2.gz	MEYCQKJYDVGJOW-DNVCBOLYSA-N	0	3	349.434	3.024	20	30		EGEDHN
C[C@@H](NCc1ccc(CN2CCN(C)CC2)cc1)c1cccc(C#N)c1	ZINC000181541614	455352572	/nfs/dbraw/zinc/35/25/72/455352572.db2.gz	RCXCAWYWYNNOQS-GOSISDBHSA-N	0	3	348.494	3.156	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](NC3CC(c4ccccc4)C3)C2=O)cc1	ZINC000190619046	455354020	/nfs/dbraw/zinc/35/40/20/455354020.db2.gz	BZLCYRIRWVGNOM-XVAXZDLZSA-N	0	3	345.446	3.195	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](N[C@@H]3CCCc4ccccc43)C2=O)cc1	ZINC000190616144	455354766	/nfs/dbraw/zinc/35/47/66/455354766.db2.gz	PLAAQQFNPGDTKN-NHCUHLMSSA-N	0	3	345.446	3.326	20	30		EGEDHN
Cc1ccccc1[C@H](C)N[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000190623979	455355191	/nfs/dbraw/zinc/35/51/91/455355191.db2.gz	PYXLGGFPIMCYQH-OXJNMPFZSA-N	0	3	333.435	3.318	20	30		EGEDHN
C[C@@H](NCC(=O)N[C@@](C)(C#N)C1CC1)c1cc2ccccc2s1	ZINC000184365946	455373676	/nfs/dbraw/zinc/37/36/76/455373676.db2.gz	ITLTWXNYQJJDQP-XIKOKIGWSA-N	0	3	327.453	3.360	20	30		EGEDHN
CCCN(CC(=O)Nc1sccc1C#N)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C	ZINC000265819664	455386913	/nfs/dbraw/zinc/38/69/13/455386913.db2.gz	ATTASWCRNBYTDB-BMFZPTHFSA-N	0	3	347.484	3.084	20	30		EGEDHN
C[C@H]1CN(Cc2cccc(C#N)c2)CC[C@H]1NC(=O)OC(C)(C)C	ZINC000265849985	455392207	/nfs/dbraw/zinc/39/22/07/455392207.db2.gz	PQVBXHGQDCQOJJ-WMLDXEAASA-N	0	3	329.444	3.293	20	30		EGEDHN
C=CCCCC(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000175358900	455441269	/nfs/dbraw/zinc/44/12/69/455441269.db2.gz	ADFVDVZHZRVGTO-UHFFFAOYSA-N	0	3	329.488	3.061	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC[C@H](Cc3ccccc3)[C@H]2C)CC1	ZINC000266916840	455474600	/nfs/dbraw/zinc/47/46/00/455474600.db2.gz	BDXNUCVYERLMBX-IEBWSBKVSA-N	0	3	341.499	3.300	20	30		EGEDHN
CN(CCC#N)C(=O)CCN[C@H](Cc1ccccc1)c1cccs1	ZINC000184987705	455483174	/nfs/dbraw/zinc/48/31/74/455483174.db2.gz	JOPOTBWXTUIERS-QGZVFWFLSA-N	0	3	341.480	3.384	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN[C@@H]2CCO[C@H]2c2ccccc2)c1	ZINC000191973239	455537829	/nfs/dbraw/zinc/53/78/29/455537829.db2.gz	RMVPMRKPGIWJCV-QUCCMNQESA-N	0	3	335.407	3.007	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H](C)c2cn(C)c3ccccc23)CC1	ZINC000185330959	455541424	/nfs/dbraw/zinc/54/14/24/455541424.db2.gz	NQVYQKZSFCSPKD-INIZCTEOSA-N	0	3	339.483	3.439	20	30		EGEDHN
CN(CC#Cc1ccccc1)C1CCN(C(=O)OC(C)(C)C)CC1	ZINC000192055720	455549477	/nfs/dbraw/zinc/54/94/77/455549477.db2.gz	YGUKIANYIZOGGL-UHFFFAOYSA-N	0	3	328.456	3.369	20	30		EGEDHN
CC[C@H](Cc1ccccc1)N(CC)CC(=O)N[C@](C)(C#N)C1CC1	ZINC000247380762	455593838	/nfs/dbraw/zinc/59/38/38/455593838.db2.gz	IARZCMDPLDDGHO-UYAOXDASSA-N	0	3	327.472	3.138	20	30		EGEDHN
N#Cc1cccc(OCCN2CCC[C@@H]2C[C@@H](O)c2ccco2)c1	ZINC000268247709	455630252	/nfs/dbraw/zinc/63/02/52/455630252.db2.gz	ILQJDHSDHSMXRN-SJLPKXTDSA-N	0	3	326.396	3.118	20	30		EGEDHN
C=C(C)[C@@H](NC(=O)N1CCC[C@@H](N(C)C)C1)c1ccc(F)c(F)c1	ZINC000185836857	455632540	/nfs/dbraw/zinc/63/25/40/455632540.db2.gz	YDAYZWCHJPLEEQ-RHSMWYFYSA-N	0	3	337.414	3.318	20	30		EGEDHN
C=CCC[C@@H](NC(=O)N1CC[C@@]2(CCN(C)C2)C1)c1ccccc1	ZINC000292509011	455683499	/nfs/dbraw/zinc/68/34/99/455683499.db2.gz	HLZVEHFEAXKEGR-UYAOXDASSA-N	0	3	327.472	3.431	20	30		EGEDHN
CN1CC[C@@]2(CCN(C(=O)c3ccccc3-c3ccccc3C#N)C2)C1	ZINC000292544750	455692901	/nfs/dbraw/zinc/69/29/01/455692901.db2.gz	LUYWMVBGHCKDSS-JOCHJYFZSA-N	0	3	345.446	3.393	20	30		EGEDHN
CCCCCNC(=O)C1CCN(Cc2ccc(C#N)cc2C)CC1	ZINC000186168607	455708768	/nfs/dbraw/zinc/70/87/68/455708768.db2.gz	PMLAMLQVUODXGE-UHFFFAOYSA-N	0	3	327.472	3.385	20	30		EGEDHN
CCC[C@H](C)NC(=O)[C@@H]1CCCN(Cc2ccc(C#N)cc2C)C1	ZINC000186191825	455714190	/nfs/dbraw/zinc/71/41/90/455714190.db2.gz	KEFSWRUJAIYXAI-QFBILLFUSA-N	0	3	327.472	3.384	20	30		EGEDHN
Cc1ccc(NC(=O)[C@H]2CCCN(Cc3ccc(C#N)cc3C)C2)nc1	ZINC000186296184	455737043	/nfs/dbraw/zinc/73/70/43/455737043.db2.gz	GITVLLNPNDGPDI-IBGZPJMESA-N	0	3	348.450	3.421	20	30		EGEDHN
Cc1cc(C#N)ccc1CN[C@@H](CN1CCOCC1)c1ccccc1	ZINC000186318408	455741426	/nfs/dbraw/zinc/74/14/26/455741426.db2.gz	BIFSKOCDHDQRSW-NRFANRHFSA-N	0	3	335.451	3.030	20	30		EGEDHN
C[C@H](N[C@H]1CCC[C@@H](C#N)C1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000249043186	455742640	/nfs/dbraw/zinc/74/26/40/455742640.db2.gz	VHQJTRJBYFWQRU-DAYGRLMNSA-N	0	3	341.455	3.077	20	30		EGEDHN
Cc1ccc(C)c(OC[C@H](O)CNC2(c3cccc(C#N)c3)CC2)c1	ZINC000271751960	455746344	/nfs/dbraw/zinc/74/63/44/455746344.db2.gz	GBYIUHFGKZKPKC-LJQANCHMSA-N	0	3	336.435	3.194	20	30		EGEDHN
C#CCNC(=O)CCN(C)[C@@H](C)c1sc(-c2ccccc2)nc1C	ZINC000292935741	455766846	/nfs/dbraw/zinc/76/68/46/455766846.db2.gz	ZMBNQTLRKZNBMR-HNNXBMFYSA-N	0	3	341.480	3.251	20	30		EGEDHN
C=C(C)CN1CCC(Nc2cccc(C(=O)OC(C)(C)C)n2)CC1	ZINC000292956112	455767714	/nfs/dbraw/zinc/76/77/14/455767714.db2.gz	CJAQVXYXVHPNMM-UHFFFAOYSA-N	0	3	331.460	3.489	20	30		EGEDHN
CCCC[C@H](NCC(=O)N(CC)CCC#N)c1ccc(OC)cc1	ZINC000271828506	455778725	/nfs/dbraw/zinc/77/87/25/455778725.db2.gz	PAPUKSNGIDHBHF-SFHVURJKSA-N	0	3	331.460	3.278	20	30		EGEDHN
CC(C)[C@H]1CN(Cc2cn(C)nc2-c2ccc(C#N)cc2)CCCO1	ZINC000293297361	455782188	/nfs/dbraw/zinc/78/21/88/455782188.db2.gz	WIIYOTPEXHCQFX-LJQANCHMSA-N	0	3	338.455	3.206	20	30		EGEDHN
C=CCc1cc(CN2CCSC3(CCOCC3)C2)cc(OC)c1O	ZINC000186501510	455782872	/nfs/dbraw/zinc/78/28/72/455782872.db2.gz	PZUICIRLYDDYMF-UHFFFAOYSA-N	0	3	349.496	3.227	20	30		EGEDHN
CC[C@H](NC[C@H](O)c1cc(OC)ccc1OC)c1ccc(C#N)cc1	ZINC000278220577	455789526	/nfs/dbraw/zinc/78/95/26/455789526.db2.gz	IZJBTNGQDRNFIH-OALUTQOASA-N	0	3	340.423	3.350	20	30		EGEDHN
CC[C@](C)(C#N)C(=O)Nc1ccc(N(C)C2CCN(C)CC2)cc1	ZINC000285178839	455801249	/nfs/dbraw/zinc/80/12/49/455801249.db2.gz	UMJZQAJWDFMAOM-LJQANCHMSA-N	0	3	328.460	3.095	20	30		EGEDHN
N#CCCn1cc(CN2CCC[C@@H](CO)CC2)c(-c2ccccc2)n1	ZINC000294197041	455807815	/nfs/dbraw/zinc/80/78/15/455807815.db2.gz	XOVZWDUCJJVJOJ-QGZVFWFLSA-N	0	3	338.455	3.058	20	30		EGEDHN
CN(CCC#N)c1ccc(CN[C@H]2CCO[C@@H]2c2cccnc2)cc1	ZINC000285261600	455814744	/nfs/dbraw/zinc/81/47/44/455814744.db2.gz	ZQPHERFDCAFAQK-VQTJNVASSA-N	0	3	336.439	3.051	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)C[C@H]1C=CCCC1	ZINC000186731289	455830128	/nfs/dbraw/zinc/83/01/28/455830128.db2.gz	WBGXAIFTLZZILH-KRWDZBQOSA-N	0	3	325.456	3.195	20	30		EGEDHN
CC[C@H](C)[N-]C(=S)C(C(=O)c1nccs1)[n+]1ccc(C)cc1	ZINC000278367926	455831009	/nfs/dbraw/zinc/83/10/09/455831009.db2.gz	ZHIMWIJMWIPVSS-LBPRGKRZSA-O	0	3	334.490	3.066	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)NCC2(C)CCCC2)cc1	ZINC000278516755	455838456	/nfs/dbraw/zinc/83/84/56/455838456.db2.gz	BZXXUDWCOVVEGE-ZDUSSCGKSA-N	0	3	349.456	3.074	20	30		EGEDHN
CN(C[C@H](O)COc1ccccc1C(F)(F)F)[C@@H]1CC[C@H](C#N)C1	ZINC000278571801	455840023	/nfs/dbraw/zinc/84/00/23/455840023.db2.gz	JHRCDEMDAGPFLW-MJBXVCDLSA-N	0	3	342.361	3.069	20	30		EGEDHN
COc1ccc(CN2CC[C@@H](O)CC(C)(C)C2)cc1OCCCC#N	ZINC000295209713	455842153	/nfs/dbraw/zinc/84/21/53/455842153.db2.gz	LJMCVKYMLVVIRP-QGZVFWFLSA-N	0	3	346.471	3.361	20	30		EGEDHN
Cc1ccccc1C1(CNC(=O)C(C#N)Cc2ccc(C#N)cc2)CC1	ZINC000279339248	455862636	/nfs/dbraw/zinc/86/26/36/455862636.db2.gz	PNMOFDYESQZFED-LJQANCHMSA-N	0	3	343.430	3.397	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H]2CC[C@H](c3ccc(F)cc3)C2)CC1	ZINC000279395433	455864293	/nfs/dbraw/zinc/86/42/93/455864293.db2.gz	ATSOFGQIVJJWGB-LPHOPBHVSA-N	0	3	345.462	3.411	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1CCC[C@H](c2ccncc2)C1	ZINC000296008036	455866863	/nfs/dbraw/zinc/86/68/63/455866863.db2.gz	QHPDMUSTEJERST-SFHVURJKSA-N	0	3	337.423	3.220	20	30		EGEDHN
COc1ccc(CN[C@H](CO)CC2CCC2)cc1OCCCC#N	ZINC000279661611	455869672	/nfs/dbraw/zinc/86/96/72/455869672.db2.gz	GLZLADBLHMDRGM-KRWDZBQOSA-N	0	3	332.444	3.018	20	30		EGEDHN
C=CCC[C@@H](C(=O)Nc1ccn(CCN(C)C)n1)c1ccccc1	ZINC000187290599	455891566	/nfs/dbraw/zinc/89/15/66/455891566.db2.gz	BELTZXBEOHHYHB-QGZVFWFLSA-N	0	3	326.444	3.133	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NC1CCN([C@H](C)c2ccncc2)CC1)OCC	ZINC000270166874	455892876	/nfs/dbraw/zinc/89/28/76/455892876.db2.gz	BSCHACROSRNBRE-VQIMIIECSA-N	0	3	345.487	3.095	20	30		EGEDHN
C=CCn1c(SC[C@H]2CCN(C)C2)nnc1-c1ccccc1OC	ZINC000187667122	455936047	/nfs/dbraw/zinc/93/60/47/455936047.db2.gz	LSXBFEBJUWFUMD-AWEZNQCLSA-N	0	3	344.484	3.184	20	30		EGEDHN
CCOC[C@H](N[C@H](C)C(=O)N(CCC#N)c1ccc(F)cc1)C(C)C	ZINC000286072930	455972759	/nfs/dbraw/zinc/97/27/59/455972759.db2.gz	JQXDBMIEEQLMBJ-QAPCUYQASA-N	0	3	349.450	3.112	20	30		EGEDHN
C=CCSCCNC(=O)NCC(C)(C)N1CCc2ccccc2C1	ZINC000195729463	455995672	/nfs/dbraw/zinc/99/56/72/455995672.db2.gz	FISFDGIFVBZSJA-UHFFFAOYSA-N	0	3	347.528	3.042	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(F)cc2OC(C)C)CC1	ZINC000272581068	456001748	/nfs/dbraw/zinc/00/17/48/456001748.db2.gz	GTCMLHLFORWSKG-UHFFFAOYSA-N	0	3	335.423	3.385	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@@H]1CNCc1cc2c(cc1OC(F)F)OCO2	ZINC000280678514	456028954	/nfs/dbraw/zinc/02/89/54/456028954.db2.gz	QLBVZPXQDBJQRY-BDJLRTHQSA-N	0	3	341.354	3.088	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1CNCc1cc([N+](=O)[O-])ccc1OC(F)F	ZINC000280697958	456034310	/nfs/dbraw/zinc/03/43/10/456034310.db2.gz	SDFULNWJHUTAHO-XHDPSFHLSA-N	0	3	342.342	3.267	20	30		EGEDHN
C=CCOc1ccc(CNCC2([S@](C)=O)CCC2)cc1Cl	ZINC000280720594	456038761	/nfs/dbraw/zinc/03/87/61/456038761.db2.gz	UWHCRDSRUHJNGG-NRFANRHFSA-N	0	3	327.877	3.296	20	30		EGEDHN
C#CCCCCC(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000286910367	456057256	/nfs/dbraw/zinc/05/72/56/456057256.db2.gz	UHRCXJCBWOUOIG-LJQANCHMSA-N	0	3	330.472	3.386	20	30		EGEDHN
C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NCC#Cc1ccccc1	ZINC000289438667	456126211	/nfs/dbraw/zinc/12/62/11/456126211.db2.gz	WISPTLRUQPPSEC-FUHWJXTLSA-N	0	3	328.456	3.273	20	30		EGEDHN
C#CCCOc1ccc(CN(Cc2ccc(C(N)=O)cc2)C2CC2)cc1	ZINC000271118907	456131729	/nfs/dbraw/zinc/13/17/29/456131729.db2.gz	XKHHMXZLIFJDRE-UHFFFAOYSA-N	0	3	348.446	3.352	20	30		EGEDHN
C=CCc1cc(CN2CCCC[C@@H]2CCC(=O)NC)cc(OC)c1O	ZINC000289618115	456134369	/nfs/dbraw/zinc/13/43/69/456134369.db2.gz	LMFXJMADQWCWHY-QGZVFWFLSA-N	0	3	346.471	3.010	20	30		EGEDHN
COC[C@@]1(CN[C@@H](C)c2ccc(C#N)cc2)OCCc2ccccc21	ZINC000289657231	456135588	/nfs/dbraw/zinc/13/55/88/456135588.db2.gz	GMQGLEFQYLPDCF-HRAATJIYSA-N	0	3	336.435	3.323	20	30		EGEDHN
CC(C)(CO)[C@H](NCc1ccc(OCC#N)cc1)c1cccs1	ZINC000289727703	456139941	/nfs/dbraw/zinc/13/99/41/456139941.db2.gz	JYSLNBNYCCOSON-QGZVFWFLSA-N	0	3	330.453	3.500	20	30		EGEDHN
CCCCCCCCOCc1cccc(NC(=O)[C@H]2C[C@H](O)CN2)c1	ZINC000236636673	456161106	/nfs/dbraw/zinc/16/11/06/456161106.db2.gz	IDLUGATVJFRSDA-RBUKOAKNSA-N	0	3	348.487	3.225	20	30		EGEDHN
C=CCN1CC[C@H](N[C@H](C)c2ccc(OCC(F)(F)F)cc2)C1=O	ZINC000281219567	456168989	/nfs/dbraw/zinc/16/89/89/456168989.db2.gz	OJEJCDJFTZOKBG-DOMZBBRYSA-N	0	3	342.361	3.065	20	30		EGEDHN
C[C@H]1CN(CC2CCN(c3cccc(F)c3C#N)CC2)C[C@H](C)O1	ZINC000263779188	456220577	/nfs/dbraw/zinc/22/05/77/456220577.db2.gz	VIVITNYCAWABEP-GJZGRUSLSA-N	0	3	331.435	3.023	20	30		EGEDHN
N#CCCCC[NH+]1CCC(C(=O)Nc2cc(Cl)ccc2[O-])CC1	ZINC000263829805	456236919	/nfs/dbraw/zinc/23/69/19/456236919.db2.gz	UVFZGEDNXDJFLV-UHFFFAOYSA-N	0	3	335.835	3.390	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)N(C)[C@H](C)C1CCN(C)CC1	ZINC000273588969	456238701	/nfs/dbraw/zinc/23/87/01/456238701.db2.gz	LEXBTUVFHJOOKV-MRXNPFEDSA-N	0	3	345.487	3.123	20	30		EGEDHN
CSC1c2cc(-c3noc(C4(C#N)CCCC4)n3)ccc2NC1=O	ZINC000274075375	456250124	/nfs/dbraw/zinc/25/01/24/456250124.db2.gz	XEECHJUPHDDPNP-ZDUSSCGKSA-N	0	3	340.408	3.428	20	30		EGEDHN
Cc1nnc([C@@H](C)NC2CCN(Cc3ccc(C#N)cc3)CC2)s1	ZINC000274223801	456252726	/nfs/dbraw/zinc/25/27/26/456252726.db2.gz	ONPBLUIWNUQCAQ-CYBMUJFWSA-N	0	3	341.484	3.033	20	30		EGEDHN
C[C@H](N[C@H]1CCCC[C@@H]1OC(F)F)C(=O)Nc1cccc(C#N)c1	ZINC000337383069	456349496	/nfs/dbraw/zinc/34/94/96/456349496.db2.gz	DSABWNSHSNRNPK-CQDKDKBSSA-N	0	3	337.370	3.025	20	30		EGEDHN
N#Cc1cccc(COc2cccc(CN(CCO)C3CCC3)c2)c1	ZINC000276088522	456386870	/nfs/dbraw/zinc/38/68/70/456386870.db2.gz	VOTWFVGQKHKDRQ-UHFFFAOYSA-N	0	3	336.435	3.484	20	30		EGEDHN
C=CCN1CC[C@H](N2CCCCC[C@H]2C[C@H](O)c2ccccc2)C1=O	ZINC000282068005	456404726	/nfs/dbraw/zinc/40/47/26/456404726.db2.gz	SQWDXLIXFAWKFQ-UFYCRDLUSA-N	0	3	342.483	3.142	20	30		EGEDHN
Cc1oc([N-]C(=O)[C@H](C)[NH2+][C@H]2CCCC23CCOCC3)c(C#N)c1C	ZINC000282064939	456405783	/nfs/dbraw/zinc/40/57/83/456405783.db2.gz	MURWDVCUSNBZCM-BBRMVZONSA-N	0	3	345.443	3.034	20	30		EGEDHN
C[C@H](CCC#N)N1CCC[C@@H](CNC(=O)Nc2cccc(F)c2)C1	ZINC000276296275	456437170	/nfs/dbraw/zinc/43/71/70/456437170.db2.gz	IVVPJXOTTROLRH-CABCVRRESA-N	0	3	332.423	3.351	20	30		EGEDHN
CCN(CCC#N)C(=O)CN1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2	ZINC000282343993	456484044	/nfs/dbraw/zinc/48/40/44/456484044.db2.gz	CCTRPVFQSIZHLE-REPLKXPHSA-N	0	3	325.456	3.159	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)N1CCC(n2c(C)ccc2C)CC1	ZINC000337672465	456473899	/nfs/dbraw/zinc/47/38/99/456473899.db2.gz	KGZRAMUWZVSPPM-SFHVURJKSA-N	0	3	329.488	3.331	20	30		EGEDHN
C[C@@H](NC(=O)C(C#N)Cc1ccc(C#N)cc1)c1cccc([N+](=O)[O-])c1	ZINC000348125456	456500536	/nfs/dbraw/zinc/50/05/36/456500536.db2.gz	WMDCGKOJPOCKHJ-DYVFJYSZSA-N	0	3	348.362	3.026	20	30		EGEDHN
Cc1cc(CN[C@@H]2CCCN(C(=O)Cc3ccccc3)C2)ccc1C#N	ZINC000337947708	456617864	/nfs/dbraw/zinc/61/78/64/456617864.db2.gz	ZMXSHYGJZRHHIM-OAQYLSRUSA-N	0	3	347.462	3.190	20	30		EGEDHN
COc1ccc(CN(C)CC[C@@H]2CCCO2)cc1OCCCC#N	ZINC000343441888	456624169	/nfs/dbraw/zinc/62/41/69/456624169.db2.gz	LIAHOULFFQCJAJ-KRWDZBQOSA-N	0	3	332.444	3.379	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N[C@@H]1CCCC[C@H]1OC	ZINC000277008816	456651038	/nfs/dbraw/zinc/65/10/38/456651038.db2.gz	PHKPRCZQAKPHBC-USXIJHARSA-N	0	3	336.501	3.198	20	30		EGEDHN
Cc1ccc(F)c(CN(C)C(=O)C(C#N)Cc2ccc(C#N)cc2)c1	ZINC000348509907	456722762	/nfs/dbraw/zinc/72/27/62/456722762.db2.gz	NTEMHIPDMXJYAP-KRWDZBQOSA-N	0	3	335.382	3.347	20	30		EGEDHN
Cn1cc([C@@H](NCCc2cccc(C#N)c2)c2cccc(F)c2)cn1	ZINC000343583248	456724276	/nfs/dbraw/zinc/72/42/76/456724276.db2.gz	AWGJLYLMDVTUCV-FQEVSTJZSA-N	0	3	334.398	3.353	20	30		EGEDHN
CCO[C@@H]1C[C@H](NCC(=O)N[C@@H]2CCOc3ccccc32)C1(C)C	ZINC000328656595	456729110	/nfs/dbraw/zinc/72/91/10/456729110.db2.gz	OAGJCTQBAKAXEN-HYVNUMGLSA-N	0	3	332.444	3.260	20	30		EGEDHN
C[C@H](NC(=O)CC1CCCCC1)C(=O)N1CCC[C@H]1CN1CCCC1	ZINC000328688197	456736968	/nfs/dbraw/zinc/73/69/68/456736968.db2.gz	HNMBPRBICCPCPO-WMZOPIPTSA-N	0	3	349.519	3.389	20	30		EGEDHN
O=C(NCCN1CCC2(CCCCC2)CC1)c1nccn2ccnc12	ZINC000328714693	456744293	/nfs/dbraw/zinc/74/42/93/456744293.db2.gz	OEZGMHYJKAZXEC-UHFFFAOYSA-N	0	3	341.459	3.080	20	30		EGEDHN
Cc1cccc(NC(=O)[C@H](C)N2CCC[C@@H]2[C@@H]2COCC[C@H]2O)c1C	ZINC000328829729	456770041	/nfs/dbraw/zinc/77/00/41/456770041.db2.gz	QXZKSEPNWHCEMY-RNIPGJKVSA-N	0	3	346.471	3.142	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN[C@@H]1CC[C@H](c2ccccc2)C[C@H]1OC	ZINC000353575568	456776194	/nfs/dbraw/zinc/77/61/94/456776194.db2.gz	OZTHLKOEZSNUDA-XUVXKRRUSA-N	0	3	342.483	3.128	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN1C[C@H](C)C[C@@H]1c1cccc(OC)c1	ZINC000344023693	456790182	/nfs/dbraw/zinc/79/01/82/456790182.db2.gz	BDNWJPSLBWSEDW-VQIMIIECSA-N	0	3	328.456	3.279	20	30		EGEDHN
C=C(C)CN1CCC(Nc2cc(-c3ccccc3)nc3ncnn32)CC1	ZINC000301153520	456809543	/nfs/dbraw/zinc/80/95/43/456809543.db2.gz	BUYVXLGFTUAZDV-UHFFFAOYSA-N	0	3	348.454	3.244	20	30		EGEDHN
C[C@H](N[C@@H]1CCCN(C(=O)N2CCCC2)C1)c1ccc(C#N)c(F)c1	ZINC000329178308	456848738	/nfs/dbraw/zinc/84/87/38/456848738.db2.gz	NCDHAGMTAWXSGT-WMLDXEAASA-N	0	3	344.434	3.028	20	30		EGEDHN
CC(C)(C#N)CNC(=O)N[C@H]1CCN(Cc2ccccc2)CC1(C)C	ZINC000338659600	456849702	/nfs/dbraw/zinc/84/97/02/456849702.db2.gz	QWQUBWDFCBNKHI-KRWDZBQOSA-N	0	3	342.487	3.136	20	30		EGEDHN
C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)CCc1cc2ccccc2[nH]c1=O	ZINC000329193743	456851508	/nfs/dbraw/zinc/85/15/08/456851508.db2.gz	RNHHAYLGFIEIKH-ACJLOTCBSA-N	0	3	339.439	3.312	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1ccnc(SC)c1)C(C)C	ZINC000344786387	456859354	/nfs/dbraw/zinc/85/93/54/456859354.db2.gz	HRMGYHGAAIZGBZ-INIZCTEOSA-N	0	3	333.501	3.232	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)N1CC[C@H]2CC[C@@H](C1)N2C	ZINC000341628739	456882280	/nfs/dbraw/zinc/88/22/80/456882280.db2.gz	FJWAVZGSXYAHEZ-CABCVRRESA-N	0	3	339.464	3.390	20	30		EGEDHN
CCc1c(C)nc2ccccc2c1N1CC[C@@H](NC(=O)NC2CC2)C1	ZINC000329542168	456906229	/nfs/dbraw/zinc/90/62/29/456906229.db2.gz	XQSZOHLVMLZPKS-OAHLLOKOSA-N	0	3	338.455	3.350	20	30		EGEDHN
C[C@H](NCc1ccc(C[S@@](C)=O)cc1)c1ccc(C#N)c(F)c1	ZINC000353813676	456918857	/nfs/dbraw/zinc/91/88/57/456918857.db2.gz	YXIUSDSGXAAHFE-ZAMGYDSWSA-N	0	3	330.428	3.427	20	30		EGEDHN
O=C(Cc1noc(C2CCN(C3CC3)CC2)n1)NC1CCCCC1	ZINC000329664771	456924175	/nfs/dbraw/zinc/92/41/75/456924175.db2.gz	KBDYHBUFCNNGEA-UHFFFAOYSA-N	0	3	332.448	3.243	20	30		EGEDHN
CC(=O)N[C@@H]1CCCN(C(=O)CN2CC[C@@H](C)C3(CCCCC3)C2)C1	ZINC000329749709	456935720	/nfs/dbraw/zinc/93/57/20/456935720.db2.gz	UMRNSFJDMZEKRZ-SJLPKXTDSA-N	0	3	349.519	3.246	20	30		EGEDHN
C[C@H](CN(C)C)NC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1	ZINC000349316669	456939121	/nfs/dbraw/zinc/93/91/21/456939121.db2.gz	BGBLAIBXWQGSLF-CQSZACIVSA-N	0	3	338.411	3.422	20	30		EGEDHN
CN1CCC2(CC1)C[C@H](NC(=O)C[C@H]1CCOC1)c1ccccc1O2	ZINC000329801914	456942665	/nfs/dbraw/zinc/94/26/65/456942665.db2.gz	YXMZDJNJEZVOMN-WBVHZDCISA-N	0	3	344.455	3.358	20	30		EGEDHN
N#CC[C@H](CC(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1	ZINC000353875786	456945445	/nfs/dbraw/zinc/94/54/45/456945445.db2.gz	IJWWYRFNLRGIDM-NHCUHLMSSA-N	0	3	347.462	3.465	20	30		EGEDHN
[O-]C(=[NH+]C[C@@H]1CCc2nccn2C1)N1CCC[C@H]1C1CCCCC1	ZINC000329897436	456957304	/nfs/dbraw/zinc/95/73/04/456957304.db2.gz	LKARCROJZJGLII-RDJZCZTQSA-N	0	3	330.476	3.404	20	30		EGEDHN
COC1(CCN2CCN([C@@H](C#N)c3cccc(Cl)c3)CC2)CCC1	ZINC000339141937	456960575	/nfs/dbraw/zinc/96/05/75/456960575.db2.gz	VGYSCJKNMXMQBB-SFHVURJKSA-N	0	3	347.890	3.481	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)[C@](C)(C#N)CC)c1cccc(OC)c1	ZINC000349520785	456980858	/nfs/dbraw/zinc/98/08/58/456980858.db2.gz	JEEYHNAPGHJNEX-HKUYNNGSSA-N	0	3	331.460	3.134	20	30		EGEDHN
C=CCOc1ccc(C(=O)N(C)[C@@H](C)C2CCN(C)CC2)cc1OC	ZINC000345584897	456984186	/nfs/dbraw/zinc/98/41/86/456984186.db2.gz	KNPZCDVSFOLLLN-HNNXBMFYSA-N	0	3	346.471	3.062	20	30		EGEDHN
CC(C)C[C@@H]1OCCC[C@@H]1NCC(=O)Nc1ccc2c(c1)OCO2	ZINC000330148683	456992272	/nfs/dbraw/zinc/99/22/72/456992272.db2.gz	MGWBONNZTHXKMK-HOCLYGCPSA-N	0	3	334.416	3.187	20	30		EGEDHN
CN(C)Cc1ccc(CNC(=O)NC2(c3cccc(C#N)c3)CC2)cc1	ZINC000349636931	457000785	/nfs/dbraw/zinc/00/07/85/457000785.db2.gz	NGBDRUADKHXYIU-UHFFFAOYSA-N	0	3	348.450	3.108	20	30		EGEDHN
CCN1CCC[C@@H]1CNC(=O)c1sc([C@H]2CCCOC2)nc1C	ZINC000330250223	457013176	/nfs/dbraw/zinc/01/31/76/457013176.db2.gz	MWEHKTRPASHAKD-UONOGXRCSA-N	0	3	337.489	3.134	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCSCc2ccccc2)CC1	ZINC000349704162	457021984	/nfs/dbraw/zinc/02/19/84/457021984.db2.gz	QUDVBZQCUYCDJU-UHFFFAOYSA-N	0	3	332.513	3.467	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN1C[C@H](C)N(CC)C[C@@H]1C	ZINC000346220227	457023657	/nfs/dbraw/zinc/02/36/57/457023657.db2.gz	WGVOERXGGDQHOX-HOTGVXAUSA-N	0	3	347.528	3.318	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CCC2(CCOCC2)CC1	ZINC000341984016	457041444	/nfs/dbraw/zinc/04/14/44/457041444.db2.gz	GPYLIMWWFNXGCP-IBGZPJMESA-N	0	3	345.483	3.047	20	30		EGEDHN
N#C[C@H]1CC[C@@H](NCc2cnn(-c3ccc(Br)cc3)c2)C1	ZINC000349801544	457057494	/nfs/dbraw/zinc/05/74/94/457057494.db2.gz	LXZQWXJVGKIURT-SWLSCSKDSA-N	0	3	345.244	3.417	20	30		EGEDHN
CN(C)Cc1cccc(CNC(=O)C[C@H](CC#N)c2ccccc2)c1	ZINC000354114359	457071788	/nfs/dbraw/zinc/07/17/88/457071788.db2.gz	GIFLUSVHMZJVCR-FQEVSTJZSA-N	0	3	335.451	3.452	20	30		EGEDHN
C[C@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1F)N1CCC(C)CC1	ZINC000330873927	457098550	/nfs/dbraw/zinc/09/85/50/457098550.db2.gz	YYSJVRXHDXPFRU-GFCCVEGCSA-N	0	3	338.383	3.180	20	30		EGEDHN
Cc1cc(CN2CCC(CC(=O)N3CCCC3)CC2)ccc1C#N	ZINC000362936743	457164517	/nfs/dbraw/zinc/16/45/17/457164517.db2.gz	YCHVVPMBUFMCCL-UHFFFAOYSA-N	0	3	325.456	3.091	20	30		EGEDHN
Cc1cc(CN(C)Cc2ccccc2N2CCOCC2)ccc1C#N	ZINC000362966271	457179378	/nfs/dbraw/zinc/17/93/78/457179378.db2.gz	KHYVZNKZPJPLPQ-UHFFFAOYSA-N	0	3	335.451	3.335	20	30		EGEDHN
CC(C#N)C(=O)N[C@@H]1CCCN(c2ccc(Cl)cc2Cl)C1	ZINC000356846756	457182134	/nfs/dbraw/zinc/18/21/34/457182134.db2.gz	PNYOEPCGYLOZMU-ZYHUDNBSSA-N	0	3	326.227	3.238	20	30		EGEDHN
C[C@H](C(=O)N(CCC#N)c1ccccc1)N1CC[C@H](CC2CC2)C1	ZINC000339681349	457209902	/nfs/dbraw/zinc/20/99/02/457209902.db2.gz	HERNQSOYXUTWPP-SJLPKXTDSA-N	0	3	325.456	3.444	20	30		EGEDHN
Cc1cccc(NC(=O)Nc2cccc(CNC(=O)C(C)C#N)c2)c1	ZINC000347062673	457211620	/nfs/dbraw/zinc/21/16/20/457211620.db2.gz	GLGWCNDXNQLDTK-CQSZACIVSA-N	0	3	336.395	3.415	20	30		EGEDHN
COc1ccc(-c2nc(C)c([C@@H](C)NC(=O)C(C)C#N)s2)cc1	ZINC000347109586	457234546	/nfs/dbraw/zinc/23/45/46/457234546.db2.gz	PWVXKUDBZBKUMS-WDEREUQCSA-N	0	3	329.425	3.464	20	30		EGEDHN
CCOc1c(Cl)cc(C(=O)C(C#N)c2ccncn2)cc1OC	ZINC000354458542	457236683	/nfs/dbraw/zinc/23/66/83/457236683.db2.gz	BOULOBFYBLEIQM-NSHDSACASA-N	0	3	331.759	3.027	20	30		EGEDHN
CC(C#N)C(=O)NCc1ccccc1-c1ccc(Cn2cccn2)cc1	ZINC000347117598	457237607	/nfs/dbraw/zinc/23/76/07/457237607.db2.gz	VATRJUGMCKVHHO-MRXNPFEDSA-N	0	3	344.418	3.374	20	30		EGEDHN
C[C@H](C(=O)N(C)CCC#N)N1CCC[C@@H](c2ccc(F)cc2)CC1	ZINC000351198693	457238995	/nfs/dbraw/zinc/23/89/95/457238995.db2.gz	GRPUCSBTXLONES-HZPDHXFCSA-N	0	3	331.435	3.156	20	30		EGEDHN
CC[C@@H]1Cc2ccccc2CN1C[C@@H](O)COc1ccc(C#N)cc1	ZINC000342350201	457250879	/nfs/dbraw/zinc/25/08/79/457250879.db2.gz	SOKBTTMZXDBQND-WOJBJXKFSA-N	0	3	336.435	3.135	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@H](C)N1CCC(Cc2cccnc2)CC1	ZINC000357043734	457294266	/nfs/dbraw/zinc/29/42/66/457294266.db2.gz	RKJCFAPSHXWJEW-KRWDZBQOSA-N	0	3	329.488	3.149	20	30		EGEDHN
CC(C)(C)N1C[C@H](C(=O)N(CCC#N)CC2CC2)[C@@H](C(F)(F)F)C1	ZINC000339931604	457315815	/nfs/dbraw/zinc/31/58/15/457315815.db2.gz	MXIYMMXIQWNICG-KBPBESRZSA-N	0	3	345.409	3.047	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(OCC(F)F)cc2)CC1	ZINC000360663832	457324830	/nfs/dbraw/zinc/32/48/30/457324830.db2.gz	LXRBVBBLLLXIAY-UHFFFAOYSA-N	0	3	339.386	3.102	20	30		EGEDHN
CC[C@H](CC#N)N[C@@H](C)CCCCN1C(=O)c2ccccc2C1=O	ZINC000351980613	457328519	/nfs/dbraw/zinc/32/85/19/457328519.db2.gz	GCAXNIUSEYXCKP-LSDHHAIUSA-N	0	3	327.428	3.123	20	30		EGEDHN
COc1ccc2cc(C(=O)C(C#N)c3cc(C)nc(C)n3)c(C)nc2c1	ZINC000354939738	457331455	/nfs/dbraw/zinc/33/14/55/457331455.db2.gz	MIDVQSGVOZGYFI-KRWDZBQOSA-N	0	3	346.390	3.449	20	30		EGEDHN
C#CCOc1ccc(CN2CCC(n3cc(Cl)cn3)CC2)cc1	ZINC000378574379	457410664	/nfs/dbraw/zinc/41/06/64/457410664.db2.gz	UARAHMAIQAKADM-UHFFFAOYSA-N	0	3	329.831	3.386	20	30		EGEDHN
Cc1ccccc1[C@H]([C@H](C)NC(=O)N1CCC(F)(C#N)CC1)N(C)C	ZINC000357280610	457417960	/nfs/dbraw/zinc/41/79/60/457417960.db2.gz	HVCBOJSYFOOGIX-RDJZCZTQSA-N	0	3	346.450	3.024	20	30		EGEDHN
N#CC[C@H](CC(=O)N1CC[C@@H](N2CCCCC2)C1)c1ccccc1	ZINC000355806681	457420254	/nfs/dbraw/zinc/42/02/54/457420254.db2.gz	CFACSLRMYULFKI-RTBURBONSA-N	0	3	325.456	3.161	20	30		EGEDHN
CCC[C@H](C)NC(=O)[C@H]1CCCN(Cc2ccc(CC#N)cc2)C1	ZINC000342721297	457478606	/nfs/dbraw/zinc/47/86/06/457478606.db2.gz	ZFQPMSYEXYQACH-LPHOPBHVSA-N	0	3	327.472	3.269	20	30		EGEDHN
N#CC1(CCCN2CCC[C@@H](Oc3ncccc3F)C2)CCOCC1	ZINC000374178789	457511545	/nfs/dbraw/zinc/51/15/45/457511545.db2.gz	PYSCKCMRZSORGN-MRXNPFEDSA-N	0	3	347.434	3.164	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](O)COCc2ccccc2Cl)cc1F	ZINC000404144623	457537981	/nfs/dbraw/zinc/53/79/81/457537981.db2.gz	IWNJYDJXZDOAAB-MRXNPFEDSA-N	0	3	348.805	3.018	20	30		EGEDHN
C=CCOc1cccc(CNc2cccc(CN3CC[C@@H](O)C3)c2)c1	ZINC000361044925	457539490	/nfs/dbraw/zinc/53/94/90/457539490.db2.gz	NYNAAPADGUVBSC-HXUWFJFHSA-N	0	3	338.451	3.430	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)C(=O)NC[C@@H]1N(C)CCCC1(C)C	ZINC000425510888	457581113	/nfs/dbraw/zinc/58/11/13/457581113.db2.gz	AAEMHXSTBVWZPP-QAPCUYQASA-N	0	3	342.487	3.381	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N(C)C[C@H](O)COc1ccc(F)cc1	ZINC000425531936	457587496	/nfs/dbraw/zinc/58/74/96/457587496.db2.gz	AUNJOTUBNGYLIG-KSSFIOAISA-N	0	3	328.387	3.130	20	30		EGEDHN
CN1C[C@H](NC(=O)c2ccc(C3(C#N)CC3)cc2)[C@@H](c2ccccc2)C1	ZINC000370344613	457625020	/nfs/dbraw/zinc/62/50/20/457625020.db2.gz	YTSYVTRXZAKMRG-UXHICEINSA-N	0	3	345.446	3.069	20	30		EGEDHN
FC(F)(F)Oc1ccc(C#CCN[C@H]2CCO[C@@H]2C2CC2)cc1	ZINC000364779148	457691644	/nfs/dbraw/zinc/69/16/44/457691644.db2.gz	FQIAGRHFVULNOH-JKSUJKDBSA-N	0	3	325.330	3.094	20	30		EGEDHN
Cc1ccc([C@H](CN2CCOCC2)N[C@@H]2CCC[C@@H](C#N)C2)cc1	ZINC000361464612	457740158	/nfs/dbraw/zinc/74/01/58/457740158.db2.gz	RCPHDVAEZPCIMK-RLLQIKCJSA-N	0	3	327.472	3.040	20	30		EGEDHN
C=C[C@@H]1CCCCN1C(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1	ZINC000426062483	457768012	/nfs/dbraw/zinc/76/80/12/457768012.db2.gz	QDHOSGHFSIIBKM-QXAKKESOSA-N	0	3	327.472	3.400	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N(C)Cc1cccc(C)n1)C(C)C	ZINC000457736992	457811596	/nfs/dbraw/zinc/81/15/96/457811596.db2.gz	DMFMSMIWZGYWHQ-LJQANCHMSA-N	0	3	344.503	3.230	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCc1ccc(OCC2CC2)nc1	ZINC000433345859	457817058	/nfs/dbraw/zinc/81/70/58/457817058.db2.gz	ZOKGCWDVJYMAIK-IBGZPJMESA-N	0	3	349.434	3.259	20	30		EGEDHN
C[C@@H](CNC(=O)C(C#N)CCc1ccccc1)Oc1cccc(F)c1	ZINC000433362928	457821237	/nfs/dbraw/zinc/82/12/37/457821237.db2.gz	LCSMMZJDUSCUQS-DOTOQJQBSA-N	0	3	340.398	3.482	20	30		EGEDHN
Cc1cc(CNCCNC(=O)c2ccc(Cl)cc2)ccc1C#N	ZINC000443965248	457831267	/nfs/dbraw/zinc/83/12/67/457831267.db2.gz	MVXFVYKHMZWKSH-UHFFFAOYSA-N	0	3	327.815	3.040	20	30		EGEDHN
C[C@@H](CCCc1cccnc1)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000457900751	457863155	/nfs/dbraw/zinc/86/31/55/457863155.db2.gz	CILCZINXJKPKRM-OXJNMPFZSA-N	0	3	346.434	3.163	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NC[C@@]1(CO)C[C@@H]1c1ccccc1	ZINC000426743057	457891496	/nfs/dbraw/zinc/89/14/96/457891496.db2.gz	MQFKUILXOKBABP-TUNNFDKTSA-N	0	3	348.446	3.041	20	30		EGEDHN
CN(CCC#N)c1ccc(CN2CCOCC3(CCCC3)C2)cc1	ZINC000375390172	457910363	/nfs/dbraw/zinc/91/03/63/457910363.db2.gz	HDMCSQRBJAQODD-UHFFFAOYSA-N	0	3	327.472	3.429	20	30		EGEDHN
CCc1nsc(N2CCCN(CCCCC(C)(C)C#N)CC2)n1	ZINC000375407444	457919110	/nfs/dbraw/zinc/91/91/10/457919110.db2.gz	WZGPJVIJDYMYKF-UHFFFAOYSA-N	0	3	335.521	3.333	20	30		EGEDHN
C=CCN(C)CCN(CC)[C@@H](C)C(=O)Nc1ccc(C)cc1Cl	ZINC000411637943	457936849	/nfs/dbraw/zinc/93/68/49/457936849.db2.gz	GOCFZQYAASZNDO-HNNXBMFYSA-N	0	3	337.895	3.415	20	30		EGEDHN
C[C@@H](CCCc1cccnc1)N[C@@H]1CCN(c2ccc(C#N)cc2)C1=O	ZINC000411826790	457987208	/nfs/dbraw/zinc/98/72/08/457987208.db2.gz	SVZNLTCRFSNGTD-OXJNMPFZSA-N	0	3	348.450	3.060	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000368101497	458010538	/nfs/dbraw/zinc/01/05/38/458010538.db2.gz	KTIJCLVUWBANCV-HXUWFJFHSA-N	0	3	346.474	3.239	20	30		EGEDHN
C[C@@H]1CN(CCCC2(C#N)CCOCC2)CCN1Cc1ccccc1	ZINC000411986333	458033823	/nfs/dbraw/zinc/03/38/23/458033823.db2.gz	QSHVGVKUINAMNV-LJQANCHMSA-N	0	3	341.499	3.293	20	30		EGEDHN
COCC1(CNC(=O)C(C#N)CCc2ccccc2)CCCCC1	ZINC000428080220	458074879	/nfs/dbraw/zinc/07/48/79/458074879.db2.gz	YPKULRLCWDQGOW-SFHVURJKSA-N	0	3	328.456	3.472	20	30		EGEDHN
C[C@H]1C[C@@H](N2CCCC2)CN1C(=O)c1cccc(SCC#N)c1	ZINC000375822491	458082228	/nfs/dbraw/zinc/08/22/28/458082228.db2.gz	FHFAQRWNWYJDIW-GOEBONIOSA-N	0	3	329.469	3.001	20	30		EGEDHN
C=CCN(C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1)C1CC1	ZINC000362306605	458094642	/nfs/dbraw/zinc/09/46/42/458094642.db2.gz	YXVKDXOPOORJCN-GOSISDBHSA-N	0	3	327.472	3.259	20	30		EGEDHN
C=CCSc1ccccc1C(=O)N1C[C@@H](N(C)C)[C@@H](SC)C1	ZINC000362402513	458155350	/nfs/dbraw/zinc/15/53/50/458155350.db2.gz	MPKZWWAWUYSUSM-ZBFHGGJFSA-N	0	3	336.526	3.082	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@@H]1CNCc1c(C)nn(CC(C)C)c1OCC	ZINC000435751267	458196834	/nfs/dbraw/zinc/19/68/34/458196834.db2.gz	QNKRLDOOSQDJQI-SJLPKXTDSA-N	0	3	335.492	3.317	20	30		EGEDHN
C[C@@H]1CCC[C@@H](CCN2CCN(c3nccnc3C#N)C[C@@H]2C)C1	ZINC000362464782	458197529	/nfs/dbraw/zinc/19/75/29/458197529.db2.gz	PIGBMJVALOGTOK-IKGGRYGDSA-N	0	3	327.476	3.075	20	30		EGEDHN
CC[C@@H](N[C@@H]1CCCN(C(=O)N2CCCC2)C1)c1ccc(C#N)cc1	ZINC000376141347	458210061	/nfs/dbraw/zinc/21/00/61/458210061.db2.gz	BZYHEUDCXAYNKE-RTBURBONSA-N	0	3	340.471	3.279	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCCCSc2ccccc2)CC1	ZINC000358777133	458210396	/nfs/dbraw/zinc/21/03/96/458210396.db2.gz	XJSVEZSNZCZBCG-UHFFFAOYSA-N	0	3	333.501	3.118	20	30		EGEDHN
C=C(CC)CNC(=O)N1C[C@H]2CN(Cc3ccccc3)CC[C@@H]2C1	ZINC000459103875	458266926	/nfs/dbraw/zinc/26/69/26/458266926.db2.gz	UYAXVINHRVDFPM-RTBURBONSA-N	0	3	327.472	3.116	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@H]2CC[C@@H](C1)N2C	ZINC000413836220	458309459	/nfs/dbraw/zinc/30/94/59/458309459.db2.gz	PASGEUILNXNZQY-OTWHNJEPSA-N	0	3	327.472	3.052	20	30		EGEDHN
C#CCCN1CCC(NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)s2)CC1	ZINC000376471345	458310781	/nfs/dbraw/zinc/31/07/81/458310781.db2.gz	JPTKCXQJRJXVLD-ZIAGYGMSSA-N	0	3	336.888	3.109	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@@H](NCc3cn4ccccc4n3)C2)c(F)c1	ZINC000369672231	458311735	/nfs/dbraw/zinc/31/17/35/458311735.db2.gz	NCKFTXKAKBQKDV-MRXNPFEDSA-N	0	3	349.413	3.104	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)Nc1ccc(OCCN(C)C)cc1F	ZINC000413917112	458311921	/nfs/dbraw/zinc/31/19/21/458311921.db2.gz	PVOAHKHIODLSIP-UHFFFAOYSA-N	0	3	341.386	3.199	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)c1c[nH]c(C(F)(F)F)c1	ZINC000429671325	458355788	/nfs/dbraw/zinc/35/57/88/458355788.db2.gz	KEAGVTNUTHCIJI-SNVBAGLBSA-N	0	3	332.285	3.410	20	30		EGEDHN
N#CC(C(=O)c1cnc2c(F)cccc2c1)c1nnc2n1CCCCC2	ZINC000429680323	458357698	/nfs/dbraw/zinc/35/76/98/458357698.db2.gz	HJOVLFHUTQLRNJ-AWEZNQCLSA-N	0	3	349.369	3.182	20	30		EGEDHN
C=CCN(C)CCN(CC)Cc1nc(-c2ccc(CC)cc2)no1	ZINC000429714062	458361549	/nfs/dbraw/zinc/36/15/49/458361549.db2.gz	FMJGLWPZZWBQJU-UHFFFAOYSA-N	0	3	328.460	3.239	20	30		EGEDHN
CN1CCCC(C)(C)[C@@H]1CNC(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000447962237	458371371	/nfs/dbraw/zinc/37/13/71/458371371.db2.gz	KEBSDYOZVMDAKR-ROUUACIJSA-N	0	3	342.487	3.451	20	30		EGEDHN
N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)NC[C@@H](N)c1ccccc1	ZINC000418429478	458375158	/nfs/dbraw/zinc/37/51/58/458375158.db2.gz	NPOSMPBQWXXTTO-VAMGGRTRSA-N	0	3	348.450	3.168	20	30		EGEDHN
C[C@@H](NCC(=O)NCc1cccc(C#N)c1)c1ccc(C2CC2)cc1	ZINC000419335992	458380789	/nfs/dbraw/zinc/38/07/89/458380789.db2.gz	IELMOPMQKUZSGY-OAHLLOKOSA-N	0	3	333.435	3.403	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)c2ncc(C(C)(C)C)s2)cn1	ZINC000419827152	458392663	/nfs/dbraw/zinc/39/26/63/458392663.db2.gz	BCLXBQFDRWDXBN-LLVKDONJSA-N	0	3	330.413	3.090	20	30		EGEDHN
CC1(C)CN(Cc2cccc(OCc3ccccc3C#N)c2)C[C@H]1O	ZINC000448365041	458399980	/nfs/dbraw/zinc/39/99/80/458399980.db2.gz	HHNKBXGWJAHXEY-HXUWFJFHSA-N	0	3	336.435	3.340	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)CN1CC[C@@H](c2ccccc2)C1(C)C	ZINC000421010936	458405675	/nfs/dbraw/zinc/40/56/75/458405675.db2.gz	CZUISYHBARMOPJ-PXNSSMCTSA-N	0	3	327.472	3.309	20	30		EGEDHN
CN(C)CCOc1cccc(NC(=O)[C@@]2(C#N)CC23CCCC3)c1	ZINC000448835837	458412329	/nfs/dbraw/zinc/41/23/29/458412329.db2.gz	MJTVCHCXLMDVLW-IBGZPJMESA-N	0	3	327.428	3.040	20	30		EGEDHN
C[C@H](NC(=O)NCc1ccc(C#N)s1)[C@@H](c1ccccc1)N(C)C	ZINC000422213430	458426340	/nfs/dbraw/zinc/42/63/40/458426340.db2.gz	YHUJVJNAFMNDBV-GUYCJALGSA-N	0	3	342.468	3.110	20	30		EGEDHN
CC[C@H]1CN(CC)CCN1Cc1ccc(OC)c(OCCCC#N)c1	ZINC000449565010	458427325	/nfs/dbraw/zinc/42/73/25/458427325.db2.gz	FPKAADULOPNIFP-SFHVURJKSA-N	0	3	345.487	3.294	20	30		EGEDHN
C=CCOc1cccnc1C(=O)NC[C@H](N)c1ccc(C(C)C)cc1	ZINC000422797981	458429147	/nfs/dbraw/zinc/42/91/47/458429147.db2.gz	PHFRCIAHFJDLGS-KRWDZBQOSA-N	0	3	339.439	3.200	20	30		EGEDHN
Cc1cc(C)c(CNCc2cn(C)nc2-c2ccc(C#N)cc2)cn1	ZINC000449733096	458429934	/nfs/dbraw/zinc/42/99/34/458429934.db2.gz	GFYBUXMDWNGCRV-UHFFFAOYSA-N	0	3	331.423	3.260	20	30		EGEDHN
C=CCC[C@@H](CO)NCc1ccc(-c2ccc(C(=O)OC)cc2)o1	ZINC000449698481	458430150	/nfs/dbraw/zinc/43/01/50/458430150.db2.gz	NVHCUZKQFOZLCH-INIZCTEOSA-N	0	3	329.396	3.150	20	30		EGEDHN
COC(=O)[C@@H]1CN(Cc2ccc(C#N)cc2F)C[C@@H]1c1ccccc1	ZINC000449751641	458430577	/nfs/dbraw/zinc/43/05/77/458430577.db2.gz	ACEGPBDAMXDALI-QZTJIDSGSA-N	0	3	338.382	3.086	20	30		EGEDHN
C[C@H](CCCc1cccnc1)N[C@H](C)C(=O)Nc1cccc(C#N)c1	ZINC000459631141	458430981	/nfs/dbraw/zinc/43/09/81/458430981.db2.gz	BPDOHRGUBJCIPT-HZPDHXFCSA-N	0	3	336.439	3.281	20	30		EGEDHN
C[C@H]1C[C@@]1(C#N)C(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000450162826	458440571	/nfs/dbraw/zinc/44/05/71/458440571.db2.gz	RCASUWLYPFAPRD-KXBFYZLASA-N	0	3	327.428	3.040	20	30		EGEDHN
COCCN(Cc1ccc(C#N)cc1)C[C@@H](Cc1ccccc1)OC	ZINC000450319744	458445611	/nfs/dbraw/zinc/44/56/11/458445611.db2.gz	ZFLNEPRCTIXYFW-OAQYLSRUSA-N	0	3	338.451	3.264	20	30		EGEDHN
C[C@@H]1[C@@H](NC(=O)NCC(C)(C)CCC#N)CCN1Cc1ccccc1	ZINC000377040335	458447672	/nfs/dbraw/zinc/44/76/72/458447672.db2.gz	BUZFLQKXKHESDV-AEFFLSMTSA-N	0	3	342.487	3.279	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCc1cccc(C(=O)N2CCCCC2)c1	ZINC000451670521	458484153	/nfs/dbraw/zinc/48/41/53/458484153.db2.gz	DDHQIVDFRRUADV-MOPGFXCFSA-N	0	3	328.456	3.136	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1C[C@H](C)C[C@@H]1c1cccnc1	ZINC000373411843	458485477	/nfs/dbraw/zinc/48/54/77/458485477.db2.gz	HPRZGUQWMJWZQC-CRAIPNDOSA-N	0	3	337.423	3.424	20	30		EGEDHN
CC1CN(Cc2cccc(C#N)c2)CCN(Cc2cccc(C#N)c2)C1	ZINC000451889245	458490467	/nfs/dbraw/zinc/49/04/67/458490467.db2.gz	LJZUNGOZHRAENW-UHFFFAOYSA-N	0	3	344.462	3.384	20	30		EGEDHN
CC[C@@H](COCC(F)(F)F)NC(=O)C(C#N)CCc1ccccc1	ZINC000452746162	458508618	/nfs/dbraw/zinc/50/86/18/458508618.db2.gz	PAMJOIZOPFBJTL-GJZGRUSLSA-N	0	3	342.361	3.233	20	30		EGEDHN
CC(C)[C@]1(CO)CCN(CC#Cc2ccc(C(F)(F)F)cc2)C1	ZINC000377656004	458508875	/nfs/dbraw/zinc/50/88/75/458508875.db2.gz	UWMFIAOSFQZMAK-QGZVFWFLSA-N	0	3	325.374	3.397	20	30		EGEDHN
CN1C[C@H](NC(=O)c2ccc(C(C)(C)C#N)cc2)[C@H](c2ccccc2)C1	ZINC000373538333	458523400	/nfs/dbraw/zinc/52/34/00/458523400.db2.gz	UYGZIVOFBHXSMQ-PMACEKPBSA-N	0	3	347.462	3.315	20	30		EGEDHN
C=CCn1c(-c2ccccc2C)nnc1N1CCCN(C(C)C)CC1	ZINC000453424660	458527028	/nfs/dbraw/zinc/52/70/28/458527028.db2.gz	JHIRYACGFNFXOC-UHFFFAOYSA-N	0	3	339.487	3.360	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1nc(-c2cccc(Cl)c2)cs1	ZINC000424099477	458557811	/nfs/dbraw/zinc/55/78/11/458557811.db2.gz	MIIZXMFOEXERME-LBPRGKRZSA-N	0	3	334.832	3.423	20	30		EGEDHN
Cc1ccccc1Oc1ccccc1CNC(=O)[C@H](N)CCCC#N	ZINC000424120935	458563187	/nfs/dbraw/zinc/56/31/87/458563187.db2.gz	FJXVDCQOLVJPFQ-QGZVFWFLSA-N	0	3	337.423	3.425	20	30		EGEDHN
C[C@H](CCNC(=O)[C@@H](N)CCCC#N)c1cccc(C(F)(F)F)c1	ZINC000424126666	458565955	/nfs/dbraw/zinc/56/59/55/458565955.db2.gz	TWUCKHUEHFNKCI-DOMZBBRYSA-N	0	3	341.377	3.336	20	30		EGEDHN
CC[C@H](C(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1)N(CC)CC	ZINC000461757892	458572155	/nfs/dbraw/zinc/57/21/55/458572155.db2.gz	YADOUYPKUZBQJF-QRVBRYPASA-N	0	3	327.472	3.405	20	30		EGEDHN
C[C@@H]1[C@@H](NC(=O)N[C@@H](CCCC#N)c2ccccc2)CCCN1C	ZINC000431457566	458575966	/nfs/dbraw/zinc/57/59/66/458575966.db2.gz	JKNDZBTZSFAAAJ-NJAFHUGGSA-N	0	3	328.460	3.203	20	30		EGEDHN
CC(C)(C)c1ccc(C(C)(C)CNC(=O)[C@H](N)CCCC#N)cc1	ZINC000424170968	458576756	/nfs/dbraw/zinc/57/67/56/458576756.db2.gz	LRQLTCSFSFFIDQ-QGZVFWFLSA-N	0	3	329.488	3.399	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)[C@@H](C)c1cccc(C#N)c1)C(C)C	ZINC000461893696	458577240	/nfs/dbraw/zinc/57/72/40/458577240.db2.gz	FWCHAIYGNWTTQD-FXAWDEMLSA-N	0	3	339.483	3.477	20	30		EGEDHN
C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)C(C)(C)Cc1ccc(C#N)cc1	ZINC000454995228	458582492	/nfs/dbraw/zinc/58/24/92/458582492.db2.gz	NJAFJEJCFLKADL-SJORKVTESA-N	0	3	341.499	3.364	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N[C@H]1CCc2ccc(-c3ccccc3)cc21	ZINC000424195653	458583127	/nfs/dbraw/zinc/58/31/27/458583127.db2.gz	YFXMBNIVBBIMSJ-UXHICEINSA-N	0	3	333.435	3.478	20	30		EGEDHN
C=CC(C)(C)CNC(=O)NC[C@H](c1ccc(OC)cc1)N1CCCC1	ZINC000455370458	458595239	/nfs/dbraw/zinc/59/52/39/458595239.db2.gz	RFZGQOXEBOFUCL-GOSISDBHSA-N	0	3	345.487	3.344	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)CCN1C	ZINC000438627411	458607656	/nfs/dbraw/zinc/60/76/56/458607656.db2.gz	AQCHEKDEEVADPY-GXFFZTMASA-N	0	3	340.349	3.181	20	30		EGEDHN
N#CCc1cccc(NC(=O)NC[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000455908023	458620195	/nfs/dbraw/zinc/62/01/95/458620195.db2.gz	QLYAAHXILQKXOM-LJQANCHMSA-N	0	3	348.450	3.396	20	30		EGEDHN
C[C@H]1[C@H](NC(=O)c2ccc(F)c(C#N)c2)CCN1Cc1ccccc1	ZINC000494052235	458621050	/nfs/dbraw/zinc/62/10/50/458621050.db2.gz	WYFHOJRHDDLXDB-IFXJQAMLSA-N	0	3	337.398	3.090	20	30		EGEDHN
C[C@@H](C(=O)N[C@@H](C)CN(C)Cc1ccccc1)c1cccc(C#N)c1	ZINC000462541680	458629690	/nfs/dbraw/zinc/62/96/90/458629690.db2.gz	GLBZXMJZENMQQH-DLBZAZTESA-N	0	3	335.451	3.298	20	30		EGEDHN
CC(C)[C@H](CO)[C@@H](NC(=O)C(C#N)CCc1ccccc1)C(C)C	ZINC000456179224	458634471	/nfs/dbraw/zinc/63/44/71/458634471.db2.gz	NGKDRZYTYJTLHR-FHWLQOOXSA-N	0	3	330.472	3.164	20	30		EGEDHN
CC(C)CN(C(=O)[C@H](C1CC1)N1CCCC1)c1ccc(C#N)cc1	ZINC000546789496	458676469	/nfs/dbraw/zinc/67/64/69/458676469.db2.gz	QIJBYCNNIDTKTA-IBGZPJMESA-N	0	3	325.456	3.422	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N1CCn2cccc2[C@@H]1C)C(C)C	ZINC000503441878	458708423	/nfs/dbraw/zinc/70/84/23/458708423.db2.gz	ZWJXQGFIIAMDLP-HKUYNNGSSA-N	0	3	344.503	3.273	20	30		EGEDHN
Cc1cc(C)cc(N(CCC#N)C(=O)[C@H](C)N[C@H]2CSC[C@H]2C)c1	ZINC000507252139	458754330	/nfs/dbraw/zinc/75/43/30/458754330.db2.gz	LTAFDEVUAZDGHA-RYRKJORJSA-N	0	3	345.512	3.280	20	30		EGEDHN
C[C@@]1(CO)CCCN1Cc1cccc(OCc2cccc(C#N)c2)c1	ZINC000530390379	458759086	/nfs/dbraw/zinc/75/90/86/458759086.db2.gz	OAZJVMMCFOMRCY-NRFANRHFSA-N	0	3	336.435	3.484	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@H](C(C)C)N1CCc2ccccc2C1	ZINC000464540530	458759291	/nfs/dbraw/zinc/75/92/91/458759291.db2.gz	KQUAGIGDIQWPBM-FQEVSTJZSA-N	0	3	326.484	3.379	20	30		EGEDHN
C=C(C)CN(Cc1ccccc1)C(=O)N[C@H]1CN(C2CC2)C[C@H]1C	ZINC000472046303	458764215	/nfs/dbraw/zinc/76/42/15/458764215.db2.gz	BTGUHXWKANDLIW-APWZRJJASA-N	0	3	327.472	3.257	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)[C@@H]1CCCN1C1CCCC1	ZINC000439957162	458769654	/nfs/dbraw/zinc/76/96/54/458769654.db2.gz	KJPYHTLZNKXAPG-SFHVURJKSA-N	0	3	328.456	3.275	20	30		EGEDHN
C[C@@](C#N)(NC(=O)CN1CCC[C@@](C)(c2ccccc2)CC1)C1CC1	ZINC000510123223	458774173	/nfs/dbraw/zinc/77/41/73/458774173.db2.gz	HRYMETNRSXRXFH-RTWAWAEBSA-N	0	3	339.483	3.239	20	30		EGEDHN
CN(CCc1nc(-c2ccccc2)no1)Cc1ccc(CC#N)cc1	ZINC000512211847	458783487	/nfs/dbraw/zinc/78/34/87/458783487.db2.gz	LHCUJCQKZZZEJA-UHFFFAOYSA-N	0	3	332.407	3.477	20	30		EGEDHN
CCCN(CC(=O)N[C@](C)(C#N)C(C)C)[C@H]1CCc2ccccc2C1	ZINC000516737907	458821236	/nfs/dbraw/zinc/82/12/36/458821236.db2.gz	QTSXGKHNBMEFGO-PZJWPPBQSA-N	0	3	341.499	3.310	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)c1cc2c(s1)CCOC2	ZINC000517743577	458831683	/nfs/dbraw/zinc/83/16/83/458831683.db2.gz	JDHDJHVEZYTGOR-GFCCVEGCSA-N	0	3	337.404	3.198	20	30		EGEDHN
COc1cc(CNCCc2ccn(-c3ccccc3)n2)ccc1C#N	ZINC000440808284	458855776	/nfs/dbraw/zinc/85/57/76/458855776.db2.gz	KHJKVGHJFGDUHY-UHFFFAOYSA-N	0	3	332.407	3.085	20	30		EGEDHN
CC#CCN(C)CCC(=O)Nc1sc2c(c1C#N)CCCCC2	ZINC000550489576	458886714	/nfs/dbraw/zinc/88/67/14/458886714.db2.gz	MTYJSMRYPZFKPO-UHFFFAOYSA-N	0	3	329.469	3.172	20	30		EGEDHN
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCC#Cc1ccc(F)cc1	ZINC000551418024	458888821	/nfs/dbraw/zinc/88/88/21/458888821.db2.gz	AGUYNWRBFZVXBJ-OXQOHEQNSA-N	0	3	339.410	3.187	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cccc3c2ccn3C)CC1	ZINC000519286801	458931012	/nfs/dbraw/zinc/93/10/12/458931012.db2.gz	KYMGVGYFFCZPRA-UHFFFAOYSA-N	0	3	326.444	3.340	20	30		EGEDHN
C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)c1ccccc1-c1ccccc1C#N	ZINC000467027503	458944908	/nfs/dbraw/zinc/94/49/08/458944908.db2.gz	YKLGRHRVWTXCSS-QVKFZJNVSA-N	0	3	345.446	3.438	20	30		EGEDHN
C[C@H]1CN(C2CC2)C[C@H]1NC(=O)c1ccccc1-c1ccccc1C#N	ZINC000467027505	458945839	/nfs/dbraw/zinc/94/58/39/458945839.db2.gz	YKLGRHRVWTXCSS-YCRPNKLZSA-N	0	3	345.446	3.438	20	30		EGEDHN
Cc1ccc([C@@H](CNC(=O)C2(C#N)CC(C)C2)N2CCCC2)cc1	ZINC000531816036	458983263	/nfs/dbraw/zinc/98/32/63/458983263.db2.gz	FGLFRDBMEBBRPW-KGXSXCIVSA-N	0	3	325.456	3.188	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@H](N[C@H](COC(N)=O)Cc1ccccc1)CC2	ZINC000495884862	458991320	/nfs/dbraw/zinc/99/13/20/458991320.db2.gz	JNUGNQAEFFFMLP-PKOBYXMFSA-N	0	3	335.407	3.256	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)N[C@@H]2CC[C@H](C#N)C2)N2CCCC2)cc1	ZINC000566911382	459020323	/nfs/dbraw/zinc/02/03/23/459020323.db2.gz	ITXLHFPRXWLPTE-UHOSZYNNSA-N	0	3	340.471	3.123	20	30		EGEDHN
C=CCC[C@H](O)CN1CCC(F)(c2cc(OC)cc(OC)c2)CC1	ZINC000566925681	459022355	/nfs/dbraw/zinc/02/23/55/459022355.db2.gz	HCLAECXDNPUSSZ-INIZCTEOSA-N	0	3	337.435	3.292	20	30		EGEDHN
N#C[C@@H]1CC[C@@H](NC[C@H](O)COc2cccc(Cl)c2Cl)C1	ZINC000442778840	459034657	/nfs/dbraw/zinc/03/46/57/459034657.db2.gz	KXEXMOOOYMVREU-UTUOFQBUSA-N	0	3	329.227	3.015	20	30		EGEDHN
C=CCc1cc(CNC[C@@H](C)C(=O)OC(C)(C)C)cc(OC)c1O	ZINC000594516346	459073701	/nfs/dbraw/zinc/07/37/01/459073701.db2.gz	VWHKKHKMWQRTOZ-CYBMUJFWSA-N	0	3	335.444	3.197	20	30		EGEDHN
CC(C)c1ccc([C@H](N)CNC(=O)N2Cc3ccc(C#N)cc3C2)cc1	ZINC000594534143	459082103	/nfs/dbraw/zinc/08/21/03/459082103.db2.gz	VCDFIRRRSCRSRO-HXUWFJFHSA-N	0	3	348.450	3.407	20	30		EGEDHN
CSc1nnc(CCCNC[C@@H](C#N)CCC#N)n1C1CCCC1	ZINC000577722697	459082244	/nfs/dbraw/zinc/08/22/44/459082244.db2.gz	WYGSNTCQAIOELU-CQSZACIVSA-N	0	3	346.504	3.081	20	30		EGEDHN
CN(CCCc1cc(-c2ccc(F)cc2)no1)CCOCCC#N	ZINC000590157686	459095705	/nfs/dbraw/zinc/09/57/05/459095705.db2.gz	BPOCLOXDVTXUNE-UHFFFAOYSA-N	0	3	331.391	3.275	20	30		EGEDHN
CC[C@H](C)N[C@@H](CNC(=O)N1CCC(CC#N)CC1)c1ccco1	ZINC000557832054	459111837	/nfs/dbraw/zinc/11/18/37/459111837.db2.gz	PFZPGQNTQOHUEH-HOCLYGCPSA-N	0	3	332.448	3.044	20	30		EGEDHN
CCN1CC[C@H](N[C@H](C)c2ccc(-c3cccc(C#N)c3)cc2)C1=O	ZINC000594712158	459137857	/nfs/dbraw/zinc/13/78/57/459137857.db2.gz	ZMUVTFVDOKRCNR-QRWLVFNGSA-N	0	3	333.435	3.497	20	30		EGEDHN
C[S@](=O)[C@@H]1CCC[C@@H](NCc2cccc(OCCCC#N)c2)C1	ZINC000594962113	459195579	/nfs/dbraw/zinc/19/55/79/459195579.db2.gz	PSQNHNQQYXYFCE-UQNRQAKVSA-N	0	3	334.485	3.148	20	30		EGEDHN
N#CC(C(=O)c1cnn2c1CCC2)c1nc2ccccc2n1C(F)F	ZINC000521973381	459197554	/nfs/dbraw/zinc/19/75/54/459197554.db2.gz	AURVFPCUGCBORL-SNVBAGLBSA-N	0	3	341.321	3.064	20	30		EGEDHN
Cc1ccc(CN(C)C[C@@H](O)COc2ccc(CC#N)cc2)cc1C	ZINC000590764965	459208172	/nfs/dbraw/zinc/20/81/72/459208172.db2.gz	JSZHFSWKRXOZHU-HXUWFJFHSA-N	0	3	338.451	3.241	20	30		EGEDHN
C#CC[C@H](CC(F)(F)F)NC1CC2(C1)CN(C(=O)OC(C)(C)C)C2	ZINC000496502212	459217697	/nfs/dbraw/zinc/21/76/97/459217697.db2.gz	VMIOKZNVOPCMMG-GFCCVEGCSA-N	0	3	346.393	3.320	20	30		EGEDHN
COc1cc(NC(C)=O)ccc1[C@H](C)NCCc1ccc(C#N)cc1	ZINC000595057845	459230093	/nfs/dbraw/zinc/23/00/93/459230093.db2.gz	XWNDEGLSFOVURH-AWEZNQCLSA-N	0	3	337.423	3.419	20	30		EGEDHN
C=CCCSCCNC(=O)NC[C@@H](N)c1ccc(C(C)C)cc1	ZINC000595267634	459264606	/nfs/dbraw/zinc/26/46/06/459264606.db2.gz	NRXNVTQXKDBIIY-QGZVFWFLSA-N	0	3	335.517	3.418	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC(C)(CNC[C@@H](C#N)CCC#N)CC1	ZINC000496637757	459269160	/nfs/dbraw/zinc/26/91/60/459269160.db2.gz	XSYXNSACKAAWLX-OAHLLOKOSA-N	0	3	334.464	3.057	20	30		EGEDHN
CN(CCc1ccc(C#N)cc1)Cc1cc(Br)cn1C	ZINC000595344267	459282368	/nfs/dbraw/zinc/28/23/68/459282368.db2.gz	KOQIPYVEMJXJKW-UHFFFAOYSA-N	0	3	332.245	3.334	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@H](C=Nn1cnc2ccccc21)CC(F)F	ZINC000496742179	459307014	/nfs/dbraw/zinc/30/70/14/459307014.db2.gz	QSQGYQDITMUHBD-NSHDSACASA-N	0	3	338.358	3.419	20	30		EGEDHN
N#CC(C(=O)c1ccc2c(c1)CCC=C2)c1nnc2n1CCCCC2	ZINC000560230832	459313477	/nfs/dbraw/zinc/31/34/77/459313477.db2.gz	LOHYGEFYVZHSMP-QGZVFWFLSA-N	0	3	332.407	3.454	20	30		EGEDHN
C=CCn1c(CC)nnc1N(C)C1CCN(Cc2ccccc2)CC1	ZINC000582150803	459316056	/nfs/dbraw/zinc/31/60/56/459316056.db2.gz	SZNSYYICTQFSRY-UHFFFAOYSA-N	0	3	339.487	3.127	20	30		EGEDHN
C[C@@H](CN1CCC(C)CC1)NC(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000595568548	459349921	/nfs/dbraw/zinc/34/99/21/459349921.db2.gz	VLCWKBWAIQNRIU-HKUYNNGSSA-N	0	3	342.487	3.451	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2NCc1ccc(-n2cncn2)c(F)c1	ZINC000591357492	459361573	/nfs/dbraw/zinc/36/15/73/459361573.db2.gz	FZQZYVIYPOUOLV-LJQANCHMSA-N	0	3	347.397	3.445	20	30		EGEDHN
C=CCN1CC[C@@H](S[C@H]2CCCN(Cc3ccccc3)C2)C1=O	ZINC000568882799	459361775	/nfs/dbraw/zinc/36/17/75/459361775.db2.gz	DJPDNOLYXKKIDD-ZWKOTPCHSA-N	0	3	330.497	3.171	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)Nc1cccc(C#N)n1)c1ccsc1	ZINC000568999231	459379775	/nfs/dbraw/zinc/37/97/75/459379775.db2.gz	VHGMGRZZYZPTEL-OAHLLOKOSA-N	0	3	343.456	3.219	20	30		EGEDHN
Cc1ccc2c(c1)CN(C(=O)C(C#N)CCc1ccccc1)CCO2	ZINC000561281824	459438630	/nfs/dbraw/zinc/43/86/30/459438630.db2.gz	PGBZHWWAUYOQIG-GOSISDBHSA-N	0	3	334.419	3.489	20	30		EGEDHN
N#Cc1cnn2cc(CN3CCC[C@H]3CCc3ccccc3)cnc12	ZINC000582905879	459449473	/nfs/dbraw/zinc/44/94/73/459449473.db2.gz	WNIFCPVRMPKZSZ-IBGZPJMESA-N	0	3	331.423	3.198	20	30		EGEDHN
CC[C@@H](CN1CCCC1)NC(=O)N(C)[C@H](C)c1cccc(C#N)c1	ZINC000591869614	459459440	/nfs/dbraw/zinc/45/94/40/459459440.db2.gz	DRZXBZBMFJLNMO-QAPCUYQASA-N	0	3	328.460	3.135	20	30		EGEDHN
C[C@H](C(=O)N(CCC#N)c1ccc(F)cc1)N(C)C[C@H]1CC1(C)C	ZINC000595910001	459483097	/nfs/dbraw/zinc/48/30/97/459483097.db2.gz	APVKDGOKEZJWAJ-HUUCEWRRSA-N	0	3	331.435	3.439	20	30		EGEDHN
Cc1ccc(Cl)c(OC[C@H](O)CNCc2cccc(C#N)c2)c1	ZINC000583139118	459489338	/nfs/dbraw/zinc/48/93/38/459489338.db2.gz	WAMDWRODLUVIBD-MRXNPFEDSA-N	0	3	330.815	3.050	20	30		EGEDHN
N#Cc1nc(NC[C@@H](c2ccccc2)N2CCCC2)sc1Cl	ZINC000596052692	459502195	/nfs/dbraw/zinc/50/21/95/459502195.db2.gz	HFLIHFVBLZCEFO-AWEZNQCLSA-N	0	3	332.860	3.339	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@@H](N[C@@H]3CCc4cc(F)ccc43)C2=O)cc1	ZINC000541881729	459506416	/nfs/dbraw/zinc/50/64/16/459506416.db2.gz	NCQLGEUAEQGVKG-WOJBJXKFSA-N	0	3	349.409	3.470	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)N2CCC[C@@H](CC#N)C2)N(C)C)cc1	ZINC000596093835	459517438	/nfs/dbraw/zinc/51/74/38/459517438.db2.gz	YDASRQSEGOJGDJ-HKUYNNGSSA-N	0	3	342.487	3.187	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCN2Cc3ccc(O)cc3C3(CC3)C2)cc1	ZINC000562285116	459530129	/nfs/dbraw/zinc/53/01/29/459530129.db2.gz	PORNMPIGFQFPHQ-UHFFFAOYSA-N	0	3	347.418	3.140	20	30		EGEDHN
COc1ccc([C@H](CCC#N)N[C@H]2CCN(CC(F)(F)F)C2)cc1	ZINC000569955697	459538039	/nfs/dbraw/zinc/53/80/39/459538039.db2.gz	GGBKHLAOLVTIMM-HOCLYGCPSA-N	0	3	341.377	3.266	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)c1cc(C(C)(C)C)ncn1	ZINC000596158398	459542682	/nfs/dbraw/zinc/54/26/82/459542682.db2.gz	XBBYLVZBWHRZIC-UHFFFAOYSA-N	0	3	337.471	3.214	20	30		EGEDHN
CCCc1ccc([C@H](NCC(=O)NC2(C#N)CCC2)C(C)C)cc1	ZINC000526135193	459554475	/nfs/dbraw/zinc/55/44/75/459554475.db2.gz	BEZZCUMBRVGWEU-LJQANCHMSA-N	0	3	327.472	3.488	20	30		EGEDHN
N#CCC1(CNCCC(=O)Nc2cccc(Br)c2)CC1	ZINC000571158540	459564834	/nfs/dbraw/zinc/56/48/34/459564834.db2.gz	MMVWHOGNRNJWRF-UHFFFAOYSA-N	0	3	336.233	3.061	20	30		EGEDHN
CC[C@H](c1ccccc1)[C@@H]1CCCN1CC(=O)NC1(C#N)CCC1	ZINC000527127684	459595857	/nfs/dbraw/zinc/59/58/57/459595857.db2.gz	OZUHWPXKSRLFEZ-MSOLQXFVSA-N	0	3	325.456	3.207	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2c(C)cc(C)nc2OC2CCC2)CC1	ZINC000527161859	459601072	/nfs/dbraw/zinc/60/10/72/459601072.db2.gz	KDSFMABNXSIZER-UHFFFAOYSA-N	0	3	343.471	3.010	20	30		EGEDHN
CCN1C[C@H](C)N(CC#Cc2ccc(OC(F)(F)F)cc2)C[C@@H]1C	ZINC000498904889	459609904	/nfs/dbraw/zinc/60/99/04/459609904.db2.gz	LNIKHHXCAFRAED-GJZGRUSLSA-N	0	3	340.389	3.351	20	30		EGEDHN
C[C@H](N[C@H](c1ccc(F)cc1)C1CCC1)C(=O)NC1(C#N)CCC1	ZINC000583976894	459628014	/nfs/dbraw/zinc/62/80/14/459628014.db2.gz	SCMYAPUEDHIKEP-GUYCJALGSA-N	0	3	329.419	3.207	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCC(CC(F)(F)F)CC2)CC1	ZINC000584128149	459662035	/nfs/dbraw/zinc/66/20/35/459662035.db2.gz	HDSLCCMDRHMGGV-UHFFFAOYSA-N	0	3	347.425	3.401	20	30		EGEDHN
N#C[C@H](c1cccc(Cl)c1)N1CCN(C[C@@H]2CCCC[C@H]2O)CC1	ZINC000584175471	459674017	/nfs/dbraw/zinc/67/40/17/459674017.db2.gz	AHJVXHHSJXTKKY-QXAKKESOSA-N	0	3	347.890	3.073	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)NC[C@H](C)C#N)N(CC)CC)cc1	ZINC000563032334	459701213	/nfs/dbraw/zinc/70/12/13/459701213.db2.gz	WDPKOPLQRWRBTF-CRAIPNDOSA-N	0	3	330.476	3.091	20	30		EGEDHN
CC(C)Cc1ccc([C@@H](CNC(=O)NCC(C)(C)C#N)N(C)C)cc1	ZINC000501822790	459747447	/nfs/dbraw/zinc/74/74/47/459747447.db2.gz	KJKINBULZNLFIJ-GOSISDBHSA-N	0	3	344.503	3.337	20	30		EGEDHN
N#CCN(C(=O)C(C[C@@H]1CCCO1)C(F)(F)F)c1ccccc1	ZINC000593039966	459750769	/nfs/dbraw/zinc/75/07/69/459750769.db2.gz	VZFUNZZCOCXARE-KBPBESRZSA-N	0	3	326.318	3.291	20	30		EGEDHN
CC(C)O[C@@H]1CCCN(CCC(=O)Nc2ccc(C#N)c(Cl)c2)C1	ZINC000593055570	459758486	/nfs/dbraw/zinc/75/84/86/459758486.db2.gz	LXJJKTOZEVRQKY-MRXNPFEDSA-N	0	3	349.862	3.430	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)[C@@H]1C[C@@H]2C=C[C@H]1CC2	ZINC000593060405	459760311	/nfs/dbraw/zinc/76/03/11/459760311.db2.gz	YHWXEVVYROLOMZ-LSTHTHJFSA-N	0	3	337.467	3.051	20	30		EGEDHN
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NCc1ccc(C#N)s1	ZINC000584581638	459772362	/nfs/dbraw/zinc/77/23/62/459772362.db2.gz	NUGZYNRXGRFZMU-DYVFJYSZSA-N	0	3	328.437	3.130	20	30		EGEDHN
C=CC[C@@H](CC)NCc1cn(-c2ccccc2Br)nn1	ZINC000564414770	459773542	/nfs/dbraw/zinc/77/35/42/459773542.db2.gz	NHCZNYLLRGGMDO-GFCCVEGCSA-N	0	3	335.249	3.474	20	30		EGEDHN
C[C@@H](NCC(=O)N[C@](C)(C#N)C1CC1)c1ccc(F)c2ccccc21	ZINC000565269792	459782233	/nfs/dbraw/zinc/78/22/33/459782233.db2.gz	JXHLUVVYVRCEFN-ZUOKHONESA-N	0	3	339.414	3.438	20	30		EGEDHN
N#Cc1ccc2c(c1)CCCC[C@H]2N[C@H]1Cc2ccccc2NC1=O	ZINC000528002113	459792304	/nfs/dbraw/zinc/79/23/04/459792304.db2.gz	WJWDOTQRZOFDGJ-UXHICEINSA-N	0	3	331.419	3.479	20	30		EGEDHN
CCc1oc2ccccc2c1CC(=O)C(C#N)C(=O)NC1CCCC1	ZINC000528923221	459817488	/nfs/dbraw/zinc/81/74/88/459817488.db2.gz	FHPVDTWLAARXEW-INIZCTEOSA-N	0	3	338.407	3.305	20	30		EGEDHN
Cc1csc(NC(=O)NC[C@H]2CCN2C2CCCCC2)c1C#N	ZINC000529098782	459822756	/nfs/dbraw/zinc/82/27/56/459822756.db2.gz	QBTGRCAONVVJHL-CQSZACIVSA-N	0	3	332.473	3.457	20	30		EGEDHN
C[C@@H](c1ccncc1)N1CCC(Nc2ncc3c(c2C#N)CCC3)CC1	ZINC000574751486	459866235	/nfs/dbraw/zinc/86/62/35/459866235.db2.gz	LQDFKDQRGRXIIO-HNNXBMFYSA-N	0	3	347.466	3.474	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)C1CC2(CCC2)C1	ZINC000574990350	459904688	/nfs/dbraw/zinc/90/46/88/459904688.db2.gz	VBDHGYRCHOHKMW-UHFFFAOYSA-N	0	3	325.456	3.029	20	30		EGEDHN
C[C@@H](CNC(=O)c1cc2ccccc2n1CC#N)N1CCCC[C@@H]1C	ZINC000609163434	459916296	/nfs/dbraw/zinc/91/62/96/459916296.db2.gz	LEVDFVHBAAMFRJ-HOTGVXAUSA-N	0	3	338.455	3.158	20	30		EGEDHN
CCC(C#N)C(=O)N1CCc2ccccc2[C@H]1C(=O)OC(C)(C)C	ZINC000598568162	459941150	/nfs/dbraw/zinc/94/11/50/459941150.db2.gz	IIVGHZFRQYMOAQ-BBRMVZONSA-N	0	3	328.412	3.004	20	30		EGEDHN
C[C@H](CCC#N)CN1CCCN(C(=O)c2ccc(Cl)cc2)CC1	ZINC000602449689	459943244	/nfs/dbraw/zinc/94/32/44/459943244.db2.gz	QSQUANCNJYBWTF-OAHLLOKOSA-N	0	3	333.863	3.428	20	30		EGEDHN
COc1ccc([C@H]2CCCN2C[C@@H](O)CC(C)(C)C#N)c(OC)c1	ZINC000598584780	459954511	/nfs/dbraw/zinc/95/45/11/459954511.db2.gz	VPWRGZBZWBNFSB-WMLDXEAASA-N	0	3	332.444	3.141	20	30		EGEDHN
COC[C@H](NC[C@@H](O)CC(C)(C)C#N)c1cccc(C(F)(F)F)c1	ZINC000598599208	459959594	/nfs/dbraw/zinc/95/95/94/459959594.db2.gz	AVOUPSCFQPUSIR-GJZGRUSLSA-N	0	3	344.377	3.283	20	30		EGEDHN
COc1cc([C@@H](C)NC[C@@H](O)CC(C)(C)C#N)ccc1OC(C)C	ZINC000598599516	459959666	/nfs/dbraw/zinc/95/96/66/459959666.db2.gz	BVMVTBDPDDBFDC-ZBFHGGJFSA-N	0	3	334.460	3.434	20	30		EGEDHN
C[C@H](CC1(C#N)CCOCC1)NC[C@H](c1ccco1)N1CCCCC1	ZINC000602500310	459970385	/nfs/dbraw/zinc/97/03/85/459970385.db2.gz	YUVPDDCBVILHMO-QZTJIDSGSA-N	0	3	345.487	3.495	20	30		EGEDHN
C[C@H](CC1(C#N)CCOCC1)NCc1ccc2c(c1)OCCCO2	ZINC000602532805	459986930	/nfs/dbraw/zinc/98/69/30/459986930.db2.gz	LXRXGBCXSZZSME-OAHLLOKOSA-N	0	3	330.428	3.036	20	30		EGEDHN
C[C@H](CC1(C#N)CCOCC1)N[C@@H](C)c1ccc([S@](C)=O)cc1	ZINC000602575151	460004396	/nfs/dbraw/zinc/00/43/96/460004396.db2.gz	CBDGJGWNANHKIO-USGALAMMSA-N	0	3	334.485	3.174	20	30		EGEDHN
COc1cccc(CNC[C@@H](O)CC(C)(C)C#N)c1OC1CCCC1	ZINC000598721247	460006716	/nfs/dbraw/zinc/00/67/16/460006716.db2.gz	UEIIVLOTPLPTNQ-INIZCTEOSA-N	0	3	346.471	3.407	20	30		EGEDHN
Cc1cc(C[C@@H](C)NCc2cccc(C#N)n2)n(-c2ccccc2)n1	ZINC000602583812	460008990	/nfs/dbraw/zinc/00/89/90/460008990.db2.gz	YUAVPJITIUWMRA-OAHLLOKOSA-N	0	3	331.423	3.168	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)NCc1cccc(Oc2ccccc2F)c1	ZINC000593912961	460015451	/nfs/dbraw/zinc/01/54/51/460015451.db2.gz	VEDGKSYYAVTWIL-KRWDZBQOSA-N	0	3	341.386	3.255	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CC(Cc3ccsc3)C2)cc1	ZINC000598779425	460031140	/nfs/dbraw/zinc/03/11/40/460031140.db2.gz	VJJOUGZAKAIFBF-SFHVURJKSA-N	0	3	335.432	3.003	20	30		EGEDHN
C[C@H]1CN(c2nccnc2C#N)CCN1CCC1CCCCCC1	ZINC000575955529	460039255	/nfs/dbraw/zinc/03/92/55/460039255.db2.gz	MYYKURUIYRKRRR-INIZCTEOSA-N	0	3	327.476	3.219	20	30		EGEDHN
C[C@H](CCC#N)CN[C@@H](CO)c1ccc(Br)c(F)c1	ZINC000602671823	460058277	/nfs/dbraw/zinc/05/82/77/460058277.db2.gz	JYYZPYHSGOQPLE-YGRLFVJLSA-N	0	3	329.213	3.151	20	30		EGEDHN
N#CC[C@H]1CCCN(C(=O)c2cccc(CN3CCCCC3)c2)C1	ZINC000597902069	460102284	/nfs/dbraw/zinc/10/22/84/460102284.db2.gz	PVDPYEQWUXXVTE-QGZVFWFLSA-N	0	3	325.456	3.438	20	30		EGEDHN
N#CCC1CCN(C[C@H](O)COc2cc(Cl)cc(Cl)c2)CC1	ZINC000602805968	460136523	/nfs/dbraw/zinc/13/65/23/460136523.db2.gz	KNFUVQSBYUHBCM-HNNXBMFYSA-N	0	3	343.254	3.359	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H](Cn3cnc4ccccc43)C2)nc1	ZINC000602812232	460140588	/nfs/dbraw/zinc/14/05/88/460140588.db2.gz	ONXBSUUFUGAFSD-KRWDZBQOSA-N	0	3	331.423	3.215	20	30		EGEDHN
C=C[C@H]1CCCCN1CCOc1ccc(OCC(=O)OCC)cc1	ZINC000618767554	460163989	/nfs/dbraw/zinc/16/39/89/460163989.db2.gz	ZURWUDZHYXJZDK-INIZCTEOSA-N	0	3	333.428	3.048	20	30		EGEDHN
C[C@H](CNC(=O)N[C@@H]1CCc2cc(C#N)ccc21)N1CCCC[C@H]1C	ZINC000618797756	460178848	/nfs/dbraw/zinc/17/88/48/460178848.db2.gz	TXNYEMFMFHEZCI-SPYBWZPUSA-N	0	3	340.471	3.108	20	30		EGEDHN
C[C@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccc(S(C)(=O)=O)cc1	ZINC000618807900	460183994	/nfs/dbraw/zinc/18/39/94/460183994.db2.gz	XXTLDDQCUPLHBC-DJJJIMSYSA-N	0	3	340.448	3.300	20	30		EGEDHN
C[C@@H](c1ccc(F)c(F)c1)N(C)C[C@H](O)COc1ccccc1C#N	ZINC000599255729	460206318	/nfs/dbraw/zinc/20/63/18/460206318.db2.gz	IWPCHZVTUNUWFS-BBRMVZONSA-N	0	3	346.377	3.269	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)cc1)C[C@H](O)COc1ccccc1C#N	ZINC000599273687	460213997	/nfs/dbraw/zinc/21/39/97/460213997.db2.gz	GXLDZMJOCUKORN-FQEVSTJZSA-N	0	3	349.434	3.080	20	30		EGEDHN
Cc1nc(C)c([C@@H](C)N(C)C[C@H](O)COc2ccccc2C#N)s1	ZINC000599294733	460219558	/nfs/dbraw/zinc/21/95/58/460219558.db2.gz	HNPYLGXHIRIGBD-CJNGLKHVSA-N	0	3	345.468	3.064	20	30		EGEDHN
N#CCCCC[C@H](N)C(=O)N[C@H]1CCCC[C@@H]1Cc1ccccc1	ZINC000594436422	460219771	/nfs/dbraw/zinc/21/97/71/460219771.db2.gz	IZMXBWFBMXGWIX-QYZOEREBSA-N	0	3	327.472	3.315	20	30		EGEDHN
Cc1ccc([C@@H]2C[C@H]2NC(=O)C(C#N)Cc2ccc(C#N)cc2)cc1	ZINC000576825083	460220168	/nfs/dbraw/zinc/22/01/68/460220168.db2.gz	JQXUNAVXJZVIAF-SLFFLAALSA-N	0	3	329.403	3.221	20	30		EGEDHN
CC[C@H](NC[C@@H](O)COc1ccccc1C#N)c1ccc(OC)cc1	ZINC000599344211	460232467	/nfs/dbraw/zinc/23/24/67/460232467.db2.gz	AOGCRPYZEJJEAW-MJGOQNOKSA-N	0	3	340.423	3.047	20	30		EGEDHN
C[C@@H](N[C@@H](C)c1cccc(C#N)c1)c1ccc(NS(C)(=O)=O)cc1	ZINC000610829951	460245250	/nfs/dbraw/zinc/24/52/50/460245250.db2.gz	TVVFHEQJXLKLDQ-KGLIPLIRSA-N	0	3	343.452	3.342	20	30		EGEDHN
CN(CCOC(C)(C)C)CCC(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000610859829	460249685	/nfs/dbraw/zinc/24/96/85/460249685.db2.gz	OLEOIEVKGLMIME-UHFFFAOYSA-N	0	3	337.851	3.287	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N1CCC(C(N)=O)(c2ccccc2)CC1	ZINC000614963148	460253994	/nfs/dbraw/zinc/25/39/94/460253994.db2.gz	WZFGJCBABIHPHO-MRXNPFEDSA-N	0	3	333.435	3.138	20	30		EGEDHN
CN(C(=O)c1c(Cl)cc(C#N)cc1Cl)C1CCN(C)CC1	ZINC000611093211	460288036	/nfs/dbraw/zinc/28/80/36/460288036.db2.gz	KAQNJEMJPYPWHR-UHFFFAOYSA-N	0	3	326.227	3.031	20	30		EGEDHN
N#Cc1ccc(C2=CCN(Cc3ccccc3-n3cncn3)CC2)cc1	ZINC000611287730	460330709	/nfs/dbraw/zinc/33/07/09/460330709.db2.gz	HQJYYMMIGVOSFF-UHFFFAOYSA-N	0	3	341.418	3.428	20	30		EGEDHN
Cc1nn(-c2ccccc2)c(CN2CC[C@H](N3CCCCC3)C2)c1C#N	ZINC000611347183	460342061	/nfs/dbraw/zinc/34/20/61/460342061.db2.gz	MHGQZDREVFWPBD-IBGZPJMESA-N	0	3	349.482	3.113	20	30		EGEDHN
C[C@@H](NC[C@H](O)COc1cccc2[nH]ccc21)c1cccc(C#N)c1	ZINC000611388484	460351001	/nfs/dbraw/zinc/35/10/01/460351001.db2.gz	PFOWVNJZMNZGMN-PBHICJAKSA-N	0	3	335.407	3.130	20	30		EGEDHN
CC(C)[C@H](NCc1ccccc1C(C)(C)C#N)C(=O)N1CCCC1	ZINC000611395576	460355273	/nfs/dbraw/zinc/35/52/73/460355273.db2.gz	PESDCWOHYTXVRE-SFHVURJKSA-N	0	3	327.472	3.224	20	30		EGEDHN
COc1cccc2c1OC[C@@H](N[C@@H](C)c1ccc(C#N)c(F)c1)C2	ZINC000611465650	460370579	/nfs/dbraw/zinc/37/05/79/460370579.db2.gz	YVTGMCWSSCZRHY-LRDDRELGSA-N	0	3	326.371	3.360	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)N1CCC[C@](C)(C#N)C1)c1ccsc1	ZINC000612100112	460540656	/nfs/dbraw/zinc/54/06/56/460540656.db2.gz	ZDQRUDISBCRQNJ-FUHWJXTLSA-N	0	3	348.516	3.466	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N[C@@H]1CCO[C@H]1c1ccccc1	ZINC000601687880	460869770	/nfs/dbraw/zinc/86/97/70/460869770.db2.gz	BNEWMIAGMIERDW-AQNXPRMDSA-N	0	3	334.419	3.405	20	30		EGEDHN
N#CCC1(CNC[C@H](O)COc2cc(Cl)cc(Cl)c2)CC1	ZINC000601965416	460964189	/nfs/dbraw/zinc/96/41/89/460964189.db2.gz	NHUBWQSEKGODIE-ZDUSSCGKSA-N	0	3	329.227	3.017	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN(CCO)C2CCC2)cc1OC	ZINC000628244813	461061626	/nfs/dbraw/zinc/06/16/26/461061626.db2.gz	WOYWEWPMHKKWGZ-UHFFFAOYSA-N	0	3	325.836	3.260	20	30		EGEDHN
C=C(C)Cn1c(C2CCC2)nnc1N1CCN(C(C)(C)CC)CC1	ZINC000655631648	461339295	/nfs/dbraw/zinc/33/92/95/461339295.db2.gz	TZUAMKCVTMGJOG-UHFFFAOYSA-N	0	3	331.508	3.432	20	30		EGEDHN
CC#CC[C@@H](CO)NCc1c(C)nn(Cc2ccc(Cl)cc2)c1C	ZINC000641768517	461361731	/nfs/dbraw/zinc/36/17/31/461361731.db2.gz	BCJPDJHHCPXCIP-SFHVURJKSA-N	0	3	345.874	3.066	20	30		EGEDHN
C=CCN(CCC(=O)NCc1cnc(C)s1)CCc1ccccc1	ZINC000639461830	461936632	/nfs/dbraw/zinc/93/66/32/461936632.db2.gz	WSNIVOHEBLYRTE-UHFFFAOYSA-N	0	3	343.496	3.189	20	30		EGEDHN
C=CCCn1cc(CN[C@H](C)Cc2cccc(Br)c2)nn1	ZINC000657330183	462050565	/nfs/dbraw/zinc/05/05/65/462050565.db2.gz	LTQCZFAVDBUAEJ-CYBMUJFWSA-N	0	3	349.276	3.338	20	30		EGEDHN
C=CCCn1cc(CNC[C@H](c2ccc(C)cc2)N2CCCC2)nn1	ZINC000657337995	462056185	/nfs/dbraw/zinc/05/61/85/462056185.db2.gz	FRHLLKUJIFTHHC-HXUWFJFHSA-N	0	3	339.487	3.089	20	30		EGEDHN
C=C(C)[C@@H](NC(=O)N[C@H]1CCN(CCC)C1)c1ccc(F)c(F)c1	ZINC000661036972	462074616	/nfs/dbraw/zinc/07/46/16/462074616.db2.gz	NCFHKNQLDYDNCO-WMLDXEAASA-N	0	3	337.414	3.366	20	30		EGEDHN
C=CC[C@H](CC)NC(=O)N1CC[C@H](N(C)CCc2ccccc2)C1	ZINC000664809067	462195981	/nfs/dbraw/zinc/19/59/81/462195981.db2.gz	HMFYTKGOCYWPLJ-OALUTQOASA-N	0	3	329.488	3.300	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)N[C@H]1CCCN2CCCC[C@@H]12	ZINC000654439615	462225492	/nfs/dbraw/zinc/22/54/92/462225492.db2.gz	SJJYGHNYHHHSKI-ROUUACIJSA-N	0	3	343.471	3.068	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cccc3c2ccnc3OC)CC1	ZINC000640270392	462342269	/nfs/dbraw/zinc/34/22/69/462342269.db2.gz	KXQXBGYOXYQNST-UHFFFAOYSA-N	0	3	340.427	3.015	20	30		EGEDHN
C=CC(C)(C)CNC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000652232513	462483706	/nfs/dbraw/zinc/48/37/06/462483706.db2.gz	DWFXYSOKVAWZRU-SFHVURJKSA-N	0	3	329.488	3.410	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)C(=O)NC1CCN(CC=C)CC1	ZINC000171737125	526338265	/nfs/dbraw/zinc/33/82/65/526338265.db2.gz	CDUJKMVGIIIUGE-UHFFFAOYSA-N	0	3	343.471	3.043	20	30		EGEDHN
C=CCN1CCC(NC(=O)/C=C/c2ccc(OC(F)F)cc2)CC1	ZINC000171725345	526415455	/nfs/dbraw/zinc/41/54/55/526415455.db2.gz	VGVZIBZNOPIGOR-VMPITWQZSA-N	0	3	336.382	3.068	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc3ccn(C)c3c2)CC1	ZINC000173835025	526595613	/nfs/dbraw/zinc/59/56/13/526595613.db2.gz	LJBOKYVADWJTNK-UHFFFAOYSA-N	0	3	326.444	3.340	20	30		EGEDHN
C=CCN(C)Cc1ccc(OCC(=O)N2CCCCC2)c(OCC)c1	ZINC000154783667	527575424	/nfs/dbraw/zinc/57/54/24/527575424.db2.gz	UREXUADQYXMPKF-UHFFFAOYSA-N	0	3	346.471	3.094	20	30		EGEDHN
CCN(CC)[C@H](CNCc1ccc(OC)c(C#N)c1)c1ccco1	ZINC000174320951	528280705	/nfs/dbraw/zinc/28/07/05/528280705.db2.gz	ZZJFXZUNYHHSBS-QGZVFWFLSA-N	0	3	327.428	3.333	20	30		EGEDHN
CCCC[C@H](CNC(=O)OC(C)(C)C)NCc1cc(C#N)n(C)c1	ZINC000191317093	528959715	/nfs/dbraw/zinc/95/97/15/528959715.db2.gz	UMWSPHKGRYOEIA-OAHLLOKOSA-N	0	3	334.464	3.070	20	30		EGEDHN
CCO[C@@H]1C[C@@H](NCc2ccc(C#N)s2)[C@@H]1Oc1ccccc1	ZINC000187639870	535411065	/nfs/dbraw/zinc/41/10/65/535411065.db2.gz	MNTYCZZANISWGA-KURKYZTESA-N	0	3	328.437	3.334	20	30		EGEDHN
C[C@@H](C(=O)NC1(C#N)CCCCC1)N1CC[C@H](Cc2ccccc2)C1	ZINC000124281478	546744348	/nfs/dbraw/zinc/74/43/48/546744348.db2.gz	GYRQUKWXVNCRQS-PKOBYXMFSA-N	0	3	339.483	3.282	20	30		EGEDHN
COc1ccccc1NC(=O)[C@H](C)N[C@H]1CCC(=O)NC12CCC2	ZINC000328693317	547482771	/nfs/dbraw/zinc/48/27/71/547482771.db2.gz	JOFXZZZBIMIBMQ-WFASDCNBSA-N	0	3	331.416	3.303	20	30		EGEDHN
N#C[C@@H]1CCC[C@H](N[C@@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)C1	ZINC000329574611	547501978	/nfs/dbraw/zinc/50/19/78/547501978.db2.gz	ASLSDXNCHDDJFD-FRRDWIJNSA-N	0	3	335.810	3.256	20	30		EGEDHN
CCN1CCC[C@@H]1CNC(=O)N[C@H]1CCCOc2ccc(F)cc21	ZINC000329801472	547507855	/nfs/dbraw/zinc/50/78/55/547507855.db2.gz	JPWVMJDDKCIMKB-ZBFHGGJFSA-N	0	3	335.423	3.027	20	30		EGEDHN
C[C@H](NC([O-])=[NH+][C@@H]1CCn2ccnc2C1)C12CC3CC(CC(C3)C1)C2	ZINC000330185686	547514758	/nfs/dbraw/zinc/51/47/58/547514758.db2.gz	RMEQXARZPKWHHQ-JWMYSTGGSA-N	0	3	342.487	3.306	20	30		EGEDHN
N#C[C@H]1CCC[C@H]1NC(=O)NCCN1CCC2(CCCCC2)CC1	ZINC000333029001	547527412	/nfs/dbraw/zinc/52/74/12/547527412.db2.gz	BTUZRPUREJOJDA-IAGOWNOFSA-N	0	3	332.492	3.024	20	30		EGEDHN
C=C(CNC(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1ccccc1	ZINC000672682458	548462161	/nfs/dbraw/zinc/46/21/61/548462161.db2.gz	KJFZWNXKXJHYDX-HXUWFJFHSA-N	0	3	335.451	3.274	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CNC1(CO)CCCCC1	ZINC000678972861	549606508	/nfs/dbraw/zinc/60/65/08/549606508.db2.gz	QGUQDQHAXLKFTG-UHFFFAOYSA-N	0	3	334.485	3.188	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1scnc1Cl)C(C)C	ZINC000728083085	574716764	/nfs/dbraw/zinc/71/67/64/574716764.db2.gz	BFNQIXNMWMHSHV-LBPRGKRZSA-N	0	3	327.881	3.225	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H](CN2CCCCC2)c2ccccc2)cn1	ZINC000728867406	574782222	/nfs/dbraw/zinc/78/22/22/574782222.db2.gz	KRUFPNPZNRFZCZ-FQEVSTJZSA-N	0	3	333.435	3.020	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](CC)c2ccccc2OC)CC1	ZINC000730116840	574923304	/nfs/dbraw/zinc/92/33/04/574923304.db2.gz	GOTLUZUELWCSQZ-QGZVFWFLSA-N	0	3	331.460	3.096	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](C)Cc2ccccc2Cl)CC1	ZINC000730119534	574923668	/nfs/dbraw/zinc/92/36/68/574923668.db2.gz	VSAHPQYQKWSOGF-CQSZACIVSA-N	0	3	335.879	3.221	20	30		EGEDHN
CCCN1CCC(NC=C2C(=O)CC3(CCCCC3)CC2=O)CC1	ZINC000730970947	575041249	/nfs/dbraw/zinc/04/12/49/575041249.db2.gz	INKIJJPUNRBNAL-UHFFFAOYSA-N	0	3	332.488	3.217	20	30		EGEDHN
C#CCN(Cc1ccc(F)cc1)C(=O)NCCN1CCCC[C@H]1CC	ZINC000733351458	575329982	/nfs/dbraw/zinc/32/99/82/575329982.db2.gz	FLDXKEAUTDGTID-LJQANCHMSA-N	0	3	345.462	3.235	20	30		EGEDHN
C[C@@H](CCO)SCC(=O)C(C#N)c1nc(-c2ccccc2)cs1	ZINC000741733777	575331144	/nfs/dbraw/zinc/33/11/44/575331144.db2.gz	WXAKUVDBTZZSNN-GXTWGEPZSA-N	0	3	346.477	3.490	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1Cl)C(=O)[C@@H]1COc2ccccc21	ZINC000733678883	575381111	/nfs/dbraw/zinc/38/11/11/575381111.db2.gz	NIVIWGPNSVUNEP-CHWSQXEVSA-N	0	3	340.766	3.164	20	30		EGEDHN
CC1CCC(N2CCN(C(=O)/C=C/c3ccccc3C#N)CC2)CC1	ZINC000734401002	575480071	/nfs/dbraw/zinc/48/00/71/575480071.db2.gz	QZQGRMMTIGKVKP-DHZHZOJOSA-N	0	3	337.467	3.294	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN[C@H](C)c2ccc3[nH]c(=O)[nH]c3c2)cc1	ZINC000740897821	576634980	/nfs/dbraw/zinc/63/49/80/576634980.db2.gz	GALFSIZMFNTMGX-CHWSQXEVSA-N	0	3	336.395	3.410	20	30		EGEDHN
CN(C)C1(CN=Cc2cc3ccccc3[nH]c2=O)Cc2ccccc2C1	ZINC000741466228	576688234	/nfs/dbraw/zinc/68/82/34/576688234.db2.gz	IXIAVZGTKUVUAK-UCQKPKSFSA-N	0	3	345.446	3.459	20	30		EGEDHN
C#CCOc1ccc(C(=O)N2CCN(C3CCC(C)CC3)CC2)cc1	ZINC000741564495	576701631	/nfs/dbraw/zinc/70/16/31/576701631.db2.gz	CLTZIKHSGNWHKB-UHFFFAOYSA-N	0	3	340.467	3.035	20	30		EGEDHN
CON=Cc1ccc(C(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)cc1	ZINC000742401237	576779705	/nfs/dbraw/zinc/77/97/05/576779705.db2.gz	AKACJBPYWVEWIS-IBGZPJMESA-N	0	3	339.439	3.008	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@H]1C[C@]12CCc1ccccc12	ZINC000744022794	576818975	/nfs/dbraw/zinc/81/89/75/576818975.db2.gz	SPDMJICNMTUKJT-BLIXFSHQSA-N	0	3	338.451	3.296	20	30		EGEDHN
N#CC(C(=O)NC1CCCCC1)C(=O)[C@@H]1C[C@]12CCc1ccccc12	ZINC000744027151	576819098	/nfs/dbraw/zinc/81/90/98/576819098.db2.gz	KEVLLVPFANWQSJ-MDKPJZGXSA-N	0	3	336.435	3.048	20	30		EGEDHN
C=C[C@H](C)[NH2+]Cc1cccc(OCc2ccccc2-c2nn[n-]n2)c1	ZINC000819730015	606772004	/nfs/dbraw/zinc/77/20/04/606772004.db2.gz	PQJGIIJFQDUBLD-AWEZNQCLSA-N	0	3	335.411	3.110	20	30		EGEDHN
C=C[C@H](C)[NH2+]Cc1cccc(OCc2ccccc2-c2nnn[n-]2)c1	ZINC000819730015	606772002	/nfs/dbraw/zinc/77/20/02/606772002.db2.gz	PQJGIIJFQDUBLD-AWEZNQCLSA-N	0	3	335.411	3.110	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1ccc(Br)cc1Cl	ZINC000691634048	1298135853	/nfs/dbraw/zinc/13/58/53/1298135853.db2.gz	ZLWZZUIEYGXPOV-JTQLQIEISA-N	0	3	330.613	3.062	20	30		EGEDHN
C[C@H](SCc1ccccc1)C(=O)C(C#N)C(=O)NC1CCCCC1	ZINC000050683757	1291654236	/nfs/dbraw/zinc/65/42/36/1291654236.db2.gz	ADUWXCLBTHANHH-WMLDXEAASA-N	0	3	344.480	3.466	20	30		EGEDHN
N#CC(C(=O)CCc1cccc(Cl)c1)C(=O)NC1CCCCC1	ZINC000050682332	1291654315	/nfs/dbraw/zinc/65/43/15/1291654315.db2.gz	FVEURCMCIATGJR-INIZCTEOSA-N	0	3	332.831	3.430	20	30		EGEDHN
Cc1ccc(C(=O)CCC(=O)C(C#N)C(=O)NC2CCCCC2)s1	ZINC000050681772	1291654383	/nfs/dbraw/zinc/65/43/83/1291654383.db2.gz	BOQFCKGINNQUKQ-CQSZACIVSA-N	0	3	346.452	3.177	20	30		EGEDHN
COc1ccc(CCNC(=O)C(C#N)C(=O)CCC2CCCC2)cc1	ZINC000051594476	1291681297	/nfs/dbraw/zinc/68/12/97/1291681297.db2.gz	MFNCXDFYICQGAP-GOSISDBHSA-N	0	3	342.439	3.033	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(OCCC(C)C)cc2)CC1	ZINC000073376602	1292315849	/nfs/dbraw/zinc/31/58/49/1292315849.db2.gz	XZGCGRQHZJNIHM-UHFFFAOYSA-N	0	3	328.456	3.395	20	30		EGEDHN
C#Cc1cnc(NC[C@@H](c2cccc(C(F)(F)F)c2)N(C)C)nc1	ZINC000827932419	1292405426	/nfs/dbraw/zinc/40/54/26/1292405426.db2.gz	NSDMKJQKDPFWCN-HNNXBMFYSA-N	0	3	334.345	3.192	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(Cl)cc2-n2cccc2)CC1	ZINC000103983857	1293017783	/nfs/dbraw/zinc/01/77/83/1293017783.db2.gz	IDDUVMOJXRTMFH-UHFFFAOYSA-N	0	3	341.842	3.414	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)[C@@H](C)Cc1ccc(Cl)cc1Cl	ZINC000107409400	1293066817	/nfs/dbraw/zinc/06/68/17/1293066817.db2.gz	AEWDLVLJPMWSER-GWCFXTLKSA-N	0	3	341.238	3.405	20	30		EGEDHN
C[C@H](CSc1ccccc1)C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000111945982	1293113696	/nfs/dbraw/zinc/11/36/96/1293113696.db2.gz	OMXAMSFTDCIQAW-UKRRQHHQSA-N	0	3	339.420	3.157	20	30		EGEDHN
C[C@H](CSc1ccccc1)C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000111945986	1293113710	/nfs/dbraw/zinc/11/37/10/1293113710.db2.gz	OMXAMSFTDCIQAW-HIFRSBDPSA-N	0	3	339.420	3.157	20	30		EGEDHN
COc1ccc(CNC(=O)C(C#N)C(=O)[C@@H](C)CC2CCCC2)cc1	ZINC000114618455	1293172977	/nfs/dbraw/zinc/17/29/77/1293172977.db2.gz	QQYKADAHLMXYGZ-KBXCAEBGSA-N	0	3	342.439	3.237	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)CSCCC(C)C	ZINC000121342670	1293367026	/nfs/dbraw/zinc/36/70/26/1293367026.db2.gz	FYFUTJRVRVIBIX-CYBMUJFWSA-N	0	3	334.441	3.122	20	30		EGEDHN
N#CC(C(=O)CSc1ccc2ccccc2c1)C(=O)N1CCCC1	ZINC000124675338	1293481641	/nfs/dbraw/zinc/48/16/41/1293481641.db2.gz	NNLFJCQHBMJIQG-QGZVFWFLSA-N	0	3	338.432	3.263	20	30		EGEDHN
C#CCOc1ccc(NC(=O)N2CCN(C3CCCCC3)CC2)cc1	ZINC000124937180	1293489563	/nfs/dbraw/zinc/48/95/63/1293489563.db2.gz	HTJIXQLBOXFSRA-UHFFFAOYSA-N	0	3	341.455	3.181	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)COc1ccc(C)cc1C	ZINC000125607363	1293511533	/nfs/dbraw/zinc/51/15/33/1293511533.db2.gz	BVFFWPIIDUBDMX-INIZCTEOSA-N	0	3	330.428	3.088	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@H](C)Oc1cccc(C)c1	ZINC000125598208	1293511779	/nfs/dbraw/zinc/51/17/79/1293511779.db2.gz	YPNNAYVKKAGZHT-RDJZCZTQSA-N	0	3	330.428	3.168	20	30		EGEDHN
CN(CCOc1ccc(Cl)cc1)C[C@H](O)c1ccc(C#N)cc1	ZINC000126641700	1293541064	/nfs/dbraw/zinc/54/10/64/1293541064.db2.gz	ZEMBDHLOOMJNHG-SFHVURJKSA-N	0	3	330.815	3.256	20	30		EGEDHN
COCCN1[C@H](C)CN(Cc2ccccc2C(C)(C)C#N)C[C@@H]1C	ZINC000129073610	1293613400	/nfs/dbraw/zinc/61/34/00/1293613400.db2.gz	DMIHBLRWNIBXBD-CALCHBBNSA-N	0	3	329.488	3.029	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)Cc1ccc(N2CCOCC2)c(F)c1	ZINC000130764375	1293668079	/nfs/dbraw/zinc/66/80/79/1293668079.db2.gz	NHUCQCYQOANPEQ-UHFFFAOYSA-N	0	3	339.414	3.166	20	30		EGEDHN
CC[C@H](CC(=O)C(C#N)C(=O)NC1CCCC1)c1ccc(OC)cc1	ZINC000152457630	1293970118	/nfs/dbraw/zinc/97/01/18/1293970118.db2.gz	OCPYJRHBLOZNBU-KDOFPFPSSA-N	0	3	342.439	3.347	20	30		EGEDHN
C[C@H](OC1CCCCCC1)C(=O)C(C#N)c1nnc2n1CCCCC2	ZINC000162680893	1294319925	/nfs/dbraw/zinc/31/99/25/1294319925.db2.gz	NGMHFPNMPDULOI-GOEBONIOSA-N	0	3	344.459	3.309	20	30		EGEDHN
N#Cc1ccccc1/C=C/C(=O)O[C@@H]1CCN(Cc2ccccc2)C1	ZINC000172151398	1294429362	/nfs/dbraw/zinc/42/93/62/1294429362.db2.gz	UHKPMSWXQCHSLK-CTDFXDFQSA-N	0	3	332.403	3.389	20	30		EGEDHN
N#CC(C(=O)CC[C@H]1CCOC1)c1nc2ccccc2n1C(F)F	ZINC000176100182	1294590193	/nfs/dbraw/zinc/59/01/93/1294590193.db2.gz	QGABUFOTFUMPAO-RYUDHWBXSA-N	0	3	333.338	3.424	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)c1cc(OC)cs1	ZINC000177600153	1294680976	/nfs/dbraw/zinc/68/09/76/1294680976.db2.gz	PUCNIDFHYGGYDI-LBPRGKRZSA-N	0	3	344.392	3.117	20	30		EGEDHN
Cn1cc(CNCc2ccc(OCC#N)cc2)c(-c2ccccc2)n1	ZINC000180234052	1294872908	/nfs/dbraw/zinc/87/29/08/1294872908.db2.gz	KNNGLYIAPLWHDK-UHFFFAOYSA-N	0	3	332.407	3.279	20	30		EGEDHN
CC(C)N1CCN(c2ccc(C(=O)OCC3(C#N)CCC3)cc2)CC1	ZINC000183850120	1295152522	/nfs/dbraw/zinc/15/25/22/1295152522.db2.gz	MPIONMQGPZEHKN-UHFFFAOYSA-N	0	3	341.455	3.068	20	30		EGEDHN
C#CCOc1ccccc1NC(=O)NC[C@@H](c1ccccc1)N(C)C	ZINC000188126543	1295438177	/nfs/dbraw/zinc/43/81/77/1295438177.db2.gz	MUXYPJFWRQGKBP-SFHVURJKSA-N	0	3	337.423	3.123	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)COc1ccc(Cl)c(C)c1	ZINC000193376945	1295858760	/nfs/dbraw/zinc/85/87/60/1295858760.db2.gz	GEGYGCYBDUQBPQ-CQSZACIVSA-N	0	3	336.819	3.043	20	30		EGEDHN
CCCc1nc(C)c(C(=O)C(C#N)C(=O)Nc2ccccc2)s1	ZINC000193446152	1295870737	/nfs/dbraw/zinc/87/07/37/1295870737.db2.gz	LYLHZIBVULPKMW-CYBMUJFWSA-N	0	3	327.409	3.365	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CNCc2ccc(-n3ccnc3)cc2)cc1	ZINC000237599912	1296252809	/nfs/dbraw/zinc/25/28/09/1296252809.db2.gz	AAZSCMOQZRZHQF-MRXNPFEDSA-N	0	3	332.407	3.453	20	30		EGEDHN
CC(C)(C)OC(=O)N1[C@@H]2CC[C@H]1C[C@@H](CNC[C@@H](C#N)CCC#N)C2	ZINC000872233115	1296833561	/nfs/dbraw/zinc/83/35/61/1296833561.db2.gz	NFCNUGIKIPMQQW-WCXIOVBPSA-N	0	3	346.475	3.198	20	30		EGEDHN
C#CCOc1ccccc1CNCCN(CC)C(=O)OC(C)(C)C	ZINC000304861042	1296945937	/nfs/dbraw/zinc/94/59/37/1296945937.db2.gz	PCXHWEQEMVPRFR-UHFFFAOYSA-N	0	3	332.444	3.045	20	30		EGEDHN
CCc1nc(C#N)cc(N2C[C@H](C)N(Cc3ccccc3)[C@H](C)[C@H]2C)n1	ZINC000404423339	1297753887	/nfs/dbraw/zinc/75/38/87/1297753887.db2.gz	JWIOHBUPBFLANL-GVDBMIGSSA-N	0	3	349.482	3.398	20	30		EGEDHN
C[C@@H]1CCN(Cc2ccccc2)C[C@H]1NC(=O)c1cccc(C#N)c1	ZINC000716261103	1298295343	/nfs/dbraw/zinc/29/53/43/1298295343.db2.gz	DBXNQWJNWANRTQ-OXQOHEQNSA-N	0	3	333.435	3.199	20	30		EGEDHN
Oc1cccc(C=Nc2ccc(CCN3CCSCC3)cc2)c1O	ZINC000747033083	1298712716	/nfs/dbraw/zinc/71/27/16/1298712716.db2.gz	NOHMSWLUKKYFMO-UHFFFAOYSA-N	0	3	342.464	3.440	20	30		EGEDHN
C=C(Cl)C[C@H](N)C(=O)NCC1(c2c(F)cccc2F)CCCC1	ZINC000876637881	1298888295	/nfs/dbraw/zinc/88/82/95/1298888295.db2.gz	URDURXFWYGWXNJ-AWEZNQCLSA-N	0	3	342.817	3.363	20	30		EGEDHN
C#CCCCCCCN[C@@H](c1nc(-c2nc[nH]n2)no1)C(C)(C)C	ZINC000877113667	1299162158	/nfs/dbraw/zinc/16/21/58/1299162158.db2.gz	NLXABEYRBDLNOZ-ZDUSSCGKSA-N	0	3	330.436	3.115	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN2CC[C@H](OCc3ccccn3)C2)cc1	ZINC000877645744	1299453421	/nfs/dbraw/zinc/45/34/21/1299453421.db2.gz	VGFGZIQCSIDOJA-JXFKEZNVSA-N	0	3	337.423	3.164	20	30		EGEDHN
CC1(C)CN(CC(=O)C(C#N)c2nc3ccccc3s2)CCS1	ZINC000751494837	1299556792	/nfs/dbraw/zinc/55/67/92/1299556792.db2.gz	RCOCTQORRSHRLL-GFCCVEGCSA-N	0	3	345.493	3.300	20	30		EGEDHN
C[C@@H](NCC(=O)N[C@](C)(C#N)C1CC1)c1csc2ccccc21	ZINC000754745876	1300207432	/nfs/dbraw/zinc/20/74/32/1300207432.db2.gz	YDXZTWYSYSPKHK-KZULUSFZSA-N	0	3	327.453	3.360	20	30		EGEDHN
COc1ccc(CNC(=O)C(C#N)C(=O)[C@H](C)CCC(C)(C)C)cc1	ZINC000755610449	1300365067	/nfs/dbraw/zinc/36/50/67/1300365067.db2.gz	OHBKCVCJFHINCV-PBHICJAKSA-N	0	3	344.455	3.483	20	30		EGEDHN
C[C@@H]1CN(C2CC2)CC1N=Nc1ncnc2sc3c(c21)CCC3	ZINC000755879510	1300408079	/nfs/dbraw/zinc/40/80/79/1300408079.db2.gz	HVRHTIYFWGZDQK-SNVBAGLBSA-N	0	3	327.457	3.062	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)OC(C)(C)C)CN1Cc1ccc(CC#N)cc1	ZINC000879226488	1300438461	/nfs/dbraw/zinc/43/84/61/1300438461.db2.gz	PJIGCFPUYQNXST-YOEHRIQHSA-N	0	3	329.444	3.240	20	30		EGEDHN
COc1cccc([C@H]2CN(Cc3ccc(C#N)cc3Cl)CCN2)c1	ZINC000879523529	1300578998	/nfs/dbraw/zinc/57/89/98/1300578998.db2.gz	ZYDCHURIFMRLMB-LJQANCHMSA-N	0	3	341.842	3.367	20	30		EGEDHN
CC[C@@H]1CC[C@@H](C(=O)C(C#N)C(=O)Nc2cccc3ccccc32)O1	ZINC000757307765	1300664858	/nfs/dbraw/zinc/66/48/58/1300664858.db2.gz	XZRWCCRFRHIKDH-KYJSFNMBSA-N	0	3	336.391	3.445	20	30		EGEDHN
CC[C@@H](C(=O)NCc1cccc(-c2ccc(C#N)s2)c1)N(C)C	ZINC000765621228	1302291394	/nfs/dbraw/zinc/29/13/94/1302291394.db2.gz	APWGZRANRHDSTG-INIZCTEOSA-N	0	3	327.453	3.243	20	30		EGEDHN
COc1ccc(C(=O)C(C#N)C(=O)Nc2cccc(C)c2)nc1Cl	ZINC000766841612	1302529530	/nfs/dbraw/zinc/52/95/30/1302529530.db2.gz	VJLJDRARTNKIOX-LBPRGKRZSA-N	0	3	343.770	3.013	20	30		EGEDHN
C=CCNC(=O)[C@H](C)N1CC[C@H](c2ccc(C(F)(F)F)cc2)C1	ZINC000767875140	1302777755	/nfs/dbraw/zinc/77/77/55/1302777755.db2.gz	JSBKLYODOPCCMP-JSGCOSHPSA-N	0	3	326.362	3.185	20	30		EGEDHN
C#CCCOc1ccc(CN(C)C[C@@H]2COc3ccccc3O2)cc1	ZINC000768178188	1302843764	/nfs/dbraw/zinc/84/37/64/1302843764.db2.gz	FPOFEBPLSVESTR-LJQANCHMSA-N	0	3	337.419	3.361	20	30		EGEDHN
CCN1CCCC[C@H]1C(=O)N1CCC(c2ccc(C#N)cc2)CC1	ZINC000887704486	1303901176	/nfs/dbraw/zinc/90/11/76/1303901176.db2.gz	HRLMMYFFGMIKIX-IBGZPJMESA-N	0	3	325.456	3.139	20	30		EGEDHN
CC(C)C[C@H](NCC(=O)NCCC#N)c1cccc(C(F)(F)F)c1	ZINC000775322841	1303939680	/nfs/dbraw/zinc/93/96/80/1303939680.db2.gz	ASHMBHZZAVYHEZ-HNNXBMFYSA-N	0	3	341.377	3.412	20	30		EGEDHN
CN(C)c1ccncc1C=[NH+][N-]c1ccc(F)cc1Br	ZINC000776186733	1304108160	/nfs/dbraw/zinc/10/81/60/1304108160.db2.gz	YGNQFJWZSHPFLY-UHFFFAOYSA-N	0	3	337.196	3.495	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CN[C@H]1CCc2nc(C)ncc2C1	ZINC000778156535	1304405200	/nfs/dbraw/zinc/40/52/00/1304405200.db2.gz	XPPATCSUNZMZBE-HNNXBMFYSA-N	0	3	341.842	3.098	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)Nc1ccc(C#N)cn1)c1ccsc1	ZINC000889221241	1304417156	/nfs/dbraw/zinc/41/71/56/1304417156.db2.gz	XLTWTRBLYZIJJY-OAHLLOKOSA-N	0	3	343.456	3.219	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CN1CC[C@@H](Cc2cnn(C)c2)C1	ZINC000779164987	1304536831	/nfs/dbraw/zinc/53/68/31/1304536831.db2.gz	WTCFQTFOTFPUQC-HNNXBMFYSA-N	0	3	343.858	3.150	20	30		EGEDHN
CC[C@@H]1C[C@H](C(=O)C(C#N)C(=O)Nc2ccccc2Cl)CCO1	ZINC000780304688	1304674717	/nfs/dbraw/zinc/67/47/17/1304674717.db2.gz	ADXXHLJMUYSZBF-JHJVBQTASA-N	0	3	334.803	3.193	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)cn1)[C@@H]1CCCCN1C(=O)OC(C)(C)C	ZINC000783300633	1305078769	/nfs/dbraw/zinc/07/87/69/1305078769.db2.gz	OPCHJIYEGYZCFP-PBHICJAKSA-N	0	3	344.459	3.221	20	30		EGEDHN
N#CC(C(=O)CCCCc1ccccc1)C(=O)NCc1ccccc1	ZINC000892485277	1305399454	/nfs/dbraw/zinc/39/94/54/1305399454.db2.gz	WWEJAWZPFJCAGX-IBGZPJMESA-N	0	3	334.419	3.425	20	30		EGEDHN
N#CC(C(=O)CCCOc1ccc2c(c1)NC(=O)CC2)c1ccccn1	ZINC000786298990	1305552687	/nfs/dbraw/zinc/55/26/87/1305552687.db2.gz	LWUMNADISBQXEV-MRXNPFEDSA-N	0	3	349.390	3.002	20	30		EGEDHN
N#CC(C(=O)CCC1CCCC1)C(=O)NCc1ccc(F)c(F)c1	ZINC000786571644	1305601964	/nfs/dbraw/zinc/60/19/64/1305601964.db2.gz	YHBGVHZIIZAGDU-AWEZNQCLSA-N	0	3	334.366	3.260	20	30		EGEDHN
CC(C)n1cc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)cn1	ZINC000786931304	1305661381	/nfs/dbraw/zinc/66/13/81/1305661381.db2.gz	WOBJSPSCUYDZDR-GFCCVEGCSA-N	0	3	330.775	3.079	20	30		EGEDHN
C#CCC1(C(=O)NCC2(N3CCSCC3)CCCC2)CCCCC1	ZINC000788166371	1305887085	/nfs/dbraw/zinc/88/70/85/1305887085.db2.gz	FZUMIYWRHUSXIH-UHFFFAOYSA-N	0	3	348.556	3.438	20	30		EGEDHN
C=CCC1(O)CCN(Cc2c(C)nn(-c3ccccc3)c2C)CC1	ZINC000895835148	1309545823	/nfs/dbraw/zinc/54/58/23/1309545823.db2.gz	ATIXBWSKHVUSJS-UHFFFAOYSA-N	0	3	325.456	3.392	20	30		EGEDHN
COC(=O)[C@H]1[C@@H]2CN(Cc3ccc(-c4ccccc4C#N)cc3)C[C@@H]21	ZINC000794953952	1309632291	/nfs/dbraw/zinc/63/22/91/1309632291.db2.gz	TWOVVNDUKKGZJD-PMOLBWCYSA-N	0	3	332.403	3.076	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CNCc2ccc(C[S@](C)=O)cc2)cc1	ZINC000796525431	1310020872	/nfs/dbraw/zinc/02/08/72/1310020872.db2.gz	CPMWDDHCEJJBCE-MYYSRTQBSA-N	0	3	342.464	3.146	20	30		EGEDHN
N#CC(C(=O)CCc1cnccn1)c1nc2ccccc2n1C(F)F	ZINC000796649456	1310056404	/nfs/dbraw/zinc/05/64/04/1310056404.db2.gz	HWGNPPJYJLWSRY-GFCCVEGCSA-N	0	3	341.321	3.030	20	30		EGEDHN
CSCCCN(C)CC(=O)C(C#N)c1nc2ccccc2s1	ZINC000799200614	1310512348	/nfs/dbraw/zinc/51/23/48/1310512348.db2.gz	MCIISTANEZJNDG-LBPRGKRZSA-N	0	3	333.482	3.157	20	30		EGEDHN
CCCN(CCNCc1ccc(C#N)c(OC)c1)C(=O)OC(C)(C)C	ZINC000799340742	1310528906	/nfs/dbraw/zinc/52/89/06/1310528906.db2.gz	QXKPQEFZTZWONZ-UHFFFAOYSA-N	0	3	347.459	3.304	20	30		EGEDHN
Cc1ccc(C(=O)N(CCN(C)C)Cc2cccs2)cc1C#N	ZINC000799347853	1310532355	/nfs/dbraw/zinc/53/23/55/1310532355.db2.gz	POHMMMCHPUQINZ-UHFFFAOYSA-N	0	3	327.453	3.132	20	30		EGEDHN
Cc1ccc(C(=O)N(CCN(C)C)CC2CCCCC2)cc1C#N	ZINC000799576037	1310579046	/nfs/dbraw/zinc/57/90/46/1310579046.db2.gz	QMJAQLHXDBGNSM-UHFFFAOYSA-N	0	3	327.472	3.451	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CCN(C(=O)C#Cc2cccs2)C1	ZINC000836919402	1320554634	/nfs/dbraw/zinc/55/46/34/1320554634.db2.gz	IOQRNELSCKVAHV-KRWDZBQOSA-N	0	3	338.476	3.080	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CC[C@H](NCc2cc(C)ccc2F)C1	ZINC001018969125	1316989573	/nfs/dbraw/zinc/98/95/73/1316989573.db2.gz	NLCLKNQCLKMKEP-KRWDZBQOSA-N	0	3	341.430	3.126	20	30		EGEDHN
CC(C)(C)[C@@H]1C[C@H]1C(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001019132576	1317065657	/nfs/dbraw/zinc/06/56/57/1317065657.db2.gz	ZQCQTSGABMFZLE-GVDBMIGSSA-N	0	3	343.446	3.070	20	30		EGEDHN
CC1(C)CCC[C@H]1C(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001019255409	1317128191	/nfs/dbraw/zinc/12/81/91/1317128191.db2.gz	GWDIFRCNPFGRKA-IRXDYDNUSA-N	0	3	343.446	3.214	20	30		EGEDHN
CCOC(=O)c1[nH]c(C)c(CNCc2ccc(OCC#N)cc2)c1C	ZINC000858129668	1328690254	/nfs/dbraw/zinc/69/02/54/1328690254.db2.gz	OEIKHEWCKUMEET-UHFFFAOYSA-N	0	3	341.411	3.000	20	30		EGEDHN
CC[C@H](C)N[C@@H](CNC(=O)c1ccc(C)c(C#N)c1)c1ccco1	ZINC000807679192	1317576004	/nfs/dbraw/zinc/57/60/04/1317576004.db2.gz	GEGFGYYDMMYYEE-YOEHRIQHSA-N	0	3	325.412	3.319	20	30		EGEDHN
CN(C)C[C@H](NC(=O)/C=C/c1ccccc1C#N)c1ccc(F)cc1	ZINC000807703516	1317578999	/nfs/dbraw/zinc/57/89/99/1317578999.db2.gz	IWZXOTQCJZYQST-DLENHJPASA-N	0	3	337.398	3.130	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H](c2ccc(CC(C)C)cc2)N(C)C)cn1	ZINC000807726102	1317580310	/nfs/dbraw/zinc/58/03/10/1317580310.db2.gz	IUEREHSGHQWBEI-NRFANRHFSA-N	0	3	349.478	3.294	20	30		EGEDHN
CC(C)C[C@H]1CN(C)CCN1Cn1ccc(-c2ccc(C#N)cc2)n1	ZINC000902543020	1317591003	/nfs/dbraw/zinc/59/10/03/1317591003.db2.gz	OLBGDKUNBQLSFN-IBGZPJMESA-N	0	3	337.471	3.041	20	30		EGEDHN
CC[C@H](NCc1ccc(OCCO)c(OC)c1)c1cccc(C#N)c1	ZINC000902758971	1317613852	/nfs/dbraw/zinc/61/38/52/1317613852.db2.gz	MFTPMWSAJZKUOA-SFHVURJKSA-N	0	3	340.423	3.179	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@H](NC(=O)C[C@H]3C=CCCC3)C2)c(F)c1	ZINC001020283399	1317623400	/nfs/dbraw/zinc/62/34/00/1317623400.db2.gz	BFCHJMCIJDDZCD-WBAXXEDZSA-N	0	3	341.430	3.181	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cn(CC)c3ccccc23)C1	ZINC001020373233	1317666731	/nfs/dbraw/zinc/66/67/31/1317666731.db2.gz	PYVCWRHEHFSEHU-HDJSIYSDSA-N	0	3	331.847	3.264	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)Cc2cccc(C)c2Cl)C1	ZINC001020388259	1317675761	/nfs/dbraw/zinc/67/57/61/1317675761.db2.gz	ZPJIVEXBZJPAPB-HDJSIYSDSA-N	0	3	327.255	3.180	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2C[C@H](NCc3ccccc3Cl)C2)cc1	ZINC001020456541	1317704644	/nfs/dbraw/zinc/70/46/44/1317704644.db2.gz	UVLHGYGUDRPVKP-IYARVYRRSA-N	0	3	338.838	3.372	20	30		EGEDHN
C#Cc1ccc(CN[C@@H](CN2CCOCC2)c2ccc(C)cc2)cc1	ZINC000809602963	1317841462	/nfs/dbraw/zinc/84/14/62/1317841462.db2.gz	FLBCHQWVVWFEGF-QFIPXVFZSA-N	0	3	334.463	3.139	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)c2ccsc2Cl)C1	ZINC001020681558	1317860623	/nfs/dbraw/zinc/86/06/23/1317860623.db2.gz	LHIJUGQXEKJHII-KYZUINATSA-N	0	3	349.681	3.161	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)Cc2c[nH]c3c2cccc3C)C1	ZINC001020681534	1317860688	/nfs/dbraw/zinc/86/06/88/1317860688.db2.gz	JZZRHJRTSXBTPM-SHTZXODSSA-N	0	3	331.847	3.008	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)Cc2cccc3sccc32)C1	ZINC001020681711	1317861107	/nfs/dbraw/zinc/86/11/07/1317861107.db2.gz	UFRVYIZHUIIFEK-HDJSIYSDSA-N	0	3	334.872	3.433	20	30		EGEDHN
C#C[C@@H](NCc1cnn(-c2ccc(Br)cc2)c1)C(C)C	ZINC000809685098	1317862612	/nfs/dbraw/zinc/86/26/12/1317862612.db2.gz	ZFTROVABLDKNRF-MRXNPFEDSA-N	0	3	332.245	3.382	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)[C@@H]2CCCC[C@@H]2CC)C1	ZINC001020843484	1317950930	/nfs/dbraw/zinc/95/09/30/1317950930.db2.gz	HOFUYXDTYYQADA-ZQDZILKHSA-N	0	3	343.309	3.348	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@H](NCc1ccc(N3CCOC3=O)cc1)CC2	ZINC000810235866	1317983163	/nfs/dbraw/zinc/98/31/63/1317983163.db2.gz	VNIIDCPODCGUAV-LJQANCHMSA-N	0	3	333.391	3.292	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)[C@H]1CCCSC1)c1ccccc1	ZINC000810710775	1318047203	/nfs/dbraw/zinc/04/72/03/1318047203.db2.gz	VEZSPVBLUTXRFO-XHSDSOJGSA-N	0	3	330.453	3.106	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)Cc2ccc(OC(C)C)cc2)C1	ZINC001021082378	1318072516	/nfs/dbraw/zinc/07/25/16/1318072516.db2.gz	PAJFTSCJNIHGNK-WKILWMFISA-N	0	3	336.863	3.006	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)c2ccco2)c(F)c1	ZINC000959843550	1318220645	/nfs/dbraw/zinc/22/06/45/1318220645.db2.gz	FOEYDGFPDBUGSJ-INIZCTEOSA-N	0	3	341.386	3.075	20	30		EGEDHN
Cc1ccc(CNC[C@@H]2CCCCN2C(=O)[C@H](C)C#N)c(Cl)c1	ZINC000959918074	1318265999	/nfs/dbraw/zinc/26/59/99/1318265999.db2.gz	AFINTAGZLTTWCQ-ZBFHGGJFSA-N	0	3	333.863	3.279	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)s1	ZINC000959961981	1318291860	/nfs/dbraw/zinc/29/18/60/1318291860.db2.gz	SJNYTSLOOFGPDA-XJKSGUPXSA-N	0	3	331.485	3.137	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@H](CCCN3C(=O)c3ccc[nH]3)C2)c1	ZINC001021519373	1318345939	/nfs/dbraw/zinc/34/59/39/1318345939.db2.gz	NIQRUBURQYCLQW-UYAOXDASSA-N	0	3	348.450	3.013	20	30		EGEDHN
C=C1CCC(C(=O)N2CCCC[C@H]2CNCc2cccnc2)CC1	ZINC000960111913	1318363207	/nfs/dbraw/zinc/36/32/07/1318363207.db2.gz	PYFJNCJGALQCAY-IBGZPJMESA-N	0	3	327.472	3.299	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@@H](CCCN3C(=O)C=C3CCC3)C2)cc1	ZINC001021558667	1318406671	/nfs/dbraw/zinc/40/66/71/1318406671.db2.gz	KZBFWRQOOHVALI-SFTDATJTSA-N	0	3	349.478	3.481	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@H](CCCN3C(=O)C3=CCCC3)C2)cc1	ZINC001021561649	1318409964	/nfs/dbraw/zinc/40/99/64/1318409964.db2.gz	FPJPXEKONOQEFU-RTWAWAEBSA-N	0	3	349.478	3.481	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1csnc1C	ZINC000960258401	1318433660	/nfs/dbraw/zinc/43/36/60/1318433660.db2.gz	KKFDLVSIRLLDHL-IAGOWNOFSA-N	0	3	327.453	3.013	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1sc(Cl)nc1C	ZINC000960272538	1318437136	/nfs/dbraw/zinc/43/71/36/1318437136.db2.gz	DDMNYLBEFQQOAZ-ZIAGYGMSSA-N	0	3	347.871	3.276	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2sc(C)cc2C)C1	ZINC001021595590	1318440890	/nfs/dbraw/zinc/44/08/90/1318440890.db2.gz	BSJFYYMZGZWIFB-IAGOWNOFSA-N	0	3	330.497	3.315	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2csc(C)c2C)C1	ZINC001021598453	1318443021	/nfs/dbraw/zinc/44/30/21/1318443021.db2.gz	VCTKJPXHZMJEQT-FUHWJXTLSA-N	0	3	330.497	3.315	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cncc(CC)c1	ZINC000960288281	1318445682	/nfs/dbraw/zinc/44/56/82/1318445682.db2.gz	NDGBEPMIPYEYKE-WOJBJXKFSA-N	0	3	335.451	3.206	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)CCc2ccsc2)C1	ZINC001021603917	1318447923	/nfs/dbraw/zinc/44/79/23/1318447923.db2.gz	SPZJSKPLIHYKOU-ROUUACIJSA-N	0	3	330.497	3.017	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(F)c(C)cc2F)C1	ZINC001021608483	1318454392	/nfs/dbraw/zinc/45/43/92/1318454392.db2.gz	QMEKLIDLTKLMCU-KXBFYZLASA-N	0	3	346.421	3.223	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)Cc1cc(C)ccc1F	ZINC000960326207	1318462043	/nfs/dbraw/zinc/46/20/43/1318462043.db2.gz	VGFOQOFBSDHAJO-TZIWHRDSSA-N	0	3	338.426	3.234	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc2nc(C)ccc2o1	ZINC000960325517	1318462285	/nfs/dbraw/zinc/46/22/85/1318462285.db2.gz	MKLVRENKHLHRDA-YLJYHZDGSA-N	0	3	347.418	3.308	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)C[C@H]1OCc2ccccc21	ZINC000960331546	1318464811	/nfs/dbraw/zinc/46/48/11/1318464811.db2.gz	VIMDHIYFVUNWMH-KCZVDYSFSA-N	0	3	348.446	3.206	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@H]1C2[C@@H]1[C@@H]1CC[C@H]2C1	ZINC000960333102	1318465743	/nfs/dbraw/zinc/46/57/43/1318465743.db2.gz	LHHSDZCFBAYJSO-GSXIQEMTSA-N	0	3	336.479	3.226	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(Cl)ccc2F)C1	ZINC001021627954	1318480670	/nfs/dbraw/zinc/48/06/70/1318480670.db2.gz	RAEFTNKZIHBARH-DYVFJYSZSA-N	0	3	334.822	3.039	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(C)cc(Cl)c2)C1	ZINC001021631880	1318485481	/nfs/dbraw/zinc/48/54/81/1318485481.db2.gz	BYSSAFJBFFGYBR-CRAIPNDOSA-N	0	3	330.859	3.208	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc3ccc(C)cc3[nH]2)C1	ZINC001021642056	1318499647	/nfs/dbraw/zinc/49/96/47/1318499647.db2.gz	NUYJDTKJIOJWGD-NQIIRXRSSA-N	0	3	349.478	3.426	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)c1ccccc1	ZINC000960382705	1318511312	/nfs/dbraw/zinc/51/13/12/1318511312.db2.gz	IZKJNQHVJRSYPZ-HXUWFJFHSA-N	0	3	333.435	3.295	20	30		EGEDHN
N#Cc1ccccc1OCC(=O)C(C#N)c1cc(C(F)(F)F)ccn1	ZINC000813217011	1318516306	/nfs/dbraw/zinc/51/63/06/1318516306.db2.gz	APBLFNTVWBDCGV-ZDUSSCGKSA-N	0	3	345.280	3.227	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccoc2C2CC2)C1	ZINC001021659831	1318522623	/nfs/dbraw/zinc/52/26/23/1318522623.db2.gz	VTRWMZUEWMPXOC-AEFFLSMTSA-N	0	3	326.440	3.107	20	30		EGEDHN
Cc1ccoc1C(=O)N1CCC[C@@H]1CN(C)Cc1ccc(C#N)cc1	ZINC000960419487	1318543312	/nfs/dbraw/zinc/54/33/12/1318543312.db2.gz	WWIKBUMNNQSSKB-GOSISDBHSA-N	0	3	337.423	3.196	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cnc3ccccc3c2)C1	ZINC001021679310	1318550018	/nfs/dbraw/zinc/55/00/18/1318550018.db2.gz	NJPKDZPVZDVPIF-RXVVDRJESA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccsc2Cl)C1	ZINC001021681892	1318552752	/nfs/dbraw/zinc/55/27/52/1318552752.db2.gz	JTRHUMGXUSASIM-ZFWWWQNUSA-N	0	3	336.888	3.351	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(C(CC)CC)no2)C1	ZINC001021686390	1318561095	/nfs/dbraw/zinc/56/10/95/1318561095.db2.gz	YIMUQKMOBFUMRQ-AEFFLSMTSA-N	0	3	343.471	3.138	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(F)cc2Cl)C1	ZINC001021727214	1318624119	/nfs/dbraw/zinc/62/41/19/1318624119.db2.gz	KKPANVBGWDYBPL-KDOFPFPSSA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc3ccccc3[nH]2)C1	ZINC001021729435	1318629709	/nfs/dbraw/zinc/62/97/09/1318629709.db2.gz	FCEDWYIQPWNGAR-PXNSSMCTSA-N	0	3	335.451	3.118	20	30		EGEDHN
Cc1cscc1C(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001021946376	1318741468	/nfs/dbraw/zinc/74/14/68/1318741468.db2.gz	MMWNDVADWZJILC-GASCZTMLSA-N	0	3	343.427	3.118	20	30		EGEDHN
CC(C(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1)=C1CCCC1	ZINC001021956265	1318747886	/nfs/dbraw/zinc/74/78/86/1318747886.db2.gz	BTXAIZILMABGJH-HDICACEKSA-N	0	3	341.430	3.325	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@@H](NC(=O)C(F)=C3CCCC3)C2)c(F)c1	ZINC001021964293	1318753831	/nfs/dbraw/zinc/75/38/31/1318753831.db2.gz	USJUNCTWYLVCNK-IYBDPMFKSA-N	0	3	345.393	3.232	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@@H](NC(=O)C3=CCCCCC3)C2)c1	ZINC001022007338	1318767590	/nfs/dbraw/zinc/76/75/90/1318767590.db2.gz	USOKNFQFGBLFRU-HDICACEKSA-N	0	3	341.430	3.325	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N(C)Cc1ccc(Br)cc1	ZINC000912013313	1318794104	/nfs/dbraw/zinc/79/41/04/1318794104.db2.gz	RISNWDFEAJBOLK-AWEZNQCLSA-N	0	3	325.250	3.091	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cncc(-c3ccccc3)c2)C1	ZINC001022166337	1318825850	/nfs/dbraw/zinc/82/58/50/1318825850.db2.gz	UEVYQWOKQJZRDM-HDICACEKSA-N	0	3	341.842	3.352	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)Nc1ccc(NC(=O)COC)cc1	ZINC000912301438	1318865234	/nfs/dbraw/zinc/86/52/34/1318865234.db2.gz	KRMVKJLDQOZCJS-KRWDZBQOSA-N	0	3	349.475	3.288	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc(OC)c(OCC(F)(F)F)c1	ZINC000912350350	1318876154	/nfs/dbraw/zinc/87/61/54/1318876154.db2.gz	JLHKKDCETIZJCB-LBPRGKRZSA-N	0	3	346.349	3.258	20	30		EGEDHN
COc1ccc2[nH]cc(C3=CCN(CCOCCC#N)CC3)c2c1	ZINC000815065002	1318879902	/nfs/dbraw/zinc/87/99/02/1318879902.db2.gz	NSRVZGYKXQBUCV-UHFFFAOYSA-N	0	3	325.412	3.196	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)[C@@]1(C)C=CCC1	ZINC000960792578	1318899208	/nfs/dbraw/zinc/89/92/08/1318899208.db2.gz	QPNPCJMURQNGPX-CTNGQTDRSA-N	0	3	337.467	3.337	20	30		EGEDHN
C[C@H]1CCN(Cc2ccccc2)C[C@H]1NC(=O)c1ccccc1CC#N	ZINC000913101195	1318974286	/nfs/dbraw/zinc/97/42/86/1318974286.db2.gz	CABLVMQXWFNWNU-LAUBAEHRSA-N	0	3	347.462	3.393	20	30		EGEDHN
CO[C@@H]1CCC[C@H](C(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)C1	ZINC000815906528	1319071622	/nfs/dbraw/zinc/07/16/22/1319071622.db2.gz	BUXDYJHKGQXCRD-NILFDRSVSA-N	0	3	334.803	3.193	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)Cc2ccc(F)c(Cl)c2)C1	ZINC001022763958	1319093524	/nfs/dbraw/zinc/09/35/24/1319093524.db2.gz	CLODEKPCCHZKDC-TXEJJXNPSA-N	0	3	331.218	3.011	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cnc(-c3ccoc3)s2)C1	ZINC001022822083	1319125709	/nfs/dbraw/zinc/12/57/09/1319125709.db2.gz	OZLQSLKBRXWTDF-TXEJJXNPSA-N	0	3	337.832	3.006	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@@H](NC(=O)[C@@H]3CC34CCCC4)C2)c(F)c1	ZINC001022936349	1319179703	/nfs/dbraw/zinc/17/97/03/1319179703.db2.gz	JALCIBZLLQBYKM-BBWFWOEESA-N	0	3	341.430	3.014	20	30		EGEDHN
CCC(=O)N1CCC[C@@H]([C@@H]2CCN(CC#Cc3ccc(F)cc3)C2)C1	ZINC000961082126	1319194558	/nfs/dbraw/zinc/19/45/58/1319194558.db2.gz	VYCAYLOJCUKEHT-RTBURBONSA-N	0	3	342.458	3.148	20	30		EGEDHN
CCc1ccc(C#CC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)cc1	ZINC000816664942	1319205280	/nfs/dbraw/zinc/20/52/80/1319205280.db2.gz	LHPBOPSDFDZMOA-HXUWFJFHSA-N	0	3	338.426	3.159	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)c2ccc(CC)cc2)C1	ZINC001023047100	1319236492	/nfs/dbraw/zinc/23/64/92/1319236492.db2.gz	QVTYNYHVNOZPMZ-GASCZTMLSA-N	0	3	337.261	3.008	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)C2(C)C(C)(C)C2(C)C)C1	ZINC001023173262	1319306244	/nfs/dbraw/zinc/30/62/44/1319306244.db2.gz	IOKLWTDDVYRXHH-TXEJJXNPSA-N	0	3	343.309	3.204	20	30		EGEDHN
C#CC[C@@H](NCc1cccc(CN2CCOCC2)c1)c1ccccc1	ZINC000817276291	1319309879	/nfs/dbraw/zinc/30/98/79/1319309879.db2.gz	XODOEBPQRTVFIP-JOCHJYFZSA-N	0	3	334.463	3.373	20	30		EGEDHN
CC(=O)N1CCC([C@@H]2CCCN(Cc3ccc(F)c(C#N)c3)C2)CC1	ZINC000961299190	1319461272	/nfs/dbraw/zinc/46/12/72/1319461272.db2.gz	OKOWOZMTOIMFIU-GOSISDBHSA-N	0	3	343.446	3.168	20	30		EGEDHN
C#Cc1cccc(NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)c1	ZINC000915339377	1319470328	/nfs/dbraw/zinc/47/03/28/1319470328.db2.gz	NWEBRRXJCGOVJS-HXUWFJFHSA-N	0	3	333.435	3.454	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc(F)c3ccccc3c2)C1	ZINC001023406178	1319512888	/nfs/dbraw/zinc/51/28/88/1319512888.db2.gz	CNDZTOPPXJMXAF-INIZCTEOSA-N	0	3	338.426	3.444	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](C2CCN(C(=O)C#CC3CC3)CC2)C1	ZINC000961363868	1319521491	/nfs/dbraw/zinc/52/14/91/1319521491.db2.gz	CBVIFGTVXUFAMR-GOSISDBHSA-N	0	3	334.891	3.103	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](C2CCN(C(=O)c3cc[nH]c3)CC2)C1	ZINC000961373760	1319528905	/nfs/dbraw/zinc/52/89/05/1319528905.db2.gz	OLLHOGCGNLYEKU-KRWDZBQOSA-N	0	3	335.879	3.331	20	30		EGEDHN
C#CCN(C)CCCNC(=O)C1(Cc2cccs2)CCCCC1	ZINC000818606408	1319568044	/nfs/dbraw/zinc/56/80/44/1319568044.db2.gz	SGFIHJKMVMDOKE-UHFFFAOYSA-N	0	3	332.513	3.312	20	30		EGEDHN
C#CCN(C)CCCNC(=O)CC1CCC(c2ccccc2)CC1	ZINC000818606320	1319568070	/nfs/dbraw/zinc/56/80/70/1319568070.db2.gz	LXHWTPNEXWZEFE-UHFFFAOYSA-N	0	3	326.484	3.422	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc(CCCC)cc2)C1	ZINC001023476453	1319579076	/nfs/dbraw/zinc/57/90/76/1319579076.db2.gz	MEPAWRNBRONVMT-IBGZPJMESA-N	0	3	326.484	3.494	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2occc2-c2ccccc2)C1	ZINC001023477947	1319581638	/nfs/dbraw/zinc/58/16/38/1319581638.db2.gz	KOLFBPZFZILHDK-KRWDZBQOSA-N	0	3	336.435	3.412	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)[C@H]2CCc3c2cccc3Cl)C1	ZINC001023492742	1319596214	/nfs/dbraw/zinc/59/62/14/1319596214.db2.gz	CHNWVQCXHXIAQK-YJBOKZPZSA-N	0	3	344.886	3.221	20	30		EGEDHN
CC[C@H](C#N)Oc1cccc(CNC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819067469	1319626460	/nfs/dbraw/zinc/62/64/60/1319626460.db2.gz	LFISQURPCMWMDI-RDTXWAMCSA-N	0	3	346.377	3.469	20	30		EGEDHN
N#Cc1ccc(F)c(CNCC2CC(NC(=O)C[C@H]3C=CCC3)C2)c1	ZINC000961533822	1319639778	/nfs/dbraw/zinc/63/97/78/1319639778.db2.gz	NMVVQTSCGWPERK-NXVRBGIVSA-N	0	3	341.430	3.038	20	30		EGEDHN
C#CCN1CCC[C@@H](CNC(=O)c2c(Cl)oc3ccccc32)C1	ZINC001023552249	1319663462	/nfs/dbraw/zinc/66/34/62/1319663462.db2.gz	BSTQYSJPAFSRSJ-ZDUSSCGKSA-N	0	3	330.815	3.161	20	30		EGEDHN
C=CCN1CCC[C@@H](CNC(=O)c2c(Cl)cncc2Cl)C1	ZINC001023569557	1319683874	/nfs/dbraw/zinc/68/38/74/1319683874.db2.gz	MIGRBUPTHHOQLC-NSHDSACASA-N	0	3	328.243	3.016	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)NC[C@H]1CCCN(Cc2ccc(C#N)cc2)C1	ZINC001023580931	1319704563	/nfs/dbraw/zinc/70/45/63/1319704563.db2.gz	ZMGZWHCUYBKIFU-VAMGGRTRSA-N	0	3	339.483	3.323	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)COc1ccc2ccccc2c1	ZINC000916876716	1319718311	/nfs/dbraw/zinc/71/83/11/1319718311.db2.gz	IMHYXYMALFBVAO-GOSISDBHSA-N	0	3	338.407	3.234	20	30		EGEDHN
Cc1ccc(Cl)c(OCC(=O)C(C#N)C(=O)Nc2ccccc2)c1	ZINC000916898656	1319721497	/nfs/dbraw/zinc/72/14/97/1319721497.db2.gz	GASRVYONPAEJNY-AWEZNQCLSA-N	0	3	342.782	3.375	20	30		EGEDHN
CCc1cccc(CC)c1NC(=O)C(C#N)C(=O)CC[C@@H]1CCCO1	ZINC000916910139	1319723084	/nfs/dbraw/zinc/72/30/84/1319723084.db2.gz	WLRITMSZELVNCX-DLBZAZTESA-N	0	3	342.439	3.418	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2c(F)ccc(F)c2Cl)C1	ZINC001023609325	1319723274	/nfs/dbraw/zinc/72/32/74/1319723274.db2.gz	QFDRXSJNSLXINE-LBPRGKRZSA-N	0	3	340.801	3.083	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc3sccc3c2)C1	ZINC001023677104	1319791305	/nfs/dbraw/zinc/79/13/05/1319791305.db2.gz	CHOYOBSYTBGXBJ-HNNXBMFYSA-N	0	3	326.465	3.366	20	30		EGEDHN
CC[C@H](Cc1ccccc1C)C(=O)C(C#N)C(=O)NC1CCCC1	ZINC000819947559	1319809136	/nfs/dbraw/zinc/80/91/36/1319809136.db2.gz	HHQHQGFYXAQMSX-CRAIPNDOSA-N	0	3	326.440	3.331	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc(Cl)cc2Cl)C1	ZINC001023718623	1319854630	/nfs/dbraw/zinc/85/46/30/1319854630.db2.gz	ZWJVFXRUOVSVRH-ZDUSSCGKSA-N	0	3	339.266	3.459	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2oc3ccccc3c2CC)C1	ZINC001023770499	1319919862	/nfs/dbraw/zinc/91/98/62/1319919862.db2.gz	ACPSHCOQYURREM-INIZCTEOSA-N	0	3	338.451	3.460	20	30		EGEDHN
C#CCNC(=O)[C@@H](C)N[C@H](Cc1ccc(Cl)cc1)c1ccccc1	ZINC000918198464	1319932685	/nfs/dbraw/zinc/93/26/85/1319932685.db2.gz	KOYBLHHXTCNLBT-DNVCBOLYSA-N	0	3	340.854	3.351	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCN(C(=O)CC2CCCC2)C1	ZINC001023820215	1319966403	/nfs/dbraw/zinc/96/64/03/1319966403.db2.gz	GZQMTHSRIPOXOE-GOSISDBHSA-N	0	3	339.483	3.467	20	30		EGEDHN
Cc1ccoc1C(=O)N1CCC[C@@H](CNCc2ccccc2C#N)C1	ZINC001023844273	1319984172	/nfs/dbraw/zinc/98/41/72/1319984172.db2.gz	GHPKBIYOXYQQFZ-INIZCTEOSA-N	0	3	337.423	3.102	20	30		EGEDHN
Cc1ccc(C#N)cc1C(=O)N(CCN(C)C)Cc1ccsc1	ZINC000822468304	1320084808	/nfs/dbraw/zinc/08/48/08/1320084808.db2.gz	ALXKCAOHRQNBSU-UHFFFAOYSA-N	0	3	327.453	3.132	20	30		EGEDHN
CC[C@@H](C#N)Oc1cc(CNCc2ccncc2C)ccc1OC	ZINC000823847299	1320211085	/nfs/dbraw/zinc/21/10/85/1320211085.db2.gz	KVQMJCQFXBTCLD-KRWDZBQOSA-N	0	3	325.412	3.369	20	30		EGEDHN
C=CCn1c2ccccc2n(CN2C[C@@H](C)N(C)[C@@H](C)C2)c1=S	ZINC000840090987	1321026035	/nfs/dbraw/zinc/02/60/35/1321026035.db2.gz	XEQUMPBAYSXDAC-GASCZTMLSA-N	0	3	330.501	3.340	20	30		EGEDHN
CO[C@H](CC(C)C)C(=O)C(C#N)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000842288476	1321367627	/nfs/dbraw/zinc/36/76/27/1321367627.db2.gz	IPKWNJSQUCNRHD-SMDDNHRTSA-N	0	3	340.782	3.188	20	30		EGEDHN
CCCCCCO[C@H](C)C(=O)C(C#N)c1nnc2n1CCCCC2	ZINC000842292161	1321368364	/nfs/dbraw/zinc/36/83/64/1321368364.db2.gz	SCHMXXXPMPUTTO-HUUCEWRRSA-N	0	3	332.448	3.166	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)[C@H](CC(C)C)OC)c1ccccc1	ZINC000842341807	1321374985	/nfs/dbraw/zinc/37/49/85/1321374985.db2.gz	ABLLVQAFCMNAQG-ULQDDVLXSA-N	0	3	330.428	3.024	20	30		EGEDHN
CCN(CC)c1ccc(/C=N\[C@H]2CCN(C(C)(C)C)C2=O)c(O)c1	ZINC000843265610	1321495450	/nfs/dbraw/zinc/49/54/50/1321495450.db2.gz	HFXMJIFAPAVMTL-SMEDBKPVSA-N	0	3	331.460	3.057	20	30		EGEDHN
CC(C)(C)OC(=O)C[C@@H]1CCCCN1C[C@@H](O)c1ccc(C#N)cc1	ZINC000844427448	1321606235	/nfs/dbraw/zinc/60/62/35/1321606235.db2.gz	XWHWIJYQACQWBE-ZWKOTPCHSA-N	0	3	344.455	3.178	20	30		EGEDHN
CS[C@H](C)CC(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847748740	1321900306	/nfs/dbraw/zinc/90/03/06/1321900306.db2.gz	HKKMNGAWRMIHAX-MRXNPFEDSA-N	0	3	346.496	3.477	20	30		EGEDHN
CC[C@@H](SC)C(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847748507	1321900803	/nfs/dbraw/zinc/90/08/03/1321900803.db2.gz	BCUFMNUIQSZBLI-QGZVFWFLSA-N	0	3	346.496	3.477	20	30		EGEDHN
C[C@H](COC(=O)c1cc2ccccc2n1CC#N)N1CCCCC1	ZINC000847960963	1321916358	/nfs/dbraw/zinc/91/63/58/1321916358.db2.gz	RIIOHHHKEMAJFE-OAHLLOKOSA-N	0	3	325.412	3.196	20	30		EGEDHN
COc1cccc([C@H](OC)C(=O)C(C#N)c2nc3ccccc3n2C)c1	ZINC000850738364	1322281280	/nfs/dbraw/zinc/28/12/80/1322281280.db2.gz	KFGDKZAYDLQICU-KXBFYZLASA-N	0	3	349.390	3.146	20	30		EGEDHN
Cc1cccc(CCNCc2cc(C#N)ccc2Br)n1	ZINC000922075480	1322449703	/nfs/dbraw/zinc/44/97/03/1322449703.db2.gz	BBHMWNWCIOGCFI-UHFFFAOYSA-N	0	3	330.229	3.357	20	30		EGEDHN
C[C@H](C(=O)NC1CC(CNCc2ccccc2C#N)C1)c1ccccc1	ZINC000962546917	1323004030	/nfs/dbraw/zinc/00/40/30/1323004030.db2.gz	YJDHZMXIBCYYAO-BQJIDLTASA-N	0	3	347.462	3.346	20	30		EGEDHN
N#Cc1ccc(CN2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)C23CCC(CC2)CC3)cc1	ZINC000962695024	1323046790	/nfs/dbraw/zinc/04/67/90/1323046790.db2.gz	YKPXGQSRGMYXPN-OXJBGVTBSA-N	0	3	349.478	3.075	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](CNCc2oc(CC)nc2C)C1	ZINC001024094332	1323125834	/nfs/dbraw/zinc/12/58/34/1323125834.db2.gz	IZIJDJGHUQULGI-OAHLLOKOSA-N	0	3	333.476	3.086	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@H](CNCc3ccccc3C#N)C2)CC1	ZINC001024138180	1323163077	/nfs/dbraw/zinc/16/30/77/1323163077.db2.gz	BLAIMYKOCZMAIF-MRXNPFEDSA-N	0	3	325.456	3.077	20	30		EGEDHN
C[C@H](CC(C)(C)C#N)NCc1cccc(C(=O)NC[C@@H]2CCCO2)c1	ZINC000924787731	1323163106	/nfs/dbraw/zinc/16/31/06/1323163106.db2.gz	ZVSYPTTUKWVVBN-QAPCUYQASA-N	0	3	343.471	3.013	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H](CNCc2ccn(C(C)C)n2)C1	ZINC001024138106	1323163142	/nfs/dbraw/zinc/16/31/42/1323163142.db2.gz	ZRCSUCYTQAHANM-FXAWDEMLSA-N	0	3	346.519	3.395	20	30		EGEDHN
C[C@@H](CC(C)(C)C#N)N[C@@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000924882494	1323199124	/nfs/dbraw/zinc/19/91/24/1323199124.db2.gz	QDQGCBSREDAEHD-WMZOPIPTSA-N	0	3	327.472	3.138	20	30		EGEDHN
C=CCC[N@H+]1CCC[C@H]1[C@@H]1CCCN(C(=O)c2ccccc2[O-])C1	ZINC000963252455	1323263092	/nfs/dbraw/zinc/26/30/92/1323263092.db2.gz	WBWMSUNDVPHEGL-AEFFLSMTSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=CCC[N@@H+]1CCC[C@H]1[C@@H]1CCCN(C(=O)c2ccccc2[O-])C1	ZINC000963252455	1323263098	/nfs/dbraw/zinc/26/30/98/1323263098.db2.gz	WBWMSUNDVPHEGL-AEFFLSMTSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)c2ncoc2C)C1	ZINC000963269147	1323282757	/nfs/dbraw/zinc/28/27/57/1323282757.db2.gz	BFPJHRYZXVNQNO-CABCVRRESA-N	0	3	337.851	3.052	20	30		EGEDHN
C=CCCN1CCCC[C@@H]1CNC(=O)c1c(F)c(F)cc(F)c1F	ZINC001024446889	1323405874	/nfs/dbraw/zinc/40/58/74/1323405874.db2.gz	KIAAJBADUWYZBN-LLVKDONJSA-N	0	3	344.352	3.403	20	30		EGEDHN
C=C(C)CCN1CCCC[C@@H]1CNC(=O)c1cn2cc(C)nc2s1	ZINC001024479862	1323432509	/nfs/dbraw/zinc/43/25/09/1323432509.db2.gz	RWVZLHKAKZQYOT-OAHLLOKOSA-N	0	3	346.500	3.255	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1cc(C2CCCCC2)n[nH]1	ZINC001024480834	1323435614	/nfs/dbraw/zinc/43/56/14/1323435614.db2.gz	PNFZYJMZRBRTKU-KRWDZBQOSA-N	0	3	342.487	3.065	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccc(OC)c(OC)c1C	ZINC001024502395	1323451280	/nfs/dbraw/zinc/45/12/80/1323451280.db2.gz	MWOBLVISORDVSX-INIZCTEOSA-N	0	3	346.471	3.173	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC001024507824	1323455465	/nfs/dbraw/zinc/45/54/65/1323455465.db2.gz	ZAGUCBDHDJXCAQ-AZUAARDMSA-N	0	3	341.499	3.060	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cnn2cccc(Cl)c12	ZINC001024542682	1323486061	/nfs/dbraw/zinc/48/60/61/1323486061.db2.gz	ZTLFFDPPVWIOAF-CQSZACIVSA-N	0	3	346.862	3.148	20	30		EGEDHN
C=C(C)CCN1CCCC[C@H]1CNC(=O)c1nc2cnccc2s1	ZINC001024545379	1323486934	/nfs/dbraw/zinc/48/69/34/1323486934.db2.gz	JAFUKOCINYBKNI-AWEZNQCLSA-N	0	3	344.484	3.242	20	30		EGEDHN
C=C(C)CCN1CCCC[C@@H]1CNC(=O)c1nc2cnccc2s1	ZINC001024545380	1323487382	/nfs/dbraw/zinc/48/73/82/1323487382.db2.gz	JAFUKOCINYBKNI-CQSZACIVSA-N	0	3	344.484	3.242	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cc(F)c(F)c(F)c1	ZINC001024672031	1323584528	/nfs/dbraw/zinc/58/45/28/1323584528.db2.gz	PTNLFXGYJFSEQL-CYBMUJFWSA-N	0	3	326.362	3.264	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccccc1NC(=O)CC	ZINC001024716810	1323621906	/nfs/dbraw/zinc/62/19/06/1323621906.db2.gz	IWWMDCOIGGTJSL-INIZCTEOSA-N	0	3	343.471	3.196	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccccc1OCC(C)C	ZINC001024716993	1323621926	/nfs/dbraw/zinc/62/19/26/1323621926.db2.gz	RBXFKWSWOBOJBS-GOSISDBHSA-N	0	3	342.483	3.329	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cc(-n2cccc2)ccn1	ZINC001024746941	1323649158	/nfs/dbraw/zinc/64/91/58/1323649158.db2.gz	JSYVRLKMUJISSU-GOSISDBHSA-N	0	3	338.455	3.033	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccc(C(F)(F)F)cc1	ZINC001024774328	1323674598	/nfs/dbraw/zinc/67/45/98/1323674598.db2.gz	QQOZTMANJYHDSS-INIZCTEOSA-N	0	3	338.373	3.313	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1coc2ccc(F)cc12	ZINC001024777264	1323677676	/nfs/dbraw/zinc/67/76/76/1323677676.db2.gz	IKKMFFOPIUVGRO-OAHLLOKOSA-N	0	3	328.387	3.180	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccc(OCC2CC2)cc1	ZINC001024805144	1323709539	/nfs/dbraw/zinc/70/95/39/1323709539.db2.gz	QMJSHXOFBHBLJN-LJQANCHMSA-N	0	3	340.467	3.083	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cc(Cl)cc2c1OCC2	ZINC001024817118	1323719416	/nfs/dbraw/zinc/71/94/16/1323719416.db2.gz	ULEPIGYUTNVGSU-INIZCTEOSA-N	0	3	348.874	3.435	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCCC[C@@H]1CNCc1cc(C#N)ccc1OC	ZINC001024919360	1323783064	/nfs/dbraw/zinc/78/30/64/1323783064.db2.gz	XZBBRSYKLQRSOI-FXZAEMTOSA-N	0	3	341.455	3.004	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)c(F)c1	ZINC001024924699	1323787458	/nfs/dbraw/zinc/78/74/58/1323787458.db2.gz	QRBOPNCCOZFNNV-MRXNPFEDSA-N	0	3	347.409	3.431	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCCC[C@@H]1CNCc1ccccn1	ZINC001024973864	1323807922	/nfs/dbraw/zinc/80/79/22/1323807922.db2.gz	APNVAUXQXUMCCS-MRXNPFEDSA-N	0	3	335.879	3.331	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCCC[C@H]2CNCc2c(C)noc2CC)C1	ZINC001025076767	1323879420	/nfs/dbraw/zinc/87/94/20/1323879420.db2.gz	UEJBEEOPOCEMJL-INIZCTEOSA-N	0	3	345.487	3.372	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cnc(C)s1	ZINC001025209448	1323998931	/nfs/dbraw/zinc/99/89/31/1323998931.db2.gz	LTRWYNJVEHSLLH-HZPDHXFCSA-N	0	3	333.501	3.487	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(C)nc(C)c1	ZINC001025237097	1324027756	/nfs/dbraw/zinc/02/77/56/1324027756.db2.gz	XIVPIOZYFIELSE-VQTJNVASSA-N	0	3	339.483	3.181	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cncc(Cl)c1C	ZINC001025240491	1324034824	/nfs/dbraw/zinc/03/48/24/1324034824.db2.gz	PETMPLJXKBOLOY-QZTJIDSGSA-N	0	3	345.874	3.136	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ncccc1CC	ZINC001025243663	1324040405	/nfs/dbraw/zinc/04/04/05/1324040405.db2.gz	DDTUMJXLJGBEKH-MOPGFXCFSA-N	0	3	339.483	3.126	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ncc(C)cc1C	ZINC001025252096	1324055917	/nfs/dbraw/zinc/05/59/17/1324055917.db2.gz	MHPREUIOFWSNCQ-RBUKOAKNSA-N	0	3	339.483	3.181	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(OCC)no1	ZINC001025252416	1324057386	/nfs/dbraw/zinc/05/73/86/1324057386.db2.gz	OMOYFTOZLKUZTK-JKSUJKDBSA-N	0	3	347.459	3.109	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cccnc1C(F)F	ZINC001025252807	1324058009	/nfs/dbraw/zinc/05/80/09/1324058009.db2.gz	ZJSKHAIWDJVYQI-CVEARBPZSA-N	0	3	347.409	3.112	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1occ2c1CCC2	ZINC001025255944	1324062888	/nfs/dbraw/zinc/06/28/88/1324062888.db2.gz	UBUYRYQULFTJRN-OALUTQOASA-N	0	3	340.467	3.251	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(F)ccc1C	ZINC001025255487	1324063128	/nfs/dbraw/zinc/06/31/28/1324063128.db2.gz	QVHGGZSXIMBYNU-MOPGFXCFSA-N	0	3	328.431	3.226	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)C1(C(F)F)CCC1	ZINC001025258540	1324067878	/nfs/dbraw/zinc/06/78/78/1324067878.db2.gz	HFHNXXOBYAQTOT-HZPDHXFCSA-N	0	3	338.442	3.291	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc[nH]c1C1CC1	ZINC001025259132	1324069142	/nfs/dbraw/zinc/06/91/42/1324069142.db2.gz	LPNGTAYPESYBGI-MOPGFXCFSA-N	0	3	339.483	3.375	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccn(CC)c1C	ZINC001025263597	1324075323	/nfs/dbraw/zinc/07/53/23/1324075323.db2.gz	OMUPIZQLAAWCOZ-UXHICEINSA-N	0	3	341.499	3.299	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc2ncccc2c1	ZINC001025264533	1324076286	/nfs/dbraw/zinc/07/62/86/1324076286.db2.gz	AVVURENUNUNVRD-RTWAWAEBSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cccc2[nH]ccc21	ZINC001025269841	1324083160	/nfs/dbraw/zinc/08/31/60/1324083160.db2.gz	XESAHWHETODROC-VQTJNVASSA-N	0	3	335.451	3.260	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1conc1C1CC1	ZINC001025269958	1324084820	/nfs/dbraw/zinc/08/48/20/1324084820.db2.gz	YWUDVEKEAHKVES-SJORKVTESA-N	0	3	329.444	3.197	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cccc(OC)c1C	ZINC001025274347	1324092188	/nfs/dbraw/zinc/09/21/88/1324092188.db2.gz	XALTVILXOYGTAD-RBUKOAKNSA-N	0	3	340.467	3.096	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1nc(C)ncc1Cl	ZINC001025274748	1324094203	/nfs/dbraw/zinc/09/42/03/1324094203.db2.gz	NBYIJSROUUCIRO-HZPDHXFCSA-N	0	3	348.878	3.084	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)Cc1ccc(CC)cc1	ZINC001025275316	1324095606	/nfs/dbraw/zinc/09/56/06/1324095606.db2.gz	WBRKUOQUJXTRAW-RTWAWAEBSA-N	0	3	338.495	3.270	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)Cc1ccc(CC)cc1	ZINC001025275317	1324095876	/nfs/dbraw/zinc/09/58/76/1324095876.db2.gz	WBRKUOQUJXTRAW-SFTDATJTSA-N	0	3	338.495	3.270	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1coc(C2CC2)n1	ZINC001025278172	1324099420	/nfs/dbraw/zinc/09/94/20/1324099420.db2.gz	RNSWKZORSAMQAY-DLBZAZTESA-N	0	3	329.444	3.197	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc(OC)cc1	ZINC001025292442	1324116562	/nfs/dbraw/zinc/11/65/62/1324116562.db2.gz	IOTPNJPBYIMEOX-WOJBJXKFSA-N	0	3	340.467	3.178	20	30		EGEDHN
C#CCCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cnc(CC)s1	ZINC001025301558	1324134853	/nfs/dbraw/zinc/13/48/53/1324134853.db2.gz	LTGVICPTBCEXJD-HZPDHXFCSA-N	0	3	345.512	3.188	20	30		EGEDHN
C[C@H](NC(=O)C1CCCC1)[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001025318517	1324154745	/nfs/dbraw/zinc/15/47/45/1324154745.db2.gz	BDZUOBCUHHEXQZ-JXFKEZNVSA-N	0	3	339.483	3.465	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc3ccccc3nc2C)C1	ZINC001025432209	1324270182	/nfs/dbraw/zinc/27/01/82/1324270182.db2.gz	GXJDJMZXMPCBKW-MAUKXSAKSA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc3cc(C)cn3c2)C1	ZINC001025437029	1324277085	/nfs/dbraw/zinc/27/70/85/1324277085.db2.gz	RQNGBCWBNLFWQD-MSOLQXFVSA-N	0	3	337.467	3.101	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(F)cc3ccoc32)C1	ZINC001025465860	1324310196	/nfs/dbraw/zinc/31/01/96/1324310196.db2.gz	WTODYSVESBHGBX-DZGCQCFKSA-N	0	3	328.387	3.035	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(C)cc(OC)c2C)C1	ZINC001025472184	1324318120	/nfs/dbraw/zinc/31/81/20/1324318120.db2.gz	NXXRZKQBWPBMDQ-MSOLQXFVSA-N	0	3	342.483	3.166	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cccc(C(C)C)n2)C1	ZINC001025473146	1324319263	/nfs/dbraw/zinc/31/92/63/1324319263.db2.gz	ZPCQJOVVDXMMQM-SJORKVTESA-N	0	3	327.472	3.059	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc3ccccc3cc2F)C1	ZINC001025482804	1324330806	/nfs/dbraw/zinc/33/08/06/1324330806.db2.gz	QORZLVTVVSGNFN-CRAIPNDOSA-N	0	3	338.426	3.442	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(C)c(Cl)c2F)C1	ZINC001025489027	1324340315	/nfs/dbraw/zinc/34/03/15/1324340315.db2.gz	NKAGDRIRBUSMQV-UONOGXRCSA-N	0	3	336.838	3.251	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc3cc(Cl)ccc3[nH]2)C1	ZINC001025501705	1324350240	/nfs/dbraw/zinc/35/02/40/1324350240.db2.gz	JKECVWLQGYDOFN-KBPBESRZSA-N	0	3	343.858	3.285	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H](C)[C@@H]2CCCN(Cc3ccccn3)C2)cc1	ZINC001025504061	1324353107	/nfs/dbraw/zinc/35/31/07/1324353107.db2.gz	XYARHFIUFGJHEY-YLJYHZDGSA-N	0	3	347.462	3.093	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cncc3sccc32)C1	ZINC001025517914	1324361482	/nfs/dbraw/zinc/36/14/82/1324361482.db2.gz	CBCUBMYMQQWQNK-GJZGRUSLSA-N	0	3	341.480	3.150	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(Cl)cc2OC)C1	ZINC001025520108	1324364348	/nfs/dbraw/zinc/36/43/48/1324364348.db2.gz	RNAFJGZWDHUDOA-LSDHHAIUSA-N	0	3	348.874	3.202	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](C)[C@H]2CCCN(Cc3cnoc3C)C2)CC1	ZINC001025523314	1324368308	/nfs/dbraw/zinc/36/83/08/1324368308.db2.gz	OOXKREDASSAMKD-YJBOKZPZSA-N	0	3	345.487	3.446	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(C(C)C)nc2CC)C1	ZINC001025530616	1324375824	/nfs/dbraw/zinc/37/58/24/1324375824.db2.gz	JUXFNESPHVHVMZ-SJORKVTESA-N	0	3	341.499	3.231	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2[nH]c3ccc(C)cc3c2C)C1	ZINC001025583453	1324425236	/nfs/dbraw/zinc/42/52/36/1324425236.db2.gz	ZNAQQZJLPJXNEM-IRXDYDNUSA-N	0	3	337.467	3.248	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc3scnc3c2)C1	ZINC001025585337	1324427162	/nfs/dbraw/zinc/42/71/62/1324427162.db2.gz	OOVDHOMGKNOFRN-ZBFHGGJFSA-N	0	3	341.480	3.150	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2[nH]ccc2-c2ccccc2)C1	ZINC001025591485	1324437321	/nfs/dbraw/zinc/43/73/21/1324437321.db2.gz	CIWZLYVHQPBOGH-FUHWJXTLSA-N	0	3	335.451	3.145	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ncsc2C(C)C)C1	ZINC001025595676	1324443168	/nfs/dbraw/zinc/44/31/68/1324443168.db2.gz	QOXPIOVCQBDEDI-GJZGRUSLSA-N	0	3	333.501	3.120	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(CC)c(CC)o2)C1	ZINC001025598876	1324447665	/nfs/dbraw/zinc/44/76/65/1324447665.db2.gz	CFEAZXAERUTKLU-DOTOQJQBSA-N	0	3	330.472	3.258	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccsc2C(F)(F)F)C1	ZINC001025603105	1324451547	/nfs/dbraw/zinc/45/15/47/1324451547.db2.gz	QPNCVKSOVHRSIW-RYUDHWBXSA-N	0	3	344.402	3.230	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(CCC)c(C)s2)C1	ZINC001025614181	1324467145	/nfs/dbraw/zinc/46/71/45/1324467145.db2.gz	HRNXCZJTCWMDOP-RHSMWYFYSA-N	0	3	332.513	3.473	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccccc2CC(C)C)C1	ZINC001025630410	1324482104	/nfs/dbraw/zinc/48/21/04/1324482104.db2.gz	SOGKUEPJPQPTBF-PKOBYXMFSA-N	0	3	326.484	3.349	20	30		EGEDHN
CC(C)=C(F)C(=O)N1C[C@@H]2CC[C@@H](NCc3ccccc3C#N)[C@@H]2C1	ZINC001026240676	1324684167	/nfs/dbraw/zinc/68/41/67/1324684167.db2.gz	MRDROSNRZZXCCR-RCCFBDPRSA-N	0	3	341.430	3.148	20	30		EGEDHN
CC(C)=C(F)C(=O)N1C[C@@H]2CC[C@H](NCc3ccccc3C#N)[C@@H]2C1	ZINC001026240674	1324684287	/nfs/dbraw/zinc/68/42/87/1324684287.db2.gz	MRDROSNRZZXCCR-KSZLIROESA-N	0	3	341.430	3.148	20	30		EGEDHN
Cc1cc(C(=O)N2C[C@@H]3CC[C@@H](NCc4ccccc4C#N)[C@@H]3C2)co1	ZINC001026249811	1324685890	/nfs/dbraw/zinc/68/58/90/1324685890.db2.gz	HFODHAHBHNMGET-DFQSSKMNSA-N	0	3	349.434	3.100	20	30		EGEDHN
CC(C(=O)N1C[C@@H]2CC[C@@H](NCc3ccccc3C#N)[C@@H]2C1)=C1CCC1	ZINC001026264094	1324692172	/nfs/dbraw/zinc/69/21/72/1324692172.db2.gz	QXKZSOKFQOWIQY-PWRODBHTSA-N	0	3	349.478	3.385	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H]3CC[C@H](NCc4nc(C)cs4)[C@@H]3C2)C1	ZINC001026354643	1324747750	/nfs/dbraw/zinc/74/77/50/1324747750.db2.gz	BJXDIWYQEWHKHU-XHSDSOJGSA-N	0	3	345.512	3.134	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H]3CC[C@@H](NCc4nc(C)cs4)[C@@H]3C2)C1	ZINC001026354640	1324748249	/nfs/dbraw/zinc/74/82/49/1324748249.db2.gz	BJXDIWYQEWHKHU-ARFHVFGLSA-N	0	3	345.512	3.134	20	30		EGEDHN
Cc1ccsc1C(=O)N1CC[C@H](CNCc2ccccc2C#N)C1	ZINC001026649232	1324948923	/nfs/dbraw/zinc/94/89/23/1324948923.db2.gz	MCBIZFCCRYWLEC-OAHLLOKOSA-N	0	3	339.464	3.180	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)c2coc(C)n2)C1	ZINC000963289532	1325074968	/nfs/dbraw/zinc/07/49/68/1325074968.db2.gz	JNJSCYVBXMGOLD-GDBMZVCRSA-N	0	3	337.851	3.052	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](CNCc2ccccc2C#N)C1	ZINC001026988741	1325128860	/nfs/dbraw/zinc/12/88/60/1325128860.db2.gz	NYUQHNUPVIRPLM-INIZCTEOSA-N	0	3	325.456	3.099	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](CNCc3cc(C4CC4)no3)C2)CC1	ZINC001027041234	1325177304	/nfs/dbraw/zinc/17/73/04/1325177304.db2.gz	SAHLYEYYGMRPAV-OAHLLOKOSA-N	0	3	343.471	3.237	20	30		EGEDHN
CC1(C)CC[C@H](C(=O)N2CC[C@@H](CNCc3ccccc3C#N)C2)C1	ZINC001027045327	1325182133	/nfs/dbraw/zinc/18/21/33/1325182133.db2.gz	QSYCCZURAAESAS-IRXDYDNUSA-N	0	3	339.483	3.323	20	30		EGEDHN
Cc1ccc(C(=O)NC2CC3(CC(NCc4ccccc4C#N)C3)C2)o1	ZINC000963524739	1325292923	/nfs/dbraw/zinc/29/29/23/1325292923.db2.gz	JZMJAOQEKAYSOS-UHFFFAOYSA-N	0	3	349.434	3.291	20	30		EGEDHN
C/C(=C/C(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)cc2)C1)C1CC1	ZINC001027313214	1325463121	/nfs/dbraw/zinc/46/31/21/1325463121.db2.gz	AUNLRKUXMANLRD-WNJRYGEDSA-N	0	3	337.467	3.337	20	30		EGEDHN
C/C(=C\C(=O)N1CCC[C@@H](N(C)Cc2cccc(C#N)c2)C1)C1CC1	ZINC001027313382	1325465925	/nfs/dbraw/zinc/46/59/25/1325465925.db2.gz	DRWLNEBERAZTQQ-MBNYPGIVSA-N	0	3	337.467	3.337	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)CC2CCC2)C1	ZINC001027348257	1325513361	/nfs/dbraw/zinc/51/33/61/1325513361.db2.gz	XJUZKYLDWOEKGV-IBGZPJMESA-N	0	3	325.456	3.171	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)C2CC(F)(F)C2)C1	ZINC001027359517	1325541363	/nfs/dbraw/zinc/54/13/63/1325541363.db2.gz	ULBZNDDXSPEQRH-KRWDZBQOSA-N	0	3	347.409	3.026	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC[C@H](N(C)Cc2ccc(F)c(C#N)c2)C1	ZINC001027361032	1325543241	/nfs/dbraw/zinc/54/32/41/1325543241.db2.gz	XHKYIPLPWMFPOG-SHDIAVBESA-N	0	3	329.419	3.086	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)C[C@H](C)c2ccco2)c1	ZINC000860468185	1329320990	/nfs/dbraw/zinc/32/09/90/1329320990.db2.gz	IPQWCZNDKYBLHD-WFASDCNBSA-N	0	3	326.352	3.129	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)[C@@H](OCC)C2CC2)cc1	ZINC000860468934	1329321054	/nfs/dbraw/zinc/32/10/54/1329321054.db2.gz	GLKVRROMEITYNC-MJGOQNOKSA-N	0	3	342.439	3.492	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)C[C@H](C)c1ccco1	ZINC000860473114	1329321863	/nfs/dbraw/zinc/32/18/63/1329321863.db2.gz	IJSXKUHAKPGFMS-STQMWFEESA-N	0	3	326.352	3.129	20	30		EGEDHN
COC1CC(C(=O)C(C#N)C(=O)Nc2cc(Cl)cc(Cl)c2)C1	ZINC000860473128	1329321929	/nfs/dbraw/zinc/32/19/29/1329321929.db2.gz	IKRTVZMTNZWACH-VRILXCRUSA-N	0	3	341.194	3.066	20	30		EGEDHN
CC(=O)N[C@H](CC(C)C)C(=O)C(C#N)c1nc2cc(F)ccc2s1	ZINC000860533526	1329327872	/nfs/dbraw/zinc/32/78/72/1329327872.db2.gz	SVIJEIXBGGMEAA-GXTWGEPZSA-N	0	3	347.415	3.162	20	30		EGEDHN
C[C@H](CC(=O)C(C#N)C(=O)NCc1ccc(F)cc1F)c1ccco1	ZINC000860692856	1329344772	/nfs/dbraw/zinc/34/47/72/1329344772.db2.gz	XFQMXVPONXTJOX-RISCZKNCSA-N	0	3	346.333	3.077	20	30		EGEDHN
CN(Cc1cccc(C(F)F)c1)[C@@H]1CCCN(C(=O)C#CC2CC2)C1	ZINC001027406421	1327632933	/nfs/dbraw/zinc/63/29/33/1327632933.db2.gz	RCXFATZXLWIFOH-GOSISDBHSA-N	0	3	346.421	3.460	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)[C@@H]2CCC2(F)F)C1	ZINC001027458457	1327701830	/nfs/dbraw/zinc/70/18/30/1327701830.db2.gz	JNBWVBPPMRUMIH-SJORKVTESA-N	0	3	347.409	3.026	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)c2cc3c(o2)c(F)ccc3C)C1	ZINC001027504327	1327767963	/nfs/dbraw/zinc/76/79/63/1327767963.db2.gz	FHVQOWGVHVJNME-AWEZNQCLSA-N	0	3	328.387	3.050	20	30		EGEDHN
Cc1cocc1C(=O)N1CCC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001027530350	1327814812	/nfs/dbraw/zinc/81/48/12/1327814812.db2.gz	SWQZTDFAAWDNQJ-SFHVURJKSA-N	0	3	337.423	3.196	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1cccc(OC)c1C)C2	ZINC000965293722	1327973529	/nfs/dbraw/zinc/97/35/29/1327973529.db2.gz	BAPPCMPAXVQVCO-UHFFFAOYSA-N	0	3	348.874	3.387	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N1CCC[C@@H](N(C)Cc2ccsc2)C1	ZINC001027612399	1327976248	/nfs/dbraw/zinc/97/62/48/1327976248.db2.gz	IOBSWCCUXKNDFR-SQNIBIBYSA-N	0	3	348.512	3.152	20	30		EGEDHN
C[C@H](CC(=O)N1CCC[C@@H](N(C)Cc2cccc(C#N)c2)C1)C1CC1	ZINC001027695606	1328103000	/nfs/dbraw/zinc/10/30/00/1328103000.db2.gz	HRAMXDQMIHHFME-OXQOHEQNSA-N	0	3	339.483	3.417	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)[C@H](c2ccc(F)cc2)C(C)C)C1	ZINC001027697020	1328106750	/nfs/dbraw/zinc/10/67/50/1328106750.db2.gz	QZTAFMYURDLLSA-MOPGFXCFSA-N	0	3	330.447	3.121	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)[C@@H](C)Cc2cccc(Cl)c2)C1	ZINC001027704243	1328118681	/nfs/dbraw/zinc/11/86/81/1328118681.db2.gz	LZGQSMDULHXXQN-YJBOKZPZSA-N	0	3	332.875	3.075	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2c(F)c(F)cc(F)c2F)C1	ZINC000966260875	1328240308	/nfs/dbraw/zinc/24/03/08/1328240308.db2.gz	GFAOAQFSHSDTDJ-MFKMUULPSA-N	0	3	344.352	3.259	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2cc(C)c(OC)c(C)c2)C1	ZINC000966303004	1328262795	/nfs/dbraw/zinc/26/27/95/1328262795.db2.gz	XJWPZUFLMMEZDR-RDTXWAMCSA-N	0	3	330.472	3.328	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)C2(c3cccc(Cl)c3)CC2)C1	ZINC000966567433	1328344523	/nfs/dbraw/zinc/34/45/23/1328344523.db2.gz	RZPKITLZNWGGIK-MAUKXSAKSA-N	0	3	344.886	3.222	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2conc2C2CCCC2)C1	ZINC000966672411	1328375105	/nfs/dbraw/zinc/37/51/05/1328375105.db2.gz	WRFYJOUWEKIZTN-RHSMWYFYSA-N	0	3	331.460	3.349	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](C)[C@H](NC(=O)c2cn3cc(C)nc3s2)C1	ZINC000966718362	1328391704	/nfs/dbraw/zinc/39/17/04/1328391704.db2.gz	CIVMKXXCHBSILV-UKRRQHHQSA-N	0	3	346.500	3.111	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2cn(C)c3ccc(F)cc23)C1	ZINC000966787648	1328412657	/nfs/dbraw/zinc/41/26/57/1328412657.db2.gz	QCPWQTIZOIHERC-RDTXWAMCSA-N	0	3	343.446	3.334	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC001027969481	1328441893	/nfs/dbraw/zinc/44/18/93/1328441893.db2.gz	NMCFRSSDAPXXJV-RBSFLKMASA-N	0	3	330.394	3.288	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2nc(C(C)(C)C)cs2)C1	ZINC000966874134	1328447560	/nfs/dbraw/zinc/44/75/60/1328447560.db2.gz	CSVSJVVEJYSLOM-ZIAGYGMSSA-N	0	3	335.517	3.457	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](C)[C@H](NC(=O)c2cc(C(F)(F)F)no2)C1	ZINC000966889388	1328454998	/nfs/dbraw/zinc/45/49/98/1328454998.db2.gz	YAVIVQWOGBLXHR-VXGBXAGGSA-N	0	3	345.365	3.100	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)Cc2ccc(C)c(Cl)c2)C1	ZINC000966907885	1328468442	/nfs/dbraw/zinc/46/84/42/1328468442.db2.gz	HPVSDLBSYBRKIQ-QAPCUYQASA-N	0	3	332.875	3.041	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccccc2-c2ccncc2)C1	ZINC000966908984	1328469936	/nfs/dbraw/zinc/46/99/36/1328469936.db2.gz	YBCSQMOSGAQNMR-UWJYYQICSA-N	0	3	347.462	3.212	20	30		EGEDHN
C#CCCN1CCC[C@H]1CNC(=O)c1cc2c(o1)c(F)ccc2C	ZINC001028043101	1328508168	/nfs/dbraw/zinc/50/81/68/1328508168.db2.gz	GLTQLFJVAHIOMM-AWEZNQCLSA-N	0	3	328.387	3.098	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)CN[C@@H]1CCc2cccc3cccc1c32	ZINC000931807147	1329763035	/nfs/dbraw/zinc/76/30/35/1329763035.db2.gz	SLBAKJNVICJVFO-WIYYLYMNSA-N	0	3	335.451	3.471	20	30		EGEDHN
CN(Cc1ccc(CC#N)cc1)C[C@@H]1CCN1C(=O)OC(C)(C)C	ZINC000933467949	1329891588	/nfs/dbraw/zinc/89/15/88/1329891588.db2.gz	QMVWAOWNPWXAJF-KRWDZBQOSA-N	0	3	329.444	3.194	20	30		EGEDHN
C[C@H](Cc1cccnc1)NCc1ccc(C#N)cc1Br	ZINC000934233850	1329957377	/nfs/dbraw/zinc/95/73/77/1329957377.db2.gz	LDWSPASMPNXLNK-GFCCVEGCSA-N	0	3	330.229	3.437	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H](C)[C@H](NCc3cnc(C)s3)C2)CC1	ZINC000939051343	1330365822	/nfs/dbraw/zinc/36/58/22/1330365822.db2.gz	YXFBWZYGOCYAFD-CXAGYDPISA-N	0	3	333.501	3.134	20	30		EGEDHN
CC1(C)CN(Cc2cccc(C#N)c2)CC[C@H]1NC(=O)C1CCC1	ZINC000940513287	1331096036	/nfs/dbraw/zinc/09/60/36/1331096036.db2.gz	BBRMHVYBCBRSCM-GOSISDBHSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)cc2)CC[C@H]1NC(=O)C1C=CC=CC=C1	ZINC000942093235	1331825930	/nfs/dbraw/zinc/82/59/30/1331825930.db2.gz	ZBMRZLWMNXZHDD-DYESRHJHSA-N	0	3	347.462	3.183	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc(C)cc2Cl)[C@@H](C)C1	ZINC000942193254	1331873363	/nfs/dbraw/zinc/87/33/63/1331873363.db2.gz	RZJZSUBFPCKYAC-MAUKXSAKSA-N	0	3	332.875	3.041	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)n(C(CC)CC)n2)[C@H](C)C1	ZINC000942209287	1331880435	/nfs/dbraw/zinc/88/04/35/1331880435.db2.gz	UZDKWLSKAQZRNU-QAPCUYQASA-N	0	3	344.503	3.016	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(C(F)F)cc2)[C@H](C)C1	ZINC000942468012	1331941155	/nfs/dbraw/zinc/94/11/55/1331941155.db2.gz	VURRETQQVJNYNE-PBHICJAKSA-N	0	3	334.410	3.017	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3cc(Cl)ccc3[nH]2)[C@H](C)C1	ZINC000942556288	1331971166	/nfs/dbraw/zinc/97/11/66/1331971166.db2.gz	YRTDXTFVIOYYIM-CJNGLKHVSA-N	0	3	343.858	3.285	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCN(Cc3cccnc3C)C[C@H]2C)CC1	ZINC000942600893	1331997967	/nfs/dbraw/zinc/99/79/67/1331997967.db2.gz	WNMZZQCRZPPJSO-OXQOHEQNSA-N	0	3	341.499	3.463	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(CCc3csc(C)n3)C[C@@H]2C)C1	ZINC000942608633	1332004387	/nfs/dbraw/zinc/00/43/87/1332004387.db2.gz	XWSNDVQVKQYQNC-WMLDXEAASA-N	0	3	347.528	3.177	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2c(F)ccc(F)c2Cl)[C@H](C)C1	ZINC000942959755	1332067155	/nfs/dbraw/zinc/06/71/55/1332067155.db2.gz	NPHHCLYYXAMMMP-MFKMUULPSA-N	0	3	328.790	3.244	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc3sccc3c2)[C@H](C)C1	ZINC000943818050	1332273752	/nfs/dbraw/zinc/27/37/52/1332273752.db2.gz	VKFXPZAPFKOBQB-PBHICJAKSA-N	0	3	326.465	3.365	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnn(C3CCCCC3)c2)[C@H](C)C1	ZINC000944016735	1332308256	/nfs/dbraw/zinc/30/82/56/1332308256.db2.gz	NJNICVPQCQCHOY-CRAIPNDOSA-N	0	3	330.476	3.015	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnn(C(CC)CC)c2C)[C@@H](C)C1	ZINC000944063920	1332319862	/nfs/dbraw/zinc/31/98/62/1332319862.db2.gz	WIXSJHWOWAEPQM-KBXCAEBGSA-N	0	3	332.492	3.179	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(Cl)ccc2Cl)[C@@H](C)C1	ZINC000944305246	1332367905	/nfs/dbraw/zinc/36/79/05/1332367905.db2.gz	LRPUTMDOKRJHRT-BLLLJJGKSA-N	0	3	339.266	3.457	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2c(Cl)cccc2Cl)[C@H](C)C1	ZINC000944304772	1332368284	/nfs/dbraw/zinc/36/82/84/1332368284.db2.gz	LAOLWAWSIYGDDK-IUODEOHRSA-N	0	3	339.266	3.457	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2csc3c2CCCC3)[C@@H](C)C1	ZINC000944698281	1332422746	/nfs/dbraw/zinc/42/27/46/1332422746.db2.gz	FAQHOTAUCRSNFW-WMLDXEAASA-N	0	3	330.497	3.090	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(COC(C)C)cc2)[C@H](C)C1	ZINC000944810304	1332426839	/nfs/dbraw/zinc/42/68/39/1332426839.db2.gz	HONHCFGRKWYEHD-YLJYHZDGSA-N	0	3	342.483	3.075	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2sc(Cl)nc2Cl)[C@@H](C)C1	ZINC000944944982	1332459837	/nfs/dbraw/zinc/45/98/37/1332459837.db2.gz	PRBOYUYFBRPSOM-IUCAKERBSA-N	0	3	334.272	3.076	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)CC2C3CC4CC(C3)CC2C4)[C@H](C)C1	ZINC000945006089	1332475221	/nfs/dbraw/zinc/47/52/21/1332475221.db2.gz	GYQDJZALBBWLFB-SXOVULEUSA-N	0	3	342.527	3.299	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3ccccc3n2CC)[C@@H](C)C1	ZINC000945088048	1332496308	/nfs/dbraw/zinc/49/63/08/1332496308.db2.gz	ADROQLKDTVEQCJ-WMZOPIPTSA-N	0	3	337.467	3.125	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3cncc(CC)c3)CC[C@@H]2C1	ZINC000946677446	1332875952	/nfs/dbraw/zinc/87/59/52/1332875952.db2.gz	AHJFQDUVQVHCFT-CALCHBBNSA-N	0	3	347.890	3.181	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CN(Cc3cncc(F)c3)C[C@H]2CC1	ZINC000946714179	1332882615	/nfs/dbraw/zinc/88/26/15/1332882615.db2.gz	IHSRERCXDUASHS-CALCHBBNSA-N	0	3	345.462	3.103	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)Cc3cccc(C)c3)CC[C@@H]2C1	ZINC000946752201	1332890933	/nfs/dbraw/zinc/89/09/33/1332890933.db2.gz	XKRLAOIDXUUFIW-KDURUIRLSA-N	0	3	346.902	3.460	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H]2CN(Cc3nocc3C)C[C@H]2CC1	ZINC000946758833	1332893345	/nfs/dbraw/zinc/89/33/45/1332893345.db2.gz	VZAZPWUFALDYDR-QKLQHJQFSA-N	0	3	345.487	3.256	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)C2CCCC2)CCN1Cc1cccc(C#N)c1	ZINC000946976435	1332951500	/nfs/dbraw/zinc/95/15/00/1332951500.db2.gz	UYMRJVUEIWVPPU-HNAYVOBHSA-N	0	3	325.456	3.218	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)c2ccccc2)CCN1Cc1cccc(C#N)c1	ZINC000947006358	1332968004	/nfs/dbraw/zinc/96/80/04/1332968004.db2.gz	ZXAXCZZMMQXWIJ-OXJNMPFZSA-N	0	3	333.435	3.341	20	30		EGEDHN
Cc1cncc(C(=O)N[C@H]2CCN(Cc3ccc(C#N)cc3)[C@H](C)C2)c1	ZINC000947162928	1333030909	/nfs/dbraw/zinc/03/09/09/1333030909.db2.gz	NUBLBGFIDAOPQS-UZLBHIALSA-N	0	3	348.450	3.045	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccccc2CC(C)(C)C)C[C@@H]1C	ZINC000947429463	1333124809	/nfs/dbraw/zinc/12/48/09/1333124809.db2.gz	IDDSRDXXZLTENB-WMZOPIPTSA-N	0	3	326.484	3.491	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)c3ccccc3n2)C[C@@H]1C	ZINC000947456275	1333136093	/nfs/dbraw/zinc/13/60/93/1333136093.db2.gz	YXKUOXFVWWLPNJ-DLBZAZTESA-N	0	3	335.451	3.149	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)nn2C(CC)CC)C[C@@H]1C	ZINC000947471385	1333141495	/nfs/dbraw/zinc/14/14/95/1333141495.db2.gz	BNJDMXDNJKVMNZ-DLBZAZTESA-N	0	3	344.503	3.159	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2coc3ccc(OC)cc32)C[C@@H]1C	ZINC000947537714	1333162498	/nfs/dbraw/zinc/16/24/98/1333162498.db2.gz	POYAOIWKRDFBAV-UONOGXRCSA-N	0	3	328.412	3.210	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc3cccc(OC)c3o2)C[C@H]1C	ZINC000947667606	1333215393	/nfs/dbraw/zinc/21/53/93/1333215393.db2.gz	RPQIDKTVPUKVSY-HIFRSBDPSA-N	0	3	328.412	3.210	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)C2CC3(CC3)C2)CCN1Cc1ccc(C#N)cc1	ZINC000947701306	1333230629	/nfs/dbraw/zinc/23/06/29/1333230629.db2.gz	AEWGIVMTQYLDHE-KXBFYZLASA-N	0	3	337.467	3.218	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3cnccc3C)[C@@H](C)C2)C1	ZINC000947702792	1333232535	/nfs/dbraw/zinc/23/25/35/1333232535.db2.gz	SIUYQULIYWPAHF-WMZOPIPTSA-N	0	3	327.472	3.215	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C(C)C)nc2C)C[C@H]1C	ZINC000947727548	1333242522	/nfs/dbraw/zinc/24/25/22/1333242522.db2.gz	YXCNDMMFOIZGPF-NVXWUHKLSA-N	0	3	327.472	3.119	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)oc2C(F)(F)F)C[C@@H]1C	ZINC000947757802	1333252818	/nfs/dbraw/zinc/25/28/18/1333252818.db2.gz	FTSQNINLUMXYTN-AAEUAGOBSA-N	0	3	342.361	3.213	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C(C)(C)c2ccccc2F)C[C@@H]1C	ZINC000947811368	1333268811	/nfs/dbraw/zinc/26/88/11/1333268811.db2.gz	ZHPHERABDJBABC-JKSUJKDBSA-N	0	3	330.447	3.096	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ncoc2-c2cccs2)C[C@@H]1C	ZINC000947825648	1333272228	/nfs/dbraw/zinc/27/22/28/1333272228.db2.gz	URCYJNZGPINVSU-STQMWFEESA-N	0	3	331.441	3.172	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccccc2C(F)(F)F)C[C@@H]1C	ZINC000947962064	1333321760	/nfs/dbraw/zinc/32/17/60/1333321760.db2.gz	JEMWEUIWCANMPT-QWHCGFSZSA-N	0	3	326.362	3.474	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc(C(F)(F)F)c2)C[C@H]1C	ZINC000947961779	1333322195	/nfs/dbraw/zinc/32/21/95/1333322195.db2.gz	FMKVQQIWZLGCMF-CJNGLKHVSA-N	0	3	338.373	3.311	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C(F)(F)F)cc2)C[C@@H]1C	ZINC000947963062	1333323189	/nfs/dbraw/zinc/32/31/89/1333323189.db2.gz	QVKPYDUAIZDBGV-BBRMVZONSA-N	0	3	338.373	3.311	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc3c(c2)CCCC3)C[C@H]1C	ZINC000948015831	1333342401	/nfs/dbraw/zinc/34/24/01/1333342401.db2.gz	IGGPFVDNCQTTMX-DYESRHJHSA-N	0	3	338.495	3.100	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)n(C(C)C)c2C)C[C@H]1C	ZINC000948017689	1333342887	/nfs/dbraw/zinc/34/28/87/1333342887.db2.gz	WOKSAUXNNFHRBL-CRAIPNDOSA-N	0	3	329.488	3.292	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(CC(C)C)cc2)C[C@H]1C	ZINC000948020301	1333343881	/nfs/dbraw/zinc/34/38/81/1333343881.db2.gz	BAZQNUUEOFMTNX-YLJYHZDGSA-N	0	3	326.484	3.491	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3cc(C)cc(C)c3)CC2)C[C@@H]1C	ZINC000948044380	1333352244	/nfs/dbraw/zinc/35/22/44/1333352244.db2.gz	QKGXNQQGGRJWIJ-ICSRJNTNSA-N	0	3	338.495	3.327	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(-c3ccccc3)[nH]2)C[C@@H]1C	ZINC000948094497	1333373407	/nfs/dbraw/zinc/37/34/07/1333373407.db2.gz	LQFUORMMVDRHOT-FUHWJXTLSA-N	0	3	335.451	3.288	20	30		EGEDHN
CN(C(=O)[C@H]1CC1(C)C)[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948295217	1333468570	/nfs/dbraw/zinc/46/85/70/1333468570.db2.gz	PKOZTYIOTWVTAI-RTBURBONSA-N	0	3	339.483	3.417	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2cccc(OCCC)c2)CC1	ZINC000948416964	1333517571	/nfs/dbraw/zinc/51/75/71/1333517571.db2.gz	UDZYVXMNFUWZKS-GOSISDBHSA-N	0	3	328.456	3.035	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2ccc(C(C)C)nc2)CC1	ZINC000948438881	1333525051	/nfs/dbraw/zinc/52/50/51/1333525051.db2.gz	BRJCOWDQZSEKCW-GOSISDBHSA-N	0	3	327.472	3.155	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2nc(Cl)sc2Cl)CC1	ZINC000948670681	1333622627	/nfs/dbraw/zinc/62/26/27/1333622627.db2.gz	VIOAWWKEEAZAKA-JTQLQIEISA-N	0	3	346.283	3.010	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2ccc(F)c(Cl)c2F)CC1	ZINC000948746664	1333657030	/nfs/dbraw/zinc/65/70/30/1333657030.db2.gz	HMLVOZUMJRVBJI-GFCCVEGCSA-N	0	3	340.801	3.178	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cc([C@H](C)CC)no2)CC1	ZINC000948836259	1333703867	/nfs/dbraw/zinc/70/38/67/1333703867.db2.gz	AHZQBQTWWMIXMV-CVEARBPZSA-N	0	3	331.460	3.138	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2ccc(C(F)F)cc2F)CC1	ZINC000948873081	1333716626	/nfs/dbraw/zinc/71/66/26/1333716626.db2.gz	AZXUFOVQBVMUFM-AWEZNQCLSA-N	0	3	338.373	3.323	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@H]1CNC(=O)c1ccc(C)n1C	ZINC000948889792	1333720205	/nfs/dbraw/zinc/72/02/05/1333720205.db2.gz	GGOPYDFWOPEVKB-HXUWFJFHSA-N	0	3	337.467	3.239	20	30		EGEDHN
N#Cc1cc(C(=O)NC[C@H]2c3ccccc3CCN2CC2CCC2)c[nH]1	ZINC000948907028	1333729135	/nfs/dbraw/zinc/72/91/35/1333729135.db2.gz	VCYJSYPDRBXYJV-FQEVSTJZSA-N	0	3	348.450	3.016	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@@H]1CNC(=O)[C@@H]1CCCOCC1	ZINC000948913239	1333731505	/nfs/dbraw/zinc/73/15/05/1333731505.db2.gz	QTKAIMDPASPFGA-QUCCMNQESA-N	0	3	342.483	3.095	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@@H]1CNC(=O)[C@@H]1CC1(F)F	ZINC000948915935	1333732771	/nfs/dbraw/zinc/73/27/71/1333732771.db2.gz	IJFANEMWQFUZJL-IRXDYDNUSA-N	0	3	334.410	3.323	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2CCN(CC3CCCC3)CC2)cc1	ZINC000948918832	1333733858	/nfs/dbraw/zinc/73/38/58/1333733858.db2.gz	DSJAOIQVYQNUBC-UHFFFAOYSA-N	0	3	328.456	3.199	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@@H]1CNC(=O)[C@H]1OCC[C@H]1CC	ZINC000948928729	1333736961	/nfs/dbraw/zinc/73/69/61/1333736961.db2.gz	KSALPINTBLAZMX-UXPWSPDFSA-N	0	3	342.483	3.093	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1CCCC[C@H]1CC)CCO2	ZINC000949221204	1333797698	/nfs/dbraw/zinc/79/76/98/1333797698.db2.gz	UZFKEQZCKXLBSG-MSOLQXFVSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C[C@@H]3C=CCCC3)CC2)C1	ZINC000949395629	1333836396	/nfs/dbraw/zinc/83/63/96/1333836396.db2.gz	XDLUMQSUMXIOGN-LJQANCHMSA-N	0	3	346.515	3.392	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C3(C4CC4)CCC3)CC2)C1	ZINC000949423852	1333844226	/nfs/dbraw/zinc/84/42/26/1333844226.db2.gz	SFDZTNXJHMKGOI-UHFFFAOYSA-N	0	3	346.515	3.226	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C(C)(C)C3CCC3)CC2)C1	ZINC000949426899	1333844890	/nfs/dbraw/zinc/84/48/90/1333844890.db2.gz	ADWGBIJABRLLDC-UHFFFAOYSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@H]3CCC[C@H](C)C3)CC2)C1	ZINC000949455187	1333851940	/nfs/dbraw/zinc/85/19/40/1333851940.db2.gz	VXUSSWZSYHKEIQ-ROUUACIJSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3ccc(C)cc3C)CC2)C1	ZINC000949520482	1333866139	/nfs/dbraw/zinc/86/61/39/1333866139.db2.gz	UXEQVSIRZAKWFY-UHFFFAOYSA-N	0	3	342.483	3.187	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2c(C)c(F)ccc2Cl)C1	ZINC000967032758	1335646812	/nfs/dbraw/zinc/64/68/12/1335646812.db2.gz	OKMGBSZNXBAHJI-MLGOLLRUSA-N	0	3	336.838	3.251	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)Cc2cc3ccccc3s2)C1	ZINC000967331758	1335703041	/nfs/dbraw/zinc/70/30/41/1335703041.db2.gz	COBMJWOYWPNGOC-YJBOKZPZSA-N	0	3	340.492	3.294	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)Cc2cc3ccccc3o2)C1	ZINC000967620198	1335794270	/nfs/dbraw/zinc/79/42/70/1335794270.db2.gz	DLQKYHPUJUOPOB-MAUKXSAKSA-N	0	3	326.440	3.378	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CN(CCc3cccs3)CC[C@H]2C)C1	ZINC000968277162	1335883646	/nfs/dbraw/zinc/88/36/46/1335883646.db2.gz	YAQQSBRAZSGPHZ-WBVHZDCISA-N	0	3	332.513	3.474	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2c(C)noc2C(F)(F)F)C1	ZINC000968369328	1335906468	/nfs/dbraw/zinc/90/64/68/1335906468.db2.gz	ITLFHWQHXOIWPI-JQWIXIFHSA-N	0	3	345.365	3.018	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2cnn(C(CC)CC)c2C)C1	ZINC000968518061	1335950974	/nfs/dbraw/zinc/95/09/74/1335950974.db2.gz	XGDDPVCBDYRYFT-KXBFYZLASA-N	0	3	344.503	3.016	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)C(C)(C)c2ccc(C)cc2)C1	ZINC000968556555	1335960702	/nfs/dbraw/zinc/96/07/02/1335960702.db2.gz	BGIYSJFGUMPZQP-IEBWSBKVSA-N	0	3	326.484	3.123	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)Cc2ccc3ccccc3c2)C1	ZINC000968627498	1335989553	/nfs/dbraw/zinc/98/95/53/1335989553.db2.gz	IXNYBRKFBXEDCM-UTKZUKDTSA-N	0	3	334.463	3.232	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccc3[nH]c(C)c(C)c3c2)C1	ZINC000968634888	1335991517	/nfs/dbraw/zinc/99/15/17/1335991517.db2.gz	BMUCZZUKFMCQRM-JLTOFOAXSA-N	0	3	337.467	3.248	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2cc(OC)c(OC)cc2C)C1	ZINC000968664819	1336002355	/nfs/dbraw/zinc/00/23/55/1336002355.db2.gz	JJQMSURGWZRMFA-WMLDXEAASA-N	0	3	346.471	3.029	20	30		EGEDHN
N#Cc1cccc(CN2CCCCC[C@H]2CNC(=O)C2CCC2)c1	ZINC000968727112	1336026055	/nfs/dbraw/zinc/02/60/55/1336026055.db2.gz	KSRQLDFDVFGBAW-IBGZPJMESA-N	0	3	325.456	3.219	20	30		EGEDHN
N#Cc1ccc(CN2CCCCC[C@H]2CNC(=O)c2ccncc2)cc1	ZINC000968735593	1336032091	/nfs/dbraw/zinc/03/20/91/1336032091.db2.gz	LHIIWIHOLHMYRB-FQEVSTJZSA-N	0	3	348.450	3.128	20	30		EGEDHN
C[C@]1(C(=O)N2CC[C@@H](NCc3ccc(C#N)c(F)c3)C2)CC=CCC1	ZINC000968782905	1336048593	/nfs/dbraw/zinc/04/85/93/1336048593.db2.gz	FMYHKMMTBHBPDQ-XLIONFOSSA-N	0	3	341.430	3.134	20	30		EGEDHN
C[C@@]1(C(=O)N2CC[C@@H](NCc3ccc(C#N)s3)C2)CC=CCC1	ZINC000968783094	1336049500	/nfs/dbraw/zinc/04/95/00/1336049500.db2.gz	LLNPPCBXOJQRAV-RDTXWAMCSA-N	0	3	329.469	3.057	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccoc1C(F)(F)F	ZINC000968875376	1336075429	/nfs/dbraw/zinc/07/54/29/1336075429.db2.gz	ZJDQYFHMCIDUNM-LBPRGKRZSA-N	0	3	330.350	3.459	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1c(C)onc1C1CC1	ZINC000968955438	1336102143	/nfs/dbraw/zinc/10/21/43/1336102143.db2.gz	VUCIVAUCLIYNIO-INIZCTEOSA-N	0	3	331.460	3.411	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cnn(C(C)C)c1Cl	ZINC000968967830	1336104609	/nfs/dbraw/zinc/10/46/09/1336104609.db2.gz	BXSDNQOLHPKQSG-CQSZACIVSA-N	0	3	338.883	3.278	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cncc2sccc21	ZINC000969001410	1336115146	/nfs/dbraw/zinc/11/51/46/1336115146.db2.gz	ADEFNCPCLUYQDP-CQSZACIVSA-N	0	3	329.469	3.457	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1ccc2cnccc2c1	ZINC000969105733	1336146340	/nfs/dbraw/zinc/14/63/40/1336146340.db2.gz	MVCJNOMJXTUKMX-HXUWFJFHSA-N	0	3	335.451	3.233	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)[C@@H]1C[C@H]1c1ccc(F)cc1	ZINC000969158927	1336166774	/nfs/dbraw/zinc/16/67/74/1336166774.db2.gz	WPVSKQCXYCYAMX-SLFFLAALSA-N	0	3	342.458	3.313	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1cccnc1OC(C)C	ZINC000969173684	1336171242	/nfs/dbraw/zinc/17/12/42/1336171242.db2.gz	PUKVCFMNPTULMX-QGZVFWFLSA-N	0	3	345.487	3.419	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3cnn(C(C)(C)C)c3)C2)CC1	ZINC000969830371	1336251886	/nfs/dbraw/zinc/25/18/86/1336251886.db2.gz	KCOTYVBVPZPYRV-GOSISDBHSA-N	0	3	344.503	3.075	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](NCc2ccccc2N(C)C)C1	ZINC000969829996	1336251931	/nfs/dbraw/zinc/25/19/31/1336251931.db2.gz	BQMWQBBUXCCXMK-YLJYHZDGSA-N	0	3	329.488	3.045	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)c2cc(C3CC3)[nH]c2C2CC2)C1	ZINC000969958628	1336266394	/nfs/dbraw/zinc/26/63/94/1336266394.db2.gz	MCMGTHUZIUUMGU-CYBMUJFWSA-N	0	3	327.472	3.396	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)[C@H]2CCc3c2cccc3Cl)C1	ZINC000970169016	1336288111	/nfs/dbraw/zinc/28/81/11/1336288111.db2.gz	JKTMIUCPEBZUHK-DYVFJYSZSA-N	0	3	332.875	3.382	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)N2CC[C@@H](NCc3ccc(C#N)s3)C2)CC1	ZINC000970528282	1336317751	/nfs/dbraw/zinc/31/77/51/1336317751.db2.gz	NKBHQJYRMPYFOH-RBSFLKMASA-N	0	3	331.485	3.137	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cccc(NC(=O)CC)c2)CC1	ZINC001005460841	1336354872	/nfs/dbraw/zinc/35/48/72/1336354872.db2.gz	GDZCLADYCRLHTM-UHFFFAOYSA-N	0	3	343.471	3.148	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cc(C3CC3)[nH]c2C2CC2)CC1	ZINC001005576233	1336373822	/nfs/dbraw/zinc/37/38/22/1336373822.db2.gz	VHRARQFHDIBTBE-UHFFFAOYSA-N	0	3	327.472	3.492	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cnn3cccc(Cl)c23)CC1	ZINC001005687897	1336393188	/nfs/dbraw/zinc/39/31/88/1336393188.db2.gz	BJDUOOWRDGQINB-UHFFFAOYSA-N	0	3	346.862	3.100	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2ccc(F)c(Cl)c2F)CC1	ZINC001005938588	1336426326	/nfs/dbraw/zinc/42/63/26/1336426326.db2.gz	SUTHXRZAZPVYDN-UHFFFAOYSA-N	0	3	328.790	3.341	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cc(F)c(F)c(F)c2)CC1	ZINC001006036723	1336440761	/nfs/dbraw/zinc/44/07/61/1336440761.db2.gz	AZWPTZJKWZNVQB-UHFFFAOYSA-N	0	3	326.362	3.216	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccc(-c3cn[nH]c3)cc2)CC1	ZINC001006126472	1336455761	/nfs/dbraw/zinc/45/57/61/1336455761.db2.gz	GKZROLZELQOVAS-UHFFFAOYSA-N	0	3	338.455	3.189	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cc(OC)c(C)c(OC)c2)CC1	ZINC001006372092	1336496969	/nfs/dbraw/zinc/49/69/69/1336496969.db2.gz	JMZSJUUCMGKRTR-UHFFFAOYSA-N	0	3	346.471	3.125	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2sc(Cl)nc2Cl)CC1	ZINC001006417970	1336502188	/nfs/dbraw/zinc/50/21/88/1336502188.db2.gz	YTMKEZTUOJDXGN-UHFFFAOYSA-N	0	3	334.272	3.172	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccc(N(CC)CC)nc2)CC1	ZINC001006466514	1336512555	/nfs/dbraw/zinc/51/25/55/1336512555.db2.gz	PZBNEDOODCZIBI-UHFFFAOYSA-N	0	3	344.503	3.040	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CCCN(CCc2cccs2)C1	ZINC001007503491	1336659297	/nfs/dbraw/zinc/65/92/97/1336659297.db2.gz	RPASBOWCCRANQV-MRXNPFEDSA-N	0	3	343.496	3.173	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H](NC(=O)c2cc3c(C)nn(C)c3s2)C1	ZINC001008111040	1336771573	/nfs/dbraw/zinc/77/15/73/1336771573.db2.gz	AFXTYGPNHOKZJZ-CQSZACIVSA-N	0	3	346.500	3.104	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2sccc2-n2cccc2)C1	ZINC001008120094	1336773926	/nfs/dbraw/zinc/77/39/26/1336773926.db2.gz	JDWKBVPGVZOBJW-OAHLLOKOSA-N	0	3	329.469	3.309	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2cc3cccc(OC)c3o2)C1	ZINC001008350639	1336831058	/nfs/dbraw/zinc/83/10/58/1336831058.db2.gz	RLHJWFQPJQIHEW-OAHLLOKOSA-N	0	3	328.412	3.212	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CCCN(CCCC3CCCC3)C2)c1	ZINC001008470975	1336865187	/nfs/dbraw/zinc/86/51/87/1336865187.db2.gz	XVAHAZOSJGJSFO-HXUWFJFHSA-N	0	3	339.483	3.228	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2cnn(CCC(C)C)c2C)C1	ZINC001009124718	1336973321	/nfs/dbraw/zinc/97/33/21/1336973321.db2.gz	REJASJSSCNXZLX-QGZVFWFLSA-N	0	3	332.492	3.008	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2ccnc(O[C@@H](C)CC)c2)C1	ZINC001009135344	1336974554	/nfs/dbraw/zinc/97/45/54/1336974554.db2.gz	YQRLEALTQKQUPM-RDJZCZTQSA-N	0	3	331.460	3.029	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CCN(Cc2cccc(CC)c2)C1	ZINC001014725469	1337886414	/nfs/dbraw/zinc/88/64/14/1337886414.db2.gz	OMAGPUYGFADDCO-IBGZPJMESA-N	0	3	337.467	3.241	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(CCc3ccc(CC)cc3)C2)cc1	ZINC001015488429	1338157663	/nfs/dbraw/zinc/15/76/63/1338157663.db2.gz	PRGLHTVECQQHLJ-JOCHJYFZSA-N	0	3	346.474	3.277	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCN(CCc3ccc(C)cc3)C2)CC1	ZINC001015659461	1338238803	/nfs/dbraw/zinc/23/88/03/1338238803.db2.gz	BARJJYRGTXEXMI-HXUWFJFHSA-N	0	3	326.484	3.474	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN([C@@H](CC)c3ccccc3)C2)cn1	ZINC001016016819	1338407945	/nfs/dbraw/zinc/40/79/45/1338407945.db2.gz	OCUIVGYPMQFMSC-UXHICEINSA-N	0	3	333.435	3.018	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@@H]1CCN(Cc2ccc(C)c(C)c2)C1	ZINC001016114945	1338467204	/nfs/dbraw/zinc/46/72/04/1338467204.db2.gz	UYJDQQFZRACHJS-JOCHJYFZSA-N	0	3	346.474	3.218	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@H]3NC(=O)[C@H]3CC=CCC3)CC2)c1	ZINC001016500027	1338627300	/nfs/dbraw/zinc/62/73/00/1338627300.db2.gz	LVCDRRVDOHQXCY-VQTJNVASSA-N	0	3	349.478	3.385	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H]2CC23CCN(Cc2cccc(C#N)c2)CC3)co1	ZINC001016594032	1338658636	/nfs/dbraw/zinc/65/86/36/1338658636.db2.gz	UJMMZKMMPVDPHH-LJQANCHMSA-N	0	3	349.434	3.244	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2scnc2C2CCCC2)CC1	ZINC001016713357	1338699942	/nfs/dbraw/zinc/69/99/42/1338699942.db2.gz	VPIUCUVVDVPGQB-OAHLLOKOSA-N	0	3	343.496	3.018	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC23CCN(Cc2c(C)noc2C)CC3)C1	ZINC001016807988	1338732782	/nfs/dbraw/zinc/73/27/82/1338732782.db2.gz	NHWXYEQJYUCZGQ-KRWDZBQOSA-N	0	3	343.471	3.118	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N[C@H]1CC12CCN(Cc1cccc(C#N)c1)CC2	ZINC001016845158	1338744761	/nfs/dbraw/zinc/74/47/61/1338744761.db2.gz	NYGVGMWGZCQDGP-QRVBRYPASA-N	0	3	337.467	3.075	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)C2[C@@H]3CCCCCC[C@@H]23)CC1	ZINC001016847235	1338746213	/nfs/dbraw/zinc/74/62/13/1338746213.db2.gz	KPMVBIFXQNCIOO-KURKYZTESA-N	0	3	328.500	3.197	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)[C@@H](C)c2ccc(Cl)s2)CC1	ZINC001016919042	1338769801	/nfs/dbraw/zinc/76/98/01/1338769801.db2.gz	JPEVQTFLZFBECR-JSGCOSHPSA-N	0	3	336.888	3.109	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cc(C)c(F)cc2Cl)CC1	ZINC001016949109	1338781738	/nfs/dbraw/zinc/78/17/38/1338781738.db2.gz	AHOOEGYBHHEURC-KRWDZBQOSA-N	0	3	348.849	3.395	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cc3cccc(C)c3o2)CC1	ZINC001016985619	1338793145	/nfs/dbraw/zinc/79/31/45/1338793145.db2.gz	LCLTTZHOFVDCKR-GOSISDBHSA-N	0	3	336.435	3.349	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2oc3ccccc3c2CC)CC1	ZINC001016993587	1338796849	/nfs/dbraw/zinc/79/68/49/1338796849.db2.gz	OKDCSTAKQXEXTP-GOSISDBHSA-N	0	3	336.435	3.213	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2cc(-c3ccccc3)co2)CC1	ZINC001017004174	1338801011	/nfs/dbraw/zinc/80/10/11/1338801011.db2.gz	QXWTWEQCDADUEU-IBGZPJMESA-N	0	3	334.419	3.164	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2cc(-c3ccccc3)co2)CC1	ZINC001017004175	1338801247	/nfs/dbraw/zinc/80/12/47/1338801247.db2.gz	QXWTWEQCDADUEU-LJQANCHMSA-N	0	3	334.419	3.164	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H](CN(C)Cc2cnoc2C)C1	ZINC001017179678	1338923534	/nfs/dbraw/zinc/92/35/34/1338923534.db2.gz	MGSDXNHJTRHKQP-INIZCTEOSA-N	0	3	333.476	3.256	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1C[C@H]1c1sccc1C	ZINC001017549693	1339365767	/nfs/dbraw/zinc/36/57/67/1339365767.db2.gz	KSLSRFQQLURAFD-YYIAUSFCSA-N	0	3	330.497	3.411	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CCn1ccnc1C(C)C	ZINC001018024089	1339484480	/nfs/dbraw/zinc/48/44/80/1339484480.db2.gz	PACAZKXAIXJXEC-HDICACEKSA-N	0	3	344.503	3.038	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1CCO[C@@H](C(C)C)C1	ZINC001018144858	1339513524	/nfs/dbraw/zinc/51/35/24/1339513524.db2.gz	UVZVDOUWSBGBRP-INDMIFKZSA-N	0	3	334.504	3.079	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H](C)c1cccc(OC)c1	ZINC001018327845	1339579211	/nfs/dbraw/zinc/57/92/11/1339579211.db2.gz	YWYVJSSBTDPEGW-QRQLOZEOSA-N	0	3	342.483	3.440	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)COC1CCC(C)CC1	ZINC001018334176	1339581329	/nfs/dbraw/zinc/58/13/29/1339581329.db2.gz	GDCZGMPGEBWNRS-FXSDRFNOSA-N	0	3	334.504	3.223	20	30		EGEDHN
Cc1ccccc1C(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001018443873	1339621542	/nfs/dbraw/zinc/62/15/42/1339621542.db2.gz	MKTAQMDTAJVQMH-KRWDZBQOSA-N	0	3	337.398	3.010	20	30		EGEDHN
C[C@H](N[C@H]1CCN(C(=O)c2c[nH]c(C#N)c2)C1)c1ccccc1Cl	ZINC001018747876	1339718679	/nfs/dbraw/zinc/71/86/79/1339718679.db2.gz	OOBJJTKBKRKCEK-JSGCOSHPSA-N	0	3	342.830	3.105	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1cnn(C2CCCC2)c1C	ZINC001028253215	1340513711	/nfs/dbraw/zinc/51/37/11/1340513711.db2.gz	RIAXHLBJPARKNG-KRWDZBQOSA-N	0	3	330.476	3.077	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCCN2Cc2ccc(CC)cc2)nc1	ZINC001028272311	1340525448	/nfs/dbraw/zinc/52/54/48/1340525448.db2.gz	SUVNJXAKWZIYIH-FQEVSTJZSA-N	0	3	347.462	3.020	20	30		EGEDHN
Cc1ccccc1C(=O)NC[C@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC001028380672	1340609531	/nfs/dbraw/zinc/60/95/31/1340609531.db2.gz	PMHXPZLUMOBJCE-LJQANCHMSA-N	0	3	333.435	3.119	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H](CNC(=O)C3CCCCCC3)C2)c1	ZINC001028442574	1340643400	/nfs/dbraw/zinc/64/34/00/1340643400.db2.gz	FOLWUPUQGPXHSX-IBGZPJMESA-N	0	3	339.483	3.467	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CCN(Cc3ccc(C#N)cc3)C2)CC1	ZINC001028780504	1340812928	/nfs/dbraw/zinc/81/29/28/1340812928.db2.gz	KBLDHSOEHXRKRX-IBGZPJMESA-N	0	3	337.467	3.243	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H](CNC(=O)c3occc3Cl)C2)c1	ZINC001028781884	1340813919	/nfs/dbraw/zinc/81/39/19/1340813919.db2.gz	HXONQXCONHVQNI-OAHLLOKOSA-N	0	3	343.814	3.057	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)c2coc3ccc(Cl)cc23)C1	ZINC001028956242	1340893526	/nfs/dbraw/zinc/89/35/26/1340893526.db2.gz	AVQGMQIZZQNHNE-CYBMUJFWSA-N	0	3	330.815	3.161	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC([C@@H](C)NCc2cc(F)ccc2C#N)CC1	ZINC001029076907	1340924595	/nfs/dbraw/zinc/92/45/95/1340924595.db2.gz	BWFBTNWLPQSDQY-XUYKZZHDSA-N	0	3	343.446	3.380	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)C1CCN(C(=O)C2CC(C)C2)CC1	ZINC001029078688	1340925389	/nfs/dbraw/zinc/92/53/89/1340925389.db2.gz	DHUSINKWHSMEQF-LFDOHDQPSA-N	0	3	339.483	3.321	20	30		EGEDHN
CC[C@H](F)C(=O)N1CCC([C@@H](C)NCc2ccccc2C#N)CC1	ZINC001029129673	1340937792	/nfs/dbraw/zinc/93/77/92/1340937792.db2.gz	YUJPAOLNBDBKBT-KDOFPFPSSA-N	0	3	331.435	3.023	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CC[C@@H](C1)N2C[C@@H](O)C1CCCCC1	ZINC001029454318	1340993750	/nfs/dbraw/zinc/99/37/50/1340993750.db2.gz	YPUNMVJQEUUMIC-RCLSDMTESA-N	0	3	348.531	3.205	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001029652130	1341034543	/nfs/dbraw/zinc/03/45/43/1341034543.db2.gz	NULNCZDGYMYQNP-AWEZNQCLSA-N	0	3	333.501	3.336	20	30		EGEDHN
C[C@H](c1ccccc1F)N(C)C[C@@H]1CCN(C(=O)C#CC2CC2)C1	ZINC001029732777	1341056900	/nfs/dbraw/zinc/05/69/00/1341056900.db2.gz	BYDPKFFYLSCEGO-WBVHZDCISA-N	0	3	328.431	3.080	20	30		EGEDHN
C[C@@H](c1ccccc1F)N(C)C[C@@H]1CCN(C(=O)C#CC2CC2)C1	ZINC001029732776	1341057001	/nfs/dbraw/zinc/05/70/01/1341057001.db2.gz	BYDPKFFYLSCEGO-RDJZCZTQSA-N	0	3	328.431	3.080	20	30		EGEDHN
C[C@H](c1cc(F)ccc1F)N(C)C[C@H]1CCN(C(=O)C#CC2CC2)C1	ZINC001029734404	1341057898	/nfs/dbraw/zinc/05/78/98/1341057898.db2.gz	WXJMTPQMVYQRPZ-GDBMZVCRSA-N	0	3	346.421	3.220	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](CN(C)Cc2cncc(C)c2)C1	ZINC001029797991	1341076059	/nfs/dbraw/zinc/07/60/59/1341076059.db2.gz	DHEMEAFBUZHVMS-QGZVFWFLSA-N	0	3	329.488	3.273	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](CN(C)Cc2ccnc(Cl)c2)C1	ZINC001029801128	1341077208	/nfs/dbraw/zinc/07/72/08/1341077208.db2.gz	HKWYDDJYDNAJCP-OAHLLOKOSA-N	0	3	335.879	3.228	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCN(C(=O)[C@@H]2CCC2(C)C)C1	ZINC001029813209	1341083389	/nfs/dbraw/zinc/08/33/89/1341083389.db2.gz	RQARWQNRCNVANS-PBHICJAKSA-N	0	3	345.512	3.336	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@H](CN(C)Cc2cncc(F)c2)C1	ZINC001029825512	1341087094	/nfs/dbraw/zinc/08/70/94/1341087094.db2.gz	FMLRQMWFFGFYJR-KXBFYZLASA-N	0	3	333.451	3.103	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)CC1CCN(C(=O)CCC2CC2)CC1	ZINC001029948143	1341131336	/nfs/dbraw/zinc/13/13/36/1341131336.db2.gz	VWGUTKKCZOXRFB-UHFFFAOYSA-N	0	3	345.512	3.480	20	30		EGEDHN
C=CCn1cccc1C(=O)N1C[C@@H]2C[C@H]1CN2CC1CC(C)(C)C1	ZINC001032447696	1341513485	/nfs/dbraw/zinc/51/34/85/1341513485.db2.gz	UEWNSKKQXNMUDC-IRXDYDNUSA-N	0	3	327.472	3.009	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(C)nc1C(C)C	ZINC001032545749	1341537117	/nfs/dbraw/zinc/53/71/17/1341537117.db2.gz	KYGRWOSQWYQXMM-IRXDYDNUSA-N	0	3	327.472	3.378	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H](CC)Cc1ccccc1C	ZINC001032733262	1341594765	/nfs/dbraw/zinc/59/47/65/1341594765.db2.gz	OIKSPVICFSNEKM-HOJAQTOUSA-N	0	3	326.484	3.425	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C(C)(C)c1ccc(OC)cc1	ZINC001032796310	1341616077	/nfs/dbraw/zinc/61/60/77/1341616077.db2.gz	ABZHNBDWYFOMRC-ROUUACIJSA-N	0	3	342.483	3.224	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H](C)Cc1cccc(F)c1	ZINC001032811096	1341623346	/nfs/dbraw/zinc/62/33/46/1341623346.db2.gz	SABMOTRLAWSVKG-SNRMKQJTSA-N	0	3	330.447	3.256	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C(C)(C)c1ccccc1OC	ZINC001032818868	1341625975	/nfs/dbraw/zinc/62/59/75/1341625975.db2.gz	WDUKVFFYPMUUMD-IRXDYDNUSA-N	0	3	342.483	3.224	20	30		EGEDHN
CN(C(=O)c1ccc(C#N)[nH]1)[C@H]1CCN(Cc2ccc(C3CC3)cc2)C1	ZINC001033012178	1341695865	/nfs/dbraw/zinc/69/58/65/1341695865.db2.gz	TXTCVXCFLNTNIV-IBGZPJMESA-N	0	3	348.450	3.110	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2c(F)ccc3ccncc32)C1	ZINC001033103272	1341723734	/nfs/dbraw/zinc/72/37/34/1341723734.db2.gz	VSSCMCTWMVAOFF-HNNXBMFYSA-N	0	3	327.403	3.096	20	30		EGEDHN
C=C(C)CCN1CC[C@H](N(C)C(=O)c2cc3c(C)nn(C)c3s2)C1	ZINC001033309793	1341776719	/nfs/dbraw/zinc/77/67/19/1341776719.db2.gz	QJBWQVXKFSLFRA-AWEZNQCLSA-N	0	3	346.500	3.056	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)C2(c3cccnc3)CCCC2)C1	ZINC001033365434	1341797475	/nfs/dbraw/zinc/79/74/75/1341797475.db2.gz	GSFQKSYDXMVKNI-GOSISDBHSA-N	0	3	327.472	3.002	20	30		EGEDHN
C=CCCN1CC[C@H](N(C)C(=O)c2coc(-c3ccccc3)n2)C1	ZINC001033591020	1341887749	/nfs/dbraw/zinc/88/77/49/1341887749.db2.gz	XTPBKMGMDORORO-INIZCTEOSA-N	0	3	325.412	3.064	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2coc3c2cccc3OC)C1	ZINC001033832223	1342033439	/nfs/dbraw/zinc/03/34/39/1342033439.db2.gz	DUJGKCMDXBQZBH-OAHLLOKOSA-N	0	3	340.423	3.001	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2cncc(-c3ccccc3)c2)C1	ZINC001033847485	1342042874	/nfs/dbraw/zinc/04/28/74/1342042874.db2.gz	JGMQURJZABCJGG-OAQYLSRUSA-N	0	3	347.462	3.308	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2ccc3nccc(C)c3c2)C1	ZINC001033852531	1342044435	/nfs/dbraw/zinc/04/44/35/1342044435.db2.gz	XPTCRPDBFLMGHO-GOSISDBHSA-N	0	3	335.451	3.103	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2csc(C(F)(F)F)c2)C1	ZINC001033886560	1342059805	/nfs/dbraw/zinc/05/98/05/1342059805.db2.gz	WYKHHNVGBFTBCV-CYBMUJFWSA-N	0	3	344.402	3.327	20	30		EGEDHN
C=CCCN1CC[C@@H](N(CC)C(=O)c2cc(-c3ccccc3)no2)C1	ZINC001033891448	1342064898	/nfs/dbraw/zinc/06/48/98/1342064898.db2.gz	NZCDYJSFRYNGLT-QGZVFWFLSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@H]2CCc3ccc(F)cc3O2)C1	ZINC001033901914	1342074895	/nfs/dbraw/zinc/07/48/95/1342074895.db2.gz	SSBWSDVGSIJUGX-QZTJIDSGSA-N	0	3	346.446	3.018	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2nc3ccccc3cc2C)C1	ZINC001033908212	1342079012	/nfs/dbraw/zinc/07/90/12/1342079012.db2.gz	ZHHOTDKMGSJZIJ-SFHVURJKSA-N	0	3	335.451	3.103	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@H]2CCCc3cccnc32)C1	ZINC001033932061	1342095332	/nfs/dbraw/zinc/09/53/32/1342095332.db2.gz	GDMYYCOPCVWHSB-ROUUACIJSA-N	0	3	327.472	3.000	20	30		EGEDHN
C#Cc1cncc(C(=O)N(CC)[C@H]2CCN(Cc3ccccc3C)C2)c1	ZINC001033955450	1342111887	/nfs/dbraw/zinc/11/18/87/1342111887.db2.gz	LEPXAOWRPSFRQE-NRFANRHFSA-N	0	3	347.462	3.108	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cc(F)cc3cccnc32)C1	ZINC001033973321	1342123877	/nfs/dbraw/zinc/12/38/77/1342123877.db2.gz	CCBJZJOLVMFJIB-KRWDZBQOSA-N	0	3	341.430	3.486	20	30		EGEDHN
C=CCCN1CC[C@@H](N(CC)C(=O)c2occc2Br)C1	ZINC001033988569	1342132821	/nfs/dbraw/zinc/13/28/21/1342132821.db2.gz	MLHWKPJLLLWDOS-GFCCVEGCSA-N	0	3	341.249	3.155	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@H]2CCOc3ccccc32)C1	ZINC001033992757	1342135476	/nfs/dbraw/zinc/13/54/76/1342135476.db2.gz	XDWMOHRWFNTJQT-WMZOPIPTSA-N	0	3	328.456	3.052	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cccc3c2ccn3C)C1	ZINC001033992672	1342135864	/nfs/dbraw/zinc/13/58/64/1342135864.db2.gz	WEFUMOAJBKJQSN-MRXNPFEDSA-N	0	3	325.456	3.291	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cccc(N3CCCC3)c2)C1	ZINC001033996054	1342136387	/nfs/dbraw/zinc/13/63/87/1342136387.db2.gz	AVEBMQONIIHEEX-FQEVSTJZSA-N	0	3	341.499	3.399	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cc3c(C)cccn3c2)C1	ZINC001034017142	1342155167	/nfs/dbraw/zinc/15/51/67/1342155167.db2.gz	XVAZEJBEVMYMSF-GOSISDBHSA-N	0	3	325.456	3.360	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2cc(C)n(C(C)C)c2C)C1	ZINC001034035011	1342174174	/nfs/dbraw/zinc/17/41/74/1342174174.db2.gz	OMJIZWQOLVTGSD-GOSISDBHSA-N	0	3	329.488	3.246	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2ccc(OC(C)C)cc2)C1	ZINC001034035384	1342174969	/nfs/dbraw/zinc/17/49/69/1342174969.db2.gz	KNLVLHLIOUFKLK-GOSISDBHSA-N	0	3	328.456	3.034	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@H]2Cc3c2cccc3Cl)C1	ZINC001034051629	1342193304	/nfs/dbraw/zinc/19/33/04/1342193304.db2.gz	XQORKNQHWACBBQ-PBHICJAKSA-N	0	3	332.875	3.479	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3coc4ccc(Cl)cc43)[C@@H]2C1	ZINC001076509626	1356599477	/nfs/dbraw/zinc/59/94/77/1356599477.db2.gz	GHECKAABRTWWLD-SUMWQHHRSA-N	0	3	342.826	3.256	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2csc([C@H]3CCCO3)n2)C1	ZINC001034206972	1342317449	/nfs/dbraw/zinc/31/74/49/1342317449.db2.gz	NSAXAVIWPFZSAU-GDBMZVCRSA-N	0	3	349.500	3.155	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccn(C3CCCC3)n2)C1	ZINC001034229177	1342333886	/nfs/dbraw/zinc/33/38/86/1342333886.db2.gz	NDOHYQHMWFBOGY-INIZCTEOSA-N	0	3	330.476	3.159	20	30		EGEDHN
N#Cc1ccc(CN2CCCC[C@@H](NC(=O)Cc3ccccc3)C2)cc1	ZINC001034273103	1342364184	/nfs/dbraw/zinc/36/41/84/1342364184.db2.gz	QPAAXIOGXIIBNQ-OAQYLSRUSA-N	0	3	347.462	3.272	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@@H]2COc3ccc(Cl)cc32)C1	ZINC001034308167	1342391097	/nfs/dbraw/zinc/39/10/97/1342391097.db2.gz	URFANZLVABVYSN-DOTOQJQBSA-N	0	3	348.874	3.363	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc(N(C)C)cc2)C1	ZINC001034322361	1342399140	/nfs/dbraw/zinc/39/91/40/1342399140.db2.gz	FRAABQLHCKPRGP-YZGWKJHDSA-N	0	3	341.499	3.013	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)C2(c3ccc(F)cc3)CCC2)C1	ZINC001034338969	1342412303	/nfs/dbraw/zinc/41/23/03/1342412303.db2.gz	RRQPNAFKFKONSY-GOSISDBHSA-N	0	3	330.447	3.404	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2csc(-c3ccco3)n2)C1	ZINC001034365148	1342434948	/nfs/dbraw/zinc/43/49/48/1342434948.db2.gz	PYPZHJFXGQYSHV-AWEZNQCLSA-N	0	3	343.452	3.011	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc3c(c2)C[C@@H](C)O3)C1	ZINC001034444692	1342505145	/nfs/dbraw/zinc/50/51/45/1342505145.db2.gz	JQELENYMTHPYIA-QAPCUYQASA-N	0	3	328.456	3.170	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc3[nH]c(C)nc3c2)C1	ZINC001034468597	1342523991	/nfs/dbraw/zinc/52/39/91/1342523991.db2.gz	SCBMLFFEUXJGAG-MRXNPFEDSA-N	0	3	326.444	3.032	20	30		EGEDHN
C=CCCN1CCCC[C@H](NC(=O)c2cc3cccnc3s2)C1	ZINC001034474248	1342529937	/nfs/dbraw/zinc/52/99/37/1342529937.db2.gz	QSTSUONTKDKXKY-HNNXBMFYSA-N	0	3	329.469	3.457	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cnn(C3CCCC3)c2C)C1	ZINC001034483328	1342540537	/nfs/dbraw/zinc/54/05/37/1342540537.db2.gz	LAYQKMVGZSCKDQ-KRWDZBQOSA-N	0	3	344.503	3.467	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cnn(CCC)c2C2CC2)C1	ZINC001034483971	1342541868	/nfs/dbraw/zinc/54/18/68/1342541868.db2.gz	OXOMQFWTBJSWIW-KRWDZBQOSA-N	0	3	344.503	3.331	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCCN(Cc3cccc(C)c3)C2)cn1	ZINC001034494146	1342550319	/nfs/dbraw/zinc/55/03/19/1342550319.db2.gz	UNGZSJNYCSCTIH-OAQYLSRUSA-N	0	3	347.462	3.156	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cnn(CC(C)C)c2C)C1	ZINC001034505573	1342564027	/nfs/dbraw/zinc/56/40/27/1342564027.db2.gz	CFGBRWANXRAGBU-QGZVFWFLSA-N	0	3	332.492	3.008	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2c(C)nn(CC)c2Cl)C1	ZINC001034530472	1342586703	/nfs/dbraw/zinc/58/67/03/1342586703.db2.gz	DCRIPUTZYFZZST-AWEZNQCLSA-N	0	3	338.883	3.025	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cnn(C(C)(C)C)c2CC)C1	ZINC001034534278	1342589650	/nfs/dbraw/zinc/58/96/50/1342589650.db2.gz	FITOBOHYIYLRLG-INIZCTEOSA-N	0	3	346.519	3.361	20	30		EGEDHN
N#Cc1ccc(F)cc1CN[C@H]1CC[C@H](NC(=O)C2CCCC2)CC1	ZINC001034579649	1342625827	/nfs/dbraw/zinc/62/58/27/1342625827.db2.gz	AVVQTOPBIGQYNW-WGSAOQKQSA-N	0	3	343.446	3.405	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)C2CCCC2)CC1	ZINC001034580285	1342626598	/nfs/dbraw/zinc/62/65/98/1342626598.db2.gz	IMRXKEOEFHNPTA-HDJSIYSDSA-N	0	3	329.282	3.102	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1CC[C@H](NC(=O)CC2CCC2)CC1	ZINC001034613849	1342648497	/nfs/dbraw/zinc/64/84/97/1342648497.db2.gz	DEMDFROTYOMTBU-WGSAOQKQSA-N	0	3	325.456	3.265	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1CC[C@H](NC(=O)C2(C3CC3)CC2)CC1	ZINC001034666271	1342679698	/nfs/dbraw/zinc/67/96/98/1342679698.db2.gz	WDRHFSRBULMAGM-WGSAOQKQSA-N	0	3	337.467	3.265	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)C2(C)CCC2)CC1	ZINC001034709926	1342706100	/nfs/dbraw/zinc/70/61/00/1342706100.db2.gz	TYAACBMMSJFKIM-JOCQHMNTSA-N	0	3	329.282	3.102	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1CC[C@H](NC(=O)[C@H]2CC23CCC3)CC1	ZINC001034748321	1342736049	/nfs/dbraw/zinc/73/60/49/1342736049.db2.gz	ZQDCUVVFVNJBSO-GUDVDZBRSA-N	0	3	337.467	3.265	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)c2ccccc2)s1	ZINC001034845991	1342798699	/nfs/dbraw/zinc/79/86/99/1342798699.db2.gz	UVOOOAHMQNRONV-OAHLLOKOSA-N	0	3	325.437	3.014	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2ccc(C3CC3)cn2)C12CCC2	ZINC001078798590	1357090850	/nfs/dbraw/zinc/09/08/50/1357090850.db2.gz	QUFUEGKSTBEHNY-SJORKVTESA-N	0	3	345.874	3.342	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)s1)C1CCC1	ZINC001034972887	1342858815	/nfs/dbraw/zinc/85/88/15/1342858815.db2.gz	GFLGONFSUMMOJR-UKRRQHHQSA-N	0	3	331.485	3.137	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N1CCC2(CCN(Cc3ccc(C#N)s3)C2)CC1	ZINC001035156161	1342972830	/nfs/dbraw/zinc/97/28/30/1342972830.db2.gz	JIUABBTWRLDEQJ-YOEHRIQHSA-N	0	3	343.496	3.090	20	30		EGEDHN
CC(C)C(=O)N1CCC2(CCN(Cc3ccc(C#N)s3)C2)CC1	ZINC001035158877	1342975730	/nfs/dbraw/zinc/97/57/30/1342975730.db2.gz	SZEDAAXRFXTKOI-UHFFFAOYSA-N	0	3	331.485	3.090	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccnc(C3CC3)c1)CC2	ZINC001035743860	1343165161	/nfs/dbraw/zinc/16/51/61/1343165161.db2.gz	SEACEMGANQXMTF-UHFFFAOYSA-N	0	3	325.456	3.073	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@@H]1[C@@H](C=C(C)C)C1(C)C)CC2	ZINC001035747082	1343167095	/nfs/dbraw/zinc/16/70/95/1343167095.db2.gz	JHYXIKZOSYLABO-MSOLQXFVSA-N	0	3	328.500	3.173	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1[nH]c3ccc(C)cc3c1C)CC2	ZINC001035826664	1343216369	/nfs/dbraw/zinc/21/63/69/1343216369.db2.gz	TVOWOGQLSSGGSV-UHFFFAOYSA-N	0	3	349.478	3.346	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1c(F)cccc1Cl)CC2	ZINC001035840532	1343223040	/nfs/dbraw/zinc/22/30/40/1343223040.db2.gz	LQVFKZPVZJZJJU-UHFFFAOYSA-N	0	3	334.822	3.040	20	30		EGEDHN
C[C@@H]1CN(C(=O)/C=C/c2ccco2)CC[C@@H]1NCc1ccccc1C#N	ZINC001035903148	1343260445	/nfs/dbraw/zinc/26/04/45/1343260445.db2.gz	BDMVMTIXYPGBRW-QBWPFYJZSA-N	0	3	349.434	3.191	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](NCc3cc(C4CC4)no3)[C@@H](C)C2)C1	ZINC001036171392	1343344129	/nfs/dbraw/zinc/34/41/29/1343344129.db2.gz	XHQPSVXXRFFBQB-YOEHRIQHSA-N	0	3	343.471	3.235	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3nc(C)oc3C)[C@H](C)C2)CC1	ZINC001036176067	1343347578	/nfs/dbraw/zinc/34/75/78/1343347578.db2.gz	VOSHVKBXCSKXST-KDOFPFPSSA-N	0	3	345.487	3.364	20	30		EGEDHN
C[C@H]1CN(C(=O)C(C)(C)C)CC[C@@H]1NCc1cc(F)ccc1C#N	ZINC001036274381	1343391244	/nfs/dbraw/zinc/39/12/44/1343391244.db2.gz	WOTMFQHQHUOOFQ-GUYCJALGSA-N	0	3	331.435	3.070	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@@H]([C@@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001036338474	1343423718	/nfs/dbraw/zinc/42/37/18/1343423718.db2.gz	LOFVMCXESKHWAS-NVXWUHKLSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@@H]([C@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001036339580	1343425379	/nfs/dbraw/zinc/42/53/79/1343425379.db2.gz	GHAINXSZQJNCJW-DOTOQJQBSA-N	0	3	343.446	3.380	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCCN(C(=O)C(C)(C)F)C1	ZINC001036359291	1343441153	/nfs/dbraw/zinc/44/11/53/1343441153.db2.gz	XHGJVUIBFXNDMM-WMLDXEAASA-N	0	3	331.435	3.023	20	30		EGEDHN
C[C@@H](NCc1cc(F)ccc1C#N)[C@@H]1CCCN(C(=O)C2(C)CC2)C1	ZINC001036408380	1343468978	/nfs/dbraw/zinc/46/89/78/1343468978.db2.gz	IMIGKEMFFHYRAP-GDBMZVCRSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]([C@@H](C)NCc2nc(C)oc2C)C1	ZINC001036426038	1343478983	/nfs/dbraw/zinc/47/89/83/1343478983.db2.gz	CXSMYYYNPFSMAU-CJNGLKHVSA-N	0	3	333.476	3.220	20	30		EGEDHN
C/C(=C\C(=O)N1CC[C@@H]2[C@@H](CCN2CC#Cc2ccccc2)C1)C1CC1	ZINC001036659478	1343605557	/nfs/dbraw/zinc/60/55/57/1343605557.db2.gz	ZSDWERSNUWKANO-UJBPIODHSA-N	0	3	348.490	3.317	20	30		EGEDHN
CCC1(C(=O)N2CC[C@@H]3[C@H](CCN3Cc3ccc(C#N)s3)C2)CC1	ZINC001036814088	1343750838	/nfs/dbraw/zinc/75/08/38/1343750838.db2.gz	IXYHUVIXTDECBN-RHSMWYFYSA-N	0	3	343.496	3.233	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]3[C@@H](CCN3Cc3oc(C)nc3C)C2)C1	ZINC001036815957	1343753477	/nfs/dbraw/zinc/75/34/77/1343753477.db2.gz	NQSKAXQXTDSNDS-IRXDYDNUSA-N	0	3	343.471	3.071	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001036875910	1343814863	/nfs/dbraw/zinc/81/48/63/1343814863.db2.gz	IDEMQHKSSFCKDT-XJKSGUPXSA-N	0	3	331.485	3.089	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCC[C@@H]1NC(=O)Cc1ccccc1	ZINC001037031658	1343940121	/nfs/dbraw/zinc/94/01/21/1343940121.db2.gz	NFXUFJVFUOPGKW-SFTDATJTSA-N	0	3	347.462	3.175	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCC[C@@H]1NC(=O)C=C1CCC1	ZINC001037200080	1344037362	/nfs/dbraw/zinc/03/73/62/1344037362.db2.gz	ZCMJOTOAWZGDHR-UXHICEINSA-N	0	3	337.467	3.433	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCC[C@H]2CNCc2cscn2)C1	ZINC001037239416	1344061798	/nfs/dbraw/zinc/06/17/98/1344061798.db2.gz	GJRKATXXLWEZGY-GOEBONIOSA-N	0	3	333.501	3.264	20	30		EGEDHN
C/C=C(/C)C(=O)N1CC[C@H](NCc2cc(F)ccc2C#N)[C@H](CC)C1	ZINC001037822110	1344118678	/nfs/dbraw/zinc/11/86/78/1344118678.db2.gz	MSZPZRZZIFBXNS-RTEFYLRESA-N	0	3	343.446	3.380	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](NCc2cscn2)[C@H](CC)C1	ZINC001037894424	1344165973	/nfs/dbraw/zinc/16/59/73/1344165973.db2.gz	YZMSRPQBTIZCHJ-GDBMZVCRSA-N	0	3	335.517	3.462	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](NCc2cc(C)n(C)n2)[C@@H](CC)C1	ZINC001037902777	1344168047	/nfs/dbraw/zinc/16/80/47/1344168047.db2.gz	GXTQSQUPZVSTQE-WMZOPIPTSA-N	0	3	346.519	3.048	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NC[C@H]1CCN1CC1CC(C)(C)C1	ZINC001038427543	1344424718	/nfs/dbraw/zinc/42/47/18/1344424718.db2.gz	JMXFOSTUNJUBAQ-QGZVFWFLSA-N	0	3	342.483	3.492	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1ccccc1OCC(C)C	ZINC001038818079	1344596005	/nfs/dbraw/zinc/59/60/05/1344596005.db2.gz	LVTFAMPHRULDQS-KRWDZBQOSA-N	0	3	330.472	3.492	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1cnn(C2CCCC2)c1C	ZINC001038901661	1344641802	/nfs/dbraw/zinc/64/18/02/1344641802.db2.gz	WMBKTLCJNBKJDF-KRWDZBQOSA-N	0	3	330.476	3.077	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2sccc2C)C[C@H]1c1cccc(F)c1	ZINC001079166383	1357198959	/nfs/dbraw/zinc/19/89/59/1357198959.db2.gz	GXVZMBYZVIQDOT-DLBZAZTESA-N	0	3	342.439	3.027	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)CC(F)(F)F)CC2)C1	ZINC001039118696	1344791738	/nfs/dbraw/zinc/79/17/38/1344791738.db2.gz	DIVHLNGBPUANLB-CYBMUJFWSA-N	0	3	338.801	3.252	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)c3cccnc3C)CC2)C1	ZINC001039154693	1344839304	/nfs/dbraw/zinc/83/93/04/1344839304.db2.gz	FGIQKBPVKCSSEX-KRWDZBQOSA-N	0	3	347.890	3.317	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2sccc2F)C1	ZINC001039200153	1344909950	/nfs/dbraw/zinc/90/99/50/1344909950.db2.gz	HCPZLRDYBZJGOD-HOCLYGCPSA-N	0	3	334.460	3.227	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2sccc2Cl)C1	ZINC001039212986	1344927961	/nfs/dbraw/zinc/92/79/61/1344927961.db2.gz	ZJIQDJIIPKDVJC-UKRRQHHQSA-N	0	3	336.888	3.351	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)CCc2ccsc2)C1	ZINC001039213808	1344928818	/nfs/dbraw/zinc/92/88/18/1344928818.db2.gz	LZQJLWXFTYBXCH-MSOLQXFVSA-N	0	3	330.497	3.017	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc(C(C)C)on2)C1	ZINC001039226204	1344944295	/nfs/dbraw/zinc/94/42/95/1344944295.db2.gz	STNYMSKDZNPRQJ-FUHWJXTLSA-N	0	3	343.471	3.138	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ncc(C)cc2C)C1	ZINC001039228641	1344948742	/nfs/dbraw/zinc/94/87/42/1344948742.db2.gz	KIRFEFMDUUILKF-OALUTQOASA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc(C)c(C)s2)C1	ZINC001039238504	1344962424	/nfs/dbraw/zinc/96/24/24/1344962424.db2.gz	IQHRMAVPGGBZSS-IAGOWNOFSA-N	0	3	330.497	3.315	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)CCc2ccccc2C)C1	ZINC001039238298	1344962617	/nfs/dbraw/zinc/96/26/17/1344962617.db2.gz	NBJIKZPXHCPHDP-SFTDATJTSA-N	0	3	338.495	3.264	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)Cc2cccc(F)c2)C1	ZINC001039240324	1344964641	/nfs/dbraw/zinc/96/46/41/1344964641.db2.gz	UAEDUUCFVSLKKM-ICSRJNTNSA-N	0	3	342.458	3.095	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)CCc2ccccc2F)C1	ZINC001039240489	1344965781	/nfs/dbraw/zinc/96/57/81/1344965781.db2.gz	UWQBAQASGHUNGA-AZUAARDMSA-N	0	3	342.458	3.095	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2sc(C)nc2C)C1	ZINC001039250522	1344981036	/nfs/dbraw/zinc/98/10/36/1344981036.db2.gz	OQHUGLGDPYVRMU-IRXDYDNUSA-N	0	3	345.512	3.100	20	30		EGEDHN
Cc1cc(C)cc(CN2CC[C@H]3CC[C@@H](C2)N3C(=O)[C@H](C)C#N)c1	ZINC001039342965	1345021763	/nfs/dbraw/zinc/02/17/63/1345021763.db2.gz	BDWZXWFQPJCEAZ-QRQLOZEOSA-N	0	3	325.456	3.028	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1coc2cc(F)ccc12	ZINC001039397730	1345045815	/nfs/dbraw/zinc/04/58/15/1345045815.db2.gz	XJPRDJIJOKWLHP-CVEARBPZSA-N	0	3	340.398	3.274	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C1([C@@H]2CCCCO2)CCC1	ZINC001039403648	1345049767	/nfs/dbraw/zinc/04/97/67/1345049767.db2.gz	HMXMLSOJOCKXNN-QYZOEREBSA-N	0	3	346.515	3.367	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(Cl)cc1C	ZINC001039428528	1345063566	/nfs/dbraw/zinc/06/35/66/1345063566.db2.gz	QGBXDZWPYKAQDS-SJORKVTESA-N	0	3	330.859	3.351	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(C(C)C)cn1	ZINC001039437363	1345066894	/nfs/dbraw/zinc/06/68/94/1345066894.db2.gz	IHSXIRSUEZYCPL-MSOLQXFVSA-N	0	3	327.472	3.460	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)Oc1ccc(F)cc1	ZINC001039468128	1345085961	/nfs/dbraw/zinc/08/59/61/1345085961.db2.gz	VNLNDTVNDHEENE-JQHSSLGASA-N	0	3	346.446	3.234	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@H](C)n1nc(C)cc1C	ZINC001039471058	1345087153	/nfs/dbraw/zinc/08/71/53/1345087153.db2.gz	FNGHROCQNUNSFV-OTWHNJEPSA-N	0	3	344.503	3.092	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](OC)c1ccc(F)cc1	ZINC001039476024	1345090766	/nfs/dbraw/zinc/09/07/66/1345090766.db2.gz	VYQCYPOSOBSIJO-CEXWTWQISA-N	0	3	346.446	3.155	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](OC)C1CCCCC1	ZINC001039478088	1345092678	/nfs/dbraw/zinc/09/26/78/1345092678.db2.gz	XITAOAAHNCFQKF-QYZOEREBSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC[C@@H]1CCOC1	ZINC001039896622	1345238804	/nfs/dbraw/zinc/23/88/04/1345238804.db2.gz	NSLOSXDBPGHCPA-FTEYMNFISA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC1CCOCC1	ZINC001039897105	1345239499	/nfs/dbraw/zinc/23/94/99/1345239499.db2.gz	UKJDMIURASHSFA-WSTZPKSXSA-N	0	3	334.504	3.081	20	30		EGEDHN
C#CCOc1ccc(C(=O)N2C[C@H]3CCC[C@@H](C2)N3CCCC)cc1	ZINC001039940205	1345253790	/nfs/dbraw/zinc/25/37/90/1345253790.db2.gz	JVXMUZQKRQKLNJ-KDURUIRLSA-N	0	3	340.467	3.178	20	30		EGEDHN
CC(C)(F)C(=O)N1CC[C@]2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001040037534	1345302813	/nfs/dbraw/zinc/30/28/13/1345302813.db2.gz	AVMKQDZWRMHOHU-HXUWFJFHSA-N	0	3	343.446	3.121	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CC[C@]2(C1)CCCN(Cc1cccc(C#N)c1)C2	ZINC001040085581	1345330073	/nfs/dbraw/zinc/33/00/73/1345330073.db2.gz	ZKSUBRNCFSPVNL-DYESRHJHSA-N	0	3	339.483	3.419	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cn(C(C)(C)C)nc3C)C2)C1	ZINC001040200046	1345372444	/nfs/dbraw/zinc/37/24/44/1345372444.db2.gz	FHJKPVVDXOZROR-HXUWFJFHSA-N	0	3	344.503	3.061	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3oc(CC4CC4)nc3C)C2)C1	ZINC001040202980	1345374441	/nfs/dbraw/zinc/37/44/41/1345374441.db2.gz	VCJXSQXBHFWEMF-HXUWFJFHSA-N	0	3	343.471	3.050	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3ccc4nccc(C)c4c3)C2)C1	ZINC001040220527	1345380413	/nfs/dbraw/zinc/38/04/13/1345380413.db2.gz	KCIAUINIUMPIJT-JOCHJYFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)C[C@H]3CCC(F)(F)C3)C2)C1	ZINC001040233113	1345387625	/nfs/dbraw/zinc/38/76/25/1345387625.db2.gz	WTDNJGXEIJIPCU-AEFFLSMTSA-N	0	3	338.442	3.150	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3ccc4nc(C)oc4c3)C2)C1	ZINC001040252676	1345395808	/nfs/dbraw/zinc/39/58/08/1345395808.db2.gz	IDLVFUXZSSZNTO-FQEVSTJZSA-N	0	3	339.439	3.250	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1CC[C@]2(C1)CCCN(CC=C)C2	ZINC001040265870	1345403378	/nfs/dbraw/zinc/40/33/78/1345403378.db2.gz	GRQSYCCUWCPNOW-OAQYLSRUSA-N	0	3	340.467	3.366	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3c(F)cc(C)cc3F)C2)C1	ZINC001040288416	1345412955	/nfs/dbraw/zinc/41/29/55/1345412955.db2.gz	CRIILXAHCHNJKL-FQEVSTJZSA-N	0	3	346.421	3.225	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)Cc3cccc(C(F)F)c3)C2)C1	ZINC001040289042	1345413790	/nfs/dbraw/zinc/41/37/90/1345413790.db2.gz	ATUWVHNTIVNOBB-HXUWFJFHSA-N	0	3	346.421	3.114	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@H]3[C@@H]4CCCCCC[C@@H]43)C2)C1	ZINC001040418170	1345486465	/nfs/dbraw/zinc/48/64/65/1345486465.db2.gz	MJJINWXHTNAFJC-PXCRPINLSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ccc(Cl)c(F)c3)C2)C1	ZINC001040419857	1345487278	/nfs/dbraw/zinc/48/72/78/1345487278.db2.gz	YZHOMRHZWWXGKR-IBGZPJMESA-N	0	3	348.849	3.431	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cnc(C)nc3C(C)C)C2)C1	ZINC001040432636	1345495865	/nfs/dbraw/zinc/49/58/65/1345495865.db2.gz	OSBVVUQCUNQEGM-FQEVSTJZSA-N	0	3	342.487	3.023	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@@H](C)c3ccc(C)cc3)C2)C1	ZINC001040496017	1345520654	/nfs/dbraw/zinc/52/06/54/1345520654.db2.gz	CYCYZCARKVLZJV-UGKGYDQZSA-N	0	3	338.495	3.436	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ccc(C(F)F)o3)C2)C1	ZINC001040511733	1345527083	/nfs/dbraw/zinc/52/70/83/1345527083.db2.gz	ACCDJJPLJYTPRQ-SFHVURJKSA-N	0	3	336.382	3.169	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)Cc3ccc(Cl)cc3)C2)C1	ZINC001040513479	1345527466	/nfs/dbraw/zinc/52/74/66/1345527466.db2.gz	MUYOBOODACGYPN-FQEVSTJZSA-N	0	3	344.886	3.220	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@]3(C)CCC(C)=C(C)C3)C2)C1	ZINC001040548046	1345541862	/nfs/dbraw/zinc/54/18/62/1345541862.db2.gz	PFNLYEMGMZAYLW-NHCUHLMSSA-N	0	3	328.500	3.461	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3csc(C4CC4)n3)C2)C1	ZINC001040552261	1345544400	/nfs/dbraw/zinc/54/44/00/1345544400.db2.gz	ZQZOSDZILJADNP-GOSISDBHSA-N	0	3	331.485	3.135	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cnc(C(C)C)s3)C2)C1	ZINC001040557001	1345545712	/nfs/dbraw/zinc/54/57/12/1345545712.db2.gz	UTCMBDUROUFTRI-GOSISDBHSA-N	0	3	333.501	3.381	20	30		EGEDHN
CC(F)(F)C(=O)N1CCC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001040577535	1345548611	/nfs/dbraw/zinc/54/86/11/1345548611.db2.gz	WFAOOCSZUNTAAM-UHFFFAOYSA-N	0	3	347.409	3.028	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3c(C)noc3C(C)C)C2)CC1	ZINC001040735276	1345572210	/nfs/dbraw/zinc/57/22/10/1345572210.db2.gz	MLQZDADTHAMQJC-UHFFFAOYSA-N	0	3	343.471	3.058	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cc(C)c(F)cc3F)C2)CC1	ZINC001040740210	1345572653	/nfs/dbraw/zinc/57/26/53/1345572653.db2.gz	GQJJNPYDIFYXLF-UHFFFAOYSA-N	0	3	346.421	3.225	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)Cc3ccc(C(F)F)cc3)C2)CC1	ZINC001040771744	1345577453	/nfs/dbraw/zinc/57/74/53/1345577453.db2.gz	PSINTMFGFSMDKM-UHFFFAOYSA-N	0	3	346.421	3.114	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccc4ncccc4c3)C2)CC1	ZINC001040828308	1345583938	/nfs/dbraw/zinc/58/39/38/1345583938.db2.gz	IODZAUXJAFEMFZ-UHFFFAOYSA-N	0	3	347.462	3.186	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC2(C1)CCN(Cc1cccnc1)CC2	ZINC001040830991	1345584025	/nfs/dbraw/zinc/58/40/25/1345584025.db2.gz	QIBXEFNBSSCZRI-HXUWFJFHSA-N	0	3	341.499	3.498	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)Cc3c(C)cc(C)cc3C)C2)CC1	ZINC001040831975	1345584314	/nfs/dbraw/zinc/58/43/14/1345584314.db2.gz	YMQCPWFAAXVXSY-UHFFFAOYSA-N	0	3	338.495	3.102	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cccc(F)c3Cl)C2)CC1	ZINC001040864197	1345589654	/nfs/dbraw/zinc/58/96/54/1345589654.db2.gz	DIRXYLAPSHKUPN-UHFFFAOYSA-N	0	3	334.822	3.040	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cc(C(CC)CC)no3)C2)CC1	ZINC001040876304	1345593170	/nfs/dbraw/zinc/59/31/70/1345593170.db2.gz	PLGUSMSIOTYVKU-UHFFFAOYSA-N	0	3	343.471	3.140	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3csc(C(C)(C)C)n3)C2)CC1	ZINC001040882516	1345594181	/nfs/dbraw/zinc/59/41/81/1345594181.db2.gz	DVUHZOMSOIAFNI-UHFFFAOYSA-N	0	3	345.512	3.002	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccc4ccn(C)c4c3)C2)CC1	ZINC001040906214	1345597409	/nfs/dbraw/zinc/59/74/09/1345597409.db2.gz	CFFRZWMDMXSTBU-UHFFFAOYSA-N	0	3	349.478	3.130	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ncsc3C(C)C)C2)CC1	ZINC001040911609	1345598687	/nfs/dbraw/zinc/59/86/87/1345598687.db2.gz	GGIYJCBLKYDGGX-UHFFFAOYSA-N	0	3	345.512	3.218	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@@H](C)c3ccc(C)s3)C2)CC1	ZINC001040911769	1345598757	/nfs/dbraw/zinc/59/87/57/1345598757.db2.gz	IYOJZBACECWODU-INIZCTEOSA-N	0	3	330.497	3.108	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@@]3(C)CCC(C)=C(C)C3)C2)CC1	ZINC001040950792	1345607390	/nfs/dbraw/zinc/60/73/90/1345607390.db2.gz	CDVBJWSFHYGJSM-FQEVSTJZSA-N	0	3	328.500	3.461	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@]2(CCN(C[C@@H](F)CC)C2)C1	ZINC001041320557	1345701816	/nfs/dbraw/zinc/70/18/16/1345701816.db2.gz	CYMMHDLPENPJOK-WMLDXEAASA-N	0	3	330.875	3.438	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)[C@H]3CC[C@H](C4CCC4)CC3)C2)C1	ZINC001041370979	1345711727	/nfs/dbraw/zinc/71/17/27/1345711727.db2.gz	IKIBASMAJJQEDN-ZJOUEHCJSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)[C@H]3CCCc4ccccc43)C2)C1	ZINC001041406993	1345720359	/nfs/dbraw/zinc/72/03/59/1345720359.db2.gz	FSEWISYTIBCDLO-UNMCSNQZSA-N	0	3	336.479	3.054	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cccc(-n4cccc4)c3)C2)C1	ZINC001041443820	1345729263	/nfs/dbraw/zinc/72/92/63/1345729263.db2.gz	WSWXRLJPFCFCQH-JOCHJYFZSA-N	0	3	347.462	3.039	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)[C@H](C)c3c(F)cccc3F)C2)C1	ZINC001041475116	1345738905	/nfs/dbraw/zinc/73/89/05/1345738905.db2.gz	HWHIARYHVZHQFJ-QRWLVFNGSA-N	0	3	346.421	3.016	20	30		EGEDHN
C[C@@]1(C(=O)N2CC[C@@]3(CCN(Cc4ccc(C#N)cc4)C3)C2)C=CCC1	ZINC001041560141	1345769026	/nfs/dbraw/zinc/76/90/26/1345769026.db2.gz	PFVKLQZSQLLWLE-FGZHOGPDSA-N	0	3	349.478	3.339	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@]2(CCN(Cc3cnccc3C)C2)C1	ZINC001041625705	1345800142	/nfs/dbraw/zinc/80/01/42/1345800142.db2.gz	KKWIUZRNPHJRCU-RTWAWAEBSA-N	0	3	341.499	3.417	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@]2(CCN(Cc3cccnc3)C2)C1	ZINC001041627070	1345801161	/nfs/dbraw/zinc/80/11/61/1345801161.db2.gz	ZSYZZKBDGLERTJ-PMACEKPBSA-N	0	3	327.472	3.108	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@]2(CCN(Cc3scnc3C)C2)C1	ZINC001041626424	1345801225	/nfs/dbraw/zinc/80/12/25/1345801225.db2.gz	SJRUAKSHGZFXDY-RBUKOAKNSA-N	0	3	347.528	3.478	20	30		EGEDHN
CC1(C(=O)N2CC[C@]3(CCN(Cc4ccc(C#N)cc4)C3)C2)CC=CC1	ZINC001041632590	1345802824	/nfs/dbraw/zinc/80/28/24/1345802824.db2.gz	KUJABUHQDZEROY-QFIPXVFZSA-N	0	3	349.478	3.339	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@]3(CCN(Cc4ccccn4)C3)C2)CC1	ZINC001041634264	1345803996	/nfs/dbraw/zinc/80/39/96/1345803996.db2.gz	CAVCOVYOBCDULH-NRFANRHFSA-N	0	3	339.483	3.252	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@]3(CCN(Cc4cccnc4C)C3)C2)C1	ZINC001041653420	1345812048	/nfs/dbraw/zinc/81/20/48/1345812048.db2.gz	RSWNVUNLWXXPSF-NRFANRHFSA-N	0	3	339.483	3.171	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)C[C@H](C)c3cccc(F)c3)C2)C1	ZINC001041660305	1345814430	/nfs/dbraw/zinc/81/44/30/1345814430.db2.gz	NMJCTIKPWUNGSA-LAUBAEHRSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3ccc(Cl)c(CCC)c3)C2)C1	ZINC001041783406	1345848773	/nfs/dbraw/zinc/84/87/73/1345848773.db2.gz	HFNGJZDGBUHMHI-HXUWFJFHSA-N	0	3	344.886	3.464	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)Cc3cccc4ccccc43)C2)C1	ZINC001041800730	1345854994	/nfs/dbraw/zinc/85/49/94/1345854994.db2.gz	XBOBCAHWZKKBSH-QHCPKHFHSA-N	0	3	346.474	3.330	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3csc4c3CC[C@@H](C)C4)C2)C1	ZINC001041816319	1345861280	/nfs/dbraw/zinc/86/12/80/1345861280.db2.gz	MQSDSPAIEJXDHU-FOIQADDNSA-N	0	3	342.508	3.044	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)[C@@H](C)Cc3cccc(Cl)c3)C2)C1	ZINC001041856007	1345875016	/nfs/dbraw/zinc/87/50/16/1345875016.db2.gz	WAHOSPMBOHRPDL-JXFKEZNVSA-N	0	3	344.886	3.076	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc4nccc(C)c4c3)C[C@@H]21	ZINC001042077893	1345939180	/nfs/dbraw/zinc/93/91/80/1345939180.db2.gz	QWUGILWPRQJYIP-UTKZUKDTSA-N	0	3	347.462	3.103	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3nc(C(C)(C)C)cs3)C[C@@H]21	ZINC001042102999	1345944727	/nfs/dbraw/zinc/94/47/27/1345944727.db2.gz	QTFUXSFQTJGEFG-CABCVRRESA-N	0	3	345.512	3.000	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(F)cc4ccoc43)C[C@H]21	ZINC001042121454	1345949728	/nfs/dbraw/zinc/94/97/28/1345949728.db2.gz	HGTCASVTRNLRAF-SUMWQHHRSA-N	0	3	328.387	3.294	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(F)cc4ccoc43)C[C@@H]21	ZINC001042121453	1345949888	/nfs/dbraw/zinc/94/98/88/1345949888.db2.gz	HGTCASVTRNLRAF-GUYCJALGSA-N	0	3	328.387	3.294	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)Cc3cccc(C4CC4)c3)C[C@H]21	ZINC001042163364	1345961618	/nfs/dbraw/zinc/96/16/18/1345961618.db2.gz	SITYVZRFPVGGJO-TZIWHRDSSA-N	0	3	336.479	3.053	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cc4ccc(C)cc4[nH]3)C[C@H]21	ZINC001042168008	1345963782	/nfs/dbraw/zinc/96/37/82/1345963782.db2.gz	QPKJYEQFOCTXLY-OXJNMPFZSA-N	0	3	335.451	3.036	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3sccc3-n3cccc3)C[C@@H]21	ZINC001042175240	1345966424	/nfs/dbraw/zinc/96/64/24/1345966424.db2.gz	AHIJWJUPNFLASZ-RDJZCZTQSA-N	0	3	341.480	3.261	20	30		EGEDHN
CC1(C(=O)N2CC[C@@H]3CCN(Cc4cccc(C#N)c4)[C@@H]3C2)CCC1	ZINC001042182992	1345970999	/nfs/dbraw/zinc/97/09/99/1345970999.db2.gz	HQYDDRCQOXPNLA-RBUKOAKNSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@H]2C1	ZINC001042188631	1345975730	/nfs/dbraw/zinc/97/57/30/1345975730.db2.gz	VNAXGLJMIPASMJ-OALUTQOASA-N	0	3	337.467	3.193	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(Cl)cc3OC)C[C@@H]21	ZINC001042206189	1345984044	/nfs/dbraw/zinc/98/40/44/1345984044.db2.gz	DAKHXBVXDNXRRO-BBRMVZONSA-N	0	3	334.847	3.071	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(F)c(Cl)cc3F)C[C@@H]21	ZINC001042207775	1345986166	/nfs/dbraw/zinc/98/61/66/1345986166.db2.gz	UCOHLNZKOIFMRM-BZNIZROVSA-N	0	3	340.801	3.341	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3cccc(C#N)c3)[C@@H]2C1	ZINC001042209066	1345987121	/nfs/dbraw/zinc/98/71/21/1345987121.db2.gz	WXLOHNIIJQCLLH-RTBURBONSA-N	0	3	339.483	3.417	20	30		EGEDHN
CC(F)(F)CC(=O)N1CC[C@H]2CCN(Cc3ccc(C#N)cc3)[C@@H]2C1	ZINC001042218386	1345990862	/nfs/dbraw/zinc/99/08/62/1345990862.db2.gz	JDBLKLXZKSHIMC-IAGOWNOFSA-N	0	3	347.409	3.026	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3ccc(C)c(F)c3F)C[C@@H]21	ZINC001042240238	1346000313	/nfs/dbraw/zinc/00/03/13/1346000313.db2.gz	KOEAPGFQNNWBSP-ZBFHGGJFSA-N	0	3	334.410	3.386	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3scnc3C(C)C)C[C@H]21	ZINC001042263944	1346010884	/nfs/dbraw/zinc/01/08/84/1346010884.db2.gz	ZRIVRBGLTXUGSE-LSDHHAIUSA-N	0	3	333.501	3.379	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ncoc3-c3cccs3)C[C@H]21	ZINC001042271980	1346014536	/nfs/dbraw/zinc/01/45/36/1346014536.db2.gz	JKQBNLCGZZESPM-UONOGXRCSA-N	0	3	343.452	3.126	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3coc(C4CCCC4)n3)C[C@H]21	ZINC001042294618	1346020302	/nfs/dbraw/zinc/02/03/02/1346020302.db2.gz	ODJSZYZRNDSARS-MAUKXSAKSA-N	0	3	343.471	3.445	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C(C)(C)Cc3ccccc3)C[C@H]21	ZINC001042305244	1346025450	/nfs/dbraw/zinc/02/54/50/1346025450.db2.gz	XPKVFMBXZJBUJG-RBUKOAKNSA-N	0	3	326.484	3.364	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3ccc(C#N)cc3)[C@H]2C1	ZINC001042324992	1346033652	/nfs/dbraw/zinc/03/36/52/1346033652.db2.gz	YHYUCWWDGASKPV-MSOLQXFVSA-N	0	3	325.456	3.027	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@]3(c4ccccc4)C[C@H](F)C3)C[C@H]21	ZINC001042326963	1346036007	/nfs/dbraw/zinc/03/60/07/1346036007.db2.gz	STPWQNNVTFZCRV-XLBJILASSA-N	0	3	342.458	3.165	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3cc4[nH]ccc4s3)C[C@H]21	ZINC001042327339	1346036409	/nfs/dbraw/zinc/03/64/09/1346036409.db2.gz	WGWFWRPOCJDZAZ-UKRRQHHQSA-N	0	3	329.469	3.342	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)COc3c(C)cc(C)cc3C)C[C@@H]21	ZINC001042331905	1346039380	/nfs/dbraw/zinc/03/93/80/1346039380.db2.gz	GBVWQOFYVVYUKC-OALUTQOASA-N	0	3	342.483	3.099	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(C)nc4ccccc43)C[C@@H]21	ZINC001042338916	1346043224	/nfs/dbraw/zinc/04/32/24/1346043224.db2.gz	NYJRSFOTMMIMGD-UZLBHIALSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(F)c(F)cc3Cl)C[C@H]21	ZINC001042338937	1346043464	/nfs/dbraw/zinc/04/34/64/1346043464.db2.gz	OEJGEGWEWSTEHA-BDJLRTHQSA-N	0	3	340.801	3.341	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3cc4c(s3)CCCC4)C[C@H]21	ZINC001042338729	1346043680	/nfs/dbraw/zinc/04/36/80/1346043680.db2.gz	LVHMHBFUNCEERS-DOTOQJQBSA-N	0	3	342.508	3.187	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cccc4ccccc43)C[C@@H]21	ZINC001042339802	1346044733	/nfs/dbraw/zinc/04/47/33/1346044733.db2.gz	BMKOEBGYVBOCOH-NQIIRXRSSA-N	0	3	332.447	3.400	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cc(C)c(F)c(C)c3)C[C@H]21	ZINC001042359628	1346054353	/nfs/dbraw/zinc/05/43/53/1346054353.db2.gz	FSMYIVRABJUAAF-SJLPKXTDSA-N	0	3	328.431	3.002	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@@H](NCc2cc(F)ccc2C#N)C[C@H]1C	ZINC001044423473	1346325240	/nfs/dbraw/zinc/32/52/40/1346325240.db2.gz	WNYINTDXSJPGHR-RDTXWAMCSA-N	0	3	331.435	3.213	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)c2cccs2)s1	ZINC001044908556	1346460543	/nfs/dbraw/zinc/46/05/43/1346460543.db2.gz	UOUVZEFYFGTKQN-LBPRGKRZSA-N	0	3	331.466	3.076	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)c2ccsc2)cc1F	ZINC001044911529	1346461433	/nfs/dbraw/zinc/46/14/33/1346461433.db2.gz	TZMWVOCVWJZLDY-INIZCTEOSA-N	0	3	343.427	3.153	20	30		EGEDHN
CC(C)(C(=O)N1CCC[C@H]1CNCc1ccc(C#N)c(F)c1)C1CC1	ZINC001045162397	1346511010	/nfs/dbraw/zinc/51/10/10/1346511010.db2.gz	FADOIFWTZGWXDQ-KRWDZBQOSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C[C@@H](C(=O)N1CCC[C@H]1CNCc1cncs1)c1ccccc1	ZINC001045319556	1346558537	/nfs/dbraw/zinc/55/85/37/1346558537.db2.gz	FFOVKPGGGUOWCA-FUHWJXTLSA-N	0	3	341.480	3.194	20	30		EGEDHN
C=C[C@@H](C(=O)N1CCC[C@H]1CNCc1ccns1)c1ccccc1	ZINC001045319281	1346558545	/nfs/dbraw/zinc/55/85/45/1346558545.db2.gz	AOJWHCXHBFDKIK-FUHWJXTLSA-N	0	3	341.480	3.194	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2cnc(-c3ccccc3)o2)CC1	ZINC001045468798	1346601270	/nfs/dbraw/zinc/60/12/70/1346601270.db2.gz	LZYAAEDJOCDDHP-UHFFFAOYSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2ccc(OCC(C)C)cc2)CC1	ZINC001045634821	1346654544	/nfs/dbraw/zinc/65/45/44/1346654544.db2.gz	FKPPXIGGJUYRCW-UHFFFAOYSA-N	0	3	330.472	3.492	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1ccc(C)nc1C	ZINC001045827982	1346710645	/nfs/dbraw/zinc/71/06/45/1346710645.db2.gz	YWAGWSHOGWEJTN-MOPGFXCFSA-N	0	3	341.499	3.476	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H]2CC[C@@H](C1)N2CCc1ccns1	ZINC001045840768	1346716295	/nfs/dbraw/zinc/71/62/95/1346716295.db2.gz	NSZKNPCOIGFXTK-JTDSTZFVSA-N	0	3	347.528	3.353	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]3CC[C@@H](C2)N3CCc2ccns2)C1	ZINC001045843696	1346718228	/nfs/dbraw/zinc/71/82/28/1346718228.db2.gz	PCRSKRIVNMPASI-CVEARBPZSA-N	0	3	345.512	3.107	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@H]1CCCC3(CC3)C1)C2	ZINC001045942596	1346778675	/nfs/dbraw/zinc/77/86/75/1346778675.db2.gz	VTUFHPXAZGEIHR-GHTZIAJQSA-N	0	3	328.500	3.295	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)C13CCC(CC1)C3)C2	ZINC001045949177	1346783895	/nfs/dbraw/zinc/78/38/95/1346783895.db2.gz	ZHOLJFMDDQREDA-VEDCXYSMSA-N	0	3	328.500	3.295	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H]1CCCCC1(F)F)C2	ZINC001045954872	1346789791	/nfs/dbraw/zinc/78/97/91/1346789791.db2.gz	JOFZAOJHNGZZOC-WMZOPIPTSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)Cc1cc(C)cc(C)c1)C2	ZINC001045962254	1346797767	/nfs/dbraw/zinc/79/77/67/1346797767.db2.gz	FWXYOOYMFIBQSF-QFIPXVFZSA-N	0	3	338.495	3.184	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)C1CCC(F)CC1)C2	ZINC001045965493	1346800392	/nfs/dbraw/zinc/80/03/92/1346800392.db2.gz	VEBAGAWDMKYROQ-QLOJAFMTSA-N	0	3	334.479	3.243	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@H]1CCCC(F)(F)C1)C2	ZINC001045965365	1346800622	/nfs/dbraw/zinc/80/06/22/1346800622.db2.gz	GNQXSAGRNIVNMW-FUHWJXTLSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc(C)cc(F)c1)C2	ZINC001045969025	1346803770	/nfs/dbraw/zinc/80/37/70/1346803770.db2.gz	XNHNAGUJRZSUKN-NRFANRHFSA-N	0	3	342.458	3.476	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1oc(C(C)C)nc1C)C2	ZINC001045972879	1346809081	/nfs/dbraw/zinc/80/90/81/1346809081.db2.gz	JQKPNSGCQOGXOI-FQEVSTJZSA-N	0	3	343.471	3.058	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1csc(C)c1)C2	ZINC001045974758	1346810967	/nfs/dbraw/zinc/81/09/67/1346810967.db2.gz	LARVEQJIMSLRML-IBGZPJMESA-N	0	3	330.497	3.398	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@H]1CC13CCCC3)C2	ZINC001045976153	1346812567	/nfs/dbraw/zinc/81/25/67/1346812567.db2.gz	SBGODJDDOXMAAT-UYAOXDASSA-N	0	3	328.500	3.295	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@H](C)c1ccc(C)cc1)C2	ZINC001045981170	1346819840	/nfs/dbraw/zinc/81/98/40/1346819840.db2.gz	QJUSRCUCTHPBGT-KNQAVFIVSA-N	0	3	338.495	3.436	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)Cc1ccccc1F)C2	ZINC001045982692	1346821891	/nfs/dbraw/zinc/82/18/91/1346821891.db2.gz	DNUZQCYDSVJUGU-OAQYLSRUSA-N	0	3	342.458	3.096	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)CCc1ccc(C)o1)C2	ZINC001045984569	1346825156	/nfs/dbraw/zinc/82/51/56/1346825156.db2.gz	DHVLQUNJOIDTPE-OAQYLSRUSA-N	0	3	342.483	3.249	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H](C)Cc1ccccc1)C2	ZINC001045986648	1346828649	/nfs/dbraw/zinc/82/86/49/1346828649.db2.gz	WXHLOMITWQDTSA-UGKGYDQZSA-N	0	3	338.495	3.203	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1c(C)cccc1F)C2	ZINC001045987498	1346829258	/nfs/dbraw/zinc/82/92/58/1346829258.db2.gz	TYFPTZAMSMBLDY-OAQYLSRUSA-N	0	3	342.458	3.476	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@]2(C)CCN(Cc3cccc(C)c3)C2)cc1	ZINC001046532574	1347006758	/nfs/dbraw/zinc/00/67/58/1347006758.db2.gz	XGRAXYOUUFPZNC-JOCHJYFZSA-N	0	3	332.447	3.371	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@]2(C)CCN(Cc3ccc(C)c(C)c3)C2)cn1	ZINC001046779989	1347096964	/nfs/dbraw/zinc/09/69/64/1347096964.db2.gz	YZICIJUIWHOCPJ-JOCHJYFZSA-N	0	3	347.462	3.074	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2nccc3occc32)C1	ZINC001046957724	1347165281	/nfs/dbraw/zinc/16/52/81/1347165281.db2.gz	ISWOKARJKYBSJN-CYBMUJFWSA-N	0	3	349.381	3.091	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)c3sccc3F)C2)CC1	ZINC001047236121	1347263728	/nfs/dbraw/zinc/26/37/28/1347263728.db2.gz	FZXCNRWZTZYCRQ-INIZCTEOSA-N	0	3	348.487	3.475	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)[C@@H](C)C3CCC3)C2)CC1	ZINC001047243281	1347269293	/nfs/dbraw/zinc/26/92/93/1347269293.db2.gz	JSMAZUXHAYGVQC-FXAWDEMLSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)C(C)(C)C3CCC3)C2)CC1	ZINC001047246907	1347272576	/nfs/dbraw/zinc/27/25/76/1347272576.db2.gz	BEOJZTAQXIJFNT-SFHVURJKSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)[C@@H](C)C(F)(F)F)C2)CC1	ZINC001047248526	1347273636	/nfs/dbraw/zinc/27/36/36/1347273636.db2.gz	RPJFIKLBJONHRA-GDBMZVCRSA-N	0	3	344.421	3.159	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)C3CCC(=C)CC3)C2)CC1	ZINC001047253122	1347277253	/nfs/dbraw/zinc/27/72/53/1347277253.db2.gz	SIKTWJZUDLIBJO-FQEVSTJZSA-N	0	3	328.500	3.317	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)c3occc3CC)C2)CC1	ZINC001047253623	1347277966	/nfs/dbraw/zinc/27/79/66/1347277966.db2.gz	DYIDSGTXZKKLHC-IBGZPJMESA-N	0	3	342.483	3.430	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)CC(C)(F)F)C2)CC1	ZINC001047254171	1347278222	/nfs/dbraw/zinc/27/82/22/1347278222.db2.gz	OFVOQJVJDHHHFK-MRXNPFEDSA-N	0	3	326.431	3.006	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3cc(F)cc(F)c3)C2)CC1	ZINC001047264105	1347284986	/nfs/dbraw/zinc/28/49/86/1347284986.db2.gz	GUKSGBSBTJHTGO-INIZCTEOSA-N	0	3	346.421	3.162	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3cccn3C(C)C)C2)CC1	ZINC001047265838	1347287144	/nfs/dbraw/zinc/28/71/44/1347287144.db2.gz	XLAVJJAPYUNDQJ-LJQANCHMSA-N	0	3	341.499	3.266	20	30		EGEDHN
C[C@@H](NCc1cc(F)ccc1C#N)[C@@H]1CCN(C(=O)C2CCCC2)C1	ZINC001047668970	1347323153	/nfs/dbraw/zinc/32/31/53/1347323153.db2.gz	YEELEUYXPSCJPT-RHSMWYFYSA-N	0	3	343.446	3.214	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@@H]([C@@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001047680321	1347327133	/nfs/dbraw/zinc/32/71/33/1347327133.db2.gz	ATTHSZDMIJQZNF-GDBMZVCRSA-N	0	3	331.435	3.070	20	30		EGEDHN
CC(C(=O)N1CC[C@@H]([C@H](C)NCc2ccccc2C#N)C1)=C1CCC1	ZINC001047840517	1347386298	/nfs/dbraw/zinc/38/62/98/1347386298.db2.gz	KKZSKBWIFWQCAH-OXJNMPFZSA-N	0	3	337.467	3.385	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H]([C@H](C)NCc2nccs2)C1	ZINC001047852060	1347388921	/nfs/dbraw/zinc/38/89/21/1347388921.db2.gz	DHGFGHBYBSQUKC-WCQYABFASA-N	0	3	341.908	3.248	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]([C@H](C)NCc2ccn(C(C)C)n2)C1	ZINC001047930651	1347414098	/nfs/dbraw/zinc/41/40/98/1347414098.db2.gz	GBGHSVUWPSBZGK-HOTGVXAUSA-N	0	3	332.492	3.003	20	30		EGEDHN
CCC1(C(=O)N2CC[C@@H]([C@@H](C)NCc3ccccc3C#N)C2)CCC1	ZINC001047935810	1347415955	/nfs/dbraw/zinc/41/59/55/1347415955.db2.gz	JGZKSMJEGRPYRN-VQIMIIECSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H]([C@@H](C)NCc3cscn3)C2)CC1	ZINC001047956902	1347423570	/nfs/dbraw/zinc/42/35/70/1347423570.db2.gz	ASXRGGOTPPOGJE-ZBFHGGJFSA-N	0	3	333.501	3.216	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H]([C@H](C)NCc3cnc(C)o3)C2)CC1	ZINC001047962744	1347425752	/nfs/dbraw/zinc/42/57/52/1347425752.db2.gz	NJFPDAAUUFFFEZ-YOEHRIQHSA-N	0	3	331.460	3.056	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC(C)(C)C)C[C@@H]1CNCc1cc(F)ccc1C#N	ZINC001048149936	1347481976	/nfs/dbraw/zinc/48/19/76/1347481976.db2.gz	YILWTSCYLWBBHV-PBHICJAKSA-N	0	3	345.462	3.318	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](C)[C@@H](CNCc2csc(CC)n2)C1	ZINC001048337700	1347522398	/nfs/dbraw/zinc/52/23/98/1347522398.db2.gz	FIVNOUJZGSOUFC-GJZGRUSLSA-N	0	3	349.544	3.492	20	30		EGEDHN
C[C@@H]1CN(C(=O)C(C)(C)C2CC2)C[C@H]1CNCc1ccccc1C#N	ZINC001048347424	1347526241	/nfs/dbraw/zinc/52/62/41/1347526241.db2.gz	DDJLYIAPLMPSFF-CRAIPNDOSA-N	0	3	339.483	3.179	20	30		EGEDHN
C[C@H]1CN(C(=O)C(C)(C)C(F)F)C[C@H]1CNCc1ccccc1C#N	ZINC001048382063	1347537913	/nfs/dbraw/zinc/53/79/13/1347537913.db2.gz	IPDXWKGVIKPJIT-XJKSGUPXSA-N	0	3	349.425	3.034	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2CCF	ZINC001048539302	1347584244	/nfs/dbraw/zinc/58/42/44/1347584244.db2.gz	IOUZSDQOPAUBRI-BJWYYQGGSA-N	0	3	346.446	3.194	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)C2CCCC2)cc1	ZINC001049280376	1347767602	/nfs/dbraw/zinc/76/76/02/1347767602.db2.gz	ODGVPRHQPDQRNX-WOJBJXKFSA-N	0	3	337.467	3.314	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)[C@@H]2CC=CCC2)cc1	ZINC001049325977	1347792102	/nfs/dbraw/zinc/79/21/02/1347792102.db2.gz	LCAFJUXZLLSWAY-NJDAHSKKSA-N	0	3	349.478	3.480	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@H]2CCCN3C(=O)C2CC=CC2)c1	ZINC001049397379	1347819816	/nfs/dbraw/zinc/81/98/16/1347819816.db2.gz	RUUNRXIUGPDLIF-UXHICEINSA-N	0	3	335.451	3.090	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049415505	1347838335	/nfs/dbraw/zinc/83/83/35/1347838335.db2.gz	LKAIZHOVZJRDIQ-GUDVDZBRSA-N	0	3	337.467	3.170	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1nc(C(C)C)oc1C	ZINC001049468403	1347863734	/nfs/dbraw/zinc/86/37/34/1347863734.db2.gz	HNGDMRLCFRVKPI-CVEARBPZSA-N	0	3	331.460	3.361	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1coc2c1cccc2OC	ZINC001049475736	1347867847	/nfs/dbraw/zinc/86/78/47/1347867847.db2.gz	VPVNWJCQXLNGQC-IRXDYDNUSA-N	0	3	340.423	3.306	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H]1CC[C@H](c2ccccc2)O1	ZINC001049480808	1347870283	/nfs/dbraw/zinc/87/02/83/1347870283.db2.gz	QJYBYBHSYSQAHG-WTGUMLROSA-N	0	3	340.467	3.158	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(C2CC2)n(CC)n1	ZINC001049516658	1347887985	/nfs/dbraw/zinc/88/79/85/1347887985.db2.gz	DZZCHFTXBGONOX-MSOLQXFVSA-N	0	3	342.487	3.035	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1cncc2ccccc21	ZINC001049528820	1347893668	/nfs/dbraw/zinc/89/36/68/1347893668.db2.gz	BBRUCFFLCZPGGQ-WOJBJXKFSA-N	0	3	335.451	3.029	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1nc(C(C)(C)C)cs1	ZINC001049531234	1347894274	/nfs/dbraw/zinc/89/42/74/1347894274.db2.gz	IPGAHADGAARSCS-GJZGRUSLSA-N	0	3	345.512	3.143	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1nc(C(C)(C)C)cs1	ZINC001049531236	1347894523	/nfs/dbraw/zinc/89/45/23/1347894523.db2.gz	IPGAHADGAARSCS-LSDHHAIUSA-N	0	3	345.512	3.143	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cnoc1-c1ccco1	ZINC001049556888	1347907874	/nfs/dbraw/zinc/90/78/74/1347907874.db2.gz	CRLSNSGXZJWKAQ-HZPDHXFCSA-N	0	3	341.411	3.190	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1coc2ccc(OC)cc21	ZINC001049586665	1347923549	/nfs/dbraw/zinc/92/35/49/1347923549.db2.gz	UXIWMARMBNKOMJ-ZWKOTPCHSA-N	0	3	340.423	3.306	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc2c(c1)C(C)(C)CO2	ZINC001049587028	1347923962	/nfs/dbraw/zinc/92/39/62/1347923962.db2.gz	DMQFHYDQSFDYBR-ROUUACIJSA-N	0	3	340.467	3.222	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1cccc(C)c1Cl	ZINC001049591319	1347926158	/nfs/dbraw/zinc/92/61/58/1347926158.db2.gz	FWYVAORVHQJLLJ-IAGOWNOFSA-N	0	3	332.875	3.442	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1cc(F)c(C)cc1F	ZINC001049612298	1347935735	/nfs/dbraw/zinc/93/57/35/1347935735.db2.gz	LZNWPJUCPGXKDP-MSOLQXFVSA-N	0	3	334.410	3.067	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccccc1-n1cccc1	ZINC001049685859	1347971637	/nfs/dbraw/zinc/97/16/37/1347971637.db2.gz	BQCGVFJYIORPJT-LEWJYISDSA-N	0	3	347.462	3.180	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]3[C@H]2CCN3CCC(F)(F)F)C1	ZINC001049704700	1347982091	/nfs/dbraw/zinc/98/20/91/1347982091.db2.gz	ZJDQDNQQWGRZMI-UONOGXRCSA-N	0	3	330.394	3.360	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@H]2CCCN3C(=O)C2CC3(CC3)C2)c1	ZINC001049711822	1347986706	/nfs/dbraw/zinc/98/67/06/1347986706.db2.gz	VSKFYGORRAACDY-UXHICEINSA-N	0	3	349.478	3.314	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]3[C@H]2CCN3Cc2ccc(C#N)cc2)C1	ZINC001049711540	1347986892	/nfs/dbraw/zinc/98/68/92/1347986892.db2.gz	MXNDVBGVZYXRKK-VQTJNVASSA-N	0	3	349.478	3.480	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(-c2cccs2)n[nH]1	ZINC001049744933	1347997414	/nfs/dbraw/zinc/99/74/14/1347997414.db2.gz	BWDWBCTZXWYIOK-JKSUJKDBSA-N	0	3	342.468	3.003	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1ccc(F)c(Cl)c1	ZINC001049747884	1347998596	/nfs/dbraw/zinc/99/85/96/1347998596.db2.gz	LGCRJJHGHOOKMO-ZWKOTPCHSA-N	0	3	348.849	3.110	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)[C@@H]2CC23CCC3)c1	ZINC001049750935	1348000143	/nfs/dbraw/zinc/00/01/43/1348000143.db2.gz	AHVNTAPFIAAMNL-XUVXKRRUSA-N	0	3	349.478	3.314	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccc(C)s1	ZINC001049779027	1348017706	/nfs/dbraw/zinc/01/77/06/1348017706.db2.gz	BBTADIRSVFKNIA-VQHPVUNQSA-N	0	3	330.497	3.411	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1[nH]c2ccc(C)cc2c1C	ZINC001049821696	1348038685	/nfs/dbraw/zinc/03/86/85/1348038685.db2.gz	HSGUKDSRAZKJFI-VQTJNVASSA-N	0	3	349.478	3.487	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)CCc1cc(C)cc(C)c1	ZINC001049832240	1348045762	/nfs/dbraw/zinc/04/57/62/1348045762.db2.gz	UTDBYYDWJJYSIV-NHCUHLMSSA-N	0	3	338.495	3.325	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cnn(CCC(C)C)c1C	ZINC001049837309	1348049819	/nfs/dbraw/zinc/04/98/19/1348049819.db2.gz	ARWABYPTWRFGJY-RBUKOAKNSA-N	0	3	344.503	3.103	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc2nc(C)ccc2o1	ZINC001049854664	1348061879	/nfs/dbraw/zinc/06/18/79/1348061879.db2.gz	OZIKHVNPOMGAGO-IAGOWNOFSA-N	0	3	339.439	3.391	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](C)c1ccc(F)cc1F	ZINC001049903189	1348102882	/nfs/dbraw/zinc/10/28/82/1348102882.db2.gz	GGKWUGLUDNHZDS-JEBQAFNWSA-N	0	3	334.410	3.320	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](CC)c1ccc(OC)cc1	ZINC001049907250	1348104670	/nfs/dbraw/zinc/10/46/70/1348104670.db2.gz	CBTRNFKRBZYVAT-HSALFYBXSA-N	0	3	342.483	3.440	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1cccc(F)c1F	ZINC001049906912	1348104834	/nfs/dbraw/zinc/10/48/34/1348104834.db2.gz	GUXMQEXCUMERAH-CIRFHOKZSA-N	0	3	346.421	3.320	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](C)Cc1ccc(OC)cc1	ZINC001049910911	1348107050	/nfs/dbraw/zinc/10/70/50/1348107050.db2.gz	WOWGQNWZXAKSGB-FFZOFVMBSA-N	0	3	342.483	3.125	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccccc1OCC1CC1	ZINC001049913461	1348108591	/nfs/dbraw/zinc/10/85/91/1348108591.db2.gz	YHEQXINTMPIJPW-OALUTQOASA-N	0	3	340.467	3.340	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](C)Cc1ccc(C)cc1	ZINC001049916909	1348110721	/nfs/dbraw/zinc/11/07/21/1348110721.db2.gz	JMGDJXYLKABOOS-HLAWJBBLSA-N	0	3	338.495	3.262	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](C)c1cccc(OC)c1	ZINC001049923282	1348115487	/nfs/dbraw/zinc/11/54/87/1348115487.db2.gz	UIRZVTVYOLIGBN-ATZDWAIDSA-N	0	3	328.456	3.050	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21)C1CC1	ZINC001050009890	1348152897	/nfs/dbraw/zinc/15/28/97/1348152897.db2.gz	FGLGHDZUTDQEMT-UIAACRFSSA-N	0	3	337.467	3.027	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)Cc3ccc(C)cc3Cl)[C@@H]2C1	ZINC001050078194	1348175055	/nfs/dbraw/zinc/17/50/55/1348175055.db2.gz	KFFXLYVJUHZGHN-FUHWJXTLSA-N	0	3	332.875	3.300	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3ccc(F)c(Cl)c3F)[C@@H]2C1	ZINC001050130645	1348192247	/nfs/dbraw/zinc/19/22/47/1348192247.db2.gz	FBGOGEJKALHMLZ-SMDDNHRTSA-N	0	3	340.801	3.341	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)Cc3c(F)cccc3Cl)[C@@H]2C1	ZINC001050189863	1348206445	/nfs/dbraw/zinc/20/64/45/1348206445.db2.gz	SKKJDWSPCWDWHE-SUMWQHHRSA-N	0	3	336.838	3.130	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3ccc(N(CC)CC)cc3)[C@@H]2C1	ZINC001050190087	1348206551	/nfs/dbraw/zinc/20/65/51/1348206551.db2.gz	YNLLPDRVSWGIQE-AZUAARDMSA-N	0	3	341.499	3.255	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)c3cc(C)n(C(C)C)c3C)[C@@H]2C1	ZINC001050198229	1348208787	/nfs/dbraw/zinc/20/87/87/1348208787.db2.gz	FVTGAQJBQSJMGV-AZUAARDMSA-N	0	3	341.499	3.246	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC[C@H](CNCc3ccn(CC)n3)CC2)C1	ZINC001050363102	1348239181	/nfs/dbraw/zinc/23/91/81/1348239181.db2.gz	NEFWRJDZSIOXSS-QAQDUYKDSA-N	0	3	344.503	3.024	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@H]3CC[C@H](C4CCC4)CC3)C2)CC1	ZINC001050549332	1348287887	/nfs/dbraw/zinc/28/78/87/1348287887.db2.gz	MVCGYLHDCICFIU-WGSAOQKQSA-N	0	3	328.500	3.151	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)[C@H]4C[C@H]5C[C@H]5C4)C3)CC2)c1	ZINC001050628829	1348308181	/nfs/dbraw/zinc/30/81/81/1348308181.db2.gz	BPRPSPSOQYWZGZ-PMOLBWCYSA-N	0	3	349.478	3.029	20	30		EGEDHN
CC(F)(F)CC(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001050651042	1348316593	/nfs/dbraw/zinc/31/65/93/1348316593.db2.gz	JNEFSHAKRXHYKQ-UHFFFAOYSA-N	0	3	347.409	3.028	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3ccccc3O[C@@H](C)CC)C2)CC1	ZINC001050684573	1348326362	/nfs/dbraw/zinc/32/63/62/1348326362.db2.gz	MHUNXOZRQNHEGN-KRWDZBQOSA-N	0	3	340.467	3.035	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3scnc3C(C)(C)C)C2)CC1	ZINC001050692639	1348328997	/nfs/dbraw/zinc/32/89/97/1348328997.db2.gz	GUJMPWFBADIGGJ-UHFFFAOYSA-N	0	3	345.512	3.002	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc4c(c3)C=CCC4)C2)CC1	ZINC001050695744	1348329740	/nfs/dbraw/zinc/32/97/40/1348329740.db2.gz	NMLIQZRUAXPTEN-UHFFFAOYSA-N	0	3	334.463	3.207	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)CCc3cc(C)cc(C)c3)C2)CC1	ZINC001050723731	1348338292	/nfs/dbraw/zinc/33/82/92/1348338292.db2.gz	QQDCVIUJJXWUGF-UHFFFAOYSA-N	0	3	338.495	3.184	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)[C@@H]3CCCO[C@@H]3C)cccc2C1	ZINC001051285047	1348418616	/nfs/dbraw/zinc/41/86/16/1348418616.db2.gz	WKELDMLJAQFVHA-VQIMIIECSA-N	0	3	342.483	3.052	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)[C@H]3CCC[C@@H](F)C3)cccc2C1	ZINC001051288235	1348419504	/nfs/dbraw/zinc/41/95/04/1348419504.db2.gz	NNIRWKXAHZIUSE-QFBILLFUSA-N	0	3	342.458	3.213	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)[C@@H]3CC[C@H](OC)C3)cccc2C1	ZINC001051291734	1348421211	/nfs/dbraw/zinc/42/12/11/1348421211.db2.gz	ATPLPKARZLKJPJ-APWZRJJASA-N	0	3	342.483	3.052	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)C34CCC(CC3)C4)cccc2C1	ZINC001051293513	1348422694	/nfs/dbraw/zinc/42/26/94/1348422694.db2.gz	UNIBIPSIGBISOP-UHFFFAOYSA-N	0	3	336.479	3.265	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3ncc(C)cc3C)cccc2C1	ZINC001051294676	1348423076	/nfs/dbraw/zinc/42/30/76/1348423076.db2.gz	NVYUNESIMCGZPS-UHFFFAOYSA-N	0	3	347.462	3.010	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)[C@@H]3C[C@H]3CC(C)C)cccc2C1	ZINC001051300136	1348424854	/nfs/dbraw/zinc/42/48/54/1348424854.db2.gz	HPCONCKCOPBEAF-TZIWHRDSSA-N	0	3	338.495	3.366	20	30		EGEDHN
C[C@@H](C(=O)N[C@@H]1CCCN(Cc2ccc(C#N)cc2)CC1)C1CCC1	ZINC001052485783	1348553251	/nfs/dbraw/zinc/55/32/51/1348553251.db2.gz	DLTDGTGPAZNVPD-OXQOHEQNSA-N	0	3	339.483	3.465	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)Cc2ccc(CC(C)C)cc2)CC1	ZINC001052540215	1348571880	/nfs/dbraw/zinc/57/18/80/1348571880.db2.gz	ZFYMUXJSDLIZML-HXUWFJFHSA-N	0	3	326.484	3.032	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cc3c(o2)c(F)ccc3C)CC1	ZINC001052588697	1348587509	/nfs/dbraw/zinc/58/75/09/1348587509.db2.gz	ZKXVGXSZKICBMZ-HNNXBMFYSA-N	0	3	342.414	3.488	20	30		EGEDHN
CC1(C)CC[C@@H]1C(=O)N[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC001052636718	1348605196	/nfs/dbraw/zinc/60/51/96/1348605196.db2.gz	WYGWCVJTZWCCQE-RTBURBONSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)Cc2ccc(F)cc2Cl)CC1	ZINC001052681389	1348628172	/nfs/dbraw/zinc/62/81/72/1348628172.db2.gz	AGJYFASSFKEDRA-MRXNPFEDSA-N	0	3	336.838	3.016	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccccc2O[C@@H](C)CC)CC1	ZINC001052755594	1348664876	/nfs/dbraw/zinc/66/48/76/1348664876.db2.gz	WOKZRBRQVPQCHD-ZWKOTPCHSA-N	0	3	342.483	3.472	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2cc3cc(C)ccc3s2)CC1	ZINC001052835854	1348694861	/nfs/dbraw/zinc/69/48/61/1348694861.db2.gz	DWWGCONUVJNUCM-INIZCTEOSA-N	0	3	326.465	3.427	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)C(C)(C)c2ccc(F)cc2)CC1	ZINC001052877405	1348714809	/nfs/dbraw/zinc/71/48/09/1348714809.db2.gz	LOLPXUUSPQBLBX-SFHVURJKSA-N	0	3	330.447	3.097	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2sc(C(C)C)nc2C)CC1	ZINC001052929294	1348752933	/nfs/dbraw/zinc/75/29/33/1348752933.db2.gz	AFKFSEKJVLWGRN-OAHLLOKOSA-N	0	3	333.501	3.183	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](NC(=O)c2ccccc2CN(C)C)CC1	ZINC001052955739	1348769515	/nfs/dbraw/zinc/76/95/15/1348769515.db2.gz	JLBQQDDTZCVECB-QGZVFWFLSA-N	0	3	349.906	3.085	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@@H]2CCCCc3ccccc32)CC1	ZINC001052960286	1348772811	/nfs/dbraw/zinc/77/28/11/1348772811.db2.gz	QCEURFFJUCRRPB-PZJWPPBQSA-N	0	3	338.495	3.491	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc(N(C)C(C)C)cc2)CC1	ZINC001052971648	1348781382	/nfs/dbraw/zinc/78/13/82/1348781382.db2.gz	LTXKZPXDZBELKZ-IBGZPJMESA-N	0	3	341.499	3.139	20	30		EGEDHN
CCC(=O)N1CCC[C@H]([C@H]2CCCN(Cc3ccc(C#N)s3)C2)C1	ZINC001052996494	1348793161	/nfs/dbraw/zinc/79/31/61/1348793161.db2.gz	JIJNFUAMFMZPMM-HOTGVXAUSA-N	0	3	345.512	3.480	20	30		EGEDHN
CC(=O)N1CCC[C@@H]([C@@H]2CCCN(Cc3ccc(C#N)s3)C2)C1	ZINC001052997093	1348794071	/nfs/dbraw/zinc/79/40/71/1348794071.db2.gz	ORFQTLVCOHXAID-HZPDHXFCSA-N	0	3	331.485	3.090	20	30		EGEDHN
CC(=O)N1CCC[C@@H]([C@H]2CCCN(Cc3ccc(C#N)s3)C2)C1	ZINC001052997094	1348794241	/nfs/dbraw/zinc/79/42/41/1348794241.db2.gz	ORFQTLVCOHXAID-JKSUJKDBSA-N	0	3	331.485	3.090	20	30		EGEDHN
CC(=O)N1CCCC[C@H]1[C@H]1CCCN(Cc2ccc(C#N)s2)C1	ZINC001053054961	1348861567	/nfs/dbraw/zinc/86/15/67/1348861567.db2.gz	TYWTZGUOQYHXES-YJBOKZPZSA-N	0	3	331.485	3.233	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccccc2F)C1	ZINC001053061034	1348869878	/nfs/dbraw/zinc/86/98/78/1348869878.db2.gz	LOQQVZKWFGHKLO-APWZRJJASA-N	0	3	328.431	3.166	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)Cc2cccs2)C1	ZINC001053060893	1348870213	/nfs/dbraw/zinc/87/02/13/1348870213.db2.gz	KFDXEPLOEKLVKW-AEFFLSMTSA-N	0	3	330.497	3.017	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cccc(F)c2)C1	ZINC001053062841	1348873961	/nfs/dbraw/zinc/87/39/61/1348873961.db2.gz	CXVXYIBHZHWANC-IEBWSBKVSA-N	0	3	328.431	3.166	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccc(Cl)o2)C1	ZINC001053067934	1348880674	/nfs/dbraw/zinc/88/06/74/1348880674.db2.gz	TWDIHXUDEQXRFO-LSDHHAIUSA-N	0	3	334.847	3.273	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cc(Cl)c[nH]2)C1	ZINC001053070414	1348884739	/nfs/dbraw/zinc/88/47/39/1348884739.db2.gz	YKOBMQDMVYBPSU-YOEHRIQHSA-N	0	3	333.863	3.008	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2c(C)coc2C)C1	ZINC001053082662	1348904520	/nfs/dbraw/zinc/90/45/20/1348904520.db2.gz	GKHHZZYEZXYLRV-QZTJIDSGSA-N	0	3	328.456	3.236	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)[C@H]2C[C@H]3C[C@H]3C2)C1	ZINC001053094287	1348923671	/nfs/dbraw/zinc/92/36/71/1348923671.db2.gz	DBLALVSFRTVVJL-OMZCGLGVSA-N	0	3	328.500	3.149	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cc(C(C)C)no2)C1	ZINC001053102754	1348936613	/nfs/dbraw/zinc/93/66/13/1348936613.db2.gz	UWYBIOGHXHDVAB-WMZOPIPTSA-N	0	3	343.471	3.138	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)C2(F)CCCCC2)C1	ZINC001053105536	1348942827	/nfs/dbraw/zinc/94/28/27/1348942827.db2.gz	UORJVOUEPWOTRI-ROUUACIJSA-N	0	3	334.479	3.385	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cnc(CC)s2)C1	ZINC001053106600	1348943958	/nfs/dbraw/zinc/94/39/58/1348943958.db2.gz	UUXWGOWROPLHRR-HZPDHXFCSA-N	0	3	345.512	3.045	20	30		EGEDHN
C=C(C)CCN1Cc2ccccc2C[C@H]1CNC(=O)c1c[nH]c(C#N)c1	ZINC001054037581	1349133935	/nfs/dbraw/zinc/13/39/35/1349133935.db2.gz	JZNVPZKDTWJVMQ-FQEVSTJZSA-N	0	3	348.450	3.009	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)CC1(c3ccccc3)CC1)C2	ZINC001054143125	1349153597	/nfs/dbraw/zinc/15/35/97/1349153597.db2.gz	MYJYFHAPRNGFTI-OAQYLSRUSA-N	0	3	336.479	3.056	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)Cc1ccc(C)cc1Cl)C2	ZINC001054153981	1349157511	/nfs/dbraw/zinc/15/75/11/1349157511.db2.gz	NMXYTFHYJSQFDZ-FQEVSTJZSA-N	0	3	344.886	3.139	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)C1(C)CCC(F)(F)CC1)C2	ZINC001054154314	1349158037	/nfs/dbraw/zinc/15/80/37/1349158037.db2.gz	CKJPABOEIQHZAI-SFHVURJKSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)CCc1ccc(F)cc1)C2	ZINC001054160758	1349162836	/nfs/dbraw/zinc/16/28/36/1349162836.db2.gz	NFQFIQNDIJIYCU-NRFANRHFSA-N	0	3	342.458	3.096	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2cccc3c(C)c(C)[nH]c32)C1	ZINC001079977410	1357447371	/nfs/dbraw/zinc/44/73/71/1357447371.db2.gz	SYTIDAJSMZIHBE-FZKQIMNGSA-N	0	3	325.456	3.411	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@H](C)c1ccc(Cl)cc1)C2	ZINC001054188683	1349191847	/nfs/dbraw/zinc/19/18/47/1349191847.db2.gz	RCFGDNOXFBKLRW-OXQOHEQNSA-N	0	3	344.886	3.391	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc(C)cc(F)c1)C2	ZINC001054202947	1349204115	/nfs/dbraw/zinc/20/41/15/1349204115.db2.gz	NNEJVOABKDSGSW-FQEVSTJZSA-N	0	3	328.431	3.086	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@]3(C2)CCCN(C(=O)[C@@H]2CC24CC4)C3)c1	ZINC001054204388	1349206399	/nfs/dbraw/zinc/20/63/99/1349206399.db2.gz	UNHCIIJQRYNHKZ-FPOVZHCZSA-N	0	3	349.478	3.173	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc3c(c1)C=CCC3)C2	ZINC001054212463	1349212660	/nfs/dbraw/zinc/21/26/60/1349212660.db2.gz	HJZPDXZEEUCCHN-QFIPXVFZSA-N	0	3	334.463	3.207	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(C(F)F)cc1)C2	ZINC001054213319	1349213002	/nfs/dbraw/zinc/21/30/02/1349213002.db2.gz	XEOSNDYDGNVZGR-LJQANCHMSA-N	0	3	332.394	3.186	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)C[C@H]1CCc3ccccc31)C2	ZINC001054216365	1349215955	/nfs/dbraw/zinc/21/59/55/1349215955.db2.gz	UQGMKMLPFIGVBD-DENIHFKCSA-N	0	3	336.479	3.054	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H](C)c1ccc(C)cc1)C2	ZINC001054227534	1349221773	/nfs/dbraw/zinc/22/17/73/1349221773.db2.gz	IUXIDHOIDPKWTF-UGKGYDQZSA-N	0	3	338.495	3.436	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1sccc1C(F)F)C2	ZINC001054234734	1349226733	/nfs/dbraw/zinc/22/67/33/1349226733.db2.gz	ISPCBCSMSJNVIZ-KRWDZBQOSA-N	0	3	338.423	3.247	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)C1(c3ccccc3)CC1)C2	ZINC001054235958	1349228202	/nfs/dbraw/zinc/22/82/02/1349228202.db2.gz	ATXWNFPNIYWNKC-OAQYLSRUSA-N	0	3	336.479	3.056	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)Cc1ccccc1Cl)C2	ZINC001054237253	1349230462	/nfs/dbraw/zinc/23/04/62/1349230462.db2.gz	VZMJWROQEMGOPS-FQEVSTJZSA-N	0	3	344.886	3.220	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@H]1CC3CCC1CC3)C2	ZINC001054245756	1349239499	/nfs/dbraw/zinc/23/94/99/1349239499.db2.gz	BAPNHMIQLSNFOD-XSNSTOHYSA-N	0	3	328.500	3.151	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3cc(C)on3)cc2C1	ZINC001054255142	1349251113	/nfs/dbraw/zinc/25/11/13/1349251113.db2.gz	DDUXDEWOIHYREP-UHFFFAOYSA-N	0	3	325.412	3.195	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@H]3C[C@H]3OCC)cc2C1	ZINC001054257716	1349254141	/nfs/dbraw/zinc/25/41/41/1349254141.db2.gz	UFYUBFCBDWSUAZ-RBUKOAKNSA-N	0	3	328.456	3.010	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@H]3CC[C@@H](C)O3)cc2C1	ZINC001054283326	1349284318	/nfs/dbraw/zinc/28/43/18/1349284318.db2.gz	VZHLGOWHQBMLQG-DNVCBOLYSA-N	0	3	328.456	3.152	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cc4c([nH]3)CCC4)cc2C1	ZINC001054289426	1349293240	/nfs/dbraw/zinc/29/32/40/1349293240.db2.gz	FZEACWJTWDGFFL-UHFFFAOYSA-N	0	3	335.451	3.325	20	30		EGEDHN
C#Cc1ccc(C(=O)NCc2ccc3c(c2)CN(CC2CCC2)C3)nc1	ZINC001054290422	1349295620	/nfs/dbraw/zinc/29/56/20/1349295620.db2.gz	PQIDTELVHZVZLR-UHFFFAOYSA-N	0	3	345.446	3.109	20	30		EGEDHN
C[C@H]1CN(C(=O)c2cccs2)C[C@H]1NCc1ccc(C#N)c(F)c1	ZINC001054350290	1349330300	/nfs/dbraw/zinc/33/03/00/1349330300.db2.gz	JNNCDINWAKCDSS-BLLLJJGKSA-N	0	3	343.427	3.009	20	30		EGEDHN
Cc1cc(C(=O)N2C[C@H](C)[C@H](NCc3ccc(C#N)s3)C2)c(C)o1	ZINC001054375005	1349339906	/nfs/dbraw/zinc/33/99/06/1349339906.db2.gz	IAEWWTVRXRRODX-APPDUMDISA-N	0	3	343.452	3.080	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC(C)(C)C2CC2)C[C@H]1NCc1ccc(C#N)s1	ZINC001054642183	1349426335	/nfs/dbraw/zinc/42/63/35/1349426335.db2.gz	JQVNNHSKCYAJQN-CXAGYDPISA-N	0	3	345.512	3.383	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@H](C)[C@H](NCc2scnc2C)C1	ZINC001054679611	1349434871	/nfs/dbraw/zinc/43/48/71/1349434871.db2.gz	KIRFATAISUXZML-GXFFZTMASA-N	0	3	341.908	3.167	20	30		EGEDHN
C[C@H]1CN(C(=O)C23CCC(CC2)C3)C[C@H]1NCc1ccc(C#N)s1	ZINC001054800681	1349466706	/nfs/dbraw/zinc/46/67/06/1349466706.db2.gz	AQTLTUDUWICGIR-PBCKZISKSA-N	0	3	343.496	3.137	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2c(Cl)cncc2Cl)C1	ZINC001080384786	1357597313	/nfs/dbraw/zinc/59/73/13/1357597313.db2.gz	OZIBQALQYVLGDW-ZWNOBZJWSA-N	0	3	328.243	3.015	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CN(Cc3ccc(COC)cc3)C[C@H]2C)C1	ZINC001080404410	1357608547	/nfs/dbraw/zinc/60/85/47/1357608547.db2.gz	GSUMFKRHKLHRKJ-VQIMIIECSA-N	0	3	342.483	3.126	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)C2CC(C(C)(C)C)C2)C1	ZINC001070435793	1354348555	/nfs/dbraw/zinc/34/85/55/1354348555.db2.gz	RQYUCBKNORIMCX-HPUBIQBYSA-N	0	3	344.503	3.074	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)CCC1CCCC1)C[C@@H](C)O2	ZINC001071126328	1354465924	/nfs/dbraw/zinc/46/59/24/1354465924.db2.gz	BIHCAYUGTPWQBF-YLJYHZDGSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1csc(C)c1C)C[C@@H](C)O2	ZINC001071168414	1354486175	/nfs/dbraw/zinc/48/61/75/1354486175.db2.gz	APGRVFHNWVSZFG-AUUYWEPGSA-N	0	3	348.512	3.246	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1ccoc1C1CC1)C[C@H](C)O2	ZINC001071204015	1354503506	/nfs/dbraw/zinc/50/35/06/1354503506.db2.gz	LQMJAJATBXBYLU-MGPUTAFESA-N	0	3	344.455	3.039	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1cc(C)ccc1C)C[C@H](C)O2	ZINC001071235837	1354519937	/nfs/dbraw/zinc/51/99/37/1354519937.db2.gz	LDQNKWILYQRWRG-GHTZIAJQSA-N	0	3	342.483	3.185	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cn(C(C)(C)C)nc2C)CC[C@H]1C	ZINC001071501730	1354731348	/nfs/dbraw/zinc/73/13/48/1354731348.db2.gz	UCGFIIUXEMJEDD-ZBFHGGJFSA-N	0	3	332.492	3.105	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCCCCN(C(=O)C3CCC3)C2)c(F)c1	ZINC001088245775	1359815096	/nfs/dbraw/zinc/81/50/96/1359815096.db2.gz	CFFSQWKPSFLNOU-GOSISDBHSA-N	0	3	343.446	3.358	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc3nccc(C)c3c2)CC[C@@H]1C	ZINC001071533639	1354750455	/nfs/dbraw/zinc/75/04/55/1354750455.db2.gz	IZBDURDSLZYXAU-WMZOPIPTSA-N	0	3	335.451	3.149	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc3nc(C)oc3c2)CC[C@@H]1C	ZINC001071588294	1354780417	/nfs/dbraw/zinc/78/04/17/1354780417.db2.gz	HVOVNGBDZVNXRY-XJKSGUPXSA-N	0	3	327.428	3.295	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2ccc3cccnc3c2)CC[C@@H]1C	ZINC001071607561	1354793129	/nfs/dbraw/zinc/79/31/29/1354793129.db2.gz	PSZCSHJPXKNQCN-QFBILLFUSA-N	0	3	337.467	3.323	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2(C)CCC(F)(F)CC2)CC[C@@H]1C	ZINC001071612920	1354797522	/nfs/dbraw/zinc/79/75/22/1354797522.db2.gz	PCHARFOCWGSRCI-GJZGRUSLSA-N	0	3	326.431	3.194	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2(C)CCC(F)(F)CC2)CC[C@H]1C	ZINC001071612921	1354797554	/nfs/dbraw/zinc/79/75/54/1354797554.db2.gz	PCHARFOCWGSRCI-HUUCEWRRSA-N	0	3	326.431	3.194	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(-n3cccc3)cc2)CC[C@H]1C	ZINC001071653886	1354829011	/nfs/dbraw/zinc/82/90/11/1354829011.db2.gz	AOZWNIWZHLPAOO-MJGOQNOKSA-N	0	3	335.451	3.083	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)c2cn(CC)c3ccccc23)CC[C@@H]1C	ZINC001071670586	1354840178	/nfs/dbraw/zinc/84/01/78/1354840178.db2.gz	NHKPFTBGXYQOME-JKSUJKDBSA-N	0	3	325.456	3.430	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2scnc2C(F)F)CC[C@@H]1C	ZINC001071675729	1354843494	/nfs/dbraw/zinc/84/34/94/1354843494.db2.gz	GSUOVIDVTMTSLX-QWRGUYRKSA-N	0	3	329.416	3.240	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccccc2-n2cccc2)CC[C@H]1C	ZINC001071793160	1354939075	/nfs/dbraw/zinc/93/90/75/1354939075.db2.gz	WASUABFYDCHBHX-QZTJIDSGSA-N	0	3	335.451	3.083	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2oc(CC(C)C)nc2C)CC[C@H]1C	ZINC001071882847	1355004163	/nfs/dbraw/zinc/00/41/63/1355004163.db2.gz	BFRDYOYFUPUKEH-GDBMZVCRSA-N	0	3	333.476	3.340	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2oc(CC(C)C)nc2C)CC[C@@H]1C	ZINC001071882849	1355004240	/nfs/dbraw/zinc/00/42/40/1355004240.db2.gz	BFRDYOYFUPUKEH-HOCLYGCPSA-N	0	3	333.476	3.340	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccccc2OCC(C)C)CC[C@H]1C	ZINC001071904175	1355016465	/nfs/dbraw/zinc/01/64/65/1355016465.db2.gz	DNDWNYKWTDRJNV-MSOLQXFVSA-N	0	3	342.483	3.327	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CC[C@@H](C)N(Cc3ccc(C)cc3)C2)cn1	ZINC001072002955	1355068074	/nfs/dbraw/zinc/06/80/74/1355068074.db2.gz	PZFCLSUZQQIQTP-DYESRHJHSA-N	0	3	347.462	3.154	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(COC)c(F)c2)CC[C@H]1C	ZINC001072023627	1355085984	/nfs/dbraw/zinc/08/59/84/1355085984.db2.gz	UNPOPZBUQUNAKI-PBHICJAKSA-N	0	3	334.435	3.131	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@H]1CC[C@@H](C)N(Cc2ccccc2)C1	ZINC001072023612	1355086413	/nfs/dbraw/zinc/08/64/13/1355086413.db2.gz	UFGFYJSVTMJVRS-GCJKJVERSA-N	0	3	346.474	3.380	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)[C@@]2(c3ccccc3)C[C@H](F)C2)CC[C@@H]1C	ZINC001072030628	1355091325	/nfs/dbraw/zinc/09/13/25/1355091325.db2.gz	SHXKEZRPJMVMIU-ROPHOZQPSA-N	0	3	342.458	3.049	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2(c3ccc(Cl)cc3)CC2)CC[C@@H]1C	ZINC001072049871	1355103668	/nfs/dbraw/zinc/10/36/68/1355103668.db2.gz	RJNFVGFPHTUDEW-YJBOKZPZSA-N	0	3	344.886	3.364	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(OCC(C)C)cc2)CC[C@@H]1C	ZINC001072049031	1355103779	/nfs/dbraw/zinc/10/37/79/1355103779.db2.gz	NNKYKULGABFQEY-HKUYNNGSSA-N	0	3	342.483	3.327	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cccc(OCC(C)C)c2)CC[C@H]1C	ZINC001072058965	1355107774	/nfs/dbraw/zinc/10/77/74/1355107774.db2.gz	WCXOLGWEBVATHD-MJGOQNOKSA-N	0	3	342.483	3.327	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cnn(C(C)(C)C)c2CC)CC[C@H]1C	ZINC001072072293	1355112834	/nfs/dbraw/zinc/11/28/34/1355112834.db2.gz	IMJPQMCSYKKVIW-HZPDHXFCSA-N	0	3	346.519	3.359	20	30		EGEDHN
C=C(Cl)CN1C[C@H](NC(=O)c2cccc(CN(C)C)c2)CC[C@H]1C	ZINC001072095059	1355126682	/nfs/dbraw/zinc/12/66/82/1355126682.db2.gz	FWPDEMIJDBLSQS-CRAIPNDOSA-N	0	3	349.906	3.083	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C23CC(C(F)(F)F)(C2)C3)CC[C@H]1C	ZINC001072102091	1355131120	/nfs/dbraw/zinc/13/11/20/1355131120.db2.gz	MRBWVLSGJHSIDP-KCNJBTMXSA-N	0	3	330.394	3.264	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)Cc2cccc(OC(C)C)c2)CC[C@H]1C	ZINC001072102661	1355131581	/nfs/dbraw/zinc/13/15/81/1355131581.db2.gz	QHKWNOMSRSVRBW-SJLPKXTDSA-N	0	3	330.472	3.171	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C(C)(C)c2ccccc2C)CC[C@@H]1C	ZINC001072113385	1355138864	/nfs/dbraw/zinc/13/88/64/1355138864.db2.gz	ULMQXFWWPGZERZ-ROUUACIJSA-N	0	3	326.484	3.265	20	30		EGEDHN
Cc1ccccc1C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001072414013	1355279392	/nfs/dbraw/zinc/27/93/92/1355279392.db2.gz	LZFGMMYBHVXZMG-UHFFFAOYSA-N	0	3	345.446	3.215	20	30		EGEDHN
CC(C)(C)CC(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001072460231	1355296403	/nfs/dbraw/zinc/29/64/03/1355296403.db2.gz	BSSMVGKVTGHKOZ-UHFFFAOYSA-N	0	3	325.456	3.029	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccccc3CC(C)(C)C)C2)C1	ZINC001072843003	1355461186	/nfs/dbraw/zinc/46/11/86/1355461186.db2.gz	MFYVFXZKYLOHTQ-UHFFFAOYSA-N	0	3	338.495	3.446	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CN(C(=O)C[C@H]4C=CCCC4)C3)C2)cc1	ZINC001072846094	1355462117	/nfs/dbraw/zinc/46/21/17/1355462117.db2.gz	MECBGAYFYPIBLL-SFHVURJKSA-N	0	3	349.478	3.339	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)[C@H]4CCCC45CC5)C3)C2)c1	ZINC001072850839	1355464728	/nfs/dbraw/zinc/46/47/28/1355464728.db2.gz	AEVFUCWGRBUFRK-LJQANCHMSA-N	0	3	349.478	3.173	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)[C@@H]4CC[C@@H]5C[C@@H]5C4)C3)C2)c1	ZINC001072879681	1355480489	/nfs/dbraw/zinc/48/04/89/1355480489.db2.gz	WOMFNIKPNIRPOG-VAMGGRTRSA-N	0	3	349.478	3.029	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3cc4cc(Cl)ccc4o3)C2)C1	ZINC001072903191	1355490381	/nfs/dbraw/zinc/49/03/81/1355490381.db2.gz	SYFYSSXEZFZRMZ-UHFFFAOYSA-N	0	3	330.815	3.420	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1ccc(C)nc1C)C2	ZINC001072945135	1355513370	/nfs/dbraw/zinc/51/33/70/1355513370.db2.gz	URLWYASNNCEYOM-HXUWFJFHSA-N	0	3	341.499	3.335	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)C[C@@H](C)c3ccc(CC)cc3)C2)C1	ZINC001072975878	1355532033	/nfs/dbraw/zinc/53/20/33/1355532033.db2.gz	NLLQPHPELRMKGC-QGZVFWFLSA-N	0	3	326.484	3.463	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)C3(C(F)(F)F)CCCCC3)C2)C1	ZINC001073480351	1355814498	/nfs/dbraw/zinc/81/44/98/1355814498.db2.gz	OTHIUVYDKXOYPE-UHFFFAOYSA-N	0	3	330.394	3.220	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CN(CC3=CCCCC3)CCCO2)CC1	ZINC001073755710	1355890657	/nfs/dbraw/zinc/89/06/57/1355890657.db2.gz	HVVFRQDIWZEGNV-FQEVSTJZSA-N	0	3	346.515	3.440	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2cccc(C(F)F)c2)C1	ZINC001073861784	1355923780	/nfs/dbraw/zinc/92/37/80/1355923780.db2.gz	IEZDBYLJIYNHIY-MRXNPFEDSA-N	0	3	338.398	3.021	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2ccc(C(C)C)s2)C1	ZINC001073906177	1355950391	/nfs/dbraw/zinc/95/03/91/1355950391.db2.gz	TXJCDERHMSBTEB-OAHLLOKOSA-N	0	3	336.501	3.268	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCCN1C(=O)c1ccoc1	ZINC001073948513	1355986541	/nfs/dbraw/zinc/98/65/41/1355986541.db2.gz	MAQYMGIBIDQAGQ-LJQANCHMSA-N	0	3	337.423	3.278	20	30		EGEDHN
C[C@H](C(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(C#N)cc1)C1CC1	ZINC001073981411	1356009369	/nfs/dbraw/zinc/00/93/69/1356009369.db2.gz	AYCLTTIRXHQVHX-OXJNMPFZSA-N	0	3	339.483	3.417	20	30		EGEDHN
Cc1cc(CN(C)C[C@H]2CCCCN2C(=O)C#CC2CC2)cs1	ZINC001074012781	1356034536	/nfs/dbraw/zinc/03/45/36/1356034536.db2.gz	MQSMXRKUWGOYOQ-GOSISDBHSA-N	0	3	330.497	3.283	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@H](CNCc2cc(F)ccc2C#N)[C@H](C)C1	ZINC001075209998	1356344219	/nfs/dbraw/zinc/34/42/19/1356344219.db2.gz	UIICGPZNXPBBDZ-NVXWUHKLSA-N	0	3	343.446	3.238	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCO[C@H]1C1CCN(C(=O)/C(C)=C/C)CC1	ZINC001075408980	1356360027	/nfs/dbraw/zinc/36/00/27/1356360027.db2.gz	PPYOFFNBADZYST-ZPIZQRTESA-N	0	3	340.895	3.081	20	30		EGEDHN
C=CCN1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)[C@@H]2CC23CC3)C1	ZINC001075423107	1356364739	/nfs/dbraw/zinc/36/47/39/1356364739.db2.gz	JSJZAOKALIGUQV-QRQLOZEOSA-N	0	3	342.458	3.334	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cnn(C4CCCC4)c3C)[C@@H]2C1	ZINC001076445811	1356579571	/nfs/dbraw/zinc/57/95/71/1356579571.db2.gz	MFYJIMSTYMICJM-QFBILLFUSA-N	0	3	342.487	3.029	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)Cc3c(F)cccc3Cl)[C@@H]2C1	ZINC001076495803	1356596715	/nfs/dbraw/zinc/59/67/15/1356596715.db2.gz	SQEZUHZSKSDBHK-SUMWQHHRSA-N	0	3	336.838	3.130	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)[C@@H](C)Cc3cccc(Cl)c3)[C@@H]2C1	ZINC001076641231	1356640386	/nfs/dbraw/zinc/64/03/86/1356640386.db2.gz	YZZDTOUIYRLDRV-QILLFSRXSA-N	0	3	332.875	3.237	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cn(CC)c3ccccc23)C1	ZINC001098931947	1363527463	/nfs/dbraw/zinc/52/74/63/1363527463.db2.gz	JIQFLSLZASCGDR-KKSFZXQISA-N	0	3	337.467	3.432	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2nc(Cl)sc2C)C1	ZINC001098938350	1363529167	/nfs/dbraw/zinc/52/91/67/1363529167.db2.gz	UVNGDYGKJRGYBS-LRDDRELGSA-N	0	3	339.892	3.265	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)Cc1nc(C)sc1C	ZINC001099120608	1363635148	/nfs/dbraw/zinc/63/51/48/1363635148.db2.gz	CZJXSDORKQWAIC-MRXNPFEDSA-N	0	3	349.544	3.485	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@@H](C)c2cccc(F)c2)C[C@H]1C(F)(F)F	ZINC001099343948	1363761951	/nfs/dbraw/zinc/76/19/51/1363761951.db2.gz	AYZREBQTHQJRSZ-NILFDRSVSA-N	0	3	344.352	3.094	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2C[C@H](NCc3oc(C)nc3C)C23CCC3)C1	ZINC001078721062	1357065644	/nfs/dbraw/zinc/06/56/44/1357065644.db2.gz	VMHBELFBRLFVJD-DLBZAZTESA-N	0	3	343.471	3.165	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)Cc2c(C)cccc2C)C[C@H]1c1ccccc1	ZINC001081122389	1357840675	/nfs/dbraw/zinc/84/06/75/1357840675.db2.gz	QXWREOKGBVATHA-FCHUYYIVSA-N	0	3	346.474	3.063	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C2(C)CCC(C)CC2)C[C@H]1c1ccccc1	ZINC001081233164	1357851991	/nfs/dbraw/zinc/85/19/91/1357851991.db2.gz	UTECEOZVAGKNBW-GWFKXHKXSA-N	0	3	338.495	3.420	20	30		EGEDHN
C[C@@H]1CN(C(=O)C[C@@H]2CC=CCC2)C[C@H]1NCc1ccc(C#N)s1	ZINC001082688255	1358073239	/nfs/dbraw/zinc/07/32/39/1358073239.db2.gz	OXPITPLDKZZHLH-IIDMSEBBSA-N	0	3	343.496	3.303	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H](C)[C@H](NCc2c(C)nsc2C)C1	ZINC001082721709	1358080088	/nfs/dbraw/zinc/08/00/88/1358080088.db2.gz	GHOLEODSBVYPPK-XHBKTUGNSA-N	0	3	335.517	3.299	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)C3CC(C)(C)CC(C)(C)C3)[C@H]2C1	ZINC001083154790	1358121177	/nfs/dbraw/zinc/12/11/77/1358121177.db2.gz	NKXFOUNIUHHQPB-ZWKOTPCHSA-N	0	3	348.531	3.327	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)C3CCC(C(C)(C)C)CC3)[C@H]2C1	ZINC001083264806	1358128001	/nfs/dbraw/zinc/12/80/01/1358128001.db2.gz	SCMZQDKKTJWXOL-WZOJCFFYSA-N	0	3	348.531	3.327	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)c3csc4cc(C)ccc34)[C@@H]2C1	ZINC001084373527	1358203378	/nfs/dbraw/zinc/20/33/78/1358203378.db2.gz	LURDKDCFCXEBRE-CRAIPNDOSA-N	0	3	338.476	3.379	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3ocnc3-c3ccccc3)[C@@H]2C1	ZINC001084396362	1358206586	/nfs/dbraw/zinc/20/65/86/1358206586.db2.gz	AFPMEMKOJOCARE-IAGOWNOFSA-N	0	3	337.423	3.064	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3cc(C)n(C(CC)CC)n3)[C@@H]2C1	ZINC001084471972	1358222199	/nfs/dbraw/zinc/22/21/99/1358222199.db2.gz	VPNDIJQAUGCXAC-VQIMIIECSA-N	0	3	344.503	3.275	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3cc(-c4ccco4)on3)[C@@H]2C1	ZINC001084559853	1358238109	/nfs/dbraw/zinc/23/81/09/1358238109.db2.gz	VUAWKMJNUHIILU-GDBMZVCRSA-N	0	3	341.411	3.047	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CCN(CCc3ccccc3)C[C@H]21	ZINC001084573979	1358240701	/nfs/dbraw/zinc/24/07/01/1358240701.db2.gz	KPAVHOXZQAFPDT-RTBURBONSA-N	0	3	326.484	3.364	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3ccc(F)c(Cl)c3F)[C@@H]2C1	ZINC001084632281	1358262249	/nfs/dbraw/zinc/26/22/49/1358262249.db2.gz	XOQJGNWOFFULBB-BXUZGUMPSA-N	0	3	340.801	3.341	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CCN(C(=O)[C@@H]4CC=CCC4)C[C@@H]32)c1	ZINC001084887897	1358339984	/nfs/dbraw/zinc/33/99/84/1358339984.db2.gz	IKVBMXJYFDIUDA-NJYVYQBISA-N	0	3	349.478	3.337	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@H]2CCN(Cc3ccc(C#N)cc3)[C@H]2C1)C1CC1	ZINC001084913393	1358346071	/nfs/dbraw/zinc/34/60/71/1358346071.db2.gz	MLSVROAFSFNDBR-BEVDRBHNSA-N	0	3	337.467	3.027	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@H](c3ccccc3)C3CC3)C[C@@H]21	ZINC001084988828	1358360467	/nfs/dbraw/zinc/36/04/67/1358360467.db2.gz	JCVSESYZKDYQIS-JRGCBEDISA-N	0	3	336.479	3.126	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H]2CCN(Cc3cnccc3C)[C@H]2C1	ZINC001085023922	1358369858	/nfs/dbraw/zinc/36/98/58/1358369858.db2.gz	FHGNCECJQHKIBI-SLYNCCJLSA-N	0	3	341.499	3.415	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@H](CC)Oc3ccccc3C)C[C@@H]21	ZINC001085046148	1358376324	/nfs/dbraw/zinc/37/63/24/1358376324.db2.gz	BMZBGSJWHCETRO-CEXWTWQISA-N	0	3	342.483	3.261	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@H](C)c3ccc(F)c(F)c3)C[C@@H]21	ZINC001085097761	1358389590	/nfs/dbraw/zinc/38/95/90/1358389590.db2.gz	WTGFCXRBYNEONM-IYOUNJFTSA-N	0	3	334.410	3.177	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@@H]2CCCC[C@H]2NC(=O)CC2CCC2)c1	ZINC001085160629	1358416350	/nfs/dbraw/zinc/41/63/50/1358416350.db2.gz	ODXPDBLHEZHJAX-RTBURBONSA-N	0	3	343.446	3.405	20	30		EGEDHN
C[C@@H](C(=O)N[C@@H]1CCCC[C@H]1NCc1cc(C#N)ccc1F)C1CC1	ZINC001085162395	1358417464	/nfs/dbraw/zinc/41/74/64/1358417464.db2.gz	NXVWDVJWTVARPY-UPRAQXHNSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccc2ccncc2n1	ZINC001085276356	1358449373	/nfs/dbraw/zinc/44/93/73/1358449373.db2.gz	CTRCTMCFOXLLCH-HUUCEWRRSA-N	0	3	344.846	3.013	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCCC[C@H]2NCc2conc2C)CC1	ZINC001085320145	1358464719	/nfs/dbraw/zinc/46/47/19/1358464719.db2.gz	HZKVSYDDNVEKNF-QZTJIDSGSA-N	0	3	331.460	3.246	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1c[nH]nc1-c1ccco1	ZINC001085428056	1358496726	/nfs/dbraw/zinc/49/67/26/1358496726.db2.gz	KFAOINDMZDXGBJ-ZIAGYGMSSA-N	0	3	348.834	3.053	20	30		EGEDHN
CC[C@H](c1ccccc1)N1CC[C@H]1CN(C)C(=O)c1cc(C#N)c[nH]1	ZINC001085535819	1358573112	/nfs/dbraw/zinc/57/31/12/1358573112.db2.gz	PXRCPYWWEZCZBW-PKOBYXMFSA-N	0	3	336.439	3.184	20	30		EGEDHN
CN(C[C@@H]1CCN1[C@H]1CCCc2ccccc21)C(=O)c1ccc(C#N)[nH]1	ZINC001085553753	1358590072	/nfs/dbraw/zinc/59/00/72/1358590072.db2.gz	XISRQYSUAZYYFZ-PXNSSMCTSA-N	0	3	348.450	3.110	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1cn(C)c2ccc(F)cc12	ZINC001085644177	1358656976	/nfs/dbraw/zinc/65/69/76/1358656976.db2.gz	HXKRDWVUMISBEN-HNNXBMFYSA-N	0	3	329.419	3.040	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)[C@@H]1CCCC[C@H]1C(F)(F)F	ZINC001085649525	1358658871	/nfs/dbraw/zinc/65/88/71/1358658871.db2.gz	RXUQPMBJQSUSBK-RBSFLKMASA-N	0	3	332.410	3.464	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cnoc1-c1ccco1	ZINC001085677503	1358681653	/nfs/dbraw/zinc/68/16/53/1358681653.db2.gz	OAMOJSGYHASTAX-AWEZNQCLSA-N	0	3	329.400	3.047	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1ccc(F)c2ccncc12	ZINC001085779909	1358754606	/nfs/dbraw/zinc/75/46/06/1358754606.db2.gz	GDIKUIZTQDQDIW-CQSZACIVSA-N	0	3	327.403	3.096	20	30		EGEDHN
C=C1CCC(C(=O)N(C)C[C@@H]2CCN2CC[C@H]2CCCCO2)CC1	ZINC001085800798	1358776119	/nfs/dbraw/zinc/77/61/19/1358776119.db2.gz	BWEQVXOBAAYPJU-RBUKOAKNSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C1CCC(C(=O)N(C)C[C@@H]2CCN2CC2CC(F)(F)C2)CC1	ZINC001085800842	1358776271	/nfs/dbraw/zinc/77/62/71/1358776271.db2.gz	CXVPSYJTCPAYFJ-INIZCTEOSA-N	0	3	326.431	3.311	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cnoc1-c1ccccc1	ZINC001085901447	1358859718	/nfs/dbraw/zinc/85/97/18/1358859718.db2.gz	FRKJNCYNGZRLJO-KRWDZBQOSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1c(Cl)cccc1OC	ZINC001085986016	1358938165	/nfs/dbraw/zinc/93/81/65/1358938165.db2.gz	SUPWHGQAQUVQAM-CQSZACIVSA-N	0	3	336.863	3.461	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@@H]2COc3cc(C)c(C)cc32)C1	ZINC001086159148	1359011168	/nfs/dbraw/zinc/01/11/68/1359011168.db2.gz	KTOQFYIHSBVNJC-HLLBOEOZSA-N	0	3	348.874	3.016	20	30		EGEDHN
C[C@H]1CC[C@@H](C(=O)NC[C@H]2C[C@@H](NCc3cc(C#N)ccc3F)C2)C1	ZINC001086216233	1359030189	/nfs/dbraw/zinc/03/01/89/1359030189.db2.gz	NAYYXABQHCGBCF-KMANFZQXSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)[C@H]2C[C@@]2(C)C(C)C)C1	ZINC001086241791	1359039159	/nfs/dbraw/zinc/03/91/59/1359039159.db2.gz	UFHGYAJFNZMZEP-CTASWTNQSA-N	0	3	343.309	3.062	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc3cc(C)cn3c2)C1	ZINC001086384279	1359083759	/nfs/dbraw/zinc/08/37/59/1359083759.db2.gz	NMJWTWYNPAYCGQ-KOMQPUFPSA-N	0	3	331.847	3.098	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NC[C@H]1C[C@H](NCC(=C)Cl)C1	ZINC001086404848	1359089001	/nfs/dbraw/zinc/08/90/01/1359089001.db2.gz	QIXPZQQYOJEZJN-SHTZXODSSA-N	0	3	334.847	3.102	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cccc(-n3cccc3)c2)C1	ZINC001086420216	1359091802	/nfs/dbraw/zinc/09/18/02/1359091802.db2.gz	HZGFAVOODGXLLX-JCNLHEQBSA-N	0	3	343.858	3.328	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)[C@H]2CCC[C@H]2CC)C1	ZINC001086469124	1359109688	/nfs/dbraw/zinc/10/96/88/1359109688.db2.gz	CSFUQJBFNBWTKB-TUVASFSCSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2csc3c2CCCC3)C1	ZINC001086547984	1359141612	/nfs/dbraw/zinc/14/16/12/1359141612.db2.gz	OSJGTXHCCKQDFT-JOCQHMNTSA-N	0	3	338.904	3.477	20	30		EGEDHN
CC/C=C(/C)C(=O)N1CC[C@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001184030499	1387382850	/nfs/dbraw/zinc/38/28/50/1387382850.db2.gz	DMQDYBSYLBOFAK-KFBGUCGJSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CC[C@@H](N[C@H](C)c3cnccn3)C2)CC1	ZINC001086794864	1359203022	/nfs/dbraw/zinc/20/30/22/1359203022.db2.gz	OEWBDSMUJJGTNB-SOLBZPMBSA-N	0	3	342.487	3.159	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccc(F)c(OC)c2)C1	ZINC001086810339	1359205555	/nfs/dbraw/zinc/20/55/55/1359205555.db2.gz	LCMRIEYJDOXGPE-GXTWGEPZSA-N	0	3	340.826	3.075	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cc(C(C)C)no2)C1	ZINC001086819560	1359208426	/nfs/dbraw/zinc/20/84/26/1359208426.db2.gz	OYJKTKLZSGTQAE-QWHCGFSZSA-N	0	3	325.840	3.039	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)[C@H]2CCOc3ccccc32)C1	ZINC001086829550	1359210059	/nfs/dbraw/zinc/21/00/59/1359210059.db2.gz	FHOJAYLEHWPSEX-UXLLHSPISA-N	0	3	348.874	3.180	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cc3sccc3[nH]2)C1	ZINC001086845024	1359212147	/nfs/dbraw/zinc/21/21/47/1359212147.db2.gz	GPANJQGPKSNCCA-NWDGAFQWSA-N	0	3	337.876	3.470	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc(C)s3)C2)CC1	ZINC001086898159	1359227599	/nfs/dbraw/zinc/22/75/99/1359227599.db2.gz	BQRXQWYTDNFFFG-HNNXBMFYSA-N	0	3	330.497	3.396	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)/C=C/c3ccco3)C2)CC1	ZINC001086898134	1359227616	/nfs/dbraw/zinc/22/76/16/1359227616.db2.gz	BEKUIVOBWBNCJM-OZSKJFCKSA-N	0	3	326.440	3.019	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H]3C[C@@H]4C=C[C@H]3CC4)C2)CC1	ZINC001086925332	1359251029	/nfs/dbraw/zinc/25/10/29/1359251029.db2.gz	TVDIYFWENXUTRX-ZGXWSNOMSA-N	0	3	340.511	3.315	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cc4ccc(C)cc4[nH]3)C2)CC1	ZINC001086935528	1359258576	/nfs/dbraw/zinc/25/85/76/1359258576.db2.gz	UAKDUBIRIGTYGP-KRWDZBQOSA-N	0	3	349.478	3.426	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)[C@H](C)C(C)(F)F)C2)CC1	ZINC001086943059	1359264361	/nfs/dbraw/zinc/26/43/61/1359264361.db2.gz	IYSQCVYZVOVFGM-CABCVRRESA-N	0	3	326.431	3.004	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cnc4ccccc4c3)C2)CC1	ZINC001086945567	1359266643	/nfs/dbraw/zinc/26/66/43/1359266643.db2.gz	DXOBZHHUBZKTLE-KRWDZBQOSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)Cc3cc(C)ccc3F)C2)CC1	ZINC001086953789	1359274303	/nfs/dbraw/zinc/27/43/03/1359274303.db2.gz	SLEVWDGSAFROTL-QGZVFWFLSA-N	0	3	342.458	3.013	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)Cc3sc(C)cc3C)C2)CC1	ZINC001086954197	1359274841	/nfs/dbraw/zinc/27/48/41/1359274841.db2.gz	FIXVETBXCSVGJF-INIZCTEOSA-N	0	3	344.524	3.244	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc(OC)cc3)C2)CC1	ZINC001086954931	1359275496	/nfs/dbraw/zinc/27/54/96/1359275496.db2.gz	YPYBOSCIGDOWJK-KRWDZBQOSA-N	0	3	340.467	3.035	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc4ccccc4[nH]3)C2)CC1	ZINC001086956668	1359277841	/nfs/dbraw/zinc/27/78/41/1359277841.db2.gz	TXZVSBCUKHMHJK-MRXNPFEDSA-N	0	3	335.451	3.118	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@H](C)Cc3ccccc3)C2)CC1	ZINC001086957122	1359278086	/nfs/dbraw/zinc/27/80/86/1359278086.db2.gz	FNGGZUNODOZEKL-MOPGFXCFSA-N	0	3	338.495	3.201	20	30		EGEDHN
C[C@@H]1CCN(C(=O)C2CCC2)[C@H](CNCc2ccc(C#N)cc2F)C1	ZINC001087107224	1359287500	/nfs/dbraw/zinc/28/75/00/1359287500.db2.gz	LWYGXKJARNSIFQ-KDOFPFPSSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@@H]1CCN(C(=O)C(C)(C)F)[C@H](CNCc2ccc(C#N)c(F)c2)C1	ZINC001087108420	1359288229	/nfs/dbraw/zinc/28/82/29/1359288229.db2.gz	QOHXXZXJTIBMKA-CJNGLKHVSA-N	0	3	349.425	3.162	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC001087200060	1359318626	/nfs/dbraw/zinc/31/86/26/1359318626.db2.gz	LGKRNMHDLJZYIJ-XOKHGSTOSA-N	0	3	349.425	3.162	20	30		EGEDHN
CCC(=O)N[C@@H]1[C@H]2CCCN(Cc3ccc(C#N)cc3)[C@H]2C1(C)C	ZINC001087262609	1359332399	/nfs/dbraw/zinc/33/23/99/1359332399.db2.gz	GAHXCIADGHXGTG-BHIYHBOVSA-N	0	3	325.456	3.073	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccccc3F)C(C)(C)[C@@H]21	ZINC001087267116	1359338110	/nfs/dbraw/zinc/33/81/10/1359338110.db2.gz	VWUMHZJGHMJUPW-KBAYOESNSA-N	0	3	328.431	3.068	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc(C)s3)C(C)(C)[C@H]21	ZINC001087266586	1359338432	/nfs/dbraw/zinc/33/84/32/1359338432.db2.gz	NUIBVOGRXPLBJC-PVAVHDDUSA-N	0	3	330.497	3.299	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3csc(C)c3C)C(C)(C)[C@@H]21	ZINC001087288075	1359367171	/nfs/dbraw/zinc/36/71/71/1359367171.db2.gz	QZGBIISUBNGYKV-DJIMGWMZSA-N	0	3	330.497	3.217	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)Cc3ccccc3CC)C(C)(C)[C@H]21	ZINC001087290647	1359370109	/nfs/dbraw/zinc/37/01/09/1359370109.db2.gz	GJJJQBISHWJUDI-NRSPTQNISA-N	0	3	338.495	3.030	20	30		EGEDHN
C=CCN1CCC[C@@H]2[C@@H](NC(=O)c3ncc(Cl)s3)C(C)(C)[C@@H]21	ZINC001087294961	1359375219	/nfs/dbraw/zinc/37/52/19/1359375219.db2.gz	BKAHVCSAIYDUOC-RAIGVLPGSA-N	0	3	339.892	3.201	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3c(C)oc(C)c3C)C(C)(C)[C@H]21	ZINC001087295222	1359375780	/nfs/dbraw/zinc/37/57/80/1359375780.db2.gz	GFGFANBHVGBBGH-NJAFHUGGSA-N	0	3	328.456	3.057	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc[nH]c1C(C)C	ZINC001087300228	1359382510	/nfs/dbraw/zinc/38/25/10/1359382510.db2.gz	HYAQBQQQQOBFSE-NZSAHSFTSA-N	0	3	341.499	3.380	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3coc(C(F)F)c3)C(C)(C)[C@@H]21	ZINC001087300414	1359383521	/nfs/dbraw/zinc/38/35/21/1359383521.db2.gz	KJVJJAGNIJVFQK-BPLDGKMQSA-N	0	3	336.382	3.069	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3csc(C(C)C)n3)C(C)(C)[C@H]21	ZINC001087307639	1359394430	/nfs/dbraw/zinc/39/44/30/1359394430.db2.gz	DEISHGRBLBCYNT-KBMXLJTQSA-N	0	3	345.512	3.119	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cncc4ccccc43)C(C)(C)[C@H]21	ZINC001087317704	1359409208	/nfs/dbraw/zinc/40/92/08/1359409208.db2.gz	LQJCHGBWLKTWOP-RLLQIKCJSA-N	0	3	347.462	3.087	20	30		EGEDHN
C=CCN1CCC[C@@H]2[C@@H](NC(=O)c3scnc3Cl)C(C)(C)[C@@H]21	ZINC001087320015	1359412877	/nfs/dbraw/zinc/41/28/77/1359412877.db2.gz	XPJPSTGLKBJLLZ-RAIGVLPGSA-N	0	3	339.892	3.201	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cccc4c3CCC4)C(C)(C)[C@H]21	ZINC001087320018	1359412941	/nfs/dbraw/zinc/41/29/41/1359412941.db2.gz	XSGANMDPIHTOSQ-AABGKKOBSA-N	0	3	336.479	3.027	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cnc(C(C)C)s1	ZINC001087320437	1359413178	/nfs/dbraw/zinc/41/31/78/1359413178.db2.gz	DUURQMCQAYFHAL-VNQPRFMTSA-N	0	3	345.512	3.119	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)[C@@H](C)C2CCC2)C1	ZINC001087430675	1359462623	/nfs/dbraw/zinc/46/26/23/1359462623.db2.gz	BMFXIWJCYFNDEX-IOMROCGXSA-N	0	3	338.495	3.420	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)[C@@H]2CCC2(F)F)C1	ZINC001087430319	1359462785	/nfs/dbraw/zinc/46/27/85/1359462785.db2.gz	IXBPJBXAVLCOON-FGTMMUONSA-N	0	3	346.421	3.029	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccoc2C(F)(F)F)[C@H]1CC	ZINC001087587009	1359544530	/nfs/dbraw/zinc/54/45/30/1359544530.db2.gz	QCWBWYGISPAVBI-QWHCGFSZSA-N	0	3	330.350	3.457	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2occc2Br)[C@H]1CC	ZINC001087764849	1359634325	/nfs/dbraw/zinc/63/43/25/1359634325.db2.gz	MSKBVHATHSOQSG-QWHCGFSZSA-N	0	3	341.249	3.201	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CN(C(=O)C[C@@H]4C=CCC4)C[C@@H]3C2)cc1	ZINC001087880153	1359694348	/nfs/dbraw/zinc/69/43/48/1359694348.db2.gz	VLSAHBGRFHZNCP-UIFIKXQLSA-N	0	3	349.478	3.195	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)CCc3ccc(C)cc3C)C[C@@H]2C1	ZINC001088057798	1359737960	/nfs/dbraw/zinc/73/79/60/1359737960.db2.gz	RMSQZPANDZZPTI-RTWAWAEBSA-N	0	3	338.495	3.040	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)[C@@H](C)c3ccc(Cl)cc3)C[C@@H]2C1	ZINC001088090531	1359752733	/nfs/dbraw/zinc/75/27/33/1359752733.db2.gz	UAPIBWYVTIFVQY-JQHSSLGASA-N	0	3	344.886	3.247	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CCN(Cc4scnc4C)C[C@H]3C2)C1	ZINC001088098612	1359755718	/nfs/dbraw/zinc/75/57/18/1359755718.db2.gz	SFKLWNOQEHFIQS-CVEARBPZSA-N	0	3	345.512	3.088	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)[C@@H](CC)CC3CCCC3)C[C@@H]2C1	ZINC001088128241	1359766948	/nfs/dbraw/zinc/76/69/48/1359766948.db2.gz	GGBZCAVAAISZRP-ZCNNSNEGSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3[nH]ccc3-c3ccccc3)C[C@@H]2C1	ZINC001088168016	1359779045	/nfs/dbraw/zinc/77/90/45/1359779045.db2.gz	FFTZEKVOKWRTGF-MOPGFXCFSA-N	0	3	347.462	3.099	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3ccc(Cl)c(Cl)c3)C[C@@H]2C1	ZINC001088180681	1359783637	/nfs/dbraw/zinc/78/36/37/1359783637.db2.gz	VEMZVSRWNXQRAX-KGLIPLIRSA-N	0	3	337.250	3.021	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3cc(C)n(C(C)C)c3C)C[C@@H]2C1	ZINC001088194937	1359790561	/nfs/dbraw/zinc/79/05/61/1359790561.db2.gz	DXZZSJMRYFCRDQ-MOPGFXCFSA-N	0	3	341.499	3.103	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)CCc3cc(C)sc3C)C[C@@H]2C1	ZINC001088215946	1359799138	/nfs/dbraw/zinc/79/91/38/1359799138.db2.gz	JCPKKJFZAJNKAP-MOPGFXCFSA-N	0	3	344.524	3.101	20	30		EGEDHN
C=CCN1CC[C@@H](OCC2CCN(C(=O)c3cc(C)oc3C)CC2)C1	ZINC001088228030	1359806886	/nfs/dbraw/zinc/80/68/86/1359806886.db2.gz	GEVBKTNIZVJRFA-GOSISDBHSA-N	0	3	346.471	3.026	20	30		EGEDHN
C=CCN1CC[C@@H](OCC2CCN(C(=O)c3ccc(C)cc3)CC2)C1	ZINC001088239880	1359810396	/nfs/dbraw/zinc/81/03/96/1359810396.db2.gz	JNPJZDXZQCWBGQ-HXUWFJFHSA-N	0	3	342.483	3.124	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCCCC[C@@H](NCC(=C)Cl)C2)cc1	ZINC001088357573	1359841499	/nfs/dbraw/zinc/84/14/99/1359841499.db2.gz	FLOGURXIRWPFBT-GOSISDBHSA-N	0	3	330.859	3.395	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCCC[C@H](NCc2cc(OC)ccn2)C1	ZINC001088360291	1359844185	/nfs/dbraw/zinc/84/41/85/1359844185.db2.gz	VKHGZZVUCYIPAR-INIZCTEOSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCCCC[C@@H](NCc2cn(C)nc2C)C1	ZINC001088374685	1359855902	/nfs/dbraw/zinc/85/59/02/1359855902.db2.gz	NPZCPZYNMVFJSS-QUCCMNQESA-N	0	3	346.519	3.192	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2ccn(C)c2CC)C1	ZINC001088381528	1359865553	/nfs/dbraw/zinc/86/55/53/1359865553.db2.gz	GQIXBZCUHQAUQE-OAHLLOKOSA-N	0	3	337.895	3.314	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2cnn(C(F)F)c2)C1	ZINC001088405873	1359877574	/nfs/dbraw/zinc/87/75/74/1359877574.db2.gz	IFEWFTJOZDFDQB-CYBMUJFWSA-N	0	3	346.809	3.005	20	30		EGEDHN
C[C@@H]1[C@@H](NC(=O)c2ccc(C#N)[nH]2)CCN1Cc1ccc(C2CC2)cc1	ZINC001088529883	1359960418	/nfs/dbraw/zinc/96/04/18/1359960418.db2.gz	SQRWBFBLRVJCAN-KUHUBIRLSA-N	0	3	348.450	3.157	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cc(F)c(Cl)cc2F)[C@H]1C	ZINC001088829175	1360066816	/nfs/dbraw/zinc/06/68/16/1360066816.db2.gz	HQJUSSWJGKAFLS-BMIGLBTASA-N	0	3	328.790	3.387	20	30		EGEDHN
Cc1cc(CN(C)C[C@@H]2CCCCN2C(=O)[C@@H](C)C#N)c(C)s1	ZINC001089136940	1360195793	/nfs/dbraw/zinc/19/57/93/1360195793.db2.gz	QYHCQCUQCMCABJ-GUYCJALGSA-N	0	3	333.501	3.338	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cccc3scnc32)CC(C)(C)C1	ZINC001089384380	1360386489	/nfs/dbraw/zinc/38/64/89/1360386489.db2.gz	PWHNABPSQKCJEJ-AWEZNQCLSA-N	0	3	341.480	3.150	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C2C3CC4CC(C3)CC2C4)CC(C)(C)C1	ZINC001089406528	1360404811	/nfs/dbraw/zinc/40/48/11/1360404811.db2.gz	NECPLZGUCGPNHW-BIKXEMDZSA-N	0	3	342.527	3.299	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2nc(C(C)(C)C)cs2)CC(C)(C)C1	ZINC001089410516	1360408617	/nfs/dbraw/zinc/40/86/17/1360408617.db2.gz	QTRRZAJDLXBYHD-CQSZACIVSA-N	0	3	347.528	3.294	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2c(C)cccc2Cl)CC(C)(C)C1	ZINC001089430511	1360422205	/nfs/dbraw/zinc/42/22/05/1360422205.db2.gz	NQXHHHAXRFKXJK-INIZCTEOSA-N	0	3	346.902	3.431	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc3ccccc3n2C)CC(C)(C)C1	ZINC001089476931	1360459526	/nfs/dbraw/zinc/45/95/26/1360459526.db2.gz	SXPSHKOGNXLCKQ-QGZVFWFLSA-N	0	3	337.467	3.032	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3cnc(C)o3)CC(C)(C)C2)C1	ZINC001089485478	1360466265	/nfs/dbraw/zinc/46/62/65/1360466265.db2.gz	MMAAJEAWHIJYQJ-INIZCTEOSA-N	0	3	345.487	3.446	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc3ccncc3c2)CC(C)(C)C1	ZINC001089531829	1360493101	/nfs/dbraw/zinc/49/31/01/1360493101.db2.gz	QKDTWAXQGIWOIG-LJQANCHMSA-N	0	3	335.451	3.088	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2oc(CC)cc2C)CC(C)(C)C1	ZINC001089538455	1360496803	/nfs/dbraw/zinc/49/68/03/1360496803.db2.gz	BXSBDRBXQPLDAP-INIZCTEOSA-N	0	3	330.472	3.394	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc3ccccc3n2)CC(C)(C)C1	ZINC001089547103	1360501595	/nfs/dbraw/zinc/50/15/95/1360501595.db2.gz	ZENDONVRSWYNDP-SFHVURJKSA-N	0	3	349.478	3.479	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2nc(C)c(C)s2)CC(C)(C)C1	ZINC001089557951	1360506609	/nfs/dbraw/zinc/50/66/09/1360506609.db2.gz	DMZOCOSWFMHVFR-OAHLLOKOSA-N	0	3	333.501	3.004	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccn(C(C)(C)C)n1	ZINC001089645853	1360558463	/nfs/dbraw/zinc/55/84/63/1360558463.db2.gz	BJIKGYPGOHEKSA-MRXNPFEDSA-N	0	3	346.519	3.435	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccsc1COC	ZINC001089659387	1360570460	/nfs/dbraw/zinc/57/04/60/1360570460.db2.gz	ZIKKYYPTMSLHSD-OAHLLOKOSA-N	0	3	348.512	3.138	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1c2c[nH]nc2ccc1C	ZINC001089664106	1360574108	/nfs/dbraw/zinc/57/41/08/1360574108.db2.gz	ZSFTXAQOBSTZKL-HNNXBMFYSA-N	0	3	340.471	3.278	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1nccc2occc21	ZINC001089675046	1360583287	/nfs/dbraw/zinc/58/32/87/1360583287.db2.gz	HCBMNOPTOPTBSA-CQSZACIVSA-N	0	3	327.428	3.234	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H]1CCc2cccnc21	ZINC001089687067	1360592502	/nfs/dbraw/zinc/59/25/02/1360592502.db2.gz	DTBOARCSZMBLME-MSOLQXFVSA-N	0	3	341.499	3.294	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1noc2c1CCCC2	ZINC001089702326	1360605530	/nfs/dbraw/zinc/60/55/30/1360605530.db2.gz	XQBZAYFQHIMSMV-HNNXBMFYSA-N	0	3	345.487	3.350	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1c(C)nn(CC)c1C	ZINC001089711388	1360615025	/nfs/dbraw/zinc/61/50/25/1360615025.db2.gz	SNRIXNUOYUYVNS-KRWDZBQOSA-N	0	3	346.519	3.316	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(NC(C)=O)cc1	ZINC001089725629	1360628215	/nfs/dbraw/zinc/62/82/15/1360628215.db2.gz	GERXTXAJNVVJQZ-SFHVURJKSA-N	0	3	343.471	3.051	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc2[nH]ccc2s1	ZINC001089726715	1360629801	/nfs/dbraw/zinc/62/98/01/1360629801.db2.gz	PAWTYBLJEDSSOD-CQSZACIVSA-N	0	3	343.496	3.473	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1[nH]nc2ccccc21	ZINC001089731476	1360635361	/nfs/dbraw/zinc/63/53/61/1360635361.db2.gz	RDRFPCSVRGQWKB-HNNXBMFYSA-N	0	3	340.471	3.359	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1c[nH]nc1-c1ccco1	ZINC001089735679	1360640385	/nfs/dbraw/zinc/64/03/85/1360640385.db2.gz	OEIIHULHVOIEFI-CQSZACIVSA-N	0	3	342.443	3.076	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)CC1CCCC1	ZINC001089762113	1360654027	/nfs/dbraw/zinc/65/40/27/1360654027.db2.gz	CNCCJMFSXLUYDA-MLHJIOFPSA-N	0	3	336.907	3.488	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](CNCc2nccs2)[C@@H](C)C1	ZINC001184461775	1387466515	/nfs/dbraw/zinc/46/65/15/1387466515.db2.gz	VOOBJSAYQGRGLZ-RDJZCZTQSA-N	0	3	347.528	3.486	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)C(F)=C(C)C)C1	ZINC001089789840	1360664397	/nfs/dbraw/zinc/66/43/97/1360664397.db2.gz	OSWXMPYAHKPYAY-AJNGGQMLSA-N	0	3	326.843	3.171	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](CNCc2cc(C)no2)[C@@H](C)C1	ZINC001184484875	1387469625	/nfs/dbraw/zinc/46/96/25/1387469625.db2.gz	DJKXDAYCPXDOMQ-GOEBONIOSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1(C(C)C)CC1	ZINC001089861828	1360706724	/nfs/dbraw/zinc/70/67/24/1360706724.db2.gz	KJQUIZWQHMEANW-NXOAAHMSSA-N	0	3	336.907	3.344	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1cc(C)[nH]c1C	ZINC001089868705	1360710694	/nfs/dbraw/zinc/71/06/94/1360710694.db2.gz	FITRGDYRLUKOSQ-OWLYRPNTSA-N	0	3	347.890	3.166	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cccc(C)c2)CC2(CCOCC2)C1	ZINC001089920473	1360745247	/nfs/dbraw/zinc/74/52/47/1360745247.db2.gz	RVFUWLHEXVQNDH-LJQANCHMSA-N	0	3	342.483	3.172	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccccc2C)CC2(CCOCC2)C1	ZINC001089922815	1360746357	/nfs/dbraw/zinc/74/63/57/1360746357.db2.gz	SLGJQWJQKUGOOB-GOSISDBHSA-N	0	3	342.483	3.172	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C2C(C)(C)C2(C)C)CC2(CCOCC2)C1	ZINC001089932693	1360750483	/nfs/dbraw/zinc/75/04/83/1360750483.db2.gz	SKBLWZBGNBVTQS-MRXNPFEDSA-N	0	3	348.531	3.232	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)[C@@H]2CCCCC2(C)C)CC2(CCOCC2)C1	ZINC001089969309	1360772733	/nfs/dbraw/zinc/77/27/33/1360772733.db2.gz	IDLXICLVGTTXMB-MSOLQXFVSA-N	0	3	348.531	3.376	20	30		EGEDHN
CC[C@H](C)CC(=O)N1CC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001323848547	1387474995	/nfs/dbraw/zinc/47/49/95/1387474995.db2.gz	SQCKMCRSQTYEEB-UWJYYQICSA-N	0	3	339.483	3.419	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2oc(C(F)F)cc2C)C1	ZINC001091078664	1360989634	/nfs/dbraw/zinc/98/96/34/1360989634.db2.gz	GUUSQKQJNACMFB-UHFFFAOYSA-N	0	3	332.778	3.376	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cnc(-c3ccccc3)o2)C1	ZINC001091085997	1360990192	/nfs/dbraw/zinc/99/01/92/1360990192.db2.gz	MVJKPMMFROVDNI-UHFFFAOYSA-N	0	3	345.830	3.192	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(N(C)C(C)C)cc2)C1	ZINC001091388696	1361074841	/nfs/dbraw/zinc/07/48/41/1361074841.db2.gz	RCTVSVQSVZUXIO-UHFFFAOYSA-N	0	3	349.906	3.382	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C[C@@H](C)c3ccccc3C)C[C@]2(C)C1	ZINC001092069003	1361287447	/nfs/dbraw/zinc/28/74/47/1361287447.db2.gz	DPVKUEQLSSFSLH-KNKQGSTJSA-N	0	3	338.495	3.292	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc(C)c(F)cc3Cl)C[C@]2(C)C1	ZINC001092234741	1361335041	/nfs/dbraw/zinc/33/50/41/1361335041.db2.gz	LNNQGVLQOQGJDA-KUHUBIRLSA-N	0	3	348.849	3.205	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C2C=CC=CC=C2)CC1	ZINC001093369525	1361578653	/nfs/dbraw/zinc/57/86/53/1361578653.db2.gz	BMVHUXXJXVROIB-HXUWFJFHSA-N	0	3	336.479	3.011	20	30		EGEDHN
CC[C@@H](F)CN1CC2(CCC2)[C@H]1C1CCN(C(=O)C#CC2CC2)CC1	ZINC001093370760	1361579676	/nfs/dbraw/zinc/57/96/76/1361579676.db2.gz	YWWKKUZNUNUMBO-UYAOXDASSA-N	0	3	346.490	3.241	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)[C@H]2CC23CCCC3)CC1	ZINC001093381103	1361592287	/nfs/dbraw/zinc/59/22/87/1361592287.db2.gz	GRDISHHYJBPRSQ-RTBURBONSA-N	0	3	340.511	3.293	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H]1[C@@H](c3ccccc3)C1(C)C)C2	ZINC001095424252	1362135371	/nfs/dbraw/zinc/13/53/71/1362135371.db2.gz	JZPNXKHTWDLUKE-CXQPBAHBSA-N	0	3	336.479	3.171	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1c(Cl)oc3ccccc31)C2	ZINC001095901022	1362278532	/nfs/dbraw/zinc/27/85/32/1362278532.db2.gz	GVDOWAIPDZFTIK-SNPRPXQTSA-N	0	3	342.826	3.445	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](CNCc2cc(C)no2)[C@H](C)C1	ZINC001184935449	1387565298	/nfs/dbraw/zinc/56/52/98/1387565298.db2.gz	XAIKUHIPGDSCQC-SJLPKXTDSA-N	0	3	345.487	3.141	20	30		EGEDHN
C#CCN(C)CCCNC(=O)C(C)(C)c1ccc(Cl)c(Cl)c1	ZINC001324327382	1387592688	/nfs/dbraw/zinc/59/26/88/1387592688.db2.gz	RRQWKLJDLFNJDF-UHFFFAOYSA-N	0	3	341.282	3.342	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1ccc(C)c(Cl)c1)C2	ZINC001097319691	1362929887	/nfs/dbraw/zinc/92/98/87/1362929887.db2.gz	MKLMPQDGXKAXSY-NXHRZFHOSA-N	0	3	332.875	3.489	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](CNCc2nc(C)cs2)[C@@H](C)C1	ZINC001185061352	1387604484	/nfs/dbraw/zinc/60/44/84/1387604484.db2.gz	LSUZEELKKGTYGY-HOCLYGCPSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cnc(CC3CC3)s1)C2	ZINC001097579121	1363059894	/nfs/dbraw/zinc/05/98/94/1363059894.db2.gz	DIIWSOXHOJEERL-OAGGEKHMSA-N	0	3	345.512	3.397	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc3ncccc3s1)C2	ZINC001097638561	1363086118	/nfs/dbraw/zinc/08/61/18/1363086118.db2.gz	CXQTVSWTHSDDMH-NFAWXSAZSA-N	0	3	327.453	3.208	20	30		EGEDHN
C#CCN(C)CCCNC(=O)C1(c2ccc(C(C)C)cc2)CCC1	ZINC001324373548	1387612821	/nfs/dbraw/zinc/61/28/21/1387612821.db2.gz	MWOLSUFRYXNPCC-UHFFFAOYSA-N	0	3	326.484	3.303	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@]1(C)CCc3ccccc3C1)C2	ZINC001098532201	1363357149	/nfs/dbraw/zinc/35/71/49/1363357149.db2.gz	WLWOSGHUGIYYGL-JBPLPALLSA-N	0	3	338.495	3.479	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)C[C@@H](NC(=O)CC1CC1)c1ccccc1O2	ZINC001098541032	1363361912	/nfs/dbraw/zinc/36/19/12/1363361912.db2.gz	GHBFGUBBEJIUJI-NQIIRXRSSA-N	0	3	340.467	3.447	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1cc(C)sc1C)C[C@@H](C)O2	ZINC001098613843	1363399326	/nfs/dbraw/zinc/39/93/26/1363399326.db2.gz	DMYLYQDVOZNJOJ-CQSZACIVSA-N	0	3	348.512	3.246	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)C2C3CC4CC(C3)CC2C4)C1	ZINC001098875709	1363501615	/nfs/dbraw/zinc/50/16/15/1363501615.db2.gz	UWTJMCTTXYYWSF-HGBKEOBVSA-N	0	3	340.511	3.053	20	30		EGEDHN
Cc1ccc(CN2CC(C)(C)CC[C@@H]2CNC(=O)[C@@H](C)C#N)cc1	ZINC001098975695	1363550094	/nfs/dbraw/zinc/55/00/94/1363550094.db2.gz	MCFJMCBJVZWRQP-FUHWJXTLSA-N	0	3	327.472	3.262	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3CCC[C@]3(NC(=O)[C@H]3CC34CCC4)C2)cc1	ZINC001099055774	1363597922	/nfs/dbraw/zinc/59/79/22/1363597922.db2.gz	RLGIODYNINVSPD-JQVVWYNYSA-N	0	3	349.478	3.219	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC[C@H]1CCC(C)(C)CN1CCOCC	ZINC001099093335	1363617857	/nfs/dbraw/zinc/61/78/57/1363617857.db2.gz	OQJBHUAOYDADQZ-GOSISDBHSA-N	0	3	336.520	3.398	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cccn2C2CCCC2)C1	ZINC001099097134	1363620486	/nfs/dbraw/zinc/62/04/86/1363620486.db2.gz	OUWNXPLSVVCBQK-JXFKEZNVSA-N	0	3	327.472	3.374	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)C(C)(C)CC(F)F	ZINC001099106426	1363625592	/nfs/dbraw/zinc/62/55/92/1363625592.db2.gz	FPPDNTSMWSCMQV-CQSZACIVSA-N	0	3	328.447	3.298	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(C)n(CC3CC3)c2C)C1	ZINC001099121766	1363635792	/nfs/dbraw/zinc/63/57/92/1363635792.db2.gz	HAMGBJWCFREWMC-RXVVDRJESA-N	0	3	341.499	3.285	20	30		EGEDHN
C#CCN1C[C@@H]2CCC[C@]2(NC(=O)C[C@@H]2CCCc3ccccc32)C1	ZINC001099131465	1363643348	/nfs/dbraw/zinc/64/33/48/1363643348.db2.gz	ZPIBMVDZAVPZSJ-IPJJNNNSSA-N	0	3	336.479	3.101	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)C[C@@H]1C[C@H]1C1CC1	ZINC001099148489	1363655760	/nfs/dbraw/zinc/65/57/60/1363655760.db2.gz	DQZJATSCRHDPDT-OTWHNJEPSA-N	0	3	348.531	3.232	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccsc2)C[C@H]1C(F)(F)F	ZINC001099269608	1363724890	/nfs/dbraw/zinc/72/48/90/1363724890.db2.gz	OUXVHEUTVRKBIE-REWJHTLYSA-N	0	3	344.402	3.017	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)Cc1cc(F)ccc1OC	ZINC001099281328	1363730108	/nfs/dbraw/zinc/73/01/08/1363730108.db2.gz	SNMCTUHXKQFISU-KRWDZBQOSA-N	0	3	348.462	3.170	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(C)cc1	ZINC001099316250	1363746323	/nfs/dbraw/zinc/74/63/23/1363746323.db2.gz	PDJDBPVGBWHGKR-IBGZPJMESA-N	0	3	344.499	3.418	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@@H](C)c2ccc(C)o2)C[C@H]1C(F)(F)F	ZINC001099318154	1363747025	/nfs/dbraw/zinc/74/70/25/1363747025.db2.gz	HSZUEAMXJBFYJZ-BFHYXJOUSA-N	0	3	344.377	3.247	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)COc1ccccc1C	ZINC001099324697	1363750959	/nfs/dbraw/zinc/75/09/59/1363750959.db2.gz	QLGPNKPXEXWNJV-KRWDZBQOSA-N	0	3	330.472	3.167	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)COc1ccc(C)c(C)c1	ZINC001099340617	1363760257	/nfs/dbraw/zinc/76/02/57/1363760257.db2.gz	WLKRFUSNDQXBDC-GOSISDBHSA-N	0	3	344.499	3.475	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2cccc(C3CC3)c2)C[C@H]1C(F)(F)F	ZINC001099346797	1363763444	/nfs/dbraw/zinc/76/34/44/1363763444.db2.gz	LBNXTHHWDPEIJI-HZPDHXFCSA-N	0	3	338.373	3.343	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@@H]2CCCC(C)(C)C2)C[C@H]1C(F)(F)F	ZINC001099347453	1363764091	/nfs/dbraw/zinc/76/40/91/1363764091.db2.gz	LEGHLDSNIVBERT-MGPQQGTHSA-N	0	3	332.410	3.368	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)C23CC(C(C)(C)C)(C2)C3)C[C@H]1C(F)(F)F	ZINC001099348425	1363764862	/nfs/dbraw/zinc/76/48/62/1363764862.db2.gz	ZDFURGHGVNTQML-QJRTVWDNSA-N	0	3	344.421	3.368	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)CCc2ccc(C)s2)C[C@H]1C(F)(F)F	ZINC001099348191	1363765007	/nfs/dbraw/zinc/76/50/07/1363765007.db2.gz	CDUYFZDYEJWKPK-ZIAGYGMSSA-N	0	3	346.418	3.154	20	30		EGEDHN
CC(C)(F)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2ccccc2C#N)C1	ZINC001099356404	1363769862	/nfs/dbraw/zinc/76/98/62/1363769862.db2.gz	HFFJPPZYXGKFIG-PXNSSMCTSA-N	0	3	343.446	3.025	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1CCN(Cc2ccccc2C(C)C)C[C@H]1O	ZINC001099858428	1363966220	/nfs/dbraw/zinc/96/62/20/1363966220.db2.gz	LNMXASDYXRLEQE-VQTJNVASSA-N	0	3	344.499	3.218	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CCN(Cc2ccc(C(C)C)cc2)C[C@H]1O	ZINC001099944625	1363989138	/nfs/dbraw/zinc/98/91/38/1363989138.db2.gz	OXFMDZOGQBNBTF-RTBURBONSA-N	0	3	344.499	3.074	20	30		EGEDHN
O=C(C=C1CCC1)NCC1CC(NCC#Cc2cccc(Cl)c2)C1	ZINC001100240200	1364054619	/nfs/dbraw/zinc/05/46/19/1364054619.db2.gz	IJEAZZIZHNKKBB-UHFFFAOYSA-N	0	3	342.870	3.286	20	30		EGEDHN
CC[C@@H](C)CC(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100280988	1364066399	/nfs/dbraw/zinc/06/63/99/1364066399.db2.gz	QFGZIPFJMYGUFH-LSJNQWAISA-N	0	3	330.447	3.098	20	30		EGEDHN
CC[C@H](C)CC(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1	ZINC001100282396	1364066820	/nfs/dbraw/zinc/06/68/20/1364066820.db2.gz	KHZWDUVNRHAWGD-KTAKPFMOSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)Cc2ccc3cccnc3c2)C1	ZINC001100436506	1364113497	/nfs/dbraw/zinc/11/34/97/1364113497.db2.gz	AFXBAUOFQWZNNQ-UHFFFAOYSA-N	0	3	343.858	3.014	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)Cc2cccc3ncccc23)C1	ZINC001100503499	1364138316	/nfs/dbraw/zinc/13/83/16/1364138316.db2.gz	FAJIRRRBXIUXLJ-UHFFFAOYSA-N	0	3	343.858	3.014	20	30		EGEDHN
C=CC(C)(C)C(=O)NCC1CC(NCC#Cc2ccccc2Cl)C1	ZINC001100568867	1364166401	/nfs/dbraw/zinc/16/64/01/1364166401.db2.gz	AKSFECSJAOAWDD-UHFFFAOYSA-N	0	3	344.886	3.388	20	30		EGEDHN
CC#CCCCC(=O)NCC1CC(NCc2cc(C)ccc2F)C1	ZINC001100591428	1364178169	/nfs/dbraw/zinc/17/81/69/1364178169.db2.gz	YEJQDZGRQHXNLQ-UHFFFAOYSA-N	0	3	330.447	3.312	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC2CC(NCc3cccc(Cl)n3)C2)C1	ZINC001100661546	1364208567	/nfs/dbraw/zinc/20/85/67/1364208567.db2.gz	ZUNHNEVCRYOPSN-UHFFFAOYSA-N	0	3	333.863	3.076	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC1CC(NCc2c(C)nsc2C)C1	ZINC001100711379	1364230841	/nfs/dbraw/zinc/23/08/41/1364230841.db2.gz	MQPROCZHGMYFJN-UHFFFAOYSA-N	0	3	335.517	3.347	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)C[C@@H](CC)C(C)C)C1	ZINC001100887682	1364313023	/nfs/dbraw/zinc/31/30/23/1364313023.db2.gz	NGXZLYKVGFPZRS-SHARSMKWSA-N	0	3	345.325	3.452	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)CCCOc2ccccc2)C1	ZINC001100944086	1364341131	/nfs/dbraw/zinc/34/11/31/1364341131.db2.gz	OPGPTWJKIHEHIL-UHFFFAOYSA-N	0	3	336.863	3.083	20	30		EGEDHN
CCC(C)(CC)C(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001101004572	1364367367	/nfs/dbraw/zinc/36/73/67/1364367367.db2.gz	AAZWZJJFXNZBQV-UHFFFAOYSA-N	0	3	326.484	3.349	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C2(c3ccccc3C)CC2)C1	ZINC001101073533	1364400330	/nfs/dbraw/zinc/40/03/30/1364400330.db2.gz	RCODZGRWQMIUTJ-UHFFFAOYSA-N	0	3	332.875	3.264	20	30		EGEDHN
C=CCCC(=O)NCc1cc(O[C@@H]2CCN(CC=C(C)C)C2)ccn1	ZINC001101090879	1364408320	/nfs/dbraw/zinc/40/83/20/1364408320.db2.gz	QKAQJHXVMLJBAO-LJQANCHMSA-N	0	3	343.471	3.083	20	30		EGEDHN
C=CCCCC(=O)NCc1cc(O[C@@H]2CCN(CC(=C)C)C2)ccn1	ZINC001101095516	1364411749	/nfs/dbraw/zinc/41/17/49/1364411749.db2.gz	KCNPEPUTPYJLSV-LJQANCHMSA-N	0	3	343.471	3.083	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@H]2CN(Cc3ccc(C#N)cc3)C[C@@]2(C)C1	ZINC001101203280	1364461577	/nfs/dbraw/zinc/46/15/77/1364461577.db2.gz	OYXJXNNOZDHACO-IRLDBZIGSA-N	0	3	349.478	3.032	20	30		EGEDHN
CC[C@@H](C)CC(=O)N1C[C@H]2CN(Cc3ccc(C#N)cc3)C[C@@]2(C)C1	ZINC001101215239	1364467014	/nfs/dbraw/zinc/46/70/14/1364467014.db2.gz	LXNABIVMRDKFTN-BSIFCXSSSA-N	0	3	339.483	3.275	20	30		EGEDHN
C#CCCCC(=O)N1C[C@H]2CN(Cc3cc(C)ccc3F)C[C@@]2(C)C1	ZINC001101217951	1364468531	/nfs/dbraw/zinc/46/85/31/1364468531.db2.gz	MRWVFNBEFZIJNZ-NQIIRXRSSA-N	0	3	342.458	3.218	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1C[C@H]2CN(Cc3cccc(F)c3)C[C@@]2(C)C1	ZINC001101229028	1364475926	/nfs/dbraw/zinc/47/59/26/1364475926.db2.gz	HCHCYSSKDDXLJA-UTKZUKDTSA-N	0	3	342.458	3.156	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N1C[C@H]2CN(Cc3ccc(C#N)cc3)C[C@@]2(C)C1	ZINC001101328885	1364511066	/nfs/dbraw/zinc/51/10/66/1364511066.db2.gz	VHXDEZDTUJIPTA-SEQWBOFDSA-N	0	3	349.478	3.361	20	30		EGEDHN
C=CC1(CC(=O)N2C[C@H]3CN(CC#CC)C[C@@]3(C)C2)CCCCC1	ZINC001101390602	1364542115	/nfs/dbraw/zinc/54/21/15/1364542115.db2.gz	DSENBFVBKQJTND-QUCCMNQESA-N	0	3	328.500	3.317	20	30		EGEDHN
C=CCCC(=O)N1CCC(C(C)(C)CNCc2ccn(CC)n2)CC1	ZINC001101519465	1364595577	/nfs/dbraw/zinc/59/55/77/1364595577.db2.gz	HCYMKQOJTMVPNO-UHFFFAOYSA-N	0	3	346.519	3.224	20	30		EGEDHN
C=CCCC(=O)N1CCC(C(C)(C)CNCc2nccs2)CC1	ZINC001101519573	1364595642	/nfs/dbraw/zinc/59/56/42/1364595642.db2.gz	LBHXQOXXPJNQKY-UHFFFAOYSA-N	0	3	335.517	3.464	20	30		EGEDHN
C=CCC[C@H](C)N1CC2(C1)C[C@@H](NC(=O)CCCCC)c1nccn12	ZINC001101609101	1364654274	/nfs/dbraw/zinc/65/42/74/1364654274.db2.gz	UBSSIYSRVLZNIX-DLBZAZTESA-N	0	3	344.503	3.390	20	30		EGEDHN
C=CCC[C@H](C)N1CC2(C1)C[C@H](NC(=O)C(C)(C)C=C)c1nccn12	ZINC001101637375	1364663673	/nfs/dbraw/zinc/66/36/73/1364663673.db2.gz	KQSFNIHYACIEMQ-HOTGVXAUSA-N	0	3	342.487	3.022	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@H]1CC2(CN(CCC(C)C)C2)n2ccnc21	ZINC001101639724	1364666476	/nfs/dbraw/zinc/66/64/76/1364666476.db2.gz	MCAMAKZVHITFAS-SJORKVTESA-N	0	3	344.503	3.103	20	30		EGEDHN
CCCCCC(=O)NC[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1C	ZINC001101723200	1364703704	/nfs/dbraw/zinc/70/37/04/1364703704.db2.gz	RIMYKXAYYSQHNW-CRAIPNDOSA-N	0	3	345.462	3.462	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1CNC(=O)CC1CCC1	ZINC001101856938	1364752730	/nfs/dbraw/zinc/75/27/30/1364752730.db2.gz	QIMWEGXPJKATPD-VQIMIIECSA-N	0	3	342.458	3.052	20	30		EGEDHN
C/C=C(/C)C(=O)NC[C@@H]1CN(CC#Cc2ccc(Cl)cc2)C[C@H]1C	ZINC001101861375	1364754829	/nfs/dbraw/zinc/75/48/29/1364754829.db2.gz	ADBOLVURTWHOJT-BJBSRSQVSA-N	0	3	344.886	3.342	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C	ZINC001102005131	1364807921	/nfs/dbraw/zinc/80/79/21/1364807921.db2.gz	VWYRKYBIMCTFHP-UYAOXDASSA-N	0	3	338.495	3.325	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@@H]1CN(Cc2cc(C)ns2)C[C@H]1C	ZINC001102006659	1364809570	/nfs/dbraw/zinc/80/95/70/1364809570.db2.gz	NQNMIQSXMHYMHS-UKRRQHHQSA-N	0	3	335.517	3.238	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1CNC(=O)CC1(C)CC1	ZINC001102162808	1364903346	/nfs/dbraw/zinc/90/33/46/1364903346.db2.gz	IWQMGMCKTRXFHH-RHSMWYFYSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H]1CN(Cc2cn(C(C)C)nc2C)C[C@H]1C	ZINC001102229932	1364947081	/nfs/dbraw/zinc/94/70/81/1364947081.db2.gz	KNXIHSTUGCKAFM-NVXWUHKLSA-N	0	3	346.519	3.169	20	30		EGEDHN
C=CCCC1(C(=O)NC[C@@H]2CN(Cc3ccccn3)C[C@H]2C)CC1	ZINC001102326322	1365002569	/nfs/dbraw/zinc/00/25/69/1365002569.db2.gz	NEFKQVVTSCPUMV-IAGOWNOFSA-N	0	3	327.472	3.012	20	30		EGEDHN
C[C@@H](C(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C)C(C)(F)F	ZINC001102382313	1365032761	/nfs/dbraw/zinc/03/27/61/1365032761.db2.gz	XWVDNBGIRRZXDA-SOLBZPMBSA-N	0	3	348.437	3.014	20	30		EGEDHN
C[C@@H](CC(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C)C1CC1	ZINC001102604453	1365133384	/nfs/dbraw/zinc/13/33/84/1365133384.db2.gz	WLLKQMNHCPEBMT-SQWLQELKSA-N	0	3	345.512	3.240	20	30		EGEDHN
CCC(=O)NCC[C@@H]1CN(CC#Cc2ccc(Cl)cc2)C[C@H]1C	ZINC001102626750	1365141679	/nfs/dbraw/zinc/14/16/79/1365141679.db2.gz	TVSXFTOBVDRSQO-NVXWUHKLSA-N	0	3	332.875	3.176	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)[C@@H](C)OCCCC)C1	ZINC001102748056	1365200292	/nfs/dbraw/zinc/20/02/92/1365200292.db2.gz	QFNKTZBWKKMAKZ-FVQBIDKESA-N	0	3	330.900	3.018	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1CCNC(=O)[C@@H]1CC1(C)C	ZINC001102870326	1365262418	/nfs/dbraw/zinc/26/24/18/1365262418.db2.gz	YUAILLQCWYMGMT-SUMDDJOVSA-N	0	3	339.483	3.179	20	30		EGEDHN
C#CCCCC(=O)NCC[C@@H]1CN(Cc2ccnc(Cl)c2)C[C@H]1C	ZINC001102916996	1365290979	/nfs/dbraw/zinc/29/09/79/1365290979.db2.gz	HRIVYDUILAPGJL-NVXWUHKLSA-N	0	3	347.890	3.113	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cc(C)cs2)C1	ZINC001102950235	1365311677	/nfs/dbraw/zinc/31/16/77/1365311677.db2.gz	OBAIORMKQOFWDZ-TZMCWYRMSA-N	0	3	326.893	3.497	20	30		EGEDHN
C[C@@H]1CN(Cc2cc(C#N)ccc2F)C[C@H]1CCNC(=O)C1(C)CC1	ZINC001103013732	1365337289	/nfs/dbraw/zinc/33/72/89/1365337289.db2.gz	MMKZDVHIQBWXLZ-GDBMZVCRSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cccc3c[nH]nc32)C1	ZINC001103301065	1365482153	/nfs/dbraw/zinc/48/21/53/1365482153.db2.gz	OZQLKQAKPLSLHC-IUODEOHRSA-N	0	3	346.862	3.003	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)[C@@H](C)C(F)(F)F)C1	ZINC001103325728	1365496343	/nfs/dbraw/zinc/49/63/43/1365496343.db2.gz	SSWZITVISNICDX-YUSALJHKSA-N	0	3	326.790	3.012	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC[C@@H]2CN([C@H](C)c3ncc(C)o3)C[C@H]2C)C1	ZINC001103418625	1365549527	/nfs/dbraw/zinc/54/95/27/1365549527.db2.gz	RHHWOTCPLVYDFX-DJIMGWMZSA-N	0	3	345.487	3.475	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cccc3c2OCC3)C1	ZINC001103461925	1365575878	/nfs/dbraw/zinc/57/58/78/1365575878.db2.gz	BOOAKDYSKOSKCL-CZUORRHYSA-N	0	3	348.874	3.062	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)C2(C)CC(F)(F)C2)C1	ZINC001103634542	1365692607	/nfs/dbraw/zinc/69/26/07/1365692607.db2.gz	WYWPHJQZXFCYCV-DGCLKSJQSA-N	0	3	334.838	3.249	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)C[C@H](C)n2cccc2)C1	ZINC001103657267	1365706764	/nfs/dbraw/zinc/70/67/64/1365706764.db2.gz	YFPODKRKYMNYAX-HYVNUMGLSA-N	0	3	337.895	3.266	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2[nH]ccc2C2CC2)C[C@H]1C	ZINC001104278384	1365975782	/nfs/dbraw/zinc/97/57/82/1365975782.db2.gz	TXRPMMUFQOVHEU-IUODEOHRSA-N	0	3	335.879	3.332	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2nccc3occc32)C[C@H]1C	ZINC001104439909	1366030049	/nfs/dbraw/zinc/03/00/49/1366030049.db2.gz	XRRXCOYWMGJNKJ-TZMCWYRMSA-N	0	3	347.846	3.268	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cc(OC)cs2)C[C@H]1C	ZINC001104478617	1366043114	/nfs/dbraw/zinc/04/31/14/1366043114.db2.gz	SGSFTCXKOLFKCJ-DGCLKSJQSA-N	0	3	342.892	3.197	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H](C)[C@H](CCNCc2cnc(C)o2)C1	ZINC001104563927	1366078610	/nfs/dbraw/zinc/07/86/10/1366078610.db2.gz	ZFTZVQVZYKHSHY-BFYDXBDKSA-N	0	3	333.476	3.160	20	30		EGEDHN
C[C@@H]1CN(C(=O)C(C)(C)C)C[C@H]1CCNCc1cc(C#N)ccc1F	ZINC001104939836	1366231906	/nfs/dbraw/zinc/23/19/06/1366231906.db2.gz	JAMUKAGBJBINJQ-GDBMZVCRSA-N	0	3	345.462	3.318	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)CCCn2cccc2)C[C@H]1C	ZINC001105050648	1366293198	/nfs/dbraw/zinc/29/31/98/1366293198.db2.gz	UHUJYTRUFOQXJA-NVXWUHKLSA-N	0	3	337.895	3.095	20	30		EGEDHN
CC/C=C(\C)C(=O)N1CC(n2cc(CNCCCCCCC)nn2)C1	ZINC001105183153	1366360748	/nfs/dbraw/zinc/36/07/48/1366360748.db2.gz	DUOSPCBRSLSSBL-MHWRWJLKSA-N	0	3	347.507	3.078	20	30		EGEDHN
CC#CC[NH2+]CC1([C@H]2CCCCN2C(=O)c2ccccc2[O-])CCC1	ZINC001105509348	1366500344	/nfs/dbraw/zinc/50/03/44/1366500344.db2.gz	XLWSXQPAZSZROU-LJQANCHMSA-N	0	3	340.467	3.170	20	30		EGEDHN
CC/C=C(/C)C(=O)N1C[C@@H](CNCc2cc(F)ccc2C#N)[C@H](C)C1	ZINC001105895825	1366597073	/nfs/dbraw/zinc/59/70/73/1366597073.db2.gz	JATOBUMHSUIWML-DZLAQPFJSA-N	0	3	343.446	3.238	20	30		EGEDHN
CC/C=C(/C)C(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001105898038	1366597632	/nfs/dbraw/zinc/59/76/32/1366597632.db2.gz	SWEGHMUXUBYXIG-HHNZGKMASA-N	0	3	325.456	3.099	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](CNCc3ocnc3C)[C@H](C)C2)CCCC1	ZINC001107099375	1366874571	/nfs/dbraw/zinc/87/45/71/1366874571.db2.gz	FNJYJPNPVUPYCZ-NVXWUHKLSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@]12CCC[C@H]1N(Cc1cccnc1)CC2	ZINC001107495481	1366995071	/nfs/dbraw/zinc/99/50/71/1366995071.db2.gz	OVTMYRPTWWRMEU-YLJYHZDGSA-N	0	3	327.472	3.155	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CC[C@@H]1CCCC1(F)F	ZINC001109249664	1367025394	/nfs/dbraw/zinc/02/53/94/1367025394.db2.gz	INPDUZFSKTVCEO-YVSFHVDLSA-N	0	3	338.442	3.193	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2C[C@@H]1CCCCO1	ZINC001109329311	1367056336	/nfs/dbraw/zinc/05/63/36/1367056336.db2.gz	RNGDNIZUHDYZOR-XWSJACJDSA-N	0	3	332.488	3.045	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2C[C@H]1CCCCO1	ZINC001109329313	1367056644	/nfs/dbraw/zinc/05/66/44/1367056644.db2.gz	RNGDNIZUHDYZOR-YRXWBPOGSA-N	0	3	332.488	3.045	20	30		EGEDHN
C=C[C@@H](C(=O)NC[C@]12CCC[C@H]1N(CCF)CC2)c1ccccc1	ZINC001107640999	1367088591	/nfs/dbraw/zinc/08/85/91/1367088591.db2.gz	VEQQLCMIOXAOHG-QWFCFKBJSA-N	0	3	330.447	3.287	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2ccc(C)s2)C1	ZINC001107698340	1367107391	/nfs/dbraw/zinc/10/73/91/1367107391.db2.gz	OOYWPMIOIBJNBD-KDOFPFPSSA-N	0	3	336.501	3.232	20	30		EGEDHN
COCC#CCN[C@@H]1CCN(C(=O)[C@H](CC2CCCCC2)C(C)C)C1	ZINC001186042155	1387853556	/nfs/dbraw/zinc/85/35/56/1387853556.db2.gz	UGCMYMSXEJNXSU-WOJBJXKFSA-N	0	3	348.531	3.069	20	30		EGEDHN
CN(C/C=C/c1ccc(Cl)cc1)[C@H]1CCN(C(=O)C#CC2CC2)C1	ZINC001190037576	1367158355	/nfs/dbraw/zinc/15/83/55/1367158355.db2.gz	UNGJTGLRIKJSEL-PHXNAMCJSA-N	0	3	342.870	3.299	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](c1ccncc1)C(C)C)C2	ZINC001109643737	1367260981	/nfs/dbraw/zinc/26/09/81/1367260981.db2.gz	YETFXZNSJHJMQO-YDZRNGNQSA-N	0	3	327.472	3.119	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2C[C@@H](OC)c1ccccc1	ZINC001109657632	1367267353	/nfs/dbraw/zinc/26/73/53/1367267353.db2.gz	YEVLLVBGDFIFKK-FUMNGEBKSA-N	0	3	342.483	3.452	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CC[C@@H](N(C)Cc2ccc(F)cc2)C1)OCC	ZINC001190445547	1367268446	/nfs/dbraw/zinc/26/84/46/1367268446.db2.gz	YLJZCQFWDICDBQ-RTBURBONSA-N	0	3	348.462	3.230	20	30		EGEDHN
CC(C)CC1(C(=O)N2CC[C@H](N(C)Cc3ccc(C#N)cc3)C2)CC1	ZINC001190593603	1367301633	/nfs/dbraw/zinc/30/16/33/1367301633.db2.gz	BRLQOJWVZQAVIB-IBGZPJMESA-N	0	3	339.483	3.417	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)C2(CC=C)CCC2)C1	ZINC001108187983	1367331609	/nfs/dbraw/zinc/33/16/09/1367331609.db2.gz	PIGVXCUVBFOUIB-MJGOQNOKSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1scnc1C1CC1)C2	ZINC001109814272	1367337998	/nfs/dbraw/zinc/33/79/98/1367337998.db2.gz	VKZMVVPDCYBZJT-ILXRZTDVSA-N	0	3	331.485	3.322	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@]2(C)CN(CC3CCCCC3)CCO2)C1	ZINC001108201716	1367340290	/nfs/dbraw/zinc/34/02/90/1367340290.db2.gz	QUACADDRBHZGFY-FQEVSTJZSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2c(C)cccc2C)C1	ZINC001108236380	1367353761	/nfs/dbraw/zinc/35/37/61/1367353761.db2.gz	KQJJSGQXJAQSLB-GHTZIAJQSA-N	0	3	344.499	3.479	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)Cc2cccc(C(C)C)c2)C1	ZINC001191145606	1367432252	/nfs/dbraw/zinc/43/22/52/1367432252.db2.gz	XGDMCWCRNBBRPK-HXUWFJFHSA-N	0	3	344.499	3.088	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@H](C)c1ccccc1)C2	ZINC001110065817	1367491056	/nfs/dbraw/zinc/49/10/56/1367491056.db2.gz	KIORPXZJVMZACT-RNQOJCNYSA-N	0	3	342.483	3.104	20	30		EGEDHN
C=C[C@@H](C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCOC(C)C)c1ccccc1	ZINC001110136628	1367518605	/nfs/dbraw/zinc/51/86/05/1367518605.db2.gz	JPEOWLFVZURQDJ-ZRNYENFQSA-N	0	3	342.483	3.103	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CC[C@H]1CCc3ccccc31)C2	ZINC001110139312	1367521228	/nfs/dbraw/zinc/52/12/28/1367521228.db2.gz	NQGIONSSEOAVFG-QCFAMHMHSA-N	0	3	336.479	3.241	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N1CC[C@H](N(C)Cc2cccc(F)c2)C1	ZINC001191577043	1367532649	/nfs/dbraw/zinc/53/26/49/1367532649.db2.gz	OZNCSGUKQYPPBZ-ICSRJNTNSA-N	0	3	348.462	3.087	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccc(C)c(C)c1	ZINC001110184366	1367553219	/nfs/dbraw/zinc/55/32/19/1367553219.db2.gz	GZEXXLFCYMZWKE-RNQOJCNYSA-N	0	3	342.483	3.116	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](N(C)CCc2ccccc2F)C1	ZINC001191754544	1367577204	/nfs/dbraw/zinc/57/72/04/1367577204.db2.gz	QFRBDAKFFSFGSM-IBGZPJMESA-N	0	3	344.474	3.485	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001191868159	1367620938	/nfs/dbraw/zinc/62/09/38/1367620938.db2.gz	OZEINKCYLQEWTQ-LPHOPBHVSA-N	0	3	325.456	3.193	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](N(C)Cc2ccccc2N(C)C)C1	ZINC001191868086	1367621168	/nfs/dbraw/zinc/62/11/68/1367621168.db2.gz	NVPABBOUQDPMGC-HKUYNNGSSA-N	0	3	343.515	3.388	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](N(C)Cc2ccc(C)c(F)c2)C1	ZINC001191868468	1367622179	/nfs/dbraw/zinc/62/21/79/1367622179.db2.gz	UEBZPMRSECOUPT-GOSISDBHSA-N	0	3	330.447	3.360	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@@H](N(C)CCc2scnc2C)C1	ZINC001191889445	1367625929	/nfs/dbraw/zinc/62/59/29/1367625929.db2.gz	GLULCFRUFCJPHC-HZPDHXFCSA-N	0	3	335.517	3.129	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@@H](N(C)CCc2csc(C)n2)C1	ZINC001191889596	1367627007	/nfs/dbraw/zinc/62/70/07/1367627007.db2.gz	IPDHJBACWIQKTQ-NVXWUHKLSA-N	0	3	335.517	3.129	20	30		EGEDHN
C=CCN1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)C#CC(C)C)C1	ZINC001186179869	1387891231	/nfs/dbraw/zinc/89/12/31/1387891231.db2.gz	IHCMNIDSMNTFFI-UYAOXDASSA-N	0	3	342.458	3.193	20	30		EGEDHN
C=CCOCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccc(C(C)C)cc1	ZINC001110391618	1367685661	/nfs/dbraw/zinc/68/56/61/1367685661.db2.gz	WMLGLVFABQEJLJ-AQNXPRMDSA-N	0	3	342.483	3.234	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](N(C)C[C@@H](OC)c2ccccc2)C1	ZINC001192093423	1367685925	/nfs/dbraw/zinc/68/59/25/1367685925.db2.gz	JUMVNDIKBBENAS-RTBURBONSA-N	0	3	330.472	3.263	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](N(C)Cc2cccc(OC)c2)C1	ZINC001192586059	1367825377	/nfs/dbraw/zinc/82/53/77/1367825377.db2.gz	IAEBJFGWQIFPBW-KRWDZBQOSA-N	0	3	330.472	3.330	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](N(C)Cc2ccc(OC)cc2)C1	ZINC001192586656	1367827195	/nfs/dbraw/zinc/82/71/95/1367827195.db2.gz	SUXZJAKNQOHCGO-KRWDZBQOSA-N	0	3	330.472	3.330	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@@H](OCC)C1=CCCC1)C2	ZINC001110565781	1367837024	/nfs/dbraw/zinc/83/70/24/1367837024.db2.gz	NGJWSJLCBCIABE-AKHDSKFASA-N	0	3	332.488	3.190	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCCOC(C)C	ZINC001110601452	1367862376	/nfs/dbraw/zinc/86/23/76/1367862376.db2.gz	ZJLBBEIQMQSWQS-OAGGEKHMSA-N	0	3	342.911	3.302	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2C[C@H]1CCCCO1	ZINC001110601324	1367862559	/nfs/dbraw/zinc/86/25/59/1367862559.db2.gz	TUMYYGNFRZBZCU-FPCVCCKLSA-N	0	3	340.895	3.056	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)C2(CC(C)C)CCCC2)C1	ZINC001192896478	1367899098	/nfs/dbraw/zinc/89/90/98/1367899098.db2.gz	LNVZVLHDFOHARZ-SFHVURJKSA-N	0	3	336.520	3.328	20	30		EGEDHN
CCC(CC)CC(=O)N1CC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001193077957	1367937470	/nfs/dbraw/zinc/93/74/70/1367937470.db2.gz	PHFYVDWMXKNLBM-IBGZPJMESA-N	0	3	327.472	3.417	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1c(C)onc1C1CC1)C2	ZINC001110826568	1368011680	/nfs/dbraw/zinc/01/16/80/1368011680.db2.gz	RMMADESNIYYOHL-OAGGEKHMSA-N	0	3	329.444	3.162	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccc(COC)cc1	ZINC001110964266	1368127376	/nfs/dbraw/zinc/12/73/76/1368127376.db2.gz	BOVGGGVPIYVKGF-AQNXPRMDSA-N	0	3	342.483	3.411	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2cc3cccc(C)c3o2)C1	ZINC001194305456	1368227717	/nfs/dbraw/zinc/22/77/17/1368227717.db2.gz	LNHQASGJCBKYAP-QGZVFWFLSA-N	0	3	342.439	3.090	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)COc1cccc(Cl)c1)C2	ZINC001111376342	1368275977	/nfs/dbraw/zinc/27/59/77/1368275977.db2.gz	HHSDMKHUSYJOKU-OIISXLGYSA-N	0	3	334.847	3.016	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](N(C)C[C@H]3CCCCO3)C2)CCCC1	ZINC001194568556	1368288402	/nfs/dbraw/zinc/28/84/02/1368288402.db2.gz	UGLKEOKRKQRDJV-QZTJIDSGSA-N	0	3	334.504	3.225	20	30		EGEDHN
C/C(=C\C(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(C#N)cc1)C2)C1CC1	ZINC001111627352	1368388268	/nfs/dbraw/zinc/38/82/68/1368388268.db2.gz	MJVKAMKEDYMQPV-WPWQHHGMSA-N	0	3	349.478	3.385	20	30		EGEDHN
C=CCCC(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(C)c(OC)c1)C2	ZINC001111650295	1368411668	/nfs/dbraw/zinc/41/16/68/1368411668.db2.gz	MIQYXBHVRLWYGQ-RXVVDRJESA-N	0	3	342.483	3.441	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CCC[C@]3(NC(=O)CCC3CC3)C2)c1	ZINC001111672305	1368417816	/nfs/dbraw/zinc/41/78/16/1368417816.db2.gz	ZCPCMVDBSFSTRR-FPOVZHCZSA-N	0	3	337.467	3.219	20	30		EGEDHN
N#Cc1ccc(C(=O)N2CCCN(CC/C=C\c3ccccc3)CC2)[nH]1	ZINC001195497822	1368445941	/nfs/dbraw/zinc/44/59/41/1368445941.db2.gz	ROTKHVUZYDVKML-WTKPLQERSA-N	0	3	348.450	3.138	20	30		EGEDHN
C=C(C)CCC(=O)N[C@]12CCC[C@H]1CN(Cc1c(C)noc1CC)C2	ZINC001111764818	1368451493	/nfs/dbraw/zinc/45/14/93/1368451493.db2.gz	CYCMXXWOVKFPQT-JXFKEZNVSA-N	0	3	345.487	3.372	20	30		EGEDHN
Cc1cccc(CCCN2CCCN(C(=O)C#CC(C)C)CC2)c1	ZINC001195774895	1368487505	/nfs/dbraw/zinc/48/75/05/1368487505.db2.gz	GQTJXKPSEHTGHJ-UHFFFAOYSA-N	0	3	326.484	3.121	20	30		EGEDHN
C=CCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1ncccc1C)C2	ZINC001111855993	1368508607	/nfs/dbraw/zinc/50/86/07/1368508607.db2.gz	WCQWWPKYWQKEGV-PXNSSMCTSA-N	0	3	327.472	3.217	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2nn(C)cc2Cl)CC1	ZINC001195934393	1368519656	/nfs/dbraw/zinc/51/96/56/1368519656.db2.gz	ALERFRDOGVGPNP-UHFFFAOYSA-N	0	3	340.899	3.192	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H](CC)Cc2ccccc2)C1	ZINC001111889153	1368533674	/nfs/dbraw/zinc/53/36/74/1368533674.db2.gz	YPKWXOBNCBCVBI-URVUXULASA-N	0	3	338.495	3.249	20	30		EGEDHN
C=C(C)CN1CCCN(C(=O)CCOc2cc(C)cc(C)c2)CC1	ZINC001196072258	1368543349	/nfs/dbraw/zinc/54/33/49/1368543349.db2.gz	AHMMLFZHXVXFBN-UHFFFAOYSA-N	0	3	330.472	3.183	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cc3cccn3cn2)CC1	ZINC001196258688	1368578199	/nfs/dbraw/zinc/57/81/99/1368578199.db2.gz	DTOMAUKVIGEPQB-UHFFFAOYSA-N	0	3	342.487	3.453	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)CCc2ccc(CC)cc2)C1	ZINC001111978938	1368587486	/nfs/dbraw/zinc/58/74/86/1368587486.db2.gz	PTLZLFCTVWHXGF-UNMCSNQZSA-N	0	3	338.495	3.176	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2ccn3ccnc3c2)CC1	ZINC001196493352	1368628011	/nfs/dbraw/zinc/62/80/11/1368628011.db2.gz	UVEMNJVWYNQDTA-UHFFFAOYSA-N	0	3	340.471	3.229	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@@H](C(F)(F)F)[C@H](NCC=C(C)C)C1	ZINC001112086802	1368651267	/nfs/dbraw/zinc/65/12/67/1368651267.db2.gz	ULXYFXGXOAZTPG-HUUCEWRRSA-N	0	3	330.394	3.125	20	30		EGEDHN
C=CC1(CC(=O)N[C@@H]2CN(CC/C=C/CC)C[C@H]2O)CCCCC1	ZINC001196860442	1368702167	/nfs/dbraw/zinc/70/21/67/1368702167.db2.gz	GYHZVYYYSTXZOH-PJHKVULZSA-N	0	3	334.504	3.031	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cc(C)nc(OC)c2)CC1	ZINC001196926716	1368714756	/nfs/dbraw/zinc/71/47/56/1368714756.db2.gz	XWUXHXKZMSRTFS-UHFFFAOYSA-N	0	3	345.487	3.293	20	30		EGEDHN
C=CCC1(C(=O)N2CCCN(C[C@H](OC)C3CCC3)CC2)CCC1	ZINC001197076442	1368741280	/nfs/dbraw/zinc/74/12/80/1368741280.db2.gz	IBCLQMRTXHURHT-SFHVURJKSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2oc(CC(C)C)nc2C)CC1	ZINC001197402692	1368807079	/nfs/dbraw/zinc/80/70/79/1368807079.db2.gz	FMANKFGTYDSRQG-UHFFFAOYSA-N	0	3	333.476	3.296	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2occc2Br)CC1	ZINC001197461741	1368820717	/nfs/dbraw/zinc/82/07/17/1368820717.db2.gz	ZXLCCPTWYNXWQI-UHFFFAOYSA-N	0	3	341.249	3.156	20	30		EGEDHN
C#CCCCCC(=O)N1CCN(C[C@H]2CCc3ccccc3C2)CC1	ZINC001112774433	1368994807	/nfs/dbraw/zinc/99/48/07/1368994807.db2.gz	XBPMBDFHKFCLCW-IBGZPJMESA-N	0	3	338.495	3.129	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N1CCCN([C@H](CC)c2ccccc2)CC1	ZINC001198343012	1369012350	/nfs/dbraw/zinc/01/23/50/1369012350.db2.gz	FBVAQBWHSFBRTC-IEBWSBKVSA-N	0	3	330.472	3.263	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N1CCCN(Cc2ccccc2C2CC2)CC1	ZINC001198344683	1369013389	/nfs/dbraw/zinc/01/33/89/1369013389.db2.gz	WBCUIIRQEKROCI-QGZVFWFLSA-N	0	3	342.483	3.189	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)c1ccncc1)c1ccccc1OC	ZINC001198491586	1369044596	/nfs/dbraw/zinc/04/45/96/1369044596.db2.gz	IZHULCCENFNQRC-SFHVURJKSA-N	0	3	339.439	3.117	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)c1cccs1)c1ccccc1OC	ZINC001198505963	1369048278	/nfs/dbraw/zinc/04/82/78/1369048278.db2.gz	CCFAOKRYZXYUPG-OAHLLOKOSA-N	0	3	330.453	3.394	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)[C@@H](C)SC)c1ccccc1OC	ZINC001198555408	1369060386	/nfs/dbraw/zinc/06/03/86/1369060386.db2.gz	UQLCTSFTECNKRI-GDBMZVCRSA-N	0	3	336.501	3.160	20	30		EGEDHN
C=CCCC(=O)NC[C@H](NCCCCCOC)c1ccccc1OC	ZINC001198594681	1369067729	/nfs/dbraw/zinc/06/77/29/1369067729.db2.gz	AHIYICGQQWMRGT-SFHVURJKSA-N	0	3	348.487	3.225	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@H](C)OCCCC)c1ccccc1OC	ZINC001198595394	1369069381	/nfs/dbraw/zinc/06/93/81/1369069381.db2.gz	LESVDBUIWKGBFT-WMZOPIPTSA-N	0	3	348.487	3.223	20	30		EGEDHN
COc1ccccc1[C@@H](CNC(=O)[C@H](C)C#N)NCCCC(C)C	ZINC001198617323	1369074696	/nfs/dbraw/zinc/07/46/96/1369074696.db2.gz	NFYXWTRDCPCEOQ-NVXWUHKLSA-N	0	3	331.460	3.038	20	30		EGEDHN
COc1ccccc1[C@H](CNC(=O)[C@@H](C)C#N)NCCC(C)(C)C	ZINC001198617994	1369074831	/nfs/dbraw/zinc/07/48/31/1369074831.db2.gz	VEXQNSBYOFAYBC-HOCLYGCPSA-N	0	3	331.460	3.038	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)C1CC=CC1)c1ccccc1OC	ZINC001198627712	1369076719	/nfs/dbraw/zinc/07/67/19/1369076719.db2.gz	QQIJGAGPTIERCG-SFHVURJKSA-N	0	3	328.456	3.375	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)C[C@@H](C)SC)c1ccccc1OC	ZINC001198668836	1369087438	/nfs/dbraw/zinc/08/74/38/1369087438.db2.gz	VWAIJQXKERHHMC-GDBMZVCRSA-N	0	3	336.501	3.160	20	30		EGEDHN
C#CCCCC(=O)NC[C@@H](NCCCCC)c1ccccc1OC	ZINC001198695825	1369092615	/nfs/dbraw/zinc/09/26/15/1369092615.db2.gz	VGQBAHHPWTZGPR-GOSISDBHSA-N	0	3	330.472	3.436	20	30		EGEDHN
C#CCC1(C(=O)NC[C@@H](NC(C)C)c2ccccc2OC)CCC1	ZINC001198752406	1369105704	/nfs/dbraw/zinc/10/57/04/1369105704.db2.gz	OOKDMILRMSFCMX-QGZVFWFLSA-N	0	3	328.456	3.044	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)c1cc(F)c[nH]1)c1ccccc1OC	ZINC001198795134	1369116110	/nfs/dbraw/zinc/11/61/10/1369116110.db2.gz	AQOMSBKYJDMPRR-QGZVFWFLSA-N	0	3	345.418	3.189	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@]1(C)C[C@H]2C[C@H]2C1)c1ccccc1OC	ZINC001198806505	1369119109	/nfs/dbraw/zinc/11/91/09/1369119109.db2.gz	XJSHNTZGZDILQM-HPNQWNLUSA-N	0	3	342.483	3.454	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@H]1C[C@H]2C[C@H]2C1)c1ccccc1OC	ZINC001198857438	1369131800	/nfs/dbraw/zinc/13/18/00/1369131800.db2.gz	PJESPZNAQASPSN-MUQADHOPSA-N	0	3	328.456	3.064	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)Cc2cccc3ncccc23)CC1	ZINC001113095636	1369198685	/nfs/dbraw/zinc/19/86/85/1369198685.db2.gz	WWXMBBJQOKPXBW-KRWDZBQOSA-N	0	3	337.467	3.276	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)Cc2cccc3cccnc32)CC1	ZINC001113174537	1369244943	/nfs/dbraw/zinc/24/49/43/1369244943.db2.gz	PCFFDJSQPQWZRD-KRWDZBQOSA-N	0	3	337.467	3.276	20	30		EGEDHN
C=CCCC(=O)N1CCCO[C@H](CNCc2sccc2Cl)C1	ZINC001200083309	1369313303	/nfs/dbraw/zinc/31/33/03/1369313303.db2.gz	GJGWJQPOONHXTF-CYBMUJFWSA-N	0	3	342.892	3.075	20	30		EGEDHN
C#CCC1(C(=O)N2CCC(NCc3nc(C)sc3C)CC2)CCC1	ZINC001201002733	1369465476	/nfs/dbraw/zinc/46/54/76/1369465476.db2.gz	WZIVIMLPOVUICV-UHFFFAOYSA-N	0	3	345.512	3.034	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCCO[C@@H](CNCc2ccccc2F)C1	ZINC001201233388	1369501667	/nfs/dbraw/zinc/50/16/67/1369501667.db2.gz	PABRKXZBYWXBHQ-AEFFLSMTSA-N	0	3	348.462	3.135	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1CCN(C[C@H](C)CC(C)C)CC1	ZINC001113582000	1369502588	/nfs/dbraw/zinc/50/25/88/1369502588.db2.gz	SRRCINXASMYIHP-GOSISDBHSA-N	0	3	326.484	3.037	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)CCOc2ccccc2F)CC1	ZINC001113603493	1369512445	/nfs/dbraw/zinc/51/24/45/1369512445.db2.gz	JKSQCFDTIMTZBO-INIZCTEOSA-N	0	3	334.435	3.094	20	30		EGEDHN
CC(F)(F)CCC(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001201308329	1369514739	/nfs/dbraw/zinc/51/47/39/1369514739.db2.gz	SISUYXGTCQRIAZ-UHFFFAOYSA-N	0	3	335.398	3.074	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)Cn2ccc3ccccc32)CC1	ZINC001113644231	1369541018	/nfs/dbraw/zinc/54/10/18/1369541018.db2.gz	NAKSRPBHGFPSNS-KRWDZBQOSA-N	0	3	325.456	3.140	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)Cc2ccc(OCC=C)cc2)CC1	ZINC001113695228	1369569783	/nfs/dbraw/zinc/56/97/83/1369569783.db2.gz	UGGAYCLQXZKAPJ-GOSISDBHSA-N	0	3	342.483	3.293	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)c2c[nH]c3ccc(F)cc23)CC1	ZINC001113735196	1369595045	/nfs/dbraw/zinc/59/50/45/1369595045.db2.gz	JJPRLEOMUCUZCU-AWEZNQCLSA-N	0	3	329.419	3.420	20	30		EGEDHN
CCCCCCCN1CCO[C@@H]2[C@@H](COc3ncccn3)CC[C@H]21	ZINC001201776630	1369622211	/nfs/dbraw/zinc/62/22/11/1369622211.db2.gz	HPOLNODGGLWDCT-KZNAEPCWSA-N	0	3	333.476	3.305	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)Nc1ccccc1Br	ZINC001201986604	1369659717	/nfs/dbraw/zinc/65/97/17/1369659717.db2.gz	VBPFZJFYSGRVEN-LBPRGKRZSA-N	0	3	338.249	3.221	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC(NCc2cc(C3CC3)no2)CC1	ZINC001202123483	1369692871	/nfs/dbraw/zinc/69/28/71/1369692871.db2.gz	READANYFLQLYSR-AWEZNQCLSA-N	0	3	331.460	3.235	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@@H](NC(=O)CCC(C)C)C12CCC2	ZINC001202447572	1369774671	/nfs/dbraw/zinc/77/46/71/1369774671.db2.gz	JKAWJOYIXBQXAX-ZIAGYGMSSA-N	0	3	343.309	3.348	20	30		EGEDHN
C/C(=C/C(=O)N[C@@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2)C1CC1	ZINC001202573440	1369810020	/nfs/dbraw/zinc/81/00/20/1369810020.db2.gz	LYNTWDJFXCPEJO-JHGYCJGCSA-N	0	3	348.490	3.411	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@@H](NCc2nc(C)c(C)s2)C12CCC2	ZINC001202592178	1369815566	/nfs/dbraw/zinc/81/55/66/1369815566.db2.gz	RZIIYHWPDZCLKI-CABCVRRESA-N	0	3	333.501	3.243	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@@H](NCc2cc(C#N)ccc2F)C12CCC2	ZINC001202600395	1369819277	/nfs/dbraw/zinc/81/92/77/1369819277.db2.gz	UAWHAPGKFROLCZ-QZTJIDSGSA-N	0	3	341.430	3.181	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1C[C@H](NCC=C(Cl)Cl)C12CCC2	ZINC001202846376	1369906251	/nfs/dbraw/zinc/90/62/51/1369906251.db2.gz	KALYOYKTGYQJAT-STQMWFEESA-N	0	3	329.271	3.126	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1C[C@@H](NCc2oc(C)nc2C)C12CCC2	ZINC001202968135	1369940417	/nfs/dbraw/zinc/94/04/17/1369940417.db2.gz	JHYKKXRPZWHJOU-IAGOWNOFSA-N	0	3	345.487	3.411	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1C[C@@H](NCc2ccns2)C12CCC2	ZINC001202969409	1369940760	/nfs/dbraw/zinc/94/07/60/1369940760.db2.gz	PPWYZTWZGUOKKC-CABCVRRESA-N	0	3	333.501	3.262	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1C[C@H](NCc2c(C)onc2CC)C12CCC2	ZINC001202987694	1369946823	/nfs/dbraw/zinc/94/68/23/1369946823.db2.gz	OBFCQXAEYUMPTJ-ZWKOTPCHSA-N	0	3	345.487	3.419	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202988346	1369947510	/nfs/dbraw/zinc/94/75/10/1369947510.db2.gz	SABRDDMJLUKARK-UXHICEINSA-N	0	3	336.479	3.411	20	30		EGEDHN
N#Cc1ccccc1O[C@@H]1CCCN(Cc2cccc3nonc32)C1	ZINC001203141291	1369997218	/nfs/dbraw/zinc/99/72/18/1369997218.db2.gz	ZRYLIYFUOMOWJV-MRXNPFEDSA-N	0	3	334.379	3.138	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1C[C@@H](NCc2oc(CC)nc2C)C12CCC2	ZINC001203279913	1370058383	/nfs/dbraw/zinc/05/83/83/1370058383.db2.gz	CEGGSESAHBHLLG-CVEARBPZSA-N	0	3	345.487	3.275	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1[C@H]2CN(CCOc3cccc(C)c3)C[C@H]21	ZINC001114780783	1370076495	/nfs/dbraw/zinc/07/64/95/1370076495.db2.gz	LNHXCPHXHVOLPE-XODKDNOYSA-N	0	3	342.483	3.023	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)C2(C(F)F)CCC2)C12CCC2	ZINC001203311271	1370076920	/nfs/dbraw/zinc/07/69/20/1370076920.db2.gz	MMHQWPAEUHLCIS-NEPJUHHUSA-N	0	3	332.822	3.191	20	30		EGEDHN
CCC(C)(C)C(=O)N[C@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001203331888	1370086244	/nfs/dbraw/zinc/08/62/44/1370086244.db2.gz	JBQPQGWWROWXSL-MOPGFXCFSA-N	0	3	338.495	3.491	20	30		EGEDHN
CCC(C)(C)C(=O)N[C@@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001203331890	1370086458	/nfs/dbraw/zinc/08/64/58/1370086458.db2.gz	JBQPQGWWROWXSL-RBUKOAKNSA-N	0	3	338.495	3.491	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001203341892	1370090807	/nfs/dbraw/zinc/09/08/07/1370090807.db2.gz	UNJLCFXFKJBTEX-VQTJNVASSA-N	0	3	336.479	3.411	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H]2C[C@H](NCc3ccns3)C23CCC3)CC1	ZINC001203372895	1370103198	/nfs/dbraw/zinc/10/31/98/1370103198.db2.gz	GFMAOUOZDULHSI-HOTGVXAUSA-N	0	3	345.512	3.407	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2C[C@H](NCc3ccns3)C23CCC3)CC1	ZINC001203372897	1370103288	/nfs/dbraw/zinc/10/32/88/1370103288.db2.gz	GFMAOUOZDULHSI-JKSUJKDBSA-N	0	3	345.512	3.407	20	30		EGEDHN
CCC1(C(=O)N[C@H]2C[C@H](NCC#Cc3ccccc3)C23CCC3)CC1	ZINC001203387849	1370108720	/nfs/dbraw/zinc/10/87/20/1370108720.db2.gz	XUCQSPZTDBTYLT-OALUTQOASA-N	0	3	336.479	3.245	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CC[N@@H+](Cc3ccccc3[O-])C2)C1	ZINC001203550067	1370166183	/nfs/dbraw/zinc/16/61/83/1370166183.db2.gz	GQCKUYDNOYOTJT-LJQANCHMSA-N	0	3	330.428	3.003	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CC[N@H+](Cc3ccccc3[O-])C2)C1	ZINC001203550067	1370166184	/nfs/dbraw/zinc/16/61/84/1370166184.db2.gz	GQCKUYDNOYOTJT-LJQANCHMSA-N	0	3	330.428	3.003	20	30		EGEDHN
COc1cc(C#N)ccc1OC1CC[NH+](Cc2ccccc2[O-])CC1	ZINC001203558577	1370169420	/nfs/dbraw/zinc/16/94/20/1370169420.db2.gz	NKIATDGNHMTGDW-UHFFFAOYSA-N	0	3	338.407	3.316	20	30		EGEDHN
CCC[C@](C)(CC)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001115028410	1370223490	/nfs/dbraw/zinc/22/34/90/1370223490.db2.gz	MRGKTLOZNYOWJS-PXCRPINLSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)CCOc2ccccc2)C12CCC2	ZINC001203731092	1370239130	/nfs/dbraw/zinc/23/91/30/1370239130.db2.gz	NOGKQACJDMKRMA-DLBZAZTESA-N	0	3	348.874	3.225	20	30		EGEDHN
C=CCO[C@H]1CO[C@@]2(C1)CCCN(Cc1ccc(OC)c(C)c1)C2	ZINC001203896157	1370304601	/nfs/dbraw/zinc/30/46/01/1370304601.db2.gz	HWQFDPWUMRAVFM-UYAOXDASSA-N	0	3	331.456	3.330	20	30		EGEDHN
CC(C)CC(=O)NCC1(NCC#Cc2ccccc2)CCCCC1	ZINC001115385716	1370422893	/nfs/dbraw/zinc/42/28/93/1370422893.db2.gz	AHEZGRFBQZQLFU-UHFFFAOYSA-N	0	3	326.484	3.493	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H]2CN(CCOc3ccc(Cl)cc3)C[C@H]21	ZINC001187210276	1388071848	/nfs/dbraw/zinc/07/18/48/1388071848.db2.gz	SQDHOYRPEKTSIR-MAUKXSAKSA-N	0	3	348.874	3.218	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)C2CC=CC2)CCCCC1	ZINC001115459864	1370463567	/nfs/dbraw/zinc/46/35/67/1370463567.db2.gz	GYSYVLGVTYBEHI-UHFFFAOYSA-N	0	3	341.293	3.270	20	30		EGEDHN
CC(C)CCC(=O)N1CCC(CNCc2cc(F)ccc2C#N)CC1	ZINC001204435940	1370477056	/nfs/dbraw/zinc/47/70/56/1370477056.db2.gz	CPPPYVPPRWYBGV-UHFFFAOYSA-N	0	3	345.462	3.462	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CC[C@H]2CN(Cc3ccc(C)cc3)C[C@H]21	ZINC001187218032	1388074294	/nfs/dbraw/zinc/07/42/94/1388074294.db2.gz	XSCYQTDSIMJFSF-YSIASYRMSA-N	0	3	342.483	3.009	20	30		EGEDHN
CCc1noc(C)c1CNC1(CNC(=O)C#CC(C)C)CCCCC1	ZINC001115522557	1370521466	/nfs/dbraw/zinc/52/14/66/1370521466.db2.gz	RZZLHUXIHHFHRA-UHFFFAOYSA-N	0	3	345.487	3.114	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)Cc2ccncc2C)CCCCC1	ZINC001115540135	1370536570	/nfs/dbraw/zinc/53/65/70/1370536570.db2.gz	ZPLBHTSZUFLOKE-UHFFFAOYSA-N	0	3	335.879	3.094	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H]2CN([C@@H]3CCc4c3cc(F)cc4F)C[C@H]21	ZINC001187233671	1388078679	/nfs/dbraw/zinc/07/86/79/1388078679.db2.gz	XDVBHXPEBYAEGP-MJXNMMHHSA-N	0	3	346.421	3.451	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CCC(CNC/C(Cl)=C/Cl)CC1	ZINC001204692545	1370547556	/nfs/dbraw/zinc/54/75/56/1370547556.db2.gz	MAXCMPFBZPANAT-OJNRTJSBSA-N	0	3	349.302	3.115	20	30		EGEDHN
CN1CCN(Cc2ccc(Nc3cc(Cl)cnc3C#N)cc2)CC1	ZINC001204740545	1370560373	/nfs/dbraw/zinc/56/03/73/1370560373.db2.gz	JAENGDUHMLDYLG-UHFFFAOYSA-N	0	3	341.846	3.098	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)Cc2cnccc2C)CCCCC1	ZINC001115577739	1370580612	/nfs/dbraw/zinc/58/06/12/1370580612.db2.gz	HDBQMRWWMQYLDA-UHFFFAOYSA-N	0	3	335.879	3.094	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cc(C)cc(C)n2)CCCCC1	ZINC001115609790	1370608830	/nfs/dbraw/zinc/60/88/30/1370608830.db2.gz	IDTFLEGFIRLUCT-UHFFFAOYSA-N	0	3	335.879	3.473	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)[C@@H](F)CC)CCCCC1	ZINC001115669469	1370650533	/nfs/dbraw/zinc/65/05/33/1370650533.db2.gz	VUUKAHQWLSEYQU-LBPRGKRZSA-N	0	3	335.261	3.052	20	30		EGEDHN
C=CCCN1C[C@@H](O)[C@H](N(Cc2ccccc2)C(=O)[C@@H](C)CCC)C1	ZINC001205109954	1370653278	/nfs/dbraw/zinc/65/32/78/1370653278.db2.gz	LLYMIQZXUNOWFX-DFQSSKMNSA-N	0	3	344.499	3.073	20	30		EGEDHN
CN1CCN(C2(c3ccc(Nc4ccc(C#N)cc4O)cc3)CC2)CC1	ZINC001205120311	1370655985	/nfs/dbraw/zinc/65/59/85/1370655985.db2.gz	OJQAOIMFQRITOF-UHFFFAOYSA-N	0	3	348.450	3.244	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCC1(NCc2cnoc2C)CCCCC1	ZINC001115684989	1370667733	/nfs/dbraw/zinc/66/77/33/1370667733.db2.gz	QAANHJAWMTUDFA-MRXNPFEDSA-N	0	3	333.476	3.494	20	30		EGEDHN
C=CCCCC(=O)NCC1(NCc2cncc(F)c2)CCCCC1	ZINC001115701152	1370682754	/nfs/dbraw/zinc/68/27/54/1370682754.db2.gz	AHGDXQOYPSPAMI-UHFFFAOYSA-N	0	3	333.451	3.486	20	30		EGEDHN
C=C(C)CCN1C[C@@H](O)[C@H](N(Cc2ccccc2)C(=O)C(C)(C)C)C1	ZINC001205216636	1370684205	/nfs/dbraw/zinc/68/42/05/1370684205.db2.gz	ICSUTGROYLFQQK-RTBURBONSA-N	0	3	344.499	3.073	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)C[C@H]2CC[C@H](C)O2)CCCCC1	ZINC001115709928	1370688731	/nfs/dbraw/zinc/68/87/31/1370688731.db2.gz	WALDWGDIBWOWKD-LSDHHAIUSA-N	0	3	328.884	3.105	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC2(NCc3cncs3)CCCCC2)C1	ZINC001115723158	1370701757	/nfs/dbraw/zinc/70/17/57/1370701757.db2.gz	AWEHORVVJYGAQV-UHFFFAOYSA-N	0	3	333.501	3.408	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)/C=C(\C)C2CC2)C[C@H]1c1cccc(F)c1	ZINC001205374775	1370734795	/nfs/dbraw/zinc/73/47/95/1370734795.db2.gz	SXDQGWQDLXWGRE-RUQNTENUSA-N	0	3	340.442	3.089	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](c2cccc(F)c2)[C@H](NCC#CC)C1	ZINC001205425147	1370751207	/nfs/dbraw/zinc/75/12/07/1370751207.db2.gz	VIAWTNLQDIQYBR-RBUKOAKNSA-N	0	3	342.458	3.335	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)CC[C@H](C)CC)C[C@H]1c1cccc(F)c1	ZINC001205446261	1370757992	/nfs/dbraw/zinc/75/79/92/1370757992.db2.gz	YNRVADRZMIMXPW-AYOQOUSVSA-N	0	3	330.447	3.169	20	30		EGEDHN
CCCCCCCCCCC(=O)N1CC[C@@H](NCc2n[nH]c(C)n2)C1	ZINC001187341479	1388097460	/nfs/dbraw/zinc/09/74/60/1388097460.db2.gz	XNBDGSKWWQWOCW-QGZVFWFLSA-N	0	3	349.523	3.334	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CCN(Cc3ccncc3C)C2)C1	ZINC001205827998	1370884985	/nfs/dbraw/zinc/88/49/85/1370884985.db2.gz	IWIZYZCJZXYBIU-LJQANCHMSA-N	0	3	329.444	3.001	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)N1CCC(CNCc2oc(CC)nc2C)CC1	ZINC001205953915	1370921525	/nfs/dbraw/zinc/92/15/25/1370921525.db2.gz	BCWTXPNVLMZKKD-GJZGRUSLSA-N	0	3	347.503	3.332	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)N1CCC(CNCc2ccn(C(C)C)n2)CC1	ZINC001205955299	1370922590	/nfs/dbraw/zinc/92/25/90/1370922590.db2.gz	OXMFOMICQXABKE-IAGOWNOFSA-N	0	3	346.519	3.250	20	30		EGEDHN
CC#CCCCC(=O)N1CCC(CNCc2nc(C)c(C)s2)CC1	ZINC001205965979	1370924430	/nfs/dbraw/zinc/92/44/30/1370924430.db2.gz	LVOJBUDJOWSGER-UHFFFAOYSA-N	0	3	347.528	3.282	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC(CNCc2oc(CC)nc2C)CC1	ZINC001205988134	1370930223	/nfs/dbraw/zinc/93/02/23/1370930223.db2.gz	BFVGJYWHPMRGNT-MRXNPFEDSA-N	0	3	347.503	3.476	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC(CN[C@@H](C)c2cnc(C)cn2)CC1	ZINC001205989867	1370932211	/nfs/dbraw/zinc/93/22/11/1370932211.db2.gz	XUUJGGHODJYXME-WBVHZDCISA-N	0	3	344.503	3.277	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1CN(Cc2cc3ccccc3s2)C[C@H]1C	ZINC001206946160	1371239843	/nfs/dbraw/zinc/23/98/43/1371239843.db2.gz	MTHXSQJQXQFYNE-CRAIPNDOSA-N	0	3	340.492	3.497	20	30		EGEDHN
COc1cccc([C@H](C)N2C[C@@H](C)[C@H](NC(=O)C#CC(C)(C)C)C2)c1	ZINC001206949474	1371240970	/nfs/dbraw/zinc/24/09/70/1371240970.db2.gz	FFMLRLSLUVANMK-JTDSTZFVSA-N	0	3	342.483	3.242	20	30		EGEDHN
CC[C@@H](c1ccc(F)cc1)N1C[C@@H](C)[C@H](NC(=O)C#CC2CC2)C1	ZINC001206953170	1371243839	/nfs/dbraw/zinc/24/38/39/1371243839.db2.gz	VDJOYWLCIJOASM-ZMYBRWDISA-N	0	3	328.431	3.127	20	30		EGEDHN
O=C(C1CCC1)N1CCC[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207011596	1371266954	/nfs/dbraw/zinc/26/69/54/1371266954.db2.gz	BTMRTIXPBLBFBD-SFHVURJKSA-N	0	3	330.859	3.072	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CN(CCc2scnc2C)C[C@H]1C	ZINC001207165580	1371317342	/nfs/dbraw/zinc/31/73/42/1371317342.db2.gz	VQNWNOBAAQCTED-UKRRQHHQSA-N	0	3	335.517	3.033	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN(C[C@H](O)c2ccc(CC)cc2)C[C@H]1C	ZINC001207215810	1371331494	/nfs/dbraw/zinc/33/14/94/1371331494.db2.gz	QAUXMLCAUOBFEW-AHRSYUTCSA-N	0	3	344.499	3.075	20	30		EGEDHN
N#Cc1ccsc1NC(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC001207287553	1371351512	/nfs/dbraw/zinc/35/15/12/1371351512.db2.gz	UQXRSULVPXQZFU-MRXNPFEDSA-N	0	3	340.452	3.406	20	30		EGEDHN
N#Cc1ccc(N2CCCN(CCc3cccc(Cl)c3)CC2)nc1	ZINC001207423117	1371390021	/nfs/dbraw/zinc/39/00/21/1371390021.db2.gz	UAVPNIMFUZQKTN-UHFFFAOYSA-N	0	3	340.858	3.361	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CN(CCc3ccc(F)cc3)C2)CC1	ZINC001207511272	1371419901	/nfs/dbraw/zinc/41/99/01/1371419901.db2.gz	KDTJKAIUCLQRJI-UHFFFAOYSA-N	0	3	332.419	3.089	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2CN(Cc3ccc4cc[nH]c4c3)C[C@H]2C)CCC1	ZINC001207522074	1371424118	/nfs/dbraw/zinc/42/41/18/1371424118.db2.gz	UVKZMWMGBLZNEL-OXQOHEQNSA-N	0	3	349.478	3.298	20	30		EGEDHN
C=CCOCc1nn(C)c2c1CN(CCc1cccc(C)c1)CC2	ZINC001207538419	1371429195	/nfs/dbraw/zinc/42/91/95/1371429195.db2.gz	ZGBCRJCNICQNLA-UHFFFAOYSA-N	0	3	325.456	3.032	20	30		EGEDHN
CC(C)[C@@H](C)CC(=O)N1CCC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001207644770	1371461995	/nfs/dbraw/zinc/46/19/95/1371461995.db2.gz	HKHUJPFPMNXACM-MAUKXSAKSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC(C)[C@H](C)CC(=O)N1CCC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001207644771	1371462469	/nfs/dbraw/zinc/46/24/69/1371462469.db2.gz	HKHUJPFPMNXACM-QAPCUYQASA-N	0	3	345.462	3.460	20	30		EGEDHN
CC(C)(C)/C=C/C(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207710831	1371481810	/nfs/dbraw/zinc/48/18/10/1371481810.db2.gz	SHEMPHAOVJMBEJ-HYSAVQALSA-N	0	3	342.458	3.360	20	30		EGEDHN
CCC[C@H](C)C(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207718464	1371485331	/nfs/dbraw/zinc/48/53/31/1371485331.db2.gz	QMBHKCZTZVTNMM-LPHOPBHVSA-N	0	3	330.447	3.194	20	30		EGEDHN
CCC[C@H](C)C(=O)N1CCC[C@@H](NCc2cc(C#N)ccc2OC)C1	ZINC001207718529	1371485568	/nfs/dbraw/zinc/48/55/68/1371485568.db2.gz	RNGDAGQEDZOWNX-MAUKXSAKSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H](C)C[C@@H]2CCCO2)CCCCC1	ZINC001120226447	1371509364	/nfs/dbraw/zinc/50/93/64/1371509364.db2.gz	MCKMZIVREDNSQK-HOCLYGCPSA-N	0	3	342.911	3.353	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NCC1(NCC=C(Cl)Cl)CCCCC1	ZINC001120233149	1371510314	/nfs/dbraw/zinc/51/03/14/1371510314.db2.gz	BHWYNVHMWVZCPJ-ZDUSSCGKSA-N	0	3	349.302	3.305	20	30		EGEDHN
CCCC[C@H](C)C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001207979904	1371558645	/nfs/dbraw/zinc/55/86/45/1371558645.db2.gz	PRZUUEWIVMJTHK-AZUAARDMSA-N	0	3	326.484	3.445	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001208202841	1371644586	/nfs/dbraw/zinc/64/45/86/1371644586.db2.gz	JXYROGRELFYBCL-GOSISDBHSA-N	0	3	344.886	3.397	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@@H](NCc2cc(CO)ccc2F)C1	ZINC001208239859	1371676200	/nfs/dbraw/zinc/67/62/00/1371676200.db2.gz	GFGIGKQFIIQPIF-QGZVFWFLSA-N	0	3	348.462	3.001	20	30		EGEDHN
CC[C@H](C)C(=O)NC1CC2(CC(NCc3ccccc3C#N)C2)C1	ZINC001120657926	1371687559	/nfs/dbraw/zinc/68/75/59/1371687559.db2.gz	KIJQGZUOSYPYEQ-MPCBAHKLSA-N	0	3	325.456	3.121	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CN(Cc2ccccc2N(C)C)C[C@H]1C	ZINC001208292316	1371704193	/nfs/dbraw/zinc/70/41/93/1371704193.db2.gz	RRGWVCYQZHTHAQ-SJLPKXTDSA-N	0	3	343.515	3.291	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1CN(CCc2ccccc2F)C[C@H]1C	ZINC001208393382	1371751683	/nfs/dbraw/zinc/75/16/83/1371751683.db2.gz	QIRBYOLQLDCNHB-JTDSTZFVSA-N	0	3	332.463	3.407	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN(CCOc2cccc(CC)c2)C[C@H]1C	ZINC001208458711	1371774322	/nfs/dbraw/zinc/77/43/22/1371774322.db2.gz	UOHLZERPHPMCIW-YLJYHZDGSA-N	0	3	344.499	3.421	20	30		EGEDHN
O=C(N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1)C1(F)CCCC1	ZINC001208460833	1371776575	/nfs/dbraw/zinc/77/65/75/1371776575.db2.gz	YRSGUPYRDRUDEN-GOSISDBHSA-N	0	3	346.421	3.040	20	30		EGEDHN
N#Cc1cc(Cl)nc(NCC2CCN(Cc3ccncc3)CC2)c1	ZINC001120946035	1371818762	/nfs/dbraw/zinc/81/87/62/1371818762.db2.gz	KJPNQWLJXJHUFW-UHFFFAOYSA-N	0	3	341.846	3.326	20	30		EGEDHN
CC(C)=C(F)C(=O)NC1CC2(CC(NCc3ccccc3C#N)C2)C1	ZINC001120947818	1371819285	/nfs/dbraw/zinc/81/92/85/1371819285.db2.gz	ZBGPZVFKXQNHTM-UHFFFAOYSA-N	0	3	341.430	3.339	20	30		EGEDHN
CC1(CC(=O)N2CCC[C@@H](NCC#Cc3ccc(Cl)cc3)C2)CC1	ZINC001208587607	1371828692	/nfs/dbraw/zinc/82/86/92/1371828692.db2.gz	HOYNZHLISWEUMO-GOSISDBHSA-N	0	3	344.886	3.462	20	30		EGEDHN
CC(C)C#CC(=O)NC1CC2(CC(NCc3c(F)cccc3F)C2)C1	ZINC001121077274	1371849571	/nfs/dbraw/zinc/84/95/71/1371849571.db2.gz	OIHIIQJZXCYCEE-UHFFFAOYSA-N	0	3	346.421	3.141	20	30		EGEDHN
Cc1csc(CNC2CC3(C2)CC(NC(=O)C#CC(C)(C)C)C3)n1	ZINC001121091338	1371851607	/nfs/dbraw/zinc/85/16/07/1371851607.db2.gz	DPWGDMASBSEEQE-UHFFFAOYSA-N	0	3	345.512	3.018	20	30		EGEDHN
C[C@]1(C(=O)N2CCC[C@@H](NCC#Cc3ccccc3)C2)C[C@H]2C[C@H]2C1	ZINC001208696579	1371865309	/nfs/dbraw/zinc/86/53/09/1371865309.db2.gz	JLOITAUBQFNDKA-DYQZNNLLSA-N	0	3	336.479	3.055	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N1CCC[C@@H](NCc2ccccc2F)C1	ZINC001208797824	1371899198	/nfs/dbraw/zinc/89/91/98/1371899198.db2.gz	VGECMELFQUFLEC-YLJYHZDGSA-N	0	3	348.462	3.135	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCCN(CCCc2cccc(C#N)c2)CC1	ZINC001208851758	1371918131	/nfs/dbraw/zinc/91/81/31/1371918131.db2.gz	KUIQFMMXMFIKLW-UHFFFAOYSA-N	0	3	343.471	3.434	20	30		EGEDHN
N#Cc1ccc(CCCN2CCC[C@@H](C(F)(F)F)[C@H]2CO)cc1	ZINC001208856705	1371919735	/nfs/dbraw/zinc/91/97/35/1371919735.db2.gz	QXERYDRXFVZBJQ-HZPDHXFCSA-N	0	3	326.362	3.126	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)[C@H](C)CC2CCCCC2)C1	ZINC001209115968	1372002929	/nfs/dbraw/zinc/00/29/29/1372002929.db2.gz	KSQBNYVQWKYRIB-ZHALLVOQSA-N	0	3	336.520	3.232	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@@H](NCc2cc(C)ccc2F)C1	ZINC001209156259	1372017224	/nfs/dbraw/zinc/01/72/24/1372017224.db2.gz	LGMXJPXISFRUDK-GOSISDBHSA-N	0	3	330.447	3.408	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC[C@H](NCc2cn(C(C)C)nc2C)C1	ZINC001209184405	1372029374	/nfs/dbraw/zinc/02/93/74/1372029374.db2.gz	SFHLBBDBHFVLFD-MJGOQNOKSA-N	0	3	346.519	3.455	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC1CC2(CC(NCc3cnoc3C)C2)C1	ZINC001121714113	1372057008	/nfs/dbraw/zinc/05/70/08/1372057008.db2.gz	VOIQPMLQAFNLDG-CBRGODRTSA-N	0	3	331.460	3.102	20	30		EGEDHN
CCOC(=O)CCCCCCN1CCN(c2ccccc2C#N)CC1	ZINC001209347229	1372073390	/nfs/dbraw/zinc/07/33/90/1372073390.db2.gz	GEVKZOPVLLEVMQ-UHFFFAOYSA-N	0	3	343.471	3.194	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N[C@@H](CC)c1nc(-c2ccccc2)c[nH]1	ZINC001121856815	1372104306	/nfs/dbraw/zinc/10/43/06/1372104306.db2.gz	CENOJYHWGMBAJE-CVEARBPZSA-N	0	3	326.444	3.328	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(SC(F)F)cc1)C(=O)[C@H]1C[C@@H]1F	ZINC001122449666	1372249556	/nfs/dbraw/zinc/24/95/56/1372249556.db2.gz	VOQAQTUGTYULBI-DCAQKATOSA-N	0	3	328.315	3.007	20	30		EGEDHN
CC[C@@H](C)c1ccc(NC(=O)C(C#N)C(=O)c2ccc(C)nn2)cc1	ZINC001122547413	1372271976	/nfs/dbraw/zinc/27/19/76/1372271976.db2.gz	RHIYBJQFYQZFBQ-WBMJQRKESA-N	0	3	336.395	3.260	20	30		EGEDHN
CC(C)N1CCC[C@@H]1C(=O)C(C#N)c1nc(-c2ccncc2)cs1	ZINC001122567809	1372276380	/nfs/dbraw/zinc/27/63/80/1372276380.db2.gz	GSDWGWWXEJDPPS-GOEBONIOSA-N	0	3	340.452	3.254	20	30		EGEDHN
CC1(CCC(=O)N2CCC[C@H](NCc3ccc(F)c(C#N)c3)C2)CC1	ZINC001210465888	1372360323	/nfs/dbraw/zinc/36/03/23/1372360323.db2.gz	YVLYZCAHHNHDHA-KRWDZBQOSA-N	0	3	343.446	3.358	20	30		EGEDHN
O=C([C@H]1CC12CCCC2)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001210503048	1372368141	/nfs/dbraw/zinc/36/81/41/1372368141.db2.gz	MUSFNCVNMQINCV-WOJBJXKFSA-N	0	3	336.479	3.199	20	30		EGEDHN
CCc1c(C(=O)C(C#N)c2ncc(Cl)n2C)cnn1C1CCCC1	ZINC001123338104	1372431426	/nfs/dbraw/zinc/43/14/26/1372431426.db2.gz	YDEYTLBTBDCYEI-GFCCVEGCSA-N	0	3	345.834	3.438	20	30		EGEDHN
C=C(CN1CCCCC1)c1nc(-c2ccc(C3OCCO3)cc2)no1	ZINC001211436163	1372558567	/nfs/dbraw/zinc/55/85/67/1372558567.db2.gz	DAGQRXUZOLCWHB-UHFFFAOYSA-N	0	3	341.411	3.281	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@H]2CCC(F)(F)C2)C[C@H]1c1ccccc1	ZINC001211611242	1372590549	/nfs/dbraw/zinc/59/05/49/1372590549.db2.gz	RRQNWFUENRJWAB-OKZBNKHCSA-N	0	3	346.421	3.029	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)CC(C)(C)CC(F)F)C[C@H]1c1ccccc1	ZINC001211637521	1372593732	/nfs/dbraw/zinc/59/37/32/1372593732.db2.gz	QERKKJHQBMFQGW-DLBZAZTESA-N	0	3	348.437	3.275	20	30		EGEDHN
C=CC[C@@H](C(=O)N1CC[C@@H](NCc2cccnc2)C1)c1ccccc1	ZINC001188001682	1388210297	/nfs/dbraw/zinc/21/02/97/1388210297.db2.gz	ICNKBFNCEGYHIP-WOJBJXKFSA-N	0	3	335.451	3.132	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2cccc(C)c2)[C@H](OC)C1	ZINC001211795510	1372616241	/nfs/dbraw/zinc/61/62/41/1372616241.db2.gz	RCHJHFNLKBIINX-RTBURBONSA-N	0	3	332.488	3.394	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CN(Cc2ccccc2C(C)C)C[C@H]1OC	ZINC001212022219	1372648712	/nfs/dbraw/zinc/64/87/12/1372648712.db2.gz	GSGKHSIZNUKFPN-RTBURBONSA-N	0	3	330.472	3.092	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)C(C)=C2CCCC2)[C@H](OC)C1	ZINC001212095105	1372656423	/nfs/dbraw/zinc/65/64/23/1372656423.db2.gz	RSSYNFKDBONKPX-RTBURBONSA-N	0	3	334.504	3.439	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2cc(C)c(C)o2)[C@H](OC)C1	ZINC001212122742	1372660857	/nfs/dbraw/zinc/66/08/57/1372660857.db2.gz	PMNOOBZLYMNKTC-SJLPKXTDSA-N	0	3	336.476	3.296	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CN([C@@H](C)c2cccc(C)c2)C[C@H]1OC	ZINC001212341283	1372691698	/nfs/dbraw/zinc/69/16/98/1372691698.db2.gz	ZTDAUCWZIHXQNO-QXAKKESOSA-N	0	3	344.499	3.474	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NCCNCc1cc(C(C)C)ccc1OC	ZINC001124489398	1372706336	/nfs/dbraw/zinc/70/63/36/1372706336.db2.gz	ZMNMHTHZAFFZSU-MRXNPFEDSA-N	0	3	348.487	3.006	20	30		EGEDHN
CCCCCCCCS(=O)(=O)N[C@H]1C[C@H]2CCC[C@@H](C1)N2C	ZINC001188028686	1388220926	/nfs/dbraw/zinc/22/09/26/1388220926.db2.gz	IKEXZOMAQKHCLV-BJWYYQGGSA-N	0	3	330.538	3.282	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2ccc(C)c(C)n2)[C@H](OC)C1	ZINC001213166692	1372851491	/nfs/dbraw/zinc/85/14/91/1372851491.db2.gz	ZXPFPAMULIFACK-RTBURBONSA-N	0	3	347.503	3.098	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2cc(C)c(C)cn2)[C@H](OC)C1	ZINC001213198998	1372858457	/nfs/dbraw/zinc/85/84/57/1372858457.db2.gz	KTTDGKDVUVJYLJ-RTBURBONSA-N	0	3	347.503	3.098	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CN([C@@H](C)c2ccccc2C)C[C@H]1OC	ZINC001213260225	1372869957	/nfs/dbraw/zinc/86/99/57/1372869957.db2.gz	AOQMPDPKCWDYSH-QXAKKESOSA-N	0	3	344.499	3.474	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CN(CCCC2CCCC2)C[C@H]1OC	ZINC001213260950	1372870302	/nfs/dbraw/zinc/87/03/02/1372870302.db2.gz	YCANHXDHCCFXFO-QZTJIDSGSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN([C@H](CC)c2ccccc2)C[C@H]1OC	ZINC001213350577	1372890004	/nfs/dbraw/zinc/89/00/04/1372890004.db2.gz	VRRBHSZBXFMJAI-GUDVDZBRSA-N	0	3	330.472	3.309	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2c[nH]cc2C2CC2)[C@H](OC)C1	ZINC001213644928	1372939665	/nfs/dbraw/zinc/93/96/65/1372939665.db2.gz	KUURWUXUQIYMBY-RTBURBONSA-N	0	3	345.487	3.068	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@H]2CC23CCCC3)[C@H](OC)C1	ZINC001213671841	1372943478	/nfs/dbraw/zinc/94/34/78/1372943478.db2.gz	TXNPRBZBPVVGIM-KZNAEPCWSA-N	0	3	336.520	3.353	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2cccc(C(F)F)c2)[C@H](OC)C1	ZINC001213756337	1372956424	/nfs/dbraw/zinc/95/64/24/1372956424.db2.gz	SNHXKYPDXRMYCV-HZPDHXFCSA-N	0	3	338.398	3.019	20	30		EGEDHN
C/C=C(\C)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001214413679	1373057198	/nfs/dbraw/zinc/05/71/98/1373057198.db2.gz	JETJHHYQQJSIMM-UPJFGJQXSA-N	0	3	330.859	3.094	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@@H](C)[C@H](NCc2cccc(C(C)C)n2)C1	ZINC001214465981	1373065879	/nfs/dbraw/zinc/06/58/79/1373065879.db2.gz	CGRNOUHRCHQVAZ-YLJYHZDGSA-N	0	3	341.499	3.335	20	30		EGEDHN
CC/C(C)=C\C(=O)N1C[C@@H](C)[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001214576456	1373082849	/nfs/dbraw/zinc/08/28/49/1373082849.db2.gz	XOXIQUYXSOOPIG-CFIUCSMOSA-N	0	3	344.886	3.484	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H](C)[C@H](NCc2cc(C)ns2)C1	ZINC001214708545	1373106756	/nfs/dbraw/zinc/10/67/56/1373106756.db2.gz	LLJCKFPXLIRBAZ-CXAGYDPISA-N	0	3	333.501	3.156	20	30		EGEDHN
C#CCC1(C(=O)N2C[C@@H](C)[C@H](NCc3cc(F)cc(F)c3)C2)CCC1	ZINC001214830241	1373126635	/nfs/dbraw/zinc/12/66/35/1373126635.db2.gz	WZFOEBGDAUXBOV-RDTXWAMCSA-N	0	3	346.421	3.095	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NCCNCc1cc2ccccc2o1)OCC	ZINC001128528809	1373284255	/nfs/dbraw/zinc/28/42/55/1373284255.db2.gz	SEJOCWKUAFEJJB-SFHVURJKSA-N	0	3	330.428	3.010	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)CCc3ccco3)[C@H]2C1	ZINC001217264737	1373413706	/nfs/dbraw/zinc/41/37/06/1373413706.db2.gz	CPGRPPBPAPPESY-RBUKOAKNSA-N	0	3	348.487	3.094	20	30		EGEDHN
C=C(C)CN1CC[C@H](Oc2cnccc2CNC(=O)C(C)(C)CC)C1	ZINC001130323364	1373492692	/nfs/dbraw/zinc/49/26/92/1373492692.db2.gz	HHTCRKQYRCEUHG-KRWDZBQOSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)[C@@H](CC)CCCC)C1	ZINC001130350995	1373500936	/nfs/dbraw/zinc/50/09/36/1373500936.db2.gz	BGQHDUVMJRWTFG-HOTGVXAUSA-N	0	3	332.492	3.218	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)[C@H](CC)CC(C)C)C1	ZINC001130438603	1373539300	/nfs/dbraw/zinc/53/93/00/1373539300.db2.gz	MPJUZJOIADWBCW-HZPDHXFCSA-N	0	3	332.492	3.074	20	30		EGEDHN
O=C(/C=C/c1ccccc1O[C@H]1CC[C@@H]2NCCO[C@@H]21)c1ccccc1	ZINC001218116748	1373563881	/nfs/dbraw/zinc/56/38/81/1373563881.db2.gz	RIZYALRMAHRPAZ-BMZHNJBWSA-N	0	3	349.430	3.481	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)C[C@H](CC)CCCC)C[C@H]1c1cn(C)cn1	ZINC001130632652	1373572549	/nfs/dbraw/zinc/57/25/49/1373572549.db2.gz	LCIDXSBZVUKTSY-ZIFCJYIRSA-N	0	3	346.519	3.097	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2OCCN(C(=O)c3ccc(CC)s3)[C@H]2C1	ZINC001218253690	1373584724	/nfs/dbraw/zinc/58/47/24/1373584724.db2.gz	ZOVJEIQXFXUKNO-HYVNUMGLSA-N	0	3	348.512	3.190	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)C/C=C(\C)C=C)[C@H]2C1	ZINC001218487662	1373623453	/nfs/dbraw/zinc/62/34/53/1373623453.db2.gz	LWRVQACUURRVNY-AQXMTDBDSA-N	0	3	332.488	3.167	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCO[C@@H]2CN(CCCC(C)(C)C)C[C@@H]21	ZINC001218517202	1373628112	/nfs/dbraw/zinc/62/81/12/1373628112.db2.gz	KAGPJOMFYJQJHK-OKZBNKHCSA-N	0	3	336.520	3.327	20	30		EGEDHN
CN[C@@H](Cc1ccc(Cl)cc1)C(=O)Nc1sc(C)cc1C#N	ZINC001218553286	1373632687	/nfs/dbraw/zinc/63/26/87/1373632687.db2.gz	AFJBOUOBSVLFPV-AWEZNQCLSA-N	0	3	333.844	3.351	20	30		EGEDHN
CCCc1ccccc1C(=O)NCCNCc1ccc(C#N)s1	ZINC001131123796	1373647076	/nfs/dbraw/zinc/64/70/76/1373647076.db2.gz	KAKTXIZNTGMHHB-UHFFFAOYSA-N	0	3	327.453	3.092	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@@H](NCc3cc(C)ns3)C2)CCCCC1	ZINC001188257984	1388276351	/nfs/dbraw/zinc/27/63/51/1388276351.db2.gz	RTGWXUUTZIGKMW-MRXNPFEDSA-N	0	3	345.512	3.116	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCO[C@H]1C1CCN(C(=O)[C@@H](C)CCC)CC1	ZINC001131456422	1373701605	/nfs/dbraw/zinc/70/16/05/1373701605.db2.gz	PGYMIJFWRVOILB-XKQJLSEDSA-N	0	3	342.911	3.161	20	30		EGEDHN
N#C[C@@H](NC(=O)C[C@@H](N)c1ccc(C(F)(F)F)cc1)c1ccccc1	ZINC001219558539	1373716095	/nfs/dbraw/zinc/71/60/95/1373716095.db2.gz	QHOBWPRUQQLLIS-HZPDHXFCSA-N	0	3	347.340	3.476	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H](C)O[C@@]2(CCN(CC=C(C)C)C2)C1	ZINC001131661278	1373748801	/nfs/dbraw/zinc/74/88/01/1373748801.db2.gz	LZDFIGNIRHDFHI-WIYYLYMNSA-N	0	3	346.515	3.413	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@H]3CCN(C[C@@H]4CCCCO4)C[C@H]32)CCCC1	ZINC001222150915	1373817614	/nfs/dbraw/zinc/81/76/14/1373817614.db2.gz	ALGSAQGEHUJOGB-CEXWTWQISA-N	0	3	346.515	3.225	20	30		EGEDHN
CC(C)SCC(=O)NCC1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001222416378	1373842842	/nfs/dbraw/zinc/84/28/42/1373842842.db2.gz	JAPCPQRTOXFWSJ-UHFFFAOYSA-N	0	3	345.512	3.028	20	30		EGEDHN
N#Cc1cccc(CN2CCC(CNC(=O)CC3CCC3)CC2)c1	ZINC001222756944	1373867999	/nfs/dbraw/zinc/86/79/99/1373867999.db2.gz	VXLALBVMANMNHI-UHFFFAOYSA-N	0	3	325.456	3.077	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC[C@@H](C)N(CCOc2ccccc2C)C1	ZINC001131894647	1375031910	/nfs/dbraw/zinc/03/19/10/1375031910.db2.gz	AXDLRUZSEDIQNG-MSOLQXFVSA-N	0	3	330.472	3.309	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@@H](C)N(Cc2cccc(COC)c2)C1	ZINC001131899539	1375035716	/nfs/dbraw/zinc/03/57/16/1375035716.db2.gz	NMLJBHVLZPFDJU-VQIMIIECSA-N	0	3	330.472	3.268	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3cnccc3C)[C@H]2C1	ZINC001223587090	1375039351	/nfs/dbraw/zinc/03/93/51/1375039351.db2.gz	NJEIINQZKXVKHK-MJGOQNOKSA-N	0	3	341.499	3.415	20	30		EGEDHN
CC#CCCCC(=O)NCC1CCN(CCc2csc(C)n2)CC1	ZINC001224158682	1375058409	/nfs/dbraw/zinc/05/84/09/1375058409.db2.gz	XISWRZVXUNTYEG-UHFFFAOYSA-N	0	3	347.528	3.016	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N[C@@H]1CCCC[C@H]1NCC=C(Cl)Cl	ZINC001225246622	1375099034	/nfs/dbraw/zinc/09/90/34/1375099034.db2.gz	GDXMFOUAWLJWMD-BFHYXJOUSA-N	0	3	349.302	3.304	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1CC[C@H](C)N(CCCc2cccc(F)c2)C1	ZINC001132022233	1375103050	/nfs/dbraw/zinc/10/30/50/1375103050.db2.gz	WZEFDUPVORGZDD-FXAWDEMLSA-N	0	3	344.474	3.387	20	30		EGEDHN
C[C@H]1CC[C@H](NC(=O)C#CC(C)(C)C)CN1CC1CC(F)(F)C1	ZINC001132037426	1375110873	/nfs/dbraw/zinc/11/08/73/1375110873.db2.gz	BRNNMMUIDACCCW-ZFWWWQNUSA-N	0	3	326.431	3.050	20	30		EGEDHN
C[C@H]1CC[C@H](NC(=O)C#CC2CC2)CN1Cc1ccc2ncccc2c1	ZINC001132047294	1375115566	/nfs/dbraw/zinc/11/55/66/1375115566.db2.gz	WFEKIHUOVXDWHF-JXFKEZNVSA-N	0	3	347.462	3.117	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1CC[C@H](C)N(CCc2cnn(CC)c2)C1	ZINC001132060405	1375125541	/nfs/dbraw/zinc/12/55/41/1375125541.db2.gz	FIGUQRNHOKDANP-WMZOPIPTSA-N	0	3	346.519	3.017	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CC[C@@H](C)N(CCc2scnc2C)C1	ZINC001132071421	1375132789	/nfs/dbraw/zinc/13/27/89/1375132789.db2.gz	ANUOHMDPFJGHJV-GDBMZVCRSA-N	0	3	335.517	3.319	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1CC[C@@H](C)N(CCc2scnc2C)C1	ZINC001132071424	1375133004	/nfs/dbraw/zinc/13/30/04/1375133004.db2.gz	ANUOHMDPFJGHJV-ZBFHGGJFSA-N	0	3	335.517	3.319	20	30		EGEDHN
O=C(C#CC1CC1)N[C@@H]1CCCC[C@H]1NCc1ccc(Cl)cc1F	ZINC001226111909	1375204201	/nfs/dbraw/zinc/20/42/01/1375204201.db2.gz	QIBRFEWWPDHNIL-QZTJIDSGSA-N	0	3	348.849	3.410	20	30		EGEDHN
C=CCCCN1C[C@H](NC(=O)c2nc(Cl)cs2)CC[C@@H]1C	ZINC001132238265	1375234126	/nfs/dbraw/zinc/23/41/26/1375234126.db2.gz	QMPBWOKKMKLNRP-NWDGAFQWSA-N	0	3	327.881	3.345	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1CC[C@@H](C)N(Cc2ccc(CO)cc2)C1	ZINC001132256284	1375250648	/nfs/dbraw/zinc/25/06/48/1375250648.db2.gz	MBHPSYPPFMEVMC-APWZRJJASA-N	0	3	330.472	3.004	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC1CCN([C@@H](C)c2ccc(F)cc2)CC1	ZINC001226446899	1375260295	/nfs/dbraw/zinc/26/02/95/1375260295.db2.gz	HRNUDJGIZXEEQI-JKSUJKDBSA-N	0	3	348.462	3.449	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)C[C@H](OCC)C(=C)C	ZINC001226541684	1375278730	/nfs/dbraw/zinc/27/87/30/1375278730.db2.gz	CVBFGQCANKZCNE-OAGGEKHMSA-N	0	3	328.884	3.127	20	30		EGEDHN
C[C@H](C#N)C(=O)NC1CCN(CCCc2ccccc2Cl)CC1	ZINC001226641409	1375298271	/nfs/dbraw/zinc/29/82/71/1375298271.db2.gz	ZZFBILFFTTWLGJ-CQSZACIVSA-N	0	3	333.863	3.013	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2(Cc3ccc(F)cc3)CC2)CC[C@H]1C	ZINC001132340675	1375320945	/nfs/dbraw/zinc/32/09/45/1375320945.db2.gz	XCBNGIJXWAUCDL-VQIMIIECSA-N	0	3	342.458	3.141	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2cc(C)cc(C)c2)CC[C@H]1C	ZINC001132444595	1375387730	/nfs/dbraw/zinc/38/77/30/1375387730.db2.gz	CGXPGSACZYSHDG-IEBWSBKVSA-N	0	3	330.472	3.089	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COc2c(C)cccc2C)CC[C@H]1C	ZINC001132467024	1375408670	/nfs/dbraw/zinc/40/86/70/1375408670.db2.gz	ARXHZVDEAOMDKQ-QZTJIDSGSA-N	0	3	330.472	3.227	20	30		EGEDHN
CC(C)C#CC(=O)NC1CCN(Cc2ccc(C(F)F)cc2)CC1	ZINC001227244284	1375412026	/nfs/dbraw/zinc/41/20/26/1375412026.db2.gz	JYNNWAWAXYXTBK-UHFFFAOYSA-N	0	3	334.410	3.364	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCc2c(C)noc2Cl)CC[C@H]1C	ZINC001132529595	1375443480	/nfs/dbraw/zinc/44/34/80/1375443480.db2.gz	OPYPWNCYQRCKSE-OCCSQVGLSA-N	0	3	339.867	3.114	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1CC[C@@H](C)N(Cc2ccc(CC)cc2)C1	ZINC001132532636	1375444786	/nfs/dbraw/zinc/44/47/86/1375444786.db2.gz	GDOXUFSVOLEFBU-YLJYHZDGSA-N	0	3	344.499	3.311	20	30		EGEDHN
C=C(C)CCC(=O)NC1CCN(CCOc2ccc(OC)cc2)CC1	ZINC001227607298	1375452808	/nfs/dbraw/zinc/45/28/08/1375452808.db2.gz	OGRAOQBNVILWRE-UHFFFAOYSA-N	0	3	346.471	3.011	20	30		EGEDHN
CC#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)[C@@H](C)CC)CC1	ZINC001132552812	1375459891	/nfs/dbraw/zinc/45/98/91/1375459891.db2.gz	ZTAJALGQRNIGEJ-ICSRJNTNSA-N	0	3	341.499	3.334	20	30		EGEDHN
C#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)/C=C(\C)CC)CC1	ZINC001132554503	1375460661	/nfs/dbraw/zinc/46/06/61/1375460661.db2.gz	HPAABAMEFSWLFX-BONDDZEJSA-N	0	3	339.483	3.254	20	30		EGEDHN
C#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)C(F)=C(C)C)CC1	ZINC001132555581	1375462747	/nfs/dbraw/zinc/46/27/47/1375462747.db2.gz	WRCMFASEQDSINI-GOSISDBHSA-N	0	3	343.446	3.161	20	30		EGEDHN
CC#CCN1CC[C@@H](CN(Cc2scnc2C)C(=O)[C@H](C)CC)C1	ZINC001132559073	1375466260	/nfs/dbraw/zinc/46/62/60/1375466260.db2.gz	SNVMPAWEGQOCFY-NVXWUHKLSA-N	0	3	347.528	3.171	20	30		EGEDHN
C#CCC1(C(=O)NC2CCN(Cc3csc(C)c3)CC2)CCC1	ZINC001227754110	1375471780	/nfs/dbraw/zinc/47/17/80/1375471780.db2.gz	HHNLFQVRBVOPNG-UHFFFAOYSA-N	0	3	330.497	3.331	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCNCc1cnc(-c2ccccc2)s1	ZINC001132576699	1375473642	/nfs/dbraw/zinc/47/36/42/1375473642.db2.gz	NRYZTUZYUIURCH-LSDHHAIUSA-N	0	3	343.496	3.474	20	30		EGEDHN
C[C@@]1(C(=O)N[C@@H]2CCCC[C@H]2NCC#Cc2ccccc2)C=CCC1	ZINC001227991665	1375499576	/nfs/dbraw/zinc/49/95/76/1375499576.db2.gz	WWAPBHMLBFITSH-KCZVDYSFSA-N	0	3	336.479	3.411	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](C)[C@@H](CNCc2nc(C)c(C)s2)C1	ZINC001132696335	1375518478	/nfs/dbraw/zinc/51/84/78/1375518478.db2.gz	JUHPIYVCTQJADG-CJNGLKHVSA-N	0	3	335.517	3.300	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)Cc2cccc(C(C)C)c2)CC1	ZINC001228162891	1375522342	/nfs/dbraw/zinc/52/23/42/1375522342.db2.gz	PFKVLNWGICRTIM-UHFFFAOYSA-N	0	3	344.499	3.136	20	30		EGEDHN
CC(C)CCC(=O)N1CC[C@H](N(C)Cc2ccc(OCC#N)cc2)C1	ZINC001188821834	1388384280	/nfs/dbraw/zinc/38/42/80/1388384280.db2.gz	VLODWXIHFMHUNK-SFHVURJKSA-N	0	3	343.471	3.058	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)C1(CC)CC1	ZINC001228418191	1375569266	/nfs/dbraw/zinc/56/92/66/1375569266.db2.gz	CMZHAPLDUUPYJV-CHWSQXEVSA-N	0	3	329.282	3.102	20	30		EGEDHN
Cc1cnc(CNC[C@@H]2CN(C(=O)C#CC(C)(C)C)CC[C@@H]2C)s1	ZINC001132820410	1375582800	/nfs/dbraw/zinc/58/28/00/1375582800.db2.gz	VFWNFZQIAWPOEE-GOEBONIOSA-N	0	3	347.528	3.075	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](C)[C@@H](CNCc2ccn(CC)n2)C1	ZINC001132847070	1375599710	/nfs/dbraw/zinc/59/97/10/1375599710.db2.gz	RMIMTTCKGYGTMM-SJORKVTESA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NC1CCN(CCOc2cccc(C)c2)CC1	ZINC001228748880	1375662801	/nfs/dbraw/zinc/66/28/01/1375662801.db2.gz	NXEHBIFZNKALFA-ROUUACIJSA-N	0	3	344.499	3.413	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NC1CCN(Cc2cccc(COC)c2)CC1	ZINC001228750427	1375663230	/nfs/dbraw/zinc/66/32/30/1375663230.db2.gz	YPUOWMXGMFCODH-SJORKVTESA-N	0	3	344.499	3.372	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](C)[C@@H](CNCc3cc(C)no3)C2)CCC1	ZINC001133105499	1375778852	/nfs/dbraw/zinc/77/88/52/1375778852.db2.gz	UMUQBJREKPJCJF-WBVHZDCISA-N	0	3	345.487	3.304	20	30		EGEDHN
CCC(=O)C1(c2cccc(OC3CC(C#N)C3)c2)CCN(C)CC1	ZINC001229735424	1375882943	/nfs/dbraw/zinc/88/29/43/1375882943.db2.gz	HOPMXUSDZVJCSO-UHFFFAOYSA-N	0	3	326.440	3.310	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)C[C@H](C)c2ccc(F)cc2)CC1	ZINC001230342900	1376004711	/nfs/dbraw/zinc/00/47/11/1376004711.db2.gz	ZVRMZBITGVDOEA-INIZCTEOSA-N	0	3	348.462	3.103	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1ccccc1C#N)NC(=O)c1ccc(F)cc1	ZINC001133550175	1376079958	/nfs/dbraw/zinc/07/99/58/1376079958.db2.gz	NYGNYUXCWHUMCF-LSDHHAIUSA-N	0	3	339.414	3.384	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)Cc1ccsc1	ZINC001133564934	1376092540	/nfs/dbraw/zinc/09/25/40/1376092540.db2.gz	TVFBZVHXGMJIST-NWDGAFQWSA-N	0	3	345.306	3.072	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCNCc2ccc(Br)s2)C1	ZINC001133570997	1376096916	/nfs/dbraw/zinc/09/69/16/1376096916.db2.gz	BCSNPBMAHLTDRC-UHFFFAOYSA-N	0	3	343.290	3.073	20	30		EGEDHN
C#CCCN(CCCNC(=O)c1cccc(C)c1)Cc1cccnc1	ZINC001230660675	1376119622	/nfs/dbraw/zinc/11/96/22/1376119622.db2.gz	OUOFJMYXMIECBQ-UHFFFAOYSA-N	0	3	335.451	3.035	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccccc2OC2CCC2)cc1	ZINC001133612981	1376121007	/nfs/dbraw/zinc/12/10/07/1376121007.db2.gz	XWDPDSLIRFSCDH-UHFFFAOYSA-N	0	3	349.434	3.009	20	30		EGEDHN
C#CCCN(CCCNC(=O)[C@H](C)C(CC)CC)Cc1cccnc1	ZINC001230796335	1376151389	/nfs/dbraw/zinc/15/13/89/1376151389.db2.gz	AESOXWZFCUDMJT-GOSISDBHSA-N	0	3	343.515	3.486	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)[C@@H]1CC[C@H](F)C1)Cc1cccnc1	ZINC001230824540	1376161266	/nfs/dbraw/zinc/16/12/66/1376161266.db2.gz	FHOIZXONGOIZKP-MSOLQXFVSA-N	0	3	333.451	3.104	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)CC/C=C/c2ccccc2)cc1	ZINC001133699936	1376163174	/nfs/dbraw/zinc/16/31/74/1376163174.db2.gz	BBFGKADGCKSLJA-XBXARRHUSA-N	0	3	333.435	3.258	20	30		EGEDHN
C#CCCN(CCCNC(=O)[C@@H]1C[C@@]1(C)C(C)C)Cc1cccnc1	ZINC001230882324	1376176044	/nfs/dbraw/zinc/17/60/44/1376176044.db2.gz	OTRFHGZUULXFIF-FPOVZHCZSA-N	0	3	341.499	3.095	20	30		EGEDHN
C[C@H](C[C@@H](C)[NH2+]Cc1ccc(C#N)s1)NC(=O)c1ccccc1[O-]	ZINC001133723112	1376176743	/nfs/dbraw/zinc/17/67/43/1376176743.db2.gz	RFHGIXSOOVQLFC-CHWSQXEVSA-N	0	3	343.452	3.012	20	30		EGEDHN
C#CCCN(CCCNC(=O)[C@@H](C)c1ccccc1)Cc1cccnc1	ZINC001230906810	1376180995	/nfs/dbraw/zinc/18/09/95/1376180995.db2.gz	VNOXABUSRCBAIO-IBGZPJMESA-N	0	3	349.478	3.217	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2ccc(C(F)F)c(F)c2)c1	ZINC001133757387	1376192591	/nfs/dbraw/zinc/19/25/91/1376192591.db2.gz	LHXZZUPDXJVINZ-UHFFFAOYSA-N	0	3	347.340	3.155	20	30		EGEDHN
O=C1NCC2(CCN(Cc3ccccc3C#Cc3ccccc3)CC2)O1	ZINC001231579097	1376270663	/nfs/dbraw/zinc/27/06/63/1376270663.db2.gz	ZVFTYOBWNWGYSB-UHFFFAOYSA-N	0	3	346.430	3.161	20	30		EGEDHN
C=CCN1C(=O)CC[C@@]12CCCN(Cc1ccc(F)cc1OC)CC2	ZINC001231600714	1376275145	/nfs/dbraw/zinc/27/51/45/1376275145.db2.gz	BHSLHJYRQWLEBC-HXUWFJFHSA-N	0	3	346.446	3.367	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H]2CN(CC[C@H]3CC3(Cl)Cl)C[C@H]21	ZINC001189006259	1388434394	/nfs/dbraw/zinc/43/43/94/1388434394.db2.gz	AMSKGSICGNWYSH-SOUVJXGZSA-N	0	3	345.314	3.459	20	30		EGEDHN
C#Cc1cccc(CN2C[C@@H]3CCN(C(=O)c4cccc(F)c4)[C@@H]3C2)c1	ZINC001231656720	1376296690	/nfs/dbraw/zinc/29/66/90/1376296690.db2.gz	FLZDXETWXSXHTQ-PZJWPPBQSA-N	0	3	348.421	3.154	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)c1cscc1C	ZINC001134035889	1376323278	/nfs/dbraw/zinc/32/32/78/1376323278.db2.gz	WJTHBFRNMBNKEW-VXGBXAGGSA-N	0	3	345.306	3.452	20	30		EGEDHN
Cc1coc(C)c1C(=O)N[C@@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001134256552	1376440066	/nfs/dbraw/zinc/44/00/66/1376440066.db2.gz	LQOFHYLBKAABLB-GJZGRUSLSA-N	0	3	339.439	3.455	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cc(F)cc(Cl)c2)cc1F	ZINC001134272883	1376448080	/nfs/dbraw/zinc/44/80/80/1376448080.db2.gz	PDDVJWNEYQKBAA-UHFFFAOYSA-N	0	3	349.768	3.009	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)c1cc(C)cs1	ZINC001134281019	1376455484	/nfs/dbraw/zinc/45/54/84/1376455484.db2.gz	VKYYHKZRVXMXFC-NEPJUHHUSA-N	0	3	345.306	3.452	20	30		EGEDHN
CCCc1nc(C)c(CN[C@@H](C)C[C@@H](C)NC(=O)C#CC(C)(C)C)o1	ZINC001134328546	1376478137	/nfs/dbraw/zinc/47/81/37/1376478137.db2.gz	DESYKDJWVDOCNU-LSDHHAIUSA-N	0	3	347.503	3.358	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)C#CC(C)(C)C)NCc1c(F)cccc1F	ZINC001134328663	1376479343	/nfs/dbraw/zinc/47/93/43/1376479343.db2.gz	FPVDKCUHPOXDMP-KBPBESRZSA-N	0	3	336.426	3.387	20	30		EGEDHN
Cc1nc(C(C)C)oc1CN[C@H](C)C[C@@H](C)NC(=O)C#CC(C)C	ZINC001134341138	1376484778	/nfs/dbraw/zinc/48/47/78/1376484778.db2.gz	KIVJAEWWTPKDHW-HUUCEWRRSA-N	0	3	333.476	3.139	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H](C)C[C@@H](C)NCc1ccn(CC)n1	ZINC001134417974	1376522352	/nfs/dbraw/zinc/52/23/52/1376522352.db2.gz	CIURDXFEYUAXOL-HZPDHXFCSA-N	0	3	332.492	3.044	20	30		EGEDHN
Cc1ccc(CN2CC[C@@H]3[C@@H]2CCN3Cc2cc(F)ccc2C#N)o1	ZINC001232889991	1376534373	/nfs/dbraw/zinc/53/43/73/1376534373.db2.gz	WJPLIMPHTAFVEV-UXHICEINSA-N	0	3	339.414	3.448	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@H](C)C[C@H](C)NCc1oc(C)nc1C	ZINC001134447569	1376542374	/nfs/dbraw/zinc/54/23/74/1376542374.db2.gz	JCXRZFVPNNBDGZ-WDEREUQCSA-N	0	3	341.883	3.443	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H](C)C[C@@H](C)NCc1nccn1C(F)F	ZINC001134470025	1376555121	/nfs/dbraw/zinc/55/51/21/1376555121.db2.gz	LJAIIVZBKXVEQV-CHWSQXEVSA-N	0	3	328.407	3.007	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCc2ncnc(OC(C)C)c2CC1	ZINC001233080443	1376566314	/nfs/dbraw/zinc/56/63/14/1376566314.db2.gz	YIKBZUIXVKNACR-UHFFFAOYSA-N	0	3	336.439	3.045	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCC2(CC1)OC(=O)Nc1ncccc12	ZINC001233083132	1376567524	/nfs/dbraw/zinc/56/75/24/1376567524.db2.gz	WWHUMOVUHFUPCJ-UHFFFAOYSA-N	0	3	348.406	3.315	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@H]1CCN(Cc1cnc(C)c(C)c1)C2	ZINC001233158234	1376577190	/nfs/dbraw/zinc/57/71/90/1376577190.db2.gz	DODSFOWXVYFHQP-VQTJNVASSA-N	0	3	330.472	3.272	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CCN(Cc3ccc(C)c(O)c3)C2)C1	ZINC001233231707	1376593972	/nfs/dbraw/zinc/59/39/72/1376593972.db2.gz	YVOYZXPCRMXLOJ-HXUWFJFHSA-N	0	3	344.455	3.311	20	30		EGEDHN
N#Cc1ccc(CN2CCC([N@@H+]3CCc4ccccc4C3)CC2)c([O-])c1	ZINC001233386851	1376633904	/nfs/dbraw/zinc/63/39/04/1376633904.db2.gz	KXTMJQKTRBLFAX-UHFFFAOYSA-N	0	3	347.462	3.287	20	30		EGEDHN
N#Cc1ccc(CN2CCC([N@H+]3CCc4ccccc4C3)CC2)c([O-])c1	ZINC001233386851	1376633912	/nfs/dbraw/zinc/63/39/12/1376633912.db2.gz	KXTMJQKTRBLFAX-UHFFFAOYSA-N	0	3	347.462	3.287	20	30		EGEDHN
N#Cc1ccc(C[NH+]2CCC(N3CCc4ccccc4C3)CC2)c([O-])c1	ZINC001233386851	1376633915	/nfs/dbraw/zinc/63/39/15/1376633915.db2.gz	KXTMJQKTRBLFAX-UHFFFAOYSA-N	0	3	347.462	3.287	20	30		EGEDHN
C[C@@H](CC1CCCCC1)C(=O)NCCNCc1ccc(C#N)cc1	ZINC001134677832	1376651789	/nfs/dbraw/zinc/65/17/89/1376651789.db2.gz	KFNXXSJGVXYFIC-INIZCTEOSA-N	0	3	327.472	3.371	20	30		EGEDHN
C[C@@H](CC1CCCC1)C(=O)NCCNCc1ccc(C#N)c(F)c1	ZINC001134683171	1376656560	/nfs/dbraw/zinc/65/65/60/1376656560.db2.gz	JNTHLNMXYNVRJQ-AWEZNQCLSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)c1ccc(CC)o1	ZINC001134749196	1376697839	/nfs/dbraw/zinc/69/78/39/1376697839.db2.gz	QPKPVJPRCCNVIH-NWDGAFQWSA-N	0	3	343.265	3.237	20	30		EGEDHN
C=CCCOCCCCC(=O)N(C)C[C@H]1CCN1CC[C@H](C)F	ZINC001234276201	1376798487	/nfs/dbraw/zinc/79/84/87/1376798487.db2.gz	JZFQNZFITSTAJL-DLBZAZTESA-N	0	3	328.472	3.030	20	30		EGEDHN
C=CCCCN1CC[C@@H]1CN(C)C(=O)c1ccnc(-c2ccco2)c1	ZINC001235632766	1376880753	/nfs/dbraw/zinc/88/07/53/1376880753.db2.gz	LCUWRLFCJYFZIP-QGZVFWFLSA-N	0	3	339.439	3.454	20	30		EGEDHN
CN1CCC[C@@H]2CN(C(=O)c3ccc(C#C[Si](C)(C)C)cc3)C[C@H]21	ZINC001189169972	1388471988	/nfs/dbraw/zinc/47/19/88/1388471988.db2.gz	PEBMVFWWMLCISL-RTBURBONSA-N	0	3	340.543	3.082	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)C(C)(C)C1CC1	ZINC001135252391	1377003344	/nfs/dbraw/zinc/00/33/44/1377003344.db2.gz	RSLZGKXRTPQBMJ-RYUDHWBXSA-N	0	3	331.298	3.204	20	30		EGEDHN
C=CCCCC(=O)N[C@H](C)C[C@@H](C)NCc1nc2ccccc2n1C	ZINC001135358040	1377050625	/nfs/dbraw/zinc/05/06/25/1377050625.db2.gz	LRZBGGWTGIBSKD-HZPDHXFCSA-N	0	3	342.487	3.303	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc(C(F)F)cc2)cc1	ZINC001135385096	1377066863	/nfs/dbraw/zinc/06/68/63/1377066863.db2.gz	QRNDGRWBSYOMPJ-UHFFFAOYSA-N	0	3	329.350	3.015	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2conc2CC)CCC1	ZINC001135393914	1377071023	/nfs/dbraw/zinc/07/10/23/1377071023.db2.gz	ABCWGFZPGUFDBE-GJZGRUSLSA-N	0	3	333.476	3.356	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1cc(F)ccc1C#N)NC(=O)CC(C)(F)F	ZINC001135402560	1377075873	/nfs/dbraw/zinc/07/58/73/1377075873.db2.gz	OELNFMJXSAYKPT-NWDGAFQWSA-N	0	3	341.377	3.116	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](C)C[C@@H](C)NCc2nccn2CC)CC1	ZINC001135416445	1377083320	/nfs/dbraw/zinc/08/33/20/1377083320.db2.gz	UKCDBNUPNYDABD-CVEARBPZSA-N	0	3	332.492	3.022	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)c1ccc(Cl)[nH]1	ZINC001135420035	1377085442	/nfs/dbraw/zinc/08/54/42/1377085442.db2.gz	SKHZVMLJPRCMOJ-NXEZZACHSA-N	0	3	348.672	3.063	20	30		EGEDHN
CC(C)C1(C(=O)N[C@H](C)C[C@H](C)NCc2ccccc2C#N)CC1	ZINC001135439161	1377098571	/nfs/dbraw/zinc/09/85/71/1377098571.db2.gz	RXXNKWREPLFMQP-JKSUJKDBSA-N	0	3	327.472	3.367	20	30		EGEDHN
Cc1cccc(C(=O)NCCNCc2ccc(C#N)cc2)c1Cl	ZINC001135531918	1377131704	/nfs/dbraw/zinc/13/17/04/1377131704.db2.gz	HIWZKCRXBCNFJL-UHFFFAOYSA-N	0	3	327.815	3.040	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2ccc(C(F)F)cc2F)c1	ZINC001135776238	1377209208	/nfs/dbraw/zinc/20/92/08/1377209208.db2.gz	CCLYFRIEAGNREA-UHFFFAOYSA-N	0	3	347.340	3.155	20	30		EGEDHN
C=C(Br)CN[C@@H](C)CCNC(=O)c1cc(C)c(C)s1	ZINC001267157286	1377419137	/nfs/dbraw/zinc/41/91/37/1377419137.db2.gz	LGUDVJSNZRPKRG-NSHDSACASA-N	0	3	345.306	3.372	20	30		EGEDHN
CC1(C)CC(C(=O)NCC[C@@H]2CCN(Cc3ccc(C#N)s3)C2)C1	ZINC001267524139	1377451801	/nfs/dbraw/zinc/45/18/01/1377451801.db2.gz	PLAINUZLULITEM-CQSZACIVSA-N	0	3	345.512	3.384	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC2(C1)CCN(CCCC(F)(F)F)C2	ZINC001268985302	1377535359	/nfs/dbraw/zinc/53/53/59/1377535359.db2.gz	LMGACQZBKQQKGY-UHFFFAOYSA-N	0	3	332.410	3.466	20	30		EGEDHN
C=CCO[C@@H]1CO[C@]2(C1)CCCN(Cc1cccc(OCC)c1)C2	ZINC001138099340	1377676662	/nfs/dbraw/zinc/67/66/62/1377676662.db2.gz	RSLZDTMNRSFUFG-PMACEKPBSA-N	0	3	331.456	3.411	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@@H](C(F)(F)F)[C@H]2CO)c1[O-]	ZINC001138625639	1377755950	/nfs/dbraw/zinc/75/59/50/1377755950.db2.gz	RGYYSJZIBCAZEC-HUUCEWRRSA-N	0	3	329.362	3.256	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@@H](C(F)(F)F)[C@H]2CO)c1[O-]	ZINC001138625639	1377755956	/nfs/dbraw/zinc/75/59/56/1377755956.db2.gz	RGYYSJZIBCAZEC-HUUCEWRRSA-N	0	3	329.362	3.256	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2C[C@H]3CN(C(=O)OC(C)(C)C)[C@@H]3C2)c1[O-]	ZINC001138629525	1377756884	/nfs/dbraw/zinc/75/68/84/1377756884.db2.gz	BVZWGOYYABVCLU-DLBZAZTESA-N	0	3	344.455	3.172	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2C[C@H]3CN(C(=O)OC(C)(C)C)[C@@H]3C2)c1[O-]	ZINC001138629525	1377756885	/nfs/dbraw/zinc/75/68/85/1377756885.db2.gz	BVZWGOYYABVCLU-DLBZAZTESA-N	0	3	344.455	3.172	20	30		EGEDHN
C=CCc1cccc(CN2CC(C)(CNC(=O)OC(C)(C)C)C2)c1O	ZINC001138630659	1377757575	/nfs/dbraw/zinc/75/75/75/1377757575.db2.gz	ZTJFXNGYIWAMQP-UHFFFAOYSA-N	0	3	346.471	3.467	20	30		EGEDHN
C=C(C)COc1ccccc1CN1CCC2(CCCC(=O)N2)CC1	ZINC001138660961	1377764824	/nfs/dbraw/zinc/76/48/24/1377764824.db2.gz	JJMKGTQAOQLZBA-UHFFFAOYSA-N	0	3	328.456	3.276	20	30		EGEDHN
C=C(C)COc1ccccc1CN1CCC2(C[C@@H]2C(=O)N(C)C)CC1	ZINC001138664661	1377764953	/nfs/dbraw/zinc/76/49/53/1377764953.db2.gz	UGPRQWAQIBZCQZ-GOSISDBHSA-N	0	3	342.483	3.332	20	30		EGEDHN
C=CCOc1ccccc1CN1CCCN(c2ccc(C#N)cn2)CC1	ZINC001139029724	1377819781	/nfs/dbraw/zinc/81/97/81/1377819781.db2.gz	IYFWURMRZVUNIF-UHFFFAOYSA-N	0	3	348.450	3.230	20	30		EGEDHN
N#Cc1ccnc(-c2ccc(CN3CCC[C@@H](n4ccnn4)C3)cc2)c1	ZINC001139406370	1377880242	/nfs/dbraw/zinc/88/02/42/1377880242.db2.gz	QBQHBAPLHXGNSH-LJQANCHMSA-N	0	3	344.422	3.049	20	30		EGEDHN
C[C@@H]1CC[C@@H](CO)CN1Cc1ccc(Oc2ccc(C#N)cc2)nc1	ZINC001139427185	1377882233	/nfs/dbraw/zinc/88/22/33/1377882233.db2.gz	XHAPWLXLJNBUGU-CRAIPNDOSA-N	0	3	337.423	3.338	20	30		EGEDHN
N#Cc1ccc(Oc2ccc(CN3CCC[C@H](CO)CC3)cn2)cc1	ZINC001139427144	1377882258	/nfs/dbraw/zinc/88/22/58/1377882258.db2.gz	WJVIHUPAPDPFGJ-KRWDZBQOSA-N	0	3	337.423	3.340	20	30		EGEDHN
C[C@@H]1CC[C@H](CO)CN1Cc1ccc(Oc2ccc(C#N)cc2)nc1	ZINC001139427187	1377882398	/nfs/dbraw/zinc/88/23/98/1377882398.db2.gz	XHAPWLXLJNBUGU-QAPCUYQASA-N	0	3	337.423	3.338	20	30		EGEDHN
C[C@H]1CN(Cc2ccc(Oc3ccc(C#N)cc3)nc2)CCC[C@H]1O	ZINC001139426643	1377882417	/nfs/dbraw/zinc/88/24/17/1377882417.db2.gz	HRIRSLMVRBMBIU-HNAYVOBHSA-N	0	3	337.423	3.338	20	30		EGEDHN
COC(=O)c1ccc(C2CN(Cc3c[nH]c4c3cccc4C#N)C2)cc1	ZINC001139707258	1377938066	/nfs/dbraw/zinc/93/80/66/1377938066.db2.gz	UZNYZQJMHSJKSH-UHFFFAOYSA-N	0	3	345.402	3.426	20	30		EGEDHN
Cc1ccc(CN2CC[C@]3(C[C@H](OCC4CC4)CO3)C2)cc1C#N	ZINC001139724319	1377941410	/nfs/dbraw/zinc/94/14/10/1377941410.db2.gz	ODPYWUUGIGVBTD-PMACEKPBSA-N	0	3	326.440	3.027	20	30		EGEDHN
Cc1ccc(CN2CC[C@]3(C[C@H](Oc4ccccn4)CO3)C2)cc1C#N	ZINC001139725103	1377941907	/nfs/dbraw/zinc/94/19/07/1377941907.db2.gz	CPSFLKISQRYHNQ-FPOVZHCZSA-N	0	3	349.434	3.074	20	30		EGEDHN
C#C[C@@H]1CCCN(Cc2ccc3n2CCN(C(=O)OC(C)(C)C)C3)C1	ZINC001139929758	1377978869	/nfs/dbraw/zinc/97/88/69/1377978869.db2.gz	QOSOSYCDEJVBPX-MRXNPFEDSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3cc(F)cc(Cl)c3)C2)C1=O	ZINC001140537903	1378081113	/nfs/dbraw/zinc/08/11/13/1378081113.db2.gz	XJFOQCKHSSJCFK-GOSISDBHSA-N	0	3	336.838	3.480	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]3CN(CCCC(F)(F)F)C[C@H]32)C1	ZINC001273134264	1378089030	/nfs/dbraw/zinc/08/90/30/1378089030.db2.gz	ISPWHLCHYVFSOB-UONOGXRCSA-N	0	3	330.394	3.218	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@]23CCN([C@@H](C)CC)C3=O)c1[O-]	ZINC001273360221	1378098900	/nfs/dbraw/zinc/09/89/00/1378098900.db2.gz	JCZRFAVIROLLOV-HRAATJIYSA-N	0	3	342.483	3.486	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@]23CCN([C@@H](C)CC)C3=O)c1[O-]	ZINC001273360221	1378098902	/nfs/dbraw/zinc/09/89/02/1378098902.db2.gz	JCZRFAVIROLLOV-HRAATJIYSA-N	0	3	342.483	3.486	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN2Cc2ccccc2N2CCCC2)C1=O	ZINC001273360768	1378099161	/nfs/dbraw/zinc/09/91/61/1378099161.db2.gz	VMTCTSNUWJQTKG-OAQYLSRUSA-N	0	3	339.483	3.040	20	30		EGEDHN
C=C(C)CN1C[C@]2(CC1=O)CCCCN2Cc1cc(O)ccc1C	ZINC001274110774	1378117067	/nfs/dbraw/zinc/11/70/67/1378117067.db2.gz	URPZWDDKALYRBS-HXUWFJFHSA-N	0	3	328.456	3.234	20	30		EGEDHN
C#CCN1CC2(CCC1=O)CCN(Cc1cccc(Cl)c1C)CC2	ZINC001274413619	1378124376	/nfs/dbraw/zinc/12/43/76/1378124376.db2.gz	WIOOKQASYNOLCG-UHFFFAOYSA-N	0	3	344.886	3.486	20	30		EGEDHN
N#Cc1ccccc1OC1CCN(Cc2c[nH]c3ccncc23)CC1	ZINC001140804843	1378144870	/nfs/dbraw/zinc/14/48/70/1378144870.db2.gz	HUJCGOFAJVGHRH-UHFFFAOYSA-N	0	3	332.407	3.478	20	30		EGEDHN
CC(C)CCC(=O)N1CCC[C@H]2CN(Cc3cccc(C#N)c3)C[C@H]21	ZINC001279597120	1378315431	/nfs/dbraw/zinc/31/54/31/1378315431.db2.gz	GRNHDCJLHAGYOJ-VQTJNVASSA-N	0	3	339.483	3.417	20	30		EGEDHN
O[C@H]1CCN(Cc2ccc(C#Cc3ccccc3)s2)CC[C@@H]1F	ZINC001141972459	1378400338	/nfs/dbraw/zinc/40/03/38/1378400338.db2.gz	KRQDFGRXYFRPHV-OALUTQOASA-N	0	3	329.440	3.443	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)C2(CCOC)CC2)CC1	ZINC001281834400	1378455141	/nfs/dbraw/zinc/45/51/41/1378455141.db2.gz	YBQWJZHLZAZZKI-UHFFFAOYSA-N	0	3	342.911	3.116	20	30		EGEDHN
N#Cc1cccc(O[C@H]2CCCN(Cc3ccc4nccn4c3)C2)c1	ZINC001143027783	1378528855	/nfs/dbraw/zinc/52/88/55/1378528855.db2.gz	RWDSBIXKBYCAFH-IBGZPJMESA-N	0	3	332.407	3.249	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)Cc1ccc(F)c(C(F)(F)F)c1	ZINC001143695303	1378636309	/nfs/dbraw/zinc/63/63/09/1378636309.db2.gz	SLWKGWGWKFRVOK-ZDUSSCGKSA-N	0	3	344.352	3.154	20	30		EGEDHN
Cc1oc(C(C)C)cc1C(=O)NCCNCc1cccc(C#N)c1	ZINC001146343701	1378821938	/nfs/dbraw/zinc/82/19/38/1378821938.db2.gz	ABXKKQTVHWAQGB-UHFFFAOYSA-N	0	3	325.412	3.103	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2nccnc2C)CCCC1	ZINC001146821447	1378928758	/nfs/dbraw/zinc/92/87/58/1378928758.db2.gz	MEVOMRHUQPNGIF-HOTGVXAUSA-N	0	3	344.503	3.294	20	30		EGEDHN
C[C@@H](CN(C)C(=O)C1C(C)(C)C1(C)C)NCc1ccc(F)c(C#N)c1	ZINC001283593805	1379039987	/nfs/dbraw/zinc/03/99/87/1379039987.db2.gz	FCQFPXOACIOBDX-ZDUSSCGKSA-N	0	3	345.462	3.316	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)C[C@H](C)Cc3cccc(F)c3)C2)C1	ZINC001147566716	1379044049	/nfs/dbraw/zinc/04/40/49/1379044049.db2.gz	QPKCLYHOHDYQAH-MRXNPFEDSA-N	0	3	330.447	3.115	20	30		EGEDHN
CC#CCCCC(=O)N1CC2(C1)CCN(CCCCC(F)(F)F)C2	ZINC001148111394	1379120575	/nfs/dbraw/zinc/12/05/75/1379120575.db2.gz	YCSHYWWBZATCHQ-UHFFFAOYSA-N	0	3	344.421	3.447	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC2(C1)CCN(Cc1sc(C)nc1C)C2	ZINC001148131999	1379122852	/nfs/dbraw/zinc/12/28/52/1379122852.db2.gz	XBBLLFPZLUZHMV-INIZCTEOSA-N	0	3	347.528	3.397	20	30		EGEDHN
CCCC1(C(=O)N2CC3(C2)CCN(Cc2ccc(C#N)cc2)C3)CC1	ZINC001148241397	1379137696	/nfs/dbraw/zinc/13/76/96/1379137696.db2.gz	KHJCUDQRHVAHEM-UHFFFAOYSA-N	0	3	337.467	3.173	20	30		EGEDHN
Cc1ccc(C(C)(C)C(=O)NCCNCc2ccc(C#N)cc2)cc1	ZINC001148329966	1379154102	/nfs/dbraw/zinc/15/41/02/1379154102.db2.gz	XVYSBZIMTRZVJB-UHFFFAOYSA-N	0	3	335.451	3.050	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC2(C1)CCN(Cc1sc(C)nc1C)C2	ZINC001148357348	1379156052	/nfs/dbraw/zinc/15/60/52/1379156052.db2.gz	KGXNKNKKFACCJZ-UHFFFAOYSA-N	0	3	347.528	3.397	20	30		EGEDHN
CCCCCCCCCCC(=O)NCCNCC(=O)NC(C)(C)C	ZINC001148763976	1379264119	/nfs/dbraw/zinc/26/41/19/1379264119.db2.gz	MHTQGAMSKCQJBZ-UHFFFAOYSA-N	0	3	341.540	3.138	20	30		EGEDHN
CCCCCCCCCCC(=O)NCCNCC(=O)N(C)C(C)C	ZINC001148763885	1379264152	/nfs/dbraw/zinc/26/41/52/1379264152.db2.gz	IRSRORBELLPYHU-UHFFFAOYSA-N	0	3	341.540	3.090	20	30		EGEDHN
Cc1cc(C(=O)NCCNCc2ccc(C#N)cc2)c(Cl)cc1F	ZINC001149239531	1379353336	/nfs/dbraw/zinc/35/33/36/1379353336.db2.gz	LFIMXUBXELEFDE-UHFFFAOYSA-N	0	3	345.805	3.179	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccsc2C(F)F)cc1	ZINC001149397108	1379375498	/nfs/dbraw/zinc/37/54/98/1379375498.db2.gz	QUXAXTLZUWWDJX-UHFFFAOYSA-N	0	3	335.379	3.077	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@H]1CN([C@H](C)c2ccccc2)CCCO1	ZINC001149797035	1379449036	/nfs/dbraw/zinc/44/90/36/1379449036.db2.gz	QFEHBVWKZYYBNH-MJGOQNOKSA-N	0	3	330.472	3.311	20	30		EGEDHN
CCC[C@@H](C(=O)NCCNCc1ccc(C#N)s1)c1ccccc1	ZINC001150043953	1379488819	/nfs/dbraw/zinc/48/88/19/1379488819.db2.gz	JFCSUGCFBKZMNY-GOSISDBHSA-N	0	3	341.480	3.409	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@@H]1CN(CC2=CCCCC2)CCCO1	ZINC001150138767	1379501034	/nfs/dbraw/zinc/50/10/34/1379501034.db2.gz	DVABAEWKYCDENF-IEBWSBKVSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@@H]1CN(Cc2cccc(C)c2)CCCO1	ZINC001150140754	1379501303	/nfs/dbraw/zinc/50/13/03/1379501303.db2.gz	VNANIKSAMGIKFW-AZUAARDMSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@H]1CN(Cc2ccccc2C)CCCO1	ZINC001150159348	1379505640	/nfs/dbraw/zinc/50/56/40/1379505640.db2.gz	GUOQWBPJSNJSFS-QUCCMNQESA-N	0	3	344.499	3.304	20	30		EGEDHN
Cc1cc(C)c(C(=O)NCCNCc2ccc(F)c(C#N)c2)c(C)c1	ZINC001150164347	1379506666	/nfs/dbraw/zinc/50/66/66/1379506666.db2.gz	SHLOSCLQMGTOIN-UHFFFAOYSA-N	0	3	339.414	3.142	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)CCCCc2ccccc2)C1	ZINC001150202256	1379513566	/nfs/dbraw/zinc/51/35/66/1379513566.db2.gz	CZMPULIGGOLKHD-HXUWFJFHSA-N	0	3	344.499	3.183	20	30		EGEDHN
Cc1ccc2c(CC(=O)NCCNCc3ccc(C#N)cc3)coc2c1	ZINC001150226910	1379519731	/nfs/dbraw/zinc/51/97/31/1379519731.db2.gz	KBVDUULSUMULDF-UHFFFAOYSA-N	0	3	347.418	3.061	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@H]2CN([C@H](C)c3ccccc3)CCCO2)C1	ZINC001150293337	1379529339	/nfs/dbraw/zinc/52/93/39/1379529339.db2.gz	YBTFVSWKHUWVOU-IEBWSBKVSA-N	0	3	342.483	3.311	20	30		EGEDHN
CCc1cc(C(=O)NCCNCc2ccc(C#N)cc2)sc1C	ZINC001150388051	1379544302	/nfs/dbraw/zinc/54/43/02/1379544302.db2.gz	WILJQXPUBNOBLD-UHFFFAOYSA-N	0	3	327.453	3.010	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)[C@@H](CC)Cc2ccccc2)C1	ZINC001150393218	1379546054	/nfs/dbraw/zinc/54/60/54/1379546054.db2.gz	BHLWIIQYJKMMPX-VQTJNVASSA-N	0	3	344.499	3.039	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)C[C@H](C)c2ccccc2C)C1	ZINC001150404151	1379549759	/nfs/dbraw/zinc/54/97/59/1379549759.db2.gz	URJZMJAGJJVPIB-OALUTQOASA-N	0	3	344.499	3.272	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)CC(C)(C)C2CC2)CC1	ZINC001151108291	1379663329	/nfs/dbraw/zinc/66/33/29/1379663329.db2.gz	OYKZKNDZGDCDGF-UHFFFAOYSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2cc[nH]c2CCC)CC1	ZINC001151266420	1379690205	/nfs/dbraw/zinc/69/02/05/1379690205.db2.gz	DUPXPZLQBIDHQC-UHFFFAOYSA-N	0	3	347.503	3.144	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2ccccc2CC)CC1	ZINC001151275488	1379692070	/nfs/dbraw/zinc/69/20/70/1379692070.db2.gz	QKJBYFYJOHDFQL-UHFFFAOYSA-N	0	3	344.499	3.426	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2cc(Cl)cs2)CC1	ZINC001151351898	1379704064	/nfs/dbraw/zinc/70/40/64/1379704064.db2.gz	LFRWZUFUZDPOAC-UHFFFAOYSA-N	0	3	342.892	3.188	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2cc(C)ccc2C)CC1	ZINC001151402179	1379710967	/nfs/dbraw/zinc/71/09/67/1379710967.db2.gz	APMLSLNQMKLPEQ-UHFFFAOYSA-N	0	3	344.499	3.480	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)c1ccoc1C	ZINC001151801361	1379785013	/nfs/dbraw/zinc/78/50/13/1379785013.db2.gz	QFACTYCRCJGHNT-CQSZACIVSA-N	0	3	325.412	3.100	20	30		EGEDHN
C=C[C@H](CC(=O)NCCNCc1ccc(Cl)nc1)c1ccccc1	ZINC001151942406	1379821461	/nfs/dbraw/zinc/82/14/61/1379821461.db2.gz	HZGVHSJCSWIKKQ-MRXNPFEDSA-N	0	3	343.858	3.301	20	30		EGEDHN
C=C[C@@H](C(=O)NCCNCc1ccc(F)c(F)c1)c1ccccc1	ZINC001151990285	1379832353	/nfs/dbraw/zinc/83/23/53/1379832353.db2.gz	FAFWVTICNXCZRI-MRXNPFEDSA-N	0	3	330.378	3.140	20	30		EGEDHN
C=C[C@H](C(=O)NCCNCc1ccc(C)c(F)c1)c1ccccc1	ZINC001151998217	1379835397	/nfs/dbraw/zinc/83/53/97/1379835397.db2.gz	RIBJRBDETYXJEG-SFHVURJKSA-N	0	3	326.415	3.310	20	30		EGEDHN
Cc1cccc2oc(C(=O)NCCNCc3cccc(C#N)c3)cc21	ZINC001152893522	1379991970	/nfs/dbraw/zinc/99/19/70/1379991970.db2.gz	ZXGKBFNSKQHDHV-UHFFFAOYSA-N	0	3	333.391	3.133	20	30		EGEDHN
CC1CCC(C)(C(=O)NCCNCc2ccc(C#N)c(F)c2)CC1	ZINC001152918276	1379994132	/nfs/dbraw/zinc/99/41/32/1379994132.db2.gz	RRZSXQNEHZRBRR-UHFFFAOYSA-N	0	3	331.435	3.120	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2ccc(-c3ccccc3)[nH]2)c1	ZINC001153433722	1380076780	/nfs/dbraw/zinc/07/67/80/1380076780.db2.gz	HGXJJQMKWHFMED-UHFFFAOYSA-N	0	3	344.418	3.073	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1cn(CC)c2ccccc12	ZINC001154229148	1380234409	/nfs/dbraw/zinc/23/44/09/1380234409.db2.gz	HMQWUTXSGDBGKB-MRXNPFEDSA-N	0	3	325.456	3.125	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)[C@]1(C)C=CCC1	ZINC001154683016	1380331277	/nfs/dbraw/zinc/33/12/77/1380331277.db2.gz	STYUIZLXNUBUOJ-OXQOHEQNSA-N	0	3	325.456	3.241	20	30		EGEDHN
C=C/C(C)=C\CC(=O)NC[C@@H](C)N(CC)Cc1cccc(C#N)c1	ZINC001154699842	1380334728	/nfs/dbraw/zinc/33/47/28/1380334728.db2.gz	SFFQIPIDDJUFSG-LPPOOGIUSA-N	0	3	325.456	3.407	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@@H](C)N(CC)Cc1ccc2nonc2c1	ZINC001154742906	1380343884	/nfs/dbraw/zinc/34/38/84/1380343884.db2.gz	OGTWAFLDJKNSGY-LSDHHAIUSA-N	0	3	344.459	3.152	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NCCCN[C@@H](C)c1c(F)cccc1F	ZINC001155440526	1380454213	/nfs/dbraw/zinc/45/42/13/1380454213.db2.gz	TUFQOCZUDYOULR-UONOGXRCSA-N	0	3	340.414	3.103	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)[C@H](C)C(C)C	ZINC001155580589	1380470534	/nfs/dbraw/zinc/47/05/34/1380470534.db2.gz	DJJGGCIZUTXEMP-HUUCEWRRSA-N	0	3	333.451	3.316	20	30		EGEDHN
C=CCCC(=O)NCCCNCc1nc(-c2ccccc2)cs1	ZINC001155587025	1380470878	/nfs/dbraw/zinc/47/08/78/1380470878.db2.gz	UUPGDGYZFHSYDK-UHFFFAOYSA-N	0	3	329.469	3.372	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)C(C1CC1)C1CC1	ZINC001156282908	1380552274	/nfs/dbraw/zinc/55/22/74/1380552274.db2.gz	AMIWYIBPGGMOCB-OAHLLOKOSA-N	0	3	339.483	3.321	20	30		EGEDHN
N#Cc1nc(Cl)ccc1C(F)(F)n1nc(CN)c2ccccc21	ZINC001156855449	1380697177	/nfs/dbraw/zinc/69/71/77/1380697177.db2.gz	KHXRWCVHACKVHU-UHFFFAOYSA-N	0	3	333.729	3.013	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NC[C@@H](C)N(CC)C/C=C\c1ccccc1	ZINC001157214167	1380812512	/nfs/dbraw/zinc/81/25/12/1380812512.db2.gz	ZOZHCRQMQRXLFA-CPZOXXFISA-N	0	3	330.472	3.118	20	30		EGEDHN
COc1cccc(CN(C)C[C@H]2CCCCN2C(=O)C#CC(C)C)c1	ZINC001157940117	1381076920	/nfs/dbraw/zinc/07/69/20/1381076920.db2.gz	UULISGPEQHJGFA-LJQANCHMSA-N	0	3	342.483	3.168	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)Cc1cc(C)c(Cl)cn1	ZINC001158128745	1381137122	/nfs/dbraw/zinc/13/71/22/1381137122.db2.gz	JASBBXIWZSQWMN-MRXNPFEDSA-N	0	3	335.879	3.085	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H](C)OCc1ccccc1	ZINC001158212292	1381161316	/nfs/dbraw/zinc/16/13/16/1381161316.db2.gz	IUXZJMZCDVEPBR-PKOBYXMFSA-N	0	3	330.472	3.091	20	30		EGEDHN
CC#CCCCC(=O)N1CCCC[C@@H]1CN(C)CCOCC(C)C	ZINC001158357632	1381215697	/nfs/dbraw/zinc/21/56/97/1381215697.db2.gz	LKTLMCISOKVCFS-LJQANCHMSA-N	0	3	336.520	3.166	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)CCCOc1ccccc1F	ZINC001158909503	1381458309	/nfs/dbraw/zinc/45/83/09/1381458309.db2.gz	QRMPQPRYKZFNSM-QGZVFWFLSA-N	0	3	348.462	3.484	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cnc(CC(C)C)s1	ZINC001158955695	1381484029	/nfs/dbraw/zinc/48/40/29/1381484029.db2.gz	SGOPEBADXJUMIR-OAHLLOKOSA-N	0	3	335.517	3.454	20	30		EGEDHN
Cc1cc(C(=O)NCC[C@H](C)NCc2ccccc2C#N)ccc1F	ZINC001328402368	1388738056	/nfs/dbraw/zinc/73/80/56/1388738056.db2.gz	GTPBXBNKKKLOFO-HNNXBMFYSA-N	0	3	339.414	3.304	20	30		EGEDHN
C=CCCC(=O)NCCC1=CCN(CCOc2ccc(F)cc2)CC1	ZINC001159538635	1381822089	/nfs/dbraw/zinc/82/20/89/1381822089.db2.gz	FCPPFNFFMCVQAY-UHFFFAOYSA-N	0	3	346.446	3.309	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCC1=CCN([C@@H](C)c2cccc(F)c2)CC1	ZINC001159595435	1381842671	/nfs/dbraw/zinc/84/26/71/1381842671.db2.gz	YTAVVGWQJYBVDV-GJZGRUSLSA-N	0	3	329.419	3.185	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cccc3c2CCCC3)CC1	ZINC001160228149	1382040835	/nfs/dbraw/zinc/04/08/35/1382040835.db2.gz	KGRMCOUMOWQOJU-UHFFFAOYSA-N	0	3	336.479	3.341	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H]2CCCc3ccccc32)CC1	ZINC001160492597	1382122238	/nfs/dbraw/zinc/12/22/38/1382122238.db2.gz	VDQKJVBIUIYWIO-OAQYLSRUSA-N	0	3	336.479	3.268	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCC1=CCN(Cc2ncccc2C)CC1	ZINC001160941791	1382244481	/nfs/dbraw/zinc/24/44/81/1382244481.db2.gz	PZHGHAZISSVGBE-FUHWJXTLSA-N	0	3	341.499	3.487	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)[C@@H]1CCCc2ccccc21	ZINC001161018379	1382273633	/nfs/dbraw/zinc/27/36/33/1382273633.db2.gz	BVWVWNCDSMCWOG-OAQYLSRUSA-N	0	3	347.462	3.274	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)Cc2c(C)cc(C)cc2C)CC1	ZINC001161084493	1382294110	/nfs/dbraw/zinc/29/41/10/1382294110.db2.gz	NJSYVEFXXWCZPC-UHFFFAOYSA-N	0	3	338.495	3.316	20	30		EGEDHN
N#Cc1cc(Cl)nc(NC2CCN(Cc3ccc(O)cc3)CC2)c1	ZINC001161131248	1382312372	/nfs/dbraw/zinc/31/23/72/1382312372.db2.gz	RTXDKLHPLWXDJZ-UHFFFAOYSA-N	0	3	342.830	3.389	20	30		EGEDHN
N#Cc1cc(Cl)cc(NCC2CCN(Cc3ccccn3)CC2)n1	ZINC001161242612	1382352438	/nfs/dbraw/zinc/35/24/38/1382352438.db2.gz	AKVSIFRTDNYKGZ-UHFFFAOYSA-N	0	3	341.846	3.326	20	30		EGEDHN
CC[C@@H](Nc1nccnc1C(C#N)C(=O)OC(C)(C)C)C(F)(F)F	ZINC001161382701	1382391330	/nfs/dbraw/zinc/39/13/30/1382391330.db2.gz	OEMLCTSTMDNAJZ-NXEZZACHSA-N	0	3	344.337	3.178	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cnn([C@@H](C)CC)c2C)CC1	ZINC001161678989	1382478620	/nfs/dbraw/zinc/47/86/20/1382478620.db2.gz	RQOFUPZHXNDDPE-HNNXBMFYSA-N	0	3	330.476	3.101	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C2CCC(C(F)F)CC2)CC1	ZINC001161801539	1382510410	/nfs/dbraw/zinc/51/04/10/1382510410.db2.gz	KDONLAGIWXTIGK-UHFFFAOYSA-N	0	3	338.442	3.220	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H]2C[C@H]2c2cccc(F)c2F)CC1	ZINC001161907638	1382547792	/nfs/dbraw/zinc/54/77/92/1382547792.db2.gz	CKDBLIVDUVADJL-DLBZAZTESA-N	0	3	346.421	3.393	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@H]1[C@@H](C=C(C)C)C1(C)C	ZINC001162150169	1382639890	/nfs/dbraw/zinc/63/98/90/1382639890.db2.gz	JMBRZUDDCUAIIO-ZIAGYGMSSA-N	0	3	343.309	3.229	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1ccc2occc2c1	ZINC001162821966	1382885980	/nfs/dbraw/zinc/88/59/80/1382885980.db2.gz	BBTJYEYXKXPGLZ-UHFFFAOYSA-N	0	3	346.430	3.341	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C[C@H]1CCC[C@@H]1C	ZINC001162822438	1382886716	/nfs/dbraw/zinc/88/67/16/1382886716.db2.gz	QKKXOVMPGMTWMB-AZUAARDMSA-N	0	3	326.484	3.107	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C[C@H]1CCC[C@@H]1C	ZINC001162822382	1382886914	/nfs/dbraw/zinc/88/69/14/1382886914.db2.gz	NJQHYKGIBHWENK-PZJWPPBQSA-N	0	3	340.511	3.497	20	30		EGEDHN
C=C1CCC(C(=O)N(CCNCCF)CCc2ccccc2)CC1	ZINC001162918351	1382915954	/nfs/dbraw/zinc/91/59/54/1382915954.db2.gz	AGLIQCVPJLTTGZ-UHFFFAOYSA-N	0	3	332.463	3.363	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H](C)c1ccsc1	ZINC001162929213	1382918904	/nfs/dbraw/zinc/91/89/04/1382918904.db2.gz	SPSLJWBKMOYMPA-QGZVFWFLSA-N	0	3	340.492	3.146	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C1(C(C)(F)F)CC1	ZINC001162935476	1382920569	/nfs/dbraw/zinc/92/05/69/1382920569.db2.gz	XQCWCEJOBSTGCP-UHFFFAOYSA-N	0	3	348.437	3.106	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H](C)CC(C)(C)C	ZINC001162952352	1382925729	/nfs/dbraw/zinc/92/57/29/1382925729.db2.gz	MSAIHIBKUZQFHR-SFHVURJKSA-N	0	3	328.500	3.353	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)CCC(C)(C)C	ZINC001162960189	1382927931	/nfs/dbraw/zinc/92/79/31/1382927931.db2.gz	OEOJNCHVEPUQNZ-UHFFFAOYSA-N	0	3	328.500	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H](C)c1ccccc1	ZINC001162987382	1382938776	/nfs/dbraw/zinc/93/87/76/1382938776.db2.gz	OKEJZASYXOYEQW-IBGZPJMESA-N	0	3	334.463	3.084	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CC[C@H](CC)CC1	ZINC001162987655	1382938965	/nfs/dbraw/zinc/93/89/65/1382938965.db2.gz	SRBGSFGZFVOKAM-XUTJKUGGSA-N	0	3	340.511	3.497	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)[C@H]2CC[C@@H]3C[C@@H]3CC2)c(F)c1	ZINC001163006891	1382945775	/nfs/dbraw/zinc/94/57/75/1382945775.db2.gz	ODBUJUGFYSPAHN-BJWYYQGGSA-N	0	3	343.446	3.120	20	30		EGEDHN
COc1cc(CCC#N)c(N[C@H]2CNCc3ccsc32)cc1OC	ZINC001163230649	1383001553	/nfs/dbraw/zinc/00/15/53/1383001553.db2.gz	YXPJRJFIARHDOX-HNNXBMFYSA-N	0	3	343.452	3.478	20	30		EGEDHN
CC(C)N1CCN(Cc2ccc(NC3=CC(=O)CCC3)c(F)c2)CC1	ZINC001163468090	1383058247	/nfs/dbraw/zinc/05/82/47/1383058247.db2.gz	IYPHSFLZFRIEDF-UHFFFAOYSA-N	0	3	345.462	3.401	20	30		EGEDHN
CC[C@H](C)C(=O)NCCC1(CNCc2ccc(C#N)cc2F)CC1	ZINC001163496867	1383065709	/nfs/dbraw/zinc/06/57/09/1383065709.db2.gz	VUNPYAUODBAXDY-AWEZNQCLSA-N	0	3	331.435	3.120	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCCNCc2c(F)cccc2Cl)cc1	ZINC001163729392	1383115277	/nfs/dbraw/zinc/11/52/77/1383115277.db2.gz	RWGHGWHPIHVHTO-UHFFFAOYSA-N	0	3	344.817	3.370	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCCNCc2cccc(Cl)c2F)cc1	ZINC001163733784	1383116109	/nfs/dbraw/zinc/11/61/09/1383116109.db2.gz	CNXLSQSJRSGUOR-UHFFFAOYSA-N	0	3	344.817	3.370	20	30		EGEDHN
C[C@@H](C(=O)NCCC1(CNCc2ccc(C#N)cc2F)CC1)C1CC1	ZINC001163965104	1383140797	/nfs/dbraw/zinc/14/07/97/1383140797.db2.gz	KPPIMZXMQTWCLJ-CQSZACIVSA-N	0	3	343.446	3.120	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCCCNCc1ccn(C2CCCC2)n1	ZINC001164345664	1383179655	/nfs/dbraw/zinc/17/96/55/1383179655.db2.gz	FSBYANOTEOPMSS-MRXNPFEDSA-N	0	3	332.492	3.196	20	30		EGEDHN
CC(C)(C)C#CC(=O)NCCC1(CNCc2ccncc2Cl)CC1	ZINC001164482594	1383191103	/nfs/dbraw/zinc/19/11/03/1383191103.db2.gz	AGFLRSLXFILJTN-UHFFFAOYSA-N	0	3	347.890	3.161	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C[C@@H]2CCC(F)(F)C2)CC1	ZINC001165374547	1383282172	/nfs/dbraw/zinc/28/21/72/1383282172.db2.gz	VLXVNGXMFTZFPF-ZDUSSCGKSA-N	0	3	334.838	3.441	20	30		EGEDHN
C=CCOc1ccc(C(=O)NCCC2(CNCC(=C)Cl)CC2)cc1	ZINC001165805641	1383347267	/nfs/dbraw/zinc/34/72/67/1383347267.db2.gz	UKKUUBDRMZTPAS-UHFFFAOYSA-N	0	3	348.874	3.494	20	30		EGEDHN
C#CCCCCCC(=O)NCCC1(CNCc2ccccn2)CC1	ZINC001166589430	1383442039	/nfs/dbraw/zinc/44/20/39/1383442039.db2.gz	ZUSWJSLVDMPQGZ-UHFFFAOYSA-N	0	3	327.472	3.041	20	30		EGEDHN
C[C@@H]1CCCN(c2nccnc2C(C#N)C(=O)OC(C)(C)C)[C@@H]1C	ZINC001166612974	1383447224	/nfs/dbraw/zinc/44/72/24/1383447224.db2.gz	BZEHUTWVIPACDC-MCIONIFRSA-N	0	3	330.432	3.050	20	30		EGEDHN
C[C@@]1(C(=O)NCCC2(CNCc3ccccc3C#N)CC2)C=CCC1	ZINC001166655223	1383454094	/nfs/dbraw/zinc/45/40/94/1383454094.db2.gz	LZZVWCMVXCAHFR-HXUWFJFHSA-N	0	3	337.467	3.291	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCC1(CNCC(=C)Br)CC1	ZINC001166693686	1383461744	/nfs/dbraw/zinc/46/17/44/1383461744.db2.gz	JEQQUARGYXBQGH-TZMCWYRMSA-N	0	3	343.309	3.229	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCC1(CNCc2ccc(F)cn2)CC1	ZINC001166696029	1383462731	/nfs/dbraw/zinc/46/27/31/1383462731.db2.gz	VQQABUHXHYXPOZ-GJZGRUSLSA-N	0	3	333.451	3.055	20	30		EGEDHN
C[C@H]1C[C@@H]1CC(=O)NCCC1(CNCc2cc(C#N)ccc2F)CC1	ZINC001167011066	1383516834	/nfs/dbraw/zinc/51/68/34/1383516834.db2.gz	AAVXSGIQFCBPRY-GOEBONIOSA-N	0	3	343.446	3.120	20	30		EGEDHN
N#Cc1c(-c2ccccc2)ccnc1-n1nc(CN)c2ccccc21	ZINC001167695087	1383713793	/nfs/dbraw/zinc/71/37/93/1383713793.db2.gz	CCFNQAUEBGUROT-UHFFFAOYSA-N	0	3	325.375	3.418	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)COc2ccccc2C)CC1	ZINC001167952895	1383777820	/nfs/dbraw/zinc/77/78/20/1383777820.db2.gz	LXZMJNYRUQDQES-UHFFFAOYSA-N	0	3	336.863	3.002	20	30		EGEDHN
C=CC1(CC(=O)NCCCN[C@H](C)c2cnc(C)cn2)CCCCC1	ZINC001168182610	1383836501	/nfs/dbraw/zinc/83/65/01/1383836501.db2.gz	HQDNWIRGHUTEDU-QGZVFWFLSA-N	0	3	344.503	3.469	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2csc(C3CC3)n2)CC1	ZINC001168485934	1383919924	/nfs/dbraw/zinc/91/99/24/1383919924.db2.gz	ZWSWMMHFKBSUEL-UHFFFAOYSA-N	0	3	339.892	3.263	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H](NCC2(C#N)CC2)C[C@H]1C(F)(F)F	ZINC001168523763	1383929625	/nfs/dbraw/zinc/92/96/25/1383929625.db2.gz	MGQMXTMDOONODJ-NEPJUHHUSA-N	0	3	347.381	3.210	20	30		EGEDHN
C[C@@H](CC#N)N[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C(F)(F)F)C1	ZINC001168531109	1383931296	/nfs/dbraw/zinc/93/12/96/1383931296.db2.gz	UQNRMVWPRPAMNU-TUAOUCFPSA-N	0	3	335.370	3.209	20	30		EGEDHN
C[C@@H](CCCCNCc1cc(F)ccc1C#N)NC(=O)C1CCC1	ZINC001168730772	1383983536	/nfs/dbraw/zinc/98/35/36/1383983536.db2.gz	MZDIKEZSQNCEGJ-AWEZNQCLSA-N	0	3	331.435	3.262	20	30		EGEDHN
C[C@H]1C[C@H](N(C)Cc2ccc(C#N)cc2)CN1C(=O)OC(C)(C)C	ZINC001168865456	1384039952	/nfs/dbraw/zinc/03/99/52/1384039952.db2.gz	MPAZRSVFBKCHGH-YOEHRIQHSA-N	0	3	329.444	3.388	20	30		EGEDHN
COCCN(CCC(=O)OC(C)(C)C)[C@H](C)c1cccc(C#N)c1	ZINC001308142264	1384100783	/nfs/dbraw/zinc/10/07/83/1384100783.db2.gz	KMCOFINLLLOBLG-OAHLLOKOSA-N	0	3	332.444	3.299	20	30		EGEDHN
CC(C)SCC(=O)N[C@H](C)CCCCNCc1ccccc1C#N	ZINC001169266521	1384129764	/nfs/dbraw/zinc/12/97/64/1384129764.db2.gz	HTIKXCKLKQKFOL-MRXNPFEDSA-N	0	3	347.528	3.464	20	30		EGEDHN
CC[C@H]1CCCC[C@@H]1C(=O)NCCCNCc1ccccc1C#N	ZINC001169729616	1384179366	/nfs/dbraw/zinc/17/93/66/1384179366.db2.gz	NMTGVXKUHNGUBZ-LPHOPBHVSA-N	0	3	327.472	3.371	20	30		EGEDHN
CC[C@]1(C(C)C)C[C@@H]1C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001169730049	1384179707	/nfs/dbraw/zinc/17/97/07/1384179707.db2.gz	QXYUBYMTXROBFI-YLJYHZDGSA-N	0	3	345.462	3.366	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)c1cscn1	ZINC001169738473	1384180698	/nfs/dbraw/zinc/18/06/98/1384180698.db2.gz	RFPBQLVMUYKUCZ-AWEZNQCLSA-N	0	3	342.468	3.093	20	30		EGEDHN
CSC[C@H](C)C(=O)N[C@H](C)CCCCNCc1ccccc1C#N	ZINC001169821722	1384189143	/nfs/dbraw/zinc/18/91/43/1384189143.db2.gz	NDOUQYZAVYGQNR-JKSUJKDBSA-N	0	3	347.528	3.322	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)/C=C\C1CC1	ZINC001169981699	1384209917	/nfs/dbraw/zinc/20/99/17/1384209917.db2.gz	GJVRUGJAYHKXCH-JNSOCZORSA-N	0	3	325.456	3.289	20	30		EGEDHN
CS[C@@H](C)CC(=O)N[C@H](C)CCCCNCc1ccccc1C#N	ZINC001170230192	1384271003	/nfs/dbraw/zinc/27/10/03/1384271003.db2.gz	ACTTXVDUXOGMSB-CVEARBPZSA-N	0	3	347.528	3.464	20	30		EGEDHN
CO[C@H](C)CCC(=O)N[C@H](C)CCCCNCc1ccccc1C#N	ZINC001170303752	1384286322	/nfs/dbraw/zinc/28/63/22/1384286322.db2.gz	PQJMOGIQNVZERV-IAGOWNOFSA-N	0	3	345.487	3.138	20	30		EGEDHN
CO[C@@H]1[C@H](C)[C@@H](NCc2cc(C#N)ccc2Br)C1(C)C	ZINC001170399144	1384307798	/nfs/dbraw/zinc/30/77/98/1384307798.db2.gz	HPRZORFWZHFFJC-VCTAVGKDSA-N	0	3	337.261	3.470	20	30		EGEDHN
Cc1nc(CNCCCC[C@H](C)NC(=O)C#CC(C)C)c(C)s1	ZINC001170647628	1384355971	/nfs/dbraw/zinc/35/59/71/1384355971.db2.gz	HJYWZFPHNGYYTL-AWEZNQCLSA-N	0	3	335.517	3.184	20	30		EGEDHN
C[C@H](C(=O)NCCCNCc1ccc(C#N)cc1F)C1CCCC1	ZINC001170755608	1384380188	/nfs/dbraw/zinc/38/01/88/1384380188.db2.gz	HJBTUDZVXWUCRX-AWEZNQCLSA-N	0	3	331.435	3.120	20	30		EGEDHN
N#Cc1ccc(N2CCN([C@H]3CCc4cccc(F)c4C3)CC2)cc1	ZINC001170997303	1384426701	/nfs/dbraw/zinc/42/67/01/1384426701.db2.gz	RCZDPPBAICAPDK-IBGZPJMESA-N	0	3	335.426	3.377	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H](C)CCCCN[C@H](C)c1nnc(CC)[nH]1	ZINC001170997966	1384427083	/nfs/dbraw/zinc/42/70/83/1384427083.db2.gz	NCGSCLCDNADHRL-LSDHHAIUSA-N	0	3	349.523	3.295	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H](C)CCCCNCc1cc2n(n1)CCC2	ZINC001170998082	1384427108	/nfs/dbraw/zinc/42/71/08/1384427108.db2.gz	ONGUGGYPGGRKFU-INIZCTEOSA-N	0	3	346.519	3.196	20	30		EGEDHN
Cc1cnc(OC2CCN([C@H](C)Cc3cccc(C#N)c3)CC2)nc1	ZINC001171232151	1384475652	/nfs/dbraw/zinc/47/56/52/1384475652.db2.gz	PVTJMAHGWZBLIV-MRXNPFEDSA-N	0	3	336.439	3.131	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)c1ccsn1	ZINC001171465212	1384530285	/nfs/dbraw/zinc/53/02/85/1384530285.db2.gz	UAZGHQOCBGVSBE-AWEZNQCLSA-N	0	3	342.468	3.093	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)CCC(F)F	ZINC001171821119	1384651019	/nfs/dbraw/zinc/65/10/19/1384651019.db2.gz	KOGMXEVMRZCFCP-AWEZNQCLSA-N	0	3	337.414	3.368	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1cccc2cn[nH]c21	ZINC001316877976	1384662527	/nfs/dbraw/zinc/66/25/27/1384662527.db2.gz	LFQDHKMDTCCTKF-BBRMVZONSA-N	0	3	346.862	3.288	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1cccc2c[nH]nc21	ZINC001316877976	1384662530	/nfs/dbraw/zinc/66/25/30/1384662530.db2.gz	LFQDHKMDTCCTKF-BBRMVZONSA-N	0	3	346.862	3.288	20	30		EGEDHN
CC[C@H](C)[C@H]([NH2+][C@@H](C)CCc1c(F)cc(Cl)cc1F)C(=O)N[O-]	ZINC001172569035	1384813490	/nfs/dbraw/zinc/81/34/90/1384813490.db2.gz	CMLFBXDKJIVWAS-YHAQOWFVSA-N	0	3	348.821	3.449	20	30		EGEDHN
C[C@@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C#N)C1)c1cccnc1	ZINC001172969558	1384893180	/nfs/dbraw/zinc/89/31/80/1384893180.db2.gz	YPSHBGXAVKXQKC-BMFZPTHFSA-N	0	3	330.432	3.024	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H](N2CCC(C(F)F)CC2)C[C@H]1C#N	ZINC001172992473	1384896340	/nfs/dbraw/zinc/89/63/40/1384896340.db2.gz	YRSRIHWQYFREID-KGLIPLIRSA-N	0	3	343.418	3.255	20	30		EGEDHN
COc1ccc([N+](=O)[O-])c(C[C@H](C)NCC#Cc2ccccc2)c1F	ZINC001173191194	1384934319	/nfs/dbraw/zinc/93/43/19/1384934319.db2.gz	KDZFCIYYNYEZRX-AWEZNQCLSA-N	0	3	342.370	3.315	20	30		EGEDHN
C=CCOC1CCC(n2nc(C(F)(F)F)c3c2CCNC3)CC1	ZINC001173326813	1384959279	/nfs/dbraw/zinc/95/92/79/1384959279.db2.gz	RXIHCPYNAAMKFQ-UHFFFAOYSA-N	0	3	329.366	3.234	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@]1(F)CCN(C2CCC(C)(C#N)CC2)C1	ZINC001173601520	1384985798	/nfs/dbraw/zinc/98/57/98/1384985798.db2.gz	UXFNQJTYMLFIFD-IUPXNIOVSA-N	0	3	339.455	3.398	20	30		EGEDHN
C[C@H](CNC(=O)c1ccsc1Cl)NCc1ccc(C#N)s1	ZINC001317270650	1385041455	/nfs/dbraw/zinc/04/14/55/1385041455.db2.gz	JJWOJSXTLSDBGA-SECBINFHSA-N	0	3	339.873	3.243	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H](C)CCCCNCc1cc(C)no1	ZINC001174694653	1385135443	/nfs/dbraw/zinc/13/54/43/1385135443.db2.gz	UXVIHQIONZHJQV-MRXNPFEDSA-N	0	3	333.476	3.331	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H](C)CCCCNCc1cc2n(n1)CCC2	ZINC001174834043	1385157306	/nfs/dbraw/zinc/15/73/06/1385157306.db2.gz	VDKMWTMUQVJLFP-IRXDYDNUSA-N	0	3	346.519	3.196	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H](C)CCCCNCc1nccn1CC	ZINC001174849499	1385159762	/nfs/dbraw/zinc/15/97/62/1385159762.db2.gz	NQYUNWPAYDSYLW-IRXDYDNUSA-N	0	3	334.508	3.270	20	30		EGEDHN
C=CCCCC(=O)N[C@H](C)CCCCNCc1ncc(Cl)n1C	ZINC001174985888	1385179013	/nfs/dbraw/zinc/17/90/13/1385179013.db2.gz	BXHGZIUROCTJCV-CQSZACIVSA-N	0	3	340.899	3.194	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H](C)CCCCNCc2nccn2CC)CC1	ZINC001175074475	1385190194	/nfs/dbraw/zinc/19/01/94/1385190194.db2.gz	SJLZUJITXQUSIB-KRWDZBQOSA-N	0	3	346.519	3.414	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@H](C)CCCCNCc1cc(OC)no1	ZINC001175082687	1385192048	/nfs/dbraw/zinc/19/20/48/1385192048.db2.gz	RFFRQPDWRAZYDR-RDTXWAMCSA-N	0	3	337.464	3.050	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)CCCCNCc2cnc(C)o2)CCC1	ZINC001175096818	1385194096	/nfs/dbraw/zinc/19/40/96/1385194096.db2.gz	BUVQSWPZYFWXHS-HNNXBMFYSA-N	0	3	333.476	3.494	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H](CNC(=O)CCC3CCC3)C2)c1	ZINC001317524578	1385243240	/nfs/dbraw/zinc/24/32/40/1385243240.db2.gz	QKJKOUOTOXBGKM-IBGZPJMESA-N	0	3	325.456	3.077	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N[C@H](C)CCCCNCc1ccccc1C#N	ZINC001175351223	1385263019	/nfs/dbraw/zinc/26/30/19/1385263019.db2.gz	UTSKKWXEPYKFFM-GPMSIDNRSA-N	0	3	327.472	3.369	20	30		EGEDHN
CCN1CCN(c2ccc(Nc3cc(C#N)ccc3NC)cc2)CC1	ZINC001175781476	1385403454	/nfs/dbraw/zinc/40/34/54/1385403454.db2.gz	ISAKPIXQKFGBHO-UHFFFAOYSA-N	0	3	335.455	3.485	20	30		EGEDHN
C=C[C@H](C(=O)NCCCNCc1ccn(C(C)C)n1)c1ccccc1	ZINC001176785551	1385696485	/nfs/dbraw/zinc/69/64/85/1385696485.db2.gz	HZWYXPXNCJWCCL-IBGZPJMESA-N	0	3	340.471	3.030	20	30		EGEDHN
C=C(Br)CNCCCN(CC1CCCC1)C(=O)C1CC1	ZINC001177179137	1385847140	/nfs/dbraw/zinc/84/71/40/1385847140.db2.gz	ZNEBVIOKHDMVRR-UHFFFAOYSA-N	0	3	343.309	3.304	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)c1cccnc1	ZINC001177196145	1385855612	/nfs/dbraw/zinc/85/56/12/1385855612.db2.gz	SKOBRNVAUVORST-UHFFFAOYSA-N	0	3	335.879	3.446	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)C1(C)CCC(C)CC1	ZINC001177201742	1385861299	/nfs/dbraw/zinc/86/12/99/1385861299.db2.gz	ONOZLXCFHKWPGO-UHFFFAOYSA-N	0	3	331.298	3.207	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)COCC1CC1	ZINC001177225436	1385874099	/nfs/dbraw/zinc/87/40/99/1385874099.db2.gz	MMWFZYWCGNCVAX-UHFFFAOYSA-N	0	3	342.911	3.164	20	30		EGEDHN
CC(C)c1occc1C(=O)NCCCNCc1ccccc1C#N	ZINC001177234563	1385878602	/nfs/dbraw/zinc/87/86/02/1385878602.db2.gz	PQMVTSFCJYECOT-UHFFFAOYSA-N	0	3	325.412	3.184	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)Cc2cc3ccccc3[nH]2)CC1	ZINC001318996447	1385915900	/nfs/dbraw/zinc/91/59/00/1385915900.db2.gz	LWBIJLHWRJCONV-UHFFFAOYSA-N	0	3	340.471	3.350	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@H]1OCC[C@H]1C	ZINC001177423937	1385951272	/nfs/dbraw/zinc/95/12/72/1385951272.db2.gz	ZJTRVEFCPZATQY-PBHICJAKSA-N	0	3	342.911	3.162	20	30		EGEDHN
Cc1cccc(F)c1C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001177458735	1385963048	/nfs/dbraw/zinc/96/30/48/1385963048.db2.gz	FKGPCCAROPUYDS-UHFFFAOYSA-N	0	3	343.377	3.055	20	30		EGEDHN
CC[C@H](CNC(=O)CCc1cccs1)NCc1ccc(C#N)s1	ZINC001698624885	1406265552	/nfs/dbraw/zinc/26/55/52/1406265552.db2.gz	HZSMFIKYCIGHIE-CYBMUJFWSA-N	0	3	347.509	3.298	20	30		EGEDHN
N#Cc1ccc(F)c(CNCC2(NC(=O)CC3CCC3)CCCC2)c1	ZINC001698628770	1406271681	/nfs/dbraw/zinc/27/16/81/1406271681.db2.gz	YGBOIQDKXLQUMN-UHFFFAOYSA-N	0	3	343.446	3.406	20	30		EGEDHN
CC[C@H](C)C(=O)N1CC[C@H](NCC#Cc2ccccc2Cl)[C@@H]1C	ZINC001178140244	1386140073	/nfs/dbraw/zinc/14/00/73/1386140073.db2.gz	ZJMBTWIZZIEZKN-MPGHIAIKSA-N	0	3	332.875	3.317	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2cccc(Cl)c2)CCN1C(=O)[C@H]1CC1(C)C	ZINC001178481167	1386230019	/nfs/dbraw/zinc/23/00/19/1386230019.db2.gz	JMVRKYTWOCQMIU-QGTPRVQTSA-N	0	3	344.886	3.317	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2Cl)CCN1C(=O)[C@@H]1CC1(C)C	ZINC001178480992	1386230539	/nfs/dbraw/zinc/23/05/39/1386230539.db2.gz	HMUWVFCGMVZOPN-ZVZYQTTQSA-N	0	3	344.886	3.317	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](NCC#Cc2cccc(Cl)c2)[C@@H]1C	ZINC001178577107	1386254924	/nfs/dbraw/zinc/25/49/24/1386254924.db2.gz	OLACOCOAEOTDRM-LPHOPBHVSA-N	0	3	342.870	3.074	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1ccc(C(F)F)nc1)C(C)C	ZINC001319919139	1386390491	/nfs/dbraw/zinc/39/04/91/1386390491.db2.gz	SMYBWIZTOAFCHY-CYBMUJFWSA-N	0	3	331.794	3.116	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](NCc2c(C)nsc2C)[C@@H]1C	ZINC001179360046	1386462875	/nfs/dbraw/zinc/46/28/75/1386462875.db2.gz	LSJCVTWADUKYEY-YOEHRIQHSA-N	0	3	333.501	3.033	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1ccc2oc(C)nc2c1)C1CC1	ZINC001698648347	1406297181	/nfs/dbraw/zinc/29/71/81/1406297181.db2.gz	YNTYSPCMYJDNFU-GOSISDBHSA-N	0	3	347.846	3.377	20	30		EGEDHN
C=CCC1(C(=O)NCCCCCCNCc2cc(OC)no2)CCC1	ZINC001179492511	1386496987	/nfs/dbraw/zinc/49/69/87/1386496987.db2.gz	JHSFDBNZCOARPF-UHFFFAOYSA-N	0	3	349.475	3.196	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@H](NCC#Cc3ccccc3)[C@@H]2C)cs1	ZINC001179724784	1386564987	/nfs/dbraw/zinc/56/49/87/1386564987.db2.gz	AZHRYNOGVDBQIC-LPHOPBHVSA-N	0	3	338.476	3.301	20	30		EGEDHN
CC(C)C[C@H](C)C(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@@H]1C	ZINC001179794653	1386589227	/nfs/dbraw/zinc/58/92/27/1386589227.db2.gz	QLSITPMNHYISLW-ZWOKBUDYSA-N	0	3	344.474	3.438	20	30		EGEDHN
N#CCOc1ccc(NC2CCN(CCC(F)(F)F)CC2)cc1	ZINC001320820168	1386728321	/nfs/dbraw/zinc/72/83/21/1386728321.db2.gz	YMULOKJOVMPVAS-UHFFFAOYSA-N	0	3	327.350	3.418	20	30		EGEDHN
C[C@H](CC(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@@H]1C)C1CC1	ZINC001180230459	1386739330	/nfs/dbraw/zinc/73/93/30/1386739330.db2.gz	CTIZQERWSHOHFM-GUXCAODWSA-N	0	3	342.458	3.192	20	30		EGEDHN
COc1cc(CN2CCC[C@H]2CNc2cccc(C)n2)ccc1C#N	ZINC001321219332	1386845026	/nfs/dbraw/zinc/84/50/26/1386845026.db2.gz	CPFMMNGIINZKPX-SFHVURJKSA-N	0	3	336.439	3.347	20	30		EGEDHN
CCCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2cc(F)ccc2C#N)C1	ZINC001180625710	1386851235	/nfs/dbraw/zinc/85/12/35/1386851235.db2.gz	QKSHORQJNKMJEI-FOIQADDNSA-N	0	3	345.462	3.462	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](NCc2csc(Br)c2)C1	ZINC001181542943	1387013496	/nfs/dbraw/zinc/01/34/96/1387013496.db2.gz	IEZSFWSJPXDREW-GFCCVEGCSA-N	0	3	343.290	3.167	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](NCc2ccc(Cl)c(F)c2)C1	ZINC001182109057	1387106252	/nfs/dbraw/zinc/10/62/52/1387106252.db2.gz	ZAAKPVNMBREGTG-OAHLLOKOSA-N	0	3	336.838	3.363	20	30		EGEDHN
CCCC[C@@H](C)C(=O)N1CC[C@@H](NCc2ccc(OC)c(C#N)c2)C1	ZINC001182277751	1387136400	/nfs/dbraw/zinc/13/64/00/1387136400.db2.gz	KEHXTSQBSQBHQZ-CRAIPNDOSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@@H](C)[C@](C)(CNCc2cnc(C)o2)C1	ZINC001182313658	1387146139	/nfs/dbraw/zinc/14/61/39/1387146139.db2.gz	DZLJTLYBVJQANF-IDHHARJASA-N	0	3	333.476	3.160	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](NCc2cc(F)cc(F)c2)C1	ZINC001182841501	1387233751	/nfs/dbraw/zinc/23/37/51/1387233751.db2.gz	MICJWLXXWPEKMC-GOSISDBHSA-N	0	3	334.410	3.424	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1nccc2occc21	ZINC001329316195	1389059590	/nfs/dbraw/zinc/05/95/90/1389059590.db2.gz	BOSBVBDHNZOVIH-UHFFFAOYSA-N	0	3	335.835	3.268	20	30		EGEDHN
C=C(C)CCC(=O)NCCCCN1CCN(Cc2ccccc2)CC1	ZINC001337070186	1389248148	/nfs/dbraw/zinc/24/81/48/1389248148.db2.gz	KOSWCPMFVROJSH-UHFFFAOYSA-N	0	3	343.515	3.057	20	30		EGEDHN
C[C@H](N[C@H]1CCC[C@@H](C#N)C1)C(=O)Nc1cccc(N2CCCC2)c1	ZINC001331567092	1389805225	/nfs/dbraw/zinc/80/52/25/1389805225.db2.gz	UUZGWCUGJUUFBF-BBWFWOEESA-N	0	3	340.471	3.286	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N1CCC[C@](C)(CC)C1	ZINC001339486005	1390043616	/nfs/dbraw/zinc/04/36/16/1390043616.db2.gz	ZWQAIHJLBZHJNZ-LPHOPBHVSA-N	0	3	331.508	3.290	20	30		EGEDHN
C=CCn1c([C@@H](C)OC(C)(C)C)nnc1N1CCN(CC(C)C)CC1	ZINC001339775409	1390139612	/nfs/dbraw/zinc/13/96/12/1390139612.db2.gz	WECZXCORZDCPGQ-MRXNPFEDSA-N	0	3	349.523	3.118	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)Nc1cccc(-c2nncn2C)c1	ZINC001339839003	1390168093	/nfs/dbraw/zinc/16/80/93/1390168093.db2.gz	PMGSHBDQRIATFC-QGZVFWFLSA-N	0	3	343.475	3.499	20	30		EGEDHN
CC(N=Nc1ccc(C#N)cn1)c1ccc([O-])c(C[NH+]2CCCCC2)c1	ZINC001333215439	1390267674	/nfs/dbraw/zinc/26/76/74/1390267674.db2.gz	PFFHRFSDNAWHSK-UHFFFAOYSA-N	0	3	349.438	3.481	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)N(C)Cc1ncc(Cl)n1C	ZINC001340358688	1390276552	/nfs/dbraw/zinc/27/65/52/1390276552.db2.gz	ZXTDKRPTHSCRBK-CYBMUJFWSA-N	0	3	328.888	3.110	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N1CCc2ccc(C(F)(F)F)cc2C1	ZINC001340875857	1390391340	/nfs/dbraw/zinc/39/13/40/1390391340.db2.gz	JYWQBMKRPKKHQW-HNNXBMFYSA-N	0	3	326.362	3.274	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N[C@H](C)c1ccc(OCC(F)(F)F)cc1	ZINC001341497907	1390494562	/nfs/dbraw/zinc/49/45/62/1390494562.db2.gz	ZODIZVFNYCMSMW-IUODEOHRSA-N	0	3	344.377	3.489	20	30		EGEDHN
C=C(C)Cn1c(C(F)F)nnc1N1CCN(CCC(C)(C)C)CC1	ZINC001341964686	1390555338	/nfs/dbraw/zinc/55/53/38/1390555338.db2.gz	AQFONPFYKQFOSQ-UHFFFAOYSA-N	0	3	341.450	3.350	20	30		EGEDHN
C=CC1CCN(c2nnc([C@H]3CCCN(C)C3)n2CC(=C)C)CC1	ZINC001342246371	1390590672	/nfs/dbraw/zinc/59/06/72/1390590672.db2.gz	BQUVHXCMMVPKRC-KRWDZBQOSA-N	0	3	329.492	3.066	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)CCCC(=O)OC(C)(C)C)c1	ZINC001342617674	1390632995	/nfs/dbraw/zinc/63/29/95/1390632995.db2.gz	XRZCQCBAWSLFKE-HNNXBMFYSA-N	0	3	344.411	3.154	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN[C@@H]2CCOc3c(F)cccc32)c1	ZINC001335319074	1390671648	/nfs/dbraw/zinc/67/16/48/1390671648.db2.gz	KXTWIEFYPWGHLR-QGZVFWFLSA-N	0	3	339.370	3.139	20	30		EGEDHN
CC(C)c1c(C(=O)C(C#N)c2nccn2C)cnn1-c1ccccc1	ZINC001342924048	1390673404	/nfs/dbraw/zinc/67/34/04/1390673404.db2.gz	JDIHBFWMRYZCHE-OAHLLOKOSA-N	0	3	333.395	3.219	20	30		EGEDHN
N#CC(C(=O)CC[C@@H]1CCCCO1)c1nccn1Cc1ccccc1	ZINC001342924808	1390673748	/nfs/dbraw/zinc/67/37/48/1390673748.db2.gz	NZNMSBYYTANSHX-ZWKOTPCHSA-N	0	3	337.423	3.457	20	30		EGEDHN
C=C(C)Cn1c([C@H](C)CCC#N)nnc1N1C[C@@H](C)N(CC)C[C@H]1C	ZINC001342964435	1390678407	/nfs/dbraw/zinc/67/84/07/1390678407.db2.gz	SFFROBXYRVEREV-BRWVUGGUSA-N	0	3	344.507	3.180	20	30		EGEDHN
CC(C)N1CCC[C@H]1C(=O)C(C#N)c1nc2cc(F)ccc2s1	ZINC001343273381	1390703967	/nfs/dbraw/zinc/70/39/67/1390703967.db2.gz	HIRFRORVMYSUTB-OCCSQVGLSA-N	0	3	331.416	3.484	20	30		EGEDHN
Cc1ccc(C(=O)NCC(=O)C(C#N)c2nc(C(C)C)cs2)s1	ZINC001344007312	1390749637	/nfs/dbraw/zinc/74/96/37/1390749637.db2.gz	PBUWJTXYDRQIOX-LLVKDONJSA-N	0	3	347.465	3.243	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCC(=O)c1ccc(F)cc1F	ZINC001344875621	1390821013	/nfs/dbraw/zinc/82/10/13/1390821013.db2.gz	VVEPGEDDPZTOTG-CYBMUJFWSA-N	0	3	331.322	3.021	20	30		EGEDHN
CCc1c(C(=O)C(C#N)c2ncc(Cl)n2C)cnn1C(C)(C)C	ZINC001345643242	1390871342	/nfs/dbraw/zinc/87/13/42/1390871342.db2.gz	OIHMDQUXUPDNSB-SNVBAGLBSA-N	0	3	333.823	3.077	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCc1ccccc1Br	ZINC001346095603	1390907121	/nfs/dbraw/zinc/90/71/21/1390907121.db2.gz	HIFRRSNAJXHEPS-CYBMUJFWSA-N	0	3	346.228	3.475	20	30		EGEDHN
Cc1coc(C)c1C(=O)N(C)[C@H](C)CNCc1ccc(C#N)s1	ZINC001698822313	1406514116	/nfs/dbraw/zinc/51/41/16/1406514116.db2.gz	KYPAZZRXKYFXAD-GFCCVEGCSA-N	0	3	331.441	3.080	20	30		EGEDHN
CN1CCCC[C@H]1CNC(=O)c1ccccc1-c1ccccc1C#N	ZINC001353894914	1392106527	/nfs/dbraw/zinc/10/65/27/1392106527.db2.gz	RLZLMFCWTSRANZ-KRWDZBQOSA-N	0	3	333.435	3.439	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)Nc1nnc([C@H]2CCCO2)s1	ZINC001354536586	1392151211	/nfs/dbraw/zinc/15/12/11/1392151211.db2.gz	OMTSNRSAYJTLAE-CHWSQXEVSA-N	0	3	340.493	3.406	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@]2(C)CCc3ccccc3C2)C1	ZINC001479347191	1392221313	/nfs/dbraw/zinc/22/13/13/1392221313.db2.gz	LHMFRPOJFZTSLH-MOXGXCLJSA-N	0	3	346.902	3.419	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@@H](CC)CC(F)(F)F)C1	ZINC001479408389	1392237141	/nfs/dbraw/zinc/23/71/41/1392237141.db2.gz	KSUNMLQYOXMOEE-SRVKXCTJSA-N	0	3	326.790	3.202	20	30		EGEDHN
CCC(C)(C)CC(=O)N1CC[C@H](NCc2ccc(OC)c(C#N)c2)C1	ZINC001480110666	1392589535	/nfs/dbraw/zinc/58/95/35/1392589535.db2.gz	MBPLOCSQSKJIKD-KRWDZBQOSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1cc(-c2ccccc2)on1	ZINC001480777826	1392927346	/nfs/dbraw/zinc/92/73/46/1392927346.db2.gz	GFPADJQAYPLYFL-ZDUSSCGKSA-N	0	3	333.819	3.192	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)CCOc2cc(C)ccc2C)C1	ZINC001490948806	1394382585	/nfs/dbraw/zinc/38/25/85/1394382585.db2.gz	QHVCVLXUNWSCBV-WKILWMFISA-N	0	3	336.863	3.062	20	30		EGEDHN
CC[C@@H](CNC(=O)C1=CCCCCC1)NCc1ccc(C#N)s1	ZINC001481804443	1394538224	/nfs/dbraw/zinc/53/82/24/1394538224.db2.gz	JLOZVDDBPWQWAW-HNNXBMFYSA-N	0	3	331.485	3.495	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2scnc2C)CCCC[C@@H]1C	ZINC001481955726	1394617068	/nfs/dbraw/zinc/61/70/68/1394617068.db2.gz	UXOGYVOWRNEXSL-MEDUHNTESA-N	0	3	341.908	3.472	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H](F)Cc2ccccc2)CCCC1	ZINC001482238425	1394834193	/nfs/dbraw/zinc/83/41/93/1394834193.db2.gz	QZJMYIWCZKDLDQ-INIZCTEOSA-N	0	3	338.854	3.338	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)Cc1ccc(C)c(OC)c1)C(C)C	ZINC001698966962	1406726706	/nfs/dbraw/zinc/72/67/06/1406726706.db2.gz	ZZGHUOIMDXDCJM-MRXNPFEDSA-N	0	3	338.879	3.029	20	30		EGEDHN
C[C@@H](C(=O)N(C)CCN(C)Cc1ccc(OCC#N)cc1)C(C)(C)C	ZINC001698991424	1406781388	/nfs/dbraw/zinc/78/13/88/1406781388.db2.gz	WFROWUVPARNFCL-INIZCTEOSA-N	0	3	345.487	3.161	20	30		EGEDHN
Cc1cc(C)cc(C(=O)NC[C@H](C)N(C)Cc2cccc(C#N)c2)c1	ZINC001485377615	1395857633	/nfs/dbraw/zinc/85/76/33/1395857633.db2.gz	LAAGSYBFWKANLJ-KRWDZBQOSA-N	0	3	335.451	3.425	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccc2c(c1)CCC2)N(C)Cc1ccc(C#N)cc1	ZINC001485384865	1395871758	/nfs/dbraw/zinc/87/17/58/1395871758.db2.gz	WSXWZUQWDVMGHU-INIZCTEOSA-N	0	3	347.462	3.297	20	30		EGEDHN
CCC(C)(C)C(=O)N[C@@H]1CC[C@@H](CNCc2ccccc2C#N)C1	ZINC001486210216	1396183135	/nfs/dbraw/zinc/18/31/35/1396183135.db2.gz	IWGKLHBPZUQQHN-CRAIPNDOSA-N	0	3	327.472	3.369	20	30		EGEDHN
CCN(CCNC(=O)c1cc(F)ccc1F)Cc1ccc(C#N)cc1	ZINC001492965163	1396330113	/nfs/dbraw/zinc/33/01/13/1396330113.db2.gz	ICOGARUGSIUKAU-UHFFFAOYSA-N	0	3	343.377	3.088	20	30		EGEDHN
CCN(CCNC(=O)[C@@H]1CCCCC1(F)F)Cc1ccc(C#N)cc1	ZINC001492992685	1396330863	/nfs/dbraw/zinc/33/08/63/1396330863.db2.gz	JQEXVGYJCWQWOZ-KRWDZBQOSA-N	0	3	349.425	3.322	20	30		EGEDHN
CC(C)CCC(=O)N1CC[C@@H](NCc2ccccc2C#N)[C@H](C)C1	ZINC001496329507	1396652435	/nfs/dbraw/zinc/65/24/35/1396652435.db2.gz	JBHCNWMQYDGNNA-VQIMIIECSA-N	0	3	327.472	3.321	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)NC(=O)CCCc1cccs1	ZINC001497977690	1396901053	/nfs/dbraw/zinc/90/10/53/1396901053.db2.gz	VUEYLCRIPZUBRU-CYBMUJFWSA-N	0	3	347.509	3.298	20	30		EGEDHN
Cc1ccc(F)cc1C(=O)N[C@@H](C)CN(C)Cc1cccc(C#N)c1	ZINC001498347609	1396971117	/nfs/dbraw/zinc/97/11/17/1396971117.db2.gz	KSFMQVIYSQRRKC-HNNXBMFYSA-N	0	3	339.414	3.256	20	30		EGEDHN
Cc1ccc(F)cc1C(=O)N[C@H](C)CN(C)Cc1cccc(C#N)c1	ZINC001498347610	1396971142	/nfs/dbraw/zinc/97/11/42/1396971142.db2.gz	KSFMQVIYSQRRKC-OAHLLOKOSA-N	0	3	339.414	3.256	20	30		EGEDHN
CCC1(C(=O)N[C@H](C)[C@H]2CCCN(Cc3cccc(C#N)c3)C2)CC1	ZINC001690501232	1404613838	/nfs/dbraw/zinc/61/38/38/1404613838.db2.gz	IGARRYKXGNNAJA-APWZRJJASA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@@H](CNC(=O)c1sccc1Cl)NCc1ccc(C#N)s1	ZINC001690577839	1404637987	/nfs/dbraw/zinc/63/79/87/1404637987.db2.gz	VHHVQDRSAKHMSJ-VIFPVBQESA-N	0	3	339.873	3.243	20	30		EGEDHN
CC(C)CC1(C(=O)NC[C@@H](C)NCc2ccc(C#N)s2)CCC1	ZINC001690599828	1404646207	/nfs/dbraw/zinc/64/62/07/1404646207.db2.gz	INWFQKMKINQOMT-CQSZACIVSA-N	0	3	333.501	3.430	20	30		EGEDHN
CCCC1(C(=O)N2CC[C@@H](CNCc3ccccc3C#N)C2)CCC1	ZINC001690730003	1404699843	/nfs/dbraw/zinc/69/98/43/1404699843.db2.gz	HWKFADORPORKGC-KRWDZBQOSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1ccccc1-n1cccc1	ZINC001690861193	1404782661	/nfs/dbraw/zinc/78/26/61/1404782661.db2.gz	UWBUTLHKYFDSEI-OAHLLOKOSA-N	0	3	331.847	3.328	20	30		EGEDHN
CCN(CCNC(=O)c1cc(C)sc1C)Cc1cccc(C#N)c1	ZINC001691029991	1404939814	/nfs/dbraw/zinc/93/98/14/1404939814.db2.gz	ZSQTYRHHKAUBFI-UHFFFAOYSA-N	0	3	341.480	3.489	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@@]2(C)C[C@@H]2c2ccccc2)C1	ZINC001691817981	1405531970	/nfs/dbraw/zinc/53/19/70/1405531970.db2.gz	OGWRWWFVKACGFH-MYZZLAAOSA-N	0	3	332.875	3.417	20	30		EGEDHN
CCN(CCNC(=O)[C@H]1CCC(C)(C)C1)Cc1cccc(C#N)c1	ZINC001731811785	1427994853	/nfs/dbraw/zinc/99/48/53/1427994853.db2.gz	SQLDMZFJPLGHOL-SFHVURJKSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C[C@@H](C(=O)N[C@@H]1CCN(CC2CC(F)(F)C2)C1)c1ccccc1	ZINC001698553746	1406151557	/nfs/dbraw/zinc/15/15/57/1406151557.db2.gz	KCCYLHLEVRRWFS-IAGOWNOFSA-N	0	3	334.410	3.192	20	30		EGEDHN
C[C@@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)C1(C)CCCC1	ZINC001732431575	1428577924	/nfs/dbraw/zinc/57/79/24/1428577924.db2.gz	OGVGDANZKSWUPO-AWEZNQCLSA-N	0	3	331.435	3.214	20	30		EGEDHN
COc1ccc(C#N)cc1CNC[C@@H](C)NC(=O)CCC1CCCC1	ZINC001699352908	1412659816	/nfs/dbraw/zinc/65/98/16/1412659816.db2.gz	MICMNBNKVWSPNP-OAHLLOKOSA-N	0	3	343.471	3.132	20	30		EGEDHN
CC/C=C(/C)C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)c(F)c1	ZINC001699745688	1413156006	/nfs/dbraw/zinc/15/60/06/1413156006.db2.gz	HEJYBHRAXMSAPS-OTMHGDBASA-N	0	3	329.419	3.134	20	30		EGEDHN
CC[C@H](SC)C(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1	ZINC001699770408	1413176082	/nfs/dbraw/zinc/17/60/82/1413176082.db2.gz	PMZIDAGVYYZANM-KRWDZBQOSA-N	0	3	345.512	3.171	20	30		EGEDHN
CCCCC(=O)NC[C@@]1(C)CCCN(Cc2cccc(C#N)c2)C1	ZINC001699873157	1413324447	/nfs/dbraw/zinc/32/44/47/1413324447.db2.gz	ZOHQRAPCZUGDPR-HXUWFJFHSA-N	0	3	327.472	3.467	20	30		EGEDHN
N#Cc1ccc(CN2[C@@H]3CC[C@H]2C[C@@H](CNC(=O)CC2CC2)C3)s1	ZINC001699975279	1413415451	/nfs/dbraw/zinc/41/54/51/1413415451.db2.gz	NOUKAELWQIWRKE-MUJYYYPQSA-N	0	3	343.496	3.279	20	30		EGEDHN
CCC(CC)C(=O)NCC1(NCc2ccc(OC)c(C#N)c2)CCC1	ZINC001700127430	1413542517	/nfs/dbraw/zinc/54/25/17/1413542517.db2.gz	NUVLRGHFPBFJFJ-UHFFFAOYSA-N	0	3	343.471	3.132	20	30		EGEDHN
CC(C)[C@H](CNC(=O)CC1CCC1)NCc1ccc(C#N)cc1F	ZINC001732554445	1428741453	/nfs/dbraw/zinc/74/14/53/1428741453.db2.gz	UOKCDNWTXULFPU-SFHVURJKSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCCC[C@H]1CNCc1cccc(OC)n1	ZINC001700345578	1413832324	/nfs/dbraw/zinc/83/23/24/1413832324.db2.gz	ZUBUOQGJQLCQAE-WMZOPIPTSA-N	0	3	345.487	3.163	20	30		EGEDHN
C[C@H](CNC(=O)C1CCC2(CC2)CC1)N(C)Cc1ccc(C#N)cc1	ZINC001700465747	1414073486	/nfs/dbraw/zinc/07/34/86/1414073486.db2.gz	FVXGTBGHFZESIK-MRXNPFEDSA-N	0	3	339.483	3.465	20	30		EGEDHN
CN(C(=O)CC1(C)CC1)[C@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001700728292	1414389875	/nfs/dbraw/zinc/38/98/75/1414389875.db2.gz	VTWYXSBNVPIPKZ-GOSISDBHSA-N	0	3	343.446	3.214	20	30		EGEDHN
CN(C(=O)C1(C)CCC1)[C@@H](CNCc1cc(C#N)ccc1F)C1CC1	ZINC001700729947	1414392948	/nfs/dbraw/zinc/39/29/48/1414392948.db2.gz	YLOKYSANGDTMGC-SFHVURJKSA-N	0	3	343.446	3.214	20	30		EGEDHN
CC(C)(C(=O)N[C@@H]1CCC[C@H]1CNCc1ccccc1C#N)C(F)F	ZINC001732625150	1428888579	/nfs/dbraw/zinc/88/85/79/1428888579.db2.gz	OYIRQRAOFQOVHA-JKSUJKDBSA-N	0	3	349.425	3.224	20	30		EGEDHN
C[C@H](NC(=O)CC1(C)CC1)[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001713276367	1417897158	/nfs/dbraw/zinc/89/71/58/1417897158.db2.gz	UTJNVKBRBXWEDX-LPHOPBHVSA-N	0	3	339.483	3.465	20	30		EGEDHN
CCCN(CCNC(=O)[C@H](C)C1CCC1)Cc1cccc(C#N)c1	ZINC001713547188	1418319863	/nfs/dbraw/zinc/31/98/63/1418319863.db2.gz	NTTFOTSMMHGVLZ-MRXNPFEDSA-N	0	3	327.472	3.323	20	30		EGEDHN
C[C@@H](CC(=O)NCC1(NCc2ccc(C#N)s2)CCC1)C1CC1	ZINC001733727936	1429956439	/nfs/dbraw/zinc/95/64/39/1429956439.db2.gz	CNWONVWRJSTELI-ZDUSSCGKSA-N	0	3	331.485	3.184	20	30		EGEDHN
C[C@@H](CNC(=O)Cc1ccccc1Cl)NCc1ccc(C#N)s1	ZINC001714300764	1419080649	/nfs/dbraw/zinc/08/06/49/1419080649.db2.gz	VUUUBUMPUSIQJR-LBPRGKRZSA-N	0	3	347.871	3.110	20	30		EGEDHN
C[C@@H](CNCc1cc(Cl)sc1Cl)CNC(=O)[C@@H](C)C#N	ZINC001714377263	1419132374	/nfs/dbraw/zinc/13/23/74/1419132374.db2.gz	KSAUAYAHOWBYDH-IUCAKERBSA-N	0	3	334.272	3.056	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1cc(-c2cccs2)on1	ZINC001714481258	1419203925	/nfs/dbraw/zinc/20/39/25/1419203925.db2.gz	BPUGATJIEZTUIQ-LLVKDONJSA-N	0	3	339.848	3.254	20	30		EGEDHN
Cc1ccc(C(=O)NCC[C@H](C)NCc2ccccc2C#N)cc1C	ZINC001714498119	1419222542	/nfs/dbraw/zinc/22/25/42/1419222542.db2.gz	DCPNLTPVOHJNHB-KRWDZBQOSA-N	0	3	335.451	3.473	20	30		EGEDHN
Cc1ccc(C(=O)NCC[C@@H](C)NCc2ccccc2C#N)cc1C	ZINC001714498120	1419222571	/nfs/dbraw/zinc/22/25/71/1419222571.db2.gz	DCPNLTPVOHJNHB-QGZVFWFLSA-N	0	3	335.451	3.473	20	30		EGEDHN
C[C@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)CCC(C)(F)F	ZINC001715338111	1420041981	/nfs/dbraw/zinc/04/19/81/1420041981.db2.gz	KNCJBHDRCDDDBJ-GFCCVEGCSA-N	0	3	341.377	3.069	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cc2nc(C)ccc2o1)C(C)C	ZINC001715709714	1420305046	/nfs/dbraw/zinc/30/50/46/1420305046.db2.gz	CNDVJGOEYRZMDC-CQSZACIVSA-N	0	3	335.835	3.233	20	30		EGEDHN
C[C@@H](C(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1)C1CC1	ZINC001716794600	1420927536	/nfs/dbraw/zinc/92/75/36/1420927536.db2.gz	OPWKEDFQOXOAQP-OAHLLOKOSA-N	0	3	325.456	3.075	20	30		EGEDHN
Cc1nc(C)c(CN(CCNC(=O)[C@@H](C)C#N)C2CCCCCC2)o1	ZINC001723639046	1424503145	/nfs/dbraw/zinc/50/31/45/1424503145.db2.gz	DLBZYRAPYVXIIA-AWEZNQCLSA-N	0	3	346.475	3.092	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCC[C@H](C)NCc1cnc(Cl)s1	ZINC001725005515	1425419368	/nfs/dbraw/zinc/41/93/68/1425419368.db2.gz	KVRYJSGVOCHAPT-NSHDSACASA-N	0	3	329.897	3.383	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1ncoc1C1CC1	ZINC001731294983	1427237474	/nfs/dbraw/zinc/23/74/74/1427237474.db2.gz	STHNDIQUUZHXKT-OCCSQVGLSA-N	0	3	337.851	3.277	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(CCCOc3ccccc3C)C2)C1	ZINC001731374267	1427305626	/nfs/dbraw/zinc/30/56/26/1427305626.db2.gz	NSJIFUSSSAELBU-SFHVURJKSA-N	0	3	342.483	3.311	20	30		EGEDHN
Cc1cc(C(=O)NC[C@@H](C)NCc2ccc(C#N)s2)c(C)s1	ZINC001731604490	1427648821	/nfs/dbraw/zinc/64/88/21/1427648821.db2.gz	RWDWKUROTGULSE-SNVBAGLBSA-N	0	3	333.482	3.206	20	30		EGEDHN
Cc1ccc(C)c(C(=O)NC[C@H](C)NCc2ccc(C#N)s2)c1	ZINC001731633629	1427687844	/nfs/dbraw/zinc/68/78/44/1427687844.db2.gz	KXWGTAYIQAPUKF-AWEZNQCLSA-N	0	3	327.453	3.145	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)CC2(C)CC2)CCN1Cc1cccc(C#N)c1	ZINC001733902547	1437720542	/nfs/dbraw/zinc/72/05/42/1437720542.db2.gz	VKCIHKYEGHWYOE-MAUKXSAKSA-N	0	3	325.456	3.218	20	30		EGEDHN
C=C(Br)CNC1CCC(N(C)C(=O)C2(CC)CC2)CC1	ZINC001734012391	1437803908	/nfs/dbraw/zinc/80/39/08/1437803908.db2.gz	XOTNFOYGVDXANS-UHFFFAOYSA-N	0	3	343.309	3.444	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1ccc(F)c(F)c1	ZINC001734020384	1437809371	/nfs/dbraw/zinc/80/93/71/1437809371.db2.gz	NXSUOJWPEBJVEA-UHFFFAOYSA-N	0	3	330.806	3.405	20	30		EGEDHN
Cc1ccsc1C(=O)NC[C@@H](C)N(C)Cc1cccc(C#N)c1	ZINC001734025745	1437813404	/nfs/dbraw/zinc/81/34/04/1437813404.db2.gz	GEBOMBMLYNYYDC-CQSZACIVSA-N	0	3	327.453	3.179	20	30		EGEDHN
C[C@@H](CNC(=O)CCC1CCCC1)N(C)Cc1cccc(C#N)c1	ZINC001734026700	1437815118	/nfs/dbraw/zinc/81/51/18/1437815118.db2.gz	WHQIQXJYAABUBW-INIZCTEOSA-N	0	3	327.472	3.465	20	30		EGEDHN
Cc1cc(C(=O)N(C)C[C@@H](C)NCc2ccc(C#N)s2)c(C)o1	ZINC001734315413	1438044966	/nfs/dbraw/zinc/04/49/66/1438044966.db2.gz	UBCSGCJTIQDZLP-LLVKDONJSA-N	0	3	331.441	3.080	20	30		EGEDHN
Cc1ccc(CC(=O)N(C)C[C@H](C)NCc2ccc(C#N)s2)cc1	ZINC001734331946	1438055294	/nfs/dbraw/zinc/05/52/94/1438055294.db2.gz	OJAXKQTYACQVOI-HNNXBMFYSA-N	0	3	341.480	3.107	20	30		EGEDHN
CCC[C@@H](C)C(=O)NCCCN(CC)CC#Cc1ccc(F)cc1	ZINC001752170311	1440149708	/nfs/dbraw/zinc/14/97/08/1440149708.db2.gz	APEWCKVVKKQCBZ-QGZVFWFLSA-N	0	3	332.463	3.442	20	30		EGEDHN
CCN(CC#Cc1ccccc1)CCCNC(=O)c1occc1Cl	ZINC001752210158	1440154753	/nfs/dbraw/zinc/15/47/53/1440154753.db2.gz	KEDFNQMGVFUYEC-UHFFFAOYSA-N	0	3	344.842	3.427	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCCN(CC)Cc2cccc([N+](=O)[O-])c2)C1	ZINC001752210482	1440154852	/nfs/dbraw/zinc/15/48/52/1440154852.db2.gz	SRIKXFHZMGZKJG-UHFFFAOYSA-N	0	3	345.443	3.279	20	30		EGEDHN
CC#CCN(CCCNC(=O)c1ccccc1-n1cccc1)C1CC1	ZINC001752277149	1440163921	/nfs/dbraw/zinc/16/39/21/1440163921.db2.gz	GMDCGGSSWZNIFV-UHFFFAOYSA-N	0	3	335.451	3.085	20	30		EGEDHN
CC#CCN(CCCNC(=O)c1cc(C)n(CC2CC2)c1C)C1CC1	ZINC001752287433	1440165673	/nfs/dbraw/zinc/16/56/73/1440165673.db2.gz	QITWHNBZLDHUGW-UHFFFAOYSA-N	0	3	341.499	3.123	20	30		EGEDHN
CN(C(=O)CCC(F)F)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001752302483	1440168038	/nfs/dbraw/zinc/16/80/38/1440168038.db2.gz	GYQNCQBQZCJFIT-UHFFFAOYSA-N	0	3	335.398	3.026	20	30		EGEDHN
C=C(C)CN1CCC(N(CCC)C(=O)[C@@H]2C[C@H]2C2CCOCC2)CC1	ZINC001752439966	1440181043	/nfs/dbraw/zinc/18/10/43/1440181043.db2.gz	OPEDTMILQILLIL-VQTJNVASSA-N	0	3	348.531	3.328	20	30		EGEDHN
C#CCCN1CCC(N(CCC)C(=O)c2cc(F)ccc2OC)CC1	ZINC001752440090	1440181058	/nfs/dbraw/zinc/18/10/58/1440181058.db2.gz	RZGCEMPRRUPAHS-UHFFFAOYSA-N	0	3	346.446	3.174	20	30		EGEDHN
C=CCN1CCC(N(CCC)C(=O)c2cc(C(C)C)nn2C)CC1	ZINC001752441683	1440181317	/nfs/dbraw/zinc/18/13/17/1440181317.db2.gz	KCXYCFHREYVTAT-UHFFFAOYSA-N	0	3	332.492	3.046	20	30		EGEDHN
O=C(NC[C@@H](NCC#Cc1ccccc1)C1CC1)C1=CCCCCC1	ZINC001752460703	1440183706	/nfs/dbraw/zinc/18/37/06/1440183706.db2.gz	WAJAKDGLJJBQAG-OAQYLSRUSA-N	0	3	336.479	3.413	20	30		EGEDHN
CC1(C)CC[C@@H](C(=O)NC[C@@H](NCC#Cc2ccccc2)C2CC2)C1	ZINC001752483317	1440186033	/nfs/dbraw/zinc/18/60/33/1440186033.db2.gz	YBNNDIZZVBATFJ-WOJBJXKFSA-N	0	3	338.495	3.349	20	30		EGEDHN
C=CCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(OC)cc1C	ZINC001752542978	1440194689	/nfs/dbraw/zinc/19/46/89/1440194689.db2.gz	SKJBYWBMTVMUMC-CALCHBBNSA-N	0	3	328.456	3.259	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)c1cccc2c1OCC2	ZINC001752564430	1440195221	/nfs/dbraw/zinc/19/52/21/1440195221.db2.gz	COUSEHYKWRAZQJ-NXHRZFHOSA-N	0	3	340.467	3.265	20	30		EGEDHN
C=CCCCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)Cc1c[nH]cn1	ZINC001752567590	1440195610	/nfs/dbraw/zinc/19/56/10/1440195610.db2.gz	UFFSQMCNOOECSF-YTQUADARSA-N	0	3	344.503	3.010	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1C[C@H](NCc2cc(Cl)cc3c2OCC3)C1	ZINC001752650332	1440197931	/nfs/dbraw/zinc/19/79/31/1440197931.db2.gz	FGNXJIOAGPICJD-WKILWMFISA-N	0	3	348.874	3.224	20	30		EGEDHN
CCC[C@@H](CC)C(=O)N[C@H]1C[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001752672643	1440198911	/nfs/dbraw/zinc/19/89/11/1440198911.db2.gz	FUNSMOIUVQRMQG-BHIYHBOVSA-N	0	3	330.447	3.240	20	30		EGEDHN
O=C(N[C@H]1C[C@@H](NCC#Cc2ccc(F)cc2)C1)C1CCCCCC1	ZINC001752714844	1440203545	/nfs/dbraw/zinc/20/35/45/1440203545.db2.gz	QOMOWHNFBBBOOQ-BGYRXZFFSA-N	0	3	342.458	3.384	20	30		EGEDHN
C#CCN1CCC[C@H](CNC(=O)[C@@H](CC)Cc2cccc(C)c2)C1	ZINC001752787078	1440211997	/nfs/dbraw/zinc/21/19/97/1440211997.db2.gz	FZDNEMZELDXUAJ-UXHICEINSA-N	0	3	326.484	3.025	20	30		EGEDHN
C=CCC1(C(=O)N2CCC[C@@H](CNCc3oc(C)nc3C)C2)CCC1	ZINC001752806152	1440215761	/nfs/dbraw/zinc/21/57/61/1440215761.db2.gz	GBJXDMGGVVHQQO-KRWDZBQOSA-N	0	3	345.487	3.366	20	30		EGEDHN
CC(C)c1ccc(CN2CCCC[C@@H]2CNC(=O)[C@@H](C)C#N)cc1	ZINC001752816976	1440218314	/nfs/dbraw/zinc/21/83/14/1440218314.db2.gz	SSEKQTLAUWVBRP-QFBILLFUSA-N	0	3	327.472	3.440	20	30		EGEDHN
CCc1ccc(CN2CCCC[C@@H]2CNC(=O)C#CC(C)C)cc1	ZINC001752818727	1440219160	/nfs/dbraw/zinc/21/91/60/1440219160.db2.gz	IGTZLKONTVAZLC-HXUWFJFHSA-N	0	3	326.484	3.379	20	30		EGEDHN
Cc1ncccc1C(=O)N1CCCC[C@@H]1CNCC#Cc1ccccc1	ZINC001752829476	1440224953	/nfs/dbraw/zinc/22/49/53/1440224953.db2.gz	CJCOECBKFREJGA-HXUWFJFHSA-N	0	3	347.462	3.026	20	30		EGEDHN
CC(C)c1ccc(C(=O)NC[C@H](C)NCc2ccc(C#N)s2)cn1	ZINC001752879936	1440238614	/nfs/dbraw/zinc/23/86/14/1440238614.db2.gz	OPXCNRBGJHBHHJ-ZDUSSCGKSA-N	0	3	342.468	3.046	20	30		EGEDHN
C[C@H](CNC(=O)C[C@@H](C)c1ccco1)NCc1ccc(F)c(C#N)c1	ZINC001752912679	1440246011	/nfs/dbraw/zinc/24/60/11/1440246011.db2.gz	DSQUGQGXNNKZIK-ZIAGYGMSSA-N	0	3	343.402	3.078	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H](C)N[C@H](C)c2ccccc2F)CCOCC1	ZINC001752916196	1440247102	/nfs/dbraw/zinc/24/71/02/1440247102.db2.gz	KWZJEUNUFRXRER-HZPDHXFCSA-N	0	3	348.462	3.354	20	30		EGEDHN
CC#CCN(C)[C@H]1CCCN(C(=O)C[C@H]2CCCc3ccccc32)C1	ZINC001752996987	1440262458	/nfs/dbraw/zinc/26/24/58/1440262458.db2.gz	JZZITPZLIYLDME-UXHICEINSA-N	0	3	338.495	3.443	20	30		EGEDHN
CC#CCN(C)[C@H]1CCCN(C(=O)c2csc3c2CC[C@H](C)C3)C1	ZINC001753001147	1440264667	/nfs/dbraw/zinc/26/46/67/1440264667.db2.gz	XOBRVHVJHGZULU-HOTGVXAUSA-N	0	3	344.524	3.433	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCC[C@@H](C)NCc1cnc(Cl)s1	ZINC001753007354	1440266133	/nfs/dbraw/zinc/26/61/33/1440266133.db2.gz	KVRYJSGVOCHAPT-LLVKDONJSA-N	0	3	329.897	3.383	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1csc(C(C)(C)C)n1	ZINC001753015577	1440268349	/nfs/dbraw/zinc/26/83/49/1440268349.db2.gz	OWDKQCDLNAVPEZ-LLVKDONJSA-N	0	3	329.897	3.291	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)c1ccc(C)c(C)c1	ZINC001753018157	1440269087	/nfs/dbraw/zinc/26/90/87/1440269087.db2.gz	HCHXTHBSFFRNDJ-CQSZACIVSA-N	0	3	339.277	3.310	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)NCCC[C@H]1CCCN1Cc1ccccc1C#N	ZINC001753026553	1440271631	/nfs/dbraw/zinc/27/16/31/1440271631.db2.gz	QRNJGINIUZVXKD-RBUKOAKNSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCC[C@@H]2CCCN2Cc2ccns2)C1	ZINC001753033030	1440273306	/nfs/dbraw/zinc/27/33/06/1440273306.db2.gz	CLKMGXWSVHOZGW-OAHLLOKOSA-N	0	3	333.501	3.360	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@H]1CCN(Cc2sc(C)nc2C)C1	ZINC001753129279	1440316073	/nfs/dbraw/zinc/31/60/73/1440316073.db2.gz	NDCSVAIIHLMOEA-OAHLLOKOSA-N	0	3	335.517	3.300	20	30		EGEDHN
CCCN(CCNC(=O)C1(F)CCCC1)Cc1ccc(C#N)c(F)c1	ZINC001753145418	1440324100	/nfs/dbraw/zinc/32/41/00/1440324100.db2.gz	HGANEOQFQXQVRH-UHFFFAOYSA-N	0	3	349.425	3.308	20	30		EGEDHN
C=C[C@H](CC(=O)N(C)CCNCc1cncc(F)c1)c1ccccc1	ZINC001753272424	1440345560	/nfs/dbraw/zinc/34/55/60/1440345560.db2.gz	MRSJTOUZUNDJHF-QGZVFWFLSA-N	0	3	341.430	3.129	20	30		EGEDHN
C=CCN[C@@H](CNC(=O)[C@H](C)Oc1ccccc1F)c1ccccc1	ZINC001753298914	1440353268	/nfs/dbraw/zinc/35/32/68/1440353268.db2.gz	OZOWRAIDCVYHGD-YJBOKZPZSA-N	0	3	342.414	3.226	20	30		EGEDHN
CC(C)COCCN[C@H](CNC(=O)C#CC(C)(C)C)c1ccccc1	ZINC001753298496	1440353321	/nfs/dbraw/zinc/35/33/21/1440353321.db2.gz	IRMMPQDNDIFVIU-LJQANCHMSA-N	0	3	344.499	3.156	20	30		EGEDHN
C=C(C)CN[C@@H](CNC(=O)COc1ccccc1C)c1ccccc1	ZINC001753303497	1440354955	/nfs/dbraw/zinc/35/49/55/1440354955.db2.gz	ZVVAEYLUXWQTPH-IBGZPJMESA-N	0	3	338.451	3.397	20	30		EGEDHN
C=CC1(CC(=O)NC[C@@H](NC[C@H](C)O)c2ccccc2)CCCCC1	ZINC001753309030	1440356145	/nfs/dbraw/zinc/35/61/45/1440356145.db2.gz	AWBFZUUWMUHYPV-PKOBYXMFSA-N	0	3	344.499	3.341	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CCC)C(=O)c2cc(Cl)cn2CC)C1	ZINC001753322533	1440364494	/nfs/dbraw/zinc/36/44/94/1440364494.db2.gz	IDXUIBBPRAEYQQ-MRXNPFEDSA-N	0	3	335.879	3.111	20	30		EGEDHN
CC/C=C(/C)C(=O)NCC[C@@H]1CCN(Cc2ccccc2C#N)C1	ZINC001753322717	1440364708	/nfs/dbraw/zinc/36/47/08/1440364708.db2.gz	PPDFHRSORYITEZ-LTFKWQPMSA-N	0	3	325.456	3.243	20	30		EGEDHN
CCC[C@@H](C)C(=O)NCC[C@H]1CCN(CC#Cc2ccc(F)cc2)C1	ZINC001753325060	1440366160	/nfs/dbraw/zinc/36/61/60/1440366160.db2.gz	OUHLOOSKLROCCV-MJGOQNOKSA-N	0	3	344.474	3.442	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](N(Cc2ccccc2)C(=O)CC(C)(C)O)C1	ZINC001753362450	1440383466	/nfs/dbraw/zinc/38/34/66/1440383466.db2.gz	YIOYDKSHRMBXTH-LJQANCHMSA-N	0	3	344.499	3.217	20	30		EGEDHN
C=CCC1(C(=O)NCC2CN(CCc3ccc(OC)cc3)C2)CCC1	ZINC001753409068	1440392699	/nfs/dbraw/zinc/39/26/99/1440392699.db2.gz	JJXXTGDWFNUNGW-UHFFFAOYSA-N	0	3	342.483	3.032	20	30		EGEDHN
C=CCOCCN1CC[C@@H](N(C)C(=O)C[C@@H](C)c2cccc(F)c2)C1	ZINC001753444865	1440403296	/nfs/dbraw/zinc/40/32/96/1440403296.db2.gz	ZSDWUWWOXHXRAA-VQIMIIECSA-N	0	3	348.462	3.055	20	30		EGEDHN
C=C[C@@H](CC(=O)N(C)[C@H]1CCN(CCOC(C)C)C1)c1ccccc1	ZINC001753450863	1440405899	/nfs/dbraw/zinc/40/58/99/1440405899.db2.gz	XLEVFOIRAFLQBV-ICSRJNTNSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=CCOCCN1CC[C@H](N(CC)C(=O)c2csc(Cl)c2)C1	ZINC001753458744	1440409386	/nfs/dbraw/zinc/40/93/86/1440409386.db2.gz	JYJISLFJPXNDQB-AWEZNQCLSA-N	0	3	342.892	3.141	20	30		EGEDHN
CC[C@H](CNC(=O)c1sccc1C)NCc1ccc(C#N)s1	ZINC001753464896	1440412364	/nfs/dbraw/zinc/41/23/64/1440412364.db2.gz	UOVPYNKBUODFFD-GFCCVEGCSA-N	0	3	333.482	3.288	20	30		EGEDHN
CC[C@H](CNC(=O)c1cc[nH]c1C)NCC#Cc1cccc(Cl)c1	ZINC001753470147	1440413788	/nfs/dbraw/zinc/41/37/88/1440413788.db2.gz	NQGDJRWJGBOXBS-QGZVFWFLSA-N	0	3	343.858	3.126	20	30		EGEDHN
CC[C@@H](CNC(=O)CC(C)(C)CC)NCC#Cc1ccc(F)cc1	ZINC001753474911	1440414988	/nfs/dbraw/zinc/41/49/88/1440414988.db2.gz	GFSMXIHTYGMCSE-SFHVURJKSA-N	0	3	332.463	3.488	20	30		EGEDHN
C[C@H](C(=O)NC1(CNCC#Cc2ccccc2)CCCC1)n1cccc1	ZINC001753502487	1440423700	/nfs/dbraw/zinc/42/37/00/1440423700.db2.gz	QFGCBTVQGWANJF-LJQANCHMSA-N	0	3	349.478	3.119	20	30		EGEDHN
C#CCCCCC(=O)N[C@]1(CNCc2conc2C)CCCC[C@@H]1C	ZINC001753531950	1440431327	/nfs/dbraw/zinc/43/13/27/1440431327.db2.gz	PCKMECYORHCVGV-JXFKEZNVSA-N	0	3	345.487	3.331	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H](CCNCc2cc(C3CC3)no2)C1	ZINC001753547002	1440434430	/nfs/dbraw/zinc/43/44/30/1440434430.db2.gz	WICGXHGOSJCNLX-INIZCTEOSA-N	0	3	343.471	3.074	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCCN(C(=O)c2ncccc2CC)C1	ZINC001753549918	1440434789	/nfs/dbraw/zinc/43/47/89/1440434789.db2.gz	GVRBFONBXZSMIH-HNNXBMFYSA-N	0	3	335.879	3.228	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H](CCNCc2cnoc2C)C1	ZINC001753551172	1440435050	/nfs/dbraw/zinc/43/50/50/1440435050.db2.gz	GJYPLQNTUBDIPU-INIZCTEOSA-N	0	3	333.476	3.304	20	30		EGEDHN
C#Cc1ccc(C(=O)NCc2ccc(CNC/C=C/Cl)cc2)cc1	ZINC001753589969	1440442617	/nfs/dbraw/zinc/44/26/17/1440442617.db2.gz	UZWINBDKEXXMTH-KGVSQERTSA-N	0	3	338.838	3.440	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)CC1=CCCCC1	ZINC001753607939	1440448467	/nfs/dbraw/zinc/44/84/67/1440448467.db2.gz	XFXUJCFDOMKMIM-MRXNPFEDSA-N	0	3	325.456	3.291	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cccc3c2O[C@H](C)C3)CCCC1	ZINC001753667055	1440460645	/nfs/dbraw/zinc/46/06/45/1440460645.db2.gz	PYHVTYOMHOBNSR-CQSZACIVSA-N	0	3	348.874	3.395	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccc(F)cc1)N(C)C(=O)c1ccc(F)cc1	ZINC001753676563	1440463480	/nfs/dbraw/zinc/46/34/80/1440463480.db2.gz	DROHNJWEGJEAJY-HNNXBMFYSA-N	0	3	342.389	3.067	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)C[C@H](C=C)c1ccccc1)CC2	ZINC001753677758	1440463783	/nfs/dbraw/zinc/46/37/83/1440463783.db2.gz	WLZHQYOEMDFTNU-IBGZPJMESA-N	0	3	336.479	3.294	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)N(C)C(=O)C[C@@H]1C=CCCC1	ZINC001753698982	1440468063	/nfs/dbraw/zinc/46/80/63/1440468063.db2.gz	OECQULFHVPWSGT-LSDHHAIUSA-N	0	3	331.485	3.303	20	30		EGEDHN
C=CCC1(C(=O)N(C)[C@@H](C)CNCC#Cc2ccc(F)cc2)CCC1	ZINC001753710549	1440470454	/nfs/dbraw/zinc/47/04/54/1440470454.db2.gz	FBFWYKNGJVFULH-KRWDZBQOSA-N	0	3	342.458	3.360	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](CN[C@@H](C)c2n[nH]c(C)n2)CC(C)C)CC1	ZINC001753742359	1440479689	/nfs/dbraw/zinc/47/96/89/1440479689.db2.gz	QQRLJTMHDAUQKJ-YOEHRIQHSA-N	0	3	347.507	3.041	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H](C)[C@@H]1CNCc1c(C)nsc1C	ZINC001753818971	1440495135	/nfs/dbraw/zinc/49/51/35/1440495135.db2.gz	OEEODBGNDFHMFC-KSSFIOAISA-N	0	3	347.528	3.280	20	30		EGEDHN
Cc1cocc1C(=O)NC[C@H](NCc1cc(C#N)ccc1F)C(C)C	ZINC001753836061	1440501065	/nfs/dbraw/zinc/50/10/65/1440501065.db2.gz	XAQQUTCDEVZAEM-SFHVURJKSA-N	0	3	343.402	3.143	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)CCc1ccccc1)NCC#Cc1ccccc1	ZINC001753845413	1440504247	/nfs/dbraw/zinc/50/42/47/1440504247.db2.gz	ZMKCHQGYIRYNBP-JOCHJYFZSA-N	0	3	348.490	3.401	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1CCC[C@@H]1CNCc1ncc(C)s1	ZINC001753895377	1440522688	/nfs/dbraw/zinc/52/26/88/1440522688.db2.gz	MXDPLRUXVKQDQU-CABCVRRESA-N	0	3	335.517	3.428	20	30		EGEDHN
C[C@@H](CCNCc1cc(C#N)ccc1F)NC(=O)CCC1(C)CC1	ZINC001754009959	1440531134	/nfs/dbraw/zinc/53/11/34/1440531134.db2.gz	PLUJOKUHUGYEHX-AWEZNQCLSA-N	0	3	331.435	3.262	20	30		EGEDHN
C=C(Br)CNCC[C@H](C)NC(=O)c1ccc(F)cc1C	ZINC001754014696	1440531641	/nfs/dbraw/zinc/53/16/41/1440531641.db2.gz	JDIKRAHNJMEHEK-LBPRGKRZSA-N	0	3	343.240	3.141	20	30		EGEDHN
C=C(Br)CNCC[C@@H](C)NC(=O)c1ccc(F)cc1C	ZINC001754014695	1440531675	/nfs/dbraw/zinc/53/16/75/1440531675.db2.gz	JDIKRAHNJMEHEK-GFCCVEGCSA-N	0	3	343.240	3.141	20	30		EGEDHN
CCN(CCNCc1cccc(C#N)c1)C(=O)C[C@@H]1C=CCCC1	ZINC001754052352	1440535763	/nfs/dbraw/zinc/53/57/63/1440535763.db2.gz	ZFVPANCPDWAXMG-QGZVFWFLSA-N	0	3	325.456	3.243	20	30		EGEDHN
CCN(CCNCc1ccc(C#N)cc1)C(=O)c1cccc2c1CCC2	ZINC001754083480	1440539745	/nfs/dbraw/zinc/53/97/45/1440539745.db2.gz	IWSAAJBYIUCROY-UHFFFAOYSA-N	0	3	347.462	3.299	20	30		EGEDHN
N#Cc1cccc(CNC/C=C/CNC(=O)[C@H]2CCCC3(CC3)C2)c1	ZINC001754119256	1440542558	/nfs/dbraw/zinc/54/25/58/1440542558.db2.gz	JGWLPRFNWVIHOW-SNDJDQCESA-N	0	3	337.467	3.291	20	30		EGEDHN
C=C[C@@H](C(=O)NC/C=C\CNCc1cccc(C#N)c1)c1ccccc1	ZINC001754209118	1440550945	/nfs/dbraw/zinc/55/09/45/1440550945.db2.gz	DWKSCLGWVJZDQH-IZRJCCQOSA-N	0	3	345.446	3.290	20	30		EGEDHN
Cc1c(F)cccc1C(=O)N[C@H](C)CNCc1ccc(C#N)c(F)c1	ZINC001754225811	1440553231	/nfs/dbraw/zinc/55/32/31/1440553231.db2.gz	MPPPCSVPRIUZSC-GFCCVEGCSA-N	0	3	343.377	3.053	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)NC(=O)[C@@H]1C[C@H]1c1ccsc1	ZINC001754231083	1440554073	/nfs/dbraw/zinc/55/40/73/1440554073.db2.gz	AGXLMIOTOAAWSK-XFBWCDHKSA-N	0	3	345.493	3.079	20	30		EGEDHN
Cc1cscc1C(=O)N[C@@H](C)CNCC#Cc1ccc(Cl)cc1	ZINC001754261871	1440560016	/nfs/dbraw/zinc/56/00/16/1440560016.db2.gz	BOTJVSJIERYNKK-AWEZNQCLSA-N	0	3	346.883	3.470	20	30		EGEDHN
C=C[C@H](C(=O)N[C@@H](C)CNCc1ccnc(Cl)c1)c1ccccc1	ZINC001754294818	1440566206	/nfs/dbraw/zinc/56/62/06/1440566206.db2.gz	BJIIZLAIQBOOSM-YOEHRIQHSA-N	0	3	343.858	3.299	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(C2CC2)cc1)NC(=O)c1ccc(C#N)[nH]1	ZINC001754306248	1440571164	/nfs/dbraw/zinc/57/11/64/1440571164.db2.gz	WTFBNUOJCXDGSP-CQSZACIVSA-N	0	3	336.439	3.014	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CCCC[C@H]1CNCc1ccccc1C#N	ZINC001754339196	1440587811	/nfs/dbraw/zinc/58/78/11/1440587811.db2.gz	DNPRWLHWOYQWES-RBUKOAKNSA-N	0	3	325.456	3.289	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)c1c(F)cccc1F	ZINC001754343679	1440589212	/nfs/dbraw/zinc/58/92/12/1440589212.db2.gz	ZVHCHYOJOJDZRK-CYBMUJFWSA-N	0	3	343.377	3.087	20	30		EGEDHN
C=C(Br)CNCCCN(C)C(=O)[C@@H]1CCCC1(C)C	ZINC001754389880	1440594058	/nfs/dbraw/zinc/59/40/58/1440594058.db2.gz	ANYPUPWKJUPSSS-ZDUSSCGKSA-N	0	3	331.298	3.159	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)N(C)CCCNCc2ccc(C#N)cc2F)CC1	ZINC001754408212	1440595864	/nfs/dbraw/zinc/59/58/64/1440595864.db2.gz	AOFODLQXTSAUGN-JCNLHEQBSA-N	0	3	345.462	3.462	20	30		EGEDHN
CC/C=C(\C)C(=O)N[C@@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001754435174	1440597938	/nfs/dbraw/zinc/59/79/38/1440597938.db2.gz	XXYBTYPDLFXNFB-KKUWEBEJSA-N	0	3	329.419	3.038	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001754442945	1440599518	/nfs/dbraw/zinc/59/95/18/1440599518.db2.gz	NBFKLIWKESDYQL-GOSISDBHSA-N	0	3	343.446	3.284	20	30		EGEDHN
C=CCCCN1CC[C@@H]1CNC(=O)c1ocnc1-c1ccccc1	ZINC001754485568	1440608715	/nfs/dbraw/zinc/60/87/15/1440608715.db2.gz	XUKFVJZHKDELGR-MRXNPFEDSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=CCCCN1CC[C@H]1CNC(=O)c1ccc(-c2cnco2)cc1	ZINC001754487181	1440609080	/nfs/dbraw/zinc/60/90/80/1440609080.db2.gz	DLGSTOMNVJJZEI-KRWDZBQOSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=CCC[C@H](C)N1CC[C@@H]1CNC(=O)c1cnoc1-c1ccco1	ZINC001754487939	1440609220	/nfs/dbraw/zinc/60/92/20/1440609220.db2.gz	SXGFNJHNGIULAL-UONOGXRCSA-N	0	3	329.400	3.093	20	30		EGEDHN
C=CCCCCCN1CC[C@@H]1CNC(=O)[C@@H]1CCc2cccnc21	ZINC001754492174	1440610673	/nfs/dbraw/zinc/61/06/73/1440610673.db2.gz	XFQYBLPSNRXWPZ-QZTJIDSGSA-N	0	3	327.472	3.048	20	30		EGEDHN
C=CCCCCCN1CC[C@H]1CNC(=O)[C@@H]1OCCc2ccccc21	ZINC001754501933	1440614703	/nfs/dbraw/zinc/61/47/03/1440614703.db2.gz	NGQJLWCLXNONFA-AZUAARDMSA-N	0	3	342.483	3.237	20	30		EGEDHN
C=CCCCN1CC[C@H]1CNC(=O)[C@@]1(C)CCc2ccccc2C1	ZINC001754505030	1440616034	/nfs/dbraw/zinc/61/60/34/1440616034.db2.gz	PCIQBUGGMNFBGW-FPOVZHCZSA-N	0	3	326.484	3.338	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NCC1(N[C@H]2CCc3c2cccc3F)CC1	ZINC001754509242	1440617118	/nfs/dbraw/zinc/61/71/18/1440617118.db2.gz	CKFKELKXIBONLI-KDOFPFPSSA-N	0	3	346.446	3.033	20	30		EGEDHN
CC1=C(C)C[C@@H](C(=O)NCC2(NCc3ccc(C#N)cc3)CC2)CC1	ZINC001754515075	1440618323	/nfs/dbraw/zinc/61/83/23/1440618323.db2.gz	OCHQYRPBUFFSGX-IBGZPJMESA-N	0	3	337.467	3.433	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC1(NCc2ccc3c(c2)COC3)CC1	ZINC001754523749	1440620262	/nfs/dbraw/zinc/62/02/62/1440620262.db2.gz	HBNRUCWWBLLTNX-LJQANCHMSA-N	0	3	328.456	3.058	20	30		EGEDHN
C[C@H](C(=O)NCC1(NCc2ccc(C#N)cc2)CC1)c1ccccc1	ZINC001754531461	1440622664	/nfs/dbraw/zinc/62/26/64/1440622664.db2.gz	BIOYZDHFZFKPGS-INIZCTEOSA-N	0	3	333.435	3.100	20	30		EGEDHN
C=CCOCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1CC[C@H](C)CC1	ZINC001754543517	1440626679	/nfs/dbraw/zinc/62/66/79/1440626679.db2.gz	JLTWKDFQFUWACA-MKXGPGLRSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(Cl)CN(CC1CC1)C1CCN(C(=O)c2cncc(C)c2)CC1	ZINC001754548559	1440629004	/nfs/dbraw/zinc/62/90/04/1440629004.db2.gz	VZPUOEPRRJXSQV-UHFFFAOYSA-N	0	3	347.890	3.459	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)N1C[C@H]2CCC[C@@H](C1)N2CCCCCCC	ZINC001754551802	1440630109	/nfs/dbraw/zinc/63/01/09/1440630109.db2.gz	QHGWUXAPKHYAIX-NSHGMRRFSA-N	0	3	336.520	3.349	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@H]2CCC[C@@H](C1)N2CCC[C@H]1CCOC1	ZINC001754553068	1440630403	/nfs/dbraw/zinc/63/04/03/1440630403.db2.gz	STWAYKYTUOMYJZ-WCIQWLHISA-N	0	3	348.531	3.471	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@]2(C1)CCCN(Cc1ccccn1)C2	ZINC001754556423	1440631987	/nfs/dbraw/zinc/63/19/87/1440631987.db2.gz	ALUYCKHYFDMPBU-HXUWFJFHSA-N	0	3	327.472	3.252	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@@]2(CCN(Cc3cccnc3)C2)C1	ZINC001754565483	1440635269	/nfs/dbraw/zinc/63/52/69/1440635269.db2.gz	KKXQYTDHPQUQEC-YLJYHZDGSA-N	0	3	327.472	3.108	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](NCc2ccn(C(C)C)n2)C[C@H]1C	ZINC001754596376	1440641510	/nfs/dbraw/zinc/64/15/10/1440641510.db2.gz	VZQLVUZSOLORSO-SJORKVTESA-N	0	3	332.492	3.289	20	30		EGEDHN
Cc1nc(CN[C@@H]2CCN(C(=O)C#CC(C)(C)C)[C@@H](C)C2)sc1C	ZINC001754596816	1440641683	/nfs/dbraw/zinc/64/16/83/1440641683.db2.gz	ZJSULNVLKCVCRP-XJKSGUPXSA-N	0	3	347.528	3.279	20	30		EGEDHN
Cc1cscc1C(=O)N1CCC[C@H]1CNCC#Cc1ccccc1	ZINC001754608323	1440643456	/nfs/dbraw/zinc/64/34/56/1440643456.db2.gz	WHAFIYVFNHOWTH-SFHVURJKSA-N	0	3	338.476	3.302	20	30		EGEDHN
CC(F)(F)CCC(=O)N1CCC[C@H]1CNCc1ccc(C#N)s1	ZINC001754613260	1440644148	/nfs/dbraw/zinc/64/41/48/1440644148.db2.gz	BGUAEIDRCVMAOQ-LBPRGKRZSA-N	0	3	341.427	3.136	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)C[C@@H](C)c2cccc(F)c2)CC1	ZINC001754629013	1440647137	/nfs/dbraw/zinc/64/71/37/1440647137.db2.gz	OEOOMRASHDVXBY-MRXNPFEDSA-N	0	3	330.447	3.313	20	30		EGEDHN
C#CCN(C(C)=O)C1CCN(Cc2ccc(C(C)(C)C)cc2)CC1	ZINC001754633640	1440648429	/nfs/dbraw/zinc/64/84/29/1440648429.db2.gz	DSVQPCGNROXSIT-UHFFFAOYSA-N	0	3	326.484	3.430	20	30		EGEDHN
C#CCN(C(=O)c1ccccc1Cl)C1CCN(CC(=C)C)CC1	ZINC001754641817	1440649346	/nfs/dbraw/zinc/64/93/46/1440649346.db2.gz	AYAZJAGFHPPHKK-UHFFFAOYSA-N	0	3	330.859	3.456	20	30		EGEDHN
C#CCNC[C@H](NC(=O)[C@H](F)C(C)C)c1ccc2ccccc2c1	ZINC001754644158	1440649703	/nfs/dbraw/zinc/64/97/03/1440649703.db2.gz	PEWMMEBUYYHPBF-RBUKOAKNSA-N	0	3	326.415	3.214	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@@]1(C)CCN(Cc2ccc3cc[nH]c3c2)C1	ZINC001754669382	1440657507	/nfs/dbraw/zinc/65/75/07/1440657507.db2.gz	AVYUMSNJMKMZBO-NRFANRHFSA-N	0	3	337.467	3.298	20	30		EGEDHN
C#CCCCC(=O)N[C@@]1(C)CCN(CCOc2cccc(Cl)c2)C1	ZINC001754672329	1440658360	/nfs/dbraw/zinc/65/83/60/1440658360.db2.gz	GJCAXCYIPBTSTE-IBGZPJMESA-N	0	3	348.874	3.103	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@](C)(CNCc3ccn(C(C)C)n3)C2)C1	ZINC001754704765	1440668675	/nfs/dbraw/zinc/66/86/75/1440668675.db2.gz	OXCNKVIUPCJZGW-IBGZPJMESA-N	0	3	344.503	3.149	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@@](C)(CNCc2cc(F)ccc2C#N)C1	ZINC001754710811	1440670187	/nfs/dbraw/zinc/67/01/87/1440670187.db2.gz	NEGKWIYWWVFNQR-IBGZPJMESA-N	0	3	331.435	3.072	20	30		EGEDHN
C#CCN1CCC(C)(CNC(=O)CCc2cc(C)cc(C)c2)CC1	ZINC001754721171	1440673237	/nfs/dbraw/zinc/67/32/37/1440673237.db2.gz	CUXQEGUCKMZOBA-UHFFFAOYSA-N	0	3	326.484	3.088	20	30		EGEDHN
CC(C)(C)C#CC(=O)NC[C@]1(C)CCCN(CCOCC2CCC2)C1	ZINC001754726899	1440676709	/nfs/dbraw/zinc/67/67/09/1440676709.db2.gz	ITYRGJVSUNINFF-NRFANRHFSA-N	0	3	348.531	3.071	20	30		EGEDHN
C=CCN1CCC[C@](C)(CNC(=O)[C@H]2CCOc3c(F)cccc32)C1	ZINC001754735953	1440682436	/nfs/dbraw/zinc/68/24/36/1440682436.db2.gz	NYICERRYFDWPRE-OXJNMPFZSA-N	0	3	346.446	3.096	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@@H](CNC(=O)C(C)(C)C2CCCC2)C1	ZINC001754744047	1440684113	/nfs/dbraw/zinc/68/41/13/1440684113.db2.gz	VNZVJTVWSLUNIJ-INIZCTEOSA-N	0	3	340.458	3.300	20	30		EGEDHN
C=C1CCC(C(=O)N[C@]2(CO)CCCN(CC/C=C\CCC)C2)CC1	ZINC001754857723	1440700419	/nfs/dbraw/zinc/70/04/19/1440700419.db2.gz	NCBDQARIVFOTLQ-QEVIJRNUSA-N	0	3	348.531	3.422	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H]2[C@@H]1CCN2CCOc1cccc(F)c1	ZINC001754864532	1440702231	/nfs/dbraw/zinc/70/22/31/1440702231.db2.gz	XHDDYNWZAUHMRQ-MOPGFXCFSA-N	0	3	346.446	3.236	20	30		EGEDHN
Cc1cc(F)ccc1CN1CC[C@@H]2[C@@H]1CCCN2C(=O)C#CC(C)C	ZINC001754865398	1440702782	/nfs/dbraw/zinc/70/27/82/1440702782.db2.gz	LMKLAOTZGOPKFT-VQTJNVASSA-N	0	3	342.458	3.359	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCN(C(=O)c2ccc3nc(C)oc3c2)C1	ZINC001754919442	1440709051	/nfs/dbraw/zinc/70/90/51/1440709051.db2.gz	SEEUVCBCDRIMDG-AWEZNQCLSA-N	0	3	347.846	3.331	20	30		EGEDHN
COCC#CCN[C@H](C)c1ccc(CNC(=O)[C@@H](C)C(C)(C)C)cc1	ZINC001754947297	1440713668	/nfs/dbraw/zinc/71/36/68/1440713668.db2.gz	JEOGFPZPKDRCMD-IAGOWNOFSA-N	0	3	344.499	3.285	20	30		EGEDHN
COCC#CCN[C@H](C)c1ccc(CNC(=O)/C=C\C(C)(C)C)cc1	ZINC001754954376	1440715868	/nfs/dbraw/zinc/71/58/68/1440715868.db2.gz	RWCHKYRCYDZVAK-MUSGIIIZSA-N	0	3	342.483	3.206	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)s1)c1ccc(CNC(=O)C(F)F)cc1	ZINC001754955223	1440716203	/nfs/dbraw/zinc/71/62/03/1440716203.db2.gz	XYNXHHMCEVAHTC-LLVKDONJSA-N	0	3	349.406	3.352	20	30		EGEDHN
C[C@H](C#N)C(=O)NCC1(NCc2cc(Cl)cc(Cl)c2)CCC1	ZINC001754978875	1440720801	/nfs/dbraw/zinc/72/08/01/1440720801.db2.gz	VJPUCMYRSVOZAI-LLVKDONJSA-N	0	3	340.254	3.282	20	30		EGEDHN
C=C(C)CCN1CCN([C@@H]2CCN(C(=O)[C@H](C)C(CC)CC)C2)CC1	ZINC001755019979	1440726494	/nfs/dbraw/zinc/72/64/94/1440726494.db2.gz	VTBCDEZDHYGNRD-UYAOXDASSA-N	0	3	349.563	3.243	20	30		EGEDHN
CC[C@@H](C)CCCCC(=O)N[C@@H]1CCCN(CC#CCOC)CC1	ZINC001755024667	1440728139	/nfs/dbraw/zinc/72/81/39/1440728139.db2.gz	GBHTXDLFYNJBEC-RTBURBONSA-N	0	3	336.520	3.213	20	30		EGEDHN
CC#CCN(C)CCCN(C)C(=O)c1ccc(-c2ccco2)s1	ZINC001755043578	1440738823	/nfs/dbraw/zinc/73/88/23/1440738823.db2.gz	CASCGUVWILUNCU-UHFFFAOYSA-N	0	3	330.453	3.425	20	30		EGEDHN
COc1ccc(CN(C)CCCN(C)C(=O)[C@H](C)C(C)C)cc1C#N	ZINC001755045851	1440740922	/nfs/dbraw/zinc/74/09/22/1440740922.db2.gz	KVQNIEQWCXXOPU-MRXNPFEDSA-N	0	3	345.487	3.139	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)CCCOC(C)C)C1	ZINC001755047436	1440742103	/nfs/dbraw/zinc/74/21/03/1440742103.db2.gz	NTKUOOJNFRVOFB-PMACEKPBSA-N	0	3	348.531	3.308	20	30		EGEDHN
CCC1(NCc2nccs2)CCN(C(=O)C#CC(C)(C)C)CC1	ZINC001755068384	1440745840	/nfs/dbraw/zinc/74/58/40/1440745840.db2.gz	CFHBLZJIMVCGIC-UHFFFAOYSA-N	0	3	333.501	3.053	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)C3(C)CCOCC3)cc2C1	ZINC001755101499	1440752673	/nfs/dbraw/zinc/75/26/73/1440752673.db2.gz	KYPYCTPQEWZJDV-UHFFFAOYSA-N	0	3	342.483	3.401	20	30		EGEDHN
CC/C(C)=C/C(=O)N1C[C@H](C)[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001755108827	1440754016	/nfs/dbraw/zinc/75/40/16/1440754016.db2.gz	MDLSQDILJILWQG-WJQQLCIQSA-N	0	3	344.886	3.484	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@H](C)[C@H](NCc2cccc(C(C)C)n2)C1	ZINC001755120250	1440755434	/nfs/dbraw/zinc/75/54/34/1440755434.db2.gz	CWAWHDIQDDGFON-QFBILLFUSA-N	0	3	329.488	3.498	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CCN(Cc2ccc(C#N)cc2)[C@H](C)C1	ZINC001755161768	1440764909	/nfs/dbraw/zinc/76/49/09/1440764909.db2.gz	ZLHILROHXNYYIG-VQIMIIECSA-N	0	3	325.456	3.384	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)CC(C)(C)c2ccc(F)cc2)C[C@@H]1C	ZINC001755162437	1440765267	/nfs/dbraw/zinc/76/52/67/1440765267.db2.gz	VBYITEKJNPILQK-YJBOKZPZSA-N	0	3	330.447	3.096	20	30		EGEDHN
C=C(C)CN1CCN(CCCCCNC(=O)[C@@H]2CCCC23CC3)CC1	ZINC001755173246	1440770142	/nfs/dbraw/zinc/77/01/42/1440770142.db2.gz	NLDTUKZRSLAMET-IBGZPJMESA-N	0	3	347.547	3.047	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@H](C)CC(C)(C)C)CCO2	ZINC001755174371	1440770371	/nfs/dbraw/zinc/77/03/71/1440770371.db2.gz	OZOWKNNUCMOBIV-KRWDZBQOSA-N	0	3	336.520	3.328	20	30		EGEDHN
CS[C@@H](C)CC(=O)N1CCC[C@@H]1CN(C)Cc1cccc(C#N)c1	ZINC001755191963	1440775037	/nfs/dbraw/zinc/77/50/37/1440775037.db2.gz	WSWGJCOXKBXWEV-MAUKXSAKSA-N	0	3	345.512	3.123	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCN1C(=O)c1cccc(C(F)(F)F)c1	ZINC001755201365	1440780002	/nfs/dbraw/zinc/78/00/02/1440780002.db2.gz	QPCRWDSJLLKSNO-OAHLLOKOSA-N	0	3	326.362	3.428	20	30		EGEDHN
C=C(Br)CNCC1CC(NC(=O)[C@]2(C)CC=CCC2)C1	ZINC001755211132	1440783269	/nfs/dbraw/zinc/78/32/69/1440783269.db2.gz	IHWHMLXCXKZNNT-ZBCRRDGASA-N	0	3	341.293	3.126	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](C)[C@H](C)NCc2cccc(Cl)n2)CC1	ZINC001755253806	1440792771	/nfs/dbraw/zinc/79/27/71/1440792771.db2.gz	WPZGLZLMJMUSNJ-UONOGXRCSA-N	0	3	335.879	3.464	20	30		EGEDHN
C[C@@H](NCC#Cc1ccccc1)[C@H](C)NC(=O)C1(c2ccccc2)CC1	ZINC001755269015	1440797140	/nfs/dbraw/zinc/79/71/40/1440797140.db2.gz	UJKNFPAVVTVKRA-MOPGFXCFSA-N	0	3	346.474	3.253	20	30		EGEDHN
CCc1ccccc1C(=O)NC[C@H](C)N(C)Cc1ccc(C#N)cc1	ZINC001755315169	1440815202	/nfs/dbraw/zinc/81/52/02/1440815202.db2.gz	ZCAREZXJOJAWLP-INIZCTEOSA-N	0	3	335.451	3.371	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)CC[C@H](NCc2cc(C)n(C)n2)C(C)C)C1	ZINC001755351715	1440828071	/nfs/dbraw/zinc/82/80/71/1440828071.db2.gz	ZAWHJUZWEPVUEE-SFHVURJKSA-N	0	3	346.519	3.048	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)[C@H](OC)[C@@H](C)CC)CCCCC1	ZINC001755352579	1440828332	/nfs/dbraw/zinc/82/83/32/1440828332.db2.gz	GKFJVTMGUSGYEH-DZGCQCFKSA-N	0	3	330.900	3.209	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)Cc1cccc2ncccc12	ZINC001755365583	1440834033	/nfs/dbraw/zinc/83/40/33/1440834033.db2.gz	HGBKNNBJVPDXEZ-LJQANCHMSA-N	0	3	349.478	3.161	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H](C)C2CN(Cc3cccc(OC)c3C)C2)C1	ZINC001755387041	1440840869	/nfs/dbraw/zinc/84/08/69/1440840869.db2.gz	XUHIDLRGNIHMGI-INIZCTEOSA-N	0	3	342.483	3.296	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C[C@H](C)c2ccccc2C)C(C)(C)C1	ZINC001755411812	1440846585	/nfs/dbraw/zinc/84/65/85/1440846585.db2.gz	OMXLDMHGXQCZKW-HKUYNNGSSA-N	0	3	326.484	3.339	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)C[C@@H](C)c2ccccc2OC)C(C)(C)C1	ZINC001755415974	1440848822	/nfs/dbraw/zinc/84/88/22/1440848822.db2.gz	MYHCXNLIHIDZGM-CRAIPNDOSA-N	0	3	330.472	3.201	20	30		EGEDHN
CC[C@H](C)CCC(=O)NC[C@@H]1[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001755429137	1440850872	/nfs/dbraw/zinc/85/08/72/1440850872.db2.gz	BDFHBHHSOCRHCD-MVJPYGJCSA-N	0	3	339.483	3.179	20	30		EGEDHN
CC/C=C(/C)C(=O)N1CC2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001755454742	1440854842	/nfs/dbraw/zinc/85/48/42/1440854842.db2.gz	NREUEROOQOOQQO-ZWSORDCHSA-N	0	3	337.467	3.339	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H](CNCc3cnc(C)o3)C2)CCCC1	ZINC001755484224	1440860604	/nfs/dbraw/zinc/86/06/04/1440860604.db2.gz	MKFKFIXDGXJMKJ-WKILWMFISA-N	0	3	331.460	3.104	20	30		EGEDHN
C[C@@H](CCCNCc1ccccc1C#N)NC(=O)CCC(F)(F)F	ZINC001755491934	1440861563	/nfs/dbraw/zinc/86/15/63/1440861563.db2.gz	VGDICLGKHKBDJA-ZDUSSCGKSA-N	0	3	341.377	3.275	20	30		EGEDHN
CC#CCCCC(=O)N(C)[C@H](CNCc1cc(F)ccc1F)C1CC1	ZINC001755564945	1440875478	/nfs/dbraw/zinc/87/54/78/1440875478.db2.gz	OSOPFAAOEYMYPL-LJQANCHMSA-N	0	3	348.437	3.485	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@@H](CO)NCc1ccc2ccccc2c1	ZINC001755637551	1440890712	/nfs/dbraw/zinc/89/07/12/1440890712.db2.gz	BOVAHSBVNJHGME-PZJWPPBQSA-N	0	3	340.467	3.009	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](NCc2ncccc2C)[C@H]1C	ZINC001755654027	1440891655	/nfs/dbraw/zinc/89/16/55/1440891655.db2.gz	KHJPBSKPKBYCNR-AEFFLSMTSA-N	0	3	327.472	3.237	20	30		EGEDHN
CC#CCN[C@@H]1C[C@@H](C)N(C(=O)c2ccc(Cl)c3occc32)C1	ZINC001755691595	1440896780	/nfs/dbraw/zinc/89/67/80/1440896780.db2.gz	ZMYQZQRZKYWZAH-CHWSQXEVSA-N	0	3	330.815	3.302	20	30		EGEDHN
CC#CCN1CC[C@]2(NC(=O)C/C=C\c3ccc(F)cc3)CCC[C@@H]12	ZINC001755700010	1440899420	/nfs/dbraw/zinc/89/94/20/1440899420.db2.gz	BPUXJHKCGGKVSH-LFLMQBRGSA-N	0	3	340.442	3.366	20	30		EGEDHN
C=CCOCCN1CCC[C@H](NC(=O)c2coc3ccccc32)[C@@H]1C	ZINC001755723462	1440908390	/nfs/dbraw/zinc/90/83/90/1440908390.db2.gz	PLPVJUQHRVTIKF-YJBOKZPZSA-N	0	3	342.439	3.218	20	30		EGEDHN
C=CCOCCN1CCC[C@@H](NC(=O)c2coc3ccccc32)[C@@H]1C	ZINC001755723460	1440908479	/nfs/dbraw/zinc/90/84/79/1440908479.db2.gz	PLPVJUQHRVTIKF-MAUKXSAKSA-N	0	3	342.439	3.218	20	30		EGEDHN
C=CCN(C)CCN(C(=O)[C@H]1CCc2ccc(OC)cc21)C(C)C	ZINC001755813184	1440921856	/nfs/dbraw/zinc/92/18/56/1440921856.db2.gz	HZNYDMIGSURQJF-SFHVURJKSA-N	0	3	330.472	3.080	20	30		EGEDHN
C#CCCN(C)CCN(C(=O)[C@@H]1C[C@H]1c1cc(F)ccc1F)C(C)C	ZINC001755815457	1440923233	/nfs/dbraw/zinc/92/32/33/1440923233.db2.gz	LJDHNLOVYMYXIM-FUHWJXTLSA-N	0	3	348.437	3.260	20	30		EGEDHN
Cc1c[nH]cc1C(=O)N[C@@H](CNCc1ccc(C#N)s1)C(C)(C)C	ZINC001755837521	1440930773	/nfs/dbraw/zinc/93/07/73/1440930773.db2.gz	SEWWPDMNXQUZTF-INIZCTEOSA-N	0	3	344.484	3.191	20	30		EGEDHN
C#CCCCC(=O)N[C@H](C)C1CCN(Cc2ccccc2F)CC1	ZINC001755843193	1440932273	/nfs/dbraw/zinc/93/22/73/1440932273.db2.gz	XHJVLXFNCUAPGE-MRXNPFEDSA-N	0	3	330.447	3.346	20	30		EGEDHN
CC#CCN1CCC([C@@H](C)NC(=O)C/C=C\c2ccc(F)cc2)CC1	ZINC001755843391	1440932380	/nfs/dbraw/zinc/93/23/80/1440932380.db2.gz	GCWKKJHLDIQBTC-KEGWNNHHSA-N	0	3	342.458	3.469	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCC1=CCN(C[C@@H]2CCCCO2)CC1	ZINC001755888231	1440940864	/nfs/dbraw/zinc/94/08/64/1440940864.db2.gz	REUUYWPQWYHYIP-IBGZPJMESA-N	0	3	332.488	3.072	20	30		EGEDHN
Cc1ccc([C@H](CN[C@@H](C)c2ccc(C#N)cc2)N2CCOCC2)o1	ZINC000181423829	234181982	/nfs/dbraw/zinc/18/19/82/234181982.db2.gz	CEQGYJHRCOSARS-LPHOPBHVSA-N	0	3	339.439	3.184	20	30		EGEDHN
C[C@H](NCc1ccc(N2CCO[C@@H](C)C2)nc1)c1ccc(C#N)cc1	ZINC000181510413	234211798	/nfs/dbraw/zinc/21/17/98/234211798.db2.gz	OVPHWTCIPMEMNL-HOTGVXAUSA-N	0	3	336.439	3.029	20	30		EGEDHN
C[C@H](NC[C@@H](c1cccs1)N1CCOCC1)c1ccc(C#N)cc1	ZINC000072287935	299305928	/nfs/dbraw/zinc/30/59/28/299305928.db2.gz	QMGLUPVGKNJVMS-YJBOKZPZSA-N	0	3	341.480	3.344	20	30		EGEDHN
Cc1cccc([C@H](C)N[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)c1	ZINC000190616727	238630049	/nfs/dbraw/zinc/63/00/49/238630049.db2.gz	KNHHVTJHJCNLFZ-OXJNMPFZSA-N	0	3	333.435	3.318	20	30		EGEDHN
Cn1cc(CN[C@@H]2CCN(c3ccc(F)c(Cl)c3)C2)cc1C#N	ZINC000191568333	239192385	/nfs/dbraw/zinc/19/23/85/239192385.db2.gz	UTRKLAKRUQDSHS-CYBMUJFWSA-N	0	3	332.810	3.058	20	30		EGEDHN
C[C@@H]1C[C@H](c2ccccc2)CN1CC(=O)NCc1ccc(C#N)cc1	ZINC000265258524	247346849	/nfs/dbraw/zinc/34/68/49/247346849.db2.gz	XSJNGDVZLHLXNT-UZLBHIALSA-N	0	3	333.435	3.052	20	30		EGEDHN
C=CCN1CCC(Nc2ccc(C(=O)N3CCC(C)CC3)cn2)CC1	ZINC000266333387	248252128	/nfs/dbraw/zinc/25/21/28/248252128.db2.gz	HDTGNWLGXJSYBS-UHFFFAOYSA-N	0	3	342.487	3.016	20	30		EGEDHN
CN(CCN1CCO[C@H](c2cccc(C#N)c2)C1)Cc1ccccc1	ZINC000450645081	269687909	/nfs/dbraw/zinc/68/79/09/269687909.db2.gz	LHVPLQLAJXRMME-NRFANRHFSA-N	0	3	335.451	3.064	20	30		EGEDHN
CC(C)Oc1ccc(C#N)cc1NC(=O)N(C)C[C@@H]1CCCN(C)C1	ZINC000118810944	221188285	/nfs/dbraw/zinc/18/82/85/221188285.db2.gz	USABUJJESKQJJH-MRXNPFEDSA-N	0	3	344.459	3.151	20	30		EGEDHN
C[C@@H](N[C@@H]1CN(Cc2ccccc2)CC[C@@H]1CO)c1cccc(C#N)c1	ZINC000181784611	533528385	/nfs/dbraw/zinc/52/83/85/533528385.db2.gz	LJUZYHQDSZUATK-ZPMCFJSWSA-N	0	3	349.478	3.092	20	30		EGEDHN
C[C@@H](N[C@H]1CC(=O)N(c2c(F)cccc2F)C1)c1cccc(C#N)c1	ZINC000181916125	533539874	/nfs/dbraw/zinc/53/98/74/533539874.db2.gz	IIIDWVNGUJXGDI-DOMZBBRYSA-N	0	3	341.361	3.293	20	30		EGEDHN
C[C@@H](N[C@H]1CCCN(C(=O)Cc2ccccc2)C1)c1ccc(C#N)cc1	ZINC000338032458	141077264	/nfs/dbraw/zinc/07/72/64/141077264.db2.gz	VXOBJCFVJFZGNZ-UTKZUKDTSA-N	0	3	347.462	3.443	20	30		EGEDHN
CCCN(CCN1CCCCC1)C(=O)CSc1ccc(C#N)cc1	ZINC000342790374	141148145	/nfs/dbraw/zinc/14/81/45/141148145.db2.gz	AQHJVYCPOJBLLQ-UHFFFAOYSA-N	0	3	345.512	3.375	20	30		EGEDHN
CC(C)[C@]1(C)C[C@@H]1C(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000185732413	144118052	/nfs/dbraw/zinc/11/80/52/144118052.db2.gz	LNHFIZAVXQNZMP-QUCCMNQESA-N	0	3	327.472	3.131	20	30		EGEDHN
C[C@H]1CN(C(=O)c2cc(C#N)ccc2Cl)CCN(C2CCC2)C1	ZINC000344782634	144224045	/nfs/dbraw/zinc/22/40/45/144224045.db2.gz	YBUZHZGFPFRZNJ-CYBMUJFWSA-N	0	3	331.847	3.158	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@H](c3nc(C4CC4)n[nH]3)C2)c1F	ZINC000341136035	155182214	/nfs/dbraw/zinc/18/22/14/155182214.db2.gz	ZHMURWRNIJHVRA-OAHLLOKOSA-N	0	3	325.391	3.072	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@H](c3n[nH]c(C4CC4)n3)C2)c1F	ZINC000341136035	155182216	/nfs/dbraw/zinc/18/22/16/155182216.db2.gz	ZHMURWRNIJHVRA-OAHLLOKOSA-N	0	3	325.391	3.072	20	30		EGEDHN
N#Cc1ccnc(NC[C@@H](c2ccccc2)N2CCCC2)c1Cl	ZINC000341349817	155247522	/nfs/dbraw/zinc/24/75/22/155247522.db2.gz	BDXDVNNRDXTKJQ-INIZCTEOSA-N	0	3	326.831	3.278	20	30		EGEDHN
COCCN(CCC(=O)Nc1ccc(C#N)cc1)Cc1ccccc1	ZINC000121287786	152340050	/nfs/dbraw/zinc/34/00/50/152340050.db2.gz	XYFFMMZVBYOKPW-UHFFFAOYSA-N	0	3	337.423	3.035	20	30		EGEDHN
CCN1CCN(c2cccc(NCc3ccc(C#N)s3)c2)CC1	ZINC000191885423	153227810	/nfs/dbraw/zinc/22/78/10/153227810.db2.gz	AXEHIIYNLQNHDL-UHFFFAOYSA-N	0	3	326.469	3.374	20	30		EGEDHN
CCN1CCN(c2cccc(NCc3cc(C#N)cs3)c2)CC1	ZINC000191885240	153228079	/nfs/dbraw/zinc/22/80/79/153228079.db2.gz	CJJHEFPTHKSAIS-UHFFFAOYSA-N	0	3	326.469	3.374	20	30		EGEDHN
C[C@H](CNC(=O)N[C@@H](C)c1ccc(C#N)cc1)N1CCCC[C@@H]1C	ZINC000337383448	154322432	/nfs/dbraw/zinc/32/24/32/154322432.db2.gz	VYVRMHHCROVXQW-XHSDSOJGSA-N	0	3	328.460	3.181	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)NCC1(N(C)C)CCC1	ZINC000349000573	156313551	/nfs/dbraw/zinc/31/35/51/156313551.db2.gz	DNCSAWBESRJSLU-UHFFFAOYSA-N	0	3	327.453	3.296	20	30		EGEDHN
N#Cc1ccccc1COc1cccc(CN2CCC(CO)CC2)c1	ZINC000305738195	163080834	/nfs/dbraw/zinc/08/08/34/163080834.db2.gz	VYMBSJBSALUTJP-UHFFFAOYSA-N	0	3	336.435	3.342	20	30		EGEDHN
Cc1cc(CN2CC[C@](CO)(Cc3ccc(F)cc3)C2)ccc1C#N	ZINC000344131695	164110597	/nfs/dbraw/zinc/11/05/97/164110597.db2.gz	OFGIVBVTCRNHAA-NRFANRHFSA-N	0	3	338.426	3.433	20	30		EGEDHN
CCN(Cc1nnc(-c2cccc(C#N)c2)o1)[C@@H]1CCOC(C)(C)C1	ZINC000351919379	165150080	/nfs/dbraw/zinc/15/00/80/165150080.db2.gz	PGBBQQWDCYQHJK-MRXNPFEDSA-N	0	3	340.427	3.388	20	30		EGEDHN
CC[C@H](C)N[C@@H](CNC(=O)CCc1ccc(C#N)cc1)c1ccco1	ZINC000359540569	167186123	/nfs/dbraw/zinc/18/61/23/167186123.db2.gz	CJIYGCKWGWZZSW-YJBOKZPZSA-N	0	3	339.439	3.329	20	30		EGEDHN
C[C@@H](C(=O)N[C@H]1CCN(Cc2ccccc2)C1)c1cccc(C#N)c1	ZINC000359890890	167259639	/nfs/dbraw/zinc/25/96/39/167259639.db2.gz	XTJVLDOSJIVTMZ-UZLBHIALSA-N	0	3	333.435	3.052	20	30		EGEDHN
C[C@H](C(=O)N[C@@H]1CCN(C)[C@@H]1c1ccccc1)c1cccc(C#N)c1	ZINC000360393829	167319001	/nfs/dbraw/zinc/31/90/01/167319001.db2.gz	LEAGCQFXCRLMBT-CWFSZBLJSA-N	0	3	333.435	3.223	20	30		EGEDHN
COc1cccc([C@H](CNc2c(C#N)cccc2[N+](=O)[O-])N(C)C)c1	ZINC000425199169	269795357	/nfs/dbraw/zinc/79/53/57/269795357.db2.gz	HGYMCSQXKKSZIM-KRWDZBQOSA-N	0	3	340.383	3.190	20	30		EGEDHN
Cc1cc(NCCCCN2C[C@@H](C)O[C@H](C)C2)c(C#N)cc1[N+](=O)[O-]	ZINC000413180622	269916070	/nfs/dbraw/zinc/91/60/70/269916070.db2.gz	DKGHUGGBJDQNIJ-HUUCEWRRSA-N	0	3	346.431	3.076	20	30		EGEDHN
CSc1ccc(OC[C@@H](O)CN(C)Cc2ccc(C#N)cc2)cc1	ZINC000411129502	270046831	/nfs/dbraw/zinc/04/68/31/270046831.db2.gz	GOWHVOGNIISVFK-KRWDZBQOSA-N	0	3	342.464	3.152	20	30		EGEDHN
N#Cc1ccc(CN[C@@H](Cc2ccccc2)[C@@H](O)C(F)F)cc1F	ZINC000421368452	270048570	/nfs/dbraw/zinc/04/85/70/270048570.db2.gz	UZXKMUFDUWYMTM-DLBZAZTESA-N	0	3	334.341	3.024	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]([C@@H](CO)C2CC2)C2CC2)c(Br)c1	ZINC000451611657	270053350	/nfs/dbraw/zinc/05/33/50/270053350.db2.gz	LQERDHGXPGZBDD-DOTOQJQBSA-N	0	3	349.272	3.207	20	30		EGEDHN
Cc1cc(C#N)cc(NC(=O)NC[C@@H](Cc2ccccc2)N(C)C)c1	ZINC000455979046	270054029	/nfs/dbraw/zinc/05/40/29/270054029.db2.gz	DBQSKUIJNZLCEV-LJQANCHMSA-N	0	3	336.439	3.161	20	30		EGEDHN
Cc1ccc([C@H]2C[C@H](C)N(CC(=O)NCc3ccc(C#N)cc3)C2)cc1	ZINC000490067232	270056488	/nfs/dbraw/zinc/05/64/88/270056488.db2.gz	XIWAKODNURZHBW-UWJYYQICSA-N	0	3	347.462	3.361	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CN1CCC[C@@H](c2ccccc2)C1	ZINC000528513461	270059964	/nfs/dbraw/zinc/05/99/64/270059964.db2.gz	UCLRACDKOGSRIA-UXHICEINSA-N	0	3	336.435	3.178	20	30		EGEDHN
N#Cc1ccc(N2CC[C@H](N3CC[C@H](Cc4ccccc4)C3)C2=O)cc1	ZINC000533293197	270060692	/nfs/dbraw/zinc/06/06/92/270060692.db2.gz	BNRBJSKYEPYFDK-CTNGQTDRSA-N	0	3	345.446	3.228	20	30		EGEDHN
CCC[C@@H](C)NC(=O)[C@@H]1CCCN(Cc2ccc(C#N)c(OC)c2)C1	ZINC000282482374	266067571	/nfs/dbraw/zinc/06/75/71/266067571.db2.gz	WXLVCFOENVUGGF-CRAIPNDOSA-N	0	3	343.471	3.084	20	30		EGEDHN
CCN(CC(=O)Nc1ccc(C#N)c(Cl)c1)[C@H]1CCOC(C)(C)C1	ZINC000289965464	266106968	/nfs/dbraw/zinc/10/69/68/266106968.db2.gz	WTJPAFVFOWDWPK-HNNXBMFYSA-N	0	3	349.862	3.430	20	30		EGEDHN
CC(C)Oc1ccc([C@@H](O)CNCc2ccc(C#N)cc2F)cc1	ZINC000269446636	266295497	/nfs/dbraw/zinc/29/54/97/266295497.db2.gz	UYACORHCGLZPOM-IBGZPJMESA-N	0	3	328.387	3.308	20	30		EGEDHN
CCO[C@H]1C[C@H](NCC(=O)Nc2cc(Cl)ccc2C#N)C12CCC2	ZINC000296328571	266303561	/nfs/dbraw/zinc/30/35/61/266303561.db2.gz	QOXCDCXGBJZZLF-HOTGVXAUSA-N	0	3	347.846	3.087	20	30		EGEDHN
COc1cc(CNC[C@H](c2c(F)cccc2F)N(C)C)ccc1C#N	ZINC000281784087	266827300	/nfs/dbraw/zinc/82/73/00/266827300.db2.gz	UACKQFXZLZJXEG-QGZVFWFLSA-N	0	3	345.393	3.238	20	30		EGEDHN
COc1cc(CN[C@H](C)[C@@H]2OCCc3sccc32)ccc1C#N	ZINC000291751051	266830681	/nfs/dbraw/zinc/83/06/81/266830681.db2.gz	QGPOTJJIFCITAX-XIKOKIGWSA-N	0	3	328.437	3.420	20	30		EGEDHN
C[C@H](CN(C)Cc1ccccc1)Nc1c(C#N)nnc2ccccc21	ZINC000310887898	267155577	/nfs/dbraw/zinc/15/55/77/267155577.db2.gz	JVQCTNDSVFXKOZ-OAHLLOKOSA-N	0	3	331.423	3.434	20	30		EGEDHN
C[C@H](NC1CCN(Cc2ccc(C#N)cc2)CC1)c1nccs1	ZINC000181718406	267180244	/nfs/dbraw/zinc/18/02/44/267180244.db2.gz	NDTFOKXVLLDHRK-AWEZNQCLSA-N	0	3	326.469	3.330	20	30		EGEDHN
C[C@H](NCCC(=O)Nc1sccc1C#N)c1ccc2n[nH]cc2c1	ZINC000353261672	267182546	/nfs/dbraw/zinc/18/25/46/267182546.db2.gz	QEJXVYIHFSIJFX-NSHDSACASA-N	0	3	339.424	3.175	20	30		EGEDHN
CC[C@H](N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O)c1ccncc1	ZINC000453200736	267222932	/nfs/dbraw/zinc/22/29/32/267222932.db2.gz	VSNRGZNDVKIIOF-RBUKOAKNSA-N	0	3	334.423	3.190	20	30		EGEDHN
CC[C@H]1CCCCN1CCNC(=O)C(C)(C)c1cc(F)cc(C#N)c1	ZINC000512263955	267226336	/nfs/dbraw/zinc/22/63/36/267226336.db2.gz	XQDGLQMHSWFNLC-SFHVURJKSA-N	0	3	345.462	3.356	20	30		EGEDHN
CC[C@](CNCc1cc(C#N)cs1)(C(=O)OC)c1ccccc1	ZINC000414574812	267239965	/nfs/dbraw/zinc/23/99/65/267239965.db2.gz	AUHASSUPYPXVCF-GOSISDBHSA-N	0	3	328.437	3.230	20	30		EGEDHN
CN(C(=O)/C=C\c1cccc(C#N)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC000492106969	267270186	/nfs/dbraw/zinc/27/01/86/267270186.db2.gz	FBUGPVACVUXVOT-XPTLAUCJSA-N	0	3	345.446	3.304	20	30		EGEDHN
CN(C)[C@H](CNCc1ccc(C#N)c(F)c1)c1c(F)cccc1F	ZINC000421368939	267288842	/nfs/dbraw/zinc/28/88/42/267288842.db2.gz	VFUBKNSMXIOSOR-QGZVFWFLSA-N	0	3	333.357	3.368	20	30		EGEDHN
CN(CC(=O)NCc1ccc(C#N)cc1)[C@@H]1CCC[C@H]1C(C)(C)C	ZINC000419327226	267298268	/nfs/dbraw/zinc/29/82/68/267298268.db2.gz	NMSBQHQHDSEDDQ-QZTJIDSGSA-N	0	3	327.472	3.321	20	30		EGEDHN
CN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)c1ccc(C#N)s1	ZINC000487552979	267307217	/nfs/dbraw/zinc/30/72/17/267307217.db2.gz	QQJRVVQQRSQAFL-INIZCTEOSA-N	0	3	339.464	3.214	20	30		EGEDHN
COC(=O)N1CCC([C@@H](C)NCc2ccc(C#N)cc2Cl)CC1	ZINC000492572241	267376538	/nfs/dbraw/zinc/37/65/38/267376538.db2.gz	LDLHHNQWUSKWNA-GFCCVEGCSA-N	0	3	335.835	3.168	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)[C@@H](C)c2cccc(C#N)c2)N(C)C)cc1	ZINC000462000834	268046246	/nfs/dbraw/zinc/04/62/46/268046246.db2.gz	QRNSPYBAQLLGNP-JXFKEZNVSA-N	0	3	335.451	3.389	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CCS[C@@H]3CCCC[C@@H]32)cc1	ZINC000279915376	268089372	/nfs/dbraw/zinc/08/93/72/268089372.db2.gz	FDKLZOAQMIHDCB-FGTMMUONSA-N	0	3	339.464	3.127	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NC[C@@H]2CCCCC2(F)F)cc1	ZINC000295335584	268090709	/nfs/dbraw/zinc/09/07/09/268090709.db2.gz	FJXWMIFSVMIJKC-CVEARBPZSA-N	0	3	331.366	3.182	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCc2cccc3cccnc32)cc1	ZINC000348181283	268091493	/nfs/dbraw/zinc/09/14/93/268091493.db2.gz	NLNTUZOXDRFLQY-LJQANCHMSA-N	0	3	340.386	3.105	20	30		EGEDHN
N#Cc1ccc(S(=O)(=O)CCNCCCC2CCCCC2)cc1	ZINC000520686296	268250706	/nfs/dbraw/zinc/25/07/06/268250706.db2.gz	HLBIMZTZWWWEJK-UHFFFAOYSA-N	0	3	334.485	3.282	20	30		EGEDHN
N#Cc1cccc(NC(=O)C2CCN(Cc3ccsc3)CC2)c1	ZINC000271200481	268264981	/nfs/dbraw/zinc/26/49/81/268264981.db2.gz	WJOJZEPEWSLVOJ-UHFFFAOYSA-N	0	3	325.437	3.470	20	30		EGEDHN
N#Cc1cccc(OCCN[C@@H](c2cccs2)C2(CO)CCC2)c1	ZINC000452057861	268284755	/nfs/dbraw/zinc/28/47/55/268284755.db2.gz	HITHAUXKFQOHBZ-SFHVURJKSA-N	0	3	342.464	3.492	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CN[C@@H]1CCc2c1cccc2Cl	ZINC000530230714	268298494	/nfs/dbraw/zinc/29/84/94/268298494.db2.gz	IRTNQUWPFLSYPR-KBXCAEBGSA-N	0	3	342.826	3.228	20	30		EGEDHN
CN(C)[C@@]1(CNc2ccc(C#N)cc2C(F)(F)F)CCSC1	ZINC000361703336	273812532	/nfs/dbraw/zinc/81/25/32/273812532.db2.gz	YUWVOPHTOBKYLN-CQSZACIVSA-N	0	3	329.391	3.426	20	30		EGEDHN
Cc1nnc(SCCN(C)Cc2ccc(F)cc2)c(C#N)c1C	ZINC000185687074	275216047	/nfs/dbraw/zinc/21/60/47/275216047.db2.gz	SWQPEZVDQVHIIV-UHFFFAOYSA-N	0	3	330.432	3.328	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccc(C#N)c(F)c1	ZINC000353564339	278241421	/nfs/dbraw/zinc/24/14/21/278241421.db2.gz	VPDJNGPGCQKDJI-AWEZNQCLSA-N	0	3	340.402	3.339	20	30		EGEDHN
Cc1ccccc1[C@@H]([C@@H](C)NC(=O)c1ccc(C#N)s1)N(C)C	ZINC000357859133	281360635	/nfs/dbraw/zinc/36/06/35/281360635.db2.gz	HITSZPGJPWYOHB-CXAGYDPISA-N	0	3	327.453	3.349	20	30		EGEDHN
CN(C)CCN(Cc1ccc(F)cc1)Cc1ccc(C#N)cc1F	ZINC000349071795	289145800	/nfs/dbraw/zinc/14/58/00/289145800.db2.gz	HTWZBTNVLAZSRE-UHFFFAOYSA-N	0	3	329.394	3.400	20	30		EGEDHN
C[C@H](CCc1ccccc1)CN1CCN(c2ccc(C#N)cn2)CC1	ZINC000539409408	314312175	/nfs/dbraw/zinc/31/21/75/314312175.db2.gz	WMIVYXQYRRPAEP-GOSISDBHSA-N	0	3	334.467	3.344	20	30		EGEDHN
CC(C)n1cc([C@@H](C)NCCC(=O)Nc2cccc(C#N)c2)cn1	ZINC000541646166	314477145	/nfs/dbraw/zinc/47/71/45/314477145.db2.gz	YOBDSVXDHMIQPI-CQSZACIVSA-N	0	3	325.416	3.015	20	30		EGEDHN
COCCN(Cc1ccc(C#N)cc1)C[C@@H]1CCC2(CCCC2)O1	ZINC000549119944	315076230	/nfs/dbraw/zinc/07/62/30/315076230.db2.gz	VSZKWPKUIMPQHZ-IBGZPJMESA-N	0	3	328.456	3.498	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)NCCN1CC[C@@H](C)C1	ZINC000551276743	315147977	/nfs/dbraw/zinc/14/79/77/315147977.db2.gz	TULNUDPSFFQUKQ-GFCCVEGCSA-N	0	3	327.453	3.153	20	30		EGEDHN
C[C@@H]1OCC[C@@]1(O)CN(Cc1ccccc1)Cc1ccc(C#N)cc1	ZINC000565708614	316359802	/nfs/dbraw/zinc/35/98/02/316359802.db2.gz	LDTUUCFTVXBTNE-LAUBAEHRSA-N	0	3	336.435	3.100	20	30		EGEDHN
C[C@H](NCCNC(=O)c1ccccc1Cl)c1ccc(C#N)cc1	ZINC000173909565	323298633	/nfs/dbraw/zinc/29/86/33/323298633.db2.gz	XDDJYQOOQOPQED-ZDUSSCGKSA-N	0	3	327.815	3.292	20	30		EGEDHN
C[C@@H](NC1(CNCc2ccc(C#N)o2)CCOCC1)c1ccccc1	ZINC000174419242	323306498	/nfs/dbraw/zinc/30/64/98/323306498.db2.gz	NQMRLJBESMTMPF-MRXNPFEDSA-N	0	3	339.439	3.141	20	30		EGEDHN
C[C@H]1CN(Cc2cccc(CNCc3cc(C#N)cs3)c2)CCO1	ZINC000177690304	323344729	/nfs/dbraw/zinc/34/47/29/323344729.db2.gz	MLNNDRAZRBJWMH-HNNXBMFYSA-N	0	3	341.480	3.130	20	30		EGEDHN
Cc1oc(C#N)cc1-c1nc(-c2ccc(OCCN(C)C)cc2)no1	ZINC000349987942	324049279	/nfs/dbraw/zinc/04/92/79/324049279.db2.gz	DNEKUVDRCXRHLF-UHFFFAOYSA-N	0	3	338.367	3.117	20	30		EGEDHN
CCO[C@@H]1C[C@@H](N(C)Cc2cnc3c(C#N)cnn3c2)C1(CC)CC	ZINC000580952097	325313343	/nfs/dbraw/zinc/31/33/43/325313343.db2.gz	HKFIJXVMFUGYSE-IAGOWNOFSA-N	0	3	341.459	3.017	20	30		EGEDHN
COC[C@@]1(CN[C@@H]2CCc3ccc(C#N)cc32)OCCc2ccccc21	ZINC000581696489	325383001	/nfs/dbraw/zinc/38/30/01/325383001.db2.gz	MZPPMJRIZRILKK-FGZHOGPDSA-N	0	3	348.446	3.250	20	30		EGEDHN
C[S@](=O)C[C@@H](NCCCOc1cccc(C#N)c1)c1ccccc1	ZINC000183086346	455225151	/nfs/dbraw/zinc/22/51/51/455225151.db2.gz	RQQFFKHPJRIBPA-DVECYGJZSA-N	0	3	342.464	3.037	20	30		EGEDHN
CC(C)Oc1ccc(NC(=O)N2CC[C@@H]3CC[C@H](C2)N3C)cc1C#N	ZINC000157884777	455244631	/nfs/dbraw/zinc/24/46/31/455244631.db2.gz	TVKUZPOUHSMQBW-DLBZAZTESA-N	0	3	342.443	3.046	20	30		EGEDHN
COc1ccc(CN(CC(C)(C)O)C2CC2)cc1OCCCC#N	ZINC000189945924	455258660	/nfs/dbraw/zinc/25/86/60/455258660.db2.gz	JRQKGQHEZXWAEH-UHFFFAOYSA-N	0	3	332.444	3.113	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cccc3ccn(C)c32)CC1	ZINC000190021090	455273321	/nfs/dbraw/zinc/27/33/21/455273321.db2.gz	VNQGPANRPZPHIA-UHFFFAOYSA-N	0	3	326.444	3.340	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ncoc2-c2ccc(C)cc2)CC1	ZINC000173579280	455309092	/nfs/dbraw/zinc/30/90/92/455309092.db2.gz	BICMJTSGVYKGKT-UHFFFAOYSA-N	0	3	325.412	3.030	20	30		EGEDHN
C[C@@H]1CCC[C@](C#N)(NC(=O)c2ccc(CN3CCCC3)cc2)C1	ZINC000265383326	455316756	/nfs/dbraw/zinc/31/67/56/455316756.db2.gz	QXUHCVUWQDVVLG-UZLBHIALSA-N	0	3	325.456	3.485	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CNCc1cc2c(s1)CCCC2	ZINC000600715168	460576109	/nfs/dbraw/zinc/57/61/09/460576109.db2.gz	GCSRYYREWJDNQC-MRXNPFEDSA-N	0	3	342.464	3.028	20	30		EGEDHN
N#Cc1ccc(CCC(=O)NC2CCN(Cc3ccccc3)CC2)cc1	ZINC000010765833	453301756	/nfs/dbraw/zinc/30/17/56/453301756.db2.gz	XUEMBHBARODLGN-UHFFFAOYSA-N	0	3	347.462	3.272	20	30		EGEDHN
COCCC[N@H+](C)CCOc1ccc(-c2ccc(C#N)cc2[O-])cc1	ZINC000600777717	460599978	/nfs/dbraw/zinc/59/99/78/460599978.db2.gz	SDLRTGKDWYDEDC-UHFFFAOYSA-N	0	3	340.423	3.278	20	30		EGEDHN
COCCC[N@@H+](C)CCOc1ccc(-c2ccc(C#N)cc2[O-])cc1	ZINC000600777717	460599983	/nfs/dbraw/zinc/59/99/83/460599983.db2.gz	SDLRTGKDWYDEDC-UHFFFAOYSA-N	0	3	340.423	3.278	20	30		EGEDHN
C[C@]1(C#N)CCCN(C(=O)NC[C@@H](c2cccs2)N2CCCC2)C1	ZINC000612357392	460604670	/nfs/dbraw/zinc/60/46/70/460604670.db2.gz	AFKNXVXRGYHNAA-MAUKXSAKSA-N	0	3	346.500	3.220	20	30		EGEDHN
CSc1ccc([C@@H](C)NC[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000030534646	453836469	/nfs/dbraw/zinc/83/64/69/453836469.db2.gz	BLCCNPSERVJKTG-RHSMWYFYSA-N	0	3	342.464	3.371	20	30		EGEDHN
C[C@H](CNC(=O)c1ccccc1-c1ccccc1C#N)N1CCCC1	ZINC000052641453	453841277	/nfs/dbraw/zinc/84/12/77/453841277.db2.gz	KMMGHHYYJZLVNG-MRXNPFEDSA-N	0	3	333.435	3.439	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)Cc1cc(=O)n2cccc(C)c2n1	ZINC000052825674	453846524	/nfs/dbraw/zinc/84/65/24/453846524.db2.gz	ZSYJATDYDAOPQB-UHFFFAOYSA-N	0	3	346.434	3.287	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)[C@H](C)N(C)CCCCc1ccccc1	ZINC000053079773	453856608	/nfs/dbraw/zinc/85/66/08/453856608.db2.gz	BCUGBCSLRMLOKK-PXNSSMCTSA-N	0	3	329.488	3.384	20	30		EGEDHN
CN(C)Cc1cccc(C(=O)N(CCC#N)c2ccc(F)cc2)c1	ZINC000081366640	453866102	/nfs/dbraw/zinc/86/61/02/453866102.db2.gz	CHLMAOVWOVTMCW-UHFFFAOYSA-N	0	3	325.387	3.448	20	30		EGEDHN
N#Cc1ccccc1/C=C/C(=O)NCCCN1CCc2ccccc2C1	ZINC000032400640	453870048	/nfs/dbraw/zinc/87/00/48/453870048.db2.gz	AJUQFIUGSFXKGY-ZHACJKMWSA-N	0	3	345.446	3.136	20	30		EGEDHN
C=CCN(CCC(=O)Nc1cc(N)ccc1F)Cc1cccs1	ZINC000081645833	453900482	/nfs/dbraw/zinc/90/04/82/453900482.db2.gz	QUTDZESZSNYSKN-UHFFFAOYSA-N	0	3	333.432	3.486	20	30		EGEDHN
C[C@@H](O)CN(Cc1nnc(-c2cccc(C#N)c2)o1)C1CCCCC1	ZINC000075717259	453921493	/nfs/dbraw/zinc/92/14/93/453921493.db2.gz	PSICDHKVNXIUJN-CQSZACIVSA-N	0	3	340.427	3.124	20	30		EGEDHN
N#CCc1cccc(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)c1	ZINC000067361315	453925179	/nfs/dbraw/zinc/92/51/79/453925179.db2.gz	QRCRSZJGXKLAEY-FQEVSTJZSA-N	0	3	347.462	3.395	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@H](C)CN2CCC[C@H](C)C2)cc1OC	ZINC000055405156	453982295	/nfs/dbraw/zinc/98/22/95/453982295.db2.gz	XNJFBFGAONKYIH-JKSUJKDBSA-N	0	3	346.471	3.110	20	30		EGEDHN
N#Cc1cccc(CNC[C@H](O)COc2cccc3ccccc32)c1	ZINC000069160619	454084087	/nfs/dbraw/zinc/08/40/87/454084087.db2.gz	XYCIDTBLZHLYGM-IBGZPJMESA-N	0	3	332.403	3.241	20	30		EGEDHN
COc1ccc(CNC[C@H](O)C2CCCCC2)cc1OCCCC#N	ZINC000069170539	454084784	/nfs/dbraw/zinc/08/47/84/454084784.db2.gz	VWFSXMWCHZOIGP-SFHVURJKSA-N	0	3	346.471	3.409	20	30		EGEDHN
CN(C)[C@H](CNc1c(C#N)nnc2ccccc21)Cc1ccccc1	ZINC000077486091	454112413	/nfs/dbraw/zinc/11/24/13/454112413.db2.gz	OXFLFVGXSKUBDC-INIZCTEOSA-N	0	3	331.423	3.086	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)C2(C#N)CCCCC2)N(C)C)cc1	ZINC000057383302	454124350	/nfs/dbraw/zinc/12/43/50/454124350.db2.gz	WBYTVAZLIFXRDK-GOSISDBHSA-N	0	3	327.472	3.442	20	30		EGEDHN
C=CCOc1cccc(NC(=O)CC2(N3CCOCC3)CCCC2)c1	ZINC000119276385	454183041	/nfs/dbraw/zinc/18/30/41/454183041.db2.gz	PUHJHZLKSQCZHU-UHFFFAOYSA-N	0	3	344.455	3.225	20	30		EGEDHN
C[C@@H]1C[C@@H]1c1ccc(CN(CCC(=O)N(C)CCC#N)C2CC2)o1	ZINC000130904914	454224641	/nfs/dbraw/zinc/22/46/41/454224641.db2.gz	GWXWVXIIAHJRMR-PBHICJAKSA-N	0	3	329.444	3.130	20	30		EGEDHN
Cc1nnc(NCC(C)(C)N2CCc3ccccc3C2)c(C#N)c1C	ZINC000078331486	454232744	/nfs/dbraw/zinc/23/27/44/454232744.db2.gz	IUANFABGQGNXAF-UHFFFAOYSA-N	0	3	335.455	3.214	20	30		EGEDHN
COCCOc1ccc(CN[C@@H](C)c2ccc(C#N)cc2)cc1OC	ZINC000078447632	454254595	/nfs/dbraw/zinc/25/45/95/454254595.db2.gz	UJMRSTRTVHNNSN-HNNXBMFYSA-N	0	3	340.423	3.443	20	30		EGEDHN
CC(=O)Nc1cc(C(=O)C(C#N)c2nc3ccccc3[nH]2)ccc1F	ZINC000072032112	454267269	/nfs/dbraw/zinc/26/72/69/454267269.db2.gz	KCWPZUCDNAILKK-GFCCVEGCSA-N	0	3	336.326	3.150	20	30		EGEDHN
COc1ccc(CN(C)CCc2ccccn2)cc1OCCCC#N	ZINC000120785866	454347673	/nfs/dbraw/zinc/34/76/73/454347673.db2.gz	HDTJIWOHYAFXOS-UHFFFAOYSA-N	0	3	339.439	3.447	20	30		EGEDHN
C=CCn1c(SCCN2CCC(C)CC2)nnc1-c1cccnc1	ZINC000121010714	454377804	/nfs/dbraw/zinc/37/78/04/454377804.db2.gz	NUDGWINPRFIUAH-UHFFFAOYSA-N	0	3	343.500	3.350	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Cc2c[nH]c3c2cccc3C)CC1	ZINC000133060993	454389712	/nfs/dbraw/zinc/38/97/12/454389712.db2.gz	UXTYHRFLVKRGOB-UHFFFAOYSA-N	0	3	325.456	3.176	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)C[C@H](O)COc1ccc(C#N)cc1	ZINC000047739992	454404283	/nfs/dbraw/zinc/40/42/83/454404283.db2.gz	ABYNUBJMUGFQDK-FQEVSTJZSA-N	0	3	349.434	3.082	20	30		EGEDHN
COCCN(Cc1ccc(C#N)cc1)C[C@@H](O)c1ccccc1Cl	ZINC000063753821	454444232	/nfs/dbraw/zinc/44/42/32/454444232.db2.gz	XCRPGYSWGVBQSI-LJQANCHMSA-N	0	3	344.842	3.394	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN(C)Cc1ccc(C#N)cc1	ZINC000073649445	454463273	/nfs/dbraw/zinc/46/32/73/454463273.db2.gz	KFGPZUVAPLYHLA-FQEVSTJZSA-N	0	3	336.435	3.158	20	30		EGEDHN
C=CCNC(=O)Nc1ccc(NC(=O)[C@H](C)N2[C@H](C)CC[C@@H]2C)cc1	ZINC000101635360	454477899	/nfs/dbraw/zinc/47/78/99/454477899.db2.gz	WUGJMSCMQGNJHU-ZNMIVQPWSA-N	0	3	344.459	3.194	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)c2ccc(NC(=O)NC(C)C)cc2)n1	ZINC000048789583	454516090	/nfs/dbraw/zinc/51/60/90/454516090.db2.gz	KGJYKUINLIBDRV-CQSZACIVSA-N	0	3	342.424	3.472	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cccc(Br)c2C)CC1	ZINC000080079396	454529146	/nfs/dbraw/zinc/52/91/46/454529146.db2.gz	WTAJUPMCECZQSE-UHFFFAOYSA-N	0	3	337.261	3.138	20	30		EGEDHN
N#CC1CCN(CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1	ZINC000104679838	454594812	/nfs/dbraw/zinc/59/48/12/454594812.db2.gz	GWDZPTOHDVJYKJ-UHFFFAOYSA-N	0	3	326.356	3.028	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C(=O)c1ccc(CN2CCCC2)cc1	ZINC000074516393	454596468	/nfs/dbraw/zinc/59/64/68/454596468.db2.gz	HEDLHLURKQECDX-UHFFFAOYSA-N	0	3	333.435	3.426	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)c1cc(F)cc(F)c1	ZINC000065930808	454640791	/nfs/dbraw/zinc/64/07/91/454640791.db2.gz	JIEOCYXKPFBFOA-UHFFFAOYSA-N	0	3	343.377	3.040	20	30		EGEDHN
CCCNC(=O)[C@@H]1CCCN(Cc2ccccc2C(C)(C)C#N)C1	ZINC000135162080	454640880	/nfs/dbraw/zinc/64/08/80/454640880.db2.gz	JERIFAZTKPSYAX-QGZVFWFLSA-N	0	3	327.472	3.226	20	30		EGEDHN
CN(C)CCOc1ccc(NC(=O)[C@@H]2C[C@H]2c2cccc(C#N)c2)cc1	ZINC000080893693	454644403	/nfs/dbraw/zinc/64/44/03/454644403.db2.gz	HYBMGUKYGSYZSI-VQTJNVASSA-N	0	3	349.434	3.241	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCc2ccc(OCC)cc2)CC1	ZINC000106034240	454674884	/nfs/dbraw/zinc/67/48/84/454674884.db2.gz	KIHXZHSRLRVXLU-UHFFFAOYSA-N	0	3	330.472	3.175	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCSc2ccccc2F)CC1	ZINC000106038253	454676032	/nfs/dbraw/zinc/67/60/32/454676032.db2.gz	KMQBZOZYZGGJHT-UHFFFAOYSA-N	0	3	336.476	3.465	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(SC)ccc2[N+](=O)[O-])CC1	ZINC000106037990	454676137	/nfs/dbraw/zinc/67/61/37/454676137.db2.gz	MZWASRYVGSBMCJ-UHFFFAOYSA-N	0	3	349.456	3.087	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC1CCN(Cc2cccc(C)c2)CC1	ZINC000066316657	454683752	/nfs/dbraw/zinc/68/37/52/454683752.db2.gz	FEZHHGGWXVUVKD-KRWDZBQOSA-N	0	3	330.472	3.057	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(Cc2ccccc2)C2CC2)CC1	ZINC000106341137	454691711	/nfs/dbraw/zinc/69/17/11/454691711.db2.gz	ZVNWOHDSQRCSOC-UHFFFAOYSA-N	0	3	327.472	3.401	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@H](CC)Oc2ccccc2Cl)CC1	ZINC000176321756	454729056	/nfs/dbraw/zinc/72/90/56/454729056.db2.gz	MIICJMZWXVAEBF-INIZCTEOSA-N	0	3	336.863	3.264	20	30		EGEDHN
CCOc1ccc(NC(=O)CCN(C)Cc2cccc(C#N)c2)cc1	ZINC000136478002	454743756	/nfs/dbraw/zinc/74/37/56/454743756.db2.gz	QVKRJLREOTUUGX-UHFFFAOYSA-N	0	3	337.423	3.418	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CNC1(c2ccc(F)cc2)CCCC1	ZINC000107899469	454776589	/nfs/dbraw/zinc/77/65/89/454776589.db2.gz	YNQXFLZNALODSM-HNNXBMFYSA-N	0	3	331.435	3.193	20	30		EGEDHN
C[C@@H](NCc1ccc(N2CCCC2)nc1)c1ccc(OCC#N)cc1	ZINC000177116585	454825435	/nfs/dbraw/zinc/82/54/35/454825435.db2.gz	UNWITNQWGWLUBY-MRXNPFEDSA-N	0	3	336.439	3.435	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc3nc(C4CC4)oc3c2)CC1	ZINC000177176694	454833024	/nfs/dbraw/zinc/83/30/24/454833024.db2.gz	GRYIQOGOMFTAGO-UHFFFAOYSA-N	0	3	340.427	3.477	20	30		EGEDHN
C=C(C)CN(CC)[C@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000125951391	454858885	/nfs/dbraw/zinc/85/88/85/454858885.db2.gz	AOCMJICWUXDIAH-GOSISDBHSA-N	0	3	343.515	3.054	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)[C@H](CC)c2ccncc2)CC1	ZINC000125972191	454860399	/nfs/dbraw/zinc/86/03/99/454860399.db2.gz	PQMAKDHBEQITCY-GOSISDBHSA-N	0	3	330.476	3.215	20	30		EGEDHN
C[C@@H](NCC1(c2ccc(F)cc2)CCCCC1)C(=O)N(C)CCC#N	ZINC000112534793	454889410	/nfs/dbraw/zinc/88/94/10/454889410.db2.gz	BFNWQHHPGLMGAI-MRXNPFEDSA-N	0	3	345.462	3.378	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CCC(OC(C)(C)C)CC1	ZINC000164905596	454891288	/nfs/dbraw/zinc/89/12/88/454891288.db2.gz	PQJLIAYRENGXMR-GOSISDBHSA-N	0	3	347.499	3.434	20	30		EGEDHN
C#CCCCCNC(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000160710060	455489913	/nfs/dbraw/zinc/48/99/13/455489913.db2.gz	WXRMDRMCIAXHBQ-LJQANCHMSA-N	0	3	327.472	3.096	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC[C@H](C)c2cccc(C)c2)CC1	ZINC000154872118	454938458	/nfs/dbraw/zinc/93/84/58/454938458.db2.gz	NPNXRXDUSXTNOY-KRWDZBQOSA-N	0	3	329.488	3.438	20	30		EGEDHN
CC(C)CN(C(=O)c1ccc(C#N)c(Cl)c1)C1CCN(C)CC1	ZINC000127137593	454940755	/nfs/dbraw/zinc/94/07/55/454940755.db2.gz	IQPRSZYVJPRBQE-UHFFFAOYSA-N	0	3	333.863	3.404	20	30		EGEDHN
Cc1nc2c(s1)[C@H](N(C)C[C@H](O)c1ccc(C#N)cc1)CCC2	ZINC000127390572	454960413	/nfs/dbraw/zinc/96/04/13/454960413.db2.gz	KIRAONIPOIGCJA-SJORKVTESA-N	0	3	327.453	3.366	20	30		EGEDHN
CCO[C@H]1CCCN(Cc2cn(CCC#N)nc2-c2ccccc2)C1	ZINC000155485674	455007852	/nfs/dbraw/zinc/00/78/52/455007852.db2.gz	SFUQQCFZVJEDOF-IBGZPJMESA-N	0	3	338.455	3.465	20	30		EGEDHN
Cc1cccc(S(=O)(=O)CCCN[C@H](C)c2ccc(C#N)cc2)c1	ZINC000155796667	455046591	/nfs/dbraw/zinc/04/65/91/455046591.db2.gz	MIRGPIPIQHGHLO-MRXNPFEDSA-N	0	3	342.464	3.381	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN(C)[C@H](C)c1ccncc1	ZINC000179671688	455066065	/nfs/dbraw/zinc/06/60/65/455066065.db2.gz	HNSXEVCHGVCSIH-APWZRJJASA-N	0	3	326.440	3.243	20	30		EGEDHN
C[C@H]1CCC[C@](C#N)(NC(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000116798507	455068845	/nfs/dbraw/zinc/06/88/45/455068845.db2.gz	COSULTPVVSZWDY-JXFKEZNVSA-N	0	3	325.456	3.485	20	30		EGEDHN
C=CC[C@@H](C)NC(=O)Nc1ccc(CCN2CCSCC2)cc1	ZINC000117004365	455077264	/nfs/dbraw/zinc/07/72/64/455077264.db2.gz	RVPAJGJZSNUJKU-OAHLLOKOSA-N	0	3	333.501	3.364	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(OC3CCCC3)nc2)CC1	ZINC000171639906	455081928	/nfs/dbraw/zinc/08/19/28/455081928.db2.gz	VXLXJWFFZGVWCB-UHFFFAOYSA-N	0	3	344.459	3.175	20	30		EGEDHN
Cn1cc(CN2CCC[C@H](c3cc[nH]n3)C2)c(-c2ccc(C#N)cc2)n1	ZINC000179944419	455103296	/nfs/dbraw/zinc/10/32/96/455103296.db2.gz	RHQIFXJEBGPEPN-KRWDZBQOSA-N	0	3	346.438	3.061	20	30		EGEDHN
C=C(C)CN(C)C(=O)Nc1ccc(N2CCN(CC)CC2)cc1C	ZINC000180018390	455117000	/nfs/dbraw/zinc/11/70/00/455117000.db2.gz	ULZBJUHVJYJKHT-UHFFFAOYSA-N	0	3	330.476	3.177	20	30		EGEDHN
C=CCCOCCNCc1cc(Br)cc2c1OCC2	ZINC000156445291	455119412	/nfs/dbraw/zinc/11/94/12/455119412.db2.gz	QXJWTQSAKJFNLT-UHFFFAOYSA-N	0	3	326.234	3.066	20	30		EGEDHN
C=CCC[C@H](N[C@H]1CCN(CC(F)(F)F)C1=O)c1ccccc1	ZINC000180050470	455123064	/nfs/dbraw/zinc/12/30/64/455123064.db2.gz	YGEUWCJPMXQDDO-GJZGRUSLSA-N	0	3	326.362	3.447	20	30		EGEDHN
CCN(C[C@@H]1CCN(Cc2ccc(C#N)s2)C1)CC(F)(F)F	ZINC000180048224	455123109	/nfs/dbraw/zinc/12/31/09/455123109.db2.gz	LDMPXVZXCCMDNR-LBPRGKRZSA-N	0	3	331.407	3.326	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)Nc2cccc(C#N)c2)CN1Cc1ccccc1	ZINC000152595410	455140391	/nfs/dbraw/zinc/14/03/91/455140391.db2.gz	MMIGBXKMGNAEFF-HNAYVOBHSA-N	0	3	334.423	3.343	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@@H]2Cc2ccc(C)cc2)CC1	ZINC000172265114	455141135	/nfs/dbraw/zinc/14/11/35/455141135.db2.gz	JOOFXCANFNJISD-HXUWFJFHSA-N	0	3	341.499	3.362	20	30		EGEDHN
Fc1ccc(C#CCN2CCC(CCCN3CCOCC3)CC2)cc1	ZINC000182983061	455203912	/nfs/dbraw/zinc/20/39/12/455203912.db2.gz	KWSCYQRHLMRDGO-UHFFFAOYSA-N	0	3	344.474	3.002	20	30		EGEDHN
Cc1nc(C)c([C@H](C)N(C)C[C@H](O)COc2ccc(C#N)cc2)s1	ZINC000264398459	455205464	/nfs/dbraw/zinc/20/54/64/455205464.db2.gz	HBQYMNVDGDUWNS-BBRMVZONSA-N	0	3	345.468	3.064	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2NCc1ccc2c(c1)C(=O)NCC2	ZINC000612574242	460666374	/nfs/dbraw/zinc/66/63/74/460666374.db2.gz	UHFMTZCJKHBDAX-HXUWFJFHSA-N	0	3	331.419	3.011	20	30		EGEDHN
C[C@@](C#N)(NC(=O)CN[C@@H](CC1CCC1)c1ccccc1)C1CC1	ZINC000181348518	455321230	/nfs/dbraw/zinc/32/12/30/455321230.db2.gz	BIKBEBHWFQHZES-ICSRJNTNSA-N	0	3	325.456	3.316	20	30		EGEDHN
COc1ccc([C@@H](C)N[C@H]2CCN(Cc3ccc(C#N)cc3)C2=O)cc1	ZINC000190606104	455352426	/nfs/dbraw/zinc/35/24/26/455352426.db2.gz	PAHFNPOCGIXNCI-QRWLVFNGSA-N	0	3	349.434	3.019	20	30		EGEDHN
C[C@H](CN1CCC[C@@H](C)C1)NC(=O)N[C@H](CCC#N)c1ccccc1	ZINC000245912879	455397152	/nfs/dbraw/zinc/39/71/52/455397152.db2.gz	DUPRUFSMFQFBQG-ZHALLVOQSA-N	0	3	342.487	3.451	20	30		EGEDHN
CCCC[C@H](NCC(=O)N[C@](C)(C#N)C1CC1)c1ccc(OC)cc1	ZINC000182141091	455445455	/nfs/dbraw/zinc/44/54/55/455445455.db2.gz	VSFZHVKSLSWTKN-AZUAARDMSA-N	0	3	343.471	3.325	20	30		EGEDHN
CN(CCc1ccncc1)Cc1cn(C)nc1-c1ccc(C#N)cc1	ZINC000182395469	455505130	/nfs/dbraw/zinc/50/51/30/455505130.db2.gz	HAIUFYJDOJWINU-UHFFFAOYSA-N	0	3	331.423	3.028	20	30		EGEDHN
C#CCCOc1ccc(CN[C@@H](C)[C@@H](O)c2cccc(F)c2)cc1	ZINC000267147991	455507896	/nfs/dbraw/zinc/50/78/96/455507896.db2.gz	BLLVCCCEWHHINF-MGPUTAFESA-N	0	3	327.399	3.440	20	30		EGEDHN
COC(=O)COc1ccc([C@@H](C)NCc2ccc(F)c(C#N)c2)cc1	ZINC000185645921	455589411	/nfs/dbraw/zinc/58/94/11/455589411.db2.gz	WFQGYJICEGOEBK-CYBMUJFWSA-N	0	3	342.370	3.100	20	30		EGEDHN
CC#CCCN1CCC(c2noc(-c3ccccc3OC)n2)CC1	ZINC000192337947	455592667	/nfs/dbraw/zinc/59/26/67/455592667.db2.gz	RNMGWYHCQKILKW-UHFFFAOYSA-N	0	3	325.412	3.338	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CC[C@H](Oc2ccc(C#N)cn2)C1	ZINC000292215759	455598233	/nfs/dbraw/zinc/59/82/33/455598233.db2.gz	ORAVFFUFEKBTBL-SFHVURJKSA-N	0	3	346.434	3.408	20	30		EGEDHN
N#C[C@@H]1CCC[C@@H](NCc2ccc(C(=O)N3CCCCC3)cc2)C1	ZINC000185801375	455623863	/nfs/dbraw/zinc/62/38/63/455623863.db2.gz	XBUAKFBUDBHUHO-IEBWSBKVSA-N	0	3	325.456	3.485	20	30		EGEDHN
C[C@H]1CN(Cc2cccc(CN[C@@H]3CCC[C@H](C#N)C3)c2)CCO1	ZINC000185798052	455624275	/nfs/dbraw/zinc/62/42/75/455624275.db2.gz	PHJDQHIGWRDRNY-ABSDTBQOSA-N	0	3	327.472	3.079	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H](CCC)c2ccc(F)cc2F)CC1	ZINC000268229737	455625175	/nfs/dbraw/zinc/62/51/75/455625175.db2.gz	DTHPXVRRNUULPG-GOSISDBHSA-N	0	3	334.410	3.267	20	30		EGEDHN
C=CCN(C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1)C1CC1	ZINC000271487632	455656485	/nfs/dbraw/zinc/65/64/85/455656485.db2.gz	JJCXOPYQXHKNCR-FUHWJXTLSA-N	0	3	327.472	3.400	20	30		EGEDHN
C=CCN(C(=O)Nc1ccc(CCN2CCSCC2)cc1)C1CC1	ZINC000271592798	455695187	/nfs/dbraw/zinc/69/51/87/455695187.db2.gz	UCXYVBUMYYZCRN-UHFFFAOYSA-N	0	3	345.512	3.460	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCc3cccc(F)c3[C@H]2C)CC1	ZINC000606501386	460687114	/nfs/dbraw/zinc/68/71/14/460687114.db2.gz	ZSMGUNYACUSNKT-OAHLLOKOSA-N	0	3	345.462	3.495	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H]2C[C@H](c3ccc(F)cc3)C2)CC1	ZINC000292636226	455718324	/nfs/dbraw/zinc/71/83/24/455718324.db2.gz	JYWZQCXVWJVJQM-RUCARUNLSA-N	0	3	345.462	3.411	20	30		EGEDHN
C=CCCn1cc(CNCCc2c(C)[nH]c3ccc(F)cc32)nn1	ZINC000623717931	460688267	/nfs/dbraw/zinc/68/82/67/460688267.db2.gz	QHSUQBPMBFZXIC-UHFFFAOYSA-N	0	3	327.407	3.115	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1ccc(CC#N)cc1	ZINC000248929101	455739745	/nfs/dbraw/zinc/73/97/45/455739745.db2.gz	XOQOGTGHZGLISK-OXJNMPFZSA-N	0	3	348.450	3.395	20	30		EGEDHN
CN(CC(=O)NCC#Cc1cccc(C(F)(F)F)c1)C1CCCC1	ZINC000193335863	455753363	/nfs/dbraw/zinc/75/33/63/455753363.db2.gz	ZIYVKFOPRBWXRD-UHFFFAOYSA-N	0	3	338.373	3.048	20	30		EGEDHN
N#C[C@H]1CCC[C@@H](N[C@H]2CCCN(Cc3ccc(F)cc3F)C2=O)C1	ZINC000193343594	455754963	/nfs/dbraw/zinc/75/49/63/455754963.db2.gz	KPYVOGGMXRAVQD-XCRHUMRWSA-N	0	3	347.409	3.128	20	30		EGEDHN
C[C@@H](N[C@H]1CCN(Cc2ccccc2)C1=O)c1ccc(OCC#N)cc1	ZINC000271788634	455760519	/nfs/dbraw/zinc/76/05/19/455760519.db2.gz	IONPASOVYWLLSG-UZLBHIALSA-N	0	3	349.434	3.041	20	30		EGEDHN
C=C(C)Cn1c(C)nnc1N(C)C1CCN(Cc2ccccc2)CC1	ZINC000292962187	455768883	/nfs/dbraw/zinc/76/88/83/455768883.db2.gz	MBZHIWHFXNFQSA-UHFFFAOYSA-N	0	3	339.487	3.263	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc3[nH]c(C(C)(C)C)nc3c2)CC1	ZINC000194046830	455796057	/nfs/dbraw/zinc/79/60/57/455796057.db2.gz	FEVPLQZSCFVMIY-UHFFFAOYSA-N	0	3	338.455	3.144	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc3nc(C(C)(C)C)[nH]c3c2)CC1	ZINC000194046830	455796062	/nfs/dbraw/zinc/79/60/62/455796062.db2.gz	FEVPLQZSCFVMIY-UHFFFAOYSA-N	0	3	338.455	3.144	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2ccnc(SCC)c2)CC1	ZINC000186584775	455798857	/nfs/dbraw/zinc/79/88/57/455798857.db2.gz	UYRWPTSUJLTODB-UHFFFAOYSA-N	0	3	348.516	3.033	20	30		EGEDHN
C[C@H]1C[C@@H](N(C)C(=O)CC(C)(C)C#N)CCN1Cc1ccccc1	ZINC000278384400	455833974	/nfs/dbraw/zinc/83/39/74/455833974.db2.gz	RCZXKELQSBNBTD-WMZOPIPTSA-N	0	3	327.472	3.438	20	30		EGEDHN
C[C@H]1C[C@H](N(C)C(=O)CC(C)(C)C#N)CCN1Cc1ccccc1	ZINC000278384390	455834032	/nfs/dbraw/zinc/83/40/32/455834032.db2.gz	RCZXKELQSBNBTD-FUHWJXTLSA-N	0	3	327.472	3.438	20	30		EGEDHN
C=CCOc1ccc(CNC[C@@H](O)Cc2cccc(F)c2)cc1OC	ZINC000295113515	455838596	/nfs/dbraw/zinc/83/85/96/455838596.db2.gz	LYUZFVQQNQNNIM-SFHVURJKSA-N	0	3	345.414	3.092	20	30		EGEDHN
N#C[C@@H]1CC[C@H](N2CCC[C@H](CNC(=O)Nc3cccc(F)c3)C2)C1	ZINC000278618937	455843296	/nfs/dbraw/zinc/84/32/96/455843296.db2.gz	NFGOGDHIVBFLOW-RKVPGOIHSA-N	0	3	344.434	3.351	20	30		EGEDHN
COc1cccc(OC)c1OC1CCN([C@@H]2CC[C@@H](C#N)C2)CC1	ZINC000278693003	455844819	/nfs/dbraw/zinc/84/48/19/455844819.db2.gz	SHTKRYLTZWOMCI-HUUCEWRRSA-N	0	3	330.428	3.239	20	30		EGEDHN
C[C@@H]1[C@@H](NC(=O)[C@]2(C#N)CC23CCCC3)CCN1Cc1ccccc1	ZINC000295302355	455845478	/nfs/dbraw/zinc/84/54/78/455845478.db2.gz	KHNKMOHARWHRRL-PLMTUMEDSA-N	0	3	337.467	3.240	20	30		EGEDHN
C[C@H](N[C@H](c1ccccc1)C1CC1)C(=O)NC1(C#N)CCCCC1	ZINC000194553055	455858237	/nfs/dbraw/zinc/85/82/37/455858237.db2.gz	MDLVGIGKOSHFIT-MAUKXSAKSA-N	0	3	325.456	3.458	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)N[C@H](C[C@H]1CCOC1)c1ccccc1	ZINC000279131121	455859203	/nfs/dbraw/zinc/85/92/03/455859203.db2.gz	WBRLYPIUSLIKHX-NLWGTHIKSA-N	0	3	342.483	3.333	20	30		EGEDHN
C#CCN(Cc1ccccc1)C[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000285510170	455860880	/nfs/dbraw/zinc/86/08/80/455860880.db2.gz	DICZPAQJJVHJGS-HXUWFJFHSA-N	0	3	332.447	3.284	20	30		EGEDHN
CC[C@H](C)N1CCN(CC#Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000295921063	455863604	/nfs/dbraw/zinc/86/36/04/455863604.db2.gz	FITJYXPZTLZEPL-HNNXBMFYSA-N	0	3	340.389	3.353	20	30		EGEDHN
COc1cc(CN[C@H](c2cccs2)C(C)(C)CO)ccc1C#N	ZINC000295965701	455864445	/nfs/dbraw/zinc/86/44/45/455864445.db2.gz	IOGNTABXKAMNAB-QGZVFWFLSA-N	0	3	330.453	3.478	20	30		EGEDHN
COc1ccc(C)cc1[C@H](C)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000279684090	455870642	/nfs/dbraw/zinc/87/06/42/455870642.db2.gz	HEISEZMLGFSRSM-YJBOKZPZSA-N	0	3	347.418	3.435	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCCCc2ccccc2F)CC1	ZINC000279895455	455876445	/nfs/dbraw/zinc/87/64/45/455876445.db2.gz	KXNDKKLAQHOEBY-UHFFFAOYSA-N	0	3	333.451	3.098	20	30		EGEDHN
CN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(C(C)(C)C#N)cc2)C1	ZINC000280084709	455887259	/nfs/dbraw/zinc/88/72/59/455887259.db2.gz	YJELIIUTXBYLLX-SJLPKXTDSA-N	0	3	325.456	3.044	20	30		EGEDHN
C[C@H](NC(=O)CCc1ccc(C#N)cc1)[C@H](c1ccccc1)N(C)C	ZINC000187264409	455889190	/nfs/dbraw/zinc/88/91/90/455889190.db2.gz	VOKPFBDEOUVBOB-HRAATJIYSA-N	0	3	335.451	3.298	20	30		EGEDHN
CCC[C@]1(NCC(=O)N(CCC#N)c2cccc(Cl)c2)CCOC1	ZINC000285650242	455889831	/nfs/dbraw/zinc/88/98/31/455889831.db2.gz	SJSFLOXNIXHCLX-SFHVURJKSA-N	0	3	349.862	3.135	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H]2CCCc3c(F)cc(F)cc32)CC1	ZINC000296258401	455892789	/nfs/dbraw/zinc/89/27/89/455892789.db2.gz	CPUZPTBSMKESHF-GOSISDBHSA-N	0	3	349.425	3.292	20	30		EGEDHN
N#CCc1ccc(C(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1	ZINC000270273650	455917157	/nfs/dbraw/zinc/91/71/57/455917157.db2.gz	KPNMDUPMDVQEFF-HXUWFJFHSA-N	0	3	333.435	3.320	20	30		EGEDHN
N#Cc1ccc(C(F)(F)F)nc1NC[C@H]1NCCc2ccccc21	ZINC000261725460	455935547	/nfs/dbraw/zinc/93/55/47/455935547.db2.gz	RBQOTFUJBXZLFC-CQSZACIVSA-N	0	3	332.329	3.271	20	30		EGEDHN
CC(C)c1nnc([C@H](C)[NH2+]C2CCN(c3ccc(C#N)cc3)CC2)[n-]1	ZINC000286000703	455956891	/nfs/dbraw/zinc/95/68/91/455956891.db2.gz	HNKPWYQJHZFVHN-AWEZNQCLSA-N	0	3	338.459	3.119	20	30		EGEDHN
N#Cc1c(Cl)nsc1N1C[C@H]2CN(Cc3ccccc3)C[C@H]2C1	ZINC000280447707	455973182	/nfs/dbraw/zinc/97/31/82/455973182.db2.gz	KZFOKKYVIQKWGI-OKILXGFUSA-N	0	3	344.871	3.236	20	30		EGEDHN
C[C@H]([NH2+][C@H]1CCCN(c2ccc(C#N)cc2)C1=O)c1ccccc1[O-]	ZINC000272553046	455992362	/nfs/dbraw/zinc/99/23/62/455992362.db2.gz	SUVMSSOUASECJW-KSSFIOAISA-N	0	3	335.407	3.110	20	30		EGEDHN
Cc1cccn2cc(CNC3CCN(c4ccc(C#N)cc4)CC3)nc12	ZINC000286170595	455993069	/nfs/dbraw/zinc/99/30/69/455993069.db2.gz	PVSKWCWRSKRSKO-UHFFFAOYSA-N	0	3	345.450	3.273	20	30		EGEDHN
COc1ccc(Cl)cc1NC(=O)CCN1CCC(C)(C#N)CC1	ZINC000272571038	455997822	/nfs/dbraw/zinc/99/78/22/455997822.db2.gz	NCKQUBBWORGLJB-UHFFFAOYSA-N	0	3	335.835	3.303	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)C[C@H](C)c1c(C)n[nH]c1C)C(C)C	ZINC000270648901	456003975	/nfs/dbraw/zinc/00/39/75/456003975.db2.gz	AXWIXHHRAXIPFI-MAUKXSAKSA-N	0	3	346.519	3.335	20	30		EGEDHN
C=CCSCCNCc1cc2c(cc1Br)OCO2	ZINC000222058563	456044827	/nfs/dbraw/zinc/04/48/27/456044827.db2.gz	QYOCFEKKNWSQES-UHFFFAOYSA-N	0	3	330.247	3.187	20	30		EGEDHN
C[C@H](C#N)Oc1ccccc1NC(=O)N1CC[C@H](N2CCCCC2)C1	ZINC000272703307	456046037	/nfs/dbraw/zinc/04/60/37/456046037.db2.gz	VDPAVYOPTPSENF-CVEARBPZSA-N	0	3	342.443	3.070	20	30		EGEDHN
C[C@H](N[C@H]1CCO[C@H](c2cncn2C)C1)c1ccc(C#N)cc1F	ZINC000332429650	456075350	/nfs/dbraw/zinc/07/53/50/456075350.db2.gz	PTJVNLVFEIXGCV-YEWDVWPNSA-N	0	3	328.391	3.002	20	30		EGEDHN
C=CCS(=O)(=O)CCN[C@@H](C)c1ccc(OC)c2ccccc21	ZINC000272818262	456078720	/nfs/dbraw/zinc/07/87/20/456078720.db2.gz	FJFIYBDWSILELC-AWEZNQCLSA-N	0	3	333.453	3.100	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC(C)(C)[C@H]2c2cccs2)CC1	ZINC000287892446	456081795	/nfs/dbraw/zinc/08/17/95/456081795.db2.gz	YKBILVRWKXWQEK-MRXNPFEDSA-N	0	3	333.501	3.491	20	30		EGEDHN
CC[C@@](C)(C#N)C(=O)N1CC[C@@]2(CCN(Cc3ccccc3)C2)C1	ZINC000287982246	456082991	/nfs/dbraw/zinc/08/29/91/456082991.db2.gz	AOCXUPSGWABCJC-VQTJNVASSA-N	0	3	325.456	3.051	20	30		EGEDHN
C=CCN(C(=O)NCc1ccc(OC2CCN(C)CC2)cc1)C1CC1	ZINC000288047815	456086145	/nfs/dbraw/zinc/08/61/45/456086145.db2.gz	ZVBHNFNDMCUVQR-UHFFFAOYSA-N	0	3	343.471	3.020	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CC[C@@]2(CCN(Cc3ccccc3)C2)C1	ZINC000288617562	456100643	/nfs/dbraw/zinc/10/06/43/456100643.db2.gz	ZXVHNHVQKAXSCD-WIYYLYMNSA-N	0	3	342.483	3.092	20	30		EGEDHN
CC(C)(C)OCc1cc(CNC(=N)Nc2cc(F)ccc2F)no1	ZINC000288735222	456104318	/nfs/dbraw/zinc/10/43/18/456104318.db2.gz	ODWJMHFAFAHLHV-UHFFFAOYSA-N	0	3	338.358	3.195	20	30		EGEDHN
Cc1nnc(N(C)[C@H]2CCCN(Cc3ccccc3)C2)c(C#N)c1C	ZINC000301438788	456116232	/nfs/dbraw/zinc/11/62/32/456116232.db2.gz	NTLUYDJQRXBMIT-SFHVURJKSA-N	0	3	335.455	3.066	20	30		EGEDHN
Cc1cnccc1OC1CCN(CCCC2(C#N)CCOCC2)CC1	ZINC000289439285	456125565	/nfs/dbraw/zinc/12/55/65/456125565.db2.gz	SXVBZUALMANRCF-UHFFFAOYSA-N	0	3	343.471	3.334	20	30		EGEDHN
COc1ccccc1CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000271209087	456172917	/nfs/dbraw/zinc/17/29/17/456172917.db2.gz	ZPUJMRPLSDQGOD-UHFFFAOYSA-N	0	3	349.434	3.418	20	30		EGEDHN
CC[C@H](CC#N)N[C@@H]1CCCC[C@@H](N2C(=O)c3ccccc3C2=O)C1	ZINC000273869974	456246522	/nfs/dbraw/zinc/24/65/22/456246522.db2.gz	OGDWMOSOAMWFFJ-BZUAXINKSA-N	0	3	339.439	3.266	20	30		EGEDHN
C=CCCO[C@@H](C)c1nc(-c2ccccc2OCCN(C)C)no1	ZINC000273933839	456248639	/nfs/dbraw/zinc/24/86/39/456248639.db2.gz	RNHVWFIVNOFXLI-AWEZNQCLSA-N	0	3	331.416	3.331	20	30		EGEDHN
N#C[C@H]1CCC[C@H](NCc2cccc(C(=O)NCc3ccco3)c2)C1	ZINC000274205017	456252705	/nfs/dbraw/zinc/25/27/05/456252705.db2.gz	MBHDZOVMMINWID-YJBOKZPZSA-N	0	3	337.423	3.382	20	30		EGEDHN
COc1cc(CNCCSCc2ccccc2C#N)ccc1C#N	ZINC000281800581	456324257	/nfs/dbraw/zinc/32/42/57/456324257.db2.gz	VGUWNQUBUIJWOE-UHFFFAOYSA-N	0	3	337.448	3.462	20	30		EGEDHN
C=CCN1CC[C@H](N(Cc2ccc(OC)cc2)[C@@H](C)C2CC2)C1=O	ZINC000337143870	456329948	/nfs/dbraw/zinc/32/99/48/456329948.db2.gz	VVLPOOQBHNVWNZ-KXBFYZLASA-N	0	3	328.456	3.083	20	30		EGEDHN
N#CC1(CCCN2CCN(CCc3cccs3)CC2)CCOCC1	ZINC000337137248	456330759	/nfs/dbraw/zinc/33/07/59/456330759.db2.gz	NZUVNNHVHJXWIE-UHFFFAOYSA-N	0	3	347.528	3.009	20	30		EGEDHN
C=CCN1CC[C@H](N(Cc2ccc(OC)cc2)[C@H](C)C2CC2)C1=O	ZINC000337143867	456330775	/nfs/dbraw/zinc/33/07/75/456330775.db2.gz	VVLPOOQBHNVWNZ-BEFAXECRSA-N	0	3	328.456	3.083	20	30		EGEDHN
CCN1CCN(c2ccc(F)cc2[C@@H](C)N[C@H](C)CCC#N)CC1	ZINC000276364719	456457493	/nfs/dbraw/zinc/45/74/93/456457493.db2.gz	ZQOZHTSSRHDBDC-HZPDHXFCSA-N	0	3	332.467	3.310	20	30		EGEDHN
COc1cc(C#N)ccc1CN(C)CCc1cccc([N+](=O)[O-])c1	ZINC000282344158	456483940	/nfs/dbraw/zinc/48/39/40/456483940.db2.gz	CDLKBQCHTGEUFB-UHFFFAOYSA-N	0	3	325.368	3.150	20	30		EGEDHN
CN1CC=C(CNC(=O)c2ccccc2-c2ccccc2C#N)CC1	ZINC000343248261	456481389	/nfs/dbraw/zinc/48/13/89/456481389.db2.gz	BDWWEWSWQDACAZ-UHFFFAOYSA-N	0	3	331.419	3.217	20	30		EGEDHN
C=CCOc1cccc(CNCc2ccc(C[S@](C)=O)cc2)c1	ZINC000353115817	456500051	/nfs/dbraw/zinc/50/00/51/456500051.db2.gz	FJQJZOQQMXDVCZ-QHCPKHFHSA-N	0	3	329.465	3.420	20	30		EGEDHN
C=CC1CCN(C[C@@H](O)COc2ccc(/C=C\C)cc2OC)CC1	ZINC000348179775	456517862	/nfs/dbraw/zinc/51/78/62/456517862.db2.gz	HISAKNAIWNHXAE-WLPBJKJWSA-N	0	3	331.456	3.366	20	30		EGEDHN
C=CCc1cc(CNC[C@@H](O)[C@H](C)c2ccccc2)cc(OC)c1O	ZINC000657797015	462272798	/nfs/dbraw/zinc/27/27/98/462272798.db2.gz	YNXJDWILFVWZLP-DNVCBOLYSA-N	0	3	341.451	3.384	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CNC(CC)(CC)CCO	ZINC000282485007	456529335	/nfs/dbraw/zinc/52/93/35/456529335.db2.gz	PFAWWDFRFUMTTI-UHFFFAOYSA-N	0	3	336.501	3.434	20	30		EGEDHN
COc1cc([C@H](C)N[C@H](C)c2cccc(C#N)c2)ccc1OCCO	ZINC000305756558	456556089	/nfs/dbraw/zinc/55/60/89/456556089.db2.gz	AIXUAMVDZCIOQO-CABCVRRESA-N	0	3	340.423	3.350	20	30		EGEDHN
C=C(Br)CN[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1C	ZINC000310009543	456578022	/nfs/dbraw/zinc/57/80/22/456578022.db2.gz	JNGJGSKXIHKJAH-JQWIXIFHSA-N	0	3	333.270	3.130	20	30		EGEDHN
CCN1CCO[C@H](CNCc2ccc(C#N)s2)[C@@H]1c1ccccc1	ZINC000343393545	456587944	/nfs/dbraw/zinc/58/79/44/456587944.db2.gz	QKZHPJNWCDEWSH-MOPGFXCFSA-N	0	3	341.480	3.171	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N(Cc1ccco1)C1CCN(C)CC1	ZINC000337892108	456590014	/nfs/dbraw/zinc/59/00/14/456590014.db2.gz	IKOPMNCKGSEXMU-UHFFFAOYSA-N	0	3	337.423	3.196	20	30		EGEDHN
C=CCc1cc(CN[C@@H]2CCO[C@@H]2c2cccnc2)cc(OC)c1O	ZINC000343399596	456593293	/nfs/dbraw/zinc/59/32/93/456593293.db2.gz	KLBTYLANYABQLE-YLJYHZDGSA-N	0	3	340.423	3.144	20	30		EGEDHN
CN(C)C[C@H](NC(=O)c1cccc(CC#N)c1)c1ccc(Cl)cc1	ZINC000282817996	456634634	/nfs/dbraw/zinc/63/46/34/456634634.db2.gz	IOSAJHGKHFMCDS-SFHVURJKSA-N	0	3	341.842	3.439	20	30		EGEDHN
CCCC1CCC(NCCS(=O)(=O)c2ccc(C#N)cc2)CC1	ZINC000321832047	456642320	/nfs/dbraw/zinc/64/23/20/456642320.db2.gz	GJQGTJRYQPTBCF-UHFFFAOYSA-N	0	3	334.485	3.280	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@@H](NCc1ccccc1CN1CCOCC1)CC2	ZINC000353413882	456686318	/nfs/dbraw/zinc/68/63/18/456686318.db2.gz	RFWNEABXLZIVGW-QFIPXVFZSA-N	0	3	347.462	3.168	20	30		EGEDHN
C=CCN(CCOc1ccccc1)[C@H](C)c1cccc(-n2cnnn2)c1	ZINC000343558862	456705004	/nfs/dbraw/zinc/70/50/04/456705004.db2.gz	CQTOUMSALGLJFX-QGZVFWFLSA-N	0	3	349.438	3.290	20	30		EGEDHN
C=C(C)COc1cc(CN2CCN(C3CCC3)CC2)ccc1OC	ZINC000353508140	456723064	/nfs/dbraw/zinc/72/30/64/456723064.db2.gz	PUNYKMMMLBCQBU-UHFFFAOYSA-N	0	3	330.472	3.320	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Cc1nc(CC)cs1)C(C)C	ZINC000283184020	456729466	/nfs/dbraw/zinc/72/94/66/456729466.db2.gz	LNPYZVWXRQZGNO-INIZCTEOSA-N	0	3	335.517	3.063	20	30		EGEDHN
O=C(CN[C@@H]1CCC(=O)NC12CCC2)Nc1nc2c(s1)CCCC2	ZINC000328688858	456738728	/nfs/dbraw/zinc/73/87/28/456738728.db2.gz	HWKZRYPQHLGJLO-CYBMUJFWSA-N	0	3	348.472	3.241	20	30		EGEDHN
CN(C)Cc1cccc(CNC(=O)Nc2ccc(C#N)c(F)c2)c1	ZINC000353543577	456746163	/nfs/dbraw/zinc/74/61/63/456746163.db2.gz	AUSHTCCCQTXVKT-UHFFFAOYSA-N	0	3	326.375	3.081	20	30		EGEDHN
CC[C@@H](C)n1ncc(NC(=O)N2CCN3CCC[C@H]3C2)c1C1CC1	ZINC000328944634	456796971	/nfs/dbraw/zinc/79/69/71/456796971.db2.gz	UTSHTCIILMPTBV-HIFRSBDPSA-N	0	3	331.464	3.057	20	30		EGEDHN
CC(C)n1nccc1[C@@H]1OCCC[C@H]1C(=O)N[C@@H]1CCN(C)[C@H](C)C1	ZINC000328993407	456808626	/nfs/dbraw/zinc/80/86/26/456808626.db2.gz	DSIWXOGVTFXLTJ-YFHUEUNASA-N	0	3	348.491	3.371	20	30		EGEDHN
Cc1cccc(NC(=O)[C@H](C)N2CCC[C@@H]2[C@H]2COCC[C@]2(C)O)c1	ZINC000328995430	456808807	/nfs/dbraw/zinc/80/88/07/456808807.db2.gz	WIAZCQMRODIAIE-MMTROXRISA-N	0	3	346.471	3.223	20	30		EGEDHN
NC(=O)[C@@H]1CCCN(Cc2ccccc2NC(=O)[C@H]2CCC(=O)N2)C1	ZINC000329144706	456843164	/nfs/dbraw/zinc/84/31/64/456843164.db2.gz	NFPMJGTWLDAURQ-UKRRQHHQSA-N	0	3	344.415	3.141	20	30		EGEDHN
CCCN1CCC[C@H]1CNC(=O)c1ccc2c(c1)NC(=O)[C@@H](C)N2C	ZINC000329224269	456855785	/nfs/dbraw/zinc/85/57/85/456855785.db2.gz	ZKCGSHIKXMIPDI-HIFRSBDPSA-N	0	3	344.459	3.292	20	30		EGEDHN
Cc1cc2c[nH]nc2c(C(=O)N[C@@H]2CN(C)C[C@H]2c2ccccc2)c1	ZINC000329245775	456860028	/nfs/dbraw/zinc/86/00/28/456860028.db2.gz	QTRXJHZKMICANI-ZWKOTPCHSA-N	0	3	334.423	3.274	20	30		EGEDHN
C[C@@H](NC(=O)C(C#N)Cc1ccc(C#N)cc1)c1ccc(Cl)cn1	ZINC000338902649	456867605	/nfs/dbraw/zinc/86/76/05/456867605.db2.gz	KPBYIYYAGOLBIK-DOMZBBRYSA-N	0	3	338.798	3.166	20	30		EGEDHN
Cc1cnc([C@H](NC(=O)N[C@H](C)C2=CCN(C)CC2)C2CC2)s1	ZINC000329309177	456870778	/nfs/dbraw/zinc/87/07/78/456870778.db2.gz	AHBPYXKSAGPIEZ-IUODEOHRSA-N	0	3	334.489	3.057	20	30		EGEDHN
C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)N[C@H]1CCCOc2cc(F)ccc21	ZINC000329516697	456903292	/nfs/dbraw/zinc/90/32/92/456903292.db2.gz	YWWRTNDWAKIUNI-DQYPLSBCSA-N	0	3	347.434	3.026	20	30		EGEDHN
CC(C)Cn1ncc2cc(C(=O)N[C@H](C)C3=CCN(C)CC3)cnc21	ZINC000329533942	456905736	/nfs/dbraw/zinc/90/57/36/456905736.db2.gz	YJTXXJFLMOGBLC-CQSZACIVSA-N	0	3	341.459	3.042	20	30		EGEDHN
CC(C)N(CC(=O)NC(=O)Nc1ccc2c(c1)OCCO2)C1CCC1	ZINC000329606012	456914631	/nfs/dbraw/zinc/91/46/31/456914631.db2.gz	ZOOMVAIOQIDFKX-UHFFFAOYSA-N	0	3	347.415	3.223	20	30		EGEDHN
C=CCc1cc(CN(CCN(C)C)Cc2ccco2)cc(OC)c1O	ZINC000349293562	456934534	/nfs/dbraw/zinc/93/45/34/456934534.db2.gz	FFGWDNIIDAXTPM-UHFFFAOYSA-N	0	3	344.455	3.286	20	30		EGEDHN
CC[C@@H]1c2ccsc2CCN1C(=O)N[C@H]1CCc2nc[nH]c2C1	ZINC000329749937	456935607	/nfs/dbraw/zinc/93/56/07/456935607.db2.gz	URJJVWDCRKTLCP-XHDPSFHLSA-N	0	3	330.457	3.252	20	30		EGEDHN
CC[C@@H]1c2ccsc2CCN1C(=O)N[C@H]1CCc2[nH]cnc2C1	ZINC000329749937	456935609	/nfs/dbraw/zinc/93/56/09/456935609.db2.gz	URJJVWDCRKTLCP-XHDPSFHLSA-N	0	3	330.457	3.252	20	30		EGEDHN
CCc1nccn1[C@@H]1CCCN(C([O-])=[NH+]CC2C[C@H](C)O[C@@H](C)C2)C1	ZINC000329801054	456942798	/nfs/dbraw/zinc/94/27/98/456942798.db2.gz	JGZLNUYJDWKCSX-YQQAZPJKSA-N	0	3	348.491	3.200	20	30		EGEDHN
C[C@H]1CCN(Cc2cccc(OCc3ccccc3C#N)c2)C[C@@H]1O	ZINC000349408312	456963947	/nfs/dbraw/zinc/96/39/47/456963947.db2.gz	PDXBSHRGRQUBNJ-KKSFZXQISA-N	0	3	336.435	3.340	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NCC(C)(C)N1CCc2ccccc2C1)OCC	ZINC000339199844	456988248	/nfs/dbraw/zinc/98/82/48/456988248.db2.gz	CYDIEXLIEVQEKS-LJQANCHMSA-N	0	3	344.499	3.311	20	30		EGEDHN
C[C@H](C(=O)NC1(C#N)CCC1)N(C)CC12CC3CC(CC(C3)C1)C2	ZINC000345773973	456993006	/nfs/dbraw/zinc/99/30/06/456993006.db2.gz	PTDGUKFQSZSGSV-DGTBMVLOSA-N	0	3	329.488	3.086	20	30		EGEDHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)C[C@@H](CC#N)c2ccccc2)C1	ZINC000356464977	457002684	/nfs/dbraw/zinc/00/26/84/457002684.db2.gz	UZDRPRLLBHQCEV-CEXWTWQISA-N	0	3	325.456	3.017	20	30		EGEDHN
C=CCOc1ccc(CN2CCC(O[C@@H]3CCOC3)CC2)cc1OC	ZINC000354010285	457005780	/nfs/dbraw/zinc/00/57/80/457005780.db2.gz	MUFUNLXFVJKESF-GOSISDBHSA-N	0	3	347.455	3.030	20	30		EGEDHN
N#Cc1ccc(OCCN(Cc2ccccc2)CC2(CO)CC2)cc1	ZINC000341930128	457007782	/nfs/dbraw/zinc/00/77/82/457007782.db2.gz	BUNBSTZLPJCKMQ-UHFFFAOYSA-N	0	3	336.435	3.212	20	30		EGEDHN
C[C@H]1C[C@H]1N1CCN(C(=O)c2ccc(C(C)(C)C#N)cc2)C[C@@H](C)C1	ZINC000346163878	457021278	/nfs/dbraw/zinc/02/12/78/457021278.db2.gz	DCVQUGUBFPKPKZ-TXPKVOOTSA-N	0	3	339.483	3.290	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CC2(CCC2)[C@H]1[C@@H]1CCCO1	ZINC000330293481	457023313	/nfs/dbraw/zinc/02/33/13/457023313.db2.gz	DSKKZWNOEAKBLB-GBESFXJTSA-N	0	3	338.451	3.319	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)C(C#N)Cc2ccc(C#N)cc2)cc1	ZINC000359104326	457055567	/nfs/dbraw/zinc/05/55/67/457055567.db2.gz	HVPGTEAPVAPQMF-IBGZPJMESA-N	0	3	345.402	3.122	20	30		EGEDHN
C[C@@H]1[C@@H](NC(=O)c2cn(CCCC#N)c3ccccc23)CCCN1C	ZINC000346620231	457081496	/nfs/dbraw/zinc/08/14/96/457081496.db2.gz	RGVBGGZSSOTAGZ-QAPCUYQASA-N	0	3	338.455	3.158	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)[C@H](C)N1C[C@@H](c2ccccc2)C[C@H]1C	ZINC000330793962	457086633	/nfs/dbraw/zinc/08/66/33/457086633.db2.gz	CZSDEQBTRJTRQM-NDUPCHFUSA-N	0	3	327.472	3.307	20	30		EGEDHN
CC[C@H](C)N[C@@H](CNC(=O)c1cccc(CC#N)c1)c1ccco1	ZINC000359553393	457095048	/nfs/dbraw/zinc/09/50/48/457095048.db2.gz	HOCPCABFWCTGKF-YOEHRIQHSA-N	0	3	325.412	3.205	20	30		EGEDHN
C[C@H](CNC(=O)Nc1cc(F)cc([N+](=O)[O-])c1)N1CCC(C)CC1	ZINC000331001634	457118050	/nfs/dbraw/zinc/11/80/50/457118050.db2.gz	WFDSXFHSZIMWJM-GFCCVEGCSA-N	0	3	338.383	3.180	20	30		EGEDHN
COc1ccc(CN[C@H](C)c2cc[nH]c(=O)c2)cc1OCCCC#N	ZINC000339456178	457125047	/nfs/dbraw/zinc/12/50/47/457125047.db2.gz	UPHDMLGPVXMNFT-CQSZACIVSA-N	0	3	341.411	3.329	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN(C)CCOc1ccc(F)cc1	ZINC000354240092	457149785	/nfs/dbraw/zinc/14/97/85/457149785.db2.gz	QHGPAXYDAFQCLJ-UHFFFAOYSA-N	0	3	344.386	3.096	20	30		EGEDHN
Cc1cc(CN2CCC(C(=O)N3CCC[C@H](C)C3)CC2)ccc1C#N	ZINC000362924163	457157515	/nfs/dbraw/zinc/15/75/15/457157515.db2.gz	NNGOKMFBHJCEEL-INIZCTEOSA-N	0	3	339.483	3.337	20	30		EGEDHN
C=C(CNC(=O)NCCCN1CCc2ccccc2C1)c1ccccc1	ZINC000350480542	457184166	/nfs/dbraw/zinc/18/41/66/457184166.db2.gz	IWJMYWAWRKHGMA-UHFFFAOYSA-N	0	3	349.478	3.447	20	30		EGEDHN
CC(C#N)C(=O)NC[C@H](c1ccccc1)N1CCc2sccc2C1	ZINC000347084728	457222543	/nfs/dbraw/zinc/22/25/43/457222543.db2.gz	ZLPFWSIGTZVJPQ-RHSMWYFYSA-N	0	3	339.464	3.123	20	30		EGEDHN
CCCN(CC(=O)N(CC)CCC#N)[C@H]1C[C@H](OCC)C12CCCC2	ZINC000354468199	457243472	/nfs/dbraw/zinc/24/34/72/457243472.db2.gz	WDNJYJCFRQUTMQ-ROUUACIJSA-N	0	3	349.519	3.198	20	30		EGEDHN
COc1ccc(C[C@H](NC(=O)C(C)C#N)c2ccccc2)cc1OC	ZINC000347131296	457246786	/nfs/dbraw/zinc/24/67/86/457246786.db2.gz	IXWXFSVQDZVRBH-YOEHRIQHSA-N	0	3	338.407	3.263	20	30		EGEDHN
CC(C#N)C(=O)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000347139675	457251787	/nfs/dbraw/zinc/25/17/87/457251787.db2.gz	SJPYTCYIOOHPNM-WCQYABFASA-N	0	3	344.802	3.256	20	30		EGEDHN
C=C(C)CN1CCC(N[C@H](c2nccn2C)c2cccc(F)c2)CC1	ZINC000357029302	457285132	/nfs/dbraw/zinc/28/51/32/457285132.db2.gz	SMNXPYLPUDJHQN-IBGZPJMESA-N	0	3	342.462	3.279	20	30		EGEDHN
N#Cc1ccnc(NC[C@@H]2CCCN2Cc2ccccc2)c1Cl	ZINC000342419087	457293919	/nfs/dbraw/zinc/29/39/19/457293919.db2.gz	UOPACGGIHXIKAX-INIZCTEOSA-N	0	3	326.831	3.105	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNc1cc(N)c([N+](=O)[O-])c(C#N)c1)C(C)C	ZINC000339970752	457317970	/nfs/dbraw/zinc/31/79/70/457317970.db2.gz	QAVHWCBKZBQALX-KRWDZBQOSA-N	0	3	343.431	3.159	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000355020579	457335585	/nfs/dbraw/zinc/33/55/85/457335585.db2.gz	XIECIVUWPOCOKJ-HXUWFJFHSA-N	0	3	343.515	3.007	20	30		EGEDHN
C[C@@H](C(=O)N(C)CCC#N)N1CCC[C@](C)(c2ccccc2)CC1	ZINC000352211313	457348941	/nfs/dbraw/zinc/34/89/41/457348941.db2.gz	JTQHBBUDKYRCJH-PXNSSMCTSA-N	0	3	327.472	3.191	20	30		EGEDHN
C[C@@H](CNC(=O)C[C@@H](CC#N)c1ccccc1)N1CCC(C)CC1	ZINC000355272330	457352392	/nfs/dbraw/zinc/35/23/92/457352392.db2.gz	HGWCLWJJVOALDP-PKOBYXMFSA-N	0	3	327.472	3.311	20	30		EGEDHN
CC(C)(CCC#N)CN[C@@H](Cc1ccc(C(F)(F)F)cc1)C(N)=O	ZINC000352270144	457353824	/nfs/dbraw/zinc/35/38/24/457353824.db2.gz	CNGOKOGWGXCDES-AWEZNQCLSA-N	0	3	341.377	3.021	20	30		EGEDHN
COc1ccc(C(=O)C(C#N)c2ccncn2)c(OCC(C)C)c1	ZINC000355548194	457386558	/nfs/dbraw/zinc/38/65/58/457386558.db2.gz	NAUYXTYAOKDKKC-OAHLLOKOSA-N	0	3	325.368	3.010	20	30		EGEDHN
CN(C)CCOc1ccccc1CNc1c(F)cc(C#N)cc1F	ZINC000357235922	457391836	/nfs/dbraw/zinc/39/18/36/457391836.db2.gz	BYJMWWCCMRPAGW-UHFFFAOYSA-N	0	3	331.366	3.389	20	30		EGEDHN
N#CC[C@@H](CC(=O)N1CC[C@@H](N2CCCCC2)C1)c1ccccc1	ZINC000355806680	457419492	/nfs/dbraw/zinc/41/94/92/457419492.db2.gz	CFACSLRMYULFKI-RBUKOAKNSA-N	0	3	325.456	3.161	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN1CCC[C@]1(C)Cc1ccccc1	ZINC000342682768	457453932	/nfs/dbraw/zinc/45/39/32/457453932.db2.gz	ZUJPWERJCHJEQW-FXAWDEMLSA-N	0	3	327.472	3.092	20	30		EGEDHN
CCC[C@H](C)NC(=O)[C@@H]1CCCN(Cc2ccc(CC#N)cc2)C1	ZINC000342721298	457478650	/nfs/dbraw/zinc/47/86/50/457478650.db2.gz	ZFQPMSYEXYQACH-QFBILLFUSA-N	0	3	327.472	3.269	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H]2CC[C@@H](C1)N2CCCSCC#N	ZINC000369996799	457493873	/nfs/dbraw/zinc/49/38/73/457493873.db2.gz	NPMSRRCICDXMBT-CABCVRRESA-N	0	3	339.505	3.107	20	30		EGEDHN
Cc1cc(C#N)nc(N2C[C@H](C)N(Cc3ccccc3)[C@@H](C)[C@H]2C)n1	ZINC000404312567	457540166	/nfs/dbraw/zinc/54/01/66/457540166.db2.gz	MFKCKBUQNVFDRS-YESZJQIVSA-N	0	3	335.455	3.144	20	30		EGEDHN
CN(C)CCN(Cc1ccco1)C(=O)C[C@@H](CC#N)c1ccccc1	ZINC000356313272	457569786	/nfs/dbraw/zinc/56/97/86/457569786.db2.gz	IOFWENDAKDKUSK-GOSISDBHSA-N	0	3	339.439	3.257	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)C[C@H](O)COCc1cccs1	ZINC000425538143	457589351	/nfs/dbraw/zinc/58/93/51/457589351.db2.gz	ROXJPMQFTJLTEL-PBHICJAKSA-N	0	3	330.453	3.190	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN[C@@H](C)c1ccncc1CC	ZINC000361130713	457600700	/nfs/dbraw/zinc/60/07/00/457600700.db2.gz	HATSZDWVKCZAFI-LPHOPBHVSA-N	0	3	340.467	3.463	20	30		EGEDHN
COC(=O)[C@H]1CC[C@@H](NCc2ccc(C#N)cc2C(F)(F)F)C1	ZINC000356404052	457608874	/nfs/dbraw/zinc/60/88/74/457608874.db2.gz	IOQNCMPDBLYXQG-WCQYABFASA-N	0	3	326.318	3.008	20	30		EGEDHN
C=CCN1CC[C@H](N(CCc2ccc(F)cc2)C2CCCC2)C1=O	ZINC000410339364	457637773	/nfs/dbraw/zinc/63/77/73/457637773.db2.gz	RZVPMBDTNCMYAZ-IBGZPJMESA-N	0	3	330.447	3.400	20	30		EGEDHN
N#Cc1cccc(OCCCN2CCC(Oc3ccccn3)CC2)c1	ZINC000357703445	457662972	/nfs/dbraw/zinc/66/29/72/457662972.db2.gz	GGDRACPPPTUGSI-UHFFFAOYSA-N	0	3	337.423	3.266	20	30		EGEDHN
C[C@H]1C[C@@H](c2ccccc2)CN1CC(=O)NCc1cccc(C#N)c1	ZINC000365340453	457745300	/nfs/dbraw/zinc/74/53/00/457745300.db2.gz	VTDBEWDLISGXML-OXJNMPFZSA-N	0	3	333.435	3.052	20	30		EGEDHN
N#Cc1nc(N[C@H]2CCN(Cc3ccccc3)C2)ccc1C(F)(F)F	ZINC000443411904	457760123	/nfs/dbraw/zinc/76/01/23/457760123.db2.gz	YHMGCJBRTGRNAW-AWEZNQCLSA-N	0	3	346.356	3.080	20	30		EGEDHN
COc1ccc(CNC(=O)C(C#N)CCc2ccccc2)c(OC)c1	ZINC000433222422	457783597	/nfs/dbraw/zinc/78/35/97/457783597.db2.gz	VEJYJPZLWMTDTJ-INIZCTEOSA-N	0	3	338.407	3.093	20	30		EGEDHN
Cc1c(F)cccc1NC(=O)CCN(C)Cc1ccc(C#N)cc1	ZINC000433274714	457797263	/nfs/dbraw/zinc/79/72/63/457797263.db2.gz	OFPFDXYIABDCKZ-UHFFFAOYSA-N	0	3	325.387	3.466	20	30		EGEDHN
N#Cc1ccc(OCCN[C@H](c2ccccc2)C2(CO)CCC2)cc1	ZINC000433295734	457802669	/nfs/dbraw/zinc/80/26/69/457802669.db2.gz	QFAGNSLCYRVIEO-HXUWFJFHSA-N	0	3	336.435	3.431	20	30		EGEDHN
Cc1nc2ccc(C(=O)C(C#N)c3nc4ccccc4[nH]3)cc2n1C	ZINC000361654863	457812986	/nfs/dbraw/zinc/81/29/86/457812986.db2.gz	MOTOYIDEDZILNP-ZDUSSCGKSA-N	0	3	329.363	3.248	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN2CC(Cc3ccc(F)c(F)c3)C2)cc1	ZINC000371176947	457817340	/nfs/dbraw/zinc/81/73/40/457817340.db2.gz	MLYPAKRSKOVTQG-IBGZPJMESA-N	0	3	328.362	3.044	20	30		EGEDHN
C[C@@H](CNC(=O)C(C#N)CCc1ccccc1)Oc1cccc(F)c1	ZINC000433362930	457821249	/nfs/dbraw/zinc/82/12/49/457821249.db2.gz	LCSMMZJDUSCUQS-RDJZCZTQSA-N	0	3	340.398	3.482	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cc(-c3cccnc3)ccc2C)CC1	ZINC000366551685	457849647	/nfs/dbraw/zinc/84/96/47/457849647.db2.gz	MXXUWZIZGLMJBY-UHFFFAOYSA-N	0	3	333.435	3.341	20	30		EGEDHN
C[C@@H](CCCc1cccnc1)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000457900747	457863197	/nfs/dbraw/zinc/86/31/97/457863197.db2.gz	CILCZINXJKPKRM-JXFKEZNVSA-N	0	3	346.434	3.163	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)N(C)CC(C)(C)C#N)C1	ZINC000457944061	457877090	/nfs/dbraw/zinc/87/70/90/457877090.db2.gz	YOSNYGZQRVZBLB-DOTOQJQBSA-N	0	3	328.460	3.013	20	30		EGEDHN
C=CCNC(=O)NC(=O)[C@H](C)N[C@H](CC(C)(C)C)c1ccc(F)cc1	ZINC000361841402	457901477	/nfs/dbraw/zinc/90/14/77/457901477.db2.gz	CTTUKUFKRXCRQT-XJKSGUPXSA-N	0	3	349.450	3.293	20	30		EGEDHN
C[C@H]1C[C@@H](c2cccnc2)N(CCC(=O)Nc2cccc(C#N)c2)C1	ZINC000411523134	457910576	/nfs/dbraw/zinc/91/05/76/457910576.db2.gz	GPHLBTQBPNMIBI-KXBFYZLASA-N	0	3	334.423	3.365	20	30		EGEDHN
C=CCC[C@H](C(=O)N1CCC(OCCN(C)C)CC1)c1ccccc1	ZINC000426821802	457910776	/nfs/dbraw/zinc/91/07/76/457910776.db2.gz	WTJXRRJDEHYSSO-FQEVSTJZSA-N	0	3	344.499	3.306	20	30		EGEDHN
CCCN(CCc1cccs1)[C@@H](C)C(=O)N[C@@](C)(C#N)C(C)C	ZINC000411557916	457919021	/nfs/dbraw/zinc/91/90/21/457919021.db2.gz	VOEZUYADFXTKMU-YJBOKZPZSA-N	0	3	335.517	3.446	20	30		EGEDHN
CN(CC(C)(C)C#N)C(=O)NC[C@H]1CCCN(Cc2cccs2)C1	ZINC000458098587	457930956	/nfs/dbraw/zinc/93/09/56/457930956.db2.gz	HHKIAZPABIELAO-OAHLLOKOSA-N	0	3	348.516	3.151	20	30		EGEDHN
CCNC(=O)[C@@H](NCc1ccc(-c2ccccc2C#N)cc1)C(C)C	ZINC000411775301	457976568	/nfs/dbraw/zinc/97/65/68/457976568.db2.gz	BNMBMMNIWGULDD-FQEVSTJZSA-N	0	3	335.451	3.476	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N[C@@H](C)c1cccc(O)c1)C(C)C	ZINC000444854465	457989369	/nfs/dbraw/zinc/98/93/69/457989369.db2.gz	WWKGPXRPOXNDRG-QFBILLFUSA-N	0	3	345.487	3.451	20	30		EGEDHN
CC(C)n1cnnc1[C@@H]1CCCN(CCCC2(C#N)CCOCC2)C1	ZINC000375611105	457989861	/nfs/dbraw/zinc/98/98/61/457989861.db2.gz	FEMPMLPMMXVPCI-QGZVFWFLSA-N	0	3	345.491	3.139	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@@H]2CCN(C3CCCC3)C2)cc1OC	ZINC000371596931	458002116	/nfs/dbraw/zinc/00/21/16/458002116.db2.gz	LTBBVHHBUHKRTJ-MRXNPFEDSA-N	0	3	344.455	3.007	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC2(Cc3cccc(Cl)c3)CC2)CC1	ZINC000458317961	458010425	/nfs/dbraw/zinc/01/04/25/458010425.db2.gz	DCZFLJDBZWTABA-UHFFFAOYSA-N	0	3	347.890	3.365	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@](C)(Cc2ccccc2)C2CC2)CC1	ZINC000458337549	458017719	/nfs/dbraw/zinc/01/77/19/458017719.db2.gz	QWEOVPSPMNIQBX-NRFANRHFSA-N	0	3	341.499	3.347	20	30		EGEDHN
N#CC(C(=O)c1ccc([N+](=O)[O-])cc1)c1cc(C(F)(F)F)ccn1	ZINC000362115021	458028985	/nfs/dbraw/zinc/02/89/85/458028985.db2.gz	BFDDUDNHFIIURP-LBPRGKRZSA-N	0	3	335.241	3.499	20	30		EGEDHN
C=CCC[C@H](NC(=O)N[C@@H]1CN(C2CC2)C[C@H]1C)c1ccccc1	ZINC000435098847	458093124	/nfs/dbraw/zinc/09/31/24/458093124.db2.gz	OCIYKKBZQCCQRB-AYOQOUSVSA-N	0	3	327.472	3.476	20	30		EGEDHN
CN(C)CCOc1ccc(NC(=O)[C@]2(C#N)CC23CCCC3)c(F)c1	ZINC000413922854	458312119	/nfs/dbraw/zinc/31/21/19/458312119.db2.gz	ZXAMEDDUCZMNGV-LJQANCHMSA-N	0	3	345.418	3.179	20	30		EGEDHN
COc1ccc([C@H](CO)CN[C@H](C)c2ccc(C#N)c(F)c2)cc1	ZINC000414177063	458316078	/nfs/dbraw/zinc/31/60/78/458316078.db2.gz	JLCDCFNLSRPQPD-DYVFJYSZSA-N	0	3	328.387	3.133	20	30		EGEDHN
N#CC1(F)CCN(C(=O)Nc2cc(CN)cc(C(F)(F)F)c2)CC1	ZINC000415974060	458335262	/nfs/dbraw/zinc/33/52/62/458335262.db2.gz	RBSCYGYINZDZSX-UHFFFAOYSA-N	0	3	344.312	3.024	20	30		EGEDHN
CN(C)CCN(Cc1ccsc1)C(=O)Nc1ccc(F)c(C#N)c1	ZINC000459388422	458355976	/nfs/dbraw/zinc/35/59/76/458355976.db2.gz	FOIWAVSTFGWOOW-UHFFFAOYSA-N	0	3	346.431	3.355	20	30		EGEDHN
CN(CCN1CCN([C@@H](C#N)c2ccccc2)CC1)Cc1ccccc1	ZINC000429688576	458358396	/nfs/dbraw/zinc/35/83/96/458358396.db2.gz	CITCVTKTJVPKJC-QFIPXVFZSA-N	0	3	348.494	3.001	20	30		EGEDHN
Cn1c2ccc(CN[C@H]3CCCc4cc(C#N)ccc43)cc2oc1=O	ZINC000418136750	458371669	/nfs/dbraw/zinc/37/16/69/458371669.db2.gz	ATCNTYLWRHSYBZ-KRWDZBQOSA-N	0	3	333.391	3.170	20	30		EGEDHN
C=CCC[C@H]1NC(=O)N(C[C@@H](c2ccc(C)cc2)N2CCCC2)C1=O	ZINC000419957166	458395470	/nfs/dbraw/zinc/39/54/70/458395470.db2.gz	VABOPVLXDZUDBV-MSOLQXFVSA-N	0	3	341.455	3.019	20	30		EGEDHN
C=CCOc1ccc(CN2CC[C@H](C(=O)OC)[C@@H]2C(C)C)cc1OC	ZINC000430146947	458410231	/nfs/dbraw/zinc/41/02/31/458410231.db2.gz	KEKPSZZPQRMFKP-LPHOPBHVSA-N	0	3	347.455	3.280	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)Cc1ccc(C#N)c(F)c1	ZINC000421356504	458411994	/nfs/dbraw/zinc/41/19/94/458411994.db2.gz	LEVUXGXVBVXHFU-UHFFFAOYSA-N	0	3	336.414	3.133	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N(CCN(C)C)C2CCCC2)cc1	ZINC000448976446	458417394	/nfs/dbraw/zinc/41/73/94/458417394.db2.gz	TZBULYWNYSDFRM-UHFFFAOYSA-N	0	3	330.472	3.127	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)[C@@H]1CC12CCSCC2)C(C)C	ZINC000448974634	458417786	/nfs/dbraw/zinc/41/77/86/458417786.db2.gz	LKYXYWIONNGEFY-IRXDYDNUSA-N	0	3	336.545	3.335	20	30		EGEDHN
CN(C)CCN(Cc1ccsc1)C(=O)Nc1ccc(C#N)c(F)c1	ZINC000459583702	458419072	/nfs/dbraw/zinc/41/90/72/458419072.db2.gz	UBJYBUNJHUSIGA-UHFFFAOYSA-N	0	3	346.431	3.355	20	30		EGEDHN
CC(C)CN(CCCOc1cccc(C#N)c1)Cc1cnn(C)c1	ZINC000459591708	458422048	/nfs/dbraw/zinc/42/20/48/458422048.db2.gz	LBPZWJOOVRODNQ-UHFFFAOYSA-N	0	3	326.444	3.219	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCc1cc(Br)cc2c1OCC2	ZINC000449546713	458426349	/nfs/dbraw/zinc/42/63/49/458426349.db2.gz	DMWQDCCJUDOKAD-CABCVRRESA-N	0	3	338.245	3.207	20	30		EGEDHN
CC(C)(CC#N)CNCc1cc(Br)c2c(c1)OCCO2	ZINC000459661226	458439476	/nfs/dbraw/zinc/43/94/76/458439476.db2.gz	AWOHKPVEAIMUCM-UHFFFAOYSA-N	0	3	339.233	3.250	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1S[C@@H]1CC[C@@H](C#N)C1	ZINC000450743783	458456316	/nfs/dbraw/zinc/45/63/16/458456316.db2.gz	JEOUCXGUDXXXAZ-HZPDHXFCSA-N	0	3	345.516	3.277	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC[C@@H]2CCC[C@H](C(F)(F)F)C2)CC1	ZINC000437495856	458457419	/nfs/dbraw/zinc/45/74/19/458457419.db2.gz	XTCHPMQVNOFBCR-KGLIPLIRSA-N	0	3	347.425	3.305	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CCN(c2c(C#N)cccc2C#N)C1	ZINC000450806840	458457669	/nfs/dbraw/zinc/45/76/69/458457669.db2.gz	GAOBFTDZKXOQEX-KRWDZBQOSA-N	0	3	330.435	3.388	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCc1cccc(C(=O)NCc2ccco2)c1	ZINC000451677516	458485546	/nfs/dbraw/zinc/48/55/46/458485546.db2.gz	USZVGAPRQTUUTD-MOPGFXCFSA-N	0	3	340.423	3.033	20	30		EGEDHN
CC1CN(Cc2ccc(C#N)cc2)CCN(Cc2ccc(C#N)cc2)C1	ZINC000451887993	458489580	/nfs/dbraw/zinc/48/95/80/458489580.db2.gz	HZMDCFBVRWFGCT-UHFFFAOYSA-N	0	3	344.462	3.384	20	30		EGEDHN
CCO[C@@H]1CCC[C@H]1N[C@@H](C)C(=O)N(CCC#N)c1ccc(F)cc1	ZINC000452014784	458493319	/nfs/dbraw/zinc/49/33/19/458493319.db2.gz	HRRURRARLLZDPQ-BMGDILEWSA-N	0	3	347.434	3.008	20	30		EGEDHN
C[C@]12CN([C@H]3CCN(c4sccc4C#N)C3=O)C[C@@H]1[C@@H]1CC[C@H]2C1	ZINC000452053075	458494547	/nfs/dbraw/zinc/49/45/47/458494547.db2.gz	NWXIMKKYQQDWCE-MFDZDQDISA-N	0	3	341.480	3.093	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCC[C@@H]2CCc3ccccc32)cc1	ZINC000452314844	458499147	/nfs/dbraw/zinc/49/91/47/458499147.db2.gz	LOKOFPRLBDLRHY-PMACEKPBSA-N	0	3	343.430	3.477	20	30		EGEDHN
CC(C)C[C@@H](CN1CCCC1)NC(=O)C1(c2cccc(C#N)c2)CC1	ZINC000452345689	458499815	/nfs/dbraw/zinc/49/98/15/458499815.db2.gz	RUADCLYAQOFSPW-IBGZPJMESA-N	0	3	339.483	3.217	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CCCc2occc2C1)C(C)C	ZINC000460125255	458501618	/nfs/dbraw/zinc/50/16/18/458501618.db2.gz	PGXHHMZPTFFMSS-GOSISDBHSA-N	0	3	345.487	3.436	20	30		EGEDHN
C=CCC[C@H](CO)N[C@@H](C)c1ccccc1I	ZINC000453346460	458525011	/nfs/dbraw/zinc/52/50/11/458525011.db2.gz	IDSDZBFOXOIPIH-NWDGAFQWSA-N	0	3	345.224	3.269	20	30		EGEDHN
C=CCn1c([C@H](C)CC)nnc1N1CCN([C@@H]2C[C@H]2C)C[C@@H](C)C1	ZINC000453423100	458527125	/nfs/dbraw/zinc/52/71/25/458527125.db2.gz	BKKWNQJBXDBLBJ-QBPKDAKJSA-N	0	3	331.508	3.144	20	30		EGEDHN
CC[C@H](Cc1ccccc1)N(CC)CC(=O)N(CC)C[C@@H](C)C#N	ZINC000468917137	458543515	/nfs/dbraw/zinc/54/35/15/458543515.db2.gz	JFCRRPSBHXFGIS-PKOBYXMFSA-N	0	3	329.488	3.338	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1cccc(COc2cccc(F)c2)c1	ZINC000424099684	458557930	/nfs/dbraw/zinc/55/79/30/458557930.db2.gz	VRAJBAGHVFOMTL-GOSISDBHSA-N	0	3	341.386	3.364	20	30		EGEDHN
Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)[C@H](N)CCCC#N	ZINC000424106653	458559882	/nfs/dbraw/zinc/55/98/82/458559882.db2.gz	SQGYGSCEHPURCX-SWLSCSKDSA-N	0	3	342.468	3.317	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N[C@@H](Cc1ccccc1)c1ccccc1F	ZINC000424116484	458561932	/nfs/dbraw/zinc/56/19/32/458561932.db2.gz	BUAAUEQZJONLFN-OALUTQOASA-N	0	3	339.414	3.247	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N[C@H]1CCOc2c(-c3ccccc3)cccc21	ZINC000424116174	458561972	/nfs/dbraw/zinc/56/19/72/458561972.db2.gz	XAOYFEJFBSLBNV-MOPGFXCFSA-N	0	3	349.434	3.315	20	30		EGEDHN
Cc1cccc(Oc2ccc(NC(=O)[C@@H](N)CCCC#N)cn2)c1C	ZINC000424146061	458569921	/nfs/dbraw/zinc/56/99/21/458569921.db2.gz	OWKGOENBJGATRN-INIZCTEOSA-N	0	3	338.411	3.450	20	30		EGEDHN
CCCCn1ccnc1-c1cccc(NC(=O)[C@@H](N)CCCC#N)c1	ZINC000424146381	458570497	/nfs/dbraw/zinc/57/04/97/458570497.db2.gz	PNFISZCVADMZFJ-KRWDZBQOSA-N	0	3	339.443	3.310	20	30		EGEDHN
CCCNc1ccc(C(F)(F)F)cc1NC(=O)[C@H](N)CCCC#N	ZINC000424148038	458570637	/nfs/dbraw/zinc/57/06/37/458570637.db2.gz	SVRRSZQWCQREGA-GFCCVEGCSA-N	0	3	342.365	3.487	20	30		EGEDHN
C[C@H](CC#N)Sc1ccccc1NC(=O)N1C[C@@H]2CCN(C)[C@@H]2C1	ZINC000454759345	458574091	/nfs/dbraw/zinc/57/40/91/458574091.db2.gz	LKHZDTDAQWNOSI-IJEWVQPXSA-N	0	3	344.484	3.249	20	30		EGEDHN
COc1cc(Oc2ccccc2)ccc1NC(=O)[C@H](N)CCCC#N	ZINC000424174016	458577271	/nfs/dbraw/zinc/57/72/71/458577271.db2.gz	NVWBUWIIOITMDU-MRXNPFEDSA-N	0	3	339.395	3.447	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N1CCc2ccccc2[C@@H]1Cc1ccccc1	ZINC000424172807	458577346	/nfs/dbraw/zinc/57/73/46/458577346.db2.gz	MEXSGWOWULNDQJ-SFTDATJTSA-N	0	3	347.462	3.376	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1cc(Cl)ccc1OCC1CCC1	ZINC000424176500	458577948	/nfs/dbraw/zinc/57/79/48/458577948.db2.gz	SCMWDGFLMYPXKN-CQSZACIVSA-N	0	3	335.835	3.479	20	30		EGEDHN
C=CCOc1ccc(CN[C@H]2CCO[C@@H]2c2c(C)nn(C)c2C)cc1	ZINC000431664586	458603201	/nfs/dbraw/zinc/60/32/01/458603201.db2.gz	LWABHEXPFKXYBD-ICSRJNTNSA-N	0	3	341.455	3.222	20	30		EGEDHN
C=CCN(C)C(=O)Nc1cc(Cl)ccc1OC1CCN(C)CC1	ZINC000455943808	458624270	/nfs/dbraw/zinc/62/42/70/458624270.db2.gz	MBKGKNSBOWRDGV-UHFFFAOYSA-N	0	3	337.851	3.463	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NC(=O)c1ccc(CN(CC)C2CC2)cc1	ZINC000456256154	458634719	/nfs/dbraw/zinc/63/47/19/458634719.db2.gz	CRFMIKUBMMIIEI-MOPGFXCFSA-N	0	3	328.456	3.134	20	30		EGEDHN
CC1(C)[C@H](NCc2cccc(OCc3ccccc3C#N)c2)C[C@@H]1O	ZINC000494429283	458675155	/nfs/dbraw/zinc/67/51/55/458675155.db2.gz	WSKYDZDNULOXAP-UXHICEINSA-N	0	3	336.435	3.386	20	30		EGEDHN
C[C@H](NCC(=O)NCc1cccc(C#N)c1)c1ccc2c(c1)CCCC2	ZINC000546931927	458689048	/nfs/dbraw/zinc/68/90/48/458689048.db2.gz	ZDTKJXQKZSXIBS-INIZCTEOSA-N	0	3	347.462	3.404	20	30		EGEDHN
C#CC[C@H](C)N[C@H](C)c1ccc(CNC(=O)OC(C)(C)C)nc1C	ZINC000494556683	458698125	/nfs/dbraw/zinc/69/81/25/458698125.db2.gz	XXXQRRGMMXQRHN-UONOGXRCSA-N	0	3	331.460	3.477	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CCn2cccc2[C@H]1C)C(C)C	ZINC000503441879	458708765	/nfs/dbraw/zinc/70/87/65/458708765.db2.gz	ZWJXQGFIIAMDLP-IEBWSBKVSA-N	0	3	344.503	3.273	20	30		EGEDHN
C=C(C)COc1cc(CN2C[C@@H](C)[C@](C)(C(=O)OC)C2)ccc1OC	ZINC000504561867	458739303	/nfs/dbraw/zinc/73/93/03/458739303.db2.gz	WEEGESBEQTWOCZ-FOIQADDNSA-N	0	3	347.455	3.281	20	30		EGEDHN
CC[C@](C)(C#N)C(=O)NC[C@H](C(C)C)N1CCc2ccccc2C1	ZINC000505605761	458744707	/nfs/dbraw/zinc/74/47/07/458744707.db2.gz	FCHAUOWLSRVRBD-UYAOXDASSA-N	0	3	327.472	3.125	20	30		EGEDHN
C=C(C)CN(Cc1ccccc1)C(=O)N[C@H]1C[C@@H](C)N(C2CC2)C1	ZINC000472036200	458762574	/nfs/dbraw/zinc/76/25/74/458762574.db2.gz	BWMUJSOHZNGVQJ-AEFFLSMTSA-N	0	3	327.472	3.400	20	30		EGEDHN
C[C@](C#N)(NC(=O)CN1CCC[C@@](C)(c2ccccc2)CC1)C1CC1	ZINC000510123222	458775009	/nfs/dbraw/zinc/77/50/09/458775009.db2.gz	HRYMETNRSXRXFH-NHCUHLMSSA-N	0	3	339.483	3.239	20	30		EGEDHN
Cc1cccc2c1CC[C@H]2NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000547768165	458788342	/nfs/dbraw/zinc/78/83/42/458788342.db2.gz	REGQKPFNJFSFET-YLJYHZDGSA-N	0	3	329.403	3.353	20	30		EGEDHN
CCN(Cc1ccccc1)C(=O)[C@H](C)N1CCC(CCC#N)CC1	ZINC000514670518	458800399	/nfs/dbraw/zinc/80/03/99/458800399.db2.gz	VZZZULRQFSHGOE-KRWDZBQOSA-N	0	3	327.472	3.439	20	30		EGEDHN
Cc1cccc([C@H](C)NC[C@H](O)COc2ccc(CC#N)cc2)c1C	ZINC000515319728	458807550	/nfs/dbraw/zinc/80/75/50/458807550.db2.gz	RNJGRSCGMIMKOD-HKUYNNGSSA-N	0	3	338.451	3.460	20	30		EGEDHN
CC1(C(=O)N2CCC(CC#N)CC2)CCN(Cc2ccccc2)CC1	ZINC000547860647	458808510	/nfs/dbraw/zinc/80/85/10/458808510.db2.gz	ZFYSCDOSFBOWEU-UHFFFAOYSA-N	0	3	339.483	3.441	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN[C@@H]1CC[C@H](c2ccccc2)C[C@H]1OC	ZINC000515443353	458809690	/nfs/dbraw/zinc/80/96/90/458809690.db2.gz	HWYIECIIUBWJJF-XUVXKRRUSA-N	0	3	344.499	3.352	20	30		EGEDHN
CC(C)(C)OC(=O)NCC1CCN(Cc2ccc(CC#N)cc2)CC1	ZINC000495291305	458828016	/nfs/dbraw/zinc/82/80/16/458828016.db2.gz	GWSKHGVHJMXGGY-UHFFFAOYSA-N	0	3	343.471	3.489	20	30		EGEDHN
C[C@H]1CN(Cc2ccc(CC#N)cc2)CC[C@H]1NC(=O)OC(C)(C)C	ZINC000495291315	458828148	/nfs/dbraw/zinc/82/81/48/458828148.db2.gz	HAILJXFLJRQMGY-MAUKXSAKSA-N	0	3	343.471	3.488	20	30		EGEDHN
COc1cc(CNc2cccc(OCCN(C)C)c2)ccc1C#N	ZINC000440632179	458834694	/nfs/dbraw/zinc/83/46/94/458834694.db2.gz	BRIBYPLHWRFIGC-UHFFFAOYSA-N	0	3	325.412	3.119	20	30		EGEDHN
CC(C)N1CC[C@H](N(C)C(=O)C(C)(C)Cc2ccc(C#N)cc2)C1	ZINC000457094672	458864442	/nfs/dbraw/zinc/86/44/42/458864442.db2.gz	PCXFABGXJNGKFW-SFHVURJKSA-N	0	3	327.472	3.068	20	30		EGEDHN
C=CCn1c(C2CCCC2)nnc1N1CC[C@H](N2CCCCC2)C1	ZINC000548837737	458874583	/nfs/dbraw/zinc/87/45/83/458874583.db2.gz	BFWCHGLCGZIHEH-KRWDZBQOSA-N	0	3	329.492	3.186	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)cn1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000495777055	458949854	/nfs/dbraw/zinc/94/98/54/458949854.db2.gz	YHDSFINPWAJCIT-ZBFHGGJFSA-N	0	3	344.459	3.078	20	30		EGEDHN
CN(C[C@@H](O)CNc1ccc(Oc2ccc(C#N)cc2)cc1)C1CC1	ZINC000577098828	458979641	/nfs/dbraw/zinc/97/96/41/458979641.db2.gz	JXTOOWVPSGMEFV-SFHVURJKSA-N	0	3	337.423	3.218	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1	ZINC000467842089	458989620	/nfs/dbraw/zinc/98/96/20/458989620.db2.gz	PNKVTJOYGDUFRT-CTNGQTDRSA-N	0	3	344.499	3.477	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CC[C@@H](C(F)(F)F)C2(C)C)CC1	ZINC000468332941	459015057	/nfs/dbraw/zinc/01/50/57/459015057.db2.gz	UVXIKMLIQVLYBL-CQSZACIVSA-N	0	3	347.425	3.399	20	30		EGEDHN
C[C@@H](NC(=O)N1CCCN(C(C)(C)C)CC1)c1ccc(C#N)cc1	ZINC000519922019	459023433	/nfs/dbraw/zinc/02/34/33/459023433.db2.gz	WRZKQODSBRELNJ-OAHLLOKOSA-N	0	3	328.460	3.135	20	30		EGEDHN
C=CCc1ccc(OC[C@@H](O)CN2CCC(CC)CC2)c(OC)c1	ZINC000520272898	459046139	/nfs/dbraw/zinc/04/61/39/459046139.db2.gz	PDYPSFNTZOYHSS-SFHVURJKSA-N	0	3	333.472	3.285	20	30		EGEDHN
CN1CCC[C@@H](CNC(=O)NCC2(C#N)CCC2)[C@@H]1c1cccs1	ZINC000567097456	459046950	/nfs/dbraw/zinc/04/69/50/459046950.db2.gz	ILXGOIZBMRMIHZ-GOEBONIOSA-N	0	3	346.500	3.124	20	30		EGEDHN
N#C[C@H]1CC[C@@H](NCCOc2ncc(C(F)(F)F)cc2Cl)C1	ZINC000442879401	459050517	/nfs/dbraw/zinc/05/05/17/459050517.db2.gz	VRIGPDBWVAZYFS-GXSJLCMTSA-N	0	3	333.741	3.414	20	30		EGEDHN
COCCN(C(=O)OC(C)(C)C)C1CCN([C@H](C)CCC#N)CC1	ZINC000496055222	459050986	/nfs/dbraw/zinc/05/09/86/459050986.db2.gz	FMTJCFSWEUSCPQ-OAHLLOKOSA-N	0	3	339.480	3.027	20	30		EGEDHN
COc1cc(CN2CCN(C3CCC(C)CC3)CC2)ccc1C#N	ZINC000442885794	459053116	/nfs/dbraw/zinc/05/31/16/459053116.db2.gz	OLPSZRPHQKJIIC-UHFFFAOYSA-N	0	3	327.472	3.263	20	30		EGEDHN
Cc1ccccc1[C@H]([C@H](C)NC(=O)NCC#Cc1ccccc1)N(C)C	ZINC000477831800	459062212	/nfs/dbraw/zinc/06/22/12/459062212.db2.gz	WSWPYOJVETUFTO-RXVVDRJESA-N	0	3	349.478	3.337	20	30		EGEDHN
C[C@H]1CN(C(=O)Nc2cccc(CC#N)c2)CCN(C2CCC2)C1	ZINC000567229310	459069782	/nfs/dbraw/zinc/06/97/82/459069782.db2.gz	WUVOUZYYUWNITO-OAHLLOKOSA-N	0	3	326.444	3.091	20	30		EGEDHN
CC(C)CN(CCc1ccccc1)CC(=O)NCc1ccc(C#N)cc1	ZINC000557512739	459079232	/nfs/dbraw/zinc/07/92/32/459079232.db2.gz	ONWLBTBECUTCCU-UHFFFAOYSA-N	0	3	349.478	3.375	20	30		EGEDHN
CSc1nnc(CCCNC[C@H](C#N)CCC#N)n1C1CCCC1	ZINC000577722694	459081537	/nfs/dbraw/zinc/08/15/37/459081537.db2.gz	WYGSNTCQAIOELU-AWEZNQCLSA-N	0	3	346.504	3.081	20	30		EGEDHN
CN1CCN(c2c(C#N)cnc3ccccc32)C[C@H]1Cc1ccccc1	ZINC000557726631	459103179	/nfs/dbraw/zinc/10/31/79/459103179.db2.gz	RKTAEECIBLABBK-LJQANCHMSA-N	0	3	342.446	3.470	20	30		EGEDHN
C#CC[C@@H](CC(F)(F)F)N[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000496208301	459108635	/nfs/dbraw/zinc/10/86/35/459108635.db2.gz	URIAGXPQSCVTSI-STQMWFEESA-N	0	3	334.382	3.320	20	30		EGEDHN
C=C(C)[C@H](NC(=O)NCCN1CCCCC1)c1ccc(F)c(F)c1	ZINC000478831938	459111432	/nfs/dbraw/zinc/11/14/32/459111432.db2.gz	CPZQCQMUJMUXHB-KRWDZBQOSA-N	0	3	337.414	3.367	20	30		EGEDHN
CC[C@@H](C)N[C@@H](CNC(=O)N1CCC(CC#N)CC1)c1ccco1	ZINC000557832057	459112619	/nfs/dbraw/zinc/11/26/19/459112619.db2.gz	PFZPGQNTQOHUEH-ZBFHGGJFSA-N	0	3	332.448	3.044	20	30		EGEDHN
C=CCOc1ccc(CNC[C@@H](CO)Cc2ccco2)cc1Cl	ZINC000532675983	459127028	/nfs/dbraw/zinc/12/70/28/459127028.db2.gz	UGDMFMPSTWPGAN-HNNXBMFYSA-N	0	3	335.831	3.439	20	30		EGEDHN
CCN(CC)C(=O)[C@H](NCCc1ccc(C#N)cc1)c1ccccc1	ZINC000594708555	459136443	/nfs/dbraw/zinc/13/64/43/459136443.db2.gz	AXHZWIFWYHVNNV-HXUWFJFHSA-N	0	3	335.451	3.300	20	30		EGEDHN
C=CCNC(=O)CN[C@@H]1CC(C)(C)c2ccc(Br)cc21	ZINC000479414709	459139214	/nfs/dbraw/zinc/13/92/14/459139214.db2.gz	FVMOTFYEAZNLKN-CQSZACIVSA-N	0	3	337.261	3.063	20	30		EGEDHN
Cc1ccc2oc(CNC[C@H](O)COc3ccc(C#N)cc3)cc2c1	ZINC000594733625	459143838	/nfs/dbraw/zinc/14/38/38/459143838.db2.gz	ZYLLBUDZFRVACB-KRWDZBQOSA-N	0	3	336.391	3.142	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCCCOc2c(C)cccc2C)CC1	ZINC000521595282	459163742	/nfs/dbraw/zinc/16/37/42/459163742.db2.gz	BMNKGJREGNLWNV-UHFFFAOYSA-N	0	3	345.487	3.022	20	30		EGEDHN
Cc1ncccc1NC(=O)[C@H](C)N[C@@H]1CCCc2cc(C#N)ccc21	ZINC000590780411	459214962	/nfs/dbraw/zinc/21/49/62/459214962.db2.gz	SBRNVTFTPLCMKU-IFXJQAMLSA-N	0	3	334.423	3.256	20	30		EGEDHN
Cc1ncccc1NC(=O)[C@H](C)N[C@H]1CCCc2cc(C#N)ccc21	ZINC000590780413	459215257	/nfs/dbraw/zinc/21/52/57/459215257.db2.gz	SBRNVTFTPLCMKU-LIRRHRJNSA-N	0	3	334.423	3.256	20	30		EGEDHN
CN(CC(=O)NCC#Cc1cccc(C(F)(F)F)c1)CC(C)(C)C	ZINC000533415811	459232430	/nfs/dbraw/zinc/23/24/30/459232430.db2.gz	TXYCEXKSGVYSBO-UHFFFAOYSA-N	0	3	340.389	3.151	20	30		EGEDHN
CC[C@H](NCC1(S(C)(=O)=O)CCCCC1)c1ccc(C#N)cc1	ZINC000595077858	459238760	/nfs/dbraw/zinc/23/87/60/459238760.db2.gz	QRMATUCHIOOWSH-KRWDZBQOSA-N	0	3	334.485	3.346	20	30		EGEDHN
N#CCC[C@@H](C#N)CNc1ccc(CCN2CCSCC2)cc1	ZINC000579337697	459245308	/nfs/dbraw/zinc/24/53/08/459245308.db2.gz	VABIMRUHKPLVNY-KRWDZBQOSA-N	0	3	328.485	3.133	20	30		EGEDHN
CN(Cc1ccccc1)[C@H]1CCN(C(=O)Nc2cccc(CC#N)c2)C1	ZINC000590854883	459246823	/nfs/dbraw/zinc/24/68/23/459246823.db2.gz	QNJDQKHJPCYLHL-FQEVSTJZSA-N	0	3	348.450	3.491	20	30		EGEDHN
C[C@@H](COc1cccc(F)c1)NC(=O)C(C#N)CCc1ccccc1	ZINC000559279082	459247523	/nfs/dbraw/zinc/24/75/23/459247523.db2.gz	OOJWUUSPCSYEGN-RDJZCZTQSA-N	0	3	340.398	3.482	20	30		EGEDHN
C[C@H](COc1cccc(F)c1)NC(=O)C(C#N)CCc1ccccc1	ZINC000559279080	459248163	/nfs/dbraw/zinc/24/81/63/459248163.db2.gz	OOJWUUSPCSYEGN-NVXWUHKLSA-N	0	3	340.398	3.482	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1CCC[C@@H](c2ccc(F)cc2)CC1	ZINC000481426104	459254156	/nfs/dbraw/zinc/25/41/56/459254156.db2.gz	MTUDJPZAXAHPBR-IAGOWNOFSA-N	0	3	345.462	3.403	20	30		EGEDHN
CC(C)C[C@](C)(C#N)NC(=O)[C@@H]1CN(C(C)(C)C)C[C@H]1C(F)(F)F	ZINC000559369930	459256761	/nfs/dbraw/zinc/25/67/61/459256761.db2.gz	JXJNGMWSURVXNZ-XJKCOSOUSA-N	0	3	347.425	3.340	20	30		EGEDHN
CN(CC#Cc1ccc(OC(F)(F)F)cc1)C[C@H]1CCCC[C@H]1O	ZINC000481546530	459260655	/nfs/dbraw/zinc/26/06/55/459260655.db2.gz	TXADXUQKVUBOIL-NVXWUHKLSA-N	0	3	341.373	3.420	20	30		EGEDHN
CC(C)(CC#N)CNC(=O)N[C@@H](CN1CCCCC1)c1ccccc1	ZINC000590925572	459269544	/nfs/dbraw/zinc/26/95/44/459269544.db2.gz	HAODDQPTTOKUEJ-SFHVURJKSA-N	0	3	342.487	3.453	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)[C@]2(C#N)CC23CCCC3)CN1Cc1ccccc1	ZINC000581648028	459276393	/nfs/dbraw/zinc/27/63/93/459276393.db2.gz	PPHSBQBRSUVFFE-HGHGUNKESA-N	0	3	337.467	3.240	20	30		EGEDHN
N#Cc1ccc(CCN[C@@H](CN2CCCC2=O)c2ccccc2)cc1	ZINC000595412457	459292964	/nfs/dbraw/zinc/29/29/64/459292964.db2.gz	ZXABMVPWSMPMCU-FQEVSTJZSA-N	0	3	333.435	3.054	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)N1CCC[C@H](CC#N)C1)c1ccsc1	ZINC000595451284	459307389	/nfs/dbraw/zinc/30/73/89/459307389.db2.gz	ZONIRJCMMCCDON-WBVHZDCISA-N	0	3	348.516	3.466	20	30		EGEDHN
Cc1cc(C)cc(OC[C@H](O)CNC2(c3cccc(C#N)c3)CC2)c1	ZINC000560174672	459309761	/nfs/dbraw/zinc/30/97/61/459309761.db2.gz	MORYPNOUSJSRFG-LJQANCHMSA-N	0	3	336.435	3.194	20	30		EGEDHN
C[C@@H](NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1)c1ccc(C#N)cc1	ZINC000523668627	459321737	/nfs/dbraw/zinc/32/17/37/459321737.db2.gz	YAJKDGZRPWDASE-OXQOHEQNSA-N	0	3	348.450	3.043	20	30		EGEDHN
N#CCC[C@@H](C#N)CNC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000560454998	459349042	/nfs/dbraw/zinc/34/90/42/459349042.db2.gz	LBLWXVAIKAKNCF-INIZCTEOSA-N	0	3	330.863	3.338	20	30		EGEDHN
C[C@@H]1[C@@H](Cc2ccccc2)CCN1Cc1cnc2c(C#N)cnn2c1	ZINC000582360835	459353156	/nfs/dbraw/zinc/35/31/56/459353156.db2.gz	UESYWFOCKXYBIX-CRAIPNDOSA-N	0	3	331.423	3.054	20	30		EGEDHN
CC[C@@H](C)N(CC)CC(=O)Nc1c(C#N)c(C)c(C)n1CCCOC	ZINC000595592911	459358340	/nfs/dbraw/zinc/35/83/40/459358340.db2.gz	KDMIRCRAJKNZCW-CQSZACIVSA-N	0	3	348.491	3.072	20	30		EGEDHN
N#CC[C@@H]1CCCN(C(=O)NCCN2CCC3(CCCCC3)CC2)C1	ZINC000595605539	459362278	/nfs/dbraw/zinc/36/22/78/459362278.db2.gz	BQXFRARXBUAMDV-SFHVURJKSA-N	0	3	346.519	3.368	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@H](N[C@@H]1CCN(C(=O)Nc3ccccc3)C1)CC2	ZINC000582479429	459371114	/nfs/dbraw/zinc/37/11/14/459371114.db2.gz	WNPHQKRLSHDISB-UYAOXDASSA-N	0	3	346.434	3.442	20	30		EGEDHN
CN1CC[C@@H]2CCN(C(=O)c3ccc(C#Cc4ccccc4)cc3)[C@H]2C1	ZINC000538713897	459373206	/nfs/dbraw/zinc/37/32/06/459373206.db2.gz	BWLQKXPUERVWCF-IRLDBZIGSA-N	0	3	344.458	3.253	20	30		EGEDHN
N#Cc1cnn2c1NC[C@H](CN1CCC[C@@H]1c1cccc(Cl)c1)C2	ZINC000569104840	459396214	/nfs/dbraw/zinc/39/62/14/459396214.db2.gz	ZVHMHXTXNNOMLV-CXAGYDPISA-N	0	3	341.846	3.287	20	30		EGEDHN
COc1cc(CN[C@@H]2CCC[C@H]2NC(=O)OC(C)(C)C)ccc1C#N	ZINC000497025388	459409971	/nfs/dbraw/zinc/40/99/71/459409971.db2.gz	KOLFBMGEQVVWOA-HZPDHXFCSA-N	0	3	345.443	3.102	20	30		EGEDHN
OC[C@H](NCC#Cc1ccc(OC(F)(F)F)cc1)C1CCCCC1	ZINC000541050780	459421936	/nfs/dbraw/zinc/42/19/36/459421936.db2.gz	BSDXMPIVSNDBGA-KRWDZBQOSA-N	0	3	341.373	3.468	20	30		EGEDHN
CC(C)C[C@@H](NC[C@H](O)CN(C)CCC#N)c1ccc(Cl)cc1	ZINC000591742313	459428063	/nfs/dbraw/zinc/42/80/63/459428063.db2.gz	JHGCCPCMYKHWIC-ZWKOTPCHSA-N	0	3	337.895	3.223	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@H]1[C@@H]1CCCCC1=Nn1cnnc1	ZINC000497080936	459430804	/nfs/dbraw/zinc/43/08/04/459430804.db2.gz	UXVSYSLNLDBBBR-HIFRSBDPSA-N	0	3	333.436	3.072	20	30		EGEDHN
Cc1cc(C)cc(OC[C@H](O)CN[C@@H]2CCc3cc(C#N)ccc32)c1	ZINC000591764164	459431069	/nfs/dbraw/zinc/43/10/69/459431069.db2.gz	UWELXUWIHNITFU-WIYYLYMNSA-N	0	3	336.435	3.192	20	30		EGEDHN
N#Cc1ccc2c(c1)CC[C@H]2NC[C@@H](O)COc1cccc2[nH]ccc21	ZINC000591764358	459431690	/nfs/dbraw/zinc/43/16/90/459431690.db2.gz	HBJGSKASJKZYJX-OXQOHEQNSA-N	0	3	347.418	3.056	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1CCC([C@H]2CCCCO2)CC1	ZINC000595790257	459442264	/nfs/dbraw/zinc/44/22/64/459442264.db2.gz	VLRINGWUYNNEPO-GOSISDBHSA-N	0	3	344.455	3.227	20	30		EGEDHN
C[C@@H](CN[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O)c1ccccc1	ZINC000485270917	459447397	/nfs/dbraw/zinc/44/73/97/459447397.db2.gz	JGADGJLFNMBKHG-OXJNMPFZSA-N	0	3	333.435	3.447	20	30		EGEDHN
CN(C(=O)CN1CC[C@@H](Cc2ccccc2)C1)C1(C#N)CCCCC1	ZINC000525640018	459470795	/nfs/dbraw/zinc/47/07/95/459470795.db2.gz	LXJQDXYHVQWMJS-IBGZPJMESA-N	0	3	339.483	3.236	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@@H](NCc2ccc(CC#N)cc2)C1	ZINC000497203927	459484471	/nfs/dbraw/zinc/48/44/71/459484471.db2.gz	PQBBIMGCQMDSKD-QGZVFWFLSA-N	0	3	329.444	3.242	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN2CCC[C@@H](c3ccncc3)C2)c1	ZINC000583125157	459486415	/nfs/dbraw/zinc/48/64/15/459486415.db2.gz	OPVKSUKNPDGXMD-GOSISDBHSA-N	0	3	334.423	3.161	20	30		EGEDHN
C[C@H](N[C@@H]1CCO[C@@H](c2ccnn2C)C1)c1ccc(C#N)cc1F	ZINC000583363930	459526279	/nfs/dbraw/zinc/52/62/79/459526279.db2.gz	PUNCTZCVERWBIA-WPKBUWHJSA-N	0	3	328.391	3.002	20	30		EGEDHN
COCCN(CC(=O)N(CCC#N)c1ccccc1)[C@H]1CCC[C@@H]1C	ZINC000487962083	459536548	/nfs/dbraw/zinc/53/65/48/459536548.db2.gz	OJYYKFMBHVQHSM-HKUYNNGSSA-N	0	3	343.471	3.070	20	30		EGEDHN
COCCN(CC(=O)N(CCC#N)c1ccccc1)[C@H]1CCC[C@H]1C	ZINC000487962085	459536995	/nfs/dbraw/zinc/53/69/95/459536995.db2.gz	OJYYKFMBHVQHSM-MJGOQNOKSA-N	0	3	343.471	3.070	20	30		EGEDHN
Cc1nc(Nc2ccc(CCN3CCSCC3)cc2)ccc1C#N	ZINC000488065054	459538155	/nfs/dbraw/zinc/53/81/55/459538155.db2.gz	BAQDNAXLXSJIPF-UHFFFAOYSA-N	0	3	338.480	3.019	20	30		EGEDHN
Cc1cc(CN2CCC(C(=O)Nc3ccc(O)cc3)CC2)ccc1C#N	ZINC000488202796	459541327	/nfs/dbraw/zinc/54/13/27/459541327.db2.gz	OVRDHCUKQVSFFT-UHFFFAOYSA-N	0	3	349.434	3.423	20	30		EGEDHN
C[C@H]1OCC[C@]1(O)CN(Cc1ccc(C#N)s1)Cc1ccccc1	ZINC000583468227	459542533	/nfs/dbraw/zinc/54/25/33/459542533.db2.gz	METDQSRMTBXEGD-BEFAXECRSA-N	0	3	342.464	3.162	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN(C)CCc1ccccc1O	ZINC000542321758	459547186	/nfs/dbraw/zinc/54/71/86/459547186.db2.gz	MKKPSIHWRIOSAQ-IBGZPJMESA-N	0	3	341.451	3.035	20	30		EGEDHN
C=C(C)CNC(=O)N1CC[C@@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000488567215	459547459	/nfs/dbraw/zinc/54/74/59/459547459.db2.gz	PLOFHEDPDIZQEX-FQEVSTJZSA-N	0	3	327.472	3.260	20	30		EGEDHN
CC(C)c1ccc(OC2CCN(C(=O)[C@H](N)CCCC#N)CC2)cc1	ZINC000570508386	459556539	/nfs/dbraw/zinc/55/65/39/459556539.db2.gz	OYTXNMKVKUUTPO-LJQANCHMSA-N	0	3	343.471	3.201	20	30		EGEDHN
N#CCc1ccc(OC[C@H](O)CN[C@@H]2CCCc3sccc32)cc1	ZINC000583689419	459582099	/nfs/dbraw/zinc/58/20/99/459582099.db2.gz	QBFMGDXVDYEBLR-CRAIPNDOSA-N	0	3	342.464	3.221	20	30		EGEDHN
N#Cc1nc(N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)sc1Cl	ZINC000596281189	459583001	/nfs/dbraw/zinc/58/30/01/459583001.db2.gz	OKENXVUEBYEEJL-DZGCQCFKSA-N	0	3	344.871	3.379	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccccc2-c2csc(C)n2)CC1	ZINC000490741890	459585827	/nfs/dbraw/zinc/58/58/27/459585827.db2.gz	XGPGNURBGIEHPD-UHFFFAOYSA-N	0	3	339.464	3.402	20	30		EGEDHN
C[C@@H]1C[C@@H]1c1ccc(CNC(=O)C(C#N)Cc2ccc(C#N)cc2)o1	ZINC000527159612	459599949	/nfs/dbraw/zinc/59/99/49/459599949.db2.gz	LYCNCJJLJMDDHK-QBIMZIAESA-N	0	3	333.391	3.273	20	30		EGEDHN
C#C[C@H](N[C@@H](C)C1CN(C(=O)OC(C)(C)C)C1)c1ccc(F)cc1	ZINC000491181829	459603549	/nfs/dbraw/zinc/60/35/49/459603549.db2.gz	WDXZTZYPQBOAJD-GUYCJALGSA-N	0	3	332.419	3.345	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)[C@@]2(C#N)CC23CCCC3)N(C)C)cc1	ZINC000573069585	459619756	/nfs/dbraw/zinc/61/97/56/459619756.db2.gz	ORFADVKFGAAKRR-RXVVDRJESA-N	0	3	339.483	3.442	20	30		EGEDHN
C=CCN(CCc1ccco1)C[C@H](O)COc1ccc(C)cc1C	ZINC000491424978	459626480	/nfs/dbraw/zinc/62/64/80/459626480.db2.gz	YFKNJDHWEKJZRF-SFHVURJKSA-N	0	3	329.440	3.367	20	30		EGEDHN
CC(C)N(C(=O)c1cccc(C#N)n1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000592694822	459668593	/nfs/dbraw/zinc/66/85/93/459668593.db2.gz	NYVPJHIHFMEQHO-LJQANCHMSA-N	0	3	348.450	3.078	20	30		EGEDHN
CC(C)CN(C(=O)/C=C\c1ccc(C#N)cc1)C1CCN(C)CC1	ZINC000491839118	459681832	/nfs/dbraw/zinc/68/18/32/459681832.db2.gz	QRDDKTJNCWCTRE-HJWRWDBZSA-N	0	3	325.456	3.150	20	30		EGEDHN
C=CCCSCCNC(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C	ZINC000596596979	459691418	/nfs/dbraw/zinc/69/14/18/459691418.db2.gz	HRIZZVWVXIRODI-NVXWUHKLSA-N	0	3	335.517	3.286	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)NC[C@H](C)C#N)N(CC)CC)cc1	ZINC000563032341	459701127	/nfs/dbraw/zinc/70/11/27/459701127.db2.gz	WDPKOPLQRWRBTF-QAPCUYQASA-N	0	3	330.476	3.091	20	30		EGEDHN
CC[C@H](C)CCNC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000596726420	459742236	/nfs/dbraw/zinc/74/22/36/459742236.db2.gz	CJBFROZLHQCINX-INIZCTEOSA-N	0	3	330.476	3.068	20	30		EGEDHN
CCn1cc(CN(CCC(=O)Nc2ccc(C#N)cc2)C(C)C)cn1	ZINC000593079740	459766997	/nfs/dbraw/zinc/76/69/97/459766997.db2.gz	KFSIMRLDVXWREF-UHFFFAOYSA-N	0	3	339.443	3.014	20	30		EGEDHN
CN(C(=O)C(C[C@@H]1CCCO1)C(F)(F)F)c1ccccc1C#N	ZINC000593095906	459771754	/nfs/dbraw/zinc/77/17/54/459771754.db2.gz	IUSOWFMTQMAIRR-STQMWFEESA-N	0	3	326.318	3.269	20	30		EGEDHN
COc1cc(C#N)ccc1NC(=O)C(C[C@@H]1CCCO1)C(F)(F)F	ZINC000593129320	459782795	/nfs/dbraw/zinc/78/27/95/459782795.db2.gz	UOFITIAXVAXRAE-RYUDHWBXSA-N	0	3	342.317	3.253	20	30		EGEDHN
N#CC(C(=O)NC1CCCCC1)C(=O)[C@H]1Cc2c1cccc2Cl	ZINC000528919611	459817714	/nfs/dbraw/zinc/81/77/14/459817714.db2.gz	MHUQRNJIIVJUCC-GJZGRUSLSA-N	0	3	330.815	3.137	20	30		EGEDHN
CN(CC(=O)N1CC=C(c2ccc(C#N)cc2)CC1)CC(C)(C)C	ZINC000602132782	459851568	/nfs/dbraw/zinc/85/15/68/459851568.db2.gz	JDTAHBOPJRCHPH-UHFFFAOYSA-N	0	3	325.456	3.152	20	30		EGEDHN
Cn1cc([C@H]2N(C(=O)C(C#N)CCc3ccccc3)CC2(C)C)cn1	ZINC000574762972	459868495	/nfs/dbraw/zinc/86/84/95/459868495.db2.gz	CBPHGKVWJZHFJY-FUHWJXTLSA-N	0	3	336.439	3.102	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N1CCC(SC)CC1)C(C)C	ZINC000602234039	459874450	/nfs/dbraw/zinc/87/44/50/459874450.db2.gz	LUXIPQNDDHEHND-KRWDZBQOSA-N	0	3	339.549	3.222	20	30		EGEDHN
C[C@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccccc1-n1ccnn1	ZINC000586793828	459875462	/nfs/dbraw/zinc/87/54/62/459875462.db2.gz	CNRVHXLETHYSEV-LIRRHRJNSA-N	0	3	329.407	3.477	20	30		EGEDHN
CC[C@H](C#N)C(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1	ZINC000593427376	459886145	/nfs/dbraw/zinc/88/61/45/459886145.db2.gz	UXRMMSFRLSLXJZ-CQSZACIVSA-N	0	3	341.377	3.145	20	30		EGEDHN
N#Cc1cccc(CN2CCCN(CCCc3ccccc3)CC2)n1	ZINC000602427346	459933850	/nfs/dbraw/zinc/93/38/50/459933850.db2.gz	FJQJYRMKGUXYEQ-UHFFFAOYSA-N	0	3	334.467	3.094	20	30		EGEDHN
Cc1nc(CNC2CCN(Cc3cccc(C#N)c3)CC2)cs1	ZINC000593688291	459950613	/nfs/dbraw/zinc/95/06/13/459950613.db2.gz	OLSFJVSCATVBTC-UHFFFAOYSA-N	0	3	326.469	3.077	20	30		EGEDHN
COCc1ccc(CNC2CCN(Cc3cccc(C#N)c3)CC2)o1	ZINC000593693105	459954396	/nfs/dbraw/zinc/95/43/96/459954396.db2.gz	PFONQWHAVAXYIX-UHFFFAOYSA-N	0	3	339.439	3.052	20	30		EGEDHN
CC(C)C1CCC(N2CCN(C[C@@H](O)CC(C)(C)C#N)CC2)CC1	ZINC000598593092	459955123	/nfs/dbraw/zinc/95/51/23/459955123.db2.gz	PNTSTSMAZPTZIP-ACBHZAAOSA-N	0	3	335.536	3.120	20	30		EGEDHN
CCCN(CCN1CCCC1)C(=O)NCc1ccc(C#N)c(Cl)c1	ZINC000588672556	459964381	/nfs/dbraw/zinc/96/43/81/459964381.db2.gz	KDWVBPUUKHKSGF-UHFFFAOYSA-N	0	3	348.878	3.229	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN1CCC(c2noc3cc(F)ccc32)CC1	ZINC000598616274	459965571	/nfs/dbraw/zinc/96/55/71/459965571.db2.gz	LMBVIOMWNCUKHB-HNNXBMFYSA-N	0	3	345.418	3.447	20	30		EGEDHN
Cc1ccc(CN2CCSCC2)cc1NCc1cccc(C#N)n1	ZINC000602490389	459966490	/nfs/dbraw/zinc/96/64/90/459966490.db2.gz	IFUAZPGQAMMPMO-UHFFFAOYSA-N	0	3	338.480	3.423	20	30		EGEDHN
COC(=O)c1cc(CN[C@@H](C)c2cccc(C#N)c2)n2c1CCCC2	ZINC000598632773	459970443	/nfs/dbraw/zinc/97/04/43/459970443.db2.gz	ATDXTZMAZVFJTJ-AWEZNQCLSA-N	0	3	337.423	3.333	20	30		EGEDHN
COc1ccc2c(c1)OCC[C@H]2N[C@H](C)CC1(C#N)CCOCC1	ZINC000602557937	459995468	/nfs/dbraw/zinc/99/54/68/459995468.db2.gz	MOBBQHJBZRWDNL-RHSMWYFYSA-N	0	3	330.428	3.207	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CNCc1cccc(OCC(F)(F)F)c1	ZINC000598715006	460003081	/nfs/dbraw/zinc/00/30/81/460003081.db2.gz	LNHXBKOBKMXWJQ-CYBMUJFWSA-N	0	3	330.350	3.018	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CNCc1cccnc1Oc1cccc(F)c1	ZINC000598713452	460003680	/nfs/dbraw/zinc/00/36/80/460003680.db2.gz	CDSZDHKQMMDSEV-INIZCTEOSA-N	0	3	343.402	3.403	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)NCc1cccc(Oc2ccccc2F)c1	ZINC000593912970	460015941	/nfs/dbraw/zinc/01/59/41/460015941.db2.gz	VEDGKSYYAVTWIL-QGZVFWFLSA-N	0	3	341.386	3.255	20	30		EGEDHN
CCN(C[C@H]1CCCN1CC)C(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000576063622	460062348	/nfs/dbraw/zinc/06/23/48/460062348.db2.gz	PVMSSBWZQBVGTB-GOSISDBHSA-N	0	3	327.472	3.434	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1CCC[C@H]1c1ccc(O)cc1	ZINC000610132862	460068442	/nfs/dbraw/zinc/06/84/42/460068442.db2.gz	TURXPSAKVFJRMQ-SFHVURJKSA-N	0	3	338.407	3.488	20	30		EGEDHN
CC1CCN([C@H](CNC(=O)c2cccc(C#N)n2)c2ccccc2)CC1	ZINC000589329997	460074639	/nfs/dbraw/zinc/07/46/39/460074639.db2.gz	IDOXSRPXHSNFGP-HXUWFJFHSA-N	0	3	348.450	3.156	20	30		EGEDHN
CC1(C(=O)N2CCC[C@](C)(C#N)C2)CCN(Cc2ccccc2)CC1	ZINC000614276880	460079236	/nfs/dbraw/zinc/07/92/36/460079236.db2.gz	UJWHFDSTUVAMAE-HXUWFJFHSA-N	0	3	339.483	3.441	20	30		EGEDHN
CN(C)c1cccc(CN2CCCN(c3ccccc3C#N)CC2)c1	ZINC000610211583	460083966	/nfs/dbraw/zinc/08/39/66/460083966.db2.gz	OFQDCSHMXWZIPE-UHFFFAOYSA-N	0	3	334.467	3.337	20	30		EGEDHN
COc1ccc([C@H](CN2CCCC2)NC(=O)CCCCCC#N)cc1	ZINC000589844221	460148661	/nfs/dbraw/zinc/14/86/61/460148661.db2.gz	PSPCWAFOYQVBLO-IBGZPJMESA-N	0	3	343.471	3.422	20	30		EGEDHN
C[C@@H](NCC[C@@H](O)COCc1ccccc1)c1ccc(C#N)cc1F	ZINC000599091126	460157405	/nfs/dbraw/zinc/15/74/05/460157405.db2.gz	XWFHEKZRFHHLFL-CRAIPNDOSA-N	0	3	342.414	3.316	20	30		EGEDHN
N#CCC[C@H](NC(=O)N[C@H]1CCCN2CCCC[C@@H]12)c1ccccc1	ZINC000594228765	460160834	/nfs/dbraw/zinc/16/08/34/460160834.db2.gz	DLOHKPYUZQWOAW-FHWLQOOXSA-N	0	3	340.471	3.348	20	30		EGEDHN
C[C@@H](CN1CCCCC1)Nc1c(C#N)cnc2c(F)ccc(F)c21	ZINC000610514814	460171758	/nfs/dbraw/zinc/17/17/58/460171758.db2.gz	YIRZZHYWEKVADL-LBPRGKRZSA-N	0	3	330.382	3.093	20	30		EGEDHN
CN(C)[C@@H](CNC(=O)N[C@H]1CCc2cc(C#N)ccc21)c1ccccc1	ZINC000618795248	460178314	/nfs/dbraw/zinc/17/83/14/460178314.db2.gz	LRVUBWRMIXSTTR-PMACEKPBSA-N	0	3	348.450	3.148	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)C(=O)N1CCC[C@H]1CN1CCCCC1	ZINC000594277809	460178371	/nfs/dbraw/zinc/17/83/71/460178371.db2.gz	NPBJEPKQNGCEFM-XLIONFOSSA-N	0	3	339.483	3.214	20	30		EGEDHN
CN(C)Cc1cccc(CNC(=O)N[C@H]2CCc3cc(C#N)ccc32)c1	ZINC000618798581	460180170	/nfs/dbraw/zinc/18/01/70/460180170.db2.gz	UEIJWXITBAFPDM-FQEVSTJZSA-N	0	3	348.450	3.107	20	30		EGEDHN
CN1CCC(N(C(=O)c2cc(C#N)cs2)c2ccccc2)CC1	ZINC000610613744	460197792	/nfs/dbraw/zinc/19/77/92/460197792.db2.gz	UITDUORNYWDIMX-UHFFFAOYSA-N	0	3	325.437	3.361	20	30		EGEDHN
CC(C)N(Cc1cccc(F)c1)C[C@@H](O)COc1ccccc1C#N	ZINC000599271376	460213800	/nfs/dbraw/zinc/21/38/00/460213800.db2.gz	XEMXFKAVQWWYPL-LJQANCHMSA-N	0	3	342.414	3.348	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](CC)CN1CCCC1	ZINC000610722170	460225407	/nfs/dbraw/zinc/22/54/07/460225407.db2.gz	TXFZWZOMRODMIS-IBGZPJMESA-N	0	3	342.487	3.354	20	30		EGEDHN
C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@H](CC)CN1CCCC1	ZINC000610722091	460225839	/nfs/dbraw/zinc/22/58/39/460225839.db2.gz	CVTBFZQBRMEJTG-LJQANCHMSA-N	0	3	340.471	3.130	20	30		EGEDHN
C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@@H](CC)CN1CCCC1	ZINC000610722090	460225995	/nfs/dbraw/zinc/22/59/95/460225995.db2.gz	CVTBFZQBRMEJTG-IBGZPJMESA-N	0	3	340.471	3.130	20	30		EGEDHN
COc1ccc(C#N)cc1CN1C[C@@H]2CN(c3ccccc3)C[C@@H]2C1	ZINC000610952841	460265362	/nfs/dbraw/zinc/26/53/62/460265362.db2.gz	KZZMORBJARDYAU-KDURUIRLSA-N	0	3	333.435	3.135	20	30		EGEDHN
CC(C)OC1CCC(NC(=O)C(C#N)Cc2ccc(C#N)cc2)CC1	ZINC000619304530	460324099	/nfs/dbraw/zinc/32/40/99/460324099.db2.gz	OSFYKCCETZWGDA-LMDPOFIKSA-N	0	3	339.439	3.093	20	30		EGEDHN
Cc1ccccc1CN1CCCN(c2nc3c(cc2C#N)CCC3)CC1	ZINC000603850461	460347862	/nfs/dbraw/zinc/34/78/62/460347862.db2.gz	HCJTYTLWCKDSHO-UHFFFAOYSA-N	0	3	346.478	3.463	20	30		EGEDHN
CN(Cc1ccccc1)C[C@H](O)CN[C@@H](CCC#N)c1ccccc1	ZINC000611407025	460356728	/nfs/dbraw/zinc/35/67/28/460356728.db2.gz	VCGFFJBGBMRSQC-RTWAWAEBSA-N	0	3	337.467	3.114	20	30		EGEDHN
COc1cccc2c1OC[C@H](N[C@@H](C)c1ccc(C#N)c(F)c1)C2	ZINC000611465649	460370189	/nfs/dbraw/zinc/37/01/89/460370189.db2.gz	YVTGMCWSSCZRHY-BLLLJJGKSA-N	0	3	326.371	3.360	20	30		EGEDHN
Cc1ccc2oc(CNC[C@H](O)COc3ccccc3C#N)cc2c1	ZINC000601961389	460962681	/nfs/dbraw/zinc/96/26/81/460962681.db2.gz	XBCAMIZUQWYUJN-KRWDZBQOSA-N	0	3	336.391	3.142	20	30		EGEDHN
CC#CC[C@@H](CO)NCc1cc(Cl)c(OCCC)c(OC)c1	ZINC000641769723	461361915	/nfs/dbraw/zinc/36/19/15/461361915.db2.gz	YVCOTPZQJXHGKC-AWEZNQCLSA-N	0	3	325.836	3.001	20	30		EGEDHN
C=CCN(C(=O)N[C@@H](CN)c1ccc2ccccc2c1)[C@@H](C)COC	ZINC000659528904	461372879	/nfs/dbraw/zinc/37/28/79/461372879.db2.gz	YRURLLLZHDZLJT-KXBFYZLASA-N	0	3	341.455	3.072	20	30		EGEDHN
CCCN1CC[C@H](NC(=O)Nc2cccc(C#Cc3ccccn3)c2)C1	ZINC000666045848	461421767	/nfs/dbraw/zinc/42/17/67/461421767.db2.gz	UNDNSBRGAFEFHP-FQEVSTJZSA-N	0	3	348.450	3.087	20	30		EGEDHN
N#CC(C(=O)c1ccc(NC(N)=O)cc1)c1nc(C2CC2)cs1	ZINC000647372550	461663336	/nfs/dbraw/zinc/66/33/36/461663336.db2.gz	OQKPUVCRXLCQJH-GFCCVEGCSA-N	0	3	326.381	3.001	20	30		EGEDHN
C=CCCn1cc(CN[C@@H](CN2CCCCC2)c2ccccc2)nn1	ZINC000653612595	461760531	/nfs/dbraw/zinc/76/05/31/461760531.db2.gz	YAYFRHQAVVNMGH-FQEVSTJZSA-N	0	3	339.487	3.171	20	30		EGEDHN
C=CCCn1cc(CN[C@@H](C)Cc2cn(C)c3ccc(F)cc23)nn1	ZINC000657494406	462155607	/nfs/dbraw/zinc/15/56/07/462155607.db2.gz	AJMLOOBFVFQWLX-AWEZNQCLSA-N	0	3	341.434	3.206	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN(C)Cc1cn[nH]c1C	ZINC000639967544	462196271	/nfs/dbraw/zinc/19/62/71/462196271.db2.gz	KWLKLZDHMMGVAG-UHFFFAOYSA-N	0	3	330.457	3.067	20	30		EGEDHN
C=C[C@H](CC(=O)N1C[C@@H](c2cccc(F)c2)[C@H](N)C1)c1ccccc1	ZINC000649368170	462489469	/nfs/dbraw/zinc/48/94/69/462489469.db2.gz	MGCMRVOLUTZJIE-UIAACRFSSA-N	0	3	338.426	3.439	20	30		EGEDHN
C[C@H]1CN(CCC(=O)Nc2sc3c(c2C#N)CCCC3)CCS1	ZINC000171699582	533925757	/nfs/dbraw/zinc/92/57/57/533925757.db2.gz	UFUURNNQTQNLHI-LBPRGKRZSA-N	0	3	349.525	3.264	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)[C@@H](C)c2sc(C)nc2C)CC1	ZINC000171742063	526423717	/nfs/dbraw/zinc/42/37/17/526423717.db2.gz	FOYFBROBVOVFRV-ZDUSSCGKSA-N	0	3	336.505	3.113	20	30		EGEDHN
C=CCN1CCC(NC(=O)Cn2ccc3ccc(Cl)cc32)CC1	ZINC000171715607	526424413	/nfs/dbraw/zinc/42/44/13/526424413.db2.gz	PGIDGWHHRHNESD-UHFFFAOYSA-N	0	3	331.847	3.061	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](c2ccccc2)C2CCC2)CC1	ZINC000171734655	526440076	/nfs/dbraw/zinc/44/00/76/526440076.db2.gz	CLHMHDYTGBJWLM-LJQANCHMSA-N	0	3	327.472	3.477	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(-c3ccc(C)cc3)no2)CC1	ZINC000171719115	526446984	/nfs/dbraw/zinc/44/69/84/526446984.db2.gz	ITCGMDZADBUYQD-UHFFFAOYSA-N	0	3	325.412	3.030	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(CC)CCc2ccccc2)CC1	ZINC000171560366	526583782	/nfs/dbraw/zinc/58/37/82/526583782.db2.gz	ZUMBNCDRZJBWIJ-UHFFFAOYSA-N	0	3	329.488	3.301	20	30		EGEDHN
C#CCCCN[C@H](c1ccccc1)c1cccc(S(C)(=O)=O)c1	ZINC000179458937	526714802	/nfs/dbraw/zinc/71/48/02/526714802.db2.gz	ADVOITOJNZADGA-LJQANCHMSA-N	0	3	327.449	3.183	20	30		EGEDHN
CN1CCCC(C)(C)[C@H]1CNC(=O)CSCc1ccc(C#N)cc1	ZINC000344695850	536350603	/nfs/dbraw/zinc/35/06/03/536350603.db2.gz	GWDGUCUPJSGWSA-QGZVFWFLSA-N	0	3	345.512	3.028	20	30		EGEDHN
C=CCOc1ccccc1CN[C@@H](C)c1cccc(-n2cnnn2)c1	ZINC000161484572	546956062	/nfs/dbraw/zinc/95/60/62/546956062.db2.gz	AOOZWOBHASUIRH-HNNXBMFYSA-N	0	3	335.411	3.078	20	30		EGEDHN
N#CC(C(=O)c1ccc(C(F)F)cc1)c1nnc2n1CCCCC2	ZINC000338857139	547566060	/nfs/dbraw/zinc/56/60/60/547566060.db2.gz	OHTVPECEVSYYIQ-CYBMUJFWSA-N	0	3	330.338	3.432	20	30		EGEDHN
C=CCCOCC(=O)N1CC[C@@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000673801766	548629053	/nfs/dbraw/zinc/62/90/53/548629053.db2.gz	WSBSEMDPXCMJDI-NRFANRHFSA-N	0	3	342.483	3.094	20	30		EGEDHN
C=CCc1ccc(OC[C@H](O)CN2CCC3(CC3)CC2)c(OC)c1	ZINC000677717037	549316205	/nfs/dbraw/zinc/31/62/05/549316205.db2.gz	BYYYUJUCYSOHIF-QGZVFWFLSA-N	0	3	331.456	3.039	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN[C@H](CN1CCCCC1)c1ccccc1	ZINC000679938209	549792726	/nfs/dbraw/zinc/79/27/26/549792726.db2.gz	MIPLBTWKWGXRKX-HXUWFJFHSA-N	0	3	341.499	3.004	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(F)c(C(F)(F)F)c(F)c2)CC1	ZINC000683240407	550206906	/nfs/dbraw/zinc/20/69/06/550206906.db2.gz	YPMOLDOBYUZURJ-UHFFFAOYSA-N	0	3	348.315	3.364	20	30		EGEDHN
C#Cc1ccc(C(=O)N(CC)[C@@H]2CCN([C@@H](C)c3ccccc3)C2)nc1	ZINC000728861813	574779787	/nfs/dbraw/zinc/77/97/87/574779787.db2.gz	PSYHQWSGGGVCNE-FXAWDEMLSA-N	0	3	347.462	3.361	20	30		EGEDHN
COc1cccc(/C=N/CCc2ccc(OCCN(C)C)cc2)c1O	ZINC000729150442	574818964	/nfs/dbraw/zinc/81/89/64/574818964.db2.gz	VQHMKRYPIHJBQG-RCCKNPSSSA-N	0	3	342.439	3.003	20	30		EGEDHN
CCCCCCC[C@H](C)CNC(=O)NC[C@@H]1CN2CCC[C@H]2CO1	ZINC000729496531	574866094	/nfs/dbraw/zinc/86/60/94/574866094.db2.gz	BUIIVQJKIODGKG-OKZBNKHCSA-N	0	3	339.524	3.145	20	30		EGEDHN
CC(=NNc1ccnc2ccccc21)c1ccc(OCCN(C)C)cc1	ZINC000730148510	574925857	/nfs/dbraw/zinc/92/58/57/574925857.db2.gz	VVWWRZUIYDZJEY-UHFFFAOYSA-N	0	3	348.450	3.433	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H]2C[C@H]2c2ccc(N(C)C)cc2)CC1	ZINC000730549823	575000098	/nfs/dbraw/zinc/00/00/98/575000098.db2.gz	QCMGDFBFBAPQLE-VQTJNVASSA-N	0	3	341.499	3.013	20	30		EGEDHN
CCCCN(CCOC)CC(=O)C(C#N)c1nc2ccccc2s1	ZINC000731667596	575195351	/nfs/dbraw/zinc/19/53/51/575195351.db2.gz	SDDBZQLOZDZCEF-CQSZACIVSA-N	0	3	345.468	3.221	20	30		EGEDHN
CCCCN(CCOC)CC(=O)C(C#N)c1nc2ccccc2s1	ZINC000731667595	575195358	/nfs/dbraw/zinc/19/53/58/575195358.db2.gz	SDDBZQLOZDZCEF-AWEZNQCLSA-N	0	3	345.468	3.221	20	30		EGEDHN
N#CC(C(=O)C[C@H]1CCc2ccccc2C1)C(=O)NCc1ccccc1	ZINC000732593226	575278742	/nfs/dbraw/zinc/27/87/42/575278742.db2.gz	HSULQKGKLXZQDI-PXNSSMCTSA-N	0	3	346.430	3.207	20	30		EGEDHN
CCN(CC)c1ccc(C=[NH+]Cc2cc3c([nH]c2=O)CCC3)c([O-])c1	ZINC000733080979	575305984	/nfs/dbraw/zinc/30/59/84/575305984.db2.gz	IITXNFIDECVDIO-MTJSOVHGSA-N	0	3	339.439	3.447	20	30		EGEDHN
C#CCCOc1ccc(CN[C@H](C)c2ccc3c(c2)CC(=O)N3C)cc1	ZINC000733327432	575328176	/nfs/dbraw/zinc/32/81/76/575328176.db2.gz	XFICRHNRZKMNOW-MRXNPFEDSA-N	0	3	348.446	3.458	20	30		EGEDHN
CCN(CC(=O)/C=C1/N(C)c2ccccc2C1(C)C)C[C@H]1CCOC1	ZINC000734149456	575443093	/nfs/dbraw/zinc/44/30/93/575443093.db2.gz	NEKQMZXNQDGIEO-DDLUMYACSA-N	0	3	342.483	3.225	20	30		EGEDHN
C=CC[C@H](NC(=O)NCC(C)(C)N1CCCCC1)c1ccncc1	ZINC000734654468	575532280	/nfs/dbraw/zinc/53/22/80/575532280.db2.gz	VTFUSSBVHXVBTA-KRWDZBQOSA-N	0	3	330.476	3.263	20	30		EGEDHN
C=CC[C@@H](NC(=O)N1CCC[C@H]1CN1CCCCC1)c1ccncc1	ZINC000734684101	575536913	/nfs/dbraw/zinc/53/69/13/575536913.db2.gz	SDTFZFCVWDMNBI-RBUKOAKNSA-N	0	3	342.487	3.359	20	30		EGEDHN
C#Cc1ccc(C(=O)NC2CCN([C@H](C)c3ccccc3)CC2)nc1	ZINC000734784173	575551360	/nfs/dbraw/zinc/55/13/60/575551360.db2.gz	ZBFWVISOLCLAKC-MRXNPFEDSA-N	0	3	333.435	3.018	20	30		EGEDHN
N=C(N)NN=C(Cc1ccccc1F)c1ccccc1Br	ZINC000735608475	575689210	/nfs/dbraw/zinc/68/92/10/575689210.db2.gz	BKTZJBBTRGETNL-UHFFFAOYSA-N	0	3	349.207	3.018	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)Cc3ccc4c(c3)CCO4)nc21	ZINC000735792589	575715248	/nfs/dbraw/zinc/71/52/48/575715248.db2.gz	MUNHSGDYAKNVBD-HNNXBMFYSA-N	0	3	331.375	3.225	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)C[C@H]2CCOC2)cc1	ZINC000740536474	576594191	/nfs/dbraw/zinc/59/41/91/576594191.db2.gz	UPYOPANDNFKEHV-NVXWUHKLSA-N	0	3	328.412	3.103	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2ccc(F)c(C(F)(F)F)c2)CC1	ZINC000740737199	576621823	/nfs/dbraw/zinc/62/18/23/576621823.db2.gz	DSXNEUXBOWLMLT-UHFFFAOYSA-N	0	3	342.336	3.062	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2ccc(SC(C)C)cc2)CC1	ZINC000740739081	576622045	/nfs/dbraw/zinc/62/20/45/576622045.db2.gz	VEOVPPCECDKVMD-UHFFFAOYSA-N	0	3	330.497	3.405	20	30		EGEDHN
C[C@H]1CCCN1CCNC(=O)c1ccccc1-c1ccccc1C#N	ZINC000742239009	576761153	/nfs/dbraw/zinc/76/11/53/576761153.db2.gz	CIGRADWHXKMBRJ-INIZCTEOSA-N	0	3	333.435	3.439	20	30		EGEDHN
COc1ccc(CN[C@@H]2CCN([C@H](C)c3ccccc3)C2)cc1C#N	ZINC000742370381	576774869	/nfs/dbraw/zinc/77/48/69/576774869.db2.gz	PKKFNVNTDKQARQ-OXQOHEQNSA-N	0	3	335.451	3.492	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)C(C#N)C(=O)Nc1c(CC)cccc1CC	ZINC000743450160	576809467	/nfs/dbraw/zinc/80/94/67/576809467.db2.gz	XTWGQDMRMPYJGL-PBHICJAKSA-N	0	3	342.439	3.440	20	30		EGEDHN
[O-]c1c(O)ccc(/C=N\C2CC[NH+](CC3CCCCC3)CC2)c1O	ZINC000743537877	576811435	/nfs/dbraw/zinc/81/14/35/576811435.db2.gz	CIWUPMYEYCNZRW-NDENLUEZSA-N	0	3	332.444	3.267	20	30		EGEDHN
C#Cc1ccc(C(=O)N(CC)C[C@@H]2CCN(Cc3ccccc3)C2)cn1	ZINC000743781143	576815864	/nfs/dbraw/zinc/81/58/64/576815864.db2.gz	BUPJVKNLRNJISB-LJQANCHMSA-N	0	3	347.462	3.047	20	30		EGEDHN
N#Cc1c2[nH]c3ccccc3n2c(=O)cc1CN1CCC[C@@H]2CCC[C@H]21	ZINC000744408632	576827579	/nfs/dbraw/zinc/82/75/79/576827579.db2.gz	AWLQJXDNHLBDLB-YXJHDRRASA-N	0	3	346.434	3.488	20	30		EGEDHN
N#CC(C(=O)CCc1cc(Cl)cs1)C(=O)NC1CCCCC1	ZINC000077865892	1292488573	/nfs/dbraw/zinc/48/85/73/1292488573.db2.gz	JGQXFZXXGVPCHX-CQSZACIVSA-N	0	3	338.860	3.492	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)CCc1cc(Cl)cs1	ZINC000077865640	1292488798	/nfs/dbraw/zinc/48/87/98/1292488798.db2.gz	CEOXPZVYLGSYPP-CYBMUJFWSA-N	0	3	326.849	3.349	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)c1sc(C)nc1C	ZINC000104380527	1293022729	/nfs/dbraw/zinc/02/27/29/1293022729.db2.gz	QVWDEURHCUWPFS-LBPRGKRZSA-N	0	3	343.408	3.120	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN[C@H](C)c2ccc(NC(N)=O)cc2)cc1	ZINC000113351175	1293147429	/nfs/dbraw/zinc/14/74/29/1293147429.db2.gz	RCQGOOMKIJZYPZ-ZIAGYGMSSA-N	0	3	338.411	3.319	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1[NH2+][C@H](C)c1cc(Br)cc(C)c1[O-]	ZINC000834890237	1293165473	/nfs/dbraw/zinc/16/54/73/1293165473.db2.gz	ZHTOXKGVVKLRJY-HONMWMINSA-N	0	3	326.234	3.457	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1	ZINC000835057115	1293195137	/nfs/dbraw/zinc/19/51/37/1293195137.db2.gz	QNSKKYNRZRGLOX-XHSDSOJGSA-N	0	3	332.831	3.459	20	30		EGEDHN
N#CC(C(=O)CCCC(=O)C1CC1)C(=O)Nc1ccc(Cl)cc1	ZINC000835059897	1293196095	/nfs/dbraw/zinc/19/60/95/1293196095.db2.gz	GAKDPASNNPCFKM-CQSZACIVSA-N	0	3	332.787	3.137	20	30		EGEDHN
CCC[C@H](OC)C(=O)C(C#N)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000835066228	1293197617	/nfs/dbraw/zinc/19/76/17/1293197617.db2.gz	XAQRVKFBJGXIDT-OLZOCXBDSA-N	0	3	343.210	3.456	20	30		EGEDHN
CCC[C@H](OC)C(=O)C(C#N)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000835066230	1293197673	/nfs/dbraw/zinc/19/76/73/1293197673.db2.gz	XAQRVKFBJGXIDT-STQMWFEESA-N	0	3	343.210	3.456	20	30		EGEDHN
C[C@@H](Oc1ccccn1)C(=O)C(C#N)c1cc(C(F)(F)F)ccn1	ZINC000835454246	1293294470	/nfs/dbraw/zinc/29/44/70/1293294470.db2.gz	GGWVOIRRVLXVAF-PWSUYJOCSA-N	0	3	335.285	3.139	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)Cc2c(F)cccc2F)c1	ZINC000119995944	1293297915	/nfs/dbraw/zinc/29/79/15/1293297915.db2.gz	VZGJZJFKLZFDCC-AWEZNQCLSA-N	0	3	328.318	3.163	20	30		EGEDHN
Cc1ccc(C(C)C)cc1O[C@H](C)C(=O)C(C#N)C(=O)N1CCCC1	ZINC000124844638	1293487048	/nfs/dbraw/zinc/48/70/48/1293487048.db2.gz	KTCJBLMUPAWOGL-NVXWUHKLSA-N	0	3	342.439	3.217	20	30		EGEDHN
C[C@H]1CCc2sc(C(=O)C(C#N)C(=O)Nc3ccccn3)cc2C1	ZINC000125110608	1293495815	/nfs/dbraw/zinc/49/58/15/1293495815.db2.gz	BLJHJEBADULXJU-AAEUAGOBSA-N	0	3	339.420	3.229	20	30		EGEDHN
Cc1ccc2c(CC(=O)C(C#N)C(=O)Nc3ccccn3)coc2c1	ZINC000126367257	1293532817	/nfs/dbraw/zinc/53/28/17/1293532817.db2.gz	JSDBZMZUCMPSMZ-OAHLLOKOSA-N	0	3	333.347	3.026	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)[C@H](C)Oc2cccc(C)c2)c1	ZINC000127519142	1293566780	/nfs/dbraw/zinc/56/67/80/1293566780.db2.gz	FBBQIDIXVKLGEO-YJBOKZPZSA-N	0	3	336.391	3.418	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)COc2ccc(C)cc2C)c1	ZINC000127544402	1293566834	/nfs/dbraw/zinc/56/68/34/1293566834.db2.gz	YJOQFPPALMPBHP-QGZVFWFLSA-N	0	3	336.391	3.338	20	30		EGEDHN
C[C@@H](Oc1cccc(Cl)c1)C(=O)C(C#N)C(=O)Nc1ccccc1	ZINC000127951468	1293578511	/nfs/dbraw/zinc/57/85/11/1293578511.db2.gz	UDSILVDKGLAIIC-MLGOLLRUSA-N	0	3	342.782	3.455	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)[C@H](C)Oc2ccccc2)cc1	ZINC000128381010	1293591040	/nfs/dbraw/zinc/59/10/40/1293591040.db2.gz	UNPBCIHCHSPHFL-KSSFIOAISA-N	0	3	336.391	3.364	20	30		EGEDHN
COc1ccc([C@@H](C)NCc2cccc(OCC#N)c2)cc1OC	ZINC000128497638	1293595635	/nfs/dbraw/zinc/59/56/35/1293595635.db2.gz	QQWHPAUWTAZAGM-CQSZACIVSA-N	0	3	326.396	3.457	20	30		EGEDHN
C=CCc1cc(CN2CCC[C@H]2CC(=O)OCC)cc(OC)c1O	ZINC000130495365	1293658477	/nfs/dbraw/zinc/65/84/77/1293658477.db2.gz	WLSLJFKZIKCGHI-INIZCTEOSA-N	0	3	333.428	3.047	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@@H](C)c1c(F)cccc1F	ZINC000153195698	1294002279	/nfs/dbraw/zinc/00/22/79/1294002279.db2.gz	CVGBHUNQOIWENK-QWHCGFSZSA-N	0	3	336.382	3.474	20	30		EGEDHN
CC(C)(C)SCCCC(=O)C(C#N)C(=O)NCc1ccccc1	ZINC000155107965	1294084853	/nfs/dbraw/zinc/08/48/53/1294084853.db2.gz	ZOYLKOFFALZMLQ-HNNXBMFYSA-N	0	3	332.469	3.324	20	30		EGEDHN
N#CC(C(=O)CC1CCOCC1)c1nc2ccccc2n1C(F)F	ZINC000172019776	1294425995	/nfs/dbraw/zinc/42/59/95/1294425995.db2.gz	DDLRHOWMURIXTL-GFCCVEGCSA-N	0	3	333.338	3.424	20	30		EGEDHN
CCOc1ccc(O)c(/C=N/CCN(C)Cc2ccc(F)cc2)c1	ZINC000176414598	1294605832	/nfs/dbraw/zinc/60/58/32/1294605832.db2.gz	ZQKVKWYOAVUQFF-FYJGNVAPSA-N	0	3	330.403	3.481	20	30		EGEDHN
N#Cc1csc(CNCc2ccc(N3CCC(CO)CC3)cc2)c1	ZINC000177689550	1294686945	/nfs/dbraw/zinc/68/69/45/1294686945.db2.gz	PWLNYCCSSJEYQS-UHFFFAOYSA-N	0	3	341.480	3.118	20	30		EGEDHN
CC(C)(CC(=O)C(C#N)C(=O)Nc1ccccn1)c1ccc(F)cc1	ZINC000870162955	1295713578	/nfs/dbraw/zinc/71/35/78/1295713578.db2.gz	RPDYZDJDCYHAGR-OAHLLOKOSA-N	0	3	339.370	3.236	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](C#N)CCC#N)C(C)(C)C1	ZINC000872223227	1296825410	/nfs/dbraw/zinc/82/54/10/1296825410.db2.gz	ONOISKSUGNKFOF-GJZGRUSLSA-N	0	3	334.464	3.055	20	30		EGEDHN
C#CCOc1ccccc1CNC[C@@H]1CCCN1C(=O)OC(C)(C)C	ZINC000310653164	1297098900	/nfs/dbraw/zinc/09/89/00/1297098900.db2.gz	KSCLXEOXLZPHAY-KRWDZBQOSA-N	0	3	344.455	3.188	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)Nc1cccc2c1CCN(CC(C)(C)O)C2	ZINC000443129646	1297856325	/nfs/dbraw/zinc/85/63/25/1297856325.db2.gz	NWFIKDLKNUFCEK-HXUWFJFHSA-N	0	3	330.472	3.356	20	30		EGEDHN
CCc1cccc(CC)c1NC(=O)C(C#N)C(=O)CCCCOC	ZINC000747018676	1298710558	/nfs/dbraw/zinc/71/05/58/1298710558.db2.gz	SFPCYHUZLIJTFO-MRXNPFEDSA-N	0	3	330.428	3.275	20	30		EGEDHN
C#CCN(C[C@@H](O)COc1ccccc1F)[C@@H]1CCc2ccccc21	ZINC000747528712	1298796442	/nfs/dbraw/zinc/79/64/42/1298796442.db2.gz	NUBMJGONAXHPJE-YLJYHZDGSA-N	0	3	339.410	3.188	20	30		EGEDHN
COc1cccc(O)c1/C=N\C1CCN([C@H](C)c2ccncc2)CC1	ZINC000747689930	1298832912	/nfs/dbraw/zinc/83/29/12/1298832912.db2.gz	BBUOAAOCQOWJJF-YZLQOSHFSA-N	0	3	339.439	3.440	20	30		EGEDHN
C=C(Cl)C[C@@H](N)C(=O)Nc1ccc(F)cc1OCC(F)(F)F	ZINC000876663087	1298905337	/nfs/dbraw/zinc/90/53/37/1298905337.db2.gz	QGRDQJYEMCZQNS-SECBINFHSA-N	0	3	340.704	3.175	20	30		EGEDHN
CC(C)N(CCCNCc1cccc(C#N)n1)C(=O)OC(C)(C)C	ZINC000877024608	1299117502	/nfs/dbraw/zinc/11/75/02/1299117502.db2.gz	JFFFYKDRPLYLBL-UHFFFAOYSA-N	0	3	332.448	3.078	20	30		EGEDHN
CCCC[C@H](CNC(=O)OC(C)(C)C)NCc1cccc(C#N)n1	ZINC000877158102	1299185532	/nfs/dbraw/zinc/18/55/32/1299185532.db2.gz	DSOPUCMNLVURAQ-OAHLLOKOSA-N	0	3	332.448	3.126	20	30		EGEDHN
C#CCCCCCCN[C@@H](C(N)=O)c1cccc(Br)c1	ZINC000877487403	1299339570	/nfs/dbraw/zinc/33/95/70/1299339570.db2.gz	FGAHJDCSOXGVOL-OAHLLOKOSA-N	0	3	337.261	3.149	20	30		EGEDHN
CN(C)CCN(C)C(=O)Nc1ccc([C@H](C#N)c2ccccc2)cc1	ZINC000750588771	1299431323	/nfs/dbraw/zinc/43/13/23/1299431323.db2.gz	WMKUSPAVHHNFHR-LJQANCHMSA-N	0	3	336.439	3.367	20	30		EGEDHN
CC[C@@H]1CN(CCCOc2ccc(C#N)cc2)[C@@H](CC)CN1C(C)=O	ZINC000752090843	1299691964	/nfs/dbraw/zinc/69/19/64/1299691964.db2.gz	DKYJHDPOCKQXHJ-RBUKOAKNSA-N	0	3	343.471	3.048	20	30		EGEDHN
CC(=O)[C@@](C#N)(CCN1CCC([C@H]2CCOC2)CC1)c1ccccc1	ZINC000878403153	1299977118	/nfs/dbraw/zinc/97/71/18/1299977118.db2.gz	VTPSOBHHXUSQHO-FPOVZHCZSA-N	0	3	340.467	3.176	20	30		EGEDHN
CC(=O)[C@](C#N)(CCN1CCC([C@@H]2CCCO2)CC1)c1ccccc1	ZINC000878483072	1300027818	/nfs/dbraw/zinc/02/78/18/1300027818.db2.gz	GCBLYSMWULXOEK-LEWJYISDSA-N	0	3	340.467	3.318	20	30		EGEDHN
Cc1cccc2ncc(C=NN=c3[nH]c4cc(F)c(F)cc4[nH]3)n21	ZINC000755631496	1300369812	/nfs/dbraw/zinc/36/98/12/1300369812.db2.gz	NCEGBAMIDARBII-UHFFFAOYSA-N	0	3	326.310	3.243	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)CN1CCc1ccc(C#N)cc1	ZINC000879221634	1300434755	/nfs/dbraw/zinc/43/47/55/1300434755.db2.gz	CWQJBMCSBUXHJZ-RHSMWYFYSA-N	0	3	329.444	3.088	20	30		EGEDHN
C#CCOc1cccc(NC(=O)[C@H]2CCCCN2C2CCCC2)c1	ZINC000764506153	1302078415	/nfs/dbraw/zinc/07/84/15/1302078415.db2.gz	VPUOYPTVQDPHMV-LJQANCHMSA-N	0	3	326.440	3.434	20	30		EGEDHN
CC[C@H](C)c1ccc(NC(=O)C(C#N)C(=O)[C@H]2C[C@@]23CCOC3)cc1	ZINC000764755344	1302127537	/nfs/dbraw/zinc/12/75/37/1302127537.db2.gz	FDTKOYJSHXYWAW-QIYDDFJZSA-N	0	3	340.423	3.274	20	30		EGEDHN
C#CC[C@H](NC(=O)NC[C@H]1CCCCN1C1CC1)c1ccccc1	ZINC000764799893	1302137463	/nfs/dbraw/zinc/13/74/63/1302137463.db2.gz	MWQQSFREZIAENE-MOPGFXCFSA-N	0	3	325.456	3.067	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cccc(Cl)c2Cl)[C@H](C)C1	ZINC000944304140	1332367018	/nfs/dbraw/zinc/36/70/18/1332367018.db2.gz	GOLFJGNTTXSEPM-BXUZGUMPSA-N	0	3	325.239	3.067	20	30		EGEDHN
C#CC[C@H](CO)NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1	ZINC000883124146	1302261026	/nfs/dbraw/zinc/26/10/26/1302261026.db2.gz	XXBCPBDHXSTSAC-GFCCVEGCSA-N	0	3	325.252	3.198	20	30		EGEDHN
C=CC[C@H](N[C@@H](C)c1cccc(NS(C)(=O)=O)c1)c1ccncc1	ZINC000766017384	1302370375	/nfs/dbraw/zinc/37/03/75/1302370375.db2.gz	AYDLMCAQTXYUAS-KSSFIOAISA-N	0	3	345.468	3.421	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)[C@H](F)c1ccccc1	ZINC000769285453	1303084668	/nfs/dbraw/zinc/08/46/68/1303084668.db2.gz	ZUUBGFAUJWBWLS-CZUORRHYSA-N	0	3	326.327	3.053	20	30		EGEDHN
N#CC(C(=O)Cc1ccco1)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000772639703	1303557106	/nfs/dbraw/zinc/55/71/06/1303557106.db2.gz	KBXVMMRYBMIFGF-CYBMUJFWSA-N	0	3	337.162	3.476	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)Cc2ccc(C)o2)cc1Cl	ZINC000775228406	1303927412	/nfs/dbraw/zinc/92/74/12/1303927412.db2.gz	UHWWLHNARLSMEV-ZDUSSCGKSA-N	0	3	346.770	3.140	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N1CCC[C@@H](C(=O)Nc2ccccn2)C1	ZINC000777711812	1304337577	/nfs/dbraw/zinc/33/75/77/1304337577.db2.gz	XYDGJOCIMJEIOU-MAUKXSAKSA-N	0	3	334.423	3.365	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CNc1cc(CN(C)C)ccn1	ZINC000777733188	1304341072	/nfs/dbraw/zinc/34/10/72/1304341072.db2.gz	XBNNDAQHSZHKDF-UHFFFAOYSA-N	0	3	329.831	3.421	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CNCCCN1CCCCCC1=O	ZINC000778152518	1304404395	/nfs/dbraw/zinc/40/43/95/1304404395.db2.gz	UIZLLXGODQEVJI-UHFFFAOYSA-N	0	3	348.874	3.234	20	30		EGEDHN
C=CCOCC(=O)N(CCC)C1CCN(Cc2ccccc2)CC1	ZINC000889490751	1304501868	/nfs/dbraw/zinc/50/18/68/1304501868.db2.gz	FQAPTMOBCHBCRU-UHFFFAOYSA-N	0	3	330.472	3.092	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2nn(C(C)C)cc2Cl)CC1	ZINC000889542931	1304517424	/nfs/dbraw/zinc/51/74/24/1304517424.db2.gz	KYPXBUXKQFNFFP-UHFFFAOYSA-N	0	3	339.871	3.279	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)N(C)C	ZINC000891251950	1305000498	/nfs/dbraw/zinc/00/04/98/1305000498.db2.gz	IJZKOBJTJYTICQ-IBGZPJMESA-N	0	3	329.488	3.240	20	30		EGEDHN
N#CC(C(=O)Nc1ccccn1)C(=O)c1cc2cccc(Cl)c2o1	ZINC000783069761	1305044517	/nfs/dbraw/zinc/04/45/17/1305044517.db2.gz	NTCJIDIIKKKYNP-LLVKDONJSA-N	0	3	339.738	3.442	20	30		EGEDHN
COC1CCC(CN2CCN(c3ccc(C#N)cc3F)CC2)CC1	ZINC000891827743	1305180394	/nfs/dbraw/zinc/18/03/94/1305180394.db2.gz	YYTXSZDUMPLGSO-UHFFFAOYSA-N	0	3	331.435	3.025	20	30		EGEDHN
C[C@@H](C(=O)C(C#N)C(=O)NCc1cccc(Cl)c1)c1ccco1	ZINC000786536446	1305593058	/nfs/dbraw/zinc/59/30/58/1305593058.db2.gz	BTDFFSARSPHFLV-RISCZKNCSA-N	0	3	330.771	3.062	20	30		EGEDHN
CCCCCCCCNC(=O)N1CCN(C2CCOCC2)C[C@H]1C	ZINC000787296437	1305728288	/nfs/dbraw/zinc/72/82/88/1305728288.db2.gz	LUDXPRYGXGUOPN-QGZVFWFLSA-N	0	3	339.524	3.242	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/Cc2ccc(NC(C)=O)nc2)c([O-])c1	ZINC000788317733	1305920939	/nfs/dbraw/zinc/92/09/39/1305920939.db2.gz	KUNDNQVRQMKDNV-DEDYPNTBSA-N	0	3	340.427	3.211	20	30		EGEDHN
C=C(C)[C@@H](NC(=O)N(C)[C@@H]1CCCN(C)C1)c1ccc(F)c(F)c1	ZINC000894265935	1306309681	/nfs/dbraw/zinc/30/96/81/1306309681.db2.gz	XOFSFDYSZLJKHM-RHSMWYFYSA-N	0	3	337.414	3.318	20	30		EGEDHN
O=C1[C@H]([NH2+][C@H]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)CCCN1[O-]	ZINC000895162440	1309217514	/nfs/dbraw/zinc/21/75/14/1309217514.db2.gz	ZOADIKPNDFJNDT-AEGPPILISA-N	0	3	342.361	3.311	20	30		EGEDHN
C=CCC1(NCc2cn(C)nc2I)CCCC1	ZINC000895279751	1309269732	/nfs/dbraw/zinc/26/97/32/1309269732.db2.gz	KVBMUGYGBZQMNV-UHFFFAOYSA-N	0	3	345.228	3.003	20	30		EGEDHN
COc1ccc(C2=NO[C@H](CN[C@H](C)CC(C)(C)C#N)C2)cc1C	ZINC000895976767	1309623899	/nfs/dbraw/zinc/62/38/99/1309623899.db2.gz	JSTULYVMTBYIML-ZBFHGGJFSA-N	0	3	329.444	3.415	20	30		EGEDHN
CCCC(=O)N1CCC[C@H]1C(=O)C(C#N)c1ncc(C(C)(C)C)s1	ZINC000797569075	1310212545	/nfs/dbraw/zinc/21/25/45/1310212545.db2.gz	AFFUBSJYFIMARO-STQMWFEESA-N	0	3	347.484	3.408	20	30		EGEDHN
C=CCOc1cccc(CN2CCC[C@H](Cc3nc(C)no3)C2)c1	ZINC000897578913	1310392467	/nfs/dbraw/zinc/39/24/67/1310392467.db2.gz	JVLYBBQXYBJRNN-QGZVFWFLSA-N	0	3	327.428	3.398	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)cc1C#N	ZINC000799319839	1310523778	/nfs/dbraw/zinc/52/37/78/1310523778.db2.gz	RQOVOBDHLLCVIP-OXQOHEQNSA-N	0	3	333.435	3.432	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)[C@@H]2O[C@@H](C)C[C@@H]2C)cc1	ZINC000800384768	1310747804	/nfs/dbraw/zinc/74/78/04/1310747804.db2.gz	JUXVBKNAIXGHSZ-OJFPTFHUSA-N	0	3	342.439	3.490	20	30		EGEDHN
C#CCCCOc1cccnc1NC1CCN(CCOC(C)C)CC1	ZINC000820670323	1319931966	/nfs/dbraw/zinc/93/19/66/1319931966.db2.gz	MRCFYNFJGDWIPE-UHFFFAOYSA-N	0	3	345.487	3.175	20	30		EGEDHN
C#CCOc1ccc(CNCc2ccc(OC)c(OC)c2C)cc1	ZINC000824926438	1320297024	/nfs/dbraw/zinc/29/70/24/1320297024.db2.gz	NNBNURLUTTZFHP-UHFFFAOYSA-N	0	3	325.408	3.314	20	30		EGEDHN
Cc1cccc([C@@H](O)CN2CCC(Oc3cccc(C#N)c3)CC2)c1	ZINC000929523955	1328626460	/nfs/dbraw/zinc/62/64/60/1328626460.db2.gz	INMSYZZAJFYIGP-NRFANRHFSA-N	0	3	336.435	3.444	20	30		EGEDHN
CC(C)N1CCC[C@H]1C(=O)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000929691575	1328669090	/nfs/dbraw/zinc/66/90/90/1328669090.db2.gz	CNDGLUSGWKOQIA-INIZCTEOSA-N	0	3	338.373	3.046	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)[C@@H]3CCC=CCCC3)C2)s1	ZINC001019030805	1317014903	/nfs/dbraw/zinc/01/49/03/1317014903.db2.gz	UNIMSPRRVAYZPM-CVEARBPZSA-N	0	3	343.496	3.447	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@H](NCc2ccc(F)c(C#N)c2)C1)C(C)(C)C	ZINC001019042186	1317018572	/nfs/dbraw/zinc/01/85/72/1317018572.db2.gz	ASKBKQSELNTZFY-BBRMVZONSA-N	0	3	331.435	3.070	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H]1C(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001019407445	1317222465	/nfs/dbraw/zinc/22/24/65/1317222465.db2.gz	AXRBDXARNSFCAN-FGTMMUONSA-N	0	3	343.446	3.070	20	30		EGEDHN
CCc1cc(C)c(C(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)o1	ZINC001019659371	1317321635	/nfs/dbraw/zinc/32/16/35/1317321635.db2.gz	AIDSTGPHTKPAHB-ZDUSSCGKSA-N	0	3	343.452	3.088	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)c3cccc(Cl)c3)C2)s1	ZINC001019694759	1317341538	/nfs/dbraw/zinc/34/15/38/1317341538.db2.gz	NZRSJOZGPKKXAX-AWEZNQCLSA-N	0	3	345.855	3.277	20	30		EGEDHN
N#Cc1ccccc1CN1CCC2(CC1)CCN(C(=O)C(F)F)CC2	ZINC000957484527	1317393513	/nfs/dbraw/zinc/39/35/13/1317393513.db2.gz	WBNLEMOSNFPRJC-UHFFFAOYSA-N	0	3	347.409	3.028	20	30		EGEDHN
C#CCN(Cc1ccccc1)C(=O)NC[C@H](Cc1ccccc1)N(C)C	ZINC000806308744	1317478276	/nfs/dbraw/zinc/47/82/76/1317478276.db2.gz	XQJCQNYYJZAUAN-NRFANRHFSA-N	0	3	349.478	3.004	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@H](NC(=O)C=C3CCCCC3)C2)c(F)c1	ZINC001020015339	1317501638	/nfs/dbraw/zinc/50/16/38/1317501638.db2.gz	ZXUMONJOWAAEBH-IYARVYRRSA-N	0	3	341.430	3.325	20	30		EGEDHN
C[C@@H](N[C@H]1C[C@H](NC(=O)c2cc(C#N)c[nH]2)C1)c1ccccc1Cl	ZINC001020056177	1317522257	/nfs/dbraw/zinc/52/22/57/1317522257.db2.gz	FABKKXCMGLDOOY-MRVWCRGKSA-N	0	3	342.830	3.151	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C2=CCCCCC2)C1	ZINC001020102233	1317543528	/nfs/dbraw/zinc/54/35/28/1317543528.db2.gz	LCYIDRZPJVRXQW-HDJSIYSDSA-N	0	3	327.266	3.022	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC(CN(CC)Cc2cncs2)CC1	ZINC000957737446	1317601824	/nfs/dbraw/zinc/60/18/24/1317601824.db2.gz	HPWOJSPBFUTRCH-UHFFFAOYSA-N	0	3	335.517	3.416	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1SCOC1CCC1	ZINC000808018983	1317614198	/nfs/dbraw/zinc/61/41/98/1317614198.db2.gz	RFWVTGHDWGAYFI-UHFFFAOYSA-N	0	3	336.505	3.111	20	30		EGEDHN
C#C[C@H](NC(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1)C(C)(C)C	ZINC000808243809	1317649366	/nfs/dbraw/zinc/64/93/66/1317649366.db2.gz	PPASRAYBUIJHMV-SZMVWBNQSA-N	0	3	327.472	3.169	20	30		EGEDHN
C=C(Cl)COc1ccc([C@@H](C)N[C@@H]2COCC[C@H]2OC)cc1	ZINC000903300209	1317684913	/nfs/dbraw/zinc/68/49/13/1317684913.db2.gz	WMJWWVWKBPBMPU-KBRIMQKVSA-N	0	3	325.836	3.272	20	30		EGEDHN
CC(C)(C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1)C1CCC1	ZINC001020438976	1317696780	/nfs/dbraw/zinc/69/67/80/1317696780.db2.gz	JLCSQKVSWBWKDB-QAQDUYKDSA-N	0	3	343.446	3.260	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2C[C@H](N[C@@H](C)c3ccccc3F)C2)cc1	ZINC001020456179	1317705129	/nfs/dbraw/zinc/70/51/29/1317705129.db2.gz	DOTYIUMELXZBPD-WBAXXEDZSA-N	0	3	336.410	3.419	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)c2c(C)cccc2C)C1	ZINC001020618000	1317802142	/nfs/dbraw/zinc/80/21/42/1317802142.db2.gz	FCOHVAXFXKVPLB-HDJSIYSDSA-N	0	3	337.261	3.062	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cnc(-c3ccoc3)s2)C1	ZINC001020694810	1317870009	/nfs/dbraw/zinc/87/00/09/1317870009.db2.gz	OZLQSLKBRXWTDF-HAQNSBGRSA-N	0	3	337.832	3.006	20	30		EGEDHN
C#C[C@H](NCc1cc(OC)c(OCC(F)F)c(OC)c1)C(C)(C)C	ZINC000809781393	1317899932	/nfs/dbraw/zinc/89/99/32/1317899932.db2.gz	PODXOJUDCWUQFV-HNNXBMFYSA-N	0	3	341.398	3.485	20	30		EGEDHN
CC(C)n1ncc2cc(/C=C3\C(=O)c4ncnn4C3C)c(Cl)nc21	ZINC000905079884	1317921075	/nfs/dbraw/zinc/92/10/75/1317921075.db2.gz	GNNAIGIAQKODFA-IWKZGAEBSA-N	0	3	342.790	3.098	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)Cc2c[nH]c3cccc(C)c23)C1	ZINC001020941801	1318005484	/nfs/dbraw/zinc/00/54/84/1318005484.db2.gz	YXCIMEWZUKVMAG-SHTZXODSSA-N	0	3	331.847	3.008	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)C[C@H]2CCc3ccccc3C2)C1	ZINC001020976654	1318027156	/nfs/dbraw/zinc/02/71/56/1318027156.db2.gz	IANAVMOHNINYKX-WBAXXEDZSA-N	0	3	332.875	3.171	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccsc2C#N)C1	ZINC000906382698	1318089706	/nfs/dbraw/zinc/08/97/06/1318089706.db2.gz	RJVIBGVTTQNCRU-ZFWWWQNUSA-N	0	3	325.437	3.185	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000811055507	1318097819	/nfs/dbraw/zinc/09/78/19/1318097819.db2.gz	AVGKUHOBXIQDIV-JOCHJYFZSA-N	0	3	346.474	3.333	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)Cc2cccc(OC(C)C)c2)C1	ZINC001021116736	1318101431	/nfs/dbraw/zinc/10/14/31/1318101431.db2.gz	OHVWUGXZSPZQNP-WKILWMFISA-N	0	3	336.863	3.006	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C[C@@H]2CCCC[C@@H]2C)C1	ZINC001021119050	1318102247	/nfs/dbraw/zinc/10/22/47/1318102247.db2.gz	QYDYWDKODGLSCC-MXAVVETBSA-N	0	3	343.309	3.348	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NC1C[C@H]2CC[C@@H](C1)N2C/C=C\Cl	ZINC001021447282	1318257010	/nfs/dbraw/zinc/25/70/10/1318257010.db2.gz	HJVKRAZZDAJDBB-WRNHXYGMSA-N	0	3	342.870	3.075	20	30		EGEDHN
C/C(=C/C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)s1)C1CC1	ZINC000959898194	1318257101	/nfs/dbraw/zinc/25/71/01/1318257101.db2.gz	GAJCLDBYINFSPU-DNXIFWLFSA-N	0	3	343.496	3.447	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCCC[C@H]1CNCc1cc2ccccc2o1	ZINC000959925523	1318267812	/nfs/dbraw/zinc/26/78/12/1318267812.db2.gz	OOTLTIHQGDNVEQ-ZBFHGGJFSA-N	0	3	325.412	3.063	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCCC[C@H]1CNCc1cc(Cl)ccc1F	ZINC000959927148	1318269079	/nfs/dbraw/zinc/26/90/79/1318269079.db2.gz	ZTVBOBYINFOYCQ-WFASDCNBSA-N	0	3	337.826	3.109	20	30		EGEDHN
CSc1ccc([C@H](CNC(=O)c2ccsc2C#N)N(C)C)cc1	ZINC000908458816	1318348967	/nfs/dbraw/zinc/34/89/67/1318348967.db2.gz	YIXFHAFKFYXEDY-HNNXBMFYSA-N	0	3	345.493	3.374	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@H]2CN(Cc3ccc(C#N)cc3)CC[C@H]21	ZINC001021528611	1318364773	/nfs/dbraw/zinc/36/47/73/1318364773.db2.gz	ZISQIJFEEQMZQT-RBUKOAKNSA-N	0	3	325.456	3.027	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1sccc1F	ZINC000960260999	1318434801	/nfs/dbraw/zinc/43/48/01/1318434801.db2.gz	CEUPEJQELPUUQJ-HZPDHXFCSA-N	0	3	330.428	3.449	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cscc2C(F)F)C1	ZINC001021592706	1318438115	/nfs/dbraw/zinc/43/81/15/1318438115.db2.gz	SPCRQDLBYGGJRM-WFASDCNBSA-N	0	3	338.423	3.245	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)Cc1ccc(F)c(F)c1	ZINC000960298558	1318449392	/nfs/dbraw/zinc/44/93/92/1318449392.db2.gz	AYEBBWWEHASGNE-UYAOXDASSA-N	0	3	342.389	3.065	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@H](C)c1cccs1	ZINC000960305349	1318453165	/nfs/dbraw/zinc/45/31/65/1318453165.db2.gz	DQUHLPMUSOSUBI-MZMPZRCHSA-N	0	3	326.465	3.409	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1nc(C)c(C)s1	ZINC000960329083	1318463622	/nfs/dbraw/zinc/46/36/22/1318463622.db2.gz	JSSWNTVRNIHMLF-IAGOWNOFSA-N	0	3	341.480	3.321	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(F)ccc2CC)C1	ZINC001021625359	1318475018	/nfs/dbraw/zinc/47/50/18/1318475018.db2.gz	PCOMALIPOKXUCF-FXAWDEMLSA-N	0	3	342.458	3.338	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(F)ccc2CC)C1	ZINC001021625363	1318475166	/nfs/dbraw/zinc/47/51/66/1318475166.db2.gz	PCOMALIPOKXUCF-XLIONFOSSA-N	0	3	342.458	3.338	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(-n3cccc3)cc2)C1	ZINC001021626733	1318478748	/nfs/dbraw/zinc/47/87/48/1318478748.db2.gz	HSHNNSQIHLFCAW-CTNGQTDRSA-N	0	3	347.462	3.037	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(Cl)ccc2F)C1	ZINC001021627952	1318480645	/nfs/dbraw/zinc/48/06/45/1318480645.db2.gz	RAEFTNKZIHBARH-CXAGYDPISA-N	0	3	334.822	3.039	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)CCc2ccc(C)cc2)C1	ZINC001021629542	1318483980	/nfs/dbraw/zinc/48/39/80/1318483980.db2.gz	HGRAHIPINVQUPU-LEWJYISDSA-N	0	3	338.495	3.264	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)CCc2ccc3[nH]ccc3c2)C1	ZINC001021636377	1318491101	/nfs/dbraw/zinc/49/11/01/1318491101.db2.gz	PYAIBZHOFPZIAN-FPOVZHCZSA-N	0	3	349.478	3.047	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc3c(cc(C)cc3C)[nH]2)C1	ZINC001021638679	1318494991	/nfs/dbraw/zinc/49/49/91/1318494991.db2.gz	GDDCNIZJGBGDQA-UWJYYQICSA-N	0	3	349.478	3.344	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)CCc2ccc(Cl)cc2)C1	ZINC001021638552	1318495211	/nfs/dbraw/zinc/49/52/11/1318495211.db2.gz	FWYHYXTYFOJYHZ-PKOBYXMFSA-N	0	3	344.886	3.219	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)C[C@@H]1C=CCC1	ZINC000960401796	1318529729	/nfs/dbraw/zinc/52/97/29/1318529729.db2.gz	ZGECNQMAJFQIKN-YLJYHZDGSA-N	0	3	337.467	3.337	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(F)ccc2Cl)C1	ZINC001021674605	1318539690	/nfs/dbraw/zinc/53/96/90/1318539690.db2.gz	BVEGITCNIHXWPA-SUMWQHHRSA-N	0	3	334.822	3.039	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)[C@@H]1CC=CCC1	ZINC000960421291	1318544506	/nfs/dbraw/zinc/54/45/06/1318544506.db2.gz	VHYGJLYXTYXRTM-UXHICEINSA-N	0	3	337.467	3.337	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cccc(F)c2Cl)C1	ZINC001021677346	1318546494	/nfs/dbraw/zinc/54/64/94/1318546494.db2.gz	QAKKNEIVOTUPCT-YOEHRIQHSA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc3cc(F)ccc3o2)C1	ZINC001021682395	1318554135	/nfs/dbraw/zinc/55/41/35/1318554135.db2.gz	QMCXZYDQDPXYGQ-PBHICJAKSA-N	0	3	340.398	3.132	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2oc(C(C)C)nc2C)C1	ZINC001021686993	1318562044	/nfs/dbraw/zinc/56/20/44/1318562044.db2.gz	DNBZBDBBDSVJCN-SJORKVTESA-N	0	3	343.471	3.056	20	30		EGEDHN
C/C(=C/C(=O)N1CCC[C@@H]1CN(C)Cc1ccc(C#N)cc1)C1CC1	ZINC000960465420	1318583627	/nfs/dbraw/zinc/58/36/27/1318583627.db2.gz	LXKHOWDKDAKIMW-VMTBQTDASA-N	0	3	337.467	3.337	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc3ccncc3c2)C1	ZINC001021711497	1318588520	/nfs/dbraw/zinc/58/85/20/1318588520.db2.gz	XCPHJIJOERFNLF-PZJWPPBQSA-N	0	3	347.462	3.185	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC[C@H]1CN(C)Cc1ccc(C(F)F)cc1	ZINC000960503146	1318611636	/nfs/dbraw/zinc/61/16/36/1318611636.db2.gz	PMDSHJMIIGHBFH-BBRMVZONSA-N	0	3	335.398	3.207	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(OC(C)C)cc2)C1	ZINC001021726797	1318620931	/nfs/dbraw/zinc/62/09/31/1318620931.db2.gz	GIGJEXHXPHYDHF-AZUAARDMSA-N	0	3	340.467	3.034	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(F)cc2Cl)C1	ZINC001021728762	1318627251	/nfs/dbraw/zinc/62/72/51/1318627251.db2.gz	VSXDHOBYWIRWBC-CXAGYDPISA-N	0	3	334.822	3.039	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(F)cc2Cl)C1	ZINC001021728772	1318627675	/nfs/dbraw/zinc/62/76/75/1318627675.db2.gz	VSXDHOBYWIRWBC-SUMWQHHRSA-N	0	3	334.822	3.039	20	30		EGEDHN
CC1CC(C(=O)N2CCC[C@@H]2CN(C)Cc2ccc(C#N)cc2)C1	ZINC000960533711	1318652820	/nfs/dbraw/zinc/65/28/20/1318652820.db2.gz	IMSDCMNRXGGDCM-XUJQIHCRSA-N	0	3	325.456	3.027	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)CCc2cc(C)sc2C)C1	ZINC001021742576	1318654670	/nfs/dbraw/zinc/65/46/70/1318654670.db2.gz	GDFSSNHXSBLDFU-RBUKOAKNSA-N	0	3	344.524	3.244	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)/C=C/c1ccc[nH]1	ZINC000960581948	1318712895	/nfs/dbraw/zinc/71/28/95/1318712895.db2.gz	QHYYQBIVVXHMJM-CTDFXDFQSA-N	0	3	348.450	3.023	20	30		EGEDHN
Cc1cc(C(=O)N2CCC[C@@H]2CN(C)Cc2ccc(C#N)cc2)co1	ZINC000960589704	1318720239	/nfs/dbraw/zinc/72/02/39/1318720239.db2.gz	LGEIIULBGZFATH-LJQANCHMSA-N	0	3	337.423	3.196	20	30		EGEDHN
CCc1ccc(C#CC(=O)Nc2cc(CN(C)C)ccc2OC)cc1	ZINC000814485270	1318753558	/nfs/dbraw/zinc/75/35/58/1318753558.db2.gz	CWZWJLYNMZSKSJ-UHFFFAOYSA-N	0	3	336.435	3.309	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)C1(C2CC2)CC1	ZINC000960698030	1318798779	/nfs/dbraw/zinc/79/87/79/1318798779.db2.gz	DBJFCJCJDHYGKN-LJQANCHMSA-N	0	3	337.467	3.171	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H]1CN(C)Cc1cccc(C#N)c1)C1CCC1	ZINC000960701566	1318802903	/nfs/dbraw/zinc/80/29/03/1318802903.db2.gz	LTDHYWHXCODENN-UZLBHIALSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=CCC(F)(F)C(=O)NC[C@@H](c1cccc(OC)c1)N(CC)CC	ZINC000814875008	1318836588	/nfs/dbraw/zinc/83/65/88/1318836588.db2.gz	OASVPNCVCNWQDX-INIZCTEOSA-N	0	3	340.414	3.406	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]1CN(C)Cc1cccc(C#N)c1	ZINC000960785815	1318887071	/nfs/dbraw/zinc/88/70/71/1318887071.db2.gz	ARAFHUQYBVSRGF-GOSISDBHSA-N	0	3	325.456	3.193	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)[C@H]2CCC[C@@H]2CCC)C1	ZINC001022333172	1318894873	/nfs/dbraw/zinc/89/48/73/1318894873.db2.gz	NWWJDFILMLUFTK-XQLPTFJDSA-N	0	3	343.309	3.348	20	30		EGEDHN
C[C@H]1CCN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccccc1CC#N	ZINC000913101197	1318976299	/nfs/dbraw/zinc/97/62/99/1318976299.db2.gz	CABLVMQXWFNWNU-UWJYYQICSA-N	0	3	347.462	3.393	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H]1CN(C)Cc1ccc(C#N)cc1)C(C)(F)F	ZINC000960870842	1319014671	/nfs/dbraw/zinc/01/46/71/1319014671.db2.gz	UEDTXCBJAUVWMF-YOEHRIQHSA-N	0	3	349.425	3.272	20	30		EGEDHN
C[C@H]1CCCC[C@H]1C(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001022620884	1319020181	/nfs/dbraw/zinc/02/01/81/1319020181.db2.gz	SNSQTFSMLQKESA-VIBAHUMZSA-N	0	3	343.446	3.260	20	30		EGEDHN
C[C@@H]1CCC[C@H](C(=O)N[C@H]2C[C@@H](NCc3cc(C#N)ccc3F)C2)C1	ZINC001022623947	1319025411	/nfs/dbraw/zinc/02/54/11/1319025411.db2.gz	ZWHVWUDSXXDKIT-SIUPPRGNSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@@H](NCc3oc(CC)nc3C)C2)CC1	ZINC001022656206	1319047071	/nfs/dbraw/zinc/04/70/71/1319047071.db2.gz	XCTWYJJNZXANDZ-IYBDPMFKSA-N	0	3	331.460	3.029	20	30		EGEDHN
C[C@H]1CCC[C@@]1(C)C(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001022666778	1319057506	/nfs/dbraw/zinc/05/75/06/1319057506.db2.gz	RGWAZDZRVZWEDY-FVINJOMDSA-N	0	3	343.446	3.260	20	30		EGEDHN
Cc1cc(C#N)cnc1C(=O)OC[C@@H]1CCCCN1Cc1ccccc1	ZINC000816073981	1319097047	/nfs/dbraw/zinc/09/70/47/1319097047.db2.gz	MGJHAFDKUMWGGP-IBGZPJMESA-N	0	3	349.434	3.473	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2scnc2C(C)(C)C)C1	ZINC001022826741	1319127719	/nfs/dbraw/zinc/12/77/19/1319127719.db2.gz	TVAWOTSESKRKQD-PHIMTYICSA-N	0	3	327.881	3.044	20	30		EGEDHN
C[C@@H](C(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1)C1CCCC1	ZINC001022958250	1319187748	/nfs/dbraw/zinc/18/77/48/1319187748.db2.gz	HCUXSKFIDPTKBH-XWIAVFTESA-N	0	3	343.446	3.260	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)N1CCC[C@@H](C#N)C1)c1ccsc1	ZINC000914066255	1319223073	/nfs/dbraw/zinc/22/30/73/1319223073.db2.gz	RLQXLMHSFOAXQQ-GOEBONIOSA-N	0	3	334.489	3.076	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@H]([C@H]2CCN(CC#Cc3ccccc3)C2)C1	ZINC000961149291	1319270360	/nfs/dbraw/zinc/27/03/60/1319270360.db2.gz	WEQAFMAKQRVTCJ-SFTDATJTSA-N	0	3	338.495	3.255	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)C23CC(c4ccccc4)(C2)C3)C1	ZINC001023140267	1319282767	/nfs/dbraw/zinc/28/27/67/1319282767.db2.gz	ZSZCQYNXIDEALD-CCZBSFLLSA-N	0	3	330.859	3.098	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H](CNC(=O)C3C=CC=CC=C3)C2)cc1	ZINC001023395736	1319503079	/nfs/dbraw/zinc/50/30/79/1319503079.db2.gz	MASAFZZOICJACT-HXUWFJFHSA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cncc(-c3ccccc3)c2)C1	ZINC001023403701	1319512985	/nfs/dbraw/zinc/51/29/85/1319512985.db2.gz	NKWWSFSTLHESOL-SFHVURJKSA-N	0	3	347.462	3.214	20	30		EGEDHN
C[C@H](N[C@@H]1CC[C@H](C#N)C1)c1ccc(S(=O)(=O)C(F)F)cc1	ZINC000818356921	1319535761	/nfs/dbraw/zinc/53/57/61/1319535761.db2.gz	SPTJLAHTRKMCAB-GMXVVIOVSA-N	0	3	328.384	3.026	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@H]2CCCN(C[C@@H](F)CC)C2)cc1	ZINC001023448811	1319549629	/nfs/dbraw/zinc/54/96/29/1319549629.db2.gz	YQXIRIQEQCPEKM-AEFFLSMTSA-N	0	3	348.462	3.441	20	30		EGEDHN
C#CCN(C)CCCNC(=O)C1(c2c(Cl)cccc2Cl)CC1	ZINC000818606175	1319567966	/nfs/dbraw/zinc/56/79/66/1319567966.db2.gz	FWMVWRNHOAEKHU-UHFFFAOYSA-N	0	3	339.266	3.096	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2nc3ccccc3cc2C)C1	ZINC001023497690	1319605538	/nfs/dbraw/zinc/60/55/38/1319605538.db2.gz	IWNWSHARKPXQJO-QGZVFWFLSA-N	0	3	335.451	3.008	20	30		EGEDHN
Cc1ccsc1C(=O)NC1CC(CNCc2ccccc2C#N)C1	ZINC000961489150	1319613311	/nfs/dbraw/zinc/61/33/11/1319613311.db2.gz	PCEWIFJCZPHBLL-UHFFFAOYSA-N	0	3	339.464	3.226	20	30		EGEDHN
Cc1ccc(-c2csc(C(C#N)C(=O)c3cc[n+]([O-])cc3)n2)cc1	ZINC000916628281	1319688624	/nfs/dbraw/zinc/68/86/24/1319688624.db2.gz	PDEJPFKPKDENPJ-OAHLLOKOSA-N	0	3	335.388	3.242	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc(C(F)F)c(F)c2)C1	ZINC001023589022	1319711274	/nfs/dbraw/zinc/71/12/74/1319711274.db2.gz	QNVJBGIGKPPECK-CYBMUJFWSA-N	0	3	338.373	3.228	20	30		EGEDHN
N#CC(C(=O)NC1CCCCC1)C(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1	ZINC000916894919	1319721083	/nfs/dbraw/zinc/72/10/83/1319721083.db2.gz	CJHBHPBAKQDTIQ-ZACQAIPSSA-N	0	3	328.387	3.087	20	30		EGEDHN
CCOCC(=O)C(C#N)C(=O)Nc1ccccc1Oc1ccccc1	ZINC000916904364	1319723746	/nfs/dbraw/zinc/72/37/46/1319723746.db2.gz	BFOZJJUSJJWWJA-OAHLLOKOSA-N	0	3	338.363	3.163	20	30		EGEDHN
C=CCNC(=O)C(C#N)C(=O)CSc1cc(Cl)ccc1Cl	ZINC000916917760	1319725122	/nfs/dbraw/zinc/72/51/22/1319725122.db2.gz	NCONOIVMEVYFHS-SNVBAGLBSA-N	0	3	343.235	3.097	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2)C1	ZINC001023640781	1319762995	/nfs/dbraw/zinc/76/29/95/1319762995.db2.gz	MXWTTXYGOQUHOK-AYOQOUSVSA-N	0	3	344.886	3.295	20	30		EGEDHN
C=CCN1CCC[C@@H](CNC(=O)c2ncc(Cl)cc2Cl)C1	ZINC001023671481	1319787825	/nfs/dbraw/zinc/78/78/25/1319787825.db2.gz	HCMYXCBCSQGYCI-NSHDSACASA-N	0	3	328.243	3.016	20	30		EGEDHN
N#Cc1ccccc1CNCC1CC(NC(=O)[C@H]2CCCC23CC3)C1	ZINC000961987739	1319794989	/nfs/dbraw/zinc/79/49/89/1319794989.db2.gz	DEXMRECBDOYVNJ-XUJQIHCRSA-N	0	3	337.467	3.123	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccccc2C(F)(F)F)C1	ZINC001023715925	1319848483	/nfs/dbraw/zinc/84/84/83/1319848483.db2.gz	DHIIGTSWEBKYPB-CQSZACIVSA-N	0	3	338.373	3.171	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc(Cl)c(Cl)c2)C1	ZINC001023717105	1319849158	/nfs/dbraw/zinc/84/91/58/1319849158.db2.gz	CDTPPXQMWKJLJF-CYBMUJFWSA-N	0	3	339.266	3.459	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc(C(F)(F)F)cc2)C1	ZINC001023716991	1319850504	/nfs/dbraw/zinc/85/05/04/1319850504.db2.gz	ZDPZZRMBKMUXKW-AWEZNQCLSA-N	0	3	338.373	3.171	20	30		EGEDHN
N#Cc1ccccc1CNCC1CC(NC(=O)c2ccoc2C2CC2)C1	ZINC000962230052	1319870200	/nfs/dbraw/zinc/87/02/00/1319870200.db2.gz	QTLHJXDEALIRJN-UHFFFAOYSA-N	0	3	349.434	3.327	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc(C)n(C(C)C)c2C)C1	ZINC001023740322	1319886929	/nfs/dbraw/zinc/88/69/29/1319886929.db2.gz	DYLIGPDWPVXQBY-GOSISDBHSA-N	0	3	329.488	3.151	20	30		EGEDHN
CCc1ccoc1C(=O)NC1CC(CNCc2ccccc2C#N)C1	ZINC000962266632	1319891344	/nfs/dbraw/zinc/89/13/44/1319891344.db2.gz	HDKOHZVTWXBSIQ-UHFFFAOYSA-N	0	3	337.423	3.012	20	30		EGEDHN
C#CCNC(=O)[C@@H](C)N[C@@H](Cc1ccc(Cl)cc1)c1ccccc1	ZINC000918198461	1319932152	/nfs/dbraw/zinc/93/21/52/1319932152.db2.gz	KOYBLHHXTCNLBT-BEFAXECRSA-N	0	3	340.854	3.351	20	30		EGEDHN
COc1ccc(OC)c([C@H](O)CN(C)[C@H](C)c2cccc(C#N)c2)c1	ZINC000823617933	1320192829	/nfs/dbraw/zinc/19/28/29/1320192829.db2.gz	NTPVUHHXJVHIFP-AUUYWEPGSA-N	0	3	340.423	3.302	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)C#CC(C)(C)C)c1cccc(OC)c1	ZINC000837326935	1320597932	/nfs/dbraw/zinc/59/79/32/1320597932.db2.gz	UUPBOZQAPFMLHW-GOSISDBHSA-N	0	3	330.472	3.244	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N[C@@H](C)c1cc2ccccc2s1	ZINC000838350714	1320764085	/nfs/dbraw/zinc/76/40/85/1320764085.db2.gz	YOVBZGGZKOFNEX-AWEZNQCLSA-N	0	3	329.469	3.217	20	30		EGEDHN
C#Cc1ccc(CNCc2cc(F)c(N3CCOCC3)c(F)c2)cc1	ZINC000839146104	1320880758	/nfs/dbraw/zinc/88/07/58/1320880758.db2.gz	WMJNBMXZSBJJJR-UHFFFAOYSA-N	0	3	342.389	3.073	20	30		EGEDHN
Cc1ccc([C@@H](C)N[C@@H]2CCN(c3ccc(C#N)cc3)C2=O)s1	ZINC000839551618	1320936859	/nfs/dbraw/zinc/93/68/59/1320936859.db2.gz	DJGAWQVBISUBAZ-CZUORRHYSA-N	0	3	325.437	3.384	20	30		EGEDHN
Cc1ccc(CN2CC[C@@H](CNC(=O)OC(C)(C)C)C2)cc1C#N	ZINC000859113326	1328925812	/nfs/dbraw/zinc/92/58/12/1328925812.db2.gz	YAZMNRHVDAJIPM-INIZCTEOSA-N	0	3	329.444	3.213	20	30		EGEDHN
C=CCc1cc(C[N@@H+]2CCC[C@@H]2[C@@H]2CCC[C@H]2O)c([O-])c(OC)c1	ZINC000840121015	1321032218	/nfs/dbraw/zinc/03/22/18/1321032218.db2.gz	QDJHYHWYMNUYEC-RCCFBDPRSA-N	0	3	331.456	3.255	20	30		EGEDHN
C=CCc1cc(C[N@H+]2CCC[C@@H]2[C@@H]2CCC[C@H]2O)c([O-])c(OC)c1	ZINC000840121015	1321032224	/nfs/dbraw/zinc/03/22/24/1321032224.db2.gz	QDJHYHWYMNUYEC-RCCFBDPRSA-N	0	3	331.456	3.255	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)[C@H]2CCC(F)(F)C2)C1	ZINC001103068120	1365362736	/nfs/dbraw/zinc/36/27/36/1365362736.db2.gz	ARVKFLIQCNYKDC-KWCYVHTRSA-N	0	3	334.838	3.249	20	30		EGEDHN
C[C@@H](NC(=O)C1CCCCC1)C(=O)C(C#N)c1nc(C2CC2)cs1	ZINC000842941036	1321451990	/nfs/dbraw/zinc/45/19/90/1321451990.db2.gz	GXUIAIXLTDUQNN-BXUZGUMPSA-N	0	3	345.468	3.282	20	30		EGEDHN
CC(C)(C)OC(=O)C[C@@H]1CCCCN1C[C@H](O)c1ccc(C#N)cc1	ZINC000844427447	1321605578	/nfs/dbraw/zinc/60/55/78/1321605578.db2.gz	XWHWIJYQACQWBE-ROUUACIJSA-N	0	3	344.455	3.178	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(Cl)c(Cl)nc2C)CC1	ZINC000847452262	1321872664	/nfs/dbraw/zinc/87/26/64/1321872664.db2.gz	RZBNWCHKPHOZII-UHFFFAOYSA-N	0	3	328.243	3.077	20	30		EGEDHN
C#CCN(CC)C[C@H](O)CO[C@H](c1ccccc1)c1ccccc1C	ZINC000920096054	1322137144	/nfs/dbraw/zinc/13/71/44/1322137144.db2.gz	UZNNCQYRBJKKKL-RBBKRZOGSA-N	0	3	337.463	3.417	20	30		EGEDHN
CCO[C@@H](CC)C(=O)C(C#N)C(=O)Nc1c(CC)cccc1CC	ZINC000920109254	1322137687	/nfs/dbraw/zinc/13/76/87/1322137687.db2.gz	NDARZBCKCZJIQM-HOTGVXAUSA-N	0	3	330.428	3.274	20	30		EGEDHN
C[C@H](Cc1ccc(F)cc1)C(=O)C(C#N)C(=O)NC1CCCCC1	ZINC000921131061	1322260399	/nfs/dbraw/zinc/26/03/99/1322260399.db2.gz	GMNNZOSTYUTMPA-DYVFJYSZSA-N	0	3	330.403	3.162	20	30		EGEDHN
Cc1cc(C)cc(C(=O)NC2CC(CNCc3ccccc3C#N)C2)c1	ZINC000962590683	1323018665	/nfs/dbraw/zinc/01/86/65/1323018665.db2.gz	DLZPGXJHBMEQCA-UHFFFAOYSA-N	0	3	347.462	3.473	20	30		EGEDHN
C#C[C@](C)(CC)NCC(=O)N[C@H](c1cccs1)c1ccc(F)cc1	ZINC000852097114	1323145766	/nfs/dbraw/zinc/14/57/66/1323145766.db2.gz	LSFBJFIOSJFVSJ-RBUKOAKNSA-N	0	3	344.455	3.484	20	30		EGEDHN
CN(C(=O)C1CCC1)C1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC000962969010	1323177406	/nfs/dbraw/zinc/17/74/06/1323177406.db2.gz	XQPCMMGOOHRWRD-UHFFFAOYSA-N	0	3	343.446	3.357	20	30		EGEDHN
N#CC[C@@H]1CCCN(CC(=O)C(C#N)c2nc3ccccc3s2)C1	ZINC000852319645	1323179126	/nfs/dbraw/zinc/17/91/26/1323179126.db2.gz	QTXJONRPGWJPKY-UONOGXRCSA-N	0	3	338.436	3.098	20	30		EGEDHN
C=CCN(C[C@@H](O)c1ccccc1Br)[C@H](C)COC	ZINC000852356447	1323182955	/nfs/dbraw/zinc/18/29/55/1323182955.db2.gz	FFJPAMOSERAZCU-IUODEOHRSA-N	0	3	328.250	3.005	20	30		EGEDHN
CC(C)(C)OC(=O)NCC12CC(C1)CN2CCc1ccc(C#N)cc1	ZINC000852525637	1323204953	/nfs/dbraw/zinc/20/49/53/1323204953.db2.gz	ALPFPIFABBWPJX-UHFFFAOYSA-N	0	3	341.455	3.090	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@H]([C@H]2CCCN2Cc2ccccc2C#N)C1	ZINC000963260697	1323274109	/nfs/dbraw/zinc/27/41/09/1323274109.db2.gz	VTOZUXCZGGSBEM-VQTJNVASSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=CCCN1CCCC[C@H]1CNC(=O)c1cnc([C@H](C)OC)s1	ZINC001024439582	1323402413	/nfs/dbraw/zinc/40/24/13/1323402413.db2.gz	CWEOEHDBLUZDNV-KBPBESRZSA-N	0	3	337.489	3.011	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cccc([C@@H]2CCOC2)c1	ZINC001024515588	1323465813	/nfs/dbraw/zinc/46/58/13/1323465813.db2.gz	WEIAIWROSVZWLU-UXHICEINSA-N	0	3	342.483	3.351	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cnn(-c2ccccc2)c1	ZINC001024540849	1323482164	/nfs/dbraw/zinc/48/21/64/1323482164.db2.gz	OMWWLIVZRCGKMR-IBGZPJMESA-N	0	3	338.455	3.033	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@@H]1CCOc2c(F)cccc21	ZINC001024546241	1323487949	/nfs/dbraw/zinc/48/79/49/1323487949.db2.gz	WBKADODFINDBMV-NVXWUHKLSA-N	0	3	346.446	3.239	20	30		EGEDHN
C=CCCN1CCCC[C@H]1CNC(=O)c1scnc1C(F)F	ZINC001024549449	1323491774	/nfs/dbraw/zinc/49/17/74/1323491774.db2.gz	WAYSPXLOBPVJQQ-NSHDSACASA-N	0	3	329.416	3.241	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@H]1CCc2cc(F)ccc21	ZINC001024556364	1323496181	/nfs/dbraw/zinc/49/61/81/1323496181.db2.gz	FTEAQWBHCZVFTB-HKUYNNGSSA-N	0	3	330.447	3.402	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccccc1-n1cccc1	ZINC001024630774	1323556978	/nfs/dbraw/zinc/55/69/78/1323556978.db2.gz	WPCFNWBXSZNDFH-GOSISDBHSA-N	0	3	335.451	3.085	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccccc1-n1cccn1	ZINC001024673399	1323587211	/nfs/dbraw/zinc/58/72/11/1323587211.db2.gz	LLKRXKCHGYMRNS-KRWDZBQOSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=CCCN1CCCC[C@@H]1CNC(=O)c1oc(CC(C)C)nc1C	ZINC001024700050	1323615129	/nfs/dbraw/zinc/61/51/29/1323615129.db2.gz	WANHHIGXFNKYDQ-MRXNPFEDSA-N	0	3	333.476	3.342	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1cccn1C1CCCC1	ZINC001024732723	1323633867	/nfs/dbraw/zinc/63/38/67/1323633867.db2.gz	YBRIWIHMKHMZPR-SFHVURJKSA-N	0	3	327.472	3.211	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccnc(O[C@H](C)CC)c1	ZINC001024746927	1323647027	/nfs/dbraw/zinc/64/70/27/1323647027.db2.gz	JGUDTTVJICYHKA-AEFFLSMTSA-N	0	3	345.487	3.419	20	30		EGEDHN
C=C(C)CCN1CCCC[C@H]1CNC(=O)c1scnc1Cl	ZINC001024803024	1323706119	/nfs/dbraw/zinc/70/61/19/1323706119.db2.gz	DCDXCEIVMGXRBD-LBPRGKRZSA-N	0	3	327.881	3.347	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCCC[C@@H]1CNCc1cc(Cl)ccc1F	ZINC001024902753	1323773135	/nfs/dbraw/zinc/77/31/35/1323773135.db2.gz	ZTVBOBYINFOYCQ-SWLSCSKDSA-N	0	3	337.826	3.109	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H]2[C@@H]2CCCCN2C(=O)C(F)F)cc1	ZINC001025186162	1323956856	/nfs/dbraw/zinc/95/68/56/1323956856.db2.gz	XFXHUKZSGGNIFU-SJORKVTESA-N	0	3	347.409	3.169	20	30		EGEDHN
C=C(C)C[N@@H+]1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccccc1[O-]	ZINC001025200628	1323985391	/nfs/dbraw/zinc/98/53/91/1323985391.db2.gz	FOYKYIPEVURVCK-ROUUACIJSA-N	0	3	328.456	3.427	20	30		EGEDHN
C=C(C)C[N@H+]1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccccc1[O-]	ZINC001025200628	1323985398	/nfs/dbraw/zinc/98/53/98/1323985398.db2.gz	FOYKYIPEVURVCK-ROUUACIJSA-N	0	3	328.456	3.427	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ncc(F)cc1F	ZINC001025246345	1324045857	/nfs/dbraw/zinc/04/58/57/1324045857.db2.gz	WCXGHJNYIAIBLB-HZPDHXFCSA-N	0	3	335.398	3.005	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc(C)c(C)n1	ZINC001025252720	1324058816	/nfs/dbraw/zinc/05/88/16/1324058816.db2.gz	QIGJIGAIMBIZSI-WOJBJXKFSA-N	0	3	339.483	3.181	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(F)ccc1C	ZINC001025255490	1324062603	/nfs/dbraw/zinc/06/26/03/1324062603.db2.gz	QVHGGZSXIMBYNU-RTBURBONSA-N	0	3	328.431	3.226	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)C1CC2(CCC2)C1	ZINC001025257836	1324065704	/nfs/dbraw/zinc/06/57/04/1324065704.db2.gz	AJQNBJAVCPAUNW-RBUKOAKNSA-N	0	3	328.500	3.436	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccn(C(C)C)c1C	ZINC001025263659	1324074887	/nfs/dbraw/zinc/07/48/87/1324074887.db2.gz	PEDXUCYRBKCQDH-WOJBJXKFSA-N	0	3	341.499	3.470	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)C(C)(C)c1ccccc1	ZINC001025295484	1324125879	/nfs/dbraw/zinc/12/58/79/1324125879.db2.gz	GKIBDZOUZCVAPS-PMACEKPBSA-N	0	3	338.495	3.443	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)Cc1cccc(F)c1	ZINC001025297089	1324129216	/nfs/dbraw/zinc/12/92/16/1324129216.db2.gz	OBWLYWOKPZNYRH-WOJBJXKFSA-N	0	3	342.458	3.237	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cccc(C(F)F)c2F)C1	ZINC001025424936	1324257216	/nfs/dbraw/zinc/25/72/16/1324257216.db2.gz	JXCJGCFOQVKEQO-OLZOCXBDSA-N	0	3	338.373	3.227	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2oc(C(F)F)cc2C)C1	ZINC001025445400	1324285706	/nfs/dbraw/zinc/28/57/06/1324285706.db2.gz	MYBUTTKKBZGGOQ-KGLIPLIRSA-N	0	3	338.398	3.379	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N[C@@H](C)[C@H]1CCCN(CC#CC)C1	ZINC001025460427	1324303899	/nfs/dbraw/zinc/30/38/99/1324303899.db2.gz	HYBLBCQPEUVZSK-ROUUACIJSA-N	0	3	340.467	3.105	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)C2CCc3ccccc3CC2)C1	ZINC001025464520	1324310246	/nfs/dbraw/zinc/31/02/46/1324310246.db2.gz	QSWQYFPDKRBUSB-DYESRHJHSA-N	0	3	338.495	3.032	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(F)ccc2CC)C1	ZINC001025471978	1324316521	/nfs/dbraw/zinc/31/65/21/1324316521.db2.gz	LNVHFPIGRCVBBA-WBVHZDCISA-N	0	3	330.447	3.242	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2c(C)[nH]c3ccccc32)C1	ZINC001025480600	1324327410	/nfs/dbraw/zinc/32/74/10/1324327410.db2.gz	XZKDQWMGFVIBOO-RDJZCZTQSA-N	0	3	337.467	3.330	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2csc3ccccc23)C1	ZINC001025495927	1324346937	/nfs/dbraw/zinc/34/69/37/1324346937.db2.gz	LIMRGWDEHJVJFO-HUUCEWRRSA-N	0	3	326.465	3.365	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2c(F)ccc(F)c2Cl)C1	ZINC001025540751	1324389333	/nfs/dbraw/zinc/38/93/33/1324389333.db2.gz	YZEOOZNHMFHLBY-NWDGAFQWSA-N	0	3	340.801	3.082	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc3cc(F)ccc3o2)C1	ZINC001025550059	1324399610	/nfs/dbraw/zinc/39/96/10/1324399610.db2.gz	ZQHDGGQUMIPPIB-LSDHHAIUSA-N	0	3	342.414	3.426	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc3nc(C)ccc3c2)C1	ZINC001025564040	1324409721	/nfs/dbraw/zinc/40/97/21/1324409721.db2.gz	GZQLKIOHVOBKGP-FXAWDEMLSA-N	0	3	349.478	3.397	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(CC)c(C)s2)C1	ZINC001025614075	1324466409	/nfs/dbraw/zinc/46/64/09/1324466409.db2.gz	FZMCKIKOYQUCIR-YOEHRIQHSA-N	0	3	332.513	3.473	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2sc(C(C)C)nc2C)C1	ZINC001025618428	1324470733	/nfs/dbraw/zinc/47/07/33/1324470733.db2.gz	BGQYNDSRFDSLLF-UKRRQHHQSA-N	0	3	333.501	3.038	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cncc3ccccc32)C1	ZINC001025627419	1324479262	/nfs/dbraw/zinc/47/92/62/1324479262.db2.gz	JLVPDGCQZQUMHF-SJLPKXTDSA-N	0	3	335.451	3.088	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(C)c(F)c(C)c2)C1	ZINC001025629105	1324479808	/nfs/dbraw/zinc/47/98/08/1324479808.db2.gz	ZZKBOGPCTVKSII-IAGOWNOFSA-N	0	3	330.447	3.296	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2c[nH]c3c2cccc3CC)C1	ZINC001025630391	1324482131	/nfs/dbraw/zinc/48/21/31/1324482131.db2.gz	SEFSOHQLADWVIY-DOTOQJQBSA-N	0	3	337.467	3.194	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(-c3ccccc3)[nH]2)C1	ZINC001025633014	1324484453	/nfs/dbraw/zinc/48/44/53/1324484453.db2.gz	RNUZTDZGDXKDAP-SJLPKXTDSA-N	0	3	335.451	3.145	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(C(C)(F)F)cc2)C1	ZINC001025637507	1324489841	/nfs/dbraw/zinc/48/98/41/1324489841.db2.gz	UYXGKLFNPJBKBM-HOCLYGCPSA-N	0	3	334.410	3.262	20	30		EGEDHN
Cc1occc1C(=O)N1C[C@@H]2CC[C@@H](NCc3ccccc3C#N)[C@@H]2C1	ZINC001026193669	1324656032	/nfs/dbraw/zinc/65/60/32/1324656032.db2.gz	SZHHIWBKHQDYTH-DFQSSKMNSA-N	0	3	349.434	3.100	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H]2CC[C@H](NCc3nc(C)cs3)[C@H]2C1	ZINC001026325972	1324727768	/nfs/dbraw/zinc/72/77/68/1324727768.db2.gz	FVZFXWLCXBLYGV-JYJNAYRXSA-N	0	3	347.528	3.380	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H]2CC[C@H](NCc3nc(C)sc3C)[C@H]2C1	ZINC001026332489	1324733121	/nfs/dbraw/zinc/73/31/21/1324733121.db2.gz	NBVDWKXTRFZGGX-JYJNAYRXSA-N	0	3	347.528	3.299	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)CC2CCCC2)CC1	ZINC001026445346	1324809707	/nfs/dbraw/zinc/80/97/07/1324809707.db2.gz	HNXILAAGXNSDQU-UHFFFAOYSA-N	0	3	343.309	3.492	20	30		EGEDHN
C[C@H](C(=O)NC1CCC(NCc2ccccc2C#N)CC1)C1CC1	ZINC001026472466	1324830655	/nfs/dbraw/zinc/83/06/55/1324830655.db2.gz	GZMMOPGXTIXRJQ-YCMKEVRSSA-N	0	3	325.456	3.121	20	30		EGEDHN
C=C1CCC(C(=O)NC2CCC(NCc3ocnc3C)CC2)CC1	ZINC001026554300	1324890506	/nfs/dbraw/zinc/89/05/06/1324890506.db2.gz	VEMBIKGDMDFQJM-UHFFFAOYSA-N	0	3	331.460	3.246	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@H]1CCN(C(=O)c2ccsc2)C1	ZINC001026670321	1324964791	/nfs/dbraw/zinc/96/47/91/1324964791.db2.gz	VSYYKFBVKIMKRK-CYBMUJFWSA-N	0	3	343.427	3.011	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001026692063	1324980422	/nfs/dbraw/zinc/98/04/22/1324980422.db2.gz	LEVZCPQFVFULDS-AWEZNQCLSA-N	0	3	331.435	3.072	20	30		EGEDHN
CC(C(=O)N1CC[C@H](CNCc2cc(F)ccc2C#N)C1)=C1CCC1	ZINC001026835660	1325041019	/nfs/dbraw/zinc/04/10/19/1325041019.db2.gz	CAFISHSPFOWXIC-OAHLLOKOSA-N	0	3	341.430	3.136	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)c2cc[nH]c2C)C1	ZINC000963282028	1325063312	/nfs/dbraw/zinc/06/33/12/1325063312.db2.gz	NMJZHOMIKWLNRE-RDJZCZTQSA-N	0	3	335.879	3.392	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@@H](CNCc2cc(F)ccc2C#N)C1)C1CCC1	ZINC001026913374	1325075984	/nfs/dbraw/zinc/07/59/84/1325075984.db2.gz	IEXCTNXZLKDIHP-CABCVRRESA-N	0	3	343.446	3.072	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCN(C(=O)C23CCC(CC2)C3)C1	ZINC001026921074	1325084061	/nfs/dbraw/zinc/08/40/61/1325084061.db2.gz	LZZNRDFIGZNOOL-BQIYRTECSA-N	0	3	337.467	3.077	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](CNCc2csc(CC)n2)C1	ZINC001026988989	1325128590	/nfs/dbraw/zinc/12/85/90/1325128590.db2.gz	VCNLWPWFJLAIPB-AWEZNQCLSA-N	0	3	335.517	3.246	20	30		EGEDHN
CC1(C)CC[C@@H]1C(=O)N1CC[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001027009122	1325149389	/nfs/dbraw/zinc/14/93/89/1325149389.db2.gz	WRWSDPZKVUDZDT-KBXCAEBGSA-N	0	3	343.446	3.072	20	30		EGEDHN
CC(C)(C)OC(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1	ZINC000925478171	1325167697	/nfs/dbraw/zinc/16/76/97/1325167697.db2.gz	ULUDNQOQDXQLQI-UHFFFAOYSA-N	0	3	333.407	3.090	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](CNCc3csc(C)n3)C2)CC1	ZINC001027036798	1325170611	/nfs/dbraw/zinc/17/06/11/1325170611.db2.gz	IBRYRBYBPHWRQX-HNNXBMFYSA-N	0	3	333.501	3.136	20	30		EGEDHN
C[C@H](CC(C)(C)C#N)N[C@H](CO)c1ccc(Br)cc1	ZINC000925674588	1325258731	/nfs/dbraw/zinc/25/87/31/1325258731.db2.gz	SFCMLBICKOHQJV-BXUZGUMPSA-N	0	3	325.250	3.400	20	30		EGEDHN
Cc1ccoc1C(=O)N1CCC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001027300398	1325441751	/nfs/dbraw/zinc/44/17/51/1325441751.db2.gz	RCMMIPJMSACOAG-GOSISDBHSA-N	0	3	337.423	3.196	20	30		EGEDHN
CN(Cc1ccc(C#N)c(F)c1)[C@H]1CCCN(C(=O)CC2CCC2)C1	ZINC001027348318	1325514498	/nfs/dbraw/zinc/51/44/98/1325514498.db2.gz	YOPVJZJIKUUAIT-SFHVURJKSA-N	0	3	343.446	3.310	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)c(F)c2)C1	ZINC001027355791	1325531900	/nfs/dbraw/zinc/53/19/00/1325531900.db2.gz	AYMOPJJODOYTKQ-MYRMFFISSA-N	0	3	329.419	3.086	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)C[C@H](C)c2ccco2)cc1	ZINC000860472958	1329321683	/nfs/dbraw/zinc/32/16/83/1329321683.db2.gz	QSLHYMOSZKJJPA-SWLSCSKDSA-N	0	3	326.352	3.129	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)C(C)(C)c2ccc(Cl)cc2)C1	ZINC001027558408	1327865958	/nfs/dbraw/zinc/86/59/58/1327865958.db2.gz	VSOJCJYEIFPVSU-QGZVFWFLSA-N	0	3	332.875	3.174	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H](N(C)Cc3cccc(OC)c3)C2)C1	ZINC001027567048	1327895669	/nfs/dbraw/zinc/89/56/69/1327895669.db2.gz	QPSDNEDNHFFLKO-SFHVURJKSA-N	0	3	342.483	3.474	20	30		EGEDHN
C[C@@H]1C[C@H]([NH2+]CCNc2ccc(C#N)cn2)c2c1c(F)ccc2[O-]	ZINC000927164832	1327901802	/nfs/dbraw/zinc/90/18/02/1327901802.db2.gz	PIETXEALHWWQFF-RISCZKNCSA-N	0	3	326.375	3.048	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)[C@@H](F)c1ccccc1)C2	ZINC000965297008	1327975058	/nfs/dbraw/zinc/97/50/58/1327975058.db2.gz	TZACULNEUOUSDS-HVEGKCCWSA-N	0	3	336.838	3.467	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1coc(CC3CC3)n1)C2	ZINC000965635470	1328016212	/nfs/dbraw/zinc/01/62/12/1328016212.db2.gz	MZFWHJZGWLTZKO-UHFFFAOYSA-N	0	3	349.862	3.010	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2cscc2C(F)F)C1	ZINC000966165142	1328210815	/nfs/dbraw/zinc/21/08/15/1328210815.db2.gz	DLYFSYKATFULTQ-BXUZGUMPSA-N	0	3	326.412	3.149	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2c(F)ccc3ccncc32)C1	ZINC000966239604	1328235322	/nfs/dbraw/zinc/23/53/22/1328235322.db2.gz	WDEOGUJBELUDFX-RDTXWAMCSA-N	0	3	341.430	3.390	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2cn(C)c3ccc(F)cc23)C1	ZINC000966787646	1328412635	/nfs/dbraw/zinc/41/26/35/1328412635.db2.gz	QCPWQTIZOIHERC-KDOFPFPSSA-N	0	3	343.446	3.334	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2nc(C(C)(C)C)cs2)C1	ZINC000966874133	1328447544	/nfs/dbraw/zinc/44/75/44/1328447544.db2.gz	CSVSJVVEJYSLOM-UONOGXRCSA-N	0	3	335.517	3.457	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2cccc3c2CCCCC3)C1	ZINC000966888437	1328454908	/nfs/dbraw/zinc/45/49/08/1328454908.db2.gz	RNRJAQLFECHACU-LAUBAEHRSA-N	0	3	338.495	3.419	20	30		EGEDHN
C[C@H](CCc1cccc(F)c1)N1CCN(c2ccc(C#N)nc2)CC1	ZINC000862421753	1329485295	/nfs/dbraw/zinc/48/52/95/1329485295.db2.gz	GCDRFJRXJLBZEV-MRXNPFEDSA-N	0	3	338.430	3.236	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC2(C1)CCN(Cc1ccccc1F)CC2	ZINC001050618298	1348304088	/nfs/dbraw/zinc/30/40/88/1348304088.db2.gz	UYHJZIRFKCKIRE-UHFFFAOYSA-N	0	3	330.447	3.462	20	30		EGEDHN
CC[C@H](NC[C@@H](O)c1ccc(C#N)cc1)c1cc(F)ccc1OC	ZINC000932474819	1329817432	/nfs/dbraw/zinc/81/74/32/1329817432.db2.gz	MGCBGHMTLNOMDK-ZWKOTPCHSA-N	0	3	328.387	3.480	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1C[C@H](NCc2ccc(C#N)s2)[C@@H](C)C1	ZINC001054699157	1349441897	/nfs/dbraw/zinc/44/18/97/1349441897.db2.gz	FEIQJBGULYZHFV-BBRMVZONSA-N	0	3	333.501	3.238	20	30		EGEDHN
C[C@H]1CN(Cc2cccc(C#N)c2)CC[C@@H]1NC(=O)C1C=CC=CC=C1	ZINC000942090890	1331825415	/nfs/dbraw/zinc/82/54/15/1331825415.db2.gz	FJVHUUIMQHGYNZ-UWJYYQICSA-N	0	3	347.462	3.183	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3cccc(Cl)c3)CC2)[C@H](C)C1	ZINC000942107147	1331833416	/nfs/dbraw/zinc/83/34/16/1331833416.db2.gz	UPVLWEZIXMXWFC-QAPCUYQASA-N	0	3	344.886	3.222	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2scnc2C2CCCC2)[C@@H](C)C1	ZINC000942301223	1331898336	/nfs/dbraw/zinc/89/83/36/1331898336.db2.gz	CLLFJVMONAAFHA-GOEBONIOSA-N	0	3	345.512	3.264	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(OC)c(C(C)C)c2)[C@@H](C)C1	ZINC000942301308	1331898448	/nfs/dbraw/zinc/89/84/48/1331898448.db2.gz	FEPOBMPHCVIHLG-LPHOPBHVSA-N	0	3	342.483	3.282	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2sc(C)nc2CC(C)C)[C@H](C)C1	ZINC000942313692	1331900847	/nfs/dbraw/zinc/90/08/47/1331900847.db2.gz	LGOGLBGQXIAPQB-UKRRQHHQSA-N	0	3	335.517	3.276	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cccc(C)c2Cl)[C@H](C)C1	ZINC000942467988	1331941129	/nfs/dbraw/zinc/94/11/29/1331941129.db2.gz	VRAIURDRYSTSEB-WBVHZDCISA-N	0	3	332.875	3.041	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(Cc3ncccc3C)C[C@H]2C)cc1	ZINC000942552733	1331970816	/nfs/dbraw/zinc/97/08/16/1331970816.db2.gz	IKBCSJANHCECDX-YLJYHZDGSA-N	0	3	347.462	3.012	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCN(Cc3cncc(C)c3)C[C@H]2C)CC1	ZINC000942599889	1331997397	/nfs/dbraw/zinc/99/73/97/1331997397.db2.gz	HEGPFDBMELJXAN-YLJYHZDGSA-N	0	3	341.499	3.463	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCN(CCc3ccns3)C[C@H]2C)CC1	ZINC000942599988	1331997603	/nfs/dbraw/zinc/99/76/03/1331997603.db2.gz	IOXKVFYEBILTLP-QAPCUYQASA-N	0	3	347.528	3.259	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCN(Cc3ncccc3C)C[C@H]2C)CC1	ZINC000942600865	1331998340	/nfs/dbraw/zinc/99/83/40/1331998340.db2.gz	WDQGRLZQRIZKAG-MJGOQNOKSA-N	0	3	341.499	3.463	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3cccnc3C)C[C@@H]2C)C1	ZINC000942603390	1332001134	/nfs/dbraw/zinc/00/11/34/1332001134.db2.gz	WUFWSXKRPIYSRJ-MAUKXSAKSA-N	0	3	327.472	3.073	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccccc2OC2CCC2)[C@@H](C)C1	ZINC000942700125	1332022113	/nfs/dbraw/zinc/02/21/13/1332022113.db2.gz	NBEQRHKBXFANNW-QFBILLFUSA-N	0	3	340.467	3.081	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc(C(F)F)c(F)c2)[C@H](C)C1	ZINC000942822403	1332042624	/nfs/dbraw/zinc/04/26/24/1332042624.db2.gz	KJSVYGUPOGYWRQ-ABAIWWIYSA-N	0	3	326.362	3.390	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C(F)F)c(F)c2)[C@H](C)C1	ZINC000942823771	1332043149	/nfs/dbraw/zinc/04/31/49/1332043149.db2.gz	VSYLWUZMWBFTSV-WBMJQRKESA-N	0	3	338.373	3.227	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C(CC)CC)no2)[C@@H](C)C1	ZINC000943374653	1332161064	/nfs/dbraw/zinc/16/10/64/1332161064.db2.gz	ONDHNZLPDBYMOR-GOEBONIOSA-N	0	3	331.460	3.042	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccccc2OCC(C)C)[C@@H](C)C1	ZINC000943690510	1332239253	/nfs/dbraw/zinc/23/92/53/1332239253.db2.gz	SWSKFRRSFCEKLO-WMZOPIPTSA-N	0	3	330.472	3.348	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2sc(CC3CC3)nc2C)[C@@H](C)C1	ZINC000943771126	1332260981	/nfs/dbraw/zinc/26/09/81/1332260981.db2.gz	FDZJBYHVAQREHU-SWLSCSKDSA-N	0	3	333.501	3.030	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccc3ccsc32)[C@@H](C)C1	ZINC000943985879	1332304213	/nfs/dbraw/zinc/30/42/13/1332304213.db2.gz	BJGLZPRDBLXMCB-WMLDXEAASA-N	0	3	326.465	3.365	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2[nH]ccc2-c2ccccc2)[C@@H](C)C1	ZINC000944135243	1332332976	/nfs/dbraw/zinc/33/29/76/1332332976.db2.gz	JHXSBCVKOPRKBS-QFBILLFUSA-N	0	3	335.451	3.145	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(-c3ccccc3)cc2)[C@H](C)C1	ZINC000944530796	1332414427	/nfs/dbraw/zinc/41/44/27/1332414427.db2.gz	GWBWRVDKZQCRAN-UTKZUKDTSA-N	0	3	332.447	3.427	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2coc3cc(C)ccc23)[C@@H](C)C1	ZINC000944651123	1332421318	/nfs/dbraw/zinc/42/13/18/1332421318.db2.gz	DIPWIRFULAETIY-QFBILLFUSA-N	0	3	338.451	3.134	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(OCC(C)C)cc2)[C@@H](C)C1	ZINC000944652680	1332421903	/nfs/dbraw/zinc/42/19/03/1332421903.db2.gz	IYUQHWCEBLIGLD-FXAWDEMLSA-N	0	3	342.483	3.185	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(CCC)c(C)s2)[C@@H](C)C1	ZINC000944789932	1332424011	/nfs/dbraw/zinc/42/40/11/1332424011.db2.gz	MNEGXPQVRSXZIS-YOEHRIQHSA-N	0	3	332.513	3.473	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)n(C(C)C)c2C)[C@@H](C)C1	ZINC000944890681	1332445119	/nfs/dbraw/zinc/44/51/19/1332445119.db2.gz	MXKDPIHEMVLMCQ-HNAYVOBHSA-N	0	3	329.488	3.149	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cscc2C(F)(F)F)[C@H](C)C1	ZINC000946316004	1332786875	/nfs/dbraw/zinc/78/68/75/1332786875.db2.gz	ZHPQFCWSNHQLSQ-BXUZGUMPSA-N	0	3	344.402	3.230	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)C3C=CC=CC=C3)CC[C@@H]2C1	ZINC000946610282	1332862645	/nfs/dbraw/zinc/86/26/45/1332862645.db2.gz	MFFRKYGPWKEBSJ-HDICACEKSA-N	0	3	332.875	3.208	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@@H]3CCC[C@H]4C[C@H]43)CC[C@@H]2C1	ZINC000946652603	1332871037	/nfs/dbraw/zinc/87/10/37/1332871037.db2.gz	YATDDFFIGJCHMK-QXDIGNSFSA-N	0	3	336.907	3.346	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3occc3Cl)CC[C@@H]2C1	ZINC000946765302	1332895389	/nfs/dbraw/zinc/89/53/89/1332895389.db2.gz	LVDDRBADAVOSJH-BETUJISGSA-N	0	3	343.254	3.470	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@H](C)C2)co1	ZINC000947245266	1333063769	/nfs/dbraw/zinc/06/37/69/1333063769.db2.gz	ROOPOSPABRBZID-AUUYWEPGSA-N	0	3	337.423	3.243	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)C2C=CC=CC=C2)CCN1Cc1cccc(C#N)c1	ZINC000947360572	1333102318	/nfs/dbraw/zinc/10/23/18/1333102318.db2.gz	HBVSQQWTSRCGLD-DYESRHJHSA-N	0	3	347.462	3.326	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ncoc2-c2ccccc2)C[C@@H]1C	ZINC000947371563	1333107078	/nfs/dbraw/zinc/10/70/78/1333107078.db2.gz	ZWHOTIDSSFLKOV-HOCLYGCPSA-N	0	3	325.412	3.110	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3cccc(Cl)c3)CC2)C[C@@H]1C	ZINC000947370982	1333107204	/nfs/dbraw/zinc/10/72/04/1333107204.db2.gz	XDXWPNSIDIAMIN-YJBOKZPZSA-N	0	3	344.886	3.364	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(F)cc3ccoc32)C[C@@H]1C	ZINC000947468329	1333140113	/nfs/dbraw/zinc/14/01/13/1333140113.db2.gz	IQCBTCGVEAFELZ-BBRMVZONSA-N	0	3	328.387	3.178	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2[nH]c3ccccc3c2Cl)C[C@H]1C	ZINC000947497216	1333147172	/nfs/dbraw/zinc/14/71/72/1333147172.db2.gz	HGKSMADHINKAGK-ZIAGYGMSSA-N	0	3	343.858	3.427	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3c(cc(C)cc3C)[nH]2)C[C@H]1C	ZINC000947586070	1333182708	/nfs/dbraw/zinc/18/27/08/1333182708.db2.gz	VAQFGHMYLDQXDZ-IAGOWNOFSA-N	0	3	337.467	3.391	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3cc(Cl)ccc3[nH]2)C[C@H]1C	ZINC000947606099	1333190638	/nfs/dbraw/zinc/19/06/38/1333190638.db2.gz	BNUUGFYJPMMJFW-CZUORRHYSA-N	0	3	343.858	3.427	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(Cc3ncccc3C)[C@H](C)C2)cc1	ZINC000947611145	1333192186	/nfs/dbraw/zinc/19/21/86/1333192186.db2.gz	HONOCXYKDBFOKZ-YLJYHZDGSA-N	0	3	347.462	3.154	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)C2(C)CCC2)CCN1Cc1cccc(C#N)c1	ZINC000947612718	1333192541	/nfs/dbraw/zinc/19/25/41/1333192541.db2.gz	XNFIITHCSRZECQ-CRAIPNDOSA-N	0	3	325.456	3.218	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2oc3ccccc3c2OC)C[C@@H]1C	ZINC000947611832	1333192814	/nfs/dbraw/zinc/19/28/14/1333192814.db2.gz	QUPWGRXJYHLQPX-UONOGXRCSA-N	0	3	328.412	3.210	20	30		EGEDHN
Cc1ncccc1C(=O)N[C@H]1CCN(Cc2cccc(C#N)c2)[C@H](C)C1	ZINC000947669953	1333216826	/nfs/dbraw/zinc/21/68/26/1333216826.db2.gz	ANHGOVJAWCMIME-BEFAXECRSA-N	0	3	348.450	3.045	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2c(C)cc(C)cc2C)C[C@@H]1C	ZINC000947689942	1333224996	/nfs/dbraw/zinc/22/49/96/1333224996.db2.gz	OJOHOZLVGBTBED-RBUKOAKNSA-N	0	3	326.484	3.147	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cccc3sccc32)C[C@H]1C	ZINC000947778411	1333258720	/nfs/dbraw/zinc/25/87/20/1333258720.db2.gz	CJVGVRQAGUPOND-WBVHZDCISA-N	0	3	340.492	3.436	20	30		EGEDHN
Cc1cc(C(=O)N[C@H]2CCN(Cc3ccc(C#N)cc3)[C@@H](C)C2)ccn1	ZINC000947833481	1333273275	/nfs/dbraw/zinc/27/32/75/1333273275.db2.gz	UKJRBZCZTIXPAF-JXFKEZNVSA-N	0	3	348.450	3.045	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C(F)F)cc2F)C[C@H]1C	ZINC000947850360	1333279167	/nfs/dbraw/zinc/27/91/67/1333279167.db2.gz	ZKLIQBMNAQUIMO-TZMCWYRMSA-N	0	3	338.373	3.369	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2c[nH]nc2C2CCCCC2)C[C@H]1C	ZINC000947917532	1333306530	/nfs/dbraw/zinc/30/65/30/1333306530.db2.gz	XTIIEXOAVYMSRZ-NVXWUHKLSA-N	0	3	342.487	3.063	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C(C)(C)c2ccc(C)cc2)C[C@@H]1C	ZINC000947944532	1333314574	/nfs/dbraw/zinc/31/45/74/1333314574.db2.gz	WRFIRYPMIRMZJQ-PKOBYXMFSA-N	0	3	326.484	3.265	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2csc3c2CCCC3)C[C@H]1C	ZINC000948008134	1333340579	/nfs/dbraw/zinc/34/05/79/1333340579.db2.gz	ZYHSOPGKXHEFKJ-CABCVRRESA-N	0	3	330.497	3.233	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)n(C(C)C)c2C)C[C@@H]1C	ZINC000948017695	1333343794	/nfs/dbraw/zinc/34/37/94/1333343794.db2.gz	WOKSAUXNNFHRBL-YJBOKZPZSA-N	0	3	329.488	3.292	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2c[nH]c3c2cccc3CC)C[C@H]1C	ZINC000948069188	1333363931	/nfs/dbraw/zinc/36/39/31/1333363931.db2.gz	DBDRJNVGMYOHCR-WBVHZDCISA-N	0	3	337.467	3.336	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2coc(C3CCCCC3)n2)C[C@@H]1C	ZINC000948072880	1333365781	/nfs/dbraw/zinc/36/57/81/1333365781.db2.gz	FYCAZSDCTYZZAW-RDJZCZTQSA-N	0	3	343.471	3.328	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2ccc3nccc(C)c3c2)CC1	ZINC000948407559	1333513836	/nfs/dbraw/zinc/51/38/36/1333513836.db2.gz	DWXKQRKZGJCOGT-SFHVURJKSA-N	0	3	335.451	3.103	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2cccc(OCCC)c2)CC1	ZINC000948416965	1333517202	/nfs/dbraw/zinc/51/72/02/1333517202.db2.gz	UDZYVXMNFUWZKS-SFHVURJKSA-N	0	3	328.456	3.035	20	30		EGEDHN
C=CCn1cccc1C(=O)N(C)[C@H]1CCCN(C/C=C/Cl)CC1	ZINC000948439588	1333526548	/nfs/dbraw/zinc/52/65/48/1333526548.db2.gz	SFUFYJWJDHBADL-DHINHOHASA-N	0	3	335.879	3.353	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)Cc2cncc3ccccc32)CC1	ZINC000948445216	1333528879	/nfs/dbraw/zinc/52/88/79/1333528879.db2.gz	XJWULGICHUAIPP-HXUWFJFHSA-N	0	3	349.478	3.114	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2ccc3nc(C)oc3c2)CC1	ZINC000948456935	1333533237	/nfs/dbraw/zinc/53/32/37/1333533237.db2.gz	PFDMUGSHTSZOPY-KRWDZBQOSA-N	0	3	339.439	3.086	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@@H]2CCCN(Cc3cccnc3)CC2)cc1	ZINC000948665794	1333620999	/nfs/dbraw/zinc/62/09/99/1333620999.db2.gz	RKVZTCSMHOMQAZ-OAQYLSRUSA-N	0	3	347.462	3.190	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccccc2CC)CC1	ZINC000948726314	1333649141	/nfs/dbraw/zinc/64/91/41/1333649141.db2.gz	OHJWQOYSRPLFSK-SESVDKBCSA-N	0	3	338.495	3.299	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@H]2CCCN(Cc3cnoc3C)CC2)C1	ZINC000948753061	1333661773	/nfs/dbraw/zinc/66/17/73/1333661773.db2.gz	GBLAMKFUNURLAU-KRWDZBQOSA-N	0	3	331.460	3.152	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H]1CCC(C)=C(C)C1)CCO2	ZINC000949104673	1333778949	/nfs/dbraw/zinc/77/89/49/1333778949.db2.gz	KRDZETWNNFFYDM-GOSISDBHSA-N	0	3	332.488	3.002	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)CC3CCCCC3)CC2)C1	ZINC000949289611	1333816303	/nfs/dbraw/zinc/81/63/03/1333816303.db2.gz	NBVQLDFHOMAHBE-UHFFFAOYSA-N	0	3	334.504	3.226	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)CC3CC(C)(C)C3)CC2)C1	ZINC000949447187	1333849963	/nfs/dbraw/zinc/84/99/63/1333849963.db2.gz	MKOSXARRQDTBQI-UHFFFAOYSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC2(CC1)CN(CCC(=C)C)CCO2	ZINC000949463764	1333854274	/nfs/dbraw/zinc/85/42/74/1333854274.db2.gz	QYHCQRCNFIWOEY-LJQANCHMSA-N	0	3	334.504	3.248	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@@H]3C[C@]3(CC)C(C)C)CC2)C1	ZINC000949504926	1333862306	/nfs/dbraw/zinc/86/23/06/1333862306.db2.gz	XABXBWBPRBEETO-GHTZIAJQSA-N	0	3	348.531	3.328	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@H]3C[C@]3(CC)C(C)C)CC2)C1	ZINC000949504929	1333862840	/nfs/dbraw/zinc/86/28/40/1333862840.db2.gz	XABXBWBPRBEETO-WIYYLYMNSA-N	0	3	348.531	3.328	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C3CCC=CCC3)CC2)C1	ZINC000949529487	1333868682	/nfs/dbraw/zinc/86/86/82/1333868682.db2.gz	WDLFMSHKOFVWHS-UHFFFAOYSA-N	0	3	346.515	3.392	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)C2(C(F)(F)F)CC2)C12CCC2	ZINC001203435575	1370125187	/nfs/dbraw/zinc/12/51/87/1370125187.db2.gz	OSWDNRVYXCEFJW-MNOVXSKESA-N	0	3	336.785	3.098	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](C)[C@@H](NC(=O)c2ncc(Cl)s2)C1	ZINC000967355575	1335712054	/nfs/dbraw/zinc/71/20/54/1335712054.db2.gz	HOSOBSXSZSAOKU-NEPJUHHUSA-N	0	3	327.881	3.203	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccc(C)c3cccnc23)C1	ZINC000967410069	1335729463	/nfs/dbraw/zinc/72/94/63/1335729463.db2.gz	YFQAJHUAPGEVBY-VQIMIIECSA-N	0	3	335.451	3.007	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cnc3ccccc3c2C)C1	ZINC000967410020	1335729830	/nfs/dbraw/zinc/72/98/30/1335729830.db2.gz	XHCIUCMCWRWFKU-QRWLVFNGSA-N	0	3	335.451	3.007	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2oc3ccccc3c2OC)C1	ZINC000967726499	1335807879	/nfs/dbraw/zinc/80/78/79/1335807879.db2.gz	VYURUSISCKSYNB-GDBMZVCRSA-N	0	3	342.439	3.458	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2c(F)ccc(F)c2F)C1	ZINC000968105154	1335857609	/nfs/dbraw/zinc/85/76/09/1335857609.db2.gz	IJCIKTYJBOWDGT-BXUZGUMPSA-N	0	3	326.362	3.120	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2c(Cl)cncc2Cl)C1	ZINC000968211444	1335873094	/nfs/dbraw/zinc/87/30/94/1335873094.db2.gz	KZJQRSXGNFERAL-FZMZJTMJSA-N	0	3	342.270	3.405	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CN(CC3CC(F)(F)C3)CC[C@@H]2C)C1	ZINC000968273658	1335882155	/nfs/dbraw/zinc/88/21/55/1335882155.db2.gz	IJVBFDMVZCUTSM-DZGCQCFKSA-N	0	3	326.431	3.215	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)Cc2ccc(Cl)c(F)c2)C1	ZINC000968354274	1335899578	/nfs/dbraw/zinc/89/95/78/1335899578.db2.gz	PPUAUTCPLYCOKF-CXAGYDPISA-N	0	3	338.854	3.424	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)Cc2ccc(C(C)(C)C)cc2)C1	ZINC000968354463	1335899880	/nfs/dbraw/zinc/89/98/80/1335899880.db2.gz	SZOKSPGQAQDAER-PXNSSMCTSA-N	0	3	340.511	3.377	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2cc(Cl)cc(OC)c2)C1	ZINC000968456477	1335930789	/nfs/dbraw/zinc/93/07/89/1335930789.db2.gz	YWNGCQKDJLQZQA-SUMWQHHRSA-N	0	3	336.863	3.365	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)Cc2cccc(OCCC)c2)C1	ZINC000968517013	1335950014	/nfs/dbraw/zinc/95/00/14/1335950014.db2.gz	HLOYYJVXZAXOBV-YLJYHZDGSA-N	0	3	344.499	3.421	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)C(C)(C)c2ccc(C)cc2)C1	ZINC000968556554	1335960627	/nfs/dbraw/zinc/96/06/27/1335960627.db2.gz	BGIYSJFGUMPZQP-HKUYNNGSSA-N	0	3	326.484	3.123	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccccc2C(F)(F)F)C1	ZINC000968571271	1335965249	/nfs/dbraw/zinc/96/52/49/1335965249.db2.gz	XRKCJIDQYAMWLC-CJNGLKHVSA-N	0	3	338.373	3.169	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)Cc2c(F)cccc2Cl)C1	ZINC000968584138	1335973383	/nfs/dbraw/zinc/97/33/83/1335973383.db2.gz	STCKXAHOIRRKMO-DYVFJYSZSA-N	0	3	338.854	3.424	20	30		EGEDHN
CC[C@@H](N[C@@H]1CCN(C(=O)C#CC2CC2)C1)c1ccc(F)cc1F	ZINC000968617482	1335985425	/nfs/dbraw/zinc/98/54/25/1335985425.db2.gz	ADQPSARCEDWQRE-CRAIPNDOSA-N	0	3	332.394	3.020	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2ccc(OCC)c(OC)c2)C1	ZINC000968635118	1335991193	/nfs/dbraw/zinc/99/11/93/1335991193.db2.gz	FUBXQYCZQDPFIA-RDJZCZTQSA-N	0	3	346.471	3.110	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2cc(OC)c(OC)cc2C)C1	ZINC000968664821	1336001757	/nfs/dbraw/zinc/00/17/57/1336001757.db2.gz	JJQMSURGWZRMFA-YOEHRIQHSA-N	0	3	346.471	3.029	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)C2(c3cccc(C)c3)CC2)C1	ZINC000968682168	1336008677	/nfs/dbraw/zinc/00/86/77/1336008677.db2.gz	OXOTWUDGVIXXAW-MJGOQNOKSA-N	0	3	326.484	3.429	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)C(C)(C)c2ccccc2C)C1	ZINC000968698705	1336016086	/nfs/dbraw/zinc/01/60/86/1336016086.db2.gz	QTNSDIANVWYGFS-IEBWSBKVSA-N	0	3	326.484	3.123	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2ccc(N(C)CC)cc2)C1	ZINC000968701297	1336017210	/nfs/dbraw/zinc/01/72/10/1336017210.db2.gz	FOYQDBJJPANGFG-QFBILLFUSA-N	0	3	329.488	3.159	20	30		EGEDHN
N#Cc1ccc(CN2CCCCC[C@H]2CNC(=O)[C@@H]2CC2(F)F)cc1	ZINC000968853864	1336068851	/nfs/dbraw/zinc/06/88/51/1336068851.db2.gz	SICLHYXMRUAJGP-IRXDYDNUSA-N	0	3	347.409	3.074	20	30		EGEDHN
C#CCN1CCCCC[C@@H]1CNC(=O)c1cn(CC)c2ccccc12	ZINC000968941599	1336097752	/nfs/dbraw/zinc/09/77/52/1336097752.db2.gz	OXSZSLKHOPOZHB-QGZVFWFLSA-N	0	3	337.467	3.269	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1cnc2onc(C)c2c1	ZINC000968974388	1336106570	/nfs/dbraw/zinc/10/65/70/1336106570.db2.gz	RHQJOBJDFICVTN-INIZCTEOSA-N	0	3	342.443	3.082	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1ccc2ncccc2c1	ZINC000969011011	1336117985	/nfs/dbraw/zinc/11/79/85/1336117985.db2.gz	IRGJUICISVVZOV-IBGZPJMESA-N	0	3	335.451	3.233	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccc(N2CC=CC2)cc1	ZINC000969024655	1336120603	/nfs/dbraw/zinc/12/06/03/1336120603.db2.gz	CPXIQLQJBVDODF-HXUWFJFHSA-N	0	3	339.483	3.223	20	30		EGEDHN
N#Cc1cccc(CN2CCCCC[C@@H]2CNC(=O)[C@@H]2CC23CC3)c1	ZINC000969044487	1336126048	/nfs/dbraw/zinc/12/60/48/1336126048.db2.gz	RAJAAVYVSLRENK-MOPGFXCFSA-N	0	3	337.467	3.219	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cnccc1C(F)(F)F	ZINC000969049853	1336127879	/nfs/dbraw/zinc/12/78/79/1336127879.db2.gz	OWULLIWVDJALDM-CYBMUJFWSA-N	0	3	341.377	3.261	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cnn(CC2CCCC2)c1	ZINC000969090611	1336139492	/nfs/dbraw/zinc/13/94/92/1336139492.db2.gz	GDEXJWQEDULJLT-IBGZPJMESA-N	0	3	344.503	3.234	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccc(-c2c[nH]cn2)cc1	ZINC000969100796	1336143573	/nfs/dbraw/zinc/14/35/73/1336143573.db2.gz	IKQWKCWSMFFXKS-GOSISDBHSA-N	0	3	338.455	3.237	20	30		EGEDHN
C=CCOc1cccnc1C(=O)NC[C@H]1CCCCCN1CC(=C)C	ZINC000969108543	1336146965	/nfs/dbraw/zinc/14/69/65/1336146965.db2.gz	FKNYYGNWCMBIAO-QGZVFWFLSA-N	0	3	343.471	3.197	20	30		EGEDHN
C#CCCN1CCCCC[C@H]1CNC(=O)c1cc2[nH]ccc2s1	ZINC000969127065	1336152718	/nfs/dbraw/zinc/15/27/18/1336152718.db2.gz	RESGGNGBBXHMRR-AWEZNQCLSA-N	0	3	329.469	3.227	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cc(OC)c(C)c(OC)c1	ZINC000969135647	1336156606	/nfs/dbraw/zinc/15/66/06/1336156606.db2.gz	DBKYNJXAAATSTP-QGZVFWFLSA-N	0	3	346.471	3.173	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cc(Cl)cc2c1OCC2	ZINC000969160457	1336166977	/nfs/dbraw/zinc/16/69/77/1336166977.db2.gz	DCWQGFMZVSEREQ-MRXNPFEDSA-N	0	3	348.874	3.435	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)[C@@H]1Cc2c1cccc2Cl	ZINC000969165534	1336169020	/nfs/dbraw/zinc/16/90/20/1336169020.db2.gz	ZWHAMIOPOVEZGV-CRAIPNDOSA-N	0	3	344.886	3.364	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3ccc(OC)c(F)c3)C2)CC1	ZINC000969830661	1336251993	/nfs/dbraw/zinc/25/19/93/1336251993.db2.gz	QBHRFOROBCCMSN-QGZVFWFLSA-N	0	3	346.446	3.271	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)[C@@H]2CC=CC[C@H]2C(F)(F)F)CC1	ZINC001005590477	1336377052	/nfs/dbraw/zinc/37/70/52/1336377052.db2.gz	ZXGKSNNGUZUVOL-HUUCEWRRSA-N	0	3	330.394	3.240	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)C2CCN(Cc3cccc(OC)c3)CC2)C1	ZINC001005942847	1336427441	/nfs/dbraw/zinc/42/74/41/1336427441.db2.gz	MZHTZPGMQBVYIW-UHFFFAOYSA-N	0	3	342.483	3.474	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N(C)C1CCN(Cc2csc(C)c2)CC1	ZINC001006022659	1336438984	/nfs/dbraw/zinc/43/89/84/1336438984.db2.gz	OGOHMMYFZYTECR-MSOLQXFVSA-N	0	3	348.512	3.070	20	30		EGEDHN
CN(C(=O)[C@H]1CC12CCC2)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001006069810	1336446552	/nfs/dbraw/zinc/44/65/52/1336446552.db2.gz	HYFRCHNDSHBDBD-LJQANCHMSA-N	0	3	337.467	3.171	20	30		EGEDHN
C[C@@H]1CC[C@H](C(=O)N(C)C2CCN(Cc3ccc(C#N)cc3)CC2)C1	ZINC001006082068	1336448963	/nfs/dbraw/zinc/44/89/63/1336448963.db2.gz	JXALLSMNSKBIKR-APWZRJJASA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cnn(CC3CCCC3)c2)CC1	ZINC001006191831	1336464630	/nfs/dbraw/zinc/46/46/30/1336464630.db2.gz	HIAAUMHKHDICGV-UHFFFAOYSA-N	0	3	344.503	3.186	20	30		EGEDHN
C=C(C)CCN1CCC[C@H](NC(=O)c2coc(Br)c2)C1	ZINC001007452483	1336649427	/nfs/dbraw/zinc/64/94/27/1336649427.db2.gz	MMJXVUJVPFYXEO-ZDUSSCGKSA-N	0	3	341.249	3.203	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CCCN(Cc2ccccc2C)C1	ZINC001007503349	1336659671	/nfs/dbraw/zinc/65/96/71/1336659671.db2.gz	QKRPLTILNNHDOL-LJQANCHMSA-N	0	3	337.467	3.377	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2cc(-c3ccccc3)on2)C1	ZINC001007866559	1336721832	/nfs/dbraw/zinc/72/18/32/1336721832.db2.gz	DTHJQBAABGSQDU-INIZCTEOSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2ccccc2OC2CCC2)C1	ZINC001008478012	1336867052	/nfs/dbraw/zinc/86/70/52/1336867052.db2.gz	CBEGFZVHOHUWIH-INIZCTEOSA-N	0	3	328.456	3.388	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2c(F)ccc(F)c2Cl)C1	ZINC001008620159	1336894778	/nfs/dbraw/zinc/89/47/78/1336894778.db2.gz	GSIRWGCQMLGERB-LLVKDONJSA-N	0	3	328.790	3.389	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2cnn(C3CCCCC3)c2)C1	ZINC001009117510	1336971988	/nfs/dbraw/zinc/97/19/88/1336971988.db2.gz	REYWNQLPBGYLCQ-KRWDZBQOSA-N	0	3	330.476	3.159	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2ccnc(O[C@H](C)CC)c2)C1	ZINC001009135342	1336974355	/nfs/dbraw/zinc/97/43/55/1336974355.db2.gz	YQRLEALTQKQUPM-NVXWUHKLSA-N	0	3	331.460	3.029	20	30		EGEDHN
C#CCCN1CCC[C@H](NC(=O)c2ccc(Cl)c3occc32)C1	ZINC001009168833	1336980387	/nfs/dbraw/zinc/98/03/87/1336980387.db2.gz	QSQPOZLFOIBPBX-ZDUSSCGKSA-N	0	3	330.815	3.304	20	30		EGEDHN
C#CCCN1CCC[C@@H](NC(=O)c2ccc(Cl)c3occc32)C1	ZINC001009168831	1336980408	/nfs/dbraw/zinc/98/04/08/1336980408.db2.gz	QSQPOZLFOIBPBX-CYBMUJFWSA-N	0	3	330.815	3.304	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)Cc2c[nH]c3cccc(C)c23)C1	ZINC001009245031	1336990098	/nfs/dbraw/zinc/99/00/98/1336990098.db2.gz	ITEWLYKSTQKDCS-QGZVFWFLSA-N	0	3	325.456	3.176	20	30		EGEDHN
C=C(C)CCN1CC[C@H](NC(=O)c2c(F)c(F)cc(F)c2F)C1	ZINC001014533795	1337811675	/nfs/dbraw/zinc/81/16/75/1337811675.db2.gz	SHPOYEQOOMZTHQ-JTQLQIEISA-N	0	3	330.325	3.013	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)[C@@H]2[C@@H](c3ccccc3)C2(C)C)CC1	ZINC001016625145	1338668719	/nfs/dbraw/zinc/66/87/19/1338668719.db2.gz	DQGUBPURCLMBEV-OTWHNJEPSA-N	0	3	336.479	3.030	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)C2C3CC4CC(C3)CC2C4)CC1	ZINC001016663134	1338683860	/nfs/dbraw/zinc/68/38/60/1338683860.db2.gz	PMIDPAUCCIXOBT-BIKXEMDZSA-N	0	3	340.511	3.053	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cc(F)cc3ccoc32)CC1	ZINC001016698213	1338694840	/nfs/dbraw/zinc/69/48/40/1338694840.db2.gz	KAZZRDYQYFLCFM-KRWDZBQOSA-N	0	3	340.398	3.180	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccc(Cl)cc2F)CC1	ZINC001016717828	1338701271	/nfs/dbraw/zinc/70/12/71/1338701271.db2.gz	WCTQKFASRJTUAF-MRXNPFEDSA-N	0	3	334.822	3.087	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2nc3ccccc3cc2C)CC1	ZINC001016737597	1338707590	/nfs/dbraw/zinc/70/75/90/1338707590.db2.gz	XOFPGKOFSRQNDC-LJQANCHMSA-N	0	3	347.462	3.151	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)C2CC(C)(C)CC(C)(C)C2)CC1	ZINC001016744243	1338709424	/nfs/dbraw/zinc/70/94/24/1338709424.db2.gz	GBYXDODGCGGRDF-QGZVFWFLSA-N	0	3	330.516	3.443	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2c(Cl)oc3ccccc32)CC1	ZINC001016790881	1338727962	/nfs/dbraw/zinc/72/79/62/1338727962.db2.gz	QPEPSTMJBYXXRF-HNNXBMFYSA-N	0	3	342.826	3.304	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)C(C2CCC2)C2CCC2)CC1	ZINC001016798692	1338731064	/nfs/dbraw/zinc/73/10/64/1338731064.db2.gz	RVTXNOKVJAEYCQ-GOSISDBHSA-N	0	3	328.500	3.197	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CC23CCN(Cc2ncccc2C)CC3)C1	ZINC001016812721	1338734992	/nfs/dbraw/zinc/73/49/92/1338734992.db2.gz	RVGHLFZBXIYWHS-GOSISDBHSA-N	0	3	339.483	3.217	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)[C@@H]2C[C@H]2c2cccc(C)c2)CC1	ZINC001016872706	1338754465	/nfs/dbraw/zinc/75/44/65/1338754465.db2.gz	KNBMRKMVHKJCNA-XUVXKRRUSA-N	0	3	336.479	3.093	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)[C@@]2(C)C[C@@H]2c2ccccc2)CC1	ZINC001016874855	1338755112	/nfs/dbraw/zinc/75/51/12/1338755112.db2.gz	ZRSIFVVCJFWTFD-SBHAEUEKSA-N	0	3	336.479	3.174	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(C)c(C)c2Cl)CC1	ZINC001016924709	1338771644	/nfs/dbraw/zinc/77/16/44/1338771644.db2.gz	XGHVBEIDWICABJ-INIZCTEOSA-N	0	3	330.859	3.174	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccc3ccccc3c2)CC1	ZINC001016946138	1338779788	/nfs/dbraw/zinc/77/97/88/1338779788.db2.gz	ISFJXZCZIXORHD-FQEVSTJZSA-N	0	3	332.447	3.447	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCCN(C(=O)CC2(C)CC2)C1	ZINC001017164241	1338912281	/nfs/dbraw/zinc/91/22/81/1338912281.db2.gz	VXRRZFUTTNCFPD-OAHLLOKOSA-N	0	3	345.512	3.480	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](CN(C)Cc2oc(C)nc2C)C1	ZINC001017179774	1338924265	/nfs/dbraw/zinc/92/42/65/1338924265.db2.gz	OIAJGVZVUBRYAF-INIZCTEOSA-N	0	3	333.476	3.174	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H](CN(C)Cc2ccccn2)C1	ZINC001017201352	1338945695	/nfs/dbraw/zinc/94/56/95/1338945695.db2.gz	IHHOWCATYICVTC-YLJYHZDGSA-N	0	3	329.488	3.354	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H](CN(C)Cc2ocnc2C)C1	ZINC001017201550	1338946462	/nfs/dbraw/zinc/94/64/62/1338946462.db2.gz	KLTJDPTWLRGWAK-LPHOPBHVSA-N	0	3	333.476	3.256	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@@H](CN(C)Cc3ccc(C#N)s3)C2)CC1	ZINC001017200569	1338946477	/nfs/dbraw/zinc/94/64/77/1338946477.db2.gz	ATHBSFWJNLMDKT-HNNXBMFYSA-N	0	3	345.512	3.480	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H](CN(C)Cc2ocnc2C)C1	ZINC001017201551	1338946971	/nfs/dbraw/zinc/94/69/71/1338946971.db2.gz	KLTJDPTWLRGWAK-QFBILLFUSA-N	0	3	333.476	3.256	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H](CN(C)Cc3cnc(C)s3)C2)C1	ZINC001017207792	1338953779	/nfs/dbraw/zinc/95/37/79/1338953779.db2.gz	OWCBYLGBTUUVSM-INIZCTEOSA-N	0	3	347.528	3.478	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCCN(C(=O)[C@H]2CC23CC3)C1	ZINC001017217356	1338958953	/nfs/dbraw/zinc/95/89/53/1338958953.db2.gz	HXKZJUOGJOJSHN-RHSMWYFYSA-N	0	3	343.496	3.090	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cccc2c1CCOC2	ZINC001017726692	1339404414	/nfs/dbraw/zinc/40/44/14/1339404414.db2.gz	QANJAUHNJUBRPR-HDICACEKSA-N	0	3	340.467	3.014	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H]1CCOc2ccccc21	ZINC001017791519	1339422205	/nfs/dbraw/zinc/42/22/05/1339422205.db2.gz	XLIARWFDPHGJCX-OKZBNKHCSA-N	0	3	340.467	3.194	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cc(C)cc2cn[nH]c21	ZINC001018059427	1339492467	/nfs/dbraw/zinc/49/24/67/1339492467.db2.gz	NGSGHAVEUYGCBA-CALCHBBNSA-N	0	3	338.455	3.126	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cc(C)cc2c[nH]nc21	ZINC001018059427	1339492470	/nfs/dbraw/zinc/49/24/70/1339492470.db2.gz	NGSGHAVEUYGCBA-CALCHBBNSA-N	0	3	338.455	3.126	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)COc1ccccc1CC	ZINC001018232980	1339542421	/nfs/dbraw/zinc/54/24/21/1339542421.db2.gz	BAKBMUCUSIXARK-KDURUIRLSA-N	0	3	342.483	3.269	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](OC)c1ccc(F)cc1	ZINC001018327861	1339579319	/nfs/dbraw/zinc/57/93/19/1339579319.db2.gz	ZJPBPLAKXWGDFG-OTWHNJEPSA-N	0	3	346.446	3.155	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)CC3CCCCC3)C2)cc1F	ZINC001018467085	1339631083	/nfs/dbraw/zinc/63/10/83/1339631083.db2.gz	CXVOIKUTXXDJMG-SFHVURJKSA-N	0	3	343.446	3.358	20	30		EGEDHN
CC(C)(CC(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)C1)C1CC1	ZINC001018812440	1339733258	/nfs/dbraw/zinc/73/32/58/1339733258.db2.gz	OPPWWQYCCJDUAQ-KRWDZBQOSA-N	0	3	343.446	3.214	20	30		EGEDHN
Cc1sccc1C(=O)N1CC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001018817210	1339733531	/nfs/dbraw/zinc/73/35/31/1339733531.db2.gz	KCNZZDHLIXERJF-HNNXBMFYSA-N	0	3	343.427	3.072	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@@H]2CCCN2[C@H](C)c2ccccc2)c1	ZINC001028129221	1340447513	/nfs/dbraw/zinc/44/75/13/1340447513.db2.gz	MUCVDTVKPOGBHH-UZLBHIALSA-N	0	3	333.435	3.018	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@@H]2CCCN2[C@@H](C)c2ccccc2)c1	ZINC001028129215	1340447635	/nfs/dbraw/zinc/44/76/35/1340447635.db2.gz	MUCVDTVKPOGBHH-JXFKEZNVSA-N	0	3	333.435	3.018	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1ccc(C(F)(F)F)cc1	ZINC001028281959	1340536931	/nfs/dbraw/zinc/53/69/31/1340536931.db2.gz	SBVJIBHEXGXGOU-OAHLLOKOSA-N	0	3	326.362	3.476	20	30		EGEDHN
CCc1ccccc1C(=O)NC[C@@H]1CCN(Cc2ccc(C#N)cc2)C1	ZINC001028767766	1340799834	/nfs/dbraw/zinc/79/98/34/1340799834.db2.gz	JXPJGBLJISXAJN-IBGZPJMESA-N	0	3	347.462	3.373	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CCN(Cc3ccc(C)nc3C)C2)CC1	ZINC001028780325	1340811735	/nfs/dbraw/zinc/81/17/35/1340811735.db2.gz	HEDCRYJDDLMUNG-SFHVURJKSA-N	0	3	341.499	3.383	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CCN(Cc3cnccc3C)C2)CC1	ZINC001028781443	1340813633	/nfs/dbraw/zinc/81/36/33/1340813633.db2.gz	WIHWVCZNCOGERQ-KRWDZBQOSA-N	0	3	327.472	3.075	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](CNC(=O)C3CCC(F)CC3)C2)cc1	ZINC001028782535	1340814561	/nfs/dbraw/zinc/81/45/61/1340814561.db2.gz	RRBYSJSNMLLJAG-LMDPOFIKSA-N	0	3	343.446	3.025	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](CNC(=O)[C@]34C[C@H]3CCCC4)C2)cc1	ZINC001028791805	1340824135	/nfs/dbraw/zinc/82/41/35/1340824135.db2.gz	VFJDLGFWOKVHMB-SFHLNBCPSA-N	0	3	337.467	3.077	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)c2ccc(Cl)cc2Cl)C1	ZINC001028948370	1340891218	/nfs/dbraw/zinc/89/12/18/1340891218.db2.gz	LYGZIUYHVGNDHP-GFCCVEGCSA-N	0	3	325.239	3.068	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@@H]2CCN(Cc3ccc(C#N)cc3)C2)cc1C	ZINC001028966476	1340895753	/nfs/dbraw/zinc/89/57/53/1340895753.db2.gz	CDOXYKGBAPKFJJ-FQEVSTJZSA-N	0	3	347.462	3.427	20	30		EGEDHN
CC(C)C(=O)N1CCC([C@H](C)NCc2cc(F)ccc2C#N)CC1	ZINC001029053793	1340919946	/nfs/dbraw/zinc/91/99/46/1340919946.db2.gz	ZYPDQXMLGVDKGP-AWEZNQCLSA-N	0	3	331.435	3.070	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC([C@@H](C)NCc2ocnc2C)CC1	ZINC001029126463	1340936383	/nfs/dbraw/zinc/93/63/83/1340936383.db2.gz	TUAVZKLPTTZUBK-CQSZACIVSA-N	0	3	333.476	3.302	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CCC([C@@H](C)NCc2cc(F)ccc2C#N)CC1	ZINC001029129623	1340937694	/nfs/dbraw/zinc/93/76/94/1340937694.db2.gz	XVKPHBXGDUYOSV-FZKQIMNGSA-N	0	3	349.425	3.162	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CC[C@@H](C1)N2CC[C@@H]1CCCCO1	ZINC001029419599	1340986180	/nfs/dbraw/zinc/98/61/80/1340986180.db2.gz	HDUJMLKZASHNFQ-KSZLIROESA-N	0	3	334.504	3.223	20	30		EGEDHN
C#Cc1cncc(C(=O)N2C[C@H]3CC[C@@H](C2)N3CCC2=CCCCC2)c1	ZINC001029466462	1340997093	/nfs/dbraw/zinc/99/70/93/1340997093.db2.gz	BEWZBAQDZRHXAI-OYRHEFFESA-N	0	3	349.478	3.242	20	30		EGEDHN
Cc1cccc(Cl)c1CN(C)C[C@@H]1CCN(C(=O)[C@H](C)C#N)C1	ZINC001029676485	1341040430	/nfs/dbraw/zinc/04/04/30/1341040430.db2.gz	BXANQOIQKZLMID-CABCVRRESA-N	0	3	333.863	3.088	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC(CN(C)Cc2cnc(C)nc2)CC1	ZINC001029983069	1341143815	/nfs/dbraw/zinc/14/38/15/1341143815.db2.gz	USYVHPZFGFQYOB-UHFFFAOYSA-N	0	3	344.503	3.058	20	30		EGEDHN
C#Cc1ccc(C(=O)NCC2CN(CC[C@H]3CCCC3(F)F)C2)cc1	ZINC001031892039	1341417503	/nfs/dbraw/zinc/41/75/03/1341417503.db2.gz	JXFGZSZCBZHUSL-GOSISDBHSA-N	0	3	346.421	3.155	20	30		EGEDHN
C=C1CCC(C(=O)NCC2CN(CCc3ccc(C)cc3)C2)CC1	ZINC001031951846	1341430346	/nfs/dbraw/zinc/43/03/46/1341430346.db2.gz	QPCUTCCHDSGZJX-UHFFFAOYSA-N	0	3	326.484	3.332	20	30		EGEDHN
C=CCn1cccc1C(=O)N1C[C@@H]2C[C@H]1CN2CCC1CCCC1	ZINC001032447597	1341512859	/nfs/dbraw/zinc/51/28/59/1341512859.db2.gz	QRFGBIHMXRZVNG-ROUUACIJSA-N	0	3	327.472	3.153	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N1C[C@@H]2C[C@H]1CN2CC1CCC(C)(C)CC1	ZINC001032638419	1341566439	/nfs/dbraw/zinc/56/64/39/1341566439.db2.gz	XMGSYLNZFOAJRU-OKYOBFRVSA-N	0	3	346.515	3.079	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)CCc1nc2ccccc2o1	ZINC001032776996	1341611267	/nfs/dbraw/zinc/61/12/67/1341611267.db2.gz	JAOSMIOJNDHRAA-HOTGVXAUSA-N	0	3	339.439	3.012	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)CCc1ccc(CC)cc1	ZINC001032778606	1341611552	/nfs/dbraw/zinc/61/15/52/1341611552.db2.gz	AJPOIUYKPFJTQP-PMACEKPBSA-N	0	3	326.484	3.433	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2cc3c([nH]2)c(F)ccc3C)C1	ZINC001033203026	1341751758	/nfs/dbraw/zinc/75/17/58/1341751758.db2.gz	AYYXXRKQYQKGOG-AWEZNQCLSA-N	0	3	329.419	3.338	20	30		EGEDHN
C=CCOc1ccc(C(=O)N(C)[C@H]2CCN(CC=C(C)C)C2)cc1	ZINC001033204237	1341752248	/nfs/dbraw/zinc/75/22/48/1341752248.db2.gz	QDBGNVGGCYSBOW-SFHVURJKSA-N	0	3	328.456	3.364	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2cnc3c(F)cccc3c2)C1	ZINC001033268636	1341764197	/nfs/dbraw/zinc/76/41/97/1341764197.db2.gz	DDFRZVXVBJLGCS-INIZCTEOSA-N	0	3	327.403	3.096	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)C2(c3cccc(F)c3)CCC2)C1	ZINC001033314674	1341777940	/nfs/dbraw/zinc/77/79/40/1341777940.db2.gz	AUPCGELPPDLVAQ-GOSISDBHSA-N	0	3	330.447	3.356	20	30		EGEDHN
C#CCCN1CC[C@H](N(C)C(=O)c2c(Cl)oc3ccccc32)C1	ZINC001033355050	1341794115	/nfs/dbraw/zinc/79/41/15/1341794115.db2.gz	URZXIBUXBPMDKA-ZDUSSCGKSA-N	0	3	330.815	3.256	20	30		EGEDHN
C=C1CCC(C(=O)N(C)[C@H]2CCN(C[C@@H]3CC(C)(C)CO3)C2)CC1	ZINC001033388284	1341807438	/nfs/dbraw/zinc/80/74/38/1341807438.db2.gz	AVRMKZBFZFKNSG-ROUUACIJSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2ccc(OC)c(C3CC3)c2)C1	ZINC001033535628	1341862221	/nfs/dbraw/zinc/86/22/21/1341862221.db2.gz	DDJOFEFRFWCOID-KRWDZBQOSA-N	0	3	328.456	3.295	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)[C@@]2(c3ccccc3)C[C@H](F)C2)C1	ZINC001033629864	1341911120	/nfs/dbraw/zinc/91/11/20/1341911120.db2.gz	QYZYPGZETDHZNN-BJLQDIEVSA-N	0	3	330.447	3.165	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)Cc2ccc(OC(C)C)cc2)C1	ZINC001033678707	1341946015	/nfs/dbraw/zinc/94/60/15/1341946015.db2.gz	MMYLERJIHAITSP-SFHVURJKSA-N	0	3	330.472	3.125	20	30		EGEDHN
C=CCCN1CC[C@@H](N(CC)C(=O)c2sc(Cl)nc2C)C1	ZINC001033846026	1342042069	/nfs/dbraw/zinc/04/20/69/1342042069.db2.gz	KFHQJUZXRKAJHA-GFCCVEGCSA-N	0	3	327.881	3.217	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cc(Cl)c(Cl)n2C)C1	ZINC001033848451	1342043172	/nfs/dbraw/zinc/04/31/72/1342043172.db2.gz	MLYWLUYTASFFEO-LBPRGKRZSA-N	0	3	344.286	3.444	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cc(Cl)c(Cl)n2C)C1	ZINC001033848448	1342043269	/nfs/dbraw/zinc/04/32/69/1342043269.db2.gz	MLYWLUYTASFFEO-GFCCVEGCSA-N	0	3	344.286	3.444	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2ccc3cc(C)ccc3n2)C1	ZINC001033891648	1342064819	/nfs/dbraw/zinc/06/48/19/1342064819.db2.gz	DYCHNLICWQICCG-SFHVURJKSA-N	0	3	335.451	3.103	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)[C@@H]2C[C@H]2c2ccccc2CC)C1	ZINC001033938565	1342100999	/nfs/dbraw/zinc/10/09/99/1342100999.db2.gz	YNUDIARMWNKYBK-SESVDKBCSA-N	0	3	338.495	3.299	20	30		EGEDHN
C#Cc1cncc(C(=O)N(CC)[C@H]2CCN(CC3=CCCCC3)C2)c1	ZINC001033955458	1342112035	/nfs/dbraw/zinc/11/20/35/1342112035.db2.gz	LHWJPBGEHZIDFG-FQEVSTJZSA-N	0	3	337.467	3.100	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccc(OC)cc2Cl)C1	ZINC001033989292	1342132662	/nfs/dbraw/zinc/13/26/62/1342132662.db2.gz	YIDKEPRTYXTRJH-CQSZACIVSA-N	0	3	336.863	3.461	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccnc(OC3CCC3)c2)C1	ZINC001033997924	1342137811	/nfs/dbraw/zinc/13/78/11/1342137811.db2.gz	IYNVLRKHSDVCCJ-QGZVFWFLSA-N	0	3	343.471	3.125	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cn(CCCC)nc2C)C1	ZINC001034014792	1342152152	/nfs/dbraw/zinc/15/21/52/1342152152.db2.gz	CUNHIJGLYRNEEF-KRWDZBQOSA-N	0	3	332.492	3.104	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cn(CCCC)nc2C)C1	ZINC001034014794	1342152335	/nfs/dbraw/zinc/15/23/35/1342152335.db2.gz	CUNHIJGLYRNEEF-QGZVFWFLSA-N	0	3	332.492	3.104	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccc(OCC)c(OC)c2)C1	ZINC001034038223	1342178043	/nfs/dbraw/zinc/17/80/43/1342178043.db2.gz	QRZNMLRIQBEECQ-QGZVFWFLSA-N	0	3	346.471	3.206	20	30		EGEDHN
CC(C)(C)C(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C12CCC2	ZINC001078788812	1357084710	/nfs/dbraw/zinc/08/47/10/1357084710.db2.gz	MIUCLNOCZXAXHQ-SJORKVTESA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@@H]2CC[C@H](c3ccccc3)O2)C1	ZINC001034210896	1342321445	/nfs/dbraw/zinc/32/14/45/1342321445.db2.gz	VIZJMENWKOQAFU-ZCNNSNEGSA-N	0	3	342.483	3.454	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@H]2COc3cc(C)c(C)cc32)C1	ZINC001034330094	1342404280	/nfs/dbraw/zinc/40/42/80/1342404280.db2.gz	KRFKXVPABHSMOW-HKUYNNGSSA-N	0	3	342.483	3.326	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cc3ccc(OC)cc3[nH]2)C1	ZINC001034335309	1342410460	/nfs/dbraw/zinc/41/04/60/1342410460.db2.gz	DDJGDSQRDPNIKJ-INIZCTEOSA-N	0	3	341.455	3.337	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2oc3ccccc3c2OC)C1	ZINC001034342338	1342414137	/nfs/dbraw/zinc/41/41/37/1342414137.db2.gz	PGXIOFUNVDWNLE-OAHLLOKOSA-N	0	3	340.423	3.049	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)Cc2csc(C(C)(C)C)n2)C1	ZINC001034445389	1342506608	/nfs/dbraw/zinc/50/66/08/1342506608.db2.gz	RWGGIACBXYGXJD-AWEZNQCLSA-N	0	3	335.517	3.140	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)c2ccc(OC)c(C3CC3)c2)C1	ZINC001034464281	1342519586	/nfs/dbraw/zinc/51/95/86/1342519586.db2.gz	ZYFKVPZULMPLOJ-KRWDZBQOSA-N	0	3	328.456	3.343	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ncccc2C(F)(F)F)C1	ZINC001034471105	1342525586	/nfs/dbraw/zinc/52/55/86/1342525586.db2.gz	DNAKGXIFQUSCFF-ZDUSSCGKSA-N	0	3	341.377	3.261	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2csc(C(F)(F)F)n2)C1	ZINC001034470932	1342525977	/nfs/dbraw/zinc/52/59/77/1342525977.db2.gz	CTGCKTRKUYVANI-LLVKDONJSA-N	0	3	347.406	3.322	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cncc(C(F)(F)F)c2)C1	ZINC001034472681	1342528131	/nfs/dbraw/zinc/52/81/31/1342528131.db2.gz	WEKLZHORHQFTMP-HNNXBMFYSA-N	0	3	341.377	3.261	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@@H]2CCCc3sc(C)nc32)C1	ZINC001034494378	1342550471	/nfs/dbraw/zinc/55/04/71/1342550471.db2.gz	YJLKCEBOVPYEOD-JKSUJKDBSA-N	0	3	347.528	3.418	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc(Br)o2)C1	ZINC001034506688	1342564792	/nfs/dbraw/zinc/56/47/92/1342564792.db2.gz	LSBNRNQYBOTNQT-LBPRGKRZSA-N	0	3	341.249	3.203	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cc(F)c(F)c(F)c2F)C1	ZINC001034498005	1342554529	/nfs/dbraw/zinc/55/45/29/1342554529.db2.gz	IPBZGGXQYVSBNH-NSHDSACASA-N	0	3	344.352	3.403	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc3ncsc3c2)C1	ZINC001034512758	1342570931	/nfs/dbraw/zinc/57/09/31/1342570931.db2.gz	QICLLCUECBUBCL-OAHLLOKOSA-N	0	3	329.469	3.457	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)Cc2cccc(OC(C)C)c2)C1	ZINC001034545496	1342606471	/nfs/dbraw/zinc/60/64/71/1342606471.db2.gz	UGWIIYXBAHTGMX-SFHVURJKSA-N	0	3	330.472	3.173	20	30		EGEDHN
N#Cc1ccc(CNCc2ccc(CNC(=O)C3CC=CC3)cc2)cc1	ZINC001034810826	1342776037	/nfs/dbraw/zinc/77/60/37/1342776037.db2.gz	LCPQASHXOPYELH-UHFFFAOYSA-N	0	3	345.446	3.430	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@@H]2CNCc2c(C)noc2CC)CC1	ZINC001035035370	1342888857	/nfs/dbraw/zinc/88/88/57/1342888857.db2.gz	LQLKIGGMVLKZPV-QGZVFWFLSA-N	0	3	345.487	3.372	20	30		EGEDHN
CCCC(=O)N1CCC2(CCN(Cc3ccc(C#N)s3)C2)CC1	ZINC001035148387	1342959652	/nfs/dbraw/zinc/95/96/52/1342959652.db2.gz	FYXKJAVMKGPAMM-UHFFFAOYSA-N	0	3	331.485	3.234	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc(C(C)C)nc1)CC2	ZINC001035721225	1343152224	/nfs/dbraw/zinc/15/22/24/1343152224.db2.gz	SOYDBCGDSLXPDN-UHFFFAOYSA-N	0	3	327.472	3.319	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCC2(CN(CC=C(C)C)C2)CC1	ZINC001035723632	1343153241	/nfs/dbraw/zinc/15/32/41/1343153241.db2.gz	LFQVSQZOMLRESH-UHFFFAOYSA-N	0	3	327.472	3.178	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc(OC)cc1C)CC2	ZINC001035784539	1343195048	/nfs/dbraw/zinc/19/50/48/1343195048.db2.gz	VEOGKWRAGUFWBI-UHFFFAOYSA-N	0	3	328.456	3.118	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)C13CCC(CC1)C3(C)C)CC2	ZINC001035811921	1343211156	/nfs/dbraw/zinc/21/11/56/1343211156.db2.gz	FOPQBGGNUIFLEL-UHFFFAOYSA-N	0	3	328.500	3.151	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc(OC)c(C)c1)CC2	ZINC001035816707	1343213440	/nfs/dbraw/zinc/21/34/40/1343213440.db2.gz	MYJOVPUFTKPKQU-UHFFFAOYSA-N	0	3	328.456	3.118	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@H](C)c1ccc(CC)cc1)CC2	ZINC001035818365	1343213972	/nfs/dbraw/zinc/21/39/72/1343213972.db2.gz	TVNTUNPVVNMDLU-GOSISDBHSA-N	0	3	338.495	3.300	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@H]1CCO[C@@H](CCC)C1)CC2	ZINC001035827962	1343217364	/nfs/dbraw/zinc/21/73/64/1343217364.db2.gz	DHHJIGXLVLPADH-ROUUACIJSA-N	0	3	334.504	3.082	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccc3ccccc3c1)CC2	ZINC001035841820	1343224201	/nfs/dbraw/zinc/22/42/01/1343224201.db2.gz	LSPQZAWLHSWWEJ-UHFFFAOYSA-N	0	3	332.447	3.401	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)COc1ccc(CC)cc1)CC2	ZINC001035844183	1343226129	/nfs/dbraw/zinc/22/61/29/1343226129.db2.gz	CMABGSKJPLOLRZ-UHFFFAOYSA-N	0	3	342.483	3.128	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C[C@H]1OCc3ccccc31)CC2	ZINC001035845324	1343226607	/nfs/dbraw/zinc/22/66/07/1343226607.db2.gz	MMZBLIAWCGRCAM-LJQANCHMSA-N	0	3	340.467	3.149	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccc3c(c1)CCCC3)CC2	ZINC001035848412	1343228400	/nfs/dbraw/zinc/22/84/00/1343228400.db2.gz	WEVSCVKTJIJICH-UHFFFAOYSA-N	0	3	336.479	3.127	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1sccc1C1CC1)CC2	ZINC001035848179	1343228414	/nfs/dbraw/zinc/22/84/14/1343228414.db2.gz	QSNRLXUWNKQKAT-UHFFFAOYSA-N	0	3	328.481	3.187	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cc3cccc(F)c3o1)CC2	ZINC001035853418	1343230504	/nfs/dbraw/zinc/23/05/04/1343230504.db2.gz	SADQUSGKCSXXBC-UHFFFAOYSA-N	0	3	340.398	3.133	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1c[nH]c3c1cccc3CC)CC2	ZINC001035855970	1343232712	/nfs/dbraw/zinc/23/27/12/1343232712.db2.gz	FSLHNRBMOMBDIS-UHFFFAOYSA-N	0	3	349.478	3.292	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1csc(CC(C)C)n1)CC2	ZINC001035859416	1343236028	/nfs/dbraw/zinc/23/60/28/1343236028.db2.gz	CVZAIASPHGGYLC-UHFFFAOYSA-N	0	3	347.528	3.456	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)C1CC(c3ccccc3)C1)CC2	ZINC001035860234	1343236486	/nfs/dbraw/zinc/23/64/86/1343236486.db2.gz	VLQXKYRUHNDOCX-UHFFFAOYSA-N	0	3	336.479	3.128	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCC2CCC2)CC[C@H]1NCc1ccccc1C#N	ZINC001035975156	1343295317	/nfs/dbraw/zinc/29/53/17/1343295317.db2.gz	TZXLUHAFHCVNHA-OXQOHEQNSA-N	0	3	339.483	3.465	20	30		EGEDHN
Cc1coc(C(=O)N2CC[C@H](NCc3ccccc3C#N)[C@@H](C)C2)c1	ZINC001036148237	1343329988	/nfs/dbraw/zinc/32/99/88/1343329988.db2.gz	ZQHPVYZTTSCMBP-YJBOKZPZSA-N	0	3	337.423	3.100	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@@H](NCc2ccccc2C#N)[C@@H](C)C1	ZINC001036175676	1343347585	/nfs/dbraw/zinc/34/75/85/1343347585.db2.gz	SOPLVKQIYGGVJG-MAUKXSAKSA-N	0	3	327.472	3.321	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@H]([C@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001036338477	1343423637	/nfs/dbraw/zinc/42/36/37/1343423637.db2.gz	LOFVMCXESKHWAS-RDJZCZTQSA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@H](NCc1cc(F)ccc1C#N)[C@@H]1CCCN(C(=O)C(C)(C)F)C1	ZINC001036357700	1343439736	/nfs/dbraw/zinc/43/97/36/1343439736.db2.gz	OZKGUMCCBRJMOW-DZGCQCFKSA-N	0	3	349.425	3.162	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)C2CCC2)[C@H]1CNCc1cc(C#N)ccc1F	ZINC001036487644	1343510665	/nfs/dbraw/zinc/51/06/65/1343510665.db2.gz	NCBBOSYCODVWNP-KUHUBIRLSA-N	0	3	343.446	3.214	20	30		EGEDHN
CCCC(=O)N1CCC[C@@H](C)[C@H]1CNCc1cc(C#N)ccc1F	ZINC001036492098	1343514701	/nfs/dbraw/zinc/51/47/01/1343514701.db2.gz	BOENTANHGGZODK-RDTXWAMCSA-N	0	3	331.435	3.214	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)/C=C/C2CC2)[C@H]1CNCc1ccc(C#N)s1	ZINC001036528051	1343536218	/nfs/dbraw/zinc/53/62/18/1343536218.db2.gz	NDTPVONOCBBLRL-BUDSLTDKSA-N	0	3	343.496	3.303	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@H]2[C@H](CCN2CC#Cc2ccc(F)cc2)C1	ZINC001036626665	1343583864	/nfs/dbraw/zinc/58/38/64/1343583864.db2.gz	APBQUXFCNDHSEZ-QUCCMNQESA-N	0	3	342.458	3.146	20	30		EGEDHN
O=C(c1ccccc1)N1CC[C@@H]2[C@@H](CCN2CC#Cc2ccccc2)C1	ZINC001036627243	1343584308	/nfs/dbraw/zinc/58/43/08/1343584308.db2.gz	JRHMFQUXYXDONN-FCHUYYIVSA-N	0	3	344.458	3.275	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@H]2[C@@H](CCN2Cc2ccc(C#N)cc2F)C1	ZINC001036632319	1343589435	/nfs/dbraw/zinc/58/94/35/1343589435.db2.gz	LWQNPKDMSFKJSS-HKUYNNGSSA-N	0	3	341.430	3.086	20	30		EGEDHN
CC(C)C(=O)N1CC[C@@H]2[C@@H](CCN2CC#Cc2ccc(Cl)cc2)C1	ZINC001036649174	1343599217	/nfs/dbraw/zinc/59/92/17/1343599217.db2.gz	SRECQZBIAGUUTO-PKOBYXMFSA-N	0	3	344.886	3.270	20	30		EGEDHN
C/C(=C/C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccccc2C#N)C1)C1CC1	ZINC001036658367	1343606087	/nfs/dbraw/zinc/60/60/87/1343606087.db2.gz	HLKLMPJPDJAIFL-IBVHEKKJSA-N	0	3	349.478	3.337	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@@H]2CN(C(=O)CC3CCC3)CC[C@H]21	ZINC001036678402	1343618601	/nfs/dbraw/zinc/61/86/01/1343618601.db2.gz	PXQUTVIDBSPAPY-WOJBJXKFSA-N	0	3	337.467	3.171	20	30		EGEDHN
O=C(N1CC[C@H]2[C@H](CCN2CC#Cc2ccccc2)C1)C1(C2CC2)CC1	ZINC001036745099	1343670348	/nfs/dbraw/zinc/67/03/48/1343670348.db2.gz	SUZNQPXUQOSNCA-CTNGQTDRSA-N	0	3	348.490	3.151	20	30		EGEDHN
CC1(CC(=O)N2CC[C@@H]3[C@@H](CCN3Cc3ccccc3C#N)C2)CC1	ZINC001036775753	1343705502	/nfs/dbraw/zinc/70/55/02/1343705502.db2.gz	ACCKGVPFFFUPGI-RBUKOAKNSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2[C@H](CCN2Cc2cc(C3CC3)no2)C1	ZINC001036788643	1343718212	/nfs/dbraw/zinc/71/82/12/1343718212.db2.gz	FATUYOXBGXOFTG-CRAIPNDOSA-N	0	3	343.471	3.187	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2[C@H](CCN2Cc2cc(C)no2)C1	ZINC001036793006	1343724472	/nfs/dbraw/zinc/72/44/72/1343724472.db2.gz	XQKNBYJLJHPULE-WBVHZDCISA-N	0	3	331.460	3.008	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]2[C@H](CCN2Cc2conc2CC)C1	ZINC001036794263	1343726725	/nfs/dbraw/zinc/72/67/25/1343726725.db2.gz	RSTOOXWUAVOKOJ-CRAIPNDOSA-N	0	3	345.487	3.262	20	30		EGEDHN
CC1(C(=O)N2CC[C@H]3[C@H](CCN3CC#Cc3ccccc3)C2)CC=CC1	ZINC001036813509	1343750591	/nfs/dbraw/zinc/75/05/91/1343750591.db2.gz	YINYVNMQYWESOY-RTWAWAEBSA-N	0	3	348.490	3.317	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]3[C@@H](CCN3Cc3cc(C)ns3)C2)C1	ZINC001036816347	1343754199	/nfs/dbraw/zinc/75/41/99/1343754199.db2.gz	TUSLUQCZSFUWFT-DOTOQJQBSA-N	0	3	345.512	3.231	20	30		EGEDHN
CC1(C(=O)N[C@@H]2CCC[C@@H]2CNCc2cc(F)ccc2C#N)CCC1	ZINC001037056247	1343953566	/nfs/dbraw/zinc/95/35/66/1343953566.db2.gz	DETMBTFNVVHXCQ-CRAIPNDOSA-N	0	3	343.446	3.262	20	30		EGEDHN
Cc1cocc1C(=O)N[C@H]1CCC[C@@H]1CNCc1ccccc1C#N	ZINC001037057925	1343954473	/nfs/dbraw/zinc/95/44/73/1343954473.db2.gz	BVYXPJDOZHZPEC-MJGOQNOKSA-N	0	3	337.423	3.148	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCC[C@H]2CNCc2csc(C)n2)C1	ZINC001037071209	1343964612	/nfs/dbraw/zinc/96/46/12/1343964612.db2.gz	CQDBOBWVGIFRQE-HOCLYGCPSA-N	0	3	333.501	3.182	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCC[C@H]2CNCc2ccn(C(C)C)n2)C1	ZINC001037071722	1343965868	/nfs/dbraw/zinc/96/58/68/1343965868.db2.gz	KZVHMCGMEWEDHS-WMZOPIPTSA-N	0	3	344.503	3.195	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCC[C@H]2CNCc2ccccc2C#N)C1	ZINC001037074821	1343968046	/nfs/dbraw/zinc/96/80/46/1343968046.db2.gz	HGDYLJYZTZIJPG-RBUKOAKNSA-N	0	3	337.467	3.289	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCC[C@H]1NC(=O)c1ccco1	ZINC001037145525	1343994931	/nfs/dbraw/zinc/99/49/31/1343994931.db2.gz	CQZBWUZUMQRYGL-ZWKOTPCHSA-N	0	3	337.423	3.230	20	30		EGEDHN
CC(C)(F)C(=O)N[C@@H]1CCCC[C@@H]1CNCc1ccccc1C#N	ZINC001037156070	1344006715	/nfs/dbraw/zinc/00/67/15/1344006715.db2.gz	LPSIELDXUUNGSK-IAGOWNOFSA-N	0	3	331.435	3.071	20	30		EGEDHN
CC(C)C(=O)N[C@@H]1CCCC[C@@H]1CNCc1cc(F)ccc1C#N	ZINC001037188769	1344028179	/nfs/dbraw/zinc/02/81/79/1344028179.db2.gz	RLDGCTCQOTZQHD-CRAIPNDOSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCCC[C@@H]2CNCc2ocnc2C)CC1	ZINC001037237623	1344060634	/nfs/dbraw/zinc/06/06/34/1344060634.db2.gz	VQUSVSUOBYHGOC-QZTJIDSGSA-N	0	3	345.487	3.494	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](NCc2nccn2CC)[C@@H](CC)C1	ZINC001037908363	1344171557	/nfs/dbraw/zinc/17/15/57/1344171557.db2.gz	XKLUVWFKQTUTTQ-IRXDYDNUSA-N	0	3	346.519	3.222	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3cnns3)[C@@H](CC)C2)CC1	ZINC001037924306	1344184412	/nfs/dbraw/zinc/18/44/12/1344184412.db2.gz	LPBJSVOVKIXJBS-YOEHRIQHSA-N	0	3	348.516	3.001	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1coc2c1cccc2OC	ZINC001038248036	1344342714	/nfs/dbraw/zinc/34/27/14/1344342714.db2.gz	LKUOSWQMUNXPMC-AWEZNQCLSA-N	0	3	328.412	3.212	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1cc(C2CCCCC2)n[nH]1	ZINC001038344611	1344387683	/nfs/dbraw/zinc/38/76/83/1344387683.db2.gz	JAZXFTKWUMVCPV-INIZCTEOSA-N	0	3	330.476	3.228	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NC[C@H]1CCN1CCC1=CCCCC1	ZINC001038807451	1344591243	/nfs/dbraw/zinc/59/12/43/1344591243.db2.gz	IJKHSRWLCNPWJU-QYZOEREBSA-N	0	3	332.488	3.049	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)[C@@H]1CCCc2sc(C)nc21	ZINC001038910052	1344647702	/nfs/dbraw/zinc/64/77/02/1344647702.db2.gz	KSFIJOBFMJREIC-HUUCEWRRSA-N	0	3	333.501	3.028	20	30		EGEDHN
C=CCC[N@H+]1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001039194185	1344900656	/nfs/dbraw/zinc/90/06/56/1344900656.db2.gz	VMGYTQBNYZYGHM-SJLPKXTDSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=CCC[N@@H+]1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001039194185	1344900659	/nfs/dbraw/zinc/90/06/59/1344900659.db2.gz	VMGYTQBNYZYGHM-SJLPKXTDSA-N	0	3	328.456	3.285	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cccc(F)c2)C1	ZINC001039207281	1344918350	/nfs/dbraw/zinc/91/83/50/1344918350.db2.gz	ZBOJARNLAZVILU-MJGOQNOKSA-N	0	3	328.431	3.166	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc3cc(C)cn3c2)C1	ZINC001039209144	1344922080	/nfs/dbraw/zinc/92/20/80/1344922080.db2.gz	GZQRURSSDMLKBD-NQIIRXRSSA-N	0	3	349.478	3.198	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(Cl)cc2F)C1	ZINC001039216446	1344932990	/nfs/dbraw/zinc/93/29/90/1344932990.db2.gz	OXJXYPIFLOMVIN-KDOFPFPSSA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(Cl)cc2F)C1	ZINC001039216448	1344933052	/nfs/dbraw/zinc/93/30/52/1344933052.db2.gz	OXJXYPIFLOMVIN-KSSFIOAISA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(C)c(C)n2)C1	ZINC001039228545	1344947726	/nfs/dbraw/zinc/94/77/26/1344947726.db2.gz	JDBCORUPHXERRC-QUCCMNQESA-N	0	3	339.483	3.038	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(C(C)C)no2)C1	ZINC001039234412	1344954833	/nfs/dbraw/zinc/95/48/33/1344954833.db2.gz	JJMLLCYTIWHMGB-AEFFLSMTSA-N	0	3	343.471	3.138	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)CCc2ccccc2C)C1	ZINC001039238294	1344961339	/nfs/dbraw/zinc/96/13/39/1344961339.db2.gz	NBJIKZPXHCPHDP-LEWJYISDSA-N	0	3	338.495	3.264	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)C2CCC=CCC2)C1	ZINC001039241679	1344966849	/nfs/dbraw/zinc/96/68/49/1344966849.db2.gz	GNJAFLGTGWFONA-UXHICEINSA-N	0	3	328.500	3.459	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(C)c(CC)o2)C1	ZINC001039242974	1344969999	/nfs/dbraw/zinc/96/99/99/1344969999.db2.gz	DYQBTASYHKLESV-MSOLQXFVSA-N	0	3	342.483	3.490	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cccc(OC)c2)C1	ZINC001039248237	1344977644	/nfs/dbraw/zinc/97/76/44/1344977644.db2.gz	ACRAAXOSBITFGK-ICSRJNTNSA-N	0	3	340.467	3.035	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)CCc2ccc(C)s2)C1	ZINC001039252817	1344984440	/nfs/dbraw/zinc/98/44/40/1344984440.db2.gz	PUZBRDBTWBDWDY-IEBWSBKVSA-N	0	3	344.524	3.325	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc3sccc3[nH]2)C1	ZINC001039256533	1344986255	/nfs/dbraw/zinc/98/62/55/1344986255.db2.gz	LAPLBOYJGWVQSC-WMLDXEAASA-N	0	3	341.480	3.179	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(Cl)c(C)c1	ZINC001039428427	1345063707	/nfs/dbraw/zinc/06/37/07/1345063707.db2.gz	MGRASMZHMZDLEN-SJORKVTESA-N	0	3	330.859	3.351	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccc(Cl)c1F	ZINC001039444065	1345069437	/nfs/dbraw/zinc/06/94/37/1345069437.db2.gz	QMJMDGJMWJOECO-CVEARBPZSA-N	0	3	348.849	3.110	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)CCn1ccnc1C(C)C	ZINC001039447249	1345071844	/nfs/dbraw/zinc/07/18/44/1345071844.db2.gz	FUOATTHBVSEDJU-MSOLQXFVSA-N	0	3	344.503	3.038	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1c(C)nn(CCC)c1C	ZINC001039459198	1345078448	/nfs/dbraw/zinc/07/84/48/1345078448.db2.gz	JUWZQEJZORXVEE-MSOLQXFVSA-N	0	3	344.503	3.165	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cn1ccc2ccccc21	ZINC001039473195	1345087914	/nfs/dbraw/zinc/08/79/14/1345087914.db2.gz	ZVCQALUEDFGZJD-MOPGFXCFSA-N	0	3	337.467	3.283	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc2cc(C)ccc2o1	ZINC001039474702	1345089652	/nfs/dbraw/zinc/08/96/52/1345089652.db2.gz	VRHWKNJMRMLNMA-MSOLQXFVSA-N	0	3	336.435	3.443	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C1CC(c2ccccc2)C1	ZINC001039477354	1345091800	/nfs/dbraw/zinc/09/18/00/1345091800.db2.gz	VDILWHKPFAZAHA-VFUGHAIPSA-N	0	3	336.479	3.269	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC1CC(C)C1	ZINC001039592990	1345147458	/nfs/dbraw/zinc/14/74/58/1345147458.db2.gz	FQBLOSVPBWPRGW-SGWMQEFOSA-N	0	3	346.515	3.079	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CCC[C@@H](C2)N3CC2CC(OCC)C2)C1	ZINC001039906393	1345243595	/nfs/dbraw/zinc/24/35/95/1345243595.db2.gz	NLMBNHIUNJWXIQ-FXSDRFNOSA-N	0	3	346.515	3.223	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@]3(CCN(C(=O)/C=C/C4CC4)C3)C2)c1	ZINC001040134264	1345345642	/nfs/dbraw/zinc/34/56/42/1345345642.db2.gz	ORXCXJUPVMSOSE-VQKOGROQSA-N	0	3	349.478	3.339	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@]3(CCN(C(=O)/C=C\C4CC4)C3)C2)c1	ZINC001040134262	1345346115	/nfs/dbraw/zinc/34/61/15/1345346115.db2.gz	ORXCXJUPVMSOSE-KOIKXXGWSA-N	0	3	349.478	3.339	20	30		EGEDHN
C/C=C(/C)C(=O)N1CC[C@]2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001040149033	1345354632	/nfs/dbraw/zinc/35/46/32/1345354632.db2.gz	FJWPCVOEKRGWID-ONXLCYEJSA-N	0	3	337.467	3.339	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3sc(C4CC4)nc3C)C2)C1	ZINC001040201653	1345373240	/nfs/dbraw/zinc/37/32/40/1345373240.db2.gz	MKEQCXBIGHYJJK-IBGZPJMESA-N	0	3	345.512	3.443	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3c(C)noc3CCC)C2)C1	ZINC001040203356	1345374404	/nfs/dbraw/zinc/37/44/04/1345374404.db2.gz	XDSYVSPJPHIRMQ-LJQANCHMSA-N	0	3	331.460	3.050	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3csc(C)c3C)C2)C1	ZINC001040220326	1345380269	/nfs/dbraw/zinc/38/02/69/1345380269.db2.gz	JIJILKAPNCUNHD-IBGZPJMESA-N	0	3	330.497	3.316	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)Cc3ccccc3CC)C2)C1	ZINC001040256914	1345397665	/nfs/dbraw/zinc/39/76/65/1345397665.db2.gz	BORZKRWNLBBSFN-JOCHJYFZSA-N	0	3	338.495	3.129	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3c(C)oc(C)c3C)C2)C1	ZINC001040283820	1345411516	/nfs/dbraw/zinc/41/15/16/1345411516.db2.gz	OKPPYWJMPKMIEJ-FQEVSTJZSA-N	0	3	328.456	3.156	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cc(Cl)ccc3F)C2)C1	ZINC001040284280	1345412306	/nfs/dbraw/zinc/41/23/06/1345412306.db2.gz	UGUSVBYOJGKJFG-IBGZPJMESA-N	0	3	348.849	3.431	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3ccc4cc(C)ccc4n3)C2)C1	ZINC001040288790	1345413400	/nfs/dbraw/zinc/41/34/00/1345413400.db2.gz	IBXSHBHRZJILGO-JOCHJYFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)Cc3cccc(C4CC4)c3)C2)C1	ZINC001040310955	1345425083	/nfs/dbraw/zinc/42/50/83/1345425083.db2.gz	RIFBDWLMOABFRV-QFIPXVFZSA-N	0	3	336.479	3.054	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)CCc3ccc(Cl)cc3)C2)C1	ZINC001040317980	1345428341	/nfs/dbraw/zinc/42/83/41/1345428341.db2.gz	OXCHAHGTOLWTRS-HXUWFJFHSA-N	0	3	344.886	3.220	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cc(-c4ccco4)on3)C2)C1	ZINC001040318617	1345429072	/nfs/dbraw/zinc/42/90/72/1345429072.db2.gz	WAEMPNYJFTZPEB-IBGZPJMESA-N	0	3	341.411	3.049	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@H](C)c3cccc(C)c3)C2)C1	ZINC001040422399	1345488902	/nfs/dbraw/zinc/48/89/02/1345488902.db2.gz	MLHAQCAAJLJGAJ-DENIHFKCSA-N	0	3	338.495	3.436	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3oc(C(C)C)nc3C)C2)C1	ZINC001040436338	1345499171	/nfs/dbraw/zinc/49/91/71/1345499171.db2.gz	UWXAWENYDNQJIF-FQEVSTJZSA-N	0	3	343.471	3.058	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@]2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001040502198	1345522384	/nfs/dbraw/zinc/52/23/84/1345522384.db2.gz	KRNYBKZVJDMIPO-OAQYLSRUSA-N	0	3	339.483	3.419	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)C3CCC(C4CC4)CC3)C2)C1	ZINC001040514575	1345528459	/nfs/dbraw/zinc/52/84/59/1345528459.db2.gz	VPSPYAJITAXVIX-GRERDSQWSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@@H](C)c3cccc(F)c3)C2)C1	ZINC001040538159	1345535958	/nfs/dbraw/zinc/53/59/58/1345535958.db2.gz	GUARQLGYOCMCCF-LAUBAEHRSA-N	0	3	342.458	3.267	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@H](C)c3cccc(F)c3)C2)C1	ZINC001040538158	1345536466	/nfs/dbraw/zinc/53/64/66/1345536466.db2.gz	GUARQLGYOCMCCF-DYESRHJHSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(F)c4occc43)C2)C1	ZINC001040539297	1345536914	/nfs/dbraw/zinc/53/69/14/1345536914.db2.gz	NZTRCKJFHGPWAH-HXUWFJFHSA-N	0	3	340.398	3.133	20	30		EGEDHN
C[C@H]1C[C@H]1C(=O)N1CCC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001040590237	1345551416	/nfs/dbraw/zinc/55/14/16/1345551416.db2.gz	OJAWDIPTBYDSFA-QFBILLFUSA-N	0	3	337.467	3.029	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3sccc3Cl)C2)CC1	ZINC001040711533	1345568850	/nfs/dbraw/zinc/56/88/50/1345568850.db2.gz	VIWHPPJKLPKFNZ-UHFFFAOYSA-N	0	3	336.888	3.353	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@H](C)c3cccs3)C2)CC1	ZINC001040847382	1345587805	/nfs/dbraw/zinc/58/78/05/1345587805.db2.gz	NIUCCMNCGMAPDN-MRXNPFEDSA-N	0	3	330.497	3.189	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cc([C@H](C)CC)no3)C2)CC1	ZINC001040875995	1345593374	/nfs/dbraw/zinc/59/33/74/1345593374.db2.gz	KUPPYRLZEVESAF-MRXNPFEDSA-N	0	3	343.471	3.140	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@H]3C[C@H]3C3CCCC3)C2)CC1	ZINC001040900174	1345595918	/nfs/dbraw/zinc/59/59/18/1345595918.db2.gz	SIEMYKKAKMCFJR-OALUTQOASA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccccc3Cl)C2)CC1	ZINC001040920466	1345600827	/nfs/dbraw/zinc/60/08/27/1345600827.db2.gz	WTUICOFXRZAUDE-UHFFFAOYSA-N	0	3	330.859	3.291	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@H](C)Cc3ccccc3)C2)CC1	ZINC001040946163	1345606438	/nfs/dbraw/zinc/60/64/38/1345606438.db2.gz	FAXWFEYFVFVUOR-LJQANCHMSA-N	0	3	338.495	3.203	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cncc4ccccc43)C2)CC1	ZINC001040946905	1345607037	/nfs/dbraw/zinc/60/70/37/1345607037.db2.gz	JQONQOOVJTWDIQ-UHFFFAOYSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@]3(C)CCC(C)=C(C)C3)C2)CC1	ZINC001040950793	1345607820	/nfs/dbraw/zinc/60/78/20/1345607820.db2.gz	CDVBJWSFHYGJSM-HXUWFJFHSA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccc(C)c4c3CCC4)C2)CC1	ZINC001040954000	1345609601	/nfs/dbraw/zinc/60/96/01/1345609601.db2.gz	UVHUKVNVPMTRHX-UHFFFAOYSA-N	0	3	336.479	3.045	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N1CC[C@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001041215001	1345680273	/nfs/dbraw/zinc/68/02/73/1345680273.db2.gz	LFMHTQBSDIAJIV-NQIIRXRSSA-N	0	3	337.467	3.029	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)CC3CC(c4ccccc4)C3)C2)C1	ZINC001041422735	1345724912	/nfs/dbraw/zinc/72/49/12/1345724912.db2.gz	PLNYLDCDJMUAQY-ZNIKRAEXSA-N	0	3	336.479	3.128	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3cc4ccc(F)cc4s3)C2)C1	ZINC001041441674	1345728144	/nfs/dbraw/zinc/72/81/44/1345728144.db2.gz	CXBJRVUGYIHHPQ-IBGZPJMESA-N	0	3	342.439	3.212	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@]3(CCN(C(=O)[C@]45C[C@H]4CCC5)C3)C2)cc1	ZINC001041492006	1345743756	/nfs/dbraw/zinc/74/37/56/1345743756.db2.gz	NBNIXZMTKXXRCD-BAGYTPMASA-N	0	3	349.478	3.173	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@]2(CCN(Cc3ccc(C)nc3C)C2)C1	ZINC001041542536	1345757413	/nfs/dbraw/zinc/75/74/13/1345757413.db2.gz	DMZAQTKKULOBBH-NRFANRHFSA-N	0	3	341.499	3.335	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@]2(CCN(Cc3scnc3C)C2)C1	ZINC001041626423	1345801330	/nfs/dbraw/zinc/80/13/30/1345801330.db2.gz	SJRUAKSHGZFXDY-OALUTQOASA-N	0	3	347.528	3.478	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@]2(CCN(Cc3cncc(C)c3)C2)C1	ZINC001041626474	1345801394	/nfs/dbraw/zinc/80/13/94/1345801394.db2.gz	UKJGIIVFBOGCDO-RTWAWAEBSA-N	0	3	341.499	3.417	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@]2(CCN(Cc3ccccn3)C2)C1	ZINC001041627045	1345801607	/nfs/dbraw/zinc/80/16/07/1345801607.db2.gz	ZPUOOKPXNVSFSQ-WOJBJXKFSA-N	0	3	327.472	3.108	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@]3(CCN(Cc4cnccc4C)C3)C2)C1	ZINC001041652625	1345810894	/nfs/dbraw/zinc/81/08/94/1345810894.db2.gz	LXKQAIPOSFGIDY-OAQYLSRUSA-N	0	3	339.483	3.171	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)C[C@H](C)c3ccccc3F)C2)C1	ZINC001041741645	1345838165	/nfs/dbraw/zinc/83/81/65/1345838165.db2.gz	RLDSKVLWTBJJLS-LAUBAEHRSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)[C@H](c3ccc(F)cc3)C(C)C)C2)C1	ZINC001041847622	1345872731	/nfs/dbraw/zinc/87/27/31/1345872731.db2.gz	SOALMWUVKWJLGU-PZJWPPBQSA-N	0	3	342.458	3.123	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@@H]2CCN(Cc3cccc(C#N)c3)[C@H]2C1	ZINC001041948944	1345905817	/nfs/dbraw/zinc/90/58/17/1345905817.db2.gz	AHOFFFHBNHYHIU-PMACEKPBSA-N	0	3	339.483	3.417	20	30		EGEDHN
C/C(=C/C(=O)N1CC[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@@H]2C1)C1CC1	ZINC001041962093	1345908640	/nfs/dbraw/zinc/90/86/40/1345908640.db2.gz	QIJPCQHZWKDTNI-IBVHEKKJSA-N	0	3	349.478	3.337	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccn(C4CCCCC4)n3)C[C@@H]21	ZINC001042063420	1345933523	/nfs/dbraw/zinc/93/35/23/1345933523.db2.gz	WMMMGLATTDCRCR-APWZRJJASA-N	0	3	342.487	3.111	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cccc(OCCC)c3)C[C@H]21	ZINC001042079511	1345939469	/nfs/dbraw/zinc/93/94/69/1345939469.db2.gz	DSBXWZMAWGHXPQ-VQIMIIECSA-N	0	3	328.456	3.198	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3cc(F)c(C)cc3F)C[C@H]21	ZINC001042104046	1345945471	/nfs/dbraw/zinc/94/54/71/1345945471.db2.gz	ZWSRZBBEUFBOGA-KBXCAEBGSA-N	0	3	334.410	3.386	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3coc4ccc(OC)cc43)C[C@@H]21	ZINC001042147928	1345957109	/nfs/dbraw/zinc/95/71/09/1345957109.db2.gz	HTIVQBBUBPXZEM-KDOFPFPSSA-N	0	3	340.423	3.164	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cnc4ccccc4c3C)C[C@H]21	ZINC001042155139	1345958004	/nfs/dbraw/zinc/95/80/04/1345958004.db2.gz	HWDFBONFHNVQEE-OXQOHEQNSA-N	0	3	335.451	3.266	20	30		EGEDHN
CC1(CC(=O)N2CC[C@H]3CCN(Cc4ccc(C#N)cc4)[C@H]3C2)CC1	ZINC001042160011	1345959810	/nfs/dbraw/zinc/95/98/10/1345959810.db2.gz	JWLWRUYTYOCBRF-MOPGFXCFSA-N	0	3	337.467	3.171	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)Cc3cccc(C4CC4)c3)C[C@@H]21	ZINC001042163361	1345962134	/nfs/dbraw/zinc/96/21/34/1345962134.db2.gz	SITYVZRFPVGGJO-CTNGQTDRSA-N	0	3	336.479	3.053	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CCN(CCc3csc(C)n3)[C@@H]2C1	ZINC001042181660	1345969522	/nfs/dbraw/zinc/96/95/22/1345969522.db2.gz	IEURLAGIEUVFNR-NVXWUHKLSA-N	0	3	347.528	3.129	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3cc4ncccc4s3)C[C@H]21	ZINC001042185112	1345972911	/nfs/dbraw/zinc/97/29/11/1345972911.db2.gz	QCPODNSKAOTIIU-GOEBONIOSA-N	0	3	341.480	3.409	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(F)c4ccncc34)C[C@@H]21	ZINC001042197678	1345979581	/nfs/dbraw/zinc/97/95/81/1345979581.db2.gz	GFPBJTDCIALBDH-KUHUBIRLSA-N	0	3	339.414	3.096	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CCN(C(=O)[C@H]4C[C@H]5C[C@H]5C4)C[C@@H]32)cc1	ZINC001042197051	1345979875	/nfs/dbraw/zinc/97/98/75/1345979875.db2.gz	WSYMWPLMGLNIJP-MJCUULBUSA-N	0	3	349.478	3.027	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3ccc(F)c(F)c3F)C[C@@H]21	ZINC001042207750	1345986332	/nfs/dbraw/zinc/98/63/32/1345986332.db2.gz	SYFGWZBGPWZSKO-DOMZBBRYSA-N	0	3	338.373	3.216	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(C(C)C)nc3C)C[C@@H]21	ZINC001042238316	1345999798	/nfs/dbraw/zinc/99/97/98/1345999798.db2.gz	RSEAYRFEBBRANY-APWZRJJASA-N	0	3	327.472	3.236	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3noc4c3CCCCC4)C[C@@H]21	ZINC001042250827	1346006524	/nfs/dbraw/zinc/00/65/24/1346006524.db2.gz	DVKKHDXJOLNMSH-WBVHZDCISA-N	0	3	343.471	3.056	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3cc(C(CC)CC)no3)C[C@H]21	ZINC001042263005	1346010475	/nfs/dbraw/zinc/01/04/75/1346010475.db2.gz	RIKSPTBXZBAPSN-FUHWJXTLSA-N	0	3	343.471	3.138	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc4nc(C)ccc4c3)C[C@@H]21	ZINC001042278957	1346016036	/nfs/dbraw/zinc/01/60/36/1346016036.db2.gz	CIHXVUJDFDHYCZ-JXFKEZNVSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(Cl)cc(OC)c3)C[C@H]21	ZINC001042283550	1346016499	/nfs/dbraw/zinc/01/64/99/1346016499.db2.gz	LGAJHBKUVUDRGY-CXAGYDPISA-N	0	3	334.847	3.071	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(Cl)cc(OC)c3)C[C@@H]21	ZINC001042283552	1346016764	/nfs/dbraw/zinc/01/67/64/1346016764.db2.gz	LGAJHBKUVUDRGY-GUYCJALGSA-N	0	3	334.847	3.071	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cccc(-c4cnco4)c3)C[C@@H]21	ZINC001042297456	1346021956	/nfs/dbraw/zinc/02/19/56/1346021956.db2.gz	PDIRSSDCVFFWCR-YJBOKZPZSA-N	0	3	337.423	3.064	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3cccc(C#N)c3)[C@H]2C1	ZINC001042324931	1346033328	/nfs/dbraw/zinc/03/33/28/1346033328.db2.gz	XSPFKQXIYBVLIV-ROUUACIJSA-N	0	3	325.456	3.027	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccsc3C(F)F)C[C@@H]21	ZINC001042334553	1346041361	/nfs/dbraw/zinc/04/13/61/1346041361.db2.gz	GJQRMONTUKXXRJ-YPMHNXCESA-N	0	3	326.412	3.408	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc4ccccc4c3)C[C@@H]21	ZINC001042335556	1346041994	/nfs/dbraw/zinc/04/19/94/1346041994.db2.gz	LMXWPXQNFPOYFY-RXVVDRJESA-N	0	3	332.447	3.400	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3sccc3C3CC3)C[C@H]21	ZINC001042344146	1346047292	/nfs/dbraw/zinc/04/72/92/1346047292.db2.gz	TZVNMWIIXMOYSZ-NVXWUHKLSA-N	0	3	328.481	3.185	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc(OC(C)C)cc3)C[C@H]21	ZINC001042344684	1346047899	/nfs/dbraw/zinc/04/78/99/1346047899.db2.gz	ZMYKNHUZPHPMCX-FXAWDEMLSA-N	0	3	340.467	3.034	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3c[nH]c4c3cccc4CC)C[C@H]21	ZINC001042367170	1346058734	/nfs/dbraw/zinc/05/87/34/1346058734.db2.gz	BVPGVBQMAMKKIH-YLJYHZDGSA-N	0	3	349.478	3.290	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3c(Cl)cccc3OC)C[C@@H]21	ZINC001042370938	1346060493	/nfs/dbraw/zinc/06/04/93/1346060493.db2.gz	JBCSWKNYJGCUJU-ZBFHGGJFSA-N	0	3	348.874	3.461	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc(C)c4c3CCC4)C[C@@H]21	ZINC001042372674	1346062088	/nfs/dbraw/zinc/06/20/88/1346062088.db2.gz	ZQEIMRDWURBDMT-UTKZUKDTSA-N	0	3	336.479	3.043	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)C34CC(C(C)(C)C)(C3)C4)C[C@@H]21	ZINC001042375128	1346062451	/nfs/dbraw/zinc/06/24/51/1346062451.db2.gz	SMABLZRYTJWFLM-AMZMEHNNSA-N	0	3	328.500	3.149	20	30		EGEDHN
C[C@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)c1ccsc1	ZINC001044436785	1346331064	/nfs/dbraw/zinc/33/10/64/1346331064.db2.gz	IXKXTSKNVYAIGF-KSSFIOAISA-N	0	3	339.464	3.403	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)CCC1CC1	ZINC001044510315	1346352857	/nfs/dbraw/zinc/35/28/57/1346352857.db2.gz	PNOGHWDCCJDVDN-DNVCBOLYSA-N	0	3	325.456	3.218	20	30		EGEDHN
Cc1cnccc1C(=O)N1CC[C@H](NCc2ccccc2C#N)C[C@@H]1C	ZINC001044590343	1346377220	/nfs/dbraw/zinc/37/72/20/1346377220.db2.gz	ZJAWSKYCHVLSAU-LPHOPBHVSA-N	0	3	348.450	3.045	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2cc(F)ccc2C#N)CCN1C(=O)CC1(C)CC1	ZINC001044689428	1346403924	/nfs/dbraw/zinc/40/39/24/1346403924.db2.gz	OVJIZFOYVIGQDH-KDOFPFPSSA-N	0	3	343.446	3.357	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2cc(F)ccc2C#N)CCN1C(=O)CC1(C)CC1	ZINC001044689430	1346404088	/nfs/dbraw/zinc/40/40/88/1346404088.db2.gz	OVJIZFOYVIGQDH-RDTXWAMCSA-N	0	3	343.446	3.357	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3ocnc3C)C[C@@H]2C)CC1	ZINC001044732035	1346415394	/nfs/dbraw/zinc/41/53/94/1346415394.db2.gz	ZAVBQVZASWYNSF-WMLDXEAASA-N	0	3	331.460	3.199	20	30		EGEDHN
CC(C)(C)[C@@H]1C[C@H]1C(=O)N1CCC[C@H]1CNCc1ccc(C#N)s1	ZINC001045117738	1346497916	/nfs/dbraw/zinc/49/79/16/1346497916.db2.gz	KAUPRRWEYVOEHW-IAOVAPTHSA-N	0	3	345.512	3.383	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H]1CNCc1ccnc(Cl)c1	ZINC001045181272	1346517157	/nfs/dbraw/zinc/51/71/57/1346517157.db2.gz	ASOKKTQNDBYNCI-MAUKXSAKSA-N	0	3	335.879	3.418	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H]1CNCc1c(C)nsc1C	ZINC001045186014	1346522372	/nfs/dbraw/zinc/52/23/72/1346522372.db2.gz	UJNBLBQFMLWMAS-MAUKXSAKSA-N	0	3	335.517	3.443	20	30		EGEDHN
C[C@H](CC(=O)N1CCC[C@H]1CNCc1ccc(C#N)s1)C1CC1	ZINC001045326049	1346561630	/nfs/dbraw/zinc/56/16/30/1346561630.db2.gz	PGTAPKJDHBEWNS-HIFRSBDPSA-N	0	3	331.485	3.137	20	30		EGEDHN
C[C@H]1CC[C@@H](C(=O)NC2(C)CCN(Cc3ccc(C#N)cc3)CC2)C1	ZINC001045579483	1346635118	/nfs/dbraw/zinc/63/51/18/1346635118.db2.gz	DPZBYSYCMBZJGZ-QFBILLFUSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCCC[C@]2(CCN(Cc3ccccc3F)C2)C1	ZINC001045925011	1346761659	/nfs/dbraw/zinc/76/16/59/1346761659.db2.gz	QATOPBJBCBZHBW-OXJNMPFZSA-N	0	3	343.446	3.190	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1c(C)coc1C)C2	ZINC001045936039	1346773137	/nfs/dbraw/zinc/77/31/37/1346773137.db2.gz	ZSDZDISOOMUMLW-HXUWFJFHSA-N	0	3	328.456	3.238	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1c(C)oc(C)c1C)C2	ZINC001045950891	1346785927	/nfs/dbraw/zinc/78/59/27/1346785927.db2.gz	OBTIRKJFXPOZBY-FQEVSTJZSA-N	0	3	328.456	3.156	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc3cc(C)ccc3[nH]1)C2	ZINC001045956981	1346791905	/nfs/dbraw/zinc/79/19/05/1346791905.db2.gz	VKBRTQRYNOHREF-JOCHJYFZSA-N	0	3	349.478	3.428	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H]1Cc3ccccc31)C2	ZINC001045962911	1346798209	/nfs/dbraw/zinc/79/82/09/1346798209.db2.gz	SCXVHERTMPDEEE-IFMALSPDSA-N	0	3	336.479	3.054	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)C1CCC(F)CC1)C2	ZINC001045965492	1346800375	/nfs/dbraw/zinc/80/03/75/1346800375.db2.gz	VEBAGAWDMKYROQ-AFMYVXGZSA-N	0	3	334.479	3.243	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1scnc1C(C)C)C2	ZINC001045973503	1346809265	/nfs/dbraw/zinc/80/92/65/1346809265.db2.gz	RZBXEQMWLAKDDI-IBGZPJMESA-N	0	3	345.512	3.218	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cccc3c1ccn3C)C2	ZINC001045973890	1346809847	/nfs/dbraw/zinc/80/98/47/1346809847.db2.gz	REIJVPCSNJLSKP-JOCHJYFZSA-N	0	3	349.478	3.130	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1sccc1CC)C2	ZINC001045986654	1346828389	/nfs/dbraw/zinc/82/83/89/1346828389.db2.gz	XGABDCFYRWUAJM-LJQANCHMSA-N	0	3	330.497	3.262	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2ncoc2-c2cccs2)C1	ZINC001046711128	1347070015	/nfs/dbraw/zinc/07/00/15/1347070015.db2.gz	XWGOZABOCIDCFP-QGZVFWFLSA-N	0	3	331.441	3.173	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2cnn(CCC(C)C)c2C)C1	ZINC001046761500	1347088796	/nfs/dbraw/zinc/08/87/96/1347088796.db2.gz	VZWMJXDWVHOOHX-IBGZPJMESA-N	0	3	332.492	3.008	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@]2(C)CCN(Cc3cccc(CC)c3)C2)cn1	ZINC001046782993	1347098106	/nfs/dbraw/zinc/09/81/06/1347098106.db2.gz	IEKPYJYNPBHWOK-JOCHJYFZSA-N	0	3	347.462	3.020	20	30		EGEDHN
C#CCCN1CC[C@](C)(NC(=O)c2csc3c2CC[C@@H](C)C3)C1	ZINC001046817025	1347115925	/nfs/dbraw/zinc/11/59/25/1347115925.db2.gz	RYDYRLPYLTXDJU-KUHUBIRLSA-N	0	3	330.497	3.090	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@@H](CNC(=O)C2CCC3(CC3)CC2)C1	ZINC001046957034	1347165095	/nfs/dbraw/zinc/16/50/95/1347165095.db2.gz	JXVLEMWSMNRGMH-INIZCTEOSA-N	0	3	338.442	3.054	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2cc[nH]c2CCC)C1	ZINC001046967877	1347170484	/nfs/dbraw/zinc/17/04/84/1347170484.db2.gz	ZHMQMLIITWWMAR-CQSZACIVSA-N	0	3	339.430	3.230	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2ccoc2C2CC2)C1	ZINC001046971473	1347171980	/nfs/dbraw/zinc/17/19/80/1347171980.db2.gz	QHPIQEAXFNTGES-AWEZNQCLSA-N	0	3	338.398	3.420	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@H](CNC(=O)C2CCC(C)(C)CC2)C1	ZINC001046996571	1347179271	/nfs/dbraw/zinc/17/92/71/1347179271.db2.gz	VQZMCPKBRSHSAD-MRXNPFEDSA-N	0	3	340.458	3.300	20	30		EGEDHN
O=C(N[C@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1ccccc1)C2)c1ccccc1	ZINC001047016463	1347188112	/nfs/dbraw/zinc/18/81/12/1347188112.db2.gz	WCUCHJZRHMYFEN-BVSLBCMMSA-N	0	3	344.458	3.321	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@@H](C2CCN(C/C=C\Cl)CC2)C1	ZINC001047236950	1347264213	/nfs/dbraw/zinc/26/42/13/1347264213.db2.gz	LFXFBSUAHPKDFF-QHPGGANOSA-N	0	3	334.891	3.103	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)C3=CCCCCC3)C2)CC1	ZINC001047237978	1347264885	/nfs/dbraw/zinc/26/48/85/1347264885.db2.gz	VTPRJXIRQKTTDC-FQEVSTJZSA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3ccc(CC)o3)C2)CC1	ZINC001047246697	1347271756	/nfs/dbraw/zinc/27/17/56/1347271756.db2.gz	VRFNNHNXUPVGMV-QGZVFWFLSA-N	0	3	328.456	3.039	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@@H]3CC[C@@H]4C[C@@H]4CC3)C2)CC1	ZINC001047251650	1347276629	/nfs/dbraw/zinc/27/66/29/1347276629.db2.gz	UPPJIXQSTRGMFQ-MXEMCNAFSA-N	0	3	342.527	3.397	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)[C@H](C)C(C)(F)F)C2)CC1	ZINC001047255557	1347279163	/nfs/dbraw/zinc/27/91/63/1347279163.db2.gz	ASOJEAGUJJWHJY-RDJZCZTQSA-N	0	3	340.458	3.252	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)C3(C(C)C)CC3)C2)CC1	ZINC001047255371	1347279339	/nfs/dbraw/zinc/27/93/39/1347279339.db2.gz	XMYJHKNFEMBQTE-LJQANCHMSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@@H](C)c3ccc(C)o3)C2)CC1	ZINC001047259450	1347282061	/nfs/dbraw/zinc/28/20/61/1347282061.db2.gz	QCNHLYMEXWVMPT-PKOBYXMFSA-N	0	3	342.483	3.275	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)C[C@@H](C)C3CC3)C2)CC1	ZINC001047265739	1347286388	/nfs/dbraw/zinc/28/63/88/1347286388.db2.gz	MCJZSGCQZIZZAR-XLIONFOSSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@H]3CC4CCC3CC4)C2)CC1	ZINC001047265751	1347286903	/nfs/dbraw/zinc/28/69/03/1347286903.db2.gz	MGMKKCXYOHYXTK-HXJFWZBSSA-N	0	3	342.527	3.397	20	30		EGEDHN
C=C(C)CCN1C[C@H](O)[C@@H](N(C)C(=O)C(C)(C)C2CCCCC2)C1	ZINC001047557266	1347311432	/nfs/dbraw/zinc/31/14/32/1347311432.db2.gz	LZLBPHHTGYMITQ-ROUUACIJSA-N	0	3	336.520	3.063	20	30		EGEDHN
C[C@H](NCc1cc(F)ccc1C#N)[C@@H]1CCN(C(=O)C2=CCCC2)C1	ZINC001047800154	1347376528	/nfs/dbraw/zinc/37/65/28/1347376528.db2.gz	OVVNXHZVTIBVFH-WMLDXEAASA-N	0	3	341.430	3.134	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)C2(F)CCCC2)C1	ZINC001047887410	1347399671	/nfs/dbraw/zinc/39/96/71/1347399671.db2.gz	NNZQROJOCQMPFH-MAUKXSAKSA-N	0	3	343.446	3.167	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)C2(F)CCCC2)C1	ZINC001047887412	1347399688	/nfs/dbraw/zinc/39/96/88/1347399688.db2.gz	NNZQROJOCQMPFH-YJBOKZPZSA-N	0	3	343.446	3.167	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]([C@@H](C)NCc2ccccc2C#N)C1	ZINC001047927601	1347412827	/nfs/dbraw/zinc/41/28/27/1347412827.db2.gz	JMPLQXDGHDJZNJ-VQIMIIECSA-N	0	3	339.483	3.487	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H]([C@H](C)NCc3nc(C)oc3C)C2)CC1	ZINC001047961334	1347425271	/nfs/dbraw/zinc/42/52/71/1347425271.db2.gz	BUFRUPMOKIFFIF-KSSFIOAISA-N	0	3	345.487	3.364	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]([C@H](C)NCc3nc(C)sc3C)C2)C1	ZINC001047965308	1347426802	/nfs/dbraw/zinc/42/68/02/1347426802.db2.gz	LXQGPWUSKRUFRJ-XJKSGUPXSA-N	0	3	347.528	3.443	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC001079710543	1357353584	/nfs/dbraw/zinc/35/35/84/1357353584.db2.gz	MRHKGPOLFGRQHL-IAQYHMDHSA-N	0	3	326.362	3.390	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC(C)(C)C)C[C@@H]1CNCc1ccccc1C#N	ZINC001048147600	1347481028	/nfs/dbraw/zinc/48/10/28/1347481028.db2.gz	NIYLGMQXEVOWFF-QAPCUYQASA-N	0	3	327.472	3.179	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@@H](C)[C@@H](CNCc2nccs2)C1	ZINC001048264784	1347505712	/nfs/dbraw/zinc/50/57/12/1347505712.db2.gz	DAQBPYVDJSPWBN-YPMHNXCESA-N	0	3	341.908	3.106	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2(C)CCCC2)C[C@H]1CNCc1ccccc1C#N	ZINC001048328641	1347519561	/nfs/dbraw/zinc/51/95/61/1347519561.db2.gz	NWEYNQIENMGODT-VQIMIIECSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)[C@H]2C[C@@]2(C)CC)CC1	ZINC001048629182	1347625169	/nfs/dbraw/zinc/62/51/69/1347625169.db2.gz	SALSBXPVRJXAPM-TZIWHRDSSA-N	0	3	341.499	3.497	20	30		EGEDHN
C[C@@H](c1cccc(Cl)c1)N1C[C@@H]2CN(C(=O)C#CC3CC3)C[C@@H]2C1	ZINC001048810003	1347663525	/nfs/dbraw/zinc/66/35/25/1347663525.db2.gz	DQIKDUBHORBHNM-JCGIZDLHSA-N	0	3	342.870	3.205	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)CCc3ccc(C(C)C)cc3)C[C@@H]2C1	ZINC001048935914	1347687830	/nfs/dbraw/zinc/68/78/30/1347687830.db2.gz	MXYFRXIKTHRHOH-OYRHEFFESA-N	0	3	338.495	3.156	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CN(Cc3oc(CC)nc3C)C[C@H]2C1	ZINC001048976575	1347695876	/nfs/dbraw/zinc/69/58/76/1347695876.db2.gz	PKUZRAWFLQRMOC-IYBDPMFKSA-N	0	3	345.487	3.038	20	30		EGEDHN
Cc1ccc(C(=O)N2C[C@H]3CN(Cc4cccc(C#N)c4)C[C@H]3C2)cc1	ZINC001049187053	1347742364	/nfs/dbraw/zinc/74/23/64/1347742364.db2.gz	HFZOFMLXELSCJD-OYRHEFFESA-N	0	3	345.446	3.071	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@@H]2CCCN3C(=O)CCC2CC2)c1	ZINC001049385315	1347813660	/nfs/dbraw/zinc/81/36/60/1347813660.db2.gz	BMPBRZBLNKEMRA-PMACEKPBSA-N	0	3	337.467	3.314	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)[C@H]2[C@@H]3CCC[C@@H]32)c1	ZINC001049399959	1347822543	/nfs/dbraw/zinc/82/25/43/1347822543.db2.gz	BAFGGSAPLLHDKW-XNTOXWQXSA-N	0	3	349.478	3.170	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1cccc(C#N)c1)C1CC1	ZINC001049404418	1347827878	/nfs/dbraw/zinc/82/78/78/1347827878.db2.gz	RKVHUHVHRXBWJF-CWFSZBLJSA-N	0	3	337.467	3.170	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccn(C2CCCC2)n1	ZINC001049506277	1347882865	/nfs/dbraw/zinc/88/28/65/1347882865.db2.gz	WFIBHZRFRCOAGA-OALUTQOASA-N	0	3	342.487	3.253	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc2nccc(C)c2c1	ZINC001049506120	1347883059	/nfs/dbraw/zinc/88/30/59/1347883059.db2.gz	UJHLTONLRSAIFO-UXHICEINSA-N	0	3	335.451	3.408	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ncoc1-c1ccccc1	ZINC001049507703	1347883690	/nfs/dbraw/zinc/88/36/90/1347883690.db2.gz	LGEVVTWIEIDEAI-IRXDYDNUSA-N	0	3	337.423	3.207	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccnn1C(CC)CC	ZINC001049519395	1347889360	/nfs/dbraw/zinc/88/93/60/1347889360.db2.gz	YPLXZIZGYQIYGF-DLBZAZTESA-N	0	3	330.476	3.109	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(C)nn1C(CC)CC	ZINC001049561507	1347910186	/nfs/dbraw/zinc/91/01/86/1347910186.db2.gz	MEAGYJNGRZLZCF-QZTJIDSGSA-N	0	3	344.503	3.418	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc2cnccc2o1	ZINC001049572717	1347916055	/nfs/dbraw/zinc/91/60/55/1347916055.db2.gz	NFRNCLZMCKASIA-HZPDHXFCSA-N	0	3	325.412	3.083	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)COc1ccc(C(C)C)cc1	ZINC001049577346	1347918261	/nfs/dbraw/zinc/91/82/61/1347918261.db2.gz	PFNDDQPDPGZSOT-UXHICEINSA-N	0	3	342.483	3.440	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cn1c(C)cc2ccccc21	ZINC001049578983	1347919138	/nfs/dbraw/zinc/91/91/38/1347919138.db2.gz	CPWUNHPNDTUCIB-LEWJYISDSA-N	0	3	349.478	3.038	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cn(CC)c2ccccc12	ZINC001049582975	1347921392	/nfs/dbraw/zinc/92/13/92/1347921392.db2.gz	RXAZOPQGWAHJGW-NHCUHLMSSA-N	0	3	349.478	3.363	20	30		EGEDHN
C=CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ncc(Cl)s1	ZINC001049588935	1347924688	/nfs/dbraw/zinc/92/46/88/1347924688.db2.gz	INZJYSOEWHUUCW-VXGBXAGGSA-N	0	3	325.865	3.052	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)CCc1ccc2[nH]ccc2c1	ZINC001049592776	1347927169	/nfs/dbraw/zinc/92/71/69/1347927169.db2.gz	JSXRRGBANHTUPF-SFTDATJTSA-N	0	3	349.478	3.189	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1c(C)onc1C1CC1	ZINC001049599490	1347930272	/nfs/dbraw/zinc/93/02/72/1347930272.db2.gz	SCAGLPJZZACMHO-JKSUJKDBSA-N	0	3	329.444	3.115	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1ccc(C)nc1C	ZINC001049633806	1347945511	/nfs/dbraw/zinc/94/55/11/1347945511.db2.gz	BEUWAYGAGMCWDT-RTBURBONSA-N	0	3	341.499	3.476	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1cccc(OC)c1	ZINC001049646619	1347952993	/nfs/dbraw/zinc/95/29/93/1347952993.db2.gz	QGOZMQSBRGOTBF-RTBURBONSA-N	0	3	342.483	3.473	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@H]2CCCN3C(=O)[C@H]2C[C@H]3C[C@H]3C2)c1	ZINC001049661585	1347961400	/nfs/dbraw/zinc/96/14/00/1347961400.db2.gz	WMBKTVRSWCYIJA-IFLJBQAJSA-N	0	3	349.478	3.170	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H]2[C@@H]1CCN2CCc1ccns1	ZINC001049699469	1347979144	/nfs/dbraw/zinc/97/91/44/1347979144.db2.gz	HVCBEEAAPZLPTO-ZIFCJYIRSA-N	0	3	347.528	3.353	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](C)OC1CCCCCC1	ZINC001049710101	1347985264	/nfs/dbraw/zinc/98/52/64/1347985264.db2.gz	UISFGCPVFFEAKW-NZSAHSFTSA-N	0	3	334.504	3.366	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1c(F)ccc(F)c1Cl	ZINC001049743476	1347997054	/nfs/dbraw/zinc/99/70/54/1347997054.db2.gz	QFPZBBYEKJDDFA-ZIAGYGMSSA-N	0	3	340.801	3.483	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(C)oc1C(F)(F)F	ZINC001049754957	1348003200	/nfs/dbraw/zinc/00/32/00/1348003200.db2.gz	PDQGKICXFMSYJC-ZIAGYGMSSA-N	0	3	342.361	3.472	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(Cl)c(OC)c1	ZINC001049762678	1348007728	/nfs/dbraw/zinc/00/77/28/1348007728.db2.gz	RKSJKKZLLSRHRI-CVEARBPZSA-N	0	3	334.847	3.214	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1cccc(C#N)c1	ZINC001049766805	1348010499	/nfs/dbraw/zinc/01/04/99/1348010499.db2.gz	DWWKBNZJEVPUKC-PWIZWCRZSA-N	0	3	339.483	3.416	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1oc(C(C)C)nc1C	ZINC001049774556	1348015249	/nfs/dbraw/zinc/01/52/49/1348015249.db2.gz	XIPJNXMWIFRLSM-HZPDHXFCSA-N	0	3	331.460	3.361	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccccc1F	ZINC001049782200	1348019352	/nfs/dbraw/zinc/01/93/52/1348019352.db2.gz	OOBYVRBFOLXSMX-KVPLUYHFSA-N	0	3	340.442	3.018	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C(C)(C)c1cccc(OC)c1	ZINC001049830249	1348044819	/nfs/dbraw/zinc/04/48/19/1348044819.db2.gz	DZLIGBMOIYAODW-RTBURBONSA-N	0	3	342.483	3.224	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cnn(CCC)c1C1CC1	ZINC001049834357	1348048073	/nfs/dbraw/zinc/04/80/73/1348048073.db2.gz	AMRIWTVXTVDSEI-ROUUACIJSA-N	0	3	342.487	3.035	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1occ2c1CCCC2	ZINC001049863901	1348071004	/nfs/dbraw/zinc/07/10/04/1348071004.db2.gz	PQAOLFVOKZKSII-MSOLQXFVSA-N	0	3	328.456	3.413	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ncccc1OC(C)C	ZINC001049870384	1348075964	/nfs/dbraw/zinc/07/59/64/1348075964.db2.gz	MWXWVLXUOPDUMV-IRXDYDNUSA-N	0	3	343.471	3.124	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H]1Cc2ccc(Cl)cc21	ZINC001049871270	1348076531	/nfs/dbraw/zinc/07/65/31/1348076531.db2.gz	PZOGWGHZDYBEGU-CEXWTWQISA-N	0	3	342.870	3.068	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)CCc1c[nH]c2ccccc12	ZINC001049876719	1348081751	/nfs/dbraw/zinc/08/17/51/1348081751.db2.gz	LRENFHBXPXIKEH-NHCUHLMSSA-N	0	3	349.478	3.189	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)CCc1ccc(CC)cc1	ZINC001049888306	1348092407	/nfs/dbraw/zinc/09/24/07/1348092407.db2.gz	GFWUKDSNCPMHDZ-NHCUHLMSSA-N	0	3	338.495	3.270	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cnn(C(C)(C)C)c1CC	ZINC001049899756	1348100219	/nfs/dbraw/zinc/10/02/19/1348100219.db2.gz	GPDDEXJIPTYGBL-ZWKOTPCHSA-N	0	3	344.503	3.065	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)CC1C2CC3CC(C2)CC1C3	ZINC001049902450	1348102208	/nfs/dbraw/zinc/10/22/08/1348102208.db2.gz	AONRQELAWYJVQR-WRZXQAEKSA-N	0	3	340.511	3.147	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H]1Cc2c1cccc2Cl	ZINC001049920974	1348113286	/nfs/dbraw/zinc/11/32/86/1348113286.db2.gz	DBJXEEASZTXASU-QXAKKESOSA-N	0	3	342.870	3.068	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](C)c1cccc(OC)c1	ZINC001049923292	1348115389	/nfs/dbraw/zinc/11/53/89/1348115389.db2.gz	UIRZVTVYOLIGBN-ZYSHUDEJSA-N	0	3	328.456	3.050	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CCCN(C(=O)c4ccccc4)[C@@H]3C2)c1	ZINC001049958772	1348133137	/nfs/dbraw/zinc/13/31/37/1348133137.db2.gz	ZMVJCMTYAFHOMK-LEWJYISDSA-N	0	3	345.446	3.295	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N1CCC[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001050023435	1348158294	/nfs/dbraw/zinc/15/82/94/1348158294.db2.gz	LSNUOYUVGKWAPN-GBESFXJTSA-N	0	3	337.467	3.027	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3nsc4ccccc43)[C@@H]2C1	ZINC001050055074	1348167480	/nfs/dbraw/zinc/16/74/80/1348167480.db2.gz	BGVLACQKLAQGLY-DZGCQCFKSA-N	0	3	327.453	3.019	20	30		EGEDHN
C#CCCN1C[C@@H]2CCCN(C(=O)c3ccc(-c4ccco4)o3)[C@@H]2C1	ZINC001050093196	1348180948	/nfs/dbraw/zinc/18/09/48/1348180948.db2.gz	IZQIVYIXHCYJAL-JKSUJKDBSA-N	0	3	338.407	3.099	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)C[C@@H]3CCOc4ccccc43)[C@@H]2C1	ZINC001050110103	1348186119	/nfs/dbraw/zinc/18/61/19/1348186119.db2.gz	FWAGTISKBFZPIZ-JENIJYKNSA-N	0	3	340.467	3.052	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC[C@H](CNCc3nc(C)oc3C)CC2)C1	ZINC001050362722	1348238754	/nfs/dbraw/zinc/23/87/54/1348238754.db2.gz	HLGDAQKIEPNXFQ-QAQDUYKDSA-N	0	3	345.487	3.412	20	30		EGEDHN
C[C@H](c1cccc(Cl)c1)N1CCC2(CN(C(=O)[C@@H](C)C#N)C2)CC1	ZINC001050460887	1348271639	/nfs/dbraw/zinc/27/16/39/1348271639.db2.gz	ZRBSHYSLKMZJRY-LSDHHAIUSA-N	0	3	345.874	3.485	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC2(C1)CCN(Cc1cccc(C(F)F)c1)CC2	ZINC001050463515	1348272179	/nfs/dbraw/zinc/27/21/79/1348272179.db2.gz	TZMKDRSBIFYGPZ-CQSZACIVSA-N	0	3	347.409	3.208	20	30		EGEDHN
C[C@@H](C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)CC2)C1CC1	ZINC001050474171	1348274366	/nfs/dbraw/zinc/27/43/66/1348274366.db2.gz	HMPUTHHIDVRGCN-MRXNPFEDSA-N	0	3	337.467	3.029	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@]3(C)CC[C@H](C)C3(C)C)C2)CC1	ZINC001050690518	1348328677	/nfs/dbraw/zinc/32/86/77/1348328677.db2.gz	QYZSXOXZFIHRKV-PXNSSMCTSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H]3C[C@H]3c3cccc(C)c3)C2)CC1	ZINC001050695095	1348329728	/nfs/dbraw/zinc/32/97/28/1348329728.db2.gz	WPGDZCQGGFATON-VQTJNVASSA-N	0	3	336.479	3.046	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@H](CC)Cc3ccccc3C)C2)CC1	ZINC001050728440	1348339482	/nfs/dbraw/zinc/33/94/82/1348339482.db2.gz	SDTRVHJGQAEEOO-LJQANCHMSA-N	0	3	338.495	3.121	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3sccc3C(C)C)C2)CC1	ZINC001050762504	1348351440	/nfs/dbraw/zinc/35/14/40/1348351440.db2.gz	GKHLFACWYSDBNF-UHFFFAOYSA-N	0	3	330.497	3.433	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C3CC(c4ccccc4)C3)C2)CC1	ZINC001050769977	1348354356	/nfs/dbraw/zinc/35/43/56/1348354356.db2.gz	MICGCZWVJOOZTA-UHFFFAOYSA-N	0	3	336.479	3.128	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)[C@H]3CC[C@@H](CC)O3)cccc2C1	ZINC001051290619	1348420374	/nfs/dbraw/zinc/42/03/74/1348420374.db2.gz	ZFWOAFMZVDDNQZ-UYAOXDASSA-N	0	3	342.483	3.195	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)C3CCC(F)CC3)cccc2C1	ZINC001051298344	1348423749	/nfs/dbraw/zinc/42/37/49/1348423749.db2.gz	MUHUDRDRAPUZAD-UHFFFAOYSA-N	0	3	342.458	3.213	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)[C@@H]3CCO[C@@H](C)C3)cccc2C1	ZINC001051303870	1348426803	/nfs/dbraw/zinc/42/68/03/1348426803.db2.gz	QAOJVUYKDYSIOB-DLBZAZTESA-N	0	3	342.483	3.052	20	30		EGEDHN
C=C(C)CCN1CCN([C@H]2CCN(C(=O)CCC3CCCC3)C2)CC1	ZINC001051974746	1348493461	/nfs/dbraw/zinc/49/34/61/1348493461.db2.gz	KFOXATRXRISBNA-FQEVSTJZSA-N	0	3	347.547	3.142	20	30		EGEDHN
C=C(C)CCN1CCN([C@@H]2CCN(C(=O)C3CCCCCC3)C2)CC1	ZINC001051991173	1348494887	/nfs/dbraw/zinc/49/48/87/1348494887.db2.gz	FCWZQUCDOFNDCW-HXUWFJFHSA-N	0	3	347.547	3.142	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@H](C)c2ccc(CC)cc2)CC1	ZINC001052793490	1348681327	/nfs/dbraw/zinc/68/13/27/1348681327.db2.gz	DXKMXGFXAFOGGV-YLJYHZDGSA-N	0	3	326.484	3.347	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2cc(Cl)cc(Cl)c2)CC1	ZINC001052892879	1348729732	/nfs/dbraw/zinc/72/97/32/1348729732.db2.gz	NEZWTMYEUKPWNR-HNNXBMFYSA-N	0	3	325.239	3.211	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2cc(Cl)cc(Cl)c2)CC1	ZINC001052892880	1348730110	/nfs/dbraw/zinc/73/01/10/1348730110.db2.gz	NEZWTMYEUKPWNR-OAHLLOKOSA-N	0	3	325.239	3.211	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccccc2CC(C)C)CC1	ZINC001052966432	1348777820	/nfs/dbraw/zinc/77/78/20/1348777820.db2.gz	VMTWZBFSULEPSG-LJQANCHMSA-N	0	3	326.484	3.493	20	30		EGEDHN
C=CC[N@H+]1CCC[C@H]([C@H]2CCCN(C(=O)c3ccccc3[O-])C2)C1	ZINC001053008637	1348807330	/nfs/dbraw/zinc/80/73/30/1348807330.db2.gz	SMXLENYYHZWVKJ-IRXDYDNUSA-N	0	3	328.456	3.142	20	30		EGEDHN
C=CC[N@@H+]1CCC[C@H]([C@H]2CCCN(C(=O)c3ccccc3[O-])C2)C1	ZINC001053008637	1348807332	/nfs/dbraw/zinc/80/73/32/1348807332.db2.gz	SMXLENYYHZWVKJ-IRXDYDNUSA-N	0	3	328.456	3.142	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cccc(F)c2)C1	ZINC001053062843	1348874577	/nfs/dbraw/zinc/87/45/77/1348874577.db2.gz	CXVXYIBHZHWANC-PKOBYXMFSA-N	0	3	328.431	3.166	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2coc(C)c2)C1	ZINC001053080550	1348901393	/nfs/dbraw/zinc/90/13/93/1348901393.db2.gz	PZGYUHUKAMVZHR-HKUYNNGSSA-N	0	3	328.456	3.318	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(F)c(C)c2)C1	ZINC001053091470	1348917269	/nfs/dbraw/zinc/91/72/69/1348917269.db2.gz	AKLIBGOJNMYRDN-ICSRJNTNSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(C#C)cc2)C1	ZINC001053093914	1348922306	/nfs/dbraw/zinc/92/23/06/1348922306.db2.gz	RXOJNOULUFGJOB-RTWAWAEBSA-N	0	3	334.463	3.008	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccc(OC)o2)C1	ZINC001053102943	1348936576	/nfs/dbraw/zinc/93/65/76/1348936576.db2.gz	XWEVXXZAEDUDEJ-DLBZAZTESA-N	0	3	344.455	3.018	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2nc(C)c(C)s2)C1	ZINC001053104064	1348939190	/nfs/dbraw/zinc/93/91/90/1348939190.db2.gz	BPPRVIMZUFZQOS-IRXDYDNUSA-N	0	3	345.512	3.100	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2cc(C3CC3)[nH]c2C2CC2)C1	ZINC001079958108	1357438399	/nfs/dbraw/zinc/43/83/99/1357438399.db2.gz	LUEBCTLVRFDNEP-FZKQIMNGSA-N	0	3	327.472	3.396	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(C)c(F)c1)C2	ZINC001054161496	1349163741	/nfs/dbraw/zinc/16/37/41/1349163741.db2.gz	HFZWZKKEPXVQTL-HXUWFJFHSA-N	0	3	328.431	3.086	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)CCc1ccc3[nH]ccc3c1)C2	ZINC001054165733	1349168191	/nfs/dbraw/zinc/16/81/91/1349168191.db2.gz	NPQOYLQKMQUDJC-JOCHJYFZSA-N	0	3	349.478	3.048	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)CCc1ccc(C)cc1C)C2	ZINC001054173014	1349174459	/nfs/dbraw/zinc/17/44/59/1349174459.db2.gz	FJYBYFQDTGXSHF-QFIPXVFZSA-N	0	3	338.495	3.184	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@]2(CCN(Cc3ncccc3C)C2)C1	ZINC001054177503	1349179733	/nfs/dbraw/zinc/17/97/33/1349179733.db2.gz	NDHKZMSVFOGWFG-NRFANRHFSA-N	0	3	341.499	3.417	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@H](C)Cc1cccs1)C2	ZINC001054204834	1349206209	/nfs/dbraw/zinc/20/62/09/1349206209.db2.gz	FDLHGQVMODKAFZ-XLIONFOSSA-N	0	3	344.524	3.265	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccccc1OC(C)C)C2	ZINC001054230379	1349224609	/nfs/dbraw/zinc/22/46/09/1349224609.db2.gz	RRDAPTGPQCQNAZ-NRFANRHFSA-N	0	3	340.467	3.035	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)C(C)(C)C(C)(F)F)C2	ZINC001054233753	1349226280	/nfs/dbraw/zinc/22/62/80/1349226280.db2.gz	RFEOUDJTYJHJTA-GOSISDBHSA-N	0	3	326.431	3.006	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc3c(s1)CCCC3)C2	ZINC001054236873	1349229891	/nfs/dbraw/zinc/22/98/91/1349229891.db2.gz	OEAUHHSQIYUJEI-HXUWFJFHSA-N	0	3	342.508	3.188	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H](C)c1ccc(F)c(F)c1)C2	ZINC001054243212	1349236958	/nfs/dbraw/zinc/23/69/58/1349236958.db2.gz	ZBTISSKPICVCLS-MGPUTAFESA-N	0	3	346.421	3.016	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc3cccc(C)c3o1)C2	ZINC001054246685	1349241448	/nfs/dbraw/zinc/24/14/48/1349241448.db2.gz	GONFWTZKDFIOGG-NRFANRHFSA-N	0	3	336.435	3.303	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3ccc(F)nc3)cc2C1	ZINC001054258110	1349253757	/nfs/dbraw/zinc/25/37/57/1349253757.db2.gz	JHDWBTXFOHOSEL-UHFFFAOYSA-N	0	3	339.414	3.433	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3oc(C)nc3C)cc2C1	ZINC001054259470	1349254479	/nfs/dbraw/zinc/25/44/79/1349254479.db2.gz	BLJVELIJZGHNKP-UHFFFAOYSA-N	0	3	325.412	3.113	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3ccc(F)cn3)cc2C1	ZINC001054262369	1349260017	/nfs/dbraw/zinc/26/00/17/1349260017.db2.gz	YWVXILZVMQTMAR-UHFFFAOYSA-N	0	3	339.414	3.433	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@@H]3CCCO[C@H]3C=C)cc2C1	ZINC001054265365	1349262934	/nfs/dbraw/zinc/26/29/34/1349262934.db2.gz	LVWOTFORIYVVRF-UXHICEINSA-N	0	3	340.467	3.176	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@H]3OCC[C@H]3C)cc2C1	ZINC001054282519	1349283438	/nfs/dbraw/zinc/28/34/38/1349283438.db2.gz	JEKVADAKPZOBKU-BEFAXECRSA-N	0	3	328.456	3.010	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@@H]3CCO[C@H](C)C3)cc2C1	ZINC001054287115	1349290098	/nfs/dbraw/zinc/29/00/98/1349290098.db2.gz	ZMXAXNKAOOGGKO-SJLPKXTDSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@@H]3CCO[C@@H](CC)C3)cc2C1	ZINC001054289072	1349292874	/nfs/dbraw/zinc/29/28/74/1349292874.db2.gz	SYZPJDKSWUWZOW-XLIONFOSSA-N	0	3	342.483	3.400	20	30		EGEDHN
C[C@H]1CN(C(=O)c2ccccc2F)C[C@H]1NCc1ccc(C#N)s1	ZINC001054341037	1349320742	/nfs/dbraw/zinc/32/07/42/1349320742.db2.gz	LIMOLXJXGJXHHW-YVEFUNNKSA-N	0	3	343.427	3.009	20	30		EGEDHN
C[C@H]1CN(C(=O)C2CCCCC2)C[C@@H]1NCc1ccc(C#N)c(F)c1	ZINC001054344268	1349323217	/nfs/dbraw/zinc/32/32/17/1349323217.db2.gz	CKVHPUBITNIQNM-LIRRHRJNSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@H]1CN(C(=O)c2ccc(Cl)o2)C[C@H]1NCc1ccc(C#N)s1	ZINC001054389075	1349345238	/nfs/dbraw/zinc/34/52/38/1349345238.db2.gz	FQUHVRQRISQHSP-GXFFZTMASA-N	0	3	349.843	3.116	20	30		EGEDHN
C[C@H]1CN(C(=O)CCC2CCC2)C[C@H]1NCc1ccc(C#N)c(F)c1	ZINC001054523057	1349382408	/nfs/dbraw/zinc/38/24/08/1349382408.db2.gz	CESLPIHZYYURQP-IFXJQAMLSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=CCn1cccc1C(=O)N1C[C@H](NCc2ccccc2F)[C@@H](C)C1	ZINC001054751939	1349453976	/nfs/dbraw/zinc/45/39/76/1349453976.db2.gz	WHNXITGHMPEXJY-YJBOKZPZSA-N	0	3	341.430	3.064	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CC3(CCC3)C2)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054992271	1349541645	/nfs/dbraw/zinc/54/16/45/1349541645.db2.gz	PDCNGDHEGYIPOQ-DYVFJYSZSA-N	0	3	343.496	3.137	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)c2occc2C(C)C)C1	ZINC001070421460	1354343614	/nfs/dbraw/zinc/34/36/14/1354343614.db2.gz	KYCIRTFVKDBOKP-CQSZACIVSA-N	0	3	342.443	3.031	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)CCC1CCCC1)C[C@H](C)O2	ZINC001071126326	1354466387	/nfs/dbraw/zinc/46/63/87/1354466387.db2.gz	BIHCAYUGTPWQBF-PXNSSMCTSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)CC1=CCCCC1)C[C@H](C)O2	ZINC001071146089	1354475963	/nfs/dbraw/zinc/47/59/63/1354475963.db2.gz	GMEHEJNHAAFEGI-FXAWDEMLSA-N	0	3	332.488	3.145	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1cccc(F)c1C)C[C@H](C)O2	ZINC001071171417	1354486916	/nfs/dbraw/zinc/48/69/16/1354486916.db2.gz	MWYHBUGOMIPQRA-MGPUTAFESA-N	0	3	346.446	3.016	20	30		EGEDHN
C#CCCN1CC[C@]2(C1)CN(C(=O)C1(C)CCCCCC1)C[C@@H](C)O2	ZINC001071178255	1354488794	/nfs/dbraw/zinc/48/87/94/1354488794.db2.gz	MMBGVVKEPXSGJF-NQIIRXRSSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C1(C)CCCCC1)C[C@@H](C)O2	ZINC001071206534	1354504867	/nfs/dbraw/zinc/50/48/67/1354504867.db2.gz	LQHGDNKPXNRFKG-XLIONFOSSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C1CCC=CCC1)C[C@H](C)O2	ZINC001071244551	1354524335	/nfs/dbraw/zinc/52/43/35/1354524335.db2.gz	WSRXUZXEKATECL-PXNSSMCTSA-N	0	3	332.488	3.001	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3csc(C)c3C)C2)CC1	ZINC001086924236	1359249868	/nfs/dbraw/zinc/24/98/68/1359249868.db2.gz	NDYXIMDDESUPMB-CQSZACIVSA-N	0	3	330.497	3.315	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2coc3c2cccc3OC)CC[C@@H]1C	ZINC001071512586	1354736385	/nfs/dbraw/zinc/73/63/85/1354736385.db2.gz	ZKUMEVNLLQLMHD-LSDHHAIUSA-N	0	3	340.423	3.047	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc(C)c(OC)c(C)c2)CC[C@@H]1C	ZINC001071523006	1354744070	/nfs/dbraw/zinc/74/40/70/1354744070.db2.gz	VZHXVMBNABZXLR-WMZOPIPTSA-N	0	3	330.472	3.471	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@@H]2CCCCCN(C(=O)C3CCC3)C2)c1	ZINC001088246279	1359815706	/nfs/dbraw/zinc/81/57/06/1359815706.db2.gz	OVQFAVHAOVURQJ-GOSISDBHSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2conc2C2CCCC2)CC[C@H]1C	ZINC001071561706	1354764718	/nfs/dbraw/zinc/76/47/18/1354764718.db2.gz	TXISZMHQFLIUIL-ZBFHGGJFSA-N	0	3	331.460	3.491	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cn(C)c3ccc(F)cc23)CC[C@H]1C	ZINC001071571198	1354770656	/nfs/dbraw/zinc/77/06/56/1354770656.db2.gz	AOTQJSKSHMAEII-ZBFHGGJFSA-N	0	3	343.446	3.476	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2c3c[nH]nc3ccc2C)CC[C@@H]1C	ZINC001071624274	1354807299	/nfs/dbraw/zinc/80/72/99/1354807299.db2.gz	GNLZVBNKXKBGEV-LSDHHAIUSA-N	0	3	326.444	3.030	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc(C)nn2C(CC)CC)CC[C@@H]1C	ZINC001071631639	1354813908	/nfs/dbraw/zinc/81/39/08/1354813908.db2.gz	PNYCPURDCFWJKF-DLBZAZTESA-N	0	3	344.503	3.159	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2cc(F)c(C)cc2F)CC[C@@H]1C	ZINC001071701948	1354861603	/nfs/dbraw/zinc/86/16/03/1354861603.db2.gz	QPWRFOOHVHCEJQ-GOEBONIOSA-N	0	3	336.426	3.361	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(C(F)(F)F)nc2)CC[C@@H]1C	ZINC001071721428	1354879466	/nfs/dbraw/zinc/87/94/66/1354879466.db2.gz	QNABWHROQVIBJF-JSGCOSHPSA-N	0	3	341.377	3.259	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc3ccccc3n2C)CC[C@@H]1C	ZINC001071773121	1354921124	/nfs/dbraw/zinc/92/11/24/1354921124.db2.gz	WQKGLUBINPDEBP-RDJZCZTQSA-N	0	3	325.456	3.337	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)Cc2c(C)[nH]c3ccccc32)CC[C@@H]1C	ZINC001071783448	1354932023	/nfs/dbraw/zinc/93/20/23/1354932023.db2.gz	OSYWIWPBSJHVIR-GOEBONIOSA-N	0	3	325.456	3.174	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(F)c(COC)c2)CC[C@H]1C	ZINC001071820052	1354961552	/nfs/dbraw/zinc/96/15/52/1354961552.db2.gz	ZJNHJRSKDARXLT-RHSMWYFYSA-N	0	3	334.435	3.131	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccccc2-n2cccn2)CC[C@H]1C	ZINC001071851770	1354980272	/nfs/dbraw/zinc/98/02/72/1354980272.db2.gz	POKLASAEMKWCTG-SJORKVTESA-N	0	3	338.455	3.031	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(-c3cn[nH]c3)cc2)CC[C@@H]1C	ZINC001071893350	1355010174	/nfs/dbraw/zinc/01/01/74/1355010174.db2.gz	NUPLBYHLXVNPAQ-KXBFYZLASA-N	0	3	338.455	3.236	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(C)nc2OCCC)CC[C@@H]1C	ZINC001071937781	1355034556	/nfs/dbraw/zinc/03/45/56/1355034556.db2.gz	HISBVVNWMVIPRC-IRXDYDNUSA-N	0	3	345.487	3.338	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2c(C)nn(CCC)c2C)CC[C@@H]1C	ZINC001071972517	1355053278	/nfs/dbraw/zinc/05/32/78/1355053278.db2.gz	WUPWTBJZNYPWCB-WMLDXEAASA-N	0	3	332.492	3.069	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2c(C)nn(C(C)C)c2C)CC[C@H]1C	ZINC001071982715	1355058482	/nfs/dbraw/zinc/05/84/82/1355058482.db2.gz	PSEDUMOEAYDSMP-CRAIPNDOSA-N	0	3	346.519	3.169	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CC[C@H](C)N(Cc3ccc(C)cc3)C2)nc1	ZINC001071998275	1355066888	/nfs/dbraw/zinc/06/68/88/1355066888.db2.gz	IEUFMYJQRDNXAB-PXNSSMCTSA-N	0	3	347.462	3.154	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(N(CC)CC)cc2)CC[C@H]1C	ZINC001072023452	1355086214	/nfs/dbraw/zinc/08/62/14/1355086214.db2.gz	RFBBUEGUHXRYJQ-IEBWSBKVSA-N	0	3	341.499	3.139	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccsc2C(F)F)CC[C@@H]1C	ZINC001072032560	1355092347	/nfs/dbraw/zinc/09/23/47/1355092347.db2.gz	DZLOGOLHKHWUPM-NWDGAFQWSA-N	0	3	326.412	3.292	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc(C)nc3ccccc32)CC[C@@H]1C	ZINC001072049637	1355103511	/nfs/dbraw/zinc/10/35/11/1355103511.db2.gz	QFMMFLAMVVDNED-IRXDYDNUSA-N	0	3	335.451	3.149	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccccc2OCC2CC2)CC[C@@H]1C	ZINC001072099080	1355128953	/nfs/dbraw/zinc/12/89/53/1355128953.db2.gz	LGSVTUSEBUODCG-FUHWJXTLSA-N	0	3	340.467	3.081	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)Cc2c(C)oc3ccccc32)CC[C@@H]1C	ZINC001072128823	1355144405	/nfs/dbraw/zinc/14/44/05/1355144405.db2.gz	FZFYUCMTBOMTQZ-HOCLYGCPSA-N	0	3	326.440	3.439	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccccc1N(C)C	ZINC001089736171	1360641552	/nfs/dbraw/zinc/64/15/52/1360641552.db2.gz	LFKGNBGTLAGRLF-MRXNPFEDSA-N	0	3	329.488	3.159	20	30		EGEDHN
C[C@H]1CCN(C(=O)C2CC=CC2)C[C@@H]1CNCc1ccccc1C#N	ZINC001072237789	1355198479	/nfs/dbraw/zinc/19/84/79/1355198479.db2.gz	AFSJQQXOHMURCZ-JXFKEZNVSA-N	0	3	337.467	3.099	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](C)[C@@H](CNCc2cc(C)no2)C1	ZINC001072335332	1355244598	/nfs/dbraw/zinc/24/45/98/1355244598.db2.gz	NGNXMNSHHJNOGG-HOCLYGCPSA-N	0	3	333.476	3.160	20	30		EGEDHN
C[C@@H]1CCN(C(=O)CC(C)(F)F)C[C@@H]1CNCc1ccccc1C#N	ZINC001072359813	1355255776	/nfs/dbraw/zinc/25/57/76/1355255776.db2.gz	HXEAPPXSHOIWSI-PBHICJAKSA-N	0	3	349.425	3.178	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1ccc(OC)cc1)C2	ZINC001072944895	1355513460	/nfs/dbraw/zinc/51/34/60/1355513460.db2.gz	NLXNUDSHNHGZGT-FQEVSTJZSA-N	0	3	342.483	3.332	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3csc4c3CC[C@H](C)C4)C2)C1	ZINC001073403822	1355758409	/nfs/dbraw/zinc/75/84/09/1355758409.db2.gz	BFERLDGDVNEYTB-AWEZNQCLSA-N	0	3	330.497	3.207	20	30		EGEDHN
C#CCCN1CCCO[C@@H](CNC(=O)C2CC(C)(C)CC(C)(C)C2)C1	ZINC001073709632	1355872660	/nfs/dbraw/zinc/87/26/60/1355872660.db2.gz	BSUGHBUPQOPYKM-SFHVURJKSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2ccccc2CC(C)C)C1	ZINC001073904456	1355948674	/nfs/dbraw/zinc/94/86/74/1355948674.db2.gz	FNRDOXPYXZPMQS-IBGZPJMESA-N	0	3	344.499	3.282	20	30		EGEDHN
C[C@@H](CC(=O)N1CC[C@H](NCc2ccc(C#N)s2)[C@@H]1C)C1CC1	ZINC001075134069	1356324289	/nfs/dbraw/zinc/32/42/89/1356324289.db2.gz	ZCMQYOSJNVTRCT-DCGLDWPTSA-N	0	3	331.485	3.135	20	30		EGEDHN
C=CCN1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)[C@H]2C[C@@H]2C)C1	ZINC001075422101	1356364630	/nfs/dbraw/zinc/36/46/30/1356364630.db2.gz	KYVAQEBQBHWIEF-WLWJZTKJSA-N	0	3	330.447	3.189	20	30		EGEDHN
CC(=O)N1CCC([C@H]2CCCN(Cc3ccccc3C#N)CC2)CC1	ZINC001075442193	1356371233	/nfs/dbraw/zinc/37/12/33/1356371233.db2.gz	ZPGUQXFKYRHFLY-SFHVURJKSA-N	0	3	339.483	3.419	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1c(C)cc(C)cc1C)C2	ZINC001097773111	1363117693	/nfs/dbraw/zinc/11/76/93/1363117693.db2.gz	RKUVFUUMPPFCJI-RLLQIKCJSA-N	0	3	326.484	3.452	20	30		EGEDHN
CCCCCCN(C)CC(=O)NC[C@@H](C)Nc1cccc(F)c1C#N	ZINC001098008458	1363196031	/nfs/dbraw/zinc/19/60/31/1363196031.db2.gz	PZQJAFZVFGNSDF-OAHLLOKOSA-N	0	3	348.466	3.126	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3ccc(-c4ccccc4)o3)[C@@H]2C1	ZINC001076269868	1356531972	/nfs/dbraw/zinc/53/19/72/1356531972.db2.gz	HRPISKLPYFKWHN-ZWKOTPCHSA-N	0	3	334.419	3.116	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3c3cccc(Cl)c3)[C@@H]2C1	ZINC001076340583	1356552444	/nfs/dbraw/zinc/55/24/44/1356552444.db2.gz	JXYRXHFZHBUHFC-DZJNRPSUSA-N	0	3	330.859	3.162	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3c3ccc(C)s3)[C@@H]2C1	ZINC001076341062	1356552657	/nfs/dbraw/zinc/55/26/57/1356552657.db2.gz	ZSKGDDSQLTZDAL-YLFCFFPRSA-N	0	3	330.497	3.269	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)COc3ccccc3C(C)C)[C@@H]2C1	ZINC001076543180	1356613933	/nfs/dbraw/zinc/61/39/33/1356613933.db2.gz	ZEJXCBAWCKCGFW-PKOBYXMFSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)Cc1ccc(OC)cc1C	ZINC001099098331	1363620977	/nfs/dbraw/zinc/62/09/77/1363620977.db2.gz	NUIXYNKEZCUFCZ-SFHVURJKSA-N	0	3	344.499	3.339	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)CCc1csc(C)n1	ZINC001099257473	1363718017	/nfs/dbraw/zinc/71/80/17/1363718017.db2.gz	GAYATLPHXMWEKU-MRXNPFEDSA-N	0	3	335.517	3.177	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)C[C@@H](C)C1CC1	ZINC001099359592	1363772464	/nfs/dbraw/zinc/77/24/64/1363772464.db2.gz	RSYYXTPFDYYTSI-SJLPKXTDSA-N	0	3	336.520	3.232	20	30		EGEDHN
C#CCCN1C[C@@H](C)[C@H](NC(=O)c2cccc(Cl)c2Cl)C1	ZINC001080839128	1357750205	/nfs/dbraw/zinc/75/02/05/1357750205.db2.gz	YBJOTYMRRBTKEV-BXUZGUMPSA-N	0	3	325.239	3.067	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@H](NC(=O)C3CCC3)C23CCC3)c(F)c1	ZINC001078523452	1356992681	/nfs/dbraw/zinc/99/26/81/1356992681.db2.gz	KZUAFJQCAXFELM-ROUUACIJSA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)c2ccccc2)C12CCC2	ZINC001078539655	1357004450	/nfs/dbraw/zinc/00/44/50/1357004450.db2.gz	WDFTWYLMMJKMTO-LSDHHAIUSA-N	0	3	349.272	3.226	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc(Cl)cn2C)C12CCC2	ZINC001078676570	1357050647	/nfs/dbraw/zinc/05/06/47/1357050647.db2.gz	YLWCXBODGVWZNN-UONOGXRCSA-N	0	3	342.270	3.062	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc(OC)cs2)C12CCC2	ZINC001078695671	1357059366	/nfs/dbraw/zinc/05/93/66/1357059366.db2.gz	PSGNZTFODKVEGF-UONOGXRCSA-N	0	3	340.876	3.140	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@H](NCc3c(C)noc3C)C23CCC3)C1	ZINC001078720448	1357065379	/nfs/dbraw/zinc/06/53/79/1357065379.db2.gz	LCQDEPCEDKTABR-IRXDYDNUSA-N	0	3	343.471	3.165	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2ncoc2C(C)C)C12CCC2	ZINC001078774565	1357078319	/nfs/dbraw/zinc/07/83/19/1357078319.db2.gz	ZFJPMJLOQXKMBF-CHWSQXEVSA-N	0	3	337.851	3.181	20	30		EGEDHN
C=CCCN1C[C@@H](C)[C@H](NC(=O)c2ccc(C(F)(F)F)s2)C1	ZINC001081028365	1357786906	/nfs/dbraw/zinc/78/69/06/1357786906.db2.gz	DXGRZOMQKDOSNH-GHMZBOCLSA-N	0	3	332.391	3.393	20	30		EGEDHN
C=C(C)CCN1C[C@@H](C)[C@H](NC(=O)c2cnc(CC(C)C)s2)C1	ZINC001081034814	1357788284	/nfs/dbraw/zinc/78/82/84/1357788284.db2.gz	UCUNHQCHOKJFCC-HUUCEWRRSA-N	0	3	335.517	3.358	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2coc3cc(C)c(C)cc32)[C@H](OC)C1	ZINC001081983838	1357909879	/nfs/dbraw/zinc/90/98/79/1357909879.db2.gz	ISUDTDBRIWONAW-IEBWSBKVSA-N	0	3	342.439	3.055	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)[C@H](C)CC3CCCC3)[C@H]2C1	ZINC001083212939	1358124443	/nfs/dbraw/zinc/12/44/43/1358124443.db2.gz	HPRSHOPMGQYWNN-NZSAHSFTSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3cnc(-c4ccccc4)o3)[C@@H]2C1	ZINC001084430832	1358212010	/nfs/dbraw/zinc/21/20/10/1358212010.db2.gz	CASNPGIDJFWFHS-IAGOWNOFSA-N	0	3	337.423	3.064	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)C3(c4ccccc4)CCCC3)[C@@H]2C1	ZINC001084814446	1358319195	/nfs/dbraw/zinc/31/91/95/1358319195.db2.gz	FSCWJYKSFYGQAB-UYAOXDASSA-N	0	3	336.479	3.054	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)CC(C)(C)c3ccccc3)[C@@H]2C1	ZINC001084852007	1358328915	/nfs/dbraw/zinc/32/89/15/1358328915.db2.gz	BJYNAIFSVHYGCC-IEBWSBKVSA-N	0	3	326.484	3.463	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@H](CC)c3ccc(F)cc3)[C@@H]2C1	ZINC001084858126	1358331035	/nfs/dbraw/zinc/33/10/35/1358331035.db2.gz	LMTQHPPMMUSRLB-BHIYHBOVSA-N	0	3	330.447	3.428	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)Cc3c(C)oc4ccccc43)[C@@H]2C1	ZINC001084874708	1358337651	/nfs/dbraw/zinc/33/76/51/1358337651.db2.gz	FHIGNPHYGNTRMT-VQIMIIECSA-N	0	3	338.451	3.393	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@@H]3CCCc4ccccc43)C[C@@H]21	ZINC001084971969	1358357988	/nfs/dbraw/zinc/35/79/88/1358357988.db2.gz	JGQNUGRFIPYGQQ-NRSPTQNISA-N	0	3	336.479	3.053	20	30		EGEDHN
C[C@]1(C(=O)N2CC[C@H]3CCN(Cc4ccc(C#N)cc4)[C@H]3C2)C=CCC1	ZINC001085010375	1358365742	/nfs/dbraw/zinc/36/57/42/1358365742.db2.gz	UZFZKSNWMZAREB-URVUXULASA-N	0	3	349.478	3.337	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CCN(C(=O)[C@@H]4CC45CCC5)C[C@@H]32)c1	ZINC001085044429	1358375404	/nfs/dbraw/zinc/37/54/04/1358375404.db2.gz	UMZSPAAHEWTPMA-AABGKKOBSA-N	0	3	349.478	3.171	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@H](C)Cc3ccccc3C)C[C@@H]21	ZINC001085103511	1358392728	/nfs/dbraw/zinc/39/27/28/1358392728.db2.gz	VVCRYWWMDNVNAO-NSHGMRRFSA-N	0	3	326.484	3.282	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1c[nH]nc1-c1ccoc1	ZINC001085283309	1358450877	/nfs/dbraw/zinc/45/08/77/1358450877.db2.gz	JICABCWVQGJUIK-HUUCEWRRSA-N	0	3	348.834	3.053	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1oc(C(C)C)nc1C	ZINC001085357788	1358477587	/nfs/dbraw/zinc/47/75/87/1358477587.db2.gz	PTMLUZQFCWRGEL-ZIAGYGMSSA-N	0	3	339.867	3.490	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccc2c(c1)COC2	ZINC001085360925	1358478286	/nfs/dbraw/zinc/47/82/86/1358478286.db2.gz	HGUYQQULYFWWBX-IAGOWNOFSA-N	0	3	334.847	3.100	20	30		EGEDHN
Cc1ccccc1[C@H](C)N1CC[C@H]1CN(C)C(=O)c1c[nH]c(C#N)c1	ZINC001085556769	1358592245	/nfs/dbraw/zinc/59/22/45/1358592245.db2.gz	ZMKQENHCGQIFSX-YJBOKZPZSA-N	0	3	336.439	3.102	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1ccccc1-c1ccncc1	ZINC001085670641	1358675784	/nfs/dbraw/zinc/67/57/84/1358675784.db2.gz	BHOOGROWZGMCOT-SFHVURJKSA-N	0	3	335.451	3.471	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ncsc1C(F)(F)F	ZINC001085718297	1358709173	/nfs/dbraw/zinc/70/91/73/1358709173.db2.gz	NKVSLDYMODYENJ-LLVKDONJSA-N	0	3	347.406	3.274	20	30		EGEDHN
C=C1CCC(C(=O)N(C)C[C@@H]2CCN2C[C@@H](O)C2CCCCC2)CC1	ZINC001085801000	1358776619	/nfs/dbraw/zinc/77/66/19/1358776619.db2.gz	HQFZBQWSXUYREN-VQTJNVASSA-N	0	3	348.531	3.207	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@@H]1CCc2ccccc2C1	ZINC001085844017	1358811517	/nfs/dbraw/zinc/81/15/17/1358811517.db2.gz	BPHDDYNDZUEUBC-WOJBJXKFSA-N	0	3	326.484	3.290	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cnn(CC2CCCC2)c1	ZINC001085894512	1358854913	/nfs/dbraw/zinc/85/49/13/1358854913.db2.gz	DGLSGVUQHSFITF-IBGZPJMESA-N	0	3	344.503	3.186	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cnn(CCCC)c1C	ZINC001085917620	1358877875	/nfs/dbraw/zinc/87/78/75/1358877875.db2.gz	FNHAJHWYXJOPEZ-QGZVFWFLSA-N	0	3	332.492	3.104	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc(OC)c(Cl)c1	ZINC001085964647	1358922797	/nfs/dbraw/zinc/92/27/97/1358922797.db2.gz	NPKLBDQAPUOCQC-OAHLLOKOSA-N	0	3	336.863	3.461	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1[nH]c2ccccc2c1OC	ZINC001085992347	1358946197	/nfs/dbraw/zinc/94/61/97/1358946197.db2.gz	HZAVEWHVHYKKIN-OAHLLOKOSA-N	0	3	341.455	3.289	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cccc3ncccc32)C1	ZINC001086162579	1359012113	/nfs/dbraw/zinc/01/21/13/1359012113.db2.gz	VJCVTJRZUOLLJE-OKILXGFUSA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc3ccccc3n2C)C1	ZINC001086181697	1359018128	/nfs/dbraw/zinc/01/81/28/1359018128.db2.gz	KTVYUZCYHWNIOZ-OTVXOJSOSA-N	0	3	331.847	3.029	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2C[C@@H](NCc3ncccc3C)C2)CC1	ZINC001086187084	1359020744	/nfs/dbraw/zinc/02/07/44/1359020744.db2.gz	FOGRRSMKEVMUBC-MAEOIBBWSA-N	0	3	327.472	3.121	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccccc2OC2CCC2)C1	ZINC001086193462	1359024183	/nfs/dbraw/zinc/02/41/83/1359024183.db2.gz	BDSOUDKVJGVETL-GASCZTMLSA-N	0	3	348.874	3.468	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@@H]2C[C@H]2c2cccc(C)c2)C1	ZINC001086222987	1359032138	/nfs/dbraw/zinc/03/21/38/1359032138.db2.gz	RZJUZODIKNVANI-XOYOTBSWSA-N	0	3	332.875	3.335	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@H]2C[C@]23CCc2ccccc23)C1	ZINC001086240531	1359037982	/nfs/dbraw/zinc/03/79/82/1359037982.db2.gz	XLZJUZYHOYWJPA-CAUGKJMWSA-N	0	3	344.886	3.127	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cnc3ccc(F)cc3c2)C1	ZINC001086245782	1359041020	/nfs/dbraw/zinc/04/10/20/1359041020.db2.gz	AGJBVDPWUYDAPQ-DRQUAOQDSA-N	0	3	347.821	3.224	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2conc2C2CCCC2)C1	ZINC001086385768	1359084312	/nfs/dbraw/zinc/08/43/12/1359084312.db2.gz	KTRPERVGHCDRTA-MQMHXKEQSA-N	0	3	337.851	3.183	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)[C@@H]2CCC[C@H]2CC)C1	ZINC001086469123	1359109447	/nfs/dbraw/zinc/10/94/47/1359109447.db2.gz	CSFUQJBFNBWTKB-KBUPBQIOSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@H]2Cc3c2cccc3Cl)C1	ZINC001086562572	1359148270	/nfs/dbraw/zinc/14/82/70/1359148270.db2.gz	XWOHLCJQJSXKJW-HUBLWGQQSA-N	0	3	339.266	3.217	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)[C@H]2[C@@H]3CCCC[C@@H]32)C1	ZINC001086580970	1359154333	/nfs/dbraw/zinc/15/43/33/1359154333.db2.gz	BOHSAVNOBJCKGY-QGLKVJOYSA-N	0	3	336.479	3.030	20	30		EGEDHN
C=C(C)CN1C[C@@H](c2ccccc2)[C@H](NC(=O)[C@H]2CCC2(F)F)C1	ZINC001086594602	1359158665	/nfs/dbraw/zinc/15/86/65/1359158665.db2.gz	JTETTXBVRUGCGP-GVDBMIGSSA-N	0	3	334.410	3.192	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)C2(C)CC(F)(F)C2)C1	ZINC001086618728	1359166409	/nfs/dbraw/zinc/16/64/09/1359166409.db2.gz	IAYANWLKFKUZFC-DLBZAZTESA-N	0	3	346.421	3.029	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CC[C@H](CNC(=O)[C@@H]2CC=CCC2)C1	ZINC001086642505	1359175198	/nfs/dbraw/zinc/17/51/98/1359175198.db2.gz	IKAVUCHNCNTNSW-SQGPQFPESA-N	0	3	337.467	3.289	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2nc(C)sc2C)C1	ZINC001086730438	1359192397	/nfs/dbraw/zinc/19/23/97/1359192397.db2.gz	RFBHLOQLOKRTOQ-QWHCGFSZSA-N	0	3	327.881	3.001	20	30		EGEDHN
CC1(C)CC[C@@H]1C(=O)NC[C@H]1CC[C@@H](NCc2ccccc2C#N)C1	ZINC001086782040	1359200352	/nfs/dbraw/zinc/20/03/52/1359200352.db2.gz	LTJBXLJGKYQXTP-KFKAGJAMSA-N	0	3	339.483	3.369	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2csc(Cl)n2)C1	ZINC001086846645	1359212630	/nfs/dbraw/zinc/21/26/30/1359212630.db2.gz	IMZYNQFZRNONNK-VHSXEESVSA-N	0	3	334.272	3.037	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](CNCc2nc(C)c(C)s2)[C@@H](C)C1	ZINC001184017977	1387382376	/nfs/dbraw/zinc/38/23/76/1387382376.db2.gz	CSZRWYBOBANZRW-BBRMVZONSA-N	0	3	335.517	3.300	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccoc3CC)C2)CC1	ZINC001086920657	1359248000	/nfs/dbraw/zinc/24/80/00/1359248000.db2.gz	VWQPVWVXYUXORD-MRXNPFEDSA-N	0	3	328.456	3.182	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3cc(C)cc(C)n3)C2)CC1	ZINC001086929693	1359254225	/nfs/dbraw/zinc/25/42/25/1359254225.db2.gz	OTDFWQOJNBXBDK-SFHVURJKSA-N	0	3	339.483	3.038	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccncc3Cl)C2)CC1	ZINC001086945262	1359266575	/nfs/dbraw/zinc/26/65/75/1359266575.db2.gz	XDIBYVIYTMJBRM-OAHLLOKOSA-N	0	3	345.874	3.075	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)CC[C@@H]3CCCCO3)C2)CC1	ZINC001086945750	1359266944	/nfs/dbraw/zinc/26/69/44/1359266944.db2.gz	ICYLBXNTBCIDBG-OALUTQOASA-N	0	3	346.515	3.062	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)Cc3ccsc3C)C2)CC1	ZINC001086947280	1359268444	/nfs/dbraw/zinc/26/84/44/1359268444.db2.gz	UCFGNEJIKQXIGU-INIZCTEOSA-N	0	3	344.524	3.325	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3csc(C(C)C)n3)C2)CC1	ZINC001086949165	1359270019	/nfs/dbraw/zinc/27/00/19/1359270019.db2.gz	SSXOQUBFRIMLCY-HNNXBMFYSA-N	0	3	345.512	3.216	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@H](C)c3ccc(C)s3)C2)CC1	ZINC001086953105	1359273104	/nfs/dbraw/zinc/27/31/04/1359273104.db2.gz	ZBTIYAMTRYCBPW-DOTOQJQBSA-N	0	3	344.524	3.496	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001184078858	1387389667	/nfs/dbraw/zinc/38/96/67/1387389667.db2.gz	RCTBDKSOMKXMEY-SJLPKXTDSA-N	0	3	325.456	3.099	20	30		EGEDHN
Cn1ccnc1C(C#N)C(=O)CCCc1ccccc1Br	ZINC001343704923	1390732170	/nfs/dbraw/zinc/73/21/70/1390732170.db2.gz	NASXEXNFVPSSKX-ZDUSSCGKSA-N	0	3	346.228	3.382	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cscc3C)C(C)(C)[C@H]21	ZINC001087278290	1359353920	/nfs/dbraw/zinc/35/39/20/1359353920.db2.gz	FCDSZBOBLPTKEX-OIISXLGYSA-N	0	3	330.497	3.299	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cscc3C)C(C)(C)[C@@H]21	ZINC001087278288	1359354034	/nfs/dbraw/zinc/35/40/34/1359354034.db2.gz	FCDSZBOBLPTKEX-DJIMGWMZSA-N	0	3	330.497	3.299	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3c[nH]c4ccccc34)C(C)(C)[C@H]21	ZINC001087294823	1359375460	/nfs/dbraw/zinc/37/54/60/1359375460.db2.gz	YXICLRSNONQKLI-UXPWSPDFSA-N	0	3	349.478	3.410	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)Cc1ccc(C)cc1	ZINC001087294761	1359375578	/nfs/dbraw/zinc/37/55/78/1359375578.db2.gz	XXBKNCNMKDCAHE-HLAWJBBLSA-N	0	3	338.495	3.166	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)Cc3cc(C)cc(C)c3)C(C)(C)[C@H]21	ZINC001087303655	1359386741	/nfs/dbraw/zinc/38/67/41/1359386741.db2.gz	PVGAKKNMDGDIFN-NRSPTQNISA-N	0	3	338.495	3.084	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccoc3CCC)C(C)(C)[C@H]21	ZINC001087312169	1359399715	/nfs/dbraw/zinc/39/97/15/1359399715.db2.gz	AAEKSPQHGIBLJB-NXHRZFHOSA-N	0	3	328.456	3.084	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)C3(F)CCCCC3)C(C)(C)[C@@H]21	ZINC001087313358	1359401965	/nfs/dbraw/zinc/40/19/65/1359401965.db2.gz	SWQNKNARXVZYNK-BRWVUGGUSA-N	0	3	334.479	3.287	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1Cc1cncs1	ZINC001087378216	1359438883	/nfs/dbraw/zinc/43/88/83/1359438883.db2.gz	KNLADLZAAOGYKB-SVGFKBNWSA-N	0	3	345.512	3.024	20	30		EGEDHN
C=CCCN1CC[C@H](c2cccc(F)c2)[C@H](NC(=O)C2CCC2)C1	ZINC001087451670	1359472514	/nfs/dbraw/zinc/47/25/14/1359472514.db2.gz	DXQHOTFGFCHDQN-RTBURBONSA-N	0	3	330.447	3.476	20	30		EGEDHN
C=CCCN1CC[C@H](c2cccc(F)c2)[C@H](NC(=O)CC2CC2)C1	ZINC001087451915	1359473314	/nfs/dbraw/zinc/47/33/14/1359473314.db2.gz	RCJSKCIICQDWSU-RTBURBONSA-N	0	3	330.447	3.476	20	30		EGEDHN
C=CCCN1CC[C@H](c2cccc(F)c2)[C@H](NC(=O)[C@@H]2CC23CC3)C1	ZINC001087458504	1359475798	/nfs/dbraw/zinc/47/57/98/1359475798.db2.gz	FLMILMFTKHGAIY-CEXWTWQISA-N	0	3	342.458	3.476	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cn(C(C)(C)C)nc2C)[C@H]1CC	ZINC001087569343	1359536116	/nfs/dbraw/zinc/53/61/16/1359536116.db2.gz	RAHXVPIQSJLJIU-DLBZAZTESA-N	0	3	332.492	3.105	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cncn2-c2ccccc2)[C@H]1CC	ZINC001087602319	1359551038	/nfs/dbraw/zinc/55/10/38/1359551038.db2.gz	KCJOAFFNXMHMBS-ZWKOTPCHSA-N	0	3	338.455	3.031	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccnc(-c3ccco3)c2)[C@H]1CC	ZINC001087616241	1359555881	/nfs/dbraw/zinc/55/58/81/1359555881.db2.gz	MUDCOIBGRKEUKZ-DOTOQJQBSA-N	0	3	325.412	3.110	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)[C@@H]2Cc3cc(Cl)ccc3O2)[C@H]1CC	ZINC001087646693	1359570044	/nfs/dbraw/zinc/57/00/44/1359570044.db2.gz	NXRTUURRCDRSHS-JZXOWHBKSA-N	0	3	348.874	3.189	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)[C@@H]2CCc3ccc(F)cc3O2)[C@H]1CC	ZINC001087657956	1359575721	/nfs/dbraw/zinc/57/57/21/1359575721.db2.gz	FGZLFBLNYXLJIQ-KSZLIROESA-N	0	3	346.446	3.065	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)[C@H](C)c2ccc(Cl)cc2)[C@H]1CC	ZINC001087711467	1359603832	/nfs/dbraw/zinc/60/38/32/1359603832.db2.gz	FWTKYHOMTAIOJK-FHLIZLRMSA-N	0	3	332.875	3.436	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)[C@@H](C)c2ccc(Cl)cc2)[C@H]1CC	ZINC001087711468	1359604082	/nfs/dbraw/zinc/60/40/82/1359604082.db2.gz	FWTKYHOMTAIOJK-JCGIZDLHSA-N	0	3	332.875	3.436	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ncc(Cl)cc2Cl)[C@H]1CC	ZINC001087774028	1359637370	/nfs/dbraw/zinc/63/73/70/1359637370.db2.gz	UNPJUTACXPCRBI-QWHCGFSZSA-N	0	3	328.243	3.157	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnoc2-c2ccccc2)[C@H]1CC	ZINC001087780585	1359640018	/nfs/dbraw/zinc/64/00/18/1359640018.db2.gz	NQWUVHQAWMCGNN-DLBZAZTESA-N	0	3	325.412	3.110	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnn(C(CC)CC)c2C)[C@H]1CC	ZINC001087788743	1359645106	/nfs/dbraw/zinc/64/51/06/1359645106.db2.gz	FDPJUEGLPPKWAU-ZWKOTPCHSA-N	0	3	332.492	3.321	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc(N(CC)CC)cc2)[C@H]1CC	ZINC001087808365	1359657868	/nfs/dbraw/zinc/65/78/68/1359657868.db2.gz	MAJNIAJWAQDNDK-RBUKOAKNSA-N	0	3	329.488	3.302	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2cc3c(s2)CC[C@H](C)C3)[C@H]1CC	ZINC001087825301	1359666113	/nfs/dbraw/zinc/66/61/13/1359666113.db2.gz	ZSXQRPWZHMKWBP-BHYGNILZSA-N	0	3	344.524	3.479	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cc(C3CCCC3)no2)[C@H]1CC	ZINC001087834742	1359670322	/nfs/dbraw/zinc/67/03/22/1359670322.db2.gz	STDBZNAMKPEIEK-DOTOQJQBSA-N	0	3	331.460	3.491	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2ccc(C(F)(F)F)s2)[C@H]1CC	ZINC001087846210	1359679605	/nfs/dbraw/zinc/67/96/05/1359679605.db2.gz	OYSUEZOLZWSQBL-NWDGAFQWSA-N	0	3	344.402	3.373	20	30		EGEDHN
Cc1ccc(CN2CC[C@@H]3CN(C(=O)[C@H](C)C#N)C[C@@H]3C2)c(Cl)c1	ZINC001087911693	1359704958	/nfs/dbraw/zinc/70/49/58/1359704958.db2.gz	GDAVETMOXVCUTA-INMHGKMJSA-N	0	3	345.874	3.088	20	30		EGEDHN
C[C@@H](c1ccccc1F)N1CC[C@@H]2CN(C(=O)C#CC3CC3)C[C@@H]2C1	ZINC001087958688	1359719056	/nfs/dbraw/zinc/71/90/56/1359719056.db2.gz	ABFHTCPHCAJERC-JQHSSLGASA-N	0	3	340.442	3.080	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3ccc(C)cc3Cl)C[C@@H]2C1	ZINC001088115919	1359760024	/nfs/dbraw/zinc/76/00/24/1359760024.db2.gz	VKFWXXDQYZKFFN-CVEARBPZSA-N	0	3	330.859	3.066	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3ccc(C)c4ccccc34)C[C@@H]2C1	ZINC001088121393	1359762848	/nfs/dbraw/zinc/76/28/48/1359762848.db2.gz	DFSBHOAYFFXGNR-MSOLQXFVSA-N	0	3	332.447	3.175	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)C(C)(C)Cc3ccccc3)C[C@@H]2C1	ZINC001088163424	1359776613	/nfs/dbraw/zinc/77/66/13/1359776613.db2.gz	OLHLVONEPPZBKY-UXHICEINSA-N	0	3	338.495	3.059	20	30		EGEDHN
C=CCN1CC[C@@H](OCC2CCN(C(=O)CCC3CCCC3)CC2)C1	ZINC001088228745	1359807895	/nfs/dbraw/zinc/80/78/95/1359807895.db2.gz	ZHVSFGYESCVGCY-HXUWFJFHSA-N	0	3	348.531	3.472	20	30		EGEDHN
CC(C)(F)C(=O)N1CCCCC[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001088246739	1359816399	/nfs/dbraw/zinc/81/63/99/1359816399.db2.gz	AKZJMDKHGKVGHI-INIZCTEOSA-N	0	3	349.425	3.306	20	30		EGEDHN
C=C(Br)CN[C@H]1CCCCCN(C(=O)[C@H](F)CC)C1	ZINC001088360603	1359844461	/nfs/dbraw/zinc/84/44/61/1359844461.db2.gz	CGORYIAMVITDKU-QWHCGFSZSA-N	0	3	335.261	3.004	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCCN1C(=O)c1ccncc1	ZINC001089106163	1360170425	/nfs/dbraw/zinc/17/04/25/1360170425.db2.gz	UFMWZHRZQIPJJS-FQEVSTJZSA-N	0	3	348.450	3.080	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@H](CNC/C(Cl)=C\Cl)[C@H](C)C1	ZINC001184358422	1387440083	/nfs/dbraw/zinc/44/00/83/1387440083.db2.gz	WKEXIFFGZLYUFA-RNRBBCFGSA-N	0	3	331.287	3.039	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCCC[C@H]1CN(C)Cc1cccc(C#N)c1	ZINC001089151965	1360207738	/nfs/dbraw/zinc/20/77/38/1360207738.db2.gz	AXFLBBZBTLRCFE-OZLDOMPNSA-N	0	3	325.456	3.337	20	30		EGEDHN
Cc1csc(CNC[C@@H]2CCN(C(=O)C#CC(C)(C)C)C[C@@H]2C)n1	ZINC001184385698	1387445308	/nfs/dbraw/zinc/44/53/08/1387445308.db2.gz	DHOMKEYVSDXRMX-HOCLYGCPSA-N	0	3	347.528	3.075	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2nc(C)sc2C)CC(C)(C)C1	ZINC001089416430	1360411002	/nfs/dbraw/zinc/41/10/02/1360411002.db2.gz	LYJWIHFFVPZBSS-HNNXBMFYSA-N	0	3	333.501	3.004	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc3cc(C)ccc3n2)CC(C)(C)C1	ZINC001089436258	1360427428	/nfs/dbraw/zinc/42/74/28/1360427428.db2.gz	UGNHJMWWRRTIJU-SFHVURJKSA-N	0	3	349.478	3.397	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C(C)C)on2)CC(C)(C)C1	ZINC001089454464	1360441237	/nfs/dbraw/zinc/44/12/37/1360441237.db2.gz	XGOVWKAYFWENAG-HNNXBMFYSA-N	0	3	331.460	3.042	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(C(C)C)nc2C)CC(C)(C)C1	ZINC001089490978	1360469729	/nfs/dbraw/zinc/46/97/29/1360469729.db2.gz	HBCGOUYFLSSYQO-QGZVFWFLSA-N	0	3	341.499	3.367	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2scnc2C2CC2)CC(C)(C)C1	ZINC001089515385	1360485747	/nfs/dbraw/zinc/48/57/47/1360485747.db2.gz	WQVCAXPRDCPWES-HNNXBMFYSA-N	0	3	345.512	3.264	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccccc2OC(C)C)CC(C)(C)C1	ZINC001089540355	1360497837	/nfs/dbraw/zinc/49/78/37/1360497837.db2.gz	ULEPBRPFPSBWKL-KRWDZBQOSA-N	0	3	342.483	3.327	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cn(C(C)C)nc2C)CC(C)(C)C1	ZINC001089541043	1360498115	/nfs/dbraw/zinc/49/81/15/1360498115.db2.gz	GWYYBNBGGXJGCQ-KRWDZBQOSA-N	0	3	344.503	3.016	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(C[C@H](F)CC)CC(C)(C)C2)nc1	ZINC001089544001	1360499336	/nfs/dbraw/zinc/49/93/36/1360499336.db2.gz	LALOBDYBIIJSSG-IAGOWNOFSA-N	0	3	345.462	3.031	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccn(CC(C)C)n1	ZINC001089645991	1360557930	/nfs/dbraw/zinc/55/79/30/1360557930.db2.gz	GATFUNNAGDNRIR-QGZVFWFLSA-N	0	3	346.519	3.336	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(C(C)C)nc1	ZINC001089652031	1360565253	/nfs/dbraw/zinc/56/52/53/1360565253.db2.gz	UPLWXLJUJIQLIO-SFHVURJKSA-N	0	3	341.499	3.449	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccn2c1CCCC2	ZINC001089653755	1360566583	/nfs/dbraw/zinc/56/65/83/1360566583.db2.gz	SXDHRXDEHUWTCS-MRXNPFEDSA-N	0	3	329.488	3.231	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(C)c(OC)c1	ZINC001089668165	1360578021	/nfs/dbraw/zinc/57/80/21/1360578021.db2.gz	RKQBHAIDABHTGN-KRWDZBQOSA-N	0	3	330.472	3.410	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(F)ccc1OC	ZINC001089676299	1360584223	/nfs/dbraw/zinc/58/42/23/1360584223.db2.gz	DCOIZOVWPPDUTJ-INIZCTEOSA-N	0	3	346.446	3.078	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc2n[nH]cc2c1	ZINC001089688709	1360594711	/nfs/dbraw/zinc/59/47/11/1360594711.db2.gz	YIPKUGUBRBBHRW-QGZVFWFLSA-N	0	3	340.471	3.359	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cccn2ccnc12	ZINC001089709841	1360613866	/nfs/dbraw/zinc/61/38/66/1360613866.db2.gz	ZWXVPMGGWFIWCE-MRXNPFEDSA-N	0	3	340.471	3.131	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cnn2c1CCCC2	ZINC001089718813	1360620888	/nfs/dbraw/zinc/62/08/88/1360620888.db2.gz	URLBRLWIKPKGNY-INIZCTEOSA-N	0	3	344.503	3.016	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ncc2n1CCCC2	ZINC001089735489	1360640575	/nfs/dbraw/zinc/64/05/75/1360640575.db2.gz	MCCQNBRSOOPZIP-MRXNPFEDSA-N	0	3	344.503	3.016	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1ccccc1	ZINC001089759833	1360652750	/nfs/dbraw/zinc/65/27/50/1360652750.db2.gz	DVXBIUFJUGHOPZ-FJIDUMEYSA-N	0	3	330.859	3.222	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C(C)(C)C1CC1	ZINC001089849468	1360696332	/nfs/dbraw/zinc/69/63/32/1360696332.db2.gz	FJBQGDANJCVKTM-LLLHUVSDSA-N	0	3	336.907	3.344	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)Cc1occc1C	ZINC001089858459	1360703237	/nfs/dbraw/zinc/70/32/37/1360703237.db2.gz	AZVWJVBGTSRAMH-HZMVEIRTSA-N	0	3	348.874	3.052	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)[C@H]2CCC(C)=C(C)C2)CC2(CCOCC2)C1	ZINC001089939319	1360754077	/nfs/dbraw/zinc/75/40/77/1360754077.db2.gz	PXIQQXGGQXUPAZ-OALUTQOASA-N	0	3	346.515	3.296	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccsc2C)CC2(CCOCC2)C1	ZINC001089939565	1360754928	/nfs/dbraw/zinc/75/49/28/1360754928.db2.gz	PZTJFEDMTYERGB-MRXNPFEDSA-N	0	3	348.512	3.234	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)C2CCC(C)(C)CC2)CC2(CCOCC2)C1	ZINC001089969623	1360772712	/nfs/dbraw/zinc/77/27/12/1360772712.db2.gz	LNDMFMVOIYKFBP-GOSISDBHSA-N	0	3	348.531	3.376	20	30		EGEDHN
N#Cc1ccc(CNC2CC(CNC(=O)c3ccsc3)C2)c(F)c1	ZINC001090913672	1360951919	/nfs/dbraw/zinc/95/19/19/1360951919.db2.gz	GTBKTTLSPMGWAB-UHFFFAOYSA-N	0	3	343.427	3.057	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(-c3ccncc3)o2)C1	ZINC001091069212	1360988690	/nfs/dbraw/zinc/98/86/90/1360988690.db2.gz	RKGDGYGQHQOHJP-UHFFFAOYSA-N	0	3	345.830	3.192	20	30		EGEDHN
C=C1CCC(C(=O)NCC2CC(NCc3c(C)noc3CC)C2)CC1	ZINC001091215518	1361010017	/nfs/dbraw/zinc/01/00/17/1361010017.db2.gz	FYQFHVAMVTWLAP-UHFFFAOYSA-N	0	3	345.487	3.276	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(C)cc2Cl)C1	ZINC001091248001	1361020388	/nfs/dbraw/zinc/02/03/88/1361020388.db2.gz	DWFPQTXYTPMYQC-UHFFFAOYSA-N	0	3	327.255	3.499	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc(C4CCC4)cc3)C[C@]2(C)C1	ZINC001091721030	1361191691	/nfs/dbraw/zinc/19/16/91/1361191691.db2.gz	NGUJRMUTGMUHHG-IRLDBZIGSA-N	0	3	336.479	3.371	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CN(Cc4cnc(C)s4)C[C@@]3(C)C2)C1	ZINC001091996466	1361269670	/nfs/dbraw/zinc/26/96/70/1361269670.db2.gz	WWYHJHRBLUCULP-BEFAXECRSA-N	0	3	345.512	3.088	20	30		EGEDHN
C[C@@]12CN(Cc3ccc(C#N)cc3)C[C@@H]1CN(C(=O)[C@H]1CC13CCC3)C2	ZINC001092054714	1361284322	/nfs/dbraw/zinc/28/43/22/1361284322.db2.gz	ZTZNNMOBALZCCG-SBHAEUEKSA-N	0	3	349.478	3.029	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1C[C@H]2CN(Cc3ccc(C#N)cc3)C[C@@]2(C)C1	ZINC001092065885	1361287107	/nfs/dbraw/zinc/28/71/07/1361287107.db2.gz	UZPCPKGOEXXOMD-BSIFCXSSSA-N	0	3	339.483	3.131	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@H](C)c3cccc(Cl)c3)C[C@]2(C)C1	ZINC001092290330	1361355351	/nfs/dbraw/zinc/35/53/51/1361355351.db2.gz	NKZXQAVRWXNPCQ-MDYRTPRTSA-N	0	3	344.886	3.247	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc4cc(C)ccc4o3)C[C@]2(C)C1	ZINC001092299751	1361358450	/nfs/dbraw/zinc/35/84/50/1361358450.db2.gz	GQLKEGWQSDUIRA-UTKZUKDTSA-N	0	3	336.435	3.158	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2cccc(Cl)c2)C[C@H]1CNC(=O)C1CCC1	ZINC001092421558	1361376900	/nfs/dbraw/zinc/37/69/00/1361376900.db2.gz	NJCDKIRWGYOSJW-CRAIPNDOSA-N	0	3	344.886	3.176	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CNC(=O)[C@H]1CC=CCC1	ZINC001092459630	1361388328	/nfs/dbraw/zinc/38/83/28/1361388328.db2.gz	PIJNVVPNHNLCHA-OWCLPIDISA-N	0	3	343.496	3.160	20	30		EGEDHN
Cc1coc(C(=O)NC[C@@H]2CN(Cc3ccc(C#N)s3)C[C@H]2C)c1	ZINC001092901707	1361482220	/nfs/dbraw/zinc/48/22/20/1361482220.db2.gz	AOCPKHMOEUNGOH-ZIAGYGMSSA-N	0	3	343.452	3.019	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)c2ccc(C)s2)CC1	ZINC001093351608	1361564951	/nfs/dbraw/zinc/56/49/51/1361564951.db2.gz	CRJFVGMLNPBKJT-SFHVURJKSA-N	0	3	342.508	3.396	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)c2cccs2)CC1	ZINC001093352475	1361566693	/nfs/dbraw/zinc/56/66/93/1361566693.db2.gz	JKLBPMZDUPTRFP-QGZVFWFLSA-N	0	3	328.481	3.088	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)[C@]2(C)CC=CCC2)CC1	ZINC001093369692	1361578763	/nfs/dbraw/zinc/57/87/63/1361578763.db2.gz	JIURKHGGUIJOAT-TZIWHRDSSA-N	0	3	340.511	3.459	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C2(C3CC3)CCC2)CC1	ZINC001093375555	1361585851	/nfs/dbraw/zinc/58/58/51/1361585851.db2.gz	YWMBTBGWUXXKRM-IBGZPJMESA-N	0	3	340.511	3.293	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C2CCC(F)CC2)CC1	ZINC001093377522	1361588015	/nfs/dbraw/zinc/58/80/15/1361588015.db2.gz	UYFZSWTUWWMYPW-ACBHZAAOSA-N	0	3	346.490	3.241	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)[C@H](C)c2ccco2)CC1	ZINC001093378501	1361589182	/nfs/dbraw/zinc/58/91/82/1361589182.db2.gz	PWRFSTYRZJTIHI-VQIMIIECSA-N	0	3	340.467	3.109	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H](CNCc2csc(CC)n2)[C@H](C)C1	ZINC001094018343	1361725446	/nfs/dbraw/zinc/72/54/46/1361725446.db2.gz	NOYIOFQXIBVENM-CLCXKQKWSA-N	0	3	349.544	3.492	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3scc(C)c3Cl)CCC[C@@H]12	ZINC001094422677	1361795020	/nfs/dbraw/zinc/79/50/20/1361795020.db2.gz	BIAJZGUTRYVHAR-CXAGYDPISA-N	0	3	336.888	3.318	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](NCc2sc(C)nc2C)C1	ZINC001184890474	1387555047	/nfs/dbraw/zinc/55/50/47/1387555047.db2.gz	PZTGQHKZVXWTNI-MRXNPFEDSA-N	0	3	333.501	3.034	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H]1CCc3cc(OC)ccc31)C2	ZINC001095504346	1362158277	/nfs/dbraw/zinc/15/82/77/1362158277.db2.gz	RPKOWMOLIQBRQY-TTYHFUOFSA-N	0	3	340.467	3.023	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H]1CCc3c1cccc3Cl)C2	ZINC001095770415	1362224521	/nfs/dbraw/zinc/22/45/21/1362224521.db2.gz	OOQZGELZUAUBBQ-OLQIXAPSSA-N	0	3	342.870	3.115	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc(C)n(CC3CC3)c1C)C2	ZINC001096367271	1362474620	/nfs/dbraw/zinc/47/46/20/1362474620.db2.gz	VMFBIIAGVUJCKH-HOJAQTOUSA-N	0	3	341.499	3.426	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](C)c1cccc(Cl)c1)C2	ZINC001096577696	1362585742	/nfs/dbraw/zinc/58/57/42/1362585742.db2.gz	FSAYTKINORNDON-NBMRYCAZSA-N	0	3	330.859	3.188	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](C)c1cccc(Cl)c1)C2	ZINC001096577700	1362585804	/nfs/dbraw/zinc/58/58/04/1362585804.db2.gz	FSAYTKINORNDON-ZSGPHXLJSA-N	0	3	330.859	3.188	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](CNCc2cc(C3CC3)no2)[C@H](C)C1	ZINC001185062051	1387605273	/nfs/dbraw/zinc/60/52/73/1387605273.db2.gz	QHXNQGYUSDKMPH-NVXWUHKLSA-N	0	3	345.487	3.483	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc(F)cc1F)C2	ZINC001097573494	1363059222	/nfs/dbraw/zinc/05/92/22/1363059222.db2.gz	ZXVWPRCQTVTABU-OYMYKWPDSA-N	0	3	346.421	3.366	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1oc(C(C)C)nc1C)C2	ZINC001098003899	1363194061	/nfs/dbraw/zinc/19/40/61/1363194061.db2.gz	HKUJAYLMWPLTLD-OAGGEKHMSA-N	0	3	331.460	3.408	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C(C)(C)c1cccc(OC)c1)C2	ZINC001098155353	1363238024	/nfs/dbraw/zinc/23/80/24/1363238024.db2.gz	JBBWEFFXFWZSJV-QRQLOZEOSA-N	0	3	342.483	3.270	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](C)c1ccc(Cl)s1)C2	ZINC001098180770	1363246062	/nfs/dbraw/zinc/24/60/62/1363246062.db2.gz	NJPCAGYRJPSYOS-SYQHCUMBSA-N	0	3	336.888	3.250	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H]1CCCc3sc(C)nc31)C2	ZINC001098201836	1363254045	/nfs/dbraw/zinc/25/40/45/1363254045.db2.gz	HWEPVECRHYNFQA-QXSJWSMHSA-N	0	3	345.512	3.169	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](CNCc3nccs3)[C@@H](C)C2)CCC1	ZINC001185095816	1387617831	/nfs/dbraw/zinc/61/78/31/1387617831.db2.gz	TXKOVORUJASVHA-JKSUJKDBSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@@H]1OCCc3ccsc31)C2	ZINC001098246737	1363269187	/nfs/dbraw/zinc/26/91/87/1363269187.db2.gz	QRAULQXDYJFYAQ-NCOADZHNSA-N	0	3	346.496	3.050	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc(F)c(F)c(F)c1F)C2	ZINC001098263248	1363277654	/nfs/dbraw/zinc/27/76/54/1363277654.db2.gz	QMNKDTWKBOURBS-WQAKAFBOSA-N	0	3	342.336	3.154	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc(C3CCCC3)no1)C2	ZINC001098438200	1363325792	/nfs/dbraw/zinc/32/57/92/1363325792.db2.gz	FGXJGMAOYDKGDU-OIISXLGYSA-N	0	3	329.444	3.243	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1CC[C@@H]3C[C@@H]3CC1)C[C@H](C)O2	ZINC001098616369	1363400474	/nfs/dbraw/zinc/40/04/74/1363400474.db2.gz	JQLNRVTYZVOYGI-OKYOBFRVSA-N	0	3	346.515	3.081	20	30		EGEDHN
CCCCCCCNCc1cn([C@H]2CCN(C(=O)CCCC)C2)nn1	ZINC001098618965	1363401395	/nfs/dbraw/zinc/40/13/95/1363401395.db2.gz	PTJAYKOWXGOURT-SFHVURJKSA-N	0	3	349.523	3.302	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccc(F)c(C)c1)C[C@H](C)O2	ZINC001098627034	1363405619	/nfs/dbraw/zinc/40/56/19/1363405619.db2.gz	HRZXRHZHCOXAQM-INIZCTEOSA-N	0	3	346.446	3.016	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](NC(=O)C2CCC2)C2CCCC2)s1	ZINC001324450612	1387625377	/nfs/dbraw/zinc/62/53/77/1387625377.db2.gz	MJWMJBKSPAFMCQ-QGZVFWFLSA-N	0	3	331.485	3.184	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccc(CC)cc1)C[C@@H](C)O2	ZINC001098660527	1363423455	/nfs/dbraw/zinc/42/34/55/1363423455.db2.gz	UYOMXBYRRRNBRD-QGZVFWFLSA-N	0	3	342.483	3.131	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1cc(C)ccc1C)C[C@@H](C)O2	ZINC001098660315	1363423566	/nfs/dbraw/zinc/42/35/66/1363423566.db2.gz	RQDOQYWOIXJUCP-GOSISDBHSA-N	0	3	342.483	3.185	20	30		EGEDHN
C=CCCC(=O)NC[C@H]1CCC(C)(C)CN1CCc1ccns1	ZINC001098966543	1363544708	/nfs/dbraw/zinc/54/47/08/1363544708.db2.gz	QGDCVYJKXNHXFB-OAHLLOKOSA-N	0	3	335.517	3.259	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H]1CCC(C)(C)CN1CCOCC1CC1	ZINC001099029086	1363584166	/nfs/dbraw/zinc/58/41/66/1363584166.db2.gz	RISYRWIRXVVLFO-IBGZPJMESA-N	0	3	348.531	3.213	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)COc1cc(C)ccc1F	ZINC001099069335	1363605792	/nfs/dbraw/zinc/60/57/92/1363605792.db2.gz	GCUJXDOTZCQFAX-MRXNPFEDSA-N	0	3	348.462	3.306	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H](C)c2ccc(CC)cc2)C1	ZINC001099081395	1363612852	/nfs/dbraw/zinc/61/28/52/1363612852.db2.gz	RFQOKMILECZSJN-AGHHOFFYSA-N	0	3	338.495	3.347	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2csc(-c3ccoc3)n2)C1	ZINC001099081963	1363613585	/nfs/dbraw/zinc/61/35/85/1363613585.db2.gz	GMKAQDFRRPQPCY-KSSFIOAISA-N	0	3	343.452	3.173	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)C[C@@H]1Cc2ccccc2O1	ZINC001099085691	1363615103	/nfs/dbraw/zinc/61/51/03/1363615103.db2.gz	QSLJAFOEBZTBPA-ROUUACIJSA-N	0	3	342.483	3.173	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@H]1CCCC12CC2	ZINC001099121714	1363635899	/nfs/dbraw/zinc/63/58/99/1363635899.db2.gz	NMPRVQSARGDVFN-ZWKOTPCHSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)c1[nH]c(C)cc1C	ZINC001099122114	1363636815	/nfs/dbraw/zinc/63/68/15/1363636815.db2.gz	UZTAVAVBQIXWFG-KRWDZBQOSA-N	0	3	347.503	3.055	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)Cc1ccc(OC)c(F)c1	ZINC001099135191	1363646575	/nfs/dbraw/zinc/64/65/75/1363646575.db2.gz	JOENUIBFDXCJKS-INIZCTEOSA-N	0	3	348.462	3.170	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(OCC3CC3)cc2)C1	ZINC001099168863	1363667961	/nfs/dbraw/zinc/66/79/61/1363667961.db2.gz	KKULUDGIBMZOMC-RXVVDRJESA-N	0	3	340.467	3.246	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2csc(C3CC3)n2)C1	ZINC001099181656	1363676763	/nfs/dbraw/zinc/67/67/63/1363676763.db2.gz	NVHAHGCWCPVHLS-KSSFIOAISA-N	0	3	331.485	3.181	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)C1(c2cccnc2)CC1	ZINC001099188563	1363680820	/nfs/dbraw/zinc/68/08/20/1363680820.db2.gz	HEEUZGMVIUOLAS-SFHVURJKSA-N	0	3	341.499	3.296	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@@H]1CCC(C)(C)CN1CCn1cccn1	ZINC001099193452	1363684825	/nfs/dbraw/zinc/68/48/25/1363684825.db2.gz	BWCJGJKTESSWKE-ROUUACIJSA-N	0	3	346.519	3.092	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)C(C2CCC2)C2CCC2)C[C@H]1C(F)(F)F	ZINC001099297258	1363736877	/nfs/dbraw/zinc/73/68/77/1363736877.db2.gz	KSAGCNBQGXSIKM-HUUCEWRRSA-N	0	3	344.421	3.368	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)Cc2cc(C)cc(C)c2)C[C@H]1C(F)(F)F	ZINC001099301928	1363738632	/nfs/dbraw/zinc/73/86/32/1363738632.db2.gz	YLCVDBJEDMSALQ-HZPDHXFCSA-N	0	3	340.389	3.011	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)Cc1cccc(COC)c1	ZINC001099305199	1363740266	/nfs/dbraw/zinc/74/02/66/1363740266.db2.gz	WFINGGILQLYFEG-IBGZPJMESA-N	0	3	344.499	3.168	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)Cc1cccc(OC)c1	ZINC001099324491	1363750945	/nfs/dbraw/zinc/75/09/45/1363750945.db2.gz	MTXVGFYYYDDGTL-QGZVFWFLSA-N	0	3	330.472	3.031	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@H](C)c2ccc(C)cc2)C[C@H]1C(F)(F)F	ZINC001099333753	1363755364	/nfs/dbraw/zinc/75/53/64/1363755364.db2.gz	WSEDHLLFPISLPA-FVQBIDKESA-N	0	3	340.389	3.263	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)C[C@H](C)n1nc(C)cc1C	ZINC001099338906	1363758640	/nfs/dbraw/zinc/75/86/40/1363758640.db2.gz	BWXXBQRQIMQRPN-ROUUACIJSA-N	0	3	346.519	3.244	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H](C)COc1ccccc1	ZINC001099340578	1363760571	/nfs/dbraw/zinc/76/05/71/1363760571.db2.gz	VQZITCKVFARELN-ZWKOTPCHSA-N	0	3	344.499	3.494	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2sccc2CC)C[C@H]1C(F)(F)F	ZINC001099345609	1363763353	/nfs/dbraw/zinc/76/33/53/1363763353.db2.gz	KJGLYOKWOAYCKI-VXGBXAGGSA-N	0	3	332.391	3.089	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2ccc(F)s2)C[C@H]1C(F)(F)F	ZINC001099347354	1363763835	/nfs/dbraw/zinc/76/38/35/1363763835.db2.gz	FGUQMQAUZSAJNY-NXEZZACHSA-N	0	3	336.354	3.056	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2coc3ccccc23)C[C@H]1C(F)(F)F	ZINC001099349212	1363765483	/nfs/dbraw/zinc/76/54/83/1363765483.db2.gz	ULZPOMXPBUUCPF-ZIAGYGMSSA-N	0	3	338.329	3.211	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C=C(CC)CC)CC2(CCOCC2)C1	ZINC001099577219	1363860567	/nfs/dbraw/zinc/86/05/67/1363860567.db2.gz	UXUNCDJIMJATQM-GOSISDBHSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)[C@H](C)CCCC)CC2(CCOCC2)C1	ZINC001099579327	1363862117	/nfs/dbraw/zinc/86/21/17/1363862117.db2.gz	OZTRPCYXURWIBM-MSOLQXFVSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1CN(CC(=C)C)CC2(CCOCC2)C1	ZINC001099583527	1363865670	/nfs/dbraw/zinc/86/56/70/1363865670.db2.gz	UIPMMEPTSCCEAZ-IBGZPJMESA-N	0	3	346.515	3.318	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)CCC(C)C)C[C@H]1c1ccc(OC)cc1	ZINC001100151966	1364027742	/nfs/dbraw/zinc/02/77/42/1364027742.db2.gz	SQEXWDQSSITOIQ-VQTJNVASSA-N	0	3	342.483	3.039	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@@H](C)CCC)C[C@H]1c1ccc(OC)cc1	ZINC001100156247	1364029698	/nfs/dbraw/zinc/02/96/98/1364029698.db2.gz	WQNLZPXQWKRYSU-FFZOFVMBSA-N	0	3	342.483	3.039	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](CNCc2nccs2)[C@H](C)C1	ZINC001185226998	1387656710	/nfs/dbraw/zinc/65/67/10/1387656710.db2.gz	ULXVEQKCVLOOTJ-CABCVRRESA-N	0	3	335.517	3.320	20	30		EGEDHN
CCCC[C@H](C)C(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100296537	1364071247	/nfs/dbraw/zinc/07/12/47/1364071247.db2.gz	HLFFAISYJVOLGS-VQSBYGRUSA-N	0	3	344.474	3.488	20	30		EGEDHN
CC(C(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1)=C1CCC1	ZINC001100312223	1364077457	/nfs/dbraw/zinc/07/74/57/1364077457.db2.gz	FDGJOVOCUDDMPR-UHFFFAOYSA-N	0	3	341.430	3.182	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NCC1CC(NCc2conc2CC)C1	ZINC001100363032	1364092468	/nfs/dbraw/zinc/09/24/68/1364092468.db2.gz	MDIGBLRRNKOZTA-UHFFFAOYSA-N	0	3	339.867	3.000	20	30		EGEDHN
C[C@@H](C(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1)C1CCC1	ZINC001100437176	1364114385	/nfs/dbraw/zinc/11/43/85/1364114385.db2.gz	YOPXBLPDDXGAAV-MJJDPTRDSA-N	0	3	343.446	3.118	20	30		EGEDHN
CC1(C)CCC[C@H]1C(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100574714	1364169656	/nfs/dbraw/zinc/16/96/56/1364169656.db2.gz	BNUWQYIWOPEOMS-MHJFOBGBSA-N	0	3	338.495	3.349	20	30		EGEDHN
CC#CCCCC(=O)NCC1CC(NCc2cc(F)ccc2OC)C1	ZINC001100588854	1364176484	/nfs/dbraw/zinc/17/64/84/1364176484.db2.gz	HBGGFYWMCVKSQH-UHFFFAOYSA-N	0	3	346.446	3.012	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCC1CC(NCc2c(C)noc2CC)C1	ZINC001100594623	1364179769	/nfs/dbraw/zinc/17/97/69/1364179769.db2.gz	BWTNQCZBVUGVHC-JEYLPNPQSA-N	0	3	333.476	3.132	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C2(c3cccnc3)CCCC2)C1	ZINC001100615480	1364190028	/nfs/dbraw/zinc/19/00/28/1364190028.db2.gz	VWHNBUUNIBGBNW-UHFFFAOYSA-N	0	3	347.890	3.130	20	30		EGEDHN
CC#CCCCC(=O)N1C[C@H]2CN(Cc3ccsc3)C[C@@]2(C)C1	ZINC001101336793	1364515331	/nfs/dbraw/zinc/51/53/31/1364515331.db2.gz	PVXYNWSXGUJPCV-MJGOQNOKSA-N	0	3	330.497	3.222	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C[C@@H](CC)c3ccccc3)C[C@]2(C)C1	ZINC001101429049	1364560166	/nfs/dbraw/zinc/56/01/66/1364560166.db2.gz	YUSUMEDZHSIZGX-UZKOGDIHSA-N	0	3	338.495	3.374	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC(C(C)(C)CNC/C(Cl)=C\Cl)CC1	ZINC001101521935	1364597131	/nfs/dbraw/zinc/59/71/31/1364597131.db2.gz	HFGUZMNDBPJFAP-ZBQKXELDSA-N	0	3	346.302	3.319	20	30		EGEDHN
C#CCCCCC(=O)N1CCC(C(C)(C)CNCc2ccon2)CC1	ZINC001101533616	1364603704	/nfs/dbraw/zinc/60/37/04/1364603704.db2.gz	MMYDLMOBOCHAQA-UHFFFAOYSA-N	0	3	345.487	3.223	20	30		EGEDHN
C=CCCC(=O)NC[C@@H]1CN(CC#Cc2cccc(Cl)c2)C[C@H]1C	ZINC001101805151	1364732916	/nfs/dbraw/zinc/73/29/16/1364732916.db2.gz	JNZWECIPHRXINC-SJLPKXTDSA-N	0	3	344.886	3.342	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC[C@@H]1CN(Cc2cc(C)ns2)C[C@H]1C	ZINC001101998127	1364805240	/nfs/dbraw/zinc/80/52/40/1364805240.db2.gz	VKDXCBKMIVVMOT-RHSMWYFYSA-N	0	3	347.528	3.404	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C	ZINC001102219740	1364940732	/nfs/dbraw/zinc/94/07/32/1364940732.db2.gz	SRZXMLIXEXBYLV-UYAOXDASSA-N	0	3	338.495	3.325	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1C	ZINC001102296952	1364988535	/nfs/dbraw/zinc/98/85/35/1364988535.db2.gz	BUTKHMRFDXIGMI-CRAIPNDOSA-N	0	3	343.446	3.238	20	30		EGEDHN
CC(C)C[C@@H](C)C(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001102484932	1365082157	/nfs/dbraw/zinc/08/21/57/1365082157.db2.gz	CNHDZXFCRMAYIB-BZUAXINKSA-N	0	3	347.528	3.486	20	30		EGEDHN
CCCCCCCCC(=O)NC[C@@H]1CN(CC#CCOC)C[C@H]1C	ZINC001102527001	1365100305	/nfs/dbraw/zinc/10/03/05/1365100305.db2.gz	AHOLNIURKBUVEV-RTBURBONSA-N	0	3	336.520	3.071	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CCNC(=O)C1CCCC1	ZINC001102632577	1365144352	/nfs/dbraw/zinc/14/43/52/1365144352.db2.gz	CUEYCOXMBYDPQV-GDBMZVCRSA-N	0	3	345.512	3.384	20	30		EGEDHN
CCCC(=O)NCC[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1C	ZINC001102637149	1365146934	/nfs/dbraw/zinc/14/69/34/1365146934.db2.gz	PWAIMCJEOQFPFW-SJLPKXTDSA-N	0	3	330.447	3.052	20	30		EGEDHN
CCCC(=O)NCC[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1C	ZINC001102637010	1365147107	/nfs/dbraw/zinc/14/71/07/1365147107.db2.gz	ITMOFQDRFJSOLV-RHSMWYFYSA-N	0	3	331.435	3.072	20	30		EGEDHN
CCCCC(=O)NCC[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1C	ZINC001102670862	1365163643	/nfs/dbraw/zinc/16/36/43/1365163643.db2.gz	VWHIZNBFKPZDQV-IEBWSBKVSA-N	0	3	344.474	3.442	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)C[C@H](OCC)C(=C)C)C1	ZINC001103052549	1365356635	/nfs/dbraw/zinc/35/66/35/1365356635.db2.gz	DPAKPBDMZMEULH-OIISXLGYSA-N	0	3	342.911	3.184	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cnc3cc[nH]c3c2)C1	ZINC001103127931	1365396098	/nfs/dbraw/zinc/39/60/98/1365396098.db2.gz	HKTUZTDLXISVDV-TZMCWYRMSA-N	0	3	346.862	3.003	20	30		EGEDHN
CC[C@H](F)C(=O)NCC[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1C	ZINC001103320145	1365491535	/nfs/dbraw/zinc/49/15/35/1365491535.db2.gz	OISJHZRQFCFCGB-UNEWFSDZSA-N	0	3	349.425	3.020	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)NCC[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1C	ZINC001103335698	1365504121	/nfs/dbraw/zinc/50/41/21/1365504121.db2.gz	NCAAHDHDAZBBJK-SZVBFZGTSA-N	0	3	345.462	3.127	20	30		EGEDHN
C=CCC1(C(=O)NCC[C@@H]2CN(Cc3cc(C)no3)C[C@H]2C)CCC1	ZINC001103404510	1365540407	/nfs/dbraw/zinc/54/04/07/1365540407.db2.gz	LCGCFEOKWLAKEL-NVXWUHKLSA-N	0	3	345.487	3.304	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)NCC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001103489234	1365593244	/nfs/dbraw/zinc/59/32/44/1365593244.db2.gz	HHZWAXMVTIATEZ-BZUAXINKSA-N	0	3	347.528	3.486	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2ccc(Cl)o2)C[C@H]1C	ZINC001103885661	1365823659	/nfs/dbraw/zinc/82/36/59/1365823659.db2.gz	FOOACCYQTQXVGC-ZYHUDNBSSA-N	0	3	331.243	3.373	20	30		EGEDHN
C/C=C(\C)C(=O)N1C[C@@H](C)[C@H](CCNCc2ccc(C#N)cc2F)C1	ZINC001104053567	1365891581	/nfs/dbraw/zinc/89/15/81/1365891581.db2.gz	BYMYPYWXOPAKNR-UPJFGJQXSA-N	0	3	343.446	3.238	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](C)[C@H](CCN[C@@H](C)c2cnccn2)C1	ZINC001104239877	1365965895	/nfs/dbraw/zinc/96/58/95/1365965895.db2.gz	UYUGSXRAXPLYJG-IXDOHACOSA-N	0	3	344.503	3.214	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2ncccc2CC)C[C@H]1C	ZINC001104371110	1365991761	/nfs/dbraw/zinc/99/17/61/1365991761.db2.gz	OXJBFTJVMJZQTD-CZUORRHYSA-N	0	3	335.879	3.084	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCC(F)F)C[C@H]1CCNCc1ccccc1C#N	ZINC001104423257	1366019413	/nfs/dbraw/zinc/01/94/13/1366019413.db2.gz	AJAVBGVHCQHTCT-RHSMWYFYSA-N	0	3	349.425	3.178	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CN(C(=O)CC2(C)CC2)C[C@H]1C	ZINC001104429980	1366025291	/nfs/dbraw/zinc/02/52/91/1366025291.db2.gz	KNERJSQHZHATSS-TZMCWYRMSA-N	0	3	343.309	3.159	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@H](CCNCc2ocnc2C)C1	ZINC001104485855	1366044841	/nfs/dbraw/zinc/04/48/41/1366044841.db2.gz	QZIGCTKQNIQHAK-GDBMZVCRSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)[C@H](CCNCc2oc(CC)nc2C)C1	ZINC001104492133	1366046512	/nfs/dbraw/zinc/04/65/12/1366046512.db2.gz	QAHMHVPDLJSHQU-GDBMZVCRSA-N	0	3	347.503	3.332	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H](C)[C@H](CCNCc2cnoc2C)C1	ZINC001104562794	1366077610	/nfs/dbraw/zinc/07/76/10/1366077610.db2.gz	GAAUQLGJZYNTMB-BFYDXBDKSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](C)[C@H](CCNCc2conc2CC)C1	ZINC001104563761	1366078577	/nfs/dbraw/zinc/07/85/77/1366078577.db2.gz	UAEVJIBFYBBOKC-GVDBMIGSSA-N	0	3	347.503	3.414	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@@H](C)[C@H](CCNCc2ocnc2C)C1	ZINC001104564020	1366078754	/nfs/dbraw/zinc/07/87/54/1366078754.db2.gz	AUVYEQDKGUKABC-DJIMGWMZSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)CCc2ccc(C)o2)C[C@H]1C	ZINC001105058927	1366299294	/nfs/dbraw/zinc/29/92/94/1366299294.db2.gz	FMBJEJSRICHUOJ-CZUORRHYSA-N	0	3	338.879	3.347	20	30		EGEDHN
CCCCCCCCC(=O)N1CC(n2cc(CNCCCC)nn2)C1	ZINC001105366234	1366428791	/nfs/dbraw/zinc/42/87/91/1366428791.db2.gz	CUTOZCKPMNXZJS-UHFFFAOYSA-N	0	3	349.523	3.302	20	30		EGEDHN
CCCCCCCNCc1cn([C@H]2CCCN(C(=O)C(C)C)C2)nn1	ZINC001185872683	1387822223	/nfs/dbraw/zinc/82/22/23/1387822223.db2.gz	KTCKFSFQXOCNCF-SFHVURJKSA-N	0	3	349.523	3.158	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](CNCc2cc(C3CC3)no2)[C@H](C)C1	ZINC001106194255	1366621313	/nfs/dbraw/zinc/62/13/13/1366621313.db2.gz	FGEZYGSECAVBCB-GDBMZVCRSA-N	0	3	331.460	3.092	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@@H](CNCc2nc(C)cs2)[C@H](C)C1	ZINC001106567394	1366739484	/nfs/dbraw/zinc/73/94/84/1366739484.db2.gz	GCZLTYUIPSICMV-FVQBIDKESA-N	0	3	335.517	3.238	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](CNCc3nc(C)cs3)[C@H](C)C2)CCC1	ZINC001106635845	1366761928	/nfs/dbraw/zinc/76/19/28/1366761928.db2.gz	HHVBMXHEDJKTPW-GDBMZVCRSA-N	0	3	347.528	3.382	20	30		EGEDHN
C/C=C(\C)C(=O)NC[C@]12CCC[C@H]1N(Cc1ccc(C#N)s1)CC2	ZINC001107355599	1366940154	/nfs/dbraw/zinc/94/01/54/1366940154.db2.gz	JJFLSMGDXSYKKT-HVAXQBDLSA-N	0	3	343.496	3.447	20	30		EGEDHN
C#CCCCC(=O)NC[C@]12CCC[C@H]1N(Cc1cc(C)ns1)CC2	ZINC001107383754	1366948332	/nfs/dbraw/zinc/94/83/32/1366948332.db2.gz	FOGLKPLHTKBEPW-IEBWSBKVSA-N	0	3	345.512	3.116	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@]12CCC[C@H]1N(Cc1ccccc1F)CC2	ZINC001107393671	1366950693	/nfs/dbraw/zinc/95/06/93/1366950693.db2.gz	NJAWAJIDFVTPSO-TZIWHRDSSA-N	0	3	342.458	3.346	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@]12CCC[C@H]1N(Cc1ocnc1C)CC2	ZINC001107420946	1366959143	/nfs/dbraw/zinc/95/91/43/1366959143.db2.gz	QQBNGHVQXDBJCY-YLJYHZDGSA-N	0	3	345.487	3.446	20	30		EGEDHN
COCC#CCN1CC[C@@]2(CNC(=O)C(C)(C)C(C)(C)C)CCC[C@@H]12	ZINC001107499193	1366997352	/nfs/dbraw/zinc/99/73/52/1366997352.db2.gz	DHENXNUSRAUREG-DYESRHJHSA-N	0	3	348.531	3.069	20	30		EGEDHN
O=C(CCCF)NC[C@]12CCC[C@H]1N(CC#Cc1ccccc1)CC2	ZINC001107508076	1367007722	/nfs/dbraw/zinc/00/77/22/1367007722.db2.gz	USRFVOJKSRCXND-TZIWHRDSSA-N	0	3	342.458	3.149	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCN(C(=O)/C=C/C(C)(C)C)C1	ZINC001189427182	1367019240	/nfs/dbraw/zinc/01/92/40/1367019240.db2.gz	FIKYNYYDRMBLAX-LNENJAERSA-N	0	3	325.456	3.193	20	30		EGEDHN
C=CCOCCCC(=O)N1CC[C@H](N(C)[C@@H](C)c2cccc(F)c2)C1	ZINC001189539257	1367048793	/nfs/dbraw/zinc/04/87/93/1367048793.db2.gz	YSRCLCPZVJTKPY-LPHOPBHVSA-N	0	3	348.462	3.402	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccccc1N(C)C	ZINC001109351226	1367082013	/nfs/dbraw/zinc/08/20/13/1367082013.db2.gz	UTUKTCPNOYTKFO-HBFSDRIKSA-N	0	3	341.499	3.330	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](N(C)C[C@H](OC)c2ccccc2)C1	ZINC001189743712	1367100448	/nfs/dbraw/zinc/10/04/48/1367100448.db2.gz	IADVKZQJXCRQFP-PMACEKPBSA-N	0	3	342.483	3.100	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2cc(C)oc2C)C1	ZINC001107731890	1367120353	/nfs/dbraw/zinc/12/03/53/1367120353.db2.gz	UKRSEAGMXVHABS-AUUYWEPGSA-N	0	3	334.460	3.072	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2cc(C)oc2C)C1	ZINC001107731891	1367120594	/nfs/dbraw/zinc/12/05/94/1367120594.db2.gz	UKRSEAGMXVHABS-IFXJQAMLSA-N	0	3	334.460	3.072	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](N(C)CCOc2cc(C)cc(C)c2)C1	ZINC001189925583	1367132394	/nfs/dbraw/zinc/13/23/94/1367132394.db2.gz	CHUVPVAVHBLFIU-IBGZPJMESA-N	0	3	342.483	3.018	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@@H](N(C)[C@H]2CCc3c2cc(F)cc3F)C1	ZINC001190045677	1367159795	/nfs/dbraw/zinc/15/97/95/1367159795.db2.gz	AQWJYUZQBIMQNV-BEFAXECRSA-N	0	3	346.421	3.144	20	30		EGEDHN
C[C@@H](c1ccc(F)cc1)N(C)[C@@H]1CCN(C(=O)C#CC(C)(C)C)C1	ZINC001190085279	1367170247	/nfs/dbraw/zinc/17/02/47/1367170247.db2.gz	WJLHTHLLRLPRBT-MAUKXSAKSA-N	0	3	330.447	3.469	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NC[C@]1(C)CN(C[C@H](C)CC)CCO1	ZINC001107971456	1367224817	/nfs/dbraw/zinc/22/48/17/1367224817.db2.gz	SPIHSDVXIGLWIQ-CXAGYDPISA-N	0	3	330.900	3.018	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](N(C)CCOCCC(C)C)C1	ZINC001190327923	1367227644	/nfs/dbraw/zinc/22/76/44/1367227644.db2.gz	GIKNDLBYOIGWSU-IBGZPJMESA-N	0	3	336.520	3.350	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](N(C)CCOc2ccccc2F)C1	ZINC001190391507	1367250565	/nfs/dbraw/zinc/25/05/65/1367250565.db2.gz	ZJEKBKBDQGWFEH-INIZCTEOSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCCOCc1ccccc1)C2	ZINC001109654973	1367265705	/nfs/dbraw/zinc/26/57/05/1367265705.db2.gz	CXIZVQAZTUURRF-AABGKKOBSA-N	0	3	342.483	3.281	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)C[C@H]3CCCCC3(C)C)[C@@H]2C1	ZINC001190535475	1367287722	/nfs/dbraw/zinc/28/77/22/1367287722.db2.gz	PGCILCLKEJLQRB-IPMKNSEASA-N	0	3	348.531	3.328	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@H](N(C)Cc3ccc(F)cc3)C2)CCC1	ZINC001190595354	1367302221	/nfs/dbraw/zinc/30/22/21/1367302221.db2.gz	PSLBATONFGPGAJ-SFHVURJKSA-N	0	3	328.431	3.052	20	30		EGEDHN
C=CCCC1(C(=O)NC[C@@]2(C)CN(CC3CCCC3)CCO2)CC1	ZINC001108186632	1367329973	/nfs/dbraw/zinc/32/99/73/1367329973.db2.gz	RRIAQPJBEOIJND-IBGZPJMESA-N	0	3	334.504	3.130	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2ccoc2CCC)C1	ZINC001108340403	1367397892	/nfs/dbraw/zinc/39/78/92/1367397892.db2.gz	AULBQACEMUXAEX-UZLBHIALSA-N	0	3	348.487	3.408	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2cc(C)cc(C)c2)C1	ZINC001108365458	1367414310	/nfs/dbraw/zinc/41/43/10/1367414310.db2.gz	KCTQDBGHVSQXIJ-NQIIRXRSSA-N	0	3	344.499	3.479	20	30		EGEDHN
C=C[C@@H](CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCCF)c1ccccc1	ZINC001110133993	1367517143	/nfs/dbraw/zinc/51/71/43/1367517143.db2.gz	KHJVWVMPGRBBMB-NQYYFHDYSA-N	0	3	330.447	3.427	20	30		EGEDHN
Cc1cccc([C@H](C)N2[C@@H]3CC[C@H]2[C@H](NC(=O)CSCC#N)C3)c1	ZINC001110302340	1367624533	/nfs/dbraw/zinc/62/45/33/1367624533.db2.gz	YPUYZJUXGDVGDL-HPBDAGMYSA-N	0	3	343.496	3.034	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](N(C)CCOc2cccc(F)c2)C1	ZINC001191911544	1367634694	/nfs/dbraw/zinc/63/46/94/1367634694.db2.gz	HFTWJFSAWLKPFD-WMZOPIPTSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@@H](N(C)Cc2ccccc2N(C)C)C1	ZINC001191913311	1367637428	/nfs/dbraw/zinc/63/74/28/1367637428.db2.gz	WPNBGLCFQGBIMF-PKOBYXMFSA-N	0	3	343.515	3.388	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1cccc(C)c1	ZINC001110366519	1367669238	/nfs/dbraw/zinc/66/92/38/1367669238.db2.gz	ULZLRNJREPWTTG-AFYVEPGGSA-N	0	3	342.483	3.198	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CC1=CCCCC1	ZINC001110366636	1367670995	/nfs/dbraw/zinc/67/09/95/1367670995.db2.gz	YIYFWVRONLEXRX-OWYHZJEWSA-N	0	3	332.488	3.190	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCCc1ccc(Cl)cc1	ZINC001109088077	1367761155	/nfs/dbraw/zinc/76/11/55/1367761155.db2.gz	HTHLTRHYMKGHLG-ZSGPHXLJSA-N	0	3	345.874	3.154	20	30		EGEDHN
C[C@@H](C#N)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCc1ccc2ccccc2c1	ZINC001109089151	1367761204	/nfs/dbraw/zinc/76/12/04/1367761204.db2.gz	YGIPADHRGBDDRS-ZFCZOSEKSA-N	0	3	347.462	3.263	20	30		EGEDHN
O=C(C#CC1CC1)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccccc1C1CC1	ZINC001110540253	1367819492	/nfs/dbraw/zinc/81/94/92/1367819492.db2.gz	KPKDEERJTLXMBC-NRSPTQNISA-N	0	3	334.463	3.199	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)COc1cccc(C(C)C)c1)C2	ZINC001110589849	1367851545	/nfs/dbraw/zinc/85/15/45/1367851545.db2.gz	IXGFDEUUEAJMBV-RLLQIKCJSA-N	0	3	342.483	3.486	20	30		EGEDHN
CC[C@@H](C)CCC(=O)N1CC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001193017701	1367923734	/nfs/dbraw/zinc/92/37/34/1367923734.db2.gz	PAEZRSXMISRKLJ-VQIMIIECSA-N	0	3	327.472	3.417	20	30		EGEDHN
C=CCC[C@H](C)N1[C@@H]2CC[C@H]1[C@H](NC(=O)c1snnc1C1CC1)C2	ZINC001110688552	1367928326	/nfs/dbraw/zinc/92/83/26/1367928326.db2.gz	PMBJJYBPRJYFJS-MYPMTAMASA-N	0	3	346.500	3.105	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc(COC)cs1)C2	ZINC001110770977	1367971127	/nfs/dbraw/zinc/97/11/27/1367971127.db2.gz	DLDXHCRUAVRDLJ-OAGGEKHMSA-N	0	3	334.485	3.196	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ncc(Cl)s1)C2	ZINC001110803407	1368000885	/nfs/dbraw/zinc/00/08/85/1368000885.db2.gz	UGBCPJQPTZXBSU-UTUOFQBUSA-N	0	3	325.865	3.098	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2cccc(C3CCC3)c2)C1	ZINC001193461722	1368035045	/nfs/dbraw/zinc/03/50/45/1368035045.db2.gz	JGGTXLBXEMMJSC-FQEVSTJZSA-N	0	3	342.483	3.303	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CC1CC(F)(F)C1	ZINC001110933751	1368103987	/nfs/dbraw/zinc/10/39/87/1368103987.db2.gz	PYAIREAYRRMXEL-MIGQKNRLSA-N	0	3	326.431	3.356	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C(C1CCC1)C1CCC1)C2	ZINC001110948795	1368116469	/nfs/dbraw/zinc/11/64/69/1368116469.db2.gz	MIOFYNUZVLXQJI-QRVBRYPASA-N	0	3	346.515	3.127	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)CCCC2CCCCC2)C1	ZINC001193874655	1368136540	/nfs/dbraw/zinc/13/65/40/1368136540.db2.gz	YMCCXPKMDYWFHJ-IBGZPJMESA-N	0	3	336.520	3.472	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2C[C@H]1CC(C)(C)CO1	ZINC001111072596	1368152042	/nfs/dbraw/zinc/15/20/42/1368152042.db2.gz	OAAUCWLNVJWOGV-VQHPVUNQSA-N	0	3	334.504	3.125	20	30		EGEDHN
C=C[C@H](C(=O)N1CC[C@H](N(C)CCOCCCC)C1)c1ccccc1	ZINC001194182615	1368200888	/nfs/dbraw/zinc/20/08/88/1368200888.db2.gz	BWBUTYCVTRRCFP-PMACEKPBSA-N	0	3	344.499	3.306	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N1CC[C@H](N(C)Cc2cc3ccccc3o2)C1	ZINC001194397204	1368252276	/nfs/dbraw/zinc/25/22/76/1368252276.db2.gz	QONNYDUYXCJGBX-WBVHZDCISA-N	0	3	342.439	3.057	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCCOc1ccccc1)C2	ZINC001111355899	1368271014	/nfs/dbraw/zinc/27/10/14/1368271014.db2.gz	CZWQLTCXOURKRI-QRQLOZEOSA-N	0	3	328.456	3.143	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)C(C)(C)c2ccccc2C)C1	ZINC001194502347	1368275127	/nfs/dbraw/zinc/27/51/27/1368275127.db2.gz	MANZQIFUAKVLCT-SFHVURJKSA-N	0	3	344.499	3.008	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCOc1ccccc1C)C2	ZINC001111401906	1368297064	/nfs/dbraw/zinc/29/70/64/1368297064.db2.gz	VVBWVRZOLKUHAV-KURKYZTESA-N	0	3	328.456	3.062	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@@H](C)c1ccc(OC)cc1)C2	ZINC001111439407	1368307636	/nfs/dbraw/zinc/30/76/36/1368307636.db2.gz	YLRZAORMMPSLGC-QOJCHSLYSA-N	0	3	342.483	3.486	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCCCc1ccc(C)cc1)C2	ZINC001111484793	1368318482	/nfs/dbraw/zinc/31/84/82/1368318482.db2.gz	CGHJWDHEUGJUQR-NJYVYQBISA-N	0	3	338.495	3.453	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CCCN(CCCC2CCCC2)CC1	ZINC001195174849	1368393160	/nfs/dbraw/zinc/39/31/60/1368393160.db2.gz	VBGFKQPEAYPHGE-GOSISDBHSA-N	0	3	336.520	3.472	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H](CC)OC2CCCCC2)C1	ZINC001111746353	1368440928	/nfs/dbraw/zinc/44/09/28/1368440928.db2.gz	RLBIPUNDZARSLN-HQRMLTQVSA-N	0	3	334.504	3.271	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CN(CCC2CCCCCC2)C[C@H]1O	ZINC001195548773	1368452565	/nfs/dbraw/zinc/45/25/65/1368452565.db2.gz	HRXRTMLSRGNALW-QXAKKESOSA-N	0	3	336.520	3.111	20	30		EGEDHN
O=C(N[C@H]1CCCc2ccccc21)N1CCC2SC(=O)C=C2C1	ZINC001186430298	1387940933	/nfs/dbraw/zinc/94/09/33/1387940933.db2.gz	BQXTZUWJJFFHEJ-HOTGVXAUSA-N	0	3	328.437	3.048	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)CCc2cccc(Cl)c2)C1	ZINC001111824906	1368484217	/nfs/dbraw/zinc/48/42/17/1368484217.db2.gz	CCIKGBDGBRRBII-PXNSSMCTSA-N	0	3	344.886	3.267	20	30		EGEDHN
C=CCCOCCCCC(=O)N1CCCN(CC[C@H](C)F)CC1	ZINC001195839026	1368500514	/nfs/dbraw/zinc/50/05/14/1368500514.db2.gz	KBGUPHVWVPKDEZ-KRWDZBQOSA-N	0	3	328.472	3.032	20	30		EGEDHN
CC1(CN2CCN(c3cc(-c4ccc(C#N)cc4)[nH]n3)CC2)CCC1	ZINC001195891593	1368512054	/nfs/dbraw/zinc/51/20/54/1368512054.db2.gz	APZFNPZJOMQVBW-UHFFFAOYSA-N	0	3	335.455	3.261	20	30		EGEDHN
C=C(C)CN1CCCN(C(=O)CCOc2ccc(C)c(C)c2)CC1	ZINC001196073358	1368544006	/nfs/dbraw/zinc/54/40/06/1368544006.db2.gz	SDZRISJBBJQIGG-UHFFFAOYSA-N	0	3	330.472	3.183	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2c(C)noc2C(F)F)CC1	ZINC001196259649	1368578035	/nfs/dbraw/zinc/57/80/35/1368578035.db2.gz	MTVPYIHCDDGIFX-UHFFFAOYSA-N	0	3	327.375	3.035	20	30		EGEDHN
C=CCC[C@@H](C)N1CCCN(C(=O)c2c(C)noc2C(F)F)CC1	ZINC001196258557	1368578060	/nfs/dbraw/zinc/57/80/60/1368578060.db2.gz	AZRWTBOBOHKHDQ-GFCCVEGCSA-N	0	3	341.402	3.423	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2cc(C)n([C@H](C)C3CC3)n2)CC1	ZINC001196383102	1368603163	/nfs/dbraw/zinc/60/31/63/1368603163.db2.gz	ZBYHSGKRAXRZTC-QGZVFWFLSA-N	0	3	344.503	3.277	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@H](C)c2cccc(C)c2)C1	ZINC001196460429	1368620030	/nfs/dbraw/zinc/62/00/30/1368620030.db2.gz	IUBDNGUQMKSRDF-MISYRCLQSA-N	0	3	344.499	3.006	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)C/C=C/c2ccc(C)cc2)C1	ZINC001112030652	1368627109	/nfs/dbraw/zinc/62/71/09/1368627109.db2.gz	ZUAHFBBLFDGVHS-HKRUVYOCSA-N	0	3	336.479	3.392	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cc(CCC)n[nH]2)CC1	ZINC001196706161	1368666944	/nfs/dbraw/zinc/66/69/44/1368666944.db2.gz	VBLYPOPOOHVSKJ-UHFFFAOYSA-N	0	3	334.508	3.481	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)CCCc2ccccc2)C[C@H]1C(F)(F)F	ZINC001112159202	1368689903	/nfs/dbraw/zinc/68/99/03/1368689903.db2.gz	WIZHMMVFDIEXIL-HZPDHXFCSA-N	0	3	340.389	3.174	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)c1c[nH]c(-c2ccc(F)cc2)c1	ZINC001196974884	1368723711	/nfs/dbraw/zinc/72/37/11/1368723711.db2.gz	ATLHAWIJBORSTK-KRWDZBQOSA-N	0	3	327.403	3.201	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2cccnc2C(F)(F)F)CC1	ZINC001197262284	1368774362	/nfs/dbraw/zinc/77/43/62/1368774362.db2.gz	KYDSZQHHMFBXRC-UHFFFAOYSA-N	0	3	341.377	3.215	20	30		EGEDHN
N#Cc1cccc(NC(=S)N2CCN(CC3CCCCC3)CC2)c1	ZINC001197674911	1368870795	/nfs/dbraw/zinc/87/07/95/1368870795.db2.gz	FVBUTECSIUUJCM-UHFFFAOYSA-N	0	3	342.512	3.453	20	30		EGEDHN
C=C[C@@H](CC(=O)N1CCCN(CCC[C@H](C)O)CC1)c1ccccc1	ZINC001198214638	1368982213	/nfs/dbraw/zinc/98/22/13/1368982213.db2.gz	UNIQGBUAQYEHPG-OALUTQOASA-N	0	3	344.499	3.042	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N1CCCN(Cc2ccccc2C2CC2)CC1	ZINC001198344682	1369013191	/nfs/dbraw/zinc/01/31/91/1369013191.db2.gz	WBCUIIRQEKROCI-KRWDZBQOSA-N	0	3	342.483	3.189	20	30		EGEDHN
C=CCC[C@@H](C)N[C@@H](CNC(=O)c1ccc[nH]1)c1ccccc1OC	ZINC001198523396	1369052056	/nfs/dbraw/zinc/05/20/56/1369052056.db2.gz	XMJMPKWUXVHYMC-QAPCUYQASA-N	0	3	341.455	3.439	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)c1cc(Cl)c[nH]1)c1ccccc1OC	ZINC001198529732	1369054515	/nfs/dbraw/zinc/05/45/15/1369054515.db2.gz	JMTTXHWNPRWVCH-INIZCTEOSA-N	0	3	347.846	3.314	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)CCCOCC)c1ccccc1OC	ZINC001198567237	1369062049	/nfs/dbraw/zinc/06/20/49/1369062049.db2.gz	NVXKQFKEJNDMBQ-GOSISDBHSA-N	0	3	348.487	3.225	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)c1ncoc1C)c1ccccc1OC	ZINC001198584239	1369066057	/nfs/dbraw/zinc/06/60/57/1369066057.db2.gz	DJNSKJPUPZGKQL-INIZCTEOSA-N	0	3	343.427	3.019	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC[C@@H](NCCCC)c1ccccc1OC	ZINC001198594947	1369069058	/nfs/dbraw/zinc/06/90/58/1369069058.db2.gz	FPGBLKHHBCRADA-SJLPKXTDSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)C1=COCCC1)c1ccccc1OC	ZINC001198604949	1369071402	/nfs/dbraw/zinc/07/14/02/1369071402.db2.gz	CLGKMRBGNYHIBV-SFHVURJKSA-N	0	3	344.455	3.103	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)CO[C@H](C)CC)c1ccccc1OC	ZINC001198668734	1369087221	/nfs/dbraw/zinc/08/72/21/1369087221.db2.gz	VBSYKKNGWOQJAB-AEFFLSMTSA-N	0	3	348.487	3.223	20	30		EGEDHN
COc1ccccc1[C@@H](CNC(=O)C#CC1CC1)NCCCC(C)C	ZINC001198723022	1369099274	/nfs/dbraw/zinc/09/92/74/1369099274.db2.gz	AGCBXLJIISQHIJ-LJQANCHMSA-N	0	3	342.483	3.292	20	30		EGEDHN
C=CCC[C@H](C)N[C@@H](CNC(=O)C#CC1CC1)c1ccccc1OC	ZINC001198723844	1369099628	/nfs/dbraw/zinc/09/96/28/1369099628.db2.gz	LJBZOOOXUJLZPY-LPHOPBHVSA-N	0	3	340.467	3.210	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H](NCC2CC2)c2ccccc2OC)cc1	ZINC001198825650	1369122510	/nfs/dbraw/zinc/12/25/10/1369122510.db2.gz	DTDHUIXRJRHAAL-HXUWFJFHSA-N	0	3	348.446	3.147	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@H](NCCCF)c1ccccc1OC	ZINC001198857541	1369131518	/nfs/dbraw/zinc/13/15/18/1369131518.db2.gz	QSWORGVVZKLVRE-RDJZCZTQSA-N	0	3	336.451	3.404	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)c1occc1CC)c1ccccc1OC	ZINC001198885274	1369139129	/nfs/dbraw/zinc/13/91/29/1369139129.db2.gz	CMDMXWDBNRUXHI-KRWDZBQOSA-N	0	3	342.439	3.487	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)c1ccc(Cl)[nH]1)c1ccccc1OC	ZINC001198894123	1369141848	/nfs/dbraw/zinc/14/18/48/1369141848.db2.gz	DEUUWOCURYXDPW-OAHLLOKOSA-N	0	3	347.846	3.314	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@@H](C)c1ccco1)c1ccccc1OC	ZINC001198894992	1369142122	/nfs/dbraw/zinc/14/21/22/1369142122.db2.gz	NLPHWVISVKBEOJ-DOTOQJQBSA-N	0	3	342.439	3.415	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@@H]1C[C@H]1CCC)c1ccccc1OC	ZINC001198895650	1369143106	/nfs/dbraw/zinc/14/31/06/1369143106.db2.gz	VFEYQLQTNVZIIF-NXHRZFHOSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)c1oncc1C)c1ccccc1OC	ZINC001198953064	1369157146	/nfs/dbraw/zinc/15/71/46/1369157146.db2.gz	HTENEMVPWVCPBZ-MRXNPFEDSA-N	0	3	343.427	3.019	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)COCCC=C)c1ccccc1OC	ZINC001199002012	1369170373	/nfs/dbraw/zinc/17/03/73/1369170373.db2.gz	NYTQXAOEPYYRML-SFHVURJKSA-N	0	3	346.471	3.001	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)CCCOC(C)C)c1ccccc1OC	ZINC001199016247	1369171443	/nfs/dbraw/zinc/17/14/43/1369171443.db2.gz	HFIJIXYGQPOQJN-SFHVURJKSA-N	0	3	348.487	3.223	20	30		EGEDHN
CCC[C@@H](CC)C(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001186630448	1387990421	/nfs/dbraw/zinc/99/04/21/1387990421.db2.gz	JJYUJRPMAQIFFZ-NVXWUHKLSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=CCCC(=O)N1CCC(NCc2nc(C(C)(C)C)cs2)CC1	ZINC001199707341	1369258414	/nfs/dbraw/zinc/25/84/14/1369258414.db2.gz	VPVXPENYNAQNIP-UHFFFAOYSA-N	0	3	335.517	3.487	20	30		EGEDHN
C=CCCC(=O)N1CCCO[C@@H](CN[C@@H](C)c2ccccc2F)C1	ZINC001200101272	1369315474	/nfs/dbraw/zinc/31/54/74/1369315474.db2.gz	TWLOKRJURXDVGE-HOTGVXAUSA-N	0	3	334.435	3.060	20	30		EGEDHN
C=CCCCC(=O)N1CCN(C[C@@H]2CCc3ccccc3C2)CC1	ZINC001113282373	1369316064	/nfs/dbraw/zinc/31/60/64/1369316064.db2.gz	YWMVQLKBEPMOSP-GOSISDBHSA-N	0	3	326.484	3.292	20	30		EGEDHN
CCCCCCCCCCNC(=S)N1CCOC[C@@H]1CN(C)C	ZINC001200213109	1369330236	/nfs/dbraw/zinc/33/02/36/1369330236.db2.gz	UDQCMWUROJTSRF-KRWDZBQOSA-N	0	3	343.581	3.264	20	30		EGEDHN
C=CCNC(=S)N1CCC2(CC[C@H]2N(C)Cc2ccco2)CC1	ZINC001200286167	1369341951	/nfs/dbraw/zinc/34/19/51/1369341951.db2.gz	JLIATJANMFASCY-MRXNPFEDSA-N	0	3	333.501	3.017	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)Cn2cc(C)c3ccccc32)CC1	ZINC001113424501	1369417885	/nfs/dbraw/zinc/41/78/85/1369417885.db2.gz	CNHUDDMCRLQGGG-SFHVURJKSA-N	0	3	339.483	3.449	20	30		EGEDHN
C=CC1(CC(=O)N2CCN(C[C@H]3CCO[C@H](C)C3)CC2)CCCCC1	ZINC001113428271	1369421026	/nfs/dbraw/zinc/42/10/26/1369421026.db2.gz	NWCFHCQTLCEZHB-MOPGFXCFSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCCO[C@@H](CNCc2cccc(F)c2)C1	ZINC001201233251	1369501594	/nfs/dbraw/zinc/50/15/94/1369501594.db2.gz	MWEYENWIUYNQJZ-APWZRJJASA-N	0	3	348.462	3.135	20	30		EGEDHN
CCCCCCCN1C[C@H](NC(=O)c2cccnc2)[C@@H]2OCCC[C@@H]21	ZINC001201762730	1369618464	/nfs/dbraw/zinc/61/84/64/1369618464.db2.gz	SBFURGDPIRWGIQ-FHWLQOOXSA-N	0	3	345.487	3.014	20	30		EGEDHN
CC#CCNC[C@H]1CN(C(=O)C[C@@H](C)CCCCCC)CCCO1	ZINC001201842476	1369633089	/nfs/dbraw/zinc/63/30/89/1369633089.db2.gz	WHLIXGKZCXSWGW-OALUTQOASA-N	0	3	336.520	3.213	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC(NCc2nc(C)sc2C)CC1	ZINC001202004592	1369664772	/nfs/dbraw/zinc/66/47/72/1369664772.db2.gz	MKMALSCQMHDDOP-UHFFFAOYSA-N	0	3	347.528	3.424	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC(NCc2oc(CC)nc2C)CC1	ZINC001202004474	1369664971	/nfs/dbraw/zinc/66/49/71/1369664971.db2.gz	KPFISSNCWSTSHB-UHFFFAOYSA-N	0	3	345.487	3.210	20	30		EGEDHN
C#CCNC[C@@H]1CN(C(=O)[C@](C)(CC)CCCCCC)CCCO1	ZINC001202108060	1369688674	/nfs/dbraw/zinc/68/86/74/1369688674.db2.gz	DOBVDTYGXGLQBQ-UYAOXDASSA-N	0	3	336.520	3.213	20	30		EGEDHN
O=C(N[C@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2)c1ccccc1	ZINC001202337793	1369742344	/nfs/dbraw/zinc/74/23/44/1369742344.db2.gz	WNUPFVMUXBQAOC-SFTDATJTSA-N	0	3	344.458	3.369	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)Nc1ccc(Br)cc1	ZINC001202342998	1369743441	/nfs/dbraw/zinc/74/34/41/1369743441.db2.gz	IDFHVESYHYVYQS-AWEZNQCLSA-N	0	3	338.249	3.221	20	30		EGEDHN
CC(C)C(=O)N[C@@H]1C[C@H](NCC#Cc2ccccc2Cl)C12CCC2	ZINC001202458184	1369777400	/nfs/dbraw/zinc/77/74/00/1369777400.db2.gz	BLEHDADESVKWSB-ZWKOTPCHSA-N	0	3	344.886	3.365	20	30		EGEDHN
CC(C)C(=O)N[C@H]1C[C@H](NCC#Cc2cccc(Cl)c2)C12CCC2	ZINC001202459390	1369778181	/nfs/dbraw/zinc/77/81/81/1369778181.db2.gz	OKIPZIUPOYZPIL-ROUUACIJSA-N	0	3	344.886	3.365	20	30		EGEDHN
CC[C@@H](CC(C)C)C(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001186902390	1388025766	/nfs/dbraw/zinc/02/57/66/1388025766.db2.gz	GJCFOOINPQLCSF-FUHWJXTLSA-N	0	3	345.462	3.460	20	30		EGEDHN
C#CCCCC(=O)NC1[C@H]2CN(C/C=C/c3ccc(Cl)cc3)C[C@@H]12	ZINC001114198670	1369789581	/nfs/dbraw/zinc/78/95/81/1369789581.db2.gz	GWJIGSYZGXCZPW-KECZCAMVSA-N	0	3	342.870	3.203	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1[C@H]2CN(CCOc3c(C)cccc3C)C[C@H]21	ZINC001114353129	1369907917	/nfs/dbraw/zinc/90/79/17/1369907917.db2.gz	MWIUPDZMYWSIBL-RUYXUALKSA-N	0	3	342.483	3.085	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1C[C@H](NCc2ccccc2F)C12CCC2	ZINC001202867371	1369912112	/nfs/dbraw/zinc/91/21/12/1369912112.db2.gz	QIPADEKRJKAAKD-ZWKOTPCHSA-N	0	3	328.431	3.002	20	30		EGEDHN
O=C(C#CC1CC1)N[C@H]1C[C@H](NCc2sccc2Cl)C12CCC2	ZINC001202888765	1369917643	/nfs/dbraw/zinc/91/76/43/1369917643.db2.gz	UBOWLDBHRAZODN-HOTGVXAUSA-N	0	3	348.899	3.332	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@H]1C[C@H](NCC=C(Cl)Cl)C12CCC2	ZINC001202919647	1369926686	/nfs/dbraw/zinc/92/66/86/1369926686.db2.gz	GDDRQIQTMRAPDT-STQMWFEESA-N	0	3	343.298	3.372	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CN(Cc3ccc4c(c3)CCC4)C2)CC1	ZINC001203019436	1369955637	/nfs/dbraw/zinc/95/56/37/1369955637.db2.gz	SDOKCISEBQZZCB-UHFFFAOYSA-N	0	3	340.467	3.396	20	30		EGEDHN
CC1(CC(=O)N[C@H]2C[C@@H](NCC#Cc3ccccc3)C23CCC3)CC1	ZINC001203214698	1370028015	/nfs/dbraw/zinc/02/80/15/1370028015.db2.gz	XUUQKBPBQBDUKL-MOPGFXCFSA-N	0	3	336.479	3.245	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1[C@H]2CN(Cc3cc(F)ccc3C)C[C@H]21	ZINC001114722171	1370044897	/nfs/dbraw/zinc/04/48/97/1370044897.db2.gz	CLRCSFHRVLNFAH-OAOYMFHYSA-N	0	3	330.447	3.283	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1[C@H]2CN(CCc3ccc(F)c(F)c3)C[C@H]21	ZINC001114722629	1370046154	/nfs/dbraw/zinc/04/61/54/1370046154.db2.gz	LCBDZXZJZHJBNJ-HWLIBYHHSA-N	0	3	348.437	3.156	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1[C@H]2CN(CCc3ccccc3F)C[C@H]21	ZINC001114726483	1370048647	/nfs/dbraw/zinc/04/86/47/1370048647.db2.gz	MLWLTFMGSQPUNM-PYQAKABTSA-N	0	3	330.447	3.017	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1[C@H]2CN(CCc3ccc(F)c(F)c3)C[C@H]21	ZINC001114727392	1370049506	/nfs/dbraw/zinc/04/95/06/1370049506.db2.gz	VMJWSUPSNVWCCW-WBZSCFCESA-N	0	3	348.437	3.156	20	30		EGEDHN
Cc1coc(C(=O)N[C@H]2C[C@H](NCC#Cc3ccccc3)C23CCC3)c1	ZINC001203282245	1370061323	/nfs/dbraw/zinc/06/13/23/1370061323.db2.gz	WMIXVNZDDPHRTN-PMACEKPBSA-N	0	3	348.446	3.270	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2[C@H]3CN(Cc4sc(C)nc4C)C[C@H]32)CC1	ZINC001114777924	1370075964	/nfs/dbraw/zinc/07/59/64/1370075964.db2.gz	BILZRWWUQRUMDW-QLPKVWCKSA-N	0	3	345.512	3.053	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2[C@H]3CN(Cc4sc(C)nc4C)C[C@H]32)CCC1	ZINC001114785150	1370078812	/nfs/dbraw/zinc/07/88/12/1370078812.db2.gz	IRHXJIPIDBVNSI-QLPKVWCKSA-N	0	3	345.512	3.053	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001203341890	1370090384	/nfs/dbraw/zinc/09/03/84/1370090384.db2.gz	UNJLCFXFKJBTEX-PMACEKPBSA-N	0	3	336.479	3.411	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2C[C@H](NCc3conc3C)C23CCC3)CC1	ZINC001203372126	1370102681	/nfs/dbraw/zinc/10/26/81/1370102681.db2.gz	COQSQUINZQIJJE-DLBZAZTESA-N	0	3	343.471	3.246	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1C[C@@H](NCc2cncs2)C12CCC2	ZINC001203450893	1370131552	/nfs/dbraw/zinc/13/15/52/1370131552.db2.gz	GGMLJJRMUFSSLQ-HUUCEWRRSA-N	0	3	333.501	3.262	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1C[C@@H](NCc2ccns2)C12CCC2	ZINC001203453498	1370132072	/nfs/dbraw/zinc/13/20/72/1370132072.db2.gz	SPQUODUKFBXYPI-CABCVRRESA-N	0	3	333.501	3.262	20	30		EGEDHN
C=CCO[C@@H]1CO[C@@]2(C1)CCCN(Cc1ccccc1OCC)C2	ZINC001203542246	1370162129	/nfs/dbraw/zinc/16/21/29/1370162129.db2.gz	JUWDQASZRBAIJL-AZUAARDMSA-N	0	3	331.456	3.411	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)CCc2ccccc2)C12CCC2	ZINC001203650559	1370201098	/nfs/dbraw/zinc/20/10/98/1370201098.db2.gz	IIPGGXLKDBAJRL-IAGOWNOFSA-N	0	3	332.875	3.389	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)CCc2ccccc2)C12CCC2	ZINC001203650561	1370201654	/nfs/dbraw/zinc/20/16/54/1370201654.db2.gz	IIPGGXLKDBAJRL-SJORKVTESA-N	0	3	332.875	3.389	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)C(C)(C)C(C)(F)F)C12CCC2	ZINC001203670585	1370210053	/nfs/dbraw/zinc/21/00/53/1370210053.db2.gz	PWWNIDOUNQCQIB-RYUDHWBXSA-N	0	3	334.838	3.437	20	30		EGEDHN
CCC(CC)(CC)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001115023269	1370218630	/nfs/dbraw/zinc/21/86/30/1370218630.db2.gz	QHKHKXVGMCLAEM-BWTSREIZSA-N	0	3	339.483	3.321	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC001203756889	1370251315	/nfs/dbraw/zinc/25/13/15/1370251315.db2.gz	FLHOEKCZQCYRIU-KRWDZBQOSA-N	0	3	329.444	3.390	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@H]1C[C@@H]2C[C@H]1CN2Cc1ccc(C#N)cc1	ZINC001203899910	1370305826	/nfs/dbraw/zinc/30/58/26/1370305826.db2.gz	GSUYHSAFCWFMPI-ULQDDVLXSA-N	0	3	327.428	3.046	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)Cc2cccs2)CCCCC1	ZINC001115382944	1370421024	/nfs/dbraw/zinc/42/10/24/1370421024.db2.gz	OHAGTIXFDBTLRU-UHFFFAOYSA-N	0	3	326.893	3.452	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H]2CN(Cc3cccc(OC(C)C)c3)C[C@H]21	ZINC001187191129	1388068042	/nfs/dbraw/zinc/06/80/42/1388068042.db2.gz	FSYFRENTLMUSCG-AZUAARDMSA-N	0	3	342.483	3.473	20	30		EGEDHN
N#Cc1ccc(N2CCCN(Cc3ccc4ccccc4n3)CC2)nc1	ZINC001204502773	1370495834	/nfs/dbraw/zinc/49/58/34/1370495834.db2.gz	MLRYBWQVVOHKGP-UHFFFAOYSA-N	0	3	343.434	3.214	20	30		EGEDHN
COc1ccc(C#N)c(Nc2ccc(CN3CCN(C)CC3)cc2)c1	ZINC001204751807	1370566228	/nfs/dbraw/zinc/56/62/28/1370566228.db2.gz	ZIGOIRYHEGQZGW-UHFFFAOYSA-N	0	3	336.439	3.058	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1CCC(CNCc2cc(F)ccc2C#N)CC1	ZINC001204827516	1370584744	/nfs/dbraw/zinc/58/47/44/1370584744.db2.gz	OMGRRVFGLBWKCY-OAHLLOKOSA-N	0	3	345.462	3.462	20	30		EGEDHN
C=CC(C)(C)C(=O)NCC1(NCc2cncc(F)c2)CCCCC1	ZINC001115667002	1370648265	/nfs/dbraw/zinc/64/82/65/1370648265.db2.gz	KWHVQHNUFSLZDT-UHFFFAOYSA-N	0	3	333.451	3.342	20	30		EGEDHN
Cc1cnc(Nc2ccc(C3(N4CCN(C)CC4)CC3)cc2)c(C#N)c1	ZINC001205102854	1370650521	/nfs/dbraw/zinc/65/05/21/1370650521.db2.gz	ZUKGQLMTOZMUQP-UHFFFAOYSA-N	0	3	347.466	3.242	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C[C@H](C)C(C)C)CC[C@H]1c1ccc(F)cc1	ZINC001205263090	1370699056	/nfs/dbraw/zinc/69/90/56/1370699056.db2.gz	KEHUBOPUFQZXFR-FFZOFVMBSA-N	0	3	344.474	3.415	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ocnc2C2CC2)CCCCC1	ZINC001115728187	1370709526	/nfs/dbraw/zinc/70/95/26/1370709526.db2.gz	OQYZMZGMPYCWEV-UHFFFAOYSA-N	0	3	337.851	3.327	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](c2ccc(F)cc2)[C@H](NCC#CC)C1	ZINC001205300800	1370712993	/nfs/dbraw/zinc/71/29/93/1370712993.db2.gz	XVMRITRJNNOYSJ-RBUKOAKNSA-N	0	3	342.458	3.335	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C[C@@H]2C=CCC2)C[C@H]1c1cccc(F)c1	ZINC001205355466	1370730102	/nfs/dbraw/zinc/73/01/02/1370730102.db2.gz	QQQSLFVFQCRHNB-LSTHTHJFSA-N	0	3	340.442	3.089	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(CC)Cc2ccccc2F)CC1	ZINC001115998388	1370817903	/nfs/dbraw/zinc/81/79/03/1370817903.db2.gz	BBHXQIYENRKLTE-UHFFFAOYSA-N	0	3	333.451	3.398	20	30		EGEDHN
C=CCOC(=O)N1CCCC2(CCN(Cc3ncccc3C)CC2)C1	ZINC001205763406	1370863847	/nfs/dbraw/zinc/86/38/47/1370863847.db2.gz	SVYQGKFCMQRUQR-UHFFFAOYSA-N	0	3	343.471	3.391	20	30		EGEDHN
CC#CCCCC(=O)N1CCC(CNCc2oc(CC)nc2C)CC1	ZINC001205970507	1370925825	/nfs/dbraw/zinc/92/58/25/1370925825.db2.gz	SMVWPBBCOYVCDA-UHFFFAOYSA-N	0	3	345.487	3.067	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC(CNCc2cc(C3CC3)no2)CC1	ZINC001205988109	1370930248	/nfs/dbraw/zinc/93/02/48/1370930248.db2.gz	AMOFDWODNRZIMQ-HNNXBMFYSA-N	0	3	345.487	3.483	20	30		EGEDHN
C=C(CN1CCCC1)c1nc(-c2cc(C)c(Br)cn2)no1	ZINC001206100804	1370960547	/nfs/dbraw/zinc/96/05/47/1370960547.db2.gz	UVAQEYBDHSFDBP-UHFFFAOYSA-N	0	3	349.232	3.312	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N[C@@H]1CN(Cc2ccc(C)cc2C)C[C@H]1C	ZINC001206429257	1371052120	/nfs/dbraw/zinc/05/21/20/1371052120.db2.gz	VAHBABVMKIVHQL-QWFCFKBJSA-N	0	3	344.499	3.221	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CN(CCOc2ccc(Cl)cc2)C[C@H]1C	ZINC001206509162	1371078489	/nfs/dbraw/zinc/07/84/89/1371078489.db2.gz	DQZKJEUJXLNPLC-RHSMWYFYSA-N	0	3	336.863	3.122	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cccnc1OC)[C@@H]2CC	ZINC001206568457	1371095405	/nfs/dbraw/zinc/09/54/05/1371095405.db2.gz	MQYAUUKQUFNNTO-XLIONFOSSA-N	0	3	343.471	3.012	20	30		EGEDHN
C=CCOC(=O)N1CC2(C1)CCN(Cc1ccc(C)cc1OC)CC2	ZINC001206741229	1371151353	/nfs/dbraw/zinc/15/13/53/1371151353.db2.gz	PHJSLDFWFWTCTN-UHFFFAOYSA-N	0	3	344.455	3.224	20	30		EGEDHN
CC1(CCC(=O)N2CCC(CNCc3ccccc3C#N)CC2)CC1	ZINC001206768689	1371158791	/nfs/dbraw/zinc/15/87/91/1371158791.db2.gz	JACIXQKPTPCFCA-UHFFFAOYSA-N	0	3	339.483	3.467	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CN(C[C@H](OC)c2ccccc2)C[C@H]1C	ZINC001206884951	1371206185	/nfs/dbraw/zinc/20/61/85/1371206185.db2.gz	MTVWDNGMKUMHOD-RLLQIKCJSA-N	0	3	342.483	3.004	20	30		EGEDHN
O=C(C1CCCCC1)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207091228	1371290626	/nfs/dbraw/zinc/29/06/26/1371290626.db2.gz	NJUSUAIDMQICOZ-FQEVSTJZSA-N	0	3	342.458	3.338	20	30		EGEDHN
C=CCOC(=O)N1CCCC2(CCN(Cc3c(C)noc3C)CC2)C1	ZINC001207133741	1371304487	/nfs/dbraw/zinc/30/44/87/1371304487.db2.gz	VEUUQMGXTLKHCI-UHFFFAOYSA-N	0	3	347.459	3.292	20	30		EGEDHN
CC(C)CCC(=O)N1CCC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001207222130	1371333836	/nfs/dbraw/zinc/33/38/36/1371333836.db2.gz	NFUBYXKUNIKFLD-QGZVFWFLSA-N	0	3	331.435	3.214	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001207363019	1371374692	/nfs/dbraw/zinc/37/46/92/1371374692.db2.gz	KTPZJJFVGFGKIG-WBVHZDCISA-N	0	3	332.875	3.318	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)c2ccccc2C(C)C)C1	ZINC001207390009	1371382811	/nfs/dbraw/zinc/38/28/11/1371382811.db2.gz	OUODFQZYBJFQRL-VQIMIIECSA-N	0	3	330.472	3.063	20	30		EGEDHN
CC/C=C(\C)C(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207566826	1371437467	/nfs/dbraw/zinc/43/74/67/1371437467.db2.gz	VIWRWOADSBDPAK-ZHPQLQEBSA-N	0	3	328.431	3.114	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)COc2ccccc2)CCCCC1	ZINC001120056325	1371471004	/nfs/dbraw/zinc/47/10/04/1371471004.db2.gz	LSKFNUMXCVPCBA-UHFFFAOYSA-N	0	3	336.863	3.227	20	30		EGEDHN
O=C(/C=C/C1CC1)N1CCC[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207742267	1371490655	/nfs/dbraw/zinc/49/06/55/1371490655.db2.gz	UIZNWQDKWAVNOC-VYENPZKTSA-N	0	3	342.870	3.238	20	30		EGEDHN
C=CCCOCC(=O)NCC1(NCC=C(Cl)Cl)CCCCC1	ZINC001120234159	1371510193	/nfs/dbraw/zinc/51/01/93/1371510193.db2.gz	WAMUVJHOJGGWBW-UHFFFAOYSA-N	0	3	349.302	3.307	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H](N[C@@H](C)c2ccc(F)cc2F)C1	ZINC001207909047	1371535447	/nfs/dbraw/zinc/53/54/47/1371535447.db2.gz	NBKYUXJBJWOZDR-HOCLYGCPSA-N	0	3	334.410	3.410	20	30		EGEDHN
CC[C@H](C)CC(=O)N1CCC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001207913629	1371537553	/nfs/dbraw/zinc/53/75/53/1371537553.db2.gz	CDGPXTBWIZLDEK-YOEHRIQHSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H]([C@@H]2CCCN2Cc2ccc(F)cn2)C1	ZINC001120348037	1371542979	/nfs/dbraw/zinc/54/29/79/1371542979.db2.gz	ONYFATJVURWVPE-APWZRJJASA-N	0	3	345.462	3.390	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC[C@H](N[C@@H](C)c2ccc(F)cc2F)C1	ZINC001207991974	1371561780	/nfs/dbraw/zinc/56/17/80/1371561780.db2.gz	CCWCYBJGEBIFLB-HOCLYGCPSA-N	0	3	334.410	3.266	20	30		EGEDHN
CC/C(C)=C\C(=O)N1CCC[C@H](NCc2cc(C#N)ccc2OC)C1	ZINC001208002649	1371565000	/nfs/dbraw/zinc/56/50/00/1371565000.db2.gz	XCWIDKNWEDPQGT-BXBOZWQASA-N	0	3	341.455	3.004	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N2CCC[C@@H](NC[C@@H](F)CC)C2)cc1	ZINC001208029252	1371573724	/nfs/dbraw/zinc/57/37/24/1371573724.db2.gz	RQZGWSYMZRIUSP-ZWKOTPCHSA-N	0	3	346.446	3.031	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CN(Cc2cccc(COC)c2)C[C@H]1C	ZINC001208387816	1371748331	/nfs/dbraw/zinc/74/83/31/1371748331.db2.gz	BRBMAEFFOMMTHZ-MBOZVWFJSA-N	0	3	344.499	3.372	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1)C(C)(C)C	ZINC001208423311	1371762546	/nfs/dbraw/zinc/76/25/46/1371762546.db2.gz	HFBZREAETLBWGU-LPHOPBHVSA-N	0	3	344.474	3.440	20	30		EGEDHN
C=CCCC(=O)NC1CC2(CC(NCc3nc(C)sc3C)C2)C1	ZINC001120812908	1371768898	/nfs/dbraw/zinc/76/88/98/1371768898.db2.gz	MMCNCIFAEIHMNB-UHFFFAOYSA-N	0	3	333.501	3.243	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1CN(CCOc2ccccc2)C[C@H]1C	ZINC001208497947	1371787472	/nfs/dbraw/zinc/78/74/72/1371787472.db2.gz	HLZMTIYAVVMISN-POAQFYNOSA-N	0	3	330.472	3.104	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1CN(CCCOc2ccccc2)C[C@H]1C	ZINC001208497865	1371787565	/nfs/dbraw/zinc/78/75/65/1371787565.db2.gz	CCOCRMWVOIEJGN-QFUCXCTJSA-N	0	3	344.499	3.494	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)C(C)(C)CC(F)F)C2	ZINC001121234007	1371902798	/nfs/dbraw/zinc/90/27/98/1371902798.db2.gz	VNDZYAHLWPBACF-UHFFFAOYSA-N	0	3	334.838	3.437	20	30		EGEDHN
N#Cc1cccc(CCCN2CC[C@H](N3CCCCC3)[C@@H](F)C2)c1	ZINC001208860680	1371921821	/nfs/dbraw/zinc/92/18/21/1371921821.db2.gz	RWGOMJZNBZQMLA-PMACEKPBSA-N	0	3	329.463	3.389	20	30		EGEDHN
N#Cc1ccc(CCCN2CCN(c3noc4ccccc43)CC2)cc1	ZINC001208860371	1371921912	/nfs/dbraw/zinc/92/19/12/1371921912.db2.gz	LDPZKCSIQFYLLP-UHFFFAOYSA-N	0	3	346.434	3.454	20	30		EGEDHN
N#Cc1ccc(CCCN2CCN(CCc3ccccc3)CC2)cc1	ZINC001208859148	1371922271	/nfs/dbraw/zinc/92/22/71/1371922271.db2.gz	SKFXDXQEWCXXAT-UHFFFAOYSA-N	0	3	333.479	3.351	20	30		EGEDHN
N#Cc1ccc(CCN2CCc3nn(-c4ccccc4)cc3C2)cc1	ZINC001208928077	1371948301	/nfs/dbraw/zinc/94/83/01/1371948301.db2.gz	SRIMTRHIRROCOJ-UHFFFAOYSA-N	0	3	328.419	3.345	20	30		EGEDHN
COc1cccnc1O[C@@H]1CCCN(CCc2ccc(C#N)cc2)C1	ZINC001208928389	1371948574	/nfs/dbraw/zinc/94/85/74/1371948574.db2.gz	GWZCOIJOCHGUEN-GOSISDBHSA-N	0	3	337.423	3.048	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CN(C[C@@H](OC)c2ccccc2)C[C@H]1C	ZINC001208953830	1371960989	/nfs/dbraw/zinc/96/09/89/1371960989.db2.gz	ADQSEQGQZMOBPY-BHIYHBOVSA-N	0	3	344.499	3.413	20	30		EGEDHN
N#Cc1ccccc1CNC1CC2(C1)CC(NC(=O)CCC(F)F)C2	ZINC001121416482	1371968591	/nfs/dbraw/zinc/96/85/91/1371968591.db2.gz	WERMSYCKHICCFW-UHFFFAOYSA-N	0	3	347.409	3.121	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001209002375	1371970958	/nfs/dbraw/zinc/97/09/58/1371970958.db2.gz	AEEBYGABACUHND-OAQYLSRUSA-N	0	3	336.479	3.202	20	30		EGEDHN
CC[C@H](F)C(=O)N1CCC[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001209015436	1371974863	/nfs/dbraw/zinc/97/48/63/1371974863.db2.gz	BBZUYHADMCRQRI-IRXDYDNUSA-N	0	3	336.838	3.020	20	30		EGEDHN
C=CCN(CCN1CCC[C@H]1c1cccc(OC)c1)C(=O)OCC	ZINC001209022490	1371977298	/nfs/dbraw/zinc/97/72/98/1371977298.db2.gz	LQGUQYNOHIOYKJ-SFHVURJKSA-N	0	3	332.444	3.477	20	30		EGEDHN
CC1(C)CCC[C@H]1C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001209061858	1371987092	/nfs/dbraw/zinc/98/70/92/1371987092.db2.gz	USXZIFFNGSGNQE-UXHICEINSA-N	0	3	338.495	3.445	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@H](NCc2ccc(Cl)nc2)C1	ZINC001209110579	1372001201	/nfs/dbraw/zinc/00/12/01/1372001201.db2.gz	BULLJTQTKJFYBH-INIZCTEOSA-N	0	3	333.863	3.009	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC1CC2(CC(NCc3cnc(C)o3)C2)C1	ZINC001121616194	1372026109	/nfs/dbraw/zinc/02/61/09/1372026109.db2.gz	CNMYVMVETSCLPX-PXLHRZOGSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001209192543	1372033229	/nfs/dbraw/zinc/03/32/29/1372033229.db2.gz	ARUSNSGYHVFEGP-MAUKXSAKSA-N	0	3	343.446	3.380	20	30		EGEDHN
CC(C)c1[nH]ccc1C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001209196028	1372034087	/nfs/dbraw/zinc/03/40/87/1372034087.db2.gz	ZDNJOMGZBVYFCK-LJQANCHMSA-N	0	3	349.478	3.384	20	30		EGEDHN
C#CCCCN1CC[C@@H](NC(=O)OC(C)(C)C)[C@H](C(F)(F)F)C1	ZINC001209268114	1372054447	/nfs/dbraw/zinc/05/44/47/1372054447.db2.gz	UIBFRJRYXRFMSX-CHWSQXEVSA-N	0	3	334.382	3.177	20	30		EGEDHN
CC1(C)CC(N=Nc2nncc(N)c2Cl)CN1Cc1ccccc1	ZINC001326391006	1388175322	/nfs/dbraw/zinc/17/53/22/1388175322.db2.gz	MMELPZMVRWTSBJ-UHFFFAOYSA-N	0	3	344.850	3.165	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC1CC2(CC(NCc3oc(C)nc3C)C2)C1	ZINC001121841901	1372099460	/nfs/dbraw/zinc/09/94/60/1372099460.db2.gz	SHOYMKWMPMWUMK-UHFFFAOYSA-N	0	3	345.487	3.411	20	30		EGEDHN
C=CCCCCCCCN1CCCn2nnc(Cn3ccnc3)c2C1	ZINC001209441676	1372107272	/nfs/dbraw/zinc/10/72/72/1372107272.db2.gz	KTYGWCPZLNCNLE-UHFFFAOYSA-N	0	3	342.491	3.255	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@H](NCC#Cc3cccc(Cl)c3)C2)CC1	ZINC001209475711	1372116648	/nfs/dbraw/zinc/11/66/48/1372116648.db2.gz	QIUPPXLNTKLRRY-SFHVURJKSA-N	0	3	344.886	3.462	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)N1CCC[C@@H]1c1cn(C)nc1C	ZINC001121925547	1372124568	/nfs/dbraw/zinc/12/45/68/1372124568.db2.gz	AKWJSENCMLJSNG-QZTJIDSGSA-N	0	3	334.508	3.470	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H](C)[C@H](NC(=O)c2snnc2C(C)C)C1	ZINC001209664065	1372164453	/nfs/dbraw/zinc/16/44/53/1372164453.db2.gz	KORICVHIIXIHEN-MGPQQGTHSA-N	0	3	336.505	3.066	20	30		EGEDHN
COc1c(Cl)ccc(CN2CCC3SC(=O)C=C3C2)c1F	ZINC001209697931	1372173870	/nfs/dbraw/zinc/17/38/70/1372173870.db2.gz	WKEHEHAQMLRNPQ-LBPRGKRZSA-N	0	3	327.808	3.262	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N1CCC(N2c3ccccc3C[C@@H]2C)CC1	ZINC001122127820	1372181331	/nfs/dbraw/zinc/18/13/31/1372181331.db2.gz	FOTXUTOEKVSDNE-QFBILLFUSA-N	0	3	341.499	3.112	20	30		EGEDHN
Cn1cc(CN2CCC[C@H](Oc3ccccc3C#N)C2)c2cccnc21	ZINC001209750110	1372183952	/nfs/dbraw/zinc/18/39/52/1372183952.db2.gz	LVGJRDVYXQJKSI-SFHVURJKSA-N	0	3	346.434	3.488	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001209867669	1372218031	/nfs/dbraw/zinc/21/80/31/1372218031.db2.gz	ZUNPLHSXROJMKQ-IBGZPJMESA-N	0	3	342.458	3.360	20	30		EGEDHN
C=C(C)Cn1c([C@@H](CC)OCC)nnc1N1CCN(CC(C)C)CC1	ZINC001122484801	1372257288	/nfs/dbraw/zinc/25/72/88/1372257288.db2.gz	BZNDQOPRZAAUIF-QGZVFWFLSA-N	0	3	349.523	3.120	20	30		EGEDHN
C[C@@H](Sc1ccc(F)cc1)C(=O)C(C#N)C(=O)NC1CCCCC1	ZINC001122541159	1372270314	/nfs/dbraw/zinc/27/03/14/1372270314.db2.gz	LNWBMMLZYUHCIC-WBMJQRKESA-N	0	3	348.443	3.464	20	30		EGEDHN
C[C@@H](Sc1ccc(F)cc1)C(=O)C(C#N)C(=O)NC1CCCCC1	ZINC001122541158	1372270385	/nfs/dbraw/zinc/27/03/85/1372270385.db2.gz	LNWBMMLZYUHCIC-MLGOLLRUSA-N	0	3	348.443	3.464	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CCCN(C)C2)nnc1N1C[C@H](C)[C@@H](C)[C@H]1C	ZINC001122544005	1372271000	/nfs/dbraw/zinc/27/10/00/1372271000.db2.gz	QXWGFUAUUKLLDX-HZMVEIRTSA-N	0	3	331.508	3.144	20	30		EGEDHN
CSc1ccc(CCC(=O)C(C#N)C(=O)NC2CCCC2)cc1	ZINC001122561567	1372275775	/nfs/dbraw/zinc/27/57/75/1372275775.db2.gz	IVXWRSOKHCKSKJ-MRXNPFEDSA-N	0	3	330.453	3.109	20	30		EGEDHN
CCN1C[C@H](C)N(c2nnc(C(C)(C)CC#N)n2CC(C)C)C[C@H]1C	ZINC001122782736	1372319941	/nfs/dbraw/zinc/31/99/41/1372319941.db2.gz	GJPYIRISYKRERW-CVEARBPZSA-N	0	3	346.523	3.044	20	30		EGEDHN
C=CCC1(C(=O)N2CCC[C@H](NCc3cnn(C)c3)C2)CCCCC1	ZINC001211213730	1372504231	/nfs/dbraw/zinc/50/42/31/1372504231.db2.gz	RYJOHEHKXQMKFU-SFHVURJKSA-N	0	3	344.503	3.027	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)c2ccc([C@H](C)CC)cc2)C1	ZINC001211384294	1372546214	/nfs/dbraw/zinc/54/62/14/1372546214.db2.gz	MJIWVRJLGHITNB-MBOZVWFJSA-N	0	3	344.499	3.453	20	30		EGEDHN
C=C(CN1CCCCC1)c1nc(-c2ccccc2OCOC)no1	ZINC001211436818	1372558997	/nfs/dbraw/zinc/55/89/97/1372558997.db2.gz	YWHJUGQNASKWNS-UHFFFAOYSA-N	0	3	329.400	3.218	20	30		EGEDHN
O=C(C1CC1)N1C[C@@H](c2ccccc2)[C@H](NCC#Cc2ccccc2)C1	ZINC001211509070	1372570744	/nfs/dbraw/zinc/57/07/44/1372570744.db2.gz	XMNIRGLZMGHNQZ-FCHUYYIVSA-N	0	3	344.458	3.032	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@@H](C)CCCC)C[C@H]1c1ccccc1	ZINC001211590188	1372587324	/nfs/dbraw/zinc/58/73/24/1372587324.db2.gz	CZTCPXYLWGBMDX-YSIASYRMSA-N	0	3	326.484	3.420	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@]2(C)CC=CCC2)C[C@H]1c1ccccc1	ZINC001211605162	1372589261	/nfs/dbraw/zinc/58/92/61/1372589261.db2.gz	GOESORBMCGSCRA-TUNNFDKTSA-N	0	3	336.479	3.340	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@@H](c2ccccc2)[C@H](NCC#CC)C1	ZINC001211607770	1372589606	/nfs/dbraw/zinc/58/96/06/1372589606.db2.gz	URVUCMDVTQPCDG-ZWKOTPCHSA-N	0	3	344.886	3.373	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@](C)(F)CCCC)C[C@H]1c1ccccc1	ZINC001211625942	1372592416	/nfs/dbraw/zinc/59/24/16/1372592416.db2.gz	ZMSPPQVUXPWBFF-NSHGMRRFSA-N	0	3	330.447	3.122	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@@H](C)CC(C)C)C[C@H]1c1ccccc1	ZINC001211698338	1372604003	/nfs/dbraw/zinc/60/40/03/1372604003.db2.gz	IQUFOBABPXDCSL-YSIASYRMSA-N	0	3	326.484	3.276	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2cc(CC)ccn2)[C@H](OC)C1	ZINC001212308906	1372684207	/nfs/dbraw/zinc/68/42/07/1372684207.db2.gz	JTOVOVSPJJLJEQ-RTBURBONSA-N	0	3	347.503	3.043	20	30		EGEDHN
CCCCCCCC[C@H](C)C(=O)N1CC[C@@H](NCc2n[nH]c(C)n2)C1	ZINC001188016285	1388215286	/nfs/dbraw/zinc/21/52/86/1388215286.db2.gz	XBXCJAUTIDBXHT-DOTOQJQBSA-N	0	3	349.523	3.190	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2cc3occc3[nH]2)[C@H](OC)C1	ZINC001212344930	1372691746	/nfs/dbraw/zinc/69/17/46/1372691746.db2.gz	SSKRMUFPMQIGPO-SJLPKXTDSA-N	0	3	347.459	3.160	20	30		EGEDHN
CN1CCN(Cc2ccc(Nc3ccccc3OCC#N)cc2)CC1	ZINC001212600524	1372735766	/nfs/dbraw/zinc/73/57/66/1372735766.db2.gz	YJIOONGQJWQOON-UHFFFAOYSA-N	0	3	336.439	3.080	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CN([C@@H](CC)c2ccccc2)C[C@H]1OC	ZINC001213295506	1372877893	/nfs/dbraw/zinc/87/78/93/1372877893.db2.gz	YBDMGBLLMXABSK-HSALFYBXSA-N	0	3	342.483	3.147	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1CN(Cc2c(C)cccc2C)C[C@H]1OC	ZINC001213320062	1372883266	/nfs/dbraw/zinc/88/32/66/1372883266.db2.gz	LJXUDSNEUQLXOQ-MISYRCLQSA-N	0	3	344.499	3.221	20	30		EGEDHN
CCN1CCN(Cc2ccc(Nc3ccc(C#N)cc3N)cc2)CC1	ZINC001213358039	1372891278	/nfs/dbraw/zinc/89/12/78/1372891278.db2.gz	CSQIEPIYWCMSPW-UHFFFAOYSA-N	0	3	335.455	3.022	20	30		EGEDHN
C#CCCCCC(=O)NCCNCc1cc(C(C)C)ccc1OC	ZINC001125938812	1372895531	/nfs/dbraw/zinc/89/55/31/1372895531.db2.gz	KWGOTHAXNNCWOP-UHFFFAOYSA-N	0	3	330.472	3.218	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CC/C=C\CCC)C[C@H]2OC)CCC1	ZINC001213385424	1372897852	/nfs/dbraw/zinc/89/78/52/1372897852.db2.gz	MWGZMDYLJJXCCM-BTFXCVNISA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)C2(CCC=C)CC2)[C@H](OC)C1	ZINC001213394874	1372899997	/nfs/dbraw/zinc/89/99/97/1372899997.db2.gz	BRTLXLTWLQJDQO-QZTJIDSGSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@H](F)c2ccccc2)[C@H](OC)C1	ZINC001213491378	1372913034	/nfs/dbraw/zinc/91/30/34/1372913034.db2.gz	NCWLLLYVDHBLGD-GUDVDZBRSA-N	0	3	348.462	3.259	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@H](C)C2CCCC2)[C@H](OC)C1	ZINC001213702333	1372947242	/nfs/dbraw/zinc/94/72/42/1372947242.db2.gz	IUOQAZKUBWFEMD-BHIYHBOVSA-N	0	3	336.520	3.375	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)C2(C)CC(F)(F)C2)[C@H](OC)C1	ZINC001213708675	1372948761	/nfs/dbraw/zinc/94/87/61/1372948761.db2.gz	RXJDROQUIJNNCC-HUUCEWRRSA-N	0	3	346.462	3.208	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2ccc(C)cc2)[C@H](OC)C1	ZINC001213774650	1372960215	/nfs/dbraw/zinc/96/02/15/1372960215.db2.gz	DBBKWNZNAGSFDX-RTBURBONSA-N	0	3	332.488	3.394	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2sccc2C(C)C)[C@H](OC)C1	ZINC001213903412	1372978885	/nfs/dbraw/zinc/97/88/85/1372978885.db2.gz	VEZHCCZYDBXQNZ-HZPDHXFCSA-N	0	3	336.501	3.267	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)[C@@H](C)CCCc2ccccc2)[C@H](OC)C1	ZINC001213948985	1372985513	/nfs/dbraw/zinc/98/55/13/1372985513.db2.gz	KDXJTYOOGYJSJT-DFQSSKMNSA-N	0	3	344.499	3.037	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)CCCCc2ccc(C)cc2)[C@H](OC)C1	ZINC001213961777	1372987599	/nfs/dbraw/zinc/98/75/99/1372987599.db2.gz	QQTUUFNIERDILG-WOJBJXKFSA-N	0	3	344.499	3.099	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccco2)C[C@H]1NCC#Cc1cccc(Cl)c1	ZINC001214049758	1372999735	/nfs/dbraw/zinc/99/97/35/1372999735.db2.gz	UBCBNCBXKBGPRI-RHSMWYFYSA-N	0	3	342.826	3.035	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccoc2)C[C@H]1NCC#Cc1ccccc1Cl	ZINC001214132384	1373013455	/nfs/dbraw/zinc/01/34/55/1373013455.db2.gz	WJNVPTHMUBPDSV-RDTXWAMCSA-N	0	3	342.826	3.035	20	30		EGEDHN
CCC[C@H](C)CC(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001214296456	1373039248	/nfs/dbraw/zinc/03/92/48/1373039248.db2.gz	IODWKPIUYADKMG-JJRVBVJISA-N	0	3	333.501	3.383	20	30		EGEDHN
CC(C)[C@H](C)CC(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001214307326	1373041280	/nfs/dbraw/zinc/04/12/80/1373041280.db2.gz	AWYFSJZHIVYKPW-MBOZVWFJSA-N	0	3	344.474	3.296	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](C)[C@H](NCc2cc(OC)ccc2Cl)C1	ZINC001214524891	1373074294	/nfs/dbraw/zinc/07/42/94/1373074294.db2.gz	SJZGOZWJVXWETJ-RDTXWAMCSA-N	0	3	348.874	3.089	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2)C1	ZINC001214706857	1373106123	/nfs/dbraw/zinc/10/61/23/1373106123.db2.gz	BPIZGQILJMMKJT-WIYYLYMNSA-N	0	3	336.479	3.243	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)[C@H](NCc2cn(C(C)C)nc2C)C1	ZINC001214743488	1373113908	/nfs/dbraw/zinc/11/39/08/1373113908.db2.gz	AMLGYRRTFJJJCR-CRAIPNDOSA-N	0	3	332.492	3.065	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1C[C@@H](C)[C@H](NCC=C(Cl)Cl)C1)OCC	ZINC001214754679	1373115618	/nfs/dbraw/zinc/11/56/18/1373115618.db2.gz	CBYVOIWWRITWGJ-MCIONIFRSA-N	0	3	349.302	3.113	20	30		EGEDHN
CC(C)CC1(C(=O)N2C[C@@H](C)[C@H](NCc3ccc(C#N)s3)C2)CC1	ZINC001214823832	1373124852	/nfs/dbraw/zinc/12/48/52/1373124852.db2.gz	JXKKOTJGMKLDSO-RHSMWYFYSA-N	0	3	345.512	3.383	20	30		EGEDHN
C[C@@H]1CN(C(=O)C(C)(C)CC(F)F)C[C@H]1NCC#Cc1ccccc1	ZINC001214827303	1373125634	/nfs/dbraw/zinc/12/56/34/1373125634.db2.gz	APJYQKPKQXCGEX-NVXWUHKLSA-N	0	3	348.437	3.156	20	30		EGEDHN
C[C@@H]1CN(C(=O)C23CCC(CC2)C3)C[C@H]1NCC#Cc1ccccc1	ZINC001214969148	1373150027	/nfs/dbraw/zinc/15/00/27/1373150027.db2.gz	JGQMQHQVRMJGRQ-ZXWVYEGYSA-N	0	3	336.479	3.055	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](Oc2cnccc2CNCC(=C)C)C1	ZINC001127888742	1373196791	/nfs/dbraw/zinc/19/67/91/1373196791.db2.gz	XUKMDZXQXBVFOP-SFHVURJKSA-N	0	3	343.471	3.083	20	30		EGEDHN
C#CCC1(C(=O)NCCNCc2cccc(C(F)(F)F)c2)CCC1	ZINC001129143070	1373352755	/nfs/dbraw/zinc/35/27/55/1373352755.db2.gz	OOBJZYPWUDRHHF-UHFFFAOYSA-N	0	3	338.373	3.105	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)C(C)(C)CC(C)C)C1	ZINC001130439612	1373540331	/nfs/dbraw/zinc/54/03/31/1373540331.db2.gz	TUMMCLNUGRLIAO-OAHLLOKOSA-N	0	3	332.492	3.074	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)[C@@H](CCC)CC(C)C)C1	ZINC001130452461	1373544417	/nfs/dbraw/zinc/54/44/17/1373544417.db2.gz	FWRDJNQQSWICHO-DLBZAZTESA-N	0	3	346.519	3.464	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)C(C)(C)CC(C)(C)C)C1	ZINC001130450592	1373544467	/nfs/dbraw/zinc/54/44/67/1373544467.db2.gz	POWPBLZETFEDPC-OAHLLOKOSA-N	0	3	346.519	3.464	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)[C@]2(C)CC=C(C)CC2)C1	ZINC001130450595	1373545166	/nfs/dbraw/zinc/54/51/66/1373545166.db2.gz	PQYBTNMWJVMVPL-OXQOHEQNSA-N	0	3	342.487	3.138	20	30		EGEDHN
O=C(/C=C/c1ccccc1)c1ccc(O[C@@H]2CC[C@@H]3NCCO[C@@H]23)cc1	ZINC001218126827	1373565403	/nfs/dbraw/zinc/56/54/03/1373565403.db2.gz	IRVPCPKTKWWDIM-CBQDFYEQSA-N	0	3	349.430	3.481	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N1CCO[C@@H]2CN(CCCCCCC)C[C@@H]21	ZINC001218488536	1373624280	/nfs/dbraw/zinc/62/42/80/1373624280.db2.gz	NMXRJJUWCMKVSM-AQXMTDBDSA-N	0	3	334.504	3.391	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)C[C@H](C=C)CC)[C@H]2C1	ZINC001218517824	1373629154	/nfs/dbraw/zinc/62/91/54/1373629154.db2.gz	QAFIRNAEHMXOEZ-CEXWTWQISA-N	0	3	334.504	3.247	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)[C@@H]3C[C@H]3CCC)[C@H]2C1	ZINC001218600516	1373635492	/nfs/dbraw/zinc/63/54/92/1373635492.db2.gz	LGZZFSVNTKVHEE-AKHDSKFASA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)C[C@H](C)CCC=C(C)C)[C@H]2C1	ZINC001218672809	1373643290	/nfs/dbraw/zinc/64/32/90/1373643290.db2.gz	PPOCEMHZIYIHMY-CEXWTWQISA-N	0	3	334.504	3.247	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)[C@H](CC)CC3CCCC3)[C@H]2C1	ZINC001218715551	1373646859	/nfs/dbraw/zinc/64/68/59/1373646859.db2.gz	JKFOKHHDIFBQRD-HSALFYBXSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)C[C@H](C)C3CCCCC3)[C@H]2C1	ZINC001218766050	1373652692	/nfs/dbraw/zinc/65/26/92/1373652692.db2.gz	HGXVAACMYJKHSI-YSIASYRMSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=CC1(CC(=O)N2CCO[C@@H]3CN(CC(C)C)C[C@@H]32)CCCCC1	ZINC001218771350	1373653363	/nfs/dbraw/zinc/65/33/63/1373653363.db2.gz	FEEIQZGHJRBZIN-ZWKOTPCHSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)[C@@H](CC)CCC)[C@H]2C1	ZINC001218851966	1373661544	/nfs/dbraw/zinc/66/15/44/1373661544.db2.gz	MZSQRPMQRBPVOB-GBESFXJTSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CN([C@H](C)c2cccc3ccccc32)C[C@@H]1O	ZINC001219326165	1373701044	/nfs/dbraw/zinc/70/10/44/1373701044.db2.gz	LMMFTVNOERWZQQ-YSGRDPCXSA-N	0	3	338.451	3.028	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2cc(C3CC3)oc2C2CC2)c1	ZINC001131573908	1373723780	/nfs/dbraw/zinc/72/37/80/1373723780.db2.gz	KYJQEOWASYDFJA-UHFFFAOYSA-N	0	3	349.434	3.426	20	30		EGEDHN
C=CCCCC(=O)N1C[C@H](C)O[C@@]2(CCN(Cc3ccccc3)C2)C1	ZINC001131677189	1373758434	/nfs/dbraw/zinc/75/84/34/1373758434.db2.gz	JOFDHFLJTNMMHJ-GHTZIAJQSA-N	0	3	342.483	3.235	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)CCCc2ccccc2)[C@@H](O)C1	ZINC001220267046	1373762725	/nfs/dbraw/zinc/76/27/25/1373762725.db2.gz	RVRFFEHJXIWXPR-UXHICEINSA-N	0	3	346.515	3.141	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)CCCc3ccc(Cl)cc3)[C@@H]2C1	ZINC001188450331	1388311731	/nfs/dbraw/zinc/31/17/31/1388311731.db2.gz	PRNMIJZICWHXCH-FUHWJXTLSA-N	0	3	332.875	3.381	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC[C@H](C)N(Cc2cccc(N(C)C)c2)C1	ZINC001131900490	1375036913	/nfs/dbraw/zinc/03/69/13/1375036913.db2.gz	YUCPIRRTISVABX-WMZOPIPTSA-N	0	3	329.488	3.188	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCC1CCN(Cc2cncc(C)c2)CC1	ZINC001224165088	1375058343	/nfs/dbraw/zinc/05/83/43/1375058343.db2.gz	GEKMKHPAERTXOU-DLBZAZTESA-N	0	3	329.488	3.176	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CC[C@H](C)N(CCOc2ccccc2)C1	ZINC001131975535	1375078145	/nfs/dbraw/zinc/07/81/45/1375078145.db2.gz	BCKHZHCJQPEOGJ-RBUKOAKNSA-N	0	3	342.483	3.228	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@@H](C)N(CCOC2CCCCCC2)C1	ZINC001131996660	1375089129	/nfs/dbraw/zinc/08/91/29/1375089129.db2.gz	WZFLEJAPGDDQTF-RTBURBONSA-N	0	3	348.531	3.498	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@H](C)N(CCOc2ccc(C)cc2)C1	ZINC001131996915	1375089232	/nfs/dbraw/zinc/08/92/32/1375089232.db2.gz	ZSTPYCHNMALVJN-RBUKOAKNSA-N	0	3	342.483	3.146	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CC[C@@H](C)N(Cc2cccc(COC)c2)C1	ZINC001132003826	1375094907	/nfs/dbraw/zinc/09/49/07/1375094907.db2.gz	ZXYLOYZGUWLRCJ-XLIONFOSSA-N	0	3	342.483	3.106	20	30		EGEDHN
Cc1cc(C)cc(CN2C[C@H](NC(=O)C#CC(C)C)CC[C@@H]2C)c1	ZINC001132015929	1375099211	/nfs/dbraw/zinc/09/92/11/1375099211.db2.gz	BQZZWGZSEBPZTJ-AZUAARDMSA-N	0	3	326.484	3.432	20	30		EGEDHN
Cc1ccc(C)c(CN2C[C@@H](NC(=O)C#CC(C)C)CC[C@@H]2C)c1	ZINC001132017258	1375100684	/nfs/dbraw/zinc/10/06/84/1375100684.db2.gz	NJADDAFEQDMIKZ-ICSRJNTNSA-N	0	3	326.484	3.432	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1CC[C@H](C)N(Cc2cccc3cccnc32)C1	ZINC001132018843	1375101781	/nfs/dbraw/zinc/10/17/81/1375101781.db2.gz	ZENDJOYGQXTHJA-FXAWDEMLSA-N	0	3	349.478	3.363	20	30		EGEDHN
C#CCN1CCC(CNC(=O)[C@H](C)CCCc2ccccc2)CC1	ZINC001225604228	1375131450	/nfs/dbraw/zinc/13/14/50/1375131450.db2.gz	ZATYUABWBRGROE-GOSISDBHSA-N	0	3	326.484	3.107	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)COCCCCCCCC)CC[C@@H]1C	ZINC001132107037	1375151686	/nfs/dbraw/zinc/15/16/86/1375151686.db2.gz	XAWBIYRZSZQGNS-OALUTQOASA-N	0	3	336.520	3.356	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)CC(C)(C)CC(F)F)CC[C@H]1C	ZINC001132190692	1375197760	/nfs/dbraw/zinc/19/77/60/1375197760.db2.gz	MPDQGICMRXIOKF-CABCVRRESA-N	0	3	346.462	3.230	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1CC[C@H](C)N(CCc2cnn(CC)c2)C1	ZINC001132217900	1375216363	/nfs/dbraw/zinc/21/63/63/1375216363.db2.gz	IQMQLNJPTVBMJN-WMZOPIPTSA-N	0	3	346.519	3.017	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCNCc2cccc(C(F)(F)F)c2)cc1	ZINC001132227035	1375223619	/nfs/dbraw/zinc/22/36/19/1375223619.db2.gz	ZSONVQWQIHAHNK-UHFFFAOYSA-N	0	3	346.352	3.206	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)CCCc2ccccc2)CC[C@@H]1C	ZINC001132260732	1375251310	/nfs/dbraw/zinc/25/13/10/1375251310.db2.gz	HJRUZGXAKQVTCA-AZUAARDMSA-N	0	3	344.499	3.181	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)Cc2cc(C)ccc2C)CC[C@@H]1C	ZINC001132266255	1375255180	/nfs/dbraw/zinc/25/51/80/1375255180.db2.gz	WFGOABQUAUNDPW-ICSRJNTNSA-N	0	3	344.499	3.018	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1CCCC[C@H]1NCc1cncs1	ZINC001226434127	1375257397	/nfs/dbraw/zinc/25/73/97/1375257397.db2.gz	CPXICNIWCSEDLJ-IAGOWNOFSA-N	0	3	333.501	3.429	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC1CCN([C@@H](C)c2ccc(F)cc2)CC1	ZINC001226446897	1375260111	/nfs/dbraw/zinc/26/01/11/1375260111.db2.gz	HRNUDJGIZXEEQI-HOTGVXAUSA-N	0	3	348.462	3.449	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC1CCN(C/C=C\c2ccccc2)CC1	ZINC001226455263	1375262527	/nfs/dbraw/zinc/26/25/27/1375262527.db2.gz	DOABYYHCCMECAL-IBWPDUFMSA-N	0	3	342.483	3.262	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CC[C@H](C)N(CCOCC3CC3)C2)CC1	ZINC001132292758	1375273867	/nfs/dbraw/zinc/27/38/67/1375273867.db2.gz	UWSAPAPVTVIPBJ-LPHOPBHVSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCNCc1cnc(-c2ccccc2)s1	ZINC001132395433	1375350749	/nfs/dbraw/zinc/35/07/49/1375350749.db2.gz	AUYZQBGPBOLINY-UHFFFAOYSA-N	0	3	329.469	3.228	20	30		EGEDHN
C#CCCCCC(=O)NC1CCN(CC[C@@H]2CC2(Cl)Cl)CC1	ZINC001226951801	1375368116	/nfs/dbraw/zinc/36/81/16/1375368116.db2.gz	JASUOHVNKGWNPE-CQSZACIVSA-N	0	3	345.314	3.345	20	30		EGEDHN
C#CCCCCC(=O)NC1CCN(Cc2cccc(N(C)C)c2)CC1	ZINC001226952108	1375369201	/nfs/dbraw/zinc/36/92/01/1375369201.db2.gz	RQIHJDXSRALQCM-UHFFFAOYSA-N	0	3	341.499	3.027	20	30		EGEDHN
C=CCCCCCN1C[C@H](NC(=O)c2conc2COC)CC[C@@H]1C	ZINC001132420273	1375369121	/nfs/dbraw/zinc/36/91/21/1375369121.db2.gz	PUACLACVOZIZFZ-JKSUJKDBSA-N	0	3	349.475	3.150	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)[C@H]2CC[C@H](CC)CC2)CC[C@@H]1C	ZINC001132429819	1375377365	/nfs/dbraw/zinc/37/73/65/1375377365.db2.gz	PXAHXNOQIBLDAW-VJANTYMQSA-N	0	3	336.520	3.375	20	30		EGEDHN
CCCCCCCCCCC(=O)N[C@H]1CC[C@H](C)N(CCO)C1	ZINC001132435983	1375381363	/nfs/dbraw/zinc/38/13/63/1375381363.db2.gz	IJNMCQCVXVIZLU-ROUUACIJSA-N	0	3	326.525	3.479	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2cccc(Cl)c2)CC[C@H]1C	ZINC001132437495	1375382264	/nfs/dbraw/zinc/38/22/64/1375382264.db2.gz	VKQWIXYOJBTWLB-PBHICJAKSA-N	0	3	336.863	3.125	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2cc(C)cc(C)c2)CC[C@@H]1C	ZINC001132444594	1375388408	/nfs/dbraw/zinc/38/84/08/1375388408.db2.gz	CGXPGSACZYSHDG-HKUYNNGSSA-N	0	3	330.472	3.089	20	30		EGEDHN
C#CCCCC(=O)NC1CCN(CCOc2cc(C)cc(C)c2)CC1	ZINC001227107964	1375391181	/nfs/dbraw/zinc/39/11/81/1375391181.db2.gz	JOQGZKHKFGBPGZ-UHFFFAOYSA-N	0	3	342.483	3.066	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COc2cccc(Cl)c2)CC[C@@H]1C	ZINC001132468018	1375409824	/nfs/dbraw/zinc/40/98/24/1375409824.db2.gz	LIAHQHQVVVWAIK-HOCLYGCPSA-N	0	3	336.863	3.264	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2scc(C)c2Cl)CC1	ZINC001227496907	1375438570	/nfs/dbraw/zinc/43/85/70/1375438570.db2.gz	VURVVVRBPXPILJ-UHFFFAOYSA-N	0	3	342.892	3.107	20	30		EGEDHN
O=C(CCC(F)F)N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1	ZINC001227550772	1375442315	/nfs/dbraw/zinc/44/23/15/1375442315.db2.gz	OGMWGCAUMWAGHN-IAGOWNOFSA-N	0	3	334.410	3.100	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1CC[C@H](C)N(Cc2cccc(CC)c2)C1	ZINC001132529286	1375443170	/nfs/dbraw/zinc/44/31/70/1375443170.db2.gz	LAKXOXXFFFMKIH-PXNSSMCTSA-N	0	3	344.499	3.311	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)C2(CC=C)CCCC2)CC[C@@H]1C	ZINC001132547147	1375454355	/nfs/dbraw/zinc/45/43/55/1375454355.db2.gz	XRCNGVXDULIJFW-ROUUACIJSA-N	0	3	334.504	3.295	20	30		EGEDHN
C#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)/C=C(/C)CC)CC1	ZINC001132554505	1375460865	/nfs/dbraw/zinc/46/08/65/1375460865.db2.gz	HPAABAMEFSWLFX-TXSJJRPESA-N	0	3	339.483	3.254	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H](OCC)C1CCCC1	ZINC001227768884	1375473561	/nfs/dbraw/zinc/47/35/61/1375473561.db2.gz	UYKBXWHHBMLBOM-ZACQAIPSSA-N	0	3	342.911	3.351	20	30		EGEDHN
Cc1coc(C(=O)N[C@@H]2CCCC[C@H]2NCC#Cc2ccccc2)c1	ZINC001228079895	1375515854	/nfs/dbraw/zinc/51/58/54/1375515854.db2.gz	PBRJBOHIRFFENX-RTBURBONSA-N	0	3	336.435	3.270	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](C)[C@@H](CNCc2cc(C3CC3)no2)C1	ZINC001132700481	1375521443	/nfs/dbraw/zinc/52/14/43/1375521443.db2.gz	ILWJSWLYAUUHNL-ZBFHGGJFSA-N	0	3	331.460	3.092	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](C)[C@H](CNCc2ncc(C)s2)C1	ZINC001132761259	1375551285	/nfs/dbraw/zinc/55/12/85/1375551285.db2.gz	HPYZQPRGNJIRKJ-NVXWUHKLSA-N	0	3	347.528	3.219	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](C)[C@H](CNCc2csc(C)n2)C1	ZINC001132773707	1375555952	/nfs/dbraw/zinc/55/59/52/1375555952.db2.gz	OYDZAOHXCWGEIO-DOTOQJQBSA-N	0	3	347.528	3.219	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC1CCN(Cc2ccccc2N(C)C)CC1	ZINC001228579935	1375604193	/nfs/dbraw/zinc/60/41/93/1375604193.db2.gz	PETIOFHKMSHINU-UHFFFAOYSA-N	0	3	343.515	3.436	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](C)[C@H](CNCc2cc(C3CC3)no2)C1	ZINC001132866149	1375610275	/nfs/dbraw/zinc/61/02/75/1375610275.db2.gz	WNRVSYCDDWBRBH-NVXWUHKLSA-N	0	3	345.487	3.483	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](C)[C@H](CNCc2ocnc2C)C1	ZINC001133039052	1375729923	/nfs/dbraw/zinc/72/99/23/1375729923.db2.gz	KDRRFLHGQREEFR-FUHWJXTLSA-N	0	3	345.487	3.141	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](C)[C@@H](CNCc2cscn2)C1	ZINC001133039133	1375730545	/nfs/dbraw/zinc/73/05/45/1375730545.db2.gz	LNXAXQLADUSGKK-IRXDYDNUSA-N	0	3	347.528	3.301	20	30		EGEDHN
C[C@H]1CCN(C(=O)CCCF)C[C@H]1CNCc1cc(F)ccc1C#N	ZINC001133059296	1375750182	/nfs/dbraw/zinc/75/01/82/1375750182.db2.gz	OFLMIVFGXMUWQF-WMLDXEAASA-N	0	3	349.425	3.021	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](C)[C@@H](CNCc2nc(C)cs2)C1	ZINC001133069895	1375756859	/nfs/dbraw/zinc/75/68/59/1375756859.db2.gz	YYXPYLQTMDOOJT-RDJZCZTQSA-N	0	3	347.528	3.219	20	30		EGEDHN
C=C1CC(C)(C(=O)NC2CCN(CCOCc3ccccc3)CC2)C1	ZINC001229093075	1375762928	/nfs/dbraw/zinc/76/29/28/1375762928.db2.gz	FPIOGXXKBXUJJY-UHFFFAOYSA-N	0	3	342.483	3.140	20	30		EGEDHN
N/N=C/c1ccccc1O[C@H]1[C@@H]2CC[C@H]1CN(Cc1ccccc1)C2	ZINC001229293552	1375804942	/nfs/dbraw/zinc/80/49/42/1375804942.db2.gz	QMBBJPPAGSRGSM-NITNEJBUSA-N	0	3	335.451	3.269	20	30		EGEDHN
C[C@H](C(=O)NCCNCc1cccc(C#N)c1)c1ccc(Cl)cc1	ZINC001133244740	1375865233	/nfs/dbraw/zinc/86/52/33/1375865233.db2.gz	NBRVWNLIGJBUMJ-AWEZNQCLSA-N	0	3	341.842	3.221	20	30		EGEDHN
C[C@H](C#N)C(=O)N(CCNC/C=C\Cl)Cc1cccc(Cl)c1	ZINC001133392638	1375976506	/nfs/dbraw/zinc/97/65/06/1375976506.db2.gz	HCLIITHSQGEMGY-ACVFHECNSA-N	0	3	340.254	3.170	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C1CC(C)(C)C1	ZINC001133396032	1375980087	/nfs/dbraw/zinc/98/00/87/1375980087.db2.gz	NRPHNKBDTAGUJW-UHFFFAOYSA-N	0	3	332.875	3.328	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C1(CC#C)CCC1	ZINC001133398055	1375981758	/nfs/dbraw/zinc/98/17/58/1375981758.db2.gz	AZRDWQPESHCQDB-UHFFFAOYSA-N	0	3	342.870	3.085	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)CCC(C)(F)F	ZINC001133399602	1375983479	/nfs/dbraw/zinc/98/34/79/1375983479.db2.gz	TVAIWKMMRWADIH-UHFFFAOYSA-N	0	3	342.817	3.327	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@]1(C)C[C@H]2C[C@H]2C1	ZINC001133399916	1375984656	/nfs/dbraw/zinc/98/46/56/1375984656.db2.gz	YYNWIUUUPSLDPB-XEMDLRDOSA-N	0	3	344.886	3.328	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H]1C[C@H]1CC	ZINC001133405918	1375991587	/nfs/dbraw/zinc/99/15/87/1375991587.db2.gz	XDGJFNJZTMPIKK-SJLPKXTDSA-N	0	3	332.875	3.328	20	30		EGEDHN
C=CCCOCC(=O)NC1CCN(Cc2cc3ccccc3o2)CC1	ZINC001230411352	1376022590	/nfs/dbraw/zinc/02/25/90/1376022590.db2.gz	HHGOUSVYPUDKDJ-UHFFFAOYSA-N	0	3	342.439	3.106	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NC1CCN([C@H](CC)c2ccc(F)cc2)CC1	ZINC001230415148	1376023621	/nfs/dbraw/zinc/02/36/21/1376023621.db2.gz	LLVJSBLVBFWXNM-DNVCBOLYSA-N	0	3	348.462	3.449	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1C1CCN(C(=O)CCCOCC)CC1	ZINC001230522953	1376054708	/nfs/dbraw/zinc/05/47/08/1376054708.db2.gz	WVDZKIVNRIHWBD-QGZVFWFLSA-N	0	3	342.911	3.259	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)c1ccccc1F	ZINC001133523907	1376058345	/nfs/dbraw/zinc/05/83/45/1376058345.db2.gz	AYBYJWHDYXMPEW-NWDGAFQWSA-N	0	3	343.240	3.221	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1ccccc1C#N)NC(=O)c1ccccc1F	ZINC001133525701	1376061461	/nfs/dbraw/zinc/06/14/61/1376061461.db2.gz	OXCOTEOVRPCBJG-LSDHHAIUSA-N	0	3	339.414	3.384	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1C1CCN(C(=O)COCCCC)CC1	ZINC001230542013	1376064810	/nfs/dbraw/zinc/06/48/10/1376064810.db2.gz	SJHWVCJGPGJQGH-QGZVFWFLSA-N	0	3	342.911	3.259	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)c1ccccc1C	ZINC001133554274	1376082417	/nfs/dbraw/zinc/08/24/17/1376082417.db2.gz	AAWUVTGAAPTFES-KGLIPLIRSA-N	0	3	339.277	3.390	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)CCC(F)F)Cc1cccnc1	ZINC001230800921	1376152531	/nfs/dbraw/zinc/15/25/31/1376152531.db2.gz	VCMCJQLRHCHWGM-UHFFFAOYSA-N	0	3	325.403	3.011	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)CCCOC(C)C)Cc1cccnc1	ZINC001230939579	1376183314	/nfs/dbraw/zinc/18/33/14/1376183314.db2.gz	GELUHHTTXZQSGV-UHFFFAOYSA-N	0	3	347.503	3.171	20	30		EGEDHN
C=CCCC(=O)N[C@H](C)C[C@@H](C)NCc1ccn(-c2ccccc2)n1	ZINC001133884156	1376249691	/nfs/dbraw/zinc/24/96/91/1376249691.db2.gz	LZUOORPSRWWOBK-IAGOWNOFSA-N	0	3	340.471	3.211	20	30		EGEDHN
C=CCCC(=O)N[C@@H](C)C[C@H](C)NCc1ccn(-c2ccccc2)n1	ZINC001133884157	1376249819	/nfs/dbraw/zinc/24/98/19/1376249819.db2.gz	LZUOORPSRWWOBK-IRXDYDNUSA-N	0	3	340.471	3.211	20	30		EGEDHN
C=CCCC(=O)N[C@H](C)C[C@@H](C)NCc1ccn(C2CCCC2)n1	ZINC001133888015	1376251578	/nfs/dbraw/zinc/25/15/78/1376251578.db2.gz	FDJIXHHLGVOZNR-HZPDHXFCSA-N	0	3	332.492	3.337	20	30		EGEDHN
Cc1cc(C)c(C(=O)N[C@@H](C)C[C@@H](C)NCc2ccccc2C#N)o1	ZINC001134041809	1376327237	/nfs/dbraw/zinc/32/72/37/1376327237.db2.gz	JHDIFMIVAZMWGT-CABCVRRESA-N	0	3	339.439	3.455	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H](C)C[C@@H](C)NCc2ccccc2C#N)oc1C	ZINC001134089307	1376362241	/nfs/dbraw/zinc/36/22/41/1376362241.db2.gz	DGTWILREOGSIQZ-CABCVRRESA-N	0	3	339.439	3.455	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)c1cc(C)c(C)o1	ZINC001134110419	1376372668	/nfs/dbraw/zinc/37/26/68/1376372668.db2.gz	VZELJYOBPHQHGI-NWDGAFQWSA-N	0	3	343.265	3.292	20	30		EGEDHN
Cc1ccc(C(=O)NCCNCc2ccc(F)c(C#N)c2)c(Cl)c1	ZINC001134171281	1376398697	/nfs/dbraw/zinc/39/86/97/1376398697.db2.gz	ORRYTEKGRMJBCH-UHFFFAOYSA-N	0	3	345.805	3.179	20	30		EGEDHN
C[C@H](CC(=O)NCCNCc1ccc(C#N)c(F)c1)CC(C)(C)C	ZINC001134258190	1376441900	/nfs/dbraw/zinc/44/19/00/1376441900.db2.gz	CSOQOOLSLPLWHJ-CQSZACIVSA-N	0	3	333.451	3.366	20	30		EGEDHN
CCc1[nH]ccc1C(=O)N[C@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001134264464	1376444673	/nfs/dbraw/zinc/44/46/73/1376444673.db2.gz	ALUDMJUVRXRFNK-LSDHHAIUSA-N	0	3	338.455	3.135	20	30		EGEDHN
CC/C(C)=C\C(=O)N[C@H](C)C[C@H](C)NCc1cc(F)ccc1C#N	ZINC001134285408	1376458789	/nfs/dbraw/zinc/45/87/89/1376458789.db2.gz	RPJVZJDPUDFBJC-QUWCCNNGSA-N	0	3	331.435	3.427	20	30		EGEDHN
Cc1ncc(CN2CCC(Oc3ccc(C#N)c(Cl)c3)CC2)[nH]1	ZINC001232464369	1376463116	/nfs/dbraw/zinc/46/31/16/1376463116.db2.gz	AFXVUNIKYGJRFE-UHFFFAOYSA-N	0	3	330.819	3.287	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H](C)C[C@@H](C)NCc1nccn1C(F)F	ZINC001134470026	1376554836	/nfs/dbraw/zinc/55/48/36/1376554836.db2.gz	LJAIIVZBKXVEQV-OLZOCXBDSA-N	0	3	328.407	3.007	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)C1C=CC=CC=C1	ZINC001134476546	1376559602	/nfs/dbraw/zinc/55/96/02/1376559602.db2.gz	UAKDNVFDTYCKAM-KGLIPLIRSA-N	0	3	339.277	3.066	20	30		EGEDHN
C=CCO[C@@H]1CO[C@@]2(C1)CCCN(Cc1ccc(C#N)cc1C)C2	ZINC001233081198	1376565998	/nfs/dbraw/zinc/56/59/98/1376565998.db2.gz	SIAFSAXBTOHHGN-VQTJNVASSA-N	0	3	326.440	3.193	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCC2(CC1)c1cccc(F)c1NC2=O	ZINC001233081121	1376566469	/nfs/dbraw/zinc/56/64/69/1376566469.db2.gz	OXUNUHIMNQYRIE-UHFFFAOYSA-N	0	3	349.409	3.492	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2nc(C)c(C)s2)CCC1	ZINC001134587695	1376610435	/nfs/dbraw/zinc/61/04/35/1376610435.db2.gz	GDZBRYMHDUNTMU-KBPBESRZSA-N	0	3	347.528	3.326	20	30		EGEDHN
N#Cc1ccc(C[N@@H+]2CC[C@]3(CCN(Cc4ccccc4)C3)C2)c([O-])c1	ZINC001233387019	1376634332	/nfs/dbraw/zinc/63/43/32/1376634332.db2.gz	QQNHDPLHYQJOCM-QFIPXVFZSA-N	0	3	347.462	3.362	20	30		EGEDHN
N#Cc1ccc(C[N@H+]2CC[C@]3(CCN(Cc4ccccc4)C3)C2)c([O-])c1	ZINC001233387019	1376634335	/nfs/dbraw/zinc/63/43/35/1376634335.db2.gz	QQNHDPLHYQJOCM-QFIPXVFZSA-N	0	3	347.462	3.362	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1ccccc1C#N)NC(=O)Cc1ccccc1	ZINC001134747274	1376697066	/nfs/dbraw/zinc/69/70/66/1376697066.db2.gz	CLLHQGBENZKUHK-DLBZAZTESA-N	0	3	335.451	3.174	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)CCOc1cccc(C)c1C	ZINC001235035953	1376835049	/nfs/dbraw/zinc/83/50/49/1376835049.db2.gz	IEFLKJOYTIGMHD-GOSISDBHSA-N	0	3	330.472	3.181	20	30		EGEDHN
C=CCCCN1CC[C@H]1CN(C)C(=O)c1ccc(-c2ccncc2)o1	ZINC001235304222	1376866260	/nfs/dbraw/zinc/86/62/60/1376866260.db2.gz	PKINWRDKBYMEMF-KRWDZBQOSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=CCC[C@H](C)N1CC[C@H]1CN(C)C(=O)c1cc(C(F)(F)F)no1	ZINC001235632311	1376878986	/nfs/dbraw/zinc/87/89/86/1376878986.db2.gz	FXVVXPXGIFJYIM-RYUDHWBXSA-N	0	3	345.365	3.194	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)C1(CCF)CC1)NCc1ccccc1C#N	ZINC001135081471	1376885089	/nfs/dbraw/zinc/88/50/89/1376885089.db2.gz	MVHCTCTYSAKTQN-GJZGRUSLSA-N	0	3	331.435	3.071	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H](C)C[C@@H](C)NCc1ccn(C(C)C)n1	ZINC001135194368	1376965331	/nfs/dbraw/zinc/96/53/31/1376965331.db2.gz	UHOZTOZXHOWBRG-QZTJIDSGSA-N	0	3	346.519	3.421	20	30		EGEDHN
CC(C)N1CCC2(CCN(Cc3ccc(C#N)cc3Cl)CC2)C1=O	ZINC001238084363	1376994363	/nfs/dbraw/zinc/99/43/63/1376994363.db2.gz	HTHQYQKYVMNYRJ-UHFFFAOYSA-N	0	3	345.874	3.435	20	30		EGEDHN
Cc1ccc(O)c(-c2nccnc2C(C#N)C(=O)OC(C)(C)C)c1	ZINC001244403713	1377036958	/nfs/dbraw/zinc/03/69/58/1377036958.db2.gz	ZCELDHKILXOMKT-CYBMUJFWSA-N	0	3	325.368	3.107	20	30		EGEDHN
C=CCCCC(=O)N[C@@H](C)C[C@H](C)NCc1nccn1C(F)F	ZINC001135353205	1377049210	/nfs/dbraw/zinc/04/92/10/1377049210.db2.gz	DDIJYQWNNYOOSY-STQMWFEESA-N	0	3	328.407	3.007	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)C1(CF)CCC1)NCc1cc(F)ccc1C#N	ZINC001135501464	1377120907	/nfs/dbraw/zinc/12/09/07/1377120907.db2.gz	POWCGEDIIFWKRT-KBPBESRZSA-N	0	3	349.425	3.210	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H](C)C[C@@H](C)NCc1cc2n(n1)CCCC2	ZINC001135565112	1377147648	/nfs/dbraw/zinc/14/76/48/1377147648.db2.gz	PKVXJIBYNBPKBE-HZPDHXFCSA-N	0	3	346.519	3.195	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)[C@H](CC)CC(C)C)C1	ZINC001266630164	1377352266	/nfs/dbraw/zinc/35/22/66/1377352266.db2.gz	GHNYJAJICWYPAU-MGPQQGTHSA-N	0	3	331.298	3.204	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CC[C@@H](N(C)Cc2csc(C)c2)C1	ZINC001189241571	1388493774	/nfs/dbraw/zinc/49/37/74/1388493774.db2.gz	AMNWWACSCBFPPR-DOTOQJQBSA-N	0	3	336.501	3.070	20	30		EGEDHN
N#CCOc1ccc(CN(Cc2cccnc2)C2CCOCC2)cc1	ZINC001137119296	1377481475	/nfs/dbraw/zinc/48/14/75/1377481475.db2.gz	DRKBMECCJHVYCY-UHFFFAOYSA-N	0	3	337.423	3.165	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@H]1CCN(Cc1n[nH]c3ccccc31)C2	ZINC001137346395	1377527790	/nfs/dbraw/zinc/52/77/90/1377527790.db2.gz	VTWIPKWOGKXJMX-VQTJNVASSA-N	0	3	341.455	3.137	20	30		EGEDHN
N#Cc1ccccc1OC1CCN(Cc2c[nH]c3ncccc23)CC1	ZINC001137404414	1377541319	/nfs/dbraw/zinc/54/13/19/1377541319.db2.gz	IPSOSLRKBWBPLH-UHFFFAOYSA-N	0	3	332.407	3.478	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3ccc(C)c(F)c3F)C2)C1=O	ZINC001137965746	1377654486	/nfs/dbraw/zinc/65/44/86/1377654486.db2.gz	ANIFRDXEMRGBHI-IBGZPJMESA-N	0	3	334.410	3.274	20	30		EGEDHN
C#CCOc1ccc(CN2CCC(C(=O)OCC)(C(C)C)CC2)cc1	ZINC001138560148	1377741909	/nfs/dbraw/zinc/74/19/09/1377741909.db2.gz	IZBPDTKUKQLHFO-UHFFFAOYSA-N	0	3	343.467	3.500	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@H]3OCCC[C@]3(COC)C2)c1[O-]	ZINC001138627805	1377756557	/nfs/dbraw/zinc/75/65/57/1377756557.db2.gz	PDVHTGLXIRRLMN-UYAOXDASSA-N	0	3	331.456	3.138	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@H]3OCCC[C@]3(COC)C2)c1[O-]	ZINC001138627805	1377756558	/nfs/dbraw/zinc/75/65/58/1377756558.db2.gz	PDVHTGLXIRRLMN-UYAOXDASSA-N	0	3	331.456	3.138	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CCC(c3noc(CC)n3)CC2)c1[O-]	ZINC001138629487	1377756823	/nfs/dbraw/zinc/75/68/23/1377756823.db2.gz	ANTNOZGDKBOPCW-UHFFFAOYSA-N	0	3	327.428	3.446	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@H](Oc3ncncc3C)C2)c1[O-]	ZINC001138631095	1377758338	/nfs/dbraw/zinc/75/83/38/1377758338.db2.gz	KPBICMJMORYJFC-SFHVURJKSA-N	0	3	339.439	3.263	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@H](Oc3ncncc3C)C2)c1[O-]	ZINC001138631095	1377758340	/nfs/dbraw/zinc/75/83/40/1377758340.db2.gz	KPBICMJMORYJFC-SFHVURJKSA-N	0	3	339.439	3.263	20	30		EGEDHN
C=C(C)COc1ccccc1CN1CCC2(CCN(C)C2=O)CC1	ZINC001138666030	1377765121	/nfs/dbraw/zinc/76/51/21/1377765121.db2.gz	FZOPSAOZYPZKSW-UHFFFAOYSA-N	0	3	328.456	3.086	20	30		EGEDHN
CCOc1ccc(CN2CCC3SC(=O)C=C3C2)cc1OCC	ZINC001138972695	1377811281	/nfs/dbraw/zinc/81/12/81/1377811281.db2.gz	WYFLBTVPOJEIQR-QGZVFWFLSA-N	0	3	333.453	3.258	20	30		EGEDHN
N#Cc1cccc(N2CCN(Cc3ccc(-n4ccnc4)cc3)CC2)c1	ZINC001139360850	1377874218	/nfs/dbraw/zinc/87/42/18/1377874218.db2.gz	IPKNKNNITANWHB-UHFFFAOYSA-N	0	3	343.434	3.066	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CC2)C(=O)Nc2ccccc23)cc1F	ZINC001139526958	1377897221	/nfs/dbraw/zinc/89/72/21/1377897221.db2.gz	QBZWFQREPHVYQW-UHFFFAOYSA-N	0	3	335.382	3.183	20	30		EGEDHN
CC(=O)N1CCCC[C@@]12CCCN(Cc1ccc(C)c(C#N)c1)C2	ZINC001139724364	1377941616	/nfs/dbraw/zinc/94/16/16/1377941616.db2.gz	QAFXASYBASTXFY-FQEVSTJZSA-N	0	3	325.456	3.234	20	30		EGEDHN
C=CCn1cc(CN2CCC(COc3ccc(F)cc3)CC2)cn1	ZINC001139771409	1377949409	/nfs/dbraw/zinc/94/94/09/1377949409.db2.gz	ZIKDPSSLROQIQY-UHFFFAOYSA-N	0	3	329.419	3.499	20	30		EGEDHN
CC(C)(C)OC(=O)[C@@H]1CCN(Cc2c[nH]c3ccc(C#N)cc23)C1	ZINC001140114422	1378010497	/nfs/dbraw/zinc/01/04/97/1378010497.db2.gz	OZNBOLRIANGULB-CQSZACIVSA-N	0	3	325.412	3.203	20	30		EGEDHN
CC(C)CC(=O)NC1CCN(Cc2c[nH]c3ccc(C#N)cc23)CC1	ZINC001140113767	1378010868	/nfs/dbraw/zinc/01/08/68/1378010868.db2.gz	CPOQZKWTOFSQLA-UHFFFAOYSA-N	0	3	338.455	3.166	20	30		EGEDHN
C=CCO[C@H]1CO[C@@]2(C1)CCCN(Cc1ccc(C)c(OC)c1)C2	ZINC001140157985	1378023062	/nfs/dbraw/zinc/02/30/62/1378023062.db2.gz	ANUSHJVBGVCASG-UYAOXDASSA-N	0	3	331.456	3.330	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@H]1CCN(Cc1cc(F)cc(OC)c1)C2	ZINC001140480615	1378069935	/nfs/dbraw/zinc/06/99/35/1378069935.db2.gz	OPSUHHIYQYNFRH-VQTJNVASSA-N	0	3	349.446	3.408	20	30		EGEDHN
N#Cc1ccc(CN2CCN([C@H]3CCCc4ccccc43)CC2)cn1	ZINC001140545770	1378082868	/nfs/dbraw/zinc/08/28/68/1378082868.db2.gz	KGPQRGVKFVXVLB-NRFANRHFSA-N	0	3	332.451	3.148	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3ccc4c(c3)CCO4)CC2)C1=O	ZINC001273008275	1378084995	/nfs/dbraw/zinc/08/49/95/1378084995.db2.gz	IUPMESGPLNCRMF-OAQYLSRUSA-N	0	3	340.467	3.012	20	30		EGEDHN
N#CCCCN1C[C@]2(CC1=O)CCCCN2CCc1ccccc1F	ZINC001273041091	1378085397	/nfs/dbraw/zinc/08/53/97/1378085397.db2.gz	NKSFQPKDUDOZLT-HXUWFJFHSA-N	0	3	343.446	3.129	20	30		EGEDHN
C=CCN1CC[C@@]2(CCC[N@H+]2Cc2c([O-])ccc3ccccc32)C1=O	ZINC001273769015	1378110292	/nfs/dbraw/zinc/11/02/92/1378110292.db2.gz	DULQRONOMXQDJN-NRFANRHFSA-N	0	3	336.435	3.298	20	30		EGEDHN
C=CCN1CC[C@@]2(CCC[N@@H+]2Cc2c([O-])ccc3ccccc32)C1=O	ZINC001273769015	1378110293	/nfs/dbraw/zinc/11/02/93/1378110293.db2.gz	DULQRONOMXQDJN-NRFANRHFSA-N	0	3	336.435	3.298	20	30		EGEDHN
C[C@@H](CCNC(=O)C1CCCCC1)NCc1cc(C#N)ccc1F	ZINC001274669553	1378132369	/nfs/dbraw/zinc/13/23/69/1378132369.db2.gz	DMHLQOURAMOLOB-AWEZNQCLSA-N	0	3	331.435	3.262	20	30		EGEDHN
COc1ccc(CN2CCC[C@@H](Oc3cccc(C#N)c3)C2)cc1N	ZINC001140898406	1378174719	/nfs/dbraw/zinc/17/47/19/1378174719.db2.gz	LWMXSVTVEDCHLI-GOSISDBHSA-N	0	3	337.423	3.192	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@]3(CC[N@@H+](C4CCCC4)C3)C2)c([O-])c1	ZINC001276494229	1378176300	/nfs/dbraw/zinc/17/63/00/1378176300.db2.gz	QREIVUAZOLRKDZ-OAQYLSRUSA-N	0	3	339.483	3.494	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@]3(CC[N@H+](C4CCCC4)C3)C2)c([O-])c1	ZINC001276494229	1378176303	/nfs/dbraw/zinc/17/63/03/1378176303.db2.gz	QREIVUAZOLRKDZ-OAQYLSRUSA-N	0	3	339.483	3.494	20	30		EGEDHN
C=CCN1C(=O)CC[C@@]12CCC[N@@H+](Cc1ccc(C)cc1[O-])CC2	ZINC001140949438	1378190180	/nfs/dbraw/zinc/19/01/80/1378190180.db2.gz	BPVXHBSIVDTMKM-HXUWFJFHSA-N	0	3	328.456	3.234	20	30		EGEDHN
C=CCN1C(=O)CC[C@@]12CCC[N@H+](Cc1ccc(C)cc1[O-])CC2	ZINC001140949438	1378190185	/nfs/dbraw/zinc/19/01/85/1378190185.db2.gz	BPVXHBSIVDTMKM-HXUWFJFHSA-N	0	3	328.456	3.234	20	30		EGEDHN
N#Cc1cccc(O[C@@H]2CCCN(Cc3ccc4nccn4c3)C2)c1	ZINC001143027784	1378528822	/nfs/dbraw/zinc/52/88/22/1378528822.db2.gz	RWDSBIXKBYCAFH-LJQANCHMSA-N	0	3	332.407	3.249	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@H](NCc1sccc1Cl)C(C)C	ZINC001753830889	1440499607	/nfs/dbraw/zinc/49/96/07/1440499607.db2.gz	ZHJBSTNDFQIJKO-AWEZNQCLSA-N	0	3	326.893	3.291	20	30		EGEDHN
C#Cc1ccc(CN2CC[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]32)cc1	ZINC001144568330	1378746150	/nfs/dbraw/zinc/74/61/50/1378746150.db2.gz	QXZJOZVBMPJLHL-ZWKOTPCHSA-N	0	3	326.440	3.109	20	30		EGEDHN
C#Cc1ccc(CN2CCC(NC(=O)c3cccc(F)c3)CC2)cc1	ZINC001144578723	1378747553	/nfs/dbraw/zinc/74/75/53/1378747553.db2.gz	KVHLMTYDIRZUQF-UHFFFAOYSA-N	0	3	336.410	3.201	20	30		EGEDHN
C#Cc1ccc(CN2CCC(N(C)C(=O)c3ccccc3)CC2)cc1	ZINC001144580491	1378747817	/nfs/dbraw/zinc/74/78/17/1378747817.db2.gz	DMNZKHIDCHHNNX-UHFFFAOYSA-N	0	3	332.447	3.405	20	30		EGEDHN
C#Cc1ccc(CN2CCC(N3Cc4ccccc4C3=O)CC2)cc1	ZINC001144581518	1378747938	/nfs/dbraw/zinc/74/79/38/1378747938.db2.gz	ULFVNXXOLPQRMP-UHFFFAOYSA-N	0	3	330.431	3.288	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2cnns2)CCCC1	ZINC001146822348	1378928771	/nfs/dbraw/zinc/92/87/71/1378928771.db2.gz	QJHDRLMRIGCQIS-ZIAGYGMSSA-N	0	3	336.505	3.048	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2cc(C)no2)CCCC1	ZINC001146830962	1378931486	/nfs/dbraw/zinc/93/14/86/1378931486.db2.gz	PHBOBKMJJOEZGN-CABCVRRESA-N	0	3	333.476	3.492	20	30		EGEDHN
CCc1ccc(C(C)(C)C(=O)NCCNCc2ccc(C#N)cc2)cc1	ZINC001147114487	1378972426	/nfs/dbraw/zinc/97/24/26/1378972426.db2.gz	PISZNIIPOPZNOC-UHFFFAOYSA-N	0	3	349.478	3.304	20	30		EGEDHN
CC(C)(C)/C=C\C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001147239898	1378993526	/nfs/dbraw/zinc/99/35/26/1378993526.db2.gz	FOUMSGSZXBBFTG-HJWRWDBZSA-N	0	3	337.467	3.195	20	30		EGEDHN
C#CCCCCC(=O)N1CC2(C1)CCN(Cc1cc(F)ccc1C)C2	ZINC001147374934	1379010908	/nfs/dbraw/zinc/01/09/08/1379010908.db2.gz	WSLIWAQAKISMRD-UHFFFAOYSA-N	0	3	342.458	3.362	20	30		EGEDHN
CCC(C)(C)CC(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001147616680	1379050806	/nfs/dbraw/zinc/05/08/06/1379050806.db2.gz	NPYODJKJECIWRG-UHFFFAOYSA-N	0	3	339.483	3.419	20	30		EGEDHN
C#CCC1(C(=O)N2CC3(C2)CCN(Cc2csc(C)c2)C3)CCC1	ZINC001147710920	1379063377	/nfs/dbraw/zinc/06/33/77/1379063377.db2.gz	BECMSQYGKOUAHM-UHFFFAOYSA-N	0	3	342.508	3.284	20	30		EGEDHN
CC(C)(C)CCC(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001148471824	1379179125	/nfs/dbraw/zinc/17/91/25/1379179125.db2.gz	SIBVNTRDINMFQI-UHFFFAOYSA-N	0	3	339.483	3.419	20	30		EGEDHN
CCCCCCCCC(=O)NCCNCC(=O)N(C(C)C)C(C)C	ZINC001148727489	1379253939	/nfs/dbraw/zinc/25/39/39/1379253939.db2.gz	AJBCIONQCNAQJY-UHFFFAOYSA-N	0	3	341.540	3.088	20	30		EGEDHN
Cc1ccccc1C1(C(=O)NCCNCc2ccc(C#N)cc2)CCC1	ZINC001149260378	1379355802	/nfs/dbraw/zinc/35/58/02/1379355802.db2.gz	WMCLAWVLWOBLHW-UHFFFAOYSA-N	0	3	347.462	3.194	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cccc3ccccc32)cc1	ZINC001149718024	1379436163	/nfs/dbraw/zinc/43/61/63/1379436163.db2.gz	ZTOYTKWRNIRYDZ-UHFFFAOYSA-N	0	3	329.403	3.231	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@H]1CN(Cc2ccccc2CC)CCCO1	ZINC001150085634	1379492112	/nfs/dbraw/zinc/49/21/12/1379492112.db2.gz	RMIFNQQZVDOVTI-IBGZPJMESA-N	0	3	344.499	3.168	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@@H]1CN(Cc2ccccc2C)CCCO1	ZINC001150141279	1379501257	/nfs/dbraw/zinc/50/12/57/1379501257.db2.gz	ZEBHSXYEUWHEAA-AZUAARDMSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@H]1CN(CC2=CCCCC2)CCCO1	ZINC001150159589	1379505358	/nfs/dbraw/zinc/50/53/58/1379505358.db2.gz	KUVKMTATPZMYFR-MJGOQNOKSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@@H]1CN(Cc2cccc(C)c2)CCCO1	ZINC001150246615	1379521856	/nfs/dbraw/zinc/52/18/56/1379521856.db2.gz	GMRZQQUYCQQYOL-CTNGQTDRSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@H]1CN(Cc2ccc(C)cc2)CCCO1	ZINC001150253699	1379522577	/nfs/dbraw/zinc/52/25/77/1379522577.db2.gz	FREBXONIGBONQC-PZJWPPBQSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@H]2CN(Cc3cccc(C)c3)CCCO2)C1	ZINC001150281909	1379527631	/nfs/dbraw/zinc/52/76/31/1379527631.db2.gz	FLGRBOWHKBDGDJ-IBGZPJMESA-N	0	3	342.483	3.058	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)[C@@H](c2ccccc2)C(C)C)C1	ZINC001150380037	1379542041	/nfs/dbraw/zinc/54/20/41/1379542041.db2.gz	OLXGYYYJSJDWKT-VQTJNVASSA-N	0	3	344.499	3.209	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)C[C@@H](C)c2ccc(F)cc2)C1	ZINC001150754399	1379608031	/nfs/dbraw/zinc/60/80/31/1379608031.db2.gz	ZOOUEOUQFDIGOQ-VQIMIIECSA-N	0	3	348.462	3.103	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)C=C2CCCCC2)CC1	ZINC001151006735	1379646784	/nfs/dbraw/zinc/64/67/84/1379646784.db2.gz	ANGRAHGVYKFKMG-UHFFFAOYSA-N	0	3	334.504	3.440	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2sccc2F)CC1	ZINC001151095941	1379661224	/nfs/dbraw/zinc/66/12/24/1379661224.db2.gz	QAIILIAEMKMOLN-UHFFFAOYSA-N	0	3	340.464	3.064	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2cccc(F)c2C)CC1	ZINC001151138225	1379666559	/nfs/dbraw/zinc/66/65/59/1379666559.db2.gz	VNMYPUAPEMYHAU-UHFFFAOYSA-N	0	3	348.462	3.311	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@@H]2CCCC2(C)C)CC1	ZINC001151249012	1379687062	/nfs/dbraw/zinc/68/70/62/1379687062.db2.gz	WWNWPUZUAKNZPX-KRWDZBQOSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@@H](C)c2cccc(C)c2)CC1	ZINC001151340047	1379701383	/nfs/dbraw/zinc/70/13/83/1379701383.db2.gz	OZELMDNZLYDLPH-SFHVURJKSA-N	0	3	344.499	3.272	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2cc3[nH]ccc3s2)CC1	ZINC001151406309	1379712533	/nfs/dbraw/zinc/71/25/33/1379712533.db2.gz	BCGDBIQDKLMOKR-UHFFFAOYSA-N	0	3	347.484	3.016	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2cccc(C3CC3)c2)CC1	ZINC001151412463	1379714305	/nfs/dbraw/zinc/71/43/05/1379714305.db2.gz	FTJIOSNTMLRKOJ-UHFFFAOYSA-N	0	3	342.483	3.351	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)CCC(C)C	ZINC001151766938	1379775921	/nfs/dbraw/zinc/77/59/21/1379775921.db2.gz	RRSICLKCGVNQCL-OAHLLOKOSA-N	0	3	333.451	3.460	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc(C3CC3)cc2)cc1F	ZINC001151898457	1379812425	/nfs/dbraw/zinc/81/24/25/1379812425.db2.gz	AAGXVCQJHBFRNQ-UHFFFAOYSA-N	0	3	337.398	3.094	20	30		EGEDHN
C#CCN1CCC(C)(CNC(=O)c2ccsc2C(F)F)CC1	ZINC001754721289	1440673343	/nfs/dbraw/zinc/67/33/43/1440673343.db2.gz	IQOZTGVBHZZEEN-UHFFFAOYSA-N	0	3	326.412	3.151	20	30		EGEDHN
Cc1cccc2cc(C(=O)NCCNCc3cccc(C#N)c3)oc21	ZINC001152640204	1379960840	/nfs/dbraw/zinc/96/08/40/1379960840.db2.gz	YUOITGQUAHBYPD-UHFFFAOYSA-N	0	3	333.391	3.133	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H](C)N(CC)Cc1ccc(F)c(C#N)c1	ZINC001152867433	1379988083	/nfs/dbraw/zinc/98/80/83/1379988083.db2.gz	RZIZBGDBPPBTGJ-MRXNPFEDSA-N	0	3	343.446	3.218	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H](C)N(CC)C[C@@H](OC)c1ccccc1	ZINC001152873704	1379989048	/nfs/dbraw/zinc/98/90/48/1379989048.db2.gz	ROLLMMLETBFNRC-UYAOXDASSA-N	0	3	344.499	3.394	20	30		EGEDHN
CCC[C@@H](CC(C)C)C(=O)NCCNCc1ccc(OC)c(C#N)c1	ZINC001152876494	1379989867	/nfs/dbraw/zinc/98/98/67/1379989867.db2.gz	KKONSEKHYVNPFQ-KRWDZBQOSA-N	0	3	345.487	3.235	20	30		EGEDHN
CCN(Cc1ccc(Cl)c(F)c1)[C@H](C)CNC(=O)C#CC1CC1	ZINC001153232383	1380040919	/nfs/dbraw/zinc/04/09/19/1380040919.db2.gz	CXBPSSLKTXWDOA-CYBMUJFWSA-N	0	3	336.838	3.219	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)C(C)=C1CCC1	ZINC001153240961	1380042569	/nfs/dbraw/zinc/04/25/69/1380042569.db2.gz	NDXJYKOOPKXHMZ-OAHLLOKOSA-N	0	3	325.456	3.385	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@@H](C)N(CC)CCc1csc(C)n1	ZINC001153608782	1380102588	/nfs/dbraw/zinc/10/25/88/1380102588.db2.gz	PPLZDDIGFSCRMO-CQSZACIVSA-N	0	3	337.533	3.423	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H](C)N(CC)Cc1ccc2c(c1)OCCO2	ZINC001153625744	1380106797	/nfs/dbraw/zinc/10/67/97/1380106797.db2.gz	HCMQPPJYYPYNSF-MRXNPFEDSA-N	0	3	346.471	3.141	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)C1(C2CC2)CC1	ZINC001153952431	1380161263	/nfs/dbraw/zinc/16/12/63/1380161263.db2.gz	ILSMTGHVUFOBFR-OAHLLOKOSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC(F)(F)c1ccc(C(=O)NCCNCc2cccc(C#N)c2)cc1	ZINC001153960721	1380162843	/nfs/dbraw/zinc/16/28/43/1380162843.db2.gz	VZMWBPQHSNVEGR-UHFFFAOYSA-N	0	3	343.377	3.190	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)[C@H](C)C1CCC1	ZINC001153985567	1380169619	/nfs/dbraw/zinc/16/96/19/1380169619.db2.gz	FPLCREZCXDYIHG-HZPDHXFCSA-N	0	3	327.472	3.321	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)CC2CCCCC2)c1	ZINC001154407523	1380272309	/nfs/dbraw/zinc/27/23/09/1380272309.db2.gz	UMYANKFLCWVQRF-UHFFFAOYSA-N	0	3	331.435	3.264	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)C1(C)CCC1	ZINC001154632628	1380321483	/nfs/dbraw/zinc/32/14/83/1380321483.db2.gz	ZQAYDBWZGWXVLX-CQSZACIVSA-N	0	3	331.435	3.214	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)c1cc(C)co1	ZINC001154724867	1380340790	/nfs/dbraw/zinc/34/07/90/1380340790.db2.gz	QPSNOXAJOXBRQN-CQSZACIVSA-N	0	3	343.402	3.239	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@@H](C)N(CC)C[C@@H](O)c1ccccc1	ZINC001154751188	1380345764	/nfs/dbraw/zinc/34/57/64/1380345764.db2.gz	QIZIKZIBWLHFGK-ZIFCJYIRSA-N	0	3	332.488	3.149	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)NC[C@@H](C)N(CC)Cc1ccc(F)c(C#N)c1	ZINC001155360408	1380442137	/nfs/dbraw/zinc/44/21/37/1380442137.db2.gz	NYMXXHXLRRMMJH-FRFSOERESA-N	0	3	331.435	3.070	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)[C@H]1CC12CCCC2	ZINC001156200100	1380540718	/nfs/dbraw/zinc/54/07/18/1380540718.db2.gz	KBUMGLOTXOPNDF-VQIMIIECSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@H]1CCN(Cc2ccccc2)C[C@@H]1N(C)c1ncc(C#N)cc1F	ZINC001156342162	1380562210	/nfs/dbraw/zinc/56/22/10/1380562210.db2.gz	ZNKFXMYGGCKMGD-KXBFYZLASA-N	0	3	338.430	3.439	20	30		EGEDHN
Cc1nc(N2CCC[C@@H](NCOCC[Si](C)(C)C)C2)ccc1C#N	ZINC001156467032	1380579587	/nfs/dbraw/zinc/57/95/87/1380579587.db2.gz	YXVXUAUQGHZBES-QGZVFWFLSA-N	0	3	346.551	3.132	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C[C@@H]1CCCc2ccccc21	ZINC001156530388	1380588771	/nfs/dbraw/zinc/58/87/71/1380588771.db2.gz	NVUSYLSBUKWOOY-MJGOQNOKSA-N	0	3	326.484	3.347	20	30		EGEDHN
C=CCOCC(=O)N1CCCC[C@@H]1CN(C)Cc1cc(F)ccc1C	ZINC001157701854	1381008562	/nfs/dbraw/zinc/00/85/62/1381008562.db2.gz	JSAIOEOQALQRMA-LJQANCHMSA-N	0	3	348.462	3.150	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)CC(C)(C)C)CCN1Cc1ccc(C#N)cc1	ZINC001328224745	1388693209	/nfs/dbraw/zinc/69/32/09/1388693209.db2.gz	ULSDASVYVDUCLB-YJBOKZPZSA-N	0	3	327.472	3.464	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1cc(C)c(C)o1	ZINC001157802523	1381036914	/nfs/dbraw/zinc/03/69/14/1381036914.db2.gz	JTAUZBNMDMMDMB-QGZVFWFLSA-N	0	3	334.460	3.026	20	30		EGEDHN
C#CCCCC(=O)N1CCCC[C@@H]1CN(C)CCc1ccccc1F	ZINC001157903212	1381066592	/nfs/dbraw/zinc/06/65/92/1381066592.db2.gz	UDRVTWQNOASXJK-LJQANCHMSA-N	0	3	344.474	3.485	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC001158117770	1381132957	/nfs/dbraw/zinc/13/29/57/1381132957.db2.gz	GAVWZKDSGRKFCA-UYAOXDASSA-N	0	3	341.499	3.012	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCCN1C(=O)CCC(F)F	ZINC001158233481	1381168986	/nfs/dbraw/zinc/16/89/86/1381168986.db2.gz	OMKQNKJKMIJYOW-QGZVFWFLSA-N	0	3	349.425	3.416	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H]1COc2cc(C)c(C)cc21	ZINC001158283444	1381183975	/nfs/dbraw/zinc/18/39/75/1381183975.db2.gz	KXXMCAXIXWHLJC-MJGOQNOKSA-N	0	3	342.483	3.278	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1COc2cc(C)c(C)cc21	ZINC001158283443	1381184050	/nfs/dbraw/zinc/18/40/50/1381184050.db2.gz	KXXMCAXIXWHLJC-IEBWSBKVSA-N	0	3	342.483	3.278	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc2ccc(OC)cc2[nH]1	ZINC001158300706	1381191051	/nfs/dbraw/zinc/19/10/51/1381191051.db2.gz	LZIORUJJUXAVRJ-MRXNPFEDSA-N	0	3	341.455	3.289	20	30		EGEDHN
CC#CCCCC(=O)N1CCCC[C@@H]1CN(C)CCOCCCC	ZINC001158357788	1381216112	/nfs/dbraw/zinc/21/61/12/1381216112.db2.gz	NXTCFVDFVVLKJV-LJQANCHMSA-N	0	3	336.520	3.310	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1ccoc1C1CC1	ZINC001158397779	1381231046	/nfs/dbraw/zinc/23/10/46/1381231046.db2.gz	ODHKGQDMFNRALR-QGZVFWFLSA-N	0	3	346.471	3.286	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H](C)OCc1ccccc1	ZINC001158521945	1381279815	/nfs/dbraw/zinc/27/98/15/1381279815.db2.gz	IUXZJMZCDVEPBR-IEBWSBKVSA-N	0	3	330.472	3.091	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1cccc(Cl)c1C	ZINC001158577980	1381306302	/nfs/dbraw/zinc/30/63/02/1381306302.db2.gz	DFGXAOHHDWSGGX-UHFFFAOYSA-N	0	3	345.668	3.267	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc2c(c1)C[C@@H](C)O2	ZINC001158605308	1381315702	/nfs/dbraw/zinc/31/57/02/1381315702.db2.gz	UQRHHYYQOAGCDB-CRAIPNDOSA-N	0	3	328.456	3.123	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCCNCc1csc([N+](=O)[O-])c1	ZINC001158747136	1381381027	/nfs/dbraw/zinc/38/10/27/1381381027.db2.gz	WENXDQQSTNCOEV-UHFFFAOYSA-N	0	3	337.445	3.021	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc(OC)c(C)c(OC)c1	ZINC001158829806	1381422003	/nfs/dbraw/zinc/42/20/03/1381422003.db2.gz	HTYSNNUQGAUVKE-QGZVFWFLSA-N	0	3	346.471	3.125	20	30		EGEDHN
C=C(C)CCC(=O)NCCCNCC(=O)Nc1c(C)cc(C)cc1C	ZINC001159021346	1381513930	/nfs/dbraw/zinc/51/39/30/1381513930.db2.gz	SEFCCYZTMPXFDO-UHFFFAOYSA-N	0	3	345.487	3.003	20	30		EGEDHN
Cc1nc(Cl)nc(-n2c(-c3ccccc3)cnc2[C@H](C)N)c1C#N	ZINC001159595969	1381842044	/nfs/dbraw/zinc/84/20/44/1381842044.db2.gz	SHZXUXMFRPYVHJ-JTQLQIEISA-N	0	3	338.802	3.183	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCC1=CCN(CCOCC2CC2)CC1	ZINC001160253229	1382050496	/nfs/dbraw/zinc/05/04/96/1382050496.db2.gz	LSMSPEHMJKNBTA-UHFFFAOYSA-N	0	3	346.515	3.320	20	30		EGEDHN
C=C(C)CCC(=O)NCCC1=CCN(CCc2csc(C)n2)CC1	ZINC001160257893	1382051705	/nfs/dbraw/zinc/05/17/05/1382051705.db2.gz	JMMAQMGYEMTYLX-UHFFFAOYSA-N	0	3	347.528	3.489	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H]2CC=CC[C@H]2C(F)(F)F)CC1	ZINC001160492337	1382122209	/nfs/dbraw/zinc/12/22/09/1382122209.db2.gz	PZEVECJHKGIKQS-HZPDHXFCSA-N	0	3	342.405	3.456	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@]2(C)[C@H]3Cc4ccccc4[C@H]32)CC1	ZINC001160551413	1382139628	/nfs/dbraw/zinc/13/96/28/1382139628.db2.gz	KXHYZOKIKBXCAI-QZNHQXDQSA-N	0	3	348.490	3.124	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc(F)ccc2CC)CC1	ZINC001160600077	1382150148	/nfs/dbraw/zinc/15/01/48/1382150148.db2.gz	IUGLWEURYVOUGT-UHFFFAOYSA-N	0	3	328.431	3.163	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2c[nH]nc2-c2ccccc2)CC1	ZINC001160810056	1382203798	/nfs/dbraw/zinc/20/37/98/1382203798.db2.gz	HLGNUNRSURTGAP-UHFFFAOYSA-N	0	3	336.439	3.015	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)CCc2cccc(Cl)c2)CC1	ZINC001160810861	1382205031	/nfs/dbraw/zinc/20/50/31/1382205031.db2.gz	YNYZEYCFXIPUKU-UHFFFAOYSA-N	0	3	344.886	3.434	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@H]1CCC=CCCC1	ZINC001160814217	1382205172	/nfs/dbraw/zinc/20/51/72/1382205172.db2.gz	AYHQWNBQTIQJFR-AWEZNQCLSA-N	0	3	329.282	3.127	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCC1=CCN(CCOCC2CCC2)CC1	ZINC001160888240	1382224913	/nfs/dbraw/zinc/22/49/13/1382224913.db2.gz	CFOGCXFEYKXQMU-UHFFFAOYSA-N	0	3	334.504	3.154	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccn(C(C)C)c2C)CC1	ZINC001160979972	1382260334	/nfs/dbraw/zinc/26/03/34/1382260334.db2.gz	SMIKVCPFTZIBPC-UHFFFAOYSA-N	0	3	327.472	3.153	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)Cc2ccc(F)c(Cl)c2)CC1	ZINC001161314265	1382369086	/nfs/dbraw/zinc/36/90/86/1382369086.db2.gz	SDCUBBVMPANCBY-UHFFFAOYSA-N	0	3	336.838	3.346	20	30		EGEDHN
C[C@H](c1ccccc1)N(C(=O)[C@@H]1CCNC[C@@H]1F)C1=CC(=O)CCC1	ZINC001161509435	1382426692	/nfs/dbraw/zinc/42/66/92/1382426692.db2.gz	PEZMCMDNEFEFLD-ZMYBRWDISA-N	0	3	344.430	3.161	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CCc2ccc(F)cc2F)CC1	ZINC001161617786	1382461265	/nfs/dbraw/zinc/46/12/65/1382461265.db2.gz	STBXOXZDWNHLQI-UHFFFAOYSA-N	0	3	334.410	3.222	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccnc(C(F)(F)F)c2)CC1	ZINC001161639982	1382467441	/nfs/dbraw/zinc/46/74/41/1382467441.db2.gz	NAIUELMPWQTOMU-UHFFFAOYSA-N	0	3	339.361	3.038	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)CCc2ccccc2Cl)CC1	ZINC001161829028	1382522909	/nfs/dbraw/zinc/52/29/09/1382522909.db2.gz	FTANUBMJDPGODM-UHFFFAOYSA-N	0	3	344.886	3.434	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H](C)COc2ccccc2)CC1	ZINC001161883985	1382539358	/nfs/dbraw/zinc/53/93/58/1382539358.db2.gz	GAGXIHTVHYFIFB-KRWDZBQOSA-N	0	3	328.456	3.026	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc(N(C)C(C)C)cc2)CC1	ZINC001162001970	1382596115	/nfs/dbraw/zinc/59/61/15/1382596115.db2.gz	AFBNKGCTUHASQC-UHFFFAOYSA-N	0	3	341.499	3.469	20	30		EGEDHN
C#CCN1CCC(CNC(=O)C2(CC(C)C)CCCC2)(COC)CC1	ZINC001162533173	1382782469	/nfs/dbraw/zinc/78/24/69/1382782469.db2.gz	HDVALAOKRVOVFE-UHFFFAOYSA-N	0	3	348.531	3.071	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)c1ccsc1C	ZINC001162803341	1382877723	/nfs/dbraw/zinc/87/77/23/1382877723.db2.gz	YZISRMWZYVBCNQ-UHFFFAOYSA-N	0	3	340.492	3.354	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C1(C)CCCCC1	ZINC001162911787	1382913764	/nfs/dbraw/zinc/91/37/64/1382913764.db2.gz	VNMSBGXMDGUJCV-UHFFFAOYSA-N	0	3	326.484	3.251	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C[C@H](C)c1ccco1	ZINC001162983035	1382937641	/nfs/dbraw/zinc/93/76/41/1382937641.db2.gz	XHCKMVATCLRRGA-SFHVURJKSA-N	0	3	338.451	3.067	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H](C)c1ccccc1	ZINC001162987383	1382939067	/nfs/dbraw/zinc/93/90/67/1382939067.db2.gz	OKEJZASYXOYEQW-LJQANCHMSA-N	0	3	334.463	3.084	20	30		EGEDHN
CC[C@H](C)C(=O)NCCC1(CNCc2cc(C#N)ccc2F)CC1	ZINC001163496792	1383065458	/nfs/dbraw/zinc/06/54/58/1383065458.db2.gz	SPWVMTCSUKMIJZ-AWEZNQCLSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)C[C@H](C)C(C)C)CC1	ZINC001163757662	1383118402	/nfs/dbraw/zinc/11/84/02/1383118402.db2.gz	UPHPHQQZKQKOQF-ZDUSSCGKSA-N	0	3	345.325	3.453	20	30		EGEDHN
CCN1CCCN(c2nc3cc(F)ccc3c(Cl)c2C#N)CC1	ZINC001163772241	1383120685	/nfs/dbraw/zinc/12/06/85/1383120685.db2.gz	JEJUUMJKIRSIAW-UHFFFAOYSA-N	0	3	332.810	3.431	20	30		EGEDHN
Cc1c(F)ccc2nc(Cl)c(C#N)c(-n3cnc4c3CNCC4)c12	ZINC001164317780	1383177227	/nfs/dbraw/zinc/17/72/27/1383177227.db2.gz	YPCSQHUULPHGEH-UHFFFAOYSA-N	0	3	341.777	3.039	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@H]2CCCO[C@H]2C(C)C)CC1	ZINC001164570379	1383200034	/nfs/dbraw/zinc/20/00/34/1383200034.db2.gz	WJNNPGWTPQJUFJ-HOTGVXAUSA-N	0	3	342.911	3.066	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)c2ccoc2C2CC2)c(F)c1	ZINC001164604096	1383205774	/nfs/dbraw/zinc/20/57/74/1383205774.db2.gz	CILBYOKXMDFCKO-UHFFFAOYSA-N	0	3	341.386	3.077	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCC1(CNCc2c(C)noc2C)CC1	ZINC001165215168	1383250013	/nfs/dbraw/zinc/25/00/13/1383250013.db2.gz	JMGSGZHIOPOQEA-UHFFFAOYSA-N	0	3	333.476	3.270	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1nccc2ccccc21	ZINC001165319197	1383272427	/nfs/dbraw/zinc/27/24/27/1383272427.db2.gz	UTANEPUROIMCGX-UHFFFAOYSA-N	0	3	344.418	3.016	20	30		EGEDHN
CCc1ccccc1C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001165327597	1383274024	/nfs/dbraw/zinc/27/40/24/1383274024.db2.gz	JWFBHHMFNMPXNO-UHFFFAOYSA-N	0	3	339.414	3.169	20	30		EGEDHN
C#CCC1(C(=O)NCCC2(CNCc3ccccc3C#N)CC2)CCC1	ZINC001165412734	1383290277	/nfs/dbraw/zinc/29/02/77/1383290277.db2.gz	NSXNWSRYQLMSAR-UHFFFAOYSA-N	0	3	349.478	3.128	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCCNCc2nc(C(C)(C)C)cs2)C1	ZINC001166245469	1383406754	/nfs/dbraw/zinc/40/67/54/1383406754.db2.gz	DJXNFEWUCKAXSR-UHFFFAOYSA-N	0	3	335.517	3.393	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCC1(CNCc2c(C)noc2CC)CC1	ZINC001166703712	1383463583	/nfs/dbraw/zinc/46/35/83/1383463583.db2.gz	JSYGSPSMZMWDST-GJZGRUSLSA-N	0	3	347.503	3.380	20	30		EGEDHN
CC#CCCCC(=O)NCCC1(CNCc2oc(CC)nc2C)CC1	ZINC001166710258	1383464729	/nfs/dbraw/zinc/46/47/29/1383464729.db2.gz	UKNMVMJXHQFBKA-UHFFFAOYSA-N	0	3	345.487	3.115	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCCC1(CN[C@@H](C)c2cnc(C)cn2)CC1	ZINC001166765694	1383474510	/nfs/dbraw/zinc/47/45/10/1383474510.db2.gz	VTZWLFMVRONVCV-IRXDYDNUSA-N	0	3	344.503	3.324	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2nc(Cl)cs2)CC1	ZINC001166829868	1383484314	/nfs/dbraw/zinc/48/43/14/1383484314.db2.gz	JKIHVIDICPHBFR-UHFFFAOYSA-N	0	3	334.272	3.039	20	30		EGEDHN
N#Cc1ccccc1CNCC1(CCNC(=O)[C@@H]2CC[C@H](F)C2)CC1	ZINC001166850981	1383487499	/nfs/dbraw/zinc/48/74/99/1383487499.db2.gz	QMQXOZURYYTMBO-QAPCUYQASA-N	0	3	343.446	3.073	20	30		EGEDHN
C=C1CCC(C(=O)NCCC2(CNCc3conc3C)CC2)CC1	ZINC001167011826	1383517545	/nfs/dbraw/zinc/51/75/45/1383517545.db2.gz	JCVLAXMTALGSRG-UHFFFAOYSA-N	0	3	331.460	3.106	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCC2(CN[C@H](C)c3cnc(C)cn3)CC2)C1	ZINC001167129841	1383547082	/nfs/dbraw/zinc/54/70/82/1383547082.db2.gz	DRBNRYBDQLUFCZ-MRXNPFEDSA-N	0	3	342.487	3.078	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1ccc(C)cc1Cl	ZINC001167176524	1383559030	/nfs/dbraw/zinc/55/90/30/1383559030.db2.gz	FLARLKGFTLOUDC-UHFFFAOYSA-N	0	3	345.668	3.267	20	30		EGEDHN
C=Cc1ccc(C(=O)NCCCNCc2ccc(C#N)cc2F)cc1	ZINC001167229480	1383571305	/nfs/dbraw/zinc/57/13/05/1383571305.db2.gz	GMECPPBGXCTNMD-UHFFFAOYSA-N	0	3	337.398	3.250	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1cc(F)ccc1Cl	ZINC001167269596	1383580614	/nfs/dbraw/zinc/58/06/14/1383580614.db2.gz	MTNMVGVZONMDKX-UHFFFAOYSA-N	0	3	349.631	3.097	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)NCCC1(CNCc2ccc(C#N)cc2F)CC1	ZINC001167282684	1383584083	/nfs/dbraw/zinc/58/40/83/1383584083.db2.gz	FFBSGMXYSXCBEM-NVXWUHKLSA-N	0	3	343.446	3.120	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)Cc2c[nH]c3ccccc23)CC1	ZINC001167856452	1383759902	/nfs/dbraw/zinc/75/99/02/1383759902.db2.gz	GUJKNXRVQXYCRI-UHFFFAOYSA-N	0	3	345.874	3.339	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@H](C)[C@H](C)C(C)(C)C	ZINC001168168757	1383832330	/nfs/dbraw/zinc/83/23/30/1383832330.db2.gz	SZCHLIZDLVTWGJ-OLZOCXBDSA-N	0	3	333.314	3.309	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@H]2Oc3ccccc3[C@@H]2C)CC1	ZINC001168530103	1383930721	/nfs/dbraw/zinc/93/07/21/1383930721.db2.gz	IHJOMCAZBRSGKZ-YOEHRIQHSA-N	0	3	348.874	3.180	20	30		EGEDHN
CCOC(=O)[C@@H]1[C@H](C)C[C@H](C)N(Cc2ccc(C#N)cc2OC)[C@H]1C	ZINC001308154774	1384101552	/nfs/dbraw/zinc/10/15/52/1384101552.db2.gz	DAFXRISZKJHLII-MMMWYMCRSA-N	0	3	344.455	3.365	20	30		EGEDHN
C=CCc1ccc(NC(=O)C(C)(C)C)c(-n2ccc([C@@H](C)N)n2)n1	ZINC001169230626	1384125190	/nfs/dbraw/zinc/12/51/90/1384125190.db2.gz	UTFLGNSPXHUCQT-GFCCVEGCSA-N	0	3	327.432	3.000	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)[C@@H]2C[C@H]2C2CCCC2)c(F)c1	ZINC001169678508	1384172350	/nfs/dbraw/zinc/17/23/50/1384172350.db2.gz	CWNQOMODFYZOJT-ZWKOTPCHSA-N	0	3	343.446	3.120	20	30		EGEDHN
C[C@@H](CCCCNCc1cc(F)ccc1C#N)NC(=O)/C=C/C1CC1	ZINC001169981538	1384209586	/nfs/dbraw/zinc/20/95/86/1384209586.db2.gz	GDBSRQWFMZVERS-VSGCLNPGSA-N	0	3	343.446	3.428	20	30		EGEDHN
CC[C@H](SC)C(=O)N[C@H](C)CCCCNCc1ccccc1C#N	ZINC001170213287	1384266057	/nfs/dbraw/zinc/26/60/57/1384266057.db2.gz	XZBINRCBJHBICG-QAPCUYQASA-N	0	3	347.528	3.464	20	30		EGEDHN
C=C[C@@H]1C[C@]1(Nc1ccc(F)c(CN2CCCC2)c1)C(=O)OCC	ZINC001170927238	1384413223	/nfs/dbraw/zinc/41/32/23/1384413223.db2.gz	JGSZKDIAFQVQFK-DNVCBOLYSA-N	0	3	332.419	3.341	20	30		EGEDHN
CCCCCC[C@H](F)C(=O)NCCCNCc1ccccc1C#N	ZINC001171146970	1384454601	/nfs/dbraw/zinc/45/46/01/1384454601.db2.gz	XVPWZJUHAKUKIV-SFHVURJKSA-N	0	3	333.451	3.463	20	30		EGEDHN
C=CCOC(=O)[C@H](CC(C)C)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1	ZINC001171728540	1384615898	/nfs/dbraw/zinc/61/58/98/1384615898.db2.gz	PVYPPPXFJGPLRM-RLLQIKCJSA-N	0	3	344.499	3.383	20	30		EGEDHN
CCCCCCCCC(=O)NCCCNCc1cccc(OC)n1	ZINC001171822856	1384651599	/nfs/dbraw/zinc/65/15/99/1384651599.db2.gz	QFNAXOHFFNGGET-UHFFFAOYSA-N	0	3	335.492	3.437	20	30		EGEDHN
CCCCCCCCC(=O)NCCCNCc1cc(OC)ccn1	ZINC001171823013	1384651629	/nfs/dbraw/zinc/65/16/29/1384651629.db2.gz	WKCVIUFPJSSJCR-UHFFFAOYSA-N	0	3	335.492	3.437	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1cccc(CC)n1	ZINC001316878729	1384663242	/nfs/dbraw/zinc/66/32/42/1384663242.db2.gz	WFONRLYBAQXUTF-PBHICJAKSA-N	0	3	335.879	3.369	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1nc(C)oc1C	ZINC001316879200	1384664067	/nfs/dbraw/zinc/66/40/67/1384664067.db2.gz	JREZTPJZDUWLME-RISCZKNCSA-N	0	3	325.840	3.017	20	30		EGEDHN
N#CCC1CN(C2CCN(c3ccc(Br)cc3)CC2)C1	ZINC001171990277	1384707504	/nfs/dbraw/zinc/70/75/04/1384707504.db2.gz	OVEUCPCDTAOIBK-UHFFFAOYSA-N	0	3	334.261	3.263	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)N1CCN(c2cccc(C#N)c2)CC1	ZINC001172310603	1384766141	/nfs/dbraw/zinc/76/61/41/1384766141.db2.gz	GRCVKYZXVNRMAB-QGZVFWFLSA-N	0	3	330.435	3.183	20	30		EGEDHN
COC(=O)C1(C#N)CCN([C@H]2CCC[C@@H](c3ccccc3)C2)CC1	ZINC001172549372	1384810489	/nfs/dbraw/zinc/81/04/89/1384810489.db2.gz	OZWRLUCRNIWSSM-MSOLQXFVSA-N	0	3	326.440	3.492	20	30		EGEDHN
C[C@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C#N)C1)c1ccncc1	ZINC001172967659	1384892164	/nfs/dbraw/zinc/89/21/64/1384892164.db2.gz	ZHLUJXZKBDJHEU-IMJJTQAJSA-N	0	3	330.432	3.024	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H](NC(C)(C)c2ccncc2)C[C@H]1C#N	ZINC001172981088	1384894574	/nfs/dbraw/zinc/89/45/74/1384894574.db2.gz	JLBRLFJOIHRFHL-CVEARBPZSA-N	0	3	344.459	3.198	20	30		EGEDHN
C=CCOC1CCC(N2CCN(C(=O)c3ccccc3)C[C@H]2C)CC1	ZINC001173323317	1384958811	/nfs/dbraw/zinc/95/88/11/1384958811.db2.gz	DANGDHOQWKDHEC-QHGAOEGBSA-N	0	3	342.483	3.347	20	30		EGEDHN
CCCC1(C(=O)N2CC[C@H](CNCc3ccccc3C#N)C2)CC1	ZINC001317334162	1385087812	/nfs/dbraw/zinc/08/78/12/1385087812.db2.gz	KTCPFKKHUZJQQU-MRXNPFEDSA-N	0	3	325.456	3.077	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1cnc2ccccc2c1C	ZINC001317401641	1385116431	/nfs/dbraw/zinc/11/64/31/1385116431.db2.gz	SBFNLJIOUYLEDP-CYBMUJFWSA-N	0	3	331.847	3.394	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)c1cccc(C)c1C	ZINC001317411366	1385122428	/nfs/dbraw/zinc/12/24/28/1385122428.db2.gz	CEEYOUCTUDELTN-CYBMUJFWSA-N	0	3	339.277	3.310	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](C)CCCCNCc1ccn(CC)n1	ZINC001174673224	1385132543	/nfs/dbraw/zinc/13/25/43/1385132543.db2.gz	VREBUTKMSYGAPW-INIZCTEOSA-N	0	3	334.508	3.270	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@H](C)CCCCNCc1ccn(CC)n1	ZINC001174848607	1385159215	/nfs/dbraw/zinc/15/92/15/1385159215.db2.gz	FBLPZYXUFZPYHX-IAGOWNOFSA-N	0	3	334.508	3.270	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H](C)CCCCNCc1cc(C)n(C)n1	ZINC001174850398	1385160161	/nfs/dbraw/zinc/16/01/61/1385160161.db2.gz	XZUPOSHTEOABMR-CVEARBPZSA-N	0	3	334.508	3.095	20	30		EGEDHN
C=CCCCC(=O)N[C@@H](C)CCCCNCc1nnc(C)n1C1CC1	ZINC001174987911	1385179817	/nfs/dbraw/zinc/17/98/17/1385179817.db2.gz	SFRMUYJLGYQHHM-HNNXBMFYSA-N	0	3	347.507	3.042	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H](C)CCCCNCc1ccn(CC)n1	ZINC001175082248	1385191486	/nfs/dbraw/zinc/19/14/86/1385191486.db2.gz	MYHDUZVOVAFPDE-QFBILLFUSA-N	0	3	334.508	3.270	20	30		EGEDHN
CCC(CC)C(=O)NC[C@H]1CCCN1Cc1ccc(OCC#N)cc1	ZINC001317494764	1385196113	/nfs/dbraw/zinc/19/61/13/1385196113.db2.gz	PXOCMYKKGOBMSR-GOSISDBHSA-N	0	3	343.471	3.106	20	30		EGEDHN
CCCN(CCNC(=O)Cc1cccs1)Cc1cccc(C#N)c1	ZINC001317538088	1385269991	/nfs/dbraw/zinc/26/99/91/1385269991.db2.gz	DHYCALYLHZMYMM-UHFFFAOYSA-N	0	3	341.480	3.191	20	30		EGEDHN
C=CC[C@H](C(=O)NCCCNCc1oc(C)nc1C)c1ccccc1	ZINC001176698713	1385662933	/nfs/dbraw/zinc/66/29/33/1385662933.db2.gz	WUFVMMOAOWSJFU-SFHVURJKSA-N	0	3	341.455	3.247	20	30		EGEDHN
C=C[C@H](C(=O)NCCCNCc1oc(CC)nc1C)c1ccccc1	ZINC001176781898	1385695296	/nfs/dbraw/zinc/69/52/96/1385695296.db2.gz	OIHHCDDRPXXMRB-KRWDZBQOSA-N	0	3	341.455	3.111	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N[C@H](C)CCCCNC/C(Cl)=C\Cl	ZINC001176802028	1385706288	/nfs/dbraw/zinc/70/62/88/1385706288.db2.gz	WPTTYWSHDLOFKP-HUPKAIDTSA-N	0	3	337.291	3.161	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)[C@@H](c1ccc(F)cc1)C(C)C	ZINC001177122147	1385821454	/nfs/dbraw/zinc/82/14/54/1385821454.db2.gz	UBGJRKTWZNKGEP-MRXNPFEDSA-N	0	3	326.843	3.414	20	30		EGEDHN
N#Cc1ccccc1CNCCCN(CC1CCCC1)C(=O)C(F)F	ZINC001177169774	1385843328	/nfs/dbraw/zinc/84/33/28/1385843328.db2.gz	DVDWDPHOQMWMQQ-UHFFFAOYSA-N	0	3	349.425	3.322	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)CCSC	ZINC001177206609	1385863430	/nfs/dbraw/zinc/86/34/30/1385863430.db2.gz	AARIHXHIHVHZLG-UHFFFAOYSA-N	0	3	332.941	3.491	20	30		EGEDHN
C#CCC1(C(=O)NCCCNCc2ccccc2C#N)CCCCC1	ZINC001177217501	1385868770	/nfs/dbraw/zinc/86/87/70/1385868770.db2.gz	AJGZTOVFNKYPEL-UHFFFAOYSA-N	0	3	337.467	3.128	20	30		EGEDHN
C[C@H]1C[C@H]1C(=O)NCCCCCCNCc1cc(F)ccc1C#N	ZINC001177819798	1386056286	/nfs/dbraw/zinc/05/62/86/1386056286.db2.gz	QYBYSZKJFMCZAH-KBXCAEBGSA-N	0	3	331.435	3.120	20	30		EGEDHN
N#CC(Cc1cccs1)C(=O)Nc1ncccc1OC(F)(F)F	ZINC001177903274	1386078593	/nfs/dbraw/zinc/07/85/93/1386078593.db2.gz	GQQWSHXYQNDVEX-SECBINFHSA-N	0	3	341.314	3.363	20	30		EGEDHN
N#CC(Cc1cccs1)C(=O)Nc1c(N)cc(Cl)nc1Cl	ZINC001177904857	1386079005	/nfs/dbraw/zinc/07/90/05/1386079005.db2.gz	SVTNFQPRFHUZPU-SSDOTTSWSA-N	0	3	341.223	3.353	20	30		EGEDHN
COCCCCC(=O)NCCCCCCNCc1ccccc1C#N	ZINC001178001292	1386106000	/nfs/dbraw/zinc/10/60/00/1386106000.db2.gz	AJOXQPGVPKHPMY-UHFFFAOYSA-N	0	3	345.487	3.141	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2Cl)CCN1C(=O)C1CCCC1	ZINC001178018863	1386109952	/nfs/dbraw/zinc/10/99/52/1386109952.db2.gz	DXUNLKWWRUQJJU-KXBFYZLASA-N	0	3	344.886	3.461	20	30		EGEDHN
COc1ccc(C#N)cc1CN[C@H]1CCN(C(=O)CCC(C)C)[C@H]1C	ZINC001178102175	1386128584	/nfs/dbraw/zinc/12/85/84/1386128584.db2.gz	PLIUBPWKOOWLRS-YJBOKZPZSA-N	0	3	343.471	3.082	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H](CNCc2ccc(C#N)s2)CC(C)C)o1	ZINC001319603667	1386202349	/nfs/dbraw/zinc/20/23/49/1386202349.db2.gz	SBQYIARSEYRSDA-CQSZACIVSA-N	0	3	345.468	3.456	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2cccc(Cl)c2)CCN1C(=O)C=C1CCC1	ZINC001178452021	1386221963	/nfs/dbraw/zinc/22/19/63/1386221963.db2.gz	MONUIIWYIJTNQU-KXBFYZLASA-N	0	3	342.870	3.381	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](NCc2cc(C)ccc2OC)[C@@H]1C	ZINC001178529874	1386242121	/nfs/dbraw/zinc/24/21/21/1386242121.db2.gz	NFWPLBQIRDDNIX-HKUYNNGSSA-N	0	3	342.483	3.276	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](NCc2cnc(C)s2)[C@@H]1C	ZINC001178772010	1386298858	/nfs/dbraw/zinc/29/88/58/1386298858.db2.gz	PBVWHQJQNYEZLB-GUYCJALGSA-N	0	3	333.501	3.299	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](NCc2cc(C)ns2)[C@@H]1C	ZINC001178771780	1386299089	/nfs/dbraw/zinc/29/90/89/1386299089.db2.gz	LTSOKLZNCORFTD-YOEHRIQHSA-N	0	3	333.501	3.299	20	30		EGEDHN
CC[C@H](CC(F)F)C(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C	ZINC001178865435	1386333021	/nfs/dbraw/zinc/33/30/21/1386333021.db2.gz	JGVQUNNMAZRGNR-JQHSSLGASA-N	0	3	348.437	3.299	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCCCCCNCc2nccs2)cc1	ZINC001179198131	1386423010	/nfs/dbraw/zinc/42/30/10/1386423010.db2.gz	FACDIBVIWAXYGJ-UHFFFAOYSA-N	0	3	341.480	3.204	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCCCCCCNCc1nccn1CC	ZINC001179334964	1386453745	/nfs/dbraw/zinc/45/37/45/1386453745.db2.gz	CTIBTAQFCPVGKU-KRWDZBQOSA-N	0	3	334.508	3.272	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](NCc2cc(C)ccc2F)[C@@H]1C	ZINC001179360217	1386462542	/nfs/dbraw/zinc/46/25/42/1386462542.db2.gz	PXPSUNMWTMERQX-LPHOPBHVSA-N	0	3	330.447	3.407	20	30		EGEDHN
C[C@H]1[C@@H](NCc2ccc(C#N)s2)CCN1C(=O)CCCC1CC1	ZINC001179370430	1386465353	/nfs/dbraw/zinc/46/53/53/1386465353.db2.gz	SSPPGTNCVGOLSM-GUYCJALGSA-N	0	3	331.485	3.279	20	30		EGEDHN
CC(C)c1[nH]ccc1C(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C	ZINC001179380813	1386468247	/nfs/dbraw/zinc/46/82/47/1386468247.db2.gz	QKEBIYJRWWQXOM-PXNSSMCTSA-N	0	3	349.478	3.382	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@H](NCc2cnn(C(C)(C)C)c2)[C@@H]1C	ZINC001179388700	1386471501	/nfs/dbraw/zinc/47/15/01/1386471501.db2.gz	OBUIURXZIUHXNF-BQFCYCMXSA-N	0	3	346.519	3.319	20	30		EGEDHN
C=CCCCC(=O)NCCCCCCNCc1csnc1OC	ZINC001179426340	1386481003	/nfs/dbraw/zinc/48/10/03/1386481003.db2.gz	VUMDDKFDLFUXEN-UHFFFAOYSA-N	0	3	339.505	3.274	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCCCCCN[C@H](C)c1nnc(CC)[nH]1	ZINC001179482598	1386495415	/nfs/dbraw/zinc/49/54/15/1386495415.db2.gz	XOKGGFJLVHKIEI-BEFAXECRSA-N	0	3	349.523	3.297	20	30		EGEDHN
C=CCC1(C(=O)NCCCCCCNCc2cnc(C)o2)CCC1	ZINC001179493038	1386497438	/nfs/dbraw/zinc/49/74/38/1386497438.db2.gz	ZZTMFLWQXBPNEI-UHFFFAOYSA-N	0	3	333.476	3.496	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccc(F)cc2)CCN1C(=O)CCC1(C)CC1	ZINC001179841168	1386603376	/nfs/dbraw/zinc/60/33/76/1386603376.db2.gz	PPLIRXATQAQEDE-LPHOPBHVSA-N	0	3	342.458	3.337	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C)c1ccccc1	ZINC001179941293	1386639369	/nfs/dbraw/zinc/63/93/69/1386639369.db2.gz	XGWUJUXGIMFIOZ-IPJJNNNSSA-N	0	3	346.474	3.421	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2oc(CC)nc2C)C1	ZINC001180846005	1386882587	/nfs/dbraw/zinc/88/25/87/1386882587.db2.gz	BMIHYLHZBLZURS-AUUYWEPGSA-N	0	3	333.476	3.086	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2cc(F)ccc2C#N)C1	ZINC001180846354	1386883258	/nfs/dbraw/zinc/88/32/58/1386883258.db2.gz	JNHSWSLQGJLLEU-FOIQADDNSA-N	0	3	343.446	3.238	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2ccn(CC)n2)C1	ZINC001182305355	1387143018	/nfs/dbraw/zinc/14/30/18/1387143018.db2.gz	FTTZWKYFNDDTTM-SQGPQFPESA-N	0	3	346.519	3.080	20	30		EGEDHN
Cc1cccc(Cl)c1CN[C@@H]1CCN(C(=O)C#CC(C)(C)C)C1	ZINC001182458753	1387169531	/nfs/dbraw/zinc/16/95/31/1387169531.db2.gz	NGBUZPAZMGACJQ-OAHLLOKOSA-N	0	3	332.875	3.388	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(c3ncc4ccccc4n3)CC2)cc1	ZINC001329483024	1389125839	/nfs/dbraw/zinc/12/58/39/1389125839.db2.gz	SQRLXXFZYOLCID-UHFFFAOYSA-N	0	3	343.434	3.214	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)Nc1ccc(C(=O)NC)cc1C	ZINC001336690981	1389136845	/nfs/dbraw/zinc/13/68/45/1389136845.db2.gz	CCIDLLPHKZGPEJ-INIZCTEOSA-N	0	3	333.476	3.371	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(c3nccc4cccnc43)CC2)cc1	ZINC001337259621	1389287795	/nfs/dbraw/zinc/28/77/95/1389287795.db2.gz	OEEUDXCOGITICW-UHFFFAOYSA-N	0	3	343.434	3.214	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)c2ccc(C#N)cc2F)CN1Cc1ccccc1	ZINC001338902846	1389813169	/nfs/dbraw/zinc/81/31/69/1389813169.db2.gz	QAKBFLAJVOBILS-WMLDXEAASA-N	0	3	337.398	3.090	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccc(C(=O)NC2CCCCC2)cc1	ZINC001339990582	1390204404	/nfs/dbraw/zinc/20/44/04/1390204404.db2.gz	UUWWHABHWUPYJQ-GOSISDBHSA-N	0	3	343.471	3.371	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)N1CCSC2(CCOCC2)C1	ZINC001340667864	1390340987	/nfs/dbraw/zinc/34/09/87/1390340987.db2.gz	VVCVQHWKSYATHX-MRXNPFEDSA-N	0	3	342.549	3.189	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N1CCC[C@@H](c2nc3c(s2)CCCC3)C1	ZINC001341029206	1390428182	/nfs/dbraw/zinc/42/81/82/1390428182.db2.gz	DZXAKQQSPUONFW-CABCVRRESA-N	0	3	347.528	3.412	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)[C@H](C)OC1CCCCC1	ZINC001341886219	1390544687	/nfs/dbraw/zinc/54/46/87/1390544687.db2.gz	QHRLTKRHWZHYCQ-DZGCQCFKSA-N	0	3	344.411	3.080	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N(C)Cc1ccc(Br)cc1F	ZINC001342266650	1390593318	/nfs/dbraw/zinc/59/33/18/1390593318.db2.gz	JCBWQHCKEIIDGQ-CQSZACIVSA-N	0	3	343.240	3.230	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccc(Br)cc1OC	ZINC001342374951	1390606526	/nfs/dbraw/zinc/60/65/26/1390606526.db2.gz	RPMROVJLHRDUQV-LLVKDONJSA-N	0	3	327.222	3.080	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N1CCC[C@H](c2cncn2C(C)(C)C)C1	ZINC001342754950	1390650212	/nfs/dbraw/zinc/65/02/12/1390650212.db2.gz	NFTFLHOATYNHEY-JKSUJKDBSA-N	0	3	332.492	3.028	20	30		EGEDHN
C=C(C)Cn1c([C@H](CC)OCC)nnc1N1C[C@@H](C)N(CC)C[C@@H]1C	ZINC001343690931	1390731230	/nfs/dbraw/zinc/73/12/30/1390731230.db2.gz	FMDMVVPKJYXWRC-IKGGRYGDSA-N	0	3	349.523	3.261	20	30		EGEDHN
N#CC(C(=O)[C@@H]1CCCSC1)c1nccn1Cc1ccccc1	ZINC001343703928	1390732041	/nfs/dbraw/zinc/73/20/41/1390732041.db2.gz	FQVZISDVVWOLOE-CVEARBPZSA-N	0	3	325.437	3.251	20	30		EGEDHN
N#Cc1cc(C(=O)NC2CCN(Cc3ccccc3)CC2)cs1	ZINC001344055221	1390752622	/nfs/dbraw/zinc/75/26/22/1390752622.db2.gz	KRCBVOLKFMSVQO-UHFFFAOYSA-N	0	3	325.437	3.014	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCc1c(C)nn(CC(C)C)c1C	ZINC001344322198	1390782140	/nfs/dbraw/zinc/78/21/40/1390782140.db2.gz	JOFVLYPAPDLYDB-KRWDZBQOSA-N	0	3	341.459	3.181	20	30		EGEDHN
CSc1ccc([C@H](CNC(=O)C#Cc2cccs2)N(C)C)cc1	ZINC001344389671	1390788527	/nfs/dbraw/zinc/78/85/27/1390788527.db2.gz	NBJLZAKUEREHFP-KRWDZBQOSA-N	0	3	344.505	3.241	20	30		EGEDHN
Cn1cc(-c2ccc(CNCc3cccc(OCC#N)c3)s2)cn1	ZINC001344640123	1390804995	/nfs/dbraw/zinc/80/49/95/1390804995.db2.gz	VSSDUKKJDQYYKP-UHFFFAOYSA-N	0	3	338.436	3.341	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc(Cl)c(NC(=O)C2CC2)c1	ZINC001344803108	1390815985	/nfs/dbraw/zinc/81/59/85/1390815985.db2.gz	YKNHPJVIEBOYMJ-AWEZNQCLSA-N	0	3	335.835	3.311	20	30		EGEDHN
CCc1c(C(=O)C(C#N)c2nccn2CC)cnn1C1CCCC1	ZINC001344864569	1390820142	/nfs/dbraw/zinc/82/01/42/1390820142.db2.gz	TUGPZVPGWDMJLH-CQSZACIVSA-N	0	3	325.416	3.267	20	30		EGEDHN
CCn1ccnc1[C@@H](C#N)C(=O)c1ccc(CN2CCCCC2)cc1	ZINC001345646673	1390871865	/nfs/dbraw/zinc/87/18/65/1390871865.db2.gz	MNTOWPXKCJHLNY-SFHVURJKSA-N	0	3	336.439	3.379	20	30		EGEDHN
CCn1ccnc1C(C#N)=C([O-])c1ccc(C[NH+]2CCCCC2)cc1	ZINC001345646673	1390871867	/nfs/dbraw/zinc/87/18/67/1390871867.db2.gz	MNTOWPXKCJHLNY-SFHVURJKSA-N	0	3	336.439	3.379	20	30		EGEDHN
C[C@@H]1[C@@H](C(=O)OCC2(C#N)CCN(Cc3ccccc3)CC2)C1(F)F	ZINC001346546103	1390953572	/nfs/dbraw/zinc/95/35/72/1390953572.db2.gz	PUVLDIVYRNNASE-ZBFHGGJFSA-N	0	3	348.393	3.237	20	30		EGEDHN
Cc1cnc2ccccc2c1N1CCN(c2ccc(C#N)nc2)CC1	ZINC001348835395	1391273120	/nfs/dbraw/zinc/27/31/20/1391273120.db2.gz	ZPVZCQMQYPESJD-UHFFFAOYSA-N	0	3	329.407	3.137	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCN(C(=O)OC(C)(C)C)C(C)C	ZINC001349701614	1391355418	/nfs/dbraw/zinc/35/54/18/1391355418.db2.gz	HKUBUKLPYCSRQN-AWEZNQCLSA-N	0	3	348.447	3.115	20	30		EGEDHN
C[C@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)c1ccsc1	ZINC001698813362	1406501278	/nfs/dbraw/zinc/50/12/78/1406501278.db2.gz	CSOOJPMCKUPYET-GFCCVEGCSA-N	0	3	331.416	3.009	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@@H](OCC)c2ccccc2)C1	ZINC001479346197	1392221401	/nfs/dbraw/zinc/22/14/01/1392221401.db2.gz	MADZPXLSJDTEJO-UAGQMJEPSA-N	0	3	336.863	3.001	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)CCc1nccs1	ZINC001479834210	1392420125	/nfs/dbraw/zinc/42/01/25/1392420125.db2.gz	NXXBUBQXDPSWPO-KGLIPLIRSA-N	0	3	341.908	3.187	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)CCc1nccs1	ZINC001479834211	1392420034	/nfs/dbraw/zinc/42/00/34/1392420034.db2.gz	NXXBUBQXDPSWPO-UONOGXRCSA-N	0	3	341.908	3.187	20	30		EGEDHN
CCC(C)(C)CC(=O)N1CC[C@@H](CNCc2ccccc2C#N)C1	ZINC001480643826	1392834166	/nfs/dbraw/zinc/83/41/66/1392834166.db2.gz	LMYOXDMXLLIGLC-INIZCTEOSA-N	0	3	327.472	3.323	20	30		EGEDHN
Cc1cc(C(=O)NCC[C@H](C)NCc2cc(C#N)ccc2F)oc1C	ZINC001480759343	1392917493	/nfs/dbraw/zinc/91/74/93/1392917493.db2.gz	ONNGDTCZIPHPMQ-ZDUSSCGKSA-N	0	3	343.402	3.205	20	30		EGEDHN
C[C@H](CCNC(=O)c1cc(C#N)c[nH]1)N[C@@H](C)c1c(F)cccc1F	ZINC001480759493	1392917580	/nfs/dbraw/zinc/91/75/80/1392917580.db2.gz	VCSWXJWSJVADSY-NEPJUHHUSA-N	0	3	346.381	3.024	20	30		EGEDHN
CCN(CCNC(=O)[C@H](C)C#N)[C@H](C)c1ccc(F)c(Cl)c1	ZINC001480968389	1393054337	/nfs/dbraw/zinc/05/43/37/1393054337.db2.gz	WIKMLKBSTBJJRI-VXGBXAGGSA-N	0	3	325.815	3.138	20	30		EGEDHN
CCN(CCNC(=O)c1c[nH]c2ccccc21)Cc1ccc(C#N)cc1	ZINC001480986950	1393069281	/nfs/dbraw/zinc/06/92/81/1393069281.db2.gz	PCHCGHUVFPBKOW-UHFFFAOYSA-N	0	3	346.434	3.291	20	30		EGEDHN
CCN(CCNC(=O)c1cccc(C)c1C)Cc1cccc(C#N)c1	ZINC001481015044	1393091914	/nfs/dbraw/zinc/09/19/14/1393091914.db2.gz	KEAABJBEUBWIBI-UHFFFAOYSA-N	0	3	335.451	3.427	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2ccc(F)cn2)CCCC[C@H]1C	ZINC001481955290	1394617016	/nfs/dbraw/zinc/61/70/16/1394617016.db2.gz	DWWJKLZGVNGVOV-PXAZEXFGSA-N	0	3	339.842	3.242	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cn(C(C)(C)C)nc1C)C(C)C	ZINC001698961367	1406715029	/nfs/dbraw/zinc/71/50/29/1406715029.db2.gz	LEIBWBPINQFSAW-OAHLLOKOSA-N	0	3	340.899	3.043	20	30		EGEDHN
CC1(C(=O)NC[C@@]2(C)CCCN(Cc3ccc(C#N)cc3)C2)CC1	ZINC001484161634	1395295888	/nfs/dbraw/zinc/29/58/88/1395295888.db2.gz	SNHKOXWJBMXUGQ-LJQANCHMSA-N	0	3	325.456	3.077	20	30		EGEDHN
C[C@@H](CN(C)C(=O)C(C)(C)C1CCC1)NCc1ccc(C#N)s1	ZINC001485906899	1396163665	/nfs/dbraw/zinc/16/36/65/1396163665.db2.gz	SYABLEHHJIBCNN-ZDUSSCGKSA-N	0	3	333.501	3.383	20	30		EGEDHN
N#Cc1cccc(CNCc2ccc(CNC(=O)CC3CC3)cc2)c1	ZINC001495482225	1396536579	/nfs/dbraw/zinc/53/65/79/1396536579.db2.gz	ZDCMODVNYNBHGP-UHFFFAOYSA-N	0	3	333.435	3.264	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccnn2[C@H](C)CC)CCCC1	ZINC001495918734	1396572327	/nfs/dbraw/zinc/57/23/27/1396572327.db2.gz	NQKIDVRKIWLQTN-CQSZACIVSA-N	0	3	338.883	3.239	20	30		EGEDHN
CC(C)CCC(=O)N1CC[C@@H](NCc2ccccc2C#N)[C@@H](C)C1	ZINC001496329506	1396652451	/nfs/dbraw/zinc/65/24/51/1396652451.db2.gz	JBHCNWMQYDGNNA-QFBILLFUSA-N	0	3	327.472	3.321	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cc(C)c(F)cc1F)C(C)C	ZINC001496572910	1396716347	/nfs/dbraw/zinc/71/63/47/1396716347.db2.gz	ZUUBZBUNYYJQLH-HNNXBMFYSA-N	0	3	330.806	3.370	20	30		EGEDHN
CCCCCCCN1CC[C@H](NC(=O)c2ncc(OC)cc2F)C1	ZINC001690093402	1404296324	/nfs/dbraw/zinc/29/63/24/1404296324.db2.gz	XAFWTABSZWGHNW-AWEZNQCLSA-N	0	3	337.439	3.004	20	30		EGEDHN
CCc1ccccc1C(=O)NC[C@@H](C)N(C)Cc1cccc(C#N)c1	ZINC001725176109	1425693066	/nfs/dbraw/zinc/69/30/66/1425693066.db2.gz	IZSHYVLGAZITDB-MRXNPFEDSA-N	0	3	335.451	3.371	20	30		EGEDHN
Cc1cccc(C(=O)NCC[C@H](C)NCc2cc(C#N)ccc2F)c1	ZINC001690830188	1404766572	/nfs/dbraw/zinc/76/65/72/1404766572.db2.gz	VJJJWROTGDGTEN-HNNXBMFYSA-N	0	3	339.414	3.304	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@@H](C)Cc2ccc(F)cc2)C1	ZINC001691481877	1405295452	/nfs/dbraw/zinc/29/54/52/1405295452.db2.gz	WBPLSUSFHVWBTK-YLQAJVPDSA-N	0	3	338.854	3.241	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)C[C@@H]2CCc3ccccc32)C1	ZINC001691529711	1405323983	/nfs/dbraw/zinc/32/39/83/1405323983.db2.gz	CSFNHHZDNFIAML-XIRDDKMYSA-N	0	3	332.875	3.343	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)CCc2cccc(F)c2F)C1	ZINC001691544375	1405332377	/nfs/dbraw/zinc/33/23/77/1405332377.db2.gz	BIRBTOWUCDXMFB-MQMHXKEQSA-N	0	3	342.817	3.134	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)CCOc2ccccc2C)C1	ZINC001691752822	1405472239	/nfs/dbraw/zinc/47/22/39/1405472239.db2.gz	SNLMCFMIDLJRMN-IYBDPMFKSA-N	0	3	336.863	3.001	20	30		EGEDHN
CC1(C(=O)NCC[C@H]2CCN(Cc3ccccc3C#N)C2)CCC1	ZINC001691900984	1405624198	/nfs/dbraw/zinc/62/41/98/1405624198.db2.gz	JZENKDMPNAADDA-INIZCTEOSA-N	0	3	325.456	3.077	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2csnc2C)CCCC[C@H]1C	ZINC001732262354	1428502891	/nfs/dbraw/zinc/50/28/91/1428502891.db2.gz	VHXAVVDCGQPSKV-BDJLRTHQSA-N	0	3	341.908	3.472	20	30		EGEDHN
C[C@@H](CN(C)Cc1cccc(C#N)c1)NC(=O)c1ccc(F)c(F)c1	ZINC001699445934	1412779911	/nfs/dbraw/zinc/77/99/11/1412779911.db2.gz	JEDADWAPCRASSH-ZDUSSCGKSA-N	0	3	343.377	3.087	20	30		EGEDHN
C=C(Br)CNCC(C)(C)CN(C)C(=O)[C@H]1CC1(C)C	ZINC001700441877	1414014290	/nfs/dbraw/zinc/01/42/90/1414014290.db2.gz	YAFFLQGZDMMVSK-GFCCVEGCSA-N	0	3	331.298	3.015	20	30		EGEDHN
Cc1cc(C(=O)NC[C@@H](C)N(C)Cc2cccc(C#N)c2)sc1C	ZINC001700485079	1414129799	/nfs/dbraw/zinc/12/97/99/1414129799.db2.gz	GVPOLURROPDOHB-CQSZACIVSA-N	0	3	341.480	3.487	20	30		EGEDHN
C[C@H](CN(C)[C@@H](C)c1ccc(Cl)cc1)NC(=O)c1cc(C#N)c[nH]1	ZINC001733035020	1429159112	/nfs/dbraw/zinc/15/91/12/1429159112.db2.gz	ZONXIUZZIKYHRY-OLZOCXBDSA-N	0	3	344.846	3.351	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)C2(Cc3ccccc3)CC2)C1	ZINC001707064195	1417178836	/nfs/dbraw/zinc/17/88/36/1417178836.db2.gz	FVHUOIITAMSSQW-CALCHBBNSA-N	0	3	332.875	3.246	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)C[C@H](CC)C(C)C)C1	ZINC001707077459	1417187775	/nfs/dbraw/zinc/18/77/75/1417187775.db2.gz	NGXZLYKVGFPZRS-SOUVJXGZSA-N	0	3	345.325	3.452	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)COC1CCCC1	ZINC001707432925	1417337678	/nfs/dbraw/zinc/33/76/78/1417337678.db2.gz	HBLCNANRBDNALK-HOCLYGCPSA-N	0	3	328.884	3.057	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1cn(C(C)C)cn1	ZINC001707444705	1417348423	/nfs/dbraw/zinc/34/84/23/1417348423.db2.gz	ROCDMDNYRHJYLU-HOCLYGCPSA-N	0	3	338.883	3.189	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1cc(CCC)n[nH]1	ZINC001713001436	1417554982	/nfs/dbraw/zinc/55/49/82/1417554982.db2.gz	ZDSJEZAAVHMQOY-XJKSGUPXSA-N	0	3	338.883	3.088	20	30		EGEDHN
CC#CCN[C@H]1CCN(C(=O)[C@@H]2C[C@H]2c2cccc3ccccc32)C1	ZINC001713150724	1417730731	/nfs/dbraw/zinc/73/07/31/1417730731.db2.gz	UQJDHRMJDZVIAD-DZFGPLHGSA-N	0	3	332.447	3.157	20	30		EGEDHN
C[C@H](NC(=O)CC1(C)CC1)[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001713276368	1417897260	/nfs/dbraw/zinc/89/72/60/1417897260.db2.gz	UTJNVKBRBXWEDX-QFBILLFUSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@@H](CNC(=O)C1(C)CCCCC1)NCc1ccc(F)c(C#N)c1	ZINC001713335770	1417959894	/nfs/dbraw/zinc/95/98/94/1417959894.db2.gz	VRXWZJZRTSWWAM-AWEZNQCLSA-N	0	3	331.435	3.262	20	30		EGEDHN
C[C@H](CCNC(=O)c1ccsc1)NCc1cc(C#N)ccc1F	ZINC001713402718	1418026212	/nfs/dbraw/zinc/02/62/12/1418026212.db2.gz	RFYFLDKONKPPOQ-GFCCVEGCSA-N	0	3	331.416	3.057	20	30		EGEDHN
Cc1cc(C(=O)NCC[C@H]2CCN(Cc3ccc(C#N)s3)C2)co1	ZINC001713729648	1418514327	/nfs/dbraw/zinc/51/43/27/1418514327.db2.gz	ZQXSQAVWBADHTO-AWEZNQCLSA-N	0	3	343.452	3.163	20	30		EGEDHN
CCCN(C(=O)[C@H](C)C#N)C1CCN(Cc2csc(C)c2)CC1	ZINC001713852946	1418649981	/nfs/dbraw/zinc/64/99/81/1418649981.db2.gz	CRXGAWMAPNPCEN-CQSZACIVSA-N	0	3	333.501	3.419	20	30		EGEDHN
CC1(CCC(=O)N[C@@H](CNCc2ccc(C#N)cc2F)C2CC2)CC1	ZINC001733187799	1429289475	/nfs/dbraw/zinc/28/94/75/1429289475.db2.gz	QWIILOGJBIDPNB-SFHVURJKSA-N	0	3	343.446	3.262	20	30		EGEDHN
C[C@H](CCNC(=O)C1CC(C)(C)C1)NCc1cc(C#N)ccc1F	ZINC001714467034	1419195480	/nfs/dbraw/zinc/19/54/80/1419195480.db2.gz	RNBVGICUOVPOGL-CYBMUJFWSA-N	0	3	331.435	3.118	20	30		EGEDHN
CCCC1(C(=O)NCC[C@@H]2CCN(Cc3ccccc3C#N)C2)CC1	ZINC001714879760	1419615567	/nfs/dbraw/zinc/61/55/67/1419615567.db2.gz	ZFAAOVDNCTWIJZ-QGZVFWFLSA-N	0	3	339.483	3.467	20	30		EGEDHN
C[C@H](c1ccc(C(C)(C)C)cc1)N1CC(CNC(=O)[C@@H](C)C#N)C1	ZINC001714962256	1419701390	/nfs/dbraw/zinc/70/13/90/1419701390.db2.gz	XTZYVVKBVPRWLR-LSDHHAIUSA-N	0	3	327.472	3.253	20	30		EGEDHN
CC[C@@H](CNC(=O)C1(CC)CCC1)NCc1cc(C#N)ccc1OC	ZINC001715067930	1419804008	/nfs/dbraw/zinc/80/40/08/1419804008.db2.gz	HWPBHXOBPBIIBG-KRWDZBQOSA-N	0	3	343.471	3.132	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2c(C)nsc2C)CCCC1	ZINC001715105365	1419847575	/nfs/dbraw/zinc/84/75/75/1419847575.db2.gz	YKCLOGWQZBEALW-UHFFFAOYSA-N	0	3	327.881	3.145	20	30		EGEDHN
C[C@@](CNCc1ccc(C#N)cc1F)(NC(=O)CC1(C)CC1)C1CC1	ZINC001715120663	1419865441	/nfs/dbraw/zinc/86/54/41/1419865441.db2.gz	WXODUXUBTKRWMD-FQEVSTJZSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C(Br)CNC[C@@H]1[C@@H](C)CCCN1C(=O)CC1CCC1	ZINC001715354185	1420054018	/nfs/dbraw/zinc/05/40/18/1420054018.db2.gz	HOYQXCGYVPSLNX-SWLSCSKDSA-N	0	3	343.309	3.302	20	30		EGEDHN
Cc1c(Cl)cccc1C(=O)N[C@@H](C)CNCc1ccc(C#N)s1	ZINC001715975405	1420435865	/nfs/dbraw/zinc/43/58/65/1420435865.db2.gz	BGPIFWUABHNMLE-NSHDSACASA-N	0	3	347.871	3.490	20	30		EGEDHN
CCc1ccc(F)cc1C(=O)N[C@@H](C)CNCc1ccc(C#N)s1	ZINC001715986714	1420444466	/nfs/dbraw/zinc/44/44/66/1420444466.db2.gz	MLQUDBBOFIJNIF-LBPRGKRZSA-N	0	3	345.443	3.229	20	30		EGEDHN
CCC1(C(=O)NCC2(NCc3cccc(C#N)c3)CC2)CCCC1	ZINC001716697532	1420850551	/nfs/dbraw/zinc/85/05/51/1420850551.db2.gz	VTJDECJXKBCXKO-UHFFFAOYSA-N	0	3	325.456	3.267	20	30		EGEDHN
C[C@@H](CN(C)Cc1cccc(C#N)c1)NC(=O)[C@@H]1CC[C@@H](C)CC1	ZINC001722904705	1424230619	/nfs/dbraw/zinc/23/06/19/1424230619.db2.gz	FQULYBHMNXWYHX-BXWFABGCSA-N	0	3	327.472	3.321	20	30		EGEDHN
N#Cc1cccc(CNC2(CNC(=O)c3cccc4c3CCC4)CC2)c1	ZINC001723594133	1424479561	/nfs/dbraw/zinc/47/95/61/1424479561.db2.gz	BAUSIBGYSFKMTF-UHFFFAOYSA-N	0	3	345.446	3.099	20	30		EGEDHN
CCCCC(=O)N[C@H](CNCc1cc(C#N)ccc1OC)C(C)(C)C	ZINC001725750547	1426428609	/nfs/dbraw/zinc/42/86/09/1426428609.db2.gz	YMSPOQNAQACBRG-GOSISDBHSA-N	0	3	345.487	3.378	20	30		EGEDHN
C#CCCN1CCC[C@H](NC(=O)[C@@H](c2ccc(F)cc2)C(C)C)C1	ZINC001731372735	1427302146	/nfs/dbraw/zinc/30/21/46/1427302146.db2.gz	IATGAGBDXMDGFM-RBUKOAKNSA-N	0	3	330.447	3.169	20	30		EGEDHN
Cc1ccc(CCC(=O)NCC[C@H](C)NCc2ccccc2C#N)cc1	ZINC001731731513	1427808528	/nfs/dbraw/zinc/80/85/28/1427808528.db2.gz	ZTCZQMRRGWOBQD-SFHVURJKSA-N	0	3	349.478	3.484	20	30		EGEDHN
CCCN(CCNC(=O)Cc1ccc(C)cc1)Cc1ccc(C#N)cc1	ZINC001731867010	1428115872	/nfs/dbraw/zinc/11/58/72/1428115872.db2.gz	PKCPWCPCUYLQLL-UHFFFAOYSA-N	0	3	349.478	3.438	20	30		EGEDHN
CCCN(CCNC(=O)Cc1ccccc1C)Cc1ccc(C#N)cc1	ZINC001731873908	1428135558	/nfs/dbraw/zinc/13/55/58/1428135558.db2.gz	RUIKFLIZABGYBO-UHFFFAOYSA-N	0	3	349.478	3.438	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1ccc2[nH]ccc2n1	ZINC001734020534	1437809888	/nfs/dbraw/zinc/80/98/88/1437809888.db2.gz	TZCJLASYQOPONF-UHFFFAOYSA-N	0	3	334.851	3.003	20	30		EGEDHN
CCc1ccsc1C(=O)N(C)C[C@@H](C)NCc1ccc(C#N)s1	ZINC001734357615	1438074479	/nfs/dbraw/zinc/07/44/79/1438074479.db2.gz	RZIIXKYKDHYIND-GFCCVEGCSA-N	0	3	347.509	3.494	20	30		EGEDHN
CCc1ccsc1C(=O)N(C)C[C@H](C)NCc1ccc(C#N)s1	ZINC001734357617	1438074844	/nfs/dbraw/zinc/07/48/44/1438074844.db2.gz	RZIIXKYKDHYIND-LBPRGKRZSA-N	0	3	347.509	3.494	20	30		EGEDHN
C#CCCCC(=O)N1CCCC[C@H]1[C@@H](C)NCC=C(Cl)Cl	ZINC001752144192	1440145456	/nfs/dbraw/zinc/14/54/56/1440145456.db2.gz	CFTJLDKTUPEVFP-KGLIPLIRSA-N	0	3	331.287	3.468	20	30		EGEDHN
Cc1c[nH]cc1C(=O)N1CCCC[C@@H]1[C@H](C)NCC#Cc1ccccc1	ZINC001752154639	1440146703	/nfs/dbraw/zinc/14/67/03/1440146703.db2.gz	DBZDUDZYOKFYFI-GHTZIAJQSA-N	0	3	349.478	3.348	20	30		EGEDHN
C=C1CCC(C(=O)NCCCN(CC)[C@H](C)c2cnccn2)CC1	ZINC001752209639	1440154819	/nfs/dbraw/zinc/15/48/19/1440154819.db2.gz	BENYFIYTWOVTGR-MRXNPFEDSA-N	0	3	330.476	3.112	20	30		EGEDHN
CC(C)C#CC(=O)N(C)C1CCN([C@H]2CCc3c2cccc3F)CC1	ZINC001752299558	1440167392	/nfs/dbraw/zinc/16/73/92/1440167392.db2.gz	HKKHDILCJAZHDG-FQEVSTJZSA-N	0	3	342.458	3.395	20	30		EGEDHN
C=C(C)CN1CCC(N(CCC)C(=O)[C@@H](C)Oc2cccnc2)CC1	ZINC001752439494	1440180982	/nfs/dbraw/zinc/18/09/82/1440180982.db2.gz	INKWRJWOYJFFFX-QGZVFWFLSA-N	0	3	345.487	3.128	20	30		EGEDHN
C=CCN1CCC(N(CCC)C(=O)C[C@@H]2CCO[C@H](CC)C2)CC1	ZINC001752442260	1440181468	/nfs/dbraw/zinc/18/14/68/1440181468.db2.gz	RXNPQYJTSKVETR-IEBWSBKVSA-N	0	3	336.520	3.471	20	30		EGEDHN
CC(F)(F)C(C)(C)C(=O)NC[C@@H](NCC#Cc1ccccc1)C1CC1	ZINC001752494311	1440187163	/nfs/dbraw/zinc/18/71/63/1440187163.db2.gz	NTMFFRDDUJHUPG-QGZVFWFLSA-N	0	3	348.437	3.204	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)N1CCC[C@H](CN(C)CC#Cc2ccc(F)cc2)C1	ZINC001752516381	1440191354	/nfs/dbraw/zinc/19/13/54/1440191354.db2.gz	DRFKSLHGFJTVBU-YVWKXTFCSA-N	0	3	342.458	3.004	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2n[nH]cc2c1	ZINC001752543397	1440194878	/nfs/dbraw/zinc/19/48/78/1440194878.db2.gz	YOLRTEYTTNXAMY-JCGIZDLHSA-N	0	3	338.455	3.206	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)c1cccc(OC)c1F	ZINC001752543965	1440194963	/nfs/dbraw/zinc/19/49/63/1440194963.db2.gz	YQZQLWSVCCFBMA-OAGGEKHMSA-N	0	3	346.446	3.478	20	30		EGEDHN
CCC(CC)[C@@H](C)C(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001752579606	1440195760	/nfs/dbraw/zinc/19/57/60/1440195760.db2.gz	LISREJOICGONLB-KDOFPFPSSA-N	0	3	345.462	3.460	20	30		EGEDHN
CCC(C)(C)CC(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2OC)C1	ZINC001752632955	1440197193	/nfs/dbraw/zinc/19/71/93/1440197193.db2.gz	NEEOXKADDMQISJ-QAQDUYKDSA-N	0	3	343.471	3.130	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1C[C@H](NCc2cnc(Cl)s2)C1	ZINC001752669106	1440198807	/nfs/dbraw/zinc/19/88/07/1440198807.db2.gz	KEXXBGRWYQHLIU-XYPYZODXSA-N	0	3	327.881	3.136	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1ocnc1C	ZINC001752696263	1440201070	/nfs/dbraw/zinc/20/10/70/1440201070.db2.gz	PEKFHPIBYPKFOI-AYHJJNSGSA-N	0	3	343.471	3.363	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@H]2CN(Cc3ccccn3)CC[C@H]21	ZINC001752704255	1440202079	/nfs/dbraw/zinc/20/20/79/1440202079.db2.gz	CPCPZZKMPJWOHP-PKOBYXMFSA-N	0	3	341.499	3.497	20	30		EGEDHN
CC[C@@H]1CCC[C@@]1(C)C(=O)N[C@H]1C[C@@H](NCC#Cc2ccccc2)C1	ZINC001752738558	1440204451	/nfs/dbraw/zinc/20/44/51/1440204451.db2.gz	ZEJCRSOFUSZSHI-XWSHUIEDSA-N	0	3	338.495	3.491	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@H]1CCCN(Cc2cnccc2C)C1	ZINC001752784994	1440210795	/nfs/dbraw/zinc/21/07/95/1440210795.db2.gz	NOFIJWZGPHTLMW-QGZVFWFLSA-N	0	3	329.488	3.321	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@@H]1CCCN(Cc2c(C)onc2CC)C1	ZINC001752786064	1440211353	/nfs/dbraw/zinc/21/13/53/1440211353.db2.gz	JZFGZAUHUMHHSL-SJORKVTESA-N	0	3	347.503	3.476	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)CCc2cc(C)cc(C)c2)C1	ZINC001752788918	1440212767	/nfs/dbraw/zinc/21/27/67/1440212767.db2.gz	TZTODDDKUJFDFM-HXUWFJFHSA-N	0	3	326.484	3.088	20	30		EGEDHN
C=CCOCCN1CCCC[C@H]1CNC(=O)[C@H](C)c1cccc(C)c1	ZINC001752822722	1440221469	/nfs/dbraw/zinc/22/14/69/1440221469.db2.gz	MTYYNZTYBARKBL-QUCCMNQESA-N	0	3	344.499	3.272	20	30		EGEDHN
C=CCN1CCCC[C@H]1CNC(=O)CCc1c[nH]c2ccccc12	ZINC001752825167	1440223134	/nfs/dbraw/zinc/22/31/34/1440223134.db2.gz	MUCBFQJQRNXXLY-KRWDZBQOSA-N	0	3	325.456	3.257	20	30		EGEDHN
C=CCN1CCCC[C@@H]1CNC(=O)CCc1c[nH]c2ccccc12	ZINC001752825168	1440223208	/nfs/dbraw/zinc/22/32/08/1440223208.db2.gz	MUCBFQJQRNXXLY-QGZVFWFLSA-N	0	3	325.456	3.257	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@H]1CCCCN1C[C@H]1CC(C)(C)CO1	ZINC001752826661	1440223721	/nfs/dbraw/zinc/22/37/21/1440223721.db2.gz	ALOPROUUJYLYSY-IAGOWNOFSA-N	0	3	336.520	3.375	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)[C@H](OC(C)C)c1ccccc1	ZINC001752826280	1440223743	/nfs/dbraw/zinc/22/37/43/1440223743.db2.gz	ZCEALFDYYNXIST-WOJBJXKFSA-N	0	3	342.483	3.147	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)Cc2ccc(CC(C)C)cc2)C1	ZINC001752837388	1440228502	/nfs/dbraw/zinc/22/85/02/1440228502.db2.gz	SRFYYFRCHGRCLG-WIYYLYMNSA-N	0	3	340.511	3.278	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)CCc2ccc(C)cc2C)C1	ZINC001752842556	1440231404	/nfs/dbraw/zinc/23/14/04/1440231404.db2.gz	XZOJBBSKYTZCCW-FPOVZHCZSA-N	0	3	340.511	3.476	20	30		EGEDHN
C[C@H](CCNC(=O)[C@]1(C)CC=CCC1)NCc1cc(C#N)ccc1F	ZINC001753006841	1440266004	/nfs/dbraw/zinc/26/60/04/1440266004.db2.gz	RWPTVGOOLXELDE-FOIQADDNSA-N	0	3	343.446	3.428	20	30		EGEDHN
O=C(C#CC1CC1)NCCC[C@H]1CCCN1Cc1cccc(F)c1F	ZINC001753028015	1440271997	/nfs/dbraw/zinc/27/19/97/1440271997.db2.gz	BJUJIBJBQSXGTR-KRWDZBQOSA-N	0	3	346.421	3.239	20	30		EGEDHN
O=C(C#CC1CC1)NC[C@@H]1CCN([C@H]2CCc3c2cccc3Cl)C1	ZINC001753123593	1440314548	/nfs/dbraw/zinc/31/45/48/1440314548.db2.gz	FDYNRZHLMIOUPP-KXBFYZLASA-N	0	3	342.870	3.179	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@H]1CCN(Cc2cn(C(C)C)nc2C)C1	ZINC001753132289	1440317118	/nfs/dbraw/zinc/31/71/18/1440317118.db2.gz	LUMQFMVNHCJGRG-QZTJIDSGSA-N	0	3	346.519	3.313	20	30		EGEDHN
C=C(C)CN(CCNC(=O)c1cc(C)oc1C(F)(F)F)C1CC1	ZINC001753160037	1440333145	/nfs/dbraw/zinc/33/31/45/1440333145.db2.gz	GHISQUWJCRBTPZ-UHFFFAOYSA-N	0	3	330.350	3.377	20	30		EGEDHN
CN(CCNCc1ccc(C#N)cc1)C(=O)c1ccc(Cl)cc1F	ZINC001753210954	1440339257	/nfs/dbraw/zinc/33/92/57/1440339257.db2.gz	WRZJLLIQKMXEPJ-UHFFFAOYSA-N	0	3	345.805	3.213	20	30		EGEDHN
C#CCCN[C@H](CNC(=O)c1cnoc1-c1ccco1)c1ccccc1	ZINC001753300008	1440353711	/nfs/dbraw/zinc/35/37/11/1440353711.db2.gz	LZLLIFCJBWDTBC-QGZVFWFLSA-N	0	3	349.390	3.019	20	30		EGEDHN
C#CCCN[C@H](CNC(=O)CC1CCC(OC)CC1)c1ccccc1	ZINC001753302656	1440354516	/nfs/dbraw/zinc/35/45/16/1440354516.db2.gz	HQGWGRKOXAPVQE-LYBXBRPPSA-N	0	3	342.483	3.052	20	30		EGEDHN
C=CC1(CC(=O)NC[C@@H](NC[C@@H](C)O)c2ccccc2)CCCCC1	ZINC001753309028	1440356122	/nfs/dbraw/zinc/35/61/22/1440356122.db2.gz	AWBFZUUWMUHYPV-IEBWSBKVSA-N	0	3	344.499	3.341	20	30		EGEDHN
C=CCN[C@@H](CNC(=O)[C@@H]1CCc2ccccc2O1)c1ccccc1	ZINC001753311414	1440356816	/nfs/dbraw/zinc/35/68/16/1440356816.db2.gz	NHPRVTPSQDPKOS-ICSRJNTNSA-N	0	3	336.435	3.013	20	30		EGEDHN
C#CCCN1CC[C@H](N(CCC)C(=O)c2cccc(F)c2Cl)C1	ZINC001753326200	1440366900	/nfs/dbraw/zinc/36/69/00/1440366900.db2.gz	GMPCZRNWPVONJL-AWEZNQCLSA-N	0	3	336.838	3.429	20	30		EGEDHN
CN(CC#Cc1ccccc1)C[C@H]1CCN(C(=O)CCC(C)(F)F)C1	ZINC001753350733	1440377880	/nfs/dbraw/zinc/37/78/80/1440377880.db2.gz	QBUSVJRQYNFAIV-GOSISDBHSA-N	0	3	348.437	3.254	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H]2C[C@H]1CN2C(=O)c1cccc(C(C)C)n1	ZINC001753423709	1440396009	/nfs/dbraw/zinc/39/60/09/1440396009.db2.gz	VVALCSZWXMPFGF-ULQDDVLXSA-N	0	3	327.472	3.458	20	30		EGEDHN
CC#CCCCC(=O)N(C)[C@H]1CCN(Cc2cccc(OC)c2C)C1	ZINC001753440968	1440401849	/nfs/dbraw/zinc/40/18/49/1440401849.db2.gz	AAQCOECZIGAOEU-IBGZPJMESA-N	0	3	342.483	3.230	20	30		EGEDHN
C=CCOCCN1CC[C@@H](N(C)C(=O)C[C@@H](C)c2ccccc2C)C1	ZINC001753445537	1440403843	/nfs/dbraw/zinc/40/38/43/1440403843.db2.gz	OADSKFHMKGIUFH-RTBURBONSA-N	0	3	344.499	3.224	20	30		EGEDHN
C=CCOCCN1CC[C@@H](N(C)C(=O)C[C@H](C)c2ccccc2C)C1	ZINC001753445536	1440403894	/nfs/dbraw/zinc/40/38/94/1440403894.db2.gz	OADSKFHMKGIUFH-RBUKOAKNSA-N	0	3	344.499	3.224	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)COc2cc(C)ccc2F)C1	ZINC001753457654	1440409007	/nfs/dbraw/zinc/40/90/07/1440409007.db2.gz	VVDHNOUFCZWGRK-INIZCTEOSA-N	0	3	334.435	3.012	20	30		EGEDHN
C=CCN1CC[C@@H](N(CC)C(=O)Cc2c[nH]c3cc(C)ccc23)C1	ZINC001753459935	1440410031	/nfs/dbraw/zinc/41/00/31/1440410031.db2.gz	VRTKGSYQINZCFQ-QGZVFWFLSA-N	0	3	325.456	3.128	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)CCc2ccc(OC)c(F)c2)C1	ZINC001753462914	1440411568	/nfs/dbraw/zinc/41/15/68/1440411568.db2.gz	ZTEBXOFJIMTYSI-KRWDZBQOSA-N	0	3	348.462	3.266	20	30		EGEDHN
CC[C@@H](CNC(=O)[C@@H]1CC1(C)C)NCC#Cc1ccccc1Cl	ZINC001753469809	1440413782	/nfs/dbraw/zinc/41/37/82/1440413782.db2.gz	GXKQMUHLZCIAKN-HOTGVXAUSA-N	0	3	332.875	3.222	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H](CC)NCC#Cc1ccc(Cl)cc1	ZINC001753472505	1440414305	/nfs/dbraw/zinc/41/43/05/1440414305.db2.gz	IUWNOVNIWOOQSL-LJQANCHMSA-N	0	3	344.886	3.370	20	30		EGEDHN
CC[C@@H](CNC(=O)c1ccoc1Cl)NCC#Cc1ccccc1	ZINC001753472250	1440414336	/nfs/dbraw/zinc/41/43/36/1440414336.db2.gz	CQWGKBJBEDNGKY-HNNXBMFYSA-N	0	3	330.815	3.083	20	30		EGEDHN
C=C(C)CCC(=O)NC1(CNCc2oc(CC)nc2C)CCCC1	ZINC001753504080	1440423957	/nfs/dbraw/zinc/42/39/57/1440423957.db2.gz	DOVRJEGGPNDQNL-UHFFFAOYSA-N	0	3	333.476	3.420	20	30		EGEDHN
Cc1cccnc1CNC[C@@]1(NC(=O)C#CC(C)C)CCCC[C@@H]1C	ZINC001753532992	1440431609	/nfs/dbraw/zinc/43/16/09/1440431609.db2.gz	VXFXSHXZUDWRIS-RXVVDRJESA-N	0	3	341.499	3.204	20	30		EGEDHN
C#CCCCCC(=O)N1CCC[C@H](CCNCc2c(C)noc2C)C1	ZINC001753542837	1440433717	/nfs/dbraw/zinc/43/37/17/1440433717.db2.gz	ALEMRNARHNJECL-GOSISDBHSA-N	0	3	345.487	3.203	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1CC[C@H](NC(=O)C2(CCF)CC2)CC1	ZINC001753583692	1440440805	/nfs/dbraw/zinc/44/08/05/1440440805.db2.gz	ABRYNFUFSAKMOT-IYARVYRRSA-N	0	3	343.446	3.215	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H]1C(=O)NC[C@@H](C)CNCc1ccccc1C#N	ZINC001753630917	1440452172	/nfs/dbraw/zinc/45/21/72/1440452172.db2.gz	QWILBKJMTFODKG-KFKAGJAMSA-N	0	3	327.472	3.082	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC1(NCc2cccnc2OC)CCCC1	ZINC001753667922	1440461008	/nfs/dbraw/zinc/46/10/08/1440461008.db2.gz	ODPSEDOXNUMNTH-IBGZPJMESA-N	0	3	345.487	3.211	20	30		EGEDHN
C=CCCCC(=O)NCC1(NCC(=C)Br)CCCC1	ZINC001753668357	1440461148	/nfs/dbraw/zinc/46/11/48/1440461148.db2.gz	WVJPYDGJKKLTBQ-UHFFFAOYSA-N	0	3	329.282	3.270	20	30		EGEDHN
Cc1cc(C(=O)N(C)[C@@H](C)CNCC#Cc2ccc(F)cc2)oc1C	ZINC001753685632	1440465393	/nfs/dbraw/zinc/46/53/93/1440465393.db2.gz	NOYDRPXHMGVULG-HNNXBMFYSA-N	0	3	342.414	3.137	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCCCN1C(=O)c1c(C)noc1C	ZINC001753770767	1440485472	/nfs/dbraw/zinc/48/54/72/1440485472.db2.gz	CEOOADCCZGKPMS-CQSZACIVSA-N	0	3	325.840	3.018	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCCCN1C(=O)c1cc(C)n(C)c1C	ZINC001753787280	1440488325	/nfs/dbraw/zinc/48/83/25/1440488325.db2.gz	CJXKYWRXFRKTNX-MRXNPFEDSA-N	0	3	337.895	3.369	20	30		EGEDHN
CN(CC#Cc1ccccc1)CCC1CCN(C(=O)C2(C)CC2)CC1	ZINC001753819817	1440495254	/nfs/dbraw/zinc/49/52/54/1440495254.db2.gz	FFHDUVBUADZHRH-UHFFFAOYSA-N	0	3	338.495	3.399	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@H](NCc2cc(C#N)ccc2F)C(C)C)o1	ZINC001753822708	1440496931	/nfs/dbraw/zinc/49/69/31/1440496931.db2.gz	ORFZFKAXUBMMOT-KRWDZBQOSA-N	0	3	343.402	3.143	20	30		EGEDHN
CC(C)[C@H](CNC(=O)C1CC=CC1)NCC#Cc1ccccc1Cl	ZINC001753827039	1440498617	/nfs/dbraw/zinc/49/86/17/1440498617.db2.gz	IEHQILVOBFGFPV-IBGZPJMESA-N	0	3	344.886	3.388	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)[C@@H](C)C1CCC1)NCc1ccc(C#N)cc1F	ZINC001753832713	1440500126	/nfs/dbraw/zinc/50/01/26/1440500126.db2.gz	SLRAHVHFEMMNQM-IFXJQAMLSA-N	0	3	345.462	3.364	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1c(C)noc1C(F)F)C(C)C	ZINC001753832790	1440500173	/nfs/dbraw/zinc/50/01/73/1440500173.db2.gz	USSJOVKBWLPZRE-JTQLQIEISA-N	0	3	335.782	3.017	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CCC[C@H]1CNCc1nc(C)sc1C	ZINC001753887436	1440521410	/nfs/dbraw/zinc/52/14/10/1440521410.db2.gz	JHEMUCWDYNCCGA-JKSUJKDBSA-N	0	3	335.517	3.491	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2CCC[C@H]2CNCc2ccn(CC)n2)CCC1	ZINC001753893696	1440522350	/nfs/dbraw/zinc/52/23/50/1440522350.db2.gz	LBALYNMKRUOBRI-WMZOPIPTSA-N	0	3	344.503	3.024	20	30		EGEDHN
C[C@H](CCNCc1cc(C#N)ccc1F)NC(=O)c1ccoc1Cl	ZINC001753960843	1440526221	/nfs/dbraw/zinc/52/62/21/1440526221.db2.gz	JMTRMOQLQFPOQG-LLVKDONJSA-N	0	3	349.793	3.242	20	30		EGEDHN
C[C@@H](C(=O)N[C@@H](C)CCNCc1ccccc1C#N)C1CCCC1	ZINC001754011902	1440531359	/nfs/dbraw/zinc/53/13/59/1440531359.db2.gz	FXEYROBXUHJNRO-JKSUJKDBSA-N	0	3	327.472	3.369	20	30		EGEDHN
C=C(Cl)CNCC[C@H](C)NC(=O)C12CC(c3ccccc3)(C1)C2	ZINC001754025535	1440533071	/nfs/dbraw/zinc/53/30/71/1440533071.db2.gz	LXQWVUFJUKXQDP-MNNVXMFVSA-N	0	3	332.875	3.345	20	30		EGEDHN
N#Cc1ccc(CNC/C=C\CNC(=O)c2cscc2Cl)cc1	ZINC001754134425	1440543827	/nfs/dbraw/zinc/54/38/27/1440543827.db2.gz	CXKLPTNZUMICKS-UPHRSURJSA-N	0	3	345.855	3.349	20	30		EGEDHN
C#CCC1(C(=O)NC/C=C\CNCc2cccnc2C)CCCCC1	ZINC001754211999	1440551361	/nfs/dbraw/zinc/55/13/61/1440551361.db2.gz	NOVWIZGDTPSGCC-FPLPWBNLSA-N	0	3	339.483	3.126	20	30		EGEDHN
C[C@H](CNCC#Cc1ccc(Cl)cc1)NC(=O)[C@@H]1CC=CCC1	ZINC001754217166	1440552114	/nfs/dbraw/zinc/55/21/14/1440552114.db2.gz	BUVYKTXWBCQTTF-NVXWUHKLSA-N	0	3	330.859	3.142	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H](C)CNCc2ccc(Cl)c(F)c2)cc1	ZINC001754237901	1440555197	/nfs/dbraw/zinc/55/51/97/1440555197.db2.gz	YMYAEFGNTKALFE-CYBMUJFWSA-N	0	3	344.817	3.369	20	30		EGEDHN
C=C[C@H](CC(=O)N[C@H](C)CNCc1cc(C)ns1)c1ccccc1	ZINC001754254566	1440558865	/nfs/dbraw/zinc/55/88/65/1440558865.db2.gz	HGRRWUIEGHUMSE-HZPDHXFCSA-N	0	3	343.496	3.406	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccc(Cl)cc1)NC(=O)Cc1ccsc1	ZINC001754257496	1440559441	/nfs/dbraw/zinc/55/94/41/1440559441.db2.gz	PELMVMWGEVTMID-AWEZNQCLSA-N	0	3	346.883	3.090	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)CN(C)Cc2cccc(C)c2)CCOCC1	ZINC001754343285	1440589141	/nfs/dbraw/zinc/58/91/41/1440589141.db2.gz	RAHWCFUSVCRHKT-GOSISDBHSA-N	0	3	344.499	3.304	20	30		EGEDHN
CCC(C)(CC)C(=O)N(C)CCCNCc1ccc(C#N)cc1F	ZINC001754414711	1440596671	/nfs/dbraw/zinc/59/66/71/1440596671.db2.gz	JVCHNNQBAMQHJE-UHFFFAOYSA-N	0	3	333.451	3.462	20	30		EGEDHN
C[C@]1(C(=O)N[C@H](CNCc2ccc(C#N)c(F)c2)C2CC2)C=CCC1	ZINC001754449739	1440600777	/nfs/dbraw/zinc/60/07/77/1440600777.db2.gz	YCAGMRCTUQMXPL-QUCCMNQESA-N	0	3	341.430	3.038	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)CCc1ccc2[nH]ccc2c1	ZINC001754489302	1440609777	/nfs/dbraw/zinc/60/97/77/1440609777.db2.gz	UVZIGUNOTYEMIT-SFHVURJKSA-N	0	3	325.456	3.257	20	30		EGEDHN
C=CCOCC(=O)N1C[C@H]2CCC[C@@H](C1)N2CC[C@@H]1CCC[C@H](C)C1	ZINC001754549959	1440629503	/nfs/dbraw/zinc/62/95/03/1440629503.db2.gz	AZNZOFMVBAEXCS-LWYYNNOASA-N	0	3	348.531	3.471	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@]2(C1)CCCN(Cc1ccccn1)C2	ZINC001754556422	1440631874	/nfs/dbraw/zinc/63/18/74/1440631874.db2.gz	ALUYCKHYFDMPBU-FQEVSTJZSA-N	0	3	327.472	3.252	20	30		EGEDHN
CC/C(C)=C/C(=O)N1CCC[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC001754610857	1440643902	/nfs/dbraw/zinc/64/39/02/1440643902.db2.gz	VBLAETRLNWRNAL-ZGUWOUCSSA-N	0	3	329.419	3.134	20	30		EGEDHN
CCCSCC(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1	ZINC001754624328	1440645915	/nfs/dbraw/zinc/64/59/15/1440645915.db2.gz	XBJCIMDJZPCZLB-UHFFFAOYSA-N	0	3	345.512	3.172	20	30		EGEDHN
C=CCCCC(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1	ZINC001754628648	1440647024	/nfs/dbraw/zinc/64/70/24/1440647024.db2.gz	AWHAAHIUQURICJ-UHFFFAOYSA-N	0	3	325.456	3.385	20	30		EGEDHN
C#CCN(C(=O)Cc1cc(C)ccc1F)C1CCN(CC(=C)C)CC1	ZINC001754642258	1440649313	/nfs/dbraw/zinc/64/93/13/1440649313.db2.gz	KZXIOEMPOGMPOA-UHFFFAOYSA-N	0	3	342.458	3.179	20	30		EGEDHN
CC#CCNC[C@H](NC(=O)c1nccs1)c1ccc2ccccc2c1	ZINC001754644592	1440649797	/nfs/dbraw/zinc/64/97/97/1440649797.db2.gz	UXUZILGWOZSHQM-SFHVURJKSA-N	0	3	349.459	3.380	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1cccc(C#N)c1	ZINC001754658181	1440654121	/nfs/dbraw/zinc/65/41/21/1440654121.db2.gz	UPWPHTWRTDXNTB-RTWAWAEBSA-N	0	3	349.478	3.317	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)CCOc2ccc(C)cc2C)C1	ZINC001754674163	1440659223	/nfs/dbraw/zinc/65/92/23/1440659223.db2.gz	OOXMYWPDGNSIJU-FQEVSTJZSA-N	0	3	330.472	3.229	20	30		EGEDHN
C#CCCCCCC(=O)N[C@]1(C)CCN(Cc2cccc(OC)c2)C1	ZINC001754678384	1440661210	/nfs/dbraw/zinc/66/12/10/1440661210.db2.gz	RSICSJMOSVZLRD-OAQYLSRUSA-N	0	3	342.483	3.360	20	30		EGEDHN
C#CCN1CCC(C)(CNC(=O)C[C@H](C)c2cccc(OC)c2)CC1	ZINC001754721970	1440673553	/nfs/dbraw/zinc/67/35/53/1440673553.db2.gz	HWWTUIKJXOTFJQ-KRWDZBQOSA-N	0	3	342.483	3.040	20	30		EGEDHN
C=CCN1CCC[C@@](C)(CNC(=O)c2csc(CC(C)C)n2)C1	ZINC001754734304	1440681490	/nfs/dbraw/zinc/68/14/90/1440681490.db2.gz	KQMLHGSLOXTQEW-SFHVURJKSA-N	0	3	335.517	3.360	20	30		EGEDHN
C=CCN1CCC[C@@](C)(CNC(=O)c2nc(Cl)sc2C)C1	ZINC001754736958	1440682518	/nfs/dbraw/zinc/68/25/18/1440682518.db2.gz	WLMVVLRDSGDCGQ-HNNXBMFYSA-N	0	3	327.881	3.123	20	30		EGEDHN
C=CC(C)(C)C(=O)NCC1(NCc2cc(C)ccc2F)CCOCC1	ZINC001754739485	1440682850	/nfs/dbraw/zinc/68/28/50/1440682850.db2.gz	OWHZRVGQXGLDJD-UHFFFAOYSA-N	0	3	348.462	3.101	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@H](CNC(=O)CCCc2ccccc2)C1	ZINC001754744757	1440684409	/nfs/dbraw/zinc/68/44/09/1440684409.db2.gz	MMPODXRUEKBCKL-GOSISDBHSA-N	0	3	348.437	3.106	20	30		EGEDHN
C/C=C(/C)C(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(Cc1ccc(C#N)cc1F)C2	ZINC001754782024	1440686519	/nfs/dbraw/zinc/68/65/19/1440686519.db2.gz	WEEWWGMGLFEMAJ-NVHJVYKVSA-N	0	3	341.430	3.133	20	30		EGEDHN
C=C(C)CN[C@@H](CNC(=O)c1cc(CC)n[nH]1)c1ccccc1CC	ZINC001754786028	1440687835	/nfs/dbraw/zinc/68/78/35/1440687835.db2.gz	SKBQLTKCDDCRPI-IBGZPJMESA-N	0	3	340.471	3.171	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)C2(CCF)CC2)C1	ZINC001754796454	1440689531	/nfs/dbraw/zinc/68/95/31/1440689531.db2.gz	BVPGSLKTQQNIHY-CRAIPNDOSA-N	0	3	343.446	3.025	20	30		EGEDHN
C=CCCC[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)c1ccccc1[O-])C2	ZINC001754829656	1440694198	/nfs/dbraw/zinc/69/41/98/1440694198.db2.gz	PAJPKMOVJWAZLL-BJWYYQGGSA-N	0	3	328.456	3.331	20	30		EGEDHN
C=CCCC[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)c1ccccc1[O-])C2	ZINC001754829656	1440694199	/nfs/dbraw/zinc/69/41/99/1440694199.db2.gz	PAJPKMOVJWAZLL-BJWYYQGGSA-N	0	3	328.456	3.331	20	30		EGEDHN
C=CCCC(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1C#N	ZINC001754829687	1440694407	/nfs/dbraw/zinc/69/44/07/1440694407.db2.gz	PYKQHAMZCXPLNM-PDFPEKILSA-N	0	3	337.467	3.384	20	30		EGEDHN
C#CCNCCN(Cc1ccccc1)C(=O)[C@@H]1CCCC[C@@H]1CC	ZINC001754836912	1440697046	/nfs/dbraw/zinc/69/70/46/1440697046.db2.gz	ACYCXARXJMKKAU-VQTJNVASSA-N	0	3	326.484	3.454	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@H]2[C@H]1CCN2Cc1cccc(C#N)c1	ZINC001754867146	1440703425	/nfs/dbraw/zinc/70/34/25/1440703425.db2.gz	HCCXSWACKOLMRI-LEWJYISDSA-N	0	3	349.478	3.317	20	30		EGEDHN
C#CCCN(C)Cc1ccccc1CNC(=O)c1ccc2c(c1)COC2	ZINC001754946813	1440713466	/nfs/dbraw/zinc/71/34/66/1440713466.db2.gz	YAMXUFFZDOAUGG-UHFFFAOYSA-N	0	3	348.446	3.102	20	30		EGEDHN
CC#CCN[C@H](C)c1ccc(CNC(=O)c2nc(CC)oc2C)cc1	ZINC001754949248	1440714570	/nfs/dbraw/zinc/71/45/70/1440714570.db2.gz	YSVSMGZRJCICGU-CQSZACIVSA-N	0	3	339.439	3.149	20	30		EGEDHN
C/C=C(\C)C(=O)N[C@H]1CC[C@H](CNCc2cc(F)ccc2C#N)CC1	ZINC001754950479	1440714782	/nfs/dbraw/zinc/71/47/82/1440714782.db2.gz	NATADVVSVPGXLE-IAAFNXNLSA-N	0	3	343.446	3.428	20	30		EGEDHN
C=C(C)CCC(=O)N1CCO[C@@H](CNCc2ccc(Cl)s2)C1	ZINC001754999560	1440725609	/nfs/dbraw/zinc/72/56/09/1440725609.db2.gz	BDKDXVIAQNEPPZ-ZDUSSCGKSA-N	0	3	342.892	3.075	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(CC)(NCc3nccn3C)CC2)CCC1	ZINC001755072754	1440747282	/nfs/dbraw/zinc/74/72/82/1440747282.db2.gz	RWYBVOHZHJZILE-UHFFFAOYSA-N	0	3	344.503	3.027	20	30		EGEDHN
C#CCCCCC(=O)N1CCC[C@]2(CCN(CCC(F)(F)F)C2)C1	ZINC001755078212	1440749916	/nfs/dbraw/zinc/74/99/16/1440749916.db2.gz	KTKSNAVMCOVROL-QGZVFWFLSA-N	0	3	344.421	3.447	20	30		EGEDHN
C=CCN1Cc2ccc(CNC(=O)C(C)(C)N3CCCCC3)cc2C1	ZINC001755101088	1440752450	/nfs/dbraw/zinc/75/24/50/1440752450.db2.gz	REDYSYLQXZFEOC-UHFFFAOYSA-N	0	3	341.499	3.069	20	30		EGEDHN
C=CCOCCCC(=O)N1C[C@@H](C)[C@@H](NCc2cc(C)ccc2F)C1	ZINC001755107133	1440753847	/nfs/dbraw/zinc/75/38/47/1440753847.db2.gz	JKQWHLPNSUXUNO-APWZRJJASA-N	0	3	348.462	3.053	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)[C@@H](C)Cc2ccc(F)cc2)C(C)(C)C1	ZINC001755143716	1440762363	/nfs/dbraw/zinc/76/23/63/1440762363.db2.gz	NSVZGLSOMZZTIL-MAUKXSAKSA-N	0	3	332.463	3.407	20	30		EGEDHN
COc1cccc(CN2CC[C@@H](NC(=O)C#CC(C)(C)C)C[C@H]2C)c1	ZINC001755159467	1440764269	/nfs/dbraw/zinc/76/42/69/1440764269.db2.gz	HFPVJRNQUQLTNY-SJLPKXTDSA-N	0	3	342.483	3.214	20	30		EGEDHN
CC(C)CCCN1CCc2ccccc2[C@@H]1CNC(=O)[C@H](C)C#N	ZINC001755172170	1440769500	/nfs/dbraw/zinc/76/95/00/1440769500.db2.gz	LIIXKTBPLQZUBF-APWZRJJASA-N	0	3	327.472	3.298	20	30		EGEDHN
C=CC1(CC(=O)NC2(CO)CCN(CC=C(C)C)CC2)CCCCC1	ZINC001755180756	1440771058	/nfs/dbraw/zinc/77/10/58/1440771058.db2.gz	FIPLPQOMWKOHAF-UHFFFAOYSA-N	0	3	348.531	3.422	20	30		EGEDHN
C=C(Cl)CNCC1CC(NC(=O)[C@@H](C)c2c(F)cccc2F)C1	ZINC001755213962	1440783732	/nfs/dbraw/zinc/78/37/32/1440783732.db2.gz	BGVVIPQGYSXQRK-HIFPTAJRSA-N	0	3	342.817	3.305	20	30		EGEDHN
C[C@@H](NC(=O)c1ccoc1)[C@H](C)NCC#Cc1ccc(Cl)cc1	ZINC001755225638	1440785751	/nfs/dbraw/zinc/78/57/51/1440785751.db2.gz	DURAHGTYRUFMBE-UONOGXRCSA-N	0	3	330.815	3.081	20	30		EGEDHN
Cc1cc(F)cc(C(=O)N[C@@H](C)[C@H](C)NCc2ccc(C#N)s2)c1	ZINC001755256451	1440793441	/nfs/dbraw/zinc/79/34/41/1440793441.db2.gz	KCCQTQLDXFTRNZ-STQMWFEESA-N	0	3	345.443	3.364	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)c(F)c1)[C@H](C)NC(=O)C(C1CC1)C1CC1	ZINC001755262558	1440794932	/nfs/dbraw/zinc/79/49/32/1440794932.db2.gz	LFVYDHKVCBXEHX-STQMWFEESA-N	0	3	343.446	3.116	20	30		EGEDHN
C=CCC1(C(=O)N(C)CC(C)(C)CNCc2cc(C)n(C)n2)CCC1	ZINC001755285724	1440801914	/nfs/dbraw/zinc/80/19/14/1440801914.db2.gz	NMABIWFCPVRWCS-UHFFFAOYSA-N	0	3	346.519	3.049	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@@H](C)N(C)[C@H]1CCc2c1cc(F)cc2F	ZINC001755297729	1440807114	/nfs/dbraw/zinc/80/71/14/1440807114.db2.gz	CMDWRZMJJOMUNS-ACJLOTCBSA-N	0	3	334.410	3.048	20	30		EGEDHN
CC(C)c1[nH]ccc1C(=O)NC[C@H](C)N(C)Cc1cccc(C#N)c1	ZINC001755312733	1440813996	/nfs/dbraw/zinc/81/39/96/1440813996.db2.gz	IIABRCWFHHIPQZ-HNNXBMFYSA-N	0	3	338.455	3.260	20	30		EGEDHN
C=C[C@@H](C(=O)NC[C@H](C)N(C)Cc1cccc(C#N)c1)c1ccccc1	ZINC001755328482	1440823226	/nfs/dbraw/zinc/82/32/26/1440823226.db2.gz	QBJWMRUEPLANQE-LAUBAEHRSA-N	0	3	347.462	3.465	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2cccc3n[nH]cc32)CCCCC1	ZINC001755353480	1440828552	/nfs/dbraw/zinc/82/85/52/1440828552.db2.gz	MLQUGKNKNGGOLE-UHFFFAOYSA-N	0	3	346.862	3.338	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)COc1ccc(C)cc1C	ZINC001755368521	1440836238	/nfs/dbraw/zinc/83/62/38/1440836238.db2.gz	SJOWNNJQXLOSNA-GOSISDBHSA-N	0	3	330.472	3.229	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2(Cc3ccccc3)CCC2)C(C)(C)C1	ZINC001755413279	1440847445	/nfs/dbraw/zinc/84/74/45/1440847445.db2.gz	WQQXGLCQDDKENY-LJQANCHMSA-N	0	3	338.495	3.249	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)C23CC(C(C)(C)C)(C2)C3)C(C)(C)C1	ZINC001755415868	1440848493	/nfs/dbraw/zinc/84/84/93/1440848493.db2.gz	MGYAGFVZGYLFHQ-ATIQYGATSA-N	0	3	348.531	3.232	20	30		EGEDHN
C=C(Cl)CNC[C@H]1C[C@H](NC(=O)C[C@@H](C)c2c(C)noc2C)C1	ZINC001755473506	1440859221	/nfs/dbraw/zinc/85/92/21/1440859221.db2.gz	NLTHIGNAWHROOQ-VCTAVGKDSA-N	0	3	339.867	3.022	20	30		EGEDHN
C[C@@H](CCCNCc1cc(C#N)ccc1F)NC(=O)[C@]1(C)C=CCC1	ZINC001755510853	1440863638	/nfs/dbraw/zinc/86/36/38/1440863638.db2.gz	JCONUKXSPJGGJQ-MGPUTAFESA-N	0	3	343.446	3.428	20	30		EGEDHN
CN(C(=O)CC(C)(C)C)[C@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001755555700	1440873068	/nfs/dbraw/zinc/87/30/68/1440873068.db2.gz	CNZNTRYALDVFDX-GOSISDBHSA-N	0	3	345.462	3.460	20	30		EGEDHN
CCC(C)(C)C(=O)N(C)[C@@H](CNCC#Cc1ccccc1)C1CC1	ZINC001755565552	1440875524	/nfs/dbraw/zinc/87/55/24/1440875524.db2.gz	BDNJNDQPVKXPNY-IBGZPJMESA-N	0	3	326.484	3.301	20	30		EGEDHN
C[C@@H](CN(C)C(=O)C1(C(F)F)CCCC1)NCC#Cc1ccccc1	ZINC001755600792	1440883974	/nfs/dbraw/zinc/88/39/74/1440883974.db2.gz	HSQYLQSRCJHVIW-INIZCTEOSA-N	0	3	348.437	3.300	20	30		EGEDHN
CCC[C@@H](CC)C(=O)N(C)C[C@@H](C)NCC#Cc1ccc(F)cc1	ZINC001755611825	1440887359	/nfs/dbraw/zinc/88/73/59/1440887359.db2.gz	VCQPSGYOTQLZOJ-SJLPKXTDSA-N	0	3	332.463	3.440	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@H](CO)NCc1ccc2ccccc2c1	ZINC001755637549	1440890685	/nfs/dbraw/zinc/89/06/85/1440890685.db2.gz	BOVAHSBVNJHGME-CTNGQTDRSA-N	0	3	340.467	3.009	20	30		EGEDHN
Cc1cscc1C(=O)N1CC[C@@H](NCC#Cc2ccccc2)[C@@H]1C	ZINC001755650630	1440891336	/nfs/dbraw/zinc/89/13/36/1440891336.db2.gz	OYIRCDDHVCKGIR-QFBILLFUSA-N	0	3	338.476	3.301	20	30		EGEDHN
C#CCCCC(=O)N1C[C@H](NCc2ccc(F)c(Cl)c2)C[C@H]1C	ZINC001755673519	1440894150	/nfs/dbraw/zinc/89/41/50/1440894150.db2.gz	ILGTXPXAVDQPEF-UKRRQHHQSA-N	0	3	336.838	3.362	20	30		EGEDHN
C=CCN1CC[C@]2(NC(=O)[C@@H](OCC)c3ccccc3)CCC[C@@H]12	ZINC001755705042	1440902401	/nfs/dbraw/zinc/90/24/01/1440902401.db2.gz	TZLDMFVAIDXAFJ-WSTZPKSXSA-N	0	3	328.456	3.063	20	30		EGEDHN
C=CCOCCN1CCC[C@@H](NC(=O)C2CCC(C)(C)CC2)[C@@H]1C	ZINC001755724376	1440908757	/nfs/dbraw/zinc/90/87/57/1440908757.db2.gz	XAEPMEPZKFSNDU-FUHWJXTLSA-N	0	3	336.520	3.375	20	30		EGEDHN
CCCCCC(C)(C)C(=O)N1C[C@H](NCC#CCOC)C(C)(C)C1	ZINC001755767065	1440916449	/nfs/dbraw/zinc/91/64/49/1440916449.db2.gz	UYDFJNOWSGECRS-KRWDZBQOSA-N	0	3	336.520	3.069	20	30		EGEDHN
C#CCCN(C)CCN(C(=O)CCc1ccc(C)cc1C)C(C)C	ZINC001755814060	1440922109	/nfs/dbraw/zinc/92/21/09/1440922109.db2.gz	NFTSNOWTBHKFQC-UHFFFAOYSA-N	0	3	328.500	3.428	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@H](CNCc1cncc(F)c1)C(C)(C)C	ZINC001755831331	1440928790	/nfs/dbraw/zinc/92/87/90/1440928790.db2.gz	XHWGNMPTGVNGHJ-WMLDXEAASA-N	0	3	335.467	3.444	20	30		EGEDHN
CC[C@H](F)CN1CCC([C@@H](C)NC(=O)CC#Cc2ccccc2)CC1	ZINC001755845427	1440933109	/nfs/dbraw/zinc/93/31/09/1440933109.db2.gz	JLWPYGANGAKTMV-XLIONFOSSA-N	0	3	344.474	3.393	20	30		EGEDHN
C#CCN1CCC([C@H](C)NC(=O)[C@@H](C)c2ccc(Cl)s2)CC1	ZINC001755851420	1440935131	/nfs/dbraw/zinc/93/51/31/1440935131.db2.gz	WLUJYWXNHRJFMH-STQMWFEESA-N	0	3	338.904	3.355	20	30		EGEDHN
CCC(CC)C(=O)N(C)C1CC(NCc2cc(C#N)ccc2OC)C1	ZINC001755853240	1440935493	/nfs/dbraw/zinc/93/54/93/1440935493.db2.gz	QYHPJJYZCICOII-UHFFFAOYSA-N	0	3	343.471	3.082	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N(C)C1CC(NCc2ccc(C#N)cc2F)C1	ZINC001755859846	1440936492	/nfs/dbraw/zinc/93/64/92/1440936492.db2.gz	ISXADJJBQLRJNC-RWBZWWBESA-N	0	3	343.446	3.379	20	30		EGEDHN
C=C(Cl)CNC1CC(N(C)C(=O)[C@@H](C)Cc2ccc(F)cc2)C1	ZINC001755865389	1440937625	/nfs/dbraw/zinc/93/76/25/1440937625.db2.gz	BHYCXCDBZMODBO-CDEQTRAXSA-N	0	3	338.854	3.336	20	30		EGEDHN
C=CCN1CC=C(CNC(=O)C2(Cc3ccc(F)cc3)CC2)CC1	ZINC001755895626	1440942630	/nfs/dbraw/zinc/94/26/30/1440942630.db2.gz	OGMSEIKYJXXRQG-UHFFFAOYSA-N	0	3	328.431	3.083	20	30		EGEDHN
CCN(CC)[C@H](Cn1c(C)nnc1N(C)[C@@H](C)CC#N)c1ccco1	ZINC001766597888	1441402790	/nfs/dbraw/zinc/40/27/90/1441402790.db2.gz	HHCDJKWCEOJLRX-GOEBONIOSA-N	0	3	344.463	3.001	20	30		EGEDHN
CCN(C(=O)c1cc(C#N)c[nH]1)[C@@H]1CCN([C@H](C)c2ccccc2)C1	ZINC000368537011	168369995	/nfs/dbraw/zinc/36/99/95/168369995.db2.gz	CSERRSTYGJWPDX-CRAIPNDOSA-N	0	3	336.439	3.184	20	30		EGEDHN
CCN(C(=O)c1cc(C#N)c[nH]1)[C@H]1CCN([C@@H](C)c2ccccc2)C1	ZINC000368537014	168370176	/nfs/dbraw/zinc/37/01/76/168370176.db2.gz	CSERRSTYGJWPDX-YJBOKZPZSA-N	0	3	336.439	3.184	20	30		EGEDHN
C[C@H](N[C@@H](CN1CCOCC1)c1ccccc1)c1ccc(C#N)cc1	ZINC000181421268	234180191	/nfs/dbraw/zinc/18/01/91/234180191.db2.gz	KVNRIJWPCOMZLG-UWJYYQICSA-N	0	3	335.451	3.282	20	30		EGEDHN
C[C@H](NCCCS(=O)(=O)Cc1ccccc1)c1ccc(C#N)cc1	ZINC000181543465	234224470	/nfs/dbraw/zinc/22/44/70/234224470.db2.gz	QJTCWXLZYUNEJC-INIZCTEOSA-N	0	3	342.464	3.214	20	30		EGEDHN
C[C@@H](CCN[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O)c1ccccc1	ZINC000194891824	240755963	/nfs/dbraw/zinc/75/59/63/240755963.db2.gz	JPCAPQYSOJADSX-LAUBAEHRSA-N	0	3	347.462	3.443	20	30		EGEDHN
C[C@@H](NC(=O)c1cccc(F)c1C#N)[C@H](c1ccccc1)N(C)C	ZINC000193654193	296105594	/nfs/dbraw/zinc/10/55/94/296105594.db2.gz	PAUJOCHJSKIKFK-FZKQIMNGSA-N	0	3	325.387	3.119	20	30		EGEDHN
CCOCCCN1CC[C@@H](Nc2snc(Cl)c2C#N)[C@H](C)C1	ZINC000265177031	247272256	/nfs/dbraw/zinc/27/22/56/247272256.db2.gz	CYOLZSMRWSQJEE-DGCLKSJQSA-N	0	3	342.896	3.217	20	30		EGEDHN
C[C@H](NC[C@@H](O)c1ccc(C#N)cc1)c1ccc(NC(=O)C2CC2)cc1	ZINC000268573813	252034728	/nfs/dbraw/zinc/03/47/28/252034728.db2.gz	BFASBMQRIKYCKB-VBKZILBWSA-N	0	3	349.434	3.291	20	30		EGEDHN
Cc1csc(C2(NC[C@@H](O)c3ccc(C#N)cc3)CCCC2)n1	ZINC000268638313	252091175	/nfs/dbraw/zinc/09/11/75/252091175.db2.gz	GONMBWDYJOCRIV-MRXNPFEDSA-N	0	3	327.453	3.416	20	30		EGEDHN
CCN(Cc1ccc(OC)cc1OC)C[C@@H](O)c1ccc(C#N)cc1	ZINC000268697375	252149092	/nfs/dbraw/zinc/14/90/92/252149092.db2.gz	QJUKOQHUOUVITA-LJQANCHMSA-N	0	3	340.423	3.131	20	30		EGEDHN
C[C@H](c1ccc([S@](C)=O)cc1)N(C)C[C@@H](O)c1ccc(C#N)cc1	ZINC000268729312	252179298	/nfs/dbraw/zinc/17/92/98/252179298.db2.gz	XAXHDLFYAKTBBS-PMCQGFSISA-N	0	3	342.464	3.022	20	30		EGEDHN
C[C@@H](N[C@H](C)c1ccc(NS(C)(=O)=O)cc1)c1ccc(C#N)cc1	ZINC000268835418	252284736	/nfs/dbraw/zinc/28/47/36/252284736.db2.gz	XVUANIZXWBWZEB-ZIAGYGMSSA-N	0	3	343.452	3.342	20	30		EGEDHN
COc1ccccc1[C@H](CNCc1ccc(C#N)o1)N1CCCCC1	ZINC000174282265	533013936	/nfs/dbraw/zinc/01/39/36/533013936.db2.gz	QBFMBTJKPUWZTN-IBGZPJMESA-N	0	3	339.439	3.477	20	30		EGEDHN
C[C@H](c1ccc(C#N)cc1)N1CCC[C@H](CNC(=O)C(C)(C)C)C1	ZINC000118399700	221145929	/nfs/dbraw/zinc/14/59/29/221145929.db2.gz	KBDUUTMITXDJPN-NVXWUHKLSA-N	0	3	327.472	3.494	20	30		EGEDHN
CC(C)(C)OC1CCN(CCC(=O)Nc2ccc(C#N)cc2)CC1	ZINC000119090353	221242224	/nfs/dbraw/zinc/24/22/24/221242224.db2.gz	SLCLQCXOVUWOCM-UHFFFAOYSA-N	0	3	329.444	3.166	20	30		EGEDHN
CCN(CCOc1cccc(C#N)c1)C[C@H]1COc2ccccc2O1	ZINC000338357312	141106372	/nfs/dbraw/zinc/10/63/72/141106372.db2.gz	ZJPWROQPHDCFGW-SFHVURJKSA-N	0	3	338.407	3.099	20	30		EGEDHN
CCN(C(=O)c1cccc(C#N)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000186323449	144130052	/nfs/dbraw/zinc/13/00/52/144130052.db2.gz	GJYYBJHCHOLGAH-HXUWFJFHSA-N	0	3	333.435	3.295	20	30		EGEDHN
N#Cc1nc(-c2ccco2)oc1N1CCN(C[C@@H]2CC=CCC2)CC1	ZINC000119629165	152217819	/nfs/dbraw/zinc/21/78/19/152217819.db2.gz	CLTRMMJNRZWUQB-OAHLLOKOSA-N	0	3	338.411	3.285	20	30		EGEDHN
COc1cc([C@@H](C)N[C@@H](C)c2ccc(C#N)cc2)ccc1OCCO	ZINC000341590174	155370868	/nfs/dbraw/zinc/37/08/68/155370868.db2.gz	UJBQKEVFIHCHHC-LSDHHAIUSA-N	0	3	340.423	3.350	20	30		EGEDHN
Cn1cc(CN2CCN(Cc3cccc4ccccc43)CC2)cc1C#N	ZINC000191189086	153179252	/nfs/dbraw/zinc/17/92/52/153179252.db2.gz	WNSXCNZLNCSDAU-UHFFFAOYSA-N	0	3	344.462	3.368	20	30		EGEDHN
CCN(CC)C(=O)C1(NCc2ccc(C#N)c(F)c2)CCCCC1	ZINC000192106637	153242828	/nfs/dbraw/zinc/24/28/28/153242828.db2.gz	CRSIYNRLHQPGFG-UHFFFAOYSA-N	0	3	331.435	3.358	20	30		EGEDHN
N#Cc1ccc(OCCCN2CCC[C@](O)(C(F)(F)F)CC2)cc1	ZINC000326627594	154184590	/nfs/dbraw/zinc/18/45/90/154184590.db2.gz	PATANWDSAQCXTN-MRXNPFEDSA-N	0	3	342.361	3.106	20	30		EGEDHN
COc1cccc([C@@H](CNc2nc3c(cc2C#N)CCC3)N(C)C)c1	ZINC000336889252	154231284	/nfs/dbraw/zinc/23/12/84/154231284.db2.gz	LJBBLSPDEZSUSS-LJQANCHMSA-N	0	3	336.439	3.165	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)Cc1cc(F)cc(F)c1	ZINC000348935416	156293291	/nfs/dbraw/zinc/29/32/91/156293291.db2.gz	PKJWPTXEXCCBQH-UHFFFAOYSA-N	0	3	329.394	3.400	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)s1)Cc1ccc(F)c(F)c1	ZINC000349034107	156324659	/nfs/dbraw/zinc/32/46/59/156324659.db2.gz	CJPBYCPHEQHGNB-UHFFFAOYSA-N	0	3	335.423	3.462	20	30		EGEDHN
C[C@@H](C(=O)N(Cc1ccc(C#N)cc1)C1CC1)N1CCCCCC1	ZINC000172098361	286743827	/nfs/dbraw/zinc/74/38/27/286743827.db2.gz	QRSYHOABIYZBNE-INIZCTEOSA-N	0	3	325.456	3.314	20	30		EGEDHN
CCN(Cc1cc(=O)n2c(C)cccc2n1)[C@H](C)c1ccc(C#N)cc1	ZINC000097153521	162047240	/nfs/dbraw/zinc/04/72/40/162047240.db2.gz	OVOQODGKXZVDRU-MRXNPFEDSA-N	0	3	346.434	3.458	20	30		EGEDHN
CC[C@@H](C)N[C@@H](CNC(=O)NCc1cccc(C#N)c1)c1ccco1	ZINC000350394917	165040469	/nfs/dbraw/zinc/04/04/69/165040469.db2.gz	BNUZMPYTROUAMM-PBHICJAKSA-N	0	3	340.427	3.080	20	30		EGEDHN
N#Cc1cccc(OCCCN2CC3(CCC3)[C@H]2[C@H]2CCCO2)c1	ZINC000352423411	165393802	/nfs/dbraw/zinc/39/38/02/165393802.db2.gz	NXGMUMPESDTGRN-RTBURBONSA-N	0	3	326.440	3.361	20	30		EGEDHN
CC[C@H](C)N[C@H](CNC(=O)c1cccc(C#N)c1C)c1ccco1	ZINC000359539467	167184197	/nfs/dbraw/zinc/18/41/97/167184197.db2.gz	IQKXNTNZKDOORA-SUMWQHHRSA-N	0	3	325.412	3.319	20	30		EGEDHN
CC[C@H](C)N[C@@H](CNC(=O)c1cccc(C#N)c1C)c1ccco1	ZINC000359539465	167184439	/nfs/dbraw/zinc/18/44/39/167184439.db2.gz	IQKXNTNZKDOORA-GUYCJALGSA-N	0	3	325.412	3.319	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N[C@H]1CCN(Cc2ccccc2)[C@H]1C	ZINC000359832650	167244194	/nfs/dbraw/zinc/24/41/94/167244194.db2.gz	LREULJUOMYMMCA-JXFKEZNVSA-N	0	3	333.435	3.260	20	30		EGEDHN
CC(C)(C)N1C[C@@H](N[C@@H]2CCCCc3cc(C#N)ccc32)CC1=O	ZINC000360664319	167382753	/nfs/dbraw/zinc/38/27/53/167382753.db2.gz	PAQBXWRXSYBUTA-FUHWJXTLSA-N	0	3	325.456	3.315	20	30		EGEDHN
N#Cc1cccc(OC2CCN(CCCO[C@H]3CCCCO3)CC2)c1	ZINC000366887109	168152753	/nfs/dbraw/zinc/15/27/53/168152753.db2.gz	UWSNCDJUOXNGGU-FQEVSTJZSA-N	0	3	344.455	3.335	20	30		EGEDHN
CS[C@H]1CN(c2nc3c(cc2C#N)CCCC3(C)C)C[C@@H]1N(C)C	ZINC000428167667	269810469	/nfs/dbraw/zinc/81/04/69/269810469.db2.gz	RPMYNMOAAWYHHG-HOTGVXAUSA-N	0	3	344.528	3.049	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)CCc1cccs1	ZINC000065930041	264932123	/nfs/dbraw/zinc/93/21/23/264932123.db2.gz	OCJQXQUSYVFIRS-UHFFFAOYSA-N	0	3	341.480	3.143	20	30		EGEDHN
CSc1ccc([C@@H](CNC(=O)c2cc(C#N)oc2C)N(C)C)cc1	ZINC000294273307	270042235	/nfs/dbraw/zinc/04/22/35/270042235.db2.gz	CBHJGEFBXJNBRL-QGZVFWFLSA-N	0	3	343.452	3.214	20	30		EGEDHN
C#CCNC(=O)[C@@H](C)N[C@@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000368057155	270045874	/nfs/dbraw/zinc/04/58/74/270045874.db2.gz	BUQCPCMPYJYZAQ-JKSUJKDBSA-N	0	3	331.419	3.014	20	30		EGEDHN
CCC[C@H](C)NC(=O)[C@H]1CCCN(Cc2ccc(C#N)c(C)c2)C1	ZINC000486674069	270056329	/nfs/dbraw/zinc/05/63/29/270056329.db2.gz	HTQFJALPXGPGRQ-LPHOPBHVSA-N	0	3	327.472	3.384	20	30		EGEDHN
Cc1cc(N(C)[C@H]2CCCN(C)C2)n2c3ccccc3nc2c1C#N	ZINC000525128941	270059451	/nfs/dbraw/zinc/05/94/51/270059451.db2.gz	UJNJIEKZZZQIFW-HNNXBMFYSA-N	0	3	333.439	3.198	20	30		EGEDHN
CCC1(CC)CN(C(=O)C(C#N)Cc2ccc(C#N)cc2)CCS1	ZINC000280210704	266010831	/nfs/dbraw/zinc/01/08/31/266010831.db2.gz	GAWRCVFHKSMHLY-KRWDZBQOSA-N	0	3	341.480	3.375	20	30		EGEDHN
CCCCCC(=O)NC1CCN(CCOc2cccc(C#N)c2)CC1	ZINC000299592920	266022574	/nfs/dbraw/zinc/02/25/74/266022574.db2.gz	UEYBJXCBMMRBEG-UHFFFAOYSA-N	0	3	343.471	3.098	20	30		EGEDHN
CCN(Cc1ccc(CN(C)C)cc1)C(=O)c1cc(C#N)oc1C	ZINC000280749438	266135908	/nfs/dbraw/zinc/13/59/08/266135908.db2.gz	XRXLRSOCYKHHAG-UHFFFAOYSA-N	0	3	325.412	3.184	20	30		EGEDHN
CCN(Cc1nnc(-c2ccc(C#N)cc2)o1)[C@@H]1CCOC(C)(C)C1	ZINC000289359665	266140712	/nfs/dbraw/zinc/14/07/12/266140712.db2.gz	ABGZEHZYHIJCQC-MRXNPFEDSA-N	0	3	340.427	3.388	20	30		EGEDHN
CCSCC[C@@H](C)N(C)C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000280298976	266344492	/nfs/dbraw/zinc/34/44/92/266344492.db2.gz	FPVVMHWQKWGOKW-RHSMWYFYSA-N	0	3	329.469	3.231	20	30		EGEDHN
CCS[C@@H]1CC[C@@H](N(C)C(=O)C(C#N)Cc2ccc(C#N)cc2)C1	ZINC000348320669	266346562	/nfs/dbraw/zinc/34/65/62/266346562.db2.gz	NXNSBDTYJADFNV-KZNAEPCWSA-N	0	3	341.480	3.373	20	30		EGEDHN
CC(=O)Nc1cccc(OCCN[C@H](C)c2ccc(C#N)c(F)c2)c1	ZINC000271977534	266749980	/nfs/dbraw/zinc/74/99/80/266749980.db2.gz	WFFXWRFEGXOHBC-CYBMUJFWSA-N	0	3	341.386	3.385	20	30		EGEDHN
C[C@@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccc(C#N)c(F)c1	ZINC000271966322	266975477	/nfs/dbraw/zinc/97/54/77/266975477.db2.gz	SPMSAKWGFYSNBI-IUODEOHRSA-N	0	3	333.407	3.357	20	30		EGEDHN
C[C@@H]1CC=CC[C@H]1C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000284219125	267010900	/nfs/dbraw/zinc/01/09/00/267010900.db2.gz	IOMVXUXDRILRNQ-VQIMIIECSA-N	0	3	325.456	3.051	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CCN(C(=O)c2ccc(C#N)cc2)C1	ZINC000324138656	267056308	/nfs/dbraw/zinc/05/63/08/267056308.db2.gz	LVRVEFVMTBCMEW-QGZVFWFLSA-N	0	3	333.435	3.152	20	30		EGEDHN
CCOC(=O)Nc1ccc(NC(=O)[C@@H](CC)N(CC)CC)cc1C#N	ZINC000493989013	267127629	/nfs/dbraw/zinc/12/76/29/267127629.db2.gz	NZZJUFFMOFYDNB-MRXNPFEDSA-N	0	3	346.431	3.186	20	30		EGEDHN
C[C@H](NCCOc1ccc(C#N)cc1)[C@@H]1OCCc2sccc21	ZINC000292415262	267181350	/nfs/dbraw/zinc/18/13/50/267181350.db2.gz	MJGDHOKOYDLXDP-UGSOOPFHSA-N	0	3	328.437	3.291	20	30		EGEDHN
C[C@H](NCCOc1ccccc1C#N)c1ccc([S@](C)=O)cc1	ZINC000271719299	267184187	/nfs/dbraw/zinc/18/41/87/267184187.db2.gz	CUSHAYZRTHSPTI-PSLXWICFSA-N	0	3	328.437	3.025	20	30		EGEDHN
CC[C@@H](C)N(CC(=O)NCc1ccc(C#N)cc1)Cc1ccccc1	ZINC000507706461	267185372	/nfs/dbraw/zinc/18/53/72/267185372.db2.gz	IOMMZGKBQHQUIA-QGZVFWFLSA-N	0	3	335.451	3.475	20	30		EGEDHN
CC[C@H](N[C@H]1CC(=O)N(c2cccc(OC)c2)C1)c1ccc(C#N)cc1	ZINC000521536258	267222672	/nfs/dbraw/zinc/22/26/72/267222672.db2.gz	OABGXSLRXNFOMS-PXNSSMCTSA-N	0	3	349.434	3.413	20	30		EGEDHN
CN(C(=O)/C=C\c1cccc(C#N)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000492106966	267270348	/nfs/dbraw/zinc/27/03/48/267270348.db2.gz	FBUGPVACVUXVOT-KUFMOJEASA-N	0	3	345.446	3.304	20	30		EGEDHN
CN(C)CCc1ccccc1NC(=O)NCc1ccc(C#N)c(F)c1	ZINC000455228526	267281607	/nfs/dbraw/zinc/28/16/07/267281607.db2.gz	NMUFSHSFEFGJPD-UHFFFAOYSA-N	0	3	340.402	3.123	20	30		EGEDHN
CN(CC(=O)NCc1cccc(C#N)c1)[C@H]1CCC[C@H]1c1ccccc1	ZINC000459668037	267298146	/nfs/dbraw/zinc/29/81/46/267298146.db2.gz	BBVKVYQTUWOOHT-SFTDATJTSA-N	0	3	347.462	3.443	20	30		EGEDHN
CN(CC(=O)NCc1cccc(C#N)c1)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000459668035	267298181	/nfs/dbraw/zinc/29/81/81/267298181.db2.gz	BBVKVYQTUWOOHT-RTWAWAEBSA-N	0	3	347.462	3.443	20	30		EGEDHN
CN(Cc1ccc(C#N)cn1)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1	ZINC000514870520	267315577	/nfs/dbraw/zinc/31/55/77/267315577.db2.gz	LPDFTCINZDQVFW-RTBURBONSA-N	0	3	325.387	3.444	20	30		EGEDHN
COC(=O)N1CCC([C@H](C)N[C@H](C)c2ccc(C#N)cc2F)CC1	ZINC000492554205	267376287	/nfs/dbraw/zinc/37/62/87/267376287.db2.gz	YWJGHPNQLDTDQD-QWHCGFSZSA-N	0	3	333.407	3.215	20	30		EGEDHN
Cc1cccc(CCN[C@H]2CCCN(c3ccc(C#N)cc3)C2=O)c1	ZINC000485227785	268052134	/nfs/dbraw/zinc/05/21/34/268052134.db2.gz	CWDHYICVPSHXLY-FQEVSTJZSA-N	0	3	333.435	3.194	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CSCCN2Cc2ccccc2)s1	ZINC000276974619	268074388	/nfs/dbraw/zinc/07/43/88/268074388.db2.gz	FWWDVYBBKXXMKT-MRXNPFEDSA-N	0	3	343.521	3.327	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCC2CCC(F)(F)CC2)cc1	ZINC000337321034	268085093	/nfs/dbraw/zinc/08/50/93/268085093.db2.gz	JADFHOUJSCFRGO-INIZCTEOSA-N	0	3	331.366	3.182	20	30		EGEDHN
N#Cc1ccc(OC2CCC([NH2+]Cc3cc(F)ccc3[O-])CC2)nc1	ZINC000180881286	268165243	/nfs/dbraw/zinc/16/52/43/268165243.db2.gz	GNUBUXFNOFPOOS-UHFFFAOYSA-N	0	3	341.386	3.278	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H]2[C@@H]2CCC[C@H]2O)c(OC(F)F)c1	ZINC000451426474	268219598	/nfs/dbraw/zinc/21/95/98/268219598.db2.gz	VAYOGWRFDBVPGI-ARFHVFGLSA-N	0	3	336.382	3.285	20	30		EGEDHN
N#Cc1cccc(C(=O)N2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)c1	ZINC000285936854	268237233	/nfs/dbraw/zinc/23/72/33/268237233.db2.gz	UPLHXMJKFPNIJV-JOCHJYFZSA-N	0	3	345.446	3.296	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1C[C@H]1c1ccc(Cl)cc1	ZINC000530235472	268303813	/nfs/dbraw/zinc/30/38/13/268303813.db2.gz	YOCOWSTXMDBAPK-FGTMMUONSA-N	0	3	342.826	3.097	20	30		EGEDHN
COCC[C@@H](c1ccccc1)N1CCN(c2ccccc2C#N)CC1	ZINC000339870217	274039386	/nfs/dbraw/zinc/03/93/86/274039386.db2.gz	ZSEDRWHYOYGJGE-NRFANRHFSA-N	0	3	335.451	3.458	20	30		EGEDHN
CS[C@H]1CN(c2c(C#N)cnc3c(C)cc(F)cc32)C[C@@H]1N(C)C	ZINC000340753528	274186226	/nfs/dbraw/zinc/18/62/26/274186226.db2.gz	LKEMNYMULRGRFC-HOTGVXAUSA-N	0	3	344.459	3.036	20	30		EGEDHN
CCN(CCn1cnc2ccccc2c1=O)[C@H](C)c1ccc(C#N)cc1	ZINC000172244554	279214086	/nfs/dbraw/zinc/21/40/86/279214086.db2.gz	NTYUALPZBUFRHH-MRXNPFEDSA-N	0	3	346.434	3.351	20	30		EGEDHN
CCN(CC)C(=O)C1(NCCOc2ccc(C#N)cc2)CCCCC1	ZINC000118847196	307488327	/nfs/dbraw/zinc/48/83/27/307488327.db2.gz	XXXYZQUOMZUAOS-UHFFFAOYSA-N	0	3	343.471	3.098	20	30		EGEDHN
CCS[C@@H]1CC[C@H](N(C)CC(=O)N(C)C2(C#N)CCCCC2)C1	ZINC000076069630	453958140	/nfs/dbraw/zinc/95/81/40/453958140.db2.gz	YHDUICLCCGPIGX-JKSUJKDBSA-N	0	3	337.533	3.277	20	30		EGEDHN
COC(=O)c1cccc(CN(C)[C@@H]2CCc3ccccc3C2)c1C#N	ZINC000535205503	314032342	/nfs/dbraw/zinc/03/23/42/314032342.db2.gz	IJTINOCOHMVWIV-GOSISDBHSA-N	0	3	334.419	3.334	20	30		EGEDHN
C[C@@]1(NCC(=O)NCc2ccc(C#N)cc2)CCCc2ccccc21	ZINC000537605818	314195280	/nfs/dbraw/zinc/19/52/80/314195280.db2.gz	RTSXILSNTCEPIX-OAQYLSRUSA-N	0	3	333.435	3.016	20	30		EGEDHN
C[C@@H](N[C@@H](C)c1ccc(C#N)cc1)[C@H]1CN(Cc2ccccc2)CCO1	ZINC000538396239	314244501	/nfs/dbraw/zinc/24/45/01/314244501.db2.gz	XLMVQZHIBNPHSB-NJNPRVFISA-N	0	3	349.478	3.498	20	30		EGEDHN
CC[C@H](N[C@H]1CCCN(c2ccc(C#N)cc2F)C1)c1ccn(C)n1	ZINC000541734835	314483494	/nfs/dbraw/zinc/48/34/94/314483494.db2.gz	NVEPYCBQBSJECI-RDJZCZTQSA-N	0	3	341.434	3.141	20	30		EGEDHN
CC(C)CN(C(=O)CCN(C)c1ccncc1)c1ccc(C#N)cc1	ZINC000543715357	314648156	/nfs/dbraw/zinc/64/81/56/314648156.db2.gz	CRTBAVBXNNNVQO-UHFFFAOYSA-N	0	3	336.439	3.469	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2NC[C@H](O)COc1ccc(F)cc1	ZINC000552970217	315239360	/nfs/dbraw/zinc/23/93/60/315239360.db2.gz	PDTOXMADNOOLAE-PXNSSMCTSA-N	0	3	340.398	3.104	20	30		EGEDHN
N#Cc1ccccc1NC(=O)CCNC1(c2ccccc2)CCOCC1	ZINC000556810677	315468537	/nfs/dbraw/zinc/46/85/37/315468537.db2.gz	QMIGJJLEICXTSR-UHFFFAOYSA-N	0	3	349.434	3.182	20	30		EGEDHN
CC(C)(C)C1CC(N[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)C1	ZINC000560610510	315712707	/nfs/dbraw/zinc/71/27/07/315712707.db2.gz	VBPKRWMIADDVMY-DAWZGUTISA-N	0	3	325.456	3.073	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@H]1CCCCN1CCCSCC#N	ZINC000074989913	454671301	/nfs/dbraw/zinc/67/13/01/454671301.db2.gz	JHDBVGNDZBAUOH-AWEZNQCLSA-N	0	3	327.494	3.012	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)c2c[nH]c(C#N)c2)N(CC)CC)cc1	ZINC000563736770	316063436	/nfs/dbraw/zinc/06/34/36/316063436.db2.gz	DRDNJFXJACTPSU-IBGZPJMESA-N	0	3	338.455	3.262	20	30		EGEDHN
C[C@H](OC[C@H](O)CNCc1ccc(C#N)cc1)c1ccc(Cl)cc1	ZINC000564845083	316216145	/nfs/dbraw/zinc/21/61/45/316216145.db2.gz	PTPOYPGYKPFINW-IFXJQAMLSA-N	0	3	344.842	3.440	20	30		EGEDHN
C[C@@]1(Cc2ccccc2)CCCN1Cc1cnc2c(C#N)cnn2c1	ZINC000564984894	316241443	/nfs/dbraw/zinc/24/14/43/316241443.db2.gz	CUNPBUVLIQULMG-FQEVSTJZSA-N	0	3	331.423	3.198	20	30		EGEDHN
N#Cc1cccc(C2(NC[C@@H]3CN(c4ccccc4)CCO3)CC2)c1	ZINC000565154556	316275751	/nfs/dbraw/zinc/27/57/51/316275751.db2.gz	BHEUQXWZTDMHQF-HXUWFJFHSA-N	0	3	333.435	3.042	20	30		EGEDHN
N#Cc1cccc(CNC[C@H](O)Cc2ccccc2C(F)(F)F)c1	ZINC000566106779	316417353	/nfs/dbraw/zinc/41/73/53/316417353.db2.gz	ZLORKYHWIRCHBF-MRXNPFEDSA-N	0	3	334.341	3.270	20	30		EGEDHN
COCCN1CCC(Nc2ccc(C(F)(F)F)c(C#N)c2)CC1	ZINC000166016991	454907322	/nfs/dbraw/zinc/90/73/22/454907322.db2.gz	QNLCNVZVTRZKBP-UHFFFAOYSA-N	0	3	327.350	3.100	20	30		EGEDHN
CC[C@H](NC[C@H](O)COc1ccc(C#N)cc1)c1ccc(F)cc1F	ZINC000179633908	323397337	/nfs/dbraw/zinc/39/73/37/323397337.db2.gz	TUJBRHARPPJGIV-KXBFYZLASA-N	0	3	346.377	3.317	20	30		EGEDHN
CCCC[C@@H](NCCS(=O)(=O)c1ccc(C#N)cc1)C1CCC1	ZINC000184886269	323681069	/nfs/dbraw/zinc/68/10/69/323681069.db2.gz	CGLITQBXSSSRQZ-GOSISDBHSA-N	0	3	334.485	3.280	20	30		EGEDHN
N#Cc1cc(Br)ccc1CN1CCN(C2CCCC2)CC1	ZINC000386768713	324268867	/nfs/dbraw/zinc/26/88/67/324268867.db2.gz	IADJUUWBXBQJSF-UHFFFAOYSA-N	0	3	348.288	3.381	20	30		EGEDHN
C[C@@H]1C[C@H](Nc2cc(Br)c(C#N)cc2F)CCN1C	ZINC000388242096	324273324	/nfs/dbraw/zinc/27/33/24/324273324.db2.gz	VPPWFSWDDQNDOE-MWLCHTKSSA-N	0	3	326.213	3.354	20	30		EGEDHN
N#Cc1cc(F)c(N2CC[C@@H](N3CCCC3)C2)cc1Br	ZINC000312734072	456593862	/nfs/dbraw/zinc/59/38/62/456593862.db2.gz	JYQXMNJEWJVPRB-GFCCVEGCSA-N	0	3	338.224	3.134	20	30		EGEDHN
CCc1ccc(CN[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)s1	ZINC000576565772	324639727	/nfs/dbraw/zinc/63/97/27/324639727.db2.gz	MLZOCMGYSGHAAO-GOSISDBHSA-N	0	3	339.464	3.073	20	30		EGEDHN
C[C@H]1CN(CCC(=O)Nc2ccc(C#N)c(Cl)c2)CC2(CCC2)O1	ZINC000579708981	325148673	/nfs/dbraw/zinc/14/86/73/325148673.db2.gz	MHNNIKZGDHRDER-ZDUSSCGKSA-N	0	3	347.846	3.184	20	30		EGEDHN
CCC[C@H](C)NC(=O)[C@H]1CCCN(Cc2ccc(OCC#N)cc2)C1	ZINC000264520539	455229508	/nfs/dbraw/zinc/22/95/08/455229508.db2.gz	ABKHCONBMJBJMM-WMZOPIPTSA-N	0	3	343.471	3.106	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN2CC[C@@H](N3CCCCC3)C2)c1C	ZINC000264619662	455249795	/nfs/dbraw/zinc/24/97/95/455249795.db2.gz	RINPLVAYGKBZTJ-GOSISDBHSA-N	0	3	329.488	3.034	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@@H]1CNCc1cc(C)c(Br)cn1	ZINC000623512622	460590746	/nfs/dbraw/zinc/59/07/46/460590746.db2.gz	OVRWJOXUTCGARQ-IUODEOHRSA-N	0	3	325.250	3.223	20	30		EGEDHN
C[C@@]1(C#N)CCCN(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)C1	ZINC000612354993	460603690	/nfs/dbraw/zinc/60/36/90/460603690.db2.gz	DMUPQNLPZIHHLF-ICSRJNTNSA-N	0	3	340.471	3.159	20	30		EGEDHN
C[C@]1(C#N)CCCN(C(=O)NC[C@H](c2cccs2)N2CCCC2)C1	ZINC000612357391	460604740	/nfs/dbraw/zinc/60/47/40/460604740.db2.gz	AFKNXVXRGYHNAA-CRAIPNDOSA-N	0	3	346.500	3.220	20	30		EGEDHN
Cc1ccccc1CN1CCCN(CCOc2ccc(C#N)cc2)CC1	ZINC000030153880	453834096	/nfs/dbraw/zinc/83/40/96/453834096.db2.gz	PDOKNVCIUXVKJJ-UHFFFAOYSA-N	0	3	349.478	3.453	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@H](C)N2CCCC[C@@H]2C)cc1OC	ZINC000032734296	453886638	/nfs/dbraw/zinc/88/66/38/453886638.db2.gz	AXVGANKSELAAAK-HOTGVXAUSA-N	0	3	346.471	3.253	20	30		EGEDHN
C[C@H](NCc1ccc(N2CCOCC2)c(F)c1)c1ccc(C#N)cc1	ZINC000066989452	453892687	/nfs/dbraw/zinc/89/26/87/453892687.db2.gz	PCOMYLVJLTWIAN-HNNXBMFYSA-N	0	3	339.414	3.385	20	30		EGEDHN
O=C(NCC#Cc1ccccc1)N[C@H](CN1CCCC1)c1ccccc1	ZINC000075690769	453919378	/nfs/dbraw/zinc/91/93/78/453919378.db2.gz	ANILWPDMZCPWOG-OAQYLSRUSA-N	0	3	347.462	3.174	20	30		EGEDHN
CN(C)CCN(Cc1cccs1)C(=O)/C=C/c1cccc(C#N)c1	ZINC000084250583	453979656	/nfs/dbraw/zinc/97/96/56/453979656.db2.gz	PRKAKVABFIUITB-CMDGGOBGSA-N	0	3	339.464	3.223	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)c1ccc2cc[nH]c2c1	ZINC000055388353	453980830	/nfs/dbraw/zinc/98/08/30/453980830.db2.gz	QLTUBWJDWGJWTH-UHFFFAOYSA-N	0	3	346.434	3.244	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cc(-c3ccccc3)on2)CC1	ZINC000085610585	454035449	/nfs/dbraw/zinc/03/54/49/454035449.db2.gz	CHRROGLPIMBJEG-UHFFFAOYSA-N	0	3	326.400	3.114	20	30		EGEDHN
N#Cc1cccc(C(=O)NC[C@@H]2CCCN(Cc3cccs3)C2)c1	ZINC000069777850	454143606	/nfs/dbraw/zinc/14/36/06/454143606.db2.gz	QMRWMHUNSXKXCJ-INIZCTEOSA-N	0	3	339.464	3.262	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H]2C[C@@H]2c2cccc(F)c2F)CC1	ZINC000119278430	454183550	/nfs/dbraw/zinc/18/35/50/454183550.db2.gz	OSQJLYNKRAMMGT-CVEARBPZSA-N	0	3	334.410	3.225	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H]2C[C@@H]2c2cc(F)ccc2F)CC1	ZINC000119279041	454183788	/nfs/dbraw/zinc/18/37/88/454183788.db2.gz	STSIWIYWIZLBFG-WBVHZDCISA-N	0	3	334.410	3.225	20	30		EGEDHN
C=C[C@@H](CC(=O)NC1CCN(CCOC(C)C)CC1)c1ccccc1	ZINC000119480207	454198604	/nfs/dbraw/zinc/19/86/04/454198604.db2.gz	KMYNRDCOISOEIV-SFHVURJKSA-N	0	3	344.499	3.352	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)[C@H]2C[C@@H](OCC)C23CCC3)CC1	ZINC000119567754	454205213	/nfs/dbraw/zinc/20/52/13/454205213.db2.gz	HUQARQCGKAWJMW-ZWKOTPCHSA-N	0	3	349.519	3.016	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2sc(C)cc2OC(F)F)CC1	ZINC000071907603	454251610	/nfs/dbraw/zinc/25/16/10/454251610.db2.gz	DWDXXJOSTOKNEM-UHFFFAOYSA-N	0	3	330.400	3.038	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](CC)c2ccc(OC)cc2)CC1	ZINC000078533572	454270608	/nfs/dbraw/zinc/27/06/08/454270608.db2.gz	HRJZNEKFPYXCKL-LJQANCHMSA-N	0	3	345.487	3.486	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000132387526	454333790	/nfs/dbraw/zinc/33/37/90/454333790.db2.gz	MOQZOMVPZGBMTG-NLWGTHIKSA-N	0	3	344.499	3.479	20	30		EGEDHN
C[C@@H](CO)SCC(=O)C(C#N)c1nc(-c2ccccc2)cs1	ZINC000079099151	454368422	/nfs/dbraw/zinc/36/84/22/454368422.db2.gz	PVAFUALCZPMCLA-WCQYABFASA-N	0	3	332.450	3.100	20	30		EGEDHN
Cc1cccc(C2(NCC(=O)N[C@](C)(C#N)C3CC3)CCCC2)c1	ZINC000072962865	454372156	/nfs/dbraw/zinc/37/21/56/454372156.db2.gz	WBFQEFKHLOKLAK-LJQANCHMSA-N	0	3	325.456	3.162	20	30		EGEDHN
CCN(Cc1cccc(Cl)c1)C[C@H](O)COc1ccc(C#N)cc1	ZINC000047958317	454425160	/nfs/dbraw/zinc/42/51/60/454425160.db2.gz	VBYURHQEUIGIAJ-SFHVURJKSA-N	0	3	344.842	3.473	20	30		EGEDHN
Cc1ccc(CN(CCN(C)C)C(=O)Nc2cccc(C#N)c2)o1	ZINC000048052669	454436990	/nfs/dbraw/zinc/43/69/90/454436990.db2.gz	ZQVAJPZXRFREJE-UHFFFAOYSA-N	0	3	326.400	3.055	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)C2(C#N)CCCC2)CCN1Cc1ccccc1	ZINC000079558700	454439541	/nfs/dbraw/zinc/43/95/41/454439541.db2.gz	WXFMZOGYAYDQNW-WMZOPIPTSA-N	0	3	325.456	3.240	20	30		EGEDHN
C[C@@H](CNC(=O)CSCc1ccc(C#N)cc1)N1CCCC[C@@H]1C	ZINC000048220681	454458412	/nfs/dbraw/zinc/45/84/12/454458412.db2.gz	UVYOJQPQEGIYOW-HOTGVXAUSA-N	0	3	345.512	3.171	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C(=O)c1cccc(CN2CCCC2)c1	ZINC000063916217	454458559	/nfs/dbraw/zinc/45/85/59/454458559.db2.gz	DVLIKLLXDPHJDZ-UHFFFAOYSA-N	0	3	333.435	3.426	20	30		EGEDHN
Cc1ccc(C)c([C@@H]2CCCN2CC(=O)N(CCC#N)CCC#N)c1	ZINC000133785799	454467821	/nfs/dbraw/zinc/46/78/21/454467821.db2.gz	IGJQGSUCXWPAIP-IBGZPJMESA-N	0	3	338.455	3.096	20	30		EGEDHN
C=CCc1cc(CN2CCC[C@@H](c3nc(C)no3)C2)cc(OC)c1O	ZINC000091832556	454478180	/nfs/dbraw/zinc/47/81/80/454478180.db2.gz	HCRIKOZLSWEQBC-MRXNPFEDSA-N	0	3	343.427	3.200	20	30		EGEDHN
CCCCNC(=O)C1(NCc2ccc(F)c(C#N)c2)CCCCC1	ZINC000122129832	454510424	/nfs/dbraw/zinc/51/04/24/454510424.db2.gz	GLPUBKFWVVIAMF-UHFFFAOYSA-N	0	3	331.435	3.406	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)[C@H]1CCOc2ccccc21)C(C)C	ZINC000102941953	454527992	/nfs/dbraw/zinc/52/79/92/454527992.db2.gz	INEOBSBGZXISLU-OALUTQOASA-N	0	3	342.483	3.368	20	30		EGEDHN
C#CCOc1ccccc1CN1CCC(C(=O)N(C)CCCC)CC1	ZINC000092145814	454529181	/nfs/dbraw/zinc/52/91/81/454529181.db2.gz	UVIBWBNYJIHNNR-UHFFFAOYSA-N	0	3	342.483	3.169	20	30		EGEDHN
C[C@](C#N)(NC(=O)CN(Cc1ccccc1)CC1CCC1)C1CC1	ZINC000065161423	454533555	/nfs/dbraw/zinc/53/35/55/454533555.db2.gz	UAJDAYNAJCENAT-HXUWFJFHSA-N	0	3	325.456	3.097	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN1CCC[C@@H](Cc2ccc(C)cc2)C1	ZINC000065254081	454544619	/nfs/dbraw/zinc/54/46/19/454544619.db2.gz	DUEBDVFZJZLAAK-ICSRJNTNSA-N	0	3	341.499	3.258	20	30		EGEDHN
Cc1ccc(C(=O)C(C#N)c2nnc3n2CCCCC3)cc1Cl	ZINC000103330820	454550199	/nfs/dbraw/zinc/55/01/99/454550199.db2.gz	HEEPYHYEAGFYKY-ZDUSSCGKSA-N	0	3	328.803	3.456	20	30		EGEDHN
N#CC(C(=O)Cc1ccc(Cl)cc1Cl)C(=O)Nc1ccccn1	ZINC000104055936	454574491	/nfs/dbraw/zinc/57/44/91/454574491.db2.gz	OTWSBJFFGSSMPV-LBPRGKRZSA-N	0	3	348.189	3.278	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1SCc1cccnc1	ZINC000074391946	454574569	/nfs/dbraw/zinc/57/45/69/454574569.db2.gz	HBGISOJDGWQOMQ-UHFFFAOYSA-N	0	3	343.500	3.180	20	30		EGEDHN
C=CCOCCCC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C	ZINC000080431790	454580332	/nfs/dbraw/zinc/58/03/32/454580332.db2.gz	RSCXJPRUYBAWIU-SFHVURJKSA-N	0	3	330.472	3.092	20	30		EGEDHN
CN(CCC#N)C(=O)CCN(Cc1cc(F)ccc1F)C1CCCC1	ZINC000092800304	454634681	/nfs/dbraw/zinc/63/46/81/454634681.db2.gz	XKNXWPFOHKUSQV-UHFFFAOYSA-N	0	3	349.425	3.472	20	30		EGEDHN
C[C@@H](CO)CSCC(=O)C(C#N)c1nc(-c2ccccc2)cs1	ZINC000074787366	454635986	/nfs/dbraw/zinc/63/59/86/454635986.db2.gz	YOGQXTOJHIFKRB-GXTWGEPZSA-N	0	3	346.477	3.348	20	30		EGEDHN
Cc1cc(C)cc(C2=CCN(CCC(=O)N(C)CCC#N)CC2)c1	ZINC000092808922	454636403	/nfs/dbraw/zinc/63/64/03/454636403.db2.gz	ZSPALDOIHHGQED-UHFFFAOYSA-N	0	3	325.456	3.155	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CCC[C@H](C(=O)NCC2CC2)C1	ZINC000135129117	454637128	/nfs/dbraw/zinc/63/71/28/454637128.db2.gz	SCUPXPQALITYRA-SFHVURJKSA-N	0	3	339.483	3.226	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H]1CCN(C(=O)/C=C/c2ccccc2C#N)C1	ZINC000081124033	454689533	/nfs/dbraw/zinc/68/95/33/454689533.db2.gz	WWVAKVGLTXAPHD-RJRNSMGGSA-N	0	3	345.446	3.304	20	30		EGEDHN
COC[C@@H]1CCCN(Cc2cn(CCC#N)nc2-c2ccccc2)C1	ZINC000093337444	454703580	/nfs/dbraw/zinc/70/35/80/454703580.db2.gz	LBKOWNCHKUNMDO-QGZVFWFLSA-N	0	3	338.455	3.322	20	30		EGEDHN
CC(C)(CCC#N)CNCc1cc2c(cc1OC(F)F)OCO2	ZINC000152697109	454714293	/nfs/dbraw/zinc/71/42/93/454714293.db2.gz	NATPMHUPJCRSOV-UHFFFAOYSA-N	0	3	326.343	3.436	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(N3CCCC3)c(F)c2)CC1	ZINC000106774829	454718429	/nfs/dbraw/zinc/71/84/29/454718429.db2.gz	IYUWXKNVRUATFQ-UHFFFAOYSA-N	0	3	345.462	3.196	20	30		EGEDHN
COc1ccc(CN(C)[C@H](CO)C(C)(C)C)cc1OCCCC#N	ZINC000093837456	454738081	/nfs/dbraw/zinc/73/80/81/454738081.db2.gz	VPMVIDSWNFMPJK-GOSISDBHSA-N	0	3	334.460	3.217	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H]2C[C@H](OCC)C23CCCC3)CC1	ZINC000176500302	454752476	/nfs/dbraw/zinc/75/24/76/454752476.db2.gz	LKYANDLSVSJKMA-ROUUACIJSA-N	0	3	349.519	3.064	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC[C@H](C)Oc2ccccc2C)CC1	ZINC000176497887	454752558	/nfs/dbraw/zinc/75/25/58/454752558.db2.gz	FBVIDRUEXFXCBF-KRWDZBQOSA-N	0	3	345.487	3.102	20	30		EGEDHN
N#CCSCCCN1CCN(c2ccc(C(F)(F)F)cc2)CC1	ZINC000124953169	454785030	/nfs/dbraw/zinc/78/50/30/454785030.db2.gz	PYSPSSPHZLBECT-UHFFFAOYSA-N	0	3	343.418	3.474	20	30		EGEDHN
COc1cc(OC)cc(N2CC[C@H](NCc3ccc(C#N)s3)C2)c1	ZINC000176981718	454807597	/nfs/dbraw/zinc/80/75/97/454807597.db2.gz	YICWJGFOQOYABH-ZDUSSCGKSA-N	0	3	343.452	3.005	20	30		EGEDHN
CN(C)[C@@H](CNC(=O)c1ccc(C#N)c(Cl)c1)c1ccccc1	ZINC000153628421	454814441	/nfs/dbraw/zinc/81/44/41/454814441.db2.gz	KQYRXVXEXXVIFO-KRWDZBQOSA-N	0	3	327.815	3.244	20	30		EGEDHN
C=CCN(Cc1c(C)nn(C)c1N1CCOCC1)CC1CCCCC1	ZINC000125621641	454835339	/nfs/dbraw/zinc/83/53/39/454835339.db2.gz	MPTBYZZAOKWXQS-UHFFFAOYSA-N	0	3	346.519	3.133	20	30		EGEDHN
CCCN(CC(=O)N[C@](C)(C#N)C1CC1)[C@@H]1CCc2ccccc2C1	ZINC000142384320	454836788	/nfs/dbraw/zinc/83/67/88/454836788.db2.gz	HHOVNPNFZKHZHV-TZIWHRDSSA-N	0	3	339.483	3.064	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)NCc2ccc(C#N)cc2)CN1Cc1ccccc1	ZINC000177210988	454837527	/nfs/dbraw/zinc/83/75/27/454837527.db2.gz	SZQDZNXGYWQDFV-OXQOHEQNSA-N	0	3	348.450	3.020	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1	ZINC000143003147	454839666	/nfs/dbraw/zinc/83/96/66/454839666.db2.gz	SIRNYWIPVGXWNR-HKUYNNGSSA-N	0	3	330.472	3.229	20	30		EGEDHN
C[C@@H](C(=O)N(C)C1(C#N)CCC1)N1CCC(Cc2ccccc2)CC1	ZINC000110660777	454850689	/nfs/dbraw/zinc/85/06/89/454850689.db2.gz	GJNYRIOQUMPRSD-KRWDZBQOSA-N	0	3	339.483	3.234	20	30		EGEDHN
C=CCN1CCC(Oc2ccccc2I)CC1	ZINC000177454299	454865648	/nfs/dbraw/zinc/86/56/48/454865648.db2.gz	OKARDNWHRGYIRG-UHFFFAOYSA-N	0	3	343.208	3.320	20	30		EGEDHN
CCN(CCNC(=O)Nc1cccc(C#Cc2ccccn2)c1)C1CC1	ZINC000111769870	454875624	/nfs/dbraw/zinc/87/56/24/454875624.db2.gz	DMMOVSBSFWYVPX-UHFFFAOYSA-N	0	3	348.450	3.087	20	30		EGEDHN
C=CC1CCN(C(=O)NC[C@H](c2cccs2)N2CCCC2)CC1	ZINC000111801056	454876250	/nfs/dbraw/zinc/87/62/50/454876250.db2.gz	DCMVLACTSLVWLK-MRXNPFEDSA-N	0	3	333.501	3.493	20	30		EGEDHN
N#CCCN(C(=O)CN1C[C@@H]2CCC[C@H]2C1)c1cccc(Cl)c1	ZINC000154324060	454884693	/nfs/dbraw/zinc/88/46/93/454884693.db2.gz	GKEJDZCXASDYED-GJZGRUSLSA-N	0	3	331.847	3.319	20	30		EGEDHN
C=CCNC(=O)c1ccc(NC[C@@H](c2ccco2)N(CC)CC)nc1	ZINC000112553996	454890349	/nfs/dbraw/zinc/89/03/49/454890349.db2.gz	OQOFRPMEYUEHFN-INIZCTEOSA-N	0	3	342.443	3.085	20	30		EGEDHN
C=C(Cl)COc1ccc([C@H](C)N[C@H]2CCN(C(=O)CC)C2)cc1	ZINC000126729940	454914449	/nfs/dbraw/zinc/91/44/49/454914449.db2.gz	UBXUNAMCQJQHGY-HOCLYGCPSA-N	0	3	336.863	3.479	20	30		EGEDHN
O=C(C#Cc1ccccc1)N1CCC(N2CCc3ccccc3C2)CC1	ZINC000266980273	455487794	/nfs/dbraw/zinc/48/77/94/455487794.db2.gz	FRSVIFOOYBHWGY-UHFFFAOYSA-N	0	3	344.458	3.087	20	30		EGEDHN
C=CCOc1ccc(CNCCC(=O)Nc2ccc(C)cn2)cc1	ZINC000113353521	454923977	/nfs/dbraw/zinc/92/39/77/454923977.db2.gz	BQAMPQKETRHOPU-UHFFFAOYSA-N	0	3	325.412	3.073	20	30		EGEDHN
C[C@@H](N[C@@H]1CCN(C(=O)C2CCCCC2)C1)c1ccc(C#N)cc1	ZINC000151058594	454931704	/nfs/dbraw/zinc/93/17/04/454931704.db2.gz	NKXSRGFJAVZTJX-DNVCBOLYSA-N	0	3	325.456	3.390	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCC2(OCCC)CCCCC2)CC1	ZINC000175742890	455490153	/nfs/dbraw/zinc/49/01/53/455490153.db2.gz	CUGYTLFKLREHHJ-UHFFFAOYSA-N	0	3	337.508	3.066	20	30		EGEDHN
Cc1ncc(CON=C(N)c2cccc(CN3CCCCC3)c2)s1	ZINC000170641635	454947148	/nfs/dbraw/zinc/94/71/48/454947148.db2.gz	YCRMVQHSXFGUAU-UHFFFAOYSA-N	0	3	344.484	3.275	20	30		EGEDHN
Cc1ccc(NC(=O)/C=C/c2cccc(C#N)c2)c(OCCN(C)C)c1	ZINC000151354224	454973317	/nfs/dbraw/zinc/97/33/17/454973317.db2.gz	SHXCWOPYZJTQQO-CSKARUKUSA-N	0	3	349.434	3.459	20	30		EGEDHN
CCN(CC(=O)NCC#Cc1cccc(C(F)(F)F)c1)CC(C)C	ZINC000114725393	454973591	/nfs/dbraw/zinc/97/35/91/454973591.db2.gz	NPPQAOXFJZZTNV-UHFFFAOYSA-N	0	3	340.389	3.151	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC(C)(c3ccccc3)CC2)CC1	ZINC000178779026	454976621	/nfs/dbraw/zinc/97/66/21/454976621.db2.gz	ILAMLMDFRWEJMR-UHFFFAOYSA-N	0	3	341.499	3.400	20	30		EGEDHN
COc1ccc([C@H](CCO)NC2CC(C#N)(c3ccccc3)C2)cc1	ZINC000127781434	454997302	/nfs/dbraw/zinc/99/73/02/454997302.db2.gz	YKQJLVQTJAHOPT-CKHPTIKVSA-N	0	3	336.435	3.332	20	30		EGEDHN
COCc1cccc(CN2CCCN(Cc3ccc(C#N)cc3)CC2)c1	ZINC000179184587	455017575	/nfs/dbraw/zinc/01/75/75/455017575.db2.gz	BXUZRJZCCAPKAK-UHFFFAOYSA-N	0	3	349.478	3.413	20	30		EGEDHN
Cc1cccc(C2(CN[C@@H](C(N)=O)c3ccc(C#N)cc3)CCCC2)c1	ZINC000115599234	455022658	/nfs/dbraw/zinc/02/26/58/455022658.db2.gz	LKRSGEOAHOJVQV-HXUWFJFHSA-N	0	3	347.462	3.495	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN1CCc2ccccc2CC1	ZINC000116299479	455051020	/nfs/dbraw/zinc/05/10/20/455051020.db2.gz	GATPRKSWHHAHBA-UHFFFAOYSA-N	0	3	325.437	3.049	20	30		EGEDHN
CN(CCC#N)c1ccc(CNCCOc2ncccc2Cl)cc1	ZINC000152082030	455070886	/nfs/dbraw/zinc/07/08/86/455070886.db2.gz	YCHRETYODNOOOR-UHFFFAOYSA-N	0	3	344.846	3.253	20	30		EGEDHN
C=CC[C@H](C)NC(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000116951210	455075481	/nfs/dbraw/zinc/07/54/81/455075481.db2.gz	LRUWBWRBZASUBY-INIZCTEOSA-N	0	3	345.487	3.171	20	30		EGEDHN
CC[C@H](Cc1ccccc1)N(C)CC(=O)NC1(C#N)CCCCC1	ZINC000128674340	455076486	/nfs/dbraw/zinc/07/64/86/455076486.db2.gz	FKBUUDRRBQRCHC-GOSISDBHSA-N	0	3	327.472	3.282	20	30		EGEDHN
N#CCc1ccccc1C(=O)NC[C@@H](c1cccs1)N1CCCC1	ZINC000600966302	460660468	/nfs/dbraw/zinc/66/04/68/460660468.db2.gz	MFOKWXKJJAXRPC-KRWDZBQOSA-N	0	3	339.464	3.381	20	30		EGEDHN
C[C@H](N[C@H](c1ccc(Cl)cc1)[C@H]1C[C@@H]1C)C(=O)N(C)CCC#N	ZINC000180021965	455117704	/nfs/dbraw/zinc/11/77/04/455117704.db2.gz	RLORCBSTKASKOR-MGBSGCIJSA-N	0	3	333.863	3.387	20	30		EGEDHN
N#Cc1cc([N+](=O)[O-])ccc1NCC1CCN(c2ccncc2)CC1	ZINC000180044557	455122224	/nfs/dbraw/zinc/12/22/24/455122224.db2.gz	MKHFQBMKBCULMR-UHFFFAOYSA-N	0	3	337.383	3.190	20	30		EGEDHN
C#CCOc1ccc(CNCc2ccc(N3CCCC3=O)cc2)cc1	ZINC000172112570	455123712	/nfs/dbraw/zinc/12/37/12/455123712.db2.gz	KKQBRUHCQASDSF-UHFFFAOYSA-N	0	3	334.419	3.115	20	30		EGEDHN
C#CCOc1ccc(CNCc2cc(OC)c(OC)c(OC)c2)cc1	ZINC000172112442	455124085	/nfs/dbraw/zinc/12/40/85/455124085.db2.gz	DPMYSQIOPPVNHI-UHFFFAOYSA-N	0	3	341.407	3.014	20	30		EGEDHN
CO[C@H](CNCc1cn(C)nc1-c1ccc(C#N)cc1)C(C)(C)C	ZINC000180270839	455153652	/nfs/dbraw/zinc/15/36/52/455153652.db2.gz	AOFPBPDRXFIRIB-QGZVFWFLSA-N	0	3	326.444	3.109	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCc2cccc(C(F)(F)F)c2)CC1	ZINC000264448235	455215024	/nfs/dbraw/zinc/21/50/24/455215024.db2.gz	YFGVNRNOKPJSKV-UHFFFAOYSA-N	0	3	341.377	3.155	20	30		EGEDHN
N#CCSCCCN(CCO)Cc1ccc(Cl)c(Cl)c1	ZINC000158198938	455279367	/nfs/dbraw/zinc/27/93/67/455279367.db2.gz	FBFWWCVIBODJRF-UHFFFAOYSA-N	0	3	333.284	3.435	20	30		EGEDHN
CN1CC[C@H]2[C@H](CCCN2C(=O)N[C@@H](CCC#N)c2ccccc2)C1	ZINC000183360498	455282155	/nfs/dbraw/zinc/28/21/55/455282155.db2.gz	SIZJSKBQYUGZPM-QYZOEREBSA-N	0	3	340.471	3.157	20	30		EGEDHN
C[C@@H]1CCN(C(=O)Cc2ccc(C#N)cc2)CCN1Cc1ccccc1	ZINC000173507432	455297345	/nfs/dbraw/zinc/29/73/45/455297345.db2.gz	ISYGCTANTODSID-GOSISDBHSA-N	0	3	347.462	3.224	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@@H](C)N(C)C[C@H]1CCCOC1	ZINC000245484599	455313037	/nfs/dbraw/zinc/31/30/37/455313037.db2.gz	HSHPSCAVBNHDIR-HZPDHXFCSA-N	0	3	336.501	3.010	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cc(C)ccc1[N+](=O)[O-])C(C)C	ZINC000173715159	455329329	/nfs/dbraw/zinc/32/93/29/455329329.db2.gz	AXOJCDXCBJFVMP-GOSISDBHSA-N	0	3	345.443	3.332	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCc1ccccc1CN1CCN(CC)CC1	ZINC000190510991	455335520	/nfs/dbraw/zinc/33/55/20/455335520.db2.gz	APZSJXUGJYVOSU-OAQYLSRUSA-N	0	3	343.515	3.043	20	30		EGEDHN
C[C@@H](NCc1cccnc1-n1cccn1)c1ccc(OCC#N)cc1	ZINC000181473368	455339856	/nfs/dbraw/zinc/33/98/56/455339856.db2.gz	QEPQZIXOSLIPNE-OAHLLOKOSA-N	0	3	333.395	3.020	20	30		EGEDHN
C[C@H](NCCC(=O)N(C)CCC#N)c1ccc(Cl)c(Cl)c1	ZINC000181531939	455350885	/nfs/dbraw/zinc/35/08/85/455350885.db2.gz	JPLYOVFVPZYHMB-NSHDSACASA-N	0	3	328.243	3.406	20	30		EGEDHN
CCCN(CC(=O)Nc1cccc(C#N)c1)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C	ZINC000265897519	455401154	/nfs/dbraw/zinc/40/11/54/455401154.db2.gz	TZFWKILBRMWJHQ-QRQLOZEOSA-N	0	3	341.455	3.022	20	30		EGEDHN
CC[C@@H](NCC#Cc1ccc(OC(F)(F)F)cc1)[C@@H]1CCCO1	ZINC000182371222	455499726	/nfs/dbraw/zinc/49/97/26/455499726.db2.gz	ZJPDSGSNOZCEIB-CVEARBPZSA-N	0	3	327.346	3.484	20	30		EGEDHN
CCOC(=O)[C@](C)(CNCc1cc(C#N)cs1)c1ccccc1	ZINC000191634125	455505584	/nfs/dbraw/zinc/50/55/84/455505584.db2.gz	VWPHHFAWWKHGME-GOSISDBHSA-N	0	3	328.437	3.230	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1CC[C@@H](c2ccccc2)[C@H](C)C1	ZINC000246726152	455519683	/nfs/dbraw/zinc/51/96/83/455519683.db2.gz	LXBUOKFIMMRFAP-ZHALLVOQSA-N	0	3	327.472	3.120	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)Cc1ccc(C#N)cc1	ZINC000267342870	455542877	/nfs/dbraw/zinc/54/28/77/455542877.db2.gz	BWXUKFAEPXGSNP-DYESRHJHSA-N	0	3	347.462	3.128	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000176120971	455543443	/nfs/dbraw/zinc/54/34/43/455543443.db2.gz	ZPSWNMOSMGJDOA-SCTDSRPQSA-N	0	3	330.472	3.137	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)c1cccc(C#N)c1	ZINC000267348428	455543674	/nfs/dbraw/zinc/54/36/74/455543674.db2.gz	CMXQBIZZYFMVEI-OXJNMPFZSA-N	0	3	333.435	3.199	20	30		EGEDHN
C=CCCOCC(=O)N(CC)[C@@H]1CCN([C@@H](C)c2ccccc2)C1	ZINC000620531724	460680064	/nfs/dbraw/zinc/68/00/64/460680064.db2.gz	NNFLORWIYPJXOK-PKOBYXMFSA-N	0	3	330.472	3.263	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CCCN(Cc2ccccc2)C[C@H]1C	ZINC000247065760	455554929	/nfs/dbraw/zinc/55/49/29/455554929.db2.gz	RVQRBZOWZZDAHD-MSOLQXFVSA-N	0	3	330.472	3.091	20	30		EGEDHN
C[C@@H](c1ccc(C(F)(F)F)cc1)N(C)CCC(=O)N(C)CCC#N	ZINC000271316382	455594878	/nfs/dbraw/zinc/59/48/78/455594878.db2.gz	AHCQHHPAJVKROB-ZDUSSCGKSA-N	0	3	341.377	3.460	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(CN[C@@H]3CCC[C@H](C#N)C3)cc2)C[C@H](C)O1	ZINC000185770304	455619996	/nfs/dbraw/zinc/61/99/96/455619996.db2.gz	JSNWOHOTYCJEJL-KJNZLNQQSA-N	0	3	341.499	3.468	20	30		EGEDHN
N#CCc1ccc(OC[C@H](O)CN2CCC[C@H]2c2ccccc2)cc1	ZINC000247750708	455644070	/nfs/dbraw/zinc/64/40/70/455644070.db2.gz	SIMVSEIQFYZBSC-CTNGQTDRSA-N	0	3	336.435	3.329	20	30		EGEDHN
C=CCNC(=O)CN[C@H]1CCC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000284343454	455671353	/nfs/dbraw/zinc/67/13/53/455671353.db2.gz	MWOGTTBKXSOAKG-GJZGRUSLSA-N	0	3	326.362	3.233	20	30		EGEDHN
CC[C@H](CSC)N(C)[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000192720671	455678370	/nfs/dbraw/zinc/67/83/70/455678370.db2.gz	KCCRNNCLYGQJGS-NVXWUHKLSA-N	0	3	331.485	3.127	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCC(NC(=O)c2ccccc2)CC1	ZINC000186163396	455707489	/nfs/dbraw/zinc/70/74/89/455707489.db2.gz	ASMZAWYQWZWYIF-UHFFFAOYSA-N	0	3	333.435	3.261	20	30		EGEDHN
Cn1cnc2cc(CN3CCC(Oc4cccc(C#N)c4)CC3)ccc21	ZINC000271713240	455731006	/nfs/dbraw/zinc/73/10/06/455731006.db2.gz	HQSXDBUEUXJRRD-UHFFFAOYSA-N	0	3	346.434	3.488	20	30		EGEDHN
N#C[C@H]1CCC[C@H](N[C@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)C1	ZINC000193059967	455739992	/nfs/dbraw/zinc/73/99/92/455739992.db2.gz	XNTFRIFVHFPBKE-MKBNYLNASA-N	0	3	335.810	3.256	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)c2cccc(F)c2C#N)CN1Cc1ccccc1	ZINC000186317013	455741380	/nfs/dbraw/zinc/74/13/80/455741380.db2.gz	HJVKAVDJWLEMCJ-GOEBONIOSA-N	0	3	337.398	3.090	20	30		EGEDHN
[O-]c1ccc2ccccc2c1/C=N/C1CC[NH+]([C@@H]2CCC[C@H]2O)CC1	ZINC000269035738	455770257	/nfs/dbraw/zinc/77/02/57/455770257.db2.gz	OJAOWAFMOMOJLR-YVPFWOTMSA-N	0	3	338.451	3.342	20	30		EGEDHN
COC(=O)CCCN1CCC(N[C@@H](CCC#N)c2ccccc2)CC1	ZINC000271826333	455776045	/nfs/dbraw/zinc/77/60/45/455776045.db2.gz	PWKKHHNRBFESOW-IBGZPJMESA-N	0	3	343.471	3.039	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)CC(C)(C)C1CC1	ZINC000293178046	455777019	/nfs/dbraw/zinc/77/70/19/455777019.db2.gz	GZUDWRMNHZGWKB-UHFFFAOYSA-N	0	3	327.472	3.275	20	30		EGEDHN
CN(CCC#N)c1ccc(CN2CCSC3(CCOCC3)C2)cc1	ZINC000186485968	455779039	/nfs/dbraw/zinc/77/90/39/455779039.db2.gz	HNZGDIMXKZTOOT-UHFFFAOYSA-N	0	3	345.512	3.134	20	30		EGEDHN
C=CCOc1ccc(CN[C@H]2CCO[C@@H]2c2cccnc2)cc1OC	ZINC000285068399	455785163	/nfs/dbraw/zinc/78/51/63/455785163.db2.gz	PCPWCRPVPFPMSC-FXAWDEMLSA-N	0	3	340.423	3.275	20	30		EGEDHN
CN1CCC[C@@]2(CCN(C(=O)c3ccc(C(C)(C)C#N)cc3)C2)C1	ZINC000293829965	455798506	/nfs/dbraw/zinc/79/85/06/455798506.db2.gz	BWANLAFNFQDBFT-HXUWFJFHSA-N	0	3	325.456	3.046	20	30		EGEDHN
CC[C@@H](NC[C@@H](O)COc1ccc(F)c(F)c1)c1ccc(C#N)cc1	ZINC000278672703	455844255	/nfs/dbraw/zinc/84/42/55/455844255.db2.gz	JGKZNHSALKIBLI-DNVCBOLYSA-N	0	3	346.377	3.317	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)[C@]1(C#N)CC12CCCC2	ZINC000295330995	455846364	/nfs/dbraw/zinc/84/63/64/455846364.db2.gz	MIVMKUCBNKEMEJ-PLMTUMEDSA-N	0	3	337.467	3.097	20	30		EGEDHN
CCCCO[C@@H]1C[C@@H](N[C@@H](C)C(=O)NC2(C#N)CCCCC2)C1(C)C	ZINC000253430363	455847950	/nfs/dbraw/zinc/84/79/50/455847950.db2.gz	QMAXBBCALVFHAA-GVDBMIGSSA-N	0	3	349.519	3.291	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cccc3c2OCC3(C)C)CC1	ZINC000279196478	455860500	/nfs/dbraw/zinc/86/05/00/455860500.db2.gz	JIRHNSNCKFQKMG-UHFFFAOYSA-N	0	3	328.456	3.127	20	30		EGEDHN
Cc1ccccc1C1(CNC(=O)C(C#N)Cc2ccc(C#N)cc2)CC1	ZINC000279339246	455862567	/nfs/dbraw/zinc/86/25/67/455862567.db2.gz	PNMOFDYESQZFED-IBGZPJMESA-N	0	3	343.430	3.397	20	30		EGEDHN
COc1cccc([C@@H](C)NC(=O)C(C#N)Cc2ccc(C#N)cc2)c1	ZINC000279748726	455872640	/nfs/dbraw/zinc/87/26/40/455872640.db2.gz	QBQXNHVZKIVGCC-KDOFPFPSSA-N	0	3	333.391	3.127	20	30		EGEDHN
CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)C1(C#N)CCCC1	ZINC000187327486	455895668	/nfs/dbraw/zinc/89/56/68/455895668.db2.gz	BDBRUNRGSFYVCO-GOSISDBHSA-N	0	3	327.472	3.343	20	30		EGEDHN
Cc1ccccc1O[C@@H](C)CNC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000280212214	455917584	/nfs/dbraw/zinc/91/75/84/455917584.db2.gz	AENLCMKDFVEROW-QFBILLFUSA-N	0	3	347.418	3.133	20	30		EGEDHN
C=CCC[C@@H](NCc1ccc(N2CCN(C)CC2)nc1)c1ccco1	ZINC000285834947	455925458	/nfs/dbraw/zinc/92/54/58/455925458.db2.gz	XBSQKTYIDKDYFX-GOSISDBHSA-N	0	3	340.471	3.224	20	30		EGEDHN
C[C@H](c1ccc(OCC#N)cc1)N1CCC[C@@H](CC(C)(C)C(N)=O)C1	ZINC000296393555	455925994	/nfs/dbraw/zinc/92/59/94/455925994.db2.gz	KEXPFFOWHGAHJT-CVEARBPZSA-N	0	3	343.471	3.264	20	30		EGEDHN
CN(C(=O)c1ccc(CC#N)cc1)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000270352785	455935952	/nfs/dbraw/zinc/93/59/52/455935952.db2.gz	IGGKWBJZHPFVGX-NRFANRHFSA-N	0	3	347.462	3.489	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N1CCC(CCCN2CCOCC2)CC1	ZINC000187719948	455944318	/nfs/dbraw/zinc/94/43/18/455944318.db2.gz	ZLIYIIYNKKOLRM-SFHVURJKSA-N	0	3	341.499	3.444	20	30		EGEDHN
CC(C)N1CCN(C2CCN(c3ccc(C#N)c(Cl)c3)CC2)CC1	ZINC000270514762	455973359	/nfs/dbraw/zinc/97/33/59/455973359.db2.gz	YBOYBMXYSBAIJE-UHFFFAOYSA-N	0	3	346.906	3.206	20	30		EGEDHN
CN(C)CCOc1cc(CNc2ccc(Cl)cc2C#N)ccn1	ZINC000270624894	455999951	/nfs/dbraw/zinc/99/99/51/455999951.db2.gz	DDILJAUBVMGSBB-UHFFFAOYSA-N	0	3	330.819	3.159	20	30		EGEDHN
C=CCN1CC[C@@H](N[C@@H](C)c2ccc(Oc3cccnc3)cc2)C1=O	ZINC000287284406	456066027	/nfs/dbraw/zinc/06/60/27/456066027.db2.gz	RRIZKHMLRZFLNB-HNAYVOBHSA-N	0	3	337.423	3.311	20	30		EGEDHN
C#CCN(Cc1ccccc1)C(=O)Nc1ccccc1CCN(C)C	ZINC000287445920	456069119	/nfs/dbraw/zinc/06/91/19/456069119.db2.gz	WOELQXHQZUHVJX-UHFFFAOYSA-N	0	3	335.451	3.458	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1F)c1nc(Cl)c(C#N)s1	ZINC000287668708	456074857	/nfs/dbraw/zinc/07/48/57/456074857.db2.gz	BUHSGEYRWYXBKO-UHFFFAOYSA-N	0	3	338.839	3.375	20	30		EGEDHN
N#Cc1cc(NC2CCN(CCOc3ccc(F)cc3)CC2)ccn1	ZINC000287678910	456076175	/nfs/dbraw/zinc/07/61/75/456076175.db2.gz	CIRQOTLDXBCNTE-UHFFFAOYSA-N	0	3	340.402	3.048	20	30		EGEDHN
N#CCc1ccc(CN2CCC(C(=O)NC3CCCCC3)CC2)cc1	ZINC000332506965	456084022	/nfs/dbraw/zinc/08/40/22/456084022.db2.gz	BTBUGORFEJIFET-UHFFFAOYSA-N	0	3	339.483	3.414	20	30		EGEDHN
COCCc1ncc(CNCCSCc2ccccc2C#N)s1	ZINC000601100666	460709827	/nfs/dbraw/zinc/70/98/27/460709827.db2.gz	ZCIUBQPEWNCKLN-UHFFFAOYSA-N	0	3	347.509	3.227	20	30		EGEDHN
C=CCS(=O)(=O)CCN[C@H](C)C(c1ccccc1)c1ccccc1	ZINC000272869947	456096548	/nfs/dbraw/zinc/09/65/48/456096548.db2.gz	OMVBAFMGSTWTSA-QGZVFWFLSA-N	0	3	343.492	3.397	20	30		EGEDHN
COCCCOc1cccc(CNC(=N)Nc2cc(F)ccc2F)c1	ZINC000288739587	456104898	/nfs/dbraw/zinc/10/48/98/456104898.db2.gz	OVANHOHTPMWMOZ-UHFFFAOYSA-N	0	3	349.381	3.307	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2Cc3ccccc3OC(C)(C)C2)CC1	ZINC000289001809	456112069	/nfs/dbraw/zinc/11/20/69/456112069.db2.gz	ZFQVSKWBIFYIPJ-UHFFFAOYSA-N	0	3	343.471	3.020	20	30		EGEDHN
Cc1ccc([C@@H](CNC(=O)c2cccc(F)c2C#N)N(C)C)cc1	ZINC000188694383	456114463	/nfs/dbraw/zinc/11/44/63/456114463.db2.gz	JPSRDKXTKWIYRZ-GOSISDBHSA-N	0	3	325.387	3.039	20	30		EGEDHN
C=CCN(CC=C)[C@H](CN[C@H](c1nc[nH]n1)c1ccccc1)C(C)C	ZINC000289199305	456117370	/nfs/dbraw/zinc/11/73/70/456117370.db2.gz	JOXOHBHUKZMXOM-MOPGFXCFSA-N	0	3	339.487	3.182	20	30		EGEDHN
C#Cc1ccc(CN2CCC(C(=O)Nc3ccc(O)cc3)CC2)cc1	ZINC000289467425	456126079	/nfs/dbraw/zinc/12/60/79/456126079.db2.gz	YSSKGLRLAAVMGD-UHFFFAOYSA-N	0	3	334.419	3.224	20	30		EGEDHN
C=CCn1c(C2CC2)nnc1N(C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000289542668	456130081	/nfs/dbraw/zinc/13/00/81/456130081.db2.gz	DSULFUDAAPAOHE-GOSISDBHSA-N	0	3	337.471	3.052	20	30		EGEDHN
C#C[C@@H](NC(=O)N(CC)C[C@H]1CCN(Cc2ccccc2)C1)C(C)C	ZINC000281179262	456155039	/nfs/dbraw/zinc/15/50/39/456155039.db2.gz	YMYJWGVSOHWUFV-VQTJNVASSA-N	0	3	341.499	3.198	20	30		EGEDHN
N#Cc1ccc(NCc2ccccc2CN2CC[C@@H](O)C2)cc1Cl	ZINC000273071023	456167393	/nfs/dbraw/zinc/16/73/93/456167393.db2.gz	FONRBPSDKNLIAT-GOSISDBHSA-N	0	3	341.842	3.390	20	30		EGEDHN
CN(C)CCN(Cc1cccc(F)c1)c1ccc(Cl)c(C#N)n1	ZINC000301630536	456168549	/nfs/dbraw/zinc/16/85/49/456168549.db2.gz	ITTKCTHCSLUKRS-UHFFFAOYSA-N	0	3	332.810	3.314	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CCCN1c1cc(C#N)nc(C2CC2)n1	ZINC000601121427	460718891	/nfs/dbraw/zinc/71/88/91/460718891.db2.gz	OMYAUAMAVLJVGA-MRXNPFEDSA-N	0	3	347.466	3.326	20	30		EGEDHN
N#CC1(CCCN2CCC(Oc3ccc(F)nc3)CC2)CCOCC1	ZINC000281529764	456258819	/nfs/dbraw/zinc/25/88/19/456258819.db2.gz	ZVPJRFMFKKWFHZ-UHFFFAOYSA-N	0	3	347.434	3.164	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N1CCCN(CC)CC1)c1ccc(F)c(F)c1	ZINC000275145096	456271031	/nfs/dbraw/zinc/27/10/31/456271031.db2.gz	QUCMNCUXAPXMPJ-KRWDZBQOSA-N	0	3	337.414	3.319	20	30		EGEDHN
CO[C@@H]1CCCC[C@H]1NCC(=O)N(CCC#N)c1cc(C)cc(C)c1	ZINC000275241123	456272112	/nfs/dbraw/zinc/27/21/12/456272112.db2.gz	OMBKFTGHDQJSNH-RTBURBONSA-N	0	3	343.471	3.097	20	30		EGEDHN
C#C[C@H](N[C@@H](C)CC(=O)Nc1ccc(OC)cc1OC)C(C)(C)C	ZINC000290244659	456274231	/nfs/dbraw/zinc/27/42/31/456274231.db2.gz	VBYZPSKSEQYFBR-GUYCJALGSA-N	0	3	332.444	3.058	20	30		EGEDHN
CN(C)CCc1ccccc1NC(=O)N(CCC#N)Cc1ccco1	ZINC000275618627	456277904	/nfs/dbraw/zinc/27/79/04/456277904.db2.gz	JDMKNJVHMKRYDP-UHFFFAOYSA-N	0	3	340.427	3.331	20	30		EGEDHN
COc1cc(CN[C@@H](C)c2ccc([S@@](C)=O)cc2)ccc1C#N	ZINC000281691303	456293927	/nfs/dbraw/zinc/29/39/27/456293927.db2.gz	NANVKDVYNQRCLG-ZAMGYDSWSA-N	0	3	328.437	3.155	20	30		EGEDHN
C#CCC(C)(C)C(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000290386524	456312734	/nfs/dbraw/zinc/31/27/34/456312734.db2.gz	HUGRLZKFAZEZDT-GOSISDBHSA-N	0	3	330.472	3.242	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1C[C@@H](F)CN1Cc1nccs1	ZINC000348108640	456487091	/nfs/dbraw/zinc/48/70/91/456487091.db2.gz	ULDFBSWCOOHWRC-IAGOWNOFSA-N	0	3	344.459	3.059	20	30		EGEDHN
C=CCOc1ccc(CN[C@H]2CCO[C@@H]2c2nccn2CC)cc1	ZINC000343385558	456579011	/nfs/dbraw/zinc/57/90/11/456579011.db2.gz	DHSNNBLPUYIJPJ-ROUUACIJSA-N	0	3	327.428	3.088	20	30		EGEDHN
C[C@H]1[C@H](NC(=O)c2ccccc2-c2ccccc2C#N)CCCN1C	ZINC000343431094	456615221	/nfs/dbraw/zinc/61/52/21/456615221.db2.gz	JPHAJIMSEDGLCP-MGPUTAFESA-N	0	3	333.435	3.438	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@H](NCc1ccc(CN3CCCC3=O)cc1)CC2	ZINC000353381068	456662312	/nfs/dbraw/zinc/66/23/12/456662312.db2.gz	DHMGDEQPSJMYPJ-OAQYLSRUSA-N	0	3	345.446	3.458	20	30		EGEDHN
CCN1CCN(Cc2ccccc2CNc2nccc(C)c2C#N)CC1	ZINC000343504504	456665596	/nfs/dbraw/zinc/66/55/96/456665596.db2.gz	GQUWMOMHZXLQIL-UHFFFAOYSA-N	0	3	349.482	3.011	20	30		EGEDHN
O=C(NC[C@@H]1CCCn2ccnc21)N1CCc2c(F)ccc(F)c2C1	ZINC000328605575	456717629	/nfs/dbraw/zinc/71/76/29/456717629.db2.gz	JSOBUPPOXFVGPX-LBPRGKRZSA-N	0	3	346.381	3.011	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)[C@H](C)c1cccc(-n2cnnn2)c1	ZINC000353502489	456720572	/nfs/dbraw/zinc/72/05/72/456720572.db2.gz	LQGVAWOXQXDJKL-MRXNPFEDSA-N	0	3	349.438	3.420	20	30		EGEDHN
C[C@@H]1CCN(C)CCN1C(=O)c1cccc(Nc2ccc(C#N)cc2)c1	ZINC000348516290	456727148	/nfs/dbraw/zinc/72/71/48/456727148.db2.gz	QMCLMDQQFNOTMU-MRXNPFEDSA-N	0	3	348.450	3.468	20	30		EGEDHN
O=C(NC1CC[NH+](C2CCCCC2)CC1)c1cc(F)cc2nn[n-]c21	ZINC000328664043	456732332	/nfs/dbraw/zinc/73/23/32/456732332.db2.gz	YHZJTTILFPNZGN-UHFFFAOYSA-N	0	3	345.422	3.199	20	30		EGEDHN
O=C(NC1CC[NH+](C2CCCCC2)CC1)c1cc(F)cc2[n-]nnc21	ZINC000328664043	456732335	/nfs/dbraw/zinc/73/23/35/456732335.db2.gz	YHZJTTILFPNZGN-UHFFFAOYSA-N	0	3	345.422	3.199	20	30		EGEDHN
O=C(NC1CC[NH+](C2CCCCC2)CC1)c1cc(F)cc2n[n-]nc21	ZINC000328664043	456732339	/nfs/dbraw/zinc/73/23/39/456732339.db2.gz	YHZJTTILFPNZGN-UHFFFAOYSA-N	0	3	345.422	3.199	20	30		EGEDHN
O=C(NC[C@@H](c1ccccc1)N1CCCC1)c1cn2c(n1)CCCC2	ZINC000328704688	456741610	/nfs/dbraw/zinc/74/16/10/456741610.db2.gz	KSXKGCXUDRWGFN-SFHVURJKSA-N	0	3	338.455	3.361	20	30		EGEDHN
O=C(CN1CC[C@H](C2CCOCC2)C1)N[C@H]1CCOc2ccccc21	ZINC000328835020	456771986	/nfs/dbraw/zinc/77/19/86/456771986.db2.gz	MEHYVUAMYLTQTJ-WMZOPIPTSA-N	0	3	344.455	3.215	20	30		EGEDHN
C[C@H](C(=O)Nc1ccc2c(c1)OCO2)N1CC[C@H](C2CCOCC2)C1	ZINC000328855913	456776901	/nfs/dbraw/zinc/77/69/01/456776901.db2.gz	UCLOSFYXFJHCTC-HIFRSBDPSA-N	0	3	346.427	3.140	20	30		EGEDHN
C[C@@H]1CN(C)CCN1Cc1cccc(OCc2ccccc2C#N)c1	ZINC000353585200	456783896	/nfs/dbraw/zinc/78/38/96/456783896.db2.gz	PWVWNZGZXBTFLQ-QGZVFWFLSA-N	0	3	335.451	3.273	20	30		EGEDHN
CC(C)N1CCN(c2cccc(NC(=O)C[C@](C)(O)C3CC3)c2)CC1	ZINC000328984388	456806930	/nfs/dbraw/zinc/80/69/30/456806930.db2.gz	GAWXRPDVIMLPQZ-FQEVSTJZSA-N	0	3	345.487	3.356	20	30		EGEDHN
C=CC[C@H](CO)CNCc1cc2ccccc2nc1N1CCCCC1	ZINC000341319923	456846013	/nfs/dbraw/zinc/84/60/13/456846013.db2.gz	ZKWIPCLGVRJDKB-KRWDZBQOSA-N	0	3	339.483	3.499	20	30		EGEDHN
CCCN1CCC[C@H]1CNC(=O)c1ccc2c(c1)NC(=O)[C@H](C)N2C	ZINC000329224270	456855516	/nfs/dbraw/zinc/85/55/16/456855516.db2.gz	ZKCGSHIKXMIPDI-ZFWWWQNUSA-N	0	3	344.459	3.292	20	30		EGEDHN
CC(C)[C@H](NC(=O)N[C@H]1CCN(C2CC2)C1)c1nc2ccccc2[nH]1	ZINC000329309899	456870407	/nfs/dbraw/zinc/87/04/07/456870407.db2.gz	QRSRNYYDPSBOSU-GUYCJALGSA-N	0	3	341.459	3.000	20	30		EGEDHN
CC[C@@H]1CCCCN1CCNC(=O)N1CCCC[C@H]1c1ccnn1C	ZINC000329338345	456875348	/nfs/dbraw/zinc/87/53/48/456875348.db2.gz	QJUVRARKYAOTNT-AEFFLSMTSA-N	0	3	347.507	3.126	20	30		EGEDHN
CN1CCC(Nc2ccccc2NC(=O)c2ccc(C#N)cc2)CC1	ZINC000338961664	456878572	/nfs/dbraw/zinc/87/85/72/456878572.db2.gz	RGGYSDYAEIGHKR-UHFFFAOYSA-N	0	3	334.423	3.317	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cc(C)n(C(F)F)n1)C(C)C	ZINC000341681941	456898074	/nfs/dbraw/zinc/89/80/74/456898074.db2.gz	GWYBNIRGKHVCJQ-OAHLLOKOSA-N	0	3	340.418	3.015	20	30		EGEDHN
CN(Cc1cccc(OCCCC#N)c1)C[C@H](O)Cc1ccccc1	ZINC000353771581	456900000	/nfs/dbraw/zinc/90/00/00/456900000.db2.gz	XDUMFFJKBCRSPM-HXUWFJFHSA-N	0	3	338.451	3.405	20	30		EGEDHN
CC(C)n1ncc2c1C[C@H](NC(=O)[C@@H](C1CC1)N1CCCC1)CC2	ZINC000329544133	456906667	/nfs/dbraw/zinc/90/66/67/456906667.db2.gz	YQCHUHFXNONGAA-SJLPKXTDSA-N	0	3	330.476	3.152	20	30		EGEDHN
CCN1C[C@H](C)N(Cc2ccc(OC)c(OCCCC#N)c2)C[C@@H]1C	ZINC000353816446	456920611	/nfs/dbraw/zinc/92/06/11/456920611.db2.gz	MOJUQPFLTOOMAT-IRXDYDNUSA-N	0	3	345.487	3.292	20	30		EGEDHN
Cn1nc2c(c1CNC(=O)[C@@H]1CCCN1C1CCCC1)CCCC2	ZINC000329742750	456934850	/nfs/dbraw/zinc/93/48/50/456934850.db2.gz	PPZKSTBSONUJSO-KRWDZBQOSA-N	0	3	330.476	3.162	20	30		EGEDHN
COc1ccc(CC[C@@H]2CCCCN2C(=O)C(C)C#N)cc1OC	ZINC000345224207	456971966	/nfs/dbraw/zinc/97/19/66/456971966.db2.gz	CHKNTRYOIDWMDM-HOCLYGCPSA-N	0	3	330.428	3.177	20	30		EGEDHN
CCN(C(=O)C(C)C#N)[C@@H](c1cccnc1)c1ccc(F)c(F)c1	ZINC000345642673	456985640	/nfs/dbraw/zinc/98/56/40/456985640.db2.gz	MXZVHZBCCOBLHY-YVEFUNNKSA-N	0	3	329.350	3.457	20	30		EGEDHN
CC(C#N)C(=O)N1CCN(C(c2ccccc2)c2ccccc2)CC1	ZINC000345652254	456986270	/nfs/dbraw/zinc/98/62/70/456986270.db2.gz	BNUKDKCCRLGPIS-KRWDZBQOSA-N	0	3	333.435	3.080	20	30		EGEDHN
C=CC[C@H](CO)CN[C@@H]1CCCOc2cc(Br)ccc21	ZINC000341885215	456986346	/nfs/dbraw/zinc/98/63/46/456986346.db2.gz	LBKQVFICASPTHC-SWLSCSKDSA-N	0	3	340.261	3.437	20	30		EGEDHN
CC(C#N)C(=O)NCc1ccccc1-c1ccc(Cn2ccnc2)cc1	ZINC000345802417	456996056	/nfs/dbraw/zinc/99/60/56/456996056.db2.gz	NGJKGIOQCQZHKJ-MRXNPFEDSA-N	0	3	344.418	3.374	20	30		EGEDHN
[O-]C(N[C@@H]1CCn2ccnc2C1)=[NH+]CCC12CC3CC(CC(C3)C1)C2	ZINC000330187329	456998163	/nfs/dbraw/zinc/99/81/63/456998163.db2.gz	SXSATCXLPHGYSW-VQBCORBOSA-N	0	3	342.487	3.308	20	30		EGEDHN
C[C@H](C(=O)N[C@H]1CC(=O)N(C2CCCCC2)C1)N1[C@H](C)CC[C@@H]1C	ZINC000330186503	456998808	/nfs/dbraw/zinc/99/88/08/456998808.db2.gz	JVHGZQDTUURLJR-QXSJWSMHSA-N	0	3	335.492	3.138	20	30		EGEDHN
C[C@H](N[C@H]1CCO[C@@H]1C1CC1)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000330254298	457013102	/nfs/dbraw/zinc/01/31/02/457013102.db2.gz	JIPQARLQEWLPJK-JMPLFQLZSA-N	0	3	345.468	3.242	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCc2cnc3ccccc3c2)CC1	ZINC000349707041	457022938	/nfs/dbraw/zinc/02/29/38/457022938.db2.gz	WBTLCHJVFMVQND-UHFFFAOYSA-N	0	3	337.467	3.324	20	30		EGEDHN
Cc1ccc(NC(=O)NC(=O)CN2CC[C@H](O)C23CCCC3)cc1C	ZINC000330339363	457031658	/nfs/dbraw/zinc/03/16/58/457031658.db2.gz	WORPZGQKARUIDA-INIZCTEOSA-N	0	3	345.443	3.171	20	30		EGEDHN
COCCN(CCC(=O)Nc1ccccc1C#N)Cc1cccs1	ZINC000358921077	457036132	/nfs/dbraw/zinc/03/61/32/457036132.db2.gz	GSEACYQLDPZURL-UHFFFAOYSA-N	0	3	343.452	3.097	20	30		EGEDHN
C=CCn1cccc1-c1nc(-c2ccccc2OCCN(C)C)no1	ZINC000346391748	457039552	/nfs/dbraw/zinc/03/95/52/457039552.db2.gz	OWKDWILUGTYBPZ-UHFFFAOYSA-N	0	3	338.411	3.332	20	30		EGEDHN
CCCNC(=O)c1cccc(C(=O)N(C)[C@H](C)C2CCN(C)CC2)c1	ZINC000330567857	457057234	/nfs/dbraw/zinc/05/72/34/457057234.db2.gz	WPYKTZISKNVHKM-OAHLLOKOSA-N	0	3	345.487	3.204	20	30		EGEDHN
C=C(C)Cn1c(-c2ccc(C)o2)nnc1N1C[C@@H](C)N(CC)C[C@H]1C	ZINC000359109425	457057258	/nfs/dbraw/zinc/05/72/58/457057258.db2.gz	OOQDZBCFWRWPOL-HUUCEWRRSA-N	0	3	343.475	3.342	20	30		EGEDHN
CN1CCC(NC(=O)Nc2cc(C(C)(C)C)nn2C(C)(C)C)CC1	ZINC000330652399	457066392	/nfs/dbraw/zinc/06/63/92/457066392.db2.gz	YOPHHWSMCHSDRB-UHFFFAOYSA-N	0	3	335.496	3.356	20	30		EGEDHN
CC[C@@H](C)n1nc(NC(=O)NCC(C)(C)N2CCCCC2)cc1C	ZINC000330688087	457070265	/nfs/dbraw/zinc/07/02/65/457070265.db2.gz	NYNYCJAVRVQJIA-CQSZACIVSA-N	0	3	335.496	3.175	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1)OCC	ZINC000339378651	457077640	/nfs/dbraw/zinc/07/76/40/457077640.db2.gz	OBKRYBWQIKHXPT-UYAOXDASSA-N	0	3	344.499	3.481	20	30		EGEDHN
CN(C)CCOc1ccccc1-c1noc(-c2cc(C#N)cs2)n1	ZINC000356603233	457079505	/nfs/dbraw/zinc/07/95/05/457079505.db2.gz	QVPHDMJFSNEFEO-UHFFFAOYSA-N	0	3	340.408	3.277	20	30		EGEDHN
C[C@H](C1CCN(C)CC1)N(C)C(=O)C[C@H](CC#N)c1ccccc1	ZINC000356632015	457091233	/nfs/dbraw/zinc/09/12/33/457091233.db2.gz	JCFKPSQJFGVDMT-APWZRJJASA-N	0	3	327.472	3.263	20	30		EGEDHN
CNC(=O)c1cccc(NC(=O)N(C)[C@@H](C)C2CCN(C)CC2)c1C	ZINC000330870490	457098267	/nfs/dbraw/zinc/09/82/67/457098267.db2.gz	BNHNRYAMGDXQKH-AWEZNQCLSA-N	0	3	346.475	3.137	20	30		EGEDHN
C=CCOc1cccc(CNCc2cccc(N3CCOCC3)c2)c1	ZINC000339419598	457105544	/nfs/dbraw/zinc/10/55/44/457105544.db2.gz	CRKMXSJRANCRBC-UHFFFAOYSA-N	0	3	338.451	3.378	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F	ZINC000349992231	457135614	/nfs/dbraw/zinc/13/56/14/457135614.db2.gz	REQXTOZPQYEXOI-DOTOQJQBSA-N	0	3	349.425	3.152	20	30		EGEDHN
CC[C@@H](C)N[C@@H](CNC(=O)NCC#Cc1ccccc1)c1ccco1	ZINC000350125732	457166292	/nfs/dbraw/zinc/16/62/92/457166292.db2.gz	NDNLQNSWEFPFHA-AEFFLSMTSA-N	0	3	339.439	3.060	20	30		EGEDHN
CCC(C)(C)c1ccc(NC(=O)C(=O)NC2CCN(C)CC2)cc1	ZINC000331343338	457170072	/nfs/dbraw/zinc/17/00/72/457170072.db2.gz	ZHQNNQBRKDOOCR-UHFFFAOYSA-N	0	3	331.460	3.173	20	30		EGEDHN
CCN(CCC#N)C(=O)CN1CCC[C@H]1CCCc1ccccc1	ZINC000362955290	457173346	/nfs/dbraw/zinc/17/33/46/457173346.db2.gz	QCPLUYCSYNIKJU-LJQANCHMSA-N	0	3	327.472	3.236	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CCC(C)(C#N)CC2)C1	ZINC000331501408	457195298	/nfs/dbraw/zinc/19/52/98/457195298.db2.gz	BMZXDUWHOAFWJR-FUHWJXTLSA-N	0	3	340.471	3.157	20	30		EGEDHN
CN(Cc1cn(C)nc1-c1ccc(C#N)cc1)[C@@H](CO)c1ccccc1	ZINC000360011544	457202912	/nfs/dbraw/zinc/20/29/12/457202912.db2.gz	WPHIKNSEUHXNCH-FQEVSTJZSA-N	0	3	346.434	3.124	20	30		EGEDHN
CC(C#N)C(=O)N[C@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000347080124	457219692	/nfs/dbraw/zinc/21/96/92/457219692.db2.gz	WEYAATGFDCEELO-CHWSQXEVSA-N	0	3	339.370	3.415	20	30		EGEDHN
C=CCN(Cc1ccc(C)nc1C)[C@H](C)c1cccc(-n2cnnn2)c1	ZINC000360071974	457238854	/nfs/dbraw/zinc/23/88/54/457238854.db2.gz	NYMGKNSEGULNBG-QGZVFWFLSA-N	0	3	348.454	3.423	20	30		EGEDHN
COc1ccc(C2(CNC(=O)C(C)C#N)CCCCC2)cc1OC	ZINC000347121221	457240529	/nfs/dbraw/zinc/24/05/29/457240529.db2.gz	YVWNPZGXYXKRPO-CQSZACIVSA-N	0	3	330.428	3.182	20	30		EGEDHN
N#CC(C(=O)c1ccc(Cl)c(Br)c1)c1ccncn1	ZINC000354475095	457247576	/nfs/dbraw/zinc/24/75/76/457247576.db2.gz	ZQEIHAQGXAZBNE-VIFPVBQESA-N	0	3	336.576	3.383	20	30		EGEDHN
CC(C)(C)N1C[C@H](C(F)(F)F)[C@H](C(=O)N(CCC#N)CC2CC2)C1	ZINC000339931605	457315789	/nfs/dbraw/zinc/31/57/89/457315789.db2.gz	MXIYMMXIQWNICG-KGLIPLIRSA-N	0	3	345.409	3.047	20	30		EGEDHN
CC(C)(C)N1C[C@H](C(=O)NCC(C)(C)CCC#N)[C@H](C(F)(F)F)C1	ZINC000354974968	457332848	/nfs/dbraw/zinc/33/28/48/457332848.db2.gz	KGINJZPZRKTSGG-QWHCGFSZSA-N	0	3	347.425	3.341	20	30		EGEDHN
C=CCSCCNC(=O)N[C@@H](C)[C@@H](c1ccccc1C)N(C)C	ZINC000352254167	457351816	/nfs/dbraw/zinc/35/18/16/457351816.db2.gz	YWWGDKFYYYSQBV-RDJZCZTQSA-N	0	3	335.517	3.205	20	30		EGEDHN
C[C@@H](N[C@H](C)c1ccc(F)c2ccccc21)C(=O)N(C)CCC#N	ZINC000352249013	457352115	/nfs/dbraw/zinc/35/21/15/457352115.db2.gz	FTGFHXJDKQQFIR-ZIAGYGMSSA-N	0	3	327.403	3.390	20	30		EGEDHN
CN(CCCOc1cccc(C#N)c1)C[C@H]1COc2ccccc2O1	ZINC000357166553	457355305	/nfs/dbraw/zinc/35/53/05/457355305.db2.gz	HTXLBYVYHAESDH-SFHVURJKSA-N	0	3	338.407	3.099	20	30		EGEDHN
CN1CCCC(C)(C)[C@@H]1CNC(=O)C[C@H](CC#N)c1ccccc1	ZINC000357169516	457356378	/nfs/dbraw/zinc/35/63/78/457356378.db2.gz	LTDTVJVKKANXKK-ROUUACIJSA-N	0	3	327.472	3.311	20	30		EGEDHN
CCC(C#N)(CC)C(=O)N(C)C1CCN(Cc2ccccc2)CC1	ZINC000383575361	457424670	/nfs/dbraw/zinc/42/46/70/457424670.db2.gz	KWCIOBNVHNFDOY-UHFFFAOYSA-N	0	3	327.472	3.439	20	30		EGEDHN
C[C@@H](NC(=O)NCCN(C)C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000363721990	457429884	/nfs/dbraw/zinc/42/98/84/457429884.db2.gz	WOTXFZHFBYKEGD-OAHLLOKOSA-N	0	3	336.439	3.147	20	30		EGEDHN
Cc1nc(N[C@@H]2CCN(Cc3ccccc3)CC2(C)C)ccc1C#N	ZINC000391040615	457449843	/nfs/dbraw/zinc/44/98/43/457449843.db2.gz	BOINFYKDUVDYLE-LJQANCHMSA-N	0	3	334.467	3.396	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C1(C#N)CCCCC1	ZINC000398162627	457496163	/nfs/dbraw/zinc/49/61/63/457496163.db2.gz	LIYRTRMEWLEUTH-MJGOQNOKSA-N	0	3	339.483	3.487	20	30		EGEDHN
COc1ccc(C#N)cc1CN1CCC[C@@H]1[C@@H]1C[C@@H](C)CC[C@H]1O	ZINC000374150409	457497231	/nfs/dbraw/zinc/49/72/31/457497231.db2.gz	FMWVPMLFEGQKJF-WQANXHIZSA-N	0	3	328.456	3.328	20	30		EGEDHN
N#Cc1cccc(N2CC[C@]3(C2)CCCN(Cc2ccccc2)C3)n1	ZINC000374199662	457518832	/nfs/dbraw/zinc/51/88/32/457518832.db2.gz	KDAPPBOLWOVENW-OAQYLSRUSA-N	0	3	332.451	3.446	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CCC(NC(=O)N[C@@H]2CC[C@H](C#N)C2)CC1	ZINC000425443938	457555533	/nfs/dbraw/zinc/55/55/33/457555533.db2.gz	BBJMHZCNVOFQOU-TXPKVOOTSA-N	0	3	340.471	3.203	20	30		EGEDHN
CCN1CCCC[C@H]1CNC(=O)N(C)[C@H](C)c1cccc(C#N)c1	ZINC000425449058	457557190	/nfs/dbraw/zinc/55/71/90/457557190.db2.gz	WHYNZWHWUQOFMG-QAPCUYQASA-N	0	3	328.460	3.135	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)C(=O)NC[C@H](C)N1CCC[C@@H](C)C1	ZINC000425450308	457559383	/nfs/dbraw/zinc/55/93/83/457559383.db2.gz	XZLOQUAVSZAKGC-IXDOHACOSA-N	0	3	342.487	3.381	20	30		EGEDHN
C[C@@]1(CNC(=O)C2(C#N)CCCC2)CCN(Cc2ccccc2)C1	ZINC000374276817	457562751	/nfs/dbraw/zinc/56/27/51/457562751.db2.gz	FOZSEQHMZUJMOV-IBGZPJMESA-N	0	3	325.456	3.099	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N(C)CCC(=O)N1CCOc2ccccc21	ZINC000425529205	457586831	/nfs/dbraw/zinc/58/68/31/457586831.db2.gz	AYCZPOXOLFITEC-INIZCTEOSA-N	0	3	349.434	3.367	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N1CCCN(Cc2ccccc2C)CC1	ZINC000364847685	457705066	/nfs/dbraw/zinc/70/50/66/457705066.db2.gz	OKXRNQRCXKDTHD-OAQYLSRUSA-N	0	3	344.499	3.258	20	30		EGEDHN
CN(C)[C@@H](CNC(=O)[C@@H](C#N)CCc1ccccc1)c1ccccc1	ZINC000433112517	457760643	/nfs/dbraw/zinc/76/06/43/457760643.db2.gz	BEGUTRPFTUJCGX-UXHICEINSA-N	0	3	335.451	3.178	20	30		EGEDHN
N#CC(C(=O)c1ccccc1-n1cccn1)c1cnc2ccccc2n1	ZINC000361524009	457770201	/nfs/dbraw/zinc/77/02/01/457770201.db2.gz	IHGRSSAVJUVEGN-OAHLLOKOSA-N	0	3	339.358	3.306	20	30		EGEDHN
CC[C@@H](CNC(=O)N(C)CC(C)(C)C#N)N1CCc2ccccc2C1	ZINC000457705707	457799795	/nfs/dbraw/zinc/79/97/95/457799795.db2.gz	ZTMCVJPGYJRJML-SFHVURJKSA-N	0	3	342.487	3.014	20	30		EGEDHN
CC(C)CN(C(=O)[C@@H](C#N)CCc1ccccc1)C1CCN(C)CC1	ZINC000433340098	457815229	/nfs/dbraw/zinc/81/52/29/457815229.db2.gz	ADVPGHMQIYCMAA-LJQANCHMSA-N	0	3	341.499	3.338	20	30		EGEDHN
CC(C)(C#N)CCN1CCC(n2cc(Br)cn2)CC1	ZINC000371205074	457825560	/nfs/dbraw/zinc/82/55/60/457825560.db2.gz	NNQAFHJHOJKGBA-UHFFFAOYSA-N	0	3	325.254	3.222	20	30		EGEDHN
COC[C@H](NC(=O)C(C#N)CCc1ccccc1)c1ccc(C)o1	ZINC000433389104	457827100	/nfs/dbraw/zinc/82/71/00/457827100.db2.gz	WFVPYGHIXVVBFP-IRXDYDNUSA-N	0	3	326.396	3.164	20	30		EGEDHN
Cc1cc(CN[C@H]2CC(=O)N(c3c(F)cccc3F)C2)ccc1C#N	ZINC000443994271	457836853	/nfs/dbraw/zinc/83/68/53/457836853.db2.gz	DHNYYRYLBDWVRX-HNNXBMFYSA-N	0	3	341.361	3.040	20	30		EGEDHN
C[C@H](CCCc1cccnc1)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000457900753	457862812	/nfs/dbraw/zinc/86/28/12/457862812.db2.gz	CILCZINXJKPKRM-OXQOHEQNSA-N	0	3	346.434	3.163	20	30		EGEDHN
C=CCNC(=O)NC(=O)[C@@H](C)N[C@H](CC(C)(C)C)c1ccc(F)cc1	ZINC000361841401	457900698	/nfs/dbraw/zinc/90/06/98/457900698.db2.gz	CTTUKUFKRXCRQT-CZUORRHYSA-N	0	3	349.450	3.293	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CCc3cccc(Cl)c3C2)cc1	ZINC000458008905	457901464	/nfs/dbraw/zinc/90/14/64/457901464.db2.gz	FIHJPEOGTFAFBM-KRWDZBQOSA-N	0	3	349.821	3.479	20	30		EGEDHN
C=CCN(CCc1ccccc1)C(=O)NC[C@@H]1CCCCN1C1CC1	ZINC000433948238	457917797	/nfs/dbraw/zinc/91/77/97/457917797.db2.gz	DALCCFHIOYAVHT-FQEVSTJZSA-N	0	3	341.499	3.444	20	30		EGEDHN
N#CCCN(CC1CC1)C(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000371565737	457992159	/nfs/dbraw/zinc/99/21/59/457992159.db2.gz	UEQVFAAYXMANMD-GOSISDBHSA-N	0	3	343.446	3.190	20	30		EGEDHN
C=CCC[C@H](C(=O)N1C[C@H](SC)[C@@H](N(C)C)C1)c1ccccc1	ZINC000427629477	458010677	/nfs/dbraw/zinc/01/06/77/458010677.db2.gz	NDJQLHRWXILQIC-BZSNNMDCSA-N	0	3	332.513	3.240	20	30		EGEDHN
CN(C)CCOc1ccc(NC(=O)c2cccc(CC#N)c2)cc1F	ZINC000458323890	458012937	/nfs/dbraw/zinc/01/29/37/458012937.db2.gz	SFFBSDTYSUOAOK-UHFFFAOYSA-N	0	3	341.386	3.084	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NC(=O)NCC(C)(C)N[C@@H](C)c1ccccc1	ZINC000458374359	458027537	/nfs/dbraw/zinc/02/75/37/458027537.db2.gz	OJGJLIGITBAFCS-JQHSSLGASA-N	0	3	345.487	3.149	20	30		EGEDHN
COC1([C@@H](C)NCC#Cc2ccc(OC(F)(F)F)cc2)CCC1	ZINC000412029231	458052478	/nfs/dbraw/zinc/05/24/78/458052478.db2.gz	YACKFTYOJRVTCL-CYBMUJFWSA-N	0	3	327.346	3.484	20	30		EGEDHN
Cc1cccc(CN(CCN(C)C)C(=O)NCC(C)(C)CCC#N)c1	ZINC000358679488	458146268	/nfs/dbraw/zinc/14/62/68/458146268.db2.gz	GAAVIFVJAIPNBQ-UHFFFAOYSA-N	0	3	344.503	3.398	20	30		EGEDHN
CN1CC[C@@H]2CCN(C(=O)N[C@@H](CCCC#N)c3ccccc3)[C@H]2C1	ZINC000458805920	458178072	/nfs/dbraw/zinc/17/80/72/458178072.db2.gz	VQQZEXZPNLIBIG-QYZOEREBSA-N	0	3	340.471	3.157	20	30		EGEDHN
CN(Cc1nc2ccccc2n1C)C(=O)C(C#N)CCc1ccccc1	ZINC000358737180	458181279	/nfs/dbraw/zinc/18/12/79/458181279.db2.gz	OEXULQXBIRCBJC-KRWDZBQOSA-N	0	3	346.434	3.304	20	30		EGEDHN
COCC1(C)CCN([C@H](C)C(=O)N(C)C2(C#N)CCC(C)CC2)CC1	ZINC000358743960	458186350	/nfs/dbraw/zinc/18/63/50/458186350.db2.gz	LJKBUTDPGKJOGE-OHTSDLOESA-N	0	3	349.519	3.054	20	30		EGEDHN
C[C@@H]1CCC[C@H](CCN2CCN(c3nccnc3C#N)C[C@@H]2C)C1	ZINC000362464785	458197837	/nfs/dbraw/zinc/19/78/37/458197837.db2.gz	PIGBMJVALOGTOK-IXDOHACOSA-N	0	3	327.476	3.075	20	30		EGEDHN
C=CC(C)(C)CNC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1	ZINC000458983388	458235055	/nfs/dbraw/zinc/23/50/55/458235055.db2.gz	DFXDHXPGWQIXJF-UHFFFAOYSA-N	0	3	339.430	3.250	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)N[C@H](CN(C)Cc1ccccc1)C(C)C	ZINC000436100588	458252679	/nfs/dbraw/zinc/25/26/79/458252679.db2.gz	NIAPSSLKFWVSLM-LJQANCHMSA-N	0	3	339.439	3.346	20	30		EGEDHN
CN(Cc1ccccc1)[C@H]1CCN(C(=O)c2ccc(CC#N)cc2)C1	ZINC000372275986	458260348	/nfs/dbraw/zinc/26/03/48/458260348.db2.gz	VVYCXDYJRHVWQF-FQEVSTJZSA-N	0	3	333.435	3.099	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN2CCN([C@@H]3C[C@H]3C)C[C@H](C)C2)c1C	ZINC000429033524	458262250	/nfs/dbraw/zinc/26/22/50/458262250.db2.gz	ZLKDQRMGHGBHCB-JXXFODFXSA-N	0	3	343.515	3.136	20	30		EGEDHN
C[C@H]1C[C@@H]1N1CCN(c2cc(C(F)(F)F)cnc2C#N)C[C@@H](C)C1	ZINC000413294692	458297224	/nfs/dbraw/zinc/29/72/24/458297224.db2.gz	BOZNDMNJVPXWCC-HUBLWGQQSA-N	0	3	338.377	3.139	20	30		EGEDHN
CS(=O)(=O)CC1(CN[C@H]2CCCCc3cc(C#N)ccc32)CCC1	ZINC000414338023	458317458	/nfs/dbraw/zinc/31/74/58/458317458.db2.gz	XXRCBIASMGNZEI-SFHVURJKSA-N	0	3	346.496	3.130	20	30		EGEDHN
Cc1cc(C[NH+](C)C)ccc1[N-]S(=O)(=O)c1ccc(C#N)cc1C	ZINC000414461635	458319972	/nfs/dbraw/zinc/31/99/72/458319972.db2.gz	OSQRILDDTKTJDX-UHFFFAOYSA-N	0	3	343.452	3.038	20	30		EGEDHN
C=C[C@H]1CCCCN1C(=O)Nc1ccc(OCCN(C)C)c(OC)c1	ZINC000417691519	458367599	/nfs/dbraw/zinc/36/75/99/458367599.db2.gz	XCXPEALCJVHIAL-INIZCTEOSA-N	0	3	347.459	3.208	20	30		EGEDHN
CC(C)(CCC#N)CNC(=O)N[C@@H](CN)c1ccc2ccccc2c1	ZINC000418193196	458372461	/nfs/dbraw/zinc/37/24/61/458372461.db2.gz	CXPYERKODZBXQT-SFHVURJKSA-N	0	3	338.455	3.469	20	30		EGEDHN
CC(C)(CCC#N)CNC(=O)N[C@H](CN)c1ccc2ccccc2c1	ZINC000418193195	458372619	/nfs/dbraw/zinc/37/26/19/458372619.db2.gz	CXPYERKODZBXQT-GOSISDBHSA-N	0	3	338.455	3.469	20	30		EGEDHN
C=CCOc1ccc(CN[C@H]2CCN(CC(F)F)C2)cc1Cl	ZINC000418139926	458372941	/nfs/dbraw/zinc/37/29/41/458372941.db2.gz	UXAFCXMEIVFWSZ-ZDUSSCGKSA-N	0	3	330.806	3.334	20	30		EGEDHN
C=CCN(Cc1ccccc1F)C(=O)NCc1ccc2c(c1)CNC2	ZINC000418560624	458375320	/nfs/dbraw/zinc/37/53/20/458375320.db2.gz	XNNXNAONMMHHQY-UHFFFAOYSA-N	0	3	339.414	3.327	20	30		EGEDHN
C=CCC(C)(C)CN[C@@H](C(N)=O)c1ccc(Br)cc1	ZINC000419183882	458379537	/nfs/dbraw/zinc/37/95/37/458379537.db2.gz	MZEUBVLXYQTWDG-CYBMUJFWSA-N	0	3	325.250	3.167	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)NCC2(C#N)CCC2)N2CCCC2)cc1	ZINC000419431868	458382644	/nfs/dbraw/zinc/38/26/44/458382644.db2.gz	FJSODHCFFMDMOD-SFHVURJKSA-N	0	3	340.471	3.125	20	30		EGEDHN
C[C@H](CNC(=O)c1cccc(SCC#N)c1)N1CCCC[C@H]1C	ZINC000429954371	458384343	/nfs/dbraw/zinc/38/43/43/458384343.db2.gz	VHTLWQQUSUWJRO-HUUCEWRRSA-N	0	3	331.485	3.295	20	30		EGEDHN
CN(C[C@@H]1CCCN1C)C(=O)Nc1cccc(C#Cc2ccccn2)c1	ZINC000421058739	458407012	/nfs/dbraw/zinc/40/70/12/458407012.db2.gz	MTFLWDJKOWMSAE-FQEVSTJZSA-N	0	3	348.450	3.039	20	30		EGEDHN
COCCCOc1ccc(CNCc2ccc(C#N)c(F)c2)cc1	ZINC000421360026	458412175	/nfs/dbraw/zinc/41/21/75/458412175.db2.gz	YIEDSQQVIQBHLY-UHFFFAOYSA-N	0	3	328.387	3.402	20	30		EGEDHN
C[C@H](CN1CC[C@@H](Oc2ccc(C#N)cn2)C1)c1ccc(F)cc1	ZINC000430183906	458417376	/nfs/dbraw/zinc/41/73/76/458417376.db2.gz	BRYBJLKBCLHQSW-RDTXWAMCSA-N	0	3	325.387	3.349	20	30		EGEDHN
CC1(C#N)CCC(NCc2nnc3ccc(C(F)(F)F)cn32)CC1	ZINC000449218041	458421594	/nfs/dbraw/zinc/42/15/94/458421594.db2.gz	DXZSRDUPPHZWQT-UHFFFAOYSA-N	0	3	337.349	3.310	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)s1)c1ccc(OCCN(C)C)cc1	ZINC000421893914	458423428	/nfs/dbraw/zinc/42/34/28/458423428.db2.gz	XLSQEURQBLRKSY-AWEZNQCLSA-N	0	3	329.469	3.411	20	30		EGEDHN
COc1ccc(CN2CC[C@H](OC)[C@H](C)C2)cc1OCCCC#N	ZINC000449493991	458425175	/nfs/dbraw/zinc/42/51/75/458425175.db2.gz	FVPFUMQQTWZAEQ-WBVHZDCISA-N	0	3	332.444	3.235	20	30		EGEDHN
C=CCC[C@H](CO)NCc1ccc(-c2ccc(C(=O)OC)cc2)o1	ZINC000449698482	458429913	/nfs/dbraw/zinc/42/99/13/458429913.db2.gz	NVHCUZKQFOZLCH-MRXNPFEDSA-N	0	3	329.396	3.150	20	30		EGEDHN
CO[C@@H]1C[C@H](NCc2cc(C#N)ccc2Br)C12CCC2	ZINC000459768663	458473514	/nfs/dbraw/zinc/47/35/14/458473514.db2.gz	QNLKIOKIIAUUKX-LSDHHAIUSA-N	0	3	335.245	3.368	20	30		EGEDHN
COc1ccc(CN[C@@H]2C[C@H](OC)C23CCC3)cc1OCCCC#N	ZINC000459799199	458482353	/nfs/dbraw/zinc/48/23/53/458482353.db2.gz	YOXXJVKEFUDIBC-MOPGFXCFSA-N	0	3	344.455	3.425	20	30		EGEDHN
C[C@H](CC(=O)N(C)Cc1ccccc1Cl)NCC1(CC#N)CC1	ZINC000430724097	458484797	/nfs/dbraw/zinc/48/47/97/458484797.db2.gz	MGYUNGFMXVFBHF-CQSZACIVSA-N	0	3	333.863	3.360	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC(=O)N(CC)[C@@H](C)c1ccc(F)cc1	ZINC000451676026	458485322	/nfs/dbraw/zinc/48/53/22/458485322.db2.gz	RLRUGKOZEGYKDU-QGTPRVQTSA-N	0	3	334.435	3.058	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1CCC[C@]2(CCSC2)C1	ZINC000451960507	458491316	/nfs/dbraw/zinc/49/13/16/458491316.db2.gz	BWNJTGBYSMUQLG-SFHVURJKSA-N	0	3	332.469	3.165	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CCC[C@@]2(CCSC2)C1	ZINC000451970823	458491940	/nfs/dbraw/zinc/49/19/40/458491940.db2.gz	YXESZKVFONVAFG-AZUAARDMSA-N	0	3	347.524	3.374	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN(C)[C@H]1CCN(C(C)C)C1	ZINC000452112139	458494943	/nfs/dbraw/zinc/49/49/43/458494943.db2.gz	FGXFLJGQODORBR-INIZCTEOSA-N	0	3	347.528	3.318	20	30		EGEDHN
C=C(C)CCN[C@@H]1CCS(=O)(=O)c2ccc(Br)cc21	ZINC000453323715	458524382	/nfs/dbraw/zinc/52/43/82/458524382.db2.gz	SIXLPKLWAVBCIB-CYBMUJFWSA-N	0	3	344.274	3.223	20	30		EGEDHN
CC(C)OCCOC1CCN([C@H]2CCc3ccc(C#N)cc32)CC1	ZINC000453381830	458526012	/nfs/dbraw/zinc/52/60/12/458526012.db2.gz	XTVVIPMKDYDQKW-FQEVSTJZSA-N	0	3	328.456	3.452	20	30		EGEDHN
C=CCN1CC[C@@H](NCC2(Sc3ccccc3)CCCC2)C1=O	ZINC000493695362	458537637	/nfs/dbraw/zinc/53/76/37/458537637.db2.gz	ZWWVHEQVWQRUOG-QGZVFWFLSA-N	0	3	330.497	3.468	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cc(C(C)(C)C)on1)C(C)C	ZINC000460986769	458544228	/nfs/dbraw/zinc/54/42/28/458544228.db2.gz	HXBIJUFWDMUHTF-INIZCTEOSA-N	0	3	333.476	3.401	20	30		EGEDHN
Cc1sc(NC(=O)[C@H](N)CCCC#N)nc1-c1ccc(C)cc1	ZINC000424074778	458551500	/nfs/dbraw/zinc/55/15/00/458551500.db2.gz	ICVQDOREZHMORK-CQSZACIVSA-N	0	3	328.441	3.387	20	30		EGEDHN
COc1ccc(-c2nc(NC(=O)[C@@H](N)CCCC#N)sc2C)cc1	ZINC000424078042	458552890	/nfs/dbraw/zinc/55/28/90/458552890.db2.gz	PBEVKLWNNUSCFQ-AWEZNQCLSA-N	0	3	344.440	3.087	20	30		EGEDHN
Cc1nc(NC(=O)[C@H](N)CCCC#N)sc1Cc1cccc(F)c1	ZINC000424086968	458556000	/nfs/dbraw/zinc/55/60/00/458556000.db2.gz	CRLMOYMXYWGOGO-CQSZACIVSA-N	0	3	346.431	3.141	20	30		EGEDHN
C=C(CC)CNC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C	ZINC000454278034	458556526	/nfs/dbraw/zinc/55/65/26/458556526.db2.gz	WESRJEWDHAENBW-UHFFFAOYSA-N	0	3	330.476	3.225	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1ccc(Cl)c(Br)c1	ZINC000424118127	458562222	/nfs/dbraw/zinc/56/22/22/458562222.db2.gz	BESYLWRGPITNFV-LLVKDONJSA-N	0	3	330.613	3.062	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)NC[C@H](Cc1ccccc1)c1ccccc1	ZINC000424127038	458565330	/nfs/dbraw/zinc/56/53/30/458565330.db2.gz	PQRJRGMIHIWAQD-PMACEKPBSA-N	0	3	335.451	3.150	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1ccccc1CN1CCc2ccccc21	ZINC000424126402	458565786	/nfs/dbraw/zinc/56/57/86/458565786.db2.gz	BNYPCQYEWOELFJ-SFHVURJKSA-N	0	3	348.450	3.209	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1ccccc1CN1CCc2ccccc21	ZINC000424126401	458565898	/nfs/dbraw/zinc/56/58/98/458565898.db2.gz	BNYPCQYEWOELFJ-GOSISDBHSA-N	0	3	348.450	3.209	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1cccc(-c2ccc3c(c2)CCO3)c1	ZINC000424165113	458574636	/nfs/dbraw/zinc/57/46/36/458574636.db2.gz	DKMROBLFTAWPMS-GOSISDBHSA-N	0	3	335.407	3.248	20	30		EGEDHN
N#Cc1ccc(OCCCN2CC[C@@H](OCc3ccncc3)C2)cc1	ZINC000373829401	458617440	/nfs/dbraw/zinc/61/74/40/458617440.db2.gz	BGPDPNWKAYZDGK-HXUWFJFHSA-N	0	3	337.423	3.013	20	30		EGEDHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1cccc(CC#N)c1	ZINC000455907753	458620232	/nfs/dbraw/zinc/62/02/32/458620232.db2.gz	PPUTZYSJBODRHT-MRXNPFEDSA-N	0	3	336.439	3.395	20	30		EGEDHN
CN(C)[C@H](CNC(=O)Nc1cccc(CC#N)c1)Cc1ccccc1	ZINC000455947470	458624082	/nfs/dbraw/zinc/62/40/82/458624082.db2.gz	OCAJZMGJQZVYPD-IBGZPJMESA-N	0	3	336.439	3.047	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)NCCN1CCCC(C)(C)C1	ZINC000470274125	458626808	/nfs/dbraw/zinc/62/68/08/458626808.db2.gz	PDIZKPWQROFJNA-UHFFFAOYSA-N	0	3	346.471	3.112	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN1CCCC[C@@H]1[C@@H]1C[C@@H](C)CC[C@@H]1O	ZINC000439006204	458641135	/nfs/dbraw/zinc/64/11/35/458641135.db2.gz	GPWZMWXBCZLEBW-OKYOBFRVSA-N	0	3	336.520	3.063	20	30		EGEDHN
C=CCC(C)(C)CNC(=O)NCc1ccc(OCCN(C)C)cc1	ZINC000432088700	458675018	/nfs/dbraw/zinc/67/50/18/458675018.db2.gz	KVFAVMMDZKLWQC-UHFFFAOYSA-N	0	3	333.476	3.029	20	30		EGEDHN
COC(=O)[C@]1(C)CN(CC#Cc2ccc(C(F)(F)F)cc2)C[C@H]1C	ZINC000503192175	458696351	/nfs/dbraw/zinc/69/63/51/458696351.db2.gz	HGULXBHEZSLFLC-CXAGYDPISA-N	0	3	339.357	3.188	20	30		EGEDHN
CC[C@@](C)(C#N)C(=O)NC[C@H](C(C)C)N1CCc2ccccc2C1	ZINC000505605760	458745286	/nfs/dbraw/zinc/74/52/86/458745286.db2.gz	FCHAUOWLSRVRBD-QUCCMNQESA-N	0	3	327.472	3.125	20	30		EGEDHN
C[C@H](C(=O)NC1(C#N)CCC1)N1CCC[C@@H](c2ccccc2)CC1	ZINC000530336217	458750785	/nfs/dbraw/zinc/75/07/85/458750785.db2.gz	TXHWQEZWQFJWKL-SJLPKXTDSA-N	0	3	325.456	3.207	20	30		EGEDHN
C=CCC(C)(C)CNC(=O)NCC1(N2CCSCC2)CCCC1	ZINC000432561548	458756136	/nfs/dbraw/zinc/75/61/36/458756136.db2.gz	YIDFDXMLTYHMBB-UHFFFAOYSA-N	0	3	339.549	3.250	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)N2CCN(C3CCCC3)CC2)cc1	ZINC000508401649	458758644	/nfs/dbraw/zinc/75/86/44/458758644.db2.gz	IWEAOULLNLEQQP-UHFFFAOYSA-N	0	3	343.471	3.021	20	30		EGEDHN
C=C[C@H]1CCCCN1C(=O)[C@@H]1CN(C(C)(C)C)C[C@H]1C(F)(F)F	ZINC000508643819	458761769	/nfs/dbraw/zinc/76/17/69/458761769.db2.gz	PJFVNGQQSWQEFS-BFHYXJOUSA-N	0	3	332.410	3.462	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCc1c(F)cc(F)cc1F	ZINC000511118197	458777514	/nfs/dbraw/zinc/77/75/14/458777514.db2.gz	ALYOSMJDUMQIBY-ZDUSSCGKSA-N	0	3	332.325	3.493	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1C[C@H](c2ccccc2)[C@@H]2CCC[C@H]21	ZINC000511841538	458780583	/nfs/dbraw/zinc/78/05/83/458780583.db2.gz	HHJWBSUXFQBRON-GSEOLPGOSA-N	0	3	339.483	3.263	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)[C@@H](C)N1CC[C@@H](Cc2ccccc2)[C@@H]1C	ZINC000472339030	458787207	/nfs/dbraw/zinc/78/72/07/458787207.db2.gz	BBVYRBCUWJHIAB-ZDWTUXFCSA-N	0	3	341.499	3.382	20	30		EGEDHN
CCCN(CC(=O)N(CC)C[C@@H](C)C#N)[C@H]1CCc2ccccc2C1	ZINC000513632675	458795127	/nfs/dbraw/zinc/79/51/27/458795127.db2.gz	FGJRGJPXVDVZHT-PXNSSMCTSA-N	0	3	341.499	3.264	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCC(C)(C)Oc2ccccc2)CC1	ZINC000514249041	458798163	/nfs/dbraw/zinc/79/81/63/458798163.db2.gz	AADQYGCLDWSKTJ-UHFFFAOYSA-N	0	3	345.487	3.184	20	30		EGEDHN
Cc1cccc([C@@H](C)NC[C@H](O)COc2ccc(CC#N)cc2)c1C	ZINC000515319730	458807648	/nfs/dbraw/zinc/80/76/48/458807648.db2.gz	RNJGRSCGMIMKOD-MJGOQNOKSA-N	0	3	338.451	3.460	20	30		EGEDHN
O[C@H]1CCN(CC#Cc2ccc(OC(F)(F)F)cc2)C12CCCC2	ZINC000433035483	458831023	/nfs/dbraw/zinc/83/10/23/458831023.db2.gz	MNPMDACFGXSLHS-INIZCTEOSA-N	0	3	339.357	3.316	20	30		EGEDHN
Cc1ccc(C#N)cc1NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1	ZINC000530844800	458835048	/nfs/dbraw/zinc/83/50/48/458835048.db2.gz	SZKOLBJJQIGDSJ-GOSISDBHSA-N	0	3	334.423	3.112	20	30		EGEDHN
N#Cc1ccccc1CSCCNCc1cc(C(F)(F)F)n[nH]1	ZINC000440801953	458855254	/nfs/dbraw/zinc/85/52/54/458855254.db2.gz	QGWJMAOSRRCNNC-UHFFFAOYSA-N	0	3	340.374	3.323	20	30		EGEDHN
COC(=O)N1CCC[C@H]([C@@H](C)N[C@H](C)c2ccc(C#N)cc2F)C1	ZINC000495509117	458871158	/nfs/dbraw/zinc/87/11/58/458871158.db2.gz	DIEIZQMZRZDTGH-NFAWXSAZSA-N	0	3	333.407	3.215	20	30		EGEDHN
C=C(C)Cn1c(-c2ccccc2)nnc1N1CCN(CC(C)C)CC1	ZINC000549658068	458883165	/nfs/dbraw/zinc/88/31/65/458883165.db2.gz	POAOFZBTVGMJNW-UHFFFAOYSA-N	0	3	339.487	3.299	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@@H](C1CC1)C(C)(C)CO	ZINC000550103190	458884611	/nfs/dbraw/zinc/88/46/11/458884611.db2.gz	ZRXUQDMAZIQTCO-SFHVURJKSA-N	0	3	348.512	3.290	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN1C[C@@H](c2ccccc2)C(C)(C)C1	ZINC000441097069	458888609	/nfs/dbraw/zinc/88/86/09/458888609.db2.gz	YGHWCYXHFSMGMP-WMZOPIPTSA-N	0	3	327.472	3.120	20	30		EGEDHN
C[C@H](CNC(=O)c1ccc(C(C)(C)C#N)cc1)N1CCCC[C@@H]1C	ZINC000474890229	458905583	/nfs/dbraw/zinc/90/55/83/458905583.db2.gz	UGEPHKRMWGFUHI-JKSUJKDBSA-N	0	3	327.472	3.480	20	30		EGEDHN
CC#CCCCC(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1	ZINC000466642421	458910701	/nfs/dbraw/zinc/91/07/01/458910701.db2.gz	TYAPEEXYUZMQKL-UHFFFAOYSA-N	0	3	327.472	3.349	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)N1CCC[C@H]1c1cccc(N(C)C)c1	ZINC000441347506	458924613	/nfs/dbraw/zinc/92/46/13/458924613.db2.gz	ALJNTDTTYJCICI-PXNSSMCTSA-N	0	3	341.499	3.479	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)NCC2(C#N)CC2)N(CC)CC)cc1	ZINC000576951688	458954456	/nfs/dbraw/zinc/95/44/56/458954456.db2.gz	NPHFYHPYXBFKIS-SFHVURJKSA-N	0	3	342.487	3.235	20	30		EGEDHN
CC(C)CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(C)C)C1=O	ZINC000566777314	458997185	/nfs/dbraw/zinc/99/71/85/458997185.db2.gz	LJFZZYVRUKMUTL-IBGZPJMESA-N	0	3	327.472	3.416	20	30		EGEDHN
CC(C)(C)N1CCCN(C(=O)C(C)(C)Oc2ccc(C#N)cc2)CC1	ZINC000531952790	459005951	/nfs/dbraw/zinc/00/59/51/459005951.db2.gz	BPFQAOHTTGJYGV-UHFFFAOYSA-N	0	3	343.471	3.048	20	30		EGEDHN
N#C[C@@H]1CC[C@H](NC[C@@H](O)COc2cccc(Cl)c2Cl)C1	ZINC000442778812	459033886	/nfs/dbraw/zinc/03/38/86/459033886.db2.gz	KXEXMOOOYMVREU-GRYCIOLGSA-N	0	3	329.227	3.015	20	30		EGEDHN
CCC[C@H](N[C@H]1CC[C@@H](C#N)C1)C(=O)N1CCc2sccc2C1	ZINC000442785683	459035774	/nfs/dbraw/zinc/03/57/74/459035774.db2.gz	SHIZWUAIFHCSPL-KBMXLJTQSA-N	0	3	331.485	3.083	20	30		EGEDHN
C[C@@H]1CCN(CC(=O)NCc2cccc(C#N)c2)[C@H]2CCCC[C@H]12	ZINC000520172946	459036086	/nfs/dbraw/zinc/03/60/86/459036086.db2.gz	WESMOLOTVJXEMO-LZQZEXGQSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)C1=Cc2ccccc2OC1)C(C)C	ZINC000496026103	459042244	/nfs/dbraw/zinc/04/22/44/459042244.db2.gz	BHSCQBDCQCXXRK-IBGZPJMESA-N	0	3	340.467	3.277	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@H]1CC[C@H](CNC[C@@H](C#N)CCC#N)CC1	ZINC000496075349	459056714	/nfs/dbraw/zinc/05/67/14/459056714.db2.gz	GEICOFAIBHTHKG-BRWVUGGUSA-N	0	3	348.491	3.351	20	30		EGEDHN
C[C@@H](NC(=O)NCC#Cc1ccccc1)[C@H](c1ccccc1)N(C)C	ZINC000477820125	459061227	/nfs/dbraw/zinc/06/12/27/459061227.db2.gz	PMLRHHPDBCNRFJ-YLJYHZDGSA-N	0	3	335.451	3.029	20	30		EGEDHN
N#CCCCOc1cccc(NC2CCN(C[C@@H]3CCCO3)CC2)c1	ZINC000594516376	459074440	/nfs/dbraw/zinc/07/44/40/459074440.db2.gz	YTEODNVNXBXHIC-FQEVSTJZSA-N	0	3	343.471	3.424	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H](CCNCc2ccc(C#N)c(F)c2)C1	ZINC000496161612	459092758	/nfs/dbraw/zinc/09/27/58/459092758.db2.gz	ODGYSUVWPIHCIQ-CQSZACIVSA-N	0	3	347.434	3.434	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H]2CCC[C@@H]([S@@](C)=O)C2)cc1OC	ZINC000594969484	459199325	/nfs/dbraw/zinc/19/93/25/459199325.db2.gz	ZTBZRXIVDHJEKJ-CKNGIIGNSA-N	0	3	337.485	3.039	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccccc2Oc2ccncc2)CC1	ZINC000558714880	459201325	/nfs/dbraw/zinc/20/13/25/459201325.db2.gz	NGAKYHKIFUTYFZ-UHFFFAOYSA-N	0	3	337.423	3.254	20	30		EGEDHN
CCO[C@H]1C[C@@H](NCC(=O)Nc2oc(C)c(C)c2C#N)C12CCCC2	ZINC000590739513	459201652	/nfs/dbraw/zinc/20/16/52/459201652.db2.gz	SBYJVPIOYHJOIO-CVEARBPZSA-N	0	3	345.443	3.034	20	30		EGEDHN
CC[C@@H](NCc1cccc(S(C)(=O)=O)c1)c1ccc(C#N)cc1	ZINC000590779400	459214419	/nfs/dbraw/zinc/21/44/19/459214419.db2.gz	MOOXTDOEMTWBHB-GOSISDBHSA-N	0	3	328.437	3.203	20	30		EGEDHN
CC(C#N)C(=O)N1CCC([C@@H]2N(C(=O)OC(C)(C)C)CC2(C)C)CC1	ZINC000496507131	459220563	/nfs/dbraw/zinc/22/05/63/459220563.db2.gz	ILAVVJVWNNPGSD-ZFWWWQNUSA-N	0	3	349.475	3.030	20	30		EGEDHN
C[C@H](N[C@@H]1CCC[C@H](S(C)(=O)=O)C1)c1ccc(C#N)cc1Cl	ZINC000578588195	459225338	/nfs/dbraw/zinc/22/53/38/459225338.db2.gz	WQKFOCPZYMJHEV-YUTCNCBUSA-N	0	3	340.876	3.218	20	30		EGEDHN
C=CCCS(=O)(=O)NC[C@@H](CC(C)C)N[C@@H](C)c1ccccc1	ZINC000480975882	459226180	/nfs/dbraw/zinc/22/61/80/459226180.db2.gz	CVTDARNXNHIEBV-FUHWJXTLSA-N	0	3	338.517	3.247	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN[C@@H](CC)c1ccncc1	ZINC000579704387	459250403	/nfs/dbraw/zinc/25/04/03/459250403.db2.gz	SNRZWJRBAUSTMX-OALUTQOASA-N	0	3	326.440	3.291	20	30		EGEDHN
CC(C)C[C@]1(CO)CCCN1C(=O)C(C#N)CCc1ccccc1	ZINC000559297418	459250607	/nfs/dbraw/zinc/25/06/07/459250607.db2.gz	GYRNESOLIVQEHM-ICSRJNTNSA-N	0	3	328.456	3.159	20	30		EGEDHN
C=C[C@@H](CC(=O)N1C[C@@H](c2ccccc2F)[C@H](N)C1)c1ccccc1	ZINC000581551371	459273698	/nfs/dbraw/zinc/27/36/98/459273698.db2.gz	LMKOHNIXHMFSJZ-ZAAXVRCTSA-N	0	3	338.426	3.439	20	30		EGEDHN
C[C@H](CCCCNC(=O)OC(C)(C)C)NCc1nc(C#N)cs1	ZINC000496676690	459281985	/nfs/dbraw/zinc/28/19/85/459281985.db2.gz	JRHYQYVVWQEXGZ-GFCCVEGCSA-N	0	3	338.477	3.188	20	30		EGEDHN
C[C@@H](NC(=O)N[C@@H](C)CN1CCC(C)CC1)c1ccc(C#N)cc1	ZINC000595460959	459309598	/nfs/dbraw/zinc/30/95/98/459309598.db2.gz	IPDLDNOTOLRPID-JKSUJKDBSA-N	0	3	328.460	3.039	20	30		EGEDHN
CN(Cc1ccccc1)C1(CNC(=O)c2ccc(C#N)s2)CCC1	ZINC000560333728	459324163	/nfs/dbraw/zinc/32/41/63/459324163.db2.gz	SXGYWSIHFMCMSJ-UHFFFAOYSA-N	0	3	339.464	3.404	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NC[C@H](c1ccc(CC)cc1)N(C)C)OCC	ZINC000534416877	459326224	/nfs/dbraw/zinc/32/62/24/459326224.db2.gz	WTJJRAZLRBPYIP-MOPGFXCFSA-N	0	3	332.488	3.339	20	30		EGEDHN
Cc1cc(C(C)(C)C)ccc1OC[C@@H](O)CNCC1(CC#N)CC1	ZINC000568859797	459357487	/nfs/dbraw/zinc/35/74/87/459357487.db2.gz	WJUJUIWQEOXLGK-KRWDZBQOSA-N	0	3	330.472	3.316	20	30		EGEDHN
N#CC[C@H]1CCCN(C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000595610238	459365022	/nfs/dbraw/zinc/36/50/22/459365022.db2.gz	ULCMEEVVDVIOAN-CHWSQXEVSA-N	0	3	343.254	3.359	20	30		EGEDHN
C[C@H](c1ccc(F)cc1)N1CCC[C@H](N[C@@H]2CC[C@@H](C#N)C2)C1=O	ZINC000569108704	459397429	/nfs/dbraw/zinc/39/74/29/459397429.db2.gz	QBKPFOXDXUAJLX-DTDBQYNISA-N	0	3	329.419	3.160	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2NC[C@@H](O)COc1ccccc1F	ZINC000569232094	459418685	/nfs/dbraw/zinc/41/86/85/459418685.db2.gz	ITVPCUXWICPZOW-VQIMIIECSA-N	0	3	340.398	3.104	20	30		EGEDHN
COc1cc2[nH]c(CCCNC[C@H](C#N)CCC#N)cc2c(OC)c1	ZINC000569303872	459427678	/nfs/dbraw/zinc/42/76/78/459427678.db2.gz	FZAGJPBGLZFKJI-AWEZNQCLSA-N	0	3	340.427	3.151	20	30		EGEDHN
Cc1ccc(C)c(OC[C@H](O)CN[C@H]2CCc3cc(C#N)ccc32)c1	ZINC000591763855	459430263	/nfs/dbraw/zinc/43/02/63/459430263.db2.gz	MYBCCKSSLXLKHI-QUCCMNQESA-N	0	3	336.435	3.192	20	30		EGEDHN
Cc1cccc(C)c1OC[C@@H](O)CN[C@@H]1CCc2cc(C#N)ccc21	ZINC000591763766	459430292	/nfs/dbraw/zinc/43/02/92/459430292.db2.gz	IFJPTNKSCNDDRC-AZUAARDMSA-N	0	3	336.435	3.192	20	30		EGEDHN
N#Cc1ccc2c(c1)CC[C@H]2NC[C@@H](O)COc1ccc(Cl)cc1	ZINC000591763957	459431625	/nfs/dbraw/zinc/43/16/25/459431625.db2.gz	SSOROTVOYHQJLT-VQIMIIECSA-N	0	3	342.826	3.228	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1CCC([C@@H]2CCCCO2)CC1	ZINC000595790259	459443141	/nfs/dbraw/zinc/44/31/41/459443141.db2.gz	VLRINGWUYNNEPO-SFHVURJKSA-N	0	3	344.455	3.227	20	30		EGEDHN
N#Cc1cccc(OCCCN2CCOC(C3CC3)(C3CC3)C2)c1	ZINC000595822072	459453342	/nfs/dbraw/zinc/45/33/42/459453342.db2.gz	LZRBBNDRDVJASZ-UHFFFAOYSA-N	0	3	326.440	3.218	20	30		EGEDHN
N#Cc1cccc(C2(NCCCn3c4ccccc4[nH]c3=O)CC2)c1	ZINC000582980094	459462781	/nfs/dbraw/zinc/46/27/81/459462781.db2.gz	QISHVGGVXUMPAF-UHFFFAOYSA-N	0	3	332.407	3.283	20	30		EGEDHN
COc1cc(CN(C)CCOCc2ccc(C#N)cc2)ccc1C#N	ZINC000569507328	459463013	/nfs/dbraw/zinc/46/30/13/459463013.db2.gz	DINNZHNCUINJQU-UHFFFAOYSA-N	0	3	335.407	3.087	20	30		EGEDHN
Cc1ccccc1OC[C@@H](O)CN[C@H]1CCCc2cc(C#N)ccc21	ZINC000569569180	459472920	/nfs/dbraw/zinc/47/29/20/459472920.db2.gz	WOSYYBDNRTVKQX-ICSRJNTNSA-N	0	3	336.435	3.274	20	30		EGEDHN
N#CC1(NC(=O)CN[C@H](c2ccc(Cl)cc2)C2CCC2)CCC1	ZINC000525893456	459512499	/nfs/dbraw/zinc/51/24/99/459512499.db2.gz	ISZUKMDZECXRIW-KRWDZBQOSA-N	0	3	331.847	3.333	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCc1ccc(OCCN2CCCC2)cc1	ZINC000569826616	459517694	/nfs/dbraw/zinc/51/76/94/459517694.db2.gz	FJVPPJAHRNBHFB-UHFFFAOYSA-N	0	3	330.472	3.380	20	30		EGEDHN
CC(C)[C@H]1CN(CC#Cc2ccc(OC(F)(F)F)cc2)CCN1C	ZINC000487963303	459536578	/nfs/dbraw/zinc/53/65/78/459536578.db2.gz	LBRQQCBGNKGCEP-QGZVFWFLSA-N	0	3	340.389	3.209	20	30		EGEDHN
COc1ccc([C@@H](CCC#N)N[C@H]2CCN(CC(F)(F)F)C2)cc1	ZINC000569955696	459538008	/nfs/dbraw/zinc/53/80/08/459538008.db2.gz	GGBKHLAOLVTIMM-GOEBONIOSA-N	0	3	341.377	3.266	20	30		EGEDHN
CN(C)CCN(Cc1ccc(F)cc1)c1nc(C#N)c(Cl)s1	ZINC000596158073	459542121	/nfs/dbraw/zinc/54/21/21/459542121.db2.gz	OTSFZAONESJBKM-UHFFFAOYSA-N	0	3	338.839	3.375	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000488733662	459549246	/nfs/dbraw/zinc/54/92/46/459549246.db2.gz	PEUJEEXAZMJKCQ-IEBWSBKVSA-N	0	3	337.467	3.315	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000488742370	459550760	/nfs/dbraw/zinc/55/07/60/459550760.db2.gz	FAQIIIFNCYKFMV-PKOBYXMFSA-N	0	3	337.467	3.457	20	30		EGEDHN
C=CCn1cccc1C(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000488948878	459556744	/nfs/dbraw/zinc/55/67/44/459556744.db2.gz	TYBSXDOQAHESBH-UHFFFAOYSA-N	0	3	347.528	3.156	20	30		EGEDHN
N#Cc1cc(N(CCN2CCCC2)Cc2ccc(Cl)cc2)ncn1	ZINC000562420074	459558709	/nfs/dbraw/zinc/55/87/09/459558709.db2.gz	UARNRUIXBCOCDA-UHFFFAOYSA-N	0	3	341.846	3.104	20	30		EGEDHN
CN(C)CCN(C(=O)c1ccc(Cl)c(C#N)c1)c1ccccc1	ZINC000542534920	459569223	/nfs/dbraw/zinc/56/92/23/459569223.db2.gz	WNCBWGDRDDXNIU-UHFFFAOYSA-N	0	3	327.815	3.420	20	30		EGEDHN
C=CCN(CCc1ccco1)C(=O)NC[C@H](C)N1CCCC[C@H]1C	ZINC000498144745	459570642	/nfs/dbraw/zinc/57/06/42/459570642.db2.gz	ISQRDAAVKYFXRC-SJORKVTESA-N	0	3	333.476	3.283	20	30		EGEDHN
C[C@H](NCC#Cc1ccc(OC(F)(F)F)cc1)[C@H]1CCCOC1	ZINC000542578728	459572108	/nfs/dbraw/zinc/57/21/08/459572108.db2.gz	VSBUKPDXXYCJTM-ZFWWWQNUSA-N	0	3	327.346	3.341	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1C[C@@H](c2ccc(C)cc2)C[C@@H]1C	ZINC000490041020	459575831	/nfs/dbraw/zinc/57/58/31/459575831.db2.gz	YKPHOAUGARKRDV-AOIWGVFYSA-N	0	3	327.472	3.181	20	30		EGEDHN
C[C@@H](NCC1(c2ccccc2)CCCC1)C(=O)NC1(C#N)CCC1	ZINC000527039894	459580886	/nfs/dbraw/zinc/58/08/86/459580886.db2.gz	NDUZGPNMLVJHEV-MRXNPFEDSA-N	0	3	325.456	3.039	20	30		EGEDHN
CC[C@H](N[C@@H]1CCc2ccc(C#N)cc21)C(=O)NCc1cccs1	ZINC000592396207	459591530	/nfs/dbraw/zinc/59/15/30/459591530.db2.gz	OYRRUPCGFYTTPT-ZWKOTPCHSA-N	0	3	339.464	3.292	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@@H](N[C@H]1CCN(C(=O)C3CCCCC3)C1)CC2	ZINC000583781924	459594943	/nfs/dbraw/zinc/59/49/43/459594943.db2.gz	JYEWPMTVCATNMN-ICSRJNTNSA-N	0	3	337.467	3.316	20	30		EGEDHN
C#CCNC(=O)CCN[C@H](C)c1cccc(OCc2ccccc2)c1	ZINC000491069145	459596508	/nfs/dbraw/zinc/59/65/08/459596508.db2.gz	TZHWSLUZNIJUPS-QGZVFWFLSA-N	0	3	336.435	3.056	20	30		EGEDHN
N#CC1(NC(=O)CN(CCc2ccc(F)cc2)C2CCCC2)CCC1	ZINC000527128324	459597719	/nfs/dbraw/zinc/59/77/19/459597719.db2.gz	VPXVKXNOPCVBFM-UHFFFAOYSA-N	0	3	343.446	3.175	20	30		EGEDHN
C#C[C@@H](NC1CCC(CS(C)(=O)=O)CC1)c1ccc(Cl)cc1	ZINC000491126069	459599430	/nfs/dbraw/zinc/59/94/30/459599430.db2.gz	KJEUZSONWWZOLN-QWFMPGPPSA-N	0	3	339.888	3.207	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)N1CCC(c2cccc(OC)c2)CC1	ZINC000498655642	459599734	/nfs/dbraw/zinc/59/97/34/459599734.db2.gz	JSICDXFSUUYGHJ-KRWDZBQOSA-N	0	3	342.483	3.464	20	30		EGEDHN
C#C[C@H](N[C@H](C)C1CN(C(=O)OC(C)(C)C)C1)c1ccc(F)cc1	ZINC000491181828	459603570	/nfs/dbraw/zinc/60/35/70/459603570.db2.gz	WDXZTZYPQBOAJD-DYVFJYSZSA-N	0	3	332.419	3.345	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(OC(C)(C)C)c(C#N)c2)CC1	ZINC000491297740	459613850	/nfs/dbraw/zinc/61/38/50/459613850.db2.gz	RYGHUDVUYNTFQX-UHFFFAOYSA-N	0	3	339.439	3.019	20	30		EGEDHN
CC(C)(C)N1CCCN(C(=O)c2ccc(C(C)(C)C#N)cc2)CC1	ZINC000527241147	459614327	/nfs/dbraw/zinc/61/43/27/459614327.db2.gz	PLLBUDOPZWITRH-UHFFFAOYSA-N	0	3	327.472	3.434	20	30		EGEDHN
C#C[C@H](C)N(C)C(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000491524934	459633918	/nfs/dbraw/zinc/63/39/18/459633918.db2.gz	PBMANWIQFGHFKD-INIZCTEOSA-N	0	3	329.444	3.037	20	30		EGEDHN
C#CCN1CCC(C(=O)NC[C@@H]2CCCC[C@@H]2c2ccccc2)CC1	ZINC000491622586	459641242	/nfs/dbraw/zinc/64/12/42/459641242.db2.gz	GODNAQLSSNZGBG-LEWJYISDSA-N	0	3	338.495	3.422	20	30		EGEDHN
N#C[C@H](c1cccc(Cl)c1)N1CCN(C[C@@H]2CCCC[C@@H]2O)CC1	ZINC000584175472	459673684	/nfs/dbraw/zinc/67/36/84/459673684.db2.gz	AHJVXHHSJXTKKY-UHOSZYNNSA-N	0	3	347.890	3.073	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccc(Cl)c(C#N)c1)N(C)Cc1ccccc1	ZINC000543645930	459680058	/nfs/dbraw/zinc/68/00/58/459680058.db2.gz	AVGCHHWBERDRGZ-AWEZNQCLSA-N	0	3	341.842	3.462	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](O)Cc2ccccc2C(F)(F)F)cc1	ZINC000562987754	459686721	/nfs/dbraw/zinc/68/67/21/459686721.db2.gz	KKPVSPJVQYLROZ-INIZCTEOSA-N	0	3	334.341	3.270	20	30		EGEDHN
COC(=O)N1CCC([C@@H](C)NCC#Cc2ccccc2Cl)CC1	ZINC000492200130	459695264	/nfs/dbraw/zinc/69/52/64/459695264.db2.gz	DAKPJYISSHZBOI-CQSZACIVSA-N	0	3	334.847	3.148	20	30		EGEDHN
C[C@H](CCc1cccc(F)c1)N1CCN(c2cc(C#N)ccn2)CC1	ZINC000543985952	459717100	/nfs/dbraw/zinc/71/71/00/459717100.db2.gz	HBODBTOSJVRFBB-MRXNPFEDSA-N	0	3	338.430	3.236	20	30		EGEDHN
N#Cc1ccc2c(c1)N(C(=O)C(C[C@H]1CCCO1)C(F)(F)F)CC2	ZINC000593108360	459775281	/nfs/dbraw/zinc/77/52/81/459775281.db2.gz	WFHBVFYLBCHHOK-KGLIPLIRSA-N	0	3	338.329	3.195	20	30		EGEDHN
N#Cc1ccc2c(c1)N(C(=O)C(C[C@H]1CCCO1)C(F)(F)F)CC2	ZINC000593108362	459775546	/nfs/dbraw/zinc/77/55/46/459775546.db2.gz	WFHBVFYLBCHHOK-ZIAGYGMSSA-N	0	3	338.329	3.195	20	30		EGEDHN
C[C@@H]1CCC[C@@](C#N)(NC(=O)[C@H]2CCN(Cc3ccccc3)C2)C1	ZINC000565186298	459782482	/nfs/dbraw/zinc/78/24/82/459782482.db2.gz	UPWTYVFSKALABR-IMFGXOCKSA-N	0	3	325.456	3.097	20	30		EGEDHN
Cc1cc(C#N)nc(N2CCN(Cc3ccccc3)C[C@@H]2C(C)C)n1	ZINC000528118173	459799140	/nfs/dbraw/zinc/79/91/40/459799140.db2.gz	ZBNAIWCFZMFRQR-LJQANCHMSA-N	0	3	335.455	3.004	20	30		EGEDHN
Cc1ccccc1[C@H]1CCN(C[C@H](O)COc2ccccc2C#N)C1	ZINC000528366300	459804434	/nfs/dbraw/zinc/80/44/34/459804434.db2.gz	SXYWXJIWMNJWEJ-OALUTQOASA-N	0	3	336.435	3.096	20	30		EGEDHN
Cc1ccccc1[C@@H]1CCN(C[C@H](O)COc2ccccc2C#N)C1	ZINC000528366298	459804758	/nfs/dbraw/zinc/80/47/58/459804758.db2.gz	SXYWXJIWMNJWEJ-MOPGFXCFSA-N	0	3	336.435	3.096	20	30		EGEDHN
CN(CCC#N)C[C@H](O)CN[C@@H](CC(C)(C)C)c1ccc(F)cc1	ZINC000566106282	459806205	/nfs/dbraw/zinc/80/62/05/459806205.db2.gz	LYKIPTWCQBDICS-MSOLQXFVSA-N	0	3	335.467	3.099	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2C[C@H]2c2ccc(C)cc2)CC1	ZINC000566150978	459814898	/nfs/dbraw/zinc/81/48/98/459814898.db2.gz	MLQCZUPROZVPSD-RBUKOAKNSA-N	0	3	327.472	3.191	20	30		EGEDHN
COCc1ccc(NC(=O)C[C@@H](c2ccccc2)N(C)C)cc1C#N	ZINC000529815172	459850186	/nfs/dbraw/zinc/85/01/86/459850186.db2.gz	CSJYFEMRWGRHQG-IBGZPJMESA-N	0	3	337.423	3.336	20	30		EGEDHN
CC[C@@H](C#N)C(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1	ZINC000593427375	459886413	/nfs/dbraw/zinc/88/64/13/459886413.db2.gz	UXRMMSFRLSLXJZ-AWEZNQCLSA-N	0	3	341.377	3.145	20	30		EGEDHN
CCc1cc(NC2CCN(Cc3cccc(C#N)c3)CC2)nc(C)n1	ZINC000593516060	459913174	/nfs/dbraw/zinc/91/31/74/459913174.db2.gz	WXFUQQGGJDIDLD-UHFFFAOYSA-N	0	3	335.455	3.296	20	30		EGEDHN
C[C@H](CN1CCC[C@H](C)C1)NC(=O)c1cc2ccccc2n1CC#N	ZINC000609166888	459917711	/nfs/dbraw/zinc/91/77/11/459917711.db2.gz	NVMHOSLIMAAAIM-JKSUJKDBSA-N	0	3	338.455	3.015	20	30		EGEDHN
C[C@@H](CNC(=O)c1cc2ccccc2n1CC#N)N1CCC(C)CC1	ZINC000609167892	459918255	/nfs/dbraw/zinc/91/82/55/459918255.db2.gz	IMTJEGMHLBACRI-INIZCTEOSA-N	0	3	338.455	3.015	20	30		EGEDHN
C[C@@H](CCC#N)CN(CCO)Cc1cc(Br)ccc1F	ZINC000602455789	459947167	/nfs/dbraw/zinc/94/71/67/459947167.db2.gz	YJDUBLOLRLKKJH-LBPRGKRZSA-N	0	3	343.240	3.322	20	30		EGEDHN
COc1ccc([C@H]2CCCN2C[C@H](O)CC(C)(C)C#N)c(OC)c1	ZINC000598584779	459953362	/nfs/dbraw/zinc/95/33/62/459953362.db2.gz	VPWRGZBZWBNFSB-RHSMWYFYSA-N	0	3	332.444	3.141	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN[C@@](C)(CO)c1cc(Cl)cc(Cl)c1	ZINC000598620188	459964896	/nfs/dbraw/zinc/96/48/96/459964896.db2.gz	JGOZEMTXWUKMEY-HOCLYGCPSA-N	0	3	345.270	3.091	20	30		EGEDHN
CO[C@@H](CN1CC=C(c2ccc(C#N)cc2)CC1)C1CCOCC1	ZINC000602495830	459968116	/nfs/dbraw/zinc/96/81/16/459968116.db2.gz	XOPDIMICVRTPDB-FQEVSTJZSA-N	0	3	326.440	3.089	20	30		EGEDHN
C[C@H](CC1(C#N)CCOCC1)NCc1cccc(Cn2cccn2)c1	ZINC000602517749	459979592	/nfs/dbraw/zinc/97/95/92/459979592.db2.gz	GLEZTHXSDAGKTI-QGZVFWFLSA-N	0	3	338.455	3.120	20	30		EGEDHN
C[C@@H](CC1(C#N)CCOCC1)NCc1ccc2c(c1)OCCCO2	ZINC000602532804	459986633	/nfs/dbraw/zinc/98/66/33/459986633.db2.gz	LXRXGBCXSZZSME-HNNXBMFYSA-N	0	3	330.428	3.036	20	30		EGEDHN
C[C@H](NC(=O)NCCN1CCCC(C)(C)C1)c1cccc(C#N)c1	ZINC000618391248	459995940	/nfs/dbraw/zinc/99/59/40/459995940.db2.gz	IPRPAOIPKIUBMK-HNNXBMFYSA-N	0	3	328.460	3.040	20	30		EGEDHN
Cc1cccc2oc(CCN[C@@H](C)CC3(C#N)CCOCC3)nc21	ZINC000602559468	459997550	/nfs/dbraw/zinc/99/75/50/459997550.db2.gz	UBMBNVBVKRMWOS-HNNXBMFYSA-N	0	3	327.428	3.367	20	30		EGEDHN
CCOc1cc(CNC[C@H](O)CC(C)(C)C#N)ccc1OC(F)F	ZINC000598715073	460003870	/nfs/dbraw/zinc/00/38/70/460003870.db2.gz	MJXPUUHOGXLFPX-CYBMUJFWSA-N	0	3	342.386	3.077	20	30		EGEDHN
Cc1ccc2[nH]c(-c3ccccc3NC(=O)[C@H](N)CCCC#N)nc2c1	ZINC000593912713	460015747	/nfs/dbraw/zinc/01/57/47/460015747.db2.gz	RUGIBURYZWXOKA-OAHLLOKOSA-N	0	3	347.422	3.498	20	30		EGEDHN
Cc1ccc2nc(-c3ccccc3NC(=O)[C@H](N)CCCC#N)[nH]c2c1	ZINC000593912713	460015750	/nfs/dbraw/zinc/01/57/50/460015750.db2.gz	RUGIBURYZWXOKA-OAHLLOKOSA-N	0	3	347.422	3.498	20	30		EGEDHN
C[C@@H](CCC#N)CN[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000602616371	460024787	/nfs/dbraw/zinc/02/47/87/460024787.db2.gz	NAJRYSDCEOHJAA-JSGCOSHPSA-N	0	3	339.361	3.340	20	30		EGEDHN
C[C@@H](NC1CCN(c2ccc(C#N)cn2)CC1)c1ccc(Cl)cn1	ZINC000614139369	460026102	/nfs/dbraw/zinc/02/61/02/460026102.db2.gz	USIXNKBYLLPOST-CYBMUJFWSA-N	0	3	341.846	3.321	20	30		EGEDHN
CC1(c2ccccc2)CN(C(=O)C(C#N)Cc2ccc(C#N)cc2)C1	ZINC000598781701	460032206	/nfs/dbraw/zinc/03/22/06/460032206.db2.gz	RISFAGGMYWMVAZ-SFHVURJKSA-N	0	3	329.403	3.041	20	30		EGEDHN
CCOc1cc(N2CCN(C[C@@H](C)CCC#N)CC2)ccc1[N+](=O)[O-]	ZINC000602638247	460035775	/nfs/dbraw/zinc/03/57/75/460035775.db2.gz	OUYVWJVYTZNELG-HNNXBMFYSA-N	0	3	346.431	3.055	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)C(=O)N1CCN(C2CCCCC2)CC1	ZINC000593993139	460045775	/nfs/dbraw/zinc/04/57/75/460045775.db2.gz	KIHHUXPKDSGTNZ-QGZVFWFLSA-N	0	3	339.483	3.214	20	30		EGEDHN
N#Cc1ccc(OCC(=O)N(CCN2CCCC2)c2ccccc2)cc1	ZINC000610052721	460056652	/nfs/dbraw/zinc/05/66/52/460056652.db2.gz	QVVIGVBINODUQG-UHFFFAOYSA-N	0	3	349.434	3.066	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCN(Cc3cccc4ncccc34)C2)nc1	ZINC000602673568	460057741	/nfs/dbraw/zinc/05/77/41/460057741.db2.gz	VVENRLVNIIWQAJ-QGZVFWFLSA-N	0	3	330.391	3.155	20	30		EGEDHN
C[C@@H](CCC#N)CN[C@@H](CO)c1ccc(Br)c(F)c1	ZINC000602671820	460057887	/nfs/dbraw/zinc/05/78/87/460057887.db2.gz	JYYZPYHSGOQPLE-HZMBPMFUSA-N	0	3	329.213	3.151	20	30		EGEDHN
CCN(CC)CCN(C(=O)CSCC#N)c1ccc(Cl)cc1	ZINC000598867736	460074775	/nfs/dbraw/zinc/07/47/75/460074775.db2.gz	QHGHQXKMYCMRHD-UHFFFAOYSA-N	0	3	339.892	3.272	20	30		EGEDHN
CC1(C(=O)N2CCC[C@@](C)(C#N)C2)CCN(Cc2ccccc2)CC1	ZINC000614276839	460079045	/nfs/dbraw/zinc/07/90/45/460079045.db2.gz	UJWHFDSTUVAMAE-FQEVSTJZSA-N	0	3	339.483	3.441	20	30		EGEDHN
C[C@H]1c2ccccc2OCCN1C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000598894083	460088021	/nfs/dbraw/zinc/08/80/21/460088021.db2.gz	QMKYNLAHBCCPGX-MAUKXSAKSA-N	0	3	345.402	3.223	20	30		EGEDHN
CC[C@H](C#N)N(C)C(=O)c1ccccc1OCCN1CCCC[C@@H]1C	ZINC000594095060	460099003	/nfs/dbraw/zinc/09/90/03/460099003.db2.gz	SOOBDJMXBZQTIO-DLBZAZTESA-N	0	3	343.471	3.314	20	30		EGEDHN
CCN(CCn1c(C)ncc1[N+](=O)[O-])[C@H](C)c1ccc(C#N)cc1	ZINC000602764274	460111973	/nfs/dbraw/zinc/11/19/73/460111973.db2.gz	OUTCTEUOZQJLJA-CYBMUJFWSA-N	0	3	327.388	3.055	20	30		EGEDHN
N#Cc1ccccc1OCCN[C@@H](Cn1cccn1)c1ccccc1	ZINC000610432955	460151620	/nfs/dbraw/zinc/15/16/20/460151620.db2.gz	KUKBPUPHTFVYFK-IBGZPJMESA-N	0	3	332.407	3.165	20	30		EGEDHN
N#Cc1ccc(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)s1	ZINC000610520758	460174196	/nfs/dbraw/zinc/17/41/96/460174196.db2.gz	IIAYPBMRAPWLQZ-INIZCTEOSA-N	0	3	339.464	3.262	20	30		EGEDHN
C[C@@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccc(S(C)(=O)=O)cc1	ZINC000618807897	460183925	/nfs/dbraw/zinc/18/39/25/460183925.db2.gz	XXTLDDQCUPLHBC-BFUOFWGJSA-N	0	3	340.448	3.300	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N2[C@H](C)CCC2(C)C)cc1	ZINC000602990582	460212822	/nfs/dbraw/zinc/21/28/22/460212822.db2.gz	YSNOEIUTRIGGTQ-OLZOCXBDSA-N	0	3	349.456	3.167	20	30		EGEDHN
N#CCCCC[C@@H](N)C(=O)Nc1nc(-c2cccc(F)c2)cs1	ZINC000594424846	460214269	/nfs/dbraw/zinc/21/42/69/460214269.db2.gz	CWOTVMOKSDJJGR-CYBMUJFWSA-N	0	3	332.404	3.299	20	30		EGEDHN
COc1ccc(-c2ccccc2)cc1CNC1CCN(CC#N)CC1	ZINC000610682630	460214951	/nfs/dbraw/zinc/21/49/51/460214951.db2.gz	WHRPXTVMHSIVQC-UHFFFAOYSA-N	0	3	335.451	3.440	20	30		EGEDHN
C[C@@H]1CO[C@H](c2ccccc2Cl)CN1C(=O)[C@H](N)CCCCC#N	ZINC000594433847	460218334	/nfs/dbraw/zinc/21/83/34/460218334.db2.gz	IBMJLPMEZXAOJW-XYPHTWIQSA-N	0	3	349.862	3.040	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CNC1(c2cccc(Cl)c2)CC1	ZINC000599356260	460236764	/nfs/dbraw/zinc/23/67/64/460236764.db2.gz	KNVGYCZGUSWFEJ-QGZVFWFLSA-N	0	3	342.826	3.230	20	30		EGEDHN
C[C@@H]1CCN(C(=O)Nc2ccnc(C#N)c2)CCN1Cc1ccccc1	ZINC000603131609	460249421	/nfs/dbraw/zinc/24/94/21/460249421.db2.gz	UMHAYHXARZNPMI-MRXNPFEDSA-N	0	3	349.438	3.082	20	30		EGEDHN
CC#CC[C@@H](CO)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1	ZINC000603430784	460304627	/nfs/dbraw/zinc/30/46/27/460304627.db2.gz	CSIAQWJNMWEWPX-AWEZNQCLSA-N	0	3	330.409	3.187	20	30		EGEDHN
CCOc1ccc(OC[C@@H](O)CN[C@H](C)c2cccc(C#N)c2)cc1	ZINC000611388967	460351556	/nfs/dbraw/zinc/35/15/56/460351556.db2.gz	OLXFECDRLKKEHG-QAPCUYQASA-N	0	3	340.423	3.047	20	30		EGEDHN
CN(Cc1ccccc1)C[C@@H](O)CN[C@H](CCC#N)c1ccccc1	ZINC000611407023	460357051	/nfs/dbraw/zinc/35/70/51/460357051.db2.gz	VCGFFJBGBMRSQC-LEWJYISDSA-N	0	3	337.467	3.114	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@@H](C)N(CC)Cc1ccc(CN(C)C)cc1	ZINC000626062549	460358063	/nfs/dbraw/zinc/35/80/63/460358063.db2.gz	WQGLKCHWGBXFBX-GOSISDBHSA-N	0	3	345.531	3.383	20	30		EGEDHN
COc1cccc2c1OC[C@@H](N[C@H](C)c1ccc(C#N)c(F)c1)C2	ZINC000611465652	460370589	/nfs/dbraw/zinc/37/05/89/460370589.db2.gz	YVTGMCWSSCZRHY-WBMJQRKESA-N	0	3	326.371	3.360	20	30		EGEDHN
Cc1ccccc1CN1CCCN(CCOc2ccccc2C#N)CC1	ZINC000604271885	460399207	/nfs/dbraw/zinc/39/92/07/460399207.db2.gz	NFMKOXGPAKTZTK-UHFFFAOYSA-N	0	3	349.478	3.453	20	30		EGEDHN
CN1CCCC(C)(C)[C@H]1CNC(=O)NCc1ccc(C#N)c(Cl)c1	ZINC000619761001	460434667	/nfs/dbraw/zinc/43/46/67/460434667.db2.gz	FYYCJYIRQRIEKE-MRXNPFEDSA-N	0	3	348.878	3.131	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN(CCc1ccc(F)cc1)CC(C)C	ZINC000604493557	460434921	/nfs/dbraw/zinc/43/49/21/460434921.db2.gz	GWMZTLQNOPVLNR-QGZVFWFLSA-N	0	3	347.478	3.334	20	30		EGEDHN
C[C@H](Oc1ccccc1C#N)c1nc(C2C[C@H]3CC[C@@H](C2)N3C)no1	ZINC000612954131	460781888	/nfs/dbraw/zinc/78/18/88/460781888.db2.gz	BWFTZHKGYARRFH-WWTUQBGBSA-N	0	3	338.411	3.421	20	30		EGEDHN
CN(C(=O)[C@@H]1CN(C(C)(C)C)C[C@H]1C(F)(F)F)[C@H]1CCC[C@H]1C#N	ZINC000601823156	460911287	/nfs/dbraw/zinc/91/12/87/460911287.db2.gz	XZGLMEPALCLDOS-DGAVXFQQSA-N	0	3	345.409	3.046	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN1CCC[C@@H]1CC(=O)c1ccc(F)cc1	ZINC000621269079	460968927	/nfs/dbraw/zinc/96/89/27/460968927.db2.gz	IVRNUSTWWPGJFH-SJORKVTESA-N	0	3	332.419	3.164	20	30		EGEDHN
C[C@@H]1CN(CCCNc2nc(C(C)(C)C)ccc2C#N)CCCO1	ZINC000617843286	460992806	/nfs/dbraw/zinc/99/28/06/460992806.db2.gz	YBYIXPGPAGSLJS-OAHLLOKOSA-N	0	3	330.476	3.164	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)C1CCC=CCC1	ZINC000602087533	461006325	/nfs/dbraw/zinc/00/63/25/461006325.db2.gz	ISUGPTIGMMWYMZ-UHFFFAOYSA-N	0	3	325.456	3.195	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(C(F)(F)F)ccc2NC)CC1	ZINC000668369834	461259646	/nfs/dbraw/zinc/25/96/46/461259646.db2.gz	GBHRSWAMCFNVDV-UHFFFAOYSA-N	0	3	341.377	3.127	20	30		EGEDHN
C=CCn1c(C)nnc1N1C[C@H](C)N(Cc2ccccc2)[C@H](C)[C@H]1C	ZINC000652567378	461268369	/nfs/dbraw/zinc/26/83/69/461268369.db2.gz	UESINPZCDBGXAH-GVDBMIGSSA-N	0	3	339.487	3.260	20	30		EGEDHN
C=CCn1c(C)nnc1N1C[C@H](C)N(Cc2ccccc2)[C@@H](C)[C@H]1C	ZINC000652567380	461268647	/nfs/dbraw/zinc/26/86/47/461268647.db2.gz	UESINPZCDBGXAH-YESZJQIVSA-N	0	3	339.487	3.260	20	30		EGEDHN
CC#CC[C@H](CO)NCc1cc(OC)c(OC)cc1-c1ccccc1	ZINC000641768593	461362066	/nfs/dbraw/zinc/36/20/66/461362066.db2.gz	CUTXGFWHONZMSB-GOSISDBHSA-N	0	3	339.435	3.235	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN(C)Cc1ccc(OC)cc1	ZINC000641938777	461415020	/nfs/dbraw/zinc/41/50/20/461415020.db2.gz	FLPAQNQTCDNTQS-IBGZPJMESA-N	0	3	341.451	3.295	20	30		EGEDHN
C=CCCn1cc(CNC[C@@H]2CCCO[C@H]2c2ccccc2)nn1	ZINC000657329573	462051633	/nfs/dbraw/zinc/05/16/33/462051633.db2.gz	RYHKAGMDXDCRTE-HKUYNNGSSA-N	0	3	326.444	3.112	20	30		EGEDHN
C=CC[C@@H]1CCCN([C@@H](C)C(=O)N[C@H]2CCOc3ccccc32)C1	ZINC000661378770	462223539	/nfs/dbraw/zinc/22/35/39/462223539.db2.gz	LVVSAHFARSMAND-JZXOWHBKSA-N	0	3	328.456	3.303	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)Nc1cnc2c(c1)CNCC2	ZINC000667790800	462264548	/nfs/dbraw/zinc/26/45/48/462264548.db2.gz	CBLIRWHFVHDVOY-UHFFFAOYSA-N	0	3	328.441	3.009	20	30		EGEDHN
C=CCOCCCC(=O)N1CCCN(CCCc2ccccc2)CC1	ZINC000266292353	534871809	/nfs/dbraw/zinc/87/18/09/534871809.db2.gz	ONAIWJAFPAPFGU-UHFFFAOYSA-N	0	3	344.499	3.136	20	30		EGEDHN
C=CCN1CCC(NC(=O)Cc2ccc(OCC(C)C)cc2)CC1	ZINC000170946154	526424010	/nfs/dbraw/zinc/42/40/10/526424010.db2.gz	ZKHNHNQAKAONBD-UHFFFAOYSA-N	0	3	330.472	3.031	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](CC)c2ccc(OC)cc2)CC1	ZINC000171701290	526438689	/nfs/dbraw/zinc/43/86/89/526438689.db2.gz	OXQBJDAXMXYDKM-GOSISDBHSA-N	0	3	331.460	3.096	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc3oc(C4CC4)nc3c2)CC1	ZINC000171739660	526441805	/nfs/dbraw/zinc/44/18/05/526441805.db2.gz	LFNKZGGCDCXODO-UHFFFAOYSA-N	0	3	340.427	3.477	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@H](C)N[C@H](C)c1ccc(-n2cccn2)cc1	ZINC000174370499	526543222	/nfs/dbraw/zinc/54/32/22/526543222.db2.gz	UGJFIQOVRQAXRJ-SJORKVTESA-N	0	3	340.471	3.336	20	30		EGEDHN
CC[C@@H](C)CN(CC)CC(=O)Nc1c(C#N)cnn1-c1ccccc1	ZINC000177854274	529318462	/nfs/dbraw/zinc/31/84/62/529318462.db2.gz	BSSGYQDVPOQGLF-OAHLLOKOSA-N	0	3	339.443	3.050	20	30		EGEDHN
CC(C)N(Cc1cccc(F)c1)C[C@@H](O)COc1ccc(C#N)cc1	ZINC000353334245	535096299	/nfs/dbraw/zinc/09/62/99/535096299.db2.gz	TYBJTMHINMDOMM-LJQANCHMSA-N	0	3	342.414	3.348	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC2CCC(OC(C)C)CC2)CC1	ZINC000125835897	546755214	/nfs/dbraw/zinc/75/52/14/546755214.db2.gz	WQDJMZOCJKKDAO-UHFFFAOYSA-N	0	3	337.508	3.062	20	30		EGEDHN
Cc1cc(Cl)cc(C(=O)C(C#N)c2nnc3n2CCCCC3)c1	ZINC000177698553	547028907	/nfs/dbraw/zinc/02/89/07/547028907.db2.gz	REAIKYSASZCXJC-AWEZNQCLSA-N	0	3	328.803	3.456	20	30		EGEDHN
COc1ccccc1NC(=O)[C@H](C)N[C@@H]1CCC(=O)NC12CCC2	ZINC000328693316	547482588	/nfs/dbraw/zinc/48/25/88/547482588.db2.gz	JOFXZZZBIMIBMQ-SWLSCSKDSA-N	0	3	331.416	3.303	20	30		EGEDHN
C=CCC[C@@H](O)CN1CCN(Cc2ccc(C(F)(F)F)cc2)CC1	ZINC000675486697	548928690	/nfs/dbraw/zinc/92/86/90/548928690.db2.gz	LPMIJQVDXBZKGX-QGZVFWFLSA-N	0	3	342.405	3.150	20	30		EGEDHN
Cn1c2cc(C(=O)C(C#N)c3ccc4ccccc4n3)ccc2[nH]c1=O	ZINC000676997857	549191082	/nfs/dbraw/zinc/19/10/82/549191082.db2.gz	IMRZQPMIUCMGCR-AWEZNQCLSA-N	0	3	342.358	3.317	20	30		EGEDHN
CCC#C[C@@H](C)N[C@@H](C)c1ccc(S(=O)(=O)N(CC)CC)cc1	ZINC000678728974	549549107	/nfs/dbraw/zinc/54/91/07/549549107.db2.gz	QWFMSDJROANIIB-CVEARBPZSA-N	0	3	336.501	3.170	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN1CCC(Cc2cccc(OC)c2)CC1	ZINC000680078321	549816794	/nfs/dbraw/zinc/81/67/94/549816794.db2.gz	HEVAVNRONYAHPI-UHFFFAOYSA-N	0	3	342.483	3.150	20	30		EGEDHN
C=CCN(CCOC)C(=O)N[C@@H](CN1CCCCC1)c1ccccc1	ZINC000682868822	550156372	/nfs/dbraw/zinc/15/63/72/550156372.db2.gz	OWXKWSRYACIRJX-IBGZPJMESA-N	0	3	345.487	3.058	20	30		EGEDHN
C#Cc1cccc(NC(=S)N(CC(C)C)C2CCN(C)CC2)c1	ZINC000726475662	574559556	/nfs/dbraw/zinc/55/95/56/574559556.db2.gz	KPZSFDJSNBGVJP-UHFFFAOYSA-N	0	3	329.513	3.417	20	30		EGEDHN
C[C@@H](CNC(=O)CCCCOc1cccc(C#N)c1)N1CCCCC1	ZINC000732059948	575235553	/nfs/dbraw/zinc/23/55/53/575235553.db2.gz	WWQDJRXUMVHFBD-KRWDZBQOSA-N	0	3	343.471	3.098	20	30		EGEDHN
C=CC1CCN(C(=O)Nc2ccc(N3CCN(CC)CC3)cc2)CC1	ZINC000732416526	575268093	/nfs/dbraw/zinc/26/80/93/575268093.db2.gz	GWVMHMVPBSVDPZ-UHFFFAOYSA-N	0	3	342.487	3.258	20	30		EGEDHN
C=CCSc1nc2ccccc2n1CN1CCN(C2CCC2)CC1	ZINC000733296566	575325856	/nfs/dbraw/zinc/32/58/56/575325856.db2.gz	OTHGJMWAVHPGDA-UHFFFAOYSA-N	0	3	342.512	3.442	20	30		EGEDHN
C#CCOc1ccc(CNC[C@](O)(c2ccccc2)C(F)(F)F)cc1	ZINC000733326798	575327903	/nfs/dbraw/zinc/32/79/03/575327903.db2.gz	BMPTZKXRZBDLPP-SFHVURJKSA-N	0	3	349.352	3.238	20	30		EGEDHN
C#Cc1cccc(NC(=O)NC[C@@H]2CCCN2Cc2ccccc2)c1	ZINC000734204072	575457396	/nfs/dbraw/zinc/45/73/96/575457396.db2.gz	BWKYINDIQOLTJD-FQEVSTJZSA-N	0	3	333.435	3.454	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)CCc3nc(C(C)C)no3)nc21	ZINC000735791857	575712585	/nfs/dbraw/zinc/71/25/85/575712585.db2.gz	CMYTXNHPBSWJME-LBPRGKRZSA-N	0	3	337.383	3.187	20	30		EGEDHN
Cc1cccc2nc(C(C#N)C(=O)CCc3nc(C(C)C)no3)[nH]c21	ZINC000735791857	575712587	/nfs/dbraw/zinc/71/25/87/575712587.db2.gz	CMYTXNHPBSWJME-LBPRGKRZSA-N	0	3	337.383	3.187	20	30		EGEDHN
C#CCCN1CCC(NC(=O)Cc2ccc(CC(C)C)cc2)CC1	ZINC000740736520	576621815	/nfs/dbraw/zinc/62/18/15/576621815.db2.gz	XRQFPUSWDMHXIO-UHFFFAOYSA-N	0	3	326.484	3.032	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2ccc(CSCC)cc2)CC1	ZINC000740738126	576622108	/nfs/dbraw/zinc/62/21/08/576622108.db2.gz	VJWHHBHTRRPGHC-UHFFFAOYSA-N	0	3	330.497	3.157	20	30		EGEDHN
C#CCOc1cc(F)ccc1NC(=O)N[C@H](C)CN1CCC[C@H](C)C1	ZINC000743199581	576803166	/nfs/dbraw/zinc/80/31/66/576803166.db2.gz	HMMHFQIBJCMVQG-LSDHHAIUSA-N	0	3	347.434	3.080	20	30		EGEDHN
C#CCOc1ccc(F)cc1NC(=O)NC[C@H](C)N1CCCC[C@H]1C	ZINC000743201289	576803277	/nfs/dbraw/zinc/80/32/77/576803277.db2.gz	MPXUYGWMGKMXKK-CABCVRRESA-N	0	3	347.434	3.222	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2cccc(OCC=C(C)C)c2)CC1	ZINC000743493332	576810401	/nfs/dbraw/zinc/81/04/01/576810401.db2.gz	NXBSXQZVURTZPV-UHFFFAOYSA-N	0	3	340.467	3.249	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@@H]1C[C@@]12CCc1ccccc12	ZINC000744022797	576818973	/nfs/dbraw/zinc/81/89/73/576818973.db2.gz	SPDMJICNMTUKJT-PLMTUMEDSA-N	0	3	338.451	3.296	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)[C@H](C)c2ccc(C)o2)c1	ZINC000744027045	576819140	/nfs/dbraw/zinc/81/91/40/576819140.db2.gz	GRNQXOXNYDECDA-DOMZBBRYSA-N	0	3	326.352	3.048	20	30		EGEDHN
C=CCNC(=O)C(C#N)C(=O)[C@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1	ZINC000744031116	576819193	/nfs/dbraw/zinc/81/91/93/576819193.db2.gz	QTEPABNQFLVSGD-HZSPNIEDSA-N	0	3	337.206	3.108	20	30		EGEDHN
C=CC[N@H+](Cc1cccc(-c2nnn[n-]2)c1)C[C@@H]1CCO[C@@H](CC)C1	ZINC000823914725	609171245	/nfs/dbraw/zinc/17/12/45/609171245.db2.gz	MREIXNOJFDXNQH-AEFFLSMTSA-N	0	3	341.459	3.060	20	30		EGEDHN
C=CC[N@@H+](Cc1cccc(-c2nnn[n-]2)c1)C[C@@H]1CCO[C@@H](CC)C1	ZINC000823914725	609171246	/nfs/dbraw/zinc/17/12/46/609171246.db2.gz	MREIXNOJFDXNQH-AEFFLSMTSA-N	0	3	341.459	3.060	20	30		EGEDHN
C=CC[N@H+](Cc1cccc(-c2nn[n-]n2)c1)C[C@@H]1CCO[C@@H](CC)C1	ZINC000823914725	609171248	/nfs/dbraw/zinc/17/12/48/609171248.db2.gz	MREIXNOJFDXNQH-AEFFLSMTSA-N	0	3	341.459	3.060	20	30		EGEDHN
C=CC[N@@H+](Cc1cccc(-c2nn[n-]n2)c1)C[C@@H]1CCO[C@@H](CC)C1	ZINC000823914725	609171250	/nfs/dbraw/zinc/17/12/50/609171250.db2.gz	MREIXNOJFDXNQH-AEFFLSMTSA-N	0	3	341.459	3.060	20	30		EGEDHN
COc1ccc(CCNC(=O)C(C#N)C(=O)CCC2CCCC2)cc1	ZINC000051594475	1291680082	/nfs/dbraw/zinc/68/00/82/1291680082.db2.gz	MFNCXDFYICQGAP-SFHVURJKSA-N	0	3	342.439	3.033	20	30		EGEDHN
Cc1nn(C)c(C)c1C[C@H](C)C(=O)C(C#N)c1nc2ccccc2o1	ZINC000076842606	1292445764	/nfs/dbraw/zinc/44/57/64/1292445764.db2.gz	HZKGFXPTFVZXJK-XHDPSFHLSA-N	0	3	336.395	3.233	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C[C@H]2CCCCN2Cc2ccccc2)cn1	ZINC000830975475	1292793579	/nfs/dbraw/zinc/79/35/79/1292793579.db2.gz	WVEJRBOPLLGMGV-OAQYLSRUSA-N	0	3	347.462	3.190	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)CCCC(=O)C(C)(C)C)c1	ZINC000835062821	1293196628	/nfs/dbraw/zinc/19/66/28/1293196628.db2.gz	FNINUHQASVRGRS-OAHLLOKOSA-N	0	3	328.412	3.428	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)C[C@@H]1OCCc2ccccc21	ZINC000115902598	1293196627	/nfs/dbraw/zinc/19/66/27/1293196627.db2.gz	CURATDNICYEOMM-MJGOQNOKSA-N	0	3	342.439	3.096	20	30		EGEDHN
C[C@@H]1CCN(Cc2cc(=O)n3c4ccccc4[nH]c3c2C#N)C[C@@H]1C	ZINC000122606208	1293419008	/nfs/dbraw/zinc/41/90/08/1293419008.db2.gz	MKTZYSMFKCAOFF-IJEWVQPXSA-N	0	3	334.423	3.202	20	30		EGEDHN
N#CC(C(=O)Nc1ccccn1)C(=O)c1ccc(Cl)c(Cl)c1	ZINC000125153636	1293497804	/nfs/dbraw/zinc/49/78/04/1293497804.db2.gz	RPGPHIHSNPUKSO-JTQLQIEISA-N	0	3	334.162	3.350	20	30		EGEDHN
N#CC(C(=O)CSc1ccc(F)c(F)c1)C(=O)Nc1ccccc1	ZINC000128130327	1293583065	/nfs/dbraw/zinc/58/30/65/1293583065.db2.gz	GMQCQVAHEXTKKF-CYBMUJFWSA-N	0	3	346.358	3.404	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)COC1CCCCC1	ZINC000129032290	1293611430	/nfs/dbraw/zinc/61/14/30/1293611430.db2.gz	GYUFKOLDEZWICG-OAHLLOKOSA-N	0	3	344.411	3.082	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@H]1C[C@@]12CCCc1ccccc12	ZINC000173943322	1294474696	/nfs/dbraw/zinc/47/46/96/1294474696.db2.gz	ZHNUZNRKIBPNLV-HGHGUNKESA-N	0	3	338.451	3.296	20	30		EGEDHN
C[C@H](CC(=O)C(C#N)C(=O)NC1CC1)c1ccccc1C(F)(F)F	ZINC000173975019	1294475540	/nfs/dbraw/zinc/47/55/40/1294475540.db2.gz	TZFIPNALVIWGJP-ZWNOBZJWSA-N	0	3	338.329	3.186	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)c2cncc(OC(C)C)c2)c1	ZINC000179979557	1294847385	/nfs/dbraw/zinc/84/73/85/1294847385.db2.gz	GAGBIVWTQMKJDH-QGZVFWFLSA-N	0	3	337.379	3.138	20	30		EGEDHN
C#CCOc1ccccc1NC(=O)NC[C@H](c1ccccc1)N(C)C	ZINC000188126569	1295437984	/nfs/dbraw/zinc/43/79/84/1295437984.db2.gz	MUXYPJFWRQGKBP-GOSISDBHSA-N	0	3	337.423	3.123	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)COc1ccc(Cl)cc1C	ZINC000193368932	1295858167	/nfs/dbraw/zinc/85/81/67/1295858167.db2.gz	FTCOIGBHMSDHBB-CQSZACIVSA-N	0	3	336.819	3.043	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)COCC2CC2)cc1	ZINC000193451978	1295870619	/nfs/dbraw/zinc/87/06/19/1295870619.db2.gz	KNWYFWIEAJTRRQ-KRWDZBQOSA-N	0	3	328.412	3.103	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(F)c(Cl)c1)C(=O)c1cc(C2CC2)[nH]n1	ZINC000193475858	1295875278	/nfs/dbraw/zinc/87/52/78/1295875278.db2.gz	KGNPQIPGZTYUIQ-JTQLQIEISA-N	0	3	346.749	3.041	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)Cc1ccccc1OC(C)C	ZINC000194582034	1295990462	/nfs/dbraw/zinc/99/04/62/1295990462.db2.gz	ZYIPMSGVCGOREQ-INIZCTEOSA-N	0	3	330.428	3.032	20	30		EGEDHN
CO[C@@H](C)CC(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000195492277	1296072261	/nfs/dbraw/zinc/07/22/61/1296072261.db2.gz	XITXZGZFRGGLME-WCBMZHEXSA-N	0	3	329.183	3.066	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CNCc2ccc(N3CCCC3)nc2)cc1	ZINC000237598947	1296252141	/nfs/dbraw/zinc/25/21/41/1296252141.db2.gz	ITEHGKITRQUQSY-MRXNPFEDSA-N	0	3	336.439	3.262	20	30		EGEDHN
CCN1CCN(c2ccc(N=Cc3cc(OC)ccc3O)cc2)CC1	ZINC000254304767	1296471249	/nfs/dbraw/zinc/47/12/49/1296471249.db2.gz	QHFKXWNKNDRGSC-UHFFFAOYSA-N	0	3	339.439	3.293	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CNC[C@@H](O)c2c(F)cccc2F)cc1	ZINC000304344040	1296922752	/nfs/dbraw/zinc/92/27/52/1296922752.db2.gz	ZESVBIGXZUWNJM-SJKOYZFVSA-N	0	3	332.350	3.079	20	30		EGEDHN
C[C@H]1CCN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(C#N)cc1	ZINC000716261124	1298296214	/nfs/dbraw/zinc/29/62/14/1298296214.db2.gz	DFZAYRMMBFUDAG-OXJNMPFZSA-N	0	3	333.435	3.199	20	30		EGEDHN
N#CCCN(CC(=O)C(C#N)c1nc2ccccc2s1)CC1CC1	ZINC000747961492	1298900077	/nfs/dbraw/zinc/90/00/77/1298900077.db2.gz	OQUMEQKCIYMHEL-AWEZNQCLSA-N	0	3	338.436	3.098	20	30		EGEDHN
Cc1cccc([O-])c1C[NH+]1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000876659432	1298906018	/nfs/dbraw/zinc/90/60/18/1298906018.db2.gz	XBCPHLGZSKQXMK-UHFFFAOYSA-N	0	3	349.434	3.423	20	30		EGEDHN
Cc1noc(C)c1[C@H](C)C(=O)C(C#N)C(=O)Nc1ccccc1Cl	ZINC000750391356	1299387108	/nfs/dbraw/zinc/38/71/08/1299387108.db2.gz	GFVJKBDYTFIOQW-JOYOIKCWSA-N	0	3	345.786	3.396	20	30		EGEDHN
C=CCOc1c(Br)cc(CNC2CSC2)cc1OC	ZINC000877635135	1299444916	/nfs/dbraw/zinc/44/49/16/1299444916.db2.gz	DPXHTKMIFMSDRJ-UHFFFAOYSA-N	0	3	344.274	3.228	20	30		EGEDHN
COC[C@H](C#N)OC(=O)c1cccc(CN(C)Cc2ccccc2)c1	ZINC000751780345	1299623126	/nfs/dbraw/zinc/62/31/26/1299623126.db2.gz	KLEREIJQKXYYRS-IBGZPJMESA-N	0	3	338.407	3.014	20	30		EGEDHN
C=CCC[C@@H](O)CN[C@H](COC)c1cccc(Br)c1	ZINC000879662984	1300660067	/nfs/dbraw/zinc/66/00/67/1300660067.db2.gz	RIGKLHYFWXHJAJ-HUUCEWRRSA-N	0	3	328.250	3.053	20	30		EGEDHN
C#CCCCCNC(=O)[C@@H](C)N1CCC(Cc2ccccc2)CC1	ZINC000758627190	1300925165	/nfs/dbraw/zinc/92/51/65/1300925165.db2.gz	LMVDXGLVUBPQMH-GOSISDBHSA-N	0	3	326.484	3.249	20	30		EGEDHN
N#Cc1c2[nH]c3ccccc3n2c(=O)cc1CN1CCC2(CC2)CC1	ZINC000761063511	1301398743	/nfs/dbraw/zinc/39/87/43/1301398743.db2.gz	WJBVGSXXVXSFSX-OAHLLOKOSA-N	0	3	332.407	3.100	20	30		EGEDHN
CC(C)CN(Cc1nc2ccccc2c(=O)n1CC#N)CC(C)(C)C	ZINC000761973462	1301579975	/nfs/dbraw/zinc/57/99/75/1301579975.db2.gz	MQVCJHBGKJGRQF-UHFFFAOYSA-N	0	3	340.471	3.424	20	30		EGEDHN
N#Cc1cccc(Oc2ccnc(N3CCN(C4CCCC4)CC3)n2)c1	ZINC000881793749	1301724049	/nfs/dbraw/zinc/72/40/49/1301724049.db2.gz	WSMVOBUCNTWASV-UHFFFAOYSA-N	0	3	349.438	3.205	20	30		EGEDHN
C#CCOc1ccccc1CNC[C@@](C)(O)c1ccccc1Cl	ZINC000764984436	1302182258	/nfs/dbraw/zinc/18/22/58/1302182258.db2.gz	VVSQKJWKRZTCPD-LJQANCHMSA-N	0	3	329.827	3.349	20	30		EGEDHN
N#CC(C(=O)C=Cc1ccc2[nH]ccc2c1)c1nnc2n1CCCCC2	ZINC000765914598	1302347256	/nfs/dbraw/zinc/34/72/56/1302347256.db2.gz	DOXOIKRINISBON-IQIBNGDESA-N	0	3	345.406	3.375	20	30		EGEDHN
N#CC(C(=O)C=Cc1ccc2[nH]ccc2c1)c1nnc2n1CCCCC2	ZINC000765914599	1302348256	/nfs/dbraw/zinc/34/82/56/1302348256.db2.gz	DOXOIKRINISBON-QKIRZYONSA-N	0	3	345.406	3.375	20	30		EGEDHN
COc1ccc(C(=O)C(C#N)c2nc3ccccc3n2C)nc1Cl	ZINC000766838306	1302528860	/nfs/dbraw/zinc/52/88/60/1302528860.db2.gz	YZFVDPCHQWTSHW-JTQLQIEISA-N	0	3	340.770	3.120	20	30		EGEDHN
C[C@@H]1CCN(CC(=O)C(C#N)c2nc3ccccc3s2)C[C@@H]1C	ZINC000766984820	1302558022	/nfs/dbraw/zinc/55/80/22/1302558022.db2.gz	MTZYHFVTYOSSKP-HZSPNIEDSA-N	0	3	327.453	3.450	20	30		EGEDHN
Cc1oc2ccccc2c1CC(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000767956188	1302792417	/nfs/dbraw/zinc/79/24/17/1302792417.db2.gz	NIZGVXFHSOPJGJ-HNNXBMFYSA-N	0	3	333.347	3.026	20	30		EGEDHN
C#CCOc1ccc(CN(C)Cc2ccc(C(=O)NC3CC3)cc2)cc1	ZINC000768425953	1302899972	/nfs/dbraw/zinc/89/99/72/1302899972.db2.gz	XGGDSQCULSYULN-UHFFFAOYSA-N	0	3	348.446	3.223	20	30		EGEDHN
COCCN(Cc1ccc(C#N)cc1)Cc1cc(OC)c(C)cc1O	ZINC000768438976	1302900731	/nfs/dbraw/zinc/90/07/31/1302900731.db2.gz	CRZHNVQYOJFFIS-UHFFFAOYSA-N	0	3	340.423	3.230	20	30		EGEDHN
C[C@H](NC(=O)Cc1ccccc1CC#N)[C@@H](c1ccccc1)N(C)C	ZINC000770046608	1303211877	/nfs/dbraw/zinc/21/18/77/1303211877.db2.gz	HPVFXTYSZLKCKI-KKSFZXQISA-N	0	3	335.451	3.103	20	30		EGEDHN
N#Cc1cc(C(F)(F)F)ccc1C(=O)OCCN1CCCCC1	ZINC000770398723	1303261426	/nfs/dbraw/zinc/26/14/26/1303261426.db2.gz	UCQDAXRNODJZHB-UHFFFAOYSA-N	0	3	326.318	3.220	20	30		EGEDHN
C#CC[C@H](N[C@@H](C)c1cccc(NS(C)(=O)=O)c1)c1ccccc1	ZINC000773117748	1303628293	/nfs/dbraw/zinc/62/82/93/1303628293.db2.gz	VZPAMPWXCFALSP-KXBFYZLASA-N	0	3	342.464	3.473	20	30		EGEDHN
COc1ccc(C(C)=NOC2CCOCC2)cc1CN1CCCC1	ZINC000774439713	1303809265	/nfs/dbraw/zinc/80/92/65/1303809265.db2.gz	XLRXANFYYAHKPZ-UHFFFAOYSA-N	0	3	332.444	3.211	20	30		EGEDHN
C#CCSCCN[C@H](C)c1ccc(OC)cc1Br	ZINC000776165413	1304104708	/nfs/dbraw/zinc/10/47/08/1304104708.db2.gz	QMHZQIKUNYJXOD-LLVKDONJSA-N	0	3	328.275	3.475	20	30		EGEDHN
C#CCOc1ccccc1CNc1cccc(N2CCN(CC)CC2)c1	ZINC000776267076	1304124512	/nfs/dbraw/zinc/12/45/12/1304124512.db2.gz	ZGIDXNAVKQOOFT-UHFFFAOYSA-N	0	3	349.478	3.453	20	30		EGEDHN
COc1ccc([C@H](CN2CCCC2)NC(=O)C#Cc2ccccc2)cc1	ZINC000779542871	1304582563	/nfs/dbraw/zinc/58/25/63/1304582563.db2.gz	RQMCZMRCFBCAQF-NRFANRHFSA-N	0	3	348.446	3.000	20	30		EGEDHN
COc1ccc([C@@H](CN2CCCC2)NC(=O)C#Cc2ccccc2)cc1	ZINC000779542874	1304582794	/nfs/dbraw/zinc/58/27/94/1304582794.db2.gz	RQMCZMRCFBCAQF-OAQYLSRUSA-N	0	3	348.446	3.000	20	30		EGEDHN
CC[C@@H]1C[C@@H](C(=O)C(C#N)C(=O)Nc2ccccc2Cl)CCO1	ZINC000780304698	1304675066	/nfs/dbraw/zinc/67/50/66/1304675066.db2.gz	ADXXHLJMUYSZBF-YNEHKIRRSA-N	0	3	334.803	3.193	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N1CC[C@@H](N2CC(=O)Nc3ccccc32)C1	ZINC000782194136	1304928326	/nfs/dbraw/zinc/92/83/26/1304928326.db2.gz	LLWXAPXULUCVGZ-MAUKXSAKSA-N	0	3	346.434	3.152	20	30		EGEDHN
CS[C@@H](C)CCC(=O)C(C#N)C(=O)NCc1cccc(Cl)c1	ZINC000786531290	1305591205	/nfs/dbraw/zinc/59/12/05/1305591205.db2.gz	OEBCLTLJFHHPBV-FZMZJTMJSA-N	0	3	338.860	3.197	20	30		EGEDHN
N#CC(C(=O)CC[C@H]1CCCCO1)C(=O)NCc1cccc(Cl)c1	ZINC000786546812	1305595603	/nfs/dbraw/zinc/59/56/03/1305595603.db2.gz	MBIIENRXGQHLNX-HZPDHXFCSA-N	0	3	348.830	3.014	20	30		EGEDHN
N#Cc1ccc(OCCCOC(=O)[C@H]2CCCN2C2CCCC2)cc1	ZINC000786884161	1305648837	/nfs/dbraw/zinc/64/88/37/1305648837.db2.gz	URRHUZAHEJFHPU-LJQANCHMSA-N	0	3	342.439	3.277	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)CCC(F)(F)F)c1ccccc1	ZINC000787039413	1305681814	/nfs/dbraw/zinc/68/18/14/1305681814.db2.gz	RVIIJARHLYLIER-STQMWFEESA-N	0	3	326.318	3.305	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)CCc1nccs1)c1ccccc1	ZINC000787040476	1305682067	/nfs/dbraw/zinc/68/20/67/1305682067.db2.gz	LRGMUYLXPCANAC-GJZGRUSLSA-N	0	3	341.436	3.052	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)CC[C@H](C)SC)c1ccccc1	ZINC000787042546	1305682906	/nfs/dbraw/zinc/68/29/06/1305682906.db2.gz	WZNOFTGMCKWGJZ-BPUTZDHNSA-N	0	3	332.469	3.494	20	30		EGEDHN
CCCCSCC(=O)C(C#N)C(=O)N[C@@H](CC)c1ccccc1	ZINC000787044572	1305683555	/nfs/dbraw/zinc/68/35/55/1305683555.db2.gz	GHHPVKBRMQVMPF-HOTGVXAUSA-N	0	3	332.469	3.496	20	30		EGEDHN
C=CCOc1ccc(C[NH2+]Cc2ccc(OC)cc2[O-])cc1OC	ZINC000793386031	1309360916	/nfs/dbraw/zinc/36/09/16/1309360916.db2.gz	HAXNSWFQGYLPHN-UHFFFAOYSA-N	0	3	329.396	3.264	20	30		EGEDHN
C#CCSCCNCc1cnn(-c2ccc(C(F)(F)F)cc2)c1	ZINC000796308640	1309962099	/nfs/dbraw/zinc/96/20/99/1309962099.db2.gz	DYZLQCYFPNWWKO-UHFFFAOYSA-N	0	3	339.386	3.347	20	30		EGEDHN
N#Cc1c2[nH]c3ccccc3n2c(=O)cc1CN1CCC2(CCC2)CC1	ZINC000796515425	1310018384	/nfs/dbraw/zinc/01/83/84/1310018384.db2.gz	UZMKIPUXAVTJTG-MRXNPFEDSA-N	0	3	346.434	3.490	20	30		EGEDHN
N#Cc1c2[nH]c3ccccc3n2c(=O)cc1CN1CCC2(CCC2)CC1	ZINC000796515424	1310018553	/nfs/dbraw/zinc/01/85/53/1310018553.db2.gz	UZMKIPUXAVTJTG-INIZCTEOSA-N	0	3	346.434	3.490	20	30		EGEDHN
C[C@H](CNC(=O)OC(C)(C)C)C(=O)C(C#N)c1nc2ccccc2o1	ZINC000796819767	1310093684	/nfs/dbraw/zinc/09/36/84/1310093684.db2.gz	SJRIKRYBSAENLD-NEPJUHHUSA-N	0	3	343.383	3.165	20	30		EGEDHN
CCCC(=O)N1CCC[C@@H]1C(=O)C(C#N)c1ncc(C(C)(C)C)s1	ZINC000797569073	1310212177	/nfs/dbraw/zinc/21/21/77/1310212177.db2.gz	AFFUBSJYFIMARO-QWHCGFSZSA-N	0	3	347.484	3.408	20	30		EGEDHN
C=CCN1CCC(N[C@@H](C)c2nc(Br)ccc2F)CC1	ZINC000798182048	1310312134	/nfs/dbraw/zinc/31/21/34/1310312134.db2.gz	DIIPBTKMJVWUMN-NSHDSACASA-N	0	3	342.256	3.284	20	30		EGEDHN
Cc1ccc(C(=O)N2CCN(CC3CCCCC3)CC2)cc1C#N	ZINC000799322645	1310523785	/nfs/dbraw/zinc/52/37/85/1310523785.db2.gz	PWGXYPKPUXDXKX-UHFFFAOYSA-N	0	3	325.456	3.205	20	30		EGEDHN
N#C[C@@H]1CC[C@@H]([NH2+][C@@H]2CCCN(Cc3cc(Cl)ccc3[O-])C2)C1	ZINC000799718041	1310604731	/nfs/dbraw/zinc/60/47/31/1310604731.db2.gz	ZJHBLONDNNOVLK-KBRIMQKVSA-N	0	3	333.863	3.292	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc3ccccc3n2CC)C1	ZINC001023759807	1319906726	/nfs/dbraw/zinc/90/67/26/1319906726.db2.gz	KHCVGHTWEMNIHN-KRWDZBQOSA-N	0	3	337.467	3.126	20	30		EGEDHN
C=CCCCCN(CC)CC(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000827391089	1320450226	/nfs/dbraw/zinc/45/02/26/1320450226.db2.gz	WTDCZTNYQFGVAY-UHFFFAOYSA-N	0	3	345.487	3.140	20	30		EGEDHN
COc1cc(C#N)ccc1C(=O)NC[C@@H](c1ccccc1)N1CCCC1	ZINC000929474838	1328608525	/nfs/dbraw/zinc/60/85/25/1328608525.db2.gz	YPDKUNAKHLKTJE-IBGZPJMESA-N	0	3	349.434	3.134	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)c1cc(C)cc(C)n1	ZINC000802040651	1316976075	/nfs/dbraw/zinc/97/60/75/1316976075.db2.gz	IYFZSZDCMTWDJV-AWEZNQCLSA-N	0	3	337.379	3.058	20	30		EGEDHN
Cc1cc(C)nc(C(=O)C(C#N)C(=O)Nc2ccc(F)c(Cl)c2)c1	ZINC000802042802	1316976184	/nfs/dbraw/zinc/97/61/84/1316976184.db2.gz	XHCNJNCOQWXMFL-LBPRGKRZSA-N	0	3	345.761	3.452	20	30		EGEDHN
C/C(=C(\F)C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1)C1CC1	ZINC000900248618	1317258788	/nfs/dbraw/zinc/25/87/88/1317258788.db2.gz	MPTVKWPIXBBPTR-NBVRZTHBSA-N	0	3	329.419	3.102	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccnc(Cl)c2Cl)CC1	ZINC000900606991	1317312881	/nfs/dbraw/zinc/31/28/81/1317312881.db2.gz	WYDBKCUUXJWJPY-UHFFFAOYSA-N	0	3	328.243	3.159	20	30		EGEDHN
N#CCSCCCOC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000805461909	1317369882	/nfs/dbraw/zinc/36/98/82/1317369882.db2.gz	RWPHOOXVLPBYRO-UHFFFAOYSA-N	0	3	332.469	3.089	20	30		EGEDHN
N#Cc1ccccc1CN1CCC2(CC1)CCN(C(=O)C1CC1)CC2	ZINC000957487156	1317394583	/nfs/dbraw/zinc/39/45/83/1317394583.db2.gz	YXVBKPXHHWRXJD-UHFFFAOYSA-N	0	3	337.467	3.173	20	30		EGEDHN
C[C@@H](Cc1cncc2ccccc21)C(=O)C(C#N)C(=O)NC1CCCC1	ZINC000805858528	1317431844	/nfs/dbraw/zinc/43/18/44/1317431844.db2.gz	RQRQCUKLBUKSNK-IFXJQAMLSA-N	0	3	349.434	3.181	20	30		EGEDHN
C#CCN(Cc1ccccc1)C(=O)NC[C@H](c1ccc(C)cc1)N(C)C	ZINC000806611449	1317513063	/nfs/dbraw/zinc/51/30/63/1317513063.db2.gz	CVMZPUAZKMJBDY-OAQYLSRUSA-N	0	3	349.478	3.443	20	30		EGEDHN
C[C@H](N[C@H]1C[C@H](NC(=O)c2cc(C#N)c[nH]2)C1)c1ccccc1Cl	ZINC001020056178	1317522164	/nfs/dbraw/zinc/52/21/64/1317522164.db2.gz	FABKKXCMGLDOOY-UBHSHLNASA-N	0	3	342.830	3.151	20	30		EGEDHN
CCC(=O)N1CCC(CN(CC)Cc2ccc(C#N)cc2F)CC1	ZINC000957656440	1317527339	/nfs/dbraw/zinc/52/73/39/1317527339.db2.gz	FAWVSKGYJVMBCF-UHFFFAOYSA-N	0	3	331.435	3.168	20	30		EGEDHN
Cc1ccc(C)c(NN=C2c3ccccc3N(CCN(C)C)C2=O)c1	ZINC000807955536	1317603567	/nfs/dbraw/zinc/60/35/67/1317603567.db2.gz	ZKUKHUAYZHTAFP-UHFFFAOYSA-N	0	3	336.439	3.028	20	30		EGEDHN
C[C@H]1CCCC[C@H]1C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001020526164	1317746307	/nfs/dbraw/zinc/74/63/07/1317746307.db2.gz	SNSQTFSMLQKESA-XDKFSHSGSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@H](NCc3ccc(C#N)cc3F)C2)CC1	ZINC001020550141	1317762008	/nfs/dbraw/zinc/76/20/08/1317762008.db2.gz	JAQOIIODTJYVOA-IYARVYRRSA-N	0	3	341.430	3.181	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc(C(C)C)nc2CC)C1	ZINC001020599264	1317794161	/nfs/dbraw/zinc/79/41/61/1317794161.db2.gz	RSGRRZYWXUJACL-HDJSIYSDSA-N	0	3	335.879	3.370	20	30		EGEDHN
COCOc1ccc(C#N)cc1-c1ccc([C@@H]2OCCN[C@H]2C)cc1	ZINC000904885059	1317906045	/nfs/dbraw/zinc/90/60/45/1317906045.db2.gz	JTGVSMSCILFYRD-VBKZILBWSA-N	0	3	338.407	3.257	20	30		EGEDHN
N#Cc1sccc1C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000905067910	1317917804	/nfs/dbraw/zinc/91/78/04/1317917804.db2.gz	RFAOHCTVIHRJPQ-UHFFFAOYSA-N	0	3	325.437	3.014	20	30		EGEDHN
CC1/C(=C/c2ccc(N(C)C)cc2C(F)(F)F)C(=O)c2ncnn21	ZINC000905087389	1317922232	/nfs/dbraw/zinc/92/22/32/1317922232.db2.gz	XUDDYZRPNKKQLS-TXEUWIOXSA-N	0	3	336.317	3.204	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)N[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)CC1	ZINC001020952835	1318010887	/nfs/dbraw/zinc/01/08/87/1318010887.db2.gz	ZBSSIJOCKCFKNZ-CXHKNCAGSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)c2cc(C)cc(C)c2)C1	ZINC001020977396	1318026599	/nfs/dbraw/zinc/02/65/99/1318026599.db2.gz	HSZKHLZEIXFFMH-SHTZXODSSA-N	0	3	337.261	3.062	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)Cc2ccc3c(c2)CCCC3)C1	ZINC001021033751	1318055271	/nfs/dbraw/zinc/05/52/71/1318055271.db2.gz	AYVRMULCNHFYHL-IYARVYRRSA-N	0	3	332.875	3.097	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]\Cc2ncccc2N(C)C)c([O-])c1	ZINC000811625506	1318215843	/nfs/dbraw/zinc/21/58/43/1318215843.db2.gz	OMXIUSDLNQJZGR-MOSHPQCFSA-N	0	3	326.444	3.319	20	30		EGEDHN
C#C[C@@H](C)N(C)C(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1	ZINC000812010145	1318308840	/nfs/dbraw/zinc/30/88/40/1318308840.db2.gz	GESBDSSGISRFOC-IEBWSBKVSA-N	0	3	327.472	3.123	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@H]2CN(Cc3cccc(C#N)c3)CC[C@H]21	ZINC001021512098	1318334135	/nfs/dbraw/zinc/33/41/35/1318334135.db2.gz	USIHKMYCUJFRGN-VQTJNVASSA-N	0	3	337.467	3.337	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@@H](CCCN3C(=O)c3ccoc3)C2)c1	ZINC001021519175	1318345850	/nfs/dbraw/zinc/34/58/50/1318345850.db2.gz	KTIIDLZUXXIKDA-ICSRJNTNSA-N	0	3	349.434	3.278	20	30		EGEDHN
CC(C)[C@H](F)C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC000960101993	1318357669	/nfs/dbraw/zinc/35/76/69/1318357669.db2.gz	SGZCQVZCVBSXKE-WMZOPIPTSA-N	0	3	349.425	3.162	20	30		EGEDHN
C#C[C@H](C)N(C)C(=O)NC[C@H](c1ccc(Cl)cc1)N(C)CCC	ZINC000812345590	1318372447	/nfs/dbraw/zinc/37/24/47/1318372447.db2.gz	FOSKBKCSKVXQHE-WMLDXEAASA-N	0	3	335.879	3.386	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)C[C@@H]1CCC(F)(F)C1	ZINC000960270130	1318436111	/nfs/dbraw/zinc/43/61/11/1318436111.db2.gz	FKNIOQLIRYTJFS-FDQGKXFDSA-N	0	3	334.410	3.370	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1c2c[nH]nc2ccc1C	ZINC000960276529	1318439740	/nfs/dbraw/zinc/43/97/40/1318439740.db2.gz	XXWYBBADRBCDBS-UYAOXDASSA-N	0	3	346.434	3.043	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cn(C(C)C)cn1	ZINC000960297737	1318449167	/nfs/dbraw/zinc/44/91/67/1318449167.db2.gz	VSQLTQWYTDAMTM-IEBWSBKVSA-N	0	3	338.455	3.026	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc(OC)cc1C	ZINC000960298458	1318449558	/nfs/dbraw/zinc/44/95/58/1318449558.db2.gz	FEIGQXAUKWXPGM-WOJBJXKFSA-N	0	3	336.435	3.175	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1c(F)cc(F)cc1F	ZINC000960302700	1318452138	/nfs/dbraw/zinc/45/21/38/1318452138.db2.gz	LTJBMZBXMVGMJS-SJLPKXTDSA-N	0	3	346.352	3.275	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1c[nH]cc1C1CC1	ZINC000960318450	1318459223	/nfs/dbraw/zinc/45/92/23/1318459223.db2.gz	MZIIKKYNILOJID-WOJBJXKFSA-N	0	3	335.451	3.454	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc2ccccc2[nH]1	ZINC000960334546	1318467776	/nfs/dbraw/zinc/46/77/76/1318467776.db2.gz	HWZCKDBVMMELIK-UYAOXDASSA-N	0	3	331.419	3.339	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(Cl)ccc2F)C1	ZINC001021627301	1318479140	/nfs/dbraw/zinc/47/91/40/1318479140.db2.gz	NHBYKGYIGPAALY-RDTXWAMCSA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2c[nH]c3ccccc23)C1	ZINC001021628768	1318482407	/nfs/dbraw/zinc/48/24/07/1318482407.db2.gz	XRUMTYHGEHDQHZ-UZLBHIALSA-N	0	3	335.451	3.118	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)Cc2cccc(C)c2Cl)C1	ZINC001021633282	1318486904	/nfs/dbraw/zinc/48/69/04/1318486904.db2.gz	PVNGMTFDNUBAEL-QZTJIDSGSA-N	0	3	344.886	3.137	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@H]1CN(C)Cc1ccc(OCC#N)cc1	ZINC000960382155	1318508501	/nfs/dbraw/zinc/50/85/01/1318508501.db2.gz	HKGBCKOOBRFIGO-SFHVURJKSA-N	0	3	343.471	3.058	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc3ncccc3c2)C1	ZINC001021666364	1318526951	/nfs/dbraw/zinc/52/69/51/1318526951.db2.gz	SOHNPQQXGFAAOL-PZJWPPBQSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc3occc3s2)C1	ZINC001021667008	1318529808	/nfs/dbraw/zinc/52/98/08/1318529808.db2.gz	FECUGYOORVYEIG-UONOGXRCSA-N	0	3	328.437	3.054	20	30		EGEDHN
Cc1cc(Cl)ccc1CN(C)C[C@H]1CCCN1C(=O)[C@H](C)C#N	ZINC000960502890	1318610275	/nfs/dbraw/zinc/61/02/75/1318610275.db2.gz	ONMQRTWIVMQPCG-RHSMWYFYSA-N	0	3	333.863	3.231	20	30		EGEDHN
CCCOc1cccc(CN(C)C[C@H]2CCCN2C(=O)[C@@H](C)C#N)c1	ZINC000960502416	1318611797	/nfs/dbraw/zinc/61/17/97/1318611797.db2.gz	NGPNWAIVNRVFSU-FUHWJXTLSA-N	0	3	343.471	3.058	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC[C@@H]1CN(C)Cc1cccc(C(F)F)c1	ZINC000960506389	1318615498	/nfs/dbraw/zinc/61/54/98/1318615498.db2.gz	ZDIKVNSBUICWBS-XJKSGUPXSA-N	0	3	335.398	3.207	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc3ccccc3[nH]2)C1	ZINC001021729439	1318629628	/nfs/dbraw/zinc/62/96/28/1318629628.db2.gz	FCEDWYIQPWNGAR-YLJYHZDGSA-N	0	3	335.451	3.118	20	30		EGEDHN
C[C@H](N[C@H]1C[C@@H](NC(=O)c2ccc(C#N)[nH]2)C1)c1ccccc1Cl	ZINC001021976626	1318757811	/nfs/dbraw/zinc/75/78/11/1318757811.db2.gz	IQOIGLXJJTZWSG-FPMFFAJLSA-N	0	3	342.830	3.151	20	30		EGEDHN
C[C@H](N[C@H]1C[C@@H](NC(=O)c2c[nH]c(C#N)c2)C1)c1ccccc1Cl	ZINC001021989982	1318762864	/nfs/dbraw/zinc/76/28/64/1318762864.db2.gz	HCOZFIMEVBZBRB-FPMFFAJLSA-N	0	3	342.830	3.151	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1C[C@@H](N[C@@H](C)c2ccccc2F)C1	ZINC001022206125	1318842916	/nfs/dbraw/zinc/84/29/16/1318842916.db2.gz	NWHMNDBIHQMDJZ-HRCADAONSA-N	0	3	341.430	3.425	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)NCc1ccc(NC(C)=O)cc1	ZINC000912197470	1318846424	/nfs/dbraw/zinc/84/64/24/1318846424.db2.gz	RSAIFNIIELGJAQ-SFHVURJKSA-N	0	3	333.476	3.339	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)N[C@@H]1CCCc2[nH]c(=O)ccc21	ZINC000912196186	1318846546	/nfs/dbraw/zinc/84/65/46/1318846546.db2.gz	SOMJRSOGTFWDED-NVXWUHKLSA-N	0	3	333.476	3.359	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N(C)Cc1ccccc1OC(F)(F)F	ZINC000912220960	1318850785	/nfs/dbraw/zinc/85/07/85/1318850785.db2.gz	JHQRXTRHKVIVNR-CYBMUJFWSA-N	0	3	330.350	3.227	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)[C@]12C[C@H]1CCC2	ZINC000960752836	1318854016	/nfs/dbraw/zinc/85/40/16/1318854016.db2.gz	RBKIMDMXCBLDPA-SFHLNBCPSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cccc3ccc(C)nc32)C1	ZINC001022257453	1318858143	/nfs/dbraw/zinc/85/81/43/1318858143.db2.gz	WNLXTGXBTIDAMT-GASCZTMLSA-N	0	3	329.831	3.146	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)Nc1cccc(C(=O)NC)c1C	ZINC000912314726	1318866013	/nfs/dbraw/zinc/86/60/13/1318866013.db2.gz	VCMISEIRKGLLNI-INIZCTEOSA-N	0	3	333.476	3.371	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]1CN(C)Cc1ccc(COC)cc1	ZINC000960786194	1318886737	/nfs/dbraw/zinc/88/67/37/1318886737.db2.gz	CCEFTMFQIQZELZ-LJQANCHMSA-N	0	3	344.499	3.468	20	30		EGEDHN
CC(C)(C(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1)C1CCC1	ZINC001022500966	1318967196	/nfs/dbraw/zinc/96/71/96/1318967196.db2.gz	JLCSQKVSWBWKDB-CALCHBBNSA-N	0	3	343.446	3.260	20	30		EGEDHN
CO[C@@H]1CCC[C@@H](C(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)C1	ZINC000815906527	1319070754	/nfs/dbraw/zinc/07/07/54/1319070754.db2.gz	BUXDYJHKGQXCRD-KCPJHIHWSA-N	0	3	334.803	3.193	20	30		EGEDHN
CO[C@@H]1CCC[C@@H](C(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)C1	ZINC000815906525	1319071847	/nfs/dbraw/zinc/07/18/47/1319071847.db2.gz	BUXDYJHKGQXCRD-DFBGVHRSSA-N	0	3	334.803	3.193	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc(N(CC)CC)cc2)C1	ZINC001023017514	1319223127	/nfs/dbraw/zinc/22/31/27/1319223127.db2.gz	OKHFJHDCYMBVLK-IYBDPMFKSA-N	0	3	335.879	3.136	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2sc(Cl)nc2Cl)C1	ZINC001023096526	1319258814	/nfs/dbraw/zinc/25/88/14/1319258814.db2.gz	OTCOZIRFEUMBDI-KNVOCYPGSA-N	0	3	340.663	3.053	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)C2C[C@@H](C)C[C@H](C)C2)C1	ZINC001023137521	1319280204	/nfs/dbraw/zinc/28/02/04/1319280204.db2.gz	KYEFGSRAWAURSF-LWWSYDQCSA-N	0	3	343.309	3.204	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)Cc2c(C)oc3ccccc32)C1	ZINC001023183320	1319310128	/nfs/dbraw/zinc/31/01/28/1319310128.db2.gz	BOCJQMQRFGUKHZ-OKILXGFUSA-N	0	3	332.831	3.273	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]([C@H]2CCN(Cc3ocnc3C)C2)C1	ZINC000961223225	1319350062	/nfs/dbraw/zinc/35/00/62/1319350062.db2.gz	AHPLVMKQAJRGAC-IRXDYDNUSA-N	0	3	345.487	3.256	20	30		EGEDHN
C=CC[N@H+]1CCC[C@@H](C2CCN(C(=O)c3ccccc3[O-])CC2)C1	ZINC000961331594	1319486581	/nfs/dbraw/zinc/48/65/81/1319486581.db2.gz	OOYJQKDSXPEZHP-QGZVFWFLSA-N	0	3	328.456	3.142	20	30		EGEDHN
C=CC[N@@H+]1CCC[C@@H](C2CCN(C(=O)c3ccccc3[O-])CC2)C1	ZINC000961331594	1319486588	/nfs/dbraw/zinc/48/65/88/1319486588.db2.gz	OOYJQKDSXPEZHP-QGZVFWFLSA-N	0	3	328.456	3.142	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc3nccc(C)c3c2)C1	ZINC001023390656	1319497400	/nfs/dbraw/zinc/49/74/00/1319497400.db2.gz	KFVPVLGRVSPYJT-KRWDZBQOSA-N	0	3	335.451	3.008	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)C2CCc3ccccc3CC2)C1	ZINC001023455800	1319558844	/nfs/dbraw/zinc/55/88/44/1319558844.db2.gz	RKYXWYBOOCDHBJ-GOSISDBHSA-N	0	3	338.495	3.033	20	30		EGEDHN
C#CCN(C)CCCNC(=O)[C@H](CC)Oc1ccccc1C(C)C	ZINC000818595911	1319565496	/nfs/dbraw/zinc/56/54/96/1319565496.db2.gz	SBMPIQQSCFMDDD-SFHVURJKSA-N	0	3	330.472	3.039	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc(OC)c(C(C)C)c2)C1	ZINC001023469615	1319567533	/nfs/dbraw/zinc/56/75/33/1319567533.db2.gz	JTBYHKQFCZAUKD-KRWDZBQOSA-N	0	3	342.483	3.284	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CNCc2ccnc(OC3CCCC3)c2)cc1	ZINC000818953637	1319587442	/nfs/dbraw/zinc/58/74/42/1319587442.db2.gz	LFRSPKFXHMEMLJ-IBGZPJMESA-N	0	3	337.423	3.098	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cnc3ccccc3c2C)C1	ZINC001023494391	1319601653	/nfs/dbraw/zinc/60/16/53/1319601653.db2.gz	HULYDSMLTYRQFY-QGZVFWFLSA-N	0	3	335.451	3.008	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCCN(Cc3ncccc3C)C2)cc1	ZINC001023527600	1319633245	/nfs/dbraw/zinc/63/32/45/1319633245.db2.gz	YLZSAPWNLVWXHK-LJQANCHMSA-N	0	3	347.462	3.013	20	30		EGEDHN
S=C(NN=C1CCCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000916307255	1319636268	/nfs/dbraw/zinc/63/62/68/1319636268.db2.gz	ZRYUYAKDSGGWNE-UHFFFAOYSA-N	0	3	330.501	3.045	20	30		EGEDHN
C[C@@H]1C[C@H](C)CN(CC(=O)C(C#N)c2nc3ccccc3s2)C1	ZINC000916622789	1319686292	/nfs/dbraw/zinc/68/62/92/1319686292.db2.gz	LOCDRXJCGRMXGH-HZSPNIEDSA-N	0	3	327.453	3.450	20	30		EGEDHN
C#CCOc1ccccc1CNc1ccc(CN2CCN(C)CC2)cc1	ZINC000916841957	1319712154	/nfs/dbraw/zinc/71/21/54/1319712154.db2.gz	JJKLQNDZDJWKFT-UHFFFAOYSA-N	0	3	349.478	3.058	20	30		EGEDHN
Cc1ccc(Cl)c(OCC(=O)C(C#N)C(=O)Nc2ccccc2)c1	ZINC000916898657	1319720967	/nfs/dbraw/zinc/72/09/67/1319720967.db2.gz	GASRVYONPAEJNY-CQSZACIVSA-N	0	3	342.782	3.375	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)CSC(C)C)cc1Cl	ZINC000916941645	1319725747	/nfs/dbraw/zinc/72/57/47/1319725747.db2.gz	ZYVDJCUSNOOJQY-LLVKDONJSA-N	0	3	340.832	3.138	20	30		EGEDHN
N#Cc1ccccc1CNCC1CC(NC(=O)C2=CCCCCC2)C1	ZINC000961763629	1319728353	/nfs/dbraw/zinc/72/83/53/1319728353.db2.gz	FVWHLDZFEQTSLP-UHFFFAOYSA-N	0	3	337.467	3.433	20	30		EGEDHN
C#CCN(C[C@H](O)COc1ccc(F)cc1)[C@H]1CCc2ccccc21	ZINC000917116997	1319759277	/nfs/dbraw/zinc/75/92/77/1319759277.db2.gz	CQKJPGCPXYSVPJ-RXVVDRJESA-N	0	3	339.410	3.188	20	30		EGEDHN
C[C@@H](C(=O)NC1CC(CNCc2cc(C#N)ccc2F)C1)C1CCC1	ZINC000961982504	1319790419	/nfs/dbraw/zinc/79/04/19/1319790419.db2.gz	PREJDGIHVIYYJX-MJJDPTRDSA-N	0	3	343.446	3.118	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1Cl)C(=O)c1cccc2c1OCO2	ZINC000917426735	1319806329	/nfs/dbraw/zinc/80/63/29/1319806329.db2.gz	OJHGQGCPLLIFHM-LLVKDONJSA-N	0	3	342.738	3.030	20	30		EGEDHN
C#CCN1CCC[C@@H](CNC(=O)c2ccc(Cl)c3occc32)C1	ZINC001023698372	1319827047	/nfs/dbraw/zinc/82/70/47/1319827047.db2.gz	YNZGHVAUXSLJMV-ZDUSSCGKSA-N	0	3	330.815	3.161	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC001023716753	1319850601	/nfs/dbraw/zinc/85/06/01/1319850601.db2.gz	RFCHBYCDGSUENJ-KRWDZBQOSA-N	0	3	326.484	3.449	20	30		EGEDHN
CC1(C)CC(CC(=O)NC2CC(CNCc3ccccc3C#N)C2)C1	ZINC000962216366	1319863245	/nfs/dbraw/zinc/86/32/45/1319863245.db2.gz	HEFNTXBMWWXTJF-UHFFFAOYSA-N	0	3	339.483	3.369	20	30		EGEDHN
C#CCN1CCC[C@@H](CNC(=O)c2cc3c(cccc3F)s2)C1	ZINC001023738874	1319885118	/nfs/dbraw/zinc/88/51/18/1319885118.db2.gz	JWPUNEKROCCXKO-ZDUSSCGKSA-N	0	3	330.428	3.115	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc3c(s2)CC[C@H](C)C3)C1	ZINC001023742658	1319889228	/nfs/dbraw/zinc/88/92/28/1319889228.db2.gz	JWXIOZDAWKEWGO-JKSUJKDBSA-N	0	3	344.524	3.338	20	30		EGEDHN
CC1(C)CC[C@@H](C(=O)NC2CC(CNCc3ccccc3C#N)C2)C1	ZINC000962279829	1319898021	/nfs/dbraw/zinc/89/80/21/1319898021.db2.gz	UHWOHKOLIZJCKN-KOHRHEQBSA-N	0	3	339.483	3.369	20	30		EGEDHN
CCC(CC)C(=O)N1CCC[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001023852911	1319990050	/nfs/dbraw/zinc/99/00/50/1319990050.db2.gz	KFDOFHBCBSBSCR-OAHLLOKOSA-N	0	3	345.462	3.462	20	30		EGEDHN
Cc1ccc(C#N)cc1C(=O)N1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1	ZINC000823245154	1320164979	/nfs/dbraw/zinc/16/49/79/1320164979.db2.gz	LEVXHGQEPCNAJC-PZJWPPBQSA-N	0	3	345.446	3.213	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N2CCN(C3CCCCC3)CC2)cc1	ZINC000827022828	1320421408	/nfs/dbraw/zinc/42/14/08/1320421408.db2.gz	JZJGKIVGYORBMG-UHFFFAOYSA-N	0	3	340.467	3.179	20	30		EGEDHN
CN1CCC(Oc2ccc(Cl)cc2NC(=O)C#CC2CC2)CC1	ZINC000837690340	1320667396	/nfs/dbraw/zinc/66/73/96/1320667396.db2.gz	XNADVCQSYQIQJF-UHFFFAOYSA-N	0	3	332.831	3.165	20	30		EGEDHN
N#C[C@@H]1CCC[C@H](OC(=O)C2CCN(c3ccc(Cl)cc3)C2=O)C1	ZINC000839049302	1320858199	/nfs/dbraw/zinc/85/81/99/1320858199.db2.gz	QKRCJORQZZOZRR-KCXAZCMYSA-N	0	3	346.814	3.318	20	30		EGEDHN
COC1([C@@H](C)NCC(=O)N(CCC#N)c2ccc(C)c(C)c2)CCC1	ZINC000839656778	1320954545	/nfs/dbraw/zinc/95/45/45/1320954545.db2.gz	XLOPUTZKEUZHIX-QGZVFWFLSA-N	0	3	343.471	3.097	20	30		EGEDHN
CCCCCCCOc1cccc(CN2CC[C@@H](O)[C@@H](CO)C2)c1	ZINC000840975305	1321192561	/nfs/dbraw/zinc/19/25/61/1321192561.db2.gz	MZQQZRWAQWYPIM-UYAOXDASSA-N	0	3	335.488	3.211	20	30		EGEDHN
CC(C)(C)OC1CC(ON=Cc2ccc(N3CCOCC3)cc2)C1	ZINC000842017601	1321335529	/nfs/dbraw/zinc/33/55/29/1321335529.db2.gz	PNWOBGMEIFJWDY-UHFFFAOYSA-N	0	3	332.444	3.220	20	30		EGEDHN
C[C@@]1(NC(=O)Cc2ccccc2CC#N)CCN(Cc2ccccc2)C1	ZINC000844964212	1321663176	/nfs/dbraw/zinc/66/31/76/1321663176.db2.gz	NIQNFKDFQBMDSY-JOCHJYFZSA-N	0	3	347.462	3.076	20	30		EGEDHN
C=C(C)[C@H](CC(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-])OCC	ZINC000845872937	1321747499	/nfs/dbraw/zinc/74/74/99/1321747499.db2.gz	AWXJSMHBOACPDJ-PVUWLOKVSA-N	0	3	339.363	3.447	20	30		EGEDHN
C#CCOc1ccc(NC(=O)N2CCN(C(C)(C)CC)CC2)cc1	ZINC000847148425	1321845587	/nfs/dbraw/zinc/84/55/87/1321845587.db2.gz	NMNSLQIKIJFNQO-UHFFFAOYSA-N	0	3	329.444	3.037	20	30		EGEDHN
CSC1(C(=O)OCC2(C#N)CCN(Cc3ccccc3)CC2)CC1	ZINC000847747533	1321900488	/nfs/dbraw/zinc/90/04/88/1321900488.db2.gz	LMSALQGLIOPBDC-UHFFFAOYSA-N	0	3	344.480	3.231	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccccc2OCC#N)C1	ZINC000919821295	1322109702	/nfs/dbraw/zinc/10/97/02/1322109702.db2.gz	AFLABAQHJACVKV-WMZOPIPTSA-N	0	3	349.434	3.154	20	30		EGEDHN
N#CCSCC(=O)C(C#N)c1nc(-c2ccc(C#N)cc2)cs1	ZINC000920141193	1322144091	/nfs/dbraw/zinc/14/40/91/1322144091.db2.gz	NAASBTUIIQNKRN-ZDUSSCGKSA-N	0	3	338.417	3.115	20	30		EGEDHN
N#CCOc1ccc(CNCc2ccc(O[C@H]3CCOC3)cc2)cc1	ZINC000850120760	1322194790	/nfs/dbraw/zinc/19/47/90/1322194790.db2.gz	BNWWCPIBPYFREH-FQEVSTJZSA-N	0	3	338.407	3.046	20	30		EGEDHN
COC[C@H](C)Oc1ccc(CNCc2ccc(OCC#N)cc2)cc1	ZINC000850121256	1322194945	/nfs/dbraw/zinc/19/49/45/1322194945.db2.gz	PRECPLKMBCPFRU-INIZCTEOSA-N	0	3	340.423	3.292	20	30		EGEDHN
C[C@H](Cc1ccc(F)cc1)C(=O)C(C#N)C(=O)NC1CCCCC1	ZINC000921131054	1322260609	/nfs/dbraw/zinc/26/06/09/1322260609.db2.gz	GMNNZOSTYUTMPA-CXAGYDPISA-N	0	3	330.403	3.162	20	30		EGEDHN
CC(=O)N[C@@H](CCC(C)C)C(=O)C(C#N)c1nc(C(C)C)cs1	ZINC000850872817	1322304730	/nfs/dbraw/zinc/30/47/30/1322304730.db2.gz	GNFQOHNIIXXZQF-KBPBESRZSA-N	0	3	335.473	3.384	20	30		EGEDHN
CC(C)(C)OC(=O)C1(C(=O)C(C#N)c2ccncn2)CCCCCC1	ZINC000850948590	1322314383	/nfs/dbraw/zinc/31/43/83/1322314383.db2.gz	ULPPRQBDSGODDJ-CQSZACIVSA-N	0	3	343.427	3.335	20	30		EGEDHN
N#Cc1ccc(Br)c(CN[C@@H]2CCCc3cn[nH]c32)c1	ZINC000921858772	1322414195	/nfs/dbraw/zinc/41/41/95/1322414195.db2.gz	AYBBICRYQWTOFN-CQSZACIVSA-N	0	3	331.217	3.211	20	30		EGEDHN
CC#CCCN1CC[C@H](C(F)(F)F)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000859605357	1329032999	/nfs/dbraw/zinc/03/29/99/1329032999.db2.gz	CFCYJRQWJAJLMZ-KGLIPLIRSA-N	0	3	348.409	3.425	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](CNCc2csc(CC)n2)C1	ZINC001024092928	1323123827	/nfs/dbraw/zinc/12/38/27/1323123827.db2.gz	LJYSRTOSWSTHOO-CQSZACIVSA-N	0	3	335.517	3.246	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H](CNCc2ccccc2C#N)C1	ZINC001024136418	1323161664	/nfs/dbraw/zinc/16/16/64/1323161664.db2.gz	ZXNZDLNKBKPTCZ-DYESRHJHSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H](CNCc2cc(C3CC3)no2)C1	ZINC001024137551	1323163052	/nfs/dbraw/zinc/16/30/52/1323163052.db2.gz	NOUNKIQQHRDWIT-QRWLVFNGSA-N	0	3	345.487	3.483	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H](CNCc3ccccc3C#N)C2)C1	ZINC001024146515	1323172912	/nfs/dbraw/zinc/17/29/12/1323172912.db2.gz	XAGZEIXCWHQAOI-KRWDZBQOSA-N	0	3	337.467	3.243	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCC[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001024186096	1323197332	/nfs/dbraw/zinc/19/73/32/1323197332.db2.gz	LAFRBTBXEJQIIG-HOTGVXAUSA-N	0	3	345.462	3.318	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CCC[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001024186095	1323197792	/nfs/dbraw/zinc/19/77/92/1323197792.db2.gz	LAFRBTBXEJQIIG-CVEARBPZSA-N	0	3	345.462	3.318	20	30		EGEDHN
CN(C(=O)[C@H]1CC1(C)C)C1CCC(NCc2ccccc2C#N)CC1	ZINC000963246811	1323257206	/nfs/dbraw/zinc/25/72/06/1323257206.db2.gz	RUURXXGEAYLYPI-CTWPCTMYSA-N	0	3	339.483	3.464	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cccc(NC(=O)CC)c1	ZINC001024466655	1323421604	/nfs/dbraw/zinc/42/16/04/1323421604.db2.gz	JPCDICASVTWIHS-GOSISDBHSA-N	0	3	343.471	3.196	20	30		EGEDHN
C=CCCN1CCCC[C@@H]1CNC(=O)c1cc2ccncc2s1	ZINC001024479964	1323433128	/nfs/dbraw/zinc/43/31/28/1323433128.db2.gz	VGONDTSQGGGWHG-OAHLLOKOSA-N	0	3	329.469	3.457	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccc(OC)c(OC)c1C	ZINC001024502396	1323450690	/nfs/dbraw/zinc/45/06/90/1323450690.db2.gz	MWOBLVISORDVSX-MRXNPFEDSA-N	0	3	346.471	3.173	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1cccc2c(C)c(C)[nH]c21	ZINC001024513049	1323463128	/nfs/dbraw/zinc/46/31/28/1323463128.db2.gz	MKGXQLGTXVHGGJ-QGZVFWFLSA-N	0	3	337.467	3.392	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CCCCN2C[C@H]2CCCCO2)CC1	ZINC001024632783	1323558891	/nfs/dbraw/zinc/55/88/91/1323558891.db2.gz	BDXGZOQLIPQQGO-RTBURBONSA-N	0	3	334.504	3.273	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@H]2CCCCN2Cc2ccccc2C)c1	ZINC001024643656	1323569313	/nfs/dbraw/zinc/56/93/13/1323569313.db2.gz	FWVJUCVGCOWHHY-OAQYLSRUSA-N	0	3	347.462	3.156	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccc2nc(C)ccc2c1	ZINC001024724612	1323625386	/nfs/dbraw/zinc/62/53/86/1323625386.db2.gz	YANWQKJVZGNMOC-IBGZPJMESA-N	0	3	335.451	3.151	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccc(C(F)F)cc1F	ZINC001024726641	1323627604	/nfs/dbraw/zinc/62/76/04/1323627604.db2.gz	WZXAXUBFLHMJPN-AWEZNQCLSA-N	0	3	338.373	3.371	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)c2ccccc2)s1	ZINC001024852361	1323746459	/nfs/dbraw/zinc/74/64/59/1323746459.db2.gz	VOYAHFSHINRXLU-MRXNPFEDSA-N	0	3	339.464	3.404	20	30		EGEDHN
Cc1occc1C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)s1	ZINC001024861910	1323753545	/nfs/dbraw/zinc/75/35/45/1323753545.db2.gz	NLMFFCWZYNDXJJ-CQSZACIVSA-N	0	3	343.452	3.306	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCCC[C@@H]1CNCc1sccc1Cl	ZINC001024902177	1323772652	/nfs/dbraw/zinc/77/26/52/1323772652.db2.gz	KCZRRODHMJWOMD-NWDGAFQWSA-N	0	3	325.865	3.032	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)CC2CCC2)cc1F	ZINC001024913321	1323777599	/nfs/dbraw/zinc/77/75/99/1323777599.db2.gz	ADRKJHCUVWYWNA-GOSISDBHSA-N	0	3	343.446	3.358	20	30		EGEDHN
C[C@H](C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)c(F)c1)C1CC1	ZINC001024913370	1323777745	/nfs/dbraw/zinc/77/77/45/1323777745.db2.gz	CDBUSUNYSSQRIG-KBXCAEBGSA-N	0	3	343.446	3.214	20	30		EGEDHN
O=C(C#CC1CC1)N1CCCC[C@@H]1CNCc1ccccc1Cl	ZINC001024959597	1323802320	/nfs/dbraw/zinc/80/23/20/1323802320.db2.gz	FHISUFXIDNJDJS-QGZVFWFLSA-N	0	3	330.859	3.224	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCCC[C@@H]1CNCc1ccnc(OC)c1	ZINC001025069758	1323870426	/nfs/dbraw/zinc/87/04/26/1323870426.db2.gz	ODCTZNRNPOLTLD-YLJYHZDGSA-N	0	3	345.487	3.163	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)C2CC3(CC3)C2)s1	ZINC001025078586	1323881936	/nfs/dbraw/zinc/88/19/36/1323881936.db2.gz	CZYLJCLTORZHRG-OAHLLOKOSA-N	0	3	343.496	3.281	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)C2(CF)CCC2)s1	ZINC001025090036	1323887663	/nfs/dbraw/zinc/88/76/63/1323887663.db2.gz	AZBVUHCOWFRAQE-CQSZACIVSA-N	0	3	349.475	3.230	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)C12CCC(CC1)C2	ZINC001025243998	1324040614	/nfs/dbraw/zinc/04/06/14/1324040614.db2.gz	GGWJFZLSKWYBON-XTBIFASLSA-N	0	3	328.500	3.436	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1c(C)oc(C)c1C	ZINC001025250409	1324051474	/nfs/dbraw/zinc/05/14/74/1324051474.db2.gz	JXZLILJTBYRWDE-QZTJIDSGSA-N	0	3	328.456	3.297	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1nc2c(s1)CCC2	ZINC001025251606	1324054928	/nfs/dbraw/zinc/05/49/28/1324054928.db2.gz	JYQCTYXVZJFIFK-CVEARBPZSA-N	0	3	345.512	3.277	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(C)c(C)cn1	ZINC001025252477	1324056757	/nfs/dbraw/zinc/05/67/57/1324056757.db2.gz	OUYQDNNKWDXIRN-WOJBJXKFSA-N	0	3	339.483	3.181	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)Cc1cc(C)cc(C)c1	ZINC001025261676	1324072104	/nfs/dbraw/zinc/07/21/04/1324072104.db2.gz	AYTAVEYSGJMZMB-SFTDATJTSA-N	0	3	338.495	3.325	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccncc1Cl	ZINC001025270971	1324086272	/nfs/dbraw/zinc/08/62/72/1324086272.db2.gz	FOMNDGPJUANPCK-IRXDYDNUSA-N	0	3	333.863	3.380	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc(C)cc1F	ZINC001025274303	1324091627	/nfs/dbraw/zinc/09/16/27/1324091627.db2.gz	WLJRETMWNNMXCI-RBUKOAKNSA-N	0	3	328.431	3.226	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(C2CC2)no1	ZINC001025275168	1324094771	/nfs/dbraw/zinc/09/47/71/1324094771.db2.gz	TWYFRXNPDYTDRS-IRXDYDNUSA-N	0	3	329.444	3.197	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)C1(C)CC(F)(F)C1	ZINC001025287825	1324110172	/nfs/dbraw/zinc/11/01/72/1324110172.db2.gz	GYNCNNPXBXVEBS-CVEARBPZSA-N	0	3	338.442	3.291	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1coc(CC2CC2)n1	ZINC001025288154	1324111243	/nfs/dbraw/zinc/11/12/43/1324111243.db2.gz	SKKQFFGHCOEMDX-ROUUACIJSA-N	0	3	343.471	3.272	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)Cc1ccc(Cl)cc1	ZINC001025297012	1324128805	/nfs/dbraw/zinc/12/88/05/1324128805.db2.gz	NCWOUQLOVPEWOK-RTBURBONSA-N	0	3	344.886	3.361	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)[C@H]1[C@H]2[C@@H]1[C@@H]1CC[C@H]2C1	ZINC001025304996	1324138406	/nfs/dbraw/zinc/13/84/06/1324138406.db2.gz	SNYKGKPEUKQACX-HXOHHMPKSA-N	0	3	340.511	3.147	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2oc3ccc(F)cc3c2C)C1	ZINC001025441392	1324281238	/nfs/dbraw/zinc/28/12/38/1324281238.db2.gz	CUTUUELAQRFRRZ-LSDHHAIUSA-N	0	3	342.414	3.344	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)[C@H]2CC[C@H](C3CCC3)CC2)C1	ZINC001025446199	1324287797	/nfs/dbraw/zinc/28/77/97/1324287797.db2.gz	YOZKXIXGHQCHAM-AFYVEPGGSA-N	0	3	330.516	3.443	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(CCCC)cc2)C1	ZINC001025477911	1324323278	/nfs/dbraw/zinc/32/32/78/1324323278.db2.gz	IPMPEHCOVNLGPQ-YLJYHZDGSA-N	0	3	326.484	3.493	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(-c3ccco3)o2)C1	ZINC001025482124	1324330485	/nfs/dbraw/zinc/33/04/85/1324330485.db2.gz	MELNZBLKZIQYAI-CABCVRRESA-N	0	3	326.396	3.003	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2nsc3ccc(C)cc32)C1	ZINC001025504229	1324353554	/nfs/dbraw/zinc/35/35/54/1324353554.db2.gz	ZARMSPMYCFIOGK-LSDHHAIUSA-N	0	3	341.480	3.068	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)C2CCC(F)(F)CC2)C1	ZINC001025537668	1324383655	/nfs/dbraw/zinc/38/36/55/1324383655.db2.gz	BAFKCCDHWNETHR-GOEBONIOSA-N	0	3	326.431	3.052	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccccc2C(F)(F)F)C1	ZINC001025601531	1324448295	/nfs/dbraw/zinc/44/82/95/1324448295.db2.gz	BYFJPNOUQADWSO-KBPBESRZSA-N	0	3	338.373	3.169	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2c(F)cccc2Cl)C1	ZINC001025603192	1324451280	/nfs/dbraw/zinc/45/12/80/1324451280.db2.gz	RLNPFXVUZHPBDX-KGLIPLIRSA-N	0	3	336.838	3.333	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(F)c(F)cc2Cl)C1	ZINC001025609736	1324459660	/nfs/dbraw/zinc/45/96/60/1324459660.db2.gz	HOYASLIJIIEAFU-NWDGAFQWSA-N	0	3	340.801	3.082	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2coc3ccc(F)cc23)C1	ZINC001025609336	1324460300	/nfs/dbraw/zinc/46/03/00/1324460300.db2.gz	NYGSANQWJCVLEJ-KBPBESRZSA-N	0	3	328.387	3.035	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc3ncsc3c2)C1	ZINC001025609962	1324461660	/nfs/dbraw/zinc/46/16/60/1324461660.db2.gz	IOMNWAUNKCISFA-ZBFHGGJFSA-N	0	3	341.480	3.150	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cccc(OCC(C)C)c2)C1	ZINC001025615597	1324469863	/nfs/dbraw/zinc/46/98/63/1324469863.db2.gz	WNKDEROBPAPDGW-PKOBYXMFSA-N	0	3	342.483	3.185	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(F)c3occc32)C1	ZINC001025624582	1324474882	/nfs/dbraw/zinc/47/48/82/1324474882.db2.gz	NROLOLNQKLLKEN-UONOGXRCSA-N	0	3	328.387	3.035	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2c(CC)oc3ccccc32)C1	ZINC001025630160	1324482417	/nfs/dbraw/zinc/48/24/17/1324482417.db2.gz	PXRJLISFSALQKD-HOTGVXAUSA-N	0	3	338.451	3.459	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cnc(CC(C)C)s2)C1	ZINC001025632353	1324484853	/nfs/dbraw/zinc/48/48/53/1324484853.db2.gz	JYXSEMCBQSKCMR-CVEARBPZSA-N	0	3	347.528	3.195	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2sc(C(C)(C)C)nc2C)C1	ZINC001025636215	1324488572	/nfs/dbraw/zinc/48/85/72/1324488572.db2.gz	YCTBLOSBBKOGFH-DZGCQCFKSA-N	0	3	347.528	3.213	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1[C@H]2CN(C/C=C\c3ccccc3)C[C@H]21	ZINC001025813563	1324513237	/nfs/dbraw/zinc/51/32/37/1324513237.db2.gz	QAFUWAYNIWQXJI-UWQHMNBHSA-N	0	3	347.462	3.048	20	30		EGEDHN
Cc1ccc(C(=O)N2C[C@@H]3CC[C@H](NCc4ccccc4C#N)[C@H]3C2)o1	ZINC001026188718	1324653771	/nfs/dbraw/zinc/65/37/71/1324653771.db2.gz	KHSFZVZTGCZIEW-FHWLQOOXSA-N	0	3	349.434	3.100	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CC[C@H]2CN(C(=O)C3(C4CC4)CC3)C[C@@H]21	ZINC001026291708	1324706810	/nfs/dbraw/zinc/70/68/10/1324706810.db2.gz	UUJCCPGFQNTRPE-YSIASYRMSA-N	0	3	349.478	3.075	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)c2cccs2)CC1	ZINC001026446222	1324810446	/nfs/dbraw/zinc/81/04/46/1324810446.db2.gz	PVHSLEQYROTTQG-UHFFFAOYSA-N	0	3	343.290	3.287	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)C2CC3(CC3)C2)CC1	ZINC001026557415	1324894996	/nfs/dbraw/zinc/89/49/96/1324894996.db2.gz	XPRBCZKNDDOITE-UHFFFAOYSA-N	0	3	341.293	3.102	20	30		EGEDHN
Cc1c[nH]cc1C(=O)NC1CCC(NCc2ccccc2C#N)CC1	ZINC001026605205	1324928047	/nfs/dbraw/zinc/92/80/47/1324928047.db2.gz	HWMKXKHNRDZKMY-UHFFFAOYSA-N	0	3	336.439	3.026	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)CCC2CCCC2)C1	ZINC001026660627	1324959097	/nfs/dbraw/zinc/95/90/97/1324959097.db2.gz	SVNALLWYIMKMQP-SFHVURJKSA-N	0	3	339.483	3.467	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@@H](CNCc3ccccc3C#N)C2)oc1C	ZINC001026782761	1325020481	/nfs/dbraw/zinc/02/04/81/1325020481.db2.gz	MABNKLLHADWZQO-INIZCTEOSA-N	0	3	337.423	3.020	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@H](CNCc2ccccc2C#N)C1	ZINC001026866517	1325054519	/nfs/dbraw/zinc/05/45/19/1325054519.db2.gz	XUEHPQCFNPHENC-OAHLLOKOSA-N	0	3	345.874	3.275	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)c2ocnc2C)C1	ZINC000963283935	1325065482	/nfs/dbraw/zinc/06/54/82/1325065482.db2.gz	YDHJPNBWUTVQAF-LSDHHAIUSA-N	0	3	337.851	3.052	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)Cc2cccnc2)C1	ZINC000963289175	1325074032	/nfs/dbraw/zinc/07/40/32/1325074032.db2.gz	GVTICFTVJJXZKH-ZWKOTPCHSA-N	0	3	347.890	3.080	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@H](CNCc2cc(F)ccc2C#N)C1)C1CCC1	ZINC001026913377	1325075470	/nfs/dbraw/zinc/07/54/70/1325075470.db2.gz	IEXCTNXZLKDIHP-LSDHHAIUSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](CNCc3ccccc3C#N)C2)CC1	ZINC001027040833	1325175851	/nfs/dbraw/zinc/17/58/51/1325175851.db2.gz	KOTAMFFGDXOFRI-KRWDZBQOSA-N	0	3	337.467	3.243	20	30		EGEDHN
Cc1cc(C)cc(C(=O)N2CC[C@@H](CNCc3ccccc3C#N)C2)c1	ZINC001027190347	1325293081	/nfs/dbraw/zinc/29/30/81/1325293081.db2.gz	QRILMSWVZFWGKY-SFHVURJKSA-N	0	3	347.462	3.427	20	30		EGEDHN
N#Cc1ccccc1CNC1CC2(C1)CC(NC(=O)CC1CCC1)C2	ZINC000963657052	1325361172	/nfs/dbraw/zinc/36/11/72/1325361172.db2.gz	ZNWVGDGNGIBICY-UHFFFAOYSA-N	0	3	337.467	3.265	20	30		EGEDHN
C[C@H](CC(C)(C)C#N)Nc1ccc(OCCN2CCN(C)CC2)cc1	ZINC000926009362	1325388377	/nfs/dbraw/zinc/38/83/77/1325388377.db2.gz	PKCNZFQGWGUMSB-QGZVFWFLSA-N	0	3	344.503	3.053	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)[C@@H]2CC=CCC2)C1	ZINC001027294663	1325430407	/nfs/dbraw/zinc/43/04/07/1325430407.db2.gz	YWYKDNXVFHHJNQ-WOJBJXKFSA-N	0	3	337.467	3.337	20	30		EGEDHN
C/C(=C/C(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)cc2)C1)C1CC1	ZINC001027313213	1325464016	/nfs/dbraw/zinc/46/40/16/1325464016.db2.gz	AUNLRKUXMANLRD-VMTBQTDASA-N	0	3	337.467	3.337	20	30		EGEDHN
CN(Cc1ccc(F)c(C#N)c1)[C@@H]1CCCN(C(=O)CCC2CC2)C1	ZINC001027337803	1325497469	/nfs/dbraw/zinc/49/74/69/1325497469.db2.gz	BUGBCEIPJSWLTF-GOSISDBHSA-N	0	3	343.446	3.310	20	30		EGEDHN
CCOc1cccc(CCC(=O)C(C#N)C(=O)NC2CCCCC2)c1	ZINC000860468811	1329320881	/nfs/dbraw/zinc/32/08/81/1329320881.db2.gz	LQGZXLYRESOMBR-SFHVURJKSA-N	0	3	342.439	3.176	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)C[C@@H](C)c2ccco2)cc1	ZINC000860472956	1329321879	/nfs/dbraw/zinc/32/18/79/1329321879.db2.gz	QSLHYMOSZKJJPA-DOMZBBRYSA-N	0	3	326.352	3.129	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1cc[nH]c1CCC)C2	ZINC000964634187	1327610564	/nfs/dbraw/zinc/61/05/64/1327610564.db2.gz	JKDPQYRZCKDXTD-UHFFFAOYSA-N	0	3	335.879	3.350	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H](N(C)Cc2cccc(C#N)c2)C1)C1CCC1	ZINC001027460838	1327708132	/nfs/dbraw/zinc/70/81/32/1327708132.db2.gz	PJTIYXWZFREQOF-OXJNMPFZSA-N	0	3	339.483	3.417	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)C2(C)CCC2)C1	ZINC001027527244	1327803162	/nfs/dbraw/zinc/80/31/62/1327803162.db2.gz	BDNRAXUBJVQWRG-GOSISDBHSA-N	0	3	325.456	3.171	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)C2(C)CCC2)C1	ZINC001027530100	1327811066	/nfs/dbraw/zinc/81/10/66/1327811066.db2.gz	RGUGIFDUGYCYPA-SFHVURJKSA-N	0	3	325.456	3.171	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)[C@@]2(C)C=CCC2)C1	ZINC001027532343	1327815375	/nfs/dbraw/zinc/81/53/75/1327815375.db2.gz	YRSKQOIFVQLZEH-CTNGQTDRSA-N	0	3	337.467	3.337	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H](N(C)CCn2nc(C)cc2C)C1	ZINC001027560107	1327874895	/nfs/dbraw/zinc/87/48/95/1327874895.db2.gz	PUMHOXJLBDFOIK-UYAOXDASSA-N	0	3	346.519	3.025	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H](N(C)Cc3ccc(C)nc3C)C2)C1	ZINC001027565713	1327890673	/nfs/dbraw/zinc/89/06/73/1327890673.db2.gz	AUOGMSWPTPLHTD-LJQANCHMSA-N	0	3	341.499	3.478	20	30		EGEDHN
CC[C@@H](NCCNc1ccc(C#N)cn1)c1cccc(OC)c1OC	ZINC000927167070	1327903253	/nfs/dbraw/zinc/90/32/53/1327903253.db2.gz	GDTURRDUJMBPJY-MRXNPFEDSA-N	0	3	340.427	3.123	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)C[C@H](C)c2ccc(CC)cc2)C1	ZINC001027573042	1327909052	/nfs/dbraw/zinc/90/90/52/1327909052.db2.gz	YFMWGNJFKDJVNV-FXAWDEMLSA-N	0	3	326.484	3.299	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001027585254	1327921854	/nfs/dbraw/zinc/92/18/54/1327921854.db2.gz	DFNXZVBBGCTCDE-GUDVDZBRSA-N	0	3	325.456	3.027	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)c2ccccc2O[C@H](C)CC)C1	ZINC001027596649	1327947258	/nfs/dbraw/zinc/94/72/58/1327947258.db2.gz	XZOTYALHCWETDE-IAGOWNOFSA-N	0	3	328.456	3.034	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)C1Cc3ccccc3C1)C2	ZINC000965249026	1327953727	/nfs/dbraw/zinc/95/37/27/1327953727.db2.gz	HIOOFEZGZQZBED-UHFFFAOYSA-N	0	3	344.886	3.171	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CCC[C@@H](N(C)Cc2ccc(F)c(C#N)c2)C1	ZINC001027602813	1327954244	/nfs/dbraw/zinc/95/42/44/1327954244.db2.gz	FGUOGOAQCGAGHM-CRAIPNDOSA-N	0	3	345.462	3.412	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001027604535	1327962007	/nfs/dbraw/zinc/96/20/07/1327962007.db2.gz	RJCILPZOGJHTGT-QFBILLFUSA-N	0	3	327.472	3.273	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)c2cc3cc(C)ccc3s2)C1	ZINC001027637274	1328004885	/nfs/dbraw/zinc/00/48/85/1328004885.db2.gz	PDOHTZLWKXGBBX-MRXNPFEDSA-N	0	3	326.465	3.379	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)c2cc3c(s2)CC[C@@H](C)C3)C1	ZINC001027679013	1328078965	/nfs/dbraw/zinc/07/89/65/1328078965.db2.gz	SESQDHNMYYWGKX-ZBFHGGJFSA-N	0	3	330.497	3.043	20	30		EGEDHN
C[C@@H](CC(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)cc2)C1)C1CC1	ZINC001027696867	1328105897	/nfs/dbraw/zinc/10/58/97/1328105897.db2.gz	RGYWFVIMSZGPFJ-OXJNMPFZSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1cccn1C(C)C)C2	ZINC000965922594	1328107210	/nfs/dbraw/zinc/10/72/10/1328107210.db2.gz	ACOWOWBYKOKDPC-UHFFFAOYSA-N	0	3	335.879	3.452	20	30		EGEDHN
N#Cc1cc(C(=O)NC[C@@H]2CCCN2Cc2ccc(C3CC3)cc2)c[nH]1	ZINC001027835390	1328290676	/nfs/dbraw/zinc/29/06/76/1328290676.db2.gz	BMTHFAWDXIZFKO-FQEVSTJZSA-N	0	3	348.450	3.158	20	30		EGEDHN
Cc1ccccc1C(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC000966545101	1328337128	/nfs/dbraw/zinc/33/71/28/1328337128.db2.gz	RHZAPQFBNVEJAW-QGZVFWFLSA-N	0	3	337.398	3.010	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2ccc3cc(C)cn3c2)C1	ZINC000966632318	1328363027	/nfs/dbraw/zinc/36/30/27/1328363027.db2.gz	KLOODWIEEDTSDK-APWZRJJASA-N	0	3	325.456	3.264	20	30		EGEDHN
Cc1cc(NN=Cc2c(F)ccc(C3OCCO3)c2Cl)ccn1	ZINC000863159455	1329530894	/nfs/dbraw/zinc/53/08/94/1329530894.db2.gz	RSXRHNIPJJQHGP-UHFFFAOYSA-N	0	3	335.766	3.096	20	30		EGEDHN
C#CC[C@@H](CCOC)NCc1cc(OC)c(Br)cc1F	ZINC000865645844	1329724623	/nfs/dbraw/zinc/72/46/23/1329724623.db2.gz	BAZQUKVZZVPGAU-LBPRGKRZSA-N	0	3	344.224	3.115	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CNCc2cc3c([nH]c2=O)CCCC3)cc1	ZINC000865878855	1329748156	/nfs/dbraw/zinc/74/81/56/1329748156.db2.gz	CPHIFLHAMZXFCP-AWEZNQCLSA-N	0	3	337.423	3.247	20	30		EGEDHN
CN(C)CCN(Cc1ccc(F)cc1)C(=O)Nc1sccc1C#N	ZINC000931846186	1329766241	/nfs/dbraw/zinc/76/62/41/1329766241.db2.gz	LSJHHAIHXVSDTN-UHFFFAOYSA-N	0	3	346.431	3.355	20	30		EGEDHN
CC(=O)c1nc(CCN2CCC(c3ccc(C#N)cc3)CC2)[nH]c1C	ZINC000933611486	1329905847	/nfs/dbraw/zinc/90/58/47/1329905847.db2.gz	RKAAGPDJJZBJGB-UHFFFAOYSA-N	0	3	336.439	3.215	20	30		EGEDHN
CC(=O)c1[nH]c(CCN2CCC(c3ccc(C#N)cc3)CC2)nc1C	ZINC000933611486	1329905849	/nfs/dbraw/zinc/90/58/49/1329905849.db2.gz	RKAAGPDJJZBJGB-UHFFFAOYSA-N	0	3	336.439	3.215	20	30		EGEDHN
CC(C)N1CCC[C@@H]1C(=O)N1CCC[C@H]1[C@@H](C#N)c1ccccc1	ZINC000933858665	1329928681	/nfs/dbraw/zinc/92/86/81/1329928681.db2.gz	QRGUSBXKTZKSBZ-GBESFXJTSA-N	0	3	325.456	3.158	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](C)[C@H](NCc3cc(C)ccc3OC)C2)C1	ZINC000939103885	1330377129	/nfs/dbraw/zinc/37/71/29/1330377129.db2.gz	ZTDQJBUVDUNSPP-SJLPKXTDSA-N	0	3	342.483	3.296	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2oc3c(cccc3F)c2C)[C@H](C)C1	ZINC000942124531	1331838973	/nfs/dbraw/zinc/83/89/73/1331838973.db2.gz	ZAHHVRMORQKDTK-CXAGYDPISA-N	0	3	342.414	3.344	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)[C@H]2CC[C@H](C3CCC3)CC2)[C@H](C)C1	ZINC000942145276	1331846176	/nfs/dbraw/zinc/84/61/76/1331846176.db2.gz	YFCQNHIKLAFMGL-AFYVEPGGSA-N	0	3	330.516	3.443	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(C)cc2Cl)[C@@H](C)C1	ZINC000942193258	1331873125	/nfs/dbraw/zinc/87/31/25/1331873125.db2.gz	RZJZSUBFPCKYAC-YJBOKZPZSA-N	0	3	332.875	3.041	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2occc2-c2ccccc2)[C@@H](C)C1	ZINC000942392702	1331922244	/nfs/dbraw/zinc/92/22/44/1331922244.db2.gz	KAQLKMGWQQDUEG-QFBILLFUSA-N	0	3	336.435	3.410	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cccc(C)c2Cl)[C@@H](C)C1	ZINC000942467984	1331941134	/nfs/dbraw/zinc/94/11/34/1331941134.db2.gz	VRAIURDRYSTSEB-RDJZCZTQSA-N	0	3	332.875	3.041	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)c(C)cc2Cl)[C@@H](C)C1	ZINC000942561939	1331976082	/nfs/dbraw/zinc/97/60/82/1331976082.db2.gz	DZJNLRNWRKEXTL-YJBOKZPZSA-N	0	3	332.875	3.420	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2c(C)cc(C)cc2C)[C@@H](C)C1	ZINC000942597567	1331996720	/nfs/dbraw/zinc/99/67/20/1331996720.db2.gz	LRJRWRUUORVMMJ-ICSRJNTNSA-N	0	3	326.484	3.004	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)cc2)CC[C@H]1NC(=O)C1CC2(CC2)C1	ZINC000942701593	1332023055	/nfs/dbraw/zinc/02/30/55/1332023055.db2.gz	SMZUVHSIKSGOCK-DNVCBOLYSA-N	0	3	337.467	3.075	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C(C)(C)c2ccc(C)cc2)[C@H](C)C1	ZINC000944230095	1332349998	/nfs/dbraw/zinc/34/99/98/1332349998.db2.gz	YUVSXVAVMJUAIW-IEBWSBKVSA-N	0	3	326.484	3.123	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccsc2C(F)(F)F)[C@@H](C)C1	ZINC000944344531	1332379452	/nfs/dbraw/zinc/37/94/52/1332379452.db2.gz	ARMYHDDTFALKKF-JQWIXIFHSA-N	0	3	332.391	3.393	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3c(s2)CCCC3)[C@H](C)C1	ZINC000944702793	1332423085	/nfs/dbraw/zinc/42/30/85/1332423085.db2.gz	UGABXHQWFZJFQG-ZBFHGGJFSA-N	0	3	330.497	3.090	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C(F)(F)F)s2)[C@@H](C)C1	ZINC000945368863	1332569284	/nfs/dbraw/zinc/56/92/84/1332569284.db2.gz	ZHAOUPXTTATVEK-RYUDHWBXSA-N	0	3	344.402	3.230	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3ccc(F)cc3)CC[C@@H]2C1	ZINC000946448901	1332831442	/nfs/dbraw/zinc/83/14/42/1332831442.db2.gz	FMAGFXDIGSQQDI-IYBDPMFKSA-N	0	3	336.838	3.362	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)c2ccsc2)CCN1Cc1cccc(C#N)c1	ZINC000947000678	1332964433	/nfs/dbraw/zinc/96/44/33/1332964433.db2.gz	JRAFFYPTDXGTGY-KSSFIOAISA-N	0	3	339.464	3.403	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@H](C)C2)o1	ZINC000947025497	1332979414	/nfs/dbraw/zinc/97/94/14/1332979414.db2.gz	DZLMVPPZQPMHQY-RDTXWAMCSA-N	0	3	337.423	3.243	20	30		EGEDHN
Cc1occc1C(=O)N[C@@H]1CCN(Cc2cccc(C#N)c2)[C@@H](C)C1	ZINC000947032421	1332982300	/nfs/dbraw/zinc/98/23/00/1332982300.db2.gz	OHOAAWUGXBHECL-KBXCAEBGSA-N	0	3	337.423	3.243	20	30		EGEDHN
Cc1ccoc1C(=O)N[C@@H]1CCN(Cc2ccc(C#N)cc2)[C@H](C)C1	ZINC000947058347	1332995565	/nfs/dbraw/zinc/99/55/65/1332995565.db2.gz	YHHUQOAWMLYYIG-CRAIPNDOSA-N	0	3	337.423	3.243	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)c2ccccc2[O-])CC[N@@H+]1Cc1ccc(C#N)cc1	ZINC000947070964	1333001980	/nfs/dbraw/zinc/00/19/80/1333001980.db2.gz	NSNJWHKYUBONEH-MAUKXSAKSA-N	0	3	349.434	3.047	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)c2ccccc2[O-])CC[N@H+]1Cc1ccc(C#N)cc1	ZINC000947070964	1333001983	/nfs/dbraw/zinc/00/19/83/1333001983.db2.gz	NSNJWHKYUBONEH-MAUKXSAKSA-N	0	3	349.434	3.047	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2ccc(C#N)[nH]2)CCN1C/C=C\c1ccccc1	ZINC000947215875	1333053769	/nfs/dbraw/zinc/05/37/69/1333053769.db2.gz	BOWYACLFGNVZCM-GDOYXMMASA-N	0	3	348.450	3.182	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ocnc2-c2ccccc2)C[C@H]1C	ZINC000947377398	1333107998	/nfs/dbraw/zinc/10/79/98/1333107998.db2.gz	GVSXBUUOXHVKLT-GDBMZVCRSA-N	0	3	325.412	3.110	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccc(-n3cccc3)c2)C[C@H]1C	ZINC000947512043	1333151490	/nfs/dbraw/zinc/15/14/90/1333151490.db2.gz	SQWCMGXRQPJJST-IEBWSBKVSA-N	0	3	335.451	3.083	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc(CC(C)C)cc2)C[C@H]1C	ZINC000947519823	1333154981	/nfs/dbraw/zinc/15/49/81/1333154981.db2.gz	JCAUQDBNOJSIPV-WIYYLYMNSA-N	0	3	340.511	3.420	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cccc(C(F)F)c2)C[C@@H]1C	ZINC000947540615	1333164441	/nfs/dbraw/zinc/16/44/41/1333164441.db2.gz	WFEBXTHIDKPKHI-YOEHRIQHSA-N	0	3	334.410	3.159	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C)nc2C(C)C)C[C@@H]1C	ZINC000947584261	1333182246	/nfs/dbraw/zinc/18/22/46/1333182246.db2.gz	HFAKBSHOGUTKDG-IRXDYDNUSA-N	0	3	327.472	3.119	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(-c3cccs3)on2)C[C@H]1C	ZINC000947584895	1333182771	/nfs/dbraw/zinc/18/27/71/1333182771.db2.gz	OFTVYDBDGVSCRH-OLZOCXBDSA-N	0	3	331.441	3.172	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)C2(C)CCC2)CCN1Cc1ccc(C#N)cc1	ZINC000947622050	1333196237	/nfs/dbraw/zinc/19/62/37/1333196237.db2.gz	ZYGCWPXIKLJGJX-MAUKXSAKSA-N	0	3	325.456	3.218	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)C2(C)CCC2)CCN1Cc1ccc(C#N)cc1	ZINC000947622049	1333196265	/nfs/dbraw/zinc/19/62/65/1333196265.db2.gz	ZYGCWPXIKLJGJX-CRAIPNDOSA-N	0	3	325.456	3.218	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2csc(-c3ccco3)n2)C[C@@H]1C	ZINC000947661792	1333212782	/nfs/dbraw/zinc/21/27/82/1333212782.db2.gz	AIVHOVCQXRMTER-STQMWFEESA-N	0	3	331.441	3.172	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc3cccc(OC)c3o2)C[C@H]1C	ZINC000947667607	1333215423	/nfs/dbraw/zinc/21/54/23/1333215423.db2.gz	RPQIDKTVPUKVSY-UKRRQHHQSA-N	0	3	328.412	3.210	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(F)cc2Cl)C[C@@H]1C	ZINC000947690416	1333225508	/nfs/dbraw/zinc/22/55/08/1333225508.db2.gz	WMQNDEQXEBYYHW-BBRMVZONSA-N	0	3	336.838	3.014	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(F)c(Cl)c2F)C[C@@H]1C	ZINC000947693659	1333228149	/nfs/dbraw/zinc/22/81/49/1333228149.db2.gz	QAHPCCFPTMVRLQ-NWDGAFQWSA-N	0	3	340.801	3.224	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2cccc3sccc32)C[C@H]1C	ZINC000947778409	1333258528	/nfs/dbraw/zinc/25/85/28/1333258528.db2.gz	CJVGVRQAGUPOND-NVXWUHKLSA-N	0	3	340.492	3.436	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ncoc2-c2cccs2)C[C@@H]1C	ZINC000947825647	1333272353	/nfs/dbraw/zinc/27/23/53/1333272353.db2.gz	URCYJNZGPINVSU-QWHCGFSZSA-N	0	3	331.441	3.172	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccn2C2CCCC2)C[C@@H]1C	ZINC000947857703	1333283043	/nfs/dbraw/zinc/28/30/43/1333283043.db2.gz	QGZMSPMGEPPFEC-DLBZAZTESA-N	0	3	327.472	3.209	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2coc3ccc(F)cc23)C[C@H]1C	ZINC000947975425	1333329681	/nfs/dbraw/zinc/32/96/81/1333329681.db2.gz	NJUKOYCLHGAEQX-UKRRQHHQSA-N	0	3	328.387	3.178	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3c(s2)CCCC3)C[C@@H]1C	ZINC000948001736	1333338852	/nfs/dbraw/zinc/33/88/52/1333338852.db2.gz	FAAXAILKVLAOPJ-HOCLYGCPSA-N	0	3	330.497	3.233	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3cccc(F)c3o2)C[C@@H]1C	ZINC000948064434	1333360664	/nfs/dbraw/zinc/36/06/64/1333360664.db2.gz	CNWIMVNMIAHVBP-DZGCQCFKSA-N	0	3	328.387	3.178	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2csc3ccccc32)CC1	ZINC000948662382	1333618420	/nfs/dbraw/zinc/61/84/20/1333618420.db2.gz	XXWKRHMOSYYGCD-HNNXBMFYSA-N	0	3	326.465	3.461	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@@H]2CCCN(Cc3c(C)noc3C)CC2)C1	ZINC000948746035	1333656241	/nfs/dbraw/zinc/65/62/41/1333656241.db2.gz	AREGPPWWJMOARS-QGZVFWFLSA-N	0	3	345.487	3.461	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)[C@@H]2CCCC(F)(F)C2)CC1	ZINC000948766152	1333669123	/nfs/dbraw/zinc/66/91/23/1333669123.db2.gz	HFWYFOYZHUFNJG-HZPDHXFCSA-N	0	3	326.431	3.148	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2sc(C)cc2OC)CC1	ZINC000948829858	1333701961	/nfs/dbraw/zinc/70/19/61/1333701961.db2.gz	XXAMMQYCEMIPFN-HNNXBMFYSA-N	0	3	334.485	3.015	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2)CC1	ZINC000948850074	1333708253	/nfs/dbraw/zinc/70/82/53/1333708253.db2.gz	WLHGMLLFADPXKA-GBESFXJTSA-N	0	3	344.886	3.390	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2csc(C(C)C)n2)CC1	ZINC000948852222	1333710287	/nfs/dbraw/zinc/71/02/87/1333710287.db2.gz	KXAHYQBMSZPFEQ-HNNXBMFYSA-N	0	3	333.501	3.216	20	30		EGEDHN
CC#CCN1CCC2(CC1)CN(C(=O)CCC1CCCCC1)CCO2	ZINC000949236239	1333800565	/nfs/dbraw/zinc/80/05/65/1333800565.db2.gz	NEOXHRABNZIVFJ-UHFFFAOYSA-N	0	3	346.515	3.064	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1CCC(C3CC3)CC1)CCO2	ZINC000949239635	1333801307	/nfs/dbraw/zinc/80/13/07/1333801307.db2.gz	PRQXGLBEQLCUFQ-UHFFFAOYSA-N	0	3	346.515	3.082	20	30		EGEDHN
CC#CCN1CCC2(CC1)CN(C(=O)C1(CC)CCCCC1)CCO2	ZINC000949248337	1333802712	/nfs/dbraw/zinc/80/27/12/1333802712.db2.gz	TYJLNEWGRBHTMM-UHFFFAOYSA-N	0	3	346.515	3.064	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@H]3[C@@H]4CCCC[C@@H]43)CC2)C1	ZINC000949332925	1333825891	/nfs/dbraw/zinc/82/58/91/1333825891.db2.gz	YFIIXQUSDACJEC-BWTSREIZSA-N	0	3	346.515	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3occc3C(C)C)CC2)C1	ZINC000949446991	1333849848	/nfs/dbraw/zinc/84/98/48/1333849848.db2.gz	IYQAVJRBEIEZIR-UHFFFAOYSA-N	0	3	346.471	3.286	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2coc3cc(F)ccc23)C1	ZINC000967093108	1335661430	/nfs/dbraw/zinc/66/14/30/1335661430.db2.gz	YQNPGFOFRFNLHH-DYVFJYSZSA-N	0	3	328.387	3.035	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)C2(c3cccc(C)c3)CCC2)C1	ZINC000967660737	1335802953	/nfs/dbraw/zinc/80/29/53/1335802953.db2.gz	XLFKMNWWXBBBOR-UYAOXDASSA-N	0	3	338.495	3.267	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2nsc3ccc(C)cc32)C1	ZINC000967780505	1335815991	/nfs/dbraw/zinc/81/59/91/1335815991.db2.gz	PRSGPEAMVYBFPR-GDBMZVCRSA-N	0	3	341.480	3.068	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2ccccc2-n2cccc2)C1	ZINC000968193702	1335869445	/nfs/dbraw/zinc/86/94/45/1335869445.db2.gz	WKQUQLYURKZNON-IEBWSBKVSA-N	0	3	337.467	3.494	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2ccc(C(C)C)nc2CC)C1	ZINC000968334832	1335892846	/nfs/dbraw/zinc/89/28/46/1335892846.db2.gz	KZFYNFFFHCWIIR-OXJNMPFZSA-N	0	3	341.499	3.231	20	30		EGEDHN
CC1(CC(=O)N2CC[C@@H](NCc3ccc(C#N)s3)C2)CCCC1	ZINC000968577554	1335968490	/nfs/dbraw/zinc/96/84/90/1335968490.db2.gz	JMABHDCSJIOOPP-CQSZACIVSA-N	0	3	331.485	3.281	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2c[nH]cc2-c2ccccc2)C1	ZINC000968646604	1335995355	/nfs/dbraw/zinc/99/53/55/1335995355.db2.gz	FHTMOWGXCCPJLK-OXJNMPFZSA-N	0	3	335.451	3.145	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)Cc2cccc(OCC)c2)C1	ZINC000968684978	1336010239	/nfs/dbraw/zinc/01/02/39/1336010239.db2.gz	LIUHRXDVARMSSL-QFBILLFUSA-N	0	3	330.472	3.031	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2ccc(CN(CC)CC)o2)C1	ZINC000968688019	1336011620	/nfs/dbraw/zinc/01/16/20/1336011620.db2.gz	JGWYIBYCOWUYGQ-WMZOPIPTSA-N	0	3	347.503	3.138	20	30		EGEDHN
C#CCCN1CCCCC[C@H]1CNC(=O)c1sc(Cl)nc1C	ZINC000968876931	1336076360	/nfs/dbraw/zinc/07/63/60/1336076360.db2.gz	KRMQVXUVAFDTBH-ZDUSSCGKSA-N	0	3	339.892	3.103	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1coc(Br)c1	ZINC000968882430	1336079022	/nfs/dbraw/zinc/07/90/22/1336079022.db2.gz	NQRQZKWVVXHQPN-CYBMUJFWSA-N	0	3	341.249	3.203	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)[C@@H]1CCN(C)c2ccccc21	ZINC000968893849	1336083058	/nfs/dbraw/zinc/08/30/58/1336083058.db2.gz	SAASIMWWERTFSX-IEBWSBKVSA-N	0	3	341.499	3.157	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@H]2CCCCCN2CC=C)cc1	ZINC000968923298	1336090422	/nfs/dbraw/zinc/09/04/22/1336090422.db2.gz	PMXXJRHXYVVARY-GOSISDBHSA-N	0	3	328.456	3.412	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cnn2cccc(Cl)c12	ZINC000968941158	1336097896	/nfs/dbraw/zinc/09/78/96/1336097896.db2.gz	JGTAUOSRAGVWFJ-AWEZNQCLSA-N	0	3	346.862	3.148	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1c(C)[nH]c2ccccc21	ZINC000968942810	1336099009	/nfs/dbraw/zinc/09/90/09/1336099009.db2.gz	ZWGNEOMFQPGKAH-KRWDZBQOSA-N	0	3	337.467	3.474	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cc2ccccc2n1C	ZINC000969007428	1336116096	/nfs/dbraw/zinc/11/60/96/1336116096.db2.gz	CGBTVSTZLIFKJH-KRWDZBQOSA-N	0	3	325.456	3.339	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cccc(N2CC=CC2)c1	ZINC000969053920	1336129937	/nfs/dbraw/zinc/12/99/37/1336129937.db2.gz	OEZPVSAMWLCDND-FQEVSTJZSA-N	0	3	339.483	3.223	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccnc(C(F)(F)F)c1	ZINC000969103216	1336143939	/nfs/dbraw/zinc/14/39/39/1336143939.db2.gz	GYAXCQZDLIEWGT-CQSZACIVSA-N	0	3	341.377	3.261	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1c(C)nn(CC)c1Cl	ZINC000969153579	1336164264	/nfs/dbraw/zinc/16/42/64/1336164264.db2.gz	KLSBEUBDBJUKEI-CQSZACIVSA-N	0	3	338.883	3.025	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccc(N(C)C)c(F)c1	ZINC000969156356	1336166148	/nfs/dbraw/zinc/16/61/48/1336166148.db2.gz	QVDFXZRMQSIHBN-INIZCTEOSA-N	0	3	333.451	3.052	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1ccc(F)cc1	ZINC000969158926	1336166864	/nfs/dbraw/zinc/16/68/64/1336166864.db2.gz	WPVSKQCXYCYAMX-HSALFYBXSA-N	0	3	342.458	3.313	20	30		EGEDHN
C#CCCN1CC([C@@H](C)NC(=O)c2cc3cccc(C)c3s2)C1	ZINC000969992723	1336270025	/nfs/dbraw/zinc/27/00/25/1336270025.db2.gz	ORTRGKPAMAOZJZ-CQSZACIVSA-N	0	3	326.465	3.283	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)[C@@H]2CCc3c2cccc3Cl)C1	ZINC000970169015	1336288094	/nfs/dbraw/zinc/28/80/94/1336288094.db2.gz	JKTMIUCPEBZUHK-CXAGYDPISA-N	0	3	332.875	3.382	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cc3cccc(OC)c3o2)CC1	ZINC001005902393	1336418997	/nfs/dbraw/zinc/41/89/97/1336418997.db2.gz	QSNYGKORIDVHOM-UHFFFAOYSA-N	0	3	328.412	3.164	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cnn(C(C)C)c2C2CC2)CC1	ZINC001006276458	1336480613	/nfs/dbraw/zinc/48/06/13/1336480613.db2.gz	WVMTZZRLTUABEA-UHFFFAOYSA-N	0	3	344.503	3.454	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccc(OC)c(OCC)c2)CC1	ZINC001006378737	1336497986	/nfs/dbraw/zinc/49/79/86/1336497986.db2.gz	AKHJEYHGGQTVDB-UHFFFAOYSA-N	0	3	346.471	3.206	20	30		EGEDHN
Cc1cccc([C@H](C)N2CCC[C@@H](NC(=O)c3cc(C#N)c[nH]3)C2)c1	ZINC001007030017	1336628632	/nfs/dbraw/zinc/62/86/32/1336628632.db2.gz	PNEPUWKDHHNOJO-MAUKXSAKSA-N	0	3	336.439	3.150	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)c2cn(C)c3ccc(F)cc23)C1	ZINC001007514953	1336662295	/nfs/dbraw/zinc/66/22/95/1336662295.db2.gz	PQHFLDTXRHBZQQ-OAHLLOKOSA-N	0	3	329.419	3.088	20	30		EGEDHN
C=C(C)CCN1CCC[C@H](NC(=O)c2ncsc2C(F)(F)F)C1	ZINC001007924222	1336734224	/nfs/dbraw/zinc/73/42/24/1336734224.db2.gz	HLWWGJGWZDBETL-NSHDSACASA-N	0	3	347.406	3.322	20	30		EGEDHN
C=C(C)CCN1CCC[C@H](NC(=O)c2c(F)ccc(F)c2F)C1	ZINC001008351788	1336831640	/nfs/dbraw/zinc/83/16/40/1336831640.db2.gz	XLXOYTWLHRSNCP-LBPRGKRZSA-N	0	3	326.362	3.264	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCCN(C[C@H]3CC(C)(C)CO3)C2)CC1	ZINC001008418661	1336847270	/nfs/dbraw/zinc/84/72/70/1336847270.db2.gz	PIOYQSBITVODLN-QZTJIDSGSA-N	0	3	334.504	3.129	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CCCN([C@H](C)c3ccccc3)C2)c1	ZINC001008468380	1336864039	/nfs/dbraw/zinc/86/40/39/1336864039.db2.gz	LAWSXTBLPBMYTB-UZLBHIALSA-N	0	3	333.435	3.018	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(Cc3ccccc3CC)C2)cc1	ZINC001015481225	1338155646	/nfs/dbraw/zinc/15/56/46/1338155646.db2.gz	DKUGXUQSGKCPCL-OAQYLSRUSA-N	0	3	332.447	3.235	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](NC(=O)c2oc3ccccc3c2OC)C1	ZINC001015495508	1338159007	/nfs/dbraw/zinc/15/90/07/1338159007.db2.gz	LLAJQPWUVBQATP-CQSZACIVSA-N	0	3	328.412	3.212	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN([C@@H](C)c3cc(C)ccc3C)C2)nc1	ZINC001016026361	1338413953	/nfs/dbraw/zinc/41/39/53/1338413953.db2.gz	FXZFTYYJRKVPHE-PKOBYXMFSA-N	0	3	347.462	3.245	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN([C@H](C)c3cc(C)ccc3C)C2)cn1	ZINC001016032707	1338417672	/nfs/dbraw/zinc/41/76/72/1338417672.db2.gz	CPWSQHORVROPLN-XLIONFOSSA-N	0	3	347.462	3.245	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@@H]3NC(=O)C=C3CCC3)CC2)c1	ZINC001016564650	1338648136	/nfs/dbraw/zinc/64/81/36/1338648136.db2.gz	QXLGJMVGJBCNQS-IBGZPJMESA-N	0	3	335.451	3.139	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(CCC)s2)CC1	ZINC001016641438	1338673340	/nfs/dbraw/zinc/67/33/40/1338673340.db2.gz	AOQBXDUWZTWCHD-KRWDZBQOSA-N	0	3	330.497	3.308	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cccc3ccc(C)nc32)CC1	ZINC001016680795	1338688146	/nfs/dbraw/zinc/68/81/46/1338688146.db2.gz	COEJIGXNPQNNLF-LJQANCHMSA-N	0	3	347.462	3.151	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cc3cc(C)ccc3[nH]2)CC1	ZINC001016764689	1338716956	/nfs/dbraw/zinc/71/69/56/1338716956.db2.gz	YJHXDIMESXLKTI-IBGZPJMESA-N	0	3	335.451	3.084	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2ccccc2O[C@H](C)CC)CC1	ZINC001016854029	1338747940	/nfs/dbraw/zinc/74/79/40/1338747940.db2.gz	SRZAEERRFBZJDN-APWZRJJASA-N	0	3	340.467	3.081	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)C(C)(C)c2ccc(CC)cc2)CC1	ZINC001016921325	1338770244	/nfs/dbraw/zinc/77/02/44/1338770244.db2.gz	QCIZLHYUXUTURW-LJQANCHMSA-N	0	3	338.495	3.131	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cc3cccc(C)c3o2)CC1	ZINC001016985620	1338793153	/nfs/dbraw/zinc/79/31/53/1338793153.db2.gz	LCLTTZHOFVDCKR-SFHVURJKSA-N	0	3	336.435	3.349	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cc3cccc(F)c3o2)CC1	ZINC001016986242	1338793680	/nfs/dbraw/zinc/79/36/80/1338793680.db2.gz	ONRMGRPITCNHDS-KRWDZBQOSA-N	0	3	340.398	3.180	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCCN(C(=O)C2(C)CC2)C1	ZINC001017137058	1338890347	/nfs/dbraw/zinc/89/03/47/1338890347.db2.gz	DAPVJEVIGSQTPD-CQSZACIVSA-N	0	3	331.485	3.090	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(C)c2cccnc12	ZINC001017741885	1339408404	/nfs/dbraw/zinc/40/84/04/1339408404.db2.gz	HKJGAHUFPNMXLU-CALCHBBNSA-N	0	3	335.451	3.408	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CC[C@H](C(F)(F)F)C1	ZINC001017854959	1339430674	/nfs/dbraw/zinc/43/06/74/1339430674.db2.gz	FFBXFCIFUTVKLC-BARDWOONSA-N	0	3	330.394	3.216	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1C[C@H]1c1c(F)cccc1F	ZINC001017924765	1339453970	/nfs/dbraw/zinc/45/39/70/1339453970.db2.gz	HJLJQZMIXXWKIU-QKPAOTATSA-N	0	3	346.421	3.320	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(OC)c(C)c1	ZINC001018067164	1339494354	/nfs/dbraw/zinc/49/43/54/1339494354.db2.gz	QORGINRDFDDFFV-HDICACEKSA-N	0	3	328.456	3.259	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1c[nH]c2ccccc12	ZINC001018212080	1339535166	/nfs/dbraw/zinc/53/51/66/1339535166.db2.gz	QZQTWJWIOBIVLR-HDICACEKSA-N	0	3	337.467	3.352	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cc(C)nc2ccccc21	ZINC001018239349	1339544701	/nfs/dbraw/zinc/54/47/01/1339544701.db2.gz	PILAYAPSENIKRI-CALCHBBNSA-N	0	3	335.451	3.408	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)COc1ccc(C)c(C)c1	ZINC001018257718	1339551929	/nfs/dbraw/zinc/55/19/29/1339551929.db2.gz	FHQPDBHOWXOVJH-KDURUIRLSA-N	0	3	342.483	3.324	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)COc1ccccc1Cl	ZINC001018264728	1339554879	/nfs/dbraw/zinc/55/48/79/1339554879.db2.gz	YHIOOTZEWSYFHF-IYBDPMFKSA-N	0	3	348.874	3.360	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)Cc1ccccc1C	ZINC001018324133	1339577787	/nfs/dbraw/zinc/57/77/87/1339577787.db2.gz	SROZEYMVDQMFQU-YSIASYRMSA-N	0	3	326.484	3.425	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cc2n(c1)CCCC2	ZINC001018351116	1339587237	/nfs/dbraw/zinc/58/72/37/1339587237.db2.gz	COGXPTNOVKGSGO-KDURUIRLSA-N	0	3	327.472	3.079	20	30		EGEDHN
CC[C@@H](N[C@H]1CCN(C(=O)C#CC2CC2)C1)c1ccc(F)cc1F	ZINC001018818042	1339733894	/nfs/dbraw/zinc/73/38/94/1339733894.db2.gz	ADQPSARCEDWQRE-MAUKXSAKSA-N	0	3	332.394	3.020	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1cc(F)c(Cl)cc1F	ZINC001028106478	1340429801	/nfs/dbraw/zinc/42/98/01/1340429801.db2.gz	AEWZOPJPRUQYRK-NSHDSACASA-N	0	3	328.790	3.389	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1ccc2nc(C)sc2c1	ZINC001028242094	1340503002	/nfs/dbraw/zinc/50/30/02/1340503002.db2.gz	BPUZCDYVKJBLMS-HNNXBMFYSA-N	0	3	329.469	3.375	20	30		EGEDHN
C#CCCN1CCC[C@@H]1CNC(=O)c1cc(Cl)ccc1Cl	ZINC001028283459	1340538643	/nfs/dbraw/zinc/53/86/43/1340538643.db2.gz	GXLMWHDFYMYMCY-CYBMUJFWSA-N	0	3	325.239	3.211	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@H]2CCN(C[C@@H](F)CC)C2)cc1	ZINC001028637273	1340738715	/nfs/dbraw/zinc/73/87/15/1340738715.db2.gz	PFIXPSQMRLVDGF-WBVHZDCISA-N	0	3	334.435	3.051	20	30		EGEDHN
CC(C)(C)[C@@H]1C[C@H]1C(=O)NC[C@H]1CCN(Cc2ccc(C#N)cc2)C1	ZINC001028684763	1340757475	/nfs/dbraw/zinc/75/74/75/1340757475.db2.gz	UTBJLIVOPSHVNF-GUDVDZBRSA-N	0	3	339.483	3.179	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CCN(Cc3cccc(C#N)c3)C2)CC1	ZINC001028780972	1340812931	/nfs/dbraw/zinc/81/29/31/1340812931.db2.gz	PKGPWAHSYACKRD-IBGZPJMESA-N	0	3	337.467	3.243	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)[C@@H]2C[C@H]2c2cccc3ccccc32)C1	ZINC001028874282	1340873348	/nfs/dbraw/zinc/87/33/48/1340873348.db2.gz	YWKWZBCYODZICQ-BULFRSBZSA-N	0	3	346.474	3.405	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)c2oc3ccccc3c2Cl)C1	ZINC001028922476	1340884716	/nfs/dbraw/zinc/88/47/16/1340884716.db2.gz	MGYOZALUQYSLNP-CYBMUJFWSA-N	0	3	330.815	3.161	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)C1CCN(C(=O)/C=C\C2CC2)CC1	ZINC001029074301	1340923761	/nfs/dbraw/zinc/92/37/61/1340923761.db2.gz	LZNBWKZYLJVZIZ-HLRDLLSLSA-N	0	3	337.467	3.241	20	30		EGEDHN
C[C@H](C#N)C(=O)N1C[C@H]2CC[C@@H](C1)N2CCCc1ccc(Cl)cc1	ZINC001029242950	1340960467	/nfs/dbraw/zinc/96/04/67/1340960467.db2.gz	PFMQPUSKRSXOAI-OLMNPRSZSA-N	0	3	345.874	3.107	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CC[C@@H](C1)N2CC1CC(OCC)C1	ZINC001029453717	1340993627	/nfs/dbraw/zinc/99/36/27/1340993627.db2.gz	JETWGTCTCTWBHT-XKRKNNOESA-N	0	3	334.504	3.079	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CC[C@@H](C1)N2C[C@H](OC)C1CCC1	ZINC001029456438	1340994306	/nfs/dbraw/zinc/99/43/06/1340994306.db2.gz	CKGGXMSNDDFTKH-HLNWXESRSA-N	0	3	334.504	3.079	20	30		EGEDHN
C[C@H](c1ccccc1F)N(C)C[C@H]1CCN(C(=O)C#CC2CC2)C1	ZINC001029732775	1341057151	/nfs/dbraw/zinc/05/71/51/1341057151.db2.gz	BYDPKFFYLSCEGO-NVXWUHKLSA-N	0	3	328.431	3.080	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](CN(C)Cc3ccc(Cl)nc3)C2)C1	ZINC001029836017	1341092167	/nfs/dbraw/zinc/09/21/67/1341092167.db2.gz	LHIUJXVHNCEIPV-INIZCTEOSA-N	0	3	347.890	3.372	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCN(C(=O)C2CC3(CC3)C2)C1	ZINC001029837835	1341092571	/nfs/dbraw/zinc/09/25/71/1341092571.db2.gz	VVPYQGCSWHCILJ-AWEZNQCLSA-N	0	3	343.496	3.090	20	30		EGEDHN
C#CCCN1CCC[C@H](N(Cc2ccccc2)C(=O)c2ccn(C)c2)C1	ZINC001029919807	1341119364	/nfs/dbraw/zinc/11/93/64/1341119364.db2.gz	IUHZEKFSYWFRDD-NRFANRHFSA-N	0	3	349.478	3.155	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1F	ZINC001032535318	1341534144	/nfs/dbraw/zinc/53/41/44/1341534144.db2.gz	DPDLYRNKSYWJGS-UOVPBQLFSA-N	0	3	346.421	3.320	20	30		EGEDHN
C#Cc1ccc(C(=O)N2C[C@@H]3C[C@H]2CN3CCC2=CCCCC2)cc1	ZINC001032555080	1341539348	/nfs/dbraw/zinc/53/93/48/1341539348.db2.gz	YMYGLHIGIWHANN-SFTDATJTSA-N	0	3	334.463	3.457	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cccc(F)c1OCC	ZINC001032703589	1341585657	/nfs/dbraw/zinc/58/56/57/1341585657.db2.gz	BEZJXISBIHWPKV-GJZGRUSLSA-N	0	3	332.419	3.089	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccnc(O[C@H](C)CC)c1	ZINC001032722267	1341591687	/nfs/dbraw/zinc/59/16/87/1341591687.db2.gz	QZGVNCIWVPBNSO-NJAFHUGGSA-N	0	3	343.471	3.124	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(OC)c(Cl)c1	ZINC001032773063	1341610064	/nfs/dbraw/zinc/61/00/64/1341610064.db2.gz	LRMABZJBYZJSAY-GJZGRUSLSA-N	0	3	334.847	3.214	20	30		EGEDHN
CN(C(=O)c1ccc(C#N)[nH]1)[C@@H]1CCN(Cc2ccccc2C2CC2)C1	ZINC001033022262	1341698972	/nfs/dbraw/zinc/69/89/72/1341698972.db2.gz	LWTRTNMMGGTYHO-GOSISDBHSA-N	0	3	348.450	3.110	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2cc(C3CCCCC3)n[nH]2)C1	ZINC001033158940	1341741344	/nfs/dbraw/zinc/74/13/44/1341741344.db2.gz	NPBVPKUPEMGZGP-INIZCTEOSA-N	0	3	330.476	3.180	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@H]2CCN(Cc3cccc(C)c3)C2)cc1	ZINC001033318791	1341779799	/nfs/dbraw/zinc/77/97/99/1341779799.db2.gz	PPUZHGQFYBAIHL-NRFANRHFSA-N	0	3	332.447	3.323	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1	ZINC001033495850	1341846849	/nfs/dbraw/zinc/84/68/49/1341846849.db2.gz	BSNQYAAXAFQKKU-UFYCRDLUSA-N	0	3	342.483	3.091	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)[C@]2(C)CCCc3ccccc32)C1	ZINC001033510828	1341852840	/nfs/dbraw/zinc/85/28/40/1341852840.db2.gz	WXJRHYHJMQHBPK-WIYYLYMNSA-N	0	3	326.484	3.389	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)C[C@@H]2CCc3ccccc3C2)C1	ZINC001033611355	1341901972	/nfs/dbraw/zinc/90/19/72/1341901972.db2.gz	RNUUDYIYZYYUJI-YLJYHZDGSA-N	0	3	326.484	3.290	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)C(C)(C)c2ccc(OC)cc2)C1	ZINC001033678789	1341945957	/nfs/dbraw/zinc/94/59/57/1341945957.db2.gz	ORMFSECVIJIHQZ-QGZVFWFLSA-N	0	3	330.472	3.082	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2cc3ccccc3n2CC)C1	ZINC001033686293	1341951305	/nfs/dbraw/zinc/95/13/05/1341951305.db2.gz	UTXQJXYHVBDZRG-QGZVFWFLSA-N	0	3	325.456	3.384	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2oc3c(cccc3F)c2C)C1	ZINC001033858553	1342047683	/nfs/dbraw/zinc/04/76/83/1342047683.db2.gz	ILUKBYDTKCMUMU-HNNXBMFYSA-N	0	3	342.414	3.440	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2cnc3ccccc3c2C)C1	ZINC001033905576	1342077758	/nfs/dbraw/zinc/07/77/58/1342077758.db2.gz	MHTRCZZPXHPBNT-KRWDZBQOSA-N	0	3	335.451	3.103	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cc3cc(OC)ccc3[nH]2)C1	ZINC001033937842	1342100218	/nfs/dbraw/zinc/10/02/18/1342100218.db2.gz	KUACYDHDSKOVBV-MRXNPFEDSA-N	0	3	341.455	3.289	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccc3ccn(C)c3c2)C1	ZINC001034006189	1342143563	/nfs/dbraw/zinc/14/35/63/1342143563.db2.gz	YDMHVXANTGBVPQ-GOSISDBHSA-N	0	3	325.456	3.291	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cnc3ccc(F)cc3c2)C1	ZINC001034007500	1342144911	/nfs/dbraw/zinc/14/49/11/1342144911.db2.gz	NVUQAADKRABZMG-SFHVURJKSA-N	0	3	341.430	3.486	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)C2CC(c3ccc(F)cc3)C2)C1	ZINC001034054178	1342195146	/nfs/dbraw/zinc/19/51/46/1342195146.db2.gz	FQNFNCQXQWHZKU-QLOJAFMTSA-N	0	3	342.458	3.265	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccc(N(C)CC)cc2)C1	ZINC001034057232	1342197350	/nfs/dbraw/zinc/19/73/50/1342197350.db2.gz	SRNBWENMPQRXIO-IBGZPJMESA-N	0	3	329.488	3.255	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2cscc2C(F)F)C1	ZINC001034211132	1342321631	/nfs/dbraw/zinc/32/16/31/1342321631.db2.gz	YESDOLKYRCQIDC-LBPRGKRZSA-N	0	3	326.412	3.293	20	30		EGEDHN
C=CCCN1CCCC[C@@H](NC(=O)c2scnc2C(F)(F)F)C1	ZINC001034244312	1342343599	/nfs/dbraw/zinc/34/35/99/1342343599.db2.gz	XQUZSKKJUDWOFM-LLVKDONJSA-N	0	3	347.406	3.322	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@@H]2CCCCN(CC(=C)C)C2)cc1	ZINC001034275677	1342366966	/nfs/dbraw/zinc/36/69/66/1342366966.db2.gz	IDUJGWKJUFDULD-GOSISDBHSA-N	0	3	328.456	3.412	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@@H]2CCCc3cccnc32)C1	ZINC001034366494	1342436713	/nfs/dbraw/zinc/43/67/13/1342436713.db2.gz	AITKSPRHHFFJGD-ZWKOTPCHSA-N	0	3	327.472	3.048	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc(F)c(F)c2F)C1	ZINC001034374069	1342442691	/nfs/dbraw/zinc/44/26/91/1342442691.db2.gz	XMYKWBYWQMJXAY-GFCCVEGCSA-N	0	3	326.362	3.264	20	30		EGEDHN
C=CCCN1CCCC[C@@H](NC(=O)c2cnc([C@H]3CCCO3)s2)C1	ZINC001034430814	1342492229	/nfs/dbraw/zinc/49/22/29/1342492229.db2.gz	AJXSZMRPCBYHSA-HUUCEWRRSA-N	0	3	349.500	3.155	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2ncoc2-c2cccs2)C1	ZINC001034447740	1342508306	/nfs/dbraw/zinc/50/83/06/1342508306.db2.gz	KOFFOLUEXDPXFH-AWEZNQCLSA-N	0	3	343.452	3.011	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2ccc(C(F)F)cc2F)C1	ZINC001034458520	1342514950	/nfs/dbraw/zinc/51/49/50/1342514950.db2.gz	NEUYHTOWRXRQMS-AWEZNQCLSA-N	0	3	338.373	3.371	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)c2cc(C)n(CC3CC3)c2C)C1	ZINC001034489304	1342547539	/nfs/dbraw/zinc/54/75/39/1342547539.db2.gz	BBXXUGSRKHSOTL-GOSISDBHSA-N	0	3	329.488	3.285	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)C[C@@H]2CCc3ccccc3C2)C1	ZINC001034501648	1342560097	/nfs/dbraw/zinc/56/00/97/1342560097.db2.gz	YIJRDUNYRBKJRS-YLJYHZDGSA-N	0	3	326.484	3.338	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2cc3c(s2)CC[C@H](C)C3)C1	ZINC001034522691	1342580807	/nfs/dbraw/zinc/58/08/07/1342580807.db2.gz	VTZDCFWRGACQKZ-DOTOQJQBSA-N	0	3	344.524	3.481	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@@H](C)c2cccc(OC)c2)C1	ZINC001034539675	1342599357	/nfs/dbraw/zinc/59/93/57/1342599357.db2.gz	BFCFRXBPPTWHCL-WMZOPIPTSA-N	0	3	330.472	3.346	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)C23CC(C(F)(F)F)(C2)C3)C1	ZINC001034542997	1342603530	/nfs/dbraw/zinc/60/35/30/1342603530.db2.gz	DSNVZEBHZQYDMS-IUDNXUCKSA-N	0	3	330.394	3.266	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)[C@@H](C)C2CCC2)CC1	ZINC001034670404	1342681226	/nfs/dbraw/zinc/68/12/26/1342681226.db2.gz	SRQQCODFPPWMQA-QEJZJMRPSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)[C@H]2CC23CCC3)CC1	ZINC001034746059	1342734164	/nfs/dbraw/zinc/73/41/64/1342734164.db2.gz	PSWKVCVSVYPZKS-MGPQQGTHSA-N	0	3	341.293	3.102	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)c2ccccc2F)s1	ZINC001034845640	1342798296	/nfs/dbraw/zinc/79/82/96/1342798296.db2.gz	PHNODOQHOKYPSD-CYBMUJFWSA-N	0	3	343.427	3.153	20	30		EGEDHN
CCC(CC)C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001034869170	1342813692	/nfs/dbraw/zinc/81/36/92/1342813692.db2.gz	NSPGUWGORKHWSI-QGZVFWFLSA-N	0	3	331.435	3.214	20	30		EGEDHN
C[C@@H](NC[C@H]1CCCN1C(=O)C#CC1CC1)c1ccc(F)cc1F	ZINC001034930072	1342841152	/nfs/dbraw/zinc/84/11/52/1342841152.db2.gz	HDKIORFHKXLTGX-CZUORRHYSA-N	0	3	332.394	3.020	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC[C@@H]2CNCc2ccccc2F)cc1	ZINC001035006918	1342872728	/nfs/dbraw/zinc/87/27/28/1342872728.db2.gz	QRTQZUGQMLTSKI-LJQANCHMSA-N	0	3	336.410	3.201	20	30		EGEDHN
CCC(C)(C)C(=O)N1CCC[C@@H]1CNCc1cc(C#N)ccc1OC	ZINC001035033008	1342887819	/nfs/dbraw/zinc/88/78/19/1342887819.db2.gz	MNTCNMBPGCGPKU-QGZVFWFLSA-N	0	3	343.471	3.084	20	30		EGEDHN
CC1(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)c(F)c2)CC=CC1	ZINC001035035334	1342888932	/nfs/dbraw/zinc/88/89/32/1342888932.db2.gz	JSFVSDXGUKTBIR-QGZVFWFLSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H]1CNCc1cccc(Cl)n1	ZINC001035035588	1342889796	/nfs/dbraw/zinc/88/97/96/1342889796.db2.gz	NZVONWFBJHCNEJ-QAPCUYQASA-N	0	3	335.879	3.418	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N1CCC[C@@H]1CNCc1ccccc1Cl	ZINC001035057817	1342900934	/nfs/dbraw/zinc/90/09/34/1342900934.db2.gz	WNVVUDJIPBPIEM-NUJGCVRESA-N	0	3	348.874	3.012	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)Cc2ccc(C)s2)C12CCC2	ZINC001078819576	1357099989	/nfs/dbraw/zinc/09/99/89/1357099989.db2.gz	POUGEGYSSRORNS-LSDHHAIUSA-N	0	3	338.904	3.369	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC2(CCN(Cc3cncs3)C2)CC1	ZINC001035211005	1343029525	/nfs/dbraw/zinc/02/95/25/1343029525.db2.gz	HTILAMJGMYTBBW-UHFFFAOYSA-N	0	3	333.501	3.170	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccn(C3CCCC3)n1)CC2	ZINC001035714793	1343148940	/nfs/dbraw/zinc/14/89/40/1343148940.db2.gz	CFMKPQNJYQBCJZ-UHFFFAOYSA-N	0	3	342.487	3.112	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1oc(C(F)F)cc1C)CC2	ZINC001035725786	1343154238	/nfs/dbraw/zinc/15/42/38/1343154238.db2.gz	DDPASLXOHYEZHG-UHFFFAOYSA-N	0	3	336.382	3.087	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc(C(C)C)nn1CC)CC2	ZINC001035738325	1343161920	/nfs/dbraw/zinc/16/19/20/1343161920.db2.gz	DKNKGMHXBJTNMJ-UHFFFAOYSA-N	0	3	344.503	3.141	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@H](C)c1c(F)cccc1F)CC2	ZINC001035750644	1343169224	/nfs/dbraw/zinc/16/92/24/1343169224.db2.gz	PNXNOWJKMMNHMX-OAHLLOKOSA-N	0	3	346.421	3.016	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)CCc1cccc(Cl)c1)CC2	ZINC001035760974	1343175263	/nfs/dbraw/zinc/17/52/63/1343175263.db2.gz	IYCCHFGUQYNAHO-UHFFFAOYSA-N	0	3	344.886	3.220	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cc3occc3s1)CC2	ZINC001035794190	1343202670	/nfs/dbraw/zinc/20/26/70/1343202670.db2.gz	HJFUWJRIDATDMQ-UHFFFAOYSA-N	0	3	328.437	3.056	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cc(F)cc(Cl)c1)CC2	ZINC001035806028	1343207508	/nfs/dbraw/zinc/20/75/08/1343207508.db2.gz	QRQPIROUQLXBQV-UHFFFAOYSA-N	0	3	334.822	3.040	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCC2CC2)CC[C@H]1NCc1cc(F)ccc1C#N	ZINC001035969214	1343292639	/nfs/dbraw/zinc/29/26/39/1343292639.db2.gz	UAOMXXZJYZUZIU-AUUYWEPGSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@H]1CN(C(=O)C2(C)CCCC2)CC[C@H]1NCc1ccccc1C#N	ZINC001036136757	1343322656	/nfs/dbraw/zinc/32/26/56/1343322656.db2.gz	SIOJJUPPKRHUJI-QFBILLFUSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@@H](NCc1cc(F)ccc1C#N)[C@@H]1CCCN(C(=O)C2CCC2)C1	ZINC001036340189	1343425826	/nfs/dbraw/zinc/42/58/26/1343425826.db2.gz	PRVCVBZUJKHBKJ-RHSMWYFYSA-N	0	3	343.446	3.214	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@@H](C)[C@H]1CNCc1ccc(C#N)s1	ZINC001036490368	1343513004	/nfs/dbraw/zinc/51/30/04/1343513004.db2.gz	GCZKVMWKNRKVFN-RHSMWYFYSA-N	0	3	333.501	3.383	20	30		EGEDHN
C[C@H]1CCCN(C(=O)C=C2CCC2)[C@H]1CNCc1ccc(C#N)s1	ZINC001036534613	1343541920	/nfs/dbraw/zinc/54/19/20/1343541920.db2.gz	IYRLINGSAXWYOO-KSSFIOAISA-N	0	3	343.496	3.447	20	30		EGEDHN
CCCC(=O)N1CC[C@@H]2[C@@H](CCN2CC#Cc2ccc(Cl)cc2)C1	ZINC001036624614	1343582726	/nfs/dbraw/zinc/58/27/26/1343582726.db2.gz	TXJXJIFHTPURPK-PKOBYXMFSA-N	0	3	344.886	3.414	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001036628488	1343586017	/nfs/dbraw/zinc/58/60/17/1343586017.db2.gz	BUNZQESUCVGGCT-RHSMWYFYSA-N	0	3	331.485	3.089	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2[C@@H](CCN2Cc2cc(C)no2)C1	ZINC001036793005	1343724384	/nfs/dbraw/zinc/72/43/84/1343724384.db2.gz	XQKNBYJLJHPULE-RDJZCZTQSA-N	0	3	331.460	3.008	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H]3[C@@H](CCN3Cc3conc3C)C2)CC1	ZINC001036810890	1343746310	/nfs/dbraw/zinc/74/63/10/1343746310.db2.gz	JONXIIPRVPESNP-PKOBYXMFSA-N	0	3	343.471	3.152	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]3[C@@H](CCN3Cc3cnc(C)s3)C2)C1	ZINC001036815335	1343752745	/nfs/dbraw/zinc/75/27/45/1343752745.db2.gz	CJRHUXWTPLZNQV-DOTOQJQBSA-N	0	3	345.512	3.231	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@H]2[C@@H](CCN2CC#Cc2ccc(F)cc2)C1	ZINC001036876179	1343815161	/nfs/dbraw/zinc/81/51/61/1343815161.db2.gz	LTHUXBZVTGRLQR-HKUYNNGSSA-N	0	3	342.458	3.146	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCC[C@H]2CNCc2cnc(C)o2)CC1	ZINC001037070188	1343963360	/nfs/dbraw/zinc/96/33/60/1343963360.db2.gz	NMDIFMSPUBRNBE-FUHWJXTLSA-N	0	3	331.460	3.104	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCC[C@H]2CNCc2nccs2)CC1	ZINC001037070652	1343963758	/nfs/dbraw/zinc/96/37/58/1343963758.db2.gz	VCMTWOMFDJIRQV-HOTGVXAUSA-N	0	3	333.501	3.264	20	30		EGEDHN
CC1(C(=O)N[C@H]2CCCC[C@H]2CNCc2ccccc2C#N)CC1	ZINC001037189697	1344028800	/nfs/dbraw/zinc/02/88/00/1344028800.db2.gz	DBYNCUMBIYKCDL-ROUUACIJSA-N	0	3	325.456	3.123	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](NCc2cc(C)no2)[C@H](CC)C1	ZINC001037907530	1344171114	/nfs/dbraw/zinc/17/11/14/1344171114.db2.gz	USHHZJJDLYWNII-WBVHZDCISA-N	0	3	333.476	3.302	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](NCc2cc(C)no2)[C@H](CC)C1	ZINC001037907524	1344171292	/nfs/dbraw/zinc/17/12/92/1344171292.db2.gz	USHHZJJDLYWNII-NVXWUHKLSA-N	0	3	333.476	3.302	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3nocc3C)[C@@H](CC)C2)CC1	ZINC001037917161	1344177404	/nfs/dbraw/zinc/17/74/04/1344177404.db2.gz	ATZWDLMKSNFZIU-WMZOPIPTSA-N	0	3	345.487	3.446	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1ncoc1-c1ccccc1	ZINC001038326641	1344381124	/nfs/dbraw/zinc/38/11/24/1344381124.db2.gz	HJUDGOWMNZXFMC-INIZCTEOSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@H]1CCN1CCC1CCCCC1	ZINC001038352447	1344393642	/nfs/dbraw/zinc/39/36/42/1344393642.db2.gz	HOBDGLHIGOIPKO-GOSISDBHSA-N	0	3	329.488	3.449	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCN2CCCc2ccc(C)cc2)cc1	ZINC001038588406	1344496207	/nfs/dbraw/zinc/49/62/07/1344496207.db2.gz	IGPNLXFRMWDNBE-JOCHJYFZSA-N	0	3	346.474	3.413	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H]2CC=CCC2)CC[C@H]1c1ccc(F)cc1	ZINC001079148588	1357196858	/nfs/dbraw/zinc/19/68/58/1357196858.db2.gz	BGAGGGORXJGRAW-YSIASYRMSA-N	0	3	340.442	3.089	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc(C)cs2)C1	ZINC001039200773	1344910335	/nfs/dbraw/zinc/91/03/35/1344910335.db2.gz	RFYZPBBDGSEYTR-IRXDYDNUSA-N	0	3	330.497	3.396	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cccc(F)c2)C1	ZINC001039207282	1344918717	/nfs/dbraw/zinc/91/87/17/1344918717.db2.gz	ZBOJARNLAZVILU-PKOBYXMFSA-N	0	3	328.431	3.166	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc(Cl)ccc2F)C1	ZINC001039213868	1344929012	/nfs/dbraw/zinc/92/90/12/1344929012.db2.gz	BQLOVNHBBHTATD-KBXCAEBGSA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc3ccccc3n2C)C1	ZINC001039224530	1344942103	/nfs/dbraw/zinc/94/21/03/1344942103.db2.gz	HDMADCNZCLKHKO-UYAOXDASSA-N	0	3	349.478	3.128	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccn(CC)c2C)C1	ZINC001039226675	1344945784	/nfs/dbraw/zinc/94/57/84/1344945784.db2.gz	YUXUAPTXBZGEIN-AZUAARDMSA-N	0	3	341.499	3.156	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2occ3c2CCC3)C1	ZINC001039229920	1344949378	/nfs/dbraw/zinc/94/93/78/1344949378.db2.gz	OZXDLJKJYKSKQL-QFBILLFUSA-N	0	3	340.467	3.108	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2occc2Cl)C1	ZINC001039233065	1344952351	/nfs/dbraw/zinc/95/23/51/1344952351.db2.gz	ZREKUNGRUJYQSF-GDBMZVCRSA-N	0	3	334.847	3.273	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc(C(C)C)no2)C1	ZINC001039234418	1344954984	/nfs/dbraw/zinc/95/49/84/1344954984.db2.gz	JJMLLCYTIWHMGB-WMZOPIPTSA-N	0	3	343.471	3.138	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(C(C)C)cn2)C1	ZINC001039235348	1344956207	/nfs/dbraw/zinc/95/62/07/1344956207.db2.gz	WRTPEKVNAYOCEQ-QUCCMNQESA-N	0	3	339.483	3.155	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(C(C)C)cn2)C1	ZINC001039235347	1344956647	/nfs/dbraw/zinc/95/66/47/1344956647.db2.gz	WRTPEKVNAYOCEQ-ICSRJNTNSA-N	0	3	339.483	3.155	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cnc3ccccc3c2)C1	ZINC001039238270	1344961292	/nfs/dbraw/zinc/96/12/92/1344961292.db2.gz	NAYZFGPEOHPLRX-WIYYLYMNSA-N	0	3	347.462	3.185	20	30		EGEDHN
Cc1ccccc1CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(C#N)[nH]1	ZINC001039357613	1345027276	/nfs/dbraw/zinc/02/72/76/1345027276.db2.gz	IDZKHVFXOFWZHV-MOPGFXCFSA-N	0	3	348.450	3.074	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(N(C)C)cc1F	ZINC001039386194	1345039091	/nfs/dbraw/zinc/03/90/91/1345039091.db2.gz	BPFZCFDJRRJJMR-WBVHZDCISA-N	0	3	345.462	3.147	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)CCc1ccc2[nH]ccc2c1	ZINC001039406336	1345051165	/nfs/dbraw/zinc/05/11/65/1345051165.db2.gz	QBDNKLBZBHQVEM-MOPGFXCFSA-N	0	3	337.467	3.352	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cnc(C)nc1C(C)C	ZINC001039447722	1345072282	/nfs/dbraw/zinc/07/22/82/1345072282.db2.gz	GVUZVQRLGTYGRC-SJORKVTESA-N	0	3	342.487	3.163	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(C(C)C)[nH]c1=O	ZINC001039449822	1345073671	/nfs/dbraw/zinc/07/36/71/1345073671.db2.gz	DVGZYSQYSSVGJY-CVEARBPZSA-N	0	3	343.471	3.166	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1csc(C(C)(C)C)n1	ZINC001039452361	1345075581	/nfs/dbraw/zinc/07/55/81/1345075581.db2.gz	SHHPUTSEBWYMHS-CABCVRRESA-N	0	3	345.512	3.143	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(OC)cc1Cl	ZINC001039453640	1345076056	/nfs/dbraw/zinc/07/60/56/1345076056.db2.gz	KLHSOAZPXIXZJV-CABCVRRESA-N	0	3	346.858	3.051	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2[nH]c(C)nc2c1	ZINC001039455675	1345076664	/nfs/dbraw/zinc/07/66/64/1345076664.db2.gz	KKJFFLIFZYICGI-SJORKVTESA-N	0	3	338.455	3.126	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(N(C)C)c(F)c1	ZINC001039474814	1345089698	/nfs/dbraw/zinc/08/96/98/1345089698.db2.gz	DCEAKIPSXSDEQR-SJORKVTESA-N	0	3	345.462	3.147	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC1CCC(C)(C)CC1	ZINC001039529999	1345132077	/nfs/dbraw/zinc/13/20/77/1345132077.db2.gz	FTRZCGCZGVJKNG-RYQLBKOJSA-N	0	3	331.504	3.428	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H]3CCC[C@@H](C2)N3CC[C@H]2CCCO2)CC1	ZINC001039891274	1345234428	/nfs/dbraw/zinc/23/44/28/1345234428.db2.gz	JNTKQVWLRWRWTN-HSALFYBXSA-N	0	3	346.515	3.367	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@H]3CCCC4(CC4)C3)C2)C1	ZINC001040209094	1345375622	/nfs/dbraw/zinc/37/56/22/1345375622.db2.gz	NXXXRXLRLZLTCE-GHTZIAJQSA-N	0	3	328.500	3.295	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cccc(F)c3C)C2)C1	ZINC001040220846	1345380410	/nfs/dbraw/zinc/38/04/10/1345380410.db2.gz	MSLSTKPTQZKJEZ-FQEVSTJZSA-N	0	3	328.431	3.086	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3ccc4nc(C)oc4c3)C2)C1	ZINC001040252677	1345396115	/nfs/dbraw/zinc/39/61/15/1345396115.db2.gz	IDLVFUXZSSZNTO-HXUWFJFHSA-N	0	3	339.439	3.250	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cc(C)c(F)cc3F)C2)C1	ZINC001040255635	1345397252	/nfs/dbraw/zinc/39/72/52/1345397252.db2.gz	VNGKYQIFGCDXPM-IBGZPJMESA-N	0	3	334.410	3.387	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@H]3CCC=CCCC3)C2)C1	ZINC001040256900	1345397814	/nfs/dbraw/zinc/39/78/14/1345397814.db2.gz	BEFJLAPJPSQDEJ-PZJWPPBQSA-N	0	3	328.500	3.461	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cc(C)n([C@H](C)CC)n3)C2)C1	ZINC001040271057	1345405846	/nfs/dbraw/zinc/40/58/46/1345405846.db2.gz	QEBNFFMSIARFHX-UZLBHIALSA-N	0	3	344.503	3.277	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(C)c(F)c3)C2)C1	ZINC001040282404	1345410362	/nfs/dbraw/zinc/41/03/62/1345410362.db2.gz	IPNJXPOWBLTOBH-HXUWFJFHSA-N	0	3	328.431	3.086	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cc(COC)cs3)C2)C1	ZINC001040284576	1345412132	/nfs/dbraw/zinc/41/21/32/1345412132.db2.gz	WPZHZDSGHZFKOW-SFHVURJKSA-N	0	3	334.485	3.009	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(F)c(Cl)c3)C2)C1	ZINC001040359249	1345453285	/nfs/dbraw/zinc/45/32/85/1345453285.db2.gz	CUZBGYXYCKDIDQ-LJQANCHMSA-N	0	3	348.849	3.431	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cc(F)ccc3Cl)C2)C1	ZINC001040417591	1345486234	/nfs/dbraw/zinc/48/62/34/1345486234.db2.gz	GSIKWZRPTAVLLK-IBGZPJMESA-N	0	3	348.849	3.431	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@@H]3C[C@H]3c3ccc(C)s3)C2)C1	ZINC001040444891	1345503645	/nfs/dbraw/zinc/50/36/45/1345503645.db2.gz	XGHZVWGCNQVTRL-MBOZVWFJSA-N	0	3	342.508	3.108	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)C[C@@H]3CCc4ccccc43)C2)C1	ZINC001040461531	1345509819	/nfs/dbraw/zinc/50/98/19/1345509819.db2.gz	WFOQMVHFTHTFSE-UGKGYDQZSA-N	0	3	336.479	3.054	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3coc(C4CCCC4)n3)C2)C1	ZINC001040474522	1345512084	/nfs/dbraw/zinc/51/20/84/1345512084.db2.gz	MYUGLLVWEVIWQC-HXUWFJFHSA-N	0	3	343.471	3.446	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)C3(C4CCCCC4)CC3)C2)C1	ZINC001040509209	1345526450	/nfs/dbraw/zinc/52/64/50/1345526450.db2.gz	FNTGASHLQSOUPA-FQEVSTJZSA-N	0	3	328.500	3.295	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)C34CCC(CC3)CC4)C2)C1	ZINC001040541196	1345537950	/nfs/dbraw/zinc/53/79/50/1345537950.db2.gz	YXQAYAJFFLDJCU-CKHPTIKVSA-N	0	3	328.500	3.295	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cccc4cc[nH]c43)C2)CC1	ZINC001040862083	1345589019	/nfs/dbraw/zinc/58/90/19/1345589019.db2.gz	BPJFTJMBBZZMLH-UHFFFAOYSA-N	0	3	335.451	3.119	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccc4cc[nH]c4c3)C2)CC1	ZINC001040868928	1345590636	/nfs/dbraw/zinc/59/06/36/1345590636.db2.gz	BVXOMUULQOYVRH-UHFFFAOYSA-N	0	3	335.451	3.119	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)C(C)(C)c3ccccc3F)C2)CC1	ZINC001040882891	1345594091	/nfs/dbraw/zinc/59/40/91/1345594091.db2.gz	MYSWYDIZZXYJNG-UHFFFAOYSA-N	0	3	342.458	3.051	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@H]3C[C@@H]3C3CCCC3)C2)CC1	ZINC001040900173	1345595803	/nfs/dbraw/zinc/59/58/03/1345595803.db2.gz	SIEMYKKAKMCFJR-MOPGFXCFSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@@H](C)c3ccc(C)s3)C2)CC1	ZINC001040910807	1345598470	/nfs/dbraw/zinc/59/84/70/1345598470.db2.gz	SUZYRXYXMHWNQG-KRWDZBQOSA-N	0	3	344.524	3.498	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)C3CCC(C4CC4)CC3)C2)CC1	ZINC001040925994	1345602236	/nfs/dbraw/zinc/60/22/36/1345602236.db2.gz	ZKKAMYOCWDKKLI-UHFFFAOYSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccccc3OCC)C2)CC1	ZINC001040928838	1345602645	/nfs/dbraw/zinc/60/26/45/1345602645.db2.gz	ANPPXOPWYKSIJE-UHFFFAOYSA-N	0	3	340.467	3.037	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)C[C@@H](C)c3ccc(F)cc3)C2)CC1	ZINC001040946949	1345607177	/nfs/dbraw/zinc/60/71/77/1345607177.db2.gz	KPHDJLCFKFSAIS-QGZVFWFLSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3ccccc3CC(C)(C)C)C2)C1	ZINC001041389385	1345714459	/nfs/dbraw/zinc/71/44/59/1345714459.db2.gz	KHSSVEQFCOVCSP-QFIPXVFZSA-N	0	3	338.495	3.446	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)[C@@H]3CC[C@@H](c4ccccc4)C3)C2)C1	ZINC001041401752	1345719018	/nfs/dbraw/zinc/71/90/18/1345719018.db2.gz	DSLIXKQJNHKNIH-KCZVDYSFSA-N	0	3	336.479	3.128	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)C3(C)CCC(F)(F)CC3)C2)C1	ZINC001041414815	1345723041	/nfs/dbraw/zinc/72/30/41/1345723041.db2.gz	MIBBDAMVAWPQPN-GOSISDBHSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccc(-c4ccco4)o3)C2)C1	ZINC001041465125	1345735872	/nfs/dbraw/zinc/73/58/72/1345735872.db2.gz	WTXKUWUMILYXMF-FQEVSTJZSA-N	0	3	338.407	3.101	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccc(C)c(Cl)c3F)C2)C1	ZINC001041503399	1345746027	/nfs/dbraw/zinc/74/60/27/1345746027.db2.gz	PCSXPOCMOZMKQJ-IBGZPJMESA-N	0	3	348.849	3.349	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3coc4cc(C)c(C)cc43)C2)C1	ZINC001041510588	1345747442	/nfs/dbraw/zinc/74/74/42/1345747442.db2.gz	ZBWCMNLAYURRRT-NRFANRHFSA-N	0	3	336.435	3.221	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccc(C)nc3C(C)C)C2)C1	ZINC001041517824	1345750406	/nfs/dbraw/zinc/75/04/06/1345750406.db2.gz	KNDQYGYLCBNNAF-NRFANRHFSA-N	0	3	339.483	3.075	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3cc(C)c(C)cc3Cl)C2)C1	ZINC001041540303	1345756507	/nfs/dbraw/zinc/75/65/07/1345756507.db2.gz	MEGRQTADLMUBEO-IBGZPJMESA-N	0	3	330.859	3.128	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@]2(CCN(Cc3cncc(C)c3)C2)C1	ZINC001041544644	1345758962	/nfs/dbraw/zinc/75/89/62/1345758962.db2.gz	OZSMDVCETTYLGW-FQEVSTJZSA-N	0	3	327.472	3.027	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)[C@@H](C)c3ccc(Cl)cc3)C2)C1	ZINC001041633862	1345804319	/nfs/dbraw/zinc/80/43/19/1345804319.db2.gz	ZSHNSNGXKSZONM-HNAYVOBHSA-N	0	3	330.859	3.001	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@]3(CCN(Cc4c(C)noc4C)C3)C2)C1	ZINC001041652619	1345811038	/nfs/dbraw/zinc/81/10/38/1345811038.db2.gz	LWVOZKVJMCKINO-HXUWFJFHSA-N	0	3	343.471	3.072	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001041698672	1345822640	/nfs/dbraw/zinc/82/26/40/1345822640.db2.gz	WFYOUHTWZQEBTG-SBHAEUEKSA-N	0	3	337.467	3.029	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cc(C(CC)CC)no3)C2)C1	ZINC001041728607	1345833645	/nfs/dbraw/zinc/83/36/45/1345833645.db2.gz	LGSIMKUJEUOHCZ-HXUWFJFHSA-N	0	3	343.471	3.140	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)C[C@@H](C)c3ccccc3F)C2)C1	ZINC001041741646	1345838215	/nfs/dbraw/zinc/83/82/15/1345838215.db2.gz	RLDSKVLWTBJJLS-UTKZUKDTSA-N	0	3	342.458	3.267	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)[C@H]3CC[C@H](C(C)C)CC3)C2)C1	ZINC001041759947	1345841260	/nfs/dbraw/zinc/84/12/60/1345841260.db2.gz	ZCNPLPOQUSIYGY-SFHLNBCPSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)[C@H](C)c3ccc(Cl)s3)C2)C1	ZINC001041779894	1345847041	/nfs/dbraw/zinc/84/70/41/1345847041.db2.gz	SCWUUSFJFOIEGW-CXAGYDPISA-N	0	3	336.888	3.063	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)[C@@H](C)c3ccc(Cl)s3)C2)C1	ZINC001041779897	1345847269	/nfs/dbraw/zinc/84/72/69/1345847269.db2.gz	SCWUUSFJFOIEGW-SUMWQHHRSA-N	0	3	336.888	3.063	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3[nH]ccc3-c3ccccc3)C2)C1	ZINC001041782561	1345848948	/nfs/dbraw/zinc/84/89/48/1345848948.db2.gz	AKPDQOUNKRDOFF-JOCHJYFZSA-N	0	3	347.462	3.243	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3c[nH]cc3-c3ccccc3)C2)C1	ZINC001041831506	1345866708	/nfs/dbraw/zinc/86/67/08/1345866708.db2.gz	NNOPUTNCOQGDID-JOCHJYFZSA-N	0	3	347.462	3.243	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3CCN(C(=O)C=C4CCC4)C[C@@H]32)cc1	ZINC001042006823	1345922563	/nfs/dbraw/zinc/92/25/63/1345922563.db2.gz	QRGQZOANWVEXKY-PMACEKPBSA-N	0	3	335.451	3.091	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3c(C)noc3CCC)C[C@@H]21	ZINC001042053659	1345932182	/nfs/dbraw/zinc/93/21/82/1345932182.db2.gz	CQDIEOZIDJFXID-HOTGVXAUSA-N	0	3	331.460	3.048	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccn(C4CCCCC4)n3)C[C@@H]21	ZINC001042063421	1345933532	/nfs/dbraw/zinc/93/35/32/1345933532.db2.gz	WMMMGLATTDCRCR-LPHOPBHVSA-N	0	3	342.487	3.111	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(-c4ccncc4)o3)C[C@@H]21	ZINC001042094404	1345942064	/nfs/dbraw/zinc/94/20/64/1345942064.db2.gz	RNGUUSRJSGISTG-RDJZCZTQSA-N	0	3	337.423	3.064	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3cc4ccncc4s3)C[C@@H]21	ZINC001042096434	1345943038	/nfs/dbraw/zinc/94/30/38/1345943038.db2.gz	YCRPTDLONVGCKY-ZBFHGGJFSA-N	0	3	341.480	3.409	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3coc4cc(F)ccc34)C[C@@H]21	ZINC001042124252	1345950178	/nfs/dbraw/zinc/95/01/78/1345950178.db2.gz	DKLBLKBJETVHCT-GUYCJALGSA-N	0	3	328.387	3.294	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc4c([nH]3)c(F)ccc4C)C[C@@H]21	ZINC001042123609	1345950233	/nfs/dbraw/zinc/95/02/33/1345950233.db2.gz	UFPYEKBIXCVTCH-KDOFPFPSSA-N	0	3	341.430	3.338	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)C3(c4ccccc4)CCC3)C[C@H]21	ZINC001042142550	1345955139	/nfs/dbraw/zinc/95/51/39/1345955139.db2.gz	OVUJAZVNHAZYHE-AZUAARDMSA-N	0	3	336.479	3.054	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)Cc3ccc(C(F)F)cc3)C[C@H]21	ZINC001042148352	1345957102	/nfs/dbraw/zinc/95/71/02/1345957102.db2.gz	IZYVGUNSULNWMO-SJLPKXTDSA-N	0	3	346.421	3.113	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc4cc(F)ccc4[nH]3)C[C@@H]21	ZINC001042175942	1345967305	/nfs/dbraw/zinc/96/73/05/1345967305.db2.gz	GXIXGVRZSSYOBX-UGSOOPFHSA-N	0	3	327.403	3.029	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3nsc4ccc(C)cc43)C[C@@H]21	ZINC001042183294	1345971106	/nfs/dbraw/zinc/97/11/06/1345971106.db2.gz	IUBJCZMSSGRNIA-ZBFHGGJFSA-N	0	3	341.480	3.327	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc(Cl)cc3C)C[C@H]21	ZINC001042216698	1345990052	/nfs/dbraw/zinc/99/00/52/1345990052.db2.gz	QTLRCKOXKDIPSM-CRAIPNDOSA-N	0	3	330.859	3.208	20	30		EGEDHN
CCC1(C(=O)N2CC[C@H]3CCN(Cc4ccc(C#N)cc4)[C@H]3C2)CC1	ZINC001042220327	1345991237	/nfs/dbraw/zinc/99/12/37/1345991237.db2.gz	BOKSBYZFAQLFQR-MOPGFXCFSA-N	0	3	337.467	3.171	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccccc3C3(C)CC3)C[C@H]21	ZINC001042232429	1345998512	/nfs/dbraw/zinc/99/85/12/1345998512.db2.gz	LUQHCEBTFTZBHD-FXAWDEMLSA-N	0	3	336.479	3.298	20	30		EGEDHN
C#CCN1CC[C@H]2CCN(C(=O)c3ccc(F)c4ccccc34)C[C@@H]21	ZINC001042238882	1345999884	/nfs/dbraw/zinc/99/98/84/1345999884.db2.gz	AEHVOLFILSTDGV-YWZLYKJASA-N	0	3	336.410	3.149	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(C(C)C)nc3CC)C[C@H]21	ZINC001042237968	1345999941	/nfs/dbraw/zinc/99/99/41/1345999941.db2.gz	NZSRTFSVUJTETH-OXQOHEQNSA-N	0	3	341.499	3.490	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)Cc3csc(C(C)(C)C)n3)C[C@H]21	ZINC001042265194	1346010929	/nfs/dbraw/zinc/01/09/29/1346010929.db2.gz	DEDFHCFSOGNVTG-GOEBONIOSA-N	0	3	347.528	3.092	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)Cc3csc(C(C)(C)C)n3)C[C@@H]21	ZINC001042265195	1346012066	/nfs/dbraw/zinc/01/20/66/1346012066.db2.gz	DEDFHCFSOGNVTG-HOCLYGCPSA-N	0	3	347.528	3.092	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3cc4cccnc4s3)C[C@H]21	ZINC001042299902	1346023605	/nfs/dbraw/zinc/02/36/05/1346023605.db2.gz	SBLQLHTZKVVOBN-GDBMZVCRSA-N	0	3	341.480	3.409	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(C)n(CC4CC4)c3C)C[C@@H]21	ZINC001042315796	1346030211	/nfs/dbraw/zinc/03/02/11/1346030211.db2.gz	CNKRLHISOSLLCT-QUCCMNQESA-N	0	3	341.499	3.237	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccsc3C(F)(F)F)C[C@H]21	ZINC001042326000	1346035285	/nfs/dbraw/zinc/03/52/85/1346035285.db2.gz	KWFIZZHRRMCDMS-WCQYABFASA-N	0	3	344.402	3.489	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3csc4c3CCCC4)C[C@H]21	ZINC001042346294	1346048731	/nfs/dbraw/zinc/04/87/31/1346048731.db2.gz	RKUWFLQBJKBTND-WMLDXEAASA-N	0	3	330.497	3.349	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(-c4ccccc4)[nH]3)C[C@@H]21	ZINC001042375665	1346063365	/nfs/dbraw/zinc/06/33/65/1346063365.db2.gz	ZOCBYFNOJGMCJM-PXNSSMCTSA-N	0	3	335.451	3.404	20	30		EGEDHN
C[C@H]1C[C@@H](NCc2cc(F)ccc2C#N)CCN1C(=O)CCC1CC1	ZINC001044511161	1346353254	/nfs/dbraw/zinc/35/32/54/1346353254.db2.gz	UZKSBBDOFKTRFJ-LIRRHRJNSA-N	0	3	343.446	3.357	20	30		EGEDHN
Cc1ccncc1C(=O)N1CC[C@H](NCc2ccccc2C#N)C[C@H]1C	ZINC001044516962	1346354580	/nfs/dbraw/zinc/35/45/80/1346354580.db2.gz	GESOGMBTOGPBMM-APWZRJJASA-N	0	3	348.450	3.045	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2cc(F)ccc2C#N)CCN1C(=O)/C=C\C1CC1	ZINC001044523457	1346356061	/nfs/dbraw/zinc/35/60/61/1346356061.db2.gz	ORQPVZSOVLPYLU-RGACPQENSA-N	0	3	341.430	3.133	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@@H](NCc2cc(F)ccc2C#N)C[C@H]1C	ZINC001044541651	1346364450	/nfs/dbraw/zinc/36/44/50/1346364450.db2.gz	DLWLAEWRESPVCM-CXAGYDPISA-N	0	3	347.409	3.430	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@H](NCc2ccccc2C#N)C[C@H]1C	ZINC001044541399	1346364468	/nfs/dbraw/zinc/36/44/68/1346364468.db2.gz	CLCAGPFFAAUXHQ-PBHICJAKSA-N	0	3	329.419	3.291	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3ccn(CC)n3)C[C@@H]2C)CC1	ZINC001044729868	1346414356	/nfs/dbraw/zinc/41/43/56/1346414356.db2.gz	KZOVKLFAXWEDCE-WMZOPIPTSA-N	0	3	344.503	3.119	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3ccn(CC)n3)C[C@@H]2C)CC1	ZINC001044729866	1346414470	/nfs/dbraw/zinc/41/44/70/1346414470.db2.gz	KZOVKLFAXWEDCE-FUHWJXTLSA-N	0	3	344.503	3.119	20	30		EGEDHN
CC1(C)CC[C@H]1C(=O)N1CCC[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC001045160710	1346510647	/nfs/dbraw/zinc/51/06/47/1346510647.db2.gz	SLCFFPXAMYWNPQ-IRXDYDNUSA-N	0	3	343.446	3.214	20	30		EGEDHN
CCC(C)(C)C(=O)N1CCC[C@H]1CNCc1ccc(C#N)cc1F	ZINC001045178922	1346516192	/nfs/dbraw/zinc/51/61/92/1346516192.db2.gz	RSEOIFOUAVKYSS-INIZCTEOSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H]1CNCc1ccc(C#N)s1	ZINC001045186104	1346522045	/nfs/dbraw/zinc/52/20/45/1346522045.db2.gz	YHQMASFUSMVIMO-KSSFIOAISA-N	0	3	331.485	3.303	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)[C@@H]2CCc3c2cccc3Cl)CC1	ZINC001045505655	1346612384	/nfs/dbraw/zinc/61/23/84/1346612384.db2.gz	POZVTHZGAXFTBS-QGZVFWFLSA-N	0	3	344.886	3.364	20	30		EGEDHN
CC[C@@]1(C)C[C@H]1C(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045607262	1346644339	/nfs/dbraw/zinc/64/43/39/1346644339.db2.gz	SECCLGMDPBASCK-ICSRJNTNSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1cccc(C#N)c1	ZINC001045717336	1346678399	/nfs/dbraw/zinc/67/83/99/1346678399.db2.gz	ICCSYJIJYPKPAQ-LZQZEXGQSA-N	0	3	325.456	3.170	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC[C@H]2CC[C@@H](C1)N2CCc1ccccc1Cl	ZINC001045734340	1346683124	/nfs/dbraw/zinc/68/31/24/1346683124.db2.gz	CDTKZQKAOCQHQO-OIISXLGYSA-N	0	3	345.874	3.107	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCCC[C@@]2(CCN(Cc3ccc(F)cc3)C2)C1	ZINC001045925921	1346762328	/nfs/dbraw/zinc/76/23/28/1346762328.db2.gz	XNGKFDWXIWPJNO-JXFKEZNVSA-N	0	3	343.446	3.190	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc(C)cs1)C2	ZINC001045937173	1346773594	/nfs/dbraw/zinc/77/35/94/1346773594.db2.gz	VYDFEWYYVKWFBT-LJQANCHMSA-N	0	3	330.497	3.398	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)Cc1c(C)cccc1C)C2	ZINC001045941598	1346777103	/nfs/dbraw/zinc/77/71/03/1346777103.db2.gz	LKMMRNUOVCHMRP-JOCHJYFZSA-N	0	3	338.495	3.184	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H]1CCCC3(CC3)C1)C2	ZINC001045942599	1346778740	/nfs/dbraw/zinc/77/87/40/1346778740.db2.gz	VTUFHPXAZGEIHR-WIYYLYMNSA-N	0	3	328.500	3.295	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@H]1CCCC13CC3)C2	ZINC001045946976	1346782563	/nfs/dbraw/zinc/78/25/63/1346782563.db2.gz	GIFAGMXVLUSTCX-QUCCMNQESA-N	0	3	328.500	3.295	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc(C(C)C)on1)C2	ZINC001045954672	1346789417	/nfs/dbraw/zinc/78/94/17/1346789417.db2.gz	GNWNELGGDCDHTH-HXUWFJFHSA-N	0	3	343.471	3.140	20	30		EGEDHN
C=C1CCC(C(=O)N2CCCC[C@]3(CCN(CC#CC)C3)C2)CC1	ZINC001045963065	1346798551	/nfs/dbraw/zinc/79/85/51/1346798551.db2.gz	WMFXTPXBZIVZAG-OAQYLSRUSA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc3c(C)cccn3c1)C2	ZINC001045980367	1346817424	/nfs/dbraw/zinc/81/74/24/1346817424.db2.gz	WODMRFKHABFRHJ-JOCHJYFZSA-N	0	3	349.478	3.199	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cccc3c1CCC3)C2	ZINC001045986275	1346827731	/nfs/dbraw/zinc/82/77/31/1346827731.db2.gz	MWIUDRRERYGVDW-JOCHJYFZSA-N	0	3	336.479	3.127	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H](C)n1c(C)ccc1C)C2	ZINC001045986640	1346828250	/nfs/dbraw/zinc/82/82/50/1346828250.db2.gz	WSEXHZKXQWMOKP-TZIWHRDSSA-N	0	3	341.499	3.004	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc(CF)cc1)C2	ZINC001045986868	1346828497	/nfs/dbraw/zinc/82/84/97/1346828497.db2.gz	CYBHLQFLFSGOHY-HXUWFJFHSA-N	0	3	328.431	3.108	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)[C@@H]2C[C@H]2c2ccc(N(C)C)cc2)C1	ZINC001046507580	1346998443	/nfs/dbraw/zinc/99/84/43/1346998443.db2.gz	LZEXQCYBAXRPDE-ZVDOUQERSA-N	0	3	341.499	3.013	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2cnn(C3CCCC3)c2C)C1	ZINC001046756973	1347086796	/nfs/dbraw/zinc/08/67/96/1347086796.db2.gz	BVDLHLWSAGTEJO-IBGZPJMESA-N	0	3	330.476	3.077	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2cc(F)c(F)cc2Cl)C1	ZINC001046816315	1347116414	/nfs/dbraw/zinc/11/64/14/1347116414.db2.gz	GTSZSQIRVOEYHE-INIZCTEOSA-N	0	3	328.790	3.389	20	30		EGEDHN
CCC(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1cccc(Cl)c1)C2	ZINC001047001259	1347181294	/nfs/dbraw/zinc/18/12/94/1347181294.db2.gz	NGTXRVZFUITJQM-SZMVWBNQSA-N	0	3	330.859	3.071	20	30		EGEDHN
O=C(N[C@@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1ccccc1)C2)[C@H]1C[C@H]2C[C@H]2C1	ZINC001047131898	1347215270	/nfs/dbraw/zinc/21/52/70/1347215270.db2.gz	BQZJNJHWSHMXQT-IBJQYKMBSA-N	0	3	348.490	3.053	20	30		EGEDHN
CC(C)(C)C(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(Cc1ccc(C#N)s1)C2	ZINC001047187606	1347235436	/nfs/dbraw/zinc/23/54/36/1347235436.db2.gz	DYBHMSDXTNQDMS-MJBXVCDLSA-N	0	3	331.485	3.135	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)/C=C/c3ccco3)C2)CC1	ZINC001047219046	1347250724	/nfs/dbraw/zinc/25/07/24/1347250724.db2.gz	IYFXMLTXPKLCMM-CSHXORCISA-N	0	3	340.467	3.267	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)C[C@H]3C=CCC3)C2)CC1	ZINC001047224014	1347254287	/nfs/dbraw/zinc/25/42/87/1347254287.db2.gz	UKTZQCXBBXVPNN-ICSRJNTNSA-N	0	3	328.500	3.317	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@]3(C)CC=CCC3)C2)CC1	ZINC001047240110	1347266504	/nfs/dbraw/zinc/26/65/04/1347266504.db2.gz	ZZFURDYPUKMYBC-TZIWHRDSSA-N	0	3	328.500	3.317	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)[C@@H]3CCC3(F)F)C2)CC1	ZINC001047242073	1347268304	/nfs/dbraw/zinc/26/83/04/1347268304.db2.gz	AYPCHPMTXCKQCZ-IRXDYDNUSA-N	0	3	338.442	3.006	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3ccc(F)c(F)c3)C2)CC1	ZINC001047244391	1347269663	/nfs/dbraw/zinc/26/96/63/1347269663.db2.gz	RFGYPFWHINUGLU-KRWDZBQOSA-N	0	3	346.421	3.162	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3ccoc3C3CC3)C2)CC1	ZINC001047252468	1347276885	/nfs/dbraw/zinc/27/68/85/1347276885.db2.gz	CSLKHNDDEYXREJ-GOSISDBHSA-N	0	3	340.467	3.354	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@H](C)Cc3ccco3)C2)CC1	ZINC001047257732	1347280631	/nfs/dbraw/zinc/28/06/31/1347280631.db2.gz	PNOLTEAVMYHKQU-IEBWSBKVSA-N	0	3	342.483	3.042	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@@H]3CC34CCCC4)C2)CC1	ZINC001047262504	1347283782	/nfs/dbraw/zinc/28/37/82/1347283782.db2.gz	QXRSVDZYAMBTGQ-OALUTQOASA-N	0	3	328.500	3.151	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)C2CCCCC2)C1	ZINC001047688957	1347331956	/nfs/dbraw/zinc/33/19/56/1347331956.db2.gz	VHUAYNYQDJQVOH-OXQOHEQNSA-N	0	3	339.483	3.465	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@H]([C@@H](C)NCc3ccccc3C#N)C2)o1	ZINC001047697410	1347337651	/nfs/dbraw/zinc/33/76/51/1347337651.db2.gz	GSUCPGHSHPVNRR-QAPCUYQASA-N	0	3	337.423	3.100	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)CCC2CC2)C1	ZINC001047766269	1347364831	/nfs/dbraw/zinc/36/48/31/1347364831.db2.gz	NUPUMTUGPYQIEQ-KXBFYZLASA-N	0	3	325.456	3.075	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]([C@H](C)NCc2ncc(C)s2)C1	ZINC001047928869	1347413245	/nfs/dbraw/zinc/41/32/45/1347413245.db2.gz	OVOKTADZEZTFFC-GJZGRUSLSA-N	0	3	335.517	3.380	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]([C@H](C)NCc2nc3ccccc3o2)C1	ZINC001047933262	1347414787	/nfs/dbraw/zinc/41/47/87/1347414787.db2.gz	WWKVAXGYKPGSTD-GJZGRUSLSA-N	0	3	341.455	3.367	20	30		EGEDHN
C[C@H](NCc1cc(F)ccc1C#N)[C@@H]1CCN(C(=O)C(C)(C)C)C1	ZINC001048039132	1347447726	/nfs/dbraw/zinc/44/77/26/1347447726.db2.gz	ZPZCNQCDCKEUFE-DZGCQCFKSA-N	0	3	331.435	3.070	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](CNCc2csc(CCC)n2)[C@H](C)C1	ZINC001048344655	1347524971	/nfs/dbraw/zinc/52/49/71/1347524971.db2.gz	QTOPBSIJPRQPJQ-HUUCEWRRSA-N	0	3	349.544	3.492	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)[C@@H]2CC=CCC2)CC1	ZINC001048625257	1347623588	/nfs/dbraw/zinc/62/35/88/1347623588.db2.gz	RYVMZQAXRLRMNS-GOSISDBHSA-N	0	3	339.483	3.417	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CN(C(=O)[C@H]4CCCC45CC5)C[C@@H]3C2)c1	ZINC001048891250	1347677535	/nfs/dbraw/zinc/67/75/35/1347677535.db2.gz	QUHYFROUTGVCNU-HSALFYBXSA-N	0	3	349.478	3.029	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CN(C(=O)C[C@@H]4CC=CCC4)C[C@@H]3C2)c1	ZINC001048983665	1347697830	/nfs/dbraw/zinc/69/78/30/1347697830.db2.gz	IJWSLNBMTIGFQS-UIFIKXQLSA-N	0	3	349.478	3.195	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H]3CN(Cc4scnc4C)C[C@H]3C2)CC1	ZINC001049027109	1347710445	/nfs/dbraw/zinc/71/04/45/1347710445.db2.gz	KIJRJKJPENGKGZ-CALCHBBNSA-N	0	3	345.512	3.088	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc(C4=CCCC4)cc3)C[C@@H]2C1	ZINC001049255680	1347759207	/nfs/dbraw/zinc/75/92/07/1347759207.db2.gz	IIZKHEKXNWVJDI-OYRHEFFESA-N	0	3	334.463	3.281	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)[C@@H]2CC=CCC2)c1	ZINC001049324534	1347790984	/nfs/dbraw/zinc/79/09/84/1347790984.db2.gz	ATQPWKRRQZAHTF-NJDAHSKKSA-N	0	3	349.478	3.480	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@H]2[C@H]1CCN2CCc1ccccc1Cl	ZINC001049370964	1347808264	/nfs/dbraw/zinc/80/82/64/1347808264.db2.gz	DHSRFVYKJOQSAO-FHLIZLRMSA-N	0	3	345.874	3.107	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)C2CC=CC2)c1	ZINC001049397381	1347819671	/nfs/dbraw/zinc/81/96/71/1347819671.db2.gz	RUUNRXIUGPDLIF-VQTJNVASSA-N	0	3	335.451	3.090	20	30		EGEDHN
CC1CC(C(=O)N2CCC[C@H]3[C@H]2CCN3Cc2ccc(C#N)cc2)C1	ZINC001049408038	1347831393	/nfs/dbraw/zinc/83/13/93/1347831393.db2.gz	TZXUUHRJFVNGER-OSXBXZONSA-N	0	3	337.467	3.170	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1sccc1C	ZINC001049476885	1347867521	/nfs/dbraw/zinc/86/75/21/1347867521.db2.gz	ZKGHYEWMJANFMN-NCOADZHNSA-N	0	3	330.497	3.411	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccoc1C(F)(F)F	ZINC001049497003	1347878134	/nfs/dbraw/zinc/87/81/34/1347878134.db2.gz	FXFFLEPFIPRMIE-ZIAGYGMSSA-N	0	3	340.345	3.001	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(CCC)s1	ZINC001049499129	1347878652	/nfs/dbraw/zinc/87/86/52/1347878652.db2.gz	UYRHYHRLBZCGBZ-IRXDYDNUSA-N	0	3	330.497	3.403	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(C(F)F)nc1	ZINC001049511833	1347885733	/nfs/dbraw/zinc/88/57/33/1347885733.db2.gz	PXLQMNXFHIANKA-HZPDHXFCSA-N	0	3	335.398	3.274	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C1C2CC3CC(C2)CC1C3	ZINC001049522066	1347889987	/nfs/dbraw/zinc/88/99/87/1347889987.db2.gz	OJUNXZXSBMJKTP-SMXQRSFLSA-N	0	3	328.500	3.310	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1oc(C(F)F)cc1C	ZINC001049535736	1347896644	/nfs/dbraw/zinc/89/66/44/1347896644.db2.gz	JLKQXFIQLCMQRH-KBPBESRZSA-N	0	3	336.382	3.228	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(-n2cccc2)cc1	ZINC001049579893	1347920015	/nfs/dbraw/zinc/92/00/15/1347920015.db2.gz	PJMVVXRMMIAEIS-VQTJNVASSA-N	0	3	335.451	3.342	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1sccc1-n1cccc1	ZINC001049629027	1347943136	/nfs/dbraw/zinc/94/31/36/1347943136.db2.gz	ITISONVOYYHDHN-JKSUJKDBSA-N	0	3	341.480	3.404	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1sccc1-n1cccc1	ZINC001049629022	1347943213	/nfs/dbraw/zinc/94/32/13/1347943213.db2.gz	ITISONVOYYHDHN-CVEARBPZSA-N	0	3	341.480	3.404	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cncc2sccc21	ZINC001049675493	1347967520	/nfs/dbraw/zinc/96/75/20/1347967520.db2.gz	ZRQNSGPXKBMUDG-HZPDHXFCSA-N	0	3	327.453	3.161	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C1(c2cccnc2)CCCC1	ZINC001049680904	1347970048	/nfs/dbraw/zinc/97/00/48/1347970048.db2.gz	UBPIIRQBNOFGDS-RBUKOAKNSA-N	0	3	339.483	3.145	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1c(Cl)cncc1Cl	ZINC001049688261	1347972177	/nfs/dbraw/zinc/97/21/77/1347972177.db2.gz	TZKPVCRACUFFQY-ZIAGYGMSSA-N	0	3	340.254	3.253	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]3[C@@H]2CCN3Cc2cnccc2C)C1	ZINC001049706748	1347983325	/nfs/dbraw/zinc/98/33/25/1347983325.db2.gz	KEZLMWJQNPEHJC-OALUTQOASA-N	0	3	339.483	3.312	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1sc(C)cc1OC	ZINC001049766582	1348009958	/nfs/dbraw/zinc/00/99/58/1348009958.db2.gz	LUISYKNEBNKQPE-GJZGRUSLSA-N	0	3	334.485	3.320	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(C(CC)CC)no1	ZINC001049769031	1348012037	/nfs/dbraw/zinc/01/20/37/1348012037.db2.gz	GDUKUXIRKWMMQD-MSOLQXFVSA-N	0	3	343.471	3.280	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](C)c1ccc(CC)cc1	ZINC001049789521	1348023402	/nfs/dbraw/zinc/02/34/02/1348023402.db2.gz	ASKDQCXBWFLMMH-DUXKGJEZSA-N	0	3	338.495	3.441	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cnn(C(CC)CC)c1C	ZINC001049835838	1348048987	/nfs/dbraw/zinc/04/89/87/1348048987.db2.gz	SYZJEPGVHOYECO-RBUKOAKNSA-N	0	3	344.503	3.418	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1c[nH]nc1C1CCCCC1	ZINC001049843258	1348054074	/nfs/dbraw/zinc/05/40/74/1348054074.db2.gz	OKZNPGOLAWZULD-ROUUACIJSA-N	0	3	342.487	3.322	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@](C)(OC)c1ccccc1	ZINC001049846605	1348055932	/nfs/dbraw/zinc/05/59/32/1348055932.db2.gz	KMPOFQOWGSULNP-QKNQBKEWSA-N	0	3	342.483	3.190	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)C1CCC(C(F)F)CC1	ZINC001049869807	1348075321	/nfs/dbraw/zinc/07/53/21/1348075321.db2.gz	JUIVWQWJWXCDDG-BACDZXNISA-N	0	3	338.442	3.147	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc2c(s1)CCCC2	ZINC001049875973	1348080808	/nfs/dbraw/zinc/08/08/08/1348080808.db2.gz	GWUFDSWBLKPWJS-DLBZAZTESA-N	0	3	342.508	3.329	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](C)c1ccc(F)cc1F	ZINC001049903191	1348102797	/nfs/dbraw/zinc/10/27/97/1348102797.db2.gz	GGKWUGLUDNHZDS-MORSLUCNSA-N	0	3	334.410	3.320	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cccc2oc(C)nc21	ZINC001049924136	1348115862	/nfs/dbraw/zinc/11/58/62/1348115862.db2.gz	QFVCSJXBBBMVRA-JKSUJKDBSA-N	0	3	325.412	3.001	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cccc2oc(C)nc21	ZINC001049924134	1348115997	/nfs/dbraw/zinc/11/59/97/1348115997.db2.gz	QFVCSJXBBBMVRA-HOTGVXAUSA-N	0	3	325.412	3.001	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1csc(C2CC2)n1	ZINC001049928448	1348118587	/nfs/dbraw/zinc/11/85/87/1348118587.db2.gz	SGXUJRLFKFFFOL-CVEARBPZSA-N	0	3	331.485	3.276	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@]1(C)CCc2ccccc2C1	ZINC001049937849	1348123107	/nfs/dbraw/zinc/12/31/07/1348123107.db2.gz	WCVZRPYENHVGNG-VWPQPMDRSA-N	0	3	338.495	3.433	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3CCCN(C(=O)c4ccccc4)[C@@H]3C2)cc1	ZINC001049958378	1348132327	/nfs/dbraw/zinc/13/23/27/1348132327.db2.gz	GTLRUWYQIMZBIY-LEWJYISDSA-N	0	3	345.446	3.295	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3coc4c3cccc4OC)[C@@H]2C1	ZINC001050049145	1348165415	/nfs/dbraw/zinc/16/54/15/1348165415.db2.gz	UHLFJJCBSZXDGU-WMLDXEAASA-N	0	3	340.423	3.164	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cc(Cl)c(Cl)n3C)[C@@H]2C1	ZINC001050061223	1348169509	/nfs/dbraw/zinc/16/95/09/1348169509.db2.gz	JHLHVAZQHNGDEQ-SMDDNHRTSA-N	0	3	342.270	3.054	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3cc4ccncc4s3)[C@@H]2C1	ZINC001050063062	1348170088	/nfs/dbraw/zinc/17/00/88/1348170088.db2.gz	AAZCPVRVQPXARD-JKSUJKDBSA-N	0	3	341.480	3.409	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3[nH]nc(C4CC4)c3Cl)[C@@H]2C1	ZINC001050085919	1348177425	/nfs/dbraw/zinc/17/74/25/1348177425.db2.gz	OCMMQEASWYLIGU-UONOGXRCSA-N	0	3	348.878	3.053	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)CCc3cc(C)sc3C)[C@@H]2C1	ZINC001050210827	1348212368	/nfs/dbraw/zinc/21/23/68/1348212368.db2.gz	BTFNBXPRSKFBRW-ZWKOTPCHSA-N	0	3	332.513	3.406	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)N[C@H]1CC[C@H](CNCc2cc(F)ccc2C#N)CC1	ZINC001050284384	1348226578	/nfs/dbraw/zinc/22/65/78/1348226578.db2.gz	KKXHWBDIZJWGEV-TWKYDXJASA-N	0	3	343.446	3.118	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)C[C@H]4C=CCC4)C3)CC2)c1	ZINC001050425349	1348262070	/nfs/dbraw/zinc/26/20/70/1348262070.db2.gz	NAWKPYHYYVIPSS-SFHVURJKSA-N	0	3	349.478	3.339	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC2(C1)CCN([C@@H](C)c1ccc(Cl)cc1)CC2	ZINC001050458994	1348271031	/nfs/dbraw/zinc/27/10/31/1348271031.db2.gz	GQFHKYXOGRRSIQ-GJZGRUSLSA-N	0	3	345.874	3.485	20	30		EGEDHN
Cc1cc(Cl)ccc1CN1CCC2(CN(C(=O)[C@@H](C)C#N)C2)CC1	ZINC001050463170	1348272252	/nfs/dbraw/zinc/27/22/52/1348272252.db2.gz	KUUMDNCANCNAMN-HNNXBMFYSA-N	0	3	345.874	3.233	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC2(C1)CCN(Cc1ccccn1)CC2	ZINC001050533081	1348285122	/nfs/dbraw/zinc/28/51/22/1348285122.db2.gz	HXOSTDMEJYSFAF-UHFFFAOYSA-N	0	3	347.890	3.285	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3cc(C4CC4)oc3C3CC3)C2)CC1	ZINC001050599207	1348297511	/nfs/dbraw/zinc/29/75/11/1348297511.db2.gz	NVDNQFSPKWWJQH-UHFFFAOYSA-N	0	3	338.451	3.206	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@@H]3C[C@H]3c3ccc(Cl)s3)C2)CC1	ZINC001050632423	1348309342	/nfs/dbraw/zinc/30/93/42/1348309342.db2.gz	GPSHBISKOOFUIK-ZIAGYGMSSA-N	0	3	348.899	3.063	20	30		EGEDHN
C[C@H]1C[C@H]1CC(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001050647815	1348315354	/nfs/dbraw/zinc/31/53/54/1348315354.db2.gz	SBQVCWJEUHFCCR-LPHOPBHVSA-N	0	3	337.467	3.029	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H](c3ccccc3)C(C)C)C2)CC1	ZINC001050678333	1348323920	/nfs/dbraw/zinc/32/39/20/1348323920.db2.gz	LWRCLUBBVGHVQI-FQEVSTJZSA-N	0	3	338.495	3.374	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H](CC)Cc3ccccc3)C2)CC1	ZINC001050683276	1348325497	/nfs/dbraw/zinc/32/54/97/1348325497.db2.gz	DHSLZRMMWDROLE-FQEVSTJZSA-N	0	3	338.495	3.203	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C(C)(C)c3ccc(C)cc3)C2)CC1	ZINC001050733008	1348341148	/nfs/dbraw/zinc/34/11/48/1348341148.db2.gz	RDEOTRAPKLJWHE-UHFFFAOYSA-N	0	3	338.495	3.220	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C[C@H](C)c3ccc(F)cc3)C2)CC1	ZINC001050762874	1348351421	/nfs/dbraw/zinc/35/14/21/1348351421.db2.gz	LBTDOPAVQINVEN-KRWDZBQOSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@H](c3ccc(F)cc3)C(C)C)C2)CC1	ZINC001050768223	1348353605	/nfs/dbraw/zinc/35/36/05/1348353605.db2.gz	QKMHPTLYCIJGEY-IBGZPJMESA-N	0	3	342.458	3.123	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)[C@@H]3CCC[C@H](F)C3)cccc2C1	ZINC001051288227	1348419578	/nfs/dbraw/zinc/41/95/78/1348419578.db2.gz	NNIRWKXAHZIUSE-APWZRJJASA-N	0	3	342.458	3.213	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2ccccc2CC(C)(C)C)CC1	ZINC001052475406	1348550105	/nfs/dbraw/zinc/55/01/05/1348550105.db2.gz	KZEKGEAQMWUFRB-SFHVURJKSA-N	0	3	326.484	3.493	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@@H]2CCCC[C@@H]2C(F)(F)F)CC1	ZINC001052493169	1348557169	/nfs/dbraw/zinc/55/71/69/1348557169.db2.gz	PAKYGLYBBOWYRN-XHSDSOJGSA-N	0	3	344.421	3.349	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCN(Cc3ncccc3C)CC2)cc1	ZINC001052610107	1348596083	/nfs/dbraw/zinc/59/60/83/1348596083.db2.gz	AFXOKCUKUWPIJK-FQEVSTJZSA-N	0	3	347.462	3.156	20	30		EGEDHN
CC1(C)CC[C@H]1C(=O)N[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC001052636715	1348605414	/nfs/dbraw/zinc/60/54/14/1348605414.db2.gz	WYGWCVJTZWCCQE-MOPGFXCFSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cc(C(CC)CC)no2)CC1	ZINC001052772657	1348673292	/nfs/dbraw/zinc/67/32/92/1348673292.db2.gz	BRVYEFAEZWDJQU-INIZCTEOSA-N	0	3	331.460	3.186	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@H](NC(=O)[C@@H]3C[C@H]3C3CC3)CC2)c1	ZINC001052778857	1348675844	/nfs/dbraw/zinc/67/58/44/1348675844.db2.gz	SQXOXZBGGPKJES-HSALFYBXSA-N	0	3	337.467	3.075	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)Cc2cccc(OCCC)c2)CC1	ZINC001052849532	1348701237	/nfs/dbraw/zinc/70/12/37/1348701237.db2.gz	XMUCLXKFVCTUOC-IBGZPJMESA-N	0	3	342.483	3.012	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2c[nH]nc2C2CCCCC2)CC1	ZINC001052855150	1348702934	/nfs/dbraw/zinc/70/29/34/1348702934.db2.gz	KPGHEYIEMGULKO-KRWDZBQOSA-N	0	3	342.487	3.065	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)C[C@@H]2CCCc3ccccc32)CC1	ZINC001052885273	1348721919	/nfs/dbraw/zinc/72/19/19/1348721919.db2.gz	QILRLHSZAAEREB-PMACEKPBSA-N	0	3	338.495	3.491	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)C[C@H]2CCCc3ccccc32)CC1	ZINC001052885274	1348722067	/nfs/dbraw/zinc/72/20/67/1348722067.db2.gz	QILRLHSZAAEREB-UXHICEINSA-N	0	3	338.495	3.491	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2cc3c(s2)CCCCC3)CC1	ZINC001052913159	1348744952	/nfs/dbraw/zinc/74/49/52/1348744952.db2.gz	ILKSZBTYBFTQMP-MRXNPFEDSA-N	0	3	330.497	3.235	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@H](C)c2cccc(Cl)c2)CC1	ZINC001052946675	1348763310	/nfs/dbraw/zinc/76/33/10/1348763310.db2.gz	BLCJRWMLAFAKRO-QAPCUYQASA-N	0	3	332.875	3.438	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)CC2C3CC4CC(C3)CC2C4)CC1	ZINC001052947057	1348763477	/nfs/dbraw/zinc/76/34/77/1348763477.db2.gz	HMFZCPCXILJKKG-OPFHRDBUSA-N	0	3	342.527	3.443	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)C23CC(c4ccccc4)(C2)C3)CC1	ZINC001052962716	1348774311	/nfs/dbraw/zinc/77/43/11/1348774311.db2.gz	JSNHXYTWSCHNQW-KPQWGBOZSA-N	0	3	336.479	3.102	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2sccc2C)C1	ZINC001053062297	1348873145	/nfs/dbraw/zinc/87/31/45/1348873145.db2.gz	YDGBHARKMOOFGM-SJORKVTESA-N	0	3	330.497	3.396	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cc(C)sn2)C1	ZINC001053080108	1348901524	/nfs/dbraw/zinc/90/15/24/1348901524.db2.gz	AKMIIKAPAMZZLU-FUHWJXTLSA-N	0	3	345.512	3.182	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cc[nH]c2CCC)C1	ZINC001053095803	1348926000	/nfs/dbraw/zinc/92/60/00/1348926000.db2.gz	LLAWOEOIDWSSLS-FXAWDEMLSA-N	0	3	341.499	3.307	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001054074891	1349146923	/nfs/dbraw/zinc/14/69/23/1349146923.db2.gz	CDYPLCGXHDDTBH-NRFANRHFSA-N	0	3	339.483	3.419	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)C1(C(F)(F)F)CCC1)C2	ZINC001054153495	1349156919	/nfs/dbraw/zinc/15/69/19/1349156919.db2.gz	RZAMJSHUFYCINH-MRXNPFEDSA-N	0	3	342.405	3.057	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)Cc1c(C)cccc1Cl)C2	ZINC001054159554	1349161191	/nfs/dbraw/zinc/16/11/91/1349161191.db2.gz	KVJBUUQVUCATFW-FQEVSTJZSA-N	0	3	344.886	3.139	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC[C@@]3(CCN(C[C@@H](F)CC)C3)C2)cc1	ZINC001054174369	1349175462	/nfs/dbraw/zinc/17/54/62/1349175462.db2.gz	NRUYTEUJSDQQCB-FPOVZHCZSA-N	0	3	342.458	3.344	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@]2(CCN(Cc3scnc3C)C2)C1	ZINC001054175324	1349176663	/nfs/dbraw/zinc/17/66/63/1349176663.db2.gz	MIDQFJAJCUDIQL-IBGZPJMESA-N	0	3	347.528	3.478	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@]2(CCN(Cc3cccnc3)C2)C1	ZINC001054192088	1349194337	/nfs/dbraw/zinc/19/43/37/1349194337.db2.gz	QWGXMCNKUIVYRE-LEWJYISDSA-N	0	3	341.499	3.498	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@]3(CCN(Cc4ocnc4C)C3)C2)C1	ZINC001054194555	1349197039	/nfs/dbraw/zinc/19/70/39/1349197039.db2.gz	SJMPQNAPKFYUTA-FQEVSTJZSA-N	0	3	343.471	3.154	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)C[C@H](C)c1cccc(F)c1)C2	ZINC001054194699	1349197660	/nfs/dbraw/zinc/19/76/60/1349197660.db2.gz	UPUUSXHZWJVUET-UWJYYQICSA-N	0	3	342.458	3.267	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H](F)c1ccccc1)C2	ZINC001054204864	1349206970	/nfs/dbraw/zinc/20/69/70/1349206970.db2.gz	FTNAGZOUJUDFCQ-AZUAARDMSA-N	0	3	328.431	3.035	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc([C@@H](C)CC)no1)C2	ZINC001054209366	1349210705	/nfs/dbraw/zinc/21/07/05/1349210705.db2.gz	PPDGAEKFTMGTLJ-JXFKEZNVSA-N	0	3	343.471	3.140	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc3ccn(C)c3c1)C2	ZINC001054224101	1349219420	/nfs/dbraw/zinc/21/94/20/1349219420.db2.gz	VHHBLSATDOLCDR-JOCHJYFZSA-N	0	3	349.478	3.130	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)C1CCC(C(F)F)CC1)C2	ZINC001054235014	1349227894	/nfs/dbraw/zinc/22/78/94/1349227894.db2.gz	NTIYXTDOONVBGN-LADRWXRNSA-N	0	3	338.442	3.006	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1oc3ccccc3c1C)C2	ZINC001054237682	1349230769	/nfs/dbraw/zinc/23/07/69/1349230769.db2.gz	ZYVHOSCONYDOGH-OAQYLSRUSA-N	0	3	336.435	3.303	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc3[nH]c(C)c(C)c3c1)C2	ZINC001054239830	1349233563	/nfs/dbraw/zinc/23/35/63/1349233563.db2.gz	VCXQPSNMYDXZQV-JOCHJYFZSA-N	0	3	349.478	3.346	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)C(C)(C)c1ccccc1C)C2	ZINC001054248424	1349244005	/nfs/dbraw/zinc/24/40/05/1349244005.db2.gz	SSQVJZOEGXXLTE-QFIPXVFZSA-N	0	3	338.495	3.220	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@H]3CC[C@@H](CC)O3)cc2C1	ZINC001054267495	1349264632	/nfs/dbraw/zinc/26/46/32/1349264632.db2.gz	XMRBZKUGEAYQJO-RTBURBONSA-N	0	3	328.456	3.152	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@H]3OCC[C@H]3CC)cc2C1	ZINC001054269210	1349268123	/nfs/dbraw/zinc/26/81/23/1349268123.db2.gz	QXABRWKETXYOKW-APWZRJJASA-N	0	3	328.456	3.010	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cn(C(C)C)cn3)cc2C1	ZINC001054276014	1349275717	/nfs/dbraw/zinc/27/57/17/1349275717.db2.gz	JYFORWIKZNDVSZ-UHFFFAOYSA-N	0	3	338.455	3.286	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3c(C)n[nH]c3C)cc2C1	ZINC001054286060	1349287865	/nfs/dbraw/zinc/28/78/65/1349287865.db2.gz	PTQGQFGAHHBJSE-UHFFFAOYSA-N	0	3	338.455	3.238	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3ncccc3F)cc2C1	ZINC001054287194	1349290224	/nfs/dbraw/zinc/29/02/24/1349290224.db2.gz	CKMXLPQEKYSGKP-UHFFFAOYSA-N	0	3	339.414	3.433	20	30		EGEDHN
C[C@H]1CN(C(=O)c2cccs2)C[C@@H]1NCc1ccc(C#N)c(F)c1	ZINC001054350291	1349330351	/nfs/dbraw/zinc/33/03/51/1349330351.db2.gz	JNNCDINWAKCDSS-LRDDRELGSA-N	0	3	343.427	3.009	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](NCc2ccc(Cl)nc2)[C@@H](C)C1	ZINC001054970979	1349531698	/nfs/dbraw/zinc/53/16/98/1349531698.db2.gz	KQJKCTRJSLIABW-ZFWWWQNUSA-N	0	3	335.879	3.274	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](NCc2cccc(OCC)n2)[C@@H](C)C1	ZINC001054971585	1349531741	/nfs/dbraw/zinc/53/17/41/1349531741.db2.gz	RDCCKBSGYQIGKJ-RDJZCZTQSA-N	0	3	345.487	3.019	20	30		EGEDHN
CCC(C)(C)C(=O)N1C[C@@H](C)[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001055026285	1349555937	/nfs/dbraw/zinc/55/59/37/1349555937.db2.gz	MMUZUDZNIZQILS-DYVFJYSZSA-N	0	3	331.435	3.070	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc(-c2ccco2)on1	ZINC001085750662	1358731909	/nfs/dbraw/zinc/73/19/09/1358731909.db2.gz	LYAOYLSJNMDSNX-AWEZNQCLSA-N	0	3	329.400	3.047	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1ccc(C)cc1C)C[C@@H](C)O2	ZINC001071236290	1354521020	/nfs/dbraw/zinc/52/10/20/1354521020.db2.gz	SOIXBNUCRAQBSI-NQIIRXRSSA-N	0	3	342.483	3.185	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc(C(F)F)ccc2F)CC[C@@H]1C	ZINC001071512499	1354736564	/nfs/dbraw/zinc/73/65/64/1354736564.db2.gz	YLRAYMTVFBTXOD-GXTWGEPZSA-N	0	3	338.373	3.369	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2sc(Cl)nc2C)CC[C@@H]1C	ZINC001071533641	1354750787	/nfs/dbraw/zinc/75/07/87/1354750787.db2.gz	IZOLKCRGUOUELN-JQWIXIFHSA-N	0	3	327.881	3.264	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)Cc2coc3ccc(C)cc23)CC[C@@H]1C	ZINC001071543931	1354756814	/nfs/dbraw/zinc/75/68/14/1354756814.db2.gz	PWGZJDRYVCTSSO-DOTOQJQBSA-N	0	3	326.440	3.439	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc(Cl)c(Cl)n2C)CC[C@@H]1C	ZINC001071548516	1354760371	/nfs/dbraw/zinc/76/03/71/1354760371.db2.gz	HHHDKTKFWDLUEP-NWDGAFQWSA-N	0	3	344.286	3.491	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc(C3CC3)[nH]c2C2CC2)CC[C@H]1C	ZINC001071607843	1354792973	/nfs/dbraw/zinc/79/29/73/1354792973.db2.gz	SXHUEKOFIAWBBT-PBHICJAKSA-N	0	3	339.483	3.376	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc3c([nH]2)c(F)ccc3C)CC[C@@H]1C	ZINC001071624720	1354808008	/nfs/dbraw/zinc/80/80/08/1354808008.db2.gz	JKUTUETXNQXGQN-LSDHHAIUSA-N	0	3	341.430	3.221	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc3c([nH]2)c(F)ccc3C)CC[C@H]1C	ZINC001071624718	1354808233	/nfs/dbraw/zinc/80/82/33/1354808233.db2.gz	JKUTUETXNQXGQN-HUUCEWRRSA-N	0	3	341.430	3.221	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cccc(-n3cccc3)c2)CC[C@H]1C	ZINC001071654669	1354829461	/nfs/dbraw/zinc/82/94/61/1354829461.db2.gz	HIMNESSIBSNRRI-MJGOQNOKSA-N	0	3	335.451	3.083	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2c(C)occ2C(F)(F)F)CC[C@@H]1C	ZINC001071689165	1354852808	/nfs/dbraw/zinc/85/28/08/1354852808.db2.gz	GTJUNAQPBGOCPC-WCQYABFASA-N	0	3	342.361	3.213	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(C)c3cccnc23)CC[C@@H]1C	ZINC001071695523	1354858031	/nfs/dbraw/zinc/85/80/31/1354858031.db2.gz	QWHXPLGXJALUIB-DLBZAZTESA-N	0	3	335.451	3.149	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2cccc3cccnc32)CC[C@@H]1C	ZINC001071725096	1354881364	/nfs/dbraw/zinc/88/13/64/1354881364.db2.gz	QFRQEYJDISTWPV-LPHOPBHVSA-N	0	3	337.467	3.323	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cn(CC)nc2C(C)C)CC[C@@H]1C	ZINC001071854642	1354982457	/nfs/dbraw/zinc/98/24/57/1354982457.db2.gz	DASQZUBUXHAZKD-JKSUJKDBSA-N	0	3	332.492	3.185	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)Cc2ccccc2OC(C)C)CC[C@H]1C	ZINC001071890527	1355008427	/nfs/dbraw/zinc/00/84/27/1355008427.db2.gz	NSHWLZLFSGEGJH-AEFFLSMTSA-N	0	3	330.472	3.171	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cccc(-n3cccn3)c2)CC[C@H]1C	ZINC001071898187	1355013416	/nfs/dbraw/zinc/01/34/16/1355013416.db2.gz	WZTTZHTUTIGCJX-AEFFLSMTSA-N	0	3	338.455	3.031	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C2(c3ccccc3F)CC2)CC[C@H]1C	ZINC001071957815	1355042963	/nfs/dbraw/zinc/04/29/63/1355042963.db2.gz	NZWSOPJTVSXNTQ-CVEARBPZSA-N	0	3	330.447	3.403	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2c(C)nn(CCC)c2C)CC[C@H]1C	ZINC001071972515	1355052772	/nfs/dbraw/zinc/05/27/72/1355052772.db2.gz	WUPWTBJZNYPWCB-PBHICJAKSA-N	0	3	332.492	3.069	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C23CC4CC(CC(C4)C2)C3)CC[C@H]1C	ZINC001072012075	1355075791	/nfs/dbraw/zinc/07/57/91/1355075791.db2.gz	HZMLPXPMEODOCS-AGWGEYTISA-N	0	3	328.500	3.195	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N[C@H]2CC[C@@H](C)N(CC(=C)C)C2)cc1	ZINC001072106897	1355134678	/nfs/dbraw/zinc/13/46/78/1355134678.db2.gz	XNVQUJZWQULSAG-MJGOQNOKSA-N	0	3	342.483	3.339	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@H](C)[C@@H](CNCc2ccccc2C#N)C1	ZINC001072171779	1355167033	/nfs/dbraw/zinc/16/70/33/1355167033.db2.gz	PMJSOZUOCQCRPM-LPHOPBHVSA-N	0	3	325.456	3.099	20	30		EGEDHN
C[C@H]1CCN(C(=O)c2ccoc2)C[C@@H]1CNCc1ccccc1C#N	ZINC001072194140	1355181992	/nfs/dbraw/zinc/18/19/92/1355181992.db2.gz	FXQSEHAXLGUHDW-KXBFYZLASA-N	0	3	337.423	3.039	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](C)[C@H](CNCc3nccs3)C2)C1	ZINC001072360512	1355256880	/nfs/dbraw/zinc/25/68/80/1355256880.db2.gz	RCHSEZRPVQCSCD-LSDHHAIUSA-N	0	3	333.501	3.074	20	30		EGEDHN
CC(C)(C)CC(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001072477537	1355304427	/nfs/dbraw/zinc/30/44/27/1355304427.db2.gz	RXTSUCOYRVOVJW-UHFFFAOYSA-N	0	3	325.456	3.029	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)[C@H]4[C@@H]5CCCC[C@@H]54)C3)C2)c1	ZINC001072580674	1355342878	/nfs/dbraw/zinc/34/28/78/1355342878.db2.gz	HCTKKDOGBFCTAP-PMOLBWCYSA-N	0	3	349.478	3.029	20	30		EGEDHN
CCc1ccoc1C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001072952859	1355518668	/nfs/dbraw/zinc/51/86/68/1355518668.db2.gz	BDLZYZWDUBCHED-UHFFFAOYSA-N	0	3	349.434	3.062	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C[C@@H]3C[C@@H](C)CC(C)(C)C3)C2)C1	ZINC001073062893	1355575913	/nfs/dbraw/zinc/57/59/13/1355575913.db2.gz	XMPHZXRVSFJSRA-MSOLQXFVSA-N	0	3	330.516	3.397	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)C(C4CC4)C4CC4)C3)C2)c1	ZINC001073115208	1355605664	/nfs/dbraw/zinc/60/56/64/1355605664.db2.gz	VDGYYJZLSHSMDV-UHFFFAOYSA-N	0	3	349.478	3.029	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)CC34CC5CC(CC(C5)C3)C4)C2)C1	ZINC001073147518	1355625376	/nfs/dbraw/zinc/62/53/76/1355625376.db2.gz	AAHXZJVPSUIHQB-UHFFFAOYSA-N	0	3	340.511	3.151	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2coc3c2cccc3C)C1	ZINC001073639514	1355850187	/nfs/dbraw/zinc/85/01/87/1355850187.db2.gz	HPBMWFQSYPXNGD-MRXNPFEDSA-N	0	3	342.439	3.138	20	30		EGEDHN
C#CCCN1CCCO[C@@H](CNC(=O)C2CCC(CCCC)CC2)C1	ZINC001073880436	1355937369	/nfs/dbraw/zinc/93/73/69/1355937369.db2.gz	JDIKPLGONHXPLZ-MHJFOBGBSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2cc(C)n(C(C)C)c2C)C1	ZINC001073883758	1355939944	/nfs/dbraw/zinc/93/99/44/1355939944.db2.gz	XCLAGWUBXQXVSY-GOSISDBHSA-N	0	3	347.503	3.083	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2cc3c(cccc3C)o2)C1	ZINC001073904864	1355947887	/nfs/dbraw/zinc/94/78/87/1355947887.db2.gz	PDJCARDOJJHOKJ-INIZCTEOSA-N	0	3	342.439	3.138	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](C2CCN(C(=O)[C@H](C)OC)CC2)CC1	ZINC001075448094	1356380650	/nfs/dbraw/zinc/38/06/50/1356380650.db2.gz	NOWHVDXYAQHEOK-HOTGVXAUSA-N	0	3	342.911	3.115	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccccc1	ZINC001098286676	1363285689	/nfs/dbraw/zinc/28/56/89/1363285689.db2.gz	LQYJHMAKAZIZMD-VSKRKVRLSA-N	0	3	344.458	3.132	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@@H](C)Cc3ccccc3F)[C@@H]2C1	ZINC001076232546	1356526283	/nfs/dbraw/zinc/52/62/83/1356526283.db2.gz	JJSAPQSAIOJNTI-VDZJLULYSA-N	0	3	330.447	3.113	20	30		EGEDHN
CCCCCCCCC(=O)N[C@@H](C)CCNC(=O)[C@H](CC)N(C)C	ZINC001077516507	1356792678	/nfs/dbraw/zinc/79/26/78/1356792678.db2.gz	PEVMMJDQVOGDDI-IRXDYDNUSA-N	0	3	341.540	3.088	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@H](F)Cc1ccccc1	ZINC001099349674	1363766459	/nfs/dbraw/zinc/76/64/59/1363766459.db2.gz	RJPCXDKTLGNWPP-RBUKOAKNSA-N	0	3	344.474	3.197	20	30		EGEDHN
C#CCCN1C[C@@H](C)[C@H](NC(=O)c2cc(Cl)ccc2Cl)C1	ZINC001080839115	1357749645	/nfs/dbraw/zinc/74/96/45/1357749645.db2.gz	XFTMADXEMLXHOY-IAQYHMDHSA-N	0	3	325.239	3.067	20	30		EGEDHN
CCCCCCCCC(=O)NCC[C@H](C)NC(=O)[C@@H](CC)N(C)C	ZINC001078328283	1356953227	/nfs/dbraw/zinc/95/32/27/1356953227.db2.gz	PPOJFCFUUWNWBU-DLBZAZTESA-N	0	3	341.540	3.088	20	30		EGEDHN
CC1(C(=O)N[C@@H]2C[C@H](NCc3cc(C#N)ccc3F)C23CCC3)CC1	ZINC001078629819	1357041373	/nfs/dbraw/zinc/04/13/73/1357041373.db2.gz	PIOLBXAQIULSRK-DLBZAZTESA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2ccn3ccccc23)C12CCC2	ZINC001078677712	1357051323	/nfs/dbraw/zinc/05/13/23/1357051323.db2.gz	IXMMJGJLKZRDFF-SJORKVTESA-N	0	3	343.858	3.322	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2cc(C(C)C)on2)C12CCC2	ZINC001078688982	1357054221	/nfs/dbraw/zinc/05/42/21/1357054221.db2.gz	ZDINQHQYQDDSEI-CABCVRRESA-N	0	3	337.851	3.181	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2ncccc2Cl)C12CCC2	ZINC001078785285	1357081051	/nfs/dbraw/zinc/08/10/51/1357081051.db2.gz	AXPYFJVZNSOTLX-CHWSQXEVSA-N	0	3	340.254	3.118	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)C2CC(c3cccc(F)c3)C2)C1	ZINC001081045243	1357795842	/nfs/dbraw/zinc/79/58/42/1357795842.db2.gz	JEPFZQOWQNINDR-FOSZKXBFSA-N	0	3	330.447	3.332	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H]2C[C@H]2CC(C)(C)C)C[C@H]1c1ccccc1	ZINC001081118656	1357837622	/nfs/dbraw/zinc/83/76/22/1357837622.db2.gz	PAMCHWKCVBVFON-ZGXWSNOMSA-N	0	3	338.495	3.276	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)Cc2cc(C)cc(C)c2)C[C@H]1c1ccccc1	ZINC001081173663	1357847024	/nfs/dbraw/zinc/84/70/24/1357847024.db2.gz	GXPJSJFMMWWLPO-FCHUYYIVSA-N	0	3	346.474	3.063	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H](C)c2ccsc2)C[C@H]1c1ccccc1	ZINC001081178001	1357847512	/nfs/dbraw/zinc/84/75/12/1357847512.db2.gz	FVQOLOTUZCKLOR-AYOQOUSVSA-N	0	3	338.476	3.069	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H](C)c2cccs2)C[C@H]1c1ccccc1	ZINC001081178464	1357847743	/nfs/dbraw/zinc/84/77/43/1357847743.db2.gz	NZRBNVZGMRHEOK-RYQLBKOJSA-N	0	3	338.476	3.069	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2ccc(C(F)F)o2)C[C@H]1c1ccccc1	ZINC001081219867	1357850612	/nfs/dbraw/zinc/85/06/12/1357850612.db2.gz	PERYDIFASRUDPL-LSDHHAIUSA-N	0	3	344.361	3.048	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C23CCC(CC2)CC3)C[C@H]1c1ccccc1	ZINC001081230292	1357852032	/nfs/dbraw/zinc/85/20/32/1357852032.db2.gz	XUDOWJASKISFFE-GWFKXHKXSA-N	0	3	336.479	3.174	20	30		EGEDHN
C[C@H](N[C@@H]1CN(C(=O)C#CC2CC2)C[C@H]1C)c1cccc(Cl)c1F	ZINC001082504895	1358052948	/nfs/dbraw/zinc/05/29/48/1358052948.db2.gz	QVIJQNIRXDVELI-IIYDPXPESA-N	0	3	348.849	3.390	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)C[C@H]3CCCC(C)(C)C3)[C@H]2C1	ZINC001083248389	1358126923	/nfs/dbraw/zinc/12/69/23/1358126923.db2.gz	DPESQOSMVWDJJV-FGTMMUONSA-N	0	3	334.504	3.081	20	30		EGEDHN
Cc1cccc([C@@H](C)N2CC[C@@H]3CN(C(=O)c4ccc(C#N)[nH]4)[C@@H]3C2)c1	ZINC001084284058	1358185682	/nfs/dbraw/zinc/18/56/82/1358185682.db2.gz	VPSYNBWMRNHPTM-WRWLIDTKSA-N	0	3	348.450	3.102	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3cscc3C(F)F)[C@@H]2C1	ZINC001084349560	1358197177	/nfs/dbraw/zinc/19/71/77/1358197177.db2.gz	RBVKJXQFJQFQTR-BXUZGUMPSA-N	0	3	326.412	3.408	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3ccc(C(C)(C)C)cn3)[C@@H]2C1	ZINC001084352514	1358198843	/nfs/dbraw/zinc/19/88/43/1358198843.db2.gz	DXKDUHBKTHCCFE-CRAIPNDOSA-N	0	3	327.472	3.102	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)Cc3ccc(CCCC)cc3)[C@@H]2C1	ZINC001084491365	1358224130	/nfs/dbraw/zinc/22/41/30/1358224130.db2.gz	LBQZPNCODCSJFW-NHCUHLMSSA-N	0	3	338.495	3.128	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3oc(CC(C)C)nc3C)[C@@H]2C1	ZINC001084710248	1358289410	/nfs/dbraw/zinc/28/94/10/1358289410.db2.gz	TVGJGGZCORAHIK-IAGOWNOFSA-N	0	3	345.487	3.294	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3ncc(Cl)cc3Cl)[C@@H]2C1	ZINC001084739009	1358296044	/nfs/dbraw/zinc/29/60/44/1358296044.db2.gz	NNJYSNWVOLRPNS-BXUZGUMPSA-N	0	3	340.254	3.111	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)C3CCC(C(F)F)CC3)[C@@H]2C1	ZINC001084803031	1358314798	/nfs/dbraw/zinc/31/47/98/1358314798.db2.gz	CHDNFUHNTSKGQY-QDIHITRGSA-N	0	3	326.431	3.167	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)C[C@@H](C)c3ccc(F)cc3)[C@@H]2C1	ZINC001084846683	1358327305	/nfs/dbraw/zinc/32/73/05/1358327305.db2.gz	UZQZCPLXLQUIRD-SZVBFZGTSA-N	0	3	330.447	3.428	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N1CC[C@H]2CCN(Cc3ccc(C#N)cc3)[C@H]2C1	ZINC001084920599	1358349066	/nfs/dbraw/zinc/34/90/66/1358349066.db2.gz	MKWSVWGYAVAJNF-QRVBRYPASA-N	0	3	337.467	3.027	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@H]3[C@@H]4CCCCCC[C@@H]43)C[C@@H]21	ZINC001085042244	1358374080	/nfs/dbraw/zinc/37/40/80/1358374080.db2.gz	VCWOZUBOKCKHOH-SLHNCBLASA-N	0	3	328.500	3.149	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CC[C@H]2CCN(Cc3cccc(C#N)c3)[C@H]2C1	ZINC001085048495	1358378354	/nfs/dbraw/zinc/37/83/54/1358378354.db2.gz	RMKADILJSCXKAS-DBVUQKKJSA-N	0	3	339.483	3.273	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3cc([C@H](C)CC)no3)C[C@@H]21	ZINC001085051430	1358379314	/nfs/dbraw/zinc/37/93/14/1358379314.db2.gz	NEAIXXFVLQNIRJ-INMHGKMJSA-N	0	3	331.460	3.301	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@@H](C)c3cccc(Cl)c3)C[C@@H]21	ZINC001085097571	1358389346	/nfs/dbraw/zinc/38/93/46/1358389346.db2.gz	NOXGFPWYEUPLTD-FCEWJHQRSA-N	0	3	344.886	3.390	20	30		EGEDHN
N#Cc1cccc(C[NH2+][C@@H]2CCCC[C@H]2NC(=O)c2ccccc2[O-])c1	ZINC001085133972	1358408104	/nfs/dbraw/zinc/40/81/04/1358408104.db2.gz	ALWUHYZPJZHTRQ-RTBURBONSA-N	0	3	349.434	3.095	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1c(F)cccc1OC	ZINC001085208579	1358434371	/nfs/dbraw/zinc/43/43/71/1358434371.db2.gz	YSINRDWNGHKJRU-ZIAGYGMSSA-N	0	3	340.826	3.217	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cc2ncccc2o1	ZINC001085277262	1358449560	/nfs/dbraw/zinc/44/95/60/1358449560.db2.gz	ZICKNKGGWLNJQS-CHWSQXEVSA-N	0	3	333.819	3.211	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ncsc1C1CC1	ZINC001085330392	1358470282	/nfs/dbraw/zinc/47/02/82/1358470282.db2.gz	FEOHASUSNZRCKW-CHWSQXEVSA-N	0	3	339.892	3.404	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H](C)n1c(C)ccc1C	ZINC001085432245	1358498031	/nfs/dbraw/zinc/49/80/31/1358498031.db2.gz	PDGCLJSMHIDXGE-GVDBMIGSSA-N	0	3	337.895	3.435	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cnn(CC(C)C)c1CC	ZINC001085591816	1358618551	/nfs/dbraw/zinc/61/85/51/1358618551.db2.gz	TYWAZMFLTPEYRR-KRWDZBQOSA-N	0	3	346.519	3.214	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1csc([C@H]2CCCO2)n1	ZINC001085594464	1358621084	/nfs/dbraw/zinc/62/10/84/1358621084.db2.gz	HJRNWETUASZXKQ-GDBMZVCRSA-N	0	3	349.500	3.107	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc(C)n([C@H](C)CC)n1	ZINC001085685216	1358686053	/nfs/dbraw/zinc/68/60/53/1358686053.db2.gz	LYIQRLNUOLJOJP-WBVHZDCISA-N	0	3	332.492	3.275	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc(C)n([C@@H](C)C2CC2)n1	ZINC001085685324	1358687117	/nfs/dbraw/zinc/68/71/17/1358687117.db2.gz	OWEUWVZZTCALRZ-WMZOPIPTSA-N	0	3	344.503	3.275	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1csc(C(F)(F)F)c1	ZINC001085695476	1358691808	/nfs/dbraw/zinc/69/18/08/1358691808.db2.gz	KAQZIKVRQRGJLM-LBPRGKRZSA-N	0	3	332.391	3.489	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1noc2c1CC(C)(C)CC2	ZINC001085737435	1358722536	/nfs/dbraw/zinc/72/25/36/1358722536.db2.gz	NIIZGUWOQLOUBC-HNNXBMFYSA-N	0	3	345.487	3.302	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1F	ZINC001085740475	1358724605	/nfs/dbraw/zinc/72/46/05/1358724605.db2.gz	RWICWADECPKFLA-BHYGNILZSA-N	0	3	334.410	3.177	20	30		EGEDHN
CCC(CC)[C@H](C)C(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001183818028	1387353250	/nfs/dbraw/zinc/35/32/50/1387353250.db2.gz	TYWRYLSXPTXNEM-KBXCAEBGSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1nsc2ccc(C)cc21	ZINC001085761177	1358740003	/nfs/dbraw/zinc/74/00/03/1358740003.db2.gz	CELJENBFRGYGRG-CQSZACIVSA-N	0	3	329.469	3.327	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc2c(c1)[C@H](C)CO2	ZINC001085775853	1358749475	/nfs/dbraw/zinc/74/94/75/1358749475.db2.gz	DCWKHHUXIQKTTN-WBVHZDCISA-N	0	3	328.456	3.295	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1ccc(OCC(C)C)cc1	ZINC001085959494	1358917357	/nfs/dbraw/zinc/91/73/57/1358917357.db2.gz	DDKXOOLCBYWJAM-GOSISDBHSA-N	0	3	330.472	3.444	20	30		EGEDHN
CC1(C)C(C(=O)NCC2(NCc3ccc(F)c(C#N)c3)CC2)C1(C)C	ZINC001323412417	1387366395	/nfs/dbraw/zinc/36/63/95/1387366395.db2.gz	WJTDANWPSIRSIM-UHFFFAOYSA-N	0	3	343.446	3.118	20	30		EGEDHN
CC1(C)CC(C(=O)NC[C@H]2C[C@@H](NCc3ccc(C#N)cc3F)C2)C1	ZINC001086077350	1358989009	/nfs/dbraw/zinc/98/90/09/1358989009.db2.gz	UUZFGPKDXRNSLE-KDYLLFBJSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc(C)cc(OC)c2C)C1	ZINC001086138611	1359006260	/nfs/dbraw/zinc/00/62/60/1359006260.db2.gz	RYOBQIHNYBJRDF-GASCZTMLSA-N	0	3	336.863	3.163	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)c2ccc(C)s2)C1	ZINC001086294558	1359058522	/nfs/dbraw/zinc/05/85/22/1359058522.db2.gz	FIERZCGFNFUONN-HAQNSBGRSA-N	0	3	343.290	3.063	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2c(F)ccc3ccncc32)C1	ZINC001086371900	1359079377	/nfs/dbraw/zinc/07/93/77/1359079377.db2.gz	GTRNYYPUAZPWPG-MQMHXKEQSA-N	0	3	347.821	3.224	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccccc2-n2cccc2)C1	ZINC001086465852	1359107827	/nfs/dbraw/zinc/10/78/27/1359107827.db2.gz	YFGATRMDCXYHJM-WKILWMFISA-N	0	3	343.858	3.328	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccccc2OC2CCC2)C1	ZINC001086472832	1359112103	/nfs/dbraw/zinc/11/21/03/1359112103.db2.gz	BDSOUDKVJGVETL-SHTZXODSSA-N	0	3	348.874	3.468	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@@H]2C[C@H]2c2cccc(C)c2)C1	ZINC001086503413	1359122831	/nfs/dbraw/zinc/12/28/31/1359122831.db2.gz	RZJUZODIKNVANI-LEUOFYLZSA-N	0	3	332.875	3.335	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)[C@@H]2C[C@]2(C)C(C)C)C1	ZINC001086522395	1359130937	/nfs/dbraw/zinc/13/09/37/1359130937.db2.gz	UFHGYAJFNZMZEP-RZLSGREXSA-N	0	3	343.309	3.062	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2cc[nH]c2CCC)C1	ZINC001086605297	1359161963	/nfs/dbraw/zinc/16/19/63/1359161963.db2.gz	VZPUJMCYJMZVNK-PZJWPPBQSA-N	0	3	349.478	3.188	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CC[C@@H](NCc3ccc(F)cn3)C2)CC1	ZINC001086794945	1359203394	/nfs/dbraw/zinc/20/33/94/1359203394.db2.gz	RVIFDGVAOHQUFN-MAUKXSAKSA-N	0	3	345.462	3.342	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2c(F)cccc2F)C1	ZINC001086861914	1359216529	/nfs/dbraw/zinc/21/65/29/1359216529.db2.gz	XTHKVTLBISOUJW-NWDGAFQWSA-N	0	3	328.790	3.205	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccc3c(c2)CCC3)C1	ZINC001086871841	1359218486	/nfs/dbraw/zinc/21/84/86/1359218486.db2.gz	ADHAYDWNHKSXSF-KBXCAEBGSA-N	0	3	332.875	3.416	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc(CC)s3)C2)CC1	ZINC001086931658	1359255846	/nfs/dbraw/zinc/25/58/46/1359255846.db2.gz	NZUBIIAZEKDRQX-OAHLLOKOSA-N	0	3	330.497	3.260	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccoc3C3CC3)C2)CC1	ZINC001086939308	1359261743	/nfs/dbraw/zinc/26/17/43/1359261743.db2.gz	MYXFNSJBMFUTOX-MRXNPFEDSA-N	0	3	340.467	3.497	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc(Cl)[nH]3)C2)CC1	ZINC001086941380	1359263060	/nfs/dbraw/zinc/26/30/60/1359263060.db2.gz	RYYAFKNIFQDVGB-CQSZACIVSA-N	0	3	333.863	3.008	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@H](CC)OC3CCCC3)C2)CC1	ZINC001086945579	1359266529	/nfs/dbraw/zinc/26/65/29/1359266529.db2.gz	FFPCFIRVZCLEFV-HKUYNNGSSA-N	0	3	346.515	3.060	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)C[C@H](C)n3cccc3)C2)CC1	ZINC001086953474	1359273846	/nfs/dbraw/zinc/27/38/46/1359273846.db2.gz	JLBULUQOGDWWFY-RBUKOAKNSA-N	0	3	341.499	3.166	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cc4[nH]ccc4s3)C2)CC1	ZINC001086954359	1359274695	/nfs/dbraw/zinc/27/46/95/1359274695.db2.gz	JKCYJLQJABNWIJ-AWEZNQCLSA-N	0	3	341.480	3.179	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3cccc(OC)c3)C2)CC1	ZINC001086954411	1359274806	/nfs/dbraw/zinc/27/48/06/1359274806.db2.gz	KRVPZTOONBQAIR-QGZVFWFLSA-N	0	3	340.467	3.035	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)CCc3cccs3)C2)CC1	ZINC001086956902	1359277743	/nfs/dbraw/zinc/27/77/43/1359277743.db2.gz	ZVRGADOPUUDEDT-KRWDZBQOSA-N	0	3	344.524	3.407	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](CNCc2cc(C3CC3)no2)[C@@H](C)C1	ZINC001184079195	1387389905	/nfs/dbraw/zinc/38/99/05/1387389905.db2.gz	VBWOYMRWQDSGSF-HOCLYGCPSA-N	0	3	331.460	3.092	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3sccc3F)C(C)(C)[C@H]21	ZINC001087284926	1359364212	/nfs/dbraw/zinc/36/42/12/1359364212.db2.gz	QCNYINATMOWKOJ-WQVCFCJDSA-N	0	3	334.460	3.129	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc(F)ccc3F)C(C)(C)[C@H]21	ZINC001087289760	1359368434	/nfs/dbraw/zinc/36/84/34/1359368434.db2.gz	RQBLFEJFRIDIJL-JLSDUUJJSA-N	0	3	346.421	3.207	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1[nH]ccc1C1CC1	ZINC001087289893	1359368624	/nfs/dbraw/zinc/36/86/24/1359368624.db2.gz	UATCIHXURCKDSD-NZSAHSFTSA-N	0	3	339.483	3.134	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cscc3Cl)C(C)(C)[C@H]21	ZINC001087291467	1359370860	/nfs/dbraw/zinc/37/08/60/1359370860.db2.gz	VFCQRQGVRUIMTB-UGFHNGPFSA-N	0	3	336.888	3.254	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cccc2ncccc21	ZINC001087299051	1359381183	/nfs/dbraw/zinc/38/11/83/1359381183.db2.gz	PDSSRVQQTQQOKB-YZGWKJHDSA-N	0	3	347.462	3.087	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc[nH]c3C(C)C)C(C)(C)[C@H]21	ZINC001087300229	1359382205	/nfs/dbraw/zinc/38/22/05/1359382205.db2.gz	HYAQBQQQQOBFSE-QRQLOZEOSA-N	0	3	341.499	3.380	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc[nH]c3C(C)C)C(C)(C)[C@@H]21	ZINC001087300226	1359382230	/nfs/dbraw/zinc/38/22/30/1359382230.db2.gz	HYAQBQQQQOBFSE-BHIYHBOVSA-N	0	3	341.499	3.380	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3occc3Cl)C(C)(C)[C@@H]21	ZINC001087303320	1359385867	/nfs/dbraw/zinc/38/58/67/1359385867.db2.gz	JWFQVJXCHIZVML-DAXOMENPSA-N	0	3	334.847	3.175	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)Cc1cc(C)cc(C)c1	ZINC001087303653	1359386698	/nfs/dbraw/zinc/38/66/98/1359386698.db2.gz	PVGAKKNMDGDIFN-HLAWJBBLSA-N	0	3	338.495	3.084	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc4cc[nH]c43)C(C)(C)[C@@H]21	ZINC001087304700	1359388224	/nfs/dbraw/zinc/38/82/24/1359388224.db2.gz	GMCIKRSRQVBKNR-BHIYHBOVSA-N	0	3	335.451	3.020	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(C)cc(F)c3)C(C)(C)[C@H]21	ZINC001087304494	1359388395	/nfs/dbraw/zinc/38/83/95/1359388395.db2.gz	CPJRWFZSYIBJJY-QRVBRYPASA-N	0	3	342.458	3.376	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc[nH]c3C3CCC3)C(C)(C)[C@H]21	ZINC001087305565	1359391203	/nfs/dbraw/zinc/39/12/03/1359391203.db2.gz	VLBDJMLWZIEJIJ-NEWSRXKRSA-N	0	3	339.483	3.134	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cnc4ccccc4c3)C(C)(C)[C@H]21	ZINC001087307102	1359393680	/nfs/dbraw/zinc/39/36/80/1359393680.db2.gz	UBAQARWLFRFVFO-RLLQIKCJSA-N	0	3	347.462	3.087	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc2[nH]ccc2s1	ZINC001087316908	1359408263	/nfs/dbraw/zinc/40/82/63/1359408263.db2.gz	ZEFRJCFBHGQHHC-OAUYIBNBSA-N	0	3	341.480	3.081	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(Cl)cn3CC)C(C)(C)[C@H]21	ZINC001087319364	1359411166	/nfs/dbraw/zinc/41/11/66/1359411166.db2.gz	MMSPIIFOMGCONW-OIISXLGYSA-N	0	3	347.890	3.013	20	30		EGEDHN
C=CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1scnc1Cl	ZINC001087320014	1359413065	/nfs/dbraw/zinc/41/30/65/1359413065.db2.gz	XPJPSTGLKBJLLZ-KGYLQXTDSA-N	0	3	339.892	3.201	20	30		EGEDHN
C/C=C(/C)C(=O)N1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1CC#Cc1ccccc1	ZINC001087347780	1359428091	/nfs/dbraw/zinc/42/80/91/1359428091.db2.gz	KAFYTLSUOHVEJP-RTQXLAKASA-N	0	3	348.490	3.173	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)C2CC(C)C2)CCN1Cc1ccc(C#N)cc1	ZINC001087537141	1359519244	/nfs/dbraw/zinc/51/92/44/1359519244.db2.gz	ZGBRUOPSIHHXMV-SJROMKODSA-N	0	3	325.456	3.073	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)C2C=CC=CC=C2)CCN1Cc1ccc(C#N)cc1	ZINC001087589395	1359545969	/nfs/dbraw/zinc/54/59/69/1359545969.db2.gz	ZYICOUCFGFMFFY-LEWJYISDSA-N	0	3	347.462	3.326	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccc(N(C)C)cc2F)[C@H]1CC	ZINC001087601792	1359549275	/nfs/dbraw/zinc/54/92/75/1359549275.db2.gz	JZBCUJQHTPCTJP-ZWKOTPCHSA-N	0	3	333.451	3.051	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2coc3ccc(OC)cc32)[C@H]1CC	ZINC001087652635	1359572504	/nfs/dbraw/zinc/57/25/04/1359572504.db2.gz	CHKNOEBWBKUPIP-DLBZAZTESA-N	0	3	328.412	3.210	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)C(C)(C)C2CC2)CCN1Cc1ccc(C#N)cc1	ZINC001087694797	1359595316	/nfs/dbraw/zinc/59/53/16/1359595316.db2.gz	WCBHBYHOLFDGIE-RBUKOAKNSA-N	0	3	339.483	3.464	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)[C@@H](C)c2ccc(CC)cc2)[C@H]1CC	ZINC001087764509	1359634239	/nfs/dbraw/zinc/63/42/39/1359634239.db2.gz	TVRUKBWILHZYCZ-FFZOFVMBSA-N	0	3	326.484	3.345	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccnc(O[C@@H](C)CC)c2)[C@H]1CC	ZINC001087789248	1359646291	/nfs/dbraw/zinc/64/62/91/1359646291.db2.gz	GMUOMXFVQJXCDF-BHYGNILZSA-N	0	3	331.460	3.028	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)C2CC(c3ccc(F)cc3)C2)[C@H]1CC	ZINC001087849991	1359679813	/nfs/dbraw/zinc/67/98/13/1359679813.db2.gz	HLFUPNPCCSARTM-YVZJPGBNSA-N	0	3	330.447	3.474	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3csc4ccccc34)C[C@@H]2C1	ZINC001088056526	1359736963	/nfs/dbraw/zinc/73/69/63/1359736963.db2.gz	BQJPTNZJHXPMBP-CVEARBPZSA-N	0	3	338.476	3.319	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3cc4c(ccc(C)c4C)[nH]3)C[C@@H]2C1	ZINC001088064796	1359739661	/nfs/dbraw/zinc/73/96/61/1359739661.db2.gz	VQIBQXLQJMSRDL-MSOLQXFVSA-N	0	3	349.478	3.202	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)C34CCC(CC3)C4(C)C)C[C@@H]2C1	ZINC001088133536	1359769020	/nfs/dbraw/zinc/76/90/20/1359769020.db2.gz	NNZAKFKZOKZOPC-NSSZEPTDSA-N	0	3	328.500	3.006	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3ccc(Cl)c(CCC)c3)C[C@@H]2C1	ZINC001088168907	1359778641	/nfs/dbraw/zinc/77/86/41/1359778641.db2.gz	YFOKBIHRMFRMES-MSOLQXFVSA-N	0	3	344.886	3.320	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3cc4cc(C)c(C)cc4o3)C[C@@H]2C1	ZINC001088172033	1359779616	/nfs/dbraw/zinc/77/96/16/1359779616.db2.gz	SFNWBTNZOBADDQ-AEFFLSMTSA-N	0	3	336.435	3.077	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2scnc2CC)C1	ZINC001088323924	1359830726	/nfs/dbraw/zinc/83/07/26/1359830726.db2.gz	CFYOTVPFVVAIBI-ZDUSSCGKSA-N	0	3	341.908	3.432	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)Cc2cccnc2C)C1	ZINC001088381898	1359865472	/nfs/dbraw/zinc/86/54/72/1359865472.db2.gz	PNRAHQAKKVGDEI-QGZVFWFLSA-N	0	3	335.879	3.046	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2cc(CCC)on2)C1	ZINC001088407861	1359878971	/nfs/dbraw/zinc/87/89/71/1359878971.db2.gz	HEGDEJPAUPHLHQ-AWEZNQCLSA-N	0	3	339.867	3.354	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2c[nH]nc2C2CC2)C1	ZINC001088408278	1359879471	/nfs/dbraw/zinc/87/94/71/1359879471.db2.gz	RCAPDFLFTPZCHZ-CQSZACIVSA-N	0	3	336.867	3.014	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2sccc2OC)C1	ZINC001088415442	1359885474	/nfs/dbraw/zinc/88/54/74/1359885474.db2.gz	JPZZUDMRTACYSM-ZDUSSCGKSA-N	0	3	342.892	3.484	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)[C@@H]2CCCO[C@H]2c2ccccc2)[C@H]1C	ZINC001088630473	1359996880	/nfs/dbraw/zinc/99/68/80/1359996880.db2.gz	IJZJSYVCFVPOCT-LMCOJAPRSA-N	0	3	342.483	3.309	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCCN1C(=O)c1ccco1	ZINC001089105337	1360169485	/nfs/dbraw/zinc/16/94/85/1360169485.db2.gz	JCIJBBXLOWRZRB-SFHVURJKSA-N	0	3	337.423	3.278	20	30		EGEDHN
CC(C)CC(=O)N1CCCC[C@H]1CN(C)Cc1ccc(C#N)cc1	ZINC001089107525	1360171915	/nfs/dbraw/zinc/17/19/15/1360171915.db2.gz	GZGDBIZQMIWESF-IBGZPJMESA-N	0	3	327.472	3.417	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCCC[C@H]1CN(C)Cc1ccc(Cl)cc1	ZINC001089139676	1360197269	/nfs/dbraw/zinc/19/72/69/1360197269.db2.gz	JGFIKEGPEGDWKW-PBHICJAKSA-N	0	3	333.863	3.313	20	30		EGEDHN
N#C[C@@H]1CCCN(C(=O)[C@H]2CCCN(Cc3ccc(Cl)cc3)C2)C1	ZINC001184401216	1387448789	/nfs/dbraw/zinc/44/87/89/1387448789.db2.gz	HRNWQVMKYDLLKP-IRXDYDNUSA-N	0	3	345.874	3.314	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2nc(C(C)C)oc2C)CC(C)(C)C1	ZINC001089383853	1360385750	/nfs/dbraw/zinc/38/57/50/1360385750.db2.gz	KPWIEBUHMILYMT-INIZCTEOSA-N	0	3	345.487	3.350	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C[C@@H]2C[C@H]2c2ccccc2)CC(C)(C)C1	ZINC001089387231	1360388692	/nfs/dbraw/zinc/38/86/92/1360388692.db2.gz	XVYZBIXUVULKEG-ZCNNSNEGSA-N	0	3	338.495	3.420	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccnn2C(CC)CC)CC(C)(C)C1	ZINC001089402113	1360401293	/nfs/dbraw/zinc/40/12/93/1360401293.db2.gz	CHGURNJMXKRVAI-INIZCTEOSA-N	0	3	344.503	3.098	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc(C)n([C@@H](C)CC)n2)CC(C)(C)C1	ZINC001089427434	1360419855	/nfs/dbraw/zinc/41/98/55/1360419855.db2.gz	QHSYFKHMJQMEIO-RDJZCZTQSA-N	0	3	344.503	3.016	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2c(C)noc2C2CC2)CC(C)(C)C1	ZINC001089440308	1360430313	/nfs/dbraw/zinc/43/03/13/1360430313.db2.gz	NKBIDLTWNVKMOA-INIZCTEOSA-N	0	3	343.471	3.104	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@H]2CCc3cc(F)ccc32)CC(C)(C)C1	ZINC001089440482	1360430778	/nfs/dbraw/zinc/43/07/78/1360430778.db2.gz	OJVGHDACZZQGDT-HKUYNNGSSA-N	0	3	342.458	3.096	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(C)nc2C(C)C)CC(C)(C)C1	ZINC001089449443	1360437946	/nfs/dbraw/zinc/43/79/46/1360437946.db2.gz	IJTXUCUWGWNCMH-QGZVFWFLSA-N	0	3	341.499	3.367	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(F)c(Cl)c2)CC(C)(C)C1	ZINC001089476254	1360458925	/nfs/dbraw/zinc/45/89/25/1360458925.db2.gz	LVAJOVZSQLZDKC-CQSZACIVSA-N	0	3	336.838	3.333	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3cnc(C)o3)CC(C)(C)C2)C1	ZINC001089485479	1360466206	/nfs/dbraw/zinc/46/62/06/1360466206.db2.gz	MMAAJEAWHIJYQJ-MRXNPFEDSA-N	0	3	345.487	3.446	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(C3CC3)nc2C)CC(C)(C)C1	ZINC001089494354	1360471046	/nfs/dbraw/zinc/47/10/46/1360471046.db2.gz	MMALUMQKEQRYSW-KRWDZBQOSA-N	0	3	339.483	3.121	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc3ncsc3c2)CC(C)(C)C1	ZINC001089553183	1360503994	/nfs/dbraw/zinc/50/39/94/1360503994.db2.gz	USAJMYXFPWYJQT-OAHLLOKOSA-N	0	3	341.480	3.150	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cnc(C(C)C)s2)CC(C)(C)C1	ZINC001089569501	1360514621	/nfs/dbraw/zinc/51/46/21/1360514621.db2.gz	DFZBGNNTRQFDAB-CQSZACIVSA-N	0	3	333.501	3.120	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ncnc2sccc21	ZINC001089642093	1360555129	/nfs/dbraw/zinc/55/51/29/1360555129.db2.gz	BCFHEDZTJLSQMF-CYBMUJFWSA-N	0	3	344.484	3.098	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccccc1COC	ZINC001089664285	1360574274	/nfs/dbraw/zinc/57/42/74/1360574274.db2.gz	IATBLYAZTOSDSS-SFHVURJKSA-N	0	3	342.483	3.077	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1occ2c1CCOC2	ZINC001089676401	1360585060	/nfs/dbraw/zinc/58/50/60/1360585060.db2.gz	GBLBPLBCENDSBY-MRXNPFEDSA-N	0	3	346.471	3.149	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cccc(F)c1F	ZINC001089685396	1360591024	/nfs/dbraw/zinc/59/10/24/1360591024.db2.gz	CIDZTFFWMGUZEV-AWEZNQCLSA-N	0	3	334.410	3.209	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1sc(C)cc1OC	ZINC001089707768	1360610824	/nfs/dbraw/zinc/61/08/24/1360610824.db2.gz	SMQUHFYNVWGYKP-OAHLLOKOSA-N	0	3	348.512	3.309	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(C(C)C)nn1C	ZINC001089718680	1360621097	/nfs/dbraw/zinc/62/10/97/1360621097.db2.gz	STOOAWWFCRUVPW-MRXNPFEDSA-N	0	3	346.519	3.340	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(F)cc1C	ZINC001089723913	1360627143	/nfs/dbraw/zinc/62/71/43/1360627143.db2.gz	QBGLKANBLMRNRL-KRWDZBQOSA-N	0	3	330.447	3.378	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccccc1OCC	ZINC001089728790	1360631564	/nfs/dbraw/zinc/63/15/64/1360631564.db2.gz	CVTQITWJGZHVKA-QGZVFWFLSA-N	0	3	342.483	3.329	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(N(C)C)cc1	ZINC001089728800	1360631857	/nfs/dbraw/zinc/63/18/57/1360631857.db2.gz	CWZUFQVHHMPGJH-SFHVURJKSA-N	0	3	329.488	3.159	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)/C=C/c1ccco1	ZINC001089758504	1360651623	/nfs/dbraw/zinc/65/16/23/1360651623.db2.gz	RQBDNMKTULAWOR-BLTOQTHGSA-N	0	3	346.858	3.214	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)c2ccc(F)cc2)C1	ZINC001089760488	1360652877	/nfs/dbraw/zinc/65/28/77/1360652877.db2.gz	LQMJWHFVYPIVFJ-DKIMLUQUSA-N	0	3	348.849	3.361	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1CCCCC1	ZINC001089761003	1360653393	/nfs/dbraw/zinc/65/33/93/1360653393.db2.gz	QHBCOGLQACUDSN-FJIDUMEYSA-N	0	3	336.907	3.488	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)CCC1CCC1	ZINC001089789801	1360664074	/nfs/dbraw/zinc/66/40/74/1360664074.db2.gz	OFYKZYFLXUIDKU-MHORFTMASA-N	0	3	336.907	3.488	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)Cc1ccccc1	ZINC001089825290	1360681862	/nfs/dbraw/zinc/68/18/62/1360681862.db2.gz	AXMRPLKVGTUAPG-OKYOBFRVSA-N	0	3	344.886	3.150	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)[C@@H]2C[C@H]2CC(C)C)CC2(CCOCC2)C1	ZINC001089957082	1360765752	/nfs/dbraw/zinc/76/57/52/1360765752.db2.gz	HLGGMWUCKXAQPR-GUDVDZBRSA-N	0	3	348.531	3.232	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)[C@H](C)C2CCCC2)CC2(CCOCC2)C1	ZINC001089965112	1360769886	/nfs/dbraw/zinc/76/98/86/1360769886.db2.gz	VCXUXBRSJVLDIP-MJGOQNOKSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)c2cc(C)cc(C)c2)CC2(CCOCC2)C1	ZINC001089968176	1360771716	/nfs/dbraw/zinc/77/17/16/1360771716.db2.gz	KTFYNNAREBJTRN-LJQANCHMSA-N	0	3	342.483	3.090	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](CNCc2cc(C3CC3)no2)[C@H](C)C1	ZINC001184498812	1387474148	/nfs/dbraw/zinc/47/41/48/1387474148.db2.gz	VWMYFEKKWAEFTL-NVXWUHKLSA-N	0	3	345.487	3.483	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2c(F)ccc(C)c2F)C1	ZINC001091217317	1361010861	/nfs/dbraw/zinc/01/08/61/1361010861.db2.gz	SAUWNHRGRFLZFX-UHFFFAOYSA-N	0	3	328.790	3.124	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2scnc2C(C)C)C1	ZINC001091272463	1361027896	/nfs/dbraw/zinc/02/78/96/1361027896.db2.gz	NOXQFCMXVCTQNV-UHFFFAOYSA-N	0	3	327.881	3.117	20	30		EGEDHN
CCC(CC)C(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@@]2(C)C1	ZINC001091492819	1361121029	/nfs/dbraw/zinc/12/10/29/1361121029.db2.gz	HYWYROXMBULNAK-CTNGQTDRSA-N	0	3	339.483	3.275	20	30		EGEDHN
C[C@@]12CN(Cc3ccc(C#N)cc3)C[C@@H]1CN(C(=O)CC1CCC1)C2	ZINC001091568578	1361147676	/nfs/dbraw/zinc/14/76/76/1361147676.db2.gz	QTMZUMIXKDFNLT-CTNGQTDRSA-N	0	3	337.467	3.029	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CN(Cc3cccnc3C)C[C@@]2(C)C1	ZINC001091978048	1361265155	/nfs/dbraw/zinc/26/51/55/1361265155.db2.gz	FMNWJMOIQMKGKT-NRSPTQNISA-N	0	3	341.499	3.273	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3oc4ccccc4c3C)C[C@]2(C)C1	ZINC001092250992	1361341835	/nfs/dbraw/zinc/34/18/35/1361341835.db2.gz	KUJLTEJNDKYBON-IERDGZPVSA-N	0	3	336.435	3.158	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc(C(C)(C)C)s3)C[C@]2(C)C1	ZINC001092294306	1361356105	/nfs/dbraw/zinc/35/61/05/1361356105.db2.gz	PPXSUTMDRNUYIQ-QRWLVFNGSA-N	0	3	344.524	3.463	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1CNC(=O)C1CCCCC1	ZINC001092434437	1361381698	/nfs/dbraw/zinc/38/16/98/1361381698.db2.gz	UNRLQWCEXQELDY-WIYYLYMNSA-N	0	3	338.495	3.303	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)c2cccc(C)c2)CC1	ZINC001093352372	1361566048	/nfs/dbraw/zinc/56/60/48/1361566048.db2.gz	YWNOGLHJDHQRLA-FQEVSTJZSA-N	0	3	336.479	3.335	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)/C=C\c2ccco2)CC1	ZINC001093353009	1361566824	/nfs/dbraw/zinc/56/68/24/1361566824.db2.gz	OWVXUNISNXYDPF-PXDRNWIDSA-N	0	3	338.451	3.019	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C2CCC(=C)CC2)CC1	ZINC001093375881	1361586363	/nfs/dbraw/zinc/58/63/63/1361586363.db2.gz	DPQSAEBZBPJQAE-HXUWFJFHSA-N	0	3	340.511	3.459	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@H]2CCC2(C)C)CC1	ZINC001093376268	1361586375	/nfs/dbraw/zinc/58/63/75/1361586375.db2.gz	IFQFWNYKVQNSMQ-MSOLQXFVSA-N	0	3	328.500	3.149	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)c2occc2Cl)CC1	ZINC001093377111	1361587427	/nfs/dbraw/zinc/58/74/27/1361587427.db2.gz	GGFHNWBLPSSBQL-QGZVFWFLSA-N	0	3	346.858	3.273	20	30		EGEDHN
C[C@H](C(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1)C1CCC1	ZINC001093854491	1361705899	/nfs/dbraw/zinc/70/58/99/1361705899.db2.gz	ZDSYBXSHSFYNFF-GQIGUUNPSA-N	0	3	339.483	3.179	20	30		EGEDHN
C[C@@H](CC(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1)C1CC1	ZINC001094246149	1361759290	/nfs/dbraw/zinc/75/92/90/1361759290.db2.gz	SSCNNROKBSETFF-RZQQEMMASA-N	0	3	339.483	3.179	20	30		EGEDHN
O=C(NC[C@]12CCC[C@H]1N(CC#Cc1ccccc1)CC2)c1cc[nH]c1	ZINC001094422001	1361795007	/nfs/dbraw/zinc/79/50/07/1361795007.db2.gz	KMZBWQHQBIEMSU-IFMALSPDSA-N	0	3	347.462	3.041	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1C[C@H]2C[C@@H](C1)N(C(=O)[C@H]1C[C@H]3C[C@H]3C1)C2	ZINC001094982791	1361975327	/nfs/dbraw/zinc/97/53/27/1361975327.db2.gz	JHEICEXYIJIOJK-UYOAKOKDSA-N	0	3	349.478	3.073	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](NCc2ccnc(Cl)c2)C1	ZINC001184890360	1387554991	/nfs/dbraw/zinc/55/49/91/1387554991.db2.gz	LRVMYOIPQDANJM-MRXNPFEDSA-N	0	3	333.863	3.009	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1coc3ccc(CC)cc13)C2	ZINC001095420181	1362134257	/nfs/dbraw/zinc/13/42/57/1362134257.db2.gz	RDJMIUWZWFJDBC-MNEFBYGVSA-N	0	3	336.435	3.354	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc(F)cc3ccncc31)C2	ZINC001095429300	1362138003	/nfs/dbraw/zinc/13/80/03/1362138003.db2.gz	PSZGRUHOXIHNBO-MNEFBYGVSA-N	0	3	339.414	3.285	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1sc3nccn3c1C)C2	ZINC001095549765	1362167450	/nfs/dbraw/zinc/16/74/50/1362167450.db2.gz	ARTABHHYJQWNRO-ILXRZTDVSA-N	0	3	344.484	3.006	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1ccccc1OC(C)C)C2	ZINC001096165868	1362410490	/nfs/dbraw/zinc/41/04/90/1362410490.db2.gz	VFTGJKIQUURZDU-QYZOEREBSA-N	0	3	342.483	3.314	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@H]1OCCc3ccsc31)C2	ZINC001096376112	1362479328	/nfs/dbraw/zinc/47/93/28/1362479328.db2.gz	QRAULQXDYJFYAQ-LTIDMASMSA-N	0	3	346.496	3.050	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](CNCc2ncc(C)s2)[C@H](C)C1	ZINC001184970170	1387576484	/nfs/dbraw/zinc/57/64/84/1387576484.db2.gz	UEQSEWIVPXBFAS-WBVHZDCISA-N	0	3	347.528	3.219	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1coc3ccc(Cl)cc13)C2	ZINC001096452232	1362516909	/nfs/dbraw/zinc/51/69/09/1362516909.db2.gz	ZXIZBNLQHFQETI-COXVUDFISA-N	0	3	342.826	3.445	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc3c(cccc3OC)[nH]1)C2	ZINC001096538903	1362564423	/nfs/dbraw/zinc/56/44/23/1362564423.db2.gz	QTEGRSBOPRLWOB-SKDZVZGDSA-N	0	3	339.439	3.088	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(N(C)CCC)cc1)C2	ZINC001096666640	1362624706	/nfs/dbraw/zinc/62/47/06/1362624706.db2.gz	OSEONLPMNGZJMX-AABGKKOBSA-N	0	3	341.499	3.444	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H](NCc2cn(C(C)C)nc2C)C1	ZINC001185057201	1387602161	/nfs/dbraw/zinc/60/21/61/1387602161.db2.gz	ZYFNGRSARRBIKY-MAUKXSAKSA-N	0	3	332.492	3.065	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](CNCc2cc(C3CC3)no2)[C@@H](C)C1	ZINC001185062050	1387605295	/nfs/dbraw/zinc/60/52/95/1387605295.db2.gz	QHXNQGYUSDKMPH-DOTOQJQBSA-N	0	3	345.487	3.483	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@@H](NCc2ccccc2N(C)C)C1	ZINC001185063706	1387606487	/nfs/dbraw/zinc/60/64/87/1387606487.db2.gz	GVOCCLHYTGOXCK-FUHWJXTLSA-N	0	3	329.488	3.045	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H]1CCc3c1cccc3Cl)C2	ZINC001097554640	1363054957	/nfs/dbraw/zinc/05/49/57/1363054957.db2.gz	OOQZGELZUAUBBQ-HQJJXPTPSA-N	0	3	342.870	3.115	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc3cc(F)ccc3[nH]1)C2	ZINC001097619966	1363077569	/nfs/dbraw/zinc/07/75/69/1363077569.db2.gz	UKDOEXPRCFFTJG-KYJSFNMBSA-N	0	3	327.403	3.218	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1oc(C3CC3)nc1C)C2	ZINC001098002731	1363194175	/nfs/dbraw/zinc/19/41/75/1363194175.db2.gz	TVSGWQYMGWKMRW-OAGGEKHMSA-N	0	3	329.444	3.162	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@H]1CCCc3ccccc31)C2	ZINC001098263519	1363278457	/nfs/dbraw/zinc/27/84/57/1363278457.db2.gz	YAMZOHWUDDFGDB-UKAVVXHISA-N	0	3	336.479	3.241	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1c[nH]c3c1cccc3CC)C2	ZINC001098464592	1363333159	/nfs/dbraw/zinc/33/31/59/1363333159.db2.gz	OMYGKQYMVXTOHB-LZQZEXGQSA-N	0	3	335.451	3.089	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1c[nH]c3ccc(F)cc13)C2	ZINC001098505397	1363346157	/nfs/dbraw/zinc/34/61/57/1363346157.db2.gz	VGYDLEMBLIJGCN-XWIAVFTESA-N	0	3	327.403	3.218	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@@H]1C=CCCC1)C[C@@H](C)O2	ZINC001098604815	1363395548	/nfs/dbraw/zinc/39/55/48/1363395548.db2.gz	BOMBBANZOWZJSI-QZTJIDSGSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1cccc(C)c1C)C[C@H](C)O2	ZINC001098658672	1363423123	/nfs/dbraw/zinc/42/31/23/1363423123.db2.gz	FREOCUSTBIGTGS-KRWDZBQOSA-N	0	3	342.483	3.185	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](NC(=O)C2CCC2)C2CCCC2)c(F)c1	ZINC001324452984	1387626272	/nfs/dbraw/zinc/62/62/72/1387626272.db2.gz	YZHJTVLZNHNURV-LJQANCHMSA-N	0	3	343.446	3.262	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CCC[C@]3(NC(=O)[C@H]3[C@@H]4CCC[C@@H]43)C2)c1	ZINC001098777360	1363464600	/nfs/dbraw/zinc/46/46/00/1363464600.db2.gz	AONWJRAWVOHCLC-WXOXAHCZSA-N	0	3	349.478	3.075	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cscc2C(F)F)C1	ZINC001098840182	1363488540	/nfs/dbraw/zinc/48/85/40/1363488540.db2.gz	HTQRNSABVOISPM-ZBEGNZNMSA-N	0	3	326.412	3.456	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@]23CCC[C@H]2CN(CC=C)C3)cc1	ZINC001098909255	1363515260	/nfs/dbraw/zinc/51/52/60/1363515260.db2.gz	ZNSPJQDOQIAPOP-PXNSSMCTSA-N	0	3	326.440	3.022	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cnc3c(F)cccc3c2)C1	ZINC001098945044	1363533576	/nfs/dbraw/zinc/53/35/76/1363533576.db2.gz	QVCDGKWUZIOABJ-JXFKEZNVSA-N	0	3	339.414	3.144	20	30		EGEDHN
C#CCCCC(=O)NC[C@@H]1CCC(C)(C)CN1CCOCCCC	ZINC001099043559	1363590770	/nfs/dbraw/zinc/59/07/70/1363590770.db2.gz	PXIOEXKVURZFFI-SFHVURJKSA-N	0	3	336.520	3.213	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)Cc2c[nH]c3c2cccc3C)C1	ZINC001099060226	1363601211	/nfs/dbraw/zinc/60/12/11/1363601211.db2.gz	WGBOKXFSAUKYIN-AVRDEDQJSA-N	0	3	349.478	3.013	20	30		EGEDHN
C=C(Cl)CN1CC(C)(C)CC[C@@H]1CNC(=O)C(C)(C)N(C)CC	ZINC001099130348	1363642980	/nfs/dbraw/zinc/64/29/80/1363642980.db2.gz	KGALHHQHCNEFOB-OAHLLOKOSA-N	0	3	343.943	3.076	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H](C)c1c(C)noc1C	ZINC001099271355	1363725207	/nfs/dbraw/zinc/72/52/07/1363725207.db2.gz	XCUHKNJFCOAVLA-CZUORRHYSA-N	0	3	333.476	3.188	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)Cc1ccc(OC)cc1F	ZINC001099291795	1363735210	/nfs/dbraw/zinc/73/52/10/1363735210.db2.gz	MVCBZZZZRQHSAA-INIZCTEOSA-N	0	3	348.462	3.170	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2cc(C)c(CC)o2)C[C@H]1C(F)(F)F	ZINC001099331327	1363754390	/nfs/dbraw/zinc/75/43/90/1363754390.db2.gz	ZWRSWDFABHPKLL-CHWSQXEVSA-N	0	3	344.377	3.319	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2sccc2C2CC2)C[C@H]1C(F)(F)F	ZINC001099339506	1363759908	/nfs/dbraw/zinc/75/99/08/1363759908.db2.gz	AZGWHKYBWLCYDH-CHWSQXEVSA-N	0	3	344.402	3.404	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H](OC)c1ccc(F)cc1	ZINC001099357926	1363771265	/nfs/dbraw/zinc/77/12/65/1363771265.db2.gz	BTFSYXURNPAHLC-QZTJIDSGSA-N	0	3	348.462	3.306	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)COCCc1ccccc1	ZINC001099363625	1363774754	/nfs/dbraw/zinc/77/47/54/1363774754.db2.gz	AGOJYUSTDZNUHM-IBGZPJMESA-N	0	3	344.499	3.039	20	30		EGEDHN
CC[C@H](F)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2ccccc2C#N)C1	ZINC001099478038	1363813007	/nfs/dbraw/zinc/81/30/07/1363813007.db2.gz	OEUHZAZPDQSFKH-BJLQDIEVSA-N	0	3	343.446	3.025	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)C[C@H](CC)C(C)C)CC2(CCOCC2)C1	ZINC001099596417	1363878851	/nfs/dbraw/zinc/87/88/51/1363878851.db2.gz	BKVRUJJECXHHIR-ROUUACIJSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1CCN(Cc2ccc(C(C)C)cc2)C[C@@H]1O	ZINC001099855152	1363965293	/nfs/dbraw/zinc/96/52/93/1363965293.db2.gz	CZAXKXUYJKXFAF-PMACEKPBSA-N	0	3	344.499	3.218	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C[C@@H](C)CC)C[C@H]1c1ccc(OC)cc1	ZINC001100159798	1364031235	/nfs/dbraw/zinc/03/12/35/1364031235.db2.gz	NUMVURYJASEZIB-FFZOFVMBSA-N	0	3	342.483	3.039	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCC1CC(NCc2cccc(Cl)c2Cl)C1	ZINC001100196686	1364041967	/nfs/dbraw/zinc/04/19/67/1364041967.db2.gz	QBAIXNPUDCUXBW-ZBOXLXRLSA-N	0	3	340.254	3.137	20	30		EGEDHN
O=C(NCC1CC(NCC#Cc2ccccc2)C1)C(F)=C1CCCC1	ZINC001100244994	1364056341	/nfs/dbraw/zinc/05/63/41/1364056341.db2.gz	MUZJNSBSJRHCDC-UHFFFAOYSA-N	0	3	340.442	3.320	20	30		EGEDHN
CC(C(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1)=C1CCC1	ZINC001100312366	1364077191	/nfs/dbraw/zinc/07/71/91/1364077191.db2.gz	LQMTZYNRIUJLAY-UHFFFAOYSA-N	0	3	340.442	3.162	20	30		EGEDHN
CC[C@H](CC(F)F)C(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100398004	1364102207	/nfs/dbraw/zinc/10/22/07/1364102207.db2.gz	QKEHJTXMSGDQNV-LXPRWKDFSA-N	0	3	348.437	3.204	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)[C@@](C)(F)CCCC)C1	ZINC001100461154	1364122916	/nfs/dbraw/zinc/12/29/16/1364122916.db2.gz	MXNOVJLXSAOWDU-PIMMBPRGSA-N	0	3	349.288	3.298	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCC1CC(NCc2cnc(Cl)s2)C1	ZINC001100596332	1364181212	/nfs/dbraw/zinc/18/12/12/1364181212.db2.gz	PGXMUFJRYCQSGX-HIFPTAJRSA-N	0	3	341.908	3.383	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H](c2ccncc2)C(C)C)C1	ZINC001100611104	1364187660	/nfs/dbraw/zinc/18/76/60/1364187660.db2.gz	KKVSMRXASLZDSY-BDVYOWHSSA-N	0	3	335.879	3.058	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC1CC(NCc2c(C)nsc2C)C1	ZINC001100645146	1364202855	/nfs/dbraw/zinc/20/28/55/1364202855.db2.gz	VYZKSVDHIAGEJU-JMLCCBQJSA-N	0	3	335.517	3.347	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)NCC1CC(NCC#Cc2cccc(Cl)c2)C1	ZINC001100724260	1364235853	/nfs/dbraw/zinc/23/58/53/1364235853.db2.gz	RGZVYPJAYPIBHB-LSJNQWAISA-N	0	3	346.902	3.468	20	30		EGEDHN
CC[C@@H](C)CCC(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100780354	1364259452	/nfs/dbraw/zinc/25/94/52/1364259452.db2.gz	NZPSOQBNLLTYEH-QHGAOEGBSA-N	0	3	326.484	3.349	20	30		EGEDHN
Cc1ccc(CN2C[C@@H]3CN(C(=O)C#CC(C)C)C[C@]3(C)C2)cc1F	ZINC001101229553	1364475985	/nfs/dbraw/zinc/47/59/85/1364475985.db2.gz	FODZDMMFHAPGCF-NQIIRXRSSA-N	0	3	342.458	3.074	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@H]2CN(Cc3cccnc3)C[C@@]2(C)C1	ZINC001101248686	1364485190	/nfs/dbraw/zinc/48/51/90/1364485190.db2.gz	OXGUZJNDFIXMBY-CTNGQTDRSA-N	0	3	339.483	3.130	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@H]2CN(Cc3cnccc3C)C[C@@]2(C)C1	ZINC001101253027	1364487278	/nfs/dbraw/zinc/48/72/78/1364487278.db2.gz	AJJYESSMLPRCLY-QUCCMNQESA-N	0	3	327.472	3.027	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@H]2CN(Cc3ccccc3F)C[C@@]2(C)C1	ZINC001101253204	1364487412	/nfs/dbraw/zinc/48/74/12/1364487412.db2.gz	ISNUAKBICXLWRR-XLIONFOSSA-N	0	3	330.447	3.462	20	30		EGEDHN
C#CCCCCCC(=O)N1C[C@H]2CN(CCC(F)(F)F)C[C@@]2(C)C1	ZINC001101325338	1364509457	/nfs/dbraw/zinc/50/94/57/1364509457.db2.gz	OWPSVMHCVIMZOH-WBVHZDCISA-N	0	3	344.421	3.303	20	30		EGEDHN
CC#CCCCC(=O)N1C[C@H]2CN(Cc3ccc(C#N)cc3)C[C@@]2(C)C1	ZINC001101333033	1364513500	/nfs/dbraw/zinc/51/35/00/1364513500.db2.gz	FUFXXRBJZXZAQR-IRLDBZIGSA-N	0	3	349.478	3.032	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@H]2CN(Cc3scnc3C)C[C@@]2(C)C1	ZINC001101337769	1364516245	/nfs/dbraw/zinc/51/62/45/1364516245.db2.gz	KTDVLBRGTPFZIO-FCEWJHQRSA-N	0	3	347.528	3.334	20	30		EGEDHN
C=CCC[C@H](C)N1CC2(C1)C[C@@H](NC(=O)C(CC)CC)c1nccn12	ZINC001101610107	1364654520	/nfs/dbraw/zinc/65/45/20/1364654520.db2.gz	GUQZPBVYPYKUJK-DOTOQJQBSA-N	0	3	344.503	3.246	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1CNC(=O)CC1CCCC1	ZINC001101692258	1364691703	/nfs/dbraw/zinc/69/17/03/1364691703.db2.gz	HKHAHOACSLDNQL-WIYYLYMNSA-N	0	3	338.495	3.303	20	30		EGEDHN
CC(C)CCC(=O)NC[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1C	ZINC001101710129	1364699407	/nfs/dbraw/zinc/69/94/07/1364699407.db2.gz	UWKXHBGLIDTEMP-IEBWSBKVSA-N	0	3	344.474	3.298	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NC[C@@H]1CN(Cc2cccnc2)C[C@H]1C	ZINC001102002671	1364807994	/nfs/dbraw/zinc/80/79/94/1364807994.db2.gz	VXWPLCWHWJRPQT-CZUORRHYSA-N	0	3	335.879	3.044	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H]1CN(Cc2c(C)onc2CC)C[C@H]1C	ZINC001102010598	1364810576	/nfs/dbraw/zinc/81/05/76/1364810576.db2.gz	GUIAWJAOLBCRGG-GDBMZVCRSA-N	0	3	333.476	3.086	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1CNC(=O)C(C)(C)C1CC1	ZINC001102264268	1364976510	/nfs/dbraw/zinc/97/65/10/1364976510.db2.gz	CJJBPVAOVPXOGR-IEBWSBKVSA-N	0	3	338.495	3.158	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cscc2C)C1	ZINC001102832898	1365243195	/nfs/dbraw/zinc/24/31/95/1365243195.db2.gz	JKGHQGBADPXZRU-BXUZGUMPSA-N	0	3	326.893	3.497	20	30		EGEDHN
CC(C)C#CC(=O)NCC[C@@H]1CN(Cc2ccc(F)c(F)c2)C[C@H]1C	ZINC001102956378	1365316279	/nfs/dbraw/zinc/31/62/79/1365316279.db2.gz	ZSCMHVVAGWAMOW-NVXWUHKLSA-N	0	3	348.437	3.198	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCC[C@@H]1CN(Cc2ccns2)C[C@H]1C	ZINC001103033600	1365348513	/nfs/dbraw/zinc/34/85/13/1365348513.db2.gz	UMRHLBJIJQNIHC-HUUCEWRRSA-N	0	3	335.517	3.320	20	30		EGEDHN
C=C(C)CCC(=O)NCC[C@@H]1CN(Cc2ccc(F)cn2)C[C@H]1C	ZINC001103040194	1365350943	/nfs/dbraw/zinc/35/09/43/1365350943.db2.gz	KAECWXFYIUDUHJ-HZPDHXFCSA-N	0	3	333.451	3.151	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2c(C)cncc2C)C1	ZINC001103225663	1365444816	/nfs/dbraw/zinc/44/48/16/1365444816.db2.gz	OBIXPPKRAJBXGC-GDBMZVCRSA-N	0	3	335.879	3.139	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCC[C@@H]1CN(Cc2cncs2)C[C@H]1C	ZINC001103344474	1365509805	/nfs/dbraw/zinc/50/98/05/1365509805.db2.gz	LFSMWNQQKCNTMT-BZUAXINKSA-N	0	3	335.517	3.320	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2csc(C#N)c2)CN1Cc1ccccc1	ZINC001324709083	1387746415	/nfs/dbraw/zinc/74/64/15/1387746415.db2.gz	WDIOMLGIQRFLRW-CJNGLKHVSA-N	0	3	325.437	3.013	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1CCNC(=O)C(C)(C)C	ZINC001103667606	1365715567	/nfs/dbraw/zinc/71/55/67/1365715567.db2.gz	FFXBWXZQODEXDA-NVXWUHKLSA-N	0	3	327.472	3.179	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)COCCCCCC)C1	ZINC001103674945	1365721348	/nfs/dbraw/zinc/72/13/48/1365721348.db2.gz	FVPDTWCQBBHPCC-NVXWUHKLSA-N	0	3	344.927	3.410	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CCC2)C[C@H]1CCNCc1ccc(C#N)cc1F	ZINC001103810652	1365791634	/nfs/dbraw/zinc/79/16/34/1365791634.db2.gz	ZPTBTPCVOVQRCG-RDTXWAMCSA-N	0	3	343.446	3.072	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2CC2)C[C@H]1CCNCc1ccc(C#N)cc1F	ZINC001103814667	1365794651	/nfs/dbraw/zinc/79/46/51/1365794651.db2.gz	KCOWDHGYQVRWRM-RDTXWAMCSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@H](CCNCc2cccc(OCC)n2)C1	ZINC001103979423	1365857781	/nfs/dbraw/zinc/85/77/81/1365857781.db2.gz	PRVKKKRXIFCSKT-IAGOWNOFSA-N	0	3	345.487	3.021	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@H]2CC2(C)C)C[C@H]1CCNCc1ccccc1C#N	ZINC001104084164	1365905674	/nfs/dbraw/zinc/90/56/74/1365905674.db2.gz	YRWXRHAHKNTRFR-ATZDWAIDSA-N	0	3	339.483	3.179	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cc(C)cs2)C[C@H]1C	ZINC001104158527	1365930141	/nfs/dbraw/zinc/93/01/41/1365930141.db2.gz	VBFPQBZWUQCZJB-TZMCWYRMSA-N	0	3	326.893	3.497	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H](C)[C@H](CCNCc2cc(C)no2)C1	ZINC001104563843	1366078809	/nfs/dbraw/zinc/07/88/09/1366078809.db2.gz	WZWUNVDRYIUSRN-BFYDXBDKSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H](C)[C@H](CCNCc2oc(C)nc2C)C1	ZINC001104631631	1366110796	/nfs/dbraw/zinc/11/07/96/1366110796.db2.gz	VNSYWAYRXCTITH-ZTQAJYAQSA-N	0	3	347.503	3.468	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2c(C)nsc2C)C[C@H]1C	ZINC001105076223	1366309579	/nfs/dbraw/zinc/30/95/79/1366309579.db2.gz	QBAQIFOGQIUDJA-QMTHXVAHSA-N	0	3	341.908	3.200	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cc3n(c2)CCCC3)C[C@H]1C	ZINC001105123905	1366337422	/nfs/dbraw/zinc/33/74/22/1366337422.db2.gz	BSVXFGXYKKYDBG-GDBMZVCRSA-N	0	3	349.906	3.265	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C=C(CC)CC)CC1	ZINC001105391808	1366439628	/nfs/dbraw/zinc/43/96/28/1366439628.db2.gz	MQTFYNQXVCEGBS-HXUWFJFHSA-N	0	3	328.500	3.459	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C/C=C(/C)C=C)CC1	ZINC001105394316	1366443337	/nfs/dbraw/zinc/44/33/37/1366443337.db2.gz	UIEDPIOPBDGRQW-KLBHJJEPSA-N	0	3	326.484	3.235	20	30		EGEDHN
CC/C(C)=C/C(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001106093862	1366611019	/nfs/dbraw/zinc/61/10/19/1366611019.db2.gz	NXPINFJIJQMLMU-LCINHOFUSA-N	0	3	325.456	3.099	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H](CNCc2nccs2)[C@H](C)C1	ZINC001106175429	1366616602	/nfs/dbraw/zinc/61/66/02/1366616602.db2.gz	COGFMDGSMBUYOP-GDBMZVCRSA-N	0	3	333.501	3.096	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H](CNCc2ncc(C)s2)[C@H](C)C1	ZINC001106563960	1366737158	/nfs/dbraw/zinc/73/71/58/1366737158.db2.gz	NYRMQYWIDHZSNT-IIAWOOMASA-N	0	3	335.517	3.238	20	30		EGEDHN
CC(F)(F)C(=O)NC[C@]12CCC[C@H]1N(CC#Cc1ccccc1)CC2	ZINC001107259444	1366907511	/nfs/dbraw/zinc/90/75/11/1366907511.db2.gz	FCWPOLIYJKNZKE-YLJYHZDGSA-N	0	3	346.421	3.054	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC[C@]12CCC[C@H]1N(C/C=C/Cl)CC2	ZINC001107318623	1366925638	/nfs/dbraw/zinc/92/56/38/1366925638.db2.gz	SFIFLZHNLUCGFA-FAMACXKFSA-N	0	3	340.895	3.081	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](N(C)CCOc2ccccc2Cl)C1	ZINC001189319332	1366988270	/nfs/dbraw/zinc/98/82/70/1366988270.db2.gz	XGQWIFVZOBIYHG-HNNXBMFYSA-N	0	3	336.863	3.218	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccc2ncccc2c1	ZINC001109208690	1367003724	/nfs/dbraw/zinc/00/37/24/1367003724.db2.gz	YNPUWPXQSGZQEY-GIVPXCGWSA-N	0	3	347.462	3.260	20	30		EGEDHN
CCC[C@H](C)C(=O)N1CC[C@@H](N(C)Cc2ccc(OC)c(C#N)c2)C1	ZINC001189462555	1367029753	/nfs/dbraw/zinc/02/97/53/1367029753.db2.gz	XJHUPBOZOOGCCK-MAUKXSAKSA-N	0	3	343.471	3.036	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCc1ccc(OCC)cc1)C2	ZINC001109480161	1367149154	/nfs/dbraw/zinc/14/91/54/1367149154.db2.gz	WJRHNMZKWKLSIV-HOJAQTOUSA-N	0	3	342.483	3.316	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)CC2=CCCCC2)C1	ZINC001107813104	1367157117	/nfs/dbraw/zinc/15/71/17/1367157117.db2.gz	NOXTXUCCGXNGLM-PXNSSMCTSA-N	0	3	334.504	3.439	20	30		EGEDHN
CCCOc1cccc(CN(C)[C@H]2CCN(C(=O)C#CC(C)C)C2)c1	ZINC001190055352	1367162418	/nfs/dbraw/zinc/16/24/18/1367162418.db2.gz	XYAUFUXHRAGLPJ-IBGZPJMESA-N	0	3	342.483	3.168	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)C(C)=C2CCCC2)C1	ZINC001107859892	1367179074	/nfs/dbraw/zinc/17/90/74/1367179074.db2.gz	GKSBHPSQXDKUKV-JXFKEZNVSA-N	0	3	334.504	3.439	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)C(F)=C2CCCC2)C1	ZINC001107868627	1367184791	/nfs/dbraw/zinc/18/47/91/1367184791.db2.gz	VFMITVVJWLLLJM-BEFAXECRSA-N	0	3	338.467	3.346	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)C(F)=C2CCCC2)C1	ZINC001107868628	1367184878	/nfs/dbraw/zinc/18/48/78/1367184878.db2.gz	VFMITVVJWLLLJM-DNVCBOLYSA-N	0	3	338.467	3.346	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CC1CC(F)(F)C1	ZINC001109604519	1367227202	/nfs/dbraw/zinc/22/72/02/1367227202.db2.gz	MFYPIEDTZJFVAJ-IKGGRYGDSA-N	0	3	338.442	3.337	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)C2(CC(C)C)CC2)C1	ZINC001107989421	1367231880	/nfs/dbraw/zinc/23/18/80/1367231880.db2.gz	RTXPZRKOTYNXRU-HKUYNNGSSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](N(C)C[C@@H]2CC(C)(C)CO2)C1	ZINC001190353642	1367235780	/nfs/dbraw/zinc/23/57/80/1367235780.db2.gz	BBHAEANLQJCMSE-MSOLQXFVSA-N	0	3	334.504	3.103	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](N(C)CCOc2ccccc2)C1	ZINC001190387436	1367247344	/nfs/dbraw/zinc/24/73/44/1367247344.db2.gz	DLTYBWKKGSQJPX-KRWDZBQOSA-N	0	3	330.472	3.200	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](N(C)CCOCc2ccccc2)C1	ZINC001190436625	1367264872	/nfs/dbraw/zinc/26/48/72/1367264872.db2.gz	YQCKWPOFLHBIRA-LJQANCHMSA-N	0	3	330.472	3.092	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3CCCOC(C)C)CC1	ZINC001109682240	1367279438	/nfs/dbraw/zinc/27/94/38/1367279438.db2.gz	YYVLZCJAWQGUBW-SQNIBIBYSA-N	0	3	334.504	3.269	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2cc(F)ccc2C)C1	ZINC001108106965	1367285879	/nfs/dbraw/zinc/28/58/79/1367285879.db2.gz	MRMGLDQUXOCLQL-JXFKEZNVSA-N	0	3	348.462	3.310	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@H](C)c1cccc(F)c1)C2	ZINC001109706854	1367288116	/nfs/dbraw/zinc/28/81/16/1367288116.db2.gz	XENNWHRFZZGVMH-VLQPXKRTSA-N	0	3	328.431	3.064	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@@]1(C)CN(CC2CCCCC2)CCO1	ZINC001108129861	1367296685	/nfs/dbraw/zinc/29/66/85/1367296685.db2.gz	PFKMNQDMSIZCOG-NRFANRHFSA-N	0	3	348.531	3.358	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@H](N(C)Cc3ccc(CF)cc3)C2)CCC1	ZINC001190595033	1367302089	/nfs/dbraw/zinc/30/20/89/1367302089.db2.gz	MYXJOMQBEOEQCO-IBGZPJMESA-N	0	3	342.458	3.382	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)C2CC3(CCC3)C2)C1	ZINC001108141800	1367304777	/nfs/dbraw/zinc/30/47/77/1367304777.db2.gz	DMMFKXDTEUQXQY-LPHOPBHVSA-N	0	3	334.504	3.129	20	30		EGEDHN
CC#CCCCC(=O)NC[C@]1(C)CN(CC2CCCCCC2)CCO1	ZINC001108144190	1367306274	/nfs/dbraw/zinc/30/62/74/1367306274.db2.gz	MATBHVANHVUFDI-OAQYLSRUSA-N	0	3	348.531	3.358	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@]1(C)CN(CC2CCCCCC2)CCO1	ZINC001108144189	1367306612	/nfs/dbraw/zinc/30/66/12/1367306612.db2.gz	MATBHVANHVUFDI-NRFANRHFSA-N	0	3	348.531	3.358	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@]1(C)CN(CC2CCCCC2)CCO1	ZINC001108149407	1367310699	/nfs/dbraw/zinc/31/06/99/1367310699.db2.gz	VLIQVYVWINYXDX-YLJYHZDGSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)C2CCC(=C)CC2)C1	ZINC001108186379	1367330156	/nfs/dbraw/zinc/33/01/56/1367330156.db2.gz	OMXIOYACLIURCK-PXNSSMCTSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@@]1(C)CN(CC2CC(C)(C)C2)CCO1	ZINC001108246424	1367360139	/nfs/dbraw/zinc/36/01/39/1367360139.db2.gz	MGUBPFWEGCHMLG-FQEVSTJZSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)CC(C2CC2)C2CC2)C1	ZINC001108422147	1367446909	/nfs/dbraw/zinc/44/69/09/1367446909.db2.gz	IXSJBWLAXXZDBU-IIBYNOLFSA-N	0	3	348.531	3.375	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CC(C)(C)c1ccc(C)cc1)C2	ZINC001110076240	1367495223	/nfs/dbraw/zinc/49/52/23/1367495223.db2.gz	MZAQUGOWCKKLQH-AABGKKOBSA-N	0	3	338.495	3.408	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCCc1cc(C)sc1C)C2	ZINC001110170680	1367541134	/nfs/dbraw/zinc/54/11/34/1367541134.db2.gz	QDPNPXZRVIIAEO-QYZOEREBSA-N	0	3	344.524	3.432	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](C)Cc1ccc(C)cc1)C2	ZINC001110170559	1367541965	/nfs/dbraw/zinc/54/19/65/1367541965.db2.gz	KFERKKOVCSBAPA-LMCOJAPRSA-N	0	3	326.484	3.471	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@@H](C)c1cccc(OC)c1)C2	ZINC001110174909	1367545172	/nfs/dbraw/zinc/54/51/72/1367545172.db2.gz	DADJTZNTAHKGLV-BEKAIBRUSA-N	0	3	342.483	3.486	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1cccc(CC)c1	ZINC001110178301	1367547679	/nfs/dbraw/zinc/54/76/79/1367547679.db2.gz	XMKWXEPUAUGGAI-AABGKKOBSA-N	0	3	342.483	3.063	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1cc(C)ccc1C	ZINC001110183135	1367551878	/nfs/dbraw/zinc/55/18/78/1367551878.db2.gz	KYXZBBUPPIORQM-RNQOJCNYSA-N	0	3	342.483	3.116	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@H](N(C)CCc2scnc2C)C1	ZINC001191889443	1367625946	/nfs/dbraw/zinc/62/59/46/1367625946.db2.gz	GLULCFRUFCJPHC-HOTGVXAUSA-N	0	3	335.517	3.129	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](N(C)Cc2ccc(COC)cc2)C1	ZINC001192073307	1367680411	/nfs/dbraw/zinc/68/04/11/1367680411.db2.gz	SEWDDWGYGRVAMA-IBGZPJMESA-N	0	3	330.472	3.222	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](N(C)CCOc2ccc(F)cc2)C1	ZINC001192163395	1367705297	/nfs/dbraw/zinc/70/52/97/1367705297.db2.gz	WKPRXVJLNKLSQW-YLJYHZDGSA-N	0	3	348.462	3.340	20	30		EGEDHN
CCCC1(C(=O)N2CC[C@@H](N(C)Cc3cccc(C#N)c3)C2)CC1	ZINC001192245618	1367728514	/nfs/dbraw/zinc/72/85/14/1367728514.db2.gz	GJSGLXRTOKZDOV-GOSISDBHSA-N	0	3	325.456	3.171	20	30		EGEDHN
CCCC1(C(=O)N2CC[C@@H](N(C)Cc3ccc(C#N)cc3)C2)CC1	ZINC001192256366	1367730904	/nfs/dbraw/zinc/73/09/04/1367730904.db2.gz	GVOWKIWVCIZKGF-GOSISDBHSA-N	0	3	325.456	3.171	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](N(C)CCOc3ccccc3C)C2)C1	ZINC001192257048	1367732418	/nfs/dbraw/zinc/73/24/18/1367732418.db2.gz	LSUBIVWNDDRZSB-SFHVURJKSA-N	0	3	342.483	3.263	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCCc1ccsc1	ZINC001110534356	1367814170	/nfs/dbraw/zinc/81/41/70/1367814170.db2.gz	XPSJEWVOJSKKDG-KURKYZTESA-N	0	3	330.497	3.062	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CC/C=C\c1ccccc1	ZINC001110538204	1367817966	/nfs/dbraw/zinc/81/79/66/1367817966.db2.gz	RXAVDHLIKWNPGY-KMSCTXATSA-N	0	3	336.479	3.471	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](N(C)CCOc2ccccc2)C1	ZINC001192577359	1367823142	/nfs/dbraw/zinc/82/31/42/1367823142.db2.gz	FOSXXABGOQPOSQ-QGZVFWFLSA-N	0	3	330.472	3.200	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2C[C@@H]1CCCCO1	ZINC001110595467	1367854972	/nfs/dbraw/zinc/85/49/72/1367854972.db2.gz	RNGDNIZUHDYZOR-HCXYKTFWSA-N	0	3	332.488	3.045	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)C(C)(C)C2CCCCC2)C1	ZINC001192748615	1367866120	/nfs/dbraw/zinc/86/61/20/1367866120.db2.gz	CMQVGHAGRGDDFT-GOSISDBHSA-N	0	3	336.520	3.328	20	30		EGEDHN
CCCCCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc(OCC)no1)C2	ZINC001110821575	1368008821	/nfs/dbraw/zinc/00/88/21/1368008821.db2.gz	BGGJBTRORBRYJV-OAGGEKHMSA-N	0	3	349.475	3.379	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CC1CC(F)(F)C1	ZINC001110933139	1368102708	/nfs/dbraw/zinc/10/27/08/1368102708.db2.gz	HBOOQAVFRUYWIM-XZDPQHSOSA-N	0	3	326.431	3.356	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2ccccc2C2CCC2)C1	ZINC001193747111	1368106748	/nfs/dbraw/zinc/10/67/48/1368106748.db2.gz	SXOKWARGTUCXSM-GOSISDBHSA-N	0	3	342.483	3.303	20	30		EGEDHN
CC1(C)CN(C[C@H](O)c2cccc(C#N)c2)C[C@]2(C[C@@H]3CC[C@H]2C3)O1	ZINC001193818019	1368121901	/nfs/dbraw/zinc/12/19/01/1368121901.db2.gz	GCSKSTZCZABZTF-CCMRYFRJSA-N	0	3	340.467	3.261	20	30		EGEDHN
CN1CCC[C@H](C(=O)Nc2nc(-c3ccc(C#N)s3)cs2)C1	ZINC001186351784	1387927482	/nfs/dbraw/zinc/92/74/82/1387927482.db2.gz	RIEUVHPZIKVFBK-JTQLQIEISA-N	0	3	332.454	3.024	20	30		EGEDHN
C=CCCOCC(=O)N1CC[C@H](N(C)[C@H](C)c2cccc(F)c2)C1	ZINC001194396539	1368251622	/nfs/dbraw/zinc/25/16/22/1368251622.db2.gz	FBRKJYPCJQJVCA-QAPCUYQASA-N	0	3	334.435	3.012	20	30		EGEDHN
N#Cc1cccc([C@@H](O)CN2CC[C@H](Oc3ccc(Cl)cc3)C2)c1	ZINC001194633356	1368300086	/nfs/dbraw/zinc/30/00/86/1368300086.db2.gz	RYMQPPHADQDTFV-OALUTQOASA-N	0	3	342.826	3.398	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@@H](CC)C(C)C)C[C@H](C)O2	ZINC001111552959	1368344724	/nfs/dbraw/zinc/34/47/24/1368344724.db2.gz	QUUNRGHTGMWIDN-ZWKOTPCHSA-N	0	3	336.520	3.327	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N[C@]12CCC[C@H]1CN(Cc1ccsc1)C2	ZINC001111643130	1368405368	/nfs/dbraw/zinc/40/53/68/1368405368.db2.gz	XKOVIZFWJXOXLV-AYBZRNKSSA-N	0	3	348.512	3.200	20	30		EGEDHN
C=CCOCC(=O)N[C@]12CCC[C@H]1CN([C@@H](C)c1ccc(F)cc1)C2	ZINC001111662061	1368414593	/nfs/dbraw/zinc/41/45/93/1368414593.db2.gz	DLNJIADWIXKZMW-KNBMTAEXSA-N	0	3	346.446	3.060	20	30		EGEDHN
Cc1cc(Cl)ccc1CN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H](C)C#N)C1	ZINC001111667301	1368416366	/nfs/dbraw/zinc/41/63/66/1368416366.db2.gz	ZIFRTCIKODANTF-QOKNQOGYSA-N	0	3	345.874	3.279	20	30		EGEDHN
C=CCOCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1ccsc1)C2	ZINC001111685849	1368420493	/nfs/dbraw/zinc/42/04/93/1368420493.db2.gz	CKAOAAFKAAVPQH-HKUYNNGSSA-N	0	3	348.512	3.202	20	30		EGEDHN
C#CCCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1cccnc1C)C2	ZINC001111711232	1368427566	/nfs/dbraw/zinc/42/75/66/1368427566.db2.gz	IUVMSAXQPALSIO-FPOVZHCZSA-N	0	3	339.483	3.054	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@]12CCC[C@H]1CN(Cc1ncccc1C)C2	ZINC001111850285	1368503534	/nfs/dbraw/zinc/50/35/34/1368503534.db2.gz	IDDMADWEJUWYLJ-WFXMLNOXSA-N	0	3	341.499	3.463	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)CCc2ccccc2Cl)C1	ZINC001111969799	1368580036	/nfs/dbraw/zinc/58/00/36/1368580036.db2.gz	JGIOOVNESWCWLJ-PXNSSMCTSA-N	0	3	344.886	3.267	20	30		EGEDHN
C#CCN1C[C@@H]2CCC[C@]2(NC(=O)CC(C)(C)c2ccc(C)cc2)C1	ZINC001111973408	1368582861	/nfs/dbraw/zinc/58/28/61/1368582861.db2.gz	LEAAKNDKJYLYBW-UGKGYDQZSA-N	0	3	338.495	3.267	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)C[C@@H](C)c2ccc(F)cc2)C1	ZINC001112001192	1368605127	/nfs/dbraw/zinc/60/51/27/1368605127.db2.gz	LVRBHVIIHGERKW-MMOPVJDHSA-N	0	3	342.458	3.313	20	30		EGEDHN
C#CCCN1CCCN(C(=O)CCCCc2ccc(F)cc2)CC1	ZINC001197255398	1368773567	/nfs/dbraw/zinc/77/35/67/1368773567.db2.gz	TZIRTEBJPYTNHD-UHFFFAOYSA-N	0	3	330.447	3.096	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2noc3c2CCCCC3)CC1	ZINC001197283004	1368779685	/nfs/dbraw/zinc/77/96/85/1368779685.db2.gz	AWTYHTUTZVRWSR-UHFFFAOYSA-N	0	3	331.460	3.058	20	30		EGEDHN
CC[C@@H](C)CCC(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001186536677	1387965815	/nfs/dbraw/zinc/96/58/15/1387965815.db2.gz	DTHLSJZEKJPQGM-RHSMWYFYSA-N	0	3	331.435	3.214	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)[C@@H](C)Oc2ccccn2)CC1	ZINC001197843118	1368911501	/nfs/dbraw/zinc/91/15/01/1368911501.db2.gz	PQLAFGLEVCLUIB-GOSISDBHSA-N	0	3	347.503	3.354	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2cc(F)c(F)c(F)c2F)CC1	ZINC001197899351	1368921250	/nfs/dbraw/zinc/92/12/50/1368921250.db2.gz	VGKFZRPIHANIOI-UHFFFAOYSA-N	0	3	344.352	3.357	20	30		EGEDHN
C=C(C)CN1CCCN(C(=O)CCOc2cc(C)ccc2C)CC1	ZINC001198027237	1368945851	/nfs/dbraw/zinc/94/58/51/1368945851.db2.gz	NUFCSBHYPVBPAB-UHFFFAOYSA-N	0	3	330.472	3.183	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)c2cccc(C)c2C)C1	ZINC001198275837	1368996136	/nfs/dbraw/zinc/99/61/36/1368996136.db2.gz	BUSOGNFDOGGDKE-RTBURBONSA-N	0	3	332.488	3.049	20	30		EGEDHN
C=CCCOCC(=O)N1CCCN(CC/C=C\c2ccccc2)CC1	ZINC001198330704	1369009851	/nfs/dbraw/zinc/00/98/51/1369009851.db2.gz	PJDYLFQLJJMJGD-GHXNOFRVSA-N	0	3	342.483	3.217	20	30		EGEDHN
C#CCOCCC(=O)N1CCN(CC2CCC(C(C)(C)C)CC2)CC1	ZINC001112845137	1369042054	/nfs/dbraw/zinc/04/20/54/1369042054.db2.gz	WENCNIZMMGXOTB-UHFFFAOYSA-N	0	3	348.531	3.023	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)CCSC)c1ccccc1OC	ZINC001198515699	1369051006	/nfs/dbraw/zinc/05/10/06/1369051006.db2.gz	OWLJTKWOADVITG-INIZCTEOSA-N	0	3	336.501	3.161	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)CSC(C)C)c1ccccc1OC	ZINC001198539332	1369056555	/nfs/dbraw/zinc/05/65/55/1369056555.db2.gz	BRVWFXWCNQZIDE-INIZCTEOSA-N	0	3	336.501	3.160	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)Cc2ccc(OC)cc2C)CC1	ZINC001112883170	1369066210	/nfs/dbraw/zinc/06/62/10/1369066210.db2.gz	YVMWKEREPPFZNS-KRWDZBQOSA-N	0	3	330.472	3.045	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)[C@@H](CC)OCC)c1ccccc1OC	ZINC001198585010	1369067187	/nfs/dbraw/zinc/06/71/87/1369067187.db2.gz	PEGPJRFTOKKJMR-ZWKOTPCHSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)c1cscn1)c1ccccc1OC	ZINC001198605890	1369071862	/nfs/dbraw/zinc/07/18/62/1369071862.db2.gz	LKTNKJYIGDILIT-OAHLLOKOSA-N	0	3	345.468	3.179	20	30		EGEDHN
COc1ccccc1[C@@H](CNC(=O)[C@H](C)C#N)NCCC(C)(C)C	ZINC001198617991	1369075030	/nfs/dbraw/zinc/07/50/30/1369075030.db2.gz	VEXQNSBYOFAYBC-GDBMZVCRSA-N	0	3	331.460	3.038	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@@H](C)n1cccc1)c1ccccc1OC	ZINC001198669208	1369087020	/nfs/dbraw/zinc/08/70/20/1369087020.db2.gz	XSFVVBSUJMOLDI-SJLPKXTDSA-N	0	3	341.455	3.081	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)C[C@H](C)SC)c1ccccc1OC	ZINC001198668838	1369087136	/nfs/dbraw/zinc/08/71/36/1369087136.db2.gz	VWAIJQXKERHHMC-GOEBONIOSA-N	0	3	336.501	3.160	20	30		EGEDHN
CCCCCN[C@@H](CNC(=O)C#CC1CC1)c1ccccc1OC	ZINC001198723838	1369099713	/nfs/dbraw/zinc/09/97/13/1369099713.db2.gz	LHADJGRRHRDYNC-SFHVURJKSA-N	0	3	328.456	3.046	20	30		EGEDHN
COc1ccccc1[C@@H](CNC(=O)C#CC(C)(C)C)NCC1CCC1	ZINC001198723083	1369100046	/nfs/dbraw/zinc/10/00/46/1369100046.db2.gz	BZTLXYIORNRKMD-GOSISDBHSA-N	0	3	342.483	3.292	20	30		EGEDHN
C=CCC[C@H](C)N[C@H](CNC(=O)c1cc[nH]c1)c1ccccc1OC	ZINC001198743445	1369103734	/nfs/dbraw/zinc/10/37/34/1369103734.db2.gz	ZLZROPSTMNSCEN-MAUKXSAKSA-N	0	3	341.455	3.439	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@H]1CCC1(F)F)c1ccccc1OC	ZINC001198766650	1369108860	/nfs/dbraw/zinc/10/88/60/1369108860.db2.gz	FNPLFADCHPFQFX-HUUCEWRRSA-N	0	3	338.398	3.064	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@]12C[C@H]1CCC2)c1ccccc1OC	ZINC001198805629	1369118708	/nfs/dbraw/zinc/11/87/08/1369118708.db2.gz	DJNNVLDKBOIRLF-OXFYSEKESA-N	0	3	328.456	3.208	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@H](NCCCOC)c1ccccc1OC	ZINC001198826951	1369122789	/nfs/dbraw/zinc/12/27/89/1369122789.db2.gz	NHXTWKPHAQJNHW-KRWDZBQOSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)Cc2ccc3c(c2)CCCO3)CC1	ZINC001112991546	1369125959	/nfs/dbraw/zinc/12/59/59/1369125959.db2.gz	PNHHQCGKBUHTNL-QGZVFWFLSA-N	0	3	342.483	3.053	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@H](NCCCF)c1ccccc1OC	ZINC001198857542	1369131393	/nfs/dbraw/zinc/13/13/93/1369131393.db2.gz	QSWORGVVZKLVRE-WBVHZDCISA-N	0	3	336.451	3.404	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)[C@@H]1CC12CC2)c1ccccc1OC	ZINC001198916736	1369148263	/nfs/dbraw/zinc/14/82/63/1369148263.db2.gz	SJGBXOMYKNIIRZ-IRXDYDNUSA-N	0	3	328.456	3.208	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)c1nccs1)c1ccccc1OC	ZINC001198944977	1369154291	/nfs/dbraw/zinc/15/42/91/1369154291.db2.gz	JCJNIUDVTZSKNY-OAHLLOKOSA-N	0	3	345.468	3.179	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)C[C@@H](C)COC)c1ccccc1OC	ZINC001198952907	1369156912	/nfs/dbraw/zinc/15/69/12/1369156912.db2.gz	DJKRIRKIZJJKMU-AEFFLSMTSA-N	0	3	348.487	3.081	20	30		EGEDHN
C#CCC1(C(=O)NC[C@@H](NCC)c2ccccc2OC)CCCCC1	ZINC001199002107	1369169973	/nfs/dbraw/zinc/16/99/73/1369169973.db2.gz	QDEAWSCOXSPPPT-GOSISDBHSA-N	0	3	342.483	3.436	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)c2cccc(C3CC3)c2)C1	ZINC001199192904	1369189054	/nfs/dbraw/zinc/18/90/54/1369189054.db2.gz	YNZUIXHIVPRWGM-WOJBJXKFSA-N	0	3	342.483	3.085	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)Cc2ccc(C)c(OC)c2)CC1	ZINC001113085670	1369192209	/nfs/dbraw/zinc/19/22/09/1369192209.db2.gz	ANTIJUCCOCQDHO-QGZVFWFLSA-N	0	3	330.472	3.045	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)Cc2cn(C)c3ccccc23)CC1	ZINC001113273201	1369307602	/nfs/dbraw/zinc/30/76/02/1369307602.db2.gz	WBNLJYJSUJORKQ-KRWDZBQOSA-N	0	3	339.483	3.220	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC(N[C@@H](C)c2nc3ccccc3o2)CC1	ZINC001200448874	1369371018	/nfs/dbraw/zinc/37/10/18/1369371018.db2.gz	RNHVBMMJLOVMRD-HNNXBMFYSA-N	0	3	339.439	3.129	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)C[C@@H]2OCCc3ccccc32)CC1	ZINC001113559423	1369492711	/nfs/dbraw/zinc/49/27/11/1369492711.db2.gz	SRIJJZDBWZKEKO-PXNSSMCTSA-N	0	3	342.483	3.189	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)CCc2ccccc2OC)CC1	ZINC001113611185	1369520106	/nfs/dbraw/zinc/52/01/06/1369520106.db2.gz	AEZQEEHTIDUYMK-KRWDZBQOSA-N	0	3	330.472	3.127	20	30		EGEDHN
CC#CCNC[C@H]1CN(C(=O)[C@H](CC2CCCC2)C(C)C)CCCO1	ZINC001201548457	1369573385	/nfs/dbraw/zinc/57/33/85/1369573385.db2.gz	XKNSPEPYOFHLOY-VQTJNVASSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC(NCc2nc(C)c(C)s2)CC1	ZINC001202108089	1369688748	/nfs/dbraw/zinc/68/87/48/1369688748.db2.gz	GOGNBIKILPXIPU-ZDUSSCGKSA-N	0	3	335.517	3.443	20	30		EGEDHN
C=CCC1(C(=O)N2CCCO[C@H](CNC/C=C\Cl)C2)CCCC1	ZINC001202250853	1369723160	/nfs/dbraw/zinc/72/31/60/1369723160.db2.gz	MFTCVVMUQJNVMN-MGDKSHQASA-N	0	3	340.895	3.083	20	30		EGEDHN
CCC(=O)N[C@H]1C[C@H](NCC#Cc2ccc(Cl)cc2)C12CCC2	ZINC001202259479	1369724092	/nfs/dbraw/zinc/72/40/92/1369724092.db2.gz	NMKOISVIQPQCOL-IRXDYDNUSA-N	0	3	330.859	3.119	20	30		EGEDHN
Cc1ccoc1C(=O)N[C@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202446662	1369774260	/nfs/dbraw/zinc/77/42/60/1369774260.db2.gz	FRVYDYFEYCABCO-OALUTQOASA-N	0	3	348.446	3.270	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@H](NC(=O)CC(C)(C)C)C12CCC2	ZINC001202503616	1369793059	/nfs/dbraw/zinc/79/30/59/1369793059.db2.gz	YTMZVNAQYMGNEU-OLZOCXBDSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@H](NCc2cnc(Cl)s2)C12CCC2	ZINC001202593158	1369816297	/nfs/dbraw/zinc/81/62/97/1369816297.db2.gz	XXHPRURDIACBRU-QWHCGFSZSA-N	0	3	339.892	3.280	20	30		EGEDHN
CC(C)CCCC(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001202620779	1369826614	/nfs/dbraw/zinc/82/66/14/1369826614.db2.gz	DKXIZUYJOQPDTD-UHFFFAOYSA-N	0	3	327.472	3.465	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@H](NCc2cc(F)ccc2OC)C12CCC2	ZINC001202626000	1369830149	/nfs/dbraw/zinc/83/01/49/1369830149.db2.gz	RCJYMPMKBRZFAV-ZWKOTPCHSA-N	0	3	346.446	3.318	20	30		EGEDHN
Cc1cccc(CN2CC[C@H](NC(=O)Nc3cccc(C#N)c3)C2)c1	ZINC001202798789	1369896909	/nfs/dbraw/zinc/89/69/09/1369896909.db2.gz	BIPTZLQYRULXTJ-IBGZPJMESA-N	0	3	334.423	3.263	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H]1C[C@H](NCc2ccc(F)cc2F)C12CCC2	ZINC001202867766	1369912007	/nfs/dbraw/zinc/91/20/07/1369912007.db2.gz	UJKPXJKJCQEAJJ-ROUUACIJSA-N	0	3	346.421	3.141	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1C[C@H](NCc2ocnc2C)C12CCC2	ZINC001202969076	1369940653	/nfs/dbraw/zinc/94/06/53/1369940653.db2.gz	NCCLXCHRRZVJEE-JKSUJKDBSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1C[C@H](NCC(=C)Br)C12CCC2	ZINC001202977666	1369943571	/nfs/dbraw/zinc/94/35/71/1369943571.db2.gz	FJJDNAZIQNVVFU-UONOGXRCSA-N	0	3	341.293	3.268	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1[C@H]2CN(CCc3ccccc3Cl)C[C@H]21	ZINC001114718359	1370043982	/nfs/dbraw/zinc/04/39/82/1370043982.db2.gz	MGPTWGRSAUQNEE-YRWFTTLQSA-N	0	3	344.886	3.123	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1C[C@@H](NCc2conc2CC)C12CCC2	ZINC001203259654	1370045884	/nfs/dbraw/zinc/04/58/84/1370045884.db2.gz	XTSSKRMNLNDNPF-SJORKVTESA-N	0	3	345.487	3.356	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1[C@H]2CN(CCOc3ccccc3C)C[C@H]21	ZINC001114724233	1370046718	/nfs/dbraw/zinc/04/67/18/1370046718.db2.gz	JKMQPDLQXHPEJA-PNYFIKQUSA-N	0	3	342.483	3.023	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1C[C@H](NCc2c(C)noc2C)C12CCC2	ZINC001203274310	1370055423	/nfs/dbraw/zinc/05/54/23/1370055423.db2.gz	MYPUSRSMHPHMLL-ZWKOTPCHSA-N	0	3	343.471	3.002	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)C2(C(F)F)CCC2)C12CCC2	ZINC001203311273	1370076522	/nfs/dbraw/zinc/07/65/22/1370076522.db2.gz	MMHQWPAEUHLCIS-RYUDHWBXSA-N	0	3	332.822	3.191	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@@H](NCc3cnoc3C)C23CCC3)CCC1	ZINC001203365604	1370100169	/nfs/dbraw/zinc/10/01/69/1370100169.db2.gz	HZANPOMBKJPEIB-SJORKVTESA-N	0	3	343.471	3.246	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H](NCc3ocnc3C)C23CCC3)CCC1	ZINC001203367771	1370101079	/nfs/dbraw/zinc/10/10/79/1370101079.db2.gz	VREMDWHGTNNEAO-IRXDYDNUSA-N	0	3	343.471	3.246	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2C[C@H](NCc3ccccn3)C23CCC3)CC1	ZINC001203375912	1370105007	/nfs/dbraw/zinc/10/50/07/1370105007.db2.gz	SCOFJXAAONFHRH-ZWKOTPCHSA-N	0	3	339.483	3.345	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1C[C@H](NCc2conc2C)C12CCC2	ZINC001203453028	1370132385	/nfs/dbraw/zinc/13/23/85/1370132385.db2.gz	QWYPZNDCSVRXSW-HOTGVXAUSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)CCc2cccs2)C12CCC2	ZINC001203712335	1370231520	/nfs/dbraw/zinc/23/15/20/1370231520.db2.gz	PBWICLNOZGJIDF-HUUCEWRRSA-N	0	3	338.904	3.450	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)CCOc2ccccc2)C12CCC2	ZINC001203731095	1370238800	/nfs/dbraw/zinc/23/88/00/1370238800.db2.gz	NOGKQACJDMKRMA-SJORKVTESA-N	0	3	348.874	3.225	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3O[C@@H](COCC4CC4)CC[C@H]32)c1	ZINC001203762240	1370254246	/nfs/dbraw/zinc/25/42/46/1370254246.db2.gz	NENSTSAIRUKURZ-VAMGGRTRSA-N	0	3	326.440	3.107	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(NCc3cnns3)CC2)CCCCC1	ZINC001203846653	1370288150	/nfs/dbraw/zinc/28/81/50/1370288150.db2.gz	FITJPIVKYMYUCX-UHFFFAOYSA-N	0	3	348.516	3.145	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001203900191	1370305581	/nfs/dbraw/zinc/30/55/81/1370305581.db2.gz	FABHGBDLEGIDBG-FQEVSTJZSA-N	0	3	339.439	3.169	20	30		EGEDHN
CN1C(=O)C2(CCN(Cc3ccc(C#N)cc3)CC2)[C@@H]1c1ccccc1	ZINC001203901494	1370306565	/nfs/dbraw/zinc/30/65/65/1370306565.db2.gz	OFTMTMHHZYOUDG-FQEVSTJZSA-N	0	3	345.446	3.354	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCCN(Cc2ccc(C#N)cc2)CCC1	ZINC001203905983	1370309844	/nfs/dbraw/zinc/30/98/44/1370309844.db2.gz	IFDLDBNJEXJOHN-UHFFFAOYSA-N	0	3	329.444	3.391	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@H]1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC001203905449	1370310142	/nfs/dbraw/zinc/31/01/42/1370310142.db2.gz	NGEISRCJSZVAIN-QGZVFWFLSA-N	0	3	329.444	3.437	20	30		EGEDHN
C#CCCCC(=O)N1CCC(CNCc2csc(CCC)n2)CC1	ZINC001205131858	1370659650	/nfs/dbraw/zinc/65/96/50/1370659650.db2.gz	YIUSLJQXHHGEPS-UHFFFAOYSA-N	0	3	347.528	3.227	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCC1(NCc2nccnc2C)CCCCC1	ZINC001115679620	1370663096	/nfs/dbraw/zinc/66/30/96/1370663096.db2.gz	KMGJUHWZZOHNRS-HZPDHXFCSA-N	0	3	344.503	3.152	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)/C(C)=C\CC)CC[C@H]1c1ccc(F)cc1	ZINC001205256231	1370697693	/nfs/dbraw/zinc/69/76/93/1370697693.db2.gz	DECCMEKWFQJLMA-YEDOHJRQSA-N	0	3	342.458	3.479	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC1(NCc2cc(C)ncn2)CCCCC1	ZINC001115750639	1370731787	/nfs/dbraw/zinc/73/17/87/1370731787.db2.gz	ZRQUXWGPAKUDNS-UHFFFAOYSA-N	0	3	344.503	3.296	20	30		EGEDHN
C=CCOCC(=O)N1CC[C@H]2CN(Cc3ccc(C(C)C)cc3)C[C@H]21	ZINC001187320609	1388093853	/nfs/dbraw/zinc/09/38/53/1388093853.db2.gz	XNEFJPNJDKSNBP-VQTJNVASSA-N	0	3	342.483	3.045	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N1CCC(CNCc2ccccc2C#N)CC1	ZINC001205939497	1370918135	/nfs/dbraw/zinc/91/81/35/1370918135.db2.gz	VTAZVJIJETXELJ-IUXPMGMMSA-N	0	3	337.467	3.409	20	30		EGEDHN
C#C[C@@H](NC(=O)N1CCCN(Cc2ccccc2)CC1)c1ccccc1	ZINC001326027802	1388102903	/nfs/dbraw/zinc/10/29/03/1388102903.db2.gz	WSQDSVJMRSJGEB-OAQYLSRUSA-N	0	3	347.462	3.278	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC(CNCc2oc(C)nc2C)CC1	ZINC001205989046	1370931786	/nfs/dbraw/zinc/93/17/86/1370931786.db2.gz	OBTUJZAGVPUCED-CQSZACIVSA-N	0	3	333.476	3.222	20	30		EGEDHN
C=CCCCC(=O)N1CCC(CNCc2csc(CC)n2)CC1	ZINC001206092994	1370958432	/nfs/dbraw/zinc/95/84/32/1370958432.db2.gz	DGCDOQNVLZSBFK-UHFFFAOYSA-N	0	3	335.517	3.390	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC(CNCc2ccn(C(C)C)n2)CC1	ZINC001206427425	1371051275	/nfs/dbraw/zinc/05/12/75/1371051275.db2.gz	GBQLHYRGTXIDRK-UHFFFAOYSA-N	0	3	346.519	3.395	20	30		EGEDHN
CN1CCN(CCCO[C@@H](C#Cc2ccccc2)c2ccccc2)CC1	ZINC001206595367	1371103961	/nfs/dbraw/zinc/10/39/61/1371103961.db2.gz	FLCPTZIZIIBULR-QHCPKHFHSA-N	0	3	348.490	3.434	20	30		EGEDHN
O=C(C1CCC1)N1CCC[C@@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207011452	1371266900	/nfs/dbraw/zinc/26/69/00/1371266900.db2.gz	ABOOABCOMJLJIE-GOSISDBHSA-N	0	3	330.859	3.072	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CCN(Cc3cnc(C)s3)C2)C1	ZINC001207058994	1371280783	/nfs/dbraw/zinc/28/07/83/1371280783.db2.gz	QVFUWQQLRZDQRI-QGZVFWFLSA-N	0	3	335.473	3.062	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H](CN2CCc3cc(C#N)ccc3C2)C1	ZINC001207206738	1371328417	/nfs/dbraw/zinc/32/84/17/1371328417.db2.gz	QMPVQHXCCBDJLX-MRXNPFEDSA-N	0	3	341.455	3.173	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H]2CCCC[C@@H]2OC)CCCCC1	ZINC001120226289	1371509240	/nfs/dbraw/zinc/50/92/40/1371509240.db2.gz	JEMVLHKFBJDRJQ-HOTGVXAUSA-N	0	3	342.911	3.353	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)CCc2ccccc2OCC)C1	ZINC001207884623	1371529320	/nfs/dbraw/zinc/52/93/20/1371529320.db2.gz	SYTCVLSRWSCMGP-SJLPKXTDSA-N	0	3	330.472	3.031	20	30		EGEDHN
CC[C@@H](C)CC(=O)N1CCC[C@@H](NCc2cc(C#N)ccc2OC)C1	ZINC001207915528	1371537982	/nfs/dbraw/zinc/53/79/82/1371537982.db2.gz	XUZUKAMWPKYXBN-CRAIPNDOSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H]([C@@H]2CCCN2Cc2cncc(F)c2)C1	ZINC001120348221	1371542377	/nfs/dbraw/zinc/54/23/77/1371542377.db2.gz	RORXDOZAJAGNNR-HKUYNNGSSA-N	0	3	345.462	3.390	20	30		EGEDHN
O=C(c1sccc1F)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001207978710	1371558333	/nfs/dbraw/zinc/55/83/33/1371558333.db2.gz	HXYZYQOGGCCTEC-INIZCTEOSA-N	0	3	342.439	3.133	20	30		EGEDHN
COc1cc(Cl)ccc1CN[C@@H]1CCCN(C(=O)C#CC(C)C)C1	ZINC001208006056	1371565766	/nfs/dbraw/zinc/56/57/66/1371565766.db2.gz	UWVKSSORAAQFKB-QGZVFWFLSA-N	0	3	348.874	3.089	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC[C@@H](NCc2cnc(C)s2)C1	ZINC001208194315	1371634806	/nfs/dbraw/zinc/63/48/06/1371634806.db2.gz	PVZBIFINTJHKSG-MRXNPFEDSA-N	0	3	333.501	3.301	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC[C@@H](NCc2ccc(C#N)s2)C1	ZINC001208194489	1371634988	/nfs/dbraw/zinc/63/49/88/1371634988.db2.gz	RJARYBWBJYKWIQ-MRXNPFEDSA-N	0	3	343.496	3.469	20	30		EGEDHN
COC(=O)C1(C#N)CCN(CC[C@H](C)CCCC(C)(C)OC)CC1	ZINC001208213031	1371651680	/nfs/dbraw/zinc/65/16/80/1371651680.db2.gz	MIJJEBYXJWEKLT-MRXNPFEDSA-N	0	3	338.492	3.387	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001208255573	1371685052	/nfs/dbraw/zinc/68/50/52/1371685052.db2.gz	MAEGZRPYBQQLGC-QGZVFWFLSA-N	0	3	329.419	3.134	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN(C[C@@H](OC)c2ccccc2)C[C@H]1C	ZINC001208312952	1371712419	/nfs/dbraw/zinc/71/24/19/1371712419.db2.gz	UKARZUSXQIJSPF-KBAYOESNSA-N	0	3	330.472	3.023	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1CN(CCc2scnc2C)C[C@H]1C	ZINC001208392750	1371750029	/nfs/dbraw/zinc/75/00/29/1371750029.db2.gz	CVGUZRQIUUCMMM-FVQBIDKESA-N	0	3	335.517	3.033	20	30		EGEDHN
N#Cc1ccccc1CNC1CC2(C1)CC(NC(=O)CCC1CC1)C2	ZINC001120869338	1371789843	/nfs/dbraw/zinc/78/98/43/1371789843.db2.gz	HRTKMSLDYRAXBJ-UHFFFAOYSA-N	0	3	337.467	3.265	20	30		EGEDHN
COC(=O)C1(C#N)CCN(CC2(c3ccccc3)CCCC2)CC1	ZINC001208779239	1371893860	/nfs/dbraw/zinc/89/38/60/1371893860.db2.gz	GXNUGVGYHIBDGH-UHFFFAOYSA-N	0	3	326.440	3.277	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@]1(C)CCCN(CCc2ccc(C#N)cc2)C1	ZINC001208920739	1371944801	/nfs/dbraw/zinc/94/48/01/1371944801.db2.gz	NTERSNIHXKOEMB-HXUWFJFHSA-N	0	3	343.471	3.480	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CN(CCOc2cccc(C)c2)C[C@H]1C	ZINC001208933247	1371951944	/nfs/dbraw/zinc/95/19/44/1371951944.db2.gz	OAWPYSGTJOLYLE-IEBWSBKVSA-N	0	3	344.499	3.413	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@@H](NCc2cn(C(C)C)nc2C)C1	ZINC001209155890	1372017233	/nfs/dbraw/zinc/01/72/33/1372017233.db2.gz	GMXLSZTXMJDUHY-LJQANCHMSA-N	0	3	344.503	3.047	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NC1CC2(CC(NCc3ncc(C)s3)C2)C1	ZINC001121609380	1372023025	/nfs/dbraw/zinc/02/30/25/1372023025.db2.gz	CNFRMGWBWPJSEE-ZAYNFQSFSA-N	0	3	347.528	3.427	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@H](NCc2cn(C(C)C)nc2C)C1	ZINC001209184409	1372029952	/nfs/dbraw/zinc/02/99/52/1372029952.db2.gz	SGFAFGOLRROFNF-APWZRJJASA-N	0	3	346.519	3.455	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC1CC2(CC(NCc3conc3CC)C2)C1	ZINC001121713822	1372056036	/nfs/dbraw/zinc/05/60/36/1372056036.db2.gz	NTHMKQFUTVSAAQ-VYJHHOQDSA-N	0	3	345.487	3.356	20	30		EGEDHN
C=CCC1(C(=O)NC2CC3(CC(NCc4nccs4)C3)C2)CCC1	ZINC001121713397	1372056239	/nfs/dbraw/zinc/05/62/39/1372056239.db2.gz	IEFZZVXFLJDGJS-UHFFFAOYSA-N	0	3	345.512	3.407	20	30		EGEDHN
C=CCCCCCCCCN1C[C@@H]2[C@H](C1)OCCN2c1cnccn1	ZINC001209443086	1372107544	/nfs/dbraw/zinc/10/75/44/1372107544.db2.gz	LHGPTONOLHJWRY-MOPGFXCFSA-N	0	3	344.503	3.283	20	30		EGEDHN
CCc1ccoc1C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001209465165	1372113111	/nfs/dbraw/zinc/11/31/11/1372113111.db2.gz	NZAMKEYGLMCAPY-LJQANCHMSA-N	0	3	336.435	3.088	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N[C@H](C)c1nc(-c2ccc(F)c(C)c2)no1	ZINC001121896325	1372117385	/nfs/dbraw/zinc/11/73/85/1372117385.db2.gz	LFJHVDPQYJVXNL-DOMZBBRYSA-N	0	3	346.406	3.045	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3c[nH]c4ccc(C)cc34)C2)C1=O	ZINC001209495214	1372121851	/nfs/dbraw/zinc/12/18/51/1372121851.db2.gz	NGFIVKSLAGTZAY-OAQYLSRUSA-N	0	3	337.467	3.477	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)CCOc2ccccc2CC)C1	ZINC001210206022	1372294194	/nfs/dbraw/zinc/29/41/94/1372294194.db2.gz	GPPSYABCVFHSCQ-SJLPKXTDSA-N	0	3	330.472	3.031	20	30		EGEDHN
O=C([C@H]1CC12CCCC2)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001210503047	1372368062	/nfs/dbraw/zinc/36/80/62/1372368062.db2.gz	MUSFNCVNMQINCV-VQTJNVASSA-N	0	3	336.479	3.199	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H](C)C(CC)CC)C[C@H]1c1ccccc1	ZINC001211628012	1372592500	/nfs/dbraw/zinc/59/25/00/1372592500.db2.gz	YMIWZMLBJHWVRD-LSTHTHJFSA-N	0	3	326.484	3.276	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2csc(C)c2)C[C@H]1c1ccccc1	ZINC001211687954	1372602707	/nfs/dbraw/zinc/60/27/07/1372602707.db2.gz	IPPJIHABYKYBOC-RBUKOAKNSA-N	0	3	338.476	3.278	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](NC/C=C\Cl)C1	ZINC001188009151	1388212203	/nfs/dbraw/zinc/21/22/03/1388212203.db2.gz	FBQQQUUWCOWEEE-FNYRBRLGSA-N	0	3	332.875	3.364	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2oc(C)cc2C)[C@H](OC)C1	ZINC001212087627	1372654731	/nfs/dbraw/zinc/65/47/31/1372654731.db2.gz	ZJTRUFKPHLAXCJ-IAGOWNOFSA-N	0	3	334.460	3.072	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CN([C@@H](C)c2ccccc2C)C[C@H]1OC	ZINC001212146159	1372663830	/nfs/dbraw/zinc/66/38/30/1372663830.db2.gz	KGHPOMKWIJWVME-DFQSSKMNSA-N	0	3	342.483	3.065	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2ccc(C3CCC3)cc2)[C@H](OC)C1	ZINC001212370788	1372696123	/nfs/dbraw/zinc/69/61/23/1372696123.db2.gz	TWGHYUQEIFEYMV-WOJBJXKFSA-N	0	3	342.483	3.349	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@@](C)(F)CCCC)[C@H](OC)C1	ZINC001212489691	1372714749	/nfs/dbraw/zinc/71/47/49/1372714749.db2.gz	RNHHOWWBKYJWGV-LMMKCTJWSA-N	0	3	342.499	3.467	20	30		EGEDHN
C=C[C@H](CC(=O)N1CC[C@@H](NCc2cccnc2)C1)c1ccccc1	ZINC001188039413	1388224486	/nfs/dbraw/zinc/22/44/86/1388224486.db2.gz	BVUBCRUFTLMGFV-UYAOXDASSA-N	0	3	335.451	3.132	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)C2(F)CCCCC2)[C@H](OC)C1	ZINC001213669637	1372943267	/nfs/dbraw/zinc/94/32/67/1372943267.db2.gz	KUTPHYNFNGSKBF-IAGOWNOFSA-N	0	3	342.499	3.445	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)[C@H](CC)c2ccc(F)cc2)[C@H](OC)C1	ZINC001213951505	1372986061	/nfs/dbraw/zinc/98/60/61/1372986061.db2.gz	VEWWHDILCALHIT-GUDVDZBRSA-N	0	3	348.462	3.101	20	30		EGEDHN
CC/C(C)=C/C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001214566928	1373080983	/nfs/dbraw/zinc/08/09/83/1373080983.db2.gz	WCKBEQMMBZIBDG-FESITFKDSA-N	0	3	344.886	3.484	20	30		EGEDHN
C[C@@H]1CN(C(=O)C[C@H]2C=CCCC2)C[C@H]1NCC#Cc1ccccc1	ZINC001214944486	1373146394	/nfs/dbraw/zinc/14/63/94/1373146394.db2.gz	UTEMHPYRPSGZRX-HLAWJBBLSA-N	0	3	336.479	3.221	20	30		EGEDHN
C#Cc1cnc(Nc2cccc(CN3CCCCC3)c2F)c(C#C)n1	ZINC001215675798	1373230013	/nfs/dbraw/zinc/23/00/13/1373230013.db2.gz	RTYJZFNLMLFLNQ-UHFFFAOYSA-N	0	3	334.398	3.308	20	30		EGEDHN
COc1ccc(C#N)c(-c2nc(-c3ccc(CN(C)C)cc3)no2)c1	ZINC001216669799	1373329626	/nfs/dbraw/zinc/32/96/26/1373329626.db2.gz	DIDDGNRJBRLMNV-UHFFFAOYSA-N	0	3	334.379	3.345	20	30		EGEDHN
C#CCC1(C(=O)NCCNCc2ccc(Cl)c(Cl)c2)CCC1	ZINC001129125585	1373348813	/nfs/dbraw/zinc/34/88/13/1373348813.db2.gz	XNEYOKNDZSLEGV-UHFFFAOYSA-N	0	3	339.266	3.393	20	30		EGEDHN
C=CCOc1ccc(C(=O)NCCNCc2ccc(F)c(F)c2)cc1	ZINC001130371308	1373508104	/nfs/dbraw/zinc/50/81/04/1373508104.db2.gz	LTKOYDCTJGVWSM-UHFFFAOYSA-N	0	3	346.377	3.049	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)CCCC[C@@H](C)CC)[C@H]2C1	ZINC001218003898	1373532796	/nfs/dbraw/zinc/53/27/96/1373532796.db2.gz	LXVXJYSENKQATM-GBESFXJTSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)CC2CCCCCC2)C1	ZINC001130428551	1373534134	/nfs/dbraw/zinc/53/41/34/1373534134.db2.gz	ZFOPLOWHRAPTAE-KRWDZBQOSA-N	0	3	344.503	3.362	20	30		EGEDHN
Fc1c(F)c(C(F)(F)F)c(F)c(F)c1O[C@H]1CCNC[C@H]1F	ZINC001218064610	1373551396	/nfs/dbraw/zinc/55/13/96/1373551396.db2.gz	NPDGKSYDJDCJKS-UHNVWZDZSA-N	0	3	335.194	3.341	20	30		EGEDHN
C(=N/N=C/c1ccccc1O[C@@H]1CC[C@@H]2NCCO[C@@H]12)\c1ccccc1	ZINC001218126818	1373565494	/nfs/dbraw/zinc/56/54/94/1373565494.db2.gz	IIYUGVPLFAKEEL-HDEYDSQYSA-N	0	3	349.434	3.038	20	30		EGEDHN
C=C1CC[NH2+]C[C@H]1Oc1cc2c(cc1[O-])oc(=O)cc2-c1ccccc1	ZINC001218205916	1373578466	/nfs/dbraw/zinc/57/84/66/1373578466.db2.gz	IJMLWRJRRYYLJY-HXUWFJFHSA-N	0	3	349.386	3.463	20	30		EGEDHN
CCCCc1ccc(C(=O)NCCNCc2ccc(C#N)s2)cc1	ZINC001131032190	1373628701	/nfs/dbraw/zinc/62/87/01/1373628701.db2.gz	QFUNORTXFNSNMQ-UHFFFAOYSA-N	0	3	341.480	3.482	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)C3CCC(=C)CC3)[C@H]2C1	ZINC001218591117	1373634380	/nfs/dbraw/zinc/63/43/80/1373634380.db2.gz	WVCOTKLGEHYXCP-VQTJNVASSA-N	0	3	346.515	3.391	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)[C@@H]3C[C@H]3CCC)[C@H]2C1	ZINC001218600991	1373635247	/nfs/dbraw/zinc/63/52/47/1373635247.db2.gz	WNIIUMHDCYIANJ-AKHDSKFASA-N	0	3	336.520	3.305	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)[C@@H]2CCC[C@@H]2c2ccccc2)c1	ZINC001131157833	1373655253	/nfs/dbraw/zinc/65/52/53/1373655253.db2.gz	ZJVUWHHWINEBOW-NHCUHLMSSA-N	0	3	347.462	3.348	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cc3ccccc3cc2F)cc1	ZINC001131199224	1373660730	/nfs/dbraw/zinc/66/07/30/1373660730.db2.gz	ZSINUPCFEQNOSP-UHFFFAOYSA-N	0	3	347.393	3.370	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C(CCC)CCC)C[C@H](C)O2	ZINC001131681649	1373760818	/nfs/dbraw/zinc/76/08/18/1373760818.db2.gz	GBGOBDWAILDBCL-FXAWDEMLSA-N	0	3	336.520	3.471	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)CN(C(=O)C(C)(C)CC(C)(C)C)C[C@@H](C)O2	ZINC001131701153	1373770944	/nfs/dbraw/zinc/77/09/44/1373770944.db2.gz	PREIWORNPMRFIF-DYESRHJHSA-N	0	3	348.531	3.164	20	30		EGEDHN
C=CCCCN1CC[C@@H]2CN(C(=O)c3c(F)ccc(F)c3F)[C@@H]2C1	ZINC001221774973	1373792046	/nfs/dbraw/zinc/79/20/46/1373792046.db2.gz	CHEZYWNENAQANC-IUODEOHRSA-N	0	3	338.373	3.216	20	30		EGEDHN
CCCCCCCN1CC[C@@H]2CN(C(=O)c3nc(C)oc3C)[C@@H]2C1	ZINC001221887931	1373802498	/nfs/dbraw/zinc/80/24/98/1373802498.db2.gz	JWLIPTJKCYTWHI-IAGOWNOFSA-N	0	3	333.476	3.408	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2CCN(CCCF)C[C@H]21	ZINC001222037215	1373813563	/nfs/dbraw/zinc/81/35/63/1373813563.db2.gz	WEGRWKGMFFYCDR-XUVXKRRUSA-N	0	3	344.474	3.314	20	30		EGEDHN
CC/C=C(/C)C(=O)N1CC[C@H]2CCN(Cc3ccc(C#N)cc3)[C@H]2C1	ZINC001222378896	1373829488	/nfs/dbraw/zinc/82/94/88/1373829488.db2.gz	RWJRRDJTEQFTIL-USRIKJPJSA-N	0	3	337.467	3.337	20	30		EGEDHN
CC(C)(C)CC(=O)NCC1CCN(Cc2cccc(C#N)c2)CC1	ZINC001222381290	1373830514	/nfs/dbraw/zinc/83/05/14/1373830514.db2.gz	IJFKYDDFKLMTEX-UHFFFAOYSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H]2CCN(Cc3ccc4c(c3)COC4)[C@H]2C1	ZINC001222402255	1373839031	/nfs/dbraw/zinc/83/90/31/1373839031.db2.gz	SIBFHLCVKGHNLJ-XLIONFOSSA-N	0	3	340.467	3.106	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H]2CCN(CCC(F)(F)F)[C@H]2C1	ZINC001222775591	1373879443	/nfs/dbraw/zinc/87/94/43/1373879443.db2.gz	CCZARQJDHHNLHA-KGLIPLIRSA-N	0	3	332.410	3.464	20	30		EGEDHN
C=CCC1(C(=O)NCC2CCN(Cc3ccccn3)CC2)CCC1	ZINC001224402271	1375066432	/nfs/dbraw/zinc/06/64/32/1375066432.db2.gz	CIFSRSMGKIMBQR-UHFFFAOYSA-N	0	3	327.472	3.156	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)Cc2ccc(C3CCC3)cc2)c1	ZINC001131953858	1375068476	/nfs/dbraw/zinc/06/84/76/1375068476.db2.gz	ZJRJBUAZPKQTKN-UHFFFAOYSA-N	0	3	347.462	3.274	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CC[C@H](C)N(CCc2scnc2C)C1	ZINC001131971138	1375076271	/nfs/dbraw/zinc/07/62/71/1375076271.db2.gz	CKCSWTAVKAQNFT-DOTOQJQBSA-N	0	3	347.528	3.157	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@@]2(C)CCCc3ccccc32)CC1	ZINC001224862315	1375080631	/nfs/dbraw/zinc/08/06/31/1375080631.db2.gz	JYMMNMDAKHOIPW-QFIPXVFZSA-N	0	3	338.495	3.132	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@@H](C)N(Cc2cccc(N(C)C)c2)C1	ZINC001132002650	1375093746	/nfs/dbraw/zinc/09/37/46/1375093746.db2.gz	MBVWERWXJIVCDE-IEBWSBKVSA-N	0	3	341.499	3.025	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H]1CC[C@H](C)N(CCCc2cccc(F)c2)C1	ZINC001132022234	1375103450	/nfs/dbraw/zinc/10/34/50/1375103450.db2.gz	WZEFDUPVORGZDD-PXNSSMCTSA-N	0	3	344.474	3.387	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)COc2cccc(C(C)C)c2)CC[C@H]1C	ZINC001132054059	1375119818	/nfs/dbraw/zinc/11/98/18/1375119818.db2.gz	JOLPLQCOJQKVFA-MJGOQNOKSA-N	0	3	342.483	3.181	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2csc(C)c2C)CC[C@@H]1C	ZINC001132054416	1375120552	/nfs/dbraw/zinc/12/05/52/1375120552.db2.gz	OVNIXMVFMAHBTQ-XJKSGUPXSA-N	0	3	336.501	3.150	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCOc2ccc(C)cc2C)CC[C@@H]1C	ZINC001132083788	1375137597	/nfs/dbraw/zinc/13/75/97/1375137597.db2.gz	WVEQHWYBAQMIRW-ZWKOTPCHSA-N	0	3	330.472	3.227	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NCC1CCN([C@@H](C)c2cccc(F)c2)CC1	ZINC001225639513	1375137631	/nfs/dbraw/zinc/13/76/31/1375137631.db2.gz	RXWNUMSERVJDJI-JKSUJKDBSA-N	0	3	348.462	3.306	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccc(F)cc1	ZINC001225682133	1375143515	/nfs/dbraw/zinc/14/35/15/1375143515.db2.gz	NYQBUTCGMLNWLH-GUDVDZBRSA-N	0	3	342.458	3.240	20	30		EGEDHN
C=CCCCN1C[C@H](NC(=O)c2ocnc2C(F)(F)F)CC[C@H]1C	ZINC001132195814	1375201471	/nfs/dbraw/zinc/20/14/71/1375201471.db2.gz	VWTRZNJAJFGWJX-VXGBXAGGSA-N	0	3	345.365	3.242	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCc2cccc(N(C)C)c2)CC[C@@H]1C	ZINC001132237618	1375233125	/nfs/dbraw/zinc/23/31/25/1375233125.db2.gz	KLKLKIONNXRYSE-HKUYNNGSSA-N	0	3	343.515	3.230	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2ccn(C(C)C)c2C)CC[C@H]1C	ZINC001132237488	1375233518	/nfs/dbraw/zinc/23/35/18/1375233518.db2.gz	KDSOARQSNZDPHK-AEFFLSMTSA-N	0	3	347.503	3.163	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCOc2ccc(F)cc2)CC[C@@H]1C	ZINC001132252087	1375247167	/nfs/dbraw/zinc/24/71/67/1375247167.db2.gz	AMSNAJINNACKKT-RDJZCZTQSA-N	0	3	334.435	3.140	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCCOCc2ccccc2)CC[C@@H]1C	ZINC001132261137	1375253217	/nfs/dbraw/zinc/25/32/17/1375253217.db2.gz	KRVJGLKUNBOUKV-PKOBYXMFSA-N	0	3	330.472	3.139	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CC[C@@H](C)N(CCOCC3CC3)C2)CC1	ZINC001132292760	1375273696	/nfs/dbraw/zinc/27/36/96/1375273696.db2.gz	UWSAPAPVTVIPBJ-VQIMIIECSA-N	0	3	334.504	3.129	20	30		EGEDHN
C[C@H](C#N)C(=O)NC1CCN(C/C=C/c2ccc(Cl)cc2)CC1	ZINC001226640781	1375298472	/nfs/dbraw/zinc/29/84/72/1375298472.db2.gz	PPIBHONWMNIYDL-BAABZTOOSA-N	0	3	331.847	3.093	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2ccccc2Cl)CC[C@H]1C	ZINC001132434382	1375378561	/nfs/dbraw/zinc/37/85/61/1375378561.db2.gz	WJBWYCHRMUJWAL-HUUCEWRRSA-N	0	3	336.863	3.125	20	30		EGEDHN
C[C@H](c1ccccn1)N1CC[C@@H](Oc2nc3cc(C#N)ccc3[nH]2)C1	ZINC001227217865	1375408076	/nfs/dbraw/zinc/40/80/76/1375408076.db2.gz	DXBHLZJHHZUTCA-UKRRQHHQSA-N	0	3	333.395	3.044	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COc2cccc(CC)c2)CC[C@@H]1C	ZINC001132469012	1375410094	/nfs/dbraw/zinc/41/00/94/1375410094.db2.gz	PVKHUHLRRDAWHD-WMZOPIPTSA-N	0	3	330.472	3.173	20	30		EGEDHN
CC(C)C#CC(=O)NC1CCN([C@@H]2CCc3c2cccc3F)CC1	ZINC001227265348	1375414387	/nfs/dbraw/zinc/41/43/87/1375414387.db2.gz	IIANMLILNNLSFL-LJQANCHMSA-N	0	3	328.431	3.053	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCc2nc3ccccc3o2)CC[C@@H]1C	ZINC001132477527	1375414966	/nfs/dbraw/zinc/41/49/66/1375414966.db2.gz	FGNGMZOWTUGAAN-JKSUJKDBSA-N	0	3	341.455	3.306	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COc2ccc(C)cc2C)CC[C@H]1C	ZINC001132481576	1375416429	/nfs/dbraw/zinc/41/64/29/1375416429.db2.gz	HQCCYSKBOXKKDH-QZTJIDSGSA-N	0	3	330.472	3.227	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2cc(C)c(F)c(C)c2)CC[C@@H]1C	ZINC001132490671	1375422719	/nfs/dbraw/zinc/42/27/19/1375422719.db2.gz	XBWGRXGROZTHTR-FUHWJXTLSA-N	0	3	348.462	3.228	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1CC[C@@H](C)N(Cc2ccccc2CC)C1	ZINC001132529176	1375443242	/nfs/dbraw/zinc/44/32/42/1375443242.db2.gz	JMULVYCHUJEWAR-YLJYHZDGSA-N	0	3	344.499	3.311	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1CC[C@@H](C)N(Cc2ccc(C)cc2C)C1	ZINC001132532464	1375444868	/nfs/dbraw/zinc/44/48/68/1375444868.db2.gz	DIUCSWNFLVUYIL-QUCCMNQESA-N	0	3	344.499	3.365	20	30		EGEDHN
C=C(C)CCC(=O)NC1CCN(Cc2ccccc2N(C)C)CC1	ZINC001227588605	1375448025	/nfs/dbraw/zinc/44/80/25/1375448025.db2.gz	RUYOVERIEQRLME-UHFFFAOYSA-N	0	3	329.488	3.190	20	30		EGEDHN
C#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)/C=C(/C)CC)CC1	ZINC001132554506	1375461157	/nfs/dbraw/zinc/46/11/57/1375461157.db2.gz	HPAABAMEFSWLFX-ZWSWSHGQSA-N	0	3	339.483	3.254	20	30		EGEDHN
N#Cc1ccc(OC[C@@H]2CN(Cc3ccccc3)CCCO2)cc1C#N	ZINC001228260282	1375536230	/nfs/dbraw/zinc/53/62/30/1375536230.db2.gz	RBJNORHCUFILBG-NRFANRHFSA-N	0	3	347.418	3.100	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@@H](C)[C@H](CNCc2c(F)cccc2F)C1	ZINC001132810581	1375576879	/nfs/dbraw/zinc/57/68/79/1375576879.db2.gz	YGLCPJAGFZJQKZ-HZPDHXFCSA-N	0	3	348.437	3.198	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CCN(CCOc2ccc(C)cc2)CC1	ZINC001228631589	1375622401	/nfs/dbraw/zinc/62/24/01/1375622401.db2.gz	PQSBNIHHZGAVTA-UHFFFAOYSA-N	0	3	330.472	3.167	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC1CCN(Cc2ccc(OC)cc2)CC1	ZINC001228786124	1375675733	/nfs/dbraw/zinc/67/57/33/1375675733.db2.gz	CLHGIJPHMPUDBB-INIZCTEOSA-N	0	3	330.472	3.378	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC1CCN(CCOc2cccc(F)c2)CC1	ZINC001228810583	1375685173	/nfs/dbraw/zinc/68/51/73/1375685173.db2.gz	XLHPELBPNPDBKI-INIZCTEOSA-N	0	3	348.462	3.387	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2ccc(Cl)cc2C)CC1	ZINC001228971635	1375728158	/nfs/dbraw/zinc/72/81/58/1375728158.db2.gz	RZLLAYASVMJPIH-UHFFFAOYSA-N	0	3	336.863	3.045	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](C)[C@@H](CNCc2nccs2)C1	ZINC001133038343	1375729238	/nfs/dbraw/zinc/72/92/38/1375729238.db2.gz	APFSXSPCGKFVIZ-IRXDYDNUSA-N	0	3	347.528	3.301	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](C)[C@H](CNCc2cscn2)C1	ZINC001133039131	1375729863	/nfs/dbraw/zinc/72/98/63/1375729863.db2.gz	LNXAXQLADUSGKK-DLBZAZTESA-N	0	3	347.528	3.301	20	30		EGEDHN
N#Cc1ccc(OC[C@H]2CN(Cc3ccccc3)CCCO2)c(C#N)c1	ZINC001229033642	1375747657	/nfs/dbraw/zinc/74/76/57/1375747657.db2.gz	DLQFLQYDORBUJL-HXUWFJFHSA-N	0	3	347.418	3.100	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](C)[C@H](CNCc2ncc(C)s2)C1	ZINC001133073381	1375759278	/nfs/dbraw/zinc/75/92/78/1375759278.db2.gz	UHGOQYFKDGPXNS-GDBMZVCRSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](C)[C@H](CNCc2cc(C3CC3)no2)C1	ZINC001133072884	1375759477	/nfs/dbraw/zinc/75/94/77/1375759477.db2.gz	MEITYQXBWCSONP-DOTOQJQBSA-N	0	3	345.487	3.483	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](C)[C@H](CNCc2ccccc2C#N)C1	ZINC001133090902	1375769479	/nfs/dbraw/zinc/76/94/79/1375769479.db2.gz	LPZZTQOJUVOQKM-YLJYHZDGSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](C)[C@H](CNCc3cscn3)C2)CCC1	ZINC001133105767	1375778512	/nfs/dbraw/zinc/77/85/12/1375778512.db2.gz	XIIAYSBPBNTLSQ-JKSUJKDBSA-N	0	3	347.528	3.464	20	30		EGEDHN
COc1ccc2nc(O[C@@H]3CCN(Cc4ccccc4C#N)C3)[nH]c2c1	ZINC001229728882	1375881888	/nfs/dbraw/zinc/88/18/88/1375881888.db2.gz	FTZIYMOYPALADG-QGZVFWFLSA-N	0	3	348.406	3.096	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1cc[nH]c1C	ZINC001133390981	1375975649	/nfs/dbraw/zinc/97/56/49/1375975649.db2.gz	RQDOXSNOHKYPJL-UHFFFAOYSA-N	0	3	343.858	3.232	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NC1CCN([C@@H](C)c2ccc(F)cc2)CC1	ZINC001230415818	1376023919	/nfs/dbraw/zinc/02/39/19/1376023919.db2.gz	YXGURTILONJQGC-LSDHHAIUSA-N	0	3	334.435	3.058	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@@H](CCC)c3ccccn3)[C@@H]2C1	ZINC001188948801	1388418003	/nfs/dbraw/zinc/41/80/03/1388418003.db2.gz	HRLXZOWLWSNJBO-JENIJYKNSA-N	0	3	327.472	3.074	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)Cc1cccs1	ZINC001133520907	1376055987	/nfs/dbraw/zinc/05/59/87/1376055987.db2.gz	NUQKGIPRKSWBEY-VXGBXAGGSA-N	0	3	345.306	3.072	20	30		EGEDHN
C[C@@H](CC(=O)NCCNCc1cccc(C#N)c1)c1cccc(F)c1	ZINC001133612668	1376121548	/nfs/dbraw/zinc/12/15/48/1376121548.db2.gz	SOVJLYUXIYEYOC-HNNXBMFYSA-N	0	3	339.414	3.097	20	30		EGEDHN
C[C@@H](C#N)C(=O)N(C)C[C@H]1CCN1CCCc1cccc2ccccc21	ZINC001231294690	1376223253	/nfs/dbraw/zinc/22/32/53/1376223253.db2.gz	ZWIRYWKZWOATIL-FXAWDEMLSA-N	0	3	349.478	3.465	20	30		EGEDHN
CN(CCCNC(=O)C1CCCCC1)Cc1ccc(C#N)c(F)c1	ZINC001231344570	1376228611	/nfs/dbraw/zinc/22/86/11/1376228611.db2.gz	DVBPOCRBSGLGSC-UHFFFAOYSA-N	0	3	331.435	3.216	20	30		EGEDHN
C/C(=C/C(=O)N[C@H](C)C[C@@H](C)NCc1cc(F)ccc1C#N)C1CC1	ZINC001133867070	1376242772	/nfs/dbraw/zinc/24/27/72/1376242772.db2.gz	PQBYVGRUEXKXDW-CDWBCPPQSA-N	0	3	343.446	3.427	20	30		EGEDHN
CN(CCC#N)c1ccc(CN2CC[C@@]3(C2)CC(F)(F)CO3)cc1	ZINC001231820190	1376320494	/nfs/dbraw/zinc/32/04/94/1376320494.db2.gz	BITLDQURNYAJJC-KRWDZBQOSA-N	0	3	335.398	3.037	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H](C)C[C@@H](C)NCc1nc(C)c(C)s1	ZINC001134113204	1376373282	/nfs/dbraw/zinc/37/32/82/1376373282.db2.gz	ALFDUYSVEULHGK-KGLIPLIRSA-N	0	3	335.517	3.326	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001134119149	1376377191	/nfs/dbraw/zinc/37/71/91/1376377191.db2.gz	MGPOJSGKVORBCG-SJORKVTESA-N	0	3	325.456	3.125	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H](C)C[C@H](C)NCc1nc(C)sc1C	ZINC001134119170	1376377707	/nfs/dbraw/zinc/37/77/07/1376377707.db2.gz	MSWVOXYNFDMHFE-KBPBESRZSA-N	0	3	335.517	3.326	20	30		EGEDHN
CCc1[nH]ccc1C(=O)N[C@@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001134264462	1376445058	/nfs/dbraw/zinc/44/50/58/1376445058.db2.gz	ALUDMJUVRXRFNK-GJZGRUSLSA-N	0	3	338.455	3.135	20	30		EGEDHN
COc1cccc(Cl)c1CN[C@H](C)C[C@@H](C)NC(=O)C#CC1CC1	ZINC001134322683	1376475625	/nfs/dbraw/zinc/47/56/25/1376475625.db2.gz	VJJKEPGOOXZJOB-ZIAGYGMSSA-N	0	3	348.874	3.135	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)C#CC(C)(C)C)NCc1nc2ccccc2o1	ZINC001134329112	1376479264	/nfs/dbraw/zinc/47/92/64/1376479264.db2.gz	JRHZZMOSJSCNQH-GJZGRUSLSA-N	0	3	341.455	3.250	20	30		EGEDHN
N#Cc1ccc([O-])c(C[NH+]2CCC3(CN(Cc4ccccc4)C3)CC2)c1	ZINC001232678580	1376500923	/nfs/dbraw/zinc/50/09/23/1376500923.db2.gz	IMQBLKATYGGDPW-UHFFFAOYSA-N	0	3	347.462	3.362	20	30		EGEDHN
N#Cc1ccccc1O[C@H]1CCCN(Cc2ccc(CCO)cc2)C1	ZINC001232779948	1376512298	/nfs/dbraw/zinc/51/22/98/1376512298.db2.gz	YNMADZHTKOSYGG-FQEVSTJZSA-N	0	3	336.435	3.136	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H](C)C[C@H](C)NCc1ccn(CC)n1	ZINC001134417973	1376522157	/nfs/dbraw/zinc/52/21/57/1376522157.db2.gz	CIURDXFEYUAXOL-HOTGVXAUSA-N	0	3	332.492	3.044	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H](C)C[C@H](C)NCc1oc(C)nc1C	ZINC001134419236	1376524626	/nfs/dbraw/zinc/52/46/26/1376524626.db2.gz	UYYMUURDZBYEBZ-KBPBESRZSA-N	0	3	333.476	3.433	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@H](C)C[C@@H](C)NCc1ocnc1C	ZINC001134449375	1376544238	/nfs/dbraw/zinc/54/42/38/1376544238.db2.gz	UCNZHZPJLJCBLO-GHMZBOCLSA-N	0	3	327.856	3.135	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H](C)C[C@H](C)NCc1cc(F)ccc1C#N	ZINC001134470782	1376555463	/nfs/dbraw/zinc/55/54/63/1376555463.db2.gz	SFFVGNNEZDJKTJ-GJZGRUSLSA-N	0	3	331.435	3.427	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCC[C@@](O)(C(F)(F)F)[C@H](C)C1	ZINC001233080531	1376566860	/nfs/dbraw/zinc/56/68/60/1376566860.db2.gz	NKDNYBVXFRNNAF-CJNGLKHVSA-N	0	3	326.362	3.392	20	30		EGEDHN
C=CCN1C(=O)CCC[C@]12CCCN(Cc1ccc(C)c(O)c1)C2	ZINC001233228406	1376592934	/nfs/dbraw/zinc/59/29/34/1376592934.db2.gz	AUXATNULUNQMMH-HXUWFJFHSA-N	0	3	328.456	3.234	20	30		EGEDHN
Cc1ccc(CN2C[C@H]3C[NH+](Cc4ccc(C#N)cc4[O-])C[C@@H]3C2)cc1	ZINC001233384913	1376633954	/nfs/dbraw/zinc/63/39/54/1376633954.db2.gz	MYFOUEXPNDQKAU-SFTDATJTSA-N	0	3	347.462	3.136	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)C12CCC(CC1)C2	ZINC001134737002	1376688188	/nfs/dbraw/zinc/68/81/88/1376688188.db2.gz	MJKAKXVJFFAPLU-RNDNHVFHSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)CCC(C)(F)F	ZINC001134761636	1376706312	/nfs/dbraw/zinc/70/63/12/1376706312.db2.gz	QWNWMPQTWGJGMG-WDEREUQCSA-N	0	3	341.240	3.203	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)[C@@H](C)CCc3ccccc3F)[C@@H]2C1	ZINC001189102216	1388458807	/nfs/dbraw/zinc/45/88/07/1388458807.db2.gz	SZWIPQKSXSTVGZ-VDZJLULYSA-N	0	3	330.447	3.113	20	30		EGEDHN
C#CCCCC(=O)N(C)C[C@@H]1CCN1[C@@H](CCOC)c1ccccc1	ZINC001233967255	1376745733	/nfs/dbraw/zinc/74/57/33/1376745733.db2.gz	YFPZTXAMBASDPX-PMACEKPBSA-N	0	3	342.483	3.100	20	30		EGEDHN
CN(C[C@H]1CCN1CCCCC1CCOCC1)C(=O)C#CC(C)(C)C	ZINC001234216667	1376787654	/nfs/dbraw/zinc/78/76/54/1376787654.db2.gz	ZWSQCFSRGUFLDN-LJQANCHMSA-N	0	3	348.531	3.166	20	30		EGEDHN
CN(C[C@@H]1CCN1C[C@@H]1CCCC(F)(F)C1)C(=O)C#CC(C)(C)C	ZINC001234215560	1376788036	/nfs/dbraw/zinc/78/80/36/1376788036.db2.gz	MORGWZGHHBDZJE-CVEARBPZSA-N	0	3	340.458	3.394	20	30		EGEDHN
C=CCCCN1CC[C@H]1CN(C)C(=O)c1cc(Cl)c(Cl)n1C	ZINC001235050694	1376842522	/nfs/dbraw/zinc/84/25/22/1376842522.db2.gz	GYZDGUXQUZLVRQ-LBPRGKRZSA-N	0	3	344.286	3.444	20	30		EGEDHN
CCCCCCCN1CC[C@@H]1CN(C)C(=O)c1cc2n(n1)CCCC2	ZINC001235634057	1376880462	/nfs/dbraw/zinc/88/04/62/1376880462.db2.gz	TZYVECPDGQNGTJ-GOSISDBHSA-N	0	3	346.519	3.336	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H](C)C[C@H](C)NCc2ncc(C)s2)cc1	ZINC001135184972	1376958767	/nfs/dbraw/zinc/95/87/67/1376958767.db2.gz	RQIMKSHAYZCONL-KBPBESRZSA-N	0	3	341.480	3.120	20	30		EGEDHN
C=CC1(CC(=O)NCCNCc2cccc([N+](=O)[O-])c2)CCCCC1	ZINC001135186745	1376959973	/nfs/dbraw/zinc/95/99/73/1376959973.db2.gz	JQLLWRVXJOVVFZ-UHFFFAOYSA-N	0	3	345.443	3.327	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H](C)C[C@H](C)NCc1oc(C)nc1C	ZINC001135194390	1376965769	/nfs/dbraw/zinc/96/57/69/1376965769.db2.gz	UPNSCGDUMBAVNG-LSDHHAIUSA-N	0	3	333.476	3.248	20	30		EGEDHN
CC#CCCCC(=O)N[C@H](C)C[C@@H](C)NCc1cc(C2CC2)no1	ZINC001135230834	1376989608	/nfs/dbraw/zinc/98/96/08/1376989608.db2.gz	SGAQZWMBSKTVPV-HUUCEWRRSA-N	0	3	331.460	3.119	20	30		EGEDHN
C[C@@H](CC(=O)NCCNCc1ccc(C#N)cc1)c1ccccc1F	ZINC001135390342	1377069668	/nfs/dbraw/zinc/06/96/68/1377069668.db2.gz	JPAABPFWWYDEPX-HNNXBMFYSA-N	0	3	339.414	3.097	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)C1(C)CC(=C)C1	ZINC001135420720	1377086154	/nfs/dbraw/zinc/08/61/54/1377086154.db2.gz	YVGZGNDJASHYCI-STQMWFEESA-N	0	3	329.282	3.124	20	30		EGEDHN
C=C[C@](C)(O)CNC(c1ccc(OC)cc1)c1ccc(OC)cc1	ZINC001252542071	1377089753	/nfs/dbraw/zinc/08/97/53/1377089753.db2.gz	ZKEJATNTNVZRRT-FQEVSTJZSA-N	0	3	327.424	3.320	20	30		EGEDHN
Cc1sccc1C(=O)NC[C@@H](NCc1ccc(C#N)s1)C1CC1	ZINC001266406330	1377304440	/nfs/dbraw/zinc/30/44/40/1377304440.db2.gz	AYQRBYUVMBJXJR-MRXNPFEDSA-N	0	3	345.493	3.288	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CCN(Cc3ccnc(C)c3)C2)C1	ZINC001137407095	1377542645	/nfs/dbraw/zinc/54/26/45/1377542645.db2.gz	AZVCFAIVRWHILI-IBGZPJMESA-N	0	3	329.444	3.001	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3ccc(C)c(F)c3F)C2)C1=O	ZINC001137965747	1377654221	/nfs/dbraw/zinc/65/42/21/1377654221.db2.gz	ANIFRDXEMRGBHI-LJQANCHMSA-N	0	3	334.410	3.274	20	30		EGEDHN
C=CCO[C@@H]1CO[C@@]2(C1)CCCN(Cc1cccc(OCC)c1)C2	ZINC001138099342	1377676594	/nfs/dbraw/zinc/67/65/94/1377676594.db2.gz	RSLZDTMNRSFUFG-VQTJNVASSA-N	0	3	331.456	3.411	20	30		EGEDHN
C#CCOc1ccc(C[N@@H+](CC)Cc2ccccc2[O-])cc1OC	ZINC001138347069	1377707660	/nfs/dbraw/zinc/70/76/60/1377707660.db2.gz	SGIYYCWRKCVJIE-UHFFFAOYSA-N	0	3	325.408	3.435	20	30		EGEDHN
C#CCOc1ccc(C[N@H+](CC)Cc2ccccc2[O-])cc1OC	ZINC001138347069	1377707663	/nfs/dbraw/zinc/70/76/63/1377707663.db2.gz	SGIYYCWRKCVJIE-UHFFFAOYSA-N	0	3	325.408	3.435	20	30		EGEDHN
C#CCOc1ccc(CN2CC[C@@H](C(=O)OC)[C@@H]2c2ccccc2)cc1	ZINC001138559014	1377741857	/nfs/dbraw/zinc/74/18/57/1377741857.db2.gz	DANKOYGCYXCCHC-RTWAWAEBSA-N	0	3	349.430	3.435	20	30		EGEDHN
C=C(C)COc1ccccc1CN(C(C)C)[C@H]1CCN(C(C)=O)C1	ZINC001138666121	1377764933	/nfs/dbraw/zinc/76/49/33/1377764933.db2.gz	JIOYLUZUTRFOHH-IBGZPJMESA-N	0	3	330.472	3.473	20	30		EGEDHN
N#Cc1ccnc(-c2ccc(CN3CCC[C@@H](n4cncn4)C3)cc2)c1	ZINC001139405216	1377879700	/nfs/dbraw/zinc/87/97/00/1377879700.db2.gz	KHEPCMPNPRSMMB-LJQANCHMSA-N	0	3	344.422	3.049	20	30		EGEDHN
N#Cc1ccc(Oc2ccc(CN3CCN4CCCC[C@@H]4C3)cn2)cc1	ZINC001139425615	1377882341	/nfs/dbraw/zinc/88/23/41/1377882341.db2.gz	SBNZUTXKOHTMRX-LJQANCHMSA-N	0	3	348.450	3.416	20	30		EGEDHN
Cc1cncnc1O[C@H]1CCCN(Cc2c[nH]c3c2cccc3C#N)C1	ZINC001139707617	1377938091	/nfs/dbraw/zinc/93/80/91/1377938091.db2.gz	MDOKKGUUUQYEPG-KRWDZBQOSA-N	0	3	347.422	3.181	20	30		EGEDHN
Cc1ccc(CN2CCC[C@](O)(C(F)(F)F)[C@H](C)C2)cc1C#N	ZINC001139723185	1377941540	/nfs/dbraw/zinc/94/15/40/1377941540.db2.gz	URUFXAXBEXTZBY-CZUORRHYSA-N	0	3	326.362	3.392	20	30		EGEDHN
Cc1ccc(CN2CC[C@]3(C[C@H](Oc4cccnc4)CO3)C2)cc1C#N	ZINC001139724695	1377941711	/nfs/dbraw/zinc/94/17/11/1377941711.db2.gz	MLQRWQNQTJJDLE-SFTDATJTSA-N	0	3	349.434	3.074	20	30		EGEDHN
Cc1ccc(CN2CCC3(C[C@@H]3C(=O)NC3CCC3)CC2)cc1C#N	ZINC001139725286	1377942050	/nfs/dbraw/zinc/94/20/50/1377942050.db2.gz	JWLBSAHOPFITQS-LJQANCHMSA-N	0	3	337.467	3.138	20	30		EGEDHN
C=CCO[C@H]1CO[C@@]2(C1)CCCN(Cc1ccc(COC)s1)C2	ZINC001139830758	1377958324	/nfs/dbraw/zinc/95/83/24/1377958324.db2.gz	XCSGZDGPYSNXBN-CRAIPNDOSA-N	0	3	337.485	3.221	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@H]1CC[N@@H+](Cc1cc(F)ccc1[O-])C2	ZINC001140053949	1377996733	/nfs/dbraw/zinc/99/67/33/1377996733.db2.gz	GANFVMRSNLOPGV-OALUTQOASA-N	0	3	335.419	3.105	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@H]1CC[N@H+](Cc1cc(F)ccc1[O-])C2	ZINC001140053949	1377996734	/nfs/dbraw/zinc/99/67/34/1377996734.db2.gz	GANFVMRSNLOPGV-OALUTQOASA-N	0	3	335.419	3.105	20	30		EGEDHN
N#Cc1ccccc1O[C@@H]1CCC[N@@H+](Cc2cc(F)ccc2[O-])C1	ZINC001140058927	1377998158	/nfs/dbraw/zinc/99/81/58/1377998158.db2.gz	PDSYROSPGDYYIP-QGZVFWFLSA-N	0	3	326.371	3.446	20	30		EGEDHN
N#Cc1ccccc1O[C@@H]1CCC[N@H+](Cc2cc(F)ccc2[O-])C1	ZINC001140058927	1377998159	/nfs/dbraw/zinc/99/81/59/1377998159.db2.gz	PDSYROSPGDYYIP-QGZVFWFLSA-N	0	3	326.371	3.446	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CC[N@@H+](Cc3cc(F)ccc3[O-])C2)C1	ZINC001140057771	1377998352	/nfs/dbraw/zinc/99/83/52/1377998352.db2.gz	LOHNFDVNCWNMQD-LJQANCHMSA-N	0	3	348.418	3.142	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CC[N@H+](Cc3cc(F)ccc3[O-])C2)C1	ZINC001140057771	1377998353	/nfs/dbraw/zinc/99/83/53/1377998353.db2.gz	LOHNFDVNCWNMQD-LJQANCHMSA-N	0	3	348.418	3.142	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CC2)C(=O)Nc2ccccc23)c(F)c1	ZINC001140136042	1378017830	/nfs/dbraw/zinc/01/78/30/1378017830.db2.gz	FZDDVKNHKWDKBT-UHFFFAOYSA-N	0	3	335.382	3.183	20	30		EGEDHN
C#CCN1CC[C@@]2(CCCN(Cc3cccc(F)c3Cl)CC2)C1=O	ZINC001272608333	1378076058	/nfs/dbraw/zinc/07/60/58/1378076058.db2.gz	OYFNZJCDELRDFJ-IBGZPJMESA-N	0	3	348.849	3.317	20	30		EGEDHN
C=C(C)CN1CC[C@]2(CCCN2Cc2cc(C)c(OC)c(C)c2)C1=O	ZINC001273326779	1378098147	/nfs/dbraw/zinc/09/81/47/1378098147.db2.gz	KCFZWORZYNVUOV-OAQYLSRUSA-N	0	3	342.483	3.455	20	30		EGEDHN
C=C(C)COc1ccccc1CN1CCC2(CCC(=O)N(C)C2)CC1	ZINC001273375343	1378100815	/nfs/dbraw/zinc/10/08/15/1378100815.db2.gz	YIAXTPVCKQDRDW-UHFFFAOYSA-N	0	3	342.483	3.476	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@@]3(CCC[C@H]3C(=O)N(C)C)C2)c1[O-]	ZINC001277463809	1378223780	/nfs/dbraw/zinc/22/37/80/1378223780.db2.gz	OSEUIBMJQBECIW-RXVVDRJESA-N	0	3	342.483	3.201	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@@]3(CCC[C@H]3C(=O)N(C)C)C2)c1[O-]	ZINC001277463809	1378223783	/nfs/dbraw/zinc/22/37/83/1378223783.db2.gz	OSEUIBMJQBECIW-RXVVDRJESA-N	0	3	342.483	3.201	20	30		EGEDHN
CCN(Cc1ccccc1C#N)CC1CCN(C(=O)CCCF)CC1	ZINC001281834164	1378455015	/nfs/dbraw/zinc/45/50/15/1378455015.db2.gz	WAKHFLJURCLIRL-UHFFFAOYSA-N	0	3	345.462	3.368	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)[C@@H](CC#N)c2ccccc2)N(C)C)cc1	ZINC001142539560	1378455488	/nfs/dbraw/zinc/45/54/88/1378455488.db2.gz	SWBABWNMKCELTQ-PMACEKPBSA-N	0	3	335.451	3.411	20	30		EGEDHN
N#Cc1ccc2c(CN3CCC[C@@](O)(C(F)(F)F)CC3)c[nH]c2c1	ZINC001142912272	1378507897	/nfs/dbraw/zinc/50/78/97/1378507897.db2.gz	ZXTCJEUGUIIMRM-INIZCTEOSA-N	0	3	337.345	3.319	20	30		EGEDHN
N#Cc1ccc2c(CN3CCCC[C@](O)(C(F)(F)F)C3)c[nH]c2c1	ZINC001142911876	1378508011	/nfs/dbraw/zinc/50/80/11/1378508011.db2.gz	MQPARAKUOMOGRI-MRXNPFEDSA-N	0	3	337.345	3.319	20	30		EGEDHN
CC(C)CC(=O)NC1CCN(Cc2c[nH]c3cc(C#N)ccc23)CC1	ZINC001142921898	1378509128	/nfs/dbraw/zinc/50/91/28/1378509128.db2.gz	YRSIGJOOIBSQCA-UHFFFAOYSA-N	0	3	338.455	3.166	20	30		EGEDHN
O=C1C=C2CN(Cc3cc(F)cc(OC(F)(F)F)c3)CCC2S1	ZINC001143256717	1378570509	/nfs/dbraw/zinc/57/05/09/1378570509.db2.gz	RRGCPSMIVQBZBY-CYBMUJFWSA-N	0	3	347.333	3.498	20	30		EGEDHN
CCOc1ccc(CN2CCC3SC(=O)C=C3C2)c(F)c1F	ZINC001143270961	1378572474	/nfs/dbraw/zinc/57/24/74/1378572474.db2.gz	BJZGGQMMYQSUNX-ZDUSSCGKSA-N	0	3	325.380	3.138	20	30		EGEDHN
COc1ccc(Cl)c(CN2CCC3SC(=O)C=C3C2)c1F	ZINC001143892321	1378657510	/nfs/dbraw/zinc/65/75/10/1378657510.db2.gz	WIPKMQBUVWZWRZ-CYBMUJFWSA-N	0	3	327.808	3.262	20	30		EGEDHN
COC(=O)[C@H](c1ccccc1)[C@H]1CCCCN1Cc1ccc(C#N)cn1	ZINC001144163577	1378689670	/nfs/dbraw/zinc/68/96/70/1378689670.db2.gz	LDQULJYBMGDXRA-WOJBJXKFSA-N	0	3	349.434	3.265	20	30		EGEDHN
N#Cc1ccc(CN2CCCC3(CN(Cc4ccccc4)C3)C2)nc1	ZINC001144166717	1378690916	/nfs/dbraw/zinc/69/09/16/1378690916.db2.gz	SEALKKRPGAMPPK-UHFFFAOYSA-N	0	3	332.451	3.051	20	30		EGEDHN
C#Cc1ccc(CN2CCC3(CC2)OC(=O)Nc2ncccc23)cc1	ZINC001144576840	1378747475	/nfs/dbraw/zinc/74/74/75/1378747475.db2.gz	SDNOMRFMAVLNOX-UHFFFAOYSA-N	0	3	333.391	3.116	20	30		EGEDHN
CC(C)(Cc1ccccc1)C(=O)NCCNCc1ccc(C#N)cc1	ZINC001146883946	1378939795	/nfs/dbraw/zinc/93/97/95/1378939795.db2.gz	PHBWBPHFDUUKQF-UHFFFAOYSA-N	0	3	335.451	3.033	20	30		EGEDHN
C=CCCCCC[N@H+]1CCC2(CN(C(=O)c3ccccc3[O-])C2)C1	ZINC001146999762	1378953488	/nfs/dbraw/zinc/95/34/88/1378953488.db2.gz	NBDFKSRGWHIPQE-UHFFFAOYSA-N	0	3	328.456	3.287	20	30		EGEDHN
C=CCCCCC[N@@H+]1CCC2(CN(C(=O)c3ccccc3[O-])C2)C1	ZINC001146999762	1378953493	/nfs/dbraw/zinc/95/34/93/1378953493.db2.gz	NBDFKSRGWHIPQE-UHFFFAOYSA-N	0	3	328.456	3.287	20	30		EGEDHN
C[C@H](C(=O)NCCNCc1cccc(C#N)c1)c1ccc(Cl)s1	ZINC001147161302	1378979095	/nfs/dbraw/zinc/97/90/95/1378979095.db2.gz	LBVUOBVJCBSLCP-LBPRGKRZSA-N	0	3	347.871	3.283	20	30		EGEDHN
CN(C(=O)CCC1CC1)[C@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001283493727	1378986950	/nfs/dbraw/zinc/98/69/50/1378986950.db2.gz	QRJRTGVUXFBCMV-QGZVFWFLSA-N	0	3	331.485	3.137	20	30		EGEDHN
C#CCCCC(=O)N1CC2(C1)CCN([C@H]1CCc3ccc(F)cc31)C2	ZINC001147434734	1379020616	/nfs/dbraw/zinc/02/06/16/1379020616.db2.gz	IKDCISHJFOCMBD-IBGZPJMESA-N	0	3	340.442	3.151	20	30		EGEDHN
C=C(C)CCC(=O)N1CC2(C1)CCN(Cc1cc(C)ccc1OC)C2	ZINC001147658512	1379056407	/nfs/dbraw/zinc/05/64/07/1379056407.db2.gz	USAHIEUXYSVAFU-UHFFFAOYSA-N	0	3	342.483	3.394	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)N1CC2(C1)CCN(Cc1ccc(OC)cc1)C2	ZINC001148087508	1379114469	/nfs/dbraw/zinc/11/44/69/1379114469.db2.gz	DJJQYNXYEGDVTI-IRXDYDNUSA-N	0	3	342.483	3.188	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001148137880	1379123300	/nfs/dbraw/zinc/12/33/00/1379123300.db2.gz	HEUGUIWAOBWZCI-SJORKVTESA-N	0	3	337.467	3.051	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC2(C1)CCN(Cc1sc(C)nc1C)C2	ZINC001148147683	1379125861	/nfs/dbraw/zinc/12/58/61/1379125861.db2.gz	XQVAAKRQXXGCAZ-AWEZNQCLSA-N	0	3	347.528	3.397	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N1CC2(C1)CCN([C@H](C)c1ccc(F)cc1)C2	ZINC001148899864	1379293574	/nfs/dbraw/zinc/29/35/74/1379293574.db2.gz	IFGUQTQMJWLEAH-CVEARBPZSA-N	0	3	346.446	3.012	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N1CC2(C1)CCN([C@@H](C)c1ccccc1F)C2	ZINC001148899878	1379293813	/nfs/dbraw/zinc/29/38/13/1379293813.db2.gz	IMISQXQAWVYZKE-JKSUJKDBSA-N	0	3	346.446	3.012	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cccc(Cl)c2Cl)cc1	ZINC001148897282	1379293967	/nfs/dbraw/zinc/29/39/67/1379293967.db2.gz	RNXQMPZULITKMH-UHFFFAOYSA-N	0	3	348.233	3.385	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)C2(C3CCCCC3)CC2)ccc1F	ZINC001149134315	1379330509	/nfs/dbraw/zinc/33/05/09/1379330509.db2.gz	HXKLWRWVSJUKAQ-UHFFFAOYSA-N	0	3	343.446	3.264	20	30		EGEDHN
C=CCCC(=O)NC[C@H]1CN(Cc2ccc(C(C)C)cc2)CCCO1	ZINC001149341892	1379366651	/nfs/dbraw/zinc/36/66/51/1379366651.db2.gz	RJZGIEIRCAUZMF-FQEVSTJZSA-N	0	3	344.499	3.483	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2ccccc2C2CCC2)c1	ZINC001149351930	1379367479	/nfs/dbraw/zinc/36/74/79/1379367479.db2.gz	KRSNBPUSVNGRKM-UHFFFAOYSA-N	0	3	333.435	3.345	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@@H]1CN(Cc2ccccc2C)CCCO1	ZINC001149771961	1379442563	/nfs/dbraw/zinc/44/25/63/1379442563.db2.gz	KBVYDEBWKQEHJC-LJQANCHMSA-N	0	3	344.499	3.304	20	30		EGEDHN
CCc1sc(C(=O)NCCNCc2cccc(C#N)c2)cc1C	ZINC001150317366	1379532575	/nfs/dbraw/zinc/53/25/75/1379532575.db2.gz	SAIBWKCURBJBPC-UHFFFAOYSA-N	0	3	327.453	3.010	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)[C@@H](CC)Cc2ccccc2)C1	ZINC001150393216	1379546023	/nfs/dbraw/zinc/54/60/23/1379546023.db2.gz	BHLWIIQYJKMMPX-PMACEKPBSA-N	0	3	344.499	3.039	20	30		EGEDHN
C#CCCN1CCCO[C@@H](CNC(=O)CC(C)(C)C2CCCCC2)C1	ZINC001150586899	1379573141	/nfs/dbraw/zinc/57/31/41/1379573141.db2.gz	BUELHXMHHGZECO-IBGZPJMESA-N	0	3	348.531	3.213	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)C2(C3CCCCC3)CC2)C1	ZINC001150654249	1379590669	/nfs/dbraw/zinc/59/06/69/1379590669.db2.gz	VTRBUMLOANMUAR-SFHVURJKSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=CCC1(C(=O)NC[C@H]2CN(CCCF)CCCO2)CCCCC1	ZINC001150761776	1379609585	/nfs/dbraw/zinc/60/95/85/1379609585.db2.gz	SAWCMKBIHOEROE-KRWDZBQOSA-N	0	3	340.483	3.080	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@H](C)[C@@H](C)C(C)(C)C)CC1	ZINC001151357026	1379704878	/nfs/dbraw/zinc/70/48/78/1379704878.db2.gz	OBJSXXPUKFXBEG-IAGOWNOFSA-N	0	3	338.536	3.478	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@@H]2C[C@H]2C2CCCC2)CC1	ZINC001151374514	1379707206	/nfs/dbraw/zinc/70/72/06/1379707206.db2.gz	JFIRKCBIDQHMCL-RBUKOAKNSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@@H](C)c2ccccc2C)CC1	ZINC001151409836	1379713542	/nfs/dbraw/zinc/71/35/42/1379713542.db2.gz	JGIDTUUDVCTBHV-SFHVURJKSA-N	0	3	344.499	3.272	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)C23CC(C(C)(C)C)(C2)C3)CC1	ZINC001151415359	1379715718	/nfs/dbraw/zinc/71/57/18/1379715718.db2.gz	OWLRGVOZMUEUIW-UHFFFAOYSA-N	0	3	348.531	3.376	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)[C@H]1CC=CCC1	ZINC001151830956	1379789830	/nfs/dbraw/zinc/78/98/30/1379789830.db2.gz	QXBFKYGHMCMBMW-WBVHZDCISA-N	0	3	343.446	3.380	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)C(=O)NCCNCc1cccc(F)c1	ZINC001151906976	1379814069	/nfs/dbraw/zinc/81/40/69/1379814069.db2.gz	RNWGSYITPBWRII-IBGZPJMESA-N	0	3	340.442	3.467	20	30		EGEDHN
C=CCC1(C(=O)NCCNCc2cnn(C(C)(C)C)c2)CCCCC1	ZINC001151997962	1379835472	/nfs/dbraw/zinc/83/54/72/1379835472.db2.gz	MXGRVCGCKQYWMX-UHFFFAOYSA-N	0	3	346.519	3.371	20	30		EGEDHN
C=CCOCC(=O)NC[C@@H](C)N(CC)Cc1ccc(F)c(Cl)c1	ZINC001152370515	1379921697	/nfs/dbraw/zinc/92/16/97/1379921697.db2.gz	JSHMEIBTYDETBV-CYBMUJFWSA-N	0	3	342.842	3.008	20	30		EGEDHN
CCN(Cc1ccc(Cl)c(Cl)c1)[C@H](C)CNC(=O)[C@@H](C)C#N	ZINC001152412517	1379929474	/nfs/dbraw/zinc/92/94/74/1379929474.db2.gz	BAJIOFZHAYGTDD-NWDGAFQWSA-N	0	3	342.270	3.480	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)[C@H]1[C@@H]2CCCC[C@@H]21	ZINC001152604957	1379957270	/nfs/dbraw/zinc/95/72/70/1379957270.db2.gz	ZPNQLCMZAKVJLW-XCLNPWKQSA-N	0	3	339.483	3.321	20	30		EGEDHN
CCc1oc2ccccc2c1C(=O)NCCNCc1ccc(C#N)cc1	ZINC001152626624	1379958691	/nfs/dbraw/zinc/95/86/91/1379958691.db2.gz	MEBQAINJRGYAEQ-UHFFFAOYSA-N	0	3	347.418	3.386	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)c1coc(C)c1	ZINC001152955225	1379998922	/nfs/dbraw/zinc/99/89/22/1379998922.db2.gz	JRUYMXBENOZGIZ-CQSZACIVSA-N	0	3	325.412	3.100	20	30		EGEDHN
CCN(Cc1ccc(Cl)c(OC)c1)[C@H](C)CNC(=O)C#CC1CC1	ZINC001153232589	1380041140	/nfs/dbraw/zinc/04/11/40/1380041140.db2.gz	JXEWENMCEDOOJK-CQSZACIVSA-N	0	3	348.874	3.089	20	30		EGEDHN
CC1(C)CCCC[C@H]1CC(=O)NCCNCc1ccc(C#N)cc1	ZINC001153836532	1380140687	/nfs/dbraw/zinc/14/06/87/1380140687.db2.gz	ASIQFZPMFYBMPO-SFHVURJKSA-N	0	3	327.472	3.371	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)Cc1ccccc1	ZINC001154059290	1380194859	/nfs/dbraw/zinc/19/48/59/1380194859.db2.gz	SZWVCPOUFRFUBU-QGZVFWFLSA-N	0	3	335.451	3.128	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1cc2c(cc(C)cc2C)[nH]1	ZINC001154505081	1380293051	/nfs/dbraw/zinc/29/30/51/1380293051.db2.gz	IFRKZFWSQRTNPQ-MRXNPFEDSA-N	0	3	325.456	3.248	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H](C)N(CC)Cc1cccc(NC(C)=O)c1	ZINC001154620244	1380319398	/nfs/dbraw/zinc/31/93/98/1380319398.db2.gz	FNVNDZFRIJVUQV-OAHLLOKOSA-N	0	3	345.487	3.184	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)[C@@H](C)C(F)(F)F	ZINC001154648193	1380323465	/nfs/dbraw/zinc/32/34/65/1380323465.db2.gz	CIHYGJCUCYNGOT-CHWSQXEVSA-N	0	3	341.377	3.083	20	30		EGEDHN
C=C/C(C)=C\CC(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)cc1	ZINC001154677526	1380329851	/nfs/dbraw/zinc/32/98/51/1380329851.db2.gz	ROIHTBGQHSOMHY-BOVGMKJQSA-N	0	3	325.456	3.407	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@@H](C)N(CC)Cc1cccc(C#N)c1	ZINC001154742350	1380344096	/nfs/dbraw/zinc/34/40/96/1380344096.db2.gz	DKPGSNUIKXAEOM-IAGOWNOFSA-N	0	3	327.472	3.487	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NCCCN[C@H](C)c1cc(F)ccc1F	ZINC001155438351	1380453392	/nfs/dbraw/zinc/45/33/92/1380453392.db2.gz	AMBORKYTYWYQMU-ZIAGYGMSSA-N	0	3	340.414	3.103	20	30		EGEDHN
CCN(CC#CCOC)[C@H](C)CNC(=O)C(C)(C)C1CCCCC1	ZINC001155710751	1380486008	/nfs/dbraw/zinc/48/60/08/1380486008.db2.gz	YMSNEBXZYSEXJE-QGZVFWFLSA-N	0	3	336.520	3.069	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1ccc(C(F)F)cc1F	ZINC001156025832	1380514191	/nfs/dbraw/zinc/51/41/91/1380514191.db2.gz	LHDBBFVKBQQFGN-GFCCVEGCSA-N	0	3	326.362	3.227	20	30		EGEDHN
Cc1ncc(C#N)c(N(C)[C@H]2CN(Cc3ccccc3)CC[C@@H]2C)n1	ZINC001156341193	1380561517	/nfs/dbraw/zinc/56/15/17/1380561517.db2.gz	FSKYZFPHERRTSG-KXBFYZLASA-N	0	3	335.455	3.004	20	30		EGEDHN
N#Cc1ncc(Cl)nc1NC[C@@H](c1ccccc1)N1CCCC1	ZINC001156530279	1380588765	/nfs/dbraw/zinc/58/87/65/1380588765.db2.gz	INZVRRGPJBRXDN-HNNXBMFYSA-N	0	3	327.819	3.251	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1cccc(C(F)(F)F)c1	ZINC001156561535	1380594478	/nfs/dbraw/zinc/59/44/78/1380594478.db2.gz	XNWAAQQMJGWNSL-CYBMUJFWSA-N	0	3	326.362	3.169	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1ccsc1C(F)(F)F	ZINC001156617775	1380600300	/nfs/dbraw/zinc/60/03/00/1380600300.db2.gz	RYCOMWMWVJVTLJ-LLVKDONJSA-N	0	3	332.391	3.230	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1cc(F)c(F)cc1Cl	ZINC001156712592	1380615082	/nfs/dbraw/zinc/61/50/82/1380615082.db2.gz	ZBMSUUMXKGMEFA-LLVKDONJSA-N	0	3	328.790	3.082	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)C[C@@H](C)C1CC1	ZINC001157146251	1380785876	/nfs/dbraw/zinc/78/58/76/1380785876.db2.gz	TYQAUMQIALXWKV-HZPDHXFCSA-N	0	3	327.472	3.321	20	30		EGEDHN
CN1CCC[C@@H]2CN(c3nc4ccccc4c(Cl)c3C#N)C[C@@H]21	ZINC001157271876	1380828998	/nfs/dbraw/zinc/82/89/98/1380828998.db2.gz	KJVXFUDVHGWMHU-WBMJQRKESA-N	0	3	326.831	3.290	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1cscc1C(F)(F)F	ZINC001157358071	1380851314	/nfs/dbraw/zinc/85/13/14/1380851314.db2.gz	SVGLHVWOIHGJJJ-LLVKDONJSA-N	0	3	332.391	3.230	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@H](OC(C)C)c1ccccc1	ZINC001157395183	1380867871	/nfs/dbraw/zinc/86/78/71/1380867871.db2.gz	LPWDPOWWUUEDKD-IEBWSBKVSA-N	0	3	330.472	3.003	20	30		EGEDHN
C[C@H](NCCCNC(=O)C#CC1CC1)c1ccccc1Br	ZINC001157719098	1381013421	/nfs/dbraw/zinc/01/34/21/1381013421.db2.gz	RNIQJUZEVXJPQO-ZDUSSCGKSA-N	0	3	349.272	3.019	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)COCc1ccc(C)cc1	ZINC001158043171	1381110602	/nfs/dbraw/zinc/11/06/02/1381110602.db2.gz	AGYJHUYSCVDKFP-LJQANCHMSA-N	0	3	330.472	3.011	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)C[C@@H]1C=CCCC1	ZINC001158113824	1381131570	/nfs/dbraw/zinc/13/15/70/1381131570.db2.gz	XAIATPALVCTMSS-RTBURBONSA-N	0	3	334.504	3.248	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)Cc1cccc2cnccc21	ZINC001158136851	1381139001	/nfs/dbraw/zinc/13/90/01/1381139001.db2.gz	ZETVHKPVXYYFSX-LJQANCHMSA-N	0	3	337.467	3.276	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc(Cl)c(Cl)[nH]1	ZINC001158300507	1381190508	/nfs/dbraw/zinc/19/05/08/1381190508.db2.gz	AUUKSZATNXDRCA-LLVKDONJSA-N	0	3	330.259	3.434	20	30		EGEDHN
C=C(Cl)CN(C)C[C@H]1CCCCN1C(=O)c1cccc2n[nH]cc21	ZINC001158301140	1381191485	/nfs/dbraw/zinc/19/14/85/1381191485.db2.gz	XWLDZSCXHDSAOY-CQSZACIVSA-N	0	3	346.862	3.242	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc(-c2c[nH]cn2)cc1	ZINC001158709749	1381361614	/nfs/dbraw/zinc/36/16/14/1381361614.db2.gz	SOOPOVOKAJAECD-GOSISDBHSA-N	0	3	338.455	3.189	20	30		EGEDHN
C#CCC1(C(=O)NCCCNCc2ccc(F)cc2Cl)CCC1	ZINC001159638302	1381856393	/nfs/dbraw/zinc/85/63/93/1381856393.db2.gz	NQZSGAUPAYUUIO-UHFFFAOYSA-N	0	3	336.838	3.269	20	30		EGEDHN
C[C@H](C(=O)NCCC1=CCN(Cc2ccc(C#N)cc2)CC1)C1CC1	ZINC001159717087	1381877907	/nfs/dbraw/zinc/87/79/07/1381877907.db2.gz	BMOTXROJGSPKAH-INIZCTEOSA-N	0	3	337.467	3.243	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C[C@H](OCC)C2=CCCC2)CC1	ZINC001160131519	1382008082	/nfs/dbraw/zinc/00/80/82/1382008082.db2.gz	PNLRYRNPDLNPIL-IBGZPJMESA-N	0	3	332.488	3.216	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc(C(C)(C)C)cn2)CC1	ZINC001160189711	1382028990	/nfs/dbraw/zinc/02/89/90/1382028990.db2.gz	LUKFUKQRGHXUDJ-UHFFFAOYSA-N	0	3	327.472	3.317	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C/C=C\c2cccc(F)c2)CC1	ZINC001160385949	1382090078	/nfs/dbraw/zinc/09/00/78/1382090078.db2.gz	DRBSJFVXTHAROS-ALCCZGGFSA-N	0	3	340.442	3.391	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)CCCc2ccsc2)CC1	ZINC001160412088	1382097122	/nfs/dbraw/zinc/09/71/22/1382097122.db2.gz	UBUFCUBSYNUCSO-UHFFFAOYSA-N	0	3	330.497	3.233	20	30		EGEDHN
CSc1nc(Cl)c(/C=N/[O-])c(-n2ccc3cccc(C[NH3+])c32)n1	ZINC001160456831	1382108976	/nfs/dbraw/zinc/10/89/76/1382108976.db2.gz	SVJANSPVGUYECA-QGMBQPNBSA-N	0	3	347.831	3.063	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C/C=C\c2ccccc2F)CC1	ZINC001160473118	1382116435	/nfs/dbraw/zinc/11/64/35/1382116435.db2.gz	FEJLODOUZGMXRQ-VURMDHGXSA-N	0	3	340.442	3.391	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C/C=C/c2ccccc2F)CC1	ZINC001160473117	1382116702	/nfs/dbraw/zinc/11/67/02/1382116702.db2.gz	FEJLODOUZGMXRQ-SOFGYWHQSA-N	0	3	340.442	3.391	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)Cc2ccc3cccnc3c2)CC1	ZINC001160492687	1382123462	/nfs/dbraw/zinc/12/34/62/1382123462.db2.gz	ZDMZHONWZXCZAB-UHFFFAOYSA-N	0	3	335.451	3.102	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)N1CC[C@H]1COCc1ccccc1	ZINC001160527092	1382132388	/nfs/dbraw/zinc/13/23/88/1382132388.db2.gz	PLNDSSCODHNRCJ-OALUTQOASA-N	0	3	330.472	3.268	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc(-c3ccco3)o2)CC1	ZINC001160641499	1382158696	/nfs/dbraw/zinc/15/86/96/1382158696.db2.gz	XWVSLYQICVTFLT-UHFFFAOYSA-N	0	3	338.407	3.315	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H]2CCc3cc(F)ccc32)CC1	ZINC001160688887	1382171368	/nfs/dbraw/zinc/17/13/68/1382171368.db2.gz	QZQIIXSWEVMXKF-HXUWFJFHSA-N	0	3	340.442	3.017	20	30		EGEDHN
CC#CCCCC(=O)NCCC1=CCN(Cc2cnccc2C)CC1	ZINC001160946797	1382247810	/nfs/dbraw/zinc/24/78/10/1382247810.db2.gz	PHNTWHACAOVXMT-UHFFFAOYSA-N	0	3	339.483	3.222	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc(N3CC=CC3)cc2)CC1	ZINC001161194831	1382336163	/nfs/dbraw/zinc/33/61/63/1382336163.db2.gz	NJEFNOPFHFUFFZ-UHFFFAOYSA-N	0	3	337.467	3.001	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)NCCC1=CCN(Cc2ccc(C#N)cc2)CC1	ZINC001161271653	1382358045	/nfs/dbraw/zinc/35/80/45/1382358045.db2.gz	TVVBESLQKKKQBY-WOJBJXKFSA-N	0	3	337.467	3.243	20	30		EGEDHN
CCC[C@H]1CCC[C@@H]1C(=O)NCCCNCc1ccccc1C#N	ZINC001161428035	1382407717	/nfs/dbraw/zinc/40/77/17/1382407717.db2.gz	QIWFKPDPEZHZQS-LPHOPBHVSA-N	0	3	327.472	3.371	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)Cc2nsc3ccccc32)CC1	ZINC001161924646	1382554447	/nfs/dbraw/zinc/55/44/47/1382554447.db2.gz	HTZQFPFTUAUFRA-UHFFFAOYSA-N	0	3	341.480	3.163	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)CC(C)(C)CC	ZINC001162822017	1382886495	/nfs/dbraw/zinc/88/64/95/1382886495.db2.gz	CZZVREFHPQNKGP-UHFFFAOYSA-N	0	3	328.500	3.497	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C[C@@H]1CC[C@@H]2C[C@@H]21	ZINC001162847725	1382893258	/nfs/dbraw/zinc/89/32/58/1382893258.db2.gz	AJSBTINRLMJXGC-HKBOAZHASA-N	0	3	338.495	3.107	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CCCCC1(F)F	ZINC001162876790	1382901857	/nfs/dbraw/zinc/90/18/57/1382901857.db2.gz	LNQSZQWCARGVJO-GOSISDBHSA-N	0	3	348.437	3.106	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)c1cc[nH]c1C1CC1	ZINC001162906781	1382911414	/nfs/dbraw/zinc/91/14/14/1382911414.db2.gz	QZZPWLKPCAKXFC-UHFFFAOYSA-N	0	3	349.478	3.190	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)c1occc1Cl	ZINC001162918427	1382915932	/nfs/dbraw/zinc/91/59/32/1382915932.db2.gz	CZRZMWAAHKABRB-UHFFFAOYSA-N	0	3	344.842	3.231	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CCC[C@@H]1CC	ZINC001162918901	1382917124	/nfs/dbraw/zinc/91/71/24/1382917124.db2.gz	ILQGWWVOLGYQFX-SFTDATJTSA-N	0	3	340.511	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C[C@@H](C)CC(C)C	ZINC001162982792	1382936397	/nfs/dbraw/zinc/93/63/97/1382936397.db2.gz	PBLNYVUIHIJBCO-IBGZPJMESA-N	0	3	328.500	3.353	20	30		EGEDHN
O=C(NCCC1(CNCC#Cc2cccc(Cl)c2)CC1)C1CCC1	ZINC001163103196	1382965580	/nfs/dbraw/zinc/96/55/80/1382965580.db2.gz	AEPIRFVIKQSVQO-UHFFFAOYSA-N	0	3	344.886	3.368	20	30		EGEDHN
CCCC(=O)NCCC1(CNCC#Cc2cccc(Cl)c2)CC1	ZINC001163161848	1382980352	/nfs/dbraw/zinc/98/03/52/1382980352.db2.gz	BSOVGZNNRVHHTR-UHFFFAOYSA-N	0	3	332.875	3.368	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)[C@H]1CCCC[C@@H]1C1CC1	ZINC001163171580	1382982800	/nfs/dbraw/zinc/98/28/00/1382982800.db2.gz	KXITXGVPKDWJDF-UXHICEINSA-N	0	3	339.483	3.371	20	30		EGEDHN
N#Cc1cc(Br)cc(N[C@@H]2CNCc3ccsc32)n1	ZINC001163240858	1383003157	/nfs/dbraw/zinc/00/31/57/1383003157.db2.gz	XHUGYCRNYKLLSR-LLVKDONJSA-N	0	3	335.230	3.034	20	30		EGEDHN
C[C@@H]1CCC[C@@H](C)N1c1nccnc1C(C#N)C(=O)OC(C)(C)C	ZINC001163549867	1383075900	/nfs/dbraw/zinc/07/59/00/1383075900.db2.gz	GWJWWCKUVINBCG-MGPQQGTHSA-N	0	3	330.432	3.193	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCCNCc1ccn(C2CCCC2)n1	ZINC001163855487	1383129738	/nfs/dbraw/zinc/12/97/38/1383129738.db2.gz	DUFOGMJXPZVVJS-UHFFFAOYSA-N	0	3	332.492	3.196	20	30		EGEDHN
C#CCCCCCC(=O)NCCCNCc1cc(O)ccc1Cl	ZINC001163969488	1383141417	/nfs/dbraw/zinc/14/14/17/1383141417.db2.gz	KMZWZXKEEVAQMH-UHFFFAOYSA-N	0	3	336.863	3.225	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCCNCc1nc(C(C)(C)C)cs1	ZINC001164233639	1383169356	/nfs/dbraw/zinc/16/93/56/1383169356.db2.gz	INOGXOGGDCYZOW-ZIAGYGMSSA-N	0	3	337.533	3.495	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCCCNCc1ccn(C(CC)CC)n1	ZINC001164323211	1383177675	/nfs/dbraw/zinc/17/76/75/1383177675.db2.gz	DGLIXUMDQQNORU-MRXNPFEDSA-N	0	3	334.508	3.442	20	30		EGEDHN
C=CCCCC(=O)NCCCNCc1cnc(-c2ccccc2)o1	ZINC001165531072	1383307373	/nfs/dbraw/zinc/30/73/73/1383307373.db2.gz	PBTNMPIQBQYUOY-UHFFFAOYSA-N	0	3	327.428	3.294	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc3c(c2)CCOC3)CC1	ZINC001166116925	1383391842	/nfs/dbraw/zinc/39/18/42/1383391842.db2.gz	NHSKNOPVGYFLEX-UHFFFAOYSA-N	0	3	348.874	3.002	20	30		EGEDHN
CC1(C)CC[C@H](C(=O)NCCCNCc2cc(C#N)ccc2F)C1	ZINC001166200357	1383401232	/nfs/dbraw/zinc/40/12/32/1383401232.db2.gz	OVPMUADFFCPHDA-HNNXBMFYSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCCNCc2c(Cl)cccc2OC)C1	ZINC001166238531	1383405716	/nfs/dbraw/zinc/40/57/16/1383405716.db2.gz	ALRGQJHKXSYGAE-UHFFFAOYSA-N	0	3	336.863	3.301	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)C2(C)CC=CC2)CC1	ZINC001166985912	1383509995	/nfs/dbraw/zinc/50/99/95/1383509995.db2.gz	IATAWQXHTWZOJI-UHFFFAOYSA-N	0	3	341.293	3.127	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCC1(CNCc2c(C)noc2C)CC1	ZINC001167018462	1383519883	/nfs/dbraw/zinc/51/98/83/1383519883.db2.gz	JXSZEJRQDWKAPD-SFHVURJKSA-N	0	3	333.476	3.270	20	30		EGEDHN
C=CCCC1(C(=O)NCCC2(CNCc3conc3CC)CC2)CC1	ZINC001167029798	1383523156	/nfs/dbraw/zinc/52/31/56/1383523156.db2.gz	CPKAQEIYCMSCOJ-UHFFFAOYSA-N	0	3	345.487	3.360	20	30		EGEDHN
Cc1ccc(C(=O)NCCCNCc2ccccc2C#N)c(F)c1F	ZINC001167210419	1383567683	/nfs/dbraw/zinc/56/76/83/1383567683.db2.gz	GVCRDAMKOMLBSO-UHFFFAOYSA-N	0	3	343.377	3.055	20	30		EGEDHN
C=CC1(CC(=O)NCCCNCc2nccn2CC)CCCCC1	ZINC001168182861	1383836440	/nfs/dbraw/zinc/83/64/40/1383836440.db2.gz	QOLHXZRPIIIXHG-UHFFFAOYSA-N	0	3	332.492	3.026	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@@H](F)Cc2ccccc2)CC1	ZINC001168283741	1383863150	/nfs/dbraw/zinc/86/31/50/1383863150.db2.gz	TXBMPMYOWGSAOC-INIZCTEOSA-N	0	3	338.854	3.196	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cc(C)n(C(C)C)n2)CC1	ZINC001168580902	1383940995	/nfs/dbraw/zinc/94/09/95/1383940995.db2.gz	OPMKABFBCBURBD-UHFFFAOYSA-N	0	3	338.883	3.015	20	30		EGEDHN
C[C@H](N)c1ccn(-c2c(F)c(F)c(C(F)(F)F)c(F)c2F)n1	ZINC001169233216	1384125290	/nfs/dbraw/zinc/12/52/90/1384125290.db2.gz	OPEIKMOXGJXOQU-BYPYZUCNSA-N	0	3	327.203	3.467	20	30		EGEDHN
CCO[C@@H](CC)C(=O)N[C@H](C)CCCCNCc1ccccc1C#N	ZINC001169568662	1384160339	/nfs/dbraw/zinc/16/03/39/1384160339.db2.gz	REVSSDQPYPUDCY-APWZRJJASA-N	0	3	345.487	3.138	20	30		EGEDHN
Cc1[nH]ccc1C(=O)N[C@@H](C)CCCCNCc1ccccc1C#N	ZINC001170069963	1384228742	/nfs/dbraw/zinc/22/87/42/1384228742.db2.gz	ZDHGFSNRNABUMO-HNNXBMFYSA-N	0	3	338.455	3.273	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1ccc2cnccc2c1	ZINC001170303312	1384285626	/nfs/dbraw/zinc/28/56/26/1384285626.db2.gz	DJNUKFRJGOLZIJ-UHFFFAOYSA-N	0	3	344.418	3.016	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)[C@@H]1C[C@H]1c1cc(F)c(F)c(F)c1	ZINC001170385554	1384304679	/nfs/dbraw/zinc/30/46/79/1384304679.db2.gz	TTXCFTNJFUKJCE-NWDGAFQWSA-N	0	3	346.780	3.056	20	30		EGEDHN
C=CC(=NCOC)NC[C@H](c1ccc(Cl)cc1Cl)N(C)C	ZINC001170586751	1384346414	/nfs/dbraw/zinc/34/64/14/1384346414.db2.gz	WZCSTKUTTCSAEI-CQSZACIVSA-N	0	3	330.259	3.374	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@H](C)CCC(C)(C)C	ZINC001171152419	1384455610	/nfs/dbraw/zinc/45/56/10/1384455610.db2.gz	CXWAXGCAYALLTP-GFCCVEGCSA-N	0	3	333.314	3.453	20	30		EGEDHN
CN(C)C(=O)Cc1ccc(NC(=N)c2ccc3cc(O)ccc3c2)cc1	ZINC001171185214	1384463133	/nfs/dbraw/zinc/46/31/33/1384463133.db2.gz	UHNNRYKZZUKUCW-UHFFFAOYSA-N	0	3	347.418	3.213	20	30		EGEDHN
C[C@@H](Cc1cccc(C#N)c1)N1CCC[C@H]1CNC(=O)OC(C)(C)C	ZINC001171221870	1384472026	/nfs/dbraw/zinc/47/20/26/1384472026.db2.gz	WJFSSYJHYKVBNO-YJBOKZPZSA-N	0	3	343.471	3.478	20	30		EGEDHN
C[C@@H](Cc1cccc(C#N)c1)N1CC[C@@H](N2CCCCC2)[C@@H](F)C1	ZINC001171234663	1384475990	/nfs/dbraw/zinc/47/59/90/1384475990.db2.gz	XPRZAYDYMDJBKF-FFZOFVMBSA-N	0	3	329.463	3.388	20	30		EGEDHN
Cc1cc(OC(F)(F)F)ccc1NC(=N)c1ccc(C(N)=O)cc1	ZINC001171256431	1384480256	/nfs/dbraw/zinc/48/02/56/1384480256.db2.gz	INAYDJRFZRFFPY-UHFFFAOYSA-N	0	3	337.301	3.030	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@]2(C)CCc3ccccc32)C1	ZINC001316625698	1384490858	/nfs/dbraw/zinc/49/08/58/1384490858.db2.gz	YCOZDHRLICQCHC-SIXWZSSISA-N	0	3	332.875	3.127	20	30		EGEDHN
CC(C)C(C)(C)C(=O)NC[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001316628745	1384493337	/nfs/dbraw/zinc/49/33/37/1384493337.db2.gz	AGAJNTQWGHYZPP-JCNLHEQBSA-N	0	3	345.462	3.364	20	30		EGEDHN
N#Cc1ccc(OCCNc2cc(CN3CCCCC3)ccn2)cc1	ZINC001171482650	1384536148	/nfs/dbraw/zinc/53/61/48/1384536148.db2.gz	RBRRDBGCLWQVNO-UHFFFAOYSA-N	0	3	336.439	3.430	20	30		EGEDHN
C=CCN(Cc1ccccc1)[C@@H]1CC(=O)N(C(=O)OC(C)(C)C)C1	ZINC001171718815	1384611603	/nfs/dbraw/zinc/61/16/03/1384611603.db2.gz	ZSUKSPWXBVOQKX-MRXNPFEDSA-N	0	3	330.428	3.211	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)NCc1ccncc1Br	ZINC001172296884	1384762706	/nfs/dbraw/zinc/76/27/06/1384762706.db2.gz	JRHCHUQDEDPSHQ-LBPRGKRZSA-N	0	3	330.229	3.437	20	30		EGEDHN
N#Cc1nccnc1N1CCN([C@H]2CCC[C@@H](c3ccccc3)C2)CC1	ZINC001172553949	1384811213	/nfs/dbraw/zinc/81/12/13/1384811213.db2.gz	TXHSFQTZBFOLKU-MOPGFXCFSA-N	0	3	347.466	3.197	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H](NCc2cccc(F)c2)C[C@H]1C#N	ZINC001172967972	1384892147	/nfs/dbraw/zinc/89/21/47/1384892147.db2.gz	NHQHFCAMCLLYLI-HOTGVXAUSA-N	0	3	333.407	3.207	20	30		EGEDHN
CCCCC(=O)N[C@@H](C)[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001317202846	1384980507	/nfs/dbraw/zinc/98/05/07/1384980507.db2.gz	WJEJARDRXHWPHX-QFBILLFUSA-N	0	3	327.472	3.465	20	30		EGEDHN
COc1ccccc1CN1CCN(C2CCC(C)(C#N)CC2)CC1	ZINC001173596091	1384984399	/nfs/dbraw/zinc/98/43/99/1384984399.db2.gz	JDBFDQHOQOYMNH-UHFFFAOYSA-N	0	3	327.472	3.285	20	30		EGEDHN
C[C@H](CNC(=O)c1cc(C#N)c[nH]1)N[C@@H](C)c1ccc(F)c(Cl)c1	ZINC001317230742	1385009025	/nfs/dbraw/zinc/00/90/25/1385009025.db2.gz	BRYDWLGPLPJOQL-MNOVXSKESA-N	0	3	348.809	3.148	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H](C)CCCCNCc1cc2n(n1)CCC2	ZINC001174671801	1385132173	/nfs/dbraw/zinc/13/21/73/1385132173.db2.gz	HJJFWAMDTYOHGB-MRXNPFEDSA-N	0	3	346.519	3.196	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H](C)CCCCNCc1ncc(C)s1	ZINC001174797974	1385150224	/nfs/dbraw/zinc/15/02/24/1385150224.db2.gz	DYXIOHGZDZWNSK-HNNXBMFYSA-N	0	3	335.517	3.410	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@H](C)CCCCNCc1ccn(CC)n1	ZINC001174833549	1385156970	/nfs/dbraw/zinc/15/69/70/1385156970.db2.gz	PNOKMSOJURYQLI-SJORKVTESA-N	0	3	334.508	3.270	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@H](C)CCCCNCc1nnc(C(C)C)[nH]1	ZINC001174850094	1385160275	/nfs/dbraw/zinc/16/02/75/1385160275.db2.gz	SYCDHPRGQLMIMN-HZPDHXFCSA-N	0	3	349.523	3.295	20	30		EGEDHN
C=CCCCC(=O)N[C@H](C)CCCCNCc1cc2n(n1)CCCC2	ZINC001174979332	1385177912	/nfs/dbraw/zinc/17/79/12/1385177912.db2.gz	XNWGNCKERNPKAL-QGZVFWFLSA-N	0	3	346.519	3.340	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](C)CCCCNCc2ccn(CC)n2)CC1	ZINC001175074465	1385190102	/nfs/dbraw/zinc/19/01/02/1385190102.db2.gz	SILXBWYWMBFCHN-KRWDZBQOSA-N	0	3	346.519	3.414	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H](C)CCCCNCc1cc(C)n(C)n1	ZINC001175081939	1385191519	/nfs/dbraw/zinc/19/15/19/1385191519.db2.gz	LBBPZPBNVONLEW-HNAYVOBHSA-N	0	3	334.508	3.095	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)CCCCNCc2ocnc2C)CCC1	ZINC001175097840	1385194482	/nfs/dbraw/zinc/19/44/82/1385194482.db2.gz	OLFYTPATFBJLOL-OAHLLOKOSA-N	0	3	333.476	3.494	20	30		EGEDHN
COc1cccc(CCCN2CCN(c3ccc(C#N)cc3)CC2)c1	ZINC001175443585	1385291298	/nfs/dbraw/zinc/29/12/98/1385291298.db2.gz	FTTLAZIJLFKLRK-UHFFFAOYSA-N	0	3	335.451	3.322	20	30		EGEDHN
CC(C)(C(=O)NCCCNCc1ccccc1C#N)c1ccccc1	ZINC001175642652	1385360839	/nfs/dbraw/zinc/36/08/39/1385360839.db2.gz	XFGRXNXRJQZWKW-UHFFFAOYSA-N	0	3	335.451	3.132	20	30		EGEDHN
CCN1CCN(c2ccc(Nc3ccc(OC)cc3C#N)cc2)CC1	ZINC001175780403	1385402862	/nfs/dbraw/zinc/40/28/62/1385402862.db2.gz	FXTSQLHATMCTFB-UHFFFAOYSA-N	0	3	336.439	3.452	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CCCN(CCC[C@H](C)O)C2)CCCCC1	ZINC001317955011	1385585535	/nfs/dbraw/zinc/58/55/35/1385585535.db2.gz	AWEYBETWMKVOMK-ZWKOTPCHSA-N	0	3	336.520	3.255	20	30		EGEDHN
C=C[C@H](C(=O)NCCCNCc1c(C)onc1CC)c1ccccc1	ZINC001176778078	1385692323	/nfs/dbraw/zinc/69/23/23/1385692323.db2.gz	JGXUPTSQXXXWGW-KRWDZBQOSA-N	0	3	341.455	3.111	20	30		EGEDHN
C=C[C@H](C(=O)NCCCNCc1ccncc1Cl)c1ccccc1	ZINC001176778708	1385693452	/nfs/dbraw/zinc/69/34/52/1385693452.db2.gz	OLTMNZVRBXYRFP-KRWDZBQOSA-N	0	3	343.858	3.301	20	30		EGEDHN
C=C[C@@H](C(=O)NCCCNCc1ccncc1Cl)c1ccccc1	ZINC001176778709	1385693546	/nfs/dbraw/zinc/69/35/46/1385693546.db2.gz	OLTMNZVRBXYRFP-QGZVFWFLSA-N	0	3	343.858	3.301	20	30		EGEDHN
Cc1cccc(C2(C(=O)NCCCNCc3ccccc3C#N)CC2)c1	ZINC001177007542	1385771474	/nfs/dbraw/zinc/77/14/74/1385771474.db2.gz	FMACKUAJWIGTNF-UHFFFAOYSA-N	0	3	347.462	3.194	20	30		EGEDHN
C=C(Br)CNC[C@]1(NC(=O)C(C)C)CCCC[C@H]1C	ZINC001318739252	1385847644	/nfs/dbraw/zinc/84/76/44/1385847644.db2.gz	BKONEDSBXXFBIW-IUODEOHRSA-N	0	3	331.298	3.206	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)CCOCC	ZINC001177249326	1385883496	/nfs/dbraw/zinc/88/34/96/1385883496.db2.gz	FPQDOIXEFLGARP-UHFFFAOYSA-N	0	3	330.900	3.164	20	30		EGEDHN
C[C@]1(C(=O)NCCCNCc2ccccc2C#N)CCc2ccccc21	ZINC001177247821	1385883602	/nfs/dbraw/zinc/88/36/02/1385883602.db2.gz	UYKZSHYDLRHMSU-QFIPXVFZSA-N	0	3	347.462	3.058	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@@H](C)COC	ZINC001177257869	1385887102	/nfs/dbraw/zinc/88/71/02/1385887102.db2.gz	VIWJDOFIXFSFSW-AWEZNQCLSA-N	0	3	330.900	3.020	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)C1CC(OC)C1	ZINC001177345051	1385922625	/nfs/dbraw/zinc/92/26/25/1385922625.db2.gz	KNTNDNUIVOFEFH-UHFFFAOYSA-N	0	3	342.911	3.162	20	30		EGEDHN
COCCNc1cccc(F)c1NC(=O)C(C#N)Cc1cccs1	ZINC001177915633	1386082491	/nfs/dbraw/zinc/08/24/91/1386082491.db2.gz	AKCNWAIGTXJQSV-LBPRGKRZSA-N	0	3	347.415	3.266	20	30		EGEDHN
C=CCCC(=O)NCCCCCCNCc1cc(F)ccc1C#N	ZINC001178017823	1386109655	/nfs/dbraw/zinc/10/96/55/1386109655.db2.gz	GECMWHPVUZCEDA-UHFFFAOYSA-N	0	3	331.435	3.430	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCCCCCNCc1nsc2ccccc12	ZINC001178052100	1386117325	/nfs/dbraw/zinc/11/73/25/1386117325.db2.gz	CNYXXGUSOATLTI-AWEZNQCLSA-N	0	3	344.484	3.222	20	30		EGEDHN
N#Cc1ccccc1CNCCCCCCNC(=O)/C=C/C1CC1	ZINC001178111554	1386132464	/nfs/dbraw/zinc/13/24/64/1386132464.db2.gz	MKYZVIWKBLQBQC-VAWYXSNFSA-N	0	3	325.456	3.291	20	30		EGEDHN
CC[C@H](C)C(=O)N1CC[C@H](NCC#Cc2cccc(Cl)c2)[C@@H]1C	ZINC001178140195	1386140075	/nfs/dbraw/zinc/14/00/75/1386140075.db2.gz	YJQQFZDMOZKOOD-MPGHIAIKSA-N	0	3	332.875	3.317	20	30		EGEDHN
C=CCOCC(=O)N1CC[C@H](N[C@H](C)c2ccccc2Cl)[C@@H]1C	ZINC001178335760	1386192264	/nfs/dbraw/zinc/19/22/64/1386192264.db2.gz	JIOBDNQSINHGBY-KEYYUXOJSA-N	0	3	336.863	3.183	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccc(Cl)cc2)CCN1C(=O)C1CC=CC1	ZINC001178405472	1386207208	/nfs/dbraw/zinc/20/72/08/1386207208.db2.gz	KBGAARJXKQUUNZ-KXBFYZLASA-N	0	3	342.870	3.237	20	30		EGEDHN
O=C(C#CC1CC1)NCCCCCCNCc1c(F)cccc1F	ZINC001178435390	1386216563	/nfs/dbraw/zinc/21/65/63/1386216563.db2.gz	RBSDZAMHRNAXST-UHFFFAOYSA-N	0	3	334.410	3.144	20	30		EGEDHN
O=C(C#CC1CC1)NCCCCCCNCc1csc(C2CC2)n1	ZINC001178435208	1386216675	/nfs/dbraw/zinc/21/66/75/1386216675.db2.gz	ILIDNLJMNDFWEV-UHFFFAOYSA-N	0	3	345.512	3.200	20	30		EGEDHN
CN1CCC(N(C(=O)C#Cc2ccc(F)cc2F)C2CCCC2)CC1	ZINC001178568757	1386251236	/nfs/dbraw/zinc/25/12/36/1386251236.db2.gz	KVMXDZSPQSEREX-UHFFFAOYSA-N	0	3	346.421	3.182	20	30		EGEDHN
C=C(C)CCC(=O)NCCCCCCN[C@@H](C)c1nnc(CC)[nH]1	ZINC001178598322	1386259033	/nfs/dbraw/zinc/25/90/33/1386259033.db2.gz	AIDRBGLJWQAJCW-HNNXBMFYSA-N	0	3	335.496	3.051	20	30		EGEDHN
N#Cc1ccccc1CNCCCCCCNC(=O)[C@H]1CCC1(F)F	ZINC001178792847	1386306529	/nfs/dbraw/zinc/30/65/29/1386306529.db2.gz	IYNGIDVBFORCBH-QGZVFWFLSA-N	0	3	349.425	3.370	20	30		EGEDHN
C[C@](CNCC#Cc1ccc(F)cc1)(NC(=O)[C@H]1CC1(C)C)C1CC1	ZINC001698642405	1406290682	/nfs/dbraw/zinc/29/06/82/1406290682.db2.gz	NCFMRUBQWGKLKN-WIYYLYMNSA-N	0	3	342.458	3.098	20	30		EGEDHN
N#Cc1ccccc1CNCCCCCCNC(=O)c1cc(F)c[nH]1	ZINC001179048683	1386387688	/nfs/dbraw/zinc/38/76/88/1386387688.db2.gz	JAGMCOCLZSYYOC-UHFFFAOYSA-N	0	3	342.418	3.105	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCCCCCNCc1nnc(C(C)C)[nH]1	ZINC001179212386	1386424273	/nfs/dbraw/zinc/42/42/73/1386424273.db2.gz	LIUWKYJOIDTFEL-UHFFFAOYSA-N	0	3	349.523	3.297	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCCCCCCNCc1cc(OC)no1	ZINC001179335185	1386453761	/nfs/dbraw/zinc/45/37/61/1386453761.db2.gz	GGGHECZYKLZESX-OAHLLOKOSA-N	0	3	337.464	3.052	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCCCCCCNCc1cc(OC)no1	ZINC001179335184	1386454037	/nfs/dbraw/zinc/45/40/37/1386454037.db2.gz	GGGHECZYKLZESX-HNNXBMFYSA-N	0	3	337.464	3.052	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCCCCCCN[C@@H](C)c1nnc(C)[nH]1	ZINC001179335219	1386454103	/nfs/dbraw/zinc/45/41/03/1386454103.db2.gz	HNZBFTGDXRUVPP-GJZGRUSLSA-N	0	3	335.496	3.043	20	30		EGEDHN
CCn1ccc(C(=O)N2CC[C@H](NCC#Cc3ccccc3)[C@@H]2C)c1C	ZINC001179395799	1386474657	/nfs/dbraw/zinc/47/46/57/1386474657.db2.gz	GEWCKOHBCUORCT-RXVVDRJESA-N	0	3	349.478	3.061	20	30		EGEDHN
N#Cc1ccccc1CNCCCCCCNC(=O)[C@@H]1CC12CC2	ZINC001179678115	1386550619	/nfs/dbraw/zinc/55/06/19/1386550619.db2.gz	LWOIXXPJPJMOHQ-SFHVURJKSA-N	0	3	325.456	3.125	20	30		EGEDHN
C=CCSCC(=O)N(Cc1ccc(F)cc1)C1CCN(C)CC1	ZINC001180559472	1386835108	/nfs/dbraw/zinc/83/51/08/1386835108.db2.gz	BJAMOSDWMXQDKQ-UHFFFAOYSA-N	0	3	336.476	3.168	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2nc(C)c(C)s2)C1	ZINC001180846775	1386883310	/nfs/dbraw/zinc/88/33/10/1386883310.db2.gz	XARVWCAXQASJID-FZKQIMNGSA-N	0	3	335.517	3.300	20	30		EGEDHN
Cc1cccc(C(=O)N[C@@H](C)CNCc2ccc(F)c(C#N)c2)c1F	ZINC001321856500	1386997878	/nfs/dbraw/zinc/99/78/78/1386997878.db2.gz	QMSYIAAXKIEWPQ-ZDUSSCGKSA-N	0	3	343.377	3.053	20	30		EGEDHN
CC(C)[C@H](C)CC(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001181526724	1387010158	/nfs/dbraw/zinc/01/01/58/1387010158.db2.gz	GSSCSMZLSURISM-RHSMWYFYSA-N	0	3	331.435	3.070	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccn(C3CCCCC3)n2)CC1	ZINC001322080147	1387047518	/nfs/dbraw/zinc/04/75/18/1387047518.db2.gz	MRRYPWHAGTVFLM-UHFFFAOYSA-N	0	3	331.464	3.160	20	30		EGEDHN
CCCC[C@@H](C)C(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001182279373	1387137193	/nfs/dbraw/zinc/13/71/93/1387137193.db2.gz	XIVSDRGLDJDALT-RHSMWYFYSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@@H](C)[C@](C)(CNCc2nccs2)C1	ZINC001182306323	1387143748	/nfs/dbraw/zinc/14/37/48/1387143748.db2.gz	ZKCOVPLKTAQTKP-IIDMSEBBSA-N	0	3	335.517	3.320	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@@H](C)[C@](C)(CNCc2ccn(CC)n2)C1	ZINC001182313303	1387145197	/nfs/dbraw/zinc/14/51/97/1387145197.db2.gz	AVSAOHMHKQOVQL-MBOZVWFJSA-N	0	3	346.519	3.080	20	30		EGEDHN
C[C@H](CNC(=O)c1cc(C#N)c[nH]1)N(C)[C@@H](C)c1ccc(Cl)cc1	ZINC001329409935	1389100352	/nfs/dbraw/zinc/10/03/52/1389100352.db2.gz	MAGPVYJKGSDJGE-OLZOCXBDSA-N	0	3	344.846	3.351	20	30		EGEDHN
C=C(Br)CNC[C@H](C1CC1)N(C)C(=O)CCC1CCC1	ZINC001331269508	1389677738	/nfs/dbraw/zinc/67/77/38/1389677738.db2.gz	PJNFSGAHLPKDCF-OAHLLOKOSA-N	0	3	343.309	3.302	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1nnc(Cc2ccc(C)cc2)s1	ZINC001339918172	1390189611	/nfs/dbraw/zinc/18/96/11/1390189611.db2.gz	BHEIGXCLPNFCNS-AWEZNQCLSA-N	0	3	330.457	3.059	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccccc1-c1n[nH]c(C(C)C)n1	ZINC001340604479	1390325829	/nfs/dbraw/zinc/32/58/29/1390325829.db2.gz	IOYYCSPZJOPAFV-CQSZACIVSA-N	0	3	327.432	3.217	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)C(C#N)C(=O)Nc1ccc(C(=O)OCC)cc1	ZINC001341954933	1390553937	/nfs/dbraw/zinc/55/39/37/1390553937.db2.gz	IHNKWZWGNPUKQX-BBRMVZONSA-N	0	3	342.395	3.113	20	30		EGEDHN
CCCn1ncc(C(=O)C(C#N)c2nccn2Cc2ccccc2)c1C	ZINC001342270802	1390593684	/nfs/dbraw/zinc/59/36/84/1390593684.db2.gz	ZCZIDPWDXFPAGO-QGZVFWFLSA-N	0	3	347.422	3.336	20	30		EGEDHN
CCS[C@H](C(=O)C(C#N)c1nc(N)c2ccccc2n1)C(C)C	ZINC001342547748	1390624946	/nfs/dbraw/zinc/62/49/46/1390624946.db2.gz	DFLDJYHWKAVRNO-DOMZBBRYSA-N	0	3	328.441	3.166	20	30		EGEDHN
C[C@H](CC#N)OC(=O)C1CCN(c2cc(Cl)ccc2Cl)C1=O	ZINC001342565524	1390626953	/nfs/dbraw/zinc/62/69/53/1390626953.db2.gz	GRTAMQWSPPCQNE-MWLCHTKSSA-N	0	3	341.194	3.192	20	30		EGEDHN
N#Cc1ccc(C2CCN(C(=O)[C@H](N)C3CCCCC3)CC2)cc1	ZINC001342869761	1390665673	/nfs/dbraw/zinc/66/56/73/1390665673.db2.gz	QSTDZSQQWWDQCH-LJQANCHMSA-N	0	3	325.456	3.172	20	30		EGEDHN
N#CC(C(=O)CC[C@H]1CCCCO1)c1nccn1Cc1ccccc1	ZINC001342924804	1390673307	/nfs/dbraw/zinc/67/33/07/1390673307.db2.gz	NZNMSBYYTANSHX-QZTJIDSGSA-N	0	3	337.423	3.457	20	30		EGEDHN
C=CCN(CCc1ccccc1)C(=O)c1cccc2c1OCCNC2	ZINC001343195702	1390698619	/nfs/dbraw/zinc/69/86/19/1390698619.db2.gz	DXWYJPAWHJMJBL-UHFFFAOYSA-N	0	3	336.435	3.040	20	30		EGEDHN
C=C(C)Cn1c([C@H]2C[C@H]2C)nnc1N1CCN(C2CCCC2)CC1	ZINC001343639498	1390728066	/nfs/dbraw/zinc/72/80/66/1390728066.db2.gz	RQBXWECVKQHWAK-WBVHZDCISA-N	0	3	329.492	3.042	20	30		EGEDHN
N#CC(C(=O)[C@H]1CCCSC1)c1nccn1Cc1ccccc1	ZINC001343703938	1390732030	/nfs/dbraw/zinc/73/20/30/1390732030.db2.gz	FQVZISDVVWOLOE-HOTGVXAUSA-N	0	3	325.437	3.251	20	30		EGEDHN
Cc1c(C(=O)C(C#N)c2ncc(Cl)n2C)cnn1C1CCCC1	ZINC001344864522	1390820064	/nfs/dbraw/zinc/82/00/64/1390820064.db2.gz	RPHKUFUEKGKFFJ-LBPRGKRZSA-N	0	3	331.807	3.184	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN[C@H](c2ccccc2)[C@H]2CCCO2)c1	ZINC001345606406	1390868277	/nfs/dbraw/zinc/86/82/77/1390868277.db2.gz	PIISLZZJQFUNGB-TZIWHRDSSA-N	0	3	349.434	3.397	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2nc(C(C)C)oc2C)CCCC1	ZINC001698798861	1406471638	/nfs/dbraw/zinc/47/16/38/1406471638.db2.gz	ZIICRPWXHKRJRS-UHFFFAOYSA-N	0	3	339.867	3.491	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCCOc1cccc(C(C)=O)c1	ZINC001347337014	1391056550	/nfs/dbraw/zinc/05/65/50/1391056550.db2.gz	BJIMOSBIRLKFFT-QGZVFWFLSA-N	0	3	339.395	3.141	20	30		EGEDHN
CC(C)O[C@H](C(=O)C(C#N)c1ncc(Cl)n1C)c1ccccc1	ZINC001349703283	1391355911	/nfs/dbraw/zinc/35/59/11/1391355911.db2.gz	WGKXCWPHENJXMO-CJNGLKHVSA-N	0	3	331.803	3.416	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)COC1CCCCC1	ZINC001479825078	1392413565	/nfs/dbraw/zinc/41/35/65/1392413565.db2.gz	JIQWKJAUZRLSHE-WBVHZDCISA-N	0	3	342.911	3.447	20	30		EGEDHN
C=CCOCCN1CCC[C@@H](NC(=O)C[C@H](C)C2CCCCC2)C1	ZINC001479911988	1392480214	/nfs/dbraw/zinc/48/02/14/1392480214.db2.gz	UKYYLGWMXDYHRY-PKOBYXMFSA-N	0	3	336.520	3.376	20	30		EGEDHN
Cc1cc(Cl)cc(C(=O)NC[C@@H](C)NCc2ccc(C#N)s2)c1	ZINC001480503599	1392772155	/nfs/dbraw/zinc/77/21/55/1392772155.db2.gz	VASSPUWHMDYUAZ-GFCCVEGCSA-N	0	3	347.871	3.490	20	30		EGEDHN
CCCC1(C(=O)NC[C@@H](C)NCc2ccc(OC)c(C#N)c2)CCC1	ZINC001480518018	1392775865	/nfs/dbraw/zinc/77/58/65/1392775865.db2.gz	KZEOXQAPBLIHIW-OAHLLOKOSA-N	0	3	343.471	3.132	20	30		EGEDHN
Cc1c(C(=O)NC[C@H](C)NCc2ccc(C#N)s2)ccn1C(C)C	ZINC001480522571	1392778300	/nfs/dbraw/zinc/77/83/00/1392778300.db2.gz	QVEDUZWVDAAQSO-ZDUSSCGKSA-N	0	3	344.484	3.219	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@H](CCNC(=O)c2ccsc2)C1	ZINC001481417179	1394276863	/nfs/dbraw/zinc/27/68/63/1394276863.db2.gz	MKZJFUXNTWIUPP-HNNXBMFYSA-N	0	3	339.464	3.262	20	30		EGEDHN
CC[C@H](CNC(=O)c1cccc(F)c1C)NCc1ccc(C#N)s1	ZINC001481813284	1394541753	/nfs/dbraw/zinc/54/17/53/1394541753.db2.gz	FQVFYVNDEHPOPN-CYBMUJFWSA-N	0	3	345.443	3.366	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1cccc2c1CCC2)C1CC1	ZINC001481952022	1394615115	/nfs/dbraw/zinc/61/51/15/1394615115.db2.gz	ONJFIEXKZNKIPF-LJQANCHMSA-N	0	3	332.875	3.416	20	30		EGEDHN
CC(C)C(=O)N[C@@H](CNCc1ccc(C#N)s1)C1CCCCC1	ZINC001482402471	1394965101	/nfs/dbraw/zinc/96/51/01/1394965101.db2.gz	OJFNWTQLMMGDFF-KRWDZBQOSA-N	0	3	333.501	3.430	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@H]2[C@H]1CCN2Cc1cncc(C)c1	ZINC001484464222	1395399659	/nfs/dbraw/zinc/39/96/59/1395399659.db2.gz	TZYFULJLLPZUOG-VQTJNVASSA-N	0	3	339.483	3.149	20	30		EGEDHN
Cc1ccsc1C(=O)NC[C@H](C)N(C)Cc1ccc(C#N)cc1	ZINC001485271871	1395753204	/nfs/dbraw/zinc/75/32/04/1395753204.db2.gz	GOWYWCMLWMKKLM-AWEZNQCLSA-N	0	3	327.453	3.179	20	30		EGEDHN
CCCc1occc1C(=O)N(C)C[C@@H](C)NCc1ccc(C#N)s1	ZINC001485944203	1396171583	/nfs/dbraw/zinc/17/15/83/1396171583.db2.gz	BMGJLDUDBJBZAS-CYBMUJFWSA-N	0	3	345.468	3.416	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)[C@@H](C)OC1CCCCCC1	ZINC001503468340	1396255606	/nfs/dbraw/zinc/25/56/06/1396255606.db2.gz	OCLYHJSYRWBUDJ-LSDHHAIUSA-N	0	3	330.900	3.351	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)N(C)C(=O)c1ccc(CF)cc1	ZINC001496251760	1396627304	/nfs/dbraw/zinc/62/73/04/1396627304.db2.gz	VXNQLUOZGQFUBI-ZDUSSCGKSA-N	0	3	345.443	3.340	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)NC(=O)C(C1CCC1)C1CCC1	ZINC001497889349	1396873826	/nfs/dbraw/zinc/87/38/26/1396873826.db2.gz	FFQPEBHDPGVEOB-CYBMUJFWSA-N	0	3	345.512	3.430	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1cnn2ccccc12	ZINC001689908285	1404200326	/nfs/dbraw/zinc/20/03/26/1404200326.db2.gz	BCYKXLNNJMAYSB-GDBMZVCRSA-N	0	3	346.862	3.060	20	30		EGEDHN
CC[C@@H](c1ccc(F)cc1)N1CCC(N(C)C(=O)[C@H](C)C#N)CC1	ZINC001690018881	1404259302	/nfs/dbraw/zinc/25/93/02/1404259302.db2.gz	VFKBJZMSQWEMCB-KDOFPFPSSA-N	0	3	331.435	3.359	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)Cc1c[nH]c2cc(C)ccc12	ZINC001690868699	1404786451	/nfs/dbraw/zinc/78/64/51/1404786451.db2.gz	MCTBNLFRUZMBNY-CQSZACIVSA-N	0	3	333.863	3.256	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)CCn1ccc2ccccc21	ZINC001690877989	1404791634	/nfs/dbraw/zinc/79/16/34/1404791634.db2.gz	ONAGIOJVZYZTJA-HNNXBMFYSA-N	0	3	333.863	3.268	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)CCOc2ccccc2C)C1	ZINC001691184613	1405122904	/nfs/dbraw/zinc/12/29/04/1405122904.db2.gz	SNLMCFMIDLJRMN-WKILWMFISA-N	0	3	336.863	3.001	20	30		EGEDHN
CCCN(CCNC(=O)[C@@H]1CC12CCC2)Cc1ccc(F)c(C#N)c1	ZINC001691193654	1405132286	/nfs/dbraw/zinc/13/22/86/1405132286.db2.gz	ASOFYHCVHLZPMP-KRWDZBQOSA-N	0	3	343.446	3.216	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)Cc2c[nH]c3c2cccc3C)C1	ZINC001691745206	1405465637	/nfs/dbraw/zinc/46/56/37/1405465637.db2.gz	CIBFCHIBZCVLSY-FZNQNYSPSA-N	0	3	345.874	3.256	20	30		EGEDHN
N#Cc1ccc(F)c(CNC2(CNC(=O)CCC3CC3)CCCC2)c1	ZINC001732389829	1428559823	/nfs/dbraw/zinc/55/98/23/1428559823.db2.gz	WPBBQJQJFLZUBM-UHFFFAOYSA-N	0	3	343.446	3.406	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](C)CN(C)Cc2ccc(C#N)cc2)oc1C	ZINC001699446567	1412780408	/nfs/dbraw/zinc/78/04/08/1412780408.db2.gz	WTPVKWAVKOYGHF-CQSZACIVSA-N	0	3	325.412	3.018	20	30		EGEDHN
CCC1(C(=O)N[C@@H](C)CN(C)Cc2ccc(C#N)cc2)CCCC1	ZINC001699471603	1412851587	/nfs/dbraw/zinc/85/15/87/1412851587.db2.gz	JXGHMIHMXZAICY-INIZCTEOSA-N	0	3	327.472	3.465	20	30		EGEDHN
C=C(Cl)CN(CC1CC1)C1CCN(C(=O)c2conc2C)CC1	ZINC001699690101	1413093713	/nfs/dbraw/zinc/09/37/13/1413093713.db2.gz	ZYCXZFWAWYRCGK-UHFFFAOYSA-N	0	3	337.851	3.052	20	30		EGEDHN
CCC(C)(C)C(=O)N[C@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC001700181066	1413594931	/nfs/dbraw/zinc/59/49/31/1413594931.db2.gz	NJVQXXLKGPPOTA-SFHVURJKSA-N	0	3	327.472	3.465	20	30		EGEDHN
C[C@@H](CNC(=O)c1cccc2cc[nH]c21)N(C)Cc1cccc(C#N)c1	ZINC001700478754	1414110096	/nfs/dbraw/zinc/11/00/96/1414110096.db2.gz	TYKPBDNZJVQZER-HNNXBMFYSA-N	0	3	346.434	3.290	20	30		EGEDHN
CN(C(=O)C(C)(C)C)[C@@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001700730658	1414393649	/nfs/dbraw/zinc/39/36/49/1414393649.db2.gz	ALFLKTSQDXLXPR-KRWDZBQOSA-N	0	3	331.435	3.070	20	30		EGEDHN
Cc1cc(C)c(C(=O)N(C)C[C@@H](C)NCc2ccc(F)c(C#N)c2)o1	ZINC001700747812	1414417146	/nfs/dbraw/zinc/41/71/46/1414417146.db2.gz	MJKJOUONZRXVKS-CYBMUJFWSA-N	0	3	343.402	3.158	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)CCc1cncs1	ZINC001707446289	1417350411	/nfs/dbraw/zinc/35/04/11/1417350411.db2.gz	VGEDYYPQLZSBEU-UKRRQHHQSA-N	0	3	341.908	3.187	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1cncc(CC)c1	ZINC001707447749	1417351091	/nfs/dbraw/zinc/35/10/91/1417351091.db2.gz	YEJSFVZZAHZAGN-RHSMWYFYSA-N	0	3	335.879	3.369	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H]1C(=O)NCC1(NCc2ccc(C#N)s2)CCC1	ZINC001733723127	1429946482	/nfs/dbraw/zinc/94/64/82/1429946482.db2.gz	BTUMPJISRSZZBL-RHSMWYFYSA-N	0	3	345.512	3.430	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)c1csc(C)c1C	ZINC001713408567	1418031629	/nfs/dbraw/zinc/03/16/29/1418031629.db2.gz	SZNCMUZUKKCGSG-SNVBAGLBSA-N	0	3	345.306	3.372	20	30		EGEDHN
Cc1coc(C(=O)NCC[C@@H]2CCN(Cc3ccc(C#N)s3)C2)c1	ZINC001713733561	1418524419	/nfs/dbraw/zinc/52/44/19/1418524419.db2.gz	FOPPMSMDFDKMJD-CQSZACIVSA-N	0	3	343.452	3.163	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@H]1CCCN(CCCCC2CCOCC2)C1	ZINC001713789237	1418605808	/nfs/dbraw/zinc/60/58/08/1418605808.db2.gz	CUWNWESKDLLAPN-IBGZPJMESA-N	0	3	348.531	3.213	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)NC[C@@H](NCc2ccc(C#N)s2)C2CC2)CC1	ZINC001713882246	1418679034	/nfs/dbraw/zinc/67/90/34/1418679034.db2.gz	UXNDBNJHJJITLO-DDUZABMNSA-N	0	3	345.512	3.430	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)CCc2c[nH]c3ccccc23)C1	ZINC001713965652	1418745156	/nfs/dbraw/zinc/74/51/56/1418745156.db2.gz	PWJWZPMORJXGMA-SHTZXODSSA-N	0	3	331.847	3.090	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)COc2ccc(C)cc2)CCCC1	ZINC001714151775	1418958477	/nfs/dbraw/zinc/95/84/77/1418958477.db2.gz	UFWDLKQSAXGQGU-UHFFFAOYSA-N	0	3	336.863	3.145	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1cc2ccccc2n1C)C1CC1	ZINC001714169251	1418977730	/nfs/dbraw/zinc/97/77/30/1418977730.db2.gz	IPFWVTBVEFLNDK-LJQANCHMSA-N	0	3	345.874	3.419	20	30		EGEDHN
CCc1ccccc1CC(=O)NC[C@H](C)NCc1ccc(C#N)s1	ZINC001714246946	1419033625	/nfs/dbraw/zinc/03/36/25/1419033625.db2.gz	NAQJSUDONXUXSA-AWEZNQCLSA-N	0	3	341.480	3.019	20	30		EGEDHN
Cc1ccc(C(=O)NCC[C@H](C)NCc2ccccc2C#N)s1	ZINC001714456443	1419188888	/nfs/dbraw/zinc/18/88/88/1419188888.db2.gz	VDHUZUDBHZPTHN-ZDUSSCGKSA-N	0	3	327.453	3.226	20	30		EGEDHN
C=C(Br)CN[C@@H](C)CCNC(=O)c1sccc1CC	ZINC001714500671	1419226649	/nfs/dbraw/zinc/22/66/49/1419226649.db2.gz	QBNJXBHTVQKNBW-NSHDSACASA-N	0	3	345.306	3.317	20	30		EGEDHN
CCN(CCNC(=O)[C@@H](C)c1cccs1)Cc1cccc(C#N)c1	ZINC001714592765	1419341591	/nfs/dbraw/zinc/34/15/91/1419341591.db2.gz	OZAQPOVELHOBRQ-HNNXBMFYSA-N	0	3	341.480	3.362	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)N(C)C(=O)[C@@H](C)c1ccccc1	ZINC001714823589	1419533514	/nfs/dbraw/zinc/53/35/14/1419533514.db2.gz	VMNXNOIODAWKQM-GJZGRUSLSA-N	0	3	341.480	3.360	20	30		EGEDHN
CC[C@@H](CNC(=O)c1ccccc1F)NCc1ccc(C#N)s1	ZINC001715050293	1419792006	/nfs/dbraw/zinc/79/20/06/1419792006.db2.gz	LFHBAPKAHFBUIN-LBPRGKRZSA-N	0	3	331.416	3.057	20	30		EGEDHN
CC[C@H](CNC(=O)c1ccc(F)cc1)NCc1ccc(C#N)s1	ZINC001715050971	1419792608	/nfs/dbraw/zinc/79/26/08/1419792608.db2.gz	MFSGATGBBZSVSU-CQSZACIVSA-N	0	3	331.416	3.057	20	30		EGEDHN
C[C@H](c1ccc(F)c(F)c1)N1CCC(CCNC(=O)[C@@H](C)C#N)CC1	ZINC001715200116	1419931854	/nfs/dbraw/zinc/93/18/54/1419931854.db2.gz	IQNPVMUZTRCSML-UONOGXRCSA-N	0	3	349.425	3.404	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cc(-c2ccccc2)on1)C(C)C	ZINC001715496438	1420177921	/nfs/dbraw/zinc/17/79/21/1420177921.db2.gz	MQSGHLUJEPQCAP-INIZCTEOSA-N	0	3	347.846	3.438	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)CCc1c(C)noc1Cl)C(C)C	ZINC001715511895	1420195836	/nfs/dbraw/zinc/19/58/36/1420195836.db2.gz	QPILAZDCZSMRJV-ZDUSSCGKSA-N	0	3	348.274	3.052	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cn(CC)nc1C(C)C)C(C)C	ZINC001715658452	1420281912	/nfs/dbraw/zinc/28/19/12/1420281912.db2.gz	FWFSUSRULLOFCP-HNNXBMFYSA-N	0	3	340.899	3.123	20	30		EGEDHN
CC(C)(C)CC(=O)N[C@H]1CCC[C@H]1CNCc1ccccc1C#N	ZINC001716056934	1420520167	/nfs/dbraw/zinc/52/01/67/1420520167.db2.gz	YMSSZVONULMNIU-ROUUACIJSA-N	0	3	327.472	3.369	20	30		EGEDHN
CC(C)(C)CC(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001716792493	1420925677	/nfs/dbraw/zinc/92/56/77/1420925677.db2.gz	TUUNJVMJQUDBCK-UHFFFAOYSA-N	0	3	327.472	3.465	20	30		EGEDHN
CC1(C(=O)NCC2(C)CCN(Cc3cccc(C#N)c3)CC2)CC1	ZINC001716885088	1421008666	/nfs/dbraw/zinc/00/86/66/1421008666.db2.gz	DHUSVSMOXMYUET-UHFFFAOYSA-N	0	3	325.456	3.077	20	30		EGEDHN
C[C@H](C#N)C(=O)N(C)CC(C)(C)CN[C@H](C)c1c(F)cccc1F	ZINC001717450982	1421381034	/nfs/dbraw/zinc/38/10/34/1421381034.db2.gz	FTXOGRZIKDNZPH-CHWSQXEVSA-N	0	3	337.414	3.260	20	30		EGEDHN
CC[C@@H](SC)C(=O)N(C)CC(C)(C)CNCc1ccccc1C#N	ZINC001717452314	1421382279	/nfs/dbraw/zinc/38/22/79/1421382279.db2.gz	ZDUIGDGNGBNFRO-QGZVFWFLSA-N	0	3	347.528	3.274	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1ccc(Cl)cn1	ZINC001717460157	1421389571	/nfs/dbraw/zinc/38/95/71/1421389571.db2.gz	BZNLLRQVQCLFKA-UHFFFAOYSA-N	0	3	330.259	3.175	20	30		EGEDHN
Cc1ccc(C(=O)N(C)C[C@@H](C)NCc2ccc(C#N)s2)cc1	ZINC001717751294	1421613821	/nfs/dbraw/zinc/61/38/21/1421613821.db2.gz	RSJJQOQWSGXJCI-CQSZACIVSA-N	0	3	327.453	3.179	20	30		EGEDHN
Cc1cccc(CNCc2ccc(CNC(=O)[C@@H](C)C#N)c(F)c2)c1	ZINC001718034870	1421786679	/nfs/dbraw/zinc/78/66/79/1421786679.db2.gz	QAIGPICHLWZOAX-HNNXBMFYSA-N	0	3	339.414	3.200	20	30		EGEDHN
C=C(Cl)Cn1c([C@@H](C)CC)nnc1N1CCN(CC2CC2)CC1	ZINC001722543760	1424212626	/nfs/dbraw/zinc/21/26/26/1424212626.db2.gz	SXUJLZKXEMQSLC-ZDUSSCGKSA-N	0	3	337.899	3.076	20	30		EGEDHN
N#Cc1ccccc1CNC1C[C@H]2CCC[C@@H](C1)N2C(=O)CCCF	ZINC001723615800	1424494344	/nfs/dbraw/zinc/49/43/44/1424494344.db2.gz	YOPBPAMCKWENCA-YQQQUEKLSA-N	0	3	343.446	3.310	20	30		EGEDHN
C#CCN(C(=O)[C@H]1C[C@@H]1C)C1CCN(Cc2ccc(CF)cc2)CC1	ZINC001724029628	1424636644	/nfs/dbraw/zinc/63/66/44/1424636644.db2.gz	QJXSDZFULKGHBL-JXFKEZNVSA-N	0	3	342.458	3.238	20	30		EGEDHN
CCC[C@@H](CC)C(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@H]2C1	ZINC001724626040	1424978383	/nfs/dbraw/zinc/97/83/83/1424978383.db2.gz	OVRYBMABTJDYNH-AQNXPRMDSA-N	0	3	339.483	3.275	20	30		EGEDHN
CCC1(C(=O)N[C@@H]2CCN(Cc3cccc(C#N)c3)[C@@H](C)C2)CC1	ZINC001724996806	1425402561	/nfs/dbraw/zinc/40/25/61/1425402561.db2.gz	MPRMNDQOUHPUDO-MAUKXSAKSA-N	0	3	325.456	3.218	20	30		EGEDHN
C[C@@H](CNC(=O)c1cccc(Cl)c1)N(C)Cc1ccc(C#N)cc1	ZINC001725191768	1425737872	/nfs/dbraw/zinc/73/78/72/1425737872.db2.gz	YSOKGTDVXJRLBG-AWEZNQCLSA-N	0	3	341.842	3.462	20	30		EGEDHN
C=C(Cl)CNC[C@@H](NC(=O)c1c(C)cc(C)nc1C)C(C)(C)C	ZINC001725744596	1426421936	/nfs/dbraw/zinc/42/19/36/1426421936.db2.gz	LGEOWDGBBLMQHL-OAHLLOKOSA-N	0	3	337.895	3.493	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)CCc1ccsc1	ZINC001731728617	1427803215	/nfs/dbraw/zinc/80/32/15/1427803215.db2.gz	GIEBNBXEZZCLDP-GFCCVEGCSA-N	0	3	345.306	3.074	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)Cc1cccc2cccnc21	ZINC001731734909	1427814432	/nfs/dbraw/zinc/81/44/32/1427814432.db2.gz	XMOTXXHSNYPHJT-CQSZACIVSA-N	0	3	331.847	3.014	20	30		EGEDHN
CCN(CCNC(=O)C1C(C)(C)C1(C)C)Cc1cccc(C#N)c1	ZINC001731801733	1427965687	/nfs/dbraw/zinc/96/56/87/1427965687.db2.gz	ZVIRIBXKTQSCFJ-UHFFFAOYSA-N	0	3	327.472	3.179	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)c2coc(CC)n2)CC1	ZINC001733917590	1437731190	/nfs/dbraw/zinc/73/11/90/1437731190.db2.gz	BUDRFCHUOARCLO-UHFFFAOYSA-N	0	3	339.867	3.164	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1cc(F)cc(F)c1	ZINC001734023813	1437812186	/nfs/dbraw/zinc/81/21/86/1437812186.db2.gz	QDCSEQORAYARQW-UHFFFAOYSA-N	0	3	330.806	3.405	20	30		EGEDHN
CN(C(=O)c1cccs1)[C@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001734293201	1438024089	/nfs/dbraw/zinc/02/40/89/1438024089.db2.gz	VXUMUBJFXWKTET-OAHLLOKOSA-N	0	3	345.493	3.322	20	30		EGEDHN
C=C(Br)CNC[C@@H](NC(=O)C1(C)CCC1)C(C)(C)C	ZINC001734569811	1438164329	/nfs/dbraw/zinc/16/43/29/1438164329.db2.gz	OFAQPTAPTLLNKZ-GFCCVEGCSA-N	0	3	331.298	3.206	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCCN(C)Cc2cccc(C(C)C)n2)cc1	ZINC001752033703	1440134351	/nfs/dbraw/zinc/13/43/51/1440134351.db2.gz	UTHNMCCSYWEJDC-UHFFFAOYSA-N	0	3	349.478	3.438	20	30		EGEDHN
CN(CCCNC(=O)[C@@H]1CCCC1(C)C)Cc1ccc(C#N)c(F)c1	ZINC001752042956	1440134917	/nfs/dbraw/zinc/13/49/17/1440134917.db2.gz	SALQNWJWJIBLGW-KRWDZBQOSA-N	0	3	345.462	3.462	20	30		EGEDHN
CCN(CC#Cc1ccccc1)CCCNC(=O)[C@@H]1CCC1(C)C	ZINC001752205604	1440154018	/nfs/dbraw/zinc/15/40/18/1440154018.db2.gz	LAUYQNCOOKXVPC-IBGZPJMESA-N	0	3	326.484	3.303	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CCN(CCCOc2ccccc2C)C1	ZINC001752395670	1440173601	/nfs/dbraw/zinc/17/36/01/1440173601.db2.gz	PGXABUCRUJMLMX-QGZVFWFLSA-N	0	3	330.472	3.167	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CC12CCN(Cc1cccnc1C)CC2	ZINC001752427266	1440177539	/nfs/dbraw/zinc/17/75/39/1440177539.db2.gz	OGCJEDUGAQHHBJ-GOSISDBHSA-N	0	3	341.499	3.463	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)CC(C2CCC2)C2CCC2)CC1	ZINC001752434590	1440179930	/nfs/dbraw/zinc/17/99/30/1440179930.db2.gz	HJUVCQDBWXHPGP-IBGZPJMESA-N	0	3	328.500	3.197	20	30		EGEDHN
CC1(CCC(=O)NC[C@@H](NCC#Cc2ccc(F)cc2)C2CC2)CC1	ZINC001752492062	1440187017	/nfs/dbraw/zinc/18/70/17/1440187017.db2.gz	XWCPJTXMXVWRTI-LJQANCHMSA-N	0	3	342.458	3.242	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)c1cccc(COC)c1	ZINC001752539013	1440194434	/nfs/dbraw/zinc/19/44/34/1440194434.db2.gz	WHAFBGYYTNVFHK-AHRSYUTCSA-N	0	3	342.483	3.477	20	30		EGEDHN
C=CCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@H](C)n1nc(C)cc1C	ZINC001752545684	1440195083	/nfs/dbraw/zinc/19/50/83/1440195083.db2.gz	ZEBSSDGNJLEIMN-GBESFXJTSA-N	0	3	344.503	3.092	20	30		EGEDHN
C=CCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1[C@@H]2Cc3ccccc3[C@@H]21	ZINC001752564714	1440195475	/nfs/dbraw/zinc/19/54/75/1440195475.db2.gz	JMIXRKNYUWSNNN-LXDWIVHCSA-N	0	3	336.479	3.214	20	30		EGEDHN
C=CCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)CO[C@@H]1CCCC[C@H]1C	ZINC001752565195	1440195494	/nfs/dbraw/zinc/19/54/94/1440195494.db2.gz	LLBMYALRPQEZTD-AKHDSKFASA-N	0	3	334.504	3.223	20	30		EGEDHN
O=C(CC1CCC1)N[C@H]1C[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001752621869	1440196834	/nfs/dbraw/zinc/19/68/34/1440196834.db2.gz	YYQNDYMLABFUAV-IYARVYRRSA-N	0	3	330.859	3.119	20	30		EGEDHN
C=C[C@H](CC(=O)N[C@H]1C[C@@H](NCc2conc2C)C1)c1ccccc1	ZINC001752774374	1440206554	/nfs/dbraw/zinc/20/65/54/1440206554.db2.gz	VKZNJJXSFUWGLC-LZQZEXGQSA-N	0	3	339.439	3.080	20	30		EGEDHN
CCC1(C(=O)NC[C@H]2CCCN(Cc3cccc(C#N)c3)C2)CC1	ZINC001752786453	1440211493	/nfs/dbraw/zinc/21/14/93/1440211493.db2.gz	SFZGVUGPMZPAPJ-GOSISDBHSA-N	0	3	325.456	3.077	20	30		EGEDHN
C#CCN1CCC[C@@H](CNC(=O)[C@@H](CC)Cc2cccc(C)c2)C1	ZINC001752787077	1440211982	/nfs/dbraw/zinc/21/19/82/1440211982.db2.gz	FZDNEMZELDXUAJ-PMACEKPBSA-N	0	3	326.484	3.025	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@@H]1CCCCN1Cc1ccc2cc[nH]c2c1	ZINC001752819390	1440219487	/nfs/dbraw/zinc/21/94/87/1440219487.db2.gz	VBBNZWUBFXLKBL-IBGZPJMESA-N	0	3	337.467	3.298	20	30		EGEDHN
C=CCOCCN1CCCC[C@@H]1CNC(=O)[C@@H](C)c1cccc(C)c1	ZINC001752822720	1440221408	/nfs/dbraw/zinc/22/14/08/1440221408.db2.gz	MTYYNZTYBARKBL-AZUAARDMSA-N	0	3	344.499	3.272	20	30		EGEDHN
CC1(C(=O)N2CCCC[C@@H]2CNCC#Cc2cccc(Cl)c2)CC1	ZINC001752827361	1440224167	/nfs/dbraw/zinc/22/41/67/1440224167.db2.gz	AGRQYJDIFVJMIW-GOSISDBHSA-N	0	3	344.886	3.462	20	30		EGEDHN
CC(C)c1[nH]ccc1C(=O)NC[C@H](C)NCc1ccc(F)c(C#N)c1	ZINC001752894152	1440241476	/nfs/dbraw/zinc/24/14/76/1440241476.db2.gz	HQHNVCGVMCWHIZ-ZDUSSCGKSA-N	0	3	342.418	3.057	20	30		EGEDHN
CCCCC1(C(=O)NC[C@H](C)NCc2ccc(C#N)c(F)c2)CC1	ZINC001752899530	1440242631	/nfs/dbraw/zinc/24/26/31/1440242631.db2.gz	RCJFSOAWCMIMGS-AWEZNQCLSA-N	0	3	331.435	3.262	20	30		EGEDHN
CC1=CC[C@](C)(C(=O)NC[C@@H](C)NCc2ccc(C#N)c(F)c2)CC1	ZINC001752920782	1440248386	/nfs/dbraw/zinc/24/83/86/1440248386.db2.gz	GMVTWKDFJMWSSV-QRWLVFNGSA-N	0	3	343.446	3.428	20	30		EGEDHN
C[C@H](CNC(=O)c1ccc(CF)cc1)NCc1ccc(C#N)c(F)c1	ZINC001752922231	1440249117	/nfs/dbraw/zinc/24/91/17/1440249117.db2.gz	IAKFVYCINNTGAQ-CYBMUJFWSA-N	0	3	343.377	3.075	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CCC[C@@H](NCc3ccn(CC)n3)C2)CCC1	ZINC001752976862	1440256181	/nfs/dbraw/zinc/25/61/81/1440256181.db2.gz	SEZJWFFRMXVGBP-IAGOWNOFSA-N	0	3	344.503	3.166	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)[C@H](C)CCCc2ccccc2)C1	ZINC001753000973	1440264656	/nfs/dbraw/zinc/26/46/56/1440264656.db2.gz	WXEZOWJEGMYNHL-UYAOXDASSA-N	0	3	326.484	3.201	20	30		EGEDHN
C/C(=C\C(=O)NCC[C@@H](C)NCc1cc(C#N)ccc1F)C1CC1	ZINC001753002537	1440265048	/nfs/dbraw/zinc/26/50/48/1440265048.db2.gz	HXEVSQRQTDGJPV-KADHNRKRSA-N	0	3	329.419	3.038	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)Cc1nsc2ccccc12	ZINC001753020098	1440269623	/nfs/dbraw/zinc/26/96/23/1440269623.db2.gz	BVECTFJTAIIYMM-GFCCVEGCSA-N	0	3	337.876	3.076	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1CCCNC(=O)[C@H]1[C@H]2[C@@H]1[C@@H]1CC[C@H]2C1	ZINC001753039393	1440275689	/nfs/dbraw/zinc/27/56/89/1440275689.db2.gz	AZPGNQDAJDVPQL-UCIFAOBLSA-N	0	3	336.907	3.392	20	30		EGEDHN
CCN(CCNC(=O)[C@H](C)c1ccc(C)o1)Cc1cccc(C#N)c1	ZINC001753091506	1440299252	/nfs/dbraw/zinc/29/92/52/1440299252.db2.gz	XQNBRNRNLDWKSB-MRXNPFEDSA-N	0	3	339.439	3.202	20	30		EGEDHN
C=CCOCC(=O)NC[C@@H]1CCCN1Cc1cc2ccccc2s1	ZINC001753097588	1440303233	/nfs/dbraw/zinc/30/32/33/1440303233.db2.gz	QFEIPBTUSZLZOA-INIZCTEOSA-N	0	3	344.480	3.185	20	30		EGEDHN
CCCN(CCNC(=O)C[C@@H]1C=CCC1)Cc1ccc(F)c(C#N)c1	ZINC001753141840	1440321735	/nfs/dbraw/zinc/32/17/35/1440321735.db2.gz	GTGPXFMFKWGFIM-MRXNPFEDSA-N	0	3	343.446	3.382	20	30		EGEDHN
CN(CCNCc1cccc(Oc2ccccc2)c1)C(=O)C#CC1CC1	ZINC001753187828	1440337434	/nfs/dbraw/zinc/33/74/34/1440337434.db2.gz	WUXKFPVZZPABRT-UHFFFAOYSA-N	0	3	348.446	3.440	20	30		EGEDHN
CC[C@H]1CCCC[C@H]1C(=O)N(C)CCNCc1ccc(C#N)cc1	ZINC001753248669	1440342878	/nfs/dbraw/zinc/34/28/78/1440342878.db2.gz	VLZOLNTWLHLCRR-RBUKOAKNSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC([C@H](C)NCc2cnc(C)o2)CC1	ZINC001753278865	1440346810	/nfs/dbraw/zinc/34/68/10/1440346810.db2.gz	VUPSKXPRKSJPLT-GOEBONIOSA-N	0	3	333.476	3.302	20	30		EGEDHN
C=C(C)CN[C@H](CNC(=O)c1cn[nH]c1)c1ccc(C(C)C)cc1	ZINC001753294396	1440351662	/nfs/dbraw/zinc/35/16/62/1440351662.db2.gz	MDWBQONNBAMWHB-GOSISDBHSA-N	0	3	326.444	3.170	20	30		EGEDHN
C=C(C)CN[C@@H](CNC(=O)c1cncnc1)c1ccc(C(C)C)cc1	ZINC001753294664	1440351763	/nfs/dbraw/zinc/35/17/63/1440351763.db2.gz	SDASSRCFRQEEEJ-IBGZPJMESA-N	0	3	338.455	3.237	20	30		EGEDHN
C=CCN[C@@H](CNC(=O)[C@@H](C)Oc1ccccc1F)c1ccccc1	ZINC001753298913	1440353237	/nfs/dbraw/zinc/35/32/37/1440353237.db2.gz	OZOWRAIDCVYHGD-QAPCUYQASA-N	0	3	342.414	3.226	20	30		EGEDHN
C#CCCN[C@H](CNC(=O)Cc1cc2ccccc2o1)c1ccccc1	ZINC001753300724	1440353938	/nfs/dbraw/zinc/35/39/38/1440353938.db2.gz	YZSLEDMGIQNLDT-HXUWFJFHSA-N	0	3	346.430	3.446	20	30		EGEDHN
C=CCN[C@H](CNC(=O)c1c(C)nn(CC)c1Cl)c1ccccc1	ZINC001753302384	1440354347	/nfs/dbraw/zinc/35/43/47/1440354347.db2.gz	AIXUJJPSOILDOC-OAHLLOKOSA-N	0	3	346.862	3.112	20	30		EGEDHN
C=C(C)CN[C@H](CNC(=O)COc1ccccc1C)c1ccccc1	ZINC001753303498	1440355057	/nfs/dbraw/zinc/35/50/57/1440355057.db2.gz	ZVVAEYLUXWQTPH-LJQANCHMSA-N	0	3	338.451	3.397	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CCC)C(=O)[C@H](CC(C)C)n2ccnc2)C1	ZINC001753317756	1440360704	/nfs/dbraw/zinc/36/07/04/1440360704.db2.gz	VLWFJCPLZHVIHO-MOPGFXCFSA-N	0	3	346.519	3.359	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CCC)C(=O)c2ccc3ncsc3c2)C1	ZINC001753324187	1440365498	/nfs/dbraw/zinc/36/54/98/1440365498.db2.gz	ZENDJARJCFUBJA-MRXNPFEDSA-N	0	3	341.480	3.246	20	30		EGEDHN
C=CCOCCN1CC[C@H](N(CCC)C(=O)[C@H]2CCC(C)(C)C2)C1	ZINC001753329200	1440368220	/nfs/dbraw/zinc/36/82/20/1440368220.db2.gz	WOXBSIQMYFUHRB-ROUUACIJSA-N	0	3	336.520	3.328	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CCC)C(=O)[C@@H](C)Cc2ccccc2F)C1	ZINC001753329223	1440368355	/nfs/dbraw/zinc/36/83/55/1440368355.db2.gz	XHRKGNDEHLZYIB-PKOBYXMFSA-N	0	3	344.474	3.341	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H]2C[C@H]1CN2C(=O)c1cccc(OCC)c1	ZINC001753425443	1440396608	/nfs/dbraw/zinc/39/66/08/1440396608.db2.gz	WFYDYOJSHXYELU-NJAFHUGGSA-N	0	3	328.456	3.339	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H]2C[C@H]1CN2C(=O)c1cnn(C(C)C)c1C	ZINC001753426309	1440396815	/nfs/dbraw/zinc/39/68/15/1440396815.db2.gz	VBUJEYZPQABBST-PVAVHDDUSA-N	0	3	330.476	3.026	20	30		EGEDHN
C=CCCCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H](C)c1ccc(F)c(F)c1	ZINC001753428107	1440397623	/nfs/dbraw/zinc/39/76/23/1440397623.db2.gz	WPVWYRXCRLGULD-BPUTZDHNSA-N	0	3	334.410	3.320	20	30		EGEDHN
C=CCOCCCC(=O)N(C)[C@H]1CCN(Cc2ccc(C)c(C)c2)C1	ZINC001753432894	1440398993	/nfs/dbraw/zinc/39/89/93/1440398993.db2.gz	XYCNKTVZSZERGE-FQEVSTJZSA-N	0	3	344.499	3.319	20	30		EGEDHN
C=CC(C)(C)C(=O)N(C)[C@H]1CCN(Cc2ccc3c(c2)CCC3)C1	ZINC001753442906	1440402497	/nfs/dbraw/zinc/40/24/97/1440402497.db2.gz	MGOJBFZHECBHJZ-IBGZPJMESA-N	0	3	326.484	3.420	20	30		EGEDHN
C#CCCN1CC[C@@H](N(C)C(=O)C[C@@H](C)c2ccc(CC)cc2)C1	ZINC001753444453	1440403103	/nfs/dbraw/zinc/40/31/03/1440403103.db2.gz	RCVLXKSCJSZUQV-YLJYHZDGSA-N	0	3	326.484	3.299	20	30		EGEDHN
C=CCOCCN1CC[C@@H](N(C)C(=O)c2cccc(C3CCC3)c2)C1	ZINC001753447523	1440404579	/nfs/dbraw/zinc/40/45/79/1440404579.db2.gz	BHSBNFUWTJRMNG-HXUWFJFHSA-N	0	3	342.483	3.303	20	30		EGEDHN
CCN(C(=O)C#CC(C)C)[C@@H]1CCN(CCCOc2ccccc2)C1	ZINC001753454697	1440407777	/nfs/dbraw/zinc/40/77/77/1440407777.db2.gz	BBVYBGRULFVFND-LJQANCHMSA-N	0	3	342.483	3.038	20	30		EGEDHN
CC[C@@H](CNC(=O)Cc1ccoc1)NCC#Cc1ccc(Cl)cc1	ZINC001753474049	1440414692	/nfs/dbraw/zinc/41/46/92/1440414692.db2.gz	XKOSRZOPNGUBRH-SFHVURJKSA-N	0	3	344.842	3.012	20	30		EGEDHN
CC[C@H](CNC(=O)[C@@H]1C[C@H]1CC(C)C)NCc1ccc(C#N)c(F)c1	ZINC001753485883	1440417723	/nfs/dbraw/zinc/41/77/23/1440417723.db2.gz	DMWSVHWSCGHOIR-KZNAEPCWSA-N	0	3	345.462	3.364	20	30		EGEDHN
CC(C)C(=O)NC1(CNCC#Cc2cccc(Cl)c2)CCCC1	ZINC001753499958	1440423063	/nfs/dbraw/zinc/42/30/63/1440423063.db2.gz	NXRBBFCAFQLIAF-UHFFFAOYSA-N	0	3	332.875	3.366	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCCN(C(=O)c2coc(C3CC3)n2)C1	ZINC001753557510	1440436233	/nfs/dbraw/zinc/43/62/33/1440436233.db2.gz	MZXZTILGWJQMKW-CYBMUJFWSA-N	0	3	337.851	3.136	20	30		EGEDHN
CC#CCNCc1ccc(CNC(=O)c2nc(Cl)sc2C)cc1	ZINC001753589666	1440442481	/nfs/dbraw/zinc/44/24/81/1440442481.db2.gz	JECADXPSOBNGTK-UHFFFAOYSA-N	0	3	347.871	3.148	20	30		EGEDHN
CC#CCNCc1ccc(CNC(=O)c2cnc(C3CC3)s2)cc1	ZINC001753592102	1440443194	/nfs/dbraw/zinc/44/31/94/1440443194.db2.gz	ZQFLLCCUCMSKNS-UHFFFAOYSA-N	0	3	339.464	3.063	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)C(C)=C2CCC2)CCCC1	ZINC001753664674	1440459893	/nfs/dbraw/zinc/45/98/93/1440459893.db2.gz	ZIHYGPCJQCQQSU-UHFFFAOYSA-N	0	3	341.293	3.414	20	30		EGEDHN
C#CCCCC(=O)N(C)[C@@H](C)CN[C@H]1CCc2c1c(F)ccc2F	ZINC001753686076	1440465646	/nfs/dbraw/zinc/46/56/46/1440465646.db2.gz	SXFQGZWUILAPAW-GUYCJALGSA-N	0	3	334.410	3.192	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)c(F)c1)N(C)C(=O)[C@H]1[C@@H]2CCCC[C@@H]21	ZINC001753687362	1440465844	/nfs/dbraw/zinc/46/58/44/1440465844.db2.gz	MIZIQWQNCUAMCH-CKNFYHOISA-N	0	3	343.446	3.070	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)N(C)C(=O)[C@@H]1C[C@@H]2CCCC[C@H]12	ZINC001753705283	1440469486	/nfs/dbraw/zinc/46/94/86/1440469486.db2.gz	VJFJQZNDZSWVJS-DFEHZGFQSA-N	0	3	345.512	3.383	20	30		EGEDHN
CC(C)C[C@H](CNCC#Cc1ccc(F)cc1)NC(=O)CC1CC1	ZINC001753731605	1440476117	/nfs/dbraw/zinc/47/61/17/1440476117.db2.gz	WGSTULCVOUXGSS-LJQANCHMSA-N	0	3	330.447	3.098	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H]([C@H](C)NCc2nc(C)sc2C)C1	ZINC001753793257	1440489248	/nfs/dbraw/zinc/48/92/48/1440489248.db2.gz	WDKDNYQZIKOHRE-XJKSGUPXSA-N	0	3	335.517	3.443	20	30		EGEDHN
CCC(=O)N1CCC[C@@H](C)[C@H]1CNCC#Cc1cccc(Cl)c1	ZINC001753800730	1440490773	/nfs/dbraw/zinc/49/07/73/1440490773.db2.gz	DDOZQWFFWOHYAX-CRAIPNDOSA-N	0	3	332.875	3.318	20	30		EGEDHN
C=CC(C)(C)C(=O)N(C)CCN(C)CCOc1cc(C)ccc1C	ZINC001753859626	1440510760	/nfs/dbraw/zinc/51/07/60/1440510760.db2.gz	VHHXJNFQUXCBSF-UHFFFAOYSA-N	0	3	332.488	3.285	20	30		EGEDHN
CCCSCC(=O)N[C@H]1CCC[C@H]1CNCc1ccccc1C#N	ZINC001753880623	1440520479	/nfs/dbraw/zinc/52/04/79/1440520479.db2.gz	RIGOKWAZHHNGCJ-ROUUACIJSA-N	0	3	345.512	3.076	20	30		EGEDHN
C[C@@H](NCC[C@H](C)NC(=O)c1cc(C#N)c[nH]1)c1c(F)cccc1F	ZINC001753956364	1440525722	/nfs/dbraw/zinc/52/57/22/1440525722.db2.gz	SJMJSRBFELDREJ-NWDGAFQWSA-N	0	3	346.381	3.024	20	30		EGEDHN
C[C@H](CCNCc1ccccc1C#N)NC(=O)c1cccnc1C1CC1	ZINC001753979100	1440527771	/nfs/dbraw/zinc/52/77/71/1440527771.db2.gz	DAYBFYLPWAKJIL-OAHLLOKOSA-N	0	3	348.450	3.129	20	30		EGEDHN
C[C@H](CNCC#Cc1cccc(Cl)c1)NC(=O)[C@@H](C)C(C)(F)F	ZINC001754242043	1440555949	/nfs/dbraw/zinc/55/59/49/1440555949.db2.gz	GYSZYBQRFUFYID-CHWSQXEVSA-N	0	3	342.817	3.077	20	30		EGEDHN
CN(CCCNCc1cc(C#N)ccc1F)C(=O)/C=C/C(C)(C)C	ZINC001754362761	1440591935	/nfs/dbraw/zinc/59/19/35/1440591935.db2.gz	FQCIQVZHDZTDHE-CMDGGOBGSA-N	0	3	331.435	3.238	20	30		EGEDHN
CN(CCCNCc1cc(C#N)ccc1F)C(=O)C[C@H]1CC=CCC1	ZINC001754389405	1440594056	/nfs/dbraw/zinc/59/40/56/1440594056.db2.gz	GYVIYHOPRWIYON-INIZCTEOSA-N	0	3	343.446	3.382	20	30		EGEDHN
CC1(C)CC[C@H]1C(=O)N[C@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001754448720	1440600437	/nfs/dbraw/zinc/60/04/37/1440600437.db2.gz	DPWAADWOIPBTHY-JKSUJKDBSA-N	0	3	331.485	3.040	20	30		EGEDHN
C=CCCCCCN1CC[C@@H]1CNC(=O)[C@@H]1OCCc2ccccc21	ZINC001754501936	1440614613	/nfs/dbraw/zinc/61/46/13/1440614613.db2.gz	NGQJLWCLXNONFA-UYAOXDASSA-N	0	3	342.483	3.237	20	30		EGEDHN
C=C(C)CCC(=O)NCC1(NCc2ccc(OC)c(Cl)c2)CC1	ZINC001754516719	1440618852	/nfs/dbraw/zinc/61/88/52/1440618852.db2.gz	LZLXTGOPFUQGCC-UHFFFAOYSA-N	0	3	336.863	3.443	20	30		EGEDHN
CC#CCN(CCOC)C1CCN(C(=O)[C@@](C)(CC)CCC)CC1	ZINC001754550993	1440629953	/nfs/dbraw/zinc/62/99/53/1440629953.db2.gz	MJIJLMRPPCSDRC-FQEVSTJZSA-N	0	3	336.520	3.166	20	30		EGEDHN
CCC[C@H](C)C(=O)N1CC[C@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001754563419	1440634486	/nfs/dbraw/zinc/63/44/86/1440634486.db2.gz	JRBOPXHHVXAPOL-UWJYYQICSA-N	0	3	339.483	3.419	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@]2(CCN(CCC(F)(F)F)C2)C1	ZINC001754565800	1440635479	/nfs/dbraw/zinc/63/54/79/1440635479.db2.gz	NFNLQVHNFRLBDU-HOCLYGCPSA-N	0	3	332.410	3.466	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)[C@@H](C)Cc2ccc(OC)cc2)CC1	ZINC001754630039	1440647412	/nfs/dbraw/zinc/64/74/12/1440647412.db2.gz	RUZPOKKILPAASU-INIZCTEOSA-N	0	3	330.472	3.031	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](NC(=O)CC2CC2)C2CCCC2)c(F)c1	ZINC001754643515	1440649480	/nfs/dbraw/zinc/64/94/80/1440649480.db2.gz	AJOKYRYKXYZKCZ-LJQANCHMSA-N	0	3	343.446	3.262	20	30		EGEDHN
C#CCNC[C@H](NC(=O)CCC(F)F)c1ccc2ccccc2c1	ZINC001754644042	1440649673	/nfs/dbraw/zinc/64/96/73/1440649673.db2.gz	MRUYUIHDMVNXTK-KRWDZBQOSA-N	0	3	330.378	3.265	20	30		EGEDHN
CC1CC(C(=O)N[C@H](CNCc2ccc(C#N)s2)C2CCCC2)C1	ZINC001754646027	1440650254	/nfs/dbraw/zinc/65/02/54/1440650254.db2.gz	QBSOKHAJXAGSMC-LEHRNKBSSA-N	0	3	345.512	3.430	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@]1(C)CCN(CCc2scnc2C)C1	ZINC001754677824	1440660668	/nfs/dbraw/zinc/66/06/68/1440660668.db2.gz	ASLAPAGVOWZNAM-MAUKXSAKSA-N	0	3	335.517	3.177	20	30		EGEDHN
Cc1ccc(F)cc1CN1CCC[C@](C)(CNC(=O)C#CC2CC2)C1	ZINC001754726488	1440676495	/nfs/dbraw/zinc/67/64/95/1440676495.db2.gz	BDTBVJJVOCMDSO-OAQYLSRUSA-N	0	3	342.458	3.266	20	30		EGEDHN
C=C(C)CN1CC[C@@](O)(CNC(=O)C[C@H](CC)c2ccc(C)cc2)C1	ZINC001754757325	1440685367	/nfs/dbraw/zinc/68/53/67/1440685367.db2.gz	IVBMRVFVISRYME-GHTZIAJQSA-N	0	3	344.499	3.008	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)[C@@H](C)OCCCC)C2)CC1	ZINC001754782990	1440686929	/nfs/dbraw/zinc/68/69/29/1440686929.db2.gz	IHDJZAMWYJBCSS-QUCCMNQESA-N	0	3	348.531	3.166	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H](NC[C@H](C)O)c2ccccc2CC)CC1	ZINC001754792256	1440688786	/nfs/dbraw/zinc/68/87/86/1440688786.db2.gz	ZLGDWTVEOFUFBC-JXFKEZNVSA-N	0	3	344.499	3.123	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)/C=C(/C)C2CC2)CC1	ZINC001754839412	1440697488	/nfs/dbraw/zinc/69/74/88/1440697488.db2.gz	POUDOTIDJQLHPY-ICFOKQHNSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCN(C(=O)c2sc(C)cc2OC)C1	ZINC001754935179	1440711038	/nfs/dbraw/zinc/71/10/38/1440711038.db2.gz	WXGRGSFINJHDLC-ZDUSSCGKSA-N	0	3	342.892	3.259	20	30		EGEDHN
C=CCN(C)Cc1ccccc1CNC(=O)c1nccc2cccnc21	ZINC001754945978	1440713063	/nfs/dbraw/zinc/71/30/63/1440713063.db2.gz	PLRXADIQGGMIPH-UHFFFAOYSA-N	0	3	346.434	3.178	20	30		EGEDHN
C#CCCN(C)Cc1ccccc1CNC(=O)c1ncccc1CC	ZINC001754946328	1440713160	/nfs/dbraw/zinc/71/31/60/1440713160.db2.gz	FEPGHRZYFHEERU-UHFFFAOYSA-N	0	3	335.451	3.029	20	30		EGEDHN
COCC#CCN[C@@H](C)c1ccc(CNC(=O)C(C)=C2CCC2)cc1	ZINC001754948334	1440714200	/nfs/dbraw/zinc/71/42/00/1440714200.db2.gz	YKSKGNWEHKEWEI-KRWDZBQOSA-N	0	3	340.467	3.104	20	30		EGEDHN
CC#CCN[C@H](C)c1ccc(CNC(=O)CN(C)c2ccccc2)cc1	ZINC001754951025	1440715001	/nfs/dbraw/zinc/71/50/01/1440715001.db2.gz	GNIREUSHLJCLHA-GOSISDBHSA-N	0	3	349.478	3.113	20	30		EGEDHN
C=C(C)CN(C)Cc1ccccc1CNC(=O)c1cc2c([nH]1)CCC2	ZINC001754953239	1440715704	/nfs/dbraw/zinc/71/57/04/1440715704.db2.gz	HTIXUNYSWTUECD-UHFFFAOYSA-N	0	3	337.467	3.441	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)COC(C)(C)C)cccc2C1	ZINC001754974110	1440719415	/nfs/dbraw/zinc/71/94/15/1440719415.db2.gz	KHHDZMNJUUCLGO-UHFFFAOYSA-N	0	3	330.472	3.052	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC1(NCc2ccnc(Cl)c2)CCC1	ZINC001754984589	1440722351	/nfs/dbraw/zinc/72/23/51/1440722351.db2.gz	PDUAIOSPTBBCIA-UHFFFAOYSA-N	0	3	335.879	3.466	20	30		EGEDHN
C[C@H](C(=O)N(C)CCCN(C)Cc1ccc(F)c(C#N)c1)C1CCC1	ZINC001755038623	1440735950	/nfs/dbraw/zinc/73/59/50/1440735950.db2.gz	AVOFNDAFWIHLNU-HNNXBMFYSA-N	0	3	345.462	3.414	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC[C@H]1Cc2ccccc2CN1CC(C)C	ZINC001755074435	1440748008	/nfs/dbraw/zinc/74/80/08/1440748008.db2.gz	ZBHFPUZAQYOVIS-FXAWDEMLSA-N	0	3	344.499	3.167	20	30		EGEDHN
COCC#CCN1CC[C@@]2(C1)CCCN(C(=O)C(C)(C)CC(C)C)C2	ZINC001755079388	1440750227	/nfs/dbraw/zinc/75/02/27/1440750227.db2.gz	IXEDRAHHBWHEME-OAQYLSRUSA-N	0	3	348.531	3.023	20	30		EGEDHN
C[C@@H]1CN(C(=O)/C=C/C(C)(C)C)C[C@@H]1NCc1ccc(C#N)c(F)c1	ZINC001755107302	1440754011	/nfs/dbraw/zinc/75/40/11/1440754011.db2.gz	LXFZXSUKJIDGEH-QBJLPMDFSA-N	0	3	343.446	3.236	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC(CN(CC)Cc2nccnc2C)CC1	ZINC001755183998	1440772251	/nfs/dbraw/zinc/77/22/51/1440772251.db2.gz	WCVCYXIYKOGKHK-UHFFFAOYSA-N	0	3	344.503	3.202	20	30		EGEDHN
C=CCN(C)C[C@@H]1CCCN1C(=O)c1csc(C(F)(F)F)c1	ZINC001755194725	1440776621	/nfs/dbraw/zinc/77/66/21/1440776621.db2.gz	YTQREFMEFBYZED-LBPRGKRZSA-N	0	3	332.391	3.489	20	30		EGEDHN
C=CCN(C)C[C@@H]1CCCN1C(=O)C[C@H](C)c1cccc(OC)c1	ZINC001755202340	1440780613	/nfs/dbraw/zinc/78/06/13/1440780613.db2.gz	DCDAOYZMPCALPK-WMZOPIPTSA-N	0	3	330.472	3.298	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](C)[C@@H](C)NCc1cnn(C(C)(C)C)c1	ZINC001755248008	1440791211	/nfs/dbraw/zinc/79/12/11/1440791211.db2.gz	FSHHGJAHBCKERK-CABCVRRESA-N	0	3	334.508	3.223	20	30		EGEDHN
C=C(Br)CNCC(C)(C)CN(C)C(=O)[C@H](C)CCC	ZINC001755279035	1440800035	/nfs/dbraw/zinc/80/00/35/1440800035.db2.gz	AXIJIGGTWQVOIP-GFCCVEGCSA-N	0	3	333.314	3.405	20	30		EGEDHN
CC#CCCCC(=O)N(C)CC(C)(C)CNCc1ncc(C)s1	ZINC001755283982	1440801453	/nfs/dbraw/zinc/80/14/53/1440801453.db2.gz	CLSOUYLPMJIBBK-UHFFFAOYSA-N	0	3	335.517	3.219	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@H](C)N(C)[C@@H]1CCc2c1cc(F)cc2F	ZINC001755297731	1440807238	/nfs/dbraw/zinc/80/72/38/1440807238.db2.gz	CMDWRZMJJOMUNS-SCLBCKFNSA-N	0	3	334.410	3.048	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H](C)N(C)Cc2cc3ccccc3o2)nc1	ZINC001755324000	1440820511	/nfs/dbraw/zinc/82/05/11/1440820511.db2.gz	YPEBJEWMYUYKMP-OAHLLOKOSA-N	0	3	347.418	3.059	20	30		EGEDHN
N#Cc1ccc(F)c(CNCC2(NC(=O)C3CC3)CCCCC2)c1	ZINC001755346863	1440826686	/nfs/dbraw/zinc/82/66/86/1440826686.db2.gz	UDRXTNWOEYORCU-UHFFFAOYSA-N	0	3	329.419	3.016	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)[C@@H]2C[C@H]2c2cccnc2)CCCCC1	ZINC001755354300	1440828816	/nfs/dbraw/zinc/82/88/16/1440828816.db2.gz	IRBBXVQNECBZLV-DLBZAZTESA-N	0	3	347.890	3.346	20	30		EGEDHN
CCCC[C@@H](CNCC#Cc1ccccc1)NC(=O)C1CCCC1	ZINC001755356155	1440829568	/nfs/dbraw/zinc/82/95/68/1440829568.db2.gz	GMYQRYGEJIRAAD-FQEVSTJZSA-N	0	3	326.484	3.493	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)Cc1cccc2ncccc12	ZINC001755365582	1440834108	/nfs/dbraw/zinc/83/41/08/1440834108.db2.gz	HGBKNNBJVPDXEZ-IBGZPJMESA-N	0	3	349.478	3.161	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)[C@@]1(c2ccccc2)CCCO1	ZINC001755367492	1440835358	/nfs/dbraw/zinc/83/53/58/1440835358.db2.gz	HFWPELRMDNNJOY-FPOVZHCZSA-N	0	3	342.483	3.239	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)[C@@]1(C)CCc2ccccc21	ZINC001755371971	1440837406	/nfs/dbraw/zinc/83/74/06/1440837406.db2.gz	YJXLKZCPKZPOEI-UGKGYDQZSA-N	0	3	338.495	3.275	20	30		EGEDHN
C#CCCN1CC([C@@H](C)NC(=O)CCCc2ccc(Cl)cc2)C1	ZINC001755378731	1440838670	/nfs/dbraw/zinc/83/86/70/1440838670.db2.gz	OWFMTGABEMZUGZ-OAHLLOKOSA-N	0	3	332.875	3.123	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C2CN(CC3CC(F)(F)C3)C2)CCC1	ZINC001755383996	1440840137	/nfs/dbraw/zinc/84/01/37/1440840137.db2.gz	YZQRIPSMCHUHQQ-CYBMUJFWSA-N	0	3	326.431	3.215	20	30		EGEDHN
C#CCCN1CC([C@H](C)NC(=O)C[C@H](c2ccccc2)C(C)C)C1	ZINC001755388194	1440841222	/nfs/dbraw/zinc/84/12/22/1440841222.db2.gz	AOOXTJHFJNQOMC-PXNSSMCTSA-N	0	3	326.484	3.276	20	30		EGEDHN
CCCC[C@@H](C)C(=O)NC[C@@H]1[C@H]2CN(Cc3cccc(C#N)c3)C[C@H]21	ZINC001755421148	1440849992	/nfs/dbraw/zinc/84/99/92/1440849992.db2.gz	ROXGTKUGMRYZQK-XLNTUCKNSA-N	0	3	339.483	3.179	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1C[C@H](CNCc2cc(C3CC3)no2)C1	ZINC001755471832	1440858988	/nfs/dbraw/zinc/85/89/88/1440858988.db2.gz	QOTGVKJGKJECPJ-CTYIDZIISA-N	0	3	331.460	3.139	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H](CNCc3conc3CC)C2)CCCC1	ZINC001755484312	1440860586	/nfs/dbraw/zinc/86/05/86/1440860586.db2.gz	PESIJFFHSMPULI-JCNLHEQBSA-N	0	3	345.487	3.358	20	30		EGEDHN
COc1ccc(Cl)c(CNCCC[C@H](C)NC(=O)C#CC2CC2)c1	ZINC001755497693	1440862305	/nfs/dbraw/zinc/86/23/05/1440862305.db2.gz	STOPGSUQGDXNQR-AWEZNQCLSA-N	0	3	348.874	3.137	20	30		EGEDHN
C=C(Cl)CNCCC[C@@H](C)NC(=O)[C@H]1CCN(C)c2ccccc21	ZINC001755501294	1440862621	/nfs/dbraw/zinc/86/26/21/1440862621.db2.gz	JUIQXFSGZZLUGL-WBVHZDCISA-N	0	3	349.906	3.237	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](C)CCCN[C@H](C)c2cnccn2)CC1	ZINC001755515432	1440864104	/nfs/dbraw/zinc/86/41/04/1440864104.db2.gz	SKAHXZWZKCHQFD-HZPDHXFCSA-N	0	3	330.476	3.159	20	30		EGEDHN
CCCC(=O)N1CCC(N(C)CC#Cc2ccc(Cl)cc2)CC1	ZINC001755525322	1440865743	/nfs/dbraw/zinc/86/57/43/1440865743.db2.gz	CBBHGYKVRUFRNR-UHFFFAOYSA-N	0	3	332.875	3.414	20	30		EGEDHN
CC1CC(C(=O)N(C)[C@H](CNCC#Cc2ccc(F)cc2)C2CC2)C1	ZINC001755559000	1440874082	/nfs/dbraw/zinc/87/40/82/1440874082.db2.gz	SUBKUBSCKHNARP-PKUWUEBNSA-N	0	3	342.458	3.050	20	30		EGEDHN
C=CC(C)(C)CC(=O)N(C)[C@H](CNCc1cc(C)ns1)C1CC1	ZINC001755562753	1440874954	/nfs/dbraw/zinc/87/49/54/1440874954.db2.gz	UMCLNRBBYRRFSZ-MRXNPFEDSA-N	0	3	335.517	3.380	20	30		EGEDHN
CCC(C)(C)C(=O)N(C)[C@H](CNCC#Cc1ccccc1)C1CC1	ZINC001755565553	1440875603	/nfs/dbraw/zinc/87/56/03/1440875603.db2.gz	BDNJNDQPVKXPNY-LJQANCHMSA-N	0	3	326.484	3.301	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N(C)[C@@H](CNCC#Cc1ccc(F)cc1)C1CC1	ZINC001755568860	1440876491	/nfs/dbraw/zinc/87/64/91/1440876491.db2.gz	FIUMRCQKVIAGNJ-JXFKEZNVSA-N	0	3	344.474	3.296	20	30		EGEDHN
C=CCCC(=O)N(C)C[C@H](C)NCc1ccc(Br)s1	ZINC001755579694	1440879139	/nfs/dbraw/zinc/87/91/39/1440879139.db2.gz	IVFMECMBJNXXKZ-NSHDSACASA-N	0	3	345.306	3.413	20	30		EGEDHN
C[C@H](CN(C)C(=O)C(C)(C)C(F)(F)F)NCC#Cc1ccccc1	ZINC001755614731	1440888525	/nfs/dbraw/zinc/88/85/25/1440888525.db2.gz	PMCWQYWVTDGINO-CQSZACIVSA-N	0	3	340.389	3.063	20	30		EGEDHN
C=CCCC(=O)N1C[C@H](NCc2cc(Cl)cc3c2OCC3)C[C@@H]1C	ZINC001755671786	1440894081	/nfs/dbraw/zinc/89/40/81/1440894081.db2.gz	BWCIIPFBZLWDRS-SUMWQHHRSA-N	0	3	348.874	3.320	20	30		EGEDHN
C#CCN1CC[C@]2(NC(=O)CCCc3ccccc3Cl)CCC[C@H]12	ZINC001755700089	1440899662	/nfs/dbraw/zinc/89/96/62/1440899662.db2.gz	CCLPCGITFMTNKH-AZUAARDMSA-N	0	3	344.886	3.409	20	30		EGEDHN
C#CCN1CC[C@]2(NC(=O)CCc3ccc(Cl)cc3)CCC[C@@H]12	ZINC001755703296	1440901211	/nfs/dbraw/zinc/90/12/11/1440901211.db2.gz	WSLYTKZJXYFIFW-IEBWSBKVSA-N	0	3	330.859	3.019	20	30		EGEDHN
C=C(C)CN(C)CCN(C(=O)c1cc2ccccc2c(=O)[nH]1)C(C)C	ZINC001755813500	1440921829	/nfs/dbraw/zinc/92/18/29/1440921829.db2.gz	TXOWJPNONIMCMH-UHFFFAOYSA-N	0	3	341.455	3.299	20	30		EGEDHN
C=C(C)CN(C)CCN(C(=O)[C@H]1[C@@H]2c3ccccc3C[C@H]12)C(C)C	ZINC001755814699	1440922720	/nfs/dbraw/zinc/92/27/20/1440922720.db2.gz	LRMFNZJYCJIGPO-XUVXKRRUSA-N	0	3	326.484	3.317	20	30		EGEDHN
C[C@@H](NC(=O)CCC1CC1)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001755842486	1440932138	/nfs/dbraw/zinc/93/21/38/1440932138.db2.gz	UYWLFUCSJTXCIH-MRXNPFEDSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@H](NC(=O)CCCF)C1CCN(Cc2cccc(C#N)c2)CC1	ZINC001755847507	1440933822	/nfs/dbraw/zinc/93/38/22/1440933822.db2.gz	CHJFJMLYJRZSQB-HNNXBMFYSA-N	0	3	331.435	3.025	20	30		EGEDHN
CC(C)C#CC(=O)NCC1=CCN(CCCCC(F)(F)F)CC1	ZINC001755886606	1440940365	/nfs/dbraw/zinc/94/03/65/1440940365.db2.gz	NCXQDARNVKMZMY-UHFFFAOYSA-N	0	3	330.394	3.127	20	30		EGEDHN
C=CCNCc1ccc(CNC(=O)C[C@@H]2CC[C@@H](C3CC3)O2)c(F)c1	ZINC001755901704	1440944131	/nfs/dbraw/zinc/94/41/31/1440944131.db2.gz	ALMGMNIUGUPSMJ-HKUYNNGSSA-N	0	3	346.446	3.065	20	30		EGEDHN
C=CCNCc1ccc(CNC(=O)C[C@H]2CC[C@H](C3CC3)O2)c(F)c1	ZINC001755901705	1440944154	/nfs/dbraw/zinc/94/41/54/1440944154.db2.gz	ALMGMNIUGUPSMJ-IEBWSBKVSA-N	0	3	346.446	3.065	20	30		EGEDHN
C=C(C)C[N@H+](CCc1ccc(-c2nnn[n-]2)cc1)Cc1ccccc1	ZINC001573293663	946964138	/nfs/dbraw/zinc/96/41/38/946964138.db2.gz	FOUNLYOYNDOOQM-UHFFFAOYSA-N	0	3	333.439	3.488	20	30		EGEDHN
C=C(C)C[N@@H+](CCc1ccc(-c2nnn[n-]2)cc1)Cc1ccccc1	ZINC001573293663	946964164	/nfs/dbraw/zinc/96/41/64/946964164.db2.gz	FOUNLYOYNDOOQM-UHFFFAOYSA-N	0	3	333.439	3.488	20	30		EGEDHN
C=C(C)C[N@H+](CCc1ccc(-c2nn[n-]n2)cc1)Cc1ccccc1	ZINC001573293663	946964172	/nfs/dbraw/zinc/96/41/72/946964172.db2.gz	FOUNLYOYNDOOQM-UHFFFAOYSA-N	0	3	333.439	3.488	20	30		EGEDHN
C=C(C)C[N@@H+](CCc1ccc(-c2nn[n-]n2)cc1)Cc1ccccc1	ZINC001573293663	946964191	/nfs/dbraw/zinc/96/41/91/946964191.db2.gz	FOUNLYOYNDOOQM-UHFFFAOYSA-N	0	3	333.439	3.488	20	30		EGEDHN
Cc1cc(C#N)ccc1CN[C@@H](Cc1ccccc1)[C@H](O)C(F)(F)F	ZINC001648156199	1126250191	/nfs/dbraw/zinc/25/01/91/1126250191.db2.gz	RHOVQLZYRFMZAV-ROUUACIJSA-N	0	3	348.368	3.491	20	30		EGEDHN
N#Cc1cccc(C(=O)N2C[C@@H]3CCN(Cc4ccccc4)C[C@H]3C2)c1	ZINC000368130567	168314767	/nfs/dbraw/zinc/31/47/67/168314767.db2.gz	CXNIYPJEVHPZNT-SFTDATJTSA-N	0	3	345.446	3.152	20	30		EGEDHN
COc1cccc([C@@H](CNCc2ccc(C#N)cc2)N2CCCC2)c1	ZINC000052660165	214139560	/nfs/dbraw/zinc/13/95/60/214139560.db2.gz	FTAMYEAQLXGFIM-OAQYLSRUSA-N	0	3	335.451	3.494	20	30		EGEDHN
CN(Cc1cc(C#N)n(C)c1)[C@@H]1CCCN(C(=O)OC(C)(C)C)CC1	ZINC000369001785	168390502	/nfs/dbraw/zinc/39/05/02/168390502.db2.gz	QVFJESBHTFTBFV-MRXNPFEDSA-N	0	3	346.475	3.118	20	30		EGEDHN
Cc1nnc(CCNCc2ccc(C#N)cc2C(F)(F)F)s1	ZINC000352472850	282312992	/nfs/dbraw/zinc/31/29/92/282312992.db2.gz	LFJWVSPHATVRLU-UHFFFAOYSA-N	0	3	326.347	3.069	20	30		EGEDHN
C[C@H](NC[C@H](O)COc1ccc(C#N)cc1)c1ccccc1Cl	ZINC000068046224	215272068	/nfs/dbraw/zinc/27/20/68/215272068.db2.gz	SBVGWGSNWNGODI-ZFWWWQNUSA-N	0	3	330.815	3.302	20	30		EGEDHN
Cc1ccc(C)c(CN[C@H]2CCN(Cc3ccc(C#N)cc3)C2=O)c1	ZINC000192244744	239601218	/nfs/dbraw/zinc/60/12/18/239601218.db2.gz	SRNHZYZJEPBZJM-FQEVSTJZSA-N	0	3	333.435	3.066	20	30		EGEDHN
C[C@@H](N[C@@H]1CCN(C(=O)C2CCCCC2)C1)c1cccc(C#N)c1	ZINC000181900100	241577974	/nfs/dbraw/zinc/57/79/74/241577974.db2.gz	YEQNRYMMURMNOC-DNVCBOLYSA-N	0	3	325.456	3.390	20	30		EGEDHN
N#Cc1ccccc1CNc1ccccc1CN1CCC(CO)CC1	ZINC000264094342	246059216	/nfs/dbraw/zinc/05/92/16/246059216.db2.gz	SWCHJUVLHBSOOV-UHFFFAOYSA-N	0	3	335.451	3.375	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)o1)Oc1ccc(Br)cc1	ZINC000266141060	248125858	/nfs/dbraw/zinc/12/58/58/248125858.db2.gz	HFEJMNDLRCKMLF-LLVKDONJSA-N	0	3	335.201	3.471	20	30		EGEDHN
COC(=O)N1CCC[C@@H]([C@@H](C)NCc2ccc(C#N)cc2Cl)C1	ZINC000492392067	269701323	/nfs/dbraw/zinc/70/13/23/269701323.db2.gz	RRBVJWXMLUEYSM-IUODEOHRSA-N	0	3	335.835	3.168	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)c1cc(C#N)cs1	ZINC000267709143	251275298	/nfs/dbraw/zinc/27/52/98/251275298.db2.gz	HUQLERQWVVAIMX-RHSMWYFYSA-N	0	3	339.464	3.260	20	30		EGEDHN
C[C@@H](N[C@@H](C)c1ccc(NS(C)(=O)=O)cc1)c1ccc(C#N)cc1	ZINC000268835413	252285006	/nfs/dbraw/zinc/28/50/06/252285006.db2.gz	XVUANIZXWBWZEB-KGLIPLIRSA-N	0	3	343.452	3.342	20	30		EGEDHN
C[C@H](N[C@@H](C)c1ccc(NS(C)(=O)=O)cc1)c1ccc(C#N)cc1	ZINC000268835409	252285204	/nfs/dbraw/zinc/28/52/04/252285204.db2.gz	XVUANIZXWBWZEB-KBPBESRZSA-N	0	3	343.452	3.342	20	30		EGEDHN
C#CCNC(=O)CCN[C@H](C)c1ccc(-c2ccccc2OC)cc1	ZINC000268850905	252298566	/nfs/dbraw/zinc/29/85/66/252298566.db2.gz	YAHUUOMRWROFII-MRXNPFEDSA-N	0	3	336.435	3.152	20	30		EGEDHN
Cc1cc(NC(=O)C2CCN([C@H](C)c3ccc(C#N)cc3)CC2)no1	ZINC000118391967	221146150	/nfs/dbraw/zinc/14/61/50/221146150.db2.gz	DSJLVWLNORJOFP-CQSZACIVSA-N	0	3	338.411	3.266	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)Nc1ccc(N2CCN(CC)CC2)cc1C	ZINC000069322528	258005910	/nfs/dbraw/zinc/00/59/10/258005910.db2.gz	GCHSFXQDDKACCR-KRWDZBQOSA-N	0	3	345.487	3.057	20	30		EGEDHN
COc1ccc(CNC[C@H](c2c(F)cccc2F)N(C)C)cc1C#N	ZINC000174399111	533670519	/nfs/dbraw/zinc/67/05/19/533670519.db2.gz	RLQIRPFIKLODDL-QGZVFWFLSA-N	0	3	345.393	3.238	20	30		EGEDHN
C[C@H](NCc1ccccc1Cn1cncn1)c1ccc(C#N)c(F)c1	ZINC000337816730	141061359	/nfs/dbraw/zinc/06/13/59/141061359.db2.gz	OYWVPXIUJMKQGI-AWEZNQCLSA-N	0	3	335.386	3.188	20	30		EGEDHN
CO[C@@H]1[C@H](C)[C@@H](N[C@@H](C)C(=O)Nc2ccc(C#N)c(Cl)c2)C1(C)C	ZINC000344471386	141159210	/nfs/dbraw/zinc/15/92/10/141159210.db2.gz	UWTYEWFSSRPXAL-OXUXUCFPSA-N	0	3	349.862	3.188	20	30		EGEDHN
CC[C@H](C)N[C@H](CNC(=O)Nc1cccc(C#N)c1)c1ccco1	ZINC000353353380	141293137	/nfs/dbraw/zinc/29/31/37/141293137.db2.gz	MUKZSDJWTUEXLS-XJKSGUPXSA-N	0	3	326.400	3.402	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1)C(=O)c1cc(C#N)ccc1Cl	ZINC000351604804	144286743	/nfs/dbraw/zinc/28/67/43/144286743.db2.gz	WTIFTLNFLQNLEX-UHFFFAOYSA-N	0	3	341.842	3.416	20	30		EGEDHN
CN(C)[C@]1(CNc2ccc(C#N)cc2C(F)(F)F)CCSC1	ZINC000361703333	144351225	/nfs/dbraw/zinc/35/12/25/144351225.db2.gz	YUWVOPHTOBKYLN-AWEZNQCLSA-N	0	3	329.391	3.426	20	30		EGEDHN
N#Cc1ccccc1COc1cccc(CNCCc2cnccn2)c1	ZINC000341267247	155219560	/nfs/dbraw/zinc/21/95/60/155219560.db2.gz	SMIGHKXHNCVOOA-UHFFFAOYSA-N	0	3	344.418	3.260	20	30		EGEDHN
N#Cc1ccc([C@H](NC2CCC(c3ccccc3)CC2)C(N)=O)cc1	ZINC000115596601	152022809	/nfs/dbraw/zinc/02/28/09/152022809.db2.gz	PXGSKUAUFVLPAG-UUKMXZOPSA-N	0	3	333.435	3.401	20	30		EGEDHN
Cc1ccc(CNCc2cccc(C#N)c2)c(-n2cc(Cl)cn2)n1	ZINC000190303965	153129131	/nfs/dbraw/zinc/12/91/31/153129131.db2.gz	NQHOJXGKSGAIHA-UHFFFAOYSA-N	0	3	337.814	3.391	20	30		EGEDHN
CC[C@H](Cc1ccccc1)N[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000190619744	153152616	/nfs/dbraw/zinc/15/26/16/153152616.db2.gz	JPWGSWIUZPYGNI-RTWAWAEBSA-N	0	3	347.462	3.270	20	30		EGEDHN
CN(C[C@@H]1CCN(C)[C@H]1c1cccnc1)c1nccc(C#N)c1Cl	ZINC000343011338	155613616	/nfs/dbraw/zinc/61/36/16/155613616.db2.gz	DYGBBEHZZYZJQE-RDJZCZTQSA-N	0	3	341.846	3.131	20	30		EGEDHN
C[C@@H]1[C@H](NC(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)CCCN1C	ZINC000345266035	156025539	/nfs/dbraw/zinc/02/55/39/156025539.db2.gz	MEFJJMZWQUAQKP-QMTHXVAHSA-N	0	3	340.349	3.181	20	30		EGEDHN
COc1ccc(CN(CCN(C)C)Cc2ccccc2F)cc1C#N	ZINC000348903036	156280723	/nfs/dbraw/zinc/28/07/23/156280723.db2.gz	FKCQZOPESLQAEF-UHFFFAOYSA-N	0	3	341.430	3.270	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)Cc1c(F)cccc1F	ZINC000348904795	156284160	/nfs/dbraw/zinc/28/41/60/156284160.db2.gz	OFHJSQOFSQNRLL-UHFFFAOYSA-N	0	3	329.394	3.400	20	30		EGEDHN
N#Cc1ccccc1N1CCCN(Cc2ccc3c(c2)CCO3)CC1	ZINC000111201624	162146464	/nfs/dbraw/zinc/14/64/64/162146464.db2.gz	CIADNJAZHFMOMV-UHFFFAOYSA-N	0	3	333.435	3.205	20	30		EGEDHN
N#Cc1csc(CNc2ccccc2CN2CCC(O)CC2)c1	ZINC000304647361	163070082	/nfs/dbraw/zinc/07/00/82/163070082.db2.gz	PHZGZNRVCSQUCP-UHFFFAOYSA-N	0	3	327.453	3.189	20	30		EGEDHN
CN(C)CCOC1CCN(c2ccc(C(F)(F)F)cc2C#N)CC1	ZINC000343854122	164051468	/nfs/dbraw/zinc/05/14/68/164051468.db2.gz	PBZHERDQXRDAQE-UHFFFAOYSA-N	0	3	341.377	3.124	20	30		EGEDHN
Cc1cc(CN2CC[C@@](CO)(Cc3ccc(F)cc3)C2)ccc1C#N	ZINC000344131696	164110919	/nfs/dbraw/zinc/11/09/19/164110919.db2.gz	OFGIVBVTCRNHAA-OAQYLSRUSA-N	0	3	338.426	3.433	20	30		EGEDHN
COCCN(C)CC[C@H](NCc1ccc(C#N)s1)c1ccccc1	ZINC000344231384	164131922	/nfs/dbraw/zinc/13/19/22/164131922.db2.gz	LBAYDBQNBQQKSH-IBGZPJMESA-N	0	3	343.496	3.419	20	30		EGEDHN
C[C@H]1C[C@@H]1N1CCN(C(=O)c2cc(C#N)ccc2Cl)C[C@@H](C)C1	ZINC000346175919	164357082	/nfs/dbraw/zinc/35/70/82/164357082.db2.gz	DVVSULIBJQOIMR-DCGLDWPTSA-N	0	3	331.847	3.014	20	30		EGEDHN
C[C@@H]1CC[C@@H](N(CCO)Cc2ccc(Br)cc2C#N)C1	ZINC000351652869	165115930	/nfs/dbraw/zinc/11/59/30/165115930.db2.gz	TVJZBDYPSYLFNX-MLGOLLRUSA-N	0	3	337.261	3.304	20	30		EGEDHN
CC[C@@H](C)N[C@H](CNC(=O)c1ncc(C#N)cc1Cl)c1ccco1	ZINC000359535406	167182886	/nfs/dbraw/zinc/18/28/86/167182886.db2.gz	CTMQTOKHKAJXTR-BXUZGUMPSA-N	0	3	346.818	3.059	20	30		EGEDHN
CC[C@@H](C)N[C@@H](CNC(=O)c1cccc(C#N)c1C)c1ccco1	ZINC000359539463	167184947	/nfs/dbraw/zinc/18/49/47/167184947.db2.gz	IQKXNTNZKDOORA-DYVFJYSZSA-N	0	3	325.412	3.319	20	30		EGEDHN
C[C@@H]1[C@H](NC(=O)c2cccc(F)c2C#N)CCN1Cc1ccccc1	ZINC000359841632	167245719	/nfs/dbraw/zinc/24/57/19/167245719.db2.gz	OURWSSVMMOOICC-AUUYWEPGSA-N	0	3	337.398	3.090	20	30		EGEDHN
C[C@@H]1COc2ccccc2CN1CCC(=O)Nc1cccc(C#N)c1	ZINC000359862991	167252275	/nfs/dbraw/zinc/25/22/75/167252275.db2.gz	SNACJJMXWYSWFB-OAHLLOKOSA-N	0	3	335.407	3.170	20	30		EGEDHN
C[C@@H](C(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1cccc(C#N)c1	ZINC000359890889	167259349	/nfs/dbraw/zinc/25/93/49/167259349.db2.gz	XTJVLDOSJIVTMZ-OXQOHEQNSA-N	0	3	333.435	3.052	20	30		EGEDHN
C[C@@H]1CN(CC2CCN(Cc3cc(F)ccc3C#N)CC2)C[C@@H](C)O1	ZINC000159586276	225245111	/nfs/dbraw/zinc/24/51/11/225245111.db2.gz	TVWYVKWBPRLJAC-HZPDHXFCSA-N	0	3	345.462	3.019	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)N(CCN(C)C)C1CC1	ZINC000450710620	269906985	/nfs/dbraw/zinc/90/69/85/269906985.db2.gz	CTIJUZNGYXPURB-UHFFFAOYSA-N	0	3	327.453	3.248	20	30		EGEDHN
COc1ccc([O-])c(C[NH2+]CCSCc2ccccc2C#N)c1	ZINC000182022154	270038644	/nfs/dbraw/zinc/03/86/44/270038644.db2.gz	IRVFZZQDQKTEDC-UHFFFAOYSA-N	0	3	328.437	3.295	20	30		EGEDHN
Cc1cc(C)cc(OCCNC(=O)C(C#N)Cc2ccc(C#N)cc2)c1	ZINC000279446192	270039882	/nfs/dbraw/zinc/03/98/82/270039882.db2.gz	ZBRBYGMABPPSKR-IBGZPJMESA-N	0	3	347.418	3.053	20	30		EGEDHN
CSc1ccc(OC[C@H](O)CN[C@@H](C)c2ccc(C#N)cc2)cc1	ZINC000411456685	270046873	/nfs/dbraw/zinc/04/68/73/270046873.db2.gz	VBWDBEGJGGWNOT-WMLDXEAASA-N	0	3	342.464	3.371	20	30		EGEDHN
CCOC(=O)c1ccc(C#N)c(SC[C@@H]2CCCCN2C(C)C)n1	ZINC000412991566	270047035	/nfs/dbraw/zinc/04/70/35/270047035.db2.gz	RIDLAACDYOMQDC-HNNXBMFYSA-N	0	3	347.484	3.485	20	30		EGEDHN
N#Cc1ccc(Br)c(CN2CCC[C@@H]2[C@H]2CCC[C@H]2O)c1	ZINC000451419404	270053298	/nfs/dbraw/zinc/05/32/98/270053298.db2.gz	LGLLKRMLMQEFHY-DJIMGWMZSA-N	0	3	349.272	3.446	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CN1CCC[C@@H]1c1cccs1	ZINC000528339814	270059830	/nfs/dbraw/zinc/05/98/30/270059830.db2.gz	QHAWAWIRLOLFDT-JKSUJKDBSA-N	0	3	328.437	3.197	20	30		EGEDHN
CC(C)OCCN1CCC(Nc2ccc3cc(C#N)ccc3n2)CC1	ZINC000301839242	265869056	/nfs/dbraw/zinc/86/90/56/265869056.db2.gz	ZNNBHXXZMVEVLK-UHFFFAOYSA-N	0	3	338.455	3.408	20	30		EGEDHN
CCC(CC)[C@H](CCNC(=O)C(C#N)Cc1ccc(C#N)cc1)OC	ZINC000348354568	266006782	/nfs/dbraw/zinc/00/67/82/266006782.db2.gz	YQFBJVHFKACWSO-OALUTQOASA-N	0	3	341.455	3.198	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@@H]1CCNCc1cc(C#N)cs1	ZINC000227641033	266201263	/nfs/dbraw/zinc/20/12/63/266201263.db2.gz	DCVNVZXBYOHKRV-CQSZACIVSA-N	0	3	335.473	3.499	20	30		EGEDHN
CC(C)c1ccc([C@@H](N)CNC(=O)NCc2cccc(C#N)c2)cc1	ZINC000416993267	266958871	/nfs/dbraw/zinc/95/88/71/266958871.db2.gz	MGTIRCCVQFCURH-IBGZPJMESA-N	0	3	336.439	3.181	20	30		EGEDHN
C[C@@H](c1ccc(-n2cncn2)cc1)N(C)CCOc1ccccc1C#N	ZINC000299059487	267001116	/nfs/dbraw/zinc/00/11/16/267001116.db2.gz	NJMREFNHMUJAEU-INIZCTEOSA-N	0	3	347.422	3.211	20	30		EGEDHN
C[C@@H]1CN(C(=O)Nc2ccc(F)c(C#N)c2)CCN(C2CCC2)C1	ZINC000293065276	267039490	/nfs/dbraw/zinc/03/94/90/267039490.db2.gz	ZEWZODUPEOBZLI-ZDUSSCGKSA-N	0	3	330.407	3.035	20	30		EGEDHN
CCN(CCN1CCCCCC1)C(=O)[C@@H](C)c1cccc(C#N)c1	ZINC000462460089	267064214	/nfs/dbraw/zinc/06/42/14/267064214.db2.gz	QRCUERJTVYLHQH-KRWDZBQOSA-N	0	3	327.472	3.386	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2ccccc2-c2ccccc2C#N)CCN1C	ZINC000331370832	267081057	/nfs/dbraw/zinc/08/10/57/267081057.db2.gz	GHLJJJINJLXTOY-WBVHZDCISA-N	0	3	333.435	3.438	20	30		EGEDHN
C[C@@](CO)(NCC(=O)Nc1ccc(C#N)c(Cl)c1)C1CCCCC1	ZINC000174792140	267111967	/nfs/dbraw/zinc/11/19/67/267111967.db2.gz	CCDPEFBITZBBLM-SFHVURJKSA-N	0	3	349.862	3.071	20	30		EGEDHN
C[C@@]1(NCc2ccc(C#N)cc2Br)CCO[C@@H]1C1CC1	ZINC000273097789	267117743	/nfs/dbraw/zinc/11/77/43/267117743.db2.gz	UXXRPFIPVLUTDV-HZPDHXFCSA-N	0	3	335.245	3.368	20	30		EGEDHN
CCO[C@@H]1CCCC[C@H]1NCC(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000452034501	267145938	/nfs/dbraw/zinc/14/59/38/267145938.db2.gz	LCWZFJKQMMOWGC-HZPDHXFCSA-N	0	3	335.835	3.087	20	30		EGEDHN
C[C@H](NC(=O)NC[C@@H](c1ccccc1)N(C)C)c1ccc(C#N)cc1	ZINC000298567560	267172278	/nfs/dbraw/zinc/17/22/78/267172278.db2.gz	NNJDTDGHINLREO-KXBFYZLASA-N	0	3	336.439	3.221	20	30		EGEDHN
CCS[C@@H]1CCCC[C@@H]1NCc1cccc(C(=O)OC)c1C#N	ZINC000527298736	267179738	/nfs/dbraw/zinc/17/97/38/267179738.db2.gz	ZTAJIPDPTBFNCC-DLBZAZTESA-N	0	3	332.469	3.499	20	30		EGEDHN
CC[C@H](C)N[C@H](CNC(=O)NCc1ccc(C#N)cc1)c1ccco1	ZINC000479271334	267205022	/nfs/dbraw/zinc/20/50/22/267205022.db2.gz	FOYSBIMIYMGQLR-WMLDXEAASA-N	0	3	340.427	3.080	20	30		EGEDHN
C[C@H]1CN(CCCCNc2nc3c(cc2C#N)CCCC3)C[C@H](C)O1	ZINC000301901102	267231045	/nfs/dbraw/zinc/23/10/45/267231045.db2.gz	VISTYBURNZFTGB-HOTGVXAUSA-N	0	3	342.487	3.133	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@H]1Nc1ccc([N+](=O)[O-])c(C#N)c1	ZINC000302195617	267233667	/nfs/dbraw/zinc/23/36/67/267233667.db2.gz	OKWOWJARLKPTIY-KBXCAEBGSA-N	0	3	336.395	3.399	20	30		EGEDHN
CN(C)[C@@H](CNCc1ccc(C#N)c(F)c1)c1c(F)cccc1F	ZINC000421368938	267286694	/nfs/dbraw/zinc/28/66/94/267286694.db2.gz	VFUBKNSMXIOSOR-KRWDZBQOSA-N	0	3	333.357	3.368	20	30		EGEDHN
CN(CCC(=O)Nc1cc(F)cc(F)c1)Cc1cccc(C#N)c1	ZINC000433276382	267304484	/nfs/dbraw/zinc/30/44/84/267304484.db2.gz	USUSXMGDGFUOEZ-UHFFFAOYSA-N	0	3	329.350	3.297	20	30		EGEDHN
Cc1cc(F)cc2c1CN(C(=O)C(C#N)Cc1ccc(C#N)cc1)CC2	ZINC000337237296	267328709	/nfs/dbraw/zinc/32/87/09/267328709.db2.gz	CARHQGCMUIQFMP-SFHVURJKSA-N	0	3	347.393	3.273	20	30		EGEDHN
COC(=O)[C@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1c1ccccc1	ZINC000452006328	267389551	/nfs/dbraw/zinc/38/95/51/267389551.db2.gz	NWXPVAJCCDYHEU-ROUUACIJSA-N	0	3	338.382	3.086	20	30		EGEDHN
Cc1cccc(OC[C@H](C)NC(=O)C(C#N)Cc2ccc(C#N)cc2)c1	ZINC000279291177	267483147	/nfs/dbraw/zinc/48/31/47/267483147.db2.gz	LCENJIJILCAXBC-QFBILLFUSA-N	0	3	347.418	3.133	20	30		EGEDHN
Cc1ccc(C)c(CN[C@H]2CCCN(c3ccc(C#N)cc3)C2=O)c1	ZINC000503965068	268032840	/nfs/dbraw/zinc/03/28/40/268032840.db2.gz	WGBZNORJKIUSRK-FQEVSTJZSA-N	0	3	333.435	3.460	20	30		EGEDHN
Cc1cccc([C@@H](C)CNCCS(=O)(=O)c2ccc(C#N)cc2)c1	ZINC000515347847	268056520	/nfs/dbraw/zinc/05/65/20/268056520.db2.gz	OVXADVGGPORKRO-INIZCTEOSA-N	0	3	342.464	3.034	20	30		EGEDHN
N#Cc1ccc(CN2CCC(Nc3cnc4c(c3)COCC4)CC2)cc1	ZINC000359879007	268065377	/nfs/dbraw/zinc/06/53/77/268065377.db2.gz	YQNPVGYWMACCBA-UHFFFAOYSA-N	0	3	348.450	3.102	20	30		EGEDHN
Cc1nc2ccccc2n1C[C@@H]1CCCN1Cc1ccc(C#N)cn1	ZINC000515496328	268081041	/nfs/dbraw/zinc/08/10/41/268081041.db2.gz	MSAKEAHUIRVPBI-SFHVURJKSA-N	0	3	331.423	3.276	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCc2ccc(F)c(Cl)c2)cc1	ZINC000348191595	268085837	/nfs/dbraw/zinc/08/58/37/268085837.db2.gz	FDJCMKIUEVHDFA-HNNXBMFYSA-N	0	3	341.773	3.349	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@H]2C[C@H](c3cccc(F)c3)C2)cc1	ZINC000280800874	268086877	/nfs/dbraw/zinc/08/68/77/268086877.db2.gz	YGYZQHOFGJRTDT-BJLQDIEVSA-N	0	3	347.393	3.442	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCCCOC2CCCCC2)cc1	ZINC000280577992	268090569	/nfs/dbraw/zinc/09/05/69/268090569.db2.gz	DAWDPAGUSRPQQH-GOSISDBHSA-N	0	3	339.439	3.096	20	30		EGEDHN
N#Cc1ccc(Cl)cc1NC[C@@H]1C[C@H](O)CN1Cc1ccccc1	ZINC000301879334	268101154	/nfs/dbraw/zinc/10/11/54/268101154.db2.gz	OSHKAZVEQCYVAP-ROUUACIJSA-N	0	3	341.842	3.259	20	30		EGEDHN
N#Cc1ccc(N2CC[C@H](N[C@H](c3ccccc3)C3CC3)C2=O)cc1	ZINC000269718559	268127021	/nfs/dbraw/zinc/12/70/21/268127021.db2.gz	WQJMPUQZSSUZBE-VQTJNVASSA-N	0	3	331.419	3.404	20	30		EGEDHN
N#Cc1ccc(OC2CC[NH+](Cc3ccccc3[O-])CC2)c(F)c1	ZINC000289252127	268166528	/nfs/dbraw/zinc/16/65/28/268166528.db2.gz	FFFHPOVNDXNDOJ-UHFFFAOYSA-N	0	3	326.371	3.446	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCN(Cc3ccc4ncccc4c3)C2)nc1	ZINC000292047851	268185730	/nfs/dbraw/zinc/18/57/30/268185730.db2.gz	BAEJWQBAQOUXGZ-SFHVURJKSA-N	0	3	330.391	3.155	20	30		EGEDHN
N#Cc1ccc(CNC(=O)CN(CC2CCCCC2)C2CC2)cc1	ZINC000521188234	268226260	/nfs/dbraw/zinc/22/62/60/268226260.db2.gz	SFHVBSFAEMKWQA-UHFFFAOYSA-N	0	3	325.456	3.219	20	30		EGEDHN
N#Cc1cccc(C#N)c1NC[C@@H]1CN(Cc2ccccc2)CCCO1	ZINC000302886385	268235370	/nfs/dbraw/zinc/23/53/70/268235370.db2.gz	MZLJOZBCECCXNK-HXUWFJFHSA-N	0	3	346.434	3.133	20	30		EGEDHN
N#Cc1cccc([N+](=O)[O-])c1NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000425252193	268293899	/nfs/dbraw/zinc/29/38/99/268293899.db2.gz	AGGLVYBTJFAIKN-MRXNPFEDSA-N	0	3	336.395	3.400	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CN[C@H]1CCc2c1cccc2Cl	ZINC000530230716	268299059	/nfs/dbraw/zinc/29/90/59/268299059.db2.gz	IRTNQUWPFLSYPR-KSSFIOAISA-N	0	3	342.826	3.228	20	30		EGEDHN
N#Cc1cnc(N2C[C@@H]3CCN(Cc4ccccc4)C[C@H]3C2)c(F)c1	ZINC000413295347	268312956	/nfs/dbraw/zinc/31/29/56/268312956.db2.gz	DLGWTSKSKQPBPE-ROUUACIJSA-N	0	3	336.414	3.051	20	30		EGEDHN
N#Cc1cnn2cc(CNC3(Cc4cccc(Cl)c4)CC3)cnc12	ZINC000517030713	268318334	/nfs/dbraw/zinc/31/83/34/268318334.db2.gz	UFZWVCDDXVKTOE-UHFFFAOYSA-N	0	3	337.814	3.119	20	30		EGEDHN
CC1CCN([C@@H](CNC(=O)c2cnccc2C#N)c2ccccc2)CC1	ZINC000358556579	275941889	/nfs/dbraw/zinc/94/18/89/275941889.db2.gz	MOALDUVCAYQMRF-FQEVSTJZSA-N	0	3	348.450	3.156	20	30		EGEDHN
Cc1ccccc1[C@H]([C@H](C)NC(=O)c1ccc(C#N)s1)N(C)C	ZINC000357859137	278964595	/nfs/dbraw/zinc/96/45/95/278964595.db2.gz	HITSZPGJPWYOHB-GUYCJALGSA-N	0	3	327.453	3.349	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CN(C2CC2)[C@H]2CCc3ccccc32)cc1	ZINC000068333627	307369652	/nfs/dbraw/zinc/36/96/52/307369652.db2.gz	NMVDQJGVZGHGCU-UGKGYDQZSA-N	0	3	348.446	3.450	20	30		EGEDHN
N#Cc1cc(Br)ccc1N1CC[C@@H](N2CCCCC2)C1	ZINC000130450249	307628841	/nfs/dbraw/zinc/62/88/41/307628841.db2.gz	HVXLESPRUYZGOR-OAHLLOKOSA-N	0	3	334.261	3.385	20	30		EGEDHN
CC[C@@H]1CCC[C@H]1NC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000132122974	307654303	/nfs/dbraw/zinc/65/43/03/307654303.db2.gz	QXFPFOVMGVFAAI-RTBURBONSA-N	0	3	342.487	3.210	20	30		EGEDHN
COc1ccc(CNc2cc(CN(C)C)ccc2OC)cc1C#N	ZINC000325509143	308770173	/nfs/dbraw/zinc/77/01/73/308770173.db2.gz	OQABQLGCFOAJLL-UHFFFAOYSA-N	0	3	325.412	3.249	20	30		EGEDHN
COc1ccc([C@H](C)CN2CCN(c3ccccc3C#N)CC2)cc1	ZINC000538307710	314239506	/nfs/dbraw/zinc/23/95/06/314239506.db2.gz	DLBZDXJRKAGEPK-QGZVFWFLSA-N	0	3	335.451	3.493	20	30		EGEDHN
CN(C)[C@@H](CNC(=O)c1ccc(Cl)c(C#N)c1)Cc1ccccc1	ZINC000542706864	314570431	/nfs/dbraw/zinc/57/04/31/314570431.db2.gz	AYOJYNRSJPILEB-QGZVFWFLSA-N	0	3	341.842	3.114	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CNCc2ccc(-c3ccccc3)o2)cc1	ZINC000549151781	315078305	/nfs/dbraw/zinc/07/83/05/315078305.db2.gz	FGGCQUTYFDFOAW-GOSISDBHSA-N	0	3	348.402	3.348	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)N1CC[C@@H](N2CCCC2)C1	ZINC000550504591	315129318	/nfs/dbraw/zinc/12/93/18/315129318.db2.gz	LOMGLOGTEATPBF-OAHLLOKOSA-N	0	3	339.464	3.392	20	30		EGEDHN
N#Cc1cccc(C2(NCCC(=O)N3CCc4ccccc4C3)CC2)c1	ZINC000551402237	315153343	/nfs/dbraw/zinc/15/33/43/315153343.db2.gz	YSVRHBNAPGOVRS-UHFFFAOYSA-N	0	3	345.446	3.112	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2NC[C@H](O)COc1ccc(F)cc1	ZINC000552970216	315239450	/nfs/dbraw/zinc/23/94/50/315239450.db2.gz	PDTOXMADNOOLAE-FXAWDEMLSA-N	0	3	340.398	3.104	20	30		EGEDHN
C[C@H]1CCCC[C@@H]1CCNCCS(=O)(=O)c1ccc(C#N)cc1	ZINC000568502088	316783448	/nfs/dbraw/zinc/78/34/48/316783448.db2.gz	FHCXGDFKZGYPSC-DOTOQJQBSA-N	0	3	334.485	3.138	20	30		EGEDHN
N#Cc1ccccc1-c1ccc(CN[C@@H]2CCC(=O)N[C@H]2C2CC2)cc1	ZINC000572003911	317277802	/nfs/dbraw/zinc/27/78/02/317277802.db2.gz	XRKAKZGVZNCVPA-IRLDBZIGSA-N	0	3	345.446	3.372	20	30		EGEDHN
C[C@H](NCCC(=O)Nc1sccc1C#N)c1cccc([N+](=O)[O-])c1	ZINC000180413853	323438759	/nfs/dbraw/zinc/43/87/59/323438759.db2.gz	GDVAVJQKJSOKRV-NSHDSACASA-N	0	3	344.396	3.207	20	30		EGEDHN
N#Cc1cnn2cc(CN3CCC[C@H](Cc4ccccc4)C3)cnc12	ZINC000581311265	325351019	/nfs/dbraw/zinc/35/10/19/325351019.db2.gz	STGBDOZXYQWBOZ-QGZVFWFLSA-N	0	3	331.423	3.056	20	30		EGEDHN
CC(C)Oc1ccc(C#N)cc1NC(=O)N(CCN(C)C)C(C)C	ZINC000180687004	455227907	/nfs/dbraw/zinc/22/79/07/455227907.db2.gz	PNTNPURFDOMACR-UHFFFAOYSA-N	0	3	332.448	3.149	20	30		EGEDHN
CC(C)[C@@H]1CN(Cc2cc(C#N)ccc2Br)CCN1C	ZINC000493735207	458550292	/nfs/dbraw/zinc/55/02/92/458550292.db2.gz	HLKHWDHRUBXEJI-INIZCTEOSA-N	0	3	336.277	3.093	20	30		EGEDHN
Cc1cccc([C@@H](NCC(=O)N[C@@](C)(C#N)C2CC2)C(C)(C)C)c1	ZINC000180789072	455244802	/nfs/dbraw/zinc/24/48/02/455244802.db2.gz	ZRHOYTSWVHSOOZ-QUCCMNQESA-N	0	3	327.472	3.480	20	30		EGEDHN
Cc1cccc([C@H](NCC(=O)N[C@@](C)(C#N)C2CC2)C(C)(C)C)c1	ZINC000180789056	455244947	/nfs/dbraw/zinc/24/49/47/455244947.db2.gz	ZRHOYTSWVHSOOZ-ICSRJNTNSA-N	0	3	327.472	3.480	20	30		EGEDHN
Cc1cccc([C@H](NCC(=O)N[C@](C)(C#N)C2CC2)C(C)(C)C)c1	ZINC000180789090	455245416	/nfs/dbraw/zinc/24/54/16/455245416.db2.gz	ZRHOYTSWVHSOOZ-AZUAARDMSA-N	0	3	327.472	3.480	20	30		EGEDHN
C=CC1CCN(C(=O)[C@@H]2CN(C(C)(C)C)C[C@H]2C(F)(F)F)CC1	ZINC000559713022	459274608	/nfs/dbraw/zinc/27/46/08/459274608.db2.gz	YFGKBWJCJPGMLR-ZIAGYGMSSA-N	0	3	332.410	3.320	20	30		EGEDHN
N#Cc1cccc(CNCc2ccc(C(=O)N3CCCCC3)cc2)c1	ZINC000238163007	455257614	/nfs/dbraw/zinc/25/76/14/455257614.db2.gz	PYBLLMHZRMPNSZ-UHFFFAOYSA-N	0	3	333.435	3.474	20	30		EGEDHN
CCO[C@H]1C[C@](CO)(NCc2ccccc2C(C)(C)C#N)C1(C)C	ZINC000189984034	455265789	/nfs/dbraw/zinc/26/57/89/455265789.db2.gz	LZVIIOUAAQFISU-FXAWDEMLSA-N	0	3	330.472	3.143	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CNC[C@@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000181085147	455285448	/nfs/dbraw/zinc/28/54/48/455285448.db2.gz	UKBJLUOFJPPJMB-DNUDUWDPSA-N	0	3	344.455	3.389	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CN[C@@H]1CCSc2ccccc21	ZINC000600714693	460576145	/nfs/dbraw/zinc/57/61/45/460576145.db2.gz	OWAAHINJPCPZFF-NVXWUHKLSA-N	0	3	340.448	3.125	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@@H](CO)C/C=C/C)cc1OC	ZINC000623495117	460580719	/nfs/dbraw/zinc/58/07/19/460580719.db2.gz	RDCOBMYQDHNKRG-YVARQFDVSA-N	0	3	325.836	3.330	20	30		EGEDHN
CCCN(C(=O)NCCCC#N)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000612380535	460612684	/nfs/dbraw/zinc/61/26/84/460612684.db2.gz	YQPMMAGKZWOXDO-LJQANCHMSA-N	0	3	342.487	3.376	20	30		EGEDHN
N#CCc1ccc(OC[C@@H](O)CN[C@H](c2ccccc2)C2CC2)cc1	ZINC000023678812	453715013	/nfs/dbraw/zinc/71/50/13/453715013.db2.gz	ZHKRJPQPOAYZKL-PZJWPPBQSA-N	0	3	336.435	3.233	20	30		EGEDHN
COCCN(Cc1ccc(C#N)cc1)C[C@H](O)c1cccc(Cl)c1	ZINC000075674683	453916149	/nfs/dbraw/zinc/91/61/49/453916149.db2.gz	CQTXGPNFKBWMLN-IBGZPJMESA-N	0	3	344.842	3.394	20	30		EGEDHN
N#Cc1ccc(OCCN2CC[C@H](COCc3ccccc3)C2)cc1	ZINC000075864492	453933494	/nfs/dbraw/zinc/93/34/94/453933494.db2.gz	QAZZBEVQUAKRGM-FQEVSTJZSA-N	0	3	336.435	3.476	20	30		EGEDHN
N#Cc1csc(C(=O)NC2CCN(Cc3ccccc3)CC2)c1	ZINC000084074231	453967518	/nfs/dbraw/zinc/96/75/18/453967518.db2.gz	MSGNPNCDSWRYGJ-UHFFFAOYSA-N	0	3	325.437	3.014	20	30		EGEDHN
N#CC(C(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(C(F)(F)F)cn1	ZINC000041555627	453971588	/nfs/dbraw/zinc/97/15/88/453971588.db2.gz	SNBKLHIWGPGVNH-LBPRGKRZSA-N	0	3	335.241	3.499	20	30		EGEDHN
Cc1ccccc1[C@@H]1C[C@@H](C)N([C@H](C(N)=O)c2ccc(C#N)cc2)C1	ZINC000076384592	453994704	/nfs/dbraw/zinc/99/47/04/453994704.db2.gz	NPDAWDYVPUBIKA-ZTNFWEORSA-N	0	3	333.435	3.271	20	30		EGEDHN
CCN(CCC#N)C(=O)CN[C@@H](Cc1ccccc1)c1ccccc1	ZINC000076650237	454022221	/nfs/dbraw/zinc/02/22/21/454022221.db2.gz	HKXSNOQARPAPHG-FQEVSTJZSA-N	0	3	335.451	3.322	20	30		EGEDHN
C[C@H](CC#N)N(C)C(=O)Nc1ccc(CCN2CCSCC2)cc1	ZINC000086284710	454046690	/nfs/dbraw/zinc/04/66/90/454046690.db2.gz	YLGKWUUTDOFHFZ-OAHLLOKOSA-N	0	3	346.500	3.044	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)C(=O)NCCN1CCC[C@H](C)C1	ZINC000056864930	454086516	/nfs/dbraw/zinc/08/65/16/454086516.db2.gz	LBTUHDNSEFGLBA-KRWDZBQOSA-N	0	3	345.487	3.125	20	30		EGEDHN
CCCN(CC(=O)Nc1cccc(C#N)c1)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C	ZINC000077322113	454091420	/nfs/dbraw/zinc/09/14/20/454091420.db2.gz	TZFWKILBRMWJHQ-UHOSZYNNSA-N	0	3	341.455	3.022	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2C[C@H]2c2ccccc2C)CC1	ZINC000077567020	454123877	/nfs/dbraw/zinc/12/38/77/454123877.db2.gz	NXTAOBMBMGEIOW-RBUKOAKNSA-N	0	3	327.472	3.191	20	30		EGEDHN
N#CC1(C(=O)NCCCN2CCc3ccccc3C2)CCCCC1	ZINC000057386762	454124111	/nfs/dbraw/zinc/12/41/11/454124111.db2.gz	GKAMESMWXXAYAG-UHFFFAOYSA-N	0	3	325.456	3.025	20	30		EGEDHN
C=CCSCCNC(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000159797560	455404827	/nfs/dbraw/zinc/40/48/27/455404827.db2.gz	HSEOIRDKBNVMQI-GOSISDBHSA-N	0	3	347.528	3.212	20	30		EGEDHN
Cn1cccc1[C@H]1CCCN1CCC(=O)Nc1sccc1C#N	ZINC000058068042	454162800	/nfs/dbraw/zinc/16/28/00/454162800.db2.gz	JNXCDSAUUSBARN-OAHLLOKOSA-N	0	3	328.441	3.124	20	30		EGEDHN
COc1ccc(CNCCC(=O)OC(C)(C)C)cc1OCCCC#N	ZINC000266180743	455425122	/nfs/dbraw/zinc/42/51/22/455425122.db2.gz	VAVSKCRYXGODBM-UHFFFAOYSA-N	0	3	348.443	3.199	20	30		EGEDHN
CN(CCCNC(=O)Nc1ccc(CC#N)cc1)Cc1ccccc1	ZINC000078323260	454231959	/nfs/dbraw/zinc/23/19/59/454231959.db2.gz	JSMLELJIQZZYOB-UHFFFAOYSA-N	0	3	336.439	3.396	20	30		EGEDHN
COc1cccc(OC)c1OC1CCN(CCC(C)(C)C#N)CC1	ZINC000131308888	454245390	/nfs/dbraw/zinc/24/53/90/454245390.db2.gz	KREBZTRVECGIIU-UHFFFAOYSA-N	0	3	332.444	3.487	20	30		EGEDHN
C=CCNC(=O)[C@H](C)N[C@@H](C)c1ccc(OCc2cccnc2)cc1	ZINC000120089925	454257003	/nfs/dbraw/zinc/25/70/03/454257003.db2.gz	DDQCMPJXOJZOPC-HOTGVXAUSA-N	0	3	339.439	3.002	20	30		EGEDHN
CC[C@@H](NCCOc1ccc(C#N)cc1)c1ccc2c(c1)OCCO2	ZINC000090107206	454279590	/nfs/dbraw/zinc/27/95/90/454279590.db2.gz	PBOUETHIDMUKLJ-GOSISDBHSA-N	0	3	338.407	3.449	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@H](C)N2CCC[C@H](C)C2)cc1OC	ZINC000046954365	454307339	/nfs/dbraw/zinc/30/73/39/454307339.db2.gz	YGBSIKZHVPWVHN-HOTGVXAUSA-N	0	3	346.471	3.110	20	30		EGEDHN
C=C(C)COc1cc(CNCc2ccc(C(N)=O)cc2)ccc1OC	ZINC000060926944	454320155	/nfs/dbraw/zinc/32/01/55/454320155.db2.gz	MJYPGKBKNYSSGI-UHFFFAOYSA-N	0	3	340.423	3.039	20	30		EGEDHN
N#CC1(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)CCCCC1	ZINC000062229493	454371216	/nfs/dbraw/zinc/37/12/16/454371216.db2.gz	DZOXLOZKPLQCKM-LJQANCHMSA-N	0	3	339.483	3.489	20	30		EGEDHN
CCN1CCCC[C@@H]1CNC(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000132848384	454371493	/nfs/dbraw/zinc/37/14/93/454371493.db2.gz	QOKANUOJMHMZIJ-MSOLQXFVSA-N	0	3	328.460	3.205	20	30		EGEDHN
C=CCN(CCC(=O)Nc1ccc(C#N)cc1)Cc1cccc(C#N)c1	ZINC000063300910	454403933	/nfs/dbraw/zinc/40/39/33/454403933.db2.gz	NUXUFIAQIVXGIY-UHFFFAOYSA-N	0	3	344.418	3.447	20	30		EGEDHN
CC(C)(C)N1CCCN(C(=O)CSCc2ccc(C#N)cc2)CC1	ZINC000063722476	454441035	/nfs/dbraw/zinc/44/10/35/454441035.db2.gz	QDTALJNCTPHKID-UHFFFAOYSA-N	0	3	345.512	3.124	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cccc(C3SCCS3)c2)CC1	ZINC000098092902	454453597	/nfs/dbraw/zinc/45/35/97/454453597.db2.gz	DDSAKUUOGQQAKK-UHFFFAOYSA-N	0	3	346.521	3.449	20	30		EGEDHN
COCc1ccc(CN2CCCN(c3ccccc3C#N)CC2)cc1	ZINC000091792376	454471764	/nfs/dbraw/zinc/47/17/64/454471764.db2.gz	IYGXIDYDICRGHE-UHFFFAOYSA-N	0	3	335.451	3.417	20	30		EGEDHN
CCC[C@H]1CN(CC#Cc2cccc(Cl)c2)CCN1CCOC	ZINC000121820992	454481151	/nfs/dbraw/zinc/48/11/51/454481151.db2.gz	QFCPLWSDDAHZHT-IBGZPJMESA-N	0	3	334.891	3.124	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCc3c(F)cc(F)cc3C2)CC1	ZINC000121880213	454488742	/nfs/dbraw/zinc/48/87/42/454488742.db2.gz	VWVDRBNJAHZPBU-UHFFFAOYSA-N	0	3	349.425	3.073	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)C[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000102401461	454502833	/nfs/dbraw/zinc/50/28/33/454502833.db2.gz	MZUCKFFHRHGRJA-SMDDNHRTSA-N	0	3	340.345	3.432	20	30		EGEDHN
Cc1[nH]c2ccc(C(=O)C(C#N)C(=O)Nc3ccccn3)cc2c1C	ZINC000102387426	454503270	/nfs/dbraw/zinc/50/32/70/454503270.db2.gz	RPEYGNDPKUUIFG-HNNXBMFYSA-N	0	3	332.363	3.141	20	30		EGEDHN
C#CCOc1ccc(CN2CCC(C(=O)N(C)CCCC)CC2)cc1	ZINC000092145769	454529029	/nfs/dbraw/zinc/52/90/29/454529029.db2.gz	RBLZUDQCVMDZBS-UHFFFAOYSA-N	0	3	342.483	3.169	20	30		EGEDHN
CC[C@@H](c1ccncc1)N(C)CCC(=O)Nc1sccc1C#N	ZINC000092224879	454539364	/nfs/dbraw/zinc/53/93/64/454539364.db2.gz	XYMBMQVHNGJLCW-HNNXBMFYSA-N	0	3	328.441	3.426	20	30		EGEDHN
C=CCOCCCC(=O)N(C)C1CCN(Cc2ccccc2)CC1	ZINC000080280594	454560773	/nfs/dbraw/zinc/56/07/73/454560773.db2.gz	DTGBIVHABXXBBQ-UHFFFAOYSA-N	0	3	330.472	3.092	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)CCc2c(C)noc2C)cc1	ZINC000103504566	454561299	/nfs/dbraw/zinc/56/12/99/454561299.db2.gz	DYGWVWCYMDBCGG-KRWDZBQOSA-N	0	3	339.395	3.134	20	30		EGEDHN
C=CCOCCCC(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000074448200	454583384	/nfs/dbraw/zinc/58/33/84/454583384.db2.gz	XXDOOAWKNFNJGF-IBGZPJMESA-N	0	3	330.472	3.092	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H](C)c2ccc(-c3ccncc3)cc2)CC1	ZINC000080462040	454584695	/nfs/dbraw/zinc/58/46/95/454584695.db2.gz	DEXYPLDGZXIWNB-KRWDZBQOSA-N	0	3	347.462	3.271	20	30		EGEDHN
COCCN(Cc1ccc(C#N)cc1)Cc1cccc(-n2cccn2)c1	ZINC000092567635	454587098	/nfs/dbraw/zinc/58/70/98/454587098.db2.gz	JTEGODABOBDPHV-UHFFFAOYSA-N	0	3	346.434	3.393	20	30		EGEDHN
O=C(C#Cc1ccccc1)NC[C@@H]1CCCN(Cc2cccs2)C1	ZINC000080610737	454606337	/nfs/dbraw/zinc/60/63/37/454606337.db2.gz	CWEGSGWHFKKVHE-SFHVURJKSA-N	0	3	338.476	3.128	20	30		EGEDHN
CCC[C@H](C)NC(=O)[C@H]1CCCN(Cc2ccc(OC)c(C#N)c2)C1	ZINC000135013719	454624713	/nfs/dbraw/zinc/62/47/13/454624713.db2.gz	HSUANRCILBDRGB-RDJZCZTQSA-N	0	3	343.471	3.084	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)C=C(C1CC1)C1CC1	ZINC000065930297	454640878	/nfs/dbraw/zinc/64/08/78/454640878.db2.gz	BZSNUYPIMXFXBZ-UHFFFAOYSA-N	0	3	337.467	3.195	20	30		EGEDHN
CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1sccc1C#N	ZINC000052050569	454651457	/nfs/dbraw/zinc/65/14/57/454651457.db2.gz	QVZDFSHUEBSPDT-UHFFFAOYSA-N	0	3	347.871	3.477	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2sc(CC(C)C)nc2C)CC1	ZINC000106034603	454674665	/nfs/dbraw/zinc/67/46/65/454674665.db2.gz	WTLPCDPWVJVPJI-UHFFFAOYSA-N	0	3	335.517	3.420	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C[C@H](C)c2ccccc2OC)CC1	ZINC000106034384	454674832	/nfs/dbraw/zinc/67/48/32/454674832.db2.gz	WDWONOFDYZQPDF-INIZCTEOSA-N	0	3	330.472	3.346	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](C)c2ccc(F)cc2F)CC1	ZINC000106327299	454691096	/nfs/dbraw/zinc/69/10/96/454691096.db2.gz	HPQSTBGMINLQPQ-ZDUSSCGKSA-N	0	3	337.414	3.366	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC(C)(C)c2ccccc2OC)CC1	ZINC000106338810	454691759	/nfs/dbraw/zinc/69/17/59/454691759.db2.gz	BKIGHRRNRGLCKE-UHFFFAOYSA-N	0	3	345.487	3.270	20	30		EGEDHN
C[C@H](NC(=O)N(CCN(C)C)C1CCCC1)c1ccc(C#N)cc1	ZINC000152794533	454726324	/nfs/dbraw/zinc/72/63/24/454726324.db2.gz	NBRVUNILTMRPCA-HNNXBMFYSA-N	0	3	328.460	3.135	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cnn(C(C)C)c2C2CC2)CC1	ZINC000152854197	454733247	/nfs/dbraw/zinc/73/32/47/454733247.db2.gz	LWIVDEZOXHIDDX-UHFFFAOYSA-N	0	3	330.476	3.112	20	30		EGEDHN
C[C@@H]1CN(Cc2cccc(CNCc3ccc(C#N)s3)c2)CCO1	ZINC000176955303	454803267	/nfs/dbraw/zinc/80/32/67/454803267.db2.gz	UXOHLTWRSMVQDD-OAHLLOKOSA-N	0	3	341.480	3.130	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1	ZINC000162974407	454814331	/nfs/dbraw/zinc/81/43/31/454814331.db2.gz	UKJKMQYMNFOLSP-KRWDZBQOSA-N	0	3	345.487	3.137	20	30		EGEDHN
CN(CCn1cccn1)Cc1cccc(OCc2ccccc2C#N)c1	ZINC000125318420	454814557	/nfs/dbraw/zinc/81/45/57/454814557.db2.gz	VIHTZYUQCVEIKR-UHFFFAOYSA-N	0	3	346.434	3.466	20	30		EGEDHN
C[C@H](N[C@@H](C)[C@@H](C)c1ccccc1)C(=O)NC1(C#N)CCCCC1	ZINC000177481749	454868986	/nfs/dbraw/zinc/86/89/86/454868986.db2.gz	VASGPOWVADEIQG-IKGGRYGDSA-N	0	3	327.472	3.499	20	30		EGEDHN
N#CC1(NC(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)CCCCC1	ZINC000126507590	454898769	/nfs/dbraw/zinc/89/87/69/454898769.db2.gz	XSMBSQQKIBMACP-QGZVFWFLSA-N	0	3	343.446	3.380	20	30		EGEDHN
N#Cc1cc(NCCCN2CCc3ccccc3C2)ccc1[N+](=O)[O-]	ZINC000165587376	454901463	/nfs/dbraw/zinc/90/14/63/454901463.db2.gz	KDHROJQDOQAMPZ-UHFFFAOYSA-N	0	3	336.395	3.327	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2F)CC1	ZINC000112905831	454905570	/nfs/dbraw/zinc/90/55/70/454905570.db2.gz	HFUDPFBOIFDQKB-DLBZAZTESA-N	0	3	334.410	3.225	20	30		EGEDHN
C#CCN1CCC(C(=O)NCc2ccc(C)cc2O[C@@H](C)CC)CC1	ZINC000151022995	454927307	/nfs/dbraw/zinc/92/73/07/454927307.db2.gz	SRSCXPVDXLZYSO-KRWDZBQOSA-N	0	3	342.483	3.134	20	30		EGEDHN
COc1cc(N[C@@H]2CCCN(CCCSCC#N)C2)cc(OC)c1	ZINC000155105851	454964159	/nfs/dbraw/zinc/96/41/59/454964159.db2.gz	PUSOZFICJRCBQI-OAHLLOKOSA-N	0	3	349.500	3.227	20	30		EGEDHN
N#Cc1cccc(NC(=O)NC[C@@H]2CCCN2Cc2ccccc2)c1	ZINC000114778772	454977887	/nfs/dbraw/zinc/97/78/87/454977887.db2.gz	VFFOKDVPRXUPBH-IBGZPJMESA-N	0	3	334.423	3.344	20	30		EGEDHN
N#Cc1ccc(CN(C[C@H](O)c2cccc([N+](=O)[O-])c2)C2CC2)cc1	ZINC000178857983	454984830	/nfs/dbraw/zinc/98/48/30/454984830.db2.gz	WIXOLPLIRNUBIF-IBGZPJMESA-N	0	3	337.379	3.164	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H](c2ccccc2Cl)C(C)C)CC1	ZINC000115097744	454997031	/nfs/dbraw/zinc/99/70/31/454997031.db2.gz	KNJKCRRQXAGGIB-GOSISDBHSA-N	0	3	332.875	3.499	20	30		EGEDHN
CN(C)[C@@]1(CNC(=O)Nc2ccc(C(C)(C)C#N)cc2)CCSC1	ZINC000267117015	455504009	/nfs/dbraw/zinc/50/40/09/455504009.db2.gz	AEEZWLZDDILNNN-GOSISDBHSA-N	0	3	346.500	3.047	20	30		EGEDHN
COc1ccc(CN2CCC[C@H](C(=O)Nc3ccccc3)C2)cc1C#N	ZINC000179189375	455018176	/nfs/dbraw/zinc/01/81/76/455018176.db2.gz	BDXISWQLKLRKAT-KRWDZBQOSA-N	0	3	349.434	3.418	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)CN1CCCCC1	ZINC000171039073	455019142	/nfs/dbraw/zinc/01/91/42/455019142.db2.gz	AKWMGARLLVNQCL-KRWDZBQOSA-N	0	3	342.487	3.353	20	30		EGEDHN
CC(C)c1ccc(CCCN[C@@H](C(N)=O)c2ccc(C#N)cc2)cc1	ZINC000116907638	455075565	/nfs/dbraw/zinc/07/55/65/455075565.db2.gz	QUDOGPCZFPSQPD-HXUWFJFHSA-N	0	3	335.451	3.430	20	30		EGEDHN
N#Cc1csc(CNCCOc2ccc(C(F)(F)F)cn2)c1	ZINC000152210554	455087728	/nfs/dbraw/zinc/08/77/28/455087728.db2.gz	PVHFFFDZQIRPLL-UHFFFAOYSA-N	0	3	327.331	3.202	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](C)COc2c(C)cccc2C)CC1	ZINC000171724356	455089366	/nfs/dbraw/zinc/08/93/66/455089366.db2.gz	ZWWMVIZVITWUMI-KRWDZBQOSA-N	0	3	345.487	3.020	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)[C@@H](C)c1c(C)noc1C)C(C)C	ZINC000156179380	455090055	/nfs/dbraw/zinc/09/00/55/455090055.db2.gz	BWZNQHQWAYVQPB-WMLDXEAASA-N	0	3	333.476	3.210	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@@H]2c2ccccc2OC)CC1	ZINC000171737225	455090524	/nfs/dbraw/zinc/09/05/24/455090524.db2.gz	LPBRTPOUIRIEHO-GOSISDBHSA-N	0	3	343.471	3.192	20	30		EGEDHN
CCCOc1ccc(C[NH2+]Cc2ccc(OCC#N)cc2)c([O-])c1	ZINC000171769153	455093182	/nfs/dbraw/zinc/09/31/82/455093182.db2.gz	UYHPTBRNZLNGKB-UHFFFAOYSA-N	0	3	326.396	3.373	20	30		EGEDHN
C=C(C)COCCNCc1cc(Br)cc2c1OCC2	ZINC000156243809	455097135	/nfs/dbraw/zinc/09/71/35/455097135.db2.gz	FTHUHOKCFGTPLC-UHFFFAOYSA-N	0	3	326.234	3.066	20	30		EGEDHN
C[C@@H](N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O)c1cccs1	ZINC000179963832	455107574	/nfs/dbraw/zinc/10/75/74/455107574.db2.gz	OBZVVLQSVQTGIZ-CZUORRHYSA-N	0	3	325.437	3.466	20	30		EGEDHN
N#Cc1ccc(NCC2CCN(c3ccncc3)CC2)c([N+](=O)[O-])c1	ZINC000180041783	455121086	/nfs/dbraw/zinc/12/10/86/455121086.db2.gz	DYTIHQSFHBEKAC-UHFFFAOYSA-N	0	3	337.383	3.190	20	30		EGEDHN
C[C@@H]1CN(CCC2CCN(Cc3ccc(C#N)s3)CC2)C[C@H](C)O1	ZINC000180181772	455145464	/nfs/dbraw/zinc/14/54/64/455145464.db2.gz	MQFFYRDAEGWJDQ-IYBDPMFKSA-N	0	3	347.528	3.331	20	30		EGEDHN
CN(CCc1nccs1)Cc1cn(C)nc1-c1ccc(C#N)cc1	ZINC000180243994	455151279	/nfs/dbraw/zinc/15/12/79/455151279.db2.gz	DNXQDLOZDYNSLK-UHFFFAOYSA-N	0	3	337.452	3.090	20	30		EGEDHN
CC[C@@H]1CN([C@H](C)C(=O)N(C)CCC#N)CC[C@@H]1c1ccccc1	ZINC000245411581	455290202	/nfs/dbraw/zinc/29/02/02/455290202.db2.gz	XNPINOIYKCZAAH-LMMKCTJWSA-N	0	3	327.472	3.263	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccsc1	ZINC000157293936	455181344	/nfs/dbraw/zinc/18/13/44/455181344.db2.gz	VVTGIALFHRQMEU-UHFFFAOYSA-N	0	3	328.441	3.215	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)NCCCCC#N)c1cccc(OC)c1	ZINC000264111920	455191137	/nfs/dbraw/zinc/19/11/37/455191137.db2.gz	KMLYZUHFRGXUNB-GOSISDBHSA-N	0	3	346.475	3.071	20	30		EGEDHN
CCN(Cc1ccc(OCC#N)cc1)C[C@H]1COc2ccccc2O1	ZINC000264172174	455193812	/nfs/dbraw/zinc/19/38/12/455193812.db2.gz	VUKWTHYAYIYILN-SFHVURJKSA-N	0	3	338.407	3.251	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)Cc2ccc(Cl)s2)CC1	ZINC000264399612	455205717	/nfs/dbraw/zinc/20/57/17/455205717.db2.gz	ZCAWRELPCKJPRP-UHFFFAOYSA-N	0	3	327.881	3.193	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccccc2N2CCCC2)CC1	ZINC000264412669	455208074	/nfs/dbraw/zinc/20/80/74/455208074.db2.gz	RGBCCYMLCBDHGZ-UHFFFAOYSA-N	0	3	342.487	3.449	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CCC[C@H]1c1ccncc1	ZINC000245565149	455331332	/nfs/dbraw/zinc/33/13/32/455331332.db2.gz	DPMFLFMOAOEKRO-PMACEKPBSA-N	0	3	338.451	3.387	20	30		EGEDHN
Cc1ccc([C@H](C)[NH2+][C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)c([O-])c1	ZINC000190605403	455352130	/nfs/dbraw/zinc/35/21/30/455352130.db2.gz	MEYCQKJYDVGJOW-HNAYVOBHSA-N	0	3	349.434	3.024	20	30		EGEDHN
CC(C)(C)OC(=O)CCCN1CCCN(c2ccccc2C#N)CC1	ZINC000181548727	455353391	/nfs/dbraw/zinc/35/33/91/455353391.db2.gz	JVQVBXCEOBRKRV-UHFFFAOYSA-N	0	3	343.471	3.192	20	30		EGEDHN
N#CCOc1ccc(CN2CCC[C@H](c3nnc4ccccn43)C2)cc1	ZINC000265639140	455353859	/nfs/dbraw/zinc/35/38/59/455353859.db2.gz	JCMQNDQVFZBJKK-KRWDZBQOSA-N	0	3	347.422	3.011	20	30		EGEDHN
COc1ccc(CNC[C@H](O)c2ccc(C)o2)cc1OCCCC#N	ZINC000265943255	455412268	/nfs/dbraw/zinc/41/22/68/455412268.db2.gz	GBYNYLYXYUSXLK-INIZCTEOSA-N	0	3	344.411	3.102	20	30		EGEDHN
C=CCN(CCOC)CCC(=O)Nc1c(Cl)cccc1Cl	ZINC000191129662	455448408	/nfs/dbraw/zinc/44/84/08/455448408.db2.gz	WSNDVOUTGXXGAK-UHFFFAOYSA-N	0	3	331.243	3.456	20	30		EGEDHN
CN(Cc1ccco1)Cc1ccccc1CNCc1cc(C#N)n(C)c1	ZINC000191188014	455460990	/nfs/dbraw/zinc/46/09/90/455460990.db2.gz	SWUJLTMUDUDGND-UHFFFAOYSA-N	0	3	348.450	3.412	20	30		EGEDHN
CC[C@H](NCC#Cc1ccc(OC(F)(F)F)cc1)[C@H]1CCCO1	ZINC000182371244	455499913	/nfs/dbraw/zinc/49/99/13/455499913.db2.gz	ZJPDSGSNOZCEIB-JKSUJKDBSA-N	0	3	327.346	3.484	20	30		EGEDHN
C=CCSCCNC(=O)N(Cc1ccccc1)C1CCN(C)CC1	ZINC000176026599	455529963	/nfs/dbraw/zinc/52/99/63/455529963.db2.gz	XDGHMFAQIGJXAF-UHFFFAOYSA-N	0	3	347.528	3.212	20	30		EGEDHN
CC[C@H](NCCC(=O)Nc1cccc(C#N)c1)c1c(C)noc1C	ZINC000182514495	455530291	/nfs/dbraw/zinc/53/02/91/455530291.db2.gz	MNFKWNWJSLARHD-INIZCTEOSA-N	0	3	326.400	3.233	20	30		EGEDHN
C=CCCCCCN(C)C(=O)C(=O)Nc1cc(CN(C)C)ccc1C	ZINC000176090961	455538244	/nfs/dbraw/zinc/53/82/44/455538244.db2.gz	XLHTUALVHRRICZ-UHFFFAOYSA-N	0	3	345.487	3.200	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)Cc2ccc(C#N)cc2)CCN1Cc1ccccc1	ZINC000176105231	455540382	/nfs/dbraw/zinc/54/03/82/455540382.db2.gz	HSWWEPMERFFFIR-DYESRHJHSA-N	0	3	347.462	3.270	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)Cc1ccc(C#N)cc1	ZINC000267342877	455542232	/nfs/dbraw/zinc/54/22/32/455542232.db2.gz	BWXUKFAEPXGSNP-UTKZUKDTSA-N	0	3	347.462	3.128	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC2(Cc3ccccc3)CC2)CC1	ZINC000185384167	455552394	/nfs/dbraw/zinc/55/23/94/455552394.db2.gz	WWAVGPFTLUTXBQ-UHFFFAOYSA-N	0	3	327.472	3.101	20	30		EGEDHN
C=CCc1cc(CNCc2ccccc2N(C)C)cc(OC)c1O	ZINC000267867030	455558599	/nfs/dbraw/zinc/55/85/99/455558599.db2.gz	IXDFDZKHMQOLNZ-UHFFFAOYSA-N	0	3	326.440	3.485	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](C)CSc2ccc(C)cc2)CC1	ZINC000185735090	455610129	/nfs/dbraw/zinc/61/01/29/455610129.db2.gz	OWGWXALSRGIFHZ-INIZCTEOSA-N	0	3	347.528	3.425	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1	ZINC000185789443	455623418	/nfs/dbraw/zinc/62/34/18/455623418.db2.gz	YTCQFXHLXZYVJG-RCCFBDPRSA-N	0	3	336.520	3.327	20	30		EGEDHN
C=C(C)[C@@H](NC(=O)N1CCC[C@H](N(C)C)C1)c1ccc(F)c(F)c1	ZINC000185836819	455632748	/nfs/dbraw/zinc/63/27/48/455632748.db2.gz	YDAYZWCHJPLEEQ-WMLDXEAASA-N	0	3	337.414	3.318	20	30		EGEDHN
N#C[C@H]1CCC[C@H](N[C@H]2CCN(c3ccc(F)c(Cl)c3)C2=O)C1	ZINC000185879777	455641709	/nfs/dbraw/zinc/64/17/09/455641709.db2.gz	XIFJLEHDFIBMFW-MKBNYLNASA-N	0	3	335.810	3.256	20	30		EGEDHN
N#CCOc1ccc(CN2CCC[C@@H]2C[C@H](O)c2ccco2)cc1	ZINC000268310505	455647146	/nfs/dbraw/zinc/64/71/46/455647146.db2.gz	XLTZMCQWYKLCMU-AEFFLSMTSA-N	0	3	326.396	3.270	20	30		EGEDHN
C[C@@H](NCC(=O)N[C@@](C)(C#N)C1CC1)C1(c2ccccc2)CCCC1	ZINC000185953814	455661111	/nfs/dbraw/zinc/66/11/11/455661111.db2.gz	WJGAOMVXHBTHLP-UZLBHIALSA-N	0	3	339.483	3.285	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCC2(Cc3ccc(F)cc3)CC2)CC1	ZINC000271517112	455668752	/nfs/dbraw/zinc/66/87/52/455668752.db2.gz	QASPZUSMGCSAJG-UHFFFAOYSA-N	0	3	345.462	3.098	20	30		EGEDHN
C#CC[C@@H](N[C@@H](C)c1ccc(S(=O)(=O)NC)cc1)c1ccccc1	ZINC000271593411	455695067	/nfs/dbraw/zinc/69/50/67/455695067.db2.gz	YOUWSBRXSWERJY-HNAYVOBHSA-N	0	3	342.464	3.010	20	30		EGEDHN
CN(C(=O)/C=C/c1cccc(C#N)c1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000268514935	455703356	/nfs/dbraw/zinc/70/33/56/455703356.db2.gz	FBUGPVACVUXVOT-RQWLHQTBSA-N	0	3	345.446	3.304	20	30		EGEDHN
C[C@@H]1CN(CC(=O)N(CCC#N)c2ccccc2)[C@@H]2CCCC[C@@H]21	ZINC000248432227	455714655	/nfs/dbraw/zinc/71/46/55/455714655.db2.gz	QGNFIPSTDRKGFB-BHIYHBOVSA-N	0	3	325.456	3.444	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)CN1CCC[C@]1(C)Cc1ccccc1	ZINC000248623883	455723507	/nfs/dbraw/zinc/72/35/07/455723507.db2.gz	OFSWKEXLMWKOJD-WOJBJXKFSA-N	0	3	327.472	3.138	20	30		EGEDHN
C[C@@H](NCCOc1ccccc1C#N)c1ccc([S@@](C)=O)cc1	ZINC000271719301	455733303	/nfs/dbraw/zinc/73/33/03/455733303.db2.gz	CUSHAYZRTHSPTI-QKFKETGDSA-N	0	3	328.437	3.025	20	30		EGEDHN
C=CCOCCN1CCC(N(CCC)C(=O)c2cccs2)CC1	ZINC000292757005	455748678	/nfs/dbraw/zinc/74/86/78/455748678.db2.gz	IOOSSXRCOAVUKB-UHFFFAOYSA-N	0	3	336.501	3.267	20	30		EGEDHN
COC(=O)N1CCC([C@H](C)NCC#Cc2ccc(Cl)cc2)CC1	ZINC000186387432	455759012	/nfs/dbraw/zinc/75/90/12/455759012.db2.gz	KKGGHALCFZDXSW-AWEZNQCLSA-N	0	3	334.847	3.148	20	30		EGEDHN
[O-]c1ccc2ccccc2c1/C=N/C1CC[NH+]([C@H]2CCC[C@H]2O)CC1	ZINC000269035733	455769999	/nfs/dbraw/zinc/76/99/99/455769999.db2.gz	OJAOWAFMOMOJLR-NZLUSWSZSA-N	0	3	338.451	3.342	20	30		EGEDHN
C=CCN1CCC(NC(=O)Cc2c[nH]c3cccc(Cl)c23)CC1	ZINC000293075903	455773357	/nfs/dbraw/zinc/77/33/57/455773357.db2.gz	MROMMOVCOQBGMX-UHFFFAOYSA-N	0	3	331.847	3.130	20	30		EGEDHN
CCc1ccc([C@H](C#N)NC(=O)C2C[C@H](c3ccccc3)OC2=O)cc1	ZINC000293406841	455785417	/nfs/dbraw/zinc/78/54/17/455785417.db2.gz	MXTVJJJLBNCIRN-GBESFXJTSA-N	0	3	348.402	3.234	20	30		EGEDHN
CCc1ccc([C@H](C#N)NC(=O)C2C[C@@H](c3ccccc3)OC2=O)cc1	ZINC000293406846	455786048	/nfs/dbraw/zinc/78/60/48/455786048.db2.gz	MXTVJJJLBNCIRN-QYZOEREBSA-N	0	3	348.402	3.234	20	30		EGEDHN
C[C@@H](C#N)CN(C)C(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000269141539	455797902	/nfs/dbraw/zinc/79/79/02/455797902.db2.gz	OGKDFKKBDOHKEW-INIZCTEOSA-N	0	3	344.459	3.175	20	30		EGEDHN
CCc1cc[n+](C(C(=O)c2nccs2)C(=S)[N-][C@H](C)CC)cc1	ZINC000278285010	455806411	/nfs/dbraw/zinc/80/64/11/455806411.db2.gz	QFKAQQPBINOXMF-GFCCVEGCSA-O	0	3	348.517	3.320	20	30		EGEDHN
C[C@@H](NCc1cccc(OCC[NH+](C)C)c1)c1ccc(C#N)c(F)c1	ZINC000271975687	455809464	/nfs/dbraw/zinc/80/94/64/455809464.db2.gz	XQPUHESQCNXUME-OAHLLOKOSA-N	0	3	341.430	3.489	20	30		EGEDHN
C[C@@H](NCc1cccc(OCCN(C)C)c1)c1ccc(C#N)c(F)c1	ZINC000271975687	455809469	/nfs/dbraw/zinc/80/94/69/455809469.db2.gz	XQPUHESQCNXUME-OAHLLOKOSA-N	0	3	341.430	3.489	20	30		EGEDHN
CN(C)[C@@H](CNc1nccc(C#N)n1)c1cccc(C(F)(F)F)c1	ZINC000294844824	455829491	/nfs/dbraw/zinc/82/94/91/455829491.db2.gz	BTMBQRWEWHYAMU-AWEZNQCLSA-N	0	3	335.333	3.082	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N(CC(C)C)C2CCN(C)CC2)cc1	ZINC000294970472	455834629	/nfs/dbraw/zinc/83/46/29/455834629.db2.gz	QOTXEHKHAHBANJ-UHFFFAOYSA-N	0	3	342.483	3.281	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CN(Cc2ccccc2)CCCO1	ZINC000278745908	455846920	/nfs/dbraw/zinc/84/69/20/455846920.db2.gz	WRRBFNZUJSOSKH-JOCHJYFZSA-N	0	3	349.478	3.281	20	30		EGEDHN
CC[C@@H](N[C@@H]1CCN(c2ccccc2OC)C1=O)c1ccc(C#N)cc1	ZINC000278891936	455851660	/nfs/dbraw/zinc/85/16/60/455851660.db2.gz	YRIHGNDSSWLYFT-QZTJIDSGSA-N	0	3	349.434	3.413	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H]2CCC(=O)N[C@H]2C(C)(C)C)cc1OC	ZINC000285488719	455856212	/nfs/dbraw/zinc/85/62/12/455856212.db2.gz	MDEYPWHHPADXIN-DNVCBOLYSA-N	0	3	346.471	3.043	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1C(=O)NC[C@@H](c1ccsc1)N(CC)CC	ZINC000279566596	455867936	/nfs/dbraw/zinc/86/79/36/455867936.db2.gz	SJMRJXLFEQJCEC-IXDOHACOSA-N	0	3	336.501	3.228	20	30		EGEDHN
COc1cccc([C@@H](C)NC(=O)C(C#N)Cc2ccc(C#N)cc2)c1	ZINC000279748730	455872648	/nfs/dbraw/zinc/87/26/48/455872648.db2.gz	QBQXNHVZKIVGCC-RDTXWAMCSA-N	0	3	333.391	3.127	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)/C=C\c2ccc(F)c(OC)c2)CC1	ZINC000255895604	455875386	/nfs/dbraw/zinc/87/53/86/455875386.db2.gz	ISAWKBHISUDYOW-ALCCZGGFSA-N	0	3	332.419	3.004	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)Cc2ccc(C#N)cc2)N(C)C)cc1	ZINC000194839971	455889069	/nfs/dbraw/zinc/88/90/69/455889069.db2.gz	FFKCWRXIHMKVJQ-HXUWFJFHSA-N	0	3	335.451	3.082	20	30		EGEDHN
C[C@H](CN[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O)c1ccccc1	ZINC000194891914	455896968	/nfs/dbraw/zinc/89/69/68/455896968.db2.gz	NLWLKNMEXQZXKE-OXQOHEQNSA-N	0	3	333.435	3.052	20	30		EGEDHN
C=CCC[C@H](NCc1ccc(N2CCN(C)CC2)nc1)c1ccco1	ZINC000285834948	455925521	/nfs/dbraw/zinc/92/55/21/455925521.db2.gz	XBSQKTYIDKDYFX-SFHVURJKSA-N	0	3	340.471	3.224	20	30		EGEDHN
N#CCc1ccc(C(=O)NC[C@H]2CCCN2Cc2ccccc2)cc1	ZINC000270364550	455939283	/nfs/dbraw/zinc/93/92/83/455939283.db2.gz	ZZELIEIOEYLESZ-HXUWFJFHSA-N	0	3	333.435	3.147	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N1CCC[C@H](CNC(=O)C(C)(C)C)C1	ZINC000187687466	455939935	/nfs/dbraw/zinc/93/99/35/455939935.db2.gz	RIZUFLNELOWTNA-DOTOQJQBSA-N	0	3	327.472	3.494	20	30		EGEDHN
C=C[C@H](CC(=O)NCCCCN1C[C@@H](C)O[C@@H](C)C1)c1ccccc1	ZINC000270379744	455943085	/nfs/dbraw/zinc/94/30/85/455943085.db2.gz	PBWSTGPSTPFZTE-CEXWTWQISA-N	0	3	344.499	3.352	20	30		EGEDHN
C=C[C@H](CC(=O)NCCCCN1C[C@H](C)O[C@@H](C)C1)c1ccccc1	ZINC000270379746	455943332	/nfs/dbraw/zinc/94/33/32/455943332.db2.gz	PBWSTGPSTPFZTE-GBESFXJTSA-N	0	3	344.499	3.352	20	30		EGEDHN
CCN(C(=O)C1CCN(C2CC2)CC1)[C@@H](C)c1ccc(C#N)cc1	ZINC000195341645	455945998	/nfs/dbraw/zinc/94/59/98/455945998.db2.gz	AHATVBZLBGJJQB-HNNXBMFYSA-N	0	3	325.456	3.342	20	30		EGEDHN
CC(C)(CNC(=O)C(C#N)Cc1ccc(C#N)cc1)c1cccc(F)c1	ZINC000280397013	455963085	/nfs/dbraw/zinc/96/30/85/455963085.db2.gz	KQJCMGAWDPXZPE-KRWDZBQOSA-N	0	3	349.409	3.474	20	30		EGEDHN
CCOC[C@H](N[C@@H](C)C(=O)N(CCC#N)c1ccc(F)cc1)C(C)C	ZINC000286072933	455972689	/nfs/dbraw/zinc/97/26/89/455972689.db2.gz	JQXDBMIEEQLMBJ-YJBOKZPZSA-N	0	3	349.450	3.112	20	30		EGEDHN
C[C@@H](CCc1ccco1)N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000272534758	455986233	/nfs/dbraw/zinc/98/62/33/455986233.db2.gz	JUJHXBIRBCDNOC-HNAYVOBHSA-N	0	3	337.423	3.258	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)N(Cc1ccccc1)C1CCN(C)CC1	ZINC000280533792	455992698	/nfs/dbraw/zinc/99/26/98/455992698.db2.gz	CCSZTQRXZQDPFB-UHFFFAOYSA-N	0	3	337.423	3.196	20	30		EGEDHN
CC(C)(C#N)CC(=O)N1CC[C@]2(CCN(Cc3ccccc3)C2)C1	ZINC000286182589	455995662	/nfs/dbraw/zinc/99/56/62/455995662.db2.gz	JVKQEUWJHHCFEC-FQEVSTJZSA-N	0	3	325.456	3.051	20	30		EGEDHN
N#Cc1ccc(/C=C\C(=O)NC2CCN(Cc3ccccc3)CC2)cc1	ZINC000213092727	456023261	/nfs/dbraw/zinc/02/32/61/456023261.db2.gz	XEVYHTYETFHDTB-KHPPLWFESA-N	0	3	345.446	3.352	20	30		EGEDHN
C#CCCN[C@@H](CO)c1ccc(Br)cc1C(F)(F)F	ZINC000280696765	456033299	/nfs/dbraw/zinc/03/32/99/456033299.db2.gz	IBLJQVFUKKMJEO-LBPRGKRZSA-N	0	3	336.151	3.114	20	30		EGEDHN
C=CCC[C@@H](O)CN[C@@H](CO)c1ccc(Cl)cc1C(F)(F)F	ZINC000280732911	456041512	/nfs/dbraw/zinc/04/15/12/456041512.db2.gz	LKDIKKULYFNPAS-RISCZKNCSA-N	0	3	337.769	3.309	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CC[C@@H](C(F)(F)F)[C@@H](CO)C1	ZINC000286549088	456049685	/nfs/dbraw/zinc/04/96/85/456049685.db2.gz	ONPJYQWQPDZRLW-GDBMZVCRSA-N	0	3	340.389	3.480	20	30		EGEDHN
C=C(Cl)CNC(=O)N1CC[C@]2(CCN(Cc3ccccc3)C2)C1	ZINC000287368231	456067579	/nfs/dbraw/zinc/06/75/79/456067579.db2.gz	IQHDIQLIRVZDPC-SFHVURJKSA-N	0	3	333.863	3.047	20	30		EGEDHN
COC[C@@H](NC[C@@H](O)c1ccc(C#N)cc1)c1cccc(Cl)c1	ZINC000288819418	456105822	/nfs/dbraw/zinc/10/58/22/456105822.db2.gz	MZSAAEHPXFCELY-QZTJIDSGSA-N	0	3	330.815	3.222	20	30		EGEDHN
CC(C)(C)OC(=O)N1C[C@@H]2CCN(Cc3ccc(C#N)cc3)C[C@@H]2C1	ZINC000289461469	456125235	/nfs/dbraw/zinc/12/52/35/456125235.db2.gz	GNGFWBVESIRDJJ-ZWKOTPCHSA-N	0	3	341.455	3.247	20	30		EGEDHN
CN(C)CCN(Cc1csc([N+](=O)[O-])c1)Cc1ccc(C#N)cc1	ZINC000289856360	456156684	/nfs/dbraw/zinc/15/66/84/456156684.db2.gz	QIPIPLQIPUHMMU-UHFFFAOYSA-N	0	3	344.440	3.092	20	30		EGEDHN
C[C@](C#N)(NC(=O)CN[C@@H]1CC(C)(C)CCc2ccccc21)C1CC1	ZINC000333272925	456190453	/nfs/dbraw/zinc/19/04/53/456190453.db2.gz	HPKBLIFBJRTXRR-WIYYLYMNSA-N	0	3	339.483	3.488	20	30		EGEDHN
Cc1cc(CN(C)C)cc(NC(=O)[C@H](C#N)Cc2ccc(C#N)cc2)c1	ZINC000281367557	456215110	/nfs/dbraw/zinc/21/51/10/456215110.db2.gz	AXQBKQVZGDMIGK-IBGZPJMESA-N	0	3	346.434	3.249	20	30		EGEDHN
CC1CCN([C@@H](CNc2ccc(C#N)nn2)c2cccs2)CC1	ZINC000301919394	456250562	/nfs/dbraw/zinc/25/05/62/456250562.db2.gz	KCWRTJSQZNYQAX-HNNXBMFYSA-N	0	3	327.457	3.295	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(CC#N)cc1	ZINC000274190716	456252540	/nfs/dbraw/zinc/25/25/40/456252540.db2.gz	MDDUVJXIRITEDN-OXJNMPFZSA-N	0	3	333.435	3.003	20	30		EGEDHN
CC(C)OC(=O)C[C@@H]1CCCN(Cc2ccc(OCC#N)cc2)C1	ZINC000274318321	456255504	/nfs/dbraw/zinc/25/55/04/456255504.db2.gz	OEXPYEWLPMVQOD-KRWDZBQOSA-N	0	3	330.428	3.143	20	30		EGEDHN
N#Cc1ccccc1-c1ccc(CN2CC[C@@H]3NC(=O)OC[C@H]3C2)cc1	ZINC000281518861	456256399	/nfs/dbraw/zinc/25/63/99/456256399.db2.gz	ZEKQCURSFFNVBQ-QUCCMNQESA-N	0	3	347.418	3.156	20	30		EGEDHN
C=CCCCCNC(=O)C(=O)Nc1cccc(CN2CCCCC2)c1	ZINC000274554928	456261283	/nfs/dbraw/zinc/26/12/83/456261283.db2.gz	VQEPYCFWLRWKTD-UHFFFAOYSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=CCN(C(=O)Nc1cccc(N2CCN(CC)CC2)c1)C1CC1	ZINC000274850287	456266073	/nfs/dbraw/zinc/26/60/73/456266073.db2.gz	WSIJSFGYJMAKGP-UHFFFAOYSA-N	0	3	328.460	3.011	20	30		EGEDHN
CN(C)CCc1ccccc1NC(=O)NC1(c2cccc(C#N)c2)CC1	ZINC000275688718	456287810	/nfs/dbraw/zinc/28/78/10/456287810.db2.gz	QZXPWBSHOVYWRI-UHFFFAOYSA-N	0	3	348.450	3.473	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NC[C@@H](c1cccs1)N1CCCC1	ZINC000275749778	456304024	/nfs/dbraw/zinc/30/40/24/456304024.db2.gz	SDGYLYVUXRWKLK-YJBOKZPZSA-N	0	3	336.501	3.230	20	30		EGEDHN
COc1cc(CNCCc2nc(C(F)(F)F)cs2)ccc1C#N	ZINC000281816172	456330350	/nfs/dbraw/zinc/33/03/50/456330350.db2.gz	WLCDVMWUGDSLKL-UHFFFAOYSA-N	0	3	341.358	3.374	20	30		EGEDHN
C[C@H](C#N)CSc1ccccc1NC(=O)CN[C@H]1CSC[C@H]1C	ZINC000352817790	456333318	/nfs/dbraw/zinc/33/33/18/456333318.db2.gz	RSIMHWHDXNBWQD-NFAWXSAZSA-N	0	3	349.525	3.218	20	30		EGEDHN
CC(C#N)C(=O)N1CCN(C2c3ccccc3-c3ccccc32)CC1	ZINC000337460812	456355221	/nfs/dbraw/zinc/35/52/21/456355221.db2.gz	KHRBIIHEFZOPNO-OAHLLOKOSA-N	0	3	331.419	3.060	20	30		EGEDHN
COc1ccc(CN(C)CCCC2(C#N)CCOCC2)c(OC)c1	ZINC000281942814	456369746	/nfs/dbraw/zinc/36/97/46/456369746.db2.gz	IZCKCHQRYOBEBS-UHFFFAOYSA-N	0	3	332.444	3.236	20	30		EGEDHN
C=CCOCCCN1CCCN(C(=O)c2ccc(Cl)cc2)CC1	ZINC000347971745	456431384	/nfs/dbraw/zinc/43/13/84/456431384.db2.gz	YDSCIZLPLTVYKP-UHFFFAOYSA-N	0	3	336.863	3.081	20	30		EGEDHN
CC(C)[C@@H]1CN(c2c(C#N)cnc3c(F)c(F)c(F)cc32)CCN1C	ZINC000343229322	456468643	/nfs/dbraw/zinc/46/86/43/456468643.db2.gz	RQLNGPZRIKSWOD-AWEZNQCLSA-N	0	3	348.372	3.300	20	30		EGEDHN
Cc1[nH]nc2ncc(CNCCSCc3ccccc3C#N)cc12	ZINC000340461748	456474139	/nfs/dbraw/zinc/47/41/39/456474139.db2.gz	UCCFPECIJLETQN-UHFFFAOYSA-N	0	3	337.452	3.161	20	30		EGEDHN
C[C@@H](NC(=O)NC[C@H](c1ccccc1)N(C)C)c1ccc(C#N)cc1	ZINC000298567553	456492720	/nfs/dbraw/zinc/49/27/20/456492720.db2.gz	NNJDTDGHINLREO-DNVCBOLYSA-N	0	3	336.439	3.221	20	30		EGEDHN
N#CCCn1cc(CNCc2ccccc2CO)c(-c2ccccc2)n1	ZINC000304059667	456501140	/nfs/dbraw/zinc/50/11/40/456501140.db2.gz	OCKMNMWINLLVRI-UHFFFAOYSA-N	0	3	346.434	3.246	20	30		EGEDHN
C=CCn1c(C2CC2)nnc1N1CCN(CC2CCCCC2)CC1	ZINC000337807241	456559556	/nfs/dbraw/zinc/55/95/56/456559556.db2.gz	IHQPXXFDTYWVMZ-UHFFFAOYSA-N	0	3	329.492	3.044	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H]2CCO[C@@H]2c2nccn2CC)cc1	ZINC000343385550	456579128	/nfs/dbraw/zinc/57/91/28/456579128.db2.gz	DHSNNBLPUYIJPJ-MSOLQXFVSA-N	0	3	327.428	3.088	20	30		EGEDHN
C[C@@H](NC[C@H](O)COc1ccccc1C#N)c1ccccc1Cl	ZINC000320417412	456630038	/nfs/dbraw/zinc/63/00/38/456630038.db2.gz	RVQZYLLVFCBKHZ-HIFRSBDPSA-N	0	3	330.815	3.302	20	30		EGEDHN
CS[C@H]1CN(c2c(C#N)cnc3c(C)cc(C)cc32)C[C@H]1N(C)C	ZINC000340732512	456656120	/nfs/dbraw/zinc/65/61/20/456656120.db2.gz	AMLIUZXCYXOAEN-SJORKVTESA-N	0	3	340.496	3.205	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(Cl)c3ncccc23)CC1	ZINC000338115831	456665646	/nfs/dbraw/zinc/66/56/46/456665646.db2.gz	AIMKNQKODDMSDG-UHFFFAOYSA-N	0	3	329.831	3.268	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cnn(CC(C)C)c2C2CC2)CC1	ZINC000353400176	456674620	/nfs/dbraw/zinc/67/46/20/456674620.db2.gz	PELFIIYOPGLFQK-UHFFFAOYSA-N	0	3	345.491	3.188	20	30		EGEDHN
CS[C@H](CNC(=O)C(C#N)Cc1ccc(C#N)cc1)C(C)(C)C	ZINC000348428141	456684514	/nfs/dbraw/zinc/68/45/14/456684514.db2.gz	ZYAAYPNTFMVCAO-JKSUJKDBSA-N	0	3	329.469	3.134	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCC[C@@H]2OC(F)F)c(OC(F)F)c1	ZINC000348443869	456689270	/nfs/dbraw/zinc/68/92/70/456689270.db2.gz	AKMRZOQCTXRYCO-NEPJUHHUSA-N	0	3	332.297	3.410	20	30		EGEDHN
C=CCN(CCOC(C)(C)C)[C@H](C)c1cccc(-n2cnnn2)c1	ZINC000343571574	456714205	/nfs/dbraw/zinc/71/42/05/456714205.db2.gz	BKJHMXCRMBYMHQ-OAHLLOKOSA-N	0	3	329.448	3.026	20	30		EGEDHN
CO[C@]1(C)C[C@@H](N[C@@H](C)C(=O)N(CCC#N)c2ccccc2)C1(C)C	ZINC000340849520	456717236	/nfs/dbraw/zinc/71/72/36/456717236.db2.gz	KVUFDUTWHZBQIM-XAUMDUMWSA-N	0	3	343.471	3.115	20	30		EGEDHN
CN(Cc1ccccn1)[C@@H]1CCCN(C(=O)N[C@@H]2C=CCCC2)CC1	ZINC000328632918	456723450	/nfs/dbraw/zinc/72/34/50/456723450.db2.gz	LOZVCTYBHNEOKH-IEBWSBKVSA-N	0	3	342.487	3.391	20	30		EGEDHN
CC#CC(=O)NC[C@@H](c1ccc(C(F)(F)F)cc1)N(CC)CC	ZINC000283201269	456736019	/nfs/dbraw/zinc/73/60/19/456736019.db2.gz	MUYUXOZLNOEUHZ-HNNXBMFYSA-N	0	3	326.362	3.228	20	30		EGEDHN
COc1cc(CN[C@@H](C)[C@@H]2OCCc3sccc32)ccc1C#N	ZINC000291751049	456743693	/nfs/dbraw/zinc/74/36/93/456743693.db2.gz	QGPOTJJIFCITAX-SGTLLEGYSA-N	0	3	328.437	3.420	20	30		EGEDHN
CN1CCC[C@@H]1CNC(=O)NCc1ccc(OC2CCCC2)cc1	ZINC000328729135	456747057	/nfs/dbraw/zinc/74/70/57/456747057.db2.gz	FHBTXQYZMPOUMO-MRXNPFEDSA-N	0	3	331.460	3.106	20	30		EGEDHN
C=CCOc1cccc(CN2CCC[C@](COC)(C(=O)OCC)C2)c1	ZINC000343645506	456762399	/nfs/dbraw/zinc/76/23/99/456762399.db2.gz	XWRQDRWDIWCVRK-FQEVSTJZSA-N	0	3	347.455	3.043	20	30		EGEDHN
Cc1noc(C[C@@H](NCCOc2ccc(C#N)cc2)c2ccccc2)n1	ZINC000277347512	456789159	/nfs/dbraw/zinc/78/91/59/456789159.db2.gz	WKROZMUYKJQMBD-LJQANCHMSA-N	0	3	348.406	3.202	20	30		EGEDHN
C[C@@H](N[C@@H](C)CNC(=O)OC(C)(C)C)c1ccc(OCC#N)cc1	ZINC000277354046	456791492	/nfs/dbraw/zinc/79/14/92/456791492.db2.gz	ZHJAYZCFPHVGRY-UONOGXRCSA-N	0	3	333.432	3.153	20	30		EGEDHN
CCc1cnccc1[C@H](C)NC(=O)[C@@H]1CCCN1C1CCOCC1	ZINC000329184982	456849873	/nfs/dbraw/zinc/84/98/73/456849873.db2.gz	PZVTYIYGQHZYMR-KSSFIOAISA-N	0	3	331.460	3.305	20	30		EGEDHN
CC[C@H](C)n1ncc(NC(=O)N2C[C@H](N3CCCC3)C[C@H]2C)c1C	ZINC000329229573	456858210	/nfs/dbraw/zinc/85/82/10/456858210.db2.gz	CTEFCRGZPJUXQM-SQWLQELKSA-N	0	3	333.480	3.267	20	30		EGEDHN
N#CCOc1ccc(CN[C@H](c2nnc[nH]2)C2CCCCC2)cc1	ZINC000292130037	456863515	/nfs/dbraw/zinc/86/35/15/456863515.db2.gz	LLCLQHJCTUVLPL-KRWDZBQOSA-N	0	3	325.416	3.118	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CCOC[C@H](C2CCC2)C1	ZINC000329512402	456902372	/nfs/dbraw/zinc/90/23/72/456902372.db2.gz	XUTVPJMHGNCDGE-RTBURBONSA-N	0	3	326.440	3.034	20	30		EGEDHN
Cc1cc(NC(=O)N[C@@H]2CN(C(C)C)C[C@H]2C)nn1C1CCCCC1	ZINC000329523105	456903788	/nfs/dbraw/zinc/90/37/88/456903788.db2.gz	PSODQZZLDPLKKR-RHSMWYFYSA-N	0	3	347.507	3.173	20	30		EGEDHN
CC(C)Cn1ncc2cc(C(=O)N[C@@H](C)C3=CCN(C)CC3)cnc21	ZINC000329533940	456905922	/nfs/dbraw/zinc/90/59/22/456905922.db2.gz	YJTXXJFLMOGBLC-AWEZNQCLSA-N	0	3	341.459	3.042	20	30		EGEDHN
O=C(N[C@@H]1CCc2nc[nH]c2C1)N[C@@H]1CCSc2ccccc21	ZINC000329701055	456929656	/nfs/dbraw/zinc/92/96/56/456929656.db2.gz	HFIHYTHGDCOIJM-DGCLKSJQSA-N	0	3	328.441	3.008	20	30		EGEDHN
O=C(N[C@@H]1CCc2[nH]cnc2C1)N[C@@H]1CCSc2ccccc21	ZINC000329701055	456929659	/nfs/dbraw/zinc/92/96/59/456929659.db2.gz	HFIHYTHGDCOIJM-DGCLKSJQSA-N	0	3	328.441	3.008	20	30		EGEDHN
O=C(NCC1CCN(c2ccncc2)CC1)NC[C@@H]1CCCCS1	ZINC000329754560	456935992	/nfs/dbraw/zinc/93/59/92/456935992.db2.gz	KWDBZRHJRDNGDL-KRWDZBQOSA-N	0	3	348.516	3.087	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN(C)[C@@H](C)C(C)C)cc1	ZINC000341811706	456954381	/nfs/dbraw/zinc/95/43/81/456954381.db2.gz	VULGTNPOVKRHEM-INIZCTEOSA-N	0	3	331.460	3.308	20	30		EGEDHN
C=CCOc1ccc(CN2CCC3(C[C@@H]3C(=O)OC)CC2)cc1OC	ZINC000353924961	456967181	/nfs/dbraw/zinc/96/71/81/456967181.db2.gz	UPUJLDNKXHGQRR-MRXNPFEDSA-N	0	3	345.439	3.035	20	30		EGEDHN
N#Cc1ccnc(NC[C@H]2CCCN(Cc3cccs3)C2)c1Cl	ZINC000341850422	456971408	/nfs/dbraw/zinc/97/14/08/456971408.db2.gz	CVXHUEFLILAEEV-CYBMUJFWSA-N	0	3	346.887	3.414	20	30		EGEDHN
CCOc1ccc(Oc2cc(CNC(=O)C(C)C#N)ccn2)cc1	ZINC000345761538	456991750	/nfs/dbraw/zinc/99/17/50/456991750.db2.gz	LKGNAYVTUBECBE-ZDUSSCGKSA-N	0	3	325.368	3.048	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)NC[C@]2(C)CCCN2Cc2ccccc2)CCO1	ZINC000330189374	456999586	/nfs/dbraw/zinc/99/95/86/456999586.db2.gz	LSWCPVHIGGLSPS-POAQFYNOSA-N	0	3	345.487	3.112	20	30		EGEDHN
CC(C#N)C(=O)N(Cc1ccc2c(c1)OCO2)C1CCC(C)CC1	ZINC000345924210	457006447	/nfs/dbraw/zinc/00/64/47/457006447.db2.gz	LGABCKDYTATZOO-NPCAHTBFSA-N	0	3	328.412	3.482	20	30		EGEDHN
CCCCN(C)CCNC(=O)c1cn(CCCC#N)c2ccccc12	ZINC000345983391	457010091	/nfs/dbraw/zinc/01/00/91/457010091.db2.gz	RLXGIOCMRKXQRO-UHFFFAOYSA-N	0	3	340.471	3.407	20	30		EGEDHN
C[C@H]1C[C@@H]1N1CCN(C(=O)C[C@H](CC#N)c2ccccc2)C[C@@H](C)C1	ZINC000346133264	457019642	/nfs/dbraw/zinc/01/96/42/457019642.db2.gz	AXMKCEAGQWSOES-ZULIPRJHSA-N	0	3	339.483	3.263	20	30		EGEDHN
C=CC1CCN([C@H]2CCCN(Cc3ccc(F)cc3F)C2=O)CC1	ZINC000346232228	457025925	/nfs/dbraw/zinc/02/59/25/457025925.db2.gz	APFPVSQOIYRRIS-SFHVURJKSA-N	0	3	334.410	3.354	20	30		EGEDHN
C=CCCC1(C(=O)NC2CCN([C@H](C)c3ccncc3)CC2)CC1	ZINC000356513437	457029963	/nfs/dbraw/zinc/02/99/63/457029963.db2.gz	KGAKFTFMEABSPL-MRXNPFEDSA-N	0	3	327.472	3.470	20	30		EGEDHN
C=C[C@@](C)(O)CC(=O)N(CCC)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000346299867	457030641	/nfs/dbraw/zinc/03/06/41/457030641.db2.gz	KJGZWDSKTGDWCY-PZJWPPBQSA-N	0	3	344.499	3.217	20	30		EGEDHN
C=CCNC(=O)CN[C@@H](CC(C)C)c1cccc(Br)c1	ZINC000358989083	457044410	/nfs/dbraw/zinc/04/44/10/457044410.db2.gz	MSRYOPMDVLNLKS-HNNXBMFYSA-N	0	3	339.277	3.428	20	30		EGEDHN
O=C(NCC#Cc1ccccc1)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000359006163	457045623	/nfs/dbraw/zinc/04/56/23/457045623.db2.gz	HNMOSIXTLZEBCW-NRFANRHFSA-N	0	3	347.462	3.002	20	30		EGEDHN
CC(C)C[C@](C)(C#N)NC(=O)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000330484766	457048249	/nfs/dbraw/zinc/04/82/49/457048249.db2.gz	YUPJBNDRKUAWHS-UYAOXDASSA-N	0	3	327.472	3.343	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)[C@H]2CCCN2C2CCCC2)cc1	ZINC000359064642	457049803	/nfs/dbraw/zinc/04/98/03/457049803.db2.gz	WHKGAJBXBKMONA-LJQANCHMSA-N	0	3	328.456	3.275	20	30		EGEDHN
CC(C#N)C(=O)NCC1(c2ccc(Br)s2)CCC1	ZINC000359104160	457056145	/nfs/dbraw/zinc/05/61/45/457056145.db2.gz	GYLLSZPDBBDQKM-SECBINFHSA-N	0	3	327.247	3.208	20	30		EGEDHN
C=C(C)Cn1c(C)nnc1N1C[C@H](C)N(Cc2ccccc2)C[C@H]1C	ZINC000359235619	457066290	/nfs/dbraw/zinc/06/62/90/457066290.db2.gz	VCIOISDLFSVIGV-DLBZAZTESA-N	0	3	339.487	3.262	20	30		EGEDHN
COc1ccc(F)c(C(=O)NCCN2CCCC(C)(C)C2)c1OC	ZINC000331003479	457118034	/nfs/dbraw/zinc/11/80/34/457118034.db2.gz	WVOGWOAGKOUCIK-UHFFFAOYSA-N	0	3	338.423	3.270	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NC(C)(C)CN(C)Cc1ccccc1)OCC	ZINC000339485653	457126249	/nfs/dbraw/zinc/12/62/49/457126249.db2.gz	QNVZVDDKPWYRRV-GOSISDBHSA-N	0	3	332.488	3.385	20	30		EGEDHN
Cc1ccccc1CN1CCC(NC(=O)c2ccc(C#N)s2)CC1	ZINC000362954875	457173902	/nfs/dbraw/zinc/17/39/02/457173902.db2.gz	NOFZZZITMKLEPB-UHFFFAOYSA-N	0	3	339.464	3.323	20	30		EGEDHN
C[C@@H](CCc1ccc(O)cc1)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000350476208	457183924	/nfs/dbraw/zinc/18/39/24/457183924.db2.gz	JLCAFYXZFFQTFG-KXBFYZLASA-N	0	3	347.418	3.084	20	30		EGEDHN
C=CCn1c(C(C)C)nnc1N1CCCN(Cc2ccccc2)CC1	ZINC000350622561	457192093	/nfs/dbraw/zinc/19/20/93/457192093.db2.gz	BXABYTGEHCYSLI-UHFFFAOYSA-N	0	3	339.487	3.300	20	30		EGEDHN
COc1cc(CN(C)C(=O)C(C)C#N)ccc1OCc1ccccc1	ZINC000347061259	457209711	/nfs/dbraw/zinc/20/97/11/457209711.db2.gz	DXJPVWWRBNIXKT-HNNXBMFYSA-N	0	3	338.407	3.392	20	30		EGEDHN
COc1ccc(Br)cc1[C@@H]1CCCN1C(=O)C(C)C#N	ZINC000347099626	457228968	/nfs/dbraw/zinc/22/89/68/457228968.db2.gz	DWVOLOTWPHPCGM-GWCFXTLKSA-N	0	3	337.217	3.281	20	30		EGEDHN
CC(C#N)C(=O)NC[C@H](C)Sc1ccc(Br)cc1	ZINC000347102741	457230905	/nfs/dbraw/zinc/23/09/05/457230905.db2.gz	HZPZJJBKUOWYBZ-ZJUUUORDSA-N	0	3	327.247	3.206	20	30		EGEDHN
N#Cc1ccccc1-c1ccc(CN2CCC(OCCO)CC2)cc1	ZINC000339778690	457263154	/nfs/dbraw/zinc/26/31/54/457263154.db2.gz	FTGQNWYAISYWMZ-UHFFFAOYSA-N	0	3	336.435	3.199	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H]1CN1CCCCC1)c1cccc(C#N)c1	ZINC000360157732	457280367	/nfs/dbraw/zinc/28/03/67/457280367.db2.gz	VXBJTRAHJQUULI-QFBILLFUSA-N	0	3	325.456	3.139	20	30		EGEDHN
CN(CCNC(=O)C[C@@H](CC#N)c1ccccc1)Cc1ccccc1	ZINC000355048030	457337756	/nfs/dbraw/zinc/33/77/56/457337756.db2.gz	ZVZJXVVIJQYVIZ-HXUWFJFHSA-N	0	3	335.451	3.322	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]([C@H]3CCOC3)C2)c(Br)c1	ZINC000360757898	457339863	/nfs/dbraw/zinc/33/98/63/457339863.db2.gz	VNUTWBKDPVLVLB-HIFRSBDPSA-N	0	3	335.245	3.179	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2nc3c(s2)C[C@H](C)CC3)CC1	ZINC000332304972	457345399	/nfs/dbraw/zinc/34/53/99/457345399.db2.gz	LQUSMIMPAKKOKN-GFCCVEGCSA-N	0	3	334.489	3.040	20	30		EGEDHN
N#CC[C@H](CC(=O)NC[C@H]1CCCCN1C1CC1)c1ccccc1	ZINC000357154693	457349768	/nfs/dbraw/zinc/34/97/68/457349768.db2.gz	WCNGRYNZDLATLT-IEBWSBKVSA-N	0	3	325.456	3.207	20	30		EGEDHN
C=CCOc1ccccc1CN1CCC[C@H](Cc2nccn2C)C1	ZINC000357211887	457376687	/nfs/dbraw/zinc/37/66/87/457376687.db2.gz	HMVJDPFUDUFJTP-QGZVFWFLSA-N	0	3	325.456	3.440	20	30		EGEDHN
N#Cc1ccc2c(c1)CCCC[C@@H]2NCC(=O)N1Cc2ccccc2C1	ZINC000360869938	457396157	/nfs/dbraw/zinc/39/61/57/457396157.db2.gz	FGSDWQHXYVRPBZ-NRFANRHFSA-N	0	3	345.446	3.458	20	30		EGEDHN
N#CC1(C(=O)N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)CCCCC1	ZINC000425004357	457401816	/nfs/dbraw/zinc/40/18/16/457401816.db2.gz	JPCMGPUFFGIWBQ-RBUKOAKNSA-N	0	3	337.467	3.193	20	30		EGEDHN
CN(C)[C@H](CNc1ccc(C#N)c([N+](=O)[O-])c1)c1cccc(F)c1	ZINC000357310285	457438577	/nfs/dbraw/zinc/43/85/77/457438577.db2.gz	GMUFVKKRJPOECR-QGZVFWFLSA-N	0	3	328.347	3.320	20	30		EGEDHN
CN(CCOc1cccc(C#N)c1)CCc1ccccc1[N+](=O)[O-]	ZINC000352538770	457449062	/nfs/dbraw/zinc/44/90/62/457449062.db2.gz	OQOLGQHGNZEQNU-UHFFFAOYSA-N	0	3	325.368	3.020	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN1CCC[C@@]1(C)Cc1ccccc1	ZINC000342682773	457453206	/nfs/dbraw/zinc/45/32/06/457453206.db2.gz	ZUJPWERJCHJEQW-PXNSSMCTSA-N	0	3	327.472	3.092	20	30		EGEDHN
CC(=O)c1ccc(C#N)c(N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)c1	ZINC000425270877	457477648	/nfs/dbraw/zinc/47/76/48/457477648.db2.gz	BDLADEJAWNYIRD-RBBKRZOGSA-N	0	3	345.446	3.472	20	30		EGEDHN
CN1CCC[C@]2(CCN(C(=O)C[C@H](CC#N)c3ccccc3)C2)C1	ZINC000356243460	457549414	/nfs/dbraw/zinc/54/94/14/457549414.db2.gz	BZWQLTSJFPFHIN-ICSRJNTNSA-N	0	3	325.456	3.018	20	30		EGEDHN
C[C@@H](NC[C@H]1CC[C@@H](c2nc(C3CC3)no2)O1)c1ccc(C#N)cc1	ZINC000370174333	457575017	/nfs/dbraw/zinc/57/50/17/457575017.db2.gz	PJAGMLPTHDVSFP-JLZZUVOBSA-N	0	3	338.411	3.390	20	30		EGEDHN
C[C@H](NC[C@H]1CC[C@@H](c2nc(C3CC3)no2)O1)c1ccc(C#N)cc1	ZINC000370174334	457575730	/nfs/dbraw/zinc/57/57/30/457575730.db2.gz	PJAGMLPTHDVSFP-VUCTXSBTSA-N	0	3	338.411	3.390	20	30		EGEDHN
CN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2ccc(C3(C#N)CC3)cc2)C1	ZINC000370344614	457624440	/nfs/dbraw/zinc/62/44/40/457624440.db2.gz	YTSYVTRXZAKMRG-VQTJNVASSA-N	0	3	345.446	3.069	20	30		EGEDHN
C=CCN1CC[C@@H](N(CCc2cccc(F)c2)C2CCCC2)C1=O	ZINC000410407265	457640044	/nfs/dbraw/zinc/64/00/44/457640044.db2.gz	KCLBZJDNQLEKPH-LJQANCHMSA-N	0	3	330.447	3.400	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC[C@@](F)(c3ccccc3F)C2)CC1	ZINC000374685407	457687461	/nfs/dbraw/zinc/68/74/61/457687461.db2.gz	IJMARAASMBTLDZ-IBGZPJMESA-N	0	3	349.425	3.056	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000457572950	457750738	/nfs/dbraw/zinc/75/07/38/457750738.db2.gz	RTNJBDPVXLOBDZ-AABGKKOBSA-N	0	3	342.483	3.139	20	30		EGEDHN
CC(C)C1CCC(N(C)CC(=O)NCc2cccc(C#N)c2)CC1	ZINC000433180566	457770647	/nfs/dbraw/zinc/77/06/47/457770647.db2.gz	WCWXLYCHCWNEQR-UHFFFAOYSA-N	0	3	327.472	3.321	20	30		EGEDHN
COCCN(Cc1ccco1)C(=O)C(C#N)CCc1ccccc1	ZINC000433229875	457786084	/nfs/dbraw/zinc/78/60/84/457786084.db2.gz	SPVCMMXIRIGKFE-QGZVFWFLSA-N	0	3	326.396	3.027	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)N(C)CC(C)(C)C#N)c1ccsc1	ZINC000457684531	457790741	/nfs/dbraw/zinc/79/07/41/457790741.db2.gz	JMWQUPDSYKQRHG-OAHLLOKOSA-N	0	3	336.505	3.322	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCc1ccc(OCC2CC2)nc1	ZINC000433345860	457816722	/nfs/dbraw/zinc/81/67/22/457816722.db2.gz	ZOKGCWDVJYMAIK-LJQANCHMSA-N	0	3	349.434	3.259	20	30		EGEDHN
CCc1ccc([C@@H](COC)NC(=O)C(C#N)CCc2ccccc2)o1	ZINC000433369922	457823497	/nfs/dbraw/zinc/82/34/97/457823497.db2.gz	AXOUVTXPJDJLGX-SJLPKXTDSA-N	0	3	340.423	3.418	20	30		EGEDHN
Cc1ccc(CNCc2ccc(C#N)c(C)c2)c(N2CCOCC2)c1	ZINC000443981983	457832596	/nfs/dbraw/zinc/83/25/96/457832596.db2.gz	CQVWWJQNWBWDRK-UHFFFAOYSA-N	0	3	335.451	3.302	20	30		EGEDHN
C[C@@H](CCC#N)N(C)C[C@@H](O)COc1ccc(C(F)(F)F)cc1	ZINC000411265734	457843968	/nfs/dbraw/zinc/84/39/68/457843968.db2.gz	PBLFNMTVYXWIPW-GXTWGEPZSA-N	0	3	330.350	3.069	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](C)c2cccc(OC)c2)CC1	ZINC000358197315	457852865	/nfs/dbraw/zinc/85/28/65/457852865.db2.gz	WUHCCFMHJQJLFH-HNNXBMFYSA-N	0	3	331.460	3.096	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cnc([C@@H](C)OCC)s2)CC1	ZINC000361783844	457857134	/nfs/dbraw/zinc/85/71/34/457857134.db2.gz	YGSZPPUJTNZFPQ-CYBMUJFWSA-N	0	3	337.489	3.011	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NC[C@@]1(CO)C[C@H]1c1ccccc1	ZINC000426743055	457892113	/nfs/dbraw/zinc/89/21/13/457892113.db2.gz	MQFKUILXOKBABP-JAXLGGSGSA-N	0	3	348.446	3.041	20	30		EGEDHN
CCOC(=O)[C@@]1(COC)CCCN(CCC2(C#N)CCCCC2)C1	ZINC000411667241	457943778	/nfs/dbraw/zinc/94/37/78/457943778.db2.gz	BFBNARZTFWSMMU-IBGZPJMESA-N	0	3	336.476	3.142	20	30		EGEDHN
CN(C)CCN(Cc1ccsc1)C(=O)c1cc(C#N)ccc1Cl	ZINC000458224277	457978230	/nfs/dbraw/zinc/97/82/30/457978230.db2.gz	OCLQWZRCAIIRPP-UHFFFAOYSA-N	0	3	347.871	3.477	20	30		EGEDHN
C=CCC[C@H](C(=O)N1C[C@@H](N(C)C)[C@@H](SC)C1)c1ccccc1	ZINC000427629478	458010926	/nfs/dbraw/zinc/01/09/26/458010926.db2.gz	NDJQLHRWXILQIC-KSZLIROESA-N	0	3	332.513	3.240	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CC=C(c3ccccc3F)C2)CC1	ZINC000368282743	458022878	/nfs/dbraw/zinc/02/28/78/458022878.db2.gz	GSIMOMZHXZVHQK-UHFFFAOYSA-N	0	3	343.446	3.275	20	30		EGEDHN
CCN(CCC#N)C(=O)CN(C)[C@H]1CCCC[C@@H]1c1ccccc1	ZINC000412007425	458042903	/nfs/dbraw/zinc/04/29/03/458042903.db2.gz	JDFSLMCJQVKZKV-MOPGFXCFSA-N	0	3	327.472	3.407	20	30		EGEDHN
C=CC[C@H](C(=O)N1C[C@@H](N2CCCC2)[C@@H](SC)C1)c1ccccc1	ZINC000427925742	458053409	/nfs/dbraw/zinc/05/34/09/458053409.db2.gz	VANWBBCBFHAIQA-OTWHNJEPSA-N	0	3	344.524	3.385	20	30		EGEDHN
CCN(CCC#N)C(=O)CN[C@@](C)(Cc1ccccc1)c1ccccc1	ZINC000412089093	458087410	/nfs/dbraw/zinc/08/74/10/458087410.db2.gz	DPOYIMRCFWLNNJ-QFIPXVFZSA-N	0	3	349.478	3.496	20	30		EGEDHN
CC(C)N1CC[C@@H](N(C)C(=O)N[C@H](CCC#N)c2ccccc2)C1	ZINC000458579458	458099840	/nfs/dbraw/zinc/09/98/40/458099840.db2.gz	NJXVJAGTYIIFLD-QZTJIDSGSA-N	0	3	328.460	3.156	20	30		EGEDHN
CCN(CCC#N)C(=O)CN(CC)[C@@H](Cc1ccc(F)cc1)C(C)C	ZINC000362385029	458140495	/nfs/dbraw/zinc/14/04/95/458140495.db2.gz	QJEJALHDBQJFHD-IBGZPJMESA-N	0	3	347.478	3.477	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1CNC(=O)c1cccc(CN2CCCCC2)c1	ZINC000412306954	458162149	/nfs/dbraw/zinc/16/21/49/458162149.db2.gz	GGVWLFYSRAIQST-VQTJNVASSA-N	0	3	342.483	3.384	20	30		EGEDHN
Cc1ccccc1[C@H]([C@H](C)NC(=O)N(C)CC(C)(C)C#N)N(C)C	ZINC000458765055	458162937	/nfs/dbraw/zinc/16/29/37/458162937.db2.gz	JTAUKWRGZJPBJQ-RDJZCZTQSA-N	0	3	330.476	3.177	20	30		EGEDHN
C=C(C)CCNC(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000458768756	458164546	/nfs/dbraw/zinc/16/45/46/458164546.db2.gz	WAKYOJMKVCOOJJ-SFHVURJKSA-N	0	3	333.476	3.342	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1CNc1cc(C)nc2ccc([N+](=O)[O-])cc21	ZINC000435596045	458169706	/nfs/dbraw/zinc/16/97/06/458169706.db2.gz	GBRMUEWQOJHBST-SCLBCKFNSA-N	0	3	327.384	3.266	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1CN[C@H](C(=O)N1CCCCC1)c1ccccc1	ZINC000435674731	458182089	/nfs/dbraw/zinc/18/20/89/458182089.db2.gz	RRUNQDBPWJUOGH-AABGKKOBSA-N	0	3	342.483	3.311	20	30		EGEDHN
CC[C@H](N[C@@H]1CCCN(C(=O)N2CCCC2)C1)c1ccc(C#N)cc1	ZINC000376141336	458210473	/nfs/dbraw/zinc/21/04/73/458210473.db2.gz	BZYHEUDCXAYNKE-MOPGFXCFSA-N	0	3	340.471	3.279	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCCSCc2ccc(C)cc2)CC1	ZINC000358778115	458212087	/nfs/dbraw/zinc/21/20/87/458212087.db2.gz	BVHICHKNHKKIHL-UHFFFAOYSA-N	0	3	347.528	3.178	20	30		EGEDHN
C#C[C@H](NC(=O)NC1CCN([C@H](C)c2ccccc2)CC1)C(C)C	ZINC000369617638	458291127	/nfs/dbraw/zinc/29/11/27/458291127.db2.gz	PPROTKNHEIPLLE-APWZRJJASA-N	0	3	327.472	3.169	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NC(=O)N1CCN(C2CC2)C[C@H](C)C1	ZINC000413836167	458310080	/nfs/dbraw/zinc/31/00/80/458310080.db2.gz	ORGVWSIVWNYPIG-PKOBYXMFSA-N	0	3	341.499	3.300	20	30		EGEDHN
CO[C@H]1c2ccccc2C[C@H]1NC(=O)C(C#N)CCc1ccccc1	ZINC000413877825	458312264	/nfs/dbraw/zinc/31/22/64/458312264.db2.gz	HMIXWLYQALRJSE-SXLOBPIMSA-N	0	3	334.419	3.188	20	30		EGEDHN
COC(=O)[C@]1(C)CCCN(Cc2cccc(OCCCC#N)c2)C1	ZINC000414562782	458323594	/nfs/dbraw/zinc/32/35/94/458323594.db2.gz	VJOOZOBLSHILBZ-LJQANCHMSA-N	0	3	330.428	3.144	20	30		EGEDHN
N#CC(C(=O)c1cnc2ccccc2c1)c1nnc2n1CCCCC2	ZINC000459321293	458328795	/nfs/dbraw/zinc/32/87/95/458328795.db2.gz	ZVVQAQGUKXLFDI-HNNXBMFYSA-N	0	3	331.379	3.043	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N[C@@H](CO)CC1CCCCC1	ZINC000416325332	458342165	/nfs/dbraw/zinc/34/21/65/458342165.db2.gz	KADPMECTOPUWBP-RBUKOAKNSA-N	0	3	328.456	3.206	20	30		EGEDHN
C=CCN(C)CCN(CC)[C@@H](C)C(=O)Nc1cccc2ncccc21	ZINC000429729928	458364694	/nfs/dbraw/zinc/36/46/94/458364694.db2.gz	JTUDMPSHNAOXKP-INIZCTEOSA-N	0	3	340.471	3.002	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2NCc1ccc2c(c1)NC(=O)CO2	ZINC000418143366	458372663	/nfs/dbraw/zinc/37/26/63/458372663.db2.gz	IMHZJMNORBJEEY-QGZVFWFLSA-N	0	3	333.391	3.056	20	30		EGEDHN
C=CCC[C@H]1NC(=O)N(C2CCN([C@@H](C)c3ccccc3)CC2)C1=O	ZINC000420006294	458395665	/nfs/dbraw/zinc/39/56/65/458395665.db2.gz	XVNFEYNTGAXNNE-MAUKXSAKSA-N	0	3	341.455	3.099	20	30		EGEDHN
N#Cc1cccc(C2(NCc3cccc(CN4CCOCC4)c3)CC2)c1	ZINC000420930497	458403874	/nfs/dbraw/zinc/40/38/74/458403874.db2.gz	FONWNIFGKUBSBF-UHFFFAOYSA-N	0	3	347.462	3.169	20	30		EGEDHN
N#Cc1ccc(CN[C@H](Cc2ccccc2)[C@@H](O)C(F)F)cc1F	ZINC000421368453	458411945	/nfs/dbraw/zinc/41/19/45/458411945.db2.gz	UZXKMUFDUWYMTM-IAGOWNOFSA-N	0	3	334.341	3.024	20	30		EGEDHN
CC(C)(C)O[C@@H]1C[C@H](NCc2ccc(C#N)c(F)c2)[C@@H]1n1cccn1	ZINC000421374197	458412547	/nfs/dbraw/zinc/41/25/47/458412547.db2.gz	BHROPADFSHXWMR-KSZLIROESA-N	0	3	342.418	3.181	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)NC[C@H]1CCC(F)(F)C1)C(C)C	ZINC000430175873	458414945	/nfs/dbraw/zinc/41/49/45/458414945.db2.gz	DNLYIOUXRHAEQW-JKSUJKDBSA-N	0	3	343.462	3.420	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(C(F)(F)F)cc2C)CC1	ZINC000448921577	458415992	/nfs/dbraw/zinc/41/59/92/458415992.db2.gz	NUIUNEISFGRHKP-UHFFFAOYSA-N	0	3	326.362	3.394	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCc1ccc(-c2ccccc2C(=O)OC)o1	ZINC000449517903	458425976	/nfs/dbraw/zinc/42/59/76/458425976.db2.gz	HTJLSUIVZPLCHZ-SJORKVTESA-N	0	3	327.380	3.166	20	30		EGEDHN
CCCN(CCN1CCCCCC1)C(=O)NCc1ccc(C#N)s1	ZINC000422221642	458426256	/nfs/dbraw/zinc/42/62/56/458426256.db2.gz	ZZFWVNZPEFRQEM-UHFFFAOYSA-N	0	3	348.516	3.417	20	30		EGEDHN
C[C@H](CC(=O)N(C)c1ccccc1)NCc1ccc(C#N)c(F)c1	ZINC000449736106	458429887	/nfs/dbraw/zinc/42/98/87/458429887.db2.gz	KVTGNZISCWDZPB-CQSZACIVSA-N	0	3	325.387	3.229	20	30		EGEDHN
C[C@@H](CCCc1cccnc1)N[C@@H](C)C(=O)Nc1ccccc1C#N	ZINC000459631082	458431438	/nfs/dbraw/zinc/43/14/38/458431438.db2.gz	BCBGIFRRWRFKAB-HOTGVXAUSA-N	0	3	336.439	3.281	20	30		EGEDHN
CO[C@@H]1C[C@H](NCc2ccc(C#N)cc2Br)C12CCC2	ZINC000459748914	458467372	/nfs/dbraw/zinc/46/73/72/458467372.db2.gz	GVWSTWYLVUNWQL-LSDHHAIUSA-N	0	3	335.245	3.368	20	30		EGEDHN
CC(C)C[C@@H](CN1CCCC1)NC(=O)[C@@H](C)c1cccc(C#N)c1	ZINC000452345719	458499741	/nfs/dbraw/zinc/49/97/41/458499741.db2.gz	SBXQBIHUEXSMCH-LPHOPBHVSA-N	0	3	327.472	3.288	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1C(=O)NC[C@@H]1CCCN(C)[C@H]1c1cccs1	ZINC000377465390	458501513	/nfs/dbraw/zinc/50/15/13/458501513.db2.gz	QTCMXEXHOSKAOV-BURFUSLBSA-N	0	3	348.512	3.228	20	30		EGEDHN
C=C(C)Cn1c([C@@H]2CCCCO2)nnc1N1C[C@H](C)N(CC)C[C@@H]1C	ZINC000453467249	458534473	/nfs/dbraw/zinc/53/44/73/458534473.db2.gz	QRUPKYISLDGIAJ-ULQDDVLXSA-N	0	3	347.507	3.015	20	30		EGEDHN
Cc1nc2ccccc2cc1C(=O)C(C#N)c1nnc2n1CCCCC2	ZINC000453613918	458538468	/nfs/dbraw/zinc/53/84/68/458538468.db2.gz	CRUZXTKOFOSMEW-MRXNPFEDSA-N	0	3	345.406	3.351	20	30		EGEDHN
CC(C)[C@H](CN[C@H](C(N)=O)c1ccc(C#N)cc1)Cc1ccccc1	ZINC000468851325	458539512	/nfs/dbraw/zinc/53/95/12/458539512.db2.gz	DMGKBMFBDRLBHJ-PMACEKPBSA-N	0	3	335.451	3.189	20	30		EGEDHN
CC[C@@H](Cc1ccccc1)N(CC)CC(=O)N[C@@](C)(C#N)C(C)C	ZINC000469142548	458557064	/nfs/dbraw/zinc/55/70/64/458557064.db2.gz	ZQSOSEAPWXMAPW-ICSRJNTNSA-N	0	3	329.488	3.384	20	30		EGEDHN
CC(C)c1cnc(-c2ccc(NC(=O)[C@@H](N)CCCC#N)cc2)o1	ZINC000424117601	458561961	/nfs/dbraw/zinc/56/19/61/458561961.db2.gz	CQUUVTMFMOZAHO-HNNXBMFYSA-N	0	3	326.400	3.425	20	30		EGEDHN
C[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)[C@H](N)CCCC#N	ZINC000424117915	458562115	/nfs/dbraw/zinc/56/21/15/458562115.db2.gz	ZOKDHVUDYNZKGB-IINYFYTJSA-N	0	3	328.243	3.062	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N(CCc1ccc(Cl)cc1)CC1CC1	ZINC000424130630	458567006	/nfs/dbraw/zinc/56/70/06/458567006.db2.gz	UBMIWGPWJLSTOF-KRWDZBQOSA-N	0	3	333.863	3.142	20	30		EGEDHN
C[C@H](NC(=O)[C@@H](N)CCCC#N)c1nc(-c2ccccc2)cs1	ZINC000424137480	458567650	/nfs/dbraw/zinc/56/76/50/458567650.db2.gz	LVZCXKVQQYOZCX-JSGCOSHPSA-N	0	3	328.441	3.008	20	30		EGEDHN
CC(C)(CNC(=O)[C@@H](N)CCCC#N)c1ccc(C(F)(F)F)cc1	ZINC000424172622	458576470	/nfs/dbraw/zinc/57/64/70/458576470.db2.gz	NKCWXTYRQJVOPH-AWEZNQCLSA-N	0	3	341.377	3.120	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N1CCC[C@H](CCCc2ccccc2)C1	ZINC000424168213	458576737	/nfs/dbraw/zinc/57/67/37/458576737.db2.gz	IADYICLSLPSURI-OALUTQOASA-N	0	3	327.472	3.269	20	30		EGEDHN
C[C@H](C(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1)c1cccc(C#N)c1	ZINC000462197852	458602189	/nfs/dbraw/zinc/60/21/89/458602189.db2.gz	HQIRFTISPOQJSM-FIKGOQFSSA-N	0	3	347.462	3.441	20	30		EGEDHN
CC#CCC[N@H+](C)Cc1cccc([N-]S(=O)(=O)c2ccccc2)c1	ZINC000462328991	458612796	/nfs/dbraw/zinc/61/27/96/458612796.db2.gz	UZTWXSFPLYGSFF-UHFFFAOYSA-N	0	3	342.464	3.333	20	30		EGEDHN
CC#CCC[N@@H+](C)Cc1cccc([N-]S(=O)(=O)c2ccccc2)c1	ZINC000462328991	458612802	/nfs/dbraw/zinc/61/28/02/458612802.db2.gz	UZTWXSFPLYGSFF-UHFFFAOYSA-N	0	3	342.464	3.333	20	30		EGEDHN
CCCN(CCN1CCCCC1)C(=O)Nc1cccc(CC#N)c1	ZINC000455899301	458619274	/nfs/dbraw/zinc/61/92/74/458619274.db2.gz	AFIZWYPWTYGVBI-UHFFFAOYSA-N	0	3	328.460	3.482	20	30		EGEDHN
CC[C@H](Cc1ccc(C)cc1)N(C)CC(=O)N(CC)C[C@@H](C)C#N	ZINC000470368394	458632678	/nfs/dbraw/zinc/63/26/78/458632678.db2.gz	BIOSZBBZCYEICP-PKOBYXMFSA-N	0	3	329.488	3.256	20	30		EGEDHN
CC1CCN(CCNc2c(C#N)cnc3ccc(Cl)cc32)CC1	ZINC000462774529	458652270	/nfs/dbraw/zinc/65/22/70/458652270.db2.gz	DVBMYLKTTSXPQS-UHFFFAOYSA-N	0	3	328.847	3.326	20	30		EGEDHN
C=CC1CCN(C(=O)N[C@@H]2CN(Cc3ccccc3)C[C@H]2C)CC1	ZINC000463006007	458670626	/nfs/dbraw/zinc/67/06/26/458670626.db2.gz	FKFSSRUDNOYWSZ-VQIMIIECSA-N	0	3	327.472	3.115	20	30		EGEDHN
C[C@@H]1CCCC[C@H]1C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000424593076	458673660	/nfs/dbraw/zinc/67/36/60/458673660.db2.gz	BXIYKPYOEPQZGU-VQIMIIECSA-N	0	3	327.472	3.275	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N(C)Cc1ccc(O)cc1)C(C)C	ZINC000503439351	458708431	/nfs/dbraw/zinc/70/84/31/458708431.db2.gz	RYJWIAATGNIKRW-IBGZPJMESA-N	0	3	345.487	3.232	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1	ZINC000424704364	458713477	/nfs/dbraw/zinc/71/34/77/458713477.db2.gz	IFYPVUIMZRWJGJ-CALCHBBNSA-N	0	3	336.520	3.327	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1	ZINC000424707955	458715663	/nfs/dbraw/zinc/71/56/63/458715663.db2.gz	DFUSSQWMFOHOPV-UHFFFAOYSA-N	0	3	330.472	3.432	20	30		EGEDHN
C[C@@H](C(=O)N1C[C@H](N(C)C)Cc2ccccc21)c1cccc(C#N)c1	ZINC000463778630	458718913	/nfs/dbraw/zinc/71/89/13/458718913.db2.gz	ZGNBUMFRVYVZEF-DNVCBOLYSA-N	0	3	333.435	3.181	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@H](NC/C=C/c3ccc(F)cc3)C2=O)cc1	ZINC000503915393	458729653	/nfs/dbraw/zinc/72/96/53/458729653.db2.gz	WCZYIOPKQLMVQN-OIBGTREISA-N	0	3	349.409	3.496	20	30		EGEDHN
CC(C)(CNC(=O)C(C)(C)c1cc(F)cc(C#N)c1)N1CCCCC1	ZINC000505182218	458741147	/nfs/dbraw/zinc/74/11/47/458741147.db2.gz	PYFSPPWTPFDCGF-UHFFFAOYSA-N	0	3	345.462	3.356	20	30		EGEDHN
C[C@H](CNC(=O)C(C)(C)c1cc(F)cc(C#N)c1)N1CCCC[C@@H]1C	ZINC000506494437	458751341	/nfs/dbraw/zinc/75/13/41/458751341.db2.gz	DJVNELYBIVTSRJ-LSDHHAIUSA-N	0	3	345.462	3.354	20	30		EGEDHN
CN(CCNC(=O)c1cc(C#N)ccc1Cl)Cc1ccccc1	ZINC000507509032	458755252	/nfs/dbraw/zinc/75/52/52/458755252.db2.gz	KLTCUFKOYVTRJI-UHFFFAOYSA-N	0	3	327.815	3.073	20	30		EGEDHN
C=CCn1c([C@H](C)CC)nnc1N1CCN(C2CCCCC2)CC1	ZINC000508497196	458760170	/nfs/dbraw/zinc/76/01/70/458760170.db2.gz	JPPMSFPWJWCVCL-MRXNPFEDSA-N	0	3	331.508	3.432	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@@H](C)N1CCC(COc2ccccc2)CC1	ZINC000508531968	458760943	/nfs/dbraw/zinc/76/09/43/458760943.db2.gz	QCUZUMKEIWZIMN-GOSISDBHSA-N	0	3	342.483	3.367	20	30		EGEDHN
C=C(C)CCN1CCN([C@H](C(=O)OC)c2cccc(Cl)c2)CC1	ZINC000509360505	458771454	/nfs/dbraw/zinc/77/14/54/458771454.db2.gz	WCIJZBCVWOGPGS-KRWDZBQOSA-N	0	3	336.863	3.138	20	30		EGEDHN
C[C@@H]1[C@@H](Cc2ccccc2)CCN1CC(=O)Nc1ccc(C#N)cc1	ZINC000472350418	458789219	/nfs/dbraw/zinc/78/92/19/458789219.db2.gz	UAODGLPSEBJCBQ-VQIMIIECSA-N	0	3	333.435	3.450	20	30		EGEDHN
C[C@H]1[C@H](Cc2ccccc2)CCN1CC(=O)NC1(C#N)CCCCC1	ZINC000472354658	458791099	/nfs/dbraw/zinc/79/10/99/458791099.db2.gz	VFXQCVSYYGAVGX-HKUYNNGSSA-N	0	3	339.483	3.282	20	30		EGEDHN
CN1CCC[C@@H](CNC(=O)N[C@@H]2CC[C@H](C#N)C2)[C@@H]1c1cccs1	ZINC000515469288	458809490	/nfs/dbraw/zinc/80/94/90/458809490.db2.gz	YWBKEZZEOIQAPT-LJIGWXMPSA-N	0	3	346.500	3.122	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC[C@@H](CN(C)C)c1ccc(Cl)cc1	ZINC000516557320	458818215	/nfs/dbraw/zinc/81/82/15/458818215.db2.gz	IQJDKMXRLKADLT-ZBFHGGJFSA-N	0	3	338.879	3.083	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H]2CCN(c3ccccc3)[C@H]2C)CC1	ZINC000473571805	458836388	/nfs/dbraw/zinc/83/63/88/458836388.db2.gz	VMLNVNGGGKSBOS-FXAWDEMLSA-N	0	3	341.499	3.058	20	30		EGEDHN
C=CCCCCNC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1	ZINC000474086093	458860554	/nfs/dbraw/zinc/86/05/54/458860554.db2.gz	BEAYIKIXQBMVFH-UHFFFAOYSA-N	0	3	339.430	3.394	20	30		EGEDHN
C=CCN1CCC(NC(=O)CO[C@@H]2C[C@H](C)CC[C@H]2C(C)C)CC1	ZINC000518501463	458872679	/nfs/dbraw/zinc/87/26/79/458872679.db2.gz	AZWXSCIFLGDBET-NZSAHSFTSA-N	0	3	336.520	3.230	20	30		EGEDHN
C=CCOCCN(Cc1cc(C)nc(N2CCCCC2)n1)CC(C)C	ZINC000549922103	458884711	/nfs/dbraw/zinc/88/47/11/458884711.db2.gz	YKOBSALNIBBHAC-UHFFFAOYSA-N	0	3	346.519	3.436	20	30		EGEDHN
C=CCNC(=O)NC(=O)CN(CC(C)C)[C@H](C)c1ccccc1C	ZINC000551723839	458888924	/nfs/dbraw/zinc/88/89/24/458888924.db2.gz	SJFJYNAUVFNMLX-MRXNPFEDSA-N	0	3	331.460	3.026	20	30		EGEDHN
C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)c1ccccc1-c1ccccc1C#N	ZINC000467027504	458946271	/nfs/dbraw/zinc/94/62/71/458946271.db2.gz	YKLGRHRVWTXCSS-VFNWGFHPSA-N	0	3	345.446	3.438	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@]2(C1)CCCN([C@@H]1CC[C@H](C#N)C1)C2	ZINC000495794356	458957554	/nfs/dbraw/zinc/95/75/54/458957554.db2.gz	SBUNKCPPALQDQR-FCEWJHQRSA-N	0	3	333.476	3.402	20	30		EGEDHN
C=C(C)CCNC(=O)NC[C@H](c1cccc(OC)c1)N1CCCC1	ZINC000457482718	458972801	/nfs/dbraw/zinc/97/28/01/458972801.db2.gz	LNNWLZGSGHCOFM-GOSISDBHSA-N	0	3	331.460	3.098	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCc3c(F)cc(F)cc3[C@@H]2C)CC1	ZINC000467956293	458993396	/nfs/dbraw/zinc/99/33/96/458993396.db2.gz	BNZUHQFPCGNEFX-ZDUSSCGKSA-N	0	3	349.425	3.244	20	30		EGEDHN
CCC(CC)N(CCOC)[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000567068683	459042416	/nfs/dbraw/zinc/04/24/16/459042416.db2.gz	BYWYGAVFYQNHGO-LJQANCHMSA-N	0	3	343.471	3.191	20	30		EGEDHN
C=CCc1ccc(OC[C@H](O)CN2CCC(CC)CC2)c(OC)c1	ZINC000520272897	459046175	/nfs/dbraw/zinc/04/61/75/459046175.db2.gz	PDYPSFNTZOYHSS-GOSISDBHSA-N	0	3	333.472	3.285	20	30		EGEDHN
CC1CC(C#N)(C(=O)N2CC[C@]3(CCN(Cc4ccccc4)C3)C2)C1	ZINC000557612904	459091028	/nfs/dbraw/zinc/09/10/28/459091028.db2.gz	HNKLLRCDPSABAB-SGDIKTSBSA-N	0	3	337.467	3.051	20	30		EGEDHN
COc1ccc(N2C[C@H](N[C@@H](C)c3ccc(C#N)cc3)CC2=O)cc1	ZINC000594722570	459139633	/nfs/dbraw/zinc/13/96/33/459139633.db2.gz	RVVGBTYHMZVIEV-WMLDXEAASA-N	0	3	335.407	3.023	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCCC[C@H]2NC(=O)c2ccccc2)cc1	ZINC000594995047	459208303	/nfs/dbraw/zinc/20/83/03/459208303.db2.gz	NHFKZWMPDKKULI-WOJBJXKFSA-N	0	3	333.435	3.389	20	30		EGEDHN
C=C(C)CN1CCC(N[C@@H](C)c2ccc([N+](=O)[O-])cc2OC)CC1	ZINC000595014469	459215448	/nfs/dbraw/zinc/21/54/48/459215448.db2.gz	VUUYKOCQGLISNC-AWEZNQCLSA-N	0	3	333.432	3.295	20	30		EGEDHN
C[C@@H](N[C@H]1CCc2ccc(C#N)cc21)[C@H](C)NC(=O)OC(C)(C)C	ZINC000496559854	459238112	/nfs/dbraw/zinc/23/81/12/459238112.db2.gz	TYQBHBUZKMHIKD-IGCXYCKISA-N	0	3	329.444	3.437	20	30		EGEDHN
C=C(C)CN(C)CCc1nc2sc3c(c2c(N)n1)CC[C@H](C)C3	ZINC000481212498	459239798	/nfs/dbraw/zinc/23/97/98/459239798.db2.gz	PKTNXYUYBRLHSQ-LBPRGKRZSA-N	0	3	330.501	3.449	20	30		EGEDHN
COCCN1CCC(Nc2c(C#N)cnc3c(Cl)cccc32)CC1	ZINC000568505069	459299566	/nfs/dbraw/zinc/29/95/66/459299566.db2.gz	XVHDPFDKCOKGBK-UHFFFAOYSA-N	0	3	344.846	3.283	20	30		EGEDHN
C=C(C)C[NH+]1CCC(Nc2c(C(=O)[O-])cnc3ccc(C)cc32)CC1	ZINC000582124826	459312253	/nfs/dbraw/zinc/31/22/53/459312253.db2.gz	VHRJTHBEAKDRPF-UHFFFAOYSA-N	0	3	339.439	3.116	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NC[C@H](CC)N1CCc2ccccc2C1)OCC	ZINC000534401105	459324480	/nfs/dbraw/zinc/32/44/80/459324480.db2.gz	FBEPYVOBCUSOAW-PMACEKPBSA-N	0	3	344.499	3.311	20	30		EGEDHN
CCCOc1ccc(C(C)(C)NCC(=O)N(CC)C[C@H](C)C#N)cc1	ZINC000483270103	459354560	/nfs/dbraw/zinc/35/45/60/459354560.db2.gz	JSUMNJZMAQTXKE-MRXNPFEDSA-N	0	3	345.487	3.308	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN1CCC[C@@H]1c1c(C)cccc1C	ZINC000595600057	459360482	/nfs/dbraw/zinc/36/04/82/459360482.db2.gz	FZTFUBRXLPZCDA-MAUKXSAKSA-N	0	3	327.472	3.449	20	30		EGEDHN
CC(C)c1ccc([C@@H](N)CNC(=O)N2CCC[C@](C)(C#N)C2)cc1	ZINC000591359233	459361616	/nfs/dbraw/zinc/36/16/16/459361616.db2.gz	GROIYVQYPKTFRE-PKOBYXMFSA-N	0	3	328.460	3.145	20	30		EGEDHN
C=CC[C@@H](CC)NC(=O)NCC(C)(C)N1CCc2ccccc2C1	ZINC000540808462	459388626	/nfs/dbraw/zinc/38/86/26/459388626.db2.gz	DWDSGORBGHQZHR-GOSISDBHSA-N	0	3	329.488	3.477	20	30		EGEDHN
C=CC[C@H](CC)NC(=O)NCC(C)(C)N1CCc2ccccc2C1	ZINC000540808463	459388680	/nfs/dbraw/zinc/38/86/80/459388680.db2.gz	DWDSGORBGHQZHR-SFHVURJKSA-N	0	3	329.488	3.477	20	30		EGEDHN
C=CCN(CC(=O)NCc1ccc(C#N)cc1)CC1CCCCC1	ZINC000484694855	459427250	/nfs/dbraw/zinc/42/72/50/459427250.db2.gz	QHEPVGPBQZPCQI-UHFFFAOYSA-N	0	3	325.456	3.243	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1N[C@H](C)C(=O)N[C@@H](C)c1ccc2c(c1)CCCC2	ZINC000569436900	459450284	/nfs/dbraw/zinc/45/02/84/459450284.db2.gz	ZQJISBKGHUVMAW-BWMZKYQQSA-N	0	3	342.483	3.064	20	30		EGEDHN
C=CCn1c(-c2ccccc2)nnc1N1C[C@@H](C)N(CC)C[C@H]1C	ZINC000569511423	459464122	/nfs/dbraw/zinc/46/41/22/459464122.db2.gz	ZDTQXFMQKVUWSW-HZPDHXFCSA-N	0	3	325.460	3.050	20	30		EGEDHN
N#Cc1cccc(COc2cccc(CNCCOCCF)c2)c1	ZINC000596059353	459505537	/nfs/dbraw/zinc/50/55/37/459505537.db2.gz	YIUGHVPVNLTHND-UHFFFAOYSA-N	0	3	328.387	3.213	20	30		EGEDHN
N#Cc1ccc(C(=O)N2CCCN(CC3CCCCC3)CC2)s1	ZINC000486653245	459513341	/nfs/dbraw/zinc/51/33/41/459513341.db2.gz	GEAUXCOJADEBFE-UHFFFAOYSA-N	0	3	331.485	3.348	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@@H](Nc2ccc(Cl)c(C#N)n2)C1	ZINC000486932444	459524828	/nfs/dbraw/zinc/52/48/28/459524828.db2.gz	DEZRDRJOBFNZQN-UKRRQHHQSA-N	0	3	326.831	3.276	20	30		EGEDHN
C=CCN(CCc1ccco1)C(=O)N[C@@H](C)CN1CCC[C@@H](C)C1	ZINC000497368338	459528799	/nfs/dbraw/zinc/52/87/99/459528799.db2.gz	LDUAKRPAWSFRRE-SJORKVTESA-N	0	3	333.476	3.140	20	30		EGEDHN
C[C@H](c1ccccc1)[C@@H](O)CN1CCC(C#N)(c2ccccn2)CC1	ZINC000569918241	459530331	/nfs/dbraw/zinc/53/03/31/459530331.db2.gz	YMSWLXGGYCFBHL-MJGOQNOKSA-N	0	3	335.451	3.103	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N1CCC[C@H](CC#N)C1)C(C)C	ZINC000596139348	459533866	/nfs/dbraw/zinc/53/38/66/459533866.db2.gz	ROESGNOMLXLMTP-MSOLQXFVSA-N	0	3	332.492	3.020	20	30		EGEDHN
CC(C)[C@@H]1CN(CC#Cc2ccc(OC(F)(F)F)cc2)CCN1C	ZINC000487963302	459536902	/nfs/dbraw/zinc/53/69/02/459536902.db2.gz	LBRQQCBGNKGCEP-KRWDZBQOSA-N	0	3	340.389	3.209	20	30		EGEDHN
Cc1cc(CN2CCC(C(=O)Nc3ccccc3O)CC2)ccc1C#N	ZINC000488167083	459540948	/nfs/dbraw/zinc/54/09/48/459540948.db2.gz	VNVCVXITUNAKNE-UHFFFAOYSA-N	0	3	349.434	3.423	20	30		EGEDHN
Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@H]2N[C@@H]2CC[C@H](C#N)C2)cc1	ZINC000570624921	459558893	/nfs/dbraw/zinc/55/88/93/459558893.db2.gz	WAFMLCQRVKETBS-OGWHTMIXSA-N	0	3	346.496	3.362	20	30		EGEDHN
C=CCc1ccc(OC[C@@H](O)CN2CCCC[C@H]2C=C)c(OC)c1	ZINC000489486435	459565197	/nfs/dbraw/zinc/56/51/97/459565197.db2.gz	YPDRDENQAYSAMO-MSOLQXFVSA-N	0	3	331.456	3.204	20	30		EGEDHN
N#C[C@@H]1CC[C@@H](NCCNc2ncc(C(F)(F)F)cc2Cl)C1	ZINC000571743663	459572014	/nfs/dbraw/zinc/57/20/14/459572014.db2.gz	BOBUOVBECLIFAG-MWLCHTKSSA-N	0	3	332.757	3.448	20	30		EGEDHN
C=CCCCS(=O)(=O)N(CCN1CCCCCC1)C1CCC1	ZINC000489888422	459572762	/nfs/dbraw/zinc/57/27/62/459572762.db2.gz	VJDRSJLWCGEWFX-UHFFFAOYSA-N	0	3	328.522	3.013	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cc(C)cc2c[nH]nc21)C(C)C	ZINC000498367850	459586090	/nfs/dbraw/zinc/58/60/90/459586090.db2.gz	QTVBZOSQMPXIDT-SFHVURJKSA-N	0	3	340.471	3.300	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1F)C(C)C	ZINC000498377695	459588221	/nfs/dbraw/zinc/58/82/21/459588221.db2.gz	RTAYORHRDYGBMV-QGZVFWFLSA-N	0	3	349.406	3.162	20	30		EGEDHN
CN(CCOCc1ccc(C#N)cc1)Cc1ccc2c(c1)ncn2C	ZINC000583839786	459605456	/nfs/dbraw/zinc/60/54/56/459605456.db2.gz	XWMCSCKHEVQVIB-UHFFFAOYSA-N	0	3	334.423	3.094	20	30		EGEDHN
CCCN(C(=O)NC[C@H](C)C#N)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000542875473	459605939	/nfs/dbraw/zinc/60/59/39/459605939.db2.gz	JYYHODUMPCPVIV-MJGOQNOKSA-N	0	3	342.487	3.232	20	30		EGEDHN
C#CCN1C(=O)c2ccccc2N[C@]12CCN(C)[C@@H](c1ccccc1)C2	ZINC000491295321	459613313	/nfs/dbraw/zinc/61/33/13/459613313.db2.gz	GRUIGJSIPQCPTK-IFMALSPDSA-N	0	3	345.446	3.351	20	30		EGEDHN
C#CCN1C(=O)c2ccccc2N[C@@]12CCN(C)[C@H](c1ccccc1)C2	ZINC000491295324	459613623	/nfs/dbraw/zinc/61/36/23/459613623.db2.gz	GRUIGJSIPQCPTK-UNMCSNQZSA-N	0	3	345.446	3.351	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCc2cc3c(s2)CCCC3)CC1	ZINC000592498682	459614756	/nfs/dbraw/zinc/61/47/56/459614756.db2.gz	ILIUFGJFHZOZKM-UHFFFAOYSA-N	0	3	333.501	3.077	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1)C(=O)/C=C/c1cccc(C#N)c1	ZINC000491333571	459616706	/nfs/dbraw/zinc/61/67/06/459616706.db2.gz	GNNPUCUYVHQLNL-VAWYXSNFSA-N	0	3	333.435	3.162	20	30		EGEDHN
C=CCN(CCc1ccco1)C[C@H](O)COc1cc(C)ccc1C	ZINC000491329778	459616742	/nfs/dbraw/zinc/61/67/42/459616742.db2.gz	NZHKUCSSHCKWDO-SFHVURJKSA-N	0	3	329.440	3.367	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC(C)(C)[C@H]2c2ccccc2)CC1	ZINC000592526871	459626391	/nfs/dbraw/zinc/62/63/91/459626391.db2.gz	QKILVNJLEICRSP-GOSISDBHSA-N	0	3	327.472	3.430	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)/C=C\c2cc(C)ccc2OC)CC1	ZINC000491546914	459635471	/nfs/dbraw/zinc/63/54/71/459635471.db2.gz	MQNURLQKWHQOLK-VURMDHGXSA-N	0	3	328.456	3.174	20	30		EGEDHN
N#Cc1cnc(NCC2CCN(Cc3ccncc3)CC2)c(Cl)c1	ZINC000596439335	459636302	/nfs/dbraw/zinc/63/63/02/459636302.db2.gz	AQQUPAWWSOCVEH-UHFFFAOYSA-N	0	3	341.846	3.326	20	30		EGEDHN
C=CCN1CC[C@H](NC(C)(C)c2ccc(OCC(C)C)cc2)C1=O	ZINC000499607664	459641825	/nfs/dbraw/zinc/64/18/25/459641825.db2.gz	SBBZGQCTXCCOGF-SFHVURJKSA-N	0	3	330.472	3.333	20	30		EGEDHN
C=CCN(Cc1ccnc(C)c1)[C@@H](C)c1cccc(-n2cnnn2)c1	ZINC000527531828	459657257	/nfs/dbraw/zinc/65/72/57/459657257.db2.gz	CJHSNXZNZGNMAC-INIZCTEOSA-N	0	3	334.427	3.115	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H](c2ccc(F)c(Cl)c2)C2CC2)CC1	ZINC000491724851	459661397	/nfs/dbraw/zinc/66/13/97/459661397.db2.gz	CQSQNYDPBPEPJM-GOSISDBHSA-N	0	3	348.849	3.392	20	30		EGEDHN
C#C[C@@H](CCC)NC(=O)N(C)CCC1CCN(c2ccncc2)CC1	ZINC000491793628	459675652	/nfs/dbraw/zinc/67/56/52/459675652.db2.gz	LZQHLSPNOUDOJA-SFHVURJKSA-N	0	3	342.487	3.131	20	30		EGEDHN
C#C[C@H](CCC)NC(=O)N(C)CCC1CCN(c2ccncc2)CC1	ZINC000491793627	459675770	/nfs/dbraw/zinc/67/57/70/459675770.db2.gz	LZQHLSPNOUDOJA-GOSISDBHSA-N	0	3	342.487	3.131	20	30		EGEDHN
C#CCCN1CCC(NC(=O)/C=C\c2ccc([C@@H]3C[C@H]3C)o2)CC1	ZINC000491924563	459685333	/nfs/dbraw/zinc/68/53/33/459685333.db2.gz	JSFKOJPEXFQNPK-YZIUAXRGSA-N	0	3	326.440	3.020	20	30		EGEDHN
C[C@@H](O)[C@@H]1CCCN(Cc2cn(CCC#N)nc2-c2ccccc2)C1	ZINC000543748514	459695007	/nfs/dbraw/zinc/69/50/07/459695007.db2.gz	TZRGCVWOCUZKRX-SJLPKXTDSA-N	0	3	338.455	3.057	20	30		EGEDHN
CN(C(=O)C(C[C@H]1CCCO1)C(F)(F)F)c1cccc(C#N)c1	ZINC000593038129	459749525	/nfs/dbraw/zinc/74/95/25/459749525.db2.gz	WILFRLYWSBIUQB-KGLIPLIRSA-N	0	3	326.318	3.269	20	30		EGEDHN
Cc1cccc(C)c1[C@@H](C)NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000564494394	459774313	/nfs/dbraw/zinc/77/43/13/459774313.db2.gz	FBKNGXPDBPDQIU-MJGOQNOKSA-N	0	3	338.451	3.460	20	30		EGEDHN
N#CCCC1CCN(Cc2ccc(CN3CCOCC3)cc2)CC1	ZINC000565597257	459786352	/nfs/dbraw/zinc/78/63/52/459786352.db2.gz	LHEHJGMMJXSGHH-UHFFFAOYSA-N	0	3	327.472	3.035	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CN[C@@H]2CCc3c2cccc3Cl)cc1	ZINC000566059647	459798999	/nfs/dbraw/zinc/79/89/99/459798999.db2.gz	QLLCMUXSNBVYNJ-IFXJQAMLSA-N	0	3	342.826	3.228	20	30		EGEDHN
Cc1cc(NC(=O)[C@]2(C#N)C[C@@H]2C)cc(N2CCN(C(C)C)CC2)c1	ZINC000584821245	459807472	/nfs/dbraw/zinc/80/74/72/459807472.db2.gz	ZMTPIQPQJYNORG-JXFKEZNVSA-N	0	3	340.471	3.014	20	30		EGEDHN
Cc1ccccc1CN(C)C(=O)[C@H](C)N1CCC(CCC#N)CC1	ZINC000566172604	459819301	/nfs/dbraw/zinc/81/93/01/459819301.db2.gz	FXCNBYDOHSYQTA-KRWDZBQOSA-N	0	3	327.472	3.358	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)Cc1ccncc1Cl	ZINC000529565452	459830717	/nfs/dbraw/zinc/83/07/17/459830717.db2.gz	KSDGHFBFLYXZHT-UHFFFAOYSA-N	0	3	328.847	3.170	20	30		EGEDHN
CN(C)CCOc1ccc(CNC(=O)CC2(C#N)CCCCC2)cc1	ZINC000597117179	459842473	/nfs/dbraw/zinc/84/24/73/459842473.db2.gz	JMWAHPROURNSHQ-UHFFFAOYSA-N	0	3	343.471	3.107	20	30		EGEDHN
C[C@@H](CN1CCC(C)CC1)NC(=O)c1cc2ccccc2n1CC#N	ZINC000598266682	459843988	/nfs/dbraw/zinc/84/39/88/459843988.db2.gz	ZGEHLJZHUIVQOF-INIZCTEOSA-N	0	3	338.455	3.015	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CCC=C(c2ccccn2)C1	ZINC000566346904	459847347	/nfs/dbraw/zinc/84/73/47/459847347.db2.gz	KQLKLMQQOUMJKL-GOSISDBHSA-N	0	3	331.419	3.470	20	30		EGEDHN
C[C@H](NCCC(=O)N1CCOc2ccccc21)c1cccc(C#N)c1	ZINC000585816052	459855442	/nfs/dbraw/zinc/85/54/42/459855442.db2.gz	PZHJLIYMTKQQOI-HNNXBMFYSA-N	0	3	335.407	3.025	20	30		EGEDHN
CC1(C)C[C@]1(CNCc1cnc2c(C#N)cnn2c1)c1ccccc1	ZINC000597250200	459895214	/nfs/dbraw/zinc/89/52/14/459895214.db2.gz	BJCWITIRPUMHOD-FQEVSTJZSA-N	0	3	331.423	3.058	20	30		EGEDHN
Cc1cc(C)cc(N(CCC#N)C(=O)CN2CCC[C@H]2C2CC2)c1	ZINC000609133567	459907733	/nfs/dbraw/zinc/90/77/33/459907733.db2.gz	IPASVWFCEVSTSE-IBGZPJMESA-N	0	3	325.456	3.425	20	30		EGEDHN
CN(Cc1ccc(OC(F)(F)F)cc1)C[C@@H](O)CC(C)(C)C#N	ZINC000598588033	459953761	/nfs/dbraw/zinc/95/37/61/459953761.db2.gz	YAGSHVPWVZVPEE-ZDUSSCGKSA-N	0	3	330.350	3.318	20	30		EGEDHN
C[C@H](CCC#N)CN1CCCC[C@H]1C(=O)Nc1ccc2c(c1)CCO2	ZINC000602471845	459954853	/nfs/dbraw/zinc/95/48/53/459954853.db2.gz	LLKKBARNEVNMKB-QAPCUYQASA-N	0	3	341.455	3.354	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN(Cc1cccc(F)c1)C[C@H]1CCCO1	ZINC000598589586	459954939	/nfs/dbraw/zinc/95/49/39/459954939.db2.gz	GYRHGFPWFSCHMD-QZTJIDSGSA-N	0	3	334.435	3.107	20	30		EGEDHN
C[C@@H](NC[C@@H](O)CC(C)(C)C#N)c1nc2ccccc2n1C(F)F	ZINC000598605579	459960687	/nfs/dbraw/zinc/96/06/87/459960687.db2.gz	BXKKKFDEOXEZOD-NEPJUHHUSA-N	0	3	336.386	3.383	20	30		EGEDHN
COc1ccc(CN(C[C@@H](O)CC(C)(C)C#N)CC2CC2)c(OC)c1	ZINC000598619307	459964611	/nfs/dbraw/zinc/96/46/11/459964611.db2.gz	NNPXUYFJHOZTAR-KRWDZBQOSA-N	0	3	346.471	3.217	20	30		EGEDHN
C[C@H]1CN(c2cccc(Cl)c2)CCN1C[C@@H](O)CC(C)(C)C#N	ZINC000598618303	459965831	/nfs/dbraw/zinc/96/58/31/459965831.db2.gz	OOIVIDFYOHPPFP-YOEHRIQHSA-N	0	3	335.879	3.151	20	30		EGEDHN
CC[C@H](C)N[C@H](CNC(=O)N1CCC[C@](C)(C#N)C1)c1ccco1	ZINC000588724793	459975518	/nfs/dbraw/zinc/97/55/18/459975518.db2.gz	YTJTVUXQEOWTNU-HDMKZQKVSA-N	0	3	332.448	3.044	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CC[C@H](N(C)CCc2ccccc2)C1)OCC	ZINC000618354026	459981358	/nfs/dbraw/zinc/98/13/58/459981358.db2.gz	SATYWJDMMDTQRO-VQTJNVASSA-N	0	3	344.499	3.133	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1cc(Cl)c(Br)cc1F	ZINC000602526339	459983414	/nfs/dbraw/zinc/98/34/14/459983414.db2.gz	JSQFKGFVMODZOY-SNVBAGLBSA-N	0	3	348.603	3.201	20	30		EGEDHN
C[C@@H](CCC#N)CN[C@@H]1CCN(c2ccc(C(F)(F)F)cc2)C1=O	ZINC000602545575	459992344	/nfs/dbraw/zinc/99/23/44/459992344.db2.gz	FYVGPKQLFXRQRN-SWLSCSKDSA-N	0	3	339.361	3.340	20	30		EGEDHN
COc1cc(CNC[C@H](CO)c2ccc(Cl)cc2)ccc1C#N	ZINC000588929924	460007011	/nfs/dbraw/zinc/00/70/11/460007011.db2.gz	CZOFJCBQFNOTBP-MRXNPFEDSA-N	0	3	330.815	3.086	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N(CC1CC1)c1cccc(C(F)(F)F)c1	ZINC000602593912	460014392	/nfs/dbraw/zinc/01/43/92/460014392.db2.gz	QROQDVWLDWYJLB-OAHLLOKOSA-N	0	3	339.361	3.470	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)C(=O)N(CCN(C)C)Cc1ccccc1	ZINC000593955658	460026106	/nfs/dbraw/zinc/02/61/06/460026106.db2.gz	UNVLYIBNMOIHCK-GOSISDBHSA-N	0	3	349.478	3.327	20	30		EGEDHN
CCOC(=O)C[C@H](c1ccccc1)C1CCN(C(=O)C(C)C#N)CC1	ZINC000609920243	460039868	/nfs/dbraw/zinc/03/98/68/460039868.db2.gz	WOYJHCISLFXILL-CRAIPNDOSA-N	0	3	342.439	3.122	20	30		EGEDHN
COCCCOc1ccc(CN[C@H](C)CC2(C#N)CCOCC2)cc1	ZINC000602651121	460043418	/nfs/dbraw/zinc/04/34/18/460043418.db2.gz	PLFPUDYRNMWIMR-QGZVFWFLSA-N	0	3	346.471	3.290	20	30		EGEDHN
C[C@@H](CC1(C#N)CCOCC1)NCc1cnccc1C(F)(F)F	ZINC000602713919	460082129	/nfs/dbraw/zinc/08/21/29/460082129.db2.gz	GTRNOEAZJVWRBO-LBPRGKRZSA-N	0	3	327.350	3.289	20	30		EGEDHN
COc1ccc(-c2cnc3c(cnn3C3CCN(C)CC3)c2)c(C#N)c1	ZINC000598929403	460092946	/nfs/dbraw/zinc/09/29/46/460092946.db2.gz	FMVRGTZCNPCWPK-UHFFFAOYSA-N	0	3	347.422	3.245	20	30		EGEDHN
N#Cc1ccc(NC(=O)N[C@H]2CCCN3CCCC[C@@H]23)c(Cl)c1	ZINC000594084980	460094069	/nfs/dbraw/zinc/09/40/69/460094069.db2.gz	UXESAVLUMICXID-HOTGVXAUSA-N	0	3	332.835	3.350	20	30		EGEDHN
C[C@@H](CNC(=O)N[C@@H](C)c1cccc(C#N)c1)N1CCC[C@@H](C)C1	ZINC000610351892	460130770	/nfs/dbraw/zinc/13/07/70/460130770.db2.gz	OBLCHDLJNKWPTC-PMPSAXMXSA-N	0	3	328.460	3.039	20	30		EGEDHN
CCN1CCN(c2ccc(F)cc2[C@H](C)NCC2(CC#N)CC2)CC1	ZINC000602805023	460136349	/nfs/dbraw/zinc/13/63/49/460136349.db2.gz	JRWBVRGRZSMEJU-INIZCTEOSA-N	0	3	344.478	3.312	20	30		EGEDHN
CN(C)CCN(C(=O)N[C@@H]1CCc2cc(C#N)ccc21)C1CCCC1	ZINC000618853378	460198125	/nfs/dbraw/zinc/19/81/25/460198125.db2.gz	JVTLLGVZBOPXHI-LJQANCHMSA-N	0	3	340.471	3.061	20	30		EGEDHN
CCC(C)(C)N1CCN(C(=O)[C@H](C)Cc2ccc(C#N)cc2)CC1	ZINC000594389141	460203463	/nfs/dbraw/zinc/20/34/63/460203463.db2.gz	FTMPSISFVOBKKK-MRXNPFEDSA-N	0	3	327.472	3.070	20	30		EGEDHN
C=CCN(CCc1ccccc1)C[C@@H](O)COc1ccccc1C#N	ZINC000599283549	460218337	/nfs/dbraw/zinc/21/83/37/460218337.db2.gz	YLXRMGRFXFQHPH-HXUWFJFHSA-N	0	3	336.435	3.029	20	30		EGEDHN
Cc1ccc(Cc2ccccn2)cc1NC(=O)[C@@H](N)CCCCC#N	ZINC000594443158	460221681	/nfs/dbraw/zinc/22/16/81/460221681.db2.gz	MNICPDWUTOSUMA-SFHVURJKSA-N	0	3	336.439	3.331	20	30		EGEDHN
CN(Cc1cc2ccccc2o1)C[C@H](O)COc1ccccc1C#N	ZINC000599308250	460223082	/nfs/dbraw/zinc/22/30/82/460223082.db2.gz	RWLSNHDBWKFPMD-KRWDZBQOSA-N	0	3	336.391	3.176	20	30		EGEDHN
C[C@H]1CN(C(=O)Nc2cc(F)cc(C#N)c2)CCN(C2CCC2)C1	ZINC000603071443	460235704	/nfs/dbraw/zinc/23/57/04/460235704.db2.gz	XMLNBXJUUNVPDA-CYBMUJFWSA-N	0	3	330.407	3.035	20	30		EGEDHN
C[C@@H](NC[C@H](O)COc1ccccc1C#N)c1cc2ccccc2o1	ZINC000599358403	460237736	/nfs/dbraw/zinc/23/77/36/460237736.db2.gz	HYKBALRELCWPKJ-PBHICJAKSA-N	0	3	336.391	3.395	20	30		EGEDHN
C[C@@H](NC1CCN(CC#N)CC1)c1sccc1Br	ZINC000610813241	460240974	/nfs/dbraw/zinc/24/09/74/460240974.db2.gz	AZXOXJSRFAGSJZ-SNVBAGLBSA-N	0	3	328.279	3.149	20	30		EGEDHN
N#CCCn1cc(CN2CC[C@@H](c3ccco3)C2)c(-c2ccncc2)n1	ZINC000619073770	460262340	/nfs/dbraw/zinc/26/23/40/460262340.db2.gz	YJVRQZWMOOBGHZ-QGZVFWFLSA-N	0	3	347.422	3.441	20	30		EGEDHN
COCc1cc(C#N)ccc1NCC1CCN(c2ccncc2)CC1	ZINC000603323674	460284379	/nfs/dbraw/zinc/28/43/79/460284379.db2.gz	AQUFEBRGYCAWLV-UHFFFAOYSA-N	0	3	336.439	3.428	20	30		EGEDHN
COc1cc(C#N)ccc1CN1CC[C@H](N(C)Cc2ccccc2)C1	ZINC000611235955	460314043	/nfs/dbraw/zinc/31/40/43/460314043.db2.gz	KOBSWENQJPOKAD-FQEVSTJZSA-N	0	3	335.451	3.273	20	30		EGEDHN
C[C@H](NC[C@H](O)COCc1ccccc1Cl)c1cccc(C#N)c1	ZINC000611388207	460351601	/nfs/dbraw/zinc/35/16/01/460351601.db2.gz	LELLKQZNPGUNJC-KSSFIOAISA-N	0	3	344.842	3.440	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2N[C@H]1CCN(C2CCCCC2)C1=O	ZINC000611394568	460355119	/nfs/dbraw/zinc/35/51/19/460355119.db2.gz	QEJRVFQREGNRSZ-UXHICEINSA-N	0	3	337.467	3.459	20	30		EGEDHN
C[C@@H](CNC(=O)NCc1ccc(C#N)c(Cl)c1)N1CCC[C@H](C)C1	ZINC000619757458	460433745	/nfs/dbraw/zinc/43/37/45/460433745.db2.gz	BQKQULGFUJOZDG-KBPBESRZSA-N	0	3	348.878	3.131	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CC[C@H](c2ccco2)C1)C(C)C	ZINC000601255783	460766272	/nfs/dbraw/zinc/76/62/72/460766272.db2.gz	RKYZVLHOGOSIBY-ZWKOTPCHSA-N	0	3	345.487	3.477	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)c2ccccc2CC#N)CN1Cc1ccccc1	ZINC000601308910	460783879	/nfs/dbraw/zinc/78/38/79/460783879.db2.gz	GXAXSSBBMGCZSL-LPHOPBHVSA-N	0	3	333.435	3.145	20	30		EGEDHN
Cc1cccc(S(=O)(=O)CCCN[C@H](C)c2cccc(C#N)c2)c1	ZINC000613383381	460929350	/nfs/dbraw/zinc/92/93/50/460929350.db2.gz	JJQANXKNTDVDBR-MRXNPFEDSA-N	0	3	342.464	3.381	20	30		EGEDHN
C=CCN(Cc1cc(Br)ccc1F)C(=O)[C@H](C)NCC	ZINC000637968395	461159799	/nfs/dbraw/zinc/15/97/99/461159799.db2.gz	BLJWUVBOZARQFK-NSHDSACASA-N	0	3	343.240	3.101	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)c2ccc(C)c(N3CCOCC3)c2)n1	ZINC000633894811	461320755	/nfs/dbraw/zinc/32/07/55/461320755.db2.gz	SMRSKEAKNHJYAR-OAHLLOKOSA-N	0	3	341.436	3.087	20	30		EGEDHN
C=CCCNC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1	ZINC000665947806	461363840	/nfs/dbraw/zinc/36/38/40/461363840.db2.gz	ZJHFIALHAPPEFO-UHFFFAOYSA-N	0	3	343.393	3.355	20	30		EGEDHN
C=CCN(C(=O)N[C@H](CN)c1ccc2ccccc2c1)[C@@H](C)COC	ZINC000659528903	461372575	/nfs/dbraw/zinc/37/25/75/461372575.db2.gz	YRURLLLZHDZLJT-HNAYVOBHSA-N	0	3	341.455	3.072	20	30		EGEDHN
C[C@H](C[C@H]1CCCC(=O)N1)NCC#Cc1ccc(C(F)(F)F)cc1	ZINC000638897350	461643106	/nfs/dbraw/zinc/64/31/06/461643106.db2.gz	GVEABNGEYRTQAU-CZUORRHYSA-N	0	3	338.373	3.094	20	30		EGEDHN
N#CC(C(=O)c1ccc(Cn2cncn2)cc1)c1nc(C2CC2)cs1	ZINC000647373335	461664116	/nfs/dbraw/zinc/66/41/16/461664116.db2.gz	GIGXYWPKSFELEK-OAHLLOKOSA-N	0	3	349.419	3.150	20	30		EGEDHN
C=CC[C@@H]1N(C(=O)NC2CCN([C@H]3CCOC3)CC2)CCCC1(C)C	ZINC000666977159	461895615	/nfs/dbraw/zinc/89/56/15/461895615.db2.gz	XJMIWFQTZUCOBG-ROUUACIJSA-N	0	3	349.519	3.016	20	30		EGEDHN
C=C(CNC[C@@H](O)COc1ccc(SC)cc1)c1ccccc1	ZINC000644647269	462021619	/nfs/dbraw/zinc/02/16/19/462021619.db2.gz	KOXYIMADLZUKBF-QGZVFWFLSA-N	0	3	329.465	3.451	20	30		EGEDHN
C=CC[C@@H]1CCCN(CC(=O)N[C@@H](C)c2cc(OC)ccc2OC)C1	ZINC000661377761	462223157	/nfs/dbraw/zinc/22/31/57/462223157.db2.gz	UCAJOCXJAUAFBX-JKSUJKDBSA-N	0	3	346.471	3.169	20	30		EGEDHN
C=CCN(CCc1ccccc1)C(=O)N[C@@H]1CCN(C(C)(C)C)C1	ZINC000661505780	462278097	/nfs/dbraw/zinc/27/80/97/462278097.db2.gz	CZZXRFAXRWPCMM-GOSISDBHSA-N	0	3	329.488	3.300	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)N[C@H]2CCCN3CCCC[C@H]23)cc1	ZINC000654561296	462286247	/nfs/dbraw/zinc/28/62/47/462286247.db2.gz	HMFMFJCEEARVCQ-RBUKOAKNSA-N	0	3	343.471	3.068	20	30		EGEDHN
CCN1CCN(Cc2ccccc2CNc2ccc(C#N)c(C)n2)CC1	ZINC000487935168	468061313	/nfs/dbraw/zinc/06/13/13/468061313.db2.gz	YSWGXJZLBFJDTR-UHFFFAOYSA-N	0	3	349.482	3.011	20	30		EGEDHN
Cc1sc(NC(=O)CN[C@@H]2CC(C)(C)OC2(C)C)c(C#N)c1C	ZINC000132443558	534613185	/nfs/dbraw/zinc/61/31/85/534613185.db2.gz	COCFBJKXXUQRDJ-CYBMUJFWSA-N	0	3	335.473	3.111	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cccc(C(F)(F)F)c2)CC1	ZINC000171739351	526440847	/nfs/dbraw/zinc/44/08/47/526440847.db2.gz	VTUUTGQJEJYBGC-UHFFFAOYSA-N	0	3	327.350	3.477	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cccc3c4c([nH]c32)CCCC4)CC1	ZINC000171724043	526448731	/nfs/dbraw/zinc/44/87/31/526448731.db2.gz	JKNHXRQWXNSASW-UHFFFAOYSA-N	0	3	337.467	3.427	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2sc(-c3ccc(C)o3)nc2C)CC1	ZINC000171718737	526449144	/nfs/dbraw/zinc/44/91/44/526449144.db2.gz	QCFIEZMVPCJSEJ-UHFFFAOYSA-N	0	3	345.468	3.400	20	30		EGEDHN
CCO[C@@H]1C[C@@H](NCc2cc(C#N)cs2)[C@@H]1Oc1ccccc1	ZINC000187637616	535409105	/nfs/dbraw/zinc/40/91/05/535409105.db2.gz	HTKBSLHUTGZMHC-KURKYZTESA-N	0	3	328.437	3.334	20	30		EGEDHN
N#CC(C(=O)c1ccc2ncccc2c1)c1nnc2n1CCCCC2	ZINC000179000217	547041536	/nfs/dbraw/zinc/04/15/36/547041536.db2.gz	INRKPBFXSODZPH-HNNXBMFYSA-N	0	3	331.379	3.043	20	30		EGEDHN
C[C@@H](CN(C)C)NC(=O)Nc1cccc(C#Cc2cccs2)c1	ZINC000672624242	548454409	/nfs/dbraw/zinc/45/44/09/548454409.db2.gz	RYDDBOZHFLHQLK-AWEZNQCLSA-N	0	3	327.453	3.220	20	30		EGEDHN
C=CCc1cc(CN2CCC[C@H](n3ccnc3)C2)cc(OC)c1O	ZINC000678234296	549435419	/nfs/dbraw/zinc/43/54/19/549435419.db2.gz	DALKSCQQQMJFFB-KRWDZBQOSA-N	0	3	327.428	3.163	20	30		EGEDHN
C=C[C@H]1CCCCN1C(=O)Nc1cc(C)nn1C1CCN(C)CC1	ZINC000683788738	550261828	/nfs/dbraw/zinc/26/18/28/550261828.db2.gz	CYMIWPLNQKVLDB-HNNXBMFYSA-N	0	3	331.464	3.031	20	30		EGEDHN
C=CCn1c(-c2ccccc2C)nnc1N1C[C@@H](C)N(CC)C[C@H]1C	ZINC000685543377	550427549	/nfs/dbraw/zinc/42/75/49/550427549.db2.gz	FRZQAORDVABOJK-IAGOWNOFSA-N	0	3	339.487	3.358	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=S)Nc1ccc(OC)nc1)C(C)C	ZINC000726899155	574606419	/nfs/dbraw/zinc/60/64/19/574606419.db2.gz	LOCHJOVHVRRAOE-INIZCTEOSA-N	0	3	348.516	3.075	20	30		EGEDHN
C#CCCCOC(=O)C1CCN(c2ccc(Cl)c(Cl)c2)C1=O	ZINC000727039697	574635782	/nfs/dbraw/zinc/63/57/82/574635782.db2.gz	YONDPZPUAWLRAD-GFCCVEGCSA-N	0	3	340.206	3.303	20	30		EGEDHN
C=CCCOC(=O)C1CCN(c2ccc(Cl)c(Cl)c2)C1=O	ZINC000729074120	574811132	/nfs/dbraw/zinc/81/11/32/574811132.db2.gz	CIBJZYLPZAABHU-LLVKDONJSA-N	0	3	328.195	3.466	20	30		EGEDHN
C#CCOc1cccc(NC(=O)NC[C@@H](C)N2CCCC[C@H]2C)c1	ZINC000731111119	575055071	/nfs/dbraw/zinc/05/50/71/575055071.db2.gz	JKQYQTVJPTZYCV-HZPDHXFCSA-N	0	3	329.444	3.083	20	30		EGEDHN
C#CCOc1cccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000731112227	575055379	/nfs/dbraw/zinc/05/53/79/575055379.db2.gz	BOQDMFXBDDYHBD-IBGZPJMESA-N	0	3	349.434	3.095	20	30		EGEDHN
CCCCCNC(=O)C1CCN(Cc2ccc(OCC#N)cc2)CC1	ZINC000731211610	575060653	/nfs/dbraw/zinc/06/06/53/575060653.db2.gz	QSKZFMSLHWDVDK-UHFFFAOYSA-N	0	3	343.471	3.107	20	30		EGEDHN
C=CCN(C(=O)NCc1ccc(OCCN2CCCC2)cc1)C(C)C	ZINC000732473929	575271644	/nfs/dbraw/zinc/27/16/44/575271644.db2.gz	ZPLLMOPEKFJIIE-UHFFFAOYSA-N	0	3	345.487	3.267	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1SC/C=C\Cl	ZINC000732737865	575285645	/nfs/dbraw/zinc/28/56/45/575285645.db2.gz	KVLHVXPDULRLOA-VURMDHGXSA-N	0	3	326.897	3.337	20	30		EGEDHN
CCN(CC(=O)C(C#N)c1nc2ccccc2s1)CC(F)(F)F	ZINC000732808191	575289244	/nfs/dbraw/zinc/28/92/44/575289244.db2.gz	IQQHEELPXUNXEC-SNVBAGLBSA-N	0	3	341.358	3.357	20	30		EGEDHN
Cc1ncc(C=CC(=O)C(C#N)C(=O)Nc2ccccc2Cl)s1	ZINC000732900484	575295218	/nfs/dbraw/zinc/29/52/18/575295218.db2.gz	PCKSPSLDJFWGQF-DGMVEKRQSA-N	0	3	345.811	3.466	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)/C=C/c1cncc(F)c1)C(C)C	ZINC000733162508	575311936	/nfs/dbraw/zinc/31/19/36/575311936.db2.gz	ZPIJQYZANLYVPA-LKGOPFMKSA-N	0	3	331.435	3.049	20	30		EGEDHN
C#CCCOc1ccc(CNCCOc2ccccc2OC)cc1	ZINC000733322762	575327542	/nfs/dbraw/zinc/32/75/42/575327542.db2.gz	CKZYCKFDJHHEIK-UHFFFAOYSA-N	0	3	325.408	3.266	20	30		EGEDHN
C#CCCOc1ccc(CNCCOc2ccc([N+](=O)[O-])cc2)cc1	ZINC000733328179	575328206	/nfs/dbraw/zinc/32/82/06/575328206.db2.gz	QAPPVLNNKGENSG-UHFFFAOYSA-N	0	3	340.379	3.166	20	30		EGEDHN
Cc1nc(CCC(=O)C(C#N)C(=O)Nc2cccc(C)c2)cs1	ZINC000733678922	575381374	/nfs/dbraw/zinc/38/13/74/575381374.db2.gz	ODNADEVZSQXBEZ-OAHLLOKOSA-N	0	3	327.409	3.040	20	30		EGEDHN
N#Cc1ccc(-c2ccn(CN3CCc4ccccc4CC3)n2)cc1	ZINC000738225494	576301943	/nfs/dbraw/zinc/30/19/43/576301943.db2.gz	FENMHGJMDWDOSC-UHFFFAOYSA-N	0	3	328.419	3.480	20	30		EGEDHN
N#CCOc1ccc(CNCc2cnc3ccc(Cl)cn23)cc1	ZINC000738431156	576325274	/nfs/dbraw/zinc/32/52/74/576325274.db2.gz	ZAMVCDIBOJBKGL-UHFFFAOYSA-N	0	3	326.787	3.180	20	30		EGEDHN
C#CCCN1CCC(NC(=O)[C@H](c2ccccc2)[C@H](C)CC)CC1	ZINC000740737736	576621967	/nfs/dbraw/zinc/62/19/67/576621967.db2.gz	UWDOUGDRVQBSFK-XLIONFOSSA-N	0	3	326.484	3.420	20	30		EGEDHN
C#CCOc1ccc(C(=O)NC[C@H]2CCCN2Cc2ccccc2)cc1	ZINC000741565599	576701555	/nfs/dbraw/zinc/70/15/55/576701555.db2.gz	LDBNDIOYCZKONX-HXUWFJFHSA-N	0	3	348.446	3.093	20	30		EGEDHN
C/C(=C\C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1)C(C)(C)C	ZINC000742550805	576789520	/nfs/dbraw/zinc/78/95/20/576789520.db2.gz	VRSZTVLITLFZQB-DTQAZKPQSA-N	0	3	327.472	3.441	20	30		EGEDHN
C#CCCN1CCC(NC(=O)CCc2ccc(C)c(Cl)c2)CC1	ZINC000743492578	576810339	/nfs/dbraw/zinc/81/03/39/576810339.db2.gz	WBVYPTSRLZAEGE-UHFFFAOYSA-N	0	3	332.875	3.185	20	30		EGEDHN
CC(=NNCc1ccc(F)c(F)c1)c1cccc(OCCN(C)C)c1	ZINC000743531422	576811268	/nfs/dbraw/zinc/81/12/68/576811268.db2.gz	WNKNHSVDFFHRJC-UHFFFAOYSA-N	0	3	347.409	3.419	20	30		EGEDHN
N#CC(C(=O)NC1CCCCC1)C(=O)[C@@H]1C[C@@]12CCc1ccccc12	ZINC000744027150	576819068	/nfs/dbraw/zinc/81/90/68/576819068.db2.gz	KEVLLVPFANWQSJ-DJPFJPOOSA-N	0	3	336.435	3.048	20	30		EGEDHN
Cc1cc(Br)c(NC(=O)[C@H](N)CCCC#N)cc1Cl	ZINC000691524440	1298133241	/nfs/dbraw/zinc/13/32/41/1298133241.db2.gz	BTLALVCGJJARTF-LLVKDONJSA-N	0	3	344.640	3.371	20	30		EGEDHN
COCCN(Cc1ccc(C#N)cc1)C[C@@H](O)c1ccc(Cl)cc1	ZINC000069072038	1292228940	/nfs/dbraw/zinc/22/89/40/1292228940.db2.gz	VWFBBCWJHJDAOS-LJQANCHMSA-N	0	3	344.842	3.394	20	30		EGEDHN
C#CCCN(CCOC)Cc1cn(C)nc1-c1cc2ccccc2o1	ZINC000827823809	1292383001	/nfs/dbraw/zinc/38/30/01/1292383001.db2.gz	USVUATOSOQAXKC-UHFFFAOYSA-N	0	3	337.423	3.305	20	30		EGEDHN
C=CCOc1ccccc1CNC[C@@H](O)c1cc(OC)ccc1OC	ZINC000075735053	1292408229	/nfs/dbraw/zinc/40/82/29/1292408229.db2.gz	VVZOFOMSJKAHIJ-GOSISDBHSA-N	0	3	343.423	3.092	20	30		EGEDHN
C#CC[C@H](C)OC(=O)C1CCN(c2cc(Cl)ccc2Cl)C1=O	ZINC000083784182	1292690597	/nfs/dbraw/zinc/69/05/97/1292690597.db2.gz	SYYQJGYXPOBEMM-CMPLNLGQSA-N	0	3	340.206	3.301	20	30		EGEDHN
N#CC(C(=O)COCC1CCCC1)C(=O)Nc1ccc(Cl)cc1	ZINC000835060907	1293195582	/nfs/dbraw/zinc/19/55/82/1293195582.db2.gz	OVAYCVRWOQAGEL-OAHLLOKOSA-N	0	3	334.803	3.194	20	30		EGEDHN
CC[C@@H](CC(F)(F)F)C(=O)C(C#N)C(=O)Nc1ccc(OC)cc1	ZINC000835066186	1293197737	/nfs/dbraw/zinc/19/77/37/1293197737.db2.gz	WMPQLTVTHJIUDW-GXFFZTMASA-N	0	3	342.317	3.321	20	30		EGEDHN
COCCCNC(=O)C(C#N)C(=O)C[C@H](C)c1ccc(C(C)C)cc1	ZINC000121595478	1293379888	/nfs/dbraw/zinc/37/98/88/1293379888.db2.gz	KSSSSDPOEOGIRG-MAUKXSAKSA-N	0	3	344.455	3.165	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)C(=O)NC1CC1)c1cccc(C(F)(F)F)c1	ZINC000121738986	1293386249	/nfs/dbraw/zinc/38/62/49/1293386249.db2.gz	AABXYRXAOORBQE-HZMBPMFUSA-N	0	3	338.329	3.186	20	30		EGEDHN
CCc1ccc([C@@H](C)CC(=O)C(C#N)C(=O)Nc2ccccn2)cc1	ZINC000121866297	1293393487	/nfs/dbraw/zinc/39/34/87/1293393487.db2.gz	NSAWQELJFDIYLU-WMLDXEAASA-N	0	3	335.407	3.485	20	30		EGEDHN
C[C@H](Oc1cccc(C(C)(C)C)c1)C(=O)C(C#N)C(=O)N1CCCC1	ZINC000124839147	1293486767	/nfs/dbraw/zinc/48/67/67/1293486767.db2.gz	XMIULMXVPUWOLY-WMLDXEAASA-N	0	3	342.439	3.083	20	30		EGEDHN
C=C(Br)CNC1CCN(c2ccc(OC)cc2)CC1	ZINC000125084526	1293495018	/nfs/dbraw/zinc/49/50/18/1293495018.db2.gz	OUGDWJPZQXFFOE-UHFFFAOYSA-N	0	3	325.250	3.162	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)c2cc(F)cc(F)c2)cc1	ZINC000128397226	1293592398	/nfs/dbraw/zinc/59/23/98/1293592398.db2.gz	VBSYSSZRNHIRCU-MRXNPFEDSA-N	0	3	328.318	3.488	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)COC2CCCCC2)cc1	ZINC000128542718	1293597848	/nfs/dbraw/zinc/59/78/48/1293597848.db2.gz	AETAPYLJRCQXAN-QGZVFWFLSA-N	0	3	328.412	3.246	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)Cc1cccs1	ZINC000128897786	1293607071	/nfs/dbraw/zinc/60/70/71/1293607071.db2.gz	XXTMGSAUPIBATL-ZDUSSCGKSA-N	0	3	328.393	3.037	20	30		EGEDHN
Cc1cc2occ(CC(=O)C(C#N)C(=O)NC3CC3)c2cc1C(C)C	ZINC000129154184	1293615501	/nfs/dbraw/zinc/61/55/01/1293615501.db2.gz	FOARWNCMDMZOQO-KRWDZBQOSA-N	0	3	338.407	3.395	20	30		EGEDHN
CC[C@@H](C)OCC(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000152351071	1293965305	/nfs/dbraw/zinc/96/53/05/1293965305.db2.gz	RKLULJVBFVRTNC-MWLCHTKSSA-N	0	3	343.210	3.456	20	30		EGEDHN
C=CCc1cc(CN(C)[C@@H]2CCCc3c2cnn3C)c(O)c(OC)c1	ZINC000164540447	1294349898	/nfs/dbraw/zinc/34/98/98/1294349898.db2.gz	JCBLSYFFPUBFNK-QGZVFWFLSA-N	0	3	341.455	3.372	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)CCC2CCOCC2)cc1	ZINC000173968733	1294475317	/nfs/dbraw/zinc/47/53/17/1294475317.db2.gz	ISOXOKPSMAYPNS-QGZVFWFLSA-N	0	3	328.412	3.103	20	30		EGEDHN
CCN(CCCCCCN1C(=O)c2ccccc2C1=O)C[C@@H](C)C#N	ZINC000181194912	1294947652	/nfs/dbraw/zinc/94/76/52/1294947652.db2.gz	VDAAKXRBBRVZGA-INIZCTEOSA-N	0	3	341.455	3.325	20	30		EGEDHN
CC(C)N1CCN(c2ccc(C(=O)O[C@@H]3CC[C@@H](C#N)C3)cc2)CC1	ZINC000183714127	1295139642	/nfs/dbraw/zinc/13/96/42/1295139642.db2.gz	PNHHCKOKJIAFTD-VQIMIIECSA-N	0	3	341.455	3.066	20	30		EGEDHN
N#CCCCOc1cccc(CNCc2ccc(NC(N)=O)cc2)c1	ZINC000237901283	1296270200	/nfs/dbraw/zinc/27/02/00/1296270200.db2.gz	JOFRHXJQWIFDEC-UHFFFAOYSA-N	0	3	338.411	3.150	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN(C)C[C@H]2COc3ccccc3O2)cc1	ZINC000245502893	1296310300	/nfs/dbraw/zinc/31/03/00/1296310300.db2.gz	GZLQTLIISDEYMT-YJBOKZPZSA-N	0	3	338.407	3.249	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2cc(CC#N)ccn2)C1	ZINC000871721045	1296499828	/nfs/dbraw/zinc/49/98/28/1296499828.db2.gz	IXKOUBOMPZSSSP-MAUKXSAKSA-N	0	3	349.438	3.105	20	30		EGEDHN
N#CC(C(=O)C=Cc1ccc(Cl)s1)C(=O)Nc1ccccn1	ZINC000255494317	1296537931	/nfs/dbraw/zinc/53/79/31/1296537931.db2.gz	OGYKGNHZEJDNMQ-QZPNVGJNSA-N	0	3	331.784	3.157	20	30		EGEDHN
CCCN(CCNCc1ccc(OC)c(C#N)c1)C(=O)OC(C)(C)C	ZINC000305384532	1297012478	/nfs/dbraw/zinc/01/24/78/1297012478.db2.gz	WAKSOUJEJNDDDE-UHFFFAOYSA-N	0	3	347.459	3.304	20	30		EGEDHN
C[C@@H](N[C@H](C)c1ccc2[nH]c(=O)[nH]c2c1)c1ccc(OCC#N)cc1	ZINC000327355968	1297248417	/nfs/dbraw/zinc/24/84/17/1297248417.db2.gz	GNTFEMAZEJVMGA-CHWSQXEVSA-N	0	3	336.395	3.170	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)C1CCC=CCC1	ZINC000873498778	1297544732	/nfs/dbraw/zinc/54/47/32/1297544732.db2.gz	YDUQEMREZJPSHB-OAHLLOKOSA-N	0	3	326.396	3.479	20	30		EGEDHN
C#CCN(C[C@H](O)COc1ccccc1F)[C@H]1CCc2ccccc21	ZINC000747528705	1298795405	/nfs/dbraw/zinc/79/54/05/1298795405.db2.gz	NUBMJGONAXHPJE-PXNSSMCTSA-N	0	3	339.410	3.188	20	30		EGEDHN
CC[C@@H](C#N)Oc1cc(CNCc2ccc(CO)cc2)ccc1OC	ZINC000877029543	1299119555	/nfs/dbraw/zinc/11/95/55/1299119555.db2.gz	GSBKWULRFMJNFI-SFHVURJKSA-N	0	3	340.423	3.158	20	30		EGEDHN
Cc1ccc2c(c1)[C@H]1CN(C)CC[C@H]1N2C(=O)c1ccc(C#N)s1	ZINC000749315237	1299191977	/nfs/dbraw/zinc/19/19/77/1299191977.db2.gz	COWNTHUYMZLENM-NVXWUHKLSA-N	0	3	337.448	3.376	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]\CC2(C(=O)OC)CCCC2)c([O-])c1	ZINC000751890613	1299645458	/nfs/dbraw/zinc/64/54/58/1299645458.db2.gz	PDWDSPOWJJXNJG-MOSHPQCFSA-N	0	3	332.444	3.391	20	30		EGEDHN
CC(C)(C#N)CCN1CCC(NC(=O)OCc2ccccc2)CC1	ZINC000879602711	1300622248	/nfs/dbraw/zinc/62/22/48/1300622248.db2.gz	AJKBLAKQCZJKTC-UHFFFAOYSA-N	0	3	329.444	3.317	20	30		EGEDHN
N#Cc1cc(NC(=O)N2CCN(C3CCCCC3)CC2)c(F)cc1F	ZINC000880713994	1301237937	/nfs/dbraw/zinc/23/79/37/1301237937.db2.gz	DPCAUZHLPBDTBX-UHFFFAOYSA-N	0	3	348.397	3.319	20	30		EGEDHN
C#C[C@H](NC1CC(c2cccc(Br)c2)C1)[C@@H]1CCCO1	ZINC000762619692	1301715832	/nfs/dbraw/zinc/71/58/32/1301715832.db2.gz	CIFRABJJEJXCJW-KMZOKZLKSA-N	0	3	334.257	3.466	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCC2(SC)CCCCC2)CC1	ZINC000884162168	1302760093	/nfs/dbraw/zinc/76/00/93/1302760093.db2.gz	XPPYBSZRTKJKPO-UHFFFAOYSA-N	0	3	325.522	3.002	20	30		EGEDHN
C#CCOc1ccc(CN2CCCN(c3ccccc3C#N)CC2)cc1	ZINC000768767233	1302974326	/nfs/dbraw/zinc/97/43/26/1302974326.db2.gz	DCDNLYRTBOVNBT-UHFFFAOYSA-N	0	3	345.446	3.283	20	30		EGEDHN
C#CCN[C@@H](C(=O)N1CCC(Cc2ccccc2)CC1)[C@H](C)CC	ZINC000775384145	1303952812	/nfs/dbraw/zinc/95/28/12/1303952812.db2.gz	CSTINESBQGQSEJ-YLJYHZDGSA-N	0	3	326.484	3.105	20	30		EGEDHN
C#C[C@H](N[C@@H](C)CC(=O)Nc1ccccc1C(C)C)[C@@H]1CCCO1	ZINC000775572549	1303987548	/nfs/dbraw/zinc/98/75/48/1303987548.db2.gz	SEAHIYHYXGUTNN-IEZWGBDMSA-N	0	3	328.456	3.298	20	30		EGEDHN
C#C[C@H](NCc1c(-c2ccccc2)nc2ccccn21)[C@H]1CCCO1	ZINC000775791621	1304038734	/nfs/dbraw/zinc/03/87/34/1304038734.db2.gz	WGMXGYXEOUUMDS-PKOBYXMFSA-N	0	3	331.419	3.272	20	30		EGEDHN
CCN(CC)C(=O)[C@H](Cc1ccccc1)NCc1ccc(C#N)cc1	ZINC000775999603	1304077206	/nfs/dbraw/zinc/07/72/06/1304077206.db2.gz	FSSFPFNAUYPSBH-FQEVSTJZSA-N	0	3	335.451	3.128	20	30		EGEDHN
CN(C)c1ccncc1CN=Nc1ncnc2c3ccccc3oc21	ZINC000776184969	1304108592	/nfs/dbraw/zinc/10/85/92/1304108592.db2.gz	CSNSILCTZTWUMG-UHFFFAOYSA-N	0	3	332.367	3.283	20	30		EGEDHN
Cc1ccc([C@@H](CNC(=O)Cc2ccccc2CC#N)N(C)C)cc1	ZINC000777372327	1304287203	/nfs/dbraw/zinc/28/72/03/1304287203.db2.gz	HIUNSIRKKGAZRF-HXUWFJFHSA-N	0	3	335.451	3.023	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CNCCCn1nc(C)cc1C	ZINC000778152861	1304404190	/nfs/dbraw/zinc/40/41/90/1304404190.db2.gz	XSWAWEKTEJLDBF-UHFFFAOYSA-N	0	3	331.847	3.345	20	30		EGEDHN
Cc1ccccc1CN1CCCN(C(=O)Nc2ccc(C#N)cn2)CC1	ZINC000889220620	1304415906	/nfs/dbraw/zinc/41/59/06/1304415906.db2.gz	DJHTVDJLUJQSCA-UHFFFAOYSA-N	0	3	349.438	3.002	20	30		EGEDHN
CC[C@H](C#N)OC(=O)C1CCN(c2cc(Cl)ccc2Cl)C1=O	ZINC000781167725	1304782531	/nfs/dbraw/zinc/78/25/31/1304782531.db2.gz	RJSYDXQIEJNXFT-GHMZBOCLSA-N	0	3	341.194	3.192	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)CCCc2ccsc2)c1	ZINC000783351156	1305083269	/nfs/dbraw/zinc/08/32/69/1305083269.db2.gz	UUVXROUEMXFLCQ-INIZCTEOSA-N	0	3	342.420	3.427	20	30		EGEDHN
Cc1nc(CC(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)c(C)s1	ZINC000786302762	1305553803	/nfs/dbraw/zinc/55/38/03/1305553803.db2.gz	BDUMJTIBOAESRY-CYBMUJFWSA-N	0	3	347.827	3.303	20	30		EGEDHN
CSCCCCC(=O)C(C#N)C(=O)NCc1cccc(Cl)c1	ZINC000786533530	1305591685	/nfs/dbraw/zinc/59/16/85/1305591685.db2.gz	FJRGOHDMQJNOES-CQSZACIVSA-N	0	3	338.860	3.198	20	30		EGEDHN
C[C@@H]1CC[C@@H](CCC(=O)C(C#N)C(=O)NCc2cccc(Cl)c2)O1	ZINC000786541858	1305594246	/nfs/dbraw/zinc/59/42/46/1305594246.db2.gz	WYLXVORVQRSCEM-KCXAZCMYSA-N	0	3	348.830	3.013	20	30		EGEDHN
C[C@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccc(N2CCNC2=O)cc1	ZINC000787028772	1305678938	/nfs/dbraw/zinc/67/89/38/1305678938.db2.gz	WHZCINIOIMIQCL-VBKZILBWSA-N	0	3	346.434	3.426	20	30		EGEDHN
CC[C@@H](NC(=O)C(C#N)C(=O)CCC(F)(F)F)c1ccccc1	ZINC000787039407	1305682036	/nfs/dbraw/zinc/68/20/36/1305682036.db2.gz	RVIIJARHLYLIER-CHWSQXEVSA-N	0	3	326.318	3.305	20	30		EGEDHN
C#CCn1ccc(CN(CC)C[C@@H](C)Cc2ccc(OC)c(F)c2)n1	ZINC000789758338	1306212500	/nfs/dbraw/zinc/21/25/00/1306212500.db2.gz	KBDWEVHUUYSTQH-INIZCTEOSA-N	0	3	343.446	3.365	20	30		EGEDHN
C#Cc1ccc(C(=O)NC2CCN(Cc3cccc(OC)c3)CC2)cc1	ZINC000895801018	1309527305	/nfs/dbraw/zinc/52/73/05/1309527305.db2.gz	YYMALGLFTNHPMN-UHFFFAOYSA-N	0	3	348.446	3.071	20	30		EGEDHN
C[C@@H](NC[C@H](O)c1ccc(C#N)cc1)c1ccc(Br)cn1	ZINC000796498626	1310015941	/nfs/dbraw/zinc/01/59/41/1310015941.db2.gz	NMKCZAFTAJIHMU-BZNIZROVSA-N	0	3	346.228	3.100	20	30		EGEDHN
N#CC(C(=O)CCc1ccccc1C(N)=O)c1ccc2ccccc2n1	ZINC000796627757	1310049711	/nfs/dbraw/zinc/04/97/11/1310049711.db2.gz	DGPTWVNVFGVDRC-QGZVFWFLSA-N	0	3	343.386	3.143	20	30		EGEDHN
C#CCOc1ccccc1CN[C@@H](C)c1ccccc1-n1ccnn1	ZINC000796816523	1310092713	/nfs/dbraw/zinc/09/27/13/1310092713.db2.gz	KQIOBKRRFZGTHW-INIZCTEOSA-N	0	3	332.407	3.130	20	30		EGEDHN
CC(=O)N[C@@H](CC(C)C)C(=O)C(C#N)c1ncc(C(C)(C)C)s1	ZINC000797570833	1310212523	/nfs/dbraw/zinc/21/25/23/1310212523.db2.gz	LCFJWMKYSIPVRL-OLZOCXBDSA-N	0	3	335.473	3.168	20	30		EGEDHN
CCC(=O)N1CCCC[C@@H]1C(=O)C(C#N)c1ncc(C(C)(C)C)s1	ZINC000797572861	1310214403	/nfs/dbraw/zinc/21/44/03/1310214403.db2.gz	JUFJRGOOCSGOMC-CHWSQXEVSA-N	0	3	347.484	3.408	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)CCCC2CCOCC2)cc1	ZINC000798815937	1310445866	/nfs/dbraw/zinc/44/58/66/1310445866.db2.gz	FVLNOGBYTOULLB-GOSISDBHSA-N	0	3	342.439	3.493	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)[C@H]1CCCC(F)(F)C1	ZINC000800386487	1310747468	/nfs/dbraw/zinc/74/74/68/1310747468.db2.gz	KTIDHGVSKLUYPT-NWDGAFQWSA-N	0	3	336.338	3.168	20	30		EGEDHN
C#CCCOc1ccc(C(=O)NC[C@H](c2ccccc2)N(C)C)cc1	ZINC000822199590	1320061494	/nfs/dbraw/zinc/06/14/94/1320061494.db2.gz	ZRUZJCWSGLMFDT-HXUWFJFHSA-N	0	3	336.435	3.121	20	30		EGEDHN
C#CC1CCN(C(=O)NC[C@H](c2ccc(C)cc2)N2CCCC2)CC1	ZINC000826020547	1320378841	/nfs/dbraw/zinc/37/88/41/1320378841.db2.gz	VBNVSXACLVSQES-HXUWFJFHSA-N	0	3	339.483	3.187	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N(CCCC)[C@H](C)c1ccc(C)o1	ZINC000836488887	1320494243	/nfs/dbraw/zinc/49/42/43/1320494243.db2.gz	SYTQWTHSLIGFBX-QGZVFWFLSA-N	0	3	333.476	3.416	20	30		EGEDHN
Cc1ccc(C(=O)N2CCN(Cc3ccccc3)C[C@@H](C)C2)cc1C#N	ZINC000836921048	1320554346	/nfs/dbraw/zinc/55/43/46/1320554346.db2.gz	WSDFUIMSCBEVLY-QGZVFWFLSA-N	0	3	347.462	3.461	20	30		EGEDHN
COc1cc(C#N)ccc1C(=O)NC[C@H](c1ccccc1)N1CCCC1	ZINC000929474840	1328608335	/nfs/dbraw/zinc/60/83/35/1328608335.db2.gz	YPDKUNAKHLKTJE-LJQANCHMSA-N	0	3	349.434	3.134	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3ccccc3N(C)C)C2)CC1	ZINC001019330955	1317172011	/nfs/dbraw/zinc/17/20/11/1317172011.db2.gz	FTBCIKXCADWJKN-IBGZPJMESA-N	0	3	341.499	3.190	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@H](NCc3ccc(F)c(C#N)c3)C2)cs1	ZINC001019515095	1317281661	/nfs/dbraw/zinc/28/16/61/1317281661.db2.gz	MBFUDMVGLDJROH-INIZCTEOSA-N	0	3	343.427	3.072	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@H](NCc2ccc(C#N)s2)C1)C1CCCC1	ZINC001019632180	1317311504	/nfs/dbraw/zinc/31/15/04/1317311504.db2.gz	DDXCQUWIYTULCJ-ZFWWWQNUSA-N	0	3	331.485	3.137	20	30		EGEDHN
CCC(=O)N1CCC2(CCN(Cc3ccc(C#N)s3)CC2)CC1	ZINC000957481581	1317390140	/nfs/dbraw/zinc/39/01/40/1317390140.db2.gz	KSDLHKICOHBSII-UHFFFAOYSA-N	0	3	331.485	3.234	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)sc1C	ZINC001019750371	1317399095	/nfs/dbraw/zinc/39/90/95/1317399095.db2.gz	KBOGRKCTRIKFAX-ZDUSSCGKSA-N	0	3	345.493	3.302	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)c3ccc(CF)cc3)C2)s1	ZINC001019843074	1317445705	/nfs/dbraw/zinc/44/57/05/1317445705.db2.gz	VDERFEHDFGVCLG-HNNXBMFYSA-N	0	3	343.427	3.094	20	30		EGEDHN
C#C[C@@H](CCC)NC(=O)Nc1ccc(CCN2CCSCC2)cc1	ZINC000806244246	1317474233	/nfs/dbraw/zinc/47/42/33/1317474233.db2.gz	ZDQCSHLEFWTHNW-KRWDZBQOSA-N	0	3	345.512	3.201	20	30		EGEDHN
C#CCN(Cc1ccccc1)C(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000806309589	1317478749	/nfs/dbraw/zinc/47/87/49/1317478749.db2.gz	HUMFXKSMNHOOAE-NRFANRHFSA-N	0	3	347.462	3.106	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC2(CCN(Cc3cnoc3C)CC2)CC1	ZINC000957587846	1317480406	/nfs/dbraw/zinc/48/04/06/1317480406.db2.gz	DLRWJOQULUJCJK-UHFFFAOYSA-N	0	3	345.487	3.400	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H](CN2CCCCC2)c2ccccc2)c1	ZINC000806922880	1317537380	/nfs/dbraw/zinc/53/73/80/1317537380.db2.gz	VIEYGCVGEMEQOA-FQEVSTJZSA-N	0	3	333.435	3.020	20	30		EGEDHN
Cc1csc(C(=O)N[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)c1	ZINC001020131577	1317554731	/nfs/dbraw/zinc/55/47/31/1317554731.db2.gz	OKVUMXMOCBFEJZ-SHTZXODSSA-N	0	3	343.427	3.118	20	30		EGEDHN
C#C[C@@H](NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)C(C)(C)C	ZINC000807882068	1317598336	/nfs/dbraw/zinc/59/83/36/1317598336.db2.gz	ICEYWTWNDFXDLV-FUHWJXTLSA-N	0	3	330.447	3.202	20	30		EGEDHN
CC[C@H](N[C@@H](C)C(=O)NCCc1ccccc1)c1cccc(C#N)c1	ZINC000903010401	1317639754	/nfs/dbraw/zinc/63/97/54/1317639754.db2.gz	LIIDSMDIXAZWRD-JXFKEZNVSA-N	0	3	335.451	3.346	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)Cc2ccc(C(F)F)cc2)C1	ZINC001020387064	1317674484	/nfs/dbraw/zinc/67/44/84/1317674484.db2.gz	KIOOGJSIVUDBTQ-HDJSIYSDSA-N	0	3	328.790	3.156	20	30		EGEDHN
COc1ccc(CN[C@@H]2CCc3c2ccc(OC)c3F)cc1C#N	ZINC000808709002	1317719645	/nfs/dbraw/zinc/71/96/45/1317719645.db2.gz	SLWXYSIZGYSHLU-MRXNPFEDSA-N	0	3	326.371	3.492	20	30		EGEDHN
C[C@@H]1CCC[C@@H](C(=O)N[C@H]2C[C@H](NCc3ccc(C#N)cc3F)C2)C1	ZINC001020524707	1317744106	/nfs/dbraw/zinc/74/41/06/1317744106.db2.gz	XTUJOHJKBMSYQP-MOIQIXESSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H]2CCc3ccc(Cl)cc32)CC1	ZINC000858236240	1328718793	/nfs/dbraw/zinc/71/87/93/1328718793.db2.gz	FSZMDAPHXZBKMF-KRWDZBQOSA-N	0	3	333.863	3.277	20	30		EGEDHN
CC(C)n1ncc2cc(/C=C3\C(=O)c4ncnn4C3C)c(Cl)nc21	ZINC000905079887	1317920845	/nfs/dbraw/zinc/92/08/45/1317920845.db2.gz	GNNAIGIAQKODFA-UKWOQQOSSA-N	0	3	342.790	3.098	20	30		EGEDHN
CCCCOc1cc(/C=C2\C(=O)c3ncnn3C2C)ccc1OC	ZINC000905081212	1317921620	/nfs/dbraw/zinc/92/16/20/1317921620.db2.gz	PYJHZKFEQOHTGN-CJAAZZPWSA-N	0	3	327.384	3.307	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NCC(C)(C)N1CCc2ccccc2C1	ZINC000810081566	1317949312	/nfs/dbraw/zinc/94/93/12/1317949312.db2.gz	NAVROWSURLBZMU-UHFFFAOYSA-N	0	3	346.474	3.164	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000810464410	1318011053	/nfs/dbraw/zinc/01/10/53/1318011053.db2.gz	BCUUELDEAPYKAW-JOCHJYFZSA-N	0	3	346.474	3.333	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cnc(C(C)(C)C)s2)C1	ZINC001021099093	1318081725	/nfs/dbraw/zinc/08/17/25/1318081725.db2.gz	MVEDWFJENYQHEL-XYPYZODXSA-N	0	3	327.881	3.044	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)[C@H]2CCCC(C)(C)C2)C1	ZINC001021107468	1318089577	/nfs/dbraw/zinc/08/95/77/1318089577.db2.gz	JBQKGOJWNHMXQJ-IHRRRGAJSA-N	0	3	343.309	3.348	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCCC[C@H]1CNCc1cc(C#N)ccc1OC	ZINC000959891118	1318254102	/nfs/dbraw/zinc/25/41/02/1318254102.db2.gz	YZMWMZIMEDXTFZ-YJBOKZPZSA-N	0	3	343.471	3.084	20	30		EGEDHN
CC(C)Oc1ccccc1CNC[C@@H]1CCCCN1C(=O)[C@H](C)C#N	ZINC000959918284	1318265941	/nfs/dbraw/zinc/26/59/41/1318265941.db2.gz	DZXIPLZPSJCKHZ-AEFFLSMTSA-N	0	3	343.471	3.104	20	30		EGEDHN
C[C@H](C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)c(F)c1)C1CC1	ZINC000959941345	1318276850	/nfs/dbraw/zinc/27/68/50/1318276850.db2.gz	CDBUSUNYSSQRIG-KSSFIOAISA-N	0	3	343.446	3.214	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)C=C2CCC2)c(F)c1	ZINC000959951625	1318284870	/nfs/dbraw/zinc/28/48/70/1318284870.db2.gz	VXHLFRKZRRXKJA-SFHVURJKSA-N	0	3	341.430	3.278	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)cc1F	ZINC000960101392	1318356535	/nfs/dbraw/zinc/35/65/35/1318356535.db2.gz	OYSHIPUVRPQJEP-FUHWJXTLSA-N	0	3	349.425	3.162	20	30		EGEDHN
C#C[C@@H](CCC)NC(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000812380518	1318378751	/nfs/dbraw/zinc/37/87/51/1318378751.db2.gz	GBAFZJGCBYWMQY-PKOBYXMFSA-N	0	3	345.487	3.178	20	30		EGEDHN
C#C[C@@H](NC(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C)C(C)C	ZINC000812380304	1318378996	/nfs/dbraw/zinc/37/89/96/1318378996.db2.gz	BUKQDIYXLNEKBZ-RTBURBONSA-N	0	3	345.487	3.034	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)Cc1cccs1	ZINC000960239660	1318425506	/nfs/dbraw/zinc/42/55/06/1318425506.db2.gz	FPWPKBCUKDPJPL-IEBWSBKVSA-N	0	3	326.465	3.239	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cccc(C)c2F)C1	ZINC001021590959	1318436558	/nfs/dbraw/zinc/43/65/58/1318436558.db2.gz	FYNDIVRDCGNIJW-WMZOPIPTSA-N	0	3	328.431	3.084	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2Cc3ccccc3[C@H]2NCC(=C)C)cc1	ZINC000960292623	1318447177	/nfs/dbraw/zinc/44/71/77/1318447177.db2.gz	FCWMRRLXHIHAGC-NHCUHLMSSA-N	0	3	330.431	3.229	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1csc(C)n1	ZINC000960296472	1318449380	/nfs/dbraw/zinc/44/93/80/1318449380.db2.gz	PDUSUVVZYQLGRP-NVXWUHKLSA-N	0	3	327.453	3.013	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@H]1CCc2cccnc21	ZINC000960300247	1318450606	/nfs/dbraw/zinc/45/06/06/1318450606.db2.gz	NKSNWCIRLQMANA-QKNQBKEWSA-N	0	3	347.462	3.059	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1nc(CC)oc1C	ZINC000960314833	1318456828	/nfs/dbraw/zinc/45/68/28/1318456828.db2.gz	TXCIMLIBSHVVNH-VQIMIIECSA-N	0	3	339.439	3.107	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1csc(C(C)C)n1	ZINC000960316569	1318457825	/nfs/dbraw/zinc/45/78/25/1318457825.db2.gz	GWICDUFQJYBIMN-NVXWUHKLSA-N	0	3	341.480	3.438	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)Cn1ccc2ccccc21	ZINC000960329079	1318463551	/nfs/dbraw/zinc/46/35/51/1318463551.db2.gz	JRWLAKMMSRDLCX-DENIHFKCSA-N	0	3	345.446	3.199	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)Cc2ccc(C)cc2Cl)C1	ZINC001021617645	1318466560	/nfs/dbraw/zinc/46/65/60/1318466560.db2.gz	WXOJPBGXPWCWHR-HKUYNNGSSA-N	0	3	344.886	3.137	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc(F)s1	ZINC000960333446	1318467002	/nfs/dbraw/zinc/46/70/02/1318467002.db2.gz	LTTXKLNUHKGOPK-RHSMWYFYSA-N	0	3	330.428	3.449	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(C)c(F)c2)C1	ZINC001021627685	1318480111	/nfs/dbraw/zinc/48/01/11/1318480111.db2.gz	OTLQSQCVRVSKIZ-IEBWSBKVSA-N	0	3	328.431	3.084	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cn(C)c3ccccc23)C1	ZINC001021628485	1318481940	/nfs/dbraw/zinc/48/19/40/1318481940.db2.gz	WLVOPCMCVWTRCB-YLJYHZDGSA-N	0	3	349.478	3.128	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc3c(ccc(C)c3C)[nH]2)C1	ZINC001021651758	1318512713	/nfs/dbraw/zinc/51/27/13/1318512713.db2.gz	FOGXHENDPNDKPF-LAUBAEHRSA-N	0	3	349.478	3.344	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(F)cc(Cl)c2)C1	ZINC001021678585	1318548024	/nfs/dbraw/zinc/54/80/24/1318548024.db2.gz	YYJZABUYPNMDRG-DYVFJYSZSA-N	0	3	334.822	3.039	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cccc(F)c2Cl)C1	ZINC001021678231	1318548289	/nfs/dbraw/zinc/54/82/89/1318548289.db2.gz	WRYMPDZEQPVTCJ-XJKSGUPXSA-N	0	3	334.822	3.039	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC[C@H]1CN(C)Cc1ccc(OC)c(C#N)c1	ZINC000960452255	1318573205	/nfs/dbraw/zinc/57/32/05/1318573205.db2.gz	SBZFYMCZXFVRPG-YJBOKZPZSA-N	0	3	343.471	3.036	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc3cnccc3c2)C1	ZINC001021709787	1318586955	/nfs/dbraw/zinc/58/69/55/1318586955.db2.gz	LISYNMCCUJTCOX-NHCUHLMSSA-N	0	3	347.462	3.185	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)CCC1CC1	ZINC000960489226	1318599557	/nfs/dbraw/zinc/59/95/57/1318599557.db2.gz	CAIBYBHHMWAMLW-LJQANCHMSA-N	0	3	325.456	3.171	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc3[nH]ccc3s2)C1	ZINC001021723600	1318611934	/nfs/dbraw/zinc/61/19/34/1318611934.db2.gz	VMOPJOFSHCJTNI-GOEBONIOSA-N	0	3	341.480	3.179	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(CF)cc2)C1	ZINC001021742270	1318654382	/nfs/dbraw/zinc/65/43/82/1318654382.db2.gz	CWAYSGDRXRJWQY-MOPGFXCFSA-N	0	3	328.431	3.106	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cccc3c2CCC3)C1	ZINC001021742073	1318654812	/nfs/dbraw/zinc/65/48/12/1318654812.db2.gz	BTAPRXZOSKIMSP-WIYYLYMNSA-N	0	3	336.479	3.125	20	30		EGEDHN
Cc1ccc(C#N)cc1C(=O)NCCCN1CCc2ccccc2C1	ZINC000930075698	1328779680	/nfs/dbraw/zinc/77/96/80/1328779680.db2.gz	XRKIUFXMTLVNEV-UHFFFAOYSA-N	0	3	333.435	3.045	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC001022091563	1318795087	/nfs/dbraw/zinc/79/50/87/1318795087.db2.gz	FIPWHMKKSOQHBZ-PHIMTYICSA-N	0	3	332.753	3.366	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)[C@@H]1CCC1(F)F	ZINC000960692113	1318796153	/nfs/dbraw/zinc/79/61/53/1318796153.db2.gz	HYOZREJHIQKSNA-IRXDYDNUSA-N	0	3	347.409	3.026	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H]1CN(C)Cc1ccc(C#N)cc1)C1CCC1	ZINC000960712814	1318817404	/nfs/dbraw/zinc/81/74/04/1318817404.db2.gz	SYXIRHYQYZRNRQ-UZLBHIALSA-N	0	3	339.483	3.417	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@@H](NC(=O)[C@@H]3CCCC34CC4)C2)c1	ZINC001022280528	1318874198	/nfs/dbraw/zinc/87/41/98/1318874198.db2.gz	JRDRAXQVFUIQBB-BBWFWOEESA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2c(C)occ2C(F)(F)F)C1	ZINC001022442814	1318943385	/nfs/dbraw/zinc/94/33/85/1318943385.db2.gz	QANXPKAJPGZUKS-AOOOYVTPSA-N	0	3	336.741	3.210	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cnc3ccccc3c2C)C1	ZINC001022446973	1318946582	/nfs/dbraw/zinc/94/65/82/1318946582.db2.gz	YBJHGVKVKOZLMS-OKILXGFUSA-N	0	3	329.831	3.146	20	30		EGEDHN
COc1ccc(C(C)N=Nc2ncccn2)cc1CN1CCCCC1	ZINC000912974466	1318958583	/nfs/dbraw/zinc/95/85/83/1318958583.db2.gz	XLQGOTXPQQBZBJ-UHFFFAOYSA-N	0	3	339.443	3.307	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)C1(CF)CCC1	ZINC000960872866	1319015417	/nfs/dbraw/zinc/01/54/17/1319015417.db2.gz	JBMVKFNMZGUNCW-SFHVURJKSA-N	0	3	343.446	3.121	20	30		EGEDHN
CO[C@@H]1CCC[C@H](C(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)C1	ZINC000815906526	1319072053	/nfs/dbraw/zinc/07/20/53/1319072053.db2.gz	BUXDYJHKGQXCRD-GLQYFDAESA-N	0	3	334.803	3.193	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)c2ccsc2Cl)C1	ZINC001022810222	1319119852	/nfs/dbraw/zinc/11/98/52/1319119852.db2.gz	LHIJUGQXEKJHII-DTORHVGOSA-N	0	3	349.681	3.161	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC(C(C)(C)CNC/C(Cl)=C/Cl)CC1	ZINC001101521933	1364596855	/nfs/dbraw/zinc/59/68/55/1364596855.db2.gz	HFGUZMNDBPJFAP-QENILXLESA-N	0	3	346.302	3.319	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@@H](NC(=O)[C@H]3CC34CCCC4)C2)c1	ZINC001022936849	1319179889	/nfs/dbraw/zinc/17/98/89/1319179889.db2.gz	XAXMMMVFASFQCD-IXDOHACOSA-N	0	3	341.430	3.014	20	30		EGEDHN
CC(=O)N1CCC[C@@H]([C@H]2CCN(CC#Cc3cccc(Cl)c3)C2)C1	ZINC000961079928	1319192181	/nfs/dbraw/zinc/19/21/81/1319192181.db2.gz	RFUGWFMYMRZZHZ-MOPGFXCFSA-N	0	3	344.886	3.272	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)c2cc(C)ccc2C)C1	ZINC001023020366	1319224665	/nfs/dbraw/zinc/22/46/65/1319224665.db2.gz	AHCBQTLVLRGHLM-OKILXGFUSA-N	0	3	337.261	3.062	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc(OCC(C)C)cc2)C1	ZINC001023055054	1319242697	/nfs/dbraw/zinc/24/26/97/1319242697.db2.gz	RIYZLGJULUGNCP-IYBDPMFKSA-N	0	3	336.863	3.324	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@@H](NC(=O)C3CCC=CCC3)C2)c1	ZINC001023100338	1319259778	/nfs/dbraw/zinc/25/97/78/1319259778.db2.gz	HWZKMSDAUKHOEI-HDICACEKSA-N	0	3	341.430	3.181	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)[C@H]2CCCC(C)(C)C2)C1	ZINC001023142222	1319285797	/nfs/dbraw/zinc/28/57/97/1319285797.db2.gz	JBQKGOJWNHMXQJ-MELADBBJSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)C2CC(c3cccc(F)c3)C2)C1	ZINC001023169391	1319304727	/nfs/dbraw/zinc/30/47/27/1319304727.db2.gz	SOLCCJSAEKYPNV-KZNFOHLHSA-N	0	3	336.838	3.309	20	30		EGEDHN
CC(=O)N1CCC([C@@H]2CCCN(Cc3cc(C#N)ccc3F)C2)CC1	ZINC000961308918	1319468349	/nfs/dbraw/zinc/46/83/49/1319468349.db2.gz	UXCOTDXRDWJIGI-GOSISDBHSA-N	0	3	343.446	3.168	20	30		EGEDHN
C#CCN1CCC[C@@H](CNC(=O)c2csc3cc(C)ccc23)C1	ZINC001023392057	1319499097	/nfs/dbraw/zinc/49/90/97/1319499097.db2.gz	KCMSOFZBTBWJNS-HNNXBMFYSA-N	0	3	326.465	3.285	20	30		EGEDHN
C#CCN(C)CCCNC(=O)C(C)(C)c1cccc(C(F)(F)F)c1	ZINC000818595683	1319565908	/nfs/dbraw/zinc/56/59/08/1319565908.db2.gz	JRRGWJGYFOMGCK-UHFFFAOYSA-N	0	3	340.389	3.054	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc3c4c(cccc42)CC3)C1	ZINC001023475359	1319576271	/nfs/dbraw/zinc/57/62/71/1319576271.db2.gz	XGHYYZNLCQWNGG-QGZVFWFLSA-N	0	3	346.474	3.404	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](C2CCN(C(=O)Cc3ccc[nH]3)CC2)C1	ZINC000961434883	1319589128	/nfs/dbraw/zinc/58/91/28/1319589128.db2.gz	JGZWGNFNEUATMF-QGZVFWFLSA-N	0	3	349.906	3.260	20	30		EGEDHN
C=C1CCC(C(=O)NC2[C@H]3CN(C/C=C\c4ccccc4)C[C@@H]23)CC1	ZINC000961680056	1319694984	/nfs/dbraw/zinc/69/49/84/1319694984.db2.gz	WDJMBCPEAPWPTM-CZJVNKAVSA-N	0	3	336.479	3.493	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2[C@H]3CN(Cc4ccc(F)cc4C)C[C@H]32)CC1	ZINC000961688295	1319699550	/nfs/dbraw/zinc/69/95/50/1319699550.db2.gz	PROBUXZPQZLFPG-PMOLBWCYSA-N	0	3	342.458	3.427	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc(C(C)C)nc2CC)C1	ZINC001023591719	1319711621	/nfs/dbraw/zinc/71/16/21/1319711621.db2.gz	IUSCNKMFMHWAAW-QGZVFWFLSA-N	0	3	341.499	3.233	20	30		EGEDHN
Cc1ccc(SCC(=O)C(C#N)C(=O)NC2CCCC2)c(C)c1	ZINC000917040821	1319742529	/nfs/dbraw/zinc/74/25/29/1319742529.db2.gz	MSZCOJZKWMBUBH-OAHLLOKOSA-N	0	3	330.453	3.163	20	30		EGEDHN
C#CCN1CCC[C@H](CNC(=O)c2ccc(Cl)c(CCC)c2)C1	ZINC001023697650	1319823410	/nfs/dbraw/zinc/82/34/10/1319823410.db2.gz	CWWRJVQQSUGOAQ-OAHLLOKOSA-N	0	3	332.875	3.368	20	30		EGEDHN
CC1(C(=O)NC2CC(CNCc3cc(C#N)ccc3F)C2)CCCC1	ZINC000962143579	1319835948	/nfs/dbraw/zinc/83/59/48/1319835948.db2.gz	STYABEXYOFNLKF-UHFFFAOYSA-N	0	3	343.446	3.262	20	30		EGEDHN
C[C@]1(C(=O)NC2CC(CNCc3cc(C#N)ccc3F)C2)C=CCC1	ZINC000962183789	1319847330	/nfs/dbraw/zinc/84/73/30/1319847330.db2.gz	COXVDGGQBZXNQU-LAGYLCCXSA-N	0	3	341.430	3.038	20	30		EGEDHN
C=C1CCC(C(=O)NC2CC(CNCc3nc(C)cs3)C2)CC1	ZINC000962259557	1319886067	/nfs/dbraw/zinc/88/60/67/1319886067.db2.gz	MMQGIPMEQLYMQM-UHFFFAOYSA-N	0	3	333.501	3.182	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccccc2CC(C)C)C1	ZINC001023770150	1319919388	/nfs/dbraw/zinc/91/93/88/1319919388.db2.gz	RHJPTYAZEAJPJH-GOSISDBHSA-N	0	3	326.484	3.350	20	30		EGEDHN
C#C[C@@H](NC(=O)N1CCN(C2CCCCC2)CC1)c1ccccc1	ZINC000820599929	1319919400	/nfs/dbraw/zinc/91/94/00/1319919400.db2.gz	RAPZDDKKNVZOFT-LJQANCHMSA-N	0	3	325.456	3.021	20	30		EGEDHN
C#C[C@@H](NC(=O)N(CCN(C)C)Cc1ccccc1)c1ccccc1	ZINC000820605008	1319920944	/nfs/dbraw/zinc/92/09/44/1319920944.db2.gz	IVKYLDDVGQDXEL-HXUWFJFHSA-N	0	3	335.451	3.134	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N[C@H](C)c1ccccc1C(F)(F)F	ZINC000836252003	1320464883	/nfs/dbraw/zinc/46/48/83/1320464883.db2.gz	FFQMJJNXVYKICB-CYBMUJFWSA-N	0	3	341.377	3.021	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1ccc(N2CCCC2)c(Cl)c1	ZINC000838622789	1320795848	/nfs/dbraw/zinc/79/58/48/1320795848.db2.gz	NFWNPGUIHARFRS-UHFFFAOYSA-N	0	3	348.878	3.017	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1cc(Cl)ccc1SC	ZINC000838623199	1320796056	/nfs/dbraw/zinc/79/60/56/1320796056.db2.gz	USBIRDHZJULZOA-UHFFFAOYSA-N	0	3	325.865	3.139	20	30		EGEDHN
CC[C@H](OC1CCCC1)C(=O)C(C#N)C(=O)Nc1ccccc1OC	ZINC000842289533	1321368034	/nfs/dbraw/zinc/36/80/34/1321368034.db2.gz	QROKRELVTKJGAE-HOCLYGCPSA-N	0	3	344.411	3.080	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)c1ccc(C)c(C)n1	ZINC000842290044	1321368122	/nfs/dbraw/zinc/36/81/22/1321368122.db2.gz	YRIFYKVZSSAHAP-AWEZNQCLSA-N	0	3	337.379	3.058	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C(C)C)[C@H]2CCN(Cc3ccccc3)C2)nc1	ZINC000843695467	1321537034	/nfs/dbraw/zinc/53/70/34/1321537034.db2.gz	BFPFBXLYTRWOMN-FQEVSTJZSA-N	0	3	347.462	3.188	20	30		EGEDHN
C=CCC(F)(F)C(=O)N1CCN(c2ccnc3ccccc32)CC1	ZINC000846651940	1321798356	/nfs/dbraw/zinc/79/83/56/1321798356.db2.gz	AVAXDCDZMZJNGA-UHFFFAOYSA-N	0	3	331.366	3.095	20	30		EGEDHN
C#CCOc1ccccc1NC(=O)N1CCN(C(C)(C)CC)CC1	ZINC000847171681	1321847958	/nfs/dbraw/zinc/84/79/58/1321847958.db2.gz	JHAGYOBUKDJNQV-UHFFFAOYSA-N	0	3	329.444	3.037	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(Cl)c(Cl)nc2C)CC1	ZINC000847451150	1321872350	/nfs/dbraw/zinc/87/23/50/1321872350.db2.gz	IHOQACBCPAYAAK-UHFFFAOYSA-N	0	3	342.270	3.467	20	30		EGEDHN
[O-]c1ccc(Cl)cc1/C=N/CC1CC[NH+](C2CCOCC2)CC1	ZINC000849169305	1322093603	/nfs/dbraw/zinc/09/36/03/1322093603.db2.gz	DUBIZCLCVSLMCV-DEDYPNTBSA-N	0	3	336.863	3.356	20	30		EGEDHN
CCO[C@H](CC)C(=O)C(C#N)C(=O)Nc1c(CC)cccc1CC	ZINC000920109255	1322137751	/nfs/dbraw/zinc/13/77/51/1322137751.db2.gz	NDARZBCKCZJIQM-HZPDHXFCSA-N	0	3	330.428	3.274	20	30		EGEDHN
CCc1cccc(CC)c1NC(=O)C(C#N)C(=O)[C@H](C)OCC1CC1	ZINC000920789814	1322223018	/nfs/dbraw/zinc/22/30/18/1322223018.db2.gz	GNAJWDMWJDVBHZ-SUMWQHHRSA-N	0	3	342.439	3.274	20	30		EGEDHN
C[C@H]1CN(Cc2ccc(OCC#N)cc2)CC[C@@H]1C(=O)OC(C)(C)C	ZINC000859614830	1329035176	/nfs/dbraw/zinc/03/51/76/1329035176.db2.gz	JVLHAXHQDHARQA-YJBOKZPZSA-N	0	3	344.455	3.389	20	30		EGEDHN
C#Cc1cncc(-c2noc(-c3ccc(CN4CCCCC4)o3)n2)c1	ZINC000924096071	1322899740	/nfs/dbraw/zinc/89/97/40/1322899740.db2.gz	VXSFBFPAYCMTMW-UHFFFAOYSA-N	0	3	334.379	3.359	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](CNCc2nc(C)c(C)s2)C1	ZINC001024093632	1323125524	/nfs/dbraw/zinc/12/55/24/1323125524.db2.gz	YHDOUYQQDOENCZ-HNNXBMFYSA-N	0	3	335.517	3.300	20	30		EGEDHN
CC(C)(C(=O)N1CCC[C@H](CNCc2ccccc2C#N)C1)C1CC1	ZINC001024111049	1323142919	/nfs/dbraw/zinc/14/29/19/1323142919.db2.gz	FGXGINOOYCDFKH-MRXNPFEDSA-N	0	3	339.483	3.323	20	30		EGEDHN
CC1(C)CC[C@@H]1C(=O)N1CCC[C@H](CNCc2ccccc2C#N)C1	ZINC001024111228	1323143915	/nfs/dbraw/zinc/14/39/15/1323143915.db2.gz	IVMKWWKKFZHWQW-VQIMIIECSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H](CNCc2nc(C)cs2)C1	ZINC001024135096	1323160681	/nfs/dbraw/zinc/16/06/81/1323160681.db2.gz	IUNYGRILVPKISH-MAUKXSAKSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H](CNCc2cc(C3CC3)no2)C1	ZINC001024137552	1323162393	/nfs/dbraw/zinc/16/23/93/1323162393.db2.gz	NOUNKIQQHRDWIT-YWZLYKJASA-N	0	3	345.487	3.483	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1[nH]nc2ccc(C)cc21	ZINC001024526461	1323473607	/nfs/dbraw/zinc/47/36/07/1323473607.db2.gz	AAOTYCBEEXTIHI-HNNXBMFYSA-N	0	3	326.444	3.032	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1sccc1-n1cccc1	ZINC001024585681	1323520625	/nfs/dbraw/zinc/52/06/25/1323520625.db2.gz	DTHANOCIPASIGW-INIZCTEOSA-N	0	3	341.480	3.146	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cccc2c1OCCCO2	ZINC001024729256	1323629972	/nfs/dbraw/zinc/62/99/72/1323629972.db2.gz	MHSDDFAFKJSZNE-MRXNPFEDSA-N	0	3	344.455	3.008	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccc(N(C)CCC)cc1	ZINC001024824124	1323726613	/nfs/dbraw/zinc/72/66/13/1323726613.db2.gz	CAQVAIRHRVMLHL-FQEVSTJZSA-N	0	3	341.499	3.140	20	30		EGEDHN
CC(C)=CC(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)c(F)c1	ZINC001024854421	1323749117	/nfs/dbraw/zinc/74/91/17/1323749117.db2.gz	LQMLMQXUXBRSCB-QGZVFWFLSA-N	0	3	329.419	3.134	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCCC[C@@H]1CNCc1cc(Cl)ccc1F	ZINC001024902752	1323773367	/nfs/dbraw/zinc/77/33/67/1323773367.db2.gz	ZTVBOBYINFOYCQ-IUODEOHRSA-N	0	3	337.826	3.109	20	30		EGEDHN
O=C(C#CC1CC1)N1CCCC[C@@H]1CNCc1ccc(F)cc1Cl	ZINC001024960457	1323802408	/nfs/dbraw/zinc/80/24/08/1323802408.db2.gz	UEWDBQCJYVADBQ-QGZVFWFLSA-N	0	3	348.849	3.363	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)C2(C3CC3)CC2)s1	ZINC001024993718	1323815928	/nfs/dbraw/zinc/81/59/28/1323815928.db2.gz	KBHLRLRXXADQAP-OAHLLOKOSA-N	0	3	343.496	3.281	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCCC[C@@H]1CNCc1ccc(OC)nc1	ZINC001025069230	1323869562	/nfs/dbraw/zinc/86/95/62/1323869562.db2.gz	DVYXWMMMKHPWLJ-XLIONFOSSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCCC[C@H]2CNCc2ccc(C#N)s2)C1	ZINC001025074530	1323876222	/nfs/dbraw/zinc/87/62/22/1323876222.db2.gz	NUFDPEODEXLRPS-HNNXBMFYSA-N	0	3	343.496	3.447	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCCC[C@@H]2CNCc2c(C)noc2C)C1	ZINC001025074591	1323876810	/nfs/dbraw/zinc/87/68/10/1323876810.db2.gz	QAGXAKGDLGLXEN-MRXNPFEDSA-N	0	3	331.460	3.118	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCCC[C@@H]2CNCc2ncccc2C)C1	ZINC001025075238	1323878179	/nfs/dbraw/zinc/87/81/79/1323878179.db2.gz	YMAGVDUORFFFQW-QGZVFWFLSA-N	0	3	327.472	3.217	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)s1	ZINC001025092073	1323888043	/nfs/dbraw/zinc/88/80/43/1323888043.db2.gz	XQFWGGBTLAXCIH-CKEIUWERSA-N	0	3	331.485	3.137	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccccc1F	ZINC001025190345	1323967065	/nfs/dbraw/zinc/96/70/65/1323967065.db2.gz	AXFWHBIPRBXMOT-RBUKOAKNSA-N	0	3	328.431	3.308	20	30		EGEDHN
N#Cc1ccc(C(=O)N2CCCC[C@@H]2[C@H]2CCCN2C/C=C/Cl)[nH]1	ZINC001025225074	1324012553	/nfs/dbraw/zinc/01/25/53/1324012553.db2.gz	YBCVKCDWVCTNHE-VAJLHQMSSA-N	0	3	346.862	3.098	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1[nH]ccc1C1CC1	ZINC001025234832	1324024022	/nfs/dbraw/zinc/02/40/22/1324024022.db2.gz	LCKWSDDGQZCNLE-RTBURBONSA-N	0	3	339.483	3.375	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(C)nc(C)c1	ZINC001025237096	1324028777	/nfs/dbraw/zinc/02/87/77/1324028777.db2.gz	XIVPIOZYFIELSE-UXHICEINSA-N	0	3	339.483	3.181	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc(C(C)C)nc1	ZINC001025239724	1324032328	/nfs/dbraw/zinc/03/23/28/1324032328.db2.gz	IPLVNUUAGVDZBJ-UXHICEINSA-N	0	3	339.483	3.297	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc(CC)o1	ZINC001025243721	1324039947	/nfs/dbraw/zinc/03/99/47/1324039947.db2.gz	DXGMMAAPTQRLGQ-ROUUACIJSA-N	0	3	328.456	3.324	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ncccc1CC	ZINC001025243666	1324040874	/nfs/dbraw/zinc/04/08/74/1324040874.db2.gz	DDTUMJXLJGBEKH-RTBURBONSA-N	0	3	339.483	3.126	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1nc(C)sc1C	ZINC001025245051	1324042521	/nfs/dbraw/zinc/04/25/21/1324042521.db2.gz	ZEQYNOLTZMLEGP-IRXDYDNUSA-N	0	3	345.512	3.242	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(F)ccc1CC	ZINC001025247850	1324048096	/nfs/dbraw/zinc/04/80/96/1324048096.db2.gz	RHLUSZAEWIRDHZ-WOJBJXKFSA-N	0	3	342.458	3.480	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc(OC)cc1F	ZINC001025248256	1324049156	/nfs/dbraw/zinc/04/91/56/1324049156.db2.gz	XMODBMISOSKREG-OALUTQOASA-N	0	3	346.446	3.479	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cncc(CC)c1	ZINC001025252202	1324057355	/nfs/dbraw/zinc/05/73/55/1324057355.db2.gz	NNZJUUQOURJRFU-UXHICEINSA-N	0	3	339.483	3.126	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1nccc2ccccc21	ZINC001025261076	1324072707	/nfs/dbraw/zinc/07/27/07/1324072707.db2.gz	SXPUDKPNEIRCNK-WOJBJXKFSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc2cc[nH]c2c1	ZINC001025270529	1324085293	/nfs/dbraw/zinc/08/52/93/1324085293.db2.gz	DHNXQTXSQWSVRL-PMACEKPBSA-N	0	3	335.451	3.260	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cccc(OCC)c1	ZINC001025274393	1324091996	/nfs/dbraw/zinc/09/19/96/1324091996.db2.gz	XQFJNJHICMTKNL-PMACEKPBSA-N	0	3	340.467	3.178	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1nc(C)ncc1Cl	ZINC001025274747	1324094480	/nfs/dbraw/zinc/09/44/80/1324094480.db2.gz	NBYIJSROUUCIRO-HOTGVXAUSA-N	0	3	348.878	3.084	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1coc(CCC)n1	ZINC001025289844	1324113966	/nfs/dbraw/zinc/11/39/66/1324113966.db2.gz	UCXRMYNZOTUBBZ-IRXDYDNUSA-N	0	3	331.460	3.272	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)C(C)(C)C(F)(F)F	ZINC001025294323	1324122991	/nfs/dbraw/zinc/12/29/91/1324122991.db2.gz	ZJPSVOBHHHTBTB-KGLIPLIRSA-N	0	3	330.394	3.054	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(F)cc(F)c1	ZINC001025294443	1324124293	/nfs/dbraw/zinc/12/42/93/1324124293.db2.gz	BGCSCFIKZXREJU-MOPGFXCFSA-N	0	3	346.421	3.447	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)Cc1sc(C)cc1C	ZINC001025297051	1324129332	/nfs/dbraw/zinc/12/93/32/1324129332.db2.gz	NTZJFRAXBCAYJF-ROUUACIJSA-N	0	3	344.524	3.386	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cccn1C(C)C	ZINC001025297619	1324131061	/nfs/dbraw/zinc/13/10/61/1324131061.db2.gz	ZCRZXZWZLDGXOQ-MSOLQXFVSA-N	0	3	327.472	3.161	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cncnc1C(C)C	ZINC001025301221	1324134455	/nfs/dbraw/zinc/13/44/55/1324134455.db2.gz	IFIXNVNDWZZQTR-MSOLQXFVSA-N	0	3	342.487	3.245	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc(C)nc1C	ZINC001025302784	1324136479	/nfs/dbraw/zinc/13/64/79/1324136479.db2.gz	XTVJVKGJQXMHPL-VQTJNVASSA-N	0	3	339.483	3.181	20	30		EGEDHN
C[C@H](NC(=O)c1ccoc1)[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001025346531	1324192484	/nfs/dbraw/zinc/19/24/84/1324192484.db2.gz	URUAATOFCNJKLV-YJBOKZPZSA-N	0	3	337.423	3.182	20	30		EGEDHN
C[C@@H](NC(=O)C1=CCCC1)[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001025375340	1324216675	/nfs/dbraw/zinc/21/66/75/1324216675.db2.gz	MKGGQUDFANGIOK-UZLBHIALSA-N	0	3	337.467	3.385	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cccc3scnc32)C1	ZINC001025419615	1324251971	/nfs/dbraw/zinc/25/19/71/1324251971.db2.gz	NIYXFGXIHWNYBL-HUUCEWRRSA-N	0	3	341.480	3.150	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2oc(C(F)F)cc2C)C1	ZINC001025445402	1324286531	/nfs/dbraw/zinc/28/65/31/1324286531.db2.gz	MYBUTTKKBZGGOQ-ZIAGYGMSSA-N	0	3	338.398	3.379	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(F)c(C)cc2F)C1	ZINC001025449985	1324291716	/nfs/dbraw/zinc/29/17/16/1324291716.db2.gz	AXUKFOSLGIXBBK-HUUCEWRRSA-N	0	3	334.410	3.127	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(F)c(C)cc2F)C1	ZINC001025449984	1324292613	/nfs/dbraw/zinc/29/26/13/1324292613.db2.gz	AXUKFOSLGIXBBK-GJZGRUSLSA-N	0	3	334.410	3.127	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(C)cc(OC)c2C)C1	ZINC001025472186	1324317638	/nfs/dbraw/zinc/31/76/38/1324317638.db2.gz	NXXRZKQBWPBMDQ-ROUUACIJSA-N	0	3	342.483	3.166	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(OC)c(C(C)C)c2)C1	ZINC001025475993	1324320478	/nfs/dbraw/zinc/32/04/78/1324320478.db2.gz	WDWQLAMCBMYWAG-SJLPKXTDSA-N	0	3	342.483	3.282	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2sccc2-n2cccc2)C1	ZINC001025493545	1324345227	/nfs/dbraw/zinc/34/52/27/1324345227.db2.gz	PAKCIQPFUXBQNX-JKSUJKDBSA-N	0	3	341.480	3.002	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc3ccccc3n2C)C1	ZINC001025518839	1324362521	/nfs/dbraw/zinc/36/25/21/1324362521.db2.gz	INHZWNJZRURJRC-WMZOPIPTSA-N	0	3	337.467	3.032	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(C(F)F)cc2)C1	ZINC001025557930	1324406335	/nfs/dbraw/zinc/40/63/35/1324406335.db2.gz	JVLQHKYUWNVSKF-PBHICJAKSA-N	0	3	334.410	3.478	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(C(F)F)cc2)C1	ZINC001025557933	1324406656	/nfs/dbraw/zinc/40/66/56/1324406656.db2.gz	JVLQHKYUWNVSKF-WMLDXEAASA-N	0	3	334.410	3.478	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(-c3ccccc3)nc2)C1	ZINC001025577838	1324418595	/nfs/dbraw/zinc/41/85/95/1324418595.db2.gz	VANRCYQMKGGSGB-FXAWDEMLSA-N	0	3	347.462	3.212	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(-c3ccccc3)ccn2)C1	ZINC001025579886	1324419690	/nfs/dbraw/zinc/41/96/90/1324419690.db2.gz	PPZDNJYJJTVTMK-PXNSSMCTSA-N	0	3	347.462	3.212	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(-c3ccco3)s2)C1	ZINC001025582223	1324423331	/nfs/dbraw/zinc/42/33/31/1324423331.db2.gz	PZXRQUMQNYSUHK-CABCVRRESA-N	0	3	342.464	3.472	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc3ccn(C)c3c2)C1	ZINC001025586815	1324429965	/nfs/dbraw/zinc/42/99/65/1324429965.db2.gz	FXEGPPNPVIOAGY-QFBILLFUSA-N	0	3	337.467	3.032	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)C23CC4CC(CC(C4)C2)C3)C1	ZINC001025610070	1324461363	/nfs/dbraw/zinc/46/13/63/1324461363.db2.gz	RBGIBWAIBISLRQ-YWOLTOGESA-N	0	3	342.527	3.443	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)C23CC4CC(CC(C4)C2)C3)C1	ZINC001025610069	1324461671	/nfs/dbraw/zinc/46/16/71/1324461671.db2.gz	RBGIBWAIBISLRQ-YKOJYSHRSA-N	0	3	342.527	3.443	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc3c(s2)CCCC3)C1	ZINC001025614608	1324467680	/nfs/dbraw/zinc/46/76/80/1324467680.db2.gz	MNJJEVWMDJLOIX-ZBFHGGJFSA-N	0	3	330.497	3.090	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2c[nH]c3c2cccc3CC)C1	ZINC001025630393	1324482321	/nfs/dbraw/zinc/48/23/21/1324482321.db2.gz	SEFSOHQLADWVIY-RDJZCZTQSA-N	0	3	337.467	3.194	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cnc(CC(C)C)s2)C1	ZINC001025632354	1324484921	/nfs/dbraw/zinc/48/49/21/1324484921.db2.gz	JYXSEMCBQSKCMR-HOTGVXAUSA-N	0	3	347.528	3.195	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(CC)c(CC)c2)C1	ZINC001025637548	1324489508	/nfs/dbraw/zinc/48/95/08/1324489508.db2.gz	WRUCOSIXRCCVHN-UZLBHIALSA-N	0	3	326.484	3.275	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H]3CC[C@@H](NCc4cc(C)no4)[C@H]3C2)CC1	ZINC001026347790	1324743074	/nfs/dbraw/zinc/74/30/74/1324743074.db2.gz	IILPLUXGXFPOHT-YTQUADARSA-N	0	3	343.471	3.056	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H]3CC[C@H](NCc4ncc(C)s4)[C@@H]3C2)C1	ZINC001026352898	1324747422	/nfs/dbraw/zinc/74/74/22/1324747422.db2.gz	WOBQIUASOPIZAP-XHSDSOJGSA-N	0	3	345.512	3.134	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)c2ccc(C)o2)CC1	ZINC001026447947	1324811441	/nfs/dbraw/zinc/81/14/41/1324811441.db2.gz	DEAGTVDZENZDIY-UHFFFAOYSA-N	0	3	341.249	3.127	20	30		EGEDHN
N#Cc1ccccc1CNC1CCC(NC(=O)CC2CCC2)CC1	ZINC001026470490	1324828200	/nfs/dbraw/zinc/82/82/00/1324828200.db2.gz	DEMDFROTYOMTBU-UHFFFAOYSA-N	0	3	325.456	3.265	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@H](CNCc2nc(C)cs2)C1	ZINC001026865203	1325054356	/nfs/dbraw/zinc/05/43/56/1325054356.db2.gz	YBWLDRWZOQPZAU-CYBMUJFWSA-N	0	3	341.908	3.168	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@@H](CNCc2cc(F)ccc2C#N)C1)C1CCC1	ZINC001026913375	1325075494	/nfs/dbraw/zinc/07/54/94/1325075494.db2.gz	IEXCTNXZLKDIHP-GJZGRUSLSA-N	0	3	343.446	3.072	20	30		EGEDHN
CC1(C)CCC[C@@H]1C(=O)N1CC[C@H](CNCc2ccccc2C#N)C1	ZINC001027003804	1325144154	/nfs/dbraw/zinc/14/41/54/1325144154.db2.gz	ZKJDLXISEYSNGM-VQIMIIECSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)c2conc2C)C1	ZINC000963356807	1325151823	/nfs/dbraw/zinc/15/18/23/1325151823.db2.gz	GWRSCOCBURIBLI-GOEBONIOSA-N	0	3	337.851	3.052	20	30		EGEDHN
N#Cc1ccc(F)c(CNC2CCN(OCc3ccccc3)CC2)c1	ZINC000925474331	1325166652	/nfs/dbraw/zinc/16/66/52/1325166652.db2.gz	IXLDSGBADILHEI-UHFFFAOYSA-N	0	3	339.414	3.383	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H](CNCc2ccccc2C#N)C1	ZINC001027038063	1325172592	/nfs/dbraw/zinc/17/25/92/1325172592.db2.gz	HDYQXWFAONIPIU-UZLBHIALSA-N	0	3	325.456	3.099	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](CNCc3nc(C)cs3)C2)CC1	ZINC001027040513	1325175460	/nfs/dbraw/zinc/17/54/60/1325175460.db2.gz	DOUBASHJUMIMOE-HNNXBMFYSA-N	0	3	333.501	3.136	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)c2c[nH]cc2C)C1	ZINC000963411940	1325217057	/nfs/dbraw/zinc/21/70/57/1325217057.db2.gz	AWYNAGGPXGJBPJ-WBVHZDCISA-N	0	3	335.879	3.392	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)Cc2ccc[nH]2)C1	ZINC000963427128	1325236468	/nfs/dbraw/zinc/23/64/68/1325236468.db2.gz	DPGQDPSBRDRISL-DOTOQJQBSA-N	0	3	335.879	3.013	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@@H](CNCc2ccccc2C#N)C1)c1ccccc1	ZINC001027176798	1325275059	/nfs/dbraw/zinc/27/50/59/1325275059.db2.gz	RBXSYIJLAODAJV-ROUUACIJSA-N	0	3	347.462	3.300	20	30		EGEDHN
Cc1ccc(C)c(C(=O)N2CC[C@H](CNCc3ccccc3C#N)C2)c1	ZINC001027189091	1325290567	/nfs/dbraw/zinc/29/05/67/1325290567.db2.gz	LAJVZHKAKQYLSW-GOSISDBHSA-N	0	3	347.462	3.427	20	30		EGEDHN
Cc1cc(C)cc(C(=O)N2CC[C@H](CNCc3ccccc3C#N)C2)c1	ZINC001027190346	1325292930	/nfs/dbraw/zinc/29/29/30/1325292930.db2.gz	QRILMSWVZFWGKY-GOSISDBHSA-N	0	3	347.462	3.427	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H](N(C)Cc2ccc(F)c(C#N)c2)C1)C1CC1	ZINC001027351665	1325520316	/nfs/dbraw/zinc/52/03/16/1325520316.db2.gz	MDLZIDAGUVVQAK-KBXCAEBGSA-N	0	3	343.446	3.166	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)[C@H]2CC2(C)C)C1	ZINC001027374778	1325571419	/nfs/dbraw/zinc/57/14/19/1325571419.db2.gz	JGFSEBHKTYYYBD-QZTJIDSGSA-N	0	3	325.456	3.027	20	30		EGEDHN
Cc1cc(C(=O)N2CCC[C@@H](N(C)Cc3cccc(C#N)c3)C2)co1	ZINC001027381723	1325578726	/nfs/dbraw/zinc/57/87/26/1325578726.db2.gz	GBOGCKYVNILIKA-LJQANCHMSA-N	0	3	337.423	3.196	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)[C@@H]1C[C@H]1c1ccco1	ZINC000860471864	1329321421	/nfs/dbraw/zinc/32/14/21/1329321421.db2.gz	VVFWWOCOIGDGPE-MGPQQGTHSA-N	0	3	338.363	3.129	20	30		EGEDHN
CC(C(=O)N1CCC[C@H](N(C)Cc2cccc(C#N)c2)C1)=C1CCC1	ZINC001027404092	1327628841	/nfs/dbraw/zinc/62/88/41/1327628841.db2.gz	VFRSTBJOTDYSPM-FQEVSTJZSA-N	0	3	337.467	3.481	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)CC(C)(C)c2ccc(F)cc2)C1	ZINC001027442570	1327681122	/nfs/dbraw/zinc/68/11/22/1327681122.db2.gz	YFRLGWNHXJKYAE-GOSISDBHSA-N	0	3	330.447	3.049	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)[C@H]2CCC2(F)F)C1	ZINC001027458445	1327702278	/nfs/dbraw/zinc/70/22/78/1327702278.db2.gz	JHSCVFNXRKMUIX-IAGOWNOFSA-N	0	3	347.409	3.026	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001027522066	1327793650	/nfs/dbraw/zinc/79/36/50/1327793650.db2.gz	QPZMTUQBUXVUKL-SFHVURJKSA-N	0	3	325.456	3.193	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)[C@@]2(C)C=CCC2)C1	ZINC001027532344	1327816103	/nfs/dbraw/zinc/81/61/03/1327816103.db2.gz	YRSKQOIFVQLZEH-FPOVZHCZSA-N	0	3	337.467	3.337	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)N1CCC[C@H](N(C)Cc2ccc(F)c(C#N)c2)C1	ZINC001027532915	1327817673	/nfs/dbraw/zinc/81/76/73/1327817673.db2.gz	FNSYSUQAXNSVCD-FUHWJXTLSA-N	0	3	349.425	3.114	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)c(F)c2)C1	ZINC001027535241	1327825585	/nfs/dbraw/zinc/82/55/85/1327825585.db2.gz	WOFVMLUEHPGKEL-FUHWJXTLSA-N	0	3	349.425	3.114	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H](N(C)Cc3cccc(OC)c3)C2)C1	ZINC001027567047	1327894807	/nfs/dbraw/zinc/89/48/07/1327894807.db2.gz	QPSDNEDNHFFLKO-GOSISDBHSA-N	0	3	342.483	3.474	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)[C@@H]2CC23CCC3)C1	ZINC001027596593	1327945573	/nfs/dbraw/zinc/94/55/73/1327945573.db2.gz	XBNQCRORJYZRJE-OALUTQOASA-N	0	3	337.467	3.171	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)Cc2ccc(C(C)(C)C)cc2)C1	ZINC001027597448	1327947024	/nfs/dbraw/zinc/94/70/24/1327947024.db2.gz	KQFRCYZARZUGBJ-LJQANCHMSA-N	0	3	326.484	3.083	20	30		EGEDHN
C[C@@H](CC(=O)N1CCC[C@H](N(C)Cc2cccc(C#N)c2)C1)C1CC1	ZINC001027695604	1328102605	/nfs/dbraw/zinc/10/26/05/1328102605.db2.gz	HRAMXDQMIHHFME-JXFKEZNVSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2nsc3ccccc32)C1	ZINC000966296982	1328257479	/nfs/dbraw/zinc/25/74/79/1328257479.db2.gz	KUEXELWAVXKTNA-ZFWWWQNUSA-N	0	3	329.469	3.313	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)[C@@H]1CCCO[C@H]1c1ccccc1	ZINC001027940073	1328416678	/nfs/dbraw/zinc/41/66/78/1328416678.db2.gz	GEIUPOGQWYSBHW-AQNXPRMDSA-N	0	3	342.483	3.311	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1cc2c([nH]1)c(F)ccc2C	ZINC001027981273	1328454387	/nfs/dbraw/zinc/45/43/87/1328454387.db2.gz	KZXMFLVBSBNOIE-CQSZACIVSA-N	0	3	329.419	3.386	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccccc2-c2ccncc2)C1	ZINC000966908983	1328469315	/nfs/dbraw/zinc/46/93/15/1328469315.db2.gz	YBCSQMOSGAQNMR-UTKZUKDTSA-N	0	3	347.462	3.212	20	30		EGEDHN
C[C@@H](NC(=O)Nc1sccc1C#N)[C@@H](c1ccccc1)N(C)C	ZINC000931836778	1329765236	/nfs/dbraw/zinc/76/52/36/1329765236.db2.gz	AOXQSNQDMDGSLT-DOMZBBRYSA-N	0	3	328.441	3.433	20	30		EGEDHN
C#Cc1ccc(NC(=O)N(CCN(C)C)Cc2cccc(F)c2)cc1	ZINC000934935513	1330018635	/nfs/dbraw/zinc/01/86/35/1330018635.db2.gz	IVCSBKVJBGFDOY-UHFFFAOYSA-N	0	3	339.414	3.403	20	30		EGEDHN
Cc1cc(C(=O)N2C[C@@H](C)[C@H](NCc3ccc(C#N)s3)C2)cs1	ZINC000939307431	1330419027	/nfs/dbraw/zinc/41/90/27/1330419027.db2.gz	NIHNOMIMLTZWOS-BDJLRTHQSA-N	0	3	345.493	3.240	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N[C@@H]1CCN(Cc2cccc(C#N)c2)CC1(C)C	ZINC000940665769	1331149049	/nfs/dbraw/zinc/14/90/49/1331149049.db2.gz	YYVXYUMULGIISD-QZTJIDSGSA-N	0	3	339.483	3.321	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2oc3ccc(F)cc3c2C)[C@H](C)C1	ZINC000942122007	1331838454	/nfs/dbraw/zinc/83/84/54/1331838454.db2.gz	JTIKTNCZBPMNEN-CXAGYDPISA-N	0	3	342.414	3.344	20	30		EGEDHN
C[C@@H]1CN(Cc2cccc(C#N)c2)CC[C@H]1NC(=O)C1(C2CC2)CC1	ZINC000942161821	1331853722	/nfs/dbraw/zinc/85/37/22/1331853722.db2.gz	SVLUHFPWHOZGQV-DNVCBOLYSA-N	0	3	337.467	3.075	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccccc2-c2ccncc2)[C@H](C)C1	ZINC000942176394	1331862269	/nfs/dbraw/zinc/86/22/69/1331862269.db2.gz	OXPWFYLVWGZFKZ-UTKZUKDTSA-N	0	3	347.462	3.212	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(CCC(F)(F)F)C[C@H]2C)cc1	ZINC000942553850	1331970399	/nfs/dbraw/zinc/97/03/99/1331970399.db2.gz	UXEKIQOUPLPCHK-CJNGLKHVSA-N	0	3	338.373	3.061	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C(C)(C)c2cccc(Cl)c2)[C@@H](C)C1	ZINC000943209590	1332121752	/nfs/dbraw/zinc/12/17/52/1332121752.db2.gz	RDHJZGFXZJCNMT-YJBOKZPZSA-N	0	3	346.902	3.468	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3cc(F)ccc3o2)[C@@H](C)C1	ZINC000943286779	1332138375	/nfs/dbraw/zinc/13/83/75/1332138375.db2.gz	GBSGBYSEUCUTMN-XJKSGUPXSA-N	0	3	328.387	3.035	20	30		EGEDHN
CCCCCCCCCOC(=O)NCCCN1CCN(C)CC1	ZINC001194902944	1368344796	/nfs/dbraw/zinc/34/47/96/1368344796.db2.gz	NLHGEWKGAVFTFV-UHFFFAOYSA-N	0	3	327.513	3.101	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C(C)(C)c2ccc(C)cc2)[C@@H](C)C1	ZINC000944230094	1332349846	/nfs/dbraw/zinc/34/98/46/1332349846.db2.gz	YUVSXVAVMJUAIW-HKUYNNGSSA-N	0	3	326.484	3.123	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C23CC4CC(CC(C4)C2)C3)[C@@H](C)C1	ZINC000944282796	1332363099	/nfs/dbraw/zinc/36/30/99/1332363099.db2.gz	YZVRJHTZPAMGMP-GZKSLDRRSA-N	0	3	328.500	3.053	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3c(s2)CCCCC3)[C@H](C)C1	ZINC000944618204	1332417744	/nfs/dbraw/zinc/41/77/44/1332417744.db2.gz	BYCPLYLYOHZVLJ-NVXWUHKLSA-N	0	3	344.524	3.481	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccc(OCC(C)C)c2)[C@H](C)C1	ZINC000944810264	1332426365	/nfs/dbraw/zinc/42/63/65/1332426365.db2.gz	HDGHFSNRBYZYLR-YLJYHZDGSA-N	0	3	342.483	3.185	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C(C)(C)c2ccccc2C)[C@@H](C)C1	ZINC000945806510	1332678577	/nfs/dbraw/zinc/67/85/77/1332678577.db2.gz	DRYRXCVWMZPESC-HKUYNNGSSA-N	0	3	326.484	3.123	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(CC)c(CC)c2)[C@@H](C)C1	ZINC000946309617	1332783489	/nfs/dbraw/zinc/78/34/89/1332783489.db2.gz	CFKSOHTZEYQIOT-JXFKEZNVSA-N	0	3	326.484	3.275	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cscc2C(F)(F)F)[C@@H](C)C1	ZINC000946315477	1332786830	/nfs/dbraw/zinc/78/68/30/1332786830.db2.gz	XCYJZKQOWYLSIG-GXFFZTMASA-N	0	3	332.391	3.393	20	30		EGEDHN
CCCC(=O)N1CC[C@H]2CN(Cc3cc(C#N)ccc3F)C[C@H]2CC1	ZINC000946439715	1332826707	/nfs/dbraw/zinc/82/67/07/1332826707.db2.gz	OFCSTYCIHLSUMV-CALCHBBNSA-N	0	3	343.446	3.168	20	30		EGEDHN
CC(C)C(=O)N1CC[C@H]2CN(Cc3ccc(C#N)cc3F)C[C@H]2CC1	ZINC000946487233	1332841808	/nfs/dbraw/zinc/84/18/08/1332841808.db2.gz	LTZNTHXRJMADPC-CALCHBBNSA-N	0	3	343.446	3.024	20	30		EGEDHN
N#Cc1ccccc1CN1C[C@@H]2CCN(C(=O)/C=C/C3CC3)CC[C@@H]2C1	ZINC000946533779	1332848842	/nfs/dbraw/zinc/84/88/42/1332848842.db2.gz	TWNMZUXJXUYLLL-VVYKYHNSSA-N	0	3	349.478	3.195	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]3CN(Cc4nocc4C)C[C@H]3CC2)C1	ZINC000946769687	1332896333	/nfs/dbraw/zinc/89/63/33/1332896333.db2.gz	BSEXLCTVYJHOPG-CALCHBBNSA-N	0	3	343.471	3.010	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)c2cccs2)CCN1Cc1ccc(C#N)cc1	ZINC000947018627	1332977050	/nfs/dbraw/zinc/97/70/50/1332977050.db2.gz	ZZCMEFJUUWTDPG-YOEHRIQHSA-N	0	3	339.464	3.403	20	30		EGEDHN
Cc1cccc(C(=O)N[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@H](C)C2)n1	ZINC000947075290	1333003143	/nfs/dbraw/zinc/00/31/43/1333003143.db2.gz	ORSKFLLBVFYXQV-VQIMIIECSA-N	0	3	348.450	3.045	20	30		EGEDHN
Cc1cc(CN2CC[C@H](NC(=O)c3c[nH]c(C#N)c3)C[C@@H]2C)cs1	ZINC000947205441	1333051893	/nfs/dbraw/zinc/05/18/93/1333051893.db2.gz	QLQSKROTCKVILJ-LRDDRELGSA-N	0	3	342.468	3.039	20	30		EGEDHN
Cc1cc(CN2CC[C@H](NC(=O)c3ccc(C#N)[nH]3)C[C@H]2C)cs1	ZINC000947217215	1333054161	/nfs/dbraw/zinc/05/41/61/1333054161.db2.gz	LEOIASROIMIPLR-DOMZBBRYSA-N	0	3	342.468	3.039	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)C2CC(C)(C)C2)CCN1Cc1ccc(C#N)cc1	ZINC000947278180	1333075480	/nfs/dbraw/zinc/07/54/80/1333075480.db2.gz	XJBLOPQNYWEQEF-HNAYVOBHSA-N	0	3	339.483	3.464	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)C2(C3CC3)CC2)CCN1Cc1cccc(C#N)c1	ZINC000947426228	1333123209	/nfs/dbraw/zinc/12/32/09/1333123209.db2.gz	OIWJMSCFNRCHKT-DNVCBOLYSA-N	0	3	337.467	3.218	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cn(CC)c3ccccc23)C[C@H]1C	ZINC000947524192	1333158029	/nfs/dbraw/zinc/15/80/29/1333158029.db2.gz	PIGXRFOWSAJDKQ-CVEARBPZSA-N	0	3	325.456	3.430	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc3cc(C)ccc3n2)C[C@H]1C	ZINC000947532765	1333160902	/nfs/dbraw/zinc/16/09/02/1333160902.db2.gz	MPLYTUBXIYCTHW-SJLPKXTDSA-N	0	3	335.451	3.149	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(C(F)F)cc2)C[C@@H]1C	ZINC000947540859	1333165078	/nfs/dbraw/zinc/16/50/78/1333165078.db2.gz	ZKTYUEBYSSCVEF-YOEHRIQHSA-N	0	3	334.410	3.159	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnc3c(F)cccc3c2)C[C@H]1C	ZINC000947547468	1333167664	/nfs/dbraw/zinc/16/76/64/1333167664.db2.gz	RNOKRTRSRIAXEQ-CJNGLKHVSA-N	0	3	327.403	3.143	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3c(cc(C)cc3C)[nH]2)C[C@@H]1C	ZINC000947586069	1333182881	/nfs/dbraw/zinc/18/28/81/1333182881.db2.gz	VAQFGHMYLDQXDZ-DLBZAZTESA-N	0	3	337.467	3.391	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3c(cc(C)cc3C)[nH]2)C[C@H]1C	ZINC000947586072	1333183767	/nfs/dbraw/zinc/18/37/67/1333183767.db2.gz	VAQFGHMYLDQXDZ-SJORKVTESA-N	0	3	337.467	3.391	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3ccc(F)cc3)CCC2)C[C@H]1C	ZINC000947597463	1333187860	/nfs/dbraw/zinc/18/78/60/1333187860.db2.gz	HHLKWCFIDGMMDH-APWZRJJASA-N	0	3	342.458	3.240	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3c(ccc(C)c3C)[nH]2)C[C@H]1C	ZINC000947615580	1333194289	/nfs/dbraw/zinc/19/42/89/1333194289.db2.gz	JNDZJKGNOYSLMM-NVXWUHKLSA-N	0	3	337.467	3.391	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccc(F)c3ccncc23)C[C@H]1C	ZINC000947647276	1333207874	/nfs/dbraw/zinc/20/78/74/1333207874.db2.gz	BINPANBVUXFHCJ-ZIAGYGMSSA-N	0	3	327.403	3.143	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(CCc3ccns3)[C@@H](C)C2)C1	ZINC000947702766	1333232854	/nfs/dbraw/zinc/23/28/54/1333232854.db2.gz	SBNCZFDCWGFJDK-GJZGRUSLSA-N	0	3	333.501	3.011	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cccc(Cl)c2F)C[C@H]1C	ZINC000947751475	1333250624	/nfs/dbraw/zinc/25/06/24/1333250624.db2.gz	YDCHYVWYUTWRBG-HIFRSBDPSA-N	0	3	336.838	3.014	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3cc(F)ccc3o2)C[C@@H]1C	ZINC000947771736	1333256305	/nfs/dbraw/zinc/25/63/05/1333256305.db2.gz	QOXABXXGSIQOKM-BBRMVZONSA-N	0	3	328.387	3.178	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnoc2-c2ccccc2)C[C@H]1C	ZINC000947878020	1333288008	/nfs/dbraw/zinc/28/80/08/1333288008.db2.gz	JJSWMUJCPAXMFL-GDBMZVCRSA-N	0	3	325.412	3.110	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccsc2C(F)(F)F)C[C@@H]1C	ZINC000947975169	1333328657	/nfs/dbraw/zinc/32/86/57/1333328657.db2.gz	KWBWTIPLFREEFO-NWDGAFQWSA-N	0	3	344.402	3.373	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(COC(C)C)cc2)C[C@H]1C	ZINC000948017129	1333343485	/nfs/dbraw/zinc/34/34/85/1333343485.db2.gz	TXFREMXSKUMGFY-YLJYHZDGSA-N	0	3	342.483	3.218	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3ccccc3n2CC)C[C@@H]1C	ZINC000948060294	1333358979	/nfs/dbraw/zinc/35/89/79/1333358979.db2.gz	AZYJBICZLNCQLC-FUHWJXTLSA-N	0	3	337.467	3.267	20	30		EGEDHN
CN(C(=O)C1CCC1)[C@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948140285	1333389479	/nfs/dbraw/zinc/38/94/79/1333389479.db2.gz	PONNTDYMALTICH-IBGZPJMESA-N	0	3	325.456	3.171	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N(C)[C@H]1CCCN(C/C=C/Cl)CC1	ZINC000948385012	1333504386	/nfs/dbraw/zinc/50/43/86/1333504386.db2.gz	HECBZAWFPDAHSG-CQHHLICSSA-N	0	3	340.895	3.033	20	30		EGEDHN
CN(C(=O)c1cc[nH]c1)[C@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948396692	1333508157	/nfs/dbraw/zinc/50/81/57/1333508157.db2.gz	CXPGOVDEQGWXHZ-IBGZPJMESA-N	0	3	336.439	3.013	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cc(C)c(F)cc2F)CC1	ZINC000948467860	1333537745	/nfs/dbraw/zinc/53/77/45/1333537745.db2.gz	ZRDQRFVPAKWNFX-OAHLLOKOSA-N	0	3	334.410	3.223	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)Cc2ccc3cccnc3c2)CC1	ZINC000948543428	1333565503	/nfs/dbraw/zinc/56/55/03/1333565503.db2.gz	ZLMJBHNZEVGQSC-FQEVSTJZSA-N	0	3	349.478	3.114	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)[C@@H]2CCCC[C@@H]2C(F)(F)F)CC1	ZINC000948553424	1333571921	/nfs/dbraw/zinc/57/19/21/1333571921.db2.gz	HGQWNJBTBOCSGP-XHSDSOJGSA-N	0	3	344.421	3.301	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2nc3ccccc3cc2C)CC1	ZINC000948629623	1333603265	/nfs/dbraw/zinc/60/32/65/1333603265.db2.gz	VTJGYYSWHWIRLU-GOSISDBHSA-N	0	3	335.451	3.103	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)Cc2ccc(C3CCC3)cc2)CC1	ZINC000948655394	1333614172	/nfs/dbraw/zinc/61/41/72/1333614172.db2.gz	AHOMSNILSUDEPH-NRFANRHFSA-N	0	3	338.495	3.443	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cc3cc(F)ccc3[nH]2)CC1	ZINC000948665060	1333619970	/nfs/dbraw/zinc/61/99/70/1333619970.db2.gz	GCLQMMXJFRXQRC-KRWDZBQOSA-N	0	3	341.430	3.257	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)C(C)(C)c2cccs2)CC1	ZINC000948664826	1333619986	/nfs/dbraw/zinc/61/99/86/1333619986.db2.gz	AWRLKQGVYNYIJO-INIZCTEOSA-N	0	3	332.513	3.362	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2nsc3ccc(C)cc32)CC1	ZINC000948674463	1333624014	/nfs/dbraw/zinc/62/40/14/1333624014.db2.gz	YHSVLDRJWDPLPQ-OAHLLOKOSA-N	0	3	341.480	3.164	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cc(F)c(F)cc2F)CC1	ZINC000948730293	1333649952	/nfs/dbraw/zinc/64/99/52/1333649952.db2.gz	VJTDWLYGDXJVQM-CYBMUJFWSA-N	0	3	338.373	3.054	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@H]2CCCN(Cc3ocnc3C)CC2)C1	ZINC000948758907	1333664187	/nfs/dbraw/zinc/66/41/87/1333664187.db2.gz	NFROFOLSCGJYGG-INIZCTEOSA-N	0	3	331.460	3.152	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cc(F)ccc2Cl)CC1	ZINC000948809606	1333691212	/nfs/dbraw/zinc/69/12/12/1333691212.db2.gz	QBOKNKZWYULGAJ-OAHLLOKOSA-N	0	3	336.838	3.429	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2ccc(C)c(OCC)c2)CC1	ZINC000948829354	1333700976	/nfs/dbraw/zinc/70/09/76/1333700976.db2.gz	LICZUPAXOMAZHB-IBGZPJMESA-N	0	3	342.483	3.344	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)[C@H](C)c2ccccc2F)CC1	ZINC000948868483	1333715200	/nfs/dbraw/zinc/71/52/00/1333715200.db2.gz	MARCQHUICSBCPI-SJORKVTESA-N	0	3	330.447	3.265	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)C[C@H]2CCc3ccccc32)CC1	ZINC000948868541	1333715210	/nfs/dbraw/zinc/71/52/10/1333715210.db2.gz	ONAUJUAAFPGSKV-UXHICEINSA-N	0	3	338.495	3.443	20	30		EGEDHN
N#Cc1c[nH]c(C(=O)NC[C@H]2c3ccccc3CCN2CCC2CC2)c1	ZINC000948901895	1333725956	/nfs/dbraw/zinc/72/59/56/1333725956.db2.gz	GMMOKTOLMDSCMD-FQEVSTJZSA-N	0	3	348.450	3.016	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@H]1CNC(=O)c1ccc(C#N)[nH]1	ZINC000948910426	1333730739	/nfs/dbraw/zinc/73/07/39/1333730739.db2.gz	RCJKSXQUIYAAQN-HXUWFJFHSA-N	0	3	348.450	3.182	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@H]1CNC(=O)[C@@H]1CCO[C@H]1CC	ZINC000948941533	1333742365	/nfs/dbraw/zinc/74/23/65/1333742365.db2.gz	YWJPGDUPPORYJE-AQNXPRMDSA-N	0	3	342.483	3.093	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@@H]1CNC(=O)c1cc2c([nH]1)CCC2	ZINC000948978359	1333754879	/nfs/dbraw/zinc/75/48/79/1333754879.db2.gz	KQIFVQCUJUZATA-NRFANRHFSA-N	0	3	349.478	3.409	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@@H]3CCC[C@H]3CCC)CC2)C1	ZINC000949402271	1333838241	/nfs/dbraw/zinc/83/82/41/1333838241.db2.gz	XAGBQBCRAUMBLL-RTBURBONSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3ccc(CC)s3)CC2)C1	ZINC000949408933	1333839619	/nfs/dbraw/zinc/83/96/19/1333839619.db2.gz	PNQASEAVCNPQOY-UHFFFAOYSA-N	0	3	348.512	3.194	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3cc(C)c(C)s3)CC2)C1	ZINC000949523316	1333867314	/nfs/dbraw/zinc/86/73/14/1333867314.db2.gz	MNEPLSWPLZVVOH-UHFFFAOYSA-N	0	3	348.512	3.248	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)Cc2cccc(C(F)F)c2)C1	ZINC000967333213	1335703432	/nfs/dbraw/zinc/70/34/32/1335703432.db2.gz	GWOLQJHJHSJMGY-RHSMWYFYSA-N	0	3	334.410	3.017	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cc(C)c(C)cc2Cl)C1	ZINC000967779469	1335816108	/nfs/dbraw/zinc/81/61/08/1335816108.db2.gz	NNEJFABIAMDWSY-ACJLOTCBSA-N	0	3	332.875	3.420	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CN(CC3=CCCCC3)CC[C@H]2C)c1	ZINC000968317510	1335888470	/nfs/dbraw/zinc/88/84/70/1335888470.db2.gz	LAIYQGPZCNECQD-UZLBHIALSA-N	0	3	337.467	3.004	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CN(Cc3cccc(C)c3)CC[C@@H]2C)c1	ZINC000968316712	1335888507	/nfs/dbraw/zinc/88/85/07/1335888507.db2.gz	GIKLQPWPGBUDLQ-UWJYYQICSA-N	0	3	347.462	3.012	20	30		EGEDHN
C[C@H](N[C@@H]1CCN(C(=O)c2cc(C#N)c[nH]2)C1)c1ccccc1Cl	ZINC000968346954	1335896921	/nfs/dbraw/zinc/89/69/21/1335896921.db2.gz	NTRALBNLRXXOQR-GXTWGEPZSA-N	0	3	342.830	3.105	20	30		EGEDHN
C[C@@H](N[C@@H]1CCN(C(=O)c2cc(C#N)c[nH]2)C1)c1ccccc1Cl	ZINC000968346955	1335897038	/nfs/dbraw/zinc/89/70/38/1335897038.db2.gz	NTRALBNLRXXOQR-TZMCWYRMSA-N	0	3	342.830	3.105	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)Cc2cccc3sccc32)C1	ZINC000968396259	1335919079	/nfs/dbraw/zinc/91/90/79/1335919079.db2.gz	ZTFFDTIDCLPGMG-YJBOKZPZSA-N	0	3	340.492	3.294	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2cccc(-c3ccoc3)c2)C1	ZINC000968517906	1335950723	/nfs/dbraw/zinc/95/07/23/1335950723.db2.gz	VAYNADQNRCCUAQ-JXFKEZNVSA-N	0	3	336.435	3.410	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)Cc2cccc3ccccc32)C1	ZINC000968568543	1335962505	/nfs/dbraw/zinc/96/25/05/1335962505.db2.gz	ASDSZMSPSNEVBF-DYESRHJHSA-N	0	3	334.463	3.232	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC000968579810	1335970119	/nfs/dbraw/zinc/97/01/19/1335970119.db2.gz	QKSCBSWUSYOBHP-XJKSGUPXSA-N	0	3	338.373	3.169	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(OC3CCC3)cc2)C1	ZINC000968669770	1336004284	/nfs/dbraw/zinc/00/42/84/1336004284.db2.gz	STXQGMOOCJXNSV-UZLBHIALSA-N	0	3	340.467	3.081	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2c[nH]c3ccc(F)cc23)C1	ZINC000968700673	1336017308	/nfs/dbraw/zinc/01/73/08/1336017308.db2.gz	AGESJPBLWJCBCR-UGSOOPFHSA-N	0	3	329.419	3.323	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccccc1-c1cn[nH]c1	ZINC000968882706	1336079199	/nfs/dbraw/zinc/07/91/99/1336079199.db2.gz	SMIJOMNUXOEWGB-KRWDZBQOSA-N	0	3	338.455	3.237	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)[C@@H]1CCCc2ccccc21	ZINC000968917205	1336087975	/nfs/dbraw/zinc/08/79/75/1336087975.db2.gz	QEYGXMQNKFEYQD-PZJWPPBQSA-N	0	3	338.495	3.491	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1cc2cnccc2o1	ZINC000968936878	1336096263	/nfs/dbraw/zinc/09/62/63/1336096263.db2.gz	UEBIBDMOWQPMNM-MRXNPFEDSA-N	0	3	327.428	3.378	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cc2c(cn1)CCCC2	ZINC000968942497	1336098810	/nfs/dbraw/zinc/09/88/10/1336098810.db2.gz	WWZVYCIQVSMSGP-SFHVURJKSA-N	0	3	327.472	3.121	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccc2[nH]nc(C)c2c1	ZINC000968944940	1336100280	/nfs/dbraw/zinc/10/02/80/1336100280.db2.gz	RYZHLGXXOVNHNS-MRXNPFEDSA-N	0	3	326.444	3.032	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1c[nH]nc1-c1ccccc1	ZINC000968971718	1336106038	/nfs/dbraw/zinc/10/60/38/1336106038.db2.gz	RPDPVDPZNSGZQI-KRWDZBQOSA-N	0	3	338.455	3.237	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccc2c(c1)[C@H](C)CO2	ZINC000968998305	1336114905	/nfs/dbraw/zinc/11/49/05/1336114905.db2.gz	RMIICYHALIUOFM-WBVHZDCISA-N	0	3	328.456	3.343	20	30		EGEDHN
C#CCCN1CCCCC[C@H]1CNC(=O)c1c(F)ccc(F)c1F	ZINC000969010696	1336117127	/nfs/dbraw/zinc/11/71/27/1336117127.db2.gz	ANVCFTIFADVCSM-ZDUSSCGKSA-N	0	3	338.373	3.102	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cnn(CCCC)c1CC	ZINC000969109177	1336147582	/nfs/dbraw/zinc/14/75/82/1336147582.db2.gz	WHXQOOIOIWHMGM-QGZVFWFLSA-N	0	3	346.519	3.406	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cccc(NC(C)=O)c1C	ZINC000969115941	1336150152	/nfs/dbraw/zinc/15/01/52/1336150152.db2.gz	YPWCFQZUFMNNJZ-QGZVFWFLSA-N	0	3	343.471	3.114	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccc(OCC)c(OC)c1	ZINC000969142000	1336160157	/nfs/dbraw/zinc/16/01/57/1336160157.db2.gz	RPJYUMRHXCCYGI-QGZVFWFLSA-N	0	3	346.471	3.254	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1c[nH]c2ccc(F)cc12	ZINC000969168131	1336170402	/nfs/dbraw/zinc/17/04/02/1336170402.db2.gz	XDZQWXCGVZOLCZ-MRXNPFEDSA-N	0	3	341.430	3.305	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](NCc2cc(C)ccc2OC)C1	ZINC000969564624	1336224658	/nfs/dbraw/zinc/22/46/58/1336224658.db2.gz	YMORFQJHVKTVMQ-QGZVFWFLSA-N	0	3	330.472	3.296	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)c2cnc3ccc(F)cc3c2)C1	ZINC000970690401	1336333542	/nfs/dbraw/zinc/33/35/42/1336333542.db2.gz	OUWUECUXGJBNFA-ZDUSSCGKSA-N	0	3	327.403	3.000	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCN(C(=O)C2=CCCCCC2)C1	ZINC000971404790	1336342623	/nfs/dbraw/zinc/34/26/23/1336342623.db2.gz	WWKUTXBWPLMZDM-HXUWFJFHSA-N	0	3	337.467	3.481	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccn(C3CCCC3)n2)CC1	ZINC001005459184	1336354374	/nfs/dbraw/zinc/35/43/74/1336354374.db2.gz	PDJKPOQOHBKQNY-UHFFFAOYSA-N	0	3	330.476	3.111	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cnc(-c3ccccc3)o2)CC1	ZINC001005538372	1336369763	/nfs/dbraw/zinc/36/97/63/1336369763.db2.gz	BROFQJIOTKWOAJ-UHFFFAOYSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ncsc2C(F)(F)F)CC1	ZINC001005712204	1336396330	/nfs/dbraw/zinc/39/63/30/1336396330.db2.gz	IIEVNPXSFVGTND-UHFFFAOYSA-N	0	3	347.406	3.274	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)[C@H]2CC[C@@H]2c2ccc(F)cc2)CC1	ZINC001005753693	1336398795	/nfs/dbraw/zinc/39/87/95/1336398795.db2.gz	GLFNGIGVBQTTIL-MOPGFXCFSA-N	0	3	330.447	3.428	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)Cc2c[nH]c3cc(C)ccc23)CC1	ZINC001006129533	1336456624	/nfs/dbraw/zinc/45/66/24/1336456624.db2.gz	XSFMXFNHBZYOGH-UHFFFAOYSA-N	0	3	325.456	3.128	20	30		EGEDHN
CC(C)[C@H]1C[C@@H]1C(=O)N(C)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001006219302	1336468436	/nfs/dbraw/zinc/46/84/36/1336468436.db2.gz	OFTMZGGZNVFOBO-UXHICEINSA-N	0	3	339.483	3.273	20	30		EGEDHN
CC[C@]1(C)C[C@H]1C(=O)N(C)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001006224485	1336470739	/nfs/dbraw/zinc/47/07/39/1336470739.db2.gz	JUEDHTMKRXDBCB-PZJWPPBQSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2csc(C(F)(F)F)n2)CC1	ZINC001006241644	1336474901	/nfs/dbraw/zinc/47/49/01/1336474901.db2.gz	RAJQGDKGNTVNPR-UHFFFAOYSA-N	0	3	347.406	3.274	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cnn(CCCC)c2C)CC1	ZINC001006267778	1336478962	/nfs/dbraw/zinc/47/89/62/1336478962.db2.gz	VDHSQGCDWKUDAH-UHFFFAOYSA-N	0	3	332.492	3.104	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cn(CCCC)nc2C)CC1	ZINC001006273329	1336479308	/nfs/dbraw/zinc/47/93/08/1336479308.db2.gz	BXZTVIPDTCTWQO-UHFFFAOYSA-N	0	3	332.492	3.104	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)Cc2ccc3c(c2)CCCC3)CC1	ZINC001006394752	1336499512	/nfs/dbraw/zinc/49/95/12/1336499512.db2.gz	VEENSVVBYDYIAX-UHFFFAOYSA-N	0	3	326.484	3.217	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H](NC(=O)c2ccc(-c3cc[nH]n3)s2)C1	ZINC001007545074	1336667165	/nfs/dbraw/zinc/66/71/65/1336667165.db2.gz	DHMNIMOVRXVDMF-CQSZACIVSA-N	0	3	344.484	3.299	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N[C@@H]1CCCN(CC[C@@H](C)F)C1	ZINC001007676223	1336687963	/nfs/dbraw/zinc/68/79/63/1336687963.db2.gz	WJUBRHDTFRLJBR-HZPDHXFCSA-N	0	3	334.435	3.194	20	30		EGEDHN
C#CCCN1CCC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)s2)C1	ZINC001008308240	1336819860	/nfs/dbraw/zinc/81/98/60/1336819860.db2.gz	BCIPYYPKLHEMSF-MGPQQGTHSA-N	0	3	336.888	3.109	20	30		EGEDHN
C=C(C)CCN1CCC[C@H](NC(=O)c2cc(Br)co2)C1	ZINC001008760101	1336921070	/nfs/dbraw/zinc/92/10/70/1336921070.db2.gz	HYCAZGFTHJTDDO-ZDUSSCGKSA-N	0	3	341.249	3.203	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N[C@H]1CCCN(CC2=CCCCC2)C1	ZINC001008838470	1336932801	/nfs/dbraw/zinc/93/28/01/1336932801.db2.gz	GRHDXVFPPTZBED-FHWLQOOXSA-N	0	3	332.488	3.049	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN(Cc3ccc(C)cc3C)C2)nc1	ZINC001009270310	1336994032	/nfs/dbraw/zinc/99/40/32/1336994032.db2.gz	RPCBRDNWNGOLKP-HXUWFJFHSA-N	0	3	347.462	3.074	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCN([C@H](C)c3cccc(C)c3)C2)cn1	ZINC001009273190	1336994673	/nfs/dbraw/zinc/99/46/73/1336994673.db2.gz	DNBSFKLEAWOYGK-UTKZUKDTSA-N	0	3	347.462	3.327	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2ccccc2C(F)(F)F)C1	ZINC001009308509	1337002935	/nfs/dbraw/zinc/00/29/35/1337002935.db2.gz	NZCRQMQKHXWVDK-ZDUSSCGKSA-N	0	3	326.362	3.476	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H](NC(=O)c2cc(C3CCCC3)no2)C1	ZINC001009576571	1337040837	/nfs/dbraw/zinc/04/08/37/1337040837.db2.gz	GHLDKUDNWLPOAL-MRXNPFEDSA-N	0	3	331.460	3.493	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2coc(C3CCCCC3)n2)C1	ZINC001009686104	1337059587	/nfs/dbraw/zinc/05/95/87/1337059587.db2.gz	VJYRGRNAXKHMBE-MRXNPFEDSA-N	0	3	331.460	3.493	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2cccc3c2CCCCC3)CC1	ZINC001016672285	1338686424	/nfs/dbraw/zinc/68/64/24/1338686424.db2.gz	OUTBSVNWSJYTCN-FQEVSTJZSA-N	0	3	336.479	3.173	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2c(C)[nH]c3ccccc32)CC1	ZINC001016719863	1338701876	/nfs/dbraw/zinc/70/18/76/1338701876.db2.gz	SUKZZPFYCCDCDH-GOSISDBHSA-N	0	3	335.451	3.084	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)[C@@H](c2ccccc2)C2CC2)CC1	ZINC001016726030	1338703740	/nfs/dbraw/zinc/70/37/40/1338703740.db2.gz	LKKOOWFCKKTPEV-UXHICEINSA-N	0	3	336.479	3.174	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cc(C)cc(Cl)c2)CC1	ZINC001016735175	1338707123	/nfs/dbraw/zinc/70/71/23/1338707123.db2.gz	AVGQEARMWALRGE-KRWDZBQOSA-N	0	3	330.859	3.256	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2coc3cc(C)c(C)cc32)CC1	ZINC001016747979	1338710809	/nfs/dbraw/zinc/71/08/09/1338710809.db2.gz	FKWGWNRKVAEXSL-IBGZPJMESA-N	0	3	336.435	3.267	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2cc3c(cc(C)cc3C)[nH]2)CC1	ZINC001016753219	1338712495	/nfs/dbraw/zinc/71/24/95/1338712495.db2.gz	JDIQCPODWCGAOJ-LJQANCHMSA-N	0	3	335.451	3.002	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2c(C)cc(F)cc2C)CC1	ZINC001016766976	1338717677	/nfs/dbraw/zinc/71/76/77/1338717677.db2.gz	PLAGCZIYDOAUBB-KRWDZBQOSA-N	0	3	328.431	3.050	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2csc3c2CC[C@@H](C)C3)CC1	ZINC001016957036	1338783819	/nfs/dbraw/zinc/78/38/19/1338783819.db2.gz	WCDQCOSADYRLAL-KDOFPFPSSA-N	0	3	342.508	3.090	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2cc3c(s2)CC[C@H](C)C3)CC1	ZINC001016964147	1338786605	/nfs/dbraw/zinc/78/66/05/1338786605.db2.gz	YYTYTRLCEKTZBC-KSSFIOAISA-N	0	3	342.508	3.090	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccc(C)c3c2CCC3)CC1	ZINC001016991099	1338795895	/nfs/dbraw/zinc/79/58/95/1338795895.db2.gz	XQBAYRPBPWTBCI-HXUWFJFHSA-N	0	3	336.479	3.091	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2oc3ccccc3c2CC)CC1	ZINC001016993589	1338796851	/nfs/dbraw/zinc/79/68/51/1338796851.db2.gz	OKDCSTAKQXEXTP-SFHVURJKSA-N	0	3	336.435	3.213	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCCN(C(=O)/C=C/C2CC2)C1	ZINC001017089745	1338857445	/nfs/dbraw/zinc/85/74/45/1338857445.db2.gz	YRTWZGODNOIHIC-FSNWXROXSA-N	0	3	343.496	3.256	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCCN(C(=O)[C@@H]2CC2(C)C)C1	ZINC001017106468	1338871648	/nfs/dbraw/zinc/87/16/48/1338871648.db2.gz	HVTIASHCWFZGPG-YOEHRIQHSA-N	0	3	345.512	3.336	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)Cc1ccccc1F	ZINC001017937537	1339460035	/nfs/dbraw/zinc/46/00/35/1339460035.db2.gz	RBSHZASPIQKJMG-RYQLBKOJSA-N	0	3	330.447	3.256	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CO[C@@H]1CCCC[C@@H]1C	ZINC001018016332	1339481986	/nfs/dbraw/zinc/48/19/86/1339481986.db2.gz	JHCBLLGGZXHNGB-INDMIFKZSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@H]1CCO[C@@H](C(C)C)C1	ZINC001018157284	1339517900	/nfs/dbraw/zinc/51/79/00/1339517900.db2.gz	ODYACOGDVGQLNK-INDMIFKZSA-N	0	3	334.504	3.079	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)Oc1ccc(C)cc1	ZINC001018244841	1339547968	/nfs/dbraw/zinc/54/79/68/1339547968.db2.gz	FBHRCDNYSPIEPA-GBESFXJTSA-N	0	3	342.483	3.404	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC[C@H](NCc2ccccc2Oc2ccccc2)C1	ZINC001018617171	1339683596	/nfs/dbraw/zinc/68/35/96/1339683596.db2.gz	GAFXKUGUERQUSL-AEFFLSMTSA-N	0	3	349.434	3.329	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@H](NCc2cc(Cl)cc(Cl)c2)C1	ZINC001018826874	1339735463	/nfs/dbraw/zinc/73/54/63/1339735463.db2.gz	MZSAMSPAHSTJIZ-INIZCTEOSA-N	0	3	337.250	3.097	20	30		EGEDHN
CC(C)(C)C[C@@H]1C[C@H]1C(=O)N1CC[C@H](NCc2ccc(C#N)s2)C1	ZINC001018868062	1339739859	/nfs/dbraw/zinc/73/98/59/1339739859.db2.gz	AMJQMLIYEBGMEF-GRDNDAEWSA-N	0	3	345.512	3.383	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@H](NCc2ccc(F)c(F)c2)C1	ZINC001018909421	1339750019	/nfs/dbraw/zinc/75/00/19/1339750019.db2.gz	ZRIAOIHKDSOUAM-ZDUSSCGKSA-N	0	3	342.817	3.434	20	30		EGEDHN
Cc1cc(C)c(C(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)s1	ZINC001018916686	1339753225	/nfs/dbraw/zinc/75/32/25/1339753225.db2.gz	GAYSGYZQOJJJLZ-ZDUSSCGKSA-N	0	3	345.493	3.302	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1cc(F)c(Cl)cc1F	ZINC001028106476	1340430297	/nfs/dbraw/zinc/43/02/97/1340430297.db2.gz	AEWZOPJPRUQYRK-LLVKDONJSA-N	0	3	328.790	3.389	20	30		EGEDHN
C=Cc1ccc(C(=O)NC[C@@H]2CCN(Cc3cccc(C#N)c3)C2)cc1	ZINC001028822324	1340838588	/nfs/dbraw/zinc/83/85/88/1340838588.db2.gz	RQRQPIFGJZLSEJ-FQEVSTJZSA-N	0	3	345.446	3.453	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)c2ccc(Cl)c(Cl)c2)C1	ZINC001028950269	1340892025	/nfs/dbraw/zinc/89/20/25/1340892025.db2.gz	ZQOCJRUGZSJQGM-GFCCVEGCSA-N	0	3	325.239	3.068	20	30		EGEDHN
CC(C)=CC(=O)N1CCC([C@H](C)NCc2ccccc2C#N)CC1	ZINC001029043353	1340916418	/nfs/dbraw/zinc/91/64/18/1340916418.db2.gz	GKGXFKIDXQBUSR-INIZCTEOSA-N	0	3	325.456	3.241	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)C1CCN(C(=O)[C@@H](C)C2CC2)CC1	ZINC001029076854	1340924590	/nfs/dbraw/zinc/92/45/90/1340924590.db2.gz	DJNWDSCDQXZLLC-JKSUJKDBSA-N	0	3	339.483	3.321	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC([C@@H](C)NCc2ccccc2C#N)CC1	ZINC001029078263	1340925177	/nfs/dbraw/zinc/92/51/77/1340925177.db2.gz	NSOXFRDJSPHEKL-UDCCBSLUSA-N	0	3	325.456	3.241	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC([C@H](C)NCc2nccn2CC)CC1	ZINC001029123939	1340935868	/nfs/dbraw/zinc/93/58/68/1340935868.db2.gz	AYNNUHGCSMLAQQ-INIZCTEOSA-N	0	3	346.519	3.222	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC([C@@H](C)NCc2ccn(CC)n2)CC1	ZINC001029124842	1340935998	/nfs/dbraw/zinc/93/59/98/1340935998.db2.gz	CDTHFYFZNAJUCU-MRXNPFEDSA-N	0	3	346.519	3.222	20	30		EGEDHN
CCC1(C(=O)N2CCC([C@@H](C)NCc3ccccc3C#N)CC2)CC1	ZINC001029139231	1340940487	/nfs/dbraw/zinc/94/04/87/1340940487.db2.gz	AYRHJOSTLMDDPY-MRXNPFEDSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC([C@@H](C)NCc2cnc(C)cn2)CC1	ZINC001029139226	1340940493	/nfs/dbraw/zinc/94/04/93/1340940493.db2.gz	ATLGPVSPKZEKRW-OXQOHEQNSA-N	0	3	344.503	3.104	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N1C[C@H]2CC[C@@H](C1)N2CCCC1CCC1	ZINC001029312063	1340970334	/nfs/dbraw/zinc/97/03/34/1340970334.db2.gz	OXZWQLYSYCNPEN-WCIQWLHISA-N	0	3	346.515	3.223	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CC[C@@H](C1)N2CCc1ccc(C)cc1	ZINC001029422519	1340986613	/nfs/dbraw/zinc/98/66/13/1340986613.db2.gz	MSPSMYFDQBOTIN-KDURUIRLSA-N	0	3	326.484	3.425	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](CN(C)Cc2c(C)noc2C)C1	ZINC001029797870	1341076269	/nfs/dbraw/zinc/07/62/69/1341076269.db2.gz	CNNQPRKLFNIPQO-INIZCTEOSA-N	0	3	333.476	3.174	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001029823632	1341086382	/nfs/dbraw/zinc/08/63/82/1341086382.db2.gz	VOFPYXDLSRFWGI-AWEZNQCLSA-N	0	3	333.501	3.336	20	30		EGEDHN
Cc1ccc(CN(C)CC2CCN(C(=O)[C@H](C)C#N)CC2)c(Cl)c1	ZINC001029946254	1341130896	/nfs/dbraw/zinc/13/08/96/1341130896.db2.gz	JBSBNEKRFMEQAX-OAHLLOKOSA-N	0	3	347.890	3.479	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)CC1CCN(C(=O)/C=C\C2CC2)CC1	ZINC001029950125	1341131902	/nfs/dbraw/zinc/13/19/02/1341131902.db2.gz	JBDJIPKQFXJGCP-DAXSKMNVSA-N	0	3	343.496	3.256	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC(CN(C)Cc2ccc(C#N)s2)CC1	ZINC001029953874	1341133254	/nfs/dbraw/zinc/13/32/54/1341133254.db2.gz	LWDBAHOXQIIJEE-CPSFFCFKSA-N	0	3	331.485	3.256	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC(CN(C)Cc2ocnc2C)CC1	ZINC001029982771	1341143789	/nfs/dbraw/zinc/14/37/89/1341143789.db2.gz	JFFMVRSWFOZJRP-UHFFFAOYSA-N	0	3	333.476	3.256	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC(CN(C)[C@H](C)c3cnccn3)CC2)C1	ZINC001029993560	1341150140	/nfs/dbraw/zinc/15/01/40/1341150140.db2.gz	JAZSMLPZMSASCR-MRXNPFEDSA-N	0	3	342.487	3.064	20	30		EGEDHN
CC1(C)CCC(CN2C[C@@H]3C[C@H]2CN3C(=O)c2c[nH]c(C#N)c2)CC1	ZINC001032362733	1341502506	/nfs/dbraw/zinc/50/25/06/1341502506.db2.gz	PTANPEJXPGWMQE-ROUUACIJSA-N	0	3	340.471	3.001	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2C[C@@H]3C[C@H]2CN3C[C@@H](C)CC)cc1	ZINC001032483857	1341521050	/nfs/dbraw/zinc/52/10/50/1341521050.db2.gz	KXVZMBWJYLKNGO-SZMVWBNQSA-N	0	3	328.456	3.196	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cc2cc(OC)ccc2[nH]1	ZINC001032595994	1341552159	/nfs/dbraw/zinc/55/21/59/1341552159.db2.gz	LVXNTZRHBDYMJJ-HOTGVXAUSA-N	0	3	339.439	3.041	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1coc2ccc(F)cc21	ZINC001032756861	1341604379	/nfs/dbraw/zinc/60/43/79/1341604379.db2.gz	UXVBWEIYJSCCLH-GJZGRUSLSA-N	0	3	328.387	3.437	20	30		EGEDHN
C=CCCN1CC[C@H](N(C)C(=O)c2cnc(-c3ccccc3)o2)C1	ZINC001033166169	1341743040	/nfs/dbraw/zinc/74/30/40/1341743040.db2.gz	RNBTYVYLAARCTR-INIZCTEOSA-N	0	3	325.412	3.064	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2cc(C(C)(C)C)oc2C)C1	ZINC001073789001	1355899908	/nfs/dbraw/zinc/89/99/08/1355899908.db2.gz	XXUHEWAQEGCALF-INIZCTEOSA-N	0	3	348.487	3.282	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2cnoc2-c2ccccc2)C1	ZINC001033537152	1341862362	/nfs/dbraw/zinc/86/23/62/1341862362.db2.gz	REORXEJKPLJGNY-MRXNPFEDSA-N	0	3	325.412	3.064	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2cnc3ccc(F)cc3c2)C1	ZINC001033556009	1341870679	/nfs/dbraw/zinc/87/06/79/1341870679.db2.gz	WBWKUCZUZSAHPE-QGZVFWFLSA-N	0	3	327.403	3.096	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@@H]2CCN(Cc3cc(C)ccc3C)C2)cn1	ZINC001033598378	1341890599	/nfs/dbraw/zinc/89/05/99/1341890599.db2.gz	JSSSEPSVBWQHFX-OAQYLSRUSA-N	0	3	347.462	3.026	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)C(C)(C)c2ccccc2OC)C1	ZINC001033708061	1341969575	/nfs/dbraw/zinc/96/95/75/1341969575.db2.gz	TZEXITCVLBPMIJ-MRXNPFEDSA-N	0	3	330.472	3.082	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2cc3ccccc3nc2C)C1	ZINC001033846701	1342041898	/nfs/dbraw/zinc/04/18/98/1342041898.db2.gz	RXBPJLOLLCTGDD-SFHVURJKSA-N	0	3	335.451	3.103	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2cc3c(o2)c(F)ccc3C)C1	ZINC001033905142	1342077013	/nfs/dbraw/zinc/07/70/13/1342077013.db2.gz	FFDNVUYFCYKNDB-OAHLLOKOSA-N	0	3	342.414	3.440	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)C1	ZINC001033985330	1342130894	/nfs/dbraw/zinc/13/08/94/1342130894.db2.gz	NCISLOIOLJPEGX-YZGWKJHDSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccc(-c3cn[nH]c3)cc2)C1	ZINC001033989676	1342133568	/nfs/dbraw/zinc/13/35/68/1342133568.db2.gz	NOKOKXKODHYKOX-LJQANCHMSA-N	0	3	338.455	3.189	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cnn(CCC(C)C)c2C)C1	ZINC001034010634	1342147491	/nfs/dbraw/zinc/14/74/91/1342147491.db2.gz	AZZYNJYFIRLESW-SFHVURJKSA-N	0	3	346.519	3.350	20	30		EGEDHN
C#Cc1ccc(C(=O)N(CC)[C@@H]2CCN(Cc3ccc(C)cc3)C2)cn1	ZINC001034027509	1342166588	/nfs/dbraw/zinc/16/65/88/1342166588.db2.gz	WAJDWZQNPYRETA-OAQYLSRUSA-N	0	3	347.462	3.108	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2c(Cl)nc3ccccn32)C1	ZINC001034034941	1342173521	/nfs/dbraw/zinc/17/35/21/1342173521.db2.gz	HROVPQYAIDPBDV-CQSZACIVSA-N	0	3	346.862	3.100	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccc(OCC)c(OC)c2)C1	ZINC001034038222	1342178406	/nfs/dbraw/zinc/17/84/06/1342178406.db2.gz	QRZNMLRIQBEECQ-KRWDZBQOSA-N	0	3	346.471	3.206	20	30		EGEDHN
C=CCCN1CCCC[C@@H](NC(=O)c2sc(C3CC3)nc2C)C1	ZINC001034202960	1342313161	/nfs/dbraw/zinc/31/31/61/1342313161.db2.gz	CNIJHLDPOULSMU-OAHLLOKOSA-N	0	3	333.501	3.489	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2nsc3ccccc32)C1	ZINC001034221044	1342325702	/nfs/dbraw/zinc/32/57/02/1342325702.db2.gz	JDKDNQKZXVBWJV-AWEZNQCLSA-N	0	3	329.469	3.457	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc(C)c(NC(C)=O)c2)C1	ZINC001034221576	1342326347	/nfs/dbraw/zinc/32/63/47/1342326347.db2.gz	RPRDSZDRVXRHGI-GOSISDBHSA-N	0	3	343.471	3.114	20	30		EGEDHN
C=CCCN1CCCC[C@@H](NC(=O)c2cc3ccncc3s2)C1	ZINC001034250731	1342347717	/nfs/dbraw/zinc/34/77/17/1342347717.db2.gz	RZCQYPIUZNIIRE-OAHLLOKOSA-N	0	3	329.469	3.457	20	30		EGEDHN
C=CCCN1CCCC[C@@H](NC(=O)c2ccc(-c3cc[nH]n3)s2)C1	ZINC001034266256	1342357660	/nfs/dbraw/zinc/35/76/60/1342357660.db2.gz	VWXLMWZPBXGXNR-CQSZACIVSA-N	0	3	344.484	3.299	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2cc(C)c3ccccc3n2)C1	ZINC001034275015	1342365921	/nfs/dbraw/zinc/36/59/21/1342365921.db2.gz	XRCXPQKMDVPGQV-KRWDZBQOSA-N	0	3	335.451	3.151	20	30		EGEDHN
C=C(Cl)CN1CCCC[C@H](NC(=O)c2n[nH]c3ccc(C)cc32)C1	ZINC001034285973	1342373379	/nfs/dbraw/zinc/37/33/79/1342373379.db2.gz	HXVVCBPVGDOAQW-AWEZNQCLSA-N	0	3	346.862	3.208	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@@H]2CCOc3c(F)cccc32)C1	ZINC001034296262	1342379912	/nfs/dbraw/zinc/37/99/12/1342379912.db2.gz	NLPPMCWUPRWSMD-NVXWUHKLSA-N	0	3	346.446	3.239	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)Cn2c(C)cc3ccccc32)C1	ZINC001034303978	1342386421	/nfs/dbraw/zinc/38/64/21/1342386421.db2.gz	NYTGNFAUMBTPLN-SFHVURJKSA-N	0	3	325.456	3.106	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)C2([C@@H]3CCCCO3)CCC2)C1	ZINC001034305535	1342388415	/nfs/dbraw/zinc/38/84/15/1342388415.db2.gz	ABFLCZUVLHBRSM-MSOLQXFVSA-N	0	3	334.504	3.273	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ncsc2C(F)(F)F)C1	ZINC001034308741	1342391802	/nfs/dbraw/zinc/39/18/02/1342391802.db2.gz	CUCGMJDZRPQZHE-NSHDSACASA-N	0	3	347.406	3.322	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@H]2CCc3cc(C)ccc3O2)C1	ZINC001034311087	1342392743	/nfs/dbraw/zinc/39/27/43/1342392743.db2.gz	ZAVYHSKREJLCHY-AZUAARDMSA-N	0	3	342.483	3.235	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)C2(c3cccc(F)c3)CCC2)C1	ZINC001034336091	1342411062	/nfs/dbraw/zinc/41/10/62/1342411062.db2.gz	IVRARKNWNSFGSK-GOSISDBHSA-N	0	3	330.447	3.404	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc3nc(C)n(C)c3c2)C1	ZINC001034345520	1342416494	/nfs/dbraw/zinc/41/64/94/1342416494.db2.gz	SZVCRDMVCULMQB-KRWDZBQOSA-N	0	3	340.471	3.042	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2cc3cccc(OC)c3o2)C1	ZINC001034372760	1342441483	/nfs/dbraw/zinc/44/14/83/1342441483.db2.gz	OBJOVOJPEJERSU-INIZCTEOSA-N	0	3	340.423	3.049	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)C2(c3cccc(OC)c3)CC2)C1	ZINC001034423798	1342485602	/nfs/dbraw/zinc/48/56/02/1342485602.db2.gz	KZJYRGVRNOVPQP-SFHVURJKSA-N	0	3	342.483	3.274	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc3c(c2)C[C@@H](C)O3)C1	ZINC001034444690	1342505155	/nfs/dbraw/zinc/50/51/55/1342505155.db2.gz	JQELENYMTHPYIA-CRAIPNDOSA-N	0	3	328.456	3.170	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cc(C)cc3c[nH]nc32)C1	ZINC001034448253	1342508379	/nfs/dbraw/zinc/50/83/79/1342508379.db2.gz	MLPHJFTUEVEMNI-MRXNPFEDSA-N	0	3	326.444	3.032	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cccc(N3CCCC3)c2)C1	ZINC001034463357	1342519289	/nfs/dbraw/zinc/51/92/89/1342519289.db2.gz	SQZRJYRQTOFNGE-IBGZPJMESA-N	0	3	341.499	3.447	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)c2cccc(-c3cnco3)c2)C1	ZINC001034471261	1342525839	/nfs/dbraw/zinc/52/58/39/1342525839.db2.gz	BMEIDMHESFETAU-KRWDZBQOSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@H](C)n2cnc3ccccc32)C1	ZINC001034474630	1342529499	/nfs/dbraw/zinc/52/94/99/1342529499.db2.gz	UERYXSBTFXIPHW-DLBZAZTESA-N	0	3	340.471	3.144	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cnn([C@@H](C)CC)c2C)C1	ZINC001034482555	1342540266	/nfs/dbraw/zinc/54/02/66/1342540266.db2.gz	CVSGUKMLWFPHOQ-DOTOQJQBSA-N	0	3	332.492	3.323	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2c[nH]nc2C2CCCCC2)C1	ZINC001034487405	1342545814	/nfs/dbraw/zinc/54/58/14/1342545814.db2.gz	NAWSVJPKUDRAKC-QGZVFWFLSA-N	0	3	342.487	3.065	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC001034503892	1342561760	/nfs/dbraw/zinc/56/17/60/1342561760.db2.gz	QYAKUFUYFVEKRN-MRXNPFEDSA-N	0	3	338.373	3.313	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2coc3ccc(F)cc23)C1	ZINC001034509474	1342567781	/nfs/dbraw/zinc/56/77/81/1342567781.db2.gz	CBGJXJYVUGPZHQ-OAHLLOKOSA-N	0	3	328.387	3.180	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)[C@@H]2C[C@H]2c2cccc(F)c2F)C1	ZINC001034531692	1342586436	/nfs/dbraw/zinc/58/64/36/1342586436.db2.gz	IMOPMBBYZJCORQ-CWRNSKLLSA-N	0	3	334.410	3.225	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)C2CC(c3ccc(F)cc3)C2)C1	ZINC001034554527	1342616498	/nfs/dbraw/zinc/61/64/98/1342616498.db2.gz	RVJOGANIDTYCKN-FAFZWHIHSA-N	0	3	330.447	3.476	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cccnc2OC(C)C)C1	ZINC001034561243	1342619504	/nfs/dbraw/zinc/61/95/04/1342619504.db2.gz	BPPGVJDUJXPMBK-MRXNPFEDSA-N	0	3	331.460	3.029	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H]2CC[C@H](NCc3ccccc3C#N)CC2)o1	ZINC001034588617	1342633773	/nfs/dbraw/zinc/63/37/73/1342633773.db2.gz	POWPPEQXERQDAU-IYARVYRRSA-N	0	3	337.423	3.291	20	30		EGEDHN
Cc1cc[nH]c1C(=O)N[C@H]1CC[C@H](NCc2ccccc2C#N)CC1	ZINC001034639731	1342666039	/nfs/dbraw/zinc/66/60/39/1342666039.db2.gz	WKXGMCUSMIBOSO-IYARVYRRSA-N	0	3	336.439	3.026	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1CC[C@H](NC(=O)[C@H]2CC[C@@H](F)C2)CC1	ZINC001034719066	1342713600	/nfs/dbraw/zinc/71/36/00/1342713600.db2.gz	PUANBKLBJWUOIS-VLQPXKRTSA-N	0	3	343.446	3.213	20	30		EGEDHN
Cc1cccc(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)s2)c1	ZINC001034847818	1342800800	/nfs/dbraw/zinc/80/08/00/1342800800.db2.gz	CMFOMDKFAAUIMS-MRXNPFEDSA-N	0	3	339.464	3.323	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)c2cccs2)cc1F	ZINC001034848924	1342802051	/nfs/dbraw/zinc/80/20/51/1342802051.db2.gz	BBLIZUDDRRXAGR-OAHLLOKOSA-N	0	3	343.427	3.153	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)CC2CCCC2)cc1F	ZINC001034850336	1342802491	/nfs/dbraw/zinc/80/24/91/1342802491.db2.gz	JSKUFBCMXKECKA-GOSISDBHSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC[C@@H]1CNCc1cncc(F)c1	ZINC001034947427	1342848798	/nfs/dbraw/zinc/84/87/98/1342848798.db2.gz	QHNYSMBMPSSQAA-OAHLLOKOSA-N	0	3	339.842	3.080	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H]1CNCc1cccc(OCC)n1	ZINC001035035307	1342888763	/nfs/dbraw/zinc/88/87/63/1342888763.db2.gz	IWULYCHAOIGKAE-XLIONFOSSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=C[C@H](C(=O)N1CCC[C@@H]1CNCc1cncc(C)c1)c1ccccc1	ZINC001035131918	1342949027	/nfs/dbraw/zinc/94/90/27/1342949027.db2.gz	YRUZMZXHGGCXQI-RTWAWAEBSA-N	0	3	349.478	3.440	20	30		EGEDHN
N#Cc1ccccc1CN1CCC2(C1)CCN(C(=O)C1CCC1)CC2	ZINC001035147206	1342958588	/nfs/dbraw/zinc/95/85/88/1342958588.db2.gz	DZUGNBNAFVCQDX-UHFFFAOYSA-N	0	3	337.467	3.173	20	30		EGEDHN
C[C@@H]1C[C@@H]1C(=O)N1CCC2(CCN(Cc3ccccc3C#N)C2)CC1	ZINC001035154754	1342968808	/nfs/dbraw/zinc/96/88/08/1342968808.db2.gz	YTCQNPMYBXGBTE-APWZRJJASA-N	0	3	337.467	3.029	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1oc(CC3CC3)nc1C)CC2	ZINC001035707121	1343144379	/nfs/dbraw/zinc/14/43/79/1343144379.db2.gz	RTSIYQQXMKIORW-UHFFFAOYSA-N	0	3	343.471	3.050	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc3nc(C)oc3c1)CC2	ZINC001035728913	1343155806	/nfs/dbraw/zinc/15/58/06/1343155806.db2.gz	RMZIPFRANWNDGR-UHFFFAOYSA-N	0	3	339.439	3.250	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC2(CN(CCc3scnc3C)C2)CC1	ZINC001035766545	1343178037	/nfs/dbraw/zinc/17/80/37/1343178037.db2.gz	IWIVHKKRPAYSPH-UHFFFAOYSA-N	0	3	347.528	3.131	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H]1CC[C@@H](C(F)(F)F)C1)CC2	ZINC001035777278	1343188327	/nfs/dbraw/zinc/18/83/27/1343188327.db2.gz	KUKPVLPDGKMRBA-HUUCEWRRSA-N	0	3	344.421	3.466	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cccc(OC)c1C)CC2	ZINC001035806812	1343207820	/nfs/dbraw/zinc/20/78/20/1343207820.db2.gz	JRTFEYDNGVQRID-UHFFFAOYSA-N	0	3	328.456	3.118	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc3c(c1)C[C@H](C)O3)CC2	ZINC001035820636	1343215242	/nfs/dbraw/zinc/21/52/42/1343215242.db2.gz	YHYFBSBIHADDFD-INIZCTEOSA-N	0	3	340.467	3.124	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc3sccc3[nH]1)CC2	ZINC001035828294	1343217349	/nfs/dbraw/zinc/21/73/49/1343217349.db2.gz	MRZRJPHOPBUXFI-UHFFFAOYSA-N	0	3	329.469	3.344	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccc3[nH]c(C)c(C)c3c1)CC2	ZINC001035849023	1343228775	/nfs/dbraw/zinc/22/87/75/1343228775.db2.gz	ONZOIVMWHQHDFO-UHFFFAOYSA-N	0	3	349.478	3.346	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@@H](C)Cc1ccccc1C)CC2	ZINC001035859513	1343235788	/nfs/dbraw/zinc/23/57/88/1343235788.db2.gz	CFHBWYWMTUGXNA-IBGZPJMESA-N	0	3	338.495	3.121	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)CCc1ccc(C)s1)CC2	ZINC001035862562	1343238297	/nfs/dbraw/zinc/23/82/97/1343238297.db2.gz	KBULWXZULWASSZ-UHFFFAOYSA-N	0	3	332.513	3.490	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccsc2)CC[C@@H]1NCc1ccccc1C#N	ZINC001035901987	1343259829	/nfs/dbraw/zinc/25/98/29/1343259829.db2.gz	SFQGYVDEWKQGQH-KDOFPFPSSA-N	0	3	339.464	3.260	20	30		EGEDHN
C[C@H]1CN(C(=O)CCC2CC2)CC[C@@H]1NCc1cc(F)ccc1C#N	ZINC001035969217	1343292712	/nfs/dbraw/zinc/29/27/12/1343292712.db2.gz	UAOMXXZJYZUZIU-LIRRHRJNSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](NCc3csc(CC)n3)[C@@H](C)C2)C1	ZINC001036169765	1343342462	/nfs/dbraw/zinc/34/24/62/1343342462.db2.gz	NSLIMIQWVQIHET-HOCLYGCPSA-N	0	3	347.528	3.388	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](NCc3nc(C)cs3)[C@@H](C)C2)C1	ZINC001036170217	1343343076	/nfs/dbraw/zinc/34/30/76/1343343076.db2.gz	QVNHUEKNVYXEGQ-ZFWWWQNUSA-N	0	3	333.501	3.134	20	30		EGEDHN
C[C@H]1CN(C(=O)C2CC3(CC3)C2)CC[C@H]1NCc1ccccc1C#N	ZINC001036186291	1343352177	/nfs/dbraw/zinc/35/21/77/1343352177.db2.gz	MHTMSBLIYCAIOT-HNAYVOBHSA-N	0	3	337.467	3.075	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@@H]([C@@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001036339581	1343425264	/nfs/dbraw/zinc/42/52/64/1343425264.db2.gz	GHAINXSZQJNCJW-NVXWUHKLSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]([C@@H](C)NCc2ccccc2C#N)C1	ZINC001036429118	1343481929	/nfs/dbraw/zinc/48/19/29/1343481929.db2.gz	SUBILBSNNLGTOL-APWZRJJASA-N	0	3	339.483	3.487	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@@H]([C@@H](C)NCc3cc(C)no3)C2)CC1	ZINC001036429123	1343482013	/nfs/dbraw/zinc/48/20/13/1343482013.db2.gz	FFYCZTKKPAHLRG-SJLPKXTDSA-N	0	3	345.487	3.446	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@@H]([C@H](C)NCc3ccccc3C#N)C2)CC1	ZINC001036439559	1343488634	/nfs/dbraw/zinc/48/86/34/1343488634.db2.gz	PWYNDSCQAOIOJP-QFBILLFUSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]([C@H](C)NCc3cnc(C)o3)C2)C1	ZINC001036440550	1343488849	/nfs/dbraw/zinc/48/88/49/1343488849.db2.gz	ABVVQMKKURJLGS-GOEBONIOSA-N	0	3	331.460	3.056	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H]([C@@H](C)NCc2cc(C)no2)C1	ZINC001036442222	1343489772	/nfs/dbraw/zinc/48/97/72/1343489772.db2.gz	SKUGOCPJGIJOKD-CVEARBPZSA-N	0	3	333.476	3.302	20	30		EGEDHN
C[C@H]1CCCN(C(=O)C2CCC2)[C@H]1CNCc1ccc(C#N)cc1F	ZINC001036490932	1343513806	/nfs/dbraw/zinc/51/38/06/1343513806.db2.gz	WYZZELDNIRDXHT-LIRRHRJNSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@H]1CCCN(C(=O)C(C)(C)F)[C@H]1CNCc1ccc(C#N)s1	ZINC001036501684	1343519767	/nfs/dbraw/zinc/51/97/67/1343519767.db2.gz	POTOLUJQGONRFC-WFASDCNBSA-N	0	3	337.464	3.085	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@H](C)[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001036502387	1343520520	/nfs/dbraw/zinc/52/05/20/1343520520.db2.gz	JCHKRXPKFNIMOH-KXBFYZLASA-N	0	3	343.446	3.380	20	30		EGEDHN
O=C(C1CC1)N1CC[C@@H]2[C@@H](CCN2CC#Cc2cccc(Cl)c2)C1	ZINC001036613870	1343574679	/nfs/dbraw/zinc/57/46/79/1343574679.db2.gz	NJVRULIZPVYHBD-PKOBYXMFSA-N	0	3	342.870	3.024	20	30		EGEDHN
O=C(CC1CCC1)N1CC[C@@H]2[C@@H](CCN2CC#Cc2ccccc2)C1	ZINC001036677663	1343617903	/nfs/dbraw/zinc/61/79/03/1343617903.db2.gz	FOTHNISOSFCLPC-LEWJYISDSA-N	0	3	336.479	3.151	20	30		EGEDHN
C/C=C(\C)C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccc(C#N)c(F)c2)C1	ZINC001036682518	1343624577	/nfs/dbraw/zinc/62/45/77/1343624577.db2.gz	FFFCGOMYSCVWIA-WAELIVTPSA-N	0	3	341.430	3.086	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@H]2[C@H](CCN2Cc2ccccc2Cl)C1	ZINC001036714093	1343646687	/nfs/dbraw/zinc/64/66/87/1343646687.db2.gz	SIASPDXQFAVIAT-MJGOQNOKSA-N	0	3	342.870	3.176	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@@H]2[C@H](CCN2Cc2sccc2Cl)C1	ZINC001036714035	1343647027	/nfs/dbraw/zinc/64/70/27/1343647027.db2.gz	RWEMMJIKSZWNIJ-GDBMZVCRSA-N	0	3	348.899	3.238	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2[C@@H](CCN2Cc2conc2C)C1	ZINC001036793673	1343725692	/nfs/dbraw/zinc/72/56/92/1343725692.db2.gz	JLPHPNFSGIHNIU-RDJZCZTQSA-N	0	3	331.460	3.008	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@H]2[C@@H](CCN2Cc2ccccc2C#N)C1	ZINC001036804188	1343738573	/nfs/dbraw/zinc/73/85/73/1343738573.db2.gz	FTSHETHYLDFJTC-OALUTQOASA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H]3[C@H](CCN3Cc3cnc(C)o3)C2)CC1	ZINC001036811936	1343746992	/nfs/dbraw/zinc/74/69/92/1343746992.db2.gz	YZTWGEPWJBTIIJ-IEBWSBKVSA-N	0	3	343.471	3.152	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H]3[C@@H](CCN3Cc3ocnc3C)C2)CC1	ZINC001036811581	1343747307	/nfs/dbraw/zinc/74/73/07/1343747307.db2.gz	SPXYSWDHDVPOFK-ROUUACIJSA-N	0	3	343.471	3.152	20	30		EGEDHN
CC1(C(=O)N[C@@H]2CCCC[C@@H]2CNCc2ccccc2C#N)CC1	ZINC001037189696	1344028749	/nfs/dbraw/zinc/02/87/49/1344028749.db2.gz	DBYNCUMBIYKCDL-QZTJIDSGSA-N	0	3	325.456	3.123	20	30		EGEDHN
CC[C@H]1CN(C(=O)C=C(C)C)CC[C@@H]1NCc1cc(F)ccc1C#N	ZINC001037781550	1344092225	/nfs/dbraw/zinc/09/22/25/1344092225.db2.gz	WBSNOMDQRWDVOM-KXBFYZLASA-N	0	3	343.446	3.380	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](NCc2nc(C)cs2)[C@H](CC)C1	ZINC001037906789	1344171067	/nfs/dbraw/zinc/17/10/67/1344171067.db2.gz	SKYWATLUFUSHQE-CABCVRRESA-N	0	3	335.517	3.380	20	30		EGEDHN
CC[C@H]1CN(C(=O)C(C)(C)C)CC[C@@H]1NCc1cc(F)ccc1C#N	ZINC001037964147	1344207328	/nfs/dbraw/zinc/20/73/28/1344207328.db2.gz	XLJFPZQCWOHMPA-KSSFIOAISA-N	0	3	345.462	3.460	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@H]1CCN1CCCC1CCCC1	ZINC001038348153	1344391096	/nfs/dbraw/zinc/39/10/96/1344391096.db2.gz	AMMSHJATJGKAPH-GOSISDBHSA-N	0	3	329.488	3.449	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1cc(C)nn1C(CC)CC	ZINC001038426461	1344423497	/nfs/dbraw/zinc/42/34/97/1344423497.db2.gz	WNDAEGDHEQFGHH-KRWDZBQOSA-N	0	3	332.492	3.323	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1ccc(C(F)(F)F)cc1	ZINC001038944882	1344667828	/nfs/dbraw/zinc/66/78/28/1344667828.db2.gz	JVQFUNQEOWUIRX-HNNXBMFYSA-N	0	3	326.362	3.476	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)c3ncccc3C)CC2)C1	ZINC001039124719	1344800818	/nfs/dbraw/zinc/80/08/18/1344800818.db2.gz	VEDQLWKSNOMWBW-QGZVFWFLSA-N	0	3	347.890	3.317	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC([C@H]2CCN(Cc3nocc3C)C2)CC1	ZINC001039148912	1344832246	/nfs/dbraw/zinc/83/22/46/1344832246.db2.gz	ADNYZZYDMDUVOR-KRWDZBQOSA-N	0	3	345.487	3.256	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)C3(CF)CC3)CC2)C1	ZINC001039158536	1344844046	/nfs/dbraw/zinc/84/40/46/1344844046.db2.gz	XKEJCRBMLJWQRJ-HNNXBMFYSA-N	0	3	328.859	3.049	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)[C@@H]3CC34CCC4)CC2)C1	ZINC001039162308	1344847575	/nfs/dbraw/zinc/84/75/75/1344847575.db2.gz	UQYMCINNFJCCJS-IRXDYDNUSA-N	0	3	336.907	3.490	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2oc(C)cc2C)C1	ZINC001039203562	1344914069	/nfs/dbraw/zinc/91/40/69/1344914069.db2.gz	QKYYEVMIOAVTNB-QZTJIDSGSA-N	0	3	328.456	3.236	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cscc2C)C1	ZINC001039204465	1344916435	/nfs/dbraw/zinc/91/64/35/1344916435.db2.gz	XZBWYZVXCVPAJT-WMZOPIPTSA-N	0	3	330.497	3.396	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccc3cc(C)cn3c2)C1	ZINC001039209145	1344922040	/nfs/dbraw/zinc/92/20/40/1344922040.db2.gz	GZQRURSSDMLKBD-RXVVDRJESA-N	0	3	349.478	3.198	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)Cc2c(C)cccc2C)C1	ZINC001039209990	1344923575	/nfs/dbraw/zinc/92/35/75/1344923575.db2.gz	MEJCDUPYXCQTKC-CTNGQTDRSA-N	0	3	338.495	3.182	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)Cc2cccc(CC)c2)C1	ZINC001039215015	1344930669	/nfs/dbraw/zinc/93/06/69/1344930669.db2.gz	VFRWIJSPZXSJRC-LEWJYISDSA-N	0	3	338.495	3.128	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccc(CC)s2)C1	ZINC001039218065	1344934703	/nfs/dbraw/zinc/93/47/03/1344934703.db2.gz	KJEFVWLXRQDMSQ-DOTOQJQBSA-N	0	3	330.497	3.260	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(C(C)C)on2)C1	ZINC001039226203	1344944515	/nfs/dbraw/zinc/94/45/15/1344944515.db2.gz	STNYMSKDZNPRQJ-AEFFLSMTSA-N	0	3	343.471	3.138	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccc(F)c(C)c2)C1	ZINC001039226706	1344945056	/nfs/dbraw/zinc/94/50/56/1344945056.db2.gz	ZLCZBIWAQUACCJ-PKOBYXMFSA-N	0	3	328.431	3.084	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)Cc2cc(C)cc(C)c2)C1	ZINC001039231285	1344951044	/nfs/dbraw/zinc/95/10/44/1344951044.db2.gz	REPCHEKQEFGLLQ-NHCUHLMSSA-N	0	3	338.495	3.182	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccc(C)c(F)c2F)C1	ZINC001039237506	1344960163	/nfs/dbraw/zinc/96/01/63/1344960163.db2.gz	IUFDPUMTHJMPML-DOTOQJQBSA-N	0	3	346.421	3.223	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)CCc2cccs2)C1	ZINC001039238392	1344962078	/nfs/dbraw/zinc/96/20/78/1344962078.db2.gz	IDHICUKFUDBBOO-HKUYNNGSSA-N	0	3	344.524	3.407	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc(C)ccc2F)C1	ZINC001039238408	1344962237	/nfs/dbraw/zinc/96/22/37/1344962237.db2.gz	NOFAMNOYTXBWGX-PXNSSMCTSA-N	0	3	342.458	3.474	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)C2CC3(CCC3)C2)C1	ZINC001039244723	1344972857	/nfs/dbraw/zinc/97/28/57/1344972857.db2.gz	MCIVUBAGTOSYKT-IEBWSBKVSA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(CC)c(CC)o2)C1	ZINC001039247559	1344977218	/nfs/dbraw/zinc/97/72/18/1344977218.db2.gz	XDJDDBFAJURFJW-MSOLQXFVSA-N	0	3	342.483	3.354	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2c(C)nsc2C)C1	ZINC001039251910	1344984066	/nfs/dbraw/zinc/98/40/66/1344984066.db2.gz	WQAONAHWRCLSKB-SJORKVTESA-N	0	3	345.512	3.100	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2coc3ccccc23)C1	ZINC001039253562	1344985034	/nfs/dbraw/zinc/98/50/34/1344985034.db2.gz	JYHXLHZGBLTNNI-APWZRJJASA-N	0	3	336.435	3.383	20	30		EGEDHN
CCCc1ccc(CN2CC[C@H]3CC[C@@H](C2)N3C(=O)[C@@H](C)C#N)cc1	ZINC001039348771	1345022888	/nfs/dbraw/zinc/02/28/88/1345022888.db2.gz	CFUFJKFRGVPZFX-DBVUQKKJSA-N	0	3	339.483	3.364	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H](C)n1ccnc1CC	ZINC001039377374	1345034285	/nfs/dbraw/zinc/03/42/85/1345034285.db2.gz	UOQRTTWDAFNDOC-KURKYZTESA-N	0	3	344.503	3.038	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C(C)(C)c1cccnc1	ZINC001039397459	1345045160	/nfs/dbraw/zinc/04/51/60/1345045160.db2.gz	IKLUERXFHMEPSV-MSOLQXFVSA-N	0	3	327.472	3.001	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccn(C(C)C)c1C	ZINC001039422846	1345061213	/nfs/dbraw/zinc/06/12/13/1345061213.db2.gz	PKGHRHYJDPNVMS-MSOLQXFVSA-N	0	3	327.472	3.080	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(C(F)F)cc1	ZINC001039452412	1345075165	/nfs/dbraw/zinc/07/51/65/1345075165.db2.gz	UYSRLNUFBCXJAP-SJORKVTESA-N	0	3	332.394	3.326	20	30		EGEDHN
Cc1ccc(F)cc1CN1CCC[C@]2(CCN(C(=O)[C@H](C)C#N)C2)C1	ZINC001040121595	1345339949	/nfs/dbraw/zinc/33/99/49/1345339949.db2.gz	SOMLCRGPJONBBI-UZLBHIALSA-N	0	3	343.446	3.108	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@@]2(C1)CCCN(C/C=C\c1ccccc1)C2	ZINC001040203470	1345374329	/nfs/dbraw/zinc/37/43/29/1345374329.db2.gz	ZBEJJTGUQBLYSA-HEBQJAJPSA-N	0	3	348.490	3.428	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)C3C4CC5CC(C4)CC3C5)C2)C1	ZINC001040241433	1345391826	/nfs/dbraw/zinc/39/18/26/1345391826.db2.gz	OOSPDOUMIQJKNL-CUZPGCTQSA-N	0	3	340.511	3.006	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cc(F)c(C)cc3F)C2)C1	ZINC001040250058	1345395185	/nfs/dbraw/zinc/39/51/85/1345395185.db2.gz	IXNIGXIXWPNAOO-FQEVSTJZSA-N	0	3	346.421	3.225	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@H]3CCCc4ccccc43)C2)C1	ZINC001040264826	1345402187	/nfs/dbraw/zinc/40/21/87/1345402187.db2.gz	SEKWVNNRZMPXEI-UNMCSNQZSA-N	0	3	336.479	3.054	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)C3(C)CCC(F)(F)CC3)C2)C1	ZINC001040264920	1345402607	/nfs/dbraw/zinc/40/26/07/1345402607.db2.gz	UDSBTNJZJJKWIL-SFHVURJKSA-N	0	3	338.442	3.150	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cccnc3C3CC3)C2)C1	ZINC001040279842	1345409156	/nfs/dbraw/zinc/40/91/56/1345409156.db2.gz	AVLDTNLXFWWSFV-HXUWFJFHSA-N	0	3	325.456	3.073	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3nc4ccccc4cc3C)C2)C1	ZINC001040302551	1345422202	/nfs/dbraw/zinc/42/22/02/1345422202.db2.gz	KGMZSZUYGUXCQX-QFIPXVFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@H]3CC[C@@H]4C[C@@H]4CC3)C2)C1	ZINC001040308893	1345424469	/nfs/dbraw/zinc/42/44/69/1345424469.db2.gz	DZPCRQGKSNDFSR-JTJHWIPRSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@H](C)OC3CCCCCC3)C2)C1	ZINC001040384491	1345468237	/nfs/dbraw/zinc/46/82/37/1345468237.db2.gz	NXYAOIFKUYFLSR-GHTZIAJQSA-N	0	3	346.515	3.062	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(Cl)c(F)c3)C2)C1	ZINC001040419859	1345487383	/nfs/dbraw/zinc/48/73/83/1345487383.db2.gz	YZHOMRHZWWXGKR-LJQANCHMSA-N	0	3	348.849	3.431	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(Cl)c(F)c3)C2)C1	ZINC001040419661	1345487515	/nfs/dbraw/zinc/48/75/15/1345487515.db2.gz	XUCTXLPQWXHNJR-GOSISDBHSA-N	0	3	334.822	3.040	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cnc4ccccc4c3)C2)C1	ZINC001040423388	1345489806	/nfs/dbraw/zinc/48/98/06/1345489806.db2.gz	TYQRGOTUHZEZMB-NRFANRHFSA-N	0	3	335.451	3.349	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@@H]3C[C@H]3c3cccc(C)c3)C2)C1	ZINC001040444766	1345503746	/nfs/dbraw/zinc/50/37/46/1345503746.db2.gz	WHPGWQHOUSAOPC-TUNNFDKTSA-N	0	3	336.479	3.046	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3cccc(C(F)F)c3)C2)C1	ZINC001040500186	1345520985	/nfs/dbraw/zinc/52/09/85/1345520985.db2.gz	IYXHRNAWGLEXHQ-IBGZPJMESA-N	0	3	332.394	3.186	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(F)cc3C)C2)C1	ZINC001040499705	1345521369	/nfs/dbraw/zinc/52/13/69/1345521369.db2.gz	FYYZGHQBOONRAI-HXUWFJFHSA-N	0	3	328.431	3.086	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ccccc3Cl)C2)C1	ZINC001040503461	1345523280	/nfs/dbraw/zinc/52/32/80/1345523280.db2.gz	UACSJBYIMODIDD-LJQANCHMSA-N	0	3	330.859	3.291	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)Cc3c[nH]c4ccccc34)C2)C1	ZINC001040504910	1345523704	/nfs/dbraw/zinc/52/37/04/1345523704.db2.gz	CDWRBSIINLZDLE-QFIPXVFZSA-N	0	3	349.478	3.048	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ccc(F)cc3Cl)C2)C1	ZINC001040515939	1345528682	/nfs/dbraw/zinc/52/86/82/1345528682.db2.gz	QLMBBCILIQOIPY-IBGZPJMESA-N	0	3	348.849	3.431	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@H](C)c3cccc(F)c3)C2)C1	ZINC001040538160	1345536056	/nfs/dbraw/zinc/53/60/56/1345536056.db2.gz	GUARQLGYOCMCCF-UTKZUKDTSA-N	0	3	342.458	3.267	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@]3(C)CC=C(C)CC3)C2)C1	ZINC001040539874	1345537868	/nfs/dbraw/zinc/53/78/68/1345537868.db2.gz	SCJUNENNLGWOKH-RTWAWAEBSA-N	0	3	328.500	3.461	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cncc4ccccc43)C2)C1	ZINC001040543921	1345538979	/nfs/dbraw/zinc/53/89/79/1345538979.db2.gz	RNTGJXXMXCWIIA-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3c[nH]c4c3cccc4CC)C2)C1	ZINC001040543569	1345539607	/nfs/dbraw/zinc/53/96/07/1345539607.db2.gz	PIEZLQZXQKVUSZ-JOCHJYFZSA-N	0	3	349.478	3.292	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)Cc3c(C)cccc3C)C2)CC1	ZINC001040718039	1345569967	/nfs/dbraw/zinc/56/99/67/1345569967.db2.gz	OXCLXVWDZGJFLS-UHFFFAOYSA-N	0	3	338.495	3.184	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@]3(CCN(C(=O)[C@@H]4CC=CCC4)C3)C2)c1	ZINC001041065139	1345641614	/nfs/dbraw/zinc/64/16/14/1345641614.db2.gz	YVRXNYDBFFMQJN-IRLDBZIGSA-N	0	3	349.478	3.339	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001041088953	1345650376	/nfs/dbraw/zinc/65/03/76/1345650376.db2.gz	SOXUONNPANTXOW-UZLBHIALSA-N	0	3	325.456	3.029	20	30		EGEDHN
Cc1ccc(CN2CC[C@@]3(CCN(C(=O)[C@@H](C)C#N)C3)C2)c(Cl)c1	ZINC001041136227	1345658453	/nfs/dbraw/zinc/65/84/53/1345658453.db2.gz	GIZTYHMAAWIUNJ-HNAYVOBHSA-N	0	3	345.874	3.233	20	30		EGEDHN
C[C@@H](c1ccc(F)cc1)N1CC[C@@]2(CCN(C(=O)C#CC3CC3)C2)C1	ZINC001041266462	1345690652	/nfs/dbraw/zinc/69/06/52/1345690652.db2.gz	SDEVGHWDOQALMW-HRAATJIYSA-N	0	3	340.442	3.225	20	30		EGEDHN
C=CCN1CC[C@@]2(CCN(C(=O)c3cc(-c4ccccc4)on3)C2)C1	ZINC001041452282	1345731911	/nfs/dbraw/zinc/73/19/11/1345731911.db2.gz	BLGUFEKSHXFQRS-HXUWFJFHSA-N	0	3	337.423	3.066	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccc(Cl)cc3F)C2)C1	ZINC001041452885	1345732896	/nfs/dbraw/zinc/73/28/96/1345732896.db2.gz	YFOGZYHPPXJCSZ-SFHVURJKSA-N	0	3	334.822	3.040	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)[C@H](c3ccccc3)C3CC3)C2)C1	ZINC001041463629	1345735412	/nfs/dbraw/zinc/73/54/12/1345735412.db2.gz	IEKXVLWIWDMQJO-IRLDBZIGSA-N	0	3	336.479	3.128	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cc(C)ccc3C3CC3)C2)C1	ZINC001041507466	1345746854	/nfs/dbraw/zinc/74/68/54/1345746854.db2.gz	XGUMDPHFPZYUGW-JOCHJYFZSA-N	0	3	336.479	3.434	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)CCc3ccc(Cl)cc3)C2)C1	ZINC001041519825	1345751241	/nfs/dbraw/zinc/75/12/41/1345751241.db2.gz	RSNDEFDQJFDJAW-HXUWFJFHSA-N	0	3	344.886	3.220	20	30		EGEDHN
Cc1coc(C(=O)N2CC[C@]3(CCN(Cc4cccc(C#N)c4)C3)C2)c1	ZINC001041582147	1345781500	/nfs/dbraw/zinc/78/15/00/1345781500.db2.gz	ORSZCTMSXOXKAS-NRFANRHFSA-N	0	3	349.434	3.198	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@]2(CCN(Cc3ncccc3C)C2)C1	ZINC001041624792	1345799997	/nfs/dbraw/zinc/79/99/97/1345799997.db2.gz	CPYILAGVAIGNEP-RTWAWAEBSA-N	0	3	341.499	3.417	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccc(C)c(Cl)c3)C2)C1	ZINC001041625520	1345800145	/nfs/dbraw/zinc/80/01/45/1345800145.db2.gz	IWIJDUCEXKDKJH-LJQANCHMSA-N	0	3	330.859	3.210	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)[C@H](C)c3ccc(Cl)cc3)C2)C1	ZINC001041629576	1345801991	/nfs/dbraw/zinc/80/19/91/1345801991.db2.gz	BMMCBQJVEZNWHO-OXQOHEQNSA-N	0	3	344.886	3.391	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)[C@@H](C)c3ccc(Cl)cc3)C2)C1	ZINC001041633863	1345804126	/nfs/dbraw/zinc/80/41/26/1345804126.db2.gz	ZSHNSNGXKSZONM-KXBFYZLASA-N	0	3	330.859	3.001	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)[C@H](C)OC3CCCCCC3)C2)C1	ZINC001041662012	1345815218	/nfs/dbraw/zinc/81/52/18/1345815218.db2.gz	ZURHJBWQHDFDDC-RXVVDRJESA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)C[C@H](C)c3ccc(CC)cc3)C2)C1	ZINC001041669779	1345817391	/nfs/dbraw/zinc/81/73/91/1345817391.db2.gz	XLBCIUPILIVOPZ-AVRDEDQJSA-N	0	3	338.495	3.300	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)[C@H](Cc3ccccc3)C(C)C)C2)C1	ZINC001041670908	1345817961	/nfs/dbraw/zinc/81/79/61/1345817961.db2.gz	KCTJNNILOAOYEG-IFMALSPDSA-N	0	3	338.495	3.059	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cccn3C3CCCC3)C2)C1	ZINC001041761936	1345842092	/nfs/dbraw/zinc/84/20/92/1345842092.db2.gz	VNZYFCPOGKWPHA-NRFANRHFSA-N	0	3	339.483	3.165	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)[C@H](C)c3ccc(C)s3)C2)C1	ZINC001041788109	1345850056	/nfs/dbraw/zinc/85/00/56/1345850056.db2.gz	WGRCWHMXBFCPRF-APWZRJJASA-N	0	3	330.497	3.108	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3coc4ccc(Cl)cc43)C2)C1	ZINC001041809988	1345858623	/nfs/dbraw/zinc/85/86/23/1345858623.db2.gz	XHGAFDMTFVAJLF-LJQANCHMSA-N	0	3	342.826	3.257	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@@H]2C1	ZINC001042014418	1345925498	/nfs/dbraw/zinc/92/54/98/1345925498.db2.gz	RLYSEXHTRQAVOS-ZWKOTPCHSA-N	0	3	341.430	3.244	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(C(F)F)ccc3F)C[C@H]21	ZINC001042065541	1345934589	/nfs/dbraw/zinc/93/45/89/1345934589.db2.gz	VXGSCIHDLYLSLW-BLLLJJGKSA-N	0	3	338.373	3.486	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cccc(OCCC)c3)C[C@H]21	ZINC001042080862	1345939647	/nfs/dbraw/zinc/93/96/47/1345939647.db2.gz	PEEGCDODNKSDRV-FXAWDEMLSA-N	0	3	340.467	3.035	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C3C4CC5CC(C4)CC3C5)C[C@H]21	ZINC001042095873	1345943013	/nfs/dbraw/zinc/94/30/13/1345943013.db2.gz	RFYVBVRDWBECPR-YXVJBPKESA-N	0	3	328.500	3.168	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cc(C)ccc3C3CC3)C[C@H]21	ZINC001042162506	1345961475	/nfs/dbraw/zinc/96/14/75/1345961475.db2.gz	IXGQYRRKPGWEFJ-WIYYLYMNSA-N	0	3	336.479	3.432	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2CCN(Cc3cncc(C)c3)[C@H]2C1	ZINC001042182036	1345970581	/nfs/dbraw/zinc/97/05/81/1345970581.db2.gz	BNGGXNYRAQTKGQ-MOPGFXCFSA-N	0	3	341.499	3.415	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3scnc3C)[C@H]2C1	ZINC001042187890	1345975062	/nfs/dbraw/zinc/97/50/62/1345975062.db2.gz	OVSDZOORVVDRHP-GJZGRUSLSA-N	0	3	333.501	3.087	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(F)c4ccncc34)C[C@H]21	ZINC001042197676	1345979868	/nfs/dbraw/zinc/97/98/68/1345979868.db2.gz	GFPBJTDCIALBDH-AUUYWEPGSA-N	0	3	339.414	3.096	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(Cl)cc3OC)C[C@H]21	ZINC001042206192	1345984074	/nfs/dbraw/zinc/98/40/74/1345984074.db2.gz	DAKHXBVXDNXRRO-XJKSGUPXSA-N	0	3	334.847	3.071	20	30		EGEDHN
CC1(C(=O)N2CC[C@@H]3CCN(Cc4ccc(C#N)cc4)[C@H]3C2)CC=CC1	ZINC001042220831	1345991935	/nfs/dbraw/zinc/99/19/35/1345991935.db2.gz	GBLBIKWVMREHEY-PMACEKPBSA-N	0	3	349.478	3.337	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]3CCN(Cc4cccc(C#N)c4)[C@H]3C2)C1	ZINC001042227033	1345996034	/nfs/dbraw/zinc/99/60/34/1345996034.db2.gz	HMOPMOXZJILMGS-PMACEKPBSA-N	0	3	349.478	3.337	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(C)oc3C(F)(F)F)C[C@H]21	ZINC001042249740	1346006007	/nfs/dbraw/zinc/00/60/07/1346006007.db2.gz	PLTLEMCWXCKCEM-GXTWGEPZSA-N	0	3	342.361	3.329	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc4nc(C)ccc4c3)C[C@H]21	ZINC001042278475	1346014924	/nfs/dbraw/zinc/01/49/24/1346014924.db2.gz	VVTUAAPKLGGNFT-LAUBAEHRSA-N	0	3	347.462	3.103	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(Cl)cc(OC)c3)C[C@H]21	ZINC001042283553	1346016417	/nfs/dbraw/zinc/01/64/17/1346016417.db2.gz	LGAJHBKUVUDRGY-SUMWQHHRSA-N	0	3	334.847	3.071	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cccn3C3CCCC3)C[C@H]21	ZINC001042290002	1346018903	/nfs/dbraw/zinc/01/89/03/1346018903.db2.gz	NDWDLGJAOHFHJK-YLJYHZDGSA-N	0	3	339.483	3.163	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C(C)(C)c3cccc(OC)c3)C[C@H]21	ZINC001042297787	1346022190	/nfs/dbraw/zinc/02/21/90/1346022190.db2.gz	VLEKWFWVUVKBLD-QFBILLFUSA-N	0	3	342.483	3.082	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cccc(C(F)F)c3)C[C@H]21	ZINC001042316404	1346030914	/nfs/dbraw/zinc/03/09/14/1346030914.db2.gz	LRHCRTPRSQUWHK-WMLDXEAASA-N	0	3	332.394	3.184	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc4ccccc4c3)C[C@@H]21	ZINC001042335554	1346041971	/nfs/dbraw/zinc/04/19/71/1346041971.db2.gz	LMXWPXQNFPOYFY-NQIIRXRSSA-N	0	3	332.447	3.400	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3cc(C)c(CC)s3)C[C@@H]21	ZINC001042341012	1346046180	/nfs/dbraw/zinc/04/61/80/1346046180.db2.gz	JQFFTZBWBJQKDP-HOTGVXAUSA-N	0	3	330.497	3.179	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc4c(c3)CCCC4)C[C@H]21	ZINC001042343787	1346046849	/nfs/dbraw/zinc/04/68/49/1346046849.db2.gz	OKKSWEREVWPDHY-GHTZIAJQSA-N	0	3	336.479	3.125	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3cc(C4CCCC4)no3)C[C@@H]21	ZINC001042363472	1346057156	/nfs/dbraw/zinc/05/71/56/1346057156.db2.gz	UIGZFXHHSAMMSI-WMZOPIPTSA-N	0	3	343.471	3.445	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)CC(C)(C)c3ccccc3)C[C@H]21	ZINC001042367841	1346059523	/nfs/dbraw/zinc/05/95/23/1346059523.db2.gz	MCNPHNIEUOCOFG-AZUAARDMSA-N	0	3	338.495	3.300	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3c[nH]c4ccc(C)cc34)C[C@@H]21	ZINC001042371054	1346060874	/nfs/dbraw/zinc/06/08/74/1346060874.db2.gz	KOIVSDRZRJBGMI-UZLBHIALSA-N	0	3	335.451	3.036	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3cnc(C(C)(C)C)s3)C[C@H]21	ZINC001042371724	1346061581	/nfs/dbraw/zinc/06/15/81/1346061581.db2.gz	VMMGGOWXPMCRGP-HUUCEWRRSA-N	0	3	345.512	3.000	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)C3(C(F)(F)F)CCCC3)C[C@H]21	ZINC001042379158	1346064967	/nfs/dbraw/zinc/06/49/67/1346064967.db2.gz	HFRSTOSQEOGUDK-LSDHHAIUSA-N	0	3	342.405	3.055	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(N(C)CCC)cc3)C[C@H]21	ZINC001042379938	1346065679	/nfs/dbraw/zinc/06/56/79/1346065679.db2.gz	PTGQLWQERWCHFL-YLJYHZDGSA-N	0	3	341.499	3.255	20	30		EGEDHN
Cc1cncc(C(=O)N2CC[C@H](NCc3ccccc3C#N)C[C@@H]2C)c1	ZINC001044522772	1346355495	/nfs/dbraw/zinc/35/54/95/1346355495.db2.gz	KRQUNTPHIUNISJ-JXFKEZNVSA-N	0	3	348.450	3.045	20	30		EGEDHN
Cc1cncc(C(=O)N2CC[C@@H](NCc3ccccc3C#N)C[C@H]2C)c1	ZINC001044522775	1346355627	/nfs/dbraw/zinc/35/56/27/1346355627.db2.gz	KRQUNTPHIUNISJ-OXQOHEQNSA-N	0	3	348.450	3.045	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2cc(F)ccc2C#N)CCN1C(=O)CC1CCC1	ZINC001044532955	1346360029	/nfs/dbraw/zinc/36/00/29/1346360029.db2.gz	UKFPRCBGLQHNIN-KUHUBIRLSA-N	0	3	343.446	3.357	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2cc(F)ccc2C#N)CCN1C(=O)C1=CCCC1	ZINC001044544782	1346365880	/nfs/dbraw/zinc/36/58/80/1346365880.db2.gz	VYOYXGDKQKVFBT-KUHUBIRLSA-N	0	3	341.430	3.277	20	30		EGEDHN
Cc1cccc(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)s2)c1	ZINC001044909382	1346460428	/nfs/dbraw/zinc/46/04/28/1346460428.db2.gz	CMFOMDKFAAUIMS-INIZCTEOSA-N	0	3	339.464	3.323	20	30		EGEDHN
N#Cc1cc(C(=O)N2CCC[C@H]2CNCc2cc3ccccc3o2)c[nH]1	ZINC001045002630	1346479043	/nfs/dbraw/zinc/47/90/43/1346479043.db2.gz	RKHGNOWTTFTYQM-KRWDZBQOSA-N	0	3	348.406	3.027	20	30		EGEDHN
CC1(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)c(F)c2)CC=CC1	ZINC001045183291	1346518442	/nfs/dbraw/zinc/51/84/42/1346518442.db2.gz	JSFVSDXGUKTBIR-KRWDZBQOSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H]1CNCc1cc(CO)ccc1F	ZINC001045185453	1346521426	/nfs/dbraw/zinc/52/14/26/1346521426.db2.gz	CXBLWRYBVQHYRZ-PXNSSMCTSA-N	0	3	348.462	3.001	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)C2CCC(F)CC2)s1	ZINC001045186127	1346522684	/nfs/dbraw/zinc/52/26/84/1346522684.db2.gz	ZWFODLZONYTHTE-NRXISQOPSA-N	0	3	349.475	3.229	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CCC[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC001045227320	1346535651	/nfs/dbraw/zinc/53/56/51/1346535651.db2.gz	ITPYYDQLEJTQJK-PBHICJAKSA-N	0	3	331.435	3.070	20	30		EGEDHN
C=C[C@H](C(=O)N1CCC[C@H]1CNCc1cncs1)c1ccccc1	ZINC001045319557	1346558541	/nfs/dbraw/zinc/55/85/41/1346558541.db2.gz	FFOVKPGGGUOWCA-WMZOPIPTSA-N	0	3	341.480	3.194	20	30		EGEDHN
CC1(NC(=O)C2CCCC2)CCN(Cc2cccc(C#N)c2)CC1	ZINC001045343957	1346566541	/nfs/dbraw/zinc/56/65/41/1346566541.db2.gz	KGQJCDLXCKSNBS-UHFFFAOYSA-N	0	3	325.456	3.219	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2ccc3nccc(C)c3c2)CC1	ZINC001045447630	1346596235	/nfs/dbraw/zinc/59/62/35/1346596235.db2.gz	CFLCJRVIGJFFLR-UHFFFAOYSA-N	0	3	335.451	3.151	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2cn(CC)c3ccccc23)CC1	ZINC001045497568	1346609655	/nfs/dbraw/zinc/60/96/55/1346609655.db2.gz	PLYKFLUIQNMWDZ-UHFFFAOYSA-N	0	3	325.456	3.432	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)[C@H]2CC[C@@H]2c2ccc(F)cc2)CC1	ZINC001045511849	1346613626	/nfs/dbraw/zinc/61/36/26/1346613626.db2.gz	XLZKCJXMMXVNHJ-MOPGFXCFSA-N	0	3	342.458	3.313	20	30		EGEDHN
CC1(C)CC[C@@H]1C(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045527385	1346616831	/nfs/dbraw/zinc/61/68/31/1346616831.db2.gz	MTLDNAQZIQMPBT-GOSISDBHSA-N	0	3	339.483	3.465	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@H]2CC[C@@H](C1)N2C/C=C/c1ccccc1	ZINC001045775637	1346695364	/nfs/dbraw/zinc/69/53/64/1346695364.db2.gz	NBQIRHRUNHPLMT-YIEYKEOMSA-N	0	3	334.463	3.179	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H]1C[C@@H]3C=C[C@H]1CC3)C2	ZINC001045939167	1346775178	/nfs/dbraw/zinc/77/51/78/1346775178.db2.gz	WUISUWMPNHWAFT-XAPVIXHLSA-N	0	3	340.511	3.317	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)C[C@@H]1CCC(F)(F)C1)C2	ZINC001045944283	1346780163	/nfs/dbraw/zinc/78/01/63/1346780163.db2.gz	JGUPVRQIGZUMIO-FUHWJXTLSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@H]1CC[C@@H]3C[C@@H]3CC1)C2	ZINC001045954759	1346789777	/nfs/dbraw/zinc/78/97/77/1346789777.db2.gz	INZWEQFGBGUJGV-JTJHWIPRSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@H](C)c1cccc(C)c1)C2	ZINC001045969495	1346804515	/nfs/dbraw/zinc/80/45/15/1346804515.db2.gz	RNLPJVORXJVRJS-KNQAVFIVSA-N	0	3	338.495	3.436	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H](F)c1ccccc1)C2	ZINC001045972359	1346808698	/nfs/dbraw/zinc/80/86/98/1346808698.db2.gz	ZBXUCGUJXPFMJH-AZUAARDMSA-N	0	3	328.431	3.035	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@H](C)c1ccc(C)o1)C2	ZINC001045973308	1346809620	/nfs/dbraw/zinc/80/96/20/1346809620.db2.gz	OLYPAPKBPIHLBQ-NQIIRXRSSA-N	0	3	342.483	3.419	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1sc(C)cc1OC)C2	ZINC001045973809	1346810355	/nfs/dbraw/zinc/81/03/55/1346810355.db2.gz	VFNYPKLIDCSXGI-IBGZPJMESA-N	0	3	346.496	3.017	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)C(C)(C)C(F)(F)F)C2	ZINC001045980937	1346818816	/nfs/dbraw/zinc/81/88/16/1346818816.db2.gz	NEOPWYWOPIKCOI-KRWDZBQOSA-N	0	3	344.421	3.303	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)C(C)(C)c1ccccc1)C2	ZINC001045981220	1346819744	/nfs/dbraw/zinc/81/97/44/1346819744.db2.gz	APTBBYDBZMWMBU-QFIPXVFZSA-N	0	3	338.495	3.302	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1c(C)nsc1C)C2	ZINC001045985697	1346826770	/nfs/dbraw/zinc/82/67/70/1346826770.db2.gz	AHGWIMVXXIHXOU-IBGZPJMESA-N	0	3	345.512	3.101	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2ccnc(-c3ccco3)c2)C1	ZINC001046404654	1346962693	/nfs/dbraw/zinc/96/26/93/1346962693.db2.gz	FOKXLVIBYPWSLH-IBGZPJMESA-N	0	3	325.412	3.112	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2cnc3c(F)cccc3c2)C1	ZINC001046486749	1346992137	/nfs/dbraw/zinc/99/21/37/1346992137.db2.gz	KJFJWRDMPZTYTI-IBGZPJMESA-N	0	3	327.403	3.144	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@]2(C)CCN(Cc3cc(C)cc(C)c3)C2)c1	ZINC001046604568	1347035844	/nfs/dbraw/zinc/03/58/44/1347035844.db2.gz	KYUBCEPSXXXQPR-QFIPXVFZSA-N	0	3	347.462	3.074	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@]2(C)CCN([C@H](C)c3ccccc3)C2)c1	ZINC001046605718	1347036374	/nfs/dbraw/zinc/03/63/74/1347036374.db2.gz	XADMKRQJDSOTEA-IIBYNOLFSA-N	0	3	333.435	3.018	20	30		EGEDHN
C=CCCN1CC[C@](C)(NC(=O)c2sc(CC3CC3)nc2C)C1	ZINC001046734358	1347077017	/nfs/dbraw/zinc/07/70/17/1347077017.db2.gz	PTLFZQVITLCQHG-SFHVURJKSA-N	0	3	333.501	3.174	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2cnn(C3CCCCC3)c2)C1	ZINC001046754390	1347085457	/nfs/dbraw/zinc/08/54/57/1347085457.db2.gz	PADJMUHOWPSJJE-LJQANCHMSA-N	0	3	330.476	3.159	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@]2(C)CCN(Cc3cc(C)ccc3C)C2)nc1	ZINC001046780811	1347097575	/nfs/dbraw/zinc/09/75/75/1347097575.db2.gz	ASKREJICNPUTCI-QFIPXVFZSA-N	0	3	347.462	3.074	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)C2CC(c3cccc(F)c3)C2)C1	ZINC001046872479	1347140627	/nfs/dbraw/zinc/14/06/27/1347140627.db2.gz	DMGBYPCWKTUCGQ-UHYCVJNDSA-N	0	3	330.447	3.476	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2cccnc2C2CC2)C1	ZINC001046954226	1347162934	/nfs/dbraw/zinc/16/29/34/1347162934.db2.gz	QIOLZNDDARUZEB-HNNXBMFYSA-N	0	3	349.425	3.222	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@H](CNC(=O)c2ccc(C)cc2C)C1	ZINC001046994441	1347177416	/nfs/dbraw/zinc/17/74/16/1347177416.db2.gz	GAEARRJJJQJPPU-MRXNPFEDSA-N	0	3	334.410	3.014	20	30		EGEDHN
O=C(N[C@@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1ccccc1)C2)C1CCCC1	ZINC001047007772	1347183940	/nfs/dbraw/zinc/18/39/40/1347183940.db2.gz	RROVOURLILHGSF-TYPHKJRUSA-N	0	3	336.479	3.197	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)N(Cc2cnc(C)o2)C3)CC1	ZINC001047139320	1347218050	/nfs/dbraw/zinc/21/80/50/1347218050.db2.gz	QBJXFPCLGFHQGS-JQHSSLGASA-N	0	3	343.471	3.199	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3ccc(Cl)o3)C2)CC1	ZINC001047223803	1347254170	/nfs/dbraw/zinc/25/41/70/1347254170.db2.gz	PTIXCYODYMRVJV-OAHLLOKOSA-N	0	3	334.847	3.130	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)c3csnc3C)C2)CC1	ZINC001047234701	1347262840	/nfs/dbraw/zinc/26/28/40/1347262840.db2.gz	PDGJQAGEPQVKBB-QGZVFWFLSA-N	0	3	345.512	3.039	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)CC(C)(C)C3CC3)C2)CC1	ZINC001047237388	1347264191	/nfs/dbraw/zinc/26/41/91/1347264191.db2.gz	QRKVYGAMIILVCM-SFHVURJKSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3c(C)coc3C)C2)CC1	ZINC001047240898	1347266850	/nfs/dbraw/zinc/26/68/50/1347266850.db2.gz	LAVJWNFOKBHFAO-GOSISDBHSA-N	0	3	328.456	3.094	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)/C=C\c3ccc[nH]3)C2)CC1	ZINC001047241445	1347267525	/nfs/dbraw/zinc/26/75/25/1347267525.db2.gz	PXWOSIDVHDAAKI-OLHLWXQYSA-N	0	3	339.483	3.002	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)C34CCC(CC3)C4)C2)CC1	ZINC001047245171	1347270715	/nfs/dbraw/zinc/27/07/15/1347270715.db2.gz	XDEIENANPGQJAN-BIXGBWIQSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)C[C@@H]3C=CCCC3)C2)CC1	ZINC001047245604	1347271223	/nfs/dbraw/zinc/27/12/23/1347271223.db2.gz	ZSJGLAZPJANLPL-QUCCMNQESA-N	0	3	328.500	3.317	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3ccccc3CC)C2)CC1	ZINC001047247571	1347272846	/nfs/dbraw/zinc/27/28/46/1347272846.db2.gz	GZJJDJLHJUTAPF-HXUWFJFHSA-N	0	3	338.495	3.446	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@H]3CCCC3(C)C)C2)CC1	ZINC001047250010	1347274831	/nfs/dbraw/zinc/27/48/31/1347274831.db2.gz	YWHNETQOZURXRL-RTBURBONSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)C3(C)CC=CC3)C2)CC1	ZINC001047253044	1347277184	/nfs/dbraw/zinc/27/71/84/1347277184.db2.gz	QDSOOCSSKLSVPN-IBGZPJMESA-N	0	3	328.500	3.317	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3ccc4cc[nH]c4c3)C2)CC1	ZINC001047259795	1347282032	/nfs/dbraw/zinc/28/20/32/1347282032.db2.gz	TYTYAQRWYAFQER-HXUWFJFHSA-N	0	3	349.478	3.365	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@@H](C)c3ccc(C)o3)C2)CC1	ZINC001047259445	1347282281	/nfs/dbraw/zinc/28/22/81/1347282281.db2.gz	QCNHLYMEXWVMPT-HKUYNNGSSA-N	0	3	342.483	3.275	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@@H]3CC4CCC3CC4)C2)CC1	ZINC001047265750	1347287007	/nfs/dbraw/zinc/28/70/07/1347287007.db2.gz	MGMKKCXYOHYXTK-CGNZLSCGSA-N	0	3	342.527	3.397	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3ccc(F)s3)C2)CC1	ZINC001047266436	1347287583	/nfs/dbraw/zinc/28/75/83/1347287583.db2.gz	XKXHKWPZGJQAHE-OAHLLOKOSA-N	0	3	334.460	3.085	20	30		EGEDHN
C[C@@H](NCc1cc(F)ccc1C#N)[C@H]1CCN(C(=O)C2CCCC2)C1	ZINC001047668969	1347323195	/nfs/dbraw/zinc/32/31/95/1347323195.db2.gz	YEELEUYXPSCJPT-PBHICJAKSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@@H](NCc1cc(F)ccc1C#N)[C@@H]1CCN(C(=O)C=C2CCC2)C1	ZINC001047799991	1347376399	/nfs/dbraw/zinc/37/63/99/1347376399.db2.gz	OLRYTZJOSZPVTD-RHSMWYFYSA-N	0	3	341.430	3.134	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)CC2(C)CC2)C1	ZINC001047909876	1347406216	/nfs/dbraw/zinc/40/62/16/1347406216.db2.gz	ONOBAOMLVXZNHY-QAPCUYQASA-N	0	3	325.456	3.075	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]([C@H](C)NCc2ccccc2C#N)C1	ZINC001047924432	1347411291	/nfs/dbraw/zinc/41/12/91/1347411291.db2.gz	NOXFIFCPDKKVBO-MAUKXSAKSA-N	0	3	325.456	3.097	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)C2(CF)CCC2)C1	ZINC001047987071	1347434755	/nfs/dbraw/zinc/43/47/55/1347434755.db2.gz	XYBCZWSGFZCBHJ-CRAIPNDOSA-N	0	3	343.446	3.025	20	30		EGEDHN
C[C@H]1CN(C(=O)CC2(C)CC2)C[C@H]1CNCc1cc(F)ccc1C#N	ZINC001048318954	1347517493	/nfs/dbraw/zinc/51/74/93/1347517493.db2.gz	XKMCZQFTRRWXLI-WMLDXEAASA-N	0	3	343.446	3.072	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H](C)[C@H](CNCc2csc(CCC)n2)C1	ZINC001048344657	1347525062	/nfs/dbraw/zinc/52/50/62/1347525062.db2.gz	QTOPBSIJPRQPJQ-LSDHHAIUSA-N	0	3	349.544	3.492	20	30		EGEDHN
C=C(C)CN1CCC(N(Cc2ccccn2)C(=O)C2CCC2)CC1	ZINC001048625038	1347623573	/nfs/dbraw/zinc/62/35/73/1347623573.db2.gz	JBFBEHBTQASJMH-UHFFFAOYSA-N	0	3	327.472	3.251	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CN(C(=O)C45CCC(CC4)C5)C[C@@H]3C2)c1	ZINC001048896187	1347679414	/nfs/dbraw/zinc/67/94/14/1347679414.db2.gz	WZEMKUYGJSEQBY-MXMNOXSKSA-N	0	3	349.478	3.029	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)C[C@H]2C=CCC2)c1	ZINC001049314026	1347787522	/nfs/dbraw/zinc/78/75/22/1347787522.db2.gz	KXUCIZXHPCRNRW-IOMROCGXSA-N	0	3	349.478	3.480	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@@H]2CCCN3C(=O)CCC2CC2)cc1	ZINC001049386031	1347814176	/nfs/dbraw/zinc/81/41/76/1347814176.db2.gz	JVEZTZAXLLPKTK-PMACEKPBSA-N	0	3	337.467	3.314	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1coc2cc(F)ccc12	ZINC001049475157	1347866347	/nfs/dbraw/zinc/86/63/47/1347866347.db2.gz	NWQKGQZJAWMDMF-ROUUACIJSA-N	0	3	342.414	3.366	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1sccc1C	ZINC001049476888	1347868263	/nfs/dbraw/zinc/86/82/63/1347868263.db2.gz	ZKGHYEWMJANFMN-WCXIOVBPSA-N	0	3	330.497	3.411	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(C)c(OC)c(C)c1	ZINC001049493409	1347875445	/nfs/dbraw/zinc/87/54/45/1347875445.db2.gz	YYEWJJIWENKIBM-OALUTQOASA-N	0	3	340.467	3.014	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(Cl)c(Cl)n1C	ZINC001049509339	1347884632	/nfs/dbraw/zinc/88/46/32/1347884632.db2.gz	TUWIPRRJLJFDAH-OLZOCXBDSA-N	0	3	342.270	3.197	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ocnc1-c1ccccc1	ZINC001049519294	1347888298	/nfs/dbraw/zinc/88/82/98/1347888298.db2.gz	RDALUFJAHYIEIK-SJORKVTESA-N	0	3	337.423	3.207	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccsc1COC	ZINC001049552933	1347905984	/nfs/dbraw/zinc/90/59/84/1347905984.db2.gz	RDFRFRIHCRVLEN-HZPDHXFCSA-N	0	3	334.485	3.150	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(C)n([C@@H](C)CC)n1	ZINC001049566057	1347912760	/nfs/dbraw/zinc/91/27/60/1347912760.db2.gz	ZMSDQRVGQDPGST-ZYSHUDEJSA-N	0	3	344.503	3.418	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cccc(-n2cccc2)c1	ZINC001049575502	1347916902	/nfs/dbraw/zinc/91/69/02/1347916902.db2.gz	GXNRLPDGVQOCBB-NHCUHLMSSA-N	0	3	347.462	3.180	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cccc(-n2cccc2)c1	ZINC001049575504	1347917038	/nfs/dbraw/zinc/91/70/38/1347917038.db2.gz	GXNRLPDGVQOCBB-SFTDATJTSA-N	0	3	347.462	3.180	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cn1c(C)cc2ccccc21	ZINC001049579399	1347919712	/nfs/dbraw/zinc/91/97/12/1347919712.db2.gz	GMAZSZMZHRODEP-VQTJNVASSA-N	0	3	337.467	3.201	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(-n2cccc2)cc1	ZINC001049579538	1347919744	/nfs/dbraw/zinc/91/97/44/1347919744.db2.gz	LMFULJQLCVWLAS-RTWAWAEBSA-N	0	3	347.462	3.180	20	30		EGEDHN
C=CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1scnc1C(F)F	ZINC001049590307	1347925625	/nfs/dbraw/zinc/92/56/25/1347925625.db2.gz	ZSWAQEUWIXVTRS-VXGBXAGGSA-N	0	3	341.427	3.336	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)[C@]23C[C@H]2CCC3)c1	ZINC001049605866	1347933723	/nfs/dbraw/zinc/93/37/23/1347933723.db2.gz	RUDIIHWYWHLXNW-XAPVIXHLSA-N	0	3	349.478	3.314	20	30		EGEDHN
C[C@]1(C(=O)N2CCC[C@H]3[C@H]2CCN3Cc2ccc(C#N)cc2)C=CCC1	ZINC001049644408	1347952106	/nfs/dbraw/zinc/95/21/06/1347952106.db2.gz	JDFVJDDLUVNUDJ-VWPQPMDRSA-N	0	3	349.478	3.480	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)C1(c2cccnc2)CCCC1	ZINC001049680900	1347969538	/nfs/dbraw/zinc/96/95/38/1347969538.db2.gz	UBPIIRQBNOFGDS-MOPGFXCFSA-N	0	3	339.483	3.145	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(-c2cccs2)n[nH]1	ZINC001049744932	1347997254	/nfs/dbraw/zinc/99/72/54/1347997254.db2.gz	BWDWBCTZXWYIOK-HZPDHXFCSA-N	0	3	342.468	3.003	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(-c2cccs2)n[nH]1	ZINC001049744931	1347997363	/nfs/dbraw/zinc/99/73/63/1347997363.db2.gz	BWDWBCTZXWYIOK-HOTGVXAUSA-N	0	3	342.468	3.003	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1csc(C(C)(C)C)n1	ZINC001049784784	1348021021	/nfs/dbraw/zinc/02/10/21/1348021021.db2.gz	WRYXRQIHKCMOKB-LSDHHAIUSA-N	0	3	333.501	3.306	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1csc(-c2ccoc2)n1	ZINC001049792703	1348024268	/nfs/dbraw/zinc/02/42/68/1348024268.db2.gz	JNDABXIVFMOTHZ-CVEARBPZSA-N	0	3	343.452	3.268	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ncoc1-c1cccs1	ZINC001049793496	1348024478	/nfs/dbraw/zinc/02/44/78/1348024478.db2.gz	OMCDHNBHNBLKGP-KBPBESRZSA-N	0	3	343.452	3.268	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C[C@H]1CCc2ccccc21	ZINC001049800959	1348026768	/nfs/dbraw/zinc/02/67/68/1348026768.db2.gz	FVNAJCNRSXNWSW-HLAWJBBLSA-N	0	3	336.479	3.195	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(C)nc1OCCC	ZINC001049810639	1348031397	/nfs/dbraw/zinc/03/13/97/1348031397.db2.gz	BYVQUXLXLJMSHB-ZWKOTPCHSA-N	0	3	343.471	3.044	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(OC)c(C2CC2)c1	ZINC001049815224	1348033781	/nfs/dbraw/zinc/03/37/81/1348033781.db2.gz	DFRPBSMGBTYPBI-RBUKOAKNSA-N	0	3	340.467	3.438	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1oc(CCC)nc1C	ZINC001049849115	1348058030	/nfs/dbraw/zinc/05/80/30/1348058030.db2.gz	NTMQVSSDOYJBJH-JKSUJKDBSA-N	0	3	331.460	3.191	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc2c(s1)CCOC2	ZINC001049856514	1348063729	/nfs/dbraw/zinc/06/37/29/1348063729.db2.gz	ZLDXXUNOADXOFM-HOTGVXAUSA-N	0	3	346.496	3.076	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H]1Cc2ccc(Cl)cc21	ZINC001049869093	1348074793	/nfs/dbraw/zinc/07/47/93/1348074793.db2.gz	CEQIFLDTIPFQFI-FGTMMUONSA-N	0	3	330.859	3.231	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)COc1c(C)cc(C)cc1C	ZINC001049877583	1348082702	/nfs/dbraw/zinc/08/27/02/1348082702.db2.gz	QVEGYEZICBQVDZ-OALUTQOASA-N	0	3	342.483	3.242	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1csc2c1CCCC2	ZINC001049880559	1348085258	/nfs/dbraw/zinc/08/52/58/1348085258.db2.gz	GQMWQRHKQAUZCE-IAGOWNOFSA-N	0	3	330.497	3.492	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)CC(C)(C)c1ccc(C)cc1	ZINC001049885953	1348090716	/nfs/dbraw/zinc/09/07/16/1348090716.db2.gz	QSMUBSVQVSVXKP-WOJBJXKFSA-N	0	3	338.495	3.361	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(OCC2CC2)cc1	ZINC001049901267	1348101221	/nfs/dbraw/zinc/10/12/21/1348101221.db2.gz	OCQAIWOZGGQLKK-PMACEKPBSA-N	0	3	340.467	3.340	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(Cl)cc2c1OCC2	ZINC001049919897	1348112768	/nfs/dbraw/zinc/11/27/68/1348112768.db2.gz	YNMYIZZLPLRDBB-IRXDYDNUSA-N	0	3	346.858	3.140	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cnc(CC(C)C)s1	ZINC001049920471	1348113391	/nfs/dbraw/zinc/11/33/91/1348113391.db2.gz	BPXCXMJHHRZEMA-HZPDHXFCSA-N	0	3	345.512	3.044	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(C)n(C(C)C)n1	ZINC001049934852	1348121408	/nfs/dbraw/zinc/12/14/08/1348121408.db2.gz	WFJYCYNAOYFKPJ-ROUUACIJSA-N	0	3	330.476	3.027	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)c3cccc4ccccc43)[C@@H]2C1	ZINC001050196637	1348207847	/nfs/dbraw/zinc/20/78/47/1348207847.db2.gz	KRNUYNVMXVMFMR-GHTZIAJQSA-N	0	3	332.447	3.400	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC[C@H](CNCc3cc(C)on3)CC2)C1	ZINC001050363092	1348239016	/nfs/dbraw/zinc/23/90/16/1348239016.db2.gz	MWZULGNUMGBKGN-WKILWMFISA-N	0	3	331.460	3.104	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC2(C1)CCN([C@H](C)c1cccc(Cl)c1)CC2	ZINC001050460886	1348271675	/nfs/dbraw/zinc/27/16/75/1348271675.db2.gz	ZRBSHYSLKMZJRY-HUUCEWRRSA-N	0	3	345.874	3.485	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C3(c4ccccc4)CCC3)C2)CC1	ZINC001050585850	1348294132	/nfs/dbraw/zinc/29/41/32/1348294132.db2.gz	VTQPRUHCDRWYGM-UHFFFAOYSA-N	0	3	336.479	3.056	20	30		EGEDHN
C[C@]1(C(=O)N2CC3(C2)CCN(Cc2cccc(C#N)c2)CC3)C=CCC1	ZINC001050622594	1348305844	/nfs/dbraw/zinc/30/58/44/1348305844.db2.gz	FJBXBKRSWRJMES-NRFANRHFSA-N	0	3	349.478	3.339	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC3(C2)CCN(Cc2cnc(C)s2)CC3)C1	ZINC001050657703	1348319467	/nfs/dbraw/zinc/31/94/67/1348319467.db2.gz	UUYARCAKVZLZNW-UHFFFAOYSA-N	0	3	345.512	3.232	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccccc3C3(C)CC3)C2)CC1	ZINC001050660563	1348320737	/nfs/dbraw/zinc/32/07/37/1348320737.db2.gz	RZSUCYJDLLTGOJ-UHFFFAOYSA-N	0	3	336.479	3.299	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)C[C@@H]3C[C@@H](C)CC(C)(C)C3)C2)CC1	ZINC001050700188	1348330997	/nfs/dbraw/zinc/33/09/97/1348330997.db2.gz	BKJWKVVXSQUCQO-MSOLQXFVSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3cc(Cl)ccc3Cl)C2)CC1	ZINC001050737552	1348342604	/nfs/dbraw/zinc/34/26/04/1348342604.db2.gz	BPVOKPOAWMTVKC-UHFFFAOYSA-N	0	3	337.250	3.165	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc(F)cc3Cl)C2)CC1	ZINC001050744338	1348346062	/nfs/dbraw/zinc/34/60/62/1348346062.db2.gz	JCVSXKLDYOPLSJ-UHFFFAOYSA-N	0	3	334.822	3.040	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3csc4c3CC[C@@H](C)C4)C2)CC1	ZINC001050745555	1348346429	/nfs/dbraw/zinc/34/64/29/1348346429.db2.gz	XMFHRRGVMIUMPZ-OAHLLOKOSA-N	0	3	342.508	3.044	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3cc4c(s3)CC[C@@H](C)C4)C2)CC1	ZINC001050750262	1348347986	/nfs/dbraw/zinc/34/79/86/1348347986.db2.gz	FMWIFDJVJZJDAH-OAHLLOKOSA-N	0	3	342.508	3.044	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3cscc3C)cccc2C1	ZINC001051285703	1348418665	/nfs/dbraw/zinc/41/86/65/1348418665.db2.gz	SURHHBWQKIOBCN-UHFFFAOYSA-N	0	3	338.476	3.368	20	30		EGEDHN
C=C(C)CCN1CCN([C@@H]2CCN(C(=O)C3(CC)CCCC3)C2)CC1	ZINC001052103155	1348502547	/nfs/dbraw/zinc/50/25/47/1348502547.db2.gz	NQQYSKLAKFIYMB-LJQANCHMSA-N	0	3	347.547	3.142	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N[C@@H]1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC001052317449	1348520790	/nfs/dbraw/zinc/52/07/90/1348520790.db2.gz	JVYBWQPAUJAQTN-MSOLQXFVSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@H](C(=O)N[C@H]1CCCN(Cc2ccc(C#N)cc2)CC1)C1CCC1	ZINC001052485781	1348552920	/nfs/dbraw/zinc/55/29/20/1348552920.db2.gz	DLTDGTGPAZNVPD-JXFKEZNVSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@@H]2CCCC[C@@H]2C(F)(F)F)CC1	ZINC001052493168	1348557025	/nfs/dbraw/zinc/55/70/25/1348557025.db2.gz	PAKYGLYBBOWYRN-OAGGEKHMSA-N	0	3	344.421	3.349	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cccc3c(C)c(C)[nH]c32)CC1	ZINC001052496065	1348558408	/nfs/dbraw/zinc/55/84/08/1348558408.db2.gz	CJBFYVIGEZDKGI-KRWDZBQOSA-N	0	3	337.467	3.392	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)C2CCc3ccccc3CC2)CC1	ZINC001052512423	1348563069	/nfs/dbraw/zinc/56/30/69/1348563069.db2.gz	KBZRSSSRSGDUQS-OAQYLSRUSA-N	0	3	338.495	3.176	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)Cc2cc3ccccc3s2)CC1	ZINC001052552949	1348576954	/nfs/dbraw/zinc/57/69/54/1348576954.db2.gz	CDFGWTIQBXDNOP-QGZVFWFLSA-N	0	3	340.492	3.438	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)Cc2cccc(C)c2Cl)CC1	ZINC001052555400	1348577639	/nfs/dbraw/zinc/57/76/39/1348577639.db2.gz	RELFMIUXEZSCAB-KRWDZBQOSA-N	0	3	332.875	3.185	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cc3c(cc(C)cc3C)[nH]2)CC1	ZINC001052601668	1348592056	/nfs/dbraw/zinc/59/20/56/1348592056.db2.gz	PXWFYFYVMWXDTJ-QGZVFWFLSA-N	0	3	337.467	3.392	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCCN(Cc3ccccn3)CC2)CC1	ZINC001052682730	1348629887	/nfs/dbraw/zinc/62/98/87/1348629887.db2.gz	YCGGABHXVOQXKM-GOSISDBHSA-N	0	3	327.472	3.299	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc(C(C)C)nc2C)CC1	ZINC001052719320	1348647411	/nfs/dbraw/zinc/64/74/11/1348647411.db2.gz	RRVSMRSMICKGEP-QGZVFWFLSA-N	0	3	327.472	3.121	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H](NC(=O)[C@@H]3C[C@H]3C3CC3)CC2)cc1	ZINC001052780154	1348676461	/nfs/dbraw/zinc/67/64/61/1348676461.db2.gz	CSPSQTIFRKSERJ-SLFFLAALSA-N	0	3	337.467	3.075	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2)CC1	ZINC001052783079	1348678202	/nfs/dbraw/zinc/67/82/02/1348678202.db2.gz	AEKXMHDIYSBNQR-GBESFXJTSA-N	0	3	344.886	3.438	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2csc(C(C)(C)C)n2)CC1	ZINC001052791895	1348681519	/nfs/dbraw/zinc/68/15/19/1348681519.db2.gz	HZNHJBNHJHDREI-AWEZNQCLSA-N	0	3	333.501	3.048	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2csc3c2CC[C@@H](C)C3)CC1	ZINC001052911888	1348744743	/nfs/dbraw/zinc/74/47/43/1348744743.db2.gz	PYUHOOYAIJSOQR-CABCVRRESA-N	0	3	330.497	3.090	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)Cc2ccc3ccccc3c2)CC1	ZINC001052920551	1348748970	/nfs/dbraw/zinc/74/89/70/1348748970.db2.gz	ZSHJIPBRFCOMSV-NRFANRHFSA-N	0	3	334.463	3.376	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2csc3c2CCCC3)CC1	ZINC001052920527	1348749070	/nfs/dbraw/zinc/74/90/70/1348749070.db2.gz	ZGQPHNDABOTRMW-OAHLLOKOSA-N	0	3	330.497	3.235	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2sc(C(C)C)nc2C)CC1	ZINC001052929293	1348752367	/nfs/dbraw/zinc/75/23/67/1348752367.db2.gz	AFKFSEKJVLWGRN-HNNXBMFYSA-N	0	3	333.501	3.183	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@H](C)c2ccc(F)cc2F)CC1	ZINC001052948193	1348764584	/nfs/dbraw/zinc/76/45/84/1348764584.db2.gz	YSHSBXUSHJJCQY-ZBFHGGJFSA-N	0	3	334.410	3.062	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccccc2OCC2CC2)CC1	ZINC001052956008	1348769972	/nfs/dbraw/zinc/76/99/72/1348769972.db2.gz	NHYCEDOAJLKQKD-GOSISDBHSA-N	0	3	340.467	3.083	20	30		EGEDHN
CC(=O)N1CCCC[C@H]1[C@@H]1CCCN(Cc2ccc(C#N)s2)C1	ZINC001053054960	1348861158	/nfs/dbraw/zinc/86/11/58/1348861158.db2.gz	TYWTZGUOQYHXES-QAPCUYQASA-N	0	3	331.485	3.233	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2csnc2C)C1	ZINC001053075475	1348892956	/nfs/dbraw/zinc/89/29/56/1348892956.db2.gz	HADSMTQTTZYVED-FUHWJXTLSA-N	0	3	345.512	3.182	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2csnc2C)C1	ZINC001053075477	1348893339	/nfs/dbraw/zinc/89/33/39/1348893339.db2.gz	HADSMTQTTZYVED-WMZOPIPTSA-N	0	3	345.512	3.182	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2sccc2F)C1	ZINC001053080175	1348900911	/nfs/dbraw/zinc/90/09/11/1348900911.db2.gz	BCDQXEIHAZXSKO-GDBMZVCRSA-N	0	3	334.460	3.227	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccncc2C)C1	ZINC001053081734	1348902989	/nfs/dbraw/zinc/90/29/89/1348902989.db2.gz	XRNQZXZCTFFTBG-AZUAARDMSA-N	0	3	339.483	3.120	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(C)cs2)C1	ZINC001053082776	1348903894	/nfs/dbraw/zinc/90/38/94/1348903894.db2.gz	GPJTWFCKJILJPO-SJORKVTESA-N	0	3	330.497	3.396	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cc(F)ccc2F)C1	ZINC001053087290	1348910907	/nfs/dbraw/zinc/91/09/07/1348910907.db2.gz	JUNQWFMGSZBLBW-HNAYVOBHSA-N	0	3	346.421	3.305	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cc3occc3[nH]2)C1	ZINC001053088167	1348913331	/nfs/dbraw/zinc/91/33/31/1348913331.db2.gz	ZJYVIZYWAIJJKY-CRAIPNDOSA-N	0	3	339.439	3.101	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)C2CC3(CCC3)C2)C1	ZINC001053092754	1348919250	/nfs/dbraw/zinc/91/92/50/1348919250.db2.gz	IUDCMBUYOGBPNP-IEBWSBKVSA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)C2CC3(CCC3)C2)C1	ZINC001053092760	1348919464	/nfs/dbraw/zinc/91/94/64/1348919464.db2.gz	IUDCMBUYOGBPNP-PKOBYXMFSA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(C(C)C)on2)C1	ZINC001053094587	1348924967	/nfs/dbraw/zinc/92/49/67/1348924967.db2.gz	WVLOHWTXHQXDJU-AEFFLSMTSA-N	0	3	343.471	3.138	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cc[nH]c2C2CC2)C1	ZINC001053096057	1348925628	/nfs/dbraw/zinc/92/56/28/1348925628.db2.gz	ONRASGNVUCAXCR-HKUYNNGSSA-N	0	3	339.483	3.232	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccc(C)cc2F)C1	ZINC001053099710	1348932125	/nfs/dbraw/zinc/93/21/25/1348932125.db2.gz	XYOVCMNOKVGMHI-FXAWDEMLSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)Cc2cccc(F)c2)C1	ZINC001053104399	1348939355	/nfs/dbraw/zinc/93/93/55/1348939355.db2.gz	GCMCIJVRTPNDIQ-QUCCMNQESA-N	0	3	342.458	3.095	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(C)nc2C)C1	ZINC001053106008	1348943372	/nfs/dbraw/zinc/94/33/72/1348943372.db2.gz	RLCRADFFUKEAGN-ICSRJNTNSA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccc(C)nc2C)C1	ZINC001053106007	1348943407	/nfs/dbraw/zinc/94/34/07/1348943407.db2.gz	RLCRADFFUKEAGN-AZUAARDMSA-N	0	3	339.483	3.038	20	30		EGEDHN
C=C(C)CCN1Cc2ccccc2C[C@@H]1CNC(=O)c1cc(F)c[nH]1	ZINC001054047493	1349136996	/nfs/dbraw/zinc/13/69/96/1349136996.db2.gz	FCRKEMWMIFIAKX-GOSISDBHSA-N	0	3	341.430	3.277	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2Cc3ccccc3CN2CC2CC2)cc1	ZINC001054048548	1349138535	/nfs/dbraw/zinc/13/85/35/1349138535.db2.gz	DULJWOSABKVXKI-QFIPXVFZSA-N	0	3	344.458	3.235	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc(C)c3ccccc3n1)C2	ZINC001054154881	1349157689	/nfs/dbraw/zinc/15/76/89/1349157689.db2.gz	XSUSHMVKNLQYQK-QFIPXVFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cccc(C(C)C)n1)C2	ZINC001054161032	1349163814	/nfs/dbraw/zinc/16/38/14/1349163814.db2.gz	VQMODQGVTPPXQU-NRFANRHFSA-N	0	3	339.483	3.156	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)CCc1ccc(C)cc1)C2	ZINC001054161962	1349164421	/nfs/dbraw/zinc/16/44/21/1349164421.db2.gz	TYBBVONBLMGKAR-QFIPXVFZSA-N	0	3	338.495	3.265	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)C[C@@H](C)c1ccco1)C2	ZINC001054229030	1349222360	/nfs/dbraw/zinc/22/23/60/1349222360.db2.gz	IIGBFQXMDDUKFJ-XLIONFOSSA-N	0	3	328.456	3.111	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)Cc1ccc(C)c(C)c1)C2	ZINC001054236346	1349229191	/nfs/dbraw/zinc/22/91/91/1349229191.db2.gz	ILARQXMSGYKKTI-QFIPXVFZSA-N	0	3	338.495	3.184	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@H](C)Cc1ccccc1)C2	ZINC001054243430	1349237027	/nfs/dbraw/zinc/23/70/27/1349237027.db2.gz	HMBMQUZZGIVVOJ-DENIHFKCSA-N	0	3	338.495	3.203	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1c[nH]c3c1cccc3CC)C2	ZINC001054245065	1349238366	/nfs/dbraw/zinc/23/83/66/1349238366.db2.gz	NYNJSMNWARQNGT-JOCHJYFZSA-N	0	3	349.478	3.292	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1c[nH]c3ccc(C)cc13)C2	ZINC001054246123	1349240524	/nfs/dbraw/zinc/24/05/24/1349240524.db2.gz	OGPIEAIULRXBAA-JOCHJYFZSA-N	0	3	349.478	3.428	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3csnc3C)cc2C1	ZINC001054261238	1349258002	/nfs/dbraw/zinc/25/80/02/1349258002.db2.gz	VOACXNOJLANIAA-UHFFFAOYSA-N	0	3	327.453	3.273	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)C3CC(OCC)C3)cc2C1	ZINC001054263459	1349260408	/nfs/dbraw/zinc/26/04/08/1349260408.db2.gz	OOGVWQCIPSNGMB-UHFFFAOYSA-N	0	3	328.456	3.010	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@H]3CO[C@@H](C)C3)cc2C1	ZINC001054271267	1349271234	/nfs/dbraw/zinc/27/12/34/1349271234.db2.gz	KBHVAHVVLWHIJE-HNAYVOBHSA-N	0	3	328.456	3.010	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3ccn(C)c3CC)cc2C1	ZINC001054280183	1349281067	/nfs/dbraw/zinc/28/10/67/1349281067.db2.gz	CDTRFUMUJHXWKG-UHFFFAOYSA-N	0	3	337.467	3.409	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cnoc3C3CC3)cc2C1	ZINC001054288290	1349292358	/nfs/dbraw/zinc/29/23/58/1349292358.db2.gz	PZMBNVMTVGFTOX-UHFFFAOYSA-N	0	3	337.423	3.374	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccc(F)cc2)C[C@H]1NCc1ccc(C#N)s1	ZINC001054329313	1349311487	/nfs/dbraw/zinc/31/14/87/1349311487.db2.gz	QIWFSQLUUBYEQQ-SJKOYZFVSA-N	0	3	343.427	3.009	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccoc2Cl)C[C@H]1NCc1ccc(C#N)s1	ZINC001054615015	1349415377	/nfs/dbraw/zinc/41/53/77/1349415377.db2.gz	WNDLKZJBBAAGGO-QMTHXVAHSA-N	0	3	349.843	3.116	20	30		EGEDHN
CCc1ccc(C(=O)N2C[C@H](NCc3ccc(C#N)s3)[C@@H](C)C2)o1	ZINC001054812402	1349473622	/nfs/dbraw/zinc/47/36/22/1349473622.db2.gz	JNBTZHKHUWNAPN-LRDDRELGSA-N	0	3	343.452	3.025	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@H](NCc2cccc(Cl)n2)C1	ZINC001054970808	1349531564	/nfs/dbraw/zinc/53/15/64/1349531564.db2.gz	ITNYGPPTEOUGOG-UKRRQHHQSA-N	0	3	335.879	3.274	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@@H](NCc2ccc(Cl)nc2)C1	ZINC001054970977	1349531874	/nfs/dbraw/zinc/53/18/74/1349531874.db2.gz	KQJKCTRJSLIABW-HIFRSBDPSA-N	0	3	335.879	3.274	20	30		EGEDHN
C#CCCN1CC[C@]2(C1)CN(C(=O)C1CCCCCCC1)C[C@@H](C)O2	ZINC001071188972	1354494094	/nfs/dbraw/zinc/49/40/94/1354494094.db2.gz	DBIGXXLCUKIKPT-NQIIRXRSSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C(CC)(CC)CC)C[C@H](C)O2	ZINC001071226048	1354513634	/nfs/dbraw/zinc/51/36/34/1354513634.db2.gz	UMHCYMQPJRMGTB-PXNSSMCTSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1cc(C)c(CC)o1)C[C@@H](C)O2	ZINC001071227712	1354514568	/nfs/dbraw/zinc/51/45/68/1354514568.db2.gz	IWGPDIOTAYWMQM-OXQOHEQNSA-N	0	3	346.471	3.032	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1ccc(F)cc1C)C[C@H](C)O2	ZINC001071231137	1354515741	/nfs/dbraw/zinc/51/57/41/1354515741.db2.gz	NOOHLPOBYAVJFK-JXFKEZNVSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)[C@H]1CC[C@H](C)CC1)C[C@@H](C)O2	ZINC001071232111	1354516125	/nfs/dbraw/zinc/51/61/25/1354516125.db2.gz	ZEBWWTFEWKJTJS-MLYOOKFZSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc(C)c(OC)c(C)c2)CC[C@H]1C	ZINC001071523003	1354744444	/nfs/dbraw/zinc/74/44/44/1354744444.db2.gz	VZHXVMBNABZXLR-AEFFLSMTSA-N	0	3	330.472	3.471	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cnn3c2ccc(C)c3C)CC[C@H]1C	ZINC001071580282	1354777219	/nfs/dbraw/zinc/77/72/19/1354777219.db2.gz	RADKXAMPMDJQQC-WBVHZDCISA-N	0	3	340.471	3.110	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccnn2-c2ccccc2)CC[C@@H]1C	ZINC001071610735	1354795100	/nfs/dbraw/zinc/79/51/00/1354795100.db2.gz	WLLLBVWWYZJEFZ-DLBZAZTESA-N	0	3	338.455	3.031	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc(C)c3ccccc3n2)CC[C@@H]1C	ZINC001071612619	1354796692	/nfs/dbraw/zinc/79/66/92/1354796692.db2.gz	LBPBCBVRIIDKKX-DLBZAZTESA-N	0	3	335.451	3.149	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cnn3cccc(Cl)c23)CC[C@H]1C	ZINC001071670510	1354840167	/nfs/dbraw/zinc/84/01/67/1354840167.db2.gz	LWKZZYJGKOJUNC-ZIAGYGMSSA-N	0	3	346.862	3.147	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CC[C@H](C)N(Cc3cccc(C)c3)C2)c1	ZINC001071813674	1354955951	/nfs/dbraw/zinc/95/59/51/1354955951.db2.gz	CYNWHNMPXRMMDX-UWJYYQICSA-N	0	3	347.462	3.154	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(C(C)C)nc2C)CC[C@H]1C	ZINC001071827726	1354964723	/nfs/dbraw/zinc/96/47/23/1354964723.db2.gz	CCPWLUWBZZEQEO-WBVHZDCISA-N	0	3	327.472	3.119	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2c[nH]c3ccc(F)cc23)CC[C@H]1C	ZINC001071851992	1354980383	/nfs/dbraw/zinc/98/03/83/1354980383.db2.gz	TUALUUVPRHPAQS-RHSMWYFYSA-N	0	3	343.446	3.395	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cnc(C(C)C)nc2C)CC[C@@H]1C	ZINC001071875828	1355000826	/nfs/dbraw/zinc/00/08/26/1355000826.db2.gz	FGCLTEGJYSCJQX-GOEBONIOSA-N	0	3	330.476	3.067	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)Cc2c[nH]c3cc(C)ccc23)CC[C@@H]1C	ZINC001071886629	1355006331	/nfs/dbraw/zinc/00/63/31/1355006331.db2.gz	HLAJRHJBHDWSIW-RDJZCZTQSA-N	0	3	325.456	3.174	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C(C)(C)c2ccccc2F)CC[C@H]1C	ZINC001071896538	1355011890	/nfs/dbraw/zinc/01/18/90/1355011890.db2.gz	GVQBQWLPJVDNKJ-HZPDHXFCSA-N	0	3	330.447	3.096	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc3ccn(C)c3c2)CC[C@H]1C	ZINC001071962910	1355047086	/nfs/dbraw/zinc/04/70/86/1355047086.db2.gz	CIXAKZUFBFKGCU-QAPCUYQASA-N	0	3	325.456	3.337	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cn(CCCC)nc2C)CC[C@@H]1C	ZINC001071976781	1355056505	/nfs/dbraw/zinc/05/65/05/1355056505.db2.gz	IESBWIYPYQMVAS-RDJZCZTQSA-N	0	3	332.492	3.150	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc3c(C)cccn3c2)CC[C@H]1C	ZINC001071988881	1355061132	/nfs/dbraw/zinc/06/11/32/1355061132.db2.gz	MGUMQXSUEKVROL-SJLPKXTDSA-N	0	3	325.456	3.407	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2c[nH]c3ccccc23)CC[C@@H]1C	ZINC001072012947	1355077129	/nfs/dbraw/zinc/07/71/29/1355077129.db2.gz	VQRXEYJZYBAGJC-DOTOQJQBSA-N	0	3	325.456	3.256	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(N(CC)CC)cc2)CC[C@H]1C	ZINC001072023453	1355086430	/nfs/dbraw/zinc/08/64/30/1355086430.db2.gz	RFBBUEGUHXRYJQ-MJGOQNOKSA-N	0	3	341.499	3.139	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc3ncsc3c2)CC[C@H]1C	ZINC001072043868	1355100117	/nfs/dbraw/zinc/10/01/17/1355100117.db2.gz	FWSSBEWAKWPFCV-HIFRSBDPSA-N	0	3	329.469	3.455	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2(c3ccc(Cl)cc3)CC2)CC[C@@H]1C	ZINC001072049869	1355103277	/nfs/dbraw/zinc/10/32/77/1355103277.db2.gz	RJNFVGFPHTUDEW-MAUKXSAKSA-N	0	3	344.886	3.364	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2ccc(OCC)cc2)CC[C@H]1C	ZINC001072049258	1355103611	/nfs/dbraw/zinc/10/36/11/1355103611.db2.gz	OLFMHQZAJXIGEL-SJLPKXTDSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)Cc2coc3cc(C)ccc23)CC[C@H]1C	ZINC001072050278	1355104287	/nfs/dbraw/zinc/10/42/87/1355104287.db2.gz	UQKZNYLZMUFNOF-WBVHZDCISA-N	0	3	326.440	3.439	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(COC(C)C)cc2)CC[C@@H]1C	ZINC001072063597	1355108937	/nfs/dbraw/zinc/10/89/37/1355108937.db2.gz	VJOJRYWBGCRWIA-FXAWDEMLSA-N	0	3	342.483	3.218	20	30		EGEDHN
C=C(C)CCN1C[C@H](NC(=O)c2scnc2Cl)CC[C@H]1C	ZINC001072072354	1355113264	/nfs/dbraw/zinc/11/32/64/1355113264.db2.gz	JALUFZRMHAVITG-VXGBXAGGSA-N	0	3	327.881	3.345	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C(C)(C)c2ccccc2C)CC[C@@H]1C	ZINC001072113386	1355138516	/nfs/dbraw/zinc/13/85/16/1355138516.db2.gz	ULMQXFWWPGZERZ-ZWKOTPCHSA-N	0	3	326.484	3.265	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)Cc2c(C)oc3ccccc32)CC[C@H]1C	ZINC001072128824	1355144235	/nfs/dbraw/zinc/14/42/35/1355144235.db2.gz	FZFYUCMTBOMTQZ-ZBFHGGJFSA-N	0	3	326.440	3.439	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2N(Cc2ccsc2)C(=O)C2CC2)CC1	ZINC001072134031	1355147614	/nfs/dbraw/zinc/14/76/14/1355147614.db2.gz	BCUPUVUAOJRQSH-GOSISDBHSA-N	0	3	342.508	3.365	20	30		EGEDHN
C[C@H]1CCN(C(=O)C2CCC2)C[C@@H]1CNCc1cc(F)ccc1C#N	ZINC001072153916	1355154835	/nfs/dbraw/zinc/15/48/35/1355154835.db2.gz	JZGKWHAIKRADBR-KSSFIOAISA-N	0	3	343.446	3.072	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@@H](C)[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001072170913	1355165945	/nfs/dbraw/zinc/16/59/45/1355165945.db2.gz	IZTDBHJHYIZIBX-CRAIPNDOSA-N	0	3	343.446	3.238	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](C)[C@@H](CNCc3cscn3)C2)CC1	ZINC001072352712	1355253947	/nfs/dbraw/zinc/25/39/47/1355253947.db2.gz	JYVZUCVQBNPHTG-WBVHZDCISA-N	0	3	347.528	3.464	20	30		EGEDHN
CC[C@H](c1ccc(Cl)cc1)N1CCC2(CN(C(=O)[C@@H](C)C#N)C2)C1	ZINC001072553426	1355330958	/nfs/dbraw/zinc/33/09/58/1355330958.db2.gz	ZKJZBUGZCVFZKC-WMLDXEAASA-N	0	3	345.874	3.485	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H](CC)C3CCC(C)CC3)C2)C1	ZINC001072805772	1355446516	/nfs/dbraw/zinc/44/65/16/1355446516.db2.gz	MXTLMQAMODGTSM-CTWPCTMYSA-N	0	3	330.516	3.397	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2csc3ccccc23)C1	ZINC001073716616	1355874762	/nfs/dbraw/zinc/87/47/62/1355874762.db2.gz	HNZPUFXRLFJOQN-HNNXBMFYSA-N	0	3	344.480	3.298	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2cc(Cl)ccc2C)C1	ZINC001073824891	1355908317	/nfs/dbraw/zinc/90/83/17/1355908317.db2.gz	YMPZINSRDYKTLQ-INIZCTEOSA-N	0	3	336.863	3.045	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2cc3cc(C)ccc3o2)C1	ZINC001073899329	1355946078	/nfs/dbraw/zinc/94/60/78/1355946078.db2.gz	QPMLYKFUBLFNGJ-QGZVFWFLSA-N	0	3	342.439	3.138	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCCN1C(=O)c1ccoc1	ZINC001073947457	1355984023	/nfs/dbraw/zinc/98/40/23/1355984023.db2.gz	SBMRVONILMKROO-LJQANCHMSA-N	0	3	337.423	3.278	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCCN1C(=O)c1cc[nH]c1	ZINC001074019110	1356037510	/nfs/dbraw/zinc/03/75/10/1356037510.db2.gz	GNUBXTQPLUWLOL-LJQANCHMSA-N	0	3	336.439	3.013	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC[C@H](NCc2cc(Cl)ccc2Cl)[C@@H]1C	ZINC001074568620	1356209864	/nfs/dbraw/zinc/20/98/64/1356209864.db2.gz	VBAAFMPGNWBPJJ-PGUXBMHVSA-N	0	3	340.254	3.232	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1)C2	ZINC001097708675	1363106493	/nfs/dbraw/zinc/10/64/93/1363106493.db2.gz	HFRJCQMXXGMQEP-RYPNDVFKSA-N	0	3	348.899	3.250	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cncc(-c4ccccc4)c3)[C@@H]2C1	ZINC001075857843	1356433866	/nfs/dbraw/zinc/43/38/66/1356433866.db2.gz	IMESFWBKDDDAGF-GHTZIAJQSA-N	0	3	347.462	3.471	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3cc4c(o3)c(F)ccc4C)[C@@H]2C1	ZINC001076082496	1356485283	/nfs/dbraw/zinc/48/52/83/1356485283.db2.gz	NEABGBYWDZKCOH-WMLDXEAASA-N	0	3	340.398	3.050	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)C3CC(c4ccc(F)cc4)C3)[C@@H]2C1	ZINC001076638505	1356640213	/nfs/dbraw/zinc/64/02/13/1356640213.db2.gz	SMVONVPBULSLLW-USWSCHJFSA-N	0	3	342.458	3.428	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)C[C@H](C)C(C)C	ZINC001098961237	1363542475	/nfs/dbraw/zinc/54/24/75/1363542475.db2.gz	WDYANLNWJBVSDG-ROUUACIJSA-N	0	3	338.536	3.478	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)C[C@H]1Cc2ccccc2O1	ZINC001099085692	1363615640	/nfs/dbraw/zinc/61/56/40/1363615640.db2.gz	QSLJAFOEBZTBPA-ZWKOTPCHSA-N	0	3	342.483	3.173	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@@H](C)c2ccsc2)C[C@H]1C(F)(F)F	ZINC001099306006	1363741109	/nfs/dbraw/zinc/74/11/09/1363741109.db2.gz	JHEIMGPCWAQFQL-IACUBPJLSA-N	0	3	346.418	3.407	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H](c1ccccc1)N(C)C	ZINC001099349603	1363766231	/nfs/dbraw/zinc/76/62/31/1363766231.db2.gz	QOUPHNDOHVDWJD-MOPGFXCFSA-N	0	3	343.515	3.082	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)COC1CCC(C)CC1	ZINC001099359921	1363772440	/nfs/dbraw/zinc/77/24/40/1363772440.db2.gz	UEILDXFPHAVATH-LXPRWKDFSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc(CC)ccn2)C12CCC2	ZINC001078628292	1357040492	/nfs/dbraw/zinc/04/04/92/1357040492.db2.gz	BXTJXKMZEJCZTM-HOTGVXAUSA-N	0	3	333.863	3.027	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ncc(Cl)s2)C12CCC2	ZINC001078680916	1357053082	/nfs/dbraw/zinc/05/30/82/1357053082.db2.gz	VDFVIYKMJJXRBO-UWVGGRQHSA-N	0	3	346.283	3.180	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2occc2Cl)C12CCC2	ZINC001078718008	1357063512	/nfs/dbraw/zinc/06/35/12/1357063512.db2.gz	JOLPJPPPOBGZEY-VXGBXAGGSA-N	0	3	329.227	3.316	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2ccccc2CC)C[C@H]1c1ccccc1	ZINC001081170552	1357846710	/nfs/dbraw/zinc/84/67/10/1357846710.db2.gz	BPVUMRMGEUPKGO-LEWJYISDSA-N	0	3	332.447	3.080	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)CC(C2CC2)C2CC2)C[C@H]1c1ccccc1	ZINC001081231711	1357852304	/nfs/dbraw/zinc/85/23/04/1357852304.db2.gz	NQHVMIANRLDCHM-LEWJYISDSA-N	0	3	336.479	3.030	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)[C@H]2CC[C@H](C(C)C)CC2)[C@H](OC)C1	ZINC001082274364	1358000660	/nfs/dbraw/zinc/00/06/60/1358000660.db2.gz	IXKBPSVHLLFPCC-NCXUSEDFSA-N	0	3	336.520	3.230	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H](C)[C@H](NCc2ccnc(Cl)c2)C1	ZINC001082722007	1358079952	/nfs/dbraw/zinc/07/99/52/1358079952.db2.gz	SWFVULBDMJAQQQ-DDUZABMNSA-N	0	3	335.879	3.274	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)c3ccc(Cl)c(C)c3)[C@H]2C1	ZINC001083182946	1358123188	/nfs/dbraw/zinc/12/31/88/1358123188.db2.gz	FSOMKZDKEJAQLX-ZWKOTPCHSA-N	0	3	348.874	3.140	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3cccc(C(F)F)c3F)[C@@H]2C1	ZINC001084350216	1358197318	/nfs/dbraw/zinc/19/73/18/1358197318.db2.gz	SDECWHPEVTUZGU-IUODEOHRSA-N	0	3	338.373	3.486	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@H]2CCN(Cc3ccccc3)C[C@H]21	ZINC001084373015	1358203248	/nfs/dbraw/zinc/20/32/48/1358203248.db2.gz	RPSAIUQMWPICGT-IAGOWNOFSA-N	0	3	332.875	3.498	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@@H]3CC=CC[C@H]3C(F)(F)F)[C@@H]2C1	ZINC001084453519	1358217359	/nfs/dbraw/zinc/21/73/59/1358217359.db2.gz	QKNDBWJNPFPQBY-KLHDSHLOSA-N	0	3	342.405	3.240	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)C[C@@H](C)c3cccc(F)c3)[C@@H]2C1	ZINC001084649659	1358268914	/nfs/dbraw/zinc/26/89/14/1358268914.db2.gz	ZPWQPBUZVGQUNG-SZVBFZGTSA-N	0	3	330.447	3.428	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@@H]3Cc4ccc(Cl)cc43)[C@@H]2C1	ZINC001084804501	1358315075	/nfs/dbraw/zinc/31/50/75/1358315075.db2.gz	UKSDOLHSHMLJAC-ZTFGCOKTSA-N	0	3	330.859	3.089	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)CCc3ccc(CC)cc3)[C@@H]2C1	ZINC001084826097	1358321205	/nfs/dbraw/zinc/32/12/05/1358321205.db2.gz	LCKKFILEZUPUGY-WOJBJXKFSA-N	0	3	326.484	3.290	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@@H](CC)c3ccc(OC)cc3)[C@@H]2C1	ZINC001084845869	1358327335	/nfs/dbraw/zinc/32/73/35/1358327335.db2.gz	KUBBYACOXASRRL-YZGWKJHDSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@H]3Cc4c3cccc4Cl)[C@@H]2C1	ZINC001084861101	1358333439	/nfs/dbraw/zinc/33/34/39/1358333439.db2.gz	VOXBBVXBFRFBOY-RPVQJOFSSA-N	0	3	330.859	3.089	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC[C@H]2CCN(Cc3cc4ccccc4o3)[C@H]2C1	ZINC001084906346	1358344271	/nfs/dbraw/zinc/34/42/71/1358344271.db2.gz	NDXFTWDMWGQGBM-DAYGRLMNSA-N	0	3	337.423	3.015	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@H](C)Cc3ccccc3F)C[C@@H]21	ZINC001085029897	1358372781	/nfs/dbraw/zinc/37/27/81/1358372781.db2.gz	FBXAKVDKZXJNTI-MDZRGWNJSA-N	0	3	330.447	3.113	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@H](C)Cc3cccc(F)c3)C[C@@H]21	ZINC001085104256	1358392061	/nfs/dbraw/zinc/39/20/61/1358392061.db2.gz	RZDORFJVQJRFHE-SUMDDJOVSA-N	0	3	330.447	3.113	20	30		EGEDHN
C[C@H](C(=O)N[C@@H]1CCCC[C@H]1NCc1ccc(C#N)cc1F)C1CC1	ZINC001085162659	1358417885	/nfs/dbraw/zinc/41/78/85/1358417885.db2.gz	WVMYUJOZRLSTGC-MJXNMMHHSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1sc(Cl)nc1C	ZINC001085212079	1358435183	/nfs/dbraw/zinc/43/51/83/1358435183.db2.gz	HDZNRWSKLJLUHH-GHMZBOCLSA-N	0	3	348.299	3.488	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccc(OC)c(F)c1	ZINC001085231651	1358438664	/nfs/dbraw/zinc/43/86/64/1358438664.db2.gz	LGAQTZMGXZKXOA-HUUCEWRRSA-N	0	3	340.826	3.217	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccc(OC)cc1C	ZINC001085317004	1358463738	/nfs/dbraw/zinc/46/37/38/1358463738.db2.gz	DWXAMBICTIUHPT-IAGOWNOFSA-N	0	3	336.863	3.387	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCC[C@H]2NCc2c(C)onc2CC)C1	ZINC001085324613	1358467619	/nfs/dbraw/zinc/46/76/19/1358467619.db2.gz	FQONRMDLIKJLEM-QZTJIDSGSA-N	0	3	345.487	3.419	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ncoc1C(C)(C)C	ZINC001085387254	1358485124	/nfs/dbraw/zinc/48/51/24/1358485124.db2.gz	GTWZOPAMGGYYAP-CHWSQXEVSA-N	0	3	339.867	3.355	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1cccc(C(F)F)c1F	ZINC001085597781	1358624120	/nfs/dbraw/zinc/62/41/20/1358624120.db2.gz	FXTOKOOXBPWJNV-LBPRGKRZSA-N	0	3	326.362	3.486	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccoc1C(F)(F)F	ZINC001085618711	1358639935	/nfs/dbraw/zinc/63/99/35/1358639935.db2.gz	UPADARRMYRSPES-LBPRGKRZSA-N	0	3	330.350	3.411	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1ccnc(-c2ccco2)c1	ZINC001085662358	1358666935	/nfs/dbraw/zinc/66/69/35/1358666935.db2.gz	XNOFOQXQTIQFMV-INIZCTEOSA-N	0	3	325.412	3.064	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cccnc1C(F)(F)F	ZINC001085843477	1358811395	/nfs/dbraw/zinc/81/13/95/1358811395.db2.gz	MSSOQRKARDWEGE-ZDUSSCGKSA-N	0	3	341.377	3.213	20	30		EGEDHN
C#CCN(CCc1nc2sc3c(c2c(N)n1)CCCC3)CC1CC1	ZINC001323379112	1387357060	/nfs/dbraw/zinc/35/70/60/1387357060.db2.gz	JNLFZTFLBDVGDU-UHFFFAOYSA-N	0	3	340.496	3.040	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)C1CC(c2ccc(F)cc2)C1	ZINC001086001277	1358955406	/nfs/dbraw/zinc/95/54/06/1358955406.db2.gz	BLDCFXCGYPIWNW-TVPLGVNVSA-N	0	3	330.447	3.428	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)c2sccc2C)C1	ZINC001086012233	1358962986	/nfs/dbraw/zinc/96/29/86/1358962986.db2.gz	NLCWIJGWALSTHF-TXEJJXNPSA-N	0	3	343.290	3.063	20	30		EGEDHN
CCCCC(=O)N1CC[C@H](CNCc2cc(F)ccc2C#N)[C@@H](C)C1	ZINC001183899474	1387368892	/nfs/dbraw/zinc/36/88/92/1387368892.db2.gz	POBWSJHWVSTOQC-DOTOQJQBSA-N	0	3	345.462	3.462	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccnc3ccccc32)C1	ZINC001086141025	1359006481	/nfs/dbraw/zinc/00/64/81/1359006481.db2.gz	MTBZNHANGPYZJV-OKILXGFUSA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc3ncccc3c2)C1	ZINC001086186578	1359020319	/nfs/dbraw/zinc/02/03/19/1359020319.db2.gz	GGZIBAAIGFRWPK-AKAXFMLLSA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@@H]2C[C@H]2c2ccccc2C)C1	ZINC001086222816	1359031973	/nfs/dbraw/zinc/03/19/73/1359031973.db2.gz	IVLZCIFFBCLDGU-CIRFHOKZSA-N	0	3	332.875	3.335	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cccc(C(F)F)c2)C1	ZINC001086257222	1359043910	/nfs/dbraw/zinc/04/39/10/1359043910.db2.gz	PZPYUCAPWQFDOW-VDISTLRHSA-N	0	3	328.790	3.475	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(C)c3c2CCC3)C1	ZINC001086281164	1359054017	/nfs/dbraw/zinc/05/40/17/1359054017.db2.gz	BMPAZEDUFGBHCQ-GASCZTMLSA-N	0	3	332.875	3.334	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(Cl)c(C)c2)C1	ZINC001086466524	1359108130	/nfs/dbraw/zinc/10/81/30/1359108130.db2.gz	IAKQUOOSLRUKIO-MQMHXKEQSA-N	0	3	327.255	3.499	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@@H]2CCO[C@H]2c2ccccc2)C1	ZINC001086502566	1359122180	/nfs/dbraw/zinc/12/21/80/1359122180.db2.gz	FSWFPSJEGCEOIY-DDBAPUKQSA-N	0	3	348.874	3.001	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)C[C@H]2C=CCCC2)C1	ZINC001086594784	1359158674	/nfs/dbraw/zinc/15/86/74/1359158674.db2.gz	SYLYEZINADPDFB-SESVDKBCSA-N	0	3	336.479	3.340	20	30		EGEDHN
C=CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2ocnc2CC)C1	ZINC001086608617	1359164021	/nfs/dbraw/zinc/16/40/21/1359164021.db2.gz	RITGDNOTUYUTPL-FUHWJXTLSA-N	0	3	339.439	3.011	20	30		EGEDHN
C=C(C)CN1C[C@@H](c2ccccc2)[C@H](NC(=O)[C@@H](C)c2cccnc2)C1	ZINC001086620116	1359166623	/nfs/dbraw/zinc/16/66/23/1359166623.db2.gz	YWMFSNBQNNCHGB-DZFGPLHGSA-N	0	3	349.478	3.345	20	30		EGEDHN
Cc1cc(C(=O)NC[C@H]2CC[C@@H](NCc3ccccc3C#N)C2)co1	ZINC001086680829	1359183977	/nfs/dbraw/zinc/18/39/77/1359183977.db2.gz	LQWGPGFKRJPQST-HNAYVOBHSA-N	0	3	337.423	3.148	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2c(C)noc2CCC)C1	ZINC001086694784	1359187559	/nfs/dbraw/zinc/18/75/59/1359187559.db2.gz	KKKUWIXEMSLOGH-UONOGXRCSA-N	0	3	339.867	3.176	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cccc3c2O[C@H](C)C3)C1	ZINC001086761392	1359196268	/nfs/dbraw/zinc/19/62/68/1359196268.db2.gz	CZYAVHYFRUZUOR-IJEWVQPXSA-N	0	3	348.874	3.251	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2nccc3ccccc32)C1	ZINC001086789375	1359201602	/nfs/dbraw/zinc/20/16/02/1359201602.db2.gz	JULNQIVTVRTKFL-GOEBONIOSA-N	0	3	343.858	3.475	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)[C@@H]2Cc3ccc(F)cc32)C1	ZINC001086787310	1359201662	/nfs/dbraw/zinc/20/16/62/1359201662.db2.gz	MJQQTLIWMYOYBQ-XGWLTEMNSA-N	0	3	336.838	3.092	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccc3cc[nH]c3c2)C1	ZINC001086815205	1359206985	/nfs/dbraw/zinc/20/69/85/1359206985.db2.gz	IZGAERNPQXDALB-XJKSGUPXSA-N	0	3	331.847	3.409	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cccc(OCC)c2)C1	ZINC001086814745	1359207227	/nfs/dbraw/zinc/20/72/27/1359207227.db2.gz	LHEDXLZQBXCGPP-GOEBONIOSA-N	0	3	336.863	3.326	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccc(C)cc2OC)C1	ZINC001086858200	1359215020	/nfs/dbraw/zinc/21/50/20/1359215020.db2.gz	UYDLSGUIZVMGHO-LSDHHAIUSA-N	0	3	336.863	3.244	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cc(C)n(C(C)C)n2)C1	ZINC001086891192	1359221821	/nfs/dbraw/zinc/22/18/21/1359221821.db2.gz	JLTHWVJHLBPRLB-LSDHHAIUSA-N	0	3	338.883	3.013	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)CCc3cccc(C)c3)C2)CC1	ZINC001086935703	1359258567	/nfs/dbraw/zinc/25/85/67/1359258567.db2.gz	YQCFPBYZMFQRHC-LJQANCHMSA-N	0	3	338.495	3.264	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cccc4ncccc43)C2)CC1	ZINC001086935664	1359258596	/nfs/dbraw/zinc/25/85/96/1359258596.db2.gz	XTBFUJBKIQSOAC-KRWDZBQOSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H](C)Cc3cccs3)C2)CC1	ZINC001086945647	1359267028	/nfs/dbraw/zinc/26/70/28/1359267028.db2.gz	GFHYOKHXWNQWBU-IRXDYDNUSA-N	0	3	344.524	3.263	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3oc(C(C)C)nc3C)C2)CC1	ZINC001086946509	1359267583	/nfs/dbraw/zinc/26/75/83/1359267583.db2.gz	BDDPBPZQHPNDQB-OAHLLOKOSA-N	0	3	343.471	3.056	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H](C)c3ccc(C)o3)C2)CC1	ZINC001086946885	1359268086	/nfs/dbraw/zinc/26/80/86/1359268086.db2.gz	KTJOHNFGLFFWCF-WMZOPIPTSA-N	0	3	342.483	3.418	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc4ccncc4c3)C2)CC1	ZINC001086951424	1359271813	/nfs/dbraw/zinc/27/18/13/1359271813.db2.gz	DMNAARGFJOWNQY-KRWDZBQOSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc(C(F)F)o3)C2)CC1	ZINC001086955129	1359275583	/nfs/dbraw/zinc/27/55/83/1359275583.db2.gz	DUQDIVXOTPXKDZ-CYBMUJFWSA-N	0	3	336.382	3.167	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc(F)cc(F)c3)C2)CC1	ZINC001086955740	1359276730	/nfs/dbraw/zinc/27/67/30/1359276730.db2.gz	VKRZEPISABVNKH-OAHLLOKOSA-N	0	3	346.421	3.305	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@H](C)c3cccc(F)c3)C2)CC1	ZINC001086957285	1359278251	/nfs/dbraw/zinc/27/82/51/1359278251.db2.gz	JJWYWONSHXBTPN-IAGOWNOFSA-N	0	3	342.458	3.265	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cccn3C(C)C)C2)CC1	ZINC001086957355	1359278413	/nfs/dbraw/zinc/27/84/13/1359278413.db2.gz	KVLGIFAAQLWNII-KRWDZBQOSA-N	0	3	327.472	3.019	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3cccn3C(C)C)C2)CC1	ZINC001086957669	1359278758	/nfs/dbraw/zinc/27/87/58/1359278758.db2.gz	SYYQDVJLXJQWSD-GOSISDBHSA-N	0	3	341.499	3.409	20	30		EGEDHN
CCCC(=O)N1CC[C@@H](C)C[C@H]1CNCc1cc(C#N)ccc1OC	ZINC001087110355	1359289664	/nfs/dbraw/zinc/28/96/64/1359289664.db2.gz	IIJSDFYXOBIGJO-QAPCUYQASA-N	0	3	343.471	3.084	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccc(C#N)s1	ZINC001087200432	1359318289	/nfs/dbraw/zinc/31/82/89/1359318289.db2.gz	WXPBHUNKJOUWAL-DVOMOZLQSA-N	0	3	337.464	3.085	20	30		EGEDHN
CCC(=O)N[C@@H]1[C@H]2CCCN(Cc3ccc(C#N)cc3)[C@@H]2C1(C)C	ZINC001087262610	1359331908	/nfs/dbraw/zinc/33/19/08/1359331908.db2.gz	GAHXCIADGHXGTG-QRQLOZEOSA-N	0	3	325.456	3.073	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(C)c(F)cc3F)C(C)(C)[C@H]21	ZINC001087291207	1359370205	/nfs/dbraw/zinc/37/02/05/1359370205.db2.gz	QIOMZNCPWMLDLO-XWIAVFTESA-N	0	3	346.421	3.125	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3nc(C)sc3C)C(C)(C)[C@H]21	ZINC001087291342	1359370320	/nfs/dbraw/zinc/37/03/20/1359370320.db2.gz	SIJJDDIURIJKLM-OIISXLGYSA-N	0	3	345.512	3.002	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc4ccsc4[nH]3)C(C)(C)[C@H]21	ZINC001087296784	1359377873	/nfs/dbraw/zinc/37/78/73/1359377873.db2.gz	FWQHEYPXLBWXKP-BMFZPTHFSA-N	0	3	341.480	3.081	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc(C)cc(F)c3)C(C)(C)[C@H]21	ZINC001087304495	1359388302	/nfs/dbraw/zinc/38/83/02/1359388302.db2.gz	CPJRWFZSYIBJJY-QYZOEREBSA-N	0	3	342.458	3.376	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc[nH]c1C1CCC1	ZINC001087305566	1359390894	/nfs/dbraw/zinc/39/08/94/1359390894.db2.gz	VLBDJMLWZIEJIJ-NZSAHSFTSA-N	0	3	339.483	3.134	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)C1CCC(F)(F)CC1	ZINC001087305598	1359391140	/nfs/dbraw/zinc/39/11/40/1359391140.db2.gz	VVJWIWSPSLLUIN-OWCLPIDISA-N	0	3	338.442	3.050	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc4c3ccn4C)C(C)(C)[C@H]21	ZINC001087309047	1359396738	/nfs/dbraw/zinc/39/67/38/1359396738.db2.gz	ZOTHSXBCNFPYKK-RLLQIKCJSA-N	0	3	349.478	3.030	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc4ccncc4c3)C(C)(C)[C@H]21	ZINC001087312146	1359400151	/nfs/dbraw/zinc/40/01/51/1359400151.db2.gz	ZTUAEUOTCMVQRT-AABGKKOBSA-N	0	3	347.462	3.087	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)[C@H]3CC[C@H](C)CC3)C(C)(C)[C@@H]21	ZINC001087314154	1359402676	/nfs/dbraw/zinc/40/26/76/1359402676.db2.gz	GKKUSPITSYENAW-FVVUREQNSA-N	0	3	330.516	3.441	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(CC)c(CC)o3)C(C)(C)[C@@H]21	ZINC001087314479	1359403309	/nfs/dbraw/zinc/40/33/09/1359403309.db2.gz	LPUZHJYYKWRCDS-ATZDWAIDSA-N	0	3	342.483	3.256	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)[C@H]3CC[C@H](CC)CC3)C(C)(C)[C@H]21	ZINC001087314594	1359404310	/nfs/dbraw/zinc/40/43/10/1359404310.db2.gz	NRQDVVUNOGKIFI-QQXKLLMISA-N	0	3	330.516	3.441	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(C(F)F)o3)C(C)(C)[C@H]21	ZINC001087316418	1359406677	/nfs/dbraw/zinc/40/66/77/1359406677.db2.gz	RFOHYZFBAVZCIB-DFBGVHRSSA-N	0	3	336.382	3.069	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CN(CC)CC[C@@H]1c1ccccc1	ZINC001087429560	1359461557	/nfs/dbraw/zinc/46/15/57/1359461557.db2.gz	QETZVBJIBQLPJV-RTBURBONSA-N	0	3	337.467	3.282	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2coc3c2cccc3OC)[C@H]1CC	ZINC001087572887	1359537352	/nfs/dbraw/zinc/53/73/52/1359537352.db2.gz	KKBZNRFDXUPFME-JKSUJKDBSA-N	0	3	328.412	3.210	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)[C@H](C)C2CCC2)CCN1Cc1ccc(C#N)cc1	ZINC001087620245	1359557860	/nfs/dbraw/zinc/55/78/60/1359557860.db2.gz	XHWKZYHAQMLBLZ-UIAACRFSSA-N	0	3	339.483	3.464	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccncc2OC(C)C)[C@H]1CC	ZINC001087671179	1359581467	/nfs/dbraw/zinc/58/14/67/1359581467.db2.gz	SCXJSMMZQMJYJS-DLBZAZTESA-N	0	3	331.460	3.028	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)C[C@@H]2CCOc3ccccc32)[C@H]1CC	ZINC001087685876	1359588710	/nfs/dbraw/zinc/58/87/10/1359588710.db2.gz	CUEGECPKXWOFSX-RYQLBKOJSA-N	0	3	328.456	3.098	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2csc(-c3ccco3)n2)[C@H]1CC	ZINC001087704854	1359599678	/nfs/dbraw/zinc/59/96/78/1359599678.db2.gz	KWNDUAQSFXSMIK-DZGCQCFKSA-N	0	3	343.452	3.009	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2noc3c2CCCCC3)[C@H]1CC	ZINC001087744459	1359624088	/nfs/dbraw/zinc/62/40/88/1359624088.db2.gz	QXBHMXBQIVQAAE-JKSUJKDBSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cn(CCCC)nc2C)[C@H]1CC	ZINC001087790327	1359646593	/nfs/dbraw/zinc/64/65/93/1359646593.db2.gz	FWJMGDJHVHFVRE-ZWKOTPCHSA-N	0	3	332.492	3.150	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(F)c(F)cc2Cl)[C@H]1CC	ZINC001087817341	1359661923	/nfs/dbraw/zinc/66/19/23/1359661923.db2.gz	LALBCILHGRPUPO-LSDHHAIUSA-N	0	3	328.790	3.387	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)CCc3ccc(Cl)cc3)C[C@@H]2C1	ZINC001088056586	1359736600	/nfs/dbraw/zinc/73/66/00/1359736600.db2.gz	FIWBVCMMEQZJOE-MSOLQXFVSA-N	0	3	344.886	3.076	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CCN(Cc3oc(CC)nc3C)C[C@H]2C1	ZINC001088066951	1359741353	/nfs/dbraw/zinc/74/13/53/1359741353.db2.gz	HPNUROMUHVBHCK-CVEARBPZSA-N	0	3	345.487	3.038	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)C(C)(C)C3CCCCC3)C[C@@H]2C1	ZINC001088133343	1359769217	/nfs/dbraw/zinc/76/92/17/1359769217.db2.gz	CGUFYOFFQNVASH-MSOLQXFVSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)CC(C)(C)C3CCCCC3)C[C@@H]2C1	ZINC001088170522	1359779574	/nfs/dbraw/zinc/77/95/74/1359779574.db2.gz	UYDFJNQDSDWNRE-MSOLQXFVSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3ccc(-c4cccs4)o3)C[C@@H]2C1	ZINC001088187470	1359786895	/nfs/dbraw/zinc/78/68/95/1359786895.db2.gz	ZRSMREJIOQZCRD-CABCVRRESA-N	0	3	340.448	3.035	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3c[nH]cc3-c3ccccc3)C[C@@H]2C1	ZINC001088200390	1359792134	/nfs/dbraw/zinc/79/21/34/1359792134.db2.gz	BPGSZQINMFOXQW-MOPGFXCFSA-N	0	3	347.462	3.099	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)[C@@H](CC)c3ccc(Cl)cc3)C[C@@H]2C1	ZINC001088210161	1359796428	/nfs/dbraw/zinc/79/64/28/1359796428.db2.gz	ZIEKNRYXRLADGQ-AOIWGVFYSA-N	0	3	344.886	3.247	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCCCC[C@@H](NCc3ccccn3)C2)cc1	ZINC001088358186	1359841521	/nfs/dbraw/zinc/84/15/21/1359841521.db2.gz	WFBCNGJBQPBVOI-OAQYLSRUSA-N	0	3	347.462	3.238	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2ncoc2C2CC2)C1	ZINC001088409557	1359880538	/nfs/dbraw/zinc/88/05/38/1359880538.db2.gz	MLTXCCXNLAQBMG-AWEZNQCLSA-N	0	3	337.851	3.279	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2csc3cc(C)ccc23)[C@H]1C	ZINC001088592919	1359985806	/nfs/dbraw/zinc/98/58/06/1359985806.db2.gz	GCTHYKOIXKGHRW-PBHICJAKSA-N	0	3	326.465	3.426	20	30		EGEDHN
C=C(C)CCN1CC[C@H](NC(=O)c2scnc2C(F)(F)F)[C@H]1C	ZINC001088629959	1359997442	/nfs/dbraw/zinc/99/74/42/1359997442.db2.gz	BRLQXKMFQHZSEE-MNOVXSKESA-N	0	3	347.406	3.321	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CCN(Cc3cccc(CC)c3)[C@@H]2C)c1	ZINC001088846246	1360079843	/nfs/dbraw/zinc/07/98/43/1360079843.db2.gz	DDTVRDHZLFMZPR-IERDGZPVSA-N	0	3	347.462	3.018	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2c[nH]c3c2cccc3CC)[C@H]1C	ZINC001089061404	1360152936	/nfs/dbraw/zinc/15/29/36/1360152936.db2.gz	QUUYUVMWNYJNBX-KDOFPFPSSA-N	0	3	325.456	3.499	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCCN1C(=O)C(C)(F)F	ZINC001089101593	1360167264	/nfs/dbraw/zinc/16/72/64/1360167264.db2.gz	BWPJFRJYIRZFRQ-INIZCTEOSA-N	0	3	335.398	3.026	20	30		EGEDHN
CC(C)=CC(=O)N1CCCC[C@H]1CN(C)Cc1ccc(C#N)cc1	ZINC001089108288	1360172349	/nfs/dbraw/zinc/17/23/49/1360172349.db2.gz	HOOCMZPOHDJJCA-IBGZPJMESA-N	0	3	325.456	3.337	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@H](CNCc2c(F)cccc2F)[C@@H](C)C1	ZINC001184356035	1387439147	/nfs/dbraw/zinc/43/91/47/1387439147.db2.gz	GSYOVEXOGFYXDA-JKSUJKDBSA-N	0	3	348.437	3.198	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCCN1C(=O)C1=CCCC1	ZINC001089156905	1360212850	/nfs/dbraw/zinc/21/28/50/1360212850.db2.gz	UQDJZENFYXEQLW-FQEVSTJZSA-N	0	3	337.467	3.481	20	30		EGEDHN
N#CCCCCNC(=O)[C@@H]1CCCN(Cc2ccc(Cl)cc2)C1	ZINC001184406332	1387450099	/nfs/dbraw/zinc/45/00/99/1387450099.db2.gz	OKBBGDYQSAFCRC-MRXNPFEDSA-N	0	3	333.863	3.362	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2coc(C(C)(C)C)n2)CC(C)(C)C1	ZINC001089384062	1360385293	/nfs/dbraw/zinc/38/52/93/1360385293.db2.gz	NJZDDZRJSBEOCJ-HNNXBMFYSA-N	0	3	345.487	3.216	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc(C)c(OC)c(C)c2)CC(C)(C)C1	ZINC001089392450	1360393113	/nfs/dbraw/zinc/39/31/13/1360393113.db2.gz	UJBDLWLRJUVQKE-GOSISDBHSA-N	0	3	342.483	3.166	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2ccc(C)c(Cl)c2)CC(C)(C)C1	ZINC001089416682	1360410784	/nfs/dbraw/zinc/41/07/84/1360410784.db2.gz	OGDNGMXMAQWMQI-QGZVFWFLSA-N	0	3	346.902	3.431	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(Cl)cc2F)CC(C)(C)C1	ZINC001089432794	1360424320	/nfs/dbraw/zinc/42/43/20/1360424320.db2.gz	DQLUYDZHDLPDHF-AWEZNQCLSA-N	0	3	336.838	3.333	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccccc2CCC)CC(C)(C)C1	ZINC001089434967	1360426149	/nfs/dbraw/zinc/42/61/49/1360426149.db2.gz	AKGPNTDWXZURLM-SFHVURJKSA-N	0	3	326.484	3.493	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C(C)(C)C)on2)CC(C)(C)C1	ZINC001089438114	1360428627	/nfs/dbraw/zinc/42/86/27/1360428627.db2.gz	GWCYBHFIPLPXEP-HNNXBMFYSA-N	0	3	345.487	3.216	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(C)c3cccnc23)CC(C)(C)C1	ZINC001089439887	1360430195	/nfs/dbraw/zinc/43/01/95/1360430195.db2.gz	KCSSJRQZUQWSEG-KRWDZBQOSA-N	0	3	349.478	3.397	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2cccc3cccnc32)CC(C)(C)C1	ZINC001089452558	1360440114	/nfs/dbraw/zinc/44/01/14/1360440114.db2.gz	DBZRQHPTEYMVMB-LJQANCHMSA-N	0	3	349.478	3.017	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)N[C@@H]1CCN(Cc2ccc(C#N)s2)CC(C)(C)C1	ZINC001089464729	1360449569	/nfs/dbraw/zinc/44/95/69/1360449569.db2.gz	KFTIGDGRABDRRZ-CKEIUWERSA-N	0	3	345.512	3.383	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3conc3C)CC(C)(C)C2)C1	ZINC001089485946	1360465962	/nfs/dbraw/zinc/46/59/62/1360465962.db2.gz	RIUHACBLLXURCC-KRWDZBQOSA-N	0	3	345.487	3.446	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CCN(C[C@@H](F)CC)CC(C)(C)C2)c1	ZINC001089487159	1360467742	/nfs/dbraw/zinc/46/77/42/1360467742.db2.gz	IOGKIVWOSWYYCH-ZWKOTPCHSA-N	0	3	345.462	3.031	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2sc(C)cc2OC)CC(C)(C)C1	ZINC001089510005	1360481698	/nfs/dbraw/zinc/48/16/98/1360481698.db2.gz	MFOJKMUSUZZKCA-OAHLLOKOSA-N	0	3	348.512	3.309	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C23CCC(CC2)C3(C)C)CC(C)(C)C1	ZINC001089511659	1360483548	/nfs/dbraw/zinc/48/35/48/1360483548.db2.gz	UWJJEOQATXEUKE-BATSVXPKSA-N	0	3	330.516	3.443	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2oc(C3CC3)nc2C)CC(C)(C)C1	ZINC001089514380	1360485191	/nfs/dbraw/zinc/48/51/91/1360485191.db2.gz	LGERLWVPHXISFT-INIZCTEOSA-N	0	3	343.471	3.104	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cnoc2C(C)C)CC(C)(C)C1	ZINC001089534426	1360494553	/nfs/dbraw/zinc/49/45/53/1360494553.db2.gz	SRPPZLYEGHOGCX-OAHLLOKOSA-N	0	3	331.460	3.042	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cccc(C(F)F)c2)CC(C)(C)C1	ZINC001089538307	1360496692	/nfs/dbraw/zinc/49/66/92/1360496692.db2.gz	AQHFVUYGAUXBAX-MRXNPFEDSA-N	0	3	334.410	3.478	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cnc(CC(C)C)[nH]1	ZINC001089641835	1360554401	/nfs/dbraw/zinc/55/44/01/1360554401.db2.gz	UWXSAUKUZRVHNJ-MRXNPFEDSA-N	0	3	346.519	3.405	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1c(F)cccc1OC	ZINC001089642548	1360555083	/nfs/dbraw/zinc/55/50/83/1360555083.db2.gz	MYWKKMFNCHGCCS-OAHLLOKOSA-N	0	3	346.446	3.078	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccnn1[C@@H](C)CC	ZINC001089647097	1360560227	/nfs/dbraw/zinc/56/02/27/1360560227.db2.gz	SCSRYANLTDKBOM-IRXDYDNUSA-N	0	3	344.503	3.098	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1conc1C(C)C	ZINC001089649143	1360561500	/nfs/dbraw/zinc/56/15/00/1360561500.db2.gz	BZUBRXQQULKXER-OAHLLOKOSA-N	0	3	331.460	3.042	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(C(F)F)nc1	ZINC001089649109	1360562039	/nfs/dbraw/zinc/56/20/39/1360562039.db2.gz	AXGHPWVUTYKVQZ-OAHLLOKOSA-N	0	3	349.425	3.263	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cccn2nccc12	ZINC001089664463	1360575215	/nfs/dbraw/zinc/57/52/15/1360575215.db2.gz	LVMPNQAJDFKMCZ-INIZCTEOSA-N	0	3	340.471	3.131	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H]1CCCc2cccnc21	ZINC001089684928	1360590786	/nfs/dbraw/zinc/59/07/86/1360590786.db2.gz	VUTPPSWXTUEFKZ-QZTJIDSGSA-N	0	3	341.499	3.294	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)[C@H]1CCCc2cccnc21	ZINC001089684929	1360590800	/nfs/dbraw/zinc/59/08/00/1360590800.db2.gz	VUTPPSWXTUEFKZ-ROUUACIJSA-N	0	3	341.499	3.294	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cccc(OC)c1C	ZINC001089702829	1360605463	/nfs/dbraw/zinc/60/54/63/1360605463.db2.gz	DQIRZJLIHBEHNM-KRWDZBQOSA-N	0	3	342.483	3.247	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cccc(OC)c1F	ZINC001089716670	1360618145	/nfs/dbraw/zinc/61/81/45/1360618145.db2.gz	OGJYISIVLPRFHD-HNNXBMFYSA-N	0	3	346.446	3.078	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cnn(CC)c1C	ZINC001089716780	1360618155	/nfs/dbraw/zinc/61/81/55/1360618155.db2.gz	RIKCHIPPOJHDMG-INIZCTEOSA-N	0	3	332.492	3.008	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(OCC)cc1	ZINC001089729248	1360631739	/nfs/dbraw/zinc/63/17/39/1360631739.db2.gz	IRIRWASPKQVMQV-QGZVFWFLSA-N	0	3	330.472	3.492	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(COC)cc1	ZINC001089731203	1360634920	/nfs/dbraw/zinc/63/49/20/1360634920.db2.gz	NAPZXYRAOZXWLX-GOSISDBHSA-N	0	3	330.472	3.239	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1c[nH]nc1-c1ccco1	ZINC001089735678	1360640392	/nfs/dbraw/zinc/64/03/92/1360640392.db2.gz	OEIIHULHVOIEFI-AWEZNQCLSA-N	0	3	342.443	3.076	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1occc1C	ZINC001089774062	1360658737	/nfs/dbraw/zinc/65/87/37/1360658737.db2.gz	SSUKSJNDXYYDSW-JJXSEGSLSA-N	0	3	334.847	3.123	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C(C)=C1CCC1	ZINC001089805751	1360671415	/nfs/dbraw/zinc/67/14/15/1360671415.db2.gz	LGPIKTJCJBVTDP-MHORFTMASA-N	0	3	334.891	3.408	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1(C2CC2)CC1	ZINC001089824495	1360681421	/nfs/dbraw/zinc/68/14/21/1360681421.db2.gz	OPVUSNJEPBKNOD-ORQFMDKSSA-N	0	3	334.891	3.098	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)C2=CCCCCC2)CC2(CCOCC2)C1	ZINC001089935303	1360751775	/nfs/dbraw/zinc/75/17/75/1360751775.db2.gz	USCZNNSLFYDXOT-SFHVURJKSA-N	0	3	332.488	3.050	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)[C@@H]2CCCC23CC3)CC2(CCOCC2)C1	ZINC001089943877	1360756714	/nfs/dbraw/zinc/75/67/14/1360756714.db2.gz	VJZMVDHKWRRDQT-MSOLQXFVSA-N	0	3	346.515	3.130	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)[C@@H]2CCC(C)(C)C2)CC2(CCOCC2)C1	ZINC001089956961	1360765346	/nfs/dbraw/zinc/76/53/46/1360765346.db2.gz	PKYYCKKJFBCNLH-QZTJIDSGSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)[C@@H]2CCCCC2(C)C)CC2(CCOCC2)C1	ZINC001089969311	1360772384	/nfs/dbraw/zinc/77/23/84/1360772384.db2.gz	IDLXICLVGTTXMB-ROUUACIJSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(C)CN1CC[C@@H](NC(=O)c2ccccc2CC(C)(C)C)[C@@H](O)C1	ZINC001090347314	1360894008	/nfs/dbraw/zinc/89/40/08/1360894008.db2.gz	POKHQRXARNSICG-MOPGFXCFSA-N	0	3	344.499	3.016	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc(F)c(C)cc2F)C1	ZINC001091083286	1360989237	/nfs/dbraw/zinc/98/92/37/1360989237.db2.gz	CSPNYRNDZIQWHI-UHFFFAOYSA-N	0	3	328.790	3.124	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc3cc(F)ccc3[nH]2)C1	ZINC001091171494	1361000456	/nfs/dbraw/zinc/00/04/56/1361000456.db2.gz	AXZQAFXZCKDMFU-UHFFFAOYSA-N	0	3	335.810	3.158	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2sccc2-n2cccc2)C1	ZINC001091172177	1361000471	/nfs/dbraw/zinc/00/04/71/1361000471.db2.gz	YCUREOAZMQWJCS-UHFFFAOYSA-N	0	3	349.887	3.389	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc3cccc(OC)c3o2)C1	ZINC001091208139	1361008164	/nfs/dbraw/zinc/00/81/64/1361008164.db2.gz	JHQUOOKQPCHSTK-UHFFFAOYSA-N	0	3	348.830	3.292	20	30		EGEDHN
C=C1CCC(C(=O)NCC2CC(N[C@@H](C)c3cnc(C)cn3)C2)CC1	ZINC001091215930	1361010258	/nfs/dbraw/zinc/01/02/58/1361010258.db2.gz	PQSVPNFGYXKLLH-HJOIGYKYSA-N	0	3	342.487	3.077	20	30		EGEDHN
C[C@@H](c1ccccc1F)N1C[C@@H]2CN(C(=O)C#CC3CC3)C[C@]2(C)C1	ZINC001091656097	1361170754	/nfs/dbraw/zinc/17/07/54/1361170754.db2.gz	TVARVQLNKYFDBR-XPIZARPCSA-N	0	3	340.442	3.080	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc4sccc4s3)C[C@]2(C)C1	ZINC001091787318	1361220435	/nfs/dbraw/zinc/22/04/35/1361220435.db2.gz	WRXRIVAZPZXSPT-ACJLOTCBSA-N	0	3	344.505	3.380	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CN(Cc3c(C)noc3CC)C[C@@]2(C)C1	ZINC001091918330	1361248696	/nfs/dbraw/zinc/24/86/96/1361248696.db2.gz	JLKKDACWANZCBU-QRWLVFNGSA-N	0	3	345.487	3.038	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CN(Cc4ccc(C#N)cc4)C[C@@]3(C)C2)C1	ZINC001091996453	1361269813	/nfs/dbraw/zinc/26/98/13/1361269813.db2.gz	WLKXEZPUMHNKIZ-KNQAVFIVSA-N	0	3	349.478	3.195	20	30		EGEDHN
C[C@@]12CN(Cc3cccc(C#N)c3)C[C@@H]1CN(C(=O)C1CC3(CC3)C1)C2	ZINC001092001250	1361271762	/nfs/dbraw/zinc/27/17/62/1361271762.db2.gz	SHCFGGHBYKFCFM-CTNGQTDRSA-N	0	3	349.478	3.029	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C[C@H](C)c3ccccc3C)C[C@]2(C)C1	ZINC001092069001	1361287660	/nfs/dbraw/zinc/28/76/60/1361287660.db2.gz	DPVKUEQLSSFSLH-JQVVWYNYSA-N	0	3	338.495	3.292	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@H]3CC[C@H](C(C)C)CC3)C[C@]2(C)C1	ZINC001092134062	1361312426	/nfs/dbraw/zinc/31/24/26/1361312426.db2.gz	TWIHLEJZWXAXPV-XCJLJZCSSA-N	0	3	330.516	3.252	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccccc3C3CCC3)C[C@]2(C)C1	ZINC001092237946	1361335867	/nfs/dbraw/zinc/33/58/67/1361335867.db2.gz	GYUSLALIMVDDHX-GCJKJVERSA-N	0	3	336.479	3.371	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3ccc(C(C)(C)C)s3)C[C@]2(C)C1	ZINC001092294068	1361356497	/nfs/dbraw/zinc/35/64/97/1361356497.db2.gz	IPDXGUXDUDPRCP-KUHUBIRLSA-N	0	3	330.497	3.073	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@H](CC)c3ccc(F)cc3)C[C@]2(C)C1	ZINC001092308161	1361360907	/nfs/dbraw/zinc/36/09/07/1361360907.db2.gz	FZJLNLDORKHUJD-QFUCXCTJSA-N	0	3	342.458	3.123	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NC[C@@H]1CN(C/C=C\Cl)C[C@H]1C	ZINC001092740753	1361450754	/nfs/dbraw/zinc/45/07/54/1361450754.db2.gz	RCLIWFHYALQZFH-PDTSHOSPSA-N	0	3	348.874	3.302	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)CC2CCCC2)CC1	ZINC001093353033	1361566783	/nfs/dbraw/zinc/56/67/83/1361566783.db2.gz	PKBLSXKFOGPLBA-HXUWFJFHSA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)c2cc(Cl)c[nH]2)CC1	ZINC001093353850	1361568171	/nfs/dbraw/zinc/56/81/71/1361568171.db2.gz	COMHBRFIIDMEFU-QGZVFWFLSA-N	0	3	345.874	3.008	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C(C)(C)C(C)C)CC1	ZINC001093371539	1361581211	/nfs/dbraw/zinc/58/12/11/1361581211.db2.gz	SUOIWNRRKZWUCD-SFHVURJKSA-N	0	3	330.516	3.395	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C2CCC(F)CC2)CC1	ZINC001093377523	1361587859	/nfs/dbraw/zinc/58/78/59/1361587859.db2.gz	UYFZSWTUWWMYPW-CTWPCTMYSA-N	0	3	346.490	3.241	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C2(F)CCCCC2)CC1	ZINC001093383195	1361594706	/nfs/dbraw/zinc/59/47/06/1361594706.db2.gz	IXBNKTWHDUIOOD-GOSISDBHSA-N	0	3	346.490	3.385	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3ccc4nccc(C)c4c3)CCC[C@@H]12	ZINC001094423798	1361795760	/nfs/dbraw/zinc/79/57/60/1361795760.db2.gz	AAQHWVXGLLKURE-IFMALSPDSA-N	0	3	347.462	3.151	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3ccc(C(C)C)nc3C)CCC[C@@H]12	ZINC001094511814	1361837456	/nfs/dbraw/zinc/83/74/56/1361837456.db2.gz	DHMBQQMNJWZOAF-TZIWHRDSSA-N	0	3	339.483	3.121	20	30		EGEDHN
O=C(NC[C@]12CCC[C@H]1N(CC#Cc1ccccc1)CC2)[C@H]1CC12CC2	ZINC001094522663	1361842923	/nfs/dbraw/zinc/84/29/23/1361842923.db2.gz	CDYUOTACTNENRN-TXTKFYIRSA-N	0	3	348.490	3.199	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3ccc4nc(C)ccc4c3)CCC[C@@H]12	ZINC001094542122	1361851494	/nfs/dbraw/zinc/85/14/94/1361851494.db2.gz	OAAGKSCLZWQSGU-IFMALSPDSA-N	0	3	347.462	3.151	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3ccc(C(C)(F)F)cc3)CCC[C@@H]12	ZINC001094592596	1361874895	/nfs/dbraw/zinc/87/48/95/1361874895.db2.gz	MLPJIPUTWKNWFN-YLJYHZDGSA-N	0	3	346.421	3.406	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1C[C@H]2C[C@@H](C1)N(C(=O)C1CC3(CC3)C1)C2	ZINC001095001279	1361985262	/nfs/dbraw/zinc/98/52/62/1361985262.db2.gz	TZALLORYIYTMIN-YSSFQJQWSA-N	0	3	349.478	3.218	20	30		EGEDHN
Cc1ccc(C)c(CN2[C@@H]3CC[C@H]2[C@@H](NC(=O)c2ccc(C#N)[nH]2)C3)c1	ZINC001095327283	1362103006	/nfs/dbraw/zinc/10/30/06/1362103006.db2.gz	DAEVSAOTVSEFFN-HOJAQTOUSA-N	0	3	348.450	3.039	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C1(c3cccc(OC)c3)CC1)C2	ZINC001096081352	1362374395	/nfs/dbraw/zinc/37/43/95/1362374395.db2.gz	BXLVQZGFLAIMFO-NEWSRXKRSA-N	0	3	340.467	3.024	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccccc1O[C@@H](C)CC)C2	ZINC001096083669	1362375690	/nfs/dbraw/zinc/37/56/90/1362375690.db2.gz	AIHCXFADNQGQNC-NBMJBFSESA-N	0	3	340.467	3.222	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc(Cl)cc(Cl)c1)C2	ZINC001096422582	1362503912	/nfs/dbraw/zinc/50/39/12/1362503912.db2.gz	ZOIIBYJPGUZRTK-PMPSAXMXSA-N	0	3	337.250	3.352	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@H]1CCc3ccccc3C1)C2	ZINC001096427410	1362506109	/nfs/dbraw/zinc/50/61/09/1362506109.db2.gz	JFRFHNXECAWFMH-CZGNIMDHSA-N	0	3	338.495	3.479	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](NCc2ccc(Cl)c(OC)c2)C1	ZINC001185036192	1387592976	/nfs/dbraw/zinc/59/29/76/1387592976.db2.gz	ZRACEBSPJAUBCJ-MRXNPFEDSA-N	0	3	348.874	3.233	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc(F)cc3ccncc31)C2	ZINC001097091508	1362839744	/nfs/dbraw/zinc/83/97/44/1362839744.db2.gz	PSZGRUHOXIHNBO-LZQZEXGQSA-N	0	3	339.414	3.285	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3CCc2ccccc2)cc1	ZINC001097626774	1363080153	/nfs/dbraw/zinc/08/01/53/1363080153.db2.gz	VINMUEGFXQKABD-VSKRKVRLSA-N	0	3	344.458	3.246	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3C[C@@H]2CC(C)(C)CO2)CC1	ZINC001097788845	1363121823	/nfs/dbraw/zinc/12/18/23/1363121823.db2.gz	LHUOCNAAPBBPTQ-HCXYKTFWSA-N	0	3	346.515	3.269	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cccnc1C(F)(F)F)C2	ZINC001097929112	1363169233	/nfs/dbraw/zinc/16/92/33/1363169233.db2.gz	ZNPPITNEBOGVIL-BNOWGMLFSA-N	0	3	339.361	3.012	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc(C(CC)CC)no1)C2	ZINC001097996053	1363192326	/nfs/dbraw/zinc/19/23/26/1363192326.db2.gz	RZUAWRWDIQEXQN-OIISXLGYSA-N	0	3	331.460	3.489	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc3cccnc3s1)C2	ZINC001098150602	1363236065	/nfs/dbraw/zinc/23/60/65/1363236065.db2.gz	CTEHKKTXDRLDSV-KFWWJZLASA-N	0	3	327.453	3.208	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](C)c1ccc(F)cc1F)C2	ZINC001098441280	1363326922	/nfs/dbraw/zinc/32/69/22/1363326922.db2.gz	IRWQPJDWVLWSDQ-GGBBIFEXSA-N	0	3	334.410	3.366	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1CCC3(CC3)CC1)C[C@@H](C)O2	ZINC001098614699	1363400062	/nfs/dbraw/zinc/40/00/62/1363400062.db2.gz	WZDXKOZNZYZBIB-QGZVFWFLSA-N	0	3	346.515	3.225	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H](C)c1ccsc1)C[C@H](C)O2	ZINC001098635225	1363409242	/nfs/dbraw/zinc/40/92/42/1363409242.db2.gz	FJAGJIHIQOPYIC-HOTGVXAUSA-N	0	3	348.512	3.120	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccc(C)cc1C)C[C@H](C)O2	ZINC001098660521	1363423336	/nfs/dbraw/zinc/42/33/36/1363423336.db2.gz	UUJCKWPPDUKNCR-SFHVURJKSA-N	0	3	342.483	3.185	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@]1(C)CC=C(C)CC1)C[C@@H](C)O2	ZINC001098660717	1363423991	/nfs/dbraw/zinc/42/39/91/1363423991.db2.gz	XARJRUOMCNTDEI-UYAOXDASSA-N	0	3	346.515	3.391	20	30		EGEDHN
C[C@H](C(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(C#N)cc1)C2)C1CC1	ZINC001098774792	1363463661	/nfs/dbraw/zinc/46/36/61/1363463661.db2.gz	JYJWTGIZFQYCKV-ZRCAFCQKSA-N	0	3	337.467	3.075	20	30		EGEDHN
C#CCCN1C[C@@H]2CCC[C@]2(NC(=O)c2scc(C)c2Cl)C1	ZINC001098854491	1363493464	/nfs/dbraw/zinc/49/34/64/1363493464.db2.gz	LIJIEQUAVXRONH-GUYCJALGSA-N	0	3	336.888	3.318	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)c1c(C)coc1C	ZINC001099038647	1363587830	/nfs/dbraw/zinc/58/78/30/1363587830.db2.gz	LKOLOSVRZVSCNP-KRWDZBQOSA-N	0	3	348.487	3.319	20	30		EGEDHN
C#CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(C)c3ccccc23)C1	ZINC001099053573	1363596910	/nfs/dbraw/zinc/59/69/10/1363596910.db2.gz	ZFZQMQJJYVZPPJ-JTSKRJEESA-N	0	3	332.447	3.366	20	30		EGEDHN
CC(C)(C)C#CC(=O)NC[C@@H]1CCC(C)(C)CN1CCOCC1CC1	ZINC001099070481	1363606842	/nfs/dbraw/zinc/60/68/42/1363606842.db2.gz	YJLIURJBSRCPGQ-SFHVURJKSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)C1C=CC=CC=C1	ZINC001099092687	1363618010	/nfs/dbraw/zinc/61/80/10/1363618010.db2.gz	IIWVAWAPVFJFPL-IBGZPJMESA-N	0	3	344.499	3.094	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)C1C=CC=CC=C1	ZINC001099092688	1363618423	/nfs/dbraw/zinc/61/84/23/1363618423.db2.gz	IIWVAWAPVFJFPL-LJQANCHMSA-N	0	3	344.499	3.094	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)C(C)(C)C1CC1	ZINC001099189013	1363681610	/nfs/dbraw/zinc/68/16/10/1363681610.db2.gz	NLZIPTIJKCLFNX-QGZVFWFLSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2c(C)cccc2C)C[C@H]1C(F)(F)F	ZINC001099312099	1363744491	/nfs/dbraw/zinc/74/44/91/1363744491.db2.gz	GPPXTRCYMTUYCK-ZIAGYGMSSA-N	0	3	326.362	3.082	20	30		EGEDHN
C=Cc1ccc(C(=O)N2C[C@@H](C(F)(F)F)[C@H](NCC(=C)C)C2)cc1	ZINC001099311426	1363745025	/nfs/dbraw/zinc/74/50/25/1363745025.db2.gz	XDOUBUJZOQXFFC-HZPDHXFCSA-N	0	3	338.373	3.498	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2ccc(F)cc2C)C[C@H]1C(F)(F)F	ZINC001099334668	1363756266	/nfs/dbraw/zinc/75/62/66/1363756266.db2.gz	YZTLWUPEIONNMV-HUUCEWRRSA-N	0	3	344.352	3.303	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)C(C)(C)C(C)(F)F)C[C@H]1C(F)(F)F	ZINC001099336957	1363757723	/nfs/dbraw/zinc/75/77/23/1363757723.db2.gz	AGPFLXLLFMFUMW-GHMZBOCLSA-N	0	3	342.352	3.223	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)CCCC#CC	ZINC001099513495	1363828323	/nfs/dbraw/zinc/82/83/23/1363828323.db2.gz	PXRMZHVCWCHXLC-MHORFTMASA-N	0	3	334.891	3.101	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)[C@@H](C)CCCC)CC2(CCOCC2)C1	ZINC001099579330	1363862426	/nfs/dbraw/zinc/86/24/26/1363862426.db2.gz	OZTRPCYXURWIBM-ZWKOTPCHSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CN(CC(=C)C)CC2(CCOCC2)C1	ZINC001099582861	1363864769	/nfs/dbraw/zinc/86/47/69/1363864769.db2.gz	CWBAIJYSZQXSAZ-KRWDZBQOSA-N	0	3	334.504	3.152	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C(CC)(CC)CC)CC2(CCOCC2)C1	ZINC001099595224	1363878376	/nfs/dbraw/zinc/87/83/76/1363878376.db2.gz	WAGDDFBYLJNNRF-SFHVURJKSA-N	0	3	348.531	3.213	20	30		EGEDHN
O=C(/C=C/C1CC1)NCC1CC(NCC#Cc2cccc(Cl)c2)C1	ZINC001100218973	1364046826	/nfs/dbraw/zinc/04/68/26/1364046826.db2.gz	NDGQSWYWLOCKRF-CMDGGOBGSA-N	0	3	342.870	3.142	20	30		EGEDHN
C[C@@H](C(=O)NCC1CC(NCC#Cc2cccc(Cl)c2)C1)C1CC1	ZINC001100225818	1364049959	/nfs/dbraw/zinc/04/99/59/1364049959.db2.gz	UECPMTAYACJNSL-ICXUMSERSA-N	0	3	344.886	3.222	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](CNCc2oc(C)nc2C)[C@H](C)C1	ZINC001185227240	1387656804	/nfs/dbraw/zinc/65/68/04/1387656804.db2.gz	WBDUZFRARYRQQA-PBHICJAKSA-N	0	3	347.503	3.468	20	30		EGEDHN
CCCC[C@@H](C)C(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100296536	1364071471	/nfs/dbraw/zinc/07/14/71/1364071471.db2.gz	HLFFAISYJVOLGS-PPDQVPDSSA-N	0	3	344.474	3.488	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)Cc2cccc3cnccc32)C1	ZINC001100446134	1364117501	/nfs/dbraw/zinc/11/75/01/1364117501.db2.gz	QTMPHGRGKZVJGS-UHFFFAOYSA-N	0	3	343.858	3.014	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)Cc2ccc3cnccc3c2)C1	ZINC001100503863	1364138819	/nfs/dbraw/zinc/13/88/19/1364138819.db2.gz	YZFMKJLNDOLYJF-UHFFFAOYSA-N	0	3	343.858	3.014	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)CCc2ccc3[nH]ccc3c2)C1	ZINC001100510760	1364140907	/nfs/dbraw/zinc/14/09/07/1364140907.db2.gz	XBFLZSPNHNPJIE-UHFFFAOYSA-N	0	3	345.874	3.337	20	30		EGEDHN
CCC1(C(=O)NCC2CC(NCc3ccc(C#N)cc3F)C2)CCC1	ZINC001100591924	1364178078	/nfs/dbraw/zinc/17/80/78/1364178078.db2.gz	WRWSQNCDMOXZMY-UHFFFAOYSA-N	0	3	343.446	3.262	20	30		EGEDHN
CCC1(C(=O)NCC2CC(NCc3cc(C#N)ccc3F)C2)CCC1	ZINC001100591546	1364178250	/nfs/dbraw/zinc/17/82/50/1364178250.db2.gz	DIFHKWFRKKIFAP-UHFFFAOYSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCC1CC(NCc2cnc(Cl)s2)C1	ZINC001100596333	1364180916	/nfs/dbraw/zinc/18/09/16/1364180916.db2.gz	PGXMUFJRYCQSGX-PNESKVBLSA-N	0	3	341.908	3.383	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H](CC)CC(F)(F)F)C1	ZINC001100877665	1364307806	/nfs/dbraw/zinc/30/78/06/1364307806.db2.gz	KSUNMLQYOXMOEE-CXQJBGSLSA-N	0	3	326.790	3.202	20	30		EGEDHN
CCCCCCCCC(=O)NCC1CC(NCc2ccnn2C)C1	ZINC001100906556	1364325268	/nfs/dbraw/zinc/32/52/68/1364325268.db2.gz	NGQHUBLHUYAPNS-UHFFFAOYSA-N	0	3	334.508	3.155	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)CCCc2cccs2)C1	ZINC001100957024	1364347280	/nfs/dbraw/zinc/34/72/80/1364347280.db2.gz	WDCZCMVALHYXOD-UHFFFAOYSA-N	0	3	326.893	3.308	20	30		EGEDHN
C=C[C@H](C(=O)NCC1CC(NCc2cncs2)C1)c1ccccc1	ZINC001101016965	1364375489	/nfs/dbraw/zinc/37/54/89/1364375489.db2.gz	NHDGRFNVXJKBSQ-PVARCSIZSA-N	0	3	341.480	3.097	20	30		EGEDHN
C=C(C)CN1CC[C@@H](Oc2ccnc(CNC(=O)C(C)(C)CC)c2)C1	ZINC001101096815	1364412432	/nfs/dbraw/zinc/41/24/32/1364412432.db2.gz	BWQLIYYLUGYKBB-GOSISDBHSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=CCN1CC[C@@H](Oc2ccnc(CNC(=O)C(C)(CC)CC)c2)C1	ZINC001101100257	1364413893	/nfs/dbraw/zinc/41/38/93/1364413893.db2.gz	TYGDNAJUTKDUAX-GOSISDBHSA-N	0	3	345.487	3.163	20	30		EGEDHN
CCCCCC(=O)N1C[C@H]2CN(Cc3ccc(C#N)cc3)C[C@@]2(C)C1	ZINC001101128982	1364423025	/nfs/dbraw/zinc/42/30/25/1364423025.db2.gz	UYZMDWZIXAFBCP-CTNGQTDRSA-N	0	3	339.483	3.419	20	30		EGEDHN
CCC[C@H](C)C(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@@]2(C)C1	ZINC001101181686	1364449460	/nfs/dbraw/zinc/44/94/60/1364449460.db2.gz	CADBFNXHHWXESX-SCWSEQNSSA-N	0	3	339.483	3.275	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@H]2CN(Cc3cccnc3C)C[C@@]2(C)C1	ZINC001101377648	1364535217	/nfs/dbraw/zinc/53/52/17/1364535217.db2.gz	FVZBPJOTYKCBCO-NQIIRXRSSA-N	0	3	341.499	3.273	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)[C@@H](CCC)CC3CCCC3)C[C@]2(C)C1	ZINC001101381495	1364538195	/nfs/dbraw/zinc/53/81/95/1364538195.db2.gz	SGXQDGKXGBVOTF-ZVDOUQERSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@@H](CCC)c3ccccc3)C[C@]2(C)C1	ZINC001101454193	1364570375	/nfs/dbraw/zinc/57/03/75/1364570375.db2.gz	HBVVQMRUWQSMNW-URVUXULASA-N	0	3	338.495	3.374	20	30		EGEDHN
C=CCCC(=O)NC[C@@H]1CN(CC#Cc2ccc(Cl)cc2)C[C@H]1C	ZINC001101805372	1364733098	/nfs/dbraw/zinc/73/30/98/1364733098.db2.gz	POHROAXTTPNKBN-SJLPKXTDSA-N	0	3	344.886	3.342	20	30		EGEDHN
C[C@@H]1CN(Cc2cccc(C(F)F)c2)C[C@H]1CNC(=O)C#CC1CC1	ZINC001101951476	1364788660	/nfs/dbraw/zinc/78/86/60/1364788660.db2.gz	RJNVCHIKEHRLLB-RDTXWAMCSA-N	0	3	346.421	3.222	20	30		EGEDHN
C[C@@H](c1ccc(Cl)cc1)N1C[C@@H](CNC(=O)C#CC2CC2)[C@H](C)C1	ZINC001101954193	1364789344	/nfs/dbraw/zinc/78/93/44/1364789344.db2.gz	VDYCGPUEVKXMTM-RVKKMQEKSA-N	0	3	344.886	3.499	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@@H]1CN(Cc2c(C)noc2C)C[C@H]1C	ZINC001102228996	1364946039	/nfs/dbraw/zinc/94/60/39/1364946039.db2.gz	QGOOEQMUHFFEEQ-CRAIPNDOSA-N	0	3	345.487	3.059	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CNC(=O)[C@]1(C)C=CCC1	ZINC001102247574	1364962591	/nfs/dbraw/zinc/96/25/91/1364962591.db2.gz	YHCPTMNCQNTBCH-SPYBWZPUSA-N	0	3	343.496	3.160	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@@H]1CN(Cc2oc(CC)nc2C)C[C@H]1C	ZINC001102261063	1364973672	/nfs/dbraw/zinc/97/36/72/1364973672.db2.gz	MMORKWOENUPGCS-BFYDXBDKSA-N	0	3	347.503	3.332	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1C	ZINC001102295538	1364988717	/nfs/dbraw/zinc/98/87/17/1364988717.db2.gz	ODDHVQTUMULPTQ-IEBWSBKVSA-N	0	3	342.458	3.218	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@@H]1CN(Cc2cc(C)ns2)C[C@H]1C	ZINC001102327454	1365003139	/nfs/dbraw/zinc/00/31/39/1365003139.db2.gz	VPILQXUMRSCBNO-SIIHOXLZSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@@H]1CN(Cc2oc(C)nc2C)C[C@H]1C	ZINC001102410118	1365043063	/nfs/dbraw/zinc/04/30/63/1365043063.db2.gz	LAKCQIGLDMMYKG-CZUORRHYSA-N	0	3	333.476	3.078	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H]2CN(Cc3cnoc3C)C[C@H]2C)CCCC1	ZINC001102621234	1365139720	/nfs/dbraw/zinc/13/97/20/1365139720.db2.gz	RADARAZFNMYKBM-NVXWUHKLSA-N	0	3	345.487	3.304	20	30		EGEDHN
C[C@@H]1CN(Cc2cc(C#N)ccc2F)C[C@H]1CCNC(=O)C1CCC1	ZINC001102632141	1365144721	/nfs/dbraw/zinc/14/47/21/1365144721.db2.gz	IYEDCRBRGZOCSH-RHSMWYFYSA-N	0	3	343.446	3.072	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CCNC(=O)CC1CCC1	ZINC001102824375	1365237958	/nfs/dbraw/zinc/23/79/58/1365237958.db2.gz	QQHRCXJZEJFADI-GDBMZVCRSA-N	0	3	345.512	3.384	20	30		EGEDHN
C#CCCCC(=O)NCC[C@@H]1CN(Cc2cccc(F)c2F)C[C@H]1C	ZINC001102917126	1365290905	/nfs/dbraw/zinc/29/09/05/1365290905.db2.gz	NTSYDTVGZBYTDN-HZPDHXFCSA-N	0	3	348.437	3.343	20	30		EGEDHN
CC#CCCCC(=O)NCC[C@@H]1CN([C@@H](C)c2ncc(C)o2)C[C@H]1C	ZINC001103339799	1365507156	/nfs/dbraw/zinc/50/71/56/1365507156.db2.gz	AREVSWKMTZHAPC-BPQIPLTHSA-N	0	3	345.487	3.312	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2ccc3c(c2)COC3)C1	ZINC001103525426	1365612530	/nfs/dbraw/zinc/61/25/30/1365612530.db2.gz	LIRUHLXLHXUICF-CZUORRHYSA-N	0	3	348.874	3.157	20	30		EGEDHN
C/C=C(\C)C(=O)N1C[C@@H](C)[C@H](CCNCc2cc(C#N)ccc2F)C1	ZINC001104054445	1365892200	/nfs/dbraw/zinc/89/22/00/1365892200.db2.gz	XQMZJGPWLCXOID-FZGIQDKVSA-N	0	3	343.446	3.238	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)[C@H](CCN[C@@H](C)c2cnc(C)cn2)C1	ZINC001104246888	1365967458	/nfs/dbraw/zinc/96/74/58/1365967458.db2.gz	LQGTVBOUCYKNGL-BPQIPLTHSA-N	0	3	344.503	3.277	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cc3c[nH]ccc-3n2)C[C@H]1C	ZINC001104352437	1365983175	/nfs/dbraw/zinc/98/31/75/1365983175.db2.gz	VYRKLUDPSLGFAG-TZMCWYRMSA-N	0	3	346.862	3.003	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2ccc(C)c(C)n2)C[C@H]1C	ZINC001104422382	1366018489	/nfs/dbraw/zinc/01/84/89/1366018489.db2.gz	ONXHXIKPUFKBQF-CZUORRHYSA-N	0	3	335.879	3.139	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)[C@H](CCN[C@H](C)c2cnc(C)cn2)C1	ZINC001104491888	1366046654	/nfs/dbraw/zinc/04/66/54/1366046654.db2.gz	GYARCPSQBQRNNU-DJIMGWMZSA-N	0	3	344.503	3.132	20	30		EGEDHN
C#CCCCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2cnc(C)o2)C1	ZINC001104495348	1366048571	/nfs/dbraw/zinc/04/85/71/1366048571.db2.gz	DXQGYHSKNQUUTC-SJLPKXTDSA-N	0	3	345.487	3.141	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@@H](C)[C@H](CCNCc2conc2C)C1	ZINC001104563358	1366078289	/nfs/dbraw/zinc/07/82/89/1366078289.db2.gz	MDNGDWOPSMDWLQ-DJIMGWMZSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)[C@H]2Cc3ccccc32)C[C@H]1C	ZINC001104605778	1366098895	/nfs/dbraw/zinc/09/88/95/1366098895.db2.gz	SFONLJWSPPGUGU-QBIMZIAESA-N	0	3	332.875	3.153	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H](C)[C@H](CCN[C@@H](C)c2cnccn2)C1	ZINC001104731564	1366149053	/nfs/dbraw/zinc/14/90/53/1366149053.db2.gz	OJGHAJXECFAPKS-IXDOHACOSA-N	0	3	344.503	3.214	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2coc(CCC)n2)C[C@H]1C	ZINC001104904767	1366217485	/nfs/dbraw/zinc/21/74/85/1366217485.db2.gz	KCAVWSOLNGXKFC-TZMCWYRMSA-N	0	3	339.867	3.067	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2sccc2OC)C[C@H]1C	ZINC001104936141	1366230805	/nfs/dbraw/zinc/23/08/05/1366230805.db2.gz	GBSIQQLOGFBNJO-DGCLKSJQSA-N	0	3	342.892	3.197	20	30		EGEDHN
C=C(C)CCC(=O)N1CC(n2cc(CNCCCCCCC)nn2)C1	ZINC001105254310	1366391458	/nfs/dbraw/zinc/39/14/58/1366391458.db2.gz	UARCITSMYMGDOM-UHFFFAOYSA-N	0	3	347.507	3.078	20	30		EGEDHN
CC[C@@H](F)CN1CC2(CCC2)[C@H]1C1CCN(C(=O)C#CC(C)C)CC1	ZINC001105392056	1366440374	/nfs/dbraw/zinc/44/03/74/1366440374.db2.gz	RJYDARZPOFBPSN-UYAOXDASSA-N	0	3	348.506	3.487	20	30		EGEDHN
C=CCCCCCNCc1cn([C@@H]2CCCN(C(=O)CCC)C2)nn1	ZINC001185842301	1387813006	/nfs/dbraw/zinc/81/30/06/1387813006.db2.gz	GLJOKNFFVREIOM-GOSISDBHSA-N	0	3	347.507	3.078	20	30		EGEDHN
C=CCCCCC[NH2+]C[C@@H]1CN(C(=O)c2ccccc2[O-])C[C@H]1C	ZINC001105838030	1366594076	/nfs/dbraw/zinc/59/40/76/1366594076.db2.gz	PYWRVWOLQYYOJG-IAGOWNOFSA-N	0	3	330.472	3.436	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](CNCc3cscn3)[C@H](C)C2)CCCC1	ZINC001107100538	1366874851	/nfs/dbraw/zinc/87/48/51/1366874851.db2.gz	ZYMUDCQLVBLBHK-HZPDHXFCSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=CCCC(=O)NC[C@]12CCC[C@H]1N(Cc1oc(CC)nc1C)CC2	ZINC001107327017	1366929084	/nfs/dbraw/zinc/92/90/84/1366929084.db2.gz	ODFXZQOYWLPVBM-YLJYHZDGSA-N	0	3	345.487	3.372	20	30		EGEDHN
C=CCOCC(=O)N1CC[C@@H](N(C)Cc2cc3ccccc3s2)C1	ZINC001189381006	1367007476	/nfs/dbraw/zinc/00/74/76/1367007476.db2.gz	UQWYZUHIJGEFJB-MRXNPFEDSA-N	0	3	344.480	3.137	20	30		EGEDHN
CC[C@H](F)C(=O)NC[C@]12CCC[C@H]1N(CC#Cc1ccccc1)CC2	ZINC001107508106	1367008140	/nfs/dbraw/zinc/00/81/40/1367008140.db2.gz	WEGOKEXKTYALQK-QKNQBKEWSA-N	0	3	342.458	3.147	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@]12CCC[C@H]1N(Cc1ocnc1C)CC2	ZINC001107515010	1367014379	/nfs/dbraw/zinc/01/43/79/1367014379.db2.gz	HAYHLTBQPQJLJN-ILZDJORESA-N	0	3	345.487	3.446	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CC/C=C\c1ccccc1	ZINC001109248594	1367025128	/nfs/dbraw/zinc/02/51/28/1367025128.db2.gz	RXAVDHLIKWNPGY-YKKOSAOHSA-N	0	3	336.479	3.471	20	30		EGEDHN
CCC[C@H](C)C(=O)N1CC[C@H](N(C)Cc2ccc(OCC#N)cc2)C1	ZINC001189460340	1367028419	/nfs/dbraw/zinc/02/84/19/1367028419.db2.gz	LKASZWCKFXSCCL-WMZOPIPTSA-N	0	3	343.471	3.058	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@]12CCC[C@H]1N(Cc1cnoc1C)CC2	ZINC001107561061	1367044943	/nfs/dbraw/zinc/04/49/43/1367044943.db2.gz	BPRQTJVFCVTQHD-YLJYHZDGSA-N	0	3	345.487	3.446	20	30		EGEDHN
C=CCOCCCC(=O)N1CC[C@@H](N(C)Cc2ccc(C)c(F)c2)C1	ZINC001189573089	1367057245	/nfs/dbraw/zinc/05/72/45/1367057245.db2.gz	BGVUSNQEOGFBDG-GOSISDBHSA-N	0	3	348.462	3.150	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)c3cccc(C(C)C)c3)[C@@H]2C1	ZINC001189635114	1367073620	/nfs/dbraw/zinc/07/36/20/1367073620.db2.gz	PDRYLTKBSDCLIQ-VQTJNVASSA-N	0	3	342.483	3.159	20	30		EGEDHN
C=CCC[C@@H](C)N1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1snnc1C1CC1)C2	ZINC001109422917	1367114455	/nfs/dbraw/zinc/11/44/55/1367114455.db2.gz	PMBJJYBPRJYFJS-RZFFKMDDSA-N	0	3	346.500	3.105	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1c(C)noc1C(F)F)C2	ZINC001109437974	1367120137	/nfs/dbraw/zinc/12/01/37/1367120137.db2.gz	VBGFGRQCMNWMMV-AGIUHOORSA-N	0	3	339.386	3.222	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@@H](N(C)[C@@H]2CCc3c2cc(F)cc3F)C1	ZINC001190045680	1367159735	/nfs/dbraw/zinc/15/97/35/1367159735.db2.gz	AQWJYUZQBIMQNV-DNVCBOLYSA-N	0	3	346.421	3.144	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@@H](N(C)Cc2ccc(C(F)F)cc2)C1	ZINC001190053444	1367161799	/nfs/dbraw/zinc/16/17/99/1367161799.db2.gz	ITLFOGZBIOBQCI-QGZVFWFLSA-N	0	3	334.410	3.316	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1c(C)noc1C1CC1)C2	ZINC001109531899	1367182224	/nfs/dbraw/zinc/18/22/24/1367182224.db2.gz	BEABLJOHMNCJNU-PMPSAXMXSA-N	0	3	329.444	3.162	20	30		EGEDHN
CC1CCC(CN2CCO[C@@](C)(CNC(=O)C#CC(C)(C)C)C2)CC1	ZINC001107934748	1367210463	/nfs/dbraw/zinc/21/04/63/1367210463.db2.gz	KTVXJYLAPDNPDS-NGICGMGXSA-N	0	3	348.531	3.069	20	30		EGEDHN
CC1CCC(CN2CCO[C@](C)(CNC(=O)C#CC(C)(C)C)C2)CC1	ZINC001107934749	1367210593	/nfs/dbraw/zinc/21/05/93/1367210593.db2.gz	KTVXJYLAPDNPDS-WIXQSORDSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)C(CC=C)CC=C)C1	ZINC001107965341	1367220816	/nfs/dbraw/zinc/22/08/16/1367220816.db2.gz	VUWWPUSXPPVNED-XLIONFOSSA-N	0	3	334.504	3.317	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001190329877	1367229017	/nfs/dbraw/zinc/22/90/17/1367229017.db2.gz	VMPQNORGTCOYBZ-FQEVSTJZSA-N	0	3	337.467	3.359	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001190353926	1367235908	/nfs/dbraw/zinc/23/59/08/1367235908.db2.gz	DSWDXXVNIMYADE-FQEVSTJZSA-N	0	3	337.467	3.359	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](N(C)Cc2ccccc2N(C)C)C1	ZINC001190423642	1367261541	/nfs/dbraw/zinc/26/15/41/1367261541.db2.gz	SEZWSZPCUCVFGO-GOSISDBHSA-N	0	3	329.488	3.142	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@H](N(C)Cc3cc(F)ccc3C)C2)CCC1	ZINC001190593748	1367301616	/nfs/dbraw/zinc/30/16/16/1367301616.db2.gz	DDOSACPAWYGIGH-IBGZPJMESA-N	0	3	342.458	3.360	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@@]1(C)CN(CC2CCCCC2)CCO1	ZINC001108150559	1367311441	/nfs/dbraw/zinc/31/14/41/1367311441.db2.gz	FAQRONCHPKRYEQ-XLIONFOSSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)[C@H]2CC[C@H](C3CCC3)CC2)C1	ZINC001190745170	1367340771	/nfs/dbraw/zinc/34/07/71/1367340771.db2.gz	VANGKIXYLUJZLS-VAMGGRTRSA-N	0	3	348.531	3.328	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2ccc(C)cc2F)C1	ZINC001108241029	1367356289	/nfs/dbraw/zinc/35/62/89/1367356289.db2.gz	UHOXKUFAINGZOQ-UZLBHIALSA-N	0	3	348.462	3.310	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCN(C(=O)CCC(C)(F)F)C1	ZINC001190980120	1367393521	/nfs/dbraw/zinc/39/35/21/1367393521.db2.gz	AEXAOLXBFGQLSM-INIZCTEOSA-N	0	3	335.398	3.026	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)C2CCC=CCC2)C1	ZINC001108402522	1367435178	/nfs/dbraw/zinc/43/51/78/1367435178.db2.gz	GXXPTYZGUOGXPV-YLJYHZDGSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@]2(C)CN(C[C@@H](C)CC)CCO2)CCCC1	ZINC001108444060	1367459716	/nfs/dbraw/zinc/45/97/16/1367459716.db2.gz	AEZHYIDSXNNVNW-HKUYNNGSSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@@H](C)c1ccc(OC)cc1)C2	ZINC001110133103	1367516187	/nfs/dbraw/zinc/51/61/87/1367516187.db2.gz	YLRZAORMMPSLGC-BEKAIBRUSA-N	0	3	342.483	3.486	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C1(C(F)(F)F)CCCCC1)C2	ZINC001110202887	1367562134	/nfs/dbraw/zinc/56/21/34/1367562134.db2.gz	YTZUXNYCRFSNPT-ILXRZTDVSA-N	0	3	342.405	3.244	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@@H](N(C)CCOc2ccccc2)C1	ZINC001191890700	1367627468	/nfs/dbraw/zinc/62/74/68/1367627468.db2.gz	UEMSCKYMYWLTTI-ZWKOTPCHSA-N	0	3	330.472	3.200	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@@H](N(C)Cc2ccc(OC)cc2)C1	ZINC001191913285	1367636479	/nfs/dbraw/zinc/63/64/79/1367636479.db2.gz	VRCGZSQLFDLLPN-FUHWJXTLSA-N	0	3	330.472	3.330	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](N(C)CCOc2cccc(F)c2)C1	ZINC001192058750	1367677356	/nfs/dbraw/zinc/67/73/56/1367677356.db2.gz	AFKKCXZLILQMRM-QGZVFWFLSA-N	0	3	334.435	3.094	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)CCCc2ccc(C)cc2)C1	ZINC001192152127	1367701762	/nfs/dbraw/zinc/70/17/62/1367701762.db2.gz	FPDJYWJYRRTNTB-FQEVSTJZSA-N	0	3	344.499	3.053	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](N(C)CCc3csc(C)n3)C2)CCC1	ZINC001192218522	1367721583	/nfs/dbraw/zinc/72/15/83/1367721583.db2.gz	RCRUMYWMOOHNIC-QGZVFWFLSA-N	0	3	347.528	3.273	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](N(C)CCOc3ccccc3F)C2)C1	ZINC001192255771	1367731250	/nfs/dbraw/zinc/73/12/50/1367731250.db2.gz	AQNJYUWPVXMWCO-INIZCTEOSA-N	0	3	346.446	3.094	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](N(C)CCOc3cccc(C)c3)C2)C1	ZINC001192257313	1367732822	/nfs/dbraw/zinc/73/28/22/1367732822.db2.gz	MKZDPJBBIBADJY-GOSISDBHSA-N	0	3	342.483	3.263	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCc1ccc2ccccc2c1	ZINC001109089147	1367761013	/nfs/dbraw/zinc/76/10/13/1367761013.db2.gz	YGIPADHRGBDDRS-IDCXYZFESA-N	0	3	347.462	3.263	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCc1ccc(Cl)cc1	ZINC001110538290	1367818466	/nfs/dbraw/zinc/81/84/66/1367818466.db2.gz	VVYOGRQRBPFROC-QRVBRYPASA-N	0	3	344.886	3.263	20	30		EGEDHN
Cc1ccccc1CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C#CC1CC1)C2	ZINC001110541619	1367820005	/nfs/dbraw/zinc/82/00/05/1367820005.db2.gz	SAXMCQYYXFNSRU-NJYVYQBISA-N	0	3	336.479	3.063	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](N(C)CCOCc2ccccc2)C1	ZINC001192578991	1367823246	/nfs/dbraw/zinc/82/32/46/1367823246.db2.gz	VLHDKAFIVRYTFH-LJQANCHMSA-N	0	3	344.499	3.338	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](N(C)Cc2ccccc2N(C)C)C1	ZINC001192586875	1367826246	/nfs/dbraw/zinc/82/62/46/1367826246.db2.gz	WLXYRPLKXJWDQO-SFHVURJKSA-N	0	3	343.515	3.388	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)C[C@H](C)c2ccccc2C)C1	ZINC001192640685	1367839970	/nfs/dbraw/zinc/83/99/70/1367839970.db2.gz	FEUCNWSRSJHQEJ-OALUTQOASA-N	0	3	344.499	3.224	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCc1ccccc1OCC)C2	ZINC001110776415	1367975933	/nfs/dbraw/zinc/97/59/33/1367975933.db2.gz	GJHCPOPVJDOLBC-QRVBRYPASA-N	0	3	342.483	3.316	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccccc1	ZINC001110863844	1368042509	/nfs/dbraw/zinc/04/25/09/1368042509.db2.gz	YASJEBDHEFZFGO-BNDYYXHWSA-N	0	3	342.483	3.137	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2c(C)csc2Cl)C1	ZINC001193704804	1368099495	/nfs/dbraw/zinc/09/94/95/1368099495.db2.gz	KBZSDCMEXGLFQK-CYBMUJFWSA-N	0	3	342.892	3.059	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCc1scnc1C	ZINC001110984342	1368132310	/nfs/dbraw/zinc/13/23/10/1368132310.db2.gz	DQZWVOAFBSSLFW-JEWRLFTDSA-N	0	3	347.528	3.318	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3C[C@H]2CCCCO2)CC1	ZINC001110987708	1368134533	/nfs/dbraw/zinc/13/45/33/1368134533.db2.gz	BHGXKUVIJLDHES-TVFCKZIOSA-N	0	3	332.488	3.023	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C1[C@@H]3CCCCCC[C@@H]13)C2	ZINC001111061725	1368150777	/nfs/dbraw/zinc/15/07/77/1368150777.db2.gz	JJLBFTHWHVNGRV-NNIGNNQHSA-N	0	3	346.515	3.127	20	30		EGEDHN
C=CCOC(=O)N(C)C[C@H]1CCCCN1Cc1ccc(OC)cc1	ZINC001194311559	1368229399	/nfs/dbraw/zinc/22/93/99/1368229399.db2.gz	RFEIBLDAFDAKAK-QGZVFWFLSA-N	0	3	332.444	3.304	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)[C@]2(C)CCC(C)=C(C)C2)C1	ZINC001194360393	1368243085	/nfs/dbraw/zinc/24/30/85/1368243085.db2.gz	ZOISNUGWSSVCEN-AZUAARDMSA-N	0	3	334.504	3.248	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@H](N(C)C[C@@H]3CCCCO3)C2)CCCCC1	ZINC001194367321	1368245360	/nfs/dbraw/zinc/24/53/60/1368245360.db2.gz	FAWUEXPWZSBRLK-OALUTQOASA-N	0	3	346.515	3.062	20	30		EGEDHN
C=CCCOCC(=O)N1CC[C@@H](N(C)[C@@H](C)c2ccc(F)cc2)C1	ZINC001194396592	1368251157	/nfs/dbraw/zinc/25/11/57/1368251157.db2.gz	GDFIMSIAAPOYOW-MAUKXSAKSA-N	0	3	334.435	3.012	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N1CC[C@H](N(C)Cc2cc3ccccc3o2)C1	ZINC001194397203	1368252439	/nfs/dbraw/zinc/25/24/39/1368252439.db2.gz	QONNYDUYXCJGBX-RDJZCZTQSA-N	0	3	342.439	3.057	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](C)c1ccc(C)cc1)C2	ZINC001111288938	1368254949	/nfs/dbraw/zinc/25/49/49/1368254949.db2.gz	ZYQHCAYRASODCM-AFYVEPGGSA-N	0	3	342.483	3.023	20	30		EGEDHN
C=CCCCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc(CC)on1)C2	ZINC001111293235	1368255601	/nfs/dbraw/zinc/25/56/01/1368255601.db2.gz	WZRODXPDCUSOCB-KYJSFNMBSA-N	0	3	331.460	3.319	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)c2ccccc2CCC)C1	ZINC001194557556	1368286335	/nfs/dbraw/zinc/28/63/35/1368286335.db2.gz	XJSFCLVLJQUYJG-WOJBJXKFSA-N	0	3	346.515	3.384	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](CC=C)Cc1ccccc1)C2	ZINC001111436697	1368306618	/nfs/dbraw/zinc/30/66/18/1368306618.db2.gz	UAJJACMIBYKOIP-NCYKPQTJSA-N	0	3	336.479	3.166	20	30		EGEDHN
C=C[C@@H](CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCOCC)c1ccccc1	ZINC001111441288	1368307931	/nfs/dbraw/zinc/30/79/31/1368307931.db2.gz	GUXJJTHDXUNGAU-NBYUQASBSA-N	0	3	342.483	3.104	20	30		EGEDHN
C=C[C@H](C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCOC(C)C)c1ccccc1	ZINC001111443398	1368309028	/nfs/dbraw/zinc/30/90/28/1368309028.db2.gz	JPEOWLFVZURQDJ-WCIQWLHISA-N	0	3	342.483	3.103	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccc(C)c(C)c1	ZINC001111490942	1368319743	/nfs/dbraw/zinc/31/97/43/1368319743.db2.gz	GZEXXLFCYMZWKE-AFYVEPGGSA-N	0	3	342.483	3.116	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)CCCCC(C)C)C[C@@H](C)O2	ZINC001111550611	1368342531	/nfs/dbraw/zinc/34/25/31/1368342531.db2.gz	FUCLRTWNGAGDQQ-GOSISDBHSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CCCN(Cc2ccccc2CC)CC1	ZINC001195173580	1368393705	/nfs/dbraw/zinc/39/37/05/1368393705.db2.gz	BZHDVYKYCAEVJU-SFHVURJKSA-N	0	3	344.499	3.265	20	30		EGEDHN
Cc1cccc(Cl)c1CN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H](C)C#N)C1	ZINC001111667035	1368416417	/nfs/dbraw/zinc/41/64/17/1368416417.db2.gz	RRNSXSXIARKSHJ-DOXZYTNZSA-N	0	3	345.874	3.279	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(C(F)F)cc1)C2	ZINC001111667068	1368417047	/nfs/dbraw/zinc/41/70/47/1368417047.db2.gz	SUCOZIRPZOEZAP-AZOIQLNYSA-N	0	3	347.409	3.255	20	30		EGEDHN
CC/C(C)=C\C(=O)N[C@]12CCC[C@H]1CN(Cc1cccc(C#N)c1)C2	ZINC001111734174	1368433803	/nfs/dbraw/zinc/43/38/03/1368433803.db2.gz	OERPQEMFGAKINM-MIRHKCCZSA-N	0	3	337.467	3.385	20	30		EGEDHN
CC/C(C)=C/C(=O)N[C@]12CCC[C@H]1CN(Cc1cccc(C#N)c1)C2	ZINC001111734175	1368434346	/nfs/dbraw/zinc/43/43/46/1368434346.db2.gz	OERPQEMFGAKINM-NRCMRAOMSA-N	0	3	337.467	3.385	20	30		EGEDHN
C#CCCCCC(=O)N1CCCN(Cc2ccccc2CC)CC1	ZINC001195540824	1368451572	/nfs/dbraw/zinc/45/15/72/1368451572.db2.gz	ILLVYYQRCFKTAP-UHFFFAOYSA-N	0	3	326.484	3.477	20	30		EGEDHN
C#CCCCCC(=O)N1CCCN(Cc2cccc3cccnc32)CC1	ZINC001195541278	1368451788	/nfs/dbraw/zinc/45/17/88/1368451788.db2.gz	QRTARTUGMWPGHA-UHFFFAOYSA-N	0	3	349.478	3.463	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@]12CCC[C@H]1CN(CCc1ccns1)C2	ZINC001111846969	1368501391	/nfs/dbraw/zinc/50/13/91/1368501391.db2.gz	GEEOXMUMYONMBJ-GJYPPUQNSA-N	0	3	347.528	3.259	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H](CC)Oc2ccccc2C)C1	ZINC001111885551	1368529253	/nfs/dbraw/zinc/52/92/53/1368529253.db2.gz	SHBMQVLTQSBJLY-UEXGIBASSA-N	0	3	342.483	3.309	20	30		EGEDHN
C=CCC[C@H](C)N1CCCN(C(=O)c2sc3nccn3c2C)CC1	ZINC001196184858	1368564198	/nfs/dbraw/zinc/56/41/98/1368564198.db2.gz	FCRKJMFRCKWGKB-AWEZNQCLSA-N	0	3	346.500	3.207	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCC[C@]2(NC(=O)c2sccc2CC)C1	ZINC001111997994	1368600776	/nfs/dbraw/zinc/60/07/76/1368600776.db2.gz	ZEEAVVVIJOUHGK-LPHOPBHVSA-N	0	3	348.512	3.097	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)C[C@@H](C)CC(C)(C)C)C1	ZINC001196392977	1368605188	/nfs/dbraw/zinc/60/51/88/1368605188.db2.gz	VXHMLCUBZIDCCX-KZNAEPCWSA-N	0	3	338.536	3.357	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)[C@H](F)Cc2ccccc2)C1	ZINC001112000993	1368605497	/nfs/dbraw/zinc/60/54/97/1368605497.db2.gz	CTPCXYONUZKNMI-NSHGMRRFSA-N	0	3	330.447	3.114	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2c[nH]nc2CCC)CC1	ZINC001196395792	1368606072	/nfs/dbraw/zinc/60/60/72/1368606072.db2.gz	WHVCFBMOQMGOSX-UHFFFAOYSA-N	0	3	334.508	3.481	20	30		EGEDHN
CC1(C)C[C@]1(NC[C@H](O)COc1ccccc1C#N)c1ccccc1	ZINC001196460468	1368620432	/nfs/dbraw/zinc/62/04/32/1368620432.db2.gz	ZMESSLMTIWRIFR-RXVVDRJESA-N	0	3	336.435	3.213	20	30		EGEDHN
C=CCC[C@@H](C)N1CCCN(C(=O)c2ncc(Cl)s2)CC1	ZINC001196493052	1368626828	/nfs/dbraw/zinc/62/68/28/1368626828.db2.gz	NYAJWEOESAHJFX-GFCCVEGCSA-N	0	3	327.881	3.299	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)CC(C)(C)CC(F)F)C[C@H]1C(F)(F)F	ZINC001112135871	1368675541	/nfs/dbraw/zinc/67/55/41/1368675541.db2.gz	VESLEQFLAAHFHW-GHMZBOCLSA-N	0	3	342.352	3.223	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](C(F)(F)F)[C@H](NCC(=C)C)C2)CCC1	ZINC001112162235	1368691070	/nfs/dbraw/zinc/69/10/70/1368691070.db2.gz	MIOKYDIIWQMBTD-ZIAGYGMSSA-N	0	3	330.394	3.288	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)[C@H](C)CC(C)(C)C)C[C@H]1C(F)(F)F	ZINC001112176201	1368702142	/nfs/dbraw/zinc/70/21/42/1368702142.db2.gz	TYXBTLYPMQPMCM-MGPQQGTHSA-N	0	3	332.410	3.061	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)[C@@H](CC)CC(C)C)C[C@H]1C(F)(F)F	ZINC001112191440	1368707185	/nfs/dbraw/zinc/70/71/85/1368707185.db2.gz	YWFOBCVNLXSEDX-RRFJBIMHSA-N	0	3	332.410	3.061	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)C[C@@H](C)CC(C)C)C[C@H]1C(F)(F)F	ZINC001112192377	1368707319	/nfs/dbraw/zinc/70/73/19/1368707319.db2.gz	WWBJMERIUPNICF-RRFJBIMHSA-N	0	3	332.410	3.061	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cnc3n2CCCC3)CC1	ZINC001196901578	1368711186	/nfs/dbraw/zinc/71/11/86/1368711186.db2.gz	POXHHQHPUGXCCE-UHFFFAOYSA-N	0	3	346.519	3.338	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2cnccc2C(F)(F)F)CC1	ZINC001197269166	1368775958	/nfs/dbraw/zinc/77/59/58/1368775958.db2.gz	GQOLTFZZUUEFAK-UHFFFAOYSA-N	0	3	341.377	3.215	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cccc(OC)n2)CC1	ZINC001197668911	1368869149	/nfs/dbraw/zinc/86/91/49/1368869149.db2.gz	HXVQYGFYURMPAQ-UHFFFAOYSA-N	0	3	333.476	3.209	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCCN(CCCCCCC)CC2)cn1	ZINC001197871618	1368917107	/nfs/dbraw/zinc/91/71/07/1368917107.db2.gz	UOTSPTHNRZXMFB-UHFFFAOYSA-N	0	3	327.472	3.181	20	30		EGEDHN
CCCCCCCC[C@@H](C)C(=O)N1CCCN(CCCO)CC1	ZINC001198198282	1368978889	/nfs/dbraw/zinc/97/88/89/1368978889.db2.gz	YPTCUZZDGZERBJ-GOSISDBHSA-N	0	3	326.525	3.290	20	30		EGEDHN
C=C[C@@H](CC(=O)N1CCCN(C[C@@H](CC)OC)CC1)c1ccccc1	ZINC001198214570	1368982399	/nfs/dbraw/zinc/98/23/99/1368982399.db2.gz	QXYMWPMGSGLFCR-AZUAARDMSA-N	0	3	344.499	3.306	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)c2ccc(C)c(C)c2)C1	ZINC001198304577	1369003259	/nfs/dbraw/zinc/00/32/59/1369003259.db2.gz	HVZBVLPVQVVWPK-RTBURBONSA-N	0	3	332.488	3.049	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)c1cccc(C)n1)c1ccccc1OC	ZINC001198542880	1369056944	/nfs/dbraw/zinc/05/69/44/1369056944.db2.gz	NZGWWWQMBUFTRF-SFHVURJKSA-N	0	3	339.439	3.035	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)[C@H](CC)OCC)c1ccccc1OC	ZINC001198584133	1369065830	/nfs/dbraw/zinc/06/58/30/1369065830.db2.gz	BGZQNAHDDVBYPO-ROUUACIJSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCOCC(=O)NC[C@H](NCCCCCC)c1ccccc1OC	ZINC001198607341	1369072236	/nfs/dbraw/zinc/07/22/36/1369072236.db2.gz	ZDKIJLVMBVEVQS-SFHVURJKSA-N	0	3	348.487	3.225	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)C(=O)C(C)(C)C)c1ccccc1OC	ZINC001198617131	1369074439	/nfs/dbraw/zinc/07/44/39/1369074439.db2.gz	MOXSKWBAXNBYIW-MRXNPFEDSA-N	0	3	346.471	3.024	20	30		EGEDHN
C=CCCCCCN[C@@H](CNC(=O)[C@@H](C)C#N)c1ccccc1OC	ZINC001198618009	1369075083	/nfs/dbraw/zinc/07/50/83/1369075083.db2.gz	VMBYEHVWCZAEEJ-WMZOPIPTSA-N	0	3	343.471	3.348	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)/C=C\C1CC1)c1ccccc1OC	ZINC001198637671	1369078985	/nfs/dbraw/zinc/07/89/85/1369078985.db2.gz	SHAOIVZROYARAL-SQVRQVGWSA-N	0	3	328.456	3.375	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)c1ncccc1C)c1ccccc1OC	ZINC001198647379	1369081778	/nfs/dbraw/zinc/08/17/78/1369081778.db2.gz	MWVYWCQAGFMDET-QGZVFWFLSA-N	0	3	339.439	3.035	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)CC[C@H](C)OC)c1ccccc1OC	ZINC001198677397	1369088782	/nfs/dbraw/zinc/08/87/82/1369088782.db2.gz	MVEFUBJGMFAXAP-WMZOPIPTSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)CC[C@H](C)OC)c1ccccc1OC	ZINC001198677393	1369088969	/nfs/dbraw/zinc/08/89/69/1369088969.db2.gz	MVEFUBJGMFAXAP-FUHWJXTLSA-N	0	3	348.487	3.223	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H](NCC1CC1)c1ccccc1OC	ZINC001198677181	1369089393	/nfs/dbraw/zinc/08/93/93/1369089393.db2.gz	JLGYTVTYYKAIGA-GOSISDBHSA-N	0	3	328.456	3.046	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)c1cc(C)sn1)c1ccccc1OC	ZINC001198694025	1369093159	/nfs/dbraw/zinc/09/31/59/1369093159.db2.gz	FHQLVOMHTOMGNW-INIZCTEOSA-N	0	3	345.468	3.097	20	30		EGEDHN
CC/C=C/CCN[C@@H](CNC(=O)C#CC(C)C)c1ccccc1OC	ZINC001198713070	1369096794	/nfs/dbraw/zinc/09/67/94/1369096794.db2.gz	LNZNOVNEHFNJOI-GHOSXJJBSA-N	0	3	342.483	3.458	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@H](OCC)C(C)C)c1ccccc1OC	ZINC001198724133	1369100630	/nfs/dbraw/zinc/10/06/30/1369100630.db2.gz	PXFXVWLJMIESFN-IEBWSBKVSA-N	0	3	348.487	3.079	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@@]1(C)C=CCC1)c1ccccc1OC	ZINC001198833530	1369124731	/nfs/dbraw/zinc/12/47/31/1369124731.db2.gz	BNISMCIPXXIIRW-PXNSSMCTSA-N	0	3	328.456	3.375	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@@H]1CCC1(C)C)c1ccccc1OC	ZINC001198855635	1369130785	/nfs/dbraw/zinc/13/07/85/1369130785.db2.gz	DNWWECYNXCMHCS-IRXDYDNUSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)CCCC#CC)c1ccccc1OC	ZINC001198857251	1369131364	/nfs/dbraw/zinc/13/13/64/1369131364.db2.gz	NWEZLPDNXQYVRH-SFHVURJKSA-N	0	3	328.456	3.212	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@H](NCCCF)c1ccccc1OC	ZINC001198885156	1369139395	/nfs/dbraw/zinc/13/93/95/1369139395.db2.gz	BLWFUQRLABHCDB-LPHOPBHVSA-N	0	3	336.451	3.404	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)C1(CF)CCC1)c1ccccc1OC	ZINC001198908712	1369146301	/nfs/dbraw/zinc/14/63/01/1369146301.db2.gz	MCPFVBGINOWVAD-MRXNPFEDSA-N	0	3	334.435	3.158	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@@H]1CC12CCC2)c1ccccc1OC	ZINC001198925850	1369151053	/nfs/dbraw/zinc/15/10/53/1369151053.db2.gz	YQIYSYNTTQSZNZ-IRXDYDNUSA-N	0	3	328.456	3.208	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CC/C=C/CCC)C[C@H]2O)CCCCC1	ZINC001198944138	1369154599	/nfs/dbraw/zinc/15/45/99/1369154599.db2.gz	BTJQWKKUDMSFTO-LXORQPIJSA-N	0	3	348.531	3.421	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)C(C)(C)CCOC)c1ccccc1OC	ZINC001198953567	1369156675	/nfs/dbraw/zinc/15/66/75/1369156675.db2.gz	QEVQMBZIBHZJPE-KRWDZBQOSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001200783406	1369428023	/nfs/dbraw/zinc/42/80/23/1369428023.db2.gz	PAGBTPHFEBEUCE-UHFFFAOYSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)C[C@@H]2OCCc3ccccc32)CC1	ZINC001113559424	1369492817	/nfs/dbraw/zinc/49/28/17/1369492817.db2.gz	SRIJJZDBWZKEKO-XLIONFOSSA-N	0	3	342.483	3.189	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)CCCc2nc(C(C)C)no2)CC1	ZINC001113633318	1369533643	/nfs/dbraw/zinc/53/36/43/1369533643.db2.gz	VRALKZWUJFJHPV-MRXNPFEDSA-N	0	3	348.491	3.015	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCCO[C@H](CNCc2cccc(F)c2)C1	ZINC001201516711	1369563648	/nfs/dbraw/zinc/56/36/48/1369563648.db2.gz	YYYRDWUVTPSAPU-GOSISDBHSA-N	0	3	348.462	3.135	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)CCc2cccc(F)c2F)CC1	ZINC001113732874	1369593966	/nfs/dbraw/zinc/59/39/66/1369593966.db2.gz	CFZDUGBRZOSKIC-HNNXBMFYSA-N	0	3	336.426	3.396	20	30		EGEDHN
C#CC[C@@H](CC(=O)N1CCN(C[C@@H](C)CC)CC1)c1ccccc1	ZINC001113736621	1369596143	/nfs/dbraw/zinc/59/61/43/1369596143.db2.gz	MDTUZBVVFJGOLK-ICSRJNTNSA-N	0	3	326.484	3.374	20	30		EGEDHN
CC#CCNC[C@@H]1CN(C(=O)C[C@@H](C)CCCCCC)CCCO1	ZINC001201842477	1369633000	/nfs/dbraw/zinc/63/30/00/1369633000.db2.gz	WHLIXGKZCXSWGW-RBUKOAKNSA-N	0	3	336.520	3.213	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC(N[C@H](C)c2cnc(C)cn2)CC1	ZINC001202130043	1369695192	/nfs/dbraw/zinc/69/51/92/1369695192.db2.gz	CZYGPCISLJDTCG-CVEARBPZSA-N	0	3	330.476	3.029	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)CCC(C)C)C12CCC2	ZINC001202447571	1369774401	/nfs/dbraw/zinc/77/44/01/1369774401.db2.gz	JKAWJOYIXBQXAX-UONOGXRCSA-N	0	3	343.309	3.348	20	30		EGEDHN
CCCC[C@H](CNc1cccc(F)c1C#N)NC(=O)[C@@H](CC)N(C)C	ZINC001114272100	1369841723	/nfs/dbraw/zinc/84/17/23/1369841723.db2.gz	JMEVDEQPCBHRKG-RDTXWAMCSA-N	0	3	348.466	3.124	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC(NCc2oc(CC)nc2C)CC1	ZINC001202693981	1369853871	/nfs/dbraw/zinc/85/38/71/1369853871.db2.gz	GTGGBLFKFXMGEH-UHFFFAOYSA-N	0	3	333.476	3.228	20	30		EGEDHN
Cc1cc(C(=O)N[C@H]2C[C@H](NCC#Cc3ccccc3)C23CCC3)co1	ZINC001202785858	1369891609	/nfs/dbraw/zinc/89/16/09/1369891609.db2.gz	RNIUCVYVHNQPHT-PMACEKPBSA-N	0	3	348.446	3.270	20	30		EGEDHN
Cc1ccc(F)c(CN[C@H]2C[C@@H](NC(=O)C#CC3CC3)C23CCC3)c1	ZINC001202889624	1369918741	/nfs/dbraw/zinc/91/87/41/1369918741.db2.gz	ZIAPUTJVVFLATD-RBUKOAKNSA-N	0	3	340.442	3.065	20	30		EGEDHN
C[C@@H](c1ccccc1)N(Cc1ccc(C#N)cc1)C[C@@H]1CCC(=O)N1	ZINC001202898824	1369921425	/nfs/dbraw/zinc/92/14/25/1369921425.db2.gz	IRIWVDXYOMZAID-JXFKEZNVSA-N	0	3	333.435	3.400	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2[C@H]3CN(Cc4cc5ccccc5o4)C[C@H]32)CCC1	ZINC001114396755	1369931950	/nfs/dbraw/zinc/93/19/50/1369931950.db2.gz	CVRPJMKJXCGDIU-RUYXUALKSA-N	0	3	348.446	3.173	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1C[C@@H](NCc2ncccc2C)C12CCC2	ZINC001202985262	1369945837	/nfs/dbraw/zinc/94/58/37/1369945837.db2.gz	CDBAWQZFTJSOOU-QZTJIDSGSA-N	0	3	327.472	3.263	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)C(C)(C)CC(F)F)C12CCC2	ZINC001203035442	1369962229	/nfs/dbraw/zinc/96/22/29/1369962229.db2.gz	BBWKQZSRVBAMIY-VXGBXAGGSA-N	0	3	334.838	3.437	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)CCc2ccsc2)C12CCC2	ZINC001203036292	1369962779	/nfs/dbraw/zinc/96/27/79/1369962779.db2.gz	NIIWIFHPKQYTQH-CABCVRRESA-N	0	3	338.904	3.450	20	30		EGEDHN
O=C(N[C@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2)C1(C2CC2)CC1	ZINC001203050910	1369966864	/nfs/dbraw/zinc/96/68/64/1369966864.db2.gz	HFBSBJYFLHCWGA-UXHICEINSA-N	0	3	348.490	3.245	20	30		EGEDHN
CC[C@H](C)[C@@H](C)C(=O)N1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001203093860	1369981096	/nfs/dbraw/zinc/98/10/96/1369981096.db2.gz	ZLVZAQGIARBPEW-LSDHHAIUSA-N	0	3	345.462	3.460	20	30		EGEDHN
O=C(CCC(F)F)N[C@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001203193760	1370019971	/nfs/dbraw/zinc/01/99/71/1370019971.db2.gz	XIBNCTUKWXEGEV-IRXDYDNUSA-N	0	3	346.421	3.100	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1C[C@@H](NCc2ccns2)C12CCC2	ZINC001203258304	1370044804	/nfs/dbraw/zinc/04/48/04/1370044804.db2.gz	QXGJIQDRXCOJKC-HUUCEWRRSA-N	0	3	333.501	3.262	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1C[C@H](NCc2oc(C)nc2C)C12CCC2	ZINC001203282032	1370060313	/nfs/dbraw/zinc/06/03/13/1370060313.db2.gz	UUVMXPXWDXXFNX-JKSUJKDBSA-N	0	3	331.460	3.021	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C)c(OC)c3)C[C@H]21	ZINC001114793017	1370084063	/nfs/dbraw/zinc/08/40/63/1370084063.db2.gz	YPKWHONSVGUNRZ-QRKMNUTDSA-N	0	3	342.483	3.152	20	30		EGEDHN
COc1ccc(C[NH+]2CCC(Oc3ccccc3C#N)CC2)c([O-])c1	ZINC001203629110	1370192958	/nfs/dbraw/zinc/19/29/58/1370192958.db2.gz	QVMSFSHXHFEHEX-UHFFFAOYSA-N	0	3	338.407	3.316	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)COCCCCCC)C12CCC2	ZINC001203659607	1370205582	/nfs/dbraw/zinc/20/55/82/1370205582.db2.gz	JWEKGZDKOINKBC-HOTGVXAUSA-N	0	3	342.911	3.353	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)COc2ccc(C)cc2)C12CCC2	ZINC001203695097	1370224071	/nfs/dbraw/zinc/22/40/71/1370224071.db2.gz	PFHOJINCWNKLKW-SJORKVTESA-N	0	3	348.874	3.143	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@@H](Oc4cccnc4)CO3)CC2)c1	ZINC001203757169	1370251176	/nfs/dbraw/zinc/25/11/76/1370251176.db2.gz	HRCXNSXGAWFPIK-HXUWFJFHSA-N	0	3	349.434	3.156	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)CC#Cc2ccccc2)C12CCC2	ZINC001203762886	1370254473	/nfs/dbraw/zinc/25/44/73/1370254473.db2.gz	VABGXRGZJFYWBS-MSOLQXFVSA-N	0	3	342.870	3.198	20	30		EGEDHN
C[C@@H]1C[C@@H](NCCC(=O)Nc2cccc(C#N)c2)c2ccccc2O1	ZINC001325878297	1388061883	/nfs/dbraw/zinc/06/18/83/1388061883.db2.gz	HVNOQLJEEMJHBO-RDTXWAMCSA-N	0	3	335.407	3.389	20	30		EGEDHN
CN(C)CCN(C)C(=O)Nc1ccc(Oc2ccccc2)c(C#N)c1	ZINC001203839176	1370285670	/nfs/dbraw/zinc/28/56/70/1370285670.db2.gz	ULBGZGIIHYDFCY-UHFFFAOYSA-N	0	3	338.411	3.376	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(C[C@H](c4ccccc4)C(=O)N3)CC2)cc1	ZINC001203902290	1370306961	/nfs/dbraw/zinc/30/69/61/1370306961.db2.gz	ZAXWDWRYKMSLSW-HXUWFJFHSA-N	0	3	345.446	3.197	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@]3(CC(=O)N(c4ccsc4)C3)C2)cc1	ZINC001203901878	1370307052	/nfs/dbraw/zinc/30/70/52/1370307052.db2.gz	SZVWIURCDGOTJO-IBGZPJMESA-N	0	3	337.448	3.249	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CC2)C(=O)NC[C@@H]3c2ccccc2)cc1	ZINC001203901468	1370307212	/nfs/dbraw/zinc/30/72/12/1370307212.db2.gz	NIGUXZDYGAPPGT-HXUWFJFHSA-N	0	3	345.446	3.054	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CC2)CC(=O)Nc2ccccc23)cc1	ZINC001203903665	1370307771	/nfs/dbraw/zinc/30/77/71/1370307771.db2.gz	KMAHRDOGORKKKR-UHFFFAOYSA-N	0	3	331.419	3.434	20	30		EGEDHN
C#CCC1(C(=O)N2CCC(NCc3nccs3)CC2)CCCCC1	ZINC001204008329	1370346876	/nfs/dbraw/zinc/34/68/76/1370346876.db2.gz	UUXNOZPBSGBMHH-UHFFFAOYSA-N	0	3	345.512	3.198	20	30		EGEDHN
CCCC(=O)NCC1(NCc2cc(C#N)ccc2F)CCCCC1	ZINC001115381794	1370420385	/nfs/dbraw/zinc/42/03/85/1370420385.db2.gz	NJYNWFLKUMIYAP-UHFFFAOYSA-N	0	3	331.435	3.406	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)C=C(C)C)CCCCC1	ZINC001115391881	1370428993	/nfs/dbraw/zinc/42/89/93/1370428993.db2.gz	AKPYTTWONXIOLU-UHFFFAOYSA-N	0	3	329.282	3.270	20	30		EGEDHN
C=CCCC(=O)NCC1(NCc2ccccc2[N+](=O)[O-])CCCCC1	ZINC001115443010	1370455622	/nfs/dbraw/zinc/45/56/22/1370455622.db2.gz	ZSWHUQPSJKGPNS-UHFFFAOYSA-N	0	3	345.443	3.470	20	30		EGEDHN
Cc1ccc(O[C@@H]2C[C@@H]3CN(Cc4ccccc4C#N)CCN3C2)cc1	ZINC001204369810	1370455855	/nfs/dbraw/zinc/45/58/55/1370455855.db2.gz	DMRIGQUTCAGEGG-IFMALSPDSA-N	0	3	347.462	3.204	20	30		EGEDHN
C=CCN1C(=O)CCC12CCN(Cc1ccc3ccccc3n1)CC2	ZINC001204499766	1370494039	/nfs/dbraw/zinc/49/40/39/1370494039.db2.gz	KBUVOHQMULDDGX-UHFFFAOYSA-N	0	3	335.451	3.378	20	30		EGEDHN
COc1cccc(C#N)c1Nc1cccc(CN2CCN(C)CC2)c1	ZINC001204564202	1370517128	/nfs/dbraw/zinc/51/71/28/1370517128.db2.gz	JTUUTHPFPLTTQT-UHFFFAOYSA-N	0	3	336.439	3.058	20	30		EGEDHN
Cc1cc(C#N)c(Nc2cccc(CN3CCN(C)CC3)c2)cc1F	ZINC001204578291	1370522484	/nfs/dbraw/zinc/52/24/84/1370522484.db2.gz	BQJHQSKTFKHIGK-UHFFFAOYSA-N	0	3	338.430	3.497	20	30		EGEDHN
Cc1cccnc1CNC1(CNC(=O)C#CC(C)(C)C)CCCCC1	ZINC001115528308	1370526968	/nfs/dbraw/zinc/52/69/68/1370526968.db2.gz	IUECYOVUVHYHOJ-UHFFFAOYSA-N	0	3	341.499	3.348	20	30		EGEDHN
Cc1cc(C#N)c(Nc2ccc(CN3CCN(C)CC3)cc2)s1	ZINC001204724734	1370555035	/nfs/dbraw/zinc/55/50/35/1370555035.db2.gz	LXLRXRZFWWLOKT-UHFFFAOYSA-N	0	3	326.469	3.419	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ncc3ccccn32)CCCCC1	ZINC001115627712	1370620829	/nfs/dbraw/zinc/62/08/29/1370620829.db2.gz	NKKNOVMWNOVPNB-UHFFFAOYSA-N	0	3	346.862	3.109	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)CC2(C)CC2)CCCCC1	ZINC001115633124	1370626371	/nfs/dbraw/zinc/62/63/71/1370626371.db2.gz	FSOKIQMWNPBGET-UHFFFAOYSA-N	0	3	343.309	3.494	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCC1(NCc2cnc(C)nc2)CCCCC1	ZINC001115685231	1370668383	/nfs/dbraw/zinc/66/83/83/1370668383.db2.gz	YUKVRIXVPYGDQL-INIZCTEOSA-N	0	3	344.503	3.296	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCC1(NCc2cnc(C)cn2)CCCCC1	ZINC001115685184	1370668816	/nfs/dbraw/zinc/66/88/16/1370668816.db2.gz	XKTKGAFNPURNII-MRXNPFEDSA-N	0	3	344.503	3.296	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C2CCCC2)CC[C@H]1c1ccc(F)cc1	ZINC001205233074	1370689471	/nfs/dbraw/zinc/68/94/71/1370689471.db2.gz	LOCZJUGTCUQIID-VQTJNVASSA-N	0	3	342.458	3.313	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ocnc2CC)CCCCC1	ZINC001115722131	1370701123	/nfs/dbraw/zinc/70/11/23/1370701123.db2.gz	XZZBWRVTWDALOW-UHFFFAOYSA-N	0	3	325.840	3.012	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)/C=C\C(C)(C)C)CC[C@H]1c1ccc(F)cc1	ZINC001205269934	1370701146	/nfs/dbraw/zinc/70/11/46/1370701146.db2.gz	IHNARXCPGYXHQB-ZRVJFILXSA-N	0	3	342.458	3.335	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC2(NCc3cnc(C)nc3)CCCCC2)C1	ZINC001115723377	1370702407	/nfs/dbraw/zinc/70/24/07/1370702407.db2.gz	NMYPSAQKLKSUHH-UHFFFAOYSA-N	0	3	342.487	3.050	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cccc3c2OCC3)CCCCC1	ZINC001115744070	1370725016	/nfs/dbraw/zinc/72/50/16/1370725016.db2.gz	MUOKEGWMWCTRLT-UHFFFAOYSA-N	0	3	348.874	3.396	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C[C@H](C)C(C)C)C[C@H]1c1cccc(F)c1	ZINC001205386495	1370738529	/nfs/dbraw/zinc/73/85/29/1370738529.db2.gz	SBXCUUVOWDSTAY-ZYSHUDEJSA-N	0	3	330.447	3.025	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@@H](C)CCC)C[C@H]1c1cccc(F)c1	ZINC001205391302	1370740533	/nfs/dbraw/zinc/74/05/33/1370740533.db2.gz	RAAZQZKKRFYVIU-ZYSHUDEJSA-N	0	3	330.447	3.169	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](c3cccc(F)c3)[C@H](NCC#CC)C2)C1	ZINC001205434366	1370754047	/nfs/dbraw/zinc/75/40/47/1370754047.db2.gz	FUTBUHRIEPKFIF-RBUKOAKNSA-N	0	3	340.442	3.089	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H](CC)CC(C)C)C[C@H]1c1cccc(F)c1	ZINC001205448510	1370759159	/nfs/dbraw/zinc/75/91/59/1370759159.db2.gz	GZEUBMMARLGWQH-FFZOFVMBSA-N	0	3	344.474	3.415	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C[C@H](C)C2CC2)C[C@H]1c1cccc(F)c1	ZINC001205458425	1370761411	/nfs/dbraw/zinc/76/14/11/1370761411.db2.gz	KYWOXTOIKXWQJL-RYGJVYDSSA-N	0	3	342.458	3.169	20	30		EGEDHN
CC(C)N(CCNC(=O)OC(C)(C)C)Cc1ccc(F)c(C#N)c1	ZINC001205493581	1370771678	/nfs/dbraw/zinc/77/16/78/1370771678.db2.gz	BFCCSWNZJJKLRQ-UHFFFAOYSA-N	0	3	335.423	3.432	20	30		EGEDHN
CCCCCCCCC(=O)N1CC[C@@H](NCc2cn(C)nc2C)C1	ZINC001187341513	1388097127	/nfs/dbraw/zinc/09/71/27/1388097127.db2.gz	YFQNPKSKRRKMHT-GOSISDBHSA-N	0	3	334.508	3.170	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC(CNCc2nccs2)CC1	ZINC001205886178	1370900729	/nfs/dbraw/zinc/90/07/29/1370900729.db2.gz	WGUZLUOUUCCAHT-UHFFFAOYSA-N	0	3	333.501	3.055	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC(CNCc2csc(C)n2)CC1	ZINC001205897923	1370904032	/nfs/dbraw/zinc/90/40/32/1370904032.db2.gz	SEDQPHJIIQDXOZ-UHFFFAOYSA-N	0	3	347.528	3.363	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)N1CCC(CNCc2oc(CC)nc2C)CC1	ZINC001205953914	1370921846	/nfs/dbraw/zinc/92/18/46/1370921846.db2.gz	BCWTXPNVLMZKKD-CABCVRRESA-N	0	3	347.503	3.332	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)N1CCC(CNCc2ncc(C)s2)CC1	ZINC001205954555	1370922653	/nfs/dbraw/zinc/92/26/53/1370922653.db2.gz	HMILXJKAGKAFHF-UKRRQHHQSA-N	0	3	335.517	3.238	20	30		EGEDHN
CC(C)c1ccc(CN2C[C@@H](C)[C@H](NC(=O)CSCC#N)C2)cc1	ZINC001206090328	1370958889	/nfs/dbraw/zinc/95/88/89/1370958889.db2.gz	PGBUWRRDVXUTHQ-CRAIPNDOSA-N	0	3	345.512	3.003	20	30		EGEDHN
Cc1cc(O)cc(-c2nccnc2C(C#N)C(=O)OC(C)(C)C)c1	ZINC001206218719	1370996397	/nfs/dbraw/zinc/99/63/97/1370996397.db2.gz	FTRYORCDWYNPCF-CQSZACIVSA-N	0	3	325.368	3.107	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CCN(Cc3ccncc3F)CC2)CC1	ZINC001206782299	1371165169	/nfs/dbraw/zinc/16/51/69/1371165169.db2.gz	TWJWHZGNUMDEGP-UHFFFAOYSA-N	0	3	347.434	3.221	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CN(Cc2ccc3cc[nH]c3c2)C[C@H]1C	ZINC001206885841	1371207144	/nfs/dbraw/zinc/20/71/44/1371207144.db2.gz	IAPDNSMOISJICB-OXQOHEQNSA-N	0	3	337.467	3.298	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C3CCC3)cc2)C[C@H]1NC(=O)C#CC1CC1	ZINC001206948568	1371240925	/nfs/dbraw/zinc/24/09/25/1371240925.db2.gz	RJIUXKRGPIOCLE-IIBYNOLFSA-N	0	3	336.479	3.304	20	30		EGEDHN
C[C@@H](c1ccc2c(c1)CCC2)N1C[C@@H](C)[C@H](NC(=O)C#CC2CC2)C1	ZINC001206951670	1371242862	/nfs/dbraw/zinc/24/28/62/1371242862.db2.gz	DUEARUNXJNDOOT-VWKPWSFCSA-N	0	3	336.479	3.086	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CCN(Cc3cncc(C)c3)C2)C1	ZINC001207154483	1371312924	/nfs/dbraw/zinc/31/29/24/1371312924.db2.gz	ZQLJJKQYCBROCU-IBGZPJMESA-N	0	3	329.444	3.001	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1ccnn1C(C)C)[C@@H]2CC	ZINC001207171869	1371319232	/nfs/dbraw/zinc/31/92/32/1371319232.db2.gz	SUPOFPQBWWMBGH-QUCCMNQESA-N	0	3	344.503	3.386	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN(Cc2cccc(OC)c2C)C[C@H]1C	ZINC001207215421	1371331228	/nfs/dbraw/zinc/33/12/28/1371331228.db2.gz	JIJLWJUPNDXRDW-CRAIPNDOSA-N	0	3	330.472	3.296	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN(CC[C@H]2CC2(Cl)Cl)C[C@H]1C	ZINC001207215208	1371331723	/nfs/dbraw/zinc/33/17/23/1371331723.db2.gz	CRWKSIRLGVEZKF-HZSPNIEDSA-N	0	3	333.303	3.363	20	30		EGEDHN
CCOC(=O)COc1ccc(CN[C@H](C)c2cccc(C#N)c2)cc1	ZINC001119496789	1371355811	/nfs/dbraw/zinc/35/58/11/1371355811.db2.gz	VJNVXPISTVIJGX-OAHLLOKOSA-N	0	3	338.407	3.351	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2CN(Cc3ccc(CF)cc3)C[C@H]2C)CCC1	ZINC001207510934	1371420434	/nfs/dbraw/zinc/42/04/34/1371420434.db2.gz	XBSSAVWJHWLLKC-VQIMIIECSA-N	0	3	342.458	3.286	20	30		EGEDHN
COc1ccc(CCCN2CCN(c3ccccc3C#N)CC2)cc1	ZINC001207571908	1371438327	/nfs/dbraw/zinc/43/83/27/1371438327.db2.gz	AJQMHCKJEVJZMT-UHFFFAOYSA-N	0	3	335.451	3.322	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H](C)CCCOC)CCCCC1	ZINC001119978727	1371438821	/nfs/dbraw/zinc/43/88/21/1371438821.db2.gz	MZURELMFZXFKIM-AWEZNQCLSA-N	0	3	330.900	3.210	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cc(C)n(C)c2C)CCCCC1	ZINC001120109581	1371487246	/nfs/dbraw/zinc/48/72/46/1371487246.db2.gz	FUWYMYXZVMELHX-UHFFFAOYSA-N	0	3	337.895	3.417	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccc(C)nc2C)CCCCC1	ZINC001120181493	1371500820	/nfs/dbraw/zinc/50/08/20/1371500820.db2.gz	IKICZNYHUQTRGD-UHFFFAOYSA-N	0	3	335.879	3.473	20	30		EGEDHN
C=CCOCc1nn(C)c2c1CN(C[C@@H](C)c1ccccc1)CC2	ZINC001207907712	1371534086	/nfs/dbraw/zinc/53/40/86/1371534086.db2.gz	WGADJEUGYWJJJP-MRXNPFEDSA-N	0	3	325.456	3.285	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H](N[C@H](C)c2ccc(F)cc2F)C1	ZINC001207909045	1371535262	/nfs/dbraw/zinc/53/52/62/1371535262.db2.gz	NBKYUXJBJWOZDR-GDBMZVCRSA-N	0	3	334.410	3.410	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001207934981	1371543240	/nfs/dbraw/zinc/54/32/40/1371543240.db2.gz	LVYRZGUNBGXFDU-SFHVURJKSA-N	0	3	342.870	3.076	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC[C@H]([C@@H]2CCCN2Cc2ccns2)C1	ZINC001120383109	1371556233	/nfs/dbraw/zinc/55/62/33/1371556233.db2.gz	UBESJJXQGDSDMY-WMZOPIPTSA-N	0	3	345.512	3.006	20	30		EGEDHN
CC(C)(CC(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1)C1CC1	ZINC001207983305	1371559582	/nfs/dbraw/zinc/55/95/82/1371559582.db2.gz	NZXPIFNNXOYZEB-HXUWFJFHSA-N	0	3	338.495	3.445	20	30		EGEDHN
Cc1csc(C(=O)N2CCC[C@@H](NCC#Cc3ccccc3)C2)c1	ZINC001207982704	1371560143	/nfs/dbraw/zinc/56/01/43/1371560143.db2.gz	DHKSXHMESXEPAA-GOSISDBHSA-N	0	3	338.476	3.302	20	30		EGEDHN
CC(C)=CC(=O)NC1CC2(CC(NCc3cc(F)ccc3C#N)C2)C1	ZINC001120576684	1371618295	/nfs/dbraw/zinc/61/82/95/1371618295.db2.gz	ODUCYBYRJHRLHK-UHFFFAOYSA-N	0	3	341.430	3.181	20	30		EGEDHN
CC[C@@H](CC(F)F)C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001208321924	1371717095	/nfs/dbraw/zinc/71/70/95/1371717095.db2.gz	NWJYANQYLBIWCI-ROUUACIJSA-N	0	3	348.437	3.300	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CN(CCOc2ccccc2C)C[C@H]1C	ZINC001208374138	1371741144	/nfs/dbraw/zinc/74/11/44/1371741144.db2.gz	AARAVYPMFRUGAE-RTBURBONSA-N	0	3	342.483	3.004	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1)C(C)(C)C	ZINC001208424462	1371762505	/nfs/dbraw/zinc/76/25/05/1371762505.db2.gz	ZFMIDWHWXMRBNK-IEBWSBKVSA-N	0	3	326.484	3.301	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN(Cc2ccc3c(c2)COC3)C[C@H]1C	ZINC001208452371	1371771704	/nfs/dbraw/zinc/77/17/04/1371771704.db2.gz	IHPGXMRAVWUSCL-DNVCBOLYSA-N	0	3	328.456	3.010	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC1CC2(C1)CC(N[C@H](C)c1cnccn1)C2	ZINC001121174843	1371878341	/nfs/dbraw/zinc/87/83/41/1371878341.db2.gz	BIRKJLKNOWFNMN-NUVKBMONSA-N	0	3	342.487	3.157	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC1CC2(CC(NCc3ocnc3C)C2)C1	ZINC001121176397	1371880065	/nfs/dbraw/zinc/88/00/65/1371880065.db2.gz	XIIATJNLXROHBS-UHFFFAOYSA-N	0	3	331.460	3.102	20	30		EGEDHN
C[C@@H]1CCN(CCCc2ccc(C#N)cc2)C[C@@]1(O)C(F)(F)F	ZINC001208860670	1371922308	/nfs/dbraw/zinc/92/23/08/1371922308.db2.gz	RNMUHWDDXXVWLM-CJNGLKHVSA-N	0	3	326.362	3.126	20	30		EGEDHN
CCOC(=O)[C@@H]1[C@H]2CCC[C@H]2CN1CCCc1ccc(C#N)cc1	ZINC001208864135	1371923757	/nfs/dbraw/zinc/92/37/57/1371923757.db2.gz	IZQZKWADZDRGAJ-FHWLQOOXSA-N	0	3	326.440	3.154	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H]2[C@@H](CN2CCc2ccc(C#N)cc2)C1	ZINC001208925756	1371947343	/nfs/dbraw/zinc/94/73/43/1371947343.db2.gz	QAILHCBOQZRTLX-ROUUACIJSA-N	0	3	341.455	3.042	20	30		EGEDHN
CC1(C(=O)N2CCC[C@@H](NCC#Cc3ccc(Cl)cc3)C2)CCC1	ZINC001208993151	1371969652	/nfs/dbraw/zinc/96/96/52/1371969652.db2.gz	GYSASXMLKNUSFM-GOSISDBHSA-N	0	3	344.886	3.462	20	30		EGEDHN
C=CCN(CCN1CC[C@@H](c2ccc(OC)cc2)C1)C(=O)OCC	ZINC001209021388	1371976954	/nfs/dbraw/zinc/97/69/54/1371976954.db2.gz	ZSADXGSMNSVEFR-QGZVFWFLSA-N	0	3	332.444	3.129	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@@H](NCc2cc(C)ccc2OC)C1	ZINC001209110670	1372001150	/nfs/dbraw/zinc/00/11/50/1372001150.db2.gz	DZPXYCMXKBKZJY-LJQANCHMSA-N	0	3	342.483	3.278	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CC2(CC(NCc3oc(CC)nc3C)C2)C1	ZINC001121534318	1372002617	/nfs/dbraw/zinc/00/26/17/1372002617.db2.gz	DSEHGKBYCALXHQ-UHFFFAOYSA-N	0	3	345.487	3.275	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC[C@H](NCc2cn(C(C)C)nc2C)C1	ZINC001209184396	1372029829	/nfs/dbraw/zinc/02/98/29/1372029829.db2.gz	SFHLBBDBHFVLFD-HKUYNNGSSA-N	0	3	346.519	3.455	20	30		EGEDHN
C=CCCCC(=O)NC1CC2(CC(NCc3nc(C)cs3)C2)C1	ZINC001121663964	1372039549	/nfs/dbraw/zinc/03/95/49/1372039549.db2.gz	VGDAVBNIJGGOFB-UHFFFAOYSA-N	0	3	333.501	3.325	20	30		EGEDHN
C=CCCCN1C[C@@H](C)[C@H](NC(=O)c2cnc(-c3ccoc3)s2)C1	ZINC001209238033	1372046706	/nfs/dbraw/zinc/04/67/06/1372046706.db2.gz	HDLOHLANUYQDCC-UKRRQHHQSA-N	0	3	345.468	3.419	20	30		EGEDHN
C=CCCCCCCN1C[C@H](O)C[C@H](NC(=O)OC(C)(C)C)C1	ZINC001209430924	1372104822	/nfs/dbraw/zinc/10/48/22/1372104822.db2.gz	DRJCLWNSPCBHEQ-JKSUJKDBSA-N	0	3	326.481	3.083	20	30		EGEDHN
O=C(c1occc1Cl)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001209476329	1372116373	/nfs/dbraw/zinc/11/63/73/1372116373.db2.gz	UWYMEWOJDCXGRV-INIZCTEOSA-N	0	3	342.826	3.179	20	30		EGEDHN
O=C([C@H]1CC12CC2)N1CCC[C@@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001209807279	1372203584	/nfs/dbraw/zinc/20/35/84/1372203584.db2.gz	DEIRUHJPXKNXBM-QZTJIDSGSA-N	0	3	342.870	3.072	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001209865577	1372217252	/nfs/dbraw/zinc/21/72/52/1372217252.db2.gz	IHWLFEHGZKUIKG-KRWDZBQOSA-N	0	3	343.446	3.380	20	30		EGEDHN
N#CC(C(=O)Cc1cccnc1)C(=O)Nc1ccc(Cl)cc1Cl	ZINC001122406325	1372243203	/nfs/dbraw/zinc/24/32/03/1372243203.db2.gz	JOFQYZLAQSZIEJ-LBPRGKRZSA-N	0	3	348.189	3.278	20	30		EGEDHN
CC[C@H](C)c1ccc(NC(=O)C(C#N)C(=O)COC(F)(F)F)cc1	ZINC001122547854	1372272643	/nfs/dbraw/zinc/27/26/43/1372272643.db2.gz	YMXWFEBDHBTONI-GWCFXTLKSA-N	0	3	342.317	3.384	20	30		EGEDHN
CC(C)C[C@H](C)C(=O)N1CCC[C@@H](NCc2ccc(C#N)s2)C1	ZINC001210358937	1372331749	/nfs/dbraw/zinc/33/17/49/1372331749.db2.gz	RGBZQHIETKICEK-LSDHHAIUSA-N	0	3	333.501	3.383	20	30		EGEDHN
CC(C)C[C@@H](C)C(=O)N1CCC[C@H](NCc2ccc(C#N)s2)C1	ZINC001210358934	1372331856	/nfs/dbraw/zinc/33/18/56/1372331856.db2.gz	RGBZQHIETKICEK-CABCVRRESA-N	0	3	333.501	3.383	20	30		EGEDHN
Cn1c(Cl)cnc1C(C#N)C(=O)C[C@H](CC#N)c1ccccc1	ZINC001123337900	1372431522	/nfs/dbraw/zinc/43/15/22/1372431522.db2.gz	VVACLRGHKCWSAC-KBPBESRZSA-N	0	3	326.787	3.337	20	30		EGEDHN
C=C[C@H](C(=O)N[C@@H]1CN(CCOCCCC)C[C@H]1C)c1ccccc1	ZINC001211241229	1372509847	/nfs/dbraw/zinc/50/98/47/1372509847.db2.gz	GZODXEXAQWJRFY-YZGWKJHDSA-N	0	3	344.499	3.209	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)[C@@]2(C)CCC(C)=C(C)C2)C1	ZINC001211401054	1372551680	/nfs/dbraw/zinc/55/16/80/1372551680.db2.gz	FJSMWOLDADZRBA-GGPKGHCWSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)C[C@@H]2CCCCC2(C)C)C1	ZINC001211482409	1372566914	/nfs/dbraw/zinc/56/69/14/1372566914.db2.gz	TUXUMOITLNMYJO-FGTMMUONSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H](c3ccccc3)[C@H](NCC#CC)C2)CC1	ZINC001211669270	1372600241	/nfs/dbraw/zinc/60/02/41/1372600241.db2.gz	QYXZITPVEJJNIR-LEWJYISDSA-N	0	3	336.479	3.340	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H](C)CC(C)(C)C)C[C@H]1c1ccccc1	ZINC001211683780	1372602076	/nfs/dbraw/zinc/60/20/76/1372602076.db2.gz	AVEAAILOYJZEPB-YTQUADARSA-N	0	3	326.484	3.276	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CN([C@H](C)c2cc(C)ccc2C)C[C@H]1OC	ZINC001212022612	1372648994	/nfs/dbraw/zinc/64/89/94/1372648994.db2.gz	ZICUSMBFIDUGKO-BHIYHBOVSA-N	0	3	330.472	3.146	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H]1CN(CC/C=C/CCC)C[C@H]1OC	ZINC001212337483	1372690097	/nfs/dbraw/zinc/69/00/97/1372690097.db2.gz	PQYCNSVJIFEIQC-GUFYHEMZSA-N	0	3	342.911	3.327	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H]1CN(CCCC2CCC2)C[C@H]1OC	ZINC001212337614	1372690831	/nfs/dbraw/zinc/69/08/31/1372690831.db2.gz	WTZATZJTXARKDR-HZPDHXFCSA-N	0	3	342.911	3.161	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN(CC/C=C/c2ccccc2)C[C@H]1OC	ZINC001212349486	1372692666	/nfs/dbraw/zinc/69/26/66/1372692666.db2.gz	YCKJAKOKBYNIIC-DGDLXGGDSA-N	0	3	342.483	3.262	20	30		EGEDHN
CC[C@H](NCCNC(=O)[C@@H](C)C#N)c1ccc(Cl)cc1Cl	ZINC001124895527	1372738533	/nfs/dbraw/zinc/73/85/33/1372738533.db2.gz	HNXUVFMUUMFGIY-HZMBPMFUSA-N	0	3	328.243	3.310	20	30		EGEDHN
C[C@@H]1[C@H](NC(=O)c2csc(C#N)c2)CCN1Cc1ccccc1	ZINC001326517288	1388226244	/nfs/dbraw/zinc/22/62/44/1388226244.db2.gz	USJWQEVAGRZDLS-CXAGYDPISA-N	0	3	325.437	3.013	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1CN([C@H](C)c2ccccc2)C[C@H]1OC	ZINC001213271123	1372871509	/nfs/dbraw/zinc/87/15/09/1372871509.db2.gz	IRUDCBIRMPABER-MISYRCLQSA-N	0	3	342.483	3.147	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CN(CCC2=CCCCC2)C[C@H]1OC	ZINC001213320270	1372883307	/nfs/dbraw/zinc/88/33/07/1372883307.db2.gz	QOVLSEAVMWOHKQ-QXAKKESOSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)C2CCC(=C)CC2)[C@H](OC)C1	ZINC001213376921	1372895726	/nfs/dbraw/zinc/89/57/26/1372895726.db2.gz	NQWVLFUZGIFZGI-RTBURBONSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2ccc(C)cc2F)[C@H](OC)C1	ZINC001213485631	1372912481	/nfs/dbraw/zinc/91/24/81/1372912481.db2.gz	KOFJBEMDYYLVRZ-RTBURBONSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H](NC(=O)c2ccsc2Cl)[C@H](OC)C1	ZINC001213532081	1372921496	/nfs/dbraw/zinc/92/14/96/1372921496.db2.gz	RHYUYBRQLWCXSN-IACUBPJLSA-N	0	3	342.892	3.185	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2ccc(C(F)F)cc2)[C@H](OC)C1	ZINC001213581077	1372929174	/nfs/dbraw/zinc/92/91/74/1372929174.db2.gz	OLLALZOSXSZDQQ-HZPDHXFCSA-N	0	3	338.398	3.019	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2ccoc2CCC)[C@H](OC)C1	ZINC001213716786	1372949936	/nfs/dbraw/zinc/94/99/36/1372949936.db2.gz	GLEZMOXYXPHRDK-IEBWSBKVSA-N	0	3	348.487	3.408	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H](NC(=O)c2cc3ccccc3o2)[C@H](OC)C1	ZINC001213811471	1372964598	/nfs/dbraw/zinc/96/45/98/1372964598.db2.gz	QSWVCXLMUSBXGU-ZSZQSSIHSA-N	0	3	342.439	3.217	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H](NC(=O)c2cc3ccccc3o2)[C@H](OC)C1	ZINC001213811470	1372965107	/nfs/dbraw/zinc/96/51/07/1372965107.db2.gz	QSWVCXLMUSBXGU-IDHHARJASA-N	0	3	342.439	3.217	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2c(C)cc(C)cc2C)[C@H](OC)C1	ZINC001213818143	1372966728	/nfs/dbraw/zinc/96/67/28/1372966728.db2.gz	UGMFZZYHPZUIRB-QZTJIDSGSA-N	0	3	330.472	3.007	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)CCc2ccc(C)o2)[C@H](OC)C1	ZINC001213920384	1372980551	/nfs/dbraw/zinc/98/05/51/1372980551.db2.gz	XOFWDFOKXWFVAV-RTBURBONSA-N	0	3	348.487	3.082	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)[C@H](CC)c2ccc(F)cc2)[C@H](OC)C1	ZINC001213951516	1372985792	/nfs/dbraw/zinc/98/57/92/1372985792.db2.gz	VPKBCCXKESGRMS-GUDVDZBRSA-N	0	3	348.462	3.101	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2CCCC2)C[C@H]1NCC#Cc1ccc(F)cc1	ZINC001214070411	1373003647	/nfs/dbraw/zinc/00/36/47/1373003647.db2.gz	QWOUYZKNRVJHQF-OXQOHEQNSA-N	0	3	342.458	3.194	20	30		EGEDHN
CC(C)[C@@H](C)CC(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001214307947	1373042296	/nfs/dbraw/zinc/04/22/96/1373042296.db2.gz	PPUHEGBOLUQTKJ-JJRVBVJISA-N	0	3	333.501	3.238	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCC2CC2)C[C@H]1NCC#Cc1ccc(Cl)cc1	ZINC001214368643	1373050696	/nfs/dbraw/zinc/05/06/96/1373050696.db2.gz	GXWOCJYSGIQYGX-DNVCBOLYSA-N	0	3	344.886	3.318	20	30		EGEDHN
C/C=C(/C)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001214413724	1373056996	/nfs/dbraw/zinc/05/69/96/1373056996.db2.gz	KIVLLBHHCCDKOH-YPHGIUPASA-N	0	3	330.859	3.094	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@H]2CC2(C)C)C[C@H]1NCC#Cc1ccc(Cl)cc1	ZINC001214445864	1373062942	/nfs/dbraw/zinc/06/29/42/1373062942.db2.gz	ONZPJPBKWHOICY-ZTFGCOKTSA-N	0	3	344.886	3.174	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@@H]2CCCC23CC3)C[C@H]1NCC#Cc1ccccc1	ZINC001214954844	1373147642	/nfs/dbraw/zinc/14/76/42/1373147642.db2.gz	HWNQEHFQDGOXSY-YZGWKJHDSA-N	0	3	336.479	3.055	20	30		EGEDHN
C=C(C)CNCc1ccncc1O[C@H]1CCN(C(=O)[C@H](C)CCC)C1	ZINC001127878482	1373194737	/nfs/dbraw/zinc/19/47/37/1373194737.db2.gz	PBMBVXYADLETJZ-AEFFLSMTSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H](C)[C@H](NCc2c(C)nsc2C)C1	ZINC001215367175	1373203513	/nfs/dbraw/zinc/20/35/13/1373203513.db2.gz	GTKPUHCBHRAVFX-PBFPGSCMSA-N	0	3	335.517	3.299	20	30		EGEDHN
Cc1csc(C(=O)NCCNCc2cccc(C#N)c2)c1Cl	ZINC001128075580	1373214725	/nfs/dbraw/zinc/21/47/25/1373214725.db2.gz	MQTHLNLHFAPPKE-UHFFFAOYSA-N	0	3	333.844	3.101	20	30		EGEDHN
CC(C)CCCC(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001215634555	1373221446	/nfs/dbraw/zinc/22/14/46/1373221446.db2.gz	SQAPDYJKEMRUPW-DNVCBOLYSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC(C)(C)c1ccccc1C(=O)NCCNCc1ccc(C#N)s1	ZINC001130054519	1373449236	/nfs/dbraw/zinc/44/92/36/1373449236.db2.gz	VLWVWOSIXDERLA-UHFFFAOYSA-N	0	3	341.480	3.437	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2cc(C3CC3)[nH]c2C2CC2)c1	ZINC001130224205	1373475930	/nfs/dbraw/zinc/47/59/30/1373475930.db2.gz	DGDYVPYATWMXAK-UHFFFAOYSA-N	0	3	348.450	3.161	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)C(C)=C3CCC3)[C@H]2C1	ZINC001217834088	1373506184	/nfs/dbraw/zinc/50/61/84/1373506184.db2.gz	CHADIFXCUSHDLF-RBUKOAKNSA-N	0	3	332.488	3.145	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)CCCC[C@H](C)CC)[C@H]2C1	ZINC001218004991	1373532578	/nfs/dbraw/zinc/53/25/78/1373532578.db2.gz	XIZJHMAIXIORMG-CEXWTWQISA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)[C@H](C)CC(C)(C)C)C1	ZINC001130431391	1373536722	/nfs/dbraw/zinc/53/67/22/1373536722.db2.gz	XBYHIQSKAFAQLT-CABCVRRESA-N	0	3	332.492	3.074	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)[C@@H](CC)CC(C)C)C1	ZINC001130438604	1373540140	/nfs/dbraw/zinc/54/01/40/1373540140.db2.gz	MPJUZJOIADWBCW-JKSUJKDBSA-N	0	3	332.492	3.074	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCO[C@@H]2CN(CC3CC4(CCC4)C3)C[C@@H]21	ZINC001218023346	1373540258	/nfs/dbraw/zinc/54/02/58/1373540258.db2.gz	OZDPAMHLLSJRPK-ZWKOTPCHSA-N	0	3	346.515	3.081	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)C[C@@H](CC)C(C)C)C1	ZINC001130443198	1373542785	/nfs/dbraw/zinc/54/27/85/1373542785.db2.gz	RJOZEZBRNIWYKJ-HZPDHXFCSA-N	0	3	332.492	3.074	20	30		EGEDHN
C=C(C)CCC(=O)N1CCO[C@@H]2CN(CCC3=CCCCC3)C[C@@H]21	ZINC001218040528	1373545391	/nfs/dbraw/zinc/54/53/91/1373545391.db2.gz	BRZMSKVLXGNPQK-RBUKOAKNSA-N	0	3	332.488	3.145	20	30		EGEDHN
C=C(C)CCC(=O)N1CCO[C@@H]2CN([C@H](CC)c3ccccc3)C[C@@H]21	ZINC001218040517	1373546230	/nfs/dbraw/zinc/54/62/30/1373546230.db2.gz	BLSKNYISJXLBDP-HSALFYBXSA-N	0	3	342.483	3.406	20	30		EGEDHN
N#Cc1ccc(OCc2ccccc2)cc1O[C@H]1CCNC[C@@H]1F	ZINC001218066952	1373551840	/nfs/dbraw/zinc/55/18/40/1373551840.db2.gz	OWXLERZXSIGMFP-ROUUACIJSA-N	0	3	326.371	3.216	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCO[C@@H]2CN(CCCCCCC)C[C@@H]21	ZINC001218522486	1373629806	/nfs/dbraw/zinc/62/98/06/1373629806.db2.gz	ACINEOLWOZZIRL-GBESFXJTSA-N	0	3	336.520	3.471	20	30		EGEDHN
CC(C)CC1(C(=O)NCCNCc2ccc(F)c(C#N)c2)CCC1	ZINC001131141518	1373651320	/nfs/dbraw/zinc/65/13/20/1373651320.db2.gz	CPHITALFTILRSI-UHFFFAOYSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=CC1(CC(=O)N2CCO[C@@H]3CN(CCC4CC4)C[C@@H]32)CCCCC1	ZINC001218775946	1373653376	/nfs/dbraw/zinc/65/33/76/1373653376.db2.gz	JUVNFJJHIOTOSI-RBUKOAKNSA-N	0	3	346.515	3.225	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)Nc1cc2c(cc1C(C)=O)OCO2	ZINC001218935126	1373668128	/nfs/dbraw/zinc/66/81/28/1373668128.db2.gz	YKGCWUFUZYDWRD-AWEZNQCLSA-N	0	3	332.400	3.020	20	30		EGEDHN
CNc1ccc(C#N)cc1NC(=O)[C@@H]1CCC[C@@H](c2ccccc2)N1	ZINC001218980701	1373674150	/nfs/dbraw/zinc/67/41/50/1373674150.db2.gz	IUFKDMDBSMMFQV-WMZOPIPTSA-N	0	3	334.423	3.422	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)[C@@H](c2ccccc2)C2CC2)s1	ZINC001131314726	1373679670	/nfs/dbraw/zinc/67/96/70/1373679670.db2.gz	TZBIOYSLQGEHOO-SFHVURJKSA-N	0	3	339.464	3.019	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)C(C)(C)C2CCCC2)[C@@H](O)C1	ZINC001219814224	1373733631	/nfs/dbraw/zinc/73/36/31/1373733631.db2.gz	YWKYWYHXGXHPJK-MSOLQXFVSA-N	0	3	336.520	3.111	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2ccc(CCC)cc2)[C@@H](O)C1	ZINC001220235844	1373759995	/nfs/dbraw/zinc/75/99/95/1373759995.db2.gz	UQXQZVOJUBQHMV-UXHICEINSA-N	0	3	346.515	3.384	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)C(CCC)CCC)[C@@H](O)C1	ZINC001220237502	1373760195	/nfs/dbraw/zinc/76/01/95/1373760195.db2.gz	ZLLMFDPOFMXHMF-MSOLQXFVSA-N	0	3	326.525	3.335	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)CCCCC(C)C)C[C@H](C)O2	ZINC001131694200	1373767972	/nfs/dbraw/zinc/76/79/72/1373767972.db2.gz	VYLKSISWFBDQOR-AZUAARDMSA-N	0	3	336.520	3.471	20	30		EGEDHN
CC[C@H](C)CC(=O)NCC1(NCc2ccc(OC)c(C#N)c2)CCC1	ZINC001326809961	1388318079	/nfs/dbraw/zinc/31/80/79/1388318079.db2.gz	PAVRQZNMCVYMSG-HNNXBMFYSA-N	0	3	343.471	3.132	20	30		EGEDHN
C#CCCCC(=O)NCC1CCN(Cc2cc(C)ccc2F)CC1	ZINC001223012927	1375029287	/nfs/dbraw/zinc/02/92/87/1375029287.db2.gz	QCLWVFAJDHVDJO-UHFFFAOYSA-N	0	3	330.447	3.266	20	30		EGEDHN
CC#CCCCC(=O)NCC1CCN(Cc2c(C)nsc2C)CC1	ZINC001224157929	1375057212	/nfs/dbraw/zinc/05/72/12/1375057212.db2.gz	LVMUXCGHSQIRAQ-UHFFFAOYSA-N	0	3	347.528	3.282	20	30		EGEDHN
C=CCOCC(=O)N[C@H]1CC[C@H](C)N(Cc2ccc(C(C)C)cc2)C1	ZINC001131947882	1375063466	/nfs/dbraw/zinc/06/34/66/1375063466.db2.gz	YVCPGVVHKBTHLQ-PXNSSMCTSA-N	0	3	344.499	3.482	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CC[C@H](C)N(CCCOc2ccccc2)C1	ZINC001131995366	1375088043	/nfs/dbraw/zinc/08/80/43/1375088043.db2.gz	JRDOROXVOPXXLP-OALUTQOASA-N	0	3	342.483	3.228	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CC[C@H](C)N(Cc2ccccc2N(C)C)C1	ZINC001132001591	1375091106	/nfs/dbraw/zinc/09/11/06/1375091106.db2.gz	AZTXEGWXVJRRIA-HKUYNNGSSA-N	0	3	341.499	3.025	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CC[C@H](C)N(Cc2ccc(COC)cc2)C1	ZINC001132001937	1375092498	/nfs/dbraw/zinc/09/24/98/1375092498.db2.gz	FRUHEEDEARTSHX-PXNSSMCTSA-N	0	3	342.483	3.106	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CC[C@@H](C)N(Cc2ccc(OC)c(C)c2)C1	ZINC001132003249	1375093672	/nfs/dbraw/zinc/09/36/72/1375093672.db2.gz	RTUWIBNQLXIFJZ-MJGOQNOKSA-N	0	3	342.483	3.276	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1CC[C@@H](C)N(Cc2cccc3cccnc32)C1	ZINC001132018846	1375101710	/nfs/dbraw/zinc/10/17/10/1375101710.db2.gz	ZENDJOYGQXTHJA-YLJYHZDGSA-N	0	3	349.478	3.363	20	30		EGEDHN
CCc1ccccc1CCN1C[C@@H](NC(=O)C#CC(C)C)CC[C@@H]1C	ZINC001132022163	1375103763	/nfs/dbraw/zinc/10/37/63/1375103763.db2.gz	VTPYIJMBFSKJOL-RXVVDRJESA-N	0	3	340.511	3.420	20	30		EGEDHN
C[C@H]1CC[C@@H](NC(=O)C#CC2CC2)CN1Cc1ccc2cc[nH]c2c1	ZINC001132034408	1375109953	/nfs/dbraw/zinc/10/99/53/1375109953.db2.gz	QVGNDFAAEXFMDE-HNAYVOBHSA-N	0	3	335.451	3.050	20	30		EGEDHN
C[C@@H]1CC[C@@H](NC(=O)C#CC(C)(C)C)CN1CC1CC(F)(F)C1	ZINC001132037425	1375110408	/nfs/dbraw/zinc/11/04/08/1375110408.db2.gz	BRNNMMUIDACCCW-UKRRQHHQSA-N	0	3	326.431	3.050	20	30		EGEDHN
C[C@H]1CC[C@H](NC(=O)C#CC2CC2)CN1CCc1ccc(Cl)cc1	ZINC001132046054	1375115106	/nfs/dbraw/zinc/11/51/06/1375115106.db2.gz	MAWMTTCGTVLFTP-KXBFYZLASA-N	0	3	344.886	3.265	20	30		EGEDHN
C[C@@H]1CC[C@H](NC(=O)C#CC2CC2)CN1CCCc1cccc(F)c1	ZINC001132046705	1375115533	/nfs/dbraw/zinc/11/55/33/1375115533.db2.gz	QPGGDILOTWGESA-UZLBHIALSA-N	0	3	342.458	3.141	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)C[C@@H](C)c2ccc(OC)cc2)CC1	ZINC001225525514	1375117986	/nfs/dbraw/zinc/11/79/86/1375117986.db2.gz	ONZGCSTVUJBFKJ-QGZVFWFLSA-N	0	3	342.483	3.040	20	30		EGEDHN
C=C[C@H](C(=O)NCC1CCN(Cc2ccccn2)CC1)c1ccccc1	ZINC001225535099	1375120997	/nfs/dbraw/zinc/12/09/97/1375120997.db2.gz	VFJQBQYQDQXYCQ-NRFANRHFSA-N	0	3	349.478	3.380	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NCC1CCN([C@H](C)c2ccc(F)cc2)CC1	ZINC001225631234	1375135897	/nfs/dbraw/zinc/13/58/97/1375135897.db2.gz	JVPDNYNZBUDOPK-HZPDHXFCSA-N	0	3	348.462	3.306	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@H]1CC[C@@H](C)N(CCOC2CCC2)C1	ZINC001132079394	1375136130	/nfs/dbraw/zinc/13/61/30/1375136130.db2.gz	XZXJIWZOBLDDSZ-HIFRSBDPSA-N	0	3	342.911	3.303	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@@H](C)Cc2cccc(Cl)c2)CC1	ZINC001225693941	1375145708	/nfs/dbraw/zinc/14/57/08/1375145708.db2.gz	FQEOMLAJUKIMQW-INIZCTEOSA-N	0	3	346.902	3.370	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)Cc2c(C)oc3ccccc32)CC1	ZINC001225704037	1375147750	/nfs/dbraw/zinc/14/77/50/1375147750.db2.gz	ZHKPUBDCHKUJKF-UHFFFAOYSA-N	0	3	338.451	3.135	20	30		EGEDHN
Cc1ccn(C)c1C(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1	ZINC001225884631	1375168908	/nfs/dbraw/zinc/16/89/08/1375168908.db2.gz	PRNTXVFYLDKZFQ-WOJBJXKFSA-N	0	3	349.478	3.016	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CC[C@@H](C)N(CCn2nc(C)cc2C)C1	ZINC001132218543	1375217000	/nfs/dbraw/zinc/21/70/00/1375217000.db2.gz	RMVKSEIQOZZPDT-SJLPKXTDSA-N	0	3	346.519	3.071	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CC[C@@H](C)N(CCOc2ccccc2)C1	ZINC001132249541	1375245756	/nfs/dbraw/zinc/24/57/56/1375245756.db2.gz	QCMSRTQRHBTBLZ-QZTJIDSGSA-N	0	3	330.472	3.391	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1CCCC[C@H]1NCc1conc1C	ZINC001226434148	1375257801	/nfs/dbraw/zinc/25/78/01/1375257801.db2.gz	DPNXYZKZQGDCON-QZTJIDSGSA-N	0	3	331.460	3.268	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CCCC[C@H]1N[C@H](C)c1cnc(C)cn1	ZINC001226522573	1375274433	/nfs/dbraw/zinc/27/44/33/1375274433.db2.gz	DWGWTPQEMLRAFK-BRWVUGGUSA-N	0	3	330.476	3.219	20	30		EGEDHN
C[C@H](C#N)C(=O)NC1CCN([C@@H]2CCc3ccc(Cl)cc32)CC1	ZINC001226641285	1375298399	/nfs/dbraw/zinc/29/83/99/1375298399.db2.gz	XYEJFCHNGJWPPJ-SJKOYZFVSA-N	0	3	331.847	3.068	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)CCc2ccccc2C)CC[C@H]1C	ZINC001132326382	1375305335	/nfs/dbraw/zinc/30/53/35/1375305335.db2.gz	DLRXSAAENGVPFD-UYAOXDASSA-N	0	3	344.499	3.099	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CC[C@H](C)N(CCc2cnn(CC)c2)C1	ZINC001132330564	1375310125	/nfs/dbraw/zinc/31/01/25/1375310125.db2.gz	JFUBMMYONNNKJN-FUHWJXTLSA-N	0	3	346.519	3.017	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COc2c(C)cccc2C)CC[C@H]1C	ZINC001132467023	1375408390	/nfs/dbraw/zinc/40/83/90/1375408390.db2.gz	ARXHZVDEAOMDKQ-MSOLQXFVSA-N	0	3	330.472	3.227	20	30		EGEDHN
CC1(CC(=O)N[C@@H]2CCCC[C@H]2NCc2cc(C#N)ccc2F)CC1	ZINC001227603712	1375451086	/nfs/dbraw/zinc/45/10/86/1375451086.db2.gz	XRALHQSXBCVVRZ-QZTJIDSGSA-N	0	3	343.446	3.405	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2(C(F)(F)F)CCCC2)CC[C@@H]1C	ZINC001132543615	1375451237	/nfs/dbraw/zinc/45/12/37/1375451237.db2.gz	ZGWVGYNVRJVZQB-UONOGXRCSA-N	0	3	330.394	3.102	20	30		EGEDHN
CC#CCN1CC[C@H](CN(Cc2scnc2C)C(=O)/C(C)=C\C)C1	ZINC001132557623	1375463680	/nfs/dbraw/zinc/46/36/80/1375463680.db2.gz	ACHAWGUJWNSGSK-GQMMIMOESA-N	0	3	345.512	3.092	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2N(Cc2ccsc2)C(=O)[C@H](F)CC)CC1	ZINC001132561895	1375468640	/nfs/dbraw/zinc/46/86/40/1375468640.db2.gz	BMOISVXBNJNTGU-IAGOWNOFSA-N	0	3	348.487	3.313	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2N(Cc2nccs2)C(=O)CCCC)CC1	ZINC001132567092	1375470933	/nfs/dbraw/zinc/47/09/33/1375470933.db2.gz	UXYNTKVBSKQBGQ-INIZCTEOSA-N	0	3	345.512	3.150	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CCCC[C@H]1N[C@H](C)c1n[nH]c(CC)n1	ZINC001227926108	1375492470	/nfs/dbraw/zinc/49/24/70/1375492470.db2.gz	WRXGPHCSZCMZFD-RBSFLKMASA-N	0	3	347.507	3.047	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1CCCC[C@H]1NCc1ccc(F)cn1	ZINC001228412985	1375568825	/nfs/dbraw/zinc/56/88/25/1375568825.db2.gz	DUANLRGRMXMKQH-LMMKCTJWSA-N	0	3	333.451	3.340	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@H](C)[C@@H](CNC/C(Cl)=C/Cl)C1	ZINC001132809267	1375575844	/nfs/dbraw/zinc/57/58/44/1375575844.db2.gz	NKNZEHKAGDHJNA-TZBMHECSSA-N	0	3	331.287	3.039	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](C)[C@H](CNCc2nccn2CC)C1	ZINC001132846552	1375598233	/nfs/dbraw/zinc/59/82/33/1375598233.db2.gz	JTCYZLWKRBHBKR-IAGOWNOFSA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC1CCN(Cc2sc(C)nc2C)CC1	ZINC001228580594	1375604607	/nfs/dbraw/zinc/60/46/07/1375604607.db2.gz	XEGCMSYEJSFDPN-UHFFFAOYSA-N	0	3	335.517	3.443	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC001228747462	1375661126	/nfs/dbraw/zinc/66/11/26/1375661126.db2.gz	BAAFOQKDNVFBBS-CVEARBPZSA-N	0	3	330.472	3.234	20	30		EGEDHN
CC#CCCCC(=O)NC1CCN(Cc2ccc(C)c(OC)c2)CC1	ZINC001228770727	1375671376	/nfs/dbraw/zinc/67/13/76/1375671376.db2.gz	QXSMCXNSVJQKIE-UHFFFAOYSA-N	0	3	342.483	3.278	20	30		EGEDHN
C[C@@H]1CCN(C(=O)CCC(F)F)C[C@H]1CNCc1ccccc1C#N	ZINC001132986281	1375695311	/nfs/dbraw/zinc/69/53/11/1375695311.db2.gz	DZQXFXMYLUDPMR-RHSMWYFYSA-N	0	3	349.425	3.178	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1	ZINC001228903129	1375709976	/nfs/dbraw/zinc/70/99/76/1375709976.db2.gz	ZKGXRPXCOQSTEE-DFQSSKMNSA-N	0	3	326.484	3.347	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](C)[C@H](CNCc3cc(C)no3)C2)CCC1	ZINC001133105497	1375777906	/nfs/dbraw/zinc/77/79/06/1375777906.db2.gz	UMUQBJREKPJCJF-NVXWUHKLSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@H]2CN(Cc3cccc(OC)c3)C[C@H]21	ZINC001188908530	1388406075	/nfs/dbraw/zinc/40/60/75/1388406075.db2.gz	GSLONXFZKIPDJV-XKGZKEIXSA-N	0	3	342.483	3.330	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H]2CN(CCCCC(F)(F)F)C[C@H]21	ZINC001188903145	1388405529	/nfs/dbraw/zinc/40/55/29/1388405529.db2.gz	LBHWYLJMHZTXLN-JKSUJKDBSA-N	0	3	344.421	3.445	20	30		EGEDHN
N#Cc1cc(Br)c(OC2CCN(C3CC3)CC2)cc1F	ZINC001229889680	1375913343	/nfs/dbraw/zinc/91/33/43/1375913343.db2.gz	GPCHAJKTYBFKBC-UHFFFAOYSA-N	0	3	339.208	3.465	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2ccc3c(c2)CCC=C3)CC1	ZINC001230058923	1375937655	/nfs/dbraw/zinc/93/76/55/1375937655.db2.gz	DWMONSIIZFYMCD-UHFFFAOYSA-N	0	3	340.467	3.043	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1ccoc1	ZINC001133379828	1375960097	/nfs/dbraw/zinc/96/00/97/1375960097.db2.gz	IMOJFIXLTFAGEP-UHFFFAOYSA-N	0	3	330.815	3.188	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1cncs1	ZINC001133389538	1375973569	/nfs/dbraw/zinc/97/35/69/1375973569.db2.gz	VZTFLZQZEKSJSN-UHFFFAOYSA-N	0	3	347.871	3.052	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C1(C2CC2)CC1	ZINC001133399367	1375983488	/nfs/dbraw/zinc/98/34/88/1375983488.db2.gz	LDVDCEWRSMVKQM-UHFFFAOYSA-N	0	3	330.859	3.082	20	30		EGEDHN
CC#CCCCC(=O)N(CCNCC#CC)Cc1cccc(Cl)c1	ZINC001133403586	1375987620	/nfs/dbraw/zinc/98/76/20/1375987620.db2.gz	ABXQCONTMAKASE-UHFFFAOYSA-N	0	3	344.886	3.475	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)C[C@@H]1C[C@@H]1C	ZINC001133403641	1375988433	/nfs/dbraw/zinc/98/84/33/1375988433.db2.gz	BXJQEGFXGKAZQF-RDJZCZTQSA-N	0	3	332.875	3.328	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C[C@@H](C=C)CC	ZINC001133405900	1375991551	/nfs/dbraw/zinc/99/15/51/1375991551.db2.gz	VXGUGPLNGLDPHQ-INIZCTEOSA-N	0	3	332.875	3.494	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@H](CCC)c3ccccn3)[C@@H]2C1	ZINC001188948805	1388418315	/nfs/dbraw/zinc/41/83/15/1388418315.db2.gz	HRLXZOWLWSNJBO-YQVWRLOYSA-N	0	3	327.472	3.074	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)c1ccc(F)cc1)NCc1ccccc1C#N	ZINC001133550173	1376079776	/nfs/dbraw/zinc/07/97/76/1376079776.db2.gz	NYGNYUXCWHUMCF-GJZGRUSLSA-N	0	3	339.414	3.384	20	30		EGEDHN
C[C@@H](CC(=O)NCCNCc1ccc(C#N)s1)c1cccc(F)c1	ZINC001133612070	1376121394	/nfs/dbraw/zinc/12/13/94/1376121394.db2.gz	JRACFAKEGWNPRE-ZDUSSCGKSA-N	0	3	345.443	3.158	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)c1ccsc1)NCc1cc(F)ccc1C#N	ZINC001133633921	1376130109	/nfs/dbraw/zinc/13/01/09/1376130109.db2.gz	ZTEOADYTOWRQBB-CHWSQXEVSA-N	0	3	345.443	3.446	20	30		EGEDHN
C[C@H](F)CCN(CCCNC(=O)C#CC(C)(C)C)Cc1cccnc1	ZINC001230756619	1376140165	/nfs/dbraw/zinc/14/01/65/1376140165.db2.gz	ANPCLNKYHHMZCO-KRWDZBQOSA-N	0	3	347.478	3.188	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)[C@H]1Cc2ccccc21)Cc1cccnc1	ZINC001230829971	1376162872	/nfs/dbraw/zinc/16/28/72/1376162872.db2.gz	STPQONOGVPCLSP-NRFANRHFSA-N	0	3	349.478	3.306	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)CC/C=C\c2ccccc2)c1	ZINC001133700839	1376164755	/nfs/dbraw/zinc/16/47/55/1376164755.db2.gz	UFWZGVGEVFWNEG-WTKPLQERSA-N	0	3	333.435	3.258	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)[C@H]1CC12CCC2)Cc1cccnc1	ZINC001230861158	1376169366	/nfs/dbraw/zinc/16/93/66/1376169366.db2.gz	AYQXNZWAHDIXBB-GOSISDBHSA-N	0	3	327.472	3.156	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)[C@@H]1C[C@@]1(C)CC)Cc1cccnc1	ZINC001230881952	1376176722	/nfs/dbraw/zinc/17/67/22/1376176722.db2.gz	KVFGIRJULXQAIT-AZUAARDMSA-N	0	3	329.488	3.402	20	30		EGEDHN
CN(CCC#N)c1ccc(CN2CCC3(CC(F)(F)CO3)CC2)cc1	ZINC001231816392	1376320542	/nfs/dbraw/zinc/32/05/42/1376320542.db2.gz	NICHLDUOFJDHLH-UHFFFAOYSA-N	0	3	349.425	3.427	20	30		EGEDHN
C#CCCCC(=O)N[C@H](C)C[C@@H](C)NCc1oc(C(C)C)nc1C	ZINC001134201850	1376415064	/nfs/dbraw/zinc/41/50/64/1376415064.db2.gz	SWZAJCMDSOJIJE-HUUCEWRRSA-N	0	3	333.476	3.283	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1ccccc1C#N)NC(=O)C1CC(C)(C)C1	ZINC001134252856	1376438054	/nfs/dbraw/zinc/43/80/54/1376438054.db2.gz	WAEJHOFYHIRODC-LSDHHAIUSA-N	0	3	327.472	3.367	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1c(F)cccc1F)NC(=O)C#CC(C)(C)C	ZINC001134328665	1376479483	/nfs/dbraw/zinc/47/94/83/1376479483.db2.gz	FPVDKCUHPOXDMP-UONOGXRCSA-N	0	3	336.426	3.387	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H](C)C[C@@H](C)NCc1ccn(C2CCCC2)n1	ZINC001134341571	1376484457	/nfs/dbraw/zinc/48/44/57/1376484457.db2.gz	QJXQTFIXMIEQJC-SJORKVTESA-N	0	3	344.503	3.031	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H](C)C[C@H](C)NCc1nccs1	ZINC001134457390	1376548919	/nfs/dbraw/zinc/54/89/19/1376548919.db2.gz	NHYJOBCXJBAMPB-QWRGUYRKSA-N	0	3	329.897	3.295	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCC(NC(=O)C2CCCC2)CC1	ZINC001233083111	1376567724	/nfs/dbraw/zinc/56/77/24/1376567724.db2.gz	UYWKPAORFDDGCK-UHFFFAOYSA-N	0	3	325.456	3.138	20	30		EGEDHN
COc1ccc(O[C@@H]2CCCN(Cc3ccc(C#N)cc3C)C2)nc1	ZINC001233083353	1376567786	/nfs/dbraw/zinc/56/77/86/1376567786.db2.gz	HAACWGWGRWMMMW-LJQANCHMSA-N	0	3	337.423	3.314	20	30		EGEDHN
C[C@@H](CCC(=O)NCCNCc1ccc(C#N)cc1)c1ccccc1	ZINC001134806614	1376734952	/nfs/dbraw/zinc/73/49/52/1376734952.db2.gz	MAQYOEBGMSRQEK-KRWDZBQOSA-N	0	3	335.451	3.348	20	30		EGEDHN
CCCCCC(=O)NCCCN(C)Cc1ccc(OC)c(C#N)c1	ZINC001233979144	1376747993	/nfs/dbraw/zinc/74/79/93/1376747993.db2.gz	YHFVKMDNKKGIMK-UHFFFAOYSA-N	0	3	331.460	3.085	20	30		EGEDHN
C=CCCCN1CC[C@@H]1CN(C)C(=O)c1csc([C@@H]2CCCO2)n1	ZINC001234333458	1376813444	/nfs/dbraw/zinc/81/34/44/1376813444.db2.gz	KKQBZFIKHJJYFV-ZBFHGGJFSA-N	0	3	349.500	3.107	20	30		EGEDHN
CCCCCCCN1CC[C@@H]1CN(C)C(=O)Cc1ccncc1C	ZINC001234356333	1376817737	/nfs/dbraw/zinc/81/77/37/1376817737.db2.gz	HNVPMYKSZKUIFM-LJQANCHMSA-N	0	3	331.504	3.436	20	30		EGEDHN
CCCCCCCN1CC[C@H]1CN(C)C(=O)c1cc(C2CC2)n(C)n1	ZINC001235035651	1376834067	/nfs/dbraw/zinc/83/40/67/1376834067.db2.gz	FYGLKDSJTGSXTI-KRWDZBQOSA-N	0	3	346.519	3.414	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)CC1(C)CC1)NCc1cc(F)ccc1C#N	ZINC001135061751	1376874336	/nfs/dbraw/zinc/87/43/36/1376874336.db2.gz	DTKSTIZCBAQNLB-KBPBESRZSA-N	0	3	331.435	3.260	20	30		EGEDHN
C=CCCCCCN1CC[C@@H]1CN(C)C(=O)c1cc2cccn2cn1	ZINC001235725733	1376886619	/nfs/dbraw/zinc/88/66/19/1376886619.db2.gz	UGAUBEFHACFSJN-GOSISDBHSA-N	0	3	340.471	3.227	20	30		EGEDHN
Cc1ccc(-c2nccnc2C(C#N)C(=O)OC(C)(C)C)c2c[nH]nc21	ZINC001236486437	1376954598	/nfs/dbraw/zinc/95/45/98/1376954598.db2.gz	KBNAGIYMEFWWEP-CYBMUJFWSA-N	0	3	349.394	3.277	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H](C)C[C@H](C)NCc2nc(C)cs2)cc1	ZINC001135185360	1376958171	/nfs/dbraw/zinc/95/81/71/1376958171.db2.gz	YJFWPWWXQCRZTC-KBPBESRZSA-N	0	3	341.480	3.120	20	30		EGEDHN
C=CCO[C@@H]1CO[C@@]2(C1)CCCN(Cc1ccc(C#N)c(CC)c1)C2	ZINC001238775185	1377000936	/nfs/dbraw/zinc/00/09/36/1377000936.db2.gz	PCKORSQGQHPTDE-LEWJYISDSA-N	0	3	340.467	3.447	20	30		EGEDHN
C[C@]1(C(=O)NCCNCc2cccc(C#N)c2)CCCc2ccccc21	ZINC001135349730	1377047127	/nfs/dbraw/zinc/04/71/27/1377047127.db2.gz	AXXSYOFHWMDZAT-QFIPXVFZSA-N	0	3	347.462	3.058	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)C1(C)CC=CC1)NCc1cc(F)ccc1C#N	ZINC001135411167	1377080605	/nfs/dbraw/zinc/08/06/05/1377080605.db2.gz	LROCGJXJPMFWRS-CABCVRRESA-N	0	3	343.446	3.427	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)C1(C)CC=CC1)NCc1ccccc1C#N	ZINC001135412704	1377081015	/nfs/dbraw/zinc/08/10/15/1377081015.db2.gz	UTMHAPMHARPQPO-HOTGVXAUSA-N	0	3	325.456	3.287	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H](C)C[C@@H](C)NCc2cc(C3CC3)no2)C1	ZINC001135426290	1377090131	/nfs/dbraw/zinc/09/01/31/1377090131.db2.gz	BVHKVBORNNCFRV-KGLIPLIRSA-N	0	3	331.460	3.281	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)C1CC2(CC2)C1)NCc1ccccc1C#N	ZINC001135452395	1377102478	/nfs/dbraw/zinc/10/24/78/1377102478.db2.gz	SXILFEQVFMDNDK-CABCVRRESA-N	0	3	325.456	3.121	20	30		EGEDHN
COc1cc(C#N)ccc1C(=O)N[C@H](CN1CCCC1)c1ccccc1	ZINC001135613151	1377161792	/nfs/dbraw/zinc/16/17/92/1377161792.db2.gz	PGUOLASBYBNCJO-LJQANCHMSA-N	0	3	349.434	3.134	20	30		EGEDHN
CC(C)[C@H]1CC[C@H](C(=O)NCCNCc2ccc(C#N)c(F)c2)CC1	ZINC001135734069	1377196981	/nfs/dbraw/zinc/19/69/81/1377196981.db2.gz	LFMBGVVXPJZUBA-QAQDUYKDSA-N	0	3	345.462	3.366	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CC[C@H](N(C)Cc2cc(F)ccc2C)C1	ZINC001189241951	1388493239	/nfs/dbraw/zinc/49/32/39/1388493239.db2.gz	BLAGVBSYEXILSE-APWZRJJASA-N	0	3	348.462	3.148	20	30		EGEDHN
CCN(CCNC(=O)c1cccc2cc[nH]c21)Cc1cccc(C#N)c1	ZINC001267250619	1377431493	/nfs/dbraw/zinc/43/14/93/1377431493.db2.gz	RSQKIDDYDHKBFF-UHFFFAOYSA-N	0	3	346.434	3.291	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cc(F)ccc1OC)CC2	ZINC001138372375	1377711449	/nfs/dbraw/zinc/71/14/49/1377711449.db2.gz	OMFYYXYRAYGONG-FQEVSTJZSA-N	0	3	346.446	3.367	20	30		EGEDHN
C#CCOc1ccc(CN2CCC[C@H](C(=O)OC(C)(C)C)C2)cc1	ZINC001138558953	1377741939	/nfs/dbraw/zinc/74/19/39/1377741939.db2.gz	LQDHASDFNUFYQF-KRWDZBQOSA-N	0	3	329.440	3.252	20	30		EGEDHN
C#CCOc1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC001138559628	1377742053	/nfs/dbraw/zinc/74/20/53/1377742053.db2.gz	YOLQNBNJYCSUEI-FQEVSTJZSA-N	0	3	325.383	3.491	20	30		EGEDHN
C=CCc1cccc(CN2CCN(c3ccccc3C#N)CC2)c1O	ZINC001138623404	1377754824	/nfs/dbraw/zinc/75/48/24/1377754824.db2.gz	FGBAQLJIOVKFCO-UHFFFAOYSA-N	0	3	333.435	3.315	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CCN(c3ccccc3C#N)CC2)c1[O-]	ZINC001138623404	1377754827	/nfs/dbraw/zinc/75/48/27/1377754827.db2.gz	FGBAQLJIOVKFCO-UHFFFAOYSA-N	0	3	333.435	3.315	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@@H]3OCCC[C@]3(COC)C2)c1[O-]	ZINC001138627801	1377756606	/nfs/dbraw/zinc/75/66/06/1377756606.db2.gz	PDVHTGLXIRRLMN-AZUAARDMSA-N	0	3	331.456	3.138	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@@H]3OCCC[C@]3(COC)C2)c1[O-]	ZINC001138627801	1377756610	/nfs/dbraw/zinc/75/66/10/1377756610.db2.gz	PDVHTGLXIRRLMN-AZUAARDMSA-N	0	3	331.456	3.138	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@H](Oc3cc(OC)ccn3)C2)c1[O-]	ZINC001138631372	1377757425	/nfs/dbraw/zinc/75/74/25/1377757425.db2.gz	QTXJCEKFKUWGAJ-SFHVURJKSA-N	0	3	340.423	3.178	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@H](Oc3cc(OC)ccn3)C2)c1[O-]	ZINC001138631372	1377757431	/nfs/dbraw/zinc/75/74/31/1377757431.db2.gz	QTXJCEKFKUWGAJ-SFHVURJKSA-N	0	3	340.423	3.178	20	30		EGEDHN
N#Cc1ccc(N2CCCN(Cc3ccc4occc4c3)CC2)nc1	ZINC001138825369	1377792665	/nfs/dbraw/zinc/79/26/65/1377792665.db2.gz	XDVLCLDTAWZOSV-UHFFFAOYSA-N	0	3	332.407	3.412	20	30		EGEDHN
C=CCOc1ccccc1CN1CCC[C@@]2(C[C@H](OCC)CO2)C1	ZINC001139027919	1377819191	/nfs/dbraw/zinc/81/91/91/1377819191.db2.gz	FSNWVHHMZMOOBJ-AZUAARDMSA-N	0	3	331.456	3.411	20	30		EGEDHN
C=CCOc1ccccc1CN1CCC2(CCN(C(C)C)C2=O)CC1	ZINC001139030339	1377819747	/nfs/dbraw/zinc/81/97/47/1377819747.db2.gz	FNEXDDVREAJSQU-UHFFFAOYSA-N	0	3	342.483	3.474	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCCN(Cc3ccc4nonc4c3)C2)cc1	ZINC001139223762	1377855730	/nfs/dbraw/zinc/85/57/30/1377855730.db2.gz	YXIGFKWMVNTUHO-QGZVFWFLSA-N	0	3	334.379	3.138	20	30		EGEDHN
C[C@@]1(O)CCCN(Cc2ccc(Oc3ccc(C#N)cc3)nc2)CC1	ZINC001139424368	1377881735	/nfs/dbraw/zinc/88/17/35/1377881735.db2.gz	PTBXUXGCJRSKBQ-HXUWFJFHSA-N	0	3	337.423	3.482	20	30		EGEDHN
CN1CCN(Cc2ccc(Oc3ccc(C#N)cc3)nc2)CC1(C)C	ZINC001139427435	1377882438	/nfs/dbraw/zinc/88/24/38/1377882438.db2.gz	FPJFEJPHLYFYON-UHFFFAOYSA-N	0	3	336.439	3.272	20	30		EGEDHN
Cc1ccc(CN2CC[C@]3(C2)CCCN(c2ncccn2)C3)cc1C#N	ZINC001139723575	1377941391	/nfs/dbraw/zinc/94/13/91/1377941391.db2.gz	BQGORIRDLAPGOV-NRFANRHFSA-N	0	3	347.466	3.149	20	30		EGEDHN
C=CCO[C@@H]1CO[C@]2(C1)CCCN(Cc1ccc(C)c(C#N)c1)C2	ZINC001139723758	1377941621	/nfs/dbraw/zinc/94/16/21/1377941621.db2.gz	FUIQBWFFVFNCEL-PMACEKPBSA-N	0	3	326.440	3.193	20	30		EGEDHN
CCC(=O)N(CC)C1CCN(Cc2c[nH]c3ccc(C#N)cc23)CC1	ZINC001140116989	1378011730	/nfs/dbraw/zinc/01/17/30/1378011730.db2.gz	KAPYUTILYSOJII-UHFFFAOYSA-N	0	3	338.455	3.262	20	30		EGEDHN
N#Cc1ccc(N2CCN(Cc3cccc4cnccc43)CC2)cc1	ZINC001140144331	1378020641	/nfs/dbraw/zinc/02/06/41/1378020641.db2.gz	BMIRTRYIIQKATC-UHFFFAOYSA-N	0	3	328.419	3.429	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3ccc(OC)cc3F)CC2)C1=O	ZINC001272668577	1378078288	/nfs/dbraw/zinc/07/82/88/1378078288.db2.gz	QMLPXVIMIZLCSF-HXUWFJFHSA-N	0	3	346.446	3.225	20	30		EGEDHN
C=CCNC(=O)[C@H]1CC12CC[NH+](Cc1cccc(CC=C)c1[O-])CC2	ZINC001273360897	1378099018	/nfs/dbraw/zinc/09/90/18/1378099018.db2.gz	XQJUPOIJCXNRLP-GOSISDBHSA-N	0	3	340.467	3.025	20	30		EGEDHN
C=CCOC[C@H]1CCC[C@@]12CN(Cc1cc(C)ccc1O)CCO2	ZINC001140620156	1378099466	/nfs/dbraw/zinc/09/94/66/1378099466.db2.gz	DXRDCSDLHNTMIM-UYAOXDASSA-N	0	3	331.456	3.274	20	30		EGEDHN
C=CCN1C(=O)CCC[C@@]12CCC[N@@H+](Cc1ccc(C)cc1[O-])C2	ZINC001140952422	1378189637	/nfs/dbraw/zinc/18/96/37/1378189637.db2.gz	RIYCYHRSLJLBGE-FQEVSTJZSA-N	0	3	328.456	3.234	20	30		EGEDHN
C=CCN1C(=O)CCC[C@@]12CCC[N@H+](Cc1ccc(C)cc1[O-])C2	ZINC001140952422	1378189639	/nfs/dbraw/zinc/18/96/39/1378189639.db2.gz	RIYCYHRSLJLBGE-FQEVSTJZSA-N	0	3	328.456	3.234	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@H]1CC[N@@H+](Cc1ccc(C)cc1[O-])C2	ZINC001140952053	1378189861	/nfs/dbraw/zinc/18/98/61/1378189861.db2.gz	CRRRTHZQRAKIKM-PMACEKPBSA-N	0	3	331.456	3.274	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@H]1CC[N@H+](Cc1ccc(C)cc1[O-])C2	ZINC001140952053	1378189863	/nfs/dbraw/zinc/18/98/63/1378189863.db2.gz	CRRRTHZQRAKIKM-PMACEKPBSA-N	0	3	331.456	3.274	20	30		EGEDHN
CC(C)(C)[C@H](CNCc1cc(C#N)ccc1F)NC(=O)[C@H]1CC1(C)C	ZINC001278956685	1378293825	/nfs/dbraw/zinc/29/38/25/1378293825.db2.gz	NULUZSDPMJKUNS-WBVHZDCISA-N	0	3	345.462	3.364	20	30		EGEDHN
CNC(=O)C1CCN(Cc2ccc(C#Cc3ccccc3)s2)CC1	ZINC001141972779	1378400392	/nfs/dbraw/zinc/40/03/92/1378400392.db2.gz	QZHHLEBFJZQOBP-UHFFFAOYSA-N	0	3	338.476	3.106	20	30		EGEDHN
CCc1nc(C2CCN(Cc3c[nH]c4cc(C#N)ccc34)CC2)no1	ZINC001142922821	1378509817	/nfs/dbraw/zinc/50/98/17/1378509817.db2.gz	XGZZPNMLAVMBEY-UHFFFAOYSA-N	0	3	335.411	3.365	20	30		EGEDHN
Cc1cnc(O[C@H]2CCCN(Cc3c[nH]c4cc(C#N)ccc34)C2)nc1	ZINC001142932334	1378511612	/nfs/dbraw/zinc/51/16/12/1378511612.db2.gz	YXUGESZWUUJKGX-KRWDZBQOSA-N	0	3	347.422	3.181	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@H]1CCN(Cc1cc3cccnc3[nH]1)C2	ZINC001143214360	1378561580	/nfs/dbraw/zinc/56/15/80/1378561580.db2.gz	OCJMAPFNICPJOX-ICSRJNTNSA-N	0	3	341.455	3.137	20	30		EGEDHN
COC(=O)[C@@H](c1ccccc1)[C@H]1CCCCN1Cc1cncc(C#N)c1	ZINC001144083627	1378680639	/nfs/dbraw/zinc/68/06/39/1378680639.db2.gz	LXTNERDUIUOUJQ-UXHICEINSA-N	0	3	349.434	3.265	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2ccc3sccc3c2)c1	ZINC001146316915	1378815927	/nfs/dbraw/zinc/81/59/27/1378815927.db2.gz	PACIWOQWRZLONH-UHFFFAOYSA-N	0	3	335.432	3.293	20	30		EGEDHN
Cc1oc(C(C)C)cc1C(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001146350031	1378823620	/nfs/dbraw/zinc/82/36/20/1378823620.db2.gz	PLEWWRVMUOBVRH-UHFFFAOYSA-N	0	3	343.402	3.242	20	30		EGEDHN
C=CCCC(=O)N1CC2(C1)CCN(CCOc1cc(C)ccc1C)C2	ZINC001147188200	1378984476	/nfs/dbraw/zinc/98/44/76/1378984476.db2.gz	UDDIYWBIWZNKQB-UHFFFAOYSA-N	0	3	342.483	3.183	20	30		EGEDHN
C=CCOCC(=O)N1CC2(C1)CCN([C@@H](C)c1cccc(Cl)c1)C2	ZINC001147255973	1378998068	/nfs/dbraw/zinc/99/80/68/1378998068.db2.gz	GGVVPWZSEVZDMH-HNNXBMFYSA-N	0	3	348.874	3.138	20	30		EGEDHN
CC[C@H](C)CC(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001147450754	1379022923	/nfs/dbraw/zinc/02/29/23/1379022923.db2.gz	LLHXNIZJUXQABT-INIZCTEOSA-N	0	3	325.456	3.029	20	30		EGEDHN
Cc1ccc([C@H](C)C(=O)NCCNCc2ccc(C#N)c(F)c2)s1	ZINC001147779135	1379077198	/nfs/dbraw/zinc/07/71/98/1379077198.db2.gz	WSJYIKXYSHKEFA-ZDUSSCGKSA-N	0	3	345.443	3.077	20	30		EGEDHN
C=CCCCC(=O)N1CC2(C1)CCN(CCOc1cccc(F)c1)C2	ZINC001148180826	1379129111	/nfs/dbraw/zinc/12/91/11/1379129111.db2.gz	CJPCDFGEUWIBHH-UHFFFAOYSA-N	0	3	346.446	3.095	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@H](C)CCc3ccccc3F)C2)C1	ZINC001148298204	1379148476	/nfs/dbraw/zinc/14/84/76/1379148476.db2.gz	LVQUGLWFGIYPKQ-MRXNPFEDSA-N	0	3	330.447	3.115	20	30		EGEDHN
CC[C@H](C)[C@@H](C)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001148500592	1379191724	/nfs/dbraw/zinc/19/17/24/1379191724.db2.gz	JLZYGSLVBJJEHW-DLBZAZTESA-N	0	3	339.483	3.275	20	30		EGEDHN
C=CCCOCC(=O)N1CC2(C1)CCN([C@H](C)c1ccc(F)cc1)C2	ZINC001148874528	1379288990	/nfs/dbraw/zinc/28/89/90/1379288990.db2.gz	ZOVCMLUTJUXYOC-MRXNPFEDSA-N	0	3	346.446	3.014	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2cccc(Cl)c2Cl)c1	ZINC001148896977	1379294026	/nfs/dbraw/zinc/29/40/26/1379294026.db2.gz	JWIYZJVNPWDKQP-UHFFFAOYSA-N	0	3	348.233	3.385	20	30		EGEDHN
Cc1ccsc1CCCC(=O)NCCNCc1ccc(C#N)s1	ZINC001149230570	1379351571	/nfs/dbraw/zinc/35/15/71/1379351571.db2.gz	FHXBWEWDKSDFNE-UHFFFAOYSA-N	0	3	347.509	3.218	20	30		EGEDHN
Cc1ccccc1C1(C(=O)NCCNCc2cccc(C#N)c2)CCC1	ZINC001149259900	1379355864	/nfs/dbraw/zinc/35/58/64/1379355864.db2.gz	HVVJIRUIHHKZQB-UHFFFAOYSA-N	0	3	347.462	3.194	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@H]1CN(Cc2ccccc2C)CCCO1	ZINC001149771960	1379442629	/nfs/dbraw/zinc/44/26/29/1379442629.db2.gz	KBVYDEBWKQEHJC-IBGZPJMESA-N	0	3	344.499	3.304	20	30		EGEDHN
Cc1c2ccccc2oc1C(=O)NCCNCc1cccc(C#N)c1	ZINC001150014958	1379484987	/nfs/dbraw/zinc/48/49/87/1379484987.db2.gz	YKVASGORTJWBJP-UHFFFAOYSA-N	0	3	333.391	3.133	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@H]1CN(Cc2cccc(C)c2)CCCO1	ZINC001150138811	1379501139	/nfs/dbraw/zinc/50/11/39/1379501139.db2.gz	FXRFMYUXUDQLDL-ICSRJNTNSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=CCCCC(=O)NC[C@H]1CN([C@@H](C)c2ccccc2)CCCO1	ZINC001150211805	1379516112	/nfs/dbraw/zinc/51/61/12/1379516112.db2.gz	LEWBIXZSCWQSKB-HKUYNNGSSA-N	0	3	330.472	3.311	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@@H]1CN(Cc2cccc(C)c2)CCCO1	ZINC001150373099	1379541377	/nfs/dbraw/zinc/54/13/77/1379541377.db2.gz	WAOOSHHAKBDCCH-LJQANCHMSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)C[C@H](C)c2ccccc2C)C1	ZINC001150404152	1379549702	/nfs/dbraw/zinc/54/97/02/1379549702.db2.gz	URJZMJAGJJVPIB-RBUKOAKNSA-N	0	3	344.499	3.272	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)[C@H](C)c2ccc(CC)cc2)C1	ZINC001150444058	1379553204	/nfs/dbraw/zinc/55/32/04/1379553204.db2.gz	CMVAUPLTOFVFAO-XLIONFOSSA-N	0	3	344.499	3.136	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)[C@H](F)CCCCCC)C1	ZINC001150588021	1379574480	/nfs/dbraw/zinc/57/44/80/1379574480.db2.gz	LYURJPAETZERIE-IAGOWNOFSA-N	0	3	328.472	3.078	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)CC2=CCCCC2)CC1	ZINC001151043157	1379652601	/nfs/dbraw/zinc/65/26/01/1379652601.db2.gz	ZRHALGMHDTUMKB-UHFFFAOYSA-N	0	3	334.504	3.440	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@H]2CCC=CCCC2)CC1	ZINC001151180141	1379673100	/nfs/dbraw/zinc/67/31/00/1379673100.db2.gz	FTNXXKBDODEBCL-SFHVURJKSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2occc2Cl)CC1	ZINC001151295170	1379695811	/nfs/dbraw/zinc/69/58/11/1379695811.db2.gz	XHSHJEIHNBXDOX-UHFFFAOYSA-N	0	3	340.851	3.110	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)C2C[C@@H](C)C[C@H](C)C2)CC1	ZINC001151412557	1379714921	/nfs/dbraw/zinc/71/49/21/1379714921.db2.gz	IZLRGZAMLKJILP-IRXDYDNUSA-N	0	3	336.520	3.232	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)c1ccc(C)o1	ZINC001151721244	1379768866	/nfs/dbraw/zinc/76/88/66/1379768866.db2.gz	RPXIPCCHJNQQJK-CQSZACIVSA-N	0	3	325.412	3.100	20	30		EGEDHN
C=CC[C@H](C(=O)NCCNCc1ccc(Cl)nc1)c1ccccc1	ZINC001151838393	1379793796	/nfs/dbraw/zinc/79/37/96/1379793796.db2.gz	RVMFDJVWYFNYAH-KRWDZBQOSA-N	0	3	343.858	3.301	20	30		EGEDHN
CCCCCC(C)(C)C(=O)NCCNCc1ccc(OC)c(C#N)c1	ZINC001151864499	1379804557	/nfs/dbraw/zinc/80/45/57/1379804557.db2.gz	VNSODAIDHSWQBI-UHFFFAOYSA-N	0	3	345.487	3.379	20	30		EGEDHN
C=C[C@H](CC(=O)NCCNCc1scnc1C)c1ccccc1	ZINC001151943072	1379821260	/nfs/dbraw/zinc/82/12/60/1379821260.db2.gz	PTKHOJALSQBEEB-OAHLLOKOSA-N	0	3	329.469	3.017	20	30		EGEDHN
C=CCC1(C(=O)NCCNCc2ccc(Cl)nc2)CCCCC1	ZINC001152010848	1379837895	/nfs/dbraw/zinc/83/78/95/1379837895.db2.gz	RRDVWROVOCEVQH-UHFFFAOYSA-N	0	3	335.879	3.467	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)CC[C@@H]2CCc3ccccc32)cc1	ZINC001152041537	1379848625	/nfs/dbraw/zinc/84/86/25/1379848625.db2.gz	OSZDNCWLNAOSCI-FQEVSTJZSA-N	0	3	347.462	3.274	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC[C@@H](C)N(CC)Cc1ccc(F)cc1	ZINC001152227778	1379890458	/nfs/dbraw/zinc/89/04/58/1379890458.db2.gz	JBUBGVNGTNCQRD-CVEARBPZSA-N	0	3	336.451	3.134	20	30		EGEDHN
CCN(Cc1ccc(Cl)c(Cl)c1)[C@H](C)CNC(=O)[C@H](C)C#N	ZINC001152412518	1379929618	/nfs/dbraw/zinc/92/96/18/1379929618.db2.gz	BAJIOFZHAYGTDD-VXGBXAGGSA-N	0	3	342.270	3.480	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)Cc1ccc(C)o1	ZINC001152813471	1379983025	/nfs/dbraw/zinc/98/30/25/1379983025.db2.gz	YCVJVDQFIVPYRC-OAHLLOKOSA-N	0	3	339.439	3.029	20	30		EGEDHN
CC1=C(C)C[C@@](C)(C(=O)NCCNCc2cccc(C#N)c2)CC1	ZINC001152934424	1379995975	/nfs/dbraw/zinc/99/59/75/1379995975.db2.gz	HJUWYFRDHJTYQW-FQEVSTJZSA-N	0	3	325.456	3.291	20	30		EGEDHN
CC1=C(C)C[C@@](C)(C(=O)NCCNCc2ccc(C#N)c(F)c2)CC1	ZINC001152933986	1379996193	/nfs/dbraw/zinc/99/61/93/1379996193.db2.gz	CSDRMNXZWOVURZ-FQEVSTJZSA-N	0	3	343.446	3.430	20	30		EGEDHN
CC(C)(C)C12CC(C(=O)NCCNCc3ccc(F)c(C#N)c3)(C1)C2	ZINC001152969680	1379999950	/nfs/dbraw/zinc/99/99/50/1379999950.db2.gz	CSIMXEARJPXCMW-UHFFFAOYSA-N	0	3	343.446	3.120	20	30		EGEDHN
CC1(C)CCC(CC(=O)NCCNCc2cccc(C#N)c2)CC1	ZINC001153870008	1380147057	/nfs/dbraw/zinc/14/70/57/1380147057.db2.gz	ONHXTVZEEZXJFT-UHFFFAOYSA-N	0	3	327.472	3.371	20	30		EGEDHN
CC1(C)CCC(CC(=O)NCCNCc2ccc(C#N)cc2)CC1	ZINC001153870363	1380147201	/nfs/dbraw/zinc/14/72/01/1380147201.db2.gz	ZPWHHLXXQGMULT-UHFFFAOYSA-N	0	3	327.472	3.371	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)C12CCC(CC1)C2	ZINC001154030124	1380186105	/nfs/dbraw/zinc/18/61/05/1380186105.db2.gz	ZFCURGIVDIRUBS-ZGGTZUKQSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C1(c2cccc(F)c2)CCC1	ZINC001154545619	1380302932	/nfs/dbraw/zinc/30/29/32/1380302932.db2.gz	HCSDXNSGZKRTCB-MRXNPFEDSA-N	0	3	330.447	3.097	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H](C)N(CC)Cc1ccnc(N(C)C)c1	ZINC001154584347	1380310654	/nfs/dbraw/zinc/31/06/54/1380310654.db2.gz	DOIMUJGSFJYUCM-MRXNPFEDSA-N	0	3	346.519	3.077	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)[C@@]1(C)C=CCC1	ZINC001154683017	1380331213	/nfs/dbraw/zinc/33/12/13/1380331213.db2.gz	STYUIZLXNUBUOJ-UZLBHIALSA-N	0	3	325.456	3.241	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@H](C)N(CC)C[C@@H](OC)c1ccccc1	ZINC001154747371	1380344621	/nfs/dbraw/zinc/34/46/21/1380344621.db2.gz	OIIDWDLZWHTOKC-UYAOXDASSA-N	0	3	344.499	3.394	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)C(C)(C)C1CC1	ZINC001154757763	1380346663	/nfs/dbraw/zinc/34/66/63/1380346663.db2.gz	UCKHOBQECJLOFS-CQSZACIVSA-N	0	3	345.462	3.460	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)C(C)(C)C1CC1	ZINC001154757574	1380346678	/nfs/dbraw/zinc/34/66/78/1380346678.db2.gz	QPPBVLYUUHBFOY-OAHLLOKOSA-N	0	3	327.472	3.321	20	30		EGEDHN
C=CCCC1(C(=O)NC[C@@H](C)N(CC)C[C@@H](O)c2ccccc2)CC1	ZINC001155037514	1380396626	/nfs/dbraw/zinc/39/66/26/1380396626.db2.gz	SYOUMTHUZFPEAB-IEBWSBKVSA-N	0	3	344.499	3.293	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@@H](C)N(CC)Cc1cccc(C#N)c1	ZINC001155067359	1380402385	/nfs/dbraw/zinc/40/23/85/1380402385.db2.gz	XDVNJUMISDQRQR-UZLBHIALSA-N	0	3	327.472	3.487	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)c1ccc(Cl)[nH]1	ZINC001155089930	1380406556	/nfs/dbraw/zinc/40/65/56/1380406556.db2.gz	RSPDKEGGNXZBRV-CYBMUJFWSA-N	0	3	344.846	3.180	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)C1CC2(CC2)C1	ZINC001155167066	1380417952	/nfs/dbraw/zinc/41/79/52/1380417952.db2.gz	BCEIRXLOTXMDDD-OAHLLOKOSA-N	0	3	325.456	3.075	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)C=C2CCCCC2)c(F)c1	ZINC001155335916	1380438565	/nfs/dbraw/zinc/43/85/65/1380438565.db2.gz	MGKCYJSHNIHUAD-UHFFFAOYSA-N	0	3	329.419	3.184	20	30		EGEDHN
C=C(Cl)CN(CC)[C@H](C)CNC(=O)[C@@H]1CCCCN1CCCC	ZINC001156305501	1380555419	/nfs/dbraw/zinc/55/54/19/1380555419.db2.gz	BDENKUIQZWXXPB-SJORKVTESA-N	0	3	343.943	3.220	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)CCCOc1cccc(C)c1	ZINC001156739734	1380621114	/nfs/dbraw/zinc/62/11/14/1380621114.db2.gz	GSXQMLULDIILLR-GOSISDBHSA-N	0	3	330.472	3.004	20	30		EGEDHN
N#Cc1cc(Cl)nc(C(F)(F)n2nc(CN)c3ccccc32)c1	ZINC001156855447	1380698720	/nfs/dbraw/zinc/69/87/20/1380698720.db2.gz	KCSIFOCUNVOGTB-UHFFFAOYSA-N	0	3	333.729	3.013	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCCC[C@@H]1CN(C)C/C=C/c1ccccc1	ZINC001157695485	1381005183	/nfs/dbraw/zinc/00/51/83/1381005183.db2.gz	BELWGRCDRPEGSW-HKSATOIVSA-N	0	3	325.456	3.172	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1cscc1C	ZINC001157768698	1381028410	/nfs/dbraw/zinc/02/84/10/1381028410.db2.gz	NJYFTZPIYFEPHR-MRXNPFEDSA-N	0	3	336.501	3.186	20	30		EGEDHN
CCC(CC)C(=O)N[C@H]1CCN(Cc2ccc(C#N)cc2)[C@@H](C)C1	ZINC001328237696	1388694204	/nfs/dbraw/zinc/69/42/04/1388694204.db2.gz	BORXCKQXOQGDBD-KXBFYZLASA-N	0	3	327.472	3.464	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)[C@@H]2CCCC3(CC3)C2)c1	ZINC001158011204	1381101642	/nfs/dbraw/zinc/10/16/42/1381101642.db2.gz	RQLLSAMXPGGKPW-MRXNPFEDSA-N	0	3	343.446	3.264	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1CCc2cc(OC)ccc21	ZINC001158061870	1381116936	/nfs/dbraw/zinc/11/69/36/1381116936.db2.gz	SSBRNYGMRKCDAF-YLJYHZDGSA-N	0	3	342.483	3.224	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)[C@H]1CC[C@@H]2C[C@@H]2CC1	ZINC001158255104	1381175438	/nfs/dbraw/zinc/17/54/38/1381175438.db2.gz	SOWXBEJZKIIVEA-IYWMVGAKSA-N	0	3	348.531	3.328	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)Cc1cc(F)c(C)cc1F	ZINC001158271213	1381180300	/nfs/dbraw/zinc/18/03/00/1381180300.db2.gz	SEDHDXKFGCYGQA-MRXNPFEDSA-N	0	3	336.426	3.315	20	30		EGEDHN
Cc1c(F)ccc2nc(Cl)c(C#N)c(-n3ccc([C@@H](C)N)n3)c12	ZINC001158355594	1381214493	/nfs/dbraw/zinc/21/44/93/1381214493.db2.gz	BGPRCEMMMQKALK-SECBINFHSA-N	0	3	329.766	3.413	20	30		EGEDHN
Cc1c(F)cccc1C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001158525704	1381281746	/nfs/dbraw/zinc/28/17/46/1381281746.db2.gz	BVKOXDWWGRHZNG-UHFFFAOYSA-N	0	3	343.377	3.055	20	30		EGEDHN
Cc1nc(N2CCCc3ccc(CN)nc32)c(C#N)c(C)c1Cl	ZINC001158647440	1381336326	/nfs/dbraw/zinc/33/63/26/1381336326.db2.gz	OQAGOWRHPXIMBT-UHFFFAOYSA-N	0	3	327.819	3.162	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1CCCc2sc(C)nc21	ZINC001158739502	1381377111	/nfs/dbraw/zinc/37/71/11/1381377111.db2.gz	LVROZGRZLSETIL-HZPDHXFCSA-N	0	3	347.528	3.370	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)[C@@H](C)c1ccccc1	ZINC001158758392	1381385512	/nfs/dbraw/zinc/38/55/12/1381385512.db2.gz	LSUAIFHCIHVBQN-AZUAARDMSA-N	0	3	344.499	3.306	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)Cc1ccc(OCC)cc1	ZINC001158829569	1381422694	/nfs/dbraw/zinc/42/26/94/1381422694.db2.gz	AWCNINUPVLNDOC-GOSISDBHSA-N	0	3	330.472	3.127	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H]1Cc2cc(C)c(C)cc2O1	ZINC001158893785	1381451191	/nfs/dbraw/zinc/45/11/91/1381451191.db2.gz	CUMAXGQRKMEPMT-UYAOXDASSA-N	0	3	342.483	3.106	20	30		EGEDHN
N#Cc1ccc(CN2CC=C(CCNC(=O)/C=C\C3CC3)CC2)cc1	ZINC001159685906	1381866500	/nfs/dbraw/zinc/86/65/00/1381866500.db2.gz	JUDDSEGSPUOUJD-FPLPWBNLSA-N	0	3	335.451	3.163	20	30		EGEDHN
N#Cc1ccc(CN2CC=C(CCNC(=O)CC3CCC3)CC2)cc1	ZINC001159693619	1381871224	/nfs/dbraw/zinc/87/12/24/1381871224.db2.gz	ORGGZPVMFCVDQZ-UHFFFAOYSA-N	0	3	337.467	3.387	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2coc3c2cccc3OC)CC1	ZINC001160151011	1382017166	/nfs/dbraw/zinc/01/71/66/1382017166.db2.gz	RNHQRVNKOLZQJT-UHFFFAOYSA-N	0	3	340.423	3.379	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2c(C)[nH]c3ccccc32)CC1	ZINC001160635334	1382157599	/nfs/dbraw/zinc/15/75/99/1382157599.db2.gz	LXBBPOGGNNJHOF-UHFFFAOYSA-N	0	3	335.451	3.252	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)N(C)Cc1ccc(OC)cc1OC	ZINC001160675472	1382167466	/nfs/dbraw/zinc/16/74/66/1382167466.db2.gz	DFLCRNORSJWPSJ-KRWDZBQOSA-N	0	3	334.460	3.126	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCC1=CCN(CCOCC(C)C)CC1	ZINC001160857308	1382218044	/nfs/dbraw/zinc/21/80/44/1382218044.db2.gz	ZTXZVPGFVPMVII-UHFFFAOYSA-N	0	3	336.520	3.400	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCCC1=CCN(CCOCC2CC2)CC1	ZINC001160967424	1382253754	/nfs/dbraw/zinc/25/37/54/1382253754.db2.gz	IQVNWDVGYMHNOZ-KRWDZBQOSA-N	0	3	334.504	3.154	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cncc3sccc32)CC1	ZINC001160997623	1382266907	/nfs/dbraw/zinc/26/69/07/1382266907.db2.gz	QHLNQHJIRWRUGY-UHFFFAOYSA-N	0	3	327.453	3.234	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H](CCC)c2ccccn2)CC1	ZINC001161013562	1382272180	/nfs/dbraw/zinc/27/21/80/1382272180.db2.gz	FIODDBOOZRCANJ-IBGZPJMESA-N	0	3	339.483	3.127	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2c(C)cccc2Cl)CC1	ZINC001161090470	1382295139	/nfs/dbraw/zinc/29/51/39/1382295139.db2.gz	UTAVASAVJMEBKN-UHFFFAOYSA-N	0	3	330.859	3.424	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc3ncccc3c2)CC1	ZINC001161121250	1382307527	/nfs/dbraw/zinc/30/75/27/1382307527.db2.gz	DRGFNBCNTJMFMK-UHFFFAOYSA-N	0	3	333.435	3.010	20	30		EGEDHN
N#Cc1c[nH]c2nc(NCC3CCN(Cc4ccccn4)CC3)ccc12	ZINC001161243517	1382352720	/nfs/dbraw/zinc/35/27/20/1382352720.db2.gz	SIBPCIMVFDRKIN-UHFFFAOYSA-N	0	3	346.438	3.154	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)Cc2ccccc2OC(C)C)CC1	ZINC001161452782	1382415751	/nfs/dbraw/zinc/41/57/51/1382415751.db2.gz	YRMGCHWXDAGWSG-UHFFFAOYSA-N	0	3	342.483	3.341	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc(OC)cc2Cl)CC1	ZINC001161490904	1382420828	/nfs/dbraw/zinc/42/08/28/1382420828.db2.gz	AWWHRDSDUVNQLR-UHFFFAOYSA-N	0	3	346.858	3.124	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2[nH]ccc2-c2ccccc2)CC1	ZINC001161694683	1382483204	/nfs/dbraw/zinc/48/32/04/1382483204.db2.gz	ROKJDFKJPXRXKE-UHFFFAOYSA-N	0	3	347.462	3.457	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@]2(c3ccccc3)CCCO2)CC1	ZINC001161779018	1382502786	/nfs/dbraw/zinc/50/27/86/1382502786.db2.gz	AHBFKTKJERYVHI-OAQYLSRUSA-N	0	3	340.467	3.017	20	30		EGEDHN
COc1ccc(C(=O)CNc2ccc(N=CN(C)C)c(C#N)c2)cc1	ZINC001161806513	1382513146	/nfs/dbraw/zinc/51/31/46/1382513146.db2.gz	RTVBLLOXCMMSLZ-LPYMAVHISA-N	0	3	336.395	3.083	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CCCOc2ccccc2F)CC1	ZINC001161930568	1382557540	/nfs/dbraw/zinc/55/75/40/1382557540.db2.gz	BFEOHYVAZFUNOE-UHFFFAOYSA-N	0	3	346.446	3.309	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H](C)Cc2ccccc2C)CC1	ZINC001161968198	1382576156	/nfs/dbraw/zinc/57/61/56/1382576156.db2.gz	KSQFDRFGFYSHRY-IBGZPJMESA-N	0	3	338.495	3.335	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc(N(C)CC)cc2)CC1	ZINC001161986297	1382588113	/nfs/dbraw/zinc/58/81/13/1382588113.db2.gz	AJPNVIWBOMAESZ-UHFFFAOYSA-N	0	3	327.472	3.081	20	30		EGEDHN
CCCCCCC[NH2+]CCCNC(=O)c1cc(=O)c2ccccc2[n-]1	ZINC001162034204	1382609627	/nfs/dbraw/zinc/60/96/27/1382609627.db2.gz	GJDPVWLROPRWAW-UHFFFAOYSA-N	0	3	343.471	3.208	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)C[C@@H]2CCCC[C@H]2C)(COC)CC1	ZINC001162623373	1382814058	/nfs/dbraw/zinc/81/40/58/1382814058.db2.gz	SQWOQDAKAODZRJ-MOPGFXCFSA-N	0	3	348.531	3.071	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@H]2CCCC(C)(C)C2)(COC)CC1	ZINC001162623352	1382814196	/nfs/dbraw/zinc/81/41/96/1382814196.db2.gz	RNIVUGPQQYICCD-SFHVURJKSA-N	0	3	348.531	3.071	20	30		EGEDHN
C#CCN1CCC(CNC(=O)C[C@H]2CCCCC2(C)C)(COC)CC1	ZINC001162633075	1382817105	/nfs/dbraw/zinc/81/71/05/1382817105.db2.gz	KYCDHSHRANHMEI-GOSISDBHSA-N	0	3	348.531	3.071	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C=C(CC)CC	ZINC001162770599	1382866919	/nfs/dbraw/zinc/86/69/19/1382866919.db2.gz	YKHCHRMZWHMTBN-UHFFFAOYSA-N	0	3	326.484	3.417	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)CC(C)(C)C1CC1	ZINC001162802361	1382876633	/nfs/dbraw/zinc/87/66/33/1382876633.db2.gz	KEBBATXBLHNEQQ-UHFFFAOYSA-N	0	3	340.511	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C1(CC(C)C)CC1	ZINC001162827109	1382888214	/nfs/dbraw/zinc/88/82/14/1382888214.db2.gz	RYCVMQQJRQGTDF-UHFFFAOYSA-N	0	3	326.484	3.107	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C12CCC(CC1)C2	ZINC001162841298	1382891771	/nfs/dbraw/zinc/89/17/71/1382891771.db2.gz	PWOVKRQIZVABME-UHFFFAOYSA-N	0	3	338.495	3.251	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1csc(Cl)c1	ZINC001162952722	1382926290	/nfs/dbraw/zinc/92/62/90/1382926290.db2.gz	VUXFZEUPPDYXLX-UHFFFAOYSA-N	0	3	346.883	3.309	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CCCC[C@H]1CC	ZINC001162970981	1382932928	/nfs/dbraw/zinc/93/29/28/1382932928.db2.gz	RQEOVFKTELWLMU-RTWAWAEBSA-N	0	3	340.511	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1oc(CC)cc1C	ZINC001162983002	1382937158	/nfs/dbraw/zinc/93/71/58/1382937158.db2.gz	VKQJJDLGLOTCDT-UHFFFAOYSA-N	0	3	338.451	3.058	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C[C@@H](C)c1ccco1	ZINC001162983034	1382937486	/nfs/dbraw/zinc/93/74/86/1382937486.db2.gz	XHCKMVATCLRRGA-GOSISDBHSA-N	0	3	338.451	3.067	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C1CCC(C)(C)CC1	ZINC001163006742	1382945957	/nfs/dbraw/zinc/94/59/57/1382945957.db2.gz	KRMSAISGEUDIKS-UHFFFAOYSA-N	0	3	340.511	3.497	20	30		EGEDHN
C=CCCCC(=O)NCc1ccc(CN2CCN(CCC)CC2)cc1	ZINC001163029980	1382951795	/nfs/dbraw/zinc/95/17/95/1382951795.db2.gz	LSFIWLKDVLMNHB-UHFFFAOYSA-N	0	3	343.515	3.187	20	30		EGEDHN
CC(C)CC(=O)NCCC1(CNCc2cc(C#N)ccc2F)CC1	ZINC001163202749	1382991773	/nfs/dbraw/zinc/99/17/73/1382991773.db2.gz	YLTWVWRYLPRCEI-UHFFFAOYSA-N	0	3	331.435	3.120	20	30		EGEDHN
C[C@H]1C[C@H]1C(=O)NCCC1(CNCC#Cc2cccc(Cl)c2)CC1	ZINC001163235300	1383002096	/nfs/dbraw/zinc/00/20/96/1383002096.db2.gz	HNOPXXYQSYUVSN-MAUKXSAKSA-N	0	3	344.886	3.224	20	30		EGEDHN
CC(C)=CC(=O)NCCC1(CNCc2ccc(C#N)cc2F)CC1	ZINC001163275728	1383011185	/nfs/dbraw/zinc/01/11/85/1383011185.db2.gz	KWDIJMXCVZNYDE-UHFFFAOYSA-N	0	3	329.419	3.040	20	30		EGEDHN
N#Cc1ccccc1CNCC1(CCNC(=O)[C@H]2CC=CCC2)CC1	ZINC001163389298	1383039526	/nfs/dbraw/zinc/03/95/26/1383039526.db2.gz	QFCNRGCVYCRKJZ-KRWDZBQOSA-N	0	3	337.467	3.291	20	30		EGEDHN
CC[C@@H](C)C(=O)NCCC1(CNCc2cc(C#N)ccc2F)CC1	ZINC001163496793	1383065201	/nfs/dbraw/zinc/06/52/01/1383065201.db2.gz	SPWVMTCSUKMIJZ-CQSZACIVSA-N	0	3	331.435	3.120	20	30		EGEDHN
C[C@@H]1CCC[C@H](C)N1c1nccnc1C(C#N)C(=O)OC(C)(C)C	ZINC001163549868	1383076238	/nfs/dbraw/zinc/07/62/38/1383076238.db2.gz	GWJWWCKUVINBCG-MJBXVCDLSA-N	0	3	330.432	3.193	20	30		EGEDHN
CCSCCC(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001163580128	1383082574	/nfs/dbraw/zinc/08/25/74/1383082574.db2.gz	RSUZJXZYARABJP-UHFFFAOYSA-N	0	3	345.512	3.078	20	30		EGEDHN
C/C(=C/C(=O)NCCC1(CNCc2ccccc2C#N)CC1)C1CC1	ZINC001163614965	1383089981	/nfs/dbraw/zinc/08/99/81/1383089981.db2.gz	NGTLFFICOOZEBY-VBKFSLOCSA-N	0	3	337.467	3.291	20	30		EGEDHN
CC/C=C(\C)C(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001163676637	1383103458	/nfs/dbraw/zinc/10/34/58/1383103458.db2.gz	GCWPSQXKVSQQKL-OMCISZLKSA-N	0	3	325.456	3.291	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCCNCc1nsc2ccccc12	ZINC001164222278	1383167561	/nfs/dbraw/zinc/16/75/61/1383167561.db2.gz	JXTJNDARUJHHDW-KBPBESRZSA-N	0	3	331.485	3.350	20	30		EGEDHN
CC(C)C#CC(=O)NCCC1(CNCc2cc(O)ccc2Cl)CC1	ZINC001164463755	1383189159	/nfs/dbraw/zinc/18/91/59/1383189159.db2.gz	CCKOBHAZYQFTFK-UHFFFAOYSA-N	0	3	348.874	3.081	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1ccc(C)c(Cl)c1	ZINC001165748067	1383337949	/nfs/dbraw/zinc/33/79/49/1383337949.db2.gz	GGNDSYAEXHPMKL-UHFFFAOYSA-N	0	3	345.668	3.267	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ncc(Cl)s2)CC1	ZINC001166148570	1383395088	/nfs/dbraw/zinc/39/50/88/1383395088.db2.gz	NEPOTIXSGKRFJK-UHFFFAOYSA-N	0	3	334.272	3.039	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cccc3c2O[C@H](C)C3)CC1	ZINC001166217747	1383403715	/nfs/dbraw/zinc/40/37/15/1383403715.db2.gz	OGAYWVRJMDKVFV-CQSZACIVSA-N	0	3	348.874	3.252	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cc3ccsc3[nH]2)CC1	ZINC001166481715	1383427512	/nfs/dbraw/zinc/42/75/12/1383427512.db2.gz	RAENFPDUZQCYFB-UHFFFAOYSA-N	0	3	337.876	3.472	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCC1(CN[C@H](C)c2cnc(C)cn2)CC1	ZINC001166541610	1383435603	/nfs/dbraw/zinc/43/56/03/1383435603.db2.gz	DZNLSDXFWLQDAK-MRXNPFEDSA-N	0	3	344.503	3.324	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCC1(CNCc2nc(C)cs2)CC1	ZINC001166545843	1383436489	/nfs/dbraw/zinc/43/64/89/1383436489.db2.gz	QMWWFWVXXHQABF-UHFFFAOYSA-N	0	3	335.517	3.430	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCC1(CNCc2oc(C)nc2C)CC1	ZINC001166694298	1383462254	/nfs/dbraw/zinc/46/22/54/1383462254.db2.gz	MYOCCOVDCOXDCN-UONOGXRCSA-N	0	3	333.476	3.126	20	30		EGEDHN
CC#CCCCC(=O)NCCC1(CNCc2nc(C)cs2)CC1	ZINC001166704703	1383464134	/nfs/dbraw/zinc/46/41/34/1383464134.db2.gz	XAUKMDRMLQSRBF-UHFFFAOYSA-N	0	3	333.501	3.021	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCCC1(CNCc2cccc(OC)n2)CC1	ZINC001166755588	1383472512	/nfs/dbraw/zinc/47/25/12/1383472512.db2.gz	LXJKUYQPXVPGFO-MRXNPFEDSA-N	0	3	345.487	3.069	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCCC1(CN[C@@H](C)c2cnc(C)cn2)CC1	ZINC001166755603	1383472644	/nfs/dbraw/zinc/47/26/44/1383472644.db2.gz	MFZOHSCIKPQBSH-RDJZCZTQSA-N	0	3	344.503	3.324	20	30		EGEDHN
N#Cc1ccccc1CNCC1(CCNC(=O)[C@H]2CC[C@H](F)C2)CC1	ZINC001166850982	1383487302	/nfs/dbraw/zinc/48/73/02/1383487302.db2.gz	QMQXOZURYYTMBO-YJBOKZPZSA-N	0	3	343.446	3.073	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCC1(CNCc2oc(C)nc2C)CC1	ZINC001167018128	1383519967	/nfs/dbraw/zinc/51/99/67/1383519967.db2.gz	CAPIQDUQOPZWEQ-GOSISDBHSA-N	0	3	333.476	3.270	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCC2(CNCc3nc(C)cs3)CC2)C1	ZINC001167129848	1383547012	/nfs/dbraw/zinc/54/70/12/1383547012.db2.gz	DXUZALKZQVOYAS-UHFFFAOYSA-N	0	3	333.501	3.184	20	30		EGEDHN
N#Cc1ccccc1CNCC1(CCNC(=O)C2(CF)CCC2)CC1	ZINC001167267068	1383580020	/nfs/dbraw/zinc/58/00/20/1383580020.db2.gz	HCMOMLONVQKFLO-UHFFFAOYSA-N	0	3	343.446	3.074	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCC1(CN[C@@H](C)c2cnc(C)cn2)CC1	ZINC001167340323	1383603820	/nfs/dbraw/zinc/60/38/20/1383603820.db2.gz	XXCATMSPTDMONF-INIZCTEOSA-N	0	3	344.503	3.324	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cc([C@@H](C)CC)no2)CC1	ZINC001167411842	1383627092	/nfs/dbraw/zinc/62/70/92/1383627092.db2.gz	XFUKZZZKKJYNHC-LBPRGKRZSA-N	0	3	339.867	3.430	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cccc3c2ccn3C)CC1	ZINC001167471106	1383643603	/nfs/dbraw/zinc/64/36/03/1383643603.db2.gz	VFHSABUYTNZUQG-UHFFFAOYSA-N	0	3	345.874	3.421	20	30		EGEDHN
CC[C@@H](Cc1ccccc1)C(=O)NCCCNCc1ccccc1C#N	ZINC001167488700	1383649527	/nfs/dbraw/zinc/64/95/27/1383649527.db2.gz	HTTCGDLTAOZTTE-IBGZPJMESA-N	0	3	349.478	3.423	20	30		EGEDHN
COc1cccc(C(=O)N2CCC(NC3(CC#N)CCCC3)CC2)c1	ZINC001167866971	1383761787	/nfs/dbraw/zinc/76/17/87/1383761787.db2.gz	KJZOPWOIJRSWMS-UHFFFAOYSA-N	0	3	341.455	3.116	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@@H](C)[C@H](C)C(C)(C)C	ZINC001168168761	1383832386	/nfs/dbraw/zinc/83/23/86/1383832386.db2.gz	SZCHLIZDLVTWGJ-STQMWFEESA-N	0	3	333.314	3.309	20	30		EGEDHN
CCC1(CC)[C@H](NCc2cccc(C(=O)OC)c2C#N)[C@@H](C)[C@@H]1OC	ZINC001307745420	1384023930	/nfs/dbraw/zinc/02/39/30/1384023930.db2.gz	PHMYJHBNSUKXEC-XWIAVFTESA-N	0	3	344.455	3.274	20	30		EGEDHN
C=CCc1ccc(NC(=O)C(C)(C)C)c(-n2ccc([C@H](C)N)n2)n1	ZINC001169230627	1384125429	/nfs/dbraw/zinc/12/54/29/1384125429.db2.gz	UTFLGNSPXHUCQT-LBPRGKRZSA-N	0	3	327.432	3.000	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1(C)C	ZINC001308941208	1384160936	/nfs/dbraw/zinc/16/09/36/1384160936.db2.gz	OEYFJGMNZRHQCH-CVEARBPZSA-N	0	3	347.434	3.479	20	30		EGEDHN
CC[C@@H]1CCCC[C@@H]1C(=O)NCCCNCc1ccccc1C#N	ZINC001169729614	1384179212	/nfs/dbraw/zinc/17/92/12/1384179212.db2.gz	NMTGVXKUHNGUBZ-APWZRJJASA-N	0	3	327.472	3.371	20	30		EGEDHN
CC(C)N1CCN(c2ccc(NC3=CC(=O)CC(C)(C)C3)cn2)CC1	ZINC001169951182	1384203405	/nfs/dbraw/zinc/20/34/05/1384203405.db2.gz	ADYSJOXKPWGQHA-UHFFFAOYSA-N	0	3	342.487	3.297	20	30		EGEDHN
CC(C)N1CCN(Cc2ccc(NCC(C)(C)S)c(F)c2)CC1	ZINC001170309523	1384288087	/nfs/dbraw/zinc/28/80/87/1384288087.db2.gz	VKOOBGGHRAICBP-UHFFFAOYSA-N	0	3	339.524	3.472	20	30		EGEDHN
CO[C@@H]1[C@H](C)[C@H](NCc2ccc(C#N)cc2Br)C1(C)C	ZINC001170398981	1384307758	/nfs/dbraw/zinc/30/77/58/1384307758.db2.gz	GOSQBTLEEPSAJG-WKPIXPDZSA-N	0	3	337.261	3.470	20	30		EGEDHN
C[C@@H](CCCCNCc1cc(C2CC2)no1)NC(=O)C#CC(C)(C)C	ZINC001170694552	1384367325	/nfs/dbraw/zinc/36/73/25/1384367325.db2.gz	YQRBZABRLPZBHO-HNNXBMFYSA-N	0	3	345.487	3.366	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H](C)CCCCNCc1cnns1	ZINC001170964249	1384419779	/nfs/dbraw/zinc/41/97/79/1384419779.db2.gz	ZGWMFZFDDLNMHQ-CQSZACIVSA-N	0	3	336.505	3.071	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1CCC[C@@H](C(F)(F)F)[C@H]1CO	ZINC001171208976	1384469729	/nfs/dbraw/zinc/46/97/29/1384469729.db2.gz	GUQDDRNVDXOTGI-DAXOMENPSA-N	0	3	326.362	3.124	20	30		EGEDHN
C[C@@H](Cc1cccc(C#N)c1)N1C[C@@H]2CN(C(=O)OC(C)(C)C)[C@@H]2C1	ZINC001171232460	1384475547	/nfs/dbraw/zinc/47/55/47/1384475547.db2.gz	STKVSKJSEDFSJZ-BMGDILEWSA-N	0	3	341.455	3.040	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)C[C@@H]2CCc3ccccc32)C1	ZINC001316621199	1384486996	/nfs/dbraw/zinc/48/69/96/1384486996.db2.gz	CSFNHHZDNFIAML-BHYGNILZSA-N	0	3	332.875	3.343	20	30		EGEDHN
C[C@H](CC(=O)NC[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1)C1CC1	ZINC001316640942	1384500910	/nfs/dbraw/zinc/50/09/10/1384500910.db2.gz	DOWLTAUZJIYXPD-DDUZABMNSA-N	0	3	343.446	3.118	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)N1CCN(c2noc3ccccc32)CC1	ZINC001172308601	1384765283	/nfs/dbraw/zinc/76/52/83/1384765283.db2.gz	LLLRBTFUFJAPSS-INIZCTEOSA-N	0	3	346.434	3.453	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)N1CC[C@@H](N2CCCCC2)[C@@H](F)C1	ZINC001172317124	1384768029	/nfs/dbraw/zinc/76/80/29/1384768029.db2.gz	PNQBJMRBXFIQDK-LSTHTHJFSA-N	0	3	329.463	3.388	20	30		EGEDHN
CCCCCCC[C@H](CC)N1CCN(CC(=O)N2CCCC2)CC1	ZINC001172356923	1384776448	/nfs/dbraw/zinc/77/64/48/1384776448.db2.gz	ZRWLWXMKYDDPME-IBGZPJMESA-N	0	3	337.552	3.366	20	30		EGEDHN
C[C@H](CCCC#N)N1CCO[C@@H]2[C@@H](COCc3cccnc3)CC[C@@H]21	ZINC001172498259	1384805523	/nfs/dbraw/zinc/80/55/23/1384805523.db2.gz	KFUMRPQRWXDYNG-RSPOEFSDSA-N	0	3	343.471	3.160	20	30		EGEDHN
C[C@H](CCCC#N)N1CCO[C@@H]2[C@@H](COCc3nccs3)CC[C@@H]21	ZINC001172500239	1384806709	/nfs/dbraw/zinc/80/67/09/1384806709.db2.gz	YCEBHIDJVNEZSZ-XLMAVXFVSA-N	0	3	349.500	3.221	20	30		EGEDHN
CC[C@@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C#N)C1)c1ccncc1	ZINC001172976795	1384894393	/nfs/dbraw/zinc/89/43/93/1384894393.db2.gz	VFTWCPPETPPAAF-IXDOHACOSA-N	0	3	344.459	3.414	20	30		EGEDHN
CCCOC1CCC(N2CCN(c3ccccc3C#N)CC2)CC1	ZINC001173096575	1384913158	/nfs/dbraw/zinc/91/31/58/1384913158.db2.gz	XTCZJCSTQAYQAD-UHFFFAOYSA-N	0	3	327.472	3.418	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](NCc3cnccc3C)C2)CCCC1	ZINC001317311006	1385075552	/nfs/dbraw/zinc/07/55/52/1385075552.db2.gz	RTMWDTNLJAMDFX-SFHVURJKSA-N	0	3	327.472	3.217	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H](C)CCCCNCc2nccs2)cc1	ZINC001174634666	1385128075	/nfs/dbraw/zinc/12/80/75/1385128075.db2.gz	DSOGSJKYSMFJMP-HNNXBMFYSA-N	0	3	341.480	3.203	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](C)CCCCN[C@H](C)c1nnc(CC)[nH]1	ZINC001174672847	1385132592	/nfs/dbraw/zinc/13/25/92/1385132592.db2.gz	RDDFTDYQRBRIST-LSDHHAIUSA-N	0	3	349.523	3.295	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H](C)CCCCNCc1csnc1OC	ZINC001174683646	1385134186	/nfs/dbraw/zinc/13/41/86/1385134186.db2.gz	UVKLYUSVVJVNHM-ZDUSSCGKSA-N	0	3	339.505	3.129	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H](C)CCCCNCc1ccn(CC)n1	ZINC001174694649	1385135609	/nfs/dbraw/zinc/13/56/09/1385135609.db2.gz	UWSGYOPZBLUBQL-SFHVURJKSA-N	0	3	346.519	3.251	20	30		EGEDHN
CC#CCCCC(=O)N[C@H](C)CCCCNCc1nc(C)cs1	ZINC001174797661	1385150305	/nfs/dbraw/zinc/15/03/05/1385150305.db2.gz	BIVZWHXWKLHXPZ-OAHLLOKOSA-N	0	3	335.517	3.410	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@H](C)CCCCNCc1nccn1CC	ZINC001174849497	1385159602	/nfs/dbraw/zinc/15/96/02/1385159602.db2.gz	NQYUNWPAYDSYLW-IAGOWNOFSA-N	0	3	334.508	3.270	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)C1CCC(C2CC2)CC1	ZINC001174958145	1385174669	/nfs/dbraw/zinc/17/46/69/1385174669.db2.gz	UDRIKWLFKYZZQR-UHFFFAOYSA-N	0	3	339.483	3.371	20	30		EGEDHN
CCN(CCNC(=O)c1cccnc1C1CC1)Cc1cccc(C#N)c1	ZINC001317482496	1385178847	/nfs/dbraw/zinc/17/88/47/1385178847.db2.gz	SSJUCJHLIPOYJR-UHFFFAOYSA-N	0	3	348.450	3.083	20	30		EGEDHN
CCN(CCNC(=O)C1(C)CCCC1)Cc1ccc(OCC#N)cc1	ZINC001317485318	1385182481	/nfs/dbraw/zinc/18/24/81/1385182481.db2.gz	ZHJIWWUQSPGGDR-UHFFFAOYSA-N	0	3	343.471	3.107	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H](C)CCCCNCc2nccn2CC)CC1	ZINC001175074476	1385190312	/nfs/dbraw/zinc/19/03/12/1385190312.db2.gz	SJLZUJITXQUSIB-QGZVFWFLSA-N	0	3	346.519	3.414	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H](C)CCCCNCc1cc(OC)no1	ZINC001175082686	1385192004	/nfs/dbraw/zinc/19/20/04/1385192004.db2.gz	RFFRQPDWRAZYDR-KSSFIOAISA-N	0	3	337.464	3.050	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H](C)CCCCNCc2ccn(CC)n2)C1	ZINC001175150341	1385205468	/nfs/dbraw/zinc/20/54/68/1385205468.db2.gz	MQZORRBGTWEXIY-INIZCTEOSA-N	0	3	332.492	3.024	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)c1csc2c1CC[C@@H](C)C2	ZINC001175273422	1385237336	/nfs/dbraw/zinc/23/73/36/1385237336.db2.gz	APYMNQNJUSWBPE-LLVKDONJSA-N	0	3	326.893	3.335	20	30		EGEDHN
CCCN(CCNC(=O)c1ccccc1F)Cc1ccc(C#N)cc1	ZINC001317539251	1385273386	/nfs/dbraw/zinc/27/33/86/1385273386.db2.gz	RRILJTYUZFIWIU-UHFFFAOYSA-N	0	3	339.414	3.339	20	30		EGEDHN
C=CC[C@H](C(=O)NCCCNCc1nc(C)cs1)c1ccccc1	ZINC001176697719	1385662904	/nfs/dbraw/zinc/66/29/04/1385662904.db2.gz	MJNXIHPUZBLYTJ-KRWDZBQOSA-N	0	3	343.496	3.407	20	30		EGEDHN
CC[C@@H](CNC(=O)c1ccc(F)cc1C)NCc1ccc(C#N)s1	ZINC001318593414	1385778344	/nfs/dbraw/zinc/77/83/44/1385778344.db2.gz	OWNPNZRWVNVNQU-AWEZNQCLSA-N	0	3	345.443	3.366	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@@H](CCC)CC(C)C	ZINC001177188661	1385852928	/nfs/dbraw/zinc/85/29/28/1385852928.db2.gz	VHSYAHYEIMZGOX-AWEZNQCLSA-N	0	3	333.314	3.453	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@H]1C[C@@H](C)CO1	ZINC001177368804	1385932407	/nfs/dbraw/zinc/93/24/07/1385932407.db2.gz	XZLHNNRXNNXLMI-RHSMWYFYSA-N	0	3	342.911	3.162	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](N[C@@H]2CCc3c2c(F)ccc3F)[C@@H]1C	ZINC001178324514	1386189045	/nfs/dbraw/zinc/18/90/45/1386189045.db2.gz	RLMOEYDZUMBXIG-AFAVFJNCSA-N	0	3	334.410	3.497	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](N[C@H]2CCc3c2c(F)ccc3F)[C@@H]1C	ZINC001178324515	1386189090	/nfs/dbraw/zinc/18/90/90/1386189090.db2.gz	RLMOEYDZUMBXIG-ZLIFDBKOSA-N	0	3	334.410	3.497	20	30		EGEDHN
Cc1nc(CNCCCCCCNC(=O)C#CC(C)(C)C)cs1	ZINC001178442293	1386218722	/nfs/dbraw/zinc/21/87/22/1386218722.db2.gz	NCBDVHCYEOFUKA-UHFFFAOYSA-N	0	3	335.517	3.267	20	30		EGEDHN
N#Cc1ccccc1CNCCCCCCNC(=O)c1ccsn1	ZINC001178792691	1386306364	/nfs/dbraw/zinc/30/63/64/1386306364.db2.gz	GVOHBZKUOJQHKI-UHFFFAOYSA-N	0	3	342.468	3.095	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](NCc2cccc(OCC)n2)[C@@H]1C	ZINC001178795739	1386307458	/nfs/dbraw/zinc/30/74/58/1386307458.db2.gz	WPMWHQKTZCZYLL-RDJZCZTQSA-N	0	3	345.487	3.162	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@@H]1C)C1CCC1	ZINC001178973222	1386364586	/nfs/dbraw/zinc/36/45/86/1386364586.db2.gz	IAACYJBFUVIZGO-FTRWYGJKSA-N	0	3	342.458	3.192	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1ccc2cnccc2c1)C(C)C	ZINC001319956335	1386416402	/nfs/dbraw/zinc/41/64/02/1386416402.db2.gz	JDBKCJTWDQVJHE-QGZVFWFLSA-N	0	3	331.847	3.331	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCCCCCNCc1nccn1CC	ZINC001179307043	1386446023	/nfs/dbraw/zinc/44/60/23/1386446023.db2.gz	PMFTYZQFXUDZRR-DLBZAZTESA-N	0	3	334.508	3.127	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCCCCCNCc1cn(C(C)C)nn1	ZINC001179306753	1386446045	/nfs/dbraw/zinc/44/60/45/1386446045.db2.gz	LLTOSCPCHWCNJU-IRXDYDNUSA-N	0	3	349.523	3.083	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCCCCCN[C@@H](C)c1nnc(C)[nH]1	ZINC001179481501	1386494311	/nfs/dbraw/zinc/49/43/11/1386494311.db2.gz	GOXJOJXKWNAXBY-KSSFIOAISA-N	0	3	335.496	3.043	20	30		EGEDHN
C=C1CCC(C(=O)NCCCCCCNCc2ccn(CC)n2)CC1	ZINC001179482530	1386495252	/nfs/dbraw/zinc/49/52/52/1386495252.db2.gz	WHZPRXVGHWECHQ-UHFFFAOYSA-N	0	3	346.519	3.416	20	30		EGEDHN
C=C1CCC(C(=O)NCCCCCCNCc2cc(OC)no2)CC1	ZINC001179482317	1386495409	/nfs/dbraw/zinc/49/54/09/1386495409.db2.gz	SOIDEJAVIDWGCK-UHFFFAOYSA-N	0	3	349.475	3.196	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)[C@@H]1C[C@H]1C1CCC1	ZINC001179691944	1386555258	/nfs/dbraw/zinc/55/52/58/1386555258.db2.gz	FWCPPMIDNLJVMB-DVWBAYGPSA-N	0	3	336.479	3.053	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCCCCCNCc1nnc(C(C)C)[nH]1	ZINC001179692492	1386555717	/nfs/dbraw/zinc/55/57/17/1386555717.db2.gz	JUJUPVNQLYZPGY-UHFFFAOYSA-N	0	3	349.523	3.297	20	30		EGEDHN
CC[C@H](NCC(=O)NCc1ccc(C#N)cc1)c1ccc(F)cc1	ZINC001320326465	1386576391	/nfs/dbraw/zinc/57/63/91/1386576391.db2.gz	ZYYBGSIVWRTGTE-SFHVURJKSA-N	0	3	325.387	3.054	20	30		EGEDHN
CC[C@H](C)CCC(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C	ZINC001179775370	1386580309	/nfs/dbraw/zinc/58/03/09/1386580309.db2.gz	PFPBONNZBISQAC-BJLQDIEVSA-N	0	3	326.484	3.443	20	30		EGEDHN
CC(C)C[C@H](C)C(=O)N1CC[C@H](NCc2ccc(C#N)s2)[C@@H]1C	ZINC001179795050	1386589750	/nfs/dbraw/zinc/58/97/50/1386589750.db2.gz	YIJONVCOCAVDPE-ZQIUZPCESA-N	0	3	333.501	3.381	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)CCCC(C)=O)CCCC[C@H]1C	ZINC001698657346	1406307918	/nfs/dbraw/zinc/30/79/18/1406307918.db2.gz	QYIXGJFNWXTHKS-DYVFJYSZSA-N	0	3	328.884	3.153	20	30		EGEDHN
CC[C@H](C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2cc(F)ccc2C#N)C1	ZINC001180631850	1386852870	/nfs/dbraw/zinc/85/28/70/1386852870.db2.gz	FAWYRSJMMKBGNJ-BXTJHSDWSA-N	0	3	345.462	3.318	20	30		EGEDHN
C[C@H](C(=O)N1C[C@@H](C)[C@](C)(CNCc2ccccc2C#N)C1)C1CC1	ZINC001181036491	1386921909	/nfs/dbraw/zinc/92/19/09/1386921909.db2.gz	BJNPLAALYKKRJX-VWKPWSFCSA-N	0	3	339.483	3.179	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)[C@](C)(CNCc2ccccc2C#N)C1	ZINC001181629413	1387026249	/nfs/dbraw/zinc/02/62/49/1387026249.db2.gz	GUUFIDNHNUWAIV-DYESRHJHSA-N	0	3	339.483	3.489	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](NCc2ccc(F)c(Cl)c2)C1	ZINC001182108707	1387106314	/nfs/dbraw/zinc/10/63/14/1387106314.db2.gz	SZCGCUHAWGKUNK-OAHLLOKOSA-N	0	3	336.838	3.363	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2(C)CCC2)C[C@@]1(C)CNCc1ccccc1C#N	ZINC001182224673	1387125187	/nfs/dbraw/zinc/12/51/87/1387125187.db2.gz	UFRDXSCHQGYJDL-IIBYNOLFSA-N	0	3	339.483	3.323	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCCF)C[C@@]1(C)CNCc1cc(F)ccc1C#N	ZINC001182224625	1387125289	/nfs/dbraw/zinc/12/52/89/1387125289.db2.gz	SOMHICDOQPNABQ-AUUYWEPGSA-N	0	3	349.425	3.021	20	30		EGEDHN
C=C(C)C(=O)OCCNC(=O)[C@H](c1ccccc1)N(CC)CCCC	ZINC001182231772	1387126840	/nfs/dbraw/zinc/12/68/40/1387126840.db2.gz	AMQIKUCNZMJHFI-SFHVURJKSA-N	0	3	346.471	3.085	20	30		EGEDHN
C=C(C)CCC(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1	ZINC001336374782	1389082857	/nfs/dbraw/zinc/08/28/57/1389082857.db2.gz	VTBHLRNXQXELMP-GOSISDBHSA-N	0	3	343.471	3.148	20	30		EGEDHN
C[C@@H](NC(=O)c1ccc(C#N)cc1F)[C@@H](c1ccccc1)N(C)C	ZINC001336444769	1389101220	/nfs/dbraw/zinc/10/12/20/1389101220.db2.gz	RXYUMSPXONPGNL-ACJLOTCBSA-N	0	3	325.387	3.119	20	30		EGEDHN
Cc1ccccc1CCC(=O)NC[C@@H](C)CNCc1ccccc1C#N	ZINC001698760319	1406414575	/nfs/dbraw/zinc/41/45/75/1406414575.db2.gz	AIHWBZUPAPXQFH-KRWDZBQOSA-N	0	3	349.478	3.341	20	30		EGEDHN
C=C(Br)CNC[C@H](NC(=O)C1CC2(CC2)C1)C(C)(C)C	ZINC001332857125	1390201980	/nfs/dbraw/zinc/20/19/80/1390201980.db2.gz	LGVKYPYAOQCVJL-ZDUSSCGKSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N[C@H](CC)c1nc(C(F)(F)F)cs1	ZINC001339993457	1390204719	/nfs/dbraw/zinc/20/47/19/1390204719.db2.gz	ROQAVWGSTXLRKN-VHSXEESVSA-N	0	3	335.395	3.413	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N1CCC(c2nc3ccccc3o2)CC1	ZINC001340138792	1390234738	/nfs/dbraw/zinc/23/47/38/1390234738.db2.gz	GUUGCHRKEUXLAW-OAHLLOKOSA-N	0	3	327.428	3.217	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N1CCC[C@@H](CC)CC1	ZINC001340207110	1390250186	/nfs/dbraw/zinc/25/01/86/1390250186.db2.gz	KDRRNYHZLNHAKQ-SJORKVTESA-N	0	3	331.508	3.290	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N(C)Cc1cscc1Br	ZINC001341594454	1390507661	/nfs/dbraw/zinc/50/76/61/1390507661.db2.gz	SOZPHRQSPLFLCZ-GFCCVEGCSA-N	0	3	331.279	3.153	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccn2)CC[C@@H]1Nc1ccc(OCC#N)cc1	ZINC001341853820	1390537621	/nfs/dbraw/zinc/53/76/21/1390537621.db2.gz	ABBCBVBRSLHIJA-UZLBHIALSA-N	0	3	336.439	3.306	20	30		EGEDHN
C=C(C)Cn1c(CCCCC#N)nnc1N1C[C@H](C)N(CC)C[C@@H]1C	ZINC001341940758	1390552326	/nfs/dbraw/zinc/55/23/26/1390552326.db2.gz	SFENYDQBQWXUQP-IRXDYDNUSA-N	0	3	344.507	3.009	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)Cc1ccc(Br)cc1	ZINC001344875205	1390821130	/nfs/dbraw/zinc/82/11/30/1390821130.db2.gz	PIBILSWBQZTVIK-CYBMUJFWSA-N	0	3	332.201	3.084	20	30		EGEDHN
Cn1c(Cl)cnc1C(C#N)C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1F	ZINC001347339639	1391057265	/nfs/dbraw/zinc/05/72/65/1391057265.db2.gz	YPZZPTDEHNBJHK-TUAOUCFPSA-N	0	3	335.741	3.332	20	30		EGEDHN
CC[C@H](C)N1CCN(c2nnc(CCCCC#N)n2CC(C)C)CC1	ZINC001347585948	1391096511	/nfs/dbraw/zinc/09/65/11/1391096511.db2.gz	DANULMJBWCWIAS-KRWDZBQOSA-N	0	3	346.523	3.091	20	30		EGEDHN
N#Cc1ccccc1-c1ccc(Cn2cc(CNCC3CC3)nn2)cc1	ZINC001349744912	1391361745	/nfs/dbraw/zinc/36/17/45/1391361745.db2.gz	NGTUDKYAKJRZBV-UHFFFAOYSA-N	0	3	343.434	3.365	20	30		EGEDHN
C#CC[C@@H](CC)c1nnc(N2CCN([C@@H](C)CC)CC2)n1CC1CC1	ZINC001351432741	1391639274	/nfs/dbraw/zinc/63/92/74/1391639274.db2.gz	CWKGSZXDELOUJG-FUHWJXTLSA-N	0	3	343.519	3.126	20	30		EGEDHN
Cc1ccc([C@H](CNc2ccc(C#N)cc2CO)N2CCCC2)o1	ZINC001351961424	1391725256	/nfs/dbraw/zinc/72/52/56/1391725256.db2.gz	FHHGVROUBKDXMF-SFHVURJKSA-N	0	3	325.412	3.201	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc(NC[C@@H]2CCCO2)c(F)c1	ZINC001353559877	1392039358	/nfs/dbraw/zinc/03/93/58/1392039358.db2.gz	PAIBOSUOFPBFGU-HOCLYGCPSA-N	0	3	335.423	3.039	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1cnc2cc[nH]c2c1	ZINC001479824363	1392412942	/nfs/dbraw/zinc/41/29/42/1392412942.db2.gz	MHXSPDQWYUAHOM-DYVFJYSZSA-N	0	3	346.862	3.288	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)CCc2cc(Cl)cs2)C1	ZINC001480160173	1392604740	/nfs/dbraw/zinc/60/47/40/1392604740.db2.gz	VOFGJIHPGXYDTD-HAQNSBGRSA-N	0	3	333.284	3.323	20	30		EGEDHN
Cc1cc(C(=O)NCC[C@@H](C)NCc2cc(C#N)ccc2F)c(C)o1	ZINC001480750881	1392913618	/nfs/dbraw/zinc/91/36/18/1392913618.db2.gz	PWQVMLAQJNUNEH-GFCCVEGCSA-N	0	3	343.402	3.205	20	30		EGEDHN
Cc1cscc1C(=O)NCC[C@@H](C)NCc1cc(C#N)ccc1F	ZINC001480759197	1392917599	/nfs/dbraw/zinc/91/75/99/1392917599.db2.gz	RVXXUZWGNXYXIL-CYBMUJFWSA-N	0	3	345.443	3.366	20	30		EGEDHN
C[C@@H](CCNC(=O)c1cc(C#N)c[nH]1)N[C@@H](C)c1c(F)cccc1F	ZINC001480759500	1392917652	/nfs/dbraw/zinc/91/76/52/1392917652.db2.gz	VCSWXJWSJVADSY-RYUDHWBXSA-N	0	3	346.381	3.024	20	30		EGEDHN
Cc1cc(C(=O)N(C)[C@@H](C)CNCc2ccc(C#N)s2)ccc1F	ZINC001482328097	1394898098	/nfs/dbraw/zinc/89/80/98/1394898098.db2.gz	YTIPLMCSYKRJFP-ZDUSSCGKSA-N	0	3	345.443	3.318	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1ccc2oc(C)nc2c1)C(C)C	ZINC001698968993	1406730241	/nfs/dbraw/zinc/73/02/41/1406730241.db2.gz	UMBAKDZYRJUEJR-HNNXBMFYSA-N	0	3	335.835	3.233	20	30		EGEDHN
CC(C)[C@H](CNC(=O)CC(C)(C)C)NCc1cc(C#N)ccc1F	ZINC001482513533	1395065647	/nfs/dbraw/zinc/06/56/47/1395065647.db2.gz	JQNPTFGWEYAQCK-KRWDZBQOSA-N	0	3	333.451	3.364	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1oc(C(C)C)nc1C)C(C)C	ZINC001698972592	1406737441	/nfs/dbraw/zinc/73/74/41/1406737441.db2.gz	FMJZKWYXCJRMNE-ZDUSSCGKSA-N	0	3	327.856	3.203	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)[C@H]1CCCc2cccnc21	ZINC001485258595	1395745390	/nfs/dbraw/zinc/74/53/90/1395745390.db2.gz	PBEMGKPIHLNDIN-INIZCTEOSA-N	0	3	349.906	3.328	20	30		EGEDHN
Cc1cc(C(=O)NCC[C@@H](C)NCc2ccccc2C#N)ccc1F	ZINC001690859565	1404780626	/nfs/dbraw/zinc/78/06/26/1404780626.db2.gz	GTPBXBNKKKLOFO-OAHLLOKOSA-N	0	3	339.414	3.304	20	30		EGEDHN
C[C@@H](C(=O)NC[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1)C(C)(C)C	ZINC001691150138	1405083673	/nfs/dbraw/zinc/08/36/73/1405083673.db2.gz	BMJSEHIFNKPROK-QRTARXTBSA-N	0	3	345.462	3.364	20	30		EGEDHN
C[C@@H](C(=O)NC[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1)C1CCC1	ZINC001691506057	1405309196	/nfs/dbraw/zinc/30/91/96/1405309196.db2.gz	DMCVJOVDZUFKJI-DDUZABMNSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C[C@H](C(=O)N[C@@H]1CCN(CC2CC(F)(F)C2)C1)c1ccccc1	ZINC001698553747	1406151454	/nfs/dbraw/zinc/15/14/54/1406151454.db2.gz	KCCYLHLEVRRWFS-SJORKVTESA-N	0	3	334.410	3.192	20	30		EGEDHN
Cc1cccc(C)c1C(=O)N[C@H](C)CNCc1ccc(C#N)s1	ZINC001699386824	1412699089	/nfs/dbraw/zinc/69/90/89/1412699089.db2.gz	KEHGKBZOGQFHHE-CQSZACIVSA-N	0	3	327.453	3.145	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H](C)CN(C)Cc2cccc(C#N)c2)s1	ZINC001699436938	1412758000	/nfs/dbraw/zinc/75/80/00/1412758000.db2.gz	MHLKMVASUVMQSQ-ZDUSSCGKSA-N	0	3	327.453	3.179	20	30		EGEDHN
C[C@]1(CNCc2ccccc2C#N)CCN(C(=O)CC2CCC2)C1	ZINC001699833527	1413262342	/nfs/dbraw/zinc/26/23/42/1413262342.db2.gz	FZSXZWSUIIAVBW-HXUWFJFHSA-N	0	3	325.456	3.077	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)NCC1(NCc2ccc(F)c(C#N)c2)CCC1	ZINC001700136725	1413554763	/nfs/dbraw/zinc/55/47/63/1413554763.db2.gz	PULTYBORMLCUQW-NVXWUHKLSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C(Br)CN[C@H](CNC(=O)c1ccc(F)cc1)C(C)C	ZINC001732552658	1428737518	/nfs/dbraw/zinc/73/75/18/1428737518.db2.gz	ZTPQSAHEJPFPAE-CQSZACIVSA-N	0	3	343.240	3.078	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1ccn(C(C)C)c1C)C(C)C	ZINC001732564253	1428755248	/nfs/dbraw/zinc/75/52/48/1428755248.db2.gz	FBUYYYFBZZQBGH-MRXNPFEDSA-N	0	3	325.884	3.474	20	30		EGEDHN
C[C@H](C#N)C(=O)N(C)CCN(C)[C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC001732575975	1428775794	/nfs/dbraw/zinc/77/57/94/1428775794.db2.gz	LCVNGMNYWLHEGT-OLZOCXBDSA-N	0	3	341.377	3.316	20	30		EGEDHN
COc1ccc(C#N)cc1CNC[C@@H](NC(=O)CC(C)C)C(C)(C)C	ZINC001700978426	1414616883	/nfs/dbraw/zinc/61/68/83/1414616883.db2.gz	KKZQAKDWCATJQH-GOSISDBHSA-N	0	3	345.487	3.233	20	30		EGEDHN
CC(C)(C)[C@H](CNCc1ccc(C#N)cc1F)NC(=O)C1CCC1	ZINC001700981454	1414622113	/nfs/dbraw/zinc/62/21/13/1414622113.db2.gz	VHLUTRYQHLOBFO-KRWDZBQOSA-N	0	3	331.435	3.118	20	30		EGEDHN
CCc1ccccc1CCN1CCC[C@@H](NC(=O)C#CC(C)(C)C)C1	ZINC001713060199	1417615875	/nfs/dbraw/zinc/61/58/75/1417615875.db2.gz	GDXXUHUCMGZUPB-HXUWFJFHSA-N	0	3	340.511	3.422	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)[C@@H](CCC)C(C)C)C1	ZINC001713170038	1417743326	/nfs/dbraw/zinc/74/33/26/1417743326.db2.gz	QRKHMUDVYHHJDV-IHRRRGAJSA-N	0	3	331.298	3.204	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1ccc(Cl)cc1OC	ZINC001713416046	1418039669	/nfs/dbraw/zinc/03/96/69/1418039669.db2.gz	IYACGPUHKGRJTB-NSHDSACASA-N	0	3	331.243	3.199	20	30		EGEDHN
CC1(C(=O)NC[C@@H]2CCN(Cc3ccc(C#N)cc3)C2)CCCCC1	ZINC001713535994	1418290412	/nfs/dbraw/zinc/29/04/12/1418290412.db2.gz	OBUMANBNTYIXHY-IBGZPJMESA-N	0	3	339.483	3.467	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1ccnc(C2CC2)c1)C1CC1	ZINC001714167329	1418976386	/nfs/dbraw/zinc/97/63/86/1418976386.db2.gz	QEGRVMKMCCKTDJ-SFHVURJKSA-N	0	3	333.863	3.200	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)[C@H](CC)SC)CC1	ZINC001714297592	1419076833	/nfs/dbraw/zinc/07/68/33/1419076833.db2.gz	KYFWURNXHKTNOZ-AVGNSLFASA-N	0	3	349.338	3.054	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)C1(c2cccnc2)CCCC1	ZINC001714486308	1419209419	/nfs/dbraw/zinc/20/94/19/1419209419.db2.gz	HLYUPQGDNVUMPC-OAHLLOKOSA-N	0	3	335.879	3.130	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1cc(Cl)cc(OC)c1	ZINC001714494062	1419218311	/nfs/dbraw/zinc/21/83/11/1419218311.db2.gz	OSNDVMRNAAWYTA-LLVKDONJSA-N	0	3	331.243	3.199	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2ncoc2C)CCCC[C@@H]1C	ZINC001715133354	1419882515	/nfs/dbraw/zinc/88/25/15/1419882515.db2.gz	WMFFHSCBUYDEJG-ZBEGNZNMSA-N	0	3	325.840	3.004	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@@H]1CNCC#Cc1ccc(F)cc1	ZINC001715211937	1419944602	/nfs/dbraw/zinc/94/46/02/1419944602.db2.gz	JQDGECSIBQSBFH-LJQANCHMSA-N	0	3	342.458	3.360	20	30		EGEDHN
CC1(C(=O)NCC2(NCc3ccc(C#N)cc3F)CCCC2)CCC1	ZINC001715302446	1420010103	/nfs/dbraw/zinc/01/01/03/1420010103.db2.gz	VMLZNILRFVRHGU-UHFFFAOYSA-N	0	3	343.446	3.406	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)CCCF)[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001715475171	1420154249	/nfs/dbraw/zinc/15/42/49/1420154249.db2.gz	OEGAOMIUQMZKBR-RDTXWAMCSA-N	0	3	349.425	3.164	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cc(F)c(C)cc1F)C(C)C	ZINC001715595554	1420263761	/nfs/dbraw/zinc/26/37/61/1420263761.db2.gz	LEWFZVPAPFRPLL-HNNXBMFYSA-N	0	3	330.806	3.370	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cn(CC)nc1C(C)C)C(C)C	ZINC001715658457	1420282010	/nfs/dbraw/zinc/28/20/10/1420282010.db2.gz	FWFSUSRULLOFCP-OAHLLOKOSA-N	0	3	340.899	3.123	20	30		EGEDHN
CC[C@@H](CC(=O)NCC1(NCc2ccc(C#N)cc2)CC1)C(C)C	ZINC001733262838	1429418642	/nfs/dbraw/zinc/41/86/42/1429418642.db2.gz	JLKOKADVVIUCOY-SFHVURJKSA-N	0	3	327.472	3.369	20	30		EGEDHN
CC[C@H](CC(=O)NCC1(NCc2ccc(C#N)cc2)CC1)C(C)C	ZINC001733262837	1429418999	/nfs/dbraw/zinc/41/89/99/1429418999.db2.gz	JLKOKADVVIUCOY-GOSISDBHSA-N	0	3	327.472	3.369	20	30		EGEDHN
Cc1ccc(F)c(C(=O)N[C@H](C)CNCc2ccc(C#N)s2)c1F	ZINC001716410989	1420641086	/nfs/dbraw/zinc/64/10/86/1420641086.db2.gz	RSBNYMFMEFHLIN-LLVKDONJSA-N	0	3	349.406	3.115	20	30		EGEDHN
CC(C)Oc1ccc(CNC2(CNC(=O)[C@H](C)C#N)CC2)cc1Cl	ZINC001716677962	1420833128	/nfs/dbraw/zinc/83/31/28/1420833128.db2.gz	OVFVWAXPXCEPPC-CYBMUJFWSA-N	0	3	349.862	3.025	20	30		EGEDHN
CC(C)CC(=O)NC[C@@]1(C)CCCN(Cc2ccc(C#N)cc2)C1	ZINC001716891333	1421016688	/nfs/dbraw/zinc/01/66/88/1421016688.db2.gz	LZQONAQBMSKFCZ-HXUWFJFHSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C(Cl)CNCC1(O)CCN(C(=O)C2(C)CCCCCC2)CC1	ZINC001717319773	1421260254	/nfs/dbraw/zinc/26/02/54/1421260254.db2.gz	SXEFTYQXUICCLA-UHFFFAOYSA-N	0	3	342.911	3.043	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)[C@@H](CCC)OC)CC1	ZINC001717356106	1421291064	/nfs/dbraw/zinc/29/10/64/1421291064.db2.gz	MOXWBCAWEDVDSN-MRXNPFEDSA-N	0	3	330.900	3.115	20	30		EGEDHN
CC(F)(F)CC(=O)NC[C@@H]1CCCCCN1Cc1cccc(C#N)c1	ZINC001717537799	1421476057	/nfs/dbraw/zinc/47/60/57/1421476057.db2.gz	BAHBUURROKXJQN-KRWDZBQOSA-N	0	3	349.425	3.464	20	30		EGEDHN
CCC[C@@H](C)C(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001723998055	1424620755	/nfs/dbraw/zinc/62/07/55/1424620755.db2.gz	LWZVGNBZWPIPFK-MRXNPFEDSA-N	0	3	327.472	3.465	20	30		EGEDHN
CCCCC(=O)N1CCC[C@H]1CN(C)Cc1ccc(OCC#N)cc1	ZINC001725035278	1425457542	/nfs/dbraw/zinc/45/75/42/1425457542.db2.gz	IZCMUJOXLSDBHG-SFHVURJKSA-N	0	3	343.471	3.202	20	30		EGEDHN
C[C@H](CN(C)C(=O)[C@@H](C)c1ccccc1)NCc1ccc(C#N)s1	ZINC001725519977	1426211299	/nfs/dbraw/zinc/21/12/99/1426211299.db2.gz	XBGFOOUKZRKXKR-CABCVRRESA-N	0	3	341.480	3.360	20	30		EGEDHN
C=C(Cl)CNC[C@@H](NC(=O)CCc1cncc(C)c1)C(C)(C)C	ZINC001725742256	1426418756	/nfs/dbraw/zinc/41/87/56/1426418756.db2.gz	BWENISSMZQHBNL-MRXNPFEDSA-N	0	3	337.895	3.196	20	30		EGEDHN
C=C(Br)CNC1CC(N(C)C(=O)CCC2CCCC2)C1	ZINC001725771483	1426455488	/nfs/dbraw/zinc/45/54/88/1426455488.db2.gz	GNCUWYHIOMMGEO-UHFFFAOYSA-N	0	3	343.309	3.444	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCCC2CC2)C[C@@H]1NCc1ccc(C#N)s1	ZINC001733850589	1430117649	/nfs/dbraw/zinc/11/76/49/1430117649.db2.gz	UHFIEORNDOSNOY-DYVFJYSZSA-N	0	3	331.485	3.137	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@@H](C)N(C)Cc2ccc(C#N)cc2)cc1C	ZINC001734059004	1437851216	/nfs/dbraw/zinc/85/12/16/1437851216.db2.gz	LPGSXIOOKSGAAH-QGZVFWFLSA-N	0	3	335.451	3.425	20	30		EGEDHN
CC(C)(C)C(=O)NC[C@@H]1CCCCCN1Cc1cccc(C#N)c1	ZINC001734106244	1437892986	/nfs/dbraw/zinc/89/29/86/1437892986.db2.gz	NFKXYKISNJJTHK-SFHVURJKSA-N	0	3	327.472	3.465	20	30		EGEDHN
Cc1ccc(C(=O)N(C)C[C@H](C)NCc2ccc(F)c(C#N)c2)cc1	ZINC001734352542	1438070233	/nfs/dbraw/zinc/07/02/33/1438070233.db2.gz	QTAZJZATGGFFDP-HNNXBMFYSA-N	0	3	339.414	3.256	20	30		EGEDHN
CC(C)(C)[C@@H](CNCc1ccc(C#N)cc1F)NC(=O)C1(C)CC1	ZINC001734559937	1438157955	/nfs/dbraw/zinc/15/79/55/1438157955.db2.gz	FNGPKXRJDNTHFF-MRXNPFEDSA-N	0	3	331.435	3.118	20	30		EGEDHN
COCC#CCN(CCCNC(=O)[C@@]1(C)CCC(C)=C(C)C1)C1CC1	ZINC001752290740	1440165846	/nfs/dbraw/zinc/16/58/46/1440165846.db2.gz	TXEAKGGUHOZCBB-NRFANRHFSA-N	0	3	346.515	3.134	20	30		EGEDHN
CCCSCC(=O)N(C)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001752295720	1440167138	/nfs/dbraw/zinc/16/71/38/1440167138.db2.gz	WQKGMEBZLKWUDI-UHFFFAOYSA-N	0	3	345.512	3.124	20	30		EGEDHN
C=CCN1CCC(N(CCC)C(=O)[C@H]2Cc3cccc(C)c3O2)CC1	ZINC001752441794	1440181569	/nfs/dbraw/zinc/18/15/69/1440181569.db2.gz	MJVQDGJWHZQZIV-LJQANCHMSA-N	0	3	342.483	3.188	20	30		EGEDHN
CCC[C@H](C)C(=O)NC[C@H](NCc1ccc(C#N)cc1F)C1CC1	ZINC001752452662	1440182624	/nfs/dbraw/zinc/18/26/24/1440182624.db2.gz	WFLMTMNMTLZSMT-UGSOOPFHSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)OCCC(C)C	ZINC001752566710	1440195469	/nfs/dbraw/zinc/19/54/69/1440195469.db2.gz	IJAKFKRFKGBCID-CADBVGFASA-N	0	3	336.520	3.468	20	30		EGEDHN
CCC(CC)[C@H](C)C(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001752579607	1440195746	/nfs/dbraw/zinc/19/57/46/1440195746.db2.gz	LISREJOICGONLB-KSSFIOAISA-N	0	3	345.462	3.460	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001752632262	1440197136	/nfs/dbraw/zinc/19/71/36/1440197136.db2.gz	BRJQSTCYGUYXRT-WKILWMFISA-N	0	3	331.435	3.116	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)CCOc1ccccc1C	ZINC001752825146	1440223283	/nfs/dbraw/zinc/22/32/83/1440223283.db2.gz	MHAFBFAQVVTZME-SFHVURJKSA-N	0	3	330.472	3.311	20	30		EGEDHN
N#Cc1ccccc1CNC1CCC(NC(=O)CC(F)(F)F)CC1	ZINC001752847745	1440232930	/nfs/dbraw/zinc/23/29/30/1440232930.db2.gz	BOOVWVOFXHMEQP-UHFFFAOYSA-N	0	3	339.361	3.028	20	30		EGEDHN
C=CC1(CC(=O)NC[C@@H](C)NCc2ccnc(OC)c2)CCCCC1	ZINC001752904425	1440243742	/nfs/dbraw/zinc/24/37/42/1440243742.db2.gz	JGYSNEOCOCKDDD-MRXNPFEDSA-N	0	3	345.487	3.211	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CCC[C@H](NCc2ccn(C(C)C)n2)C1	ZINC001752976025	1440256026	/nfs/dbraw/zinc/25/60/26/1440256026.db2.gz	IHTICQXYJNNWEU-DLBZAZTESA-N	0	3	332.492	3.337	20	30		EGEDHN
Cc1coc(C)c1C(=O)NCC[C@@H](C)NCc1cc(C#N)ccc1F	ZINC001753004886	1440265549	/nfs/dbraw/zinc/26/55/49/1440265549.db2.gz	RHNMJKOSSMAVDW-CYBMUJFWSA-N	0	3	343.402	3.205	20	30		EGEDHN
C[C@H](CCNC(=O)C1(C(F)F)CCCC1)NCc1ccccc1C#N	ZINC001753012396	1440267376	/nfs/dbraw/zinc/26/73/76/1440267376.db2.gz	WXDHFQAENWIWTH-CQSZACIVSA-N	0	3	349.425	3.368	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)[C@H](C)OC1CCCCCC1	ZINC001753013539	1440267686	/nfs/dbraw/zinc/26/76/86/1440267686.db2.gz	OCLYHJSYRWBUDJ-CABCVRRESA-N	0	3	330.900	3.351	20	30		EGEDHN
COCC#CCN1CC[C@H](CNC(=O)CC(C)(C)C2CCCCC2)C1	ZINC001753137438	1440319502	/nfs/dbraw/zinc/31/95/02/1440319502.db2.gz	JTIVRARYIHWQIW-GOSISDBHSA-N	0	3	348.531	3.071	20	30		EGEDHN
CCCN(CCNC(=O)/C=C(\C)C1CC1)Cc1ccc(F)c(C#N)c1	ZINC001753142565	1440322048	/nfs/dbraw/zinc/32/20/48/1440322048.db2.gz	GZJKXIFILCTNAI-RVDMUPIBSA-N	0	3	343.446	3.382	20	30		EGEDHN
CN(CCNCc1ccc(F)c(C#N)c1)C(=O)C(F)=C1CCCC1	ZINC001753180668	1440336966	/nfs/dbraw/zinc/33/69/66/1440336966.db2.gz	GYUQFOGJANMWAR-UHFFFAOYSA-N	0	3	333.382	3.043	20	30		EGEDHN
C=CCN[C@@H](CNC(=O)C[C@H]1CCCO1)c1ccc(C(C)C)cc1	ZINC001753294774	1440351704	/nfs/dbraw/zinc/35/17/04/1440351704.db2.gz	UYMLRPIJTNLXTO-MOPGFXCFSA-N	0	3	330.472	3.312	20	30		EGEDHN
C#CCCN[C@@H](CNC(=O)c1ccc2ccn(C)c2c1)c1ccccc1	ZINC001753311039	1440356554	/nfs/dbraw/zinc/35/65/54/1440356554.db2.gz	FSUKOKPRYPFXHM-FQEVSTJZSA-N	0	3	345.446	3.262	20	30		EGEDHN
C=CCOCCN1CC[C@H](N(CCC)C(=O)[C@H]2CC23CCCC3)C1	ZINC001753319881	1440362698	/nfs/dbraw/zinc/36/26/98/1440362698.db2.gz	OPHXWZLUOINJLS-ZWKOTPCHSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC(CN(C)Cc2c(C)noc2C)CC1	ZINC001753363999	1440384007	/nfs/dbraw/zinc/38/40/07/1440384007.db2.gz	LMECTCGJDOFLGJ-UHFFFAOYSA-N	0	3	333.476	3.318	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC1CN(Cc2cccc3cccnc32)C1	ZINC001753411726	1440393367	/nfs/dbraw/zinc/39/33/67/1440393367.db2.gz	WOAXUTIMSPHUDU-UHFFFAOYSA-N	0	3	337.467	3.385	20	30		EGEDHN
CCN(C(=O)[C@@H](C)C#N)[C@@H]1CCN(Cc2cc3ccccc3s2)C1	ZINC001753453915	1440407349	/nfs/dbraw/zinc/40/73/49/1440407349.db2.gz	ZJGYQOMIMUJUAG-GOEBONIOSA-N	0	3	341.480	3.484	20	30		EGEDHN
CCN(C(=O)C#CC(C)C)[C@@H]1CCN(Cc2cc(C)ccc2C)C1	ZINC001753455103	1440408023	/nfs/dbraw/zinc/40/80/23/1440408023.db2.gz	GVDWFHFEJIBOHS-HXUWFJFHSA-N	0	3	326.484	3.386	20	30		EGEDHN
C=CCOCCN1CC[C@H](N(CC)C(=O)[C@@H]2C[C@H]2CC(C)(C)C)C1	ZINC001753457498	1440408990	/nfs/dbraw/zinc/40/89/90/1440408990.db2.gz	RUYRAPKDSUSZBW-OKZBNKHCSA-N	0	3	336.520	3.184	20	30		EGEDHN
C=CCOCCN1CC[C@H](N(CC)C(=O)c2cc(C)cc(C)c2)C1	ZINC001753462466	1440411403	/nfs/dbraw/zinc/41/14/03/1440411403.db2.gz	WXMQXQSHKRRDNQ-IBGZPJMESA-N	0	3	330.472	3.042	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)COc2ccccc2Cl)C1	ZINC001753462258	1440411451	/nfs/dbraw/zinc/41/14/51/1440411451.db2.gz	UKMYKRHXEDDCLR-HNNXBMFYSA-N	0	3	336.863	3.218	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@H](CC)NCc2ccc(C#N)c(F)c2)C1	ZINC001753490442	1440419294	/nfs/dbraw/zinc/41/92/94/1440419294.db2.gz	WUPWWDRUDHKLOT-INIZCTEOSA-N	0	3	329.419	3.038	20	30		EGEDHN
CC[C@H](C)CC(=O)NC1(CNCC#Cc2ccccc2)CCCC1	ZINC001753502332	1440423680	/nfs/dbraw/zinc/42/36/80/1440423680.db2.gz	NUWGKPFDQDPLKO-SFHVURJKSA-N	0	3	326.484	3.493	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2oc(C(C)C)nc2C)CCCC1	ZINC001753508417	1440425159	/nfs/dbraw/zinc/42/51/59/1440425159.db2.gz	JFTGTWMGXPTYIW-UHFFFAOYSA-N	0	3	339.867	3.491	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)[C@@H]1C[C@H]1c1ccsc1)C1CC1	ZINC001753521224	1440428505	/nfs/dbraw/zinc/42/85/05/1440428505.db2.gz	FAGVTHDSOFQIRA-UXLLHSPISA-N	0	3	338.904	3.479	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1cc(F)c(F)cc1F)C1CC1	ZINC001753524127	1440429296	/nfs/dbraw/zinc/42/92/96/1440429296.db2.gz	XLANZHHREKOCCH-MRXNPFEDSA-N	0	3	346.780	3.345	20	30		EGEDHN
C[C@@H]1CCCC[C@]1(CNCC#Cc1ccccc1)NC(=O)C(C)(C)F	ZINC001753530028	1440430712	/nfs/dbraw/zinc/43/07/12/1440430712.db2.gz	NKIWBCPNMNIHCF-DYESRHJHSA-N	0	3	344.474	3.441	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N1CCC[C@@H](CCNCc2ccc(C#N)cc2F)C1	ZINC001753554281	1440435697	/nfs/dbraw/zinc/43/56/97/1440435697.db2.gz	WJKLMXGXAWWVQX-MPGHIAIKSA-N	0	3	343.446	3.072	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1CC[C@H](NCc2ccccc2C#N)CC1	ZINC001753582149	1440440425	/nfs/dbraw/zinc/44/04/25/1440440425.db2.gz	GZCKCYMMAMKSMV-MXVIHJGJSA-N	0	3	337.467	3.269	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1CC[C@H](NCC(=C)Br)CC1	ZINC001753586072	1440441463	/nfs/dbraw/zinc/44/14/63/1440441463.db2.gz	UNHRHDMUSFMAES-HDJSIYSDSA-N	0	3	329.282	3.268	20	30		EGEDHN
C#CCNCc1ccc(CNC(=O)C2CCc3ccccc3CC2)cc1	ZINC001753589024	1440442346	/nfs/dbraw/zinc/44/23/46/1440442346.db2.gz	KHAHINDMUBBCDB-UHFFFAOYSA-N	0	3	346.474	3.221	20	30		EGEDHN
C=C(C)CCC(=O)NCCC1CCN(Cc2cccc(OC)n2)CC1	ZINC001753594424	1440443990	/nfs/dbraw/zinc/44/39/90/1440443990.db2.gz	CAAPBPZNEIXGJP-UHFFFAOYSA-N	0	3	345.487	3.165	20	30		EGEDHN
C[C@@H](CNCc1cc(F)ccc1C#N)CNC(=O)C12CCC(CC1)C2	ZINC001753621552	1440450504	/nfs/dbraw/zinc/45/05/04/1440450504.db2.gz	PFLSGZDGZPISBT-BQTBQCLESA-N	0	3	343.446	3.120	20	30		EGEDHN
Cc1cc(C)cc(CC(=O)NC[C@H](C)CNCc2ccccc2C#N)c1	ZINC001753628670	1440451819	/nfs/dbraw/zinc/45/18/19/1440451819.db2.gz	KKPAVVHGUOZSNT-GOSISDBHSA-N	0	3	349.478	3.260	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)C[C@@H](C=C)c1ccccc1)CC2	ZINC001753677759	1440463704	/nfs/dbraw/zinc/46/37/04/1440463704.db2.gz	WLZHQYOEMDFTNU-LJQANCHMSA-N	0	3	336.479	3.294	20	30		EGEDHN
COc1ccc(C(C)C)cc1CNC[C@H](C)N(C)C(=O)C#CC(C)C	ZINC001753689368	1440466248	/nfs/dbraw/zinc/46/62/48/1440466248.db2.gz	JWUATMPDFXZKBX-KRWDZBQOSA-N	0	3	344.499	3.415	20	30		EGEDHN
CCC1(C(=O)N(C)[C@H](C)CNCC#Cc2ccccc2)CCCC1	ZINC001753717503	1440472192	/nfs/dbraw/zinc/47/21/92/1440472192.db2.gz	QFMSEUNRBHZXKW-GOSISDBHSA-N	0	3	326.484	3.445	20	30		EGEDHN
Cc1[nH]ccc1C(=O)N[C@H](CNCC#Cc1ccccc1)CC(C)C	ZINC001753732192	1440476401	/nfs/dbraw/zinc/47/64/01/1440476401.db2.gz	CTBUASBOORHAKB-IBGZPJMESA-N	0	3	337.467	3.109	20	30		EGEDHN
C=C1CCC(C(=O)N2CCCC[C@@H]2CCNCc2nccn2C)CC1	ZINC001753796037	1440489793	/nfs/dbraw/zinc/48/97/93/1440489793.db2.gz	JIDCPOIBKCCKMZ-GOSISDBHSA-N	0	3	344.503	3.027	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)C2=CCCC2)[C@H]1CNCC#Cc1ccccc1	ZINC001753804127	1440491436	/nfs/dbraw/zinc/49/14/36/1440491436.db2.gz	FBZRRPMNMMJOEX-NQIIRXRSSA-N	0	3	336.479	3.365	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H](C)[C@@H]1CNCc1cn(C(C)C)nc1C	ZINC001753805819	1440491706	/nfs/dbraw/zinc/49/17/06/1440491706.db2.gz	RZSAEVFADXFODJ-LPHOPBHVSA-N	0	3	346.519	3.455	20	30		EGEDHN
Cc1[nH]ccc1C(=O)N1CCC[C@@H](C)[C@H]1CNCC#Cc1ccccc1	ZINC001753805902	1440491760	/nfs/dbraw/zinc/49/17/60/1440491760.db2.gz	SVZNNFBMEOHGAK-DYESRHJHSA-N	0	3	349.478	3.205	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@@H](C)[C@@H]1CNCc1ccc(OC)nc1	ZINC001753808210	1440492077	/nfs/dbraw/zinc/49/20/77/1440492077.db2.gz	CGGYOGHMGWWUOO-AEFFLSMTSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=C(Br)CN[C@@H](CNC(=O)c1occc1Cl)C(C)C	ZINC001753838090	1440501633	/nfs/dbraw/zinc/50/16/33/1440501633.db2.gz	NJHJDHMKHQZFTG-NSHDSACASA-N	0	3	349.656	3.186	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)[C@H](C)Oc1cccc(C)c1)C(C)C	ZINC001753843585	1440503567	/nfs/dbraw/zinc/50/35/67/1440503567.db2.gz	SCDOAVTXCLKEMZ-DOTOQJQBSA-N	0	3	338.879	3.245	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)[C@@H](C)Oc1cccc(C)c1)C(C)C	ZINC001753843586	1440503662	/nfs/dbraw/zinc/50/36/62/1440503662.db2.gz	SCDOAVTXCLKEMZ-NVXWUHKLSA-N	0	3	338.879	3.245	20	30		EGEDHN
CCCc1ccc(CN(C)CCN(C)C(=O)c2c[nH]c(C#N)c2)cc1	ZINC001753850971	1440506697	/nfs/dbraw/zinc/50/66/97/1440506697.db2.gz	NVPZTHQJYMWIAU-UHFFFAOYSA-N	0	3	338.455	3.043	20	30		EGEDHN
CC#CCCCC(=O)N(C)CCN(C)Cc1cccc(OC)c1C	ZINC001753861267	1440511446	/nfs/dbraw/zinc/51/14/46/1440511446.db2.gz	ZJWBPKDJKNZRKL-UHFFFAOYSA-N	0	3	330.472	3.087	20	30		EGEDHN
C=C(Cl)CNCC[C@@H](C)NC(=O)c1c(F)ccc(F)c1Cl	ZINC001754001608	1440530161	/nfs/dbraw/zinc/53/01/61/1440530161.db2.gz	HMBAJZXXWXTVJQ-SECBINFHSA-N	0	3	337.197	3.469	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N(CC)CCNCc1cnn(C(C)(C)C)c1	ZINC001754062064	1440536979	/nfs/dbraw/zinc/53/69/79/1440536979.db2.gz	ZXGYRUAGMYKDNN-UHFFFAOYSA-N	0	3	334.508	3.179	20	30		EGEDHN
N#Cc1cccc(CNC/C=C/CNC(=O)[C@@H]2CCCC3(CC3)C2)c1	ZINC001754119257	1440542619	/nfs/dbraw/zinc/54/26/19/1440542619.db2.gz	JGWLPRFNWVIHOW-VQSDEBNRSA-N	0	3	337.467	3.291	20	30		EGEDHN
C[C@H]1CC(C(=O)NC/C=C\CNCc2ccc(C#N)cc2)C[C@@H](C)C1	ZINC001754213956	1440551649	/nfs/dbraw/zinc/55/16/49/1440551649.db2.gz	OUKSKLSBZIAOFC-CDERCHCSSA-N	0	3	339.483	3.393	20	30		EGEDHN
C[C@H](CNCC#Cc1ccc(Cl)cc1)NC(=O)[C@]12C[C@H]1CCCC2	ZINC001754241231	1440555862	/nfs/dbraw/zinc/55/58/62/1440555862.db2.gz	SUVIJAFVNRLXTD-WRWLIDTKSA-N	0	3	344.886	3.366	20	30		EGEDHN
C=C[C@@H](CC(=O)N[C@H](C)CNCC#Cc1ccccc1)c1ccccc1	ZINC001754255118	1440559047	/nfs/dbraw/zinc/55/90/47/1440559047.db2.gz	WQZYKSAIBRTKAY-CTNGQTDRSA-N	0	3	346.474	3.492	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)c(F)c1)NC(=O)C1CC(C(C)(C)C)C1	ZINC001754255806	1440559223	/nfs/dbraw/zinc/55/92/23/1440559223.db2.gz	ANYGBTZHNUMUDA-NVPAJSRCSA-N	0	3	345.462	3.364	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccccc1)NC(=O)C1(C)CCC(F)(F)CC1	ZINC001754273584	1440561948	/nfs/dbraw/zinc/56/19/48/1440561948.db2.gz	XRWRQTVJKBFKHG-INIZCTEOSA-N	0	3	348.437	3.348	20	30		EGEDHN
C=C[C@H](C(=O)N[C@@H](C)CNCc1c(C)nsc1C)c1ccccc1	ZINC001754294930	1440566130	/nfs/dbraw/zinc/56/61/30/1440566130.db2.gz	GOJCTLDSMVWECI-GUYCJALGSA-N	0	3	343.496	3.324	20	30		EGEDHN
Cc1ccsc1C(=O)N[C@@H](C)CN(C)Cc1ccc(C#N)cc1	ZINC001754298636	1440567047	/nfs/dbraw/zinc/56/70/47/1440567047.db2.gz	JPGZSQYFAGOJQT-AWEZNQCLSA-N	0	3	327.453	3.179	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)C12CCC(CC1)C2	ZINC001754315988	1440575542	/nfs/dbraw/zinc/57/55/42/1440575542.db2.gz	LRIGEARJDUFNRL-LSWWBPAMSA-N	0	3	325.456	3.075	20	30		EGEDHN
CN(CCCNCc1ccccc1C#N)C(=O)C[C@@H]1CCC(F)(F)C1	ZINC001754377330	1440593096	/nfs/dbraw/zinc/59/30/96/1440593096.db2.gz	VEPMCGKVKSOVEU-HNNXBMFYSA-N	0	3	349.425	3.322	20	30		EGEDHN
C=CCCCCCN1CC[C@@H]1CNC(=O)c1[nH]nc2ccccc21	ZINC001754499659	1440613519	/nfs/dbraw/zinc/61/35/19/1440613519.db2.gz	CGSZGFZPKYNIMO-OAHLLOKOSA-N	0	3	326.444	3.113	20	30		EGEDHN
C=CCC[C@@H](C)N1CC[C@H]1CNC(=O)c1cnn(C2CCCC2)c1C	ZINC001754500818	1440614245	/nfs/dbraw/zinc/61/42/45/1440614245.db2.gz	SDUBKVJIYMAEPM-QAPCUYQASA-N	0	3	344.503	3.465	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NC[C@@H]1CCN1[C@H](C)c1ccccc1C	ZINC001754501890	1440614742	/nfs/dbraw/zinc/61/47/42/1440614742.db2.gz	ZXOPCAQNQQTGBO-NQIIRXRSSA-N	0	3	346.474	3.471	20	30		EGEDHN
C=C(Cl)CN(CC1CC1)C1CCN(C(=O)[C@H](CC)OCC)CC1	ZINC001754547441	1440628127	/nfs/dbraw/zinc/62/81/27/1440628127.db2.gz	DDECRWDJXIDTGP-KRWDZBQOSA-N	0	3	342.911	3.257	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC(N(CCOC)C[C@@H](F)CC)CC1	ZINC001754559766	1440633272	/nfs/dbraw/zinc/63/32/72/1440633272.db2.gz	QLVHNHWSZQFSNP-INIZCTEOSA-N	0	3	342.499	3.276	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@]3(CCN(Cc4ccccn4)C3)C2)CCC1	ZINC001754566689	1440635976	/nfs/dbraw/zinc/63/59/76/1440635976.db2.gz	AQBXNRUCZUSULU-FQEVSTJZSA-N	0	3	339.483	3.252	20	30		EGEDHN
C[C@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)C1(CCF)CC1	ZINC001754596858	1440641699	/nfs/dbraw/zinc/64/16/99/1440641699.db2.gz	ICGQIRPSWDNTNV-MAUKXSAKSA-N	0	3	343.446	3.167	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](NC/C(Cl)=C\Cl)C[C@@H]1C	ZINC001754598195	1440641918	/nfs/dbraw/zinc/64/19/18/1440641918.db2.gz	HVQXIWIEWLVZFC-LTJDPMBBSA-N	0	3	331.287	3.468	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](NCc2nc(C)c(C)s2)C[C@@H]1C	ZINC001754597713	1440641933	/nfs/dbraw/zinc/64/19/33/1440641933.db2.gz	FGOSTVPDSJNLPY-WMLDXEAASA-N	0	3	347.528	3.423	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)Cc2coc3cc(F)ccc23)CC1	ZINC001754626688	1440646567	/nfs/dbraw/zinc/64/65/67/1440646567.db2.gz	LZKVSKGIELJRFX-UHFFFAOYSA-N	0	3	330.403	3.271	20	30		EGEDHN
C[C@@H](CC(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1)C1CC1	ZINC001754629427	1440647343	/nfs/dbraw/zinc/64/73/43/1440647343.db2.gz	CCZQTXWBDIARFI-INIZCTEOSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H](CNCc1ccccc1F)C1CCCC1	ZINC001754647988	1440651108	/nfs/dbraw/zinc/65/11/08/1440651108.db2.gz	UNCBUWKLDGRGFF-LJQANCHMSA-N	0	3	330.447	3.250	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)[C@H](C)CCOc2ccccc2)C1	ZINC001754686051	1440664769	/nfs/dbraw/zinc/66/47/69/1440664769.db2.gz	XXDAFXFJDCSSCL-XLIONFOSSA-N	0	3	330.472	3.248	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@](C)(CNCc2ccncc2Cl)C1	ZINC001754693689	1440666572	/nfs/dbraw/zinc/66/65/72/1440666572.db2.gz	WRAVKBFKRRKXNJ-IBGZPJMESA-N	0	3	347.890	3.257	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@](C)(CNCc2oc(CC)nc2C)C1	ZINC001754704371	1440668685	/nfs/dbraw/zinc/66/86/85/1440668685.db2.gz	GUFWCRSFHLFURB-VQTJNVASSA-N	0	3	347.503	3.476	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@@H](CNC(=O)C2(CC)CCCCC2)C1	ZINC001754744937	1440684470	/nfs/dbraw/zinc/68/44/70/1440684470.db2.gz	QHYLALIUJFVWRF-INIZCTEOSA-N	0	3	340.458	3.444	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@H]1CC[C@H](CNCc2ccon2)CC1	ZINC001754833673	1440696389	/nfs/dbraw/zinc/69/63/89/1440696389.db2.gz	JFFUCHWCVPZNMN-WKILWMFISA-N	0	3	333.476	3.289	20	30		EGEDHN
CC#CCNCCN(Cc1ccccc1)C(=O)[C@@H]1C[C@@H]2C=C[C@H]1CC2	ZINC001754836893	1440697108	/nfs/dbraw/zinc/69/71/08/1440697108.db2.gz	DFFFDPRZLZLLMV-HLAWJBBLSA-N	0	3	336.479	3.230	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@H]2CN(Cc3scnc3C)C[C@H]21	ZINC001754873501	1440705950	/nfs/dbraw/zinc/70/59/50/1440705950.db2.gz	LPTBXLDJYONJFC-DLBZAZTESA-N	0	3	345.512	3.068	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)CC(C)(C)CC(F)(F)F)[C@@H]2C1	ZINC001754874924	1440706544	/nfs/dbraw/zinc/70/65/44/1440706544.db2.gz	TYBIFSMYEWNOJO-UONOGXRCSA-N	0	3	332.410	3.464	20	30		EGEDHN
N#Cc1ccccc1CNCC[C@@H]1CCN(C(=O)CC2CCCC2)C1	ZINC001754901302	1440706959	/nfs/dbraw/zinc/70/69/59/1440706959.db2.gz	AIMPYZPTEPBXBG-GOSISDBHSA-N	0	3	339.483	3.467	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CC[C@@H](CCNCc2ccccc2C#N)C1	ZINC001754934807	1440711023	/nfs/dbraw/zinc/71/10/23/1440711023.db2.gz	SINCEGULKYLDDM-IAGOWNOFSA-N	0	3	327.472	3.179	20	30		EGEDHN
CC#CCN[C@@H](C)c1ccc(CNC(=O)c2occ3c2CCC3)cc1	ZINC001754948040	1440713917	/nfs/dbraw/zinc/71/39/17/1440713917.db2.gz	FGPCKZGZHZMAIZ-HNNXBMFYSA-N	0	3	336.435	3.372	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC[C@@]2(CCN(Cc3ocnc3C)C2)C1	ZINC001755079481	1440750535	/nfs/dbraw/zinc/75/05/35/1440750535.db2.gz	LASITDINDDLKAE-XLIONFOSSA-N	0	3	345.487	3.400	20	30		EGEDHN
CC/C(C)=C/C(=O)N1C[C@H](NCC#Cc2ccccc2Cl)[C@@H](C)C1	ZINC001755108825	1440753980	/nfs/dbraw/zinc/75/39/80/1440753980.db2.gz	MDLSQDILJILWQG-MLHMOSTNSA-N	0	3	344.886	3.484	20	30		EGEDHN
Cc1ccccc1CC(=O)N1C[C@H](NCC#Cc2ccccc2)[C@@H](C)C1	ZINC001755121427	1440755691	/nfs/dbraw/zinc/75/56/91/1440755691.db2.gz	HVOZPDSNBKPGAE-UGKGYDQZSA-N	0	3	346.474	3.026	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CCN(Cc2ncccc2C)CC1(C)C	ZINC001755141851	1440760838	/nfs/dbraw/zinc/76/08/38/1440760838.db2.gz	KFHMJQDUGUIESU-GOSISDBHSA-N	0	3	329.488	3.463	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)[C@@H](CC)Oc2ccccc2F)C(C)(C)C1	ZINC001755143943	1440762199	/nfs/dbraw/zinc/76/21/99/1440762199.db2.gz	SKEGAGTWDBMGCR-SJLPKXTDSA-N	0	3	348.462	3.386	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@@H]1CNC(=O)C1(CCOC)CC1	ZINC001755171758	1440769156	/nfs/dbraw/zinc/76/91/56/1440769156.db2.gz	CKIGDPHQOYLVDM-IBGZPJMESA-N	0	3	342.483	3.095	20	30		EGEDHN
C=CCCCN1CCc2ccccc2[C@@H]1CNC(=O)[C@@H](C)OCC	ZINC001755171626	1440769173	/nfs/dbraw/zinc/76/91/73/1440769173.db2.gz	ALSJQYDJLAGGPF-APWZRJJASA-N	0	3	330.472	3.093	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]1CN(C)CCOCc1ccccc1	ZINC001755197184	1440777539	/nfs/dbraw/zinc/77/75/39/1440777539.db2.gz	WEFAYYYUBYPYMX-IBGZPJMESA-N	0	3	344.499	3.338	20	30		EGEDHN
C=C(Cl)CNCC1CC(NC(=O)[C@@]2(C)CCc3ccccc32)C1	ZINC001755224930	1440785595	/nfs/dbraw/zinc/78/55/95/1440785595.db2.gz	ZVXYJUMAQNJZJY-KJXMEXGPSA-N	0	3	332.875	3.127	20	30		EGEDHN
C=CCC(C)(C)C(=O)N(C)C1CCC(N[C@H](C)c2cnccn2)CC1	ZINC001755276109	1440799174	/nfs/dbraw/zinc/79/91/74/1440799174.db2.gz	SPEWXKPUHMACIY-KLAILNCOSA-N	0	3	344.503	3.499	20	30		EGEDHN
Cc1c[nH]cc1C(=O)NC1(CNCC#Cc2ccccc2)CCCCC1	ZINC001755355351	1440829244	/nfs/dbraw/zinc/82/92/44/1440829244.db2.gz	BUQSZXJORSUHRO-UHFFFAOYSA-N	0	3	349.478	3.397	20	30		EGEDHN
CC#CCCCC(=O)NC[C@H]1CCCCCN1Cc1cncc(C)c1	ZINC001755365181	1440834233	/nfs/dbraw/zinc/83/42/33/1440834233.db2.gz	BWIFHBCNUMXSCZ-HXUWFJFHSA-N	0	3	341.499	3.444	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)[C@]1(c2ccccc2)CCCO1	ZINC001755367494	1440835441	/nfs/dbraw/zinc/83/54/41/1440835441.db2.gz	HFWPELRMDNNJOY-TZIWHRDSSA-N	0	3	342.483	3.239	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C[C@@H](C)c2ccccc2C)C(C)(C)C1	ZINC001755411813	1440846645	/nfs/dbraw/zinc/84/66/45/1440846645.db2.gz	OMXLDMHGXQCZKW-IEBWSBKVSA-N	0	3	326.484	3.339	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H](C)CCCNCc2ccc(C#N)cc2F)co1	ZINC001755495370	1440861958	/nfs/dbraw/zinc/86/19/58/1440861958.db2.gz	HMPSALFKFDNDEA-ZDUSSCGKSA-N	0	3	343.402	3.287	20	30		EGEDHN
C[C@H](CCCNCc1cc(C#N)ccc1F)NC(=O)C1(C2CC2)CC1	ZINC001755502042	1440862804	/nfs/dbraw/zinc/86/28/04/1440862804.db2.gz	QCKAMQJAGQBZID-CQSZACIVSA-N	0	3	343.446	3.262	20	30		EGEDHN
C[C@@H](CCCNCc1ccccc1C#N)NC(=O)[C@H]1CCC1(C)C	ZINC001755513876	1440863890	/nfs/dbraw/zinc/86/38/90/1440863890.db2.gz	XASQQQYIQRQAGO-MAUKXSAKSA-N	0	3	327.472	3.369	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC(N(C)Cc2oc(C)nc2C)CC1	ZINC001755529985	1440866915	/nfs/dbraw/zinc/86/69/15/1440866915.db2.gz	OIYNYQTVOHMKDZ-UHFFFAOYSA-N	0	3	345.487	3.483	20	30		EGEDHN
C=C1CCC(C(=O)N(C)[C@H](CNCc2ccns2)C2CC2)CC1	ZINC001755566259	1440875886	/nfs/dbraw/zinc/87/58/86/1440875886.db2.gz	PLANMCRKZGJXDE-QGZVFWFLSA-N	0	3	333.501	3.216	20	30		EGEDHN
CCCC[C@@H](C)C(=O)N(C)C[C@@H](C)NCc1ccc(F)c(C#N)c1	ZINC001755585767	1440880451	/nfs/dbraw/zinc/88/04/51/1440880451.db2.gz	USNJBYDMFWFIIK-HUUCEWRRSA-N	0	3	333.451	3.460	20	30		EGEDHN
C[C@H](CN(C)C(=O)c1coc(C(F)F)c1)NCC#Cc1ccccc1	ZINC001755603052	1440884544	/nfs/dbraw/zinc/88/45/44/1440884544.db2.gz	VDDJDIANCNHTPL-CQSZACIVSA-N	0	3	346.377	3.319	20	30		EGEDHN
Cc1cc(C(=O)N(C)C[C@@H](C)NCC#Cc2ccccc2)ccc1F	ZINC001755603252	1440884686	/nfs/dbraw/zinc/88/46/86/1440884686.db2.gz	XPDDAFVFSRGTAZ-QGZVFWFLSA-N	0	3	338.426	3.236	20	30		EGEDHN
C[C@@H]1[C@H](NCc2ccc(C#N)s2)CCN1C(=O)/C=C\C(C)(C)C	ZINC001755651639	1440891399	/nfs/dbraw/zinc/89/13/99/1440891399.db2.gz	HZVKWKOAMMITKI-WKEVDZOPSA-N	0	3	331.485	3.301	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N[C@]12CCC[C@H]1N(Cc1ccsc1)CC2	ZINC001755697509	1440898487	/nfs/dbraw/zinc/89/84/87/1440898487.db2.gz	YSJYDOWJBHMLOD-SUMDDJOVSA-N	0	3	348.512	3.343	20	30		EGEDHN
C#CCCCC(=O)N[C@]12CCC[C@H]1N(Cc1c(C)nsc1C)CC2	ZINC001755697689	1440898556	/nfs/dbraw/zinc/89/85/56/1440898556.db2.gz	ARNNDFMYXBEAIR-MJGOQNOKSA-N	0	3	345.512	3.177	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](NCc2cnn(C(C)(C)C)c2)C(C)(C)C1	ZINC001755762160	1440915266	/nfs/dbraw/zinc/91/52/66/1440915266.db2.gz	XEJUJLSGIIYNID-QGZVFWFLSA-N	0	3	346.519	3.321	20	30		EGEDHN
CCCCC[C@H](CC)C(=O)N1C[C@@H](NCC#CCOC)C(C)(C)C1	ZINC001755765974	1440916258	/nfs/dbraw/zinc/91/62/58/1440916258.db2.gz	AEWHQRVAGZKXLU-ZWKOTPCHSA-N	0	3	336.520	3.069	20	30		EGEDHN
C#CCCCC(=O)N[C@@H](CNCc1ccc(C#N)s1)C(C)(C)C	ZINC001755823599	1440926544	/nfs/dbraw/zinc/92/65/44/1440926544.db2.gz	IVAHKXORZQSLJQ-INIZCTEOSA-N	0	3	331.485	3.044	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H](CNCc1cccc(OC)n1)C(C)(C)C	ZINC001755824647	1440926806	/nfs/dbraw/zinc/92/68/06/1440926806.db2.gz	FILQSXOQIHOFPC-INIZCTEOSA-N	0	3	347.503	3.313	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@H](C)C1CCN(Cc2cn(C)nc2C)CC1	ZINC001755845134	1440932897	/nfs/dbraw/zinc/93/28/97/1440932897.db2.gz	XRKNRXLSAJHULC-FOIQADDNSA-N	0	3	346.519	3.048	20	30		EGEDHN
CC[C@@H](F)C(=O)N[C@@H](C)C1CCN(Cc2cccc(C#N)c2)CC1	ZINC001755848645	1440934231	/nfs/dbraw/zinc/93/42/31/1440934231.db2.gz	WQUWYPSCKAYYAD-KBXCAEBGSA-N	0	3	331.435	3.023	20	30		EGEDHN
CN(C(=O)[C@]1(C)CC=CCC1)C1CC(NCC#Cc2ccccc2)C1	ZINC001755857775	1440936133	/nfs/dbraw/zinc/93/61/33/1440936133.db2.gz	BOEWQDHFCCLOOP-QETWGEEDSA-N	0	3	336.479	3.364	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N(C)C1CC(NCc2ccc(C#N)cc2F)C1	ZINC001755860272	1440936672	/nfs/dbraw/zinc/93/66/72/1440936672.db2.gz	YLEGEUVJMQKMJL-RZNTYIFUSA-N	0	3	341.430	3.299	20	30		EGEDHN
CC(F)(F)C(=O)NC1(C2CCN(Cc3cccc(C#N)c3)CC2)CC1	ZINC001755867591	1440938108	/nfs/dbraw/zinc/93/81/08/1440938108.db2.gz	PVOAHGQQOFGJTE-UHFFFAOYSA-N	0	3	347.409	3.074	20	30		EGEDHN
C#Cc1ccc(CN[C@H](Cc2ccccc2)[C@@H](O)C(F)(F)F)cc1	ZINC000809619195	1126110914	/nfs/dbraw/zinc/11/09/14/1126110914.db2.gz	VMUAHYOGIQBQES-QZTJIDSGSA-N	0	3	333.353	3.292	20	30		EGEDHN
N#Cc1cccc(OCCN2CCC(C(=O)Nc3ccccc3)CC2)c1	ZINC000051919779	214108241	/nfs/dbraw/zinc/10/82/41/214108241.db2.gz	OKCHNFSTKQHSLJ-UHFFFAOYSA-N	0	3	349.434	3.288	20	30		EGEDHN
Cn1ncc2c1CCC[C@@H]2NCCSCc1ccccc1C#N	ZINC000177823644	232004483	/nfs/dbraw/zinc/00/44/83/232004483.db2.gz	YGUULUBRZLECFO-KRWDZBQOSA-N	0	3	326.469	3.192	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)c1cccc(F)c1F	ZINC000102342068	219196699	/nfs/dbraw/zinc/19/66/99/219196699.db2.gz	XSLRVOXGXCALPV-UHFFFAOYSA-N	0	3	343.377	3.040	20	30		EGEDHN
Cn1ccnc1[C@H](NCCSCc1ccccc1C#N)C1CC1	ZINC000187762218	282758182	/nfs/dbraw/zinc/75/81/82/282758182.db2.gz	WLYGAZIHYLBWBM-QGZVFWFLSA-N	0	3	326.469	3.266	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C(=O)[C@@H]1CCCCN1C1CCCC1	ZINC000241897230	243006379	/nfs/dbraw/zinc/00/63/79/243006379.db2.gz	TWTLVAQYLSIECA-IBGZPJMESA-N	0	3	325.456	3.314	20	30		EGEDHN
C=CCOCCCC(=O)Nc1ccc(CCN2CCSCC2)cc1	ZINC000079815948	217255906	/nfs/dbraw/zinc/25/59/06/217255906.db2.gz	VMIGMAGKFWNSPY-UHFFFAOYSA-N	0	3	348.512	3.199	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@@H](C)N1CC[C@@H](COCc2ccccc2)C1	ZINC000266524091	248344794	/nfs/dbraw/zinc/34/47/94/248344794.db2.gz	APZMZVZPVQWWJC-UYAOXDASSA-N	0	3	342.483	3.114	20	30		EGEDHN
C[C@H](N[C@@H]1CC(=O)N([C@H]2C[C@@H]2c2ccccc2)C1)c1cccc(C#N)c1	ZINC000378449766	169123504	/nfs/dbraw/zinc/12/35/04/169123504.db2.gz	GIPCYQOFHNHTEM-NOOVBMIQSA-N	0	3	345.446	3.366	20	30		EGEDHN
CCc1nnc(NC[C@@H](Cc2ccccc2)N(C)C)c(C#N)c1CC	ZINC000467717949	269681650	/nfs/dbraw/zinc/68/16/50/269681650.db2.gz	JGCWHGRGZZXSMS-MRXNPFEDSA-N	0	3	337.471	3.058	20	30		EGEDHN
C[C@@H](NC[C@@H](O)c1ccc(C#N)cc1)c1ccc(NC(=O)C2CC2)cc1	ZINC000268573809	252035505	/nfs/dbraw/zinc/03/55/05/252035505.db2.gz	BFASBMQRIKYCKB-JLTOFOAXSA-N	0	3	349.434	3.291	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N(C)CC1CCN(c2ccncc2)CC1	ZINC000337842998	141065260	/nfs/dbraw/zinc/06/52/60/141065260.db2.gz	WAZKCAZCEKTVCM-UHFFFAOYSA-N	0	3	348.450	3.250	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN2CC[C@H](c3c(F)cccc3F)C2)cc1	ZINC000185319566	144111349	/nfs/dbraw/zinc/11/13/49/144111349.db2.gz	WVTDBZUQYQAUTR-YJBOKZPZSA-N	0	3	328.362	3.359	20	30		EGEDHN
COCC#CCN[C@@H](Cc1ccc(OC)cc1)c1ccc(OC)cc1	ZINC000677818641	549336710	/nfs/dbraw/zinc/33/67/10/549336710.db2.gz	FHVLZEBXBGECFO-NRFANRHFSA-N	0	3	339.435	3.227	20	30		EGEDHN
Cc1cc(C#N)ccc1Oc1ccc(C(=O)NC[C@H]2CCCN2C)cc1	ZINC000120333673	152268719	/nfs/dbraw/zinc/26/87/19/152268719.db2.gz	KSEVPQFODNLJSB-GOSISDBHSA-N	0	3	349.434	3.483	20	30		EGEDHN
C[C@@H](CN1CCCCCC1)NC(=O)CSCc1ccc(C#N)cc1	ZINC000186285543	153004665	/nfs/dbraw/zinc/00/46/65/153004665.db2.gz	JDBDSCQHUSUOLK-INIZCTEOSA-N	0	3	345.512	3.172	20	30		EGEDHN
CCc1nnc(N[C@H]2CCN(Cc3ccccc3)C2)c(C#N)c1CC	ZINC000310696619	154142761	/nfs/dbraw/zinc/14/27/61/154142761.db2.gz	PPDKZKJOWLOHML-INIZCTEOSA-N	0	3	335.455	3.159	20	30		EGEDHN
Cc1ccnc(N2C[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C2)c1C#N	ZINC000310994024	154144844	/nfs/dbraw/zinc/14/48/44/154144844.db2.gz	HEPUSQONBQGKNE-RBUKOAKNSA-N	0	3	332.451	3.220	20	30		EGEDHN
CCOC(=O)CC(C)(C)CCN1CCN(c2ccccc2C#N)CC1	ZINC000346917881	156195998	/nfs/dbraw/zinc/19/59/98/156195998.db2.gz	HFIJBPOUGPDACM-UHFFFAOYSA-N	0	3	343.471	3.050	20	30		EGEDHN
CN(c1ccc(NC(=O)c2cccc(C#N)c2)cc1)C1CCN(C)CC1	ZINC000097207607	162047550	/nfs/dbraw/zinc/04/75/50/162047550.db2.gz	SRHWRMFUEUXPOD-UHFFFAOYSA-N	0	3	348.450	3.341	20	30		EGEDHN
N#Cc1ccc(CN(Cc2ccc(-n3cncn3)cc2)C2CC2)cc1	ZINC000338592528	163285674	/nfs/dbraw/zinc/28/56/74/163285674.db2.gz	MNNPAJIYLHAZBJ-UHFFFAOYSA-N	0	3	329.407	3.304	20	30		EGEDHN
CC[C@@H](NCc1ccncc1OCCN(C)C)c1ccc(C#N)cc1	ZINC000343929781	164068906	/nfs/dbraw/zinc/06/89/06/164068906.db2.gz	LKGPIKVAOSUNJD-LJQANCHMSA-N	0	3	338.455	3.135	20	30		EGEDHN
CN(C)c1ccccc1CN(C)CCC(=O)Nc1sccc1C#N	ZINC000344125182	164109152	/nfs/dbraw/zinc/10/91/52/164109152.db2.gz	RMJINSGUAPMCNX-UHFFFAOYSA-N	0	3	342.468	3.146	20	30		EGEDHN
N#Cc1cc(C(=O)NC[C@H](c2ccccc2)N2CCCC2)ccc1F	ZINC000345629521	164230370	/nfs/dbraw/zinc/23/03/70/164230370.db2.gz	NMRZOJFUEFNOMZ-LJQANCHMSA-N	0	3	337.398	3.264	20	30		EGEDHN
CCOc1ccc(CN[C@H]2CCCN(c3ccc(C#N)cc3)C2=O)cc1	ZINC000351909194	165145405	/nfs/dbraw/zinc/14/54/05/165145405.db2.gz	NEIHTJDXCZPINN-FQEVSTJZSA-N	0	3	349.434	3.242	20	30		EGEDHN
CCOc1ccc(CN[C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)cc1	ZINC000351909196	165145594	/nfs/dbraw/zinc/14/55/94/165145594.db2.gz	NEIHTJDXCZPINN-HXUWFJFHSA-N	0	3	349.434	3.242	20	30		EGEDHN
CN(C)C[C@@H](NC(=O)CCc1ccc(C#N)cc1)c1ccc(F)cc1	ZINC000359820153	167241557	/nfs/dbraw/zinc/24/15/57/167241557.db2.gz	MKESIJAYWSSFMT-LJQANCHMSA-N	0	3	339.414	3.049	20	30		EGEDHN
CC(C)(C(=O)N[C@@H]1CCN(C2CCCC2)C1)c1cc(F)cc(C#N)c1	ZINC000367217381	168194909	/nfs/dbraw/zinc/19/49/09/168194909.db2.gz	MSQGFMUPJJDLRT-QGZVFWFLSA-N	0	3	343.446	3.108	20	30		EGEDHN
CC[C@H](N[C@@H]1CCCN(c2ccc(C#N)cc2F)C1)c1nccn1C	ZINC000367746121	168265911	/nfs/dbraw/zinc/26/59/11/168265911.db2.gz	FASLQGDGRSQWBL-WBVHZDCISA-N	0	3	341.434	3.141	20	30		EGEDHN
N#Cc1ccccc1OCCN1CC[C@@H](n2ncc3ccccc32)C1	ZINC000367998810	168294247	/nfs/dbraw/zinc/29/42/47/168294247.db2.gz	IHLIVENNVMDGEB-GOSISDBHSA-N	0	3	332.407	3.234	20	30		EGEDHN
C[C@@H](CCc1ccc(O)cc1)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000350476207	269834416	/nfs/dbraw/zinc/83/44/16/269834416.db2.gz	JLCAFYXZFFQTFG-HNAYVOBHSA-N	0	3	347.418	3.084	20	30		EGEDHN
C[C@H](NC[C@H](O)COc1ccccc1Cl)c1ccc(C#N)cc1	ZINC000298401932	269879226	/nfs/dbraw/zinc/87/92/26/269879226.db2.gz	JWFSXMJFKPVMBA-BBRMVZONSA-N	0	3	330.815	3.302	20	30		EGEDHN
CCc1ccc2nccc(N3CCN(c4ccc(C#N)cn4)CC3)c2c1	ZINC000450268457	270053228	/nfs/dbraw/zinc/05/32/28/270053228.db2.gz	GVAZUGNQMYGSKX-UHFFFAOYSA-N	0	3	343.434	3.390	20	30		EGEDHN
CCC[C@H](C)NC(=O)[C@@H]1CCCN(Cc2ccc(C#N)c(C)c2)C1	ZINC000486674071	270056186	/nfs/dbraw/zinc/05/61/86/270056186.db2.gz	HTQFJALPXGPGRQ-QFBILLFUSA-N	0	3	327.472	3.384	20	30		EGEDHN
C#C[C@H](NC(=O)C(C#N)Cc1ccc(C#N)cc1)c1ccc(Cl)cc1	ZINC000491712725	270058212	/nfs/dbraw/zinc/05/82/12/270058212.db2.gz	AFFKCBXCOXLCCY-MJGOQNOKSA-N	0	3	347.805	3.385	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN1CC[C@@H]1Cc1ccccc1	ZINC000533346064	270060701	/nfs/dbraw/zinc/06/07/01/270060701.db2.gz	RCKPAHRZRCNGLL-MRXNPFEDSA-N	0	3	325.437	3.265	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@H](NCc1ccc(F)c(C#N)c1)C1CC1	ZINC000185227358	265720517	/nfs/dbraw/zinc/72/05/17/265720517.db2.gz	WDWAWXRZQTYLCQ-INIZCTEOSA-N	0	3	333.407	3.090	20	30		EGEDHN
CCC[C@H](C)NC(=O)[C@@H]1CCCN(Cc2ccc(C#N)c(OC)c2)C1	ZINC000282482378	266077580	/nfs/dbraw/zinc/07/75/80/266077580.db2.gz	WXLVCFOENVUGGF-MAUKXSAKSA-N	0	3	343.471	3.084	20	30		EGEDHN
CCN(CC)[C@H](CNc1cc(N)c([N+](=O)[O-])c(C#N)c1)c1ccco1	ZINC000288603392	266120351	/nfs/dbraw/zinc/12/03/51/266120351.db2.gz	WNDYLXCNYQSZSE-OAHLLOKOSA-N	0	3	343.387	3.137	20	30		EGEDHN
CCN(C[C@@H]1CCN(Cc2ccc(C#N)c(F)c2)C1)CC(F)(F)F	ZINC000192055488	266132417	/nfs/dbraw/zinc/13/24/17/266132417.db2.gz	YAAIXPJNOSVCQY-AWEZNQCLSA-N	0	3	343.368	3.403	20	30		EGEDHN
CC(C)CC[C@H]1CCCCN1CC(=O)NCc1cccc(C#N)c1	ZINC000472815257	266897947	/nfs/dbraw/zinc/89/79/47/266897947.db2.gz	YCEZWWUSXASWPA-LJQANCHMSA-N	0	3	327.472	3.465	20	30		EGEDHN
CCCc1[nH]ccc1C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000421747808	267040705	/nfs/dbraw/zinc/04/07/05/267040705.db2.gz	CVOAAZORMYEZPN-UHFFFAOYSA-N	0	3	338.455	3.043	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)Nc1cccc(C#N)n1)c1ccccc1	ZINC000517028833	267061021	/nfs/dbraw/zinc/06/10/21/267061021.db2.gz	QMMJVSUAZZUCTG-KRWDZBQOSA-N	0	3	337.427	3.158	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)Nc1cccc(C#N)n1)c1ccccc1	ZINC000517028834	267061407	/nfs/dbraw/zinc/06/14/07/267061407.db2.gz	QMMJVSUAZZUCTG-QGZVFWFLSA-N	0	3	337.427	3.158	20	30		EGEDHN
CCOC(=O)C(C)(C)C1CCN(CCOc2ccccc2C#N)CC1	ZINC000510077586	267112587	/nfs/dbraw/zinc/11/25/87/267112587.db2.gz	DELYUARUYVEFEK-UHFFFAOYSA-N	0	3	344.455	3.238	20	30		EGEDHN
C[C@H](c1ccc(-n2cncn2)cc1)N(C)CCOc1ccccc1C#N	ZINC000299059491	267207374	/nfs/dbraw/zinc/20/73/74/267207374.db2.gz	NJMREFNHMUJAEU-MRXNPFEDSA-N	0	3	347.422	3.211	20	30		EGEDHN
C[C@H]1CCC[C@@H]1CC(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000185908207	267213971	/nfs/dbraw/zinc/21/39/71/267213971.db2.gz	ITKGGIBGHPMLQY-QFBILLFUSA-N	0	3	327.472	3.275	20	30		EGEDHN
C[C@@H](NC(=O)c1c(F)cc(C#N)cc1F)[C@@H](c1ccccc1)N(C)C	ZINC000274617070	267262510	/nfs/dbraw/zinc/26/25/10/267262510.db2.gz	LHCBQOGAHXPXSK-XIKOKIGWSA-N	0	3	343.377	3.258	20	30		EGEDHN
CN(CCC(=O)Nc1cc(F)cc(F)c1)Cc1ccc(C#N)cc1	ZINC000433270347	267304340	/nfs/dbraw/zinc/30/43/40/267304340.db2.gz	DDSLHFGXYJBUEW-UHFFFAOYSA-N	0	3	329.350	3.297	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)Cc1cccc(CN2CCOCC2)c1	ZINC000420904103	267314616	/nfs/dbraw/zinc/31/46/16/267314616.db2.gz	PDIQSMSNWKYRNZ-UHFFFAOYSA-N	0	3	335.451	3.022	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)Cc1cccc(CN2CCOCC2)c1	ZINC000420906404	267319246	/nfs/dbraw/zinc/31/92/46/267319246.db2.gz	SOOVVRVRAYKOFA-UHFFFAOYSA-N	0	3	335.451	3.022	20	30		EGEDHN
COC(=O)N1CCC(CN[C@H](C)c2ccc(C#N)cc2Cl)CC1	ZINC000497055491	267374539	/nfs/dbraw/zinc/37/45/39/267374539.db2.gz	OWGGFBUCFDIWEV-GFCCVEGCSA-N	0	3	335.835	3.341	20	30		EGEDHN
N#Cc1ccc(CC(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1	ZINC000194840017	268057145	/nfs/dbraw/zinc/05/71/45/268057145.db2.gz	FDMIZYXGSXZUIL-FQEVSTJZSA-N	0	3	333.435	3.054	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@@H]2CCCOc3ccccc32)cc1	ZINC000279306114	268086672	/nfs/dbraw/zinc/08/66/72/268086672.db2.gz	MPURXELTTDOTAD-PKOBYXMFSA-N	0	3	345.402	3.271	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@H]2C[C@H](c3ccccc3)C2)cc1	ZINC000280718250	268086683	/nfs/dbraw/zinc/08/66/83/268086683.db2.gz	PRXDDRKAWNQGDS-UFYCRDLUSA-N	0	3	329.403	3.303	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@@H]2C[C@H]2c2cccc(F)c2)cc1	ZINC000279453548	268092531	/nfs/dbraw/zinc/09/25/31/268092531.db2.gz	ZQKHFSQDNHZEDB-NZSAHSFTSA-N	0	3	333.366	3.052	20	30		EGEDHN
N#Cc1ccc([N+](=O)[O-])c(N2CCCN(Cc3ccccc3)CC2)c1	ZINC000302222014	268215709	/nfs/dbraw/zinc/21/57/09/268215709.db2.gz	SMZHHKVCPZHIEB-UHFFFAOYSA-N	0	3	336.395	3.179	20	30		EGEDHN
N#Cc1cccc(C2(NC3CCN(Cc4ccccn4)CC3)CC2)c1	ZINC000272331622	268241387	/nfs/dbraw/zinc/24/13/87/268241387.db2.gz	XWWTXOZTYDCZJB-UHFFFAOYSA-N	0	3	332.451	3.197	20	30		EGEDHN
N#Cc1cccc(OCCN(CCc2ccccc2)[C@@H]2CCOC2)c1	ZINC000437541302	268284602	/nfs/dbraw/zinc/28/46/02/268284602.db2.gz	SMACEAJNNSKSBY-HXUWFJFHSA-N	0	3	336.435	3.271	20	30		EGEDHN
N#Cc1ccsc1N1CC[C@H](N[C@@H](c2ccccc2)C2CC2)C1=O	ZINC000298974662	268305882	/nfs/dbraw/zinc/30/58/82/268305882.db2.gz	PGAZLLNQEGXVNI-IRXDYDNUSA-N	0	3	337.448	3.466	20	30		EGEDHN
CCN1CCCC[C@@H]1CNC(=O)N(Cc1ccc(C#N)cc1)C(C)C	ZINC000111883441	275185798	/nfs/dbraw/zinc/18/57/98/275185798.db2.gz	CIPQAGCTXYLZGT-LJQANCHMSA-N	0	3	342.487	3.353	20	30		EGEDHN
CCN(CCN[C@H]1CCc2ccc(C#N)cc21)CCC(F)(F)F	ZINC000353598360	276132311	/nfs/dbraw/zinc/13/23/11/276132311.db2.gz	SZSXEDGCSDKWHE-INIZCTEOSA-N	0	3	325.378	3.409	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(CC[C@H](O)c3ccccc3)CC2)cc1	ZINC000289315630	276320878	/nfs/dbraw/zinc/32/08/78/276320878.db2.gz	UFAWOXWTTKOFIM-QFIPXVFZSA-N	0	3	349.478	3.190	20	30		EGEDHN
COc1ccc(CN[C@@H](CN2CCCC2)c2ccccc2)cc1C#N	ZINC000174254096	533689917	/nfs/dbraw/zinc/68/99/17/533689917.db2.gz	FTNNCVGPHJGRTL-FQEVSTJZSA-N	0	3	335.451	3.494	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCSC[C@@H]2c2ccccc2)CC1	ZINC000172151044	276894535	/nfs/dbraw/zinc/89/45/35/276894535.db2.gz	OYHJOTVVAQZVGX-GOSISDBHSA-N	0	3	345.512	3.137	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(CCC(F)(F)F)CC2CC2)CC1	ZINC000084157966	453974083	/nfs/dbraw/zinc/97/40/83/453974083.db2.gz	XKNWDXNXDJNKDQ-UHFFFAOYSA-N	0	3	347.425	3.401	20	30		EGEDHN
CC(C)n1cc([C@@H](C)NCCC(=O)Nc2ccc(C#N)cc2)cn1	ZINC000542575247	314560494	/nfs/dbraw/zinc/56/04/94/314560494.db2.gz	ZPCCWCNHVZOKOI-CQSZACIVSA-N	0	3	325.416	3.015	20	30		EGEDHN
COc1cc(C#N)ccc1NC(=O)N1CCN(C2CCCCC2)CC1	ZINC000546001910	314802220	/nfs/dbraw/zinc/80/22/20/314802220.db2.gz	NASSSYFNCIDXIB-UHFFFAOYSA-N	0	3	342.443	3.049	20	30		EGEDHN
Cc1cc(C#N)cnc1C(=O)N(CCN1CCCC1)c1ccccc1	ZINC000551365456	315152047	/nfs/dbraw/zinc/15/20/47/315152047.db2.gz	MANNHCWYQZWSJR-UHFFFAOYSA-N	0	3	334.423	3.004	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CNCc2cc3ccccc3s2)cc1	ZINC000560860502	315728485	/nfs/dbraw/zinc/72/84/85/315728485.db2.gz	SPSPYXWIWZGEBL-MRXNPFEDSA-N	0	3	338.432	3.302	20	30		EGEDHN
C[C@]1(NC(=O)NCc2cccc(C#N)c2)CCN(Cc2ccccc2)C1	ZINC000563814333	316073896	/nfs/dbraw/zinc/07/38/96/316073896.db2.gz	RGBCNWKZEWPUMT-NRFANRHFSA-N	0	3	348.450	3.022	20	30		EGEDHN
C=CCN1CCC(Nc2ccc([N+](=O)[O-])cc2Br)CC1	ZINC000301407046	456108462	/nfs/dbraw/zinc/10/84/62/456108462.db2.gz	VIVQBVNUNDHUPA-UHFFFAOYSA-N	0	3	340.221	3.420	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)c1ncc(C#N)cc1C)c1ccccc1	ZINC000575334482	324451248	/nfs/dbraw/zinc/45/12/48/324451248.db2.gz	QUQKQEOGJLBGHY-GOSISDBHSA-N	0	3	336.439	3.075	20	30		EGEDHN
CC(C)[C@@H](NC[C@H]1CNc2c(C#N)cnn2C1)c1ccc(F)cc1F	ZINC000575399359	324457213	/nfs/dbraw/zinc/45/72/13/324457213.db2.gz	QHSDJFDITIDUHY-YVEFUNNKSA-N	0	3	345.397	3.062	20	30		EGEDHN
C[C@H](N[C@@H]1CCC[C@@H](S(C)(=O)=O)C1)c1ccc(C#N)cc1Cl	ZINC000578588193	324988955	/nfs/dbraw/zinc/98/89/55/324988955.db2.gz	WQKFOCPZYMJHEV-IACUBPJLSA-N	0	3	340.876	3.218	20	30		EGEDHN
C[C@@H](N[C@H]1CCN(CC(F)(F)F)C1)c1ccc(C#N)cc1Cl	ZINC000581921531	325398506	/nfs/dbraw/zinc/39/85/06/325398506.db2.gz	DXPNDMSJSIRCJQ-PWSUYJOCSA-N	0	3	331.769	3.499	20	30		EGEDHN
C=CCN1CCC(NC(=O)COc2c(Cl)cccc2Cl)CC1	ZINC000264524341	455230176	/nfs/dbraw/zinc/23/01/76/455230176.db2.gz	YDLDRSLUQCZGMV-UHFFFAOYSA-N	0	3	343.254	3.139	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1S[C@H](C)CCOC	ZINC000447366984	458287736	/nfs/dbraw/zinc/28/77/36/458287736.db2.gz	UBKBMFZKPLDIGD-OAHLLOKOSA-N	0	3	338.521	3.010	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1N[C@@H](C)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000451607755	458483417	/nfs/dbraw/zinc/48/34/17/458483417.db2.gz	QKLWREWRGFMXLP-FZZIBODNSA-N	0	3	329.227	3.254	20	30		EGEDHN
C=CCNC(=O)CNC1(c2ccc(Br)cc2)CCCC1	ZINC000505456146	458743120	/nfs/dbraw/zinc/74/31/20/458743120.db2.gz	WJEQUQKKDMPKEY-UHFFFAOYSA-N	0	3	337.261	3.110	20	30		EGEDHN
N#CCSCCCN1CCCC[C@H]1COC(=O)NC1CCCC1	ZINC000496263565	459128748	/nfs/dbraw/zinc/12/87/48/459128748.db2.gz	KRSLXULKFFYCPK-INIZCTEOSA-N	0	3	339.505	3.157	20	30		EGEDHN
CN(C)C1(CN(C)C(=O)N[C@H](CCC#N)c2ccccc2)CCC1	ZINC000190013530	455272484	/nfs/dbraw/zinc/27/24/84/455272484.db2.gz	IMWGFQQLMOGXLK-QGZVFWFLSA-N	0	3	328.460	3.157	20	30		EGEDHN
Cc1ncc(CO)c(/C=N/CC2([NH+]3CCCCC3)CCCCC2)c1[O-]	ZINC000005110842	452837949	/nfs/dbraw/zinc/83/79/49/452837949.db2.gz	ZMBJJBGIHFILQG-FYJGNVAPSA-N	0	3	345.487	3.196	20	30		EGEDHN
Cc1c(CNC[C@@H](O)COc2ccccc2C#N)oc2ccccc12	ZINC000600729711	460581800	/nfs/dbraw/zinc/58/18/00/460581800.db2.gz	ZYQYUFVUYSPWAI-MRXNPFEDSA-N	0	3	336.391	3.142	20	30		EGEDHN
C=CCNC(=O)[C@H](C)N[C@@H](C)[C@@H](C)c1ccccc1C(F)(F)F	ZINC000159110749	455352912	/nfs/dbraw/zinc/35/29/12/455352912.db2.gz	WGDODHQVFIVZQT-AGIUHOORSA-N	0	3	328.378	3.478	20	30		EGEDHN
Cc1ccsc1[C@@H](C)N[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000190633513	455357439	/nfs/dbraw/zinc/35/74/39/455357439.db2.gz	PJPBJESYPHCXLX-RHSMWYFYSA-N	0	3	339.464	3.380	20	30		EGEDHN
C[C@H](CC1(C#N)CCOCC1)NC[C@H](c1ccco1)N1CCCC1	ZINC000600848178	460621001	/nfs/dbraw/zinc/62/10/01/460621001.db2.gz	DLQSQVYOBAPOLL-IAGOWNOFSA-N	0	3	331.460	3.105	20	30		EGEDHN
CN(CCC(=O)NCc1ccccc1Cl)Cc1cccc(C#N)c1	ZINC000026329426	453796995	/nfs/dbraw/zinc/79/69/95/453796995.db2.gz	YGNSGPAIYBIFPR-UHFFFAOYSA-N	0	3	341.842	3.350	20	30		EGEDHN
CC[C@H](CNC(=O)c1ccc(C#N)cc1)N1CCc2ccccc2C1	ZINC000032445886	453873168	/nfs/dbraw/zinc/87/31/68/453873168.db2.gz	DMGDSGRHSWIIFP-HXUWFJFHSA-N	0	3	333.435	3.125	20	30		EGEDHN
CCCOc1cccc(C(=O)C(C#N)c2nnc3n2CCCCC3)c1	ZINC000054727054	453945123	/nfs/dbraw/zinc/94/51/23/453945123.db2.gz	LOHTZOJRMTZYFS-MRXNPFEDSA-N	0	3	338.411	3.283	20	30		EGEDHN
CC(C)CCO[C@@H]1CCN(CCC(=O)Nc2cccc(C#N)c2)C1	ZINC000083246783	453946151	/nfs/dbraw/zinc/94/61/51/453946151.db2.gz	SALGLKXKUJHTCV-GOSISDBHSA-N	0	3	329.444	3.024	20	30		EGEDHN
C[C@@H](NC(C)(C)CNC(=O)c1cc(C#N)cs1)c1ccccc1	ZINC000084293113	453982114	/nfs/dbraw/zinc/98/21/14/453982114.db2.gz	BDAOYNRVLQRRIJ-CYBMUJFWSA-N	0	3	327.453	3.479	20	30		EGEDHN
Cc1ccccc1CN1CCC(NC(=O)c2ccc(C#N)cc2)CC1	ZINC000042127143	453995865	/nfs/dbraw/zinc/99/58/65/453995865.db2.gz	MNEKSYYMZOXSBT-UHFFFAOYSA-N	0	3	333.435	3.261	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Nc1nnc(C2CC2)s1)C(C)C	ZINC000043359519	454058936	/nfs/dbraw/zinc/05/89/36/454058936.db2.gz	XBRFJUQDLIAHTL-AWEZNQCLSA-N	0	3	349.504	3.236	20	30		EGEDHN
N#Cc1cccc(NC(=O)C2CCN(CCC(F)(F)F)CC2)c1	ZINC000265873422	455397704	/nfs/dbraw/zinc/39/77/04/455397704.db2.gz	WIXQGDJOEDRQBM-UHFFFAOYSA-N	0	3	325.334	3.161	20	30		EGEDHN
N#Cc1cccc(CNC(=O)C2CCN(Cc3ccccc3)CC2)c1	ZINC000057155612	454107200	/nfs/dbraw/zinc/10/72/00/454107200.db2.gz	BUMZLOVYAGUPQP-UHFFFAOYSA-N	0	3	333.435	3.087	20	30		EGEDHN
CN(CC#Cc1ccc(OC(F)(F)F)cc1)C[C@H]1CCCOC1	ZINC000160098668	455428921	/nfs/dbraw/zinc/42/89/21/455428921.db2.gz	FBHKKKUVNRVZEZ-OAHLLOKOSA-N	0	3	327.346	3.295	20	30		EGEDHN
N#CCCN(CCC#N)C(=O)CN1CCC[C@H]1CC1CCCCC1	ZINC000057871324	454153041	/nfs/dbraw/zinc/15/30/41/454153041.db2.gz	HRAXULUYVLFEPA-SFHVURJKSA-N	0	3	330.476	3.077	20	30		EGEDHN
C=C(C)CNCc1ccc(OCC(=O)N2CCCCC2)c(OCC)c1	ZINC000119649505	454210553	/nfs/dbraw/zinc/21/05/53/454210553.db2.gz	DMLLNXMLDFLSNE-UHFFFAOYSA-N	0	3	346.471	3.142	20	30		EGEDHN
CN(C(=O)[C@@H]1CCCN(Cc2ccccc2)C1)c1cccc(C#N)c1	ZINC000058860353	454237542	/nfs/dbraw/zinc/23/75/42/454237542.db2.gz	CCUYPHMGVWSPBT-LJQANCHMSA-N	0	3	333.435	3.433	20	30		EGEDHN
CC[C@@H](NC[C@H](O)c1ccc(C#N)cc1)c1ccc2c(c1)OCCO2	ZINC000095984561	454250106	/nfs/dbraw/zinc/25/01/06/454250106.db2.gz	LNMLDUQBCZYEMI-MSOLQXFVSA-N	0	3	338.407	3.104	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H]1CCN(c2ncc(C#N)cc2Cl)C1	ZINC000078506172	454266767	/nfs/dbraw/zinc/26/67/67/454266767.db2.gz	DPEGOTTVFSBSTQ-MRXNPFEDSA-N	0	3	326.831	3.317	20	30		EGEDHN
C#CCCCCN[C@@H](C)c1ccc(S(=O)(=O)C(F)F)c(OC)c1	ZINC000090398440	454299973	/nfs/dbraw/zinc/29/99/73/454299973.db2.gz	XFXIOXNTCAFEOA-LBPRGKRZSA-N	0	3	345.411	3.146	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)c1cccc(Cl)c1	ZINC000047010820	454318455	/nfs/dbraw/zinc/31/84/55/454318455.db2.gz	UVSYHIGXPVUBGD-UHFFFAOYSA-N	0	3	341.842	3.416	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCN2CCS[C@H]3CCCC[C@H]32)cc1	ZINC000246153863	455438005	/nfs/dbraw/zinc/43/80/05/455438005.db2.gz	PPEQEFOXKJVUPC-SJORKVTESA-N	0	3	329.469	3.247	20	30		EGEDHN
C=CCN(CCCN1C(=O)c2ccccc2C1=O)Cc1cccs1	ZINC000060942804	454321562	/nfs/dbraw/zinc/32/15/62/454321562.db2.gz	SNQZZTWHQDVYEW-UHFFFAOYSA-N	0	3	340.448	3.422	20	30		EGEDHN
CN1CCC(N(Cc2ccco2)C(=O)c2cccc(CC#N)c2)CC1	ZINC000078816418	454323700	/nfs/dbraw/zinc/32/37/00/454323700.db2.gz	KFAAEOPYURJHJC-UHFFFAOYSA-N	0	3	337.423	3.082	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cc(-c3nc(C)co3)ccc2C)CC1	ZINC000120786603	454347829	/nfs/dbraw/zinc/34/78/29/454347829.db2.gz	QKZFRJWHUDOBCD-UHFFFAOYSA-N	0	3	337.423	3.242	20	30		EGEDHN
C[C@H](C#N)CN(C)C(=O)NC[C@@H](c1cccs1)N1CCC(C)CC1	ZINC000079220265	454383376	/nfs/dbraw/zinc/38/33/76/454383376.db2.gz	KNABULMRUBDGBQ-CVEARBPZSA-N	0	3	348.516	3.322	20	30		EGEDHN
COc1ccc(CN2CCC(CNc3ncccc3C#N)CC2)cc1	ZINC000063282523	454400804	/nfs/dbraw/zinc/40/08/04/454400804.db2.gz	OESPJOJBFQGDQY-UHFFFAOYSA-N	0	3	336.439	3.286	20	30		EGEDHN
C=CCc1cc(CNCCNc2cccc(C)n2)cc(OC)c1O	ZINC000133449601	454426609	/nfs/dbraw/zinc/42/66/09/454426609.db2.gz	KXHHLERTZBREMU-UHFFFAOYSA-N	0	3	327.428	3.034	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C(=O)c1cccc(CN2CCCC2)c1	ZINC000063915336	454458546	/nfs/dbraw/zinc/45/85/46/454458546.db2.gz	OWAHBMKGMZXIIE-UHFFFAOYSA-N	0	3	333.435	3.426	20	30		EGEDHN
C=CCN(CC=C)C(=O)NCC1CCN(Cc2cccs2)CC1	ZINC000064251493	454470878	/nfs/dbraw/zinc/47/08/78/454470878.db2.gz	RRYBEXBPPWLTFF-UHFFFAOYSA-N	0	3	333.501	3.344	20	30		EGEDHN
C=CCOc1ccccc1CN1CCC(Cc2nccn2C)CC1	ZINC000121777502	454475370	/nfs/dbraw/zinc/47/53/70/454475370.db2.gz	BYTFTQDOCIXICQ-UHFFFAOYSA-N	0	3	325.456	3.440	20	30		EGEDHN
Cc1ccc([C@H](CNCc2cccc(C#N)c2)N2CCOCC2)cc1	ZINC000048779394	454514788	/nfs/dbraw/zinc/51/47/88/454514788.db2.gz	YVUDRJBRMPCYTE-NRFANRHFSA-N	0	3	335.451	3.030	20	30		EGEDHN
C[C@@H](CNC(=O)N[C@@H](C)c1ccc(C#N)cc1)N1CCCC[C@@H]1C	ZINC000049193672	454538952	/nfs/dbraw/zinc/53/89/52/454538952.db2.gz	VYVRMHHCROVXQW-JYJNAYRXSA-N	0	3	328.460	3.181	20	30		EGEDHN
COc1ccc(CNCCc2nccs2)cc1OCCCC#N	ZINC000065276391	454547161	/nfs/dbraw/zinc/54/71/61/454547161.db2.gz	MEXNLSRODGNYCL-UHFFFAOYSA-N	0	3	331.441	3.167	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)Nc2ccc(CC#N)cc2)N(C)C)cc1	ZINC000065359342	454553612	/nfs/dbraw/zinc/55/36/12/454553612.db2.gz	WCRTWZMZAQRPLI-IBGZPJMESA-N	0	3	336.439	3.486	20	30		EGEDHN
CCN(Cc1cn(CCC#N)nc1-c1ccccc1)C[C@@H]1CCCO1	ZINC000092406928	454562156	/nfs/dbraw/zinc/56/21/56/454562156.db2.gz	RUGZWBMCIYLAIP-IBGZPJMESA-N	0	3	338.455	3.465	20	30		EGEDHN
CN(C)CCN(C)C(=O)c1ccccc1Sc1ccccc1C#N	ZINC000080394567	454575858	/nfs/dbraw/zinc/57/58/58/454575858.db2.gz	OKMBLBXIFKRAJR-UHFFFAOYSA-N	0	3	339.464	3.343	20	30		EGEDHN
COc1ccc(OCCN(C)Cc2ccc(OC)c(C#N)c2)cc1	ZINC000134970164	454618821	/nfs/dbraw/zinc/61/88/21/454618821.db2.gz	OOHWWQPBUMHUHW-UHFFFAOYSA-N	0	3	326.396	3.086	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)C=C1CCCCC1	ZINC000065930186	454640592	/nfs/dbraw/zinc/64/05/92/454640592.db2.gz	WSFOKGYKAMXDJI-UHFFFAOYSA-N	0	3	325.456	3.339	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)CCc1ccccc1	ZINC000065931350	454641149	/nfs/dbraw/zinc/64/11/49/454641149.db2.gz	KLQGTQUMAHLQJC-UHFFFAOYSA-N	0	3	335.451	3.081	20	30		EGEDHN
COCc1ccc(CNC2CCC(Oc3ccc(C#N)cn3)CC2)o1	ZINC000092854368	454646126	/nfs/dbraw/zinc/64/61/26/454646126.db2.gz	VMBKUPCDQRCMKK-UHFFFAOYSA-N	0	3	341.411	3.172	20	30		EGEDHN
CC(C)(NC[C@@H](O)COc1ccc(CC#N)cc1)c1cccs1	ZINC000612517150	460646274	/nfs/dbraw/zinc/64/62/74/460646274.db2.gz	ZANYJWAZVGALSI-OAHLLOKOSA-N	0	3	330.453	3.079	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc3ccccc3n2CC)CC1	ZINC000106034865	454674359	/nfs/dbraw/zinc/67/43/59/454674359.db2.gz	WEOHXQGUHMCQDF-UHFFFAOYSA-N	0	3	325.456	3.432	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCOc2ccc(C)cc2C)CC1	ZINC000106036804	454674447	/nfs/dbraw/zinc/67/44/47/454674447.db2.gz	PRKNCTKEACDHJJ-UHFFFAOYSA-N	0	3	330.472	3.229	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(-c3ccc(F)cc3)on2)CC1	ZINC000136833388	454757898	/nfs/dbraw/zinc/75/78/98/454757898.db2.gz	KJKJOAFXNCNBAC-UHFFFAOYSA-N	0	3	343.402	3.251	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCC[C@@H](OCCC)CC2)CC1	ZINC000108575869	454804575	/nfs/dbraw/zinc/80/45/75/454804575.db2.gz	IKVNOGVOPYAMLM-GOSISDBHSA-N	0	3	337.508	3.018	20	30		EGEDHN
C=C(Cl)COc1ccc([C@@H](C)N[C@@H]2CCc3nc(C)nn3C2)cc1	ZINC000160565846	455474595	/nfs/dbraw/zinc/47/45/95/455474595.db2.gz	CSXBJEWEKXVAKP-CZUORRHYSA-N	0	3	346.862	3.383	20	30		EGEDHN
N#C[C@@H](NC(=O)c1cccc(CN2CCCC2)c1)c1ccccc1F	ZINC000108799910	454812598	/nfs/dbraw/zinc/81/25/98/454812598.db2.gz	BPHFIUIEMMZACO-LJQANCHMSA-N	0	3	337.398	3.416	20	30		EGEDHN
C=CC1CCN(C(=O)NC[C@@H](c2cccs2)N2CCCC2)CC1	ZINC000111801053	454876072	/nfs/dbraw/zinc/87/60/72/454876072.db2.gz	DCMVLACTSLVWLK-INIZCTEOSA-N	0	3	333.501	3.493	20	30		EGEDHN
CC(C)CN1CCCC[C@H]1CNC(=O)c1c(F)cc(C#N)cc1F	ZINC000154246890	454877752	/nfs/dbraw/zinc/87/77/52/454877752.db2.gz	HYJQHOREAOWYAS-AWEZNQCLSA-N	0	3	335.398	3.077	20	30		EGEDHN
C[C@H](N[C@@H](C)c1cccc(NS(C)(=O)=O)c1)c1ccc(C#N)cc1	ZINC000154345483	454887635	/nfs/dbraw/zinc/88/76/35/454887635.db2.gz	ROLPKGNHXPYYPM-KBPBESRZSA-N	0	3	343.452	3.342	20	30		EGEDHN
Cc1cc(N2CCN(C)CC2)ccc1NCc1cc(C#N)cs1	ZINC000177687955	454892479	/nfs/dbraw/zinc/89/24/79/454892479.db2.gz	FVWXKABHLMXXKE-UHFFFAOYSA-N	0	3	326.469	3.292	20	30		EGEDHN
C=CCC[C@@H](O)CN(C)[C@@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O	ZINC000178060737	454930990	/nfs/dbraw/zinc/93/09/90/454930990.db2.gz	DDVVHYPWYPWORV-XFBWCDHKSA-N	0	3	330.255	3.210	20	30		EGEDHN
C=CCSCCNC(=O)NCC(C)(C)N[C@H](C)c1ccccc1	ZINC000113606473	454931695	/nfs/dbraw/zinc/93/16/95/454931695.db2.gz	XIQCJXWPSOIVGN-OAHLLOKOSA-N	0	3	335.517	3.334	20	30		EGEDHN
CC1CCN([C@H](CNC(=O)c2ccc(C#N)[nH]2)c2cccs2)CC1	ZINC000151512134	454995304	/nfs/dbraw/zinc/99/53/04/454995304.db2.gz	RNSZAADWFBPQBF-MRXNPFEDSA-N	0	3	342.468	3.151	20	30		EGEDHN
C#CCN1CCC(C(=O)NCCCc2ccc(C(C)C)cc2)CC1	ZINC000116657239	455063800	/nfs/dbraw/zinc/06/38/00/455063800.db2.gz	TVSLYLNYNFGIFD-UHFFFAOYSA-N	0	3	326.484	3.204	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1c(F)cc(C#N)cc1F)C(C)C	ZINC000152067643	455068157	/nfs/dbraw/zinc/06/81/57/455068157.db2.gz	YQMFWDIHSFWVDT-QGZVFWFLSA-N	0	3	347.409	3.265	20	30		EGEDHN
FC(F)(F)Oc1ccc(C#CCN(C[C@@H]2CCOC2)C2CC2)cc1	ZINC000156113983	455082578	/nfs/dbraw/zinc/08/25/78/455082578.db2.gz	GXVBAFHQUYHVKI-HNNXBMFYSA-N	0	3	339.357	3.438	20	30		EGEDHN
C=CCN1CCC(NC(=O)/C=C/c2cccc(OC(C)C)c2)CC1	ZINC000171715392	455088846	/nfs/dbraw/zinc/08/88/46/455088846.db2.gz	IGAPJYLTRTUWPC-CMDGGOBGSA-N	0	3	328.456	3.254	20	30		EGEDHN
CN(CC#Cc1ccc(OC(F)(F)F)cc1)CC1(O)CCCC1	ZINC000152256000	455093001	/nfs/dbraw/zinc/09/30/01/455093001.db2.gz	PNEZVHDOESOBKJ-UHFFFAOYSA-N	0	3	327.346	3.174	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN2CCC[C@H](N3CCCC3)C2)c1C	ZINC000118829880	455113507	/nfs/dbraw/zinc/11/35/07/455113507.db2.gz	BTPDBEOJFZISKW-SFHVURJKSA-N	0	3	329.488	3.034	20	30		EGEDHN
N#Cc1cc(N2CCCN(Cc3ccccc3)CC2)ccc1[N+](=O)[O-]	ZINC000157603373	455212696	/nfs/dbraw/zinc/21/26/96/455212696.db2.gz	UPFFCUWCMNGATL-UHFFFAOYSA-N	0	3	336.395	3.179	20	30		EGEDHN
C=CC[C@H](C(=O)NC1CCN(CCOC(C)C)CC1)c1ccccc1	ZINC000190072295	455277756	/nfs/dbraw/zinc/27/77/56/455277756.db2.gz	MAEPGHDCWFLVHC-FQEVSTJZSA-N	0	3	344.499	3.352	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/[C@@H]2CCC[C@H](C(=O)N(C)C)C2)c([O-])c1	ZINC000265114299	455301014	/nfs/dbraw/zinc/30/10/14/455301014.db2.gz	FJSUMQXBEKHGPU-VRCPDPNESA-N	0	3	345.487	3.304	20	30		EGEDHN
C[C@@H](CSC(C)(C)C)N[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000190621976	455355963	/nfs/dbraw/zinc/35/59/63/455355963.db2.gz	ZJULDWUEYXZSQM-YOEHRIQHSA-N	0	3	345.512	3.169	20	30		EGEDHN
C=CCc1cc(CNC[C@](C)(O)c2cccs2)cc(OC)c1O	ZINC000265780727	455379945	/nfs/dbraw/zinc/37/99/45/455379945.db2.gz	OENXZGFFBBCLCY-SFHVURJKSA-N	0	3	333.453	3.188	20	30		EGEDHN
CN(c1ccc(NCc2cc(C#N)n(C)c2)cc1)C1CCN(C)CC1	ZINC000190836359	455388867	/nfs/dbraw/zinc/38/88/67/455388867.db2.gz	UHHOGTGOBHSSHB-UHFFFAOYSA-N	0	3	337.471	3.039	20	30		EGEDHN
C[C@H](N[C@@H]1C[C@H](C)N(c2ccccc2)C1=O)c1ccc(OCC#N)cc1	ZINC000181995672	455412337	/nfs/dbraw/zinc/41/23/37/455412337.db2.gz	ZPAQWQFQIDHZHR-TWOQFEAHSA-N	0	3	349.434	3.434	20	30		EGEDHN
CC[C@@H](NCC(=O)N(CCC#N)c1cccc(Cl)c1)[C@@H]1CCCO1	ZINC000182325784	455488546	/nfs/dbraw/zinc/48/85/46/455488546.db2.gz	MSDOYAONBWRXBV-SJORKVTESA-N	0	3	349.862	3.134	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@H](NCc1cc(C#N)ccc1F)C1CC1	ZINC000185201569	455520857	/nfs/dbraw/zinc/52/08/57/455520857.db2.gz	HOEBLEVSNGOBRG-INIZCTEOSA-N	0	3	333.407	3.090	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N1CC[C@@H]2OCCC[C@@H]2C1	ZINC000246788138	455524329	/nfs/dbraw/zinc/52/43/29/455524329.db2.gz	RDOXCRVYFDIKNG-JZXOWHBKSA-N	0	3	348.512	3.152	20	30		EGEDHN
C[C@H](CN1CCC[C@@H](C)C1)NC(=O)c1cccc(SCC#N)c1	ZINC000176030296	455530646	/nfs/dbraw/zinc/53/06/46/455530646.db2.gz	CUPQDCFXKJSIOO-HUUCEWRRSA-N	0	3	331.485	3.152	20	30		EGEDHN
CCN(CC)C(=O)CCC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000182568770	455542715	/nfs/dbraw/zinc/54/27/15/455542715.db2.gz	MDEFNTYZNFRRCB-UHFFFAOYSA-N	0	3	327.472	3.419	20	30		EGEDHN
N#Cc1ccccc1OCCN[C@H]1CCO[C@@H]1c1ccc(F)c(F)c1	ZINC000192137648	455562853	/nfs/dbraw/zinc/56/28/53/455562853.db2.gz	IYJSHLOUKNBILI-PKOBYXMFSA-N	0	3	344.361	3.335	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN[C@@H](c1ccc2c(c1)OCCO2)C(C)C	ZINC000161473719	455573536	/nfs/dbraw/zinc/57/35/36/455573536.db2.gz	GNMHXHFKQRZCSC-HXUWFJFHSA-N	0	3	346.471	3.169	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)C1=CCCCCC1	ZINC000185732525	455608987	/nfs/dbraw/zinc/60/89/87/455608987.db2.gz	XWVDDDHPKQRARD-UHFFFAOYSA-N	0	3	325.456	3.339	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCc3cccc(C)c3C2)CC1	ZINC000277651683	455624987	/nfs/dbraw/zinc/62/49/87/455624987.db2.gz	MYSFDLXJDHMOSL-UHFFFAOYSA-N	0	3	327.472	3.103	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@@H](C)N1CC[C@@H](COCc2ccccc2)C1	ZINC000247646404	455633315	/nfs/dbraw/zinc/63/33/15/455633315.db2.gz	ULOLBDBKPLLMIE-UYAOXDASSA-N	0	3	344.499	3.338	20	30		EGEDHN
CN1CCC(Oc2ccc(CNCc3ccc(C#N)s3)cc2)CC1	ZINC000284178489	455646651	/nfs/dbraw/zinc/64/66/51/455646651.db2.gz	XLKNZNNSPDAJEB-UHFFFAOYSA-N	0	3	341.480	3.383	20	30		EGEDHN
COc1ccc(CN[C@@H]2CCCc3cn[nH]c32)cc1OCCCC#N	ZINC000268802229	455714398	/nfs/dbraw/zinc/71/43/98/455714398.db2.gz	BKENLSSDFYAPIW-MRXNPFEDSA-N	0	3	340.427	3.268	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(OC(C)C)c(OC)c2)CC1	ZINC000186262493	455728307	/nfs/dbraw/zinc/72/83/07/455728307.db2.gz	FERMHHZBRXESLY-UHFFFAOYSA-N	0	3	347.459	3.254	20	30		EGEDHN
N#C[C@@H]1CCC[C@@H](N[C@@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)C1	ZINC000249051569	455742891	/nfs/dbraw/zinc/74/28/91/455742891.db2.gz	XNTFRIFVHFPBKE-XHBSWPGZSA-N	0	3	335.810	3.256	20	30		EGEDHN
N#C[C@@H]1CCC[C@H](Nc2ccccc2CN2CCC(CO)CC2)C1	ZINC000193112444	455743474	/nfs/dbraw/zinc/74/34/74/455743474.db2.gz	ZRFISWNQJWWMNH-MJGOQNOKSA-N	0	3	327.472	3.385	20	30		EGEDHN
N#C[C@@H]1CCC[C@@H](Nc2ccccc2CN2CCC(CO)CC2)C1	ZINC000193112427	455743610	/nfs/dbraw/zinc/74/36/10/455743610.db2.gz	ZRFISWNQJWWMNH-IEBWSBKVSA-N	0	3	327.472	3.385	20	30		EGEDHN
CC(C)C[C@@H]1OCCC[C@@H]1NCC(=O)Nc1cc(Cl)ccc1C#N	ZINC000186323358	455743903	/nfs/dbraw/zinc/74/39/03/455743903.db2.gz	UPPQVLFVBMJQGK-RDJZCZTQSA-N	0	3	349.862	3.333	20	30		EGEDHN
Cc1ccc(CN[C@H]2CCC[C@@H](C#N)C2)c(-n2cc(Cl)cn2)n1	ZINC000193338103	455753147	/nfs/dbraw/zinc/75/31/47/455753147.db2.gz	WEOCLROVMOBQGW-CJNGLKHVSA-N	0	3	329.835	3.401	20	30		EGEDHN
CCO[C@@H]1C[C@H](NCc2cc(C#N)cs2)[C@H]1Oc1ccccc1	ZINC000249422581	455754686	/nfs/dbraw/zinc/75/46/86/455754686.db2.gz	HTKBSLHUTGZMHC-RCCFBDPRSA-N	0	3	328.437	3.334	20	30		EGEDHN
C[C@@H](NCCC(=O)N(C)CCC#N)c1ccc(OCC2CC2)c(F)c1	ZINC000271778802	455756213	/nfs/dbraw/zinc/75/62/13/455756213.db2.gz	KNDBUFUFELNTRC-CQSZACIVSA-N	0	3	347.434	3.027	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cnc3c(F)cccc3c2)CC1	ZINC000292880424	455764708	/nfs/dbraw/zinc/76/47/08/455764708.db2.gz	SRQRIIAWOLMGSP-UHFFFAOYSA-N	0	3	327.403	3.144	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H]2CCCc3sc(Cl)cc32)CC1	ZINC000293786146	455797394	/nfs/dbraw/zinc/79/73/94/455797394.db2.gz	WNDFLVXOJUUEEH-CQSZACIVSA-N	0	3	336.888	3.240	20	30		EGEDHN
CC(C)Cn1cc(NC2CCN(Cc3ccc(C#N)cc3)CC2)cn1	ZINC000271957231	455805291	/nfs/dbraw/zinc/80/52/91/455805291.db2.gz	CZDPKJZAVRCINO-UHFFFAOYSA-N	0	3	337.471	3.487	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2ccc3ncccc3c2)CC1	ZINC000194148194	455808032	/nfs/dbraw/zinc/80/80/32/455808032.db2.gz	CSYHJMUNJHXVOC-UHFFFAOYSA-N	0	3	338.455	3.075	20	30		EGEDHN
COc1ccc2c(c1)OC[C@H](N[C@H](C)c1ccc(C#N)c(F)c1)C2	ZINC000271977222	455810985	/nfs/dbraw/zinc/81/09/85/455810985.db2.gz	VVXAIJMFWCOPBW-MLGOLLRUSA-N	0	3	326.371	3.360	20	30		EGEDHN
CN(C)CCOc1ccc(NC(=O)[C@@]2(C#N)CC23CCCC3)cc1	ZINC000294525258	455818711	/nfs/dbraw/zinc/81/87/11/455818711.db2.gz	QQALFXWZYPWABN-IBGZPJMESA-N	0	3	327.428	3.040	20	30		EGEDHN
CC1(C)CC[C@@H](CN2CCC(Oc3ccc(C#N)cc3F)CC2)O1	ZINC000285420577	455841480	/nfs/dbraw/zinc/84/14/80/455841480.db2.gz	GMPLNALKYAQQAU-INIZCTEOSA-N	0	3	332.419	3.498	20	30		EGEDHN
CN(CCCSCC#N)C[C@@H](O)c1ccccc1Br	ZINC000295248521	455843251	/nfs/dbraw/zinc/84/32/51/455843251.db2.gz	FMWXJXSNUSQMKJ-CQSZACIVSA-N	0	3	343.290	3.061	20	30		EGEDHN
CC[C@@H](NC[C@H](O)c1cc(OC)cc(OC)c1)c1ccc(C#N)cc1	ZINC000278668008	455844225	/nfs/dbraw/zinc/84/42/25/455844225.db2.gz	JBGBIELILPRZTP-UXHICEINSA-N	0	3	340.423	3.350	20	30		EGEDHN
CCN1CCN(c2ccc(F)cc2[C@H](C)N[C@H]2CC[C@@H](C#N)C2)CC1	ZINC000278707074	455845926	/nfs/dbraw/zinc/84/59/26/455845926.db2.gz	UFARPBCVFIQZJZ-JZXOWHBKSA-N	0	3	344.478	3.310	20	30		EGEDHN
COc1cccc(N2CC[C@H](NCc3ccc(C#N)cc3F)C2)c1	ZINC000269456835	455848344	/nfs/dbraw/zinc/84/83/44/455848344.db2.gz	XCPVXNTXWKGDFV-INIZCTEOSA-N	0	3	325.387	3.074	20	30		EGEDHN
C[C@@H](O)C[C@@H]1CCCN1CC#Cc1ccc(OC(F)(F)F)cc1	ZINC000269790513	455854095	/nfs/dbraw/zinc/85/40/95/455854095.db2.gz	JHOYSISGXQHOOJ-HIFRSBDPSA-N	0	3	327.346	3.172	20	30		EGEDHN
CC(C)OCCCN(C)Cc1cn(CCC#N)nc1-c1ccncc1	ZINC000278993989	455854723	/nfs/dbraw/zinc/85/47/23/455854723.db2.gz	BSNJUHNXMYNZRR-UHFFFAOYSA-N	0	3	341.459	3.106	20	30		EGEDHN
CCN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)CC(C)(C)C#N	ZINC000279091370	455857942	/nfs/dbraw/zinc/85/79/42/455857942.db2.gz	WJASLBVQNKLFQV-GOSISDBHSA-N	0	3	327.472	3.297	20	30		EGEDHN
CN(C)CCN(Cc1cccc(F)c1)C(=O)c1ccc(F)c(C#N)c1	ZINC000279225165	455860572	/nfs/dbraw/zinc/86/05/72/455860572.db2.gz	OFAKGIXCYLOYMJ-UHFFFAOYSA-N	0	3	343.377	3.040	20	30		EGEDHN
CN(C)CCN(Cc1ccco1)C(=O)c1cc(C#N)ccc1Cl	ZINC000285519480	455862211	/nfs/dbraw/zinc/86/22/11/455862211.db2.gz	BTWTTXHJZSZESU-UHFFFAOYSA-N	0	3	331.803	3.009	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@@H]1[C@H]2CCO[C@H]2C1(C)C	ZINC000296059530	455868554	/nfs/dbraw/zinc/86/85/54/455868554.db2.gz	GDPVPELOYCFLAL-FSPWUOQZSA-N	0	3	346.496	3.306	20	30		EGEDHN
C[C@@H](NC(=O)c1ccccc1OCC#N)[C@@H](c1ccccc1)N(C)C	ZINC000187214307	455881915	/nfs/dbraw/zinc/88/19/15/455881915.db2.gz	FSSVGZZDJXBHMS-BEFAXECRSA-N	0	3	337.423	3.010	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N1CCN([C@@H](C)CC)CC1	ZINC000296254654	455893204	/nfs/dbraw/zinc/89/32/04/455893204.db2.gz	XNVASJIWNNAWGH-IRXDYDNUSA-N	0	3	349.544	3.067	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2C[C@H]2c2ccc(F)cc2)CC1	ZINC000194955725	455905918	/nfs/dbraw/zinc/90/59/18/455905918.db2.gz	OKPSRDOZDSJAHH-ZWKOTPCHSA-N	0	3	331.435	3.021	20	30		EGEDHN
CC[C@@](C)(C#N)C(=O)N(C)CCC1CCN(c2ccncc2)CC1	ZINC000285898776	455938046	/nfs/dbraw/zinc/93/80/46/455938046.db2.gz	UVFUUQGXKYVLID-IBGZPJMESA-N	0	3	328.460	3.086	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc3c(Cl)cccc3n2)CC1	ZINC000286066690	455971308	/nfs/dbraw/zinc/97/13/08/455971308.db2.gz	PMNZKTAFFIVRDU-UHFFFAOYSA-N	0	3	327.815	3.172	20	30		EGEDHN
CCO[C@@H]1C[C@H](NCC#Cc2ccc(Cl)cc2)C12CCOCC2	ZINC000286129495	455984710	/nfs/dbraw/zinc/98/47/10/455984710.db2.gz	MORLCRFRXSZKMU-ZWKOTPCHSA-N	0	3	333.859	3.255	20	30		EGEDHN
C=CCC[C@H](NCc1cccnc1N1CCN(C)CC1)c1ccco1	ZINC000286198087	455999002	/nfs/dbraw/zinc/99/90/02/455999002.db2.gz	RNJGSZUBNROKDZ-SFHVURJKSA-N	0	3	340.471	3.224	20	30		EGEDHN
C=C(C)COc1cc(CNCC2([S@@](C)=O)CCC2)ccc1OC	ZINC000280653685	456023733	/nfs/dbraw/zinc/02/37/33/456023733.db2.gz	OJNCQRVPFOMHHY-HSZRJFAPSA-N	0	3	337.485	3.041	20	30		EGEDHN
CN(C(=O)[C@H]1CCN(Cc2ccc(C#N)s2)C1)c1ccccc1	ZINC000280902037	456077262	/nfs/dbraw/zinc/07/72/62/456077262.db2.gz	FLSXDLGUMHDSJK-AWEZNQCLSA-N	0	3	325.437	3.105	20	30		EGEDHN
C=CCN(CC=C)C(=O)NCc1ccc(OC2CCN(C)CC2)cc1	ZINC000287864113	456080676	/nfs/dbraw/zinc/08/06/76/456080676.db2.gz	OTIGPQJKNANJRB-UHFFFAOYSA-N	0	3	343.471	3.043	20	30		EGEDHN
C=C(C)CN(CC)Cc1ccc(O[C@@H](C)C(=O)N(C)C)c(OCC)c1	ZINC000270976419	456083395	/nfs/dbraw/zinc/08/33/95/456083395.db2.gz	BIOPKEAJKFCQPE-INIZCTEOSA-N	0	3	348.487	3.339	20	30		EGEDHN
C[C@H]1C[C@@H](N2CCCC2)CN1C(=O)C(C)(C)c1cc(F)cc(C#N)c1	ZINC000288560612	456099119	/nfs/dbraw/zinc/09/91/19/456099119.db2.gz	WFDJFESZDCOZGH-KBXCAEBGSA-N	0	3	343.446	3.060	20	30		EGEDHN
C=CCSCCNCc1cn2ccc(Br)cc2n1	ZINC000289515691	456128867	/nfs/dbraw/zinc/12/88/67/456128867.db2.gz	NKNBGRPKLBUPQC-UHFFFAOYSA-N	0	3	326.263	3.106	20	30		EGEDHN
Cc1ccccc1C[C@@H](CO)NCc1cccc(OCCCC#N)c1	ZINC000188935271	456176812	/nfs/dbraw/zinc/17/68/12/456176812.db2.gz	NALITXCLLOHQKZ-FQEVSTJZSA-N	0	3	338.451	3.371	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@](C)(CNCc2ccc(C#N)o2)C1	ZINC000273108042	456180649	/nfs/dbraw/zinc/18/06/49/456180649.db2.gz	XADWSRFKNHTZKL-GOSISDBHSA-N	0	3	333.432	3.278	20	30		EGEDHN
N#C[C@H]1CC[C@@H](NC(=O)NCCN2CCC3(CCCCC3)CC2)C1	ZINC000333325060	456200623	/nfs/dbraw/zinc/20/06/23/456200623.db2.gz	BQZOPKDZQSGGFK-DLBZAZTESA-N	0	3	332.492	3.024	20	30		EGEDHN
CN(CCC(=O)Nc1ccc(C#N)cc1)C[C@@H]1OCCc2ccccc21	ZINC000263783914	456221686	/nfs/dbraw/zinc/22/16/86/456221686.db2.gz	ZFGYJQMFVSCFRH-FQEVSTJZSA-N	0	3	349.434	3.133	20	30		EGEDHN
C[C@H](C1CCN(C)CC1)N(C)C(=O)Nc1ccccc1O[C@@H](C)C#N	ZINC000273354598	456224875	/nfs/dbraw/zinc/22/48/75/456224875.db2.gz	BQSNPAOUKUQKMD-LSDHHAIUSA-N	0	3	344.459	3.171	20	30		EGEDHN
C=CCCO[C@H](C)c1nc(-c2cccc(OCCN(C)C)c2)no1	ZINC000273747261	456245245	/nfs/dbraw/zinc/24/52/45/456245245.db2.gz	BVXZERJSZUZCEV-CQSZACIVSA-N	0	3	331.416	3.331	20	30		EGEDHN
CC#CCCCC(=O)N[C@H](CN1CCCC1)c1ccc(OC)cc1	ZINC000274588190	456262018	/nfs/dbraw/zinc/26/20/18/456262018.db2.gz	ZWHVGZOMYCNNEA-LJQANCHMSA-N	0	3	328.456	3.142	20	30		EGEDHN
CCc1ccc([C@H](CNc2nc3ccccn3c2C#N)N(C)C)cc1	ZINC000302057035	456277003	/nfs/dbraw/zinc/27/70/03/456277003.db2.gz	AMOAGHSNVNYZLE-SFHVURJKSA-N	0	3	333.439	3.483	20	30		EGEDHN
COc1cc(CN[C@H](C)c2ccc([S@](C)=O)cc2)ccc1C#N	ZINC000281691308	456293750	/nfs/dbraw/zinc/29/37/50/456293750.db2.gz	NANVKDVYNQRCLG-ZLOXQWCVSA-N	0	3	328.437	3.155	20	30		EGEDHN
COc1ccc(CN(C)[C@H](CO)CC(C)C)cc1OCCCC#N	ZINC000290350658	456301946	/nfs/dbraw/zinc/30/19/46/456301946.db2.gz	GAZQQJSOHGJWOO-KRWDZBQOSA-N	0	3	334.460	3.217	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCC2CCC(F)(F)CC2)CC1	ZINC000337077312	456324199	/nfs/dbraw/zinc/32/41/99/456324199.db2.gz	ROQDRJSYGOUJTN-UHFFFAOYSA-N	0	3	329.435	3.152	20	30		EGEDHN
C=CCN1CC[C@@H](NC2(c3ccc(Br)cc3)CCC2)C1=O	ZINC000337157604	456331756	/nfs/dbraw/zinc/33/17/56/456331756.db2.gz	PYMJOVQDCKUNAW-OAHLLOKOSA-N	0	3	349.272	3.205	20	30		EGEDHN
Cc1sc(NC(=O)CN[C@H]2CCCC23CCOCC3)c(C#N)c1C	ZINC000281889767	456351336	/nfs/dbraw/zinc/35/13/36/456351336.db2.gz	AUDWBLILJDDHQQ-HNNXBMFYSA-N	0	3	347.484	3.114	20	30		EGEDHN
Cc1oc([N-]C(=O)[C@@H](C)[NH2+][C@H]2CCCC23CCOCC3)c(C#N)c1C	ZINC000282064944	456404802	/nfs/dbraw/zinc/40/48/02/456404802.db2.gz	MURWDVCUSNBZCM-CJNGLKHVSA-N	0	3	345.443	3.034	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCC1(c2ccccn2)CCC1	ZINC000343108398	456410468	/nfs/dbraw/zinc/41/04/68/456410468.db2.gz	REGDLOLOLOLRRI-GOSISDBHSA-N	0	3	333.435	3.392	20	30		EGEDHN
Cc1cc(C#N)ccc1C(=O)N(C)C[C@H]1CCN(C)[C@H]1c1cccnc1	ZINC000343128148	456422902	/nfs/dbraw/zinc/42/29/02/456422902.db2.gz	NRVVAPRENAJOFP-QUCCMNQESA-N	0	3	348.450	3.027	20	30		EGEDHN
C#CCOc1ccccc1CN[C@H]1CCN(C(=O)Nc2ccccc2)C1	ZINC000282148439	456425614	/nfs/dbraw/zinc/42/56/14/456425614.db2.gz	AGGTUSDECPQOHD-IBGZPJMESA-N	0	3	349.434	3.095	20	30		EGEDHN
C=CCOCCCN1CC[C@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000348049324	456445518	/nfs/dbraw/zinc/44/55/18/456445518.db2.gz	LJJDWDDLZDBXIN-AWEZNQCLSA-N	0	3	330.350	3.146	20	30		EGEDHN
CN(Cc1ccc(F)cc1F)C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000348059147	456449425	/nfs/dbraw/zinc/44/94/25/456449425.db2.gz	VZWLQNPLBMTUJA-INIZCTEOSA-N	0	3	339.345	3.177	20	30		EGEDHN
CCn1cc([C@H](C)NCCC(=O)Nc2ccc(C#N)c(Cl)c2)cn1	ZINC000298453341	456461261	/nfs/dbraw/zinc/46/12/61/456461261.db2.gz	RDTLZVOKJVHOCL-LBPRGKRZSA-N	0	3	345.834	3.107	20	30		EGEDHN
CC(C)(C)[C@H]1NC(=O)CC[C@H]1NCc1cccc(OCCCC#N)c1	ZINC000353116050	456500176	/nfs/dbraw/zinc/50/01/76/456500176.db2.gz	ZJLSNPHXUWNTHN-MJGOQNOKSA-N	0	3	343.471	3.152	20	30		EGEDHN
C#CC[C@@H](NCCC(=O)N1CCc2sccc2C1)c1ccccc1	ZINC000298917810	456568002	/nfs/dbraw/zinc/56/80/02/456568002.db2.gz	NJHJWKGSODFGSN-GOSISDBHSA-N	0	3	338.476	3.377	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H]2CCO[C@H]2c2nccn2CC)cc1	ZINC000343385557	456578910	/nfs/dbraw/zinc/57/89/10/456578910.db2.gz	DHSNNBLPUYIJPJ-QZTJIDSGSA-N	0	3	327.428	3.088	20	30		EGEDHN
CCN1CCO[C@@H](CNCc2cc(C#N)cs2)[C@H]1c1ccccc1	ZINC000343389993	456583534	/nfs/dbraw/zinc/58/35/34/456583534.db2.gz	CMXMSUMLKHEJAP-RBUKOAKNSA-N	0	3	341.480	3.171	20	30		EGEDHN
CCN1CCO[C@H](CNCc2cccc(C#N)c2)[C@H]1c1ccccc1	ZINC000343391595	456585491	/nfs/dbraw/zinc/58/54/91/456585491.db2.gz	RAUJCNWXBHVCLB-NHCUHLMSSA-N	0	3	335.451	3.110	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@H](NCCNC(=O)c1ccccc1Cl)CC2	ZINC000353262877	456595376	/nfs/dbraw/zinc/59/53/76/456595376.db2.gz	DRSQPBFAVPLLLM-GOSISDBHSA-N	0	3	339.826	3.219	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)NCCCN1CCc2ccccc2C1	ZINC000337965233	456627025	/nfs/dbraw/zinc/62/70/25/456627025.db2.gz	VKXIBKAMNOVWPU-UHFFFAOYSA-N	0	3	333.435	3.045	20	30		EGEDHN
C=CCCC[C@@H](C)NC(=O)c1ccc(CN2CCC(CO)CC2)cc1	ZINC000343498338	456660527	/nfs/dbraw/zinc/66/05/27/456660527.db2.gz	AVUBFRIQCBXPKW-QGZVFWFLSA-N	0	3	344.499	3.366	20	30		EGEDHN
CC(C)(CNC(=O)C[C@H](CC#N)c1ccccc1)N1CCCCC1	ZINC000353537013	456741950	/nfs/dbraw/zinc/74/19/50/456741950.db2.gz	QUNLQMJYGJLBBM-SFHVURJKSA-N	0	3	327.472	3.455	20	30		EGEDHN
COc1cc(CN(C)CCOc2ccccc2C#N)cc(OC)c1	ZINC000353551380	456752783	/nfs/dbraw/zinc/75/27/83/456752783.db2.gz	SRKLUSUTYUICAZ-UHFFFAOYSA-N	0	3	326.396	3.086	20	30		EGEDHN
C[C@@H](CC(=O)N1CCCN(CC2CCC2)CC1)NC(=O)C1CCCC1	ZINC000328797133	456762367	/nfs/dbraw/zinc/76/23/67/456762367.db2.gz	VMPFVJGSPGAJHE-INIZCTEOSA-N	0	3	349.519	3.246	20	30		EGEDHN
O=C(COc1ccnc(C(F)(F)F)c1)NC1CCN(C2CC2)CC1	ZINC000328821779	456768553	/nfs/dbraw/zinc/76/85/53/456768553.db2.gz	FWDMKMFLRCATGI-UHFFFAOYSA-N	0	3	343.349	3.063	20	30		EGEDHN
CC(=O)N1CC[C@H](NC(=O)CN2[C@H](C)CC[C@H]2C)c2ccccc21	ZINC000328831173	456770712	/nfs/dbraw/zinc/77/07/12/456770712.db2.gz	UVDOKJONHXFYIC-CPUCHLNUSA-N	0	3	329.444	3.314	20	30		EGEDHN
C[C@@H](NCCC(=O)Nc1sc2c(c1C#N)CCC2)c1cccnc1	ZINC000299722752	456773565	/nfs/dbraw/zinc/77/35/65/456773565.db2.gz	SUSDUFLTMYTSKO-GFCCVEGCSA-N	0	3	340.452	3.183	20	30		EGEDHN
CCC(CC)n1nc(C)cc1C(=O)C(C#N)c1cc(C)nc(C)n1	ZINC000343795753	456774400	/nfs/dbraw/zinc/77/44/00/456774400.db2.gz	CNBPIYJGYNTTFN-HNNXBMFYSA-N	0	3	325.416	3.450	20	30		EGEDHN
C[C@@H](C(=O)Nc1cccc(C#N)c1)N1CC[C@@H](C2CCOCC2)C1	ZINC000328856903	456779019	/nfs/dbraw/zinc/77/90/19/456779019.db2.gz	UJGSETJDNKLGPW-WMLDXEAASA-N	0	3	327.428	3.283	20	30		EGEDHN
C[C@@H]1CN(C)CCN1Cc1cccc(OCc2cccc(C#N)c2)c1	ZINC000353585609	456783590	/nfs/dbraw/zinc/78/35/90/456783590.db2.gz	UNVUHWXBXZDMLE-QGZVFWFLSA-N	0	3	335.451	3.273	20	30		EGEDHN
CN(C)C[C@@H](NC(=O)Nc1ccc(F)cc1C#N)c1ccc(F)cc1	ZINC000338362523	456786709	/nfs/dbraw/zinc/78/67/09/456786709.db2.gz	YLJWOWMQPPIZTE-QGZVFWFLSA-N	0	3	344.365	3.261	20	30		EGEDHN
C[C@H](C(=O)N(CCC#N)c1ccccc1)N1CCC[C@@H](C2CC2)C1	ZINC000344079393	456794572	/nfs/dbraw/zinc/79/45/72/456794572.db2.gz	YDZSERJWKPMNOK-SJLPKXTDSA-N	0	3	325.456	3.444	20	30		EGEDHN
Cc1nccn1C[C@@H]1CCCN1C([O-])=[NH+][C@@H]1CCO[C@@H](C(C)(C)C)C1	ZINC000328934370	456794900	/nfs/dbraw/zinc/79/49/00/456794900.db2.gz	PZBCYROAAHVSQM-IXDOHACOSA-N	0	3	348.491	3.164	20	30		EGEDHN
Cc1nn(C)c(C)c1[C@H](C)C(=O)N[C@@H]1CN(C)C[C@@H]1c1ccccc1	ZINC000328998465	456810047	/nfs/dbraw/zinc/81/00/47/456810047.db2.gz	GCJSQVQBTNMBBY-MORSLUCNSA-N	0	3	340.471	3.195	20	30		EGEDHN
Cc1ccnc2ccc(C(=O)C(C#N)c3nnc4n3CCCCC4)cc12	ZINC000353635455	456818499	/nfs/dbraw/zinc/81/84/99/456818499.db2.gz	ALIHVJRVFUZGAF-INIZCTEOSA-N	0	3	345.406	3.351	20	30		EGEDHN
Cc1nsc(NC[C@H]2CCN(CCc3ccccc3)C2)c1C#N	ZINC000283745723	456833993	/nfs/dbraw/zinc/83/39/93/456833993.db2.gz	JYOIUFRUFXOGIW-MRXNPFEDSA-N	0	3	326.469	3.300	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2ccnc(-c3ccccc3)c2N)CN1C1CC1	ZINC000329221081	456855583	/nfs/dbraw/zinc/85/55/83/456855583.db2.gz	UHWVVMFQVKRSRE-HIFRSBDPSA-N	0	3	336.439	3.261	20	30		EGEDHN
CC[C@H](C)n1ncc(NC(=O)N2C[C@H](N3CCCC3)C[C@@H]2C)c1C	ZINC000329229572	456857960	/nfs/dbraw/zinc/85/79/60/456857960.db2.gz	CTEFCRGZPJUXQM-OFQRWUPVSA-N	0	3	333.480	3.267	20	30		EGEDHN
N#CC(=C([O-])c1cnn(CCF)c1)c1nc2ccccc2n1C(F)F	ZINC000344854905	456869047	/nfs/dbraw/zinc/86/90/47/456869047.db2.gz	RNQAWTWJNCPKQL-NSHDSACASA-N	0	3	347.300	3.087	20	30		EGEDHN
N#CC(C(=O)c1cnn(CCF)c1)c1nc2ccccc2n1C(F)F	ZINC000344854905	456869050	/nfs/dbraw/zinc/86/90/50/456869050.db2.gz	RNQAWTWJNCPKQL-NSHDSACASA-N	0	3	347.300	3.087	20	30		EGEDHN
O=C(Nc1cnc2c(c1)CCCC2)[C@@H]1CCCN1C1CCOCC1	ZINC000329441325	456890488	/nfs/dbraw/zinc/89/04/88/456890488.db2.gz	KAIVJXWLXYEZDU-SFHVURJKSA-N	0	3	329.444	3.192	20	30		EGEDHN
O=C(Nc1nc2c(s1)CCCCCC2)N[C@H]1CCc2[nH]cnc2C1	ZINC000329522017	456904391	/nfs/dbraw/zinc/90/43/91/456904391.db2.gz	PELVTGBKOARHTB-NSHDSACASA-N	0	3	345.472	3.409	20	30		EGEDHN
O=C(Nc1nc2c(s1)CCCCCC2)N[C@H]1CCc2nc[nH]c2C1	ZINC000329522017	456904395	/nfs/dbraw/zinc/90/43/95/456904395.db2.gz	PELVTGBKOARHTB-NSHDSACASA-N	0	3	345.472	3.409	20	30		EGEDHN
CC(C)Oc1ccc([C@@H](C)N[C@H](C)C(=O)NC2(C#N)CCC2)cc1	ZINC000345040036	456906041	/nfs/dbraw/zinc/90/60/41/456906041.db2.gz	ZDDWLUPCHSTHAY-HUUCEWRRSA-N	0	3	329.444	3.075	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)N[C@H](C)CN2CCC[C@H](C)C2)cc1	ZINC000345070858	456915836	/nfs/dbraw/zinc/91/58/36/456915836.db2.gz	DCVJRZGZDVVTGG-DLBZAZTESA-N	0	3	345.487	3.171	20	30		EGEDHN
C[C@@H]1CCN(C(=O)NC2CC(C(F)(F)F)C2)C[C@H]1n1ccnc1	ZINC000329712912	456931020	/nfs/dbraw/zinc/93/10/20/456931020.db2.gz	QSQZFGIAHOSSTD-IKWCTNDRSA-N	0	3	330.354	3.021	20	30		EGEDHN
N#CC[C@@H](CC(=O)N[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1	ZINC000353875788	456945250	/nfs/dbraw/zinc/94/52/50/456945250.db2.gz	IJWWYRFNLRGIDM-SFTDATJTSA-N	0	3	347.462	3.465	20	30		EGEDHN
C[C@@H]1CC[C@H](C)N1CC(=O)N[C@@H]1CCc2nc(C(C)(C)C)cn2C1	ZINC000329821806	456946165	/nfs/dbraw/zinc/94/61/65/456946165.db2.gz	APYAFAAHSKEULX-QLFBSQMISA-N	0	3	332.492	3.325	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](C3CCOCC3)C2)c(OC(F)F)c1	ZINC000339131421	456955247	/nfs/dbraw/zinc/95/52/47/456955247.db2.gz	HZJIZLAZUSSVCA-HNNXBMFYSA-N	0	3	336.382	3.408	20	30		EGEDHN
C[C@H](CN(C)C)NC(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1	ZINC000349372005	456955753	/nfs/dbraw/zinc/95/57/53/456955753.db2.gz	LMUOBCWMBJMYCQ-CQSZACIVSA-N	0	3	338.411	3.422	20	30		EGEDHN
COc1cccc(CN(CCN(C)C)Cc2ccc(C#N)cc2F)c1	ZINC000349387014	456960578	/nfs/dbraw/zinc/96/05/78/456960578.db2.gz	UIPCZBAWORWBIF-UHFFFAOYSA-N	0	3	341.430	3.270	20	30		EGEDHN
C[C@@H](CN1C[C@H](C)C[C@H](C)C1)NC(=O)c1coc(C2CCOCC2)n1	ZINC000329933968	456963297	/nfs/dbraw/zinc/96/32/97/456963297.db2.gz	JMHKOLLOVMECOO-ZNMIVQPWSA-N	0	3	349.475	3.240	20	30		EGEDHN
CC(C)N1CCN(c2cccc(NC(=O)C3CCC(O)CC3)c2)CC1	ZINC000329950046	456965813	/nfs/dbraw/zinc/96/58/13/456965813.db2.gz	MDEMYWGOOKWPMB-UHFFFAOYSA-N	0	3	345.487	3.356	20	30		EGEDHN
CC(C)(CNC(=O)c1coc(C2CCOCC2)n1)N1CCCCC1	ZINC000330003114	456973149	/nfs/dbraw/zinc/97/31/49/456973149.db2.gz	ZLBJGLRZHWBZTA-UHFFFAOYSA-N	0	3	335.448	3.138	20	30		EGEDHN
CC(C)c1noc2ncc(C(=O)NC[C@]3(N(C)C)CCSC3)cc21	ZINC000330056558	456980125	/nfs/dbraw/zinc/98/01/25/456980125.db2.gz	WBPRNDHMKUKHIL-QGZVFWFLSA-N	0	3	348.472	3.088	20	30		EGEDHN
CC(=O)N[C@@H](C)C1CCN(Cc2cccc3c2OCCCO3)CC1	ZINC000330084438	456983187	/nfs/dbraw/zinc/98/31/87/456983187.db2.gz	CDWOKKNROMNELP-AWEZNQCLSA-N	0	3	332.444	3.425	20	30		EGEDHN
CCN(C(=O)C(C)C#N)[C@H](c1cccnc1)c1ccc(F)c(F)c1	ZINC000345642671	456985738	/nfs/dbraw/zinc/98/57/38/456985738.db2.gz	MXZVHZBCCOBLHY-SJCJKPOMSA-N	0	3	329.350	3.457	20	30		EGEDHN
Cc1ccccc1OCCCNC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000349600631	456994607	/nfs/dbraw/zinc/99/46/07/456994607.db2.gz	QIOKPOOMIDZUHM-IBGZPJMESA-N	0	3	347.418	3.134	20	30		EGEDHN
CC[C@H](NCCC(C)(C)C#N)c1ccccc1OCC(=O)N(C)C	ZINC000345940060	457008453	/nfs/dbraw/zinc/00/84/53/457008453.db2.gz	UHCPQORABMBHDF-INIZCTEOSA-N	0	3	331.460	3.134	20	30		EGEDHN
CCn1ccnc1[C@@H]1CCCCN1C(=O)N[C@@H](C)CN1CCCCC1	ZINC000330243118	457010008	/nfs/dbraw/zinc/01/00/08/457010008.db2.gz	CLBPMDPHGUKKNU-IRXDYDNUSA-N	0	3	347.507	3.218	20	30		EGEDHN
C[C@H](N[C@H]1CCO[C@H]1C1CC1)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000330254296	457013088	/nfs/dbraw/zinc/01/30/88/457013088.db2.gz	JIPQARLQEWLPJK-FSBGKCOPSA-N	0	3	345.468	3.242	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2CCN([C@@H]3C[C@H]3C)C[C@@H](C)C2)cc1	ZINC000346161859	457021164	/nfs/dbraw/zinc/02/11/64/457021164.db2.gz	NFLKAUGZIYMFQV-GPMSIDNRSA-N	0	3	328.456	3.054	20	30		EGEDHN
C[C@@H]1C[C@@H]1N1CCN(C(=O)c2ccc(C(C)(C)C#N)cc2)C[C@@H](C)C1	ZINC000346163874	457021675	/nfs/dbraw/zinc/02/16/75/457021675.db2.gz	DCVQUGUBFPKPKZ-FCEWJHQRSA-N	0	3	339.483	3.290	20	30		EGEDHN
C=C[C@@](C)(O)CC(=O)N(CCC)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000346299870	457030574	/nfs/dbraw/zinc/03/05/74/457030574.db2.gz	KJGZWDSKTGDWCY-TZIWHRDSSA-N	0	3	344.499	3.217	20	30		EGEDHN
COCc1ncsc1C(=O)NCC(C)(C)N1C[C@H](C)C[C@@H](C)C1	ZINC000330465726	457046370	/nfs/dbraw/zinc/04/63/70/457046370.db2.gz	GOBGCQFMLOQQRL-CHWSQXEVSA-N	0	3	339.505	3.351	20	30		EGEDHN
CC(C)Cn1ncc(C(=O)N[C@@H]2CCN(C)[C@H](C)C2)c1C(F)F	ZINC000330492301	457048886	/nfs/dbraw/zinc/04/88/86/457048886.db2.gz	QOKKDIWITLWMEO-VXGBXAGGSA-N	0	3	328.407	3.264	20	30		EGEDHN
N#C[C@@H]1CC[C@H](NCc2cc(Br)c3c(c2)OCCO3)C1	ZINC000349831175	457069512	/nfs/dbraw/zinc/06/95/12/457069512.db2.gz	UYUDXJDPWIQJOM-PWSUYJOCSA-N	0	3	337.217	3.002	20	30		EGEDHN
C[C@H]1[C@H](NC(=O)c2cn(CCCC#N)c3ccccc23)CCCN1C	ZINC000346620230	457081818	/nfs/dbraw/zinc/08/18/18/457081818.db2.gz	RGVBGGZSSOTAGZ-MAUKXSAKSA-N	0	3	338.455	3.158	20	30		EGEDHN
CC(C)CC(=O)N1CCC(N[C@H](C)c2ccc(C#N)cc2F)CC1	ZINC000330789551	457085838	/nfs/dbraw/zinc/08/58/38/457085838.db2.gz	SBMJIPBKVBQGAO-CQSZACIVSA-N	0	3	331.435	3.385	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccn(Cc3ccccc3)c2)nc(C)n1	ZINC000359489329	457088344	/nfs/dbraw/zinc/08/83/44/457088344.db2.gz	AQALBAZEFFCRBA-GOSISDBHSA-N	0	3	330.391	3.433	20	30		EGEDHN
C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)Nc1ccc([N+](=O)[O-])cc1F	ZINC000330840267	457092797	/nfs/dbraw/zinc/09/27/97/457092797.db2.gz	JNLJIXJZEIRUTC-NEPJUHHUSA-N	0	3	338.383	3.180	20	30		EGEDHN
Cn1cc(CN[C@H]2CCc3cc(Br)ccc32)cc1C#N	ZINC000359736179	457126349	/nfs/dbraw/zinc/12/63/49/457126349.db2.gz	NUTUWCPMSOEQTG-INIZCTEOSA-N	0	3	330.229	3.436	20	30		EGEDHN
CC(C)(CCC#N)CNCc1cn(-c2ccc(F)cc2Cl)nn1	ZINC000342283366	457211225	/nfs/dbraw/zinc/21/12/25/457211225.db2.gz	QFIXTNGMFIBTHN-UHFFFAOYSA-N	0	3	335.814	3.479	20	30		EGEDHN
CCOc1ccccc1Oc1ccc(CNC(=O)C(C)C#N)cn1	ZINC000347070043	457214817	/nfs/dbraw/zinc/21/48/17/457214817.db2.gz	NSRHVVRYDPQMSP-ZDUSSCGKSA-N	0	3	325.368	3.048	20	30		EGEDHN
COc1ccc(C[C@H](NC(=O)C(C)C#N)c2ccc(OC)cc2)cc1	ZINC000347070534	457215118	/nfs/dbraw/zinc/21/51/18/457215118.db2.gz	OBVGAUIDFQMRFJ-LIRRHRJNSA-N	0	3	338.407	3.263	20	30		EGEDHN
N#CC1(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)CCCCC1	ZINC000363086676	457218590	/nfs/dbraw/zinc/21/85/90/457218590.db2.gz	DZOXLOZKPLQCKM-IBGZPJMESA-N	0	3	339.483	3.489	20	30		EGEDHN
CC(C#N)C(=O)N[C@@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1	ZINC000347080126	457219869	/nfs/dbraw/zinc/21/98/69/457219869.db2.gz	WEYAATGFDCEELO-OLZOCXBDSA-N	0	3	339.370	3.415	20	30		EGEDHN
CC1(C#N)CCN(C[C@@H](O)CO[C@H]2CCCc3ccccc32)CC1	ZINC000331668381	457227979	/nfs/dbraw/zinc/22/79/79/457227979.db2.gz	NZWWCBXKVAELCD-MJGOQNOKSA-N	0	3	328.456	3.067	20	30		EGEDHN
Cc1noc(C)c1COc1cccc(C(=O)C(C#N)c2ccncn2)c1	ZINC000354455856	457234142	/nfs/dbraw/zinc/23/41/42/457234142.db2.gz	BIOCIOMYUUWFOQ-MRXNPFEDSA-N	0	3	348.362	3.151	20	30		EGEDHN
Cc1cc(C(=O)C(C#N)c2ccncn2)ccc1NC(=O)CC(C)C	ZINC000354466277	457241607	/nfs/dbraw/zinc/24/16/07/457241607.db2.gz	MQLJUNLERJDPEQ-HNNXBMFYSA-N	0	3	336.395	3.260	20	30		EGEDHN
CCC[C@H]1CN(Cc2ccc(Cl)cc2C#N)CCN1CCOC	ZINC000360121297	457265060	/nfs/dbraw/zinc/26/50/60/457265060.db2.gz	GXPDVLFLLXVYIR-SFHVURJKSA-N	0	3	335.879	3.144	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN(C)[C@@H](C)C2CCC2)cc1	ZINC000357040713	457292233	/nfs/dbraw/zinc/29/22/33/457292233.db2.gz	OJDMJOOJBMQVCN-INIZCTEOSA-N	0	3	343.471	3.452	20	30		EGEDHN
CCN(CCC1CC1)[C@@H](C)C(=O)N(CCC#N)c1ccccc1OC	ZINC000355040985	457337797	/nfs/dbraw/zinc/33/77/97/457337797.db2.gz	UYAAYNOFYFXGHB-INIZCTEOSA-N	0	3	343.471	3.452	20	30		EGEDHN
COc1ccc(CN(C)CCCOc2cccc(C#N)c2)c(OC)c1	ZINC000357154156	457350050	/nfs/dbraw/zinc/35/00/50/457350050.db2.gz	OLIYBOTUMVWDTF-UHFFFAOYSA-N	0	3	340.423	3.476	20	30		EGEDHN
CN1CCCC(C)(C)[C@@H]1CNC(=O)C[C@@H](CC#N)c1ccccc1	ZINC000357169514	457356747	/nfs/dbraw/zinc/35/67/47/457356747.db2.gz	LTDTVJVKKANXKK-MSOLQXFVSA-N	0	3	327.472	3.311	20	30		EGEDHN
CC(C)CN1CCO[C@@H](CN[C@@H]2CCCCc3cc(C#N)ccc32)C1	ZINC000360838321	457377131	/nfs/dbraw/zinc/37/71/31/457377131.db2.gz	UBTQOPOLFYCMER-PZJWPPBQSA-N	0	3	341.499	3.272	20	30		EGEDHN
N#Cc1ccc2c(c1)CCCC[C@H]2NCC(=O)N1Cc2ccccc2C1	ZINC000360869939	457395721	/nfs/dbraw/zinc/39/57/21/457395721.db2.gz	FGSDWQHXYVRPBZ-OAQYLSRUSA-N	0	3	345.446	3.458	20	30		EGEDHN
CC(=O)c1ccc(C#N)c(NCC2(N(C)C)Cc3ccccc3C2)c1	ZINC000347403756	457404156	/nfs/dbraw/zinc/40/41/56/457404156.db2.gz	IUHPPVVHBGDRJB-UHFFFAOYSA-N	0	3	333.435	3.272	20	30		EGEDHN
COC[C@@H]1CCCCN([C@H](C)C(=O)Nc2ccc(C#N)c(Cl)c2)C1	ZINC000342743656	457492934	/nfs/dbraw/zinc/49/29/34/457492934.db2.gz	QHZNUPLLHUEEHL-ZIAGYGMSSA-N	0	3	349.862	3.287	20	30		EGEDHN
COC(=O)[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1c1ccccc1	ZINC000374174836	457509643	/nfs/dbraw/zinc/50/96/43/457509643.db2.gz	QFXFYTNJKSUSHC-ZWKOTPCHSA-N	0	3	338.382	3.086	20	30		EGEDHN
N#Cc1c[nH]c(C(=O)N2CC[C@@]3(C2)CCCN(Cc2ccccc2)C3)c1	ZINC000370046021	457517026	/nfs/dbraw/zinc/51/70/26/457517026.db2.gz	IEBCSKRDXUABAX-NRFANRHFSA-N	0	3	348.450	3.015	20	30		EGEDHN
Cc1cc(C#N)nc(N2C[C@H](C)N(Cc3ccccc3)[C@@H](C)[C@@H]2C)n1	ZINC000404312566	457540760	/nfs/dbraw/zinc/54/07/60/457540760.db2.gz	MFKCKBUQNVFDRS-ULQDDVLXSA-N	0	3	335.455	3.144	20	30		EGEDHN
C=CCOc1cccnc1C(=O)N[C@H](C)[C@H](c1ccccc1)N(C)C	ZINC000356260239	457553323	/nfs/dbraw/zinc/55/33/23/457553323.db2.gz	VAMZLBSDRFZHHX-DNVCBOLYSA-N	0	3	339.439	3.068	20	30		EGEDHN
C[C@H](c1ccccc1)N1CCC(NC(=O)N[C@@H]2CC[C@H](C#N)C2)CC1	ZINC000425443934	457556084	/nfs/dbraw/zinc/55/60/84/457556084.db2.gz	BBJMHZCNVOFQOU-JTDSTZFVSA-N	0	3	340.471	3.203	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)c1cccc(CC#N)c1	ZINC000370163988	457569954	/nfs/dbraw/zinc/56/99/54/457569954.db2.gz	VFQUHJFRDXDYCZ-UTKZUKDTSA-N	0	3	347.462	3.393	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N(C)C(=O)NC[C@@H]1N(C)CCCC1(C)C	ZINC000425510891	457581499	/nfs/dbraw/zinc/58/14/99/457581499.db2.gz	AAEMHXSTBVWZPP-YJBOKZPZSA-N	0	3	342.487	3.381	20	30		EGEDHN
C=CCNC(=O)[C@H](C)N(CC)CCc1ccc(C(F)(F)F)cc1	ZINC000425532840	457588510	/nfs/dbraw/zinc/58/85/10/457588510.db2.gz	CQQRERJAWAMTEF-ZDUSSCGKSA-N	0	3	328.378	3.261	20	30		EGEDHN
C=CCC1(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3)C2)CCOCC1	ZINC000425548284	457594448	/nfs/dbraw/zinc/59/44/48/457594448.db2.gz	YKNPRDPVPZRHPT-LJQANCHMSA-N	0	3	342.483	3.092	20	30		EGEDHN
C=CC(C)(C)CNC(=O)N1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1	ZINC000425594956	457607123	/nfs/dbraw/zinc/60/71/23/457607123.db2.gz	ZSOWOLNNXPRPCE-ZWKOTPCHSA-N	0	3	327.472	3.115	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N1c2ccccc2CC[C@H]1CN(C)C	ZINC000425601063	457609798	/nfs/dbraw/zinc/60/97/98/457609798.db2.gz	FIKWCPRUKDZFCM-SFHVURJKSA-N	0	3	333.435	3.390	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CN2CCC[C@@H](c3ccccc3)C2)cc1	ZINC000433048519	457653355	/nfs/dbraw/zinc/65/33/55/457653355.db2.gz	XJRITWKRKWCLGS-UXHICEINSA-N	0	3	336.435	3.178	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN2CCC[C@H](c3ccccc3)C2)cc1	ZINC000433048520	457653889	/nfs/dbraw/zinc/65/38/89/457653889.db2.gz	XJRITWKRKWCLGS-VQTJNVASSA-N	0	3	336.435	3.178	20	30		EGEDHN
CCO[C@@H]1C[C@H](N(C)CCOc2ccc(C#N)cc2OC)C12CCC2	ZINC000357779738	457687099	/nfs/dbraw/zinc/68/70/99/457687099.db2.gz	NAHGRKKIBLILMY-RBUKOAKNSA-N	0	3	344.455	3.225	20	30		EGEDHN
CN(C)Cc1c2ccccc2oc1C(=O)NCC#Cc1ccccc1	ZINC000357807088	457696796	/nfs/dbraw/zinc/69/67/96/457696796.db2.gz	SXLQZUHWXJLKOE-UHFFFAOYSA-N	0	3	332.403	3.276	20	30		EGEDHN
Cc1nn(C)cc1[C@@H](C)N[C@H]1CCCN(c2ccc(C#N)cc2F)C1	ZINC000361346104	457701375	/nfs/dbraw/zinc/70/13/75/457701375.db2.gz	MMBIHIZJNSESDN-CJNGLKHVSA-N	0	3	341.434	3.059	20	30		EGEDHN
CC(C#N)C(=O)NCc1cn(-c2ccccc2)nc1-c1ccccc1	ZINC000357824660	457702796	/nfs/dbraw/zinc/70/27/96/457702796.db2.gz	KYVCEGZMXSUWOD-HNNXBMFYSA-N	0	3	330.391	3.315	20	30		EGEDHN
CCCN(CC(=O)N(CCC#N)c1cc(C)cc(C)c1)CC(C)(C)O	ZINC000357959133	457733811	/nfs/dbraw/zinc/73/38/11/457733811.db2.gz	OPOPXVPJBSTOEL-UHFFFAOYSA-N	0	3	345.487	3.033	20	30		EGEDHN
CC(=O)Nc1ccc(CNC(=O)C(C#N)CCc2ccccc2)cc1	ZINC000433225048	457784642	/nfs/dbraw/zinc/78/46/42/457784642.db2.gz	GAHBGCKZBREZEM-SFHVURJKSA-N	0	3	335.407	3.034	20	30		EGEDHN
CC(=O)Nc1ccc(CNC(=O)C(C#N)CCc2ccccc2)cc1	ZINC000433225047	457784708	/nfs/dbraw/zinc/78/47/08/457784708.db2.gz	GAHBGCKZBREZEM-GOSISDBHSA-N	0	3	335.407	3.034	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCCOc1ncccc1Cl	ZINC000433364737	457821122	/nfs/dbraw/zinc/82/11/22/457821122.db2.gz	OFFPHEHJFSDZHP-OAHLLOKOSA-N	0	3	343.814	3.003	20	30		EGEDHN
C[C@H](CNC(=O)C(C#N)CCc1ccccc1)Oc1cccc(F)c1	ZINC000433362929	457821178	/nfs/dbraw/zinc/82/11/78/457821178.db2.gz	LCSMMZJDUSCUQS-NVXWUHKLSA-N	0	3	340.398	3.482	20	30		EGEDHN
C#CCCN1CCC(C(=O)Nc2ccc(Br)cc2)CC1	ZINC000371196156	457823335	/nfs/dbraw/zinc/82/33/35/457823335.db2.gz	RDJMPSHHZSRUDU-UHFFFAOYSA-N	0	3	335.245	3.123	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NC[C@H](CCO)c1ccccc1	ZINC000433384454	457826133	/nfs/dbraw/zinc/82/61/33/457826133.db2.gz	KFDBWHSRPUAUNI-UXHICEINSA-N	0	3	336.435	3.041	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCC(C)(C)CC#N)C1	ZINC000457945093	457876732	/nfs/dbraw/zinc/87/67/32/457876732.db2.gz	ZSRMPWLVTLGLHZ-WBVHZDCISA-N	0	3	328.460	3.061	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCC(C)(C)CC#N)C1	ZINC000457945091	457877109	/nfs/dbraw/zinc/87/71/09/457877109.db2.gz	ZSRMPWLVTLGLHZ-NVXWUHKLSA-N	0	3	328.460	3.061	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)N(C)CC(C)(C)C#N)C1	ZINC000457944063	457877422	/nfs/dbraw/zinc/87/74/22/457877422.db2.gz	YOSNYGZQRVZBLB-RDJZCZTQSA-N	0	3	328.460	3.013	20	30		EGEDHN
CC(C)(N[C@@H]1CCN(c2ccc(C#N)cc2)C1=O)c1cccs1	ZINC000411538097	457913999	/nfs/dbraw/zinc/91/39/99/457913999.db2.gz	WDUFZKNFMPJBIX-OAHLLOKOSA-N	0	3	325.437	3.250	20	30		EGEDHN
C=CCN(C)CCN(CC)[C@H](C)C(=O)Nc1ccccc1SC	ZINC000411640585	457936348	/nfs/dbraw/zinc/93/63/48/457936348.db2.gz	KVMXSLKUQWZUEQ-OAHLLOKOSA-N	0	3	335.517	3.175	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN(C)C(C)(C)CC)cc1	ZINC000358429269	457999131	/nfs/dbraw/zinc/99/91/31/457999131.db2.gz	QFJXKJDMXOOMHM-UHFFFAOYSA-N	0	3	331.460	3.452	20	30		EGEDHN
C=CCn1cccc1C(=O)Nc1ccc(OCCN(C)C)c(F)c1	ZINC000458296160	458005660	/nfs/dbraw/zinc/00/56/60/458005660.db2.gz	QTUNDOLFFJPSRS-UHFFFAOYSA-N	0	3	331.391	3.006	20	30		EGEDHN
C=CCC[C@H](C(=O)N1C[C@@H](SC)[C@H](N(C)C)C1)c1ccccc1	ZINC000427629480	458010430	/nfs/dbraw/zinc/01/04/30/458010430.db2.gz	NDJQLHRWXILQIC-RCCFBDPRSA-N	0	3	332.513	3.240	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC2(Cc3ccc(F)cc3)CC2)CC1	ZINC000458326042	458014621	/nfs/dbraw/zinc/01/46/21/458014621.db2.gz	UDGSIHUVKXTKHU-UHFFFAOYSA-N	0	3	345.462	3.241	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)NCC(C)(C)CC#N)CCN1Cc1ccccc1	ZINC000458513561	458076716	/nfs/dbraw/zinc/07/67/16/458076716.db2.gz	YTYNIMPBKQKORP-AEFFLSMTSA-N	0	3	342.487	3.279	20	30		EGEDHN
C[C@@H]1[C@H](CO)CCCN1CC#Cc1ccc(OC(F)(F)F)cc1	ZINC000412095275	458088250	/nfs/dbraw/zinc/08/82/50/458088250.db2.gz	SZLSVKFQRNPULO-HIFRSBDPSA-N	0	3	327.346	3.030	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@H](NCc3cnn4ccccc34)C2)c(F)c1	ZINC000369156743	458106414	/nfs/dbraw/zinc/10/64/14/458106414.db2.gz	PUBGXUBMOWCGJG-KRWDZBQOSA-N	0	3	349.413	3.104	20	30		EGEDHN
CC(C)[C@H](CC(F)(F)F)NCC(=O)N(CCC#N)c1ccccc1	ZINC000445890862	458110944	/nfs/dbraw/zinc/11/09/44/458110944.db2.gz	QDKWCHOJNRFAJT-HNNXBMFYSA-N	0	3	341.377	3.500	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN(C)[C@H]1C[C@@](C)(OC)C1(C)C	ZINC000362439867	458176981	/nfs/dbraw/zinc/17/69/81/458176981.db2.gz	PUMXXSJXVMNMDI-PKOBYXMFSA-N	0	3	332.444	3.081	20	30		EGEDHN
CSc1ccccc1CN1CC[C@@H](Oc2ccc(C#N)cn2)C1	ZINC000428794213	458212514	/nfs/dbraw/zinc/21/25/14/458212514.db2.gz	RFISJGBQXCPJOQ-MRXNPFEDSA-N	0	3	325.437	3.328	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC3(CCC3)c3c2cccc3F)CC1	ZINC000358813221	458233619	/nfs/dbraw/zinc/23/36/19/458233619.db2.gz	DPXXAWONXCKMEV-UHFFFAOYSA-N	0	3	343.446	3.427	20	30		EGEDHN
CC(C)(C)c1ccncc1CNC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000412566200	458235378	/nfs/dbraw/zinc/23/53/78/458235378.db2.gz	SZJMVHQGAPMFHN-QGZVFWFLSA-N	0	3	346.434	3.249	20	30		EGEDHN
C=CC(C)(C)CNC(=O)N1C[C@H]2CCN(Cc3ccccc3)C[C@H]2C1	ZINC000458993736	458237876	/nfs/dbraw/zinc/23/78/76/458237876.db2.gz	XVYTVBRGSIPPQN-MOPGFXCFSA-N	0	3	341.499	3.362	20	30		EGEDHN
C=C(C)CCNC(=O)N1C[C@H]2CN(Cc3ccccc3)CC[C@@H]2C1	ZINC000459007390	458241633	/nfs/dbraw/zinc/24/16/33/458241633.db2.gz	SOZOPZLPZHQTRS-RTBURBONSA-N	0	3	327.472	3.116	20	30		EGEDHN
C=C(C)CCNC(=O)N(CCN(C)C)Cc1ccc(F)c(F)c1	ZINC000459009180	458242503	/nfs/dbraw/zinc/24/25/03/458242503.db2.gz	VALSMBDCZYVYIT-UHFFFAOYSA-N	0	3	325.403	3.004	20	30		EGEDHN
COCCN(C)CC[C@@H](Nc1ncc(C#N)cc1F)c1ccccc1	ZINC000413122166	458292531	/nfs/dbraw/zinc/29/25/31/458292531.db2.gz	JDCYVHMARNGQHE-GOSISDBHSA-N	0	3	342.418	3.214	20	30		EGEDHN
CCN(Cc1ccc(CN(C)C)cc1)C(=O)NCC(C)(C)CC#N	ZINC000459263317	458307680	/nfs/dbraw/zinc/30/76/80/458307680.db2.gz	XDISVURCOBJQAX-UHFFFAOYSA-N	0	3	330.476	3.220	20	30		EGEDHN
C=CCn1cccc1C(=O)Nc1ccc(OCCN(C)C)cc1F	ZINC000413915934	458311624	/nfs/dbraw/zinc/31/16/24/458311624.db2.gz	OCHYKLZSAMRSDF-UHFFFAOYSA-N	0	3	331.391	3.006	20	30		EGEDHN
C=CCOc1ccc(CN2CCC[C@](C)(C(=O)OC)C2)cc1OC	ZINC000414555643	458324537	/nfs/dbraw/zinc/32/45/37/458324537.db2.gz	ISDOFHTWJSMMHB-IBGZPJMESA-N	0	3	333.428	3.035	20	30		EGEDHN
CC(C#N)C(=O)N1CCC(Nc2cccc(Br)c2)CC1	ZINC000447696482	458331439	/nfs/dbraw/zinc/33/14/39/458331439.db2.gz	SNZRTERJSBZYRX-NSHDSACASA-N	0	3	336.233	3.012	20	30		EGEDHN
C=CCN(CCc1ccco1)C(=O)Nc1ccc2c(c1)CNCC2	ZINC000415904243	458335351	/nfs/dbraw/zinc/33/53/51/458335351.db2.gz	YACWKYVIXDLRPG-UHFFFAOYSA-N	0	3	325.412	3.188	20	30		EGEDHN
C[C@@H](C(=O)N[C@@H]1CCCc2cc(C#N)ccc21)N1[C@H](C)CC[C@@H]1C	ZINC000416343339	458342216	/nfs/dbraw/zinc/34/22/16/458342216.db2.gz	RLALXVTWBDGDPQ-QCUYGVNKSA-N	0	3	325.456	3.313	20	30		EGEDHN
C=CCN(C)CCN(CC)CC(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000429704847	458360757	/nfs/dbraw/zinc/36/07/57/458360757.db2.gz	BEZHYTUNBMWYNZ-UHFFFAOYSA-N	0	3	343.393	3.084	20	30		EGEDHN
C=CCN(C)CCN(CC)Cc1cccc(C(=O)N2CCCCC2)c1	ZINC000429721487	458363521	/nfs/dbraw/zinc/36/35/21/458363521.db2.gz	XKYBGIWBIDCHPU-UHFFFAOYSA-N	0	3	343.515	3.252	20	30		EGEDHN
CN(C[C@@H]1CCCN1C)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1	ZINC000421056799	458405983	/nfs/dbraw/zinc/40/59/83/458405983.db2.gz	HBHFTEIFXOYTTQ-ZDUSSCGKSA-N	0	3	340.349	3.135	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H]1C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000448725946	458407573	/nfs/dbraw/zinc/40/75/73/458407573.db2.gz	OHOMCMJONNQPRC-RTBURBONSA-N	0	3	327.472	3.131	20	30		EGEDHN
Cc1cc(N2CCN(C)CC2)ccc1NCc1ccc(C#N)c(F)c1	ZINC000421319184	458410427	/nfs/dbraw/zinc/41/04/27/458410427.db2.gz	KXANRALFUZFIMP-UHFFFAOYSA-N	0	3	338.430	3.370	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H]1C(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000448815963	458411800	/nfs/dbraw/zinc/41/18/00/458411800.db2.gz	KHEQZDNZNASSRP-RTBURBONSA-N	0	3	327.472	3.131	20	30		EGEDHN
CN(C)CCOc1cccc(NC(=O)[C@]2(C#N)CC23CCCC3)c1	ZINC000448835838	458412780	/nfs/dbraw/zinc/41/27/80/458412780.db2.gz	MJTVCHCXLMDVLW-LJQANCHMSA-N	0	3	327.428	3.040	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)NC[C@@H]1CCC(F)(F)C1)C(C)C	ZINC000430175870	458415063	/nfs/dbraw/zinc/41/50/63/458415063.db2.gz	DNLYIOUXRHAEQW-CVEARBPZSA-N	0	3	343.462	3.420	20	30		EGEDHN
CC1(C#N)CCC(NCC(=O)Nc2ccc(F)c(F)c2F)CC1	ZINC000449219851	458421485	/nfs/dbraw/zinc/42/14/85/458421485.db2.gz	OPPZVBSTQGECEV-UHFFFAOYSA-N	0	3	325.334	3.104	20	30		EGEDHN
Cc1ccc(S(=O)(=O)C[C@H](C)NC2CCC(C)(C#N)CC2)cc1	ZINC000449250731	458421746	/nfs/dbraw/zinc/42/17/46/458421746.db2.gz	PITYFOLAZHUCKK-HJOIGYKYSA-N	0	3	334.485	3.219	20	30		EGEDHN
CCS(=O)(=O)c1ccc(CNC2CCC(C)(C#N)CC2)s1	ZINC000449296504	458422792	/nfs/dbraw/zinc/42/27/92/458422792.db2.gz	ZOZWPBQLWFMRAG-UHFFFAOYSA-N	0	3	326.487	3.104	20	30		EGEDHN
CN(CCN1CCO[C@@H](c2cccc(C#N)c2)C1)Cc1ccccc1	ZINC000450645082	458453776	/nfs/dbraw/zinc/45/37/76/458453776.db2.gz	LHVPLQLAJXRMME-OAQYLSRUSA-N	0	3	335.451	3.064	20	30		EGEDHN
C[C@H](NCCC(=O)Nc1sccc1C#N)c1ccc([N+](=O)[O-])cc1	ZINC000451096536	458465214	/nfs/dbraw/zinc/46/52/14/458465214.db2.gz	BJJYBMPXPRZWJO-NSHDSACASA-N	0	3	344.396	3.207	20	30		EGEDHN
CO[C@@H]1CCC[C@H]1N[C@@H](C)C(=O)N(CCC#N)c1cc(C)cc(C)c1	ZINC000451635571	458484256	/nfs/dbraw/zinc/48/42/56/458484256.db2.gz	XZFSXVWIOVNWBM-QXAKKESOSA-N	0	3	343.471	3.096	20	30		EGEDHN
C[C@H](CC(=O)N(C)Cc1cccc(Cl)c1)NCC1(CC#N)CC1	ZINC000430759356	458488128	/nfs/dbraw/zinc/48/81/28/458488128.db2.gz	YBUDWMSLICUDEV-CQSZACIVSA-N	0	3	333.863	3.360	20	30		EGEDHN
C[C@H](NCCCC#N)c1ccc(F)c(I)c1	ZINC000453199255	458521460	/nfs/dbraw/zinc/52/14/60/458521460.db2.gz	XHDXEYMUCPTOBS-VIFPVBQESA-N	0	3	332.160	3.385	20	30		EGEDHN
C=CCC[C@@H](CO)N[C@H]1CCc2c1cc(Br)cc2F	ZINC000453365293	458525093	/nfs/dbraw/zinc/52/50/93/458525093.db2.gz	RKCWYVOENBQPOJ-NHYWBVRUSA-N	0	3	328.225	3.492	20	30		EGEDHN
C=C(C)Cn1c(C2CCC2)nnc1N1CCN([C@@H]2C[C@H]2C)C[C@@H](C)C1	ZINC000453449736	458530722	/nfs/dbraw/zinc/53/07/22/458530722.db2.gz	FSTKULDOIPSUNO-JFIYKMOQSA-N	0	3	343.519	3.288	20	30		EGEDHN
C[C@@H](NC(=O)[C@@H](N)CCCC#N)c1cc(F)c(Cl)cc1Cl	ZINC000424061429	458548228	/nfs/dbraw/zinc/54/82/28/458548228.db2.gz	FFPASULBBDAPHI-OQPBUACISA-N	0	3	332.206	3.331	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)NCCSCc1cccc2ccccc21	ZINC000424108852	458559971	/nfs/dbraw/zinc/55/99/71/458559971.db2.gz	YQBQLDQWBCXFBY-SFHVURJKSA-N	0	3	341.480	3.210	20	30		EGEDHN
C=CC(C)(C)CNC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000454623962	458569011	/nfs/dbraw/zinc/56/90/11/458569011.db2.gz	SABGNAGUASYLMQ-WMZOPIPTSA-N	0	3	329.488	3.408	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N[C@@H]1CCc2ccc(-c3ccccc3)cc21	ZINC000424195658	458582788	/nfs/dbraw/zinc/58/27/88/458582788.db2.gz	YFXMBNIVBBIMSJ-WOJBJXKFSA-N	0	3	333.435	3.478	20	30		EGEDHN
C=C(C)Cn1c([C@@H]2CCCS2)nnc1N1CCN(C)[C@@H](C(C)C)C1	ZINC000424232142	458589121	/nfs/dbraw/zinc/58/91/21/458589121.db2.gz	BUIRPSNZWQBNQK-CVEARBPZSA-N	0	3	349.548	3.199	20	30		EGEDHN
C[C@H]1C[C@H](N(C)C(=O)Nc2ccc(CC#N)cc2Cl)CCN1C	ZINC000455698127	458606420	/nfs/dbraw/zinc/60/64/20/458606420.db2.gz	FOQTXCFFXRAJJY-GXTWGEPZSA-N	0	3	334.851	3.352	20	30		EGEDHN
CC(C)N1C[C@@H](C)[C@H](NC(=O)Nc2ccc(CC#N)cc2Cl)C1	ZINC000455706721	458607845	/nfs/dbraw/zinc/60/78/45/458607845.db2.gz	QPTSDOQLEZUHRJ-MLGOLLRUSA-N	0	3	334.851	3.256	20	30		EGEDHN
CO[C@](C)(CNC(=O)C(C#N)CCc1ccccc1)c1ccccc1	ZINC000456139140	458633164	/nfs/dbraw/zinc/63/31/64/458633164.db2.gz	ZFRONGTZZKPSAB-WIYYLYMNSA-N	0	3	336.435	3.437	20	30		EGEDHN
CC(C)[C@@H](NC(=O)C(C#N)CCc1ccccc1)[C@@H](CO)C(C)C	ZINC000456179225	458634287	/nfs/dbraw/zinc/63/42/87/458634287.db2.gz	NGKDRZYTYJTLHR-GBESFXJTSA-N	0	3	330.472	3.164	20	30		EGEDHN
CC(C)[C@@H](NC(=O)C(C#N)CCc1ccccc1)[C@@H](CO)C(C)C	ZINC000456179223	458634395	/nfs/dbraw/zinc/63/43/95/458634395.db2.gz	NGKDRZYTYJTLHR-CEXWTWQISA-N	0	3	330.472	3.164	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CCN(Cc2ccccc2)C[C@@H](C)C1)OCC	ZINC000456338925	458637865	/nfs/dbraw/zinc/63/78/65/458637865.db2.gz	OPBXRBZQIYDERG-QUCCMNQESA-N	0	3	344.499	3.338	20	30		EGEDHN
CC1(CNC(=O)C(C#N)Cc2ccc(C#N)cc2)Cc2ccccc2C1	ZINC000471097443	458679124	/nfs/dbraw/zinc/67/91/24/458679124.db2.gz	DGOOQCNVONLMCZ-HXUWFJFHSA-N	0	3	343.430	3.162	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNc1ccc([N+](=O)[O-])c(N)c1F)C(C)C	ZINC000471248090	458688525	/nfs/dbraw/zinc/68/85/25/458688525.db2.gz	BUGPZLIAEWCDHG-OAHLLOKOSA-N	0	3	336.411	3.427	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CCc2ccccc21)C(C)C	ZINC000503430442	458708579	/nfs/dbraw/zinc/70/85/79/458708579.db2.gz	CVRPAYFWKJMFED-LJQANCHMSA-N	0	3	327.472	3.457	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)N1CCCN(C(C)(C)C)CC1	ZINC000547349623	458724973	/nfs/dbraw/zinc/72/49/73/458724973.db2.gz	WHIKXZOZQTXYQR-UHFFFAOYSA-N	0	3	346.471	3.206	20	30		EGEDHN
C=CCNC(=O)NC(=O)CNC1(c2ccc(Cl)cc2)CCCCC1	ZINC000508136900	458757374	/nfs/dbraw/zinc/75/73/74/458757374.db2.gz	OIZGFLJZSMUKEN-UHFFFAOYSA-N	0	3	349.862	3.101	20	30		EGEDHN
C=CCOc1cccc(NC(=O)NC[C@H](C)N2CCC[C@H](C)C2)c1	ZINC000510718476	458776101	/nfs/dbraw/zinc/77/61/01/458776101.db2.gz	OHHDEAXJRIBVFH-HOTGVXAUSA-N	0	3	331.460	3.493	20	30		EGEDHN
CN(C[C@@H]1CCN(Cc2ccc(CC#N)cc2)C1)C(=O)OC(C)(C)C	ZINC000495031873	458785193	/nfs/dbraw/zinc/78/51/93/458785193.db2.gz	OWCKWUCFRZVNDQ-SFHVURJKSA-N	0	3	343.471	3.441	20	30		EGEDHN
C=C[C@H]1CCCCN1C(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000472380356	458792900	/nfs/dbraw/zinc/79/29/00/458792900.db2.gz	HAJOCQVTZQNZIR-OALUTQOASA-N	0	3	327.472	3.259	20	30		EGEDHN
C[C@H]1CN(CCCNc2ccc(C#N)c(C(F)(F)F)c2)CCCO1	ZINC000432854259	458800652	/nfs/dbraw/zinc/80/06/52/458800652.db2.gz	RFKZYNZOIDCNAQ-ZDUSSCGKSA-N	0	3	341.377	3.490	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNc1cc(C(F)(F)F)nc(C)n1)C(C)C	ZINC000515037277	458804887	/nfs/dbraw/zinc/80/48/87/458804887.db2.gz	PVDHEMIRBRNREK-AWEZNQCLSA-N	0	3	342.409	3.336	20	30		EGEDHN
CN1CCC[C@@]2(CCN(C(=O)Nc3ccc(C(C)(C)C#N)cc3)C2)C1	ZINC000515038351	458804924	/nfs/dbraw/zinc/80/49/24/458804924.db2.gz	AVRHMLKLFTTXLE-HXUWFJFHSA-N	0	3	340.471	3.437	20	30		EGEDHN
C=C[C@H]1CCCCN1C(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000495198432	458809902	/nfs/dbraw/zinc/80/99/02/458809902.db2.gz	BQMZSYHFAAKYPE-RBUKOAKNSA-N	0	3	327.472	3.401	20	30		EGEDHN
Cc1ncncc1[C@H](C)N[C@H]1CCCN(c2ccc(C#N)cc2F)C1	ZINC000516490807	458818855	/nfs/dbraw/zinc/81/88/55/458818855.db2.gz	OBSQNJVNJDJHLG-HOCLYGCPSA-N	0	3	339.418	3.115	20	30		EGEDHN
COc1cc(CNC[C@@H](C)N2CCc3ccccc3C2)ccc1C#N	ZINC000440807630	458855122	/nfs/dbraw/zinc/85/51/22/458855122.db2.gz	OQMMKYDWAWWWCT-MRXNPFEDSA-N	0	3	335.451	3.103	20	30		EGEDHN
CC1(CC(F)(F)F)CN(C(=O)C(C#N)Cc2ccc(C#N)cc2)C1	ZINC000457098473	458867185	/nfs/dbraw/zinc/86/71/85/458867185.db2.gz	LVSRJPYBIUMJHO-CQSZACIVSA-N	0	3	335.329	3.041	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@H]2CCc3ccc(F)cc32)cc1	ZINC000548753820	458873513	/nfs/dbraw/zinc/87/35/13/458873513.db2.gz	TWTRTYBXFRQNLJ-LPHOPBHVSA-N	0	3	333.366	3.183	20	30		EGEDHN
C=CCNC(=O)CN1CCc2ccccc2[C@@H](c2ccccc2)[C@@H]1C	ZINC000441088849	458886608	/nfs/dbraw/zinc/88/66/08/458886608.db2.gz	ADSYFWWCCPYLBX-HTAPYJJXSA-N	0	3	334.463	3.367	20	30		EGEDHN
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCC#Cc1ccc(F)cc1	ZINC000551418023	458889095	/nfs/dbraw/zinc/88/90/95/458889095.db2.gz	AGUYNWRBFZVXBJ-OXJNMPFZSA-N	0	3	339.410	3.187	20	30		EGEDHN
C[C@]1(Cc2ccccc2)CCCN1CC(=O)NC1(C#N)CCCCC1	ZINC000467216908	458959117	/nfs/dbraw/zinc/95/91/17/458959117.db2.gz	JOROJWQOBSHIPM-HXUWFJFHSA-N	0	3	339.483	3.426	20	30		EGEDHN
C=CCN1CCC(NC(=O)Cc2ccccc2OC2CCCC2)CC1	ZINC000457532863	458992294	/nfs/dbraw/zinc/99/22/94/458992294.db2.gz	ALCYORNRQDSPMD-UHFFFAOYSA-N	0	3	342.483	3.317	20	30		EGEDHN
CC[C@@H](CNCc1ccc(O[C@H](C)C#N)cc1)NC(=O)OC(C)(C)C	ZINC000495916262	459005688	/nfs/dbraw/zinc/00/56/88/459005688.db2.gz	UUIWFPPICNQUGJ-ZBFHGGJFSA-N	0	3	347.459	3.370	20	30		EGEDHN
C[C@H](C1CC1)N(CC(=O)NCc1ccc(C#N)cc1)Cc1ccccc1	ZINC000519907566	459020534	/nfs/dbraw/zinc/02/05/34/459020534.db2.gz	KLFMMOGDWFOAID-QGZVFWFLSA-N	0	3	347.462	3.475	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@H](C#N)CCC#N	ZINC000496038759	459046029	/nfs/dbraw/zinc/04/60/29/459046029.db2.gz	GNCONHOEVCEABZ-JKSUJKDBSA-N	0	3	334.464	3.199	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNC[C@@H](C#N)CCC#N	ZINC000496038756	459046162	/nfs/dbraw/zinc/04/61/62/459046162.db2.gz	GNCONHOEVCEABZ-CVEARBPZSA-N	0	3	334.464	3.199	20	30		EGEDHN
N#C[C@H]1CC[C@H](NCCOc2ncc(C(F)(F)F)cc2Cl)C1	ZINC000442879404	459050202	/nfs/dbraw/zinc/05/02/02/459050202.db2.gz	VRIGPDBWVAZYFS-ONGXEEELSA-N	0	3	333.741	3.414	20	30		EGEDHN
COc1cc(CN(CCc2ccccc2)[C@@H]2CCOC2)ccc1C#N	ZINC000442886830	459053178	/nfs/dbraw/zinc/05/31/78/459053178.db2.gz	UREQRNLSJQYWSG-HXUWFJFHSA-N	0	3	336.435	3.400	20	30		EGEDHN
Cc1ccccc1[C@H]([C@@H](C)NC(=O)NCC#Cc1ccccc1)N(C)C	ZINC000477831799	459062646	/nfs/dbraw/zinc/06/26/46/459062646.db2.gz	WSWPYOJVETUFTO-NQIIRXRSSA-N	0	3	349.478	3.337	20	30		EGEDHN
Cc1cc(CN[C@@H]2CCCN(C3CCCCC3)C2=O)ccc1C#N	ZINC000577854019	459107529	/nfs/dbraw/zinc/10/75/29/459107529.db2.gz	NBLLSYUASKBKBL-LJQANCHMSA-N	0	3	325.456	3.280	20	30		EGEDHN
Cc1cccc2c1CC[C@@H]2NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000567464345	459110369	/nfs/dbraw/zinc/11/03/69/459110369.db2.gz	OZMZBNUZCRCSQX-UWJYYQICSA-N	0	3	336.435	3.078	20	30		EGEDHN
C=CC[C@H](C)[C@H](C)Nc1ccc2nc(CCN3CCOCC3)[nH]c2c1	ZINC000558274279	459143911	/nfs/dbraw/zinc/14/39/11/459143911.db2.gz	QDGYSHMGJGNNCF-HOTGVXAUSA-N	0	3	342.487	3.450	20	30		EGEDHN
CC(=O)NCC[C@@H]1CCCN(Cc2cccc(OCCCC#N)c2)C1	ZINC000558426162	459157968	/nfs/dbraw/zinc/15/79/68/459157968.db2.gz	GJXQNNCMPMYSBJ-SFHVURJKSA-N	0	3	343.471	3.107	20	30		EGEDHN
N#Cc1ccc(NC(=O)CN2CCC[C@@H]2[C@H]2CCCOC2)cc1Cl	ZINC000567790349	459169416	/nfs/dbraw/zinc/16/94/16/459169416.db2.gz	XWZHLFRMMWXRPD-WMLDXEAASA-N	0	3	347.846	3.041	20	30		EGEDHN
Cc1cnc(CNC2CCC(Oc3ccc(C#N)cn3)CC2)s1	ZINC000590647120	459170839	/nfs/dbraw/zinc/17/08/39/459170839.db2.gz	KACFJEKJECRMFB-UHFFFAOYSA-N	0	3	328.441	3.198	20	30		EGEDHN
C[S@](=O)[C@@H]1CCC[C@H](NCc2cccc(OCCCC#N)c2)C1	ZINC000594962115	459195237	/nfs/dbraw/zinc/19/52/37/459195237.db2.gz	PSQNHNQQYXYFCE-XAEMIUIASA-N	0	3	334.485	3.148	20	30		EGEDHN
CC(C)(CNC(=O)CSc1ccc(C#N)cc1)N1CCCCC1	ZINC000522100505	459212630	/nfs/dbraw/zinc/21/26/30/459212630.db2.gz	DRYNZNPDVFQGQQ-UHFFFAOYSA-N	0	3	331.485	3.031	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccccc2OC(F)F)CC1	ZINC000578655410	459237023	/nfs/dbraw/zinc/23/70/23/459237023.db2.gz	DYTJOAOBMOKPQK-UHFFFAOYSA-N	0	3	339.386	3.450	20	30		EGEDHN
CN(CC(C)(C)C#N)C(=O)N[C@@H](CN1CCCCC1)c1ccccc1	ZINC000590925600	459269621	/nfs/dbraw/zinc/26/96/21/459269621.db2.gz	OPCSIBVVCHRCBY-SFHVURJKSA-N	0	3	342.487	3.405	20	30		EGEDHN
Cc1ccc(NC(=O)[C@@H]2CCCN(CCc3ccc(C#N)cc3)C2)nc1	ZINC000595377211	459287376	/nfs/dbraw/zinc/28/73/76/459287376.db2.gz	MKJSKAZJRIAQMX-LJQANCHMSA-N	0	3	348.450	3.155	20	30		EGEDHN
C[C@H](C(=O)N(CCC#N)c1ccccc1)N1CC[C@@H](C2CCC2)C1	ZINC000591061769	459302979	/nfs/dbraw/zinc/30/29/79/459302979.db2.gz	HORQMXKZOAWTBR-SJLPKXTDSA-N	0	3	325.456	3.444	20	30		EGEDHN
CC(C)(C)OC(=O)NC(C)(C)CN[C@H]1CCc2ccc(C#N)cc21	ZINC000496728886	459303620	/nfs/dbraw/zinc/30/36/20/459303620.db2.gz	YMBLDGBKNPKXTR-INIZCTEOSA-N	0	3	329.444	3.438	20	30		EGEDHN
CCCCO[C@@H]1C[C@H](N[C@@H](C)C(=O)Nc2ccccc2C#N)C1(C)C	ZINC000568681310	459327111	/nfs/dbraw/zinc/32/71/11/459327111.db2.gz	CMANIBJZGAFOCS-JCGIZDLHSA-N	0	3	343.471	3.459	20	30		EGEDHN
C[C@H](CN1CCC(C)CC1)NC(=O)N[C@@H](C)c1cccc(C#N)c1	ZINC000595541533	459339200	/nfs/dbraw/zinc/33/92/00/459339200.db2.gz	UFQSTSCMZDCAKK-CVEARBPZSA-N	0	3	328.460	3.039	20	30		EGEDHN
N#C[C@@H](c1ccccc1)[C@@H]1CCCN1C(=O)Nc1cccc(CN)c1	ZINC000591309991	459350851	/nfs/dbraw/zinc/35/08/51/459350851.db2.gz	XVADPWPZDFUHQW-OALUTQOASA-N	0	3	334.423	3.449	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N1CCN(C)CC[C@H]1C)c1ccc(F)c(F)c1	ZINC000483300122	459357425	/nfs/dbraw/zinc/35/74/25/459357425.db2.gz	YVVADLYDZLUBEC-DYVFJYSZSA-N	0	3	337.414	3.318	20	30		EGEDHN
CC1CC(C#N)(C(=O)N(C)CCC2CCN(c3ccncc3)CC2)C1	ZINC000537776230	459367010	/nfs/dbraw/zinc/36/70/10/459367010.db2.gz	BZTUFMKOUCMRLT-UHFFFAOYSA-N	0	3	340.471	3.086	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)[C@H](C)N[C@H](C)C(C)(C)c1ccccc1	ZINC000538153502	459368702	/nfs/dbraw/zinc/36/87/02/459368702.db2.gz	SKQGPGTZIMYITC-YRNRMSPPSA-N	0	3	329.488	3.385	20	30		EGEDHN
C=CC[C@H](CO)CN[C@H](C)c1ccc(OC)cc1Br	ZINC000538406348	459370831	/nfs/dbraw/zinc/37/08/31/459370831.db2.gz	AWOFLPQSMWJGCI-NEPJUHHUSA-N	0	3	328.250	3.293	20	30		EGEDHN
N#CC[C@@H]1CCCN(C[C@@H](O)Cc2ccc(C(F)(F)F)cc2)C1	ZINC000595621531	459373909	/nfs/dbraw/zinc/37/39/09/459373909.db2.gz	WBRGQNXUDMQVDL-HOCLYGCPSA-N	0	3	326.362	3.234	20	30		EGEDHN
C=CCN(C(=O)NC[C@@H](C1CC1)N(C)Cc1ccccc1)C1CC1	ZINC000483684692	459382037	/nfs/dbraw/zinc/38/20/37/459382037.db2.gz	MVKHIHMYHLHCKO-IBGZPJMESA-N	0	3	327.472	3.257	20	30		EGEDHN
N#Cc1ccc(CN[C@@]2(Cc3ccc(Cl)cc3)CCCOC2)nc1	ZINC000595671035	459390436	/nfs/dbraw/zinc/39/04/36/459390436.db2.gz	LQUBJGCHXOTQSX-LJQANCHMSA-N	0	3	341.842	3.488	20	30		EGEDHN
C[C@H]1CCN(CCNC(=O)c2ccc(C#Cc3ccccc3)cc2)C1	ZINC000524776270	459392619	/nfs/dbraw/zinc/39/26/19/459392619.db2.gz	MKADVHFXXMBDLS-SFHVURJKSA-N	0	3	332.447	3.158	20	30		EGEDHN
C=CCNC(=O)CN[C@H]1CCCC[C@@H]1Oc1ccc(OCCC)cc1	ZINC000484634994	459423544	/nfs/dbraw/zinc/42/35/44/459423544.db2.gz	RTOFVCBANMIAKJ-OALUTQOASA-N	0	3	346.471	3.057	20	30		EGEDHN
N#Cc1ccc2c(c1)CC[C@H]2NCCC(=O)Nc1cc(F)cc(F)c1	ZINC000591764905	459431215	/nfs/dbraw/zinc/43/12/15/459431215.db2.gz	SAFCJYVTSUSGSR-GOSISDBHSA-N	0	3	341.361	3.442	20	30		EGEDHN
Cc1cc(C)cc(OC[C@@H](O)CN[C@@H]2CCc3cc(C#N)ccc32)c1	ZINC000591764161	459431680	/nfs/dbraw/zinc/43/16/80/459431680.db2.gz	UWELXUWIHNITFU-GHTZIAJQSA-N	0	3	336.435	3.192	20	30		EGEDHN
CCCN(CCN1CCCCC1)C(=O)[C@@H](C#N)CCc1ccccc1	ZINC000561262929	459437769	/nfs/dbraw/zinc/43/77/69/459437769.db2.gz	ZCXPZDGCKFVJOW-HXUWFJFHSA-N	0	3	341.499	3.483	20	30		EGEDHN
N#C[C@@H]1CC[C@@H](N2CCC(CNC(=O)OCc3ccccc3)CC2)C1	ZINC000497101122	459438742	/nfs/dbraw/zinc/43/87/42/459438742.db2.gz	TZADVBRXBMZPTI-RTBURBONSA-N	0	3	341.455	3.317	20	30		EGEDHN
CCCN(C(=O)N[C@H](CCC#N)c1ccccc1)[C@H]1CCN(C)C1	ZINC000591992392	459507940	/nfs/dbraw/zinc/50/79/40/459507940.db2.gz	LGGSXOKCNVNADQ-ZWKOTPCHSA-N	0	3	328.460	3.157	20	30		EGEDHN
N#Cc1ccc(S(=O)(=O)CCNC2CCC(C3CCC3)CC2)cc1	ZINC000596065761	459507936	/nfs/dbraw/zinc/50/79/36/459507936.db2.gz	JYYQFVVDAVYQEZ-UHFFFAOYSA-N	0	3	346.496	3.280	20	30		EGEDHN
C=C[C@@](C)(O)CC(=O)NC[C@H](c1ccc(CC)cc1)N(CC)CC	ZINC000562187528	459516868	/nfs/dbraw/zinc/51/68/68/459516868.db2.gz	ZAOOOCSMIKQDLM-UYAOXDASSA-N	0	3	332.488	3.075	20	30		EGEDHN
N#CC[C@@H]1CCCN(C(=O)NC[C@@H](c2cccs2)N2CCCC2)C1	ZINC000596092004	459517017	/nfs/dbraw/zinc/51/70/17/459517017.db2.gz	HFWMQKOICCJDJO-HOTGVXAUSA-N	0	3	346.500	3.220	20	30		EGEDHN
C=CCN1CCC(NC(=O)CCOc2ccc(F)c(Cl)c2)CC1	ZINC000592068637	459519474	/nfs/dbraw/zinc/51/94/74/459519474.db2.gz	JHHRMCWHPNIULS-UHFFFAOYSA-N	0	3	340.826	3.015	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCc2ccc([C@H]3C[C@@H]3C)o2)CC1	ZINC000592076554	459520656	/nfs/dbraw/zinc/52/06/56/459520656.db2.gz	FGIHRJAJRXVKAR-YJBOKZPZSA-N	0	3	330.472	3.492	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(C(=O)C3CCC3)cc2)CC1	ZINC000486982734	459524333	/nfs/dbraw/zinc/52/43/33/459524333.db2.gz	CJGLYQZEQWUCFQ-UHFFFAOYSA-N	0	3	341.455	3.441	20	30		EGEDHN
Cc1cc(CN2CCC[C@@H](CNC(=O)C(C)(C)C)C2)ccc1C#N	ZINC000487878783	459535319	/nfs/dbraw/zinc/53/53/19/459535319.db2.gz	LGNBRKFZTQUWTJ-KRWDZBQOSA-N	0	3	327.472	3.241	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN1CCN(C)[C@H](C(C)C)C1	ZINC000487973333	459536946	/nfs/dbraw/zinc/53/69/46/459536946.db2.gz	RVHXMOQYGQMUDG-KRWDZBQOSA-N	0	3	347.528	3.175	20	30		EGEDHN
C[C@@H]1OCC[C@@]1(O)CN(Cc1ccc(C#N)s1)Cc1ccccc1	ZINC000583468229	459543488	/nfs/dbraw/zinc/54/34/88/459543488.db2.gz	METDQSRMTBXEGD-HNAYVOBHSA-N	0	3	342.464	3.162	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000488733664	459549370	/nfs/dbraw/zinc/54/93/70/459549370.db2.gz	PEUJEEXAZMJKCQ-PKOBYXMFSA-N	0	3	337.467	3.315	20	30		EGEDHN
Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@@H]2N[C@@H]2CC[C@H](C#N)C2)cc1	ZINC000570624920	459558783	/nfs/dbraw/zinc/55/87/83/459558783.db2.gz	WAFMLCQRVKETBS-NBMJBFSESA-N	0	3	346.496	3.362	20	30		EGEDHN
C=CCn1cccc1C(=O)NC1CCN([C@H](C)c2ccncc2)CC1	ZINC000489039705	459559157	/nfs/dbraw/zinc/55/91/57/459559157.db2.gz	KCAUAJALDCRKRW-MRXNPFEDSA-N	0	3	338.455	3.025	20	30		EGEDHN
C=C[C@@H]1CCCCN1C[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000489506458	459567101	/nfs/dbraw/zinc/56/71/01/459567101.db2.gz	HCZKHDZNCBAVQJ-ZIAGYGMSSA-N	0	3	329.362	3.486	20	30		EGEDHN
N#Cc1c(NC(=O)CNC2(C3CC3)CC2)sc2c1CCCCC2	ZINC000542527653	459567507	/nfs/dbraw/zinc/56/75/07/459567507.db2.gz	WUHUTIKVCKXPMC-UHFFFAOYSA-N	0	3	329.469	3.359	20	30		EGEDHN
C=CCN(CCc1ccco1)C(=O)NC[C@H](C)N1CCCC[C@@H]1C	ZINC000498144744	459571539	/nfs/dbraw/zinc/57/15/39/459571539.db2.gz	ISQRDAAVKYFXRC-IRXDYDNUSA-N	0	3	333.476	3.283	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](CCC)c2ccccn2)CC1	ZINC000592295931	459572083	/nfs/dbraw/zinc/57/20/83/459572083.db2.gz	MRUQRBZGRIQKCW-SFHVURJKSA-N	0	3	330.476	3.263	20	30		EGEDHN
CC[C@H](N[C@@H](C)c1cccc(C#N)c1)C(=O)NCc1cccs1	ZINC000592393963	459590385	/nfs/dbraw/zinc/59/03/85/459590385.db2.gz	LXGRPEHGBWYPOH-GUYCJALGSA-N	0	3	327.453	3.365	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@@H](N[C@@H]1CCN(C(=O)C3CCCCC3)C1)CC2	ZINC000583781925	459595485	/nfs/dbraw/zinc/59/54/85/459595485.db2.gz	JYEWPMTVCATNMN-QUCCMNQESA-N	0	3	337.467	3.316	20	30		EGEDHN
N#CC(C(=O)c1cnc(C2CC2)nc1)c1ccc(C(F)(F)F)cn1	ZINC000583794744	459597806	/nfs/dbraw/zinc/59/78/06/459597806.db2.gz	SMTDBNKQGKQMHM-GFCCVEGCSA-N	0	3	332.285	3.258	20	30		EGEDHN
C[C@@H]1C[C@@H](Nc2c(C#N)cnc3ccc(Cl)cc32)CN1C1CC1	ZINC000583845061	459604796	/nfs/dbraw/zinc/60/47/96/459604796.db2.gz	ULHLZHRURMHCJD-BXUZGUMPSA-N	0	3	326.831	3.219	20	30		EGEDHN
CC(C)(C)c1ccccc1OCCNCc1cnc2c(C#N)cnn2c1	ZINC000592506562	459618578	/nfs/dbraw/zinc/61/85/78/459618578.db2.gz	ZZCROYCUWMDLFK-UHFFFAOYSA-N	0	3	349.438	3.067	20	30		EGEDHN
N#Cc1ccc([C@H](N[C@H]2CC[C@H](c3cccc(F)c3)C2)C(N)=O)cc1	ZINC000583969653	459626625	/nfs/dbraw/zinc/62/66/25/459626625.db2.gz	SPJWWXSOWVVDIR-WDSOQIARSA-N	0	3	337.398	3.150	20	30		EGEDHN
Cc1ccnc(N2CCCN(CCCc3ccccc3)CC2)c1C#N	ZINC000543205823	459635345	/nfs/dbraw/zinc/63/53/45/459635345.db2.gz	BVVJRNDVQQSPSN-UHFFFAOYSA-N	0	3	334.467	3.407	20	30		EGEDHN
C=CCN1CC[C@H](N2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)C1=O	ZINC000499618825	459642733	/nfs/dbraw/zinc/64/27/33/459642733.db2.gz	KVUOTERZMVLZNI-ZBFHGGJFSA-N	0	3	338.373	3.282	20	30		EGEDHN
CN(C)C/C=C\C(=O)Nc1cccc(OCc2cccc(C#N)c2)c1	ZINC000491686264	459653764	/nfs/dbraw/zinc/65/37/64/459653764.db2.gz	QCXGEVAZRYLVMG-YHYXMXQVSA-N	0	3	335.407	3.194	20	30		EGEDHN
CC(C)(C#N)CCN1C[C@H]2CCC[C@@]2(c2nc(CC3CC3)no2)C1	ZINC000500440110	459679873	/nfs/dbraw/zinc/67/98/73/459679873.db2.gz	VOPZKAYFTTVDMS-DNVCBOLYSA-N	0	3	328.460	3.315	20	30		EGEDHN
Cc1ccccc1[C@H]([C@@H](C)NC(=O)N1CCC[C@H](CC#N)C1)N(C)C	ZINC000596598678	459691821	/nfs/dbraw/zinc/69/18/21/459691821.db2.gz	KRXWNGVOBXLRKG-LMMKCTJWSA-N	0	3	342.487	3.322	20	30		EGEDHN
C#CCCN1CCC(NC(=O)/C=C\c2cnc(C(C)(C)C)s2)CC1	ZINC000492092676	459692140	/nfs/dbraw/zinc/69/21/40/459692140.db2.gz	YYNGXXKBMNAFDG-FPLPWBNLSA-N	0	3	345.512	3.058	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1CNCc1ncc(Br)cc1F	ZINC000527704180	459707204	/nfs/dbraw/zinc/70/72/04/459707204.db2.gz	VIICJGFCOGCXRM-YGRLFVJLSA-N	0	3	329.213	3.054	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1CNCc1ncc(Cl)cc1Br	ZINC000527722324	459713487	/nfs/dbraw/zinc/71/34/87/459713487.db2.gz	UNCNDASTZJSVMN-ZANVPECISA-N	0	3	331.641	3.178	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)CCc2ccc(C#N)cc2)C1	ZINC000501231848	459717780	/nfs/dbraw/zinc/71/77/80/459717780.db2.gz	ZOIBNRCGNRKDJX-DYESRHJHSA-N	0	3	347.462	3.443	20	30		EGEDHN
C[C@@H](C#N)N(Cc1cccc(C(F)(F)F)c1)C(=O)/C=C/CN(C)C	ZINC000493094426	459733400	/nfs/dbraw/zinc/73/34/00/459733400.db2.gz	LURPRHOSUXWUDF-LJLILKBBSA-N	0	3	339.361	3.064	20	30		EGEDHN
CC(C#N)C(=O)NCc1ccc([C@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000493445334	459745755	/nfs/dbraw/zinc/74/57/55/459745755.db2.gz	RROMEQXPZULFEZ-STQMWFEESA-N	0	3	331.416	3.048	20	30		EGEDHN
N#CCN(C(=O)C(C[C@@H]1CCCO1)C(F)(F)F)c1ccccc1	ZINC000593039973	459750675	/nfs/dbraw/zinc/75/06/75/459750675.db2.gz	VZFUNZZCOCXARE-UONOGXRCSA-N	0	3	326.318	3.291	20	30		EGEDHN
COC[C@H](NCC(=O)Nc1ccccc1SC[C@H](C)C#N)C(C)C	ZINC000544414210	459758690	/nfs/dbraw/zinc/75/86/90/459758690.db2.gz	CYRIRPUNMABGSR-ZBFHGGJFSA-N	0	3	349.500	3.137	20	30		EGEDHN
CC1(C)CN(C(=O)C(C#N)Cc2ccc(C#N)cc2)[C@H]1c1ccncc1	ZINC000564212747	459772009	/nfs/dbraw/zinc/77/20/09/459772009.db2.gz	FMSBHDJYMUIGFA-OALUTQOASA-N	0	3	344.418	3.245	20	30		EGEDHN
CC1(C)CN(C(=O)C(C#N)Cc2ccc(C#N)cc2)[C@H]1c1ccncc1	ZINC000564212746	459772043	/nfs/dbraw/zinc/77/20/43/459772043.db2.gz	FMSBHDJYMUIGFA-MOPGFXCFSA-N	0	3	344.418	3.245	20	30		EGEDHN
CCOC1CC(N(C)Cc2ccc(OC)c(OCCCC#N)c2)C1	ZINC000564327582	459772844	/nfs/dbraw/zinc/77/28/44/459772844.db2.gz	XXRUSHRTHLYXKZ-UHFFFAOYSA-N	0	3	332.444	3.377	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N2CCCN(C(C)(C)C)CC2)cc1	ZINC000584700697	459785116	/nfs/dbraw/zinc/78/51/16/459785116.db2.gz	BPIVGBGUMMECFF-UHFFFAOYSA-N	0	3	330.472	3.127	20	30		EGEDHN
C[C@]1(NC(=O)NCc2ccc(C#N)cc2)CCN(Cc2ccccc2)C1	ZINC000593303991	459835058	/nfs/dbraw/zinc/83/50/58/459835058.db2.gz	FARCOQUULGPCDR-NRFANRHFSA-N	0	3	348.450	3.022	20	30		EGEDHN
CCN1CCC(n2nccc2NC(=O)CC2(C#N)CCCCC2)CC1	ZINC000597094370	459836527	/nfs/dbraw/zinc/83/65/27/459836527.db2.gz	GAOZGWVZWIIRDU-UHFFFAOYSA-N	0	3	343.475	3.343	20	30		EGEDHN
CCOc1ccc(CN2CC[C@H](Oc3ccc(C#N)cn3)C2)c(C)c1	ZINC000597128727	459845532	/nfs/dbraw/zinc/84/55/32/459845532.db2.gz	DYIAJZYDMPJTFX-IBGZPJMESA-N	0	3	337.423	3.314	20	30		EGEDHN
CCCN(C(=O)[C@H](C#N)CC)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000593446150	459892624	/nfs/dbraw/zinc/89/26/24/459892624.db2.gz	LSFNYSNIGSRZED-OALUTQOASA-N	0	3	327.472	3.439	20	30		EGEDHN
N#Cc1cccc(CNC(=O)CN2CCC[C@@H](c3ccccc3)CC2)c1	ZINC000608977402	459898062	/nfs/dbraw/zinc/89/80/62/459898062.db2.gz	IUKQKXGRUICXTO-OAQYLSRUSA-N	0	3	347.462	3.444	20	30		EGEDHN
CC[C@@H](C#N)C(=O)N1CC[C@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000593500721	459907573	/nfs/dbraw/zinc/90/75/73/459907573.db2.gz	SHQRTTBKHQOCTL-AZUAARDMSA-N	0	3	325.456	3.051	20	30		EGEDHN
Cc1cc(N2CCN(C3CCC3)C[C@H](C)C2)c(C#N)cc1[N+](=O)[O-]	ZINC000575018988	459910347	/nfs/dbraw/zinc/91/03/47/459910347.db2.gz	GTEKPGYPXIEKIZ-ZDUSSCGKSA-N	0	3	328.416	3.086	20	30		EGEDHN
CC[C@H](CNC(=O)CCCCCC#N)N1CCc2ccccc2C1	ZINC000588149590	459918968	/nfs/dbraw/zinc/91/89/68/459918968.db2.gz	DMPFAJRDDFXTOK-LJQANCHMSA-N	0	3	327.472	3.414	20	30		EGEDHN
C=CCn1c(-c2cc(C)cs2)nnc1N1CCN(CC2CC2)CC1	ZINC000624849762	459933301	/nfs/dbraw/zinc/93/33/01/459933301.db2.gz	FXUVAYJAJZMBIR-UHFFFAOYSA-N	0	3	343.500	3.033	20	30		EGEDHN
COc1ccc([C@@H]2CCCN2C[C@H](O)CC(C)(C)C#N)c(OC)c1	ZINC000598584778	459953149	/nfs/dbraw/zinc/95/31/49/459953149.db2.gz	VPWRGZBZWBNFSB-PBHICJAKSA-N	0	3	332.444	3.141	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN[C@H](CCO)c1ccc(Cl)c(Cl)c1	ZINC000598617497	459964153	/nfs/dbraw/zinc/96/41/53/459964153.db2.gz	SQVNBYPUDLRICO-IUODEOHRSA-N	0	3	345.270	3.307	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN1CC2(CCOCC2)[C@H]1c1ccccc1	ZINC000598623193	459966587	/nfs/dbraw/zinc/96/65/87/459966587.db2.gz	VMMYLELXCMVNMU-QZTJIDSGSA-N	0	3	328.456	3.141	20	30		EGEDHN
C[C@H](CC1(C#N)CCOCC1)NCc1cccc(N2CCCC2=O)c1	ZINC000602510748	459976303	/nfs/dbraw/zinc/97/63/03/459976303.db2.gz	MTJMQGBZJFYRAF-MRXNPFEDSA-N	0	3	341.455	3.002	20	30		EGEDHN
CSc1ccc(NC(=O)[C@H](N)CCCC#N)cc1Br	ZINC000602528398	459985112	/nfs/dbraw/zinc/98/51/12/459985112.db2.gz	ARJVZLDFXGADNA-LLVKDONJSA-N	0	3	342.262	3.131	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CC[C@@H](C)O2)nnc1N(C)CCN1CCCCC1	ZINC000624987796	459995120	/nfs/dbraw/zinc/99/51/20/459995120.db2.gz	VXYYKBMNKVUCFH-IAGOWNOFSA-N	0	3	347.507	3.016	20	30		EGEDHN
COc1cc(CN[C@H](C)CC2(C#N)CCOCC2)c2ccccc2n1	ZINC000602558310	459995860	/nfs/dbraw/zinc/99/58/60/459995860.db2.gz	OJOKBFQZLUCNSQ-OAHLLOKOSA-N	0	3	339.439	3.432	20	30		EGEDHN
CC(C)n1cc(CNC2CCC(Oc3ccccc3C#N)CC2)nn1	ZINC000588925180	460005617	/nfs/dbraw/zinc/00/56/17/460005617.db2.gz	CEUVTHSBCHHQLP-UHFFFAOYSA-N	0	3	339.443	3.210	20	30		EGEDHN
CN(C)C[C@@H](NC(=O)CC1(C#N)CCCCC1)c1ccc(F)cc1	ZINC000597658240	460020480	/nfs/dbraw/zinc/02/04/80/460020480.db2.gz	VIFXCHLWXZEMSA-QGZVFWFLSA-N	0	3	331.435	3.409	20	30		EGEDHN
N#CC1(CC(=O)Nc2cccc(CN3CC[C@@H](O)C3)c2)CCCCC1	ZINC000597687227	460027202	/nfs/dbraw/zinc/02/72/02/460027202.db2.gz	MYLQRWQIBURUPQ-GOSISDBHSA-N	0	3	341.455	3.056	20	30		EGEDHN
N#Cc1ccc(NC(=O)C2CCN(Cc3ccccc3)CC2)cc1C#N	ZINC000610111794	460065266	/nfs/dbraw/zinc/06/52/66/460065266.db2.gz	BCXFPGNXHOYNGB-UHFFFAOYSA-N	0	3	344.418	3.281	20	30		EGEDHN
N#C[C@@H]1CCC[C@H](N[C@H](Cc2ccccc2)[C@@H](O)C(F)(F)F)C1	ZINC000618573809	460068545	/nfs/dbraw/zinc/06/85/45/460068545.db2.gz	QKYFKGTXMXHHEJ-QKPAOTATSA-N	0	3	326.362	3.193	20	30		EGEDHN
CCCN(CC(=O)Nc1ccc(C#N)cc1)[C@@H]1[C@H]2CCO[C@H]2C1(C)C	ZINC000610133510	460068664	/nfs/dbraw/zinc/06/86/64/460068664.db2.gz	XZDLXNKJISYGKI-BHIYHBOVSA-N	0	3	341.455	3.022	20	30		EGEDHN
CC(C)(C)N1C[C@@H](C(=O)N2CCC[C@@H](CC#N)C2)[C@H](C(F)(F)F)C1	ZINC000597901791	460101605	/nfs/dbraw/zinc/10/16/05/460101605.db2.gz	ZMXPNUHMZALZDZ-BFHYXJOUSA-N	0	3	345.409	3.047	20	30		EGEDHN
CC[C@@H]1CCCCN1CCNC(=O)N[C@@H](C)c1cccc(C#N)c1	ZINC000610351353	460131045	/nfs/dbraw/zinc/13/10/45/460131045.db2.gz	NVOMZXASWYBLMH-MAUKXSAKSA-N	0	3	328.460	3.183	20	30		EGEDHN
COc1cc(CN[C@@H]2CCc3cc(C#N)ccc32)cc(OC)c1OC	ZINC000618742657	460151805	/nfs/dbraw/zinc/15/18/05/460151805.db2.gz	OHKVTQPKSPJXSJ-QGZVFWFLSA-N	0	3	338.407	3.361	20	30		EGEDHN
C[C@@H](C#N)CSc1ccccc1NC(=O)NCC1(N(C)C)CC1	ZINC000602834831	460152475	/nfs/dbraw/zinc/15/24/75/460152475.db2.gz	DWHRATKPCQOYFE-ZDUSSCGKSA-N	0	3	332.473	3.154	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)C(=O)N1CCN(C2CCC2)C[C@H](C)C1	ZINC000594363255	460196052	/nfs/dbraw/zinc/19/60/52/460196052.db2.gz	OXXAHBJXKYOSRZ-DLBZAZTESA-N	0	3	339.483	3.070	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1nn(C)c2ccccc12)C(C)C	ZINC000625558046	460205409	/nfs/dbraw/zinc/20/54/09/460205409.db2.gz	SKPZCNUDXBPOTL-SFHVURJKSA-N	0	3	340.471	3.002	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CN(Cc1cccc(F)c1)C1CC1	ZINC000599265369	460210277	/nfs/dbraw/zinc/21/02/77/460210277.db2.gz	QQNAMPFCAYJMIV-LJQANCHMSA-N	0	3	340.398	3.102	20	30		EGEDHN
CC(C)(C)OCCCN1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC000610681090	460214307	/nfs/dbraw/zinc/21/43/07/460214307.db2.gz	KBUASMUVHFHOSK-UHFFFAOYSA-N	0	3	329.488	3.271	20	30		EGEDHN
C[C@]1(NC[C@H](O)COc2ccccc2C#N)CCCc2ccccc21	ZINC000599327316	460229447	/nfs/dbraw/zinc/22/94/47/460229447.db2.gz	RGNKSOXEJUDGRP-RXVVDRJESA-N	0	3	336.435	3.139	20	30		EGEDHN
CC(C)(C#N)CCCN[C@@H](Cc1ccccc1)[C@@H](O)C(F)(F)F	ZINC000603147492	460255294	/nfs/dbraw/zinc/25/52/94/460255294.db2.gz	YRQSPGHHJKWYEB-LSDHHAIUSA-N	0	3	328.378	3.440	20	30		EGEDHN
CN(C(=O)C1CCN(Cc2ccccc2)CC1)c1ccc(C#N)cc1	ZINC000610984543	460271102	/nfs/dbraw/zinc/27/11/02/460271102.db2.gz	WOWZUMHLQGGWJE-UHFFFAOYSA-N	0	3	333.435	3.433	20	30		EGEDHN
CC[C@H](CN1CCCC1)NC(=O)N[C@H](CCC#N)c1ccccc1	ZINC000610986444	460272330	/nfs/dbraw/zinc/27/23/30/460272330.db2.gz	RIPPXTOPLKDZOB-QZTJIDSGSA-N	0	3	328.460	3.205	20	30		EGEDHN
COCc1cc(C#N)ccc1NCCCCN1C[C@H](C)O[C@@H](C)C1	ZINC000603308759	460281872	/nfs/dbraw/zinc/28/18/72/460281872.db2.gz	ITYQCHMPYUIQIF-HOTGVXAUSA-N	0	3	331.460	3.006	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN[C@@H]1CCO[C@H]1c1ccc(=O)[nH]c1	ZINC000599631072	460292988	/nfs/dbraw/zinc/29/29/88/460292988.db2.gz	WZHBUBRTSQQLFH-MJGOQNOKSA-N	0	3	337.423	3.208	20	30		EGEDHN
N#CCCN1CCN(CC/C=C/c2ccc(Br)cc2)CC1	ZINC000611174799	460301263	/nfs/dbraw/zinc/30/12/63/460301263.db2.gz	NFSUKJDRJCHKAG-DAFODLJHSA-N	0	3	348.288	3.384	20	30		EGEDHN
CC#CC[C@H](CO)NCc1ccc(-c2ccccc2[N+](=O)[O-])s1	ZINC000603430534	460303002	/nfs/dbraw/zinc/30/30/02/460303002.db2.gz	BDHZHLHHZLCVML-CYBMUJFWSA-N	0	3	330.409	3.187	20	30		EGEDHN
Cc1ccc([C@H](C)N(C)C[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000603684871	460333662	/nfs/dbraw/zinc/33/36/62/460333662.db2.gz	JCHQSKIBSKNAHB-FXAWDEMLSA-N	0	3	338.451	3.494	20	30		EGEDHN
Cc1cc2ncn(C[C@H](O)CN[C@@H](C)c3cccc(C#N)c3)c2cc1C	ZINC000611386856	460350172	/nfs/dbraw/zinc/35/01/72/460350172.db2.gz	AXPJGJYCBHYIDK-QFBILLFUSA-N	0	3	348.450	3.237	20	30		EGEDHN
C[C@@H](NC[C@H](O)COCc1ccccc1Cl)c1cccc(C#N)c1	ZINC000611388206	460351437	/nfs/dbraw/zinc/35/14/37/460351437.db2.gz	LELLKQZNPGUNJC-KDOFPFPSSA-N	0	3	344.842	3.440	20	30		EGEDHN
C=C(CNCc1ccc(O[C@H](C)C(=O)OC)cc1)c1ccccc1	ZINC000611437732	460365018	/nfs/dbraw/zinc/36/50/18/460365018.db2.gz	YBSOXDLZVMIOLB-MRXNPFEDSA-N	0	3	325.408	3.430	20	30		EGEDHN
N#Cc1ccc(CN2CCC(CC(=O)NC3CCCC3)CC2)cc1	ZINC000604416020	460423976	/nfs/dbraw/zinc/42/39/76/460423976.db2.gz	UYORSJVJBHNCKN-UHFFFAOYSA-N	0	3	325.456	3.219	20	30		EGEDHN
C[C@]1(C#N)CCCN(C(=O)N[C@H](CN2CCCC2)c2ccccc2)C1	ZINC000612099463	460539433	/nfs/dbraw/zinc/53/94/33/460539433.db2.gz	XAGOUZHWKOITHC-UYAOXDASSA-N	0	3	340.471	3.159	20	30		EGEDHN
Cc1cc(NC(=O)c2ccccc2CC#N)ccc1OCCN(C)C	ZINC000601634696	460852625	/nfs/dbraw/zinc/85/26/25/460852625.db2.gz	YYPDBHIHFJZTAZ-UHFFFAOYSA-N	0	3	337.423	3.254	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN1CCC[C@H]1CC(=O)c1ccc(F)cc1	ZINC000621269076	460968713	/nfs/dbraw/zinc/96/87/13/460968713.db2.gz	IVRNUSTWWPGJFH-DLBZAZTESA-N	0	3	332.419	3.164	20	30		EGEDHN
N#Cc1cnc2c(F)ccc(F)c2c1NC[C@@H]1CCCCN1C1CC1	ZINC000617976662	461048958	/nfs/dbraw/zinc/04/89/58/461048958.db2.gz	LMYQYSGGQHSLOI-AWEZNQCLSA-N	0	3	342.393	3.235	20	30		EGEDHN
C=CCn1c([C@H]2CCCCO2)nnc1N1CCN(C(C)(C)CC)CC1	ZINC000655614893	461331623	/nfs/dbraw/zinc/33/16/23/461331623.db2.gz	FMJXKVSMQKAQGQ-MRXNPFEDSA-N	0	3	347.507	3.016	20	30		EGEDHN
C=CCCC[C@@H](C)NC(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000660990000	462051901	/nfs/dbraw/zinc/05/19/01/462051901.db2.gz	CQRFEOYEOWAVAG-QGZVFWFLSA-N	0	3	344.503	3.338	20	30		EGEDHN
N#CC(C(=O)c1ccc2ccncc2c1)c1nnc2n1CCCCC2	ZINC000651268884	462160994	/nfs/dbraw/zinc/16/09/94/462160994.db2.gz	RWJQNDUDYCEYGO-INIZCTEOSA-N	0	3	331.379	3.043	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC(C)(CNCc2ccc(C#N)o2)CC1	ZINC000184271041	526392373	/nfs/dbraw/zinc/39/23/73/526392373.db2.gz	CJBNPIJLEIOUNX-UHFFFAOYSA-N	0	3	333.432	3.278	20	30		EGEDHN
C=CCN1CCC(NC(=O)CCCc2c[nH]c3ccccc23)CC1	ZINC000171726043	526420999	/nfs/dbraw/zinc/42/09/99/526420999.db2.gz	CQDXFJJCCONWBW-UHFFFAOYSA-N	0	3	325.456	3.257	20	30		EGEDHN
C=CCN1CCC(NC(=O)COc2ccccc2[C@H](C)CC)CC1	ZINC000171720752	526422418	/nfs/dbraw/zinc/42/24/18/526422418.db2.gz	PITXDCNGFGLSOQ-MRXNPFEDSA-N	0	3	330.472	3.346	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(CC)[C@@H](C)c2cccc(OC)c2)CC1	ZINC000171740954	526425185	/nfs/dbraw/zinc/42/51/85/526425185.db2.gz	OBPDPFNUBDAGGG-INIZCTEOSA-N	0	3	345.487	3.438	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@@H]2c2cccc(F)c2)CC1	ZINC000171737680	526426770	/nfs/dbraw/zinc/42/67/70/526426770.db2.gz	DMYIYHOPUPNVTH-GOSISDBHSA-N	0	3	331.435	3.323	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(Br)cc2)CC1	ZINC000171739338	526440938	/nfs/dbraw/zinc/44/09/38/526440938.db2.gz	DZIRSOSSRZOPFN-UHFFFAOYSA-N	0	3	338.249	3.221	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(-c3ccccc3Cl)n[nH]2)CC1	ZINC000171721278	526446937	/nfs/dbraw/zinc/44/69/37/526446937.db2.gz	GPNDAFIXIXUFEV-UHFFFAOYSA-N	0	3	344.846	3.110	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cc(F)c(OC)cc2C)CC1	ZINC000186755518	526595078	/nfs/dbraw/zinc/59/50/78/526595078.db2.gz	JONTUEJDCJXEKY-UHFFFAOYSA-N	0	3	335.423	3.305	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc3ncsc3c2)CC1	ZINC000171583378	526595269	/nfs/dbraw/zinc/59/52/69/526595269.db2.gz	CUXDWYTUMMNLSS-UHFFFAOYSA-N	0	3	330.457	3.458	20	30		EGEDHN
C#CCSCCNCc1cc(OC)ccc1OCc1ccccn1	ZINC000152936571	527150828	/nfs/dbraw/zinc/15/08/28/527150828.db2.gz	CNDOGFRVXGRJNY-UHFFFAOYSA-N	0	3	342.464	3.125	20	30		EGEDHN
C=CCC[C@@H](NC(=O)NC1CCN(CCOC)CC1)c1ccccc1	ZINC000159127512	527439498	/nfs/dbraw/zinc/43/94/98/527439498.db2.gz	GFCRKWVLESNSBY-LJQANCHMSA-N	0	3	345.487	3.104	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@@H](C)N[C@@H](C)c1ccc(-n2cccn2)cc1	ZINC000174367826	527629028	/nfs/dbraw/zinc/62/90/28/527629028.db2.gz	MHIJOVGDAQVHRG-DLBZAZTESA-N	0	3	338.455	3.112	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Cc1nc(C)sc1C)C(C)C	ZINC000130316382	527648166	/nfs/dbraw/zinc/64/81/66/527648166.db2.gz	JCGZDZIQBADVMV-QGZVFWFLSA-N	0	3	335.517	3.117	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@@H]1C[C@H](C)N(C2CC2)C1	ZINC000129973316	528937767	/nfs/dbraw/zinc/93/77/67/528937767.db2.gz	JNNWLHWKYSNGMY-MAUKXSAKSA-N	0	3	340.471	3.103	20	30		EGEDHN
CN(C)CCOc1ccccc1CNc1ncc(C#N)cc1Cl	ZINC000265134024	535916546	/nfs/dbraw/zinc/91/65/46/535916546.db2.gz	NWLUUJHXOWUGFB-UHFFFAOYSA-N	0	3	330.819	3.159	20	30		EGEDHN
Cn1ncc2cc(C(=O)C(C#N)c3ccc4ccccc4n3)cnc21	ZINC000673848429	548638172	/nfs/dbraw/zinc/63/81/72/548638172.db2.gz	BGJSTUXTDSAZHD-HNNXBMFYSA-N	0	3	327.347	3.007	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N(c1ccccc1)C1CCN(C)CC1)OCC	ZINC000677378923	549260163	/nfs/dbraw/zinc/26/01/63/549260163.db2.gz	CTYMWOFZAQLBJD-IBGZPJMESA-N	0	3	330.472	3.485	20	30		EGEDHN
COCC#CCN[C@H](Cc1ccc(OC)c(OC)c1)c1ccccc1	ZINC000678762613	549555563	/nfs/dbraw/zinc/55/55/63/549555563.db2.gz	JTEUJWVWEVXMOF-LJQANCHMSA-N	0	3	339.435	3.227	20	30		EGEDHN
C=CCNC(=O)CNCc1cn(Cc2ccccc2)c2ccccc12	ZINC000679027768	549618803	/nfs/dbraw/zinc/61/88/03/549618803.db2.gz	NGPYCMKDBSOYOS-UHFFFAOYSA-N	0	3	333.435	3.081	20	30		EGEDHN
C=C[C@@H]1CCCCN1C(=O)Nc1cc(C)nn1C1CCN(C)CC1	ZINC000683788739	550261900	/nfs/dbraw/zinc/26/19/00/550261900.db2.gz	CYMIWPLNQKVLDB-OAHLLOKOSA-N	0	3	331.464	3.031	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H](c2ccccc2)N2CCC(C)CC2)nc1	ZINC000728861459	574779860	/nfs/dbraw/zinc/77/98/60/574779860.db2.gz	KHMVKTBNSAEKOV-OAQYLSRUSA-N	0	3	347.462	3.266	20	30		EGEDHN
C#CCNC(=O)[C@@H](C)NCC1(c2ccc(C(C)C)cc2)CCCC1	ZINC000731040946	575046051	/nfs/dbraw/zinc/04/60/51/575046051.db2.gz	RDCDJCRWUFPXGF-QGZVFWFLSA-N	0	3	326.484	3.349	20	30		EGEDHN
C#Cc1cccc(NC(=S)NC[C@@H](C)N(C)Cc2ccccc2)c1	ZINC000731941191	575220930	/nfs/dbraw/zinc/22/09/30/575220930.db2.gz	OVSWTFGBSACXIG-MRXNPFEDSA-N	0	3	337.492	3.475	20	30		EGEDHN
CC[NH+](CC)Cc1cc(C(C)N=Nc2cc(C)ncn2)ccc1[O-]	ZINC000731935409	575222650	/nfs/dbraw/zinc/22/26/50/575222650.db2.gz	XLAHOYWNRPSPKY-UHFFFAOYSA-N	0	3	327.432	3.169	20	30		EGEDHN
CN(C)CCOc1ccc(N(C)C(=O)C2(C#N)CCCCC2)cc1	ZINC000732006085	575230878	/nfs/dbraw/zinc/23/08/78/575230878.db2.gz	MBRIZGSEWJPYOZ-UHFFFAOYSA-N	0	3	329.444	3.064	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)CO[C@@H]2CCC[C@@H](C)C2)c1	ZINC000733053058	575303744	/nfs/dbraw/zinc/30/37/44/575303744.db2.gz	INSSIBAEPIYPRB-DJIMGWMZSA-N	0	3	328.412	3.238	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)CO[C@H]2CCCC[C@H]2C)c1	ZINC000733679429	575381328	/nfs/dbraw/zinc/38/13/28/575381328.db2.gz	ZQFWGZQCHAJFQC-KYJSFNMBSA-N	0	3	328.412	3.238	20	30		EGEDHN
CCN(CC(=O)/C=C1/N(C)c2ccccc2C1(C)C)C[C@@H]1CCOC1	ZINC000734149458	575443078	/nfs/dbraw/zinc/44/30/78/575443078.db2.gz	NEKQMZXNQDGIEO-DORSJAEJSA-N	0	3	342.483	3.225	20	30		EGEDHN
C#Cc1ccc(C(=O)Nc2ccc(OCCN3CCCC3)c(C)c2)nc1	ZINC000736246862	575922878	/nfs/dbraw/zinc/92/28/78/575922878.db2.gz	OCLXXEHOWJRAAU-UHFFFAOYSA-N	0	3	349.434	3.098	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)c2cc3occc3s2)cc1	ZINC000737322869	576205526	/nfs/dbraw/zinc/20/55/26/576205526.db2.gz	MTDZZMCQZVDKCO-GFCCVEGCSA-N	0	3	340.360	3.464	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)C[C@H]2CCOC2)cc1	ZINC000740536476	576594406	/nfs/dbraw/zinc/59/44/06/576594406.db2.gz	UPYOPANDNFKEHV-WBVHZDCISA-N	0	3	328.412	3.103	20	30		EGEDHN
C#CCCN1CCC(NC(=O)Cc2coc3cc(C)c(C)cc23)CC1	ZINC000740736403	576621682	/nfs/dbraw/zinc/62/16/82/576621682.db2.gz	SFSKHLZIQZQFSP-UHFFFAOYSA-N	0	3	338.451	3.196	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2cc3c(s2)CC[C@H](C)C3)CC1	ZINC000740737594	576621735	/nfs/dbraw/zinc/62/17/35/576621735.db2.gz	SDOKBNDOIMNUCY-AWEZNQCLSA-N	0	3	330.497	3.090	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2cccc3c4c([nH]c32)CCCC4)CC1	ZINC000740737568	576621747	/nfs/dbraw/zinc/62/17/47/576621747.db2.gz	RBKNVCDXBJAQFB-UHFFFAOYSA-N	0	3	349.478	3.264	20	30		EGEDHN
CC(C)CN(CCC#N)CC(=O)C(C#N)c1nc2ccccc2s1	ZINC000740878711	576632816	/nfs/dbraw/zinc/63/28/16/576632816.db2.gz	UJZBSTLSLBFPBA-CQSZACIVSA-N	0	3	340.452	3.344	20	30		EGEDHN
C[C@@H]1CC(N=Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCN1C	ZINC000741451928	576687400	/nfs/dbraw/zinc/68/74/00/576687400.db2.gz	QRNHFHXIJZNJAK-SECBINFHSA-N	0	3	330.310	3.496	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H]1CCN(C(=O)/C=C\c2ccccc2C#N)C1	ZINC000742794405	576795623	/nfs/dbraw/zinc/79/56/23/576795623.db2.gz	WWVAKVGLTXAPHD-AXUYNXDZSA-N	0	3	345.446	3.304	20	30		EGEDHN
N#Cc1cc([N+](=O)[O-])cnc1NC[C@@H](c1ccccc1)N1CCCC1	ZINC000743144193	576802222	/nfs/dbraw/zinc/80/22/22/576802222.db2.gz	XWROFPHXPKHLEO-KRWDZBQOSA-N	0	3	337.383	3.110	20	30		EGEDHN
C#CCOc1cc(F)ccc1NC(=O)N[C@@H](C)CN1CCC[C@@H](C)C1	ZINC000743199578	576803218	/nfs/dbraw/zinc/80/32/18/576803218.db2.gz	HMMHFQIBJCMVQG-CABCVRRESA-N	0	3	347.434	3.080	20	30		EGEDHN
C[C@H](C(=O)C(C#N)C(=O)Nc1ccccn1)c1cccc(Cl)c1	ZINC000744039386	576819362	/nfs/dbraw/zinc/81/93/62/576819362.db2.gz	OGIPDKUNBOFVRF-SMDDNHRTSA-N	0	3	327.771	3.186	20	30		EGEDHN
C#CCN(Cc1ccc(F)cc1)C(=O)NC[C@@H](C)N1CCC[C@H](C)C1	ZINC000744843325	576835471	/nfs/dbraw/zinc/83/54/71/576835471.db2.gz	HPZFEZGGUJJQQI-DLBZAZTESA-N	0	3	345.462	3.091	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@H]1C[C@@H]1c1cccc(F)c1F	ZINC000076818378	1292444186	/nfs/dbraw/zinc/44/41/86/1292444186.db2.gz	WTXJMJUAWJQLKO-QLFBSQMISA-N	0	3	348.393	3.474	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)[C@H](C)c1ccccc1F	ZINC000109038807	1293085680	/nfs/dbraw/zinc/08/56/80/1293085680.db2.gz	OUBNIDOCHZPDJT-TZMCWYRMSA-N	0	3	340.354	3.285	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)CC1	ZINC000112115444	1293118460	/nfs/dbraw/zinc/11/84/60/1293118460.db2.gz	CPEWRPHFRWRGPW-UHFFFAOYSA-N	0	3	337.807	3.019	20	30		EGEDHN
C=CCN1CCC(N[C@H](C)c2nc(Br)cs2)CC1	ZINC000834571405	1293118905	/nfs/dbraw/zinc/11/89/05/1293118905.db2.gz	SIXJNXUKKFRLIY-SNVBAGLBSA-N	0	3	330.295	3.207	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)CCCC(=O)C(C)(C)C	ZINC000835064141	1293197013	/nfs/dbraw/zinc/19/70/13/1293197013.db2.gz	BQNGWPNDPUGJSB-CYBMUJFWSA-N	0	3	344.411	3.128	20	30		EGEDHN
CC(=O)N[C@H](C(=O)C(C#N)c1nc2cc(F)ccc2s1)C(C)(C)C	ZINC000835144143	1293218828	/nfs/dbraw/zinc/21/88/28/1293218828.db2.gz	BMTFHBMFPQUIFO-IAQYHMDHSA-N	0	3	347.415	3.162	20	30		EGEDHN
C[C@H]1[C@H](OC(=O)c2ccc(C#N)n2C)CCCN1Cc1ccccc1	ZINC000835480412	1293299891	/nfs/dbraw/zinc/29/98/91/1293299891.db2.gz	IMRJXRWPAATPMA-HNAYVOBHSA-N	0	3	337.423	3.107	20	30		EGEDHN
C[C@H]1[C@@H](OC(=O)c2ccc(C#N)n2C)CCCN1Cc1ccccc1	ZINC000835480414	1293300076	/nfs/dbraw/zinc/30/00/76/1293300076.db2.gz	IMRJXRWPAATPMA-KXBFYZLASA-N	0	3	337.423	3.107	20	30		EGEDHN
N#CC(C(=O)C[C@@H]1CCCCO1)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000120070933	1293303032	/nfs/dbraw/zinc/30/30/32/1293303032.db2.gz	PVPMLAGPRFDYST-RYUDHWBXSA-N	0	3	338.766	3.086	20	30		EGEDHN
N#CC(C(=O)CCCOCc1ccccc1)C(=O)Nc1ccccc1	ZINC000127655962	1293570141	/nfs/dbraw/zinc/57/01/41/1293570141.db2.gz	CKGSVLFELUNTKN-GOSISDBHSA-N	0	3	336.391	3.331	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)c1ccc(F)c(F)c1	ZINC000128957201	1293609308	/nfs/dbraw/zinc/60/93/08/1293609308.db2.gz	UURZJXSDEOYWBL-GFCCVEGCSA-N	0	3	344.317	3.325	20	30		EGEDHN
Cc1noc(C)c1[C@@H](C)C(=O)C(C#N)C(=O)Nc1cccc(C)c1	ZINC000159762920	1294246792	/nfs/dbraw/zinc/24/67/92/1294246792.db2.gz	DPBNESZZRZHDOB-IAQYHMDHSA-N	0	3	325.368	3.051	20	30		EGEDHN
C#Cc1cccc(NC(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)c1	ZINC000160348606	1294265801	/nfs/dbraw/zinc/26/58/01/1294265801.db2.gz	GICTXTZJPKIALU-OXQOHEQNSA-N	0	3	333.435	3.452	20	30		EGEDHN
C[C@@H](OC1CCCCCC1)C(=O)C(C#N)C(=O)NCc1ccccc1	ZINC000162392775	1294314859	/nfs/dbraw/zinc/31/48/59/1294314859.db2.gz	AVNJWXRFOJIYJM-CRAIPNDOSA-N	0	3	342.439	3.140	20	30		EGEDHN
C[C@@H](CCOc1ccccc1)C(=O)C(C#N)C(=O)Nc1ccccc1	ZINC000173968229	1294474643	/nfs/dbraw/zinc/47/46/43/1294474643.db2.gz	YUBYLPYMXQYZDJ-MAUKXSAKSA-N	0	3	336.391	3.439	20	30		EGEDHN
C[C@@H](CCc1cccc(F)c1)C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000174012065	1294477086	/nfs/dbraw/zinc/47/70/86/1294477086.db2.gz	UFEIKKFEDXMBSQ-BBRMVZONSA-N	0	3	339.370	3.137	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)C[C@H](C)c1ccc(OC)cc1	ZINC000175096178	1294539199	/nfs/dbraw/zinc/53/91/99/1294539199.db2.gz	BKIXOJUGAGYYRX-YOEHRIQHSA-N	0	3	330.428	3.204	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)CC[C@@H]2CCOC2)cc1	ZINC000176092194	1294590061	/nfs/dbraw/zinc/59/00/61/1294590061.db2.gz	HLMFXTHRWZAEFR-AEFFLSMTSA-N	0	3	342.439	3.493	20	30		EGEDHN
CC(C)N1CCN(c2ccc(C(=O)OCC3(CC#N)CC3)cc2)CC1	ZINC000183657018	1295134411	/nfs/dbraw/zinc/13/44/11/1295134411.db2.gz	JKSFHXDEOSBCDK-UHFFFAOYSA-N	0	3	341.455	3.068	20	30		EGEDHN
Cc1noc(C)c1[C@H](C)C(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1	ZINC000195491934	1296072859	/nfs/dbraw/zinc/07/28/59/1296072859.db2.gz	IRNNAGRMJSFJEC-LKFCYVNXSA-N	0	3	345.786	3.396	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CNCc2ccc(N3CCCC3)nc2)cc1	ZINC000237494312	1296245281	/nfs/dbraw/zinc/24/52/81/1296245281.db2.gz	ITEHGKITRQUQSY-INIZCTEOSA-N	0	3	336.439	3.262	20	30		EGEDHN
N#CC(C(=O)NC1CCCCC1)C(=O)[C@@H]1C[C@@H]1c1c(F)cccc1F	ZINC000247010117	1296380401	/nfs/dbraw/zinc/38/04/01/1296380401.db2.gz	MHQAZSZFZMZVDR-MJBXVCDLSA-N	0	3	346.377	3.226	20	30		EGEDHN
CC(C)CN(C(=O)/C=C\c1ccccc1C#N)C1CCN(C)CC1	ZINC000255515518	1296541028	/nfs/dbraw/zinc/54/10/28/1296541028.db2.gz	SDVZTXFUKSHFJD-HJWRWDBZSA-N	0	3	325.456	3.150	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]\C2CCC3(CC2)OCCO3)c([O-])c1	ZINC000255713139	1296563208	/nfs/dbraw/zinc/56/32/08/1296563208.db2.gz	DTHXDNXFXDBNGF-ZHZULCJRSA-N	0	3	332.444	3.343	20	30		EGEDHN
N#Cc1ccc(OCCCN2CCN(Cc3ccccc3)CC2)cc1	ZINC000310315386	1297091481	/nfs/dbraw/zinc/09/14/81/1297091481.db2.gz	ZKZHRFVQHBTDGW-UHFFFAOYSA-N	0	3	335.451	3.145	20	30		EGEDHN
O=C(C#Cc1ccccc1)N1CCCN(CCCc2ccccc2)CC1	ZINC000747373208	1298771252	/nfs/dbraw/zinc/77/12/52/1298771252.db2.gz	XCYAXZWUMNYMSP-UHFFFAOYSA-N	0	3	346.474	3.205	20	30		EGEDHN
C=C(Cl)C[C@@H](N)C(=O)N(C)CCCc1cc(-c2ccccc2)no1	ZINC000876629924	1298882282	/nfs/dbraw/zinc/88/22/82/1298882282.db2.gz	PGCTULXDTMUUQS-MRXNPFEDSA-N	0	3	347.846	3.203	20	30		EGEDHN
CCN(CC)Cc1ccc(C(=O)OCc2cc(C#N)ccc2F)o1	ZINC000748801518	1299083255	/nfs/dbraw/zinc/08/32/55/1299083255.db2.gz	YCUUOVVSQNPLGE-UHFFFAOYSA-N	0	3	330.359	3.489	20	30		EGEDHN
CC(C)(C)OC(=O)NC1(CNCc2cccc(C#N)n2)CCCCC1	ZINC000876994166	1299105217	/nfs/dbraw/zinc/10/52/17/1299105217.db2.gz	BNINBAWOLYVIKB-UHFFFAOYSA-N	0	3	344.459	3.270	20	30		EGEDHN
C=C(Cl)C[C@H](N)C(=O)NCC1(c2cccc(Cl)c2)CCC1	ZINC000877240365	1299219005	/nfs/dbraw/zinc/21/90/05/1299219005.db2.gz	WDKZQJAFUUJPKN-AWEZNQCLSA-N	0	3	327.255	3.348	20	30		EGEDHN
C[C@@H]([NH2+][C@H](C)c1ccccc1[O-])C(=O)N(C)C1(C#N)CCC(C)CC1	ZINC000879648351	1300648086	/nfs/dbraw/zinc/64/80/86/1300648086.db2.gz	LBPGTLZUTIUHJC-KMFGOTIKSA-N	0	3	343.471	3.362	20	30		EGEDHN
CCN1CCN(c2ccc(NC(=O)c3ccc(CC#N)cc3)cc2)CC1	ZINC000758146133	1300795492	/nfs/dbraw/zinc/79/54/92/1300795492.db2.gz	QATZISCLUCLNKK-UHFFFAOYSA-N	0	3	348.450	3.147	20	30		EGEDHN
C#CCCCCNC(=O)N[C@H](CN1CCCCC1)c1ccccc1	ZINC000758784360	1300954555	/nfs/dbraw/zinc/95/45/55/1300954555.db2.gz	CWYGXTKRDNKNOF-LJQANCHMSA-N	0	3	327.472	3.316	20	30		EGEDHN
N#Cc1c(NC(=O)CCN2CCC(F)CC2)sc2c1CCCC2	ZINC000880243006	1300999822	/nfs/dbraw/zinc/99/98/22/1300999822.db2.gz	BRCCXZUHLXFMTJ-UHFFFAOYSA-N	0	3	335.448	3.261	20	30		EGEDHN
C#CCCCC(=O)C(C#N)C(=O)Nc1cc(C)c(Cl)cc1OC	ZINC000759432218	1301090760	/nfs/dbraw/zinc/09/07/60/1301090760.db2.gz	TVJVQIFKUKOZRP-GFCCVEGCSA-N	0	3	332.787	3.108	20	30		EGEDHN
CN(CCOc1ccccc1C#N)CC(C)(C)NC(=O)OC(C)(C)C	ZINC000761197298	1301418803	/nfs/dbraw/zinc/41/88/03/1301418803.db2.gz	CFWKABDYXHGEKJ-UHFFFAOYSA-N	0	3	347.459	3.172	20	30		EGEDHN
COc1ccc(CN=Nc2cnn(C)c2)cc1OCc1ccccc1	ZINC000761881230	1301561033	/nfs/dbraw/zinc/56/10/33/1301561033.db2.gz	MLHFWINEPGLDTL-UHFFFAOYSA-N	0	3	336.395	3.454	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN[C@@H]2CCOc3c(Cl)cccc32)cc1	ZINC000763235223	1301854107	/nfs/dbraw/zinc/85/41/07/1301854107.db2.gz	JMSDTQDKFHFWBN-IAGOWNOFSA-N	0	3	328.799	3.358	20	30		EGEDHN
C[C@H]1CN(C[C@H](O)COc2ccc(CC#N)cc2)Cc2ccccc21	ZINC000763628388	1301936377	/nfs/dbraw/zinc/93/63/77/1301936377.db2.gz	JHXMRATWOAJNCL-LPHOPBHVSA-N	0	3	336.435	3.112	20	30		EGEDHN
N#Cc1ccccc1NC(=S)N1CCN(C2CCCCC2)CC1	ZINC000764500547	1302075955	/nfs/dbraw/zinc/07/59/55/1302075955.db2.gz	RCWHLLZHQXZKCB-UHFFFAOYSA-N	0	3	328.485	3.205	20	30		EGEDHN
C#CCN(C(=O)N[C@@H](CN1CCCCC1)c1ccccc1)C1CC1	ZINC000764728068	1302124455	/nfs/dbraw/zinc/12/44/55/1302124455.db2.gz	MYMVWRPQFUMKJA-IBGZPJMESA-N	0	3	325.456	3.021	20	30		EGEDHN
CC[C@H](NCc1ccc(N2CCNC2=O)cc1)c1ccc(C#N)cc1	ZINC000883287435	1302366166	/nfs/dbraw/zinc/36/61/66/1302366166.db2.gz	VGDHSKABBUAMPR-IBGZPJMESA-N	0	3	334.423	3.329	20	30		EGEDHN
C#CCCN(CC(F)(F)F)C(=O)Nc1cccc(CN(C)C)c1	ZINC000767222606	1302610314	/nfs/dbraw/zinc/61/03/14/1302610314.db2.gz	XTISTSBJNISJHI-UHFFFAOYSA-N	0	3	327.350	3.168	20	30		EGEDHN
CCN(CC)C(=O)[C@H](Cc1ccccc1)NCc1ccc(C#N)c(C)c1	ZINC000767667967	1302739539	/nfs/dbraw/zinc/73/95/39/1302739539.db2.gz	XGUQFEILJNUBKC-NRFANRHFSA-N	0	3	349.478	3.436	20	30		EGEDHN
S=C(NN=C1CCCC[C@@H]1N1CCCCC1)Nc1ccccn1	ZINC000767807260	1302767731	/nfs/dbraw/zinc/76/77/31/1302767731.db2.gz	XHKILHLJKLRRNR-HNNXBMFYSA-N	0	3	331.489	3.153	20	30		EGEDHN
CC1(C)CCCN(CCNC(=O)c2ccccc2SCC#N)C1	ZINC000768108192	1302823990	/nfs/dbraw/zinc/82/39/90/1302823990.db2.gz	DMCJZCWFRKDVSV-UHFFFAOYSA-N	0	3	331.485	3.154	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)[C@H](F)c1ccccc1	ZINC000769373916	1303101568	/nfs/dbraw/zinc/10/15/68/1303101568.db2.gz	UXDCNTZWKNCWSG-LJQANCHMSA-N	0	3	339.414	3.159	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)[C@H](F)c1ccccc1	ZINC000769375163	1303101607	/nfs/dbraw/zinc/10/16/07/1303101607.db2.gz	REIFKAPKITVTMW-LJQANCHMSA-N	0	3	339.414	3.159	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)[C@@H](F)c1ccccc1	ZINC000769375159	1303101709	/nfs/dbraw/zinc/10/17/09/1303101709.db2.gz	REIFKAPKITVTMW-IBGZPJMESA-N	0	3	339.414	3.159	20	30		EGEDHN
C#C[C@H](C)N(C)C[C@H](O)CO[C@H](c1ccccc1)c1ccc(C)cc1	ZINC000769962192	1303198987	/nfs/dbraw/zinc/19/89/87/1303198987.db2.gz	BZRYUILZZACUQG-YUXAGFNASA-N	0	3	337.463	3.415	20	30		EGEDHN
N#Cc1ccc(C(=O)OCC2CCN(Cc3ccco3)CC2)s1	ZINC000772683415	1303564011	/nfs/dbraw/zinc/56/40/11/1303564011.db2.gz	FWSWAYZVBHDYSB-UHFFFAOYSA-N	0	3	330.409	3.282	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/C[C@H]2COC3(CCCC3)O2)c([O-])c1	ZINC000773146800	1303633008	/nfs/dbraw/zinc/63/30/08/1303633008.db2.gz	CMMHWBMZRCZANG-RONKMWSCSA-N	0	3	332.444	3.343	20	30		EGEDHN
Cc1csc(CCC(=O)C(C#N)C(=O)Nc2ccccc2Cl)n1	ZINC000774056775	1303769863	/nfs/dbraw/zinc/76/98/63/1303769863.db2.gz	YQNVKKXUIDAIOT-NSHDSACASA-N	0	3	347.827	3.385	20	30		EGEDHN
CC(C)[C@@H](NCC(=O)NCCC#N)c1ccc(C(F)(F)F)cc1	ZINC000775537717	1303980931	/nfs/dbraw/zinc/98/09/31/1303980931.db2.gz	CZFVXQFJLZLMLZ-OAHLLOKOSA-N	0	3	327.350	3.022	20	30		EGEDHN
COc1ccc(OC)c([C@H](O)CN[C@@H](CCC#N)c2ccccc2)c1	ZINC000775554228	1303983856	/nfs/dbraw/zinc/98/38/56/1303983856.db2.gz	VXWAZFNNQJNKRP-RBUKOAKNSA-N	0	3	340.423	3.372	20	30		EGEDHN
C#C[C@H](N[C@@H](C)CC(=O)Nc1ccc(C)c(Cl)c1)[C@@H]1CCCO1	ZINC000775573686	1303987180	/nfs/dbraw/zinc/98/71/80/1303987180.db2.gz	JBNLBDPHCWHTEK-JQFCIGGWSA-N	0	3	334.847	3.136	20	30		EGEDHN
CC[C@H](C#N)Oc1cccc(CNCc2ccc(C(=O)OC)cc2)c1	ZINC000776185975	1304108366	/nfs/dbraw/zinc/10/83/66/1304108366.db2.gz	RMDSFWDKTHGLMH-GOSISDBHSA-N	0	3	338.407	3.444	20	30		EGEDHN
Cc1ccc(C)c(NC(=S)NN=Cc2cnccc2N(C)C)c1	ZINC000776183819	1304108434	/nfs/dbraw/zinc/10/84/34/1304108434.db2.gz	PVVBYIKWBBUYDK-UHFFFAOYSA-N	0	3	327.457	3.085	20	30		EGEDHN
CN(C)CCN(Cc1ccsc1)C(=O)Nc1cc(C#N)ccc1F	ZINC000888370366	1304136578	/nfs/dbraw/zinc/13/65/78/1304136578.db2.gz	GKMQKNLBFVHARG-UHFFFAOYSA-N	0	3	346.431	3.355	20	30		EGEDHN
CCC(CCc1ccc(Br)cc1)=NNC1=N[C@@H](C)CN1	ZINC000779792413	1304606575	/nfs/dbraw/zinc/60/65/75/1304606575.db2.gz	RGGDKFINBSVSSY-NSHDSACASA-N	0	3	337.265	3.085	20	30		EGEDHN
N#CC(C(=O)COc1ccc(-c2ccccc2)cc1)C(=O)N1CCCC1	ZINC000780301347	1304674109	/nfs/dbraw/zinc/67/41/09/1304674109.db2.gz	KYVWKLGOAJYUFJ-LJQANCHMSA-N	0	3	348.402	3.064	20	30		EGEDHN
C=CCCN(OCc1ccccc1)C(=O)N[C@@H]1C[C@@H](C)N(C2CC2)C1	ZINC000782976144	1305032714	/nfs/dbraw/zinc/03/27/14/1305032714.db2.gz	GVIDPABCEBOHRE-SJLPKXTDSA-N	0	3	343.471	3.331	20	30		EGEDHN
CCCCCCCCCN1CCC[C@H](N2CCCS2(=O)=O)C1	ZINC000789374376	1306149341	/nfs/dbraw/zinc/14/93/41/1306149341.db2.gz	LYECIEPMXTUPCA-KRWDZBQOSA-N	0	3	330.538	3.237	20	30		EGEDHN
CC(C)[C@H](CNCc1ccc(C#N)s1)ONC(=O)OC(C)(C)C	ZINC000895027763	1309162453	/nfs/dbraw/zinc/16/24/53/1309162453.db2.gz	ZAUOTLPRTOXCHD-AWEZNQCLSA-N	0	3	339.461	3.190	20	30		EGEDHN
CC(C)(CN1CC[C@](O)(CC#N)C1)c1ccc(Br)cc1	ZINC000895109830	1309193945	/nfs/dbraw/zinc/19/39/45/1309193945.db2.gz	XAKRNYMCBSQMFY-MRXNPFEDSA-N	0	3	337.261	3.077	20	30		EGEDHN
Cc1cc2ncn(CN3CC[C@@H](Oc4ccc(C#N)cn4)C3)c2cc1C	ZINC000793606970	1309415782	/nfs/dbraw/zinc/41/57/82/1309415782.db2.gz	MRZICUSGEMEHNG-QGZVFWFLSA-N	0	3	347.422	3.031	20	30		EGEDHN
COc1ccc([C@@H](NC(C)C)C(=O)NCC(C)(C)CCC#N)cc1	ZINC000897769187	1310461888	/nfs/dbraw/zinc/46/18/88/1310461888.db2.gz	AHIWZFUJDKSWJG-QGZVFWFLSA-N	0	3	331.460	3.180	20	30		EGEDHN
C[C@@H]1C[C@H](C)[C@@H](C(=O)C(C#N)C(=O)Nc2cccc3ccccc32)O1	ZINC000800384922	1310747639	/nfs/dbraw/zinc/74/76/39/1310747639.db2.gz	NGEPXWXBVUPQQG-AODNKKSCSA-N	0	3	336.391	3.301	20	30		EGEDHN
C[C@@H](N[C@@H]1CCc2ccccc2NC1=O)c1ccc(OCC#N)cc1	ZINC000839539405	1320935048	/nfs/dbraw/zinc/93/50/48/1320935048.db2.gz	MRKCHWRYVWTBCV-AUUYWEPGSA-N	0	3	335.407	3.193	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)Cc1ccc(Cl)s1	ZINC000802040673	1316975929	/nfs/dbraw/zinc/97/59/29/1316975929.db2.gz	JGJWKBFCVUNHRE-LLVKDONJSA-N	0	3	348.811	3.300	20	30		EGEDHN
CC1(C)CCC[C@@H]1C(=O)N1CC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001019255205	1317127591	/nfs/dbraw/zinc/12/75/91/1317127591.db2.gz	FGWPLTINLSXILX-DLBZAZTESA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3cnn(C(C)(C)C)c3)C2)CC1	ZINC001019331135	1317171427	/nfs/dbraw/zinc/17/14/27/1317171427.db2.gz	KCOTYVBVPZPYRV-SFHVURJKSA-N	0	3	344.503	3.075	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)C2CC(OCC)C2)cc1	ZINC000805856088	1317432012	/nfs/dbraw/zinc/43/20/12/1317432012.db2.gz	QWYSLGOGJPOBBB-VJFUWPCTSA-N	0	3	342.439	3.492	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@H](NC(=O)CC3CCCCC3)C2)c1	ZINC001019975295	1317482299	/nfs/dbraw/zinc/48/22/99/1317482299.db2.gz	WEVJJKOJPGFAET-IYARVYRRSA-N	0	3	343.446	3.405	20	30		EGEDHN
CCN(Cc1ccccc1C#N)CC1CCN(C(=O)C(C)(C)F)CC1	ZINC000957660896	1317530810	/nfs/dbraw/zinc/53/08/10/1317530810.db2.gz	FMCLENTXBIKVDJ-UHFFFAOYSA-N	0	3	345.462	3.367	20	30		EGEDHN
CCN(Cc1ccccc1C#N)CC1CCN(C(=O)C2CCC2)CC1	ZINC000957662360	1317532523	/nfs/dbraw/zinc/53/25/23/1317532523.db2.gz	CISJFXJFWGFOOP-UHFFFAOYSA-N	0	3	339.483	3.419	20	30		EGEDHN
CCN(Cc1ccccc1C#N)CC1CCN(C(=O)[C@H]2C[C@H]2C)CC1	ZINC000957670487	1317541606	/nfs/dbraw/zinc/54/16/06/1317541606.db2.gz	UWNYFCGNOPLQKI-UZLBHIALSA-N	0	3	339.483	3.275	20	30		EGEDHN
C#Cc1cncc(C(=O)N(CC)[C@H]2CCN([C@@H](C)c3ccccc3)C2)c1	ZINC000807071657	1317548447	/nfs/dbraw/zinc/54/84/47/1317548447.db2.gz	QRXXQBXAGBPAIQ-UWJYYQICSA-N	0	3	347.462	3.361	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H]2[C@@H](c3ccccc3)C2(C)C)C1	ZINC001020161062	1317568745	/nfs/dbraw/zinc/56/87/45/1317568745.db2.gz	WBLHXACEZZEAMV-VQHPVUNQSA-N	0	3	332.875	3.416	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H](CN(C)C)c2ccc(F)cc2)cc1C#N	ZINC000807703985	1317578174	/nfs/dbraw/zinc/57/81/74/1317578174.db2.gz	QIBLOAHYJBIELI-GOSISDBHSA-N	0	3	325.387	3.039	20	30		EGEDHN
C[C@H]1CCC[C@@H]1CC(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001020186386	1317582065	/nfs/dbraw/zinc/58/20/65/1317582065.db2.gz	OPYRCVDDEAQRDA-DHXZDTOLSA-N	0	3	343.446	3.260	20	30		EGEDHN
C#C[C@H](NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)C(C)(C)C	ZINC000807882067	1317598475	/nfs/dbraw/zinc/59/84/75/1317598475.db2.gz	ICEYWTWNDFXDLV-AEFFLSMTSA-N	0	3	330.447	3.202	20	30		EGEDHN
CN(C)CCN1c2ccccc2C(=NNc2ccccc2Cl)C1=O	ZINC000807944379	1317602772	/nfs/dbraw/zinc/60/27/72/1317602772.db2.gz	YJRBTHWYXLAZFC-UHFFFAOYSA-N	0	3	342.830	3.064	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC(CN(CC)Cc3cnoc3C)CC2)C1	ZINC000957751197	1317618947	/nfs/dbraw/zinc/61/89/47/1317618947.db2.gz	OKGGCTHLFIIVOQ-UHFFFAOYSA-N	0	3	345.487	3.400	20	30		EGEDHN
C[C@H]1CCC[C@@H](C(=O)N[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)C1	ZINC001020524765	1317744281	/nfs/dbraw/zinc/74/42/81/1317744281.db2.gz	ZWHVWUDSXXDKIT-DHXZDTOLSA-N	0	3	343.446	3.260	20	30		EGEDHN
CC1(C)CC[C@@H](C(=O)N[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)C1	ZINC001020561860	1317773342	/nfs/dbraw/zinc/77/33/42/1317773342.db2.gz	MCMZSEFXLIXRDJ-DJIMGWMZSA-N	0	3	343.446	3.260	20	30		EGEDHN
C#Cc1ccc(CN[C@H](CC(C)C)C(=O)Nc2nccs2)cc1	ZINC000809629414	1317850898	/nfs/dbraw/zinc/85/08/98/1317850898.db2.gz	PBLHETSWLGXNRU-MRXNPFEDSA-N	0	3	327.453	3.267	20	30		EGEDHN
C#C[C@H](C)NCc1ccc(OCc2ccc([N+](=O)[O-])cc2)c(OC)c1	ZINC000809683735	1317861914	/nfs/dbraw/zinc/86/19/14/1317861914.db2.gz	MKOXCYFLUCKZEC-AWEZNQCLSA-N	0	3	340.379	3.294	20	30		EGEDHN
COC(=O)c1cccc(CNCc2ccc(N(C)CCC#N)cc2)c1	ZINC000809729581	1317882154	/nfs/dbraw/zinc/88/21/54/1317882154.db2.gz	KQEPGAXGYKNQSE-UHFFFAOYSA-N	0	3	337.423	3.113	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cnn(C(CC)CC)c2C)C1	ZINC001020900468	1317990091	/nfs/dbraw/zinc/99/00/91/1317990091.db2.gz	GHJAQWYFCLDUDA-HDJSIYSDSA-N	0	3	338.883	3.156	20	30		EGEDHN
CC[C@H](C)c1ccc(NC(=O)C(C#N)C(=O)c2cccc(C#N)n2)cc1	ZINC000810532366	1318019569	/nfs/dbraw/zinc/01/95/69/1318019569.db2.gz	CZPDDJLTHFBGAN-SUMWQHHRSA-N	0	3	346.390	3.428	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)c2sccc2CC)C1	ZINC001021088192	1318076675	/nfs/dbraw/zinc/07/66/75/1318076675.db2.gz	MONWTNZDKLLLEQ-HAQNSBGRSA-N	0	3	343.290	3.070	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc(-c3ccccc3)[nH]2)C1	ZINC001021126007	1318106219	/nfs/dbraw/zinc/10/62/19/1318106219.db2.gz	DTHATWGQVARROJ-SHTZXODSSA-N	0	3	329.831	3.285	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)C[C@@H]2C=CCC2)s1	ZINC000959875755	1318246109	/nfs/dbraw/zinc/24/61/09/1318246109.db2.gz	VVVOQMHIWIXAAG-CVEARBPZSA-N	0	3	343.496	3.447	20	30		EGEDHN
C#C[C@@H](NC(=O)NC[C@@H](c1cccs1)N1CCCC1)C(C)(C)C	ZINC000811992717	1318303857	/nfs/dbraw/zinc/30/38/57/1318303857.db2.gz	LSDKHJCZKHVJKT-GOEBONIOSA-N	0	3	333.501	3.232	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)C2CC3(CC3)C2)s1	ZINC000960126219	1318370877	/nfs/dbraw/zinc/37/08/77/1318370877.db2.gz	CZYLJCLTORZHRG-HNNXBMFYSA-N	0	3	343.496	3.281	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cccc2scnc21	ZINC000960261363	1318434891	/nfs/dbraw/zinc/43/48/91/1318434891.db2.gz	HPRCKNHUTUKWHW-SJLPKXTDSA-N	0	3	349.459	3.468	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1nc(C)sc1C	ZINC000960277178	1318439638	/nfs/dbraw/zinc/43/96/38/1318439638.db2.gz	AWNOCDDQTNNNLE-SJLPKXTDSA-N	0	3	341.480	3.321	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cccc(C(C)C)n1	ZINC000960282508	1318443382	/nfs/dbraw/zinc/44/33/82/1318443382.db2.gz	VXJQDCVXIVWQTE-WOJBJXKFSA-N	0	3	335.451	3.376	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cccc2ncccc21	ZINC000960292700	1318447567	/nfs/dbraw/zinc/44/75/67/1318447567.db2.gz	JYCVRQDDVILFKN-NHCUHLMSSA-N	0	3	343.430	3.406	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)C2C3CC4CC(C3)CC2C4)C1	ZINC001021607032	1318454363	/nfs/dbraw/zinc/45/43/63/1318454363.db2.gz	TYAUKTZMPTZSOK-FATNNQDHSA-N	0	3	340.511	3.005	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)Cc1ccc(CC)cn1	ZINC000960310039	1318454835	/nfs/dbraw/zinc/45/48/35/1318454835.db2.gz	ZIPIEMLGWTUSSV-IFMALSPDSA-N	0	3	349.478	3.134	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1sc(C)cc1OC	ZINC000960312360	1318456019	/nfs/dbraw/zinc/45/60/19/1318456019.db2.gz	LHOJGNKTSNVAOO-NVXWUHKLSA-N	0	3	342.464	3.237	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1nc(C2CC2)oc1C	ZINC000960318088	1318458964	/nfs/dbraw/zinc/45/89/64/1318458964.db2.gz	JYMXTLVTNKIHSI-SJLPKXTDSA-N	0	3	337.423	3.032	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)CC1CCC(OC)CC1	ZINC000960333029	1318466503	/nfs/dbraw/zinc/46/65/03/1318466503.db2.gz	KDIMCCGFJRNFOF-KZQZBHJTSA-N	0	3	342.483	3.140	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@@]1(C)CCc2ccccc21	ZINC000960334037	1318467804	/nfs/dbraw/zinc/46/78/04/1318467804.db2.gz	RPZYROPXZYPVOK-XPNTWCBSSA-N	0	3	346.474	3.448	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)Cc2c(C)cccc2Cl)C1	ZINC001021625377	1318475472	/nfs/dbraw/zinc/47/54/72/1318475472.db2.gz	PMFXIXUAXFHPOF-LPHOPBHVSA-N	0	3	344.886	3.137	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)C1CCCC1	ZINC000960356323	1318479026	/nfs/dbraw/zinc/47/90/26/1318479026.db2.gz	KRJBIGIJQTXLCH-LJQANCHMSA-N	0	3	325.456	3.171	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)Cc2cccc(C3CC3)c2)C1	ZINC001021635297	1318490692	/nfs/dbraw/zinc/49/06/92/1318490692.db2.gz	JMWRXDNBGPHQRS-SFTDATJTSA-N	0	3	336.479	3.053	20	30		EGEDHN
CCc1cccc(CC)c1NC(=O)C(C#N)C(=O)[C@H](C)[C@@H](C)COC	ZINC000813060061	1318492467	/nfs/dbraw/zinc/49/24/67/1318492467.db2.gz	ONSPFYOSCYHDFQ-JJRVBVJISA-N	0	3	344.455	3.377	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(C)c3cccnc23)C1	ZINC001021638935	1318496865	/nfs/dbraw/zinc/49/68/65/1318496865.db2.gz	KZGDKYORDMARSO-YLJYHZDGSA-N	0	3	347.462	3.103	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2csc3ccccc23)C1	ZINC001021642716	1318500212	/nfs/dbraw/zinc/50/02/12/1318500212.db2.gz	RWWMXVRDQUEOFG-MAUKXSAKSA-N	0	3	338.476	3.461	20	30		EGEDHN
N#Cc1ccc(OCC(=O)C(C#N)c2cc(C(F)(F)F)ccn2)cc1	ZINC000813211327	1318514808	/nfs/dbraw/zinc/51/48/08/1318514808.db2.gz	IGNCZGJGBYICKX-AWEZNQCLSA-N	0	3	345.280	3.227	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)Cc2cc(C)cc(C)c2)C1	ZINC001021666045	1318527374	/nfs/dbraw/zinc/52/73/74/1318527374.db2.gz	OBOVWMTWPVFBRB-NHCUHLMSSA-N	0	3	338.495	3.182	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(C)c(F)c2F)C1	ZINC001021673110	1318536168	/nfs/dbraw/zinc/53/61/68/1318536168.db2.gz	GEBPEQOKKPXKRL-NVXWUHKLSA-N	0	3	346.421	3.223	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2noc3c2CCCCC3)C1	ZINC001021677351	1318545452	/nfs/dbraw/zinc/54/54/52/1318545452.db2.gz	HTADHGSKQYQGKW-DOTOQJQBSA-N	0	3	343.471	3.056	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc3cccnc3c2)C1	ZINC001021693877	1318568227	/nfs/dbraw/zinc/56/82/27/1318568227.db2.gz	RVURTYHTNBWJAA-FPOVZHCZSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)CCc2cc(C)cc(C)c2)C1	ZINC001021708541	1318584261	/nfs/dbraw/zinc/58/42/61/1318584261.db2.gz	FIXDZINOESYPAU-NHCUHLMSSA-N	0	3	338.495	3.182	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2[nH]ccc2-c2ccccc2)C1	ZINC001021712865	1318590006	/nfs/dbraw/zinc/59/00/06/1318590006.db2.gz	LEHJRFGOAFPMGZ-UYAOXDASSA-N	0	3	347.462	3.241	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2oc(CC)cc2C)C1	ZINC001021717013	1318597546	/nfs/dbraw/zinc/59/75/46/1318597546.db2.gz	NPHIGLHIZQZTKE-FUHWJXTLSA-N	0	3	328.456	3.100	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc3c(c2)CCCC3)C1	ZINC001021726894	1318621280	/nfs/dbraw/zinc/62/12/80/1318621280.db2.gz	HNLXAGMAKFZVCN-NHCUHLMSSA-N	0	3	336.479	3.125	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)CCc2ccc(CC)cc2)C1	ZINC001021733295	1318638762	/nfs/dbraw/zinc/63/87/62/1318638762.db2.gz	LOHKNPNYHFKVPZ-SFTDATJTSA-N	0	3	338.495	3.128	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2sccc2CC)C1	ZINC001021738596	1318646232	/nfs/dbraw/zinc/64/62/32/1318646232.db2.gz	APUNPNODPINDQY-SJORKVTESA-N	0	3	330.497	3.260	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)C1CC(F)(F)C1	ZINC000960531469	1318651223	/nfs/dbraw/zinc/65/12/23/1318651223.db2.gz	AFPOOBAANAVLLA-KRWDZBQOSA-N	0	3	347.409	3.026	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cncc3ccccc32)C1	ZINC001021741130	1318652405	/nfs/dbraw/zinc/65/24/05/1318652405.db2.gz	ZCWLUFAYGGIIAD-WIYYLYMNSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(C)c3c2CCC3)C1	ZINC001021742053	1318654103	/nfs/dbraw/zinc/65/41/03/1318654103.db2.gz	BNRIUXVUTZPNGF-LAUBAEHRSA-N	0	3	336.479	3.043	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc3cc(C)ccc3o2)C1	ZINC001021742358	1318654938	/nfs/dbraw/zinc/65/49/38/1318654938.db2.gz	KGCMPKLJECJCDS-WMZOPIPTSA-N	0	3	336.435	3.301	20	30		EGEDHN
CN(Cc1ccc2ncccc2c1)C[C@H]1CCCN1C(=O)C#CC1CC1	ZINC000960628256	1318754449	/nfs/dbraw/zinc/75/44/49/1318754449.db2.gz	VLFQFKUMPPDDEH-HXUWFJFHSA-N	0	3	347.462	3.071	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)[C@@H]2CCCC3(CC3)C2)C1	ZINC001022075982	1318791274	/nfs/dbraw/zinc/79/12/74/1318791274.db2.gz	UMIOFMUPMSHHTA-MCIONIFRSA-N	0	3	341.293	3.102	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)[C@@H]2CCC(C)=C(C)C2)C1	ZINC001022130177	1318809280	/nfs/dbraw/zinc/80/92/80/1318809280.db2.gz	ZSBCOSYQTQQORN-KFWWJZLASA-N	0	3	341.293	3.268	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1cc(C(F)(F)F)ccc1NC(C)=O	ZINC000912257713	1318855426	/nfs/dbraw/zinc/85/54/26/1318855426.db2.gz	CEYNBCLCAUDODW-LBPRGKRZSA-N	0	3	343.349	3.286	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)[C@]1(C)C=CCC1	ZINC000960792582	1318898548	/nfs/dbraw/zinc/89/85/48/1318898548.db2.gz	QPNPCJMURQNGPX-PZJWPPBQSA-N	0	3	337.467	3.337	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)Cc2ccc(CC(C)C)cc2)C1	ZINC001022384935	1318916443	/nfs/dbraw/zinc/91/64/43/1318916443.db2.gz	GWGNAFXJHWZJIL-HDICACEKSA-N	0	3	334.891	3.417	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc3cc(C)ccc3n2)C1	ZINC001022405257	1318926507	/nfs/dbraw/zinc/92/65/07/1318926507.db2.gz	LGSQHKIPIYEHMK-GASCZTMLSA-N	0	3	329.831	3.146	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2coc3ccc(OC)cc23)C1	ZINC001022409869	1318927601	/nfs/dbraw/zinc/92/76/01/1318927601.db2.gz	GSVZSTSHPDXVNJ-TXEJJXNPSA-N	0	3	334.803	3.044	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)[C@H]1C[C@H]2C[C@H]2C1	ZINC000960810318	1318928149	/nfs/dbraw/zinc/92/81/49/1318928149.db2.gz	RIZJIRGAYUSETI-FUMNGEBKSA-N	0	3	337.467	3.027	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)Cc2cccc(C)c2Cl)C1	ZINC001022421881	1318933839	/nfs/dbraw/zinc/93/38/39/1318933839.db2.gz	ZPJIVEXBZJPAPB-OKILXGFUSA-N	0	3	327.255	3.180	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc3cc(Cl)ccc3[nH]2)C1	ZINC001022525662	1318976566	/nfs/dbraw/zinc/97/65/66/1318976566.db2.gz	RKVQXVQMDIEOJR-BETUJISGSA-N	0	3	338.238	3.424	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]2CN(C)Cc2cccc(C#N)c2)C1	ZINC000960845860	1318981809	/nfs/dbraw/zinc/98/18/09/1318981809.db2.gz	HIIGVHCZKWSNGD-LJQANCHMSA-N	0	3	337.467	3.337	20	30		EGEDHN
C[C@H]1CC[C@H](CC(=O)N[C@H]2C[C@@H](NCc3ccc(C#N)cc3F)C2)C1	ZINC001022563363	1318993225	/nfs/dbraw/zinc/99/32/25/1318993225.db2.gz	GPVYUBJLVVSNSR-DFEHZGFQSA-N	0	3	343.446	3.260	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CCC[C@H]1CN(C)Cc1ccc(C#N)cc1	ZINC000960904474	1319047349	/nfs/dbraw/zinc/04/73/49/1319047349.db2.gz	GSXNVPOQLWMTFY-APWZRJJASA-N	0	3	327.472	3.273	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)[C@@H]1C[C@H]1C1CC1	ZINC000960916247	1319062441	/nfs/dbraw/zinc/06/24/41/1319062441.db2.gz	DWNQVJLHTASLJK-SLFFLAALSA-N	0	3	337.467	3.027	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)[C@H]1CC12CCC2	ZINC000960916425	1319062460	/nfs/dbraw/zinc/06/24/60/1319062460.db2.gz	XNZCABKAZOAKJB-RBUKOAKNSA-N	0	3	337.467	3.171	20	30		EGEDHN
CO[C@@H]1CCC[C@@H](C(=O)C(C#N)C(=O)Nc2ccccc2Cl)C1	ZINC000815907443	1319071651	/nfs/dbraw/zinc/07/16/51/1319071651.db2.gz	ATKOKONCOPEKHQ-JHJVBQTASA-N	0	3	334.803	3.193	20	30		EGEDHN
Cc1nc(C(=O)C(C#N)C(=O)Nc2cccc3ccccc32)c(C)o1	ZINC000815908617	1319072659	/nfs/dbraw/zinc/07/26/59/1319072659.db2.gz	GASQQYJCKKZIMV-HNNXBMFYSA-N	0	3	333.347	3.406	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001022738998	1319083985	/nfs/dbraw/zinc/08/39/85/1319083985.db2.gz	IKLURWYUEGVBFS-NRSFXHEJSA-N	0	3	343.446	3.116	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)[C@H]2CCCC[C@H]2CC)C1	ZINC001022904216	1319156192	/nfs/dbraw/zinc/15/61/92/1319156192.db2.gz	HOFUYXDTYYQADA-KBXIAJHMSA-N	0	3	343.309	3.348	20	30		EGEDHN
O=C(C1CC1)N1CCC[C@H]([C@H]2CCN(CC#Cc3ccccc3)C2)C1	ZINC000961075757	1319185801	/nfs/dbraw/zinc/18/58/01/1319185801.db2.gz	FEKHOAINCOHCDA-SFTDATJTSA-N	0	3	336.479	3.009	20	30		EGEDHN
CCCC(=O)N1CCC[C@@H]([C@@H]2CCN(Cc3ccc(C#N)s3)C2)C1	ZINC000961102363	1319213320	/nfs/dbraw/zinc/21/33/20/1319213320.db2.gz	TZPBWLYZTUBKCY-HZPDHXFCSA-N	0	3	345.512	3.480	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)C[C@H]2CCCC[C@@H]2C)C1	ZINC001023152221	1319297307	/nfs/dbraw/zinc/29/73/07/1319297307.db2.gz	QYDYWDKODGLSCC-PMOUVXMZSA-N	0	3	343.309	3.348	20	30		EGEDHN
Cc1cc(C(=O)NC[C@H]2CCCN(Cc3cccc(C#N)c3)C2)co1	ZINC001023323071	1319448217	/nfs/dbraw/zinc/44/82/17/1319448217.db2.gz	FNOVCMMFWZYCIK-GOSISDBHSA-N	0	3	337.423	3.102	20	30		EGEDHN
CC(=O)N1CCC([C@@H]2CCCN(Cc3ccc(C#N)cc3F)C2)CC1	ZINC000961308825	1319467717	/nfs/dbraw/zinc/46/77/17/1319467717.db2.gz	TYDUMZULBYMCJT-GOSISDBHSA-N	0	3	343.446	3.168	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc3sccc3s2)C1	ZINC001023444211	1319541320	/nfs/dbraw/zinc/54/13/20/1319541320.db2.gz	FVFANPSCTPYVSD-ZDUSSCGKSA-N	0	3	332.494	3.428	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc(C)n(C(CC)CC)n2)C1	ZINC001023453712	1319556265	/nfs/dbraw/zinc/55/62/65/1319556265.db2.gz	GEOKVBYMYBHQSL-QGZVFWFLSA-N	0	3	344.503	3.018	20	30		EGEDHN
C#CCN(C)CCCNC(=O)[C@@H](SCc1ccccc1)C(C)C	ZINC000818588777	1319564063	/nfs/dbraw/zinc/56/40/63/1319564063.db2.gz	GLHWUCXDZWPXNF-SFHVURJKSA-N	0	3	332.513	3.016	20	30		EGEDHN
C#CCN(C)CCCNC(=O)C1(c2cccc(Cl)c2)CCCC1	ZINC000818584829	1319564182	/nfs/dbraw/zinc/56/41/82/1319564182.db2.gz	YMXRKIWGFXZMPI-UHFFFAOYSA-N	0	3	332.875	3.223	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2[C@H]3CN(Cc4cc(F)ccc4C)C[C@H]32)CC1	ZINC000961675794	1319691056	/nfs/dbraw/zinc/69/10/56/1319691056.db2.gz	OCEPROBRDNBKNK-PMOLBWCYSA-N	0	3	342.458	3.427	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2[C@H]3CN([C@@H](C)c4ccc(F)cc4)C[C@H]32)C1	ZINC000961687449	1319698269	/nfs/dbraw/zinc/69/82/69/1319698269.db2.gz	MZAOOMCJKOUZRZ-VIBAHUMZSA-N	0	3	328.431	3.289	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc(F)c3ccccc23)C1	ZINC001023609861	1319724248	/nfs/dbraw/zinc/72/42/48/1319724248.db2.gz	VRXYNDIZNIWMAR-INIZCTEOSA-N	0	3	338.426	3.444	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)CCC(=O)c1ccc2ccccc2c1	ZINC000916944910	1319727383	/nfs/dbraw/zinc/72/73/83/1319727383.db2.gz	BKIDMWWARKPSGS-KRWDZBQOSA-N	0	3	336.391	3.036	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc(C(C)(C)C)oc2C)C1	ZINC001023621141	1319741927	/nfs/dbraw/zinc/74/19/27/1319741927.db2.gz	HZQGJHZMOAEZCH-MRXNPFEDSA-N	0	3	330.472	3.351	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(Cc2ccccn2)CC(C)C)CC1	ZINC000917098417	1319757900	/nfs/dbraw/zinc/75/79/00/1319757900.db2.gz	XIOZYLYPBYXOGA-UHFFFAOYSA-N	0	3	344.503	3.290	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NC[C@H]1CCCN(Cc2ccsc2)C1	ZINC001023643214	1319764061	/nfs/dbraw/zinc/76/40/61/1319764061.db2.gz	RRMCVYQZOPJEFT-NJAFHUGGSA-N	0	3	348.512	3.058	20	30		EGEDHN
C#CCN1CCC[C@@H](CNC(=O)c2cccc(Cl)c2Cl)C1	ZINC001023717020	1319849895	/nfs/dbraw/zinc/84/98/95/1319849895.db2.gz	AEKAVJUFAKOBFH-LBPRGKRZSA-N	0	3	325.239	3.068	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc(F)c(F)cc2Cl)C1	ZINC001023733845	1319874067	/nfs/dbraw/zinc/87/40/67/1319874067.db2.gz	TVJYMEFYNWAXHE-GFCCVEGCSA-N	0	3	340.801	3.083	20	30		EGEDHN
C=C1CCC(C(=O)NC2CC(CNCc3ccccc3C#N)C2)CC1	ZINC000962259456	1319886633	/nfs/dbraw/zinc/88/66/33/1319886633.db2.gz	IQKPMTCPXOJQAM-UHFFFAOYSA-N	0	3	337.467	3.289	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2c[nH]c3c2cccc3CC)C1	ZINC001023763721	1319910056	/nfs/dbraw/zinc/91/00/56/1319910056.db2.gz	ZIPPFDRGIIKXDU-INIZCTEOSA-N	0	3	337.467	3.195	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc(-c3ccccc3)co2)C1	ZINC001023785165	1319932000	/nfs/dbraw/zinc/93/20/00/1319932000.db2.gz	GLQMFOLNKMOXOG-KRWDZBQOSA-N	0	3	336.435	3.412	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCN(C(=O)C[C@H]2C=CCC2)C1	ZINC001023831493	1319975631	/nfs/dbraw/zinc/97/56/31/1319975631.db2.gz	MWXPJIIHANPXFH-ROUUACIJSA-N	0	3	337.467	3.243	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001023853973	1319989971	/nfs/dbraw/zinc/98/99/71/1319989971.db2.gz	AMTBAPQXTKPJNB-CABCVRRESA-N	0	3	331.435	3.072	20	30		EGEDHN
Cc1nc(C2CC2)ccc1C(=O)C(C#N)c1nnc2n1CCCCC2	ZINC000821621002	1320023259	/nfs/dbraw/zinc/02/32/59/1320023259.db2.gz	CKUZRSRBCNJLPZ-OAHLLOKOSA-N	0	3	335.411	3.075	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2cc(C#N)ccc2F)C1	ZINC000823268942	1320166939	/nfs/dbraw/zinc/16/69/39/1320166939.db2.gz	SXNYMBHKNVHKTC-PBHICJAKSA-N	0	3	337.398	3.263	20	30		EGEDHN
Cc1ccc(C(=O)N2c3ccccc3CC[C@@H]2CN(C)C)cc1C#N	ZINC000823906210	1320215784	/nfs/dbraw/zinc/21/57/84/1320215784.db2.gz	VVNPHSUIDBBELZ-LJQANCHMSA-N	0	3	333.435	3.390	20	30		EGEDHN
CC(C)C#CC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1	ZINC000824379072	1320252466	/nfs/dbraw/zinc/25/24/66/1320252466.db2.gz	FPNCVVTZLWEEKL-UHFFFAOYSA-N	0	3	340.389	3.255	20	30		EGEDHN
C#C[C@H](NC(=O)NC[C@H](N[C@H](C)CC)c1ccco1)c1ccccc1	ZINC000827067704	1320424478	/nfs/dbraw/zinc/42/44/78/1320424478.db2.gz	QTJFIACWYJQYOX-NJAFHUGGSA-N	0	3	339.439	3.383	20	30		EGEDHN
C#Cc1cccc(CNC(=O)NC[C@H](N[C@H](C)CC)c2ccco2)c1	ZINC000838587911	1320793208	/nfs/dbraw/zinc/79/32/08/1320793208.db2.gz	RXAVAFBDMMGLBS-QAPCUYQASA-N	0	3	339.439	3.190	20	30		EGEDHN
Cc1ccc(CN2CC[C@H](CNC(=O)OC(C)(C)C)C2)cc1C#N	ZINC000859113329	1328925651	/nfs/dbraw/zinc/92/56/51/1328925651.db2.gz	YAZMNRHVDAJIPM-MRXNPFEDSA-N	0	3	329.444	3.213	20	30		EGEDHN
N#CC1(CCCCN(CCN2CCOCC2)Cc2ccco2)CCC1	ZINC000930669232	1328931800	/nfs/dbraw/zinc/93/18/00/1328931800.db2.gz	PMGBBVQZKBMELQ-UHFFFAOYSA-N	0	3	345.487	3.278	20	30		EGEDHN
CC1(C)OCC[C@H]1NN=C1CCN(C2CC2)[C@@H](c2ccccc2)C1	ZINC000841641855	1321290886	/nfs/dbraw/zinc/29/08/86/1321290886.db2.gz	XGFICTMHDMGVMN-RTBURBONSA-N	0	3	327.472	3.499	20	30		EGEDHN
CC[C@@H](OC1CCCC1)C(=O)C(C#N)C(=O)Nc1ccc(OC)cc1	ZINC000842290477	1321368302	/nfs/dbraw/zinc/36/83/02/1321368302.db2.gz	ZFJCMDMNLBRELS-DLBZAZTESA-N	0	3	344.411	3.080	20	30		EGEDHN
N#Cc1cc(COC(=O)c2cccc(CN3CCCCC3)c2)ccn1	ZINC000842317324	1321371083	/nfs/dbraw/zinc/37/10/83/1321371083.db2.gz	FSYOJXRVHBTXDQ-UHFFFAOYSA-N	0	3	335.407	3.296	20	30		EGEDHN
C[C@@H]1CC2(CN1Cn1ccc(-c3ccc(C#N)cc3)n1)CCOCC2	ZINC000842638385	1321411524	/nfs/dbraw/zinc/41/15/24/1321411524.db2.gz	KMIHEVCSJFVFMV-MRXNPFEDSA-N	0	3	336.439	3.270	20	30		EGEDHN
OCCN1CCC(N=Nc2ccc(Cl)c(C(F)(F)F)c2)CC1	ZINC000844606724	1321625798	/nfs/dbraw/zinc/62/57/98/1321625798.db2.gz	GLFLDCHDCUPTFB-UHFFFAOYSA-N	0	3	335.757	3.215	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN[C@H]2CCc3ccccc3NC2=O)cc1	ZINC000848561038	1321975907	/nfs/dbraw/zinc/97/59/07/1321975907.db2.gz	OKARNAXLSKZWLF-KUHUBIRLSA-N	0	3	335.407	3.021	20	30		EGEDHN
C#CCOc1ccc([C@@H](C)NCc2ccccc2CC(=O)OC)cc1	ZINC000848574434	1321978664	/nfs/dbraw/zinc/97/86/64/1321978664.db2.gz	RYKCJHOZMZVDNI-MRXNPFEDSA-N	0	3	337.419	3.265	20	30		EGEDHN
CC(C)[C@H](NCc1ccc(N(C)CCC#N)cc1)c1cnn(C)c1	ZINC000922894080	1322643000	/nfs/dbraw/zinc/64/30/00/1322643000.db2.gz	XOPNIZFCENUOSD-IBGZPJMESA-N	0	3	325.460	3.257	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@@H](CNCc2cc(F)ccc2C#N)C1)C1CC1	ZINC001023914909	1323021547	/nfs/dbraw/zinc/02/15/47/1323021547.db2.gz	DVKXOONCEIIQGB-CABCVRRESA-N	0	3	343.446	3.072	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H](CNCc2csc(C)n2)C1	ZINC001024090663	1323122980	/nfs/dbraw/zinc/12/29/80/1323122980.db2.gz	NVLWEWMLDJYANV-HNNXBMFYSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=CCC[N@H+]1CCC[C@@H]1[C@H]1CCCN(C(=O)c2ccccc2[O-])C1	ZINC000963252456	1323263355	/nfs/dbraw/zinc/26/33/55/1323263355.db2.gz	WBWMSUNDVPHEGL-FUHWJXTLSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=CCC[N@@H+]1CCC[C@@H]1[C@H]1CCCN(C(=O)c2ccccc2[O-])C1	ZINC000963252456	1323263365	/nfs/dbraw/zinc/26/33/65/1323263365.db2.gz	WBWMSUNDVPHEGL-FUHWJXTLSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cc(C)c(OC)c(C)c1	ZINC001024449896	1323407847	/nfs/dbraw/zinc/40/78/47/1323407847.db2.gz	HDCRGFOZFKSDPI-SFHVURJKSA-N	0	3	330.472	3.472	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cnn(C(C)(C)C)c1C	ZINC001024466466	1323421977	/nfs/dbraw/zinc/42/19/77/1323421977.db2.gz	GLDMTPFEEJBHPN-MRXNPFEDSA-N	0	3	332.492	3.107	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccc2oc(C)nc2c1	ZINC001024501632	1323449330	/nfs/dbraw/zinc/44/93/30/1323449330.db2.gz	GNSXHNOFNHMWAC-INIZCTEOSA-N	0	3	327.428	3.297	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1cc(C2CC2)[nH]c1C1CC1	ZINC001024509709	1323457536	/nfs/dbraw/zinc/45/75/36/1323457536.db2.gz	YBIZSIXVQDUDJI-QGZVFWFLSA-N	0	3	339.483	3.377	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cc(C)n([C@@H](C)CC)n1	ZINC001024517676	1323467545	/nfs/dbraw/zinc/46/75/45/1323467545.db2.gz	CQTGQCKZOUUNJD-DOTOQJQBSA-N	0	3	332.492	3.323	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1cc(F)cc2ccoc21	ZINC001024519943	1323469274	/nfs/dbraw/zinc/46/92/74/1323469274.db2.gz	ZXGQEKZIONZDAS-MRXNPFEDSA-N	0	3	328.387	3.180	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@@H]1Cc2cc(Cl)ccc2O1	ZINC001024537546	1323479181	/nfs/dbraw/zinc/47/91/81/1323479181.db2.gz	HEBLOLGGFDYIGN-WMZOPIPTSA-N	0	3	348.874	3.190	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)[C@@H]1C[C@H]1c1c(F)cccc1F	ZINC001024636578	1323563092	/nfs/dbraw/zinc/56/30/92/1323563092.db2.gz	UIHFDDOIAVCSFB-ARFHVFGLSA-N	0	3	346.421	3.062	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@H]2CCCCN2Cc2cccc(C)c2)c1	ZINC001024644332	1323569468	/nfs/dbraw/zinc/56/94/68/1323569468.db2.gz	OVGLEZZJCYZTLB-OAQYLSRUSA-N	0	3	347.462	3.156	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)NC[C@@H]1CCCCN1Cc1cccc(C)c1	ZINC001024659541	1323576525	/nfs/dbraw/zinc/57/65/25/1323576525.db2.gz	FBYWLIBPRNGRSA-ZCNNSNEGSA-N	0	3	342.483	3.057	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccccc1O[C@@H](C)CC	ZINC001024685829	1323602160	/nfs/dbraw/zinc/60/21/60/1323602160.db2.gz	NYWBVIUCVVYHTJ-ZWKOTPCHSA-N	0	3	342.483	3.472	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)NC[C@@H]1CCCCN1CC=C(C)C	ZINC001024700789	1323614432	/nfs/dbraw/zinc/61/44/32/1323614432.db2.gz	GHATVTLXVVMFOW-FHWLQOOXSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccnc(O[C@H](C)CC)c1	ZINC001024746929	1323647204	/nfs/dbraw/zinc/64/72/04/1323647204.db2.gz	JGUDTTVJICYHKA-SJLPKXTDSA-N	0	3	345.487	3.419	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccnc(OC(C)C)c1	ZINC001024753984	1323655293	/nfs/dbraw/zinc/65/52/93/1323655293.db2.gz	KVOGNNOREYDIEA-QGZVFWFLSA-N	0	3	331.460	3.029	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)C2CCCC2)c(F)c1	ZINC001024842436	1323739731	/nfs/dbraw/zinc/73/97/31/1323739731.db2.gz	VRXPXAOXXHLENY-GOSISDBHSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCCC[C@@H]1CNCc1cncs1	ZINC001024975183	1323810378	/nfs/dbraw/zinc/81/03/78/1323810378.db2.gz	URXHKNDPWJVROY-CYBMUJFWSA-N	0	3	341.908	3.393	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCCC[C@@H]2CNCc2cnc(C)s2)C1	ZINC001025074947	1323876869	/nfs/dbraw/zinc/87/68/69/1323876869.db2.gz	VCUCPHWOOMBTCG-OAHLLOKOSA-N	0	3	333.501	3.279	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@H]2[C@@H]2CCCCN2C(=O)C(F)F)c1	ZINC001025182799	1323949816	/nfs/dbraw/zinc/94/98/16/1323949816.db2.gz	GXBADXOEMJTJGW-SJORKVTESA-N	0	3	347.409	3.169	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)CCc1ccoc1	ZINC001025217471	1324009218	/nfs/dbraw/zinc/00/92/18/1324009218.db2.gz	DCAJGNBYDAKGCK-MOPGFXCFSA-N	0	3	328.456	3.081	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccoc1CC	ZINC001025228999	1324016186	/nfs/dbraw/zinc/01/61/86/1324016186.db2.gz	FMVFVEMTDIZCBQ-QZTJIDSGSA-N	0	3	328.456	3.324	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1c(C)coc1C	ZINC001025230654	1324017213	/nfs/dbraw/zinc/01/72/13/1324017213.db2.gz	YMUIJQUNNBZGAT-QZTJIDSGSA-N	0	3	328.456	3.379	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccn(C(C)(C)C)n1	ZINC001025234843	1324022914	/nfs/dbraw/zinc/02/29/14/1324022914.db2.gz	LJVKZTUKXDFAPE-ROUUACIJSA-N	0	3	344.503	3.283	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(C)c(F)cc1F	ZINC001025240117	1324034679	/nfs/dbraw/zinc/03/46/79/1324034679.db2.gz	LUVAYMPSKCINFC-OALUTQOASA-N	0	3	346.421	3.366	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc[nH]c1CCC	ZINC001025264324	1324076807	/nfs/dbraw/zinc/07/68/07/1324076807.db2.gz	ZLCPFHJRTFUSLZ-VQTJNVASSA-N	0	3	341.499	3.450	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ocnc1C(F)F	ZINC001025265978	1324078431	/nfs/dbraw/zinc/07/84/31/1324078431.db2.gz	HKKHLHFDXGWVRN-STQMWFEESA-N	0	3	339.386	3.257	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc(Cl)[nH]1	ZINC001025268692	1324080482	/nfs/dbraw/zinc/08/04/82/1324080482.db2.gz	FBMYZMLAXLNYHV-HZPDHXFCSA-N	0	3	333.863	3.151	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc(C)c(F)c1F	ZINC001025269509	1324081997	/nfs/dbraw/zinc/08/19/97/1324081997.db2.gz	RQXIXPJYWHCSQU-SJORKVTESA-N	0	3	346.421	3.366	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cccc(OC)c1C	ZINC001025274348	1324091793	/nfs/dbraw/zinc/09/17/93/1324091793.db2.gz	XALTVILXOYGTAD-RTBURBONSA-N	0	3	340.467	3.096	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(C)ccc1F	ZINC001025274369	1324092130	/nfs/dbraw/zinc/09/21/30/1324092130.db2.gz	XLCYSUUDOHYRLS-MOPGFXCFSA-N	0	3	328.431	3.226	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc2ccccn2c1	ZINC001025274653	1324093211	/nfs/dbraw/zinc/09/32/11/1324093211.db2.gz	LVAXEPMNSZSEKE-SFTDATJTSA-N	0	3	349.478	3.422	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)CCC1CCOCC1	ZINC001025274860	1324094409	/nfs/dbraw/zinc/09/44/09/1324094409.db2.gz	PHLWHRUQPVMGRB-VQTJNVASSA-N	0	3	346.515	3.062	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)C(C)(C)C(F)(F)F	ZINC001025291906	1324116214	/nfs/dbraw/zinc/11/62/14/1324116214.db2.gz	CTDBGDWEQPTQJV-GJZGRUSLSA-N	0	3	344.421	3.444	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cccc(Cl)c1	ZINC001025292429	1324116947	/nfs/dbraw/zinc/11/69/47/1324116947.db2.gz	INFNRPGIAANOQN-ROUUACIJSA-N	0	3	330.859	3.432	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc(OC)cc1	ZINC001025292439	1324117359	/nfs/dbraw/zinc/11/73/59/1324117359.db2.gz	IOTPNJPBYIMEOX-PMACEKPBSA-N	0	3	340.467	3.178	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cccc2cnccc21	ZINC001025296394	1324128199	/nfs/dbraw/zinc/12/81/99/1324128199.db2.gz	SVNUIGXVNCCZIE-SFTDATJTSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cncc(-c3ccccc3)c2)C1	ZINC001025432958	1324272425	/nfs/dbraw/zinc/27/24/25/1324272425.db2.gz	KVVDATNTAJKVDH-MJGOQNOKSA-N	0	3	347.462	3.212	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2oc3ccc(F)cc3c2C)C1	ZINC001025441390	1324281564	/nfs/dbraw/zinc/28/15/64/1324281564.db2.gz	CUTUUELAQRFRRZ-GJZGRUSLSA-N	0	3	342.414	3.344	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2nccc3ccsc32)C1	ZINC001025447766	1324288739	/nfs/dbraw/zinc/28/87/39/1324288739.db2.gz	LTGMTMTWTGLSKN-GOEBONIOSA-N	0	3	341.480	3.150	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cccc3c2CCCCC3)C1	ZINC001025450657	1324294073	/nfs/dbraw/zinc/29/40/73/1324294073.db2.gz	LFPAHHLHHGIIFM-HKUYNNGSSA-N	0	3	338.495	3.419	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2c(C)c(F)ccc2Cl)C1	ZINC001025459619	1324302561	/nfs/dbraw/zinc/30/25/61/1324302561.db2.gz	PRXNUEWTTLJWSS-KGLIPLIRSA-N	0	3	336.838	3.251	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2coc3cc(F)ccc23)C1	ZINC001025461934	1324307817	/nfs/dbraw/zinc/30/78/17/1324307817.db2.gz	YMNDLJBLDUEFAY-HUUCEWRRSA-N	0	3	342.414	3.426	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(C)c3cccnc23)C1	ZINC001025491595	1324341678	/nfs/dbraw/zinc/34/16/78/1324341678.db2.gz	ZLKSHVYTHHEIDM-QZTJIDSGSA-N	0	3	349.478	3.397	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(C)c(C)cc2Cl)C1	ZINC001025502199	1324352259	/nfs/dbraw/zinc/35/22/59/1324352259.db2.gz	KWOIOJMWSNEERL-HZPDHXFCSA-N	0	3	332.875	3.420	20	30		EGEDHN
CC(C)(C)[C@H]1CSCCN1CCC(=O)Nc1sccc1C#N	ZINC000931590230	1329150194	/nfs/dbraw/zinc/15/01/94/1329150194.db2.gz	NNFDZXJGTFCOTM-CYBMUJFWSA-N	0	3	337.514	3.412	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)C2CCC(F)(F)CC2)C1	ZINC001025537638	1324383154	/nfs/dbraw/zinc/38/31/54/1324383154.db2.gz	BAFKCCDHWNETHR-GDBMZVCRSA-N	0	3	326.431	3.052	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(C(CC)CC)no2)C1	ZINC001025553807	1324401934	/nfs/dbraw/zinc/40/19/34/1324401934.db2.gz	AVMJNVHBARNVMQ-GOEBONIOSA-N	0	3	331.460	3.042	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(C(CC)CC)no2)C1	ZINC001025553809	1324402152	/nfs/dbraw/zinc/40/21/52/1324402152.db2.gz	AVMJNVHBARNVMQ-ZBFHGGJFSA-N	0	3	331.460	3.042	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2scnc2C(C)C)C1	ZINC001025555992	1324404916	/nfs/dbraw/zinc/40/49/16/1324404916.db2.gz	RMJQBTXCAQKHOL-GJZGRUSLSA-N	0	3	333.501	3.120	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2csc(C(C)C)n2)C1	ZINC001025556678	1324406049	/nfs/dbraw/zinc/40/60/49/1324406049.db2.gz	XPINEPLCOSVWFC-CABCVRRESA-N	0	3	333.501	3.120	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cnn(C(CC)CC)c2C)C1	ZINC001025590623	1324436504	/nfs/dbraw/zinc/43/65/04/1324436504.db2.gz	PDPACGSMALCAEL-DOTOQJQBSA-N	0	3	344.503	3.016	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2c(F)cccc2Cl)C1	ZINC001025603193	1324452595	/nfs/dbraw/zinc/45/25/95/1324452595.db2.gz	RLNPFXVUZHPBDX-UONOGXRCSA-N	0	3	336.838	3.333	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc3c(s2)CCC3)C1	ZINC001025615038	1324467976	/nfs/dbraw/zinc/46/79/76/1324467976.db2.gz	RYKJOGLEZGKCAL-ZBFHGGJFSA-N	0	3	330.497	3.090	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(Cl)ccc2OC)C1	ZINC001025614982	1324468349	/nfs/dbraw/zinc/46/83/49/1324468349.db2.gz	QTTOPLJVPMOYCO-LSDHHAIUSA-N	0	3	348.874	3.202	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc3cccc(F)c3o2)C1	ZINC001025624259	1324475240	/nfs/dbraw/zinc/47/52/40/1324475240.db2.gz	CFPIXWJYMQVBEP-DZGCQCFKSA-N	0	3	328.387	3.035	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2[C@H]3CN(C/C=C\c4ccccc4)C[C@H]32)CC1	ZINC001026002634	1324576992	/nfs/dbraw/zinc/57/69/92/1324576992.db2.gz	WDJMBCPEAPWPTM-YKWDRJHNSA-N	0	3	336.479	3.493	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H]3CC[C@@H](NCc4nccs4)[C@H]3C2)CC1	ZINC001026345743	1324742546	/nfs/dbraw/zinc/74/25/46/1324742546.db2.gz	BVNLYTCKDGDVMT-YESZJQIVSA-N	0	3	345.512	3.216	20	30		EGEDHN
CC1(C(=O)N2C[C@@H]3CC[C@@H](NCc4ccccc4C#N)[C@H]3C2)CC=CC1	ZINC001026348261	1324744395	/nfs/dbraw/zinc/74/43/95/1324744395.db2.gz	DSQSIACDOBDKOK-SLFFLAALSA-N	0	3	349.478	3.241	20	30		EGEDHN
N#Cc1ccccc1CNC1CCC(NC(=O)[C@@H]2CC=CCC2)CC1	ZINC001026451851	1324815766	/nfs/dbraw/zinc/81/57/66/1324815766.db2.gz	IWFLGTDCQBZAKZ-PBPGXSGUSA-N	0	3	337.467	3.432	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC1CCC(NC(=O)[C@H]2CC23CC3)CC1	ZINC001026566779	1324899958	/nfs/dbraw/zinc/89/99/58/1324899958.db2.gz	OILMYMDLGKGMCJ-DAWZGUTISA-N	0	3	341.430	3.014	20	30		EGEDHN
Cc1ccccc1C(=O)N1CC[C@H](CNCc2ccccc2C#N)C1	ZINC001026655597	1324955243	/nfs/dbraw/zinc/95/52/43/1324955243.db2.gz	ZSWMUMBTQNMLLZ-QGZVFWFLSA-N	0	3	333.435	3.119	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCN(C(=O)c2ccc(Cl)o2)C1	ZINC001026685750	1324975275	/nfs/dbraw/zinc/97/52/75/1324975275.db2.gz	NIHIASGWNLVUCY-CYBMUJFWSA-N	0	3	343.814	3.057	20	30		EGEDHN
CC(C(=O)N1CC[C@@H](CNCc2ccccc2C#N)C1)=C1CCCC1	ZINC001026770855	1325014189	/nfs/dbraw/zinc/01/41/89/1325014189.db2.gz	KZPPGSVIPKNXTA-KRWDZBQOSA-N	0	3	337.467	3.387	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](CNCc2nc3ccc(F)cc3o2)C1	ZINC001026992994	1325130945	/nfs/dbraw/zinc/13/09/45/1325130945.db2.gz	XGXBFNGUZXYKSE-CYBMUJFWSA-N	0	3	345.418	3.117	20	30		EGEDHN
CCC1(C(=O)N2CC[C@@H](CNCc3ccccc3C#N)C2)CCC1	ZINC001027004322	1325143619	/nfs/dbraw/zinc/14/36/19/1325143619.db2.gz	ROVCHADPXIQGFX-INIZCTEOSA-N	0	3	325.456	3.077	20	30		EGEDHN
CC1(C(=O)N2CC[C@@H](CNCc3ccccc3C#N)C2)CCCCC1	ZINC001027035683	1325169306	/nfs/dbraw/zinc/16/93/06/1325169306.db2.gz	JHYIVBNKRDWGHP-KRWDZBQOSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)c2c[nH]cc2C)C1	ZINC000963411937	1325216619	/nfs/dbraw/zinc/21/66/19/1325216619.db2.gz	AWYNAGGPXGJBPJ-DOTOQJQBSA-N	0	3	335.879	3.392	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1nc(C)sc1C)C2	ZINC000964030032	1325478023	/nfs/dbraw/zinc/47/80/23/1325478023.db2.gz	DFJMCPKQFRZHCD-UHFFFAOYSA-N	0	3	339.892	3.143	20	30		EGEDHN
CCOc1cccc(CCC(=O)C(C#N)C(=O)NC2CCCCC2)c1	ZINC000860468810	1329320903	/nfs/dbraw/zinc/32/09/03/1329320903.db2.gz	LQGZXLYRESOMBR-GOSISDBHSA-N	0	3	342.439	3.176	20	30		EGEDHN
C[C@H]1O[C@@H](C)[C@H](C)[C@H]1C(=O)C(C#N)C(=O)Nc1ccccc1Cl	ZINC000860469568	1329321566	/nfs/dbraw/zinc/32/15/66/1329321566.db2.gz	IUGQMCVQIXDUDP-HHHUMZEGSA-N	0	3	334.803	3.047	20	30		EGEDHN
CCC[C@H](OCC)C(=O)C(C#N)C(=O)N[C@@H](CC)c1ccccc1	ZINC000860696107	1329345259	/nfs/dbraw/zinc/34/52/59/1329345259.db2.gz	YHKVPLIQJWDMFP-IKGGRYGDSA-N	0	3	330.428	3.168	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N1CCC[C@@H](N(C)Cc2ccsc2)C1	ZINC001027415309	1327642595	/nfs/dbraw/zinc/64/25/95/1327642595.db2.gz	JFWCPIPSJHXCKG-KURKYZTESA-N	0	3	348.512	3.152	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)C2C=CC=CC=C2)C1	ZINC001027431322	1327669575	/nfs/dbraw/zinc/66/95/75/1327669575.db2.gz	NVQLUELHDHIRQO-NRFANRHFSA-N	0	3	347.462	3.279	20	30		EGEDHN
C[C@@H]1C[C@@H]1CC(=O)NC1CC2(CC(NCc3ccccc3C#N)C2)C1	ZINC000964853835	1327731429	/nfs/dbraw/zinc/73/14/29/1327731429.db2.gz	QIPNCXZFBHNIMQ-SKSFLTBXSA-N	0	3	337.467	3.121	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)CC2(C)CC2)C1	ZINC001027496318	1327757769	/nfs/dbraw/zinc/75/77/69/1327757769.db2.gz	OVULIRMTXRDVSK-GOSISDBHSA-N	0	3	325.456	3.171	20	30		EGEDHN
C[C@H](NC[C@H]1CCN1C(=O)OC(C)(C)C)c1ccc(C#N)c(F)c1	ZINC000927000934	1327814330	/nfs/dbraw/zinc/81/43/30/1327814330.db2.gz	NJJWLEGRMBTJLI-SWLSCSKDSA-N	0	3	333.407	3.357	20	30		EGEDHN
C[C@@H]1C[C@@H]([NH2+]CCNc2ccc(C#N)cn2)c2c1c(F)ccc2[O-]	ZINC000927164731	1327902673	/nfs/dbraw/zinc/90/26/73/1327902673.db2.gz	PIETXEALHWWQFF-BXUZGUMPSA-N	0	3	326.375	3.048	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2coc3ccc(CC)cc23)C1	ZINC000966129804	1328200039	/nfs/dbraw/zinc/20/00/39/1328200039.db2.gz	FVMQFLRKOVUFAP-KXBFYZLASA-N	0	3	338.451	3.459	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2cc(F)cc3ccncc32)C1	ZINC000966171037	1328214024	/nfs/dbraw/zinc/21/40/24/1328214024.db2.gz	ZKTUPDXUAPCXTD-LIRRHRJNSA-N	0	3	341.430	3.390	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2cc(C)c(OC)c(C)c2)C1	ZINC000966302998	1328263390	/nfs/dbraw/zinc/26/33/90/1328263390.db2.gz	XJWPZUFLMMEZDR-KBXCAEBGSA-N	0	3	330.472	3.328	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2coc(Br)c2)C1	ZINC000966522747	1328332741	/nfs/dbraw/zinc/33/27/41/1328332741.db2.gz	JEXRCEDYSCVARJ-WCQYABFASA-N	0	3	341.249	3.058	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2ccccc2-c2cn[nH]c2)C1	ZINC000966637858	1328364609	/nfs/dbraw/zinc/36/46/09/1328364609.db2.gz	ZFUWSHLINXFGSR-HNAYVOBHSA-N	0	3	338.455	3.093	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)Cc2cncc3ccccc32)C1	ZINC000966876755	1328449055	/nfs/dbraw/zinc/44/90/55/1328449055.db2.gz	ZXEPPRSMHXWZSI-OXQOHEQNSA-N	0	3	337.467	3.180	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccccc2-c2ccncc2)C1	ZINC000966908980	1328469511	/nfs/dbraw/zinc/46/95/11/1328469511.db2.gz	YBCSQMOSGAQNMR-DYESRHJHSA-N	0	3	347.462	3.212	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)CCc3ccc(C(C)C)cc3)C2)CC1	ZINC001050591095	1348295286	/nfs/dbraw/zinc/29/52/86/1348295286.db2.gz	UZHMSCXNFXONPU-UHFFFAOYSA-N	0	3	338.495	3.300	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC2(C1)CCN(Cc1ncccc1C)CC2	ZINC001050618134	1348304274	/nfs/dbraw/zinc/30/42/74/1348304274.db2.gz	RFDREPHFSHIFTR-UHFFFAOYSA-N	0	3	327.472	3.027	20	30		EGEDHN
C=CCC[C@@H](O)CN[C@@H]1CCOc2ccc(Br)cc21	ZINC000932211328	1329796375	/nfs/dbraw/zinc/79/63/75/1329796375.db2.gz	XZTXSWKUQNRVDF-TZMCWYRMSA-N	0	3	326.234	3.189	20	30		EGEDHN
C(#CCN[C@H](c1ccccn1)C1CC1)CN[C@H](c1ccccn1)C1CC1	ZINC000932384831	1329810777	/nfs/dbraw/zinc/81/07/77/1329810777.db2.gz	WXQNASHSHIJJDC-VXKWHMMOSA-N	0	3	346.478	3.262	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)[C@@H](C)N[C@H](C)COCC1CCCCC1	ZINC000932426812	1329813942	/nfs/dbraw/zinc/81/39/42/1329813942.db2.gz	NGNGVWONGQNPLJ-MDZRGWNJSA-N	0	3	337.508	3.004	20	30		EGEDHN
CC[C@H](NC[C@H](O)c1ccc(C#N)cc1)c1cc(F)ccc1OC	ZINC000932474818	1329817197	/nfs/dbraw/zinc/81/71/97/1329817197.db2.gz	MGCBGHMTLNOMDK-ROUUACIJSA-N	0	3	328.387	3.480	20	30		EGEDHN
C[C@H](Cc1cccnc1)NCc1ccc(Br)cc1C#N	ZINC000934229577	1329957126	/nfs/dbraw/zinc/95/71/26/1329957126.db2.gz	JGFUTYPHQWJSCI-GFCCVEGCSA-N	0	3	330.229	3.437	20	30		EGEDHN
N#C[C@H]1CC[C@@H](N2CCC(NC(=O)OCc3ccccc3)CC2)C1	ZINC000866592630	1330130469	/nfs/dbraw/zinc/13/04/69/1330130469.db2.gz	RHYLLNKYVNQDQX-FUHWJXTLSA-N	0	3	327.428	3.069	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](C)[C@H](NCc3cn(C(C)C)nc3C)C2)C1	ZINC000939101655	1330376412	/nfs/dbraw/zinc/37/64/12/1330376412.db2.gz	AHPFBPFUAIPZBI-CRAIPNDOSA-N	0	3	344.503	3.065	20	30		EGEDHN
C[C@H]1CN(Cc2ccc(C#N)cc2)CC[C@H]1NC(=O)C1C=CC=CC=C1	ZINC000942093236	1331826853	/nfs/dbraw/zinc/82/68/53/1331826853.db2.gz	ZBMRZLWMNXZHDD-LAUBAEHRSA-N	0	3	347.462	3.183	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(C(C)(C)CC)cc2)[C@H](C)C1	ZINC000942163426	1331854808	/nfs/dbraw/zinc/85/48/08/1331854808.db2.gz	KLTRJFAOKOHFND-VQIMIIECSA-N	0	3	326.484	3.448	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3c([nH]2)c(F)ccc3C)[C@@H](C)C1	ZINC000942205672	1331879201	/nfs/dbraw/zinc/87/92/01/1331879201.db2.gz	VLMKQEGVOKGUCQ-WMLDXEAASA-N	0	3	341.430	3.079	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2c(C)cccc2Cl)[C@H](C)C1	ZINC000942272824	1331892775	/nfs/dbraw/zinc/89/27/75/1331892775.db2.gz	RYGVEDWGQKKRMI-CRAIPNDOSA-N	0	3	332.875	3.041	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cccc(C(F)F)c2)[C@H](C)C1	ZINC000942467134	1331941583	/nfs/dbraw/zinc/94/15/83/1331941583.db2.gz	NYFSHHXCRUHGFM-PBHICJAKSA-N	0	3	334.410	3.017	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2oc3ccccc3c2OC)[C@@H](C)C1	ZINC000942546863	1331968725	/nfs/dbraw/zinc/96/87/25/1331968725.db2.gz	BKWUGLYHKXDGIW-ZFWWWQNUSA-N	0	3	328.412	3.068	20	30		EGEDHN
C[C@H]1CN(Cc2cccc(C#N)c2)CC[C@@H]1NC(=O)C(C)(C)C1CC1	ZINC000942572559	1331982918	/nfs/dbraw/zinc/98/29/18/1331982918.db2.gz	VLDSKCUQHBHMHZ-KXBFYZLASA-N	0	3	339.483	3.321	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3ncccc3C)C[C@@H]2C)C1	ZINC000942603119	1332001388	/nfs/dbraw/zinc/00/13/88/1332001388.db2.gz	SGTRTCYWPVSKIE-DLBZAZTESA-N	0	3	327.472	3.073	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3ccc(C)nc3C)C[C@@H]2C)C1	ZINC000942603436	1332001508	/nfs/dbraw/zinc/00/15/08/1332001508.db2.gz	XNOGVLUSORTOGE-KXBFYZLASA-N	0	3	341.499	3.381	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc(C(C)(C)C)c2)[C@@H](C)C1	ZINC000943744695	1332252056	/nfs/dbraw/zinc/25/20/56/1332252056.db2.gz	LVJVBPLJQDQDJW-LPHOPBHVSA-N	0	3	326.484	3.448	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(-c3ccccc3)nc2)[C@H](C)C1	ZINC000943757027	1332255352	/nfs/dbraw/zinc/25/53/52/1332255352.db2.gz	ZDAGKEGSQBUKFV-XLIONFOSSA-N	0	3	347.462	3.212	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(Cl)cc2Cl)[C@H](C)C1	ZINC000944303159	1332367462	/nfs/dbraw/zinc/36/74/62/1332367462.db2.gz	BIECOASAANWIHU-WBMJQRKESA-N	0	3	339.266	3.457	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(Cl)cc(Cl)c2)[C@@H](C)C1	ZINC000944318373	1332372856	/nfs/dbraw/zinc/37/28/56/1332372856.db2.gz	PGXLZJCUKUTHNO-LRDDRELGSA-N	0	3	339.266	3.457	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccsc2C(F)(F)F)[C@H](C)C1	ZINC000944345294	1332379776	/nfs/dbraw/zinc/37/97/76/1332379776.db2.gz	FJUKIUABJKFURU-DGCLKSJQSA-N	0	3	344.402	3.230	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2csc3c2CCCC3)[C@H](C)C1	ZINC000944698276	1332422473	/nfs/dbraw/zinc/42/24/73/1332422473.db2.gz	FAQHOTAUCRSNFW-PBHICJAKSA-N	0	3	330.497	3.090	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3ccccc3)CCCC2)[C@H](C)C1	ZINC000944697071	1332422889	/nfs/dbraw/zinc/42/28/89/1332422889.db2.gz	BDHVPEDXMKOAFN-QUCCMNQESA-N	0	3	338.495	3.348	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3cc(C)cc(C)c3)CC2)[C@@H](C)C1	ZINC000944980941	1332468670	/nfs/dbraw/zinc/46/86/70/1332468670.db2.gz	YBZBTQZKDNVXBU-ICSRJNTNSA-N	0	3	338.495	3.185	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(OC3CCC3)cc2)[C@H](C)C1	ZINC000945029279	1332481403	/nfs/dbraw/zinc/48/14/03/1332481403.db2.gz	RGZTWAHKWOVVHM-UZLBHIALSA-N	0	3	340.467	3.081	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2oc3ccccc3c2CC)[C@H](C)C1	ZINC000945365874	1332568264	/nfs/dbraw/zinc/56/82/64/1332568264.db2.gz	MGGGPXAZRCISFN-QAPCUYQASA-N	0	3	338.451	3.459	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C(C)(F)F)cc2)[C@@H](C)C1	ZINC000946310297	1332784078	/nfs/dbraw/zinc/78/40/78/1332784078.db2.gz	DURXIZRKHJXEHS-YOEHRIQHSA-N	0	3	334.410	3.262	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@H](CC)SC)CC[C@@H]2C1	ZINC000946556593	1332854190	/nfs/dbraw/zinc/85/41/90/1332854190.db2.gz	RMXRQLYIZODVTN-ZNMIVQPWSA-N	0	3	330.925	3.051	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3cccc(CC)n3)CC[C@@H]2C1	ZINC000946626115	1332865607	/nfs/dbraw/zinc/86/56/07/1332865607.db2.gz	NOZDCAYSQCQJFZ-IYBDPMFKSA-N	0	3	347.890	3.181	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3C3CCC3)CC[C@@H]2C1	ZINC000946818051	1332907427	/nfs/dbraw/zinc/90/74/27/1332907427.db2.gz	BZDCASDCYAQTFE-XWTMOSNGSA-N	0	3	336.907	3.346	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2ccsc2)CCN1Cc1ccc(C#N)cc1	ZINC000947026361	1332979470	/nfs/dbraw/zinc/97/94/70/1332979470.db2.gz	LILCTNJQCVCNRO-RDTXWAMCSA-N	0	3	339.464	3.403	20	30		EGEDHN
Cc1cncc(C(=O)N[C@H]2CCN(Cc3cccc(C#N)c3)[C@H](C)C2)c1	ZINC000947161392	1333029682	/nfs/dbraw/zinc/02/96/82/1333029682.db2.gz	FFNMNHOANYGTTH-UZLBHIALSA-N	0	3	348.450	3.045	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)C2CC(F)(F)C2)CCN1Cc1ccc(C#N)cc1	ZINC000947171398	1333035558	/nfs/dbraw/zinc/03/55/58/1333035558.db2.gz	UVLAIRIRLZFQAI-DYVFJYSZSA-N	0	3	347.409	3.073	20	30		EGEDHN
Cc1cc(CN2CC[C@H](NC(=O)c3c[nH]c(C#N)c3)C[C@H]2C)cs1	ZINC000947205443	1333051970	/nfs/dbraw/zinc/05/19/70/1333051970.db2.gz	QLQSKROTCKVILJ-WBMJQRKESA-N	0	3	342.468	3.039	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2c[nH]c(C#N)c2)CCN1C/C=C/c1ccccc1	ZINC000947206010	1333052267	/nfs/dbraw/zinc/05/22/67/1333052267.db2.gz	ZQLCYRAEBMXNSF-HPWWWVCSSA-N	0	3	348.450	3.182	20	30		EGEDHN
Cc1cc(C(=O)N[C@H]2CCN(Cc3ccc(C#N)cc3)[C@H](C)C2)co1	ZINC000947245268	1333063305	/nfs/dbraw/zinc/06/33/05/1333063305.db2.gz	ROOPOSPABRBZID-KUHUBIRLSA-N	0	3	337.423	3.243	20	30		EGEDHN
Cc1cnccc1C(=O)N[C@H]1CCN(Cc2ccc(C#N)cc2)[C@@H](C)C1	ZINC000947282264	1333076766	/nfs/dbraw/zinc/07/67/66/1333076766.db2.gz	NVXSGPGQHMBKFK-LPHOPBHVSA-N	0	3	348.450	3.045	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(F)c(C(F)F)c2)C[C@H]1C	ZINC000947319710	1333087209	/nfs/dbraw/zinc/08/72/09/1333087209.db2.gz	UNOZWTPMYXVIOB-OCCSQVGLSA-N	0	3	338.373	3.369	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2snc(Cl)c2Cl)C[C@@H]1C	ZINC000947356520	1333101262	/nfs/dbraw/zinc/10/12/62/1333101262.db2.gz	MROKFYZNACOPMR-DTWKUNHWSA-N	0	3	334.272	3.219	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)Cc2ccccc2)CCN1Cc1cccc(C#N)c1	ZINC000947454314	1333134487	/nfs/dbraw/zinc/13/44/87/1333134487.db2.gz	JLMDFQIUZLWNBH-UWJYYQICSA-N	0	3	347.462	3.270	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(C)CCC(F)(F)CC2)C[C@@H]1C	ZINC000947460849	1333137863	/nfs/dbraw/zinc/13/78/63/1333137863.db2.gz	ZXFXYXOQJFJOCL-LSDHHAIUSA-N	0	3	326.431	3.194	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc3c4c(cccc42)CC3)C[C@H]1C	ZINC000947520670	1333156114	/nfs/dbraw/zinc/15/61/14/1333156114.db2.gz	QTCUCKVBFDMNAE-CRAIPNDOSA-N	0	3	332.447	3.154	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2coc3ccc(OC)cc32)C[C@H]1C	ZINC000947537713	1333162928	/nfs/dbraw/zinc/16/29/28/1333162928.db2.gz	POYAOIWKRDFBAV-KGLIPLIRSA-N	0	3	328.412	3.210	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C)c3cccnc23)C[C@H]1C	ZINC000947554422	1333169841	/nfs/dbraw/zinc/16/98/41/1333169841.db2.gz	BLMDUXOJLDJSGB-IAGOWNOFSA-N	0	3	335.451	3.149	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2sccc2-n2cccc2)C[C@H]1C	ZINC000947599349	1333188356	/nfs/dbraw/zinc/18/83/56/1333188356.db2.gz	UBPNCVKSFQPKJZ-CVEARBPZSA-N	0	3	341.480	3.145	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2sccc2-n2cccc2)C[C@H]1C	ZINC000947597543	1333188459	/nfs/dbraw/zinc/18/84/59/1333188459.db2.gz	ICDWOCBSONZFEW-HUUCEWRRSA-N	0	3	329.469	3.308	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3cccc(F)c3)CCC2)C[C@@H]1C	ZINC000947599648	1333189120	/nfs/dbraw/zinc/18/91/20/1333189120.db2.gz	XDCFMDOJAXHZAO-QFBILLFUSA-N	0	3	342.458	3.240	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3cc(Cl)ccc3[nH]2)C[C@H]1C	ZINC000947606098	1333190441	/nfs/dbraw/zinc/19/04/41/1333190441.db2.gz	BNUUGFYJPMMJFW-CJNGLKHVSA-N	0	3	343.858	3.427	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc3cc(Cl)ccc3[nH]2)C[C@H]1C	ZINC000947607081	1333190665	/nfs/dbraw/zinc/19/06/65/1333190665.db2.gz	JXWMPUPSVFMXME-DOMZBBRYSA-N	0	3	329.831	3.037	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3c(ccc(C)c3C)[nH]2)C[C@@H]1C	ZINC000947615579	1333193898	/nfs/dbraw/zinc/19/38/98/1333193898.db2.gz	JNDZJKGNOYSLMM-DOTOQJQBSA-N	0	3	337.467	3.391	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2nsc3ccc(C)cc32)C[C@@H]1C	ZINC000947622024	1333196036	/nfs/dbraw/zinc/19/60/36/1333196036.db2.gz	ZTTOJQHMVDACJW-LSDHHAIUSA-N	0	3	341.480	3.211	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc3cccc(OC)c3o2)C[C@@H]1C	ZINC000947667608	1333215874	/nfs/dbraw/zinc/21/58/74/1333215874.db2.gz	RPQIDKTVPUKVSY-ZFWWWQNUSA-N	0	3	328.412	3.210	20	30		EGEDHN
Cc1ncccc1C(=O)N[C@H]1CCN(Cc2ccc(C#N)cc2)[C@H](C)C1	ZINC000947670621	1333217249	/nfs/dbraw/zinc/21/72/49/1333217249.db2.gz	GVFFLIPCMXMIBW-BEFAXECRSA-N	0	3	348.450	3.045	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(F)c(Cl)c2)C[C@H]1C	ZINC000947747343	1333249073	/nfs/dbraw/zinc/24/90/73/1333249073.db2.gz	WLGBFTWJYWNOHI-HIFRSBDPSA-N	0	3	336.838	3.014	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cnc(-c3ccoc3)s2)C[C@H]1C	ZINC000947779798	1333259422	/nfs/dbraw/zinc/25/94/22/1333259422.db2.gz	SYMPAABGTKGUIY-UKRRQHHQSA-N	0	3	343.452	3.009	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccn2C2CCCC2)C[C@@H]1C	ZINC000947857705	1333283032	/nfs/dbraw/zinc/28/30/32/1333283032.db2.gz	QGZMSPMGEPPFEC-IRXDYDNUSA-N	0	3	327.472	3.209	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnn(C3CCCCC3)c2)C[C@@H]1C	ZINC000947899034	1333297210	/nfs/dbraw/zinc/29/72/10/1333297210.db2.gz	DERGNCQINKYKPJ-DOTOQJQBSA-N	0	3	330.476	3.157	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cnn(C(CC)CC)c2C)C[C@@H]1C	ZINC000947908271	1333302265	/nfs/dbraw/zinc/30/22/65/1333302265.db2.gz	QUEPNCGTWRQSCX-RDJZCZTQSA-N	0	3	344.503	3.159	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2)C[C@H]1C	ZINC000947963064	1333322915	/nfs/dbraw/zinc/32/29/15/1333322915.db2.gz	QVKPYDUAIZDBGV-CZUORRHYSA-N	0	3	338.373	3.311	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccc(OCC(C)C)c2)C[C@H]1C	ZINC000948017981	1333343999	/nfs/dbraw/zinc/34/39/99/1333343999.db2.gz	YHPXPLAKNAIVSZ-IEBWSBKVSA-N	0	3	342.483	3.327	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)CC2C3CC4CC(C3)CC2C4)C[C@H]1C	ZINC000948056092	1333357495	/nfs/dbraw/zinc/35/74/95/1333357495.db2.gz	HBZFWIUDSAEWQG-CRXUISOOSA-N	0	3	342.527	3.441	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(OC3CCC3)cc2)C[C@H]1C	ZINC000948061815	1333360209	/nfs/dbraw/zinc/36/02/09/1333360209.db2.gz	ZPFORTUSVKQVEX-AEFFLSMTSA-N	0	3	340.467	3.224	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C23CC(c4ccccc4)(C2)C3)C[C@@H]1C	ZINC000948078609	1333367770	/nfs/dbraw/zinc/36/77/70/1333367770.db2.gz	MJYOAJHRNMYSCV-FIFAKTGDSA-N	0	3	336.479	3.101	20	30		EGEDHN
CN(C(=O)C(C)(F)F)[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948133296	1333385516	/nfs/dbraw/zinc/38/55/16/1333385516.db2.gz	WONFBUUEYKGNNY-MRXNPFEDSA-N	0	3	335.398	3.026	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N(C)[C@@H]1CCCN(C/C=C\Cl)CC1	ZINC000948385013	1333504136	/nfs/dbraw/zinc/50/41/36/1333504136.db2.gz	HECBZAWFPDAHSG-HFKCCXICSA-N	0	3	340.895	3.033	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2ccoc2C(F)(F)F)CC1	ZINC000948412261	1333515895	/nfs/dbraw/zinc/51/58/95/1333515895.db2.gz	JGJXRQYNDKAUNJ-CYBMUJFWSA-N	0	3	342.361	3.248	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)C2(c3ccc(F)cc3)CC2)CC1	ZINC000948421591	1333519191	/nfs/dbraw/zinc/51/91/91/1333519191.db2.gz	WKRFAKRHEDXAGP-IBGZPJMESA-N	0	3	342.458	3.194	20	30		EGEDHN
C=CCn1cccc1C(=O)N(C)[C@H]1CCCN(C[C@H](F)CC)CC1	ZINC000948439546	1333525909	/nfs/dbraw/zinc/52/59/09/1333525909.db2.gz	RHDFMOBBTGERSI-SJORKVTESA-N	0	3	335.467	3.349	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2cc(C)nn2C(CC)CC)CC1	ZINC000948570402	1333581005	/nfs/dbraw/zinc/58/10/05/1333581005.db2.gz	KSKKKLGNPXRLMC-SFHVURJKSA-N	0	3	344.503	3.112	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2c(C)[nH]c3ccccc32)CC1	ZINC000948602293	1333592019	/nfs/dbraw/zinc/59/20/19/1333592019.db2.gz	JIEXROOALHNNRM-QGZVFWFLSA-N	0	3	337.467	3.426	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)[C@@H]2CCc3cc(F)ccc32)CC1	ZINC000948621637	1333600526	/nfs/dbraw/zinc/60/05/26/1333600526.db2.gz	SMSZXNJUBGYFRL-UYAOXDASSA-N	0	3	342.458	3.192	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)[C@H](C)c2c(F)cccc2F)CC1	ZINC000948621590	1333600881	/nfs/dbraw/zinc/60/08/81/1333600881.db2.gz	RAHJTKKBIFOORZ-HZPDHXFCSA-N	0	3	348.437	3.405	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cccc3ncccc32)CC1	ZINC000948661459	1333617381	/nfs/dbraw/zinc/61/73/81/1333617381.db2.gz	BXMAPFLKOHMOHT-KRWDZBQOSA-N	0	3	335.451	3.185	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2ccn(C(C)C)c2C)CC1	ZINC000948705989	1333641009	/nfs/dbraw/zinc/64/10/09/1333641009.db2.gz	RJVXKOSMBPCDQF-GOSISDBHSA-N	0	3	329.488	3.327	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)C[C@@H]2CCCC2(F)F)CC1	ZINC000948717271	1333645388	/nfs/dbraw/zinc/64/53/88/1333645388.db2.gz	QCFRYYYREPNCDT-HOTGVXAUSA-N	0	3	326.431	3.148	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)[C@H](C)c2ccc(Cl)cc2)CC1	ZINC000948742483	1333655065	/nfs/dbraw/zinc/65/50/65/1333655065.db2.gz	KYRBWMOSMLQDAY-CRAIPNDOSA-N	0	3	332.875	3.390	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2ccc(C(C)C)nc2C)CC1	ZINC000948779183	1333675830	/nfs/dbraw/zinc/67/58/30/1333675830.db2.gz	KLSVKRNPDHCYSC-GOSISDBHSA-N	0	3	341.499	3.463	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2ccc(C3CC3)nc2C)CC1	ZINC000948786221	1333678182	/nfs/dbraw/zinc/67/81/82/1333678182.db2.gz	VTSRDIMLFNRXMB-SFHVURJKSA-N	0	3	339.483	3.217	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N(C)[C@@H]1CCCN(C/C=C/Cl)CC1	ZINC000948852978	1333710080	/nfs/dbraw/zinc/71/00/80/1333710080.db2.gz	ZGDLBNYHRLPNDN-OAPCPPSCSA-N	0	3	340.895	3.033	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)[C@@H](C)c2ccccc2F)CC1	ZINC000948868482	1333715489	/nfs/dbraw/zinc/71/54/89/1333715489.db2.gz	MARCQHUICSBCPI-IRXDYDNUSA-N	0	3	330.447	3.265	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@@H]1CNC(=O)c1cc(F)c[nH]1	ZINC000948939967	1333741987	/nfs/dbraw/zinc/74/19/87/1333741987.db2.gz	CBHIDNOVATUWAQ-SFHVURJKSA-N	0	3	327.403	3.059	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@H]1CNC(=O)c1c[nH]nc1C	ZINC000948946446	1333743405	/nfs/dbraw/zinc/74/34/05/1333743405.db2.gz	LDYJKJAGQWJQBQ-LJQANCHMSA-N	0	3	338.455	3.014	20	30		EGEDHN
CC#CCN1CCC2(CC1)CN(C(=O)C1CCCCCCC1)CCO2	ZINC000949135606	1333783298	/nfs/dbraw/zinc/78/32/98/1333783298.db2.gz	QZCXEWOGDMRMEJ-UHFFFAOYSA-N	0	3	346.515	3.064	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H](C)CC1CCCC1)CCO2	ZINC000949202033	1333795063	/nfs/dbraw/zinc/79/50/63/1333795063.db2.gz	BPERRFPXDFWUDA-QGZVFWFLSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)c3ccsc3C)CC2)C1	ZINC000949351701	1333829026	/nfs/dbraw/zinc/82/90/26/1333829026.db2.gz	FTYNCQRSLVPWIM-UHFFFAOYSA-N	0	3	348.512	3.330	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@]3(C)CCC[C@@H]3CC)CC2)C1	ZINC000949398643	1333837226	/nfs/dbraw/zinc/83/72/26/1333837226.db2.gz	NCOGKMDWVUUFGB-AZUAARDMSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3ccc(CC)cc3)CC2)C1	ZINC000949520526	1333865955	/nfs/dbraw/zinc/86/59/55/1333865955.db2.gz	XHVHGRQRZPLAAI-UHFFFAOYSA-N	0	3	342.483	3.132	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@@H]3CC4CCC3CC4)CC2)C1	ZINC000949532055	1333869115	/nfs/dbraw/zinc/86/91/15/1333869115.db2.gz	WMOAYOGHLUOWOG-CTWPCTMYSA-N	0	3	346.515	3.082	20	30		EGEDHN
CCCCCCCCCCS(=O)(=O)N[C@@H]1CCN(C)C[C@@H]1C	ZINC001201837828	1369631453	/nfs/dbraw/zinc/63/14/53/1369631453.db2.gz	VEMJFHYUFQDWLC-DLBZAZTESA-N	0	3	332.554	3.387	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2ccc(C)nc2C2CC2)C1	ZINC000967438081	1335739469	/nfs/dbraw/zinc/73/94/69/1335739469.db2.gz	TYOWFZPOKCDNCJ-KSSFIOAISA-N	0	3	327.472	3.284	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2cc(-c3cccs3)on2)C1	ZINC000967524024	1335767040	/nfs/dbraw/zinc/76/70/40/1335767040.db2.gz	KIZHOIMTWWGTND-ZFWWWQNUSA-N	0	3	345.468	3.419	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](C)[C@H](NC(=O)c2nc(Cl)cs2)C1	ZINC000968016716	1335844755	/nfs/dbraw/zinc/84/47/55/1335844755.db2.gz	MEKUHMHLVARUKT-VXGBXAGGSA-N	0	3	327.881	3.203	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CN(CCc3cccs3)CC[C@H]2C)C1	ZINC000968277158	1335883543	/nfs/dbraw/zinc/88/35/43/1335883543.db2.gz	YAQQSBRAZSGPHZ-NVXWUHKLSA-N	0	3	332.513	3.474	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(N3CC=CC3)cc2)C1	ZINC000968320956	1335889677	/nfs/dbraw/zinc/88/96/77/1335889677.db2.gz	BQAQDQCESPHFLU-XLIONFOSSA-N	0	3	339.483	3.079	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2ccc(F)c3ccccc23)C1	ZINC000968346574	1335896205	/nfs/dbraw/zinc/89/62/05/1335896205.db2.gz	XSYLJZXSTWGMTI-MGPUTAFESA-N	0	3	338.426	3.442	20	30		EGEDHN
Cc1cscc1C(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC000968347107	1335897069	/nfs/dbraw/zinc/89/70/69/1335897069.db2.gz	WBWKNMKNMOSOLW-OAHLLOKOSA-N	0	3	343.427	3.072	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)Cc2cc(F)c(F)cc2F)C1	ZINC000968354444	1335899657	/nfs/dbraw/zinc/89/96/57/1335899657.db2.gz	SVKDJYMEELCXDW-SJKOYZFVSA-N	0	3	340.389	3.049	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2cc(Br)co2)C1	ZINC000968386432	1335914357	/nfs/dbraw/zinc/91/43/57/1335914357.db2.gz	IWBWTHYBBXVCDA-DGCLKSJQSA-N	0	3	341.249	3.058	20	30		EGEDHN
CC(C(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1)=C1CCCC1	ZINC000968394903	1335918196	/nfs/dbraw/zinc/91/81/96/1335918196.db2.gz	OIVBJLVUMGYHPG-GOSISDBHSA-N	0	3	341.430	3.278	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2cc(Cl)cc(OC)c2)C1	ZINC000968456474	1335931007	/nfs/dbraw/zinc/93/10/07/1335931007.db2.gz	YWNGCQKDJLQZQA-GUYCJALGSA-N	0	3	336.863	3.365	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2sc(CC3CC3)nc2C)C1	ZINC000968477793	1335936146	/nfs/dbraw/zinc/93/61/46/1335936146.db2.gz	WMPARBARKUXICD-BBRMVZONSA-N	0	3	347.528	3.420	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2cc3c(C)cccn3c2)C1	ZINC000968539936	1335956906	/nfs/dbraw/zinc/95/69/06/1335956906.db2.gz	RCBXEVAKYXZABU-YJBOKZPZSA-N	0	3	325.456	3.264	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](C)[C@@H](NC(=O)c2sccc2COC)C1	ZINC000968539988	1335957012	/nfs/dbraw/zinc/95/70/12/1335957012.db2.gz	RYPOHFMFPSBZLN-ZBFHGGJFSA-N	0	3	336.501	3.301	20	30		EGEDHN
CC1(CC(=O)N2CC[C@@H](NCc3ccc(C#N)c(F)c3)C2)CCCC1	ZINC000968577750	1335968052	/nfs/dbraw/zinc/96/80/52/1335968052.db2.gz	USPUIXKXXNNVHB-QGZVFWFLSA-N	0	3	343.446	3.358	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2cc(C)c(F)cc2Cl)C1	ZINC000968592494	1335975924	/nfs/dbraw/zinc/97/59/24/1335975924.db2.gz	NHPRWSDQIDZHLT-YVEFUNNKSA-N	0	3	336.838	3.251	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2ccc(OC(C)C)cc2)C1	ZINC000968611514	1335983818	/nfs/dbraw/zinc/98/38/18/1335983818.db2.gz	XCMDCXPQZBJOQP-LPHOPBHVSA-N	0	3	330.472	3.490	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)C2(c3ccc(Cl)cc3)CC2)C1	ZINC000968624811	1335988657	/nfs/dbraw/zinc/98/86/57/1335988657.db2.gz	ZOAWSSYTAPWPKM-QAPCUYQASA-N	0	3	344.886	3.222	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2cc(OC)c(C)c(OC)c2)C1	ZINC000968624692	1335988819	/nfs/dbraw/zinc/98/88/19/1335988819.db2.gz	YFCIXOLZWMDYAH-YOEHRIQHSA-N	0	3	346.471	3.029	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2ccc(COC(C)C)cc2)C1	ZINC000968628532	1335990009	/nfs/dbraw/zinc/99/00/09/1335990009.db2.gz	ZZOHYSKNZXZMRA-FXAWDEMLSA-N	0	3	342.483	3.075	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccc(F)c3occc32)C1	ZINC000968677995	1336006633	/nfs/dbraw/zinc/00/66/33/1336006633.db2.gz	MUYYWYGIOOGLCX-CXAGYDPISA-N	0	3	328.387	3.035	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cc3ccccc3n2CC)C1	ZINC000968682216	1336008783	/nfs/dbraw/zinc/00/87/83/1336008783.db2.gz	PCAIVBXYVFXRBM-AEFFLSMTSA-N	0	3	337.467	3.125	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2c[nH]c3c2cccc3CC)C1	ZINC000968680982	1336009034	/nfs/dbraw/zinc/00/90/34/1336009034.db2.gz	FRIZDOGAONWNPU-KXBFYZLASA-N	0	3	337.467	3.194	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2csc(CC(C)C)n2)C1	ZINC000968694843	1336014526	/nfs/dbraw/zinc/01/45/26/1336014526.db2.gz	BIWQUNSRHPPCRQ-GJZGRUSLSA-N	0	3	335.517	3.358	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cc(C)n([C@@H](C)C2CC2)n1	ZINC000968923597	1336091127	/nfs/dbraw/zinc/09/11/27/1336091127.db2.gz	XYFNCWMWBLGTRA-WMZOPIPTSA-N	0	3	344.503	3.323	20	30		EGEDHN
C#CCN1CCCCC[C@H]1CNC(=O)c1cn(CC)c2ccccc12	ZINC000968941598	1336097691	/nfs/dbraw/zinc/09/76/91/1336097691.db2.gz	OXSZSLKHOPOZHB-KRWDZBQOSA-N	0	3	337.467	3.269	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1nc2c(s1)CCC2	ZINC000968948619	1336100459	/nfs/dbraw/zinc/10/04/59/1336100459.db2.gz	BLWUZNUVZSSWTC-CQSZACIVSA-N	0	3	333.501	3.182	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccc2nc(C)n(C)c2c1	ZINC000968973195	1336106049	/nfs/dbraw/zinc/10/60/49/1336106049.db2.gz	DNASTYKLCWWHNF-QGZVFWFLSA-N	0	3	340.471	3.042	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cc2ccc(OC)cc2[nH]1	ZINC000968977165	1336107035	/nfs/dbraw/zinc/10/70/35/1336107035.db2.gz	OYIOHTANQNBCIU-MRXNPFEDSA-N	0	3	341.455	3.337	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1ccccc1-n1cccc1	ZINC000969008218	1336116593	/nfs/dbraw/zinc/11/65/93/1336116593.db2.gz	OTQQUQDBIYGXSG-LJQANCHMSA-N	0	3	349.478	3.475	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)[C@H]1CCc2cccc(OC)c21	ZINC000969062173	1336134494	/nfs/dbraw/zinc/13/44/94/1336134494.db2.gz	KWEJMILDFNHEQE-ROUUACIJSA-N	0	3	342.483	3.272	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1cc(C)n(C(C)C)n1	ZINC000969165383	1336169340	/nfs/dbraw/zinc/16/93/40/1336169340.db2.gz	WIDSWSHPYCFXGA-QGZVFWFLSA-N	0	3	332.492	3.323	20	30		EGEDHN
CC(C)(C)C(C)(C)C(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC000969573922	1336225341	/nfs/dbraw/zinc/22/53/41/1336225341.db2.gz	RUFGRLIRHQSYPJ-MRXNPFEDSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3ccc(C#N)c(F)c3)C2)CC1	ZINC000969830409	1336251946	/nfs/dbraw/zinc/25/19/46/1336251946.db2.gz	LFVBUOBBBQNTHG-GOSISDBHSA-N	0	3	341.430	3.134	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C1)c1ccsc1	ZINC000969924173	1336261482	/nfs/dbraw/zinc/26/14/82/1336261482.db2.gz	OGYGWWWPWNMNAP-TZMCWYRMSA-N	0	3	345.493	3.175	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)c2ccc(OC)c(C3CC3)c2)C1	ZINC000970657293	1336330293	/nfs/dbraw/zinc/33/02/93/1336330293.db2.gz	MBJXVLRPWBKDFY-CQSZACIVSA-N	0	3	328.456	3.199	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)c2[nH]c3ccc(C)cc3c2C)C1	ZINC000970674263	1336332219	/nfs/dbraw/zinc/33/22/19/1336332219.db2.gz	XTRAXTUHSQTHLO-HNNXBMFYSA-N	0	3	325.456	3.411	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cnc(CC3CC3)s2)CC1	ZINC001005757093	1336399399	/nfs/dbraw/zinc/39/93/99/1336399399.db2.gz	WBVACNOWDOLQRY-UHFFFAOYSA-N	0	3	333.501	3.208	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cccnc2C(F)(F)F)CC1	ZINC001006055828	1336444279	/nfs/dbraw/zinc/44/42/79/1336444279.db2.gz	DDIQTSQDAOZEFU-UHFFFAOYSA-N	0	3	341.377	3.213	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2coc(C3CCCC3)n2)CC1	ZINC001006212120	1336467247	/nfs/dbraw/zinc/46/72/47/1336467247.db2.gz	RSTAMPNNYYOSPV-UHFFFAOYSA-N	0	3	331.460	3.445	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2c[nH]nc2C2CCCCC2)CC1	ZINC001006277098	1336480314	/nfs/dbraw/zinc/48/03/14/1336480314.db2.gz	ZNXGFQNFHPCSBF-UHFFFAOYSA-N	0	3	330.476	3.180	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2ccc(COC(C)C)cc2)CC1	ZINC001006386464	1336498311	/nfs/dbraw/zinc/49/83/11/1336498311.db2.gz	FPGQTMNNANZNGS-UHFFFAOYSA-N	0	3	330.472	3.334	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2cnc(-c3ccccc3)o2)C1	ZINC001007553453	1336667454	/nfs/dbraw/zinc/66/74/54/1336667454.db2.gz	MYCRNQXIYWBEOF-MRXNPFEDSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N[C@H]1CCCN(CC[C@@H](C)F)C1	ZINC001007676218	1336687463	/nfs/dbraw/zinc/68/74/63/1336687463.db2.gz	WJUBRHDTFRLJBR-CVEARBPZSA-N	0	3	334.435	3.194	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2csc(-c3ccco3)n2)C1	ZINC001008336908	1336825611	/nfs/dbraw/zinc/82/56/11/1336825611.db2.gz	XJGMPPKPBCJNSL-CYBMUJFWSA-N	0	3	331.441	3.173	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN([C@@H](C)c3ccccc3)C2)nc1	ZINC001009270134	1336994540	/nfs/dbraw/zinc/99/45/40/1336994540.db2.gz	QYAGEDAWQDDKNZ-QFBILLFUSA-N	0	3	333.435	3.018	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N[C@@H]2CCCN(CC=C(C)C)C2)cc1	ZINC001009652694	1337054271	/nfs/dbraw/zinc/05/42/71/1337054271.db2.gz	WZESVEKOGBRBQL-LJQANCHMSA-N	0	3	342.483	3.341	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CCN(CCCc2ccsc2)C1	ZINC001014732542	1337891271	/nfs/dbraw/zinc/89/12/71/1337891271.db2.gz	VGUSAHZYPMLDHO-QGZVFWFLSA-N	0	3	343.496	3.173	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3ccc(C)c(C)c3)C2)cc1	ZINC001015481689	1338155201	/nfs/dbraw/zinc/15/52/01/1338155201.db2.gz	GPPGRBBCJKBINJ-NRFANRHFSA-N	0	3	332.447	3.289	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(Cc3ccc(C)cc3C)C2)cc1	ZINC001015481783	1338155422	/nfs/dbraw/zinc/15/54/22/1338155422.db2.gz	HPUHPISSOADFQS-OAQYLSRUSA-N	0	3	332.447	3.289	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CCN([C@H](C)c3cc(C)ccc3C)C2)c1	ZINC001015680306	1338255636	/nfs/dbraw/zinc/25/56/36/1338255636.db2.gz	ZUHIUGSRJKSXMC-XLIONFOSSA-N	0	3	347.462	3.245	20	30		EGEDHN
C=C(C)CN1CC[C@@H](NC(=O)[C@@H]2CCCO[C@H]2c2ccc(C)cc2)C1	ZINC001015826664	1338328409	/nfs/dbraw/zinc/32/84/09/1338328409.db2.gz	HQSKYKKHYNKKAF-AQNXPRMDSA-N	0	3	342.483	3.229	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@H]1CCN(Cc2ccc(C)cc2C)C1	ZINC001016114976	1338467331	/nfs/dbraw/zinc/46/73/31/1338467331.db2.gz	VIAFGHDXYHLJDU-QFIPXVFZSA-N	0	3	346.474	3.218	20	30		EGEDHN
Cc1cc(C(=O)N[C@H]2CC23CCN(Cc2cccc(C#N)c2)CC3)co1	ZINC001016594031	1338658607	/nfs/dbraw/zinc/65/86/07/1338658607.db2.gz	UJMMZKMMPVDPHH-IBGZPJMESA-N	0	3	349.434	3.244	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)C2(C)CCC(F)(F)CC2)CC1	ZINC001016694519	1338693494	/nfs/dbraw/zinc/69/34/94/1338693494.db2.gz	PPVCLUQWAWXOQZ-OAHLLOKOSA-N	0	3	338.442	3.196	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2cc3ccc(F)cc3s2)CC1	ZINC001016715026	1338700297	/nfs/dbraw/zinc/70/02/97/1338700297.db2.gz	MMCLHJFZCXQXMP-KRWDZBQOSA-N	0	3	342.439	3.258	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2sc3ccccc3c2C)CC1	ZINC001016719264	1338701922	/nfs/dbraw/zinc/70/19/22/1338701922.db2.gz	MKKMVMMRJCGZBN-QGZVFWFLSA-N	0	3	338.476	3.427	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(C)c(Cl)c2F)CC1	ZINC001016746272	1338710457	/nfs/dbraw/zinc/71/04/57/1338710457.db2.gz	ULUXVAOGMGNTRB-HNNXBMFYSA-N	0	3	348.849	3.395	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cc(F)ccc2Cl)CC1	ZINC001016842348	1338743857	/nfs/dbraw/zinc/74/38/57/1338743857.db2.gz	INWFCIQULSPTKL-INIZCTEOSA-N	0	3	334.822	3.087	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@@H]3NC(=O)[C@@H]3CC34CCC4)CC2)c1	ZINC001016857497	1338749180	/nfs/dbraw/zinc/74/91/80/1338749180.db2.gz	ZZTYUCGPGSGGGN-OALUTQOASA-N	0	3	349.478	3.219	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)[C@H](C)c2cc3ccccc3o2)CC1	ZINC001016921282	1338770157	/nfs/dbraw/zinc/77/01/57/1338770157.db2.gz	PULGPUWUSBBQRF-DNVCBOLYSA-N	0	3	336.435	3.140	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)C(C)(C)c2ccccc2Cl)CC1	ZINC001016934851	1338774393	/nfs/dbraw/zinc/77/43/93/1338774393.db2.gz	WCBSCPHYBBRNDQ-QGZVFWFLSA-N	0	3	344.886	3.222	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cc3c(s2)CCCC3)CC1	ZINC001016959382	1338784845	/nfs/dbraw/zinc/78/48/45/1338784845.db2.gz	SAKFTBLMOWSPKA-SFHVURJKSA-N	0	3	342.508	3.235	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)[C@H](C)c2cccc(Cl)c2)CC1	ZINC001016988437	1338794419	/nfs/dbraw/zinc/79/44/19/1338794419.db2.gz	ZXYBKLWWOUYMOZ-PBHICJAKSA-N	0	3	330.859	3.047	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)C23CC(c4ccccc4)(C2)C3)CC1	ZINC001016988965	1338795104	/nfs/dbraw/zinc/79/51/04/1338795104.db2.gz	KAFJTGYMSNJZBA-BVVFMGSASA-N	0	3	348.490	3.102	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccc(C(C)(F)F)cc2)CC1	ZINC001017005303	1338801639	/nfs/dbraw/zinc/80/16/39/1338801639.db2.gz	WBMGHZBJZPHTQN-QGZVFWFLSA-N	0	3	346.421	3.406	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001017033235	1338824400	/nfs/dbraw/zinc/82/44/00/1338824400.db2.gz	QUYQPDPTVWTOKO-OAHLLOKOSA-N	0	3	333.501	3.336	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC[C@@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001017055489	1338838728	/nfs/dbraw/zinc/83/87/28/1338838728.db2.gz	JWPXGGCXLYTYMI-GJZGRUSLSA-N	0	3	333.501	3.336	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC[C@@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001017092655	1338860843	/nfs/dbraw/zinc/86/08/43/1338860843.db2.gz	IOLHBXOXDKTIHZ-DOCFVWFQSA-N	0	3	331.485	3.256	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H](CN(C)Cc2cn(C)nc2C)C1	ZINC001017179735	1338924208	/nfs/dbraw/zinc/92/42/08/1338924208.db2.gz	NPDNRJPMWHOBDN-QGZVFWFLSA-N	0	3	346.519	3.001	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H](CN(C)Cc2cccnc2)C1	ZINC001017197033	1338942749	/nfs/dbraw/zinc/94/27/49/1338942749.db2.gz	MNTQVMHHRNYGCN-ICSRJNTNSA-N	0	3	329.488	3.354	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H](CN(C)Cc2cncc(F)c2)C1	ZINC001017201517	1338945720	/nfs/dbraw/zinc/94/57/20/1338945720.db2.gz	JZFBUAUOQMKMDP-JXFKEZNVSA-N	0	3	347.478	3.493	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H](CN(C)Cc3cncc(F)c3)C2)C1	ZINC001017209136	1338956084	/nfs/dbraw/zinc/95/60/84/1338956084.db2.gz	YSZXTDXYRZSWLC-MRXNPFEDSA-N	0	3	345.462	3.247	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C(C)(C)c1cccnc1	ZINC001017692920	1339392308	/nfs/dbraw/zinc/39/23/08/1339392308.db2.gz	BZGITYIEYQKQTC-HDICACEKSA-N	0	3	327.472	3.001	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CCc2cc(F)ccc21	ZINC001017739804	1339408106	/nfs/dbraw/zinc/40/81/06/1339408106.db2.gz	QVGDGZWMZNJFLS-ZIFCJYIRSA-N	0	3	328.431	3.107	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@H]1CCOc2ccccc21	ZINC001017791518	1339422054	/nfs/dbraw/zinc/42/20/54/1339422054.db2.gz	XLIARWFDPHGJCX-KURKYZTESA-N	0	3	340.467	3.194	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cc(Cl)cn1CC	ZINC001018277201	1339558622	/nfs/dbraw/zinc/55/86/22/1339558622.db2.gz	NMKJLQISBHDUHZ-IYBDPMFKSA-N	0	3	335.879	3.416	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1Oc2ccccc2[C@H]1C	ZINC001018343637	1339585747	/nfs/dbraw/zinc/58/57/47/1339585747.db2.gz	XXBSZVGDBUCUQM-WWNBULGVSA-N	0	3	340.467	3.193	20	30		EGEDHN
C[C@@]1(C(=O)N2CC[C@H](NCc3ccc(F)c(C#N)c3)C2)CC=CCC1	ZINC001018905221	1339748734	/nfs/dbraw/zinc/74/87/34/1339748734.db2.gz	XHZJIRXVEWGYSO-FXAWDEMLSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1nsc2ccc(C)cc21	ZINC001028073338	1340409473	/nfs/dbraw/zinc/40/94/73/1340409473.db2.gz	QQXLLLOVCWYLNM-CQSZACIVSA-N	0	3	329.469	3.375	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1ccc(F)c2ccncc12	ZINC001028093997	1340422474	/nfs/dbraw/zinc/42/24/74/1340422474.db2.gz	LQOZFFTXTKBLTP-AWEZNQCLSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)[C@@H]1CCCO[C@H]1c1ccc(C)cc1	ZINC001028189834	1340475874	/nfs/dbraw/zinc/47/58/74/1340475874.db2.gz	IOMBWFNOWYWIAZ-ZCNNSNEGSA-N	0	3	342.483	3.229	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1ncoc1-c1cccs1	ZINC001028208856	1340485628	/nfs/dbraw/zinc/48/56/28/1340485628.db2.gz	XIMFYLUKNHAVJW-ZDUSSCGKSA-N	0	3	331.441	3.173	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1cccc(N2CCCC2)c1	ZINC001028223455	1340491518	/nfs/dbraw/zinc/49/15/18/1340491518.db2.gz	JHUKREZQZSZMPA-LJQANCHMSA-N	0	3	327.472	3.057	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCCN2Cc2ccc(C)cc2C)cn1	ZINC001028270367	1340523393	/nfs/dbraw/zinc/52/33/93/1340523393.db2.gz	ILWOWNBJQSWFNT-OAQYLSRUSA-N	0	3	347.462	3.074	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](CNC(=O)C3CCCCC3)C2)cc1	ZINC001028381894	1340610367	/nfs/dbraw/zinc/61/03/67/1340610367.db2.gz	NMWUXZGNQJMWMC-SFHVURJKSA-N	0	3	325.456	3.077	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H](CNC(=O)c3sccc3F)C2)c1	ZINC001028518863	1340683475	/nfs/dbraw/zinc/68/34/75/1340683475.db2.gz	ZTAVBEPIFXSNGS-OAHLLOKOSA-N	0	3	343.427	3.011	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H](CNC(=O)[C@H]3CCCC34CC4)C2)c1	ZINC001028625900	1340730534	/nfs/dbraw/zinc/73/05/34/1340730534.db2.gz	ADFQWNKCMVPOKM-RBUKOAKNSA-N	0	3	337.467	3.077	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](CNC(=O)[C@@H]3CCCC34CC4)C2)cc1	ZINC001028628662	1340734253	/nfs/dbraw/zinc/73/42/53/1340734253.db2.gz	XNIZEOWIBBTJIY-MOPGFXCFSA-N	0	3	337.467	3.077	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)[C@@H]2C[C@H]2c2ccc3ccccc3c2)C1	ZINC001028874015	1340873419	/nfs/dbraw/zinc/87/34/19/1340873419.db2.gz	PGTWWNARSIBFOA-VOQZNFBZSA-N	0	3	346.474	3.405	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCN(C(=O)[C@H]2CC=CCC2)C1	ZINC001029644785	1341031518	/nfs/dbraw/zinc/03/15/18/1341031518.db2.gz	DXNNPQLEHJMFPV-HOTGVXAUSA-N	0	3	343.496	3.256	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCN(C(=O)C=C2CCC2)C1	ZINC001029700690	1341048921	/nfs/dbraw/zinc/04/89/21/1341048921.db2.gz	MLLIJLNDRYVKQN-HNNXBMFYSA-N	0	3	329.469	3.010	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](CN(C)Cc2c(C)noc2CC)C1	ZINC001029828629	1341088621	/nfs/dbraw/zinc/08/86/21/1341088621.db2.gz	GXWOOGJIMAPESZ-OXJNMPFZSA-N	0	3	347.503	3.428	20	30		EGEDHN
Cc1ccc2ccccc2c1CN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H](C)C#N	ZINC001032317618	1341494179	/nfs/dbraw/zinc/49/41/79/1341494179.db2.gz	XOYWHZAHHCQBIC-SZMVWBNQSA-N	0	3	333.435	3.093	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1	ZINC001032673952	1341578615	/nfs/dbraw/zinc/57/86/15/1341578615.db2.gz	IISHTDCILIFGFY-XLAORIBOSA-N	0	3	330.859	3.305	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cccn1C1CCCC1	ZINC001032703390	1341585573	/nfs/dbraw/zinc/58/55/73/1341585573.db2.gz	STQMQONMUIDIEF-ROUUACIJSA-N	0	3	327.472	3.468	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1c[nH]nc1C1CCCCC1	ZINC001032726716	1341593086	/nfs/dbraw/zinc/59/30/86/1341593086.db2.gz	PYCMPQJJILFZOX-IRXDYDNUSA-N	0	3	342.487	3.322	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cccc2c1OCC2(C)C	ZINC001032821013	1341626338	/nfs/dbraw/zinc/62/63/38/1341626338.db2.gz	HYTHJKGFDJRQGZ-HOTGVXAUSA-N	0	3	340.467	3.222	20	30		EGEDHN
C=CCCN1CC[C@@H](N(C)C(=O)c2ccc(-c3ccncc3)o2)C1	ZINC001033144060	1341738352	/nfs/dbraw/zinc/73/83/52/1341738352.db2.gz	QKQLESQBGNGNHS-MRXNPFEDSA-N	0	3	325.412	3.064	20	30		EGEDHN
C=CCn1cccc1C(=O)N(C)[C@H]1CCN(Cc2ccc(C)cc2)C1	ZINC001033146148	1341739552	/nfs/dbraw/zinc/73/95/52/1341739552.db2.gz	NYBYUXXSJVPISN-IBGZPJMESA-N	0	3	337.467	3.329	20	30		EGEDHN
C=CCCN1CC[C@@H](N(C)C(=O)c2sc(C)nc2CC(C)C)C1	ZINC001033235031	1341756268	/nfs/dbraw/zinc/75/62/68/1341756268.db2.gz	JOXDTYKEGUTQMI-OAHLLOKOSA-N	0	3	335.517	3.372	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@H]2CCN(Cc3ccc(COC)cc3)C2)C1	ZINC001033398185	1341812648	/nfs/dbraw/zinc/81/26/48/1341812648.db2.gz	HFHSLDWTMNUCDU-IBGZPJMESA-N	0	3	342.483	3.222	20	30		EGEDHN
C#CCCN1CC[C@@H](N(C)C(=O)c2cc(Cl)ccc2Cl)C1	ZINC001033608926	1341899795	/nfs/dbraw/zinc/89/97/95/1341899795.db2.gz	BNLZJCAMGIDJLC-CYBMUJFWSA-N	0	3	325.239	3.163	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2cscc2C(F)F)C1	ZINC001033830818	1342030967	/nfs/dbraw/zinc/03/09/67/1342030967.db2.gz	PCWUMJNSEOEWPL-GFCCVEGCSA-N	0	3	326.412	3.245	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2csc([C@H]3CCCO3)n2)C1	ZINC001033828803	1342028948	/nfs/dbraw/zinc/02/89/48/1342028948.db2.gz	RMGMVOKLPLPBPB-GDBMZVCRSA-N	0	3	349.500	3.107	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2cc(C(F)F)ccc2F)C1	ZINC001033830470	1342030921	/nfs/dbraw/zinc/03/09/21/1342030921.db2.gz	ITAHMVBLVAVPGW-CQSZACIVSA-N	0	3	338.373	3.323	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccc(C(C)(C)C)cn2)C1	ZINC001033838315	1342036151	/nfs/dbraw/zinc/03/61/51/1342036151.db2.gz	RSORKZJCZNHAAO-KRWDZBQOSA-N	0	3	329.488	3.492	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@@H]2CCN(C)c3ccccc32)C1	ZINC001033861260	1342049828	/nfs/dbraw/zinc/04/98/28/1342049828.db2.gz	FJPJLMDFNRVXRB-PKOBYXMFSA-N	0	3	341.499	3.109	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@@H]2COc3cc(C)c(C)cc32)C1	ZINC001033908060	1342079587	/nfs/dbraw/zinc/07/95/87/1342079587.db2.gz	LMUXGEWXHLMMAX-IEBWSBKVSA-N	0	3	342.483	3.278	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccc(F)c3ccncc23)C1	ZINC001033932299	1342095895	/nfs/dbraw/zinc/09/58/95/1342095895.db2.gz	KWOHZLDJQTVECQ-HNNXBMFYSA-N	0	3	341.430	3.486	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@@H]2CCc3ccccc3C2)C1	ZINC001033975343	1342124949	/nfs/dbraw/zinc/12/49/49/1342124949.db2.gz	MGDJCABEYXXXES-UXHICEINSA-N	0	3	326.484	3.290	20	30		EGEDHN
C#Cc1ccc(C(=O)N(CC)[C@@H]2CCN(Cc3ccc(C)cc3)C2)nc1	ZINC001034023184	1342160590	/nfs/dbraw/zinc/16/05/90/1342160590.db2.gz	OGUHVOUMWLIWFP-HXUWFJFHSA-N	0	3	347.462	3.108	20	30		EGEDHN
C=CCCN1C[C@@H]2CCN(C(=O)c3cc4ncccc4s3)[C@@H]2C1	ZINC001076123478	1356496742	/nfs/dbraw/zinc/49/67/42/1356496742.db2.gz	SUSFWKKYFWBURU-DZGCQCFKSA-N	0	3	327.453	3.019	20	30		EGEDHN
N#Cc1ccc(CN2CCCC[C@H](NC(=O)C3C=CC=CC=C3)C2)cc1	ZINC001034237440	1342338288	/nfs/dbraw/zinc/33/82/88/1342338288.db2.gz	WEYMYMQDHFCXSW-NRFANRHFSA-N	0	3	347.462	3.327	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cc(C)n([C@H](C)C3CC3)n2)C1	ZINC001034280114	1342369862	/nfs/dbraw/zinc/36/98/62/1342369862.db2.gz	BPXDRYBDJCIEQB-AEFFLSMTSA-N	0	3	344.503	3.323	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N[C@H]1CCCCN(Cc2ccc(C)cc2)C1	ZINC001034404718	1342468089	/nfs/dbraw/zinc/46/80/89/1342468089.db2.gz	VPZPXRGBGVUIPQ-ZCNNSNEGSA-N	0	3	342.483	3.057	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H]1CCCCN(Cc2ccc(C)cc2)C1	ZINC001034404715	1342468519	/nfs/dbraw/zinc/46/85/19/1342468519.db2.gz	VPZPXRGBGVUIPQ-AQNXPRMDSA-N	0	3	342.483	3.057	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)c2ncoc2-c2cccs2)C1	ZINC001034447583	1342508642	/nfs/dbraw/zinc/50/86/42/1342508642.db2.gz	ILSNMSTYXPLRLW-ZDUSSCGKSA-N	0	3	331.441	3.173	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)Cc2ccccc2OC(C)C)C1	ZINC001034454165	1342513264	/nfs/dbraw/zinc/51/32/64/1342513264.db2.gz	ZXYRLHHEFMGCNL-SFHVURJKSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cnn(CC3CCCC3)c2)C1	ZINC001034462094	1342518590	/nfs/dbraw/zinc/51/85/90/1342518590.db2.gz	IVMQDIRPHDZYRJ-LJQANCHMSA-N	0	3	344.503	3.234	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2)C1	ZINC001034507562	1342566068	/nfs/dbraw/zinc/56/60/68/1342566068.db2.gz	QUHPVKYNTJPTMC-OAHLLOKOSA-N	0	3	326.362	3.476	20	30		EGEDHN
C=CCCN1CCCC[C@H](NC(=O)c2ccc(P(C)(C)=O)cc2)C1	ZINC001034537531	1342595141	/nfs/dbraw/zinc/59/51/41/1342595141.db2.gz	MMKYWXOOKNVRPP-KRWDZBQOSA-N	0	3	348.427	3.095	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2ccccc2OCC2CC2)C1	ZINC001034540641	1342600137	/nfs/dbraw/zinc/60/01/37/1342600137.db2.gz	JOJHPZLHSPHDDW-SFHVURJKSA-N	0	3	340.467	3.083	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC[C@H](NCc3ccn(C(C)C)n3)CC2)C1	ZINC001034728145	1342723338	/nfs/dbraw/zinc/72/33/38/1342723338.db2.gz	AWVMPEXCDBUJHY-QAQDUYKDSA-N	0	3	344.503	3.337	20	30		EGEDHN
N#Cc1cc(CNCc2ccc(CNC(=O)C3CC3)cc2)ccc1F	ZINC001034805044	1342769188	/nfs/dbraw/zinc/76/91/88/1342769188.db2.gz	UPQRAIOHZYXQBI-UHFFFAOYSA-N	0	3	337.398	3.013	20	30		EGEDHN
N#Cc1ccc(CNCc2ccc(CNC(=O)C3CCC3)cc2)s1	ZINC001034806227	1342770640	/nfs/dbraw/zinc/77/06/40/1342770640.db2.gz	SRVTVBOESCTJEZ-UHFFFAOYSA-N	0	3	339.464	3.326	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)[C@@H]2CC=CCC2)s1	ZINC001034858184	1342808117	/nfs/dbraw/zinc/80/81/17/1342808117.db2.gz	FBHATFKDLIAFIG-HUUCEWRRSA-N	0	3	329.469	3.057	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@@H]1CNC1c2ccccc2-c2ccccc21	ZINC001034887604	1342821571	/nfs/dbraw/zinc/82/15/71/1342821571.db2.gz	YFFVHPGSUWIWLD-HZPDHXFCSA-N	0	3	345.446	3.497	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)CCC2CCC2)s1	ZINC001034899626	1342827785	/nfs/dbraw/zinc/82/77/85/1342827785.db2.gz	BKZXFPSZDJGAHP-OAHLLOKOSA-N	0	3	331.485	3.281	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)C2CCC(F)CC2)s1	ZINC001035037587	1342891360	/nfs/dbraw/zinc/89/13/60/1342891360.db2.gz	ZWFODLZONYTHTE-YMAMQOFZSA-N	0	3	349.475	3.229	20	30		EGEDHN
CC(C)CC(=O)N1CCC2(CCN(CC#Cc3ccccc3)C2)CC1	ZINC001035149716	1342962389	/nfs/dbraw/zinc/96/23/89/1342962389.db2.gz	HWCZJCJBMRUZCM-UHFFFAOYSA-N	0	3	338.495	3.399	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC2(CCN(Cc3cnoc3C)C2)CC1	ZINC001035213236	1343031519	/nfs/dbraw/zinc/03/15/19/1343031519.db2.gz	GPFYBOCEOQBJSO-UHFFFAOYSA-N	0	3	345.487	3.400	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC2(CN(Cc3ccc(C(F)F)cc3)C2)CC1	ZINC001035671708	1343130903	/nfs/dbraw/zinc/13/09/03/1343130903.db2.gz	XIIDWEKJMPVCIY-AWEZNQCLSA-N	0	3	347.409	3.208	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cc1ccc(F)cc1F)CC2	ZINC001035709888	1343145240	/nfs/dbraw/zinc/14/52/40/1343145240.db2.gz	MOWGJDZZBQKFAL-UHFFFAOYSA-N	0	3	334.410	3.008	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc3ncccc3s1)CC2	ZINC001035760030	1343174476	/nfs/dbraw/zinc/17/44/76/1343174476.db2.gz	BAABXTPZPUAZFM-UHFFFAOYSA-N	0	3	341.480	3.410	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cccc3ncccc31)CC2	ZINC001035760526	1343174594	/nfs/dbraw/zinc/17/45/94/1343174594.db2.gz	CKNBLRSPQVIXAB-UHFFFAOYSA-N	0	3	335.451	3.349	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cnc3ccsc3c1)CC2	ZINC001035765741	1343178296	/nfs/dbraw/zinc/17/82/96/1343178296.db2.gz	DMENXZILTFYIOS-UHFFFAOYSA-N	0	3	341.480	3.410	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cc(C(C)(C)C)oc1C)CC2	ZINC001035805041	1343206812	/nfs/dbraw/zinc/20/68/12/1343206812.db2.gz	AFNLBMAQYWIVTK-UHFFFAOYSA-N	0	3	342.483	3.447	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)CO[C@@H]1CCCC[C@H]1C)CC2	ZINC001035807918	1343208050	/nfs/dbraw/zinc/20/80/50/1343208050.db2.gz	XCOWNSDNHYPVSD-QZTJIDSGSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C(C)(C)c1ccccc1)CC2	ZINC001035847017	1343227514	/nfs/dbraw/zinc/22/75/14/1343227514.db2.gz	FGPDULJOYRFWOJ-UHFFFAOYSA-N	0	3	326.484	3.465	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)COc1c(C)cccc1C)CC2	ZINC001035847536	1343228093	/nfs/dbraw/zinc/22/80/93/1343228093.db2.gz	MYEWFKZDPFXGBA-UHFFFAOYSA-N	0	3	342.483	3.183	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@H](C)c1ccc(F)c(F)c1)CC2	ZINC001035855622	1343232770	/nfs/dbraw/zinc/23/27/70/1343232770.db2.gz	RCSDKOTYKBHFLW-OAHLLOKOSA-N	0	3	346.421	3.016	20	30		EGEDHN
C[C@H]1CN(C(=O)CC2CCC2)CC[C@@H]1NCc1ccccc1C#N	ZINC001035977773	1343296798	/nfs/dbraw/zinc/29/67/98/1343296798.db2.gz	OKDFTUHDSVPGSK-KXBFYZLASA-N	0	3	325.456	3.075	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@@H](NCc2ccccc2C#N)[C@@H](C)C1	ZINC001035981586	1343299459	/nfs/dbraw/zinc/29/94/59/1343299459.db2.gz	SVCMBLOTPJITNO-WMLDXEAASA-N	0	3	329.419	3.148	20	30		EGEDHN
C[C@@H]1CN(C(=O)C(C)(C)C2CC2)CC[C@@H]1NCc1ccccc1C#N	ZINC001036143293	1343325987	/nfs/dbraw/zinc/32/59/87/1343325987.db2.gz	BOJFHINWFCCBKS-BEFAXECRSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](NCc2cc(C3CC3)no2)[C@@H](C)C1	ZINC001036144557	1343327107	/nfs/dbraw/zinc/32/71/07/1343327107.db2.gz	SWQQFDISHUORCP-XJKSGUPXSA-N	0	3	331.460	3.091	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](NCc2csc(CC)n2)[C@H](C)C1	ZINC001036148716	1343330342	/nfs/dbraw/zinc/33/03/42/1343330342.db2.gz	FTCCTYNWPYLDRW-HIFRSBDPSA-N	0	3	335.517	3.244	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2(CF)CCC2)CC[C@H]1NCc1ccccc1C#N	ZINC001036190267	1343354532	/nfs/dbraw/zinc/35/45/32/1343354532.db2.gz	YTBPLKPLFYGRRP-CRAIPNDOSA-N	0	3	343.446	3.025	20	30		EGEDHN
C[C@H](NCc1cc(F)ccc1C#N)[C@@H]1CCCN(C(=O)C2CCC2)C1	ZINC001036340194	1343425856	/nfs/dbraw/zinc/42/58/56/1343425856.db2.gz	PRVCVBZUJKHBKJ-WMLDXEAASA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCCN(C(=O)c2ccoc2)C1	ZINC001036361505	1343442935	/nfs/dbraw/zinc/44/29/35/1343442935.db2.gz	JUBJJVAYOMUOBM-MAUKXSAKSA-N	0	3	337.423	3.182	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCCN(C(=O)CC(C)(F)F)C1	ZINC001036437872	1343487038	/nfs/dbraw/zinc/48/70/38/1343487038.db2.gz	JJVJVQYVECNVON-PBHICJAKSA-N	0	3	349.425	3.320	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]([C@@H](C)NCc2nc(C)cs2)C1	ZINC001036439698	1343488498	/nfs/dbraw/zinc/48/84/98/1343488498.db2.gz	LMSNPFNQDVEHAD-HUUCEWRRSA-N	0	3	335.517	3.380	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]([C@H](C)NCc2cc(C)no2)C1	ZINC001036442238	1343489786	/nfs/dbraw/zinc/48/97/86/1343489786.db2.gz	SKUGOCPJGIJOKD-JKSUJKDBSA-N	0	3	333.476	3.302	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@H](C)[C@H]2CNCc2cnoc2C)CC1	ZINC001036574589	1343561201	/nfs/dbraw/zinc/56/12/01/1343561201.db2.gz	NXLGPRQCYKPHFN-HNAYVOBHSA-N	0	3	345.487	3.446	20	30		EGEDHN
O=C(C1CC1)N1CC[C@@H]2[C@H](CCN2CC#Cc2ccc(Cl)cc2)C1	ZINC001036613500	1343574835	/nfs/dbraw/zinc/57/48/35/1343574835.db2.gz	IIEZCODMZYCWKP-IEBWSBKVSA-N	0	3	342.870	3.024	20	30		EGEDHN
CC(C)(C)CC(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccccc2C#N)C1	ZINC001036641858	1343595729	/nfs/dbraw/zinc/59/57/29/1343595729.db2.gz	HRDVWSYUDPGONB-RTBURBONSA-N	0	3	339.483	3.417	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccccc2C#N)C1	ZINC001036687124	1343630026	/nfs/dbraw/zinc/63/00/26/1343630026.db2.gz	XSIARGSBLQMTAT-QZTJIDSGSA-N	0	3	341.430	3.244	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@@H]3[C@@H](CCN3CC#Cc3ccccc3)C2)co1	ZINC001036699573	1343638681	/nfs/dbraw/zinc/63/86/81/1343638681.db2.gz	RJZIDPIFVADKGK-PZJWPPBQSA-N	0	3	348.446	3.176	20	30		EGEDHN
CC(C(=O)N1CC[C@@H]2[C@H](CCN2CC#Cc2ccccc2)C1)=C1CCC1	ZINC001036714268	1343647290	/nfs/dbraw/zinc/64/72/90/1343647290.db2.gz	VKGZOMVCINKOAZ-FGZHOGPDSA-N	0	3	348.490	3.461	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2[C@H](CCN2Cc2cnc(C)s2)C1	ZINC001036792466	1343724125	/nfs/dbraw/zinc/72/41/25/1343724125.db2.gz	PPKINKCEWWTPIX-WBVHZDCISA-N	0	3	347.528	3.477	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]3[C@H](CCN3CC#Cc3ccccc3)C2)C1	ZINC001036815249	1343752506	/nfs/dbraw/zinc/75/25/06/1343752506.db2.gz	BGMCQBBQLCNBIO-RTWAWAEBSA-N	0	3	348.490	3.317	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccc(C#N)c(F)c2)C1	ZINC001036876353	1343815204	/nfs/dbraw/zinc/81/52/04/1343815204.db2.gz	OEUKYDUHQICXJG-SJLPKXTDSA-N	0	3	343.446	3.166	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCC[C@@H]1NC(=O)c1cccs1	ZINC001036933893	1343877426	/nfs/dbraw/zinc/87/74/26/1343877426.db2.gz	GAIHCVQLKATMIU-IRXDYDNUSA-N	0	3	339.464	3.308	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@@H]1CCC[C@H]1NC(=O)CC1CCC1	ZINC001036971001	1343900062	/nfs/dbraw/zinc/90/00/62/1343900062.db2.gz	VDXAOAHNIQOVOS-QFBILLFUSA-N	0	3	343.446	3.262	20	30		EGEDHN
Cc1cc(C(=O)N[C@H]2CCC[C@H]2CNCc2ccccc2C#N)co1	ZINC001036995059	1343917293	/nfs/dbraw/zinc/91/72/93/1343917293.db2.gz	ZVZPITFCHWMPAV-HKUYNNGSSA-N	0	3	337.423	3.148	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCC[C@@H]2CNCc2csc(C)n2)C1	ZINC001037071210	1343964743	/nfs/dbraw/zinc/96/47/43/1343964743.db2.gz	CQDBOBWVGIFRQE-ZBFHGGJFSA-N	0	3	333.501	3.182	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCC[C@@H]2CNCc2csc(CC)n2)C1	ZINC001037071434	1343964884	/nfs/dbraw/zinc/96/48/84/1343964884.db2.gz	HCHABRXGSRRJDN-ZBFHGGJFSA-N	0	3	347.528	3.436	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@H]1CCCC[C@@H]1NC(=O)C1CCC1	ZINC001037139170	1343989145	/nfs/dbraw/zinc/98/91/45/1343989145.db2.gz	MIODYIYHDRABJK-APWZRJJASA-N	0	3	343.446	3.262	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCC[C@H]1NC(=O)CC1CC1	ZINC001037148969	1344000033	/nfs/dbraw/zinc/00/00/33/1344000033.db2.gz	MDEWOGXAMXPWNM-RTBURBONSA-N	0	3	325.456	3.123	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@@H]1CCCC[C@H]1NC(=O)CC1CC1	ZINC001037148973	1344000077	/nfs/dbraw/zinc/00/00/77/1344000077.db2.gz	MDSYMDDYGAYKGU-QFBILLFUSA-N	0	3	343.446	3.262	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCC[C@H]1NC(=O)c1ccccn1	ZINC001037159646	1344009220	/nfs/dbraw/zinc/00/92/20/1344009220.db2.gz	GYYCXJYKVQFOEB-RBUKOAKNSA-N	0	3	348.450	3.032	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCC[C@@H]1NC(=O)C1=CCCC1	ZINC001037199149	1344036685	/nfs/dbraw/zinc/03/66/85/1344036685.db2.gz	WNKQOVMSVKDOKX-PMACEKPBSA-N	0	3	337.467	3.433	20	30		EGEDHN
CC[C@@H]1CN(C(=O)CC2CC2)CC[C@@H]1NCc1cc(F)ccc1C#N	ZINC001037756903	1344073539	/nfs/dbraw/zinc/07/35/39/1344073539.db2.gz	FTUZDONDPPMXLO-BEFAXECRSA-N	0	3	343.446	3.214	20	30		EGEDHN
CC[C@H]1CN(C(=O)C(C)(C)F)CC[C@H]1NCc1cc(F)ccc1C#N	ZINC001037760663	1344075515	/nfs/dbraw/zinc/07/55/15/1344075515.db2.gz	HIQLMLRLGHGSND-SUMWQHHRSA-N	0	3	349.425	3.162	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1cc(F)cc2ccncc21	ZINC001038259390	1344348273	/nfs/dbraw/zinc/34/82/73/1344348273.db2.gz	GGXFSSDNYAGCKY-MRXNPFEDSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@@H]1CCN1CCC1CCCCC1	ZINC001038352448	1344392982	/nfs/dbraw/zinc/39/29/82/1344392982.db2.gz	HOBDGLHIGOIPKO-SFHVURJKSA-N	0	3	329.488	3.449	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1ccc(-c2cnco2)cc1	ZINC001038421174	1344421729	/nfs/dbraw/zinc/42/17/29/1344421729.db2.gz	YUALSMGRDZTUAH-KRWDZBQOSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NC[C@@H]1CCN1CCCC1CCCC1	ZINC001038809036	1344591953	/nfs/dbraw/zinc/59/19/53/1344591953.db2.gz	WGXFIWNFUPCXPA-FHWLQOOXSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1ncoc1-c1cccs1	ZINC001038818490	1344595684	/nfs/dbraw/zinc/59/56/84/1344595684.db2.gz	RWMVUJIRZVLYDV-ZDUSSCGKSA-N	0	3	331.441	3.173	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](c2ccc(F)cc2)[C@H](NCCF)C1	ZINC001079156955	1357197641	/nfs/dbraw/zinc/19/76/41/1357197641.db2.gz	QPRQIAXGCIRPIH-DLBZAZTESA-N	0	3	336.426	3.282	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H](C)C(C)(C)C)CC[C@H]1c1ccc(F)cc1	ZINC001079154410	1357198033	/nfs/dbraw/zinc/19/80/33/1357198033.db2.gz	BNCGEOOANJZXDF-AYOQOUSVSA-N	0	3	344.474	3.415	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2csc3c2CC[C@H](C)C3)C1	ZINC001080887799	1357759019	/nfs/dbraw/zinc/75/90/19/1357759019.db2.gz	PRQBBQSGILVDDA-JJRVBVJISA-N	0	3	332.513	3.499	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)c3ccc(C)n3C)CC2)C1	ZINC001039098595	1344770417	/nfs/dbraw/zinc/77/04/17/1344770417.db2.gz	RFRPHGCCPXDHQA-KRWDZBQOSA-N	0	3	349.906	3.260	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)c3cscn3)CC2)C1	ZINC001039121874	1344796903	/nfs/dbraw/zinc/79/69/03/1344796903.db2.gz	LVNJWONFQAVOQB-AWEZNQCLSA-N	0	3	339.892	3.070	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)[C@H]3CC34CCC4)CC2)C1	ZINC001039162306	1344848138	/nfs/dbraw/zinc/84/81/38/1344848138.db2.gz	UQYMCINNFJCCJS-IAGOWNOFSA-N	0	3	336.907	3.490	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2sc(C)cc2C)C1	ZINC001039208910	1344921273	/nfs/dbraw/zinc/92/12/73/1344921273.db2.gz	GLNHKNTUBMDQQN-SJORKVTESA-N	0	3	330.497	3.315	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(C)c(F)cc2F)C1	ZINC001039210523	1344924325	/nfs/dbraw/zinc/92/43/25/1344924325.db2.gz	BGYJSFJLUILAAC-BEFAXECRSA-N	0	3	346.421	3.223	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cccc(F)c2C)C1	ZINC001039211762	1344926698	/nfs/dbraw/zinc/92/66/98/1344926698.db2.gz	VBHQEJREDMSDRB-VQIMIIECSA-N	0	3	328.431	3.084	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)CCc2ccc(C)cc2)C1	ZINC001039218417	1344935898	/nfs/dbraw/zinc/93/58/98/1344935898.db2.gz	LQTXDUPOPSRHSV-NHCUHLMSSA-N	0	3	338.495	3.264	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc[nH]c2C(C)C)C1	ZINC001039224928	1344943127	/nfs/dbraw/zinc/94/31/27/1344943127.db2.gz	KYCRPDBXBBXMTJ-IEBWSBKVSA-N	0	3	341.499	3.478	20	30		EGEDHN
C=C1CCC(C(=O)N2CCCC[C@@H]2[C@@H]2CCN(CC#CC)C2)CC1	ZINC001039233052	1344952515	/nfs/dbraw/zinc/95/25/15/1344952515.db2.gz	ZMDLYGDRKDLYQP-WOJBJXKFSA-N	0	3	328.500	3.459	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cccc3c2ccn3C)C1	ZINC001039232871	1344952906	/nfs/dbraw/zinc/95/29/06/1344952906.db2.gz	ZGECQWYNJVREIN-YLJYHZDGSA-N	0	3	349.478	3.128	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)Cc2ccc(CC)cc2)C1	ZINC001039236379	1344957768	/nfs/dbraw/zinc/95/77/68/1344957768.db2.gz	BCACOYGQISAHBO-SFTDATJTSA-N	0	3	338.495	3.128	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc3cc[nH]c3c2)C1	ZINC001039236478	1344958341	/nfs/dbraw/zinc/95/83/41/1344958341.db2.gz	CQQWCSKDXZHSHU-QUCCMNQESA-N	0	3	335.451	3.118	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)Cc2ccccc2Cl)C1	ZINC001039239506	1344963855	/nfs/dbraw/zinc/96/38/55/1344963855.db2.gz	NPWUHNWFOZJXSC-MJGOQNOKSA-N	0	3	344.886	3.219	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccoc2C2CC2)C1	ZINC001039242108	1344967893	/nfs/dbraw/zinc/96/78/93/1344967893.db2.gz	ADWJIXIEHZKEIU-MJGOQNOKSA-N	0	3	340.467	3.497	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc(C)c(F)c(C)c2)C1	ZINC001039244611	1344972790	/nfs/dbraw/zinc/97/27/90/1344972790.db2.gz	YGIXLWNYNLGECR-IEBWSBKVSA-N	0	3	342.458	3.392	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(C)c(F)c(C)c2)C1	ZINC001039244613	1344973260	/nfs/dbraw/zinc/97/32/60/1344973260.db2.gz	YGIXLWNYNLGECR-MJGOQNOKSA-N	0	3	342.458	3.392	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc(CC)c(CC)o2)C1	ZINC001039247561	1344976895	/nfs/dbraw/zinc/97/68/95/1344976895.db2.gz	XDJDDBFAJURFJW-QZTJIDSGSA-N	0	3	342.483	3.354	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)Cc2sc(C)cc2C)C1	ZINC001039250566	1344982146	/nfs/dbraw/zinc/98/21/46/1344982146.db2.gz	PLFUGKBWJAEZGS-ROUUACIJSA-N	0	3	344.524	3.244	20	30		EGEDHN
C=C(CN1CCCC1)C(=O)Nc1sc2c(c1C(=O)OCC)CCC2	ZINC001183027091	1387254551	/nfs/dbraw/zinc/25/45/51/1387254551.db2.gz	JGGVNXZUOJTZLI-UHFFFAOYSA-N	0	3	348.468	3.004	20	30		EGEDHN
CCc1ccc(CN2CC[C@H]3CC[C@@H](C2)N3C(=O)C#CC2CC2)cc1	ZINC001039373151	1345032051	/nfs/dbraw/zinc/03/20/51/1345032051.db2.gz	GXACAUFWEHAEED-RTWAWAEBSA-N	0	3	336.479	3.228	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc(OC)cc1C	ZINC001039381179	1345036632	/nfs/dbraw/zinc/03/66/32/1345036632.db2.gz	YORZJZUHAAUKTR-MOPGFXCFSA-N	0	3	342.483	3.188	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1C[C@H]1c1ccsc1	ZINC001039395037	1345043846	/nfs/dbraw/zinc/04/38/46/1345043846.db2.gz	UFLINCRQVCPEKQ-VSZNYVQBSA-N	0	3	330.497	3.493	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@H](C)c1c(C)n[nH]c1C	ZINC001039395710	1345044548	/nfs/dbraw/zinc/04/45/48/1345044548.db2.gz	GSPWCGVJNHLOCK-QGTPRVQTSA-N	0	3	344.503	3.162	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(Cl)ccc1F	ZINC001039402414	1345048344	/nfs/dbraw/zinc/04/83/44/1345048344.db2.gz	WHFSOFMKKVTVFT-CABCVRRESA-N	0	3	334.822	3.181	20	30		EGEDHN
C=CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1c(C)onc1C1CC1	ZINC001039405967	1345050708	/nfs/dbraw/zinc/05/07/08/1345050708.db2.gz	RKPINTUWHRTMDU-CVEARBPZSA-N	0	3	329.444	3.115	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1nccc2ccccc21	ZINC001039426141	1345062693	/nfs/dbraw/zinc/06/26/93/1345062693.db2.gz	RMJWCEQUZPKCDK-MSOLQXFVSA-N	0	3	335.451	3.490	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1c(C)cccc1Cl	ZINC001039429748	1345064315	/nfs/dbraw/zinc/06/43/15/1345064315.db2.gz	ZVAIQEATRIBKEI-CVEARBPZSA-N	0	3	330.859	3.351	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccccc1C1(C)CC1	ZINC001039435192	1345066646	/nfs/dbraw/zinc/06/66/46/1345066646.db2.gz	WXISJRPGTILRSM-MSOLQXFVSA-N	0	3	336.479	3.440	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2c(c1)C[C@@H](C)O2	ZINC001039452198	1345075149	/nfs/dbraw/zinc/07/51/49/1345075149.db2.gz	LMKRJRISPCWXDT-LZQZEXGQSA-N	0	3	340.467	3.265	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2ccn(C)c2c1	ZINC001039457606	1345077622	/nfs/dbraw/zinc/07/76/22/1345077622.db2.gz	AWYZIMRKVDWTOY-MOPGFXCFSA-N	0	3	337.467	3.433	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)CCc1c[nH]c2ccccc12	ZINC001039466273	1345084325	/nfs/dbraw/zinc/08/43/25/1345084325.db2.gz	BRUUWLPHWRRPHH-MSOLQXFVSA-N	0	3	337.467	3.352	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CCC[C@@H](C1)N2C[C@@H]1CCO[C@@H](C)C1	ZINC001039820634	1345199546	/nfs/dbraw/zinc/19/95/46/1345199546.db2.gz	KEIZOOBQLLMVCW-XWTMOSNGSA-N	0	3	334.504	3.079	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@]3(CCN(C(=O)c4ccoc4)C3)C2)cc1	ZINC001040069323	1345320453	/nfs/dbraw/zinc/32/04/53/1345320453.db2.gz	DBTOCPWSNGFXJC-NRFANRHFSA-N	0	3	349.434	3.280	20	30		EGEDHN
CC[C@H](C)C(=O)N1CC[C@]2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001040084242	1345329783	/nfs/dbraw/zinc/32/97/83/1345329783.db2.gz	RZADBQAHAKTBQG-LAUBAEHRSA-N	0	3	339.483	3.419	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cn(C(C)(C)C)nc3C)C2)C1	ZINC001040200042	1345372471	/nfs/dbraw/zinc/37/24/71/1345372471.db2.gz	FHJKPVVDXOZROR-FQEVSTJZSA-N	0	3	344.503	3.061	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3sc(Cl)nc3C)C2)C1	ZINC001040227318	1345384386	/nfs/dbraw/zinc/38/43/86/1345384386.db2.gz	DQPKPGKDJPNEAP-INIZCTEOSA-N	0	3	339.892	3.219	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cnn(C(C)(C)C)c3C)C2)C1	ZINC001040231798	1345387291	/nfs/dbraw/zinc/38/72/91/1345387291.db2.gz	KXQWKFIVWJLITM-FQEVSTJZSA-N	0	3	344.503	3.061	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cc4c(o3)CCCC4)C2)C1	ZINC001040237156	1345389451	/nfs/dbraw/zinc/38/94/51/1345389451.db2.gz	RGQMXWLYZYJRAA-OAQYLSRUSA-N	0	3	340.467	3.110	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cc4ccncc4s3)C2)C1	ZINC001040240496	1345390839	/nfs/dbraw/zinc/39/08/39/1345390839.db2.gz	HFKOEBIUBJWKHW-LJQANCHMSA-N	0	3	341.480	3.410	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)CCc3ccc(C)cc3)C2)C1	ZINC001040288458	1345413084	/nfs/dbraw/zinc/41/30/84/1345413084.db2.gz	FCWFKUMMSBPLDO-JOCHJYFZSA-N	0	3	338.495	3.265	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cccc4c3O[C@H](C)C4)C2)C1	ZINC001040301440	1345422055	/nfs/dbraw/zinc/42/20/55/1345422055.db2.gz	YJANBRIZANRKGZ-IIBYNOLFSA-N	0	3	340.467	3.124	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cc4ccc(C)cc4[nH]3)C2)C1	ZINC001040318577	1345428435	/nfs/dbraw/zinc/42/84/35/1345428435.db2.gz	VOGLRPXPOZIPDM-JOCHJYFZSA-N	0	3	349.478	3.428	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3cc4c(ccc(C)c4C)[nH]3)C2)C1	ZINC001040322055	1345430760	/nfs/dbraw/zinc/43/07/60/1345430760.db2.gz	HGSHRUJRCRZHTJ-QFIPXVFZSA-N	0	3	349.478	3.346	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3scnc3C(C)C)C2)C1	ZINC001040443235	1345502604	/nfs/dbraw/zinc/50/26/04/1345502604.db2.gz	IEDVOZVZWXDKEI-IBGZPJMESA-N	0	3	345.512	3.218	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3ccc4nc(C)ccc4c3)C2)C1	ZINC001040461016	1345510131	/nfs/dbraw/zinc/51/01/31/1345510131.db2.gz	UTVYGHHJBRJIOM-QFIPXVFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@H]3CC[C@H](C(C)C)CC3)C2)C1	ZINC001040471981	1345511097	/nfs/dbraw/zinc/51/10/97/1345511097.db2.gz	VEGAZGWJRGKGHT-ZJOUEHCJSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@H](C)c3ccc(C)s3)C2)C1	ZINC001040492005	1345517730	/nfs/dbraw/zinc/51/77/30/1345517730.db2.gz	KTDJPZSWUXLXBC-VQIMIIECSA-N	0	3	330.497	3.108	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cc4c(C)cccn4c3)C2)C1	ZINC001040492659	1345518341	/nfs/dbraw/zinc/51/83/41/1345518341.db2.gz	UENQKMSDEGOBBS-JOCHJYFZSA-N	0	3	349.478	3.199	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)C(C)(C)c3ccc(C)cc3)C2)C1	ZINC001040500746	1345522025	/nfs/dbraw/zinc/52/20/25/1345522025.db2.gz	PWFTTWYLASOTIR-JOCHJYFZSA-N	0	3	338.495	3.220	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)C(C)(C)c3ccc(C)cc3)C2)C1	ZINC001040500747	1345522030	/nfs/dbraw/zinc/52/20/30/1345522030.db2.gz	PWFTTWYLASOTIR-QFIPXVFZSA-N	0	3	338.495	3.220	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)C34CC5CC(CC(C5)C3)C4)C2)C1	ZINC001040508211	1345525274	/nfs/dbraw/zinc/52/52/74/1345525274.db2.gz	YSQLRHMXUQLTSL-RKRCHRGQSA-N	0	3	340.511	3.151	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cc4[nH]ccc4s3)C2)C1	ZINC001040510197	1345526307	/nfs/dbraw/zinc/52/63/07/1345526307.db2.gz	MGYLLIINXOEIFQ-IBGZPJMESA-N	0	3	341.480	3.181	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3ccccc3OCC)C2)C1	ZINC001040515420	1345529199	/nfs/dbraw/zinc/52/91/99/1345529199.db2.gz	JXSBMELAWYIZSD-FQEVSTJZSA-N	0	3	328.456	3.199	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cc4ccccc4[nH]3)C2)C1	ZINC001040521899	1345532000	/nfs/dbraw/zinc/53/20/00/1345532000.db2.gz	DGXYHECTAANZSW-NRFANRHFSA-N	0	3	335.451	3.119	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cn(C)c4ccccc34)C2)CC1	ZINC001040764512	1345576333	/nfs/dbraw/zinc/57/63/33/1345576333.db2.gz	XIMUYRUVSOKHKX-UHFFFAOYSA-N	0	3	349.478	3.130	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccc(-c4ccco4)o3)C2)CC1	ZINC001040767932	1345577040	/nfs/dbraw/zinc/57/70/40/1345577040.db2.gz	KVVNYAFCWKCUEG-UHFFFAOYSA-N	0	3	338.407	3.101	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)C3(C4CCC4)CCC3)C2)CC1	ZINC001040792019	1345578479	/nfs/dbraw/zinc/57/84/79/1345578479.db2.gz	WKOYBTUNKPDBTR-UHFFFAOYSA-N	0	3	328.500	3.295	20	30		EGEDHN
CC[C@H](F)C(=O)N1CCC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001040804384	1345580258	/nfs/dbraw/zinc/58/02/58/1345580258.db2.gz	RQXJSACCASEKDS-SFHVURJKSA-N	0	3	343.446	3.121	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@H](c3ccccc3)C(C)C)C2)CC1	ZINC001040870113	1345591375	/nfs/dbraw/zinc/59/13/75/1345591375.db2.gz	UJIYQGFXWMVVEM-FQEVSTJZSA-N	0	3	338.495	3.374	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@H](CC)OC3CCCC3)C2)CC1	ZINC001040872312	1345591565	/nfs/dbraw/zinc/59/15/65/1345591565.db2.gz	ZQFKKTRTJMEKKT-IBGZPJMESA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)C[C@H](C)c3ccccc3C)C2)CC1	ZINC001040875170	1345592599	/nfs/dbraw/zinc/59/25/99/1345592599.db2.gz	UQXNNPOZOZZSSB-IBGZPJMESA-N	0	3	338.495	3.436	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)C[C@@H]3CCc4ccccc43)C2)CC1	ZINC001040890354	1345594420	/nfs/dbraw/zinc/59/44/20/1345594420.db2.gz	RJMBBRQTACGVCZ-IBGZPJMESA-N	0	3	336.479	3.054	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cc(C)c(CC)s3)C2)CC1	ZINC001040930004	1345603266	/nfs/dbraw/zinc/60/32/66/1345603266.db2.gz	IEICADHGWVZTDH-UHFFFAOYSA-N	0	3	330.497	3.180	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccc(Cl)s3)C2)CC1	ZINC001040931239	1345604044	/nfs/dbraw/zinc/60/40/44/1345604044.db2.gz	JDUSWMDDYNXJBJ-UHFFFAOYSA-N	0	3	336.888	3.353	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)CCc3c[nH]c4ccccc34)C2)CC1	ZINC001040931502	1345604402	/nfs/dbraw/zinc/60/44/02/1345604402.db2.gz	PSXNGLRAGVOVRI-UHFFFAOYSA-N	0	3	349.478	3.048	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccc(C(C)C)s3)C2)CC1	ZINC001040954427	1345610286	/nfs/dbraw/zinc/61/02/86/1345610286.db2.gz	ZHUZNGCYEAXWQL-UHFFFAOYSA-N	0	3	330.497	3.433	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3oc4ccc(F)cc4c3C)C2)C1	ZINC001041352771	1345707975	/nfs/dbraw/zinc/70/79/75/1345707975.db2.gz	BHYHLJYYGNSGLS-FQEVSTJZSA-N	0	3	340.398	3.052	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)[C@@H]3CCCc4ccccc43)C2)C1	ZINC001041406987	1345720332	/nfs/dbraw/zinc/72/03/32/1345720332.db2.gz	FSEWISYTIBCDLO-IRLDBZIGSA-N	0	3	336.479	3.054	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)CCc3ccc(C)c(Cl)c3)C2)C1	ZINC001041514823	1345749561	/nfs/dbraw/zinc/74/95/61/1345749561.db2.gz	LMDIGEAQPZDRHX-FQEVSTJZSA-N	0	3	344.886	3.139	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3csc4ccccc34)C2)C1	ZINC001041520731	1345752251	/nfs/dbraw/zinc/75/22/51/1345752251.db2.gz	WBLCSQJZVRZUIN-HXUWFJFHSA-N	0	3	338.476	3.463	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)[C@H](C)c3ccc(Cl)cc3)C2)C1	ZINC001041633861	1345803930	/nfs/dbraw/zinc/80/39/30/1345803930.db2.gz	ZSHNSNGXKSZONM-DNVCBOLYSA-N	0	3	330.859	3.001	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@]2(CCN(CCC(F)(F)F)C2)C1	ZINC001041638118	1345805504	/nfs/dbraw/zinc/80/55/04/1345805504.db2.gz	IGWICBPGJOUWSJ-HOTGVXAUSA-N	0	3	332.410	3.466	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@]3(CCN(Cc4cccc(C#N)c4)C3)C2)C1	ZINC001041652592	1345810931	/nfs/dbraw/zinc/81/09/31/1345810931.db2.gz	KUZHSWXFHDCSQW-JOCHJYFZSA-N	0	3	349.478	3.339	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cc4occc4s3)C2)C1	ZINC001041672574	1345817698	/nfs/dbraw/zinc/81/76/98/1345817698.db2.gz	QSKSWIUBABDENF-SFHVURJKSA-N	0	3	328.437	3.056	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccc(C(C)C)nc3C)C2)C1	ZINC001041691955	1345821519	/nfs/dbraw/zinc/82/15/19/1345821519.db2.gz	HOXBRQSGTNAUQB-OAQYLSRUSA-N	0	3	339.483	3.075	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccc(C)cc3Cl)C2)C1	ZINC001041703276	1345822939	/nfs/dbraw/zinc/82/29/39/1345822939.db2.gz	FIDLMATZRUVEQG-LJQANCHMSA-N	0	3	330.859	3.210	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)[C@@H]3C[C@H]3c3ccc(C)s3)C2)C1	ZINC001041730402	1345834755	/nfs/dbraw/zinc/83/47/55/1345834755.db2.gz	NSFIAPBJIORSGX-MBOZVWFJSA-N	0	3	342.508	3.108	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cc(Cl)ccc3C)C2)C1	ZINC001041745063	1345838855	/nfs/dbraw/zinc/83/88/55/1345838855.db2.gz	PYYCBAODAGSWLL-IBGZPJMESA-N	0	3	330.859	3.210	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)C(C)(C)c3ccc(C)cc3)C2)C1	ZINC001041793344	1345852103	/nfs/dbraw/zinc/85/21/03/1345852103.db2.gz	JTMWZBADJDPDNO-QFIPXVFZSA-N	0	3	338.495	3.220	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3c(Cl)cccc3Cl)C2)C1	ZINC001041801009	1345855570	/nfs/dbraw/zinc/85/55/70/1345855570.db2.gz	DNISQTCKMYCTEI-KRWDZBQOSA-N	0	3	337.250	3.165	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3sccc3C3CC3)C2)C1	ZINC001041816110	1345861172	/nfs/dbraw/zinc/86/11/72/1345861172.db2.gz	LCDWCGQLAGDQMS-IBGZPJMESA-N	0	3	328.481	3.187	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cc(C)n(C(C)C)c3C)C2)C1	ZINC001041821640	1345863641	/nfs/dbraw/zinc/86/36/41/1345863641.db2.gz	KPIRPIOGMDZXLF-OAQYLSRUSA-N	0	3	341.499	3.247	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3cc4c(s3)CC[C@@H](C)C4)C2)C1	ZINC001041825435	1345864758	/nfs/dbraw/zinc/86/47/58/1345864758.db2.gz	LERXTYYNVSDXPM-FOIQADDNSA-N	0	3	342.508	3.044	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cnc(C(C)(C)C)s3)C2)C1	ZINC001041846942	1345872099	/nfs/dbraw/zinc/87/20/99/1345872099.db2.gz	FETMCAHMSKHUKX-IBGZPJMESA-N	0	3	345.512	3.002	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cccc(C(F)F)c3F)C[C@H]21	ZINC001042065327	1345933588	/nfs/dbraw/zinc/93/35/88/1345933588.db2.gz	RGLNXQWAWVYVRL-SWLSCSKDSA-N	0	3	338.373	3.486	20	30		EGEDHN
C#CCN1CC[C@H]2CCN(C(=O)CC(C)(C)c3ccc(F)cc3)C[C@@H]21	ZINC001042095506	1345942857	/nfs/dbraw/zinc/94/28/57/1345942857.db2.gz	NCABRUGSVJYWFG-LPHOPBHVSA-N	0	3	342.458	3.049	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(F)cc4ccoc43)C[C@H]21	ZINC001042121451	1345949837	/nfs/dbraw/zinc/94/98/37/1345949837.db2.gz	HGTCASVTRNLRAF-CXAGYDPISA-N	0	3	328.387	3.294	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(C)n(C(CC)CC)n3)C[C@H]21	ZINC001042125448	1345950751	/nfs/dbraw/zinc/95/07/51/1345950751.db2.gz	UHBXSKMOPBAPPS-VQIMIIECSA-N	0	3	344.503	3.275	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3csc(C(F)(F)F)c3)C[C@@H]21	ZINC001042132663	1345952393	/nfs/dbraw/zinc/95/23/93/1345952393.db2.gz	HEYXBRFUNPXNSZ-YPMHNXCESA-N	0	3	344.402	3.489	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C3(c4ccccc4)CCC3)C[C@@H]21	ZINC001042142552	1345955010	/nfs/dbraw/zinc/95/50/10/1345955010.db2.gz	OVUJAZVNHAZYHE-QUCCMNQESA-N	0	3	336.479	3.054	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3nc4ccccc4cc3C)C[C@H]21	ZINC001042155822	1345958649	/nfs/dbraw/zinc/95/86/49/1345958649.db2.gz	NJBYITOABKFVQC-VQIMIIECSA-N	0	3	335.451	3.266	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)Cc3ccc(C4CCC4)cc3)C[C@H]21	ZINC001042167423	1345963160	/nfs/dbraw/zinc/96/31/60/1345963160.db2.gz	LSDWOOHGKWJEMV-NHCUHLMSSA-N	0	3	336.479	3.053	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)CCc3ccc(C)cc3C)C[C@@H]21	ZINC001042175051	1345966604	/nfs/dbraw/zinc/96/66/04/1345966604.db2.gz	ZFBIDJBXHARESA-SFTDATJTSA-N	0	3	338.495	3.182	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C3(c4cccc(F)c4)CCC3)C[C@H]21	ZINC001042177552	1345968340	/nfs/dbraw/zinc/96/83/40/1345968340.db2.gz	WVORELYKXNEYIE-QFBILLFUSA-N	0	3	342.458	3.356	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3nsc4ccc(C)cc43)C[C@@H]21	ZINC001042183292	1345970943	/nfs/dbraw/zinc/97/09/43/1345970943.db2.gz	IUBJCZMSSGRNIA-HOCLYGCPSA-N	0	3	341.480	3.327	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(C(C)C)nc3CC)C[C@H]21	ZINC001042237967	1346000144	/nfs/dbraw/zinc/00/01/44/1346000144.db2.gz	NZSRTFSVUJTETH-OXJNMPFZSA-N	0	3	341.499	3.490	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C3(Cc4ccccc4F)CC3)C[C@H]21	ZINC001042266545	1346012518	/nfs/dbraw/zinc/01/25/18/1346012518.db2.gz	NHODBXPROZMDMP-QFBILLFUSA-N	0	3	342.458	3.257	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cccc4ccsc43)C[C@H]21	ZINC001042301428	1346024256	/nfs/dbraw/zinc/02/42/56/1346024256.db2.gz	HZKCQWNBSQZFIF-CRAIPNDOSA-N	0	3	338.476	3.461	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cccc4ccsc43)C[C@H]21	ZINC001042301429	1346024405	/nfs/dbraw/zinc/02/44/05/1346024405.db2.gz	HZKCQWNBSQZFIF-MAUKXSAKSA-N	0	3	338.476	3.461	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(C)n(CC4CC4)c3C)C[C@@H]21	ZINC001042315795	1346029989	/nfs/dbraw/zinc/02/99/89/1346029989.db2.gz	CNKRLHISOSLLCT-ICSRJNTNSA-N	0	3	341.499	3.237	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C(C)(C)c3ccc(C)cc3)C[C@H]21	ZINC001042315769	1346030053	/nfs/dbraw/zinc/03/00/53/1346030053.db2.gz	CDHVSEUNMFBZAC-UYAOXDASSA-N	0	3	338.495	3.219	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C(C)(C)c3ccc(F)cc3)C[C@@H]21	ZINC001042317112	1346030837	/nfs/dbraw/zinc/03/08/37/1346030837.db2.gz	WENBHSXCLMHWEO-YJBOKZPZSA-N	0	3	330.447	3.212	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccccc3OC(C)C)C[C@H]21	ZINC001042320530	1346031497	/nfs/dbraw/zinc/03/14/97/1346031497.db2.gz	RTUXTYVXYHTUJE-FUHWJXTLSA-N	0	3	328.456	3.196	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(C(F)(F)F)cc3)C[C@@H]21	ZINC001042327812	1346036441	/nfs/dbraw/zinc/03/64/41/1346036441.db2.gz	PDOULZPDNBJQNF-CJNGLKHVSA-N	0	3	338.373	3.428	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3sccc3C(F)F)C[C@@H]21	ZINC001042330872	1346038796	/nfs/dbraw/zinc/03/87/96/1346038796.db2.gz	IFQVRLUAWSKSBV-JSGCOSHPSA-N	0	3	338.423	3.245	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc4ncsc4c3)C[C@@H]21	ZINC001042338862	1346043182	/nfs/dbraw/zinc/04/31/82/1346043182.db2.gz	NBQQIGAXPIFTRF-CJNGLKHVSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cccc(OCC(C)C)c3)C[C@@H]21	ZINC001042349059	1346050117	/nfs/dbraw/zinc/05/01/17/1346050117.db2.gz	NRNIISQSWAYNQB-PXNSSMCTSA-N	0	3	342.483	3.444	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc(CC)c(CC)c3)C[C@H]21	ZINC001042378945	1346064788	/nfs/dbraw/zinc/06/47/88/1346064788.db2.gz	CHLUVEPMOLSMMZ-PZJWPPBQSA-N	0	3	338.495	3.371	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cccc4c3OCC4(C)C)C[C@@H]21	ZINC001042382636	1346066196	/nfs/dbraw/zinc/06/61/96/1346066196.db2.gz	KIZPLFKCTMUPID-QAPCUYQASA-N	0	3	340.467	3.079	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)Cc1ccccc1	ZINC001044649944	1346392833	/nfs/dbraw/zinc/39/28/33/1346392833.db2.gz	AWQZNXKTIXIQAG-DYESRHJHSA-N	0	3	347.462	3.270	20	30		EGEDHN
Cc1cocc1C(=O)N1CC[C@@H](NCc2ccccc2C#N)C[C@@H]1C	ZINC001044706550	1346407003	/nfs/dbraw/zinc/40/70/03/1346407003.db2.gz	CEMCLPSHMVIWKW-MAUKXSAKSA-N	0	3	337.423	3.243	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC[C@H]1CNCc1cccc(Cl)c1Cl	ZINC001044961003	1346470351	/nfs/dbraw/zinc/47/03/51/1346470351.db2.gz	KWCDXNODQYHOGR-AAEUAGOBSA-N	0	3	340.254	3.234	20	30		EGEDHN
CC1(C)CC(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)c(F)c2)C1	ZINC001045023404	1346482127	/nfs/dbraw/zinc/48/21/27/1346482127.db2.gz	ODPINKSQHFZPCB-KRWDZBQOSA-N	0	3	343.446	3.214	20	30		EGEDHN
CC(C(=O)N1CCC[C@H]1CNCc1ccc(C#N)c(F)c1)=C1CCC1	ZINC001045034206	1346483861	/nfs/dbraw/zinc/48/38/61/1346483861.db2.gz	POTSIHCTOHLYCL-SFHVURJKSA-N	0	3	341.430	3.278	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1CCC[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC001045049241	1346486451	/nfs/dbraw/zinc/48/64/51/1346486451.db2.gz	GQZCXJGKOHDVOF-KRWDZBQOSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC001045186021	1346522079	/nfs/dbraw/zinc/52/20/79/1346522079.db2.gz	UQXOYMOPHCGVNQ-FXAWDEMLSA-N	0	3	343.446	3.380	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N1CCC[C@H]1CNCc1ccc(C#N)cc1F	ZINC001045190250	1346524821	/nfs/dbraw/zinc/52/48/21/1346524821.db2.gz	XYMXYCSQQFPGRR-BPQIPLTHSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]2CNCc2ccc(F)cc2F)C1	ZINC001045190880	1346525145	/nfs/dbraw/zinc/52/51/45/1346525145.db2.gz	LRJQSILTJPUIGN-INIZCTEOSA-N	0	3	334.410	3.402	20	30		EGEDHN
CC1(NC(=O)[C@H]2CC=CCC2)CCN(Cc2cccc(C#N)c2)CC1	ZINC001045362318	1346573723	/nfs/dbraw/zinc/57/37/23/1346573723.db2.gz	NPXBUTUVMYWLFV-IBGZPJMESA-N	0	3	337.467	3.385	20	30		EGEDHN
Cc1cc(CN2CCC(C)(NC(=O)c3ccc(C#N)[nH]3)CC2)cs1	ZINC001045406434	1346586276	/nfs/dbraw/zinc/58/62/76/1346586276.db2.gz	BEHLUKMPWDQLKZ-UHFFFAOYSA-N	0	3	342.468	3.041	20	30		EGEDHN
CC1(NC(=O)c2ccc(C#N)[nH]2)CCN(C/C=C/c2ccccc2)CC1	ZINC001045410254	1346587017	/nfs/dbraw/zinc/58/70/17/1346587017.db2.gz	LRSPPDRMYVFALQ-VMPITWQZSA-N	0	3	348.450	3.184	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2cnn(C3CCCC3)c2C)CC1	ZINC001045615041	1346648303	/nfs/dbraw/zinc/64/83/03/1346648303.db2.gz	AIVBKFVJWNSJST-UHFFFAOYSA-N	0	3	330.476	3.077	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1cccc(C#N)c1	ZINC001045700897	1346671487	/nfs/dbraw/zinc/67/14/87/1346671487.db2.gz	NLYWEDGQWFNJOV-MOPGFXCFSA-N	0	3	325.456	3.170	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)Cc1ccc(C)cc1)C2	ZINC001045950699	1346785649	/nfs/dbraw/zinc/78/56/49/1346785649.db2.gz	JKEGAOWIALFHBE-JOCHJYFZSA-N	0	3	338.495	3.265	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@]1(C)C[C@H]3C[C@H]3C1)C2	ZINC001045952755	1346787794	/nfs/dbraw/zinc/78/77/94/1346787794.db2.gz	SFHOOUNIRYPTDI-KOUHRCEDSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccn3ccccc13)C2	ZINC001045952680	1346787867	/nfs/dbraw/zinc/78/78/67/1346787867.db2.gz	PIXIQCRXHFLBKQ-QFIPXVFZSA-N	0	3	349.478	3.281	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)CCc1cccc(C)c1)C2	ZINC001045954997	1346789640	/nfs/dbraw/zinc/78/96/40/1346789640.db2.gz	MCHPASPUSZFHCZ-JOCHJYFZSA-N	0	3	338.495	3.265	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc(F)ccc1C)C2	ZINC001045957969	1346792812	/nfs/dbraw/zinc/79/28/12/1346792812.db2.gz	IIRSXUAERQCAJU-FQEVSTJZSA-N	0	3	328.431	3.086	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc[nH]c1CCC)C2	ZINC001045962213	1346797561	/nfs/dbraw/zinc/79/75/61/1346797561.db2.gz	YUFBLUAUBRMACK-OAQYLSRUSA-N	0	3	341.499	3.309	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc(Cl)cc1)C2	ZINC001045980508	1346817860	/nfs/dbraw/zinc/81/78/60/1346817860.db2.gz	AGLWOEWHDKHDMW-LJQANCHMSA-N	0	3	330.859	3.291	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@]1(C)CC=C(C)CC1)C2	ZINC001045985566	1346825888	/nfs/dbraw/zinc/82/58/88/1346825888.db2.gz	WXLMPWLZJMJGKQ-SFTDATJTSA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCCN1CC[C@@](C)(NC(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2)C1	ZINC001046692854	1347064432	/nfs/dbraw/zinc/06/44/32/1347064432.db2.gz	JFBMLGPEQTXVNB-YQVWRLOYSA-N	0	3	330.859	3.047	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@]2(C)CCN(Cc3cc(C)cc(C)c3)C2)nc1	ZINC001046781276	1347097723	/nfs/dbraw/zinc/09/77/23/1347097723.db2.gz	GOJQAMMDKIXOGY-QFIPXVFZSA-N	0	3	347.462	3.074	20	30		EGEDHN
C#CCCN1CC[C@@](C)(NC(=O)c2cc(Cl)ccc2Cl)C1	ZINC001046799668	1347110083	/nfs/dbraw/zinc/11/00/83/1347110083.db2.gz	UPHWEDRYMQVVEM-MRXNPFEDSA-N	0	3	325.239	3.211	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2ccc(OCC3CC3)cc2)C1	ZINC001046847143	1347128776	/nfs/dbraw/zinc/12/87/76/1347128776.db2.gz	FISWLVAQYNEILB-FQEVSTJZSA-N	0	3	328.456	3.246	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2scnc2Cl)CC[C@@H]1C	ZINC001132489977	1375422862	/nfs/dbraw/zinc/42/28/62/1375422862.db2.gz	PMDGYWMDZDJHHH-RYUDHWBXSA-N	0	3	327.881	3.345	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2cscc2C)C1	ZINC001046927082	1347155061	/nfs/dbraw/zinc/15/50/61/1347155061.db2.gz	SXIKOPRRXRPODZ-ZDUSSCGKSA-N	0	3	328.428	3.320	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@H](CNC(=O)[C@H]2CCC(C)=C(C)C2)C1	ZINC001046941718	1347158457	/nfs/dbraw/zinc/15/84/57/1347158457.db2.gz	PLAFWLFTMQSEPL-DLBZAZTESA-N	0	3	338.442	3.220	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@H](CNC(=O)[C@@H]2CCC=CCCC2)C1	ZINC001046951827	1347161600	/nfs/dbraw/zinc/16/16/00/1347161600.db2.gz	OLZZTLZDMULKJP-IAGOWNOFSA-N	0	3	338.442	3.220	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2cc3cnccc3o2)C1	ZINC001046954932	1347163685	/nfs/dbraw/zinc/16/36/85/1347163685.db2.gz	WISHHPFOZRKLMP-AWEZNQCLSA-N	0	3	349.381	3.091	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)N(CC#Cc2ccccc2)C3)co1	ZINC001047060702	1347198885	/nfs/dbraw/zinc/19/88/85/1347198885.db2.gz	RKIUNNGNQUUNFO-TYPHKJRUSA-N	0	3	348.446	3.222	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)c3oc(C)cc3C)C2)CC1	ZINC001047232098	1347260974	/nfs/dbraw/zinc/26/09/74/1347260974.db2.gz	JDGHWZRMPPYNSJ-LJQANCHMSA-N	0	3	342.483	3.484	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)C3CCC(F)CC3)C2)CC1	ZINC001047253609	1347277745	/nfs/dbraw/zinc/27/77/45/1347277745.db2.gz	DIJZSHNEIPFVDE-JLAWEPINSA-N	0	3	334.479	3.099	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)[C@@H](C)C(C)(F)F)C2)CC1	ZINC001047255560	1347279208	/nfs/dbraw/zinc/27/92/08/1347279208.db2.gz	ASOJEAGUJJWHJY-WBVHZDCISA-N	0	3	340.458	3.252	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3ccc(F)cc3F)C2)CC1	ZINC001047264450	1347285383	/nfs/dbraw/zinc/28/53/83/1347285383.db2.gz	JQYJTTREKMQCMD-INIZCTEOSA-N	0	3	346.421	3.162	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)CCc3ccccc3)C2)CC1	ZINC001047265313	1347286434	/nfs/dbraw/zinc/28/64/34/1347286434.db2.gz	YJVDYGDJSJDVOG-OAQYLSRUSA-N	0	3	338.495	3.203	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC001047683779	1347329154	/nfs/dbraw/zinc/32/91/54/1347329154.db2.gz	SCNUCXXLVPJSLF-OXJNMPFZSA-N	0	3	333.435	3.199	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@H]([C@@H](C)NCc2cc(C)no2)C1	ZINC001047855402	1347390115	/nfs/dbraw/zinc/39/01/15/1347390115.db2.gz	LRAVCCRBLREPTM-OCCSQVGLSA-N	0	3	339.867	3.088	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]([C@@H](C)NCc2nc(C)cs2)C1	ZINC001047929246	1347413569	/nfs/dbraw/zinc/41/35/69/1347413569.db2.gz	QDHXONKKIXVHGI-CABCVRRESA-N	0	3	335.517	3.380	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H]([C@H](C)NCc3cscn3)C2)CC1	ZINC001047956896	1347423398	/nfs/dbraw/zinc/42/33/98/1347423398.db2.gz	ASXRGGOTPPOGJE-HOCLYGCPSA-N	0	3	333.501	3.216	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)C2(CF)CCC2)C1	ZINC001047987077	1347434748	/nfs/dbraw/zinc/43/47/48/1347434748.db2.gz	XYBCZWSGFZCBHJ-YJBOKZPZSA-N	0	3	343.446	3.025	20	30		EGEDHN
CCC(CC)C(=O)N1C[C@@H](CNCc2cc(F)ccc2C#N)[C@H](C)C1	ZINC001048153599	1347482967	/nfs/dbraw/zinc/48/29/67/1347482967.db2.gz	VTEQUMYZWOKCNE-RDTXWAMCSA-N	0	3	345.462	3.318	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CC(C)(C)C2)C[C@H]1CNCc1ccccc1C#N	ZINC001048241033	1347500605	/nfs/dbraw/zinc/50/06/05/1347500605.db2.gz	YYDXCJINXBSSBC-DNVCBOLYSA-N	0	3	339.483	3.179	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2(C)CC2)C[C@@H]1CNCc1cc(F)ccc1C#N	ZINC001048318952	1347517639	/nfs/dbraw/zinc/51/76/39/1347517639.db2.gz	XKMCZQFTRRWXLI-PBHICJAKSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](C)[C@H](CNCc2ncc(C)s2)C1	ZINC001048337486	1347522121	/nfs/dbraw/zinc/52/21/21/1347522121.db2.gz	DDLOPKYFECDDBJ-DZGCQCFKSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@@H](CNCc2nc(C)cs2)C1	ZINC001048337592	1347522263	/nfs/dbraw/zinc/52/22/63/1347522263.db2.gz	DYQWKCGTCHNNQK-HIFRSBDPSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)[C@@H](CNCc2nc(C)c(C)s2)C1	ZINC001048341192	1347523572	/nfs/dbraw/zinc/52/35/72/1347523572.db2.gz	YSPPWLRDSGDIKX-DOMZBBRYSA-N	0	3	335.517	3.156	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](C)[C@@H](CNCc2cc(C3CC3)no2)C1	ZINC001048340825	1347523654	/nfs/dbraw/zinc/52/36/54/1347523654.db2.gz	UJKVVJURJUWRDI-HOCLYGCPSA-N	0	3	345.487	3.338	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](CNCc2c(F)cccc2F)[C@H](C)C1	ZINC001048344772	1347524872	/nfs/dbraw/zinc/52/48/72/1347524872.db2.gz	RMPQBIIBOVWHPQ-ZIAGYGMSSA-N	0	3	336.426	3.361	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H](CNCc3cscn3)[C@H](C)C2)CC1	ZINC001048374993	1347535186	/nfs/dbraw/zinc/53/51/86/1347535186.db2.gz	SZBVEKHPKWOOFX-GDBMZVCRSA-N	0	3	333.501	3.074	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H](C)[C@@H](CNCc3nc(C)sc3C)C2)C1	ZINC001048375502	1347535529	/nfs/dbraw/zinc/53/55/29/1347535529.db2.gz	YCJXAAQKIRBCKF-BBRMVZONSA-N	0	3	347.528	3.300	20	30		EGEDHN
O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)N2CC#Cc1ccccc1)C1CCC1	ZINC001048495705	1347566549	/nfs/dbraw/zinc/56/65/49/1347566549.db2.gz	VUAFUKGJOPOKNQ-NUZGMZIFSA-N	0	3	336.479	3.197	20	30		EGEDHN
N#Cc1ccccc1CN1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)c1ccoc1)C2	ZINC001048504428	1347571097	/nfs/dbraw/zinc/57/10/97/1347571097.db2.gz	WQBLCSSMDBTCRI-VVNNIFPWSA-N	0	3	349.434	3.324	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)[C@H]2CC[C@H](F)C2)CC1	ZINC001048626678	1347624482	/nfs/dbraw/zinc/62/44/82/1347624482.db2.gz	SVEFYOUUPYMCNH-IRXDYDNUSA-N	0	3	345.462	3.199	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)[C@@H]2CCC2(F)F)CC1	ZINC001048627286	1347624964	/nfs/dbraw/zinc/62/49/64/1347624964.db2.gz	JUCLWBSAXIEBAX-KRWDZBQOSA-N	0	3	349.425	3.106	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@H]2C1	ZINC001048838153	1347669097	/nfs/dbraw/zinc/66/90/97/1347669097.db2.gz	DBMFDYKWYZKDSS-KDURUIRLSA-N	0	3	339.483	3.131	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2C[C@H]3CN(C[C@@H](F)CC)C[C@H]3C2)cc1	ZINC001048898844	1347679430	/nfs/dbraw/zinc/67/94/30/1347679430.db2.gz	DIHXGZLJFFVZOZ-KSZLIROESA-N	0	3	346.446	3.003	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc(C)c4ccccc34)C[C@@H]2C1	ZINC001049082529	1347720601	/nfs/dbraw/zinc/72/06/01/1347720601.db2.gz	IXJGHAGCQZVQHG-HDICACEKSA-N	0	3	332.447	3.175	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@H]2CCCN3C(=O)c2ccccc2)cc1	ZINC001049299821	1347779358	/nfs/dbraw/zinc/77/93/58/1347779358.db2.gz	UGDCBNILUDIIDJ-RTWAWAEBSA-N	0	3	345.446	3.437	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1cc2ccccc2o1	ZINC001049380754	1347811538	/nfs/dbraw/zinc/81/15/38/1347811538.db2.gz	GZIFQLVUSKMGEE-JLSDUUJJSA-N	0	3	337.423	3.158	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)CCC2CC2)cc1	ZINC001049386034	1347813979	/nfs/dbraw/zinc/81/39/79/1347813979.db2.gz	JVEZTZAXLLPKTK-WOJBJXKFSA-N	0	3	337.467	3.314	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1ccc(C#N)cc1)C1CC1	ZINC001049403695	1347825796	/nfs/dbraw/zinc/82/57/96/1347825796.db2.gz	KAOJODVRYLPAAS-YSSFQJQWSA-N	0	3	337.467	3.170	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1c(F)ccc2ccncc21	ZINC001049490157	1347874293	/nfs/dbraw/zinc/87/42/93/1347874293.db2.gz	ICVOHXPGLFXKQK-ZWKOTPCHSA-N	0	3	339.414	3.239	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1c(F)cccc1OC	ZINC001049492057	1347875403	/nfs/dbraw/zinc/87/54/03/1347875403.db2.gz	WNSNMHKONBFYBH-HZPDHXFCSA-N	0	3	332.419	3.089	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc2nccc(C)c2c1	ZINC001049506119	1347882929	/nfs/dbraw/zinc/88/29/29/1347882929.db2.gz	UJHLTONLRSAIFO-PMACEKPBSA-N	0	3	335.451	3.408	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)CC1(c2ccccc2)CC1	ZINC001049513085	1347886478	/nfs/dbraw/zinc/88/64/78/1347886478.db2.gz	VTSFPSYKFBSEKD-WOJBJXKFSA-N	0	3	336.479	3.197	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cccc2ccc(C)nc21	ZINC001049541546	1347899085	/nfs/dbraw/zinc/89/90/85/1347899085.db2.gz	RGVTWLWIIRZLFI-PMACEKPBSA-N	0	3	347.462	3.245	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cccc2ccc(C)nc21	ZINC001049542871	1347899792	/nfs/dbraw/zinc/89/97/92/1347899792.db2.gz	YPJYOXADSZDYIZ-RBUKOAKNSA-N	0	3	335.451	3.408	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cccc([C@@H]2CCOC2)c1	ZINC001049561478	1347910172	/nfs/dbraw/zinc/91/01/72/1347910172.db2.gz	LIIXAXACBZEGFW-HSALFYBXSA-N	0	3	340.467	3.055	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cccnc1C(F)F	ZINC001049581854	1347920888	/nfs/dbraw/zinc/92/08/88/1347920888.db2.gz	AGQVJGWZCGYFEF-GJZGRUSLSA-N	0	3	335.398	3.274	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(-c2ccccc2)on1	ZINC001049584888	1347922621	/nfs/dbraw/zinc/92/26/21/1347922621.db2.gz	XGOAXNQFPIHXJI-RBUKOAKNSA-N	0	3	349.434	3.044	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(C)c2cccnc12	ZINC001049597941	1347929862	/nfs/dbraw/zinc/92/98/62/1347929862.db2.gz	HPXJOROIVFCCNZ-MOPGFXCFSA-N	0	3	335.451	3.408	20	30		EGEDHN
C[C@]1(C(=O)N2CCC[C@H]3[C@@H]2CCN3Cc2cccc(C#N)c2)C=CCC1	ZINC001049659451	1347959530	/nfs/dbraw/zinc/95/95/30/1347959530.db2.gz	SMMDBAIITQTYAF-ONTIZHBOSA-N	0	3	349.478	3.480	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1c(C)[nH]c2ccccc21	ZINC001049681608	1347970358	/nfs/dbraw/zinc/97/03/58/1347970358.db2.gz	PJTGHHSEUZBCOI-RTWAWAEBSA-N	0	3	349.478	3.107	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](C)Cc1ccccc1F	ZINC001049713501	1347987949	/nfs/dbraw/zinc/98/79/49/1347987949.db2.gz	DPDBRZQPRQMQOT-ATZDWAIDSA-N	0	3	330.447	3.256	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@H]2[C@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049734564	1347994054	/nfs/dbraw/zinc/99/40/54/1347994054.db2.gz	FHZSSVGKNKOMNL-YSTOQKLRSA-N	0	3	337.467	3.170	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1ccc(Cl)c(F)c1	ZINC001049746103	1347997956	/nfs/dbraw/zinc/99/79/56/1347997956.db2.gz	CNDZKGLVEIWFQY-ROUUACIJSA-N	0	3	348.849	3.110	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)[C@H]2CC23CCC3)cc1	ZINC001049753917	1348002401	/nfs/dbraw/zinc/00/24/01/1348002401.db2.gz	LYBBJUDRRZTWRU-VAMGGRTRSA-N	0	3	349.478	3.314	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)[C@@H]2CC23CCC3)cc1	ZINC001049753921	1348002477	/nfs/dbraw/zinc/00/24/77/1348002477.db2.gz	LYBBJUDRRZTWRU-XUVXKRRUSA-N	0	3	349.478	3.314	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1noc2c1CCCCC2	ZINC001049759764	1348005205	/nfs/dbraw/zinc/00/52/05/1348005205.db2.gz	RVLLJKIIADZLCO-SJORKVTESA-N	0	3	343.471	3.199	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc([C@@H](C)CC)no1	ZINC001049772279	1348014048	/nfs/dbraw/zinc/01/40/48/1348014048.db2.gz	YZNNMEYJYFQSNN-USXIJHARSA-N	0	3	331.460	3.443	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](CC)c1c(C)noc1C	ZINC001049787303	1348022009	/nfs/dbraw/zinc/02/20/09/1348022009.db2.gz	GYXCPJIRIBDOHU-BRWVUGGUSA-N	0	3	331.460	3.036	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C[C@@H](C)c1ccccc1F	ZINC001049788267	1348022098	/nfs/dbraw/zinc/02/20/98/1348022098.db2.gz	MVLWSOPQUFWQEA-AYOQOUSVSA-N	0	3	328.431	3.018	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc2nc(C)ccc2c1	ZINC001049799405	1348026259	/nfs/dbraw/zinc/02/62/59/1348026259.db2.gz	VOIZRUNBSXRTFI-VQTJNVASSA-N	0	3	335.451	3.408	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cnn([C@H](C)CC)c1C	ZINC001049834529	1348048017	/nfs/dbraw/zinc/04/80/17/1348048017.db2.gz	KXCFAKGGFMPGSW-FHLIZLRMSA-N	0	3	330.476	3.027	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1[nH]ccc1-c1ccccc1	ZINC001049840189	1348052084	/nfs/dbraw/zinc/05/20/84/1348052084.db2.gz	GKJWGMGKWKRDJA-WOJBJXKFSA-N	0	3	347.462	3.384	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1coc(C2CCC2)n1	ZINC001049842102	1348053621	/nfs/dbraw/zinc/05/36/21/1348053621.db2.gz	KBTMQKBDHQZJIW-IAGOWNOFSA-N	0	3	329.444	3.197	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1c[nH]nc1C1CCCCC1	ZINC001049843255	1348053806	/nfs/dbraw/zinc/05/38/06/1348053806.db2.gz	OKZNPGOLAWZULD-MSOLQXFVSA-N	0	3	342.487	3.322	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(CC)c(CC)o1	ZINC001049850663	1348058543	/nfs/dbraw/zinc/05/85/43/1348058543.db2.gz	UCJAVVLLBYUZFL-DLBZAZTESA-N	0	3	328.456	3.107	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccccc1OC(C)C	ZINC001049854941	1348061960	/nfs/dbraw/zinc/06/19/60/1348061960.db2.gz	OUCVSPYDYGRIOC-QZTJIDSGSA-N	0	3	328.456	3.339	20	30		EGEDHN
CC(C)(C)C(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1cccc(C#N)c1	ZINC001049859911	1348066638	/nfs/dbraw/zinc/06/66/38/1348066638.db2.gz	XXSUUTRXXHCJLJ-MSOLQXFVSA-N	0	3	325.456	3.170	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc2[nH]ccc2s1	ZINC001049867448	1348073344	/nfs/dbraw/zinc/07/33/44/1348073344.db2.gz	NGSYDJJLPBXABE-LSDHHAIUSA-N	0	3	329.469	3.484	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc2ncsc2c1	ZINC001049871802	1348077220	/nfs/dbraw/zinc/07/72/20/1348077220.db2.gz	NZHULUQKUUWFNX-HOTGVXAUSA-N	0	3	327.453	3.161	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1sccc1C(F)F	ZINC001049875306	1348080312	/nfs/dbraw/zinc/08/03/12/1348080312.db2.gz	IQHZWIQBZVRSLO-UONOGXRCSA-N	0	3	338.423	3.388	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)CCc1ccccc1Cl	ZINC001049886833	1348091200	/nfs/dbraw/zinc/09/12/00/1348091200.db2.gz	VBDICQNCHUCPBF-MOPGFXCFSA-N	0	3	344.886	3.361	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(C)n(C(C)(C)C)n1	ZINC001049899764	1348100131	/nfs/dbraw/zinc/10/01/31/1348100131.db2.gz	GQYKTXLEHUBLAV-ZWKOTPCHSA-N	0	3	344.503	3.202	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cnc(C(C)(C)C)s1	ZINC001049922753	1348114457	/nfs/dbraw/zinc/11/44/57/1348114457.db2.gz	RNMABJIKYHCTSD-GJZGRUSLSA-N	0	3	345.512	3.143	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C1(C(F)(F)F)CCCC1	ZINC001049933932	1348121160	/nfs/dbraw/zinc/12/11/60/1348121160.db2.gz	UIRGXUSFDDBFNT-ZIAGYGMSSA-N	0	3	330.394	3.360	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CCCN(C(=O)CC4CCC4)[C@@H]3C2)c1	ZINC001050008921	1348152047	/nfs/dbraw/zinc/15/20/47/1348152047.db2.gz	PXVFKBRHTBYDQJ-VQTJNVASSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cc(C(F)F)ccc3F)[C@@H]2C1	ZINC001050048443	1348165311	/nfs/dbraw/zinc/16/53/11/1348165311.db2.gz	XZYAMOOYUCCADP-XJKSGUPXSA-N	0	3	338.373	3.486	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3cccc(C(C)C)n3)[C@@H]2C1	ZINC001050087873	1348178062	/nfs/dbraw/zinc/17/80/62/1348178062.db2.gz	PUOWOHVBDYRYGL-QFBILLFUSA-N	0	3	327.472	3.318	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)Cc3ccc(C(F)F)cc3)[C@@H]2C1	ZINC001050092936	1348180894	/nfs/dbraw/zinc/18/08/94/1348180894.db2.gz	AIRVDHMYOWVYEQ-DLBZAZTESA-N	0	3	334.410	3.276	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3ccc(C)c4cccnc34)[C@@H]2C1	ZINC001050098547	1348182612	/nfs/dbraw/zinc/18/26/12/1348182612.db2.gz	QPPFAHIVRCDLCF-QFBILLFUSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)CCc3cccc(Cl)c3)[C@@H]2C1	ZINC001050104134	1348183925	/nfs/dbraw/zinc/18/39/25/1348183925.db2.gz	IPWZPWSYXHXFEK-FUHWJXTLSA-N	0	3	332.875	3.381	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3noc4c3CCCCC4)[C@@H]2C1	ZINC001050153326	1348198765	/nfs/dbraw/zinc/19/87/65/1348198765.db2.gz	URXAWEXFFKIZGW-DOTOQJQBSA-N	0	3	343.471	3.056	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3cnn([C@@H](C)CC)c3C)[C@@H]2C1	ZINC001050179698	1348203296	/nfs/dbraw/zinc/20/32/96/1348203296.db2.gz	OTQKEBMVTHWHOW-VDZJLULYSA-N	0	3	344.503	3.275	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cnn(C4CCCC4)c3C)[C@@H]2C1	ZINC001050182232	1348204470	/nfs/dbraw/zinc/20/44/70/1348204470.db2.gz	RIRCCWBEEDPIOS-QFBILLFUSA-N	0	3	342.487	3.029	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3oc4ccc(F)cc4c3C)C2)CC1	ZINC001050543880	1348286901	/nfs/dbraw/zinc/28/69/01/1348286901.db2.gz	MWSZBOXWLBLQSM-UHFFFAOYSA-N	0	3	340.398	3.052	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)Cc3ccc(CCCC)cc3)C2)CC1	ZINC001050583206	1348293584	/nfs/dbraw/zinc/29/35/84/1348293584.db2.gz	GASZIWKWMHKFEP-UHFFFAOYSA-N	0	3	338.495	3.129	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@@H](C)c3ccc(Cl)cc3)C2)CC1	ZINC001050643843	1348312823	/nfs/dbraw/zinc/31/28/23/1348312823.db2.gz	SJSNEWCSSFVKOA-HNNXBMFYSA-N	0	3	330.859	3.001	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3csc(C(C)(C)C)n3)C2)CC1	ZINC001050699797	1348330614	/nfs/dbraw/zinc/33/06/14/1348330614.db2.gz	QSNWMNPMTWOGMV-UHFFFAOYSA-N	0	3	345.512	3.002	20	30		EGEDHN
CC(C)(C)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001050737504	1348342730	/nfs/dbraw/zinc/34/27/30/1348342730.db2.gz	ZXJWWASGKOWPIS-UHFFFAOYSA-N	0	3	325.456	3.029	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3cc4c(cccc4F)s3)C2)CC1	ZINC001050749505	1348348107	/nfs/dbraw/zinc/34/81/07/1348348107.db2.gz	NGVZEGOIGGDWRO-UHFFFAOYSA-N	0	3	342.439	3.212	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3ccc(F)nc3)cccc2C1	ZINC001051281438	1348416543	/nfs/dbraw/zinc/41/65/43/1348416543.db2.gz	ICQAKGIUKPQRRW-UHFFFAOYSA-N	0	3	339.414	3.085	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3cncs3)cccc2C1	ZINC001051284009	1348417302	/nfs/dbraw/zinc/41/73/02/1348417302.db2.gz	WBDLSYZCSMPLTD-UHFFFAOYSA-N	0	3	327.453	3.007	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@@H]2[C@@H](c3ccccc3)C2(C)C)CC1	ZINC001052387951	1348538436	/nfs/dbraw/zinc/53/84/36/1348538436.db2.gz	XYUHZXJYLKLHCU-ZCNNSNEGSA-N	0	3	338.495	3.420	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)C2CCc3ccccc3CC2)CC1	ZINC001052512422	1348562976	/nfs/dbraw/zinc/56/29/76/1348562976.db2.gz	KBZRSSSRSGDUQS-NRFANRHFSA-N	0	3	338.495	3.176	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@@H](C)c2c(F)cccc2F)CC1	ZINC001052562301	1348580217	/nfs/dbraw/zinc/58/02/17/1348580217.db2.gz	OOSFWDPCNQVEDQ-GJZGRUSLSA-N	0	3	334.410	3.062	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2nsc3ccc(C)cc32)CC1	ZINC001052623401	1348599227	/nfs/dbraw/zinc/59/92/27/1348599227.db2.gz	RGENDLQIJKZPKR-HNNXBMFYSA-N	0	3	341.480	3.212	20	30		EGEDHN
C[C@]1(C(=O)N[C@@H]2CCCN(Cc3cccc(C#N)c3)CC2)C=CCC1	ZINC001052636647	1348605381	/nfs/dbraw/zinc/60/53/81/1348605381.db2.gz	VPERLFROWCWZDJ-CTNGQTDRSA-N	0	3	337.467	3.385	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2c(Cl)oc3ccccc32)CC1	ZINC001052651222	1348613253	/nfs/dbraw/zinc/61/32/53/1348613253.db2.gz	SPOKESCOZXOSQS-ZDUSSCGKSA-N	0	3	330.815	3.304	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCCN(Cc3cccnc3)CC2)CC1	ZINC001052681932	1348628756	/nfs/dbraw/zinc/62/87/56/1348628756.db2.gz	KATPTQLFNHFMDD-IBGZPJMESA-N	0	3	327.472	3.299	20	30		EGEDHN
CC1(C(=O)N[C@@H]2CCCN(Cc3cccc(C#N)c3)CC2)CC=CC1	ZINC001052682166	1348628987	/nfs/dbraw/zinc/62/89/87/1348628987.db2.gz	QKQLTNSQARDNCC-LJQANCHMSA-N	0	3	337.467	3.385	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@@H]2C[C@H]2c2c(F)cccc2F)CC1	ZINC001052696983	1348638619	/nfs/dbraw/zinc/63/86/19/1348638619.db2.gz	WNNHDEZZTQXQDG-ARFHVFGLSA-N	0	3	346.421	3.062	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2)CC1	ZINC001052783078	1348677946	/nfs/dbraw/zinc/67/79/46/1348677946.db2.gz	AEKXMHDIYSBNQR-CEXWTWQISA-N	0	3	344.886	3.438	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2oc3ccccc3c2Cl)CC1	ZINC001052859442	1348705346	/nfs/dbraw/zinc/70/53/46/1348705346.db2.gz	LRLZEVQNRIJRRQ-ZDUSSCGKSA-N	0	3	330.815	3.304	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccsc2C(F)(F)F)CC1	ZINC001052898577	1348733581	/nfs/dbraw/zinc/73/35/81/1348733581.db2.gz	DSRPPXKADVMNLJ-LBPRGKRZSA-N	0	3	344.402	3.375	20	30		EGEDHN
CC(=O)N1CCC[C@@H]([C@H]2CCCN(Cc3ccc(F)c(C#N)c3)C2)C1	ZINC001052998077	1348794995	/nfs/dbraw/zinc/79/49/95/1348794995.db2.gz	UVQUFIKRYYABBV-ZWKOTPCHSA-N	0	3	343.446	3.168	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cc(Cl)c[nH]2)C1	ZINC001053070413	1348884762	/nfs/dbraw/zinc/88/47/62/1348884762.db2.gz	YKOBMQDMVYBPSU-WMLDXEAASA-N	0	3	333.863	3.008	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(Cl)c[nH]2)C1	ZINC001053070411	1348885070	/nfs/dbraw/zinc/88/50/70/1348885070.db2.gz	YKOBMQDMVYBPSU-PBHICJAKSA-N	0	3	333.863	3.008	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cc[nH]c2CC)C1	ZINC001053083339	1348904367	/nfs/dbraw/zinc/90/43/67/1348904367.db2.gz	KEXWEWHZUKJXPN-FXAWDEMLSA-N	0	3	341.499	3.307	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cc(C)cc(C)n2)C1	ZINC001053087680	1348912248	/nfs/dbraw/zinc/91/22/48/1348912248.db2.gz	MYRIANTYFNOSRM-AZUAARDMSA-N	0	3	339.483	3.038	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2onc(C)c2C)C1	ZINC001053088414	1348913379	/nfs/dbraw/zinc/91/33/79/1348913379.db2.gz	UYGGXRPTKQJFNW-ROUUACIJSA-N	0	3	343.471	3.021	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)CC(C)(F)F)C1	ZINC001053097594	1348927988	/nfs/dbraw/zinc/92/79/88/1348927988.db2.gz	HFPYZMCMACXEHB-HZPDHXFCSA-N	0	3	326.431	3.148	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cc(C)ccc2F)C1	ZINC001053097563	1348928316	/nfs/dbraw/zinc/92/83/16/1348928316.db2.gz	GQARYQICTPHEQW-YLJYHZDGSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cc(C)ccc2F)C1	ZINC001053097557	1348928398	/nfs/dbraw/zinc/92/83/98/1348928398.db2.gz	GQARYQICTPHEQW-FXAWDEMLSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2csc(C)c2)C1	ZINC001053100307	1348933524	/nfs/dbraw/zinc/93/35/24/1348933524.db2.gz	GLSWQYGPVKOICW-WMZOPIPTSA-N	0	3	330.497	3.396	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cccn2C(C)C)C1	ZINC001053103955	1348938804	/nfs/dbraw/zinc/93/88/04/1348938804.db2.gz	BDMHMIMRSNYEQY-OALUTQOASA-N	0	3	341.499	3.409	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(Cl)no2)C1	ZINC001053104337	1348939663	/nfs/dbraw/zinc/93/96/63/1348939663.db2.gz	OFRRTMUXZYEXFR-CABCVRRESA-N	0	3	349.862	3.058	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1c(C)noc1C(C)C)C2	ZINC001054148404	1349155014	/nfs/dbraw/zinc/15/50/14/1349155014.db2.gz	MVTOVAHYLJQPFU-HXUWFJFHSA-N	0	3	343.471	3.058	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc(F)cc3ccoc31)C2	ZINC001054155986	1349159148	/nfs/dbraw/zinc/15/91/48/1349159148.db2.gz	GMDXGKVPWZGIAU-HXUWFJFHSA-N	0	3	340.398	3.133	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc(Cl)ccc1F)C2	ZINC001054161262	1349163647	/nfs/dbraw/zinc/16/36/47/1349163647.db2.gz	AACMHEBTWOYMIF-LJQANCHMSA-N	0	3	348.849	3.431	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@]2(CCN(Cc3cccnc3)C2)C1	ZINC001054177277	1349179637	/nfs/dbraw/zinc/17/96/37/1349179637.db2.gz	IRMIIDHMEQCBFE-FQEVSTJZSA-N	0	3	327.472	3.108	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CCC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001054177689	1349179853	/nfs/dbraw/zinc/17/98/53/1349179853.db2.gz	QCEPTPBXXIKJLF-QUCCMNQESA-N	0	3	343.446	3.121	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cccn1C1CCCC1)C2	ZINC001054218133	1349216006	/nfs/dbraw/zinc/21/60/06/1349216006.db2.gz	MICKEWRJMCSFFE-OAQYLSRUSA-N	0	3	339.483	3.165	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc3cnccc3c1)C2	ZINC001054223166	1349218437	/nfs/dbraw/zinc/21/84/37/1349218437.db2.gz	OUILSZPBXAVYTC-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc(C)nc3ccccc31)C2	ZINC001054237434	1349230611	/nfs/dbraw/zinc/23/06/11/1349230611.db2.gz	XHZXYSZOCQOXKO-QFIPXVFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc3ccccc3[nH]1)C2	ZINC001054238335	1349232134	/nfs/dbraw/zinc/23/21/34/1349232134.db2.gz	QWJVRHMYVNKYJD-OAQYLSRUSA-N	0	3	335.451	3.119	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1sccc1C(C)C)C2	ZINC001054244666	1349238782	/nfs/dbraw/zinc/23/87/82/1349238782.db2.gz	XKJWJVMJRAEGBT-IBGZPJMESA-N	0	3	330.497	3.433	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3ccncc3F)cc2C1	ZINC001054259699	1349255936	/nfs/dbraw/zinc/25/59/36/1349255936.db2.gz	NLLMCPLVUWDRKV-UHFFFAOYSA-N	0	3	325.387	3.042	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cncc(CC)c3)cc2C1	ZINC001054273789	1349274076	/nfs/dbraw/zinc/27/40/76/1349274076.db2.gz	AWJLOFKFOFDHEW-UHFFFAOYSA-N	0	3	335.451	3.466	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cccc4nccn43)cc2C1	ZINC001054273797	1349274196	/nfs/dbraw/zinc/27/41/96/1349274196.db2.gz	AYLWVBXEBCJZBI-UHFFFAOYSA-N	0	3	346.434	3.156	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cnn4ccccc34)cc2C1	ZINC001054285301	1349286912	/nfs/dbraw/zinc/28/69/12/1349286912.db2.gz	CEGSVJDTOGNUIY-UHFFFAOYSA-N	0	3	346.434	3.156	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@H]3Cc4cccnc4C3)cc2C1	ZINC001054290481	1349295649	/nfs/dbraw/zinc/29/56/49/1349295649.db2.gz	CONRGYCZDPRABW-IBGZPJMESA-N	0	3	347.462	3.005	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@@H](C)[C@H](NCc2scnc2C)C1	ZINC001054679616	1349434897	/nfs/dbraw/zinc/43/48/97/1349434897.db2.gz	KIRFATAISUXZML-ZWNOBZJWSA-N	0	3	341.908	3.167	20	30		EGEDHN
C[C@H]1CN(C(=O)C(C)(C)C2CCC2)C[C@H]1NCc1ccc(C#N)s1	ZINC001054936541	1349519589	/nfs/dbraw/zinc/51/95/89/1349519589.db2.gz	MAGFCMJUOLYLBS-SUMWQHHRSA-N	0	3	345.512	3.383	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CN(CCc3ccccc3F)C[C@H]2C)C1	ZINC001080405704	1357609211	/nfs/dbraw/zinc/60/92/11/1357609211.db2.gz	GDKWBOLPYXBYQR-CRAIPNDOSA-N	0	3	330.447	3.161	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1coc(Br)c1	ZINC001085626692	1358645933	/nfs/dbraw/zinc/64/59/33/1358645933.db2.gz	QXVICTXMTDKALZ-ZDUSSCGKSA-N	0	3	341.249	3.155	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)CC1(C)CCCC1)C[C@@H](C)O2	ZINC001071164124	1354484485	/nfs/dbraw/zinc/48/44/85/1354484485.db2.gz	HMQPXAUIRKOYPQ-YLJYHZDGSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1sc(C)cc1C)C[C@H](C)O2	ZINC001071174089	1354487924	/nfs/dbraw/zinc/48/79/24/1354487924.db2.gz	SOOGKBMSACYHNX-HNAYVOBHSA-N	0	3	348.512	3.246	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C(C)(C)C(C)(C)C)C[C@H](C)O2	ZINC001071197203	1354499192	/nfs/dbraw/zinc/49/91/92/1354499192.db2.gz	OOZLEEUDPYUXGW-OXJNMPFZSA-N	0	3	336.520	3.327	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(F)c(C(F)F)c2)CC[C@H]1C	ZINC001071515185	1354738069	/nfs/dbraw/zinc/73/80/69/1354738069.db2.gz	RYEDHJAOCBMHBP-OCCSQVGLSA-N	0	3	338.373	3.369	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)Cc2coc3ccc(C)cc23)CC[C@@H]1C	ZINC001071541564	1354755630	/nfs/dbraw/zinc/75/56/30/1354755630.db2.gz	AOZGLLXRDCGOBQ-WMZOPIPTSA-N	0	3	338.451	3.276	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)Cc2coc3ccc(C)cc23)CC[C@H]1C	ZINC001071543932	1354757093	/nfs/dbraw/zinc/75/70/93/1354757093.db2.gz	PWGZJDRYVCTSSO-NVXWUHKLSA-N	0	3	326.440	3.439	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cn(C)c3ccc(F)cc23)CC[C@@H]1C	ZINC001071571197	1354770670	/nfs/dbraw/zinc/77/06/70/1354770670.db2.gz	AOTQJSKSHMAEII-HOCLYGCPSA-N	0	3	343.446	3.476	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@@H]2CC[C@@H](C)N(CCCF)C2)cc1	ZINC001071619272	1354802533	/nfs/dbraw/zinc/80/25/33/1354802533.db2.gz	MEOOJIQQXMVCCJ-NVXWUHKLSA-N	0	3	334.435	3.194	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N[C@@H]1CC[C@H](C)N(CC(=C)C)C1	ZINC001071620063	1354802965	/nfs/dbraw/zinc/80/29/65/1354802965.db2.gz	ZLDPUCFIISJQMW-DLBZAZTESA-N	0	3	328.456	3.410	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cccc(-n3cccc3)c2)CC[C@@H]1C	ZINC001071654667	1354829778	/nfs/dbraw/zinc/82/97/78/1354829778.db2.gz	HIMNESSIBSNRRI-HKUYNNGSSA-N	0	3	335.451	3.083	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2cc3ncccc3s2)CC[C@H]1C	ZINC001071734748	1354887701	/nfs/dbraw/zinc/88/77/01/1354887701.db2.gz	AADCBINNUGDVBI-KGLIPLIRSA-N	0	3	329.469	3.455	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C(C)(C)c2cccc(F)c2)CC[C@H]1C	ZINC001071825539	1354963497	/nfs/dbraw/zinc/96/34/97/1354963497.db2.gz	YKGAPHJTFHAALI-CRAIPNDOSA-N	0	3	330.447	3.096	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc(C)cc3c[nH]nc32)CC[C@@H]1C	ZINC001071890192	1355008721	/nfs/dbraw/zinc/00/87/21/1355008721.db2.gz	IGTBFLMESPZJHH-GOEBONIOSA-N	0	3	326.444	3.030	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(-c3cn[nH]c3)cc2)CC[C@@H]1C	ZINC001071893349	1355010438	/nfs/dbraw/zinc/01/04/38/1355010438.db2.gz	NUPLBYHLXVNPAQ-HNAYVOBHSA-N	0	3	338.455	3.236	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cccn2C2CCCC2)CC[C@@H]1C	ZINC001071937365	1355034472	/nfs/dbraw/zinc/03/44/72/1355034472.db2.gz	AMJBAVFLJXYFDI-IRXDYDNUSA-N	0	3	327.472	3.209	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc3ccn(C)c3c2)CC[C@@H]1C	ZINC001071962908	1355047197	/nfs/dbraw/zinc/04/71/97/1355047197.db2.gz	CIXAKZUFBFKGCU-MAUKXSAKSA-N	0	3	325.456	3.337	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2[nH]ccc2-c2ccccc2)CC[C@@H]1C	ZINC001071986690	1355060270	/nfs/dbraw/zinc/06/02/70/1355060270.db2.gz	XKCQSYGIGZJFCC-WMZOPIPTSA-N	0	3	335.451	3.288	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cccc(NC(C)=O)c2C)CC[C@H]1C	ZINC001071993595	1355063686	/nfs/dbraw/zinc/06/36/86/1355063686.db2.gz	UPCSSSZBIABSQB-PBHICJAKSA-N	0	3	343.471	3.112	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C(C)(C)c2ccc(F)cc2)CC[C@H]1C	ZINC001072007277	1355071693	/nfs/dbraw/zinc/07/16/93/1355071693.db2.gz	ZKJJHIHTLCBDRO-QAPCUYQASA-N	0	3	330.447	3.096	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cnn(CC(C)C)c2C)CC[C@@H]1C	ZINC001072029805	1355091350	/nfs/dbraw/zinc/09/13/50/1355091350.db2.gz	JUZGJLKRBRSNIZ-RDJZCZTQSA-N	0	3	332.492	3.006	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccsc2C(F)F)CC[C@H]1C	ZINC001072032562	1355092260	/nfs/dbraw/zinc/09/22/60/1355092260.db2.gz	DZLOGOLHKHWUPM-VXGBXAGGSA-N	0	3	326.412	3.292	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2csc3c2CCCC3)CC[C@H]1C	ZINC001072055389	1355105755	/nfs/dbraw/zinc/10/57/55/1355105755.db2.gz	UGCONPUBMDTOIW-HUUCEWRRSA-N	0	3	330.497	3.233	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2csc3c2CCCC3)CC[C@@H]1C	ZINC001072055388	1355106174	/nfs/dbraw/zinc/10/61/74/1355106174.db2.gz	UGCONPUBMDTOIW-GJZGRUSLSA-N	0	3	330.497	3.233	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc3[nH]c(C)c(C)c3c2)CC[C@@H]1C	ZINC001072066711	1355109892	/nfs/dbraw/zinc/10/98/92/1355109892.db2.gz	OBOGYNQJUVAWRG-KBXCAEBGSA-N	0	3	337.467	3.391	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(N(C)C)c(F)c2)CC[C@H]1C	ZINC001072103015	1355131089	/nfs/dbraw/zinc/13/10/89/1355131089.db2.gz	SLWJREPXSIRXRU-GDBMZVCRSA-N	0	3	333.451	3.051	20	30		EGEDHN
C[C@H]1CCN(C(=O)C(C)(C)F)C[C@@H]1CNCc1cc(F)ccc1C#N	ZINC001072156131	1355157384	/nfs/dbraw/zinc/15/73/84/1355157384.db2.gz	KUMVMOGMZOJIIB-BBRMVZONSA-N	0	3	349.425	3.020	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@H](C)[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001072170916	1355165743	/nfs/dbraw/zinc/16/57/43/1355165743.db2.gz	IZTDBHJHYIZIBX-YJBOKZPZSA-N	0	3	343.446	3.238	20	30		EGEDHN
C[C@@H]1CCN(C(=O)CCC2CC2)C[C@@H]1CNCc1ccccc1C#N	ZINC001072231676	1355196082	/nfs/dbraw/zinc/19/60/82/1355196082.db2.gz	LEQSSWUXOCBIKD-UZLBHIALSA-N	0	3	339.483	3.323	20	30		EGEDHN
C[C@H]1CCN(C(=O)CC2(C)CC2)C[C@@H]1CNCc1ccccc1C#N	ZINC001072322902	1355236807	/nfs/dbraw/zinc/23/68/07/1355236807.db2.gz	QAHLHUDOBLLTHJ-LPHOPBHVSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](C)[C@@H](CNCc2ccn(CC)n2)C1	ZINC001072334620	1355243679	/nfs/dbraw/zinc/24/36/79/1355243679.db2.gz	DXMKRMWRYSZFMW-SJORKVTESA-N	0	3	346.519	3.080	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](C)[C@@H](CNCc2nc(C)cs2)C1	ZINC001072338553	1355246248	/nfs/dbraw/zinc/24/62/48/1355246248.db2.gz	CZWCWVBEJCQXOL-ZFWWWQNUSA-N	0	3	335.517	3.238	20	30		EGEDHN
C[C@H](c1ccccc1Cl)N1CCC2(CN(C(=O)[C@@H](C)C#N)C2)C1	ZINC001072544222	1355326601	/nfs/dbraw/zinc/32/66/01/1355326601.db2.gz	FMEUBGHNWXKVNJ-UONOGXRCSA-N	0	3	331.847	3.095	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC2(C1)CCN(CCc1csc(C)n1)C2	ZINC001072944607	1355512553	/nfs/dbraw/zinc/51/25/53/1355512553.db2.gz	HPVYJQJHMAPJPQ-GOSISDBHSA-N	0	3	347.528	3.131	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H](CC)Cc3cccc(C)c3)C2)C1	ZINC001073039356	1355565128	/nfs/dbraw/zinc/56/51/28/1355565128.db2.gz	LXCXCHCDPRSMCX-HXUWFJFHSA-N	0	3	338.495	3.121	20	30		EGEDHN
Cc1ccc(C(=O)N2CC3(C2)CCN(Cc2cccc(C#N)c2)C3)cc1	ZINC001073147525	1355625699	/nfs/dbraw/zinc/62/56/99/1355625699.db2.gz	AIROBNYLNFVXQO-UHFFFAOYSA-N	0	3	345.446	3.215	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2c(C)cccc2Cl)C1	ZINC001073755595	1355890155	/nfs/dbraw/zinc/89/01/55/1355890155.db2.gz	DIUNVDGVPGBLIH-OAHLLOKOSA-N	0	3	336.863	3.045	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2ccc3ccccc3c2)C1	ZINC001073865119	1355925278	/nfs/dbraw/zinc/92/52/78/1355925278.db2.gz	CISGMDADDOQNSE-HXUWFJFHSA-N	0	3	338.451	3.237	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2c(C)csc2Cl)C1	ZINC001073867240	1355927217	/nfs/dbraw/zinc/92/72/17/1355927217.db2.gz	QULKXDICCLSINM-CYBMUJFWSA-N	0	3	342.892	3.107	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCCN1C(=O)c1ccco1	ZINC001073931928	1355967616	/nfs/dbraw/zinc/96/76/16/1355967616.db2.gz	WZNJQXMVIJSEIC-GOSISDBHSA-N	0	3	337.423	3.278	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCCC[C@@H]1CN(C)Cc1cccc(Cl)c1	ZINC001073972871	1356004186	/nfs/dbraw/zinc/00/41/86/1356004186.db2.gz	IFYSXPQXWBGLNA-WMLDXEAASA-N	0	3	333.863	3.313	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCCN1C(=O)/C=C\C1CC1	ZINC001073979054	1356007104	/nfs/dbraw/zinc/00/71/04/1356007104.db2.gz	KOKXXKGPQZKZLT-JPMGXVIASA-N	0	3	337.467	3.337	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCO[C@H]1C1CCN(C(=O)C(C)(C)C)CC1	ZINC001075416085	1356362748	/nfs/dbraw/zinc/36/27/48/1356362748.db2.gz	TWOOTQFSAVLUPM-CVEARBPZSA-N	0	3	342.911	3.161	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cccc(OCCC)c3)[C@@H]2C1	ZINC001075853327	1356434067	/nfs/dbraw/zinc/43/40/67/1356434067.db2.gz	GTSSBIGXAAWDOW-PKOBYXMFSA-N	0	3	328.456	3.198	20	30		EGEDHN
C=CCCN1C[C@@H]2CCN(C(=O)c3cnc(-c4ccoc4)s3)[C@@H]2C1	ZINC001076334131	1356550785	/nfs/dbraw/zinc/55/07/85/1356550785.db2.gz	RNITWAZPEOTTMI-DZGCQCFKSA-N	0	3	343.452	3.126	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccc4scnc4c3)[C@@H]2C1	ZINC001076419893	1356573921	/nfs/dbraw/zinc/57/39/21/1356573921.db2.gz	RGTQEZFAINRJGY-GOEBONIOSA-N	0	3	327.453	3.019	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3cc(Cl)ccc3Cl)[C@@H]2C1	ZINC001076494824	1356596167	/nfs/dbraw/zinc/59/61/67/1356596167.db2.gz	SOVYKLMSHAMHER-BLLLJJGKSA-N	0	3	337.250	3.163	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3cc(-c4ccccc4)co3)[C@@H]2C1	ZINC001076644255	1356641251	/nfs/dbraw/zinc/64/12/51/1356641251.db2.gz	IEOJXQPRTKGJFO-PKOBYXMFSA-N	0	3	334.419	3.116	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)CC2CCC2)C12CCC2	ZINC001078585056	1357019603	/nfs/dbraw/zinc/01/96/03/1357019603.db2.gz	AMOMUSQNKMBQJE-UONOGXRCSA-N	0	3	341.293	3.102	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc3occc3[nH]2)C12CCC2	ZINC001078639946	1357047690	/nfs/dbraw/zinc/04/76/90/1357047690.db2.gz	PXWMWEKQYPDPDO-GJZGRUSLSA-N	0	3	333.819	3.144	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2c(C)noc2C2CC2)C12CCC2	ZINC001078683885	1357053845	/nfs/dbraw/zinc/05/38/45/1357053845.db2.gz	XXNSEYJQRVTZNX-UONOGXRCSA-N	0	3	349.862	3.244	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2C[C@@H](NCc3ncccc3C)C23CCC3)C1	ZINC001078720579	1357065741	/nfs/dbraw/zinc/06/57/41/1357065741.db2.gz	NIRYVNDZQKPIRU-QZTJIDSGSA-N	0	3	339.483	3.263	20	30		EGEDHN
C#CCCN1C[C@@H](C)[C@H](NC(=O)c2cc3c(s2)CCCCC3)C1	ZINC001080888480	1357758499	/nfs/dbraw/zinc/75/84/99/1357758499.db2.gz	CWONKGTVEOPYGV-GDBMZVCRSA-N	0	3	330.497	3.090	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H]2CCC(C)=C(C)C2)C[C@H]1c1ccccc1	ZINC001081120970	1357839811	/nfs/dbraw/zinc/83/98/11/1357839811.db2.gz	NEBXQTWOPCZGBV-QHAWAJNXSA-N	0	3	336.479	3.340	20	30		EGEDHN
CC[C@@H](N[C@@H]1CN(C(=O)C#CC2CC2)C[C@H]1C)c1ccc(F)cc1F	ZINC001082504844	1358052273	/nfs/dbraw/zinc/05/22/73/1358052273.db2.gz	MIRCHZVFDGCIQX-UPRAQXHNSA-N	0	3	346.421	3.266	20	30		EGEDHN
C[C@@H](C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1)C1CCC1	ZINC001082586547	1358059317	/nfs/dbraw/zinc/05/93/17/1358059317.db2.gz	BJCQQXNXKWMRHX-PJIJBLCYSA-N	0	3	343.446	3.070	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)C3CCCCCCC3)[C@H]2C1	ZINC001083139201	1358120556	/nfs/dbraw/zinc/12/05/56/1358120556.db2.gz	MKUYFOGFBJLCKT-RBUKOAKNSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)[C@H](CC)CC3CCCCC3)[C@H]2C1	ZINC001083213240	1358124566	/nfs/dbraw/zinc/12/45/66/1358124566.db2.gz	SMJBXCHHGPHIRB-HSALFYBXSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=CCn1cccc1C(=O)N1C[C@H]2CCN(Cc3cccc(C)c3)C[C@H]21	ZINC001084409226	1358208789	/nfs/dbraw/zinc/20/87/89/1358208789.db2.gz	PTZRPIXWXVKBFP-TZIWHRDSSA-N	0	3	349.478	3.329	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)Cc3c(C)cc(C)cc3C)[C@@H]2C1	ZINC001084628515	1358260138	/nfs/dbraw/zinc/26/01/38/1358260138.db2.gz	KZHSOMSPGDUICH-UYAOXDASSA-N	0	3	326.484	3.263	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)Cc3ccc(F)cc3Cl)[C@@H]2C1	ZINC001084631160	1358261474	/nfs/dbraw/zinc/26/14/74/1358261474.db2.gz	FPUQDWOSCQWSAW-RHSMWYFYSA-N	0	3	336.838	3.130	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@@H]3C[C@H]3c3c(F)cccc3F)[C@@H]2C1	ZINC001084650053	1358268953	/nfs/dbraw/zinc/26/89/53/1358268953.db2.gz	NQCIJGRFWPXBRG-ATNYBXOESA-N	0	3	346.421	3.177	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)[C@@H](CC)c3ccc(Cl)cc3)[C@@H]2C1	ZINC001084846399	1358326738	/nfs/dbraw/zinc/32/67/38/1358326738.db2.gz	GFXJMJCOPQKYNT-NZSAHSFTSA-N	0	3	344.886	3.390	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C[C@@H]3CCc4ccccc43)C[C@@H]21	ZINC001085059500	1358380866	/nfs/dbraw/zinc/38/08/66/1358380866.db2.gz	CQOHFNARBOTTPQ-DYXWJJEUSA-N	0	3	336.479	3.053	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@@H](C)Cc3ccc(C)cc3)C[C@@H]21	ZINC001085102612	1358391981	/nfs/dbraw/zinc/39/19/81/1358391981.db2.gz	MSEJDAOCRNGLMX-TYPHKJRUSA-N	0	3	338.495	3.120	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@H](C)Cc3ccccc3C)C[C@@H]21	ZINC001085103510	1358392465	/nfs/dbraw/zinc/39/24/65/1358392465.db2.gz	VVCRYWWMDNVNAO-GGPKGHCWSA-N	0	3	326.484	3.282	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)c1cccs1	ZINC001085122752	1358401525	/nfs/dbraw/zinc/40/15/25/1358401525.db2.gz	SWEHZRYLBNIKPX-VXGBXAGGSA-N	0	3	343.290	3.287	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cn2cc(C)ccc2n1	ZINC001085242469	1358442384	/nfs/dbraw/zinc/44/23/84/1358442384.db2.gz	SKSIEKNZYOJTDU-HUUCEWRRSA-N	0	3	346.862	3.026	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cccc(COC)c1	ZINC001085262761	1358446275	/nfs/dbraw/zinc/44/62/75/1358446275.db2.gz	DWMZTIQCVIUMTG-IAGOWNOFSA-N	0	3	336.863	3.216	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)c1cocc1C	ZINC001085298064	1358455815	/nfs/dbraw/zinc/45/58/15/1358455815.db2.gz	FDOCNNQVAUIONK-ZIAGYGMSSA-N	0	3	341.249	3.127	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cc(CCC)on1	ZINC001085379701	1358482307	/nfs/dbraw/zinc/48/23/07/1358482307.db2.gz	OUCFRVJJBSWNNC-ZIAGYGMSSA-N	0	3	325.840	3.010	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)Cc1csc(CC)n1	ZINC001085432113	1358498587	/nfs/dbraw/zinc/49/85/87/1358498587.db2.gz	JAUPSACINOYOKW-ZIAGYGMSSA-N	0	3	341.908	3.018	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1cc(C2CC2)[nH]c1C1CC1	ZINC001085670604	1358675970	/nfs/dbraw/zinc/67/59/70/1358675970.db2.gz	ABZAGHRYXKLMKZ-INIZCTEOSA-N	0	3	327.472	3.492	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1ccc(-c2cnco2)cc1	ZINC001085675846	1358679354	/nfs/dbraw/zinc/67/93/54/1358679354.db2.gz	BFUIQENIIYPYRK-KRWDZBQOSA-N	0	3	325.412	3.064	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@@H]1CCOc2c(F)cccc21	ZINC001085714471	1358706181	/nfs/dbraw/zinc/70/61/81/1358706181.db2.gz	LHMMQQGIGHJHPS-DOTOQJQBSA-N	0	3	346.446	3.191	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@H]1CCc2ccc(F)cc2O1	ZINC001085723312	1358711602	/nfs/dbraw/zinc/71/16/02/1358711602.db2.gz	UGQVELHYKNVUQS-ZWKOTPCHSA-N	0	3	346.446	3.018	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1c[nH]nc1-c1ccccc1	ZINC001085748506	1358730750	/nfs/dbraw/zinc/73/07/50/1358730750.db2.gz	JTAFSXRVWNCJDQ-KRWDZBQOSA-N	0	3	338.455	3.189	20	30		EGEDHN
CCC(CC)[C@@H](C)C(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001183817065	1387353849	/nfs/dbraw/zinc/35/38/49/1387353849.db2.gz	LISREJOICGONLB-RDTXWAMCSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C1CCC(C(=O)N(C)C[C@@H]2CCN2C[C@H](O)C2CCCCC2)CC1	ZINC001085800998	1358775832	/nfs/dbraw/zinc/77/58/32/1358775832.db2.gz	HQFZBQWSXUYREN-PMACEKPBSA-N	0	3	348.531	3.207	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@@H]1CCOc2ccccc21	ZINC001085876161	1358840593	/nfs/dbraw/zinc/84/05/93/1358840593.db2.gz	SUANXIKGNORBBD-FUHWJXTLSA-N	0	3	328.456	3.052	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc(OC)cc1Cl	ZINC001085876709	1358841146	/nfs/dbraw/zinc/84/11/46/1358841146.db2.gz	IJQAQGHEECFQGR-CQSZACIVSA-N	0	3	336.863	3.461	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1ncoc1-c1cccs1	ZINC001085878917	1358842634	/nfs/dbraw/zinc/84/26/34/1358842634.db2.gz	QPPOFRJJCFZVOS-ZDUSSCGKSA-N	0	3	331.441	3.126	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1ncoc1-c1cccs1	ZINC001085878916	1358842747	/nfs/dbraw/zinc/84/27/47/1358842747.db2.gz	QPPOFRJJCFZVOS-CYBMUJFWSA-N	0	3	331.441	3.126	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1cccc(N2CCCC2)c1	ZINC001085890839	1358850017	/nfs/dbraw/zinc/85/00/17/1358850017.db2.gz	JVFRPIFPWHBRFI-LJQANCHMSA-N	0	3	327.472	3.009	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1cnn(C(C)C)c1C1CC1	ZINC001085916306	1358876943	/nfs/dbraw/zinc/87/69/43/1358876943.db2.gz	WOBOCLGRPVSYEY-MRXNPFEDSA-N	0	3	330.476	3.064	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cnn(C(C)(C)C)c1CC	ZINC001085975921	1358931238	/nfs/dbraw/zinc/93/12/38/1358931238.db2.gz	JHTQFGJNLFQAHL-MRXNPFEDSA-N	0	3	346.519	3.313	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1ccc(N(C)CCC)cc1	ZINC001086001913	1358957453	/nfs/dbraw/zinc/95/74/53/1358957453.db2.gz	USXXRGYOJVYJIP-LJQANCHMSA-N	0	3	329.488	3.255	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccnn2C(CC)CC)C1	ZINC001086106440	1358999155	/nfs/dbraw/zinc/99/91/55/1358999155.db2.gz	ITHCIBGYWMTGFU-OKILXGFUSA-N	0	3	338.883	3.095	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(-c3cnco3)cc2)C1	ZINC001086123116	1359002924	/nfs/dbraw/zinc/00/29/24/1359002924.db2.gz	OREMUGOWDYZCDK-AKAXFMLLSA-N	0	3	345.830	3.192	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc(C)cc(Cl)c2)C1	ZINC001086148495	1359008884	/nfs/dbraw/zinc/00/88/84/1359008884.db2.gz	NPYMJOIUVWUWAZ-JNSHFYNHSA-N	0	3	327.255	3.499	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@H]2CCc3cc(F)ccc32)C1	ZINC001086149004	1359009326	/nfs/dbraw/zinc/00/93/26/1359009326.db2.gz	MFMSMDRJKYTSAL-MJEQTWJJSA-N	0	3	336.838	3.092	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc(C)c(CC)s2)C1	ZINC001086267584	1359048632	/nfs/dbraw/zinc/04/86/32/1359048632.db2.gz	MTIXRAYSFUQNCD-BETUJISGSA-N	0	3	326.893	3.469	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(OCC3CC3)cc2)C1	ZINC001086274383	1359050750	/nfs/dbraw/zinc/05/07/50/1359050750.db2.gz	FQIGRWJKYZYZNO-WOVMCDHWSA-N	0	3	348.874	3.326	20	30		EGEDHN
CC1(C)CC[C@@H]1C(=O)NC[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001086451544	1359100583	/nfs/dbraw/zinc/10/05/83/1359100583.db2.gz	METXIHRBGOQYLP-DJIMGWMZSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2csc(C(C)(C)C)n2)C1	ZINC001086505576	1359122484	/nfs/dbraw/zinc/12/24/84/1359122484.db2.gz	FRAPEMQNTBYHHT-HAQNSBGRSA-N	0	3	341.908	3.291	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)C[C@H]2CC=CCC2)C1	ZINC001086603831	1359161653	/nfs/dbraw/zinc/16/16/53/1359161653.db2.gz	XDLOQSQFGSPKLS-SESVDKBCSA-N	0	3	336.479	3.340	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)C(C)(C)C2CCC2)C1	ZINC001086601856	1359161860	/nfs/dbraw/zinc/16/18/60/1359161860.db2.gz	SKYDGKCAYIPWSI-VQTJNVASSA-N	0	3	338.495	3.420	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)[C@@H](C)c2ccccc2)C1	ZINC001086620278	1359165991	/nfs/dbraw/zinc/16/59/91/1359165991.db2.gz	IYNBIOAGPPKUDR-YUXAGFNASA-N	0	3	346.474	3.398	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccc3[nH]ccc3c2)C1	ZINC001086790218	1359202245	/nfs/dbraw/zinc/20/22/45/1359202245.db2.gz	DKPCPKFZCWGMQS-XJKSGUPXSA-N	0	3	331.847	3.409	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cc(C)cc3c[nH]nc32)C1	ZINC001086829347	1359209986	/nfs/dbraw/zinc/20/99/86/1359209986.db2.gz	UEAXFOYTAXHYQF-DZGCQCFKSA-N	0	3	346.862	3.112	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2coc(C3CCC3)n2)C1	ZINC001086848980	1359213209	/nfs/dbraw/zinc/21/32/09/1359213209.db2.gz	PUTYPQDBAANXQD-GXTWGEPZSA-N	0	3	337.851	3.183	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccc(C3CC3)cn2)C1	ZINC001086865715	1359216745	/nfs/dbraw/zinc/21/67/45/1359216745.db2.gz	FSOUTFHGYGGKEI-XJKSGUPXSA-N	0	3	333.863	3.200	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)Cc3cccs3)C2)CC1	ZINC001086898172	1359227635	/nfs/dbraw/zinc/22/76/35/1359227635.db2.gz	CAONJXLEUDEGCQ-MRXNPFEDSA-N	0	3	330.497	3.017	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC2(C[C@H]1C)CCN(Cc1ccccc1F)CC2	ZINC001086910183	1359237476	/nfs/dbraw/zinc/23/74/76/1359237476.db2.gz	NPIFPAMUAOPCJY-HZPDHXFCSA-N	0	3	343.446	3.188	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3nc(C(C)C)oc3C)C2)CC1	ZINC001086923709	1359249343	/nfs/dbraw/zinc/24/93/43/1359249343.db2.gz	ZAXFHYOMHSGFHQ-HNNXBMFYSA-N	0	3	343.471	3.056	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)C[C@@H]3CC=CCC3)C2)CC1	ZINC001086937532	1359259825	/nfs/dbraw/zinc/25/98/25/1359259825.db2.gz	RKBKPXIFBHFLBB-RTBURBONSA-N	0	3	328.500	3.459	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)[C@H]3Cc4ccccc43)C2)CC1	ZINC001086938798	1359260853	/nfs/dbraw/zinc/26/08/53/1359260853.db2.gz	AIBBMJTUFIRSIB-PXNSSMCTSA-N	0	3	336.479	3.053	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H]3Cc4ccccc43)C2)CC1	ZINC001086938800	1359261013	/nfs/dbraw/zinc/26/10/13/1359261013.db2.gz	AIBBMJTUFIRSIB-YLJYHZDGSA-N	0	3	336.479	3.053	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc(C(C)C)cn3)C2)CC1	ZINC001086942373	1359264147	/nfs/dbraw/zinc/26/41/47/1359264147.db2.gz	PCWLAVKSNRNQRX-QGZVFWFLSA-N	0	3	339.483	3.155	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3cc(C)cc(F)c3)C2)CC1	ZINC001086944007	1359265221	/nfs/dbraw/zinc/26/52/21/1359265221.db2.gz	LEAHTLGXSGIKJK-KRWDZBQOSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@H](C)Cc3cccs3)C2)CC1	ZINC001086945646	1359266868	/nfs/dbraw/zinc/26/68/68/1359266868.db2.gz	GFHYOKHXWNQWBU-IAGOWNOFSA-N	0	3	344.524	3.263	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H](F)c3ccccc3)C2)CC1	ZINC001086945979	1359267207	/nfs/dbraw/zinc/26/72/07/1359267207.db2.gz	MTLTWYZKMPLDCG-MJGOQNOKSA-N	0	3	342.458	3.424	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cc4sccc4[nH]3)C2)CC1	ZINC001086951940	1359272012	/nfs/dbraw/zinc/27/20/12/1359272012.db2.gz	UQFRCUNPSSBORI-AWEZNQCLSA-N	0	3	341.480	3.179	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cc(C)c(CC)o3)C2)CC1	ZINC001086952959	1359273365	/nfs/dbraw/zinc/27/33/65/1359273365.db2.gz	VPIWZANCYFMAKM-INIZCTEOSA-N	0	3	328.456	3.100	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)Cc3ccc(C)s3)C2)CC1	ZINC001086958409	1359279321	/nfs/dbraw/zinc/27/93/21/1359279321.db2.gz	PNQFGGKDLLVCKD-INIZCTEOSA-N	0	3	344.524	3.325	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](CNCc2ccccc2C#N)[C@@H](C)C1	ZINC001184078857	1387389697	/nfs/dbraw/zinc/38/96/97/1387389697.db2.gz	RCTBDKSOMKXMEY-FUHWJXTLSA-N	0	3	325.456	3.099	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3sccc3C)C(C)(C)[C@H]21	ZINC001087265331	1359334465	/nfs/dbraw/zinc/33/44/65/1359334465.db2.gz	SWDIGPCVPAJRHH-OIISXLGYSA-N	0	3	330.497	3.299	20	30		EGEDHN
C=CCC[N@H+]1CCC[C@@H]2[C@@H](NC(=O)c3ccccc3[O-])C(C)(C)[C@@H]21	ZINC001087271536	1359345001	/nfs/dbraw/zinc/34/50/01/1359345001.db2.gz	SRXTZXAFAIRMOQ-KBAYOESNSA-N	0	3	328.456	3.187	20	30		EGEDHN
C=CCC[N@@H+]1CCC[C@@H]2[C@@H](NC(=O)c3ccccc3[O-])C(C)(C)[C@@H]21	ZINC001087271536	1359345003	/nfs/dbraw/zinc/34/50/03/1359345003.db2.gz	SRXTZXAFAIRMOQ-KBAYOESNSA-N	0	3	328.456	3.187	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccoc1CC	ZINC001087284095	1359363546	/nfs/dbraw/zinc/36/35/46/1359363546.db2.gz	BQPYWTJTUWBSNS-BPQIPLTHSA-N	0	3	328.456	3.084	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc4cccnc43)C(C)(C)[C@H]21	ZINC001087294538	1359375202	/nfs/dbraw/zinc/37/52/02/1359375202.db2.gz	UYLFGGXGDACYTB-RLLQIKCJSA-N	0	3	347.462	3.087	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc4ncccc43)C(C)(C)[C@@H]21	ZINC001087299049	1359381531	/nfs/dbraw/zinc/38/15/31/1359381531.db2.gz	PDSSRVQQTQQOKB-MISYRCLQSA-N	0	3	347.462	3.087	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3cccc4[nH]ccc43)C(C)(C)[C@H]21	ZINC001087305204	1359390278	/nfs/dbraw/zinc/39/02/78/1359390278.db2.gz	ORRDIGRVYHSECI-HOJAQTOUSA-N	0	3	349.478	3.410	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc(F)ccc3Cl)C(C)(C)[C@H]21	ZINC001087305844	1359391403	/nfs/dbraw/zinc/39/14/03/1359391403.db2.gz	ZKLLAUKYNDFPSY-COXVUDFISA-N	0	3	348.849	3.331	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3oc(CC)cc3C)C(C)(C)[C@H]21	ZINC001087313427	1359401923	/nfs/dbraw/zinc/40/19/23/1359401923.db2.gz	UYRWALIYJHFMRH-NEWSRXKRSA-N	0	3	342.483	3.393	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc(Cl)c3)C(C)(C)[C@H]21	ZINC001087313941	1359402549	/nfs/dbraw/zinc/40/25/49/1359402549.db2.gz	CFVBOFKAXJYYHD-ZACQAIPSSA-N	0	3	330.859	3.192	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3sc(C)nc3C)C(C)(C)[C@H]21	ZINC001087315928	1359406025	/nfs/dbraw/zinc/40/60/25/1359406025.db2.gz	KHKKNDIZKBUOLW-PVAVHDDUSA-N	0	3	345.512	3.002	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc2c(s1)CCC2	ZINC001087316861	1359407603	/nfs/dbraw/zinc/40/76/03/1359407603.db2.gz	YNXTXKRDENPNIF-FHLIZLRMSA-N	0	3	342.508	3.089	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cccc4cnccc43)C(C)(C)[C@H]21	ZINC001087317686	1359409122	/nfs/dbraw/zinc/40/91/22/1359409122.db2.gz	LJEGOGWKGDBQQF-AABGKKOBSA-N	0	3	347.462	3.087	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc4ccccc4[nH]3)C(C)(C)[C@@H]21	ZINC001087318282	1359409827	/nfs/dbraw/zinc/40/98/27/1359409827.db2.gz	UWPQJVVDTCNBJA-ATZDWAIDSA-N	0	3	335.451	3.020	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(CF)cc3)C(C)(C)[C@@H]21	ZINC001087319055	1359411838	/nfs/dbraw/zinc/41/18/38/1359411838.db2.gz	HZFVMRAZZLQPMC-GUDVDZBRSA-N	0	3	342.458	3.398	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(F)s3)C(C)(C)[C@H]21	ZINC001087319637	1359412323	/nfs/dbraw/zinc/41/23/23/1359412323.db2.gz	RBJDVJUTEQVZDN-WQVCFCJDSA-N	0	3	334.460	3.129	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3coc4ccccc34)C(C)(C)[C@@H]21	ZINC001087321414	1359412868	/nfs/dbraw/zinc/41/28/68/1359412868.db2.gz	UAOKJAKOFPUKJN-ATZDWAIDSA-N	0	3	336.435	3.285	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3[C@H](C2)[C@@H]2CC[C@H]3CN2C/C=C/Cl)C1	ZINC001087390118	1359444855	/nfs/dbraw/zinc/44/48/55/1359444855.db2.gz	VTODLRMSVGJZMX-VPDPHILASA-N	0	3	334.891	3.264	20	30		EGEDHN
C=CCCN1CC[C@H](c2cccc(F)c2)[C@H](NC(=O)c2cc[nH]c2)C1	ZINC001087455290	1359474324	/nfs/dbraw/zinc/47/43/24/1359474324.db2.gz	LTEQWLQLOWSLAY-RTBURBONSA-N	0	3	341.430	3.318	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2csc([C@@H]3CCCO3)n2)[C@H]1CC	ZINC001087571642	1359537134	/nfs/dbraw/zinc/53/71/34/1359537134.db2.gz	DJIVOPYKPGTOSA-IMJJTQAJSA-N	0	3	349.500	3.153	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)[C@H]2Cc3cc(Cl)ccc3O2)[C@H]1CC	ZINC001087646694	1359569599	/nfs/dbraw/zinc/56/95/99/1359569599.db2.gz	NXRTUURRCDRSHS-LZLYRXPVSA-N	0	3	348.874	3.189	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cccc(C(F)F)c2)[C@H]1CC	ZINC001087655630	1359574836	/nfs/dbraw/zinc/57/48/36/1359574836.db2.gz	LPVVSFZRMBRDLL-DLBZAZTESA-N	0	3	334.410	3.159	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2c(C)nn(CCC)c2C)[C@H]1CC	ZINC001087788063	1359645609	/nfs/dbraw/zinc/64/56/09/1359645609.db2.gz	CJBNTEJIBBNWCR-DLBZAZTESA-N	0	3	332.492	3.069	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnn(C3CCCC3)c2C)[C@H]1CC	ZINC001087790498	1359647101	/nfs/dbraw/zinc/64/71/01/1359647101.db2.gz	QGMCGULNVJCFFY-ZWKOTPCHSA-N	0	3	330.476	3.075	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2c[nH]c3cccc(C)c23)[C@H]1CC	ZINC001087799608	1359651429	/nfs/dbraw/zinc/65/14/29/1359651429.db2.gz	DQYZIRZNGLVMQW-PKOBYXMFSA-N	0	3	337.467	3.011	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3ccc(C)cc3)[C@@H]2CC)nc1	ZINC001087800273	1359652753	/nfs/dbraw/zinc/65/27/53/1359652753.db2.gz	KVEWOFRFIRPCIV-PZJWPPBQSA-N	0	3	347.462	3.154	20	30		EGEDHN
C=CCCN1CC[C@H](NC(=O)c2ccc(P(C)(C)=O)cc2)[C@H]1CC	ZINC001087837290	1359672894	/nfs/dbraw/zinc/67/28/94/1359672894.db2.gz	CTZHBKAXAGFNSC-ZWKOTPCHSA-N	0	3	348.427	3.093	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc(N(C)CCC)cc2)[C@H]1CC	ZINC001087849869	1359680138	/nfs/dbraw/zinc/68/01/38/1359680138.db2.gz	ZOYIJTDUDJWOPI-RBUKOAKNSA-N	0	3	329.488	3.302	20	30		EGEDHN
CC(C)(C)CC(=O)N1C[C@H]2CCN(Cc3cccc(C#N)c3)C[C@H]2C1	ZINC001087883492	1359695242	/nfs/dbraw/zinc/69/52/42/1359695242.db2.gz	VLQXIPXIBSAEEZ-MOPGFXCFSA-N	0	3	339.483	3.275	20	30		EGEDHN
Cc1cc(Cl)ccc1CN1CC[C@@H]2CN(C(=O)[C@@H](C)C#N)C[C@@H]2C1	ZINC001087911242	1359704799	/nfs/dbraw/zinc/70/47/99/1359704799.db2.gz	OIHZJGQQGRCPPW-UAGQMJEPSA-N	0	3	345.874	3.088	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)[C@H](c3ccccc3)C(C)C)C[C@@H]2C1	ZINC001088122228	1359764330	/nfs/dbraw/zinc/76/43/30/1359764330.db2.gz	SOYVJZBKOGOJNE-HKBOAZHASA-N	0	3	338.495	3.230	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)[C@H](CC)Cc3ccccc3)C[C@@H]2C1	ZINC001088125853	1359765020	/nfs/dbraw/zinc/76/50/20/1359765020.db2.gz	DDIKKGCVWRAALU-NJYVYQBISA-N	0	3	338.495	3.059	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3ccc4ccccc4c3)C[C@@H]2C1	ZINC001088181082	1359783619	/nfs/dbraw/zinc/78/36/19/1359783619.db2.gz	RWWXMCWBCVCJGB-RTWAWAEBSA-N	0	3	332.447	3.257	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)CCc3ccccc3Cl)C[C@@H]2C1	ZINC001088193795	1359790141	/nfs/dbraw/zinc/79/01/41/1359790141.db2.gz	WVSNPORGLAWPQW-MSOLQXFVSA-N	0	3	344.886	3.076	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3c(CC)oc4ccccc43)C[C@@H]2C1	ZINC001088213690	1359797939	/nfs/dbraw/zinc/79/79/39/1359797939.db2.gz	KFSMNLBRPFZAML-CVEARBPZSA-N	0	3	336.435	3.022	20	30		EGEDHN
C=CCN1CC[C@H](OCC2CCN(C(=O)CC3CCCC3)CC2)C1	ZINC001088228704	1359807497	/nfs/dbraw/zinc/80/74/97/1359807497.db2.gz	YCHBWARMCOBRPI-IBGZPJMESA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCCCC[C@H](NCc2cn(C)nc2C)C1	ZINC001088374683	1359856003	/nfs/dbraw/zinc/85/60/03/1359856003.db2.gz	NPZCPZYNMVFJSS-AZUAARDMSA-N	0	3	346.519	3.192	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2ccc3cccnn32)C1	ZINC001088395057	1359870905	/nfs/dbraw/zinc/87/09/05/1359870905.db2.gz	WKIHZEVUUBGSTA-HNNXBMFYSA-N	0	3	346.862	3.061	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)CCc2cscn2)C1	ZINC001088433076	1359901678	/nfs/dbraw/zinc/90/16/78/1359901678.db2.gz	LTZLVMYJZTYZLB-CQSZACIVSA-N	0	3	341.908	3.189	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](CNCc2c(F)cccc2F)[C@@H](C)C1	ZINC001184303441	1387425156	/nfs/dbraw/zinc/42/51/56/1387425156.db2.gz	YYXFBCSJNZIYJW-JKSUJKDBSA-N	0	3	348.437	3.343	20	30		EGEDHN
C[C@@H]1[C@@H](NC(=O)c2c[nH]c(C#N)c2)CCN1Cc1ccc(C2CC2)cc1	ZINC001088533643	1359961396	/nfs/dbraw/zinc/96/13/96/1359961396.db2.gz	AZEAAUWVDVPABX-VLIAUNLRSA-N	0	3	348.450	3.157	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cc(F)cc3ccncc32)[C@H]1C	ZINC001088575969	1359978118	/nfs/dbraw/zinc/97/81/18/1359978118.db2.gz	PJFFGKBLUUFRHH-ACJLOTCBSA-N	0	3	327.403	3.143	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CCN(Cc3ccc(C)c(C)c3)[C@@H]2C)c1	ZINC001088847078	1360080033	/nfs/dbraw/zinc/08/00/33/1360080033.db2.gz	WFMXYUHKAWAPMZ-UTKZUKDTSA-N	0	3	347.462	3.073	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)C2CC(c3ccc(F)cc3)C2)[C@H]1C	ZINC001089077868	1360161648	/nfs/dbraw/zinc/16/16/48/1360161648.db2.gz	AMIDPXKZHVNANU-MRTGAJDVSA-N	0	3	330.447	3.474	20	30		EGEDHN
CC[C@H](F)C(=O)N1CCCC[C@H]1CN(C)Cc1ccc(C#N)cc1	ZINC001089210663	1360256296	/nfs/dbraw/zinc/25/62/96/1360256296.db2.gz	ZUBNWYLRRBJKHF-ROUUACIJSA-N	0	3	331.435	3.119	20	30		EGEDHN
CC1(C)C[C@H](NC(=O)c2ccc[nH]2)CCN(CC#Cc2ccccc2)C1	ZINC001089312100	1360330752	/nfs/dbraw/zinc/33/07/52/1360330752.db2.gz	HHVHRQLGLGKPOW-LJQANCHMSA-N	0	3	349.478	3.287	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2nsc3ccccc32)CC(C)(C)C1	ZINC001089395880	1360395692	/nfs/dbraw/zinc/39/56/92/1360395692.db2.gz	BHDBGYPGXKBNHB-AWEZNQCLSA-N	0	3	341.480	3.150	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cccc(OCCC)c2)CC(C)(C)C1	ZINC001089399115	1360399015	/nfs/dbraw/zinc/39/90/15/1360399015.db2.gz	VKYWLGIYHSEPJM-GOSISDBHSA-N	0	3	342.483	3.329	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc(C)cc(OC)c2C)CC(C)(C)C1	ZINC001089430535	1360422161	/nfs/dbraw/zinc/42/21/61/1360422161.db2.gz	ODZWTEIMHZICNT-KRWDZBQOSA-N	0	3	342.483	3.166	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc(Cl)ccc2F)CC(C)(C)C1	ZINC001089435794	1360426670	/nfs/dbraw/zinc/42/66/70/1360426670.db2.gz	PREYIVIDVMINPY-AWEZNQCLSA-N	0	3	336.838	3.333	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2ccc(CC)cc2)CC(C)(C)C1	ZINC001089505007	1360477889	/nfs/dbraw/zinc/47/78/89/1360477889.db2.gz	FLDJKUHEPKQRJN-IBGZPJMESA-N	0	3	326.484	3.032	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2scnc2C(C)C)CC(C)(C)C1	ZINC001089515721	1360486123	/nfs/dbraw/zinc/48/61/23/1360486123.db2.gz	ZAWHERHCJIGDIS-CQSZACIVSA-N	0	3	333.501	3.120	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(C3CC3)s2)CC(C)(C)C1	ZINC001089541667	1360498604	/nfs/dbraw/zinc/49/86/04/1360498604.db2.gz	MJUSFKJNLOGYHL-HNNXBMFYSA-N	0	3	330.497	3.479	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C2(c3cccc(C)c3)CC2)CC(C)(C)C1	ZINC001089566711	1360512818	/nfs/dbraw/zinc/51/28/18/1360512818.db2.gz	QXGGCUHFRAEMGX-IBGZPJMESA-N	0	3	338.495	3.267	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(CC)ccn1	ZINC001089646078	1360558883	/nfs/dbraw/zinc/55/88/83/1360558883.db2.gz	IPEKSDKKMNDXML-KRWDZBQOSA-N	0	3	329.488	3.441	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(OC)cc1F	ZINC001089663410	1360573462	/nfs/dbraw/zinc/57/34/62/1360573462.db2.gz	ODKQPGKJCSJZFL-OAHLLOKOSA-N	0	3	346.446	3.078	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1c[nH]nc1CCC	ZINC001089664099	1360574321	/nfs/dbraw/zinc/57/43/21/1360574321.db2.gz	ZNQNGMVDGLEHBV-OAHLLOKOSA-N	0	3	332.492	3.159	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc2cnccc2o1	ZINC001089664430	1360574814	/nfs/dbraw/zinc/57/48/14/1360574814.db2.gz	KOGHZPAUQQMTRG-MRXNPFEDSA-N	0	3	339.439	3.072	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1nncc2ccccc21	ZINC001089669601	1360579293	/nfs/dbraw/zinc/57/92/93/1360579293.db2.gz	PDORSPVUQJTHTF-INIZCTEOSA-N	0	3	338.455	3.036	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ncc(C)cc1C	ZINC001089672956	1360582465	/nfs/dbraw/zinc/58/24/65/1360582465.db2.gz	VNMAHZRTXUXXTD-QGZVFWFLSA-N	0	3	329.488	3.495	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1occ2c1CCOC2	ZINC001089676400	1360585112	/nfs/dbraw/zinc/58/51/12/1360585112.db2.gz	GBLBPLBCENDSBY-INIZCTEOSA-N	0	3	346.471	3.149	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(C)ccc1F	ZINC001089704008	1360606843	/nfs/dbraw/zinc/60/68/43/1360606843.db2.gz	RUJQIWHVWNANPP-INIZCTEOSA-N	0	3	330.447	3.378	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc2[nH]ccc2s1	ZINC001089726714	1360629753	/nfs/dbraw/zinc/62/97/53/1360629753.db2.gz	PAWTYBLJEDSSOD-AWEZNQCLSA-N	0	3	343.496	3.473	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(OC)c(OC)c1	ZINC001089729376	1360632804	/nfs/dbraw/zinc/63/28/04/1360632804.db2.gz	MLGBAFPHBCREBB-MRXNPFEDSA-N	0	3	346.471	3.110	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(Cl)cn1CC	ZINC001089732005	1360635868	/nfs/dbraw/zinc/63/58/68/1360635868.db2.gz	JSRFMLRWWPYHHI-INIZCTEOSA-N	0	3	349.906	3.405	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1ccc(F)cc1	ZINC001089760489	1360652858	/nfs/dbraw/zinc/65/28/58/1360652858.db2.gz	LQMJWHFVYPIVFJ-HPBDAGMYSA-N	0	3	348.849	3.361	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)C2CCCCC2)C1	ZINC001089761006	1360653403	/nfs/dbraw/zinc/65/34/03/1360653403.db2.gz	QHBCOGLQACUDSN-XSLAGTTESA-N	0	3	336.907	3.488	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)c2coc(C)c2)C1	ZINC001089798928	1360668433	/nfs/dbraw/zinc/66/84/33/1360668433.db2.gz	BDCQASHXKZAWOJ-HJWJTTGWSA-N	0	3	334.847	3.123	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)Cc1ccccc1	ZINC001089825294	1360682072	/nfs/dbraw/zinc/68/20/72/1360682072.db2.gz	AXMRPLKVGTUAPG-RDGPPVDQSA-N	0	3	344.886	3.150	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1(C)CCCC1	ZINC001089848689	1360696168	/nfs/dbraw/zinc/69/61/68/1360696168.db2.gz	YLZOHAUGZXBAPX-HZMVEIRTSA-N	0	3	336.907	3.488	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1occc1CC	ZINC001089858424	1360703146	/nfs/dbraw/zinc/70/31/46/1360703146.db2.gz	AILAIOJGBIIQPL-NXOAAHMSSA-N	0	3	348.874	3.377	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)c2occc2CC)C1	ZINC001089858425	1360703487	/nfs/dbraw/zinc/70/34/87/1360703487.db2.gz	AILAIOJGBIIQPL-QAETUUGQSA-N	0	3	348.874	3.377	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)C(C)(C)C(F)F)C1	ZINC001089865619	1360708150	/nfs/dbraw/zinc/70/81/50/1360708150.db2.gz	RIYYNSZSSUOGBP-XUXIUFHCSA-N	0	3	346.849	3.199	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C(C)(C)C(F)F	ZINC001089865616	1360708421	/nfs/dbraw/zinc/70/84/21/1360708421.db2.gz	RIYYNSZSSUOGBP-CRWXNKLISA-N	0	3	346.849	3.199	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)[C@H]2CCCC3(CC3)C2)CC2(CCOCC2)C1	ZINC001089939492	1360754826	/nfs/dbraw/zinc/75/48/26/1360754826.db2.gz	SRNHDYADXVBIAM-ROUUACIJSA-N	0	3	346.515	3.130	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)c2ccc(C)c(C)c2)CC2(CCOCC2)C1	ZINC001089969241	1360772843	/nfs/dbraw/zinc/77/28/43/1360772843.db2.gz	RJROLRFETFVFRE-IBGZPJMESA-N	0	3	342.483	3.090	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cccc([C@H]3CCOC3)c2)C1	ZINC001091106071	1360993065	/nfs/dbraw/zinc/99/30/65/1360993065.db2.gz	GCHZQFPSSKMCHY-GMXGEUMGSA-N	0	3	348.874	3.041	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2nc3ccccc3cc2C)C1	ZINC001091151160	1360999144	/nfs/dbraw/zinc/99/91/44/1360999144.db2.gz	ONMITAVTUDLAPS-UHFFFAOYSA-N	0	3	343.858	3.394	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)c2ccc(C)cc2)C1	ZINC001091339211	1361051438	/nfs/dbraw/zinc/05/14/38/1361051438.db2.gz	CFQCPLPGLVXFFV-UHFFFAOYSA-N	0	3	337.261	3.002	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc(Cl)ccc2OC)C1	ZINC001091353274	1361056744	/nfs/dbraw/zinc/05/67/44/1361056744.db2.gz	FRMJVCOHGZDAKR-UHFFFAOYSA-N	0	3	343.254	3.199	20	30		EGEDHN
Cc1ccc(C(=O)N2C[C@H]3CN(Cc4ccc(C#N)cc4)C[C@@]3(C)C2)o1	ZINC001091458451	1361105625	/nfs/dbraw/zinc/10/56/25/1361105625.db2.gz	ZAICUWRIJVKDRB-NQIIRXRSSA-N	0	3	349.434	3.054	20	30		EGEDHN
Cc1occc1C(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@@]2(C)C1	ZINC001091466718	1361108979	/nfs/dbraw/zinc/10/89/79/1361108979.db2.gz	FVQDDKQELWAZFD-NQIIRXRSSA-N	0	3	349.434	3.054	20	30		EGEDHN
CC(C)=C(F)C(=O)N1C[C@H]2CN(Cc3ccc(C#N)cc3)C[C@@]2(C)C1	ZINC001091590965	1361153816	/nfs/dbraw/zinc/15/38/16/1361153816.db2.gz	KKFDWUFRDTYJKT-XLIONFOSSA-N	0	3	341.430	3.102	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc4cscc4s3)C[C@]2(C)C1	ZINC001091863958	1361237858	/nfs/dbraw/zinc/23/78/58/1361237858.db2.gz	VJRAIXRBMLPVTE-KDOFPFPSSA-N	0	3	344.505	3.380	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cccc(C(C)(C)C)c3)C[C@]2(C)C1	ZINC001092120464	1361311180	/nfs/dbraw/zinc/31/11/80/1361311180.db2.gz	HOIQMOOEGKWBKL-KNQAVFIVSA-N	0	3	338.495	3.401	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3ccc(Cl)c(Cl)c3)C[C@]2(C)C1	ZINC001092223500	1361329754	/nfs/dbraw/zinc/32/97/54/1361329754.db2.gz	MUNUGFCRJZKIFV-DYVFJYSZSA-N	0	3	337.250	3.021	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc(CC)c(C)s3)C[C@]2(C)C1	ZINC001092261381	1361347396	/nfs/dbraw/zinc/34/73/96/1361347396.db2.gz	UVLZLFMOPIEZLB-APWZRJJASA-N	0	3	330.497	3.036	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)/C=C/c2ccco2)CC1	ZINC001093353011	1361566759	/nfs/dbraw/zinc/56/67/59/1361566759.db2.gz	OWVXUNISNXYDPF-YJJPMGAVSA-N	0	3	338.451	3.019	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C2C(C)(C)C2(C)C)CC1	ZINC001093363442	1361574056	/nfs/dbraw/zinc/57/40/56/1361574056.db2.gz	FSEDMRZOCQHOGL-SFHVURJKSA-N	0	3	342.527	3.395	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)c2cc(C)c(C)o2)CC1	ZINC001093368280	1361577901	/nfs/dbraw/zinc/57/79/01/1361577901.db2.gz	VMTYGZKQUSAPQZ-LJQANCHMSA-N	0	3	340.467	3.236	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)c2cc(C)cs2)CC1	ZINC001093369757	1361578745	/nfs/dbraw/zinc/57/87/45/1361578745.db2.gz	KTEOHVMKAWASPM-GOSISDBHSA-N	0	3	342.508	3.396	20	30		EGEDHN
CN1CCC(N(C(=O)Nc2ccc(C#N)cc2)C2CCCC2)CC1	ZINC001184749679	1387527819	/nfs/dbraw/zinc/52/78/19/1387527819.db2.gz	NEVHQFVKMDTHIY-UHFFFAOYSA-N	0	3	326.444	3.429	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@]23CCC[C@H]2N(C/C=C/Cl)CC3)cc1	ZINC001094485428	1361824960	/nfs/dbraw/zinc/82/49/60/1361824960.db2.gz	RRPRSFJAWHRNCU-VBDMRIDUSA-N	0	3	342.870	3.395	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3CCc2scnc2C)C1	ZINC001095983115	1362321597	/nfs/dbraw/zinc/32/15/97/1362321597.db2.gz	QTLOUPDPABKHMP-PMPSAXMXSA-N	0	3	345.512	3.072	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc3nc(C)ccc3o1)C2	ZINC001096395108	1362486976	/nfs/dbraw/zinc/48/69/76/1362486976.db2.gz	IAUVFYDBQOXAOB-YCPHGPKFSA-N	0	3	325.412	3.047	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@@H]1CCc3ccccc3C1)C2	ZINC001096427411	1362506040	/nfs/dbraw/zinc/50/60/40/1362506040.db2.gz	JFRFHNXECAWFMH-DBOLQNLKSA-N	0	3	338.495	3.479	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc(C)nc3ccccc31)C2	ZINC001096481582	1362530293	/nfs/dbraw/zinc/53/02/93/1362530293.db2.gz	KXSKADBXGSPNHD-XPGWFJOJSA-N	0	3	335.451	3.454	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(OCC3CC3)cc1)C2	ZINC001096567731	1362582767	/nfs/dbraw/zinc/58/27/67/1362582767.db2.gz	WRCOLSBRPUIPRS-HOJAQTOUSA-N	0	3	340.467	3.387	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](C)c1ccc(F)c(F)c1)C2	ZINC001096580208	1362586494	/nfs/dbraw/zinc/58/64/94/1362586494.db2.gz	KHYKEEBZSDGFJM-YENGBRFLSA-N	0	3	334.410	3.366	20	30		EGEDHN
Cc1ccc(C)c(CN2[C@@H]3CC[C@H]2[C@H](NC(=O)c2cc(C#N)c[nH]2)C3)c1	ZINC001096931107	1362781068	/nfs/dbraw/zinc/78/10/68/1362781068.db2.gz	NOHZTDVJXJBWMZ-GGPKGHCWSA-N	0	3	348.450	3.039	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cncc(-c3ccccc3)c1)C2	ZINC001097175216	1362873862	/nfs/dbraw/zinc/87/38/62/1362873862.db2.gz	ARUJCMLYQRCDGP-NJYVYQBISA-N	0	3	345.446	3.107	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CC[C@H](C)F	ZINC001097357309	1362949645	/nfs/dbraw/zinc/94/96/45/1362949645.db2.gz	KOFSGQACIXWNOP-IDCNUPLLSA-N	0	3	346.446	3.335	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc(COC)cs1)C2	ZINC001097449708	1362995832	/nfs/dbraw/zinc/99/58/32/1362995832.db2.gz	SQXWKKYOFYGIGB-OAGGEKHMSA-N	0	3	334.485	3.196	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1c(C)noc1C1CC1)C2	ZINC001097558752	1363055519	/nfs/dbraw/zinc/05/55/19/1363055519.db2.gz	PHVKMJDFHYDELU-OAGGEKHMSA-N	0	3	329.444	3.162	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(C)c(Cl)c1F)C2	ZINC001097575609	1363058537	/nfs/dbraw/zinc/05/85/37/1363058537.db2.gz	KLPGBAUIPKLJKJ-YUELXQCFSA-N	0	3	334.822	3.146	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](C)c1ccc(Cl)s1)C2	ZINC001098180769	1363245938	/nfs/dbraw/zinc/24/59/38/1363245938.db2.gz	NJPCAGYRJPSYOS-DGAVXFQQSA-N	0	3	336.888	3.250	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](CNCc3nccs3)[C@@H](C)C2)CCC1	ZINC001185095814	1387617810	/nfs/dbraw/zinc/61/78/10/1387617810.db2.gz	TXKOVORUJASVHA-HOTGVXAUSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@]1(c3ccccc3)C[C@H](F)C1)C2	ZINC001098301597	1363290618	/nfs/dbraw/zinc/29/06/18/1363290618.db2.gz	GWNPEKWGARNOCD-BKZNIZDZSA-N	0	3	342.458	3.354	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1=CCCCCC1)C[C@H](C)O2	ZINC001098590407	1363390733	/nfs/dbraw/zinc/39/07/33/1363390733.db2.gz	SPVRHTKAHZIFKL-KRWDZBQOSA-N	0	3	332.488	3.145	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)CC(C)(C)C1CC1)C[C@@H](C)O2	ZINC001098592678	1363391274	/nfs/dbraw/zinc/39/12/74/1363391274.db2.gz	PDOSAYBMPLYMCC-MRXNPFEDSA-N	0	3	334.504	3.081	20	30		EGEDHN
CCCCCCCNCc1cn([C@H]2CCN(C(=O)[C@H](C)CC)C2)nn1	ZINC001098622440	1363403747	/nfs/dbraw/zinc/40/37/47/1363403747.db2.gz	JAWSVLXKBMXEFZ-AEFFLSMTSA-N	0	3	349.523	3.158	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1c(C)cccc1C)C[C@H](C)O2	ZINC001098638825	1363411308	/nfs/dbraw/zinc/41/13/08/1363411308.db2.gz	CLEXKUTZTWCIEP-SFHVURJKSA-N	0	3	342.483	3.185	20	30		EGEDHN
C/C=C(/C)C(=O)N1CC[C@@H](n2cc(CNCCCCCCC)nn2)C1	ZINC001098650110	1363417081	/nfs/dbraw/zinc/41/70/81/1363417081.db2.gz	YKDNDDBBMGDURS-JZWGVLFKSA-N	0	3	347.507	3.078	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccc(C)cc1C)C[C@@H](C)O2	ZINC001098660520	1363423425	/nfs/dbraw/zinc/42/34/25/1363423425.db2.gz	UUJCKWPPDUKNCR-GOSISDBHSA-N	0	3	342.483	3.185	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1(C)CCC(C)CC1)C[C@@H](C)O2	ZINC001098663985	1363425497	/nfs/dbraw/zinc/42/54/97/1363425497.db2.gz	KRVLJTWKPPQHAS-QPIRBTGLSA-N	0	3	348.531	3.471	20	30		EGEDHN
CC1CC(C(=O)N[C@]23CCC[C@H]2CN(Cc2ccc(C#N)cc2)C3)C1	ZINC001098783709	1363466603	/nfs/dbraw/zinc/46/66/03/1363466603.db2.gz	OFJDBCSHHNNLHT-SKRQAFIBSA-N	0	3	337.467	3.075	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccnc(-c3ccco3)c2)C1	ZINC001098892562	1363507595	/nfs/dbraw/zinc/50/75/95/1363507595.db2.gz	KLRXKICABOFRLU-JXFKEZNVSA-N	0	3	337.423	3.112	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(F)cc3ccoc32)C1	ZINC001098913025	1363518126	/nfs/dbraw/zinc/51/81/26/1363518126.db2.gz	JJVPFPGQXNCYLN-LIRRHRJNSA-N	0	3	328.387	3.342	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)Cc2cccc(C(F)F)c2)C1	ZINC001098940678	1363531433	/nfs/dbraw/zinc/53/14/33/1363531433.db2.gz	DIHFUXIECOTUMB-PXNSSMCTSA-N	0	3	346.421	3.161	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cncc3sccc32)C1	ZINC001098992569	1363560711	/nfs/dbraw/zinc/56/07/11/1363560711.db2.gz	ZDSBOJSEQMAIAM-UGSOOPFHSA-N	0	3	327.453	3.067	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N[C@]12CCC[C@H]1CN(Cc1cccc(C#N)c1)C2	ZINC001099037102	1363587097	/nfs/dbraw/zinc/58/70/97/1363587097.db2.gz	FLODYUOPYJOOSS-HDAAZOAOSA-N	0	3	337.467	3.075	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)C(C)(C)[C@H]1CCCCO1	ZINC001099079656	1363611880	/nfs/dbraw/zinc/61/18/80/1363611880.db2.gz	HAPYTVMYKYCDQE-DLBZAZTESA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)C[C@@H]1Cc2ccccc2O1	ZINC001099085689	1363615255	/nfs/dbraw/zinc/61/52/55/1363615255.db2.gz	QSLJAFOEBZTBPA-MSOLQXFVSA-N	0	3	342.483	3.173	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2cc3cccnc3s2)C1	ZINC001099104657	1363623912	/nfs/dbraw/zinc/62/39/12/1363623912.db2.gz	JVIJCMDQPOVGCJ-KXBFYZLASA-N	0	3	341.480	3.457	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)Cc1cc(C)ccc1OC	ZINC001099135378	1363646558	/nfs/dbraw/zinc/64/65/58/1363646558.db2.gz	JUTZUEDZCQNVPJ-GOSISDBHSA-N	0	3	344.499	3.339	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(F)c(F)cc2Cl)C1	ZINC001099146082	1363654043	/nfs/dbraw/zinc/65/40/43/1363654043.db2.gz	XQXJVLNEMWSJAT-GTNSWQLSSA-N	0	3	340.801	3.389	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H](OCC)C1CCCC1	ZINC001099159352	1363662563	/nfs/dbraw/zinc/66/25/63/1363662563.db2.gz	QYMAEPDBBPUFQW-OALUTQOASA-N	0	3	348.531	3.212	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)C1CC2(CCC2)C1	ZINC001099182258	1363677109	/nfs/dbraw/zinc/67/71/09/1363677109.db2.gz	IQMBSFQVLGKKBZ-GOSISDBHSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2ccccc2C)C[C@H]1C(F)(F)F	ZINC001099205346	1363691930	/nfs/dbraw/zinc/69/19/30/1363691930.db2.gz	YXKLOTGNQHOTEJ-HUUCEWRRSA-N	0	3	326.362	3.164	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@H](F)c1ccccc1	ZINC001099245015	1363711187	/nfs/dbraw/zinc/71/11/87/1363711187.db2.gz	GIRQXPKSNFFOMI-ZWKOTPCHSA-N	0	3	330.447	3.327	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@H]2CCC(C)=C(C)C2)C[C@H]1C(F)(F)F	ZINC001099256168	1363717036	/nfs/dbraw/zinc/71/70/36/1363717036.db2.gz	ZARPWKCTJBOPST-RRFJBIMHSA-N	0	3	330.394	3.288	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H](C)c1c(C)n[nH]c1C	ZINC001099269930	1363724515	/nfs/dbraw/zinc/72/45/15/1363724515.db2.gz	HETIQWBMTIKGAG-RHSMWYFYSA-N	0	3	346.519	3.313	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@@H](C)Cc2cccs2)C[C@H]1C(F)(F)F	ZINC001099317282	1363746362	/nfs/dbraw/zinc/74/63/62/1363746362.db2.gz	XFQLKOOIXPYQKE-IACUBPJLSA-N	0	3	346.418	3.092	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)C1(CC=C)CCOCC1	ZINC001099323853	1363750538	/nfs/dbraw/zinc/75/05/38/1363750538.db2.gz	BUIPEQMRNCDMBJ-QGZVFWFLSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2cc(CC)c(C)s2)C[C@H]1C(F)(F)F	ZINC001099338596	1363758653	/nfs/dbraw/zinc/75/86/53/1363758653.db2.gz	GEJBRECLGJVRRL-CHWSQXEVSA-N	0	3	346.418	3.397	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)Cc1c(C)noc1C	ZINC001099340729	1363760878	/nfs/dbraw/zinc/76/08/78/1363760878.db2.gz	XSXFQCUDVHKSFW-INIZCTEOSA-N	0	3	333.476	3.017	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)Cc1c(C)noc1C	ZINC001099340730	1363761000	/nfs/dbraw/zinc/76/10/00/1363761000.db2.gz	XSXFQCUDVHKSFW-MRXNPFEDSA-N	0	3	333.476	3.017	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@]2(C)CC=C(C)CC2)C[C@H]1C(F)(F)F	ZINC001099346933	1363763326	/nfs/dbraw/zinc/76/33/26/1363763326.db2.gz	WJYZRVIYNJGODA-IIAWOOMASA-N	0	3	330.394	3.288	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@H](C)Cc2ccccc2)C[C@H]1C(F)(F)F	ZINC001099346207	1363763527	/nfs/dbraw/zinc/76/35/27/1363763527.db2.gz	KLYLMOSUVLOQAK-FVQBIDKESA-N	0	3	340.389	3.030	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CC2(C)CCCC2)CC2(CCOCC2)C1	ZINC001099579632	1363861839	/nfs/dbraw/zinc/86/18/39/1363861839.db2.gz	WYGJLJCEAPCWNL-QGZVFWFLSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@H]1CN(CC(=C)C)CC2(CCOCC2)C1	ZINC001099590845	1363872496	/nfs/dbraw/zinc/87/24/96/1363872496.db2.gz	MCHPEXHTYUCYKI-MJGOQNOKSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)[C@H](CCC)C(C)C)CC2(CCOCC2)C1	ZINC001099593422	1363875273	/nfs/dbraw/zinc/87/52/73/1363875273.db2.gz	YLGIAGMCTHXHNC-QZTJIDSGSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)C[C@@H](C)C(C)C)C1	ZINC001100172019	1364035073	/nfs/dbraw/zinc/03/50/73/1364035073.db2.gz	UGPXYEDEDJVGGC-LMWSTFAQSA-N	0	3	331.298	3.062	20	30		EGEDHN
CC(C)(C)/C=C/C(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1	ZINC001100192646	1364040717	/nfs/dbraw/zinc/04/07/17/1364040717.db2.gz	JKOKFPRKQXDKDC-VOTSOKGWSA-N	0	3	343.446	3.284	20	30		EGEDHN
CC(C)(CC(=O)NCC1CC(NCC#Cc2ccccc2)C1)C1CC1	ZINC001100306789	1364075514	/nfs/dbraw/zinc/07/55/14/1364075514.db2.gz	YTTWUZIDLGLXON-UHFFFAOYSA-N	0	3	338.495	3.349	20	30		EGEDHN
O=C(NCC1CC(NCC#Cc2ccccc2)C1)[C@@H]1C[C@@H]2C=C[C@H]1CC2	ZINC001100345035	1364086069	/nfs/dbraw/zinc/08/60/69/1364086069.db2.gz	NGQXHYBEDRWSLW-UMQHGBHDSA-N	0	3	348.490	3.125	20	30		EGEDHN
C=CC(C)(C)C(=O)NCC1CC(NCc2oc(C(C)C)nc2C)C1	ZINC001100564647	1364164433	/nfs/dbraw/zinc/16/44/33/1364164433.db2.gz	PVCANSWZRAJAKN-UHFFFAOYSA-N	0	3	333.476	3.303	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1	ZINC001100595077	1364180241	/nfs/dbraw/zinc/18/02/41/1364180241.db2.gz	LNKRSODBFMDONT-MXWWQKGMSA-N	0	3	343.446	3.284	20	30		EGEDHN
C=CCCC1(C(=O)NCC2CC(NCc3oc(C)nc3C)C2)CC1	ZINC001100642517	1364200946	/nfs/dbraw/zinc/20/09/46/1364200946.db2.gz	ASCNLHNQUITCAO-UHFFFAOYSA-N	0	3	331.460	3.022	20	30		EGEDHN
C=CCC1(C(=O)NCC2CC(NCc3oc(C)nc3C)C2)CCC1	ZINC001100648554	1364203974	/nfs/dbraw/zinc/20/39/74/1364203974.db2.gz	HTCOBHFBGBYGPH-UHFFFAOYSA-N	0	3	331.460	3.022	20	30		EGEDHN
CCCCCCCCC(=O)NCC1CC(N[C@@H](C)c2n[nH]c(C)n2)C1	ZINC001100906541	1364325170	/nfs/dbraw/zinc/32/51/70/1364325170.db2.gz	MQLAMDHHDDPSQF-OOHWJJMZSA-N	0	3	349.523	3.409	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C[C@@H]2CCc3ccccc3C2)C1	ZINC001100913071	1364328497	/nfs/dbraw/zinc/32/84/97/1364328497.db2.gz	XZMHVOIIWQAFQD-MDCZIUGASA-N	0	3	346.902	3.419	20	30		EGEDHN
C=C[C@@H](CC(=O)NCC1CC(NCc2ccccn2)C1)c1ccccc1	ZINC001101013820	1364372847	/nfs/dbraw/zinc/37/28/47/1364372847.db2.gz	MGTCXJXXOOUWGZ-WBTXTPOCSA-N	0	3	349.478	3.426	20	30		EGEDHN
C=CCCC(=O)N1C[C@H]2CN(Cc3cn(C(C)C)nc3C)C[C@@]2(C)C1	ZINC001101168732	1364443417	/nfs/dbraw/zinc/44/34/17/1364443417.db2.gz	RWHKLOAGPUSLFX-QUCCMNQESA-N	0	3	344.503	3.019	20	30		EGEDHN
C=CCCCC(=O)N1C[C@H]2CN(Cc3cncc(C)c3)C[C@@]2(C)C1	ZINC001101347014	1364520931	/nfs/dbraw/zinc/52/09/31/1364520931.db2.gz	RHIUITPWSUKFQZ-QUCCMNQESA-N	0	3	327.472	3.027	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@H]2CN(Cc3ncccc3C)C[C@@]2(C)C1	ZINC001101378372	1364535651	/nfs/dbraw/zinc/53/56/51/1364535651.db2.gz	XDKAVIAKFQCYRT-UTKZUKDTSA-N	0	3	341.499	3.273	20	30		EGEDHN
C=CCC[C@@H](C)N1CC2(C1)C[C@@H](NC(=O)CCC(=C)C)c1nccn12	ZINC001101630327	1364662357	/nfs/dbraw/zinc/66/23/57/1364662357.db2.gz	DUENHBQPFRIZCI-IAGOWNOFSA-N	0	3	342.487	3.166	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CC2(CN(CCC(C)C)C2)n2ccnc21	ZINC001101635548	1364663633	/nfs/dbraw/zinc/66/36/33/1364663633.db2.gz	LXAHBBMCAVAKBK-MRXNPFEDSA-N	0	3	344.503	3.103	20	30		EGEDHN
C/C=C(\C)C(=O)NC[C@@H]1CN(CC#Cc2cccc(Cl)c2)C[C@H]1C	ZINC001101862349	1364754748	/nfs/dbraw/zinc/75/47/48/1364754748.db2.gz	WLNYIXBHCXNHHT-YUOGFCRJSA-N	0	3	344.886	3.342	20	30		EGEDHN
C[C@@H](c1ccccc1Cl)N1C[C@@H](CNC(=O)C#CC2CC2)[C@H](C)C1	ZINC001101953964	1364788889	/nfs/dbraw/zinc/78/88/89/1364788889.db2.gz	LRVITRMOZCTXSL-HLLBOEOZSA-N	0	3	344.886	3.499	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H]1CN(Cc2c(C)noc2CC)C[C@H]1C	ZINC001102011520	1364811682	/nfs/dbraw/zinc/81/16/82/1364811682.db2.gz	BYKOEUAAUQVNSO-GDBMZVCRSA-N	0	3	333.476	3.086	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@@H]1CN(Cc2c(C)noc2C)C[C@H]1C	ZINC001102260729	1364973211	/nfs/dbraw/zinc/97/32/11/1364973211.db2.gz	BMRINLQBWSELEB-JJRVBVJISA-N	0	3	333.476	3.078	20	30		EGEDHN
C=CCCC1(C(=O)NC[C@@H]2CN(Cc3conc3CC)C[C@H]2C)CC1	ZINC001102326114	1365002742	/nfs/dbraw/zinc/00/27/42/1365002742.db2.gz	IZDLCJAWJOXCOF-HZPDHXFCSA-N	0	3	345.487	3.168	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C	ZINC001102328319	1365003907	/nfs/dbraw/zinc/00/39/07/1365003907.db2.gz	DPANYXHCWTYZRA-UZKOGDIHSA-N	0	3	338.495	3.325	20	30		EGEDHN
CCCC1(C(=O)NC[C@@H]2CN(CC#Cc3ccccc3)C[C@H]2C)CC1	ZINC001102340409	1365010224	/nfs/dbraw/zinc/01/02/24/1365010224.db2.gz	HRWMQGHZEYSEGO-UYAOXDASSA-N	0	3	338.495	3.303	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@@H]1CN(Cc2cc(C)ns2)C[C@H]1C	ZINC001102411471	1365044278	/nfs/dbraw/zinc/04/42/78/1365044278.db2.gz	YCSNJYGQPGQMBH-UKRRQHHQSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](NCc3ccc(C)nc3C)C2)CC1	ZINC001185439073	1387717497	/nfs/dbraw/zinc/71/74/97/1387717497.db2.gz	KEPHKCIBELJWEH-GOSISDBHSA-N	0	3	327.472	3.135	20	30		EGEDHN
C=C[C@H](C(=O)NC[C@@H]1CN(Cc2ccccn2)C[C@H]1C)c1ccccc1	ZINC001102593220	1365129178	/nfs/dbraw/zinc/12/91/78/1365129178.db2.gz	MJJVIQDXCRONGC-QFUCXCTJSA-N	0	3	349.478	3.236	20	30		EGEDHN
CCCC(=O)NCC[C@@H]1CN(Cc2cc(C#N)ccc2F)C[C@H]1C	ZINC001102637867	1365148350	/nfs/dbraw/zinc/14/83/50/1365148350.db2.gz	YERCTMNKHDVHKH-GDBMZVCRSA-N	0	3	331.435	3.072	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1CCNC(=O)c1ccccc1	ZINC001102642850	1365151164	/nfs/dbraw/zinc/15/11/64/1365151164.db2.gz	TYPOUYMUNJPQKI-YLJYHZDGSA-N	0	3	347.462	3.446	20	30		EGEDHN
CC[C@@H](C)C(=O)NCC[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1C	ZINC001102679858	1365167452	/nfs/dbraw/zinc/16/74/52/1365167452.db2.gz	NMFUXMBDDWYJCP-JFIYKMOQSA-N	0	3	327.472	3.179	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cccc(CC)n2)C1	ZINC001103092803	1365377279	/nfs/dbraw/zinc/37/72/79/1365377279.db2.gz	LVNNXIJLIFGVAG-UKRRQHHQSA-N	0	3	335.879	3.084	20	30		EGEDHN
CC#CCCCC(=O)NCC[C@@H]1CN([C@H](C)c2ncc(C)o2)C[C@H]1C	ZINC001103339800	1365506995	/nfs/dbraw/zinc/50/69/95/1365506995.db2.gz	AREVSWKMTZHAPC-KBAYOESNSA-N	0	3	345.487	3.312	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2c(F)cccc2F)C1	ZINC001103673017	1365719430	/nfs/dbraw/zinc/71/94/30/1365719430.db2.gz	LJPYHVGOTXUCDO-DGCLKSJQSA-N	0	3	342.817	3.405	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CN(C(=O)C[C@H](C)CC)C[C@H]1C	ZINC001104122099	1365917521	/nfs/dbraw/zinc/91/75/21/1365917521.db2.gz	QCSMWOKQDHWOPZ-UMVBOHGHSA-N	0	3	345.325	3.405	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H](C)[C@H](CCNCc2cnoc2C)C1	ZINC001104231790	1365961579	/nfs/dbraw/zinc/96/15/79/1365961579.db2.gz	RSYSAJOSEPABRX-CRAIPNDOSA-N	0	3	345.487	3.326	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)[C@H](CCNCC(=C)Br)C1	ZINC001104245588	1365966972	/nfs/dbraw/zinc/96/69/72/1365966972.db2.gz	QPTQZMUPKNHVKL-UKRRQHHQSA-N	0	3	343.309	3.326	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)[C@H](CCNCc2ccc(F)cn2)C1	ZINC001104492194	1366046776	/nfs/dbraw/zinc/04/67/76/1366046776.db2.gz	TVPXHYBSEYASAL-HUUCEWRRSA-N	0	3	333.451	3.007	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2c(C)onc2CC)C1	ZINC001104607251	1366099407	/nfs/dbraw/zinc/09/94/07/1366099407.db2.gz	NKMBTDYRPBRJAA-NVXWUHKLSA-N	0	3	347.503	3.476	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H](C)[C@H](CCNCc2conc2C)C1	ZINC001104631477	1366110176	/nfs/dbraw/zinc/11/01/76/1366110176.db2.gz	OSWKYWSBROEZFD-OGWOLHLISA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cccc3c2OCC3)C[C@H]1C	ZINC001104711659	1366139647	/nfs/dbraw/zinc/13/96/47/1366139647.db2.gz	VYEAMCGKWWRKNG-CZUORRHYSA-N	0	3	348.874	3.062	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)[C@H](C)Cc2ccco2)C[C@H]1C	ZINC001104782536	1366170429	/nfs/dbraw/zinc/17/04/29/1366170429.db2.gz	HGQINUVIYSIEFS-IIAWOOMASA-N	0	3	338.879	3.285	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)CCCCCOCC)C[C@H]1C	ZINC001105087320	1366318790	/nfs/dbraw/zinc/31/87/90/1366318790.db2.gz	YJCSVQOFLXIZAH-NVXWUHKLSA-N	0	3	344.927	3.410	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(c2ccccc2)C[C@H](NC(=O)[C@@H]2C[C@H]2C)C1	ZINC001105403001	1366449537	/nfs/dbraw/zinc/44/95/37/1366449537.db2.gz	JWPAQIJDECOPLP-QUIPCFFLSA-N	0	3	332.875	3.201	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1C[C@@](CNCCF)(c2ccccc2)C1	ZINC001105439747	1366469431	/nfs/dbraw/zinc/46/94/31/1366469431.db2.gz	KQCHIKLDYPFBRI-MSEWRSJXSA-N	0	3	332.463	3.364	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](CNCc2ncc(C)s2)[C@H](C)C1	ZINC001106183686	1366617417	/nfs/dbraw/zinc/61/74/17/1366617417.db2.gz	JLUBCBIGMMDFSP-UKRRQHHQSA-N	0	3	335.517	3.238	20	30		EGEDHN
CC#CCCCC(=O)N1C[C@@H](CNCc2nc(C)sc2C)[C@H](C)C1	ZINC001106559395	1366735269	/nfs/dbraw/zinc/73/52/69/1366735269.db2.gz	SBJJOVICCSUHKJ-RHSMWYFYSA-N	0	3	347.528	3.138	20	30		EGEDHN
C=CCCC1(C(=O)N2C[C@@H](CNCc3csc(C)n3)[C@H](C)C2)CC1	ZINC001106629413	1366759927	/nfs/dbraw/zinc/75/99/27/1366759927.db2.gz	KPNSURKRFDIRFF-GDBMZVCRSA-N	0	3	347.528	3.382	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H](CNCc2ccn(C(C)C)n2)[C@H](C)C1	ZINC001106710606	1366778068	/nfs/dbraw/zinc/77/80/68/1366778068.db2.gz	NMVKIPCRQWMMHH-IAGOWNOFSA-N	0	3	346.519	3.250	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@]12CCC[C@H]1N(Cc1cncs1)CC2	ZINC001107424377	1366960397	/nfs/dbraw/zinc/96/03/97/1366960397.db2.gz	KTGISBWGJIUBQB-SJLPKXTDSA-N	0	3	333.501	3.360	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@H](n2cc(CNCCCCC)nn2)C1	ZINC001185992061	1387843301	/nfs/dbraw/zinc/84/33/01/1387843301.db2.gz	BXPMHHQNUGAGIH-SFHVURJKSA-N	0	3	347.507	3.078	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCCc1ccsc1	ZINC001109210042	1367005049	/nfs/dbraw/zinc/00/50/49/1367005049.db2.gz	ZZEBCLVBXDGEQU-SQNIBIBYSA-N	0	3	330.497	3.206	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2[C@H]1CCc2ccccc21	ZINC001109260717	1367031179	/nfs/dbraw/zinc/03/11/79/1367031179.db2.gz	MGBMVBGOYQUNQR-GTAWCEEGSA-N	0	3	336.479	3.445	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cnc([C@H](C)OC)s1)C2	ZINC001109289196	1367040624	/nfs/dbraw/zinc/04/06/24/1367040624.db2.gz	GFONSBILFDNDID-XGUBFFRZSA-N	0	3	349.500	3.152	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@]12CCC[C@H]1N(Cc1cnc(C)o1)CC2	ZINC001107560616	1367043769	/nfs/dbraw/zinc/04/37/69/1367043769.db2.gz	SDXWFCLSBHIGAZ-YLJYHZDGSA-N	0	3	345.487	3.446	20	30		EGEDHN
C#CCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3Cc2cccc(C)c2)CCC1	ZINC001109392296	1367101248	/nfs/dbraw/zinc/10/12/48/1367101248.db2.gz	ZDXIRYABCIXZRO-AABGKKOBSA-N	0	3	336.479	3.410	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2sccc2C)C1	ZINC001107698343	1367107065	/nfs/dbraw/zinc/10/70/65/1367107065.db2.gz	OPBBYACYSVIRDY-CRAIPNDOSA-N	0	3	336.501	3.232	20	30		EGEDHN
CCCC[C@H](C)C(=O)N1CC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001189974264	1367143845	/nfs/dbraw/zinc/14/38/45/1367143845.db2.gz	VGRIJHNIEKVQFC-QFBILLFUSA-N	0	3	327.472	3.417	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@H](N(C)Cc2ccc(C(F)F)cc2)C1	ZINC001190053442	1367161437	/nfs/dbraw/zinc/16/14/37/1367161437.db2.gz	ITLFOGZBIOBQCI-KRWDZBQOSA-N	0	3	334.410	3.316	20	30		EGEDHN
CN(Cc1ccc(CF)cc1)[C@@H]1CCN(C(=O)C#CC(C)(C)C)C1	ZINC001190076799	1367167772	/nfs/dbraw/zinc/16/77/72/1367167772.db2.gz	WJXGTNLAOUGZGX-GOSISDBHSA-N	0	3	330.447	3.238	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N2CC[C@H](N(C)CC=C(C)C)C2)cc1	ZINC001190121765	1367178009	/nfs/dbraw/zinc/17/80/09/1367178009.db2.gz	RGOUHAKJZLHIDO-IBGZPJMESA-N	0	3	340.467	3.201	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2cc(C)cs2)C1	ZINC001107921972	1367202901	/nfs/dbraw/zinc/20/29/01/1367202901.db2.gz	JMOPDDPXZKWFRU-YJBOKZPZSA-N	0	3	336.501	3.232	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2ccsc2C)C1	ZINC001107930041	1367207486	/nfs/dbraw/zinc/20/74/86/1367207486.db2.gz	CKPDXVDWYVZSBJ-KSSFIOAISA-N	0	3	336.501	3.232	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](N(C)CCOc2ccccc2F)C1	ZINC001190435953	1367265118	/nfs/dbraw/zinc/26/51/18/1367265118.db2.gz	MSRNMJVQGKIHRK-MRXNPFEDSA-N	0	3	334.435	3.094	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3C[C@H]2CC(C)(C)CO2)CC1	ZINC001109682042	1367279837	/nfs/dbraw/zinc/27/98/37/1367279837.db2.gz	QZXSNLJWPGJZJY-BDXSIMOUSA-N	0	3	346.515	3.269	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@]2(C)CN(CCC(C)(C)C)CCO2)CC1	ZINC001108186570	1367329899	/nfs/dbraw/zinc/32/98/99/1367329899.db2.gz	QWNWIAJLLZFHCT-FQEVSTJZSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C1(Cc3ccccc3F)CC1)C2	ZINC001109819284	1367339421	/nfs/dbraw/zinc/33/94/21/1367339421.db2.gz	CNMGEFPGSWJMEH-NEWSRXKRSA-N	0	3	342.458	3.446	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@]2(C)CN(C[C@@H](C)CC(C)C)CCO2)C1	ZINC001108201820	1367340993	/nfs/dbraw/zinc/34/09/93/1367340993.db2.gz	SHOWTGBJYBQYJK-OXJNMPFZSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2ccc(C)cc2F)C1	ZINC001108241027	1367357053	/nfs/dbraw/zinc/35/70/53/1367357053.db2.gz	UHOXKUFAINGZOQ-OXJNMPFZSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2cccc(C)c2C)C1	ZINC001108374378	1367422167	/nfs/dbraw/zinc/42/21/67/1367422167.db2.gz	KQYGPXIIGYWOOR-DYESRHJHSA-N	0	3	344.499	3.479	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1sccc1COC)C2	ZINC001109973283	1367438487	/nfs/dbraw/zinc/43/84/87/1367438487.db2.gz	ADDDHFWRBPRNOT-PMPSAXMXSA-N	0	3	334.485	3.196	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@@H](C)c1ccccc1OC)C2	ZINC001109997874	1367451593	/nfs/dbraw/zinc/45/15/93/1367451593.db2.gz	GUMGZJWLBQAHDT-FPAYPSAMSA-N	0	3	342.483	3.486	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@H](CC)CCCC)C1	ZINC001191245372	1367456974	/nfs/dbraw/zinc/45/69/74/1367456974.db2.gz	DXFGZTZJCSSQPW-KZNAEPCWSA-N	0	3	326.525	3.335	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1c(C)cccc1C	ZINC001110183196	1367551692	/nfs/dbraw/zinc/55/16/92/1367551692.db2.gz	NEJCDOHQOKWDAW-JYBIWHBTSA-N	0	3	342.483	3.116	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@@H](N(C)Cc2ccc(OC)cc2)C1	ZINC001191867634	1367618955	/nfs/dbraw/zinc/61/89/55/1367618955.db2.gz	GAFQUVGHFHOMES-SJLPKXTDSA-N	0	3	330.472	3.330	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](N(C)Cc2ccc(C)c(F)c2)C1	ZINC001191868469	1367622125	/nfs/dbraw/zinc/62/21/25/1367622125.db2.gz	UEBZPMRSECOUPT-SFHVURJKSA-N	0	3	330.447	3.360	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H](N(C)CCOCc2ccccc2)C1	ZINC001192162492	1367705498	/nfs/dbraw/zinc/70/54/98/1367705498.db2.gz	PDMFNXROYYDUJJ-FPOVZHCZSA-N	0	3	344.499	3.338	20	30		EGEDHN
C=CCOCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccc(CCC)cc1	ZINC001109071337	1367750357	/nfs/dbraw/zinc/75/03/57/1367750357.db2.gz	XADJMDHNTWWTFI-AABGKKOBSA-N	0	3	342.483	3.063	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1cc(C)sc1C	ZINC001110496672	1367784467	/nfs/dbraw/zinc/78/44/67/1367784467.db2.gz	BSNMNMJDCXSYEK-KURKYZTESA-N	0	3	330.497	3.390	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2cc(C(C)(C)C)oc2C)C1	ZINC001192560019	1367816738	/nfs/dbraw/zinc/81/67/38/1367816738.db2.gz	LPYQTQCMRJIKOE-INIZCTEOSA-N	0	3	348.487	3.234	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)[C@]2(C)CC[C@H](C)C2(C)C)C1	ZINC001192679996	1367848535	/nfs/dbraw/zinc/84/85/35/1367848535.db2.gz	KMRPGBMLQHYCHQ-QKLQHJQFSA-N	0	3	336.520	3.184	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)CC[C@H](C)c2ccccc2)C1	ZINC001192687791	1367850991	/nfs/dbraw/zinc/85/09/91/1367850991.db2.gz	LTKMWIKFATVKPZ-ICSRJNTNSA-N	0	3	344.499	3.306	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2C[C@H](OC)c1ccccc1	ZINC001110610634	1367871552	/nfs/dbraw/zinc/87/15/52/1367871552.db2.gz	LIKQJFGAUUIDCN-ZRNYENFQSA-N	0	3	342.483	3.452	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3Cc2cccc(C)c2)CCC1	ZINC001110651334	1367894049	/nfs/dbraw/zinc/89/40/49/1367894049.db2.gz	ZDXIRYABCIXZRO-AQNXPRMDSA-N	0	3	336.479	3.410	20	30		EGEDHN
CCC[C@H](CC)C(=O)N1CC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001193122161	1367949589	/nfs/dbraw/zinc/94/95/89/1367949589.db2.gz	IGUJIIQVVOJZDB-OALUTQOASA-N	0	3	327.472	3.417	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCc1scnc1C	ZINC001110933084	1368102908	/nfs/dbraw/zinc/10/29/08/1368102908.db2.gz	FWYFWWHYNRUWMH-SVGFKBNWSA-N	0	3	347.528	3.318	20	30		EGEDHN
CCCCCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc(COC)on1)C2	ZINC001111110801	1368161898	/nfs/dbraw/zinc/16/18/98/1368161898.db2.gz	NWUGPOIYQXQGRY-KYJSFNMBSA-N	0	3	349.475	3.127	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](N(C)CCOC(C)C)C2)CCCCC1	ZINC001194199393	1368206940	/nfs/dbraw/zinc/20/69/40/1368206940.db2.gz	CEUJCTNTZIPPAT-SFHVURJKSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2cc3cc(C)ccc3o2)C1	ZINC001194247299	1368217705	/nfs/dbraw/zinc/21/77/05/1368217705.db2.gz	WCEFCQRYOVUWKE-KRWDZBQOSA-N	0	3	342.439	3.090	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@H](N(C)C[C@H]3CCCCO3)C2)CCCCC1	ZINC001194367322	1368245339	/nfs/dbraw/zinc/24/53/39/1368245339.db2.gz	FAWUEXPWZSBRLK-RBUKOAKNSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@H](C)c1ccccc1)C2	ZINC001111357566	1368271712	/nfs/dbraw/zinc/27/17/12/1368271712.db2.gz	KIORPXZJVMZACT-NBYUQASBSA-N	0	3	342.483	3.104	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](C)c1ccccc1C)C2	ZINC001111440439	1368307340	/nfs/dbraw/zinc/30/73/40/1368307340.db2.gz	PDGLETFKRBGBNF-CUDHKJQZSA-N	0	3	342.483	3.023	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](CCC)CC(C)C)C2	ZINC001111480215	1368316955	/nfs/dbraw/zinc/31/69/55/1368316955.db2.gz	LELYTOOZSJZGOI-MKXGPGLRSA-N	0	3	336.520	3.373	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H]1CCCCC1(C)C)C2	ZINC001111480282	1368317712	/nfs/dbraw/zinc/31/77/12/1368317712.db2.gz	NKJAFAPUOWXUTM-TVFCKZIOSA-N	0	3	334.504	3.127	20	30		EGEDHN
C#CC[C@H](CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CC(=C)C)c1ccccc1	ZINC001111511182	1368323880	/nfs/dbraw/zinc/32/38/80/1368323880.db2.gz	AHFDVKNQOMHVJT-NCYKPQTJSA-N	0	3	336.479	3.481	20	30		EGEDHN
C#CCCN1CC[C@]2(C1)C[C@@H](NC(=O)CCC=C)c1ccccc1O2	ZINC001111529644	1368328033	/nfs/dbraw/zinc/32/80/33/1368328033.db2.gz	NNSOHYPQDHZLAC-WIYYLYMNSA-N	0	3	338.451	3.060	20	30		EGEDHN
C#CCCN1CC[C@]2(C1)C[C@@H](NC(=O)C=C(C)C)c1ccccc1O2	ZINC001111530208	1368329823	/nfs/dbraw/zinc/32/98/23/1368329823.db2.gz	UVQFRNMDWCWRMF-WIYYLYMNSA-N	0	3	338.451	3.060	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1(CCCC)CC1)C[C@H](C)O2	ZINC001111549469	1368341615	/nfs/dbraw/zinc/34/16/15/1368341615.db2.gz	RFKFQYMQTDFNOI-KRWDZBQOSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)CCCCC(C)C)C[C@H](C)O2	ZINC001111550612	1368342376	/nfs/dbraw/zinc/34/23/76/1368342376.db2.gz	FUCLRTWNGAGDQQ-SFHVURJKSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@@H](C)CC(C)C)C[C@H](C)O2	ZINC001111552602	1368343661	/nfs/dbraw/zinc/34/36/61/1368343661.db2.gz	IWSZNLPYKSGVCY-ROUUACIJSA-N	0	3	336.520	3.327	20	30		EGEDHN
C/C(=C\C(=O)N[C@]12CCC[C@H]1CN(Cc1cccc(C#N)c1)C2)C1CC1	ZINC001111625930	1368386319	/nfs/dbraw/zinc/38/63/19/1368386319.db2.gz	KDSJVVIEHQRKJC-HTEQZBAZSA-N	0	3	349.478	3.385	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CCCN(Cc2ccc(C)cc2C)CC1	ZINC001195174382	1368393457	/nfs/dbraw/zinc/39/34/57/1368393457.db2.gz	MDXPBDCULIYKCZ-LJQANCHMSA-N	0	3	344.499	3.319	20	30		EGEDHN
C=CCCC(=O)N[C@]12CCC[C@H]1CN(CCc1ccc(F)c(F)c1)C2	ZINC001111650150	1368411257	/nfs/dbraw/zinc/41/12/57/1368411257.db2.gz	HJOFDEPGSFTPNE-JXFKEZNVSA-N	0	3	348.437	3.444	20	30		EGEDHN
C=CCOCC(=O)N1CCCN(Cc2ccc3ccccc3c2)CC1	ZINC001195283766	1368413767	/nfs/dbraw/zinc/41/37/67/1368413767.db2.gz	IYWKXDSGUHHISZ-UHFFFAOYSA-N	0	3	338.451	3.077	20	30		EGEDHN
C=CCOCC(=O)N[C@]12CCC[C@H]1CN([C@H](C)c1cccc(F)c1)C2	ZINC001111662078	1368414858	/nfs/dbraw/zinc/41/48/58/1368414858.db2.gz	FDCZTBRBJJNYPS-SYNHAJSKSA-N	0	3	346.446	3.060	20	30		EGEDHN
C#CCCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(F)cc1)C2	ZINC001111711368	1368428298	/nfs/dbraw/zinc/42/82/98/1368428298.db2.gz	PKMYVBSSRRDBQR-RXVVDRJESA-N	0	3	342.458	3.490	20	30		EGEDHN
C[C@@H](c1cccc(F)c1)N1C[C@@H]2CCC[C@]2(NC(=O)C#CC2CC2)C1	ZINC001111741921	1368438907	/nfs/dbraw/zinc/43/89/07/1368438907.db2.gz	WARSDOOSVOFLEE-XERREHJYSA-N	0	3	340.442	3.271	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)c2ccn(C(C)C)c2C)C1	ZINC001195549258	1368452796	/nfs/dbraw/zinc/45/27/96/1368452796.db2.gz	VQICWDIZXLIDHZ-RTBURBONSA-N	0	3	349.519	3.123	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H](C)OCc2cccc(C)c2)C1	ZINC001111824096	1368483897	/nfs/dbraw/zinc/48/38/97/1368483897.db2.gz	UWSJDJIGHJWPPB-LMNJBCLMSA-N	0	3	342.483	3.057	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2ccoc2C(F)(F)F)CC1	ZINC001195966500	1368524914	/nfs/dbraw/zinc/52/49/14/1368524914.db2.gz	IAYZNZWCLSULCT-UHFFFAOYSA-N	0	3	330.350	3.413	20	30		EGEDHN
C=C(C)CN1CCCN(C(=O)CCOc2c(C)cccc2C)CC1	ZINC001196066879	1368542094	/nfs/dbraw/zinc/54/20/94/1368542094.db2.gz	QIBVTIPUJKEAIV-UHFFFAOYSA-N	0	3	330.472	3.183	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cncc(OC)c2C)CC1	ZINC001196288783	1368584592	/nfs/dbraw/zinc/58/45/92/1368584592.db2.gz	VJNRPKSUPVLJLI-UHFFFAOYSA-N	0	3	345.487	3.293	20	30		EGEDHN
C#CCN1C[C@@H]2CCC[C@]2(NC(=O)CC[C@@H]2CCc3ccccc32)C1	ZINC001112001084	1368605381	/nfs/dbraw/zinc/60/53/81/1368605381.db2.gz	GRONARNVQKVKNI-IPJJNNNSSA-N	0	3	336.479	3.101	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)C(=O)Nc2ccccc2)CC1	ZINC001196423886	1368613145	/nfs/dbraw/zinc/61/31/45/1368613145.db2.gz	RRJPHXNZSRHXDO-UHFFFAOYSA-N	0	3	345.487	3.130	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H](C)Cc2ccc(C)cc2)C1	ZINC001112012767	1368616554	/nfs/dbraw/zinc/61/65/54/1368616554.db2.gz	KEIPPMRWPYXNKP-VCOUNFBDSA-N	0	3	338.495	3.168	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)CCc2cc(C)sc2C)C1	ZINC001112014182	1368619105	/nfs/dbraw/zinc/61/91/05/1368619105.db2.gz	LOWKSHVKYQKZQD-ICSRJNTNSA-N	0	3	344.524	3.292	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@@H](CC)CC(F)(F)F)C[C@H]1C(F)(F)F	ZINC001112193909	1368708075	/nfs/dbraw/zinc/70/80/75/1368708075.db2.gz	ALSZGOBONNVNLX-HBNTYKKESA-N	0	3	346.315	3.130	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2c(F)cc(F)cc2F)CC1	ZINC001196977679	1368724309	/nfs/dbraw/zinc/72/43/09/1368724309.db2.gz	SMLFHFROEVTNIS-UHFFFAOYSA-N	0	3	326.362	3.218	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCCN(CCCCC3CCOCC3)CC2)C1	ZINC001197103067	1368745166	/nfs/dbraw/zinc/74/51/66/1368745166.db2.gz	ZNZSCGDUNVJFOP-UHFFFAOYSA-N	0	3	348.531	3.474	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2cccnc2OCC(C)C)CC1	ZINC001197850836	1368912626	/nfs/dbraw/zinc/91/26/26/1368912626.db2.gz	YJZZTWAPTUUQIM-UHFFFAOYSA-N	0	3	345.487	3.231	20	30		EGEDHN
CCCCCCCCC(=O)N[C@@H]1CN(CCc2ccccc2)C[C@H]1O	ZINC001198069443	1368954126	/nfs/dbraw/zinc/95/41/26/1368954126.db2.gz	ZMHNBVUAWNURDE-WOJBJXKFSA-N	0	3	346.515	3.141	20	30		EGEDHN
O=C(CC#Cc1ccccc1)N1CCCN(Cc2ccccc2)CC1	ZINC001198215054	1368982156	/nfs/dbraw/zinc/98/21/56/1368982156.db2.gz	YPPFBXPTKXRZRJ-UHFFFAOYSA-N	0	3	332.447	3.163	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)C[C@H](C)c2ccccc2)C1	ZINC001198380663	1369018935	/nfs/dbraw/zinc/01/89/35/1369018935.db2.gz	POENBALHIQQWOX-DFQSSKMNSA-N	0	3	344.499	3.088	20	30		EGEDHN
C[C@H](NCc1cc(=O)n2ncc(C#N)c2[nH]1)c1csc2ccccc21	ZINC001198516834	1369050423	/nfs/dbraw/zinc/05/04/23/1369050423.db2.gz	DMDMASDGKVTHFJ-NSHDSACASA-N	0	3	349.419	3.372	20	30		EGEDHN
C=CCC[C@@H](C)N[C@H](CNC(=O)c1ccc[nH]1)c1ccccc1OC	ZINC001198523392	1369051971	/nfs/dbraw/zinc/05/19/71/1369051971.db2.gz	XMJMPKWUXVHYMC-CRAIPNDOSA-N	0	3	341.455	3.439	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)[C@@H](CC)OCC)c1ccccc1OC	ZINC001198585007	1369066703	/nfs/dbraw/zinc/06/67/03/1369066703.db2.gz	PEGPJRFTOKKJMR-QZTJIDSGSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)CCC(F)(F)F)c1ccccc1OC	ZINC001198637578	1369079005	/nfs/dbraw/zinc/07/90/05/1369079005.db2.gz	QIBKWDZJMFXCGY-CQSZACIVSA-N	0	3	344.377	3.361	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)C[C@@H](C)SC)c1ccccc1OC	ZINC001198668843	1369087280	/nfs/dbraw/zinc/08/72/80/1369087280.db2.gz	VWAIJQXKERHHMC-ZBFHGGJFSA-N	0	3	336.501	3.160	20	30		EGEDHN
C#CCCCC(=O)NC[C@@H](NCCC1CC1)c1ccccc1OC	ZINC001198693758	1369091838	/nfs/dbraw/zinc/09/18/38/1369091838.db2.gz	CBPYQKBNXNILSO-GOSISDBHSA-N	0	3	328.456	3.046	20	30		EGEDHN
COc1ccccc1[C@H](CNC(=O)C#CC(C)C)NCC1CC(C)C1	ZINC001198713099	1369097221	/nfs/dbraw/zinc/09/72/21/1369097221.db2.gz	MUHMTWXIWQMRFN-TVPLGVNVSA-N	0	3	342.483	3.148	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)[C@@H]1CC1(F)F)c1ccccc1OC	ZINC001198712981	1369097324	/nfs/dbraw/zinc/09/73/24/1369097324.db2.gz	JLVWJZHBUUYRGD-GJZGRUSLSA-N	0	3	338.398	3.064	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)C1(F)CCCC1)c1ccccc1OC	ZINC001198784534	1369113250	/nfs/dbraw/zinc/11/32/50/1369113250.db2.gz	HMGPDYCRKBASLU-INIZCTEOSA-N	0	3	334.435	3.301	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@]1(C)C=CCC1)c1ccccc1OC	ZINC001198833529	1369124702	/nfs/dbraw/zinc/12/47/02/1369124702.db2.gz	BNISMCIPXXIIRW-FXAWDEMLSA-N	0	3	328.456	3.375	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@H](NCC[C@H](C)F)c1ccccc1OC	ZINC001198854865	1369129926	/nfs/dbraw/zinc/12/99/26/1369129926.db2.gz	ANHANKDLGBYLBW-FUHWJXTLSA-N	0	3	348.462	3.384	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@@H](NCC1CC1)c1ccccc1OC	ZINC001198856857	1369130304	/nfs/dbraw/zinc/13/03/04/1369130304.db2.gz	KUADVIQGLDJYAD-CRAIPNDOSA-N	0	3	330.472	3.454	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@]2(C)CC=C(C)CC2)C1	ZINC001198880460	1369137878	/nfs/dbraw/zinc/13/78/78/1369137878.db2.gz	OGSHKTGDUALFKL-QWFCFKBJSA-N	0	3	336.520	3.255	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)C1(CF)CC1)c1ccccc1OC	ZINC001198902748	1369144609	/nfs/dbraw/zinc/14/46/09/1369144609.db2.gz	OFWGEDJYNNWXQU-INIZCTEOSA-N	0	3	334.435	3.158	20	30		EGEDHN
C=C[C@H](C(=O)NC[C@@H](NCC)c1ccccc1OC)c1ccccc1	ZINC001198992775	1369167159	/nfs/dbraw/zinc/16/71/59/1369167159.db2.gz	FRNDWUBMHQAJEO-PKOBYXMFSA-N	0	3	338.451	3.432	20	30		EGEDHN
C=C[C@H](C(=O)NC[C@H](NCC)c1ccccc1OC)c1ccccc1	ZINC001198992768	1369167227	/nfs/dbraw/zinc/16/72/27/1369167227.db2.gz	FRNDWUBMHQAJEO-HKUYNNGSSA-N	0	3	338.451	3.432	20	30		EGEDHN
C=CCNC(=S)N(C)C[C@H]1CCCCN1Cc1ccc(OC)cc1	ZINC001200289902	1369342189	/nfs/dbraw/zinc/34/21/89/1369342189.db2.gz	PWYGAXWBBAHBGP-QGZVFWFLSA-N	0	3	347.528	3.042	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC(N[C@H](C)c2nc3ccccc3o2)CC1	ZINC001200448875	1369370968	/nfs/dbraw/zinc/37/09/68/1369370968.db2.gz	RNHVBMMJLOVMRD-OAHLLOKOSA-N	0	3	339.439	3.129	20	30		EGEDHN
C=CCCCCCN1CCN(C(=O)CCn2ccnc2C(C)C)CC1	ZINC001113397476	1369397102	/nfs/dbraw/zinc/39/71/02/1369397102.db2.gz	AHADMVXADUYMPB-UHFFFAOYSA-N	0	3	346.519	3.287	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC(NCc2conc2CC)CC1	ZINC001200747466	1369422489	/nfs/dbraw/zinc/42/24/89/1369422489.db2.gz	JFVLWTQRWRXPKA-UHFFFAOYSA-N	0	3	331.460	3.086	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCCO[C@H](CNCc2cccc(F)c2)C1	ZINC001201209609	1369495930	/nfs/dbraw/zinc/49/59/30/1369495930.db2.gz	BOZGYVLASWOERW-VQIMIIECSA-N	0	3	348.462	3.135	20	30		EGEDHN
CN1CCN(c2cc(Nc3c(C#N)oc4ccccc43)ccn2)CC1	ZINC001201654677	1369597374	/nfs/dbraw/zinc/59/73/74/1369597374.db2.gz	KXTWWUDVUOAWJD-UHFFFAOYSA-N	0	3	333.395	3.195	20	30		EGEDHN
CCCCCCCCCCS(=O)(=O)NC[C@@H]1CCCN(C)C1	ZINC001201838735	1369632611	/nfs/dbraw/zinc/63/26/11/1369632611.db2.gz	NQWIGQRUNDFOIN-KRWDZBQOSA-N	0	3	332.554	3.388	20	30		EGEDHN
CC#CCNC[C@@H]1CN(C(=O)CC(C)(C)C2CCCCC2)CCCO1	ZINC001201863616	1369635900	/nfs/dbraw/zinc/63/59/00/1369635900.db2.gz	OITCLIRRIBITSR-LJQANCHMSA-N	0	3	348.531	3.213	20	30		EGEDHN
CC#CCNC[C@@H]1CN(C(=O)C2CCC(C(C)(C)C)CC2)CCCO1	ZINC001201982441	1369659126	/nfs/dbraw/zinc/65/91/26/1369659126.db2.gz	GJSPXBJICJFEQN-CTWPCTMYSA-N	0	3	348.531	3.069	20	30		EGEDHN
CC(C)=C(C)CC(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001202019648	1369669107	/nfs/dbraw/zinc/66/91/07/1369669107.db2.gz	LIGZOCJNOBAWLV-UHFFFAOYSA-N	0	3	325.456	3.385	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)N1CCC(NCc2nc(C)sc2C)CC1	ZINC001202084678	1369684418	/nfs/dbraw/zinc/68/44/18/1369684418.db2.gz	HRBQQCMCQLWWQQ-CHWSQXEVSA-N	0	3	335.517	3.299	20	30		EGEDHN
CC(C)CC(=O)N[C@@H]1C[C@@H](NCc2cc(C#N)ccc2F)C12CCC2	ZINC001202340109	1369743219	/nfs/dbraw/zinc/74/32/19/1369743219.db2.gz	JTGONYRKYHQSCN-QZTJIDSGSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(NCc3ccn(C(C)C)n3)CC2)CCC1	ZINC001202353372	1369747808	/nfs/dbraw/zinc/74/78/08/1369747808.db2.gz	KNTJZMVHASKICW-UHFFFAOYSA-N	0	3	344.503	3.291	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H]2C[C@@H](NCC#Cc3ccccc3)C23CCC3)o1	ZINC001202370574	1369752731	/nfs/dbraw/zinc/75/27/31/1369752731.db2.gz	IPOHIUGXUBPJKC-UXHICEINSA-N	0	3	348.446	3.270	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H]2C[C@H](NCC#Cc3ccccc3)C23CCC3)o1	ZINC001202370575	1369753105	/nfs/dbraw/zinc/75/31/05/1369753105.db2.gz	IPOHIUGXUBPJKC-VQTJNVASSA-N	0	3	348.446	3.270	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C(F)F)cc3)C[C@H]21	ZINC001114161943	1369769629	/nfs/dbraw/zinc/76/96/29/1369769629.db2.gz	OJMWEQONIFVHLU-DZFIZOCASA-N	0	3	346.421	3.364	20	30		EGEDHN
CC(C)CCC(=O)N[C@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202448534	1369775005	/nfs/dbraw/zinc/77/50/05/1369775005.db2.gz	RICCTUCDSMQMEF-UXHICEINSA-N	0	3	338.495	3.491	20	30		EGEDHN
CCCCC(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C12CCC2	ZINC001202489402	1369788432	/nfs/dbraw/zinc/78/84/32/1369788432.db2.gz	KYKXZRDVCYBLAJ-ROUUACIJSA-N	0	3	343.446	3.405	20	30		EGEDHN
C/C(=C/C(=O)N[C@@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2)C1CC1	ZINC001202573442	1369809683	/nfs/dbraw/zinc/80/96/83/1369809683.db2.gz	LYNTWDJFXCPEJO-PTXNGATOSA-N	0	3	348.490	3.411	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@H](NCc2cc(F)ccc2F)C12CCC2	ZINC001202592501	1369816434	/nfs/dbraw/zinc/81/64/34/1369816434.db2.gz	UDPJFXYGYGSVDS-DLBZAZTESA-N	0	3	334.410	3.448	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1[C@H]2CN(Cc3ccc(CC(C)C)cc3)C[C@H]21	ZINC001114247247	1369826559	/nfs/dbraw/zinc/82/65/59/1369826559.db2.gz	HGRAMWIRPRDRDA-XVAYZXCPSA-N	0	3	338.495	3.091	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H]1[C@H]2CN(Cc3cccc(OC)c3)C[C@H]21	ZINC001114336691	1369898996	/nfs/dbraw/zinc/89/89/96/1369898996.db2.gz	UCWNPUYZEOGHHU-FVQHAEBGSA-N	0	3	348.874	3.020	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1[C@H]2CN(CCOc3cccc(C)c3)C[C@H]21	ZINC001114340661	1369901120	/nfs/dbraw/zinc/90/11/20/1369901120.db2.gz	JXMKPKGMBVENEG-RUYXUALKSA-N	0	3	342.483	3.023	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1C[C@@H](NCc2ccc(F)cc2F)C12CCC2	ZINC001202845190	1369906048	/nfs/dbraw/zinc/90/60/48/1369906048.db2.gz	BSPNUTSBHSYSMV-QZTJIDSGSA-N	0	3	346.421	3.285	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H]1C[C@H](NCc2ccccc2F)C12CCC2	ZINC001202867370	1369912367	/nfs/dbraw/zinc/91/23/67/1369912367.db2.gz	QIPADEKRJKAAKD-ROUUACIJSA-N	0	3	328.431	3.002	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1C[C@H](NCc2conc2C)C12CCC2	ZINC001202951634	1369934685	/nfs/dbraw/zinc/93/46/85/1369934685.db2.gz	SKXWXUPIRYENSP-ROUUACIJSA-N	0	3	343.471	3.268	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1C[C@H](NCc2oc(CC)nc2C)C12CCC2	ZINC001202987989	1369947460	/nfs/dbraw/zinc/94/74/60/1369947460.db2.gz	PNOUXJZWLWLLSB-IRXDYDNUSA-N	0	3	345.487	3.419	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1C[C@@H](NCc2cc(OC)ns2)C12CCC2	ZINC001202988108	1369947502	/nfs/dbraw/zinc/94/75/02/1369947502.db2.gz	QRGPPTQEOKHKDV-CABCVRRESA-N	0	3	349.500	3.025	20	30		EGEDHN
C=C(Br)CNC1CCN(C(=O)CCC(C)(C)C)CC1	ZINC001203010109	1369952934	/nfs/dbraw/zinc/95/29/34/1369952934.db2.gz	GUGLDJYJKDJLEO-UHFFFAOYSA-N	0	3	331.298	3.302	20	30		EGEDHN
CC[C@H](C)[C@H](C)C(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001203091725	1369979797	/nfs/dbraw/zinc/97/97/97/1369979797.db2.gz	FKAXTUNHLMIGRI-HOTGVXAUSA-N	0	3	327.472	3.321	20	30		EGEDHN
Cc1cocc1C(=O)N[C@@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001203266898	1370050477	/nfs/dbraw/zinc/05/04/77/1370050477.db2.gz	WRAJBCONWOUVJQ-VQTJNVASSA-N	0	3	348.446	3.270	20	30		EGEDHN
O=C(N[C@@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2)[C@H]1C[C@H]2C[C@H]2C1	ZINC001203290950	1370064232	/nfs/dbraw/zinc/06/42/32/1370064232.db2.gz	ZIZOJESDIPITQZ-XIYVOTBMSA-N	0	3	348.490	3.101	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2C[C@@H](NCc3ccccn3)C23CCC3)CCC1	ZINC001203364748	1370099407	/nfs/dbraw/zinc/09/94/07/1370099407.db2.gz	BHHFCDUTLTWMMB-QZTJIDSGSA-N	0	3	339.483	3.345	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1C[C@H](NCc2cnc(C)o2)C12CCC2	ZINC001203450534	1370130453	/nfs/dbraw/zinc/13/04/53/1370130453.db2.gz	BMURUQWUXPAROF-JKSUJKDBSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1C[C@H](NCc2cnoc2C)C12CCC2	ZINC001203451022	1370131327	/nfs/dbraw/zinc/13/13/27/1370131327.db2.gz	HMKDEGQSOHKBQO-HOTGVXAUSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1[C@H]2CN(CCOc3ccccc3C)C[C@H]21	ZINC001114896108	1370135457	/nfs/dbraw/zinc/13/54/57/1370135457.db2.gz	JGWMUPZEBBVNPY-DZFIZOCASA-N	0	3	342.483	3.023	20	30		EGEDHN
CC(C)CCCCC(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001115001084	1370202217	/nfs/dbraw/zinc/20/22/17/1370202217.db2.gz	RMAOCURXMWTOSA-KXTWHKPSSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)CCc2ccc(C)o2)C12CCC2	ZINC001203779888	1370260698	/nfs/dbraw/zinc/26/06/98/1370260698.db2.gz	CGZFUDZFVDQFJR-JKSUJKDBSA-N	0	3	336.863	3.290	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@H]1CCN(Cc1ccc(OC)c(F)c1)C2	ZINC001203793107	1370268068	/nfs/dbraw/zinc/26/80/68/1370268068.db2.gz	PTILCZAGXGNVGN-VQTJNVASSA-N	0	3	349.446	3.408	20	30		EGEDHN
C#CCC1(C(=O)N2CCC(NCc3cc(C)no3)CC2)CCCCC1	ZINC001204008306	1370346886	/nfs/dbraw/zinc/34/68/86/1370346886.db2.gz	SYLJHADYMRSILW-UHFFFAOYSA-N	0	3	343.471	3.037	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(NCc3ocnc3C)CC2)CCCC1	ZINC001204157448	1370394340	/nfs/dbraw/zinc/39/43/40/1370394340.db2.gz	SWXNZCHWFZEODS-UHFFFAOYSA-N	0	3	331.460	3.200	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CC[C@H]2CCCO2)CCCCC1	ZINC001115417889	1370443690	/nfs/dbraw/zinc/44/36/90/1370443690.db2.gz	JGAVUQRVQWHFRT-OAHLLOKOSA-N	0	3	328.884	3.107	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCC1(NCc2sccc2Cl)CCCCC1	ZINC001115451950	1370460076	/nfs/dbraw/zinc/46/00/76/1370460076.db2.gz	LZOAXNANVZKUII-LBPRGKRZSA-N	0	3	339.892	3.470	20	30		EGEDHN
C#CCCCC(=O)NCC1(NCc2ncccc2C)CCCCC1	ZINC001115507500	1370506979	/nfs/dbraw/zinc/50/69/79/1370506979.db2.gz	NMUPRWWHPMEWDT-UHFFFAOYSA-N	0	3	327.472	3.102	20	30		EGEDHN
C=C(C)CCC(=O)NCC1(NCc2cncc(F)c2)CCCCC1	ZINC001115557152	1370556061	/nfs/dbraw/zinc/55/60/61/1370556061.db2.gz	WMLFSTHOSMPNMX-UHFFFAOYSA-N	0	3	333.451	3.486	20	30		EGEDHN
COc1cc(C#N)ccc1Nc1ccc(CN2CCN(C)CC2)cc1	ZINC001204751117	1370565574	/nfs/dbraw/zinc/56/55/74/1370565574.db2.gz	KFWNGCADVQTIKI-UHFFFAOYSA-N	0	3	336.439	3.058	20	30		EGEDHN
Cc1coc(Nc2ccc(C3(N4CCN(C)CC4)CC3)cc2)c1C#N	ZINC001205108120	1370652746	/nfs/dbraw/zinc/65/27/46/1370652746.db2.gz	MJMBNLHVGDPIRE-UHFFFAOYSA-N	0	3	336.439	3.440	20	30		EGEDHN
CC[C@@H](F)C(=O)NCC1(NCc2cc(C#N)ccc2F)CCCCC1	ZINC001115671468	1370653130	/nfs/dbraw/zinc/65/31/30/1370653130.db2.gz	ZLBJVOHLDZZCNZ-MRXNPFEDSA-N	0	3	349.425	3.354	20	30		EGEDHN
Cc1ccnc(C#N)c1Nc1ccc(C2(N3CCN(C)CC3)CC2)cc1	ZINC001205108794	1370653267	/nfs/dbraw/zinc/65/32/67/1370653267.db2.gz	SPDHWRJJGMVHHF-UHFFFAOYSA-N	0	3	347.466	3.242	20	30		EGEDHN
CN1CCN(C2(c3ccc(Nc4c(N)cccc4C#N)cc3)CC2)CC1	ZINC001205119484	1370656056	/nfs/dbraw/zinc/65/60/56/1370656056.db2.gz	AHTFQXFFAXXXFL-UHFFFAOYSA-N	0	3	347.466	3.121	20	30		EGEDHN
CC#CCCCC(=O)NCC1(NCc2ccns2)CCCCC1	ZINC001115680107	1370663059	/nfs/dbraw/zinc/66/30/59/1370663059.db2.gz	VUXKCJSOZUJCNG-UHFFFAOYSA-N	0	3	333.501	3.245	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H](C)CCC)CC[C@H]1c1ccc(F)cc1	ZINC001205263088	1370698990	/nfs/dbraw/zinc/69/89/90/1370698990.db2.gz	KAQQQRWATKSXGF-ZYSHUDEJSA-N	0	3	330.447	3.169	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C2(C(C)C)CC2)C[C@H]1c1cccc(F)c1	ZINC001205434814	1370754298	/nfs/dbraw/zinc/75/42/98/1370754298.db2.gz	URZLXYQPVKJROE-RBUKOAKNSA-N	0	3	342.458	3.169	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccc3c(c2)COC3)CCCCC1	ZINC001115770848	1370754828	/nfs/dbraw/zinc/75/48/28/1370754828.db2.gz	FKMBBBURRXDFTJ-UHFFFAOYSA-N	0	3	348.874	3.492	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C[C@H](CC)C(C)C)C[C@H]1c1cccc(F)c1	ZINC001205452416	1370759777	/nfs/dbraw/zinc/75/97/77/1370759777.db2.gz	FKCQOEJNEDAOTP-FFZOFVMBSA-N	0	3	344.474	3.415	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC(CNCc2ncc(C)s2)CC1	ZINC001205897373	1370902925	/nfs/dbraw/zinc/90/29/25/1370902925.db2.gz	FWWVRCYDPNQHPJ-UHFFFAOYSA-N	0	3	347.528	3.363	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)N1CCC(CNCc2oc(CC)nc2C)CC1	ZINC001205953917	1370921780	/nfs/dbraw/zinc/92/17/80/1370921780.db2.gz	BCWTXPNVLMZKKD-LSDHHAIUSA-N	0	3	347.503	3.332	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)N1CCC(CNCc2csc(C)n2)CC1	ZINC001205961507	1370923669	/nfs/dbraw/zinc/92/36/69/1370923669.db2.gz	YRSJSSQJJWYJDJ-ZIAGYGMSSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=CCCS(=O)(=O)NC1C[C@H]2CCC[C@@H](C1)N2Cc1ccccc1	ZINC001326087069	1388110668	/nfs/dbraw/zinc/11/06/68/1388110668.db2.gz	PGWMYLRGVOBVRK-YQQQUEKLSA-N	0	3	348.512	3.068	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC(CNCc2cc(C3CC3)no2)CC1	ZINC001206427918	1371051584	/nfs/dbraw/zinc/05/15/84/1371051584.db2.gz	OMQXRUNJABSIAX-UHFFFAOYSA-N	0	3	345.487	3.483	20	30		EGEDHN
O=C(C1CCCC1)N1CCC[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207022999	1371270370	/nfs/dbraw/zinc/27/03/70/1371270370.db2.gz	ZWSXSLGSMGKWOP-IBGZPJMESA-N	0	3	344.886	3.462	20	30		EGEDHN
Cc1ccsc1C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001207082674	1371288418	/nfs/dbraw/zinc/28/84/18/1371288418.db2.gz	TYQLZONIFAGTBC-GOSISDBHSA-N	0	3	338.476	3.302	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207117390	1371298082	/nfs/dbraw/zinc/29/80/82/1371298082.db2.gz	VCJJSVOCRFZSJV-GOSISDBHSA-N	0	3	332.875	3.318	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN(Cc2ccc(COC)cc2)C[C@H]1C	ZINC001207206489	1371328357	/nfs/dbraw/zinc/32/83/57/1371328357.db2.gz	TYKUQNUDBJPEHX-VQIMIIECSA-N	0	3	330.472	3.126	20	30		EGEDHN
C=CCN(CCN1CCC(c2ccn(C)n2)CC1)C(=O)OC(C)(C)C	ZINC001207204885	1371328860	/nfs/dbraw/zinc/32/88/60/1371328860.db2.gz	YSRYIUCPRAQTCY-UHFFFAOYSA-N	0	3	348.491	3.023	20	30		EGEDHN
CC[C@@H](C)N[C@H](CNC(=O)Nc1sccc1C#N)c1ccco1	ZINC001119831573	1371410551	/nfs/dbraw/zinc/41/05/51/1371410551.db2.gz	YZFAMZTVVZWSML-DGCLKSJQSA-N	0	3	332.429	3.464	20	30		EGEDHN
C=CCCCN1C[C@@H](C)[C@H](NC(=O)c2scnc2C(F)(F)F)C1	ZINC001207579123	1371441698	/nfs/dbraw/zinc/44/16/98/1371441698.db2.gz	WJRPJAYNWVCXOD-GHMZBOCLSA-N	0	3	347.406	3.178	20	30		EGEDHN
CC(C)(C)/C=C\C(=O)N1CCC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001207710841	1371481427	/nfs/dbraw/zinc/48/14/27/1371481427.db2.gz	SJYQWBLMGULWCP-XZVRFQMRSA-N	0	3	343.446	3.380	20	30		EGEDHN
CC(C)(C)/C=C\C(=O)N1CCC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001207710839	1371481438	/nfs/dbraw/zinc/48/14/38/1371481438.db2.gz	SJYQWBLMGULWCP-JJEJIETFSA-N	0	3	343.446	3.380	20	30		EGEDHN
CC(C)(C)/C=C\C(=O)N1CCC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001207711031	1371482772	/nfs/dbraw/zinc/48/27/72/1371482772.db2.gz	WDNCRYRMOBPWQG-JJEJIETFSA-N	0	3	343.446	3.380	20	30		EGEDHN
O=C(C1CC=CC1)N1CCC[C@@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207727353	1371487030	/nfs/dbraw/zinc/48/70/30/1371487030.db2.gz	FYSLELQHTHARCA-LJQANCHMSA-N	0	3	342.870	3.238	20	30		EGEDHN
O=C(CC1CCC1)N1CCC[C@@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207737445	1371489396	/nfs/dbraw/zinc/48/93/96/1371489396.db2.gz	FNJAEOSEPGKXHC-LJQANCHMSA-N	0	3	344.886	3.462	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NCC1(NCc2ccccc2F)CCCCC1	ZINC001120233995	1371510340	/nfs/dbraw/zinc/51/03/40/1371510340.db2.gz	STHLZJGHLLPEEY-MRXNPFEDSA-N	0	3	348.462	3.326	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)COCCCC)C1	ZINC001120355220	1371544593	/nfs/dbraw/zinc/54/45/93/1371544593.db2.gz	GIQRHPTVJDIBNO-IAGOWNOFSA-N	0	3	342.911	3.259	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)COC(C)(C)C)C1	ZINC001120362370	1371547712	/nfs/dbraw/zinc/54/77/12/1371547712.db2.gz	FHJICTXMGLMANP-HOTGVXAUSA-N	0	3	342.911	3.257	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC[C@@H](N[C@H]2CCc3c2c(F)ccc3F)C1	ZINC001208005229	1371565075	/nfs/dbraw/zinc/56/50/75/1371565075.db2.gz	BAWSSIITHLSBJY-KDOFPFPSSA-N	0	3	346.421	3.192	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N2CCC[C@@H](NC[C@H](F)CC)C2)cc1	ZINC001208029250	1371573924	/nfs/dbraw/zinc/57/39/24/1371573924.db2.gz	RQZGWSYMZRIUSP-QZTJIDSGSA-N	0	3	346.446	3.031	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CCC[C@@H](NCC=C(Cl)Cl)C1)OCC	ZINC001208264016	1371691095	/nfs/dbraw/zinc/69/10/95/1371691095.db2.gz	HNZAPIQVDMCJBO-ZIAGYGMSSA-N	0	3	349.302	3.257	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CN(CCOc2ccccc2C)C[C@H]1C	ZINC001208298517	1371705651	/nfs/dbraw/zinc/70/56/51/1371705651.db2.gz	QPBDZNOGHLWCQH-QZTJIDSGSA-N	0	3	344.499	3.413	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CN([C@@H]2CCc3c2cccc3F)C[C@H]1C	ZINC001208374559	1371741234	/nfs/dbraw/zinc/74/12/34/1371741234.db2.gz	MSADJPDOYUPBOR-CDHQVMDDSA-N	0	3	342.458	3.443	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CN(CCOc2ccccc2C)C[C@H]1C	ZINC001208391166	1371749526	/nfs/dbraw/zinc/74/95/26/1371749526.db2.gz	KKUFMYVUFCAULR-GUDVDZBRSA-N	0	3	344.499	3.413	20	30		EGEDHN
C#CCCCC(=O)NC1CC2(CC(NCc3cc(F)ccc3F)C2)C1	ZINC001121007872	1371833386	/nfs/dbraw/zinc/83/33/86/1371833386.db2.gz	QYBJYZZSCVQYNB-UHFFFAOYSA-N	0	3	346.421	3.285	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC1CC2(CC(NCc3conc3C)C2)C1	ZINC001121169260	1371875941	/nfs/dbraw/zinc/87/59/41/1371875941.db2.gz	JFMQFFHTMNOECS-UHFFFAOYSA-N	0	3	331.460	3.102	20	30		EGEDHN
CC(C)(C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1)C1CCC1	ZINC001208779936	1371893803	/nfs/dbraw/zinc/89/38/03/1371893803.db2.gz	CYXGXOLCPLGGLT-FQEVSTJZSA-N	0	3	338.495	3.445	20	30		EGEDHN
Cc1cc(CN2C[C@@H]3CCN(C(=O)C#CC(C)C)[C@@H]3C2)c(C)s1	ZINC001187827572	1388172444	/nfs/dbraw/zinc/17/24/44/1388172444.db2.gz	JDRICTYUFXSLHN-FUHWJXTLSA-N	0	3	330.497	3.057	20	30		EGEDHN
O=C(C[C@@H]1CC=CCC1)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001208993600	1371969351	/nfs/dbraw/zinc/96/93/51/1371969351.db2.gz	LVAWQXCIJWWWIK-NHCUHLMSSA-N	0	3	336.479	3.365	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC[C@@H](NCc2cc(C)ns2)C1	ZINC001209020921	1371976397	/nfs/dbraw/zinc/97/63/97/1371976397.db2.gz	XMWWJMDWSZXYEQ-MRXNPFEDSA-N	0	3	333.501	3.116	20	30		EGEDHN
C=CCN(CCN1CCC(c2cccc(C#N)c2)CC1)C(=O)OCC	ZINC001209022241	1371976889	/nfs/dbraw/zinc/97/68/89/1371976889.db2.gz	JYJPEYSJIDRURR-UHFFFAOYSA-N	0	3	341.455	3.382	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC1CC2(CC(NCc3cc(C)no3)C2)C1	ZINC001121616358	1372026059	/nfs/dbraw/zinc/02/60/59/1372026059.db2.gz	ILDQIAGWKBPCKJ-IZCUCQHTSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@H](NCc2cnn(C(C)(C)C)c2)C1	ZINC001209183024	1372027433	/nfs/dbraw/zinc/02/74/33/1372027433.db2.gz	KVBPNHCQBPRITF-AEFFLSMTSA-N	0	3	346.519	3.321	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC[C@@H](NCc2ccc(C#N)s2)C1	ZINC001209192930	1372033039	/nfs/dbraw/zinc/03/30/39/1372033039.db2.gz	DTYFQPZDZHMAJW-LSDHHAIUSA-N	0	3	331.485	3.303	20	30		EGEDHN
C=CCCCC(=O)NC1CC2(CC(NCc3conc3CC)C2)C1	ZINC001121663601	1372039447	/nfs/dbraw/zinc/03/94/47/1372039447.db2.gz	PHBVWBSRAZDSFW-UHFFFAOYSA-N	0	3	331.460	3.110	20	30		EGEDHN
C=CCCCC(=O)NC1CC2(CC(NCc3cc(C4CC4)no3)C2)C1	ZINC001121675449	1372043137	/nfs/dbraw/zinc/04/31/37/1372043137.db2.gz	YJFMXJSHAMQWRM-UHFFFAOYSA-N	0	3	343.471	3.425	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@@H](CC)Oc2cccc(C)c2)C1	ZINC001209379383	1372083890	/nfs/dbraw/zinc/08/38/90/1372083890.db2.gz	ALJZRENTAPUHDW-BHIYHBOVSA-N	0	3	330.472	3.165	20	30		EGEDHN
C=CCCCCCN1CCO[C@H]2[C@H]1CC[C@H]2COc1ncccn1	ZINC001209427321	1372104042	/nfs/dbraw/zinc/10/40/42/1372104042.db2.gz	NWXBRIMKPQUDNK-RCCFBDPRSA-N	0	3	331.460	3.081	20	30		EGEDHN
C=CCC1(C(=O)N2CCC[C@H](NCc3cnc(C)s3)C2)CCC1	ZINC001209503890	1372122459	/nfs/dbraw/zinc/12/24/59/1372122459.db2.gz	NMMCQQKDWKJCKZ-HNNXBMFYSA-N	0	3	333.501	3.279	20	30		EGEDHN
C=CCC1(C(=O)N2CCC[C@H](NCc3cncc(F)c3)C2)CCC1	ZINC001209505110	1372123298	/nfs/dbraw/zinc/12/32/98/1372123298.db2.gz	YVULXYQTOIUKST-KRWDZBQOSA-N	0	3	331.435	3.048	20	30		EGEDHN
CCCC1(C(=O)N2CCC[C@H](NCc3ccc(C#N)s3)C2)CC1	ZINC001209551080	1372135065	/nfs/dbraw/zinc/13/50/65/1372135065.db2.gz	FOSITXAYIGEJJS-AWEZNQCLSA-N	0	3	331.485	3.281	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccc(Oc2nccc(C)n2)cc1	ZINC001121967652	1372136848	/nfs/dbraw/zinc/13/68/48/1372136848.db2.gz	KZAPKTVMVDPAKJ-MRXNPFEDSA-N	0	3	326.400	3.199	20	30		EGEDHN
Cc1[nH]c2ncccc2c1CN1CCN(c2cccc(C#N)c2)CC1	ZINC001209593443	1372146862	/nfs/dbraw/zinc/14/68/62/1372146862.db2.gz	SAJGCONGXNMKCZ-UHFFFAOYSA-N	0	3	331.423	3.065	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N[C@@H](C)c1nc(-c2ccc(Cl)cc2)no1	ZINC001122111627	1372177199	/nfs/dbraw/zinc/17/71/99/1372177199.db2.gz	CHWWBSRFWJARJT-FZMZJTMJSA-N	0	3	348.834	3.251	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001209867670	1372218079	/nfs/dbraw/zinc/21/80/79/1372218079.db2.gz	ZUNPLHSXROJMKQ-LJQANCHMSA-N	0	3	342.458	3.360	20	30		EGEDHN
C=CC1(CC(=O)N2CCC[C@H](NCc3cnn(C)c3)C2)CCCCC1	ZINC001210106874	1372272266	/nfs/dbraw/zinc/27/22/66/1372272266.db2.gz	LHNPPSRYEGHITN-SFHVURJKSA-N	0	3	344.503	3.027	20	30		EGEDHN
CCc1nc(-c2ccc(C(=O)C(C#N)c3cccc(F)n3)cc2)n[nH]1	ZINC001122721652	1372306468	/nfs/dbraw/zinc/30/64/68/1372306468.db2.gz	XWEQAIOUTDZFQM-ZDUSSCGKSA-N	0	3	335.342	3.058	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)C[C@H](C)C(=O)c1cccc(F)c1	ZINC001123338037	1372431549	/nfs/dbraw/zinc/43/15/49/1372431549.db2.gz	RKZDMNSSGWICLT-SWLSCSKDSA-N	0	3	327.359	3.127	20	30		EGEDHN
C=CCC1(C(=O)N2CCC[C@H](NCc3ccnn3C)C2)CCCCC1	ZINC001211214236	1372504308	/nfs/dbraw/zinc/50/43/08/1372504308.db2.gz	YXRAFKVQKFNSPU-KRWDZBQOSA-N	0	3	344.503	3.027	20	30		EGEDHN
C#CCC1(C(=O)N2CCC[C@@H](NCc3cncs3)C2)CCCCC1	ZINC001211344370	1372536540	/nfs/dbraw/zinc/53/65/40/1372536540.db2.gz	BHAFZRQFYZHZKY-MRXNPFEDSA-N	0	3	345.512	3.198	20	30		EGEDHN
C=CCCOCC(=O)N1CCC[C@H](NCc2cc3ccccc3o2)C1	ZINC001211355095	1372539007	/nfs/dbraw/zinc/53/90/07/1372539007.db2.gz	MQPQLZCNRBCDCP-KRWDZBQOSA-N	0	3	342.439	3.106	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N[C@@H]1CN(Cc2ccc(CCC)cc2)C[C@H]1C	ZINC001211426106	1372556283	/nfs/dbraw/zinc/55/62/83/1372556283.db2.gz	ZBFQAENMDKFIPE-MBOZVWFJSA-N	0	3	344.499	3.167	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2ccsc2C)C[C@H]1c1ccccc1	ZINC001211593142	1372586984	/nfs/dbraw/zinc/58/69/84/1372586984.db2.gz	NTKRNRORXILGQZ-RBUKOAKNSA-N	0	3	338.476	3.278	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@H]2CC[C@H](C)CC2)C[C@H]1c1ccccc1	ZINC001211711593	1372606923	/nfs/dbraw/zinc/60/69/23/1372606923.db2.gz	MSRIUOCCZVZPHV-ZIBCJSCZSA-N	0	3	338.495	3.420	20	30		EGEDHN
C=CC[C@@H](C(=O)N1CC[C@@H](NCc2cnccc2C)C1)c1ccccc1	ZINC001188001706	1388210418	/nfs/dbraw/zinc/21/04/18/1388210418.db2.gz	JSFDJOWYJAUOKQ-NHCUHLMSSA-N	0	3	349.478	3.440	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@@H](C)CC(F)F)[C@H](OC)C1	ZINC001213190567	1372856941	/nfs/dbraw/zinc/85/69/41/1372856941.db2.gz	ZLJJTFUCPSHZTQ-RRFJBIMHSA-N	0	3	334.451	3.064	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CN([C@@H](C)c2ccccc2C)C[C@H]1OC	ZINC001213303712	1372879900	/nfs/dbraw/zinc/87/99/00/1372879900.db2.gz	WQLQSWPKQXPIBN-DFQSSKMNSA-N	0	3	342.483	3.065	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H](NC(=O)c2csc(Cl)c2)[C@H](OC)C1	ZINC001213534455	1372921322	/nfs/dbraw/zinc/92/13/22/1372921322.db2.gz	BWAGAWCRRGENRX-MRVWCRGKSA-N	0	3	342.892	3.185	20	30		EGEDHN
C#CCCCC(=O)NCCNCc1cccc(Oc2ccccc2)c1	ZINC001126338630	1372958721	/nfs/dbraw/zinc/95/87/21/1372958721.db2.gz	DWBPXOMPKACQQI-UHFFFAOYSA-N	0	3	336.435	3.488	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H]2CN(CCOc3ccccc3)C[C@H]21	ZINC001188063745	1388233516	/nfs/dbraw/zinc/23/35/16/1388233516.db2.gz	OOJFGNKWHUAJLV-PKOBYXMFSA-N	0	3	342.483	3.200	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2cc(C)cc(C)c2)[C@H](OC)C1	ZINC001213776773	1372960238	/nfs/dbraw/zinc/96/02/38/1372960238.db2.gz	NVHKYYIPKLBMRM-WOJBJXKFSA-N	0	3	344.499	3.479	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H](NC(=O)c2cc(C)c(C)s2)[C@H](OC)C1	ZINC001213823419	1372967274	/nfs/dbraw/zinc/96/72/74/1372967274.db2.gz	YAYKMNDTRQRDGJ-FVQBIDKESA-N	0	3	336.501	3.149	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@H]2CC3CCC2CC3)[C@H](OC)C1	ZINC001213929646	1372981672	/nfs/dbraw/zinc/98/16/72/1372981672.db2.gz	FQDRXBZYOMRWDW-GNWGEKMJSA-N	0	3	348.531	3.375	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2ccc(C(C)C)s2)[C@H](OC)C1	ZINC001213946908	1372984616	/nfs/dbraw/zinc/98/46/16/1372984616.db2.gz	XUFXIJKFYWZWSM-HUUCEWRRSA-N	0	3	336.501	3.267	20	30		EGEDHN
Cc1cccc(C(=O)N2C[C@@H](C)[C@H](NCC#Cc3ccccc3)C2)c1	ZINC001214076917	1373005466	/nfs/dbraw/zinc/00/54/66/1373005466.db2.gz	BVNOPVNMTFMEAH-WIYYLYMNSA-N	0	3	332.447	3.097	20	30		EGEDHN
CC/C=C(\C)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001214262455	1373033318	/nfs/dbraw/zinc/03/33/18/1373033318.db2.gz	YXMJHVSHOWJRFH-ZYTFGIMSSA-N	0	3	344.886	3.484	20	30		EGEDHN
CCC[C@H](C)CC(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001214296478	1373039532	/nfs/dbraw/zinc/03/95/32/1373039532.db2.gz	JCDMWCICXPDGGT-SQGPQFPESA-N	0	3	344.474	3.440	20	30		EGEDHN
C[C@@H]1CN(C(=O)/C=C/C2CC2)C[C@H]1NCC#Cc1ccc(Cl)cc1	ZINC001214393905	1373053557	/nfs/dbraw/zinc/05/35/57/1373053557.db2.gz	GBSHOEMWTYUCJT-WMCILJIVSA-N	0	3	342.870	3.094	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](C)[C@H](N[C@H](C)c2ccc(F)cc2F)C1	ZINC001214514067	1373072408	/nfs/dbraw/zinc/07/24/08/1373072408.db2.gz	LURHKMMCMBVTBD-HBUWYVDXSA-N	0	3	334.410	3.266	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H](C)[C@H](NCc2scnc2C)C1	ZINC001214707482	1373106046	/nfs/dbraw/zinc/10/60/46/1373106046.db2.gz	OARGXTMBEAFVNA-CZUORRHYSA-N	0	3	333.501	3.156	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)[C@@H](C)CCc3ccc(F)cc3)[C@@H]2C1	ZINC001188165959	1388255869	/nfs/dbraw/zinc/25/58/69/1388255869.db2.gz	UBTLOPVREZPGJO-VDZJLULYSA-N	0	3	330.447	3.113	20	30		EGEDHN
N#Cc1ccc(F)c(-c2noc(-c3cc4c(s3)CCNC4)n2)c1	ZINC001217293797	1373418949	/nfs/dbraw/zinc/41/89/49/1373418949.db2.gz	MHIQGQIGNZZBQF-UHFFFAOYSA-N	0	3	326.356	3.122	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)CCCC(C)(C)C)C1	ZINC001130368584	1373506507	/nfs/dbraw/zinc/50/65/07/1373506507.db2.gz	OWLHOUFNFBKJFX-OAHLLOKOSA-N	0	3	332.492	3.218	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)CCC[C@H](C)CCC)[C@H]2C1	ZINC001218004068	1373532840	/nfs/dbraw/zinc/53/28/40/1373532840.db2.gz	OBIVFMFCXWLKBG-CEXWTWQISA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)[C@@H](CCC)CC(C)C)C1	ZINC001130452463	1373545217	/nfs/dbraw/zinc/54/52/17/1373545217.db2.gz	FWRDJNQQSWICHO-IRXDYDNUSA-N	0	3	346.519	3.464	20	30		EGEDHN
CN1CCCC[C@@H]1CNC(=O)Nc1ccc(OC(C)(C)C)c(C#N)c1	ZINC001218288923	1373589864	/nfs/dbraw/zinc/58/98/64/1373589864.db2.gz	VVNOXKRUMFHUTG-MRXNPFEDSA-N	0	3	344.459	3.341	20	30		EGEDHN
COc1cc([O-])cc(O[C@@H]2C[NH2+][C@H]2C)c1C(=O)/C=C/c1ccccc1	ZINC001218385928	1373604580	/nfs/dbraw/zinc/60/45/80/1373604580.db2.gz	MLNUDYWXZZYUBW-UTNRYCNNSA-N	0	3	339.391	3.036	20	30		EGEDHN
CC(C)=CCCC1=CC(=O)c2c(O)ccc(O[C@@H]3CN[C@@H]3C)c2C1=O	ZINC001218391260	1373604887	/nfs/dbraw/zinc/60/48/87/1373604887.db2.gz	LLMORGNOFKWZEL-SJKOYZFVSA-N	0	3	341.407	3.183	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCO[C@@H]2CN(CC3CC4(CCC4)C3)C[C@@H]21	ZINC001218518770	1373628616	/nfs/dbraw/zinc/62/86/16/1373628616.db2.gz	ZJWRPMCRNVUYMR-YTQUADARSA-N	0	3	346.515	3.081	20	30		EGEDHN
Cc1cc(C#N)c(NC(=O)[C@H](N)C23CC4CC(CC(C4)C2)C3)s1	ZINC001218556367	1373632832	/nfs/dbraw/zinc/63/28/32/1373632832.db2.gz	ZMVMWZYQUCLQRP-ZJZJNUNYSA-N	0	3	329.469	3.410	20	30		EGEDHN
CC(C)=C[C@H]1[C@@H](C(=O)NCCNCc2ccc(C#N)s2)C1(C)C	ZINC001131088934	1373640940	/nfs/dbraw/zinc/64/09/40/1373640940.db2.gz	UGUXYMWWQBCHAV-HOTGVXAUSA-N	0	3	331.485	3.064	20	30		EGEDHN
C=CC1(CC(=O)N2CCO[C@@H]3CN(CCC(C)C)C[C@@H]32)CCCCC1	ZINC001218771650	1373653421	/nfs/dbraw/zinc/65/34/21/1373653421.db2.gz	KFBUBSBVAFVGMA-RBUKOAKNSA-N	0	3	348.531	3.471	20	30		EGEDHN
C[C@H](C#N)c1ccc(NC(=O)[C@@](C)(N)Cc2ccc(F)cc2)cc1	ZINC001218871302	1373663547	/nfs/dbraw/zinc/66/35/47/1373663547.db2.gz	KRXQFWPFQOIRLG-YJYMSZOUSA-N	0	3	325.387	3.351	20	30		EGEDHN
COc1cccc(NC(=O)[C@H](N)C23CC4CC(CC(C4)C2)C3)c1C#N	ZINC001218979018	1373673268	/nfs/dbraw/zinc/67/32/68/1373673268.db2.gz	VJYHGGGXRNKIOP-HLJROMEYSA-N	0	3	339.439	3.049	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CN([C@@H](C)c2cccc3ccccc32)C[C@@H]1O	ZINC001219326163	1373701070	/nfs/dbraw/zinc/70/10/70/1373701070.db2.gz	LMMFTVNOERWZQQ-BEVDRBHNSA-N	0	3	338.451	3.028	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cc3cscc3s2)cc1	ZINC001131475738	1373706631	/nfs/dbraw/zinc/70/66/31/1373706631.db2.gz	YFDHADHTBATJGI-UHFFFAOYSA-N	0	3	341.461	3.354	20	30		EGEDHN
Cc1cc(NC(=O)N[C@]2(C)CCN(Cc3ccccc3)C2)ncc1C#N	ZINC001219692633	1373726769	/nfs/dbraw/zinc/72/67/69/1373726769.db2.gz	RBDVMSZEJUTTHZ-HXUWFJFHSA-N	0	3	349.438	3.048	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)NCc1ccc(OC(F)F)cc1	ZINC001219916116	1373739784	/nfs/dbraw/zinc/73/97/84/1373739784.db2.gz	KVLVPXSHZUHMNW-HNNXBMFYSA-N	0	3	326.387	3.368	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](C)O[C@]2(CCN(Cc3ccccc3)C2)C1	ZINC001131677191	1373758103	/nfs/dbraw/zinc/75/81/03/1373758103.db2.gz	JOFDHFLJTNMMHJ-NQIIRXRSSA-N	0	3	342.483	3.235	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H](C)O[C@@]2(CCN(CC=C(C)C)C2)C1	ZINC001131688996	1373764350	/nfs/dbraw/zinc/76/43/50/1373764350.db2.gz	VQKWDNUKUVCWBW-YLJYHZDGSA-N	0	3	334.504	3.247	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C(C)(C)CC(C)C)C[C@@H](C)O2	ZINC001131691831	1373765684	/nfs/dbraw/zinc/76/56/84/1373765684.db2.gz	AMOADXYPXNGQFT-YLJYHZDGSA-N	0	3	336.520	3.327	20	30		EGEDHN
O=C(C#CC1CC1)N1C[C@H]2CCN(CC/C=C/c3ccccc3)C[C@H]21	ZINC001221530367	1373778092	/nfs/dbraw/zinc/77/80/92/1373778092.db2.gz	HZBRVQGCMNUILH-FTWXOEDXSA-N	0	3	334.463	3.036	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@H]3CCN(C[C@@H](CC)OC)C[C@H]32)CCCC1	ZINC001222152584	1373817545	/nfs/dbraw/zinc/81/75/45/1373817545.db2.gz	WJHFWYXPNRQSFS-KZNAEPCWSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@H]3CCN(C[C@H]4CCCCO4)C[C@H]32)CCCC1	ZINC001222150916	1373818017	/nfs/dbraw/zinc/81/80/17/1373818017.db2.gz	ALGSAQGEHUJOGB-GUDVDZBRSA-N	0	3	346.515	3.225	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCCC[C@@H]1CNCC#Cc1ccc(F)cc1	ZINC001326699364	1388285489	/nfs/dbraw/zinc/28/54/89/1388285489.db2.gz	XRDYEISFYUEOIA-KVMOOHLOSA-N	0	3	328.431	3.114	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@@H](C)N(Cc2ccccc2N(C)C)C1	ZINC001131898604	1375035059	/nfs/dbraw/zinc/03/50/59/1375035059.db2.gz	BKFQENYODXBQHP-SJLPKXTDSA-N	0	3	329.488	3.188	20	30		EGEDHN
CC#CCCCC(=O)NCC1CCN(Cc2ccc(C)nc2C)CC1	ZINC001224156970	1375057063	/nfs/dbraw/zinc/05/70/63/1375057063.db2.gz	CVEFPTYMJXSDIJ-UHFFFAOYSA-N	0	3	341.499	3.220	20	30		EGEDHN
CC#CCCCC(=O)NCC1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001224158407	1375057546	/nfs/dbraw/zinc/05/75/46/1375057546.db2.gz	SVAMFFZWRKPSCJ-UHFFFAOYSA-N	0	3	337.467	3.080	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCC1CCN(Cc2cncc(C)c2)CC1	ZINC001224165089	1375058208	/nfs/dbraw/zinc/05/82/08/1375058208.db2.gz	GEKMKHPAERTXOU-IAGOWNOFSA-N	0	3	329.488	3.176	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CC[C@@H](C)N(Cc2cccc(N(C)C)c2)C1	ZINC001132002652	1375093937	/nfs/dbraw/zinc/09/39/37/1375093937.db2.gz	MBVWERWXJIVCDE-MJGOQNOKSA-N	0	3	341.499	3.025	20	30		EGEDHN
Cc1ccc(CN2C[C@H](NC(=O)C#CC(C)C)CC[C@@H]2C)cc1C	ZINC001132021957	1375102406	/nfs/dbraw/zinc/10/24/06/1375102406.db2.gz	SIZFNTCCCUVBJQ-AZUAARDMSA-N	0	3	326.484	3.432	20	30		EGEDHN
CCc1ccc(CN2C[C@@H](NC(=O)C#CC(C)C)CC[C@@H]2C)cc1	ZINC001132022122	1375103400	/nfs/dbraw/zinc/10/34/00/1375103400.db2.gz	VGWSXIQMFXEFMS-PXNSSMCTSA-N	0	3	326.484	3.378	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N[C@H]2CC[C@H](C)N(CC(=C)C)C2)cc1	ZINC001132041479	1375112927	/nfs/dbraw/zinc/11/29/27/1375112927.db2.gz	FQZOURTYQHEIOH-HKUYNNGSSA-N	0	3	340.467	3.248	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COc2cc(C)ccc2F)CC[C@H]1C	ZINC001132041751	1375113165	/nfs/dbraw/zinc/11/31/65/1375113165.db2.gz	KEZOVIIDHFIXSN-CVEARBPZSA-N	0	3	334.435	3.058	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1CC[C@H](C)N(CCOC2CCC2)C1	ZINC001132057312	1375122957	/nfs/dbraw/zinc/12/29/57/1375122957.db2.gz	NAJPWFAOMIDZTB-WMZOPIPTSA-N	0	3	334.504	3.293	20	30		EGEDHN
C/C=C(\C)C(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccc(F)cc1	ZINC001225592760	1375129043	/nfs/dbraw/zinc/12/90/43/1375129043.db2.gz	OWUCVFFMNBBVMB-MNZAMAJESA-N	0	3	328.431	3.160	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCOc2ccc(C)c(C)c2)CC[C@@H]1C	ZINC001132097608	1375145956	/nfs/dbraw/zinc/14/59/56/1375145956.db2.gz	MBYSOIWJFGOPJK-ROUUACIJSA-N	0	3	330.472	3.227	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCc2cccc(OC)c2)CC[C@@H]1C	ZINC001132168976	1375184013	/nfs/dbraw/zinc/18/40/13/1375184013.db2.gz	ITIWUBGOCZUAGH-FUHWJXTLSA-N	0	3	330.472	3.173	20	30		EGEDHN
O=C(C#CC1CC1)N[C@@H]1CCCC[C@H]1NCc1cc(Cl)ccc1F	ZINC001226111367	1375204434	/nfs/dbraw/zinc/20/44/34/1375204434.db2.gz	GXAKCVATCKTNHH-QZTJIDSGSA-N	0	3	348.849	3.410	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCN[C@H](C)c2ccc(F)c(F)c2)cc1	ZINC001132226729	1375222273	/nfs/dbraw/zinc/22/22/73/1375222273.db2.gz	MOIBFZOOIUNXFR-CYBMUJFWSA-N	0	3	328.362	3.027	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CC[C@H](C)N(CCc2scnc2C)C1	ZINC001132228163	1375224556	/nfs/dbraw/zinc/22/45/56/1375224556.db2.gz	NJBZJWJYZIRZAI-DZGCQCFKSA-N	0	3	335.517	3.175	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCOc2ccc(F)cc2)CC[C@H]1C	ZINC001132252089	1375247619	/nfs/dbraw/zinc/24/76/19/1375247619.db2.gz	AMSNAJINNACKKT-WBVHZDCISA-N	0	3	334.435	3.140	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)CCCc2ccccc2)CC[C@@H]1C	ZINC001132260733	1375251485	/nfs/dbraw/zinc/25/14/85/1375251485.db2.gz	HJRUZGXAKQVTCA-ICSRJNTNSA-N	0	3	344.499	3.181	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CCCC[C@H]1N[C@@H](C)c1n[nH]c(CC)n1	ZINC001226482028	1375266645	/nfs/dbraw/zinc/26/66/45/1375266645.db2.gz	ULZVNFNNXHVENG-RRFJBIMHSA-N	0	3	347.507	3.047	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCNCc1ccc(F)c(Br)c1	ZINC001132391137	1375346518	/nfs/dbraw/zinc/34/65/18/1375346518.db2.gz	BBNCAFHKANYZGT-UHFFFAOYSA-N	0	3	343.240	3.006	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCOc2ccccc2CC)CC[C@H]1C	ZINC001132414806	1375362159	/nfs/dbraw/zinc/36/21/59/1375362159.db2.gz	XIJFJUQWGXXYLK-AEFFLSMTSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COc2ccccc2OCC)CC[C@H]1C	ZINC001132460823	1375403439	/nfs/dbraw/zinc/40/34/39/1375403439.db2.gz	LYBVIFWTAVGHBQ-IAGOWNOFSA-N	0	3	346.471	3.009	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COc2ccc3c(c2)CCC3)CC[C@@H]1C	ZINC001132462048	1375403818	/nfs/dbraw/zinc/40/38/18/1375403818.db2.gz	VLYKXVKEQPLAEJ-LPHOPBHVSA-N	0	3	342.483	3.099	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCCOc2cccc(C)c2)CC[C@@H]1C	ZINC001132462020	1375404382	/nfs/dbraw/zinc/40/43/82/1375404382.db2.gz	VCQFVXMFPMQVJM-ROUUACIJSA-N	0	3	330.472	3.309	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCCOc2cccc(C)c2)CC[C@H]1C	ZINC001132462018	1375404396	/nfs/dbraw/zinc/40/43/96/1375404396.db2.gz	VCQFVXMFPMQVJM-MSOLQXFVSA-N	0	3	330.472	3.309	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COc2ccc3c(c2)CCC3)CC[C@H]1C	ZINC001132462047	1375404603	/nfs/dbraw/zinc/40/46/03/1375404603.db2.gz	VLYKXVKEQPLAEJ-APWZRJJASA-N	0	3	342.483	3.099	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COc2ccccc2CC)CC[C@H]1C	ZINC001132472731	1375412949	/nfs/dbraw/zinc/41/29/49/1375412949.db2.gz	LIAPKJSBWMMSHE-AEFFLSMTSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=CCCCN1C[C@H](NC(=O)c2scnc2Cl)CC[C@H]1C	ZINC001132489979	1375422979	/nfs/dbraw/zinc/42/29/79/1375422979.db2.gz	PMDGYWMDZDJHHH-VXGBXAGGSA-N	0	3	327.881	3.345	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCCOc2cccc(F)c2)CC[C@H]1C	ZINC001132508440	1375432313	/nfs/dbraw/zinc/43/23/13/1375432313.db2.gz	KAESGMJRASSKTG-NVXWUHKLSA-N	0	3	334.435	3.140	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCc2c(C)noc2Cl)CC[C@@H]1C	ZINC001132529594	1375443401	/nfs/dbraw/zinc/44/34/01/1375443401.db2.gz	OPYPWNCYQRCKSE-JSGCOSHPSA-N	0	3	339.867	3.114	20	30		EGEDHN
C#CCC1(C(=O)N[C@H]2CC[C@H](C)N(CCOC(C)C)C2)CCCCC1	ZINC001132530374	1375444422	/nfs/dbraw/zinc/44/44/22/1375444422.db2.gz	XLVOUFSJTQHJPJ-OALUTQOASA-N	0	3	348.531	3.354	20	30		EGEDHN
C#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)C=C2CCC2)CC1	ZINC001132554802	1375461957	/nfs/dbraw/zinc/46/19/57/1375461957.db2.gz	MMNDZRVCIDUSRZ-HXUWFJFHSA-N	0	3	337.467	3.008	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2N(Cc2ccsc2)C(=O)[C@@H](F)CC)CC1	ZINC001132561894	1375468571	/nfs/dbraw/zinc/46/85/71/1375468571.db2.gz	BMOISVXBNJNTGU-DLBZAZTESA-N	0	3	348.487	3.313	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1	ZINC001228459831	1375575252	/nfs/dbraw/zinc/57/52/52/1375575252.db2.gz	KIRNGVZMGCPTFV-XRXFAXGQSA-N	0	3	338.495	3.491	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NC1CCN(Cc2ccc(C)cc2)CC1	ZINC001228466824	1375575692	/nfs/dbraw/zinc/57/56/92/1375575692.db2.gz	ONZQQMMNWWVHQZ-OAQYLSRUSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](C)[C@@H](CNCc2cc(C)no2)C1	ZINC001132843243	1375595686	/nfs/dbraw/zinc/59/56/86/1375595686.db2.gz	KDXYCGMVOSLVOZ-YJBOKZPZSA-N	0	3	345.487	3.326	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CCN(Cc2cc(C)ccc2OC)CC1	ZINC001228631039	1375622894	/nfs/dbraw/zinc/62/28/94/1375622894.db2.gz	ASWIFUDNOKBMGJ-UHFFFAOYSA-N	0	3	330.472	3.296	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC1CCN(Cc2ccccc2N(C)C)CC1	ZINC001228786172	1375675316	/nfs/dbraw/zinc/67/53/16/1375675316.db2.gz	DMKOZOXECDQJEV-QGZVFWFLSA-N	0	3	343.515	3.436	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)C(C2CCC2)C2CCC2)ccc1F	ZINC001132966330	1375680232	/nfs/dbraw/zinc/68/02/32/1375680232.db2.gz	MDSPLXBCFNLENL-UHFFFAOYSA-N	0	3	343.446	3.120	20	30		EGEDHN
C=CCCCC(=O)NC1CCN(Cc2cccc(COC)c2)CC1	ZINC001228927601	1375718268	/nfs/dbraw/zinc/71/82/68/1375718268.db2.gz	GMEOXJBDMDSWQO-UHFFFAOYSA-N	0	3	330.472	3.270	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC1CCN(C[C@H](O)c2ccc(F)cc2)CC1	ZINC001229017481	1375740718	/nfs/dbraw/zinc/74/07/18/1375740718.db2.gz	TXKMDEJZSCMFKX-ICSRJNTNSA-N	0	3	348.462	3.042	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](C)[C@@H](CNCc2ncc(C)s2)C1	ZINC001133073383	1375759812	/nfs/dbraw/zinc/75/98/12/1375759812.db2.gz	UHGOQYFKDGPXNS-HOCLYGCPSA-N	0	3	335.517	3.382	20	30		EGEDHN
Cc1nnc(O[C@H]2[C@@H]3CC[C@H]2CN(Cc2ccccc2)C3)c(C#N)c1C	ZINC001229439581	1375835916	/nfs/dbraw/zinc/83/59/16/1375835916.db2.gz	OZMHYWUOORSCSF-RUYXUALKSA-N	0	3	348.450	3.255	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1ccccc1	ZINC001133377681	1375957877	/nfs/dbraw/zinc/95/78/77/1375957877.db2.gz	YKWZJCDMOJMZSP-UHFFFAOYSA-N	0	3	326.827	3.205	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)/C=C(\C)C1CC1	ZINC001133385219	1375966938	/nfs/dbraw/zinc/96/69/38/1375966938.db2.gz	CWOJUKIKOTZENO-NTCAYCPXSA-N	0	3	330.859	3.248	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1cc(F)ccc1C#N)NC(=O)C1CCCC1	ZINC001133464996	1376024094	/nfs/dbraw/zinc/02/40/94/1376024094.db2.gz	HUNANAPNJVWALP-UONOGXRCSA-N	0	3	331.435	3.260	20	30		EGEDHN
C#CCC1(C(=O)NCCCN(CC(=C)C)Cc2cccnc2)CCC1	ZINC001230778274	1376150494	/nfs/dbraw/zinc/15/04/94/1376150494.db2.gz	MMXIAHUWGBNCHJ-UHFFFAOYSA-N	0	3	339.483	3.160	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)C1(CCF)CC1)Cc1cccnc1	ZINC001230808063	1376153726	/nfs/dbraw/zinc/15/37/26/1376153726.db2.gz	NEFFYGSTHLPHPI-UHFFFAOYSA-N	0	3	333.451	3.106	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1ccccc1C#N)NC(=O)c1ccc(Cl)o1	ZINC001133689059	1376156655	/nfs/dbraw/zinc/15/66/55/1376156655.db2.gz	UQIOYUGFBIPPBN-QWHCGFSZSA-N	0	3	345.830	3.491	20	30		EGEDHN
C#CCCN(CCCNC(=O)[C@H]1CCC(C)(C)C1)Cc1cccnc1	ZINC001230840574	1376165031	/nfs/dbraw/zinc/16/50/31/1376165031.db2.gz	ALLAGKDVZIMVCB-IBGZPJMESA-N	0	3	341.499	3.240	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)[C@H]1CC[C@@H](C)C1)Cc1cccnc1	ZINC001230861260	1376169573	/nfs/dbraw/zinc/16/95/73/1376169573.db2.gz	FRYKBSMUIKBDGB-MJGOQNOKSA-N	0	3	329.488	3.402	20	30		EGEDHN
CC(C)SCC(=O)N[C@@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001133726236	1376178727	/nfs/dbraw/zinc/17/87/27/1376178727.db2.gz	FZZZQNUTDGMROI-GJZGRUSLSA-N	0	3	333.501	3.073	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)c1ccc(F)s1)Cc1cccnc1	ZINC001230940041	1376184977	/nfs/dbraw/zinc/18/49/77/1376184977.db2.gz	NBMWINNQEAROAG-UHFFFAOYSA-N	0	3	347.459	3.480	20	30		EGEDHN
C[C@H](C#N)C(=O)N(C)C[C@@H]1CCN1CCCc1cccc2ccccc21	ZINC001231294697	1376223389	/nfs/dbraw/zinc/22/33/89/1376223389.db2.gz	ZWIRYWKZWOATIL-XLIONFOSSA-N	0	3	349.478	3.465	20	30		EGEDHN
C=CCCC(=O)N[C@H](C)C[C@H](C)NCc1ccn(C2CCCC2)n1	ZINC001133888016	1376251753	/nfs/dbraw/zinc/25/17/53/1376251753.db2.gz	FDJIXHHLGVOZNR-JKSUJKDBSA-N	0	3	332.492	3.337	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)CC(C2CCC2)C2CCC2)c1	ZINC001133946999	1376278441	/nfs/dbraw/zinc/27/84/41/1376278441.db2.gz	QWBFYLXWIJOHDK-UHFFFAOYSA-N	0	3	339.483	3.371	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CCN(Cc3ccc(C)nc3C)C2)C1	ZINC001232081784	1376396130	/nfs/dbraw/zinc/39/61/30/1376396130.db2.gz	HDFJSOCVYCUSJD-FQEVSTJZSA-N	0	3	343.471	3.309	20	30		EGEDHN
C#CCCCC(=O)N[C@H](C)C[C@@H](C)NCc1nc2ccc(F)cc2o1	ZINC001134206460	1376418434	/nfs/dbraw/zinc/41/84/34/1376418434.db2.gz	VEMGMUSXXMQIDJ-ZIAGYGMSSA-N	0	3	345.418	3.143	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)c1c(C)coc1C	ZINC001134289221	1376460623	/nfs/dbraw/zinc/46/06/23/1376460623.db2.gz	SGZLEELXSQOAKC-RYUDHWBXSA-N	0	3	343.265	3.292	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)C#CC1CC1)NCc1nc(C(C)(C)C)cs1	ZINC001134321541	1376475566	/nfs/dbraw/zinc/47/55/66/1376475566.db2.gz	ITZZJJURWKJMLG-KGLIPLIRSA-N	0	3	347.528	3.227	20	30		EGEDHN
Cc1nc(CN[C@H](C)C[C@@H](C)NC(=O)C#CC(C)(C)C)c(C)s1	ZINC001134329241	1376479432	/nfs/dbraw/zinc/47/94/32/1376479432.db2.gz	MDFBLIVFXUQWDY-CHWSQXEVSA-N	0	3	335.517	3.182	20	30		EGEDHN
C#CCCCCC(=O)N1CCC[C@@H](CN(C)CCC(F)(F)F)C1	ZINC001752506608	1440189359	/nfs/dbraw/zinc/18/93/59/1440189359.db2.gz	UWYPUAGIEPHGPD-HNNXBMFYSA-N	0	3	332.410	3.303	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@H](C)C[C@@H](C)NCc1nccn1CC	ZINC001134456800	1376547825	/nfs/dbraw/zinc/54/78/25/1376547825.db2.gz	DOBDUFYQSCYOAS-CHWSQXEVSA-N	0	3	340.899	3.055	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2ccn(C(C)C)n2)CCC1	ZINC001134566980	1376599507	/nfs/dbraw/zinc/59/95/07/1376599507.db2.gz	ITHZETQLCJTVSA-IAGOWNOFSA-N	0	3	344.503	3.031	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2ccn(C(C)C)n2)CCC1	ZINC001134566984	1376599545	/nfs/dbraw/zinc/59/95/45/1376599545.db2.gz	ITHZETQLCJTVSA-SJORKVTESA-N	0	3	344.503	3.031	20	30		EGEDHN
C[C@H](CCC(=O)NCCNCc1ccc(C#N)cc1)c1ccccc1	ZINC001134806616	1376735350	/nfs/dbraw/zinc/73/53/50/1376735350.db2.gz	MAQYOEBGMSRQEK-QGZVFWFLSA-N	0	3	335.451	3.348	20	30		EGEDHN
CC(C)C#CC(=O)N(C)C[C@H]1CCN1CC[C@@H]1CCc2ccccc21	ZINC001234159995	1376780110	/nfs/dbraw/zinc/78/01/10/1376780110.db2.gz	FIYLJPUCFCGKCO-VQTJNVASSA-N	0	3	338.495	3.299	20	30		EGEDHN
C=CCCCCCN1CC[C@H]1CN(C)C(=O)c1cnc2cc[nH]c2c1	ZINC001235667597	1376883187	/nfs/dbraw/zinc/88/31/87/1376883187.db2.gz	XIUTUKAIAAVHMT-KRWDZBQOSA-N	0	3	340.471	3.456	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)C1CC2(CCC2)C1	ZINC001135225203	1376986704	/nfs/dbraw/zinc/98/67/04/1376986704.db2.gz	OHHBEZRPSXUQMB-STQMWFEESA-N	0	3	343.309	3.348	20	30		EGEDHN
CC#CCCCC(=O)N[C@H](C)C[C@H](C)NCc1nc2ccccc2o1	ZINC001135236061	1376992887	/nfs/dbraw/zinc/99/28/87/1376992887.db2.gz	PRMSYQQIZYCRMW-JKSUJKDBSA-N	0	3	341.455	3.394	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3ccc(C#N)cc3Cl)C2)C1=O	ZINC001238081630	1376993293	/nfs/dbraw/zinc/99/32/93/1376993293.db2.gz	CJBWFOLLVQENFS-LJQANCHMSA-N	0	3	343.858	3.212	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)CCCC1CC1	ZINC001135246420	1376999725	/nfs/dbraw/zinc/99/97/25/1376999725.db2.gz	HMHRQDHUDGFBON-STQMWFEESA-N	0	3	331.298	3.348	20	30		EGEDHN
Cc1cccc(CC(=O)N[C@@H](C)C[C@@H](C)NCc2ccccc2C#N)c1	ZINC001135350323	1377048548	/nfs/dbraw/zinc/04/85/48/1377048548.db2.gz	SLRMBLOWACFHLD-MSOLQXFVSA-N	0	3	349.478	3.482	20	30		EGEDHN
CCc1ccoc1C(=O)N[C@@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001135387271	1377067259	/nfs/dbraw/zinc/06/72/59/1377067259.db2.gz	MRBFYKXBDSMHON-CABCVRRESA-N	0	3	339.439	3.400	20	30		EGEDHN
CCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2cc(F)ccc2C#N)CC1	ZINC001135391073	1377069856	/nfs/dbraw/zinc/06/98/56/1377069856.db2.gz	QKJFDOQVYKKVHM-KGLIPLIRSA-N	0	3	331.435	3.260	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2conc2CC)CCC1	ZINC001135393915	1377071351	/nfs/dbraw/zinc/07/13/51/1377071351.db2.gz	ABCWGFZPGUFDBE-HUUCEWRRSA-N	0	3	333.476	3.356	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)C1(CCC)CC1	ZINC001135401828	1377075335	/nfs/dbraw/zinc/07/53/35/1377075335.db2.gz	JVKGOWBIGWQETF-OLZOCXBDSA-N	0	3	331.298	3.348	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H](C)C[C@@H](C)NCc2ccncc2Cl)C1	ZINC001135417980	1377084359	/nfs/dbraw/zinc/08/43/59/1377084359.db2.gz	ASWKYBYBAGMFOM-ZIAGYGMSSA-N	0	3	335.879	3.464	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H](C)C[C@H](C)NCc2nc(C)c(C)s2)C1	ZINC001135418503	1377084872	/nfs/dbraw/zinc/08/48/72/1377084872.db2.gz	FQVVCQYQEMBFFA-QWHCGFSZSA-N	0	3	335.517	3.489	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H](C)C[C@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001135418950	1377084924	/nfs/dbraw/zinc/08/49/24/1377084924.db2.gz	ISVDNVKDJTZAMF-GJZGRUSLSA-N	0	3	343.446	3.427	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)C1(CF)CCC1)NCc1cc(F)ccc1C#N	ZINC001135501465	1377120857	/nfs/dbraw/zinc/12/08/57/1377120857.db2.gz	POWCGEDIIFWKRT-KGLIPLIRSA-N	0	3	349.425	3.210	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)Cc2ccc(Cl)cc2)C1	ZINC001264438363	1377143276	/nfs/dbraw/zinc/14/32/76/1377143276.db2.gz	VVHPVWLGKKZIHZ-CTYIDZIISA-N	0	3	327.255	3.119	20	30		EGEDHN
CC1(C)C[C@]1(C(=O)NCCNCc1ccc(C#N)cc1)c1ccccc1	ZINC001135649982	1377175445	/nfs/dbraw/zinc/17/54/45/1377175445.db2.gz	ALWBIJPGBFGEDR-JOCHJYFZSA-N	0	3	347.462	3.132	20	30		EGEDHN
CC(C)[C@H]1CC[C@H](C(=O)NCCNCc2cccc(C#N)c2)CC1	ZINC001135734284	1377196706	/nfs/dbraw/zinc/19/67/06/1377196706.db2.gz	QQJWYERZRJGLCA-WGSAOQKQSA-N	0	3	327.472	3.226	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1cnc2c(F)cccc2c1	ZINC001266161479	1377212297	/nfs/dbraw/zinc/21/22/97/1377212297.db2.gz	XAEWPYSCBWAQON-GFCCVEGCSA-N	0	3	335.810	3.224	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3c[nH]c4cccc(F)c34)C2)C1=O	ZINC001136981530	1377449090	/nfs/dbraw/zinc/44/90/90/1377449090.db2.gz	RYUIBCOVXYEPEM-FQEVSTJZSA-N	0	3	341.430	3.308	20	30		EGEDHN
C=CCOC(=O)N[C@H]1CCCN(Cc2ccc(O)c3ccccc23)C1	ZINC001138064140	1377673139	/nfs/dbraw/zinc/67/31/39/1377673139.db2.gz	WPOXGIMEPINROT-INIZCTEOSA-N	0	3	340.423	3.422	20	30		EGEDHN
N#Cc1ccc(OC2CC[NH+](Cc3ncccc3[O-])CC2)cc1Cl	ZINC001138394359	1377715771	/nfs/dbraw/zinc/71/57/71/1377715771.db2.gz	QOWFDRIVIIUJCA-UHFFFAOYSA-N	0	3	343.814	3.356	20	30		EGEDHN
C#CCOc1ccc(CN2CCC[C@@]3(C[C@H](OCC=C)CO3)C2)cc1	ZINC001138558755	1377742144	/nfs/dbraw/zinc/74/21/44/1377742144.db2.gz	IFVPYGRESKQFSR-LEWJYISDSA-N	0	3	341.451	3.025	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@H]3[C@@H]2CCC(=O)N3CC2CC2)c1[O-]	ZINC001138626179	1377755916	/nfs/dbraw/zinc/75/59/16/1377755916.db2.gz	DCPUJXZXPSYUSU-OALUTQOASA-N	0	3	340.467	3.096	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@H]3[C@@H]2CCC(=O)N3CC2CC2)c1[O-]	ZINC001138626179	1377755922	/nfs/dbraw/zinc/75/59/22/1377755922.db2.gz	DCPUJXZXPSYUSU-OALUTQOASA-N	0	3	340.467	3.096	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@]3(CCCN3C(=O)C(C)C)C2)c1[O-]	ZINC001138628976	1377756695	/nfs/dbraw/zinc/75/66/95/1377756695.db2.gz	JTSBYVWGQIDNRN-OAQYLSRUSA-N	0	3	342.483	3.344	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@]3(CCCN3C(=O)C(C)C)C2)c1[O-]	ZINC001138628976	1377756697	/nfs/dbraw/zinc/75/66/97/1377756697.db2.gz	JTSBYVWGQIDNRN-OAQYLSRUSA-N	0	3	342.483	3.344	20	30		EGEDHN
C=C(C)COc1ccccc1CN1CCC(c2nncn2C)CC1	ZINC001138665072	1377765268	/nfs/dbraw/zinc/76/52/68/1377765268.db2.gz	FSIYIOKXDNOXSQ-UHFFFAOYSA-N	0	3	326.444	3.150	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3cc(F)ccc3Cl)C2)C1=O	ZINC001138673758	1377765397	/nfs/dbraw/zinc/76/53/97/1377765397.db2.gz	SCEBEINTVSCGED-SFHVURJKSA-N	0	3	336.838	3.480	20	30		EGEDHN
C=CCOc1ccccc1CN1CCC[C@@]2(CCN(CC=C)C2=O)C1	ZINC001139027912	1377819025	/nfs/dbraw/zinc/81/90/25/1377819025.db2.gz	FSACVRIQLROMTB-OAQYLSRUSA-N	0	3	340.467	3.252	20	30		EGEDHN
C=CCOc1ccccc1CN1CC[C@]2(CCCN2C(=O)C(C)C)C1	ZINC001139032594	1377820292	/nfs/dbraw/zinc/82/02/92/1377820292.db2.gz	QDQTXRZEGBFEDK-OAQYLSRUSA-N	0	3	342.483	3.474	20	30		EGEDHN
COC(=O)N1CCC2(CCN(Cc3ccc(C#N)c(F)c3)CC2)CC1	ZINC001139525971	1377897381	/nfs/dbraw/zinc/89/73/81/1377897381.db2.gz	QKYDLZFMENSHGJ-UHFFFAOYSA-N	0	3	345.418	3.142	20	30		EGEDHN
N#Cc1cccc2c(CN3CCCN(c4ccc(F)cn4)CC3)c[nH]c21	ZINC001139701741	1377937777	/nfs/dbraw/zinc/93/77/77/1377937777.db2.gz	OYDFCFZMAZZDCO-UHFFFAOYSA-N	0	3	349.413	3.286	20	30		EGEDHN
COc1ccc(O[C@@H]2CCN(Cc3c[nH]c4c3cccc4C#N)C2)nc1	ZINC001139707501	1377938125	/nfs/dbraw/zinc/93/81/25/1377938125.db2.gz	HYHWHGMRYQZALF-QGZVFWFLSA-N	0	3	348.406	3.096	20	30		EGEDHN
COCC[C@@H]1CO[C@@]2(C1)CCCN(Cc1ccc(C)c(C#N)c1)C2	ZINC001139725365	1377941975	/nfs/dbraw/zinc/94/19/75/1377941975.db2.gz	MNNGMNFYQSODQX-AZUAARDMSA-N	0	3	328.456	3.274	20	30		EGEDHN
Cc1ccc(CN2CCC[C@@H](Oc3ccc(C(N)=O)cc3)C2)cc1C#N	ZINC001139727272	1377942707	/nfs/dbraw/zinc/94/27/07/1377942707.db2.gz	LLVWTUVBYYOPJD-HXUWFJFHSA-N	0	3	349.434	3.009	20	30		EGEDHN
Cn1ncc2cc(CN3CCC[C@H](Oc4cccc(C#N)c4)C3)ccc21	ZINC001139951977	1377981670	/nfs/dbraw/zinc/98/16/70/1377981670.db2.gz	DURMSBUFVRIHPD-FQEVSTJZSA-N	0	3	346.434	3.488	20	30		EGEDHN
N#CCCCN1CCC2(CCN(Cc3cc(F)cc(F)c3)CC2)C1=O	ZINC001272978597	1378084080	/nfs/dbraw/zinc/08/40/80/1378084080.db2.gz	QWFIZUBMYQTBOA-UHFFFAOYSA-N	0	3	347.409	3.083	20	30		EGEDHN
N#CCCCN1C[C@]2(CC1=O)CCCCN2CCc1cccc(F)c1	ZINC001273134296	1378088852	/nfs/dbraw/zinc/08/88/52/1378088852.db2.gz	IZYAJIOPCAQNCO-HXUWFJFHSA-N	0	3	343.446	3.129	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3nc(C)c(C)s3)CC2)C1=O	ZINC001273657312	1378109726	/nfs/dbraw/zinc/10/97/26/1378109726.db2.gz	NMBZKGPGWSLTMN-GOSISDBHSA-N	0	3	333.501	3.151	20	30		EGEDHN
C=C(C)CN1CCC2(CCN(Cc3cnc(C)c(C)c3)CC2)C1=O	ZINC001274085796	1378115652	/nfs/dbraw/zinc/11/56/52/1378115652.db2.gz	HAXJZEVDMPYXLL-UHFFFAOYSA-N	0	3	327.472	3.089	20	30		EGEDHN
O=C1C=C2CN(Cc3ccc(OC(F)(F)F)c(F)c3)CCC2S1	ZINC001140886440	1378169896	/nfs/dbraw/zinc/16/98/96/1378169896.db2.gz	YSZVLCWAAMMOFZ-CYBMUJFWSA-N	0	3	347.333	3.498	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CC3(C[C@H]3C(=O)N(CC)C(C)C)C2)c1[O-]	ZINC001277463382	1378224286	/nfs/dbraw/zinc/22/42/86/1378224286.db2.gz	KGOULQZGXADQNJ-SFHVURJKSA-N	0	3	342.483	3.200	20	30		EGEDHN
C=CCc1cccc(CN2CC3(C[C@H]3C(=O)N(CC)C(C)C)C2)c1O	ZINC001277463382	1378224289	/nfs/dbraw/zinc/22/42/89/1378224289.db2.gz	KGOULQZGXADQNJ-SFHVURJKSA-N	0	3	342.483	3.200	20	30		EGEDHN
N#Cc1c(N)sc(CN2CCC[C@@H]2Cc2ccccn2)c1Cl	ZINC001141112012	1378242814	/nfs/dbraw/zinc/24/28/14/1378242814.db2.gz	MBEDLMKGLBQUEG-GFCCVEGCSA-N	0	3	332.860	3.457	20	30		EGEDHN
C=CCN1C(=O)CC[C@@]12CCCN(Cc1cccc(F)c1OC)CC2	ZINC001143528886	1378609182	/nfs/dbraw/zinc/60/91/82/1378609182.db2.gz	KSXXDEFPGGNURE-HXUWFJFHSA-N	0	3	346.446	3.367	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CN(Cc3cccc(CC)c3)C2)CC1	ZINC001144318975	1378716058	/nfs/dbraw/zinc/71/60/58/1378716058.db2.gz	RCZTXAHZZNQKCY-UHFFFAOYSA-N	0	3	328.456	3.469	20	30		EGEDHN
C#Cc1ccc(CN2CCC[C@@]3(C[C@H](Oc4cccnc4)CO3)C2)cc1	ZINC001144572127	1378746595	/nfs/dbraw/zinc/74/65/95/1378746595.db2.gz	QRYNRMCYAULKHL-FCHUYYIVSA-N	0	3	348.446	3.265	20	30		EGEDHN
Cc1c[nH]cc1C(=O)N[C@H](C)C[C@H](C)NCc1cc(F)ccc1C#N	ZINC001146374869	1378830058	/nfs/dbraw/zinc/83/00/58/1378830058.db2.gz	RTHFFTLRZLPOJH-UONOGXRCSA-N	0	3	342.418	3.021	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C[C@H](C)NCc2nccn2C)CCCCC1	ZINC001146506254	1378855800	/nfs/dbraw/zinc/85/58/00/1378855800.db2.gz	YZDSIDIFMTYUPT-DLBZAZTESA-N	0	3	346.519	3.320	20	30		EGEDHN
CC[C@@H](CC(=O)NCCNCc1ccc(C#N)c(F)c1)C(C)(C)C	ZINC001147466362	1379026146	/nfs/dbraw/zinc/02/61/46/1379026146.db2.gz	JWJNDDUXJJRZJY-INIZCTEOSA-N	0	3	333.451	3.366	20	30		EGEDHN
CCCC[C@@H](C)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001147467015	1379027296	/nfs/dbraw/zinc/02/72/96/1379027296.db2.gz	BJUVSMWRBXCEHU-QGZVFWFLSA-N	0	3	339.483	3.419	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)CCCc3ccc(Cl)cc3)C2)C1	ZINC001147841052	1379089430	/nfs/dbraw/zinc/08/94/30/1379089430.db2.gz	JBPVKAADLPVNKJ-UHFFFAOYSA-N	0	3	344.886	3.220	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001148137877	1379123559	/nfs/dbraw/zinc/12/35/59/1379123559.db2.gz	HEUGUIWAOBWZCI-DLBZAZTESA-N	0	3	337.467	3.051	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)c2ccc3ccccc3c2)ccc1F	ZINC001148870727	1379287567	/nfs/dbraw/zinc/28/75/67/1379287567.db2.gz	OLCRVNMBFJUAOU-UHFFFAOYSA-N	0	3	347.393	3.370	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N1CC2(C1)CCN([C@@H](C)c1cccc(F)c1)C2	ZINC001148899934	1379293932	/nfs/dbraw/zinc/29/39/32/1379293932.db2.gz	LRBOEYOOIKVTHU-HOTGVXAUSA-N	0	3	346.446	3.012	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@@H]1CN(Cc2cccc(C)c2)CCCO1	ZINC001150140763	1379501338	/nfs/dbraw/zinc/50/13/38/1379501338.db2.gz	VNANIKSAMGIKFW-UYAOXDASSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H]1CN(Cc2cc(C)ccc2C)CCCO1	ZINC001150211822	1379515800	/nfs/dbraw/zinc/51/58/00/1379515800.db2.gz	LKMFQYGGAQFMGR-HXUWFJFHSA-N	0	3	344.499	3.367	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)[C@@H](F)CC2CCCCC2)C1	ZINC001150595851	1379576505	/nfs/dbraw/zinc/57/65/05/1379576505.db2.gz	DUUDXFLBQRXTFW-MSOLQXFVSA-N	0	3	340.483	3.078	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@H]2CCCC[C@@H]2C)CC1	ZINC001151281338	1379691751	/nfs/dbraw/zinc/69/17/51/1379691751.db2.gz	JGRLDTMDCBITFD-ROUUACIJSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)CCc2ccccc2C)CC1	ZINC001151339485	1379701321	/nfs/dbraw/zinc/70/13/21/1379701321.db2.gz	CCLPOBVCIOICFK-UHFFFAOYSA-N	0	3	344.499	3.101	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)C[C@H]1C=CCC1	ZINC001151801599	1379785056	/nfs/dbraw/zinc/78/50/56/1379785056.db2.gz	WRGDUJZNDRIAHP-SJORKVTESA-N	0	3	325.456	3.241	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)c2ccc(C3CC3)cc2)ccc1F	ZINC001151899256	1379813038	/nfs/dbraw/zinc/81/30/38/1379813038.db2.gz	JSZPOPGHPJKDJX-UHFFFAOYSA-N	0	3	337.398	3.094	20	30		EGEDHN
C=C[C@@H](CC(=O)NCCNCc1cccc(F)c1)c1ccccc1	ZINC001151943121	1379821547	/nfs/dbraw/zinc/82/15/47/1379821547.db2.gz	RASOCGWNNWYHMK-KRWDZBQOSA-N	0	3	326.415	3.391	20	30		EGEDHN
C=C[C@H](C(=O)NCCNCc1cc(F)ccc1C)c1ccccc1	ZINC001151989952	1379832401	/nfs/dbraw/zinc/83/24/01/1379832401.db2.gz	BXQMRGJHAAKYSG-IBGZPJMESA-N	0	3	326.415	3.310	20	30		EGEDHN
C=CCOCC(=O)NC[C@@H](C)N(CC)Cc1cccc(OCCC)c1	ZINC001152370960	1379922282	/nfs/dbraw/zinc/92/22/82/1379922282.db2.gz	VTRKGVNDTGYSGN-QGZVFWFLSA-N	0	3	348.487	3.005	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)CCC1CC1	ZINC001152489149	1379942153	/nfs/dbraw/zinc/94/21/53/1379942153.db2.gz	VCRYBTCVYGQUMP-CQSZACIVSA-N	0	3	331.435	3.214	20	30		EGEDHN
CCN(Cc1ccc(Cl)cc1)[C@H](C)CNC(=O)c1ccc(C#N)[nH]1	ZINC001152789728	1379981186	/nfs/dbraw/zinc/98/11/86/1379981186.db2.gz	MCNIBFADSWSSHB-CYBMUJFWSA-N	0	3	344.846	3.180	20	30		EGEDHN
CC[C@@H](SC)C(=O)NC[C@@H](C)N(CC)Cc1cccc(C#N)c1	ZINC001152842509	1379986144	/nfs/dbraw/zinc/98/61/44/1379986144.db2.gz	ZVKVQIMJBZZUKL-RHSMWYFYSA-N	0	3	333.501	3.026	20	30		EGEDHN
C#CC[C@H](CC(=O)NCCNCc1cccc(F)c1)c1ccccc1	ZINC001153713901	1380117257	/nfs/dbraw/zinc/11/72/57/1380117257.db2.gz	BJAXLSBNFLRXKT-LJQANCHMSA-N	0	3	338.426	3.229	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)c1[nH]c(C)cc1C	ZINC001154038947	1380188997	/nfs/dbraw/zinc/18/89/97/1380188997.db2.gz	QLHMLPDEIZGLIL-MRXNPFEDSA-N	0	3	338.455	3.144	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1[nH]c2ccccc2c1Cl	ZINC001154167689	1380219996	/nfs/dbraw/zinc/21/99/96/1380219996.db2.gz	PXQAYWULSWWJIQ-CYBMUJFWSA-N	0	3	331.847	3.285	20	30		EGEDHN
CCN(Cc1ccc(OC)c(C#N)c1)[C@H](C)CNC(=O)C1(C)CCC1	ZINC001154631412	1380321085	/nfs/dbraw/zinc/32/10/85/1380321085.db2.gz	MWSBWBKUDDEKIK-OAHLLOKOSA-N	0	3	343.471	3.084	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)C1(CC)CCC1	ZINC001154711651	1380337075	/nfs/dbraw/zinc/33/70/75/1380337075.db2.gz	GEXOZEVMZQSUKL-MRXNPFEDSA-N	0	3	327.472	3.465	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)C1(CC)CC1	ZINC001155056148	1380400148	/nfs/dbraw/zinc/40/01/48/1380400148.db2.gz	LASCIZPEOYRBFQ-CQSZACIVSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NCCCN[C@H](C)c1c(F)cccc1F	ZINC001155440527	1380454126	/nfs/dbraw/zinc/45/41/26/1380454126.db2.gz	TUFQOCZUDYOULR-ZIAGYGMSSA-N	0	3	340.414	3.103	20	30		EGEDHN
C[Si](C)(C)C#Cc1cccnc1N[C@H]1CCCC[C@@]12CNCCO2	ZINC001155826986	1380496280	/nfs/dbraw/zinc/49/62/80/1380496280.db2.gz	YABJYKCYODPEHM-PKOBYXMFSA-N	0	3	343.547	3.024	20	30		EGEDHN
C#CCCCCC(=O)NCCCNCc1nsc2ccccc21	ZINC001156827831	1380656200	/nfs/dbraw/zinc/65/62/00/1380656200.db2.gz	JOFMYNJMJBHCRQ-UHFFFAOYSA-N	0	3	329.469	3.086	20	30		EGEDHN
C#CCCCCC(=O)NCCCNCc1cc(-c2ccccc2)no1	ZINC001156827570	1380660818	/nfs/dbraw/zinc/66/08/18/1380660818.db2.gz	CSNLCKSXLYAIRU-UHFFFAOYSA-N	0	3	339.439	3.131	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)C[C@@H](C)C1CC1	ZINC001157146294	1380786105	/nfs/dbraw/zinc/78/61/05/1380786105.db2.gz	VZCGVBZVPLRWDI-HUUCEWRRSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@@H](C)CCCc1ccccc1	ZINC001157178227	1380797381	/nfs/dbraw/zinc/79/73/81/1380797381.db2.gz	YIFPGWNJETXWMZ-RBUKOAKNSA-N	0	3	328.500	3.495	20	30		EGEDHN
C=CCCOCC(=O)NC[C@@H](C)N(CC)Cc1cc(C)sc1C	ZINC001157213397	1380812009	/nfs/dbraw/zinc/81/20/09/1380812009.db2.gz	JOQCOMUKWPOVSO-CQSZACIVSA-N	0	3	338.517	3.284	20	30		EGEDHN
Cc1c(Cl)c(Cl)nc(N2C[C@H]3[C@H](C2)CCCN3C)c1C#N	ZINC001157259097	1380826496	/nfs/dbraw/zinc/82/64/96/1380826496.db2.gz	CQFMOOPPZNKLPV-JQWIXIFHSA-N	0	3	325.243	3.099	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)N1CCN(c2cc(C)ccc2C)CC1	ZINC001157464321	1380915277	/nfs/dbraw/zinc/91/52/77/1380915277.db2.gz	CJROXGLZONOXMX-IBGZPJMESA-N	0	3	343.515	3.416	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)N1CC[C@H](OC(=O)OC(C)(C)C)C1	ZINC001157592880	1380975532	/nfs/dbraw/zinc/97/55/32/1380975532.db2.gz	RFLUQIVYKNRKPN-GJZGRUSLSA-N	0	3	340.464	3.003	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCCC[C@@H]1CN(C)C/C=C\c1ccccc1	ZINC001157695486	1381005608	/nfs/dbraw/zinc/00/56/08/1381005608.db2.gz	BELWGRCDRPEGSW-PVDJYUQQSA-N	0	3	325.456	3.172	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)C(F)=C1CCCC1	ZINC001157802365	1381036899	/nfs/dbraw/zinc/03/68/99/1381036899.db2.gz	BANHQZGFYQNUNU-QGZVFWFLSA-N	0	3	338.467	3.300	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1ccc([C@H]2C[C@@H]2C)o1	ZINC001157912795	1381068214	/nfs/dbraw/zinc/06/82/14/1381068214.db2.gz	YLGSJNRNWQLFPK-JQWIXIFHSA-N	0	3	341.249	3.021	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccnn1C1CCCC1	ZINC001158018725	1381103847	/nfs/dbraw/zinc/10/38/47/1381103847.db2.gz	HZLQNNKDXGMEOX-QGZVFWFLSA-N	0	3	330.476	3.111	20	30		EGEDHN
C=C(Cl)Cn1c(N2CCN(CC(C)C)CC2)nnc1C(C)(C)C	ZINC001286635220	1381123845	/nfs/dbraw/zinc/12/38/45/1381123845.db2.gz	MROJUFCMWSWBLN-UHFFFAOYSA-N	0	3	339.915	3.106	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc2oc(C)nc2c1	ZINC001158118015	1381133602	/nfs/dbraw/zinc/13/36/02/1381133602.db2.gz	OKWXIKLWEKGBFQ-MRXNPFEDSA-N	0	3	327.428	3.249	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1CCc2ccc(F)cc2O1	ZINC001158220754	1381163333	/nfs/dbraw/zinc/16/33/33/1381163333.db2.gz	DXFHQTRAMPHPQO-MSOLQXFVSA-N	0	3	346.446	3.018	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H](C)OCc1ccc(C)cc1	ZINC001158283266	1381183726	/nfs/dbraw/zinc/18/37/26/1381183726.db2.gz	IHTYUCVMLSUJSB-AZUAARDMSA-N	0	3	344.499	3.399	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)Cc1cc2ccccc2o1	ZINC001158296276	1381189209	/nfs/dbraw/zinc/18/92/09/1381189209.db2.gz	ISUIAJCUMNGJSB-QGZVFWFLSA-N	0	3	326.440	3.474	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)C[C@@H]1CCOc2ccccc21	ZINC001158310720	1381194736	/nfs/dbraw/zinc/19/47/36/1381194736.db2.gz	IMNKDHOIWJYDJF-ZWKOTPCHSA-N	0	3	342.483	3.442	20	30		EGEDHN
C=CCCCC(=O)N1CCCC[C@@H]1CN(C)CCO[C@H]1CC1(F)F	ZINC001158418968	1381239902	/nfs/dbraw/zinc/23/99/02/1381239902.db2.gz	DXJGSRFVFDEIEQ-CVEARBPZSA-N	0	3	344.446	3.080	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)[C@H](F)c1ccccc1	ZINC001158529895	1381283601	/nfs/dbraw/zinc/28/36/01/1381283601.db2.gz	RQDQSJSWENJXLH-RTBURBONSA-N	0	3	348.462	3.213	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cnc(C(C)C)nc1C	ZINC001158560259	1381299264	/nfs/dbraw/zinc/29/92/64/1381299264.db2.gz	QTZMVTWFOWHLAD-MRXNPFEDSA-N	0	3	330.476	3.021	20	30		EGEDHN
CCN1CCN(c2c(C#N)cnc3cnc(Cl)cc32)C(C)(C)C1	ZINC001158563143	1381300910	/nfs/dbraw/zinc/30/09/10/1381300910.db2.gz	ZHOMJGVLWAXXDH-UHFFFAOYSA-N	0	3	329.835	3.075	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1ccc2occc2c1	ZINC001158578450	1381308198	/nfs/dbraw/zinc/30/81/98/1381308198.db2.gz	LGCXNMKRFILYQN-UHFFFAOYSA-N	0	3	333.391	3.214	20	30		EGEDHN
CC1=C(C)C[C@H](C(=O)NCCCNCc2cc(C#N)ccc2F)CC1	ZINC001158720912	1381366152	/nfs/dbraw/zinc/36/61/52/1381366152.db2.gz	NJDHHTYTXOCTBE-QGZVFWFLSA-N	0	3	343.446	3.430	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)C[C@@H]1CCC2(CCC2)CO1	ZINC001158773342	1381393965	/nfs/dbraw/zinc/39/39/65/1381393965.db2.gz	GIAKTPWYZRDFIE-MSOLQXFVSA-N	0	3	334.504	3.225	20	30		EGEDHN
Cc1ccsc1C(=O)NCC[C@H](C)NCc1ccccc1C#N	ZINC001328293849	1388717877	/nfs/dbraw/zinc/71/78/77/1388717877.db2.gz	GHFQDPGNXKMFLJ-AWEZNQCLSA-N	0	3	327.453	3.226	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H](C)Oc1ccc(F)cc1	ZINC001158836778	1381423912	/nfs/dbraw/zinc/42/39/12/1381423912.db2.gz	CJSUMNKSWFKZCX-NVXWUHKLSA-N	0	3	334.435	3.092	20	30		EGEDHN
C=CCCOCC(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(F)cc1	ZINC001158936096	1381473729	/nfs/dbraw/zinc/47/37/29/1381473729.db2.gz	UJWVNQKRBVBYAC-LJQANCHMSA-N	0	3	348.462	3.231	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)Cc1c[nH]c2cc(C)ccc12	ZINC001328427370	1388743274	/nfs/dbraw/zinc/74/32/74/1388743274.db2.gz	MCTBNLFRUZMBNY-AWEZNQCLSA-N	0	3	333.863	3.256	20	30		EGEDHN
N#Cc1cc(Nc2c([O-])cccc2Cl)ccc1N1CC[NH2+]CC1	ZINC001159748971	1381888380	/nfs/dbraw/zinc/88/83/80/1381888380.db2.gz	SIXICGWVLIMHJW-UHFFFAOYSA-N	0	3	328.803	3.070	20	30		EGEDHN
Cc1cc[nH]c1C(=O)NCCC1=CCN(Cc2ccc(C#N)cc2)CC1	ZINC001159990188	1381961794	/nfs/dbraw/zinc/96/17/94/1381961794.db2.gz	CRDQUIJRVAQLDB-UHFFFAOYSA-N	0	3	348.450	3.147	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C2(C)CCC(F)(F)CC2)CC1	ZINC001160546824	1382138517	/nfs/dbraw/zinc/13/85/17/1382138517.db2.gz	ZFOURDOECHQQEK-UHFFFAOYSA-N	0	3	338.442	3.364	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CCc2ccc3[nH]ccc3c2)CC1	ZINC001160676649	1382168347	/nfs/dbraw/zinc/16/83/47/1382168347.db2.gz	DIMBBYHNJKOXQQ-UHFFFAOYSA-N	0	3	337.467	3.425	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)C[C@H]2C=CCCC2)c1	ZINC001160803075	1382201358	/nfs/dbraw/zinc/20/13/58/1382201358.db2.gz	HFTSPNOKTNMGGQ-HNNXBMFYSA-N	0	3	329.419	3.040	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCC1=CCN(CCc2ccns2)CC1	ZINC001160940871	1382243174	/nfs/dbraw/zinc/24/31/74/1382243174.db2.gz	HFGXRTUVNIGGEJ-CVEARBPZSA-N	0	3	347.528	3.282	20	30		EGEDHN
C=CCN1CCC[C@H]1CNc1nnc(Cl)cc1-c1ccncc1	ZINC001160953071	1382250522	/nfs/dbraw/zinc/25/05/22/1382250522.db2.gz	PJKCBUFNGGUMKE-AWEZNQCLSA-N	0	3	329.835	3.254	20	30		EGEDHN
C=CCN1CCC[C@H]1CNc1nccc(Oc2ccc(F)cc2)n1	ZINC001160958047	1382250927	/nfs/dbraw/zinc/25/09/27/1382250927.db2.gz	ZBIFBTFYPDZJDN-HNNXBMFYSA-N	0	3	328.391	3.470	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCCC1=CCN(CCc2ccns2)CC1	ZINC001160990565	1382263258	/nfs/dbraw/zinc/26/32/58/1382263258.db2.gz	CGASXCDGGVVDJR-MRXNPFEDSA-N	0	3	347.528	3.426	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc3c(c2)[C@H](C)CO3)CC1	ZINC001161008176	1382270276	/nfs/dbraw/zinc/27/02/76/1382270276.db2.gz	JAMSXRMEEKJRCI-OAHLLOKOSA-N	0	3	326.440	3.121	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H](CCC)c2ccccn2)CC1	ZINC001161013644	1382272074	/nfs/dbraw/zinc/27/20/74/1382272074.db2.gz	HEZLCRFUMLNUDL-GOSISDBHSA-N	0	3	327.472	3.290	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCC1=CCN(CCc2ccns2)CC1	ZINC001161121222	1382307970	/nfs/dbraw/zinc/30/79/70/1382307970.db2.gz	CVVUVNRMGBJJLS-IBGZPJMESA-N	0	3	347.528	3.426	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C[C@H](C)c2cccc(F)c2)CC1	ZINC001161180667	1382328729	/nfs/dbraw/zinc/32/87/29/1382328729.db2.gz	CTCQTVUPWNMUDR-KRWDZBQOSA-N	0	3	342.458	3.481	20	30		EGEDHN
CCCC[C@](C)(F)C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001161287816	1382360553	/nfs/dbraw/zinc/36/05/53/1382360553.db2.gz	ALFGMVGWZCLIKL-SFHVURJKSA-N	0	3	337.414	3.212	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc(C(F)(F)F)ccn2)CC1	ZINC001161631538	1382465166	/nfs/dbraw/zinc/46/51/66/1382465166.db2.gz	BBHBEXYWIZFASH-UHFFFAOYSA-N	0	3	339.361	3.038	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc3sccc3[nH]2)CC1	ZINC001161631784	1382465452	/nfs/dbraw/zinc/46/54/52/1382465452.db2.gz	JJOPKEGFPGLIKW-UHFFFAOYSA-N	0	3	327.453	3.005	20	30		EGEDHN
COc1cc(C#N)ccc1C(=O)Nc1ccc(CN(C)C)cc1F	ZINC001161699858	1382484449	/nfs/dbraw/zinc/48/44/49/1382484449.db2.gz	HNWDGWVMJQFJHW-UHFFFAOYSA-N	0	3	327.359	3.020	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H](CC)CC(F)(F)F)CC1	ZINC001161709219	1382487110	/nfs/dbraw/zinc/48/71/10/1382487110.db2.gz	VKWLXLDAOFITGH-HNNXBMFYSA-N	0	3	330.394	3.127	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc(C)c(CC)s2)CC1	ZINC001161834908	1382524845	/nfs/dbraw/zinc/52/48/45/1382524845.db2.gz	XUKPGBLWOGOPRY-UHFFFAOYSA-N	0	3	330.497	3.394	20	30		EGEDHN
N#Cc1ncc(Cl)nc1NC[C@@H]1CCCN1Cc1ccccc1	ZINC001161885452	1382540512	/nfs/dbraw/zinc/54/05/12/1382540512.db2.gz	PYYKTCKUNFVJGH-AWEZNQCLSA-N	0	3	327.819	3.078	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc(F)c3occc32)CC1	ZINC001161907976	1382547996	/nfs/dbraw/zinc/54/79/96/1382547996.db2.gz	HBSZERWSFPQATL-UHFFFAOYSA-N	0	3	340.398	3.347	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cccc3oc(C)nc32)CC1	ZINC001161968248	1382575575	/nfs/dbraw/zinc/57/55/75/1382575575.db2.gz	MDPZNCPVKSKBEY-UHFFFAOYSA-N	0	3	325.412	3.074	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H](OCC)c2ccccc2)CC1	ZINC001161986940	1382589047	/nfs/dbraw/zinc/58/90/47/1382589047.db2.gz	OMHRSIBTSHEVOC-IBGZPJMESA-N	0	3	328.456	3.089	20	30		EGEDHN
Cc1oc(C)c(C(=O)NCCCNCc2cc(C#N)ccc2F)c1C	ZINC001162103619	1382630105	/nfs/dbraw/zinc/63/01/05/1382630105.db2.gz	JXXHJLHKJAZVDW-UHFFFAOYSA-N	0	3	343.402	3.125	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)c1ccc2c3c(cccc31)CC2	ZINC001162167149	1382646585	/nfs/dbraw/zinc/64/65/85/1382646585.db2.gz	NUSSBVJZPWEEDW-UHFFFAOYSA-N	0	3	328.843	3.400	20	30		EGEDHN
C#CCN1CCC(CNC(=O)C[C@H](C)CCCCC)(COC)CC1	ZINC001162513259	1382778296	/nfs/dbraw/zinc/77/82/96/1382778296.db2.gz	JOENPLZQULUAEN-GOSISDBHSA-N	0	3	336.520	3.071	20	30		EGEDHN
C#CCCCC(=O)N(CCNC/C=C/Cl)CCc1ccccc1	ZINC001162790965	1382873854	/nfs/dbraw/zinc/87/38/54/1382873854.db2.gz	SXXLDDCLAVHNDJ-MDWZMJQESA-N	0	3	332.875	3.203	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1C[C@H]1C(C)(C)C	ZINC001162859737	1382897656	/nfs/dbraw/zinc/89/76/56/1382897656.db2.gz	GXQSNYWBJZJPNJ-WOJBJXKFSA-N	0	3	340.511	3.353	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C1(CC)CCC1	ZINC001162891989	1382907158	/nfs/dbraw/zinc/90/71/58/1382907158.db2.gz	BWWFAOXYAWNOOG-UHFFFAOYSA-N	0	3	326.484	3.251	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CCCC1(C)C	ZINC001162892795	1382907568	/nfs/dbraw/zinc/90/75/68/1382907568.db2.gz	VTMNQRHYZWWBCE-LJQANCHMSA-N	0	3	326.484	3.107	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CCCC[C@@H]1C	ZINC001162905865	1382911070	/nfs/dbraw/zinc/91/10/70/1382911070.db2.gz	AGDWYMOBMMGXEP-AZUAARDMSA-N	0	3	326.484	3.107	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CCCC[C@H]1C	ZINC001162905871	1382911297	/nfs/dbraw/zinc/91/12/97/1382911297.db2.gz	AGDWYMOBMMGXEP-UYAOXDASSA-N	0	3	326.484	3.107	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@H](C)[C@@H](C)CC	ZINC001162964309	1382929638	/nfs/dbraw/zinc/92/96/38/1382929638.db2.gz	VTWZZPRQDFUJTC-RBUKOAKNSA-N	0	3	328.500	3.353	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1C[C@H]1c1ccccc1	ZINC001162987164	1382938697	/nfs/dbraw/zinc/93/86/97/1382938697.db2.gz	MQWFYGGSPMZVFH-FCHUYYIVSA-N	0	3	346.474	3.084	20	30		EGEDHN
Cc1ccc(C(=O)NCCCNCc2ccccc2C#N)c(C2CC2)n1	ZINC001163447946	1383054067	/nfs/dbraw/zinc/05/40/67/1383054067.db2.gz	XAAZFGKSUUKLEQ-UHFFFAOYSA-N	0	3	348.450	3.049	20	30		EGEDHN
Cc1ccc(CCC(=O)NCCCNCc2ccccc2C#N)c(C)c1	ZINC001163542098	1383074346	/nfs/dbraw/zinc/07/43/46/1383074346.db2.gz	DOWHRVXRALZQSP-UHFFFAOYSA-N	0	3	349.478	3.404	20	30		EGEDHN
C[C@@H]1Oc2ccc(NC(=N)c3ccc(C(F)(F)F)cc3)cc2NC1=O	ZINC001163680631	1383104729	/nfs/dbraw/zinc/10/47/29/1383104729.db2.gz	UARLWQLQAGABJS-VIFPVBQESA-N	0	3	349.312	3.462	20	30		EGEDHN
CC(C)=C(F)C(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001164069786	1383152810	/nfs/dbraw/zinc/15/28/10/1383152810.db2.gz	DCLCSKJAXSMNHH-UHFFFAOYSA-N	0	3	329.419	3.198	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NCCC1(CNCc2cnoc2C)CC1	ZINC001164693808	1383218531	/nfs/dbraw/zinc/21/85/31/1383218531.db2.gz	VBNNKZYMQGXWNA-UHFFFAOYSA-N	0	3	339.867	3.138	20	30		EGEDHN
Cc1ncc(C#N)c(N(C)[C@@H]2CN(Cc3ccccc3)CC[C@H]2C)n1	ZINC001165180873	1383242373	/nfs/dbraw/zinc/24/23/73/1383242373.db2.gz	FSKYZFPHERRTSG-DNVCBOLYSA-N	0	3	335.455	3.004	20	30		EGEDHN
C[C@@H]1CCN(Cc2ccccc2)C[C@H]1N(C)c1nccc(F)c1C#N	ZINC001165184268	1383243557	/nfs/dbraw/zinc/24/35/57/1383243557.db2.gz	VTPOLLAYMGPITO-DNVCBOLYSA-N	0	3	338.430	3.439	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)[C@H](C)C(C)(C)C)CC1	ZINC001165764152	1383341418	/nfs/dbraw/zinc/34/14/18/1383341418.db2.gz	NESGGMAZLJVUNE-ZDUSSCGKSA-N	0	3	345.325	3.453	20	30		EGEDHN
C[C@@H](C(=O)NCCCNCc1ccc(C#N)cc1F)c1cccs1	ZINC001166510911	1383430849	/nfs/dbraw/zinc/43/08/49/1383430849.db2.gz	RUUGUHQFFXZQDB-CYBMUJFWSA-N	0	3	345.443	3.158	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCC1(CNCc2c(C)noc2C)CC1	ZINC001166541992	1383435597	/nfs/dbraw/zinc/43/55/97/1383435597.db2.gz	XYMPGDRKZLRNND-UHFFFAOYSA-N	0	3	333.476	3.270	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCC1(CNCc2ccc(F)cn2)CC1	ZINC001166546382	1383436455	/nfs/dbraw/zinc/43/64/55/1383436455.db2.gz	WJGFROOMSDEBFW-UHFFFAOYSA-N	0	3	333.451	3.199	20	30		EGEDHN
C=CCC1(C(=O)NCCC2(CNCc3ccc(F)cn3)CC2)CCC1	ZINC001167036096	1383525151	/nfs/dbraw/zinc/52/51/51/1383525151.db2.gz	VKTPYXSPXUNTQB-UHFFFAOYSA-N	0	3	345.462	3.343	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)C2(C(C)C)CC2)CC1	ZINC001167149539	1383552918	/nfs/dbraw/zinc/55/29/18/1383552918.db2.gz	VLRKCLNYLHMWHA-UHFFFAOYSA-N	0	3	343.309	3.207	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1cnc2ccccc2c1	ZINC001167343255	1383604526	/nfs/dbraw/zinc/60/45/26/1383604526.db2.gz	BJHKRFLLVORVJW-UHFFFAOYSA-N	0	3	344.418	3.016	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@H]2CCO[C@H](C(C)C)C2)CC1	ZINC001167652355	1383699087	/nfs/dbraw/zinc/69/90/87/1383699087.db2.gz	YFMCYOYFPKAUBB-HOTGVXAUSA-N	0	3	342.911	3.066	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C[C@@H]2CCO[C@@H](CC)C2)CC1	ZINC001167657979	1383700957	/nfs/dbraw/zinc/70/09/57/1383700957.db2.gz	KFFJWTSUXOUDHD-CVEARBPZSA-N	0	3	342.911	3.210	20	30		EGEDHN
CC(C)N1CCN(c2ccc(NCCc3ccc(C#N)cc3)cn2)CC1	ZINC001167679377	1383708263	/nfs/dbraw/zinc/70/82/63/1383708263.db2.gz	QPDBKFRXYJZDGM-UHFFFAOYSA-N	0	3	349.482	3.138	20	30		EGEDHN
CC(C)(C)c1nc2c(o1)c(C#N)cnc2-n1nc(CN)c2ccccc21	ZINC001167697334	1383714078	/nfs/dbraw/zinc/71/40/78/1383714078.db2.gz	UMKDYSQJADXRKP-UHFFFAOYSA-N	0	3	346.394	3.190	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@@H](C)[C@@H](C)C(C)(C)C	ZINC001168168759	1383832405	/nfs/dbraw/zinc/83/24/05/1383832405.db2.gz	SZCHLIZDLVTWGJ-QWHCGFSZSA-N	0	3	333.314	3.309	20	30		EGEDHN
C=CC1(CC(=O)NCCCN[C@H](C)c2cnccn2)CCCCC1	ZINC001168182562	1383836303	/nfs/dbraw/zinc/83/63/03/1383836303.db2.gz	FGQFWKQKDIZATC-MRXNPFEDSA-N	0	3	330.476	3.160	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)CCCCCOCC)CC1	ZINC001168418509	1383901129	/nfs/dbraw/zinc/90/11/29/1383901129.db2.gz	AQCHEDFJSBMKEW-UHFFFAOYSA-N	0	3	330.900	3.212	20	30		EGEDHN
CCOC(=O)[C@@H]1[C@H](C)C[C@@H](C)N(Cc2ccc(C#N)cc2OC)[C@@H]1C	ZINC001308154773	1384101944	/nfs/dbraw/zinc/10/19/44/1384101944.db2.gz	DAFXRISZKJHLII-DEXNDLTESA-N	0	3	344.455	3.365	20	30		EGEDHN
CCN(CC)C(=O)C[C@@H](C)N1CCC(C#N)(c2ccccc2F)CC1	ZINC001169491138	1384154356	/nfs/dbraw/zinc/15/43/56/1384154356.db2.gz	WZWCEGGDDXRGFN-MRXNPFEDSA-N	0	3	345.462	3.330	20	30		EGEDHN
N#CC1(c2ccccc2)CC(NCc2cc3c([nH]c2=O)CCCC3)C1	ZINC001308908443	1384158747	/nfs/dbraw/zinc/15/87/47/1384158747.db2.gz	DVTSUDBAUHQQES-UHFFFAOYSA-N	0	3	333.435	3.380	20	30		EGEDHN
CCO[C@H](CC)C(=O)N[C@H](C)CCCCNCc1ccccc1C#N	ZINC001169568667	1384160372	/nfs/dbraw/zinc/16/03/72/1384160372.db2.gz	REVSSDQPYPUDCY-VQIMIIECSA-N	0	3	345.487	3.138	20	30		EGEDHN
N#Cc1c(F)c(F)c(N2CCCc3ccc(CN)nc32)c(F)c1F	ZINC001169591508	1384162630	/nfs/dbraw/zinc/16/26/30/1384162630.db2.gz	ZGNRCUWKCMYSQV-UHFFFAOYSA-N	0	3	336.292	3.053	20	30		EGEDHN
CC[C@@]1(C(C)C)C[C@@H]1C(=O)NCCCNCc1ccccc1C#N	ZINC001169730409	1384179580	/nfs/dbraw/zinc/17/95/80/1384179580.db2.gz	SUKDXRQDDTZHHP-QUCCMNQESA-N	0	3	327.472	3.226	20	30		EGEDHN
C[C@@H](CCCCNC/C(Cl)=C/Cl)NC(=O)c1cc(C#N)c[nH]1	ZINC001170043816	1384224286	/nfs/dbraw/zinc/22/42/86/1384224286.db2.gz	SKRKSKUJQHIZSG-HKMIMPICSA-N	0	3	343.258	3.084	20	30		EGEDHN
COC(=O)[C@@H]1[C@@H]2CC[C@@H](C2)N1C1CCC(C#N)(c2ccccc2)CC1	ZINC001170406049	1384309835	/nfs/dbraw/zinc/30/98/35/1384309835.db2.gz	ROPOHDGWSBHQDU-LIEGOMBTSA-N	0	3	338.451	3.416	20	30		EGEDHN
C[C@H](Nc1ccc(/N=C/N(C)C)c(C#N)c1)[C@H](O)c1cccc(O)c1	ZINC001170675010	1384362065	/nfs/dbraw/zinc/36/20/65/1384362065.db2.gz	GFYAFRPUMGBSGQ-KCSSBKLYSA-N	0	3	338.411	3.019	20	30		EGEDHN
C=CCn1ccc2c1ncnc2-n1c(-c2ccccc2)cnc1[C@H](C)N	ZINC001170680241	1384364440	/nfs/dbraw/zinc/36/44/40/1384364440.db2.gz	QTCZYQCLPNJRJK-AWEZNQCLSA-N	0	3	344.422	3.490	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)C[C@@H](CC)C(C)(C)C	ZINC001170886333	1384405328	/nfs/dbraw/zinc/40/53/28/1384405328.db2.gz	SWJUCPJDSOSDTN-CYBMUJFWSA-N	0	3	333.314	3.453	20	30		EGEDHN
Cc1cncnc1O[C@@H]1CCCN([C@H](C)Cc2cccc(C#N)c2)C1	ZINC001171232496	1384475474	/nfs/dbraw/zinc/47/54/74/1384475474.db2.gz	SUZRSCJZAOAMSF-VQIMIIECSA-N	0	3	336.439	3.131	20	30		EGEDHN
CCc1cc(Br)ccc1NC(=N)c1ccc(C(N)=O)cc1	ZINC001171256683	1384480212	/nfs/dbraw/zinc/48/02/12/1384480212.db2.gz	RHKPWFGALBZEGN-UHFFFAOYSA-N	0	3	346.228	3.147	20	30		EGEDHN
COc1cccc(CN2CCN([C@H](C)Cc3ccc(C#N)cc3)CC2)c1	ZINC001172310563	1384766499	/nfs/dbraw/zinc/76/64/99/1384766499.db2.gz	GGVQXCROFNEUBS-GOSISDBHSA-N	0	3	349.478	3.316	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)N1CC[C@@H](N2CCCCC2)[C@@H](F)C1	ZINC001172317120	1384768174	/nfs/dbraw/zinc/76/81/74/1384768174.db2.gz	PNQBJMRBXFIQDK-FFZOFVMBSA-N	0	3	329.463	3.388	20	30		EGEDHN
CC1(CCC(=O)NC[C@@H](NCc2ccc(C#N)s2)C2CC2)CC1	ZINC001317028717	1384795842	/nfs/dbraw/zinc/79/58/42/1384795842.db2.gz	GVOYCHZHSJFOIM-MRXNPFEDSA-N	0	3	331.485	3.184	20	30		EGEDHN
C[C@@H](CCCC#N)N1CCN(c2ccc(-c3ncccn3)cc2)CC1	ZINC001172506321	1384806971	/nfs/dbraw/zinc/80/69/71/1384806971.db2.gz	RJVUNMSGOLKBOM-KRWDZBQOSA-N	0	3	335.455	3.348	20	30		EGEDHN
CC(C)C[C@H]([NH2+][C@H](C)CCc1c(F)cc(Cl)cc1F)C(=O)N[O-]	ZINC001172569457	1384813283	/nfs/dbraw/zinc/81/32/83/1384813283.db2.gz	FEWIHIICWSLZCE-BMIGLBTASA-N	0	3	348.821	3.449	20	30		EGEDHN
C[C@H](N[C@H]1CCN(C(=O)OC(C)(C)C)[C@H](C#N)C1)c1ccncc1	ZINC001172967658	1384891914	/nfs/dbraw/zinc/89/19/14/1384891914.db2.gz	ZHLUJXZKBDJHEU-BPUTZDHNSA-N	0	3	330.432	3.024	20	30		EGEDHN
C[C@H](N[C@H]1CCN(C(=O)OC(C)(C)C)[C@H](C#N)C1)c1cccnc1	ZINC001172969559	1384892916	/nfs/dbraw/zinc/89/29/16/1384892916.db2.gz	YPSHBGXAVKXQKC-BPUTZDHNSA-N	0	3	330.432	3.024	20	30		EGEDHN
CC(C)(C)OC(=O)[C@@H]1CCCCN1CNC1CCC(CC#N)CC1	ZINC001173334592	1384960722	/nfs/dbraw/zinc/96/07/22/1384960722.db2.gz	UZPQOYWZFJHCIT-JCYILVPMSA-N	0	3	335.492	3.202	20	30		EGEDHN
N#CC1(CNC2CCN(C(=O)c3ccc(F)c(Cl)c3)CC2)CCC1	ZINC001173761174	1385013916	/nfs/dbraw/zinc/01/39/16/1385013916.db2.gz	BWZYMGPNINEMAN-UHFFFAOYSA-N	0	3	349.837	3.367	20	30		EGEDHN
CC[C@@H](CC#N)NC1CCN(C(=O)c2ccc(F)c(Cl)c2)CC1	ZINC001173777463	1385015175	/nfs/dbraw/zinc/01/51/75/1385015175.db2.gz	JVNUXQBPQGENAU-ZDUSSCGKSA-N	0	3	337.826	3.366	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCN(C(=O)CCCC2CC2)C1	ZINC001317336661	1385089215	/nfs/dbraw/zinc/08/92/15/1385089215.db2.gz	ZMEWZRAJENANHS-QGZVFWFLSA-N	0	3	325.456	3.077	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H](C)CCCCNCc1cc2n(n1)CCCC2	ZINC001174682602	1385133965	/nfs/dbraw/zinc/13/39/65/1385133965.db2.gz	MVTZZLZTCJPBOW-INIZCTEOSA-N	0	3	346.519	3.196	20	30		EGEDHN
C=CCCCC(=O)N[C@@H](C)CCCCNCc1ncc(Cl)n1C	ZINC001174985887	1385179226	/nfs/dbraw/zinc/17/92/26/1385179226.db2.gz	BXHGZIUROCTJCV-AWEZNQCLSA-N	0	3	340.899	3.194	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H](C)CCCCNCc1cn(C(C)C)nn1	ZINC001175082260	1385191451	/nfs/dbraw/zinc/19/14/51/1385191451.db2.gz	NHENOCHEVJFMTC-QFBILLFUSA-N	0	3	349.523	3.226	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@H](C)CCCCNCc1cc2n(n1)CCC2	ZINC001175081919	1385191539	/nfs/dbraw/zinc/19/15/39/1385191539.db2.gz	KIUXUPUVDZGXSV-OXQOHEQNSA-N	0	3	346.519	3.196	20	30		EGEDHN
CCc1ccc(C(=O)NCCCNCc2ccc(C#N)cc2F)cc1	ZINC001175085993	1385192893	/nfs/dbraw/zinc/19/28/93/1385192893.db2.gz	WBSGYUUDBVQIGY-UHFFFAOYSA-N	0	3	339.414	3.169	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H](C)CCCCNCc1nnc(C(C)C)[nH]1	ZINC001175468556	1385300965	/nfs/dbraw/zinc/30/09/65/1385300965.db2.gz	HGFQNPIENQWTGN-HNNXBMFYSA-N	0	3	349.523	3.295	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H](C)CCCCNCc1cc(OC)no1	ZINC001175470035	1385302035	/nfs/dbraw/zinc/30/20/35/1385302035.db2.gz	ZBHCUFYHJIZIME-AWEZNQCLSA-N	0	3	337.464	3.050	20	30		EGEDHN
N#Cc1cccc2c1c(N)nn2C1=CCN(Cc2ccccc2)CC1	ZINC001175505627	1385314918	/nfs/dbraw/zinc/31/49/18/1385314918.db2.gz	WGGLANFDPKUQHQ-UHFFFAOYSA-N	0	3	329.407	3.237	20	30		EGEDHN
CCN1CCN(c2ccc(Nc3c(C#N)cccc3C#N)cc2)CC1	ZINC001175780572	1385402332	/nfs/dbraw/zinc/40/23/32/1385402332.db2.gz	JMFIOUCCLPFTNL-UHFFFAOYSA-N	0	3	331.423	3.315	20	30		EGEDHN
CCCCC(=O)NCC[C@H]1CCN(Cc2ccc(F)c(C#N)c2)C1	ZINC001317773318	1385464884	/nfs/dbraw/zinc/46/48/84/1385464884.db2.gz	BBENVHOFENZXMA-HNNXBMFYSA-N	0	3	331.435	3.216	20	30		EGEDHN
C=CC[C@@H](C(=O)NCCCNCc1nc(C)cs1)c1ccccc1	ZINC001176697722	1385662778	/nfs/dbraw/zinc/66/27/78/1385662778.db2.gz	MJNXIHPUZBLYTJ-QGZVFWFLSA-N	0	3	343.496	3.407	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)[C@@H]2CC3CCC2CC3)c1	ZINC001177074843	1385797202	/nfs/dbraw/zinc/79/72/02/1385797202.db2.gz	WLTGYHOHZVOWAQ-JFUPDXTOSA-N	0	3	343.446	3.120	20	30		EGEDHN
Cc1cccc(Cl)c1CNCC1(NC(=O)[C@H](C)C#N)CCCC1	ZINC001318626812	1385802391	/nfs/dbraw/zinc/80/23/91/1385802391.db2.gz	NTVYDQYOUUNXGN-CQSZACIVSA-N	0	3	333.863	3.327	20	30		EGEDHN
C#CCCCC(=O)N(CCCNCc1ocnc1C)CC1CCCC1	ZINC001177312253	1385909795	/nfs/dbraw/zinc/90/97/95/1385909795.db2.gz	YJIIWCGYVMQAMW-UHFFFAOYSA-N	0	3	345.487	3.285	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)Cc1ccc[nH]1	ZINC001177485395	1385975214	/nfs/dbraw/zinc/97/52/14/1385975214.db2.gz	YZBFCBZMYDTFBV-UHFFFAOYSA-N	0	3	337.895	3.308	20	30		EGEDHN
N#Cc1ccccc1CNCCCCCCNC(=O)c1ccco1	ZINC001177771515	1386040044	/nfs/dbraw/zinc/04/00/44/1386040044.db2.gz	NHSRBGCVCKUFRR-UHFFFAOYSA-N	0	3	325.412	3.231	20	30		EGEDHN
N#CC(Cc1cccs1)C(=O)Nc1cccc(-c2cccc(N)n2)n1	ZINC001177903807	1386079467	/nfs/dbraw/zinc/07/94/67/1386079467.db2.gz	LASFEEYPMUKRNO-LBPRGKRZSA-N	0	3	349.419	3.108	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@H](NCC#Cc2ccc(Cl)cc2)[C@@H]1C	ZINC001178066249	1386121337	/nfs/dbraw/zinc/12/13/37/1386121337.db2.gz	UCBSDZOXBIPZNO-YJBOKZPZSA-N	0	3	330.859	3.237	20	30		EGEDHN
CCC1(C(=O)N(C)[C@H](C)CNCc2ccc(F)c(C#N)c2)CCC1	ZINC001319515708	1386156767	/nfs/dbraw/zinc/15/67/67/1386156767.db2.gz	SIKITLHRKKFXBG-CQSZACIVSA-N	0	3	331.435	3.214	20	30		EGEDHN
CC/C=C(/C)C(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@@H]1C	ZINC001178246216	1386170695	/nfs/dbraw/zinc/17/06/95/1386170695.db2.gz	YAPOPVAATDMSJR-JMSWLKAVSA-N	0	3	328.431	3.113	20	30		EGEDHN
N#Cc1cc(C(=O)NCCCCCCNC/C(Cl)=C/Cl)c[nH]1	ZINC001178257981	1386175009	/nfs/dbraw/zinc/17/50/09/1386175009.db2.gz	RCKGWWHZWFOYND-JYRVWZFOSA-N	0	3	343.258	3.085	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCCCCCN[C@H](C)c1nnc(CC)[nH]1	ZINC001178580320	1386255075	/nfs/dbraw/zinc/25/50/75/1386255075.db2.gz	WPWACMLFHNMZQW-OAHLLOKOSA-N	0	3	349.523	3.297	20	30		EGEDHN
C=C(C)CCC(=O)NCCCCCCNCc1nnc(C)n1CCC	ZINC001178596020	1386258170	/nfs/dbraw/zinc/25/81/70/1386258170.db2.gz	CVIUBJPXUUBRBF-UHFFFAOYSA-N	0	3	349.523	3.119	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCCCCCNCc1cc2n(n1)CCC2	ZINC001179212848	1386424910	/nfs/dbraw/zinc/42/49/10/1386424910.db2.gz	ZUPFUITUDPWYMU-UHFFFAOYSA-N	0	3	346.519	3.198	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H](NCc2cccc(OCC)n2)[C@@H]1C	ZINC001179364172	1386464266	/nfs/dbraw/zinc/46/42/66/1386464266.db2.gz	GNSVLEOSUXLQJV-RYRKJORJSA-N	0	3	345.487	3.162	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)[C@@H]1C	ZINC001179380073	1386468257	/nfs/dbraw/zinc/46/82/57/1386468257.db2.gz	DATAFUFCJFDOOG-VCBZYWHSSA-N	0	3	343.446	3.379	20	30		EGEDHN
C=CCCCC(=O)NCCCCCCNCc1nnc(C(C)C)[nH]1	ZINC001179421884	1386480446	/nfs/dbraw/zinc/48/04/46/1386480446.db2.gz	NSUWTUOHHVFHLF-UHFFFAOYSA-N	0	3	335.496	3.051	20	30		EGEDHN
C=CCCC1(C(=O)NCCCCCCN[C@@H](C)c2nnc(C)[nH]2)CC1	ZINC001179482502	1386494957	/nfs/dbraw/zinc/49/49/57/1386494957.db2.gz	VOLWKUPQFQHPFS-HNNXBMFYSA-N	0	3	347.507	3.187	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCCCCCNCc1nnc(C(C)C)[nH]1	ZINC001179482345	1386495303	/nfs/dbraw/zinc/49/53/03/1386495303.db2.gz	TZKCQBCHTWZKDT-IBGZPJMESA-N	0	3	349.523	3.297	20	30		EGEDHN
C=CCCOCC(=O)N1CC[C@H](NCc2cc3ccccc3o2)[C@@H]1C	ZINC001180253907	1386747634	/nfs/dbraw/zinc/74/76/34/1386747634.db2.gz	NPIYFDQICURRKS-YJBOKZPZSA-N	0	3	342.439	3.105	20	30		EGEDHN
COc1cc(CN2CCC[C@@H]2CNc2cccc(C)n2)ccc1C#N	ZINC001321219331	1386845094	/nfs/dbraw/zinc/84/50/94/1386845094.db2.gz	CPFMMNGIINZKPX-GOSISDBHSA-N	0	3	336.439	3.347	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](C)[C@](C)(CN[C@@H](C)c2cnccn2)C1	ZINC001181594130	1387021499	/nfs/dbraw/zinc/02/14/99/1387021499.db2.gz	IIDDFEGNCDRTBX-GQIGUUNPSA-N	0	3	344.503	3.214	20	30		EGEDHN
C#CCCCCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2ocnc2C)C1	ZINC001182208396	1387120726	/nfs/dbraw/zinc/12/07/26/1387120726.db2.gz	SRORSXWILPEDQH-OXQOHEQNSA-N	0	3	345.487	3.141	20	30		EGEDHN
C=CCOc1ccccc1[C@@H](C)NC(=O)[C@@H]1CCCN1CC1CC1	ZINC001182560180	1387187577	/nfs/dbraw/zinc/18/75/77/1387187577.db2.gz	DOPGLMSKWZGHGG-QAPCUYQASA-N	0	3	328.456	3.303	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1ccccc1COC	ZINC001329305985	1389056065	/nfs/dbraw/zinc/05/60/65/1389056065.db2.gz	BCSGSTCLLFALGE-UHFFFAOYSA-N	0	3	338.879	3.273	20	30		EGEDHN
C=C[C@H](COC)N[C@H]1CCc2ccc(I)cc21	ZINC001330316883	1389386243	/nfs/dbraw/zinc/38/62/43/1389386243.db2.gz	UOCFWWQLSSMSCS-OCCSQVGLSA-N	0	3	343.208	3.069	20	30		EGEDHN
CN(C(=O)C1CCCC1)[C@@H](CNCc1cc(C#N)ccc1F)C1CC1	ZINC001331238897	1389664313	/nfs/dbraw/zinc/66/43/13/1389664313.db2.gz	BFITUNDAJFERQV-IBGZPJMESA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@H](CN(C)C(=O)C1CCCCC1)NCc1ccc(F)c(C#N)c1	ZINC001331368556	1389720649	/nfs/dbraw/zinc/72/06/49/1389720649.db2.gz	AQDLGBGJUWYKCC-CQSZACIVSA-N	0	3	331.435	3.214	20	30		EGEDHN
Cc1sccc1C(=O)N(C)C[C@H](C)NCc1ccc(F)c(C#N)c1	ZINC001331440830	1389749580	/nfs/dbraw/zinc/74/95/80/1389749580.db2.gz	IYWQVZGGRKRZDI-LBPRGKRZSA-N	0	3	345.443	3.318	20	30		EGEDHN
C[C@@H]1[C@H](NCc2ccc(C#N)s2)CCN1C(=O)CCC(F)(F)F	ZINC001331869562	1389893823	/nfs/dbraw/zinc/89/38/23/1389893823.db2.gz	LLBWLKPSXVLWGG-ZWNOBZJWSA-N	0	3	345.390	3.041	20	30		EGEDHN
C=CCC[C@H]1CCCN1C(=O)[C@@H]1CCCN(Cc2cccnc2)C1	ZINC001339281405	1389972801	/nfs/dbraw/zinc/97/28/01/1389972801.db2.gz	QWXGUKUPYGZJNA-MOPGFXCFSA-N	0	3	327.472	3.251	20	30		EGEDHN
C=CCC[C@@H]1CCCN1C(=O)[C@H]1CCCN(Cc2cccnc2)C1	ZINC001339281407	1389973299	/nfs/dbraw/zinc/97/32/99/1389973299.db2.gz	QWXGUKUPYGZJNA-RBUKOAKNSA-N	0	3	327.472	3.251	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N1CC[C@H](C(C)(C)C)C1	ZINC001339483377	1390042545	/nfs/dbraw/zinc/04/25/45/1390042545.db2.gz	IQEMDCBNZFSEGK-HOTGVXAUSA-N	0	3	331.508	3.146	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1cc(F)ccc1OC[C@@H]1CCCO1	ZINC001339924087	1390190731	/nfs/dbraw/zinc/19/07/31/1390190731.db2.gz	XLBSVNPRRJSLJK-GJZGRUSLSA-N	0	3	336.407	3.006	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)[C@@H]1CC[C@@H](C)CC1	ZINC001698769864	1406428370	/nfs/dbraw/zinc/42/83/70/1406428370.db2.gz	AKGNDVVXJMPXEW-BRWVUGGUSA-N	0	3	327.472	3.226	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N[C@@H](c1c(F)cccc1F)C(F)(F)F	ZINC001340428016	1390287340	/nfs/dbraw/zinc/28/73/40/1390287340.db2.gz	FCZBKDNONZRHAW-YPMHNXCESA-N	0	3	336.304	3.368	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccc2oc(C(F)(F)F)nc2c1	ZINC001340620778	1390330001	/nfs/dbraw/zinc/33/00/01/1390330001.db2.gz	KSLDRMZPZSIAOX-SNVBAGLBSA-N	0	3	327.306	3.469	20	30		EGEDHN
CC[C@@]1(CCc2ccccc2)CCCN1C(=O)[C@@H](N)CCCC#N	ZINC001333729611	1390386431	/nfs/dbraw/zinc/38/64/31/1390386431.db2.gz	AUISBBFDRLWTTI-ICSRJNTNSA-N	0	3	327.472	3.412	20	30		EGEDHN
CCS[C@@H](C(=O)C(C#N)c1nc(N)c2ccccc2n1)C(C)C	ZINC001342547749	1390624951	/nfs/dbraw/zinc/62/49/51/1390624951.db2.gz	DFLDJYHWKAVRNO-IUODEOHRSA-N	0	3	328.441	3.166	20	30		EGEDHN
Cc1oc(C(C)(C)C)cc1C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC001342918111	1390672407	/nfs/dbraw/zinc/67/24/07/1390672407.db2.gz	GNQJFZXHMGIXDR-CYBMUJFWSA-N	0	3	325.368	3.242	20	30		EGEDHN
CC(C)N1CCC[C@@H]1C(=O)C(C#N)c1nc2cc(F)ccc2s1	ZINC001343273369	1390704178	/nfs/dbraw/zinc/70/41/78/1390704178.db2.gz	HIRFRORVMYSUTB-GXTWGEPZSA-N	0	3	331.416	3.484	20	30		EGEDHN
C=CCNC(=O)Nc1ccc(NC(=O)[C@H]2CCCN2CC(C)C)cc1	ZINC001335582926	1390705864	/nfs/dbraw/zinc/70/58/64/1390705864.db2.gz	CJHPYGOXKXJGEB-QGZVFWFLSA-N	0	3	344.459	3.053	20	30		EGEDHN
CC[C@@H](C)c1ccc(NC(=O)C(C#N)C(=O)Cc2cc(C)on2)cc1	ZINC001343599462	1390725469	/nfs/dbraw/zinc/72/54/69/1390725469.db2.gz	LNZKGYMNEQRUPR-PXAZEXFGSA-N	0	3	339.395	3.387	20	30		EGEDHN
Cn1c(Cl)cnc1C(C#N)C(=O)C[C@@H]1CCc2ccccc2C1	ZINC001344321778	1390782185	/nfs/dbraw/zinc/78/21/85/1390782185.db2.gz	BFJCGPHDNYSGEE-IUODEOHRSA-N	0	3	327.815	3.445	20	30		EGEDHN
CCN1C[C@H](C)N(c2nnc([C@H](C)CCC#N)n2CC(C)C)C[C@H]1C	ZINC001344342999	1390784942	/nfs/dbraw/zinc/78/49/42/1390784942.db2.gz	OKHWINPOAQQFJV-ZACQAIPSSA-N	0	3	346.523	3.260	20	30		EGEDHN
CSc1ccc([C@@H](CNC(=O)C#Cc2cccs2)N(C)C)cc1	ZINC001344389672	1390788547	/nfs/dbraw/zinc/78/85/47/1390788547.db2.gz	NBJLZAKUEREHFP-QGZVFWFLSA-N	0	3	344.505	3.241	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCC1(N[C@@H](C)c2cc(F)ccc2F)CCCC1	ZINC001698795538	1406463414	/nfs/dbraw/zinc/46/34/14/1406463414.db2.gz	FSNYVALRIGAYLR-STQMWFEESA-N	0	3	335.398	3.204	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCc1cccc(OC(C)(C)C)n1	ZINC001344875170	1390821017	/nfs/dbraw/zinc/82/10/17/1390821017.db2.gz	NNIMONSAQJMIIF-OAHLLOKOSA-N	0	3	340.427	3.284	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccc(COC)cc2)CCCC1	ZINC001698804218	1406483462	/nfs/dbraw/zinc/48/34/62/1406483462.db2.gz	MMYLHHHYYUZFOU-UHFFFAOYSA-N	0	3	336.863	3.218	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)N(C)C(=O)c1ccc(F)cc1	ZINC001698810853	1406497494	/nfs/dbraw/zinc/49/74/94/1406497494.db2.gz	FRCRZVDUEAEVKD-GFCCVEGCSA-N	0	3	331.416	3.009	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)NCc1cc(Cl)c(OCC)c(OC)c1	ZINC001353182747	1391953134	/nfs/dbraw/zinc/95/31/34/1391953134.db2.gz	METRMARSLBXXLR-AWEZNQCLSA-N	0	3	340.851	3.047	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)CC(C)(C)C2CC2)C1	ZINC001479367165	1392226662	/nfs/dbraw/zinc/22/66/62/1392226662.db2.gz	FFRNMEMJUASEPO-MQMHXKEQSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)CCc1nccs1	ZINC001479834212	1392420015	/nfs/dbraw/zinc/42/00/15/1392420015.db2.gz	NXXBUBQXDPSWPO-ZIAGYGMSSA-N	0	3	341.908	3.187	20	30		EGEDHN
CCC(CC)C(=O)NC[C@@H](NCc1ccc(C#N)cc1F)C1CC1	ZINC001480005188	1392532055	/nfs/dbraw/zinc/53/20/55/1392532055.db2.gz	NIVNLOHWONGUOO-GOSISDBHSA-N	0	3	331.435	3.118	20	30		EGEDHN
CCC(CC)C(=O)NC[C@H](NCc1ccc(C#N)cc1F)C1CC1	ZINC001480005189	1392532158	/nfs/dbraw/zinc/53/21/58/1392532158.db2.gz	NIVNLOHWONGUOO-SFHVURJKSA-N	0	3	331.435	3.118	20	30		EGEDHN
Cc1cc(C)c(C(=O)NC[C@@H](C)NCc2ccc(C#N)s2)c(C)c1	ZINC001480586326	1392806279	/nfs/dbraw/zinc/80/62/79/1392806279.db2.gz	VXWIVVYYHAWNQQ-OAHLLOKOSA-N	0	3	341.480	3.453	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)C1(Cc2ccc(F)cc2)CC1	ZINC001480797219	1392939614	/nfs/dbraw/zinc/93/96/14/1392939614.db2.gz	NLTRHYQVAWDADN-AWEZNQCLSA-N	0	3	338.854	3.385	20	30		EGEDHN
C=C(Br)CN[C@@H](C)CCNC(=O)CCc1ccccc1	ZINC001480805691	1392945572	/nfs/dbraw/zinc/94/55/72/1392945572.db2.gz	VKWDTFBQSAVBRO-AWEZNQCLSA-N	0	3	339.277	3.012	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)NCC[C@@H]1CCN(Cc2ccc(C#N)c(F)c2)C1	ZINC001481426173	1394282868	/nfs/dbraw/zinc/28/28/68/1394282868.db2.gz	GZXIGXPBCZKPEF-RHSMWYFYSA-N	0	3	343.446	3.072	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H](CNC(=O)CCC3CCC3)C2)cc1	ZINC001491098206	1394427336	/nfs/dbraw/zinc/42/73/36/1394427336.db2.gz	LSYGXBVOUDQKGQ-FQEVSTJZSA-N	0	3	339.483	3.467	20	30		EGEDHN
CC[C@@H](CNC(=O)c1ccc(Cl)o1)NCc1ccc(C#N)s1	ZINC001481789366	1394530760	/nfs/dbraw/zinc/53/07/60/1394530760.db2.gz	YBLVELQWNZVQCD-JTQLQIEISA-N	0	3	337.832	3.164	20	30		EGEDHN
CC[C@H](CNC(=O)c1cnoc1C(C)C)NCc1ccc(C#N)s1	ZINC001481862763	1394566053	/nfs/dbraw/zinc/56/60/53/1394566053.db2.gz	ABAZYWUFVNQAKK-GFCCVEGCSA-N	0	3	346.456	3.029	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)CC2CCOCC2)CCCC[C@H]1C	ZINC001481958230	1394619825	/nfs/dbraw/zinc/61/98/25/1394619825.db2.gz	UYDGGGRBNDBDKO-KDOFPFPSSA-N	0	3	342.911	3.210	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2oncc2C)CCCC[C@H]1C	ZINC001481959851	1394620989	/nfs/dbraw/zinc/62/09/89/1394620989.db2.gz	CTNZZUNBNUUVOE-WBMJQRKESA-N	0	3	325.840	3.004	20	30		EGEDHN
C[C@@H](CNCc1ccccc1C#N)CNC(=O)[C@H](C)c1cccs1	ZINC001482141500	1394766702	/nfs/dbraw/zinc/76/67/02/1394766702.db2.gz	DFCPZFRKCHHIQY-LSDHHAIUSA-N	0	3	341.480	3.265	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccc(Cl)cc1)N(C)Cc1ccc(C#N)cc1	ZINC001485374515	1395853617	/nfs/dbraw/zinc/85/36/17/1395853617.db2.gz	IWAHDKDDUVTATM-AWEZNQCLSA-N	0	3	341.842	3.462	20	30		EGEDHN
Cc1ccc(C(=O)N(C)C[C@@H](C)NCc2ccc(C#N)s2)c(C)c1	ZINC001485951697	1396172872	/nfs/dbraw/zinc/17/28/72/1396172872.db2.gz	MUUTZOHYXGIYAQ-OAHLLOKOSA-N	0	3	341.480	3.487	20	30		EGEDHN
CCC(C)(C)C(=O)N[C@H]1CC[C@H](CNCc2ccccc2C#N)C1	ZINC001486210219	1396183095	/nfs/dbraw/zinc/18/30/95/1396183095.db2.gz	IWGKLHBPZUQQHN-YJBOKZPZSA-N	0	3	327.472	3.369	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)C[C@H](C)SC)CC1	ZINC001505395130	1396282427	/nfs/dbraw/zinc/28/24/27/1396282427.db2.gz	ABIWDIJTCPCGHV-AWEZNQCLSA-N	0	3	332.941	3.441	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1csc2c1CCCC2	ZINC001492121920	1396306027	/nfs/dbraw/zinc/30/60/27/1396306027.db2.gz	VHOKDOKHJGWYNM-LBPRGKRZSA-N	0	3	326.893	3.477	20	30		EGEDHN
Cc1cc(C)c(C(=O)N[C@@H](C)CN(C)Cc2cccc(C#N)c2)s1	ZINC001498294045	1396960951	/nfs/dbraw/zinc/96/09/51/1396960951.db2.gz	OVEZDBCNSVYWHE-AWEZNQCLSA-N	0	3	341.480	3.487	20	30		EGEDHN
CC[C@@H](C)CC(=O)N(C)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001690021904	1404260875	/nfs/dbraw/zinc/26/08/75/1404260875.db2.gz	NAVMKXGWKSEOIY-MRXNPFEDSA-N	0	3	327.472	3.417	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@H]1CCN(CC[C@H]2CCCC2(F)F)C1	ZINC001690090469	1404293635	/nfs/dbraw/zinc/29/36/35/1404293635.db2.gz	JWQPRJWAUZQQEJ-CABCVRRESA-N	0	3	326.431	3.052	20	30		EGEDHN
C[C@H](CCNC(=O)c1cccc(F)c1)NCc1cc(C#N)ccc1F	ZINC001690829994	1404765720	/nfs/dbraw/zinc/76/57/20/1404765720.db2.gz	NWPPPRHJXKKQBB-CYBMUJFWSA-N	0	3	343.377	3.135	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)Cc2cc(F)c(C)cc2F)C1	ZINC001691104984	1405043881	/nfs/dbraw/zinc/04/38/81/1405043881.db2.gz	MUXOAJWUVIVAMN-XBXGTLAGSA-N	0	3	342.817	3.053	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC[C@H]1C[C@H](NCc2cccc(Cl)c2Cl)C1	ZINC001691138393	1405073294	/nfs/dbraw/zinc/07/32/94/1405073294.db2.gz	QBAIXNPUDCUXBW-GVXVVHGQSA-N	0	3	340.254	3.137	20	30		EGEDHN
Cc1ccc(CC(=O)NC[C@H]2CCN(Cc3ccc(C#N)cc3)C2)cc1	ZINC001691147541	1405080516	/nfs/dbraw/zinc/08/05/16/1405080516.db2.gz	AQPRDVMDCIZXEF-OAQYLSRUSA-N	0	3	347.462	3.048	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)Cc2ccc(Cl)c(F)c2)C1	ZINC001691742516	1405463820	/nfs/dbraw/zinc/46/38/20/1405463820.db2.gz	ADJWTBQJOYATKJ-BETUJISGSA-N	0	3	345.245	3.259	20	30		EGEDHN
Cc1coc(C(=O)NCC[C@H]2CCN(Cc3ccccc3C#N)C2)c1	ZINC001691905241	1405629367	/nfs/dbraw/zinc/62/93/67/1405629367.db2.gz	PXPNUPHFPMPBJG-INIZCTEOSA-N	0	3	337.423	3.102	20	30		EGEDHN
CC[C@H](CNC(=O)c1cc(C(C)C)on1)NCc1ccc(C#N)s1	ZINC001732210046	1428458450	/nfs/dbraw/zinc/45/84/50/1428458450.db2.gz	LHJPDTZJJDMDLE-GFCCVEGCSA-N	0	3	346.456	3.029	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H](C)CN(C)Cc2cccc(C#N)c2)s1	ZINC001699436937	1412758314	/nfs/dbraw/zinc/75/83/14/1412758314.db2.gz	MHLKMVASUVMQSQ-CYBMUJFWSA-N	0	3	327.453	3.179	20	30		EGEDHN
C[C@H](CN(C)Cc1cccc(C#N)c1)NC(=O)C1=CCCCCC1	ZINC001699450141	1412788840	/nfs/dbraw/zinc/78/88/40/1412788840.db2.gz	MPNCLQVMUPDPKB-MRXNPFEDSA-N	0	3	325.456	3.385	20	30		EGEDHN
CC1(CNC(=O)c2ccco2)CCN(Cc2cccc(C#N)c2)CC1	ZINC001699860187	1413293439	/nfs/dbraw/zinc/29/34/39/1413293439.db2.gz	JAIIFEXQTBTCMC-UHFFFAOYSA-N	0	3	337.423	3.183	20	30		EGEDHN
C[C@]1(CNC(=O)C2CCCC2)CCCN(Cc2cccc(C#N)c2)C1	ZINC001699866467	1413304499	/nfs/dbraw/zinc/30/44/99/1413304499.db2.gz	AESCSIUKJGRQFQ-OAQYLSRUSA-N	0	3	339.483	3.467	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)CC1(C)CC1)NCc1ccc(C#N)cc1F	ZINC001732562827	1428753452	/nfs/dbraw/zinc/75/34/52/1428753452.db2.gz	ZQVNPQKAPULTEI-QGZVFWFLSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)Cc1cccc2cccnc21)C(C)C	ZINC001732565352	1428757392	/nfs/dbraw/zinc/75/73/92/1428757392.db2.gz	MPVGNZVFRHBNOM-QGZVFWFLSA-N	0	3	345.874	3.260	20	30		EGEDHN
CN(C(=O)CCC1(C)CC1)C1CC(NCc2ccc(C#N)cc2F)C1	ZINC001701023907	1414685381	/nfs/dbraw/zinc/68/53/81/1414685381.db2.gz	GEDOSFXBBBWPEW-UHFFFAOYSA-N	0	3	343.446	3.357	20	30		EGEDHN
CC(C)CCC(=O)NC[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001713210664	1417782852	/nfs/dbraw/zinc/78/28/52/1417782852.db2.gz	VVQNUBIYNADVCE-LJQANCHMSA-N	0	3	327.472	3.323	20	30		EGEDHN
CC(C)(C(=O)NC[C@H]1CCCN(Cc2cccc(C#N)c2)C1)C(F)F	ZINC001713218818	1417799177	/nfs/dbraw/zinc/79/91/77/1417799177.db2.gz	CWERQTWCADJJFQ-MRXNPFEDSA-N	0	3	349.425	3.178	20	30		EGEDHN
CCN(CCNC(=O)C1(c2ccccc2)CC1)Cc1ccc(C#N)cc1	ZINC001713497186	1418208148	/nfs/dbraw/zinc/20/81/48/1418208148.db2.gz	XXHRKKSSRYOIMQ-UHFFFAOYSA-N	0	3	347.462	3.228	20	30		EGEDHN
CC1(CCC(=O)NC[C@@H]2CCCN(Cc3cccc(C#N)c3)C2)CC1	ZINC001714050623	1418849194	/nfs/dbraw/zinc/84/91/94/1418849194.db2.gz	ZQUKJXWTHCPOGJ-IBGZPJMESA-N	0	3	339.483	3.467	20	30		EGEDHN
C[C@@H](CCNC(=O)c1ccc(F)cc1)NCc1cc(C#N)ccc1F	ZINC001714456130	1419188964	/nfs/dbraw/zinc/18/89/64/1419188964.db2.gz	LZBQQKYPRXVWGM-ZDUSSCGKSA-N	0	3	343.377	3.135	20	30		EGEDHN
CC[C@H](CNC(=O)Cc1ccccc1C)NCc1ccc(C#N)s1	ZINC001715078553	1419814090	/nfs/dbraw/zinc/81/40/90/1419814090.db2.gz	BRHUDMQTVRAMQO-MRXNPFEDSA-N	0	3	341.480	3.155	20	30		EGEDHN
C[C@@](CNCc1ccc(C#N)cc1F)(NC(=O)C1=CCCC1)C1CC1	ZINC001715113547	1419857249	/nfs/dbraw/zinc/85/72/49/1419857249.db2.gz	MLTOEVPWFDGBLK-FQEVSTJZSA-N	0	3	341.430	3.182	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H]2COc3ccccc3C2)CCCC1	ZINC001715303899	1420012377	/nfs/dbraw/zinc/01/23/77/1420012377.db2.gz	PHDCLTNPTRLZBD-INIZCTEOSA-N	0	3	348.874	3.009	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cc(-c2ccccc2)on1)C(C)C	ZINC001715496440	1420177891	/nfs/dbraw/zinc/17/78/91/1420177891.db2.gz	MQSGHLUJEPQCAP-MRXNPFEDSA-N	0	3	347.846	3.438	20	30		EGEDHN
CCC(CC)C(=O)N[C@@H]1CCC[C@@H]1CNCc1ccccc1C#N	ZINC001715544915	1420242146	/nfs/dbraw/zinc/24/21/46/1420242146.db2.gz	GWHNLSALDZHZIW-RTBURBONSA-N	0	3	327.472	3.369	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H](C)CNCc2ccc(F)c(C#N)c2)c(C)c1	ZINC001715958192	1420424547	/nfs/dbraw/zinc/42/45/47/1420424547.db2.gz	NCEFNGQBCNAMFU-OAHLLOKOSA-N	0	3	339.414	3.222	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)NC(=O)C12CCC(CC1)CC2	ZINC001716464850	1420677476	/nfs/dbraw/zinc/67/74/76/1420677476.db2.gz	CHTWJTPTNUMPAI-VNSJNIRKSA-N	0	3	331.485	3.184	20	30		EGEDHN
CCCc1occc1C(=O)N[C@@H](C)CN(C)Cc1ccc(C#N)cc1	ZINC001716501956	1420729625	/nfs/dbraw/zinc/72/96/25/1420729625.db2.gz	YEGLWXCJYPPPML-HNNXBMFYSA-N	0	3	339.439	3.354	20	30		EGEDHN
CC(C)SCC(=O)N1CC[C@H](NCc2ccccc2C#N)C[C@@H]1C	ZINC001716757106	1420906974	/nfs/dbraw/zinc/90/69/74/1420906974.db2.gz	HSVRZDITTAKVED-YJBOKZPZSA-N	0	3	345.512	3.169	20	30		EGEDHN
CN(C(=O)CCC1CC1)[C@@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001717728415	1421595609	/nfs/dbraw/zinc/59/56/09/1421595609.db2.gz	JLHMUBSVQDWUGJ-IBGZPJMESA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@H]1C[C@@H](NCc2ccc(F)c(C#N)c2)CN1C(=O)CCC1(C)CC1	ZINC001717825135	1421640102	/nfs/dbraw/zinc/64/01/02/1421640102.db2.gz	BEUGHVNQODPQDL-WMLDXEAASA-N	0	3	343.446	3.357	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@](C)(CNCc3ccccc3C#N)C2)o1	ZINC001733416849	1429621586	/nfs/dbraw/zinc/62/15/86/1429621586.db2.gz	DIRGHLPPZCPWRV-HXUWFJFHSA-N	0	3	337.423	3.102	20	30		EGEDHN
Cc1cocc1C(=O)N(C)CCCN(C)Cc1ccc(F)c(C#N)c1	ZINC001724855324	1425225100	/nfs/dbraw/zinc/22/51/00/1425225100.db2.gz	VETYNTOXLNEEGL-UHFFFAOYSA-N	0	3	343.402	3.193	20	30		EGEDHN
CC(C)(C(=O)N[C@H]1CC[C@@H](CNCc2ccccc2C#N)C1)C(F)F	ZINC001725660305	1426342390	/nfs/dbraw/zinc/34/23/90/1426342390.db2.gz	KSSOEOCFYFASJL-CJNGLKHVSA-N	0	3	349.425	3.224	20	30		EGEDHN
C[C@@H](C#N)C(=O)N(C)C1CCN([C@H]2CCc3c2cccc3Cl)CC1	ZINC001731346923	1427284923	/nfs/dbraw/zinc/28/49/23/1427284923.db2.gz	SWKILUZXTLCYAG-UGSOOPFHSA-N	0	3	345.874	3.410	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1ccnc2ccncc21	ZINC001734018470	1437808097	/nfs/dbraw/zinc/80/80/97/1437808097.db2.gz	LIAKCBBOOJGBCQ-UHFFFAOYSA-N	0	3	346.862	3.070	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1cnn(C(C)(C)C)c1	ZINC001734019062	1437808516	/nfs/dbraw/zinc/80/85/16/1437808516.db2.gz	DJFQURQKGGCKRS-UHFFFAOYSA-N	0	3	340.899	3.078	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@@H](C)N(C)Cc2ccc(C#N)cc2)cc1F	ZINC001734043483	1437832023	/nfs/dbraw/zinc/83/20/23/1437832023.db2.gz	OCZSXLQESHHYCY-OAHLLOKOSA-N	0	3	339.414	3.256	20	30		EGEDHN
CN(C(=O)C(C)(C)C)[C@@H](CNCc1cc(C#N)ccc1F)C1CC1	ZINC001734310283	1438041055	/nfs/dbraw/zinc/04/10/55/1438041055.db2.gz	INVOZSRUARCWIN-KRWDZBQOSA-N	0	3	331.435	3.070	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1cc(C)nc(C)c1	ZINC001752146753	1440146165	/nfs/dbraw/zinc/14/61/65/1440146165.db2.gz	PBFLLLZWFDVRDU-DOTOQJQBSA-N	0	3	335.879	3.424	20	30		EGEDHN
CCN(CC#Cc1ccc(F)cc1)CCCNC(=O)[C@H](C)C1CCC1	ZINC001752189106	1440152131	/nfs/dbraw/zinc/15/21/31/1440152131.db2.gz	MQELDHZQZCCPSQ-QGZVFWFLSA-N	0	3	344.474	3.442	20	30		EGEDHN
CC#CCN(CCCNC(=O)C1C2CC3CC(C2)CC1C3)C1CC1	ZINC001752262357	1440162012	/nfs/dbraw/zinc/16/20/12/1440162012.db2.gz	WGRPYUCXKFYZNX-UHFFFAOYSA-N	0	3	328.500	3.053	20	30		EGEDHN
CC#CCCCC(=O)N(C)C1CCN(CCOc2ccccc2)CC1	ZINC001752303481	1440168263	/nfs/dbraw/zinc/16/82/63/1440168263.db2.gz	CDSJOKQGQLLAHS-UHFFFAOYSA-N	0	3	342.483	3.182	20	30		EGEDHN
C=CCOCCN1CCC(N(CCC)C(=O)c2cccc(F)c2)CC1	ZINC001752431454	1440178374	/nfs/dbraw/zinc/17/83/74/1440178374.db2.gz	GRGFSZXTLYWZIP-UHFFFAOYSA-N	0	3	348.462	3.345	20	30		EGEDHN
Cc1cccc(Cl)c1CN[C@H](CNC(=O)C#CC1CC1)C1CC1	ZINC001752465492	1440183972	/nfs/dbraw/zinc/18/39/72/1440183972.db2.gz	YIICEVBXKNPNMM-GOSISDBHSA-N	0	3	330.859	3.046	20	30		EGEDHN
CC(C)c1cccc(CN[C@@H](CNC(=O)C#CC(C)(C)C)C2CC2)n1	ZINC001752465560	1440183985	/nfs/dbraw/zinc/18/39/85/1440183985.db2.gz	ZVJHGBNQWJZJPC-IBGZPJMESA-N	0	3	341.499	3.239	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H](NCc1c(C)noc1CC)C1CC1	ZINC001752471814	1440184532	/nfs/dbraw/zinc/18/45/32/1440184532.db2.gz	FTBBNIQILNOPJI-MRXNPFEDSA-N	0	3	333.476	3.132	20	30		EGEDHN
CCCC(C)(C)C(=O)NC[C@@H](NCC#Cc1ccc(F)cc1)C1CC1	ZINC001752479921	1440185363	/nfs/dbraw/zinc/18/53/63/1440185363.db2.gz	ILIKGPKJIWMOIH-LJQANCHMSA-N	0	3	344.474	3.488	20	30		EGEDHN
C=C[C@@H](C(=O)NC[C@H](NCc1cncs1)C1CC1)c1ccccc1	ZINC001752500665	1440188357	/nfs/dbraw/zinc/18/83/57/1440188357.db2.gz	XLNAESSJFRWWOV-MSOLQXFVSA-N	0	3	341.480	3.097	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](OC)C1CCCC1	ZINC001752544558	1440195009	/nfs/dbraw/zinc/19/50/09/1440195009.db2.gz	BXLYOEHLSBUFRA-GDAAHCPNSA-N	0	3	334.504	3.222	20	30		EGEDHN
CC1(C)CCC(C(=O)N[C@H]2C[C@H](NCC#Cc3ccccc3)C2)CC1	ZINC001752687576	1440200087	/nfs/dbraw/zinc/20/00/87/1440200087.db2.gz	VBJWWPMAAFWFLL-MXVIHJGJSA-N	0	3	338.495	3.491	20	30		EGEDHN
C=CCOCCCC(=O)N1CCC[C@@H]2CN(C/C=C/Cl)CC[C@H]21	ZINC001752704286	1440202118	/nfs/dbraw/zinc/20/21/18/1440202118.db2.gz	CXADECYBTDTAPH-AQBSSDIKSA-N	0	3	340.895	3.035	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001752754496	1440205218	/nfs/dbraw/zinc/20/52/18/1440205218.db2.gz	TYSMOJUEZNMATL-RRQGHBQHSA-N	0	3	329.419	3.036	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@H]1CCCN(Cc2scnc2C)C1	ZINC001752784696	1440210599	/nfs/dbraw/zinc/21/05/99/1440210599.db2.gz	HRERAMBULAJDJZ-QGZVFWFLSA-N	0	3	347.528	3.363	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)CCCc2sccc2C)C1	ZINC001752788823	1440212822	/nfs/dbraw/zinc/21/28/22/1440212822.db2.gz	SARUVSZHDRLESD-KRWDZBQOSA-N	0	3	332.513	3.231	20	30		EGEDHN
CC(C)(C)/C=C/C(=O)N1CCC[C@H](CNCc2ccccc2C#N)C1	ZINC001752795715	1440214352	/nfs/dbraw/zinc/21/43/52/1440214352.db2.gz	YKYJZQVMJFCEKQ-SXSDINLZSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC[C@H](CNCc2nc(C)sc2C)C1	ZINC001752798991	1440214717	/nfs/dbraw/zinc/21/47/17/1440214717.db2.gz	KAIIWZOZTDCLFR-MRXNPFEDSA-N	0	3	335.517	3.444	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC[C@@H](CNCc2cnc(C)o2)C1	ZINC001752800320	1440214937	/nfs/dbraw/zinc/21/49/37/1440214937.db2.gz	XLBMOAFKOCLMSX-INIZCTEOSA-N	0	3	331.460	3.080	20	30		EGEDHN
CC(C)c1ccc(CN2CCCC[C@@H]2CNC(=O)[C@H](C)C#N)cc1	ZINC001752816977	1440218303	/nfs/dbraw/zinc/21/83/03/1440218303.db2.gz	SSEKQTLAUWVBRP-VQIMIIECSA-N	0	3	327.472	3.440	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@H]1CCCCN1Cc1ccc2cc[nH]c2c1	ZINC001752819391	1440219389	/nfs/dbraw/zinc/21/93/89/1440219389.db2.gz	VBBNZWUBFXLKBL-LJQANCHMSA-N	0	3	337.467	3.298	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@H]1CCCCN1CCc1cnn(CC)c1	ZINC001752822148	1440221294	/nfs/dbraw/zinc/22/12/94/1440221294.db2.gz	AKCBLDBOMIWRGI-GOSISDBHSA-N	0	3	346.519	3.019	20	30		EGEDHN
C#CCCCC(=O)N[C@H](C)[C@@H]1CCCN(Cc2ccccc2F)C1	ZINC001752838750	1440229114	/nfs/dbraw/zinc/22/91/14/1440229114.db2.gz	WMRKKLJYHKVELY-IAGOWNOFSA-N	0	3	330.447	3.346	20	30		EGEDHN
C=CCCOCC(=O)N[C@H](C)[C@@H]1CCCN(Cc2ccc(F)cc2)C1	ZINC001752841449	1440230726	/nfs/dbraw/zinc/23/07/26/1440230726.db2.gz	QSXRDCHXXSVQSZ-SJLPKXTDSA-N	0	3	348.462	3.135	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC1CCC(NCc2c(F)cccc2Cl)CC1	ZINC001752849168	1440233181	/nfs/dbraw/zinc/23/31/81/1440233181.db2.gz	ZTBCARAYYYUWOY-HIFPTAJRSA-N	0	3	337.826	3.156	20	30		EGEDHN
C=CCCC(=O)NC[C@H](C)NCc1cc(F)cc(Br)c1	ZINC001752863573	1440236117	/nfs/dbraw/zinc/23/61/17/1440236117.db2.gz	BCUPCLWXFJYOLD-NSHDSACASA-N	0	3	343.240	3.149	20	30		EGEDHN
C[C@@H](CNC(=O)c1cc(Cl)cs1)NCc1ccc(C#N)s1	ZINC001752903563	1440243580	/nfs/dbraw/zinc/24/35/80/1440243580.db2.gz	QTYBVLDVRRBRCF-VIFPVBQESA-N	0	3	339.873	3.243	20	30		EGEDHN
C[C@H](CNC(=O)CC#Cc1ccccc1)NCc1cc2ccccc2o1	ZINC001752920886	1440248351	/nfs/dbraw/zinc/24/83/51/1440248351.db2.gz	IDEHNWFNKSPIOF-QGZVFWFLSA-N	0	3	346.430	3.469	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CCC[C@H](NCc2oc(CCC)nc2C)C1	ZINC001752964688	1440253966	/nfs/dbraw/zinc/25/39/66/1440253966.db2.gz	GVCQKFYJXSOUEI-HOTGVXAUSA-N	0	3	333.476	3.419	20	30		EGEDHN
Cc1nc(C(C)C)oc1CN[C@H]1CCC[C@@H](NC(=O)C#CC(C)C)C1	ZINC001752967587	1440254382	/nfs/dbraw/zinc/25/43/82/1440254382.db2.gz	GPGCAFBVGQMEQX-DLBZAZTESA-N	0	3	345.487	3.283	20	30		EGEDHN
Cc1csc(C(=O)NCC[C@@H](C)NCc2ccccc2C#N)c1	ZINC001753004960	1440265517	/nfs/dbraw/zinc/26/55/17/1440265517.db2.gz	UUHFRLCQSNWAMN-CQSZACIVSA-N	0	3	327.453	3.226	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H]2CCCNC(=O)C2CCC2)c(F)c1	ZINC001753021837	1440270236	/nfs/dbraw/zinc/27/02/36/1440270236.db2.gz	GKPQZVIRZCIPHM-GOSISDBHSA-N	0	3	343.446	3.358	20	30		EGEDHN
CC(C)C#CC(=O)NCCC[C@H]1CCCN1Cc1cccc(F)c1F	ZINC001753028509	1440272182	/nfs/dbraw/zinc/27/21/82/1440272182.db2.gz	ICXFIOLPUXOXNX-KRWDZBQOSA-N	0	3	348.437	3.485	20	30		EGEDHN
CCN(CCNC(=O)c1cccc(F)c1F)Cc1ccc(C#N)cc1	ZINC001753087592	1440297368	/nfs/dbraw/zinc/29/73/68/1440297368.db2.gz	KBEKYTHLYQEIPQ-UHFFFAOYSA-N	0	3	343.377	3.088	20	30		EGEDHN
C#CCCCC(=O)NC[C@H]1CCN(Cc2ccc(C(C)C)nc2C)C1	ZINC001753122284	1440314141	/nfs/dbraw/zinc/31/41/41/1440314141.db2.gz	JMFGYMVDAFAAGL-GOSISDBHSA-N	0	3	341.499	3.255	20	30		EGEDHN
CCCN(CCNC(=O)C#CC1CC1)Cc1cccc(OC(C)C)c1	ZINC001753143083	1440322699	/nfs/dbraw/zinc/32/26/99/1440322699.db2.gz	IGIJVLNSWXLRTB-UHFFFAOYSA-N	0	3	342.483	3.215	20	30		EGEDHN
CCCN(CCNC(=O)c1cc(C)co1)Cc1ccc(F)c(C#N)c1	ZINC001753146607	1440324656	/nfs/dbraw/zinc/32/46/56/1440324656.db2.gz	AZEWQUPXHLHSIS-UHFFFAOYSA-N	0	3	343.402	3.241	20	30		EGEDHN
C=CCOCC(=O)NCCN(C1CC1)[C@@H]1CCc2ccc(Cl)cc21	ZINC001753152998	1440329295	/nfs/dbraw/zinc/32/92/95/1440329295.db2.gz	RJBXJZODPSDSJG-GOSISDBHSA-N	0	3	348.874	3.111	20	30		EGEDHN
Cc1ccc(F)c(C(=O)N(C)CCNCc2ccc(C#N)c(F)c2)c1	ZINC001753236188	1440341730	/nfs/dbraw/zinc/34/17/30/1440341730.db2.gz	UHAZWMVPNLPOAL-UHFFFAOYSA-N	0	3	343.377	3.007	20	30		EGEDHN
C=C(C)CN[C@H](CNC(=O)Cc1ccc2n[nH]cc2c1)c1ccccc1	ZINC001753300540	1440353907	/nfs/dbraw/zinc/35/39/07/1440353907.db2.gz	VOCGYQAYRXAYRT-HXUWFJFHSA-N	0	3	348.450	3.129	20	30		EGEDHN
C=CCN[C@H](CNC(=O)Cc1cn(C)c2ccccc12)c1ccccc1	ZINC001753301656	1440354251	/nfs/dbraw/zinc/35/42/51/1440354251.db2.gz	NCZYHDPBUQSQOI-HXUWFJFHSA-N	0	3	347.462	3.354	20	30		EGEDHN
C=C(C)CN[C@@H](CNC(=O)COc1ccc(F)cc1)c1ccccc1	ZINC001753302662	1440354527	/nfs/dbraw/zinc/35/45/27/1440354527.db2.gz	HRKVGKLBJCVAMK-IBGZPJMESA-N	0	3	342.414	3.228	20	30		EGEDHN
C=C(C)CN[C@@H](CNC(=O)c1sccc1OC)c1ccccc1	ZINC001753303006	1440354672	/nfs/dbraw/zinc/35/46/72/1440354672.db2.gz	NLHUTEQYTBNHCS-HNNXBMFYSA-N	0	3	330.453	3.394	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CCC)C(=O)c2ncn3ccc(C)cc23)C1	ZINC001753317652	1440360690	/nfs/dbraw/zinc/36/06/90/1440360690.db2.gz	SLKFYVOCOXNIMR-KRWDZBQOSA-N	0	3	340.471	3.145	20	30		EGEDHN
C=CCOCCN1CC[C@@H](N(CCC)C(=O)[C@H]2CCC(C)(C)C2)C1	ZINC001753329201	1440368195	/nfs/dbraw/zinc/36/81/95/1440368195.db2.gz	WOXBSIQMYFUHRB-ZWKOTPCHSA-N	0	3	336.520	3.328	20	30		EGEDHN
COCC#CCN1CC[C@H](CCNC(=O)C[C@@H]2CCCCC2(C)C)C1	ZINC001753341359	1440375644	/nfs/dbraw/zinc/37/56/44/1440375644.db2.gz	WHKWFYLFKMSOEA-OALUTQOASA-N	0	3	348.531	3.071	20	30		EGEDHN
COCC#CCN1CC[C@H](CCNC(=O)C[C@H]2CCCCC2(C)C)C1	ZINC001753341360	1440375723	/nfs/dbraw/zinc/37/57/23/1440375723.db2.gz	WHKWFYLFKMSOEA-RBUKOAKNSA-N	0	3	348.531	3.071	20	30		EGEDHN
C=CC1(CC(=O)NCC2CN(C[C@@H]3CC(C)(C)CO3)C2)CCCCC1	ZINC001753412215	1440393498	/nfs/dbraw/zinc/39/34/98/1440393498.db2.gz	JAHHQBGYVLBGSV-SFHVURJKSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=CC1(CC(=O)NCC2CN(C[C@H]3CC[C@H](C)O3)C2)CCCCC1	ZINC001753412978	1440393605	/nfs/dbraw/zinc/39/36/05/1440393605.db2.gz	WGLDHBZCNLUJLC-FUHWJXTLSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCCCN1C[C@@H]2C[C@H]1CN2C(=O)c1cccc2scnc21	ZINC001753420805	1440395356	/nfs/dbraw/zinc/39/53/56/1440395356.db2.gz	LGZWQENMCOXGEB-KBPBESRZSA-N	0	3	327.453	3.161	20	30		EGEDHN
C=CCCCN1C[C@@H]2C[C@H]1CN2C(=O)c1sccc1-n1cccc1	ZINC001753422751	1440395760	/nfs/dbraw/zinc/39/57/60/1440395760.db2.gz	JWQFVLVRFVBDFB-HOTGVXAUSA-N	0	3	341.480	3.404	20	30		EGEDHN
C=CCCCN1C[C@@H]2C[C@H]1CN2C(=O)c1nccc2ccsc21	ZINC001753422474	1440395820	/nfs/dbraw/zinc/39/58/20/1440395820.db2.gz	YKRNFFNCELDDIT-GJZGRUSLSA-N	0	3	327.453	3.161	20	30		EGEDHN
C#CCC1(C(=O)N(C)[C@@H]2CCN(C[C@@H]3CCCCO3)C2)CCCCC1	ZINC001753449417	1440405524	/nfs/dbraw/zinc/40/55/24/1440405524.db2.gz	FXFZPOORIPHCSE-MOPGFXCFSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=CCCC(=O)N(CC)[C@H]1CCN(C[C@H](OC)c2ccccc2)C1	ZINC001753452859	1440406847	/nfs/dbraw/zinc/40/68/47/1440406847.db2.gz	GSEUIICEDKQOKA-OALUTQOASA-N	0	3	330.472	3.263	20	30		EGEDHN
C=C(C)CCC(=O)N(CC)[C@@H]1CCN(C[C@@H](O)c2ccc(F)cc2)C1	ZINC001753457129	1440408637	/nfs/dbraw/zinc/40/86/37/1440408637.db2.gz	KEZHYERXWUZRIG-RTBURBONSA-N	0	3	348.462	3.138	20	30		EGEDHN
CC[C@H](CNC(=O)c1ccc(C)s1)NCc1ccc(C#N)s1	ZINC001753463580	1440412035	/nfs/dbraw/zinc/41/20/35/1440412035.db2.gz	GAFKSCZSYUWNLW-GFCCVEGCSA-N	0	3	333.482	3.288	20	30		EGEDHN
CC[C@@H](CNC(=O)C(C)=C1CCC1)NCc1cc(C#N)ccc1OC	ZINC001753471249	1440414102	/nfs/dbraw/zinc/41/41/02/1440414102.db2.gz	IPJPHCZBNOSSEH-SFHVURJKSA-N	0	3	341.455	3.052	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H](CC)NCC=C(Cl)Cl)cc1	ZINC001753481809	1440416829	/nfs/dbraw/zinc/41/68/29/1440416829.db2.gz	YUZHRCCQFXRWJX-AWEZNQCLSA-N	0	3	325.239	3.085	20	30		EGEDHN
CC[C@@H](CNC(=O)[C@H](C)C1CCCC1)NCC#Cc1ccc(F)cc1	ZINC001753492429	1440419983	/nfs/dbraw/zinc/41/99/83/1440419983.db2.gz	NKOUVQUFBMPKTJ-UZLBHIALSA-N	0	3	344.474	3.488	20	30		EGEDHN
C=CCCC(=O)N[C@]1(CNCc2oc(C)nc2C)CCCC[C@H]1C	ZINC001753532084	1440431316	/nfs/dbraw/zinc/43/13/16/1440431316.db2.gz	QSBNFMWAQLVFJI-KUHUBIRLSA-N	0	3	333.476	3.412	20	30		EGEDHN
C#CCCCCC(=O)N[C@@]1(CNCc2conc2C)CCCC[C@@H]1C	ZINC001753531951	1440431330	/nfs/dbraw/zinc/43/13/30/1440431330.db2.gz	PCKMECYORHCVGV-OXJNMPFZSA-N	0	3	345.487	3.331	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CCCN(C(=O)C(C)(C)C)C1	ZINC001753558351	1440436341	/nfs/dbraw/zinc/43/63/41/1440436341.db2.gz	AVGFLCIYANRDSU-ZDUSSCGKSA-N	0	3	331.298	3.159	20	30		EGEDHN
C[C@H](CNCC#Cc1ccccc1Cl)N(C)C(=O)C1CC=CC1	ZINC001753684023	1440465153	/nfs/dbraw/zinc/46/51/53/1440465153.db2.gz	WPLNWSRMZHDKFP-OAHLLOKOSA-N	0	3	330.859	3.094	20	30		EGEDHN
C[C@H](CNCC#Cc1ccc(F)cc1)N(C)C(=O)C(C1CC1)C1CC1	ZINC001753720416	1440472917	/nfs/dbraw/zinc/47/29/17/1440472917.db2.gz	ZPAYJAYRNXJTTO-OAHLLOKOSA-N	0	3	342.458	3.050	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H](C)[C@H]1CNCc1c(C)nsc1C	ZINC001753806002	1440491689	/nfs/dbraw/zinc/49/16/89/1440491689.db2.gz	UUQIHBBOECZCRZ-CXAGYDPISA-N	0	3	335.517	3.443	20	30		EGEDHN
C#CCCCCC(=O)N1CCC(CCN(C)Cc2cc(C)no2)CC1	ZINC001753818677	1440495065	/nfs/dbraw/zinc/49/50/65/1440495065.db2.gz	ZFEFLXRDGSAVPR-UHFFFAOYSA-N	0	3	345.487	3.237	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H](C)[C@@H]1CNCc1ccnc(Cl)c1	ZINC001753818951	1440495093	/nfs/dbraw/zinc/49/50/93/1440495093.db2.gz	NYULBRNTJZCHBZ-RDJZCZTQSA-N	0	3	347.890	3.255	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)C[C@H](C)c1c(C)n[nH]c1C)C(C)C	ZINC001753834157	1440500425	/nfs/dbraw/zinc/50/04/25/1440500425.db2.gz	IVFNUGVVBXTSTA-NHYWBVRUSA-N	0	3	340.899	3.003	20	30		EGEDHN
CCCCC(=O)N1CC[C@@H]2[C@@H](CCN2CC#Cc2ccc(F)cc2)C1	ZINC001753886291	1440521291	/nfs/dbraw/zinc/52/12/91/1440521291.db2.gz	UXLATHXMIKMKMC-AZUAARDMSA-N	0	3	342.458	3.290	20	30		EGEDHN
C[C@@H](CCNCc1cc(C#N)ccc1F)NC(=O)C1C(C)(C)C1(C)C	ZINC001753954154	1440525649	/nfs/dbraw/zinc/52/56/49/1440525649.db2.gz	FTDJCJIIIFVMLC-ZDUSSCGKSA-N	0	3	345.462	3.364	20	30		EGEDHN
CCCC1(C(=O)N(CC)CCNCc2cccc(C#N)c2)CCC1	ZINC001754062861	1440537100	/nfs/dbraw/zinc/53/71/00/1440537100.db2.gz	RTWQMXLZVMBTSH-UHFFFAOYSA-N	0	3	327.472	3.467	20	30		EGEDHN
CCN(CCNCc1cccc(C#N)c1)C(=O)[C@H]1C[C@@H]1c1ccccc1	ZINC001754071157	1440538106	/nfs/dbraw/zinc/53/81/06/1440538106.db2.gz	YDHHYXURZMXYSY-RTWAWAEBSA-N	0	3	347.462	3.300	20	30		EGEDHN
N#Cc1cccc(CNC/C=C/CNC(=O)c2cccc(Cl)c2)c1	ZINC001754198300	1440549769	/nfs/dbraw/zinc/54/97/69/1440549769.db2.gz	UBZHGGLCPAMMPV-OWOJBTEDSA-N	0	3	339.826	3.287	20	30		EGEDHN
Cc1cc(C(=O)NC/C=C\CNCc2cccc(C#N)c2)sc1C	ZINC001754205132	1440550532	/nfs/dbraw/zinc/55/05/32/1440550532.db2.gz	YVYJDJGFHCKWRW-ARJAWSKDSA-N	0	3	339.464	3.312	20	30		EGEDHN
C=C[C@@H](C(=O)NC/C=C/CNCc1cccc(C#N)c1)c1ccccc1	ZINC001754209117	1440550988	/nfs/dbraw/zinc/55/09/88/1440550988.db2.gz	DWKSCLGWVJZDQH-IRUYWQDXSA-N	0	3	345.446	3.290	20	30		EGEDHN
C[C@H](CNCC#Cc1ccc(Cl)cc1)NC(=O)/C=C\C(C)(C)C	ZINC001754220252	1440552518	/nfs/dbraw/zinc/55/25/18/1440552518.db2.gz	CJIAHCNUNITQJY-QYMJWVLRSA-N	0	3	332.875	3.388	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H](C)CNCc2ccc(F)c(C#N)c2)c(F)c1	ZINC001754246420	1440556983	/nfs/dbraw/zinc/55/69/83/1440556983.db2.gz	CLMGDSWKIVGOJD-CYBMUJFWSA-N	0	3	343.377	3.053	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccc(F)cc1)NC(=O)[C@H]1CCC=CCCC1	ZINC001754272948	1440561777	/nfs/dbraw/zinc/56/17/77/1440561777.db2.gz	YLKPQLKBQOFRSV-HKUYNNGSSA-N	0	3	342.458	3.408	20	30		EGEDHN
C=CCN(C)C[C@@H](C)NC(=O)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC001754308568	1440572117	/nfs/dbraw/zinc/57/21/17/1440572117.db2.gz	BUEOGXGORKWNKZ-UWMJVVDFSA-N	0	3	332.410	3.224	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)[C@H](C)c1cccs1	ZINC001754324560	1440579679	/nfs/dbraw/zinc/57/96/79/1440579679.db2.gz	ACTSXBLSSUIXGJ-LSDHHAIUSA-N	0	3	341.480	3.360	20	30		EGEDHN
O=C(CC1CCC1)N[C@@H](CNCC#Cc1ccccc1Cl)C1CC1	ZINC001754436591	1440598210	/nfs/dbraw/zinc/59/82/10/1440598210.db2.gz	BNIVRPCSSPZNOI-IBGZPJMESA-N	0	3	344.886	3.366	20	30		EGEDHN
C#CCCCC(=O)N[C@@H](CNCc1cccc(Cl)c1F)C1CC1	ZINC001754439617	1440598848	/nfs/dbraw/zinc/59/88/48/1440598848.db2.gz	GJWOXSQBLILSGZ-INIZCTEOSA-N	0	3	336.838	3.267	20	30		EGEDHN
CC[C@H]1CN(C(=O)C#CC(C)C)CC[C@H]1NCc1nc(C)sc1C	ZINC001754464799	1440604010	/nfs/dbraw/zinc/60/40/10/1440604010.db2.gz	MNQJOMZVYYOKKG-DLBZAZTESA-N	0	3	347.528	3.136	20	30		EGEDHN
C=CCCCN1CC[C@@H]1CNC(=O)[C@]1(C)CCc2ccccc2C1	ZINC001754505032	1440615971	/nfs/dbraw/zinc/61/59/71/1440615971.db2.gz	PCIQBUGGMNFBGW-TZIWHRDSSA-N	0	3	326.484	3.338	20	30		EGEDHN
C[C@H]1CCC[C@]1(C)C(=O)NCC1(NCc2ccc(C#N)c(F)c2)CC1	ZINC001754523951	1440620419	/nfs/dbraw/zinc/62/04/19/1440620419.db2.gz	NTMLOLHHCRBCNE-LIRRHRJNSA-N	0	3	343.446	3.262	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)CCC(F)(F)F)C1	ZINC001754537835	1440625231	/nfs/dbraw/zinc/62/52/31/1440625231.db2.gz	DZNDVPRNILAXMQ-GJZGRUSLSA-N	0	3	330.394	3.055	20	30		EGEDHN
CC1(CCC(=O)N2CCC[C@H]2CNCc2ccc(C#N)c(F)c2)CC1	ZINC001754619207	1440644939	/nfs/dbraw/zinc/64/49/39/1440644939.db2.gz	SEDOSVBCDHFFDJ-KRWDZBQOSA-N	0	3	343.446	3.358	20	30		EGEDHN
C#CCN(C(=O)C[C@H]1CCC(C)(C)CO1)C1CCN(CC(=C)C)CC1	ZINC001754638224	1440648762	/nfs/dbraw/zinc/64/87/62/1440648762.db2.gz	QGCIALRHRCINHO-LJQANCHMSA-N	0	3	346.515	3.084	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](NC(=O)CC2CC2)C2CCCC2)c(F)c1	ZINC001754643514	1440649408	/nfs/dbraw/zinc/64/94/08/1440649408.db2.gz	AJOKYRYKXYZKCZ-IBGZPJMESA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H](CNCc2ccccn2)C2CCCC2)C1	ZINC001754649866	1440651606	/nfs/dbraw/zinc/65/16/06/1440651606.db2.gz	JMFQEFGJIYTFST-GOSISDBHSA-N	0	3	327.472	3.203	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@@](C)(CNCc2ccccc2C#N)C1	ZINC001754686451	1440665127	/nfs/dbraw/zinc/66/51/27/1440665127.db2.gz	DTIVNOCMGDTJDS-FQEVSTJZSA-N	0	3	327.472	3.323	20	30		EGEDHN
CC/C=C(/C)C(=O)N1CC[C@@](C)(CNCc2ccccc2C#N)C1	ZINC001754688768	1440665790	/nfs/dbraw/zinc/66/57/90/1440665790.db2.gz	BQGQXNBTADMYOE-YYFKYVOKSA-N	0	3	325.456	3.243	20	30		EGEDHN
C[C@]1(CNCc2ccccc2C#N)CCN(C(=O)CCCC2CC2)C1	ZINC001754703826	1440668496	/nfs/dbraw/zinc/66/84/96/1440668496.db2.gz	VLRPJEWQTQGRPY-OAQYLSRUSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@](C)(CN[C@@H](C)c3cnccn3)C2)CC1	ZINC001754704972	1440668909	/nfs/dbraw/zinc/66/89/09/1440668909.db2.gz	SRZJDACIYMVDPB-OXJNMPFZSA-N	0	3	342.487	3.112	20	30		EGEDHN
C/C=C(/C)C(=O)NC[C@@]1(C)CCCN(Cc2cccc(C#N)c2)C1	ZINC001754725258	1440675512	/nfs/dbraw/zinc/67/55/12/1440675512.db2.gz	KINJFQTZKVQKHH-RNBALMJFSA-N	0	3	325.456	3.243	20	30		EGEDHN
CC#CCN1CCC[C@@](C)(CNC(=O)[C@@H](CC)CC(F)(F)F)C1	ZINC001754731361	1440679485	/nfs/dbraw/zinc/67/94/85/1440679485.db2.gz	FBMIFHPPAVHMJW-HOCLYGCPSA-N	0	3	332.410	3.207	20	30		EGEDHN
CC#CCN1CCC[C@](C)(CNC(=O)[C@@H](C)Cc2ccc(C)cc2)C1	ZINC001754735324	1440682040	/nfs/dbraw/zinc/68/20/40/1440682040.db2.gz	ZEMIWCBVKKWBPL-SIKLNZKXSA-N	0	3	340.511	3.415	20	30		EGEDHN
CC(C)=CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(Cc1ccc(C#N)cc1F)C2	ZINC001754780581	1440686278	/nfs/dbraw/zinc/68/62/78/1440686278.db2.gz	UBUBPMNVOXVGQD-JQHSSLGASA-N	0	3	341.430	3.133	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@H](C)[C@H](CNCc2nc(C)sc2C)C1	ZINC001754809931	1440691871	/nfs/dbraw/zinc/69/18/71/1440691871.db2.gz	AGQWGKRIZDYULE-WMLDXEAASA-N	0	3	347.528	3.138	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2Cc1conc1C	ZINC001754831575	1440695662	/nfs/dbraw/zinc/69/56/62/1440695662.db2.gz	GWVYTMQRXKJAIH-ZAWLATJESA-N	0	3	345.487	3.445	20	30		EGEDHN
C=C(C)CN1CCC(N(Cc2ccccn2)C(=O)C=C(C)C)CC1	ZINC001754839232	1440697430	/nfs/dbraw/zinc/69/74/30/1440697430.db2.gz	IORQZCJVFCNSFL-UHFFFAOYSA-N	0	3	327.472	3.417	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@]2(CO)CCCN(CC/C=C\CC)C2)CC1	ZINC001754858392	1440700378	/nfs/dbraw/zinc/70/03/78/1440700378.db2.gz	ZJGXJHQHLMPFMP-FBQMEGEOSA-N	0	3	334.504	3.032	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@]1(CO)CCCN(Cc2cccc(C)c2)C1	ZINC001754857298	1440700578	/nfs/dbraw/zinc/70/05/78/1440700578.db2.gz	DIFNYDWBZRWOCU-RXVVDRJESA-N	0	3	344.499	3.040	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@@H]2[C@@H]1CCN2CCc1ccns1	ZINC001754869548	1440704683	/nfs/dbraw/zinc/70/46/83/1440704683.db2.gz	YWOOBHNMPVNXIH-SJORKVTESA-N	0	3	333.501	3.107	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@@H]2[C@H]1CCN2CCc1ccns1	ZINC001754869546	1440704695	/nfs/dbraw/zinc/70/46/95/1440704695.db2.gz	YWOOBHNMPVNXIH-IAGOWNOFSA-N	0	3	333.501	3.107	20	30		EGEDHN
C=C(Br)CNCC[C@H]1CCN(C(=O)/C(C)=C\CC)C1	ZINC001754905096	1440707577	/nfs/dbraw/zinc/70/75/77/1440707577.db2.gz	ATDVXPRZDLZDGS-VDFGQWLZSA-N	0	3	329.282	3.080	20	30		EGEDHN
CC[C@@H](C)CC(=O)N1CC[C@@H](CCNCc2cc(C#N)ccc2F)C1	ZINC001754913108	1440708263	/nfs/dbraw/zinc/70/82/63/1440708263.db2.gz	SEXZIXLBTLIFAE-HZPDHXFCSA-N	0	3	345.462	3.462	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCN(C(=O)c2cc3ccccc3n2C)C1	ZINC001754929561	1440710347	/nfs/dbraw/zinc/71/03/47/1440710347.db2.gz	NYFAPUMKWRVNNT-OAHLLOKOSA-N	0	3	345.874	3.373	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCN(C(=O)c2cc3ccccn3c2)C1	ZINC001754933811	1440711002	/nfs/dbraw/zinc/71/10/02/1440711002.db2.gz	BRGYFCWMRKIAOG-OAHLLOKOSA-N	0	3	331.847	3.134	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCN(C(=O)c2cc3ccccn3c2)C1	ZINC001754933810	1440711021	/nfs/dbraw/zinc/71/10/21/1440711021.db2.gz	BRGYFCWMRKIAOG-HNNXBMFYSA-N	0	3	331.847	3.134	20	30		EGEDHN
CC#CCN[C@H](C)c1ccc(CNC(=O)Cc2ccccc2F)cc1	ZINC001754951381	1440715106	/nfs/dbraw/zinc/71/51/06/1440715106.db2.gz	RSHJZGGGCHIBMW-MRXNPFEDSA-N	0	3	338.426	3.359	20	30		EGEDHN
CC#CC[NH+]1CCC(CCCCCNC(=O)c2ccccc2[O-])CC1	ZINC001755074984	1440748051	/nfs/dbraw/zinc/74/80/51/1440748051.db2.gz	UBZWQHOHIISBLW-UHFFFAOYSA-N	0	3	342.483	3.418	20	30		EGEDHN
C=CCCCN1Cc2ccccc2C[C@@H]1CNC(=O)Cc1cccnc1	ZINC001755075632	1440748335	/nfs/dbraw/zinc/74/83/35/1440748335.db2.gz	KSGFSRNRAWEGOG-OAQYLSRUSA-N	0	3	349.478	3.133	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccoc2C2CC2)C[C@@H]1NCC#Cc1ccccc1	ZINC001755113439	1440754560	/nfs/dbraw/zinc/75/45/60/1440754560.db2.gz	HKIULAZUNOENJE-UZLBHIALSA-N	0	3	348.446	3.259	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1CCN(Cc2ncccc2C)CC1(C)C	ZINC001755141852	1440760845	/nfs/dbraw/zinc/76/08/45/1440760845.db2.gz	KFHMJQDUGUIESU-SFHVURJKSA-N	0	3	329.488	3.463	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)COc2cccc(CC)c2)C(C)(C)C1	ZINC001755143795	1440762271	/nfs/dbraw/zinc/76/22/71/1440762271.db2.gz	PTCVENHWLILWFJ-SFHVURJKSA-N	0	3	330.472	3.031	20	30		EGEDHN
C=CCCCN1CCOC2(CCN(C(=O)C[C@@H]3C[C@H]3C3CC3)CC2)C1	ZINC001755173804	1440770149	/nfs/dbraw/zinc/77/01/49/1440770149.db2.gz	BHDYMOWGQUIUSX-OALUTQOASA-N	0	3	346.515	3.082	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H]1CN(C)Cc1cccc2nsnc21	ZINC001755188352	1440773840	/nfs/dbraw/zinc/77/38/40/1440773840.db2.gz	DFBLNARUKZEWBW-HNNXBMFYSA-N	0	3	344.484	3.080	20	30		EGEDHN
C=CC1(CC(=O)NC2CC(CNCc3ocnc3C)C2)CCCCC1	ZINC001755217339	1440784199	/nfs/dbraw/zinc/78/41/99/1440784199.db2.gz	GEZVIKWRJZQAKR-UHFFFAOYSA-N	0	3	345.487	3.494	20	30		EGEDHN
C[C@H](NCC#Cc1cccc(Cl)c1)[C@H](C)NC(=O)C1CCCC1	ZINC001755225209	1440785762	/nfs/dbraw/zinc/78/57/62/1440785762.db2.gz	YYWARCHCAGGTOZ-GJZGRUSLSA-N	0	3	332.875	3.365	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H](C)[C@H](C)NCC#Cc1ccc(Cl)cc1	ZINC001755249569	1440791555	/nfs/dbraw/zinc/79/15/55/1440791555.db2.gz	QXWBTXDVRVXMKC-GJZGRUSLSA-N	0	3	332.875	3.387	20	30		EGEDHN
C=CCC(C)(C)C(=O)N(C)C1CCC(NCc2cnc(C)cn2)CC1	ZINC001755275944	1440798995	/nfs/dbraw/zinc/79/89/95/1440798995.db2.gz	MLZSRAJSOQGCDV-UHFFFAOYSA-N	0	3	344.503	3.247	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)C[C@@H]1CC[C@@H](C2CC2)O1	ZINC001755282708	1440801049	/nfs/dbraw/zinc/80/10/49/1440801049.db2.gz	CEIJQAMUOQVGRM-HOTGVXAUSA-N	0	3	342.911	3.161	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@H](C)N(C)[C@H]1CCc2c1cc(F)cc2F	ZINC001755297732	1440807213	/nfs/dbraw/zinc/80/72/13/1440807213.db2.gz	CMDWRZMJJOMUNS-UGSOOPFHSA-N	0	3	334.410	3.048	20	30		EGEDHN
C[C@H](CNC(=O)C#CC1CC1)N(C)[C@H](C)c1ccc(F)c(Cl)c1	ZINC001755299889	1440808075	/nfs/dbraw/zinc/80/80/75/1440808075.db2.gz	IFFZIUTTYKVURI-CHWSQXEVSA-N	0	3	336.838	3.390	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC1(CNCc2cc(C)ncn2)CCCCC1	ZINC001755351224	1440827865	/nfs/dbraw/zinc/82/78/65/1440827865.db2.gz	USUAWIBTDLWMGA-UHFFFAOYSA-N	0	3	344.503	3.296	20	30		EGEDHN
C#Cc1ccc(C(=O)NC2(CNCC(=C)Cl)CCCCC2)cc1	ZINC001755353783	1440828684	/nfs/dbraw/zinc/82/86/84/1440828684.db2.gz	WZKBSEZMXLUUDZ-UHFFFAOYSA-N	0	3	330.859	3.443	20	30		EGEDHN
C[C@@H](C(=O)NC[C@H]1CCCCCN1Cc1ccc(C#N)cc1)C1CC1	ZINC001755365013	1440833914	/nfs/dbraw/zinc/83/39/14/1440833914.db2.gz	OEBDJENGVCBIER-OXQOHEQNSA-N	0	3	339.483	3.465	20	30		EGEDHN
Cc1cc(CN2C[C@@H](NC(=O)C#CC(C)C)C(C)(C)C2)c(C)s1	ZINC001755408659	1440845277	/nfs/dbraw/zinc/84/52/77/1440845277.db2.gz	SYILGNDPRUKFHT-QGZVFWFLSA-N	0	3	332.513	3.351	20	30		EGEDHN
Cc1cc(CN2C[C@@H](NC(=O)C#CC3CC3)C(C)(C)C2)c(C)s1	ZINC001755409243	1440845404	/nfs/dbraw/zinc/84/54/04/1440845404.db2.gz	YCRFKUSRNOEYCG-QGZVFWFLSA-N	0	3	330.497	3.105	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)[C@@H](C)CCc2ccccc2F)C(C)(C)C1	ZINC001755412374	1440846757	/nfs/dbraw/zinc/84/67/57/1440846757.db2.gz	UCMBABYIANBDKW-QFBILLFUSA-N	0	3	344.474	3.244	20	30		EGEDHN
C=C1CCC(C(=O)N2CC3(C2)CCCN(CCOCC2CC2)C3)CC1	ZINC001755458109	1440856576	/nfs/dbraw/zinc/85/65/76/1440856576.db2.gz	ZTJQUSXZOHNWPN-UHFFFAOYSA-N	0	3	346.515	3.084	20	30		EGEDHN
C/C(=C\C(=O)N[C@H]1C[C@H](CNCc2cc(C#N)ccc2F)C1)C1CC1	ZINC001755466038	1440858290	/nfs/dbraw/zinc/85/82/90/1440858290.db2.gz	FISHBTIWOBPRBQ-ZTRSUEEBSA-N	0	3	341.430	3.038	20	30		EGEDHN
C=C(Br)CNCCC[C@@H](C)NC(=O)c1cc(Cl)c[nH]1	ZINC001755489238	1440861183	/nfs/dbraw/zinc/86/11/83/1440861183.db2.gz	XPNLYOGXLHUVNT-SNVBAGLBSA-N	0	3	348.672	3.065	20	30		EGEDHN
C=C(Cl)CNCCC[C@H](C)NC(=O)c1cc2ccccc2c(=O)o1	ZINC001755502548	1440862757	/nfs/dbraw/zinc/86/27/57/1440862757.db2.gz	YSKAYCFLCAJJOX-ZDUSSCGKSA-N	0	3	348.830	3.034	20	30		EGEDHN
C[C@H](CCCNCc1cc(C#N)ccc1F)NC(=O)[C@]1(C)C=CCC1	ZINC001755510851	1440863624	/nfs/dbraw/zinc/86/36/24/1440863624.db2.gz	JCONUKXSPJGGJQ-FOIQADDNSA-N	0	3	343.446	3.428	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H]1C(=O)N(C)C[C@H](C)NCc1ccc(F)c(C#N)c1	ZINC001755605064	1440885300	/nfs/dbraw/zinc/88/53/00/1440885300.db2.gz	COVSSJRMPXMHAY-YXJHDRRASA-N	0	3	345.462	3.316	20	30		EGEDHN
C=CCC(C)(C)C(=O)N(C)C[C@H](C)NCc1cn(C(C)C)nc1C	ZINC001755608191	1440886422	/nfs/dbraw/zinc/88/64/22/1440886422.db2.gz	ZVTVDTIZIPASRW-HNNXBMFYSA-N	0	3	334.508	3.311	20	30		EGEDHN
C[C@@H](CN(C)C(=O)CC#Cc1ccccc1)NCc1ccsc1	ZINC001755618885	1440889756	/nfs/dbraw/zinc/88/97/56/1440889756.db2.gz	PJCAJKSREGCSKG-INIZCTEOSA-N	0	3	326.465	3.126	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](NCc2ncccc2C)[C@H]1C	ZINC001755654029	1440891708	/nfs/dbraw/zinc/89/17/08/1440891708.db2.gz	KHJPBSKPKBYCNR-SJLPKXTDSA-N	0	3	327.472	3.237	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@@H](NCc2cc(Cl)ccc2F)[C@H]1C	ZINC001755653888	1440891715	/nfs/dbraw/zinc/89/17/15/1440891715.db2.gz	LPZHVDVNOFFBFU-CXAGYDPISA-N	0	3	336.838	3.218	20	30		EGEDHN
C#CCN1CC[C@]2(NC(=O)CCc3ccc(Cl)cc3)CCC[C@H]12	ZINC001755703298	1440901257	/nfs/dbraw/zinc/90/12/57/1440901257.db2.gz	WSLYTKZJXYFIFW-PKOBYXMFSA-N	0	3	330.859	3.019	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@]12CCC[C@H]1N(Cc1cccnc1)CC2	ZINC001755703509	1440901318	/nfs/dbraw/zinc/90/13/18/1440901318.db2.gz	YIKRDPQFJOZSNI-XLIONFOSSA-N	0	3	327.472	3.297	20	30		EGEDHN
C#CCN1CC[C@]2(NC(=O)C[C@H](C)c3ccc(F)cc3)CCC[C@H]12	ZINC001755705314	1440902567	/nfs/dbraw/zinc/90/25/67/1440902567.db2.gz	WZFQRISWTXCFOC-ZAAXVRCTSA-N	0	3	328.431	3.066	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CCCN(CCn2nc(C)cc2C)[C@H]1C	ZINC001755720026	1440906715	/nfs/dbraw/zinc/90/67/15/1440906715.db2.gz	CDDLAHCCSJAKHA-ZWKOTPCHSA-N	0	3	346.519	3.071	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](NCc2ccc(F)c(C#N)c2)C(C)(C)C1	ZINC001755756203	1440914089	/nfs/dbraw/zinc/91/40/89/1440914089.db2.gz	AMKMPSJRCBEFHO-GOSISDBHSA-N	0	3	343.446	3.380	20	30		EGEDHN
CCc1occc1C(=O)N(C)C1CC(NCC#Cc2ccccc2)C1	ZINC001755856183	1440935789	/nfs/dbraw/zinc/93/57/89/1440935789.db2.gz	OZGYJKQDNVISEN-UHFFFAOYSA-N	0	3	336.435	3.086	20	30		EGEDHN
C=C[C@@H](C(=O)N(C)C1CC(NCc2ncccc2C)C1)c1ccccc1	ZINC001755865540	1440937714	/nfs/dbraw/zinc/93/77/14/1440937714.db2.gz	HUIBKANBPWTABO-SOAGJPPSSA-N	0	3	349.478	3.439	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(OC)c(-c2nnn[n-]2)c1	ZINC001573325446	947359805	/nfs/dbraw/zinc/35/98/05/947359805.db2.gz	CGOPYAMDAWLJTK-KRWDZBQOSA-N	0	3	349.438	3.152	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)[NH2+]Cc1ccc(OC)c(-c2nn[n-]n2)c1	ZINC001573325446	947359818	/nfs/dbraw/zinc/35/98/18/947359818.db2.gz	CGOPYAMDAWLJTK-KRWDZBQOSA-N	0	3	349.438	3.152	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)[NH2+]Cc1ccc(-c2nnn[n-]2)c(OC)c1	ZINC001573325895	947365578	/nfs/dbraw/zinc/36/55/78/947365578.db2.gz	HXAAVCOXPPLKAP-QGZVFWFLSA-N	0	3	349.438	3.152	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)[NH2+]Cc1ccc(-c2nn[n-]n2)c(OC)c1	ZINC001573325895	947365590	/nfs/dbraw/zinc/36/55/90/947365590.db2.gz	HXAAVCOXPPLKAP-QGZVFWFLSA-N	0	3	349.438	3.152	20	30		EGEDHN
COc1ccc(C#N)cc1CN[C@H](C)[C@@H]1OCCc2sccc21	ZINC000368637591	168377527	/nfs/dbraw/zinc/37/75/27/168377527.db2.gz	YNACYRGFWLRMPE-XIKOKIGWSA-N	0	3	328.437	3.420	20	30		EGEDHN
COc1ccc(CN[C@H](C)c2ccc3c(c2)CCC(=O)N3)cc1C#N	ZINC000174276216	231164180	/nfs/dbraw/zinc/16/41/80/231164180.db2.gz	ZTPBTYIAQOBIIH-CYBMUJFWSA-N	0	3	335.407	3.302	20	30		EGEDHN
CC[C@H](C)CN(CC)CC(=O)Nc1c(C#N)cnn1-c1ccccc1	ZINC000177854282	529657368	/nfs/dbraw/zinc/65/73/68/529657368.db2.gz	BSSGYQDVPOQGLF-HNNXBMFYSA-N	0	3	339.443	3.050	20	30		EGEDHN
COC(=O)c1cccc(C(=O)C(C#N)c2ccc(C(F)(F)F)cn2)c1	ZINC000048829188	213967816	/nfs/dbraw/zinc/96/78/16/213967816.db2.gz	BYCSLCXOIIBXCS-ZDUSSCGKSA-N	0	3	348.280	3.377	20	30		EGEDHN
CN1CCC(NC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)CC1	ZINC000103186279	219267139	/nfs/dbraw/zinc/26/71/39/219267139.db2.gz	UKRIJZMLGVGJFT-UHFFFAOYSA-N	0	3	335.407	3.175	20	30		EGEDHN
C[C@H](N[C@H]1CC(=O)N(c2c(F)cccc2F)C1)c1cccc(C#N)c1	ZINC000181916108	234380023	/nfs/dbraw/zinc/38/00/23/234380023.db2.gz	IIIDWVNGUJXGDI-WFASDCNBSA-N	0	3	341.361	3.293	20	30		EGEDHN
N#Cc1cccc(CNC(=O)N[C@@H](CN2CCCC2)c2ccccc2)c1	ZINC000077789863	283206554	/nfs/dbraw/zinc/20/65/54/283206554.db2.gz	JCVQDIJHRSPWNA-FQEVSTJZSA-N	0	3	348.450	3.195	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)[C@H](C)c2cc(F)ccc2F)CC1	ZINC000264335089	246366683	/nfs/dbraw/zinc/36/66/83/246366683.db2.gz	GNXUAHKOIYMICL-CYBMUJFWSA-N	0	3	337.414	3.318	20	30		EGEDHN
CC#CCN1CCC(C(=O)Nc2cccc(Br)c2)CC1	ZINC000266022797	248037614	/nfs/dbraw/zinc/03/76/14/248037614.db2.gz	WYIJZJZAWHAKTF-UHFFFAOYSA-N	0	3	335.245	3.123	20	30		EGEDHN
Cc1nc([C@H](C)NC2CCN(c3ccc(C#N)cn3)CC2)cs1	ZINC000378199239	169084774	/nfs/dbraw/zinc/08/47/74/169084774.db2.gz	ISCMTCLYBNBOQG-LBPRGKRZSA-N	0	3	327.457	3.038	20	30		EGEDHN
Cc1ccc(N2CC[C@@H](N[C@H](C)c3ccc(OCC#N)cc3)C2=O)cc1	ZINC000095404409	218339671	/nfs/dbraw/zinc/33/96/71/218339671.db2.gz	BSPIDVVDIRSPGK-OXQOHEQNSA-N	0	3	349.434	3.354	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1	ZINC000153299498	224085081	/nfs/dbraw/zinc/08/50/81/224085081.db2.gz	PTIGYXVKRBIUSK-IBGZPJMESA-N	0	3	337.379	3.164	20	30		EGEDHN
Cn1nc(C(C)(C)C)cc1C(=O)C(C#N)c1nc2ccccc2n1C	ZINC000097466027	219026605	/nfs/dbraw/zinc/02/66/05/219026605.db2.gz	XXLVMBUQHYJQED-LBPRGKRZSA-N	0	3	335.411	3.094	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)Nc1ccc(N2CCN(CC)CC2)cc1C	ZINC000069322523	258006120	/nfs/dbraw/zinc/00/61/20/258006120.db2.gz	GCHSFXQDDKACCR-QGZVFWFLSA-N	0	3	345.487	3.057	20	30		EGEDHN
C[C@@H](N[C@H]1CCCN(c2ccc(C#N)cc2F)C1)c1cncs1	ZINC000160150660	533542644	/nfs/dbraw/zinc/54/26/44/533542644.db2.gz	WIYLRHYATNKFAS-OCCSQVGLSA-N	0	3	330.432	3.473	20	30		EGEDHN
Cc1sc(NC(=O)CN[C@H]2CCCO[C@@H]2CC(C)C)c(C#N)c1C	ZINC000186389059	144132021	/nfs/dbraw/zinc/13/20/21/144132021.db2.gz	CJAYCMSBZDOGID-JKSUJKDBSA-N	0	3	349.500	3.358	20	30		EGEDHN
CCO[C@@H]1C[C@H](NCc2cc(C#N)cs2)[C@@H]1Oc1ccccc1	ZINC000187637580	144161992	/nfs/dbraw/zinc/16/19/92/144161992.db2.gz	HTKBSLHUTGZMHC-KSZLIROESA-N	0	3	328.437	3.334	20	30		EGEDHN
COCC#CCN1CCCC[C@H]1CCc1ccc(OC)c(OC)c1	ZINC000677817989	549337047	/nfs/dbraw/zinc/33/70/47/549337047.db2.gz	DQTSQJRUXCRUET-SFHVURJKSA-N	0	3	331.456	3.141	20	30		EGEDHN
CSc1ccc([C@@H](CNC(=O)c2ccc(C#N)s2)N(C)C)cc1	ZINC000341491613	155321856	/nfs/dbraw/zinc/32/18/56/155321856.db2.gz	ZLHBMELINHNXFL-OAHLLOKOSA-N	0	3	345.493	3.374	20	30		EGEDHN
C[C@@H](N[C@@H]1[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]21)c1ccc(C#N)cc1	ZINC000302083805	154025509	/nfs/dbraw/zinc/02/55/09/154025509.db2.gz	FUZDCHGFCLLCCT-VZEFYGNVSA-N	0	3	327.428	3.074	20	30		EGEDHN
N#Cc1csc(CNCCOc2cccc(C(F)(F)F)n2)c1	ZINC000340107740	155100611	/nfs/dbraw/zinc/10/06/11/155100611.db2.gz	XVZLMHIYCGKGEP-UHFFFAOYSA-N	0	3	327.331	3.202	20	30		EGEDHN
N#Cc1ncccc1N1CC[C@@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000368667839	157257219	/nfs/dbraw/zinc/25/72/19/157257219.db2.gz	TUFSBYHWCNLNRC-NRFANRHFSA-N	0	3	332.451	3.446	20	30		EGEDHN
COC(=O)[C@H]1CN(Cc2cc(C#N)cs2)C[C@H]1c1ccccc1	ZINC000343636581	164000091	/nfs/dbraw/zinc/00/00/91/164000091.db2.gz	IZXHYSZKGWOLDX-IRXDYDNUSA-N	0	3	326.421	3.008	20	30		EGEDHN
CN(CCCN(C)c1cc(C#N)ccc1[N+](=O)[O-])Cc1ccco1	ZINC000343884237	164058044	/nfs/dbraw/zinc/05/80/44/164058044.db2.gz	ZHEYOARVJCVVPJ-UHFFFAOYSA-N	0	3	328.372	3.018	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)CCn1cc(Br)cn1	ZINC000344222924	164129739	/nfs/dbraw/zinc/12/97/39/164129739.db2.gz	MBUPPNFFKXVGBO-GFCCVEGCSA-N	0	3	333.233	3.210	20	30		EGEDHN
CN(C)Cc1ccc(-c2noc(COc3ccc(C#N)cc3)n2)cc1	ZINC000355592936	166253951	/nfs/dbraw/zinc/25/39/51/166253951.db2.gz	CRSDFVBOFADPOZ-UHFFFAOYSA-N	0	3	334.379	3.249	20	30		EGEDHN
CN(CCNc1ccc(C#N)c([N+](=O)[O-])c1)Cc1ccc(F)cc1	ZINC000357502209	166696352	/nfs/dbraw/zinc/69/63/52/166696352.db2.gz	KLXHZRUECZKYSI-UHFFFAOYSA-N	0	3	328.347	3.149	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N[C@@H](CN(C)C)c1ccc(F)cc1	ZINC000359819662	167240250	/nfs/dbraw/zinc/24/02/50/167240250.db2.gz	KWSOHHGAJULFRO-SFHVURJKSA-N	0	3	325.387	3.039	20	30		EGEDHN
Cc1ccc(CN(CCN(C)C)C(=O)[C@H](C)c2cccc(C#N)c2)o1	ZINC000360329857	167304434	/nfs/dbraw/zinc/30/44/34/167304434.db2.gz	UXIKBBTXEPMAGH-MRXNPFEDSA-N	0	3	339.439	3.154	20	30		EGEDHN
N#Cc1ccc2c(c1)CCCC[C@@H]2NCc1ccc(OCCO)cc1	ZINC000360659122	167381903	/nfs/dbraw/zinc/38/19/03/167381903.db2.gz	WUUMMUVBHUQMBS-NRFANRHFSA-N	0	3	336.435	3.487	20	30		EGEDHN
CN(C)[C@H]1Cc2ccccc2N(C(=O)c2cc(C#N)ccc2Cl)C1	ZINC000367588378	168245726	/nfs/dbraw/zinc/24/57/26/168245726.db2.gz	WLSYQIBGXWKCJU-HNNXBMFYSA-N	0	3	339.826	3.345	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)c(F)c1)c1cccc(N2CCOCC2)c1	ZINC000453370152	269879739	/nfs/dbraw/zinc/87/97/39/269879739.db2.gz	FQBSZZXIYGVUDL-HNNXBMFYSA-N	0	3	339.414	3.385	20	30		EGEDHN
N#Cc1ccc(CNCc2ccc(N3CCC(CO)CC3)cc2)s1	ZINC000176954299	270038651	/nfs/dbraw/zinc/03/86/51/270038651.db2.gz	RRNOFJZKAATQHT-UHFFFAOYSA-N	0	3	341.480	3.118	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H](c3nnc4n3CCCCC4)C2)cc1	ZINC000298229867	270043019	/nfs/dbraw/zinc/04/30/19/270043019.db2.gz	YEANLDKFLCBYKW-SFHVURJKSA-N	0	3	335.455	3.256	20	30		EGEDHN
Cc1ccc(F)c(CCNC(=O)C(C#N)Cc2ccc(C#N)cc2)c1	ZINC000456340760	270054283	/nfs/dbraw/zinc/05/42/83/270054283.db2.gz	ZFZKJLKTECFXOR-GOSISDBHSA-N	0	3	335.382	3.047	20	30		EGEDHN
N#Cc1ccc(N2CC[C@H](N3CC[C@@H](Cc4ccccc4)C3)C2=O)cc1	ZINC000533293198	270060963	/nfs/dbraw/zinc/06/09/63/270060963.db2.gz	BNRBJSKYEPYFDK-FPOVZHCZSA-N	0	3	345.446	3.228	20	30		EGEDHN
CCC(CC)(CNCc1cc(C#N)n(C)c1)NC(=O)OC(C)(C)C	ZINC000191255263	266000787	/nfs/dbraw/zinc/00/07/87/266000787.db2.gz	OGJUAQHCBWNUQH-UHFFFAOYSA-N	0	3	334.464	3.070	20	30		EGEDHN
CCC1(CC)[C@@H](NCC(=O)Nc2sc(C)c(C)c2C#N)C[C@@H]1OC	ZINC000191374837	266011502	/nfs/dbraw/zinc/01/15/02/266011502.db2.gz	AYGDGLKRPGORLA-GJZGRUSLSA-N	0	3	349.500	3.358	20	30		EGEDHN
CCC1(CC)[C@H](NCC(=O)Nc2sc(C)c(C)c2C#N)C[C@@H]1OC	ZINC000191374818	266013323	/nfs/dbraw/zinc/01/33/23/266013323.db2.gz	AYGDGLKRPGORLA-CABCVRRESA-N	0	3	349.500	3.358	20	30		EGEDHN
CCN(CCc1ccccc1)C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000279729751	266131251	/nfs/dbraw/zinc/13/12/51/266131251.db2.gz	NLOIBHCBYHFZAA-HXUWFJFHSA-N	0	3	331.419	3.332	20	30		EGEDHN
CCS[C@@H]1CCC[C@H]1NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000280499897	266345787	/nfs/dbraw/zinc/34/57/87/266345787.db2.gz	QTPTXUSJJMDNTJ-GVDBMIGSSA-N	0	3	327.453	3.031	20	30		EGEDHN
CCS[C@@H]1CCC[C@@H]1N[C@@H](C)C(=O)Nc1oc(C)c(C)c1C#N	ZINC000286013131	266346486	/nfs/dbraw/zinc/34/64/86/266346486.db2.gz	GYEBOVMFBBLANA-TUKIKUTGSA-N	0	3	335.473	3.359	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@H](CNCc1ccc(C#N)c(F)c1)C1CC1	ZINC000496046796	266869498	/nfs/dbraw/zinc/86/94/98/266869498.db2.gz	VIVNAVFYLRCLEX-MRXNPFEDSA-N	0	3	333.407	3.090	20	30		EGEDHN
CC(C)(C)O[C@@H]1C[C@@H](NCc2cc(C#N)cs2)[C@H]1n1cccn1	ZINC000449653324	266872801	/nfs/dbraw/zinc/87/28/01/266872801.db2.gz	BZHNQBZRVGJMQD-BZUAXINKSA-N	0	3	330.457	3.103	20	30		EGEDHN
CCCCNC(=O)C1(NCCOc2ccc(C#N)cc2)CCCCC1	ZINC000440901724	267009060	/nfs/dbraw/zinc/00/90/60/267009060.db2.gz	YYNNHMOPOIGOHS-UHFFFAOYSA-N	0	3	343.471	3.146	20	30		EGEDHN
N#Cc1cc(F)c(NCc2ccccc2CN2CC[C@H](O)C2)c(F)c1	ZINC000273268236	267009150	/nfs/dbraw/zinc/00/91/50/267009150.db2.gz	WPTAUWIDRVNGHR-INIZCTEOSA-N	0	3	343.377	3.015	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1Nc1nc2ccccn2c1C#N	ZINC000302175222	267055151	/nfs/dbraw/zinc/05/51/51/267055151.db2.gz	NYTUHYAIWTWTCQ-WBVHZDCISA-N	0	3	331.423	3.138	20	30		EGEDHN
CCOC(=O)N1CCC([C@@H](C)NCc2cccc(C#N)c2F)CC1	ZINC000495575426	267122473	/nfs/dbraw/zinc/12/24/73/267122473.db2.gz	RKXQTQHRZUNAIU-CYBMUJFWSA-N	0	3	333.407	3.044	20	30		EGEDHN
CCOC(=O)N1CCC[C@H]([C@@H](C)NCc2cc(C#N)ccc2F)C1	ZINC000495521676	267123728	/nfs/dbraw/zinc/12/37/28/267123728.db2.gz	WUMHNDUYGTXZLX-HIFRSBDPSA-N	0	3	333.407	3.044	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)NC[C@H]1N(C)CCCC1(C)C	ZINC000448015056	267167828	/nfs/dbraw/zinc/16/78/28/267167828.db2.gz	FBOPZSHTKMPQIB-QGZVFWFLSA-N	0	3	344.459	3.199	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)NC[C@@H]1N(C)CCCC1(C)C	ZINC000448015055	267168483	/nfs/dbraw/zinc/16/84/83/267168483.db2.gz	FBOPZSHTKMPQIB-KRWDZBQOSA-N	0	3	344.459	3.199	20	30		EGEDHN
CC[C@@H](N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O)c1ccncc1	ZINC000453200718	267198454	/nfs/dbraw/zinc/19/84/54/267198454.db2.gz	VSNRGZNDVKIIOF-MOPGFXCFSA-N	0	3	334.423	3.190	20	30		EGEDHN
C[C@H](c1ccc(C#N)cc1)N1CCC(c2nnc3n2CCCC3)CC1	ZINC000330166988	267207094	/nfs/dbraw/zinc/20/70/94/267207094.db2.gz	VLRDIRIKAAYHFP-OAHLLOKOSA-N	0	3	335.455	3.427	20	30		EGEDHN
C[C@H]1[C@@H](NC(=O)NCc2ccc(C#N)cc2)CCN1Cc1ccccc1	ZINC000287083046	267251058	/nfs/dbraw/zinc/25/10/58/267251058.db2.gz	MAXNHPOPXDOIRO-JXFKEZNVSA-N	0	3	348.450	3.020	20	30		EGEDHN
CN(C)C[C@H](NC(=O)/C=C/c1cccc(C#N)c1)c1ccc(F)cc1	ZINC000493001815	267281889	/nfs/dbraw/zinc/28/18/89/267281889.db2.gz	CRUDOVGHQKAIIN-NJGYHNCTSA-N	0	3	337.398	3.130	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@]12C[C@@H]1CN(C(=O)OC(C)(C)C)C2	ZINC000497128996	267319454	/nfs/dbraw/zinc/31/94/54/267319454.db2.gz	KSRQCHNCCMJXCH-YLJYHZDGSA-N	0	3	341.455	3.247	20	30		EGEDHN
CN1CCCN(Cc2cccc(OCc3ccccc3C#N)c2)CC1	ZINC000435244243	267333396	/nfs/dbraw/zinc/33/33/96/267333396.db2.gz	CIRDMPGOLPFGDQ-UHFFFAOYSA-N	0	3	335.451	3.275	20	30		EGEDHN
N#Cc1ccc(CNCC2CCN(CC(F)(F)F)CC2)c(F)c1	ZINC000275463414	268072663	/nfs/dbraw/zinc/07/26/63/268072663.db2.gz	HZRMVBFMKMQZMH-UHFFFAOYSA-N	0	3	329.341	3.061	20	30		EGEDHN
Cc1nc2ccccc2n1C[C@H]1CCCN1Cc1ccc(C#N)cn1	ZINC000515496322	268080201	/nfs/dbraw/zinc/08/02/01/268080201.db2.gz	MSAKEAHUIRVPBI-GOSISDBHSA-N	0	3	331.423	3.276	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCC2(Cc3ccccc3)CC2)cc1	ZINC000279852436	268085801	/nfs/dbraw/zinc/08/58/01/268085801.db2.gz	BDGFDSHJPSCELL-FQEVSTJZSA-N	0	3	343.430	3.380	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@H]([NH2+][C@H]3CCc4cccc([O-])c43)C2=O)cc1	ZINC000296360902	268115575	/nfs/dbraw/zinc/11/55/75/268115575.db2.gz	IAIQYTLLDWNMCL-ROUUACIJSA-N	0	3	347.418	3.036	20	30		EGEDHN
N#Cc1ccc(NC(=O)CN[C@H](CCO)C2CCCCC2)cc1Cl	ZINC000181512460	268141296	/nfs/dbraw/zinc/14/12/96/268141296.db2.gz	LYIWTSOVCZQXLO-QGZVFWFLSA-N	0	3	349.862	3.071	20	30		EGEDHN
N#Cc1ccc([N+](=O)[O-])c(NCCCN2CCc3ccccc3C2)c1	ZINC000302199389	268217007	/nfs/dbraw/zinc/21/70/07/268217007.db2.gz	GNMLYKYJTGPXOQ-UHFFFAOYSA-N	0	3	336.395	3.327	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](NC[C@@H]3C[C@H]3c3ccccc3)C2=O)cc1	ZINC000521205901	268222984	/nfs/dbraw/zinc/22/29/84/268222984.db2.gz	GWMXSJPNVASDPI-PCCBWWKXSA-N	0	3	345.446	3.052	20	30		EGEDHN
N#Cc1cccc(C#N)c1NCC1(N2CCSCC2)CCCC1	ZINC000302831119	268235161	/nfs/dbraw/zinc/23/51/61/268235161.db2.gz	KXUXBVODDGCVSB-UHFFFAOYSA-N	0	3	326.469	3.203	20	30		EGEDHN
N#Cc1cccc(Cl)c1NC[C@H](O)CN1CCc2ccccc2C1	ZINC000301532509	268256729	/nfs/dbraw/zinc/25/67/29/268256729.db2.gz	PXZBRKFRVSOECC-KRWDZBQOSA-N	0	3	341.842	3.043	20	30		EGEDHN
N#Cc1cccc(OC2CCN(CCN3CCc4ccccc43)CC2)c1	ZINC000428252357	268283414	/nfs/dbraw/zinc/28/34/14/268283414.db2.gz	HGLZQFNAWFELJZ-UHFFFAOYSA-N	0	3	347.462	3.464	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CN(C1CC1)[C@H]1CCc2ccccc21	ZINC000528410315	268299341	/nfs/dbraw/zinc/29/93/41/268299341.db2.gz	LBBOZNDEQMQIEK-CTNGQTDRSA-N	0	3	348.446	3.450	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CN[C@H]1CCc2c1cccc2Cl	ZINC000530230715	268304857	/nfs/dbraw/zinc/30/48/57/268304857.db2.gz	IRTNQUWPFLSYPR-KDOFPFPSSA-N	0	3	342.826	3.228	20	30		EGEDHN
C[C@@H](CNC(=O)Nc1ccc(F)c(C#N)c1)N(C)Cc1ccccc1	ZINC000111756592	275185027	/nfs/dbraw/zinc/18/50/27/275185027.db2.gz	GVYHCCAWNULEKJ-AWEZNQCLSA-N	0	3	340.402	3.339	20	30		EGEDHN
CN1CC=C(CNc2c(C#N)cnc3c(F)c(F)c(F)cc32)CC1	ZINC000286450715	276002712	/nfs/dbraw/zinc/00/27/12/276002712.db2.gz	JMXFWTNWNBSMDZ-UHFFFAOYSA-N	0	3	332.329	3.198	20	30		EGEDHN
CCN1CCCC[C@H]1CNC(=O)N(Cc1ccc(C#N)cc1)C1CC1	ZINC000171776821	276159858	/nfs/dbraw/zinc/15/98/58/276159858.db2.gz	LUMJTPHQICFMJO-IBGZPJMESA-N	0	3	340.471	3.107	20	30		EGEDHN
CNC(=O)[C@@H](Cc1c[nH]c2ccccc12)N[C@@H](C)c1ccc(C#N)cc1	ZINC000344092031	277240377	/nfs/dbraw/zinc/24/03/77/277240377.db2.gz	CPUHGUPWEQKWFU-VBKZILBWSA-N	0	3	346.434	3.047	20	30		EGEDHN
CS[C@H]1CN(c2cc(C#N)ccc2C(F)(F)F)C[C@@H]1N(C)C	ZINC000345351272	278167651	/nfs/dbraw/zinc/16/76/51/278167651.db2.gz	ROLFHAHJGOIHRY-KBPBESRZSA-N	0	3	329.391	3.059	20	30		EGEDHN
Cc1c(C#N)cccc1NC(=O)N[C@H](CN(C)C)c1ccc(F)cc1	ZINC000350151263	278584235	/nfs/dbraw/zinc/58/42/35/278584235.db2.gz	HIPAVSRNANNPDU-GOSISDBHSA-N	0	3	340.402	3.430	20	30		EGEDHN
CSCC[C@H](C)N(C)[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000248708276	308009621	/nfs/dbraw/zinc/00/96/21/308009621.db2.gz	BJJGGWUDWUGOJF-YOEHRIQHSA-N	0	3	331.485	3.127	20	30		EGEDHN
N#Cc1cnn2cc(CNCC3(c4ccc(Cl)cc4)CC3)cnc12	ZINC000551050708	315140504	/nfs/dbraw/zinc/14/05/04/315140504.db2.gz	BCZNASONVVRRFK-UHFFFAOYSA-N	0	3	337.814	3.076	20	30		EGEDHN
CN1CCN(CCCOc2cccc(C#N)c2)C[C@@H]1Cc1ccccc1	ZINC000551406513	315152918	/nfs/dbraw/zinc/15/29/18/315152918.db2.gz	MGSRHSRWIXAFJF-NRFANRHFSA-N	0	3	349.478	3.186	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2NC[C@@H](O)COc1ccc(F)cc1	ZINC000552970219	315239272	/nfs/dbraw/zinc/23/92/72/315239272.db2.gz	PDTOXMADNOOLAE-YLJYHZDGSA-N	0	3	340.398	3.104	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2NC[C@@H](O)COc1ccc(F)cc1	ZINC000552970218	315239526	/nfs/dbraw/zinc/23/95/26/315239526.db2.gz	PDTOXMADNOOLAE-XLIONFOSSA-N	0	3	340.398	3.104	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CNCc2csc3ccccc23)cc1	ZINC000554869947	315353250	/nfs/dbraw/zinc/35/32/50/315353250.db2.gz	YUUVHZFQVZJLRR-MRXNPFEDSA-N	0	3	338.432	3.302	20	30		EGEDHN
Cc1cc(C#N)cnc1C(=O)Nc1ccccc1NC1CCN(C)CC1	ZINC000559450505	315634089	/nfs/dbraw/zinc/63/40/89/315634089.db2.gz	RWGOGTPVFPMHMZ-UHFFFAOYSA-N	0	3	349.438	3.020	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1F)c1snc(Cl)c1C#N	ZINC000092681729	454610315	/nfs/dbraw/zinc/61/03/15/454610315.db2.gz	QOVSVPOKBCIYAG-UHFFFAOYSA-N	0	3	338.839	3.375	20	30		EGEDHN
N#Cc1cccc(CNC[C@@H](O)CO[C@H]2CCCc3ccccc32)c1	ZINC000564844036	316215813	/nfs/dbraw/zinc/21/58/13/316215813.db2.gz	HSYFGJOMYNUCLZ-CTNGQTDRSA-N	0	3	336.435	3.103	20	30		EGEDHN
N#Cc1cccc(C2(NC(=O)Nc3cccc4c3CCNC4)CC2)c1	ZINC000565939639	316391695	/nfs/dbraw/zinc/39/16/95/316391695.db2.gz	CYEKKICBWWLIJG-UHFFFAOYSA-N	0	3	332.407	3.015	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN[C@H]2CCc3c2cccc3Cl)cc1	ZINC000566059648	316409452	/nfs/dbraw/zinc/40/94/52/316409452.db2.gz	QLLCMUXSNBVYNJ-KUHUBIRLSA-N	0	3	342.826	3.228	20	30		EGEDHN
C[C@H]1C[C@H](C(C)(C)C)CCN1CC(=O)NCc1ccc(C#N)cc1	ZINC000570072175	317004469	/nfs/dbraw/zinc/00/44/69/317004469.db2.gz	QHICJOSIMVUYLK-MAUKXSAKSA-N	0	3	327.472	3.321	20	30		EGEDHN
N#CCSCCCN1CCC[C@@H](n2ccc(C(F)(F)F)n2)C1	ZINC000182839716	455174950	/nfs/dbraw/zinc/17/49/50/455174950.db2.gz	RTBBCPCPIXCAIO-GFCCVEGCSA-N	0	3	332.395	3.186	20	30		EGEDHN
CC(C)(NC[C@@H](O)COc1ccc(C#N)cc1)c1cccc(Cl)c1	ZINC000179605919	323395916	/nfs/dbraw/zinc/39/59/16/323395916.db2.gz	BAYBDNJNLCEVRL-QGZVFWFLSA-N	0	3	344.842	3.476	20	30		EGEDHN
COCCCC[C@@H](NCc1cnc2c(C#N)cnn2c1)c1ccccc1	ZINC000582242071	325425552	/nfs/dbraw/zinc/42/55/52/325425552.db2.gz	XTHDGNRXGWDNCR-LJQANCHMSA-N	0	3	349.438	3.249	20	30		EGEDHN
COC(=O)CCN(CC#Cc1ccc(C(F)(F)F)cc1)C(C)C	ZINC000427022317	457936646	/nfs/dbraw/zinc/93/66/46/457936646.db2.gz	XESMBFYBNFBNFV-UHFFFAOYSA-N	0	3	327.346	3.330	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC2CCC(CSC)CC2)CC1	ZINC000454471856	458563340	/nfs/dbraw/zinc/56/33/40/458563340.db2.gz	ZUQXRGWUFPKEGC-UHFFFAOYSA-N	0	3	339.549	3.248	20	30		EGEDHN
N#Cc1cccc(CNCc2ccc(NC(=O)c3ccncc3)cc2)c1	ZINC000237970721	455239573	/nfs/dbraw/zinc/23/95/73/455239573.db2.gz	QCZBVXYSSDXAGO-UHFFFAOYSA-N	0	3	342.402	3.495	20	30		EGEDHN
CCN(CC)C(=O)CCC1CCN(Cc2ccc(C#N)s2)CC1	ZINC000180769051	455242113	/nfs/dbraw/zinc/24/21/13/455242113.db2.gz	GTZSWOQZRWQVTO-UHFFFAOYSA-N	0	3	333.501	3.480	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H]2CC[C@H](Cc3ccccc3)C2)CC1	ZINC000189887467	455250298	/nfs/dbraw/zinc/25/02/98/455250298.db2.gz	NPNDFZKBHRJBQX-QUCCMNQESA-N	0	3	341.499	3.347	20	30		EGEDHN
C=CCc1cc(CN(CCO)Cc2ccc(C)cc2)cc(OC)c1O	ZINC000180844397	455254459	/nfs/dbraw/zinc/25/44/59/455254459.db2.gz	YNQASMMWYMVOFY-UHFFFAOYSA-N	0	3	341.451	3.432	20	30		EGEDHN
N#CCCCNCc1sc(N2CCOCC2)nc1-c1ccccc1	ZINC000612194934	460563707	/nfs/dbraw/zinc/56/37/07/460563707.db2.gz	ZDRFAHHCWGUOIB-UHFFFAOYSA-N	0	3	342.468	3.040	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@H]2C[C@H](O)C2(C)C)cc1OC	ZINC000623496763	460580394	/nfs/dbraw/zinc/58/03/94/460580394.db2.gz	JLXOAFWJMGRSGE-GJZGRUSLSA-N	0	3	325.836	3.162	20	30		EGEDHN
CN(Cc1cccc(Cl)c1)C[C@@H](O)COc1ccc(CC#N)cc1	ZINC000025867044	453788258	/nfs/dbraw/zinc/78/82/58/453788258.db2.gz	ASLHVCSWKLHZBR-GOSISDBHSA-N	0	3	344.842	3.278	20	30		EGEDHN
CC(C)[C@H](CNC(=O)C1(C#N)CCCC1)N1CCc2ccccc2C1	ZINC000025918503	453789835	/nfs/dbraw/zinc/78/98/35/453789835.db2.gz	WBNBZMUOEAKJLT-IBGZPJMESA-N	0	3	339.483	3.269	20	30		EGEDHN
C[C@@H](CNc1ccc([N+](=O)[O-])cc1C#N)N1CCc2ccccc2C1	ZINC000026729773	453804653	/nfs/dbraw/zinc/80/46/53/453804653.db2.gz	VQSFRJIFDZGDQK-AWEZNQCLSA-N	0	3	336.395	3.325	20	30		EGEDHN
C[C@@H](NC[C@@H](O)COCc1ccccc1Cl)c1ccc(C#N)cc1	ZINC000030532593	453836423	/nfs/dbraw/zinc/83/64/23/453836423.db2.gz	SCIOCXKQNQPYMY-RDTXWAMCSA-N	0	3	344.842	3.440	20	30		EGEDHN
CN(C)[C@@H](CNC(=O)/C=C/c1ccc(OCC#N)cc1)c1ccccc1	ZINC000031436736	453847518	/nfs/dbraw/zinc/84/75/18/453847518.db2.gz	VHYHVSJNHJQKHG-YPNIWSFNSA-N	0	3	349.434	3.021	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)c1ccc(C#N)c(C)n1)c1ccsc1	ZINC000031983575	453859653	/nfs/dbraw/zinc/85/96/53/453859653.db2.gz	BVOCYAWNHOXDTP-QGZVFWFLSA-N	0	3	342.468	3.136	20	30		EGEDHN
CN(CC#Cc1ccc(OC(F)(F)F)cc1)C[C@@H]1CCC[C@@H]1O	ZINC000159522865	455382661	/nfs/dbraw/zinc/38/26/61/455382661.db2.gz	YINARAFSTUNFJK-HOCLYGCPSA-N	0	3	327.346	3.030	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N[C@@H](CN1CCCCC1)c1ccccc1	ZINC000075630650	453912666	/nfs/dbraw/zinc/91/26/66/453912666.db2.gz	JBBHGOZJEZHIBL-HKUYNNGSSA-N	0	3	330.472	3.311	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@@H](C)N2CCC(C)CC2)cc1OC	ZINC000067271571	453916403	/nfs/dbraw/zinc/91/64/03/453916403.db2.gz	ZCTJEZOMKUIUQZ-MRXNPFEDSA-N	0	3	346.471	3.110	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2ccc(C#N)cc2)C1	ZINC000054720027	453944460	/nfs/dbraw/zinc/94/44/60/453944460.db2.gz	PPGFTGDBKKBEIT-JXFKEZNVSA-N	0	3	348.450	3.193	20	30		EGEDHN
C#Cc1cccc(NC(=O)NC2CCN(CCc3ccccc3)CC2)c1	ZINC000076097276	453963416	/nfs/dbraw/zinc/96/34/16/453963416.db2.gz	GBJTVMHHRCZASU-UHFFFAOYSA-N	0	3	347.462	3.497	20	30		EGEDHN
CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1cc(C#N)cs1	ZINC000084110680	453969460	/nfs/dbraw/zinc/96/94/60/453969460.db2.gz	NGFTXALUQXBEJG-UHFFFAOYSA-N	0	3	349.406	3.102	20	30		EGEDHN
N#CC(C(=O)c1csc2c1CCCC2)c1nnc2n1CCCCC2	ZINC000041510507	453970129	/nfs/dbraw/zinc/97/01/29/453970129.db2.gz	AWOYZRAUAVFEBY-ZDUSSCGKSA-N	0	3	340.452	3.435	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN[C@@H](C)c1cccc(N2CCCC2)c1	ZINC000181878934	455393167	/nfs/dbraw/zinc/39/31/67/455393167.db2.gz	XNDNBNBIRWUFPI-KRWDZBQOSA-N	0	3	327.472	3.138	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cccc(CC#N)c1	ZINC000076389299	453995535	/nfs/dbraw/zinc/99/55/35/453995535.db2.gz	YVBXUMKUDSZODP-GOSISDBHSA-N	0	3	347.462	3.489	20	30		EGEDHN
CCN(Cc1cc(=O)n2cc(C)ccc2n1)[C@H](C)c1ccc(C#N)cc1	ZINC000042741094	454023055	/nfs/dbraw/zinc/02/30/55/454023055.db2.gz	LXHSKPDALKVPDL-MRXNPFEDSA-N	0	3	346.434	3.458	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1CCC[C@@H]1CCc1ccccc1	ZINC000077194312	454073525	/nfs/dbraw/zinc/07/35/25/454073525.db2.gz	RVPYCMYHOXCINR-IEBWSBKVSA-N	0	3	327.472	3.092	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1CC[C@H](Oc2ccccc2)C1	ZINC000077316250	454090725	/nfs/dbraw/zinc/09/07/25/454090725.db2.gz	BIDQZQMYCLIFKF-SFHVURJKSA-N	0	3	338.407	3.099	20	30		EGEDHN
N#CC(C(=O)c1cccc2c1OCO2)c1ccc(C(F)(F)F)cn1	ZINC000077430791	454105805	/nfs/dbraw/zinc/10/58/05/454105805.db2.gz	JLQJVACZUMAKQK-NSHDSACASA-N	0	3	334.253	3.319	20	30		EGEDHN
Cc1ccc(C#N)cc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000069614935	454124964	/nfs/dbraw/zinc/12/49/64/454124964.db2.gz	OSYKUJNUZBUFMF-GOSISDBHSA-N	0	3	334.423	3.263	20	30		EGEDHN
N#Cc1ccc(CNC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)cc1	ZINC000077789953	454156777	/nfs/dbraw/zinc/15/67/77/454156777.db2.gz	YSMMITCSDGZLSC-HXUWFJFHSA-N	0	3	348.450	3.022	20	30		EGEDHN
Cn1cccc1[C@@H]1CCCN1CCC(=O)Nc1sccc1C#N	ZINC000058068039	454163099	/nfs/dbraw/zinc/16/30/99/454163099.db2.gz	JNXCDSAUUSBARN-HNNXBMFYSA-N	0	3	328.441	3.124	20	30		EGEDHN
COC[C@@H](N[C@@H](C)C(=O)N(CCC#N)c1cc(C)cc(C)c1)C(C)C	ZINC000130281629	454186769	/nfs/dbraw/zinc/18/67/69/454186769.db2.gz	KNSVBQWOIJOZSO-PKOBYXMFSA-N	0	3	345.487	3.199	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])s1)C(C)C	ZINC000078397482	454247521	/nfs/dbraw/zinc/24/75/21/454247521.db2.gz	XXTKBQQJKCUULC-ZDUSSCGKSA-N	0	3	337.445	3.085	20	30		EGEDHN
N#Cc1c(F)cccc1NCCCN1CCN(c2ccccc2)CC1	ZINC000078601336	454283934	/nfs/dbraw/zinc/28/39/34/454283934.db2.gz	HOBNWIGWTINIHG-UHFFFAOYSA-N	0	3	338.430	3.322	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1ccc(F)cc1[N+](=O)[O-])C(C)C	ZINC000131903555	454296269	/nfs/dbraw/zinc/29/62/69/454296269.db2.gz	ZIWQCWSLROWDDF-KRWDZBQOSA-N	0	3	349.406	3.162	20	30		EGEDHN
C[C@@H]1CCCN(CCNC(=O)N[C@@H](CCC#N)c2ccccc2)C1	ZINC000131976913	454303675	/nfs/dbraw/zinc/30/36/75/454303675.db2.gz	XTKBUHQRVLZEDE-AEFFLSMTSA-N	0	3	328.460	3.063	20	30		EGEDHN
C=CCn1c(Cc2ccccc2)nnc1SC[C@@H]1CCN(C)C1	ZINC000191084441	455439621	/nfs/dbraw/zinc/43/96/21/455439621.db2.gz	HNBLQABWJZMWNU-MRXNPFEDSA-N	0	3	328.485	3.099	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H](C)c2ccc(C(F)(F)F)cc2)CC1	ZINC000048264937	454464359	/nfs/dbraw/zinc/46/43/59/454464359.db2.gz	HSQFYVHZKGCGPD-CYBMUJFWSA-N	0	3	338.373	3.228	20	30		EGEDHN
C[C@@H](CN1CCCCC1)NC(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000133798461	454468558	/nfs/dbraw/zinc/46/85/58/454468558.db2.gz	AJBGLFFMHHQLBO-WMZOPIPTSA-N	0	3	328.460	3.205	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)cc1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000048744900	454512677	/nfs/dbraw/zinc/51/26/77/454512677.db2.gz	KVWNLPAQVYUSHM-HNNXBMFYSA-N	0	3	349.434	3.066	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)n1	ZINC000048789499	454515994	/nfs/dbraw/zinc/51/59/94/454515994.db2.gz	SNBLRAIMIZVZSM-SNVBAGLBSA-N	0	3	326.337	3.331	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H]2c3cccc(F)c3CC[C@@H]2C)CC1	ZINC000080121051	454537021	/nfs/dbraw/zinc/53/70/21/454537021.db2.gz	MRTTXBQPVKWCQC-IFXJQAMLSA-N	0	3	345.462	3.399	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2cc(F)cc(Br)c2)nc(C)n1	ZINC000049406410	454547188	/nfs/dbraw/zinc/54/71/88/454547188.db2.gz	AIPLRIGOGDNXHS-ZDUSSCGKSA-N	0	3	348.175	3.485	20	30		EGEDHN
CC(C)(CNC(=O)c1cccc(CC#N)c1)N1CCc2ccccc2C1	ZINC000049657262	454555635	/nfs/dbraw/zinc/55/56/35/454555635.db2.gz	ZPJQCXPKUWXSEO-UHFFFAOYSA-N	0	3	347.462	3.319	20	30		EGEDHN
Cc1cccc(OCC(=O)C(C#N)C(=O)Nc2ccccc2Cl)c1	ZINC000103504459	454561608	/nfs/dbraw/zinc/56/16/08/454561608.db2.gz	IEOBALJUYYFVLK-AWEZNQCLSA-N	0	3	342.782	3.375	20	30		EGEDHN
CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1ccc(C#N)cc1	ZINC000065937197	454641519	/nfs/dbraw/zinc/64/15/19/454641519.db2.gz	UQVKWANCVQBIBE-UHFFFAOYSA-N	0	3	341.842	3.416	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)c1sccc1C#N)c1ccccc1	ZINC000052028817	454649411	/nfs/dbraw/zinc/64/94/11/454649411.db2.gz	KZTNXSCEUYBFPQ-INIZCTEOSA-N	0	3	327.453	3.433	20	30		EGEDHN
N#CC1(NC(=O)CN2CCC[C@H]2CCc2ccccc2)CCCCC1	ZINC000052105781	454655352	/nfs/dbraw/zinc/65/53/52/454655352.db2.gz	MPHIQOZQMCPFCQ-IBGZPJMESA-N	0	3	339.483	3.426	20	30		EGEDHN
C[C@@H](NC(=O)N1CCC[C@@H]1CN1CCCCC1)c1cccc(C#N)c1	ZINC000074917435	454658539	/nfs/dbraw/zinc/65/85/39/454658539.db2.gz	BSVPMBKSPYUBFI-VQIMIIECSA-N	0	3	340.471	3.279	20	30		EGEDHN
COc1ccccc1CN(CCCSCC#N)C[C@@H]1CCCO1	ZINC000074981644	454668838	/nfs/dbraw/zinc/66/88/38/454668838.db2.gz	ZUQPHLHUVCSGPM-KRWDZBQOSA-N	0	3	334.485	3.323	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H](C)Oc2ccccc2Cl)CC1	ZINC000106036820	454674290	/nfs/dbraw/zinc/67/42/90/454674290.db2.gz	ZRVATAJISJLHAC-CQSZACIVSA-N	0	3	336.863	3.264	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(N(C)CCC)cc2)CC1	ZINC000106035504	454674434	/nfs/dbraw/zinc/67/44/34/454674434.db2.gz	XDTZWXWPIPQENY-UHFFFAOYSA-N	0	3	329.488	3.303	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C(C)(C)Oc2ccc(F)cc2)CC1	ZINC000106037487	454674457	/nfs/dbraw/zinc/67/44/57/454674457.db2.gz	TUFMIOVKDOBQFA-UHFFFAOYSA-N	0	3	334.435	3.140	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H](C)Sc2ccc(OC)cc2)CC1	ZINC000106035797	454674594	/nfs/dbraw/zinc/67/45/94/454674594.db2.gz	UPAGUDLTZBYNDT-OAHLLOKOSA-N	0	3	348.512	3.333	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H]2CCCc3ccc(F)cc32)CC1	ZINC000093126408	454685201	/nfs/dbraw/zinc/68/52/01/454685201.db2.gz	XOKZQNRVTYTEQN-SFHVURJKSA-N	0	3	331.435	3.153	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](CC)c2nc(C)cs2)CC1	ZINC000106275385	454689648	/nfs/dbraw/zinc/68/96/48/454689648.db2.gz	ZWIADSYMMURUHI-OAHLLOKOSA-N	0	3	336.505	3.242	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2nnc(CCCC)s2)CC1	ZINC000106316834	454690764	/nfs/dbraw/zinc/69/07/64/454690764.db2.gz	MWFMTTPWRKFZOM-UHFFFAOYSA-N	0	3	337.493	3.043	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NCC1CCN(Cc2ccc(C)cc2)CC1	ZINC000106829193	454721872	/nfs/dbraw/zinc/72/18/72/454721872.db2.gz	UJSRPGJOBDCHFD-GOSISDBHSA-N	0	3	344.499	3.304	20	30		EGEDHN
CCOC[C@H]1CCN(Cc2ccc(OC)c(OCCCC#N)c2)C1	ZINC000093839335	454739084	/nfs/dbraw/zinc/73/90/84/454739084.db2.gz	VSVUVUQJDQIAQU-KRWDZBQOSA-N	0	3	332.444	3.236	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)/C=C/c2ccc(F)c(OC)c2)CC1	ZINC000153333873	454783177	/nfs/dbraw/zinc/78/31/77/454783177.db2.gz	ISAWKBHISUDYOW-FNORWQNLSA-N	0	3	332.419	3.004	20	30		EGEDHN
C[C@@H](C#N)CSc1ccccc1NC(=O)NC[C@@H]1CCCN(C)C1	ZINC000108528531	454801763	/nfs/dbraw/zinc/80/17/63/454801763.db2.gz	KPJAWWGLSFXISM-GJZGRUSLSA-N	0	3	346.500	3.402	20	30		EGEDHN
Cc1cccc([C@@H](CNCc2ccc(C#N)s2)N2CCOCC2)c1	ZINC000176947154	454802559	/nfs/dbraw/zinc/80/25/59/454802559.db2.gz	SZLMIMKNHNZWMN-LJQANCHMSA-N	0	3	341.480	3.091	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)NCc2ccc(C#N)cc2)CN1Cc1ccccc1	ZINC000177211007	454837694	/nfs/dbraw/zinc/83/76/94/454837694.db2.gz	SZQDZNXGYWQDFV-OXJNMPFZSA-N	0	3	348.450	3.020	20	30		EGEDHN
CN(CCCNC1CC(C#N)(c2ccccc2)C1)CC(F)(F)F	ZINC000125913561	454856161	/nfs/dbraw/zinc/85/61/61/454856161.db2.gz	NAEGZEPTBMJLQZ-UHFFFAOYSA-N	0	3	325.378	3.084	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](C)c2csc(CC)n2)CC1	ZINC000111495967	454867550	/nfs/dbraw/zinc/86/75/50/454867550.db2.gz	RTMIMAUHUPBZGR-CYBMUJFWSA-N	0	3	336.505	3.106	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H](CCNCc2cc(C#N)cs2)C1	ZINC000177698064	454893251	/nfs/dbraw/zinc/89/32/51/454893251.db2.gz	PMYAFOZXUWRXIC-CYBMUJFWSA-N	0	3	335.473	3.356	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@@H](CC)[C@H]1CCCO1	ZINC000182326530	455489689	/nfs/dbraw/zinc/48/96/89/455489689.db2.gz	BFQIINGAUNUXRY-GOEBONIOSA-N	0	3	334.485	3.450	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2CCC[C@H](SCC)C2)CC1	ZINC000175739769	455490488	/nfs/dbraw/zinc/49/04/88/455490488.db2.gz	URWUKNBVIDDCNX-SJORKVTESA-N	0	3	339.549	3.390	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2sc(CC3CC3)nc2C)CC1	ZINC000191547314	455495777	/nfs/dbraw/zinc/49/57/77/455495777.db2.gz	DKEYQIVEJAINKP-UHFFFAOYSA-N	0	3	333.501	3.174	20	30		EGEDHN
CC(C)(C#N)c1ccc(NC(=O)N2CC[C@@H](N3CCCC3)C2)cc1	ZINC000170751360	454969645	/nfs/dbraw/zinc/96/96/45/454969645.db2.gz	NPGJDZQSUIFVER-QGZVFWFLSA-N	0	3	326.444	3.190	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@H](NCc1ccc(C#N)cc1F)C1CC1	ZINC000178791737	454977547	/nfs/dbraw/zinc/97/75/47/454977547.db2.gz	UZAUTHXPSODPQQ-INIZCTEOSA-N	0	3	333.407	3.090	20	30		EGEDHN
CN(CCNC(=O)c1ccc(C#N)c(Cl)c1)Cc1ccccc1	ZINC000155286197	454983397	/nfs/dbraw/zinc/98/33/97/454983397.db2.gz	HEELNXDQDIUDPX-UHFFFAOYSA-N	0	3	327.815	3.073	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc(-c3cc[nH]n3)cc2)CC1	ZINC000151637523	455010828	/nfs/dbraw/zinc/01/08/28/455010828.db2.gz	JNHXQXSOBMKFJW-UHFFFAOYSA-N	0	3	339.443	3.239	20	30		EGEDHN
C[C@H](c1ccccc1)N1CCC(NC(=O)N2CCC(C#N)CC2)CC1	ZINC000116435766	455056746	/nfs/dbraw/zinc/05/67/46/455056746.db2.gz	XTJANKYPVSUDAT-MRXNPFEDSA-N	0	3	340.471	3.157	20	30		EGEDHN
C=CC[C@H](C)NC(=O)NC[C@H](c1cccc(OC)c1)N1CCCC1	ZINC000117026306	455077698	/nfs/dbraw/zinc/07/76/98/455077698.db2.gz	JNRMXZZOYDHUEQ-MAUKXSAKSA-N	0	3	331.460	3.096	20	30		EGEDHN
C[C@H](N[C@H]1CC(=O)N(c2c(F)cccc2F)C1)c1ccc(C#N)cc1	ZINC000179798584	455079948	/nfs/dbraw/zinc/07/99/48/455079948.db2.gz	DEQDORFHVQRYOU-WFASDCNBSA-N	0	3	341.361	3.293	20	30		EGEDHN
CCC1(CC)[C@@H](N[C@@H](C)C(=O)Nc2ccccc2C#N)[C@@H](C)[C@@H]1OC	ZINC000179794427	455080006	/nfs/dbraw/zinc/08/00/06/455080006.db2.gz	IWGZCTNEZVNCDP-BODMPHMZSA-N	0	3	343.471	3.315	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cnn(CC(C)C)c2C2CC2)CC1	ZINC000156167674	455088686	/nfs/dbraw/zinc/08/86/86/455088686.db2.gz	QDWUDVRPEAONGX-UHFFFAOYSA-N	0	3	344.503	3.187	20	30		EGEDHN
C=CCN1CCC(NC(=O)/C=C/c2cccc(C(F)(F)F)c2)CC1	ZINC000171721641	455088838	/nfs/dbraw/zinc/08/88/38/455088838.db2.gz	FINIDXDYHBANAW-VOTSOKGWSA-N	0	3	338.373	3.485	20	30		EGEDHN
COC(=O)c1ccc(CNCCSCc2ccccc2C#N)cc1	ZINC000180357925	455161013	/nfs/dbraw/zinc/16/10/13/455161013.db2.gz	KYMWIBFWXREGRU-UHFFFAOYSA-N	0	3	340.448	3.368	20	30		EGEDHN
C[C@H](NCCC(=O)Nc1ccc(C#N)cc1)c1cccc([N+](=O)[O-])c1	ZINC000180424472	455167265	/nfs/dbraw/zinc/16/72/65/455167265.db2.gz	PCZFMFKDIXOXSJ-ZDUSSCGKSA-N	0	3	338.367	3.146	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(C)nn2C(CC)CC)CC1	ZINC000180479940	455178443	/nfs/dbraw/zinc/17/84/43/455178443.db2.gz	CBWSVTUCIYIEBD-UHFFFAOYSA-N	0	3	332.492	3.323	20	30		EGEDHN
CCS[C@@H]1CCCC[C@@H]1NCC(=O)N(C)C1(C#N)CCCCC1	ZINC000189506090	455209462	/nfs/dbraw/zinc/20/94/62/455209462.db2.gz	OWNFGUJKJGQTND-JKSUJKDBSA-N	0	3	337.533	3.325	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(Oc3ccccc3)nc2)CC1	ZINC000264444170	455214700	/nfs/dbraw/zinc/21/47/00/455214700.db2.gz	BAIXWCPTUOUTAU-UHFFFAOYSA-N	0	3	337.423	3.254	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@H](C)N[C@H](CC)c1ccc2c(c1)OCCO2	ZINC000180642672	455216146	/nfs/dbraw/zinc/21/61/46/455216146.db2.gz	UIPXQZTXZXUBIY-DOTOQJQBSA-N	0	3	346.471	3.312	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2nc(-c3ccccc3)oc2C)CC1	ZINC000264464033	455218774	/nfs/dbraw/zinc/21/87/74/455218774.db2.gz	GUOBSWPZFRXNRX-UHFFFAOYSA-N	0	3	339.439	3.420	20	30		EGEDHN
C#CCN1CCC(C(=O)NCC(CC)(CC)c2ccccc2)CC1	ZINC000173390921	455277472	/nfs/dbraw/zinc/27/74/72/455277472.db2.gz	IFRZLLWBZLUDBF-UHFFFAOYSA-N	0	3	326.484	3.206	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](CC(C)(C)C)C(F)(F)F)CC1	ZINC000181160498	455296803	/nfs/dbraw/zinc/29/68/03/455296803.db2.gz	BBYMUMORNZCZQV-CYBMUJFWSA-N	0	3	335.414	3.303	20	30		EGEDHN
N#CCCN(CCC#N)C(=O)CN1CCCC2(CCCCC2)CC1	ZINC000190320109	455297522	/nfs/dbraw/zinc/29/75/22/455297522.db2.gz	LANYYPCGVOKYEF-UHFFFAOYSA-N	0	3	330.476	3.079	20	30		EGEDHN
C[C@@H]1CCN(C(=O)c2cccc(C#N)c2)CCN1Cc1ccccc1	ZINC000173523034	455299951	/nfs/dbraw/zinc/29/99/51/455299951.db2.gz	ROGYBQJSRGEVAC-QGZVFWFLSA-N	0	3	333.435	3.295	20	30		EGEDHN
CN(C)[C@@H]1CCCN(C(=O)c2cccc(Nc3ccc(C#N)cc3)c2)C1	ZINC000158443224	455303636	/nfs/dbraw/zinc/30/36/36/455303636.db2.gz	NJFGBMRLHDDMMF-HXUWFJFHSA-N	0	3	348.450	3.468	20	30		EGEDHN
CN(C)CCN(Cc1ccco1)C(=O)c1ccc(C#N)c(Cl)c1	ZINC000158601051	455316004	/nfs/dbraw/zinc/31/60/04/455316004.db2.gz	PUUPIOGERZCRGP-UHFFFAOYSA-N	0	3	331.803	3.009	20	30		EGEDHN
N#Cc1cccc(OC2CCN(C[C@H](O)CC3CCCC3)CC2)c1	ZINC000190517597	455336982	/nfs/dbraw/zinc/33/69/82/455336982.db2.gz	GIGXFHLSMMDHKQ-GOSISDBHSA-N	0	3	328.456	3.343	20	30		EGEDHN
C[C@@H](NCc1ccnc(N2CCCC2)c1)c1ccc(OCC#N)cc1	ZINC000181458781	455337289	/nfs/dbraw/zinc/33/72/89/455337289.db2.gz	HGVHSAMXOUNAFM-MRXNPFEDSA-N	0	3	336.439	3.435	20	30		EGEDHN
CCCn1cc(C(=O)C(C#N)C(=O)Nc2cccc3ccccc32)cn1	ZINC000181516630	455347289	/nfs/dbraw/zinc/34/72/89/455347289.db2.gz	OIWBUAVEFGWMAQ-QGZVFWFLSA-N	0	3	346.390	3.407	20	30		EGEDHN
C[C@@H](NCCS(=O)(=O)c1ccc(C#N)cc1)[C@H](C)c1ccccc1	ZINC000181525733	455348516	/nfs/dbraw/zinc/34/85/16/455348516.db2.gz	FMVUDPBECLMNHI-JKSUJKDBSA-N	0	3	342.464	3.114	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC[C@H](c3c(F)cccc3F)C2)CC1	ZINC000184459386	455384289	/nfs/dbraw/zinc/38/42/89/455384289.db2.gz	HZITWPXNNUSVNS-AWEZNQCLSA-N	0	3	349.425	3.114	20	30		EGEDHN
C[C@@H](N[C@@H]1CCN(C(=O)CCc2ccccc2)C1)c1cccc(C#N)c1	ZINC000181890253	455395046	/nfs/dbraw/zinc/39/50/46/455395046.db2.gz	WCHHAMWSTYFWEE-DYESRHJHSA-N	0	3	347.462	3.443	20	30		EGEDHN
CC(C)Oc1ccc(NC(=O)N(CCN(C)C)C(C)C)cc1C#N	ZINC000181903174	455396714	/nfs/dbraw/zinc/39/67/14/455396714.db2.gz	GVFQUQUYRJOKAP-UHFFFAOYSA-N	0	3	332.448	3.149	20	30		EGEDHN
CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)N1CCC(C#N)CC1	ZINC000184561606	455402298	/nfs/dbraw/zinc/40/22/98/455402298.db2.gz	YEVALTYQZFACOA-IBGZPJMESA-N	0	3	342.487	3.088	20	30		EGEDHN
CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)N1CCC(C#N)CC1	ZINC000184561589	455403264	/nfs/dbraw/zinc/40/32/64/455403264.db2.gz	YEVALTYQZFACOA-LJQANCHMSA-N	0	3	342.487	3.088	20	30		EGEDHN
N#CC(C(=O)c1ccc(-n2cccn2)cc1)c1cnc2ccccc2n1	ZINC000190910435	455403331	/nfs/dbraw/zinc/40/33/31/455403331.db2.gz	HRPGQQLWLQWJKY-INIZCTEOSA-N	0	3	339.358	3.306	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)CCC1	ZINC000190990999	455420643	/nfs/dbraw/zinc/42/06/43/455420643.db2.gz	XHXLGMYVSWXXNT-LJQANCHMSA-N	0	3	342.483	3.140	20	30		EGEDHN
C[C@H](O)[C@H]1CCCCN1CC#Cc1ccc(OC(F)(F)F)cc1	ZINC000160056170	455425534	/nfs/dbraw/zinc/42/55/34/455425534.db2.gz	OBZNRXZDWYJIDX-XJKSGUPXSA-N	0	3	327.346	3.172	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCSC3(CCCCC3)C2)CC1	ZINC000175512894	455456513	/nfs/dbraw/zinc/45/65/13/455456513.db2.gz	MXVCKIXVHDVIRA-UHFFFAOYSA-N	0	3	337.533	3.098	20	30		EGEDHN
Cc1ccc(C(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)c(F)c1	ZINC000175584801	455467489	/nfs/dbraw/zinc/46/74/89/455467489.db2.gz	MPURSTPDYSGSQJ-UHFFFAOYSA-N	0	3	339.414	3.210	20	30		EGEDHN
C=CCN(Cc1ccccc1F)C(=O)N[C@H]1C[C@@H](C)N(C2CC2)C1	ZINC000175612251	455470949	/nfs/dbraw/zinc/47/09/49/455470949.db2.gz	VEYPTFKGCZGIEA-ZBFHGGJFSA-N	0	3	331.435	3.149	20	30		EGEDHN
CC#CCCCC(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000185317629	455539299	/nfs/dbraw/zinc/53/92/99/455539299.db2.gz	OXGNRTMYXZWKAK-UHFFFAOYSA-N	0	3	342.483	3.217	20	30		EGEDHN
COc1cc(C#N)ccc1CN[C@H]1CCO[C@@H]1c1ccc(F)c(F)c1	ZINC000192131756	455560965	/nfs/dbraw/zinc/56/09/65/455560965.db2.gz	PWCWQWGTFPJVTJ-PKOBYXMFSA-N	0	3	344.361	3.465	20	30		EGEDHN
COc1ccc(CN[C@H]2CCO[C@@H]2c2ccc(F)c(F)c2)cc1C#N	ZINC000182695843	455570085	/nfs/dbraw/zinc/57/00/85/455570085.db2.gz	RPFZZCBNDSHFFN-PKOBYXMFSA-N	0	3	344.361	3.465	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/Cc2ncnn2C(C)(C)C)c([O-])c1	ZINC000283830389	455601096	/nfs/dbraw/zinc/60/10/96/455601096.db2.gz	RGPGKOUQTUGWRM-YBFXNURJSA-N	0	3	329.448	3.204	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](C)CSc2ccc(C)cc2)CC1	ZINC000185735070	455610458	/nfs/dbraw/zinc/61/04/58/455610458.db2.gz	OWGWXALSRGIFHZ-MRXNPFEDSA-N	0	3	347.528	3.425	20	30		EGEDHN
C=CCC(CC=C)C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000268199598	455617076	/nfs/dbraw/zinc/61/70/76/455617076.db2.gz	YMKKSKUFAWOJRV-UHFFFAOYSA-N	0	3	325.456	3.217	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)c1ccc(Cl)c(C#N)n1	ZINC000268289622	455641623	/nfs/dbraw/zinc/64/16/23/455641623.db2.gz	DIAIJNZRJPXGLF-UHFFFAOYSA-N	0	3	339.830	3.047	20	30		EGEDHN
N#C[C@H]1CCC[C@@H](NCC(=O)N2CCC(Cc3ccccc3)CC2)C1	ZINC000192924540	455718909	/nfs/dbraw/zinc/71/89/09/455718909.db2.gz	SJVAYNMEJTTXJI-VQTJNVASSA-N	0	3	339.483	3.140	20	30		EGEDHN
C[C@H]1CN(C(=O)Nc2ccc(F)c(C#N)c2)CCN(C2CCC2)C1	ZINC000293065268	455773746	/nfs/dbraw/zinc/77/37/46/455773746.db2.gz	ZEWZODUPEOBZLI-CYBMUJFWSA-N	0	3	330.407	3.035	20	30		EGEDHN
C#CCCOc1ccc(CN2CCSC3(CCOCC3)C2)cc1	ZINC000186503242	455783169	/nfs/dbraw/zinc/78/31/69/455783169.db2.gz	BOCRRUVNHHMPPO-UHFFFAOYSA-N	0	3	331.481	3.187	20	30		EGEDHN
Cc1ccc(CNC(=O)C2CCN([C@H]3CC[C@@H](C#N)C3)CC2)cc1F	ZINC000293389346	455784377	/nfs/dbraw/zinc/78/43/77/455784377.db2.gz	GUAUGIATMPTGAV-QAPCUYQASA-N	0	3	343.446	3.155	20	30		EGEDHN
CC[C@H](NCc1ccc(OCCO)c(OC)c1)c1ccc(C#N)cc1	ZINC000278235746	455793361	/nfs/dbraw/zinc/79/33/61/455793361.db2.gz	KPLPXZMOVFONDI-SFHVURJKSA-N	0	3	340.423	3.179	20	30		EGEDHN
COc1ccc(CN(CCOCCC#N)[C@@H](C)C2CC2)c(OC)c1	ZINC000294121183	455805822	/nfs/dbraw/zinc/80/58/22/455805822.db2.gz	NICWBOWMTMRIGK-HNNXBMFYSA-N	0	3	332.444	3.235	20	30		EGEDHN
C#CCCOc1ccc(C(=O)NCc2ccccc2CN(C)C)cc1	ZINC000294610214	455821722	/nfs/dbraw/zinc/82/17/22/455821722.db2.gz	ZWJHXGGNAFFHJV-UHFFFAOYSA-N	0	3	336.435	3.080	20	30		EGEDHN
C[C@@H]1C[C@@H](N(C)C(=O)CC(C)(C)C#N)CCN1Cc1ccccc1	ZINC000278384384	455833711	/nfs/dbraw/zinc/83/37/11/455833711.db2.gz	RCZXKELQSBNBTD-AEFFLSMTSA-N	0	3	327.472	3.438	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1C(=O)NCC(C)(C)N[C@@H](C)c1ccccc1	ZINC000278642357	455842392	/nfs/dbraw/zinc/84/23/92/455842392.db2.gz	LOBXWSPRGKCJHQ-CGTJXYLNSA-N	0	3	330.472	3.213	20	30		EGEDHN
COC(=O)C(C)(C)CCNCc1ccc(OC)c(OCCCC#N)c1	ZINC000285449457	455847683	/nfs/dbraw/zinc/84/76/83/455847683.db2.gz	IWZSIVOJJFKJMR-UHFFFAOYSA-N	0	3	348.443	3.057	20	30		EGEDHN
CC[C@@H](N[C@@H]1CCN(Cc2ccccc2)C1=O)c1ccc(C#N)cc1	ZINC000278875543	455851704	/nfs/dbraw/zinc/85/17/04/455851704.db2.gz	XJSZXXWVSSOWPR-WOJBJXKFSA-N	0	3	333.435	3.400	20	30		EGEDHN
N#Cc1ccc(CN(C[C@@H](O)COc2ccccc2F)C2CC2)cc1	ZINC000194539834	455856108	/nfs/dbraw/zinc/85/61/08/455856108.db2.gz	GARNGDMOISVWOJ-GOSISDBHSA-N	0	3	340.398	3.102	20	30		EGEDHN
C=CCN1CCC(NC(=O)/C=C\c2nc3ccccc3s2)CC1	ZINC000255538821	455868981	/nfs/dbraw/zinc/86/89/81/455868981.db2.gz	FUSGQCJAUIGEQX-FPLPWBNLSA-N	0	3	327.453	3.076	20	30		EGEDHN
COc1ccc([C@@H](C)NC(=O)C(C#N)Cc2ccc(C#N)cc2)cc1	ZINC000279812902	455873988	/nfs/dbraw/zinc/87/39/88/455873988.db2.gz	XNEVMIMYSYSADQ-RDTXWAMCSA-N	0	3	333.391	3.127	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN2C[C@H](N3CCCC3)C[C@@H]2C)c1C	ZINC000285578528	455874777	/nfs/dbraw/zinc/87/47/77/455874777.db2.gz	OGTUVULSEZGWFI-MAUKXSAKSA-N	0	3	329.488	3.032	20	30		EGEDHN
CN(C)CCN(C(=O)/C=C\c1ccc(OCC#N)cc1)c1ccccc1	ZINC000255898591	455875271	/nfs/dbraw/zinc/87/52/71/455875271.db2.gz	VSYNFTNTIVIVLF-RAXLEYEMSA-N	0	3	349.434	3.197	20	30		EGEDHN
C=CC[C@@H](C)N[C@@H](C)c1cc(S(N)(=O)=O)c(Cl)cc1Cl	ZINC000280018548	455880727	/nfs/dbraw/zinc/88/07/27/455880727.db2.gz	HFOZZSSYMNPASY-BDAKNGLRSA-N	0	3	337.272	3.256	20	30		EGEDHN
C=CCS(=O)(=O)CCNCCCCc1cccc(C(F)(F)F)c1	ZINC000280232029	455922972	/nfs/dbraw/zinc/92/29/72/455922972.db2.gz	JOGDSRGSANMTLY-UHFFFAOYSA-N	0	3	349.418	3.219	20	30		EGEDHN
C=C(C)[C@H](NC[C@@H](O)COCc1ccco1)c1ccc(F)c(F)c1	ZINC000187786074	455952222	/nfs/dbraw/zinc/95/22/22/455952222.db2.gz	QWBHUIQLBSZREC-KDOFPFPSSA-N	0	3	337.366	3.342	20	30		EGEDHN
C[C@@H](NC1(c2cccc(C#N)c2)CC1)c1ccccc1-n1ccnn1	ZINC000286093995	455975861	/nfs/dbraw/zinc/97/58/61/455975861.db2.gz	MFIBOHUTGBAMFY-OAHLLOKOSA-N	0	3	329.407	3.479	20	30		EGEDHN
C=CCC[C@@H](NCc1cccnc1N1CCN(C)CC1)c1ccco1	ZINC000286198083	455998490	/nfs/dbraw/zinc/99/84/90/455998490.db2.gz	RNJGSZUBNROKDZ-GOSISDBHSA-N	0	3	340.471	3.224	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cccc(SC)c2[N+](=O)[O-])CC1	ZINC000188143063	456007945	/nfs/dbraw/zinc/00/79/45/456007945.db2.gz	UDURNMXSYSBWPH-UHFFFAOYSA-N	0	3	349.456	3.087	20	30		EGEDHN
C=CCC[C@H](NC(=O)N1CC[C@@H]2CCN(C)C[C@@H]21)c1ccccc1	ZINC000272633270	456020279	/nfs/dbraw/zinc/02/02/79/456020279.db2.gz	XFXZUHMQEQWMLG-FHWLQOOXSA-N	0	3	327.472	3.430	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@@H]1CNCc1cc([N+](=O)[O-])ccc1OC(F)F	ZINC000280697952	456034230	/nfs/dbraw/zinc/03/42/30/456034230.db2.gz	SDFULNWJHUTAHO-IAQYHMDHSA-N	0	3	342.342	3.267	20	30		EGEDHN
CC[C@@](C)(C#N)C(=O)Nc1cc(C)cc(N2CCN(C(C)C)CC2)c1	ZINC000286445024	456047224	/nfs/dbraw/zinc/04/72/24/456047224.db2.gz	IKXSDMLMVPKOMP-FQEVSTJZSA-N	0	3	342.487	3.404	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(F)cc2OC(C)(C)C)CC1	ZINC000270870070	456056588	/nfs/dbraw/zinc/05/65/88/456056588.db2.gz	UENRJHYLTWTQJW-UHFFFAOYSA-N	0	3	332.419	3.287	20	30		EGEDHN
C=CCS(=O)(=O)CCN[C@@H](C)Cc1c(Cl)cccc1Cl	ZINC000272840359	456086700	/nfs/dbraw/zinc/08/67/00/456086700.db2.gz	JKRZVIGLCNXFSI-NSHDSACASA-N	0	3	336.284	3.115	20	30		EGEDHN
N#CCc1ccc(CN2CCC(NC(=O)C3CCCCC3)CC2)cc1	ZINC000332522309	456087022	/nfs/dbraw/zinc/08/70/22/456087022.db2.gz	LAKYQNSIQHYUML-UHFFFAOYSA-N	0	3	339.483	3.414	20	30		EGEDHN
COc1ccc(CN[C@@H](c2cccs2)C(C)(C)CO)cc1C#N	ZINC000289637953	456134207	/nfs/dbraw/zinc/13/42/07/456134207.db2.gz	FJURIJPCPAWMHD-KRWDZBQOSA-N	0	3	330.453	3.478	20	30		EGEDHN
COC[C@@]1(CN[C@H](C)c2ccc(C#N)cc2)OCCc2ccccc21	ZINC000289657237	456134731	/nfs/dbraw/zinc/13/47/31/456134731.db2.gz	GMQGLEFQYLPDCF-IIBYNOLFSA-N	0	3	336.435	3.323	20	30		EGEDHN
C=CCSCCNCc1ccc(C(=O)OC)cc1Br	ZINC000231944480	456144634	/nfs/dbraw/zinc/14/46/34/456144634.db2.gz	PIHCIAJMJXGDGY-UHFFFAOYSA-N	0	3	344.274	3.245	20	30		EGEDHN
CC1CCN([C@H](CNC(=O)NCCCC#N)c2ccccc2)CC1	ZINC000273019162	456148172	/nfs/dbraw/zinc/14/81/72/456148172.db2.gz	BTTQDTPJUQMTLY-GOSISDBHSA-N	0	3	328.460	3.063	20	30		EGEDHN
C[C@H](C#N)Oc1ccccc1NC(=O)N(C)[C@@H](C)C1CCN(C)CC1	ZINC000273354595	456224899	/nfs/dbraw/zinc/22/48/99/456224899.db2.gz	BQSNPAOUKUQKMD-CABCVRRESA-N	0	3	344.459	3.171	20	30		EGEDHN
C=CCN(C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C)C1CC1	ZINC000297475300	456230102	/nfs/dbraw/zinc/23/01/02/456230102.db2.gz	LXIGJIPBCIKWGK-QGZVFWFLSA-N	0	3	333.501	3.371	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN(C)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1	ZINC000273438252	456230620	/nfs/dbraw/zinc/23/06/20/456230620.db2.gz	MURUIXKXLOJXMQ-RTBURBONSA-N	0	3	346.446	3.178	20	30		EGEDHN
C=CCS(=O)(=O)CCN[C@@H]1CCCc2c3cc(C)ccc3[nH]c21	ZINC000290213337	456268394	/nfs/dbraw/zinc/26/83/94/456268394.db2.gz	HJDATPDOINQLCD-QGZVFWFLSA-N	0	3	332.469	3.044	20	30		EGEDHN
N#Cc1ccccc1-c1ccc(CNC(=O)C23CCCN2CCC3)cc1	ZINC000290366860	456307426	/nfs/dbraw/zinc/30/74/26/456307426.db2.gz	MYJHTVSFOYNFDE-UHFFFAOYSA-N	0	3	345.446	3.470	20	30		EGEDHN
C=CC[C@H](CC)NC(=O)CCCN1CCN(c2ccccc2)CC1	ZINC000337088004	456325750	/nfs/dbraw/zinc/32/57/50/456325750.db2.gz	GSQLVSLOSSZRHO-SFHVURJKSA-N	0	3	329.488	3.060	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)s1)[C@H](c1ccccc1)N1CCOCC1	ZINC000342947662	456332332	/nfs/dbraw/zinc/33/23/32/456332332.db2.gz	SYXYSPVZRIWQGU-DNVCBOLYSA-N	0	3	341.480	3.171	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N(CC)Cc1ccc(CN(C)C)cc1	ZINC000275859121	456334152	/nfs/dbraw/zinc/33/41/52/456334152.db2.gz	XGXJUAZWPSBQFH-FQEVSTJZSA-N	0	3	332.488	3.326	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Cc1c(F)cccc1C#N)C(C)C	ZINC000352841083	456355572	/nfs/dbraw/zinc/35/55/72/456355572.db2.gz	YYRIZROUYNMJBH-IBGZPJMESA-N	0	3	343.446	3.055	20	30		EGEDHN
CN(C[C@@H](O)CSc1nc(-c2ccccc2)ccc1C#N)C1CC1	ZINC000290537723	456357954	/nfs/dbraw/zinc/35/79/54/456357954.db2.gz	DWPWSEJJGMWUBE-QGZVFWFLSA-N	0	3	339.464	3.167	20	30		EGEDHN
N#Cc1cccc(COc2cccc(CN[C@@H]3C=C[C@@H](CO)C3)c2)c1	ZINC000347781218	456364323	/nfs/dbraw/zinc/36/43/23/456364323.db2.gz	UHZOIVPUBOBOSK-UYAOXDASSA-N	0	3	334.419	3.164	20	30		EGEDHN
C=CCN1CC[C@H](N2CCCCC[C@@H]2C[C@H](O)c2ccccc2)C1=O	ZINC000282067989	456405795	/nfs/dbraw/zinc/40/57/95/456405795.db2.gz	SQWDXLIXFAWKFQ-AABGKKOBSA-N	0	3	342.483	3.142	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)CN(Cc1ccccc1)[C@H](C)C1CC1	ZINC000302806975	456407333	/nfs/dbraw/zinc/40/73/33/456407333.db2.gz	DLMHUGRNBRPALI-UZLBHIALSA-N	0	3	327.472	3.342	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)nc(C)n1	ZINC000347972637	456433355	/nfs/dbraw/zinc/43/33/55/456433355.db2.gz	YICLHQPTTWQAPC-ZDUSSCGKSA-N	0	3	330.731	3.145	20	30		EGEDHN
C=CCN(CCc1ccccc1)C(=O)NC[C@H]1CCCCN1CC	ZINC000303483218	456463534	/nfs/dbraw/zinc/46/35/34/456463534.db2.gz	QHOORAYTKZSCQW-LJQANCHMSA-N	0	3	329.488	3.301	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc3ccc(Cl)cc3n2)CC1	ZINC000282293614	456468134	/nfs/dbraw/zinc/46/81/34/456468134.db2.gz	LQCMYKJGYRIOJO-UHFFFAOYSA-N	0	3	327.815	3.172	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC2(Cc3ccccc3)CCC2)CC1	ZINC000353170447	456538208	/nfs/dbraw/zinc/53/82/08/456538208.db2.gz	XRTWUKUVYWWZOW-UHFFFAOYSA-N	0	3	327.472	3.101	20	30		EGEDHN
COc1cc([C@H](C)N[C@@H](C)c2cccc(C#N)c2)ccc1OCCO	ZINC000305756559	456555797	/nfs/dbraw/zinc/55/57/97/456555797.db2.gz	AIXUAMVDZCIOQO-GJZGRUSLSA-N	0	3	340.423	3.350	20	30		EGEDHN
CCN(CCN1CCCCCC1)C(=O)Nc1ccc(CC#N)cc1	ZINC000348243088	456564604	/nfs/dbraw/zinc/56/46/04/456564604.db2.gz	LDIPLRUDUTWMCT-UHFFFAOYSA-N	0	3	328.460	3.482	20	30		EGEDHN
C=C(C)COc1cc(CN2CCC([C@H](C)CO)CC2)ccc1OC	ZINC000651956237	462392301	/nfs/dbraw/zinc/39/23/01/462392301.db2.gz	QQEQJKFMEYWCDD-MRXNPFEDSA-N	0	3	333.472	3.491	20	30		EGEDHN
C=CCOCCCC(=O)N[C@@H]1CCN(Cc2ccccc2)CC1(C)C	ZINC000282640260	456578175	/nfs/dbraw/zinc/57/81/75/456578175.db2.gz	FBBQKAUDXWDHJS-LJQANCHMSA-N	0	3	344.499	3.386	20	30		EGEDHN
N#CCCCOc1cccc(CN[C@H]2CCO[C@H]2c2cccnc2)c1	ZINC000343392784	456586194	/nfs/dbraw/zinc/58/61/94/456586194.db2.gz	VQVMDXKGCYEJLG-PMACEKPBSA-N	0	3	337.423	3.384	20	30		EGEDHN
CCCCOC1CCN(C(=O)C(C#N)Cc2ccc(C#N)cc2)CC1	ZINC000348282332	456594716	/nfs/dbraw/zinc/59/47/16/456594716.db2.gz	VXYGVWFOOAFRNG-SFHVURJKSA-N	0	3	339.439	3.048	20	30		EGEDHN
COc1cc(NCCN[C@@H]2CCc3ccc(C#N)cc32)cc(OC)c1	ZINC000353274339	456603692	/nfs/dbraw/zinc/60/36/92/456603692.db2.gz	OSHYTRLZXBUZQZ-HXUWFJFHSA-N	0	3	337.423	3.264	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)CSCc1ccncc1)C(C)C	ZINC000299181257	456627961	/nfs/dbraw/zinc/62/79/61/456627961.db2.gz	ZKUAURDTGBBPOI-SFHVURJKSA-N	0	3	347.528	3.130	20	30		EGEDHN
CN(CC[C@@H]1CCCO1)Cc1cn(CCC#N)nc1-c1ccccc1	ZINC000343459578	456635546	/nfs/dbraw/zinc/63/55/46/456635546.db2.gz	DUFRMBATRIUJFJ-IBGZPJMESA-N	0	3	338.455	3.465	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)Nc2ncc(-c3ccccc3)s2)nc(C)n1	ZINC000340748898	456666610	/nfs/dbraw/zinc/66/66/10/456666610.db2.gz	YYVCCAAHPAPOLR-CQSZACIVSA-N	0	3	349.419	3.463	20	30		EGEDHN
COCCN1CCC(NC(=O)c2coc(C3CCCCC3)n2)CC1	ZINC000328756976	456753316	/nfs/dbraw/zinc/75/33/16/456753316.db2.gz	UQDVNBQYFASIIR-UHFFFAOYSA-N	0	3	335.448	3.138	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NCc2ccc(C#N)cc2)C1	ZINC000338316349	456769030	/nfs/dbraw/zinc/76/90/30/456769030.db2.gz	PPGFTGDBKKBEIT-OXJNMPFZSA-N	0	3	348.450	3.193	20	30		EGEDHN
C=CCC[C@@H](NCCN1CCNC1=O)c1ccc(C(F)(F)F)cc1	ZINC000343778503	456774081	/nfs/dbraw/zinc/77/40/81/456774081.db2.gz	YIWNBMATAQYSQD-OAHLLOKOSA-N	0	3	341.377	3.328	20	30		EGEDHN
Cc1ccc(C)c(NC(=O)[C@H](C)N2CCC[C@@H]2[C@H]2COCC[C@@H]2O)c1	ZINC000328858322	456778555	/nfs/dbraw/zinc/77/85/55/456778555.db2.gz	YHVVRCGWDKKBJN-ISARSNTHSA-N	0	3	346.471	3.142	20	30		EGEDHN
CN1CCC(Oc2ccc(CNC(=O)N[C@@H]3C=CCCC3)cc2)CC1	ZINC000328873667	456781826	/nfs/dbraw/zinc/78/18/26/456781826.db2.gz	JDWPGONUTHJBEO-QGZVFWFLSA-N	0	3	343.471	3.272	20	30		EGEDHN
CN1CCC(Oc2ccc(CNC(=O)NC[C@H]3CC3(C)C)cc2)CC1	ZINC000328879394	456783109	/nfs/dbraw/zinc/78/31/09/456783109.db2.gz	LIVAKUXAWYDTOF-MRXNPFEDSA-N	0	3	345.487	3.209	20	30		EGEDHN
COc1ccc([C@@H](CN(C)C)N[C@H]2CCc3ccc(C#N)cc32)cc1	ZINC000353592660	456789378	/nfs/dbraw/zinc/78/93/78/456789378.db2.gz	AXJUWVPMBNQBGU-LEWJYISDSA-N	0	3	335.451	3.447	20	30		EGEDHN
CSCC[C@@](C)(C#N)NC(=O)c1ccc(CN2CCCCC2)cc1	ZINC000344663769	456845637	/nfs/dbraw/zinc/84/56/37/456845637.db2.gz	HUGDTFAIBLEFNL-IBGZPJMESA-N	0	3	345.512	3.438	20	30		EGEDHN
C[C@@H](NC(=O)C(C#N)Cc1ccc(C#N)cc1)c1ccc(Cl)cn1	ZINC000338902650	456867272	/nfs/dbraw/zinc/86/72/72/456867272.db2.gz	KPBYIYYAGOLBIK-IUODEOHRSA-N	0	3	338.798	3.166	20	30		EGEDHN
N#CC(C(=O)c1cncc2ccccc21)c1nnc2n1CCCCC2	ZINC000329357873	456878053	/nfs/dbraw/zinc/87/80/53/456878053.db2.gz	BHFKQRGHFIWWBT-OAHLLOKOSA-N	0	3	331.379	3.043	20	30		EGEDHN
N#CC(C(=O)c1cncc2ccccc21)c1nnc2n1CCCCC2	ZINC000329357869	456878103	/nfs/dbraw/zinc/87/81/03/456878103.db2.gz	BHFKQRGHFIWWBT-HNNXBMFYSA-N	0	3	331.379	3.043	20	30		EGEDHN
C=CCc1cc(CN2CC[C@@H](COC(F)F)C2)cc(OC)c1O	ZINC000348870371	456884567	/nfs/dbraw/zinc/88/45/67/456884567.db2.gz	SLNBIGSGRYDHJR-GFCCVEGCSA-N	0	3	327.371	3.190	20	30		EGEDHN
CC(C#N)C(=O)NCc1nc2c(s1)C[C@H](c1ccccc1)CC2	ZINC000344986098	456887898	/nfs/dbraw/zinc/88/78/98/456887898.db2.gz	LFTMPEMOXAXEQT-GXTWGEPZSA-N	0	3	325.437	3.191	20	30		EGEDHN
C[C@@H]1C[C@H](C(=O)NC[C@H]2CCCN2Cc2ccccc2)CC(=O)N1	ZINC000329432075	456889334	/nfs/dbraw/zinc/88/93/34/456889334.db2.gz	KTULVIZNESJTDD-HYVNUMGLSA-N	0	3	329.444	3.363	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccc(N3CCC(C)CC3)nc2)nc(C)n1	ZINC000329524536	456904012	/nfs/dbraw/zinc/90/40/12/456904012.db2.gz	QMFTZIRPIRGMHX-KRWDZBQOSA-N	0	3	349.438	3.215	20	30		EGEDHN
CN(C(=O)N[C@H]1CCn2ccnc2C1)[C@H]1CC[C@@H](C(F)(F)F)CC1	ZINC000329663616	456924554	/nfs/dbraw/zinc/92/45/54/456924554.db2.gz	PGPLYLUNILZLMK-RWMBFGLXSA-N	0	3	344.381	3.165	20	30		EGEDHN
C[C@@H]1CN(CC(=O)NC(=O)NC23CC4CC(CC(C4)C2)C3)C[C@H]1C	ZINC000329801274	456942618	/nfs/dbraw/zinc/94/26/18/456942618.db2.gz	IZBJTXBXVNSLCZ-WWRWRHIGSA-N	0	3	333.476	3.414	20	30		EGEDHN
CCN1CCC[C@@H]1CNC(=O)N[C@@H]1CCCO[C@H]1c1ccc(C)cc1	ZINC000329936161	456963642	/nfs/dbraw/zinc/96/36/42/456963642.db2.gz	CXHQWGKDJFYBOH-QRVBRYPASA-N	0	3	345.487	3.203	20	30		EGEDHN
C[C@H]1CCN(Cc2cccc(OCc3cccc(C#N)c3)c2)C[C@H]1O	ZINC000349420754	456966861	/nfs/dbraw/zinc/96/68/61/456966861.db2.gz	RNPMEFBRMJCCHG-HRAATJIYSA-N	0	3	336.435	3.340	20	30		EGEDHN
C[C@H](N[C@@H]1CCC[C@]1(C)CO)C(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000329957837	456966892	/nfs/dbraw/zinc/96/68/92/456966892.db2.gz	QINIMQWBXUDUES-WNFPGIANSA-N	0	3	334.504	3.441	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NC[C@@H]1CCCCN1Cc1ccccc1	ZINC000345691247	456987959	/nfs/dbraw/zinc/98/79/59/456987959.db2.gz	MEFHAHAZUFVHKD-UFYCRDLUSA-N	0	3	342.483	3.139	20	30		EGEDHN
COc1ccc(CN[C@H]2[C@H]3CCO[C@H]3C23CCC3)cc1NC(C)=O	ZINC000330193933	456999258	/nfs/dbraw/zinc/99/92/58/456999258.db2.gz	AQWTZBQJHYFSKF-FHLIZLRMSA-N	0	3	330.428	3.350	20	30		EGEDHN
C[C@H](CNC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1)N(C)C	ZINC000358851046	457004782	/nfs/dbraw/zinc/00/47/82/457004782.db2.gz	IXVZFGRVBFFSNA-CYBMUJFWSA-N	0	3	341.386	3.170	20	30		EGEDHN
CCS(=O)(=O)c1ccc([C@@H](C)NCc2ccc(CC#N)cc2)cc1	ZINC000341965042	457028542	/nfs/dbraw/zinc/02/85/42/457028542.db2.gz	HNZOUDUYDGJZSY-OAHLLOKOSA-N	0	3	342.464	3.397	20	30		EGEDHN
C[C@H]1C[C@@H]1N1CCN(C(=O)c2cccc(SCC#N)c2)C[C@@H](C)C1	ZINC000346285324	457029240	/nfs/dbraw/zinc/02/92/40/457029240.db2.gz	YLSMIHLQOJFINB-MPGHIAIKSA-N	0	3	343.496	3.105	20	30		EGEDHN
C[C@@H](CN1C[C@H](C)C[C@H](C)C1)NC(=O)c1csc([N+](=O)[O-])c1	ZINC000330590369	457059261	/nfs/dbraw/zinc/05/92/61/457059261.db2.gz	YQTWPASNQVPKAI-TUAOUCFPSA-N	0	3	325.434	3.327	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1)OCC	ZINC000339374005	457073808	/nfs/dbraw/zinc/07/38/08/457073808.db2.gz	DEXGHRMOEKERHI-MOPGFXCFSA-N	0	3	330.472	3.139	20	30		EGEDHN
CCC1(CC)[C@H](N[C@H](C)C(=O)Nc2cccc(C#N)c2)C[C@H]1OC	ZINC000359421341	457083280	/nfs/dbraw/zinc/08/32/80/457083280.db2.gz	KKBTTYSUWJXFHY-KBRIMQKVSA-N	0	3	329.444	3.069	20	30		EGEDHN
C[C@@H](C1CCN(C)CC1)N(C)C(=O)C[C@H](CC#N)c1ccccc1	ZINC000356632016	457092118	/nfs/dbraw/zinc/09/21/18/457092118.db2.gz	JCFKPSQJFGVDMT-LPHOPBHVSA-N	0	3	327.472	3.263	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N(CCN(C)C)Cc1cccc(F)c1)OCC	ZINC000339400712	457095057	/nfs/dbraw/zinc/09/50/57/457095057.db2.gz	GSLFOZOXDDYHPS-SFHVURJKSA-N	0	3	336.451	3.087	20	30		EGEDHN
CC#CCCNCc1cn(Cc2ccccc2)nc1-c1cccnc1	ZINC000354177871	457113507	/nfs/dbraw/zinc/11/35/07/457113507.db2.gz	ITUPSLNQGTWNGF-UHFFFAOYSA-N	0	3	330.435	3.496	20	30		EGEDHN
Cc1ccc(NC(=O)c2c(F)cc(C#N)cc2F)c(CN(C)C)c1	ZINC000346781555	457166995	/nfs/dbraw/zinc/16/69/95/457166995.db2.gz	WGOFDSPZOHJEGR-UHFFFAOYSA-N	0	3	329.350	3.459	20	30		EGEDHN
CCCC[C@@H](NCC(=O)NC1(C#N)CCC1)c1ccc(OC)cc1	ZINC000346952212	457192038	/nfs/dbraw/zinc/19/20/38/457192038.db2.gz	VXEHWPCYIIZYAJ-QGZVFWFLSA-N	0	3	329.444	3.079	20	30		EGEDHN
CCc1cnc(CNC2CCN(c3ccc(C#N)cc3)CC2)s1	ZINC000360002512	457195946	/nfs/dbraw/zinc/19/59/46/457195946.db2.gz	YBCZBDMUNRQZEE-UHFFFAOYSA-N	0	3	326.469	3.336	20	30		EGEDHN
Cc1nc(NCCCCN2C[C@@H](C)O[C@@H](C)C2)c(Cl)cc1C#N	ZINC000360068971	457235705	/nfs/dbraw/zinc/23/57/05/457235705.db2.gz	BYDOMKAYBVUISC-BETUJISGSA-N	0	3	336.867	3.216	20	30		EGEDHN
COc1ccc(C2(CNC(=O)C(C)C#N)CCCCC2)cc1OC	ZINC000347121218	457240780	/nfs/dbraw/zinc/24/07/80/457240780.db2.gz	YVWNPZGXYXKRPO-AWEZNQCLSA-N	0	3	330.428	3.182	20	30		EGEDHN
Cn1c(C(=O)C(C#N)c2ccncn2)cc2cc(C(F)(F)F)ccc21	ZINC000354477027	457247663	/nfs/dbraw/zinc/24/76/63/457247663.db2.gz	SPWCVIFYRYXXFT-GFCCVEGCSA-N	0	3	344.296	3.477	20	30		EGEDHN
CC(C#N)C(=O)N1CCO[C@@H](c2cc(F)c(Cl)cc2Cl)C1	ZINC000347138482	457252064	/nfs/dbraw/zinc/25/20/64/457252064.db2.gz	QXKZUPDOJBNULO-ISVAXAHUSA-N	0	3	331.174	3.192	20	30		EGEDHN
C[C@@H](CO)N(Cc1ccc(Br)cc1C#N)C1CCCC1	ZINC000347171321	457268546	/nfs/dbraw/zinc/26/85/46/457268546.db2.gz	QIFWALDUAWQIDM-LBPRGKRZSA-N	0	3	337.261	3.446	20	30		EGEDHN
N#CCCCC(=O)N1CC[C@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000360309556	457301181	/nfs/dbraw/zinc/30/11/81/457301181.db2.gz	IDGZHOYWHOWZIO-HXUWFJFHSA-N	0	3	325.456	3.195	20	30		EGEDHN
C[C@H](CNC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)N(C)C	ZINC000347249430	457309924	/nfs/dbraw/zinc/30/99/24/457309924.db2.gz	NMCGBZPIAAAENA-OAHLLOKOSA-N	0	3	337.423	3.225	20	30		EGEDHN
N#C[C@@H](c1cccc(Cl)c1)N1CCN(C[C@H]2CCSC2)CC1	ZINC000355291891	457354717	/nfs/dbraw/zinc/35/47/17/457354717.db2.gz	OGFMXMZCNAKGTE-PBHICJAKSA-N	0	3	335.904	3.275	20	30		EGEDHN
C=CCNC(=O)NC(=O)[C@H](C)N[C@H](c1ccc(Cl)cc1)C(C)C	ZINC000357196766	457369713	/nfs/dbraw/zinc/36/97/13/457369713.db2.gz	DPUCNILSBUQHBG-WFASDCNBSA-N	0	3	337.851	3.027	20	30		EGEDHN
N#Cc1ccc(CNc2cccc(CN3CCC(O)CC3)c2)s1	ZINC000355393540	457369994	/nfs/dbraw/zinc/36/99/94/457369994.db2.gz	ZNMMCRNTQHXXLN-UHFFFAOYSA-N	0	3	327.453	3.189	20	30		EGEDHN
C=C[C@@H](CC(=O)NCC1(SC)CCN(C)CC1)c1ccccc1	ZINC000355438163	457374218	/nfs/dbraw/zinc/37/42/18/457374218.db2.gz	DIZDITXMRXFGEX-INIZCTEOSA-N	0	3	332.513	3.290	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CC(=O)N(c3ccccc3Cl)C2)cc1	ZINC000363618083	457383581	/nfs/dbraw/zinc/38/35/81/457383581.db2.gz	PVTNETKUUMCIJQ-OAHLLOKOSA-N	0	3	325.799	3.107	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1SCc1ncc(C)o1	ZINC000360864110	457390731	/nfs/dbraw/zinc/39/07/31/457390731.db2.gz	KDFZNSNWCKXSCW-UHFFFAOYSA-N	0	3	347.488	3.081	20	30		EGEDHN
C=CCc1cc(CN2CCC[C@H](c3ccnn3C)C2)cc(OC)c1O	ZINC000378338540	457391151	/nfs/dbraw/zinc/39/11/51/457391151.db2.gz	YUCTUKDBMHGZHV-KRWDZBQOSA-N	0	3	341.455	3.242	20	30		EGEDHN
CC1CC(C#N)(C(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H](C)C2)C1	ZINC000379718140	457418402	/nfs/dbraw/zinc/41/84/02/457418402.db2.gz	QEIUEERHSQSWPA-OUBFZGACSA-N	0	3	325.456	3.096	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)C2CCN(Cc3ccc(CC#N)cc3)CC2)C1	ZINC000342674939	457447606	/nfs/dbraw/zinc/44/76/06/457447606.db2.gz	XIGLZAANYJDZPP-QGZVFWFLSA-N	0	3	339.483	3.223	20	30		EGEDHN
Cc1nc(N[C@H]2CCN(Cc3ccccc3)CC2(C)C)ccc1C#N	ZINC000391040072	457449888	/nfs/dbraw/zinc/44/98/88/457449888.db2.gz	BOINFYKDUVDYLE-IBGZPJMESA-N	0	3	334.467	3.396	20	30		EGEDHN
COC[C@@H]1CCCCN([C@@H](C)C(=O)Nc2ccc(C#N)c(Cl)c2)C1	ZINC000342743654	457493666	/nfs/dbraw/zinc/49/36/66/457493666.db2.gz	QHZNUPLLHUEEHL-UONOGXRCSA-N	0	3	349.862	3.287	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)C1(C#N)CCCC1	ZINC000398171762	457496942	/nfs/dbraw/zinc/49/69/42/457496942.db2.gz	PAGFWIDHMUXMCJ-FUHWJXTLSA-N	0	3	325.456	3.097	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC(c3cccc(F)c3)CC2)CC1	ZINC000364265245	457550732	/nfs/dbraw/zinc/55/07/32/457550732.db2.gz	PSMMMIJXZWMLDM-UHFFFAOYSA-N	0	3	345.462	3.365	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)c1cccc(CC#N)c1	ZINC000370163987	457569886	/nfs/dbraw/zinc/56/98/86/457569886.db2.gz	VFQUHJFRDXDYCZ-LAUBAEHRSA-N	0	3	347.462	3.393	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)CC1	ZINC000357581017	457606067	/nfs/dbraw/zinc/60/60/67/457606067.db2.gz	LDYWHBLISUISCS-UHFFFAOYSA-N	0	3	343.383	3.111	20	30		EGEDHN
C=CCN1CC[C@H](N(CCc2ccccc2F)C2CCCC2)C1=O	ZINC000410337956	457638250	/nfs/dbraw/zinc/63/82/50/457638250.db2.gz	LQSXRSSBZFAUDE-IBGZPJMESA-N	0	3	330.447	3.400	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CN2CCC[C@H](c3ccccc3)C2)cc1	ZINC000433048511	457653930	/nfs/dbraw/zinc/65/39/30/457653930.db2.gz	XJRITWKRKWCLGS-PMACEKPBSA-N	0	3	336.435	3.178	20	30		EGEDHN
Cc1nccnc1[C@@H](C)N[C@H]1CCCN(c2ccc(C#N)cc2F)C1	ZINC000364735191	457683147	/nfs/dbraw/zinc/68/31/47/457683147.db2.gz	CZGCRGLRUSHCGD-ZBFHGGJFSA-N	0	3	339.418	3.115	20	30		EGEDHN
Cc1ccccc1[C@@H]([C@H](C)NC(=O)c1ccc(C#N)s1)N(C)C	ZINC000357859140	457714654	/nfs/dbraw/zinc/71/46/54/457714654.db2.gz	HITSZPGJPWYOHB-SUMWQHHRSA-N	0	3	327.453	3.349	20	30		EGEDHN
Cc1ccccc1[C@H]([C@@H](C)NC(=O)c1cc(C#N)cs1)N(C)C	ZINC000357877195	457720915	/nfs/dbraw/zinc/72/09/15/457720915.db2.gz	UJENXHIACOMJEJ-DYVFJYSZSA-N	0	3	327.453	3.349	20	30		EGEDHN
C[C@@H](O)[C@H]1C[C@H](C)CCN1CC#Cc1ccc(OC(F)(F)F)cc1	ZINC000443346022	457752235	/nfs/dbraw/zinc/75/22/35/457752235.db2.gz	LYKYXVSNXBHLBW-CKEIUWERSA-N	0	3	341.373	3.418	20	30		EGEDHN
COc1ccc(CNC(=O)C(C#N)CCc2ccccc2)cc1OC	ZINC000433122557	457761757	/nfs/dbraw/zinc/76/17/57/457761757.db2.gz	RESJMJKJOBHIQG-QGZVFWFLSA-N	0	3	338.407	3.093	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCCOc1cccc(F)c1	ZINC000433220066	457782225	/nfs/dbraw/zinc/78/22/25/457782225.db2.gz	JRTROTSYTGSJQR-MRXNPFEDSA-N	0	3	326.371	3.093	20	30		EGEDHN
C#Cc1ccc(CN2CCC(C(=O)Nc3ccc(C)cn3)CC2)cc1	ZINC000375081964	457784891	/nfs/dbraw/zinc/78/48/91/457784891.db2.gz	QFCRPAFOLOVCAH-UHFFFAOYSA-N	0	3	333.435	3.222	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NC[C@@H]1CCN(c2ccccc2)C1	ZINC000433231838	457786176	/nfs/dbraw/zinc/78/61/76/457786176.db2.gz	YUNPNQLEYAUJKR-PMACEKPBSA-N	0	3	347.462	3.402	20	30		EGEDHN
CC[C@H](CNC(=O)N(C)CC(C)(C)C#N)N1CCc2ccccc2C1	ZINC000457705706	457800705	/nfs/dbraw/zinc/80/07/05/457800705.db2.gz	ZTMCVJPGYJRJML-GOSISDBHSA-N	0	3	342.487	3.014	20	30		EGEDHN
Cc1ccc([C@@H](CNC(=O)[C@H](C#N)CCc2ccccc2)N(C)C)cc1	ZINC000433305243	457804275	/nfs/dbraw/zinc/80/42/75/457804275.db2.gz	PKFXKGUUXLWKKV-LEWJYISDSA-N	0	3	349.478	3.487	20	30		EGEDHN
CN(C)CCN(Cc1ccsc1)C(=O)c1c(F)cc(C#N)cc1F	ZINC000411113435	457805006	/nfs/dbraw/zinc/80/50/06/457805006.db2.gz	NGNUVNSCXRYACG-UHFFFAOYSA-N	0	3	349.406	3.102	20	30		EGEDHN
CC(C)CN(C(=O)[C@H](C#N)CCc1ccccc1)C1CCN(C)CC1	ZINC000433340097	457815537	/nfs/dbraw/zinc/81/55/37/457815537.db2.gz	ADVPGHMQIYCMAA-IBGZPJMESA-N	0	3	341.499	3.338	20	30		EGEDHN
C=CCNC(=O)NC(=O)[C@H](C)N[C@@H](CC(C)(C)C)c1ccc(F)cc1	ZINC000361841399	457900479	/nfs/dbraw/zinc/90/04/79/457900479.db2.gz	CTTUKUFKRXCRQT-BBRMVZONSA-N	0	3	349.450	3.293	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN[C@]2(CO)CCCc3ccccc32)cc1	ZINC000366921357	457910912	/nfs/dbraw/zinc/91/09/12/457910912.db2.gz	KNCXDKQLXRUJLM-KKSFZXQISA-N	0	3	336.435	3.291	20	30		EGEDHN
C#C[C@H](NC(=O)NC[C@@H]1CCCN(C)[C@@H]1c1cccs1)C(C)C	ZINC000366999666	457919907	/nfs/dbraw/zinc/91/99/07/457919907.db2.gz	XUWFEFSTTRRJTJ-ZOBUZTSGSA-N	0	3	333.501	3.088	20	30		EGEDHN
C=CCN(C)CCN(CC)[C@H](C)C(=O)N1CCC[C@H]1c1cccs1	ZINC000411637598	457937261	/nfs/dbraw/zinc/93/72/61/457937261.db2.gz	FZAMLKMGFKZWSU-SJORKVTESA-N	0	3	349.544	3.240	20	30		EGEDHN
C=CCN(C)CCN(CC)Cc1ncc(-c2ccc(OC)cc2)o1	ZINC000411643716	457937855	/nfs/dbraw/zinc/93/78/55/457937855.db2.gz	PTTITRXYORGPAR-UHFFFAOYSA-N	0	3	329.444	3.290	20	30		EGEDHN
C=C[C@H]1CCCCN1C(=O)C(=O)Nc1cccc(CN(CC)CC)c1	ZINC000427663794	458018025	/nfs/dbraw/zinc/01/80/25/458018025.db2.gz	POYKLUGONYEEEM-SFHVURJKSA-N	0	3	343.471	3.034	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)[C@H](C)Cc2cccc(F)c2)CC1	ZINC000458348291	458019718	/nfs/dbraw/zinc/01/97/18/458019718.db2.gz	YSARXIJDOZSFFY-OAHLLOKOSA-N	0	3	333.451	3.049	20	30		EGEDHN
C=CCS(=O)(=O)CCN[C@@H]1CCC[C@H]1c1ccccc1Cl	ZINC000368319613	458025651	/nfs/dbraw/zinc/02/56/51/458025651.db2.gz	STMYHIGJGHPSMY-GOEBONIOSA-N	0	3	327.877	3.167	20	30		EGEDHN
N#CC(C(=O)c1ccc(NC(N)=O)cc1)c1cc(C(F)(F)F)ccn1	ZINC000362117496	458031549	/nfs/dbraw/zinc/03/15/49/458031549.db2.gz	KDUIWUIDNNNOGL-GFCCVEGCSA-N	0	3	348.284	3.081	20	30		EGEDHN
C[C@H](c1ccccc1)N1CCC(NC(=O)NCC(C)(C)CC#N)CC1	ZINC000458393690	458034186	/nfs/dbraw/zinc/03/41/86/458034186.db2.gz	BJABEZAKIMYCFO-MRXNPFEDSA-N	0	3	342.487	3.451	20	30		EGEDHN
COC1([C@@H](C)NCC(=O)N(CCC#N)c2cc(C)cc(C)c2)CCC1	ZINC000412020041	458048675	/nfs/dbraw/zinc/04/86/75/458048675.db2.gz	JUPRXDVPPAJIHE-QGZVFWFLSA-N	0	3	343.471	3.097	20	30		EGEDHN
CC(C)C[C@@H](CN[C@@H](C)c1ccc(C#N)cc1F)N1CCOCC1	ZINC000358582927	458091264	/nfs/dbraw/zinc/09/12/64/458091264.db2.gz	FSUBIDGGHRGVCT-RDJZCZTQSA-N	0	3	333.451	3.095	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1CNC(=O)c1cccc(CN2CCCCC2)c1	ZINC000412306952	458162299	/nfs/dbraw/zinc/16/22/99/458162299.db2.gz	GGVWLFYSRAIQST-UXHICEINSA-N	0	3	342.483	3.384	20	30		EGEDHN
N#CC1(F)CCN(C(=O)c2cccc(CN3CCCCC3)c2)CC1	ZINC000412327740	458168768	/nfs/dbraw/zinc/16/87/68/458168768.db2.gz	AJZKOAOVAVRZOQ-UHFFFAOYSA-N	0	3	329.419	3.140	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1CNCc1ccc(OC)c(OC)c1Cl	ZINC000435733161	458192816	/nfs/dbraw/zinc/19/28/16/458192816.db2.gz	BAARDIJFNNKJTQ-CJNGLKHVSA-N	0	3	325.836	3.428	20	30		EGEDHN
Cn1cc(C(=O)C(C#N)c2nc3ccccc3o2)c2ccccc2c1=O	ZINC000429104520	458273103	/nfs/dbraw/zinc/27/31/03/458273103.db2.gz	FWWYMRDZKNHJQL-CQSZACIVSA-N	0	3	343.342	3.170	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1CN[C@H](C)c1nnn(-c2ccccc2)c1C	ZINC000436281025	458282539	/nfs/dbraw/zinc/28/25/39/458282539.db2.gz	CWUXBYNRYBPYIY-OGWOLHLISA-N	0	3	326.444	3.208	20	30		EGEDHN
CN(Cc1ccccc1)CC(C)(C)NC(=O)NCC(C)(C)CC#N	ZINC000459252829	458303235	/nfs/dbraw/zinc/30/32/35/458303235.db2.gz	CZGBXCLMAYCAHC-UHFFFAOYSA-N	0	3	330.476	3.136	20	30		EGEDHN
C[C@H](C(=O)Nc1cc(C#N)ccc1NC1CC1)N1[C@H](C)CC[C@@H]1C	ZINC000413766878	458306162	/nfs/dbraw/zinc/30/61/62/458306162.db2.gz	LZIIRWKFWCSWHS-HZSPNIEDSA-N	0	3	326.444	3.332	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NC(=O)N(C)C[C@H]1CCCN(C)C1	ZINC000413828489	458308358	/nfs/dbraw/zinc/30/83/58/458308358.db2.gz	UXXGLVTXBXLRFY-RBUKOAKNSA-N	0	3	329.488	3.157	20	30		EGEDHN
CN1CCc2ccc(C(=O)C(C#N)c3cnc4ccccc4n3)cc21	ZINC000447627999	458324086	/nfs/dbraw/zinc/32/40/86/458324086.db2.gz	FABGDORBYNVKJT-HNNXBMFYSA-N	0	3	328.375	3.112	20	30		EGEDHN
C=C(C)C[NH+]1CCC(NCc2cccc([O-])c2Br)CC1	ZINC000459407240	458361399	/nfs/dbraw/zinc/36/13/99/458361399.db2.gz	VJTYWIJMWJERRT-UHFFFAOYSA-N	0	3	339.277	3.285	20	30		EGEDHN
CC(C)(CCC#N)CNC(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000376662368	458363671	/nfs/dbraw/zinc/36/36/71/458363671.db2.gz	WWDNZBVBMUBAPX-GOSISDBHSA-N	0	3	342.487	3.280	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2nc3c(s2)CC(C)(C)CC3)CC1	ZINC000417661532	458366209	/nfs/dbraw/zinc/36/62/09/458366209.db2.gz	PUGVYTBHDLEGQL-UHFFFAOYSA-N	0	3	348.516	3.430	20	30		EGEDHN
CO[C@H](CNCc1cn(CCC#N)nc1-c1ccncc1)CC(C)C	ZINC000418088307	458371538	/nfs/dbraw/zinc/37/15/38/458371538.db2.gz	ACMCBEYONJKUJP-SFHVURJKSA-N	0	3	341.459	3.009	20	30		EGEDHN
Cc1ccc(CC(C)(C)NCC(=O)NC2(C#N)CCCCC2)cc1	ZINC000419310723	458380012	/nfs/dbraw/zinc/38/00/12/458380012.db2.gz	DDJIOHXIQSURBM-UHFFFAOYSA-N	0	3	327.472	3.248	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCc1cccc(Br)c1OC	ZINC000449549535	458427512	/nfs/dbraw/zinc/42/75/12/458427512.db2.gz	YVGWAYKFJMEYCP-KGLIPLIRSA-N	0	3	326.234	3.281	20	30		EGEDHN
CC(C)(C)O[C@@H]1C[C@@H](NCc2ccc(C#N)s2)[C@H]1n1cccn1	ZINC000449657168	458428397	/nfs/dbraw/zinc/42/83/97/458428397.db2.gz	NWYNTCBXMIFRNG-BZUAXINKSA-N	0	3	330.457	3.103	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN(C)[C@H]1CCC[C@H]1c1ccccc1	ZINC000459670962	458442447	/nfs/dbraw/zinc/44/24/47/458442447.db2.gz	GHFJTVBIYCYWBN-NEWSRXKRSA-N	0	3	327.472	3.263	20	30		EGEDHN
COCCN(CCN(C)Cc1ccccc1)Cc1ccc(C#N)cc1	ZINC000450310428	458445566	/nfs/dbraw/zinc/44/55/66/458445566.db2.gz	AOUODVUQGLRTTO-UHFFFAOYSA-N	0	3	337.467	3.139	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N[C@H]1C[C@@H](OC)C12CCC2	ZINC000459746643	458467177	/nfs/dbraw/zinc/46/71/77/458467177.db2.gz	FWEGECBOCXLIMQ-BHYGNILZSA-N	0	3	348.512	3.198	20	30		EGEDHN
C[C@@H]1C[C@H](c2ccccc2)[C@H](C)N1CC(=O)NCc1ccc(C#N)cc1	ZINC000451182227	458468950	/nfs/dbraw/zinc/46/89/50/458468950.db2.gz	INKWDJDUVUDFLM-WWMYMODYSA-N	0	3	347.462	3.441	20	30		EGEDHN
CN(CCOc1ccc(C#N)cc1)[C@H](CO)c1ccc(Cl)cc1	ZINC000451329513	458473935	/nfs/dbraw/zinc/47/39/35/458473935.db2.gz	XIPPKGIITXKGEM-GOSISDBHSA-N	0	3	330.815	3.256	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCC(=O)N[C@H](c1ccccc1)C1CCCCC1	ZINC000451601577	458482476	/nfs/dbraw/zinc/48/24/76/458482476.db2.gz	ASTHTZKQIXGSPZ-SVFBPWRDSA-N	0	3	342.483	3.357	20	30		EGEDHN
CC(C)Cc1ccc([C@H](CNC(=O)[C@]2(C#N)C[C@H]2C)N(C)C)cc1	ZINC000451773885	458487070	/nfs/dbraw/zinc/48/70/70/458487070.db2.gz	NMNPZLZOYOYOOB-BPAFIMBUSA-N	0	3	327.472	3.154	20	30		EGEDHN
C=CCC[C@H](CO)N[C@H](C)c1ccccc1I	ZINC000453346464	458524418	/nfs/dbraw/zinc/52/44/18/458524418.db2.gz	IDSDZBFOXOIPIH-VXGBXAGGSA-N	0	3	345.224	3.269	20	30		EGEDHN
Cc1nc(C(C)C)ccc1C(=O)C(C#N)c1nnc2n1CCCCC2	ZINC000453630297	458538751	/nfs/dbraw/zinc/53/87/51/458538751.db2.gz	YUCBRGPHYOIEOJ-HNNXBMFYSA-N	0	3	337.427	3.321	20	30		EGEDHN
COc1ccc([C@H]2CCCCCN2C(=O)[C@H](N)CCCC#N)cc1	ZINC000424062536	458549425	/nfs/dbraw/zinc/54/94/25/458549425.db2.gz	LCESAGPZCFWPAT-QZTJIDSGSA-N	0	3	329.444	3.160	20	30		EGEDHN
CCOC(=O)c1cc2cc(NC(=O)[C@H](N)CCCC#N)ccc2s1	ZINC000424078796	458553569	/nfs/dbraw/zinc/55/35/69/458553569.db2.gz	FDUCKZFKOMLGLM-CYBMUJFWSA-N	0	3	345.424	3.038	20	30		EGEDHN
Cc1nc(NC(=O)[C@@H](N)CCCC#N)sc1Cc1ccccc1F	ZINC000424089966	458557092	/nfs/dbraw/zinc/55/70/92/458557092.db2.gz	JOSRXUIPOUOUQE-AWEZNQCLSA-N	0	3	346.431	3.141	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)NCCSCc1cccc2ccccc21	ZINC000424108845	458560169	/nfs/dbraw/zinc/56/01/69/458560169.db2.gz	YQBQLDQWBCXFBY-GOSISDBHSA-N	0	3	341.480	3.210	20	30		EGEDHN
CC(C)(Cc1ccc(Cl)cc1Cl)NC(=O)[C@H](N)CCCC#N	ZINC000424119543	458563255	/nfs/dbraw/zinc/56/32/55/458563255.db2.gz	DYIAZNBRVVGKRD-CQSZACIVSA-N	0	3	342.270	3.452	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2C[C@@H]3[C@@H]4CC[C@@H](C4)[C@@]3(C)C2)CC1	ZINC000454462227	458563968	/nfs/dbraw/zinc/56/39/68/458563968.db2.gz	KHBVNYOWSDTMBJ-YNVMFWSZSA-N	0	3	331.504	3.105	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1ccc(COCc2ccccc2)cc1	ZINC000424122722	458564234	/nfs/dbraw/zinc/56/42/34/458564234.db2.gz	JREOXMGEHOTBHG-IBGZPJMESA-N	0	3	337.423	3.363	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)NC[C@@H](Cc1ccccc1)c1ccccc1	ZINC000424127039	458565408	/nfs/dbraw/zinc/56/54/08/458565408.db2.gz	PQRJRGMIHIWAQD-UXHICEINSA-N	0	3	335.451	3.150	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)NCCCC#N)N(CC)CC)cc1	ZINC000431463922	458576150	/nfs/dbraw/zinc/57/61/50/458576150.db2.gz	JQRJCRDKOPUOOP-GOSISDBHSA-N	0	3	330.476	3.235	20	30		EGEDHN
N#CCc1cccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000455956054	458623542	/nfs/dbraw/zinc/62/35/42/458623542.db2.gz	XJHSCYTUJQQXHW-IBGZPJMESA-N	0	3	334.423	3.149	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1)C(=O)Nc1cccc(CC#N)c1	ZINC000455946238	458623739	/nfs/dbraw/zinc/62/37/39/458623739.db2.gz	MRBULBTZNHBLFX-UHFFFAOYSA-N	0	3	336.439	3.348	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1CC[C@@](C)(CCc2ccccc2)C1	ZINC000470366436	458632773	/nfs/dbraw/zinc/63/27/73/458632773.db2.gz	DYMWECBAERKYGZ-WIYYLYMNSA-N	0	3	341.499	3.339	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CCN(Cc2ccccc2)C[C@H](C)C1)OCC	ZINC000456338924	458637393	/nfs/dbraw/zinc/63/73/93/458637393.db2.gz	OPBXRBZQIYDERG-ICSRJNTNSA-N	0	3	344.499	3.338	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CC[C@H](C(F)(F)F)[C@@H]1C	ZINC000470952679	458668012	/nfs/dbraw/zinc/66/80/12/458668012.db2.gz	GQDBUOYRQWLDGB-IMJJTQAJSA-N	0	3	343.389	3.428	20	30		EGEDHN
CC#CCCCC(=O)NC[C@H](C(C)C)N1CCc2ccccc2C1	ZINC000464540531	458759662	/nfs/dbraw/zinc/75/96/62/458759662.db2.gz	KQUAGIGDIQWPBM-HXUWFJFHSA-N	0	3	326.484	3.379	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)CN1CCC[C@](C)(c2ccccc2)CC1	ZINC000510079914	458774493	/nfs/dbraw/zinc/77/44/93/458774493.db2.gz	QYONQUQHHWLSRZ-LEWJYISDSA-N	0	3	341.499	3.485	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)[C@@H](C)N1CC[C@@H](Cc2ccccc2)[C@H]1C	ZINC000472339025	458787907	/nfs/dbraw/zinc/78/79/07/458787907.db2.gz	BBVYRBCUWJHIAB-PLOVASNDSA-N	0	3	341.499	3.382	20	30		EGEDHN
C[C@@H]1[C@H](Cc2ccccc2)CCN1CC(=O)NC1(C#N)CCCCC1	ZINC000472354662	458790920	/nfs/dbraw/zinc/79/09/20/458790920.db2.gz	VFXQCVSYYGAVGX-MJGOQNOKSA-N	0	3	339.483	3.282	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@H]1CCCN(Cc2ccc(CC#N)cc2)C1	ZINC000495256237	458820965	/nfs/dbraw/zinc/82/09/65/458820965.db2.gz	YRTGAEYDANEVBQ-GOSISDBHSA-N	0	3	343.471	3.489	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccnn2CCC(C)C)CC1	ZINC000547994129	458821245	/nfs/dbraw/zinc/82/12/45/458821245.db2.gz	QAUMQVOCDADVAF-UHFFFAOYSA-N	0	3	333.480	3.091	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccnc(N3CCC[C@@H](C)C3)c2)nc(C)n1	ZINC000517004089	458825620	/nfs/dbraw/zinc/82/56/20/458825620.db2.gz	JOFOFCPORRKAPX-DYVFJYSZSA-N	0	3	349.438	3.215	20	30		EGEDHN
COc1cc(CNCCCN(C)c2ccccc2F)ccc1C#N	ZINC000440823625	458858886	/nfs/dbraw/zinc/85/88/86/458858886.db2.gz	RWXVXEPLJZZWKL-UHFFFAOYSA-N	0	3	327.403	3.322	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1	ZINC000551464999	458889006	/nfs/dbraw/zinc/88/90/06/458889006.db2.gz	RKTNDUSBMOWVQA-CALCHBBNSA-N	0	3	336.520	3.327	20	30		EGEDHN
C=CC[C@@H](CC)NC(=O)N(CCN(C)C)Cc1ccc(F)cc1F	ZINC000466379252	458896892	/nfs/dbraw/zinc/89/68/92/458896892.db2.gz	WOEKCDVVVBKEGH-MRXNPFEDSA-N	0	3	339.430	3.393	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccc(C(C)(C)C#N)cc1)N1CCCC[C@@H]1C	ZINC000474890227	458905626	/nfs/dbraw/zinc/90/56/26/458905626.db2.gz	UGEPHKRMWGFUHI-HOTGVXAUSA-N	0	3	327.472	3.480	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@@H](CCNC[C@@H](C#N)CCC#N)C1	ZINC000495645693	458907221	/nfs/dbraw/zinc/90/72/21/458907221.db2.gz	UNCYRSJDSATVLX-JKSUJKDBSA-N	0	3	334.464	3.057	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@]1(C)CCN(Cc2cccc(C#N)c2)C1	ZINC000495790336	458955983	/nfs/dbraw/zinc/95/59/83/458955983.db2.gz	ZXSWGDSRQZZACV-LJQANCHMSA-N	0	3	329.444	3.295	20	30		EGEDHN
CCc1nnc(NCCN(C)Cc2ccc(F)cc2)c(C#N)c1CC	ZINC000467782361	458986992	/nfs/dbraw/zinc/98/69/92/458986992.db2.gz	CUOWXYKGWQKTAJ-UHFFFAOYSA-N	0	3	341.434	3.156	20	30		EGEDHN
CC[C@@H](CN[C@H]1CCc2ccc(C#N)cc21)NC(=O)OC(C)(C)C	ZINC000495925492	459007590	/nfs/dbraw/zinc/00/75/90/459007590.db2.gz	XYEWKSAWEJPVQR-RDJZCZTQSA-N	0	3	329.444	3.438	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(CN[C@@H]3CC[C@H](C#N)C3)cc2)C[C@H](C)O1	ZINC000442722337	459027227	/nfs/dbraw/zinc/02/72/27/459027227.db2.gz	VDMLHHYCSIDDJX-ACZWYYKOSA-N	0	3	327.472	3.078	20	30		EGEDHN
C=CCNC(=O)CN[C@H]1CC[C@@H](c2ccc(C(F)(F)F)cc2)C1	ZINC000442829274	459043735	/nfs/dbraw/zinc/04/37/35/459043735.db2.gz	UMPFCNHOOQROOO-HIFRSBDPSA-N	0	3	326.362	3.233	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNC[C@@H](C#N)CCC#N	ZINC000496038758	459045950	/nfs/dbraw/zinc/04/59/50/459045950.db2.gz	GNCONHOEVCEABZ-HZPDHXFCSA-N	0	3	334.464	3.199	20	30		EGEDHN
COc1cc(CN(CCc2ccccc2)[C@H]2CCOC2)ccc1C#N	ZINC000442886829	459053985	/nfs/dbraw/zinc/05/39/85/459053985.db2.gz	UREQRNLSJQYWSG-FQEVSTJZSA-N	0	3	336.435	3.400	20	30		EGEDHN
C=CCN(CCn1cnc2ccccc2c1=O)CC1CCCCC1	ZINC000532571646	459112369	/nfs/dbraw/zinc/11/23/69/459112369.db2.gz	RGYIXWZHFFYLGU-UHFFFAOYSA-N	0	3	325.456	3.465	20	30		EGEDHN
C=CC1CCN(C(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000521175764	459125342	/nfs/dbraw/zinc/12/53/42/459125342.db2.gz	UHSHEAATJVCNKY-LJQANCHMSA-N	0	3	327.472	3.259	20	30		EGEDHN
C=CC1CCN(C(=O)N[C@H]2CCCN(Cc3ccccc3)C2)CC1	ZINC000521175763	459125381	/nfs/dbraw/zinc/12/53/81/459125381.db2.gz	UHSHEAATJVCNKY-IBGZPJMESA-N	0	3	327.472	3.259	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CC[C@@H](c2cccnc2)C1	ZINC000578010077	459132062	/nfs/dbraw/zinc/13/20/62/459132062.db2.gz	VVQWAXBQTKPCIK-UXHICEINSA-N	0	3	338.451	3.039	20	30		EGEDHN
C[C@@H](C1CCN(C)CC1)N(C)C(=O)c1cccc(SCC#N)c1	ZINC000479551726	459148424	/nfs/dbraw/zinc/14/84/24/459148424.db2.gz	WIVUNXMWFULWFF-AWEZNQCLSA-N	0	3	331.485	3.105	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](N3CCN(C(C)C)CC3)C2)CCCCC1	ZINC000590677281	459178585	/nfs/dbraw/zinc/17/85/85/459178585.db2.gz	QYXVACSKFFSKOD-IBGZPJMESA-N	0	3	347.547	3.140	20	30		EGEDHN
CN(Cc1ccccc1)[C@H]1CCN(c2cccc(C#N)c2[N+](=O)[O-])C1	ZINC000590691243	459183580	/nfs/dbraw/zinc/18/35/80/459183580.db2.gz	MBLHDXZYGPSSFP-KRWDZBQOSA-N	0	3	336.395	3.177	20	30		EGEDHN
CCCN(Cc1cnc2c(C#N)cnn2c1)[C@H]1C[C@H](OCC)C1(C)C	ZINC000578508031	459212340	/nfs/dbraw/zinc/21/23/40/459212340.db2.gz	KVUUZLKKTOQWNX-IRXDYDNUSA-N	0	3	341.459	3.017	20	30		EGEDHN
CC(C)C[C@@H](CN1CCCC1)NC(=O)N[C@H](C)c1cccc(C#N)c1	ZINC000590807513	459229300	/nfs/dbraw/zinc/22/93/00/459229300.db2.gz	IJBNROKJCXLAPW-APWZRJJASA-N	0	3	342.487	3.429	20	30		EGEDHN
C=CCC1(CNCCS(=O)(=O)c2ccc(C#N)cc2)CCCC1	ZINC000579701507	459250882	/nfs/dbraw/zinc/25/08/82/459250882.db2.gz	IEPQXZBQJBWUAX-UHFFFAOYSA-N	0	3	332.469	3.058	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN[C@H](CC)c1ccncc1	ZINC000579704390	459251007	/nfs/dbraw/zinc/25/10/07/459251007.db2.gz	SNRZWJRBAUSTMX-RTBURBONSA-N	0	3	326.440	3.291	20	30		EGEDHN
C[C@H](NC[C@H](O)COc1ccc(CC#N)cc1)c1ccccc1Cl	ZINC000580456052	459260126	/nfs/dbraw/zinc/26/01/26/459260126.db2.gz	LRKNCYDRFIKYOD-HOCLYGCPSA-N	0	3	344.842	3.497	20	30		EGEDHN
Cc1cc(C(C)(C)C)cc(C)c1CCNC(=O)[C@H](N)CCCC#N	ZINC000580768261	459264828	/nfs/dbraw/zinc/26/48/28/459264828.db2.gz	HYXICQLQLURBSE-GOSISDBHSA-N	0	3	329.488	3.281	20	30		EGEDHN
N#Cc1ccc(CCN2CCC(NC(=O)Nc3ccccc3)CC2)cc1	ZINC000595359423	459284589	/nfs/dbraw/zinc/28/45/89/459284589.db2.gz	JOFBZLLYMJFTEQ-UHFFFAOYSA-N	0	3	348.450	3.387	20	30		EGEDHN
N#C[C@H](c1ccccc1)N1CCN(CC2Cc3ccccc3C2)CC1	ZINC000568465396	459290194	/nfs/dbraw/zinc/29/01/94/459290194.db2.gz	XLXIKXISGWTDHK-JOCHJYFZSA-N	0	3	331.463	3.284	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)N1CCC[C@@H](CC#N)C1)c1ccccc1	ZINC000595428286	459297947	/nfs/dbraw/zinc/29/79/47/459297947.db2.gz	XBSBNGZIBHUKPI-HKUYNNGSSA-N	0	3	342.487	3.405	20	30		EGEDHN
C[C@H](c1ccccc1)[C@@H](CO)NC(=O)C(C#N)CCc1ccccc1	ZINC000591320258	459353937	/nfs/dbraw/zinc/35/39/37/459353937.db2.gz	YJSMRISYTGRTMQ-NSISKUIASA-N	0	3	336.435	3.040	20	30		EGEDHN
C=C(C)[C@@H](NC(=O)N1CCN(C)CC[C@H]1C)c1ccc(F)c(F)c1	ZINC000483300120	459357853	/nfs/dbraw/zinc/35/78/53/459357853.db2.gz	YVVADLYDZLUBEC-CXAGYDPISA-N	0	3	337.414	3.318	20	30		EGEDHN
CC(C)(C)c1ccc(OC[C@@H](O)CN2CCC[C@@H](CC#N)C2)cc1	ZINC000595608908	459363565	/nfs/dbraw/zinc/36/35/65/459363565.db2.gz	BPTKMJNOJNCKHA-WMZOPIPTSA-N	0	3	330.472	3.349	20	30		EGEDHN
N#CC[C@H]1CCCN(C[C@@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000595609126	459363798	/nfs/dbraw/zinc/36/37/98/459363798.db2.gz	GOAWNVIDBFRCPQ-TZMCWYRMSA-N	0	3	343.254	3.359	20	30		EGEDHN
N#CC1(CNC(=O)N[C@H](CN2CCCCC2)c2ccccc2)CCC1	ZINC000591389340	459369650	/nfs/dbraw/zinc/36/96/50/459369650.db2.gz	MDHADYAZYXUJEY-GOSISDBHSA-N	0	3	340.471	3.207	20	30		EGEDHN
C=C(CC)CN1CCN(CCCc2nc(-c3cccs3)no2)CC1	ZINC000539115180	459374798	/nfs/dbraw/zinc/37/47/98/459374798.db2.gz	AERZCCPEKSDVDA-UHFFFAOYSA-N	0	3	346.500	3.315	20	30		EGEDHN
C=CCN(C(=O)NC[C@@H](CC)N1CCc2ccccc2C1)C1CC1	ZINC000540059994	459379930	/nfs/dbraw/zinc/37/99/30/459379930.db2.gz	RPZUVBRTWQQQRN-GOSISDBHSA-N	0	3	327.472	3.183	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1)OCC	ZINC000569090621	459392986	/nfs/dbraw/zinc/39/29/86/459392986.db2.gz	HQTURXGSZXBYJC-IAGOWNOFSA-N	0	3	338.879	3.430	20	30		EGEDHN
COC[C@H](NCCCOc1cccc(C#N)c1)c1cccc(OC)c1	ZINC000595682592	459395044	/nfs/dbraw/zinc/39/50/44/459395044.db2.gz	BXJXGLOJESQNAL-FQEVSTJZSA-N	0	3	340.423	3.313	20	30		EGEDHN
N#Cc1cnn2c1NC[C@@H](CN1CCC[C@H]1c1cccc(Cl)c1)C2	ZINC000569104842	459395621	/nfs/dbraw/zinc/39/56/21/459395621.db2.gz	ZVHMHXTXNNOMLV-GUYCJALGSA-N	0	3	341.846	3.287	20	30		EGEDHN
N#CCC1CCN(C(=O)N[C@H](CN2CCCC2)c2ccccc2)CC1	ZINC000540985807	459414892	/nfs/dbraw/zinc/41/48/92/459414892.db2.gz	BINFIZLYSPLIBK-LJQANCHMSA-N	0	3	340.471	3.159	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@H](Nc2nc3ccccn3c2C#N)C1	ZINC000541114440	459428413	/nfs/dbraw/zinc/42/84/13/459428413.db2.gz	WIVUTZCHYVQDLA-RDJZCZTQSA-N	0	3	331.423	3.453	20	30		EGEDHN
Cc1cc(C)cc(OC[C@@H](O)CNCc2ccc(C#N)c(Cl)c2)c1	ZINC000591765718	459431268	/nfs/dbraw/zinc/43/12/68/459431268.db2.gz	CFPUDVGZGCHQDN-KRWDZBQOSA-N	0	3	344.842	3.358	20	30		EGEDHN
C=CCSCCN[C@@H](CN1CCOCC1)c1ccc(CC)cc1	ZINC000541571108	459467463	/nfs/dbraw/zinc/46/74/63/459467463.db2.gz	OGFAERODADHDIJ-IBGZPJMESA-N	0	3	334.529	3.131	20	30		EGEDHN
C=CCSCCN[C@H](CN1CCOCC1)c1ccc(CC)cc1	ZINC000541571110	459467698	/nfs/dbraw/zinc/46/76/98/459467698.db2.gz	OGFAERODADHDIJ-LJQANCHMSA-N	0	3	334.529	3.131	20	30		EGEDHN
CN(C)[C@@H](CNC(=O)N1CCC(CCC#N)CC1)c1ccccc1	ZINC000591893952	459470448	/nfs/dbraw/zinc/47/04/48/459470448.db2.gz	JUBWDKNCJCIOJW-SFHVURJKSA-N	0	3	328.460	3.015	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@H](N[C@H]3CCc4cc(F)ccc43)C2=O)cc1	ZINC000541881726	459506426	/nfs/dbraw/zinc/50/64/26/459506426.db2.gz	NCQLGEUAEQGVKG-PMACEKPBSA-N	0	3	349.409	3.470	20	30		EGEDHN
CCCN(C(=O)N[C@@H]1CCCc2cc(C#N)ccc21)[C@H]1CCN(C)C1	ZINC000592034448	459514523	/nfs/dbraw/zinc/51/45/23/459514523.db2.gz	MIJAAQWKNLQPOW-PKOBYXMFSA-N	0	3	340.471	3.061	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCc2ccc([C@H]3C[C@H]3C)o2)CC1	ZINC000592076553	459521174	/nfs/dbraw/zinc/52/11/74/459521174.db2.gz	FGIHRJAJRXVKAR-QAPCUYQASA-N	0	3	330.472	3.492	20	30		EGEDHN
C[C@@H](CNC(=O)c1cn(CCCC#N)c2ccccc12)N1CCCC1	ZINC000569909588	459529605	/nfs/dbraw/zinc/52/96/05/459529605.db2.gz	XUUIOIUKYRZUKZ-INIZCTEOSA-N	0	3	338.455	3.159	20	30		EGEDHN
COCCN(CC(=O)Nc1cc(Cl)ccc1C#N)[C@H]1CCC[C@H]1C	ZINC000487948765	459535829	/nfs/dbraw/zinc/53/58/29/459535829.db2.gz	ARCBTPVSLPNYNA-DYVFJYSZSA-N	0	3	349.862	3.287	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N1CC[C@H](C(=O)NCc2ccccc2)C1	ZINC000592154779	459537993	/nfs/dbraw/zinc/53/79/93/459537993.db2.gz	JLZXXECIRAGKNB-UZLBHIALSA-N	0	3	333.435	3.258	20	30		EGEDHN
Cc1nc(NCC2CCN(Cc3cccs3)CC2)ccc1C#N	ZINC000488075405	459537999	/nfs/dbraw/zinc/53/79/99/459537999.db2.gz	KNMSAYRYKUFUNX-UHFFFAOYSA-N	0	3	326.469	3.069	20	30		EGEDHN
Cc1cc(CN2CCC[C@@H](c3nnc4ccccn43)C2)ccc1C#N	ZINC000488105418	459539005	/nfs/dbraw/zinc/53/90/05/459539005.db2.gz	VJJWGRAYGOYQDX-GOSISDBHSA-N	0	3	331.423	3.289	20	30		EGEDHN
CCN(CCc1cccs1)[C@H](C)C(=O)NC1(C#N)CCCCC1	ZINC000488322531	459541913	/nfs/dbraw/zinc/54/19/13/459541913.db2.gz	JLQGQHOCLZRPII-OAHLLOKOSA-N	0	3	333.501	3.344	20	30		EGEDHN
Cc1cc(CN2CCC(CCCN3CCOCC3)CC2)ccc1C#N	ZINC000488309350	459542439	/nfs/dbraw/zinc/54/24/39/459542439.db2.gz	FHEHUJFVONCXIT-UHFFFAOYSA-N	0	3	341.499	3.191	20	30		EGEDHN
Cc1cccc([C@H]2CCN(C[C@H](O)COc3ccc(C#N)cc3)C2)c1	ZINC000542319569	459548404	/nfs/dbraw/zinc/54/84/04/459548404.db2.gz	KBUUOOOFCDOXKN-PMACEKPBSA-N	0	3	336.435	3.096	20	30		EGEDHN
C[C@@H]1C[C@H]1N1CCN(c2nc(C(F)(F)F)ccc2C#N)C[C@@H](C)C1	ZINC000488738388	459549826	/nfs/dbraw/zinc/54/98/26/459549826.db2.gz	YXNMCRPEJUVPTH-OUCADQQQSA-N	0	3	338.377	3.139	20	30		EGEDHN
C[C@H]1C[C@@H]1N1CCN(c2nc3cc(Cl)ccn3c2C#N)C[C@@H](C)C1	ZINC000488735816	459550673	/nfs/dbraw/zinc/55/06/73/459550673.db2.gz	PLMBUIKKJMCUEY-YDHLFZDLSA-N	0	3	343.862	3.026	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CC[C@H]2Cc2ccccc2)cc1	ZINC000526928270	459560662	/nfs/dbraw/zinc/56/06/62/459560662.db2.gz	UDTBYQAQTDLWSP-UXHICEINSA-N	0	3	329.403	3.084	20	30		EGEDHN
N#Cc1nc(NC[C@H]2CCN(Cc3ccccc3)C2)sc1Cl	ZINC000596223186	459565492	/nfs/dbraw/zinc/56/54/92/459565492.db2.gz	NUENRARBHUBEJU-CYBMUJFWSA-N	0	3	332.860	3.024	20	30		EGEDHN
N#CCCC1CCN(Cc2c[nH]nc2-c2ccc3c(c2)OCO3)CC1	ZINC000583631678	459571118	/nfs/dbraw/zinc/57/11/18/459571118.db2.gz	YFUVWVNGNTWTDG-UHFFFAOYSA-N	0	3	338.411	3.321	20	30		EGEDHN
C=CCn1cccc1C(=O)N(C)C1CCN(Cc2ccccc2)CC1	ZINC000490027256	459574983	/nfs/dbraw/zinc/57/49/83/459574983.db2.gz	ASJAQIHYKJPZLY-UHFFFAOYSA-N	0	3	337.467	3.411	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N1Cc2ccccc2C1)C(C)C	ZINC000592346790	459577580	/nfs/dbraw/zinc/57/75/80/459577580.db2.gz	IKJAZHHMTQVOPF-IBGZPJMESA-N	0	3	327.472	3.410	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc3[nH]c(C(F)F)nc3c2)CC1	ZINC000592379468	459587222	/nfs/dbraw/zinc/58/72/22/459587222.db2.gz	BDAZQGRTCAQNSQ-UHFFFAOYSA-N	0	3	348.397	3.271	20	30		EGEDHN
Cc1nsc(NCC2CCN(Cc3ccncc3)CC2)c1C#N	ZINC000596436325	459635635	/nfs/dbraw/zinc/63/56/35/459635635.db2.gz	LJYBOTKXMLJDOJ-UHFFFAOYSA-N	0	3	327.457	3.042	20	30		EGEDHN
CN(Cc1ccccc1)C1(CNC(=O)c2sccc2C#N)CCC1	ZINC000573198311	459640796	/nfs/dbraw/zinc/64/07/96/459640796.db2.gz	HVHSNXINWYIKTH-UHFFFAOYSA-N	0	3	339.464	3.404	20	30		EGEDHN
N#C[C@@H](c1ccc(Br)cc1)N1CCN(CCC2CC2)CC1	ZINC000501064581	459710199	/nfs/dbraw/zinc/71/01/99/459710199.db2.gz	XYDWWLNVBLIYED-KRWDZBQOSA-N	0	3	348.288	3.431	20	30		EGEDHN
C=CCN(CC=C)C(=O)NC[C@H](CC)N1CCc2ccccc2C1	ZINC000501387509	459725029	/nfs/dbraw/zinc/72/50/29/459725029.db2.gz	NWLSAEMMJGAZGY-IBGZPJMESA-N	0	3	327.472	3.207	20	30		EGEDHN
CCc1ccc([C@@H]2CCN(Cc3cnc4c(C#N)cnn4c3)C2)cc1	ZINC000563151121	459725268	/nfs/dbraw/zinc/72/52/68/459725268.db2.gz	QFOBSCWDQHDROD-GOSISDBHSA-N	0	3	331.423	3.153	20	30		EGEDHN
CN(CCCNC(=O)CC1(C#N)CCCCC1)Cc1ccccc1	ZINC000596680490	459725858	/nfs/dbraw/zinc/72/58/58/459725858.db2.gz	PZQFUMFISORAAV-UHFFFAOYSA-N	0	3	327.472	3.489	20	30		EGEDHN
N#CC1(CC(=O)N[C@H]2CCN(Cc3ccccc3)C2)CCCCC1	ZINC000596681548	459727150	/nfs/dbraw/zinc/72/71/50/459727150.db2.gz	LESLJXWAYUFSIM-SFHVURJKSA-N	0	3	325.456	3.241	20	30		EGEDHN
N#CCc1ccc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)cc1	ZINC000593014665	459739647	/nfs/dbraw/zinc/73/96/47/459739647.db2.gz	CGCAPMNYRLOFIK-UONOGXRCSA-N	0	3	326.318	3.439	20	30		EGEDHN
CN(C)CCOc1cccc(-c2noc(-c3ccc(C#N)cc3)n2)c1	ZINC000544780617	459784423	/nfs/dbraw/zinc/78/44/23/459784423.db2.gz	TUBCMXDEWZTFAC-UHFFFAOYSA-N	0	3	334.379	3.216	20	30		EGEDHN
O[C@@H](CNCC#Cc1ccccc1)CO[C@H]1CCCc2ccccc21	ZINC000565475864	459784770	/nfs/dbraw/zinc/78/47/70/459784770.db2.gz	GUHULEGWVLWJBZ-UNMCSNQZSA-N	0	3	335.447	3.083	20	30		EGEDHN
C[C@H]1O[C@@H](C)[C@H](C)[C@H]1C(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1	ZINC000528917787	459817643	/nfs/dbraw/zinc/81/76/43/459817643.db2.gz	HPXVTKWXRKHJLB-VOAKKNSGSA-N	0	3	334.803	3.047	20	30		EGEDHN
N#Cc1cc(F)ccc1NC(=O)NC[C@@H]1CCN1C1CCCCC1	ZINC000529008406	459820790	/nfs/dbraw/zinc/82/07/90/459820790.db2.gz	HHIIBPLPRACURO-INIZCTEOSA-N	0	3	330.407	3.226	20	30		EGEDHN
CCC(C#N)(CC)C(=O)N1CC[C@]2(CCN(Cc3ccccc3)C2)C1	ZINC000529370081	459827914	/nfs/dbraw/zinc/82/79/14/459827914.db2.gz	WLKSJAZEBIEHMV-FQEVSTJZSA-N	0	3	339.483	3.441	20	30		EGEDHN
N#Cc1cnn2cc(CNCCCCCc3ccc(F)cc3)cnc12	ZINC000566242370	459828030	/nfs/dbraw/zinc/82/80/30/459828030.db2.gz	JPCAFCTWUWYDAZ-UHFFFAOYSA-N	0	3	337.402	3.243	20	30		EGEDHN
C[C@H](CN1CCC(C)CC1)NC(=O)c1cc2ccccc2n1CC#N	ZINC000598266683	459844053	/nfs/dbraw/zinc/84/40/53/459844053.db2.gz	ZGEHLJZHUIVQOF-MRXNPFEDSA-N	0	3	338.455	3.015	20	30		EGEDHN
CCCN1CC[C@H](NC(=O)c2c(Cl)cc(C#N)cc2Cl)C1	ZINC000598343937	459872737	/nfs/dbraw/zinc/87/27/37/459872737.db2.gz	YTNNQVRKLQQWBS-NSHDSACASA-N	0	3	326.227	3.079	20	30		EGEDHN
CCCN1CC[C@@H](NC(=O)c2cn(CCCC#N)c3ccccc23)C1	ZINC000598344085	459872819	/nfs/dbraw/zinc/87/28/19/459872819.db2.gz	ZSNGXSMRAZTSJD-MRXNPFEDSA-N	0	3	338.455	3.159	20	30		EGEDHN
CC[C@@H](C#N)C(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1	ZINC000593426840	459885683	/nfs/dbraw/zinc/88/56/83/459885683.db2.gz	OWOORTDJPCLVDB-AWEZNQCLSA-N	0	3	341.377	3.145	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000598398586	459889118	/nfs/dbraw/zinc/88/91/18/459889118.db2.gz	KJPMFQMVMSLFKB-AZUAARDMSA-N	0	3	334.419	3.439	20	30		EGEDHN
CN(C)Cc1cccc(NC(=O)[C@@H]2CCCN2c2ccc(C#N)cc2)c1	ZINC000609096570	459904430	/nfs/dbraw/zinc/90/44/30/459904430.db2.gz	KFTNXHYXHBFLMT-FQEVSTJZSA-N	0	3	348.450	3.227	20	30		EGEDHN
Cc1cc(F)ccc1N(CC#N)C(=O)C1Oc2ccccc2O[C@H]1C	ZINC000602393719	459914229	/nfs/dbraw/zinc/91/42/29/459914229.db2.gz	HKYZIJMNICDNIH-SCLBCKFNSA-N	0	3	340.354	3.219	20	30		EGEDHN
CC(C)n1cncc1CNC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000593691529	459953369	/nfs/dbraw/zinc/95/33/69/459953369.db2.gz	BDCUDTTUYOIZLR-UHFFFAOYSA-N	0	3	337.471	3.090	20	30		EGEDHN
COc1ccsc1CNC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000593693076	459954521	/nfs/dbraw/zinc/95/45/21/459954521.db2.gz	NYSXYEHZKVUJTN-UHFFFAOYSA-N	0	3	341.480	3.383	20	30		EGEDHN
CC(C)Oc1cc(CN(C[C@@H](O)CC(C)(C)C#N)C2CC2)ccn1	ZINC000598596854	459957369	/nfs/dbraw/zinc/95/73/69/459957369.db2.gz	MNOWIFORCMAGTF-KRWDZBQOSA-N	0	3	331.460	3.134	20	30		EGEDHN
C[C@H](CC1(C#N)CCOCC1)NCc1ccc(Cn2cccn2)cc1	ZINC000602497826	459969416	/nfs/dbraw/zinc/96/94/16/459969416.db2.gz	ARTUYWNFDUWCNJ-QGZVFWFLSA-N	0	3	338.455	3.120	20	30		EGEDHN
C[C@H](CC1(C#N)CCOCC1)NCc1ccc(N2CCCCC2)nc1	ZINC000602513771	459979117	/nfs/dbraw/zinc/97/91/17/459979117.db2.gz	IMHHHVPXKMEBBE-QGZVFWFLSA-N	0	3	342.487	3.260	20	30		EGEDHN
CN1CCC(N(C(=O)COc2ccccc2C#N)c2ccccc2)CC1	ZINC000609566670	459983635	/nfs/dbraw/zinc/98/36/35/459983635.db2.gz	BLWPQXFKBLRBBZ-UHFFFAOYSA-N	0	3	349.434	3.064	20	30		EGEDHN
N#Cc1cccc(CNC2CCN(c3nc4ccccc4s3)CC2)n1	ZINC000602536952	459988533	/nfs/dbraw/zinc/98/85/33/459988533.db2.gz	YGUSJZCUVGXASN-UHFFFAOYSA-N	0	3	349.463	3.322	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N[C@H]1CCCc2c3cc(Cl)ccc3[nH]c21	ZINC000602565420	460000076	/nfs/dbraw/zinc/00/00/76/460000076.db2.gz	HTNUHTNZLRTAFV-ZBFHGGJFSA-N	0	3	344.846	3.336	20	30		EGEDHN
COc1ccc(CNC[C@@H](O)CC(C)(C)C#N)c(C(F)(F)F)c1	ZINC000598720541	460005905	/nfs/dbraw/zinc/00/59/05/460005905.db2.gz	OOGSOOGUICADGX-LBPRGKRZSA-N	0	3	330.350	3.104	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CNCc1cc(F)cc(OC)c1	ZINC000575916492	460031322	/nfs/dbraw/zinc/03/13/22/460031322.db2.gz	JUMDQSGMTLXHPL-SFHVURJKSA-N	0	3	345.414	3.092	20	30		EGEDHN
N#Cc1ccc(Nc2cccc(C(=O)N[C@@H]3CCN(C4CC4)C3)c2)cc1	ZINC000609987415	460045468	/nfs/dbraw/zinc/04/54/68/460045468.db2.gz	VEQUYOHUDKTBJD-LJQANCHMSA-N	0	3	346.434	3.268	20	30		EGEDHN
Cc1cc(C)c(C#N)c(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)n1	ZINC000598858121	460071908	/nfs/dbraw/zinc/07/19/08/460071908.db2.gz	WXIGKUQBDKQMTM-WCQYABFASA-N	0	3	341.333	3.256	20	30		EGEDHN
COc1cccc2c1OCC[C@H]2N[C@@H](C)CC1(C#N)CCOCC1	ZINC000602712971	460080478	/nfs/dbraw/zinc/08/04/78/460080478.db2.gz	XBHIMFGQNGWXAW-GOEBONIOSA-N	0	3	330.428	3.207	20	30		EGEDHN
Cc1ncc([N+](=O)[O-])n1CCN(Cc1ccc(C#N)cc1)CC(C)C	ZINC000602766315	460114618	/nfs/dbraw/zinc/11/46/18/460114618.db2.gz	PIIWFXGDXJKWNE-UHFFFAOYSA-N	0	3	341.415	3.130	20	30		EGEDHN
C[C@H](NC(=O)NC[C@@H](c1ccccc1)N(C)C)c1cccc(C#N)c1	ZINC000610356022	460132529	/nfs/dbraw/zinc/13/25/29/460132529.db2.gz	HLSBBTVEULCVIK-KXBFYZLASA-N	0	3	336.439	3.221	20	30		EGEDHN
C[C@H](CN1CCC[C@@H](C)C1)NC(=O)N[C@@H](C)c1cccc(C#N)c1	ZINC000610401124	460141887	/nfs/dbraw/zinc/14/18/87/460141887.db2.gz	SDJVEDRKCSUZLN-OAGGEKHMSA-N	0	3	328.460	3.039	20	30		EGEDHN
N#Cc1ccc2c(c1)CC[C@@H]2NCc1ccc(-n2cncn2)c(F)c1	ZINC000618743203	460152609	/nfs/dbraw/zinc/15/26/09/460152609.db2.gz	ZXUKHJMSTWUZRL-SFHVURJKSA-N	0	3	333.370	3.055	20	30		EGEDHN
Cc1ccc([C@@H](CNC(=O)[C@@H](C)Cc2ccc(C#N)cc2)N(C)C)cc1	ZINC000594254557	460174554	/nfs/dbraw/zinc/17/45/54/460174554.db2.gz	ISQUWNMJAYVNIZ-LAUBAEHRSA-N	0	3	349.478	3.464	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)C(=O)N1CCCN(C2CCCC2)CC1	ZINC000594297176	460182673	/nfs/dbraw/zinc/18/26/73/460182673.db2.gz	CVHXPUAUMBYTEJ-QGZVFWFLSA-N	0	3	339.483	3.214	20	30		EGEDHN
CCC(C)(C)N1CCN(C(=O)C[C@@H](CC#N)c2ccccc2)CC1	ZINC000594390325	460203099	/nfs/dbraw/zinc/20/30/99/460203099.db2.gz	UZYDYJIMFXVELP-GOSISDBHSA-N	0	3	327.472	3.407	20	30		EGEDHN
C[C@@H](NC1CCN(CC#N)CC1)c1ccc(F)cc1OC(F)F	ZINC000610813989	460241888	/nfs/dbraw/zinc/24/18/88/460241888.db2.gz	YEJQOVRBBDQBJL-LLVKDONJSA-N	0	3	327.350	3.066	20	30		EGEDHN
N#Cc1ccc(CNc2ccc(CN3CCC(O)CC3)cc2)s1	ZINC000610909806	460258656	/nfs/dbraw/zinc/25/86/56/460258656.db2.gz	OTGDXVXSGORFQZ-UHFFFAOYSA-N	0	3	327.453	3.189	20	30		EGEDHN
C[C@@H]1CN(CCC(=O)Nc2sccc2C#N)C[C@@H](C)C1(F)F	ZINC000599512152	460265498	/nfs/dbraw/zinc/26/54/98/460265498.db2.gz	DGLSNDFVLRULPE-GHMZBOCLSA-N	0	3	327.400	3.171	20	30		EGEDHN
CN(C)CCOc1ccc(CNC2(c3cccc(C#N)c3)CC2)cc1	ZINC000610972029	460268894	/nfs/dbraw/zinc/26/88/94/460268894.db2.gz	QQZDKOJVCLVFKJ-UHFFFAOYSA-N	0	3	335.451	3.278	20	30		EGEDHN
CC(C)[C@H]1CN(C[C@H](O)CC(C)(C)C#N)CCN1Cc1ccccc1	ZINC000599549004	460272000	/nfs/dbraw/zinc/27/20/00/460272000.db2.gz	LWAABUGACXCQNP-WOJBJXKFSA-N	0	3	343.515	3.130	20	30		EGEDHN
COCc1cc(C#N)ccc1NCc1ccccc1OCCN(C)C	ZINC000603280385	460276537	/nfs/dbraw/zinc/27/65/37/460276537.db2.gz	BYZVYWZLXWLYBC-UHFFFAOYSA-N	0	3	339.439	3.257	20	30		EGEDHN
CCCN(CCN1CCCC1)C(=O)Nc1cc(OC)c(C#N)cc1F	ZINC000599812914	460339378	/nfs/dbraw/zinc/33/93/78/460339378.db2.gz	VPNZZARSSSXCQW-UHFFFAOYSA-N	0	3	348.422	3.046	20	30		EGEDHN
Cc1ccc(C(=O)NCCN[C@H]2CCCc3cc(C#N)ccc32)cc1	ZINC000611391049	460352418	/nfs/dbraw/zinc/35/24/18/460352418.db2.gz	NXOYKOVQBOSOAX-FQEVSTJZSA-N	0	3	333.435	3.264	20	30		EGEDHN
CCC(C#N)(CC)C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C	ZINC000599980351	460366313	/nfs/dbraw/zinc/36/63/13/460366313.db2.gz	YLZKWTHMEXVZJE-MRXNPFEDSA-N	0	3	333.501	3.457	20	30		EGEDHN
N#CCC1CCN(C[C@@H](O)COc2ccc(Cl)c(Cl)c2)CC1	ZINC000611687979	460428996	/nfs/dbraw/zinc/42/89/96/460428996.db2.gz	VBZWNJNBNHCQPJ-CYBMUJFWSA-N	0	3	343.254	3.359	20	30		EGEDHN
C=CC[C@H]1CCN(C(=O)[C@@H]2CN(C(C)(C)C)C[C@H]2C(F)(F)F)C1	ZINC000628491527	460440730	/nfs/dbraw/zinc/44/07/30/460440730.db2.gz	AFJCYSJKXDITOG-BFHYXJOUSA-N	0	3	332.410	3.320	20	30		EGEDHN
C=CCOc1c(Cl)cc(CNC[C@H](O)[C@@H](C)CC)cc1OC	ZINC000623417225	460537647	/nfs/dbraw/zinc/53/76/47/460537647.db2.gz	XHWBVLBTIREQIU-WFASDCNBSA-N	0	3	327.852	3.410	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N1CC[C@@H](c2ccco2)C1)C(C)C	ZINC000601255778	460766081	/nfs/dbraw/zinc/76/60/81/460766081.db2.gz	RKYZVLHOGOSIBY-MSOLQXFVSA-N	0	3	345.487	3.477	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN1CCC[C@H](C(=O)c2ccc(F)cc2)C1	ZINC000621258661	460965008	/nfs/dbraw/zinc/96/50/08/460965008.db2.gz	UREYTFWIHNTFRI-RDJZCZTQSA-N	0	3	332.419	3.021	20	30		EGEDHN
COc1ccc([C@@H]2CN(Cc3ccccc3)C[C@H]2NCCC#N)cc1	ZINC000601969474	460965691	/nfs/dbraw/zinc/96/56/91/460965691.db2.gz	SQUMXMZNVZOFKK-LEWJYISDSA-N	0	3	335.451	3.166	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CCCCO2)nnc1N(C)CCN1CCCCC1	ZINC000652626676	461307283	/nfs/dbraw/zinc/30/72/83/461307283.db2.gz	HDNNRLNSPHJSNA-QGZVFWFLSA-N	0	3	347.507	3.018	20	30		EGEDHN
C=CCN(C(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1)[C@H](C)COC	ZINC000663785805	461805239	/nfs/dbraw/zinc/80/52/39/461805239.db2.gz	ZNJVTBQNJAZTLM-ZIFCJYIRSA-N	0	3	345.487	3.054	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H]2C[C@H]2c2ccccc2Cl)CC1	ZINC000660707417	461931635	/nfs/dbraw/zinc/93/16/35/461931635.db2.gz	OKJPSPZNANPHPI-DOTOQJQBSA-N	0	3	333.863	3.146	20	30		EGEDHN
C=CCCn1cc(CNC[C@@H](c2ccc(C)cc2)N2CCCC2)nn1	ZINC000657337994	462056408	/nfs/dbraw/zinc/05/64/08/462056408.db2.gz	FRHLLKUJIFTHHC-FQEVSTJZSA-N	0	3	339.487	3.089	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N[C@H]1CCN(CCC)C1)c1ccc(F)c(F)c1	ZINC000661036974	462074705	/nfs/dbraw/zinc/07/47/05/462074705.db2.gz	NCFHKNQLDYDNCO-YOEHRIQHSA-N	0	3	337.414	3.366	20	30		EGEDHN
C=CCCn1cc(CNC[C@@H]2CCCO[C@@H]2c2ccc(C)cc2)nn1	ZINC000657385816	462088398	/nfs/dbraw/zinc/08/83/98/462088398.db2.gz	WQVSCJAYNKWSAB-AZUAARDMSA-N	0	3	340.471	3.420	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)N[C@@H]1CCCN2CCCC[C@@H]12	ZINC000654318462	462161187	/nfs/dbraw/zinc/16/11/87/462161187.db2.gz	NEUVLDLQECMEOP-MSOLQXFVSA-N	0	3	344.455	3.007	20	30		EGEDHN
C=CCN(CCCOc1ccc(S(C)(=O)=O)cc1)C(C)(C)C	ZINC000661755443	462399558	/nfs/dbraw/zinc/39/95/58/462399558.db2.gz	QVNPWWOILTUAKH-UHFFFAOYSA-N	0	3	325.474	3.146	20	30		EGEDHN
C=CC[C@H](C(=O)N1CCCN(c2ccncc2)CC1)c1ccccc1	ZINC000640445117	462408665	/nfs/dbraw/zinc/40/86/65/462408665.db2.gz	PLZKIWQZBPSUMO-FQEVSTJZSA-N	0	3	335.451	3.480	20	30		EGEDHN
C=CCN1CCC(NC(=O)C[C@H](CC)c2ccc(OC)cc2)CC1	ZINC000178541206	526423516	/nfs/dbraw/zinc/42/35/16/526423516.db2.gz	KIKNJZFPOCNEII-INIZCTEOSA-N	0	3	330.472	3.346	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2sc(C)nc2CC(C)C)CC1	ZINC000178176168	526443051	/nfs/dbraw/zinc/44/30/51/526443051.db2.gz	FMCROVVAQJPNGJ-UHFFFAOYSA-N	0	3	336.505	3.422	20	30		EGEDHN
C#CCOc1ccc([C@@H](C)NC[C@@H](O)c2cccc(OC)c2)cc1	ZINC000178083984	527115339	/nfs/dbraw/zinc/11/53/39/527115339.db2.gz	HKEZAIQKTBUNCG-FOIQADDNSA-N	0	3	325.408	3.091	20	30		EGEDHN
C#CCOc1ccc([C@H](C)NC[C@@H](O)c2cccc(OC)c2)cc1	ZINC000178083968	527115755	/nfs/dbraw/zinc/11/57/55/527115755.db2.gz	HKEZAIQKTBUNCG-MGPUTAFESA-N	0	3	325.408	3.091	20	30		EGEDHN
COc1cc(CN2CCC(CO)(c3ccccc3)CC2)ccc1C#N	ZINC000294087883	536297877	/nfs/dbraw/zinc/29/78/77/536297877.db2.gz	ZKBUXOYYWAFEFE-UHFFFAOYSA-N	0	3	336.435	3.093	20	30		EGEDHN
COCCN(CCCCCn1cccn1)Cc1ccc(C#N)cc1	ZINC000264225017	536834367	/nfs/dbraw/zinc/83/43/67/536834367.db2.gz	WVDFUITWJCOUAR-UHFFFAOYSA-N	0	3	326.444	3.074	20	30		EGEDHN
COc1ccc([C@H](NCC(=O)Nc2cccc(C#N)c2)C2CC2)cc1	ZINC000193343676	536930164	/nfs/dbraw/zinc/93/01/64/536930164.db2.gz	IEEQKTPEHVJBCM-HXUWFJFHSA-N	0	3	335.407	3.246	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2c3c(ccc2OC)CCC3)CC1	ZINC000191316939	547182840	/nfs/dbraw/zinc/18/28/40/547182840.db2.gz	SGEUJVIWDMMJCM-UHFFFAOYSA-N	0	3	343.471	3.346	20	30		EGEDHN
C[C@H](NC(=O)N[C@H]1CCN(C2CC2)C1)c1nc(C(C)(C)C)cs1	ZINC000329483534	547498385	/nfs/dbraw/zinc/49/83/85/547498385.db2.gz	WMEBRNHVOKBHLH-RYUDHWBXSA-N	0	3	336.505	3.242	20	30		EGEDHN
CN1CCC(CC(=O)N[C@H]2CCc3nc(C(C)(C)C)cn3C2)CC1	ZINC000330114724	547513654	/nfs/dbraw/zinc/51/36/54/547513654.db2.gz	FCZLMYMHVFQVPN-HNNXBMFYSA-N	0	3	332.492	3.184	20	30		EGEDHN
C=CCN(Cc1ccccc1F)C(=O)N[C@@H](CC)CN1CCCC1	ZINC000675200919	548871816	/nfs/dbraw/zinc/87/18/16/548871816.db2.gz	XCUNRQUNPCBEBO-KRWDZBQOSA-N	0	3	333.451	3.398	20	30		EGEDHN
C=CCCOCC(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000676066289	549030888	/nfs/dbraw/zinc/03/08/88/549030888.db2.gz	XLJVJXRHHNVEJP-UHFFFAOYSA-N	0	3	332.444	3.083	20	30		EGEDHN
N#CC(C(=O)c1cnc2nccnc2c1)c1ccc2ccccc2n1	ZINC000680617220	549885771	/nfs/dbraw/zinc/88/57/71/549885771.db2.gz	ISGYXQAYAOTICR-CQSZACIVSA-N	0	3	325.331	3.063	20	30		EGEDHN
CC(=NNCCCc1ccccc1)c1cccc(N2CCOCC2)c1	ZINC000729145987	574818388	/nfs/dbraw/zinc/81/83/88/574818388.db2.gz	JLSWZIAFMYLVJN-UHFFFAOYSA-N	0	3	337.467	3.470	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(Cl)nc(Cl)c2)CC1	ZINC000729976063	574900393	/nfs/dbraw/zinc/90/03/93/574900393.db2.gz	VPKYWAKDKQZYDU-UHFFFAOYSA-N	0	3	328.243	3.159	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCCCOc2cccc(C)c2)CC1	ZINC000730022477	574906206	/nfs/dbraw/zinc/90/62/06/574906206.db2.gz	ZRBSXHVYGINSFL-UHFFFAOYSA-N	0	3	345.487	3.104	20	30		EGEDHN
C=CCc1cc(C(=O)NC[C@@H]2CCCCN2CC)cc(OC)c1OC	ZINC000731873225	575214116	/nfs/dbraw/zinc/21/41/16/575214116.db2.gz	KUXBNWWIEZQWKO-KRWDZBQOSA-N	0	3	346.471	3.037	20	30		EGEDHN
C[C@H](CNC(=O)CCCCOc1cccc(C#N)c1)N1CCCCC1	ZINC000732059949	575235625	/nfs/dbraw/zinc/23/56/25/575235625.db2.gz	WWQDJRXUMVHFBD-QGZVFWFLSA-N	0	3	343.471	3.098	20	30		EGEDHN
N#CC(C(=O)CC[C@H]1CCCCO1)C(=O)Nc1ccccc1Cl	ZINC000732494443	575272351	/nfs/dbraw/zinc/27/23/51/575272351.db2.gz	HGPNCCLGBRLWPH-CHWSQXEVSA-N	0	3	334.803	3.337	20	30		EGEDHN
C[C@@H]1CCCC[C@@H]1OCC(=O)C(C#N)c1nc2ccccc2n1C	ZINC000733676625	575380767	/nfs/dbraw/zinc/38/07/67/575380767.db2.gz	CWIWIJCURPATNM-LBTNJELSSA-N	0	3	325.412	3.345	20	30		EGEDHN
Cc1nc(CCC(=O)C(C#N)C(=O)Nc2ccccc2Cl)cs1	ZINC000733678840	575381377	/nfs/dbraw/zinc/38/13/77/575381377.db2.gz	KZJRHZVWVOZJMY-LBPRGKRZSA-N	0	3	347.827	3.385	20	30		EGEDHN
C=CC[C@@H](NC(=O)NCCN(C)Cc1ccccc1)c1ccncc1	ZINC000734661828	575533978	/nfs/dbraw/zinc/53/39/78/575533978.db2.gz	RQPXKKDQOHVECE-LJQANCHMSA-N	0	3	338.455	3.130	20	30		EGEDHN
C=CC[C@H](NC(=O)NC[C@@H](C)N1CCC(C)CC1)c1ccncc1	ZINC000734666207	575534342	/nfs/dbraw/zinc/53/43/42/575534342.db2.gz	WCGJCRIAVWAODW-AEFFLSMTSA-N	0	3	330.476	3.118	20	30		EGEDHN
CC[C@H](C)c1ccc(NC(=O)C(C#N)C(=O)C[C@H]2CCOC2)cc1	ZINC000740534808	576593773	/nfs/dbraw/zinc/59/37/73/576593773.db2.gz	IBJZRBKPTUQCTF-JJRVBVJISA-N	0	3	328.412	3.274	20	30		EGEDHN
CN(C)C1(CN=Cc2cc3ccccc3[nH]c2=O)Cc2ccccc2C1	ZINC000741466227	576688446	/nfs/dbraw/zinc/68/84/46/576688446.db2.gz	IXIAVZGTKUVUAK-OEAKJJBVSA-N	0	3	345.446	3.459	20	30		EGEDHN
C=C(C)CN1CCC(NC(=S)N[C@@H]2CCc3ccccc3C2)CC1	ZINC000742996216	576799137	/nfs/dbraw/zinc/79/91/37/576799137.db2.gz	AODNEXNKGZMSMY-LJQANCHMSA-N	0	3	343.540	3.049	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)C(C#N)C(=O)Nc1c(CC)cccc1CC	ZINC000743450163	576809428	/nfs/dbraw/zinc/80/94/28/576809428.db2.gz	XTWGQDMRMPYJGL-RHSMWYFYSA-N	0	3	342.439	3.440	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)[C@H](C)c1ccccc1C(F)(F)F	ZINC000744032092	576819302	/nfs/dbraw/zinc/81/93/02/576819302.db2.gz	BZIUEEBZLSNDEK-ZYHUDNBSSA-N	0	3	326.318	3.042	20	30		EGEDHN
N#Cc1ccc(OCCCN(Cc2cccc(C(N)=O)c2)C2CC2)cc1	ZINC000830534452	1292729081	/nfs/dbraw/zinc/72/90/81/1292729081.db2.gz	ANRNHODWUGBZLE-UHFFFAOYSA-N	0	3	349.434	3.091	20	30		EGEDHN
C[C@H](NC(=O)c1cc(C#N)ccc1F)[C@H](c1ccccc1)N(C)C	ZINC000832319942	1292989299	/nfs/dbraw/zinc/98/92/99/1292989299.db2.gz	NKCMXRLHVMAVRK-SCLBCKFNSA-N	0	3	325.387	3.119	20	30		EGEDHN
C#CCOc1ccc(CNCc2ccccc2Cn2cccn2)cc1	ZINC000113316621	1293146637	/nfs/dbraw/zinc/14/66/37/1293146637.db2.gz	SYQTWDSVTICJJV-UHFFFAOYSA-N	0	3	331.419	3.233	20	30		EGEDHN
COc1ccc(CNC(=O)C(C#N)C(=O)[C@H](C)CC2CCCC2)cc1	ZINC000114618460	1293173238	/nfs/dbraw/zinc/17/32/38/1293173238.db2.gz	QQYKADAHLMXYGZ-KDOFPFPSSA-N	0	3	342.439	3.237	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)[C@@H](CCC)OC)cc1	ZINC000835062267	1293197131	/nfs/dbraw/zinc/19/71/31/1293197131.db2.gz	NKAKQSBIZVYAOK-DLBZAZTESA-N	0	3	330.428	3.492	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)[C@H](C)Cc1cccc(C(F)(F)F)c1	ZINC000121770991	1293388883	/nfs/dbraw/zinc/38/88/83/1293388883.db2.gz	GJQUWUCPJDGMQE-BXUZGUMPSA-N	0	3	340.345	3.117	20	30		EGEDHN
N#CC(C(=O)CCCOc1ccccc1F)C(=O)Nc1ccccc1	ZINC000125527486	1293509830	/nfs/dbraw/zinc/50/98/30/1293509830.db2.gz	OMFFYBRFTOQMAY-OAHLLOKOSA-N	0	3	340.354	3.332	20	30		EGEDHN
COc1ccc(COCCNC2CC(C#N)(c3ccccc3)C2)cc1	ZINC000127799163	1293574904	/nfs/dbraw/zinc/57/49/04/1293574904.db2.gz	JORMFNUFVAEIFV-UHFFFAOYSA-N	0	3	336.435	3.425	20	30		EGEDHN
Cc1cc(Cl)ccc1OCC(=O)C(C#N)C(=O)Nc1ccccc1	ZINC000127853410	1293575627	/nfs/dbraw/zinc/57/56/27/1293575627.db2.gz	KKWXEWRQVUJJIR-HNNXBMFYSA-N	0	3	342.782	3.375	20	30		EGEDHN
COc1ccc(CN(C)CCC(=O)Nc2sccc2C#N)cc1F	ZINC000139273123	1293842026	/nfs/dbraw/zinc/84/20/26/1293842026.db2.gz	UIVNWODCYCPDJV-UHFFFAOYSA-N	0	3	347.415	3.228	20	30		EGEDHN
CC[C@@H](CC(=O)C(C#N)C(=O)NC1CCCC1)c1ccc(OC)cc1	ZINC000152457560	1293969985	/nfs/dbraw/zinc/96/99/85/1293969985.db2.gz	OCPYJRHBLOZNBU-KSSFIOAISA-N	0	3	342.439	3.347	20	30		EGEDHN
CCCCCCCON=C(N)c1ccccc1CN1CCC(O)CC1	ZINC000153559576	1294019187	/nfs/dbraw/zinc/01/91/87/1294019187.db2.gz	SYAOFJLLUZGMLC-UHFFFAOYSA-N	0	3	347.503	3.251	20	30		EGEDHN
CC[C@H](SC)C(=O)C(C#N)C(=O)Nc1ccc(OC)c(Cl)c1	ZINC000156512869	1294147124	/nfs/dbraw/zinc/14/71/24/1294147124.db2.gz	SBKSATGFKWGXGK-MFKMUULPSA-N	0	3	340.832	3.138	20	30		EGEDHN
C=CCSc1nc2ccccc2n1CN1CCC(OC(C)=O)CC1	ZINC000156884523	1294162200	/nfs/dbraw/zinc/16/22/00/1294162200.db2.gz	NOUKVCUTMFYCGG-UHFFFAOYSA-N	0	3	345.468	3.299	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)CC[C@@H]1CC[C@H](C)O1	ZINC000173971659	1294475421	/nfs/dbraw/zinc/47/54/21/1294475421.db2.gz	IMEPSPWGLMLFDL-SOUVJXGZSA-N	0	3	344.411	3.080	20	30		EGEDHN
C[C@H](C(=O)C(C#N)C(=O)Nc1ccccn1)c1ccc(Cl)s1	ZINC000175121554	1294540740	/nfs/dbraw/zinc/54/07/40/1294540740.db2.gz	JQENCPVMQIQJCX-UWVGGRQHSA-N	0	3	333.800	3.248	20	30		EGEDHN
C[C@@H](NCc1ccc([S@@](C)=O)cc1)c1ccc(OCC#N)cc1	ZINC000175992554	1294583457	/nfs/dbraw/zinc/58/34/57/1294583457.db2.gz	JVQYHRGKSRQUSI-QKFKETGDSA-N	0	3	328.437	3.177	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@@H](C)Oc1cccc(Cl)c1	ZINC000193371820	1295858231	/nfs/dbraw/zinc/85/82/31/1295858231.db2.gz	LEHLFHXPVWGRSK-IUODEOHRSA-N	0	3	336.819	3.123	20	30		EGEDHN
C#CCN(C[C@H](O)COCc1cccs1)[C@H]1CCc2ccccc21	ZINC000245466397	1296309106	/nfs/dbraw/zinc/30/91/06/1296309106.db2.gz	JFILJHRSDMAIJM-PXNSSMCTSA-N	0	3	341.476	3.248	20	30		EGEDHN
CCO[C@@H]1C[C@@H]1C(=O)C(C#N)C(=O)Nc1ccc([C@H](C)CC)cc1	ZINC000249739243	1296451501	/nfs/dbraw/zinc/45/15/01/1296451501.db2.gz	XCYIDFPMOYQIIR-VJUNAUMWSA-N	0	3	328.412	3.272	20	30		EGEDHN
CON=Cc1ccc(C(=O)N2CCN(C3CCC(C)CC3)CC2)cc1	ZINC000255019954	1296489570	/nfs/dbraw/zinc/48/95/70/1296489570.db2.gz	CQDBVBIQXIUQDF-UHFFFAOYSA-N	0	3	343.471	3.003	20	30		EGEDHN
COc1cccc([C@H](C/N=C\c2cc(OC)ccc2O)N(C)C)c1	ZINC000255417238	1296531860	/nfs/dbraw/zinc/53/18/60/1296531860.db2.gz	XKDBRRPGZHLYSM-HRVJUDJTSA-N	0	3	328.412	3.131	20	30		EGEDHN
C#CCOc1ccccc1CNCC1(NC(=O)OC(C)(C)C)CCC1	ZINC000385469352	1297583854	/nfs/dbraw/zinc/58/38/54/1297583854.db2.gz	FQXFNVCPVDUEAC-UHFFFAOYSA-N	0	3	344.455	3.236	20	30		EGEDHN
CCc1nc(C#N)cc(N2C[C@H](C)N(Cc3ccccc3)[C@H](C)[C@@H]2C)n1	ZINC000404423337	1297753593	/nfs/dbraw/zinc/75/35/93/1297753593.db2.gz	JWIOHBUPBFLANL-BBWFWOEESA-N	0	3	349.482	3.398	20	30		EGEDHN
C[C@@H](NCc1cc(C#N)cs1)c1ccc(N2CCOCC2)cc1	ZINC000748099095	1298928722	/nfs/dbraw/zinc/92/87/22/1298928722.db2.gz	DRZJHKSPSTZXJC-CQSZACIVSA-N	0	3	327.453	3.307	20	30		EGEDHN
C=C(Cl)C[C@H](N)C(=O)Nc1ccc(N2CCCC2)c(Cl)c1	ZINC000876745633	1298955531	/nfs/dbraw/zinc/95/55/31/1298955531.db2.gz	DVYGNDPVOXFTHJ-ZDUSSCGKSA-N	0	3	328.243	3.349	20	30		EGEDHN
C=C(Cl)C[C@@H](N)C(=O)NCc1ccc(N2CCC(C)CC2)cc1	ZINC000876756249	1298962149	/nfs/dbraw/zinc/96/21/49/1298962149.db2.gz	PMLDYCIJPRMLOQ-QGZVFWFLSA-N	0	3	335.879	3.009	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@H]2C[C@H](O)c2ccc(F)cc2)n1	ZINC000876808998	1299002915	/nfs/dbraw/zinc/00/29/15/1299002915.db2.gz	OQONPGILVLFZQK-OALUTQOASA-N	0	3	325.387	3.180	20	30		EGEDHN
Cc1cccc([O-])c1C[NH2+]C1CCC(Oc2ccc(C#N)cn2)CC1	ZINC000877119224	1299166116	/nfs/dbraw/zinc/16/61/16/1299166116.db2.gz	VKFXTIWSASDVHU-UHFFFAOYSA-N	0	3	337.423	3.447	20	30		EGEDHN
Cc1noc(C)c1N(C)CC(=O)C(C#N)c1nc2ccccc2s1	ZINC000749845583	1299285905	/nfs/dbraw/zinc/28/59/05/1299285905.db2.gz	GZDZVJUXQCFAMD-GFCCVEGCSA-N	0	3	340.408	3.214	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000878900286	1300251736	/nfs/dbraw/zinc/25/17/36/1300251736.db2.gz	ASBJYRQWGOTLTC-UHFFFAOYSA-N	0	3	348.462	3.387	20	30		EGEDHN
C#CC[C@H](NC(=O)NC[C@H](c1ccccc1)N(C)C)c1ccccc1	ZINC000757064707	1300628534	/nfs/dbraw/zinc/62/85/34/1300628534.db2.gz	MXNSJPPSQKJMBN-VQTJNVASSA-N	0	3	335.451	3.353	20	30		EGEDHN
Cc1nc2sc3c(c2c(N=NC2C[C@@H](C)N(C)C2)n1)CCCC3	ZINC000761801743	1301543803	/nfs/dbraw/zinc/54/38/03/1301543803.db2.gz	NYPFHUBWLVVPGA-SNVBAGLBSA-N	0	3	329.473	3.370	20	30		EGEDHN
C=C(C)CN1CCC(Nc2ncc(C#N)cc2Br)CC1	ZINC000881946253	1301765122	/nfs/dbraw/zinc/76/51/22/1301765122.db2.gz	IZJZVBGQINCSBZ-UHFFFAOYSA-N	0	3	335.249	3.168	20	30		EGEDHN
C#CCCCN1CCN(Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000766895939	1302541528	/nfs/dbraw/zinc/54/15/28/1302541528.db2.gz	LDHWEUDUWJPZTO-UHFFFAOYSA-N	0	3	326.362	3.116	20	30		EGEDHN
C[C@@H]1CCN(Cc2cc(=O)n3c4ccccc4[nH]c3c2C#N)C[C@H]1C	ZINC000766984519	1302557968	/nfs/dbraw/zinc/55/79/68/1302557968.db2.gz	MKTZYSMFKCAOFF-IIAWOOMASA-N	0	3	334.423	3.202	20	30		EGEDHN
CCCCN(Cc1ccccc1F)C(=O)C1CC2(C1)CNC[C@@H]2C#N	ZINC000884121812	1302743889	/nfs/dbraw/zinc/74/38/89/1302743889.db2.gz	ZHXGFXCMFWAHMB-GNZRSQJKSA-N	0	3	343.446	3.094	20	30		EGEDHN
N#CC(CCN1C[C@@H]2C[C@]2(CO)C1)(c1ccccc1)c1ccccc1	ZINC000769802883	1303176706	/nfs/dbraw/zinc/17/67/06/1303176706.db2.gz	XFXZPMVQCUWNSL-LEWJYISDSA-N	0	3	332.447	3.201	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)CCCC(F)(F)F)cc1	ZINC000771261394	1303382456	/nfs/dbraw/zinc/38/24/56/1303382456.db2.gz	OHUFLSFEJDVUIJ-GFCCVEGCSA-N	0	3	328.290	3.075	20	30		EGEDHN
C#CCN1CCC[C@@H](N[C@H](c2cccnc2)c2ccc(F)c(C)c2)C1	ZINC000886663204	1303543964	/nfs/dbraw/zinc/54/39/64/1303543964.db2.gz	VVQACOVMXDXBFA-CTNGQTDRSA-N	0	3	337.442	3.306	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]\C[C@H]2COC3(CCCC3)O2)c([O-])c1	ZINC000773146795	1303632862	/nfs/dbraw/zinc/63/28/62/1303632862.db2.gz	CMMHWBMZRCZANG-BRLDDBHUSA-N	0	3	332.444	3.343	20	30		EGEDHN
Cc1nc(C(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)sc1C	ZINC000774044296	1303767546	/nfs/dbraw/zinc/76/75/46/1303767546.db2.gz	SQUFNWLESYCFQT-LBPRGKRZSA-N	0	3	333.800	3.375	20	30		EGEDHN
CCN1CCCC[C@@H]1C(=O)C(C#N)c1nc2cc(F)ccc2s1	ZINC000774072761	1303771690	/nfs/dbraw/zinc/77/16/90/1303771690.db2.gz	OTODIXXGSYKNNC-TZMCWYRMSA-N	0	3	331.416	3.486	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)c1	ZINC000774251342	1303790575	/nfs/dbraw/zinc/79/05/75/1303790575.db2.gz	IHWVYBMDJQQLJJ-HOTGVXAUSA-N	0	3	343.362	3.076	20	30		EGEDHN
COC(=O)Cc1ccccc1CN[C@H](C)c1ccc(OCC#N)cc1	ZINC000775336361	1303941439	/nfs/dbraw/zinc/94/14/39/1303941439.db2.gz	IAFCCOASSLVYPY-OAHLLOKOSA-N	0	3	338.407	3.155	20	30		EGEDHN
CC(C)[C@@H](NCC(=O)NCCC#N)c1cccc(C(F)(F)F)c1	ZINC000775332935	1303941932	/nfs/dbraw/zinc/94/19/32/1303941932.db2.gz	KVDIQTHYPAUARF-OAHLLOKOSA-N	0	3	327.350	3.022	20	30		EGEDHN
C#CC[C@@H](NC[C@@H](O)COc1ccc(OCC)cc1)c1ccccc1	ZINC000775397740	1303956375	/nfs/dbraw/zinc/95/63/75/1303956375.db2.gz	ATRZHHRZUJMIRU-WIYYLYMNSA-N	0	3	339.435	3.179	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CNC1CCN(CC(F)F)CC1	ZINC000778161670	1304406917	/nfs/dbraw/zinc/40/69/17/1304406917.db2.gz	MHFLSEVDBCKVRQ-UHFFFAOYSA-N	0	3	342.817	3.171	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)Nc1ccc(C#N)cn1)c1ccsc1	ZINC000889221240	1304417144	/nfs/dbraw/zinc/41/71/44/1304417144.db2.gz	XLTWTRBLYZIJJY-HNNXBMFYSA-N	0	3	343.456	3.219	20	30		EGEDHN
C#CCCOc1ccc(CN(C)CCN(C)C(=O)OC(C)(C)C)cc1	ZINC000779596800	1304585610	/nfs/dbraw/zinc/58/56/10/1304585610.db2.gz	MJXQVCYOHSGADR-UHFFFAOYSA-N	0	3	346.471	3.387	20	30		EGEDHN
CC(C)(C)c1cnc(CCC(=O)C(C#N)C(=O)NC2CCCCC2)o1	ZINC000788179562	1305888703	/nfs/dbraw/zinc/88/87/03/1305888703.db2.gz	IBYMVKPXOXCOPE-CQSZACIVSA-N	0	3	345.443	3.062	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@H]1CCCCC[C@@H]1NCc1ccc(C#N)cn1	ZINC000788259241	1305910233	/nfs/dbraw/zinc/91/02/33/1305910233.db2.gz	MBPPUWIIPCGJKR-IRXDYDNUSA-N	0	3	344.459	3.269	20	30		EGEDHN
CC1(C)CCC1=NNC(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000788955082	1306048779	/nfs/dbraw/zinc/04/87/79/1306048779.db2.gz	RTPKXMXWLGDBQG-UHFFFAOYSA-N	0	3	344.528	3.291	20	30		EGEDHN
CN(CCCN(C)c1cc(C#N)sc1[N+](=O)[O-])Cc1ccco1	ZINC000893849692	1306096132	/nfs/dbraw/zinc/09/61/32/1306096132.db2.gz	XPMQEGJHPHYZQB-UHFFFAOYSA-N	0	3	334.401	3.079	20	30		EGEDHN
CCOC(=O)C1(CC(=O)C(C#N)c2nc3ccccc3o2)CCC1	ZINC000789350835	1306144467	/nfs/dbraw/zinc/14/44/67/1306144467.db2.gz	MKKQKKHHKZFTAG-GFCCVEGCSA-N	0	3	326.352	3.128	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N(C)[C@H]1CCCN(C)C1)c1ccc(F)c(F)c1	ZINC000894265938	1306310311	/nfs/dbraw/zinc/31/03/11/1306310311.db2.gz	XOFSFDYSZLJKHM-YOEHRIQHSA-N	0	3	337.414	3.318	20	30		EGEDHN
N#CC(C(=O)c1ccc(-n2cccc2)nc1)c1cnc2ccccc2n1	ZINC000792111079	1309121919	/nfs/dbraw/zinc/12/19/19/1309121919.db2.gz	PXIJXYWUMZUAJV-HNNXBMFYSA-N	0	3	339.358	3.306	20	30		EGEDHN
Fc1ccc(CCN2CCC(N=Nc3ncccc3F)CC2)cc1	ZINC000794989821	1309643958	/nfs/dbraw/zinc/64/39/58/1309643958.db2.gz	DIBUZNXLMYVLOC-UHFFFAOYSA-N	0	3	330.382	3.466	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)c2ccc(Cl)cc2)C1	ZINC001023005168	1319212328	/nfs/dbraw/zinc/21/23/28/1319212328.db2.gz	PTMNZIKMZFXMAC-BETUJISGSA-N	0	3	343.652	3.099	20	30		EGEDHN
C#CCN(Cc1ccccc1)C[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000796633322	1310050907	/nfs/dbraw/zinc/05/09/07/1310050907.db2.gz	RZJOXRNCGAITPO-GOSISDBHSA-N	0	3	328.456	3.379	20	30		EGEDHN
N#CC[C@@H](CC(=O)C(C#N)C(=O)NC1CCCCC1)c1ccccc1	ZINC000796632349	1310051189	/nfs/dbraw/zinc/05/11/89/1310051189.db2.gz	KIBWQXGSGBMDPH-WMZOPIPTSA-N	0	3	337.423	3.232	20	30		EGEDHN
Cc1ccc2c(c1)CC[C@H](C(=O)C(C#N)C(=O)Nc1ccccc1)O2	ZINC000796633786	1310051995	/nfs/dbraw/zinc/05/19/95/1310051995.db2.gz	OYLQKVPFXHOBJJ-SJLPKXTDSA-N	0	3	334.375	3.036	20	30		EGEDHN
N#CC(C(=O)CCc1cnc2ccccc2c1)C(=O)NC1CCCCC1	ZINC000796634162	1310052731	/nfs/dbraw/zinc/05/27/31/1310052731.db2.gz	RIVIVOVGQPTKOC-SFHVURJKSA-N	0	3	349.434	3.325	20	30		EGEDHN
CC(C)(C)c1cnc(C(C#N)C(=O)C2(C)COC(C)(C)OC2)s1	ZINC000797571115	1310213757	/nfs/dbraw/zinc/21/37/57/1310213757.db2.gz	NXWVIBCSNHBGIA-LLVKDONJSA-N	0	3	336.457	3.406	20	30		EGEDHN
N#Cc1ccc(NCCNCc2cscc2C(F)(F)F)nc1	ZINC000897396558	1310318791	/nfs/dbraw/zinc/31/87/91/1310318791.db2.gz	NCRAXTVQFBLSOR-UHFFFAOYSA-N	0	3	326.347	3.235	20	30		EGEDHN
C#CCCOc1ccc(CN2CCC[C@H](Cc3nc(C)no3)C2)cc1	ZINC000897579277	1310391632	/nfs/dbraw/zinc/39/16/32/1310391632.db2.gz	SNFKPUIJFKYJPM-GOSISDBHSA-N	0	3	339.439	3.235	20	30		EGEDHN
COc1ccc([C@@H](NC(C)C)C(=O)NCC2CCC(C#N)CC2)cc1	ZINC000897659897	1310425657	/nfs/dbraw/zinc/42/56/57/1310425657.db2.gz	PPYDXKRAIRAQQB-LADRWXRNSA-N	0	3	343.471	3.180	20	30		EGEDHN
CN(Cc1ccccc1)c1ccc(NC(=O)[C@@H](N)CCCC#N)cc1	ZINC000827454363	1320454237	/nfs/dbraw/zinc/45/42/37/1320454237.db2.gz	JZBXZWGIKOOEKJ-IBGZPJMESA-N	0	3	336.439	3.283	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N[C@H](C)c1oc2ccccc2c1C	ZINC000836246940	1320464536	/nfs/dbraw/zinc/46/45/36/1320464536.db2.gz	MVWKRGUARWFRQM-OAHLLOKOSA-N	0	3	327.428	3.057	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N[C@H](CC)c1ccc(Cl)s1	ZINC000836488951	1320494276	/nfs/dbraw/zinc/49/42/76/1320494276.db2.gz	SBZPPUGVKQHCRF-GFCCVEGCSA-N	0	3	327.881	3.107	20	30		EGEDHN
C#C[C@@H](NCCC(=O)Nc1cc(Cl)ccc1Cl)[C@H]1CCCO1	ZINC000839565557	1320938667	/nfs/dbraw/zinc/93/86/67/1320938667.db2.gz	YRHDXVDPMCLCOJ-UKRRQHHQSA-N	0	3	341.238	3.092	20	30		EGEDHN
C#C[C@H](CCC)NC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F	ZINC000803191251	1317090168	/nfs/dbraw/zinc/09/01/68/1317090168.db2.gz	WKILNIZRVOSUFC-SJORKVTESA-N	0	3	334.410	3.062	20	30		EGEDHN
Cc1ccc(F)cc1C(=O)N1CC[C@H](NCc2ccc(C#N)s2)C1	ZINC001019208018	1317104749	/nfs/dbraw/zinc/10/47/49/1317104749.db2.gz	ZDWZQYJPBQLZGS-AWEZNQCLSA-N	0	3	343.427	3.072	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H](NCc2cc(C)ccc2OC)C1	ZINC001019333914	1317173307	/nfs/dbraw/zinc/17/33/07/1317173307.db2.gz	HAJDKFHRUIEVSX-FXAWDEMLSA-N	0	3	330.472	3.296	20	30		EGEDHN
N#Cc1cc(CN[C@H]2CCN(C(=O)C3(F)CCCCC3)C2)ccc1F	ZINC001019605883	1317303376	/nfs/dbraw/zinc/30/33/76/1317303376.db2.gz	WAMVICQVBAUHTF-INIZCTEOSA-N	0	3	347.409	3.060	20	30		EGEDHN
C=C[C@@H](C(=O)N1CC[C@H](NCc2ccc(C)nc2C)C1)c1ccccc1	ZINC001019804609	1317431505	/nfs/dbraw/zinc/43/15/05/1317431505.db2.gz	CDBYRXWULYZBCY-LEWJYISDSA-N	0	3	349.478	3.359	20	30		EGEDHN
C=C[C@H](C(=O)N1CC[C@H](NCc2cncc(C)c2)C1)c1ccccc1	ZINC001019805120	1317433043	/nfs/dbraw/zinc/43/30/43/1317433043.db2.gz	UBBBMPSMUOKQTG-PMACEKPBSA-N	0	3	335.451	3.050	20	30		EGEDHN
CC(C)(C)c1nc(CON=Cc2ccc(N3CCOCC3)cc2)co1	ZINC000902689563	1317605441	/nfs/dbraw/zinc/60/54/41/1317605441.db2.gz	JOUHJYMGLKUGPI-UHFFFAOYSA-N	0	3	343.427	3.359	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC(CN(CC)Cc3conc3C)CC2)C1	ZINC000957751222	1317619114	/nfs/dbraw/zinc/61/91/14/1317619114.db2.gz	PBLRXOMDTXFISV-UHFFFAOYSA-N	0	3	345.487	3.400	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)[C@H]2CCC=CCCC2)C1	ZINC001020284917	1317625518	/nfs/dbraw/zinc/62/55/18/1317625518.db2.gz	INRLVIAAAULCOP-KKUMJFAQSA-N	0	3	341.293	3.268	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)Cc2cc3ccccc3s2)C1	ZINC001020388235	1317675661	/nfs/dbraw/zinc/67/56/61/1317675661.db2.gz	YNBIRBQZKGNPKP-HDJSIYSDSA-N	0	3	334.872	3.433	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C2(C)CCCCC2)C1	ZINC001020542780	1317756753	/nfs/dbraw/zinc/75/67/53/1317756753.db2.gz	SHKYHKYOBAQLRE-JOCQHMNTSA-N	0	3	329.282	3.102	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@H](NC(=O)[C@@]34C[C@@H]3CCCC4)C2)c1	ZINC001020566269	1317777585	/nfs/dbraw/zinc/77/75/85/1317777585.db2.gz	KWIJAWPBEPJTHB-BOSXTWCSSA-N	0	3	341.430	3.014	20	30		EGEDHN
C#C[C@H](CC)NCc1cc(Br)c(OC)c(OCC)c1	ZINC000809686333	1317863033	/nfs/dbraw/zinc/86/30/33/1317863033.db2.gz	LTQVNMIRHZKJGQ-GFCCVEGCSA-N	0	3	326.234	3.358	20	30		EGEDHN
CC1/C(=C/c2ccc(C(=O)OC(C)(C)C)cc2)C(=O)c2ncnn21	ZINC000905087247	1317922126	/nfs/dbraw/zinc/92/21/26/1317922126.db2.gz	WSZVNHQFXFXXBE-HOXUKUGESA-N	0	3	325.368	3.074	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NC[C@H](c1ccsc1)N(CC)CC	ZINC000810115642	1317954277	/nfs/dbraw/zinc/95/42/77/1317954277.db2.gz	MLYGPAVFJMNQQC-LJQANCHMSA-N	0	3	340.492	3.471	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CNCc1cc(Br)ccc1Cl	ZINC000905526207	1317966123	/nfs/dbraw/zinc/96/61/23/1317966123.db2.gz	UPYGXUFIVLEDRQ-GFCCVEGCSA-N	0	3	345.668	3.493	20	30		EGEDHN
CC(C)[C@@]1(C)C[C@@H]1C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001020859656	1317967668	/nfs/dbraw/zinc/96/76/68/1317967668.db2.gz	CTJPMWKTAHKTSH-WOCWXWTJSA-N	0	3	343.446	3.116	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)c2cc(C)c(C)s2)C1	ZINC001021026294	1318051944	/nfs/dbraw/zinc/05/19/44/1318051944.db2.gz	CZUDKAHVTUAESP-HAQNSBGRSA-N	0	3	343.290	3.124	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2c[nH]cc2-c2ccccc2)C1	ZINC001021044989	1318059717	/nfs/dbraw/zinc/05/97/17/1318059717.db2.gz	WSXXITZRGZOSLG-SHTZXODSSA-N	0	3	329.831	3.285	20	30		EGEDHN
C=C1CCC(C(=O)NC2C[C@H]3CC[C@@H](C2)N3Cc2ccccn2)CC1	ZINC001021367942	1318212990	/nfs/dbraw/zinc/21/29/90/1318212990.db2.gz	APBBRYMJIRWEHM-IHWFROFDSA-N	0	3	339.483	3.440	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)C1(F)CCCCC1	ZINC000811883463	1318285342	/nfs/dbraw/zinc/28/53/42/1318285342.db2.gz	SHQFJDHZLHYQKP-UHFFFAOYSA-N	0	3	331.435	3.121	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC000959955337	1318286628	/nfs/dbraw/zinc/28/66/28/1318286628.db2.gz	RLESKFTYEXPESK-ZTWVHDNBSA-N	0	3	329.419	3.134	20	30		EGEDHN
C=CC(C)(C)CC(=O)N(C[C@@H](O)CC(C)(C)C)C1CCN(C)CC1	ZINC000907994245	1318289391	/nfs/dbraw/zinc/28/93/91/1318289391.db2.gz	VLZKVFZXZOTSBT-KRWDZBQOSA-N	0	3	338.536	3.309	20	30		EGEDHN
C[C@@H](NC[C@@H]1CCCCN1C(=O)C#CC1CC1)c1cc(F)ccc1F	ZINC000960005903	1318309839	/nfs/dbraw/zinc/30/98/39/1318309839.db2.gz	FSGAJDROBMMUPZ-PBHICJAKSA-N	0	3	346.421	3.410	20	30		EGEDHN
C#C[C@@H](C)N(C)C(=O)NC[C@@H](c1ccc(Cl)cc1)N(C)CCC	ZINC000812345588	1318372422	/nfs/dbraw/zinc/37/24/22/1318372422.db2.gz	FOSKBKCSKVXQHE-PBHICJAKSA-N	0	3	335.879	3.386	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@@H](CCCN3C(=O)C3=CCCC3)C2)c1	ZINC001021564229	1318413873	/nfs/dbraw/zinc/41/38/73/1318413873.db2.gz	XOHYOUXMQVIXHE-SFTDATJTSA-N	0	3	349.478	3.481	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc(C)nc(C)c1	ZINC000960273744	1318438736	/nfs/dbraw/zinc/43/87/36/1318438736.db2.gz	RUADMEHVWHXPMR-WOJBJXKFSA-N	0	3	335.451	3.260	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc3cc(C)cn3c2)C1	ZINC001021599600	1318442821	/nfs/dbraw/zinc/44/28/21/1318442821.db2.gz	IJAGJYVBAMFXJQ-WIYYLYMNSA-N	0	3	349.478	3.198	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc3cc(C)cn3c2)C1	ZINC001021599597	1318443268	/nfs/dbraw/zinc/44/32/68/1318443268.db2.gz	IJAGJYVBAMFXJQ-GHTZIAJQSA-N	0	3	349.478	3.198	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc2[nH]ccc2c1	ZINC000960301598	1318451720	/nfs/dbraw/zinc/45/17/20/1318451720.db2.gz	DXCXOTXEWANALG-WOJBJXKFSA-N	0	3	331.419	3.339	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cnc2ccccc2c1	ZINC000960311462	1318454386	/nfs/dbraw/zinc/45/43/86/1318454386.db2.gz	AKODVAMYTJIXCN-NHCUHLMSSA-N	0	3	343.430	3.406	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@H]1C[C@@H]1c1ccccc1	ZINC000960310295	1318454938	/nfs/dbraw/zinc/45/49/38/1318454938.db2.gz	GERYXOFHUZLQLB-PLACYPQZSA-N	0	3	332.447	3.348	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cccc(OC)c1C	ZINC000960314033	1318456719	/nfs/dbraw/zinc/45/67/19/1318456719.db2.gz	UUSNRGGWKFZKIP-UYAOXDASSA-N	0	3	336.435	3.175	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc2cccnc2c1	ZINC000960317561	1318457924	/nfs/dbraw/zinc/45/79/24/1318457924.db2.gz	WOVCPLBWKICRNB-NHCUHLMSSA-N	0	3	343.430	3.406	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc(OC)cc1	ZINC000960324471	1318461642	/nfs/dbraw/zinc/46/16/42/1318461642.db2.gz	DNKFHXMRTWDWNC-WOJBJXKFSA-N	0	3	336.435	3.257	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2nc3ccccc3cc2C)C1	ZINC001021635620	1318490639	/nfs/dbraw/zinc/49/06/39/1318490639.db2.gz	LFNRDAVIVFQUSU-AZUAARDMSA-N	0	3	347.462	3.103	20	30		EGEDHN
CC(COC(=O)c1cccc(Oc2ccc(C#N)cc2)c1)[N+](=O)[O-]	ZINC000813110002	1318500877	/nfs/dbraw/zinc/50/08/77/1318500877.db2.gz	YJHZLJSTIYKUCT-LBPRGKRZSA-N	0	3	326.308	3.173	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc3[nH]ccc3c2)C1	ZINC001021651884	1318513533	/nfs/dbraw/zinc/51/35/33/1318513533.db2.gz	FTQHBSUOOTZIOJ-AZUAARDMSA-N	0	3	335.451	3.118	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2nccc3ccccc32)C1	ZINC001021661835	1318525257	/nfs/dbraw/zinc/52/52/57/1318525257.db2.gz	RYYHUISLLKQUIO-AZUAARDMSA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(C)cc2F)C1	ZINC001021676666	1318543971	/nfs/dbraw/zinc/54/39/71/1318543971.db2.gz	MBFXHOLBOWGDHR-QFBILLFUSA-N	0	3	328.431	3.084	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(C)cc2F)C1	ZINC001021676662	1318544226	/nfs/dbraw/zinc/54/42/26/1318544226.db2.gz	MBFXHOLBOWGDHR-APWZRJJASA-N	0	3	328.431	3.084	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cccc3c2ccn3C)C1	ZINC001021693032	1318567058	/nfs/dbraw/zinc/56/70/58/1318567058.db2.gz	XIFANMYAUQIIAJ-PXNSSMCTSA-N	0	3	349.478	3.128	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2[nH]c3ccc(C)cc3c2C)C1	ZINC001021703691	1318576119	/nfs/dbraw/zinc/57/61/19/1318576119.db2.gz	AYNKTJWWILUOPF-PXNSSMCTSA-N	0	3	349.478	3.344	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2oc(CC)cc2C)C1	ZINC001021717016	1318597228	/nfs/dbraw/zinc/59/72/28/1318597228.db2.gz	NPHIGLHIZQZTKE-WMZOPIPTSA-N	0	3	328.456	3.100	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(Cl)cc2)C1	ZINC001021720692	1318603612	/nfs/dbraw/zinc/60/36/12/1318603612.db2.gz	YQCPFUWEADVGLW-FUHWJXTLSA-N	0	3	330.859	3.290	20	30		EGEDHN
CCCOc1cccc(CN(C)C[C@H]2CCCN2C(=O)[C@H](C)C#N)c1	ZINC000960502417	1318612483	/nfs/dbraw/zinc/61/24/83/1318612483.db2.gz	NGPNWAIVNRVFSU-SJLPKXTDSA-N	0	3	343.471	3.058	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(CC(C)C)cc2)C1	ZINC001021729771	1318629932	/nfs/dbraw/zinc/62/99/32/1318629932.db2.gz	HHPYXGOVXXGXBB-LEWJYISDSA-N	0	3	338.495	3.445	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)Cc2ccc(C)c(C)c2)C1	ZINC001021730055	1318631624	/nfs/dbraw/zinc/63/16/24/1318631624.db2.gz	KWJBQPNTHVQZPF-SFTDATJTSA-N	0	3	338.495	3.182	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(C)c(C)s2)C1	ZINC001021730683	1318632910	/nfs/dbraw/zinc/63/29/10/1318632910.db2.gz	PNEMBFVBUZBQLH-SJORKVTESA-N	0	3	330.497	3.315	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cccn2C(C)C)C1	ZINC001021744090	1318658906	/nfs/dbraw/zinc/65/89/06/1318658906.db2.gz	URAQDIBNIHJNDK-MSOLQXFVSA-N	0	3	327.472	3.019	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)CC(C)(C)c2ccccc2)C1	ZINC001021743962	1318659297	/nfs/dbraw/zinc/65/92/97/1318659297.db2.gz	STLGYTORMONRJO-AZUAARDMSA-N	0	3	338.495	3.300	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(C(C)(F)F)cc2)C1	ZINC001021745492	1318660717	/nfs/dbraw/zinc/66/07/17/1318660717.db2.gz	BHHRFRVAFBVEFZ-AEFFLSMTSA-N	0	3	346.421	3.358	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(C(C)(F)F)cc2)C1	ZINC001021745493	1318662015	/nfs/dbraw/zinc/66/20/15/1318662015.db2.gz	BHHRFRVAFBVEFZ-FUHWJXTLSA-N	0	3	346.421	3.358	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)CCc2ccc(C)s2)C1	ZINC001021751703	1318666000	/nfs/dbraw/zinc/66/60/00/1318666000.db2.gz	LCJBRZHFMMAZIV-IEBWSBKVSA-N	0	3	344.524	3.325	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)[C@H]1CC1(C)C	ZINC000960564894	1318698131	/nfs/dbraw/zinc/69/81/31/1318698131.db2.gz	QZPKGTGMZIPNSB-QZTJIDSGSA-N	0	3	325.456	3.027	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1nnc(SCc2ccccc2)s1	ZINC000911971879	1318788884	/nfs/dbraw/zinc/78/88/84/1318788884.db2.gz	QUIVGCHDKSQJOV-ZDUSSCGKSA-N	0	3	348.497	3.453	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)Cc1ccccc1	ZINC000960704821	1318807688	/nfs/dbraw/zinc/80/76/88/1318807688.db2.gz	SZJVFYSNWMKQLB-OAQYLSRUSA-N	0	3	347.462	3.224	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)NC1(c2noc(C)n2)CCCC1	ZINC000912201852	1318848405	/nfs/dbraw/zinc/84/84/05/1318848405.db2.gz	XLLBKJKHNVXPKZ-OAHLLOKOSA-N	0	3	336.480	3.341	20	30		EGEDHN
C[Si](C)(C)C#CCCNC(=O)c1cccc(CN2CCCC2)c1	ZINC000912333037	1318872849	/nfs/dbraw/zinc/87/28/49/1318872849.db2.gz	GUGOVVKDZLNXJX-UHFFFAOYSA-N	0	3	328.532	3.283	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2nc3ccccc3cc2C)C1	ZINC001022452792	1318947479	/nfs/dbraw/zinc/94/74/79/1318947479.db2.gz	RPWAZUVCWCTVGV-GASCZTMLSA-N	0	3	329.831	3.146	20	30		EGEDHN
CC(C)(C(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1)C1CCC1	ZINC001022500937	1318967162	/nfs/dbraw/zinc/96/71/62/1318967162.db2.gz	ILYCQLQCLQNCSK-CALCHBBNSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc(OC)c(C3CC3)c2)C1	ZINC001022914934	1319165307	/nfs/dbraw/zinc/16/53/07/1319165307.db2.gz	BMSORBBRWMDDCE-GASCZTMLSA-N	0	3	334.847	3.176	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)c2cc(C)c(C)s2)C1	ZINC001023067509	1319250133	/nfs/dbraw/zinc/25/01/33/1319250133.db2.gz	CZUDKAHVTUAESP-TXEJJXNPSA-N	0	3	343.290	3.124	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@@]2(C)CCc3ccccc3C2)C1	ZINC001023186209	1319311570	/nfs/dbraw/zinc/31/15/70/1319311570.db2.gz	XQWGCSIAMMLXBR-SCTDSRPQSA-N	0	3	332.875	3.171	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]([C@H]2CCN(Cc3cncs3)C2)C1	ZINC000961229160	1319358060	/nfs/dbraw/zinc/35/80/60/1319358060.db2.gz	LQJZRGXJJVXPQT-HOTGVXAUSA-N	0	3	347.528	3.416	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]([C@@H]2CCN(Cc3cc(C)no3)C2)C1	ZINC000961232665	1319363251	/nfs/dbraw/zinc/36/32/51/1319363251.db2.gz	UGCOSISZTWPNAP-IAGOWNOFSA-N	0	3	345.487	3.256	20	30		EGEDHN
CC[C@H](C#N)Oc1cc(CN[C@@H](C)c2cnccc2N)ccc1OC	ZINC000817917035	1319459647	/nfs/dbraw/zinc/45/96/47/1319459647.db2.gz	DKUCBAGDRHHCOZ-DZGCQCFKSA-N	0	3	340.427	3.035	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cccc(C(F)F)c2F)C1	ZINC001023371367	1319483778	/nfs/dbraw/zinc/48/37/78/1319483778.db2.gz	YHVCJDBXJCRCDP-ZDUSSCGKSA-N	0	3	338.373	3.228	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N1CCC[C@H]1c1ccccc1C(F)(F)F	ZINC000818109442	1319501513	/nfs/dbraw/zinc/50/15/13/1319501513.db2.gz	CPIXJISCPLOGSO-CABCVRRESA-N	0	3	339.361	3.390	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cncc(-c3ccccc3)c2)C1	ZINC001023403698	1319513069	/nfs/dbraw/zinc/51/30/69/1319513069.db2.gz	NKWWSFSTLHESOL-GOSISDBHSA-N	0	3	347.462	3.214	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](C2CCN(C(=O)[C@H]3CC3(F)F)CC2)C1	ZINC000961358411	1319515788	/nfs/dbraw/zinc/51/57/88/1319515788.db2.gz	FVWYLOCCGOREDW-HUUCEWRRSA-N	0	3	346.849	3.345	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cccc3ccc(C)nc32)C1	ZINC001023440580	1319535840	/nfs/dbraw/zinc/53/58/40/1319535840.db2.gz	IZADCDIEGVRXOM-QGZVFWFLSA-N	0	3	335.451	3.008	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)[C@@H]2CC[C@@H](c3ccccc3)C2)C1	ZINC001023452105	1319556201	/nfs/dbraw/zinc/55/62/01/1319556201.db2.gz	XDXHEHIKIIPWHM-HMXCVIKNSA-N	0	3	338.495	3.422	20	30		EGEDHN
C#CCN(C)CCCNC(=O)CCCc1cccc(C(F)(F)F)c1	ZINC000818593380	1319565737	/nfs/dbraw/zinc/56/57/37/1319565737.db2.gz	WXWLGNPDFSIMTI-UHFFFAOYSA-N	0	3	340.389	3.099	20	30		EGEDHN
C#CCN(C)CCCNC(=O)C(C)(C)c1ccc(OCC(C)C)cc1	ZINC000818603342	1319566460	/nfs/dbraw/zinc/56/64/60/1319566460.db2.gz	ZBRPOBWJPQTFIG-UHFFFAOYSA-N	0	3	344.499	3.070	20	30		EGEDHN
C=CCN1CCC[C@H](CNC(=O)c2scnc2C2CCCC2)C1	ZINC001023470114	1319568698	/nfs/dbraw/zinc/56/86/98/1319568698.db2.gz	SULKDBUZPUYMIC-CQSZACIVSA-N	0	3	333.501	3.429	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc3c4c(cccc42)CC3)C1	ZINC001023475358	1319576098	/nfs/dbraw/zinc/57/60/98/1319576098.db2.gz	XGHYYZNLCQWNGG-KRWDZBQOSA-N	0	3	346.474	3.404	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CNCc2ccc(OC3CCCC3)nc2)cc1	ZINC000818964073	1319593899	/nfs/dbraw/zinc/59/38/99/1319593899.db2.gz	JWGDKJZXCHOLHK-IBGZPJMESA-N	0	3	337.423	3.098	20	30		EGEDHN
N#Cc1ccccc1CNCC1CC(NC(=O)C2CCCCC2)C1	ZINC000961501804	1319619585	/nfs/dbraw/zinc/61/95/85/1319619585.db2.gz	VTORXZBTVFUGCK-UHFFFAOYSA-N	0	3	325.456	3.123	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCCN(Cc3cccnc3C)C2)cc1	ZINC001023527271	1319632989	/nfs/dbraw/zinc/63/29/89/1319632989.db2.gz	SCRHDLQXXAYYCH-LJQANCHMSA-N	0	3	347.462	3.013	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCCN(Cc3ncccc3C)C2)cc1	ZINC001023527599	1319633498	/nfs/dbraw/zinc/63/34/98/1319633498.db2.gz	YLZSAPWNLVWXHK-IBGZPJMESA-N	0	3	347.462	3.013	20	30		EGEDHN
Cc1coc(C(=O)NC[C@H]2CCCN(Cc3cccc(C#N)c3)C2)c1	ZINC001023547892	1319659299	/nfs/dbraw/zinc/65/92/99/1319659299.db2.gz	YBEKTTNHIYJZSO-GOSISDBHSA-N	0	3	337.423	3.102	20	30		EGEDHN
N#CC(C(=O)COc1cccc(Cl)c1)C(=O)Nc1ccccc1	ZINC000916898616	1319721330	/nfs/dbraw/zinc/72/13/30/1319721330.db2.gz	FHXXJRPIKVIYTI-OAHLLOKOSA-N	0	3	328.755	3.066	20	30		EGEDHN
Cc1nc(C)c(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)s1	ZINC000916907200	1319723498	/nfs/dbraw/zinc/72/34/98/1319723498.db2.gz	VHVIOJPOVDYMJD-SNVBAGLBSA-N	0	3	333.800	3.375	20	30		EGEDHN
CN(CCCOc1ccc(C#N)cc1)C[C@H]1COc2ccccc2O1	ZINC000917022664	1319739884	/nfs/dbraw/zinc/73/98/84/1319739884.db2.gz	PIQVZSVBDVRASU-SFHVURJKSA-N	0	3	338.407	3.099	20	30		EGEDHN
C#CCN1CCC[C@@H](CNC(=O)c2cc3cc(C)ccc3s2)C1	ZINC001023677253	1319790335	/nfs/dbraw/zinc/79/03/35/1319790335.db2.gz	GRKMFDOMGFBJGM-HNNXBMFYSA-N	0	3	326.465	3.285	20	30		EGEDHN
CC[C@H](Cc1ccccc1C)C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000819952699	1319809864	/nfs/dbraw/zinc/80/98/64/1319809864.db2.gz	VASICXGZEOJJIQ-WBVHZDCISA-N	0	3	335.407	3.306	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC001023716754	1319848848	/nfs/dbraw/zinc/84/88/48/1319848848.db2.gz	RFCHBYCDGSUENJ-QGZVFWFLSA-N	0	3	326.484	3.449	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cccc(Cl)c2Cl)C1	ZINC001023718382	1319854659	/nfs/dbraw/zinc/85/46/59/1319854659.db2.gz	RXRVVSCXHBLRQE-CYBMUJFWSA-N	0	3	339.266	3.459	20	30		EGEDHN
C#CCN1CCC[C@@H](CNC(=O)c2cc3c(s2)CCCCC3)C1	ZINC001023736279	1319879727	/nfs/dbraw/zinc/87/97/27/1319879727.db2.gz	YXEKIINMMOWQRF-HNNXBMFYSA-N	0	3	330.497	3.092	20	30		EGEDHN
C=CCc1cc(C(=O)NC[C@@H](C)N2CCCCC2)cc(OC)c1OC	ZINC000917839044	1319880572	/nfs/dbraw/zinc/88/05/72/1319880572.db2.gz	VQNKMDQWGDJXTI-OAHLLOKOSA-N	0	3	346.471	3.037	20	30		EGEDHN
CCC(CC)C(=O)N1CCC[C@@H](CNCc2ccccc2C#N)C1	ZINC001023853436	1319990015	/nfs/dbraw/zinc/99/00/15/1319990015.db2.gz	WJGVQXRXAHVKIM-INIZCTEOSA-N	0	3	327.472	3.323	20	30		EGEDHN
C#CC[C@H](CO)NCc1cccc(NC(=O)c2ccccc2Cl)c1	ZINC000821207373	1320003376	/nfs/dbraw/zinc/00/33/76/1320003376.db2.gz	OOZOEYXWOOOKTH-MRXNPFEDSA-N	0	3	342.826	3.066	20	30		EGEDHN
C#CC1CCN(C(=O)NC[C@H](c2ccsc2)N(CC)CC)CC1	ZINC000825638543	1320351880	/nfs/dbraw/zinc/35/18/80/1320351880.db2.gz	CZDGDLZMMSHYPB-QGZVFWFLSA-N	0	3	333.501	3.186	20	30		EGEDHN
C=C(Cl)CNC(=O)NC[C@H](c1ccc(SC)cc1)N(C)C	ZINC000838624617	1320796251	/nfs/dbraw/zinc/79/62/51/1320796251.db2.gz	HEFCEBMWQCKNPV-CQSZACIVSA-N	0	3	327.881	3.063	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]\C[C@@H](O)Cc2cccc(F)c2)c([O-])c1	ZINC000840707063	1321131406	/nfs/dbraw/zinc/13/14/06/1321131406.db2.gz	NEHPAJCDQILERN-CVHFWEDTSA-N	0	3	344.430	3.400	20	30		EGEDHN
CO[C@H](CC(C)C)C(=O)C(C#N)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000842288473	1321367570	/nfs/dbraw/zinc/36/75/70/1321367570.db2.gz	IPKWNJSQUCNRHD-BXUZGUMPSA-N	0	3	340.782	3.188	20	30		EGEDHN
C[C@H](C#N)Oc1ccccc1NC(=O)NC[C@@H]1CCCCN1C1CC1	ZINC000930760840	1328960049	/nfs/dbraw/zinc/96/00/49/1328960049.db2.gz	LFZUFVXELRGPGF-ZBFHGGJFSA-N	0	3	342.443	3.116	20	30		EGEDHN
CC(C)N(Cc1ccc(N(C)C)cc1)Cc1cnc2c(C#N)cnn2c1	ZINC000843393962	1321511034	/nfs/dbraw/zinc/51/10/34/1321511034.db2.gz	DZOVNXLJIAJQMA-UHFFFAOYSA-N	0	3	348.454	3.078	20	30		EGEDHN
Cc1ccc(CN2C[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]3C2)cc1C#N	ZINC000859288888	1328961912	/nfs/dbraw/zinc/96/19/12/1328961912.db2.gz	FGTDJBVFKCDNNP-HDICACEKSA-N	0	3	341.455	3.165	20	30		EGEDHN
C=C(C)[C@H](CC(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-])OCC	ZINC000845872940	1321747200	/nfs/dbraw/zinc/74/72/00/1321747200.db2.gz	AWXJSMHBOACPDJ-YLQAJVPDSA-N	0	3	339.363	3.447	20	30		EGEDHN
C=C(C)[C@H](CC(=O)O[C@H](c1ccccc1F)C(C)[N+](=O)[O-])OCC	ZINC000845872935	1321747325	/nfs/dbraw/zinc/74/73/25/1321747325.db2.gz	AWXJSMHBOACPDJ-NUTKFTJISA-N	0	3	339.363	3.447	20	30		EGEDHN
N#CC1(COC(=O)Cc2ccoc2)CCN(Cc2ccccc2)CC1	ZINC000847747717	1321900389	/nfs/dbraw/zinc/90/03/89/1321900389.db2.gz	OLENKACAVIGPCI-UHFFFAOYSA-N	0	3	338.407	3.171	20	30		EGEDHN
N#CC1(COC(=O)Cc2ccco2)CCN(Cc2ccccc2)CC1	ZINC000847748056	1321900404	/nfs/dbraw/zinc/90/04/04/1321900404.db2.gz	WVGUHQJZYYHXKZ-UHFFFAOYSA-N	0	3	338.407	3.171	20	30		EGEDHN
N#C[C@@H]1CCCN(C(=O)N[C@@H](CN2CCCCC2)c2ccccc2)C1	ZINC000918861644	1322005070	/nfs/dbraw/zinc/00/50/70/1322005070.db2.gz	PJDQENDAVIUIPK-HKUYNNGSSA-N	0	3	340.471	3.159	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)CCCc1cccnc1)c1ccccc1	ZINC000850978030	1322318937	/nfs/dbraw/zinc/31/89/37/1322318937.db2.gz	KDKUHUMCEFMTBD-OALUTQOASA-N	0	3	349.434	3.381	20	30		EGEDHN
CC[C@@H](C[C@H](C)CO)NCc1cc(C#N)ccc1Br	ZINC000921807400	1322401340	/nfs/dbraw/zinc/40/13/40/1322401340.db2.gz	QAXJCNWENNVVOY-FZMZJTMJSA-N	0	3	325.250	3.207	20	30		EGEDHN
N#Cc1ccc(Br)c(CNCC2(CCO)CCCC2)c1	ZINC000921807868	1322401360	/nfs/dbraw/zinc/40/13/60/1322401360.db2.gz	UYWWAJDXVGJISV-UHFFFAOYSA-N	0	3	337.261	3.353	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC[C@H](CNCc2nccs2)C1	ZINC001024002725	1323073654	/nfs/dbraw/zinc/07/36/54/1323073654.db2.gz	IAQIHDWQPRXCNA-CYBMUJFWSA-N	0	3	341.908	3.250	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCN(C(=O)C2C=CC=CC=C2)C1	ZINC001024006526	1323077246	/nfs/dbraw/zinc/07/72/46/1323077246.db2.gz	DJXSWFXSXKTBKD-GOSISDBHSA-N	0	3	347.462	3.185	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](CNCc2cc(C3CC3)no2)C1	ZINC001024093205	1323123649	/nfs/dbraw/zinc/12/36/49/1323123649.db2.gz	QVTQXLRDGBCORJ-AWEZNQCLSA-N	0	3	331.460	3.092	20	30		EGEDHN
Cc1cocc1C(=O)N1CCC[C@H](CNCc2ccccc2C#N)C1	ZINC001024100967	1323132433	/nfs/dbraw/zinc/13/24/33/1323132433.db2.gz	DKGBTDJMPJSMSB-MRXNPFEDSA-N	0	3	337.423	3.102	20	30		EGEDHN
C#C[C@](C)(CC)NCC(=O)N(C)Cc1ccc2cc(OC)ccc2c1	ZINC000852098703	1323146228	/nfs/dbraw/zinc/14/62/28/1323146228.db2.gz	UGAXICFXJWXYNN-OAQYLSRUSA-N	0	3	338.451	3.198	20	30		EGEDHN
C#C[C@](C)(CC)NCC(=O)NCCc1cccc(Cl)c1Cl	ZINC000852102645	1323148069	/nfs/dbraw/zinc/14/80/69/1323148069.db2.gz	MQCQFBGUZJGRMY-MRXNPFEDSA-N	0	3	327.255	3.044	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ncn2cc(Cl)ccc12	ZINC001024448258	1323407017	/nfs/dbraw/zinc/40/70/17/1323407017.db2.gz	GYAGZBYFLUIKOO-HNNXBMFYSA-N	0	3	346.862	3.148	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1nsc2ccccc21	ZINC001024452909	1323410972	/nfs/dbraw/zinc/41/09/72/1323410972.db2.gz	CGRNNTDMVSRUEH-AWEZNQCLSA-N	0	3	329.469	3.457	20	30		EGEDHN
C=CCCN1CCCC[C@@H]1CNC(=O)c1c(C)noc1C(F)F	ZINC001024499975	1323448287	/nfs/dbraw/zinc/44/82/87/1323448287.db2.gz	SGLBRVNSZMKDOU-GFCCVEGCSA-N	0	3	327.375	3.081	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1cc(C2CC2)[nH]c1C1CC1	ZINC001024509708	1323457964	/nfs/dbraw/zinc/45/79/64/1323457964.db2.gz	YBIZSIXVQDUDJI-KRWDZBQOSA-N	0	3	339.483	3.377	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@H]1CCOc2c(F)cccc21	ZINC001024546243	1323487027	/nfs/dbraw/zinc/48/70/27/1323487027.db2.gz	WBKADODFINDBMV-WBVHZDCISA-N	0	3	346.446	3.239	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1c(C)occ1C(F)(F)F	ZINC001024558960	1323499149	/nfs/dbraw/zinc/49/91/49/1323499149.db2.gz	PSKJAWNTYPLNNA-CYBMUJFWSA-N	0	3	342.361	3.214	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1ccc(F)cc1F	ZINC001024573573	1323511126	/nfs/dbraw/zinc/51/11/26/1323511126.db2.gz	QMTYGPABAISDBM-BPQIPLTHSA-N	0	3	346.421	3.062	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1c(F)cccc1F	ZINC001024636580	1323563241	/nfs/dbraw/zinc/56/32/41/1323563241.db2.gz	UIHFDDOIAVCSFB-BZUAXINKSA-N	0	3	346.421	3.062	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccc(F)c(Cl)c1F	ZINC001024638040	1323564267	/nfs/dbraw/zinc/56/42/67/1323564267.db2.gz	RHQBEGUHNDLIIX-LBPRGKRZSA-N	0	3	340.801	3.226	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cnn(CC2CCCC2)c1	ZINC001024732316	1323633019	/nfs/dbraw/zinc/63/30/19/1323633019.db2.gz	SWJKFPDBPHWMHW-LJQANCHMSA-N	0	3	344.503	3.234	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cnn([C@H](C)CC)c1C	ZINC001024750034	1323652675	/nfs/dbraw/zinc/65/26/75/1323652675.db2.gz	KIKRBYPREPOTCZ-WBVHZDCISA-N	0	3	332.492	3.323	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCCCN2Cc2ccc(C)cc2)cn1	ZINC001024769419	1323668964	/nfs/dbraw/zinc/66/89/64/1323668964.db2.gz	HLWYVTPFICPCFD-NRFANRHFSA-N	0	3	347.462	3.156	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCCCN2Cc2ccc(C)cc2)cn1	ZINC001024769421	1323669665	/nfs/dbraw/zinc/66/96/65/1323669665.db2.gz	HLWYVTPFICPCFD-OAQYLSRUSA-N	0	3	347.462	3.156	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1c(Cl)nc2ccccn21	ZINC001024788916	1323694609	/nfs/dbraw/zinc/69/46/09/1323694609.db2.gz	PGECTWUEMDNFCX-CQSZACIVSA-N	0	3	346.862	3.148	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@H]1Cc2cc(C)c(C)cc2O1	ZINC001024809207	1323711901	/nfs/dbraw/zinc/71/19/01/1323711901.db2.gz	QYYAAIFEOXKFKA-UYAOXDASSA-N	0	3	342.483	3.154	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1ccc(F)cc1	ZINC001024817427	1323720606	/nfs/dbraw/zinc/72/06/06/1323720606.db2.gz	ZPCNWJYQKPBJOB-CEXWTWQISA-N	0	3	330.447	3.476	20	30		EGEDHN
CC(C)=CC(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001024854151	1323747324	/nfs/dbraw/zinc/74/73/24/1323747324.db2.gz	AFQVQFCLMVODHB-QGZVFWFLSA-N	0	3	329.419	3.134	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)C2CC=CC2)c(F)c1	ZINC001024909551	1323775526	/nfs/dbraw/zinc/77/55/26/1323775526.db2.gz	JRNJEYYQOHHVAG-GOSISDBHSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCCC[C@H]1CNCc1n[nH]c(C(C)C)n1	ZINC001025037800	1323840284	/nfs/dbraw/zinc/84/02/84/1323840284.db2.gz	BXBMJAPLJNKQEZ-HNNXBMFYSA-N	0	3	347.507	3.001	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@H]1CNCc1c(C)onc1CC	ZINC001025040388	1323841778	/nfs/dbraw/zinc/84/17/78/1323841778.db2.gz	BMZOEKQQMNIOHW-HNNXBMFYSA-N	0	3	333.476	3.228	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@@H]1CNCc1ccc(Cl)nc1	ZINC001025041088	1323843308	/nfs/dbraw/zinc/84/33/08/1323843308.db2.gz	SPLOLYDSDCZXKB-OAHLLOKOSA-N	0	3	335.879	3.418	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCCC[C@H]2CNCc2cncc(F)c2)C1	ZINC001025074189	1323876966	/nfs/dbraw/zinc/87/69/66/1323876966.db2.gz	INNPHZGJMFDARI-KRWDZBQOSA-N	0	3	331.435	3.048	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccccc1F	ZINC001025190343	1323967215	/nfs/dbraw/zinc/96/72/15/1323967215.db2.gz	AXFWHBIPRBXMOT-OALUTQOASA-N	0	3	328.431	3.308	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1onc2c1CCCC2	ZINC001025250138	1324050480	/nfs/dbraw/zinc/05/04/80/1324050480.db2.gz	HETDDMLNVCTPJC-ROUUACIJSA-N	0	3	343.471	3.199	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cccc(C(C)C)n1	ZINC001025250285	1324050682	/nfs/dbraw/zinc/05/06/82/1324050682.db2.gz	ILCYFIUDGVKARD-PMACEKPBSA-N	0	3	339.483	3.297	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cccc2ncccc21	ZINC001025256700	1324064167	/nfs/dbraw/zinc/06/41/67/1324064167.db2.gz	ZLAMPIZJJPPYTA-LEWJYISDSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc[nH]c1C(C)C	ZINC001025262912	1324073635	/nfs/dbraw/zinc/07/36/35/1324073635.db2.gz	GYISMTRHOJMBBQ-ZWKOTPCHSA-N	0	3	327.472	3.230	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)C(C)(C)C(F)F	ZINC001025268504	1324079967	/nfs/dbraw/zinc/07/99/67/1324079967.db2.gz	BUSKUVGVOLFENV-LSDHHAIUSA-N	0	3	326.431	3.147	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1nc(CC)oc1C	ZINC001025277066	1324097786	/nfs/dbraw/zinc/09/77/86/1324097786.db2.gz	NAFYDSCNWYTDCL-HOTGVXAUSA-N	0	3	331.460	3.191	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc2sccc2[nH]1	ZINC001025283979	1324105647	/nfs/dbraw/zinc/10/56/47/1324105647.db2.gz	DAPCDWOZFNZFPT-DLBZAZTESA-N	0	3	341.480	3.322	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1oc(CC)nc1C	ZINC001025287542	1324109516	/nfs/dbraw/zinc/10/95/16/1324109516.db2.gz	OOTFDHFXTLCXHO-HOTGVXAUSA-N	0	3	331.460	3.191	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccccc1OC	ZINC001025291568	1324115503	/nfs/dbraw/zinc/11/55/03/1324115503.db2.gz	AXJHIYAFAFPOTF-OALUTQOASA-N	0	3	340.467	3.178	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)Cc1cc(C)ccc1F	ZINC001025291484	1324115543	/nfs/dbraw/zinc/11/55/43/1324115543.db2.gz	AFXFLOUBFCFWKR-VQTJNVASSA-N	0	3	342.458	3.155	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc(F)cc1C	ZINC001025292997	1324118854	/nfs/dbraw/zinc/11/88/54/1324118854.db2.gz	OOZDMUMIQPBWNE-RTBURBONSA-N	0	3	328.431	3.226	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ncccc1Cl	ZINC001025293590	1324120430	/nfs/dbraw/zinc/12/04/30/1324120430.db2.gz	SAWGEMMZSFCYOQ-DLBZAZTESA-N	0	3	345.874	3.217	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)Cn1ccc2ccccc21	ZINC001025293571	1324120570	/nfs/dbraw/zinc/12/05/70/1324120570.db2.gz	DQFMXMRCHMFUMW-NHCUHLMSSA-N	0	3	349.478	3.120	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ncccc1Cl	ZINC001025293593	1324120665	/nfs/dbraw/zinc/12/06/65/1324120665.db2.gz	SAWGEMMZSFCYOQ-SJORKVTESA-N	0	3	345.874	3.217	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)CCc1ccc(C)o1	ZINC001025301400	1324133910	/nfs/dbraw/zinc/13/39/10/1324133910.db2.gz	JCUVLJCEPPSBHV-PMACEKPBSA-N	0	3	342.483	3.389	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(C(F)F)ccc2F)C1	ZINC001025423409	1324255786	/nfs/dbraw/zinc/25/57/86/1324255786.db2.gz	RSRLALQQNPMVJS-GXTWGEPZSA-N	0	3	338.373	3.227	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc3ccccc3nc2C)C1	ZINC001025432210	1324270521	/nfs/dbraw/zinc/27/05/21/1324270521.db2.gz	GXJDJMZXMPCBKW-QAPCUYQASA-N	0	3	335.451	3.007	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2coc3cc(F)ccc23)C1	ZINC001025461874	1324308276	/nfs/dbraw/zinc/30/82/76/1324308276.db2.gz	XNEPPOPJVVRXPS-UONOGXRCSA-N	0	3	328.387	3.035	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cn(CC)c3ccccc23)C1	ZINC001025478165	1324324045	/nfs/dbraw/zinc/32/40/45/1324324045.db2.gz	KKQCBCDMHSNOSF-IAGOWNOFSA-N	0	3	337.467	3.125	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(C3CC3)oc2C2CC2)C1	ZINC001025484225	1324331734	/nfs/dbraw/zinc/33/17/34/1324331734.db2.gz	AVHVBEDZHYKIOB-WMLDXEAASA-N	0	3	340.467	3.498	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H](C)[C@@H]2CCCN(Cc3ccccn3)C2)cc1	ZINC001025504058	1324353439	/nfs/dbraw/zinc/35/34/39/1324353439.db2.gz	XYARHFIUFGJHEY-FXAWDEMLSA-N	0	3	347.462	3.093	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc3ncccc3c2)C1	ZINC001025524525	1324370514	/nfs/dbraw/zinc/37/05/14/1324370514.db2.gz	UQGUWJJRSKWQIQ-QFBILLFUSA-N	0	3	335.451	3.088	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(Cl)cc(OC)c2)C1	ZINC001025578569	1324419573	/nfs/dbraw/zinc/41/95/73/1324419573.db2.gz	YBSLLWBVVVYDTB-HUUCEWRRSA-N	0	3	348.874	3.202	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(-c3ccco3)s2)C1	ZINC001025582226	1324423234	/nfs/dbraw/zinc/42/32/34/1324423234.db2.gz	PZXRQUMQNYSUHK-LSDHHAIUSA-N	0	3	342.464	3.472	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2occ3c2CCCC3)C1	ZINC001025602566	1324449883	/nfs/dbraw/zinc/44/98/83/1324449883.db2.gz	IMRQUISPBRAPKG-CVEARBPZSA-N	0	3	328.456	3.012	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2sccc2C2CC2)C1	ZINC001025611682	1324464285	/nfs/dbraw/zinc/46/42/85/1324464285.db2.gz	OBBOJZRGXOTLRK-GDBMZVCRSA-N	0	3	330.497	3.479	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(F)c3occc32)C1	ZINC001025624583	1324474661	/nfs/dbraw/zinc/47/46/61/1324474661.db2.gz	NROLOLNQKLLKEN-ZIAGYGMSSA-N	0	3	328.387	3.035	20	30		EGEDHN
Cc1ccoc1C(=O)N1C[C@@H]2CC[C@@H](NCc3ccccc3C#N)[C@@H]2C1	ZINC001026198014	1324658606	/nfs/dbraw/zinc/65/86/06/1324658606.db2.gz	CMIWFXLKOCNSDE-IPMKNSEASA-N	0	3	349.434	3.100	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CC[C@H]2CN(C(=O)CC3CCC3)C[C@H]21	ZINC001026229730	1324673337	/nfs/dbraw/zinc/67/33/37/1324673337.db2.gz	QAAYFNZJWZAQIG-XUVXKRRUSA-N	0	3	337.467	3.075	20	30		EGEDHN
N#Cc1ccccc1CNC1CCC(NC(=O)c2cccs2)CC1	ZINC001026446373	1324810339	/nfs/dbraw/zinc/81/03/39/1324810339.db2.gz	YASHBRPHVOLNCZ-UHFFFAOYSA-N	0	3	339.464	3.451	20	30		EGEDHN
Cc1cccnc1C(=O)NC1CCC(NCc2ccccc2C#N)CC1	ZINC001026473413	1324832151	/nfs/dbraw/zinc/83/21/51/1324832151.db2.gz	NXSBWEOTTHCDPS-UHFFFAOYSA-N	0	3	348.450	3.093	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)C2CC(C)(C)C2)CC1	ZINC001026488086	1324842382	/nfs/dbraw/zinc/84/23/82/1324842382.db2.gz	KSWLRGKTALYKPH-UHFFFAOYSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=C1CC(C)(C(=O)NC2CCC(NCc3oc(CC)nc3C)CC2)C1	ZINC001026555762	1324893025	/nfs/dbraw/zinc/89/30/25/1324893025.db2.gz	KYCKPKYETVKVHR-UHFFFAOYSA-N	0	3	345.487	3.419	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001026692064	1324980322	/nfs/dbraw/zinc/98/03/22/1324980322.db2.gz	LEVZCPQFVFULDS-CQSZACIVSA-N	0	3	331.435	3.072	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCN(C(=O)[C@@H]2C[C@@H]3C=C[C@H]2CC3)C1	ZINC001026856624	1325045509	/nfs/dbraw/zinc/04/55/09/1325045509.db2.gz	GPQJBALLKBMMOO-DCXXXQMHSA-N	0	3	349.478	3.099	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@H](CNCc2oc(C)nc2C)C1	ZINC001026865834	1325054099	/nfs/dbraw/zinc/05/40/99/1325054099.db2.gz	MSVZBPMLYLYYKG-CQSZACIVSA-N	0	3	339.867	3.008	20	30		EGEDHN
CC1(C(=O)N2CC[C@@H](CNCc3cc(F)ccc3C#N)C2)CCCC1	ZINC001026978161	1325121237	/nfs/dbraw/zinc/12/12/37/1325121237.db2.gz	JKCQECHKKRKQCY-HNNXBMFYSA-N	0	3	343.446	3.216	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H](CNCc2nc(C)c(C)s2)C1	ZINC001027039072	1325173067	/nfs/dbraw/zinc/17/30/67/1325173067.db2.gz	VGBGZZBKXFFCRV-CRAIPNDOSA-N	0	3	335.517	3.300	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@H](CNCc2csc(CC)n2)C1	ZINC001027040366	1325174391	/nfs/dbraw/zinc/17/43/91/1325174391.db2.gz	AMJOGKBEVAAXGF-KSSFIOAISA-N	0	3	335.517	3.246	20	30		EGEDHN
C[C@@H](CC(C)(C)C#N)N[C@H]1CCN(CCCc2ccccc2)C1=O	ZINC000925499045	1325179491	/nfs/dbraw/zinc/17/94/91/1325179491.db2.gz	LYAHVXGCLKADQB-WMZOPIPTSA-N	0	3	327.472	3.138	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)[C@@H]2CC23CCCC3)C1	ZINC001027155476	1325258716	/nfs/dbraw/zinc/25/87/16/1325258716.db2.gz	NNVNZUWIAOMWLG-LPHOPBHVSA-N	0	3	337.467	3.077	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)/C=C/c2ccco2)C1	ZINC001027275552	1325388648	/nfs/dbraw/zinc/38/86/48/1325388648.db2.gz	SJUARMYOQRKENC-VYENPZKTSA-N	0	3	349.434	3.287	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)C[C@H]2C=CCC2)C1	ZINC001027290122	1325422639	/nfs/dbraw/zinc/42/26/39/1325422639.db2.gz	PISZZDSLWUEYQX-FXAWDEMLSA-N	0	3	337.467	3.337	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)C[C@H]2C=CCC2)C1	ZINC001027290355	1325423836	/nfs/dbraw/zinc/42/38/36/1325423836.db2.gz	UFBODKLTNDGUPB-PXNSSMCTSA-N	0	3	337.467	3.337	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC[C@@H](N(C)Cc2ccc(OC)c(C#N)c2)C1	ZINC001027305174	1325450010	/nfs/dbraw/zinc/45/00/10/1325450010.db2.gz	JARPQSXDJHVVBC-CRAIPNDOSA-N	0	3	343.471	3.036	20	30		EGEDHN
CN(Cc1ccc(C#N)c(F)c1)[C@@H]1CCCN(C(=O)CCC2CC2)C1	ZINC001027339916	1325498828	/nfs/dbraw/zinc/49/88/28/1325498828.db2.gz	KDEOYDUOZQZTRJ-GOSISDBHSA-N	0	3	343.446	3.310	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)CC2CCC2)C1	ZINC001027352046	1325520487	/nfs/dbraw/zinc/52/04/87/1325520487.db2.gz	YJPWAQCTLFAFEX-IBGZPJMESA-N	0	3	325.456	3.171	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@H](N(C)CCOCCC(C)C)C1	ZINC001190355213	1367237739	/nfs/dbraw/zinc/23/77/39/1367237739.db2.gz	WDZJPCDTZYGOHO-INIZCTEOSA-N	0	3	344.927	3.361	20	30		EGEDHN
CC[C@@H](SC)C(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001027371381	1325565394	/nfs/dbraw/zinc/56/53/94/1325565394.db2.gz	ADNZZRYLHYGYRX-QZTJIDSGSA-N	0	3	345.512	3.123	20	30		EGEDHN
CCN(C(=O)OC(C)(C)C)[C@@H](C)C(=O)C(C#N)c1nc(C)cs1	ZINC000860449616	1329318742	/nfs/dbraw/zinc/31/87/42/1329318742.db2.gz	CLUQLAYRROHFJP-NWDGAFQWSA-N	0	3	337.445	3.273	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)C[C@H](C)c2ccco2)c1	ZINC000860468182	1329321205	/nfs/dbraw/zinc/32/12/05/1329321205.db2.gz	IPQWCZNDKYBLHD-SWLSCSKDSA-N	0	3	326.352	3.129	20	30		EGEDHN
CCO[C@@H](C(=O)C(C#N)C(=O)Nc1c(CC)cccc1CC)C1CC1	ZINC000860470126	1329321527	/nfs/dbraw/zinc/32/15/27/1329321527.db2.gz	NKEGYQNGUAOTBN-VQIMIIECSA-N	0	3	342.439	3.274	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)C(=O)NCc1cccc(Cl)c1)c1ccco1	ZINC000860692041	1329345044	/nfs/dbraw/zinc/34/50/44/1329345044.db2.gz	WZBOCXVXUKBBRS-SWLSCSKDSA-N	0	3	344.798	3.452	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)[C@H]1[C@@H](C)[C@@H](C)O[C@H]1C)c1ccccc1	ZINC000860695936	1329345308	/nfs/dbraw/zinc/34/53/08/1329345308.db2.gz	WVPQBBCRWNCCAW-PSTFYZFSSA-N	0	3	342.439	3.022	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)C2CC(C)(C)C2)C1	ZINC001027396270	1327614107	/nfs/dbraw/zinc/61/41/07/1327614107.db2.gz	VLLKPPYGVGJVRS-IBGZPJMESA-N	0	3	339.483	3.417	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)[C@H]2CCC2(C)C)C1	ZINC001027534655	1327825399	/nfs/dbraw/zinc/82/53/99/1327825399.db2.gz	BFKDULXKPGTXGC-RBUKOAKNSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)[C@H](F)c1ccccc1)C2	ZINC000965297010	1327974991	/nfs/dbraw/zinc/97/49/91/1327974991.db2.gz	TZACULNEUOUSDS-LMBQMVEXSA-N	0	3	336.838	3.467	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2cccc(C(F)F)c2F)C1	ZINC000966165362	1328213025	/nfs/dbraw/zinc/21/30/25/1328213025.db2.gz	FTPWNSWKJCLSMS-IUODEOHRSA-N	0	3	338.373	3.227	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2cccc(OCCC)c2)C1	ZINC000966393176	1328289595	/nfs/dbraw/zinc/28/95/95/1328289595.db2.gz	YGRIAZJXZOISBJ-LPHOPBHVSA-N	0	3	330.472	3.492	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cncc(-c3ccccc3)c2)C1	ZINC000966563463	1328342406	/nfs/dbraw/zinc/34/24/06/1328342406.db2.gz	LKWUEPRUSULSNE-UTKZUKDTSA-N	0	3	347.462	3.212	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1c(F)ccc2ccncc21	ZINC001027897472	1328362769	/nfs/dbraw/zinc/36/27/69/1328362769.db2.gz	OOKXGCTZJCTBDO-HNNXBMFYSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1cc(Cl)c(Cl)n1C	ZINC001027919415	1328396344	/nfs/dbraw/zinc/39/63/44/1328396344.db2.gz	YBEDJKNOMDIWKP-LLVKDONJSA-N	0	3	330.259	3.102	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H]1CNC(=O)c1scnc1C(F)(F)F	ZINC001027939608	1328417658	/nfs/dbraw/zinc/41/76/58/1328417658.db2.gz	USJMZHXWTYLTOW-LLVKDONJSA-N	0	3	347.406	3.322	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@H]2CCCN2CC=C(C)C)cc1	ZINC001027973963	1328449741	/nfs/dbraw/zinc/44/97/41/1328449741.db2.gz	CMTIFYLPODUQEW-GOSISDBHSA-N	0	3	328.456	3.412	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2ccc(-c3cc[nH]n3)s2)C1	ZINC000966884369	1328451172	/nfs/dbraw/zinc/45/11/72/1328451172.db2.gz	LDZLZNNZAIVDJT-DZGCQCFKSA-N	0	3	344.484	3.155	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1cc2c([nH]1)c(F)ccc2C	ZINC001027981272	1328454505	/nfs/dbraw/zinc/45/45/05/1328454505.db2.gz	KZXMFLVBSBNOIE-AWEZNQCLSA-N	0	3	329.419	3.386	20	30		EGEDHN
C=CCCN1CCC[C@H]1CNC(=O)c1sc(C)nc1CC(C)C	ZINC001028004301	1328466548	/nfs/dbraw/zinc/46/65/48/1328466548.db2.gz	XGCAOLDPDNXNRD-HNNXBMFYSA-N	0	3	335.517	3.420	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(-c3cnco3)cc2)C1	ZINC000966946281	1328489493	/nfs/dbraw/zinc/48/94/93/1328489493.db2.gz	WZJYTBNDFMJWMC-QAPCUYQASA-N	0	3	339.439	3.358	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H](c3ccccc3)C3CC3)C2)CC1	ZINC001050591007	1348295313	/nfs/dbraw/zinc/29/53/13/1348295313.db2.gz	RJOGJUDGJDDYGK-HXUWFJFHSA-N	0	3	336.479	3.128	20	30		EGEDHN
CC[C@@H](NC[C@H](O)c1ccc(C#N)cc1)c1cc(F)ccc1OC	ZINC000932474816	1329817363	/nfs/dbraw/zinc/81/73/63/1329817363.db2.gz	MGCBGHMTLNOMDK-MSOLQXFVSA-N	0	3	328.387	3.480	20	30		EGEDHN
C[C@H]1CN(Cc2cccc(C#N)c2)CC[C@H]1NC(=O)C1(C2CC2)CC1	ZINC000942161822	1331852901	/nfs/dbraw/zinc/85/29/01/1331852901.db2.gz	SVLUHFPWHOZGQV-HNAYVOBHSA-N	0	3	337.467	3.075	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3sccc3s2)[C@@H](C)C1	ZINC000942183743	1331866439	/nfs/dbraw/zinc/86/64/39/1331866439.db2.gz	LERFSKKCIGUNMJ-QWHCGFSZSA-N	0	3	332.494	3.426	20	30		EGEDHN
C[C@H]1CN(Cc2cccc(C#N)c2)CC[C@@H]1NC(=O)C1(F)CCCC1	ZINC000942195166	1331874315	/nfs/dbraw/zinc/87/43/15/1331874315.db2.gz	GSLHVMLEZFFAFL-YJBOKZPZSA-N	0	3	343.446	3.167	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)cc2)CC[C@@H]1NC(=O)C1(C)CCCC1	ZINC000942540066	1331964483	/nfs/dbraw/zinc/96/44/83/1331964483.db2.gz	GRHSBTFIAUOPEW-APWZRJJASA-N	0	3	339.483	3.465	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3ncccc3C)C[C@H]2C)cc1	ZINC000942552732	1331970364	/nfs/dbraw/zinc/97/03/64/1331970364.db2.gz	IKBCSJANHCECDX-XLIONFOSSA-N	0	3	347.462	3.012	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)c(C)cc2Cl)[C@H](C)C1	ZINC000942561938	1331975607	/nfs/dbraw/zinc/97/56/07/1331975607.db2.gz	DZJNLRNWRKEXTL-QAPCUYQASA-N	0	3	332.875	3.420	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2nsc3ccc(C)cc32)[C@H](C)C1	ZINC000942561931	1331975762	/nfs/dbraw/zinc/97/57/62/1331975762.db2.gz	DYFUJDMUBQIMJO-ZBFHGGJFSA-N	0	3	341.480	3.068	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(F)c(Cl)c2F)[C@@H](C)C1	ZINC000942602396	1331999479	/nfs/dbraw/zinc/99/94/79/1331999479.db2.gz	ILNGHNBITKDTJN-FZMZJTMJSA-N	0	3	340.801	3.082	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3ccc(C#N)cc3)C[C@@H]2C)C1	ZINC000942602841	1332000694	/nfs/dbraw/zinc/00/06/94/1332000694.db2.gz	OEWRYDJQQQHVKL-QFBILLFUSA-N	0	3	337.467	3.241	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)cc2)CC[C@H]1NC(=O)C1(C)CC=CC1	ZINC000942603172	1332001532	/nfs/dbraw/zinc/00/15/32/1332001532.db2.gz	TUOVJUXGNJCVIX-VQIMIIECSA-N	0	3	337.467	3.241	20	30		EGEDHN
C[C@@H]1CN(Cc2cccc(C#N)c2)CC[C@@H]1NC(=O)C1CC2(CC2)C1	ZINC000942698491	1332021586	/nfs/dbraw/zinc/02/15/86/1332021586.db2.gz	HRSIEKNZJJOVKE-BEFAXECRSA-N	0	3	337.467	3.075	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2cccc3sccc32)[C@@H](C)C1	ZINC000943335156	1332152254	/nfs/dbraw/zinc/15/22/54/1332152254.db2.gz	QGVOIXNNXWBCKY-MAUKXSAKSA-N	0	3	340.492	3.294	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccccc2OCC(C)C)[C@@H](C)C1	ZINC000943688631	1332238835	/nfs/dbraw/zinc/23/88/35/1332238835.db2.gz	FBDQFDRASBJEMS-HKUYNNGSSA-N	0	3	342.483	3.185	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ncoc2-c2cccs2)[C@H](C)C1	ZINC000943690741	1332239406	/nfs/dbraw/zinc/23/94/06/1332239406.db2.gz	VXFNOXUGESGAHC-CHWSQXEVSA-N	0	3	331.441	3.029	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnc3ccc(F)cc3c2)[C@@H](C)C1	ZINC000943985817	1332303411	/nfs/dbraw/zinc/30/34/11/1332303411.db2.gz	ALYFTGYZQAFBRX-SUMWQHHRSA-N	0	3	327.403	3.000	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnc(CC(C)(C)C)s2)[C@H](C)C1	ZINC000944033767	1332312194	/nfs/dbraw/zinc/31/21/94/1332312194.db2.gz	PLGABFMMFCRJFG-KGLIPLIRSA-N	0	3	335.517	3.358	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccccc2C(F)(F)F)[C@@H](C)C1	ZINC000944266211	1332358284	/nfs/dbraw/zinc/35/82/84/1332358284.db2.gz	XRGXWWCEDBFCGB-XJKSGUPXSA-N	0	3	338.373	3.169	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccccc2OCC2CC2)[C@@H](C)C1	ZINC000945094386	1332499242	/nfs/dbraw/zinc/49/92/42/1332499242.db2.gz	WTDUKYZMIZRXTO-YJBOKZPZSA-N	0	3	328.456	3.102	20	30		EGEDHN
CC(C)C(=O)N1CC[C@H]2CN(Cc3cc(C#N)ccc3F)C[C@H]2CC1	ZINC000946487078	1332841215	/nfs/dbraw/zinc/84/12/15/1332841215.db2.gz	DUFCSCORAJPKQD-CALCHBBNSA-N	0	3	343.446	3.024	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc(Cl)cn2)C12CCC2	ZINC001078786433	1357081884	/nfs/dbraw/zinc/08/18/84/1357081884.db2.gz	VQXDSFUILNYKOF-KBPBESRZSA-N	0	3	340.254	3.118	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccn(C3CCCCC3)n2)C[C@H]1C	ZINC000947314140	1333085090	/nfs/dbraw/zinc/08/50/90/1333085090.db2.gz	FNHSTRMPZYLBAZ-HZPDHXFCSA-N	0	3	330.476	3.157	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2c(C)nn(C(C)(C)C)c2C)C[C@H]1C	ZINC000947369189	1333106665	/nfs/dbraw/zinc/10/66/65/1333106665.db2.gz	HSJSFGBIIUDWAZ-CZUORRHYSA-N	0	3	332.492	3.024	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CCN(CCC(F)(F)F)[C@@H](C)C1	ZINC000947391117	1333113050	/nfs/dbraw/zinc/11/30/50/1333113050.db2.gz	GVLXYXJKGMZTHU-UONOGXRCSA-N	0	3	343.393	3.209	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2cccc(C(C)C)c2)C[C@@H]1C	ZINC000947498764	1333148114	/nfs/dbraw/zinc/14/81/14/1333148114.db2.gz	YQVIVUKTGVYYQL-FXAWDEMLSA-N	0	3	326.484	3.345	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(OC)c(C(C)C)c2)C[C@@H]1C	ZINC000947505820	1333149781	/nfs/dbraw/zinc/14/97/81/1333149781.db2.gz	FPVJLEJTVPVGAT-FUHWJXTLSA-N	0	3	342.483	3.425	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2cccc(C)c2Cl)C[C@@H]1C	ZINC000947540912	1333165122	/nfs/dbraw/zinc/16/51/22/1333165122.db2.gz	ZZTINACRSTXQLQ-DOTOQJQBSA-N	0	3	332.875	3.183	20	30		EGEDHN
Cc1cocc1C(=O)N[C@H]1CCN(Cc2ccc(C#N)cc2)[C@H](C)C1	ZINC000947625261	1333199148	/nfs/dbraw/zinc/19/91/48/1333199148.db2.gz	UKUHFBGXVJEDRI-QAPCUYQASA-N	0	3	337.423	3.243	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)[C@H]2C[C@H]3C[C@H]3C2)CCN1Cc1cccc(C#N)c1	ZINC000947639134	1333204346	/nfs/dbraw/zinc/20/43/46/1333204346.db2.gz	MOKVSVZJGQHWSE-NSYSGPAISA-N	0	3	337.467	3.073	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)C2CC3(CC3)C2)CCN1Cc1cccc(C#N)c1	ZINC000947702292	1333231863	/nfs/dbraw/zinc/23/18/63/1333231863.db2.gz	LYRHFUGEOOZABY-KXBFYZLASA-N	0	3	337.467	3.218	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2cccc3sccc32)C[C@@H]1C	ZINC000947780212	1333259882	/nfs/dbraw/zinc/25/98/82/1333259882.db2.gz	XVOYKLHWTZLZMA-HOCLYGCPSA-N	0	3	326.465	3.046	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2c[nH]c3cc(C)ccc23)C[C@H]1C	ZINC000947800229	1333265830	/nfs/dbraw/zinc/26/58/30/1333265830.db2.gz	GYIDYGCIZLDMLY-AEFFLSMTSA-N	0	3	337.467	3.011	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2csc(C(C)(C)C)n2)C[C@H]1C	ZINC000947810580	1333268173	/nfs/dbraw/zinc/26/81/73/1333268173.db2.gz	MLEXNQPROQIYOL-ZIAGYGMSSA-N	0	3	333.501	3.047	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)n(CC3CC3)c2C)C[C@H]1C	ZINC000947938733	1333313045	/nfs/dbraw/zinc/31/30/45/1333313045.db2.gz	ATYZTSSINKMWPR-BEFAXECRSA-N	0	3	341.499	3.121	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(N(CC)CC)cc2)C[C@@H]1C	ZINC000947966617	1333324106	/nfs/dbraw/zinc/32/41/06/1333324106.db2.gz	DSQVXALXXSFYGN-PKOBYXMFSA-N	0	3	341.499	3.139	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2coc3ccc(F)cc23)C[C@H]1C	ZINC000947975423	1333329605	/nfs/dbraw/zinc/32/96/05/1333329605.db2.gz	NJUKOYCLHGAEQX-HIFRSBDPSA-N	0	3	328.387	3.178	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](NC(=O)c2ccccc2CN(C)C)C[C@H]1C	ZINC000948070345	1333364289	/nfs/dbraw/zinc/36/42/89/1333364289.db2.gz	OOVORDGVTXTZNQ-NVXWUHKLSA-N	0	3	349.906	3.083	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C(C)(C)c2ccccc2C)C[C@@H]1C	ZINC000948089301	1333371859	/nfs/dbraw/zinc/37/18/59/1333371859.db2.gz	BVWPTJKZKACDDD-ROUUACIJSA-N	0	3	326.484	3.265	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)C[C@H]2CCC(F)(F)C2)CC1	ZINC000948424081	1333520011	/nfs/dbraw/zinc/52/00/11/1333520011.db2.gz	GFZWUSNUFMDZGO-HZPDHXFCSA-N	0	3	326.431	3.148	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2ccc3cc(C)cn3c2)CC1	ZINC000948431654	1333521682	/nfs/dbraw/zinc/52/16/82/1333521682.db2.gz	BPKGDIFXWSDBQK-LJQANCHMSA-N	0	3	337.467	3.198	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2cc(C)n(C(CC)CC)n2)CC1	ZINC000948571015	1333581727	/nfs/dbraw/zinc/58/17/27/1333581727.db2.gz	XHOUKAWSFHJKQE-SFHVURJKSA-N	0	3	344.503	3.112	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2csc(C(F)(F)F)c2)CC1	ZINC000948586604	1333585793	/nfs/dbraw/zinc/58/57/93/1333585793.db2.gz	KFCVDCNXDIVOCW-ZDUSSCGKSA-N	0	3	344.402	3.327	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)Cc2cc(F)c(C)cc2F)CC1	ZINC000948642469	1333608558	/nfs/dbraw/zinc/60/85/58/1333608558.db2.gz	IICHDKUFGIJSNS-KRWDZBQOSA-N	0	3	348.437	3.152	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2cc3c(cc(C)cc3C)[nH]2)CC1	ZINC000948655898	1333614894	/nfs/dbraw/zinc/61/48/94/1333614894.db2.gz	OUSWJTZEVXLJMT-KRWDZBQOSA-N	0	3	337.467	3.344	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cc3cc(F)ccc3[nH]2)CC1	ZINC000948665061	1333620007	/nfs/dbraw/zinc/62/00/07/1333620007.db2.gz	GCLQMMXJFRXQRC-QGZVFWFLSA-N	0	3	341.430	3.257	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2ccc(Cl)cc2OC)CC1	ZINC000948721922	1333646037	/nfs/dbraw/zinc/64/60/37/1333646037.db2.gz	BBOOXYZBUQEMOZ-INIZCTEOSA-N	0	3	348.874	3.298	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2ccccc2-n2cccc2)CC1	ZINC000948743406	1333655526	/nfs/dbraw/zinc/65/55/26/1333655526.db2.gz	TVXGVHKKQNEPIO-IBGZPJMESA-N	0	3	349.478	3.427	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2cc3cc(F)ccc3o2)CC1	ZINC000948816725	1333696077	/nfs/dbraw/zinc/69/60/77/1333696077.db2.gz	MIJWXEDGWXYQSD-MRXNPFEDSA-N	0	3	328.387	3.132	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)Cc2ccc(Cl)s2)CC1	ZINC000948833112	1333703066	/nfs/dbraw/zinc/70/30/66/1333703066.db2.gz	JGZLNACYRZIXSY-CQSZACIVSA-N	0	3	338.904	3.280	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2ccc3nc(C)ccc3c2)CC1	ZINC000948877811	1333717266	/nfs/dbraw/zinc/71/72/66/1333717266.db2.gz	RPCVPTWYCHPRGM-IBGZPJMESA-N	0	3	335.451	3.103	20	30		EGEDHN
CCCCN1CCc2ccccc2[C@@H]1CNC(=O)c1ccc(C#N)[nH]1	ZINC000948909851	1333729645	/nfs/dbraw/zinc/72/96/45/1333729645.db2.gz	CTIUVDPXXJRSID-IBGZPJMESA-N	0	3	336.439	3.016	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@H]1CNC(=O)[C@H]1CCCCO1	ZINC000948909950	1333729944	/nfs/dbraw/zinc/72/99/44/1333729944.db2.gz	FBDVMQCBARRYQU-WOJBJXKFSA-N	0	3	342.483	3.237	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@@H]1c2ccccc2CCN1CCC	ZINC000948923611	1333736074	/nfs/dbraw/zinc/73/60/74/1333736074.db2.gz	NJXZKDLMSBKZKG-HXUWFJFHSA-N	0	3	337.467	3.413	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@H]1CNC(=O)[C@H]1OCC[C@H]1C	ZINC000948961014	1333748508	/nfs/dbraw/zinc/74/85/08/1333748508.db2.gz	HLGQDBAPXWZHAT-AHRSYUTCSA-N	0	3	342.483	3.093	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2c3ccccc3CCN2CC(C)C)nc1	ZINC000948978050	1333754367	/nfs/dbraw/zinc/75/43/67/1333754367.db2.gz	HFBXMXCTBBPNSS-OAQYLSRUSA-N	0	3	347.462	3.048	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H]1CCCC[C@@H]1C1CC1)CCO2	ZINC000949141449	1333783925	/nfs/dbraw/zinc/78/39/25/1333783925.db2.gz	CBSGGKWBQCOMAQ-RTBURBONSA-N	0	3	346.515	3.082	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1cc(Cl)ccc1C)CCO2	ZINC000949212577	1333796085	/nfs/dbraw/zinc/79/60/85/1333796085.db2.gz	CLBIHSKNNKVVAA-UHFFFAOYSA-N	0	3	348.874	3.141	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)CC3CCCC3)CC2)C1	ZINC000949285629	1333815095	/nfs/dbraw/zinc/81/50/95/1333815095.db2.gz	OIHRDBZFSUNOML-UHFFFAOYSA-N	0	3	334.504	3.226	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@@H]3CCC[C@@H]3CCC)CC2)C1	ZINC000949402269	1333838276	/nfs/dbraw/zinc/83/82/76/1333838276.db2.gz	XAGBQBCRAUMBLL-RBUKOAKNSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3cc(F)ccc3C)CC2)C1	ZINC000949430118	1333845323	/nfs/dbraw/zinc/84/53/23/1333845323.db2.gz	NOPDGOFELUJRFC-UHFFFAOYSA-N	0	3	346.446	3.017	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3ccc(CF)cc3)CC2)C1	ZINC000949531621	1333869230	/nfs/dbraw/zinc/86/92/30/1333869230.db2.gz	MURDEZGEEHPMON-UHFFFAOYSA-N	0	3	346.446	3.039	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cc(C)nn2C(CC)CC)C1	ZINC000967091276	1335660352	/nfs/dbraw/zinc/66/03/52/1335660352.db2.gz	UXCOJQGHIGDNGD-QAPCUYQASA-N	0	3	344.503	3.016	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)Cc2ccc(Cl)c(F)c2)C1	ZINC000968354276	1335899542	/nfs/dbraw/zinc/89/95/42/1335899542.db2.gz	PPUAUTCPLYCOKF-GUYCJALGSA-N	0	3	338.854	3.424	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)Cc2cccc3sccc32)C1	ZINC000968396258	1335918861	/nfs/dbraw/zinc/91/88/61/1335918861.db2.gz	ZTFFDTIDCLPGMG-QAPCUYQASA-N	0	3	340.492	3.294	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2cccc3c2ccn3C)C1	ZINC000968423637	1335925661	/nfs/dbraw/zinc/92/56/61/1335925661.db2.gz	VCTSRWPYRWFKSY-MAUKXSAKSA-N	0	3	325.456	3.195	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccccc2C(F)(F)F)C1	ZINC000968571269	1335965280	/nfs/dbraw/zinc/96/52/80/1335965280.db2.gz	XRKCJIDQYAMWLC-BBRMVZONSA-N	0	3	338.373	3.169	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)Cc2ccc3c(c2)CCC3)C1	ZINC000968631016	1335990087	/nfs/dbraw/zinc/99/00/87/1335990087.db2.gz	FCZFKBHXLFWLRD-UZLBHIALSA-N	0	3	326.484	3.121	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)Cc2nsc3ccccc32)C1	ZINC000968668149	1336002901	/nfs/dbraw/zinc/00/29/01/1336002901.db2.gz	AEADTNMBGUGZEE-PBHICJAKSA-N	0	3	343.496	3.242	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)CC2C3CC4CC(C3)CC2C4)C1	ZINC000968668410	1336003048	/nfs/dbraw/zinc/00/30/48/1336003048.db2.gz	BWZIYBWZXSMKPA-KBDFJOJTSA-N	0	3	342.527	3.299	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(C(C)(F)F)cc2)C1	ZINC000968710643	1336019653	/nfs/dbraw/zinc/01/96/53/1336019653.db2.gz	RWAROMGJJNGYGA-PBHICJAKSA-N	0	3	334.410	3.262	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC000968795610	1336054058	/nfs/dbraw/zinc/05/40/58/1336054058.db2.gz	UIAYPQZEWVPAAC-OAHLLOKOSA-N	0	3	349.837	3.167	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1sccc1CN(C)C	ZINC000968877314	1336077136	/nfs/dbraw/zinc/07/71/36/1336077136.db2.gz	TURWJYIIPHJVBM-QGZVFWFLSA-N	0	3	349.544	3.360	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccccc1-c1cn[nH]c1	ZINC000968882707	1336078925	/nfs/dbraw/zinc/07/89/25/1336078925.db2.gz	SMIJOMNUXOEWGB-QGZVFWFLSA-N	0	3	338.455	3.237	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccc2nc(C)oc2c1	ZINC000968896445	1336083762	/nfs/dbraw/zinc/08/37/62/1336083762.db2.gz	QOINCHGZLXZMOZ-MRXNPFEDSA-N	0	3	327.428	3.297	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cnoc1-c1ccco1	ZINC000968916694	1336088369	/nfs/dbraw/zinc/08/83/69/1336088369.db2.gz	GUCIOHRYORMLDA-CQSZACIVSA-N	0	3	329.400	3.095	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccc(C(F)(F)F)nc1	ZINC000968971452	1336105276	/nfs/dbraw/zinc/10/52/76/1336105276.db2.gz	LJTZBUUSXYHLQL-AWEZNQCLSA-N	0	3	341.377	3.261	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1c(F)ccc(F)c1OC	ZINC000968980015	1336108299	/nfs/dbraw/zinc/10/82/99/1336108299.db2.gz	OPRQTHNMWOWAIT-CYBMUJFWSA-N	0	3	338.398	3.134	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1ccc2c(c1)[C@H](C)CO2	ZINC000968998528	1336114913	/nfs/dbraw/zinc/11/49/13/1336114913.db2.gz	YRWNUQLQDYIGRC-AEFFLSMTSA-N	0	3	340.467	3.180	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1ccc2c(c1)[C@H](C)CO2	ZINC000968998530	1336114954	/nfs/dbraw/zinc/11/49/54/1336114954.db2.gz	YRWNUQLQDYIGRC-SJLPKXTDSA-N	0	3	340.467	3.180	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)[C@@H]1CCc2cccc(OC)c21	ZINC000969062172	1336134233	/nfs/dbraw/zinc/13/42/33/1336134233.db2.gz	KWEJMILDFNHEQE-QZTJIDSGSA-N	0	3	342.483	3.272	20	30		EGEDHN
C#CCCN1CCCCC[C@@H]1CNC(=O)c1cc([C@@H](C)CC)no1	ZINC000969061576	1336134279	/nfs/dbraw/zinc/13/42/79/1336134279.db2.gz	BYRGLXBFQHZDKJ-JKSUJKDBSA-N	0	3	331.460	3.186	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1ccc(C)nc1OCC	ZINC000969090892	1336139548	/nfs/dbraw/zinc/13/95/48/1336139548.db2.gz	ORVGGZHJTMDHCS-QGZVFWFLSA-N	0	3	345.487	3.339	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1ccc2ccn(C)c2c1	ZINC000969103255	1336144928	/nfs/dbraw/zinc/14/49/28/1336144928.db2.gz	KBECERTZHZYXSW-IBGZPJMESA-N	0	3	337.467	3.176	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1oc(CCC)nc1C	ZINC000969111563	1336147889	/nfs/dbraw/zinc/14/78/89/1336147889.db2.gz	REXZGHDJCDZWOK-MRXNPFEDSA-N	0	3	333.476	3.486	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccc(OC)c(OCC)c1	ZINC000969138992	1336157667	/nfs/dbraw/zinc/15/76/67/1336157667.db2.gz	GHDSIYXKOVEVJW-QGZVFWFLSA-N	0	3	346.471	3.254	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)C12CC(C(F)(F)F)(C1)C2	ZINC000969156149	1336164992	/nfs/dbraw/zinc/16/49/92/1336164992.db2.gz	LCLRQBGJXAEVPD-JEYLPNPQSA-N	0	3	330.394	3.266	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1cccc2oc(C)nc21	ZINC000969158182	1336166839	/nfs/dbraw/zinc/16/68/39/1336166839.db2.gz	DJPNSPSXDBKMEA-MRXNPFEDSA-N	0	3	339.439	3.134	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@@H](NCc3ccc(C#N)s3)C2)c(C)s1	ZINC000969232254	1336183129	/nfs/dbraw/zinc/18/31/29/1336183129.db2.gz	DNNORCBTSWDVJI-CYBMUJFWSA-N	0	3	345.493	3.302	20	30		EGEDHN
Cc1oc(C)c(C(=O)N2CC[C@@H](NCc3ccc(C#N)s3)C2)c1C	ZINC000969257397	1336188379	/nfs/dbraw/zinc/18/83/79/1336188379.db2.gz	DBAYOOHDPJODFS-CQSZACIVSA-N	0	3	343.452	3.142	20	30		EGEDHN
CC1(C)CC(CC(=O)N2CC[C@@H](NCc3ccc(C#N)s3)C2)C1	ZINC000969687872	1336236985	/nfs/dbraw/zinc/23/69/85/1336236985.db2.gz	UORHEIKMNSCSKS-CQSZACIVSA-N	0	3	331.485	3.137	20	30		EGEDHN
C#CCCN1CC([C@H](C)NC(=O)c2cc(Cl)sc2Cl)C1	ZINC000969843443	1336253146	/nfs/dbraw/zinc/25/31/46/1336253146.db2.gz	AOCJCADBSRVUOA-VIFPVBQESA-N	0	3	331.268	3.128	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)[C@@H]2C[C@H]2c2c(F)cccc2F)C1	ZINC000970389213	1336302465	/nfs/dbraw/zinc/30/24/65/1336302465.db2.gz	DHMWCFGZBRLSOM-BPLDGKMQSA-N	0	3	334.410	3.081	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)c2ccc(C(C)C)nc2CC)C1	ZINC000970431507	1336308028	/nfs/dbraw/zinc/30/80/28/1336308028.db2.gz	NZYMKBNVVZYAFS-HNNXBMFYSA-N	0	3	329.488	3.394	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)[C@@H]2CCC[C@@H](C(F)(F)F)C2)CC1	ZINC001005637995	1336386813	/nfs/dbraw/zinc/38/68/13/1336386813.db2.gz	JSCXHBQFPKLHNK-ZIAGYGMSSA-N	0	3	332.410	3.464	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cnc3c(F)cccc3c2)CC1	ZINC001005719660	1336397117	/nfs/dbraw/zinc/39/71/17/1336397117.db2.gz	UEMSIZGWXZVVTR-UHFFFAOYSA-N	0	3	327.403	3.096	20	30		EGEDHN
CN(C(=O)[C@]1(C)C=CCC1)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001005842270	1336407704	/nfs/dbraw/zinc/40/77/04/1336407704.db2.gz	UVQOLVPPDSTYCG-OAQYLSRUSA-N	0	3	337.467	3.337	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccnc(C(F)(F)F)c2)CC1	ZINC001006241592	1336474695	/nfs/dbraw/zinc/47/46/95/1336474695.db2.gz	OUZYIQJKLRWXHR-UHFFFAOYSA-N	0	3	341.377	3.213	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2ccsc2C(F)(F)F)CC1	ZINC001006348195	1336493148	/nfs/dbraw/zinc/49/31/48/1336493148.db2.gz	OJWXSMHUEADTCQ-UHFFFAOYSA-N	0	3	332.391	3.489	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H](NC(=O)c2conc2C2CCCC2)C1	ZINC001007484309	1336656179	/nfs/dbraw/zinc/65/61/79/1336656179.db2.gz	RHAKAEVCQZULNB-MRXNPFEDSA-N	0	3	331.460	3.493	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CCCN(CC2=CCCCC2)C1	ZINC001007501688	1336659227	/nfs/dbraw/zinc/65/92/27/1336659227.db2.gz	CFEJVMHWUHZGAW-SFHVURJKSA-N	0	3	327.472	3.369	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2cnc(-c3ccccc3)o2)C1	ZINC001007553451	1336667502	/nfs/dbraw/zinc/66/75/02/1336667502.db2.gz	MYCRNQXIYWBEOF-INIZCTEOSA-N	0	3	325.412	3.112	20	30		EGEDHN
C#CCCN1CCC[C@H](NC(=O)Cc2ccc(CC(C)C)cc2)C1	ZINC001007845060	1336715778	/nfs/dbraw/zinc/71/57/78/1336715778.db2.gz	NLUPKHVYYQCWNX-FQEVSTJZSA-N	0	3	326.484	3.032	20	30		EGEDHN
C=C(C)CCN1CCC[C@H](NC(=O)c2oc(CC(C)C)nc2C)C1	ZINC001008791979	1336926151	/nfs/dbraw/zinc/92/61/51/1336926151.db2.gz	CQFSVYQLXFTURN-INIZCTEOSA-N	0	3	333.476	3.342	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2cnn(CCC(C)C)c2C)C1	ZINC001009124717	1336973366	/nfs/dbraw/zinc/97/33/66/1336973366.db2.gz	REJASJSSCNXZLX-KRWDZBQOSA-N	0	3	332.492	3.008	20	30		EGEDHN
C=C(C)CCN1CCC[C@H](NC(=O)c2ccc(Br)o2)C1	ZINC001009314608	1337004881	/nfs/dbraw/zinc/00/48/81/1337004881.db2.gz	VPLSELXLLUYNOJ-LBPRGKRZSA-N	0	3	341.249	3.203	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)Cc2c(C)oc3ccccc32)C1	ZINC001009783632	1337075121	/nfs/dbraw/zinc/07/51/21/1337075121.db2.gz	ANZKYDWEHFFDRO-MRXNPFEDSA-N	0	3	326.440	3.440	20	30		EGEDHN
CC(C)c1ccccc1CN1CC[C@@H](NC(=O)c2ccc(C#N)[nH]2)C1	ZINC001010653991	1337236022	/nfs/dbraw/zinc/23/60/22/1337236022.db2.gz	DXWWYDSNJFSGEF-QGZVFWFLSA-N	0	3	336.439	3.014	20	30		EGEDHN
N#Cc1ccc(C(=O)N[C@H]2CCN(Cc3ccc4ccccc4c3)C2)[nH]1	ZINC001010657962	1337236804	/nfs/dbraw/zinc/23/68/04/1337236804.db2.gz	PZDJNDRVHOXXDG-IBGZPJMESA-N	0	3	344.418	3.044	20	30		EGEDHN
N#Cc1ccc(C(=O)N[C@@H]2CCN(Cc3ccc4ccccc4c3)C2)[nH]1	ZINC001010657972	1337236955	/nfs/dbraw/zinc/23/69/55/1337236955.db2.gz	PZDJNDRVHOXXDG-LJQANCHMSA-N	0	3	344.418	3.044	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CCN(Cc2ccccc2CC)C1	ZINC001014725443	1337886442	/nfs/dbraw/zinc/88/64/42/1337886442.db2.gz	NTZGGUWVVBWMBU-IBGZPJMESA-N	0	3	337.467	3.241	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(CCCc3ccccc3OC)C2)C1	ZINC001015676003	1338252773	/nfs/dbraw/zinc/25/27/73/1338252773.db2.gz	HBYHANRLRRPAFJ-SFHVURJKSA-N	0	3	342.483	3.175	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CCN(Cc3ccccc3C(C)C)C2)c1	ZINC001015679207	1338254799	/nfs/dbraw/zinc/25/47/99/1338254799.db2.gz	VQLXOOOYNSSLAS-FQEVSTJZSA-N	0	3	347.462	3.191	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CCN([C@@H](CC)c3ccccc3)C2)c1	ZINC001015679955	1338255594	/nfs/dbraw/zinc/25/55/94/1338255594.db2.gz	QRAXFTRMCCBXSL-PMACEKPBSA-N	0	3	333.435	3.018	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2ccccc2CC(C)(C)C)CC1	ZINC001016680754	1338688188	/nfs/dbraw/zinc/68/81/88/1338688188.db2.gz	FBHHICKQGVLIMQ-LJQANCHMSA-N	0	3	338.495	3.493	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2cc3ccccc3cc2F)CC1	ZINC001016726517	1338704272	/nfs/dbraw/zinc/70/42/72/1338704272.db2.gz	NOHJWDCMVWDIQZ-IBGZPJMESA-N	0	3	336.410	3.196	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)Cc2c(C)cc(C)cc2C)CC1	ZINC001016805898	1338732074	/nfs/dbraw/zinc/73/20/74/1338732074.db2.gz	DCWXHWGHLAJROV-FQEVSTJZSA-N	0	3	338.495	3.148	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)C[C@H]2CCc3ccccc32)CC1	ZINC001016886647	1338759134	/nfs/dbraw/zinc/75/91/34/1338759134.db2.gz	SYIUMMRFQPANJQ-QUCCMNQESA-N	0	3	336.479	3.101	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2sccc2C(F)F)CC1	ZINC001016952747	1338782555	/nfs/dbraw/zinc/78/25/55/1338782555.db2.gz	XRXIHKRVJLKFPH-CYBMUJFWSA-N	0	3	338.423	3.293	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCCN(C(=O)C2CC=CC2)C1	ZINC001017083622	1338853113	/nfs/dbraw/zinc/85/31/13/1338853113.db2.gz	FIEXDTXTMAYAEV-OAHLLOKOSA-N	0	3	343.496	3.256	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](CN(C)Cc2cncc(C)c2)C1	ZINC001017179814	1338923899	/nfs/dbraw/zinc/92/38/99/1338923899.db2.gz	PMIYBTKCRKOEDB-KRWDZBQOSA-N	0	3	329.488	3.273	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@H](CN(C)Cc3ccccn3)C2)CC1	ZINC001017196073	1338941738	/nfs/dbraw/zinc/94/17/38/1338941738.db2.gz	DOOIOFNHAGWUEY-GOSISDBHSA-N	0	3	341.499	3.498	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@@H](CN(C)Cc3cnoc3C)C2)CC1	ZINC001017197004	1338942790	/nfs/dbraw/zinc/94/27/90/1338942790.db2.gz	LZUNHFXMWWNNLW-KRWDZBQOSA-N	0	3	345.487	3.400	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H](CN(C)Cc2cncc(F)c2)C1	ZINC001017201518	1338945897	/nfs/dbraw/zinc/94/58/97/1338945897.db2.gz	JZFBUAUOQMKMDP-OXJNMPFZSA-N	0	3	347.478	3.493	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H](CN(C)Cc2ccc(F)cn2)C1	ZINC001017202290	1338947279	/nfs/dbraw/zinc/94/72/79/1338947279.db2.gz	RZHCKYBRBFBZMH-UZLBHIALSA-N	0	3	347.478	3.493	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccc(C)c1Cl	ZINC001017730650	1339406190	/nfs/dbraw/zinc/40/61/90/1339406190.db2.gz	RKZBMMIDQDWLDT-CALCHBBNSA-N	0	3	332.875	3.442	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cc2ccsc2[nH]1	ZINC001017782816	1339419779	/nfs/dbraw/zinc/41/97/79/1339419779.db2.gz	NEDMUCRDTGXGBP-GASCZTMLSA-N	0	3	329.469	3.484	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](c1ccncc1)C(C)C	ZINC001017849174	1339430117	/nfs/dbraw/zinc/43/01/17/1339430117.db2.gz	GLUPZCCDYWTDQG-ZCNNSNEGSA-N	0	3	341.499	3.463	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](c1cccnc1)C(C)C	ZINC001018100117	1339501556	/nfs/dbraw/zinc/50/15/56/1339501556.db2.gz	XQGSHFCIRLJSOE-HSALFYBXSA-N	0	3	341.499	3.463	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(C)cc1OC	ZINC001018194891	1339527615	/nfs/dbraw/zinc/52/76/15/1339527615.db2.gz	FSMLTNFCSJXNCL-CALCHBBNSA-N	0	3	328.456	3.259	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)Oc1ccccc1	ZINC001018236379	1339543514	/nfs/dbraw/zinc/54/35/14/1339543514.db2.gz	HJKZGUCJQVJKLL-OKZBNKHCSA-N	0	3	328.456	3.095	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@H](C)c1cccc(OC)c1	ZINC001018327846	1339579195	/nfs/dbraw/zinc/57/91/95/1339579195.db2.gz	YWYVJSSBTDPEGW-YTQUADARSA-N	0	3	342.483	3.440	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@H](NCc2ccccc2N(C)C)C1	ZINC001018910059	1339750628	/nfs/dbraw/zinc/75/06/28/1339750628.db2.gz	JTERAWRUEIBPGU-INIZCTEOSA-N	0	3	349.906	3.222	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CCCN2Cc2ccc(CO)cc2)CC1	ZINC001028118019	1340438891	/nfs/dbraw/zinc/43/88/91/1340438891.db2.gz	VMKXZXSNDIRVEX-FQEVSTJZSA-N	0	3	342.483	3.006	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@H]2CCCN2Cc2ccc(CC)cc2)c1	ZINC001028130107	1340447780	/nfs/dbraw/zinc/44/77/80/1340447780.db2.gz	YFKNZPSHUVYKKQ-OAQYLSRUSA-N	0	3	347.462	3.020	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1cnoc1-c1ccccc1	ZINC001028235817	1340497557	/nfs/dbraw/zinc/49/75/57/1340497557.db2.gz	DXWJQVKIGKNWJL-MRXNPFEDSA-N	0	3	325.412	3.112	20	30		EGEDHN
Cc1cccc(C(=O)NC[C@H]2CCN(Cc3ccc(C#N)cc3)C2)c1	ZINC001028387248	1340614485	/nfs/dbraw/zinc/61/44/85/1340614485.db2.gz	XQWBHCVUOCRUTB-LJQANCHMSA-N	0	3	333.435	3.119	20	30		EGEDHN
Cc1cscc1C(=O)NC[C@@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC001028469039	1340657723	/nfs/dbraw/zinc/65/77/23/1340657723.db2.gz	IZTCZGSRGAPCMN-KRWDZBQOSA-N	0	3	339.464	3.180	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@@H]2CCN(C[C@H](F)CC)C2)cc1	ZINC001028637270	1340738330	/nfs/dbraw/zinc/73/83/30/1340738330.db2.gz	PFIXPSQMRLVDGF-DOTOQJQBSA-N	0	3	334.435	3.051	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@H]2CCN(C[C@H](F)CC)C2)cc1	ZINC001028637271	1340738377	/nfs/dbraw/zinc/73/83/77/1340738377.db2.gz	PFIXPSQMRLVDGF-NVXWUHKLSA-N	0	3	334.435	3.051	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)c2ccc(-c3ccco3)s2)C1	ZINC001028901414	1340878972	/nfs/dbraw/zinc/87/89/72/1340878972.db2.gz	BVQALLVZLDEHHU-CQSZACIVSA-N	0	3	328.437	3.083	20	30		EGEDHN
Cc1cc(C)cc(C(=O)NC[C@H]2CCN(Cc3ccc(C#N)cc3)C2)c1	ZINC001028954343	1340893238	/nfs/dbraw/zinc/89/32/38/1340893238.db2.gz	XSTVYMXIJLFWES-HXUWFJFHSA-N	0	3	347.462	3.427	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)N1CCC([C@H](C)NCc2ccccc2C#N)CC1	ZINC001029132017	1340938833	/nfs/dbraw/zinc/93/88/33/1340938833.db2.gz	YXXGXUZZCMAZLZ-HNAYVOBHSA-N	0	3	345.462	3.269	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC([C@@H](C)NCc2cc(OC)no2)CC1	ZINC001029139564	1340940445	/nfs/dbraw/zinc/94/04/45/1340940445.db2.gz	GGYVYNFLKNVMIK-AUUYWEPGSA-N	0	3	349.475	3.002	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CC[C@@H](C1)N2C[C@H](OC)C1CCC1	ZINC001029420314	1340986351	/nfs/dbraw/zinc/98/63/51/1340986351.db2.gz	XAAWVWUIRCGXJI-KSZLIROESA-N	0	3	334.504	3.079	20	30		EGEDHN
Cc1ccc(CN(C)C[C@@H]2CCN(C(=O)[C@H](C)C#N)C2)c(Cl)c1	ZINC001029677043	1341040474	/nfs/dbraw/zinc/04/04/74/1341040474.db2.gz	IGKYHVUSNZLFOF-CABCVRRESA-N	0	3	333.863	3.088	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](CN(C)Cc2ccc(F)cn2)C1	ZINC001029798372	1341076703	/nfs/dbraw/zinc/07/67/03/1341076703.db2.gz	JQXZWBNPPTVRCO-OAHLLOKOSA-N	0	3	333.451	3.103	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](CN(C)Cc2cn(C(C)C)nc2C)C1	ZINC001029803111	1341078181	/nfs/dbraw/zinc/07/81/81/1341078181.db2.gz	JBJVILKDSRHBHU-KRWDZBQOSA-N	0	3	346.519	3.265	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCN(C(=O)C2(C)CC=CC2)C1	ZINC001029828200	1341088455	/nfs/dbraw/zinc/08/84/55/1341088455.db2.gz	VYTKLZNBZGGKRI-OAHLLOKOSA-N	0	3	343.496	3.256	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N1CC[C@@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001029834713	1341091641	/nfs/dbraw/zinc/09/16/41/1341091641.db2.gz	YDIFONLGKGJZGE-HDMKZQKVSA-N	0	3	345.512	3.336	20	30		EGEDHN
C[C@H](CC(=O)N1CC[C@@H](CN(C)Cc2ccc(C#N)s2)C1)C1CC1	ZINC001029911876	1341114598	/nfs/dbraw/zinc/11/45/98/1341114598.db2.gz	SOIYLZSUZXCPHJ-CABCVRRESA-N	0	3	345.512	3.336	20	30		EGEDHN
CC[C@H](F)C(=O)N1CCC(CN(C)Cc2ccc(C#N)cc2F)CC1	ZINC001029984399	1341144012	/nfs/dbraw/zinc/14/40/12/1341144012.db2.gz	GMKQOEOWGQBDCU-KRWDZBQOSA-N	0	3	349.425	3.116	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ncoc1-c1ccccc1	ZINC001032433886	1341511502	/nfs/dbraw/zinc/51/15/02/1341511502.db2.gz	UIKWSRCVCYHSCE-IRXDYDNUSA-N	0	3	337.423	3.207	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(-c2cnco2)cc1	ZINC001032478974	1341519913	/nfs/dbraw/zinc/51/99/13/1341519913.db2.gz	XGQPWPUMQIFJPQ-ROUUACIJSA-N	0	3	337.423	3.207	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)COc1ccc(C(C)C)cc1	ZINC001032503842	1341524803	/nfs/dbraw/zinc/52/48/03/1341524803.db2.gz	UBGPOSHAKDIDGT-ROUUACIJSA-N	0	3	328.456	3.050	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(Cl)cc1OC	ZINC001032592640	1341550866	/nfs/dbraw/zinc/55/08/66/1341550866.db2.gz	IUNISVFIRUKZFG-GJZGRUSLSA-N	0	3	334.847	3.214	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1ccc(F)cc1Cl	ZINC001032604904	1341555869	/nfs/dbraw/zinc/55/58/69/1341555869.db2.gz	XTFIEBXFMFXWLD-HOTGVXAUSA-N	0	3	336.838	3.273	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1c[nH]nc1-c1ccsc1	ZINC001032704867	1341585582	/nfs/dbraw/zinc/58/55/82/1341585582.db2.gz	ABJIFXHSBRMPMU-GJZGRUSLSA-N	0	3	342.468	3.003	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)COc1c(C)cc(C)cc1C	ZINC001032767537	1341608569	/nfs/dbraw/zinc/60/85/69/1341608569.db2.gz	YKFORDQRUHMBAV-OALUTQOASA-N	0	3	342.483	3.242	20	30		EGEDHN
CN(C(=O)c1c[nH]c(C#N)c1)[C@H]1CCN(Cc2ccccc2C2CC2)C1	ZINC001033024358	1341699678	/nfs/dbraw/zinc/69/96/78/1341699678.db2.gz	WPQMKYMUTGGUIS-IBGZPJMESA-N	0	3	348.450	3.110	20	30		EGEDHN
C=CCCN1CC[C@@H](N(C)C(=O)c2cnc(-c3ccccc3)o2)C1	ZINC001033166170	1341743328	/nfs/dbraw/zinc/74/33/28/1341743328.db2.gz	RNBTYVYLAARCTR-MRXNPFEDSA-N	0	3	325.412	3.064	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](N(C)C(=O)c2cc3ncccc3s2)C1	ZINC001033319791	1341779887	/nfs/dbraw/zinc/77/98/87/1341779887.db2.gz	BUSOKSBOSRUWDU-CQSZACIVSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@H]2CCN(CC[C@@H]3CC3(Cl)Cl)C2)C1	ZINC001033400789	1341814392	/nfs/dbraw/zinc/81/43/92/1341814392.db2.gz	XJXBTKOVZLVXSG-KGLIPLIRSA-N	0	3	345.314	3.459	20	30		EGEDHN
C#CCCN1CC[C@@H](N(C)C(=O)c2ccc(Cl)c(CCC)c2)C1	ZINC001033580814	1341881753	/nfs/dbraw/zinc/88/17/53/1341881753.db2.gz	GMMKSUAMSLDXQP-QGZVFWFLSA-N	0	3	332.875	3.462	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](N(CC)C(=O)c2cn3cc(C)nc3s2)C1	ZINC001033856424	1342046936	/nfs/dbraw/zinc/04/69/36/1342046936.db2.gz	SKDINUIMAPLRDE-OAHLLOKOSA-N	0	3	346.500	3.207	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cccc([C@@H]3CCOC3)c2)C1	ZINC001033875261	1342053970	/nfs/dbraw/zinc/05/39/70/1342053970.db2.gz	DALPIYZZRKSPGC-UXHICEINSA-N	0	3	342.483	3.303	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2ccc3cc(C)ccc3n2)C1	ZINC001033891647	1342065196	/nfs/dbraw/zinc/06/51/96/1342065196.db2.gz	DYCHNLICWQICCG-GOSISDBHSA-N	0	3	335.451	3.103	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@H]2CCOc3c(F)cccc32)C1	ZINC001033893030	1342066560	/nfs/dbraw/zinc/06/65/60/1342066560.db2.gz	QPFGQQAFJPYCSY-WBVHZDCISA-N	0	3	346.446	3.191	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cnc3c(F)cccc3c2)C1	ZINC001033896130	1342068537	/nfs/dbraw/zinc/06/85/37/1342068537.db2.gz	ATKXHDBDIWCOFO-QGZVFWFLSA-N	0	3	341.430	3.486	20	30		EGEDHN
C=C1CCC(C(=O)N(CC)[C@@H]2CCN(C[C@H]3CC(C)(C)CO3)C2)CC1	ZINC001033951505	1342109599	/nfs/dbraw/zinc/10/95/99/1342109599.db2.gz	WUXWKBVMMSUBMT-RTBURBONSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=CCCN1CC[C@@H](N(CC)C(=O)c2ccc(Br)o2)C1	ZINC001034026872	1342166630	/nfs/dbraw/zinc/16/66/30/1342166630.db2.gz	ZEYRRFZADSDYFQ-GFCCVEGCSA-N	0	3	341.249	3.155	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cc(-c3ccc(C)o3)n[nH]2)C1	ZINC001034043526	1342185065	/nfs/dbraw/zinc/18/50/65/1342185065.db2.gz	WHNONONPJUFWOO-HNNXBMFYSA-N	0	3	342.443	3.091	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2ccc(OC3CCC3)cc2)C1	ZINC001034044516	1342185199	/nfs/dbraw/zinc/18/51/99/1342185199.db2.gz	BUWHIKWWPZRXRY-GOSISDBHSA-N	0	3	340.467	3.178	20	30		EGEDHN
C=CCCN1CC[C@H](N(CC)C(=O)c2cnc(CC(C)C)s2)C1	ZINC001034050765	1342191468	/nfs/dbraw/zinc/19/14/68/1342191468.db2.gz	FQESNANAUVACAD-HNNXBMFYSA-N	0	3	335.517	3.454	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@@H]2CCc3ccc(OC)cc32)C1	ZINC001034244442	1342343960	/nfs/dbraw/zinc/34/39/60/1342343960.db2.gz	BDZBXGYCYWMWAE-PKOBYXMFSA-N	0	3	342.483	3.272	20	30		EGEDHN
C=CCCN1CCCC[C@H](NC(=O)c2cc3ccncc3s2)C1	ZINC001034250729	1342347414	/nfs/dbraw/zinc/34/74/14/1342347414.db2.gz	RZCQYPIUZNIIRE-HNNXBMFYSA-N	0	3	329.469	3.457	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)c2cn(CC)c3ccccc23)C1	ZINC001034294864	1342377520	/nfs/dbraw/zinc/37/75/20/1342377520.db2.gz	BVGGQAVOWXRDDI-MRXNPFEDSA-N	0	3	325.456	3.432	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)[C@@H]2C[C@H]2c2c(F)cccc2F)C1	ZINC001034384835	1342453136	/nfs/dbraw/zinc/45/31/36/1342453136.db2.gz	IYQZNSXEFPXMTK-RBSFLKMASA-N	0	3	334.410	3.225	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2cc(C)oc2C(F)(F)F)C1	ZINC001034423817	1342484994	/nfs/dbraw/zinc/48/49/94/1342484994.db2.gz	LKWOPJXYYFEWRR-CYBMUJFWSA-N	0	3	342.361	3.214	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc3c(c2)C[C@H](C)O3)C1	ZINC001034444693	1342505411	/nfs/dbraw/zinc/50/54/11/1342505411.db2.gz	JQELENYMTHPYIA-YJBOKZPZSA-N	0	3	328.456	3.170	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cccc(F)c2OCC)C1	ZINC001034467415	1342522771	/nfs/dbraw/zinc/52/27/71/1342522771.db2.gz	LYUMUJOPPWLNQC-HNNXBMFYSA-N	0	3	334.435	3.385	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccnc(OC(C)C)c2)C1	ZINC001034482943	1342539665	/nfs/dbraw/zinc/53/96/65/1342539665.db2.gz	NFYKWKMNVYGPFZ-KRWDZBQOSA-N	0	3	331.460	3.029	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)C[C@H]2CCc3ccccc3C2)C1	ZINC001034501646	1342559724	/nfs/dbraw/zinc/55/97/24/1342559724.db2.gz	YIJRDUNYRBKJRS-PXNSSMCTSA-N	0	3	326.484	3.338	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2cc(C)c(F)cc2Cl)C1	ZINC001034508122	1342566794	/nfs/dbraw/zinc/56/67/94/1342566794.db2.gz	ZTSATLNKVIDMAO-AWEZNQCLSA-N	0	3	336.838	3.395	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2cc3c(s2)CCCC3)C1	ZINC001034514889	1342573478	/nfs/dbraw/zinc/57/34/78/1342573478.db2.gz	NWPQAYWPSKPRLR-MRXNPFEDSA-N	0	3	330.497	3.235	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2cscc2C(F)(F)F)C1	ZINC001034559655	1342618164	/nfs/dbraw/zinc/61/81/64/1342618164.db2.gz	SGPUEJWORSMYFC-GFCCVEGCSA-N	0	3	344.402	3.375	20	30		EGEDHN
Cc1occc1C(=O)N[C@H]1CC[C@H](NCc2ccccc2C#N)CC1	ZINC001034590888	1342635645	/nfs/dbraw/zinc/63/56/45/1342635645.db2.gz	NZILGYIHTQXVSJ-IYARVYRRSA-N	0	3	337.423	3.291	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC[C@@H]1CNC1c2ccccc2-c2ccccc21	ZINC001034887605	1342821751	/nfs/dbraw/zinc/82/17/51/1342821751.db2.gz	YFFVHPGSUWIWLD-JKSUJKDBSA-N	0	3	345.446	3.497	20	30		EGEDHN
COc1ccc(C(C)C)cc1CNC[C@H]1CCCN1C(=O)[C@H](C)C#N	ZINC001034886247	1342821762	/nfs/dbraw/zinc/82/17/62/1342821762.db2.gz	HSAIBJFNSOOBNA-CRAIPNDOSA-N	0	3	343.471	3.059	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC2(CCN(CC#Cc3ccccc3)C2)CC1	ZINC001035159061	1342975768	/nfs/dbraw/zinc/97/57/68/1342975768.db2.gz	YCMQGKIOEGQDRL-LJQANCHMSA-N	0	3	338.495	3.399	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC2(CCN(Cc3conc3C)C2)CC1	ZINC001035211318	1343029145	/nfs/dbraw/zinc/02/91/45/1343029145.db2.gz	JULUQEGCYMYMJI-UHFFFAOYSA-N	0	3	331.460	3.010	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1nc(C(C)C)oc1C)CC2	ZINC001035705804	1343143807	/nfs/dbraw/zinc/14/38/07/1343143807.db2.gz	FMWFFVCAROGDSO-UHFFFAOYSA-N	0	3	331.460	3.221	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)CO[C@@H]1CCCC[C@@H]1CC)CC2	ZINC001035704187	1343143812	/nfs/dbraw/zinc/14/38/12/1343143812.db2.gz	ZDRXMNAACFGGBK-RBUKOAKNSA-N	0	3	348.531	3.472	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)Cc1cccc(C(C)C)c1)CC2	ZINC001035744488	1343164622	/nfs/dbraw/zinc/16/46/22/1343164622.db2.gz	HIKZTQGYNGADAM-UHFFFAOYSA-N	0	3	338.495	3.300	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H]1CCc3cc(F)ccc31)CC2	ZINC001035751480	1343170606	/nfs/dbraw/zinc/17/06/06/1343170606.db2.gz	YJGIPKGSHQIKMD-LJQANCHMSA-N	0	3	342.458	3.356	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cc3c(ccc(C)c3C)[nH]1)CC2	ZINC001035765269	1343177477	/nfs/dbraw/zinc/17/74/77/1343177477.db2.gz	UZJOFXJIAYECTM-UHFFFAOYSA-N	0	3	349.478	3.346	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)C(C)(C)c1ccccc1F)CC2	ZINC001035819221	1343214547	/nfs/dbraw/zinc/21/45/47/1343214547.db2.gz	ITSMXKDQWHKXSI-UHFFFAOYSA-N	0	3	342.458	3.051	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H]1CCOc3ccccc31)CC2	ZINC001035820439	1343215264	/nfs/dbraw/zinc/21/52/64/1343215264.db2.gz	UYDFDWNGVITXGX-GOSISDBHSA-N	0	3	340.467	3.053	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)C[C@@H]1CCc3ccccc31)CC2	ZINC001035822963	1343215544	/nfs/dbraw/zinc/21/55/44/1343215544.db2.gz	ZBLMUZUTIXGJET-IBGZPJMESA-N	0	3	336.479	3.054	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)CCc1cc(C)cc(C)c1)CC2	ZINC001035832092	1343219860	/nfs/dbraw/zinc/21/98/60/1343219860.db2.gz	ZXVCKFUTIMXXGV-UHFFFAOYSA-N	0	3	338.495	3.184	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1[nH]ccc1-c1ccccc1)CC2	ZINC001035839105	1343221601	/nfs/dbraw/zinc/22/16/01/1343221601.db2.gz	NXIUTVCXEWJUJL-UHFFFAOYSA-N	0	3	347.462	3.243	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)CCc1ccc(CC)cc1)CC2	ZINC001035849923	1343229666	/nfs/dbraw/zinc/22/96/66/1343229666.db2.gz	QCQCSDWECQAKSR-UHFFFAOYSA-N	0	3	338.495	3.129	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@@H](NCc2cc(F)ccc2C#N)[C@@H](C)C1	ZINC001035907371	1343263128	/nfs/dbraw/zinc/26/31/28/1343263128.db2.gz	KVVHAUHLTYTKMV-KBXCAEBGSA-N	0	3	331.435	3.070	20	30		EGEDHN
C/C(=C\C(=O)N1CC[C@H](NCc2ccccc2C#N)[C@H](C)C1)C1CC1	ZINC001035938574	1343280183	/nfs/dbraw/zinc/28/01/83/1343280183.db2.gz	DSLLHYLFDAZEHA-HWIYTKFHSA-N	0	3	337.467	3.241	20	30		EGEDHN
C[C@H]1CN(C(=O)CCC2CC2)CC[C@H]1NCc1cc(F)ccc1C#N	ZINC001035969215	1343293005	/nfs/dbraw/zinc/29/30/05/1343293005.db2.gz	UAOMXXZJYZUZIU-IFXJQAMLSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@@H]1CN(C(=O)C#CC2CC2)CC[C@@H]1NCc1c(F)cccc1Cl	ZINC001036020238	1343308460	/nfs/dbraw/zinc/30/84/60/1343308460.db2.gz	CBJPMZJRCKAMGY-ACJLOTCBSA-N	0	3	348.849	3.219	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](NCc2nc(C)oc2C)[C@H](C)C1	ZINC001036139435	1343324453	/nfs/dbraw/zinc/32/44/53/1343324453.db2.gz	ZHXFEKFPAXDJJO-CJNGLKHVSA-N	0	3	333.476	3.220	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](NCc2cc(F)ccc2C#N)[C@H](C)C1	ZINC001036140977	1343325643	/nfs/dbraw/zinc/32/56/43/1343325643.db2.gz	FJJXFEXHDLLHOZ-KDOFPFPSSA-N	0	3	343.446	3.236	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](NCc3nc(C)cs3)[C@H](C)C2)C1	ZINC001036170215	1343343178	/nfs/dbraw/zinc/34/31/78/1343343178.db2.gz	QVNHUEKNVYXEGQ-HIFRSBDPSA-N	0	3	333.501	3.134	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCCN(C(=O)CC2CC2)C1	ZINC001036346978	1343433936	/nfs/dbraw/zinc/43/39/36/1343433936.db2.gz	YVKLLCRVFVTTJX-DNVCBOLYSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@H]1CCCN(C(=O)C2CCC2)[C@H]1CNCc1cc(C#N)ccc1F	ZINC001036487645	1343510965	/nfs/dbraw/zinc/51/09/65/1343510965.db2.gz	NCBBOSYCODVWNP-LIRRHRJNSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@H]1CCCN(C(=O)C(C)(C)F)[C@@H]1CNCc1cc(C#N)ccc1F	ZINC001036501051	1343519550	/nfs/dbraw/zinc/51/95/50/1343519550.db2.gz	NRMRQGVQUGVKFM-SUMWQHHRSA-N	0	3	349.425	3.162	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@H](C)[C@H]1CNCc1ccc(C#N)cc1F	ZINC001036511346	1343526976	/nfs/dbraw/zinc/52/69/76/1343526976.db2.gz	SSHNUVDHBRROLT-KBXCAEBGSA-N	0	3	331.435	3.070	20	30		EGEDHN
C[C@H]1CCCN(C(=O)C=C2CCC2)[C@@H]1CNCc1ccc(C#N)s1	ZINC001036534611	1343541715	/nfs/dbraw/zinc/54/17/15/1343541715.db2.gz	IYRLINGSAXWYOO-KBXCAEBGSA-N	0	3	343.496	3.447	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001036652783	1343603125	/nfs/dbraw/zinc/60/31/25/1343603125.db2.gz	XZXLTDHDCLHTFN-CRAIPNDOSA-N	0	3	345.512	3.479	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CN(C(=O)C4=CCCC4)CC[C@@H]32)s1	ZINC001036686169	1343628515	/nfs/dbraw/zinc/62/85/15/1343628515.db2.gz	JWXTUVNEZLWIAR-QAPCUYQASA-N	0	3	341.480	3.153	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2[C@H](CCN2Cc2ccccc2F)C1	ZINC001036792891	1343724483	/nfs/dbraw/zinc/72/44/83/1343724483.db2.gz	WHYZECVXACPVEU-AEFFLSMTSA-N	0	3	330.447	3.461	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]2[C@H](CCN2Cc2cnoc2C)C1	ZINC001036794416	1343726705	/nfs/dbraw/zinc/72/67/05/1343726705.db2.gz	USZAANPARFYPJR-NVXWUHKLSA-N	0	3	331.460	3.008	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@@H]2[C@@H](CCN2CC#Cc2ccccc2)C1	ZINC001036804041	1343738594	/nfs/dbraw/zinc/73/85/94/1343738594.db2.gz	DAFJXDOUIQLNIU-VQTJNVASSA-N	0	3	338.495	3.397	20	30		EGEDHN
CCC1(C(=O)N2CC[C@H]3[C@H](CCN3Cc3ccc(C#N)s3)C2)CC1	ZINC001036814087	1343750865	/nfs/dbraw/zinc/75/08/65/1343750865.db2.gz	IXYHUVIXTDECBN-PBHICJAKSA-N	0	3	343.496	3.233	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCC[C@@H]1NC(=O)CC1CCC1	ZINC001036970612	1343900399	/nfs/dbraw/zinc/90/03/99/1343900399.db2.gz	PBZUOJUNGNLARY-OALUTQOASA-N	0	3	325.456	3.123	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCC[C@H]1NC(=O)C1(F)CCCC1	ZINC001037033268	1343940731	/nfs/dbraw/zinc/94/07/31/1343940731.db2.gz	NGZLDHKEDPVCBP-QZTJIDSGSA-N	0	3	343.446	3.215	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NC[C@H]1CCN1CCC1CCCCC1	ZINC001038267690	1344349749	/nfs/dbraw/zinc/34/97/49/1344349749.db2.gz	YPVVAMYFRWETEO-QRVBRYPASA-N	0	3	334.504	3.129	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCN2CCC2CCCCCC2)cn1	ZINC001038934547	1344660466	/nfs/dbraw/zinc/66/04/66/1344660466.db2.gz	ZAMMPNZEYVJQBE-HXUWFJFHSA-N	0	3	339.483	3.228	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1ccc(COC(C)C)cc1	ZINC001039012285	1344715575	/nfs/dbraw/zinc/71/55/75/1344715575.db2.gz	LMINDQSMUCPWJX-IBGZPJMESA-N	0	3	330.472	3.382	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)[C@H](CC)SC)CC2)C1	ZINC001039119060	1344792456	/nfs/dbraw/zinc/79/24/56/1344792456.db2.gz	VMFOILYRGCRSCJ-HOTGVXAUSA-N	0	3	344.952	3.441	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)C3CC(F)(F)C3)CC2)C1	ZINC001039128919	1344807472	/nfs/dbraw/zinc/80/74/72/1344807472.db2.gz	XGUAHANECZDBGG-AWEZNQCLSA-N	0	3	346.849	3.345	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)[C@H](F)C(C)C)CC2)C1	ZINC001039150918	1344833919	/nfs/dbraw/zinc/83/39/19/1344833919.db2.gz	CXWZGPLEPIOFNB-HZPDHXFCSA-N	0	3	330.875	3.294	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2sccc2C)C1	ZINC001039178340	1344872715	/nfs/dbraw/zinc/87/27/15/1344872715.db2.gz	OSKWNFICCLKDME-SJORKVTESA-N	0	3	330.497	3.396	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cccc(F)c2C)C1	ZINC001039212970	1344928629	/nfs/dbraw/zinc/92/86/29/1344928629.db2.gz	ZDTLYAOTIFNHAI-XLIONFOSSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)CCc2ccc(F)cc2)C1	ZINC001039218443	1344935726	/nfs/dbraw/zinc/93/57/26/1344935726.db2.gz	MFYDDBBLGJBVNF-ICSRJNTNSA-N	0	3	342.458	3.095	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccn(C(C)C)c2C)C1	ZINC001039225454	1344943536	/nfs/dbraw/zinc/94/35/36/1344943536.db2.gz	OHNLKGZHTBDLOM-UYAOXDASSA-N	0	3	341.499	3.327	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc(C(C)C)on2)C1	ZINC001039226205	1344944492	/nfs/dbraw/zinc/94/44/92/1344944492.db2.gz	STNYMSKDZNPRQJ-SJLPKXTDSA-N	0	3	343.471	3.138	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)Cc2cc(C)ccc2C)C1	ZINC001039228965	1344948337	/nfs/dbraw/zinc/94/83/37/1344948337.db2.gz	KKBMNJLDDCGZTE-TZIWHRDSSA-N	0	3	338.495	3.182	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)Cc2cc(C)cc(C)c2)C1	ZINC001039231287	1344950803	/nfs/dbraw/zinc/95/08/03/1344950803.db2.gz	REPCHEKQEFGLLQ-SFTDATJTSA-N	0	3	338.495	3.182	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc3c(c2)CCC3)C1	ZINC001039238417	1344962638	/nfs/dbraw/zinc/96/26/38/1344962638.db2.gz	IDLSTICVYVHRIV-RTWAWAEBSA-N	0	3	336.479	3.125	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)Cc2ccccc2Cl)C1	ZINC001039239505	1344964081	/nfs/dbraw/zinc/96/40/81/1344964081.db2.gz	NPWUHNWFOZJXSC-IEBWSBKVSA-N	0	3	344.886	3.219	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)C2CCC=CCC2)C1	ZINC001039241680	1344967235	/nfs/dbraw/zinc/96/72/35/1344967235.db2.gz	GNJAFLGTGWFONA-VQTJNVASSA-N	0	3	328.500	3.459	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc[nH]c2CCC)C1	ZINC001039246807	1344976061	/nfs/dbraw/zinc/97/60/61/1344976061.db2.gz	URYUGZZBHHJBKE-XLIONFOSSA-N	0	3	341.499	3.307	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cccc(OC)c2)C1	ZINC001039248238	1344978228	/nfs/dbraw/zinc/97/82/28/1344978228.db2.gz	ACRAAXOSBITFGK-QUCCMNQESA-N	0	3	340.467	3.035	20	30		EGEDHN
C=CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cnc([C@H](C)OC)s1	ZINC001039375102	1345033128	/nfs/dbraw/zinc/03/31/28/1345033128.db2.gz	RMLYVGZWOWRUAO-ZNMIVQPWSA-N	0	3	349.500	3.106	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cn1c(C)cc2ccccc21	ZINC001039402487	1345048536	/nfs/dbraw/zinc/04/85/36/1345048536.db2.gz	ZKRHVZNONYAVFT-UXHICEINSA-N	0	3	349.478	3.038	20	30		EGEDHN
C=C(C)CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ncc(Cl)s1	ZINC001039404601	1345050462	/nfs/dbraw/zinc/05/04/62/1345050462.db2.gz	JQAIPWLMDSJVLY-OLZOCXBDSA-N	0	3	339.892	3.442	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@H]1CCCC1(F)F	ZINC001039424643	1345061797	/nfs/dbraw/zinc/06/17/97/1345061797.db2.gz	AZBWWBKFVINFNN-OAGGEKHMSA-N	0	3	326.431	3.453	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc2ccccc2n1C	ZINC001039426230	1345062413	/nfs/dbraw/zinc/06/24/13/1345062413.db2.gz	XKQSETPLNSDHMY-MSOLQXFVSA-N	0	3	337.467	3.433	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](CC)c1c(C)noc1C	ZINC001039452435	1345075465	/nfs/dbraw/zinc/07/54/65/1345075465.db2.gz	WIGWVBXZHAFZLW-FGTMMUONSA-N	0	3	345.487	3.426	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1cc(F)ccc1OC	ZINC001039456701	1345076934	/nfs/dbraw/zinc/07/69/34/1345076934.db2.gz	JSOGDLFXTQWDDM-MSOLQXFVSA-N	0	3	346.446	3.018	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cn(C(C)C)nc1C	ZINC001039459607	1345079323	/nfs/dbraw/zinc/07/93/23/1345079323.db2.gz	FGBMTKRDXDQLDX-SJORKVTESA-N	0	3	330.476	3.027	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(C2CC2)cn1	ZINC001039465158	1345083004	/nfs/dbraw/zinc/08/30/04/1345083004.db2.gz	QZQMDPSQDBNICA-MSOLQXFVSA-N	0	3	325.456	3.214	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(N(C)CC)cc1	ZINC001039476784	1345091276	/nfs/dbraw/zinc/09/12/76/1345091276.db2.gz	NOYAGEHOPWEMQY-UXHICEINSA-N	0	3	341.499	3.398	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C12CC(C(C)(C)C)(C1)C2	ZINC001039476423	1345091588	/nfs/dbraw/zinc/09/15/88/1345091588.db2.gz	RYAYTPMZSGHKPZ-UUBYJMPYSA-N	0	3	328.500	3.291	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC1CC(OCC)C1	ZINC001039896173	1345239086	/nfs/dbraw/zinc/23/90/86/1345239086.db2.gz	FTHVPRBSXGNDHF-DIMYUCCJSA-N	0	3	348.531	3.469	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@@]2(C1)CCCN(Cc1cccc(F)c1)C2	ZINC001040198872	1345372816	/nfs/dbraw/zinc/37/28/16/1345372816.db2.gz	XBYDJFQCQKNFQI-NRFANRHFSA-N	0	3	340.442	3.054	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@]3(CCN(C(=O)c4cc[nH]c4)C3)C2)cc1	ZINC001040222462	1345381280	/nfs/dbraw/zinc/38/12/80/1345381280.db2.gz	DSVFFCYEXPDYGF-NRFANRHFSA-N	0	3	348.450	3.015	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cnn(C(C)(C)C)c3C)C2)C1	ZINC001040231800	1345387181	/nfs/dbraw/zinc/38/71/81/1345387181.db2.gz	KXQWKFIVWJLITM-HXUWFJFHSA-N	0	3	344.503	3.061	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CC[C@]2(C1)CCCN(C[C@@H](F)CC)C2	ZINC001040241593	1345391993	/nfs/dbraw/zinc/39/19/93/1345391993.db2.gz	PRTRNQLTZPMUJY-FXAWDEMLSA-N	0	3	347.478	3.350	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cncc(Cl)c3C)C2)C1	ZINC001040253761	1345397045	/nfs/dbraw/zinc/39/70/45/1345397045.db2.gz	QYTVKYHKXYQEJC-SFHVURJKSA-N	0	3	333.863	3.158	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@@H]3CCC=CCCC3)C2)C1	ZINC001040256901	1345397723	/nfs/dbraw/zinc/39/77/23/1345397723.db2.gz	BEFJLAPJPSQDEJ-TZIWHRDSSA-N	0	3	328.500	3.461	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cnoc3-c3ccco3)C2)C1	ZINC001040263631	1345402095	/nfs/dbraw/zinc/40/20/95/1345402095.db2.gz	GQWBZIJGQIYYLJ-LJQANCHMSA-N	0	3	341.411	3.049	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3c(F)cc(C)cc3F)C2)C1	ZINC001040288417	1345413121	/nfs/dbraw/zinc/41/31/21/1345413121.db2.gz	CRIILXAHCHNJKL-HXUWFJFHSA-N	0	3	346.421	3.225	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3c(F)ccc(F)c3F)C2)C1	ZINC001040361209	1345454737	/nfs/dbraw/zinc/45/47/37/1345454737.db2.gz	QRNMMLSRXUUMRD-GOSISDBHSA-N	0	3	338.373	3.218	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@H](C)c3cccc(C)c3)C2)C1	ZINC001040422400	1345489124	/nfs/dbraw/zinc/48/91/24/1345489124.db2.gz	MLHAQCAAJLJGAJ-KNQAVFIVSA-N	0	3	338.495	3.436	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@H](CC)OC3CCCC3)C2)C1	ZINC001040432299	1345494624	/nfs/dbraw/zinc/49/46/24/1345494624.db2.gz	RTMSQURBSAZAKM-PZJWPPBQSA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3cccc4ccsc43)C2)C1	ZINC001040478936	1345513075	/nfs/dbraw/zinc/51/30/75/1345513075.db2.gz	MEXZCNNLIFHHHF-HXUWFJFHSA-N	0	3	338.476	3.463	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)Cc3sc(C)cc3C)C2)C1	ZINC001040514906	1345528110	/nfs/dbraw/zinc/52/81/10/1345528110.db2.gz	XMAJAYDHEPDTPG-FQEVSTJZSA-N	0	3	344.524	3.245	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cc4c(s3)CCC4)C2)C1	ZINC001040521307	1345530886	/nfs/dbraw/zinc/53/08/86/1345530886.db2.gz	ZOKPPYDZDCWPFX-IBGZPJMESA-N	0	3	330.497	3.351	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3c[nH]cc3-c3ccccc3)C2)C1	ZINC001040530551	1345534849	/nfs/dbraw/zinc/53/48/49/1345534849.db2.gz	CBWHOGDMVNTYLS-JOCHJYFZSA-N	0	3	347.462	3.243	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@@H](C)c3cccc(Cl)c3)C2)C1	ZINC001040537528	1345535884	/nfs/dbraw/zinc/53/58/84/1345535884.db2.gz	ATMWSAFLUNBAPA-OXJNMPFZSA-N	0	3	344.886	3.391	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@H](C)c3ccc(F)cc3F)C2)C1	ZINC001040537622	1345536532	/nfs/dbraw/zinc/53/65/32/1345536532.db2.gz	BLKKKVQMIPNKSA-QRWLVFNGSA-N	0	3	346.421	3.016	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3cc4ccccc4n3CC)C2)C1	ZINC001040541628	1345537394	/nfs/dbraw/zinc/53/73/94/1345537394.db2.gz	CIQSUCDOVBUFQX-QFIPXVFZSA-N	0	3	349.478	3.223	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3c[nH]c4c3cccc4CC)C2)C1	ZINC001040543571	1345539345	/nfs/dbraw/zinc/53/93/45/1345539345.db2.gz	PIEZLQZXQKVUSZ-QFIPXVFZSA-N	0	3	349.478	3.292	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)CCc3cc(C)sc3C)C2)C1	ZINC001040546847	1345541268	/nfs/dbraw/zinc/54/12/68/1345541268.db2.gz	HIADLLDDZRHXOK-HXUWFJFHSA-N	0	3	344.524	3.245	20	30		EGEDHN
C[C@@H]1C[C@@H]1C(=O)N1CCC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001040590235	1345551323	/nfs/dbraw/zinc/55/13/23/1345551323.db2.gz	OJAWDIPTBYDSFA-APWZRJJASA-N	0	3	337.467	3.029	20	30		EGEDHN
CC(C)C(=O)N1CCC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001040612986	1345556254	/nfs/dbraw/zinc/55/62/54/1345556254.db2.gz	NCFSXASXACAMQK-UHFFFAOYSA-N	0	3	325.456	3.029	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC2(C1)CCN(Cc1oc(C)nc1C)CC2	ZINC001040801710	1345579554	/nfs/dbraw/zinc/57/95/54/1345579554.db2.gz	YYKOLIFYHPVOER-UHFFFAOYSA-N	0	3	345.487	3.318	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC2(C1)CCN(Cc1ccccn1)CC2	ZINC001040830839	1345584055	/nfs/dbraw/zinc/58/40/55/1345584055.db2.gz	OUEUHILNYJIARV-FQEVSTJZSA-N	0	3	341.499	3.498	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@@H](CC)OC3CCCC3)C2)CC1	ZINC001040872314	1345591719	/nfs/dbraw/zinc/59/17/19/1345591719.db2.gz	ZQFKKTRTJMEKKT-LJQANCHMSA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)C34CCC(CC3)C4(C)C)C2)CC1	ZINC001040875527	1345592815	/nfs/dbraw/zinc/59/28/15/1345592815.db2.gz	BBNORINTLYWMHT-UHFFFAOYSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cc4ccccc4[nH]3)C2)CC1	ZINC001040929883	1345603392	/nfs/dbraw/zinc/60/33/92/1345603392.db2.gz	FYSQBZRCFYGZRD-UHFFFAOYSA-N	0	3	335.451	3.119	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3c[nH]c4ccc(C)cc34)C2)CC1	ZINC001040947941	1345607418	/nfs/dbraw/zinc/60/74/18/1345607418.db2.gz	IZDGKVMCKXAANB-UHFFFAOYSA-N	0	3	335.451	3.038	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccc(-c4ccccc4)[nH]3)C2)CC1	ZINC001040953967	1345609658	/nfs/dbraw/zinc/60/96/58/1345609658.db2.gz	KAKABTOVHSCAHY-UHFFFAOYSA-N	0	3	347.462	3.243	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3coc4ccccc34)C2)CC1	ZINC001040957847	1345610323	/nfs/dbraw/zinc/61/03/23/1345610323.db2.gz	YUGGJWMTTBPUOU-UHFFFAOYSA-N	0	3	336.435	3.384	20	30		EGEDHN
Cc1ccc(CN2CC[C@]3(CCN(C(=O)[C@H](C)C#N)C3)C2)c(Cl)c1	ZINC001041136225	1345658924	/nfs/dbraw/zinc/65/89/24/1345658924.db2.gz	GIZTYHMAAWIUNJ-BEFAXECRSA-N	0	3	345.874	3.233	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)[C@@H]3C[C@H]3c3sccc3C)C2)C1	ZINC001041284937	1345694768	/nfs/dbraw/zinc/69/47/68/1345694768.db2.gz	ZQBLNZNAEKTEGE-HLIPFELVSA-N	0	3	342.508	3.108	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@]2(CCN(Cc3ccccn3)C2)C1	ZINC001041322357	1345702165	/nfs/dbraw/zinc/70/21/65/1345702165.db2.gz	PDIGRCDTOWJFPN-LJQANCHMSA-N	0	3	347.890	3.285	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@]3(CCN(C(=O)C4(C5CC5)CC4)C3)C2)c1	ZINC001041386595	1345714726	/nfs/dbraw/zinc/71/47/26/1345714726.db2.gz	NHRBJOVKJXGOGH-NRFANRHFSA-N	0	3	349.478	3.173	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@]2(CCN(Cc3ncccc3C)C2)C1	ZINC001041536761	1345755828	/nfs/dbraw/zinc/75/58/28/1345755828.db2.gz	QOSCSDUBVTXURV-NRFANRHFSA-N	0	3	341.499	3.417	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@]2(CCN(Cc3c(C)noc3C)C2)C1	ZINC001041626237	1345801616	/nfs/dbraw/zinc/80/16/16/1345801616.db2.gz	QIPMDBQKLYBOQT-UXHICEINSA-N	0	3	345.487	3.318	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@]3(CCN(Cc4cncc(C)c4)C3)C2)C1	ZINC001041652932	1345812156	/nfs/dbraw/zinc/81/21/56/1345812156.db2.gz	OIKWVUYFIONCRD-NRFANRHFSA-N	0	3	339.483	3.171	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3ccc(F)c4ccccc34)C2)C1	ZINC001041705065	1345824361	/nfs/dbraw/zinc/82/43/61/1345824361.db2.gz	LBESRWATIDZSMT-OAQYLSRUSA-N	0	3	336.410	3.150	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)[C@@H]3C[C@H]3c3cccc(C)c3)C2)C1	ZINC001041735153	1345835760	/nfs/dbraw/zinc/83/57/60/1345835760.db2.gz	CSBNDTFOMBHJED-VWPQPMDRSA-N	0	3	336.479	3.046	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)C(C)(C)c3ccccc3F)C2)C1	ZINC001041741914	1345837968	/nfs/dbraw/zinc/83/79/68/1345837968.db2.gz	WHMNBWRRTKXQIO-NRFANRHFSA-N	0	3	342.458	3.051	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccccc3OC(C)C)C2)C1	ZINC001041796094	1345853181	/nfs/dbraw/zinc/85/31/81/1345853181.db2.gz	FXIKDCZIZFGGAC-NRFANRHFSA-N	0	3	340.467	3.035	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cc(C)nc4ccccc43)C2)C1	ZINC001041815369	1345860396	/nfs/dbraw/zinc/86/03/96/1345860396.db2.gz	AMLDCESVTDYGEJ-JOCHJYFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccc4[nH]c(C)c(C)c4c3)C2)C1	ZINC001041823054	1345864221	/nfs/dbraw/zinc/86/42/21/1345864221.db2.gz	WHJJUXUOUAGYBM-QFIPXVFZSA-N	0	3	349.478	3.346	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)CC3C4CC5CC(C4)CC3C5)C2)C1	ZINC001041838790	1345868282	/nfs/dbraw/zinc/86/82/82/1345868282.db2.gz	BYSRTWZRRNTDDN-CUZPGCTQSA-N	0	3	340.511	3.006	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)C[C@@H](C)c3ccc(F)cc3)C2)C1	ZINC001041842507	1345869916	/nfs/dbraw/zinc/86/99/16/1345869916.db2.gz	HROJUQSNMBYDSX-DYESRHJHSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3c(CC)oc4ccccc43)C2)C1	ZINC001041845666	1345871509	/nfs/dbraw/zinc/87/15/09/1345871509.db2.gz	MRCSAZRTTAFLII-NRFANRHFSA-N	0	3	336.435	3.166	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(C(F)F)ccc3F)C[C@@H]21	ZINC001042065542	1345934668	/nfs/dbraw/zinc/93/46/68/1345934668.db2.gz	VXGSCIHDLYLSLW-LRDDRELGSA-N	0	3	338.373	3.486	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cccc(OCCC)c3)C[C@@H]21	ZINC001042080864	1345939673	/nfs/dbraw/zinc/93/96/73/1345939673.db2.gz	PEEGCDODNKSDRV-XLIONFOSSA-N	0	3	340.467	3.035	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ocnc3-c3ccccc3)C[C@H]21	ZINC001042089230	1345941191	/nfs/dbraw/zinc/94/11/91/1345941191.db2.gz	WJCNUGQARDWXSC-NVXWUHKLSA-N	0	3	337.423	3.064	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ocnc3-c3ccccc3)C[C@H]21	ZINC001042089229	1345941224	/nfs/dbraw/zinc/94/12/24/1345941224.db2.gz	WJCNUGQARDWXSC-DOTOQJQBSA-N	0	3	337.423	3.064	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3conc3C3CCCC3)C[C@@H]21	ZINC001042091825	1345941617	/nfs/dbraw/zinc/94/16/17/1345941617.db2.gz	YMXCNYPWIYNFGH-QAPCUYQASA-N	0	3	343.471	3.445	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cccc4ccc(C)nc43)C[C@@H]21	ZINC001042111490	1345946310	/nfs/dbraw/zinc/94/63/10/1345946310.db2.gz	JUJMMCCTPGAKHR-LPHOPBHVSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cccc4ccc(C)nc43)C[C@H]21	ZINC001042111492	1345947213	/nfs/dbraw/zinc/94/72/13/1345947213.db2.gz	JUJMMCCTPGAKHR-VQIMIIECSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(C)c4ccccc4n3)C[C@@H]21	ZINC001042115212	1345947960	/nfs/dbraw/zinc/94/79/60/1345947960.db2.gz	SWCHMGBBOAHLTB-UZLBHIALSA-N	0	3	335.451	3.266	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)C3(C)CCC(F)(F)CC3)C[C@H]21	ZINC001042116298	1345948399	/nfs/dbraw/zinc/94/83/99/1345948399.db2.gz	BHDPWCXHYRNICR-JKSUJKDBSA-N	0	3	338.442	3.148	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3c(F)cc(C)cc3F)C[C@H]21	ZINC001042146062	1345956884	/nfs/dbraw/zinc/95/68/84/1345956884.db2.gz	KVMFLCLSKQTUQR-RHSMWYFYSA-N	0	3	334.410	3.386	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3sccc3-n3cccc3)C[C@@H]21	ZINC001042175241	1345966492	/nfs/dbraw/zinc/96/64/92/1345966492.db2.gz	AHIJWJUPNFLASZ-WBVHZDCISA-N	0	3	341.480	3.261	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3csc(-c4ccco4)n3)C[C@@H]21	ZINC001042206656	1345985106	/nfs/dbraw/zinc/98/51/06/1345985106.db2.gz	HVSQRHXVFUKYDQ-ZFWWWQNUSA-N	0	3	343.452	3.126	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3c(F)ccc(F)c3Cl)C[C@@H]21	ZINC001042245633	1346003050	/nfs/dbraw/zinc/00/30/50/1346003050.db2.gz	RFIAHAROSVDYBN-RISCZKNCSA-N	0	3	340.801	3.341	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3csc(C(C)(C)C)n3)C[C@@H]21	ZINC001042267334	1346012319	/nfs/dbraw/zinc/01/23/19/1346012319.db2.gz	SZMLBGOUIYUZKE-HIFRSBDPSA-N	0	3	333.501	3.163	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ncc(Cl)cc3Cl)C[C@H]21	ZINC001042287975	1346017759	/nfs/dbraw/zinc/01/77/59/1346017759.db2.gz	PWKDVPOJJBYENZ-BXUZGUMPSA-N	0	3	340.254	3.111	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cccc(N4CCCC4)c3)C[C@@H]21	ZINC001042286765	1346017792	/nfs/dbraw/zinc/01/77/92/1346017792.db2.gz	CLQJLEXPGZQWRQ-XLIONFOSSA-N	0	3	339.483	3.009	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(OC)c(C4CC4)c3)C[C@@H]21	ZINC001042290970	1346019148	/nfs/dbraw/zinc/01/91/48/1346019148.db2.gz	VHFFUYITDSXVLO-LPHOPBHVSA-N	0	3	340.467	3.295	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc4sccc4c3)C[C@@H]21	ZINC001042296951	1346021400	/nfs/dbraw/zinc/02/14/00/1346021400.db2.gz	JOCLAHQYWYATNA-YJBOKZPZSA-N	0	3	338.476	3.461	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3ncoc3C(C)(C)C)C[C@@H]21	ZINC001042307164	1346025900	/nfs/dbraw/zinc/02/59/00/1346025900.db2.gz	MKUGTSXLFLIVGE-CABCVRRESA-N	0	3	331.460	3.085	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3sccc3COC)C[C@@H]21	ZINC001042311328	1346027917	/nfs/dbraw/zinc/02/79/17/1346027917.db2.gz	JDKSBCCYCLXPMF-HOCLYGCPSA-N	0	3	334.485	3.007	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(OCC(C)C)cc3)C[C@H]21	ZINC001042340162	1346044908	/nfs/dbraw/zinc/04/49/08/1346044908.db2.gz	FNQRGKRMIVJHHL-FXAWDEMLSA-N	0	3	342.483	3.444	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cc(C)c(F)c(C)c3)C[C@@H]21	ZINC001042359626	1346054386	/nfs/dbraw/zinc/05/43/86/1346054386.db2.gz	FSMYIVRABJUAAF-AEFFLSMTSA-N	0	3	328.431	3.002	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(F)c4occc43)C[C@H]21	ZINC001042363750	1346057438	/nfs/dbraw/zinc/05/74/38/1346057438.db2.gz	XMVVTORZNZRAOB-CXAGYDPISA-N	0	3	328.387	3.294	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3c(Cl)cccc3OC)C[C@H]21	ZINC001042369702	1346060094	/nfs/dbraw/zinc/06/00/94/1346060094.db2.gz	AAOJASGGLFBUGY-UKRRQHHQSA-N	0	3	334.847	3.071	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C(C)(C)c3ccccc3C)C[C@H]21	ZINC001042380180	1346065243	/nfs/dbraw/zinc/06/52/43/1346065243.db2.gz	RYEBPHHWPDJQNZ-IEBWSBKVSA-N	0	3	326.484	3.381	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C(C)(C)c3ccccc3C)C[C@@H]21	ZINC001042380181	1346065533	/nfs/dbraw/zinc/06/55/33/1346065533.db2.gz	RYEBPHHWPDJQNZ-MJGOQNOKSA-N	0	3	326.484	3.381	20	30		EGEDHN
C[C@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)CC1CCC1	ZINC001044533948	1346360400	/nfs/dbraw/zinc/36/04/00/1346360400.db2.gz	YBHLNAPECHOFKI-KXBFYZLASA-N	0	3	325.456	3.218	20	30		EGEDHN
C[C@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)Cc1ccccc1	ZINC001044649946	1346392985	/nfs/dbraw/zinc/39/29/85/1346392985.db2.gz	AWQZNXKTIXIQAG-LAUBAEHRSA-N	0	3	347.462	3.270	20	30		EGEDHN
C[C@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)C1(F)CCCC1	ZINC001044655038	1346395119	/nfs/dbraw/zinc/39/51/19/1346395119.db2.gz	WFWLNCJQZCKHHX-YJBOKZPZSA-N	0	3	343.446	3.310	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)CC2CCCC2)cc1F	ZINC001044905241	1346459382	/nfs/dbraw/zinc/45/93/82/1346459382.db2.gz	JSKUFBCMXKECKA-SFHVURJKSA-N	0	3	343.446	3.358	20	30		EGEDHN
C/C(=C\C(=O)N1CCC[C@H]1CNCc1ccc(C#N)cc1F)C1CC1	ZINC001044943226	1346467119	/nfs/dbraw/zinc/46/71/19/1346467119.db2.gz	LTWVGKODDDTNDK-MXHVWWQHSA-N	0	3	341.430	3.134	20	30		EGEDHN
Cc1coc(C)c1C(=O)N1CCC[C@H]1CNCc1ccc(C#N)s1	ZINC001045020706	1346481382	/nfs/dbraw/zinc/48/13/82/1346481382.db2.gz	AAMVVZMYGRBNJH-AWEZNQCLSA-N	0	3	343.452	3.224	20	30		EGEDHN
C[C@]1(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)s2)CC=CCC1	ZINC001045050664	1346486579	/nfs/dbraw/zinc/48/65/79/1346486579.db2.gz	DTZLHWQUBOFBKU-KXBFYZLASA-N	0	3	343.496	3.447	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@H]2CNCc2cncc(F)c2)CC1	ZINC001045182205	1346517798	/nfs/dbraw/zinc/51/77/98/1346517798.db2.gz	OITBMFUKNHTDCB-SFHVURJKSA-N	0	3	331.435	3.048	20	30		EGEDHN
C=C[C@H](C(=O)N1CCC[C@H]1CNCc1cccnc1)c1ccccc1	ZINC001045320135	1346558783	/nfs/dbraw/zinc/55/87/83/1346558783.db2.gz	NHDNZBBQMLZFLW-PMACEKPBSA-N	0	3	335.451	3.132	20	30		EGEDHN
CC1(NC(=O)[C@H]2[C@@H]3CCC[C@@H]32)CCN(Cc2cccc(C#N)c2)CC1	ZINC001045394994	1346581604	/nfs/dbraw/zinc/58/16/04/1346581604.db2.gz	WCWWCMALQUPEIN-BWTSREIZSA-N	0	3	337.467	3.075	20	30		EGEDHN
CC1CC(C(=O)NC2(C)CCN(Cc3ccc(C#N)cc3)CC2)C1	ZINC001045404896	1346585215	/nfs/dbraw/zinc/58/52/15/1346585215.db2.gz	CUNGDMMELDWKQW-UHFFFAOYSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)[C@H]2CC[C@H]2c2ccc(F)cc2)CC1	ZINC001045511852	1346613643	/nfs/dbraw/zinc/61/36/43/1346613643.db2.gz	XLZKCJXMMXVNHJ-OALUTQOASA-N	0	3	342.458	3.313	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2ccc(OCC(C)C)cc2)CC1	ZINC001045634388	1346653937	/nfs/dbraw/zinc/65/39/37/1346653937.db2.gz	BFKKWNLUIHNFDC-UHFFFAOYSA-N	0	3	342.483	3.329	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2cc3ccccc3n2CC)CC1	ZINC001045646128	1346657701	/nfs/dbraw/zinc/65/77/01/1346657701.db2.gz	DRKBRCILPUYKOC-UHFFFAOYSA-N	0	3	325.456	3.432	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2ccc(N(C)CCC)cc2)CC1	ZINC001045653758	1346660831	/nfs/dbraw/zinc/66/08/31/1346660831.db2.gz	FBNHGRREESEWKC-UHFFFAOYSA-N	0	3	329.488	3.303	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1cccc(C#N)c1	ZINC001045758620	1346691529	/nfs/dbraw/zinc/69/15/29/1346691529.db2.gz	ZASMJMPJPWCLCO-CEXWTWQISA-N	0	3	337.467	3.170	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)C1C(C)(C)C1(C)C)C2	ZINC001045926265	1346762343	/nfs/dbraw/zinc/76/23/43/1346762343.db2.gz	BGKHSXBYGHRDEV-OAQYLSRUSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cccc3cccnc31)C2	ZINC001045950680	1346785214	/nfs/dbraw/zinc/78/52/14/1346785214.db2.gz	IYMNGCLXQLEBRO-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)C1CCC3(CC3)CC1)C2	ZINC001045953185	1346788143	/nfs/dbraw/zinc/78/81/43/1346788143.db2.gz	UMPPJPKVEQTCAH-NRFANRHFSA-N	0	3	328.500	3.295	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1occ3c1CCC3)C2	ZINC001045954578	1346789255	/nfs/dbraw/zinc/78/92/55/1346789255.db2.gz	DEHCSHYJZKPEPX-OAQYLSRUSA-N	0	3	340.467	3.110	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccoc1C1CC1)C2	ZINC001045959851	1346794829	/nfs/dbraw/zinc/79/48/29/1346794829.db2.gz	BPXNPNPYPDTDFX-OAQYLSRUSA-N	0	3	340.467	3.499	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc(F)c(Cl)c1)C2	ZINC001045960095	1346795029	/nfs/dbraw/zinc/79/50/29/1346795029.db2.gz	FWAXUYWSOXZYJS-IBGZPJMESA-N	0	3	348.849	3.431	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)Cc1cccc(C)c1)C2	ZINC001045960884	1346796456	/nfs/dbraw/zinc/79/64/56/1346796456.db2.gz	VFGAOSSZLXTHAB-JOCHJYFZSA-N	0	3	338.495	3.265	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)C[C@@H]1CCCC1(F)F)C2	ZINC001045961913	1346797253	/nfs/dbraw/zinc/79/72/53/1346797253.db2.gz	VDCIQWDEWAZRMZ-FUHWJXTLSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H](C)c1ccsc1)C2	ZINC001045964801	1346799797	/nfs/dbraw/zinc/79/97/97/1346799797.db2.gz	BRYASWOQYLZWAD-LPHOPBHVSA-N	0	3	330.497	3.189	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)CC[C@@H]1CCCCO1)C2	ZINC001045969501	1346804601	/nfs/dbraw/zinc/80/46/01/1346804601.db2.gz	ROVBINTUOBOYQR-FPOVZHCZSA-N	0	3	346.515	3.064	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H](F)c1ccccc1)C2	ZINC001045970219	1346805902	/nfs/dbraw/zinc/80/59/02/1346805902.db2.gz	CSNOOIANLKTDGS-PZJWPPBQSA-N	0	3	342.458	3.425	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)C1(C(F)(F)F)CC1)C2	ZINC001045970774	1346806387	/nfs/dbraw/zinc/80/63/87/1346806387.db2.gz	LEQPUZDREDQAKU-INIZCTEOSA-N	0	3	342.405	3.057	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@H](C)c1cc(C)oc1C)C2	ZINC001045974922	1346810992	/nfs/dbraw/zinc/81/09/92/1346810992.db2.gz	QEMFTOKDFZBBKB-UTKZUKDTSA-N	0	3	342.483	3.338	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc(C)c(CC)o1)C2	ZINC001045979970	1346817755	/nfs/dbraw/zinc/81/77/55/1346817755.db2.gz	NOFPVYXFFQCNPJ-NRFANRHFSA-N	0	3	342.483	3.492	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc3ccccc3n1)C2	ZINC001045981688	1346820491	/nfs/dbraw/zinc/82/04/91/1346820491.db2.gz	XYSKSCQOEWROGH-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)C1(c3ccccc3)CC1)C2	ZINC001045983155	1346823376	/nfs/dbraw/zinc/82/33/76/1346823376.db2.gz	JHXUKJWPKWYTQR-OAQYLSRUSA-N	0	3	336.479	3.056	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)Cc1ccccc1C)C2	ZINC001045984142	1346824575	/nfs/dbraw/zinc/82/45/75/1346824575.db2.gz	VWLHCFSDJOJSNK-JOCHJYFZSA-N	0	3	338.495	3.265	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H](C=C)c1ccccc1)C2	ZINC001045985495	1346825901	/nfs/dbraw/zinc/82/59/01/1346825901.db2.gz	VOHVUVBTBUHXEG-RBBKRZOGSA-N	0	3	336.479	3.294	20	30		EGEDHN
C=C(C)CCN1CC[C@](C)(NC(=O)c2cnc([C@@H](C)OC)s2)C1	ZINC001046319247	1346933665	/nfs/dbraw/zinc/93/36/65/1346933665.db2.gz	QUFMPVFXLLUTRZ-DYVFJYSZSA-N	0	3	337.489	3.011	20	30		EGEDHN
C=C(C)CCN1CC[C@@](C)(NC(=O)c2cnc(CC3CC3)s2)C1	ZINC001046510744	1346999703	/nfs/dbraw/zinc/99/97/03/1346999703.db2.gz	YNKZGCWDLNZSEQ-GOSISDBHSA-N	0	3	333.501	3.256	20	30		EGEDHN
C=C1CCC(C(=O)N[C@]2(C)CCN(CCc3scnc3C)C2)CC1	ZINC001046594683	1347031008	/nfs/dbraw/zinc/03/10/08/1347031008.db2.gz	NDTNINOQTSNOIR-LJQANCHMSA-N	0	3	347.528	3.321	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2cc3ncccc3o2)C1	ZINC001046956787	1347165417	/nfs/dbraw/zinc/16/54/17/1347165417.db2.gz	GDKJYRMJFIMSMO-ZDUSSCGKSA-N	0	3	349.381	3.091	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@H]3C[C@@H](C2)N(Cc2ccns2)C3)CC1	ZINC001047139094	1347217652	/nfs/dbraw/zinc/21/76/52/1347217652.db2.gz	LSZLCVIGLDLRCB-XIRDDKMYSA-N	0	3	345.512	3.359	20	30		EGEDHN
CC(C)(C)C(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(Cc1ccc(F)c(C#N)c1)C2	ZINC001047187848	1347235389	/nfs/dbraw/zinc/23/53/89/1347235389.db2.gz	GXBLKMXJYRZFKT-UAGQMJEPSA-N	0	3	343.446	3.213	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)c3ccccc3F)C2)CC1	ZINC001047219698	1347251201	/nfs/dbraw/zinc/25/12/01/1347251201.db2.gz	PRISGVFBKNZOMJ-SFHVURJKSA-N	0	3	342.458	3.413	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3cc(C)cs3)C2)CC1	ZINC001047238642	1347265364	/nfs/dbraw/zinc/26/53/64/1347265364.db2.gz	CELVIIVOEIATPN-KRWDZBQOSA-N	0	3	330.497	3.254	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3cccc(C)c3F)C2)CC1	ZINC001047240336	1347266695	/nfs/dbraw/zinc/26/66/95/1347266695.db2.gz	BIRCERHAZWQSCU-SFHVURJKSA-N	0	3	342.458	3.332	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)c3coc(C)c3)C2)CC1	ZINC001047240904	1347266974	/nfs/dbraw/zinc/26/69/74/1347266974.db2.gz	LHFZLIWOJOCBBH-GOSISDBHSA-N	0	3	328.456	3.176	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)C3(C4CC4)CC3)C2)CC1	ZINC001047243773	1347269298	/nfs/dbraw/zinc/26/92/98/1347269298.db2.gz	NPQDZDXUAUCBHA-SFHVURJKSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@H]3CCCC34CC4)C2)CC1	ZINC001047245166	1347270321	/nfs/dbraw/zinc/27/03/21/1347270321.db2.gz	WZBIVSDOLSELPR-RTBURBONSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)C3(F)CCCC3)C2)CC1	ZINC001047246105	1347271049	/nfs/dbraw/zinc/27/10/49/1347271049.db2.gz	IQGSCMXLVBGDQY-SFHVURJKSA-N	0	3	334.479	3.243	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3c[nH]c4ccccc34)C2)CC1	ZINC001047246604	1347271988	/nfs/dbraw/zinc/27/19/88/1347271988.db2.gz	SLKQHOWSCFVBLY-GOSISDBHSA-N	0	3	349.478	3.365	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3ccoc3C3CC3)C2)CC1	ZINC001047252469	1347276765	/nfs/dbraw/zinc/27/67/65/1347276765.db2.gz	CSLKHNDDEYXREJ-SFHVURJKSA-N	0	3	340.467	3.354	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@@H](C)c3ccsc3)C2)CC1	ZINC001047253877	1347278083	/nfs/dbraw/zinc/27/80/83/1347278083.db2.gz	JRXGKLMXAWRHAM-WMZOPIPTSA-N	0	3	344.524	3.435	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@@H]3C[C@H]3C3CCC3)C2)CC1	ZINC001047256791	1347280198	/nfs/dbraw/zinc/28/01/98/1347280198.db2.gz	CDQHCXCZCLQCHA-SLFFLAALSA-N	0	3	328.500	3.006	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)c3cc(C)[nH]c3C)C2)CC1	ZINC001047260035	1347282801	/nfs/dbraw/zinc/28/28/01/1347282801.db2.gz	WREIAKMPLYBODR-LJQANCHMSA-N	0	3	341.499	3.219	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)C3(F)CCCCC3)C2)CC1	ZINC001047261765	1347283504	/nfs/dbraw/zinc/28/35/04/1347283504.db2.gz	IINYUPKQGXUGNA-GOSISDBHSA-N	0	3	334.479	3.243	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)C[C@H](C)n3cccc3)C2)CC1	ZINC001047263912	1347284977	/nfs/dbraw/zinc/28/49/77/1347284977.db2.gz	KNFSMPWFRWIWDQ-ICSRJNTNSA-N	0	3	341.499	3.023	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@H]([C@H](C)NCc2ccccc2C#N)C1	ZINC001047788300	1347371565	/nfs/dbraw/zinc/37/15/65/1347371565.db2.gz	DFMIWFPTTSVMSG-YOEHRIQHSA-N	0	3	329.419	3.148	20	30		EGEDHN
CC(C(=O)N1CC[C@H]([C@@H](C)NCc2ccccc2C#N)C1)=C1CCC1	ZINC001047840522	1347386374	/nfs/dbraw/zinc/38/63/74/1347386374.db2.gz	KKZSKBWIFWQCAH-UZLBHIALSA-N	0	3	337.467	3.385	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]([C@@H](C)NCc2nc(C)sc2C)C1	ZINC001047924915	1347411634	/nfs/dbraw/zinc/41/16/34/1347411634.db2.gz	RGPGMLCWOYHZJR-DOMZBBRYSA-N	0	3	335.517	3.299	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]([C@@H](C)NCc2nc(C)sc2C)C1	ZINC001047924917	1347411846	/nfs/dbraw/zinc/41/18/46/1347411846.db2.gz	RGPGMLCWOYHZJR-IUODEOHRSA-N	0	3	335.517	3.299	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]([C@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001047931525	1347414411	/nfs/dbraw/zinc/41/44/11/1347414411.db2.gz	KFBQKDBUSFPZMM-HOCLYGCPSA-N	0	3	343.446	3.236	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]([C@@H](C)NCc2nc3ccccc3o2)C1	ZINC001047933261	1347414918	/nfs/dbraw/zinc/41/49/18/1347414918.db2.gz	WWKVAXGYKPGSTD-CABCVRRESA-N	0	3	341.455	3.367	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]([C@H](C)NCc3nc(C)c(C)s3)C2)C1	ZINC001047964703	1347426571	/nfs/dbraw/zinc/42/65/71/1347426571.db2.gz	BPQSHJJSBUUYIT-HOCLYGCPSA-N	0	3	347.528	3.443	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]([C@H](C)NCc3nc(C)cs3)C2)C1	ZINC001047972038	1347430219	/nfs/dbraw/zinc/43/02/19/1347430219.db2.gz	OKOHNPZQWXBBQI-LSDHHAIUSA-N	0	3	333.501	3.134	20	30		EGEDHN
Cc1cccc(C(=O)N2C[C@@H](CNCc3ccccc3C#N)[C@H](C)C2)c1	ZINC001048121733	1347473950	/nfs/dbraw/zinc/47/39/50/1347473950.db2.gz	HWNWRWFNDLWVFN-DYESRHJHSA-N	0	3	347.462	3.365	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H](C)[C@@H](CNCc3nccs3)C2)CC1	ZINC001048370338	1347533003	/nfs/dbraw/zinc/53/30/03/1347533003.db2.gz	ROOGLNAZDBKYAR-HOCLYGCPSA-N	0	3	333.501	3.074	20	30		EGEDHN
C[C@H]1CN(C(=O)C2(C)CC=CC2)C[C@@H]1CNCc1ccccc1C#N	ZINC001048374232	1347534717	/nfs/dbraw/zinc/53/47/17/1347534717.db2.gz	OXTILXZYFVNPTD-LPHOPBHVSA-N	0	3	337.467	3.099	20	30		EGEDHN
CCC1(C(=O)N2C[C@@H](C)[C@@H](CNCc3cc(F)ccc3C#N)C2)CC1	ZINC001048379468	1347536982	/nfs/dbraw/zinc/53/69/82/1347536982.db2.gz	PJORIBOFKILXKU-PBHICJAKSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)[C@@H]2CC[C@@H](F)C2)CC1	ZINC001048626677	1347624421	/nfs/dbraw/zinc/62/44/21/1347624421.db2.gz	SVEFYOUUPYMCNH-IAGOWNOFSA-N	0	3	345.462	3.199	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)C2CC(C)(C)C2)CC1	ZINC001048628513	1347624960	/nfs/dbraw/zinc/62/49/60/1347624960.db2.gz	ZRJHZUIFQXPQRZ-UHFFFAOYSA-N	0	3	341.499	3.497	20	30		EGEDHN
C=C(C)CN1CCC(N(Cc2ccccn2)C(=O)[C@@H]2C[C@H]2CC)CC1	ZINC001048629026	1347625363	/nfs/dbraw/zinc/62/53/63/1347625363.db2.gz	NMVZLYBYKFGXCW-YLJYHZDGSA-N	0	3	341.499	3.497	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2C[C@H]3CN(C/C=C\Cl)C[C@H]3C2)cc1	ZINC001048899114	1347680369	/nfs/dbraw/zinc/68/03/69/1347680369.db2.gz	JNZVOOSSUGTZKT-CGNDGYEGSA-N	0	3	346.858	3.008	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CN([C@H](C)c3ccccc3F)C[C@H]2C1	ZINC001048977689	1347696632	/nfs/dbraw/zinc/69/66/32/1347696632.db2.gz	IQVCGXPFBLCIQL-OAGGEKHMSA-N	0	3	330.447	3.489	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CN(Cc3ccc(C)c(F)c3)C[C@H]2C1	ZINC001048982489	1347697277	/nfs/dbraw/zinc/69/72/77/1347697277.db2.gz	RVNLATHPVORLLJ-CALCHBBNSA-N	0	3	330.447	3.237	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CN(Cc3ccc(F)cc3)C[C@H]2C1	ZINC001049026386	1347709809	/nfs/dbraw/zinc/70/98/09/1347709809.db2.gz	OCSBLPWRXNALDC-QKLQHJQFSA-N	0	3	330.447	3.318	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3c4ccccc4oc3CC)C[C@@H]2C1	ZINC001049236153	1347752852	/nfs/dbraw/zinc/75/28/52/1347752852.db2.gz	DCMOJQRWOLFFQR-IYBDPMFKSA-N	0	3	336.435	3.022	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049344852	1347798975	/nfs/dbraw/zinc/79/89/75/1347798975.db2.gz	RDAMEYWQOHYKAP-IPELMVKDSA-N	0	3	325.456	3.170	20	30		EGEDHN
C#CCCN1C[C@@H](C)[C@H](NC(=O)c2csc3cc(C)ccc23)C1	ZINC001079768935	1357376389	/nfs/dbraw/zinc/37/63/89/1357376389.db2.gz	TZMHRSRWCLLFOA-RHSMWYFYSA-N	0	3	326.465	3.283	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1oc(CC2CC2)nc1C	ZINC001049470942	1347864572	/nfs/dbraw/zinc/86/45/72/1347864572.db2.gz	URYUBEZYAVQWJS-IAGOWNOFSA-N	0	3	343.471	3.191	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)[C@@H]1CC[C@H](c2ccccc2)O1	ZINC001049480804	1347869976	/nfs/dbraw/zinc/86/99/76/1347869976.db2.gz	QJYBYBHSYSQAHG-WCIQWLHISA-N	0	3	340.467	3.158	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H]1CCCN2C(=O)CC(C)(C)c1ccc(F)cc1	ZINC001049522586	1347890832	/nfs/dbraw/zinc/89/08/32/1347890832.db2.gz	RGWXQOYQGDVUIB-MOPGFXCFSA-N	0	3	342.458	3.192	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1oc(C(F)F)cc1C	ZINC001049535739	1347896952	/nfs/dbraw/zinc/89/69/52/1347896952.db2.gz	JLKQXFIQLCMQRH-ZIAGYGMSSA-N	0	3	336.382	3.228	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(-c2cnco2)cc1	ZINC001049554376	1347906155	/nfs/dbraw/zinc/90/61/55/1347906155.db2.gz	CHQBHECJXYRXGS-ROUUACIJSA-N	0	3	337.423	3.207	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1cccc(C(C)C)c1	ZINC001049567947	1347914104	/nfs/dbraw/zinc/91/41/04/1347914104.db2.gz	QNMHLAHVOYWSGG-NHCUHLMSSA-N	0	3	338.495	3.441	20	30		EGEDHN
C=CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1scnc1C(F)F	ZINC001049590304	1347925559	/nfs/dbraw/zinc/92/55/59/1347925559.db2.gz	ZSWAQEUWIXVTRS-NEPJUHHUSA-N	0	3	341.427	3.336	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H]1C[C@]1(C)c1ccccc1	ZINC001049612634	1347935631	/nfs/dbraw/zinc/93/56/31/1347935631.db2.gz	UXFCTGCCGDPLDL-GPQLQYNLSA-N	0	3	336.479	3.053	20	30		EGEDHN
CC1(C(=O)N2CCC[C@@H]3[C@@H]2CCN3Cc2ccc(C#N)cc2)CCC1	ZINC001049644282	1347951534	/nfs/dbraw/zinc/95/15/34/1347951534.db2.gz	ICSOMEKZLFLDDZ-MOPGFXCFSA-N	0	3	337.467	3.314	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc2cc(OC)ccc2[nH]1	ZINC001049682983	1347970593	/nfs/dbraw/zinc/97/05/93/1347970593.db2.gz	YVWPSJDXWQMIDO-RTBURBONSA-N	0	3	339.439	3.041	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1c(F)cccc1F	ZINC001049706477	1347983573	/nfs/dbraw/zinc/98/35/73/1347983573.db2.gz	IYSQMYAPIIWTES-DTTOXWODSA-N	0	3	346.421	3.320	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049734558	1347993787	/nfs/dbraw/zinc/99/37/87/1347993787.db2.gz	FHZSSVGKNKOMNL-UAFMIMERSA-N	0	3	337.467	3.170	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C1[C@@H]2CCCCCC[C@@H]12	ZINC001049749268	1347999249	/nfs/dbraw/zinc/99/92/49/1347999249.db2.gz	QXXZHLMYJPIYMY-AKHDSKFASA-N	0	3	328.500	3.291	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](CC)Oc1ccccc1C	ZINC001049757938	1348004312	/nfs/dbraw/zinc/00/43/12/1348004312.db2.gz	DRVPSSVRHMWONJ-GUDVDZBRSA-N	0	3	342.483	3.404	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(OCC)c(C)c1	ZINC001049762431	1348007109	/nfs/dbraw/zinc/00/71/09/1348007109.db2.gz	OWTRWJCOTQERGL-RBUKOAKNSA-N	0	3	340.467	3.096	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1cccc(C#N)c1	ZINC001049766806	1348010821	/nfs/dbraw/zinc/01/08/21/1348010821.db2.gz	DWWKBNZJEVPUKC-VDGAXYAQSA-N	0	3	339.483	3.416	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C[C@H](C)c1ccccc1F	ZINC001049788941	1348022609	/nfs/dbraw/zinc/02/26/09/1348022609.db2.gz	SMBLGTPLIZQQES-PWIZWCRZSA-N	0	3	342.458	3.408	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cccc(OC(C)C)n1	ZINC001049827794	1348043525	/nfs/dbraw/zinc/04/35/25/1348043525.db2.gz	LYLGMNXFWHYSJA-ROUUACIJSA-N	0	3	343.471	3.124	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cnn(C2CCCCC2)c1	ZINC001049830617	1348044897	/nfs/dbraw/zinc/04/48/97/1348044897.db2.gz	HHHYLEYMHJUIEN-RBUKOAKNSA-N	0	3	342.487	3.253	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc2c(s1)CCOC2	ZINC001049856515	1348064032	/nfs/dbraw/zinc/06/40/32/1348064032.db2.gz	ZLDXXUNOADXOFM-HZPDHXFCSA-N	0	3	346.496	3.076	20	30		EGEDHN
CC(C)(C)C(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1cccc(C#N)c1	ZINC001049859912	1348066717	/nfs/dbraw/zinc/06/67/17/1348066717.db2.gz	XXSUUTRXXHCJLJ-QZTJIDSGSA-N	0	3	325.456	3.170	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(OC(C)C)cc1	ZINC001049871539	1348076711	/nfs/dbraw/zinc/07/67/11/1348076711.db2.gz	MFZMNUSGKSKGQD-OALUTQOASA-N	0	3	328.456	3.339	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(C)nc2ccccc21	ZINC001049871552	1348077345	/nfs/dbraw/zinc/07/73/45/1348077345.db2.gz	MLLLMXVKJLCLPW-VQTJNVASSA-N	0	3	335.451	3.408	20	30		EGEDHN
Cc1c[nH]cc1C(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049889519	1348094683	/nfs/dbraw/zinc/09/46/83/1348094683.db2.gz	GPESKWREOWPKKF-WOJBJXKFSA-N	0	3	348.450	3.074	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1sc(C(C)C)nc1C	ZINC001049891498	1348096163	/nfs/dbraw/zinc/09/61/63/1348096163.db2.gz	UNAXRYUZVMPDSX-HOTGVXAUSA-N	0	3	345.512	3.277	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(C)n(C(C)(C)C)n1	ZINC001049899761	1348100011	/nfs/dbraw/zinc/10/00/11/1348100011.db2.gz	GQYKTXLEHUBLAV-MSOLQXFVSA-N	0	3	344.503	3.202	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C[C@H](C)c1ccc(F)cc1	ZINC001049913350	1348108604	/nfs/dbraw/zinc/10/86/04/1348108604.db2.gz	WFQQUZXLLNDMKM-PWIZWCRZSA-N	0	3	342.458	3.408	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cnc(C(C)(C)C)s1	ZINC001049922758	1348114737	/nfs/dbraw/zinc/11/47/37/1348114737.db2.gz	RNMABJIKYHCTSD-HUUCEWRRSA-N	0	3	345.512	3.143	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cccnc1OC(C)C	ZINC001049936751	1348122190	/nfs/dbraw/zinc/12/21/90/1348122190.db2.gz	XMYODYDLZOUPRW-ZWKOTPCHSA-N	0	3	343.471	3.124	20	30		EGEDHN
C[C@H](c1cccc(F)c1)N1C[C@@H]2CCCN(C(=O)C#CC3CC3)[C@@H]2C1	ZINC001050046332	1348164609	/nfs/dbraw/zinc/16/46/09/1348164609.db2.gz	WXQZDDAFBUOQFB-MOXGXCLJSA-N	0	3	340.442	3.223	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)Cc3c(C)cccc3Cl)[C@@H]2C1	ZINC001050085302	1348176855	/nfs/dbraw/zinc/17/68/55/1348176855.db2.gz	CKZZZARBDVOTPV-MAUKXSAKSA-N	0	3	332.875	3.300	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3cc(F)c(F)cc3F)[C@@H]2C1	ZINC001050129815	1348191342	/nfs/dbraw/zinc/19/13/42/1348191342.db2.gz	ZFMXHDYAHRCYAH-YVEFUNNKSA-N	0	3	338.373	3.216	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cc(C)n(CC4CC4)c3C)[C@@H]2C1	ZINC001050184184	1348204946	/nfs/dbraw/zinc/20/49/46/1348204946.db2.gz	NZWYLCYGQWAXCE-AZUAARDMSA-N	0	3	341.499	3.237	20	30		EGEDHN
Cc1ccc(C(=O)N2CC3(C2)CCN(Cc2cccc(C#N)c2)CC3)o1	ZINC001050423097	1348260980	/nfs/dbraw/zinc/26/09/80/1348260980.db2.gz	FUUKPFSPLHRVAK-UHFFFAOYSA-N	0	3	349.434	3.198	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)[C@H]4[C@@H]5CCC[C@@H]54)C3)CC2)c1	ZINC001050476824	1348275049	/nfs/dbraw/zinc/27/50/49/1348275049.db2.gz	MZFAZDOKZKIZEN-PMOLBWCYSA-N	0	3	349.478	3.029	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3oc(C(F)F)cc3C)C2)CC1	ZINC001050550565	1348288119	/nfs/dbraw/zinc/28/81/19/1348288119.db2.gz	NEFOPXCKBFXSAR-UHFFFAOYSA-N	0	3	336.382	3.087	20	30		EGEDHN
CC1(CC(=O)N2CC3(C2)CCN(Cc2cccc(C#N)c2)CC3)CC1	ZINC001050593516	1348296024	/nfs/dbraw/zinc/29/60/24/1348296024.db2.gz	STDSNKWUBKNLDX-UHFFFAOYSA-N	0	3	337.467	3.173	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)C4CC5(CC5)C4)C3)CC2)c1	ZINC001050659549	1348320433	/nfs/dbraw/zinc/32/04/33/1348320433.db2.gz	UOOFMGPZAIAJTR-UHFFFAOYSA-N	0	3	349.478	3.173	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@H](C)c3cccc(Cl)c3)C2)CC1	ZINC001050758915	1348350073	/nfs/dbraw/zinc/35/00/73/1348350073.db2.gz	BEMKQANAYYFEFD-OAHLLOKOSA-N	0	3	330.859	3.001	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)C3(C(F)(F)F)CCCCC3)C2)CC1	ZINC001050770065	1348354587	/nfs/dbraw/zinc/35/45/87/1348354587.db2.gz	QFABWDQCGHJIKH-UHFFFAOYSA-N	0	3	342.405	3.057	20	30		EGEDHN
C=CCN1CCc2c(CNC(=O)c3[nH]nc4ccccc43)cccc2C1	ZINC001051306982	1348428628	/nfs/dbraw/zinc/42/86/28/1348428628.db2.gz	ZUMZCARLBRDGOR-UHFFFAOYSA-N	0	3	346.434	3.037	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cc(C)nn2C(CC)CC)CC1	ZINC001052506318	1348561566	/nfs/dbraw/zinc/56/15/66/1348561566.db2.gz	ACGQPKFZBRNQIO-KRWDZBQOSA-N	0	3	344.503	3.160	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)Cc2cccc(C)c2Cl)CC1	ZINC001052555401	1348577573	/nfs/dbraw/zinc/57/75/73/1348577573.db2.gz	RELFMIUXEZSCAB-QGZVFWFLSA-N	0	3	332.875	3.185	20	30		EGEDHN
C[C@@]1(C(=O)N[C@H]2CCCN(Cc3cccc(C#N)c3)CC2)C=CCC1	ZINC001052636649	1348605473	/nfs/dbraw/zinc/60/54/73/1348605473.db2.gz	VPERLFROWCWZDJ-PZJWPPBQSA-N	0	3	337.467	3.385	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@H]2CCCN(C/C=C/Cl)CC2)cc1	ZINC001052772661	1348673183	/nfs/dbraw/zinc/67/31/83/1348673183.db2.gz	BRYLINZWOJAALH-ITHMCKDVSA-N	0	3	346.858	3.035	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc(C(F)F)cc2F)CC1	ZINC001052822963	1348690674	/nfs/dbraw/zinc/69/06/74/1348690674.db2.gz	WFWKQDMXLXLFTJ-AWEZNQCLSA-N	0	3	338.373	3.371	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2cc(Cl)ccc2Cl)CC1	ZINC001052891721	1348728831	/nfs/dbraw/zinc/72/88/31/1348728831.db2.gz	ZWODFFKPKBGNMD-CYBMUJFWSA-N	0	3	325.239	3.211	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)C2CCC(C(F)F)CC2)CC1	ZINC001052904510	1348738134	/nfs/dbraw/zinc/73/81/34/1348738134.db2.gz	SMPKVYLKEIFLHH-UYSNPLJNSA-N	0	3	326.431	3.052	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)Cc2coc3cc(C)ccc23)CC1	ZINC001052916364	1348746892	/nfs/dbraw/zinc/74/68/92/1348746892.db2.gz	LBHLYDQAHRHWBB-SFHVURJKSA-N	0	3	338.451	3.278	20	30		EGEDHN
CCC(=O)N1CCC[C@@H]([C@@H]2CCCN(Cc3ccc(C#N)s3)C2)C1	ZINC001052996495	1348793092	/nfs/dbraw/zinc/79/30/92/1348793092.db2.gz	JIJNFUAMFMZPMM-HZPDHXFCSA-N	0	3	345.512	3.480	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)Cc2cccs2)C1	ZINC001053060894	1348870295	/nfs/dbraw/zinc/87/02/95/1348870295.db2.gz	KFDXEPLOEKLVKW-FUHWJXTLSA-N	0	3	330.497	3.017	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cc(C)oc2C)C1	ZINC001053067407	1348880221	/nfs/dbraw/zinc/88/02/21/1348880221.db2.gz	RCPRARORQFNJDN-IEBWSBKVSA-N	0	3	328.456	3.236	20	30		EGEDHN
C#CCC[N@H+]1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001053068856	1348882340	/nfs/dbraw/zinc/88/23/40/1348882340.db2.gz	WPGWXARDWZOXDE-MJGOQNOKSA-N	0	3	340.467	3.122	20	30		EGEDHN
C#CCC[N@@H+]1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001053068856	1348882343	/nfs/dbraw/zinc/88/23/43/1348882343.db2.gz	WPGWXARDWZOXDE-MJGOQNOKSA-N	0	3	340.467	3.122	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(C)nc2)C1	ZINC001053070384	1348884785	/nfs/dbraw/zinc/88/47/85/1348884785.db2.gz	YEQDVWFABTZWQG-UXHICEINSA-N	0	3	339.483	3.120	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccoc2Cl)C1	ZINC001053082104	1348902825	/nfs/dbraw/zinc/90/28/25/1348902825.db2.gz	ZBLFRROOXBYLHQ-GDBMZVCRSA-N	0	3	334.847	3.273	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)Cc2ccccc2)C1	ZINC001053088494	1348913208	/nfs/dbraw/zinc/91/32/08/1348913208.db2.gz	WJHFHDRDLQYOQT-RTWAWAEBSA-N	0	3	338.495	3.346	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)CC(C)(F)F)C1	ZINC001053097593	1348927842	/nfs/dbraw/zinc/92/78/42/1348927842.db2.gz	HFPYZMCMACXEHB-HOTGVXAUSA-N	0	3	326.431	3.148	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ncccc2Cl)C1	ZINC001053103953	1348938425	/nfs/dbraw/zinc/93/84/25/1348938425.db2.gz	MARMGOHBEIXESN-WBVHZDCISA-N	0	3	345.874	3.075	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)Cc2ccccc2C)C1	ZINC001053104116	1348939620	/nfs/dbraw/zinc/93/96/20/1348939620.db2.gz	CBWYOZVHLBXUEM-SFTDATJTSA-N	0	3	338.495	3.264	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cc(F)cc(F)c2)C1	ZINC001053106612	1348944498	/nfs/dbraw/zinc/94/44/98/1348944498.db2.gz	UWESKCJEYTUATR-HNAYVOBHSA-N	0	3	346.421	3.305	20	30		EGEDHN
C=C(C)CCN1Cc2ccccc2C[C@@H]1CNC(=O)c1ccc(C#N)[nH]1	ZINC001054038718	1349134366	/nfs/dbraw/zinc/13/43/66/1349134366.db2.gz	KDULXPRZPLXFBV-LJQANCHMSA-N	0	3	348.450	3.009	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)CCc1ccc(C)cc1)C2	ZINC001054161961	1349164119	/nfs/dbraw/zinc/16/41/19/1349164119.db2.gz	TYBBVONBLMGKAR-JOCHJYFZSA-N	0	3	338.495	3.265	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1nccc3ccccc31)C2	ZINC001054185757	1349188426	/nfs/dbraw/zinc/18/84/26/1349188426.db2.gz	IIZNYABLTPICJY-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1cccc(Cl)c1F)C2	ZINC001054186457	1349189394	/nfs/dbraw/zinc/18/93/94/1349189394.db2.gz	SRYVFKWHDUSMHX-SFHVURJKSA-N	0	3	334.822	3.040	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(Cl)cc1C)C2	ZINC001054188783	1349191818	/nfs/dbraw/zinc/19/18/18/1349191818.db2.gz	UNPFOPABHJAIFD-IBGZPJMESA-N	0	3	330.859	3.210	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1c(C)cccc1Cl)C2	ZINC001054189850	1349192689	/nfs/dbraw/zinc/19/26/89/1349192689.db2.gz	VFJFEMGYLLSMJD-IBGZPJMESA-N	0	3	330.859	3.210	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cccc3c1ccn3C)C2	ZINC001054214895	1349214136	/nfs/dbraw/zinc/21/41/36/1349214136.db2.gz	IRJDOBLISRLFNC-QFIPXVFZSA-N	0	3	349.478	3.130	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)C[C@@H](C)c1ccccc1F)C2	ZINC001054215209	1349214553	/nfs/dbraw/zinc/21/45/53/1349214553.db2.gz	PHHKHIHLZCTZHQ-DYESRHJHSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1[nH]c3ccc(C)cc3c1C)C2	ZINC001054223505	1349218594	/nfs/dbraw/zinc/21/85/94/1349218594.db2.gz	WCDYXIHQHGTBQV-QFIPXVFZSA-N	0	3	349.478	3.346	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H](C)c1ccc(C)s1)C2	ZINC001054227110	1349220749	/nfs/dbraw/zinc/22/07/49/1349220749.db2.gz	IEWCGQLMVGDMIT-FXAWDEMLSA-N	0	3	344.524	3.498	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)CCc1ccccc1F)C2	ZINC001054238609	1349232485	/nfs/dbraw/zinc/23/24/85/1349232485.db2.gz	ZFWIGSNCRJDRIR-OAQYLSRUSA-N	0	3	342.458	3.096	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)C[C@H](C)c1ccc(F)cc1)C2	ZINC001054243820	1349237990	/nfs/dbraw/zinc/23/79/90/1349237990.db2.gz	OPXVOEYJLOVWAH-UWJYYQICSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1c[nH]c3c1cccc3CC)C2	ZINC001054245066	1349238936	/nfs/dbraw/zinc/23/89/36/1349238936.db2.gz	NYNJSMNWARQNGT-QFIPXVFZSA-N	0	3	349.478	3.292	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3cc(C#N)c[nH]3)cc2C1	ZINC001054260410	1349257060	/nfs/dbraw/zinc/25/70/60/1349257060.db2.gz	MRGMHEOCUFGUOZ-UHFFFAOYSA-N	0	3	334.423	3.098	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@@H]3CCCO[C@@H]3C)cc2C1	ZINC001054262203	1349259492	/nfs/dbraw/zinc/25/94/92/1349259492.db2.gz	OOABTKBHMGFIJS-OXQOHEQNSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@H]3CCC[C@H]3OC)cc2C1	ZINC001054271606	1349271397	/nfs/dbraw/zinc/27/13/97/1349271397.db2.gz	SISGOPZZJKCJQO-VQTJNVASSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cncc4[nH]ccc43)cc2C1	ZINC001054273133	1349272632	/nfs/dbraw/zinc/27/26/32/1349272632.db2.gz	WIESFYAKSGZFPS-UHFFFAOYSA-N	0	3	346.434	3.385	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@@H]3C[C@H]3c3cccnc3)cc2C1	ZINC001054283627	1349285272	/nfs/dbraw/zinc/28/52/72/1349285272.db2.gz	LZDWSSJBOHXDSE-LEWJYISDSA-N	0	3	347.462	3.393	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC(C)(C)C)C[C@@H]1NCc1ccc(C#N)c(F)c1	ZINC001054387250	1349344485	/nfs/dbraw/zinc/34/44/85/1349344485.db2.gz	CIJSUMHAORIFSM-DYVFJYSZSA-N	0	3	331.435	3.070	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CC(C)(C)C2)C[C@H]1NCc1ccc(C#N)c(F)c1	ZINC001054617075	1349415883	/nfs/dbraw/zinc/41/58/83/1349415883.db2.gz	CBYZRBGYKHQZEM-FZKQIMNGSA-N	0	3	343.446	3.070	20	30		EGEDHN
Cc1sccc1C(=O)N1C[C@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001054626739	1349420675	/nfs/dbraw/zinc/42/06/75/1349420675.db2.gz	CUZVVWMNKKHWLL-MEDUHNTESA-N	0	3	345.493	3.240	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2cc(F)c3ncccc3c2)C1	ZINC001080633735	1357709359	/nfs/dbraw/zinc/70/93/59/1357709359.db2.gz	QFCKWVCMADJYDQ-CXAGYDPISA-N	0	3	327.403	3.000	20	30		EGEDHN
CN(C)C1(C)CN(C(=O)C[C@@H](C#N)c2c(Cl)cccc2Cl)C1	ZINC001183105644	1387263887	/nfs/dbraw/zinc/26/38/87/1387263887.db2.gz	FTKASKDSYAUPGP-NSHDSACASA-N	0	3	340.254	3.153	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCO[C@H]1C1CCN(C(=O)[C@@H](C)C(C)C)CC1	ZINC001071091373	1354453781	/nfs/dbraw/zinc/45/37/81/1354453781.db2.gz	BAYTVUVMYFZABV-UAGQMJEPSA-N	0	3	342.911	3.017	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C1=CCCCCC1)C[C@H](C)O2	ZINC001071161299	1354482535	/nfs/dbraw/zinc/48/25/35/1354482535.db2.gz	IADILRHCHZAYMW-PXNSSMCTSA-N	0	3	332.488	3.145	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1cc(C)sc1C)C[C@H](C)O2	ZINC001071185356	1354491468	/nfs/dbraw/zinc/49/14/68/1354491468.db2.gz	FCOAKMCIQXCEAA-IFXJQAMLSA-N	0	3	348.512	3.246	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1ccc(C)cc1C)C[C@H](C)O2	ZINC001071236289	1354521159	/nfs/dbraw/zinc/52/11/59/1354521159.db2.gz	SOIXBNUCRAQBSI-GHTZIAJQSA-N	0	3	342.483	3.185	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)CC(C1CC1)C1CC1)C[C@H](C)O2	ZINC001071244345	1354524908	/nfs/dbraw/zinc/52/49/08/1354524908.db2.gz	SYNUMJYMHVBGIW-KKSFZXQISA-N	0	3	346.515	3.081	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1c(C)cccc1F)C[C@H](C)O2	ZINC001071245867	1354525696	/nfs/dbraw/zinc/52/56/96/1354525696.db2.gz	KYQCLAQTEBCTHQ-OXJNMPFZSA-N	0	3	346.446	3.016	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H]3C[C@H]3CC(C)(C)C)C2)CC1	ZINC001086923818	1359249720	/nfs/dbraw/zinc/24/97/20/1359249720.db2.gz	BSOTXIQSUWFFQK-OKZBNKHCSA-N	0	3	330.516	3.395	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2ccc(OC)cc2C)CC[C@@H]1C	ZINC001071530874	1354749905	/nfs/dbraw/zinc/74/99/05/1354749905.db2.gz	BWJXRZJVIQLXEO-WMZOPIPTSA-N	0	3	330.472	3.091	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc3cc(C)cn3c2)CC[C@H]1C	ZINC001071558191	1354763520	/nfs/dbraw/zinc/76/35/20/1354763520.db2.gz	ZKCHNMLFDGSFOG-AEFFLSMTSA-N	0	3	325.456	3.407	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc3oc(C)nc3c2)CC[C@H]1C	ZINC001071602105	1354788891	/nfs/dbraw/zinc/78/88/91/1354788891.db2.gz	GWOXIWBYZAFMHL-CJNGLKHVSA-N	0	3	327.428	3.295	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N[C@H]1CC[C@H](C)N(CCCF)C1	ZINC001071619532	1354802375	/nfs/dbraw/zinc/80/23/75/1354802375.db2.gz	PXZGVQBKAZVNKK-HOTGVXAUSA-N	0	3	334.435	3.194	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2coc3cc(F)ccc23)CC[C@@H]1C	ZINC001071631647	1354814060	/nfs/dbraw/zinc/81/40/60/1354814060.db2.gz	PQSIFXVLQHLMFJ-DZGCQCFKSA-N	0	3	328.387	3.178	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(C(F)(F)F)cn2)CC[C@@H]1C	ZINC001071721171	1354878421	/nfs/dbraw/zinc/87/84/21/1354878421.db2.gz	MZKHHUVNVRJXFW-GXTWGEPZSA-N	0	3	341.377	3.259	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2cccc3cccnc32)CC[C@H]1C	ZINC001071725095	1354882235	/nfs/dbraw/zinc/88/22/35/1354882235.db2.gz	QFRQEYJDISTWPV-APWZRJJASA-N	0	3	337.467	3.323	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc3nc(C)n(C)c3c2)CC[C@H]1C	ZINC001071738476	1354888763	/nfs/dbraw/zinc/88/87/63/1354888763.db2.gz	CWAHCQUCHQYDIZ-RHSMWYFYSA-N	0	3	340.471	3.041	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2c(F)ccc(F)c2F)CC[C@@H]1C	ZINC001071784097	1354932353	/nfs/dbraw/zinc/93/23/53/1354932353.db2.gz	YNTMQQKIGFFQTA-RYUDHWBXSA-N	0	3	326.362	3.263	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc(-n3cccc3)ccn2)CC[C@H]1C	ZINC001071966549	1355049087	/nfs/dbraw/zinc/04/90/87/1355049087.db2.gz	FWUZMWRKABAABQ-SJORKVTESA-N	0	3	338.455	3.031	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc3ncsc3c2)CC[C@H]1C	ZINC001072043869	1355099972	/nfs/dbraw/zinc/09/99/72/1355099972.db2.gz	FWSSBEWAKWPFCV-UKRRQHHQSA-N	0	3	329.469	3.455	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(OCC(C)C)cc2)CC[C@H]1C	ZINC001072049033	1355103629	/nfs/dbraw/zinc/10/36/29/1355103629.db2.gz	NNKYKULGABFQEY-MJGOQNOKSA-N	0	3	342.483	3.327	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(C(C)(F)F)cc2)CC[C@H]1C	ZINC001072124211	1355142324	/nfs/dbraw/zinc/14/23/24/1355142324.db2.gz	YOUMUTYGRUWCLH-RHSMWYFYSA-N	0	3	334.410	3.404	20	30		EGEDHN
C[C@@H]1CCN(C(=O)C(C)(C)F)C[C@@H]1CNCc1cc(F)ccc1C#N	ZINC001072156133	1355157049	/nfs/dbraw/zinc/15/70/49/1355157049.db2.gz	KUMVMOGMZOJIIB-CJNGLKHVSA-N	0	3	349.425	3.020	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](C)[C@@H](CNCc2cnc(C)o2)C1	ZINC001072334511	1355243709	/nfs/dbraw/zinc/24/37/09/1355243709.db2.gz	CIPBDPRVJNDLMH-HOCLYGCPSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](C)[C@@H](CNCc2csc(C)n2)C1	ZINC001072334926	1355244046	/nfs/dbraw/zinc/24/40/46/1355244046.db2.gz	JULJUIQVCUAAKO-HIFRSBDPSA-N	0	3	335.517	3.238	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CN(C(=O)CC4CCCC4)C3)C2)cc1	ZINC001072416482	1355280043	/nfs/dbraw/zinc/28/00/43/1355280043.db2.gz	JYMZYVWLZPWNSA-UHFFFAOYSA-N	0	3	337.467	3.173	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@@H]3CCCC[C@@H]3C(F)(F)F)C2)C1	ZINC001072857002	1355468084	/nfs/dbraw/zinc/46/80/84/1355468084.db2.gz	FHGOKDVZYURXRF-KGLIPLIRSA-N	0	3	330.394	3.075	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CN(C(=O)[C@@H]4CC[C@H]5C[C@H]5C4)C3)C2)cc1	ZINC001072878934	1355479899	/nfs/dbraw/zinc/47/98/99/1355479899.db2.gz	HUZUVWRXZWLHRH-ZCNNSNEGSA-N	0	3	349.478	3.029	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C[C@H](C)c3ccc(CC)cc3)C2)C1	ZINC001072976130	1355532135	/nfs/dbraw/zinc/53/21/35/1355532135.db2.gz	RJOAMEXBJYQXCZ-SFHVURJKSA-N	0	3	338.495	3.300	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2cc3ccccc3s2)C1	ZINC001073680956	1355864233	/nfs/dbraw/zinc/86/42/33/1355864233.db2.gz	AEMAKKPSDMKBNX-MRXNPFEDSA-N	0	3	344.480	3.298	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CN(CC3=CCCCC3)CCCO2)CC1	ZINC001073755711	1355890523	/nfs/dbraw/zinc/89/05/23/1355890523.db2.gz	HVVFRQDIWZEGNV-HXUWFJFHSA-N	0	3	346.515	3.440	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2cccc3ccccc32)C1	ZINC001073874174	1355931001	/nfs/dbraw/zinc/93/10/01/1355931001.db2.gz	VMCNSXPCPMDTGO-GOSISDBHSA-N	0	3	338.451	3.237	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2sccc2C(F)F)C1	ZINC001073873587	1355931466	/nfs/dbraw/zinc/93/14/66/1355931466.db2.gz	FLKFNUSDRNUTRQ-LBPRGKRZSA-N	0	3	344.427	3.083	20	30		EGEDHN
CCCC(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(OC)c(C#N)c1	ZINC001073928565	1355962983	/nfs/dbraw/zinc/96/29/83/1355962983.db2.gz	IAKOWXGYGTXROS-GOSISDBHSA-N	0	3	343.471	3.180	20	30		EGEDHN
CS[C@H](C)C(=O)N1CCCC[C@@H]1CN(C)Cc1cccc(C#N)c1	ZINC001073954657	1355991042	/nfs/dbraw/zinc/99/10/42/1355991042.db2.gz	ZWYMTOYJEZOBMR-CRAIPNDOSA-N	0	3	345.512	3.123	20	30		EGEDHN
Cc1cc(CN(C)C[C@H]2CCCCN2C(=O)[C@H](C)C#N)c(C)s1	ZINC001073970497	1356003131	/nfs/dbraw/zinc/00/31/31/1356003131.db2.gz	QYHCQCUQCMCABJ-CXAGYDPISA-N	0	3	333.501	3.338	20	30		EGEDHN
CN(Cc1ccccc1)C[C@H]1CCCCN1C(=O)c1cc(C#N)c[nH]1	ZINC001073984427	1356013763	/nfs/dbraw/zinc/01/37/63/1356013763.db2.gz	LPLTYSPJPIZCAW-GOSISDBHSA-N	0	3	336.439	3.013	20	30		EGEDHN
C#CCCN1C[C@@H](C)[C@H](NC(=O)c2ccc(Cl)cc2Cl)C1	ZINC001080833290	1357747788	/nfs/dbraw/zinc/74/77/88/1357747788.db2.gz	BFMUEEMXEWDURW-IAQYHMDHSA-N	0	3	325.239	3.067	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCCN1C(=O)[C@H]1CC12CC2	ZINC001074072199	1356066901	/nfs/dbraw/zinc/06/69/01/1356066901.db2.gz	SOKSWARVVGIQGM-RTBURBONSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cccc(-n4cccc4)c3)[C@@H]2C1	ZINC001076001705	1356463826	/nfs/dbraw/zinc/46/38/26/1356463826.db2.gz	ACIYNMCQQJDFNG-AZUAARDMSA-N	0	3	335.451	3.200	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cc(Cl)cc(OC)c3)[C@@H]2C1	ZINC001076386087	1356564869	/nfs/dbraw/zinc/56/48/69/1356564869.db2.gz	ADGPLPOEHBASMK-SUMWQHHRSA-N	0	3	334.847	3.071	20	30		EGEDHN
C=CCCN1C[C@@H]2CCN(C(=O)c3sc(CC4CC4)nc3C)[C@@H]2C1	ZINC001076404204	1356571007	/nfs/dbraw/zinc/57/10/07/1356571007.db2.gz	JOJKBYSVZLVVSZ-JKSUJKDBSA-N	0	3	345.512	3.126	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccc(OC)c(C4CC4)c3)[C@@H]2C1	ZINC001076408551	1356571974	/nfs/dbraw/zinc/57/19/74/1356571974.db2.gz	QNQHLLHFHQFZOX-PKOBYXMFSA-N	0	3	340.467	3.295	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H](c1ccccc1)N(C)C	ZINC001099349608	1363766006	/nfs/dbraw/zinc/76/60/06/1363766006.db2.gz	QOUPHNDOHVDWJD-RTBURBONSA-N	0	3	343.515	3.082	20	30		EGEDHN
C=CCC1(C(=O)NC[C@H]2CCC(C)(C)CN2CCO)CCCCC1	ZINC001099349381	1363766278	/nfs/dbraw/zinc/76/62/78/1363766278.db2.gz	QDMBIRHAKZEUNX-QGZVFWFLSA-N	0	3	336.520	3.112	20	30		EGEDHN
C#CCCN1C[C@@H](C)[C@H](NC(=O)c2coc3ccc(Cl)cc23)C1	ZINC001080867275	1357753505	/nfs/dbraw/zinc/75/35/05/1357753505.db2.gz	XSARCERRPYRAQD-MLGOLLRUSA-N	0	3	330.815	3.160	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)C2=CCCC2)C12CCC2	ZINC001078588561	1357022614	/nfs/dbraw/zinc/02/26/14/1357022614.db2.gz	DBVQWIPKAFBNGC-UONOGXRCSA-N	0	3	339.277	3.022	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cncc(CC)c2)C12CCC2	ZINC001078683720	1357053538	/nfs/dbraw/zinc/05/35/38/1357053538.db2.gz	VXCHUWXEFODRJH-HOTGVXAUSA-N	0	3	333.863	3.027	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2cc[nH]c2CCC)C12CCC2	ZINC001078704732	1357062515	/nfs/dbraw/zinc/06/25/15/1357062515.db2.gz	BRQBMHSQXCHUNM-HZPDHXFCSA-N	0	3	335.879	3.350	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2C[C@H](NCc3conc3C)C23CCC3)CC1	ZINC001078716656	1357063060	/nfs/dbraw/zinc/06/30/60/1357063060.db2.gz	WGPVOSIBAAXOLO-ZWKOTPCHSA-N	0	3	343.471	3.246	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@@H]1CN(Cc2ccc(C)cc2)C[C@H]1C	ZINC001080851560	1357752441	/nfs/dbraw/zinc/75/24/41/1357752441.db2.gz	PQNJOEOFSXDFNW-XMSQKQJNSA-N	0	3	346.474	3.156	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C2(C)C(C)(C)C2(C)C)C[C@H]1c1ccccc1	ZINC001081236092	1357852038	/nfs/dbraw/zinc/85/20/38/1357852038.db2.gz	SBUBXBZKZTXOMX-ZWKOTPCHSA-N	0	3	338.495	3.276	20	30		EGEDHN
C[C@H](C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1)C1CCC1	ZINC001082586546	1358060222	/nfs/dbraw/zinc/06/02/22/1358060222.db2.gz	BJCQQXNXKWMRHX-BIENJYKASA-N	0	3	343.446	3.070	20	30		EGEDHN
C=C1CCC(C(=O)N2CCO[C@@H]3CN(CCC4CCCC4)C[C@@H]32)CC1	ZINC001083183946	1358123019	/nfs/dbraw/zinc/12/30/19/1358123019.db2.gz	GVMJMIIYLNMRMQ-VQTJNVASSA-N	0	3	346.515	3.225	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1C[C@H]2CCN(CCc3ccc4ccccc4c3)C[C@H]21	ZINC001084233223	1358167948	/nfs/dbraw/zinc/16/79/48/1358167948.db2.gz	XUCZJTWNRNUDMT-ZLGUVYLKSA-N	0	3	347.462	3.075	20	30		EGEDHN
CC(C)c1ccccc1CN1CC[C@@H]2CN(C(=O)[C@@H](C)C#N)[C@@H]2C1	ZINC001084231735	1358168760	/nfs/dbraw/zinc/16/87/60/1358168760.db2.gz	JVOPGELVTXEIGV-KVSKMBFKSA-N	0	3	325.456	3.002	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3cc4cccc(OC)c4o3)[C@@H]2C1	ZINC001084618149	1358256805	/nfs/dbraw/zinc/25/68/05/1358256805.db2.gz	DUEUICNRRQTMNZ-HZPDHXFCSA-N	0	3	340.423	3.164	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CCN(CC3CC(F)(F)C3)C[C@H]21	ZINC001084635256	1358263041	/nfs/dbraw/zinc/26/30/41/1358263041.db2.gz	TZMDLYDVEREEGX-BFYDXBDKSA-N	0	3	326.431	3.167	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)c3cc(C)nc4ccccc43)[C@@H]2C1	ZINC001084812313	1358316698	/nfs/dbraw/zinc/31/66/98/1358316698.db2.gz	ZHDOHGDGMVXLTP-OXQOHEQNSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H]2CCN(Cc3scnc3C)[C@H]2C1	ZINC001085024165	1358370551	/nfs/dbraw/zinc/37/05/51/1358370551.db2.gz	ZPIWVPQGHGMPCC-JTDSTZFVSA-N	0	3	347.528	3.477	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@H](CC)Cc3ccccc3)C[C@@H]21	ZINC001085047287	1358377815	/nfs/dbraw/zinc/37/78/15/1358377815.db2.gz	HMEXADRMWNUMAB-ZCNNSNEGSA-N	0	3	326.484	3.364	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@H](CC)c3ccc(F)cc3)C[C@@H]21	ZINC001085103392	1358391873	/nfs/dbraw/zinc/39/18/73/1358391873.db2.gz	OACATSQKBSGKEY-RLLQIKCJSA-N	0	3	342.458	3.265	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@]3(C)CCc4ccccc4C3)C[C@@H]21	ZINC001085109949	1358394075	/nfs/dbraw/zinc/39/40/75/1358394075.db2.gz	VNMSXEJVELJWRA-KAGYGMCKSA-N	0	3	338.495	3.290	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@@H]2CCCC[C@H]2NC(=O)c2ccco2)c1	ZINC001085120085	1358399191	/nfs/dbraw/zinc/39/91/91/1358399191.db2.gz	STOHKXPCKGQHSO-IAGOWNOFSA-N	0	3	341.386	3.121	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cc(C(C)(C)C)on1	ZINC001085270534	1358447943	/nfs/dbraw/zinc/44/79/43/1358447943.db2.gz	JHYDONWKBRXHFR-CHWSQXEVSA-N	0	3	339.867	3.355	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)Cn1ccc2ccccc21	ZINC001085427450	1358496811	/nfs/dbraw/zinc/49/68/11/1358496811.db2.gz	DTWDXJOEBAUDOE-IAGOWNOFSA-N	0	3	345.874	3.411	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc(C(C)(C)C)cn1	ZINC001085600139	1358625901	/nfs/dbraw/zinc/62/59/01/1358625901.db2.gz	LQKVEHXDXKDUBW-QGZVFWFLSA-N	0	3	329.488	3.492	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1c(F)ccc2ccncc21	ZINC001085610013	1358630164	/nfs/dbraw/zinc/63/01/64/1358630164.db2.gz	HHBHPKPTXJUUOV-OAHLLOKOSA-N	0	3	327.403	3.096	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1cn(C)c2ccc(F)cc12	ZINC001085644178	1358657374	/nfs/dbraw/zinc/65/73/74/1358657374.db2.gz	HXKRDWVUMISBEN-OAHLLOKOSA-N	0	3	329.419	3.040	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1cc2c([nH]1)c(F)ccc2C	ZINC001085684170	1358685813	/nfs/dbraw/zinc/68/58/13/1358685813.db2.gz	LJQVTRKZQULJRE-CQSZACIVSA-N	0	3	329.419	3.338	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1sccc1-n1cccc1	ZINC001085752175	1358732801	/nfs/dbraw/zinc/73/28/01/1358732801.db2.gz	YJRANVVLZGUYQF-OAHLLOKOSA-N	0	3	329.469	3.261	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)[C@@H]1C[C@H]1c1c(F)cccc1F	ZINC001085805361	1358780870	/nfs/dbraw/zinc/78/08/70/1358780870.db2.gz	DVIINXJKUFCYNJ-RRFJBIMHSA-N	0	3	334.410	3.177	20	30		EGEDHN
C#Cc1cncc(C(=O)N(C)C[C@H]2CCN2CCC2CCCCC2)c1	ZINC001085809829	1358788890	/nfs/dbraw/zinc/78/88/90/1358788890.db2.gz	ONTPOYKMRWMUNU-HXUWFJFHSA-N	0	3	339.483	3.180	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@H]1CCc2cccc(OC)c21	ZINC001085859564	1358826806	/nfs/dbraw/zinc/82/68/06/1358826806.db2.gz	DMXIQUILGIUINQ-ROUUACIJSA-N	0	3	342.483	3.224	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc2c(c1)C[C@H](C)O2	ZINC001085875393	1358839207	/nfs/dbraw/zinc/83/92/07/1358839207.db2.gz	ZKOYKZGWQSBJCF-MAUKXSAKSA-N	0	3	328.456	3.123	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1cccc(C(F)(F)F)c1	ZINC001085942090	1358900118	/nfs/dbraw/zinc/90/01/18/1358900118.db2.gz	XZBBXOOUGRNFNV-HNNXBMFYSA-N	0	3	326.362	3.428	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1ccc(N(CC)CC)cc1	ZINC001085943957	1358903561	/nfs/dbraw/zinc/90/35/61/1358903561.db2.gz	VZUHAUIBFXMSEB-LJQANCHMSA-N	0	3	329.488	3.255	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@H]1Cc2ccc(Cl)cc21	ZINC001085951348	1358907528	/nfs/dbraw/zinc/90/75/28/1358907528.db2.gz	DLXJEAXXSXRBSJ-AEFFLSMTSA-N	0	3	332.875	3.479	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc(Cl)ccc1OC	ZINC001085959149	1358916653	/nfs/dbraw/zinc/91/66/53/1358916653.db2.gz	ULBYWUHYTNWOLV-OAHLLOKOSA-N	0	3	336.863	3.461	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1	ZINC001085995852	1358951056	/nfs/dbraw/zinc/95/10/56/1358951056.db2.gz	WRZYHLZDXNFOMR-CEXWTWQISA-N	0	3	330.447	3.428	20	30		EGEDHN
CCCCC(=O)N1CC[C@@H](CNCc2cc(F)ccc2C#N)[C@@H](C)C1	ZINC001183899480	1387368862	/nfs/dbraw/zinc/36/88/62/1387368862.db2.gz	POBWSJHWVSTOQC-RDJZCZTQSA-N	0	3	345.462	3.462	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cccc(OCCC)c2)C1	ZINC001086101174	1358997920	/nfs/dbraw/zinc/99/79/20/1358997920.db2.gz	CSUNKVIZCHOLIJ-FZNQNYSPSA-N	0	3	336.863	3.326	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc(C)c(F)cc2F)C1	ZINC001086118635	1359001558	/nfs/dbraw/zinc/00/15/58/1359001558.db2.gz	HYPRSXADWOOQQB-TXEJJXNPSA-N	0	3	328.790	3.124	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@H]2CC[C@@H](C(F)(F)F)C2)C1	ZINC001086178180	1359016191	/nfs/dbraw/zinc/01/61/91/1359016191.db2.gz	WGKKABZBUKYCCI-WUHRBBMRSA-N	0	3	338.801	3.202	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc3cccc(OC)c3o2)C1	ZINC001086181602	1359017833	/nfs/dbraw/zinc/01/78/33/1359017833.db2.gz	JHQUOOKQPCHSTK-XBXGTLAGSA-N	0	3	348.830	3.292	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2C[C@@H](NCc3c(C)noc3CC)C2)CC1	ZINC001086187605	1359020802	/nfs/dbraw/zinc/02/08/02/1359020802.db2.gz	FYQFHVAMVTWLAP-WOVMCDHWSA-N	0	3	345.487	3.276	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(Cl)c(OC)c2)C1	ZINC001086216274	1359030168	/nfs/dbraw/zinc/03/01/68/1359030168.db2.gz	OMJHMKLQGKBSKM-BJHJDKERSA-N	0	3	343.254	3.199	20	30		EGEDHN
C[C@@H]1CC[C@@H](C(=O)NC[C@H]2C[C@@H](NCc3ccc(C#N)cc3F)C2)C1	ZINC001086216241	1359030521	/nfs/dbraw/zinc/03/05/21/1359030521.db2.gz	NKJYMTZVCXFYRD-IIVZCXTMSA-N	0	3	343.446	3.118	20	30		EGEDHN
CC[C@]1(C)C[C@@H]1C(=O)NC[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001086240067	1359037203	/nfs/dbraw/zinc/03/72/03/1359037203.db2.gz	POTZGHVHJQJRBF-XNWPKKHHSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)C2CCC=CCC2)C1	ZINC001086274276	1359050633	/nfs/dbraw/zinc/05/06/33/1359050633.db2.gz	ZPLMKTVGHDVHCZ-OTVXOJSOSA-N	0	3	341.293	3.126	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@H](CNC(=O)c3cccs3)C2)c1	ZINC001086297775	1359060049	/nfs/dbraw/zinc/06/00/49/1359060049.db2.gz	WPTPLYOACXRGIV-CTYIDZIISA-N	0	3	343.427	3.057	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc(C)c3ccccc3n2)C1	ZINC001086403239	1359088369	/nfs/dbraw/zinc/08/83/69/1359088369.db2.gz	BLGDFZIWAVCURU-SHTZXODSSA-N	0	3	343.858	3.394	20	30		EGEDHN
CC1(C)CC[C@H]1C(=O)NC[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001086451633	1359100644	/nfs/dbraw/zinc/10/06/44/1359100644.db2.gz	RGZGOGDJWWJVNQ-XIRDDKMYSA-N	0	3	343.446	3.118	20	30		EGEDHN
CC[C@@]1(C)C[C@@H]1C(=O)NC[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001086521139	1359129248	/nfs/dbraw/zinc/12/92/48/1359129248.db2.gz	POTZGHVHJQJRBF-OYRIPWCXSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc(F)c(F)cc2Cl)C1	ZINC001086546248	1359140396	/nfs/dbraw/zinc/14/03/96/1359140396.db2.gz	AWRZZTQJMBSNLM-MGCOHNPYSA-N	0	3	349.208	3.469	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)C=C2CCCCC2)C1	ZINC001086577322	1359153468	/nfs/dbraw/zinc/15/34/68/1359153468.db2.gz	FWCGSNBOJZWPKS-LEWJYISDSA-N	0	3	336.479	3.484	20	30		EGEDHN
C=CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2oc(C)nc2C)C1	ZINC001086579798	1359154272	/nfs/dbraw/zinc/15/42/72/1359154272.db2.gz	YBYHYDDANWHTTK-ZWKOTPCHSA-N	0	3	339.439	3.065	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)CC2CC(C)(C)C2)C1	ZINC001086605853	1359162636	/nfs/dbraw/zinc/16/26/36/1359162636.db2.gz	YKSOKXRKVKSUAP-VQTJNVASSA-N	0	3	338.495	3.420	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)[C@H]2CCC(C)(C)C2)C1	ZINC001086608577	1359163197	/nfs/dbraw/zinc/16/31/97/1359163197.db2.gz	PBZGRPNUBOLKMC-SLFFLAALSA-N	0	3	338.495	3.420	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cccc(COC)c2)C1	ZINC001086747971	1359194564	/nfs/dbraw/zinc/19/45/64/1359194564.db2.gz	AMJPMYRJAACUIJ-WMLDXEAASA-N	0	3	336.863	3.074	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2c(C)cc(C)nc2C)C1	ZINC001086763684	1359196898	/nfs/dbraw/zinc/19/68/98/1359196898.db2.gz	XMRGUTWZFNXODN-JKSUJKDBSA-N	0	3	335.879	3.247	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)[C@H]2CCCCC2(F)F)C1	ZINC001086766967	1359197601	/nfs/dbraw/zinc/19/76/01/1359197601.db2.gz	RLYCNLLKSFMBAB-BFHYXJOUSA-N	0	3	334.838	3.439	20	30		EGEDHN
CC1(C)CC[C@H]1C(=O)NC[C@H]1CC[C@@H](NCc2ccccc2C#N)C1	ZINC001086782039	1359199926	/nfs/dbraw/zinc/19/99/26/1359199926.db2.gz	LTJBXLJGKYQXTP-IPELMVKDSA-N	0	3	339.483	3.369	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccc3c(c2)C[C@H](C)O3)C1	ZINC001086829683	1359209741	/nfs/dbraw/zinc/20/97/41/1359209741.db2.gz	LBYMMQMBJAANHU-GRDNDAEWSA-N	0	3	348.874	3.251	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccc3cccnc3c2)C1	ZINC001086831912	1359210289	/nfs/dbraw/zinc/21/02/89/1359210289.db2.gz	UJRHUCYDRQYMQO-WMLDXEAASA-N	0	3	343.858	3.475	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cc3ccccc3[nH]2)C1	ZINC001086871130	1359217870	/nfs/dbraw/zinc/21/78/70/1359217870.db2.gz	NSRSQQMEVPFFCU-DZGCQCFKSA-N	0	3	331.847	3.409	20	30		EGEDHN
CCC(=O)N1CC2(C[C@H]1C)CCN(Cc1cccc(C#N)c1)CC2	ZINC001086893206	1359222802	/nfs/dbraw/zinc/22/28/02/1359222802.db2.gz	JNRQAWYVSUOUMR-MRXNPFEDSA-N	0	3	325.456	3.171	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)/C=C/c3ccco3)C2)CC1	ZINC001086898133	1359227457	/nfs/dbraw/zinc/22/74/57/1359227457.db2.gz	BEKUIVOBWBNCJM-IWAYRVGRSA-N	0	3	326.440	3.019	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc(F)cc3)C2)CC1	ZINC001086898381	1359228281	/nfs/dbraw/zinc/22/82/81/1359228281.db2.gz	HFXVFYZJYAROJJ-INIZCTEOSA-N	0	3	328.431	3.166	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3oc(C)cc3C)C2)CC1	ZINC001086914050	1359241399	/nfs/dbraw/zinc/24/13/99/1359241399.db2.gz	DNOZWXKMPBBJKG-INIZCTEOSA-N	0	3	328.456	3.236	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3oc(C)cc3C)C2)CC1	ZINC001086914051	1359241680	/nfs/dbraw/zinc/24/16/80/1359241680.db2.gz	DNOZWXKMPBBJKG-MRXNPFEDSA-N	0	3	328.456	3.236	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3cc(C(C)C)on3)C2)CC1	ZINC001086934844	1359258187	/nfs/dbraw/zinc/25/81/87/1359258187.db2.gz	BUMRDNPDGBFNPD-INIZCTEOSA-N	0	3	343.471	3.138	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)Cc3cccc(Cl)c3)C2)CC1	ZINC001086940471	1359262137	/nfs/dbraw/zinc/26/21/37/1359262137.db2.gz	RRRUFQDQAIPSDY-INIZCTEOSA-N	0	3	344.886	3.219	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3nccc4ccccc43)C2)CC1	ZINC001086940091	1359262245	/nfs/dbraw/zinc/26/22/45/1359262245.db2.gz	HWAUZCNFNOLNBA-KRWDZBQOSA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3cc(C)ccc3F)C2)CC1	ZINC001086945181	1359266630	/nfs/dbraw/zinc/26/66/30/1359266630.db2.gz	UKVXRZNEQARLCA-KRWDZBQOSA-N	0	3	342.458	3.474	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc(OC)cc3)C2)CC1	ZINC001086954932	1359275571	/nfs/dbraw/zinc/27/55/71/1359275571.db2.gz	YPYBOSCIGDOWJK-QGZVFWFLSA-N	0	3	340.467	3.035	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)Cc3cccc(F)c3)C2)CC1	ZINC001086955863	1359276752	/nfs/dbraw/zinc/27/67/52/1359276752.db2.gz	YCTMRMMRVJKTEN-KRWDZBQOSA-N	0	3	342.458	3.095	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H](C)c3cccc(F)c3)C2)CC1	ZINC001086957287	1359278028	/nfs/dbraw/zinc/27/80/28/1359278028.db2.gz	JJWYWONSHXBTPN-SJORKVTESA-N	0	3	342.458	3.265	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccc(C#N)s1	ZINC001087112289	1359290581	/nfs/dbraw/zinc/29/05/81/1359290581.db2.gz	SSHXYTIEJLEGCF-CABCVRRESA-N	0	3	333.501	3.383	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](CNCc2oc(CCC)nc2C)[C@H](C)C1	ZINC001184078438	1387388624	/nfs/dbraw/zinc/38/86/24/1387388624.db2.gz	OMJTVASKSIYDQF-WBVHZDCISA-N	0	3	347.503	3.476	20	30		EGEDHN
CC1(C)[C@H](NC(=O)C2CC2)[C@@H]2CCCN(Cc3cccc(C#N)c3)[C@H]21	ZINC001087266376	1359336701	/nfs/dbraw/zinc/33/67/01/1359336701.db2.gz	KVSFIHGJDZXRAK-IPMKNSEASA-N	0	3	337.467	3.073	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccsc1C	ZINC001087286509	1359364884	/nfs/dbraw/zinc/36/48/84/1359364884.db2.gz	RVHCYMUGGRLRKY-IXDOHACOSA-N	0	3	330.497	3.299	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc2cc(C)cn2c1	ZINC001087290101	1359369576	/nfs/dbraw/zinc/36/95/76/1359369576.db2.gz	XEVBRBLXWZJQED-HSALFYBXSA-N	0	3	349.478	3.100	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)Cc3ccc(C)cc3)C(C)(C)[C@H]21	ZINC001087294763	1359375301	/nfs/dbraw/zinc/37/53/01/1359375301.db2.gz	XXBKNCNMKDCAHE-NRSPTQNISA-N	0	3	338.495	3.166	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccn2ccccc12	ZINC001087295567	1359377130	/nfs/dbraw/zinc/37/71/30/1359377130.db2.gz	KYURKNVBXAIXFW-YZGWKJHDSA-N	0	3	349.478	3.181	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc(Cl)c(F)c1	ZINC001087305422	1359390579	/nfs/dbraw/zinc/39/05/79/1359390579.db2.gz	SEDYMEMIRVPIRK-XOKHGSTOSA-N	0	3	348.849	3.331	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cccc2ccncc21	ZINC001087311152	1359398924	/nfs/dbraw/zinc/39/89/24/1359398924.db2.gz	JRYOLOZFBZBZFL-YZGWKJHDSA-N	0	3	347.462	3.087	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc4c(C)cccn4c3)C(C)(C)[C@H]21	ZINC001087312416	1359400769	/nfs/dbraw/zinc/40/07/69/1359400769.db2.gz	DZJBSAFAIJZGPY-RLLQIKCJSA-N	0	3	349.478	3.100	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc(C)c(CC)s1	ZINC001087317806	1359409100	/nfs/dbraw/zinc/40/91/00/1359409100.db2.gz	NEKDKSDALUNABR-FHLIZLRMSA-N	0	3	344.524	3.471	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)C34CC(C(C)(C)C)(C3)C4)C(C)(C)[C@H]21	ZINC001087318748	1359410784	/nfs/dbraw/zinc/41/07/84/1359410784.db2.gz	CBQHIWQFIQRGIM-WKUAPKQTSA-N	0	3	342.527	3.441	20	30		EGEDHN
CC(C)=CC(=O)N1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1CC#Cc1ccccc1	ZINC001087331847	1359421690	/nfs/dbraw/zinc/42/16/90/1359421690.db2.gz	CFROXNKEFXMGIA-CBPXPLCBSA-N	0	3	348.490	3.173	20	30		EGEDHN
C=C(C)CCN1CC[C@H](c2ccccc2)[C@H](NC(=O)c2cocn2)C1	ZINC001087423517	1359459412	/nfs/dbraw/zinc/45/94/12/1359459412.db2.gz	CYOCFBMYWNLYOJ-QZTJIDSGSA-N	0	3	339.439	3.229	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)c2cc[nH]c2CC)C1	ZINC001087426993	1359461580	/nfs/dbraw/zinc/46/15/80/1359461580.db2.gz	HFKKGSLDLWMMBY-WIYYLYMNSA-N	0	3	349.478	3.188	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)[C@H]2CC23CCC3)C1	ZINC001087438567	1359465643	/nfs/dbraw/zinc/46/56/43/1359465643.db2.gz	FLIHXPZTKKZPEP-VAMGGRTRSA-N	0	3	336.479	3.174	20	30		EGEDHN
C=CCCN1CC[C@H](c2cccc(F)c2)[C@H](NC(=O)[C@H]2C[C@@H]2C)C1	ZINC001087457189	1359475459	/nfs/dbraw/zinc/47/54/59/1359475459.db2.gz	MQQCJLVAYJMSQC-KLIQENQMSA-N	0	3	330.447	3.332	20	30		EGEDHN
C=CCCN1CC[C@H](c2ccc(F)cc2)[C@H](NC(=O)C(C)(C)F)C1	ZINC001087461278	1359477565	/nfs/dbraw/zinc/47/75/65/1359477565.db2.gz	ABNCYHVMTPFFEN-IAGOWNOFSA-N	0	3	336.426	3.424	20	30		EGEDHN
C=CCCN1CC[C@H](c2ccc(F)cc2)[C@H](NC(=O)[C@@H]2C[C@H]2C)C1	ZINC001087466745	1359479698	/nfs/dbraw/zinc/47/96/98/1359479698.db2.gz	ITMKJSFGCFCZFY-UTRMSSBJSA-N	0	3	330.447	3.332	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)c2c[nH]c(C#N)c2)CCN1C/C=C\c1ccccc1	ZINC001087548675	1359526459	/nfs/dbraw/zinc/52/64/59/1359526459.db2.gz	IVCMJMCROXNKRI-JRDMDSSDSA-N	0	3	348.450	3.182	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)C[C@H]2CCOc3ccccc32)[C@H]1CC	ZINC001087685875	1359587958	/nfs/dbraw/zinc/58/79/58/1359587958.db2.gz	CUEGECPKXWOFSX-BPQIPLTHSA-N	0	3	328.456	3.098	20	30		EGEDHN
N#Cc1cccnc1NCCNCc1c(Cl)ccc2cccnc21	ZINC001323621790	1387409095	/nfs/dbraw/zinc/40/90/95/1387409095.db2.gz	QZCTYVGGDHTCDF-UHFFFAOYSA-N	0	3	337.814	3.357	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CN(C(=O)[C@]45C[C@H]4CCC5)C[C@@H]3C2)cc1	ZINC001088047818	1359734910	/nfs/dbraw/zinc/73/49/10/1359734910.db2.gz	UZPFWTCHICDCLP-XAPVIXHLSA-N	0	3	349.478	3.029	20	30		EGEDHN
C[C@]1(C(=O)N2C[C@H]3CCN(Cc4ccc(C#N)cc4)C[C@H]3C2)C=CCC1	ZINC001088071532	1359744380	/nfs/dbraw/zinc/74/43/80/1359744380.db2.gz	MBTCEBDOZCLHDD-URVUXULASA-N	0	3	349.478	3.195	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)C[C@H](C)c3ccccc3C)C[C@@H]2C1	ZINC001088128929	1359766886	/nfs/dbraw/zinc/76/68/86/1359766886.db2.gz	PAVNPXOZWRERNC-ZCNNSNEGSA-N	0	3	338.495	3.292	20	30		EGEDHN
C=CCN1CC[C@@H](OCC2CCN(C(=O)[C@H](C)C3CCCC3)CC2)C1	ZINC001088240428	1359811495	/nfs/dbraw/zinc/81/14/95/1359811495.db2.gz	YQUZXXWSHYVYMU-YLJYHZDGSA-N	0	3	348.531	3.328	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2ccc3[nH]ccc3n2)C1	ZINC001088346331	1359833700	/nfs/dbraw/zinc/83/37/00/1359833700.db2.gz	MHWYMTRVNRKAGE-AWEZNQCLSA-N	0	3	346.862	3.290	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCCCC[C@H](NCc2cnoc2C)C1	ZINC001088358863	1359842214	/nfs/dbraw/zinc/84/22/14/1359842214.db2.gz	LSUCOIWOQVFKRY-KRWDZBQOSA-N	0	3	333.476	3.446	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2ccc3n[nH]cc3c2)C1	ZINC001088369870	1359853122	/nfs/dbraw/zinc/85/31/22/1359853122.db2.gz	UNSVCFKESPHBPX-MRXNPFEDSA-N	0	3	346.862	3.290	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2ccn(C)c2CC)C1	ZINC001088381527	1359865493	/nfs/dbraw/zinc/86/54/93/1359865493.db2.gz	GQIXBZCUHQAUQE-HNNXBMFYSA-N	0	3	337.895	3.314	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2cc(C3CC3)n[nH]2)C1	ZINC001088388213	1359866894	/nfs/dbraw/zinc/86/68/94/1359866894.db2.gz	PLYKNHNNHMIEEH-AWEZNQCLSA-N	0	3	336.867	3.014	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)[C@H](OC)C2CCCC2)C1	ZINC001088419521	1359889233	/nfs/dbraw/zinc/88/92/33/1359889233.db2.gz	RVHLWVFTBNECFD-DLBZAZTESA-N	0	3	342.911	3.305	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)Cc2csc(C)n2)C1	ZINC001088422443	1359892212	/nfs/dbraw/zinc/89/22/12/1359892212.db2.gz	QDTQIGQTYJTSOD-AWEZNQCLSA-N	0	3	341.908	3.107	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2ccc(C)nc2C)C1	ZINC001088430613	1359898315	/nfs/dbraw/zinc/89/83/15/1359898315.db2.gz	UEOOGWMPJMWYPL-INIZCTEOSA-N	0	3	335.879	3.425	20	30		EGEDHN
CC/C(C)=C/C(=O)N1CC[C@H](CNCc2ccccc2C#N)[C@@H](C)C1	ZINC001184328051	1387430908	/nfs/dbraw/zinc/43/09/08/1387430908.db2.gz	KXQITFOKKPYVTF-SLRHEHJISA-N	0	3	339.483	3.489	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3ccccc3N(C)C)[C@@H]2C)C1	ZINC001088840012	1360073855	/nfs/dbraw/zinc/07/38/55/1360073855.db2.gz	QAJZDLLTDCUITM-AEFFLSMTSA-N	0	3	341.499	3.188	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)Cc2ccccc2OC(C)C)[C@H]1C	ZINC001088919665	1360103151	/nfs/dbraw/zinc/10/31/51/1360103151.db2.gz	UINNISGUQOJEOE-AEFFLSMTSA-N	0	3	330.472	3.171	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cccc(-c3cnco3)c2)[C@H]1C	ZINC001088952549	1360113129	/nfs/dbraw/zinc/11/31/29/1360113129.db2.gz	XBEVINOVEGGFSO-PBHICJAKSA-N	0	3	325.412	3.110	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cnn(C3CCCCC3)c2)[C@H]1C	ZINC001088963285	1360118170	/nfs/dbraw/zinc/11/81/70/1360118170.db2.gz	ZOVDXTVBGKTAJX-QAPCUYQASA-N	0	3	330.476	3.157	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccc(COC(C)C)cc2)[C@H]1C	ZINC001089031751	1360142631	/nfs/dbraw/zinc/14/26/31/1360142631.db2.gz	BNVOZWUMZSAIKO-APWZRJJASA-N	0	3	330.472	3.380	20	30		EGEDHN
CCCC(=O)N1CCCC[C@H]1CN(C)Cc1ccc(OC)c(C#N)c1	ZINC001089102831	1360168441	/nfs/dbraw/zinc/16/84/41/1360168441.db2.gz	IAKOWXGYGTXROS-SFHVURJKSA-N	0	3	343.471	3.180	20	30		EGEDHN
CCC(=O)N[C@H]1CCN(Cc2ccc(OC)c(C#N)c2)CC(C)(C)C1	ZINC001089283255	1360301910	/nfs/dbraw/zinc/30/19/10/1360301910.db2.gz	IULPVIJMXVVRPV-KRWDZBQOSA-N	0	3	343.471	3.084	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2c(C)noc2CCC)CC(C)(C)C1	ZINC001089381792	1360384440	/nfs/dbraw/zinc/38/44/40/1360384440.db2.gz	NYPQRYHSVUFFJN-INIZCTEOSA-N	0	3	345.487	3.179	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc(C)c(F)cc2F)CC(C)(C)C1	ZINC001089418336	1360411535	/nfs/dbraw/zinc/41/15/35/1360411535.db2.gz	NPZJKTVKZCQTIA-AWEZNQCLSA-N	0	3	334.410	3.127	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3ncccc3o2)CC(C)(C)C1	ZINC001089439371	1360429465	/nfs/dbraw/zinc/42/94/65/1360429465.db2.gz	FCMKYQIONRUWNM-OAHLLOKOSA-N	0	3	339.439	3.072	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@H](C)c2c(F)cccc2F)CC(C)(C)C1	ZINC001089440478	1360430754	/nfs/dbraw/zinc/43/07/54/1360430754.db2.gz	AMOCIOSOLCPLPG-CABCVRRESA-N	0	3	348.437	3.308	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc3ccc(C)cc3[nH]2)CC(C)(C)C1	ZINC001089453189	1360440546	/nfs/dbraw/zinc/44/05/46/1360440546.db2.gz	KSSLXEDGQXNHCG-QGZVFWFLSA-N	0	3	337.467	3.330	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2nccc3ccccc32)CC(C)(C)C1	ZINC001089476509	1360459010	/nfs/dbraw/zinc/45/90/10/1360459010.db2.gz	ODPLWKBDYHSMTF-SFHVURJKSA-N	0	3	349.478	3.479	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc(F)c2F)CC(C)(C)C1	ZINC001089478848	1360461276	/nfs/dbraw/zinc/46/12/76/1360461276.db2.gz	WCNPXDGFFAFHLN-AWEZNQCLSA-N	0	3	334.410	3.209	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc3sccc3[nH]2)CC(C)(C)C1	ZINC001089535978	1360495287	/nfs/dbraw/zinc/49/52/87/1360495287.db2.gz	ZHOMFZKTGQUEHJ-CYBMUJFWSA-N	0	3	329.469	3.083	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc(CC)c(CC)o2)CC(C)(C)C1	ZINC001089540729	1360498272	/nfs/dbraw/zinc/49/82/72/1360498272.db2.gz	XATYNVRLRJUELA-INIZCTEOSA-N	0	3	330.472	3.258	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2sc(C)nc2C)CC(C)(C)C1	ZINC001089554027	1360505160	/nfs/dbraw/zinc/50/51/60/1360505160.db2.gz	CTRTZHAWPUMNNW-HNNXBMFYSA-N	0	3	333.501	3.004	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C(C)(C)c2ccccc2)CC(C)(C)C1	ZINC001089554880	1360506124	/nfs/dbraw/zinc/50/61/24/1360506124.db2.gz	FMIUEWPIVHMDBW-SFHVURJKSA-N	0	3	326.484	3.204	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2nc(C)c(C)s2)CC(C)(C)C1	ZINC001089557949	1360506870	/nfs/dbraw/zinc/50/68/70/1360506870.db2.gz	DMZOCOSWFMHVFR-HNNXBMFYSA-N	0	3	333.501	3.004	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(C)cc(C)n1	ZINC001089660116	1360571748	/nfs/dbraw/zinc/57/17/48/1360571748.db2.gz	FAXKEFCWHMFNOO-KRWDZBQOSA-N	0	3	329.488	3.495	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccccc1COC	ZINC001089664627	1360574878	/nfs/dbraw/zinc/57/48/78/1360574878.db2.gz	NOCYBNPUHYDJLY-QGZVFWFLSA-N	0	3	330.472	3.239	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cccc2nccn21	ZINC001089667461	1360577397	/nfs/dbraw/zinc/57/73/97/1360577397.db2.gz	IBBWICTYWKTIKO-MRXNPFEDSA-N	0	3	340.471	3.131	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1nccc2occc21	ZINC001089675617	1360584534	/nfs/dbraw/zinc/58/45/34/1360584534.db2.gz	MBAYQCKZPOQCRE-HNNXBMFYSA-N	0	3	339.439	3.072	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1nc(CC)oc1C	ZINC001089707642	1360610929	/nfs/dbraw/zinc/61/09/29/1360610929.db2.gz	PGHAKKMZSRJQER-HNNXBMFYSA-N	0	3	333.476	3.342	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ncoc1C(C)C	ZINC001089720314	1360622479	/nfs/dbraw/zinc/62/24/79/1360622479.db2.gz	UXDCLCVQHCBOQK-OAHLLOKOSA-N	0	3	331.460	3.042	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cn(C(C)C)nc1C	ZINC001089726106	1360629275	/nfs/dbraw/zinc/62/92/75/1360629275.db2.gz	NAXXYNJGKMSURO-QGZVFWFLSA-N	0	3	344.503	3.016	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)c2ccccc2)C1	ZINC001089759836	1360652607	/nfs/dbraw/zinc/65/26/07/1360652607.db2.gz	DVXBIUFJUGHOPZ-XSLAGTTESA-N	0	3	330.859	3.222	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1ccccc1F	ZINC001089760085	1360652809	/nfs/dbraw/zinc/65/28/09/1360652809.db2.gz	GYDMCNBDRFTFBI-ZDRJDWQYSA-N	0	3	348.849	3.361	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)c2occc2C)C1	ZINC001089774064	1360658596	/nfs/dbraw/zinc/65/85/96/1360658596.db2.gz	SSUKSJNDXYYDSW-VGWMRTNUSA-N	0	3	334.847	3.123	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)c2cc(C)c(C)o2)C1	ZINC001089797165	1360668019	/nfs/dbraw/zinc/66/80/19/1360668019.db2.gz	JXUFMBUBFGVLLH-QAETUUGQSA-N	0	3	348.874	3.431	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1(CC)CCC1	ZINC001089852295	1360698072	/nfs/dbraw/zinc/69/80/72/1360698072.db2.gz	ZZVPUZHJJHRUQY-NXOAAHMSSA-N	0	3	336.907	3.488	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)[C@@H]2C[C@H]2CC(C)(C)C)CC2(CCOCC2)C1	ZINC001089941372	1360755944	/nfs/dbraw/zinc/75/59/44/1360755944.db2.gz	HORUPCVMEXVNLQ-RCCFBDPRSA-N	0	3	348.531	3.232	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](CNCc2csc(C)n2)[C@@H](C)C1	ZINC001184512414	1387480034	/nfs/dbraw/zinc/48/00/34/1387480034.db2.gz	LQLYDEJXYPIACB-HOCLYGCPSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)c2ccc(C)s2)C1	ZINC001090901499	1360949354	/nfs/dbraw/zinc/94/93/54/1360949354.db2.gz	FIERZCGFNFUONN-UHFFFAOYSA-N	0	3	343.290	3.063	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cccc(Cl)c2C)C1	ZINC001091041747	1360984069	/nfs/dbraw/zinc/98/40/69/1360984069.db2.gz	YVHGUMQWEVUDKO-UHFFFAOYSA-N	0	3	327.255	3.499	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C2C3CC4CC(C3)CC2C4)C1	ZINC001091070617	1360988638	/nfs/dbraw/zinc/98/86/38/1360988638.db2.gz	USPIUKCXXXCUNR-UHFFFAOYSA-N	0	3	336.907	3.296	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cccc(Cl)c2F)C1	ZINC001091210818	1361008547	/nfs/dbraw/zinc/00/85/47/1361008547.db2.gz	XOJPCAGTJIMGJH-UHFFFAOYSA-N	0	3	331.218	3.330	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccn(C(CC)CC)n2)C1	ZINC001091266045	1361026540	/nfs/dbraw/zinc/02/65/40/1361026540.db2.gz	RGFHALGPCBFOJW-UHFFFAOYSA-N	0	3	338.883	3.095	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(OC)c(C3CC3)c2)C1	ZINC001091303079	1361036536	/nfs/dbraw/zinc/03/65/36/1361036536.db2.gz	QWNJNHYVRGRJMH-UHFFFAOYSA-N	0	3	348.874	3.423	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)c2cccs2)CC1	ZINC001093352474	1361566881	/nfs/dbraw/zinc/56/68/81/1361566881.db2.gz	JKLBPMZDUPTRFP-KRWDZBQOSA-N	0	3	328.481	3.088	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@@H](C)C(C)(C)C)CC1	ZINC001093372326	1361582175	/nfs/dbraw/zinc/58/21/75/1361582175.db2.gz	CEYQNWGPJDAVSV-AEFFLSMTSA-N	0	3	330.516	3.395	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@H]2CC=CCC2)C[C@H]1CNCc1ccccc1C#N	ZINC001093631511	1361663883	/nfs/dbraw/zinc/66/38/83/1361663883.db2.gz	PIRDJUKHNJNIQE-FUHIMQAGSA-N	0	3	337.467	3.099	20	30		EGEDHN
C[C@@H](C(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1)C(C)(F)F	ZINC001094051490	1361730047	/nfs/dbraw/zinc/73/00/47/1361730047.db2.gz	SMTMYRBEEOLRME-JKIFEVAISA-N	0	3	349.425	3.034	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3ccc(CC)c(CC)c3)CCC[C@@H]12	ZINC001094593168	1361875668	/nfs/dbraw/zinc/87/56/68/1361875668.db2.gz	WRIPNHNXWVHUCX-IFMALSPDSA-N	0	3	338.495	3.419	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1ccc(C(F)F)cc1)C2	ZINC001095749316	1362220658	/nfs/dbraw/zinc/22/06/58/1362220658.db2.gz	DJDJZPYYQZMKQV-IKGGRYGDSA-N	0	3	334.410	3.464	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1sccc1COC)C2	ZINC001096344127	1362468169	/nfs/dbraw/zinc/46/81/69/1362468169.db2.gz	ICXLUQRWVFLLAM-PMPSAXMXSA-N	0	3	334.485	3.196	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(C)c(C)c1Cl)C2	ZINC001096344982	1362469308	/nfs/dbraw/zinc/46/93/08/1362469308.db2.gz	HHGOIRQELOFNQI-PVAVHDDUSA-N	0	3	330.859	3.315	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](CNCc2oc(C)nc2C)[C@H](C)C1	ZINC001184967116	1387575782	/nfs/dbraw/zinc/57/57/82/1387575782.db2.gz	HTTSHKPXKIXTOY-CRAIPNDOSA-N	0	3	345.487	3.059	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc(Cl)ccc1Cl)C2	ZINC001096416767	1362499830	/nfs/dbraw/zinc/49/98/30/1362499830.db2.gz	RDHUGSJOQNSVTB-KCXAZCMYSA-N	0	3	337.250	3.352	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccccc1	ZINC001096434848	1362510820	/nfs/dbraw/zinc/51/08/20/1362510820.db2.gz	LQYJHMAKAZIZMD-FSSWDIPSSA-N	0	3	344.458	3.132	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(-c3cnco3)cc1)C2	ZINC001097346792	1362945120	/nfs/dbraw/zinc/94/51/20/1362945120.db2.gz	NKSTWAGITPUIRO-KURKYZTESA-N	0	3	337.423	3.253	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1ccc(C)cc1Cl)C2	ZINC001097360879	1362951687	/nfs/dbraw/zinc/95/16/87/1362951687.db2.gz	SLDLORQOVVCTCV-NXHRZFHOSA-N	0	3	332.875	3.489	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](CNCc2csc(C)n2)[C@H](C)C1	ZINC001185062892	1387605088	/nfs/dbraw/zinc/60/50/88/1387605088.db2.gz	WOXFIGLRIZXVAD-ZBFHGGJFSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](CNCc2ccccc2C#N)[C@@H](C)C1	ZINC001185061777	1387605201	/nfs/dbraw/zinc/60/52/01/1387605201.db2.gz	PMKVGAJYCIQIBG-PKOBYXMFSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](CNCc3cc(C)no3)[C@@H](C)C2)CC1	ZINC001185094961	1387617497	/nfs/dbraw/zinc/61/74/97/1387617497.db2.gz	MTEKTQPFAFQANB-RDJZCZTQSA-N	0	3	345.487	3.304	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3[C@H](C)c2ccccc2)nc1	ZINC001098245546	1363268416	/nfs/dbraw/zinc/26/84/16/1363268416.db2.gz	QLLIJHYBLBCVDF-SKBHOOIQSA-N	0	3	345.446	3.159	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H]1Cc3ccc(Cl)cc31)C2	ZINC001098305995	1363292532	/nfs/dbraw/zinc/29/25/32/1363292532.db2.gz	SWHGMZFKVWPKKY-SPUZQDLCSA-N	0	3	330.859	3.277	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C(C)(C)c1ccc(OC)cc1)C2	ZINC001098451517	1363328567	/nfs/dbraw/zinc/32/85/67/1363328567.db2.gz	LPCUSVDVPYRHMS-QRQLOZEOSA-N	0	3	342.483	3.270	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](C)c1cccc(OC)c1)C2	ZINC001098465924	1363334091	/nfs/dbraw/zinc/33/40/91/1363334091.db2.gz	LINXISSNTIJLRU-OPNNQBFTSA-N	0	3	328.456	3.096	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1=CCCCCC1)C[C@@H](C)O2	ZINC001098590408	1363390836	/nfs/dbraw/zinc/39/08/36/1363390836.db2.gz	SPVRHTKAHZIFKL-QGZVFWFLSA-N	0	3	332.488	3.145	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccc(CC)s1)C[C@@H](C)O2	ZINC001098614607	1363399816	/nfs/dbraw/zinc/39/98/16/1363399816.db2.gz	USHUUACHYRGQDC-OAHLLOKOSA-N	0	3	348.512	3.192	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)CC1CC(C)(C)C1)C[C@H](C)O2	ZINC001098630186	1363407034	/nfs/dbraw/zinc/40/70/34/1363407034.db2.gz	BZNRILZNUYZYDE-INIZCTEOSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1(C)CCC(C)CC1)C[C@H](C)O2	ZINC001098663984	1363425448	/nfs/dbraw/zinc/42/54/48/1363425448.db2.gz	KRVLJTWKPPQHAS-FDYSRKEFSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccc(CF)cc1)C[C@H](C)O2	ZINC001098664669	1363426044	/nfs/dbraw/zinc/42/60/44/1363426044.db2.gz	VSVDCIFZIPQQQO-INIZCTEOSA-N	0	3	346.446	3.038	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CCC[C@]3(NC(=O)CC3CCC3)C2)c1	ZINC001098768893	1363461868	/nfs/dbraw/zinc/46/18/68/1363461868.db2.gz	ANBJAWCRMQLKIP-FPOVZHCZSA-N	0	3	337.467	3.219	20	30		EGEDHN
C=CCCCNCc1cn([C@H]2CCN(C(=O)CCCCCC)C2)nn1	ZINC001098780473	1363465164	/nfs/dbraw/zinc/46/51/64/1363465164.db2.gz	WMRPNYTXVOJNRX-SFHVURJKSA-N	0	3	347.507	3.078	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(C#N)cc1)C2	ZINC001098796689	1363471572	/nfs/dbraw/zinc/47/15/72/1363471572.db2.gz	ZZAUELBHBHIFBK-UEXGIBASSA-N	0	3	337.467	3.075	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cccc3ccc(C)nc32)C1	ZINC001098896057	1363509659	/nfs/dbraw/zinc/50/96/59/1363509659.db2.gz	MPOSCBPJSZRLGT-AVRDEDQJSA-N	0	3	347.462	3.151	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2cc([C@@H](C)CC)no2)C1	ZINC001099068374	1363606156	/nfs/dbraw/zinc/60/61/56/1363606156.db2.gz	SOXKJCSSVVLAOX-DOXZYTNZSA-N	0	3	331.460	3.349	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2csc(C(C)C)n2)C1	ZINC001099080381	1363612055	/nfs/dbraw/zinc/61/20/55/1363612055.db2.gz	FGPISLDCXYOKIH-KSSFIOAISA-N	0	3	333.501	3.427	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cnn(C3CCCC3)c2C)C1	ZINC001099112999	1363630798	/nfs/dbraw/zinc/63/07/98/1363630798.db2.gz	GLROXGMEWPAAJJ-JXFKEZNVSA-N	0	3	342.487	3.077	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H](C)C(C)(C)C	ZINC001099121281	1363635724	/nfs/dbraw/zinc/63/57/24/1363635724.db2.gz	JXHJLFJDRDGQHL-DLBZAZTESA-N	0	3	338.536	3.478	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(OC(C)C)cc2)C1	ZINC001099147645	1363655355	/nfs/dbraw/zinc/65/53/55/1363655355.db2.gz	MOPNQGZSEZZQNV-PXNSSMCTSA-N	0	3	328.456	3.244	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(C)n(C(C)C)c2C)C1	ZINC001099154911	1363660341	/nfs/dbraw/zinc/66/03/41/1363660341.db2.gz	UQOIAHULBFULJJ-PXNSSMCTSA-N	0	3	329.488	3.456	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(OC3CCC3)cc2)C1	ZINC001099171570	1363669307	/nfs/dbraw/zinc/66/93/07/1363669307.db2.gz	AJVMITLRHQOGPU-UWJYYQICSA-N	0	3	340.467	3.388	20	30		EGEDHN
C#CCCN1C[C@@H]2CCC[C@]2(NC(=O)c2cnc(C(C)(C)C)s2)C1	ZINC001099176466	1363673470	/nfs/dbraw/zinc/67/34/70/1363673470.db2.gz	VLMCPXFUYHGMOI-LIRRHRJNSA-N	0	3	345.512	3.048	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)C1(C(C)C)CC1	ZINC001099230074	1363703366	/nfs/dbraw/zinc/70/33/66/1363703366.db2.gz	QJYCSCYWAYLGHC-KRWDZBQOSA-N	0	3	336.520	3.232	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H](F)c1ccccc1	ZINC001099245010	1363711688	/nfs/dbraw/zinc/71/16/88/1363711688.db2.gz	GIRQXPKSNFFOMI-QZTJIDSGSA-N	0	3	330.447	3.327	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)C(C)(C)CC=C	ZINC001099252661	1363715195	/nfs/dbraw/zinc/71/51/95/1363715195.db2.gz	YVUXGMCTNJDBNC-QGZVFWFLSA-N	0	3	336.520	3.398	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2cc(F)c(C)cc2F)C[C@H]1C(F)(F)F	ZINC001099265163	1363723056	/nfs/dbraw/zinc/72/30/56/1363723056.db2.gz	CURUYCIDVYIILW-BXUZGUMPSA-N	0	3	348.315	3.052	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)CCN(C)c1ccccc1	ZINC001099269762	1363724756	/nfs/dbraw/zinc/72/47/56/1363724756.db2.gz	DNUVPZIRNZNJJR-IBGZPJMESA-N	0	3	343.515	3.306	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2cc3ccsc3[nH]2)C[C@H]1C(F)(F)F	ZINC001099287211	1363733582	/nfs/dbraw/zinc/73/35/82/1363733582.db2.gz	DDIONQBBNLXZKE-ZYHUDNBSSA-N	0	3	343.374	3.008	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)Cc2cc(C)ccc2C)C[C@H]1C(F)(F)F	ZINC001099301376	1363738577	/nfs/dbraw/zinc/73/85/77/1363738577.db2.gz	HDNUDYFGILQOLN-HZPDHXFCSA-N	0	3	340.389	3.011	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H](C)Oc1ccccn1	ZINC001099316602	1363746471	/nfs/dbraw/zinc/74/64/71/1363746471.db2.gz	WTSMZJWMQKMCAI-DLBZAZTESA-N	0	3	345.487	3.032	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2ccc(C)c(C)c2)C[C@H]1C(F)(F)F	ZINC001099338454	1363758850	/nfs/dbraw/zinc/75/88/50/1363758850.db2.gz	BSFOVZMFWZQNOV-HZPDHXFCSA-N	0	3	340.389	3.472	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)C[C@@H](C)n1nc(C)cc1C	ZINC001099338904	1363758938	/nfs/dbraw/zinc/75/89/38/1363758938.db2.gz	BWXXBQRQIMQRPN-MSOLQXFVSA-N	0	3	346.519	3.244	20	30		EGEDHN
N#Cc1ccccc1CNC[C@]12CCC[C@H]1CN(C(=O)[C@@H]1CC13CC3)C2	ZINC001099506073	1363824606	/nfs/dbraw/zinc/82/46/06/1363824606.db2.gz	LEHZIYWQEMXEPL-IPJJNNNSSA-N	0	3	349.478	3.077	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)CCC1(C)CC1	ZINC001099544550	1363841304	/nfs/dbraw/zinc/84/13/04/1363841304.db2.gz	QPTWHTGRQDNLPO-NXOAAHMSSA-N	0	3	336.907	3.488	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100357999	1364089810	/nfs/dbraw/zinc/08/98/10/1364089810.db2.gz	BQBQFAGLTSZTJH-UHFFFAOYSA-N	0	3	336.479	3.291	20	30		EGEDHN
C#CCC1(C(=O)NCC2CC(NCc3ccccc3F)C2)CCC1	ZINC001100396842	1364101944	/nfs/dbraw/zinc/10/19/44/1364101944.db2.gz	WUCWSPMTLLXNRY-UHFFFAOYSA-N	0	3	328.431	3.004	20	30		EGEDHN
CCCC[C@@](C)(F)C(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100460910	1364123012	/nfs/dbraw/zinc/12/30/12/1364123012.db2.gz	DUPNARXKPDYXSU-GZNCHQMQSA-N	0	3	344.474	3.441	20	30		EGEDHN
CC(C)(C(=O)NCC1CC(NCC#Cc2ccccc2)C1)C1CCC1	ZINC001100543829	1364154273	/nfs/dbraw/zinc/15/42/73/1364154273.db2.gz	ZCVSDAGZQSIJCG-UHFFFAOYSA-N	0	3	338.495	3.349	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCC1CC(NCc2cnc(Cl)s2)C1	ZINC001100587794	1364176207	/nfs/dbraw/zinc/17/62/07/1364176207.db2.gz	XKWMYXLCYCPHHZ-HIFPTAJRSA-N	0	3	341.908	3.383	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1	ZINC001100595078	1364180500	/nfs/dbraw/zinc/18/05/00/1364180500.db2.gz	LNKRSODBFMDONT-NXVRBGIVSA-N	0	3	343.446	3.284	20	30		EGEDHN
CCCC1(C(=O)NCC2CC(NCC#Cc3ccc(F)cc3)C2)CC1	ZINC001100654177	1364206218	/nfs/dbraw/zinc/20/62/18/1364206218.db2.gz	QQPLICLRUQHXFS-UHFFFAOYSA-N	0	3	342.458	3.242	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC2CC(NCc3oc(CCC)nc3C)C2)C1	ZINC001100661377	1364208334	/nfs/dbraw/zinc/20/83/34/1364208334.db2.gz	QBWFGFPDGLLGJX-UHFFFAOYSA-N	0	3	345.487	3.276	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)Cc2ccc(F)c(Cl)c2)C1	ZINC001100703471	1364226754	/nfs/dbraw/zinc/22/67/54/1364226754.db2.gz	IGFYEDNXRMQFMT-UHFFFAOYSA-N	0	3	345.245	3.259	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C2(c3cccc(F)c3)CC2)C1	ZINC001100730766	1364239038	/nfs/dbraw/zinc/23/90/38/1364239038.db2.gz	OFOIZODRPUYTNV-UHFFFAOYSA-N	0	3	336.838	3.094	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)CCc2ccc(CC)cc2)C1	ZINC001100973607	1364352959	/nfs/dbraw/zinc/35/29/59/1364352959.db2.gz	CHANKQGXPQZEAH-UHFFFAOYSA-N	0	3	334.891	3.419	20	30		EGEDHN
C=C(C)CN1CC[C@H](Oc2ccnc(CNC(=O)/C(C)=C\CC)c2)C1	ZINC001101092114	1364408857	/nfs/dbraw/zinc/40/88/57/1364408857.db2.gz	MGHMCNLAIWQVTO-ICRRLBEQSA-N	0	3	343.471	3.083	20	30		EGEDHN
CCCCCC(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@@]2(C)C1	ZINC001101128046	1364422088	/nfs/dbraw/zinc/42/20/88/1364422088.db2.gz	XBYKWLIVKLTWRC-CTNGQTDRSA-N	0	3	339.483	3.419	20	30		EGEDHN
CC#CCCCC(=O)N1C[C@H]2CN(Cc3ccc(F)cc3)C[C@@]2(C)C1	ZINC001101333518	1364513090	/nfs/dbraw/zinc/51/30/90/1364513090.db2.gz	YPDRBFFPKNYAKY-NQIIRXRSSA-N	0	3	342.458	3.300	20	30		EGEDHN
CCCCCC[C@H](C)C(=O)N1C[C@H]2CN(CC#CCOC)C[C@@]2(C)C1	ZINC001101399974	1364545640	/nfs/dbraw/zinc/54/56/40/1364545640.db2.gz	AODJRNCHUXMJHN-ZVDOUQERSA-N	0	3	348.531	3.023	20	30		EGEDHN
C=CCCC(=O)N1CCC(C(C)(C)CNCc2cscn2)CC1	ZINC001101519397	1364595451	/nfs/dbraw/zinc/59/54/51/1364595451.db2.gz	DAVZWWVMJYROGC-UHFFFAOYSA-N	0	3	335.517	3.464	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC(C(C)(C)CNCc2ccon2)CC1	ZINC001101544479	1364609212	/nfs/dbraw/zinc/60/92/12/1364609212.db2.gz	BAFUAOOHYMSGDX-UHFFFAOYSA-N	0	3	333.476	3.385	20	30		EGEDHN
C=CCC[C@H](C)N1CC2(C1)C[C@H](NC(=O)CCC(C)C)c1nccn12	ZINC001101607667	1364652725	/nfs/dbraw/zinc/65/27/25/1364652725.db2.gz	UVDDHAYIVHMOGL-IRXDYDNUSA-N	0	3	344.503	3.246	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@H]1CC2(CN(CCC(C)C)C2)n2ccnc21	ZINC001101643042	1364667975	/nfs/dbraw/zinc/66/79/75/1364667975.db2.gz	UBWLFRPBVMJHAQ-QFBILLFUSA-N	0	3	344.503	3.103	20	30		EGEDHN
C=CCCC(=O)NC[C@@H]1CN(CCc2c(F)cccc2F)C[C@H]1C	ZINC001101805136	1364733187	/nfs/dbraw/zinc/73/31/87/1364733187.db2.gz	JAXLZCXDADRRFJ-HUUCEWRRSA-N	0	3	336.426	3.158	20	30		EGEDHN
CCC[C@H](C)C(=O)NC[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1C	ZINC001101828712	1364741924	/nfs/dbraw/zinc/74/19/24/1364741924.db2.gz	GWXTZZQSFOCYKJ-YQVWRLOYSA-N	0	3	344.474	3.298	20	30		EGEDHN
C[C@H](CC(F)F)C(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C	ZINC001102162771	1364903100	/nfs/dbraw/zinc/90/31/00/1364903100.db2.gz	HLLARCABBSLAKI-JFIYKMOQSA-N	0	3	348.437	3.014	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H]1CN(Cc2c(C)noc2CC)C[C@H]1C	ZINC001102221383	1364941602	/nfs/dbraw/zinc/94/16/02/1364941602.db2.gz	PFAPOWULWGKDLR-GDBMZVCRSA-N	0	3	347.503	3.332	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@@H]1CN(Cc2conc2CC)C[C@H]1C	ZINC001102260967	1364973628	/nfs/dbraw/zinc/97/36/28/1364973628.db2.gz	JTEKDCDSROWLRZ-ARFHVFGLSA-N	0	3	333.476	3.023	20	30		EGEDHN
CC(C)C1(C(=O)NC[C@@H]2CN(CC#Cc3ccccc3)C[C@H]2C)CC1	ZINC001102346531	1365014374	/nfs/dbraw/zinc/01/43/74/1365014374.db2.gz	RXJDCUWHQDGSIW-UYAOXDASSA-N	0	3	338.495	3.158	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@H]2CN(Cc3ccccc3F)C[C@H]2C)C1	ZINC001102348213	1365015600	/nfs/dbraw/zinc/01/56/00/1365015600.db2.gz	VSFANYRBAPQLJV-NVXWUHKLSA-N	0	3	330.447	3.366	20	30		EGEDHN
CC(C)[C@H](C)C(=O)NC[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1C	ZINC001102423049	1365047534	/nfs/dbraw/zinc/04/75/34/1365047534.db2.gz	KUCPUFNDEWNAFC-ZIFCJYIRSA-N	0	3	344.474	3.153	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](NCc3ccc(C)nc3C)C2)CCC1	ZINC001185463485	1387722269	/nfs/dbraw/zinc/72/22/69/1387722269.db2.gz	SQKUTFVDTRTSDL-GOSISDBHSA-N	0	3	327.472	3.135	20	30		EGEDHN
C/C=C(\C)C(=O)NCC[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1C	ZINC001102841088	1365246454	/nfs/dbraw/zinc/24/64/54/1365246454.db2.gz	ARVGNJVLXSYSSH-YUOGFCRJSA-N	0	3	325.456	3.099	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](NCc3cn(C(C)C)nc3C)C2)CC1	ZINC001185486781	1387729355	/nfs/dbraw/zinc/72/93/55/1387729355.db2.gz	JMKBANOJGOQQDD-GOSISDBHSA-N	0	3	344.503	3.209	20	30		EGEDHN
C#CCCCC(=O)NCC[C@@H]1CN(Cc2cc(F)cc(F)c2)C[C@H]1C	ZINC001102917262	1365290673	/nfs/dbraw/zinc/29/06/73/1365290673.db2.gz	UPHFOWJUDRWVJU-NVXWUHKLSA-N	0	3	348.437	3.343	20	30		EGEDHN
CC(C)C#CC(=O)NCC[C@@H]1CN(Cc2cc(F)cc(F)c2)C[C@H]1C	ZINC001102956147	1365316057	/nfs/dbraw/zinc/31/60/57/1365316057.db2.gz	SQJVFKVWBQZOOW-NVXWUHKLSA-N	0	3	348.437	3.198	20	30		EGEDHN
C#Cc1ccc(C(=O)NCC[C@@H]2CN(CC(=C)Cl)C[C@H]2C)cc1	ZINC001103301162	1365482684	/nfs/dbraw/zinc/48/26/84/1365482684.db2.gz	SZRAQUDQAODMAU-RDTXWAMCSA-N	0	3	330.859	3.108	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC[C@@H]1CN(Cc2cc(C)no2)C[C@H]1C	ZINC001103401437	1365537538	/nfs/dbraw/zinc/53/75/38/1365537538.db2.gz	BLLJEEZUAQFGKC-IDHHARJASA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2sc(C)nc2C)C1	ZINC001103704889	1365742019	/nfs/dbraw/zinc/74/20/19/1365742019.db2.gz	NAFVFWNCOYLMTA-QMTHXVAHSA-N	0	3	341.908	3.200	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2ccsc2C)C[C@H]1C	ZINC001104167964	1365934872	/nfs/dbraw/zinc/93/48/72/1365934872.db2.gz	TWCIJBHOKOUIPQ-BXUZGUMPSA-N	0	3	326.893	3.497	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)[C@@H]2C[C@@H]3C=C[C@H]2CC3)C[C@H]1C	ZINC001104215332	1365955114	/nfs/dbraw/zinc/95/51/14/1365955114.db2.gz	ZXKROERZHOZQCN-SOVHRIKKSA-N	0	3	336.907	3.415	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@@H](C)[C@H](CCNCc2c(C)noc2C)C1	ZINC001104562825	1366077369	/nfs/dbraw/zinc/07/73/69/1366077369.db2.gz	GUANXFPYCTYALL-ZTFGCOKTSA-N	0	3	347.503	3.468	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H](C)[C@H](CCNCc2ocnc2C)C1	ZINC001104562645	1366077784	/nfs/dbraw/zinc/07/77/84/1366077784.db2.gz	CZYMSJAKKFDEEC-BFYDXBDKSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](C)[C@H](CCNCc2cnoc2C)C1	ZINC001104562797	1366077790	/nfs/dbraw/zinc/07/77/90/1366077790.db2.gz	GAAUQLGJZYNTMB-ZMSDIMECSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2sc(C)nc2C)C[C@H]1C	ZINC001104988993	1366260384	/nfs/dbraw/zinc/26/03/84/1366260384.db2.gz	MKNMXMOKBGRPDK-QMTHXVAHSA-N	0	3	341.908	3.200	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2ccc(C)nc2C)C[C@H]1C	ZINC001105048851	1366292346	/nfs/dbraw/zinc/29/23/46/1366292346.db2.gz	KDIDQDCHKQFZRT-MLGOLLRUSA-N	0	3	335.879	3.139	20	30		EGEDHN
CCCCCCCNCc1cn(C2CN(C(=O)[C@H](C)CCC)C2)nn1	ZINC001105197003	1366367374	/nfs/dbraw/zinc/36/73/74/1366367374.db2.gz	BRFSORXERXEHGT-MRXNPFEDSA-N	0	3	349.523	3.158	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)CC(C)=C(C)C)CC1	ZINC001105394539	1366444037	/nfs/dbraw/zinc/44/40/37/1366444037.db2.gz	ZVCHKVWSKOIHCN-FQEVSTJZSA-N	0	3	328.500	3.459	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(c2ccccc2)C[C@H](NC(=O)C#CC(C)C)C1	ZINC001105423295	1366459575	/nfs/dbraw/zinc/45/95/75/1366459575.db2.gz	MOCDBKLLIMXWRD-PUZFROQSSA-N	0	3	344.886	3.205	20	30		EGEDHN
C=CCCCCCNCc1cn([C@H]2CCCN(C(=O)CCC)C2)nn1	ZINC001185842302	1387812963	/nfs/dbraw/zinc/81/29/63/1387812963.db2.gz	GLJOKNFFVREIOM-SFHVURJKSA-N	0	3	347.507	3.078	20	30		EGEDHN
C#CCC[NH2+]CC1([C@H]2CCCCN2C(=O)c2ccccc2[O-])CCC1	ZINC001105508582	1366499376	/nfs/dbraw/zinc/49/93/76/1366499376.db2.gz	FCVSORZTBAHMMJ-LJQANCHMSA-N	0	3	340.467	3.170	20	30		EGEDHN
CC[C@@H](C)CC(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001106061569	1366608962	/nfs/dbraw/zinc/60/89/62/1366608962.db2.gz	IHWBIXYSKZRVCH-GPMSIDNRSA-N	0	3	327.472	3.179	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](N(C)CCOc2cc(C)cc(C)c2)C1	ZINC001189318590	1366988615	/nfs/dbraw/zinc/98/86/15/1366988615.db2.gz	MYXMGBIENPCRMU-SFHVURJKSA-N	0	3	330.472	3.181	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@]12CCC[C@H]1N(Cc1cncs1)CC2	ZINC001107503329	1367001931	/nfs/dbraw/zinc/00/19/31/1367001931.db2.gz	VSJILODAAQLZCZ-CRAIPNDOSA-N	0	3	333.501	3.216	20	30		EGEDHN
C=CCOCCCC(=O)N1CC[C@H](N(C)[C@@H](C)c2ccc(F)cc2)C1	ZINC001189526852	1367045394	/nfs/dbraw/zinc/04/53/94/1367045394.db2.gz	KFIWIYQKCJCQPE-LPHOPBHVSA-N	0	3	348.462	3.402	20	30		EGEDHN
COCC#CCN1CC[C@@]2(CNC(=O)[C@H](C)CC(C)(C)C)CCC[C@@H]12	ZINC001107567846	1367048487	/nfs/dbraw/zinc/04/84/87/1367048487.db2.gz	NLOIZWCOFOMYTK-DBXWQHBBSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCCOC(C)C	ZINC001109329027	1367056567	/nfs/dbraw/zinc/05/65/67/1367056567.db2.gz	HULZIVMSRFPRET-QYZOEREBSA-N	0	3	334.504	3.291	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCc1ccc(OC)cc1	ZINC001109354982	1367084651	/nfs/dbraw/zinc/08/46/51/1367084651.db2.gz	FXEMKSGKGRBUIG-HOJAQTOUSA-N	0	3	342.483	3.316	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](N(C)Cc2ccc(F)cc2C)C1	ZINC001189743856	1367100472	/nfs/dbraw/zinc/10/04/72/1367100472.db2.gz	JVAOXMXXNCXHMM-IBGZPJMESA-N	0	3	330.447	3.360	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](N(C)CCOc2cccc(C)c2)C1	ZINC001189751999	1367102731	/nfs/dbraw/zinc/10/27/31/1367102731.db2.gz	MLLDKHIOFWRYGM-LJQANCHMSA-N	0	3	342.483	3.100	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2ccc(F)cc2)C1	ZINC001107691748	1367104482	/nfs/dbraw/zinc/10/44/82/1367104482.db2.gz	CXWGPVLGKFLVJS-BEFAXECRSA-N	0	3	334.435	3.001	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H]1CCC=CCCC1)C2	ZINC001109438652	1367120115	/nfs/dbraw/zinc/12/01/15/1367120115.db2.gz	GNQZFJRCWICBIO-YRXWBPOGSA-N	0	3	332.488	3.047	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](N(C)Cc2ccc(Cl)cc2C)C1	ZINC001189909070	1367127991	/nfs/dbraw/zinc/12/79/91/1367127991.db2.gz	AKEAKVUOKGKWFT-SFHVURJKSA-N	0	3	332.875	3.485	20	30		EGEDHN
C[C@H](c1cccc(F)c1)N(C)[C@@H]1CCN(C(=O)C#CC(C)(C)C)C1	ZINC001190084602	1367168925	/nfs/dbraw/zinc/16/89/25/1367168925.db2.gz	QAQVLNTTXDYGHK-CRAIPNDOSA-N	0	3	330.447	3.469	20	30		EGEDHN
C=CCC[C@H](C)N1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1nc(Cl)cs1)C2	ZINC001109640388	1367258217	/nfs/dbraw/zinc/25/82/17/1367258217.db2.gz	DSHGPNCGVCLXAP-RNJOBUHISA-N	0	3	339.892	3.486	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@]1(C)CN(CC2CCCCCC2)CCO1	ZINC001108119079	1367290802	/nfs/dbraw/zinc/29/08/02/1367290802.db2.gz	HQUYWLHMSVNHPY-HXUWFJFHSA-N	0	3	336.520	3.376	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@@H](N(C)C/C=C\c3ccccc3)C2)CCC1	ZINC001190595739	1367302180	/nfs/dbraw/zinc/30/21/80/1367302180.db2.gz	RYNCIDLTMRSJMT-RVPHRTOXSA-N	0	3	336.479	3.426	20	30		EGEDHN
C=CCCC1(C(=O)NC[C@]2(C)CN(CC(CC)CC)CCO2)CC1	ZINC001108185886	1367328471	/nfs/dbraw/zinc/32/84/71/1367328471.db2.gz	GSRBKJQGHWDERN-LJQANCHMSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@]2(C)CN(CC(CC)CC)CCO2)CC1	ZINC001108186396	1367330546	/nfs/dbraw/zinc/33/05/46/1367330546.db2.gz	OSTXHFQNLYZJHE-FQEVSTJZSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@]1(C)CN(CC2CC(C)(C)C2)CCO1	ZINC001108246425	1367359473	/nfs/dbraw/zinc/35/94/73/1367359473.db2.gz	MGUBPFWEGCHMLG-HXUWFJFHSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@]1(C)CN(C[C@@H](C)CC(C)C)CCO1	ZINC001108246780	1367359813	/nfs/dbraw/zinc/35/98/13/1367359813.db2.gz	VECFYHZNMPCTIO-FXAWDEMLSA-N	0	3	338.536	3.478	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)CC(C2CC2)C2CC2)C1	ZINC001108422148	1367446865	/nfs/dbraw/zinc/44/68/65/1367446865.db2.gz	IXSJBWLAXXZDBU-KKSFZXQISA-N	0	3	348.531	3.375	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCCCc1ccc(C)cc1)C2	ZINC001110184234	1367553460	/nfs/dbraw/zinc/55/34/60/1367553460.db2.gz	CGHJWDHEUGJUQR-HKBOAZHASA-N	0	3	338.495	3.453	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCC(C)(C)c1ccccc1)C2	ZINC001110191960	1367557943	/nfs/dbraw/zinc/55/79/43/1367557943.db2.gz	PZJQDUVWNOEDCV-AABGKKOBSA-N	0	3	338.495	3.489	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](N(C)CCOc2cccc(F)c2)C1	ZINC001191695974	1367562985	/nfs/dbraw/zinc/56/29/85/1367562985.db2.gz	MJCIMSIENYPVEC-QGZVFWFLSA-N	0	3	348.462	3.340	20	30		EGEDHN
CC(C)=C(C)CC(=O)N1CC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001191763257	1367580835	/nfs/dbraw/zinc/58/08/35/1367580835.db2.gz	KGZAAJLOPSRBMG-IBGZPJMESA-N	0	3	325.456	3.337	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](N(C)CCc2c(F)cccc2F)C1	ZINC001191858870	1367615569	/nfs/dbraw/zinc/61/55/69/1367615569.db2.gz	CYKZCZZSIBFQEA-MRXNPFEDSA-N	0	3	348.437	3.234	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@@H](N(C)Cc2ccc3c(c2)COC3)C1	ZINC001191868196	1367619878	/nfs/dbraw/zinc/61/98/78/1367619878.db2.gz	PUWBIMAZDJPQDE-OXQOHEQNSA-N	0	3	342.483	3.352	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001191867993	1367619914	/nfs/dbraw/zinc/61/99/14/1367619914.db2.gz	MKVKVHMTSUOFHU-LPHOPBHVSA-N	0	3	325.456	3.193	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@@H](N(C)CCOc2cccc(F)c2)C1	ZINC001191891028	1367628936	/nfs/dbraw/zinc/62/89/36/1367628936.db2.gz	WDWBKXVAMGEJOL-FUHWJXTLSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](N(C)CCOCCC(C)C)C2)CC1	ZINC001192181613	1367709792	/nfs/dbraw/zinc/70/97/92/1367709792.db2.gz	WSPQJLTWHQNWJJ-LJQANCHMSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCCOc1ccccc1	ZINC001109043897	1367737036	/nfs/dbraw/zinc/73/70/36/1367737036.db2.gz	ZLMWCDWGIYNYON-NEWSRXKRSA-N	0	3	328.456	3.143	20	30		EGEDHN
C=CCOCCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccc(C)cc1	ZINC001109120516	1367780829	/nfs/dbraw/zinc/78/08/29/1367780829.db2.gz	XDMIJOSHJHFNGK-AABGKKOBSA-N	0	3	342.483	3.199	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)C[C@@H](C)c2ccccc2C)C1	ZINC001192640726	1367839136	/nfs/dbraw/zinc/83/91/36/1367839136.db2.gz	FEUCNWSRSJHQEJ-RTBURBONSA-N	0	3	344.499	3.224	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2C[C@@H]1CC(C)(C)CO1	ZINC001110603683	1367865578	/nfs/dbraw/zinc/86/55/78/1367865578.db2.gz	OCGJRTKAVVXRGP-TWMKSMIVSA-N	0	3	334.504	3.125	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)[C@H](C)c2ccc(CC)cc2)C1	ZINC001192875748	1367893806	/nfs/dbraw/zinc/89/38/06/1367893806.db2.gz	DXLKPPBNSAHGQL-XLIONFOSSA-N	0	3	344.499	3.088	20	30		EGEDHN
C=CCCCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1onc(C)c1C)C2	ZINC001110699915	1367938448	/nfs/dbraw/zinc/93/84/48/1367938448.db2.gz	PADUOXLJFRLIAX-ZACQAIPSSA-N	0	3	331.460	3.373	20	30		EGEDHN
CCCCCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1coc(OCC)n1)C2	ZINC001110770874	1367970640	/nfs/dbraw/zinc/97/06/40/1367970640.db2.gz	XUOJZAWSPNZHFE-INMHGKMJSA-N	0	3	349.475	3.379	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCOCCCC	ZINC001110901990	1368075763	/nfs/dbraw/zinc/07/57/63/1368075763.db2.gz	HZHQRHCMAHDQFI-QRVBRYPASA-N	0	3	334.504	3.108	20	30		EGEDHN
C=C[C@H](C(=O)N1CC[C@H](N(C)CCOCC(C)C)C1)c1ccccc1	ZINC001194183473	1368201940	/nfs/dbraw/zinc/20/19/40/1368201940.db2.gz	PXLXQNGLNKRDDP-PMACEKPBSA-N	0	3	344.499	3.162	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)CC(C)(C)c2ccccc2)C1	ZINC001194284013	1368224217	/nfs/dbraw/zinc/22/42/17/1368224217.db2.gz	DSOKUAXQYRRTPE-LJQANCHMSA-N	0	3	344.499	3.090	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2cc3c(cccc3C)o2)C1	ZINC001194346111	1368239756	/nfs/dbraw/zinc/23/97/56/1368239756.db2.gz	PRTZQFCMQOHYLP-INIZCTEOSA-N	0	3	342.439	3.090	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@H](C)CCc1ccccc1)C2	ZINC001111488886	1368319714	/nfs/dbraw/zinc/31/97/14/1368319714.db2.gz	YRYQINVGXWFMSN-WLRLJWMZSA-N	0	3	338.495	3.390	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@@H](C)CCc1ccccc1)C2	ZINC001111488885	1368320256	/nfs/dbraw/zinc/32/02/56/1368320256.db2.gz	YRYQINVGXWFMSN-KCLUMXDGSA-N	0	3	338.495	3.390	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H](C)OC2(CCN(CC=C)CC2)C1	ZINC001111544326	1368337719	/nfs/dbraw/zinc/33/77/19/1368337719.db2.gz	QENOJBSSVPAEFZ-QGZVFWFLSA-N	0	3	332.488	3.023	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H](C)C(CC)CC)C[C@H](C)O2	ZINC001111545490	1368338095	/nfs/dbraw/zinc/33/80/95/1368338095.db2.gz	HTHXMSGGGJYOKX-IRXDYDNUSA-N	0	3	336.520	3.327	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H](C)CC(C)(C)C)C[C@H](C)O2	ZINC001111550916	1368342808	/nfs/dbraw/zinc/34/28/08/1368342808.db2.gz	NPCYGMGIQZHHBL-SJORKVTESA-N	0	3	336.520	3.327	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CN([C@@H](C)c2cc(C)ccc2C)C[C@H]1O	ZINC001195277516	1368413172	/nfs/dbraw/zinc/41/31/72/1368413172.db2.gz	GJVJBQOLKDMYOZ-QXAKKESOSA-N	0	3	344.499	3.128	20	30		EGEDHN
C#CCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1cc(C)ccc1F)C2	ZINC001111729546	1368431574	/nfs/dbraw/zinc/43/15/74/1368431574.db2.gz	UINRHAPOPUNBRC-RXVVDRJESA-N	0	3	342.458	3.408	20	30		EGEDHN
CC(C)C#CC(=O)N[C@]12CCC[C@H]1CN(CCCCC(F)(F)F)C2	ZINC001111736300	1368434651	/nfs/dbraw/zinc/43/46/51/1368434651.db2.gz	BRIIUFIAOZBWMY-RDJZCZTQSA-N	0	3	344.421	3.349	20	30		EGEDHN
N#Cc1c[nH]c(C(=O)N2CCCN(CC/C=C/c3ccccc3)CC2)c1	ZINC001195434890	1368436278	/nfs/dbraw/zinc/43/62/78/1368436278.db2.gz	UNXVHEWKQQABTI-RUDMXATFSA-N	0	3	348.450	3.138	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@]12CCC[C@H]1CN(Cc1cccnc1C)C2	ZINC001111761704	1368448285	/nfs/dbraw/zinc/44/82/85/1368448285.db2.gz	ICGQKQYPWMNAPR-RXVVDRJESA-N	0	3	341.499	3.463	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@]12CCC[C@H]1CN(Cc1cncc(C)c1)C2	ZINC001111761965	1368448610	/nfs/dbraw/zinc/44/86/10/1368448610.db2.gz	URJDJEIGWLGEHR-RXVVDRJESA-N	0	3	341.499	3.463	20	30		EGEDHN
C=C(C)CCC(=O)N[C@]12CCC[C@H]1CN(Cc1c(C)onc1CC)C2	ZINC001111763715	1368450041	/nfs/dbraw/zinc/45/00/41/1368450041.db2.gz	DFSKHWQYIVFKAV-JXFKEZNVSA-N	0	3	345.487	3.372	20	30		EGEDHN
CC#CCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1cccc(C#N)c1)C2	ZINC001111845838	1368500007	/nfs/dbraw/zinc/50/00/07/1368500007.db2.gz	CESUEIGTBFBFGU-UNMCSNQZSA-N	0	3	349.478	3.223	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@]12CCC[C@H]1CN(Cc1cnccc1C)C2	ZINC001111848585	1368502520	/nfs/dbraw/zinc/50/25/20/1368502520.db2.gz	LYIMALONZGHPIH-CUWPLCDZSA-N	0	3	341.499	3.463	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)C[C@H](C)c2cccc(F)c2)C1	ZINC001111868684	1368516030	/nfs/dbraw/zinc/51/60/30/1368516030.db2.gz	ICROCBGYUOYLIC-MDKPJZGXSA-N	0	3	342.458	3.313	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2ccn(C(F)F)n2)CC1	ZINC001195966433	1368524875	/nfs/dbraw/zinc/52/48/75/1368524875.db2.gz	DNFNXJIYGPGINF-UHFFFAOYSA-N	0	3	342.434	3.397	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2ccn(CC(C)C)n2)CC1	ZINC001195997294	1368531764	/nfs/dbraw/zinc/53/17/64/1368531764.db2.gz	UPLONBSHZBSYAE-UHFFFAOYSA-N	0	3	346.519	3.433	20	30		EGEDHN
C=C(C)CCC(=O)N1CCCN(C[C@H](Cc2ccccc2)OC)CC1	ZINC001196018179	1368537198	/nfs/dbraw/zinc/53/71/98/1368537198.db2.gz	MRIWHLNQAMJRMI-FQEVSTJZSA-N	0	3	344.499	3.135	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2cnc(-c3ccccc3)o2)CC1	ZINC001196223605	1368571234	/nfs/dbraw/zinc/57/12/34/1368571234.db2.gz	ZNYDINDBXSMJPG-UHFFFAOYSA-N	0	3	339.439	3.456	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)C(C)(C)C2CCCC2)C[C@H]1C(F)(F)F	ZINC001112116111	1368666754	/nfs/dbraw/zinc/66/67/54/1368666754.db2.gz	KPDPGZQUWVTWEC-HUUCEWRRSA-N	0	3	344.421	3.205	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)[C@H]2CC[C@H](CC)CC2)C[C@H]1C(F)(F)F	ZINC001112196615	1368709538	/nfs/dbraw/zinc/70/95/38/1368709538.db2.gz	VAZZDSSOMNQTAU-KLHDSHLOSA-N	0	3	344.421	3.205	20	30		EGEDHN
C=CCOc1cccnc1C(=O)N1CCCN(CCCCCC)CC1	ZINC001197768985	1368892613	/nfs/dbraw/zinc/89/26/13/1368892613.db2.gz	PROPDEKVPASGMP-UHFFFAOYSA-N	0	3	345.487	3.375	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2nccs2)C1	ZINC001112514960	1368908967	/nfs/dbraw/zinc/90/89/67/1368908967.db2.gz	PQCXYASTDZJFLM-GJYPPUQNSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H]2CCC[C@]2(CNCc2nccs2)C1	ZINC001112520639	1368911724	/nfs/dbraw/zinc/91/17/24/1368911724.db2.gz	PNPKRVPJTNFYQP-YJBOKZPZSA-N	0	3	333.501	3.218	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)c2ccc(Cl)cc2)C1	ZINC001198056184	1368951563	/nfs/dbraw/zinc/95/15/63/1368951563.db2.gz	WXUQLLBAYYXKRY-IAGOWNOFSA-N	0	3	338.879	3.085	20	30		EGEDHN
C#CCCN1CCCN(C(=O)C[C@H](C)CCc2ccccc2)CC1	ZINC001198331034	1369010433	/nfs/dbraw/zinc/01/04/33/1369010433.db2.gz	VDJYUADYBBFDPW-LJQANCHMSA-N	0	3	326.484	3.203	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N1CCCN([C@H](C)c2cccc(C)c2)CC1	ZINC001198343967	1369012773	/nfs/dbraw/zinc/01/27/73/1369012773.db2.gz	POYAOHFFKLLUKK-MSOLQXFVSA-N	0	3	330.472	3.181	20	30		EGEDHN
C=CCCCN1C[C@@H](O)[C@H](NC(=O)C2CCC(CCCC)CC2)C1	ZINC001198409246	1369024953	/nfs/dbraw/zinc/02/49/53/1369024953.db2.gz	KZJBZZRHEUNPDS-CSODTCANSA-N	0	3	336.520	3.111	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)c1ccc[nH]1)c1ccccc1OC	ZINC001198522210	1369051828	/nfs/dbraw/zinc/05/18/28/1369051828.db2.gz	JESDYZPYCAIHGJ-KRWDZBQOSA-N	0	3	327.428	3.050	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)c1ccoc1)c1ccccc1OC	ZINC001198529771	1369054202	/nfs/dbraw/zinc/05/42/02/1369054202.db2.gz	KJSRAJKABJLMBM-QGZVFWFLSA-N	0	3	328.412	3.315	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)c1cc(Cl)c[nH]1)c1ccccc1OC	ZINC001198529733	1369054312	/nfs/dbraw/zinc/05/43/12/1369054312.db2.gz	JMTTXHWNPRWVCH-MRXNPFEDSA-N	0	3	347.846	3.314	20	30		EGEDHN
C=CCCC(=O)NC[C@H](NCCCOC(C)C)c1ccccc1OC	ZINC001198594902	1369068495	/nfs/dbraw/zinc/06/84/95/1369068495.db2.gz	FCGCCMWKBRJQLN-SFHVURJKSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)[C@H]1CC1(C)C)c1ccccc1OC	ZINC001198667184	1369085928	/nfs/dbraw/zinc/08/59/28/1369085928.db2.gz	DPRXDMJGCPTSRH-IAGOWNOFSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)CC[C@@H](C)OC)c1ccccc1OC	ZINC001198677391	1369089368	/nfs/dbraw/zinc/08/93/68/1369089368.db2.gz	MVEFUBJGMFAXAP-AEFFLSMTSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)[C@@H]1CC1(F)F)c1ccccc1OC	ZINC001198712983	1369097067	/nfs/dbraw/zinc/09/70/67/1369097067.db2.gz	JLVWJZHBUUYRGD-LSDHHAIUSA-N	0	3	338.398	3.064	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)[C@@H]1CC1(F)F)c1ccccc1OC	ZINC001198712765	1369097303	/nfs/dbraw/zinc/09/73/03/1369097303.db2.gz	GLDMDCCLLKIWND-LSDHHAIUSA-N	0	3	338.398	3.064	20	30		EGEDHN
C#CCC1(C(=O)NC[C@H](NC(C)C)c2ccccc2OC)CCC1	ZINC001198752404	1369105180	/nfs/dbraw/zinc/10/51/80/1369105180.db2.gz	OOKDMILRMSFCMX-KRWDZBQOSA-N	0	3	328.456	3.044	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)c1ccns1)c1ccccc1OC	ZINC001198753041	1369106376	/nfs/dbraw/zinc/10/63/76/1369106376.db2.gz	XHLWRBXZOYLFBP-OAHLLOKOSA-N	0	3	345.468	3.179	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)c1ccsn1)c1ccccc1OC	ZINC001198766658	1369109114	/nfs/dbraw/zinc/10/91/14/1369109114.db2.gz	FRWIKHAPSLLAGK-INIZCTEOSA-N	0	3	345.468	3.179	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)C1(C2CC2)CC1)c1ccccc1OC	ZINC001198766722	1369109149	/nfs/dbraw/zinc/10/91/49/1369109149.db2.gz	GXAKPDGSNQDOBY-QGZVFWFLSA-N	0	3	328.456	3.208	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)CCC(C)(F)F)c1ccccc1OC	ZINC001198776391	1369110936	/nfs/dbraw/zinc/11/09/36/1369110936.db2.gz	QILYXHGYWWBNPT-OAHLLOKOSA-N	0	3	340.414	3.454	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@H](NCCCOC)c1ccccc1OC	ZINC001198857709	1369132524	/nfs/dbraw/zinc/13/25/24/1369132524.db2.gz	WHALFHHNKFQGMT-AEFFLSMTSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)C1(C)CC=CC1)c1ccccc1OC	ZINC001198876836	1369136766	/nfs/dbraw/zinc/13/67/66/1369136766.db2.gz	YRNKDWCGUHLWKF-KRWDZBQOSA-N	0	3	328.456	3.375	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@@H](C)C(C)(F)F)c1ccccc1OC	ZINC001198902196	1369144099	/nfs/dbraw/zinc/14/40/99/1369144099.db2.gz	HSASJVXEPHGCSV-HIFRSBDPSA-N	0	3	340.414	3.310	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CCCC(C)C)C[C@H]2O)CCCCC1	ZINC001198944792	1369154626	/nfs/dbraw/zinc/15/46/26/1369154626.db2.gz	NTHPWNOTVKEJAB-QZTJIDSGSA-N	0	3	336.520	3.111	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)C[C@H]2CCOc3ccccc32)CC1	ZINC001113184665	1369250847	/nfs/dbraw/zinc/25/08/47/1369250847.db2.gz	RSPFDTJOHYUVQI-QZTJIDSGSA-N	0	3	342.483	3.442	20	30		EGEDHN
C=CCCC(=O)N1CCC(NCc2ccn(C(CC)CC)n2)CC1	ZINC001199725869	1369262071	/nfs/dbraw/zinc/26/20/71/1369262071.db2.gz	DXAOWCPTKHBVHK-UHFFFAOYSA-N	0	3	332.492	3.291	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)CCCOCc2ccccc2)CC1	ZINC001113279708	1369313383	/nfs/dbraw/zinc/31/33/83/1369313383.db2.gz	CFYHFXMQHUBZHB-LJQANCHMSA-N	0	3	344.499	3.482	20	30		EGEDHN
C=CCCCC(=O)N1CCN(C[C@H]2CCc3ccccc3C2)CC1	ZINC001113282374	1369316198	/nfs/dbraw/zinc/31/61/98/1369316198.db2.gz	YWMVQLKBEPMOSP-SFHVURJKSA-N	0	3	326.484	3.292	20	30		EGEDHN
N#Cc1cccc2c(NC(=S)NCCN3CCCCC3)cccc12	ZINC001200430728	1369365467	/nfs/dbraw/zinc/36/54/67/1369365467.db2.gz	FQECPUAKPWMQCK-UHFFFAOYSA-N	0	3	338.480	3.484	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)c2ccc(C(C)C)[nH]c2=O)CC1	ZINC001113406122	1369403981	/nfs/dbraw/zinc/40/39/81/1369403981.db2.gz	WAGDKOATQVNRLB-HNNXBMFYSA-N	0	3	331.460	3.023	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)Cc2csc(C(C)(C)C)n2)CC1	ZINC001113433695	1369424344	/nfs/dbraw/zinc/42/43/44/1369424344.db2.gz	ZOEHBNWZLWXFLM-HNNXBMFYSA-N	0	3	349.544	3.482	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCCO[C@@H](CNCc2ccccc2F)C1	ZINC001201209671	1369496673	/nfs/dbraw/zinc/49/66/73/1369496673.db2.gz	CAQXXFLEZATZAG-WMZOPIPTSA-N	0	3	348.462	3.135	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)C[C@@H]2OCc3ccccc32)CC1	ZINC001113591937	1369505011	/nfs/dbraw/zinc/50/50/11/1369505011.db2.gz	SGQADCLRQSHGAY-APWZRJJASA-N	0	3	328.456	3.147	20	30		EGEDHN
CC(C)C[C@@H](C)CN1CCN(C(=O)CC#Cc2ccccc2)CC1	ZINC001113668647	1369556183	/nfs/dbraw/zinc/55/61/83/1369556183.db2.gz	SHWKGSZDOABYSW-LJQANCHMSA-N	0	3	326.484	3.255	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)CCc2cc(F)ccc2F)CC1	ZINC001113681134	1369563379	/nfs/dbraw/zinc/56/33/79/1369563379.db2.gz	GOADJYYKFJSXIS-HNNXBMFYSA-N	0	3	336.426	3.396	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)CCc2cccc(F)c2F)CC1	ZINC001113732875	1369594085	/nfs/dbraw/zinc/59/40/85/1369594085.db2.gz	CFZDUGBRZOSKIC-OAHLLOKOSA-N	0	3	336.426	3.396	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC1CCN(C(=O)CCCC2CC2)CC1	ZINC001202084396	1369683781	/nfs/dbraw/zinc/68/37/81/1369683781.db2.gz	BUBMXUVIWFXDHR-UHFFFAOYSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001202107591	1369688605	/nfs/dbraw/zinc/68/86/05/1369688605.db2.gz	BMQXMXVORNNXRP-HNNXBMFYSA-N	0	3	343.446	3.380	20	30		EGEDHN
CCC(=O)N[C@@H]1C[C@H](NCC#Cc2ccc(Cl)cc2)C12CCC2	ZINC001202259472	1369724115	/nfs/dbraw/zinc/72/41/15/1369724115.db2.gz	NMKOISVIQPQCOL-DLBZAZTESA-N	0	3	330.859	3.119	20	30		EGEDHN
C=CCCCC(=O)N1CCC(NCc2cc(O)ccc2Cl)CC1	ZINC001202273922	1369727266	/nfs/dbraw/zinc/72/72/66/1369727266.db2.gz	VDIAGJFCHFLDGU-UHFFFAOYSA-N	0	3	336.863	3.483	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC(NCc3conc3CC)CC2)CC1	ZINC001202358758	1369748191	/nfs/dbraw/zinc/74/81/91/1369748191.db2.gz	FNSHHMDAWQOTHR-UHFFFAOYSA-N	0	3	331.460	3.064	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC(NCc3oc(CC)nc3C)CC2)CC1	ZINC001202365634	1369751549	/nfs/dbraw/zinc/75/15/49/1369751549.db2.gz	QSEXFDQFDDGZGO-UHFFFAOYSA-N	0	3	345.487	3.372	20	30		EGEDHN
CC(C)=CC(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C12CCC2	ZINC001202385061	1369757322	/nfs/dbraw/zinc/75/73/22/1369757322.db2.gz	WYUJUGJYCKBFHY-ROUUACIJSA-N	0	3	341.430	3.181	20	30		EGEDHN
CC(C)=CC(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C12CCC2	ZINC001202385059	1369757530	/nfs/dbraw/zinc/75/75/30/1369757530.db2.gz	WYUJUGJYCKBFHY-MSOLQXFVSA-N	0	3	341.430	3.181	20	30		EGEDHN
CC(C)C(=O)N[C@H]1C[C@H](NCC#Cc2ccccc2Cl)C12CCC2	ZINC001202458183	1369777526	/nfs/dbraw/zinc/77/75/26/1369777526.db2.gz	BLEHDADESVKWSB-ROUUACIJSA-N	0	3	344.886	3.365	20	30		EGEDHN
CC(C)(C)CC(=O)N[C@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202502496	1369792963	/nfs/dbraw/zinc/79/29/63/1369792963.db2.gz	UYRUZFUJRKKPSB-MOPGFXCFSA-N	0	3	338.495	3.491	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@@H](NCc2nc(C)c(C)s2)C12CCC2	ZINC001202592182	1369815745	/nfs/dbraw/zinc/81/57/45/1369815745.db2.gz	RZIIYHWPDZCLKI-HUUCEWRRSA-N	0	3	333.501	3.243	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C12CCC2	ZINC001202600396	1369819239	/nfs/dbraw/zinc/81/92/39/1369819239.db2.gz	UAWHAPGKFROLCZ-ROUUACIJSA-N	0	3	341.430	3.181	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1C[C@@H](NCc2ccncc2Cl)C12CCC2	ZINC001202844883	1369905616	/nfs/dbraw/zinc/90/56/16/1369905616.db2.gz	AEGGUSBXCJINGD-SJORKVTESA-N	0	3	345.874	3.056	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1C[C@@H](NCc2cc(C)ccc2F)C12CCC2	ZINC001202846013	1369906700	/nfs/dbraw/zinc/90/67/00/1369906700.db2.gz	HGHADEYWMHGUCT-RTBURBONSA-N	0	3	342.458	3.455	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1C[C@H](NCc2cnoc2C)C12CCC2	ZINC001202952646	1369935424	/nfs/dbraw/zinc/93/54/24/1369935424.db2.gz	YFKUGMUYDDTECC-ROUUACIJSA-N	0	3	343.471	3.268	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1C[C@H](NCc2ccc(F)cn2)C12CCC2	ZINC001202960212	1369937257	/nfs/dbraw/zinc/93/72/57/1369937257.db2.gz	KSJRUFGPUDBIAE-IRXDYDNUSA-N	0	3	345.462	3.340	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1C[C@H](NCc2oc(C)nc2C)C12CCC2	ZINC001202968133	1369940331	/nfs/dbraw/zinc/94/03/31/1369940331.db2.gz	JHYKKXRPZWHJOU-DLBZAZTESA-N	0	3	345.487	3.411	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1C[C@@H](NCc2ocnc2C)C12CCC2	ZINC001203258609	1370046313	/nfs/dbraw/zinc/04/63/13/1370046313.db2.gz	SPOWMCNYIHLTMP-HZPDHXFCSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1C[C@H](NCc2ccccn2)C12CCC2	ZINC001203259977	1370046672	/nfs/dbraw/zinc/04/66/72/1370046672.db2.gz	ZMDFSTRQPUQERC-DLBZAZTESA-N	0	3	327.472	3.201	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1C[C@@H](NCc2c(C)noc2C)C12CCC2	ZINC001203338953	1370089091	/nfs/dbraw/zinc/08/90/91/1370089091.db2.gz	DQXABRJOVBJDAB-IAGOWNOFSA-N	0	3	331.460	3.165	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2C[C@@H](NCc3conc3C)C23CCC3)CCC1	ZINC001203366945	1370100694	/nfs/dbraw/zinc/10/06/94/1370100694.db2.gz	PYYRHAYCYZFPNT-IAGOWNOFSA-N	0	3	343.471	3.246	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2C[C@H](NCc3cnc(C)o3)C23CCC3)CC1	ZINC001203374057	1370103478	/nfs/dbraw/zinc/10/34/78/1370103478.db2.gz	JTZFAARGGPUZJD-DLBZAZTESA-N	0	3	343.471	3.246	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1C[C@H](NCc2ccccn2)C12CCC2	ZINC001203450613	1370130463	/nfs/dbraw/zinc/13/04/63/1370130463.db2.gz	CUCUHCMKPZABHR-IRXDYDNUSA-N	0	3	327.472	3.201	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1C[C@@H](NCc2cnoc2C)C12CCC2	ZINC001203451025	1370131120	/nfs/dbraw/zinc/13/11/20/1370131120.db2.gz	HMKDEGQSOHKBQO-HZPDHXFCSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1C[C@@H](NCc2ocnc2C)C12CCC2	ZINC001203451034	1370131435	/nfs/dbraw/zinc/13/14/35/1370131435.db2.gz	HQQUDMSJTBGUDM-HZPDHXFCSA-N	0	3	331.460	3.102	20	30		EGEDHN
CCC[C@H](C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21)C(C)C	ZINC001114904289	1370139608	/nfs/dbraw/zinc/13/96/08/1370139608.db2.gz	RHJMBHOSPLSQTM-VNTMZGSJSA-N	0	3	339.483	3.177	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)CCc2cccs2)C12CCC2	ZINC001203712341	1370231600	/nfs/dbraw/zinc/23/16/00/1370231600.db2.gz	PBWICLNOZGJIDF-LSDHHAIUSA-N	0	3	338.904	3.450	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)CCc2cccs2)C12CCC2	ZINC001203712331	1370231643	/nfs/dbraw/zinc/23/16/43/1370231643.db2.gz	PBWICLNOZGJIDF-CABCVRRESA-N	0	3	338.904	3.450	20	30		EGEDHN
Cc1c[nH]cc1C(=O)N[C@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001203720466	1370234723	/nfs/dbraw/zinc/23/47/23/1370234723.db2.gz	DIGCSWURTZNNAE-UXHICEINSA-N	0	3	347.462	3.005	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@]3(C[C@H](OCC4CC4)CO3)C2)c1	ZINC001203756803	1370250739	/nfs/dbraw/zinc/25/07/39/1370250739.db2.gz	CYFCVMIIURQJNY-VQTJNVASSA-N	0	3	326.440	3.108	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@@H]1CCN(Cc1ccc(OC)c(F)c1)C2	ZINC001203793108	1370268253	/nfs/dbraw/zinc/26/82/53/1370268253.db2.gz	PTILCZAGXGNVGN-WOJBJXKFSA-N	0	3	349.446	3.408	20	30		EGEDHN
C[C@@H](CC(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21)C(C)(C)C	ZINC001115172885	1370325891	/nfs/dbraw/zinc/32/58/91/1370325891.db2.gz	YGGJOBQFELCDHF-FEUVXWNVSA-N	0	3	339.483	3.177	20	30		EGEDHN
O=C(NCC1(NCC#Cc2ccccc2)CCCCC1)c1ccncc1	ZINC001115381618	1370420522	/nfs/dbraw/zinc/42/05/22/1370420522.db2.gz	FDWVMJFUPRYYNA-UHFFFAOYSA-N	0	3	347.462	3.156	20	30		EGEDHN
CCCCCCCCOc1ccc(CN2C[C@H](O)[C@H](CO)C2)cc1	ZINC001204311955	1370440285	/nfs/dbraw/zinc/44/02/85/1370440285.db2.gz	NAFXEBDNUGRXTE-ICSRJNTNSA-N	0	3	335.488	3.211	20	30		EGEDHN
CC/C=C(\C)C(=O)N1CCC(CNCc2ccccc2C#N)CC1	ZINC001204662021	1370539191	/nfs/dbraw/zinc/53/91/91/1370539191.db2.gz	JZUIFCLPKJUHPE-OMCISZLKSA-N	0	3	325.456	3.243	20	30		EGEDHN
C=CCCC(=O)N1CCC(CNCc2cc(O)ccc2Cl)CC1	ZINC001204752973	1370566698	/nfs/dbraw/zinc/56/66/98/1370566698.db2.gz	CCVPDIWHILOIFJ-UHFFFAOYSA-N	0	3	336.863	3.340	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2onc(C)c2C)CCCCC1	ZINC001115587521	1370587801	/nfs/dbraw/zinc/58/78/01/1370587801.db2.gz	BTPLOEHWPUMXNZ-UHFFFAOYSA-N	0	3	325.840	3.066	20	30		EGEDHN
C#CCCCCC(=O)N1CCC(CNC/C(Cl)=C\Cl)CC1	ZINC001205027778	1370633426	/nfs/dbraw/zinc/63/34/26/1370633426.db2.gz	ZPZQXXHMSCAQPR-RVDMUPIBSA-N	0	3	331.287	3.327	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC1(NCc2cnc(C)cn2)CCCCC1	ZINC001115663523	1370646683	/nfs/dbraw/zinc/64/66/83/1370646683.db2.gz	ROMGUCGNPUCBJI-UHFFFAOYSA-N	0	3	344.503	3.296	20	30		EGEDHN
C=CC(C)(C)CC(=O)N(Cc1ccccc1)[C@@H]1CN(C(C)C)C[C@H]1O	ZINC001205144617	1370663204	/nfs/dbraw/zinc/66/32/04/1370663204.db2.gz	IBLBLQSUDJELFD-RTBURBONSA-N	0	3	344.499	3.071	20	30		EGEDHN
CC(C)(C)c1ccc(-c2noc([C@H]3CCNC[C@H]3F)n2)c(C#N)c1	ZINC001205218771	1370684963	/nfs/dbraw/zinc/68/49/63/1370684963.db2.gz	ITQHNVAPJGLXPW-LSDHHAIUSA-N	0	3	328.391	3.321	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)C2(CC)CC2)CCCCC1	ZINC001115713722	1370693068	/nfs/dbraw/zinc/69/30/68/1370693068.db2.gz	YMPJPVGMVOBAPR-UHFFFAOYSA-N	0	3	343.309	3.494	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H](CC(C)C)OC)CCCCC1	ZINC001115717010	1370696910	/nfs/dbraw/zinc/69/69/10/1370696910.db2.gz	LCPWGBQHSSQKCQ-HNNXBMFYSA-N	0	3	330.900	3.209	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](c2ccc(F)cc2)[C@H](NCCF)C1	ZINC001205269754	1370701099	/nfs/dbraw/zinc/70/10/99/1370701099.db2.gz	DNEMLBZSFLRPHJ-RBUKOAKNSA-N	0	3	348.437	3.263	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C(F)=C(C)C)CC[C@H]1c1ccc(F)cc1	ZINC001205269939	1370701135	/nfs/dbraw/zinc/70/11/35/1370701135.db2.gz	IOUXYSFOEUCJET-ZWKOTPCHSA-N	0	3	346.421	3.387	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C2(C)CCC2)CC[C@H]1c1ccc(F)cc1	ZINC001205299742	1370712040	/nfs/dbraw/zinc/71/20/40/1370712040.db2.gz	BGEAKSZUEFHJLT-RBUKOAKNSA-N	0	3	342.458	3.313	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)CC(C)=C(C)C)CC[C@H]1c1ccc(F)cc1	ZINC001205300733	1370712564	/nfs/dbraw/zinc/71/25/64/1370712564.db2.gz	UAWJLYXQOBBESS-VQTJNVASSA-N	0	3	342.458	3.479	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@H]2CC=CCC2)C[C@H]1c1cccc(F)c1	ZINC001205354706	1370729938	/nfs/dbraw/zinc/72/99/38/1370729938.db2.gz	IYHOPOOBYZBZSN-FFZOFVMBSA-N	0	3	340.442	3.089	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)/C=C\C(C)(C)C)C[C@H]1c1cccc(F)c1	ZINC001205387653	1370740016	/nfs/dbraw/zinc/74/00/16/1370740016.db2.gz	IHAJLZDIQAKTCN-MWLUNVDJSA-N	0	3	342.458	3.335	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C(C)(C)C(C)C)C[C@H]1c1cccc(F)c1	ZINC001205409888	1370746613	/nfs/dbraw/zinc/74/66/13/1370746613.db2.gz	LWCZBYUUOJRWDE-RBUKOAKNSA-N	0	3	344.474	3.415	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@@H](c2cccc(F)c2)[C@H](NCC#CC)C1	ZINC001205428468	1370752877	/nfs/dbraw/zinc/75/28/77/1370752877.db2.gz	BIJTZFPCUBFBIX-FFZOFVMBSA-N	0	3	342.458	3.335	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)CCCCC(C)C)[C@@H]3COC[C@@H]32)CC1	ZINC001205513886	1370777402	/nfs/dbraw/zinc/77/74/02/1370777402.db2.gz	VLKZDGCAKKRTOZ-RBUKOAKNSA-N	0	3	348.531	3.328	20	30		EGEDHN
Cn1cc(-c2ccc(CNCc3ccc(OCC#N)cc3)cc2)cn1	ZINC001116872284	1370990979	/nfs/dbraw/zinc/99/09/79/1370990979.db2.gz	ZVBPLUBRXIYPBE-UHFFFAOYSA-N	0	3	332.407	3.279	20	30		EGEDHN
C[C@@H](NCc1cccc(OCC#N)c1)c1ccc(C(=O)N(C)C)cc1	ZINC001117714990	1371068401	/nfs/dbraw/zinc/06/84/01/1371068401.db2.gz	TVBNIWCGAPYXLS-OAHLLOKOSA-N	0	3	337.423	3.142	20	30		EGEDHN
C[C@@H]1CN(CCCc2ccsc2)C[C@H]1NC(=O)C#CC(C)(C)C	ZINC001206950886	1371241899	/nfs/dbraw/zinc/24/18/99/1371241899.db2.gz	NCSXVOMEPMWDCQ-NVXWUHKLSA-N	0	3	332.513	3.167	20	30		EGEDHN
O=C(C1CCCC1)N1CCC[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001207022918	1371269998	/nfs/dbraw/zinc/26/99/98/1371269998.db2.gz	YJBLAJDPMRRXSN-SFHVURJKSA-N	0	3	344.886	3.462	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)CCOc2c(C)cccc2C)C1	ZINC001207351329	1371368728	/nfs/dbraw/zinc/36/87/28/1371368728.db2.gz	IISOTWOXSUUIJG-QZTJIDSGSA-N	0	3	330.472	3.085	20	30		EGEDHN
CCCCC(=O)N1CCC[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207372203	1371377776	/nfs/dbraw/zinc/37/77/76/1371377776.db2.gz	BWNZTOWHXVDPDI-SFHVURJKSA-N	0	3	332.875	3.462	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2CN(Cc3cc(C)sc3C)C[C@H]2C)CCC1	ZINC001207510881	1371420113	/nfs/dbraw/zinc/42/01/13/1371420113.db2.gz	WAWXNUGKZBAXHY-RDTXWAMCSA-N	0	3	344.524	3.495	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2CN(CCCCC(F)(F)F)C[C@H]2C)CCC1	ZINC001207510061	1371420509	/nfs/dbraw/zinc/42/05/09/1371420509.db2.gz	JFVIVZKTDHGEKC-HUUCEWRRSA-N	0	3	344.421	3.349	20	30		EGEDHN
CC/C=C(\C)C(=O)N1CCC[C@@H](NCc2cc(C#N)ccc2OC)C1	ZINC001207566597	1371437439	/nfs/dbraw/zinc/43/74/39/1371437439.db2.gz	ROKCHTWYBTVVDB-PRWGNSRSSA-N	0	3	341.455	3.004	20	30		EGEDHN
CC(C)[C@@H](C)CC(=O)N1CCC[C@H](NCc2ccc(C#N)s2)C1	ZINC001207645407	1371462749	/nfs/dbraw/zinc/46/27/49/1371462749.db2.gz	MROJJXCASRKCPO-GJZGRUSLSA-N	0	3	333.501	3.383	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)C[C@H](C)[C@H]2CCCO2)CCCCC1	ZINC001120062463	1371474422	/nfs/dbraw/zinc/47/44/22/1371474422.db2.gz	NWKCEVFUEOCSCG-GOEBONIOSA-N	0	3	342.911	3.353	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H](OC)C2CCCC2)CCCCC1	ZINC001120075371	1371479718	/nfs/dbraw/zinc/47/97/18/1371479718.db2.gz	YQOAOOMZAMUHPX-INIZCTEOSA-N	0	3	342.911	3.353	20	30		EGEDHN
CC(C)(C)/C=C/C(=O)N1CCC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001207711032	1371482730	/nfs/dbraw/zinc/48/27/30/1371482730.db2.gz	WDNCRYRMOBPWQG-KBOKABMXSA-N	0	3	343.446	3.380	20	30		EGEDHN
O=C(C1CC=CC1)N1CCC[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207727839	1371487085	/nfs/dbraw/zinc/48/70/85/1371487085.db2.gz	IXUWQOSBTKUORU-IBGZPJMESA-N	0	3	342.870	3.238	20	30		EGEDHN
CC1CC(C(=O)N2CCC[C@H](NCC#Cc3ccccc3Cl)C2)C1	ZINC001207783246	1371502107	/nfs/dbraw/zinc/50/21/07/1371502107.db2.gz	XRNDCEKAGRMBIX-VJFUWPCTSA-N	0	3	344.886	3.318	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H](C)C[C@@H]2CCCO2)CCCCC1	ZINC001120226449	1371509283	/nfs/dbraw/zinc/50/92/83/1371509283.db2.gz	MCKMZIVREDNSQK-ZBFHGGJFSA-N	0	3	342.911	3.353	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H]2CCCC[C@H]2OC)CCCCC1	ZINC001120226290	1371509500	/nfs/dbraw/zinc/50/95/00/1371509500.db2.gz	JEMVLHKFBJDRJQ-HZPDHXFCSA-N	0	3	342.911	3.353	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CCCOC(C)C)CCCCC1	ZINC001120246175	1371512950	/nfs/dbraw/zinc/51/29/50/1371512950.db2.gz	XIFIJRUVZHVNOL-UHFFFAOYSA-N	0	3	330.900	3.353	20	30		EGEDHN
C#CCCCCC(=O)N1CCC[C@@H](NCc2ccc(F)c(F)c2)C1	ZINC001207860072	1371521892	/nfs/dbraw/zinc/52/18/92/1371521892.db2.gz	GKGGOGPDASYBGG-MRXNPFEDSA-N	0	3	334.410	3.239	20	30		EGEDHN
C#CCCCCC(=O)N1CCC[C@@H](NCc2cc(F)ccc2OC)C1	ZINC001207862965	1371523160	/nfs/dbraw/zinc/52/31/60/1371523160.db2.gz	CQERMPXJWQOZBJ-GOSISDBHSA-N	0	3	346.446	3.109	20	30		EGEDHN
CC[C@H](C)CC(=O)N1CCC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001207913628	1371537749	/nfs/dbraw/zinc/53/77/49/1371537749.db2.gz	CDGPXTBWIZLDEK-WMLDXEAASA-N	0	3	331.435	3.214	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H](NCc2ccccc2OC2CC2)C1	ZINC001207934241	1371541795	/nfs/dbraw/zinc/54/17/95/1371541795.db2.gz	AFABTSNEWHQZPE-SFHVURJKSA-N	0	3	340.467	3.112	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H](NCc2cccc(Cl)c2F)C1	ZINC001207943568	1371545151	/nfs/dbraw/zinc/54/51/51/1371545151.db2.gz	BEUNUCOHEQYMFQ-OAHLLOKOSA-N	0	3	336.838	3.363	20	30		EGEDHN
CC1(C)CC(C(=O)N2CCC[C@H](NCC#Cc3ccc(F)cc3)C2)C1	ZINC001207966357	1371554305	/nfs/dbraw/zinc/55/43/05/1371554305.db2.gz	VNFGGHVDHSGVAM-IBGZPJMESA-N	0	3	342.458	3.194	20	30		EGEDHN
COc1ccc(Cl)cc1CN[C@H]1CCCN(C(=O)C#CC(C)C)C1	ZINC001208008923	1371566602	/nfs/dbraw/zinc/56/66/02/1371566602.db2.gz	OEWHXKMHKJZBIJ-KRWDZBQOSA-N	0	3	348.874	3.089	20	30		EGEDHN
C=CCOCc1nn(C)c2c1CN(C[C@H]1CCC(C)=C[C@@H]1C)CC2	ZINC001208171157	1371616509	/nfs/dbraw/zinc/61/65/09/1371616509.db2.gz	SODGJQYPHPEOPC-DLBZAZTESA-N	0	3	329.488	3.473	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@@H](NCc2ccnc(Cl)c2)C1	ZINC001208239887	1371676231	/nfs/dbraw/zinc/67/62/31/1371676231.db2.gz	GJACIHMAXSCZGS-OAHLLOKOSA-N	0	3	335.879	3.418	20	30		EGEDHN
O=C(c1cc2occc2[nH]1)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001208255742	1371685134	/nfs/dbraw/zinc/68/51/34/1371685134.db2.gz	QAQBVTQIWVOAGA-KRWDZBQOSA-N	0	3	347.418	3.007	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CN(CCOc2ccccc2)C[C@H]1C	ZINC001208298199	1371705747	/nfs/dbraw/zinc/70/57/47/1371705747.db2.gz	FPMCYCQMGTZGKE-SJLPKXTDSA-N	0	3	330.472	3.104	20	30		EGEDHN
C#CCC1(C(=O)N2CCC[C@H](NCc3ccnc(Cl)c3)C2)CCC1	ZINC001208319352	1371716114	/nfs/dbraw/zinc/71/61/14/1371716114.db2.gz	RKTHLLMPALRLEY-INIZCTEOSA-N	0	3	345.874	3.009	20	30		EGEDHN
O=C([C@H]1CCCC12CC2)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001208414263	1371759362	/nfs/dbraw/zinc/75/93/62/1371759362.db2.gz	LJZPYGBUYCSALQ-WOJBJXKFSA-N	0	3	336.479	3.199	20	30		EGEDHN
C#CCCCC(=O)NC1CC2(CC(NCc3ccncc3Cl)C2)C1	ZINC001121007684	1371833015	/nfs/dbraw/zinc/83/30/15/1371833015.db2.gz	PICFBNJXGLGHEE-UHFFFAOYSA-N	0	3	345.874	3.056	20	30		EGEDHN
O=C(C[C@@H]1C[C@H]1C1CC1)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001208638552	1371849145	/nfs/dbraw/zinc/84/91/45/1371849145.db2.gz	IRVMPENTQXYWNA-HBMCJLEFSA-N	0	3	336.479	3.055	20	30		EGEDHN
C=C(C)CCC(=O)NC1CC2(CC(NCc3oc(C)nc3C)C2)C1	ZINC001121183326	1371881823	/nfs/dbraw/zinc/88/18/23/1371881823.db2.gz	JDIYHJCKAGGOQT-UHFFFAOYSA-N	0	3	331.460	3.165	20	30		EGEDHN
CC(C)(C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1)C1CCC1	ZINC001208779937	1371893922	/nfs/dbraw/zinc/89/39/22/1371893922.db2.gz	CYXGXOLCPLGGLT-HXUWFJFHSA-N	0	3	338.495	3.445	20	30		EGEDHN
N#Cc1cccc(CCCN2CCN(c3ccc(Cl)cn3)CC2)c1	ZINC001208850994	1371918058	/nfs/dbraw/zinc/91/80/58/1371918058.db2.gz	QDYNQZVZGBYGIO-UHFFFAOYSA-N	0	3	340.858	3.361	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC[C@@H](NCc2scnc2C)C1	ZINC001209002920	1371971981	/nfs/dbraw/zinc/97/19/81/1371971981.db2.gz	DWODFAFCMHREMV-MRXNPFEDSA-N	0	3	333.501	3.116	20	30		EGEDHN
C=CCN(CCN1CCC2(COc3ccccc32)CC1)C(=O)OCC	ZINC001209020839	1371975509	/nfs/dbraw/zinc/97/55/09/1371975509.db2.gz	OUJIZSDBJHOOBK-UHFFFAOYSA-N	0	3	344.455	3.057	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC[C@H](NCc2cc(C)ns2)C1	ZINC001209020920	1371977054	/nfs/dbraw/zinc/97/70/54/1371977054.db2.gz	XMWWJMDWSZXYEQ-INIZCTEOSA-N	0	3	333.501	3.116	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC1CC2(CC(NCc3ocnc3C)C2)C1	ZINC001121528533	1372000294	/nfs/dbraw/zinc/00/02/94/1372000294.db2.gz	SJFBMLRQIUQCPY-UHFFFAOYSA-N	0	3	331.460	3.102	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@@H](NCc2cc(F)ccc2OC)C1	ZINC001209112852	1372001913	/nfs/dbraw/zinc/00/19/13/1372001913.db2.gz	WMNKHZWJUYZVHJ-GOSISDBHSA-N	0	3	346.446	3.109	20	30		EGEDHN
C#CCCCCCC(=O)NC1CC2(CC(NCc3nccs3)C2)C1	ZINC001121534678	1372002521	/nfs/dbraw/zinc/00/25/21/1372002521.db2.gz	SPDRFKDBYAEVBI-UHFFFAOYSA-N	0	3	345.512	3.244	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N(C)Cc1ccc(C)s1	ZINC001121594910	1372019329	/nfs/dbraw/zinc/01/93/29/1372019329.db2.gz	DDEPSZQJDGNMGW-HNNXBMFYSA-N	0	3	345.516	3.280	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC1CC2(CC(NCc3ocnc3C)C2)C1	ZINC001121617564	1372027518	/nfs/dbraw/zinc/02/75/18/1372027518.db2.gz	VIZBGAUSLSGILC-PXLHRZOGSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=CCCC1(C(=O)NC2CC3(CC(NCc4cnc(C)o4)C3)C2)CC1	ZINC001121713910	1372056937	/nfs/dbraw/zinc/05/69/37/1372056937.db2.gz	QHEUWCDPVZIZGV-UHFFFAOYSA-N	0	3	343.471	3.246	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@H](NCc2cnn(C(C)(C)C)c2)C1	ZINC001209373480	1372080610	/nfs/dbraw/zinc/08/06/10/1372080610.db2.gz	CAHIPGARDAIJAF-KRWDZBQOSA-N	0	3	332.492	3.075	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC1CC2(C1)CC(N[C@@H](C)c1cnccn1)C2	ZINC001121842124	1372099326	/nfs/dbraw/zinc/09/93/26/1372099326.db2.gz	VLPSIBGWBHVIQB-VPDSAYSTSA-N	0	3	342.487	3.157	20	30		EGEDHN
C=CCCCCCCN1CCO[C@H]2[C@H]1CC[C@H]2COc1ncccn1	ZINC001209436901	1372106407	/nfs/dbraw/zinc/10/64/07/1372106407.db2.gz	ZFHANEIBNWDBQR-IPMKNSEASA-N	0	3	345.487	3.471	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001209456357	1372111442	/nfs/dbraw/zinc/11/14/42/1372111442.db2.gz	ZWORHNGVGLYDDH-CTNGQTDRSA-N	0	3	342.458	3.360	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N(C)Cc1cc(Br)cs1	ZINC001121924734	1372124260	/nfs/dbraw/zinc/12/42/60/1372124260.db2.gz	HVVVHNPSBRFKKI-LBPRGKRZSA-N	0	3	331.279	3.153	20	30		EGEDHN
O=C(N1CCC[C@H](NCC#Cc2cccc(Cl)c2)C1)C1(CF)CC1	ZINC001209576792	1372141852	/nfs/dbraw/zinc/14/18/52/1372141852.db2.gz	ACPFEUATVGVNGO-KRWDZBQOSA-N	0	3	348.849	3.022	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CC[C@H]2CN(CCCc3ccsc3)C[C@H]21	ZINC001187849004	1388177030	/nfs/dbraw/zinc/17/70/30/1388177030.db2.gz	HYLWISOQKBRHNZ-ZWKOTPCHSA-N	0	3	344.524	3.263	20	30		EGEDHN
CC(C)[C@@H]1C[C@@H](C(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)CCO1	ZINC001122449227	1372249386	/nfs/dbraw/zinc/24/93/86/1372249386.db2.gz	SARPWHDRCZDOCJ-RCBQFDQVSA-N	0	3	348.830	3.439	20	30		EGEDHN
CC(C)[C@@H]1C[C@@H](C(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)CCO1	ZINC001122449226	1372249634	/nfs/dbraw/zinc/24/96/34/1372249634.db2.gz	SARPWHDRCZDOCJ-MAZHCROVSA-N	0	3	348.830	3.439	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)C[C@H](C)Cc3cccc(F)c3)[C@@H]2C1	ZINC001187930537	1388192531	/nfs/dbraw/zinc/19/25/31/1388192531.db2.gz	VNHBWRIFVKXBPY-HHXXYDBFSA-N	0	3	330.447	3.113	20	30		EGEDHN
CC(C)C[C@@H](C)C(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001210359415	1372332519	/nfs/dbraw/zinc/33/25/19/1372332519.db2.gz	WNWJESCRBJHRGA-XLIONFOSSA-N	0	3	344.474	3.440	20	30		EGEDHN
O=C([C@@H]1CC12CCCC2)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001210502964	1372368150	/nfs/dbraw/zinc/36/81/50/1372368150.db2.gz	MUSFNCVNMQINCV-PMACEKPBSA-N	0	3	336.479	3.199	20	30		EGEDHN
Cn1c(Cl)cnc1C(C#N)C(=O)CCCOCCc1ccccc1	ZINC001123234664	1372403764	/nfs/dbraw/zinc/40/37/64/1372403764.db2.gz	ZSPISIRRHDRXKN-OAHLLOKOSA-N	0	3	345.830	3.289	20	30		EGEDHN
Cn1c(Cl)cnc1C(C#N)=C([O-])c1ccc(OC(C)(C)C)cn1	ZINC001123336203	1372430796	/nfs/dbraw/zinc/43/07/96/1372430796.db2.gz	DUKPMJGRTDLKTP-LLVKDONJSA-N	0	3	332.791	3.136	20	30		EGEDHN
Cn1c(Cl)cnc1C(C#N)C(=O)c1ccc(OC(C)(C)C)cn1	ZINC001123336203	1372430799	/nfs/dbraw/zinc/43/07/99/1372430799.db2.gz	DUKPMJGRTDLKTP-LLVKDONJSA-N	0	3	332.791	3.136	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)COc2c(C)cc(C)cc2C)C1	ZINC001210815903	1372431836	/nfs/dbraw/zinc/43/18/36/1372431836.db2.gz	DKVFCKZXKCZOHJ-QZTJIDSGSA-N	0	3	330.472	3.003	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C(C)=C2CCCC2)C[C@H]1c1ccccc1	ZINC001211571132	1372582752	/nfs/dbraw/zinc/58/27/52/1372582752.db2.gz	DVEWGLZIDBTYGS-LEWJYISDSA-N	0	3	336.479	3.484	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)C[C@H](C)C(C)C)[C@H](OC)C1	ZINC001212017610	1372647746	/nfs/dbraw/zinc/64/77/46/1372647746.db2.gz	MWHLKYBIYBNSJW-RCCFBDPRSA-N	0	3	326.525	3.454	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@H]2[C@@H]3CCCC[C@@H]32)[C@H](OC)C1	ZINC001212076052	1372654158	/nfs/dbraw/zinc/65/41/58/1372654158.db2.gz	KRLOCNDPOWRJGZ-ZRSRNVLSSA-N	0	3	336.520	3.208	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CN([C@H](C)c2cccc(C)c2)C[C@H]1OC	ZINC001212148184	1372664630	/nfs/dbraw/zinc/66/46/30/1372664630.db2.gz	CHYDTBXBGYLJQO-MISYRCLQSA-N	0	3	342.483	3.065	20	30		EGEDHN
C#CCCC[C@H](N)c1nc(-c2ncccc2/C=C/N2CCCC2)no1	ZINC001212327316	1372687493	/nfs/dbraw/zinc/68/74/93/1372687493.db2.gz	ZMKMTSCRTYYSBF-DKGMDFAASA-N	0	3	337.427	3.001	20	30		EGEDHN
CN1CCN(Cc2ccc(Nc3ccc(OCC#N)cc3)cc2)CC1	ZINC001212608853	1372736745	/nfs/dbraw/zinc/73/67/45/1372736745.db2.gz	JCDBFQOGQPRWTJ-UHFFFAOYSA-N	0	3	336.439	3.080	20	30		EGEDHN
CC[C@@H](NCCNC(=O)[C@@H](C)C#N)c1ccc(Cl)cc1Cl	ZINC001124895533	1372738479	/nfs/dbraw/zinc/73/84/79/1372738479.db2.gz	HNXUVFMUUMFGIY-IINYFYTJSA-N	0	3	328.243	3.310	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1CN(CCCCCCC)C[C@H]1OC	ZINC001213273328	1372872845	/nfs/dbraw/zinc/87/28/45/1372872845.db2.gz	KURAHNGJOLORNG-RTBURBONSA-N	0	3	336.520	3.356	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CN([C@H](C)c2ccccc2C)C[C@H]1OC	ZINC001213303713	1372879690	/nfs/dbraw/zinc/87/96/90/1372879690.db2.gz	WQLQSWPKQXPIBN-MISYRCLQSA-N	0	3	342.483	3.065	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1CN(Cc2cc(C)ccc2C)C[C@H]1OC	ZINC001213320571	1372883836	/nfs/dbraw/zinc/88/38/36/1372883836.db2.gz	ZYBGHCHMROBNDB-DFQSSKMNSA-N	0	3	344.499	3.221	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H](NC(=O)c2occc2C(C)C)[C@H](OC)C1	ZINC001213324142	1372884182	/nfs/dbraw/zinc/88/41/82/1372884182.db2.gz	RJBZJRAQYIEXAD-DJIMGWMZSA-N	0	3	334.460	3.187	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@@H]2Cc3ccccc32)[C@H](OC)C1	ZINC001213344231	1372887898	/nfs/dbraw/zinc/88/78/98/1372887898.db2.gz	IHFIRSVBQJTJTP-VAMGGRTRSA-N	0	3	344.499	3.112	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)C(C)(C)C(F)F)[C@H](OC)C1	ZINC001213421351	1372904462	/nfs/dbraw/zinc/90/44/62/1372904462.db2.gz	WIFUJTMEXQSUAY-ZIAGYGMSSA-N	0	3	334.451	3.064	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2c(C)cccc2C)[C@H](OC)C1	ZINC001213474497	1372910351	/nfs/dbraw/zinc/91/03/51/1372910351.db2.gz	JXUBJFQZNVNLCW-RTBURBONSA-N	0	3	344.499	3.479	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CN(CCCC2CCCC2)C[C@H]1OC	ZINC001213497670	1372914539	/nfs/dbraw/zinc/91/45/39/1372914539.db2.gz	AUJBHLZJRYQUKW-QZTJIDSGSA-N	0	3	336.520	3.375	20	30		EGEDHN
N#CC[C@H](C(=O)NC[C@H]1CCCN1Cc1ccccc1)c1ccccc1	ZINC001126213446	1372948938	/nfs/dbraw/zinc/94/89/38/1372948938.db2.gz	BWAUOZHIDJVVSA-RTWAWAEBSA-N	0	3	347.462	3.465	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)[C@H](F)CC2CCCCC2)[C@H](OC)C1	ZINC001213728576	1372952447	/nfs/dbraw/zinc/95/24/47/1372952447.db2.gz	NBJSYIVORLNHSJ-KZNAEPCWSA-N	0	3	340.483	3.077	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H](NC(=O)c2cc3c(s2)CCC3)[C@H](OC)C1	ZINC001213814132	1372966011	/nfs/dbraw/zinc/96/60/11/1372966011.db2.gz	DWEBQNRJFLRGNX-NUEKZKHPSA-N	0	3	348.512	3.021	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)C(CC(C)C)CC(C)C)[C@H](OC)C1	ZINC001213934457	1372982035	/nfs/dbraw/zinc/98/20/35/1372982035.db2.gz	UMOBCDLKDJAJCT-RTBURBONSA-N	0	3	338.536	3.476	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)CCC(C)(C)c2ccccc2)[C@H](OC)C1	ZINC001213977481	1372989509	/nfs/dbraw/zinc/98/95/09/1372989509.db2.gz	HSQNJQIBHZTIAR-RTBURBONSA-N	0	3	344.499	3.136	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](C)[C@H](NCc2cc(Cl)ccc2OC)C1	ZINC001214527376	1373074208	/nfs/dbraw/zinc/07/42/08/1373074208.db2.gz	SVQNUIQVJAZIGE-RHSMWYFYSA-N	0	3	348.874	3.089	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@@H](C)[C@H](N[C@@H]2CCc3c2c(F)ccc3F)C1	ZINC001214584067	1373084897	/nfs/dbraw/zinc/08/48/97/1373084897.db2.gz	MBYJWHBLJDZXSG-FSPWUOQZSA-N	0	3	346.421	3.048	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001214706984	1373105798	/nfs/dbraw/zinc/10/57/98/1373105798.db2.gz	DZDOVSFQRPFMQF-RDTXWAMCSA-N	0	3	343.496	3.325	20	30		EGEDHN
C#CCCCCCC(=O)N1C[C@@H](C)[C@H](NCc2cc(F)cc(F)c2)C1	ZINC001215323208	1373197872	/nfs/dbraw/zinc/19/78/72/1373197872.db2.gz	XZXOQVHEKZXICD-DNVCBOLYSA-N	0	3	348.437	3.485	20	30		EGEDHN
C=C[C@H](CC(=O)N1C[C@@H](C)[C@H](NCc2ccccn2)C1)c1ccccc1	ZINC001216811288	1373345535	/nfs/dbraw/zinc/34/55/35/1373345535.db2.gz	DWKYMCAYHWRSHO-DBXWQHBBSA-N	0	3	349.478	3.378	20	30		EGEDHN
CCCCCCCCOCC(=O)NCCNCc1cccc(C#N)c1	ZINC001129523125	1373394136	/nfs/dbraw/zinc/39/41/36/1373394136.db2.gz	UGPLWFVDDFUJBZ-UHFFFAOYSA-N	0	3	345.487	3.141	20	30		EGEDHN
CC(C)(C)c1ccc(-c2noc(-c3noc4c3CNCC4)n2)c(C#N)c1	ZINC001217213002	1373407937	/nfs/dbraw/zinc/40/79/37/1373407937.db2.gz	IYUKSKDKMAYBSX-UHFFFAOYSA-N	0	3	349.394	3.206	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2cc3sccc3s2)c1	ZINC001130289171	1373486308	/nfs/dbraw/zinc/48/63/08/1373486308.db2.gz	LQWQLIXYSLQFSD-UHFFFAOYSA-N	0	3	341.461	3.354	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NCCNCc1ccc(F)c(F)c1	ZINC001130374641	1373510121	/nfs/dbraw/zinc/51/01/21/1373510121.db2.gz	ZOZZEXJVBJXNKK-UHFFFAOYSA-N	0	3	346.377	3.049	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2OCCN(C(=O)c3cccc(F)c3C)[C@H]2C1	ZINC001217953299	1373518413	/nfs/dbraw/zinc/51/84/13/1373518413.db2.gz	CXUYJWCQVOMCKU-ZOCIIQOWSA-N	0	3	346.446	3.014	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)C2(C)CCCCCC2)C1	ZINC001130396071	1373519174	/nfs/dbraw/zinc/51/91/74/1373519174.db2.gz	WOOCOLKPHJOALE-INIZCTEOSA-N	0	3	344.503	3.362	20	30		EGEDHN
CC1(C(=O)NCCNCc2ccc(C#N)s2)CCC(F)(F)CC1	ZINC001130409073	1373523915	/nfs/dbraw/zinc/52/39/15/1373523915.db2.gz	UDZPWZGJRWNHNE-UHFFFAOYSA-N	0	3	341.427	3.041	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCO[C@@H]2CN(CC/C=C/CCC)C[C@@H]21	ZINC001217997435	1373530665	/nfs/dbraw/zinc/53/06/65/1373530665.db2.gz	FIHXLPWGEAXCHH-CWDJHMJFSA-N	0	3	334.504	3.247	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2OCCN(C(=O)c3sc(C)cc3C)[C@H]2C1	ZINC001217998169	1373531280	/nfs/dbraw/zinc/53/12/80/1373531280.db2.gz	USGZDGFANOHHJU-HYVNUMGLSA-N	0	3	348.512	3.245	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)[C@H](CCC)CC(C)C)C1	ZINC001130452464	1373544922	/nfs/dbraw/zinc/54/49/22/1373544922.db2.gz	FWRDJNQQSWICHO-SJORKVTESA-N	0	3	346.519	3.464	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)C2(C)CCC(C)CC2)C1	ZINC001130452312	1373545065	/nfs/dbraw/zinc/54/50/65/1373545065.db2.gz	ATKXEWLADNNTCG-NGEICVOHSA-N	0	3	344.503	3.218	20	30		EGEDHN
C=C1CC[NH2+]C[C@@H]1Oc1cc2c(cc1[O-])oc(=O)cc2-c1ccccc1	ZINC001218205913	1373578261	/nfs/dbraw/zinc/57/82/61/1373578261.db2.gz	IJMLWRJRRYYLJY-FQEVSTJZSA-N	0	3	349.386	3.463	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@@H](C)CCCCCC)C[C@H]1c1cn(C)cn1	ZINC001130698755	1373581901	/nfs/dbraw/zinc/58/19/01/1373581901.db2.gz	SCQMUUPDJZVFCJ-JENIJYKNSA-N	0	3	346.519	3.097	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)C[C@H](CC)CCCC)[C@H]2C1	ZINC001218332414	1373598230	/nfs/dbraw/zinc/59/82/30/1373598230.db2.gz	IGAGHAREPUZFIH-CEXWTWQISA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)[C@H]3CCCC3(C)C)[C@H]2C1	ZINC001218447699	1373614872	/nfs/dbraw/zinc/61/48/72/1373614872.db2.gz	KTHGHPRZDMXUSA-CEXWTWQISA-N	0	3	348.531	3.471	20	30		EGEDHN
CC#CCCCC(=O)N1CCO[C@@H]2CN(CCCC3CCCC3)C[C@@H]21	ZINC001218490954	1373624924	/nfs/dbraw/zinc/62/49/24/1373624924.db2.gz	XJBJXFQOBBVMOO-VQTJNVASSA-N	0	3	346.515	3.062	20	30		EGEDHN
N#Cc1ccnc(NC(=O)C[C@@H](N)c2ccc(C(F)(F)F)cc2)c1	ZINC001218503739	1373626949	/nfs/dbraw/zinc/62/69/49/1373626949.db2.gz	IWYZWKLFVQWZIO-CYBMUJFWSA-N	0	3	334.301	3.001	20	30		EGEDHN
C=C1CCC(C(=O)N2CCO[C@@H]3CN(CC/C=C/CC)C[C@@H]32)CC1	ZINC001218591054	1373634604	/nfs/dbraw/zinc/63/46/04/1373634604.db2.gz	TVBUOGMRHYLRNR-WWAPKCSDSA-N	0	3	332.488	3.001	20	30		EGEDHN
CC(C)=C[C@@H]1[C@H](C(=O)NCCNCc2ccc(C#N)s2)C1(C)C	ZINC001131088935	1373641232	/nfs/dbraw/zinc/64/12/32/1373641232.db2.gz	UGUXYMWWQBCHAV-HZPDHXFCSA-N	0	3	331.485	3.064	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)C[C@H](C)CCCCC)[C@H]2C1	ZINC001218737306	1373649349	/nfs/dbraw/zinc/64/93/49/1373649349.db2.gz	LZKMYYCHKGCRRY-CEXWTWQISA-N	0	3	336.520	3.471	20	30		EGEDHN
C[C@H]1CCN[C@@H](C(=O)Nc2nc(-c3ccc(C#N)s3)cs2)C1	ZINC001218787938	1373654536	/nfs/dbraw/zinc/65/45/36/1373654536.db2.gz	OIPBDHYICLRCQY-GXSJLCMTSA-N	0	3	332.454	3.070	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2OCCN(C(=O)c3cccc(Cl)c3)[C@H]2C1	ZINC001219004259	1373677257	/nfs/dbraw/zinc/67/72/57/1373677257.db2.gz	CMVWQNCAFXNCAE-JCGIZDLHSA-N	0	3	348.874	3.220	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2OCCN(C(=O)c3cc(C)c(C)s3)[C@H]2C1	ZINC001219022986	1373680209	/nfs/dbraw/zinc/68/02/09/1373680209.db2.gz	CRPUFRXSJIXBEP-HYVNUMGLSA-N	0	3	348.512	3.245	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)C[C@@H](C)C3CC3)[C@H]2C1	ZINC001219053694	1373683086	/nfs/dbraw/zinc/68/30/86/1373683086.db2.gz	KDJBFLYRYBDTJR-NZSAHSFTSA-N	0	3	336.520	3.305	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)CCCC(C)(C)C)C[C@@H](C)O2	ZINC001131642566	1373740233	/nfs/dbraw/zinc/74/02/33/1373740233.db2.gz	RRKRLKYBWAXZLN-YLJYHZDGSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCCCN1CC[C@@H]2CN(C(=O)c3conc3C3CCCC3)[C@@H]2C1	ZINC001221605824	1373784189	/nfs/dbraw/zinc/78/41/89/1373784189.db2.gz	FGZOYDOGXFQTGY-SJLPKXTDSA-N	0	3	343.471	3.445	20	30		EGEDHN
N#Cc1cc(CNC2(CNC(=O)CC3CCC3)CCC2)ccc1F	ZINC001326801128	1388314744	/nfs/dbraw/zinc/31/47/44/1388314744.db2.gz	ATIWMTXDMYZROF-UHFFFAOYSA-N	0	3	329.419	3.016	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@@H](C)N(Cc2cccc(N(C)C)c2)C1	ZINC001131900489	1375037510	/nfs/dbraw/zinc/03/75/10/1375037510.db2.gz	YUCPIRRTISVABX-SJLPKXTDSA-N	0	3	329.488	3.188	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1CC[C@@H](C)N(CCc2scnc2C)C1	ZINC001131971141	1375075838	/nfs/dbraw/zinc/07/58/38/1375075838.db2.gz	CKCSWTAVKAQNFT-WBVHZDCISA-N	0	3	347.528	3.157	20	30		EGEDHN
CCc1ccc(CN2C[C@@H](NC(=O)C#CC(C)C)CC[C@H]2C)cc1	ZINC001132022123	1375103686	/nfs/dbraw/zinc/10/36/86/1375103686.db2.gz	VGWSXIQMFXEFMS-XLIONFOSSA-N	0	3	326.484	3.378	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H]1CC[C@@H](C)N(CCOC2CCC2)C1	ZINC001132079395	1375136137	/nfs/dbraw/zinc/13/61/37/1375136137.db2.gz	XZXJIWZOBLDDSZ-UKRRQHHQSA-N	0	3	342.911	3.303	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1CC[C@@H](C)N(CCOC2CCC2)C1	ZINC001132240221	1375235431	/nfs/dbraw/zinc/23/54/31/1375235431.db2.gz	CYBKRDJQCLYGLX-QZTJIDSGSA-N	0	3	334.504	3.108	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2cc[nH]c2C2CCC2)CC[C@H]1C	ZINC001132306225	1375286124	/nfs/dbraw/zinc/28/61/24/1375286124.db2.gz	TYRBITDPMVTEGG-NVXWUHKLSA-N	0	3	345.487	3.068	20	30		EGEDHN
C=CCOCCCC(=O)NC1CCN(C/C=C/c2ccccc2)CC1	ZINC001226761116	1375327327	/nfs/dbraw/zinc/32/73/27/1375327327.db2.gz	ZIHZYDZXYGMGPD-UXBLZVDNSA-N	0	3	342.483	3.263	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2cc3sccc3[nH]2)CC[C@H]1C	ZINC001132403263	1375355684	/nfs/dbraw/zinc/35/56/84/1375355684.db2.gz	UKHRXIKELSTUMI-KGLIPLIRSA-N	0	3	347.484	3.015	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2scnc2Cl)CC[C@H]1C	ZINC001132489974	1375422608	/nfs/dbraw/zinc/42/26/08/1375422608.db2.gz	PMDGYWMDZDJHHH-NEPJUHHUSA-N	0	3	327.881	3.345	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1CC[C@H](C)N(Cc2ccccc2CC)C1	ZINC001132529173	1375443220	/nfs/dbraw/zinc/44/32/20/1375443220.db2.gz	JMULVYCHUJEWAR-FXAWDEMLSA-N	0	3	344.499	3.311	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1CC[C@H](C)N(Cc2cccc(C)c2)C1	ZINC001132529817	1375443816	/nfs/dbraw/zinc/44/38/16/1375443816.db2.gz	RPIGDHPPMRUDLE-HKUYNNGSSA-N	0	3	330.472	3.057	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2(C(F)(F)F)CCCCC2)CC[C@H]1C	ZINC001132543445	1375450980	/nfs/dbraw/zinc/45/09/80/1375450980.db2.gz	YIJYVEBAAOCOBH-CABCVRRESA-N	0	3	344.421	3.492	20	30		EGEDHN
CC#CCN1CC[C@H](CN(Cc2scnc2C)C(=O)/C(C)=C/C)C1	ZINC001132557621	1375463814	/nfs/dbraw/zinc/46/38/14/1375463814.db2.gz	ACHAWGUJWNSGSK-CVDFKLHSSA-N	0	3	345.512	3.092	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCNCc1cccc(C(F)(F)F)c1	ZINC001132575963	1375472795	/nfs/dbraw/zinc/47/27/95/1375472795.db2.gz	FORCFIUFHLZRMJ-CHWSQXEVSA-N	0	3	328.378	3.369	20	30		EGEDHN
CC#CCCCC(=O)NC1CCN(Cc2cc(F)ccc2C)CC1	ZINC001228717813	1375651972	/nfs/dbraw/zinc/65/19/72/1375651972.db2.gz	JUSBYMCGWGDTGA-UHFFFAOYSA-N	0	3	330.447	3.408	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NC1CCN(CCOc2ccc(C)cc2)CC1	ZINC001228750122	1375663427	/nfs/dbraw/zinc/66/34/27/1375663427.db2.gz	WLAKCURNLHXESN-MSOLQXFVSA-N	0	3	344.499	3.413	20	30		EGEDHN
CC#CCCCC(=O)NC1CCN(CCCCC(F)(F)F)CC1	ZINC001228770052	1375670073	/nfs/dbraw/zinc/67/00/73/1375670073.db2.gz	BWLDWBWATTXIFB-UHFFFAOYSA-N	0	3	332.410	3.493	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC1CCN(Cc2ccc(OC)cc2)CC1	ZINC001228810529	1375684678	/nfs/dbraw/zinc/68/46/78/1375684678.db2.gz	WMLQKPWTXDXEPW-INIZCTEOSA-N	0	3	330.472	3.378	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC1CCN(Cc2ccccc2N(C)C)CC1	ZINC001228810428	1375685732	/nfs/dbraw/zinc/68/57/32/1375685732.db2.gz	VPFMRIXQUXLSSF-QGZVFWFLSA-N	0	3	343.515	3.436	20	30		EGEDHN
C=CCCCC(=O)NC1CCN(C[C@H](OC)c2ccccc2)CC1	ZINC001228928128	1375719491	/nfs/dbraw/zinc/71/94/91/1375719491.db2.gz	WCNYSVOAUHZPCG-IBGZPJMESA-N	0	3	330.472	3.311	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](C)[C@H](CNCc2csc(C)n2)C1	ZINC001133059311	1375750259	/nfs/dbraw/zinc/75/02/59/1375750259.db2.gz	OHBSLNYRCKLUCT-NVXWUHKLSA-N	0	3	347.528	3.219	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](C)[C@H](CNCc3ocnc3C)C2)CC1	ZINC001133105785	1375777846	/nfs/dbraw/zinc/77/78/46/1375777846.db2.gz	XMLPJMJAIDZCDC-NVXWUHKLSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@H](C)[C@@H](CNCc3nccs3)C2)CC1	ZINC001133105517	1375778554	/nfs/dbraw/zinc/77/85/54/1375778554.db2.gz	UTQCPXFUYMWIOB-HOTGVXAUSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](C)[C@H](CNCc2nccs2)C1	ZINC001133142223	1375804099	/nfs/dbraw/zinc/80/40/99/1375804099.db2.gz	MHQAPDVSHRGJLJ-HUUCEWRRSA-N	0	3	335.517	3.320	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2ccc(C(C)(C)C)cc2)CC1	ZINC001230108466	1375945241	/nfs/dbraw/zinc/94/52/41/1375945241.db2.gz	XIFOFMLPUGEBRW-UHFFFAOYSA-N	0	3	344.499	3.381	20	30		EGEDHN
C=CCCC1(C(=O)NCCNCc2ccc(OC)c(Cl)c2)CC1	ZINC001133368813	1375951330	/nfs/dbraw/zinc/95/13/30/1375951330.db2.gz	IFCRZVSWRNYBOF-UHFFFAOYSA-N	0	3	336.863	3.301	20	30		EGEDHN
C=CC(C)(C)C(=O)N(CCNCCF)Cc1cccc(Cl)c1	ZINC001133403671	1375988200	/nfs/dbraw/zinc/98/82/00/1375988200.db2.gz	DFQUZGAVQFIVQJ-UHFFFAOYSA-N	0	3	326.843	3.440	20	30		EGEDHN
C=CCC[C@@H](C(=O)NC1CCN(CCOCC)CC1)c1ccccc1	ZINC001230479723	1376036343	/nfs/dbraw/zinc/03/63/43/1376036343.db2.gz	RVGJPUBTMQOFJI-HXUWFJFHSA-N	0	3	344.499	3.354	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1C1CCN(C(=O)COC(C)(C)C)CC1	ZINC001230552319	1376073523	/nfs/dbraw/zinc/07/35/23/1376073523.db2.gz	MVMXVRBWPJDBGR-INIZCTEOSA-N	0	3	342.911	3.257	20	30		EGEDHN
C#CCCN(CCCNC(=O)[C@@H](CC)CCC)Cc1cccnc1	ZINC001230881585	1376174916	/nfs/dbraw/zinc/17/49/16/1376174916.db2.gz	HZSIBYWIEAMUSN-IBGZPJMESA-N	0	3	329.488	3.240	20	30		EGEDHN
Cc1ncc(C(=O)N[C@@H](C)C[C@@H](C)NCc2ccccc2C#N)s1	ZINC001133871111	1376244339	/nfs/dbraw/zinc/24/43/39/1376244339.db2.gz	HKZFWMKLFPGAOT-OLZOCXBDSA-N	0	3	342.468	3.010	20	30		EGEDHN
C=CCOCC(=O)N[C@@H](C)C[C@H](C)NCc1cccc(F)c1Cl	ZINC001133910061	1376261311	/nfs/dbraw/zinc/26/13/11/1376261311.db2.gz	VIYUPKGIQHLKLL-STQMWFEESA-N	0	3	342.842	3.055	20	30		EGEDHN
CN1C(=O)CC[C@@H]2[C@H]1CCN2Cc1ccccc1C#Cc1ccccc1	ZINC001231577214	1376268398	/nfs/dbraw/zinc/26/83/98/1376268398.db2.gz	QVNKOUYDUYBIPW-FGZHOGPDSA-N	0	3	344.458	3.282	20	30		EGEDHN
C=CCOc1cccc(CN2CCC3(CCN(C(C)C)C3=O)CC2)c1	ZINC001231624521	1376286057	/nfs/dbraw/zinc/28/60/57/1376286057.db2.gz	OMQOGOHRHSRNIG-UHFFFAOYSA-N	0	3	342.483	3.474	20	30		EGEDHN
C=CCOCCCC(=O)N[C@H](C)C[C@@H](C)NC/C(Cl)=C/Cl	ZINC001134019122	1376315561	/nfs/dbraw/zinc/31/55/61/1376315561.db2.gz	RUKIKFMLSKRIPH-OFLZDLGMSA-N	0	3	337.291	3.161	20	30		EGEDHN
Cc1nnc(C2CCN(Cc3ccc(N(C)CCC#N)cc3)CC2)o1	ZINC001231821218	1376319354	/nfs/dbraw/zinc/31/93/54/1376319354.db2.gz	UQEXBSXBYJPBMG-UHFFFAOYSA-N	0	3	339.443	3.108	20	30		EGEDHN
C#CCCCCC(=O)N[C@H](C)C[C@H](C)NCc1nc(C)sc1C	ZINC001134119172	1376376864	/nfs/dbraw/zinc/37/68/64/1376376864.db2.gz	MSWVOXYNFDMHFE-UONOGXRCSA-N	0	3	335.517	3.326	20	30		EGEDHN
Cc1nscc1C(=O)N[C@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001134127538	1376382517	/nfs/dbraw/zinc/38/25/17/1376382517.db2.gz	PJRFUQGBSIEIDN-CHWSQXEVSA-N	0	3	342.468	3.010	20	30		EGEDHN
C=CCN1C(=O)CCC[C@@]12CCCN(Cc1ccc(C)nc1C)C2	ZINC001232080653	1376397355	/nfs/dbraw/zinc/39/73/55/1376397355.db2.gz	HBXIUEWBFGUZTO-FQEVSTJZSA-N	0	3	327.472	3.232	20	30		EGEDHN
C#CCCCC(=O)N[C@@H](C)C[C@@H](C)NCc1nc2ccccc2o1	ZINC001134201712	1376415573	/nfs/dbraw/zinc/41/55/73/1376415573.db2.gz	SPFNQFQRSUQKRA-CABCVRRESA-N	0	3	327.428	3.004	20	30		EGEDHN
CCc1occc1C(=O)N[C@@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001134273440	1376448840	/nfs/dbraw/zinc/44/88/40/1376448840.db2.gz	GHEBMFHDSFZDRR-CABCVRRESA-N	0	3	339.439	3.400	20	30		EGEDHN
CCC(CC)n1ccc(CN[C@@H](C)C[C@H](C)NC(=O)C#CC2CC2)n1	ZINC001134317483	1376472733	/nfs/dbraw/zinc/47/27/33/1376472733.db2.gz	JQXJLIPTDUXJNK-HOTGVXAUSA-N	0	3	344.503	3.031	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H](C)C[C@@H](C)NCc1ccn(C(C)C)n1	ZINC001134457108	1376547360	/nfs/dbraw/zinc/54/73/60/1376547360.db2.gz	JTLLQVYHKPLCDW-CVEARBPZSA-N	0	3	334.508	3.439	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H](C)C[C@H](C)NCc1ccn(C(C)C)n1	ZINC001134457111	1376547963	/nfs/dbraw/zinc/54/79/63/1376547963.db2.gz	JTLLQVYHKPLCDW-JKSUJKDBSA-N	0	3	334.508	3.439	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCC[C@](O)(C(F)(F)F)[C@@H](C)C1	ZINC001233080536	1376566182	/nfs/dbraw/zinc/56/61/82/1376566182.db2.gz	NKDNYBVXFRNNAF-XJKSGUPXSA-N	0	3	326.362	3.392	20	30		EGEDHN
COc1cccc(O[C@H]2CCCN(Cc3ccc(C#N)cc3C)C2)n1	ZINC001233083246	1376568232	/nfs/dbraw/zinc/56/82/32/1376568232.db2.gz	BGTQFFHWFFMJPI-SFHVURJKSA-N	0	3	337.423	3.314	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CCN(Cc3cnc(C)c(C)c3)C2)C1	ZINC001233157074	1376576213	/nfs/dbraw/zinc/57/62/13/1376576213.db2.gz	ZWJRDBJZPHAEMP-FQEVSTJZSA-N	0	3	343.471	3.309	20	30		EGEDHN
C=CCOCCCC(=O)N(C)C[C@@H]1CCN1Cc1ccccc1C	ZINC001233491361	1376653933	/nfs/dbraw/zinc/65/39/33/1376653933.db2.gz	XAOHILPJOPNRMH-IBGZPJMESA-N	0	3	330.472	3.011	20	30		EGEDHN
C=CCOCCCC(=O)N(C)C[C@@H]1CCN1CCCC1CCCC1	ZINC001233489897	1376654257	/nfs/dbraw/zinc/65/42/57/1376654257.db2.gz	NCBIODZKIQRSDH-IBGZPJMESA-N	0	3	336.520	3.472	20	30		EGEDHN
N#Cc1nc2cc(O[C@H]3CC[C@H](N4CCOCC4)CC3)ccc2s1	ZINC001233698548	1376698445	/nfs/dbraw/zinc/69/84/45/1376698445.db2.gz	QJIUWVJGBGWZHE-HDJSIYSDSA-N	0	3	343.452	3.190	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1ccccc1C#N)NC(=O)CCC(C)(F)F	ZINC001134761707	1376706746	/nfs/dbraw/zinc/70/67/46/1376706746.db2.gz	RZTJLADJOUJCJE-UONOGXRCSA-N	0	3	337.414	3.367	20	30		EGEDHN
C#CCCCC(=O)N(C)C[C@@H]1CCN1[C@H](CCOC)c1ccccc1	ZINC001233967257	1376745630	/nfs/dbraw/zinc/74/56/30/1376745630.db2.gz	YFPZTXAMBASDPX-VQTJNVASSA-N	0	3	342.483	3.100	20	30		EGEDHN
C=C[C@@](C)(O)CC(=O)N(C)C[C@H]1CCN1Cc1ccccc1C(C)C	ZINC001233978033	1376747649	/nfs/dbraw/zinc/74/76/49/1376747649.db2.gz	QLDWEJDAYIBBAW-WIYYLYMNSA-N	0	3	344.499	3.170	20	30		EGEDHN
COCCN1CCC(Oc2ccc([C@H]3CC(=O)C=C(C)O3)cc2)CC1	ZINC001234165694	1376781587	/nfs/dbraw/zinc/78/15/87/1376781587.db2.gz	LRRJRMHJBFMJEZ-HXUWFJFHSA-N	0	3	345.439	3.111	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1cc(F)ccc1C#N)NC(=O)C1(CCF)CC1	ZINC001135065978	1376877986	/nfs/dbraw/zinc/87/79/86/1376877986.db2.gz	MUXHSULVCWSRMI-UONOGXRCSA-N	0	3	349.425	3.210	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)C1(C2CC2)CCC1	ZINC001135086854	1376888382	/nfs/dbraw/zinc/88/83/82/1376888382.db2.gz	LKMDSIDAORCBBO-QWHCGFSZSA-N	0	3	343.309	3.348	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H](C)C[C@@H](C)NCc2ccccc2C#N)cc1	ZINC001135184313	1376956842	/nfs/dbraw/zinc/95/68/42/1376956842.db2.gz	FSRDUYPGEKXIAO-IAGOWNOFSA-N	0	3	345.446	3.226	20	30		EGEDHN
C=CC1(CC(=O)NCCNCc2ccc(C#N)c(F)c2)CCCCC1	ZINC001135190811	1376963263	/nfs/dbraw/zinc/96/32/63/1376963263.db2.gz	OQPRZUKNROGTBW-UHFFFAOYSA-N	0	3	343.446	3.430	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)C1(C)CCC1)NCc1cc(F)ccc1C#N	ZINC001135206651	1376976477	/nfs/dbraw/zinc/97/64/77/1376976477.db2.gz	CDRKUIOFOVBQJE-ZIAGYGMSSA-N	0	3	331.435	3.260	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2ccn(CC)n2)CC1	ZINC001135381988	1377065443	/nfs/dbraw/zinc/06/54/43/1377065443.db2.gz	CABHVRGRXDQQLX-HOTGVXAUSA-N	0	3	332.492	3.022	20	30		EGEDHN
Cc1ccoc1CC(=O)N[C@@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001135447350	1377100958	/nfs/dbraw/zinc/10/09/58/1377100958.db2.gz	VKMUAHXWDVYCPG-HOTGVXAUSA-N	0	3	339.439	3.075	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H](C)C[C@@H](C)NCC(=C)Br	ZINC001135560137	1377144320	/nfs/dbraw/zinc/14/43/20/1377144320.db2.gz	BYLQXDGRLRJVII-CHWSQXEVSA-N	0	3	331.298	3.370	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1ccc(OC)nc1)[C@@H]2CC	ZINC001137034460	1377462097	/nfs/dbraw/zinc/46/20/97/1377462097.db2.gz	OBWCVCOWRGCIKS-XLIONFOSSA-N	0	3	343.471	3.012	20	30		EGEDHN
CCCCCCCC(=O)N1CCC2(CN(CCn3ccnc3)C2)CC1	ZINC001269075677	1377537197	/nfs/dbraw/zinc/53/71/97/1377537197.db2.gz	NTVLAJSZTHJTNG-UHFFFAOYSA-N	0	3	346.519	3.168	20	30		EGEDHN
CCOc1cccc(CN2CCCN(c3ccc(C#N)cn3)CC2)c1	ZINC001138101056	1377676720	/nfs/dbraw/zinc/67/67/20/1377676720.db2.gz	HOXDWLRLJRKEJL-UHFFFAOYSA-N	0	3	336.439	3.064	20	30		EGEDHN
C=CCN1C(=O)CCC[C@]12CCCN(Cc1c(C)nn(CC)c1C)C2	ZINC001138643392	1377760969	/nfs/dbraw/zinc/76/09/69/1377760969.db2.gz	YJKBDOUOFXWBKC-HXUWFJFHSA-N	0	3	344.503	3.053	20	30		EGEDHN
C=CCOC(=O)N[C@H]1CCCN(Cc2c(C)cc(OC)c(C)c2C)C1	ZINC001138727927	1377774431	/nfs/dbraw/zinc/77/44/31/1377774431.db2.gz	XIOSRPGWLAPKOL-KRWDZBQOSA-N	0	3	346.471	3.497	20	30		EGEDHN
C=CCOC(=O)N[C@@H]1CCCN(Cc2cccc3c2ccn3C)C1	ZINC001139161929	1377841842	/nfs/dbraw/zinc/84/18/42/1377841842.db2.gz	BBQRLAQAMPSENP-MRXNPFEDSA-N	0	3	327.428	3.055	20	30		EGEDHN
N#Cc1ccnc(-c2ccc(CN3CCC4SC(=O)C=C4C3)cc2)c1	ZINC001139402457	1377879160	/nfs/dbraw/zinc/87/91/60/1377879160.db2.gz	RYMYLTNVVZXKGJ-LJQANCHMSA-N	0	3	347.443	3.394	20	30		EGEDHN
N#Cc1ccnc(-c2ccc(CN3CC[C@H]4SC(=O)C=C4C3)cc2)c1	ZINC001139402457	1377879162	/nfs/dbraw/zinc/87/91/62/1377879162.db2.gz	RYMYLTNVVZXKGJ-LJQANCHMSA-N	0	3	347.443	3.394	20	30		EGEDHN
N#Cc1ccc(Oc2ccc(CN3CC(N4CCCC4)C3)cn2)cc1	ZINC001139425455	1377882319	/nfs/dbraw/zinc/88/23/19/1377882319.db2.gz	PCORDQGEZJMDJE-UHFFFAOYSA-N	0	3	334.423	3.026	20	30		EGEDHN
COc1ccc(CCN(Cc2cc(C#N)ccc2F)C[C@@H](C)O)cc1	ZINC001139646679	1377925178	/nfs/dbraw/zinc/92/51/78/1377925178.db2.gz	DJFFTFICCAOSEC-OAHLLOKOSA-N	0	3	342.414	3.131	20	30		EGEDHN
Cc1ccnc(O[C@H]2CCCN(Cc3c[nH]c4c3cccc4C#N)C2)n1	ZINC001139707531	1377938037	/nfs/dbraw/zinc/93/80/37/1377938037.db2.gz	IXPNCYNJIHZZCR-KRWDZBQOSA-N	0	3	347.422	3.181	20	30		EGEDHN
C=CCn1cc(CN2CCC(c3nc4ccccc4n3C)CC2)cn1	ZINC001139772558	1377948948	/nfs/dbraw/zinc/94/89/48/1377948948.db2.gz	KOEBIWUVZLWDCF-UHFFFAOYSA-N	0	3	335.455	3.335	20	30		EGEDHN
N#Cc1cc(F)cc(CN2CCC3(CC2)C(=O)N[C@H]3c2ccccc2)c1	ZINC001139875269	1377969462	/nfs/dbraw/zinc/96/94/62/1377969462.db2.gz	XWRQLKCRJKQIPG-IBGZPJMESA-N	0	3	349.409	3.151	20	30		EGEDHN
CN(CCCCNC(=O)OC(C)(C)C)Cc1cc(F)cc(C#N)c1	ZINC001139878589	1377970079	/nfs/dbraw/zinc/97/00/79/1377970079.db2.gz	PJRQOHCTHLZKPL-UHFFFAOYSA-N	0	3	335.423	3.434	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cc(F)cc(C#N)c1)CC2	ZINC001139876989	1377970162	/nfs/dbraw/zinc/97/01/62/1377970162.db2.gz	TYVKTYFEVXBDOZ-FQEVSTJZSA-N	0	3	341.430	3.230	20	30		EGEDHN
CCN1C(=O)CCC12CCN(Cc1c[nH]c3ccc(C#N)cc13)CC2	ZINC001140111690	1378010510	/nfs/dbraw/zinc/01/05/10/1378010510.db2.gz	CRDAXQWMRMBHAY-UHFFFAOYSA-N	0	3	336.439	3.016	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@@H]1CCN(Cc1cc(F)cc(OC)c1)C2	ZINC001140480614	1378070168	/nfs/dbraw/zinc/07/01/68/1378070168.db2.gz	OPSUHHIYQYNFRH-UXHICEINSA-N	0	3	349.446	3.408	20	30		EGEDHN
C=CCN1C(=O)CC[C@@H]2[C@H]1CCN2Cc1ccc(OC(C)C)cc1	ZINC001273007363	1378084895	/nfs/dbraw/zinc/08/48/95/1378084895.db2.gz	CHOQGODEQIQKBV-RTBURBONSA-N	0	3	328.456	3.225	20	30		EGEDHN
C=C(C)CN1CC2(CCC1=O)CC[NH+](Cc1cc(F)ccc1[O-])CC2	ZINC001273284760	1378094315	/nfs/dbraw/zinc/09/43/15/1378094315.db2.gz	LCJACHIJTKANJW-UHFFFAOYSA-N	0	3	346.446	3.312	20	30		EGEDHN
C#CCN1CC[C@@]2(CCCN(Cc3cccc(Cl)c3F)CC2)C1=O	ZINC001273285289	1378094512	/nfs/dbraw/zinc/09/45/12/1378094512.db2.gz	PJKLIFIZPHNYNJ-IBGZPJMESA-N	0	3	348.849	3.317	20	30		EGEDHN
N#CCCCN1CC[C@@]2(CCN(Cc3cc(F)ccc3Cl)C2)C1=O	ZINC001273374373	1378100784	/nfs/dbraw/zinc/10/07/84/1378100784.db2.gz	MCXGYKVOCRAVJZ-GOSISDBHSA-N	0	3	349.837	3.207	20	30		EGEDHN
Cn1cnc2ccc(CN3CCC[C@H](Oc4ccccc4C#N)C3)cc21	ZINC001140739021	1378127935	/nfs/dbraw/zinc/12/79/35/1378127935.db2.gz	ZKOXYDFTKDGQRA-SFHVURJKSA-N	0	3	346.434	3.488	20	30		EGEDHN
N#CCCCN1CC[C@]2(CCCN2Cc2cccc3cccnc32)C1=O	ZINC001275532667	1378141589	/nfs/dbraw/zinc/14/15/89/1378141589.db2.gz	PUEVJMZIVSFNLQ-OAQYLSRUSA-N	0	3	348.450	3.105	20	30		EGEDHN
C=CCN1CCC2(CCN(Cc3ccc(-n4cccc4)cc3)CC2)C1=O	ZINC001276519707	1378176890	/nfs/dbraw/zinc/17/68/90/1378176890.db2.gz	HFQWHYQSLBEZGU-UHFFFAOYSA-N	0	3	349.478	3.478	20	30		EGEDHN
N#Cc1cccc(N2CCC[C@@]3(C2)CN(C2CCCC2)CCO3)c1	ZINC001276952984	1378196891	/nfs/dbraw/zinc/19/68/91/1378196891.db2.gz	DJQRHYJOENUKJL-HXUWFJFHSA-N	0	3	325.456	3.172	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@@H]1CCN(Cc1cnc(CCCC)[nH]1)C2	ZINC001141068225	1378227033	/nfs/dbraw/zinc/22/70/33/1378227033.db2.gz	BCELKKSZYGYOKB-UYAOXDASSA-N	0	3	347.503	3.326	20	30		EGEDHN
COC[C@@]12CCC[C@@H]1CN(Cc1sc(N)c(C#N)c1Cl)C2	ZINC001141111515	1378241912	/nfs/dbraw/zinc/24/19/12/1378241912.db2.gz	UBDKYJZGXNZRJS-BMIGLBTASA-N	0	3	325.865	3.104	20	30		EGEDHN
CC(C)N1CCN(Cc2cc(Br)ccc2C#N)C[C@@H]1C	ZINC001141907729	1378392833	/nfs/dbraw/zinc/39/28/33/1378392833.db2.gz	LZTDLLBPYLMLOD-ZDUSSCGKSA-N	0	3	336.277	3.235	20	30		EGEDHN
C=CCOC[C@H]1CCC[C@@]12CN(Cc1cccc3n[nH]cc31)CCO2	ZINC001143091337	1378537358	/nfs/dbraw/zinc/53/73/58/1378537358.db2.gz	GIOYBMYXNXZJMG-YLJYHZDGSA-N	0	3	341.455	3.137	20	30		EGEDHN
COc1cc(CN2CCC3SC(=O)C=C3C2)cc(C(F)(F)F)c1	ZINC001143513329	1378606985	/nfs/dbraw/zinc/60/69/85/1378606985.db2.gz	AEWVQKKLWINCLK-AWEZNQCLSA-N	0	3	343.370	3.488	20	30		EGEDHN
COc1ccc(CN2CCC3SC(=O)C=C3C2)cc1C(F)(F)F	ZINC001143639056	1378628600	/nfs/dbraw/zinc/62/86/00/1378628600.db2.gz	MROPZDHSINGEOF-CQSZACIVSA-N	0	3	343.370	3.488	20	30		EGEDHN
C=C(Cc1ccccc1)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC001144405163	1378726594	/nfs/dbraw/zinc/72/65/94/1378726594.db2.gz	FZULDOKNWCXUIL-UHFFFAOYSA-N	0	3	349.478	3.209	20	30		EGEDHN
C#Cc1ccc(CN2CCC3(C[C@H](c4ccccc4)C(=O)N3)CC2)cc1	ZINC001144571660	1378746051	/nfs/dbraw/zinc/74/60/51/1378746051.db2.gz	DHXUAJWICRBKDS-OAQYLSRUSA-N	0	3	344.458	3.306	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2ccn(C)n2)CCCCC1	ZINC001146502252	1378853246	/nfs/dbraw/zinc/85/32/46/1378853246.db2.gz	BUSKVEQLJYVWHT-IRXDYDNUSA-N	0	3	346.519	3.320	20	30		EGEDHN
C=C(Cl)CNCC[C@@H](C)NC(=O)[C@@H](CC)c1c(C)noc1C	ZINC001754006555	1440530795	/nfs/dbraw/zinc/53/07/95/1440530795.db2.gz	TVCPERWPAXTWRH-RISCZKNCSA-N	0	3	327.856	3.022	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CC2(C1)CCN(Cc1csc(C)c1)C2	ZINC001147140912	1378975462	/nfs/dbraw/zinc/97/54/62/1378975462.db2.gz	RUQJUJFTPRVKJS-INIZCTEOSA-N	0	3	348.512	3.072	20	30		EGEDHN
CC(C)C#CC(=O)N1CC2(C1)CCN(Cc1cc3ccccc3o1)C2	ZINC001147499653	1379033373	/nfs/dbraw/zinc/03/33/73/1379033373.db2.gz	YTFVESSEABJKLZ-UHFFFAOYSA-N	0	3	336.435	3.127	20	30		EGEDHN
C=CCCCC(=O)N1CC2(C1)CCN(Cc1ccc(C)c(OC)c1)C2	ZINC001148199528	1379133010	/nfs/dbraw/zinc/13/30/10/1379133010.db2.gz	IRNOJDNMEKVATR-UHFFFAOYSA-N	0	3	342.483	3.394	20	30		EGEDHN
C=CCCC1(C(=O)N2CC3(C2)CCN(Cc2cccc(C#N)c2)C3)CC1	ZINC001148262486	1379140742	/nfs/dbraw/zinc/14/07/42/1379140742.db2.gz	NTSXBNPSFSYEAO-UHFFFAOYSA-N	0	3	349.478	3.339	20	30		EGEDHN
CC(C)C[C@@H](C)C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001148496590	1379189848	/nfs/dbraw/zinc/18/98/48/1379189848.db2.gz	OTUBORFDRBMHMU-QGZVFWFLSA-N	0	3	339.483	3.275	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cccc(C(F)F)c2)cc1F	ZINC001148572774	1379215504	/nfs/dbraw/zinc/21/55/04/1379215504.db2.gz	KYTKSLDEEZWWGC-UHFFFAOYSA-N	0	3	347.340	3.155	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)CCCc3cc(C)ccc3C)C2)C1	ZINC001148811914	1379273381	/nfs/dbraw/zinc/27/33/81/1379273381.db2.gz	KZJGJPWJUHNNPU-UHFFFAOYSA-N	0	3	326.484	3.346	20	30		EGEDHN
CCCCCCCCCC(=O)NCCN[C@H](C)C(=O)NC(C)(C)C	ZINC001148823756	1379276633	/nfs/dbraw/zinc/27/66/33/1379276633.db2.gz	DSCXREKVXKITSY-MRXNPFEDSA-N	0	3	341.540	3.136	20	30		EGEDHN
CCC[C@@H](C(=O)NCCNCc1cccc(C#N)c1)c1ccccc1	ZINC001150058711	1379490252	/nfs/dbraw/zinc/49/02/52/1379490252.db2.gz	UWUYIALAEUDBBU-HXUWFJFHSA-N	0	3	335.451	3.348	20	30		EGEDHN
CCc1sc(C(=O)NCCNCc2ccc(F)c(C#N)c2)cc1C	ZINC001150316837	1379532634	/nfs/dbraw/zinc/53/26/34/1379532634.db2.gz	NQMVXNTYWOBBNV-UHFFFAOYSA-N	0	3	345.443	3.149	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H]2CN(CC(=C)C)CCCO2)CCCCC1	ZINC001150762312	1379609670	/nfs/dbraw/zinc/60/96/70/1379609670.db2.gz	WLVBNWDTZNJAEH-GOSISDBHSA-N	0	3	334.504	3.296	20	30		EGEDHN
C#CCCCC(=O)NC1(CCOC)CCN(Cc2ccsc2)CC1	ZINC001151090882	1379659711	/nfs/dbraw/zinc/65/97/11/1379659711.db2.gz	HHYBICJFPSMCND-UHFFFAOYSA-N	0	3	348.512	3.039	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)Cc2cccc(C)c2)CC1	ZINC001151287787	1379693974	/nfs/dbraw/zinc/69/39/74/1379693974.db2.gz	BKFGFTZOKYHKHL-UHFFFAOYSA-N	0	3	344.499	3.101	20	30		EGEDHN
C[C@H](C(=O)NCCNCc1ccc(C#N)s1)c1cccc(Cl)c1	ZINC001151640110	1379752720	/nfs/dbraw/zinc/75/27/20/1379752720.db2.gz	FVZRYJDNCHLVSN-LBPRGKRZSA-N	0	3	347.871	3.283	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)c1ccc(C)o1	ZINC001151721180	1379768771	/nfs/dbraw/zinc/76/87/71/1379768771.db2.gz	OUMPIGQGQWBEHZ-CYBMUJFWSA-N	0	3	343.402	3.239	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)C[C@@H]1C=CCC1	ZINC001151801598	1379784970	/nfs/dbraw/zinc/78/49/70/1379784970.db2.gz	WRGDUJZNDRIAHP-IAGOWNOFSA-N	0	3	325.456	3.241	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)C[C@H]1C=CCC1	ZINC001151807339	1379787015	/nfs/dbraw/zinc/78/70/15/1379787015.db2.gz	ZLFFVVCGTNWAEX-CVEARBPZSA-N	0	3	343.446	3.380	20	30		EGEDHN
CCCCC[C@H](CC)C(=O)NCCNCc1ccc(OC)c(C#N)c1	ZINC001151891155	1379811743	/nfs/dbraw/zinc/81/17/43/1379811743.db2.gz	UHRSMKKSOQZHPQ-KRWDZBQOSA-N	0	3	345.487	3.379	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc(C3CC3)cc2)s1	ZINC001151906854	1379814106	/nfs/dbraw/zinc/81/41/06/1379814106.db2.gz	QQGSXXKURNXVHX-UHFFFAOYSA-N	0	3	325.437	3.017	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)C(=O)NCCNCc1cccc(C#N)c1	ZINC001151923288	1379816167	/nfs/dbraw/zinc/81/61/67/1379816167.db2.gz	USXMQKOEVWCKSH-NRFANRHFSA-N	0	3	347.462	3.199	20	30		EGEDHN
C[C@H](CC(=O)NCCNCc1cccc(C#N)c1)c1ccc(F)cc1	ZINC001152111451	1379863853	/nfs/dbraw/zinc/86/38/53/1379863853.db2.gz	WQDCTTIQBIPSHN-OAHLLOKOSA-N	0	3	339.414	3.097	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)/C=C(/C)C1CC1	ZINC001152128141	1379868015	/nfs/dbraw/zinc/86/80/15/1379868015.db2.gz	HCIKNHMVIZUAMC-UVQBRAAOSA-N	0	3	325.456	3.241	20	30		EGEDHN
Cc1c2cccc(C)c2oc1C(=O)NCCNCc1cccc(C#N)c1	ZINC001152439878	1379934536	/nfs/dbraw/zinc/93/45/36/1379934536.db2.gz	UATVTHVGSHMSLS-UHFFFAOYSA-N	0	3	347.418	3.441	20	30		EGEDHN
CC(C)CC(CC(C)C)C(=O)NCCNCc1cccc(C#N)c1	ZINC001152659425	1379964723	/nfs/dbraw/zinc/96/47/23/1379964723.db2.gz	KXLVKAQXTDSQSM-UHFFFAOYSA-N	0	3	329.488	3.472	20	30		EGEDHN
C#CC[C@H](CC(=O)NCCNCc1ccc(C)nc1C)c1ccccc1	ZINC001153715138	1380117760	/nfs/dbraw/zinc/11/77/60/1380117760.db2.gz	YEBWXUPKFOWOPC-HXUWFJFHSA-N	0	3	349.478	3.101	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)C1(C2CC2)CCC1	ZINC001154500982	1380292110	/nfs/dbraw/zinc/29/21/10/1380292110.db2.gz	TZMKJBDMHNFSRB-MRXNPFEDSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H](C)N(CC)Cc1ccc(OC)c(F)c1	ZINC001154620783	1380319561	/nfs/dbraw/zinc/31/95/61/1380319561.db2.gz	SOEGGKBEIRAESY-CQSZACIVSA-N	0	3	336.451	3.373	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)[C@]1(C)C=CCC1	ZINC001154683027	1380331116	/nfs/dbraw/zinc/33/11/16/1380331116.db2.gz	TVTRLNDJIDNRGX-FOIQADDNSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@@H](C)N(CC)Cc1ccc2nonc2c1	ZINC001154750873	1380345163	/nfs/dbraw/zinc/34/51/63/1380345163.db2.gz	DMKTYOSQDLYWTI-HUUCEWRRSA-N	0	3	344.459	3.152	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1c(F)ccc(F)c1Cl	ZINC001155418236	1380450310	/nfs/dbraw/zinc/45/03/10/1380450310.db2.gz	CQCPIKCKYVFVRG-LLVKDONJSA-N	0	3	328.790	3.082	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)[C@H]1CC12CCC2	ZINC001155503055	1380461828	/nfs/dbraw/zinc/46/18/28/1380461828.db2.gz	GCHBTDGNCAPQEP-RHSMWYFYSA-N	0	3	343.446	3.214	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)[C@@H]1CC12CCCC2	ZINC001156200099	1380541026	/nfs/dbraw/zinc/54/10/26/1380541026.db2.gz	KBUMGLOTXOPNDF-APWZRJJASA-N	0	3	339.483	3.465	20	30		EGEDHN
CN(CCN(C)C(=O)c1cccc2c(C#N)c[nH]c21)Cc1ccccc1	ZINC001157168270	1380792660	/nfs/dbraw/zinc/79/26/60/1380792660.db2.gz	WAUYHGBBBVEYPR-UHFFFAOYSA-N	0	3	346.434	3.244	20	30		EGEDHN
CC(C)C#CC(=O)NCCCNCc1csc(-c2ccsc2)n1	ZINC001157644084	1380988013	/nfs/dbraw/zinc/98/80/13/1380988013.db2.gz	LBHVPNQDWFOLBC-UHFFFAOYSA-N	0	3	347.509	3.127	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)CC1=CCCCC1	ZINC001157680135	1381000541	/nfs/dbraw/zinc/00/05/41/1381000541.db2.gz	PYXOQEVLNMNTDL-LJQANCHMSA-N	0	3	334.504	3.392	20	30		EGEDHN
C=CCCC(=O)N1CCCC[C@@H]1CN(C)Cc1ccc2nonc2c1	ZINC001157705976	1381009348	/nfs/dbraw/zinc/00/93/48/1381009348.db2.gz	PYHTXLUATOREQZ-MRXNPFEDSA-N	0	3	342.443	3.002	20	30		EGEDHN
C#CCCCCC(=O)N1CCCC[C@@H]1CN(C)CCOCC(C)C	ZINC001157857568	1381052930	/nfs/dbraw/zinc/05/29/30/1381052930.db2.gz	ZMDCUALFCBYAKV-LJQANCHMSA-N	0	3	336.520	3.166	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N2CCCC[C@@H]2CN(C)CC=C)cc1	ZINC001157930289	1381074687	/nfs/dbraw/zinc/07/46/87/1381074687.db2.gz	AKNSGMQJHSIXCI-LJQANCHMSA-N	0	3	340.467	3.201	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1csc([C@H]2CCCO2)n1	ZINC001157957890	1381081336	/nfs/dbraw/zinc/08/13/36/1381081336.db2.gz	JYSHWXLIIYUCOI-GDBMZVCRSA-N	0	3	349.500	3.107	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1cscc1C(F)F	ZINC001158220885	1381163667	/nfs/dbraw/zinc/16/36/67/1381163667.db2.gz	HEWBVPYYXGNPJJ-UHFFFAOYSA-N	0	3	349.406	3.467	20	30		EGEDHN
CC#CCCCC(=O)N1CCCC[C@@H]1CN(C)C[C@H]1CC(C)(C)CO1	ZINC001158357917	1381216934	/nfs/dbraw/zinc/21/69/34/1381216934.db2.gz	SWQGDICMNZNCAC-RTBURBONSA-N	0	3	348.531	3.308	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc(F)c2ccncc12	ZINC001158363244	1381217398	/nfs/dbraw/zinc/21/73/98/1381217398.db2.gz	CLCRNEJQYDEUIT-OAHLLOKOSA-N	0	3	341.430	3.486	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCCC[C@@H]1CN(C)CCOC1CCC1	ZINC001158369532	1381220614	/nfs/dbraw/zinc/22/06/14/1381220614.db2.gz	IZANLVQMZPMOGW-ZWKOTPCHSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)Cc1ccc(Cl)s1	ZINC001158565093	1381301381	/nfs/dbraw/zinc/30/13/81/1381301381.db2.gz	GSYDOOOFLCOUMT-CYBMUJFWSA-N	0	3	326.893	3.443	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)Cn1cc(C)c2ccccc21	ZINC001158588098	1381309407	/nfs/dbraw/zinc/30/94/07/1381309407.db2.gz	OVZBTZAAWVGBBW-GOSISDBHSA-N	0	3	339.483	3.449	20	30		EGEDHN
C[Si](C)(C)C#Cc1cccnc1N1CCCc2ccc(CN)nc21	ZINC001158652035	1381336994	/nfs/dbraw/zinc/33/69/94/1381336994.db2.gz	IYRJEIBSRBUOQN-UHFFFAOYSA-N	0	3	336.515	3.249	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1oc(CC)cc1C	ZINC001158744980	1381379682	/nfs/dbraw/zinc/37/96/82/1381379682.db2.gz	YLJRHMUNWGWJTC-QGZVFWFLSA-N	0	3	348.487	3.280	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc(C2CCCC2)no1	ZINC001158885844	1381449022	/nfs/dbraw/zinc/44/90/22/1381449022.db2.gz	FKHGFKXYSIOOBM-MRXNPFEDSA-N	0	3	331.460	3.445	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N1CCCC[C@@H]1CN(C)Cc1ccccc1	ZINC001158966646	1381489353	/nfs/dbraw/zinc/48/93/53/1381489353.db2.gz	OSSQELLRWXIWQJ-IEBWSBKVSA-N	0	3	330.472	3.091	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NCCC1=CCN(Cc2ccsc2)CC1	ZINC001159488967	1381807256	/nfs/dbraw/zinc/80/72/56/1381807256.db2.gz	XINGGXMJPKXYIG-INIZCTEOSA-N	0	3	348.512	3.368	20	30		EGEDHN
C=CCCC(=O)NCCC1=CCN(CCOCc2ccccc2)CC1	ZINC001159544178	1381824018	/nfs/dbraw/zinc/82/40/18/1381824018.db2.gz	JUXKUGHFRFWLQI-UHFFFAOYSA-N	0	3	342.483	3.308	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCC1=CCN([C@H]2CCc3ccc(F)cc32)CC1	ZINC001159593586	1381839611	/nfs/dbraw/zinc/83/96/11/1381839611.db2.gz	HACXWHGDJJJORD-KUHUBIRLSA-N	0	3	341.430	3.111	20	30		EGEDHN
C#CCCCC(=O)NCCC1=CCN(Cc2ccc(OC)cc2)CC1	ZINC001159957763	1381950002	/nfs/dbraw/zinc/95/00/02/1381950002.db2.gz	MZOJVAKPDBWGJF-UHFFFAOYSA-N	0	3	340.467	3.137	20	30		EGEDHN
Cc1cc(F)ccc1CN1CC=C(CCNC(=O)C#CC2CC2)CC1	ZINC001160081819	1381991701	/nfs/dbraw/zinc/99/17/01/1381991701.db2.gz	XHOVPPCUZVQDSS-UHFFFAOYSA-N	0	3	340.442	3.186	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CO[C@H]2CCCC[C@@H]2CC)CC1	ZINC001160106832	1381998081	/nfs/dbraw/zinc/99/80/81/1381998081.db2.gz	DFNBLXBRKITSDX-OALUTQOASA-N	0	3	334.504	3.296	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)C[C@@H]1C[C@H]1c1ccc(OC)cc1	ZINC001160254356	1382051173	/nfs/dbraw/zinc/05/11/73/1382051173.db2.gz	BUJBHJJOYXRWEH-RDJZCZTQSA-N	0	3	336.863	3.037	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2oc(C(F)F)cc2C)CC1	ZINC001160411884	1382097520	/nfs/dbraw/zinc/09/75/20/1382097520.db2.gz	RBFRBPXAARTGIB-UHFFFAOYSA-N	0	3	336.382	3.301	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc3oc(C)nc3c2)CC1	ZINC001160455807	1382108701	/nfs/dbraw/zinc/10/87/01/1382108701.db2.gz	NUZUWZYKELNVOG-UHFFFAOYSA-N	0	3	325.412	3.074	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H](C)c2c(F)cccc2F)CC1	ZINC001160699311	1382173350	/nfs/dbraw/zinc/17/33/50/1382173350.db2.gz	FTTRBNYSXCXBHE-CQSZACIVSA-N	0	3	334.410	3.393	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2sccc2-n2cccc2)CC1	ZINC001160821441	1382208808	/nfs/dbraw/zinc/20/88/08/1382208808.db2.gz	HMADZLLCOGMRBJ-UHFFFAOYSA-N	0	3	341.480	3.477	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cnc3ccsc3c2)CC1	ZINC001160860726	1382218051	/nfs/dbraw/zinc/21/80/51/1382218051.db2.gz	NKJKFCYVLBAEHS-UHFFFAOYSA-N	0	3	327.453	3.234	20	30		EGEDHN
C=CCN1CCC[C@H]1CNc1nccnc1C1SCCCS1	ZINC001160953136	1382250545	/nfs/dbraw/zinc/25/05/45/1382250545.db2.gz	SJOJEFUGFLFYBX-ZDUSSCGKSA-N	0	3	336.530	3.408	20	30		EGEDHN
C=CCN(C(=O)[C@@H](N)Cc1ccc(OCC)cc1)C1CCCCC1	ZINC001161247517	1382354085	/nfs/dbraw/zinc/35/40/85/1382354085.db2.gz	DFTXOKRLUKJMLT-IBGZPJMESA-N	0	3	330.472	3.302	20	30		EGEDHN
Cc1nc(NCC2CCN(Cc3ccccn3)CC2)ccc1CC#N	ZINC001161246526	1382354275	/nfs/dbraw/zinc/35/42/75/1382354275.db2.gz	SWXRVTOFCZHIMY-UHFFFAOYSA-N	0	3	335.455	3.175	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)Cc2cccc(Cl)c2F)CC1	ZINC001161320735	1382370418	/nfs/dbraw/zinc/37/04/18/1382370418.db2.gz	OPHVGLVSKJUVNV-UHFFFAOYSA-N	0	3	348.849	3.183	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@@H]1CCC[C@@H]1CCC	ZINC001161419856	1382404438	/nfs/dbraw/zinc/40/44/38/1382404438.db2.gz	UPINRRPWHJZOCS-UONOGXRCSA-N	0	3	331.298	3.207	20	30		EGEDHN
CCC[C@@H]1CCC[C@@H]1C(=O)NCCCNCc1ccccc1C#N	ZINC001161428034	1382407522	/nfs/dbraw/zinc/40/75/22/1382407522.db2.gz	QIWFKPDPEZHZQS-APWZRJJASA-N	0	3	327.472	3.371	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H]2CCO[C@H]2c2ccccc2)CC1	ZINC001161457923	1382416060	/nfs/dbraw/zinc/41/60/60/1382416060.db2.gz	PJJHLNRFUBYRSG-UXHICEINSA-N	0	3	340.467	3.089	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C[C@@H](C)c2ccccc2F)CC1	ZINC001161497006	1382423156	/nfs/dbraw/zinc/42/31/56/1382423156.db2.gz	NYPHYXCNZNWGRG-QGZVFWFLSA-N	0	3	342.458	3.481	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H](C)c2ccccc2F)CC1	ZINC001161496886	1382423863	/nfs/dbraw/zinc/42/38/63/1382423863.db2.gz	JKFIHMHHCFURAY-INIZCTEOSA-N	0	3	328.431	3.091	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CCOc2ccccc2CC)CC1	ZINC001161674212	1382476678	/nfs/dbraw/zinc/47/66/78/1382476678.db2.gz	HLRBZKWSQLVMDB-UHFFFAOYSA-N	0	3	342.483	3.342	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cnn([C@H](C)CC)c2C)CC1	ZINC001161678990	1382478557	/nfs/dbraw/zinc/47/85/57/1382478557.db2.gz	RQOFUPZHXNDDPE-OAHLLOKOSA-N	0	3	330.476	3.101	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)Cc2ccc3c(c2)CCCC3)CC1	ZINC001161844522	1382527405	/nfs/dbraw/zinc/52/74/05/1382527405.db2.gz	LTYVINFJFWINJW-UHFFFAOYSA-N	0	3	338.495	3.432	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@]2(C)CCc3ccccc32)CC1	ZINC001161972540	1382578597	/nfs/dbraw/zinc/57/85/97/1382578597.db2.gz	FPEJKPMWDZIPFK-JOCHJYFZSA-N	0	3	336.479	3.052	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cnc(C(C)C)s2)CC1	ZINC001162021374	1382604379	/nfs/dbraw/zinc/60/43/79/1382604379.db2.gz	KHTGMCDLJLEJOK-UHFFFAOYSA-N	0	3	331.485	3.042	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@H](CC)CCCC)(COC)CC1	ZINC001162142124	1382637447	/nfs/dbraw/zinc/63/74/47/1382637447.db2.gz	GQKHEPWWAPBHGI-GOSISDBHSA-N	0	3	336.520	3.071	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@@H]1[C@@H](C=C(C)C)C1(C)C	ZINC001162150165	1382640031	/nfs/dbraw/zinc/64/00/31/1382640031.db2.gz	JMBRZUDDCUAIIO-KGLIPLIRSA-N	0	3	343.309	3.229	20	30		EGEDHN
C#CCN1CCC(CNC(=O)C[C@@H](C)C2CCCCC2)(COC)CC1	ZINC001162528017	1382781526	/nfs/dbraw/zinc/78/15/26/1382781526.db2.gz	PKHVKTYYDVWLBV-GOSISDBHSA-N	0	3	348.531	3.071	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@](C)(CC)CCC)(COC)CC1	ZINC001162553085	1382787751	/nfs/dbraw/zinc/78/77/51/1382787751.db2.gz	GTUQFPMIQAWAOY-LJQANCHMSA-N	0	3	336.520	3.071	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@@](C)(CC)CCC)(COC)CC1	ZINC001162553084	1382788091	/nfs/dbraw/zinc/78/80/91/1382788091.db2.gz	GTUQFPMIQAWAOY-IBGZPJMESA-N	0	3	336.520	3.071	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)CC1CCCCC1	ZINC001162689186	1382834607	/nfs/dbraw/zinc/83/46/07/1382834607.db2.gz	YXHYMOQWIVRCCE-UHFFFAOYSA-N	0	3	326.484	3.251	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H](CC)CCCC	ZINC001162710519	1382844346	/nfs/dbraw/zinc/84/43/46/1382844346.db2.gz	WYADEBJNDQPIRC-FQEVSTJZSA-N	0	3	328.500	3.497	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H](C)C(C)(C)C	ZINC001162840938	1382891286	/nfs/dbraw/zinc/89/12/86/1382891286.db2.gz	JDFDFSOQEPXCDM-GOSISDBHSA-N	0	3	328.500	3.353	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@]1(C)CCC[C@@H]1CC	ZINC001162840905	1382891512	/nfs/dbraw/zinc/89/15/12/1382891512.db2.gz	HOMKOCKBOTYOBY-UNMCSNQZSA-N	0	3	340.511	3.497	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@]1(C)C[C@H]2C[C@H]2C1	ZINC001162871581	1382900752	/nfs/dbraw/zinc/90/07/52/1382900752.db2.gz	UJWMTOJYIZPIQH-VTYHHJSWSA-N	0	3	338.495	3.107	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1Cc2ccccc21	ZINC001162911412	1382914075	/nfs/dbraw/zinc/91/40/75/1382914075.db2.gz	MFDVTIVORYTFND-JOCHJYFZSA-N	0	3	346.474	3.011	20	30		EGEDHN
C=C1CCC(C(=O)N(CCNCC#CC)CCc2ccccc2)CC1	ZINC001162919710	1382917464	/nfs/dbraw/zinc/91/74/64/1382917464.db2.gz	ZWOSIIVQYGTUFT-UHFFFAOYSA-N	0	3	338.495	3.417	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)CCc1ccccc1C	ZINC001162946380	1382923467	/nfs/dbraw/zinc/92/34/67/1382923467.db2.gz	GSPFXTLTJPABLN-UHFFFAOYSA-N	0	3	348.490	3.222	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1C[C@@H]1C1CCCC1	ZINC001162970776	1382932330	/nfs/dbraw/zinc/93/23/30/1382932330.db2.gz	KVZQMCJCKHQFNY-NHCUHLMSSA-N	0	3	338.495	3.107	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H](C)c1ccccc1C	ZINC001163001446	1382943522	/nfs/dbraw/zinc/94/35/22/1382943522.db2.gz	DCARIAIJONGUMQ-FQEVSTJZSA-N	0	3	348.490	3.393	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C1CC(C(C)(C)C)C1	ZINC001163006695	1382945769	/nfs/dbraw/zinc/94/57/69/1382945769.db2.gz	JBOWIQAVYMUKQA-UHFFFAOYSA-N	0	3	340.511	3.353	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1ccc(CF)cc1	ZINC001163007751	1382947405	/nfs/dbraw/zinc/94/74/05/1382947405.db2.gz	YWCFHZYGJGQFRO-UHFFFAOYSA-N	0	3	338.426	3.064	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1c(C)cccc1F	ZINC001163012874	1382948311	/nfs/dbraw/zinc/94/83/11/1382948311.db2.gz	DJWJOWMJLCHRJZ-UHFFFAOYSA-N	0	3	338.426	3.042	20	30		EGEDHN
C=CCc1ccnc(N[C@@H]2CNCc3ccsc32)c1C(OC)OC	ZINC001163221651	1382996408	/nfs/dbraw/zinc/99/64/08/1382996408.db2.gz	XFXJFACNTRPCLX-CQSZACIVSA-N	0	3	345.468	3.419	20	30		EGEDHN
Cc1c(C#N)c(N[C@H]2CCCC[C@@]23CNCCO3)nc2ccccc12	ZINC001163645464	1383094509	/nfs/dbraw/zinc/09/45/09/1383094509.db2.gz	WHJHQDGPAQNYBN-AZUAARDMSA-N	0	3	336.439	3.128	20	30		EGEDHN
CC(C)(C(=O)NCCCNCc1ccccc1C#N)c1cccs1	ZINC001163892664	1383133542	/nfs/dbraw/zinc/13/35/42/1383133542.db2.gz	WSGQXYNDLAPMDD-UHFFFAOYSA-N	0	3	341.480	3.193	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCCNCc1cc(OC)ccc1Cl	ZINC001164223469	1383167839	/nfs/dbraw/zinc/16/78/39/1383167839.db2.gz	SSCVJSNYKOHJAR-ZIAGYGMSSA-N	0	3	338.879	3.403	20	30		EGEDHN
C[C@H](NCC1(CCNC(=O)C#CC2CC2)CC1)c1cc(F)ccc1F	ZINC001164483014	1383191636	/nfs/dbraw/zinc/19/16/36/1383191636.db2.gz	VRPHTQVEXZOUBA-AWEZNQCLSA-N	0	3	346.421	3.315	20	30		EGEDHN
N#Cc1c(Cl)nc2cccc(Cl)c2c1-n1ncc2c1CCNC2	ZINC001165223630	1383252983	/nfs/dbraw/zinc/25/29/83/1383252983.db2.gz	PRTSTBSKJZDNHR-UHFFFAOYSA-N	0	3	344.205	3.245	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc(C(F)F)nc2)CC1	ZINC001165383874	1383284190	/nfs/dbraw/zinc/28/41/90/1383284190.db2.gz	XTQOFKJFGSMBIR-UHFFFAOYSA-N	0	3	343.805	3.261	20	30		EGEDHN
C=CCC1(C(=O)NCCCNCc2oc(CCC)nc2C)CCC1	ZINC001165998032	1383375305	/nfs/dbraw/zinc/37/53/05/1383375305.db2.gz	KPHOVLLKIGBNPX-UHFFFAOYSA-N	0	3	333.476	3.278	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCC1(CNCc2ccc(F)cn2)CC1	ZINC001166696030	1383462857	/nfs/dbraw/zinc/46/28/57/1383462857.db2.gz	VQQABUHXHYXPOZ-HUUCEWRRSA-N	0	3	333.451	3.055	20	30		EGEDHN
CC(C)(C(=O)NCCC1(CNCc2ccccc2C#N)CC1)C1CC1	ZINC001166769949	1383475375	/nfs/dbraw/zinc/47/53/75/1383475375.db2.gz	HUPIRCOHWZBYBW-UHFFFAOYSA-N	0	3	339.483	3.371	20	30		EGEDHN
C=CCCCC(=O)NCCC1(CNCc2cc(C3CC3)no2)CC1	ZINC001166910054	1383498655	/nfs/dbraw/zinc/49/86/55/1383498655.db2.gz	KSZJODGTBQLNBL-UHFFFAOYSA-N	0	3	331.460	3.284	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCC1(CN[C@H](C)c2cnc(C)cn2)CC1	ZINC001167018444	1383520226	/nfs/dbraw/zinc/52/02/26/1383520226.db2.gz	JNUCSSZKTUOBJK-APWZRJJASA-N	0	3	344.503	3.324	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCC1(CN[C@@H](C)c2cnc(C)cn2)CC1	ZINC001167018445	1383520266	/nfs/dbraw/zinc/52/02/66/1383520266.db2.gz	JNUCSSZKTUOBJK-LPHOPBHVSA-N	0	3	344.503	3.324	20	30		EGEDHN
C=C1CCC(C(=O)NCCC2(CNCc3ccns3)CC2)CC1	ZINC001167029884	1383523024	/nfs/dbraw/zinc/52/30/24/1383523024.db2.gz	QNJHDWKDNQDVSU-UHFFFAOYSA-N	0	3	333.501	3.266	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)C[C@H](C)CC(C)(C)C	ZINC001167262760	1383578815	/nfs/dbraw/zinc/57/88/15/1383578815.db2.gz	YXRHAGBAIRLOCV-LBPRGKRZSA-N	0	3	333.314	3.453	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)C1[C@@H]2CCCCCC[C@@H]12	ZINC001167296045	1383588296	/nfs/dbraw/zinc/58/82/96/1383588296.db2.gz	KAYFDJPTBKMVCA-ZIAGYGMSSA-N	0	3	343.309	3.207	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCC1(CN[C@H](C)c2cnccn2)CC1	ZINC001167340310	1383603620	/nfs/dbraw/zinc/60/36/20/1383603620.db2.gz	XOHMABKIKHBFJR-OAHLLOKOSA-N	0	3	330.476	3.016	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)Cc2ccsc2C)CC1	ZINC001167394315	1383621774	/nfs/dbraw/zinc/62/17/74/1383621774.db2.gz	CTIGHIINNPCAAP-UHFFFAOYSA-N	0	3	326.893	3.228	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)[C@H](C)Cc1ccccc1Cl	ZINC001167475720	1383644755	/nfs/dbraw/zinc/64/47/55/1383644755.db2.gz	KPIBXVWMYIXJCH-GFCCVEGCSA-N	0	3	329.271	3.367	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc3cnccc3c2)CC1	ZINC001167652379	1383698854	/nfs/dbraw/zinc/69/88/54/1383698854.db2.gz	YZINISGGBQQJGJ-UHFFFAOYSA-N	0	3	343.858	3.477	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2sccc2COC)CC1	ZINC001167732633	1383724357	/nfs/dbraw/zinc/72/43/57/1383724357.db2.gz	KQPDSOANUXMDPE-UHFFFAOYSA-N	0	3	342.892	3.137	20	30		EGEDHN
Cc1ccccc1[C@@H]1C[C@H]1C(=O)NCCCNCc1ccccc1C#N	ZINC001168068716	1383810524	/nfs/dbraw/zinc/81/05/24/1383810524.db2.gz	OCYKHYMYFQGIAU-LEWJYISDSA-N	0	3	347.462	3.266	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cccc3c2CCC3)CC1	ZINC001168446783	1383907580	/nfs/dbraw/zinc/90/75/80/1383907580.db2.gz	XRMOCKAWMKNZCN-UHFFFAOYSA-N	0	3	332.875	3.418	20	30		EGEDHN
C=CCOC(=O)N[C@H]1CCCN([C@@H]2CCc3cc(F)ccc3C2)C1	ZINC001168447669	1383908291	/nfs/dbraw/zinc/90/82/91/1383908291.db2.gz	GEBNTCZHGQXXJO-ZWKOTPCHSA-N	0	3	332.419	3.060	20	30		EGEDHN
N#CC1(c2ccccc2F)CCN([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1	ZINC001169055902	1384101470	/nfs/dbraw/zinc/10/14/70/1384101470.db2.gz	RACWMHWFFIJBLF-LSDHHAIUSA-N	0	3	331.391	3.128	20	30		EGEDHN
CC(=O)CCCC(=O)N[C@H](C)CCCCNCc1ccccc1C#N	ZINC001169133099	1384112025	/nfs/dbraw/zinc/11/20/25/1384112025.db2.gz	RRWWFJRBJUUYMJ-MRXNPFEDSA-N	0	3	343.471	3.082	20	30		EGEDHN
C[C@H](N)c1ccn(-c2cc(Br)cc(Cl)c2C#N)n1	ZINC001169233859	1384125839	/nfs/dbraw/zinc/12/58/39/1384125839.db2.gz	SWWZSRQSRPIADZ-ZETCQYMHSA-N	0	3	325.597	3.180	20	30		EGEDHN
CN(C)/C=N/c1ccc(N[C@H]2CCc3ccccc3[C@@H]2O)cc1C#N	ZINC001169627460	1384166782	/nfs/dbraw/zinc/16/67/82/1384166782.db2.gz	IHKDZXIVEPHMLG-LWAXZCTGSA-N	0	3	334.423	3.240	20	30		EGEDHN
CC[C@]1(C(C)C)C[C@@H]1C(=O)NCCCNCc1ccccc1C#N	ZINC001169730410	1384179667	/nfs/dbraw/zinc/17/96/67/1384179667.db2.gz	SUKDXRQDDTZHHP-UYAOXDASSA-N	0	3	327.472	3.226	20	30		EGEDHN
CC[C@]1(C(C)C)C[C@H]1C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001169732790	1384179942	/nfs/dbraw/zinc/17/99/42/1384179942.db2.gz	ZYMCJLQMWVASDW-FXAWDEMLSA-N	0	3	345.462	3.366	20	30		EGEDHN
CCC(CC)n1ccc(CNCCCC[C@@H](C)NC(=O)[C@@H](C)C#N)n1	ZINC001169849450	1384191078	/nfs/dbraw/zinc/19/10/78/1384191078.db2.gz	WQCDPVAWSULHAJ-JKSUJKDBSA-N	0	3	347.507	3.168	20	30		EGEDHN
CC1(C)CC(=O)C=C(Nc2cccc3cc([C@@H]4CNCCO4)cn32)C1	ZINC001169953092	1384203462	/nfs/dbraw/zinc/20/34/62/1384203462.db2.gz	MQFWLOAIKOJANM-SFHVURJKSA-N	0	3	339.439	3.285	20	30		EGEDHN
C[C@@H](CCCCNC/C(Cl)=C\Cl)NC(=O)c1ccc(C#N)[nH]1	ZINC001170202050	1384262786	/nfs/dbraw/zinc/26/27/86/1384262786.db2.gz	QYLBEMIPLYIKME-SERMCNLOSA-N	0	3	343.258	3.084	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)Cc1ccoc1	ZINC001170348371	1384297526	/nfs/dbraw/zinc/29/75/26/1384297526.db2.gz	SXYOVYLCVKEFJM-MRXNPFEDSA-N	0	3	339.439	3.159	20	30		EGEDHN
CO[C@@H]1[C@@H](C)[C@@H](NCc2cc(C#N)ccc2Br)C1(C)C	ZINC001170399140	1384307489	/nfs/dbraw/zinc/30/74/89/1384307489.db2.gz	HPRZORFWZHFFJC-COLVAYQJSA-N	0	3	337.261	3.470	20	30		EGEDHN
C#CCCCC(=O)N[C@@H](C)CCCCNCc1nc(C)sc1C	ZINC001170424765	1384315356	/nfs/dbraw/zinc/31/53/56/1384315356.db2.gz	DYYFHQCBJIZDKL-AWEZNQCLSA-N	0	3	335.517	3.328	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)[C@H]1C[C@@H]1C(F)F	ZINC001170531826	1384336958	/nfs/dbraw/zinc/33/69/58/1384336958.db2.gz	RNBYEMOHLOYODU-JQFCIGGWSA-N	0	3	349.425	3.224	20	30		EGEDHN
Cc1nc(CNCCCC[C@H](C)NC(=O)C#CC(C)(C)C)cs1	ZINC001170693513	1384367205	/nfs/dbraw/zinc/36/72/05/1384367205.db2.gz	PZLVJJSSMJXNMS-AWEZNQCLSA-N	0	3	335.517	3.266	20	30		EGEDHN
CN1c2ccc(NC(=N)c3ccc4cc(O)ccc4c3)cc2CNC1=O	ZINC001171186242	1384463572	/nfs/dbraw/zinc/46/35/72/1384463572.db2.gz	PCAIXTNILNLQIR-UHFFFAOYSA-N	0	3	346.390	3.242	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H](C)CCCCNCc2csc(C)n2)CCC1	ZINC001171187515	1384463894	/nfs/dbraw/zinc/46/38/94/1384463894.db2.gz	VKLKNQDZYFOPDG-HNNXBMFYSA-N	0	3	347.528	3.410	20	30		EGEDHN
C[C@@H](Cc1cccc(C#N)c1)N1CCN(CCc2cccs2)CC1	ZINC001171221763	1384472039	/nfs/dbraw/zinc/47/20/39/1384472039.db2.gz	UJZHFGWQDLOPRA-KRWDZBQOSA-N	0	3	339.508	3.411	20	30		EGEDHN
N#Cc1ccc(N2CCN([C@@H]3CCc4c(F)cccc4C3)CC2)cc1	ZINC001171435802	1384523579	/nfs/dbraw/zinc/52/35/79/1384523579.db2.gz	ZAXOXJUPUOHOSW-LJQANCHMSA-N	0	3	335.426	3.377	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)c1ccsn1	ZINC001171465213	1384530746	/nfs/dbraw/zinc/53/07/46/1384530746.db2.gz	UAZGHQOCBGVSBE-CQSZACIVSA-N	0	3	342.468	3.093	20	30		EGEDHN
O=C1C=C2CN([C@@H]3CCc4cc(F)c(F)c(F)c4C3)CCC2S1	ZINC001171534059	1384554469	/nfs/dbraw/zinc/55/44/69/1384554469.db2.gz	DKMSDVYRQYSBLU-RISCZKNCSA-N	0	3	339.382	3.235	20	30		EGEDHN
CC(C)CC(=O)N1CCCN([C@@H](C)Cc2ccc(C#N)cc2)CC1	ZINC001172310701	1384766580	/nfs/dbraw/zinc/76/65/80/1384766580.db2.gz	IEHKCSYMOIZFEA-KRWDZBQOSA-N	0	3	327.472	3.070	20	30		EGEDHN
C=CCOC[C@H]1CCC[C@@]12CN([C@@H](C)CCOC(C)C)CCO2	ZINC001172451870	1384795091	/nfs/dbraw/zinc/79/50/91/1384795091.db2.gz	VNMPUICUPMGXOO-IPMKNSEASA-N	0	3	325.493	3.264	20	30		EGEDHN
N#C[C@@H]1CCN([C@@H]2CC[C@H]3CN(C(=O)c4ccccc4)CC[C@H]3C2)C1	ZINC001172531513	1384809143	/nfs/dbraw/zinc/80/91/43/1384809143.db2.gz	MQJHTIVDZGDQSB-FRYIKTPZSA-N	0	3	337.467	3.163	20	30		EGEDHN
COc1cccc(CN[C@@H]2CCN(C(=O)OC(C)(C)C)[C@H](C#N)C2)c1	ZINC001172968725	1384892984	/nfs/dbraw/zinc/89/29/84/1384892984.db2.gz	SKKIRXBCUZEUCI-CVEARBPZSA-N	0	3	345.443	3.076	20	30		EGEDHN
C=CCO[C@@H]1CO[C@@]2(C1)CCCN(C1Cc3cc(F)c(F)cc3C1)C2	ZINC001173482334	1384978910	/nfs/dbraw/zinc/97/89/10/1384978910.db2.gz	IAVVDFGANMYXFU-FXAWDEMLSA-N	0	3	349.421	3.258	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@H]1CN(C2CCC(C)(C#N)CC2)CC[C@H]1F	ZINC001173597679	1384984576	/nfs/dbraw/zinc/98/45/76/1384984576.db2.gz	DIXBRTYYZSUUHD-NWPKHEMWSA-N	0	3	339.455	3.396	20	30		EGEDHN
CO[C@@H](CN1CCN(C2CCC(C)(C#N)CC2)CC1)c1ccccc1	ZINC001173599109	1384985434	/nfs/dbraw/zinc/98/54/34/1384985434.db2.gz	ZNEADUMLYNMMCE-KBWCOIMZSA-N	0	3	341.499	3.464	20	30		EGEDHN
C[C@@H](CC(=O)NCCCNCc1cc(C#N)ccc1F)C(C)(C)C	ZINC001174571121	1385120775	/nfs/dbraw/zinc/12/07/75/1385120775.db2.gz	LVJQNOMGKWBDFH-AWEZNQCLSA-N	0	3	333.451	3.366	20	30		EGEDHN
Cc1ccc(C(=O)NCC[C@@H](C)NCc2ccccc2C#N)c(C)c1	ZINC001317412726	1385123447	/nfs/dbraw/zinc/12/34/47/1385123447.db2.gz	OWMPYLDFZOKTOE-QGZVFWFLSA-N	0	3	335.451	3.473	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)[C@H]1C[C@H]2C[C@H]2C1	ZINC001174840648	1385157944	/nfs/dbraw/zinc/15/79/44/1385157944.db2.gz	DTPGQGIULZWESS-KCUHQSDYSA-N	0	3	339.483	3.369	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H](C)CCCCNCc1cc(OC)no1	ZINC001174848794	1385159421	/nfs/dbraw/zinc/15/94/21/1385159421.db2.gz	IESUUWNMJXEKTQ-CABCVRRESA-N	0	3	337.464	3.050	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1ccsc1C(F)F	ZINC001174874357	1385163467	/nfs/dbraw/zinc/16/34/67/1385163467.db2.gz	JSTZYTIMCUPCDD-UHFFFAOYSA-N	0	3	349.406	3.467	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)CCCCNCc2nccn2CC)CCC1	ZINC001175089030	1385193016	/nfs/dbraw/zinc/19/30/16/1385193016.db2.gz	GQXZJNDMVXLUIO-KRWDZBQOSA-N	0	3	346.519	3.414	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)CCCCNCc2cnc(C)o2)CCC1	ZINC001175096821	1385194128	/nfs/dbraw/zinc/19/41/28/1385194128.db2.gz	BUVQSWPZYFWXHS-OAHLLOKOSA-N	0	3	333.476	3.494	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1cc2c(s1)CCC2	ZINC001175339703	1385257337	/nfs/dbraw/zinc/25/73/37/1385257337.db2.gz	PVYJJNPNAJYEKK-UHFFFAOYSA-N	0	3	339.464	3.018	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1cc(CC)c(C)s1	ZINC001175600401	1385345971	/nfs/dbraw/zinc/34/59/71/1385345971.db2.gz	SWFLRZLHAOKINF-UHFFFAOYSA-N	0	3	345.306	3.237	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)Cc1ccco1	ZINC001175812321	1385412217	/nfs/dbraw/zinc/41/22/17/1385412217.db2.gz	NCBIURNBYIEZGS-MRXNPFEDSA-N	0	3	339.439	3.159	20	30		EGEDHN
CCCCCCCC[C@H](C)C(=O)NCCCNCc1nccn1C	ZINC001176706673	1385665941	/nfs/dbraw/zinc/66/59/41/1385665941.db2.gz	KNTFFDQBWNHKOW-KRWDZBQOSA-N	0	3	336.524	3.403	20	30		EGEDHN
C=C[C@H](C(=O)NCCCNCc1nc(C)cs1)c1ccccc1	ZINC001176778292	1385692930	/nfs/dbraw/zinc/69/29/30/1385692930.db2.gz	KUILZZJWQQBIGM-INIZCTEOSA-N	0	3	329.469	3.017	20	30		EGEDHN
CC[C@H](CNC(=O)c1ccc(F)cc1C)NCc1ccc(C#N)s1	ZINC001318593415	1385778783	/nfs/dbraw/zinc/77/87/83/1385778783.db2.gz	OWNPNZRWVNVNQU-CQSZACIVSA-N	0	3	345.443	3.366	20	30		EGEDHN
C=C1CC=C(F)C=C1NC(=O)C1CCN(Cc2ccccn2)CC1	ZINC001177215442	1385868548	/nfs/dbraw/zinc/86/85/48/1385868548.db2.gz	ZGSZWRDDYXFCJQ-UHFFFAOYSA-N	0	3	327.403	3.107	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@H](C)SC	ZINC001177225438	1385874106	/nfs/dbraw/zinc/87/41/06/1385874106.db2.gz	MOUNRFCWNQKULD-AWEZNQCLSA-N	0	3	332.941	3.489	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@@H](CC)OC	ZINC001177245942	1385883089	/nfs/dbraw/zinc/88/30/89/1385883089.db2.gz	QEAULZZSIMPSPM-MRXNPFEDSA-N	0	3	330.900	3.162	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)C[C@@H]1CCCC[C@H]1C	ZINC001177310470	1385908019	/nfs/dbraw/zinc/90/80/19/1385908019.db2.gz	XDNLUMGEZWBMQY-OCCSQVGLSA-N	0	3	331.298	3.207	20	30		EGEDHN
C=CCC1(C(=O)NCCCNCc2oc(CC)nc2C)CCCC1	ZINC001177548012	1385993156	/nfs/dbraw/zinc/99/31/56/1385993156.db2.gz	MGVLZHFGTNFOPI-UHFFFAOYSA-N	0	3	333.476	3.278	20	30		EGEDHN
C=CCC1(C(=O)NCCCNCc2cc(C#N)ccc2F)CCCC1	ZINC001177552418	1385995413	/nfs/dbraw/zinc/99/54/13/1385995413.db2.gz	FBSOFFIYVUYLJH-UHFFFAOYSA-N	0	3	343.446	3.430	20	30		EGEDHN
C[C@@H](CNCc1ccccc1C#N)CNC(=O)C1(C)CCCCC1	ZINC001319237868	1386019527	/nfs/dbraw/zinc/01/95/27/1386019527.db2.gz	JWXDPNVIUXBCRE-INIZCTEOSA-N	0	3	327.472	3.371	20	30		EGEDHN
C=C(CNCc1ccccc1O[C@H](C)C(=O)OC)c1ccccc1	ZINC001177687631	1386022738	/nfs/dbraw/zinc/02/27/38/1386022738.db2.gz	DVOBSJLCMKKSAW-MRXNPFEDSA-N	0	3	325.408	3.430	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)N(C)C(=O)C12CCC(CC1)C2	ZINC001319477515	1386139077	/nfs/dbraw/zinc/13/90/77/1386139077.db2.gz	OZFMYEZLFMESHV-WRSVWVKZSA-N	0	3	331.485	3.137	20	30		EGEDHN
C/C=C(/C)C(=O)NCCCCCCNCc1cc(F)ccc1C#N	ZINC001178149616	1386143253	/nfs/dbraw/zinc/14/32/53/1386143253.db2.gz	XWGIVKHLPYUZIO-CQPUUCJISA-N	0	3	331.435	3.430	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccc(F)cc2)CCN1C(=O)/C=C/C(C)(C)C	ZINC001178378653	1386202677	/nfs/dbraw/zinc/20/26/77/1386202677.db2.gz	FTDJWFFKONDETL-CMQPXPSLSA-N	0	3	342.458	3.359	20	30		EGEDHN
COc1cc(C#N)ccc1CN1CCC[C@@H]1CNc1cccc(C)n1	ZINC001319756806	1386282761	/nfs/dbraw/zinc/28/27/61/1386282761.db2.gz	PNRQVSZJJKJLCG-GOSISDBHSA-N	0	3	336.439	3.347	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCCCCCNCc1ccn(CC)n1	ZINC001179481321	1386493393	/nfs/dbraw/zinc/49/33/93/1386493393.db2.gz	CTTKMHBBEHCBOL-IBGZPJMESA-N	0	3	334.508	3.272	20	30		EGEDHN
N#Cc1ccccc1CNCCCCCCNC(=O)Cc1ccco1	ZINC001179867794	1386612411	/nfs/dbraw/zinc/61/24/11/1386612411.db2.gz	FZRRJLHJEJHJRP-UHFFFAOYSA-N	0	3	339.439	3.160	20	30		EGEDHN
C/C=C(/C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2ccccc2C#N)C1	ZINC001181049811	1386925096	/nfs/dbraw/zinc/92/50/96/1386925096.db2.gz	XLICKNVNURARGK-SZGALGMRSA-N	0	3	325.456	3.099	20	30		EGEDHN
CCC[C@@H](C)CC(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001181500468	1387005403	/nfs/dbraw/zinc/00/54/03/1387005403.db2.gz	CMLSGJIPDGRAOW-RHSMWYFYSA-N	0	3	331.435	3.214	20	30		EGEDHN
Cc1cc(F)ccc1C(=O)N[C@@H](C)CN(C)Cc1cccc(C#N)c1	ZINC001322281520	1387137885	/nfs/dbraw/zinc/13/78/85/1387137885.db2.gz	PVCZCTLLUVEJPU-HNNXBMFYSA-N	0	3	339.414	3.256	20	30		EGEDHN
C=CCCC1(C(=O)N2C[C@@H](C)[C@](C)(CNCc3ocnc3C)C2)CC1	ZINC001182516245	1387181445	/nfs/dbraw/zinc/18/14/45/1387181445.db2.gz	DEDQVKNCWUGEGV-DNVCBOLYSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H](C)[C@](C)(CNCc2cnc(C)o2)C1	ZINC001182525164	1387181813	/nfs/dbraw/zinc/18/18/13/1387181813.db2.gz	XKDAIBVUZYUTLK-NIKGAXFTSA-N	0	3	333.476	3.160	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N(C)C[C@H](C)NCc1ccc(F)c(C#N)c1	ZINC001331458569	1389756778	/nfs/dbraw/zinc/75/67/78/1389756778.db2.gz	KZVVNMILOGUWQW-AWEZNQCLSA-N	0	3	333.451	3.316	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N1CC[C@H](C)C(C)(C)C1	ZINC001338850435	1389790207	/nfs/dbraw/zinc/79/02/07/1389790207.db2.gz	BAVJHFYZPNWIQA-HOTGVXAUSA-N	0	3	331.508	3.146	20	30		EGEDHN
N#Cc1cc(Cl)ncc1NC(=O)C(C[C@@H]1CCCO1)C(F)(F)F	ZINC001339028579	1389866384	/nfs/dbraw/zinc/86/63/84/1389866384.db2.gz	PXCPZZQKZWZORS-VHSXEESVSA-N	0	3	347.724	3.293	20	30		EGEDHN
C=C(Br)CNC[C@H](NC(=O)C1=CCCC1)C(C)(C)C	ZINC001332791050	1390189130	/nfs/dbraw/zinc/18/91/30/1390189130.db2.gz	XGCMUCXWUVMHQW-ZDUSSCGKSA-N	0	3	329.282	3.126	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)N1CCc2nc(C3CC3)ncc2C1	ZINC001340707781	1390350589	/nfs/dbraw/zinc/35/05/89/1390350589.db2.gz	FKCCWRPADOZINA-QGZVFWFLSA-N	0	3	344.503	3.317	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1cnn(-c2cc(C)ccc2C)c1C	ZINC001341018493	1390426380	/nfs/dbraw/zinc/42/63/80/1390426380.db2.gz	BKAGVSQVXXSNME-INIZCTEOSA-N	0	3	326.444	3.420	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)[C@H](C)OC1CCCCC1	ZINC001341886224	1390544657	/nfs/dbraw/zinc/54/46/57/1390544657.db2.gz	QHRLTKRHWZHYCQ-ZFWWWQNUSA-N	0	3	344.411	3.080	20	30		EGEDHN
C[C@H](Sc1ccc(F)cc1)C(=O)C(C#N)C(=O)NC1CCCC1	ZINC001342011899	1390561633	/nfs/dbraw/zinc/56/16/33/1390561633.db2.gz	XWPKJLYYLHIJGQ-NHYWBVRUSA-N	0	3	334.416	3.074	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)c2ccc(C)nn2)cc1	ZINC001342717580	1390644920	/nfs/dbraw/zinc/64/49/20/1390644920.db2.gz	MNXUHBYESOICBC-INIZCTEOSA-N	0	3	336.395	3.089	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N1CCC[C@H]1c1nc2ccccc2n1CC	ZINC001343410401	1390712234	/nfs/dbraw/zinc/71/22/34/1390712234.db2.gz	YMUMKZKJESAELO-YJBOKZPZSA-N	0	3	340.471	3.403	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)[C@H]2CCC[C@@H]2OC)cc1	ZINC001343590162	1390724826	/nfs/dbraw/zinc/72/48/26/1390724826.db2.gz	LODGWTMBSOKVMN-KSZLIROESA-N	0	3	342.439	3.492	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCc1c(C)nn(CC(C)C)c1C	ZINC001344322199	1390782020	/nfs/dbraw/zinc/78/20/20/1390782020.db2.gz	JOFVLYPAPDLYDB-QGZVFWFLSA-N	0	3	341.459	3.181	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCC(=O)c1ccc(F)cc1F	ZINC001344875622	1390821115	/nfs/dbraw/zinc/82/11/15/1390821115.db2.gz	VVEPGEDDPZTOTG-ZDUSSCGKSA-N	0	3	331.322	3.021	20	30		EGEDHN
CC(C)n1ccc(CC(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)n1	ZINC001346040355	1390902392	/nfs/dbraw/zinc/90/23/92/1390902392.db2.gz	SYLFOFULGSXUQV-HNNXBMFYSA-N	0	3	344.802	3.007	20	30		EGEDHN
C=C(Br)CN[C@@H](C)[C@H]1CCCCN1C(=O)C(C)(C)F	ZINC001479817434	1392409427	/nfs/dbraw/zinc/40/94/27/1392409427.db2.gz	GLQAIQQIIWHZJC-NWDGAFQWSA-N	0	3	335.261	3.002	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1cnc2ccccn21	ZINC001479828011	1392415410	/nfs/dbraw/zinc/41/54/10/1392415410.db2.gz	VGRYUBSPGOHXOW-GJZGRUSLSA-N	0	3	346.862	3.060	20	30		EGEDHN
CC(C)c1scnc1C(=O)NC[C@@H](C)NCc1ccc(C#N)s1	ZINC001480568848	1392795418	/nfs/dbraw/zinc/79/54/18/1392795418.db2.gz	BUBLMHBFPFAYDR-LLVKDONJSA-N	0	3	348.497	3.108	20	30		EGEDHN
CC(C)CC(=O)NCC[C@H]1CCN(Cc2ccc(F)c(C#N)c2)C1	ZINC001481415682	1394274891	/nfs/dbraw/zinc/27/48/91/1394274891.db2.gz	YAWKAUAGNUMYKZ-HNNXBMFYSA-N	0	3	331.435	3.072	20	30		EGEDHN
CC[C@H](CNC(=O)c1ccc(F)c(C)c1)NCc1ccc(C#N)s1	ZINC001481849421	1394558300	/nfs/dbraw/zinc/55/83/00/1394558300.db2.gz	JSHVDKHGKJQAKL-CQSZACIVSA-N	0	3	345.443	3.366	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)CC2CCOCC2)CCCC[C@@H]1C	ZINC001481958231	1394619780	/nfs/dbraw/zinc/61/97/80/1394619780.db2.gz	UYDGGGRBNDBDKO-KSSFIOAISA-N	0	3	342.911	3.210	20	30		EGEDHN
C=C(Cl)CNC[C@H](CC(C)C)NC(=O)c1cc(C)cc2c[nH]nc21	ZINC001482396461	1394957871	/nfs/dbraw/zinc/95/78/71/1394957871.db2.gz	UDXDWAZJEOBYHX-HNNXBMFYSA-N	0	3	348.878	3.358	20	30		EGEDHN
C[C@H](CN(C)C(=O)CCc1ccccc1)NCc1ccc(C#N)s1	ZINC001485948852	1396172682	/nfs/dbraw/zinc/17/26/82/1396172682.db2.gz	VOWGDFHGYUJECE-OAHLLOKOSA-N	0	3	341.480	3.189	20	30		EGEDHN
C[C@H](CCNC(=O)CCC(F)(F)F)NCc1cc(C#N)ccc1F	ZINC001491999923	1396301964	/nfs/dbraw/zinc/30/19/64/1396301964.db2.gz	KZABFFSQBDKEDE-LLVKDONJSA-N	0	3	345.340	3.024	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1csc2c1CCCC2	ZINC001492121918	1396306115	/nfs/dbraw/zinc/30/61/15/1396306115.db2.gz	VHOKDOKHJGWYNM-GFCCVEGCSA-N	0	3	326.893	3.477	20	30		EGEDHN
CC(C)c1ccccc1CN(C)C[C@@H](C)NC(=O)c1cc(C#N)c[nH]1	ZINC001498254356	1396947403	/nfs/dbraw/zinc/94/74/03/1396947403.db2.gz	KWJRKDQSTDKVLU-OAHLLOKOSA-N	0	3	338.455	3.260	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1cnn2ccccc12	ZINC001689908287	1404200391	/nfs/dbraw/zinc/20/03/91/1404200391.db2.gz	BCYKXLNNJMAYSB-HOCLYGCPSA-N	0	3	346.862	3.060	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@H]1CCN(CCc2ccc(OC)cc2)C1	ZINC001690101895	1404299273	/nfs/dbraw/zinc/29/92/73/1404299273.db2.gz	VVZDBZACWSUCIB-FXAWDEMLSA-N	0	3	330.472	3.031	20	30		EGEDHN
Cc1cc(C(=O)NC[C@@H](C)NCc2ccc(C#N)s2)c(F)cc1F	ZINC001690591309	1404642654	/nfs/dbraw/zinc/64/26/54/1404642654.db2.gz	LBSTYEYLLXPTTF-LLVKDONJSA-N	0	3	349.406	3.115	20	30		EGEDHN
Cc1cc(C(=O)NC[C@@H](C)NCc2ccc(F)c(C#N)c2)sc1C	ZINC001690645123	1404676857	/nfs/dbraw/zinc/67/68/57/1404676857.db2.gz	DWCDMXCDQPQYFK-GFCCVEGCSA-N	0	3	345.443	3.284	20	30		EGEDHN
CCN(CCNC(=O)c1cccc2cc[nH]c21)Cc1ccc(C#N)cc1	ZINC001691042402	1404952248	/nfs/dbraw/zinc/95/22/48/1404952248.db2.gz	KQMNUSSMBCYXCY-UHFFFAOYSA-N	0	3	346.434	3.291	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)C[C@H]2CCc3ccccc3C2)C1	ZINC001691124844	1405065427	/nfs/dbraw/zinc/06/54/27/1405065427.db2.gz	XZMHVOIIWQAFQD-TXPKVOOTSA-N	0	3	346.902	3.419	20	30		EGEDHN
CCC(C)(C)CC(=O)N(C)[C@H](C)CNCc1ccc(F)c(C#N)c1	ZINC001732419678	1428573911	/nfs/dbraw/zinc/57/39/11/1428573911.db2.gz	NTWHDKLITVVKMM-CQSZACIVSA-N	0	3	333.451	3.460	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)N(C)C(=O)CCc1cccs1	ZINC001732455962	1428589694	/nfs/dbraw/zinc/58/96/94/1428589694.db2.gz	AXPOMUWGIFDCSU-CYBMUJFWSA-N	0	3	347.509	3.251	20	30		EGEDHN
C[C@H](CN(C)Cc1cccc(C(F)F)c1)NC(=O)c1cc(C#N)c[nH]1	ZINC001699441293	1412769283	/nfs/dbraw/zinc/76/92/83/1412769283.db2.gz	JFRNWJXEBQGMLO-GFCCVEGCSA-N	0	3	346.381	3.074	20	30		EGEDHN
Cc1csc(C(=O)N[C@@H](C)CN(C)Cc2cccc(C#N)c2)c1	ZINC001699444871	1412777458	/nfs/dbraw/zinc/77/74/58/1412777458.db2.gz	BGUNMUYHZNSZKO-AWEZNQCLSA-N	0	3	327.453	3.179	20	30		EGEDHN
CC(C)CCC(=O)N1CC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001699699295	1413111690	/nfs/dbraw/zinc/11/16/90/1413111690.db2.gz	BRBXASPBJXABBU-OAQYLSRUSA-N	0	3	339.483	3.419	20	30		EGEDHN
CC(C)(F)C(=O)NC[C@]1(C)CCCN(Cc2cccc(C#N)c2)C1	ZINC001699867182	1413306216	/nfs/dbraw/zinc/30/62/16/1413306216.db2.gz	UGOOLWFPXKQKLJ-IBGZPJMESA-N	0	3	331.435	3.025	20	30		EGEDHN
C[C@H](CNC(=O)c1cc(F)ccc1F)N(C)Cc1cccc(C#N)c1	ZINC001700461450	1414060139	/nfs/dbraw/zinc/06/01/39/1414060139.db2.gz	PQWAOPZUUNJESC-CYBMUJFWSA-N	0	3	343.377	3.087	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H](CNCc2ccc(C#N)s2)C(C)(C)C)o1	ZINC001700978947	1414617780	/nfs/dbraw/zinc/61/77/80/1414617780.db2.gz	OUBHLMMQZDMADO-MRXNPFEDSA-N	0	3	345.468	3.456	20	30		EGEDHN
CC(C)(C)[C@H](CNCc1ccc(C#N)s1)NC(=O)c1ccns1	ZINC001700987391	1414630026	/nfs/dbraw/zinc/63/00/26/1414630026.db2.gz	IWGFSUAZIZAMSV-AWEZNQCLSA-N	0	3	348.497	3.011	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)NC(=O)CCCc1cccs1	ZINC001733023772	1429142937	/nfs/dbraw/zinc/14/29/37/1429142937.db2.gz	VUEYLCRIPZUBRU-ZDUSSCGKSA-N	0	3	347.509	3.298	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)C1CC2(CCC2)C1	ZINC001733048295	1429183602	/nfs/dbraw/zinc/18/36/02/1429183602.db2.gz	GHGSANCARLEHDX-OAHLLOKOSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1ccc(COC)o1	ZINC001712998008	1417549570	/nfs/dbraw/zinc/54/95/70/1417549570.db2.gz	DCNYLNZSXRAWNX-ZFWWWQNUSA-N	0	3	340.851	3.151	20	30		EGEDHN
CCCCCCCN1CCC[C@@H](NC(=O)c2cc3cccn3cn2)C1	ZINC001713060778	1417616222	/nfs/dbraw/zinc/61/62/22/1417616222.db2.gz	MGRWTVQMIPVJKM-QGZVFWFLSA-N	0	3	342.487	3.499	20	30		EGEDHN
N#Cc1ccc(CN[C@H](CNC(=O)c2ccsc2)C2CC2)c(F)c1	ZINC001713105691	1417665676	/nfs/dbraw/zinc/66/56/76/1417665676.db2.gz	PRDXLBIXKCDBGF-QGZVFWFLSA-N	0	3	343.427	3.057	20	30		EGEDHN
C[C@@H](NC(=O)CC1CC1)[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001713272187	1417885873	/nfs/dbraw/zinc/88/58/73/1417885873.db2.gz	SLEUYVIDFRJYRQ-DNVCBOLYSA-N	0	3	325.456	3.075	20	30		EGEDHN
CCN(CCNC(=O)Cc1ccccc1C)Cc1ccc(C#N)cc1	ZINC001713496885	1418207571	/nfs/dbraw/zinc/20/75/71/1418207571.db2.gz	PFAXFMNSQIPIEG-UHFFFAOYSA-N	0	3	335.451	3.048	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](NC(=O)CC2CCCC2)C2CC2)s1	ZINC001733163826	1429266104	/nfs/dbraw/zinc/26/61/04/1429266104.db2.gz	QBDJCIOBHCTFEZ-KRWDZBQOSA-N	0	3	331.485	3.184	20	30		EGEDHN
CCCCCCCN1CC[C@H](NC(=O)c2conc2C(F)(F)F)C1	ZINC001713826211	1418626439	/nfs/dbraw/zinc/62/64/39/1418626439.db2.gz	CTUUHVICVYMPHJ-LBPRGKRZSA-N	0	3	347.381	3.468	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1ccc2ccccc2n1)C1CC1	ZINC001714175096	1418982535	/nfs/dbraw/zinc/98/25/35/1418982535.db2.gz	WUIBJNBBSXBSAC-LJQANCHMSA-N	0	3	343.858	3.475	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2cnccc2C)CCCC[C@H]1C	ZINC001714180824	1418989045	/nfs/dbraw/zinc/98/90/45/1418989045.db2.gz	UBQWJQKDQPSRFD-RDTXWAMCSA-N	0	3	335.879	3.411	20	30		EGEDHN
CC[C@@H](N[C@H](C)CNC(=O)c1cc(C#N)c[nH]1)c1ccc(F)cc1F	ZINC001714222598	1419017120	/nfs/dbraw/zinc/01/71/20/1419017120.db2.gz	LJGLGKWNXKXTSD-BDJLRTHQSA-N	0	3	346.381	3.024	20	30		EGEDHN
C[C@H](CNC(=O)c1ccc(CF)cc1)NCc1ccc(F)c(C#N)c1	ZINC001714308078	1419088338	/nfs/dbraw/zinc/08/83/38/1419088338.db2.gz	BKNPVTWFNWJNGY-CYBMUJFWSA-N	0	3	343.377	3.075	20	30		EGEDHN
Cc1coc(C)c1C(=O)NCC[C@@H](C)NCc1ccccc1C#N	ZINC001714466710	1419195160	/nfs/dbraw/zinc/19/51/60/1419195160.db2.gz	PUKUTWFETHIPFA-CQSZACIVSA-N	0	3	325.412	3.066	20	30		EGEDHN
Cc1coc(C)c1C(=O)NCC[C@H](C)NCc1ccccc1C#N	ZINC001714466709	1419195327	/nfs/dbraw/zinc/19/53/27/1419195327.db2.gz	PUKUTWFETHIPFA-AWEZNQCLSA-N	0	3	325.412	3.066	20	30		EGEDHN
C[C@@H](CCNC(=O)CCC(C)(F)F)NCc1cc(C#N)ccc1F	ZINC001714476324	1419199758	/nfs/dbraw/zinc/19/97/58/1419199758.db2.gz	DJSDGIATEIPPQG-LBPRGKRZSA-N	0	3	341.377	3.117	20	30		EGEDHN
COc1ccc(C#N)cc1CNC1(CNC(=O)C(C)(C)C)CCCC1	ZINC001714509578	1419237073	/nfs/dbraw/zinc/23/70/73/1419237073.db2.gz	MOVUTQOJADPLLC-UHFFFAOYSA-N	0	3	343.471	3.132	20	30		EGEDHN
C[C@H](C#N)C(=O)NCC1CN([C@@H](C)c2ccc(C(C)(C)C)cc2)C1	ZINC001714962253	1419700987	/nfs/dbraw/zinc/70/09/87/1419700987.db2.gz	XTZYVVKBVPRWLR-CABCVRRESA-N	0	3	327.472	3.253	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2nncc3ccccc32)CCCC1	ZINC001715097231	1419837455	/nfs/dbraw/zinc/83/74/55/1419837455.db2.gz	JQSMFJFVOIESRX-UHFFFAOYSA-N	0	3	344.846	3.015	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1cnc2ccccc2c1)C1CC1	ZINC001715122024	1419867179	/nfs/dbraw/zinc/86/71/79/1419867179.db2.gz	WZQDJJMIFLZGBS-LJQANCHMSA-N	0	3	343.858	3.475	20	30		EGEDHN
CC1(CC(=O)N[C@H]2CCC[C@H]2CNCc2ccccc2C#N)CC1	ZINC001715566852	1420256791	/nfs/dbraw/zinc/25/67/91/1420256791.db2.gz	KLODQOLRPJDWSX-ROUUACIJSA-N	0	3	325.456	3.123	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cnc(C)nc1C(C)C)C(C)C	ZINC001715659412	1420282304	/nfs/dbraw/zinc/28/23/04/1420282304.db2.gz	JFWKAAIMCZPHSP-HNNXBMFYSA-N	0	3	338.883	3.005	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)C(C)(C)C(F)(F)F	ZINC001716501068	1420727798	/nfs/dbraw/zinc/72/77/98/1420727798.db2.gz	PPWHBWAVQDJGMH-LBPRGKRZSA-N	0	3	341.377	3.083	20	30		EGEDHN
C[C@@H](C(=O)N[C@@H](C)CN(C)Cc1cccc(C#N)c1)c1ccccc1	ZINC001722907180	1424239426	/nfs/dbraw/zinc/23/94/26/1424239426.db2.gz	WHVADFACBDMAGW-DLBZAZTESA-N	0	3	335.451	3.298	20	30		EGEDHN
CCCC[C@H](C)C(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@H]2C1	ZINC001733574215	1429777499	/nfs/dbraw/zinc/77/74/99/1429777499.db2.gz	NMAPCCVBTTUSLE-FFZOFVMBSA-N	0	3	339.483	3.275	20	30		EGEDHN
CC(C)CCC(=O)N1CCC[C@@H]1CN(C)Cc1cccc(C#N)c1	ZINC001725035557	1425457451	/nfs/dbraw/zinc/45/74/51/1425457451.db2.gz	KGNFQDVVXSMVSL-LJQANCHMSA-N	0	3	327.472	3.417	20	30		EGEDHN
C=C(Br)CNCC(C)(C)CN(C)C(=O)C1=CCCC1	ZINC001725139256	1425615782	/nfs/dbraw/zinc/61/57/82/1425615782.db2.gz	ARPHGCYXNNFHOE-UHFFFAOYSA-N	0	3	329.282	3.080	20	30		EGEDHN
Cc1ccsc1C(=O)N(C)C[C@@H](C)NCc1ccc(F)c(C#N)c1	ZINC001725471187	1426142148	/nfs/dbraw/zinc/14/21/48/1426142148.db2.gz	IIRIDULAYOEANB-CYBMUJFWSA-N	0	3	345.443	3.318	20	30		EGEDHN
C[C@H](CN(C)C(=O)[C@H](C)c1ccccc1)NCc1ccc(C#N)s1	ZINC001725519983	1426211241	/nfs/dbraw/zinc/21/12/41/1426211241.db2.gz	XBGFOOUKZRKXKR-HUUCEWRRSA-N	0	3	341.480	3.360	20	30		EGEDHN
C[C@H]1C[C@H](NCc2ccc(C#N)s2)CN1C(=O)CCC(F)(F)F	ZINC001725580088	1426235778	/nfs/dbraw/zinc/23/57/78/1426235778.db2.gz	FJSPHKAWQCTMMB-QWRGUYRKSA-N	0	3	345.390	3.041	20	30		EGEDHN
CC(C)CCC(=O)N[C@@H]1CC[C@@H](CNCc2ccccc2C#N)C1	ZINC001725644304	1426325183	/nfs/dbraw/zinc/32/51/83/1426325183.db2.gz	WDGPDNJPYYROOR-VQIMIIECSA-N	0	3	327.472	3.369	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@@H]1CCCN(CCCc2ccsc2)C1	ZINC001731353457	1427292865	/nfs/dbraw/zinc/29/28/65/1427292865.db2.gz	QIPYKKMJUGWWKC-QGZVFWFLSA-N	0	3	332.513	3.311	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](NCc2cnc(-c3ccccc3)s2)C1	ZINC001731431252	1427413561	/nfs/dbraw/zinc/41/35/61/1427413561.db2.gz	GIKVUMNIJCKHMK-INIZCTEOSA-N	0	3	341.480	3.467	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1cccc(F)c1OCC	ZINC001731737001	1427819285	/nfs/dbraw/zinc/81/92/85/1427819285.db2.gz	SDENOUXKZHKBER-GFCCVEGCSA-N	0	3	328.815	3.075	20	30		EGEDHN
CC(C)SCC(=O)N[C@@H]1CCN(Cc2cccc(C#N)c2)[C@@H](C)C1	ZINC001733895240	1437712868	/nfs/dbraw/zinc/71/28/68/1437712868.db2.gz	OTPCXYRMOGSYAI-MAUKXSAKSA-N	0	3	345.512	3.169	20	30		EGEDHN
C[C@H](CNC(=O)C1=CCCCCC1)N(C)Cc1ccc(C#N)cc1	ZINC001734034153	1437821688	/nfs/dbraw/zinc/82/16/88/1437821688.db2.gz	CJEIMVPJMADFTE-MRXNPFEDSA-N	0	3	325.456	3.385	20	30		EGEDHN
Cc1coc(C(=O)N(C)[C@@H](CNCc2ccc(C#N)s2)C2CC2)c1	ZINC001734305347	1438037387	/nfs/dbraw/zinc/03/73/87/1438037387.db2.gz	RBJWTLRQWLAQCM-INIZCTEOSA-N	0	3	343.452	3.162	20	30		EGEDHN
CCC(=CC(=O)NCCCN(C)Cc1ccc(C#N)c(F)c1)CC	ZINC001751959866	1440128575	/nfs/dbraw/zinc/12/85/75/1440128575.db2.gz	ABCQGYYSJKMNPA-UHFFFAOYSA-N	0	3	331.435	3.382	20	30		EGEDHN
CN(CCCNC(=O)[C@@H]1C[C@H]1C(C)(C)C)Cc1ccc(C#N)c(F)c1	ZINC001752013796	1440132748	/nfs/dbraw/zinc/13/27/48/1440132748.db2.gz	AQWFWNMTERGXON-IAGOWNOFSA-N	0	3	345.462	3.318	20	30		EGEDHN
CCN(CCCNC(=O)C#CC(C)(C)C)Cc1cc(F)ccc1OC	ZINC001752181120	1440151298	/nfs/dbraw/zinc/15/12/98/1440151298.db2.gz	NGBCXTFULISXGW-UHFFFAOYSA-N	0	3	348.462	3.212	20	30		EGEDHN
CCN(CC#Cc1ccccc1)CCCNC(=O)[C@H]1CCC1(C)C	ZINC001752205605	1440154225	/nfs/dbraw/zinc/15/42/25/1440154225.db2.gz	LAUYQNCOOKXVPC-LJQANCHMSA-N	0	3	326.484	3.303	20	30		EGEDHN
C=CCCN1CCN(CCNC(=O)CCC2CCCCCC2)CC1	ZINC001752367161	1440172069	/nfs/dbraw/zinc/17/20/69/1440172069.db2.gz	HVIWUZUYMUQVIG-UHFFFAOYSA-N	0	3	335.536	3.047	20	30		EGEDHN
C=CCN1CCC(N(CCC)C(=O)C[C@@H]2CCO[C@@H](CC)C2)CC1	ZINC001752442261	1440181577	/nfs/dbraw/zinc/18/15/77/1440181577.db2.gz	RXNPQYJTSKVETR-MJGOQNOKSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=C[C@H](C(=O)NC[C@H](NCc1cncs1)C1CC1)c1ccccc1	ZINC001752500667	1440188315	/nfs/dbraw/zinc/18/83/15/1440188315.db2.gz	XLNAESSJFRWWOV-ROUUACIJSA-N	0	3	341.480	3.097	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@H](CN(C)Cc2cn(C)nc2C)C1	ZINC001752515670	1440191108	/nfs/dbraw/zinc/19/11/08/1440191108.db2.gz	BQKKSGLGAAHTMZ-QGZVFWFLSA-N	0	3	346.519	3.001	20	30		EGEDHN
CCC(C)(C)CC(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001752633576	1440197203	/nfs/dbraw/zinc/19/72/03/1440197203.db2.gz	WIDXSXVUBHTDIQ-WKILWMFISA-N	0	3	331.435	3.260	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H](N[C@H](C)c3cnc(C)cn3)C2)CCCC1	ZINC001752691770	1440200616	/nfs/dbraw/zinc/20/06/16/1440200616.db2.gz	LHELUAACGRUBQK-BRWVUGGUSA-N	0	3	342.487	3.219	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@@H]1CCCN(CC[C@@H]2CC2(Cl)Cl)C1	ZINC001752780710	1440208607	/nfs/dbraw/zinc/20/86/07/1440208607.db2.gz	DPWZSIIWAUUWDD-LSDHHAIUSA-N	0	3	345.314	3.058	20	30		EGEDHN
C[C@@H](NC(=O)CC1CCC1)[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001752838359	1440228897	/nfs/dbraw/zinc/22/88/97/1440228897.db2.gz	QRXHQBJKOYODPK-OXQOHEQNSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@H](CNC(=O)C=C1CCCCC1)NCc1ccc(F)c(C#N)c1	ZINC001752862131	1440235838	/nfs/dbraw/zinc/23/58/38/1440235838.db2.gz	NZXZQGMLBGMAPI-CQSZACIVSA-N	0	3	329.419	3.182	20	30		EGEDHN
C[C@H](CNC(=O)C#CC1CC1)NC1c2ccccc2-c2ccccc21	ZINC001752870708	1440237043	/nfs/dbraw/zinc/23/70/43/1440237043.db2.gz	ZSMQHIHADRIXKK-OAHLLOKOSA-N	0	3	330.431	3.264	20	30		EGEDHN
C/C=C(/C)C(=O)N[C@@H]1CCC[C@H](NCc2cc(F)ccc2C#N)C1	ZINC001752966827	1440254174	/nfs/dbraw/zinc/25/41/74/1440254174.db2.gz	KNLILVFUZWFTBY-ZAYZHACPSA-N	0	3	329.419	3.181	20	30		EGEDHN
CC#CCN(C)[C@@H]1CCCN(C(=O)C[C@H](C)c2ccccc2F)C1	ZINC001752998830	1440263436	/nfs/dbraw/zinc/26/34/36/1440263436.db2.gz	NSHGCNCBDFOEGC-DLBZAZTESA-N	0	3	330.447	3.265	20	30		EGEDHN
CC(C)(C)C(=O)NCCC[C@H]1CCCN1Cc1ccccc1C#N	ZINC001753038100	1440275325	/nfs/dbraw/zinc/27/53/25/1440275325.db2.gz	OZQVUJAIPFQIFY-SFHVURJKSA-N	0	3	327.472	3.465	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1CCCNC(=O)c1ccc(N(C)C)cc1	ZINC001753038797	1440275517	/nfs/dbraw/zinc/27/55/17/1440275517.db2.gz	ZGBDCLRJFWQYCQ-GOSISDBHSA-N	0	3	349.906	3.480	20	30		EGEDHN
CCN(CCNC(=O)c1c[nH]c(C#N)c1)Cc1ccc(C2CC2)cc1	ZINC001753080725	1440293795	/nfs/dbraw/zinc/29/37/95/1440293795.db2.gz	GJEUYLVOPGMJKN-UHFFFAOYSA-N	0	3	336.439	3.016	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H](CNC(=O)CCC3CCCC3)C2)c1	ZINC001753119033	1440312882	/nfs/dbraw/zinc/31/28/82/1440312882.db2.gz	MIIUMJLDXICDOE-FQEVSTJZSA-N	0	3	339.483	3.467	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCN(Cc1ccc(C2CCC2)cc1)C1CC1	ZINC001753153237	1440329192	/nfs/dbraw/zinc/32/91/92/1440329192.db2.gz	XPWZWQVFLXNFQG-OAHLLOKOSA-N	0	3	325.456	3.194	20	30		EGEDHN
Cc1cc(C(=O)N(C)CCNCc2ccc(C#N)s2)ccc1Cl	ZINC001753227100	1440340659	/nfs/dbraw/zinc/34/06/59/1440340659.db2.gz	VBRBURLJUSCSOT-UHFFFAOYSA-N	0	3	347.871	3.443	20	30		EGEDHN
CN(CCNCc1ccc(C#N)s1)C(=O)C12CCC(CC1)C2(C)C	ZINC001753239013	1440341919	/nfs/dbraw/zinc/34/19/19/1440341919.db2.gz	CPNQEJNXZBWEBT-UHFFFAOYSA-N	0	3	345.512	3.384	20	30		EGEDHN
Cc1ccccc1C(C)(C)C(=O)N(C)CCNCc1cccc(C#N)c1	ZINC001753267811	1440345020	/nfs/dbraw/zinc/34/50/20/1440345020.db2.gz	LEQBNCXXQFPXMW-UHFFFAOYSA-N	0	3	349.478	3.393	20	30		EGEDHN
C#CCCN[C@@H](CNC(=O)CC(F)(F)C(F)(F)F)c1ccccc1	ZINC001753302980	1440354676	/nfs/dbraw/zinc/35/46/76/1440354676.db2.gz	MSAODERNGXVDHB-ZDUSSCGKSA-N	0	3	348.315	3.045	20	30		EGEDHN
C=CC(C)(C)C(=O)NCC[C@@H]1CCN(Cc2ccc(C#N)c(F)c2)C1	ZINC001753335693	1440372107	/nfs/dbraw/zinc/37/21/07/1440372107.db2.gz	XTQHCGYTDKATSY-OAHLLOKOSA-N	0	3	343.446	3.238	20	30		EGEDHN
C=CCC1(C(=O)NCC[C@H]2CCN([C@@H](C)c3cnccn3)C2)CCC1	ZINC001753336564	1440372686	/nfs/dbraw/zinc/37/26/86/1440372686.db2.gz	WCGOQCHJDTWTCI-IRXDYDNUSA-N	0	3	342.487	3.112	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NCC1CN(Cc2ccc(C)cc2C)C1	ZINC001753407383	1440392267	/nfs/dbraw/zinc/39/22/67/1440392267.db2.gz	HJXDUHPEBKQLJR-OAQYLSRUSA-N	0	3	344.499	3.080	20	30		EGEDHN
C=CCCCN1C[C@@H]2C[C@H]1CN2C(=O)c1coc2c1cccc2OC	ZINC001753420993	1440395188	/nfs/dbraw/zinc/39/51/88/1440395188.db2.gz	SDHPMCLYXBQKSC-GJZGRUSLSA-N	0	3	340.423	3.306	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(C(C)C)cn1	ZINC001753425438	1440396731	/nfs/dbraw/zinc/39/67/31/1440396731.db2.gz	WCMHEXGSBADITF-SZMVWBNQSA-N	0	3	327.472	3.458	20	30		EGEDHN
CC[C@@H](CNC(=O)c1c[nH]c(C#N)c1)N[C@H](C)c1ccccc1Cl	ZINC001753473817	1440414755	/nfs/dbraw/zinc/41/47/55/1440414755.db2.gz	VRNYDVZRSWZSHU-OCCSQVGLSA-N	0	3	344.846	3.399	20	30		EGEDHN
CC[C@H](CNC(=O)c1ccc(F)s1)NCc1ccc(C#N)c(F)c1	ZINC001753498836	1440422738	/nfs/dbraw/zinc/42/27/38/1440422738.db2.gz	ZQPUCHBYJJJVGJ-CYBMUJFWSA-N	0	3	349.406	3.196	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)C[C@@H]1Cc2ccccc2O1)C1CC1	ZINC001753519064	1440428177	/nfs/dbraw/zinc/42/81/77/1440428177.db2.gz	WCMCLCMZXLXSPB-QFBILLFUSA-N	0	3	348.874	3.007	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1cncc2ccccc21)C1CC1	ZINC001753528299	1440430077	/nfs/dbraw/zinc/43/00/77/1440430077.db2.gz	WGENAYFVQOEWON-LJQANCHMSA-N	0	3	343.858	3.475	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2cscn2)CCCC[C@@H]1C	ZINC001753531693	1440431297	/nfs/dbraw/zinc/43/12/97/1440431297.db2.gz	LMTXYSPBLJWWIA-XHDPSFHLSA-N	0	3	327.881	3.164	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC[C@H](CCNCc2ccc(C#N)cc2F)C1	ZINC001753544995	1440433973	/nfs/dbraw/zinc/43/39/73/1440433973.db2.gz	HPTRAQRAFFBQNH-ZLCWXWNNSA-N	0	3	343.446	3.382	20	30		EGEDHN
CC#CCNCc1ccc(CNC(=O)[C@H](C)c2ccsc2)cc1	ZINC001753590585	1440442716	/nfs/dbraw/zinc/44/27/16/1440442716.db2.gz	KWVOOAJSSLSCBZ-OAHLLOKOSA-N	0	3	326.465	3.281	20	30		EGEDHN
CC(C(=O)NC[C@H](C)CNCc1cc(F)ccc1C#N)=C1CCC1	ZINC001753613498	1440449280	/nfs/dbraw/zinc/44/92/80/1440449280.db2.gz	YPHGIJAGFHPYBZ-CYBMUJFWSA-N	0	3	329.419	3.040	20	30		EGEDHN
C#CCC1(C(=O)NC[C@@H](C)CNCc2csc(C)n2)CCCCC1	ZINC001753644498	1440455344	/nfs/dbraw/zinc/45/53/44/1440455344.db2.gz	HKOHWOUTWMGVIB-HNNXBMFYSA-N	0	3	347.528	3.267	20	30		EGEDHN
C#CCCCC(=O)N(C)[C@H](C)CNCc1cc(Cl)cc2c1OCC2	ZINC001753684496	1440465344	/nfs/dbraw/zinc/46/53/44/1440465344.db2.gz	FCFJUHOULYPUEW-CQSZACIVSA-N	0	3	348.874	3.015	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)N(C)C(=O)C[C@H]1C=CCCC1	ZINC001753698980	1440468060	/nfs/dbraw/zinc/46/80/60/1440468060.db2.gz	OECQULFHVPWSGT-GJZGRUSLSA-N	0	3	331.485	3.303	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)c(F)c1)N(C)C(=O)C12CCC(CC1)C2	ZINC001753699641	1440468260	/nfs/dbraw/zinc/46/82/60/1440468260.db2.gz	ZUZGZBVHKXVJFQ-BQTBQCLESA-N	0	3	343.446	3.214	20	30		EGEDHN
C=CCCCC(=O)N(C)[C@H](C)CNCC#Cc1cccc(Cl)c1	ZINC001753711362	1440470714	/nfs/dbraw/zinc/47/07/14/1440470714.db2.gz	YQCVYXFHYQQKJJ-MRXNPFEDSA-N	0	3	332.875	3.484	20	30		EGEDHN
CCC1(C(=O)N(C)[C@@H](C)CNCC#Cc2ccccc2Cl)CC1	ZINC001753711451	1440470788	/nfs/dbraw/zinc/47/07/88/1440470788.db2.gz	QCSRUYYCGWDYNS-HNNXBMFYSA-N	0	3	332.875	3.318	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@H](C)CNCc2cccc(C(C)C)n2)C1	ZINC001753711958	1440470845	/nfs/dbraw/zinc/47/08/45/1440470845.db2.gz	AWZXESJAUOOREX-MRXNPFEDSA-N	0	3	329.488	3.498	20	30		EGEDHN
CC(C)C[C@@H](CNCc1ccc(C#N)s1)NC(=O)c1ccoc1	ZINC001753732822	1440476726	/nfs/dbraw/zinc/47/67/26/1440476726.db2.gz	KUYMHWMFXIQWGP-AWEZNQCLSA-N	0	3	331.441	3.147	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](NCc2cc(C3CC3)no2)[C@H](C)C1	ZINC001753756069	1440483175	/nfs/dbraw/zinc/48/31/75/1440483175.db2.gz	ZHSJWALGHHVZFD-RHSMWYFYSA-N	0	3	345.487	3.481	20	30		EGEDHN
C=CCCCC(=O)N1CCCC[C@@H]1CCNCc1ccc(F)cn1	ZINC001753785469	1440487986	/nfs/dbraw/zinc/48/79/86/1440487986.db2.gz	UJWVYFOWKIYLNY-GOSISDBHSA-N	0	3	333.451	3.438	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@@H]([C@@H](C)NCc2ccn(CC)n2)C1	ZINC001753799727	1440490579	/nfs/dbraw/zinc/49/05/79/1440490579.db2.gz	QGKHZPDYOUGTSU-IAGOWNOFSA-N	0	3	346.519	3.222	20	30		EGEDHN
CCC(=O)N1CCC[C@H](C)[C@H]1CNCC#Cc1cccc(Cl)c1	ZINC001753800731	1440490785	/nfs/dbraw/zinc/49/07/85/1440490785.db2.gz	DDOZQWFFWOHYAX-MAUKXSAKSA-N	0	3	332.875	3.318	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H](C)[C@H]1CNCc1ccnc(Cl)c1	ZINC001753818950	1440495101	/nfs/dbraw/zinc/49/51/01/1440495101.db2.gz	NYULBRNTJZCHBZ-NVXWUHKLSA-N	0	3	347.890	3.255	20	30		EGEDHN
CC(C)[C@H](CNC(=O)/C=C/c1ccco1)NCC#Cc1ccccc1	ZINC001753822219	1440496788	/nfs/dbraw/zinc/49/67/88/1440496788.db2.gz	DTLUDCKPPSFXIA-SJFMBGHLSA-N	0	3	336.435	3.075	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)C(C)(C)C1CC1)NCC#Cc1ccc(F)cc1	ZINC001753837500	1440501529	/nfs/dbraw/zinc/50/15/29/1440501529.db2.gz	NGRCDGPHKJEYFQ-LJQANCHMSA-N	0	3	344.474	3.344	20	30		EGEDHN
CN(CCN(C)C(=O)CCC1CCCC1)Cc1ccc(C#N)cc1	ZINC001753848198	1440505593	/nfs/dbraw/zinc/50/55/93/1440505593.db2.gz	WGDNKHUTUINMJF-UHFFFAOYSA-N	0	3	327.472	3.419	20	30		EGEDHN
C[C@H](CCNCc1cc(C#N)ccc1F)NC(=O)c1sccc1F	ZINC001753962969	1440526347	/nfs/dbraw/zinc/52/63/47/1440526347.db2.gz	BJECZLOCWVIGMB-LLVKDONJSA-N	0	3	349.406	3.196	20	30		EGEDHN
C=C(Cl)CNCC[C@@H](C)NC(=O)CCc1cc(F)ccc1F	ZINC001754025631	1440533051	/nfs/dbraw/zinc/53/30/51/1440533051.db2.gz	NSXODHIMHWLNPZ-GFCCVEGCSA-N	0	3	330.806	3.134	20	30		EGEDHN
CCN(CCNCc1ccc(F)c(C#N)c1)C(=O)[C@@]1(C)CCC[C@H]1C	ZINC001754065385	1440537454	/nfs/dbraw/zinc/53/74/54/1440537454.db2.gz	DDLGPBYKYVHSEG-QRWLVFNGSA-N	0	3	345.462	3.462	20	30		EGEDHN
CC(C)(C)/C=C\C(=O)NC/C=C\CNCc1ccc(F)c(C#N)c1	ZINC001754104619	1440541463	/nfs/dbraw/zinc/54/14/63/1440541463.db2.gz	VDEBJFOFNKGPQO-WPAMCMATSA-N	0	3	329.419	3.062	20	30		EGEDHN
C=C[C@@H](C(=O)NC/C=C\CNCCC(F)(F)F)c1ccccc1	ZINC001754210548	1440551144	/nfs/dbraw/zinc/55/11/44/1440551144.db2.gz	ZCKQOFYVRSWICO-IDTUSYRASA-N	0	3	326.362	3.171	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)NC(=O)c1cccc(Cl)c1	ZINC001754291382	1440565233	/nfs/dbraw/zinc/56/52/33/1440565233.db2.gz	IEXNEFLHCGKLHN-NSHDSACASA-N	0	3	333.844	3.181	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](NC(=O)c2ccc(Cl)o2)C2CC2)s1	ZINC001754433276	1440597481	/nfs/dbraw/zinc/59/74/81/1440597481.db2.gz	CAEWNZKRCVFERA-ZDUSSCGKSA-N	0	3	349.843	3.164	20	30		EGEDHN
C=CCCCCCN1CC[C@@H]1CNC(=O)[C@H]1CCc2cccnc21	ZINC001754492173	1440610636	/nfs/dbraw/zinc/61/06/36/1440610636.db2.gz	XFQYBLPSNRXWPZ-MSOLQXFVSA-N	0	3	327.472	3.048	20	30		EGEDHN
CC(C)[C@]1(C)C[C@H]1C(=O)NCC1(NCc2ccc(F)c(C#N)c2)CC1	ZINC001754530568	1440622367	/nfs/dbraw/zinc/62/23/67/1440622367.db2.gz	WNDDRIFMXXVHNB-LPHOPBHVSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=CCOCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C(C)(C)C1CCC1	ZINC001754544629	1440626894	/nfs/dbraw/zinc/62/68/94/1440626894.db2.gz	XNHVKHNYSINDAU-MSOLQXFVSA-N	0	3	334.504	3.081	20	30		EGEDHN
C#CCCCC(=O)N1C[C@H]2CCC[C@@H](C1)N2CC1CC2(CCC2)C1	ZINC001754551817	1440630228	/nfs/dbraw/zinc/63/02/28/1440630228.db2.gz	QTLOZYIKSUGSIS-KDURUIRLSA-N	0	3	328.500	3.436	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@@]2(CCN(CCC(F)(F)F)C2)C1	ZINC001754565798	1440635469	/nfs/dbraw/zinc/63/54/69/1440635469.db2.gz	NFNLQVHNFRLBDU-GDBMZVCRSA-N	0	3	332.410	3.466	20	30		EGEDHN
CCCc1[nH]ccc1C(=O)N1CCC[C@H]1CNCC#Cc1ccccc1	ZINC001754615176	1440644294	/nfs/dbraw/zinc/64/42/94/1440644294.db2.gz	DEPZFNKZHWWEEC-IBGZPJMESA-N	0	3	349.478	3.213	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N1CCC[C@H]1CNCC#Cc1ccc(F)cc1	ZINC001754615716	1440644514	/nfs/dbraw/zinc/64/45/14/1440644514.db2.gz	YZRRDWFYHFPDKK-MBNKTHEGSA-N	0	3	340.442	3.280	20	30		EGEDHN
C#CCN(C(=O)C[C@@H]1CCC(C)(C)CO1)C1CCN(CC(=C)C)CC1	ZINC001754638223	1440648722	/nfs/dbraw/zinc/64/87/22/1440648722.db2.gz	QGCIALRHRCINHO-IBGZPJMESA-N	0	3	346.515	3.084	20	30		EGEDHN
C#CCN(C(=O)COc1ccsc1)C1CCN(CC=C(C)C)CC1	ZINC001754642065	1440649242	/nfs/dbraw/zinc/64/92/42/1440649242.db2.gz	HGCLGWBLCQAEIG-UHFFFAOYSA-N	0	3	346.496	3.019	20	30		EGEDHN
C#CCN(C(=O)[C@H](C)Cc1ccccc1)C1CCN(CC(=C)C)CC1	ZINC001754643421	1440649485	/nfs/dbraw/zinc/64/94/85/1440649485.db2.gz	XUXYGADTJZJGOC-LJQANCHMSA-N	0	3	338.495	3.368	20	30		EGEDHN
CC1(C(=O)N[C@@H](CNCc2ccc(C#N)s2)C2CCCC2)CC1	ZINC001754650631	1440651770	/nfs/dbraw/zinc/65/17/70/1440651770.db2.gz	QUYLDIAZIDMNDL-INIZCTEOSA-N	0	3	331.485	3.184	20	30		EGEDHN
C=CCOCC(=O)N[C@@]1(C)CCN([C@@H](CC)c2ccc(F)cc2)C1	ZINC001754668538	1440657397	/nfs/dbraw/zinc/65/73/97/1440657397.db2.gz	NJBQBNCOQLTWRE-HKUYNNGSSA-N	0	3	334.435	3.060	20	30		EGEDHN
C=CCN1CCC[C@](C)(CNC(=O)c2ccc3nc(C)oc3c2)C1	ZINC001754727354	1440676956	/nfs/dbraw/zinc/67/69/56/1440676956.db2.gz	IWLDPOWZDYCLTA-LJQANCHMSA-N	0	3	327.428	3.154	20	30		EGEDHN
CC#CCN1CCC[C@@](C)(CNC(=O)Cc2ccc(C)c(C)c2)C1	ZINC001754732897	1440680523	/nfs/dbraw/zinc/68/05/23/1440680523.db2.gz	FBPIGWBZBNTHQU-NRFANRHFSA-N	0	3	326.484	3.088	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@H]1CN(CCCCCF)CCC1(F)F	ZINC001754743285	1440683558	/nfs/dbraw/zinc/68/35/58/1440683558.db2.gz	IJJGMAPODDWOQU-AWEZNQCLSA-N	0	3	334.426	3.412	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(Cc1cc(C)no1)C2	ZINC001754782217	1440686624	/nfs/dbraw/zinc/68/66/24/1440686624.db2.gz	ABNBSDYIAMRHHD-XHSDSOJGSA-N	0	3	331.460	3.054	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2Cc1cnc(C)o1	ZINC001754832165	1440695845	/nfs/dbraw/zinc/69/58/45/1440695845.db2.gz	ZHTDJQZRYLIECD-ZJPYXAASSA-N	0	3	345.487	3.445	20	30		EGEDHN
CC#CCNCCN(Cc1ccccc1)C(=O)C(C)(C)C(F)(F)F	ZINC001754839327	1440697407	/nfs/dbraw/zinc/69/74/07/1440697407.db2.gz	LWQLJRGNOPRKNA-UHFFFAOYSA-N	0	3	340.389	3.217	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@@H](CC(C)C)c3ccccc3)C[C@@H]2C1	ZINC001754844350	1440698792	/nfs/dbraw/zinc/69/87/92/1440698792.db2.gz	INTCBVSEXPGIMH-HBMCJLEFSA-N	0	3	338.495	3.230	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCN(C(=O)c2cnc3ccsc3c2)C1	ZINC001754926521	1440709915	/nfs/dbraw/zinc/70/99/15/1440709915.db2.gz	SKOTYMQHQNONPA-ZDUSSCGKSA-N	0	3	349.887	3.491	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](CCNCc3oc(C)nc3C)C2)CC1	ZINC001754930245	1440710436	/nfs/dbraw/zinc/71/04/36/1440710436.db2.gz	GVDNPDZSOFZUAS-QGZVFWFLSA-N	0	3	345.487	3.366	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](CCNCc2ccn(C(C)C)n2)C1	ZINC001754932522	1440710777	/nfs/dbraw/zinc/71/07/77/1440710777.db2.gz	AOQHGAKITVJBNK-KRWDZBQOSA-N	0	3	346.519	3.395	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCN(C(=O)[C@H](CC)OC2CCCC2)C1	ZINC001754934074	1440711004	/nfs/dbraw/zinc/71/10/04/1440711004.db2.gz	IPHBJBDJMBWGCD-RDJZCZTQSA-N	0	3	342.911	3.305	20	30		EGEDHN
C#CCN[C@@H](C)c1ccc(CNC(=O)C2(C(F)(F)F)CCC2)cc1	ZINC001754947169	1440713697	/nfs/dbraw/zinc/71/36/97/1440713697.db2.gz	GVZMUVFMJQMFKL-ZDUSSCGKSA-N	0	3	338.373	3.319	20	30		EGEDHN
CC[C@@H](C)CC(=O)NCC1(NCc2ccc(C#N)c(F)c2)CCC1	ZINC001754981105	1440721352	/nfs/dbraw/zinc/72/13/52/1440721352.db2.gz	DFCNIWUOJRRXBL-CQSZACIVSA-N	0	3	331.435	3.262	20	30		EGEDHN
C=CCC1(C(=O)NCC2(NCc3ccc(C#N)s3)CCC2)CCC1	ZINC001754985683	1440722714	/nfs/dbraw/zinc/72/27/14/1440722714.db2.gz	AJYVJJBUFUTQAO-UHFFFAOYSA-N	0	3	343.496	3.495	20	30		EGEDHN
COCC#CCN1CCC[C@@H](NC(=O)c2ccc(C(C)C)cc2)CC1	ZINC001755031592	1440731989	/nfs/dbraw/zinc/73/19/89/1440731989.db2.gz	VKTBCBNCQCGSCK-HXUWFJFHSA-N	0	3	342.483	3.044	20	30		EGEDHN
CCC[C@@H](C)C(=O)N(C)CCCN(C)Cc1ccc(C#N)c(F)c1	ZINC001755035067	1440733717	/nfs/dbraw/zinc/73/37/17/1440733717.db2.gz	HHFARFAIQXLNRR-OAHLLOKOSA-N	0	3	333.451	3.414	20	30		EGEDHN
CCCCCC(=O)N1C[C@@H](C)[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001755103222	1440753577	/nfs/dbraw/zinc/75/35/77/1440753577.db2.gz	IPQQLTFLDSFVTG-APWZRJJASA-N	0	3	330.447	3.194	20	30		EGEDHN
Cc1ccccc1CC(=O)N1C[C@@H](C)[C@@H](NCC#Cc2ccccc2)C1	ZINC001755121425	1440755662	/nfs/dbraw/zinc/75/56/62/1440755662.db2.gz	HVOZPDSNBKPGAE-KNQAVFIVSA-N	0	3	346.474	3.026	20	30		EGEDHN
C=CCC[C@H](C)N1CCc2ccccc2[C@@H]1CNC(=O)C#CC1CC1	ZINC001755172535	1440769712	/nfs/dbraw/zinc/76/97/12/1440769712.db2.gz	TXFSAUQUSVPXTQ-UWJYYQICSA-N	0	3	336.479	3.470	20	30		EGEDHN
C=CCCCN1CCOC2(CCN(C(=O)[C@@H]3CCCC[C@@H]3C)CC2)C1	ZINC001755174318	1440770270	/nfs/dbraw/zinc/77/02/70/1440770270.db2.gz	NUJINPJBKNGXRO-RBUKOAKNSA-N	0	3	348.531	3.472	20	30		EGEDHN
CC[C@@H](C)CCC(=O)N1CCC2(CCN(CC#CCOC)CC2)CC1	ZINC001755176056	1440770818	/nfs/dbraw/zinc/77/08/18/1440770818.db2.gz	RMMAUUMWTPLCQA-LJQANCHMSA-N	0	3	348.531	3.167	20	30		EGEDHN
CC(C)=C(C)CC(=O)NC1CC(CNCc2cc(C#N)ccc2F)C1	ZINC001755216420	1440784028	/nfs/dbraw/zinc/78/40/28/1440784028.db2.gz	YQUPHCIFBNSSSZ-UHFFFAOYSA-N	0	3	343.446	3.428	20	30		EGEDHN
C[C@@H](NCC#Cc1ccc(Cl)cc1)[C@H](C)NC(=O)c1ccco1	ZINC001755223279	1440785119	/nfs/dbraw/zinc/78/51/19/1440785119.db2.gz	KVJFCZYZEXAZMX-KGLIPLIRSA-N	0	3	330.815	3.081	20	30		EGEDHN
Cc1occc1C(=O)N[C@H](C)[C@H](C)NCC#Cc1ccccc1Cl	ZINC001755228142	1440786493	/nfs/dbraw/zinc/78/64/93/1440786493.db2.gz	ZJZYUWJKFIYIDU-UONOGXRCSA-N	0	3	344.842	3.390	20	30		EGEDHN
C[C@@H](NCC#Cc1ccccc1)[C@@H](C)NC(=O)C1(c2ccccc2)CC1	ZINC001755269022	1440797144	/nfs/dbraw/zinc/79/71/44/1440797144.db2.gz	UJKNFPAVVTVKRA-RTBURBONSA-N	0	3	346.474	3.253	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1csc(C2CC2)n1	ZINC001755288698	1440802798	/nfs/dbraw/zinc/80/27/98/1440802798.db2.gz	ZVHCZAHTXNYRKW-UHFFFAOYSA-N	0	3	341.908	3.461	20	30		EGEDHN
O=C(NC1(CNCC#Cc2ccccc2)CCCCC1)c1ccc[nH]1	ZINC001755348327	1440827095	/nfs/dbraw/zinc/82/70/95/1440827095.db2.gz	WEFRFTUNBBEDDY-UHFFFAOYSA-N	0	3	335.451	3.089	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)C[C@@H]2CCCCO2)CCCCC1	ZINC001755350433	1440827683	/nfs/dbraw/zinc/82/76/83/1440827683.db2.gz	RROSPNKZQWSEDO-HNNXBMFYSA-N	0	3	328.884	3.107	20	30		EGEDHN
CCCC[C@H](CNCC#Cc1ccc(F)cc1)NC(=O)c1ccc[nH]1	ZINC001755356166	1440829470	/nfs/dbraw/zinc/82/94/70/1440829470.db2.gz	GVEWDUHXOHIZAW-GOSISDBHSA-N	0	3	341.430	3.084	20	30		EGEDHN
CCCC[C@@H](CNCC#CCOC)NC(=O)C1CCC(C)(C)CC1	ZINC001755361629	1440831794	/nfs/dbraw/zinc/83/17/94/1440831794.db2.gz	XJURSSIVOXWCFF-SFHVURJKSA-N	0	3	336.520	3.117	20	30		EGEDHN
Cc1ncccc1CN1CCCCC[C@@H]1CNC(=O)C#CC(C)(C)C	ZINC001755363673	1440833164	/nfs/dbraw/zinc/83/31/64/1440833164.db2.gz	MUDNLFRZZYYBGU-LJQANCHMSA-N	0	3	341.499	3.300	20	30		EGEDHN
C=CCCCC(=O)N[C@@H](C)C1CN(Cc2cccc(N(C)C)c2)C1	ZINC001755381174	1440839255	/nfs/dbraw/zinc/83/92/55/1440839255.db2.gz	DUYAAJOKXIYGBP-INIZCTEOSA-N	0	3	329.488	3.045	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@]3(C2)CN(CCC(C)C)CCO3)CCCC1	ZINC001755403030	1440843219	/nfs/dbraw/zinc/84/32/19/1440843219.db2.gz	FRBVPWCJKISKOD-OAQYLSRUSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1CN(Cc2cccc(CC)c2)CC1(C)C	ZINC001755415020	1440847981	/nfs/dbraw/zinc/84/79/81/1440847981.db2.gz	DIGPMOZLKORXIC-LJQANCHMSA-N	0	3	344.499	3.168	20	30		EGEDHN
C[C@@H](CCCNCc1cccc(Cl)n1)NC(=O)C#CC(C)(C)C	ZINC001755497653	1440862246	/nfs/dbraw/zinc/86/22/46/1440862246.db2.gz	BSFOLCQJYVEGMT-AWEZNQCLSA-N	0	3	335.879	3.159	20	30		EGEDHN
C[C@@H](CCCNCC#Cc1ccccc1Cl)NC(=O)[C@@H]1C[C@H]1C	ZINC001755511500	1440863595	/nfs/dbraw/zinc/86/35/95/1440863595.db2.gz	OXNDJXZMUYNERE-HLLBOEOZSA-N	0	3	332.875	3.222	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](C)CCCN[C@@H](C)c2cnccn2)CC1	ZINC001755515428	1440864194	/nfs/dbraw/zinc/86/41/94/1440864194.db2.gz	SKAHXZWZKCHQFD-CVEARBPZSA-N	0	3	330.476	3.159	20	30		EGEDHN
C=C(Cl)CNCCC[C@H](C)NC(=O)C[C@@H]1OCc2ccccc21	ZINC001755523322	1440865307	/nfs/dbraw/zinc/86/53/07/1440865307.db2.gz	UKBKTLYHEVWCBT-YOEHRIQHSA-N	0	3	336.863	3.275	20	30		EGEDHN
C[C@@H]1C[C@@H]1C(=O)N1CCC(N(C)CC#Cc2ccccc2Cl)CC1	ZINC001755525600	1440865605	/nfs/dbraw/zinc/86/56/05/1440865605.db2.gz	KHEDJBQPDAGFNS-QAPCUYQASA-N	0	3	344.886	3.270	20	30		EGEDHN
CN(CC#Cc1ccccc1)C1CCN(C(=O)[C@@H]2CCC2(F)F)CC1	ZINC001755530910	1440867230	/nfs/dbraw/zinc/86/72/30/1440867230.db2.gz	UAIDFQCQSHLSOR-SFHVURJKSA-N	0	3	346.421	3.006	20	30		EGEDHN
C=C(Br)CNC[C@@H](C1CC1)N(C)C(=O)[C@@H](C)C(C)(C)C	ZINC001755559896	1440874253	/nfs/dbraw/zinc/87/42/53/1440874253.db2.gz	LUBPCNZOUWPALK-OCCSQVGLSA-N	0	3	345.325	3.404	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N(C)[C@H](CNCC#Cc1ccc(F)cc1)C1CC1	ZINC001755568862	1440876546	/nfs/dbraw/zinc/87/65/46/1440876546.db2.gz	FIUMRCQKVIAGNJ-OXQOHEQNSA-N	0	3	344.474	3.296	20	30		EGEDHN
CC/C(C)=C/C(=O)N(C)[C@@H](CNCc1cc(C#N)ccc1F)C1CC1	ZINC001755571637	1440877074	/nfs/dbraw/zinc/87/70/74/1440877074.db2.gz	PRXGVZNDKHRBML-JNMQVBFRSA-N	0	3	343.446	3.380	20	30		EGEDHN
COc1ccc(CN[C@@H](C)CN(C)C(=O)/C=C/C(C)(C)C)cc1C#N	ZINC001755581456	1440879440	/nfs/dbraw/zinc/87/94/40/1440879440.db2.gz	HNVNRVHNDQZRNW-FEAKQIBJSA-N	0	3	343.471	3.106	20	30		EGEDHN
C[C@H](CN(C)C(=O)CC1CC(C)(C)C1)NCc1ccc(C#N)s1	ZINC001755601307	1440884235	/nfs/dbraw/zinc/88/42/35/1440884235.db2.gz	KBTCQNRLTGXYAU-CYBMUJFWSA-N	0	3	333.501	3.383	20	30		EGEDHN
Cc1cc(C(=O)N(C)C[C@@H](C)NCc2ccc(C#N)s2)ccc1F	ZINC001755603273	1440884701	/nfs/dbraw/zinc/88/47/01/1440884701.db2.gz	XYDYMLHGMMOTOX-CYBMUJFWSA-N	0	3	345.443	3.318	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](NCc2ccc(F)c(F)c2)[C@H]1C	ZINC001755650732	1440891324	/nfs/dbraw/zinc/89/13/24/1440891324.db2.gz	QPGXYFFUIHJBET-RDTXWAMCSA-N	0	3	334.410	3.237	20	30		EGEDHN
C[C@@H]1C[C@@H](NCC#Cc2ccc(F)cc2)CN1C(=O)C1(F)CCCC1	ZINC001755680163	1440895014	/nfs/dbraw/zinc/89/50/14/1440895014.db2.gz	DJLHDFBZOWXDIG-CRAIPNDOSA-N	0	3	346.421	3.039	20	30		EGEDHN
C#CCCCC(=O)N[C@@]12CCC[C@@H]1N(Cc1c(C)nsc1C)CC2	ZINC001755697690	1440898471	/nfs/dbraw/zinc/89/84/71/1440898471.db2.gz	ARNNDFMYXBEAIR-PKOBYXMFSA-N	0	3	345.512	3.177	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H]2CCC[C@H](NCc3nc(C)sc3C)[C@@H]2C1	ZINC001755708387	1440903176	/nfs/dbraw/zinc/90/31/76/1440903176.db2.gz	BNNFJLBFQXFSTJ-BBWFWOEESA-N	0	3	347.528	3.443	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H]3CCC[C@H](NCc4ccon4)[C@H]3C2)CCC1	ZINC001755709918	1440903428	/nfs/dbraw/zinc/90/34/28/1440903428.db2.gz	XBPITDMURSEGKI-SZMVWBNQSA-N	0	3	343.471	3.138	20	30		EGEDHN
Cc1nc(C(C)C)oc1CNC[C@H]1CC[C@@H](NC(=O)C#CC(C)C)C1	ZINC001755734843	1440910789	/nfs/dbraw/zinc/91/07/89/1440910789.db2.gz	XDRJOEKMUJGVGU-DLBZAZTESA-N	0	3	345.487	3.140	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1C[C@H](NCc2ccccc2F)C(C)(C)C1	ZINC001755752261	1440913381	/nfs/dbraw/zinc/91/33/81/1440913381.db2.gz	GAVNJCIRDMGYGN-QAPCUYQASA-N	0	3	348.462	3.134	20	30		EGEDHN
CCC[C@H](C)C(=O)N1C[C@H](NCc2ccc(C#N)s2)C(C)(C)C1	ZINC001755754153	1440913677	/nfs/dbraw/zinc/91/36/77/1440913677.db2.gz	SAUVHLBLPMOTNL-BBRMVZONSA-N	0	3	333.501	3.383	20	30		EGEDHN
CS[C@H](C)CC(=O)N1C[C@H](NCC#Cc2ccccc2)C(C)(C)C1	ZINC001755755833	1440913965	/nfs/dbraw/zinc/91/39/65/1440913965.db2.gz	VXDDIPUDUCESRT-AEFFLSMTSA-N	0	3	344.524	3.006	20	30		EGEDHN
C=C(C)CN(C)CCN(C(=O)c1cccc(C(F)(F)F)n1)C(C)C	ZINC001755814790	1440922813	/nfs/dbraw/zinc/92/28/13/1440922813.db2.gz	OBJWCOWWBGHNSH-UHFFFAOYSA-N	0	3	343.393	3.459	20	30		EGEDHN
C#CCCCC(=O)N[C@@H](CNCc1ccc(Cl)nc1)C(C)(C)C	ZINC001755823463	1440926299	/nfs/dbraw/zinc/92/62/99/1440926299.db2.gz	HCKPSEXPDQJOSX-HNNXBMFYSA-N	0	3	335.879	3.159	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC1=CCN(CCOc2ccccc2)CC1	ZINC001755892223	1440941804	/nfs/dbraw/zinc/94/18/04/1440941804.db2.gz	BRTSALQVFASNSF-NRFANRHFSA-N	0	3	342.483	3.416	20	30		EGEDHN
C=CCN1CC=C(CNC(=O)[C@H](OC(C)C)c2ccccc2)CC1	ZINC001755900685	1440943891	/nfs/dbraw/zinc/94/38/91/1440943891.db2.gz	OZTFMWALQXJCAL-LJQANCHMSA-N	0	3	328.456	3.087	20	30		EGEDHN
C=CCNCc1ccc(CNC(=O)c2sccc2OC)c(F)c1	ZINC001755902385	1440944338	/nfs/dbraw/zinc/94/43/38/1440944338.db2.gz	GTHCYZUBKSQQHW-UHFFFAOYSA-N	0	3	334.416	3.101	20	30		EGEDHN
CCN(CC)[C@@H](Cn1c(C)nnc1N(C)[C@H](C)CC#N)c1ccco1	ZINC001766597890	1441402742	/nfs/dbraw/zinc/40/27/42/1441402742.db2.gz	HHCDJKWCEOJLRX-ZBFHGGJFSA-N	0	3	344.463	3.001	20	30		EGEDHN
CCN(CC)[C@@H](Cn1c(C)nnc1N(C)[C@@H](C)CC#N)c1ccco1	ZINC001766597889	1441402778	/nfs/dbraw/zinc/40/27/78/1441402778.db2.gz	HHCDJKWCEOJLRX-HOCLYGCPSA-N	0	3	344.463	3.001	20	30		EGEDHN
N#Cc1cccc(C(=O)N2C[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C2)c1	ZINC000368130564	168314735	/nfs/dbraw/zinc/31/47/35/168314735.db2.gz	CXNIYPJEVHPZNT-LEWJYISDSA-N	0	3	345.446	3.152	20	30		EGEDHN
Cc1ccc(C(=O)NCCN[C@H](C)c2ccc(C#N)cc2)cc1F	ZINC000173871956	231058077	/nfs/dbraw/zinc/05/80/77/231058077.db2.gz	YZDUFNDSJOPHGU-CQSZACIVSA-N	0	3	325.387	3.086	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccccc2S[C@@H](C)CC#N)CC1	ZINC000066800576	215080766	/nfs/dbraw/zinc/08/07/66/215080766.db2.gz	HRGLTGIRBJCPEG-HNNXBMFYSA-N	0	3	341.480	3.365	20	30		EGEDHN
COCCCCCN1CCN(c2c(C#N)cnc3ccccc32)CC1	ZINC000103227559	219272209	/nfs/dbraw/zinc/27/22/09/219272209.db2.gz	WXMXBUFYDSRUMT-UHFFFAOYSA-N	0	3	338.455	3.045	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2c(C)cccc2OC(F)F)CC1	ZINC000069332601	215379840	/nfs/dbraw/zinc/37/98/40/215379840.db2.gz	VNIPFYBBXOQCPM-UHFFFAOYSA-N	0	3	339.386	3.368	20	30		EGEDHN
C[C@H](NC[C@@H](c1cccs1)N1CCOCC1)c1cccc(C#N)c1	ZINC000181397766	234174333	/nfs/dbraw/zinc/17/43/33/234174333.db2.gz	JTSQAFJXBCMFNN-YJBOKZPZSA-N	0	3	341.480	3.344	20	30		EGEDHN
Cc1ccc(C(=O)NCCN[C@@H](C)c2cccc(C#N)c2)cc1F	ZINC000181466044	234195755	/nfs/dbraw/zinc/19/57/55/234195755.db2.gz	HDCDUZNRKQSBKA-AWEZNQCLSA-N	0	3	325.387	3.086	20	30		EGEDHN
N#Cc1ccc(Cl)cc1NC(=O)CN[C@H](CCO)C1CCCCC1	ZINC000181495733	234205553	/nfs/dbraw/zinc/20/55/53/234205553.db2.gz	VVYSYHIUFIQNEO-MRXNPFEDSA-N	0	3	349.862	3.071	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cccc(C(F)(F)F)c2F)CC1	ZINC000079542190	217239945	/nfs/dbraw/zinc/23/99/45/217239945.db2.gz	UQLFEUFHTCFVSN-UHFFFAOYSA-N	0	3	330.325	3.225	20	30		EGEDHN
N#Cc1ccc(NCc2ccc(CN3CCC(O)CC3)cc2)c(F)c1	ZINC000264312557	246337658	/nfs/dbraw/zinc/33/76/58/246337658.db2.gz	SZEJZWCSQBDCFU-UHFFFAOYSA-N	0	3	339.414	3.266	20	30		EGEDHN
C#CCNC(=O)[C@@H](C)N[C@H](C)c1ccc(-c2ccccc2OC)cc1	ZINC000266435080	248299063	/nfs/dbraw/zinc/29/90/63/248299063.db2.gz	FDCSKBCKUWRQKX-HZPDHXFCSA-N	0	3	336.435	3.151	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N(CC)C[C@H]1CCN(Cc2ccccc2)C1	ZINC000266527818	248345735	/nfs/dbraw/zinc/34/57/35/248345735.db2.gz	JSPVQQFPUMBYFQ-QUCCMNQESA-N	0	3	344.499	3.338	20	30		EGEDHN
Cc1ccccc1[C@@H](C)N[C@@H]1CCN(c2sccc2C#N)C1=O	ZINC000267725565	251289131	/nfs/dbraw/zinc/28/91/31/251289131.db2.gz	VSNCSZWAEAEZRI-CZUORRHYSA-N	0	3	325.437	3.384	20	30		EGEDHN
C=C(CN[C@@H](C)c1ccc(S(C)(=O)=O)c(OC)c1)c1ccccc1	ZINC000268809091	252261836	/nfs/dbraw/zinc/26/18/36/252261836.db2.gz	IJOIERLKIBWDIR-HNNXBMFYSA-N	0	3	345.464	3.463	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N(CCN(C)C)Cc1cccc(F)c1	ZINC000337820338	141062222	/nfs/dbraw/zinc/06/22/22/141062222.db2.gz	QKPZHSDWHHOUGN-UHFFFAOYSA-N	0	3	339.414	3.210	20	30		EGEDHN
C[C@H](N[C@H]1CCCN(C(=O)Cc2ccccc2)C1)c1ccc(C#N)cc1	ZINC000338032461	141077063	/nfs/dbraw/zinc/07/70/63/141077063.db2.gz	VXOBJCFVJFZGNZ-UWJYYQICSA-N	0	3	347.462	3.443	20	30		EGEDHN
CN(CCN(C)C1CC1)c1c(C#N)cnc2c(F)ccc(Cl)c21	ZINC000351566278	144280578	/nfs/dbraw/zinc/28/05/78/144280578.db2.gz	YZJHJRWRBHHJGZ-UHFFFAOYSA-N	0	3	332.810	3.429	20	30		EGEDHN
C[C@@H](c1ccc(-n2cncn2)cc1)N(C)Cc1ccc(C#N)c(F)c1	ZINC000191919293	153231462	/nfs/dbraw/zinc/23/14/62/153231462.db2.gz	KJBVBISXWVPIKW-AWEZNQCLSA-N	0	3	335.386	3.471	20	30		EGEDHN
COCCN(Cc1ccc(C#N)cc1)Cc1ccc(-n2ccnc2)cc1	ZINC000101547028	162050039	/nfs/dbraw/zinc/05/00/39/162050039.db2.gz	OXVDVLYYZYEULQ-UHFFFAOYSA-N	0	3	346.434	3.393	20	30		EGEDHN
CN1CCC(N(Cc2ccccc2)C(=O)c2ccc(C#N)cc2)CC1	ZINC000129059848	162345233	/nfs/dbraw/zinc/34/52/33/162345233.db2.gz	JQTWLCHILYVPAV-UHFFFAOYSA-N	0	3	333.435	3.295	20	30		EGEDHN
CN(Cc1cc(C#N)n(C)c1)C[C@H]1C[C@H](F)CN1Cc1cccs1	ZINC000354933143	166067406	/nfs/dbraw/zinc/06/74/06/166067406.db2.gz	FZIMFSMJJOKYKV-DOTOQJQBSA-N	0	3	346.475	3.003	20	30		EGEDHN
C[C@@H](NCCN1C(=O)CCC1=O)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000359886988	167258256	/nfs/dbraw/zinc/25/82/56/167258256.db2.gz	UGTLCNOEAQRALT-OAHLLOKOSA-N	0	3	347.418	3.025	20	30		EGEDHN
C[C@H](C(=O)N[C@H]1CCN(C)[C@@H]1c1ccccc1)c1cccc(C#N)c1	ZINC000360393830	167319054	/nfs/dbraw/zinc/31/90/54/167319054.db2.gz	LEAGCQFXCRLMBT-RYGJVYDSSA-N	0	3	333.435	3.223	20	30		EGEDHN
C[C@@H](C(=O)NCC1CCN(c2ccncc2)CC1)c1cccc(C#N)c1	ZINC000360728694	167399268	/nfs/dbraw/zinc/39/92/68/167399268.db2.gz	KYLLDBBXLPPUNU-MRXNPFEDSA-N	0	3	348.450	3.090	20	30		EGEDHN
CCCN(CC)CC(=O)Nc1c(C#N)c(C)c(C)n1Cc1ccco1	ZINC000299381310	270043413	/nfs/dbraw/zinc/04/34/13/270043413.db2.gz	OBXRVRSIPHIWJP-UHFFFAOYSA-N	0	3	342.443	3.288	20	30		EGEDHN
N#Cc1c(N[C@@H]2CCCN(Cc3ccccc3)C2)nc2ccccn12	ZINC000302064932	270044347	/nfs/dbraw/zinc/04/43/47/270044347.db2.gz	CPCMTZWZEBIGNX-QGZVFWFLSA-N	0	3	331.423	3.282	20	30		EGEDHN
CC#CCN(C)CCC(=O)Nc1sc2c(c1C#N)CC[C@H](C)C2	ZINC000411775088	270046628	/nfs/dbraw/zinc/04/66/28/270046628.db2.gz	WVYPMLLHZAINRU-ZDUSSCGKSA-N	0	3	329.469	3.028	20	30		EGEDHN
N#Cc1ccccc1OCCN[C@@H](c1ccccc1)C1(CO)CCC1	ZINC000433313276	270050781	/nfs/dbraw/zinc/05/07/81/270050781.db2.gz	USWWJHUBMDPSQM-FQEVSTJZSA-N	0	3	336.435	3.431	20	30		EGEDHN
N#Cc1ccccc1COc1cccc(CNC[C@@H](O)C2CCC2)c1	ZINC000449741101	270052715	/nfs/dbraw/zinc/05/27/15/270052715.db2.gz	SNFVZZRLSNFSOS-OAQYLSRUSA-N	0	3	336.435	3.388	20	30		EGEDHN
C[C@H](N[C@@H]1CCN(c2ccc(C#N)cc2)C1=O)[C@@H](C)c1ccccc1	ZINC000476824476	270055514	/nfs/dbraw/zinc/05/55/14/270055514.db2.gz	OTZYKZVNNJLTEO-GQIGUUNPSA-N	0	3	333.435	3.445	20	30		EGEDHN
CN1CCN(Cc2ccc(NCc3ccc(C#N)cc3F)cc2)CC1	ZINC000533311699	270060647	/nfs/dbraw/zinc/06/06/47/270060647.db2.gz	CWTIOAXFDROULN-UHFFFAOYSA-N	0	3	338.430	3.057	20	30		EGEDHN
C[C@H]1CCC[C@H]1CC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000185896318	265505991	/nfs/dbraw/zinc/50/59/91/265505991.db2.gz	OSSDDXKVAGNZHO-LPHOPBHVSA-N	0	3	327.472	3.275	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)c1cc(C#N)oc1C)c1ccsc1	ZINC000280526511	266119815	/nfs/dbraw/zinc/11/98/15/266119815.db2.gz	GICQGBQLYJGIBF-MRXNPFEDSA-N	0	3	331.441	3.334	20	30		EGEDHN
CC[C@H](NCc1ccc(NS(C)(=O)=O)cc1)c1ccc(C#N)cc1	ZINC000278869218	266408567	/nfs/dbraw/zinc/40/85/67/266408567.db2.gz	WWCZZOLTPWJTMC-SFHVURJKSA-N	0	3	343.452	3.171	20	30		EGEDHN
CCCCN1CCCC[C@H]1CNC(=O)[C@@H](C)Oc1ccc(C#N)cc1	ZINC000523342976	267007411	/nfs/dbraw/zinc/00/74/11/267007411.db2.gz	XMIRSRMHSSKSIY-AEFFLSMTSA-N	0	3	343.471	3.096	20	30		EGEDHN
CCCCNC(=O)C1(NCCOc2cccc(C#N)c2)CCCCC1	ZINC000440907815	267009451	/nfs/dbraw/zinc/00/94/51/267009451.db2.gz	YIEOQASIIUCOSV-UHFFFAOYSA-N	0	3	343.471	3.146	20	30		EGEDHN
CCC[C@H]1CN(Cc2ccc(C#N)cc2Cl)CCN1CCOC	ZINC000439428479	267037790	/nfs/dbraw/zinc/03/77/90/267037790.db2.gz	GHXBLNMNNDHUSU-KRWDZBQOSA-N	0	3	335.879	3.144	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)N(C)[C@H](C)C1CCN(C)CC1	ZINC000273499381	267048858	/nfs/dbraw/zinc/04/88/58/267048858.db2.gz	QFHNPGWOMWBEFF-CQSZACIVSA-N	0	3	344.459	3.151	20	30		EGEDHN
CCN(CCN1CCCCCC1)C(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1	ZINC000412340734	267064009	/nfs/dbraw/zinc/06/40/09/267064009.db2.gz	DJYKGUJWZKHENU-VQTJNVASSA-N	0	3	339.483	3.386	20	30		EGEDHN
CCN(CCOc1cccc(C#N)c1)Cc1ccc(OC)cc1OC	ZINC000519906744	267066298	/nfs/dbraw/zinc/06/62/98/267066298.db2.gz	SOYORJRTUPWKNH-UHFFFAOYSA-N	0	3	340.423	3.476	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2cccc(F)c2C#N)CN1Cc1ccccc1	ZINC000186316948	267091679	/nfs/dbraw/zinc/09/16/79/267091679.db2.gz	HJVKAVDJWLEMCJ-ZBFHGGJFSA-N	0	3	337.398	3.090	20	30		EGEDHN
CCOC(=O)N1CCC[C@H]([C@@H](C)NCc2cccc(C#N)c2F)C1	ZINC000495486512	267123243	/nfs/dbraw/zinc/12/32/43/267123243.db2.gz	HTNLGQGZILSLLM-CJNGLKHVSA-N	0	3	333.407	3.044	20	30		EGEDHN
CCO[C@H]1C[C@@H](NCC(=O)Nc2ccc(C#N)cc2)C1(CC)CC	ZINC000429338320	267157387	/nfs/dbraw/zinc/15/73/87/267157387.db2.gz	MGENFQKHEKDLDF-SJORKVTESA-N	0	3	329.444	3.070	20	30		EGEDHN
CCS[C@H]1CCCC[C@H]1NCc1cccc(C(=O)OC)c1C#N	ZINC000527298739	267181874	/nfs/dbraw/zinc/18/18/74/267181874.db2.gz	ZTAJIPDPTBFNCC-SJORKVTESA-N	0	3	332.469	3.499	20	30		EGEDHN
CC[C@@H](NC1CCC(Oc2ncccc2C#N)CC1)c1nccn1C	ZINC000527349946	267194285	/nfs/dbraw/zinc/19/42/85/267194285.db2.gz	NVHKWBYQXVQHBC-OFLPRAFFSA-N	0	3	339.443	3.118	20	30		EGEDHN
CC(C)O[C@@H]1C[C@@H](N[C@H](C)C(=O)Nc2ccccc2C#N)C1(C)C	ZINC000274206606	267197951	/nfs/dbraw/zinc/19/79/51/267197951.db2.gz	OERIYPGPXJYGEH-KBRIMQKVSA-N	0	3	329.444	3.067	20	30		EGEDHN
Cc1c(C#N)cccc1NC(=O)N1CCN(C2CCCCC2)CC1	ZINC000178582563	267285411	/nfs/dbraw/zinc/28/54/11/267285411.db2.gz	HCQGPMRMYNXHSI-UHFFFAOYSA-N	0	3	326.444	3.349	20	30		EGEDHN
COC(=O)N1CCC(CN[C@@H](C)c2ccc(C#N)cc2Cl)CC1	ZINC000497055504	267374209	/nfs/dbraw/zinc/37/42/09/267374209.db2.gz	OWGGFBUCFDIWEV-LBPRGKRZSA-N	0	3	335.835	3.341	20	30		EGEDHN
Cc1ccc(C#N)cc1NC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1	ZINC000286884244	267388752	/nfs/dbraw/zinc/38/87/52/267388752.db2.gz	DEAQTUAGYKNKRR-SFHVURJKSA-N	0	3	340.402	3.430	20	30		EGEDHN
C[C@H](C(=O)N1CCN(CCC(C)(C)C)CC1)c1cccc(C#N)c1	ZINC000461924568	267803212	/nfs/dbraw/zinc/80/32/12/267803212.db2.gz	XCVWCLYCLJEDRP-INIZCTEOSA-N	0	3	327.472	3.242	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CC[C@@H](c3ccccc3)C2)cc1	ZINC000279421013	268083863	/nfs/dbraw/zinc/08/38/63/268083863.db2.gz	WXBOWNUENVBRSV-UXHICEINSA-N	0	3	329.403	3.257	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@H]2CCCOc3ccccc32)cc1	ZINC000279306111	268091920	/nfs/dbraw/zinc/09/19/20/268091920.db2.gz	MPURXELTTDOTAD-MJGOQNOKSA-N	0	3	345.402	3.271	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@H]2CCCc3sccc32)cc1	ZINC000280175238	268092431	/nfs/dbraw/zinc/09/24/31/268092431.db2.gz	XVXOITQAPHGZBZ-WBVHZDCISA-N	0	3	335.432	3.496	20	30		EGEDHN
N#Cc1ccc(F)c(CNC(=O)[C@@H]2CCCCN2C2CCCC2)c1	ZINC000331708566	268102807	/nfs/dbraw/zinc/10/28/07/268102807.db2.gz	BZGKPBXKQONFOL-SFHVURJKSA-N	0	3	329.419	3.111	20	30		EGEDHN
Cn1cc(CN2CCC(CCNC(=O)OC(C)(C)C)CC2)cc1C#N	ZINC000496417072	268127723	/nfs/dbraw/zinc/12/77/23/268127723.db2.gz	KJCLMJAXNDTJIU-UHFFFAOYSA-N	0	3	346.475	3.024	20	30		EGEDHN
N#Cc1cc(Br)ccc1CN[C@@H]([C@@H](CO)C1CC1)C1CC1	ZINC000451611106	268174748	/nfs/dbraw/zinc/17/47/48/268174748.db2.gz	LBQDANDNZKOEAS-DLBZAZTESA-N	0	3	349.272	3.207	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN2CCC(N3CCc4ccccc43)CC2)cc1	ZINC000282040617	268214210	/nfs/dbraw/zinc/21/42/10/268214210.db2.gz	LLWQTIJULJOBPZ-JOCHJYFZSA-N	0	3	347.462	3.119	20	30		EGEDHN
N#Cc1ccc(CNC(=O)C2CCN(Cc3ccccc3)CC2)s1	ZINC000421603395	268224843	/nfs/dbraw/zinc/22/48/43/268224843.db2.gz	VCFDQIQGHZYSSZ-UHFFFAOYSA-N	0	3	339.464	3.148	20	30		EGEDHN
N#Cc1ccc(CNC(=O)c2cccc(CN3CCCC3)c2)s1	ZINC000421926674	268231736	/nfs/dbraw/zinc/23/17/36/268231736.db2.gz	XLWWHGBUEZVPDL-UHFFFAOYSA-N	0	3	325.437	3.146	20	30		EGEDHN
N#Cc1ccc(CNCc2cccc(CN3CCCC3=O)c2)cc1F	ZINC000421323432	268233335	/nfs/dbraw/zinc/23/33/35/268233335.db2.gz	GNGZFMMGXNNFAA-UHFFFAOYSA-N	0	3	337.398	3.110	20	30		EGEDHN
N#Cc1cnc(N2C[C@@H]3CCN(Cc4ccccc4)C[C@@H]3C2)c(F)c1	ZINC000413295349	268313040	/nfs/dbraw/zinc/31/30/40/268313040.db2.gz	DLGWTSKSKQPBPE-ZWKOTPCHSA-N	0	3	336.414	3.051	20	30		EGEDHN
CC(C)Oc1ccc(NC(=O)N[C@H](C)CN2CCCCC2)cc1C#N	ZINC000435556219	269626689	/nfs/dbraw/zinc/62/66/89/269626689.db2.gz	BPKSOSDAYOGWME-OAHLLOKOSA-N	0	3	344.459	3.341	20	30		EGEDHN
CO[C@@H](CN1CCCN(Cc2ccc(C#N)cc2)CC1)c1ccccc1	ZINC000338547224	274059394	/nfs/dbraw/zinc/05/93/94/274059394.db2.gz	UAANUQDELJMDJP-QFIPXVFZSA-N	0	3	349.478	3.454	20	30		EGEDHN
CS[C@H]1CN(c2ccc(C#N)cc2C(F)(F)F)C[C@@H]1N(C)C	ZINC000340735477	278168042	/nfs/dbraw/zinc/16/80/42/278168042.db2.gz	ATYWPQIFUCSCEF-KBPBESRZSA-N	0	3	329.391	3.059	20	30		EGEDHN
Cc1cccc2ncc(CN(CCN(C)C)Cc3ccc(C#N)cc3)n21	ZINC000348933353	281320623	/nfs/dbraw/zinc/32/06/23/281320623.db2.gz	ITUTWCCEYYDEJZ-UHFFFAOYSA-N	0	3	347.466	3.078	20	30		EGEDHN
N#Cc1cnn(-c2ccccc2)c1NC(=O)CN(C1CC1)C1CCCC1	ZINC000064809341	307357819	/nfs/dbraw/zinc/35/78/19/307357819.db2.gz	TYUVBXPFRYQCAI-UHFFFAOYSA-N	0	3	349.438	3.089	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(C(=O)OCc3ccccc3)C2)s1	ZINC000496223330	311680747	/nfs/dbraw/zinc/68/07/47/311680747.db2.gz	DJXOYSWBLYNRAZ-OAHLLOKOSA-N	0	3	341.436	3.120	20	30		EGEDHN
CCc1ccc(C(C)(C)NCC(=O)NCc2ccc(C#N)cc2)cc1	ZINC000539358115	314308339	/nfs/dbraw/zinc/30/83/39/314308339.db2.gz	LEEARSCCHWHKRX-UHFFFAOYSA-N	0	3	335.451	3.262	20	30		EGEDHN
C[C@@H](CCc1ccccc1)CN1CCN(c2nccnc2C#N)C[C@H]1C	ZINC000539408557	314312303	/nfs/dbraw/zinc/31/23/03/314312303.db2.gz	YKVQOFNAJURTHO-ZWKOTPCHSA-N	0	3	349.482	3.128	20	30		EGEDHN
C[C@H](CCc1ccccc1)CN1CCN(c2nccnc2C#N)C[C@@H]1C	ZINC000539408547	314312456	/nfs/dbraw/zinc/31/24/56/314312456.db2.gz	YKVQOFNAJURTHO-MSOLQXFVSA-N	0	3	349.482	3.128	20	30		EGEDHN
COC(=O)c1cccc(CN[C@@H](Cc2ccccc2)C2CC2)c1C#N	ZINC000542549662	314558177	/nfs/dbraw/zinc/55/81/77/314558177.db2.gz	CINSKFRQXJXJKM-FQEVSTJZSA-N	0	3	334.419	3.456	20	30		EGEDHN
CC(C)n1cc([C@H](C)NCCC(=O)Nc2ccc(C#N)cc2)cn1	ZINC000542575246	314560419	/nfs/dbraw/zinc/56/04/19/314560419.db2.gz	ZPCCWCNHVZOKOI-AWEZNQCLSA-N	0	3	325.416	3.015	20	30		EGEDHN
Cc1ccc(NC(=O)CCN[C@@H]2CCCc3cc(C#N)ccc32)nc1	ZINC000553293902	315255629	/nfs/dbraw/zinc/25/56/29/315255629.db2.gz	OQTGBHZUNYWPOC-GOSISDBHSA-N	0	3	334.423	3.258	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CNC2(c3ccc(Cl)cc3)CC2)cc1	ZINC000553338175	315258639	/nfs/dbraw/zinc/25/86/39/315258639.db2.gz	ZTHRXZFVQGHIAB-KRWDZBQOSA-N	0	3	342.826	3.230	20	30		EGEDHN
Cc1csc(NC(=O)N2CCCN(C3CCCC3)CC2)c1C#N	ZINC000563357237	316005491	/nfs/dbraw/zinc/00/54/91/316005491.db2.gz	RTZMXXHICLTUCG-UHFFFAOYSA-N	0	3	332.473	3.410	20	30		EGEDHN
CC(C)(C)N1CC[C@@H](N[C@H]2CCCCc3cc(C#N)ccc32)C1=O	ZINC000567856165	316684517	/nfs/dbraw/zinc/68/45/17/316684517.db2.gz	DBLWLIRWWJGSQN-ZWKOTPCHSA-N	0	3	325.456	3.315	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CN[C@@H]2CCSc3ccccc32)cc1	ZINC000568971723	316847898	/nfs/dbraw/zinc/84/78/98/316847898.db2.gz	IUABNRKJYGLVFN-MAUKXSAKSA-N	0	3	340.448	3.125	20	30		EGEDHN
Cc1ccc2c(c1)[C@@H](NC[C@H](O)COc1ccc(C#N)cc1)CCC2	ZINC000572115149	317293019	/nfs/dbraw/zinc/29/30/19/317293019.db2.gz	SUQBAOYKJLFRQD-RXVVDRJESA-N	0	3	336.435	3.274	20	30		EGEDHN
CC(C)(C)c1ccc(OC[C@H](O)CNCc2ccc(C#N)s2)cc1	ZINC000572993313	317422656	/nfs/dbraw/zinc/42/26/56/317422656.db2.gz	XPHNDEPBFHIWFY-OAHLLOKOSA-N	0	3	344.480	3.447	20	30		EGEDHN
Cc1cc([C@H](NCc2cnc3c(C#N)cnn3c2)C2CC2)ccc1F	ZINC000574158645	317567632	/nfs/dbraw/zinc/56/76/32/317567632.db2.gz	QAAMQOGQCAEYTQ-GOSISDBHSA-N	0	3	335.386	3.289	20	30		EGEDHN
CN(Cc1ccccc1)C1(CNC(=O)Cc2ccc(C#N)cc2)CCC1	ZINC000386638975	324268966	/nfs/dbraw/zinc/26/89/66/324268966.db2.gz	IEJAJFVNFFQJIR-UHFFFAOYSA-N	0	3	347.462	3.272	20	30		EGEDHN
CC[C@H](Cc1ccc(C)cc1)N(C)Cc1cnc2c(C#N)cnn2c1	ZINC000580432026	325249489	/nfs/dbraw/zinc/24/94/89/325249489.db2.gz	LWELIHUIFCNCHQ-LJQANCHMSA-N	0	3	333.439	3.363	20	30		EGEDHN
CC(C)OCCCN(C)[C@H](C)C(=O)N(C)C1(C#N)CCC(C)CC1	ZINC000354211336	457132722	/nfs/dbraw/zinc/13/27/22/457132722.db2.gz	WFUQXHRDOWKHNB-TVRKMHQQSA-N	0	3	337.508	3.053	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cnn([C@H](C)C3CC3)c2)CC1	ZINC000189635627	455225015	/nfs/dbraw/zinc/22/50/15/455225015.db2.gz	UJUOKIQMRBRLAD-CQSZACIVSA-N	0	3	331.464	3.016	20	30		EGEDHN
C[C@@H](C#N)CSc1ccccc1NC(=O)NC1CCN(C)CC1	ZINC000264502527	455225752	/nfs/dbraw/zinc/22/57/52/455225752.db2.gz	CUBKWTYHTMOJRH-ZDUSSCGKSA-N	0	3	332.473	3.154	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@H](C)N1CC[C@H](c2ccccc2OC)C1	ZINC000157812693	455234799	/nfs/dbraw/zinc/23/47/99/455234799.db2.gz	FWTDHGUIRGYHJR-IRXDYDNUSA-N	0	3	330.472	3.298	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1N[C@@H](C)C(=O)Nc1cc(Cl)ccc1Cl	ZINC000451601874	458482265	/nfs/dbraw/zinc/48/22/65/458482265.db2.gz	CAVKJZUESPMFNW-BHYNMZESSA-N	0	3	329.227	3.254	20	30		EGEDHN
C=CCSCCNC(=O)N(CCC)CCN1CCCCCC1	ZINC000460144723	458502189	/nfs/dbraw/zinc/50/21/89/458502189.db2.gz	YDZPJRNSOLIGIZ-UHFFFAOYSA-N	0	3	327.538	3.203	20	30		EGEDHN
CC[C@@H](CSc1ccc(C)c(C)c1)NC(=O)[C@H](N)CCCC#N	ZINC000424177425	458577156	/nfs/dbraw/zinc/57/71/56/458577156.db2.gz	UHCMIKZFMAECRE-DOTOQJQBSA-N	0	3	333.501	3.312	20	30		EGEDHN
CC(C)Oc1ccc(NC(=O)N(C)C[C@H]2CCCN(C)C2)cc1C#N	ZINC000157877529	455243960	/nfs/dbraw/zinc/24/39/60/455243960.db2.gz	XYWGKZCUKZVUEU-HNNXBMFYSA-N	0	3	344.459	3.151	20	30		EGEDHN
CC(C)(CO)[C@@H](NCC#Cc1ccc(C(F)(F)F)cc1)C1CC1	ZINC000567412768	459102367	/nfs/dbraw/zinc/10/23/67/459102367.db2.gz	LRDIXWXNOLMAJA-INIZCTEOSA-N	0	3	325.374	3.444	20	30		EGEDHN
CC(C)(C#N)CCN1CCC(c2nc(-c3ccccn3)no2)CC1	ZINC000157912300	455247894	/nfs/dbraw/zinc/24/78/94/455247894.db2.gz	WSTCZHIJPARVGL-UHFFFAOYSA-N	0	3	325.416	3.251	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)N[C@H](C)c1cccc(-n2cccn2)c1	ZINC000173202774	455247066	/nfs/dbraw/zinc/24/70/66/455247066.db2.gz	SFBCQWGXJUEZOS-SJORKVTESA-N	0	3	338.455	3.112	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@H](NCc2ccc(OCC#N)cc2)C1	ZINC000180848379	455255448	/nfs/dbraw/zinc/25/54/48/455255448.db2.gz	QRQZBACFBRRDHU-INIZCTEOSA-N	0	3	345.443	3.078	20	30		EGEDHN
C#CCCCNC(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000173318358	455264963	/nfs/dbraw/zinc/26/49/63/455264963.db2.gz	FMIURECGSYJRGX-MJGOQNOKSA-N	0	3	327.472	3.094	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]1NCc1ccc(OCC#N)cc1	ZINC000183318078	455277025	/nfs/dbraw/zinc/27/70/25/455277025.db2.gz	UKVAQIZYMVFVCS-IAGOWNOFSA-N	0	3	345.443	3.124	20	30		EGEDHN
C[C@H](c1ccccc1)[C@H](C)NCCS(=O)(=O)c1ccc(C#N)cc1	ZINC000181525767	455348867	/nfs/dbraw/zinc/34/88/67/455348867.db2.gz	FMVUDPBECLMNHI-HOTGVXAUSA-N	0	3	342.464	3.114	20	30		EGEDHN
Cc1ccc([C@@H](C)N[C@H]2CCN(Cc3ccc(C#N)cc3)C2=O)s1	ZINC000190604008	455350605	/nfs/dbraw/zinc/35/06/05/455350605.db2.gz	KBHHPFUKBYJFQC-PBHICJAKSA-N	0	3	339.464	3.380	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1CNCc1cc(C)c(Br)cn1	ZINC000623512624	460590425	/nfs/dbraw/zinc/59/04/25/460590425.db2.gz	OVRWJOXUTCGARQ-WFASDCNBSA-N	0	3	325.250	3.223	20	30		EGEDHN
COc1ccc(CN2CC[C@H]3OCCC[C@H]3C2)cc1OCCCC#N	ZINC000245715402	455363023	/nfs/dbraw/zinc/36/30/23/455363023.db2.gz	GVINYLXQBXITAT-ZWKOTPCHSA-N	0	3	344.455	3.379	20	30		EGEDHN
N#Cc1cc([N+](=O)[O-])ccc1NCC1(N2CCSCC2)CCCC1	ZINC000029620729	453830375	/nfs/dbraw/zinc/83/03/75/453830375.db2.gz	KYIMEQDVWVOVDJ-UHFFFAOYSA-N	0	3	346.456	3.240	20	30		EGEDHN
C[C@@H](NC[C@@H](O)COc1ccc(Cl)cc1)c1ccc(C#N)cc1	ZINC000030532765	453836326	/nfs/dbraw/zinc/83/63/26/453836326.db2.gz	BOPWEAHBNGYFQF-CXAGYDPISA-N	0	3	330.815	3.302	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)Cc1cc(=O)n2cc(C)ccc2n1	ZINC000052825623	453846529	/nfs/dbraw/zinc/84/65/29/453846529.db2.gz	WSYDPEXHWMNALU-UHFFFAOYSA-N	0	3	346.434	3.287	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cc(Cl)c(Cl)cc2OC)CC1	ZINC000190761998	455379214	/nfs/dbraw/zinc/37/92/14/455379214.db2.gz	CSWPDLPCGVDKKY-UHFFFAOYSA-N	0	3	341.238	3.286	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(OCCCC)cc2C)CC1	ZINC000066921951	453885973	/nfs/dbraw/zinc/88/59/73/453885973.db2.gz	TUXUQWORVPRFOW-UHFFFAOYSA-N	0	3	328.456	3.458	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2c(C)nc(C(C)C)nc2SC)CC1	ZINC000081687358	453903579	/nfs/dbraw/zinc/90/35/79/453903579.db2.gz	XOROGGMUPYPQJS-UHFFFAOYSA-N	0	3	348.516	3.011	20	30		EGEDHN
C[C@H](C(=O)N(C)CCC#N)N1CCC(CCc2ccccc2)CC1	ZINC000054148524	453913476	/nfs/dbraw/zinc/91/34/76/453913476.db2.gz	IECFQGPTIXWYFF-QGZVFWFLSA-N	0	3	327.472	3.092	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)c1ccc(C#N)c(C)n1)c1ccccc1	ZINC000075723166	453922305	/nfs/dbraw/zinc/92/23/05/453922305.db2.gz	ONPQGCYCTOQIMB-IBGZPJMESA-N	0	3	336.439	3.075	20	30		EGEDHN
C=CCN(CC=C)C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000067734376	453961450	/nfs/dbraw/zinc/96/14/50/453961450.db2.gz	HMIZMSHDFLYMHQ-LJQANCHMSA-N	0	3	327.472	3.282	20	30		EGEDHN
C[C@@H](NC(=O)NCC(C)(C)N1CCCCC1)c1ccc(C#N)cc1	ZINC000042317660	454005995	/nfs/dbraw/zinc/00/59/95/454005995.db2.gz	VCKYZPBVUGKSES-OAHLLOKOSA-N	0	3	328.460	3.183	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N(C)[C@@H](C)c1ccccn1)C(C)C	ZINC000068583904	454039737	/nfs/dbraw/zinc/03/97/37/454039737.db2.gz	CWDPCGYENCMTDM-HKUYNNGSSA-N	0	3	344.503	3.483	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N(C)[C@H](C)c1cccnc1)C(C)C	ZINC000068583897	454039921	/nfs/dbraw/zinc/03/99/21/454039921.db2.gz	HCKAVNZJPISEMP-IEBWSBKVSA-N	0	3	344.503	3.483	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@@H]2C[C@@H]2c2c(F)cccc2Cl)CC1	ZINC000076994578	454057920	/nfs/dbraw/zinc/05/79/20/454057920.db2.gz	RBFDULUUTRPDCF-UONOGXRCSA-N	0	3	336.838	3.349	20	30		EGEDHN
Cn1cc(CNC2(c3ccc4c(c3)OCCO4)CCCC2)cc1C#N	ZINC000190926217	455407955	/nfs/dbraw/zinc/40/79/55/455407955.db2.gz	RXNKYAZIWJGKJU-UHFFFAOYSA-N	0	3	337.423	3.227	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H]2CC(C)(C)Cc3oc(C)cc32)CC1	ZINC000057172766	454108675	/nfs/dbraw/zinc/10/86/75/454108675.db2.gz	UNLUMLHOTQGSML-QGZVFWFLSA-N	0	3	328.456	3.063	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@H](Cc2ccccc2)N(C)C)cc1	ZINC000045053475	454135492	/nfs/dbraw/zinc/13/54/92/454135492.db2.gz	CDCWGIGJZLABAV-IBGZPJMESA-N	0	3	338.451	3.154	20	30		EGEDHN
COc1ccc(CN2CCN(CC(C)(C)CCC#N)CC2)cc1F	ZINC000119926418	454236273	/nfs/dbraw/zinc/23/62/73/454236273.db2.gz	COYOBQJLTALQPR-UHFFFAOYSA-N	0	3	333.451	3.282	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN1CCC(Cc2cccc(F)c2)CC1	ZINC000071953202	454261694	/nfs/dbraw/zinc/26/16/94/454261694.db2.gz	SOMSULDZTKNPPQ-UHFFFAOYSA-N	0	3	330.447	3.281	20	30		EGEDHN
Cc1ccc(CN(C)C)cc1NC(=O)Cc1cccc(OCC#N)c1	ZINC000090013058	454263752	/nfs/dbraw/zinc/26/37/52/454263752.db2.gz	WJEGALMMVNQDKW-UHFFFAOYSA-N	0	3	337.423	3.140	20	30		EGEDHN
CN(Cc1ccccc1)[C@H]1CCN(c2ncc(C#N)cc2Cl)C1	ZINC000078506179	454266674	/nfs/dbraw/zinc/26/66/74/454266674.db2.gz	DPEGOTTVFSBSTQ-INIZCTEOSA-N	0	3	326.831	3.317	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H]1CCN(c2c(C#N)nnc3ccccc32)C1	ZINC000078507387	454266924	/nfs/dbraw/zinc/26/69/24/454266924.db2.gz	IBJAEGMOHGTSMZ-QGZVFWFLSA-N	0	3	343.434	3.212	20	30		EGEDHN
CC(=O)Nc1cc(C(=O)C(C#N)c2nc3ccccc3[nH]2)ccc1F	ZINC000072032113	454268229	/nfs/dbraw/zinc/26/82/29/454268229.db2.gz	KCWPZUCDNAILKK-LBPRGKRZSA-N	0	3	336.326	3.150	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1ccc2nccnc2c1)C(C)C	ZINC000120284833	454282249	/nfs/dbraw/zinc/28/22/49/454282249.db2.gz	KTMQRNWPOZTFLM-LJQANCHMSA-N	0	3	338.455	3.058	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)CCC1	ZINC000191045033	455431864	/nfs/dbraw/zinc/43/18/64/455431864.db2.gz	ZPKXPBKINMYMQW-CALCHBBNSA-N	0	3	334.504	3.081	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)c1ccc(Cl)o1	ZINC000060575895	454303499	/nfs/dbraw/zinc/30/34/99/454303499.db2.gz	PNTSPVCUYXYTQV-UHFFFAOYSA-N	0	3	331.803	3.009	20	30		EGEDHN
CC[C@H]1CCC[C@H]1NC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000132123096	454315126	/nfs/dbraw/zinc/31/51/26/454315126.db2.gz	QXFPFOVMGVFAAI-RBUKOAKNSA-N	0	3	342.487	3.210	20	30		EGEDHN
CCN1CCCC[C@H]1CNC(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000132848601	454371130	/nfs/dbraw/zinc/37/11/30/454371130.db2.gz	QOKANUOJMHMZIJ-ROUUACIJSA-N	0	3	328.460	3.205	20	30		EGEDHN
CCC[C@H](C)N(C)CC(=O)N(CCC#N)c1ccc(OCC)cc1	ZINC000048071180	454440681	/nfs/dbraw/zinc/44/06/81/454440681.db2.gz	ATALBZNNGGLUEL-INIZCTEOSA-N	0	3	331.460	3.452	20	30		EGEDHN
C=CCOc1cccc(CN2CCC(CC(=O)N3CCCC3)CC2)c1	ZINC000121522152	454447239	/nfs/dbraw/zinc/44/72/39/454447239.db2.gz	KAZYYQBGUHFSHN-UHFFFAOYSA-N	0	3	342.483	3.476	20	30		EGEDHN
CN(C)Cc1ccc(NC(=O)CSCc2ccc(C#N)cc2)cc1	ZINC000048191732	454454956	/nfs/dbraw/zinc/45/49/56/454454956.db2.gz	JSCGGSZIRAPILN-UHFFFAOYSA-N	0	3	339.464	3.492	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H](O)COCc1ccccc1Cl	ZINC000073649448	454463767	/nfs/dbraw/zinc/46/37/67/454463767.db2.gz	YIDVSXLEBYOQGH-GOSISDBHSA-N	0	3	344.842	3.221	20	30		EGEDHN
N#Cc1ccccc1N1CCCN(Cc2cccc3c[nH]nc32)CC1	ZINC000091792378	454472014	/nfs/dbraw/zinc/47/20/14/454472014.db2.gz	MHGVIVWQFSFXLN-UHFFFAOYSA-N	0	3	331.423	3.147	20	30		EGEDHN
Cc1[nH]c2ccc(C(=O)C(C#N)C(=O)Nc3ccccn3)cc2c1C	ZINC000102387422	454502763	/nfs/dbraw/zinc/50/27/63/454502763.db2.gz	RPEYGNDPKUUIFG-OAHLLOKOSA-N	0	3	332.363	3.141	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2cc(F)cc(Br)c2)nc(C)n1	ZINC000049406407	454546700	/nfs/dbraw/zinc/54/67/00/454546700.db2.gz	AIPLRIGOGDNXHS-CYBMUJFWSA-N	0	3	348.175	3.485	20	30		EGEDHN
N#Cc1ccccc1NC(=O)CCN1CC[C@@H](Nc2ccccc2)C1	ZINC000103480946	454560281	/nfs/dbraw/zinc/56/02/81/454560281.db2.gz	WTCNQSXYLFTSNU-GOSISDBHSA-N	0	3	334.423	3.073	20	30		EGEDHN
Cc1ccc(Cl)c(OC[C@H](O)CN(C)Cc2ccc(C#N)cc2)c1	ZINC000182194316	455458301	/nfs/dbraw/zinc/45/83/01/455458301.db2.gz	AEHSBCJSQDPWAQ-QGZVFWFLSA-N	0	3	344.842	3.392	20	30		EGEDHN
C[C@](C#N)(NC(=O)CN[C@H](c1ccc(F)cc1)C1CCC1)C1CC1	ZINC000104706141	454596237	/nfs/dbraw/zinc/59/62/37/454596237.db2.gz	TXSUTDOGZPUOGA-RBUKOAKNSA-N	0	3	329.419	3.065	20	30		EGEDHN
C=CCOc1ccc(CN2CCC(n3ccnc3)CC2)cc1OC	ZINC000092648706	454600090	/nfs/dbraw/zinc/60/00/90/454600090.db2.gz	IKRNAPOZULHLSL-UHFFFAOYSA-N	0	3	327.428	3.294	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)c1ncnc2ccc(F)cc21	ZINC000092681708	454610102	/nfs/dbraw/zinc/61/01/02/454610102.db2.gz	XIPRZOMRKRMWRD-UHFFFAOYSA-N	0	3	349.413	3.209	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN(Cc2cccc(F)c2)C2CC2)cc1	ZINC000051425505	454623544	/nfs/dbraw/zinc/62/35/44/454623544.db2.gz	WFNSCIMRJRDLSB-LJQANCHMSA-N	0	3	340.398	3.102	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000065868912	454634653	/nfs/dbraw/zinc/63/46/53/454634653.db2.gz	PCPQKRWWVQJADB-WBVHZDCISA-N	0	3	331.435	3.046	20	30		EGEDHN
Cc1ccc(C(=O)N(CCN(C)C)Cc2cccc(C#N)c2)cc1F	ZINC000065930984	454640824	/nfs/dbraw/zinc/64/08/24/454640824.db2.gz	XOCFLSKUSGGEQD-UHFFFAOYSA-N	0	3	339.414	3.210	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(NC(C)=O)ccc2Cl)CC1	ZINC000123681180	454664854	/nfs/dbraw/zinc/66/48/54/454664854.db2.gz	MVYFXXVKMJOOTG-UHFFFAOYSA-N	0	3	349.862	3.069	20	30		EGEDHN
CC(C)(C)C1CCC(O)(CNCc2cnc3ccc(C#N)cn23)CC1	ZINC000123712281	454667680	/nfs/dbraw/zinc/66/76/80/454667680.db2.gz	PODHRVYDJOOSFQ-UHFFFAOYSA-N	0	3	340.471	3.263	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cccn2Cc2ccccc2)CC1	ZINC000106037049	454674283	/nfs/dbraw/zinc/67/42/83/454674283.db2.gz	KZNXHTSIGXSHHC-UHFFFAOYSA-N	0	3	337.467	3.307	20	30		EGEDHN
CN(C)[C@H](CNc1ccc(C#N)cc1[N+](=O)[O-])c1ccc(F)cc1	ZINC000052486051	454676498	/nfs/dbraw/zinc/67/64/98/454676498.db2.gz	RYGSPTDHRMBENI-QGZVFWFLSA-N	0	3	328.347	3.320	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000066317724	454684295	/nfs/dbraw/zinc/68/42/95/454684295.db2.gz	HCBBLLRRXWZKHG-KRWDZBQOSA-N	0	3	330.472	3.057	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2CCc3cc(F)ccc32)CC1	ZINC000106266176	454688699	/nfs/dbraw/zinc/68/86/99/454688699.db2.gz	MODIFLZHBRQSAO-GOSISDBHSA-N	0	3	331.435	3.153	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H]1CCN(C(=O)C2(C#N)CCCCC2)C1	ZINC000081129261	454690698	/nfs/dbraw/zinc/69/06/98/454690698.db2.gz	KWAAYMQWWMUOMV-GOSISDBHSA-N	0	3	325.456	3.193	20	30		EGEDHN
CC[C@@]1(NCC(=O)N(CCC#N)c2ccc(Cl)c(C)c2)CCOC1	ZINC000616865316	460648695	/nfs/dbraw/zinc/64/86/95/460648695.db2.gz	KFTOEDVCKICTAV-GOSISDBHSA-N	0	3	349.862	3.054	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCc3ccccc3[C@@H]2C)CC1	ZINC000106562881	454701534	/nfs/dbraw/zinc/70/15/34/454701534.db2.gz	VFKNKFUGCWEFJT-INIZCTEOSA-N	0	3	327.472	3.356	20	30		EGEDHN
COc1ccc(CN2CCC[C@H]2C[C@@H](C)O)cc1OCCCC#N	ZINC000093483152	454719135	/nfs/dbraw/zinc/71/91/35/454719135.db2.gz	ZAZWNMZJHRISTA-WBVHZDCISA-N	0	3	332.444	3.113	20	30		EGEDHN
N#CC(C(=O)c1ccnc(OCC(F)F)c1)c1nc2ccccc2[nH]1	ZINC000136106620	454721206	/nfs/dbraw/zinc/72/12/06/454721206.db2.gz	MDCNTAHZVQLGJE-NSHDSACASA-N	0	3	342.305	3.092	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H](CC)Oc2ccccc2C)CC1	ZINC000176523508	454755532	/nfs/dbraw/zinc/75/55/32/454755532.db2.gz	XOMNAQAZVCQFBK-GOSISDBHSA-N	0	3	330.472	3.309	20	30		EGEDHN
N#CC1(C(=O)NC[C@H]2CCCN(Cc3cccs3)C2)CCCC1	ZINC000140122577	454817019	/nfs/dbraw/zinc/81/70/19/454817019.db2.gz	VVWQKZLHYJIIKK-OAHLLOKOSA-N	0	3	331.485	3.160	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)[C@@H](C)c2cccc(O)c2)CC1	ZINC000109174633	454823357	/nfs/dbraw/zinc/82/33/57/454823357.db2.gz	HHIFDINFGQUWGZ-HNNXBMFYSA-N	0	3	331.460	3.135	20	30		EGEDHN
C#CCCOc1ccc(CN(C)Cc2ccc(O)c(OC)c2)cc1	ZINC000125980555	454861226	/nfs/dbraw/zinc/86/12/26/454861226.db2.gz	IRTXAHQITJLSEP-UHFFFAOYSA-N	0	3	325.408	3.435	20	30		EGEDHN
CCCCCCCN1CCCN(Cc2nc([C@@H](C)OC)no2)CC1	ZINC000177472309	454867286	/nfs/dbraw/zinc/86/72/86/454867286.db2.gz	HEGXJQJUPDXQCB-MRXNPFEDSA-N	0	3	338.496	3.255	20	30		EGEDHN
CCN(CCC#N)C(=O)[C@@H](C)N1CCC(Cc2ccccc2)CC1	ZINC000111661789	454870976	/nfs/dbraw/zinc/87/09/76/454870976.db2.gz	XDKGNMLXBBQGGT-QGZVFWFLSA-N	0	3	327.472	3.092	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN[C@H](C)c1ccc2c(c1)CCCC2	ZINC000154342833	454887442	/nfs/dbraw/zinc/88/74/42/454887442.db2.gz	ABKQZIZOUCFQNQ-JKSUJKDBSA-N	0	3	327.472	3.224	20	30		EGEDHN
C[C@@H](CNC(=O)Nc1ccc(F)cc1C#N)N(C)Cc1ccccc1	ZINC000177929760	454920560	/nfs/dbraw/zinc/92/05/60/454920560.db2.gz	BHOPXSZUFBAXRP-AWEZNQCLSA-N	0	3	340.402	3.339	20	30		EGEDHN
C[C@H]1CCC[C@H](C(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)C1	ZINC000151146130	454943667	/nfs/dbraw/zinc/94/36/67/454943667.db2.gz	LGEBIHWJPQFUDY-LPHOPBHVSA-N	0	3	327.472	3.275	20	30		EGEDHN
C#CCOc1ccc(CN2CCC[C@@H](c3nnc4ccccn43)C2)cc1	ZINC000179779628	455077531	/nfs/dbraw/zinc/07/75/31/455077531.db2.gz	QQTHYQLCHDGOBI-GOSISDBHSA-N	0	3	346.434	3.121	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(-c3ccsc3)nc2C)CC1	ZINC000171716740	455088692	/nfs/dbraw/zinc/08/86/92/455088692.db2.gz	SUWNXUOCXCNDIT-UHFFFAOYSA-N	0	3	341.480	3.499	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCC(C)(C)c2cccc(C)c2)CC1	ZINC000171728073	455089686	/nfs/dbraw/zinc/08/96/86/455089686.db2.gz	VALUFLYQTSRJQK-UHFFFAOYSA-N	0	3	329.488	3.222	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(OC(F)F)cc2)CC1	ZINC000171737972	455090225	/nfs/dbraw/zinc/09/02/25/455090225.db2.gz	OXGQARNRUJFASS-UHFFFAOYSA-N	0	3	325.359	3.060	20	30		EGEDHN
C[C@H](C#N)CSc1ccccc1NC(=O)N1CCN2CCC[C@@H]2C1	ZINC000171894972	455100531	/nfs/dbraw/zinc/10/05/31/455100531.db2.gz	ZEVWGLBGKJECMR-HUUCEWRRSA-N	0	3	344.484	3.250	20	30		EGEDHN
C#CCOc1ccc([C@@H](C)NCc2ccc(C(=O)NCC)cc2)cc1	ZINC000156499358	455125037	/nfs/dbraw/zinc/12/50/37/455125037.db2.gz	GGDIMJJACNCMEK-MRXNPFEDSA-N	0	3	336.435	3.299	20	30		EGEDHN
C=CCSCCNC(=O)NC1CCN([C@H](C)c2ccccc2)CC1	ZINC000172124873	455125622	/nfs/dbraw/zinc/12/56/22/455125622.db2.gz	MMTISEZMDJWGQW-MRXNPFEDSA-N	0	3	347.528	3.430	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(C)c(-c3nc(C)co3)c2)CC1	ZINC000129904819	455132450	/nfs/dbraw/zinc/13/24/50/455132450.db2.gz	CXCQZEHSTNYPCO-UHFFFAOYSA-N	0	3	337.423	3.242	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)Nc2ccc(C#N)cc2)CN1Cc1ccccc1	ZINC000152580508	455138928	/nfs/dbraw/zinc/13/89/28/455138928.db2.gz	GBVSDPGEZMTFJE-DNVCBOLYSA-N	0	3	334.423	3.343	20	30		EGEDHN
C=CCSCCNC(=O)N(C)C1CCN(Cc2ccccc2)CC1	ZINC000172257059	455140896	/nfs/dbraw/zinc/14/08/96/455140896.db2.gz	QRBCUMWPKFMYIB-UHFFFAOYSA-N	0	3	347.528	3.212	20	30		EGEDHN
COc1ccc(CN(C)CCCOc2cccc(C#N)c2)cc1O	ZINC000156689419	455144653	/nfs/dbraw/zinc/14/46/53/455144653.db2.gz	WXFAPZHUUDZHBP-UHFFFAOYSA-N	0	3	326.396	3.173	20	30		EGEDHN
CN(C)c1cccc(NCc2cn(C)nc2-c2ccc(C#N)cc2)n1	ZINC000180526990	455189259	/nfs/dbraw/zinc/18/92/59/455189259.db2.gz	VPSDSMKLUMDXSO-UHFFFAOYSA-N	0	3	332.411	3.032	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cccc(-n3cccn3)c2)CC1	ZINC000264431645	455212038	/nfs/dbraw/zinc/21/20/38/455212038.db2.gz	XAVKDYCLHVXLTH-UHFFFAOYSA-N	0	3	339.443	3.034	20	30		EGEDHN
C=CCCN[C@@H](c1ccc(OC)cc1)c1cccc(S(C)(=O)=O)c1	ZINC000172945939	455212584	/nfs/dbraw/zinc/21/25/84/455212584.db2.gz	FWQAFMQMXGTZLR-IBGZPJMESA-N	0	3	345.464	3.354	20	30		EGEDHN
C#CCOc1ccc(CNCc2ccc(N3CCCCC3)nc2)cc1	ZINC000264968942	455298371	/nfs/dbraw/zinc/29/83/71/455298371.db2.gz	QHGGBOIHAILXGZ-UHFFFAOYSA-N	0	3	335.451	3.374	20	30		EGEDHN
C=CCOCCCC(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000173647803	455322891	/nfs/dbraw/zinc/32/28/91/455322891.db2.gz	BUQNHXPYGKJHOV-QUCCMNQESA-N	0	3	344.499	3.481	20	30		EGEDHN
CC#CCCCC(=O)NCC1(N[C@@H](C)c2ccccc2)CCOCC1	ZINC000183994188	455346644	/nfs/dbraw/zinc/34/66/44/455346644.db2.gz	OLNVCEDXJGHHMI-SFHVURJKSA-N	0	3	342.483	3.196	20	30		EGEDHN
C=C(Cl)CNC(=O)NC[C@H]1CCCN(Cc2cccs2)C1	ZINC000265594901	455347389	/nfs/dbraw/zinc/34/73/89/455347389.db2.gz	VCCNZPJKXXVEID-CYBMUJFWSA-N	0	3	327.881	3.012	20	30		EGEDHN
CCc1nn(C)c(CC)c1CN[C@@H](C)c1ccc(OCC#N)cc1	ZINC000182073417	455429720	/nfs/dbraw/zinc/42/97/20/455429720.db2.gz	QFQUTYZLGWWDBY-AWEZNQCLSA-N	0	3	326.444	3.298	20	30		EGEDHN
CCN(CC(=O)Nc1ccc(NC(C)=O)cc1)CC(C)(C)CCC#N	ZINC000160220194	455439776	/nfs/dbraw/zinc/43/97/76/455439776.db2.gz	MEPSGFLVDPCLAP-UHFFFAOYSA-N	0	3	344.459	3.235	20	30		EGEDHN
CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)Cc1ccc(C#N)cc1	ZINC000184843211	455458308	/nfs/dbraw/zinc/45/83/08/455458308.db2.gz	JHIICDIRRMMBML-OAQYLSRUSA-N	0	3	349.478	3.374	20	30		EGEDHN
N#CCCCOc1cccc(CN2CCS[C@@H]3COCC[C@H]32)c1	ZINC000246463157	455494033	/nfs/dbraw/zinc/49/40/33/455494033.db2.gz	OEFOBKUGOKIYIL-QZTJIDSGSA-N	0	3	332.469	3.075	20	30		EGEDHN
C=CCCCC(=O)Nc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1	ZINC000175834166	455503854	/nfs/dbraw/zinc/50/38/54/455503854.db2.gz	VLKILBZTGCFIMC-SFHVURJKSA-N	0	3	343.471	3.148	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccn(CCC(C)C)n2)CC1	ZINC000160871648	455507283	/nfs/dbraw/zinc/50/72/83/455507283.db2.gz	GXHHVVMHVLMRDB-UHFFFAOYSA-N	0	3	333.480	3.091	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1CC[C@@H](c2ccccc2)[C@@H](C)C1	ZINC000246726172	455519374	/nfs/dbraw/zinc/51/93/74/455519374.db2.gz	LXBUOKFIMMRFAP-ZIFCJYIRSA-N	0	3	327.472	3.120	20	30		EGEDHN
CN(C[C@@H]1CCCN(C)C1)C(=O)N[C@H](CCC#N)c1ccccc1	ZINC000246929052	455536528	/nfs/dbraw/zinc/53/65/28/455536528.db2.gz	SXXMZKLYMXDDAY-SJLPKXTDSA-N	0	3	328.460	3.015	20	30		EGEDHN
CN(C[C@H]1CCCN(C)C1)C(=O)N[C@H](CCC#N)c1ccccc1	ZINC000246929039	455536574	/nfs/dbraw/zinc/53/65/74/455536574.db2.gz	SXXMZKLYMXDDAY-FUHWJXTLSA-N	0	3	328.460	3.015	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)c1cccc(C#N)c1	ZINC000267348436	455543257	/nfs/dbraw/zinc/54/32/57/455543257.db2.gz	CMXQBIZZYFMVEI-UZLBHIALSA-N	0	3	333.435	3.199	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1SCc1nccs1	ZINC000161255681	455552879	/nfs/dbraw/zinc/55/28/79/455552879.db2.gz	VNWSLJVDIADWJX-UHFFFAOYSA-N	0	3	349.529	3.241	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc3cccc(Cl)c3n2)CC1	ZINC000182713185	455574132	/nfs/dbraw/zinc/57/41/32/455574132.db2.gz	NATOFXDQQBBQAZ-UHFFFAOYSA-N	0	3	327.815	3.172	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N1CC[C@H](N2CCCC2)C1)c1ccc(F)c(F)c1	ZINC000185827933	455629842	/nfs/dbraw/zinc/62/98/42/455629842.db2.gz	SJUWDUGLGPBJQO-YJBOKZPZSA-N	0	3	349.425	3.462	20	30		EGEDHN
N#CCOc1ccc(CN2CCC[C@H]2C[C@H](O)c2ccco2)cc1	ZINC000268310513	455647214	/nfs/dbraw/zinc/64/72/14/455647214.db2.gz	XLTZMCQWYKLCMU-WMZOPIPTSA-N	0	3	326.396	3.270	20	30		EGEDHN
CSCC[C@@H](C)N(C)[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000192678104	455667085	/nfs/dbraw/zinc/66/70/85/455667085.db2.gz	BJJGGWUDWUGOJF-RHSMWYFYSA-N	0	3	331.485	3.127	20	30		EGEDHN
CCC[C@@H](C)NC(=O)[C@@H]1CCCN(Cc2ccc(C#N)cc2C)C1	ZINC000186191809	455714173	/nfs/dbraw/zinc/71/41/73/455714173.db2.gz	KEFSWRUJAIYXAI-VQIMIIECSA-N	0	3	327.472	3.384	20	30		EGEDHN
CC[C@H](N[C@H](C)C(=O)N(CCC#N)c1ccc(F)cc1)[C@@H]1CCCO1	ZINC000248605413	455722272	/nfs/dbraw/zinc/72/22/72/455722272.db2.gz	OYRHHNGWHKURHQ-JLSDUUJJSA-N	0	3	347.434	3.008	20	30		EGEDHN
C=CCSCCN[C@@H](c1ccc(Cl)cc1)[C@H]1CN(C)CCO1	ZINC000248699266	455726872	/nfs/dbraw/zinc/72/68/72/455726872.db2.gz	FQQLHFMIMJNJKX-SJORKVTESA-N	0	3	340.920	3.221	20	30		EGEDHN
C[C@@H](N[C@@H](C)c1ccc(NC(N)=O)cc1)c1ccc(OCC#N)cc1	ZINC000193024434	455736105	/nfs/dbraw/zinc/73/61/05/455736105.db2.gz	NKYMJUYSPAKRND-UONOGXRCSA-N	0	3	338.411	3.491	20	30		EGEDHN
N#C[C@@H]1CCC[C@@H](N[C@@H]2CCCN(Cc3ccc(F)cc3F)C2=O)C1	ZINC000248881137	455736560	/nfs/dbraw/zinc/73/65/60/455736560.db2.gz	KPYVOGGMXRAVQD-MZMPZRCHSA-N	0	3	347.409	3.128	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCc1ccc(OC2CCN(C)CC2)cc1	ZINC000284812229	455746807	/nfs/dbraw/zinc/74/68/07/455746807.db2.gz	XBUHPCDDPRRUSQ-FQEVSTJZSA-N	0	3	330.472	3.378	20	30		EGEDHN
C=C(CNCc1c(C)nn(CC(=O)OC(C)C)c1C)c1ccccc1	ZINC000271811904	455770083	/nfs/dbraw/zinc/77/00/83/455770083.db2.gz	CBFVSTWLPPJCKC-UHFFFAOYSA-N	0	3	341.455	3.255	20	30		EGEDHN
CC(C)c1[nH]ccc1C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000285017436	455778737	/nfs/dbraw/zinc/77/87/37/455778737.db2.gz	GTKXQDPBMSSAEH-UHFFFAOYSA-N	0	3	338.455	3.214	20	30		EGEDHN
CC[C@@](C)(C#N)C(=O)N[C@@H]1CC2(CCN(C)CC2)Oc2ccccc21	ZINC000285109901	455790826	/nfs/dbraw/zinc/79/08/26/455790826.db2.gz	JTAZCQWYWYNXGA-APWZRJJASA-N	0	3	341.455	3.031	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1ccc(C2SCCCS2)cc1	ZINC000294026208	455803417	/nfs/dbraw/zinc/80/34/17/455803417.db2.gz	RCORZRJYXLEHQQ-UHFFFAOYSA-N	0	3	348.537	3.240	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)[C@@H]1CCCCC1(F)F	ZINC000294530614	455818900	/nfs/dbraw/zinc/81/89/00/455818900.db2.gz	QZYOAQNOEPMMEN-KRWDZBQOSA-N	0	3	349.425	3.274	20	30		EGEDHN
C[C@H](CNC(=O)[C@]1(C#N)CC12CCCC2)N(C)Cc1ccccc1	ZINC000294774346	455827729	/nfs/dbraw/zinc/82/77/29/455827729.db2.gz	ZHTZTVULZZVJKF-OXQOHEQNSA-N	0	3	325.456	3.097	20	30		EGEDHN
CCCc1ccc(CN[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)cc1	ZINC000616996466	460695261	/nfs/dbraw/zinc/69/52/61/460695261.db2.gz	KTMWFJFROQKFFC-OAQYLSRUSA-N	0	3	347.462	3.401	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/[C@@H](c2nncn2C)C(C)C)c([O-])c1	ZINC000285465408	455851719	/nfs/dbraw/zinc/85/17/19/455851719.db2.gz	QZTPBIQVGXYLIX-HDZGYNCQSA-N	0	3	329.448	3.183	20	30		EGEDHN
C[C@H](O)C[C@H]1CCCN1CC#Cc1ccc(OC(F)(F)F)cc1	ZINC000269790511	455853676	/nfs/dbraw/zinc/85/36/76/455853676.db2.gz	JHOYSISGXQHOOJ-DZGCQCFKSA-N	0	3	327.346	3.172	20	30		EGEDHN
N#CCOc1ccc(CN(Cc2ccccc2)[C@@H](CO)C2CC2)cc1	ZINC000269940814	455854991	/nfs/dbraw/zinc/85/49/91/455854991.db2.gz	CPYMKRNRYGQEOT-NRFANRHFSA-N	0	3	336.435	3.362	20	30		EGEDHN
Cc1cccc(OC[C@H](O)CN(Cc2ccc(C#N)cc2)C2CC2)c1	ZINC000194539946	455856082	/nfs/dbraw/zinc/85/60/82/455856082.db2.gz	NFBFQHYKWRVTMS-HXUWFJFHSA-N	0	3	336.435	3.271	20	30		EGEDHN
C[C@H](N[C@@H](c1ccccc1)C1CC1)C(=O)NC1(C#N)CCCCC1	ZINC000194553022	455857853	/nfs/dbraw/zinc/85/78/53/455857853.db2.gz	MDLVGIGKOSHFIT-YJBOKZPZSA-N	0	3	325.456	3.458	20	30		EGEDHN
CC(C)(CNC(=O)C(C#N)Cc1ccc(C#N)cc1)c1ccc(F)cc1	ZINC000279288187	455862083	/nfs/dbraw/zinc/86/20/83/455862083.db2.gz	KVITYOTYGSVYFD-KRWDZBQOSA-N	0	3	349.409	3.474	20	30		EGEDHN
COc1ccc(CN(C)C(=O)C(C#N)Cc2ccc(C#N)cc2)cc1C	ZINC000279332345	455862418	/nfs/dbraw/zinc/86/24/18/455862418.db2.gz	OYKSYSQUYFIBPZ-LJQANCHMSA-N	0	3	347.418	3.216	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)C(C)(C)C1CCOCC1)C(C)C	ZINC000280003640	455880486	/nfs/dbraw/zinc/88/04/86/455880486.db2.gz	IBVCNRUGIKDCEH-GOSISDBHSA-N	0	3	336.520	3.254	20	30		EGEDHN
N#Cc1ccc(Br)c(CN[C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)c1	ZINC000296221314	455883735	/nfs/dbraw/zinc/88/37/35/455883735.db2.gz	WXDPQQKKJFRZBK-IMJJTQAJSA-N	0	3	347.256	3.368	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccc(CC#N)cc1	ZINC000270295640	455922108	/nfs/dbraw/zinc/92/21/08/455922108.db2.gz	BWVWVDXPZSVFCT-SFHVURJKSA-N	0	3	347.462	3.489	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cc(Br)c(C)cc2C)CC1	ZINC000187592174	455929276	/nfs/dbraw/zinc/92/92/76/455929276.db2.gz	WMKKEKGBHIZMBH-UHFFFAOYSA-N	0	3	349.272	3.350	20	30		EGEDHN
C#CCOc1ccc([C@@H](C)N2CCC[C@@H](CC(C)(C)C(N)=O)C2)cc1	ZINC000296473782	455948596	/nfs/dbraw/zinc/94/85/96/455948596.db2.gz	NWTQJFIZVUDHPL-SJORKVTESA-N	0	3	342.483	3.373	20	30		EGEDHN
N#Cc1ccccc1N1CCCN(CC[C@@H](O)c2ccccc2)CC1	ZINC000286088451	455974835	/nfs/dbraw/zinc/97/48/35/455974835.db2.gz	UBMMOJGELUAZME-OAQYLSRUSA-N	0	3	335.451	3.194	20	30		EGEDHN
CN(C)CCOc1cc(CNc2ccc(C#N)c(Cl)c2)ccn1	ZINC000270727435	456025194	/nfs/dbraw/zinc/02/51/94/456025194.db2.gz	QDUYHNAMCZBOSK-UHFFFAOYSA-N	0	3	330.819	3.159	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)C(C)(C)c1c(C)noc1C)C(C)C	ZINC000280688613	456031717	/nfs/dbraw/zinc/03/17/17/456031717.db2.gz	ZHXMINTUEWUMDN-KRWDZBQOSA-N	0	3	347.503	3.384	20	30		EGEDHN
C=CCC[C@H](O)CN[C@@H](CO)c1ccc(Cl)cc1C(F)(F)F	ZINC000280732908	456040367	/nfs/dbraw/zinc/04/03/67/456040367.db2.gz	LKDIKKULYFNPAS-FZMZJTMJSA-N	0	3	337.769	3.309	20	30		EGEDHN
C=CCNC(=O)[C@@H](C)N[C@@H](c1cccc(OC(F)(F)F)c1)C1CC1	ZINC000286746787	456053160	/nfs/dbraw/zinc/05/31/60/456053160.db2.gz	YNLCNEMJDNHSER-IAQYHMDHSA-N	0	3	342.361	3.317	20	30		EGEDHN
CCCN(C)[C@H](CNC(=O)NCCCC#N)c1ccc(Cl)cc1	ZINC000286940421	456057949	/nfs/dbraw/zinc/05/79/49/456057949.db2.gz	VWRDBEWCMFMQIC-MRXNPFEDSA-N	0	3	336.867	3.326	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N2CCCC[C@@H](C)C2)cc1	ZINC000287086482	456061330	/nfs/dbraw/zinc/06/13/30/456061330.db2.gz	IRVHGLVCTAVIRI-KGLIPLIRSA-N	0	3	349.456	3.026	20	30		EGEDHN
C=CCC[C@H](NCC1(N2CCOCC2)CC(OCC)C1)c1ccco1	ZINC000287761662	456078151	/nfs/dbraw/zinc/07/81/51/456078151.db2.gz	ZTVADZPMPWDLEC-FDYSRKEFSA-N	0	3	348.487	3.146	20	30		EGEDHN
C=CCS(=O)(=O)CCN[C@H](CC)c1ccc2cc(OC)ccc2c1	ZINC000272888045	456102381	/nfs/dbraw/zinc/10/23/81/456102381.db2.gz	SCODJDNRWZFRQC-LJQANCHMSA-N	0	3	347.480	3.490	20	30		EGEDHN
CN(C)CCN(Cc1nc2ccccc2n1C)Cc1ccc(C#N)cc1	ZINC000289143824	456115509	/nfs/dbraw/zinc/11/55/09/456115509.db2.gz	ANIHTHOMKLFUEG-UHFFFAOYSA-N	0	3	347.466	3.009	20	30		EGEDHN
CC(C)[C@@](C)(NCCC(C#N)(c1ccccc1)c1ccccc1)C(N)=O	ZINC000289473617	456127253	/nfs/dbraw/zinc/12/72/53/456127253.db2.gz	ZFFYIPIXMBXKRA-OAQYLSRUSA-N	0	3	349.478	3.376	20	30		EGEDHN
CCc1nnc(N2CCN(CCC(C)(C)C)CC2)c(C#N)c1CC	ZINC000301639846	456171200	/nfs/dbraw/zinc/17/12/00/456171200.db2.gz	YHOBPTTYADNENL-UHFFFAOYSA-N	0	3	329.492	3.031	20	30		EGEDHN
CN1CCN(CCNc2cc(C#N)ccc2C(F)(F)F)CC1(C)C	ZINC000281537022	456260116	/nfs/dbraw/zinc/26/01/16/456260116.db2.gz	AVPOTRVCOLBCIX-UHFFFAOYSA-N	0	3	340.393	3.015	20	30		EGEDHN
COc1cc(CN[C@H](C)C[C@H](O)c2ccc(F)cc2)ccc1C#N	ZINC000281698592	456295984	/nfs/dbraw/zinc/29/59/84/456295984.db2.gz	NOCXVBWGBHYNHE-ACJLOTCBSA-N	0	3	328.387	3.308	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)c2cccc(Nc3cnn(C)c3)c2)n1	ZINC000342902792	456303703	/nfs/dbraw/zinc/30/37/03/456303703.db2.gz	IDZRZPKHVQWWQC-HNNXBMFYSA-N	0	3	337.408	3.419	20	30		EGEDHN
CSc1ccccc1[C@H](C)NC[C@H](O)COc1ccc(C#N)cc1	ZINC000281761444	456312599	/nfs/dbraw/zinc/31/25/99/456312599.db2.gz	RRIOGZMDDWTKQT-HOCLYGCPSA-N	0	3	342.464	3.371	20	30		EGEDHN
CC(C)Oc1ccc([C@H](CNC(=O)C2(C#N)CCCC2)N(C)C)cc1	ZINC000290389096	456313535	/nfs/dbraw/zinc/31/35/35/456313535.db2.gz	HYYROXVGQCOOID-SFHVURJKSA-N	0	3	343.471	3.277	20	30		EGEDHN
C[C@@H](CNc1cc(C#N)ccc1[N+](=O)[O-])N1CCc2ccccc2C1	ZINC000302208002	456317994	/nfs/dbraw/zinc/31/79/94/456317994.db2.gz	LFUBRWKIEAELMS-AWEZNQCLSA-N	0	3	336.395	3.325	20	30		EGEDHN
CN(C)[C@@H](CNc1cc(C#N)ccc1[N+](=O)[O-])c1ccc(F)cc1	ZINC000302233847	456324844	/nfs/dbraw/zinc/32/48/44/456324844.db2.gz	ZQSQZZCBCFZBDA-KRWDZBQOSA-N	0	3	328.347	3.320	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2c(F)ccc(OCC)c2F)CC1	ZINC000340438126	456462068	/nfs/dbraw/zinc/46/20/68/456462068.db2.gz	DINBDCVLCQBDIJ-UHFFFAOYSA-N	0	3	339.386	3.135	20	30		EGEDHN
CCC(CC)(CCO)NCc1ccc(C#N)cc1Br	ZINC000282326258	456478205	/nfs/dbraw/zinc/47/82/05/456478205.db2.gz	AKNCZTBXLAWIPS-UHFFFAOYSA-N	0	3	325.250	3.352	20	30		EGEDHN
CN(CCCOc1ccccc1)C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000348112817	456491743	/nfs/dbraw/zinc/49/17/43/456491743.db2.gz	GDJNFKLONOWZDA-IBGZPJMESA-N	0	3	347.418	3.168	20	30		EGEDHN
Cc1nccn1CCCN(C)Cc1ccc(C#N)cc1OC(F)F	ZINC000348269373	456585562	/nfs/dbraw/zinc/58/55/62/456585562.db2.gz	UXLIWDHBWCJCKV-UHFFFAOYSA-N	0	3	334.370	3.187	20	30		EGEDHN
CN(Cc1cccc(Cl)c1)C[C@H](O)COc1ccccc1C#N	ZINC000320369070	456628160	/nfs/dbraw/zinc/62/81/60/456628160.db2.gz	IORNGHVJSUXYKX-KRWDZBQOSA-N	0	3	330.815	3.083	20	30		EGEDHN
C[C@H](NC[C@@H](O)COc1ccccc1C#N)c1ccc(Cl)cc1	ZINC000321443491	456637349	/nfs/dbraw/zinc/63/73/49/456637349.db2.gz	GLDJAHYIVCCNGH-SUMWQHHRSA-N	0	3	330.815	3.302	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCc2ccc3ccccc3n2)CC1	ZINC000291417452	456638110	/nfs/dbraw/zinc/63/81/10/456638110.db2.gz	CVPQUMURPALDBH-UHFFFAOYSA-N	0	3	337.467	3.324	20	30		EGEDHN
CC[C@@H](C)N[C@@H](CNC(=O)Nc1ccc(C#N)cc1)c1ccco1	ZINC000353328394	456641628	/nfs/dbraw/zinc/64/16/28/456641628.db2.gz	HYAZPRDLHOLYOD-CJNGLKHVSA-N	0	3	326.400	3.402	20	30		EGEDHN
C=CCCN(C)Cc1cn(C)nc1-c1ccc2c(c1)OCCCO2	ZINC000343469544	456643437	/nfs/dbraw/zinc/64/34/37/456643437.db2.gz	NPOHEWNYSLSVJX-UHFFFAOYSA-N	0	3	327.428	3.256	20	30		EGEDHN
CN(CCC#N)c1ccc(CN2CC(C)(C)[C@H]2[C@@H]2CCCO2)cc1	ZINC000291460759	456650250	/nfs/dbraw/zinc/65/02/50/456650250.db2.gz	DCZZIFUDUCFBHX-RBUKOAKNSA-N	0	3	327.472	3.426	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N[C@@H]1CCCC[C@@H]1OC	ZINC000277008812	456651658	/nfs/dbraw/zinc/65/16/58/456651658.db2.gz	PHKPRCZQAKPHBC-UAGQMJEPSA-N	0	3	336.501	3.198	20	30		EGEDHN
CS[C@H]1CN(c2ccc(C(F)(F)F)cc2C#N)C[C@H]1N(C)C	ZINC000340737095	456658720	/nfs/dbraw/zinc/65/87/20/456658720.db2.gz	CXBXKVVTEZUIRL-KGLIPLIRSA-N	0	3	329.391	3.059	20	30		EGEDHN
COc1ccccc1[C@H](CN[C@@H]1CCc2ccc(C#N)cc21)N(C)C	ZINC000353381319	456662210	/nfs/dbraw/zinc/66/22/10/456662210.db2.gz	FDDXOGBWFWUKLF-UXHICEINSA-N	0	3	335.451	3.447	20	30		EGEDHN
C[C@@H](NC1CCN(c2ccc(C#N)cc2)CC1)C(=O)Nc1ccccc1	ZINC000299353871	456665346	/nfs/dbraw/zinc/66/53/46/456665346.db2.gz	KUDIXRFBYAPEBY-MRXNPFEDSA-N	0	3	348.450	3.144	20	30		EGEDHN
C[C@@H](C(=O)N(CCN(C)C)Cc1cccc(C#N)c1)c1ccsc1	ZINC000348424880	456683030	/nfs/dbraw/zinc/68/30/30/456683030.db2.gz	RFRPRQZJJLQRMS-OAHLLOKOSA-N	0	3	341.480	3.314	20	30		EGEDHN
CCCN(CC(=O)N[C@](C)(C#N)C1CC1)[C@@H]1CCc2ccccc21	ZINC000299450268	456696441	/nfs/dbraw/zinc/69/64/41/456696441.db2.gz	ZHCGFEWZPPTGNX-UYAOXDASSA-N	0	3	325.456	3.194	20	30		EGEDHN
COC(=O)COc1ccccc1[C@H](C)NCCc1cccc(C#N)c1	ZINC000343543289	456696627	/nfs/dbraw/zinc/69/66/27/456696627.db2.gz	YCGBYHLTPCTJEO-HNNXBMFYSA-N	0	3	338.407	3.003	20	30		EGEDHN
O=C(NCCn1ccnc1)N1CCCC[C@H]1c1ccc(F)cc1F	ZINC000328588533	456714565	/nfs/dbraw/zinc/71/45/65/456714565.db2.gz	SBNLSTYDAVMKTJ-INIZCTEOSA-N	0	3	334.370	3.303	20	30		EGEDHN
Cc1cccc(C)c1NC(=O)[C@H](C)N1CCC[C@@H]1[C@H]1COCC[C@@H]1O	ZINC000328765570	456756091	/nfs/dbraw/zinc/75/60/91/456756091.db2.gz	FBJJBXVQUKRWAM-MLHJIOFPSA-N	0	3	346.471	3.142	20	30		EGEDHN
CCCCN1Cc2ccc(/N=C/c3c(CO)cnc(C)c3O)cc2C1	ZINC000299660986	456758196	/nfs/dbraw/zinc/75/81/96/456758196.db2.gz	QHXXIWGIZHFBRH-LSHDLFTRSA-N	0	3	339.439	3.454	20	30		EGEDHN
CCCC[N@@H+]1Cc2ccc(/N=C/c3c([O-])c(C)ncc3CO)cc2C1	ZINC000299660986	456758205	/nfs/dbraw/zinc/75/82/05/456758205.db2.gz	QHXXIWGIZHFBRH-LSHDLFTRSA-N	0	3	339.439	3.454	20	30		EGEDHN
CCCC[N@H+]1Cc2ccc(/N=C/c3c([O-])c(C)ncc3CO)cc2C1	ZINC000299660986	456758213	/nfs/dbraw/zinc/75/82/13/456758213.db2.gz	QHXXIWGIZHFBRH-LSHDLFTRSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=CCN(CCSC(C)C)[C@@H](C)c1cccc(-n2cnnn2)c1	ZINC000338309480	456765210	/nfs/dbraw/zinc/76/52/10/456765210.db2.gz	VJFGQPKFRQBOEL-HNNXBMFYSA-N	0	3	331.489	3.353	20	30		EGEDHN
C[C@H]([NH+]=C([O-])N1CCC(c2cnc[nH]2)CC1)[C@H]1COc2ccccc21	ZINC000328844673	456773378	/nfs/dbraw/zinc/77/33/78/456773378.db2.gz	PYZARFCVOWPJCW-XJKSGUPXSA-N	0	3	340.427	3.068	20	30		EGEDHN
C[C@H](NC(=O)[C@@H]1CCCN1C1CCCC1)[C@@H](O)Cc1ccccc1	ZINC000328926773	456792908	/nfs/dbraw/zinc/79/29/08/456792908.db2.gz	FJQQRRBRNCINBV-SNRMKQJTSA-N	0	3	330.472	3.342	20	30		EGEDHN
Cc1nn(C)c(C)c1[C@H](C)C(=O)N[C@@H]1CN(C)C[C@H]1c1ccccc1	ZINC000328998463	456809876	/nfs/dbraw/zinc/80/98/76/456809876.db2.gz	GCJSQVQBTNMBBY-DOPJRALCSA-N	0	3	340.471	3.195	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cnn(CCCC)c2CC)CC1	ZINC000277429379	456821875	/nfs/dbraw/zinc/82/18/75/456821875.db2.gz	CFVZVQGOUJWVLE-UHFFFAOYSA-N	0	3	332.492	3.016	20	30		EGEDHN
C=CC[C@H](CO)CNCc1c(C)nn(Cc2ccc(Cl)cc2)c1C	ZINC000341283182	456831295	/nfs/dbraw/zinc/83/12/95/456831295.db2.gz	WSMABXBETLEMGG-KRWDZBQOSA-N	0	3	347.890	3.476	20	30		EGEDHN
C[C@H]1CN(c2cccc(F)c2)CCN1CCCC1(C#N)CCOCC1	ZINC000292041428	456837880	/nfs/dbraw/zinc/83/78/80/456837880.db2.gz	AEMFBPFWAYLNJP-KRWDZBQOSA-N	0	3	345.462	3.437	20	30		EGEDHN
C[C@H](N[C@H]1CCCN(C(=O)N2CCCC2)C1)c1ccc(C#N)c(F)c1	ZINC000329178310	456849542	/nfs/dbraw/zinc/84/95/42/456849542.db2.gz	NCDHAGMTAWXSGT-YOEHRIQHSA-N	0	3	344.434	3.028	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2CCN(C3CCC3)C[C@H](C)C2)cc1	ZINC000344728845	456852298	/nfs/dbraw/zinc/85/22/98/456852298.db2.gz	XESNFLYRRHNERF-INIZCTEOSA-N	0	3	328.456	3.198	20	30		EGEDHN
CN(C)Cc1ccc(CNC(=O)c2ccc(C(C)(C)C#N)cc2)cc1	ZINC000353687896	456855404	/nfs/dbraw/zinc/85/54/04/456855404.db2.gz	VBZOLRCWXWYKGH-UHFFFAOYSA-N	0	3	335.451	3.479	20	30		EGEDHN
CC(C#N)C(=O)NCc1ccc(-n2cnc3ccccc32)cc1Cl	ZINC000344777548	456858443	/nfs/dbraw/zinc/85/84/43/456858443.db2.gz	SPNQIQNQUHDMMD-LBPRGKRZSA-N	0	3	338.798	3.455	20	30		EGEDHN
C[C@H](NCc1ccc(OCC#N)cc1)c1ccc(C(=O)N(C)C)cc1	ZINC000292152888	456869087	/nfs/dbraw/zinc/86/90/87/456869087.db2.gz	NCLDCFJZASFNHL-HNNXBMFYSA-N	0	3	337.423	3.142	20	30		EGEDHN
CCN1CCO[C@H](CN[C@@H]2CCC[C@@H](C#N)C2)[C@@H]1c1ccccc1	ZINC000344900741	456869762	/nfs/dbraw/zinc/86/97/62/456869762.db2.gz	YVKPIZMJKYKVQM-AFYVEPGGSA-N	0	3	327.472	3.120	20	30		EGEDHN
N#Cc1ccc(Nc2cccc(C(=O)NCCN3CCCC3)c2)cc1	ZINC000348818800	456870332	/nfs/dbraw/zinc/87/03/32/456870332.db2.gz	HUSRKWWURSRDJJ-UHFFFAOYSA-N	0	3	334.423	3.127	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)NC[C@H](C)N2CCC[C@H](C)C2)cc1	ZINC000344909208	456870907	/nfs/dbraw/zinc/87/09/07/456870907.db2.gz	ZTZYOHYKTBVXLU-IRXDYDNUSA-N	0	3	345.487	3.171	20	30		EGEDHN
COCCn1cc2c(n1)[C@H](NC(=O)[C@H](C)N1CCCCCC1)CCC2	ZINC000329379486	456881982	/nfs/dbraw/zinc/88/19/82/456881982.db2.gz	NBNVCTOGFWBYIL-DOTOQJQBSA-N	0	3	348.491	3.128	20	30		EGEDHN
C[C@@H]1Oc2ccccc2OC1C(=O)Nc1cc(C#N)c2ccccc2n1	ZINC000345015072	456898162	/nfs/dbraw/zinc/89/81/62/456898162.db2.gz	HAZLREJMLRHSNT-BUXKBTBVSA-N	0	3	345.358	3.273	20	30		EGEDHN
CCCN1CCC[C@@H]1C(=O)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000349117972	456898267	/nfs/dbraw/zinc/89/82/67/456898267.db2.gz	LNXXPCOAZHVEOX-MRXNPFEDSA-N	0	3	338.373	3.048	20	30		EGEDHN
COc1cc(CN[C@H]2CCCc3cc(C#N)ccc32)cc(OC)c1O	ZINC000341693723	456902597	/nfs/dbraw/zinc/90/25/97/456902597.db2.gz	LULKQUMDKZINKE-KRWDZBQOSA-N	0	3	338.407	3.448	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CCOC[C@H](C2CCC2)C1	ZINC000329512401	456902704	/nfs/dbraw/zinc/90/27/04/456902704.db2.gz	XUTVPJMHGNCDGE-RBUKOAKNSA-N	0	3	326.440	3.034	20	30		EGEDHN
Cc1cc(NC(=O)N[C@@H]2CN(C(C)C)C[C@@H]2C)nn1C1CCCCC1	ZINC000329523106	456904318	/nfs/dbraw/zinc/90/43/18/456904318.db2.gz	PSODQZZLDPLKKR-WMLDXEAASA-N	0	3	347.507	3.173	20	30		EGEDHN
O=C(N[C@@H]1CCc2nc[nH]c2C1)N1CCCCC[C@H]1c1ccncc1	ZINC000329757007	456936955	/nfs/dbraw/zinc/93/69/55/456936955.db2.gz	ZAZPDDKVCPYRSL-QAPCUYQASA-N	0	3	339.443	3.193	20	30		EGEDHN
O=C(N[C@@H]1CCc2[nH]cnc2C1)N1CCCCC[C@H]1c1ccncc1	ZINC000329757007	456936959	/nfs/dbraw/zinc/93/69/59/456936959.db2.gz	ZAZPDDKVCPYRSL-QAPCUYQASA-N	0	3	339.443	3.193	20	30		EGEDHN
C[C@@H]1C[C@H](N(C)C(=O)Nc2csc(-c3ccccn3)n2)CCN1C	ZINC000329831365	456947676	/nfs/dbraw/zinc/94/76/76/456947676.db2.gz	KCBQIIIRAGLVJC-CHWSQXEVSA-N	0	3	345.472	3.165	20	30		EGEDHN
CCN(C(=O)C(C)C#N)[C@H](c1cccnc1)c1ccc(F)c(F)c1	ZINC000345642667	456985607	/nfs/dbraw/zinc/98/56/07/456985607.db2.gz	MXZVHZBCCOBLHY-PXAZEXFGSA-N	0	3	329.350	3.457	20	30		EGEDHN
Cc1cccc(O[C@@H]2CCCC[C@H]2NCC(=O)NC2CCOCC2)c1	ZINC000330103975	456985884	/nfs/dbraw/zinc/98/58/84/456985884.db2.gz	HGFMQNZREVWGCY-RTBURBONSA-N	0	3	346.471	3.410	20	30		EGEDHN
[O-]C(N[C@H]1CCn2ccnc2C1)=[NH+]CCC12CC3CC(CC(C3)C1)C2	ZINC000330187328	456998189	/nfs/dbraw/zinc/99/81/89/456998189.db2.gz	SXSATCXLPHGYSW-FAKMSMKASA-N	0	3	342.487	3.308	20	30		EGEDHN
CC[C@H](NCc1cccc(OCCCC#N)c1)[C@@H](O)C(F)(F)F	ZINC000345816300	457000231	/nfs/dbraw/zinc/00/02/31/457000231.db2.gz	LBDQLHKNJCCJGX-LSDHHAIUSA-N	0	3	330.350	3.161	20	30		EGEDHN
O=C(CC1CCCC1)NC1CCN(C(=O)[C@@H]2CCCN2C2CC2)CC1	ZINC000330214026	457005249	/nfs/dbraw/zinc/00/52/49/457005249.db2.gz	FWBMVYCQDVHHSV-SFHVURJKSA-N	0	3	347.503	3.141	20	30		EGEDHN
Cc1ccc(NC(=O)NC(=O)CN2CC[C@@H](O)C23CCCC3)cc1C	ZINC000330339364	457031686	/nfs/dbraw/zinc/03/16/86/457031686.db2.gz	WORPZGQKARUIDA-MRXNPFEDSA-N	0	3	345.443	3.171	20	30		EGEDHN
COc1cc(CN[C@H]2CC[C@@H](C#N)C2)cc(Br)c1OC	ZINC000349803974	457058805	/nfs/dbraw/zinc/05/88/05/457058805.db2.gz	RYSCWGDRBXRMJM-PWSUYJOCSA-N	0	3	339.233	3.248	20	30		EGEDHN
CCC1(CC)[C@H](N[C@H](C)C(=O)Nc2cccc(C#N)c2)C[C@@H]1OC	ZINC000359421347	457083070	/nfs/dbraw/zinc/08/30/70/457083070.db2.gz	KKBTTYSUWJXFHY-XYPHTWIQSA-N	0	3	329.444	3.069	20	30		EGEDHN
Cc1cc(C)c(NC(=O)NC2CCN(CCOC(C)C)CC2)c(C)n1	ZINC000331307644	457164417	/nfs/dbraw/zinc/16/44/17/457164417.db2.gz	GKZWDQFHTSBNDF-UHFFFAOYSA-N	0	3	348.491	3.222	20	30		EGEDHN
CC[C@H](C)N[C@@H](CNC(=O)NCC#Cc1ccccc1)c1ccco1	ZINC000350125735	457165525	/nfs/dbraw/zinc/16/55/25/457165525.db2.gz	NDNLQNSWEFPFHA-WMZOPIPTSA-N	0	3	339.439	3.060	20	30		EGEDHN
CCc1nc([C@H](C)NC(=O)NC[C@@H]2N(C)CCCC2(C)C)cs1	ZINC000331338545	457170028	/nfs/dbraw/zinc/17/00/28/457170028.db2.gz	VYKYETONLYMWAM-JSGCOSHPSA-N	0	3	338.521	3.391	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN2C[C@@H](C)CC2(C)C)cc1	ZINC000350255197	457172337	/nfs/dbraw/zinc/17/23/37/457172337.db2.gz	QJIWIRRKMCUSET-INIZCTEOSA-N	0	3	343.471	3.452	20	30		EGEDHN
C=CCCC1(c2nc(-c3ccnc(OCCN(C)C)c3)no2)CC1	ZINC000346865431	457186189	/nfs/dbraw/zinc/18/61/89/457186189.db2.gz	GWBHVYFCPBQATC-UHFFFAOYSA-N	0	3	328.416	3.070	20	30		EGEDHN
CCc1cnccc1[C@H](C)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000350824393	457208644	/nfs/dbraw/zinc/20/86/44/457208644.db2.gz	DWQPSIKLMFFYTE-KBXCAEBGSA-N	0	3	332.407	3.075	20	30		EGEDHN
COc1ccc(C[C@H](NC(=O)C(C)C#N)c2ccc(OC)cc2)cc1	ZINC000347070533	457214961	/nfs/dbraw/zinc/21/49/61/457214961.db2.gz	OBVGAUIDFQMRFJ-KUHUBIRLSA-N	0	3	338.407	3.263	20	30		EGEDHN
CC(C#N)C(=O)NCC1(c2cccc(C(F)(F)F)c2)CCOCC1	ZINC000347082177	457220892	/nfs/dbraw/zinc/22/08/92/457220892.db2.gz	YELTYNUPQNQTAU-LBPRGKRZSA-N	0	3	340.345	3.029	20	30		EGEDHN
C[C@@H]1CCN(C(=O)c2cccc(CC#N)c2)CCN1Cc1ccccc1	ZINC000363124862	457230409	/nfs/dbraw/zinc/23/04/09/457230409.db2.gz	CJDOIWRGTVJWNE-GOSISDBHSA-N	0	3	347.462	3.489	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N[C@@H]2CCC(C)(C)C2)cc1	ZINC000351696576	457313833	/nfs/dbraw/zinc/31/38/33/457313833.db2.gz	WYTINNQUJWLRLJ-GXTWGEPZSA-N	0	3	349.456	3.073	20	30		EGEDHN
C=CCN1CCC(NC(=O)CCCOc2ccc3c(c2)CCC3)CC1	ZINC000360743578	457334204	/nfs/dbraw/zinc/33/42/04/457334204.db2.gz	FKNMOOYIJQANQS-UHFFFAOYSA-N	0	3	342.483	3.101	20	30		EGEDHN
CC(=O)Nc1c[nH]nc1[C@H]1CCCN([C@@H](C)c2ccc(C#N)cc2)C1	ZINC000332316486	457347232	/nfs/dbraw/zinc/34/72/32/457347232.db2.gz	KLTVFGPNCQMTBQ-GUYCJALGSA-N	0	3	337.427	3.180	20	30		EGEDHN
C=CCNC(=O)NC(=O)[C@H](C)N[C@H](C)c1ccc(F)c2ccccc21	ZINC000352277428	457353596	/nfs/dbraw/zinc/35/35/96/457353596.db2.gz	BXGYZWGEQWBNDL-OLZOCXBDSA-N	0	3	343.402	3.030	20	30		EGEDHN
CCCN(C)CC(=O)N(Cc1cccc(C(F)(F)F)c1)[C@@H](C)C#N	ZINC000425085915	457433493	/nfs/dbraw/zinc/43/34/93/457433493.db2.gz	MMJWVRBOSJMNKP-ZDUSSCGKSA-N	0	3	341.377	3.288	20	30		EGEDHN
CCO[C@H]1C[C@@H](NCC(=O)Nc2cccc(C#N)c2)C1(CC)CC	ZINC000360946531	457454650	/nfs/dbraw/zinc/45/46/50/457454650.db2.gz	KBQKILIIXMUYRD-SJORKVTESA-N	0	3	329.444	3.070	20	30		EGEDHN
COCC(C)(C)N1CCN(c2ccc(C(F)(F)F)c(C#N)c2)CC1	ZINC000425285169	457482009	/nfs/dbraw/zinc/48/20/09/457482009.db2.gz	WLDLDNSXAMYBCK-UHFFFAOYSA-N	0	3	341.377	3.124	20	30		EGEDHN
COc1ccc(C#N)cc1CN1CCC[C@@H]1[C@@H]1C[C@H](C)CC[C@@H]1O	ZINC000374150407	457497779	/nfs/dbraw/zinc/49/77/79/457497779.db2.gz	FMWVPMLFEGQKJF-FDPIWHGQSA-N	0	3	328.456	3.328	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@@H](N(C)Cc3ccccc3)C2)cc1C#N	ZINC000370018071	457505062	/nfs/dbraw/zinc/50/50/62/457505062.db2.gz	HXUDCRODQCCKMM-HXUWFJFHSA-N	0	3	333.435	3.213	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)[C@@H]1CC12CCCCC2	ZINC000357455702	457538938	/nfs/dbraw/zinc/53/89/38/457538938.db2.gz	RRIDZVMVGVTUMN-IBGZPJMESA-N	0	3	339.483	3.419	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC[C@@H](C(C)C)N1CCc2ccccc2C1	ZINC000347613091	457550471	/nfs/dbraw/zinc/55/04/71/457550471.db2.gz	AKEGAMITGDPULE-XLIONFOSSA-N	0	3	344.499	3.167	20	30		EGEDHN
C[C@@H](CN1CCCCC1)NC(=O)N(C)[C@@H](C)c1cccc(C#N)c1	ZINC000425454636	457560967	/nfs/dbraw/zinc/56/09/67/457560967.db2.gz	BEURQEPVIFWXGN-HOTGVXAUSA-N	0	3	328.460	3.135	20	30		EGEDHN
CN(C)[C@]1(CNc2cccc(Br)c2C#N)CCSC1	ZINC000357497120	457565530	/nfs/dbraw/zinc/56/55/30/457565530.db2.gz	ACMBYYHUDKYGBT-AWEZNQCLSA-N	0	3	340.290	3.170	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC(CCN3C[C@@H](C)O[C@H](C)C3)CC2)CC1	ZINC000356310514	457566904	/nfs/dbraw/zinc/56/69/04/457566904.db2.gz	UJCHIWIATPQREV-QZTJIDSGSA-N	0	3	348.531	3.471	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)C[C@H](O)COc1ccc(F)cc1	ZINC000425531934	457587611	/nfs/dbraw/zinc/58/76/11/457587611.db2.gz	AUNJOTUBNGYLIG-KDOFPFPSSA-N	0	3	328.387	3.130	20	30		EGEDHN
COc1ccc(CN2CCC3(CCO3)CC2)cc1OCCCC#N	ZINC000374332868	457588501	/nfs/dbraw/zinc/58/85/01/457588501.db2.gz	RGDKNHYVUYNOJV-UHFFFAOYSA-N	0	3	330.428	3.133	20	30		EGEDHN
COC(=O)c1ccccc1OCCN(C)[C@H](C)c1cccc(C#N)c1	ZINC000425537660	457589598	/nfs/dbraw/zinc/58/95/98/457589598.db2.gz	QNXFJSLOZZURDP-OAHLLOKOSA-N	0	3	338.407	3.417	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN[C@@H](C)c1cncc(F)c1	ZINC000361132628	457601963	/nfs/dbraw/zinc/60/19/63/457601963.db2.gz	QXIWXDJXQPFFTI-KSSFIOAISA-N	0	3	330.403	3.040	20	30		EGEDHN
CO[C@@]1(C)CCCN([C@H](C)C(=O)N(C)C2(C#N)CCC(C)CC2)CC1	ZINC000361414417	457724917	/nfs/dbraw/zinc/72/49/17/457724917.db2.gz	VNTJBCGMYONGIB-NSPNGIHDSA-N	0	3	349.519	3.197	20	30		EGEDHN
C[C@@H](O)[C@@H]1C[C@H](C)CCN1CC#Cc1ccc(OC(F)(F)F)cc1	ZINC000443346023	457752595	/nfs/dbraw/zinc/75/25/95/457752595.db2.gz	LYKYXVSNXBHLBW-CPUCHLNUSA-N	0	3	341.373	3.418	20	30		EGEDHN
C=C[C@@H]1CCCCN1C(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1	ZINC000426062481	457768335	/nfs/dbraw/zinc/76/83/35/457768335.db2.gz	QDHOSGHFSIIBKM-BHIYHBOVSA-N	0	3	327.472	3.400	20	30		EGEDHN
C[C@@H]1CCCC[C@@H]1OCCNC(=O)C(C#N)CCc1ccccc1	ZINC000433225225	457783431	/nfs/dbraw/zinc/78/34/31/457783431.db2.gz	APBADBONXLNULG-NEWSRXKRSA-N	0	3	328.456	3.470	20	30		EGEDHN
C[C@@H]1CCCC[C@H]1OCCNC(=O)C(C#N)CCc1ccccc1	ZINC000433225224	457783541	/nfs/dbraw/zinc/78/35/41/457783541.db2.gz	APBADBONXLNULG-BHIYHBOVSA-N	0	3	328.456	3.470	20	30		EGEDHN
CN(C)Cc1cccc(CNC(=O)[C@@H](C#N)CCc2ccccc2)c1	ZINC000433225566	457784584	/nfs/dbraw/zinc/78/45/84/457784584.db2.gz	BXCBKLTZOZSRBG-HXUWFJFHSA-N	0	3	335.451	3.137	20	30		EGEDHN
Cc1nc2ccc(C(=O)C(C#N)c3nc4ccccc4n3C)cc2n1C	ZINC000361656503	457812176	/nfs/dbraw/zinc/81/21/76/457812176.db2.gz	SRWFBOJBWWEOHQ-AWEZNQCLSA-N	0	3	343.390	3.259	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCCOc1ccc(Cl)cn1	ZINC000433362846	457820982	/nfs/dbraw/zinc/82/09/82/457820982.db2.gz	KRORLJVFQVUYDZ-OAHLLOKOSA-N	0	3	343.814	3.003	20	30		EGEDHN
C[C@@H](CNC(=O)C(C#N)CCc1ccccc1)Oc1ccc(F)cc1	ZINC000433380804	457826493	/nfs/dbraw/zinc/82/64/93/457826493.db2.gz	FOZKSRCZMJLZLH-RDJZCZTQSA-N	0	3	340.398	3.482	20	30		EGEDHN
C[C@H](CNC(=O)C(C#N)CCc1ccccc1)Oc1ccc(F)cc1	ZINC000433380803	457826594	/nfs/dbraw/zinc/82/65/94/457826594.db2.gz	FOZKSRCZMJLZLH-NVXWUHKLSA-N	0	3	340.398	3.482	20	30		EGEDHN
CCO[C@@H]1C[C@H](N(C)C(=O)C(C#N)CCc2ccccc2)C1(C)C	ZINC000433479981	457840625	/nfs/dbraw/zinc/84/06/25/457840625.db2.gz	ZPHHENPYJQXBQH-FGTMMUONSA-N	0	3	328.456	3.421	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN[C@H]2CCN(c3ccccc3F)C2)cc1	ZINC000366589265	457862346	/nfs/dbraw/zinc/86/23/46/457862346.db2.gz	FBMCYSYZABEKAN-RDJZCZTQSA-N	0	3	339.414	3.485	20	30		EGEDHN
CC(C)(CC#N)CNC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F	ZINC000458047588	457914662	/nfs/dbraw/zinc/91/46/62/457914662.db2.gz	YEBNXIZPWAGINL-INIZCTEOSA-N	0	3	349.425	3.200	20	30		EGEDHN
C=CCN(C)CCN(CC)[C@H](C)C(=O)Nc1cccc(SC)c1	ZINC000411640646	457936136	/nfs/dbraw/zinc/93/61/36/457936136.db2.gz	KYNYOOFDRDBVDQ-OAHLLOKOSA-N	0	3	335.517	3.175	20	30		EGEDHN
C=CCN(C)CCN(CC)[C@H](C)C(=O)Nc1ccc(C)cc1Cl	ZINC000411637953	457937030	/nfs/dbraw/zinc/93/70/30/457937030.db2.gz	GOCFZQYAASZNDO-OAHLLOKOSA-N	0	3	337.895	3.415	20	30		EGEDHN
C=CCC[C@H](C(=O)NC[C@@]1(N(C)C)CCSC1)c1ccccc1	ZINC000427251260	457968396	/nfs/dbraw/zinc/96/83/96/457968396.db2.gz	RWXDLUVOPCXRNH-HKUYNNGSSA-N	0	3	332.513	3.290	20	30		EGEDHN
C[C@H](C(=O)N(CCN(C)C)Cc1ccsc1)c1cccc(C#N)c1	ZINC000458212724	457972327	/nfs/dbraw/zinc/97/23/27/457972327.db2.gz	BKPNJKVSBIPHLN-HNNXBMFYSA-N	0	3	341.480	3.314	20	30		EGEDHN
C=CCN(Cc1ccccc1)C(=O)NC[C@@H]1CCCCN1C1CC1	ZINC000434355822	457982519	/nfs/dbraw/zinc/98/25/19/457982519.db2.gz	QPNKWEPCQDSSHZ-IBGZPJMESA-N	0	3	327.472	3.401	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](C)CCCc2cccnc2)CC1	ZINC000458328006	458014824	/nfs/dbraw/zinc/01/48/24/458014824.db2.gz	WVPWARSRAGVBSA-KRWDZBQOSA-N	0	3	344.503	3.133	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)c1c[nH]nc1-c1ccoc1	ZINC000434620562	458024647	/nfs/dbraw/zinc/02/46/47/458024647.db2.gz	YKGFYTDEHSGTNT-LBPRGKRZSA-N	0	3	331.335	3.046	20	30		EGEDHN
N#Cc1ccc(CN[C@H](c2ccccc2)C2(CO)CCOCC2)cc1	ZINC000412011268	458044537	/nfs/dbraw/zinc/04/45/37/458044537.db2.gz	TYBJVJHBIKQFII-HXUWFJFHSA-N	0	3	336.435	3.178	20	30		EGEDHN
C[C@H](Oc1ccc(C#N)cc1)C(=O)Nc1ccc(CN(C)C)cc1F	ZINC000412551450	458231251	/nfs/dbraw/zinc/23/12/51/458231251.db2.gz	RLXFRFBJMLPCSS-ZDUSSCGKSA-N	0	3	341.386	3.165	20	30		EGEDHN
N#Cc1cccc(CNC(=O)CN[C@H]2CCC[C@@H]2c2ccccc2)c1	ZINC000376278548	458256809	/nfs/dbraw/zinc/25/68/09/458256809.db2.gz	HTUOWNFSVJDACA-UXHICEINSA-N	0	3	333.435	3.100	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2Cc3ccccc3C3(CCC3)C2)CC1	ZINC000376327137	458267944	/nfs/dbraw/zinc/26/79/44/458267944.db2.gz	GXYLLOFHSJKGKO-UHFFFAOYSA-N	0	3	339.483	3.284	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)NC(=O)N[C@H](C)C1=CCN(C)CC1	ZINC000413439486	458300986	/nfs/dbraw/zinc/30/09/86/458300986.db2.gz	KAPAINJVJYMAJW-APWZRJJASA-N	0	3	327.472	3.123	20	30		EGEDHN
C[C@H](c1ccc(C#N)cc1)N1CCC(n2ccc([N+](=O)[O-])n2)CC1	ZINC000376480605	458314614	/nfs/dbraw/zinc/31/46/14/458314614.db2.gz	ZWEDPWFWAKHZNI-CYBMUJFWSA-N	0	3	325.372	3.061	20	30		EGEDHN
C=CCN(C)CCN(CC)Cc1nn(-c2ccccc2)c2c1CCC2	ZINC000429719652	458363111	/nfs/dbraw/zinc/36/31/11/458363111.db2.gz	UMTLYNAQVVJGEO-UHFFFAOYSA-N	0	3	338.499	3.301	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)NCC1(C#N)CCC1)c1ccsc1	ZINC000419414051	458381221	/nfs/dbraw/zinc/38/12/21/458381221.db2.gz	DUHZRLGKHCOYSJ-HNNXBMFYSA-N	0	3	334.489	3.124	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)NCC2(C#N)CCC2)CCN1Cc1ccccc1	ZINC000419496449	458384414	/nfs/dbraw/zinc/38/44/14/458384414.db2.gz	LYUCMNZFAVUVFL-AEFFLSMTSA-N	0	3	340.471	3.033	20	30		EGEDHN
C=CCC[C@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)C1CC1	ZINC000436830673	458389349	/nfs/dbraw/zinc/38/93/49/458389349.db2.gz	RERZTWIFELRIAS-SFHVURJKSA-N	0	3	328.456	3.331	20	30		EGEDHN
N#CCC1(CNCc2cc(Br)c3c(c2)OCCO3)CC1	ZINC000430042508	458393195	/nfs/dbraw/zinc/39/31/95/458393195.db2.gz	QFTSFCGRNJARQW-UHFFFAOYSA-N	0	3	337.217	3.004	20	30		EGEDHN
C[C@](C#N)(NC(=O)CN1CC[C@H](c2ccccc2)C1(C)C)C1CC1	ZINC000421013200	458406298	/nfs/dbraw/zinc/40/62/98/458406298.db2.gz	FYXBHRVKWMCOPN-YLJYHZDGSA-N	0	3	325.456	3.063	20	30		EGEDHN
C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)NCc1ccc(C#N)s1	ZINC000421353238	458411852	/nfs/dbraw/zinc/41/18/52/458411852.db2.gz	SGWIAOSAQQCHCS-NSHDSACASA-N	0	3	344.396	3.035	20	30		EGEDHN
C[C@@H](O)[C@@](C)(CNCc1ccc(C#N)c(F)c1)Cc1ccccc1	ZINC000421402728	458413191	/nfs/dbraw/zinc/41/31/91/458413191.db2.gz	WMZJIDAHZPEJSC-FOIQADDNSA-N	0	3	326.415	3.417	20	30		EGEDHN
CC1(C#N)CCC(NCCS(=O)(=O)c2ccc(Cl)cc2)CC1	ZINC000449101046	458420293	/nfs/dbraw/zinc/42/02/93/458420293.db2.gz	SSWQSXCLHOBZNA-UHFFFAOYSA-N	0	3	340.876	3.176	20	30		EGEDHN
Cc1ccncc1CNCc1cn(CCC#N)nc1-c1ccccc1	ZINC000449520506	458426281	/nfs/dbraw/zinc/42/62/81/458426281.db2.gz	FAJPDYJKHPXIBI-UHFFFAOYSA-N	0	3	331.423	3.457	20	30		EGEDHN
COc1ccc(CN[C@H]2C[C@@H](OC(C)C)C2)cc1OCCCC#N	ZINC000459626975	458431527	/nfs/dbraw/zinc/43/15/27/458431527.db2.gz	DAEKJZHDRZTDIQ-CALCHBBNSA-N	0	3	332.444	3.423	20	30		EGEDHN
Cc1sc(NC(=O)CN[C@H]2C[C@@H](OC(C)C)C2(C)C)c(C#N)c1C	ZINC000451509649	458479572	/nfs/dbraw/zinc/47/95/72/458479572.db2.gz	YKWGGJYTPHLCII-LSDHHAIUSA-N	0	3	349.500	3.357	20	30		EGEDHN
C[C@@H](CC(=O)N(C)Cc1cccc(Cl)c1)NCC1(CC#N)CC1	ZINC000430759354	458487865	/nfs/dbraw/zinc/48/78/65/458487865.db2.gz	YBUDWMSLICUDEV-AWEZNQCLSA-N	0	3	333.863	3.360	20	30		EGEDHN
C[C@]12CN([C@@H]3CCN(c4sccc4C#N)C3=O)C[C@H]1[C@@H]1CC[C@H]2C1	ZINC000452053077	458494247	/nfs/dbraw/zinc/49/42/47/458494247.db2.gz	NWXIMKKYQQDWCE-SNOASFMESA-N	0	3	341.480	3.093	20	30		EGEDHN
CC(C)OCCOC1CCN([C@@H]2CCc3ccc(C#N)cc32)CC1	ZINC000453381832	458525860	/nfs/dbraw/zinc/52/58/60/458525860.db2.gz	XTVVIPMKDYDQKW-HXUWFJFHSA-N	0	3	328.456	3.452	20	30		EGEDHN
C=CCn1c(-c2ccccc2)nnc1N1CCN([C@H](C)CC)CC1	ZINC000453445684	458530514	/nfs/dbraw/zinc/53/05/14/458530514.db2.gz	NVHQXZBKFNUFHG-MRXNPFEDSA-N	0	3	325.460	3.052	20	30		EGEDHN
C=C(C)Cn1c(C)nnc1N1CCN(Cc2ccccc2)C[C@H](C)C1	ZINC000453455565	458531451	/nfs/dbraw/zinc/53/14/51/458531451.db2.gz	SSQYIQBSJSMQNQ-KRWDZBQOSA-N	0	3	339.487	3.121	20	30		EGEDHN
C=C(C)Cn1c(CC(C)C)nnc1N1CCN([C@@H]2C[C@H]2C)C[C@@H](C)C1	ZINC000453452109	458532152	/nfs/dbraw/zinc/53/21/52/458532152.db2.gz	LONQDNNPSPOYIC-KZNAEPCWSA-N	0	3	345.535	3.219	20	30		EGEDHN
C=C(C)Cn1c([C@@H]2CC[C@H](C)O2)nnc1N(C)[C@H]1CCN(C(C)C)C1	ZINC000453462174	458533427	/nfs/dbraw/zinc/53/34/27/458533427.db2.gz	PDRJOUYISDNDES-ULQDDVLXSA-N	0	3	347.507	3.013	20	30		EGEDHN
Cc1cccc2[nH]c([C@H](C#N)C(=O)c3cccc(CN(C)C)c3)nc21	ZINC000453673649	458542995	/nfs/dbraw/zinc/54/29/95/458542995.db2.gz	PNVKTGGUDJIMDH-MRXNPFEDSA-N	0	3	332.407	3.423	20	30		EGEDHN
Cc1cccc2nc([C@H](C#N)C(=O)c3cccc(CN(C)C)c3)[nH]c21	ZINC000453673649	458542998	/nfs/dbraw/zinc/54/29/98/458542998.db2.gz	PNVKTGGUDJIMDH-MRXNPFEDSA-N	0	3	332.407	3.423	20	30		EGEDHN
Cc1sc(NC(=O)[C@@H](N)CCCC#N)nc1-c1ccc(C)cc1	ZINC000424074777	458551939	/nfs/dbraw/zinc/55/19/39/458551939.db2.gz	ICVQDOREZHMORK-AWEZNQCLSA-N	0	3	328.441	3.387	20	30		EGEDHN
C=CCN1CC[C@@H](NCC2(c3cccc(F)c3)CCCCC2)C1=O	ZINC000493762920	458558663	/nfs/dbraw/zinc/55/86/63/458558663.db2.gz	HFOQSPHJORWOSA-GOSISDBHSA-N	0	3	330.447	3.404	20	30		EGEDHN
C[C@H](NC(=O)[C@H](N)CCCC#N)C(c1ccccc1)c1ccccc1	ZINC000424101761	458558981	/nfs/dbraw/zinc/55/89/81/458558981.db2.gz	PKSZTEAEDPDNGT-QFBILLFUSA-N	0	3	335.451	3.344	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1ccccc1OCCc1ccccc1	ZINC000424106716	458560221	/nfs/dbraw/zinc/56/02/21/458560221.db2.gz	XVVUYSAXUHBIDJ-KRWDZBQOSA-N	0	3	337.423	3.268	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1ccc2nc(Cc3ccccc3)oc2c1	ZINC000424118876	458563238	/nfs/dbraw/zinc/56/32/38/458563238.db2.gz	DNAQIFAMOKJKQI-INIZCTEOSA-N	0	3	348.406	3.378	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCCc3ccccc3CC2)CC1	ZINC000454462794	458563690	/nfs/dbraw/zinc/56/36/90/458563690.db2.gz	KSIVCGXKMBNQMR-UHFFFAOYSA-N	0	3	341.499	3.227	20	30		EGEDHN
Cc1ccc(CNC(=O)[C@@H](N)CCCC#N)c(O[C@H](C)CC(C)C)c1	ZINC000424124209	458564475	/nfs/dbraw/zinc/56/44/75/458564475.db2.gz	LRAQBSXLKJSJGF-AEFFLSMTSA-N	0	3	345.487	3.446	20	30		EGEDHN
Cn1c2ccccc2nc1-c1cccc(NC(=O)[C@@H](N)CCCC#N)c1	ZINC000424135907	458567608	/nfs/dbraw/zinc/56/76/08/458567608.db2.gz	PTGMYDSDNWJVHN-INIZCTEOSA-N	0	3	347.422	3.200	20	30		EGEDHN
COc1ccc(-c2csc(CNC(=O)[C@H](N)CCCC#N)c2)cc1	ZINC000424149969	458571736	/nfs/dbraw/zinc/57/17/36/458571736.db2.gz	IFCIIJSUCJHBGY-QGZVFWFLSA-N	0	3	343.452	3.061	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N1CCCC[C@H]1CCCc1ccccc1	ZINC000424167638	458574820	/nfs/dbraw/zinc/57/48/20/458574820.db2.gz	FEKHTDUUBJQVMX-OALUTQOASA-N	0	3	327.472	3.412	20	30		EGEDHN
C=CC(C)(C)CNC(=O)NCc1ccc(OC2CCN(C)CC2)cc1	ZINC000454921271	458580649	/nfs/dbraw/zinc/58/06/49/458580649.db2.gz	WKTWTRFRFUCNMS-UHFFFAOYSA-N	0	3	345.487	3.171	20	30		EGEDHN
CCc1c(NC(=O)[C@H](N)CCCC#N)cnn1-c1ccccc1Cl	ZINC000424194907	458581171	/nfs/dbraw/zinc/58/11/71/458581171.db2.gz	YAVWFXSELYCDQU-CYBMUJFWSA-N	0	3	345.834	3.048	20	30		EGEDHN
C[C@@H]1C[C@H](CNC(=O)OC(C)(C)C)CN1Cc1ccc(C#N)cc1	ZINC000493915072	458600093	/nfs/dbraw/zinc/60/00/93/458600093.db2.gz	RKLQVSWZYWXADD-RHSMWYFYSA-N	0	3	329.444	3.293	20	30		EGEDHN
COC(=O)Nc1ccc(CCNCc2ccc(C#N)cc2F)cc1	ZINC000493933283	458602337	/nfs/dbraw/zinc/60/23/37/458602337.db2.gz	DEDIZZTYTHCWTI-UHFFFAOYSA-N	0	3	327.359	3.208	20	30		EGEDHN
C[C@@H](C(=O)N1CCN(C2CCCCC2)CC1)c1cccc(C#N)c1	ZINC000462235586	458606989	/nfs/dbraw/zinc/60/69/89/458606989.db2.gz	FMEZVPNBSBTDJS-MRXNPFEDSA-N	0	3	325.456	3.139	20	30		EGEDHN
CCN1CCC[C@@H]1CN(C)C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000455706683	458608210	/nfs/dbraw/zinc/60/82/10/458608210.db2.gz	QNYPOYPPCLNBAT-CQSZACIVSA-N	0	3	334.851	3.354	20	30		EGEDHN
CC#CCCNC(=O)Nc1cc(Cl)ccc1OC1CCN(C)CC1	ZINC000455941721	458624152	/nfs/dbraw/zinc/62/41/52/458624152.db2.gz	JSZIDXWZQMBEBL-UHFFFAOYSA-N	0	3	349.862	3.348	20	30		EGEDHN
Cc1cc(C#N)cc(NC(=O)N[C@H](CN(C)C)c2ccc(F)cc2)c1	ZINC000455957986	458625477	/nfs/dbraw/zinc/62/54/77/458625477.db2.gz	RDTSJJUKBLHUBM-GOSISDBHSA-N	0	3	340.402	3.430	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCc1ccc(CN2CCN(CC)CC2)cc1	ZINC000424599945	458676828	/nfs/dbraw/zinc/67/68/28/458676828.db2.gz	WQUMOAFAZUNOJD-UHFFFAOYSA-N	0	3	343.515	3.043	20	30		EGEDHN
C[C@H](C(=O)N[C@H]1CCN(Cc2ccccc2)[C@H]1C)c1cccc(C#N)c1	ZINC000464640415	458763157	/nfs/dbraw/zinc/76/31/57/458763157.db2.gz	SIBOXZDDBFECJU-FIKGOQFSSA-N	0	3	347.462	3.441	20	30		EGEDHN
C=CCn1c(-c2ccc(C)s2)nnc1N1CCN(C)[C@H](C(C)C)C1	ZINC000508861793	458764507	/nfs/dbraw/zinc/76/45/07/458764507.db2.gz	BWGQMYLMEMGHNO-HNNXBMFYSA-N	0	3	345.516	3.277	20	30		EGEDHN
C=CCn1c(C)nnc1N1CCN(C2CCC(C(C)C)CC2)CC1	ZINC000508929836	458767885	/nfs/dbraw/zinc/76/78/85/458767885.db2.gz	CIZIYZVJTHCPIV-UHFFFAOYSA-N	0	3	331.508	3.109	20	30		EGEDHN
C=CCOc1cccc(NC(=O)N[C@H](C)CN2CCC[C@@H](C)C2)c1	ZINC000510954715	458777593	/nfs/dbraw/zinc/77/75/93/458777593.db2.gz	YETYTFBMZBMINA-HZPDHXFCSA-N	0	3	331.460	3.493	20	30		EGEDHN
C[C@@H]1C[C@H](N(C)C(=O)NCC(C)(C)C#N)CCN1Cc1ccccc1	ZINC000512797235	458788321	/nfs/dbraw/zinc/78/83/21/458788321.db2.gz	JUCFUQOEHFCFJW-SJLPKXTDSA-N	0	3	342.487	3.231	20	30		EGEDHN
Cc1ccccc1C[C@@H]1CCCN1CC(=O)NCc1cccc(C#N)c1	ZINC000514189668	458798537	/nfs/dbraw/zinc/79/85/37/458798537.db2.gz	NASTUDGICKXFSG-NRFANRHFSA-N	0	3	347.462	3.190	20	30		EGEDHN
C[C@H]1CN(CCCNc2ccc(C#N)cc2C(F)(F)F)CCCO1	ZINC000432845565	458799381	/nfs/dbraw/zinc/79/93/81/458799381.db2.gz	FDNZAMLLZNBDLS-ZDUSSCGKSA-N	0	3	341.377	3.490	20	30		EGEDHN
CN(CCOCc1ccc(C#N)cc1)CC1=Cc2ccccc2OC1	ZINC000515332769	458807121	/nfs/dbraw/zinc/80/71/21/458807121.db2.gz	RFZXEEXGOVGYQE-UHFFFAOYSA-N	0	3	334.419	3.483	20	30		EGEDHN
CN(CC(=O)N[C@](C)(C#N)C1CC1)[C@@H]1CCCC[C@H]1c1ccccc1	ZINC000516417112	458817455	/nfs/dbraw/zinc/81/74/55/458817455.db2.gz	XPPRZDOJMYLEFP-QKNQBKEWSA-N	0	3	339.483	3.453	20	30		EGEDHN
Cc1ncncc1[C@@H](C)N[C@@H]1CCCN(c2ccc(C#N)cc2F)C1	ZINC000516490800	458818914	/nfs/dbraw/zinc/81/89/14/458818914.db2.gz	OBSQNJVNJDJHLG-GDBMZVCRSA-N	0	3	339.418	3.115	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NCC#Cc2ccccc2)C1	ZINC000516578015	458819430	/nfs/dbraw/zinc/81/94/30/458819430.db2.gz	FTHFSPBPFIJFHF-GHTZIAJQSA-N	0	3	347.462	3.173	20	30		EGEDHN
COC(=O)c1cccc(CN[C@H](C)CCCc2cccnc2)c1C#N	ZINC000516629218	458819741	/nfs/dbraw/zinc/81/97/41/458819741.db2.gz	FOXZZQXOBWEEGT-OAHLLOKOSA-N	0	3	337.423	3.241	20	30		EGEDHN
Cc1cc(NC(=O)c2ccc(CN3CCCCC3)cc2)ncc1C#N	ZINC000516978434	458824540	/nfs/dbraw/zinc/82/45/40/458824540.db2.gz	FZKZHGZFNAVRRE-UHFFFAOYSA-N	0	3	334.423	3.500	20	30		EGEDHN
COc1cc(CNC[C@H](c2ccccc2)N2CCCC2)ccc1C#N	ZINC000440816239	458857258	/nfs/dbraw/zinc/85/72/58/458857258.db2.gz	MBRFOIWTTDTCTO-HXUWFJFHSA-N	0	3	335.451	3.494	20	30		EGEDHN
C=C(C)Cn1c(-c2ccccc2)nnc1N1CCN(C)[C@H](C(C)C)C1	ZINC000549271254	458879347	/nfs/dbraw/zinc/87/93/47/458879347.db2.gz	CEFZGCLRTKCWGS-SFHVURJKSA-N	0	3	339.487	3.298	20	30		EGEDHN
C=CCNC(=O)CN1CCc2ccccc2[C@@H](c2ccccc2)[C@H]1C	ZINC000441088855	458886704	/nfs/dbraw/zinc/88/67/04/458886704.db2.gz	ADSYFWWCCPYLBX-VGOFRKELSA-N	0	3	334.463	3.367	20	30		EGEDHN
CC[C@](C)(C#N)c1nc(-c2ccc3c(c2)C(SC)C(=O)N3)no1	ZINC000554808075	458901480	/nfs/dbraw/zinc/90/14/80/458901480.db2.gz	KKJFIMLEYBXHST-BLLLJJGKSA-N	0	3	328.397	3.284	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)N1CCC(c2ccc(OC)cc2)CC1	ZINC000466701938	458913693	/nfs/dbraw/zinc/91/36/93/458913693.db2.gz	ABYBYNNKYVVOMW-KRWDZBQOSA-N	0	3	342.483	3.464	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN2C[C@@H](C)C[C@H]2CC)cc1	ZINC000466929089	458936248	/nfs/dbraw/zinc/93/62/48/458936248.db2.gz	NHYZLXRPTZSVPD-DLBZAZTESA-N	0	3	343.471	3.452	20	30		EGEDHN
CC(C)[C@@H](NC(=O)C(C#N)CCc1ccccc1)C1(CO)CCCC1	ZINC000566465385	458941090	/nfs/dbraw/zinc/94/10/90/458941090.db2.gz	UWZBTHUMQBUHMQ-RBUKOAKNSA-N	0	3	342.483	3.452	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)CN(C[C@@H]1CCCO1)C1CCC(C)CC1	ZINC000441469141	458950394	/nfs/dbraw/zinc/95/03/94/458950394.db2.gz	XCPJCVPNYNYDOP-QQGUTBHFSA-N	0	3	349.519	3.101	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCN2CC[C@H](Oc3ccccc3)C2)cc1	ZINC000577277290	459008856	/nfs/dbraw/zinc/00/88/56/459008856.db2.gz	MHKKNBHENLIDRI-IBGZPJMESA-N	0	3	335.407	3.040	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)c2ccc3c(c2)C(C)(C)C(=O)N3)n1	ZINC000532020208	459018822	/nfs/dbraw/zinc/01/88/22/459018822.db2.gz	VUXZYCBMGDFRPT-NSHDSACASA-N	0	3	325.393	3.171	20	30		EGEDHN
C[C@H](N[C@@H](CN1CCN(C)CC1)c1ccccc1)c1ccc(C#N)cc1	ZINC000532022414	459019520	/nfs/dbraw/zinc/01/95/20/459019520.db2.gz	MGQSVUYAVAWZAD-AVRDEDQJSA-N	0	3	348.494	3.198	20	30		EGEDHN
CCCN(CC(=O)N[C@@](C)(C#N)C(C)C)[C@H]1CCc2ccccc21	ZINC000519906549	459019968	/nfs/dbraw/zinc/01/99/68/459019968.db2.gz	JMBPAUWXIPZGLJ-ICSRJNTNSA-N	0	3	327.472	3.440	20	30		EGEDHN
CC(C)(C)OC(=O)NC1C[C@H]2CC[C@@H](C1)C2NC[C@H](C#N)CCC#N	ZINC000496039467	459046312	/nfs/dbraw/zinc/04/63/12/459046312.db2.gz	IFQAHOCYGDHBNC-CGLCSIQHSA-N	0	3	346.475	3.101	20	30		EGEDHN
N#C[C@@H]1CC[C@H](N[C@H](Cc2ccccc2)C(=O)NCc2ccccc2)C1	ZINC000442865238	459047549	/nfs/dbraw/zinc/04/75/49/459047549.db2.gz	SVIFTWMZLXUSGQ-QHAWAJNXSA-N	0	3	347.462	3.196	20	30		EGEDHN
C=CCN1CCC(NC(=O)CCCCc2ccc(OC)cc2)CC1	ZINC000520687508	459083985	/nfs/dbraw/zinc/08/39/85/459083985.db2.gz	KGUHPVUSYXQTLZ-UHFFFAOYSA-N	0	3	330.472	3.175	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@H]2CN(C)C[C@H]2c2ccccc2)cc1	ZINC000478405029	459089328	/nfs/dbraw/zinc/08/93/28/459089328.db2.gz	ZKAJUBICFKIWOP-PMACEKPBSA-N	0	3	336.435	3.079	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCCc1nc2ccccc2o1	ZINC000520817219	459096682	/nfs/dbraw/zinc/09/66/82/459096682.db2.gz	SBJBIYLYHIMUQP-INIZCTEOSA-N	0	3	333.391	3.259	20	30		EGEDHN
CC[C@H](NCc1ccc(OCCOC)nc1)c1ccc(C#N)cc1	ZINC000577814678	459099072	/nfs/dbraw/zinc/09/90/72/459099072.db2.gz	RECRMOBYSXVIST-SFHVURJKSA-N	0	3	325.412	3.219	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC([C@@H]2C[C@H]2NC[C@@H](C#N)CCC#N)CC1	ZINC000496248639	459122581	/nfs/dbraw/zinc/12/25/81/459122581.db2.gz	XBWFSMUMFVHGPT-HYVNUMGLSA-N	0	3	346.475	3.055	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@]2(CCN([C@H]3CC[C@@H](C#N)C3)C2)C1	ZINC000496375908	459170427	/nfs/dbraw/zinc/17/04/27/459170427.db2.gz	AWHRLDCFCCNTJX-JTDSTZFVSA-N	0	3	333.476	3.402	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CCC[C@@H]1[C@@H]1CCCO1)C(C)C	ZINC000480515942	459202049	/nfs/dbraw/zinc/20/20/49/459202049.db2.gz	IHHRIYLKOZOSSW-QRVBRYPASA-N	0	3	349.519	3.038	20	30		EGEDHN
Cc1c(Cl)cnc(NC[C@H]2CCN(Cc3ccccc3)C2)c1C#N	ZINC000480510537	459202296	/nfs/dbraw/zinc/20/22/96/459202296.db2.gz	QMZWJKOYMONSFZ-MRXNPFEDSA-N	0	3	340.858	3.271	20	30		EGEDHN
CN(CCOc1ccc(C#N)cc1)CCc1cccc([N+](=O)[O-])c1	ZINC000558739642	459206565	/nfs/dbraw/zinc/20/65/65/459206565.db2.gz	QNZDFSWVMXQHMY-UHFFFAOYSA-N	0	3	325.368	3.020	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CC2(CCC2)[C@@H]1C1CC1	ZINC000581222580	459269805	/nfs/dbraw/zinc/26/98/05/459269805.db2.gz	ADXLLTGCASPEFO-QUCCMNQESA-N	0	3	327.468	3.419	20	30		EGEDHN
N#Cc1ccc(CC[NH+]2CCC(C(=O)Nc3ccccc3[O-])CC2)cc1	ZINC000595350597	459281530	/nfs/dbraw/zinc/28/15/30/459281530.db2.gz	FQBVNXMJLPWAFC-UHFFFAOYSA-N	0	3	349.434	3.157	20	30		EGEDHN
N#C[C@@H](c1ccccc1)N1CCN(CC2Cc3ccccc3C2)CC1	ZINC000568465397	459291040	/nfs/dbraw/zinc/29/10/40/459291040.db2.gz	XLXIKXISGWTDHK-QFIPXVFZSA-N	0	3	331.463	3.284	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2N[C@@H]1CCN(c2ccc(F)cc2)C1=O	ZINC000591255928	459342625	/nfs/dbraw/zinc/34/26/25/459342625.db2.gz	HTDPYDXUMRAABQ-VQTJNVASSA-N	0	3	349.409	3.470	20	30		EGEDHN
N#CCC[C@H](C#N)CNC1CCN(Cc2ccc(Cl)cc2)CC1	ZINC000560454999	459349119	/nfs/dbraw/zinc/34/91/19/459349119.db2.gz	LBLWXVAIKAKNCF-MRXNPFEDSA-N	0	3	330.863	3.338	20	30		EGEDHN
C=CCCSCCNC(=O)NC[C@H]1CCN(Cc2ccccc2)C1	ZINC000595597570	459359316	/nfs/dbraw/zinc/35/93/16/459359316.db2.gz	SAQLZTAUKAGKCU-GOSISDBHSA-N	0	3	347.528	3.117	20	30		EGEDHN
N#CC[C@H]1CCCN(CCC(=O)N[C@H]2CCCc3ccccc32)C1	ZINC000595612433	459367244	/nfs/dbraw/zinc/36/72/44/459367244.db2.gz	WQKSDEVHJCPIFO-APWZRJJASA-N	0	3	325.456	3.196	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC2(c3ccc(Cl)cc3)CC2)CC1	ZINC000483678702	459380872	/nfs/dbraw/zinc/38/08/72/459380872.db2.gz	DKQAXVMVEXKISG-UHFFFAOYSA-N	0	3	333.863	3.279	20	30		EGEDHN
Cc1ccc(CN(CCN(C)C)C(=O)c2ccc(Cl)c(C#N)c2)o1	ZINC000540883617	459397332	/nfs/dbraw/zinc/39/73/32/459397332.db2.gz	QHUIFTBSQHJBCX-UHFFFAOYSA-N	0	3	345.830	3.317	20	30		EGEDHN
N#Cc1cccc(C2(NC(=O)Nc3ccc4c(c3)CNCC4)CC2)c1	ZINC000569202127	459412662	/nfs/dbraw/zinc/41/26/62/459412662.db2.gz	SRLVOXMXNAPVSE-UHFFFAOYSA-N	0	3	332.407	3.015	20	30		EGEDHN
OC[C@@H](NCC#Cc1ccc(OC(F)(F)F)cc1)C1CCCCC1	ZINC000541050782	459421974	/nfs/dbraw/zinc/42/19/74/459421974.db2.gz	BSDXMPIVSNDBGA-QGZVFWFLSA-N	0	3	341.373	3.468	20	30		EGEDHN
CCc1cccc(OC[C@H](O)CNCc2ccc(C#N)c(Cl)c2)c1	ZINC000591765861	459431150	/nfs/dbraw/zinc/43/11/50/459431150.db2.gz	MBLAAKRMIDJBCJ-QGZVFWFLSA-N	0	3	344.842	3.304	20	30		EGEDHN
C=CCC1(NCC(=O)Nc2ccc(OCC)cc2[N+](=O)[O-])CCCC1	ZINC000595780265	459437655	/nfs/dbraw/zinc/43/76/55/459437655.db2.gz	OAEQQTLMCJCHIG-UHFFFAOYSA-N	0	3	347.415	3.411	20	30		EGEDHN
CC(C)(C)OC(=O)NCC12CCC(CC1)CN2[C@H]1CC[C@H](C#N)C1	ZINC000497100041	459438915	/nfs/dbraw/zinc/43/89/15/459438915.db2.gz	PXCUAWCZHYTERZ-IOSXPMGOSA-N	0	3	333.476	3.448	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H]2CN(Cc3cc(C#N)cs3)C[C@@H]2C1	ZINC000497162897	459466828	/nfs/dbraw/zinc/46/68/28/459466828.db2.gz	CKQGJFYSZBVIKG-HUUCEWRRSA-N	0	3	347.484	3.309	20	30		EGEDHN
C[C@@H](C(=O)N(CCC#N)c1ccc(F)cc1)N(C)C[C@@H]1CC1(C)C	ZINC000595909999	459483182	/nfs/dbraw/zinc/48/31/82/459483182.db2.gz	APVKDGOKEZJWAJ-GJZGRUSLSA-N	0	3	331.435	3.439	20	30		EGEDHN
Cc1nc(C(=O)NCC2(N(C)Cc3ccccc3)CCC2)ccc1C#N	ZINC000583304284	459516533	/nfs/dbraw/zinc/51/65/33/459516533.db2.gz	BBOOVYKODFIDND-UHFFFAOYSA-N	0	3	348.450	3.046	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)N2CCC[C@@H](CC#N)C2)N(C)C)cc1	ZINC000596093838	459517696	/nfs/dbraw/zinc/51/76/96/459517696.db2.gz	YDASRQSEGOJGDJ-PKOBYXMFSA-N	0	3	342.487	3.187	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1CCC[C@@H]1CCCc1ccccc1	ZINC000486809504	459523394	/nfs/dbraw/zinc/52/33/94/459523394.db2.gz	OAMSGQLLBSSIKX-QUCCMNQESA-N	0	3	341.499	3.482	20	30		EGEDHN
Cc1cc(CNC[C@@H](c2cccs2)N2CCOCC2)ccc1C#N	ZINC000487894941	459535878	/nfs/dbraw/zinc/53/58/78/459535878.db2.gz	HQGZTEXSGMLLJK-SFHVURJKSA-N	0	3	341.480	3.091	20	30		EGEDHN
C[C@H]1C[C@H](Nc2nc(C#N)c(Cl)s2)CN1Cc1ccccc1	ZINC000596160872	459543950	/nfs/dbraw/zinc/54/39/50/459543950.db2.gz	JFKWFHBHXQNEJF-AAEUAGOBSA-N	0	3	332.860	3.165	20	30		EGEDHN
CCCN(C)[C@@H](CNC(=O)NC[C@H](C)C#N)c1ccc(Cl)cc1	ZINC000570069920	459550959	/nfs/dbraw/zinc/55/09/59/459550959.db2.gz	SWOUFLBDUBTRNK-CJNGLKHVSA-N	0	3	336.867	3.182	20	30		EGEDHN
C[C@H](C(=O)NC1(C#N)CCC1)N1CC[C@](C)(CCc2ccccc2)C1	ZINC000527048423	459582887	/nfs/dbraw/zinc/58/28/87/459582887.db2.gz	LQSIBIZMHJCUJN-XLIONFOSSA-N	0	3	339.483	3.282	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@]2(c3ccc(Cl)cc3)C[C@@H]2C)CC1	ZINC000491047514	459595944	/nfs/dbraw/zinc/59/59/44/459595944.db2.gz	UXYGZRHQYZDBLT-IFXJQAMLSA-N	0	3	330.859	3.037	20	30		EGEDHN
C#CCN(C)CCCN[C@@H](c1cccnc1)c1ccc(F)c(C)c1	ZINC000491073010	459596474	/nfs/dbraw/zinc/59/64/74/459596474.db2.gz	WZKBGGLLJSUDOS-HXUWFJFHSA-N	0	3	325.431	3.163	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(-c3ccncc3)c(C)c2)CC1	ZINC000491178583	459602860	/nfs/dbraw/zinc/60/28/60/459602860.db2.gz	ADOIJHYVVFDUAJ-UHFFFAOYSA-N	0	3	333.435	3.341	20	30		EGEDHN
C#C[C@@H](N[C@H](C)C1CN(C(=O)OC(C)(C)C)C1)c1ccc(F)cc1	ZINC000491181827	459603521	/nfs/dbraw/zinc/60/35/21/459603521.db2.gz	WDXZTZYPQBOAJD-CXAGYDPISA-N	0	3	332.419	3.345	20	30		EGEDHN
N#Cc1ccc([C@H](N[C@@H]2CC[C@H](c3cccc(F)c3)C2)C(N)=O)cc1	ZINC000583969652	459626356	/nfs/dbraw/zinc/62/63/56/459626356.db2.gz	SPJWWXSOWVVDIR-UHOSZYNNSA-N	0	3	337.398	3.150	20	30		EGEDHN
C=CCN1CC[C@H](NC(C)(C)c2ccc(OC(F)(F)F)cc2)C1=O	ZINC000499702247	459648290	/nfs/dbraw/zinc/64/82/90/459648290.db2.gz	CZUAHZWHQSMBOS-AWEZNQCLSA-N	0	3	342.361	3.197	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN[C@H](C)c1cnn(C(C)C)c1	ZINC000543502918	459664370	/nfs/dbraw/zinc/66/43/70/459664370.db2.gz	APUNXGFRPKMEHS-APWZRJJASA-N	0	3	343.471	3.283	20	30		EGEDHN
C#CCN(CC)C(=O)Nc1cc(Cl)ccc1OC1CCN(C)CC1	ZINC000491785706	459673156	/nfs/dbraw/zinc/67/31/56/459673156.db2.gz	SRMQKCIRFBWKMD-UHFFFAOYSA-N	0	3	349.862	3.300	20	30		EGEDHN
Cc1ccc(NC(=O)/C=C\c2ccc(C#N)cc2)c(OCCN(C)C)c1	ZINC000491904867	459684257	/nfs/dbraw/zinc/68/42/57/459684257.db2.gz	LEPVGEFACYUHIG-LUAWRHEFSA-N	0	3	349.434	3.459	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](O)Cc2ccccc2C(F)(F)F)cc1	ZINC000562987755	459687401	/nfs/dbraw/zinc/68/74/01/459687401.db2.gz	KKPVSPJVQYLROZ-MRXNPFEDSA-N	0	3	334.341	3.270	20	30		EGEDHN
CN1CC[C@H](NC(=O)/C=C/c2ccc(C#N)cc2)[C@H]1c1ccccc1	ZINC000492248323	459697248	/nfs/dbraw/zinc/69/72/48/459697248.db2.gz	MIEXSQLKEXQBKM-RTIYCVIDSA-N	0	3	331.419	3.133	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@H](CO)C1CCCCC1	ZINC000543839966	459706455	/nfs/dbraw/zinc/70/64/55/459706455.db2.gz	OTBFDGCUEMATEV-QGZVFWFLSA-N	0	3	348.512	3.434	20	30		EGEDHN
CC[C@@H](C)N1CCN([C@@H](C#N)c2ccc(Br)cc2)CC1	ZINC000501028746	459707479	/nfs/dbraw/zinc/70/74/79/459707479.db2.gz	JRTGPUCLPQCDFD-CJNGLKHVSA-N	0	3	336.277	3.430	20	30		EGEDHN
CCCN(CCN1CCCCC1)C(=O)NCCc1ccc(C#N)cc1	ZINC000596674469	459723867	/nfs/dbraw/zinc/72/38/67/459723867.db2.gz	DTQGEVIHUDZQQZ-UHFFFAOYSA-N	0	3	342.487	3.008	20	30		EGEDHN
C=CCCC[C@H](C)NC(=O)N[C@H](CN(C)C)c1ccc(OC)cc1	ZINC000501551520	459735892	/nfs/dbraw/zinc/73/58/92/459735892.db2.gz	GWNYEKZNQBITRG-MAUKXSAKSA-N	0	3	333.476	3.342	20	30		EGEDHN
N#Cc1cc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)ccc1F	ZINC000593050730	459755297	/nfs/dbraw/zinc/75/52/97/459755297.db2.gz	VIZBGSWGDVNOFH-VXGBXAGGSA-N	0	3	330.281	3.383	20	30		EGEDHN
CCC(C#N)(CC)C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000527928798	459775105	/nfs/dbraw/zinc/77/51/05/459775105.db2.gz	HEQHERKGXDCESN-UHFFFAOYSA-N	0	3	327.472	3.140	20	30		EGEDHN
CN(C)CCc1ccccc1NC(=O)NCCc1ccc(C#N)cc1	ZINC000596854336	459779306	/nfs/dbraw/zinc/77/93/06/459779306.db2.gz	OXDQAAMREWXKBE-UHFFFAOYSA-N	0	3	336.439	3.027	20	30		EGEDHN
C[C@H](CN1CCC(C)CC1)NC(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000598262396	459842318	/nfs/dbraw/zinc/84/23/18/459842318.db2.gz	ZJNBQKNTTCJWKP-MRXNPFEDSA-N	0	3	327.472	3.338	20	30		EGEDHN
COCCCN(CCc1ccc(OC)cc1)Cc1ccc(C#N)cn1	ZINC000566416194	459862150	/nfs/dbraw/zinc/86/21/50/459862150.db2.gz	DVIDMUOEEDOSKM-UHFFFAOYSA-N	0	3	339.439	3.043	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)c(Cl)c1)c1ccc2c(c1)OCC(=O)N2	ZINC000586794329	459875363	/nfs/dbraw/zinc/87/53/63/459875363.db2.gz	ZSEQMEJTCRWFON-LLVKDONJSA-N	0	3	341.798	3.393	20	30		EGEDHN
CCCN(C(=O)[C@H](C#N)CC)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000593446151	459892485	/nfs/dbraw/zinc/89/24/85/459892485.db2.gz	LSFNYSNIGSRZED-RBUKOAKNSA-N	0	3	327.472	3.439	20	30		EGEDHN
N#CCCN(C(=O)CN1CCC[C@H]1C1CC1)c1cccc(Cl)c1	ZINC000609137215	459908526	/nfs/dbraw/zinc/90/85/26/459908526.db2.gz	UZVWEMSDEAURJB-KRWDZBQOSA-N	0	3	331.847	3.461	20	30		EGEDHN
CC(C)CCN(CCC#N)C(=O)[C@@H]1CCCN(Cc2cccnc2)C1	ZINC000609142961	459910477	/nfs/dbraw/zinc/91/04/77/459910477.db2.gz	BDJUQSBIPVBAPD-LJQANCHMSA-N	0	3	342.487	3.082	20	30		EGEDHN
CN(C)Cc1cccc(CNC(=O)c2cc3ccccc3n2CC#N)c1	ZINC000609161359	459916606	/nfs/dbraw/zinc/91/66/06/459916606.db2.gz	PBINMUPQJLSCSZ-UHFFFAOYSA-N	0	3	346.434	3.156	20	30		EGEDHN
C=CCC1(NC(=O)[C@H]2CCCN(Cc3ccccc3)C2)CCOCC1	ZINC000618246963	459939264	/nfs/dbraw/zinc/93/92/64/459939264.db2.gz	FDXUAUILASXNKC-IBGZPJMESA-N	0	3	342.483	3.140	20	30		EGEDHN
CN(Cc1ccc(Br)s1)C[C@H](O)CC(C)(C)C#N	ZINC000598588168	459954588	/nfs/dbraw/zinc/95/45/88/459954588.db2.gz	ZRJSJAPYDLOCJB-SNVBAGLBSA-N	0	3	331.279	3.243	20	30		EGEDHN
N#Cc1cccc(CN2CCC(NCc3ccc(C#N)cc3F)CC2)c1	ZINC000593693155	459954668	/nfs/dbraw/zinc/95/46/68/459954668.db2.gz	QYWYIJKQTKBCNM-UHFFFAOYSA-N	0	3	348.425	3.323	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN(CCO)Cc1ccc(Cl)c(Cl)c1	ZINC000598601246	459959620	/nfs/dbraw/zinc/95/96/20/459959620.db2.gz	RVFDWPDGGAZZAK-ZDUSSCGKSA-N	0	3	345.270	3.088	20	30		EGEDHN
CCCN(C)[C@@H](CNC(=O)NCC1(C#N)CC1)c1ccc(Cl)cc1	ZINC000588670061	459964161	/nfs/dbraw/zinc/96/41/61/459964161.db2.gz	MOBQBOOVJNKFMH-INIZCTEOSA-N	0	3	348.878	3.326	20	30		EGEDHN
CCn1ccnc1[C@H](C)NC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000593726380	459965130	/nfs/dbraw/zinc/96/51/30/459965130.db2.gz	ZNPXXHVRIJFKHG-INIZCTEOSA-N	0	3	337.471	3.090	20	30		EGEDHN
C[C@H](CC1(C#N)CCOCC1)NCc1ccccc1Cn1cccn1	ZINC000602501089	459970727	/nfs/dbraw/zinc/97/07/27/459970727.db2.gz	DHDZNKUEOBUXIL-QGZVFWFLSA-N	0	3	338.455	3.120	20	30		EGEDHN
Cc1nn(-c2ccccc2)cc1CCCNCc1cccc(C#N)n1	ZINC000602519580	459980196	/nfs/dbraw/zinc/98/01/96/459980196.db2.gz	AIGWIRIQAHCAAN-UHFFFAOYSA-N	0	3	331.423	3.170	20	30		EGEDHN
CCN(CC)[C@@H](CN[C@H](C)CC1(C#N)CCOCC1)c1ccco1	ZINC000602525945	459982997	/nfs/dbraw/zinc/98/29/97/459982997.db2.gz	UFCRTTDPGYBENB-SJORKVTESA-N	0	3	333.476	3.351	20	30		EGEDHN
COc1cc(CNC[C@@H](CO)c2ccc(Cl)cc2)ccc1C#N	ZINC000588929919	460006802	/nfs/dbraw/zinc/00/68/02/460006802.db2.gz	CZOFJCBQFNOTBP-INIZCTEOSA-N	0	3	330.815	3.086	20	30		EGEDHN
C[C@H](CCC#N)CN[C@H]1CCN(c2ccccc2C(F)(F)F)C1=O	ZINC000602616372	460023543	/nfs/dbraw/zinc/02/35/43/460023543.db2.gz	NAJRYSDCEOHJAA-OCCSQVGLSA-N	0	3	339.361	3.340	20	30		EGEDHN
CC[C@H](CN1CCCC1)NC(=O)Nc1cc(C#N)cn1C(C)(C)C	ZINC000609839772	460027666	/nfs/dbraw/zinc/02/76/66/460027666.db2.gz	PIDCFMVPFGNNJJ-OAHLLOKOSA-N	0	3	331.464	3.111	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN(C)[C@H]1CC[C@@H](C(F)(F)F)CC1	ZINC000575901440	460029680	/nfs/dbraw/zinc/02/96/80/460029680.db2.gz	KWFQVRLIPRDMJF-MCIONIFRSA-N	0	3	333.398	3.047	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)C(=O)NC[C@@H](C)N(C)Cc1ccccc1	ZINC000593974819	460035905	/nfs/dbraw/zinc/03/59/05/460035905.db2.gz	GTNNAELAQORXNM-QZTJIDSGSA-N	0	3	349.478	3.374	20	30		EGEDHN
CN(C)CCN(Cc1nn(C)c2ccccc12)Cc1ccc(C#N)cc1	ZINC000589194441	460050448	/nfs/dbraw/zinc/05/04/48/460050448.db2.gz	BSHFZEQXHFEGCU-UHFFFAOYSA-N	0	3	347.466	3.009	20	30		EGEDHN
COCCOCc1ccc(CN[C@H](C)CC2(C#N)CCOCC2)cc1	ZINC000602678719	460061350	/nfs/dbraw/zinc/06/13/50/460061350.db2.gz	XZRIVMUQXKJQGU-QGZVFWFLSA-N	0	3	346.471	3.038	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2NCCOCC(F)(F)C(F)F	ZINC000618577765	460070224	/nfs/dbraw/zinc/07/02/24/460070224.db2.gz	HCMNMMCWPKGMQZ-AWEZNQCLSA-N	0	3	330.325	3.442	20	30		EGEDHN
Cc1cccc(C)c1OC[C@H](O)CN[C@H]1CCc2ccc(C#N)cc21	ZINC000589338045	460075695	/nfs/dbraw/zinc/07/56/95/460075695.db2.gz	PYNXVRIEMCEFIH-QUCCMNQESA-N	0	3	336.435	3.192	20	30		EGEDHN
C[C@H]1c2ccccc2OCCN1C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000598894085	460087812	/nfs/dbraw/zinc/08/78/12/460087812.db2.gz	QMKYNLAHBCCPGX-YJBOKZPZSA-N	0	3	345.402	3.223	20	30		EGEDHN
C=CCOc1c(Cl)cc(CNC[C@](C)(O)CSC)cc1OC	ZINC000598965973	460107163	/nfs/dbraw/zinc/10/71/63/460107163.db2.gz	QHJCFGQLXCYDPA-INIZCTEOSA-N	0	3	345.892	3.117	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2sc3ccc(C#N)cc3c2C)CC1	ZINC000576372146	460128462	/nfs/dbraw/zinc/12/84/62/460128462.db2.gz	HEVYGVYAVCGZSR-UHFFFAOYSA-N	0	3	339.464	3.462	20	30		EGEDHN
Cc1ccccc1[C@H]([C@@H](C)NC(=O)Nc1cccc(C#N)n1)N(C)C	ZINC000576634800	460182342	/nfs/dbraw/zinc/18/23/42/460182342.db2.gz	JDVKPJWDXBYQMQ-KDOFPFPSSA-N	0	3	337.427	3.075	20	30		EGEDHN
C=CCCCCNCCS(=O)(=O)c1cccc(Br)c1	ZINC000576698014	460196562	/nfs/dbraw/zinc/19/65/62/460196562.db2.gz	OIPFYHQVPONSSX-UHFFFAOYSA-N	0	3	346.290	3.169	20	30		EGEDHN
CCC(C)(C)N1CCN(C(=O)C[C@H](CC#N)c2ccccc2)CC1	ZINC000594390326	460203113	/nfs/dbraw/zinc/20/31/13/460203113.db2.gz	UZYDYJIMFXVELP-SFHVURJKSA-N	0	3	327.472	3.407	20	30		EGEDHN
CC(C)[C@H](C(=O)N[C@@H]1CCc2cc(C#N)ccc21)N1CCCCC1	ZINC000618892796	460211153	/nfs/dbraw/zinc/21/11/53/460211153.db2.gz	QGEWINGRNHAENA-RTBURBONSA-N	0	3	325.456	3.172	20	30		EGEDHN
C[C@H]1CN(C(=O)[C@H](N)CCCCC#N)CCc2ccc(Cl)cc21	ZINC000594452193	460224834	/nfs/dbraw/zinc/22/48/34/460224834.db2.gz	DVFZEAQCYXWNGQ-SUMWQHHRSA-N	0	3	333.863	3.239	20	30		EGEDHN
CC(C)(NC[C@H](O)COc1ccccc1C#N)c1ccc(F)c(F)c1	ZINC000599357788	460238029	/nfs/dbraw/zinc/23/80/29/460238029.db2.gz	YUVXMYXEHXMYQW-HNNXBMFYSA-N	0	3	346.377	3.101	20	30		EGEDHN
CSc1ccc([C@H](C)NC[C@H](O)COc2ccccc2C#N)cc1	ZINC000599397576	460246784	/nfs/dbraw/zinc/24/67/84/460246784.db2.gz	RCTJEQCDBMPNCO-YOEHRIQHSA-N	0	3	342.464	3.371	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccnc(C#N)c1	ZINC000603130525	460249904	/nfs/dbraw/zinc/24/99/04/460249904.db2.gz	QNSWFJOSRIALLQ-MRXNPFEDSA-N	0	3	349.438	3.082	20	30		EGEDHN
CCc1ccc(C2CCN([C@H](C)C(=O)N(C)CCC#N)CC2)cc1	ZINC000599668969	460303892	/nfs/dbraw/zinc/30/38/92/460303892.db2.gz	JORXJDKVUPVIGY-MRXNPFEDSA-N	0	3	327.472	3.189	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Nc1cccc(N)c1C)C(C)C	ZINC000625922021	460304783	/nfs/dbraw/zinc/30/47/83/460304783.db2.gz	HJPHVVZJTVRDGY-SFHVURJKSA-N	0	3	330.476	3.397	20	30		EGEDHN
Cc1ccc2c(c1)[C@H](NC(=O)C(C#N)Cc1ccc(C#N)cc1)CC2	ZINC000619285419	460320798	/nfs/dbraw/zinc/32/07/98/460320798.db2.gz	SZVCLMSXTTYJBZ-UYAOXDASSA-N	0	3	329.403	3.353	20	30		EGEDHN
CC(C)(CCC#N)CN1CCN([C@@H](CO)c2ccc(Cl)cc2)CC1	ZINC000611271081	460323930	/nfs/dbraw/zinc/32/39/30/460323930.db2.gz	UXRIYPPFVQZFCC-SFHVURJKSA-N	0	3	349.906	3.321	20	30		EGEDHN
C[C@H](NC[C@@H](O)COCc1ccccc1Cl)c1cccc(C#N)c1	ZINC000611388205	460351937	/nfs/dbraw/zinc/35/19/37/460351937.db2.gz	LELLKQZNPGUNJC-KBXCAEBGSA-N	0	3	344.842	3.440	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000611393760	460354071	/nfs/dbraw/zinc/35/40/71/460354071.db2.gz	VULDIWFSBIULTL-LEWJYISDSA-N	0	3	345.446	3.326	20	30		EGEDHN
N#CCC[C@H](NC[C@@H](O)COc1ccc(F)cc1)c1ccccc1	ZINC000611406932	460357087	/nfs/dbraw/zinc/35/70/87/460357087.db2.gz	CLKHUFPQMWKFRK-MJGOQNOKSA-N	0	3	328.387	3.200	20	30		EGEDHN
N#Cc1ccc2c(c1)CCCC[C@@H]2NC[C@@H](O)COc1ccccc1	ZINC000619508173	460371508	/nfs/dbraw/zinc/37/15/08/460371508.db2.gz	FOSQGBVUCCSYDQ-NQIIRXRSSA-N	0	3	336.435	3.355	20	30		EGEDHN
CC(C)CN(CCc1ccc(F)cc1)CC(=O)N[C@](C)(C#N)C(C)C	ZINC000604493539	460434884	/nfs/dbraw/zinc/43/48/84/460434884.db2.gz	CKIRHYFDGRDOLM-HXUWFJFHSA-N	0	3	347.478	3.381	20	30		EGEDHN
CCO[C@@H]1C[C@H](N[C@H]2CCCc3cc(C#N)ccc32)[C@@]12CCCO2	ZINC000612829036	460744916	/nfs/dbraw/zinc/74/49/16/460744916.db2.gz	HAVZQHVTPLMTLK-HAGHYFMRSA-N	0	3	326.440	3.252	20	30		EGEDHN
COc1cc(CN(C)C)ccc1NC(=O)[C@]1(C#N)CC12CCCC2	ZINC000601621983	460849337	/nfs/dbraw/zinc/84/93/37/460849337.db2.gz	QMAZQSDQFIRFQA-LJQANCHMSA-N	0	3	327.428	3.169	20	30		EGEDHN
Cc1cccc(CN2CC[C@@H](NC(=O)c3ccc(CC#N)cc3)C2)c1	ZINC000601849901	460924985	/nfs/dbraw/zinc/92/49/85/460924985.db2.gz	LXWVLELWWPGBDJ-HXUWFJFHSA-N	0	3	333.435	3.065	20	30		EGEDHN
Cc1cccc(CN2CC[C@H](NC(=O)CCc3ccc(C#N)cc3)C2)c1	ZINC000601852428	460926540	/nfs/dbraw/zinc/92/65/40/460926540.db2.gz	ZJHYZYNUTJLCPE-NRFANRHFSA-N	0	3	347.462	3.190	20	30		EGEDHN
C[C@H](c1ccccc1)[C@H](CO)NCc1ccc(C#N)cc1OC(F)F	ZINC000613389297	460931979	/nfs/dbraw/zinc/93/19/79/460931979.db2.gz	HWBJRYHNKYNSEE-DYVFJYSZSA-N	0	3	346.377	3.414	20	30		EGEDHN
Cc1ccc(CN2CC[C@H](NC(=O)CCc3ccc(C#N)cc3)C2)cc1	ZINC000601879423	460933460	/nfs/dbraw/zinc/93/34/60/460933460.db2.gz	HHRCVQZCBOLNTI-NRFANRHFSA-N	0	3	347.462	3.190	20	30		EGEDHN
C=CC[C@@H]1CCCN(C(=O)[C@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000617785277	460976301	/nfs/dbraw/zinc/97/63/01/460976301.db2.gz	IGCSLAQHZYMWGX-MJGOQNOKSA-N	0	3	327.472	3.108	20	30		EGEDHN
C=CCn1c([C@@H]2CCCCO2)nnc1N1CCN(C(C)(C)CC)CC1	ZINC000655614892	461331246	/nfs/dbraw/zinc/33/12/46/461331246.db2.gz	FMJXKVSMQKAQGQ-INIZCTEOSA-N	0	3	347.507	3.016	20	30		EGEDHN
C=C(C)[C@@H](NC1CCN([C@H]2CCOC2)CC1)c1ccc(F)c(F)c1	ZINC000655757651	461423968	/nfs/dbraw/zinc/42/39/68/461423968.db2.gz	WLWNBFVNAOIFPK-QFBILLFUSA-N	0	3	336.426	3.425	20	30		EGEDHN
C=CC[C@@H]1CCCN(C(=O)Nc2cc(C)nn2C2CCN(C)CC2)C1	ZINC000666283431	461547020	/nfs/dbraw/zinc/54/70/20/461547020.db2.gz	SNFABOPULYPTKG-MRXNPFEDSA-N	0	3	345.491	3.278	20	30		EGEDHN
C=CC[C@@H]1CCCN(C(=O)NCc2ccccc2OCCN(C)C)C1	ZINC000660513620	461825295	/nfs/dbraw/zinc/82/52/95/461825295.db2.gz	UVOUASMYFFIHPD-QGZVFWFLSA-N	0	3	345.487	3.125	20	30		EGEDHN
C=CCN1CCC(Nc2nc(C(F)F)nc3ccc(F)cc32)CC1	ZINC000647867150	461863684	/nfs/dbraw/zinc/86/36/84/461863684.db2.gz	ALHOHFXFNPSRGU-UHFFFAOYSA-N	0	3	336.361	3.191	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](CC)Cc2ccc(F)cc2)CC1	ZINC000660600706	461873562	/nfs/dbraw/zinc/87/35/62/461873562.db2.gz	VUQBQXHHJDXCPM-SFHVURJKSA-N	0	3	347.478	3.487	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCc2cccc3ccsc32)CC1	ZINC000650852806	461983335	/nfs/dbraw/zinc/98/33/35/461983335.db2.gz	RNAMXTWKTCVROI-UHFFFAOYSA-N	0	3	329.469	3.351	20	30		EGEDHN
C=CCN(CCC(=O)Nc1ccc(OC)c(Cl)c1)[C@@H](C)COC	ZINC000661242328	462166398	/nfs/dbraw/zinc/16/63/98/462166398.db2.gz	NHJDDGIINWFIPU-ZDUSSCGKSA-N	0	3	340.851	3.200	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NC(=O)N(CCC)[C@@H]1CCN(C)C1	ZINC000645550710	462369986	/nfs/dbraw/zinc/36/99/86/462369986.db2.gz	VIVKBQSXZZGWNG-RTBURBONSA-N	0	3	329.488	3.300	20	30		EGEDHN
N#Cc1ccccc1NC(=O)CCN1CCC(c2ccncc2)CC1	ZINC000191615049	534817635	/nfs/dbraw/zinc/81/76/35/534817635.db2.gz	HWNBEHGXNPUODM-UHFFFAOYSA-N	0	3	334.423	3.161	20	30		EGEDHN
C=CCN1CCC(NC(=O)C(C)(C)Oc2ccc(Cl)cc2)CC1	ZINC000171720536	526419873	/nfs/dbraw/zinc/41/98/73/526419873.db2.gz	HIFVWFAXPGVSAM-UHFFFAOYSA-N	0	3	336.863	3.264	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)[C@H](C)c2ccc(OC)cc2)CC1	ZINC000171739537	526424382	/nfs/dbraw/zinc/42/43/82/526424382.db2.gz	GGOQJPNMHPJLSS-OAHLLOKOSA-N	0	3	331.460	3.048	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(Cc2ccc(F)cc2F)C2CC2)CC1	ZINC000171741208	526425363	/nfs/dbraw/zinc/42/53/63/526425363.db2.gz	JGMZNEIRMRRXOD-UHFFFAOYSA-N	0	3	349.425	3.289	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(N(C)C(C)C)c(F)c2)CC1	ZINC000171737617	526441746	/nfs/dbraw/zinc/44/17/46/526441746.db2.gz	NPLUSWWONPIGEV-UHFFFAOYSA-N	0	3	348.466	3.442	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@@H](C)Oc2cccc(C(C)C)c2)CC1	ZINC000171717885	526442526	/nfs/dbraw/zinc/44/25/26/526442526.db2.gz	ZBAVYNNPQVNMND-MRXNPFEDSA-N	0	3	330.472	3.344	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(C)nc3onc(C(C)C)c32)CC1	ZINC000171714465	526445946	/nfs/dbraw/zinc/44/59/46/526445946.db2.gz	HPNXVUSSIQJKKO-UHFFFAOYSA-N	0	3	342.443	3.035	20	30		EGEDHN
C=C(C)CN1CCC(N[C@@H](c2ncc[nH]2)c2ccc(F)cc2)CC1	ZINC000187977741	526603658	/nfs/dbraw/zinc/60/36/58/526603658.db2.gz	JQTMTKLTDMDVDW-GOSISDBHSA-N	0	3	328.435	3.268	20	30		EGEDHN
CC(C)(C)CN(CC#Cc1ccc(OC(F)(F)F)cc1)CCO	ZINC000676559020	549109242	/nfs/dbraw/zinc/10/92/42/549109242.db2.gz	WWCGEMRDSDEIID-UHFFFAOYSA-N	0	3	329.362	3.277	20	30		EGEDHN
COc1cccc(O)c1/C=N\CCc1ccc(OCCN(C)C)cc1	ZINC000729150067	574818936	/nfs/dbraw/zinc/81/89/36/574818936.db2.gz	QPJCPCFEJIWIHB-QNGOZBTKSA-N	0	3	342.439	3.003	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(-c3ccc(F)cc3)n2C)CC1	ZINC000729976955	574900683	/nfs/dbraw/zinc/90/06/83/574900683.db2.gz	GDVVBJYQQLEYPV-UHFFFAOYSA-N	0	3	341.430	3.211	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(CCc2ccccc2)C2CC2)CC1	ZINC000730066087	574918247	/nfs/dbraw/zinc/91/82/47/574918247.db2.gz	DIIQKLVPWOMURI-UHFFFAOYSA-N	0	3	341.499	3.444	20	30		EGEDHN
C#CCOc1ccc(NC(=O)N2CCCN(C(C)(C)C)CC2)cc1	ZINC000731114734	575055428	/nfs/dbraw/zinc/05/54/28/575055428.db2.gz	LPMCAWFDGMLKBZ-UHFFFAOYSA-N	0	3	329.444	3.037	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1SCc1cscn1	ZINC000732739173	575285691	/nfs/dbraw/zinc/28/56/91/575285691.db2.gz	RBRIWWPJKFOWCR-UHFFFAOYSA-N	0	3	349.529	3.241	20	30		EGEDHN
N#CCC[C@H](C#N)CNC1CCN(c2ccc(OC(F)F)cc2)CC1	ZINC000732919588	575296273	/nfs/dbraw/zinc/29/62/73/575296273.db2.gz	MTYIWLGHUZOZNS-CQSZACIVSA-N	0	3	348.397	3.290	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)CO[C@H]2CCCC[C@H]2C)cc1	ZINC000733678871	575381304	/nfs/dbraw/zinc/38/13/04/575381304.db2.gz	MLXAECFQWSBDGH-BJZITVGISA-N	0	3	342.439	3.492	20	30		EGEDHN
CC(C)n1ccc(C(=O)C(C#N)C(=O)Nc2ccc(F)c(Cl)c2)n1	ZINC000733678739	575381348	/nfs/dbraw/zinc/38/13/48/575381348.db2.gz	IBRYDFQUAFEFNM-LLVKDONJSA-N	0	3	348.765	3.218	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)CCOCC(F)(F)F)nc21	ZINC000735789882	575713456	/nfs/dbraw/zinc/71/34/56/575713456.db2.gz	SWZHOLHZXNDTMW-SNVBAGLBSA-N	0	3	325.290	3.017	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2oc3c(cccc3F)c2C)CC1	ZINC000740736482	576621665	/nfs/dbraw/zinc/62/16/65/576621665.db2.gz	WCJKMYDIUOWVEX-UHFFFAOYSA-N	0	3	328.387	3.098	20	30		EGEDHN
C#CCCN1CCC(NC(=O)[C@@H](C)Oc2cc(C)ccc2Cl)CC1	ZINC000740738806	576622010	/nfs/dbraw/zinc/62/20/10/576622010.db2.gz	NJVMTOUQANTMKE-OAHLLOKOSA-N	0	3	348.874	3.020	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2ccc3[nH]c4c(c3c2)CCCC4)CC1	ZINC000740737686	576622058	/nfs/dbraw/zinc/62/20/58/576622058.db2.gz	JAJLWPOFBHWUCW-UHFFFAOYSA-N	0	3	349.478	3.264	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1	ZINC000741532504	576697675	/nfs/dbraw/zinc/69/76/75/576697675.db2.gz	ZXIRQNGSCQZHRM-OAQYLSRUSA-N	0	3	348.446	3.266	20	30		EGEDHN
Cc1ccc([C@H](C)C(=O)N(CCN(C)C)Cc2cccc(C#N)c2)o1	ZINC000742593171	576791210	/nfs/dbraw/zinc/79/12/10/576791210.db2.gz	LVXKFRPAQYOANL-INIZCTEOSA-N	0	3	339.439	3.154	20	30		EGEDHN
C[C@@H]1CN(CC(=O)C(C#N)c2nc3ccccc3s2)C[C@H](C)S1	ZINC000744413026	576827726	/nfs/dbraw/zinc/82/77/26/576827726.db2.gz	MCMBGQCUAWFDKS-FRRDWIJNSA-N	0	3	345.493	3.298	20	30		EGEDHN
C=CCN(CCc1ccccc1)C(=O)NC[C@@H](C)N1CCCCC1	ZINC000744855201	576835606	/nfs/dbraw/zinc/83/56/06/576835606.db2.gz	ZPPWPBGLGRRSKD-GOSISDBHSA-N	0	3	329.488	3.301	20	30		EGEDHN
CN(CCC#N)c1ccc(CNCc2ccc([S@](C)=O)cc2)cc1	ZINC000751152784	1299516293	/nfs/dbraw/zinc/51/62/93/1299516293.db2.gz	PBOZGFKOVRUKJG-DEOSSOPVSA-N	0	3	341.480	3.064	20	30		EGEDHN
Cc1ccc(OCCC(=O)C(C#N)C(=O)NC2CCCCC2)c(C)c1	ZINC000050683895	1291656143	/nfs/dbraw/zinc/65/61/43/1291656143.db2.gz	TUPXPZZIMZNJPD-QGZVFWFLSA-N	0	3	342.439	3.230	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc3[nH]c(CCCC)nc3c2)CC1	ZINC000068258828	1292194743	/nfs/dbraw/zinc/19/47/43/1292194743.db2.gz	YMNSUXBTBNHUNC-UHFFFAOYSA-N	0	3	338.455	3.189	20	30		EGEDHN
C#Cc1cnc(NC[C@H](c2cccc(C(F)(F)F)c2)N(C)C)nc1	ZINC000827932420	1292405696	/nfs/dbraw/zinc/40/56/96/1292405696.db2.gz	NSDMKJQKDPFWCN-OAHLLOKOSA-N	0	3	334.345	3.192	20	30		EGEDHN
COC(=O)N[C@@H](CC(C)C)C(=O)C(C#N)c1nc(C(C)C)cs1	ZINC000080459857	1292604042	/nfs/dbraw/zinc/60/40/42/1292604042.db2.gz	RDIXCUWLZNKPDB-NEPJUHHUSA-N	0	3	337.445	3.213	20	30		EGEDHN
COc1ccc(NC(=O)c2cccc(CN3CCCC3)c2)cc1C#N	ZINC000830420964	1292718924	/nfs/dbraw/zinc/71/89/24/1292718924.db2.gz	WTIHSYQAFGLAAV-UHFFFAOYSA-N	0	3	335.407	3.415	20	30		EGEDHN
CN(C)C(=O)O[C@@H]1CCN(Cc2ccc(-c3ccccc3C#N)cc2)C1	ZINC000830503856	1292725111	/nfs/dbraw/zinc/72/51/11/1292725111.db2.gz	AMCYJNXFXSHREW-LJQANCHMSA-N	0	3	349.434	3.498	20	30		EGEDHN
C#CCOc1ccc(CN2CCC[C@@H](CNC(=O)C(C)(C)C)C2)cc1	ZINC000093281709	1292914367	/nfs/dbraw/zinc/91/43/67/1292914367.db2.gz	FCGFPVKFQGHNKA-SFHVURJKSA-N	0	3	342.483	3.073	20	30		EGEDHN
CCO[C@@H]1CCC[C@H]1NCC(=O)N(CCC#N)c1ccc(C)c(C)c1	ZINC000832571152	1293023819	/nfs/dbraw/zinc/02/38/19/1293023819.db2.gz	XYLWZMBIRQOXJG-RTBURBONSA-N	0	3	343.471	3.097	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC(C)(C)c2ccc(F)cc2)CC1	ZINC000106338862	1293049273	/nfs/dbraw/zinc/04/92/73/1293049273.db2.gz	FYDQKGMUHMKCMI-UHFFFAOYSA-N	0	3	333.451	3.401	20	30		EGEDHN
N#Cc1ccc(CN[C@@H](Cc2ccccc2Cl)[C@@H]2CCCO2)nc1	ZINC000834773930	1293145951	/nfs/dbraw/zinc/14/59/51/1293145951.db2.gz	LSCGLALTUKGHCH-OALUTQOASA-N	0	3	341.842	3.487	20	30		EGEDHN
CC[C@H](C#N)Oc1cccc(CNCc2cnc3c(c2)c(C)nn3C)c1	ZINC000113960866	1293159835	/nfs/dbraw/zinc/15/98/35/1293159835.db2.gz	MYPZYIHODOYBEJ-QGZVFWFLSA-N	0	3	349.438	3.248	20	30		EGEDHN
C#CCSCCOC(=O)C1(C)CCN(Cc2ccccc2)CC1	ZINC000835436573	1293291163	/nfs/dbraw/zinc/29/11/63/1293291163.db2.gz	HIKWNCNUQIXRGR-UHFFFAOYSA-N	0	3	331.481	3.198	20	30		EGEDHN
C[C@@H]1[C@H](OC(=O)c2ccc(C#N)n2C)CCCN1Cc1ccccc1	ZINC000835480408	1293300350	/nfs/dbraw/zinc/30/03/50/1293300350.db2.gz	IMRJXRWPAATPMA-DNVCBOLYSA-N	0	3	337.423	3.107	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)CSCCC(C)C	ZINC000121342829	1293367099	/nfs/dbraw/zinc/36/70/99/1293367099.db2.gz	FYFUTJRVRVIBIX-ZDUSSCGKSA-N	0	3	334.441	3.122	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1)C(=O)c1coc(-c2ccccc2)n1	ZINC000121690841	1293384028	/nfs/dbraw/zinc/38/40/28/1293384028.db2.gz	QZHRESBQICEULV-HNNXBMFYSA-N	0	3	331.331	3.303	20	30		EGEDHN
CC[C@H](C)c1ccc(NC(=O)C(C#N)C(=O)[C@@H]2CCCCO2)cc1	ZINC000122006330	1293399549	/nfs/dbraw/zinc/39/95/49/1293399549.db2.gz	GIASDGOEQPKIHM-XKQJLSEDSA-N	0	3	328.412	3.417	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000836191898	1293457770	/nfs/dbraw/zinc/45/77/70/1293457770.db2.gz	AHKMJGMKRCFTTK-CYBMUJFWSA-N	0	3	341.377	3.021	20	30		EGEDHN
C=CCn1c2ccccc2n(CN2CCN(CC3CC3)CC2)c1=S	ZINC000124218269	1293470478	/nfs/dbraw/zinc/47/04/78/1293470478.db2.gz	VLGAPDGFTUBOCT-UHFFFAOYSA-N	0	3	342.512	3.343	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)[C@@H](C)Oc2ccccc2)cc1	ZINC000128380543	1293591184	/nfs/dbraw/zinc/59/11/84/1293591184.db2.gz	UNPBCIHCHSPHFL-KDOFPFPSSA-N	0	3	336.391	3.364	20	30		EGEDHN
CC(C)OCCC(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000129782068	1293634405	/nfs/dbraw/zinc/63/44/05/1293634405.db2.gz	ISPLMAYHSTZFKR-NSHDSACASA-N	0	3	343.210	3.456	20	30		EGEDHN
CNC(=O)C(C#N)C(=O)CSc1cccc2cccc(Cl)c21	ZINC000133381837	1293742874	/nfs/dbraw/zinc/74/28/74/1293742874.db2.gz	XYEMQKMADVLQPN-LLVKDONJSA-N	0	3	332.812	3.040	20	30		EGEDHN
C[C@@H](C(=O)C(C#N)C(=O)Nc1ccccc1)c1c(F)cccc1F	ZINC000153292954	1294007184	/nfs/dbraw/zinc/00/71/84/1294007184.db2.gz	CVOCIMDYRQRNNC-YPMHNXCESA-N	0	3	328.318	3.416	20	30		EGEDHN
C[C@H](C(=O)C(C#N)C(=O)Nc1ccccc1)c1c(F)cccc1F	ZINC000153292655	1294007352	/nfs/dbraw/zinc/00/73/52/1294007352.db2.gz	CVOCIMDYRQRNNC-WCQYABFASA-N	0	3	328.318	3.416	20	30		EGEDHN
C#CCOc1ccc(NC(=O)N(CCN(C)C)C2CCCC2)cc1	ZINC000153663932	1294024402	/nfs/dbraw/zinc/02/44/02/1294024402.db2.gz	IQWOLVQKQDSFDY-UHFFFAOYSA-N	0	3	329.444	3.037	20	30		EGEDHN
CC(C)Oc1ccccc1CC(=O)C(C#N)C(=O)NC1CCCCC1	ZINC000155465271	1294099406	/nfs/dbraw/zinc/09/94/06/1294099406.db2.gz	LRPYBINAGFPSHQ-QGZVFWFLSA-N	0	3	342.439	3.174	20	30		EGEDHN
Cc1oc(-c2ccco2)nc1CC(=O)C(C#N)C(=O)Nc1ccccc1	ZINC000159764839	1294246417	/nfs/dbraw/zinc/24/64/17/1294246417.db2.gz	PDNVSWHGURZEKZ-AWEZNQCLSA-N	0	3	349.346	3.133	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)[C@@H]2CCCOC2)cc1	ZINC000171036267	1294390667	/nfs/dbraw/zinc/39/06/67/1294390667.db2.gz	NYDSFGYWNAFDNC-WBVHZDCISA-N	0	3	328.412	3.103	20	30		EGEDHN
C#CCCOc1ccc(CNCc2ccc(Cn3cncn3)cc2)cc1	ZINC000172113180	1294429050	/nfs/dbraw/zinc/42/90/50/1294429050.db2.gz	HRFFHJJIEJQXDG-UHFFFAOYSA-N	0	3	346.434	3.018	20	30		EGEDHN
Cc1ccc(N(CCC#N)C(=O)[C@H](C)N2C[C@@H]3[C@H](C2)C3(C)C)cc1	ZINC000172951497	1294451121	/nfs/dbraw/zinc/45/11/21/1294451121.db2.gz	YQCWOYSQZXMJDM-RYQLBKOJSA-N	0	3	325.456	3.218	20	30		EGEDHN
COc1ccc([C@H](C)CC(=O)C(C#N)C(=O)NC2CCCCC2)cc1	ZINC000175103603	1294538168	/nfs/dbraw/zinc/53/81/68/1294538168.db2.gz	PRYXCNZNFBKTSN-RDTXWAMCSA-N	0	3	342.439	3.347	20	30		EGEDHN
C[C@@H](C(=O)C(C#N)C(=O)Nc1ccccn1)c1ccc(Cl)s1	ZINC000175121566	1294540080	/nfs/dbraw/zinc/54/00/80/1294540080.db2.gz	JQENCPVMQIQJCX-ZJUUUORDSA-N	0	3	333.800	3.248	20	30		EGEDHN
CCCCNC(=O)C1CCN(Cc2ccc(O[C@H](C)C#N)cc2)CC1	ZINC000179330169	1294786632	/nfs/dbraw/zinc/78/66/32/1294786632.db2.gz	DTXPOSWTKXRTEL-MRXNPFEDSA-N	0	3	343.471	3.106	20	30		EGEDHN
CC(C)N1CCN(c2ccc(C(=O)O[C@H](C)C(C)(C)C#N)cc2)CC1	ZINC000183719981	1295139281	/nfs/dbraw/zinc/13/92/81/1295139281.db2.gz	UHXSKCUWHOBGSL-MRXNPFEDSA-N	0	3	343.471	3.312	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@H](NCC#Cc1ccc(F)cc1)C1CC1	ZINC000185194362	1295246889	/nfs/dbraw/zinc/24/68/89/1295246889.db2.gz	SLYWPOYUVIOJCK-KRWDZBQOSA-N	0	3	332.419	3.070	20	30		EGEDHN
CCc1ccc(C(=O)C(C#N)C(=O)Nc2ccccc2OC)s1	ZINC000193470532	1295873020	/nfs/dbraw/zinc/87/30/20/1295873020.db2.gz	YNPRMMCAFOKKAS-GFCCVEGCSA-N	0	3	328.393	3.280	20	30		EGEDHN
N#CC(C(=O)C[C@@H]1CCCO1)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000193481696	1295874736	/nfs/dbraw/zinc/87/47/36/1295874736.db2.gz	BLNOFRFBYMPTLO-QWHCGFSZSA-N	0	3	341.194	3.210	20	30		EGEDHN
C=CCN(Cc1cc(Br)ccc1F)C(=O)[C@@H](N)CCC	ZINC000236794252	1296203110	/nfs/dbraw/zinc/20/31/10/1296203110.db2.gz	AYIRYJVQTPECEN-AWEZNQCLSA-N	0	3	343.240	3.230	20	30		EGEDHN
N#CC(C(=O)NC1CC1)C(=O)[C@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1	ZINC000246484426	1296355717	/nfs/dbraw/zinc/35/57/17/1296355717.db2.gz	CUBQFLDMAWAUPT-RDBSUJKOSA-N	0	3	337.206	3.084	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]\CCC(=O)N2CCCCCC2)c([O-])c1	ZINC000255556060	1296546726	/nfs/dbraw/zinc/54/67/26/1296546726.db2.gz	MOKKKDXPOMOWLR-PGMHBOJBSA-N	0	3	345.487	3.450	20	30		EGEDHN
COc1cccc([C@@H](C/N=C\c2cccc(OC)c2O)N(C)C)c1	ZINC000255761719	1296565968	/nfs/dbraw/zinc/56/59/68/1296565968.db2.gz	RYJJDMYRBGVPMC-SYERDGIWSA-N	0	3	328.412	3.131	20	30		EGEDHN
C[C@H](NC1CCN(c2ccc(C#N)cn2)CC1)c1cc(O)ccc1F	ZINC000872032481	1296682081	/nfs/dbraw/zinc/68/20/81/1296682081.db2.gz	UXFGQWAKRSTILU-ZDUSSCGKSA-N	0	3	340.402	3.118	20	30		EGEDHN
C#CCCOc1ccc(CNC[C@H](O)c2c(F)cccc2F)cc1	ZINC000304310355	1296915532	/nfs/dbraw/zinc/91/55/32/1296915532.db2.gz	QQOOATXQFBMXCR-SFHVURJKSA-N	0	3	331.362	3.190	20	30		EGEDHN
C[C@H](CN(C)C(=O)OC(C)(C)C)NC1CC(C#N)(c2ccccc2)C1	ZINC000701889609	1298188854	/nfs/dbraw/zinc/18/88/54/1298188854.db2.gz	GAODEICLUHSZQX-XRTORIHISA-N	0	3	343.471	3.455	20	30		EGEDHN
C=CCC1(O)CCN(CCOc2ccc(Br)cc2)CC1	ZINC000717471124	1298303144	/nfs/dbraw/zinc/30/31/44/1298303144.db2.gz	JYJDEBIYHPIGIC-UHFFFAOYSA-N	0	3	340.261	3.231	20	30		EGEDHN
C[C@H]1CCN(C(=O)C#Cc2ccccc2)CCN1Cc1ccccc1	ZINC000747411289	1298777286	/nfs/dbraw/zinc/77/72/86/1298777286.db2.gz	BCZYIBNONBBPCD-IBGZPJMESA-N	0	3	332.447	3.161	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cccnc2Oc2ccccc2)CC1	ZINC000747639393	1298815236	/nfs/dbraw/zinc/81/52/36/1298815236.db2.gz	MJCXHPHZKUEARZ-UHFFFAOYSA-N	0	3	335.407	3.158	20	30		EGEDHN
COc1cccc(O)c1/C=N\C1CCN([C@@H](C)c2ccncc2)CC1	ZINC000747689927	1298831664	/nfs/dbraw/zinc/83/16/64/1298831664.db2.gz	BBUOAAOCQOWJJF-HSMAQGNYSA-N	0	3	339.439	3.440	20	30		EGEDHN
N#CCCN(CC(=O)C(C#N)c1nc2ccccc2s1)CC1CC1	ZINC000747961494	1298900131	/nfs/dbraw/zinc/90/01/31/1298900131.db2.gz	OQUMEQKCIYMHEL-CQSZACIVSA-N	0	3	338.436	3.098	20	30		EGEDHN
C=CCOc1ccc(/C=C/C(=O)N(CCN(C)C)C(C)C)cc1OC	ZINC000749019467	1299128899	/nfs/dbraw/zinc/12/88/99/1299128899.db2.gz	TVLWEPPSBMCRFA-PKNBQFBNSA-N	0	3	346.471	3.072	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@@H]2C[C@H](NCC3(C#N)CC3)CC[C@H]21	ZINC000877493529	1299343648	/nfs/dbraw/zinc/34/36/48/1299343648.db2.gz	FDYBXNAHGMIOSL-BZUAXINKSA-N	0	3	333.476	3.448	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNCc1cccc(C#N)n1	ZINC000877571218	1299405988	/nfs/dbraw/zinc/40/59/88/1299405988.db2.gz	YXOJDWBCAGSIFN-QGZVFWFLSA-N	0	3	344.459	3.223	20	30		EGEDHN
Cc1cccc([O-])c1C[NH2+]C1CCN(Cc2cccc(C#N)c2)CC1	ZINC000877614459	1299433247	/nfs/dbraw/zinc/43/32/47/1299433247.db2.gz	DMVCXWKTBIDSDB-UHFFFAOYSA-N	0	3	335.451	3.327	20	30		EGEDHN
CC(=O)[C@@](C#N)(CCN(C)CCC1CCOCC1)c1ccccc1	ZINC000878186905	1299802900	/nfs/dbraw/zinc/80/29/00/1299802900.db2.gz	PCPAPBJBLBBEFQ-FQEVSTJZSA-N	0	3	328.456	3.176	20	30		EGEDHN
C#C[C@H](CC)NC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1	ZINC000753033854	1299850261	/nfs/dbraw/zinc/85/02/61/1299850261.db2.gz	RXNXTYQHQYDFSH-HZPDHXFCSA-N	0	3	333.501	3.232	20	30		EGEDHN
Cc1ccc2c(c1)CC[C@H]2N[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000754105593	1300087575	/nfs/dbraw/zinc/08/75/75/1300087575.db2.gz	OOQKXQMVBPAMBV-RTWAWAEBSA-N	0	3	345.446	3.245	20	30		EGEDHN
C[C@H](NCC(=O)N[C@@](C)(C#N)C1CC1)c1csc2ccccc21	ZINC000754745877	1300206896	/nfs/dbraw/zinc/20/68/96/1300206896.db2.gz	YDXZTWYSYSPKHK-SGTLLEGYSA-N	0	3	327.453	3.360	20	30		EGEDHN
C#CC[C@H](NC(=O)N[C@H]1CCN(Cc2ccccc2)C1)c1ccccc1	ZINC000757059185	1300626833	/nfs/dbraw/zinc/62/68/33/1300626833.db2.gz	NNRFFSALZGUZES-SFTDATJTSA-N	0	3	347.462	3.325	20	30		EGEDHN
C#CC[C@H](NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1)c1ccccc1	ZINC000757618881	1300695148	/nfs/dbraw/zinc/69/51/48/1300695148.db2.gz	ZZJNHKURPDCYAD-RTWAWAEBSA-N	0	3	347.462	3.174	20	30		EGEDHN
CC(C)(O)[C@H]1CCCN(CC#Cc2ccc(OC(F)(F)F)cc2)C1	ZINC000879963349	1300812234	/nfs/dbraw/zinc/81/22/34/1300812234.db2.gz	ILQGOWVDHFBCKM-HNNXBMFYSA-N	0	3	341.373	3.420	20	30		EGEDHN
CC[C@@]1(C)CCN(Cc2cc(=O)n3c4ccccc4[nH]c3c2C#N)C1	ZINC000758738129	1300948480	/nfs/dbraw/zinc/94/84/80/1300948480.db2.gz	ANTRGHRLOHTKBV-YWZLYKJASA-N	0	3	334.423	3.346	20	30		EGEDHN
C=C(CN(C)C)C(=O)Oc1ccc(NC(=O)c2cccs2)cc1	ZINC000763981816	1301993964	/nfs/dbraw/zinc/99/39/64/1301993964.db2.gz	ZEPQKKNBIMEYBS-UHFFFAOYSA-N	0	3	330.409	3.024	20	30		EGEDHN
C#CCOc1ccc([C@H](C)NCc2ccccc2Cn2cncn2)cc1	ZINC000764860354	1302152141	/nfs/dbraw/zinc/15/21/41/1302152141.db2.gz	MXWUDKXHHFTUJB-KRWDZBQOSA-N	0	3	346.434	3.189	20	30		EGEDHN
C[C@@H](NCc1ccc(N2CCNC2=O)cc1)c1ccc(C#N)c(F)c1	ZINC000883286482	1302365047	/nfs/dbraw/zinc/36/50/47/1302365047.db2.gz	UXAGDXUOYOHAGD-CYBMUJFWSA-N	0	3	338.386	3.078	20	30		EGEDHN
C#CCCCN1CCN(Cc2ccc(Br)c(F)c2)CC1	ZINC000766907158	1302543010	/nfs/dbraw/zinc/54/30/10/1302543010.db2.gz	VWQBYAYPJHVBEQ-UHFFFAOYSA-N	0	3	339.252	3.119	20	30		EGEDHN
CCN(CC)C(=O)[C@@H](Cc1ccccc1)NCc1ccc(C#N)c(C)c1	ZINC000767667968	1302740085	/nfs/dbraw/zinc/74/00/85/1302740085.db2.gz	XGUQFEILJNUBKC-OAQYLSRUSA-N	0	3	349.478	3.436	20	30		EGEDHN
Cc1ccc(N2CCC[C@H](NCc3ccc(C#N)c(C)c3)C2=O)cc1	ZINC000767689516	1302745785	/nfs/dbraw/zinc/74/57/85/1302745785.db2.gz	HWKGWOVAPGWXOE-FQEVSTJZSA-N	0	3	333.435	3.460	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)[C@@H](F)c1ccccc1	ZINC000769373912	1303101072	/nfs/dbraw/zinc/10/10/72/1303101072.db2.gz	UXDCNTZWKNCWSG-IBGZPJMESA-N	0	3	339.414	3.159	20	30		EGEDHN
CSc1cc(CNCc2ccc(N(C)CCC#N)cc2)ccn1	ZINC000771892414	1303455743	/nfs/dbraw/zinc/45/57/43/1303455743.db2.gz	AIVCIDUHOSYQMW-UHFFFAOYSA-N	0	3	326.469	3.443	20	30		EGEDHN
CCN(CCCNCc1ccc(C#N)cc1F)C(=O)OC(C)(C)C	ZINC000772919916	1303595690	/nfs/dbraw/zinc/59/56/90/1303595690.db2.gz	PZUUDHIPVPFLLW-UHFFFAOYSA-N	0	3	335.423	3.434	20	30		EGEDHN
Cc1cc(CN(C)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)ccc1C#N	ZINC000774877664	1303870404	/nfs/dbraw/zinc/87/04/04/1303870404.db2.gz	MECXERMEKZZAMX-QGZVFWFLSA-N	0	3	329.444	3.308	20	30		EGEDHN
C#CCOc1ccc(CN2CCC(Oc3ccncc3C)CC2)cc1	ZINC000775205244	1303925070	/nfs/dbraw/zinc/92/50/70/1303925070.db2.gz	RFOQDEFMQSLGEX-UHFFFAOYSA-N	0	3	336.435	3.445	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@H]1CCC[C@H]1NCc1cc(C#N)ccc1F	ZINC000775628211	1303998353	/nfs/dbraw/zinc/99/83/53/1303998353.db2.gz	ARJVTEJYKRJNMS-CVEARBPZSA-N	0	3	333.407	3.233	20	30		EGEDHN
C=C1CCC(C(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)CC1	ZINC000888222981	1304074806	/nfs/dbraw/zinc/07/48/06/1304074806.db2.gz	UZAJIIBFUZVCMQ-UHFFFAOYSA-N	0	3	325.456	3.195	20	30		EGEDHN
CCCN(CCN1CCCC1)C(=O)Nc1nc(Cl)c(C#N)s1	ZINC000888420851	1304154987	/nfs/dbraw/zinc/15/49/87/1304154987.db2.gz	PMJGXPUJNUASQL-UHFFFAOYSA-N	0	3	341.868	3.008	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)Cc2ccccc2CC#N)CN1Cc1ccccc1	ZINC000777409002	1304291546	/nfs/dbraw/zinc/29/15/46/1304291546.db2.gz	FBBOQMHFJKRUOJ-UWJYYQICSA-N	0	3	347.462	3.074	20	30		EGEDHN
COC[C@@H](C)NN=C(C)c1ccc(OC)c(CN2CCCCC2)c1	ZINC000777902064	1304363781	/nfs/dbraw/zinc/36/37/81/1304363781.db2.gz	NIAIDRZYXZMVPB-OAHLLOKOSA-N	0	3	333.476	3.030	20	30		EGEDHN
Cn1cc(CNCc2ccc3c(c2)CCO3)c(-c2ccc(C#N)cc2)n1	ZINC000778080907	1304394431	/nfs/dbraw/zinc/39/44/31/1304394431.db2.gz	MJPZVPMHVKACSL-UHFFFAOYSA-N	0	3	344.418	3.183	20	30		EGEDHN
COCC1(C(=O)C(C#N)c2nc(-c3ccc(OC)cc3)cs2)CC1	ZINC000779194874	1304540619	/nfs/dbraw/zinc/54/06/19/1304540619.db2.gz	PCCCZGATFVRMAC-AWEZNQCLSA-N	0	3	342.420	3.422	20	30		EGEDHN
N#CC1(NC(=O)CN[C@H](c2ccccc2)C2CCCCC2)CCC1	ZINC000784348241	1305233683	/nfs/dbraw/zinc/23/36/83/1305233683.db2.gz	XGYNRCKPWGDIKM-LJQANCHMSA-N	0	3	325.456	3.460	20	30		EGEDHN
C#Cc1cccc(NC(=O)CN(C)c2ccnc3cc(OC)ccc32)c1	ZINC000785834882	1305448675	/nfs/dbraw/zinc/44/86/75/1305448675.db2.gz	MOWPQJFPUOQRCA-UHFFFAOYSA-N	0	3	345.402	3.300	20	30		EGEDHN
N#CC(C(=O)NC1CCCC1)C(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1	ZINC000786324297	1305556384	/nfs/dbraw/zinc/55/63/84/1305556384.db2.gz	PWKMIPWLTYPGOL-UTUOFQBUSA-N	0	3	336.844	3.273	20	30		EGEDHN
Cc1cc(C#N)cc(C)c1OS(=O)(=O)c1ccc(CN(C)C)cc1	ZINC000788636607	1305987845	/nfs/dbraw/zinc/98/78/45/1305987845.db2.gz	SDJRANJJLDWCQS-UHFFFAOYSA-N	0	3	344.436	3.004	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)[C@]2(C)CCC[C@@H]2CC)C1	ZINC001020295137	1317630801	/nfs/dbraw/zinc/63/08/01/1317630801.db2.gz	MGHKBNKEZKVXTB-RZLSGREXSA-N	0	3	343.309	3.348	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1Cl)C(=O)[C@@H]1CCC(F)(F)C1	ZINC000796632373	1310050653	/nfs/dbraw/zinc/05/06/53/1310050653.db2.gz	KRWPCIDVYWKSPV-ZJUUUORDSA-N	0	3	326.730	3.423	20	30		EGEDHN
C[C@H](NC(=O)c1ccoc1)C(=O)C(C#N)c1ncc(C(C)(C)C)s1	ZINC000797570947	1310214184	/nfs/dbraw/zinc/21/41/84/1310214184.db2.gz	MDKMNPRHSBCXPD-CMPLNLGQSA-N	0	3	345.424	3.028	20	30		EGEDHN
C[C@@H](NCC1(CC#N)CC1)c1ccc(S(=O)(=O)C(F)F)cc1	ZINC000797586733	1310214272	/nfs/dbraw/zinc/21/42/72/1310214272.db2.gz	LMBQSLLPINUARM-LLVKDONJSA-N	0	3	328.384	3.027	20	30		EGEDHN
C#C[C@@H](NC(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1)C(C)C	ZINC000798553732	1310388598	/nfs/dbraw/zinc/38/85/98/1310388598.db2.gz	XQDMJYBCVQRGLD-MOPGFXCFSA-N	0	3	327.472	3.089	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000798817317	1310445598	/nfs/dbraw/zinc/44/55/98/1310445598.db2.gz	WUEMBZBUAPXYOL-ZWNOBZJWSA-N	0	3	326.318	3.042	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1C#N	ZINC000799529737	1310567806	/nfs/dbraw/zinc/56/78/06/1310567806.db2.gz	XCZAWSHPOSUQRP-HXUWFJFHSA-N	0	3	333.435	3.434	20	30		EGEDHN
C#Cc1cccc(CNC(=O)N[C@H]2CCN([C@H](C)c3ccccc3)C2)c1	ZINC000836249320	1320464412	/nfs/dbraw/zinc/46/44/12/1320464412.db2.gz	IUHVWVCRWUMTJJ-UTKZUKDTSA-N	0	3	347.462	3.303	20	30		EGEDHN
CCOc1cc(CN(C)CCO[C@H](C)C#N)ccc1OC(F)F	ZINC000801915842	1316964873	/nfs/dbraw/zinc/96/48/73/1316964873.db2.gz	VWJCJKZOGKWPLP-GFCCVEGCSA-N	0	3	328.359	3.047	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)[C@H]3CCC=CCCC3)C2)s1	ZINC001019030806	1317015472	/nfs/dbraw/zinc/01/54/72/1317015472.db2.gz	UNIMSPRRVAYZPM-HOTGVXAUSA-N	0	3	343.496	3.447	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H](NCc2ccccc2N(C)C)C1	ZINC001019331706	1317173289	/nfs/dbraw/zinc/17/32/89/1317173289.db2.gz	BQMWQBBUXCCXMK-FXAWDEMLSA-N	0	3	329.488	3.045	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@H](NCc2ccc(C#N)s2)C1)c1cccs1	ZINC001019371624	1317198753	/nfs/dbraw/zinc/19/87/53/1317198753.db2.gz	KOMUVGUJFGOTJR-OLZOCXBDSA-N	0	3	345.493	3.175	20	30		EGEDHN
O=C(C1CC1)N1CCC2(CCN(CC#Cc3ccccc3)CC2)CC1	ZINC000957486890	1317394896	/nfs/dbraw/zinc/39/48/96/1317394896.db2.gz	KYNWUPRGDBJZBR-UHFFFAOYSA-N	0	3	336.479	3.153	20	30		EGEDHN
CC(C)c1occc1C(=O)N1CC[C@H](NCc2ccc(C#N)s2)C1	ZINC001019848588	1317450465	/nfs/dbraw/zinc/45/04/65/1317450465.db2.gz	PPRMUUOTBVORHG-ZDUSSCGKSA-N	0	3	343.452	3.340	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@H](NC(=O)CC3CCCC3)C2)c1	ZINC001019954439	1317474414	/nfs/dbraw/zinc/47/44/14/1317474414.db2.gz	STCORNCBEVLIHP-QAQDUYKDSA-N	0	3	329.419	3.014	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc(C)nn2C(CC)CC)C1	ZINC001020335672	1317650724	/nfs/dbraw/zinc/65/07/24/1317650724.db2.gz	HZBRYCSVGNJKSR-HDJSIYSDSA-N	0	3	338.883	3.156	20	30		EGEDHN
C[C@@H](NCc1cc(C#N)ccc1F)C1(NC(=O)OC(C)(C)C)CC1	ZINC000903122116	1317657497	/nfs/dbraw/zinc/65/74/97/1317657497.db2.gz	VQUNJVCKRPVQQJ-GFCCVEGCSA-N	0	3	333.407	3.233	20	30		EGEDHN
COc1ccc(CN[C@@H](C)c2cccc(COC(C)=O)c2)cc1C#N	ZINC000903127480	1317659663	/nfs/dbraw/zinc/65/96/63/1317659663.db2.gz	ZADQXBYWITZLMN-AWEZNQCLSA-N	0	3	338.407	3.481	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@H]2CCc3c2cccc3Cl)C1	ZINC001020400341	1317680067	/nfs/dbraw/zinc/68/00/67/1317680067.db2.gz	OEGXTVREOPRCRY-HUBLWGQQSA-N	0	3	339.266	3.359	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)s2)C1	ZINC001020506281	1317733411	/nfs/dbraw/zinc/73/34/11/1317733411.db2.gz	UBCAICKTZROKSL-DDHJBXDOSA-N	0	3	345.295	3.494	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@H](NCc3ccccc3[N+](=O)[O-])C2)CC1	ZINC001020550078	1317761201	/nfs/dbraw/zinc/76/12/01/1317761201.db2.gz	GNDPHYNBJHVKQK-QAQDUYKDSA-N	0	3	343.427	3.078	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccccc2O[C@@H](C)CC)C1	ZINC001020649827	1317832429	/nfs/dbraw/zinc/83/24/29/1317832429.db2.gz	MJGUGFFLIPNPHZ-KKUMJFAQSA-N	0	3	336.863	3.467	20	30		EGEDHN
CCCOc1c(/C=C2\C(=O)c3ncnn3C2C)cccc1OCC	ZINC000905081941	1317921954	/nfs/dbraw/zinc/92/19/54/1317921954.db2.gz	UTTJQPPNEIRQKE-XTCQQWIJSA-N	0	3	327.384	3.307	20	30		EGEDHN
C#CCOc1ccccc1CNC[C@]1(C)OCCc2sccc21	ZINC000810169885	1317968083	/nfs/dbraw/zinc/96/80/83/1317968083.db2.gz	BDFSIUSUEXKTHL-IBGZPJMESA-N	0	3	327.449	3.338	20	30		EGEDHN
C[C@@H](C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)s1)C1CC1	ZINC000959942550	1318277957	/nfs/dbraw/zinc/27/79/57/1318277957.db2.gz	KXFPUJOIAAQYRQ-HIFRSBDPSA-N	0	3	331.485	3.137	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@H](CCCN3C(=O)CC3CC3)C2)cc1	ZINC001021497322	1318303737	/nfs/dbraw/zinc/30/37/37/1318303737.db2.gz	XAQOFMBHQSTKOE-WOJBJXKFSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=C1CCC(C(=O)N2CCCC[C@H]2CNCc2ccccn2)CC1	ZINC000960111856	1318362818	/nfs/dbraw/zinc/36/28/18/1318362818.db2.gz	OPGWWCRRQPPPAA-IBGZPJMESA-N	0	3	327.472	3.299	20	30		EGEDHN
C=C1CCC(C(=O)N2CCCC[C@H]2CNCc2cncs2)CC1	ZINC000960110821	1318363132	/nfs/dbraw/zinc/36/31/32/1318363132.db2.gz	FNOIKXDYDGUYCC-INIZCTEOSA-N	0	3	333.501	3.360	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@@H](CCCN3C(=O)c3cc[nH]c3)C2)cc1	ZINC001021587189	1318431453	/nfs/dbraw/zinc/43/14/53/1318431453.db2.gz	BAVHFSIQKKDFIF-PMACEKPBSA-N	0	3	348.450	3.013	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2nc(C(C)C)oc2C)C1	ZINC001021587329	1318431620	/nfs/dbraw/zinc/43/16/20/1318431620.db2.gz	JNIDGKRVPRMKMC-IAGOWNOFSA-N	0	3	343.471	3.056	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1c(C)noc1CCC	ZINC000960263773	1318434851	/nfs/dbraw/zinc/43/48/51/1318434851.db2.gz	ZQXNZFHOSAAKIP-VQIMIIECSA-N	0	3	339.439	3.107	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cccc(F)c2C)C1	ZINC001021594209	1318437719	/nfs/dbraw/zinc/43/77/19/1318437719.db2.gz	KETRLVUUABWDBV-QFBILLFUSA-N	0	3	328.431	3.084	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)Cc1c(C)cccc1C	ZINC000960273184	1318438876	/nfs/dbraw/zinc/43/88/76/1318438876.db2.gz	NXBJHNUYMCUYQF-IFMALSPDSA-N	0	3	334.463	3.404	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc3nccc(C)c3c2)C1	ZINC001021595517	1318441092	/nfs/dbraw/zinc/44/10/92/1318441092.db2.gz	ZICFRCISXSRAAS-GHTZIAJQSA-N	0	3	347.462	3.103	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)CCc2ccsc2)C1	ZINC001021603918	1318447635	/nfs/dbraw/zinc/44/76/35/1318447635.db2.gz	SPZJSKPLIHYKOU-ZWKOTPCHSA-N	0	3	330.497	3.017	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCC[C@@H]2CN(C/C=C/Cl)CC[C@@H]21	ZINC001021604816	1318451945	/nfs/dbraw/zinc/45/19/45/1318451945.db2.gz	GTEGTMNSXSJHOU-CAXWLTTCSA-N	0	3	347.890	3.353	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cnoc1C1CC1	ZINC000960319105	1318460493	/nfs/dbraw/zinc/46/04/93/1318460493.db2.gz	XLFYHONJTJATMZ-QZTJIDSGSA-N	0	3	337.423	3.114	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(C)c3ccccc3n2)C1	ZINC001021614036	1318462144	/nfs/dbraw/zinc/46/21/44/1318462144.db2.gz	NYQHGRFKHRSIIT-UWJYYQICSA-N	0	3	347.462	3.103	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)Cc1cccc(F)c1	ZINC000960333883	1318467298	/nfs/dbraw/zinc/46/72/98/1318467298.db2.gz	CGMACDYKZIIJQM-TZIWHRDSSA-N	0	3	338.426	3.316	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2c(C)oc(C)c2C)C1	ZINC001021625847	1318476736	/nfs/dbraw/zinc/47/67/36/1318476736.db2.gz	AZOANHOTWCKDPF-QZTJIDSGSA-N	0	3	328.456	3.155	20	30		EGEDHN
C=CCNc1ncc(C(=O)Nc2ccc(CN(C)C)cc2OC)s1	ZINC000909477787	1318479379	/nfs/dbraw/zinc/47/93/79/1318479379.db2.gz	UCMGFXVIZOWBEU-UHFFFAOYSA-N	0	3	346.456	3.064	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2coc(C(F)F)c2)C1	ZINC001021660077	1318523798	/nfs/dbraw/zinc/52/37/98/1318523798.db2.gz	YDFSSWXCZVJEJJ-HIFRSBDPSA-N	0	3	336.382	3.167	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(C)cc(F)c2)C1	ZINC001021675837	1318542703	/nfs/dbraw/zinc/54/27/03/1318542703.db2.gz	GQAIPZVEQXRNMJ-LPHOPBHVSA-N	0	3	328.431	3.084	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)CC(C)(C)C	ZINC000960432436	1318554464	/nfs/dbraw/zinc/55/44/64/1318554464.db2.gz	JCAOVTJVKVPTBG-SFHVURJKSA-N	0	3	327.472	3.417	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2[nH]ccc2-c2ccccc2)C1	ZINC001021712864	1318590249	/nfs/dbraw/zinc/59/02/49/1318590249.db2.gz	LEHJRFGOAFPMGZ-QUCCMNQESA-N	0	3	347.462	3.241	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(CC)c(CC)o2)C1	ZINC001021718342	1318599410	/nfs/dbraw/zinc/59/94/10/1318599410.db2.gz	WWWZWUCGDIIDDI-ZWKOTPCHSA-N	0	3	342.483	3.354	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@H]1CN(C)Cc1cccc(C(F)F)c1	ZINC000960506384	1318616831	/nfs/dbraw/zinc/61/68/31/1318616831.db2.gz	ZDIKVNSBUICWBS-CJNGLKHVSA-N	0	3	335.398	3.207	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(CC)c(C)s2)C1	ZINC001021728372	1318626626	/nfs/dbraw/zinc/62/66/26/1318626626.db2.gz	SURRQENFRRARKS-IAGOWNOFSA-N	0	3	330.497	3.179	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2csc3c2CCCC3)C1	ZINC001021729507	1318629603	/nfs/dbraw/zinc/62/96/03/1318629603.db2.gz	FPERKNNZOIGNIX-CRAIPNDOSA-N	0	3	342.508	3.187	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2csc3c2CCCC3)C1	ZINC001021729509	1318630636	/nfs/dbraw/zinc/63/06/36/1318630636.db2.gz	FPERKNNZOIGNIX-QAPCUYQASA-N	0	3	342.508	3.187	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc3[nH]c(C)c(C)c3c2)C1	ZINC001021733879	1318639184	/nfs/dbraw/zinc/63/91/84/1318639184.db2.gz	SLDPSQLUCOBHFZ-GHTZIAJQSA-N	0	3	349.478	3.344	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)[C@H]1CC1(C)C	ZINC000960550831	1318682807	/nfs/dbraw/zinc/68/28/07/1318682807.db2.gz	RRFUUELTNRXPDE-ZWKOTPCHSA-N	0	3	325.456	3.027	20	30		EGEDHN
CN(Cc1ccc(Cl)cc1)C[C@@H]1CCCN1C(=O)C#CC1CC1	ZINC000960614066	1318740953	/nfs/dbraw/zinc/74/09/53/1318740953.db2.gz	QGGGVXMKESNSHO-SFHVURJKSA-N	0	3	330.859	3.176	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)N1CCC[C@@H](c2nc(C)no2)C1	ZINC000911643655	1318755675	/nfs/dbraw/zinc/75/56/75/1318755675.db2.gz	VHHAZGUKBJKSEH-CVEARBPZSA-N	0	3	336.480	3.162	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)N1CCC[C@@H](c2nc(C)no2)C1	ZINC000911643658	1318755759	/nfs/dbraw/zinc/75/57/59/1318755759.db2.gz	VHHAZGUKBJKSEH-HZPDHXFCSA-N	0	3	336.480	3.162	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)NCC(=O)Nc1c(C)cccc1C	ZINC000912036155	1318796592	/nfs/dbraw/zinc/79/65/92/1318796592.db2.gz	HJXLDMYZRRWCPR-KRWDZBQOSA-N	0	3	347.503	3.436	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)C1(F)CCCC1	ZINC000960713607	1318819842	/nfs/dbraw/zinc/81/98/42/1318819842.db2.gz	LOSXUEAQNFXVLH-SFHVURJKSA-N	0	3	343.446	3.263	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccccc1C(=O)N1CCC(C)CC1	ZINC000912300503	1318864057	/nfs/dbraw/zinc/86/40/57/1318864057.db2.gz	HOEXDYVQQVOKLQ-KRWDZBQOSA-N	0	3	343.471	3.181	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1cc(Cl)ccc1C(=O)NC(C)C	ZINC000912312307	1318866618	/nfs/dbraw/zinc/86/66/18/1318866618.db2.gz	VCJBKYRHKRKRCK-AWEZNQCLSA-N	0	3	337.851	3.100	20	30		EGEDHN
C#CCN(CC)C[C@](C)(O)c1ccc(Br)cc1Cl	ZINC000815058749	1318878012	/nfs/dbraw/zinc/87/80/12/1318878012.db2.gz	RTJRGVYGTSEJNX-AWEZNQCLSA-N	0	3	330.653	3.265	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]1CN(C)Cc1cccc(COC)c1	ZINC000960785799	1318888484	/nfs/dbraw/zinc/88/84/84/1318888484.db2.gz	AGBQDASUMYRXEM-IBGZPJMESA-N	0	3	344.499	3.468	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]1CN(C)Cc1ccc2c(c1)COC2	ZINC000960792267	1318898790	/nfs/dbraw/zinc/89/87/90/1318898790.db2.gz	UNIMFXLMDONPJI-IBGZPJMESA-N	0	3	342.483	3.352	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)c2ccccc2CC)C1	ZINC001022612175	1319014363	/nfs/dbraw/zinc/01/43/63/1319014363.db2.gz	SOYZHJXGZDSXNU-OKILXGFUSA-N	0	3	337.261	3.008	20	30		EGEDHN
CCC(=O)N1CCC[C@@H]([C@H]2CCN(Cc3ccccc3C#N)C2)C1	ZINC000961065353	1319180770	/nfs/dbraw/zinc/18/07/70/1319180770.db2.gz	JOPAWXPREXICNC-MOPGFXCFSA-N	0	3	325.456	3.029	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc(COC(C)C)cc2)C1	ZINC001023074772	1319253840	/nfs/dbraw/zinc/25/38/40/1319253840.db2.gz	LEEQXLMTSJFPSL-CALCHBBNSA-N	0	3	336.863	3.215	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc3ccccc3n2CC)C1	ZINC001023126027	1319274795	/nfs/dbraw/zinc/27/47/95/1319274795.db2.gz	FTAJUZUAKGTALP-GASCZTMLSA-N	0	3	331.847	3.264	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC[C@H]([C@H]2CCN(CCF)C2)C1	ZINC000961165645	1319284697	/nfs/dbraw/zinc/28/46/97/1319284697.db2.gz	ICQBMNCQZWBTBN-GJZGRUSLSA-N	0	3	330.875	3.295	20	30		EGEDHN
C[C@@H]1C[C@@H](C(=O)OC(C)(C)C)CN(Cc2ccc(OCC#N)cc2)C1	ZINC000817289313	1319315196	/nfs/dbraw/zinc/31/51/96/1319315196.db2.gz	WXMDWVFMEVBUMG-NVXWUHKLSA-N	0	3	344.455	3.389	20	30		EGEDHN
CCC(=O)N1CCC([C@H]2CCCN(Cc3ccccc3C#N)C2)CC1	ZINC000961300136	1319462191	/nfs/dbraw/zinc/46/21/91/1319462191.db2.gz	SOMLKKMJSOLWOB-IBGZPJMESA-N	0	3	339.483	3.419	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)N2CCC[C@H](C#N)C2)N2CCCC2)cc1	ZINC000915413463	1319481959	/nfs/dbraw/zinc/48/19/59/1319481959.db2.gz	KTYZBARLMUFFAN-MJGOQNOKSA-N	0	3	340.471	3.077	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2csc(C(F)(F)F)c2)C1	ZINC001023465467	1319562820	/nfs/dbraw/zinc/56/28/20/1319562820.db2.gz	SPPZKKKZBJWEPS-LBPRGKRZSA-N	0	3	344.402	3.232	20	30		EGEDHN
C#CCN(C)CCCNC(=O)[C@@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000818615348	1319569364	/nfs/dbraw/zinc/56/93/64/1319569364.db2.gz	JQWWZUKMSVZAQS-ZIAGYGMSSA-N	0	3	339.266	3.168	20	30		EGEDHN
C(=NNCCN1CCCCC1)c1ccc(-n2cnc3ccccc32)cc1	ZINC000915976039	1319575739	/nfs/dbraw/zinc/57/57/39/1319575739.db2.gz	ZAEGZOJSTZGQDL-UHFFFAOYSA-N	0	3	347.466	3.435	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc3cc(C)ccc3n2)C1	ZINC001023479873	1319584250	/nfs/dbraw/zinc/58/42/50/1319584250.db2.gz	SVYZILRYWNEXGO-QGZVFWFLSA-N	0	3	335.451	3.008	20	30		EGEDHN
N#Cc1ccccc1CNCC1CC(NC(=O)c2ccc(Cl)o2)C1	ZINC000961557301	1319651763	/nfs/dbraw/zinc/65/17/63/1319651763.db2.gz	IWUYBTMDJGJGTJ-UHFFFAOYSA-N	0	3	343.814	3.103	20	30		EGEDHN
CCOc1cc(Cl)ccc1CNC[C@@H](O)c1ccc(C#N)cc1	ZINC000819186095	1319661859	/nfs/dbraw/zinc/66/18/59/1319661859.db2.gz	OWCDDSQRDRYZIK-QGZVFWFLSA-N	0	3	330.815	3.434	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN[C@@H]2CCCOc3c(F)cccc32)cc1	ZINC000819214827	1319671041	/nfs/dbraw/zinc/67/10/41/1319671041.db2.gz	UVGIRIYYFSETTQ-MSOLQXFVSA-N	0	3	326.371	3.234	20	30		EGEDHN
C[C@@H]1C[C@@H](C)CN(CC(=O)C(C#N)c2nc3ccccc3s2)C1	ZINC000916622790	1319686600	/nfs/dbraw/zinc/68/66/00/1319686600.db2.gz	LOCDRXJCGRMXGH-MCIONIFRSA-N	0	3	327.453	3.450	20	30		EGEDHN
CSc1ccc([C@@H](CNC(=O)C#Cc2ccccc2)N(C)C)cc1	ZINC000819336180	1319702495	/nfs/dbraw/zinc/70/24/95/1319702495.db2.gz	SPFWJRLJKCLFDL-LJQANCHMSA-N	0	3	338.476	3.179	20	30		EGEDHN
Cc1cc(C)n([C@@H](C)CC(=O)C(C#N)C(=O)Nc2cccc(C)c2)n1	ZINC000916898418	1319721216	/nfs/dbraw/zinc/72/12/16/1319721216.db2.gz	CSRWFPYSFMLPHA-DOTOQJQBSA-N	0	3	338.411	3.107	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1)C(=O)c1ccc(C(F)(F)F)cn1	ZINC000916898853	1319721655	/nfs/dbraw/zinc/72/16/55/1319721655.db2.gz	IWIACQMWUZAFJD-LBPRGKRZSA-N	0	3	333.269	3.062	20	30		EGEDHN
N#CC(C(=O)CSc1ccncc1)C(=O)Nc1ccccc1Cl	ZINC000916904537	1319723282	/nfs/dbraw/zinc/72/32/82/1319723282.db2.gz	AQMDXMXWBQVRJF-GFCCVEGCSA-N	0	3	345.811	3.175	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccccc2O[C@@H](C)CC)C1	ZINC001023620964	1319741339	/nfs/dbraw/zinc/74/13/39/1319741339.db2.gz	CTOBYNABLBXVID-ZWKOTPCHSA-N	0	3	342.483	3.329	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc(C(CC)CC)no2)C1	ZINC001023634823	1319756068	/nfs/dbraw/zinc/75/60/68/1319756068.db2.gz	SWMGWDOCQLXMQN-HNNXBMFYSA-N	0	3	331.460	3.043	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccccc2OCC(C)C)C1	ZINC001023652708	1319772580	/nfs/dbraw/zinc/77/25/80/1319772580.db2.gz	NCQYKOIHEAVNFJ-SFHVURJKSA-N	0	3	342.483	3.187	20	30		EGEDHN
C=CCN1CCC[C@H](CNC(=O)c2ncoc2-c2cccs2)C1	ZINC001023653582	1319774295	/nfs/dbraw/zinc/77/42/95/1319774295.db2.gz	BDIDTCCYUZJPEU-CYBMUJFWSA-N	0	3	331.441	3.031	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc(O[C@H](C)CC)cc2)C1	ZINC001023691466	1319808882	/nfs/dbraw/zinc/80/88/82/1319808882.db2.gz	KPCQCGZLJNYCTG-MSOLQXFVSA-N	0	3	342.483	3.329	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc3c(s2)CC[C@@H](C)C3)C1	ZINC001023742655	1319889457	/nfs/dbraw/zinc/88/94/57/1319889457.db2.gz	JWXIOZDAWKEWGO-CVEARBPZSA-N	0	3	344.524	3.338	20	30		EGEDHN
CN(C)C[C@H]1CCc2ccccc2N1C(=O)/C=C/c1ccccc1C#N	ZINC000821630881	1320023770	/nfs/dbraw/zinc/02/37/70/1320023770.db2.gz	OQEIZYHYXCCXOH-CMQXMCPJSA-N	0	3	345.446	3.481	20	30		EGEDHN
CN(C)CCN(Cc1ccc(F)cc1)C(=O)c1cc(C#N)ccc1F	ZINC000824375697	1320252507	/nfs/dbraw/zinc/25/25/07/1320252507.db2.gz	ZOGDQEBNNVGVGJ-UHFFFAOYSA-N	0	3	343.377	3.040	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)C#Cc1cccs1)c1ccsc1	ZINC000825011643	1320304299	/nfs/dbraw/zinc/30/42/99/1320304299.db2.gz	QYZZDXATUHTKAP-MRXNPFEDSA-N	0	3	332.494	3.360	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N(Cc1cccc(Cl)c1)C(C)C	ZINC000838622309	1320796081	/nfs/dbraw/zinc/79/60/81/1320796081.db2.gz	CMKGGVMSXYMBDN-UHFFFAOYSA-N	0	3	335.879	3.215	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N(Cc1ccc([C@H]2C[C@H]2C)o1)C1CC1	ZINC000838624298	1320796361	/nfs/dbraw/zinc/79/63/61/1320796361.db2.gz	QIOAKCVTPZZNBS-QAPCUYQASA-N	0	3	343.471	3.032	20	30		EGEDHN
COC1([C@H](C)NCC(=O)N(CCC#N)c2ccc(C)c(C)c2)CCC1	ZINC000839656776	1320953867	/nfs/dbraw/zinc/95/38/67/1320953867.db2.gz	XLOPUTZKEUZHIX-KRWDZBQOSA-N	0	3	343.471	3.097	20	30		EGEDHN
CC[C@H](OC1CCCC1)C(=O)C(C#N)C(=O)Nc1cccc(C)c1	ZINC000842289706	1321367974	/nfs/dbraw/zinc/36/79/74/1321367974.db2.gz	SCUQLQNGUNZOTP-SJORKVTESA-N	0	3	328.412	3.380	20	30		EGEDHN
N#CC(C(=O)CCCc1ccc2c(c1)CCCC2)C(=O)N1CCCC1	ZINC000845440214	1321707477	/nfs/dbraw/zinc/70/74/77/1321707477.db2.gz	OVLFZKYODBKFDR-LJQANCHMSA-N	0	3	338.451	3.219	20	30		EGEDHN
CCOC(=O)CCN(Cc1cc(Cl)ccc1OCC#N)C(C)C	ZINC000847087108	1321839809	/nfs/dbraw/zinc/83/98/09/1321839809.db2.gz	VSARDQIOYAKZFZ-UHFFFAOYSA-N	0	3	338.835	3.406	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847748828	1321900325	/nfs/dbraw/zinc/90/03/25/1321900325.db2.gz	JFBUHSVYNFSCOR-QGZVFWFLSA-N	0	3	326.440	3.382	20	30		EGEDHN
CS/C=C/C(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847749583	1321900365	/nfs/dbraw/zinc/90/03/65/1321900365.db2.gz	VSTQFEYDXRTGPU-KPKJPENVSA-N	0	3	330.453	3.212	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccccc2OCC#N)C1	ZINC000919821293	1322109156	/nfs/dbraw/zinc/10/91/56/1322109156.db2.gz	AFLABAQHJACVKV-SJLPKXTDSA-N	0	3	349.434	3.154	20	30		EGEDHN
C#CCOc1ccc(CNCc2ccc(O[C@@H](C)COC)cc2)cc1	ZINC000850315806	1322227162	/nfs/dbraw/zinc/22/71/62/1322227162.db2.gz	NTXBFJGAOSZQAN-KRWDZBQOSA-N	0	3	339.435	3.402	20	30		EGEDHN
Cc1cc(CNCc2ccc(N3CCCNC3=O)cc2)ccc1C#N	ZINC000850414650	1322241370	/nfs/dbraw/zinc/24/13/70/1322241370.db2.gz	SYWROFBJFZLUSL-UHFFFAOYSA-N	0	3	334.423	3.076	20	30		EGEDHN
N#CC(C(=O)CCCF)C(=O)Nc1ccc(SC(F)F)cc1	ZINC000850755115	1322284257	/nfs/dbraw/zinc/28/42/57/1322284257.db2.gz	BOYRHQZMFHKFHB-LLVKDONJSA-N	0	3	330.331	3.398	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)c2cc(COC)cs2)cc1	ZINC000850759391	1322286069	/nfs/dbraw/zinc/28/60/69/1322286069.db2.gz	IFZMWTIGGLNJRN-OAHLLOKOSA-N	0	3	342.420	3.418	20	30		EGEDHN
CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)N1CCC[C@H](C#N)C1	ZINC000922021180	1322441527	/nfs/dbraw/zinc/44/15/27/1322441527.db2.gz	MSGAGIPSUAFJLM-RTBURBONSA-N	0	3	342.487	3.088	20	30		EGEDHN
CCC(O)(CC)CCNCc1cc(C#N)ccc1Br	ZINC000922043792	1322444657	/nfs/dbraw/zinc/44/46/57/1322444657.db2.gz	CMPJJBZFDNDLIZ-UHFFFAOYSA-N	0	3	325.250	3.352	20	30		EGEDHN
C=CCOc1ccc(CNCc2ccc3c(c2)ncn3C)cc1OC	ZINC000922482403	1322539124	/nfs/dbraw/zinc/53/91/24/1322539124.db2.gz	LUBJLHFQWKGQJJ-UHFFFAOYSA-N	0	3	337.423	3.437	20	30		EGEDHN
C[C@@H](CC(C)(C)C#N)OC(=O)C1CCN(c2ccc(F)cc2)C1=O	ZINC000851210940	1323001859	/nfs/dbraw/zinc/00/18/59/1323001859.db2.gz	WEXMKPQXJZUHGV-SWLSCSKDSA-N	0	3	332.375	3.050	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H](CNCc2ccccc2C#N)C1)C1CCC1	ZINC001024037279	1323090003	/nfs/dbraw/zinc/09/00/03/1323090003.db2.gz	ZQIIPLOWCHKJPZ-IAGOWNOFSA-N	0	3	339.483	3.323	20	30		EGEDHN
C[C@H](CC(C)(C)C#N)NCc1cccc(NC(=O)[C@@H]2CCCO2)c1	ZINC000924778556	1323159226	/nfs/dbraw/zinc/15/92/26/1323159226.db2.gz	UYIZOMFJGMPJQS-PBHICJAKSA-N	0	3	329.444	3.222	20	30		EGEDHN
CC(C)C1(C(=O)N2CCC[C@H](CNCc3ccccc3C#N)C2)CC1	ZINC001024142922	1323166886	/nfs/dbraw/zinc/16/68/86/1323166886.db2.gz	BQFCQKAGXKWUKR-QGZVFWFLSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=CCN(C[C@@H](O)c1ccccc1Br)[C@@H](C)COC	ZINC000852356448	1323183085	/nfs/dbraw/zinc/18/30/85/1323183085.db2.gz	FFJPAMOSERAZCU-SWLSCSKDSA-N	0	3	328.250	3.005	20	30		EGEDHN
CCC(=O)N1CCC[C@H]([C@H]2CCCN2Cc2ccc(F)c(C#N)c2)C1	ZINC000963213979	1323238443	/nfs/dbraw/zinc/23/84/43/1323238443.db2.gz	CQEHKRZTLGMGGR-QFBILLFUSA-N	0	3	343.446	3.310	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)C1C2CC3CC(C2)CC1C3	ZINC001024481134	1323435742	/nfs/dbraw/zinc/43/57/42/1323435742.db2.gz	TYBSDLZNGANSNH-BIKXEMDZSA-N	0	3	328.500	3.053	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC001024507831	1323455401	/nfs/dbraw/zinc/45/54/01/1323455401.db2.gz	ZAGUCBDHDJXCAQ-UYAOXDASSA-N	0	3	341.499	3.060	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1nc2ccccc2cc1C	ZINC001024563303	1323503142	/nfs/dbraw/zinc/50/31/42/1323503142.db2.gz	XUJXYLFZGNJZFZ-GOSISDBHSA-N	0	3	335.451	3.151	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cncc2sccc21	ZINC001024620409	1323548976	/nfs/dbraw/zinc/54/89/76/1323548976.db2.gz	UEOBSKJZEWWGDN-CQSZACIVSA-N	0	3	329.469	3.457	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CCCCN2C[C@H]2CCCCO2)CC1	ZINC001024632782	1323558091	/nfs/dbraw/zinc/55/80/91/1323558091.db2.gz	BDXGZOQLIPQQGO-RBUKOAKNSA-N	0	3	334.504	3.273	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)NC[C@H]1CCCCN1Cc1ccc(C)cc1	ZINC001024660199	1323576636	/nfs/dbraw/zinc/57/66/36/1323576636.db2.gz	KLJNJNXBPWVMQS-AQNXPRMDSA-N	0	3	342.483	3.057	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1csc2c1CC[C@H](C)C2	ZINC001024787180	1323691760	/nfs/dbraw/zinc/69/17/60/1323691760.db2.gz	ZAUFXSRXYYMYRX-HOTGVXAUSA-N	0	3	344.524	3.481	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cc(-c2ccc(C)o2)n[nH]1	ZINC001024798295	1323702615	/nfs/dbraw/zinc/70/26/15/1323702615.db2.gz	WDZRKBVLDBKBME-OAHLLOKOSA-N	0	3	342.443	3.139	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1cc2ccccc2n1CC	ZINC001024810588	1323714253	/nfs/dbraw/zinc/71/42/53/1323714253.db2.gz	HDZKJOXLOXUSOW-SFHVURJKSA-N	0	3	337.467	3.269	20	30		EGEDHN
COc1ccc(C#N)cc1CNC[C@H]1CCCCN1C(=O)C=C(C)C	ZINC001024854632	1323748637	/nfs/dbraw/zinc/74/86/37/1323748637.db2.gz	VLNNISQCUAUGAH-GOSISDBHSA-N	0	3	341.455	3.004	20	30		EGEDHN
CC(=O)N1CCCC[C@@H]1[C@H]1CCCN1Cc1ccc(C#N)c(F)c1	ZINC001025178523	1323944437	/nfs/dbraw/zinc/94/44/37/1323944437.db2.gz	DCYSRLQZZQIMHE-RTBURBONSA-N	0	3	329.419	3.063	20	30		EGEDHN
CCC(=O)N1CCCC[C@@H]1[C@@H]1CCCN1Cc1ccc(C#N)s1	ZINC001025186460	1323958821	/nfs/dbraw/zinc/95/88/21/1323958821.db2.gz	XDHXPZBFWQDHFD-DLBZAZTESA-N	0	3	331.485	3.375	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc(F)cc1	ZINC001025190784	1323969578	/nfs/dbraw/zinc/96/95/78/1323969578.db2.gz	AZFVRUCXRFOAEL-RTBURBONSA-N	0	3	328.431	3.308	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccn(C(C)(C)C)n1	ZINC001025234841	1324023596	/nfs/dbraw/zinc/02/35/96/1324023596.db2.gz	LJVKZTUKXDFAPE-MSOLQXFVSA-N	0	3	344.503	3.283	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1c(C)[nH]nc1Cl	ZINC001025237703	1324029442	/nfs/dbraw/zinc/02/94/42/1324029442.db2.gz	OEDJXITWRKYGCY-UONOGXRCSA-N	0	3	336.867	3.017	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cccnc1C1CC1	ZINC001025247722	1324046759	/nfs/dbraw/zinc/04/67/59/1324046759.db2.gz	PKMJFAOJEZQISD-RTBURBONSA-N	0	3	337.467	3.051	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1snnc1CC	ZINC001025250626	1324051723	/nfs/dbraw/zinc/05/17/23/1324051723.db2.gz	MBXUQEAVRGZTOE-HZPDHXFCSA-N	0	3	348.516	3.136	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc(COC)o1	ZINC001025250526	1324052133	/nfs/dbraw/zinc/05/21/33/1324052133.db2.gz	KTAJBYGWRHGGHX-IAGOWNOFSA-N	0	3	332.444	3.071	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccn2ccccc12	ZINC001025252549	1324056932	/nfs/dbraw/zinc/05/69/32/1324056932.db2.gz	XUYKLYHAVXURGM-PMACEKPBSA-N	0	3	335.451	3.032	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cccnc1C(F)F	ZINC001025252809	1324058161	/nfs/dbraw/zinc/05/81/61/1324058161.db2.gz	ZJSKHAIWDJVYQI-HOTGVXAUSA-N	0	3	347.409	3.112	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1occ2c1CCC2	ZINC001025255955	1324062795	/nfs/dbraw/zinc/06/27/95/1324062795.db2.gz	UGZRXNXQJPIIOB-MSOLQXFVSA-N	0	3	328.456	3.413	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cccc(OC)c1C	ZINC001025274346	1324092033	/nfs/dbraw/zinc/09/20/33/1324092033.db2.gz	XALTVILXOYGTAD-OALUTQOASA-N	0	3	340.467	3.096	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc2ccn(C)c2c1	ZINC001025288133	1324110893	/nfs/dbraw/zinc/11/08/93/1324110893.db2.gz	RYOAEDJUJKCRAA-UXHICEINSA-N	0	3	349.478	3.271	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc2ccn(C)c2c1	ZINC001025288132	1324111160	/nfs/dbraw/zinc/11/11/60/1324111160.db2.gz	RYOAEDJUJKCRAA-PMACEKPBSA-N	0	3	349.478	3.271	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccccc1Cl	ZINC001025291946	1324115695	/nfs/dbraw/zinc/11/56/95/1324115695.db2.gz	DCQFZDZCFLOHAG-ZWKOTPCHSA-N	0	3	330.859	3.432	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc(Cl)cn1	ZINC001025292387	1324117068	/nfs/dbraw/zinc/11/70/68/1324117068.db2.gz	ICIGXNPYAIWOAG-MSOLQXFVSA-N	0	3	345.874	3.217	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc(Cl)cc1	ZINC001025294317	1324123180	/nfs/dbraw/zinc/12/31/80/1324123180.db2.gz	ZHOLUCRUFQDSPJ-ZWKOTPCHSA-N	0	3	330.859	3.432	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc(C2CC2)cn1	ZINC001025296314	1324127138	/nfs/dbraw/zinc/12/71/38/1324127138.db2.gz	JJTUNUWHAZIGLH-VQTJNVASSA-N	0	3	337.467	3.051	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(C)n(C)c1C	ZINC001025297117	1324129014	/nfs/dbraw/zinc/12/90/14/1324129014.db2.gz	OJJLJKXFJNDEPL-UXHICEINSA-N	0	3	341.499	3.124	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)CC(C1CC1)C1CC1	ZINC001025301548	1324135698	/nfs/dbraw/zinc/13/56/98/1324135698.db2.gz	LRIGGMATADOJAV-PMACEKPBSA-N	0	3	328.500	3.291	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc3nccc(C)c3c2)C1	ZINC001025428035	1324262118	/nfs/dbraw/zinc/26/21/18/1324262118.db2.gz	KDWLCHALUANXKO-MJGOQNOKSA-N	0	3	349.478	3.397	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2conc2C2CCCC2)C1	ZINC001025437770	1324277339	/nfs/dbraw/zinc/27/73/39/1324277339.db2.gz	AKXORYNDEDIQPE-WBVHZDCISA-N	0	3	343.471	3.186	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(C)n(C(CC)CC)n2)C1	ZINC001025460650	1324306091	/nfs/dbraw/zinc/30/60/91/1324306091.db2.gz	KPCPYZLWGRCQPF-SJORKVTESA-N	0	3	344.503	3.016	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(C)n(C(CC)CC)n2)C1	ZINC001025460648	1324306970	/nfs/dbraw/zinc/30/69/70/1324306970.db2.gz	KPCPYZLWGRCQPF-IAGOWNOFSA-N	0	3	344.503	3.016	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(F)cc3ccoc32)C1	ZINC001025465877	1324310161	/nfs/dbraw/zinc/31/01/61/1324310161.db2.gz	WVVSJXMSDBAOMG-GOEBONIOSA-N	0	3	342.414	3.426	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(F)cc3ccoc32)C1	ZINC001025465878	1324311089	/nfs/dbraw/zinc/31/10/89/1324311089.db2.gz	WVVSJXMSDBAOMG-HOCLYGCPSA-N	0	3	342.414	3.426	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2c(C)occ2C(F)(F)F)C1	ZINC001025484208	1324331894	/nfs/dbraw/zinc/33/18/94/1324331894.db2.gz	APORYUJCKFCHGS-DGCLKSJQSA-N	0	3	342.361	3.070	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2nc3ccccc3cc2C)C1	ZINC001025485980	1324335051	/nfs/dbraw/zinc/33/50/51/1324335051.db2.gz	QYMRVILLOCHHNE-WMZOPIPTSA-N	0	3	335.451	3.007	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2csc3ccccc23)C1	ZINC001025495925	1324348191	/nfs/dbraw/zinc/34/81/91/1324348191.db2.gz	LIMRGWDEHJVJFO-CABCVRRESA-N	0	3	326.465	3.365	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2nccc3ccccc32)C1	ZINC001025518804	1324362291	/nfs/dbraw/zinc/36/22/91/1324362291.db2.gz	IHJSVEOGNBMZDT-AEFFLSMTSA-N	0	3	335.451	3.088	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cccc3c2ccn3C)C1	ZINC001025560116	1324407914	/nfs/dbraw/zinc/40/79/14/1324407914.db2.gz	ANXGQDYIRNUWDF-SJORKVTESA-N	0	3	337.467	3.032	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc3cccnc3c2)C1	ZINC001025563503	1324409888	/nfs/dbraw/zinc/40/98/88/1324409888.db2.gz	CTIBEHWDCDAUHL-QFBILLFUSA-N	0	3	335.451	3.088	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccccc2OCC(C)C)C1	ZINC001025565613	1324411298	/nfs/dbraw/zinc/41/12/98/1324411298.db2.gz	SOTQSALVFVIHEK-MSOLQXFVSA-N	0	3	342.483	3.185	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cccc(C(C)(C)C)c2)C1	ZINC001025576611	1324415466	/nfs/dbraw/zinc/41/54/66/1324415466.db2.gz	LMMZEMGEAQOUJV-WMZOPIPTSA-N	0	3	326.484	3.448	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(Cl)cc(OC)c2)C1	ZINC001025578563	1324417782	/nfs/dbraw/zinc/41/77/82/1324417782.db2.gz	YBSLLWBVVVYDTB-CABCVRRESA-N	0	3	348.874	3.202	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(C)nc3ccccc32)C1	ZINC001025609137	1324460173	/nfs/dbraw/zinc/46/01/73/1324460173.db2.gz	DSSCBNOFLKTNKJ-QZTJIDSGSA-N	0	3	349.478	3.397	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc3c(s2)CCC3)C1	ZINC001025615037	1324468359	/nfs/dbraw/zinc/46/83/59/1324468359.db2.gz	RYKJOGLEZGKCAL-HOCLYGCPSA-N	0	3	330.497	3.090	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(C)c(F)c(C)c2)C1	ZINC001025629106	1324479851	/nfs/dbraw/zinc/47/98/51/1324479851.db2.gz	ZZKBOGPCTVKSII-IRXDYDNUSA-N	0	3	330.447	3.296	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2sc(C(C)(C)C)nc2C)C1	ZINC001025636217	1324487937	/nfs/dbraw/zinc/48/79/37/1324487937.db2.gz	YCTBLOSBBKOGFH-UKRRQHHQSA-N	0	3	347.528	3.213	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(-c3ccccc3)co2)C1	ZINC001025640382	1324490603	/nfs/dbraw/zinc/49/06/03/1324490603.db2.gz	MLIDOKUYZVUXIO-AEFFLSMTSA-N	0	3	336.435	3.410	20	30		EGEDHN
CC1(C(=O)N2C[C@@H]3CC[C@H](NCc4ccccc4C#N)[C@H]3C2)CCC1	ZINC001026332696	1324732541	/nfs/dbraw/zinc/73/25/41/1324732541.db2.gz	OKSWBFZQQZBMQC-FHWLQOOXSA-N	0	3	337.467	3.075	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H]2CC[C@H](NCc3ccccc3C#N)[C@@H]2C1	ZINC001026332739	1324732729	/nfs/dbraw/zinc/73/27/29/1324732729.db2.gz	PDZKGJMYNKECBR-OTWHNJEPSA-N	0	3	337.467	3.097	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCN(C(=O)CC2CCCCC2)C1	ZINC001026668397	1324963882	/nfs/dbraw/zinc/96/38/82/1324963882.db2.gz	OFZUMZIRNDDDMT-GOSISDBHSA-N	0	3	339.483	3.467	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC[C@@H](CNCc2c(Cl)cccc2Cl)C1	ZINC001026728327	1324994093	/nfs/dbraw/zinc/99/40/93/1324994093.db2.gz	FWODYRSHTQLEDI-NEPJUHHUSA-N	0	3	340.254	3.091	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC[C@@H](CNCc2cc(Cl)sc2Cl)C1	ZINC001026732526	1324995641	/nfs/dbraw/zinc/99/56/41/1324995641.db2.gz	KDMRRWFMHVTOGD-ZJUUUORDSA-N	0	3	346.283	3.153	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCN(C(=O)CC2=CCCCC2)C1	ZINC001026733743	1324996840	/nfs/dbraw/zinc/99/68/40/1324996840.db2.gz	BNMXNJDPPCXQPL-GOSISDBHSA-N	0	3	337.467	3.387	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)C2CC(F)(F)C2)C1	ZINC000963281253	1325061189	/nfs/dbraw/zinc/06/11/89/1325061189.db2.gz	HOAQJSWMZWMFRL-HIFRSBDPSA-N	0	3	346.849	3.487	20	30		EGEDHN
C[C@@H](CC(C)(C)C#N)NCC(=O)N1CCC(Cc2ccccc2)CC1	ZINC000925199789	1325078348	/nfs/dbraw/zinc/07/83/48/1325078348.db2.gz	FYJXZQFFWFQUHF-KRWDZBQOSA-N	0	3	341.499	3.386	20	30		EGEDHN
CC1CC(C(=O)NC2CC3(CC(NCc4ccccc4C#N)C3)C2)C1	ZINC000963673960	1325372002	/nfs/dbraw/zinc/37/20/02/1325372002.db2.gz	XNOMXNRWYAHJDG-UHFFFAOYSA-N	0	3	337.467	3.121	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)C2CCCC2)C1	ZINC001027269129	1325372149	/nfs/dbraw/zinc/37/21/49/1325372149.db2.gz	FXYLWOVERMYFLJ-IBGZPJMESA-N	0	3	325.456	3.171	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)C2CCC(NCc3cc(C)no3)CC2)C1	ZINC000963887431	1325422548	/nfs/dbraw/zinc/42/25/48/1325422548.db2.gz	RGZSMRNMTDBUDB-UHFFFAOYSA-N	0	3	331.460	3.199	20	30		EGEDHN
C/C(=C\C(=O)N1CCC[C@H](N(C)Cc2cccc(C#N)c2)C1)C1CC1	ZINC001027313383	1325464456	/nfs/dbraw/zinc/46/44/56/1325464456.db2.gz	DRWLNEBERAZTQQ-PRDNPTHXSA-N	0	3	337.467	3.337	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1c(C)noc1C1CC1)C2	ZINC000964371763	1325496030	/nfs/dbraw/zinc/49/60/30/1325496030.db2.gz	HMNJRBNNLVYRRL-UHFFFAOYSA-N	0	3	349.862	3.244	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)CCC2CC2)C1	ZINC001027338647	1325498816	/nfs/dbraw/zinc/49/88/16/1325498816.db2.gz	MORFCEBPJXPCDU-LJQANCHMSA-N	0	3	325.456	3.171	20	30		EGEDHN
CN(Cc1ccc(Cl)cc1)[C@@H]1CCCN(C(=O)C#CC2CC2)C1	ZINC001027405377	1327633124	/nfs/dbraw/zinc/63/31/24/1327633124.db2.gz	GMJZZMXKJBKTGJ-GOSISDBHSA-N	0	3	330.859	3.176	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)C2(C(F)F)CC2)C1	ZINC001027413293	1327640853	/nfs/dbraw/zinc/64/08/53/1327640853.db2.gz	MACDWKBEVZUALG-INIZCTEOSA-N	0	3	347.409	3.026	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@@H](N(C)Cc2cccc(C#N)c2)C1)C1CCC1	ZINC001027460839	1327707403	/nfs/dbraw/zinc/70/74/03/1327707403.db2.gz	PJTIYXWZFREQOF-OXQOHEQNSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001027521699	1327793966	/nfs/dbraw/zinc/79/39/66/1327793966.db2.gz	JWNXQKMJFGXBMG-GOSISDBHSA-N	0	3	325.456	3.193	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H](N(C)CCn2nc(C)cc2C)C1	ZINC001027560105	1327876076	/nfs/dbraw/zinc/87/60/76/1327876076.db2.gz	PUMHOXJLBDFOIK-ICSRJNTNSA-N	0	3	346.519	3.025	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H](N(C)Cc3ccc(C)nc3C)C2)C1	ZINC001027565712	1327890691	/nfs/dbraw/zinc/89/06/91/1327890691.db2.gz	AUOGMSWPTPLHTD-IBGZPJMESA-N	0	3	341.499	3.478	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N1CCC[C@H](N(C)Cc2csc(C)c2)C1	ZINC001027586391	1327924567	/nfs/dbraw/zinc/92/45/67/1327924567.db2.gz	ZWIDHECJWUYFBU-KSZLIROESA-N	0	3	348.512	3.070	20	30		EGEDHN
N#Cc1c[nH]c(C(=O)NC[C@H]2CCCN2Cc2ccc(C3CC3)cc2)c1	ZINC001027815657	1328267010	/nfs/dbraw/zinc/26/70/10/1328267010.db2.gz	YXOUSLVXMSWYMF-LJQANCHMSA-N	0	3	348.450	3.158	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2ccoc2C(F)(F)F)C1	ZINC000966389915	1328288535	/nfs/dbraw/zinc/28/85/35/1328288535.db2.gz	SYLXTDMTMNRUPI-WCQYABFASA-N	0	3	330.350	3.315	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2ccccc2-c2cn[nH]c2)C1	ZINC000966637857	1328364576	/nfs/dbraw/zinc/36/45/76/1328364576.db2.gz	ZFUWSHLINXFGSR-DNVCBOLYSA-N	0	3	338.455	3.093	20	30		EGEDHN
C#CCCN1CCC[C@H]1CNC(=O)c1oc2c(cccc2F)c1C	ZINC001027932498	1328411789	/nfs/dbraw/zinc/41/17/89/1328411789.db2.gz	DJGGQFRIYAHYIS-AWEZNQCLSA-N	0	3	328.387	3.098	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1cc(C)nn1C(CC)CC	ZINC001027981944	1328453970	/nfs/dbraw/zinc/45/39/70/1328453970.db2.gz	IZXGCTFGQMIDFO-QGZVFWFLSA-N	0	3	332.492	3.323	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1cc(SC)ccc1Cl	ZINC000931891576	1329768790	/nfs/dbraw/zinc/76/87/90/1329768790.db2.gz	BJFKGHYZBGHTBU-UHFFFAOYSA-N	0	3	325.865	3.139	20	30		EGEDHN
C=CCC[C@H](O)CN[C@@H]1CCOc2ccc(Br)cc21	ZINC000932211327	1329796581	/nfs/dbraw/zinc/79/65/81/1329796581.db2.gz	XZTXSWKUQNRVDF-GXTWGEPZSA-N	0	3	326.234	3.189	20	30		EGEDHN
C(#CCN[C@@H](c1ccccn1)C1CC1)CN[C@@H](c1ccccn1)C1CC1	ZINC000932384829	1329810863	/nfs/dbraw/zinc/81/08/63/1329810863.db2.gz	WXQNASHSHIJJDC-FGZHOGPDSA-N	0	3	346.478	3.262	20	30		EGEDHN
C[C@@H]1CN(Cc2cccc(C#N)c2)CC[C@H]1NC(=O)C1C=CC=CC=C1	ZINC000942090887	1331825309	/nfs/dbraw/zinc/82/53/09/1331825309.db2.gz	FJVHUUIMQHGYNZ-DYESRHJHSA-N	0	3	347.462	3.183	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3c([nH]2)c(F)ccc3C)[C@H](C)C1	ZINC000942205670	1331879133	/nfs/dbraw/zinc/87/91/33/1331879133.db2.gz	VLMKQEGVOKGUCQ-PBHICJAKSA-N	0	3	341.430	3.079	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2scnc2C2CCCC2)[C@H](C)C1	ZINC000942304781	1331899164	/nfs/dbraw/zinc/89/91/64/1331899164.db2.gz	RLYGULGAWWHAOY-UKRRQHHQSA-N	0	3	333.501	3.427	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3ccccc3s2)[C@@H](C)C1	ZINC000942315197	1331901713	/nfs/dbraw/zinc/90/17/13/1331901713.db2.gz	SPTOENFJAXXKLW-GOEBONIOSA-N	0	3	326.465	3.365	20	30		EGEDHN
C[C@H]1CN(Cc2ccc(C#N)cc2)CC[C@@H]1NC(=O)C1(C)CCCC1	ZINC000942540067	1331964666	/nfs/dbraw/zinc/96/46/66/1331964666.db2.gz	GRHSBTFIAUOPEW-LPHOPBHVSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3c(ccc(C)c3C)[nH]2)[C@H](C)C1	ZINC000942557845	1331972311	/nfs/dbraw/zinc/97/23/11/1331972311.db2.gz	NXBKYQGSGXYRSR-CRAIPNDOSA-N	0	3	337.467	3.248	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3scnc3C)C[C@H]2C)C1	ZINC000942602644	1332000899	/nfs/dbraw/zinc/00/08/99/1332000899.db2.gz	LUXRURDFFYCQJK-HIFRSBDPSA-N	0	3	333.501	3.134	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(Cl)cc2Cl)[C@@H](C)C1	ZINC000944304847	1332367994	/nfs/dbraw/zinc/36/79/94/1332367994.db2.gz	LQLFZKKYFAKVEL-NHYWBVRUSA-N	0	3	325.239	3.067	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc3[nH]c(C)c(C)c3c2)[C@H](C)C1	ZINC000944892222	1332445567	/nfs/dbraw/zinc/44/55/67/1332445567.db2.gz	YZLYRQPKSUFHGI-AUUYWEPGSA-N	0	3	337.467	3.248	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2c(C)oc3ccccc32)[C@H](C)C1	ZINC000946315067	1332786248	/nfs/dbraw/zinc/78/62/48/1332786248.db2.gz	WKTGQXVXCPTZNK-DNVCBOLYSA-N	0	3	338.451	3.134	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)C3(F)CCCC3)CC[C@@H]2C1	ZINC000946653859	1332871573	/nfs/dbraw/zinc/87/15/73/1332871573.db2.gz	JUWBRWPPUWVXKZ-GASCZTMLSA-N	0	3	328.859	3.192	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)Cc3occc3C)CC[C@@H]2C1	ZINC000946766857	1332895857	/nfs/dbraw/zinc/89/58/57/1332895857.db2.gz	DHUORLYNHZYWTK-IYBDPMFKSA-N	0	3	336.863	3.053	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@H]3[C@H]4[C@@H]3[C@@H]3CC[C@H]4C3)CC[C@@H]2C1	ZINC000946908824	1332931507	/nfs/dbraw/zinc/93/15/07/1332931507.db2.gz	QRNDSSVMEQKFOE-FYQUFESYSA-N	0	3	348.918	3.201	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2ccccc2)CCN1Cc1ccc(C#N)cc1	ZINC000947005195	1332967497	/nfs/dbraw/zinc/96/74/97/1332967497.db2.gz	LUQBMODWDYAUOW-OXQOHEQNSA-N	0	3	333.435	3.341	20	30		EGEDHN
Cc1ccncc1C(=O)N[C@H]1CCN(Cc2cccc(C#N)c2)[C@H](C)C1	ZINC000947157976	1333028441	/nfs/dbraw/zinc/02/84/41/1333028441.db2.gz	STDZKRXHTPOUDN-APWZRJJASA-N	0	3	348.450	3.045	20	30		EGEDHN
Cc1cnccc1C(=O)N[C@@H]1CCN(Cc2cccc(C#N)c2)[C@H](C)C1	ZINC000947280627	1333075883	/nfs/dbraw/zinc/07/58/83/1333075883.db2.gz	DKVDPNPOBPHHHR-VQIMIIECSA-N	0	3	348.450	3.045	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cscc2C(F)F)C[C@@H]1C	ZINC000947318192	1333086640	/nfs/dbraw/zinc/08/66/40/1333086640.db2.gz	FKFOONKSTSDJEJ-NWDGAFQWSA-N	0	3	326.412	3.292	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(F)cc3ccncc32)C[C@H]1C	ZINC000947318229	1333086801	/nfs/dbraw/zinc/08/68/01/1333086801.db2.gz	FVSBVSDILJVYIK-CZUORRHYSA-N	0	3	327.403	3.143	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)C2C=CC=CC=C2)CCN1Cc1cccc(C#N)c1	ZINC000947360575	1333102371	/nfs/dbraw/zinc/10/23/71/1333102371.db2.gz	HBVSQQWTSRCGLD-UWJYYQICSA-N	0	3	347.462	3.326	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3ccccc3nc2C)C[C@@H]1C	ZINC000947365057	1333104615	/nfs/dbraw/zinc/10/46/15/1333104615.db2.gz	HGYXYIYVFMUCLM-MAUKXSAKSA-N	0	3	335.451	3.149	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2csc(C(F)(F)F)c2)C[C@@H]1C	ZINC000947497544	1333147510	/nfs/dbraw/zinc/14/75/10/1333147510.db2.gz	JHBXCDNZHGLQLU-WCQYABFASA-N	0	3	344.402	3.373	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(OC)c(C(C)C)c2)C[C@H]1C	ZINC000947506170	1333149403	/nfs/dbraw/zinc/14/94/03/1333149403.db2.gz	KYGXVPWXCJFXKJ-WBVHZDCISA-N	0	3	328.456	3.035	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(-n3cccc3)cc2)C[C@@H]1C	ZINC000947512070	1333151472	/nfs/dbraw/zinc/15/14/72/1333151472.db2.gz	TUHOZXUJMGSRMR-PKOBYXMFSA-N	0	3	335.451	3.083	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3cccc(C)c3)CCC2)C[C@H]1C	ZINC000947602217	1333189594	/nfs/dbraw/zinc/18/95/94/1333189594.db2.gz	JCWJXMALNXAATL-QUCCMNQESA-N	0	3	338.495	3.409	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(F)c(Cl)cc2F)C[C@H]1C	ZINC000947674994	1333217909	/nfs/dbraw/zinc/21/79/09/1333217909.db2.gz	DPKIDFAAGMXRQI-MNOVXSKESA-N	0	3	328.790	3.387	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCN(CCc3ccns3)[C@H](C)C2)CC1	ZINC000947685943	1333223052	/nfs/dbraw/zinc/22/30/52/1333223052.db2.gz	QPWZRZVPEWHTBN-WBVHZDCISA-N	0	3	347.528	3.401	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)C2CC3(CC3)C2)CCN1Cc1ccc(C#N)cc1	ZINC000947701302	1333230616	/nfs/dbraw/zinc/23/06/16/1333230616.db2.gz	AEWGIVMTQYLDHE-DNVCBOLYSA-N	0	3	337.467	3.218	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C(C)(C)c2cccc(Cl)c2)C[C@@H]1C	ZINC000947758248	1333253631	/nfs/dbraw/zinc/25/36/31/1333253631.db2.gz	KSEJTODGCQOPOD-WMLDXEAASA-N	0	3	332.875	3.220	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cnc(CC(C)(C)C)s2)C[C@@H]1C	ZINC000947903010	1333299747	/nfs/dbraw/zinc/29/97/47/1333299747.db2.gz	BCXSCMHEXMCFLL-LSDHHAIUSA-N	0	3	347.528	3.338	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)nc3ccccc32)C[C@H]1C	ZINC000947997653	1333336415	/nfs/dbraw/zinc/33/64/15/1333336415.db2.gz	FAMUAYYOGAASLD-SJORKVTESA-N	0	3	335.451	3.149	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccccc2OCC2CC2)C[C@H]1C	ZINC000948061482	1333359784	/nfs/dbraw/zinc/35/97/84/1333359784.db2.gz	VBVGBKGRQJBASN-WBVHZDCISA-N	0	3	328.456	3.244	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cnc(C(C)(C)C)s2)C[C@H]1C	ZINC000948070119	1333364059	/nfs/dbraw/zinc/36/40/59/1333364059.db2.gz	MOSLRXGCPYCTRB-KGLIPLIRSA-N	0	3	333.501	3.047	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](NC(=O)c2ccccc2CN(C)C)C[C@@H]1C	ZINC000948070343	1333364944	/nfs/dbraw/zinc/36/49/44/1333364944.db2.gz	OOVORDGVTXTZNQ-DOTOQJQBSA-N	0	3	349.906	3.083	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2coc(C3CCCCC3)n2)C[C@@H]1C	ZINC000948072878	1333366063	/nfs/dbraw/zinc/36/60/63/1333366063.db2.gz	FYCAZSDCTYZZAW-DOTOQJQBSA-N	0	3	343.471	3.328	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2sc(C(C)(C)C)nc2C)C[C@H]1C	ZINC000948091180	1333372488	/nfs/dbraw/zinc/37/24/88/1333372488.db2.gz	VDLIZTACCIEXJM-HIFRSBDPSA-N	0	3	347.528	3.355	20	30		EGEDHN
CN(C(=O)C1CCC1)[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948140286	1333389419	/nfs/dbraw/zinc/38/94/19/1333389419.db2.gz	PONNTDYMALTICH-LJQANCHMSA-N	0	3	325.456	3.171	20	30		EGEDHN
CN(C(=O)C1CC=CC1)[C@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948263029	1333450090	/nfs/dbraw/zinc/45/00/90/1333450090.db2.gz	XIIYUGMWHFZWLZ-FQEVSTJZSA-N	0	3	337.467	3.337	20	30		EGEDHN
C=CCn1cccc1C(=O)N(C)[C@@H]1CCCN(C[C@@H](F)CC)CC1	ZINC000948439543	1333525782	/nfs/dbraw/zinc/52/57/82/1333525782.db2.gz	RHDFMOBBTGERSI-DLBZAZTESA-N	0	3	335.467	3.349	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cc(C)cc(OC)c2C)CC1	ZINC000948587412	1333586524	/nfs/dbraw/zinc/58/65/24/1333586524.db2.gz	ZFZSEANFHNOZLD-GOSISDBHSA-N	0	3	342.483	3.262	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cccc(-n3cccc3)c2)CC1	ZINC000948590120	1333587812	/nfs/dbraw/zinc/58/78/12/1333587812.db2.gz	IYHGSISFXUEXOQ-FQEVSTJZSA-N	0	3	349.478	3.427	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cc3ncccc3s2)CC1	ZINC000948674393	1333624059	/nfs/dbraw/zinc/62/40/59/1333624059.db2.gz	VZIPENIDYWBRIX-OAHLLOKOSA-N	0	3	341.480	3.246	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2cc(F)c(Cl)cc2F)CC1	ZINC000948729429	1333650143	/nfs/dbraw/zinc/65/01/43/1333650143.db2.gz	JMBLEFZMVWKEAA-LBPRGKRZSA-N	0	3	340.801	3.178	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)[C@@H]2CCCC(F)(F)C2)CC1	ZINC000948766150	1333669056	/nfs/dbraw/zinc/66/90/56/1333669056.db2.gz	HFWYFOYZHUFNJG-CVEARBPZSA-N	0	3	326.431	3.148	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)[C@H](C)c2cccc(C)c2)CC1	ZINC000948816907	1333695893	/nfs/dbraw/zinc/69/58/93/1333695893.db2.gz	PKPAJDWCCBTCON-UYAOXDASSA-N	0	3	326.484	3.435	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2scnc2C(C)(C)C)CC1	ZINC000948840683	1333705523	/nfs/dbraw/zinc/70/55/23/1333705523.db2.gz	LUEIAYPNTHPPEP-OAHLLOKOSA-N	0	3	347.528	3.390	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@@H]1c2ccccc2CCN1CC1CC1	ZINC000948923679	1333736266	/nfs/dbraw/zinc/73/62/66/1333736266.db2.gz	PPSRLHSJGDUANP-OAQYLSRUSA-N	0	3	349.478	3.413	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccc(Cl)c(C)c1)CCO2	ZINC000949177155	1333789456	/nfs/dbraw/zinc/78/94/56/1333789456.db2.gz	JJANQQREEZEFKR-UHFFFAOYSA-N	0	3	348.874	3.141	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C3CCCCC3)CC2)C1	ZINC000949285657	1333815367	/nfs/dbraw/zinc/81/53/67/1333815367.db2.gz	QFEUFXXAUPRPLE-UHFFFAOYSA-N	0	3	334.504	3.226	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3c(C)cccc3C)CC2)C1	ZINC000949480503	1333858811	/nfs/dbraw/zinc/85/88/11/1333858811.db2.gz	QQQBCNJJEOTEMX-UHFFFAOYSA-N	0	3	342.483	3.187	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2cc3c([nH]2)c(F)ccc3C)C1	ZINC000967064532	1335652750	/nfs/dbraw/zinc/65/27/50/1335652750.db2.gz	UQBZTBKBEIOXTK-RDTXWAMCSA-N	0	3	341.430	3.079	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)Cc2ccc(CCCC)cc2)C1	ZINC000967252456	1335678473	/nfs/dbraw/zinc/67/84/73/1335678473.db2.gz	DPRPIAFNTPQVRT-WIYYLYMNSA-N	0	3	340.511	3.422	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2coc3ccc(OC)cc23)C1	ZINC000967308154	1335695290	/nfs/dbraw/zinc/69/52/90/1335695290.db2.gz	CKPCJUUXWYWTRD-KBXCAEBGSA-N	0	3	342.439	3.458	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2ccc(C)nc2C2CC2)C1	ZINC000967438079	1335739455	/nfs/dbraw/zinc/73/94/55/1335739455.db2.gz	TYOWFZPOKCDNCJ-KBXCAEBGSA-N	0	3	327.472	3.284	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](C)[C@@H](NC(=O)c2nc(Cl)cs2)C1	ZINC000968016712	1335844698	/nfs/dbraw/zinc/84/46/98/1335844698.db2.gz	MEKUHMHLVARUKT-NEPJUHHUSA-N	0	3	327.881	3.203	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2cc(Br)co2)C1	ZINC000968386433	1335914144	/nfs/dbraw/zinc/91/41/44/1335914144.db2.gz	IWBWTHYBBXVCDA-WCQYABFASA-N	0	3	341.249	3.058	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2ccc(OCC)c(C)c2)C1	ZINC000968375387	1335908924	/nfs/dbraw/zinc/90/89/24/1335908924.db2.gz	WECYKEXPEBSEMP-YJBOKZPZSA-N	0	3	330.472	3.410	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)Cc2ccccc2OC(C)C)C1	ZINC000968413947	1335923794	/nfs/dbraw/zinc/92/37/94/1335923794.db2.gz	NREHSRVDDVOTGJ-IEBWSBKVSA-N	0	3	344.499	3.419	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cccc(C(C)(C)C)c2)C1	ZINC000968453754	1335929904	/nfs/dbraw/zinc/92/99/04/1335929904.db2.gz	GGAWEYPHDAEKMY-APWZRJJASA-N	0	3	326.484	3.448	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccc3sccc3c2)C1	ZINC000968489674	1335939309	/nfs/dbraw/zinc/93/93/09/1335939309.db2.gz	SGAJDLIGXICJCC-PBHICJAKSA-N	0	3	326.465	3.365	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C)[C@H](NC(=O)c2cccc3nc(C)[nH]c32)C1	ZINC000968508549	1335947192	/nfs/dbraw/zinc/94/71/92/1335947192.db2.gz	AZKBIOQTXNQNAC-MEDUHNTESA-N	0	3	346.862	3.064	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](C)[C@@H](NC(=O)c2cnc(C3CC3)s2)C1	ZINC000968565602	1335961120	/nfs/dbraw/zinc/96/11/20/1335961120.db2.gz	HRCUMPRRIXBSNS-HIFRSBDPSA-N	0	3	333.501	3.427	20	30		EGEDHN
CC(C)(CC(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1)C1CC1	ZINC000968589891	1335976357	/nfs/dbraw/zinc/97/63/57/1335976357.db2.gz	OPPWWQYCCJDUAQ-QGZVFWFLSA-N	0	3	343.446	3.214	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)Cc2ccc3ccccc3c2)C1	ZINC000968627496	1335989382	/nfs/dbraw/zinc/98/93/82/1335989382.db2.gz	IXNYBRKFBXEDCM-DYESRHJHSA-N	0	3	334.463	3.232	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2cnc(C(C)(C)C)s2)C1	ZINC000968681604	1336008546	/nfs/dbraw/zinc/00/85/46/1336008546.db2.gz	KKRQBQMRUICRFS-UONOGXRCSA-N	0	3	335.517	3.457	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cnc(CC(C)C)s2)C1	ZINC000968695738	1336015832	/nfs/dbraw/zinc/01/58/32/1336015832.db2.gz	VJILIHUBLVVJGA-CABCVRRESA-N	0	3	335.517	3.358	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)C2(c3ccccc3C)CC2)C1	ZINC000968706757	1336018864	/nfs/dbraw/zinc/01/88/64/1336018864.db2.gz	UIPXBIMLKMUMTB-HKUYNNGSSA-N	0	3	326.484	3.429	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccc(C(C)(F)F)cc2)C1	ZINC000968710646	1336019871	/nfs/dbraw/zinc/01/98/71/1336019871.db2.gz	RWAROMGJJNGYGA-YOEHRIQHSA-N	0	3	334.410	3.262	20	30		EGEDHN
N#Cc1ccc(CN2CCCCC[C@H]2CNC(=O)c2cccnc2)cc1	ZINC000968722961	1336024123	/nfs/dbraw/zinc/02/41/23/1336024123.db2.gz	TVSRBDGDDBZBTK-FQEVSTJZSA-N	0	3	348.450	3.128	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H](NCc2c(C)nsc2C)C1	ZINC000968795518	1336054321	/nfs/dbraw/zinc/05/43/21/1336054321.db2.gz	QYWRTYDDEZEOFR-CYBMUJFWSA-N	0	3	341.908	3.229	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)[C@H]1CCc2ccc(OC)cc21	ZINC000968890600	1336081503	/nfs/dbraw/zinc/08/15/03/1336081503.db2.gz	LQKMQISQKOGVLX-HKUYNNGSSA-N	0	3	342.483	3.272	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)[C@@H]1CCc2cc(F)ccc21	ZINC000968952697	1336101893	/nfs/dbraw/zinc/10/18/93/1336101893.db2.gz	WXFPIVHNOCWOCG-IEBWSBKVSA-N	0	3	330.447	3.402	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1c(OC)cccc1OC	ZINC000969127492	1336153094	/nfs/dbraw/zinc/15/30/94/1336153094.db2.gz	YCKWSVQKOJNNDC-MRXNPFEDSA-N	0	3	346.471	3.254	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1[nH]c2ccccc2c1OC	ZINC000969160528	1336167064	/nfs/dbraw/zinc/16/70/64/1336167064.db2.gz	GHZDTUPBPNBCSC-HNNXBMFYSA-N	0	3	341.455	3.337	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(C(=O)C3(C4CCC4)CCC3)C2)s1	ZINC000969485477	1336217480	/nfs/dbraw/zinc/21/74/80/1336217480.db2.gz	MALALDSNXJSVNB-OAHLLOKOSA-N	0	3	343.496	3.281	20	30		EGEDHN
CC1(C(=O)N2CC[C@@H](NCc3ccc(F)c(C#N)c3)C2)CCCCC1	ZINC000969811867	1336250320	/nfs/dbraw/zinc/25/03/20/1336250320.db2.gz	VDSVOCURBIHDDZ-QGZVFWFLSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)c2cn(CC)c3ccccc23)C1	ZINC000970105653	1336280417	/nfs/dbraw/zinc/28/04/17/1336280417.db2.gz	RGWYDJVGBJQGNX-OAHLLOKOSA-N	0	3	325.456	3.287	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H](C)C2CN([C@@H](C)c3cccc(C)c3)C2)c1	ZINC000970400902	1336304046	/nfs/dbraw/zinc/30/40/46/1336304046.db2.gz	HSZKDIIDRUASOS-IRXDYDNUSA-N	0	3	347.462	3.183	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)c2cc(F)c3ncccc3c2)C1	ZINC000970593055	1336325330	/nfs/dbraw/zinc/32/53/30/1336325330.db2.gz	FRMQPFDFCUNEBM-ZDUSSCGKSA-N	0	3	327.403	3.000	20	30		EGEDHN
C#CCCN1CC([C@H](C)NC(=O)c2ccc(Cl)c3occc32)C1	ZINC000970727507	1336335971	/nfs/dbraw/zinc/33/59/71/1336335971.db2.gz	YXAUVQKVJTXWNU-LBPRGKRZSA-N	0	3	330.815	3.160	20	30		EGEDHN
C#CCCN1CCC(N(C)C(=O)c2snc(Cl)c2Cl)CC1	ZINC001005453655	1336352976	/nfs/dbraw/zinc/35/29/76/1336352976.db2.gz	MGDQWDQDWYMSRV-UHFFFAOYSA-N	0	3	346.283	3.010	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)C2(c3ccc(F)cc3)CCC2)CC1	ZINC001005802940	1336403230	/nfs/dbraw/zinc/40/32/30/1336403230.db2.gz	KTRVIOFDZAHRPD-UHFFFAOYSA-N	0	3	330.447	3.356	20	30		EGEDHN
CN(C(=O)[C@@]1(C)C=CCC1)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001005842265	1336407501	/nfs/dbraw/zinc/40/75/01/1336407501.db2.gz	UVQOLVPPDSTYCG-NRFANRHFSA-N	0	3	337.467	3.337	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)C(C)(C)c2cccc(OC)c2)CC1	ZINC001006241962	1336474885	/nfs/dbraw/zinc/47/48/85/1336474885.db2.gz	YBFKUICWSGWPSM-UHFFFAOYSA-N	0	3	330.472	3.082	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2ccc3nc(C)sc3c2)CC1	ZINC001006241568	1336474912	/nfs/dbraw/zinc/47/49/12/1336474912.db2.gz	ONAUQPHBYRQTDA-UHFFFAOYSA-N	0	3	329.469	3.327	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccc(OCC)c(OC)c2)CC1	ZINC001006393301	1336498753	/nfs/dbraw/zinc/49/87/53/1336498753.db2.gz	ODEVLZCRQVSTIW-UHFFFAOYSA-N	0	3	346.471	3.206	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)C2CC(c3cccc(F)c3)C2)CC1	ZINC001006481961	1336515375	/nfs/dbraw/zinc/51/53/75/1336515375.db2.gz	WBWCBBFUYMIGAR-UHFFFAOYSA-N	0	3	330.447	3.428	20	30		EGEDHN
C#CCCN1CCC[C@@H](NC(=O)c2ccccc2CC(C)(C)C)C1	ZINC001007569566	1336670034	/nfs/dbraw/zinc/67/00/34/1336670034.db2.gz	MAOJJGSQQFVVEC-GOSISDBHSA-N	0	3	326.484	3.493	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)Cc2ccccc2OC(C)C)C1	ZINC001008864232	1336933987	/nfs/dbraw/zinc/93/39/87/1336933987.db2.gz	UPVWLCYWGDXMCX-GOSISDBHSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2cnn(CCCC)c2CC)C1	ZINC001009141198	1336975986	/nfs/dbraw/zinc/97/59/86/1336975986.db2.gz	XVESNUZLJUIYSG-MRXNPFEDSA-N	0	3	332.492	3.016	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCN([C@@H](C)c3ccccc3C)C2)nc1	ZINC001009254383	1336991420	/nfs/dbraw/zinc/99/14/20/1336991420.db2.gz	QZHHLPMBSAMFRK-HKUYNNGSSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN(Cc3ccccc3CC)C2)nc1	ZINC001009255114	1336991851	/nfs/dbraw/zinc/99/18/51/1336991851.db2.gz	ULLDQYYMTCHAOR-HXUWFJFHSA-N	0	3	347.462	3.020	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN([C@H](C)c3ccccc3)C2)nc1	ZINC001009270138	1336994555	/nfs/dbraw/zinc/99/45/55/1336994555.db2.gz	QYAGEDAWQDDKNZ-VQIMIIECSA-N	0	3	333.435	3.018	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCN(Cc3ccccc3CC)C2)cn1	ZINC001009272651	1336994737	/nfs/dbraw/zinc/99/47/37/1336994737.db2.gz	YRQADGHRCVXQBY-NRFANRHFSA-N	0	3	347.462	3.020	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CCN(Cc2ccc(C)cc2C)C1	ZINC001014731378	1337890211	/nfs/dbraw/zinc/89/02/11/1337890211.db2.gz	LILAIVAOISFJRJ-IBGZPJMESA-N	0	3	337.467	3.295	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCN(Cc3cccc(N(C)C)c3)C2)CC1	ZINC001015660005	1338239658	/nfs/dbraw/zinc/23/96/58/1338239658.db2.gz	PBQZCXPNRQHQCE-IBGZPJMESA-N	0	3	341.499	3.190	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(CC[C@@H]3CCCC3(F)F)C2)C1	ZINC001015677493	1338253683	/nfs/dbraw/zinc/25/36/83/1338253683.db2.gz	WGWNHFMGDAXSOP-GJZGRUSLSA-N	0	3	326.431	3.359	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N[C@@H]1CCN(CC2=CCCCC2)C1	ZINC001015816360	1338325550	/nfs/dbraw/zinc/32/55/50/1338325550.db2.gz	KELKMFRTFHTBQB-QYZOEREBSA-N	0	3	332.488	3.049	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccc(CCC)s2)CC1	ZINC001016641439	1338673609	/nfs/dbraw/zinc/67/36/09/1338673609.db2.gz	AOQBXDUWZTWCHD-QGZVFWFLSA-N	0	3	330.497	3.308	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2scc(C)c2Cl)CC1	ZINC001016639984	1338673753	/nfs/dbraw/zinc/67/37/53/1338673753.db2.gz	FIDSFNFUFGNCPE-ZDUSSCGKSA-N	0	3	336.888	3.318	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)[C@H]2CC[C@H](C3CCC3)CC2)CC1	ZINC001016667665	1338685792	/nfs/dbraw/zinc/68/57/92/1338685792.db2.gz	ODALQKYGJWVXCX-FHWLQOOXSA-N	0	3	328.500	3.197	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2oc(C(F)F)cc2C)CC1	ZINC001016669343	1338686105	/nfs/dbraw/zinc/68/61/05/1338686105.db2.gz	AQLHOCBGIDIFPS-CQSZACIVSA-N	0	3	336.382	3.133	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2cc3c(cc(C)cc3C)[nH]2)CC1	ZINC001016753218	1338712651	/nfs/dbraw/zinc/71/26/51/1338712651.db2.gz	JDIQCPODWCGAOJ-IBGZPJMESA-N	0	3	335.451	3.002	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(Cl)c(F)c2)CC1	ZINC001016843227	1338743724	/nfs/dbraw/zinc/74/37/24/1338743724.db2.gz	NGKZMPSVGMFXIG-INIZCTEOSA-N	0	3	334.822	3.087	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)Cc2c[nH]c3c2cccc3C)CC1	ZINC001016856742	1338749042	/nfs/dbraw/zinc/74/90/42/1338749042.db2.gz	TUEWSOBYXSEUJZ-IBGZPJMESA-N	0	3	349.478	3.013	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)C23CCC(CC2)C3(C)C)CC1	ZINC001016865374	1338751914	/nfs/dbraw/zinc/75/19/14/1338751914.db2.gz	BJJHRQNNWFKKKG-BQIYRTECSA-N	0	3	328.500	3.197	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2[nH]ccc2-c2ccccc2)CC1	ZINC001016928386	1338773495	/nfs/dbraw/zinc/77/34/95/1338773495.db2.gz	XEPIUUNWOWVNJB-IBGZPJMESA-N	0	3	347.462	3.289	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccc3c(c2)CCCC3)CC1	ZINC001016957395	1338784268	/nfs/dbraw/zinc/78/42/68/1338784268.db2.gz	WSLCHGFWFUIFJK-HXUWFJFHSA-N	0	3	336.479	3.173	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cc(C)c(F)c(C)c2)CC1	ZINC001016979732	1338790686	/nfs/dbraw/zinc/79/06/86/1338790686.db2.gz	SACTUQSUCVWFLU-KRWDZBQOSA-N	0	3	328.431	3.050	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cc3cccc(F)c3o2)CC1	ZINC001016986243	1338793415	/nfs/dbraw/zinc/79/34/15/1338793415.db2.gz	ONRMGRPITCNHDS-QGZVFWFLSA-N	0	3	340.398	3.180	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)[C@@H](C)c2cccc(Cl)c2)CC1	ZINC001016988440	1338794432	/nfs/dbraw/zinc/79/44/32/1338794432.db2.gz	ZXYBKLWWOUYMOZ-YOEHRIQHSA-N	0	3	330.859	3.047	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccccc2CC(C)C)CC1	ZINC001016993947	1338797249	/nfs/dbraw/zinc/79/72/49/1338797249.db2.gz	QNIXMMZCXHNGLR-FQEVSTJZSA-N	0	3	338.495	3.493	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(C(C)(F)F)cc2)CC1	ZINC001017001976	1338800218	/nfs/dbraw/zinc/80/02/18/1338800218.db2.gz	JLUXWQNKYKMGAB-INIZCTEOSA-N	0	3	332.394	3.016	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H](CN(C)Cc2cnoc2C)C1	ZINC001017202471	1338947843	/nfs/dbraw/zinc/94/78/43/1338947843.db2.gz	XSEXQTOSMYCNBD-QFBILLFUSA-N	0	3	333.476	3.256	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2oc(C)nc2c1	ZINC001017650249	1339382739	/nfs/dbraw/zinc/38/27/39/1339382739.db2.gz	JMRRNPVRBQZVDU-CALCHBBNSA-N	0	3	339.439	3.391	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cc(C)ccc1OC	ZINC001017713464	1339398647	/nfs/dbraw/zinc/39/86/47/1339398647.db2.gz	MGUITUOFLFHRQU-CALCHBBNSA-N	0	3	328.456	3.259	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2c(c1)CCOC2	ZINC001017726823	1339404550	/nfs/dbraw/zinc/40/45/50/1339404550.db2.gz	WVFDOMDJXOJPPT-BGYRXZFFSA-N	0	3	340.467	3.014	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1CCc2cc(F)ccc21	ZINC001017738887	1339408186	/nfs/dbraw/zinc/40/81/86/1339408186.db2.gz	AXAXYABZNLFPLB-NSHGMRRFSA-N	0	3	342.458	3.497	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1C[C@]12CCc1ccccc12	ZINC001018122076	1339506174	/nfs/dbraw/zinc/50/61/74/1339506174.db2.gz	FEHYQVMWNRFEKU-MXKPZRPRSA-N	0	3	336.479	3.142	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H]1CCc2ccccc2C1	ZINC001018212396	1339534989	/nfs/dbraw/zinc/53/49/89/1339534989.db2.gz	ZUGZIXAAMWOPDV-UIFIKXQLSA-N	0	3	338.495	3.433	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cccc2cnccc21	ZINC001018268864	1339555984	/nfs/dbraw/zinc/55/59/84/1339555984.db2.gz	ASERXIXXXIBDIZ-HDICACEKSA-N	0	3	335.451	3.490	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)Cc1cccc(F)c1	ZINC001018336027	1339582502	/nfs/dbraw/zinc/58/25/02/1339582502.db2.gz	XALQVROCQBBDBZ-ZYSHUDEJSA-N	0	3	330.447	3.256	20	30		EGEDHN
N#Cc1cc(CN[C@H]2CCN(C(=O)CC3CCCCC3)C2)ccc1F	ZINC001018468724	1339631461	/nfs/dbraw/zinc/63/14/61/1339631461.db2.gz	PILBMANODFAZOL-SFHVURJKSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@H](NCc2ccc(C#N)s2)C1	ZINC001018910572	1339750849	/nfs/dbraw/zinc/75/08/49/1339750849.db2.gz	VZTYRAYZHWRFIC-LBPRGKRZSA-N	0	3	337.876	3.089	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@H](NCc2c(C)nsc2C)C1	ZINC001018910387	1339750720	/nfs/dbraw/zinc/75/07/20/1339750720.db2.gz	QYWRTYDDEZEOFR-ZDUSSCGKSA-N	0	3	341.908	3.229	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001018910521	1339750737	/nfs/dbraw/zinc/75/07/37/1339750737.db2.gz	UIAYPQZEWVPAAC-HNNXBMFYSA-N	0	3	349.837	3.167	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@H]2CCCN2Cc2cccc(CC)c2)c1	ZINC001028126797	1340445312	/nfs/dbraw/zinc/44/53/12/1340445312.db2.gz	PXLDBSLUCYNQRW-OAQYLSRUSA-N	0	3	347.462	3.020	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1cc(F)cc2cccnc21	ZINC001028178454	1340469867	/nfs/dbraw/zinc/46/98/67/1340469867.db2.gz	RDKNDIJIZWYVCY-INIZCTEOSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1c[nH]nc1C1CCCCC1	ZINC001028252741	1340514266	/nfs/dbraw/zinc/51/42/66/1340514266.db2.gz	BDUVOLMPUXPLDZ-MRXNPFEDSA-N	0	3	330.476	3.228	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@H]2CCN(Cc3cccc(C#N)c3)C2)s1	ZINC001028376239	1340604096	/nfs/dbraw/zinc/60/40/96/1340604096.db2.gz	VIETYGQYWWRXIC-QGZVFWFLSA-N	0	3	339.464	3.180	20	30		EGEDHN
Cc1csc(C(=O)NC[C@H]2CCN(Cc3ccc(C#N)cc3)C2)c1	ZINC001028529031	1340689312	/nfs/dbraw/zinc/68/93/12/1340689312.db2.gz	UNIXNCNDABXTQF-QGZVFWFLSA-N	0	3	339.464	3.180	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)c2ccc3c4c(cccc42)CC3)C1	ZINC001028671673	1340749932	/nfs/dbraw/zinc/74/99/32/1340749932.db2.gz	NYWIJWFLKXQKDB-INIZCTEOSA-N	0	3	332.447	3.013	20	30		EGEDHN
CCc1ccccc1C(=O)NC[C@H]1CCN(Cc2ccc(C#N)cc2)C1	ZINC001028767767	1340799165	/nfs/dbraw/zinc/79/91/65/1340799165.db2.gz	JXPJGBLJISXAJN-LJQANCHMSA-N	0	3	347.462	3.373	20	30		EGEDHN
CCc1ccccc1C(=O)NC[C@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC001028767375	1340799765	/nfs/dbraw/zinc/79/97/65/1340799765.db2.gz	FEDMBBSNNQTISN-LJQANCHMSA-N	0	3	347.462	3.373	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)c2cc3cc(F)ccc3s2)C1	ZINC001028979009	1340899775	/nfs/dbraw/zinc/89/97/75/1340899775.db2.gz	NHRADIIMICJCKB-CYBMUJFWSA-N	0	3	330.428	3.115	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)C1CCN(C(=O)C2CCC2)CC1	ZINC001029036552	1340913824	/nfs/dbraw/zinc/91/38/24/1340913824.db2.gz	NEIXVCOYLYDBOS-HNNXBMFYSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC(C)=CC(=O)N1CCC([C@@H](C)NCc2ccccc2C#N)CC1	ZINC001029043354	1340916459	/nfs/dbraw/zinc/91/64/59/1340916459.db2.gz	GKGXFKIDXQBUSR-MRXNPFEDSA-N	0	3	325.456	3.241	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@H]2CC[C@@H](C1)N2CC[C@@H]1CCCO1	ZINC001029322850	1340972116	/nfs/dbraw/zinc/97/21/16/1340972116.db2.gz	CJPFQOZSJHIOIF-XHSDSOJGSA-N	0	3	340.895	3.009	20	30		EGEDHN
C#Cc1ccc(C(=O)N2C[C@H]3CC[C@@H](C2)N3CCC2=CCCCC2)nc1	ZINC001029558742	1341012028	/nfs/dbraw/zinc/01/20/28/1341012028.db2.gz	SLHJPAGJICINIK-BGYRXZFFSA-N	0	3	349.478	3.242	20	30		EGEDHN
Cc1ccoc1C(=O)N1CC[C@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001029647722	1341033439	/nfs/dbraw/zinc/03/34/39/1341033439.db2.gz	QNSVRCYIYDIREW-CQSZACIVSA-N	0	3	343.452	3.115	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCN(C(=O)C2(C3CC3)CC2)C1	ZINC001029763751	1341065594	/nfs/dbraw/zinc/06/55/94/1341065594.db2.gz	LWDFSERYBLOYMJ-AWEZNQCLSA-N	0	3	343.496	3.090	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](CN(C)Cc2c(C)nsc2C)C1	ZINC001029802050	1341077768	/nfs/dbraw/zinc/07/77/68/1341077768.db2.gz	UWPPQJKKANTYGX-OAHLLOKOSA-N	0	3	335.517	3.252	20	30		EGEDHN
CC(C)=CC(=O)N1CCC(CN(C)Cc2ccc(C#N)cc2F)CC1	ZINC001029929459	1341124671	/nfs/dbraw/zinc/12/46/71/1341124671.db2.gz	UJZUUCLXRVSSEP-UHFFFAOYSA-N	0	3	343.446	3.334	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N1CCC(CN(C)Cc2ccc(C#N)cc2F)CC1	ZINC001029931407	1341125353	/nfs/dbraw/zinc/12/53/53/1341125353.db2.gz	NXGCRJASGIHKBS-KSSFIOAISA-N	0	3	343.446	3.024	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC(CN(C)Cc2cc(C#N)ccc2F)CC1	ZINC001029937207	1341128669	/nfs/dbraw/zinc/12/86/69/1341128669.db2.gz	HTQUPNGEYHUSAB-HNNXBMFYSA-N	0	3	345.462	3.414	20	30		EGEDHN
CN(Cc1cc(C#N)ccc1F)CC1CCN(C(=O)C2(C)CC2)CC1	ZINC001029967789	1341137980	/nfs/dbraw/zinc/13/79/80/1341137980.db2.gz	URQMKHFFTBXVAF-UHFFFAOYSA-N	0	3	343.446	3.168	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC(CN(C)Cc2cn(C)nc2C)CC1	ZINC001029981819	1341143509	/nfs/dbraw/zinc/14/35/09/1341143509.db2.gz	CIXUSWZLVNLPJC-UHFFFAOYSA-N	0	3	346.519	3.001	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC(CN(C)Cc2nccnc2C)CC1	ZINC001029992205	1341148994	/nfs/dbraw/zinc/14/89/94/1341148994.db2.gz	NZZATZWPGHCCHZ-HXUWFJFHSA-N	0	3	344.503	3.058	20	30		EGEDHN
CC1(C)CC(C(=O)N2CC3(C2)CCN(Cc2cccc(C#N)c2)C3)C1	ZINC001072689529	1355389433	/nfs/dbraw/zinc/38/94/33/1355389433.db2.gz	AALDTRYWWMSBBR-UHFFFAOYSA-N	0	3	337.467	3.029	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H]1CCc2cc(F)ccc21	ZINC001032524254	1341531058	/nfs/dbraw/zinc/53/10/58/1341531058.db2.gz	ZRXOFRQXVMMHSK-LNLFQRSKSA-N	0	3	328.431	3.107	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H](CC)Oc1cccc(C)c1	ZINC001032679217	1341579645	/nfs/dbraw/zinc/57/96/45/1341579645.db2.gz	JECXIBDKNLIVLY-BJLQDIEVSA-N	0	3	342.483	3.404	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1c[nH]c2cc(C)ccc12	ZINC001032679848	1341579923	/nfs/dbraw/zinc/57/99/23/1341579923.db2.gz	MJQAZGLWUUWTAX-ROUUACIJSA-N	0	3	337.467	3.270	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H](C)Cc1ccc(C)cc1	ZINC001032806030	1341619958	/nfs/dbraw/zinc/61/99/58/1341619958.db2.gz	FBRHIZJRJHSIJO-HOJAQTOUSA-N	0	3	326.484	3.425	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)[C@@H]2CC[C@H](c3ccccc3)O2)C1	ZINC001033089240	1341719434	/nfs/dbraw/zinc/71/94/34/1341719434.db2.gz	ZHOLIAGGHCIEEI-OTWHNJEPSA-N	0	3	328.456	3.016	20	30		EGEDHN
C=C(C)CCN1CC[C@H](N(C)C(=O)c2cc3ncccc3s2)C1	ZINC001033319788	1341779757	/nfs/dbraw/zinc/77/97/57/1341779757.db2.gz	BUSOKSBOSRUWDU-AWEZNQCLSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccccc2CC)C1	ZINC001033372535	1341800805	/nfs/dbraw/zinc/80/08/05/1341800805.db2.gz	GCGZQHMSBIALQH-YSIASYRMSA-N	0	3	326.484	3.461	20	30		EGEDHN
C#CCCN1CC[C@@H](N(C)C(=O)C(C)(C)c2ccc(Cl)cc2)C1	ZINC001033383350	1341805277	/nfs/dbraw/zinc/80/52/77/1341805277.db2.gz	JVWXINKSCZZYBE-QGZVFWFLSA-N	0	3	332.875	3.174	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2ccc3nccc(C)c3c2)C1	ZINC001033852533	1342044697	/nfs/dbraw/zinc/04/46/97/1342044697.db2.gz	XPTCRPDBFLMGHO-SFHVURJKSA-N	0	3	335.451	3.103	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)[C@H]2CCc3c2cccc3Cl)C1	ZINC001033902823	1342075776	/nfs/dbraw/zinc/07/57/76/1342075776.db2.gz	SBFMCHYHTHBKEG-YJBOKZPZSA-N	0	3	344.886	3.316	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)[C@@H]2C[C@H]2c2ccc(F)cc2F)C1	ZINC001033905441	1342077781	/nfs/dbraw/zinc/07/77/81/1342077781.db2.gz	AGRPTABZFSPIKB-RYQLBKOJSA-N	0	3	346.421	3.014	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@H]2COc3cc(C)c(C)cc32)C1	ZINC001033908061	1342079661	/nfs/dbraw/zinc/07/96/61/1342079661.db2.gz	LMUXGEWXHLMMAX-MJGOQNOKSA-N	0	3	342.483	3.278	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cccc(-c3cnco3)c2)C1	ZINC001034008226	1342145668	/nfs/dbraw/zinc/14/56/68/1342145668.db2.gz	UIYFMYPJMNMWFJ-GOSISDBHSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cc3c(cccc3OC)[nH]2)C1	ZINC001034037898	1342178523	/nfs/dbraw/zinc/17/85/23/1342178523.db2.gz	MXSKSXJRRVZAMW-HNNXBMFYSA-N	0	3	341.455	3.289	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccc(N(C)C)c(F)c2)C1	ZINC001034052074	1342194002	/nfs/dbraw/zinc/19/40/02/1342194002.db2.gz	GCGWEDLVTCHCAN-INIZCTEOSA-N	0	3	333.451	3.004	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cc(C)c(OC)c(C)c2)C1	ZINC001034224788	1342328272	/nfs/dbraw/zinc/32/82/72/1342328272.db2.gz	BYYFYWOIWWNKGO-GOSISDBHSA-N	0	3	330.472	3.472	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)Cc2coc3ccc(C)cc23)C1	ZINC001034228806	1342332989	/nfs/dbraw/zinc/33/29/89/1342332989.db2.gz	ACWIUXNHRQGBLI-KRWDZBQOSA-N	0	3	326.440	3.440	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N[C@@H]1CCCCN(CC(=C)C)C1	ZINC001034275260	1342367379	/nfs/dbraw/zinc/36/73/79/1342367379.db2.gz	FOJQLLZZLAGULA-QGZVFWFLSA-N	0	3	328.456	3.412	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cccc([C@H]3CCOC3)c2)C1	ZINC001034279135	1342369903	/nfs/dbraw/zinc/36/99/03/1342369903.db2.gz	IQRQHZVCDVXLJX-PMACEKPBSA-N	0	3	342.483	3.351	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)C[C@H]2CCOc3ccccc32)C1	ZINC001034347406	1342417386	/nfs/dbraw/zinc/41/73/86/1342417386.db2.gz	YQEWVXYYNWBULP-IAGOWNOFSA-N	0	3	328.456	3.100	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2csc(-c3ccco3)n2)C1	ZINC001034365149	1342435679	/nfs/dbraw/zinc/43/56/79/1342435679.db2.gz	PYPZHJFXGQYSHV-CQSZACIVSA-N	0	3	343.452	3.011	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2c(F)ccc(F)c2Cl)C1	ZINC001034419370	1342481401	/nfs/dbraw/zinc/48/14/01/1342481401.db2.gz	BKHBZBGZIVREJB-LBPRGKRZSA-N	0	3	340.801	3.226	20	30		EGEDHN
C=CCCN1CCCC[C@@H](NC(=O)c2cnc([C@@H]3CCCO3)s2)C1	ZINC001034430810	1342492944	/nfs/dbraw/zinc/49/29/44/1342492944.db2.gz	AJXSZMRPCBYHSA-CABCVRRESA-N	0	3	349.500	3.155	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)Cc2noc3ccc(F)cc23)C1	ZINC001034438315	1342500039	/nfs/dbraw/zinc/50/00/39/1342500039.db2.gz	CRRZRESFPHYPCA-OAHLLOKOSA-N	0	3	345.418	3.056	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccnc(O[C@@H](C)CC)c2)C1	ZINC001034478763	1342535181	/nfs/dbraw/zinc/53/51/81/1342535181.db2.gz	OAFYILJTRBJQJP-WMZOPIPTSA-N	0	3	345.487	3.419	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cnn(CCC(C)C)c2C)C1	ZINC001034483506	1342540757	/nfs/dbraw/zinc/54/07/57/1342540757.db2.gz	LHBHJUNADNESOR-GOSISDBHSA-N	0	3	346.519	3.398	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@H]2CCCc3sc(C)nc32)C1	ZINC001034494374	1342549969	/nfs/dbraw/zinc/54/99/69/1342549969.db2.gz	YJLKCEBOVPYEOD-HOTGVXAUSA-N	0	3	347.528	3.418	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2ccsc2C(F)(F)F)C1	ZINC001034510985	1342570427	/nfs/dbraw/zinc/57/04/27/1342570427.db2.gz	KYZARMDZCKWELU-LBPRGKRZSA-N	0	3	344.402	3.375	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N[C@H]1CC[C@H](NCc2cc(F)ccc2C#N)CC1	ZINC001034626685	1342659059	/nfs/dbraw/zinc/65/90/59/1342659059.db2.gz	ANSBKWRUXFFQPU-BZSNNMDCSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2ccc(F)cc2F)C12CCC2	ZINC001078799363	1357090566	/nfs/dbraw/zinc/09/05/66/1357090566.db2.gz	ZYDQIZDRFHMCAC-HUUCEWRRSA-N	0	3	340.801	3.348	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)Cc2cccc(F)c2)C12CCC2	ZINC001078799568	1357091061	/nfs/dbraw/zinc/09/10/61/1357091061.db2.gz	CWJOLDRWBVSSIR-JKSUJKDBSA-N	0	3	336.838	3.138	20	30		EGEDHN
CC(C)(C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)s1)C1CC1	ZINC001035023845	1342883428	/nfs/dbraw/zinc/88/34/28/1342883428.db2.gz	NNUSSKAANFSRDW-CQSZACIVSA-N	0	3	331.485	3.137	20	30		EGEDHN
O=C(c1ccco1)N1CCC2(CCN(CC#Cc3ccccc3)C2)CC1	ZINC001035149909	1342962437	/nfs/dbraw/zinc/96/24/37/1342962437.db2.gz	JVFMGUCDDLEJNI-UHFFFAOYSA-N	0	3	348.446	3.259	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC2(CCN(Cc3ccc(C#N)s3)C2)CC1	ZINC001035159476	1342977210	/nfs/dbraw/zinc/97/72/10/1342977210.db2.gz	GEZDLFRFKRZVJO-OAHLLOKOSA-N	0	3	345.512	3.480	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC2(CCN(Cc3oc(C)nc3C)C2)CC1	ZINC001035212985	1343031249	/nfs/dbraw/zinc/03/12/49/1343031249.db2.gz	BJRHVUKDDGGAHT-UHFFFAOYSA-N	0	3	345.487	3.318	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC3(CCN(Cc4ocnc4C)C3)CC2)C1	ZINC001035227582	1343048299	/nfs/dbraw/zinc/04/82/99/1343048299.db2.gz	RHYJIWPAEIYQLV-UHFFFAOYSA-N	0	3	343.471	3.154	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1c(Cl)n[nH]c1C1CC1)CC2	ZINC001035723707	1343153068	/nfs/dbraw/zinc/15/30/68/1343153068.db2.gz	ZMOYRPLUGCAHNF-UHFFFAOYSA-N	0	3	348.878	3.055	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cncc(Cl)c1C)CC2	ZINC001035726424	1343155100	/nfs/dbraw/zinc/15/51/00/1343155100.db2.gz	QGGAHRLKMXKXND-UHFFFAOYSA-N	0	3	333.863	3.158	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C[C@H](C)c1c(C)n[nH]c1C)CC2	ZINC001035735533	1343161408	/nfs/dbraw/zinc/16/14/08/1343161408.db2.gz	HPDJENQUOODDKZ-HNNXBMFYSA-N	0	3	344.503	3.021	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC3(CN(Cc4ccccc4)C3)CC2)cc1	ZINC001035763912	1343176870	/nfs/dbraw/zinc/17/68/70/1343176870.db2.gz	ABXZIZBWGGRXDM-UHFFFAOYSA-N	0	3	344.458	3.406	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC3(CN(C[C@@H]4CC[C@@H](C)O4)C3)CC2)CC1	ZINC001035787284	1343199086	/nfs/dbraw/zinc/19/90/86/1343199086.db2.gz	OFLQCQASCYIGPK-MJGOQNOKSA-N	0	3	346.515	3.225	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC3(CN(C[C@H]4CC[C@@H](C)O4)C3)CC2)CC1	ZINC001035787283	1343199345	/nfs/dbraw/zinc/19/93/45/1343199345.db2.gz	OFLQCQASCYIGPK-IEBWSBKVSA-N	0	3	346.515	3.225	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)CO[C@H]1CCCC[C@@H]1C)CC2	ZINC001035807919	1343208262	/nfs/dbraw/zinc/20/82/62/1343208262.db2.gz	XCOWNSDNHYPVSD-ROUUACIJSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc(OCC)cc1)CC2	ZINC001035844805	1343226124	/nfs/dbraw/zinc/22/61/24/1343226124.db2.gz	PNAUOIRBJBGKIO-UHFFFAOYSA-N	0	3	328.456	3.199	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)COc1ccc(C)c(C)c1)CC2	ZINC001035850082	1343229777	/nfs/dbraw/zinc/22/97/77/1343229777.db2.gz	VDKJAIUCSYCZIU-UHFFFAOYSA-N	0	3	342.483	3.183	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@@H](C)Cc1ccc(C)cc1)CC2	ZINC001035857139	1343234001	/nfs/dbraw/zinc/23/40/01/1343234001.db2.gz	HCIDXAPHCKOCFX-IBGZPJMESA-N	0	3	338.495	3.121	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@@H](NCc2ccccc2C#N)[C@H](C)C1	ZINC001035918860	1343272410	/nfs/dbraw/zinc/27/24/10/1343272410.db2.gz	KIMSDBTVOIMIKR-DNVCBOLYSA-N	0	3	327.472	3.321	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](NCc2cc(C3CC3)no2)[C@H](C)C1	ZINC001036137701	1343322982	/nfs/dbraw/zinc/32/29/82/1343322982.db2.gz	OTKSAJRHCOMDPQ-RHSMWYFYSA-N	0	3	345.487	3.481	20	30		EGEDHN
C[C@H]1CN(C(=O)C2(C)CCC2)CC[C@H]1NCc1cc(F)ccc1C#N	ZINC001036139846	1343324479	/nfs/dbraw/zinc/32/44/79/1343324479.db2.gz	AWYMIEISUGIKNV-KBXCAEBGSA-N	0	3	343.446	3.214	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@H]([C@H](C)NCc2ccccc2C#N)C1	ZINC001036339160	1343424637	/nfs/dbraw/zinc/42/46/37/1343424637.db2.gz	DOOKOMFZRXPLLI-LPHOPBHVSA-N	0	3	325.456	3.241	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCCN(C(=O)/C=C/C2CC2)C1	ZINC001036389439	1343459450	/nfs/dbraw/zinc/45/94/50/1343459450.db2.gz	ROKJPGLAGINHIQ-FQEHLOLLSA-N	0	3	337.467	3.241	20	30		EGEDHN
C[C@H](NCc1cc(F)ccc1C#N)[C@@H]1CCCN(C(=O)C2(C)CC2)C1	ZINC001036408384	1343469050	/nfs/dbraw/zinc/46/90/50/1343469050.db2.gz	IMIGKEMFFHYRAP-GOEBONIOSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@H]([C@H](C)NCc3cc(C)no3)C2)CC1	ZINC001036429125	1343481800	/nfs/dbraw/zinc/48/18/00/1343481800.db2.gz	FFYCZTKKPAHLRG-WMZOPIPTSA-N	0	3	345.487	3.446	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H]([C@H](C)NCc2nccs2)C1	ZINC001036430357	1343482801	/nfs/dbraw/zinc/48/28/01/1343482801.db2.gz	AGEJBZNNVJFRAJ-GJZGRUSLSA-N	0	3	335.517	3.462	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)C2CC=CC2)[C@@H]1CNCc1ccc(C#N)s1	ZINC001036526966	1343535700	/nfs/dbraw/zinc/53/57/00/1343535700.db2.gz	XHUHCGMJGWMCGR-RDTXWAMCSA-N	0	3	343.496	3.303	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@H]2[C@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001036632211	1343589678	/nfs/dbraw/zinc/58/96/78/1343589678.db2.gz	KAOKAGJXOYFOSY-PBHICJAKSA-N	0	3	329.469	3.009	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CN(C(=O)C4=CCCC4)CC[C@H]32)s1	ZINC001036686167	1343628616	/nfs/dbraw/zinc/62/86/16/1343628616.db2.gz	JWXTUVNEZLWIAR-CRAIPNDOSA-N	0	3	341.480	3.153	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@H]2CN(C(=O)C3=CCCC3)CC[C@H]21	ZINC001036686797	1343629575	/nfs/dbraw/zinc/62/95/75/1343629575.db2.gz	SKZNABJYQWBVMO-VQTJNVASSA-N	0	3	335.451	3.091	20	30		EGEDHN
CC1(C(=O)N2CC[C@H]3[C@H](CCN3Cc3ccccc3C#N)C2)CCC1	ZINC001036791971	1343722955	/nfs/dbraw/zinc/72/29/55/1343722955.db2.gz	IGEYAAKXIHIMFQ-MOPGFXCFSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2[C@@H](CCN2Cc2cc(C)ns2)C1	ZINC001036794185	1343727246	/nfs/dbraw/zinc/72/72/46/1343727246.db2.gz	QUIYFKDRUISZKD-RDJZCZTQSA-N	0	3	347.528	3.477	20	30		EGEDHN
CC(C)(C(=O)N[C@H]1CCC[C@@H]1CNCc1ccccc1C#N)C1CC1	ZINC001037059973	1343955091	/nfs/dbraw/zinc/95/50/91/1343955091.db2.gz	HFUANKQCJFDCQE-MJGOQNOKSA-N	0	3	339.483	3.369	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCC[C@H]2CNCc2cnc(C)o2)CC1	ZINC001037070190	1343963196	/nfs/dbraw/zinc/96/31/96/1343963196.db2.gz	NMDIFMSPUBRNBE-WMZOPIPTSA-N	0	3	331.460	3.104	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCC[C@H]2CNCc2cscn2)CC1	ZINC001037070995	1343964898	/nfs/dbraw/zinc/96/48/98/1343964898.db2.gz	ZSKDGSXJNCQWNC-DOTOQJQBSA-N	0	3	333.501	3.264	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCC[C@@H]2CNCc2nc(C)c(C)s2)C1	ZINC001037075127	1343968365	/nfs/dbraw/zinc/96/83/65/1343968365.db2.gz	LXPCEUJHKJEJPL-CVEARBPZSA-N	0	3	347.528	3.491	20	30		EGEDHN
CC[C@@H]1CN(C(=O)CC(C)C)CC[C@@H]1NCc1cc(F)ccc1C#N	ZINC001037766646	1344079463	/nfs/dbraw/zinc/07/94/63/1344079463.db2.gz	NXGDFPZMZGUBPV-BEFAXECRSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3cnns3)[C@H](CC)C2)CC1	ZINC001037924304	1344184165	/nfs/dbraw/zinc/18/41/65/1344184165.db2.gz	LPBJSVOVKIXJBS-RHSMWYFYSA-N	0	3	348.516	3.001	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1c(F)ccc2ccncc21	ZINC001038278764	1344353555	/nfs/dbraw/zinc/35/35/55/1344353555.db2.gz	WNVFNTSDMAMKHA-HNNXBMFYSA-N	0	3	327.403	3.144	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCN2CCCc2cccc(C)c2)cc1	ZINC001038588485	1344497026	/nfs/dbraw/zinc/49/70/26/1344497026.db2.gz	IXBRVQYERWGKBN-QFIPXVFZSA-N	0	3	346.474	3.413	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)NC[C@@H]1CCN1CC1CC2(CCC2)C1	ZINC001038798218	1344589175	/nfs/dbraw/zinc/58/91/75/1344589175.db2.gz	BKPLUVMVCVVRTE-FHWLQOOXSA-N	0	3	346.515	3.129	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1cccc(-c2cnco2)c1	ZINC001038878107	1344625657	/nfs/dbraw/zinc/62/56/57/1344625657.db2.gz	KSQFPTKARXTWFU-QGZVFWFLSA-N	0	3	325.412	3.112	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H](C)C(C)(C)C)CC[C@H]1c1ccc(F)cc1	ZINC001079154411	1357197825	/nfs/dbraw/zinc/19/78/25/1357197825.db2.gz	BNCGEOOANJZXDF-ZYSHUDEJSA-N	0	3	344.474	3.415	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1cccc2c1OCC2(C)C	ZINC001039093187	1344765170	/nfs/dbraw/zinc/76/51/70/1344765170.db2.gz	RDEXDFWGJIUOGX-OAHLLOKOSA-N	0	3	328.456	3.127	20	30		EGEDHN
C=C(Cl)C[N@H+]1CC[C@@H](C2CCN(C(=O)c3ccccc3[O-])CC2)C1	ZINC001039110601	1344782516	/nfs/dbraw/zinc/78/25/16/1344782516.db2.gz	RCYLSYDCUFZAOL-MRXNPFEDSA-N	0	3	348.874	3.319	20	30		EGEDHN
C=C(Cl)C[N@@H+]1CC[C@@H](C2CCN(C(=O)c3ccccc3[O-])CC2)C1	ZINC001039110601	1344782520	/nfs/dbraw/zinc/78/25/20/1344782520.db2.gz	RCYLSYDCUFZAOL-MRXNPFEDSA-N	0	3	348.874	3.319	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)C3(CF)CC3)CC2)C1	ZINC001039158543	1344843644	/nfs/dbraw/zinc/84/36/44/1344843644.db2.gz	XKEJCRBMLJWQRJ-OAHLLOKOSA-N	0	3	328.859	3.049	20	30		EGEDHN
CCC(=O)N1CCCC[C@H]1[C@H]1CCN(Cc2ccc(C#N)s2)C1	ZINC001039181653	1344877918	/nfs/dbraw/zinc/87/79/18/1344877918.db2.gz	YWGBZMZCYSYLMH-YOEHRIQHSA-N	0	3	331.485	3.233	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2sc(C)cc2C)C1	ZINC001039208907	1344921428	/nfs/dbraw/zinc/92/14/28/1344921428.db2.gz	GLNHKNTUBMDQQN-DLBZAZTESA-N	0	3	330.497	3.315	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(C)c(F)c2)C1	ZINC001039216499	1344933093	/nfs/dbraw/zinc/93/30/93/1344933093.db2.gz	PQFYUIAQWYNHRP-ICSRJNTNSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cccc(C(C)C)n2)C1	ZINC001039218183	1344935864	/nfs/dbraw/zinc/93/58/64/1344935864.db2.gz	KYBJUGYJMQHOFQ-PXNSSMCTSA-N	0	3	339.483	3.155	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)CCc2cccc(C)c2)C1	ZINC001039224382	1344941897	/nfs/dbraw/zinc/94/18/97/1344941897.db2.gz	FQRYFCUKYXAMIJ-SFTDATJTSA-N	0	3	338.495	3.264	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cccc(Cl)c2F)C1	ZINC001039225510	1344943981	/nfs/dbraw/zinc/94/39/81/1344943981.db2.gz	PSSWHFZENWHRGP-YOEHRIQHSA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc(C)c(C)cn2)C1	ZINC001039227015	1344945929	/nfs/dbraw/zinc/94/59/29/1344945929.db2.gz	ANZCYWSMCXBBNU-AZUAARDMSA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2csc(Cl)c2)C1	ZINC001039229480	1344949655	/nfs/dbraw/zinc/94/96/55/1344949655.db2.gz	DTISLQWEUTZKQB-DZGCQCFKSA-N	0	3	336.888	3.351	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2occ3c2CCCC3)C1	ZINC001039247374	1344976810	/nfs/dbraw/zinc/97/68/10/1344976810.db2.gz	VXRJGUKMRMSBIC-QFBILLFUSA-N	0	3	340.467	3.108	20	30		EGEDHN
Cc1cc(C)cc(CN2CC[C@H]3CC[C@@H](C2)N3C(=O)C#CC2CC2)c1	ZINC001039373269	1345032147	/nfs/dbraw/zinc/03/21/47/1345032147.db2.gz	LVBSTAFLOFRZFZ-RTWAWAEBSA-N	0	3	336.479	3.282	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](CC)OC1CCCCC1	ZINC001039375226	1345033153	/nfs/dbraw/zinc/03/31/53/1345033153.db2.gz	UULBQAMPOOEFJN-WSTZPKSXSA-N	0	3	346.515	3.203	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)CCc1cccc(OC)c1F	ZINC001039382845	1345037174	/nfs/dbraw/zinc/03/71/74/1345037174.db2.gz	XAWOIQAOPUVUPA-SJORKVTESA-N	0	3	346.446	3.018	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@H]1CCC(F)(F)C1	ZINC001039384374	1345038401	/nfs/dbraw/zinc/03/84/01/1345038401.db2.gz	RROYBRFHZDGMCC-OAGGEKHMSA-N	0	3	326.431	3.453	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc(C)cc1Cl	ZINC001039397214	1345044846	/nfs/dbraw/zinc/04/48/46/1345044846.db2.gz	YYEZNDSKSNYXBN-SJORKVTESA-N	0	3	332.875	3.442	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(OC)cc1F	ZINC001039400626	1345047293	/nfs/dbraw/zinc/04/72/93/1345047293.db2.gz	LPPWAULCPYDEIO-CABCVRRESA-N	0	3	332.419	3.089	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C(C1CCC1)C1CCC1	ZINC001039425617	1345062852	/nfs/dbraw/zinc/06/28/52/1345062852.db2.gz	LWJBLZQTSJXACQ-MOPGFXCFSA-N	0	3	328.500	3.291	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(Cl)cc1OC	ZINC001039426277	1345063090	/nfs/dbraw/zinc/06/30/90/1345063090.db2.gz	ZWOUTNWIZLBQFZ-CVEARBPZSA-N	0	3	346.858	3.051	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C1[C@H]2CCCCCC[C@H]12	ZINC001039442638	1345068822	/nfs/dbraw/zinc/06/88/22/1345068822.db2.gz	MESZJOORHIIRDN-XWSJACJDSA-N	0	3	328.500	3.291	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc(CC)cc1	ZINC001039444374	1345069944	/nfs/dbraw/zinc/06/99/44/1345069944.db2.gz	CCMWRORHEAYORJ-UXHICEINSA-N	0	3	326.484	3.433	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(C)cc1OC	ZINC001039461561	1345080065	/nfs/dbraw/zinc/08/00/65/1345080065.db2.gz	XLTKYYNBJUMWMN-SJORKVTESA-N	0	3	328.456	3.259	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)c1ccc(F)c(F)c1	ZINC001039471763	1345087113	/nfs/dbraw/zinc/08/71/13/1345087113.db2.gz	LIUQQGCTSAKRMM-UAGQMJEPSA-N	0	3	346.421	3.157	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C12CC(c3ccccc3)(C1)C2	ZINC001039475352	1345090280	/nfs/dbraw/zinc/09/02/80/1345090280.db2.gz	PNWMHBPKXZURLY-YNGQWAMVSA-N	0	3	348.490	3.197	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccc2oc(C)nc21	ZINC001039475988	1345091017	/nfs/dbraw/zinc/09/10/17/1345091017.db2.gz	TVIJLODMPFDHGL-CVEARBPZSA-N	0	3	339.439	3.391	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1c[nH]c2ccc(F)cc12	ZINC001039478679	1345092556	/nfs/dbraw/zinc/09/25/56/1345092556.db2.gz	VWBDZBWNKSWQDE-CABCVRRESA-N	0	3	327.403	3.172	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CCC[C@@H](C1)N2C[C@@H]1C[C@]12CCOC2	ZINC001039823049	1345199973	/nfs/dbraw/zinc/19/99/73/1345199973.db2.gz	NRLMABZFJZXCIX-UGNRZPKXSA-N	0	3	346.515	3.081	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N1C[C@H]2CCC[C@@H](C1)N2CCCC	ZINC001039941389	1345254086	/nfs/dbraw/zinc/25/40/86/1345254086.db2.gz	PEYWFZGUGPWBQE-RDGPPVDQSA-N	0	3	334.504	3.223	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3sccc3Cl)C2)C1	ZINC001040224159	1345384141	/nfs/dbraw/zinc/38/41/41/1345384141.db2.gz	UQOZWPUTXCYSGC-QGZVFWFLSA-N	0	3	336.888	3.353	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@@H]3C[C@H]3c3ccsc3)C2)C1	ZINC001040264902	1345402456	/nfs/dbraw/zinc/40/24/56/1345402456.db2.gz	TXNIWRLLJLBCQF-NLWGTHIKSA-N	0	3	342.508	3.189	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)Cc3c(C)cc(C)cc3C)C2)C1	ZINC001040369918	1345459595	/nfs/dbraw/zinc/45/95/95/1345459595.db2.gz	WLLMJJHTHSHRFK-JOCHJYFZSA-N	0	3	338.495	3.102	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@@H](C)OC3CCCCCC3)C2)C1	ZINC001040384513	1345469358	/nfs/dbraw/zinc/46/93/58/1345469358.db2.gz	NXYAOIFKUYFLSR-WIYYLYMNSA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)C(C)(C)c3cccc(F)c3)C2)C1	ZINC001040391593	1345472505	/nfs/dbraw/zinc/47/25/05/1345472505.db2.gz	QAOUPZXKMICLME-NRFANRHFSA-N	0	3	342.458	3.051	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@H](C)c3ccsc3)C2)C1	ZINC001040392862	1345473593	/nfs/dbraw/zinc/47/35/93/1345473593.db2.gz	XHHFDCIFROOACP-VQIMIIECSA-N	0	3	330.497	3.189	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cc[nH]c3C3CCC3)C2)C1	ZINC001040395709	1345474987	/nfs/dbraw/zinc/47/49/87/1345474987.db2.gz	QEJJVTVWFGPIGU-OAQYLSRUSA-N	0	3	339.483	3.234	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cc(F)ccc3Cl)C2)C1	ZINC001040417592	1345485753	/nfs/dbraw/zinc/48/57/53/1345485753.db2.gz	GSIKWZRPTAVLLK-LJQANCHMSA-N	0	3	348.849	3.431	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@H](F)c3ccccc3)C2)C1	ZINC001040425016	1345490613	/nfs/dbraw/zinc/49/06/13/1345490613.db2.gz	PGVIMOLJSDYEQO-QUCCMNQESA-N	0	3	328.431	3.035	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3sc(C)cc3OC)C2)C1	ZINC001040432689	1345495756	/nfs/dbraw/zinc/49/57/56/1345495756.db2.gz	PWLAFHRWPJWPGP-LJQANCHMSA-N	0	3	346.496	3.017	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3csc(C(C)C)n3)C2)C1	ZINC001040454420	1345508431	/nfs/dbraw/zinc/50/84/31/1345508431.db2.gz	UXFZLZOSTXRLPK-SFHVURJKSA-N	0	3	333.501	3.381	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(Cl)cc3)C2)C1	ZINC001040501629	1345522722	/nfs/dbraw/zinc/52/27/22/1345522722.db2.gz	FKFSJZATKOKBOR-LJQANCHMSA-N	0	3	330.859	3.291	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(Cl)s3)C2)C1	ZINC001040520618	1345531186	/nfs/dbraw/zinc/53/11/86/1345531186.db2.gz	UCFCOANEZUMLQS-QGZVFWFLSA-N	0	3	336.888	3.353	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)CCc3ccccc3F)C2)C1	ZINC001040524939	1345533444	/nfs/dbraw/zinc/53/34/44/1345533444.db2.gz	OLQUBXCBDFZREU-OAQYLSRUSA-N	0	3	342.458	3.096	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3sccc3CC)C2)C1	ZINC001040542296	1345537504	/nfs/dbraw/zinc/53/75/04/1345537504.db2.gz	GJSBFSIELWNMJD-IBGZPJMESA-N	0	3	330.497	3.262	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@H](C)c3ccc(F)c(F)c3)C2)C1	ZINC001040540799	1345537649	/nfs/dbraw/zinc/53/76/49/1345537649.db2.gz	WOMLZGGPRRKFLE-FOIQADDNSA-N	0	3	346.421	3.016	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@@H]3CC4CCC3CC4)C2)C1	ZINC001040545898	1345540218	/nfs/dbraw/zinc/54/02/18/1345540218.db2.gz	XTNMJQIYIBSPJX-BRAJZSMUSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@@H](CC)c3ccc(F)cc3)C2)C1	ZINC001040546834	1345540938	/nfs/dbraw/zinc/54/09/38/1345540938.db2.gz	HBEAYSBAJMUYBR-PZJWPPBQSA-N	0	3	342.458	3.267	20	30		EGEDHN
CC(C)CC(=O)N1CCC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001040584418	1345549655	/nfs/dbraw/zinc/54/96/55/1345549655.db2.gz	JJBKWJDHCWVOIZ-UHFFFAOYSA-N	0	3	339.483	3.419	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3sc(C)cc3C)C2)CC1	ZINC001040717070	1345569828	/nfs/dbraw/zinc/56/98/28/1345569828.db2.gz	ZLGBYJXIZBPWDS-UHFFFAOYSA-N	0	3	330.497	3.316	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@H]3CCCc4ccccc43)C2)CC1	ZINC001040747241	1345573646	/nfs/dbraw/zinc/57/36/46/1345573646.db2.gz	NLAAOUFRBLUSCC-FQEVSTJZSA-N	0	3	336.479	3.054	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@@H]3CCCCC3(F)F)C2)CC1	ZINC001040790195	1345577889	/nfs/dbraw/zinc/57/78/89/1345577889.db2.gz	QTKPVNIPIPOABJ-INIZCTEOSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)CCc3cccc(C)c3)C2)CC1	ZINC001040790546	1345578577	/nfs/dbraw/zinc/57/85/77/1345578577.db2.gz	XTUTYQUFGMWMHT-UHFFFAOYSA-N	0	3	338.495	3.265	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cc(C(C)(C)C)oc3C)C2)CC1	ZINC001040861952	1345589072	/nfs/dbraw/zinc/58/90/72/1345589072.db2.gz	ZIWZHCMQCRGYPP-UHFFFAOYSA-N	0	3	342.483	3.447	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@H]3CC[C@H](C(C)C)CC3)C2)CC1	ZINC001040895307	1345595310	/nfs/dbraw/zinc/59/53/10/1345595310.db2.gz	TUPYMXUYAGRUMI-WGSAOQKQSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)Cc3ccccc3Cl)C2)CC1	ZINC001040931415	1345604016	/nfs/dbraw/zinc/60/40/16/1345604016.db2.gz	MLHLAZMNMDATOH-UHFFFAOYSA-N	0	3	344.886	3.220	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)CCc3cccs3)C2)CC1	ZINC001040936120	1345604979	/nfs/dbraw/zinc/60/49/79/1345604979.db2.gz	VSLOJZWSBMFJGH-UHFFFAOYSA-N	0	3	330.497	3.019	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@@]3(C)CC=C(C)CC3)C2)CC1	ZINC001040946668	1345606880	/nfs/dbraw/zinc/60/68/80/1345606880.db2.gz	ZEWIYGGHKVDXAI-FQEVSTJZSA-N	0	3	328.500	3.461	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3c[nH]c4ccc(C)cc34)C2)CC1	ZINC001040948336	1345607515	/nfs/dbraw/zinc/60/75/15/1345607515.db2.gz	OQPZMBYYUFJVLV-UHFFFAOYSA-N	0	3	349.478	3.428	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccc(CF)cc3)C2)CC1	ZINC001040951778	1345608179	/nfs/dbraw/zinc/60/81/79/1345608179.db2.gz	JHXSICMEDISCKO-UHFFFAOYSA-N	0	3	328.431	3.108	20	30		EGEDHN
Cc1occc1C(=O)N1CC[C@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001041056452	1345638927	/nfs/dbraw/zinc/63/89/27/1345638927.db2.gz	GDQDTPLYIXCKDJ-NRFANRHFSA-N	0	3	349.434	3.198	20	30		EGEDHN
Cc1ccoc1C(=O)N1CC[C@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001041067851	1345642642	/nfs/dbraw/zinc/64/26/42/1345642642.db2.gz	BNVUGYSEQPNQLR-NRFANRHFSA-N	0	3	349.434	3.198	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001041077243	1345646506	/nfs/dbraw/zinc/64/65/06/1345646506.db2.gz	GAXWLYLUOWTLAL-OAQYLSRUSA-N	0	3	339.483	3.419	20	30		EGEDHN
CC1CC(C(=O)N2CC[C@]3(CCN(Cc4cccc(C#N)c4)C3)C2)C1	ZINC001041198238	1345675408	/nfs/dbraw/zinc/67/54/08/1345675408.db2.gz	MZONQGJGEABHJZ-IOYBJCICSA-N	0	3	337.467	3.029	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3coc4ccc(CC)cc43)C2)C1	ZINC001041278933	1345693622	/nfs/dbraw/zinc/69/36/22/1345693622.db2.gz	BQBYZTIHOXETOZ-OAQYLSRUSA-N	0	3	336.435	3.166	20	30		EGEDHN
C=CCN1CC[C@@]2(CCN(C(=O)c3ocnc3-c3ccccc3)C2)C1	ZINC001041343957	1345706014	/nfs/dbraw/zinc/70/60/14/1345706014.db2.gz	NULCKXLAFYFOMC-HXUWFJFHSA-N	0	3	337.423	3.066	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cccc4ccc(C)nc43)C2)C1	ZINC001041395742	1345715563	/nfs/dbraw/zinc/71/55/63/1345715563.db2.gz	MZVNVOWIEOPXMG-JOCHJYFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)[C@H]3CCCc4ccccc43)C2)C1	ZINC001041406990	1345720274	/nfs/dbraw/zinc/72/02/74/1345720274.db2.gz	FSEWISYTIBCDLO-RBBKRZOGSA-N	0	3	336.479	3.054	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccc(-n4cccc4)cc3)C2)C1	ZINC001041447562	1345729639	/nfs/dbraw/zinc/72/96/39/1345729639.db2.gz	ADVZLWLKGYYTPG-JOCHJYFZSA-N	0	3	347.462	3.039	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@]2(CCN(Cc3ccc(F)cc3)C2)C1	ZINC001041545868	1345760057	/nfs/dbraw/zinc/76/00/57/1345760057.db2.gz	ZCTHKNWIWVBXMT-HXUWFJFHSA-N	0	3	330.447	3.462	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@]3(CCN(C(=O)[C@H]4C[C@H]5C[C@H]5C4)C3)C2)cc1	ZINC001041585600	1345781993	/nfs/dbraw/zinc/78/19/93/1345781993.db2.gz	FWCVNAYACYEJPK-FCIYXJNOSA-N	0	3	349.478	3.029	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@]2(CCN(Cc3cccnc3C)C2)C1	ZINC001041624612	1345800613	/nfs/dbraw/zinc/80/06/13/1345800613.db2.gz	BWHMHKZFFYGZEX-NHCUHLMSSA-N	0	3	341.499	3.417	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3ccc(C)c4ccccc34)C2)C1	ZINC001041712446	1345827680	/nfs/dbraw/zinc/82/76/80/1345827680.db2.gz	NSJXHAJGAQRVEQ-JOCHJYFZSA-N	0	3	332.447	3.319	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3ccc(O[C@@H](C)CC)cc3)C2)C1	ZINC001041774106	1345845166	/nfs/dbraw/zinc/84/51/66/1345845166.db2.gz	RLLNLCSUVUQCAZ-LAUBAEHRSA-N	0	3	340.467	3.035	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)C3CCC(C(C)(C)C)CC3)C2)C1	ZINC001041814092	1345860309	/nfs/dbraw/zinc/86/03/09/1345860309.db2.gz	MQJLMMBFNOVXBZ-WIXQSORDSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccc(CC(C)C)cc3)C2)C1	ZINC001041822193	1345863694	/nfs/dbraw/zinc/86/36/94/1345863694.db2.gz	PJXXXAXQQJMFJT-QFIPXVFZSA-N	0	3	338.495	3.446	20	30		EGEDHN
C/C(=C\C(=O)N1CC[C@@H]2CCN(Cc3cccc(C#N)c3)[C@H]2C1)C1CC1	ZINC001041962346	1345908868	/nfs/dbraw/zinc/90/88/68/1345908868.db2.gz	ROCRZYOECKKANA-IFLVGUDLSA-N	0	3	349.478	3.337	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CCN(C(=O)CCC4CC4)C[C@H]32)c1	ZINC001041984988	1345914156	/nfs/dbraw/zinc/91/41/56/1345914156.db2.gz	LNUVEAXRHPMICN-WOJBJXKFSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc4nccc(C)c4c3)C[C@H]21	ZINC001042077853	1345939203	/nfs/dbraw/zinc/93/92/03/1345939203.db2.gz	QKZBNECFPUIALU-OXQOHEQNSA-N	0	3	335.451	3.266	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cc(F)cc4ccoc43)C[C@@H]21	ZINC001042122194	1345949865	/nfs/dbraw/zinc/94/98/65/1345949865.db2.gz	NAZZLFRAIZYIOC-KSSFIOAISA-N	0	3	340.398	3.132	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3cc4ccccc4s3)C[C@H]21	ZINC001042142886	1345955440	/nfs/dbraw/zinc/95/54/40/1345955440.db2.gz	PFIORFWOYNGLKI-DOTOQJQBSA-N	0	3	338.476	3.461	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(C)nc3C(C)C)C[C@@H]21	ZINC001042167738	1345964140	/nfs/dbraw/zinc/96/41/40/1345964140.db2.gz	NIBINKYOEZHXHB-AEFFLSMTSA-N	0	3	327.472	3.236	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3csc4ccccc34)C[C@@H]21	ZINC001042169705	1345965312	/nfs/dbraw/zinc/96/53/12/1345965312.db2.gz	LADRHUUEOZOUPW-YJBOKZPZSA-N	0	3	338.476	3.461	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3cccc(F)c3)[C@H]2C1	ZINC001042183683	1345971160	/nfs/dbraw/zinc/97/11/60/1345971160.db2.gz	PZFWVFJAWGDMGJ-AEFFLSMTSA-N	0	3	330.447	3.461	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(F)c4ccncc34)C[C@@H]21	ZINC001042197679	1345979889	/nfs/dbraw/zinc/97/98/89/1345979889.db2.gz	GFPBJTDCIALBDH-LIRRHRJNSA-N	0	3	339.414	3.096	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3c(Cl)cncc3Cl)C[C@@H]21	ZINC001042215951	1345989090	/nfs/dbraw/zinc/98/90/90/1345989090.db2.gz	JUWYFADQEDFEGU-RISCZKNCSA-N	0	3	340.254	3.111	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(F)c(Cl)c3F)C[C@@H]21	ZINC001042218848	1345990730	/nfs/dbraw/zinc/99/07/30/1345990730.db2.gz	MICMVMQJAKUXOS-FZMZJTMJSA-N	0	3	340.801	3.341	20	30		EGEDHN
CCC1(C(=O)N2CC[C@@H]3CCN(Cc4ccc(C#N)cc4)[C@@H]3C2)CC1	ZINC001042220329	1345991334	/nfs/dbraw/zinc/99/13/34/1345991334.db2.gz	BOKSBYZFAQLFQR-RBUKOAKNSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3cnc(C)nc3C(C)C)C[C@H]21	ZINC001042254297	1346007124	/nfs/dbraw/zinc/00/71/24/1346007124.db2.gz	KGCBZWMKTKUNAB-FUHWJXTLSA-N	0	3	342.487	3.021	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@]3(c4ccccc4)C[C@H](F)C3)C[C@@H]21	ZINC001042326958	1346035731	/nfs/dbraw/zinc/03/57/31/1346035731.db2.gz	STPWQNNVTFZCRV-RDPOXOKHSA-N	0	3	342.458	3.165	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cccc(C(F)(F)F)c3)C[C@H]21	ZINC001042326962	1346036120	/nfs/dbraw/zinc/03/61/20/1346036120.db2.gz	KUPNHQWPGNMBCD-XJKSGUPXSA-N	0	3	338.373	3.428	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(C(F)(F)F)cc3)C[C@H]21	ZINC001042327813	1346036670	/nfs/dbraw/zinc/03/66/70/1346036670.db2.gz	PDOULZPDNBJQNF-CZUORRHYSA-N	0	3	338.373	3.428	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(COC(C)C)cc3)C[C@H]21	ZINC001042347935	1346048837	/nfs/dbraw/zinc/04/88/37/1346048837.db2.gz	FLCWWTXRCCQXDE-UYAOXDASSA-N	0	3	342.483	3.334	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc(CC(C)C)cc3)C[C@@H]21	ZINC001042347650	1346049225	/nfs/dbraw/zinc/04/92/25/1346049225.db2.gz	ATXTVWQTHQVKBO-FPOVZHCZSA-N	0	3	338.495	3.445	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3cc4cccc(F)c4o3)C[C@@H]21	ZINC001042362487	1346056793	/nfs/dbraw/zinc/05/67/93/1346056793.db2.gz	KNGNWFSCQCYKHN-YOEHRIQHSA-N	0	3	340.398	3.132	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)C34CC(C(C)(C)C)(C3)C4)C[C@H]21	ZINC001042375131	1346062625	/nfs/dbraw/zinc/06/26/25/1346062625.db2.gz	SMABLZRYTJWFLM-ZGDXVETISA-N	0	3	328.500	3.149	20	30		EGEDHN
C[C@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)c1cccs1	ZINC001044442377	1346333662	/nfs/dbraw/zinc/33/36/62/1346333662.db2.gz	KRLIYFYHXZZYGX-YOEHRIQHSA-N	0	3	339.464	3.403	20	30		EGEDHN
C[C@@H]1C[C@H]([NH2+]Cc2cccc(C#N)c2)CCN1C(=O)c1ccccc1[O-]	ZINC001044478691	1346343981	/nfs/dbraw/zinc/34/39/81/1346343981.db2.gz	OCDRZOUAZDTNHE-CRAIPNDOSA-N	0	3	349.434	3.047	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3snnc3C)C[C@H]2C)CC1	ZINC001044729171	1346413969	/nfs/dbraw/zinc/41/39/69/1346413969.db2.gz	FOQPKZVPLWGELN-CZUORRHYSA-N	0	3	348.516	3.062	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3nccs3)C[C@H]2C)CC1	ZINC001044730053	1346414583	/nfs/dbraw/zinc/41/45/83/1346414583.db2.gz	MZZWOYHJAKKEPS-GDBMZVCRSA-N	0	3	333.501	3.359	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)c2ccccc2)c(F)c1	ZINC001044903430	1346458333	/nfs/dbraw/zinc/45/83/33/1346458333.db2.gz	LVIZHOYWSXKDAP-SFHVURJKSA-N	0	3	337.398	3.092	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)C[C@@H]2C=CCC2)s1	ZINC001044914831	1346461676	/nfs/dbraw/zinc/46/16/76/1346461676.db2.gz	JGKPEGYHXVAPLO-CABCVRRESA-N	0	3	329.469	3.057	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H]1CNCc1ccnc(Cl)c1	ZINC001045181273	1346516986	/nfs/dbraw/zinc/51/69/86/1346516986.db2.gz	ASOKKTQNDBYNCI-YJBOKZPZSA-N	0	3	335.879	3.418	20	30		EGEDHN
CC(C)C1(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)s2)CC1	ZINC001045190334	1346524400	/nfs/dbraw/zinc/52/44/00/1346524400.db2.gz	BGAZVVWHVZDKDA-AWEZNQCLSA-N	0	3	331.485	3.137	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2cc(-c3ccccc3)on2)CC1	ZINC001045497279	1346609483	/nfs/dbraw/zinc/60/94/83/1346609483.db2.gz	JXZINBLNPCGDMR-UHFFFAOYSA-N	0	3	325.412	3.112	20	30		EGEDHN
CC1(NC(=O)[C@H]2CC[C@@H](F)C2)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045539753	1346623276	/nfs/dbraw/zinc/62/32/76/1346623276.db2.gz	XIVNXLWNONNWDS-ZWKOTPCHSA-N	0	3	343.446	3.167	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)C2CCC(C(F)F)CC2)CC1	ZINC001045634179	1346653958	/nfs/dbraw/zinc/65/39/58/1346653958.db2.gz	XDKSVTVTFHRGAD-UHFFFAOYSA-N	0	3	326.431	3.052	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1cccnc1C	ZINC001045827611	1346710674	/nfs/dbraw/zinc/71/06/74/1346710674.db2.gz	PWSBVIRGQYHILV-MSOLQXFVSA-N	0	3	327.472	3.168	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@]3(C2)CCCCN(C(=O)C(F)F)C3)c1	ZINC001045905520	1346742078	/nfs/dbraw/zinc/74/20/78/1346742078.db2.gz	HZHFUPOTKYKHLH-LJQANCHMSA-N	0	3	347.409	3.028	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)/C=C/c1ccco1)C2	ZINC001045909185	1346746367	/nfs/dbraw/zinc/74/63/67/1346746367.db2.gz	KHKLIPCBIXCVKG-NDDJGDGRSA-N	0	3	326.440	3.021	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc(Cl)o1)C2	ZINC001045912968	1346750539	/nfs/dbraw/zinc/75/05/39/1346750539.db2.gz	ODVWXFYASHMJPU-SFHVURJKSA-N	0	3	334.847	3.275	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc(C)oc1C)C2	ZINC001045914560	1346751852	/nfs/dbraw/zinc/75/18/52/1346751852.db2.gz	QXRMCOVTURJXPJ-HXUWFJFHSA-N	0	3	328.456	3.238	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)CCc1ccsc1)C2	ZINC001045943543	1346778990	/nfs/dbraw/zinc/77/89/90/1346778990.db2.gz	KMIMKVQKULWLOM-IBGZPJMESA-N	0	3	330.497	3.019	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)C1(C(F)(F)F)CCC1)C2	ZINC001045947007	1346782731	/nfs/dbraw/zinc/78/27/31/1346782731.db2.gz	HCUSUEMIEUJUFO-MRXNPFEDSA-N	0	3	342.405	3.057	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1c[nH]c3ccccc13)C2	ZINC001045950863	1346785185	/nfs/dbraw/zinc/78/51/85/1346785185.db2.gz	NIEKUPQTFLKWIM-NRFANRHFSA-N	0	3	335.451	3.119	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cccc3cccnc31)C2	ZINC001045950679	1346785273	/nfs/dbraw/zinc/78/52/73/1346785273.db2.gz	IYMNGCLXQLEBRO-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc(C)c(C)cn1)C2	ZINC001045953569	1346788605	/nfs/dbraw/zinc/78/86/05/1346788605.db2.gz	FFPATIQWCNUDGO-NRFANRHFSA-N	0	3	339.483	3.040	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)C(C)(C)c1cccs1)C2	ZINC001045958416	1346793561	/nfs/dbraw/zinc/79/35/61/1346793561.db2.gz	RZWCSSQWYBNPCR-HXUWFJFHSA-N	0	3	344.524	3.364	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@H](C)Cc1cccs1)C2	ZINC001045968601	1346802983	/nfs/dbraw/zinc/80/29/83/1346802983.db2.gz	DHCYFEQIKRZWEZ-YLJYHZDGSA-N	0	3	344.524	3.265	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cccc(OCC)c1)C2	ZINC001045968892	1346803646	/nfs/dbraw/zinc/80/36/46/1346803646.db2.gz	IYWJVSMXULBRNA-NRFANRHFSA-N	0	3	340.467	3.037	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc(C)cc1F)C2	ZINC001045969760	1346805101	/nfs/dbraw/zinc/80/51/01/1346805101.db2.gz	YQEJKWNKOVVJML-NRFANRHFSA-N	0	3	342.458	3.476	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cccc3cc[nH]c31)C2	ZINC001045970888	1346806206	/nfs/dbraw/zinc/80/62/06/1346806206.db2.gz	MYPYLEZWKBNOAZ-OAQYLSRUSA-N	0	3	335.451	3.119	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc3ccn(C)c3c1)C2	ZINC001045977963	1346814380	/nfs/dbraw/zinc/81/43/80/1346814380.db2.gz	MUVYRHMGBKYDBQ-QFIPXVFZSA-N	0	3	349.478	3.130	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)C[C@@H](C)n1cccc1)C2	ZINC001045981626	1346820372	/nfs/dbraw/zinc/82/03/72/1346820372.db2.gz	WBEYMYOSZDMQAK-TZIWHRDSSA-N	0	3	341.499	3.167	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1sc(C)nc1C)C2	ZINC001045982975	1346822347	/nfs/dbraw/zinc/82/23/47/1346822347.db2.gz	HJHQOPHUVBLKPM-IBGZPJMESA-N	0	3	345.512	3.101	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc(C)c(F)c(C)c1)C2	ZINC001045984412	1346825488	/nfs/dbraw/zinc/82/54/88/1346825488.db2.gz	ZNSHVFPFWPNSID-OAQYLSRUSA-N	0	3	342.458	3.394	20	30		EGEDHN
C=C(C)CCN1CC[C@](C)(NC(=O)c2cnc([C@H](C)OC)s2)C1	ZINC001046319248	1346933589	/nfs/dbraw/zinc/93/35/89/1346933589.db2.gz	QUFMPVFXLLUTRZ-GUYCJALGSA-N	0	3	337.489	3.011	20	30		EGEDHN
C=CCCN1CC[C@@](C)(NC(=O)c2cc(-c3ccccc3)no2)C1	ZINC001046439782	1346975816	/nfs/dbraw/zinc/97/58/16/1346975816.db2.gz	AQZHTWGOORGKFQ-LJQANCHMSA-N	0	3	325.412	3.112	20	30		EGEDHN
C#CCCN1CC[C@](C)(NC(=O)c2[nH]c3ccccc3c2Cl)C1	ZINC001046444752	1346976255	/nfs/dbraw/zinc/97/62/55/1346976255.db2.gz	VEEJCITZPNTDTH-SFHVURJKSA-N	0	3	329.831	3.039	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2cnc3c(F)cccc3c2)C1	ZINC001046486750	1346992068	/nfs/dbraw/zinc/99/20/68/1346992068.db2.gz	KJFJWRDMPZTYTI-LJQANCHMSA-N	0	3	327.403	3.144	20	30		EGEDHN
C#CCCN1CC[C@](C)(NC(=O)c2ccc(-c3cccs3)o2)C1	ZINC001046809950	1347112619	/nfs/dbraw/zinc/11/26/19/1347112619.db2.gz	HONMZOWMAQPSEG-SFHVURJKSA-N	0	3	328.437	3.226	20	30		EGEDHN
C#CCCN1CC[C@@](C)(NC(=O)c2cc3c(s2)CC[C@@H](C)C3)C1	ZINC001046826635	1347120781	/nfs/dbraw/zinc/12/07/81/1347120781.db2.gz	FLYALYRUNXZNCM-AUUYWEPGSA-N	0	3	330.497	3.090	20	30		EGEDHN
C=CCCN1CC[C@@](C)(NC(=O)c2sc(Cl)nc2Cl)C1	ZINC001046843242	1347127486	/nfs/dbraw/zinc/12/74/86/1347127486.db2.gz	SLNDMPIUSBYHJZ-CYBMUJFWSA-N	0	3	334.272	3.220	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@H](CNC(=O)[C@@H]2C[C@H]2CC(C)(C)C)C1	ZINC001046944466	1347159660	/nfs/dbraw/zinc/15/96/60/1347159660.db2.gz	MRWQREDBWRRDKP-ARFHVFGLSA-N	0	3	340.458	3.155	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2ncc(Cl)s2)C1	ZINC001046958460	1347165163	/nfs/dbraw/zinc/16/51/63/1347165163.db2.gz	YFNBUEOVMCOBBK-JTQLQIEISA-N	0	3	349.834	3.060	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2cccc(F)c2F)C1	ZINC001046967597	1347169566	/nfs/dbraw/zinc/16/95/66/1347169566.db2.gz	VJOXWTVTJFMOHV-LBPRGKRZSA-N	0	3	344.352	3.228	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2C[C@H]3C[C@@H](C2)N(C/C=C/Cl)C3)cc1	ZINC001047122699	1347213000	/nfs/dbraw/zinc/21/30/00/1347213000.db2.gz	BEVLUNBTNJUYMC-KVKYVFFESA-N	0	3	328.843	3.003	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)c3occc3C)C2)CC1	ZINC001047224018	1347254131	/nfs/dbraw/zinc/25/41/31/1347254131.db2.gz	ULHNOBIROAOIPR-SFHVURJKSA-N	0	3	328.456	3.176	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)/C=C(/C)C3CC3)C2)CC1	ZINC001047229586	1347259315	/nfs/dbraw/zinc/25/93/15/1347259315.db2.gz	QBUKMJQVVLZRPN-DNCJFXNASA-N	0	3	328.500	3.317	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)C(C)=C3CCCC3)C2)CC1	ZINC001047231727	1347260364	/nfs/dbraw/zinc/26/03/64/1347260364.db2.gz	GHXPDSSQNLNLDY-FQEVSTJZSA-N	0	3	328.500	3.461	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)[C@@H]3C[C@H]3CCC)C2)CC1	ZINC001047254139	1347278135	/nfs/dbraw/zinc/27/81/35/1347278135.db2.gz	NDFDIIZJCQTRHC-VAMGGRTRSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)[C@@H]3C[C@H]3CCC)C2)CC1	ZINC001047254138	1347278248	/nfs/dbraw/zinc/27/82/48/1347278248.db2.gz	NDFDIIZJCQTRHC-HSALFYBXSA-N	0	3	330.516	3.397	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]([C@H](C)NCc2nc(C)c(C)s2)C1	ZINC001047929881	1347413874	/nfs/dbraw/zinc/41/38/74/1347413874.db2.gz	ABWBSBZPRWVOEC-DZGCQCFKSA-N	0	3	335.517	3.299	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H]([C@H](C)NCc3cnc(C)o3)C2)CC1	ZINC001047962740	1347425717	/nfs/dbraw/zinc/42/57/17/1347425717.db2.gz	NJFPDAAUUFFFEZ-WMLDXEAASA-N	0	3	331.460	3.056	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]([C@@H](C)NCc3cc(C4CC4)no3)C2)C1	ZINC001047965293	1347427038	/nfs/dbraw/zinc/42/70/38/1347427038.db2.gz	LVPGAUAOUHHFTB-GDBMZVCRSA-N	0	3	343.471	3.235	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]([C@@H](C)NCc3ncc(C)s3)C2)C1	ZINC001047967807	1347427641	/nfs/dbraw/zinc/42/76/41/1347427641.db2.gz	YDQLWNXJKJBPMH-CABCVRRESA-N	0	3	333.501	3.134	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)C2CC3(CC3)C2)C1	ZINC001047970654	1347429276	/nfs/dbraw/zinc/42/92/76/1347429276.db2.gz	XKPDSEGVUGDYEK-MAUKXSAKSA-N	0	3	337.467	3.075	20	30		EGEDHN
Cc1ccccc1C(=O)N1C[C@H](C)[C@@H](CNCc2ccccc2C#N)C1	ZINC001048116185	1347471869	/nfs/dbraw/zinc/47/18/69/1347471869.db2.gz	DUCPTQPMTLQUKG-PXNSSMCTSA-N	0	3	347.462	3.365	20	30		EGEDHN
CCC(C)(C)C(=O)N1C[C@H](C)[C@@H](CNCc2ccccc2C#N)C1	ZINC001048361020	1347530907	/nfs/dbraw/zinc/53/09/07/1347530907.db2.gz	YFANZWPNXZHAFU-YJBOKZPZSA-N	0	3	327.472	3.179	20	30		EGEDHN
C=C(C)CN1CCC(N(Cc2ccccn2)C(=O)c2cc[nH]c2)CC1	ZINC001048627258	1347624664	/nfs/dbraw/zinc/62/46/64/1347624664.db2.gz	IJOOATSHUFQIDF-UHFFFAOYSA-N	0	3	338.455	3.093	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CN(C(=O)CC4CCCC4)C[C@@H]3C2)c1	ZINC001048655847	1347632909	/nfs/dbraw/zinc/63/29/09/1347632909.db2.gz	OSJTWKOIRQTOEU-BGYRXZFFSA-N	0	3	337.467	3.029	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CN(Cc3oc(CCC)nc3C)C[C@H]2C1	ZINC001048979146	1347696233	/nfs/dbraw/zinc/69/62/33/1347696233.db2.gz	ONROFWKRTYWCSR-IYBDPMFKSA-N	0	3	345.487	3.038	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CN(Cc4ccc(C)c(F)c4)C[C@H]3C2)C1	ZINC001049042183	1347713910	/nfs/dbraw/zinc/71/39/10/1347713910.db2.gz	AKAGOQFLFOUVRN-HDICACEKSA-N	0	3	342.458	3.381	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc(-c4ccco4)s3)C[C@@H]2C1	ZINC001049150710	1347734850	/nfs/dbraw/zinc/73/48/50/1347734850.db2.gz	NSIOZWXRXQRNKR-GASCZTMLSA-N	0	3	340.448	3.035	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3c(Cl)cccc3Cl)C[C@@H]2C1	ZINC001049186828	1347741898	/nfs/dbraw/zinc/74/18/98/1347741898.db2.gz	LGZFWKXJSWZCCO-BETUJISGSA-N	0	3	337.250	3.021	20	30		EGEDHN
C=C[C@@H](C(=O)N1C[C@H]2CN(C/C=C/Cl)C[C@H]2C1)c1ccccc1	ZINC001049229643	1347752111	/nfs/dbraw/zinc/75/21/11/1347752111.db2.gz	OZLMNUNSIJQCHA-JWDBNDPNSA-N	0	3	330.859	3.099	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@H]2CCCN3C(=O)C2CCCC2)c1	ZINC001049282177	1347768787	/nfs/dbraw/zinc/76/87/87/1347768787.db2.gz	WLLZOMXGSLOVHY-UXHICEINSA-N	0	3	337.467	3.314	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1cccc(C#N)c1	ZINC001049294582	1347776590	/nfs/dbraw/zinc/77/65/90/1347776590.db2.gz	AQVVUDFKQPJMPE-RTBURBONSA-N	0	3	325.456	3.170	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)C[C@@H]1C[C@H]1c1ccccc1	ZINC001049479400	1347869381	/nfs/dbraw/zinc/86/93/81/1347869381.db2.gz	KAWHRPZWDSGNCZ-BURNTYAHSA-N	0	3	336.479	3.269	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C[C@@H]1C[C@H]1c1ccccc1	ZINC001049479403	1347869672	/nfs/dbraw/zinc/86/96/72/1347869672.db2.gz	KAWHRPZWDSGNCZ-XSDIEEQYSA-N	0	3	336.479	3.269	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cccc(OCCC)c1	ZINC001049502440	1347880804	/nfs/dbraw/zinc/88/08/04/1347880804.db2.gz	NXJLXHVFSNMZGZ-RTBURBONSA-N	0	3	328.456	3.340	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(Cl)c(Cl)n1C	ZINC001049509338	1347884614	/nfs/dbraw/zinc/88/46/14/1347884614.db2.gz	TUWIPRRJLJFDAH-CHWSQXEVSA-N	0	3	342.270	3.197	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)CC1(c2ccccc2)CC1	ZINC001049513079	1347886617	/nfs/dbraw/zinc/88/66/17/1347886617.db2.gz	VTSFPSYKFBSEKD-PMACEKPBSA-N	0	3	336.479	3.197	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)CC(C)(C)c1ccc(F)cc1	ZINC001049522592	1347890611	/nfs/dbraw/zinc/89/06/11/1347890611.db2.gz	RGWXQOYQGDVUIB-RTBURBONSA-N	0	3	342.458	3.192	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cccc2c(C)c(C)[nH]c21	ZINC001049551786	1347903993	/nfs/dbraw/zinc/90/39/93/1347903993.db2.gz	IUQQDKBKITYIGX-WOJBJXKFSA-N	0	3	349.478	3.487	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(C)n([C@H](C)CC)n1	ZINC001049564688	1347912094	/nfs/dbraw/zinc/91/20/94/1347912094.db2.gz	PITPMPUBTKAHAT-FHLIZLRMSA-N	0	3	330.476	3.027	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1cccc(C(F)F)c1	ZINC001049590610	1347925785	/nfs/dbraw/zinc/92/57/85/1347925785.db2.gz	BARGCDVATZDEGZ-MSOLQXFVSA-N	0	3	346.421	3.255	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1cccc(C)c1Cl	ZINC001049591318	1347926098	/nfs/dbraw/zinc/92/60/98/1347926098.db2.gz	FWYVAORVHQJLLJ-DLBZAZTESA-N	0	3	332.875	3.442	20	30		EGEDHN
CC1(C(=O)N2CCC[C@@H]3[C@H]2CCN3Cc2ccc(C#N)cc2)CCC1	ZINC001049644293	1347951498	/nfs/dbraw/zinc/95/14/98/1347951498.db2.gz	ICSOMEKZLFLDDZ-RTBURBONSA-N	0	3	337.467	3.314	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(F)c2ccncc12	ZINC001049661796	1347961597	/nfs/dbraw/zinc/96/15/97/1347961597.db2.gz	ZVDRBCRCJWBMCN-RTBURBONSA-N	0	3	339.414	3.239	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1c(C)[nH]c2ccccc21	ZINC001049681609	1347970115	/nfs/dbraw/zinc/97/01/15/1347970115.db2.gz	PJTGHHSEUZBCOI-SFTDATJTSA-N	0	3	349.478	3.107	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C[C@H](C)c1ccc(CC)cc1	ZINC001049716162	1347988800	/nfs/dbraw/zinc/98/88/00/1347988800.db2.gz	ZQZDOGZRSGNRIG-IOMROCGXSA-N	0	3	338.495	3.441	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1oc(CC(C)C)nc1C	ZINC001049774883	1348015330	/nfs/dbraw/zinc/01/53/30/1348015330.db2.gz	YOCRYRVXPBCSGA-IAGOWNOFSA-N	0	3	345.487	3.437	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1csc(C(C)(C)C)n1	ZINC001049777474	1348016439	/nfs/dbraw/zinc/01/64/39/1348016439.db2.gz	IDLWVBJVRMTZMO-JKSUJKDBSA-N	0	3	347.528	3.234	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC001049778633	1348017119	/nfs/dbraw/zinc/01/71/19/1348017119.db2.gz	XJRMHOKMEALBCA-ZGXWSNOMSA-N	0	3	340.467	3.050	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](CC)c1c(C)noc1C	ZINC001049787304	1348022030	/nfs/dbraw/zinc/02/20/30/1348022030.db2.gz	GYXCPJIRIBDOHU-GVDBMIGSSA-N	0	3	331.460	3.036	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ncoc1-c1cccs1	ZINC001049793499	1348024305	/nfs/dbraw/zinc/02/43/05/1348024305.db2.gz	OMCDHNBHNBLKGP-KGLIPLIRSA-N	0	3	343.452	3.268	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1c[nH]nc1-c1ccsc1	ZINC001049817795	1348035176	/nfs/dbraw/zinc/03/51/76/1348035176.db2.gz	NUNRXVOOEKONRF-HZPDHXFCSA-N	0	3	342.468	3.003	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C(C)(C)c1cccc(OC)c1	ZINC001049830240	1348044359	/nfs/dbraw/zinc/04/43/59/1348044359.db2.gz	DZLIGBMOIYAODW-RBUKOAKNSA-N	0	3	342.483	3.224	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)C(C)(C)c1cccc(OC)c1	ZINC001049830237	1348044583	/nfs/dbraw/zinc/04/45/83/1348044583.db2.gz	DZLIGBMOIYAODW-OALUTQOASA-N	0	3	342.483	3.224	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C[C@H]1CCCc2ccccc21	ZINC001049854598	1348060914	/nfs/dbraw/zinc/06/09/14/1348060914.db2.gz	OCWOWMKHELAJAG-HMXCVIKNSA-N	0	3	336.479	3.195	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(N(CC)CC)cc1	ZINC001049863745	1348069973	/nfs/dbraw/zinc/06/99/73/1348069973.db2.gz	NQFJVOSTRVSHMD-PMACEKPBSA-N	0	3	341.499	3.398	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1coc2ccc(F)cc12	ZINC001049867998	1348073639	/nfs/dbraw/zinc/07/36/39/1348073639.db2.gz	QKPTXVOSROCJMD-IAGOWNOFSA-N	0	3	328.387	3.437	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C1CCC(C(F)F)CC1	ZINC001049869812	1348075658	/nfs/dbraw/zinc/07/56/58/1348075658.db2.gz	JUIVWQWJWXCDDG-SJJHQCBESA-N	0	3	338.442	3.147	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1sccc1C1CC1	ZINC001049877884	1348083026	/nfs/dbraw/zinc/08/30/26/1348083026.db2.gz	SBYZPHVHLFIFPZ-SJORKVTESA-N	0	3	328.481	3.328	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)COc1ccccc1C(C)C	ZINC001049881029	1348086053	/nfs/dbraw/zinc/08/60/53/1348086053.db2.gz	LGRXEGSXLFRAAE-RBUKOAKNSA-N	0	3	342.483	3.440	20	30		EGEDHN
Cc1c[nH]cc1C(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1cccc(C#N)c1	ZINC001049890411	1348095473	/nfs/dbraw/zinc/09/54/73/1348095473.db2.gz	MWHUWXJTODOZFD-UXHICEINSA-N	0	3	348.450	3.074	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccccc1OCC1CC1	ZINC001049913463	1348108413	/nfs/dbraw/zinc/10/84/13/1348108413.db2.gz	YHEQXINTMPIJPW-RTBURBONSA-N	0	3	340.467	3.340	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1c[nH]c2c1cccc2CC	ZINC001049915961	1348110569	/nfs/dbraw/zinc/11/05/69/1348110569.db2.gz	DIZUVDZRXYLUDU-MOPGFXCFSA-N	0	3	335.451	3.042	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](CC)c1ccc(F)cc1	ZINC001049917659	1348111461	/nfs/dbraw/zinc/11/14/61/1348111461.db2.gz	NPCJWDILNHFHGY-HSALFYBXSA-N	0	3	342.458	3.408	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc2c(cccc2C)o1	ZINC001049924640	1348115898	/nfs/dbraw/zinc/11/58/98/1348115898.db2.gz	SIYXIZQZOPSKEM-ROUUACIJSA-N	0	3	336.435	3.443	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C1(C(F)(F)F)CCCC1	ZINC001049933931	1348120960	/nfs/dbraw/zinc/12/09/60/1348120960.db2.gz	UIRGXUSFDDBFNT-UONOGXRCSA-N	0	3	330.394	3.360	20	30		EGEDHN
C/C(=C/C(=O)N1CCC[C@H]2CN(Cc3cccc(C#N)c3)C[C@H]21)C1CC1	ZINC001049983760	1348144381	/nfs/dbraw/zinc/14/43/81/1348144381.db2.gz	OMRXLYVRJBLRRW-MRCYYLRGSA-N	0	3	349.478	3.337	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cccc4ccc(C)nc43)[C@@H]2C1	ZINC001050073682	1348172612	/nfs/dbraw/zinc/17/26/12/1348172612.db2.gz	KVTQVYRJTHPYJD-PKOBYXMFSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3ccc4cc(C)ccc4n3)[C@@H]2C1	ZINC001050093097	1348180903	/nfs/dbraw/zinc/18/09/03/1348180903.db2.gz	IEEAMXUQXQEDKY-FXAWDEMLSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3cc(F)c(F)c(F)c3)[C@@H]2C1	ZINC001050145419	1348195044	/nfs/dbraw/zinc/19/50/44/1348195044.db2.gz	SQNMYXQSRYRWSZ-BLLLJJGKSA-N	0	3	338.373	3.216	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)C3[C@H]4CCCCCC[C@H]34)[C@@H]2C1	ZINC001050149313	1348196493	/nfs/dbraw/zinc/19/64/93/1348196493.db2.gz	GVEYVDQRDORMDL-CADBVGFASA-N	0	3	328.500	3.149	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)COc3c(C)cc(C)cc3C)[C@@H]2C1	ZINC001050196861	1348207706	/nfs/dbraw/zinc/20/77/06/1348207706.db2.gz	OZJRTBABKLEGTI-RBUKOAKNSA-N	0	3	342.483	3.099	20	30		EGEDHN
C#CCCN1C[C@@H]2CCCN(C(=O)c3sc(C(C)C)nc3C)[C@@H]2C1	ZINC001050199857	1348210015	/nfs/dbraw/zinc/21/00/15/1348210015.db2.gz	CMMDDCBRDNDMBP-JKSUJKDBSA-N	0	3	345.512	3.135	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)c3c[nH]c4ccc(C)cc34)[C@@H]2C1	ZINC001050209423	1348211685	/nfs/dbraw/zinc/21/16/85/1348211685.db2.gz	BBYJHSRWQPXTTJ-OXJNMPFZSA-N	0	3	335.451	3.036	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)[C@@H]4CC=CCC4)C3)CC2)c1	ZINC001050429881	1348263639	/nfs/dbraw/zinc/26/36/39/1348263639.db2.gz	MZIBPFOYJFWXCE-HXUWFJFHSA-N	0	3	349.478	3.339	20	30		EGEDHN
Cc1cccc(Cl)c1CN1CCC2(CN(C(=O)[C@@H](C)C#N)C2)CC1	ZINC001050463351	1348272199	/nfs/dbraw/zinc/27/21/99/1348272199.db2.gz	PETZADJUOBFRGI-HNNXBMFYSA-N	0	3	345.874	3.233	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H]3[C@H](C=C(C)C)C3(C)C)C2)CC1	ZINC001050584359	1348293933	/nfs/dbraw/zinc/29/39/33/1348293933.db2.gz	CRHJVPCDHIKJPL-ZWKOTPCHSA-N	0	3	328.500	3.173	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC3(C2)CCN(Cc2cncc(C)c2)CC3)C1	ZINC001050657968	1348319690	/nfs/dbraw/zinc/31/96/90/1348319690.db2.gz	XNJJHCCZBTZXMG-UHFFFAOYSA-N	0	3	339.483	3.171	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3cc(C)[nH]c3C)cccc2C1	ZINC001051300224	1348424843	/nfs/dbraw/zinc/42/48/43/1348424843.db2.gz	JGLQCMPKFQSMLM-UHFFFAOYSA-N	0	3	337.467	3.496	20	30		EGEDHN
C=C(C)CCN1CCN([C@H]2CCN(C(=O)C(CC)(CC)CC)C2)CC1	ZINC001052100313	1348502282	/nfs/dbraw/zinc/50/22/82/1348502282.db2.gz	CZTJZLCDHVJHFT-IBGZPJMESA-N	0	3	349.563	3.388	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2cc3cccc(C)c3s2)CC1	ZINC001052501444	1348560659	/nfs/dbraw/zinc/56/06/59/1348560659.db2.gz	CUFLEVXNUSNFNH-MRXNPFEDSA-N	0	3	326.465	3.427	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2cc3cc(Cl)ccc3[nH]2)CC1	ZINC001052614394	1348597375	/nfs/dbraw/zinc/59/73/75/1348597375.db2.gz	QCAMCIONCJYMAW-HNNXBMFYSA-N	0	3	329.831	3.039	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@H](NC(=O)[C@H]3C[C@H]4C[C@H]4C3)CC2)c1	ZINC001052643873	1348609622	/nfs/dbraw/zinc/60/96/22/1348609622.db2.gz	OHFPMXXPWXVNQC-NMLBUPMWSA-N	0	3	337.467	3.075	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)Cc2c[nH]c3cc(C)ccc23)CC1	ZINC001052785255	1348678762	/nfs/dbraw/zinc/67/87/62/1348678762.db2.gz	FOKMJBOAMGEPSH-SFHVURJKSA-N	0	3	337.467	3.013	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2csc3c2CC[C@H](C)C3)CC1	ZINC001052911889	1348744473	/nfs/dbraw/zinc/74/44/73/1348744473.db2.gz	PYUHOOYAIJSOQR-GJZGRUSLSA-N	0	3	330.497	3.090	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@@H](C)c2ccc(F)cc2F)CC1	ZINC001052948191	1348765144	/nfs/dbraw/zinc/76/51/44/1348765144.db2.gz	YSHSBXUSHJJCQY-GOEBONIOSA-N	0	3	334.410	3.062	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](NC(=O)c2cccc(CN(C)C)c2)CC1	ZINC001052954068	1348768425	/nfs/dbraw/zinc/76/84/25/1348768425.db2.gz	KRARHDVLWFNPED-GOSISDBHSA-N	0	3	349.906	3.085	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)C2CC(c3ccc(F)cc3)C2)CC1	ZINC001052970212	1348780735	/nfs/dbraw/zinc/78/07/35/1348780735.db2.gz	GZMZJIRGIOAREF-AFMYVXGZSA-N	0	3	342.458	3.313	20	30		EGEDHN
CCC(=O)N1CCC[C@@H]([C@H]2CCCN(CC#Cc3ccccc3)C2)C1	ZINC001052996517	1348793040	/nfs/dbraw/zinc/79/30/40/1348793040.db2.gz	JQCCIGJXYWWYJV-LEWJYISDSA-N	0	3	338.495	3.399	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC[C@@H]([C@H]3CCCN(CCF)C3)C2)cc1	ZINC001053036193	1348835881	/nfs/dbraw/zinc/83/58/81/1348835881.db2.gz	IMHVJEZQSDWHBD-VQTJNVASSA-N	0	3	342.458	3.202	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)Cc2ccsc2)C1	ZINC001053061698	1348871305	/nfs/dbraw/zinc/87/13/05/1348871305.db2.gz	UNLMTLSKBPIDAG-RTBURBONSA-N	0	3	344.524	3.407	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cccs2)C1	ZINC001053062913	1348873926	/nfs/dbraw/zinc/87/39/26/1348873926.db2.gz	FCMPCZNSKCKMON-IAGOWNOFSA-N	0	3	330.497	3.478	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cc(Cl)c[nH]2)C1	ZINC001053066565	1348878873	/nfs/dbraw/zinc/87/88/73/1348878873.db2.gz	AZPYKXYGLDYPHK-CRAIPNDOSA-N	0	3	347.890	3.398	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(Cl)o2)C1	ZINC001053067931	1348881295	/nfs/dbraw/zinc/88/12/95/1348881295.db2.gz	TWDIHXUDEQXRFO-CABCVRRESA-N	0	3	334.847	3.273	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2scnc2C)C1	ZINC001053070005	1348883371	/nfs/dbraw/zinc/88/33/71/1348883371.db2.gz	RQUVAZUZUMUUEB-SJORKVTESA-N	0	3	345.512	3.182	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)COC2CCCC2)C1	ZINC001053070221	1348884499	/nfs/dbraw/zinc/88/44/99/1348884499.db2.gz	UPTQPADWAAERDX-QUCCMNQESA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccoc2CC)C1	ZINC001053085354	1348906977	/nfs/dbraw/zinc/90/69/77/1348906977.db2.gz	FMNNIOKLNYLXNE-FUHWJXTLSA-N	0	3	328.456	3.182	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(F)c(C)c2)C1	ZINC001053091472	1348916946	/nfs/dbraw/zinc/91/69/46/1348916946.db2.gz	AKLIBGOJNMYRDN-UYAOXDASSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccc(Cl)[nH]2)C1	ZINC001053093830	1348922506	/nfs/dbraw/zinc/92/25/06/1348922506.db2.gz	AFRRYKKWZSSJBW-GOEBONIOSA-N	0	3	333.863	3.008	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ncccc2Cl)C1	ZINC001053103947	1348938407	/nfs/dbraw/zinc/93/84/07/1348938407.db2.gz	MARMGOHBEIXESN-NVXWUHKLSA-N	0	3	345.874	3.075	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(F)s2)C1	ZINC001053106113	1348944448	/nfs/dbraw/zinc/94/44/48/1348944448.db2.gz	SFRXFVUAFODMPP-HUUCEWRRSA-N	0	3	334.460	3.227	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)CCc2cccs2)C1	ZINC001053107586	1348946660	/nfs/dbraw/zinc/94/66/60/1348946660.db2.gz	JWBJYSDUMQQYKN-MJGOQNOKSA-N	0	3	344.524	3.407	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc3cc(C)cn3c1)C2	ZINC001054142632	1349153574	/nfs/dbraw/zinc/15/35/74/1349153574.db2.gz	HGXIXUFAYAGQKT-QFIPXVFZSA-N	0	3	349.478	3.199	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cscc1Cl)C2	ZINC001054149871	1349155525	/nfs/dbraw/zinc/15/55/25/1349155525.db2.gz	PUCXYMGIUFZZOU-QGZVFWFLSA-N	0	3	336.888	3.353	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)C1(c3ccccc3)CCC1)C2	ZINC001054161274	1349163848	/nfs/dbraw/zinc/16/38/48/1349163848.db2.gz	ANCXOJFKFGEDSO-OAQYLSRUSA-N	0	3	336.479	3.056	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H]1C[C@@H]3CCCC[C@H]13)C2	ZINC001054169011	1349170481	/nfs/dbraw/zinc/17/04/81/1349170481.db2.gz	OCALQMAUDZEGAW-HUUJSLGLSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)Cc1cccc(C3CC3)c1)C2	ZINC001054171268	1349173159	/nfs/dbraw/zinc/17/31/59/1349173159.db2.gz	MVGLMAKQLKGRHZ-QFIPXVFZSA-N	0	3	336.479	3.054	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1c(C)cc(F)cc1C)C2	ZINC001054174471	1349175189	/nfs/dbraw/zinc/17/51/89/1349175189.db2.gz	QTHPZYQPMHWAIX-HXUWFJFHSA-N	0	3	328.431	3.004	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC[C@]3(CCN(C/C=C/Cl)C3)C2)cc1	ZINC001054174023	1349175225	/nfs/dbraw/zinc/17/52/25/1349175225.db2.gz	JKIFWRWTJBBANA-FTJUBABDSA-N	0	3	342.870	3.349	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@H]1[C@@H]3CCCCCC[C@@H]31)C2	ZINC001054203967	1349205190	/nfs/dbraw/zinc/20/51/90/1349205190.db2.gz	MNFKENKMRREHTD-XODKDNOYSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H](C)c1ccccc1F)C2	ZINC001054215778	1349215110	/nfs/dbraw/zinc/21/51/10/1349215110.db2.gz	FIGWAQQFONABOI-LAUBAEHRSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@H](C)c1ccc(C)s1)C2	ZINC001054226915	1349220973	/nfs/dbraw/zinc/22/09/73/1349220973.db2.gz	GEPDEOYEWMYGKV-VQIMIIECSA-N	0	3	330.497	3.108	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@H](C)c1ccc(C)cc1)C2	ZINC001054227528	1349221862	/nfs/dbraw/zinc/22/18/62/1349221862.db2.gz	IUXIDHOIDPKWTF-DENIHFKCSA-N	0	3	338.495	3.436	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc3c(s1)CCC3)C2	ZINC001054236404	1349229470	/nfs/dbraw/zinc/22/94/70/1349229470.db2.gz	JTSHFVIDOWANPB-HXUWFJFHSA-N	0	3	342.508	3.188	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)C(C)(C)c1ccccc1)C2	ZINC001054238256	1349231741	/nfs/dbraw/zinc/23/17/41/1349231741.db2.gz	NWOVKFRGSLKPGI-JOCHJYFZSA-N	0	3	338.495	3.302	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc(CC)c(C)s1)C2	ZINC001054238617	1349233003	/nfs/dbraw/zinc/23/30/03/1349233003.db2.gz	ZSFNTGKXBQMGJL-LJQANCHMSA-N	0	3	330.497	3.180	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)C3=COCCC3)cc2C1	ZINC001054257334	1349252747	/nfs/dbraw/zinc/25/27/47/1349252747.db2.gz	GZQCIMBHFTWKCB-UHFFFAOYSA-N	0	3	326.440	3.279	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3ncoc3CC)cc2C1	ZINC001054259259	1349254981	/nfs/dbraw/zinc/25/49/81/1349254981.db2.gz	RVMPNIKSDRHWEC-UHFFFAOYSA-N	0	3	325.412	3.059	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3ocnc3C)cc2C1	ZINC001054260315	1349256564	/nfs/dbraw/zinc/25/65/64/1349256564.db2.gz	JNZOAXCVSWUIOA-UHFFFAOYSA-N	0	3	325.412	3.195	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3ccc(F)cn3)cc2C1	ZINC001054262006	1349259546	/nfs/dbraw/zinc/25/95/46/1349259546.db2.gz	GJBDFBFVBQJVIZ-UHFFFAOYSA-N	0	3	325.387	3.042	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3ccn(C(C)C)n3)cc2C1	ZINC001054284039	1349284852	/nfs/dbraw/zinc/28/48/52/1349284852.db2.gz	BGGIEFFDPXDYJU-UHFFFAOYSA-N	0	3	338.455	3.286	20	30		EGEDHN
Cc1cscc1C(=O)N1C[C@@H](C)[C@@H](NCc2ccc(C#N)s2)C1	ZINC001054536646	1349388711	/nfs/dbraw/zinc/38/87/11/1349388711.db2.gz	FDTXPQJSDLBYCR-BZNIZROVSA-N	0	3	345.493	3.240	20	30		EGEDHN
C[C@H]1CN(C(=O)C2C(C)(C)C2(C)C)C[C@H]1NCc1ccc(C#N)s1	ZINC001054543500	1349393030	/nfs/dbraw/zinc/39/30/30/1349393030.db2.gz	VQLMIXREAOWBIE-SWLSCSKDSA-N	0	3	345.512	3.238	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2(C)CCCC2)C[C@H]1NCc1ccc(C#N)s1	ZINC001054944770	1349524332	/nfs/dbraw/zinc/52/43/32/1349524332.db2.gz	SWCOUVLEERDENC-CZUORRHYSA-N	0	3	331.485	3.137	20	30		EGEDHN
CCC1(C(=O)N2C[C@@H](C)[C@H](NCc3ccc(C#N)c(F)c3)C2)CCC1	ZINC001054987228	1349539718	/nfs/dbraw/zinc/53/97/18/1349539718.db2.gz	VCBKIZUDXXWYNF-RDTXWAMCSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@H]1CN(C(=O)C2CC3(CCC3)C2)C[C@H]1NCc1ccc(C#N)s1	ZINC001054992273	1349541665	/nfs/dbraw/zinc/54/16/65/1349541665.db2.gz	PDCNGDHEGYIPOQ-SUMWQHHRSA-N	0	3	343.496	3.137	20	30		EGEDHN
C=C(CN1CCCC1)C(=O)Nc1nc(Cl)c(Cl)nc1Cl	ZINC001183039023	1387255398	/nfs/dbraw/zinc/25/53/98/1387255398.db2.gz	LGKBOWMDVLQSTQ-UHFFFAOYSA-N	0	3	335.622	3.027	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2cc3c(ccc(C)c3C)[nH]2)C1	ZINC001080256519	1357538306	/nfs/dbraw/zinc/53/83/06/1357538306.db2.gz	UQYDXJDTRIEGKE-AUUYWEPGSA-N	0	3	325.456	3.411	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@@H]2C[C@H]2c2c(F)cccc2F)C1	ZINC001080407462	1357610528	/nfs/dbraw/zinc/61/05/28/1357610528.db2.gz	BZRIJJYHOUVOJO-VMUDFCTBSA-N	0	3	334.410	3.081	20	30		EGEDHN
C#CCCN1C[C@@H](C)[C@H](NC(=O)C(C)(C)c2cccc(Cl)c2)C1	ZINC001080525845	1357661368	/nfs/dbraw/zinc/66/13/68/1357661368.db2.gz	OFXXCEUMBKOGTN-RHSMWYFYSA-N	0	3	332.875	3.077	20	30		EGEDHN
C=C(C)CCN1C[C@@H](C)[C@H](NC(=O)c2cnc([C@H]3CCCO3)s2)C1	ZINC001080579273	1357683850	/nfs/dbraw/zinc/68/38/50/1357683850.db2.gz	XOJBAACYJMOQMX-RBSFLKMASA-N	0	3	349.500	3.011	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)[C@@H]2C[C@@H]2C(C)C)CC1	ZINC001167579905	1383676948	/nfs/dbraw/zinc/67/69/48/1383676948.db2.gz	WRAFDICOWKBQPF-ZIAGYGMSSA-N	0	3	343.309	3.063	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)[C@@H]2CCCCC2(C)C)C1	ZINC001070435644	1354348312	/nfs/dbraw/zinc/34/83/12/1354348312.db2.gz	MSWGXXSKHJRTQT-WBVHZDCISA-N	0	3	344.503	3.218	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1ccc(CC)s1)C[C@@H](C)O2	ZINC001071185163	1354491595	/nfs/dbraw/zinc/49/15/95/1354491595.db2.gz	BMKPDOGPUSXHET-BEFAXECRSA-N	0	3	348.512	3.192	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1cc(F)ccc1C)C[C@@H](C)O2	ZINC001071195515	1354496496	/nfs/dbraw/zinc/49/64/96/1354496496.db2.gz	YMQKTZQGEMSMBP-OXQOHEQNSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1ccc(CC)cc1)C[C@@H](C)O2	ZINC001071238886	1354521404	/nfs/dbraw/zinc/52/14/04/1354521404.db2.gz	SLZOWSLOGCLVGY-UTKZUKDTSA-N	0	3	342.483	3.131	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1ccc(COC(C)C)cc1	ZINC001085966591	1358924525	/nfs/dbraw/zinc/92/45/25/1358924525.db2.gz	OCVFKDNJOVKDLG-LJQANCHMSA-N	0	3	330.472	3.334	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@H]3CCC(C)=C(C)C3)C2)CC1	ZINC001086924458	1359249663	/nfs/dbraw/zinc/24/96/63/1359249663.db2.gz	SXBYOCPCDIAUKQ-OALUTQOASA-N	0	3	328.500	3.459	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2oc(CC3CC3)nc2C)CC[C@H]1C	ZINC001071504644	1354732696	/nfs/dbraw/zinc/73/26/96/1354732696.db2.gz	IKUYJVVTGZANPV-CJNGLKHVSA-N	0	3	331.460	3.094	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cscc2C(F)F)CC[C@H]1C	ZINC001071512599	1354736811	/nfs/dbraw/zinc/73/68/11/1354736811.db2.gz	ZSWKKBZCLGPXAD-NEPJUHHUSA-N	0	3	326.412	3.292	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2ccc(OC)cc2C)CC[C@@H]1C	ZINC001071530872	1354749851	/nfs/dbraw/zinc/74/98/51/1354749851.db2.gz	BWJXRZJVIQLXEO-FUHWJXTLSA-N	0	3	330.472	3.091	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2oc3c(cccc3F)c2C)CC[C@H]1C	ZINC001071568345	1354767691	/nfs/dbraw/zinc/76/76/91/1354767691.db2.gz	MLIPIZZQFCYKHI-UKRRQHHQSA-N	0	3	342.414	3.486	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccnc(-n3cccc3)c2)CC[C@H]1C	ZINC001071594671	1354785086	/nfs/dbraw/zinc/78/50/86/1354785086.db2.gz	WIXNWZNPVRVUPU-AEFFLSMTSA-N	0	3	338.455	3.031	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2cc(C)c(Cl)cn2)CC[C@H]1C	ZINC001071601772	1354788999	/nfs/dbraw/zinc/78/89/99/1354788999.db2.gz	DSFGTSRKULIKFN-CABCVRRESA-N	0	3	335.879	3.131	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc(C3CC3)[nH]c2C2CC2)CC[C@H]1C	ZINC001071607844	1354793175	/nfs/dbraw/zinc/79/31/75/1354793175.db2.gz	SXHUEKOFIAWBBT-RHSMWYFYSA-N	0	3	339.483	3.376	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2[nH]c3ccccc3c2Cl)CC[C@@H]1C	ZINC001071646175	1354824017	/nfs/dbraw/zinc/82/40/17/1354824017.db2.gz	SXIRSDOWQRYYSU-KBPBESRZSA-N	0	3	343.858	3.427	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cnn3cccc(Cl)c23)CC[C@@H]1C	ZINC001071670507	1354840079	/nfs/dbraw/zinc/84/00/79/1354840079.db2.gz	LWKZZYJGKOJUNC-KBPBESRZSA-N	0	3	346.862	3.147	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(C)c3cccnc23)CC[C@@H]1C	ZINC001071695525	1354857355	/nfs/dbraw/zinc/85/73/55/1354857355.db2.gz	QWHXPLGXJALUIB-IRXDYDNUSA-N	0	3	335.451	3.149	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2cc(F)c(C)cc2F)CC[C@@H]1C	ZINC001071701949	1354861660	/nfs/dbraw/zinc/86/16/60/1354861660.db2.gz	QPWRFOOHVHCEJQ-HOCLYGCPSA-N	0	3	336.426	3.361	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2csc(-c3ccco3)n2)CC[C@H]1C	ZINC001071775436	1354921491	/nfs/dbraw/zinc/92/14/91/1354921491.db2.gz	CFXGIMVLRQGDSA-KGLIPLIRSA-N	0	3	343.452	3.009	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(-c3ccccc3)nc2)CC[C@@H]1C	ZINC001071928195	1355028794	/nfs/dbraw/zinc/02/87/94/1355028794.db2.gz	ZGODELGKRFUEAE-FXAWDEMLSA-N	0	3	347.462	3.355	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc3scnc3c2)CC[C@H]1C	ZINC001071960648	1355044592	/nfs/dbraw/zinc/04/45/92/1355044592.db2.gz	GNJNMQXLIMLYEL-HIFRSBDPSA-N	0	3	329.469	3.455	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cnn(CCC(C)C)c2C)CC[C@@H]1C	ZINC001071972824	1355054730	/nfs/dbraw/zinc/05/47/30/1355054730.db2.gz	BPUZIPJHXPSQHH-FUHWJXTLSA-N	0	3	346.519	3.396	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cn(CCCC)nc2C)CC[C@@H]1C	ZINC001071976779	1355056862	/nfs/dbraw/zinc/05/68/62/1355056862.db2.gz	IESBWIYPYQMVAS-DOTOQJQBSA-N	0	3	332.492	3.150	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C(C)(C)c2ccc(F)cc2)CC[C@@H]1C	ZINC001072007276	1355071487	/nfs/dbraw/zinc/07/14/87/1355071487.db2.gz	ZKJJHIHTLCBDRO-MAUKXSAKSA-N	0	3	330.447	3.096	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2(c3ccccc3)CCCC2)CC[C@H]1C	ZINC001072053922	1355105090	/nfs/dbraw/zinc/10/50/90/1355105090.db2.gz	WKNVHYLUKISFQX-QUCCMNQESA-N	0	3	338.495	3.491	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc3ccccc3n2CC)CC[C@@H]1C	ZINC001072092752	1355125054	/nfs/dbraw/zinc/12/50/54/1355125054.db2.gz	WZRRWEHINVHWCX-FUHWJXTLSA-N	0	3	337.467	3.267	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2(c3ccc(C)cc3)CCC2)CC[C@@H]1C	ZINC001072101934	1355130625	/nfs/dbraw/zinc/13/06/25/1355130625.db2.gz	LQGNPPGHDFJZPA-ICSRJNTNSA-N	0	3	338.495	3.409	20	30		EGEDHN
C[C@H]1CCN(C(=O)C2CCC2)C[C@H]1CNCc1cc(F)ccc1C#N	ZINC001072153914	1355154701	/nfs/dbraw/zinc/15/47/01/1355154701.db2.gz	JZGKWHAIKRADBR-KBXCAEBGSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](C)[C@@H](CNCc2csc(C)n2)C1	ZINC001072334928	1355243735	/nfs/dbraw/zinc/24/37/35/1355243735.db2.gz	JULJUIQVCUAAKO-ZFWWWQNUSA-N	0	3	335.517	3.238	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H](CC)Cc3ccccc3C)C2)C1	ZINC001073125579	1355610026	/nfs/dbraw/zinc/61/00/26/1355610026.db2.gz	BNGHXHATJFHDNS-LJQANCHMSA-N	0	3	338.495	3.121	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)C(C)(C)c3ccccc3Cl)C2)C1	ZINC001073136379	1355615558	/nfs/dbraw/zinc/61/55/58/1355615558.db2.gz	KCKSTWQVOPNGMC-UHFFFAOYSA-N	0	3	332.875	3.338	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2ccc(C3CC3)s2)C1	ZINC001073856605	1355920679	/nfs/dbraw/zinc/92/06/79/1355920679.db2.gz	KNSHSARKFGJAIS-OAHLLOKOSA-N	0	3	334.485	3.022	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCCN1C(=O)/C=C/C1CC1	ZINC001073979262	1356008054	/nfs/dbraw/zinc/00/80/54/1356008054.db2.gz	SVSXHXXEDRYLIR-YVNCXZRQSA-N	0	3	337.467	3.337	20	30		EGEDHN
C#CCCN1C[C@@H](C)[C@H](NC(=O)c2ccc(Cl)c(Cl)c2)C1	ZINC001080833386	1357747617	/nfs/dbraw/zinc/74/76/17/1357747617.db2.gz	GPTSZXPIULTBHI-IAQYHMDHSA-N	0	3	325.239	3.067	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@H](NCc2ccc(C#N)s2)[C@@H]1C)C1CCC1	ZINC001074707262	1356226704	/nfs/dbraw/zinc/22/67/04/1356226704.db2.gz	YEHKTQLHMUVVRV-DCGLDWPTSA-N	0	3	331.485	3.135	20	30		EGEDHN
C=C[C@H](C(=O)N1CC[C@H](NCc2cccnc2)[C@@H]1C)c1ccccc1	ZINC001075125127	1356319725	/nfs/dbraw/zinc/31/97/25/1356319725.db2.gz	SQMNSFQAHIMLPM-VDGAXYAQSA-N	0	3	335.451	3.130	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H](C)Cn1ccc(C)n1	ZINC001099098074	1363620591	/nfs/dbraw/zinc/62/05/91/1363620591.db2.gz	IWCLPUKOBKANPI-WMZOPIPTSA-N	0	3	346.519	3.011	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)C(C)(C)C(F)(F)F	ZINC001099315875	1363745355	/nfs/dbraw/zinc/74/53/55/1363745355.db2.gz	IYIPKQLDHDBCLT-ZDUSSCGKSA-N	0	3	332.410	3.205	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCCO[C@H](CNCc2cccc(F)c2)C1	ZINC001078460394	1356977949	/nfs/dbraw/zinc/97/79/49/1356977949.db2.gz	RUHVVVIPHFXOOO-QUCCMNQESA-N	0	3	348.462	3.135	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2C[C@H](NCC(=C)Cl)C23CCC3)cc1	ZINC001078698715	1357060186	/nfs/dbraw/zinc/06/01/86/1357060186.db2.gz	UOVDZTWWVGCTEP-IRXDYDNUSA-N	0	3	328.843	3.051	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2C[C@H](NCc3cnc(C)o3)C23CCC3)CC1	ZINC001078716836	1357063073	/nfs/dbraw/zinc/06/30/73/1357063073.db2.gz	ZHNKXKUNDRUEIF-ZWKOTPCHSA-N	0	3	343.471	3.246	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@@H](NCc3ccc(F)cn3)C23CCC3)C1	ZINC001078720641	1357066025	/nfs/dbraw/zinc/06/60/25/1357066025.db2.gz	OGTRWGBSILAHDF-SJORKVTESA-N	0	3	343.446	3.094	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2coc(C3CCC3)n2)C12CCC2	ZINC001078773542	1357077746	/nfs/dbraw/zinc/07/77/46/1357077746.db2.gz	JDLXALTZQILDKS-GJZGRUSLSA-N	0	3	349.862	3.325	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@]2(C)CCc3ccccc3C2)C1	ZINC001081066690	1357806889	/nfs/dbraw/zinc/80/68/89/1357806889.db2.gz	CCWSJRUVWLLVML-OZOXKJRCSA-N	0	3	326.484	3.194	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)Cc2ccc(C)c(C)c2)C[C@H]1c1ccccc1	ZINC001081222283	1357851365	/nfs/dbraw/zinc/85/13/65/1357851365.db2.gz	WGRUANCSTMMTFS-FCHUYYIVSA-N	0	3	346.474	3.063	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)C[C@H](C)C3CCCCC3)[C@H]2C1	ZINC001083222391	1358124626	/nfs/dbraw/zinc/12/46/26/1358124626.db2.gz	QZAZQYKKGKUBFQ-YSIASYRMSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)C[C@H]3CCCC(C)(C)C3)[C@H]2C1	ZINC001083248174	1358126498	/nfs/dbraw/zinc/12/64/98/1358126498.db2.gz	UUMUAJTWONPWNU-CEXWTWQISA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)COc3cccc(C(C)C)c3)[C@@H]2C1	ZINC001084366591	1358200315	/nfs/dbraw/zinc/20/03/15/1358200315.db2.gz	VNJNUIQVTKPWGV-UYAOXDASSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=CCn1cccc1C(=O)N1C[C@H]2CCN(CC3=CCCCC3)C[C@H]21	ZINC001084409154	1358208674	/nfs/dbraw/zinc/20/86/74/1358208674.db2.gz	LXJNGLILDQSNMB-UYAOXDASSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)Cc3ccc(Cl)c(F)c3)[C@@H]2C1	ZINC001084684506	1358278776	/nfs/dbraw/zinc/27/87/76/1358278776.db2.gz	MOZXVGSYDQUYRY-RHSMWYFYSA-N	0	3	336.838	3.130	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)Cc3c[nH]c4c3cccc4C)[C@@H]2C1	ZINC001084702614	1358286690	/nfs/dbraw/zinc/28/66/90/1358286690.db2.gz	IGMMHQFOUVNUBR-VQIMIIECSA-N	0	3	337.467	3.128	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3sc(CC)nc3C)[C@@H]2C1	ZINC001084717545	1358291923	/nfs/dbraw/zinc/29/19/23/1358291923.db2.gz	ZYAHJDNCNHTTND-HUUCEWRRSA-N	0	3	333.501	3.126	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3cc4cccnc4s3)[C@@H]2C1	ZINC001084755458	1358301625	/nfs/dbraw/zinc/30/16/25/1358301625.db2.gz	UPIJCHAEELIDNL-HUUCEWRRSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3coc(C4CCC4)n3)[C@@H]2C1	ZINC001084763957	1358304422	/nfs/dbraw/zinc/30/44/22/1358304422.db2.gz	JFMKYIVGJYKHEQ-NVXWUHKLSA-N	0	3	329.444	3.055	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)c3ccc(Cl)c(CCC)c3)[C@@H]2C1	ZINC001084775014	1358307066	/nfs/dbraw/zinc/30/70/66/1358307066.db2.gz	PKHKFAPJRIBJCM-IEBWSBKVSA-N	0	3	344.886	3.462	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3coc(C4CCCCC4)n3)[C@@H]2C1	ZINC001084861862	1358333999	/nfs/dbraw/zinc/33/39/99/1358333999.db2.gz	JFUOZEKQQCLARX-SJLPKXTDSA-N	0	3	343.471	3.445	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@H]3CCCC[C@H]3C(F)(F)F)C[C@@H]21	ZINC001084962288	1358355028	/nfs/dbraw/zinc/35/50/28/1358355028.db2.gz	CUEIJVGSTNPGLB-FPCVCCKLSA-N	0	3	344.421	3.464	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCCC[C@H]2NC(=O)C2CCCC2)c(F)c1	ZINC001085114296	1358396250	/nfs/dbraw/zinc/39/62/50/1358396250.db2.gz	PYDKQYAPEJSZMY-RTBURBONSA-N	0	3	343.446	3.405	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccoc1C	ZINC001085127640	1358404559	/nfs/dbraw/zinc/40/45/59/1358404559.db2.gz	LAQCPTTZVQVDNV-ZIAGYGMSSA-N	0	3	341.249	3.127	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)CC1CCC1	ZINC001085160137	1358415928	/nfs/dbraw/zinc/41/59/28/1358415928.db2.gz	VBKZPNLOORUXRE-ZIAGYGMSSA-N	0	3	329.282	3.102	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccn2c1CCCC2	ZINC001085228566	1358438656	/nfs/dbraw/zinc/43/86/56/1358438656.db2.gz	SCRRONONIWTUTA-HZPDHXFCSA-N	0	3	335.879	3.208	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)Cc1noc2ccccc21	ZINC001085264343	1358446782	/nfs/dbraw/zinc/44/67/82/1358446782.db2.gz	HJBIYXPEUMNBAE-HUUCEWRRSA-N	0	3	347.846	3.140	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cc2c(cn1)CCCC2	ZINC001085267207	1358447397	/nfs/dbraw/zinc/44/73/97/1358447397.db2.gz	NWUFGOXJKIWDMG-IAGOWNOFSA-N	0	3	347.890	3.344	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H]1Cc2ccc(F)cc21	ZINC001085311285	1358462151	/nfs/dbraw/zinc/46/21/51/1358462151.db2.gz	APQDKZYWHPWCLW-GVDBMIGSSA-N	0	3	336.838	3.235	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1snnc1C(C)C	ZINC001085372447	1358481013	/nfs/dbraw/zinc/48/10/13/1358481013.db2.gz	PYTSMBOQCBCJCM-VXGBXAGGSA-N	0	3	342.896	3.045	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)C[C@H]1OCc2ccccc21	ZINC001085408781	1358493015	/nfs/dbraw/zinc/49/30/15/1358493015.db2.gz	RTOIOKVJULGIKQ-KZNAEPCWSA-N	0	3	348.874	3.418	20	30		EGEDHN
CN(C[C@@H]1CCN1[C@H]1CCCc2ccccc21)C(=O)c1c[nH]c(C#N)c1	ZINC001085556745	1358591971	/nfs/dbraw/zinc/59/19/71/1358591971.db2.gz	YURJRPTZLDLRJW-ICSRJNTNSA-N	0	3	348.450	3.110	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1csc([C@@H]2CCCO2)n1	ZINC001085594467	1358621658	/nfs/dbraw/zinc/62/16/58/1358621658.db2.gz	HJRNWETUASZXKQ-ZBFHGGJFSA-N	0	3	349.500	3.107	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc(C)c(OC)c(C)c1	ZINC001085611581	1358633648	/nfs/dbraw/zinc/63/36/48/1358633648.db2.gz	WHPVXWGKCZJLLO-SFHVURJKSA-N	0	3	330.472	3.425	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)[C@@H]1CCCO[C@H]1c1ccccc1	ZINC001085647816	1358659213	/nfs/dbraw/zinc/65/92/13/1358659213.db2.gz	VNKYCHYJGWJTCI-ZCNNSNEGSA-N	0	3	342.483	3.263	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cccc([C@H]2CCOC2)c1	ZINC001085682129	1358684158	/nfs/dbraw/zinc/68/41/58/1358684158.db2.gz	NTCBOMCTCHLIBG-VQTJNVASSA-N	0	3	342.483	3.303	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cnn2cccc(Cl)c12	ZINC001085711663	1358704397	/nfs/dbraw/zinc/70/43/97/1358704397.db2.gz	OCIWCQXARLMAAU-AWEZNQCLSA-N	0	3	346.862	3.100	20	30		EGEDHN
C=C1CCC(C(=O)N(C)C[C@H]2CCN2C[C@H](OC)C2CCCC2)CC1	ZINC001085801159	1358776057	/nfs/dbraw/zinc/77/60/57/1358776057.db2.gz	LDLIQVSPTIKFQP-UXHICEINSA-N	0	3	348.531	3.471	20	30		EGEDHN
C#Cc1cncc(C(=O)N(C)C[C@@H]2CCN2CCC2=CCCCC2)c1	ZINC001085809714	1358787516	/nfs/dbraw/zinc/78/75/16/1358787516.db2.gz	MAWOAENEZBBDOQ-FQEVSTJZSA-N	0	3	337.467	3.100	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cccnc1C(F)(F)F	ZINC001085843476	1358812045	/nfs/dbraw/zinc/81/20/45/1358812045.db2.gz	MSSOQRKARDWEGE-CYBMUJFWSA-N	0	3	341.377	3.213	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C[C@H]2CCN2[C@H](CC)c2ccccc2)cn1	ZINC001085933933	1358888955	/nfs/dbraw/zinc/88/89/55/1358888955.db2.gz	NNVNNCHJURBMNV-NHCUHLMSSA-N	0	3	347.462	3.361	20	30		EGEDHN
CCCCC(=O)N1CC[C@@H](CNCc2ccccc2C#N)[C@@H](C)C1	ZINC001183913526	1387370014	/nfs/dbraw/zinc/37/00/14/1387370014.db2.gz	SBKJQZCHHSIMFR-WMZOPIPTSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccoc2C(F)(F)F)C1	ZINC001086097304	1358996190	/nfs/dbraw/zinc/99/61/90/1358996190.db2.gz	WZOLSQRJOWKXTG-AOOOYVTPSA-N	0	3	336.741	3.149	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(Cl)cc2F)C1	ZINC001086141616	1359006740	/nfs/dbraw/zinc/00/67/40/1359006740.db2.gz	MBBKWPVLSOKXAQ-KLPPZKSPSA-N	0	3	331.218	3.330	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(OC)c(C3CC3)c2)C1	ZINC001086238777	1359036478	/nfs/dbraw/zinc/03/64/78/1359036478.db2.gz	QWNJNHYVRGRJMH-AKAXFMLLSA-N	0	3	348.874	3.423	20	30		EGEDHN
CC[C@@]1(C)C[C@H]1C(=O)NC[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001086239428	1359036859	/nfs/dbraw/zinc/03/68/59/1359036859.db2.gz	FCAVKWUNBPCAMK-FORWCCJISA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc3cccnc3s2)C1	ZINC001086245238	1359040640	/nfs/dbraw/zinc/04/06/40/1359040640.db2.gz	YHAMTBPWFASAEG-BJHJDKERSA-N	0	3	335.860	3.147	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@H](CNC(=O)c3cccs3)C2)c(F)c1	ZINC001086297536	1359060040	/nfs/dbraw/zinc/06/00/40/1359060040.db2.gz	KINGSCNSVNONRN-CTYIDZIISA-N	0	3	343.427	3.057	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2C[C@H](NCc3oc(CC)nc3C)C2)CC1	ZINC001086467388	1359108425	/nfs/dbraw/zinc/10/84/25/1359108425.db2.gz	ALYQYLOZTBRICT-JCNLHEQBSA-N	0	3	345.487	3.276	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)NC[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001086468703	1359109683	/nfs/dbraw/zinc/10/96/83/1359109683.db2.gz	MWNYYOXTGCLMRX-JOCBIADPSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2c(F)ccc(F)c2Cl)C1	ZINC001086487068	1359115455	/nfs/dbraw/zinc/11/54/55/1359115455.db2.gz	FIRRIKWVNGFFCQ-MGCOHNPYSA-N	0	3	349.208	3.469	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2oc(CC(C)C)nc2C)C1	ZINC001086499999	1359121649	/nfs/dbraw/zinc/12/16/49/1359121649.db2.gz	HQCXSHFLPUQJOZ-HDJSIYSDSA-N	0	3	339.867	3.032	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)C[C@@H]2C[C@H]2C2CC2)C1	ZINC001086600846	1359160741	/nfs/dbraw/zinc/16/07/41/1359160741.db2.gz	RBTKPOVUXGTJMD-XSDIEEQYSA-N	0	3	336.479	3.030	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)[C@]23C[C@H]2CCCC3)C1	ZINC001086608005	1359162783	/nfs/dbraw/zinc/16/27/83/1359162783.db2.gz	ICIAHQSFLUBARX-XAPVIXHLSA-N	0	3	336.479	3.174	20	30		EGEDHN
C=C(Br)CN[C@@H]1CC[C@H](CNC(=O)[C@H]2CC=CCC2)C1	ZINC001086642148	1359174589	/nfs/dbraw/zinc/17/45/89/1359174589.db2.gz	TVCVLMNBILXBHF-SOUVJXGZSA-N	0	3	341.293	3.126	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2coc(C(C)(C)C)n2)C1	ZINC001086695046	1359187300	/nfs/dbraw/zinc/18/73/00/1359187300.db2.gz	YSRJWPTVBQAMSB-QWHCGFSZSA-N	0	3	339.867	3.213	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)[C@@H]2C[C@H]2c2ccsc2)C1	ZINC001086732525	1359192880	/nfs/dbraw/zinc/19/28/80/1359192880.db2.gz	PTESAJGIRYYZQX-DRPJVOAASA-N	0	3	338.904	3.479	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cccc3ncccc32)C1	ZINC001086771008	1359197880	/nfs/dbraw/zinc/19/78/80/1359197880.db2.gz	MLPAAMPPMUOZFB-LSDHHAIUSA-N	0	3	343.858	3.475	20	30		EGEDHN
C=C(Br)CN[C@@H]1CC[C@H](CNC(=O)[C@H]2CCC2(C)C)C1	ZINC001086779627	1359199648	/nfs/dbraw/zinc/19/96/48/1359199648.db2.gz	UGBFTHBUGHSOEA-BFHYXJOUSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CC[C@@H](NCc3cnc(C)o3)C2)CC1	ZINC001086794839	1359203439	/nfs/dbraw/zinc/20/34/39/1359203439.db2.gz	NEKDSCZYPZNSNQ-DOTOQJQBSA-N	0	3	331.460	3.104	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2oc(C3CC3)nc2C)C1	ZINC001086824296	1359208925	/nfs/dbraw/zinc/20/89/25/1359208925.db2.gz	ZSSUBUOVIKJZFE-GXTWGEPZSA-N	0	3	337.851	3.101	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccc3[nH]c(C)nc3c2)C1	ZINC001086839683	1359211664	/nfs/dbraw/zinc/21/16/64/1359211664.db2.gz	RRCPJBFULOTSKV-DZGCQCFKSA-N	0	3	346.862	3.112	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cc[nH]c3C(C)C)C2)CC1	ZINC001086937914	1359260706	/nfs/dbraw/zinc/26/07/06/1359260706.db2.gz	CIWAQZRYHCXAIR-INIZCTEOSA-N	0	3	327.472	3.088	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3cccc(F)c3F)C2)CC1	ZINC001086938445	1359261001	/nfs/dbraw/zinc/26/10/01/1359261001.db2.gz	QGKSYAAVMRVLRN-OAHLLOKOSA-N	0	3	346.421	3.305	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)[C@H]3Cc4ccccc43)C2)CC1	ZINC001086938799	1359261060	/nfs/dbraw/zinc/26/10/60/1359261060.db2.gz	AIBBMJTUFIRSIB-XLIONFOSSA-N	0	3	336.479	3.053	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc4occc4s3)C2)CC1	ZINC001086942157	1359263677	/nfs/dbraw/zinc/26/36/77/1359263677.db2.gz	KHXSKMNEBKZEIS-CQSZACIVSA-N	0	3	342.464	3.444	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cccc4cc[nH]c43)C2)CC1	ZINC001086943879	1359264610	/nfs/dbraw/zinc/26/46/10/1359264610.db2.gz	HRFKZLHQXSXCGL-INIZCTEOSA-N	0	3	335.451	3.118	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H]3C[C@H]3c3ccco3)C2)CC1	ZINC001086945110	1359265792	/nfs/dbraw/zinc/26/57/92/1359265792.db2.gz	RJAJWALALMRKNC-RCCFBDPRSA-N	0	3	340.467	3.109	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc(Cl)c(F)c3)C2)CC1	ZINC001086944695	1359265892	/nfs/dbraw/zinc/26/58/92/1359265892.db2.gz	GQXQVGLMWDWFHN-AWEZNQCLSA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cc(C)ccc3F)C2)CC1	ZINC001086944967	1359265995	/nfs/dbraw/zinc/26/59/95/1359265995.db2.gz	NWOJNBWEXJYRKI-INIZCTEOSA-N	0	3	328.431	3.084	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cccc(F)c3Cl)C2)CC1	ZINC001086945614	1359266375	/nfs/dbraw/zinc/26/63/75/1359266375.db2.gz	FTGARBDPQNWGCO-CQSZACIVSA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)CC[C@H]3CCCCO3)C2)CC1	ZINC001086945752	1359267224	/nfs/dbraw/zinc/26/72/24/1359267224.db2.gz	ICYLBXNTBCIDBG-RTBURBONSA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@H](C)c3ccccc3F)C2)CC1	ZINC001086948715	1359269689	/nfs/dbraw/zinc/26/96/89/1359269689.db2.gz	GKUTVEJOSGFQKU-DLBZAZTESA-N	0	3	342.458	3.265	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3csc(C)c3)C2)CC1	ZINC001086948575	1359269752	/nfs/dbraw/zinc/26/97/52/1359269752.db2.gz	BZAKIPGNBMDMQR-HNNXBMFYSA-N	0	3	330.497	3.396	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccoc3CCC)C2)CC1	ZINC001086952654	1359272802	/nfs/dbraw/zinc/27/28/02/1359272802.db2.gz	MUYBCMZGAPCOMH-MRXNPFEDSA-N	0	3	328.456	3.182	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc(CC(C)C)c[nH]3)C2)CC1	ZINC001086953833	1359274250	/nfs/dbraw/zinc/27/42/50/1359274250.db2.gz	UVVHMBYKVSAAPU-QGZVFWFLSA-N	0	3	341.499	3.163	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cccc4cnccc43)C2)CC1	ZINC001086957467	1359278131	/nfs/dbraw/zinc/27/81/31/1359278131.db2.gz	OSNMCNRRFJDDSJ-KRWDZBQOSA-N	0	3	347.462	3.185	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC[C@@H](C)C[C@H]1CNCc1cc2ccccc2o1	ZINC001087136548	1359301680	/nfs/dbraw/zinc/30/16/80/1359301680.db2.gz	YOGDPJSORNMUOR-VYDXJSESSA-N	0	3	339.439	3.309	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](CNCc2ccccc2C#N)[C@@H](C)C1	ZINC001184078859	1387389985	/nfs/dbraw/zinc/38/99/85/1387389985.db2.gz	RCTBDKSOMKXMEY-WMZOPIPTSA-N	0	3	325.456	3.099	20	30		EGEDHN
C=CCC[N@H+]1CCC[C@@H]2[C@@H](NC(=O)c3ccccc3[O-])C(C)(C)[C@H]21	ZINC001087271538	1359345033	/nfs/dbraw/zinc/34/50/33/1359345033.db2.gz	SRXTZXAFAIRMOQ-NXHRZFHOSA-N	0	3	328.456	3.187	20	30		EGEDHN
C=CCC[N@@H+]1CCC[C@@H]2[C@@H](NC(=O)c3ccccc3[O-])C(C)(C)[C@H]21	ZINC001087271538	1359345035	/nfs/dbraw/zinc/34/50/35/1359345035.db2.gz	SRXTZXAFAIRMOQ-NXHRZFHOSA-N	0	3	328.456	3.187	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(C)cs3)C(C)(C)[C@@H]21	ZINC001087285419	1359364676	/nfs/dbraw/zinc/36/46/76/1359364676.db2.gz	YFFJLBWBHFVUDU-DJIMGWMZSA-N	0	3	330.497	3.299	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc4occc4c3)C(C)(C)[C@H]21	ZINC001087288110	1359366546	/nfs/dbraw/zinc/36/65/46/1359366546.db2.gz	RLBCFFURAAABEP-QRQLOZEOSA-N	0	3	336.435	3.285	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc(F)c3C)C(C)(C)[C@@H]21	ZINC001087288231	1359366807	/nfs/dbraw/zinc/36/68/07/1359366807.db2.gz	TXHLVLYHBVDRRM-BHIYHBOVSA-N	0	3	342.458	3.376	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc(C)c(F)cc3F)C(C)(C)[C@H]21	ZINC001087291204	1359370287	/nfs/dbraw/zinc/37/02/87/1359370287.db2.gz	QIOMZNCPWMLDLO-BVGQSLNGSA-N	0	3	346.421	3.125	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc(Cl)ccc1F	ZINC001087295134	1359375971	/nfs/dbraw/zinc/37/59/71/1359375971.db2.gz	FFDWPRRYAYUPLF-XOKHGSTOSA-N	0	3	348.849	3.331	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc(C(C)C)on1	ZINC001087297448	1359379180	/nfs/dbraw/zinc/37/91/80/1359379180.db2.gz	OYECDQAXQCBIKK-FHLIZLRMSA-N	0	3	343.471	3.040	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc2[nH]ccc2c1	ZINC001087299941	1359382616	/nfs/dbraw/zinc/38/26/16/1359382616.db2.gz	DPAIYWXTTKUFHO-YZGWKJHDSA-N	0	3	349.478	3.410	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccoc3C3CC3)C(C)(C)[C@H]21	ZINC001087300901	1359384288	/nfs/dbraw/zinc/38/42/88/1359384288.db2.gz	SHRGYZNFVOAEGQ-QRQLOZEOSA-N	0	3	340.467	3.399	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(C(C)C)cn3)C(C)(C)[C@@H]21	ZINC001087305160	1359390344	/nfs/dbraw/zinc/39/03/44/1359390344.db2.gz	OCLKBXXIBUJIMG-BHIYHBOVSA-N	0	3	339.483	3.057	20	30		EGEDHN
C=CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(C(C)C)no3)C(C)(C)[C@H]21	ZINC001087305459	1359390543	/nfs/dbraw/zinc/39/05/43/1359390543.db2.gz	SSEPFUBDQPRYKR-XYPHTWIQSA-N	0	3	331.460	3.203	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cccc2c1ccn2C	ZINC001087309048	1359396117	/nfs/dbraw/zinc/39/61/17/1359396117.db2.gz	ZOTHSXBCNFPYKK-YZGWKJHDSA-N	0	3	349.478	3.030	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3oc(CC)cc3C)C(C)(C)[C@H]21	ZINC001087312233	1359400234	/nfs/dbraw/zinc/40/02/34/1359400234.db2.gz	AZHPGSPREUUTDE-NXHRZFHOSA-N	0	3	328.456	3.002	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(C4CC4)s3)C(C)(C)[C@@H]21	ZINC001087313205	1359401634	/nfs/dbraw/zinc/40/16/34/1359401634.db2.gz	QRDZZCJJZLMCKO-ZTFGCOKTSA-N	0	3	342.508	3.478	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc(CC)c(C)s1	ZINC001087316901	1359408329	/nfs/dbraw/zinc/40/83/29/1359408329.db2.gz	ZBUPXZBDIYEQCO-BPQIPLTHSA-N	0	3	344.524	3.471	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(C4CC4)cc3)C(C)(C)[C@@H]21	ZINC001087317865	1359409152	/nfs/dbraw/zinc/40/91/52/1359409152.db2.gz	NZOXNWMOXFIRNY-VAMGGRTRSA-N	0	3	336.479	3.416	20	30		EGEDHN
C/C=C(\C)C(=O)N1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1CC#Cc1ccccc1	ZINC001087347778	1359427985	/nfs/dbraw/zinc/42/79/85/1359427985.db2.gz	KAFYTLSUOHVEJP-AGZKUOPMSA-N	0	3	348.490	3.173	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)c2cc(C)[nH]c2C)C1	ZINC001087438079	1359465654	/nfs/dbraw/zinc/46/56/54/1359465654.db2.gz	DAFWPMUPDDIKDX-TZIWHRDSSA-N	0	3	349.478	3.243	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2F)[C@H]1CC	ZINC001087670361	1359581885	/nfs/dbraw/zinc/58/18/85/1359581885.db2.gz	NSQJKKXPDYXAPW-CIRFHOKZSA-N	0	3	334.410	3.223	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccc3[nH]c(C)nc3c2)[C@H]1CC	ZINC001087776705	1359638850	/nfs/dbraw/zinc/63/88/50/1359638850.db2.gz	SZBQXBSBVZNEHN-FUHWJXTLSA-N	0	3	326.444	3.030	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccc(C)nc2OCCC)[C@H]1CC	ZINC001087778927	1359639548	/nfs/dbraw/zinc/63/95/48/1359639548.db2.gz	ZPKXAMKPFSRHHE-ZWKOTPCHSA-N	0	3	345.487	3.338	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2[nH]ccc2-c2ccccc2)[C@H]1CC	ZINC001087794180	1359649475	/nfs/dbraw/zinc/64/94/75/1359649475.db2.gz	YISITAHAWVBDEB-RBUKOAKNSA-N	0	3	335.451	3.288	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)C(C)(C)C)CCN1Cc1ccc(OCC#N)cc1	ZINC001087806038	1359655790	/nfs/dbraw/zinc/65/57/90/1359655790.db2.gz	KBMPGWBHSSAPRD-ZWKOTPCHSA-N	0	3	343.471	3.104	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](NC(=O)c2ccccc2CN(C)C)[C@H]1CC	ZINC001087840915	1359674678	/nfs/dbraw/zinc/67/46/78/1359674678.db2.gz	UCZYRKMRCURILY-ZWKOTPCHSA-N	0	3	349.906	3.083	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CN(C(=O)c4ccccc4)C[C@@H]3C2)c1	ZINC001087869375	1359689422	/nfs/dbraw/zinc/68/94/22/1359689422.db2.gz	POGGEXIXHHCQII-RTWAWAEBSA-N	0	3	345.446	3.152	20	30		EGEDHN
Cc1coc(C(=O)N2C[C@H]3CCN(Cc4ccc(C#N)cc4)C[C@H]3C2)c1	ZINC001088075454	1359746948	/nfs/dbraw/zinc/74/69/48/1359746948.db2.gz	JPKYRCZNHBZGHM-MOPGFXCFSA-N	0	3	349.434	3.054	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)C[C@H](C)c3cccc(F)c3)C[C@@H]2C1	ZINC001088100668	1359757105	/nfs/dbraw/zinc/75/71/05/1359757105.db2.gz	WWGWCXAGACFURW-UHOSZYNNSA-N	0	3	342.458	3.123	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)[C@H]3[C@@H]4CCCCCC[C@@H]43)C[C@@H]2C1	ZINC001088119173	1359761582	/nfs/dbraw/zinc/76/15/82/1359761582.db2.gz	IBPJLVFRPSGCQT-RMMWZPCPSA-N	0	3	328.500	3.006	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3ccccc3-c3ccccc3)C[C@@H]2C1	ZINC001088190664	1359788369	/nfs/dbraw/zinc/78/83/69/1359788369.db2.gz	LRBOYOGPKNSOFC-UXHICEINSA-N	0	3	344.458	3.381	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3ccc(C(C)(C)C)s3)C[C@@H]2C1	ZINC001088209121	1359795572	/nfs/dbraw/zinc/79/55/72/1359795572.db2.gz	IHPQVIWFTMIVQY-CABCVRRESA-N	0	3	330.497	3.073	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)[C@@H](CC)c3ccc(F)cc3)C[C@@H]2C1	ZINC001088215678	1359799718	/nfs/dbraw/zinc/79/97/18/1359799718.db2.gz	VWFYOJIPEXOLBH-HBFSDRIKSA-N	0	3	342.458	3.123	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3ccc(C4=CCCC4)cc3)C[C@@H]2C1	ZINC001088224769	1359802820	/nfs/dbraw/zinc/80/28/20/1359802820.db2.gz	NYUBMZIIDRJBOM-RTWAWAEBSA-N	0	3	334.463	3.281	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2cccc3c2OCC3)C1	ZINC001088388538	1359866824	/nfs/dbraw/zinc/86/68/24/1359866824.db2.gz	YGFVAWAAXMEZQV-MRXNPFEDSA-N	0	3	348.874	3.348	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)CC[C@H]2CCCOC2)C1	ZINC001088407014	1359878925	/nfs/dbraw/zinc/87/89/25/1359878925.db2.gz	KCWXRBLUZWCUOH-IAGOWNOFSA-N	0	3	342.911	3.307	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3cccc(OC)c3C)[C@@H]2C)C1	ZINC001088844554	1360078351	/nfs/dbraw/zinc/07/83/51/1360078351.db2.gz	WAGZGGGSBLHCEI-AEFFLSMTSA-N	0	3	342.483	3.439	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)C(C)(C)c2ccccc2Cl)[C@H]1C	ZINC001088991612	1360127426	/nfs/dbraw/zinc/12/74/26/1360127426.db2.gz	IVICDTVKQCFMLO-PBHICJAKSA-N	0	3	332.875	3.220	20	30		EGEDHN
CS[C@H](C)C(=O)N1CCCC[C@H]1CN(C)Cc1ccc(C#N)cc1	ZINC001089124540	1360187522	/nfs/dbraw/zinc/18/75/22/1360187522.db2.gz	ZXYJEWQXLAJDID-QAPCUYQASA-N	0	3	345.512	3.123	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCCN1C(=O)[C@H]1CC1(F)F	ZINC001089174351	1360227997	/nfs/dbraw/zinc/22/79/97/1360227997.db2.gz	ZGJCIEJKTJYGGH-DLBZAZTESA-N	0	3	347.409	3.026	20	30		EGEDHN
CC(C)(S)CNC(=O)[C@@H]1CCCN(Cc2ccc(Cl)cc2)C1	ZINC001184403823	1387450285	/nfs/dbraw/zinc/45/02/85/1387450285.db2.gz	FUHJBZAUVTWIIH-CQSZACIVSA-N	0	3	340.920	3.377	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(C(C)(C)C)cn2)CC(C)(C)C1	ZINC001089389345	1360389929	/nfs/dbraw/zinc/38/99/29/1360389929.db2.gz	PHLWOSXRPLLJLA-QGZVFWFLSA-N	0	3	341.499	3.233	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@@H](C)c2c(F)cccc2F)CC(C)(C)C1	ZINC001089440494	1360430875	/nfs/dbraw/zinc/43/08/75/1360430875.db2.gz	AMOCIOSOLCPLPG-LSDHHAIUSA-N	0	3	348.437	3.308	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc3ccc(C)cc3[nH]2)CC(C)(C)C1	ZINC001089453186	1360440452	/nfs/dbraw/zinc/44/04/52/1360440452.db2.gz	KSSLXEDGQXNHCG-KRWDZBQOSA-N	0	3	337.467	3.330	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C(C)C)on2)CC(C)(C)C1	ZINC001089454467	1360441269	/nfs/dbraw/zinc/44/12/69/1360441269.db2.gz	XGOVWKAYFWENAG-OAHLLOKOSA-N	0	3	331.460	3.042	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@H](C)c2ccc(C)s2)CC(C)(C)C1	ZINC001089537532	1360496054	/nfs/dbraw/zinc/49/60/54/1360496054.db2.gz	NVWBIGDKQZXREG-HZPDHXFCSA-N	0	3	332.513	3.400	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C2CCC(C3CC3)CC2)CC(C)(C)C1	ZINC001089548100	1360501983	/nfs/dbraw/zinc/50/19/83/1360501983.db2.gz	GXKNCPSXBNNSML-ACBHZAAOSA-N	0	3	330.516	3.443	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2c(F)cccc2F)CC(C)(C)C1	ZINC001089548712	1360502236	/nfs/dbraw/zinc/50/22/36/1360502236.db2.gz	PIDINJHKZGVPIT-AWEZNQCLSA-N	0	3	334.410	3.209	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@H](C)c2ccc(F)c(F)c2)CC(C)(C)C1	ZINC001089561295	1360509202	/nfs/dbraw/zinc/50/92/02/1360509202.db2.gz	ONIHSMWLDXLANL-GDBMZVCRSA-N	0	3	348.437	3.308	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ccnn1C(C)C	ZINC001089646341	1360558940	/nfs/dbraw/zinc/55/89/40/1360558940.db2.gz	NUIREEOIENIDHB-INIZCTEOSA-N	0	3	332.492	3.261	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(C)cc(C)n1	ZINC001089660119	1360571696	/nfs/dbraw/zinc/57/16/96/1360571696.db2.gz	FAXKEFCWHMFNOO-QGZVFWFLSA-N	0	3	329.488	3.495	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccccc1COC	ZINC001089664626	1360575248	/nfs/dbraw/zinc/57/52/48/1360575248.db2.gz	NOCYBNPUHYDJLY-KRWDZBQOSA-N	0	3	330.472	3.239	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(C)nn1CC	ZINC001089699242	1360603204	/nfs/dbraw/zinc/60/32/04/1360603204.db2.gz	JBYIKNZZELEJJW-INIZCTEOSA-N	0	3	332.492	3.008	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1noc2c1CCCC2	ZINC001089702327	1360605949	/nfs/dbraw/zinc/60/59/49/1360605949.db2.gz	XQBZAYFQHIMSMV-OAHLLOKOSA-N	0	3	345.487	3.350	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cnc2ccccc2c1	ZINC001089706607	1360608894	/nfs/dbraw/zinc/60/88/94/1360608894.db2.gz	UZKAFNOMHKPISF-LJQANCHMSA-N	0	3	349.478	3.479	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cc2c([nH]1)CCC2	ZINC001089722301	1360625261	/nfs/dbraw/zinc/62/52/61/1360625261.db2.gz	VZPOCTFRVHFXDI-INIZCTEOSA-N	0	3	329.488	3.300	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1oc(CC)cc1C	ZINC001089723197	1360626520	/nfs/dbraw/zinc/62/65/20/1360626520.db2.gz	HXRNORFNDWLDSD-INIZCTEOSA-N	0	3	330.472	3.394	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1cccc(N(C)C)c1	ZINC001089729512	1360633015	/nfs/dbraw/zinc/63/30/15/1360633015.db2.gz	PXQIIQWGCRRAOJ-SFHVURJKSA-N	0	3	329.488	3.159	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(C)n(C(C)C)n1	ZINC001089737568	1360642921	/nfs/dbraw/zinc/64/29/21/1360642921.db2.gz	XKHAQPBJVDWDKG-KRWDZBQOSA-N	0	3	344.503	3.016	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1ccccc1	ZINC001089759834	1360652841	/nfs/dbraw/zinc/65/28/41/1360652841.db2.gz	DVXBIUFJUGHOPZ-MHORFTMASA-N	0	3	330.859	3.222	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)CCC1CCC1	ZINC001089789799	1360664019	/nfs/dbraw/zinc/66/40/19/1360664019.db2.gz	OFYKZYFLXUIDKU-FJIDUMEYSA-N	0	3	336.907	3.488	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1cc[nH]c1CC	ZINC001089809732	1360673032	/nfs/dbraw/zinc/67/30/32/1360673032.db2.gz	TUAYVPCHBWVDHQ-SCNOPHJPSA-N	0	3	347.890	3.112	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1[nH]c(C)cc1C	ZINC001089825544	1360682124	/nfs/dbraw/zinc/68/21/24/1360682124.db2.gz	CKVCCJFGIVHUON-YVSFHVDLSA-N	0	3	347.890	3.166	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1(F)CCCC1	ZINC001089832807	1360685578	/nfs/dbraw/zinc/68/55/78/1360685578.db2.gz	ZQCIYOTVKLRPGK-JJXSEGSLSA-N	0	3	340.870	3.190	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](CNCc2cnc(C)o2)[C@H](C)C1	ZINC001184474129	1387468433	/nfs/dbraw/zinc/46/84/33/1387468433.db2.gz	TTWBRZJZFLAGSO-ZBFHGGJFSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1cc(C)co1	ZINC001089850936	1360697433	/nfs/dbraw/zinc/69/74/33/1360697433.db2.gz	RKWBGEUTRKDNAD-JJXSEGSLSA-N	0	3	334.847	3.123	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccoc2CC)CC2(CCOCC2)C1	ZINC001089939285	1360754030	/nfs/dbraw/zinc/75/40/30/1360754030.db2.gz	NRZIHTIECBONDK-MRXNPFEDSA-N	0	3	346.471	3.019	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C[C@H]2C=CCCC2)CC2(CCOCC2)C1	ZINC001089944335	1360757391	/nfs/dbraw/zinc/75/73/91/1360757391.db2.gz	BRFKWRZCOIXZNR-OALUTQOASA-N	0	3	346.515	3.296	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)[C@@H]2CCCC2(C)C)CC2(CCOCC2)C1	ZINC001089952028	1360761139	/nfs/dbraw/zinc/76/11/39/1360761139.db2.gz	ROFBCPQTOVVIII-MSOLQXFVSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc(-c3ccccc3)on2)C1	ZINC001091130664	1360995829	/nfs/dbraw/zinc/99/58/29/1360995829.db2.gz	QNZPIYQVSFTHOT-UHFFFAOYSA-N	0	3	345.830	3.192	20	30		EGEDHN
C[C@@]12CN(Cc3cccc(C#N)c3)C[C@@H]1CN(C(=O)[C@H]1CC=CCC1)C2	ZINC001091473677	1361111913	/nfs/dbraw/zinc/11/19/13/1361111913.db2.gz	CBBUGRDTCJIGIL-VWPQPMDRSA-N	0	3	349.478	3.195	20	30		EGEDHN
CC(C)(C)CC(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@@]2(C)C1	ZINC001091485393	1361117243	/nfs/dbraw/zinc/11/72/43/1361117243.db2.gz	AHGWWPJJVGTPTK-NQIIRXRSSA-N	0	3	339.483	3.275	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CN(Cc3cnccc3C)C[C@@]2(C)C1	ZINC001091910915	1361244063	/nfs/dbraw/zinc/24/40/63/1361244063.db2.gz	IZZJLEMPMMFNGE-NQIIRXRSSA-N	0	3	341.499	3.273	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CN(CCC(F)(F)F)C[C@@]2(C)C1	ZINC001091981956	1361266697	/nfs/dbraw/zinc/26/66/97/1361266697.db2.gz	YNHGISAEYCEREG-KBMXLJTQSA-N	0	3	332.410	3.321	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CN(Cc4cccnc4C)C[C@@]3(C)C2)C1	ZINC001091996187	1361269730	/nfs/dbraw/zinc/26/97/30/1361269730.db2.gz	SBQOOACVUHOELG-NQIIRXRSSA-N	0	3	339.483	3.027	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccsc3C(F)F)C[C@]2(C)C1	ZINC001092236605	1361335629	/nfs/dbraw/zinc/33/56/29/1361335629.db2.gz	INRXVRXMMONLNY-PXAZEXFGSA-N	0	3	338.423	3.103	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc4c(cccc4C)o3)C[C@]2(C)C1	ZINC001092309802	1361361631	/nfs/dbraw/zinc/36/16/31/1361361631.db2.gz	AIUSAMCHCGKSOS-IERDGZPVSA-N	0	3	336.435	3.158	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C(C)(C)C2CC2)CC1	ZINC001093377623	1361588428	/nfs/dbraw/zinc/58/84/28/1361588428.db2.gz	VPGYUYVWLXPRPT-GOSISDBHSA-N	0	3	328.500	3.149	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C(C2CC2)C2CC2)CC1	ZINC001093381762	1361593350	/nfs/dbraw/zinc/59/33/50/1361593350.db2.gz	UOATTYOREHZJBQ-FQEVSTJZSA-N	0	3	340.511	3.149	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H](CNCc2csc(CC)n2)[C@H](C)C1	ZINC001094018344	1361725488	/nfs/dbraw/zinc/72/54/88/1361725488.db2.gz	NOYIOFQXIBVENM-SPYBWZPUSA-N	0	3	349.544	3.492	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3ccc(Cl)cc3C)CCC[C@@H]12	ZINC001094501338	1361833002	/nfs/dbraw/zinc/83/30/02/1361833002.db2.gz	FNECIKDAABRTCS-IEBWSBKVSA-N	0	3	330.859	3.256	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3c(C)cccc3Cl)CCC[C@@H]12	ZINC001094503637	1361833797	/nfs/dbraw/zinc/83/37/97/1361833797.db2.gz	LSAWEKQSAIRBKP-VQIMIIECSA-N	0	3	330.859	3.256	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cccc(F)c3Cl)CCC[C@@H]12	ZINC001094521305	1361842037	/nfs/dbraw/zinc/84/20/37/1361842037.db2.gz	QZCJVABLCXWDFL-CRAIPNDOSA-N	0	3	334.822	3.087	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1C[C@H]2C[C@@H](C1)N(C(=O)C=C1CCC1)C2	ZINC001094895029	1361936788	/nfs/dbraw/zinc/93/67/88/1361936788.db2.gz	WPWZZNXRWBJSSN-DBVUQKKJSA-N	0	3	335.451	3.138	20	30		EGEDHN
Cc1ccc(CN2[C@@H]3CC[C@H]2[C@@H](NC(=O)c2ccc(C#N)[nH]2)C3)c(C)c1	ZINC001095329677	1362103474	/nfs/dbraw/zinc/10/34/74/1362103474.db2.gz	XEKYIRYSDVZHDK-HOJAQTOUSA-N	0	3	348.450	3.039	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H]1CCCC[C@H]1C(F)(F)F)C2	ZINC001095560782	1362170271	/nfs/dbraw/zinc/17/02/71/1362170271.db2.gz	AHCNWGYTMMNBLO-SUJAAXHWSA-N	0	3	342.405	3.100	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H]1CC=CC[C@H]1C(F)(F)F)C2	ZINC001095621218	1362187527	/nfs/dbraw/zinc/18/75/27/1362187527.db2.gz	VGVIWUQDKRZCGE-SUJAAXHWSA-N	0	3	342.405	3.429	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc(F)cc3ccoc31)C2	ZINC001095652474	1362196649	/nfs/dbraw/zinc/19/66/49/1362196649.db2.gz	XBZNHLZYWMQCQL-PVAVHDDUSA-N	0	3	328.387	3.483	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(OC)c(C(C)C)c1)C2	ZINC001095698939	1362204651	/nfs/dbraw/zinc/20/46/51/1362204651.db2.gz	WGOKGZGRAOBVAQ-NEWSRXKRSA-N	0	3	340.467	3.177	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(C(C)C)nc1CC)C2	ZINC001096027282	1362339008	/nfs/dbraw/zinc/33/90/08/1362339008.db2.gz	QVMHAVUNJVIYGB-XPGWFJOJSA-N	0	3	339.483	3.126	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cccnc1C(F)(F)F)C2	ZINC001096067705	1362363886	/nfs/dbraw/zinc/36/38/86/1362363886.db2.gz	ZNPPITNEBOGVIL-XBFCOCLRSA-N	0	3	339.361	3.012	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1oc(C(C)C)nc1C)C2	ZINC001096129956	1362398475	/nfs/dbraw/zinc/39/84/75/1362398475.db2.gz	HKUJAYLMWPLTLD-PMPSAXMXSA-N	0	3	331.460	3.408	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1[nH]c3ccc(C)cc3c1C)C2	ZINC001096265966	1362451040	/nfs/dbraw/zinc/45/10/40/1362451040.db2.gz	BUKBICBKXMQFGU-MNEFBYGVSA-N	0	3	335.451	3.143	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1oc(CC3CC3)nc1C)C2	ZINC001097084869	1362836564	/nfs/dbraw/zinc/83/65/64/1362836564.db2.gz	QBJCENPNLHLFPH-ZACQAIPSSA-N	0	3	343.471	3.237	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc(C)c(OC)c(C)c1)C2	ZINC001097115697	1362847298	/nfs/dbraw/zinc/84/72/98/1362847298.db2.gz	OQFJKOJFDWYWIL-KURKYZTESA-N	0	3	328.456	3.223	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H]1CCc3ccc(OC)cc31)C2	ZINC001097235411	1362895669	/nfs/dbraw/zinc/89/56/69/1362895669.db2.gz	OGRQDVVMBZVRMK-VUBSUSDNSA-N	0	3	340.467	3.023	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H]1CCCC[C@@H]1C(F)(F)F)C2	ZINC001097339122	1362941389	/nfs/dbraw/zinc/94/13/89/1362941389.db2.gz	AHCNWGYTMMNBLO-LJIZCISZSA-N	0	3	342.405	3.100	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](C)c1cc3ccccc3o1)C2	ZINC001098180824	1363246235	/nfs/dbraw/zinc/24/62/35/1363246235.db2.gz	OMZVBJSVLYKGJX-HPBDAGMYSA-N	0	3	336.435	3.281	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc(F)cc1)C2	ZINC001098480582	1363338601	/nfs/dbraw/zinc/33/86/01/1363338601.db2.gz	NRTXBBBMXIJXPO-ZRSRNVLSSA-N	0	3	328.431	3.227	20	30		EGEDHN
C=C(C)CN1CCC2(CC1)CN(C(=O)CC)Cc1ccccc1O2	ZINC001098537055	1363358351	/nfs/dbraw/zinc/35/83/51/1363358351.db2.gz	FJCWLWPJYWPQJB-UHFFFAOYSA-N	0	3	328.456	3.228	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1cc(C)ccc1F)C[C@@H](C)O2	ZINC001098642401	1363413398	/nfs/dbraw/zinc/41/33/98/1363413398.db2.gz	BOKPNVAIXOYNDC-MRXNPFEDSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C(CC)(CC)CC)C[C@@H](C)O2	ZINC001098650269	1363416927	/nfs/dbraw/zinc/41/69/27/1363416927.db2.gz	MFJQEEVDUYGNBV-QGZVFWFLSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(C)n(C(CC)CC)n2)C1	ZINC001098913511	1363518034	/nfs/dbraw/zinc/51/80/34/1363518034.db2.gz	BZROAHNDQLPNRZ-JXFKEZNVSA-N	0	3	344.503	3.323	20	30		EGEDHN
C#CCCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc3cc(F)ccc3o2)C1	ZINC001099060191	1363601000	/nfs/dbraw/zinc/60/10/00/1363601000.db2.gz	NDWUTRQMAIQCBK-YWZLYKJASA-N	0	3	340.398	3.180	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@H]1CCC(C)(C)CN1Cc1ccccc1	ZINC001099065909	1363605197	/nfs/dbraw/zinc/60/51/97/1363605197.db2.gz	ZPXPXFMPEVGKKY-LJQANCHMSA-N	0	3	326.484	3.453	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2cc([C@H](C)CC)no2)C1	ZINC001099068375	1363605505	/nfs/dbraw/zinc/60/55/05/1363605505.db2.gz	SOXKJCSSVVLAOX-VCBZYWHSSA-N	0	3	331.460	3.349	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)C(C)(C)[C@H]1CCCCO1	ZINC001099080494	1363611977	/nfs/dbraw/zinc/61/19/77/1363611977.db2.gz	QPCSKLLSZDDZCG-QZTJIDSGSA-N	0	3	348.531	3.212	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(OC)cc2Cl)C1	ZINC001099081964	1363613805	/nfs/dbraw/zinc/61/38/05/1363613805.db2.gz	GPFHVGNPHPWUNR-UGSOOPFHSA-N	0	3	334.847	3.119	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)C(C)(C)C1CCOCC1	ZINC001099140177	1363649965	/nfs/dbraw/zinc/64/99/65/1363649965.db2.gz	RISAAFVDNHFLFQ-GOSISDBHSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@]12C[C@@H]1CCCC2	ZINC001099220498	1363698595	/nfs/dbraw/zinc/69/85/95/1363698595.db2.gz	OMFGINSFEVBVQF-UEXGIBASSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H](C)Oc1cccnc1	ZINC001099221314	1363699433	/nfs/dbraw/zinc/69/94/33/1363699433.db2.gz	ZKWPWZPYGDUYLZ-IAGOWNOFSA-N	0	3	345.487	3.032	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H](C)C(C)(F)F	ZINC001099234865	1363705960	/nfs/dbraw/zinc/70/59/60/1363705960.db2.gz	NRRDOCVQVYURSH-LSDHHAIUSA-N	0	3	346.462	3.087	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H](C)CC(C)C	ZINC001099291309	1363734520	/nfs/dbraw/zinc/73/45/20/1363734520.db2.gz	GUYXUDPRPMSIHW-ZWKOTPCHSA-N	0	3	338.536	3.478	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)Cc2cccc(Cl)c2)C[C@H]1C(F)(F)F	ZINC001099300640	1363738686	/nfs/dbraw/zinc/73/86/86/1363738686.db2.gz	QHXJYIRPVPYYEL-ZIAGYGMSSA-N	0	3	346.780	3.047	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)CC[C@@H]1CC(C)(C)CO1	ZINC001099321058	1363749280	/nfs/dbraw/zinc/74/92/80/1363749280.db2.gz	PKRLVNBNYQRUDG-IAGOWNOFSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)C1(CCOC)CCC1	ZINC001099321345	1363749578	/nfs/dbraw/zinc/74/95/78/1363749578.db2.gz	UZFCKFKFNJJCMM-KRWDZBQOSA-N	0	3	336.520	3.376	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@H](C)Oc1ccccc1	ZINC001099324022	1363750511	/nfs/dbraw/zinc/75/05/11/1363750511.db2.gz	FFMGGKWPOIDGIU-ROUUACIJSA-N	0	3	342.483	3.084	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)Cc1ccc(OCC)cc1	ZINC001099328682	1363752809	/nfs/dbraw/zinc/75/28/09/1363752809.db2.gz	HVBXYSYHJGDJBS-SFHVURJKSA-N	0	3	344.499	3.421	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)Cc1ccccc1OC	ZINC001099329677	1363753826	/nfs/dbraw/zinc/75/38/26/1363753826.db2.gz	QKGLXIRLQYOBIU-QGZVFWFLSA-N	0	3	330.472	3.031	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2cc(C)c(C)s2)C[C@H]1C(F)(F)F	ZINC001099338444	1363758754	/nfs/dbraw/zinc/75/87/54/1363758754.db2.gz	ANCQCOFSLICWKJ-VXGBXAGGSA-N	0	3	332.391	3.143	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)COc1cccc(C)c1	ZINC001099339315	1363759707	/nfs/dbraw/zinc/75/97/07/1363759707.db2.gz	GMYAOJAOBTZBKB-KRWDZBQOSA-N	0	3	330.472	3.167	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)C1(CCOC)CCCC1	ZINC001099358623	1363771436	/nfs/dbraw/zinc/77/14/36/1363771436.db2.gz	JJIDGENINRHYQX-KRWDZBQOSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)C2(CCF)CC2)C1	ZINC001099507267	1363825253	/nfs/dbraw/zinc/82/52/53/1363825253.db2.gz	ZKOYYNCEDSGYTD-VGWMRTNUSA-N	0	3	340.870	3.048	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C[C@@H](C)C(C)C)CC2(CCOCC2)C1	ZINC001099569418	1363854485	/nfs/dbraw/zinc/85/44/85/1363854485.db2.gz	ANPILADMUSVQCQ-QZTJIDSGSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCCC(C)(C)C)CC2(CCOCC2)C1	ZINC001099571451	1363856090	/nfs/dbraw/zinc/85/60/90/1363856090.db2.gz	IAWPMQXVVIBQKC-KRWDZBQOSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C2(CC(C)C)CC2)CC2(CCOCC2)C1	ZINC001099582884	1363864597	/nfs/dbraw/zinc/86/45/97/1363864597.db2.gz	DQBRTIFXLCKXAB-SFHVURJKSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C2(CC)CCC2)CC2(CCOCC2)C1	ZINC001099587004	1363868498	/nfs/dbraw/zinc/86/84/98/1363868498.db2.gz	NGTRNOVMGQORFK-QGZVFWFLSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)C(CCC)CCC)CC2(CCOCC2)C1	ZINC001099588815	1363870104	/nfs/dbraw/zinc/87/01/04/1363870104.db2.gz	JQZPGXOKBZDWAF-GOSISDBHSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)[C@@H](CCC)C(C)C)CC2(CCOCC2)C1	ZINC001099593423	1363875718	/nfs/dbraw/zinc/87/57/18/1363875718.db2.gz	YLGIAGMCTHXHNC-ROUUACIJSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)[C@@H](CC)CCC)CC2(CCOCC2)C1	ZINC001099594935	1363876797	/nfs/dbraw/zinc/87/67/97/1363876797.db2.gz	OGQLDDHHYLGVFN-ROUUACIJSA-N	0	3	336.520	3.376	20	30		EGEDHN
C[C@@H](C(=O)NCC1CC(NCC#Cc2ccc(Cl)cc2)C1)C1CC1	ZINC001100224198	1364049321	/nfs/dbraw/zinc/04/93/21/1364049321.db2.gz	GMHCRHPMGHZVLT-ICXUMSERSA-N	0	3	344.886	3.222	20	30		EGEDHN
C[C@@H](C(=O)NCC1CC(NCC#Cc2ccccc2Cl)C1)C1CC1	ZINC001100225364	1364050320	/nfs/dbraw/zinc/05/03/20/1364050320.db2.gz	DWXJXRYXBAZYHL-KSTDHSDQSA-N	0	3	344.886	3.222	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)[C@H](C)C(CC)CC)C1	ZINC001100465055	1364124723	/nfs/dbraw/zinc/12/47/23/1364124723.db2.gz	NUNBLCUTEOOLGU-DNOWBOINSA-N	0	3	345.325	3.452	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCC1CC(NCc2cccc(OCC)n2)C1	ZINC001100595349	1364180419	/nfs/dbraw/zinc/18/04/19/1364180419.db2.gz	URDZUSIQASOYEX-HJOIGYKYSA-N	0	3	345.487	3.067	20	30		EGEDHN
CCCc1[nH]ccc1C(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100596658	1364181030	/nfs/dbraw/zinc/18/10/30/1364181030.db2.gz	YJICNCKWYMVLHE-UHFFFAOYSA-N	0	3	349.478	3.117	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC2CC(NCc3cc(C)ccc3F)C2)C1	ZINC001100661066	1364208194	/nfs/dbraw/zinc/20/81/94/1364208194.db2.gz	AHOWCHAEEFSCKF-UHFFFAOYSA-N	0	3	330.447	3.475	20	30		EGEDHN
C[C@H](C(=O)NCC1CC(NCC#Cc2ccccc2)C1)C1CCCC1	ZINC001100853648	1364292413	/nfs/dbraw/zinc/29/24/13/1364292413.db2.gz	RGFQEHCKLMAGDG-OCDPCBSRSA-N	0	3	338.495	3.349	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)Cc2c[nH]c3cccc(C)c23)C1	ZINC001100879005	1364308013	/nfs/dbraw/zinc/30/80/13/1364308013.db2.gz	LPJCDACHXHETTG-UHFFFAOYSA-N	0	3	345.874	3.256	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)C[C@H](CC)C(C)C)C1	ZINC001100887683	1364312964	/nfs/dbraw/zinc/31/29/64/1364312964.db2.gz	NGXZLYKVGFPZRS-SLTAFYQDSA-N	0	3	345.325	3.452	20	30		EGEDHN
Cc1ccccc1CC(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100966044	1364350401	/nfs/dbraw/zinc/35/04/01/1364350401.db2.gz	IHRWFDLTGVLXTG-UHFFFAOYSA-N	0	3	346.474	3.074	20	30		EGEDHN
C=CC[C@H](C(=O)NCC1CC(NCc2ccccn2)C1)c1ccccc1	ZINC001101012565	1364371290	/nfs/dbraw/zinc/37/12/90/1364371290.db2.gz	GHIVVMSKYGYTDA-JITJBCMDSA-N	0	3	349.478	3.426	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H](C)c2cccc(OC)c2)C1	ZINC001101037482	1364383704	/nfs/dbraw/zinc/38/37/04/1364383704.db2.gz	OQPBLGMKVFXZIS-HLIUYOAVSA-N	0	3	336.863	3.036	20	30		EGEDHN
C=CCN1CC[C@@H](Oc2ccnc(CNC(=O)C(C)(C)C(C)C)c2)C1	ZINC001101093856	1364410380	/nfs/dbraw/zinc/41/03/80/1364410380.db2.gz	LKTBMDTVTLMPEN-GOSISDBHSA-N	0	3	345.487	3.019	20	30		EGEDHN
C=CCN1CC[C@@H](Oc2ccnc(CNC(=O)[C@H](C)C(C)(C)C)c2)C1	ZINC001101095420	1364411528	/nfs/dbraw/zinc/41/15/28/1364411528.db2.gz	IIDOBRQDVCAWSR-MAUKXSAKSA-N	0	3	345.487	3.019	20	30		EGEDHN
C=C(C)CN1CC[C@H](Oc2ccnc(CNC(=O)[C@@H](C)C(C)C)c2)C1	ZINC001101097014	1364412872	/nfs/dbraw/zinc/41/28/72/1364412872.db2.gz	HBQRTMZEFBNJCG-LPHOPBHVSA-N	0	3	345.487	3.019	20	30		EGEDHN
C=CCCC(=O)N1C[C@H]2CN(CCc3ccc(F)c(F)c3)C[C@@]2(C)C1	ZINC001101167847	1364443245	/nfs/dbraw/zinc/44/32/45/1364443245.db2.gz	XIXWNHIBGOOUDJ-UZLBHIALSA-N	0	3	348.437	3.254	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC(C(C)(C)CNC/C(Cl)=C/Cl)CC1	ZINC001101521934	1364596991	/nfs/dbraw/zinc/59/69/91/1364596991.db2.gz	HFGUZMNDBPJFAP-UGMNDJHYSA-N	0	3	346.302	3.319	20	30		EGEDHN
CCC(CC)C(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C	ZINC001101744585	1364711225	/nfs/dbraw/zinc/71/12/25/1364711225.db2.gz	QAHFRFIOEGXLAM-YLJYHZDGSA-N	0	3	326.484	3.158	20	30		EGEDHN
CC(C)C(C)(C)C(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001102000276	1364805860	/nfs/dbraw/zinc/80/58/60/1364805860.db2.gz	IZAWJJRXCYAZKZ-HUUCEWRRSA-N	0	3	347.528	3.486	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1CNC(=O)CC1(C)CC1	ZINC001102162945	1364902937	/nfs/dbraw/zinc/90/29/37/1364902937.db2.gz	MUTFDMNMXSODFF-RHSMWYFYSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@@H]1CN(Cc2oc(CC)nc2C)C[C@H]1C	ZINC001102261064	1364973604	/nfs/dbraw/zinc/97/36/04/1364973604.db2.gz	MMORKWOENUPGCS-ZMSDIMECSA-N	0	3	347.503	3.332	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H]1CN(Cc2oc(CCC)nc2C)C[C@H]1C	ZINC001102296985	1364988757	/nfs/dbraw/zinc/98/87/57/1364988757.db2.gz	DAUBBXHTWUJKBB-NVXWUHKLSA-N	0	3	347.503	3.476	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H]1CN(Cc2cnn(C(C)(C)C)c2)C[C@H]1C	ZINC001102298388	1364990246	/nfs/dbraw/zinc/99/02/46/1364990246.db2.gz	QJGYUWAVPWXKIF-SJLPKXTDSA-N	0	3	346.519	3.179	20	30		EGEDHN
C=CCCC(=O)NCC[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1C	ZINC001102760124	1365205766	/nfs/dbraw/zinc/20/57/66/1365205766.db2.gz	GGPIMWRYTNGNNG-SJLPKXTDSA-N	0	3	325.456	3.099	20	30		EGEDHN
C[C@H](C#N)C(=O)NCC[C@@H]1CN(Cc2sccc2Cl)C[C@H]1C	ZINC001102784077	1365216648	/nfs/dbraw/zinc/21/66/48/1365216648.db2.gz	LKHXBGIXUKMMBO-JHJVBQTASA-N	0	3	339.892	3.135	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)[C@@H]2C[C@@H]3C=C[C@H]2CC3)C1	ZINC001103006411	1365335109	/nfs/dbraw/zinc/33/51/09/1365335109.db2.gz	OIMJASDZGVCJDR-SOVHRIKKSA-N	0	3	336.907	3.415	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cc(CC)ccn2)C1	ZINC001103022017	1365341549	/nfs/dbraw/zinc/34/15/49/1365341549.db2.gz	UCAHYRHDLYNAFY-CZUORRHYSA-N	0	3	335.879	3.084	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1CCNC(=O)CCC(F)F	ZINC001103235664	1365448157	/nfs/dbraw/zinc/44/81/57/1365448157.db2.gz	HIKFQKUJCMIYFW-GDBMZVCRSA-N	0	3	349.425	3.178	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC[C@@H]1CN(Cc2cncc(F)c2)C[C@H]1C	ZINC001103308156	1365485512	/nfs/dbraw/zinc/48/55/12/1365485512.db2.gz	WGEDSASJYQLKRE-NVXWUHKLSA-N	0	3	347.478	3.397	20	30		EGEDHN
CC[C@@H](F)C(=O)NCC[C@@H]1CN(Cc2ccc(C#N)cc2F)C[C@H]1C	ZINC001103319998	1365491677	/nfs/dbraw/zinc/49/16/77/1365491677.db2.gz	GRNWVCCLWNFQRT-FRFSOERESA-N	0	3	349.425	3.020	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)[C@H](C)C(F)(F)F)C1	ZINC001103325727	1365496287	/nfs/dbraw/zinc/49/62/87/1365496287.db2.gz	SSWZITVISNICDX-ADEWGFFLSA-N	0	3	326.790	3.012	20	30		EGEDHN
C=CCCCC(=O)NCC[C@@H]1CN(Cc2cc(OC)ccn2)C[C@H]1C	ZINC001103385363	1365528122	/nfs/dbraw/zinc/52/81/22/1365528122.db2.gz	PMZDWARURFQNQK-IAGOWNOFSA-N	0	3	345.487	3.021	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)C2Cc3ccccc3C2)C1	ZINC001103466350	1365579294	/nfs/dbraw/zinc/57/92/94/1365579294.db2.gz	ATETZJFXOIYLCY-RDTXWAMCSA-N	0	3	346.902	3.228	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cncc(Cl)c2)C1	ZINC001103532743	1365616989	/nfs/dbraw/zinc/61/69/89/1365616989.db2.gz	OKVYWZGMTYUDND-DGCLKSJQSA-N	0	3	342.270	3.175	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cccc(N(C)C)c2)C1	ZINC001103673266	1365720298	/nfs/dbraw/zinc/72/02/98/1365720298.db2.gz	ZOZNVLHIXBEURL-RHSMWYFYSA-N	0	3	349.906	3.193	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2[nH]nc3ccccc32)C1	ZINC001103691144	1365730818	/nfs/dbraw/zinc/73/08/18/1365730818.db2.gz	RVVDKHLXMPCKTH-TZMCWYRMSA-N	0	3	346.862	3.003	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CN(C(=O)CCC(C)C)C[C@H]1C	ZINC001103861876	1365816312	/nfs/dbraw/zinc/81/63/12/1365816312.db2.gz	QPTMPPPKRLOAHR-UKRRQHHQSA-N	0	3	345.325	3.405	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@H](CCNCc2ccncc2Cl)C1	ZINC001103979210	1365857904	/nfs/dbraw/zinc/85/79/04/1365857904.db2.gz	FAGHUGLOKMPSJV-GDBMZVCRSA-N	0	3	335.879	3.275	20	30		EGEDHN
C[C@@H]1CN(C(=O)/C=C/C2CC2)C[C@H]1CCNCc1ccccc1C#N	ZINC001104036756	1365884546	/nfs/dbraw/zinc/88/45/46/1365884546.db2.gz	GJGIQOLXCIHGCM-LMFNFFQTSA-N	0	3	337.467	3.099	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cscc2C)C[C@H]1C	ZINC001104045048	1365888283	/nfs/dbraw/zinc/88/82/83/1365888283.db2.gz	XGHNYIRMIFRCMY-BXUZGUMPSA-N	0	3	326.893	3.497	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2nc(C)c(C)s2)C1	ZINC001104124851	1365918732	/nfs/dbraw/zinc/91/87/32/1365918732.db2.gz	UHHZVGMQBCKWAL-RHSMWYFYSA-N	0	3	347.528	3.138	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@@H](C)[C@H](CCNCc2cc(F)ccc2F)C1	ZINC001104163462	1365932728	/nfs/dbraw/zinc/93/27/28/1365932728.db2.gz	ILEDEOSPAIEADW-HZPDHXFCSA-N	0	3	348.437	3.198	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2ccn3c2CCCC3)C[C@H]1C	ZINC001104303197	1365978707	/nfs/dbraw/zinc/97/87/07/1365978707.db2.gz	VBVPXBRWVMBZEH-GDBMZVCRSA-N	0	3	349.906	3.265	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)C[C@@H]2CC(C)(C)CO2)C[C@H]1C	ZINC001104411201	1366011759	/nfs/dbraw/zinc/01/17/59/1366011759.db2.gz	WWIMNYBSXKASOE-FVQBIDKESA-N	0	3	342.911	3.018	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N1C[C@@H](C)[C@H](CCNCC(=C)Cl)C1	ZINC001104455315	1366035313	/nfs/dbraw/zinc/03/53/13/1366035313.db2.gz	NHJQTZBSMBOFTG-QGPMSJSTSA-N	0	3	342.911	3.042	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCCF)C[C@H]1CCNCc1cc(C#N)ccc1F	ZINC001104509488	1366054331	/nfs/dbraw/zinc/05/43/31/1366054331.db2.gz	KODATWUZCBIYSE-GDBMZVCRSA-N	0	3	349.425	3.021	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@@H](C)[C@H](CCNCc2conc2C)C1	ZINC001104563359	1366077960	/nfs/dbraw/zinc/07/79/60/1366077960.db2.gz	MDNGDWOPSMDWLQ-HYVNUMGLSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H](C)[C@H](CCNCc3conc3C)C2)CC1	ZINC001104629211	1366108605	/nfs/dbraw/zinc/10/86/05/1366108605.db2.gz	CWVSTIUMXFSWGD-CRAIPNDOSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](C)[C@H](CCNCc3ccc(F)cn3)C2)C1	ZINC001104652901	1366119191	/nfs/dbraw/zinc/11/91/91/1366119191.db2.gz	QSKGOEOZDDVSBY-HZPDHXFCSA-N	0	3	345.462	3.151	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1C[C@@H](C)[C@H](CCNCc2ccccc2C#N)C1	ZINC001104748464	1366156099	/nfs/dbraw/zinc/15/60/99/1366156099.db2.gz	RFZZUNPVDUSPGL-FUHIMQAGSA-N	0	3	341.499	3.425	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1C[C@@H](C)[C@H](CCNCc2ccccc2C#N)C1	ZINC001104748465	1366156129	/nfs/dbraw/zinc/15/61/29/1366156129.db2.gz	RFZZUNPVDUSPGL-MBOZVWFJSA-N	0	3	341.499	3.425	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)Cc2cccc(F)c2)C[C@H]1C	ZINC001104980423	1366255108	/nfs/dbraw/zinc/25/51/08/1366255108.db2.gz	KZXGXGQHCAVLIV-CZUORRHYSA-N	0	3	338.854	3.195	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C[C@@H](C=C)CC)CC1	ZINC001105394468	1366443492	/nfs/dbraw/zinc/44/34/92/1366443492.db2.gz	XULSHKPZQNBFJT-PXNSSMCTSA-N	0	3	328.500	3.315	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](CNCc2csc(C)n2)[C@H](C)C1	ZINC001106564194	1366737164	/nfs/dbraw/zinc/73/71/64/1366737164.db2.gz	UPHLGQHVXIOJBE-SQWLQELKSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@]12CCC[C@H]1N(Cc1cnoc1C)CC2	ZINC001107424494	1366960371	/nfs/dbraw/zinc/96/03/71/1366960371.db2.gz	QMLQUNFTWRMHFA-IEBWSBKVSA-N	0	3	331.460	3.200	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](N(C)CCOc2c(C)cccc2C)C1	ZINC001189317720	1366986869	/nfs/dbraw/zinc/98/68/69/1366986869.db2.gz	BYZLUDOGSYQKHK-SFHVURJKSA-N	0	3	330.472	3.181	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@]12CCC[C@H]1N(Cc1cc(C)no1)CC2	ZINC001107515577	1367013689	/nfs/dbraw/zinc/01/36/89/1367013689.db2.gz	YIBBYWDNDAZMNV-ILZDJORESA-N	0	3	345.487	3.446	20	30		EGEDHN
C=CCC[C@@H](C)N1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ncc(Cl)s1)C2	ZINC001109517159	1367171925	/nfs/dbraw/zinc/17/19/25/1367171925.db2.gz	YRQRPUWSLXFOCA-NDBYEHHHSA-N	0	3	339.892	3.486	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2cc(C)cs2)C1	ZINC001107921969	1367202751	/nfs/dbraw/zinc/20/27/51/1367202751.db2.gz	JMOPDDPXZKWFRU-CRAIPNDOSA-N	0	3	336.501	3.232	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2cccc(C)c2F)C1	ZINC001107961125	1367219138	/nfs/dbraw/zinc/21/91/38/1367219138.db2.gz	SOCIYVRDUWCQLJ-UZLBHIALSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NC[C@@]1(C)CN(C[C@H](C)CC)CCO1	ZINC001107971457	1367224315	/nfs/dbraw/zinc/22/43/15/1367224315.db2.gz	SPIHSDVXIGLWIQ-DYVFJYSZSA-N	0	3	330.900	3.018	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](N(C)CCOc2ccccc2)C1	ZINC001190354283	1367236560	/nfs/dbraw/zinc/23/65/60/1367236560.db2.gz	HRXHBYCJIGAQSA-IBGZPJMESA-N	0	3	342.483	3.367	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccc(COC)cc1	ZINC001109656071	1367266751	/nfs/dbraw/zinc/26/67/51/1367266751.db2.gz	BOVGGGVPIYVKGF-AABGKKOBSA-N	0	3	342.483	3.411	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@]1(C)CN(CC2CCCCC2)CCO1	ZINC001108115792	1367289092	/nfs/dbraw/zinc/28/90/92/1367289092.db2.gz	UGKMNLAUGIQJKB-FQEVSTJZSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)C2CC3(CCC3)C2)C1	ZINC001108141799	1367305428	/nfs/dbraw/zinc/30/54/28/1367305428.db2.gz	DMMFKXDTEUQXQY-APWZRJJASA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2cc[nH]c2C(C)C)C1	ZINC001108153534	1367313578	/nfs/dbraw/zinc/31/35/78/1367313578.db2.gz	QLMMXFGPZKQFQO-UZLBHIALSA-N	0	3	347.503	3.314	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@]2(C)CN(CC3CCC(C)CC3)CCO2)C1	ZINC001108200937	1367340529	/nfs/dbraw/zinc/34/05/29/1367340529.db2.gz	GGEMFWMLNSOOGJ-QYGXFBIXSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@]2(C)CN(CC3CCC(C)CC3)CCO2)C1	ZINC001108200936	1367340629	/nfs/dbraw/zinc/34/06/29/1367340629.db2.gz	GGEMFWMLNSOOGJ-IAYYMHMVSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)Nc1ccc(OC(F)(F)F)cc1	ZINC001190761364	1367344456	/nfs/dbraw/zinc/34/44/56/1367344456.db2.gz	SMQQMVVPKJVTMI-ZDUSSCGKSA-N	0	3	343.349	3.357	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2ccoc2CCC)C1	ZINC001108340401	1367397987	/nfs/dbraw/zinc/39/79/87/1367397987.db2.gz	AULBQACEMUXAEX-OXJNMPFZSA-N	0	3	348.487	3.408	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@@H](CC)CCCC)C1	ZINC001191245373	1367457419	/nfs/dbraw/zinc/45/74/19/1367457419.db2.gz	DXFGZTZJCSSQPW-RCCFBDPRSA-N	0	3	326.525	3.335	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3CCC[C@@H](C)O)CCCCC1	ZINC001110135554	1367518137	/nfs/dbraw/zinc/51/81/37/1367518137.db2.gz	IRVHJESCCRFHGX-YRXWBPOGSA-N	0	3	348.531	3.396	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3C[C@@H](CC)OC)CCCC1	ZINC001110214582	1367569114	/nfs/dbraw/zinc/56/91/14/1367569114.db2.gz	NCHFUYCVIRRCMO-BDXSIMOUSA-N	0	3	334.504	3.269	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](N(C)CCOc2ccc(C)cc2)C1	ZINC001191727108	1367571325	/nfs/dbraw/zinc/57/13/25/1367571325.db2.gz	GCMMQFNCWKOYNM-QGZVFWFLSA-N	0	3	330.472	3.119	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@H](N(C)Cc2ccc3c(c2)COC3)C1	ZINC001191911335	1367634563	/nfs/dbraw/zinc/63/45/63/1367634563.db2.gz	FBBZAUKZRRCRLN-UZLBHIALSA-N	0	3	342.483	3.352	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001191913616	1367638749	/nfs/dbraw/zinc/63/87/49/1367638749.db2.gz	ZQXYBDARJYBSRD-APWZRJJASA-N	0	3	325.456	3.193	20	30		EGEDHN
C=CCCCCC[N@@H+]1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccccc1[O-])C2	ZINC001108934935	1367670152	/nfs/dbraw/zinc/67/01/52/1367670152.db2.gz	KPTASXMUTPDGKW-NJAFHUGGSA-N	0	3	328.456	3.474	20	30		EGEDHN
C=CCCCCC[N@H+]1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccccc1[O-])C2	ZINC001108934935	1367670155	/nfs/dbraw/zinc/67/01/55/1367670155.db2.gz	KPTASXMUTPDGKW-NJAFHUGGSA-N	0	3	328.456	3.474	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2C[C@H](OC)c1ccccc1	ZINC001110378734	1367679117	/nfs/dbraw/zinc/67/91/17/1367679117.db2.gz	DYUUUQWCSRKRGN-YRXWBPOGSA-N	0	3	328.456	3.062	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](N(C)CCOCc2ccccc2)C1	ZINC001192092822	1367684912	/nfs/dbraw/zinc/68/49/12/1367684912.db2.gz	DFYLKFODSVVBKX-LJQANCHMSA-N	0	3	330.472	3.092	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](N(C)Cc3cccc(OC)c3)C2)CCC1	ZINC001192218518	1367721964	/nfs/dbraw/zinc/72/19/64/1367721964.db2.gz	RCQDQGHTWXFWCY-SFHVURJKSA-N	0	3	342.483	3.474	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)CC(C2CCC2)C2CCC2)C1	ZINC001192377906	1367767310	/nfs/dbraw/zinc/76/73/10/1367767310.db2.gz	OUSUJPFVULPMMH-IBGZPJMESA-N	0	3	348.531	3.328	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)C[C@@H](C)c2ccccc2F)C1	ZINC001192877722	1367893945	/nfs/dbraw/zinc/89/39/45/1367893945.db2.gz	LKXOWRCQJZCYQS-SJORKVTESA-N	0	3	348.462	3.055	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3CCc2ccccc2)CCC1	ZINC001110652606	1367896630	/nfs/dbraw/zinc/89/66/30/1367896630.db2.gz	MEIWETKICLGBRM-AQNXPRMDSA-N	0	3	336.479	3.144	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@@H]2CCCC3(CC3)C2)C1	ZINC001192952952	1367911082	/nfs/dbraw/zinc/91/10/82/1367911082.db2.gz	CNSWUGOLXAIXNP-KZNAEPCWSA-N	0	3	336.520	3.089	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)[C@H]2CC[C@H](C(C)C)CC2)C1	ZINC001193037590	1367928719	/nfs/dbraw/zinc/92/87/19/1367928719.db2.gz	FRHDNXWZUPIYDC-FHWLQOOXSA-N	0	3	336.520	3.184	20	30		EGEDHN
CC(C)C[C@@H](C)C(=O)N1CC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001193088170	1367940896	/nfs/dbraw/zinc/94/08/96/1367940896.db2.gz	RVYMQHYKSIBURE-APWZRJJASA-N	0	3	327.472	3.273	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CC1CC(F)(F)C1	ZINC001110892299	1368066944	/nfs/dbraw/zinc/06/69/44/1368066944.db2.gz	UOHMSXYVEHCKAZ-KFWWJZLASA-N	0	3	326.431	3.356	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2C[C@H](OC)c1ccccc1	ZINC001110898331	1368072663	/nfs/dbraw/zinc/07/26/63/1368072663.db2.gz	BITLXVQXDNMGBQ-YRXWBPOGSA-N	0	3	342.483	3.308	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2C[C@@H](OC)c1ccccc1	ZINC001110967217	1368128231	/nfs/dbraw/zinc/12/82/31/1368128231.db2.gz	YEVLLVBGDFIFKK-YSTOQKLRSA-N	0	3	342.483	3.452	20	30		EGEDHN
C=CCCCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ncccc1F)C2	ZINC001111180843	1368181973	/nfs/dbraw/zinc/18/19/73/1368181973.db2.gz	QNBMFBODLSHBLC-OIISXLGYSA-N	0	3	331.435	3.302	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)C(CC(C)C)CC(C)C)C1	ZINC001194326936	1368232821	/nfs/dbraw/zinc/23/28/21/1368232821.db2.gz	UQEUCDLPPDRUKV-IBGZPJMESA-N	0	3	338.536	3.430	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@H](N(C)CCOCC(C)C)C2)CCCCC1	ZINC001194381755	1368249417	/nfs/dbraw/zinc/24/94/17/1368249417.db2.gz	MWBFORNDVJPIOR-IBGZPJMESA-N	0	3	348.531	3.166	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](N(C)C[C@@H]3CCCCO3)C2)CCCC1	ZINC001194568555	1368288905	/nfs/dbraw/zinc/28/89/05/1368288905.db2.gz	UGLKEOKRKQRDJV-MSOLQXFVSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)C[C@H](NC(=O)CCC)c1ccccc1O2	ZINC001111529102	1368327030	/nfs/dbraw/zinc/32/70/30/1368327030.db2.gz	DOIJDFWHGVLJSP-FXAWDEMLSA-N	0	3	328.456	3.447	20	30		EGEDHN
Cc1ccc(C)c([C@H](C)N2CCCN(C(=O)CSCC#N)CC2)c1	ZINC001194918914	1368347185	/nfs/dbraw/zinc/34/71/85/1368347185.db2.gz	FMMVLXJNQTZEKW-KRWDZBQOSA-N	0	3	345.512	3.156	20	30		EGEDHN
CCC[C@H](C)C(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(C#N)cc1)C2	ZINC001111672769	1368418470	/nfs/dbraw/zinc/41/84/70/1368418470.db2.gz	LYWBBGIRSQKPOI-LRQRDZAKSA-N	0	3	339.483	3.465	20	30		EGEDHN
C#CCCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1cccc(F)c1)C2	ZINC001111711462	1368428559	/nfs/dbraw/zinc/42/85/59/1368428559.db2.gz	URZPZKMMIYXFEF-RXVVDRJESA-N	0	3	342.458	3.490	20	30		EGEDHN
C#CCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(C)c(F)c1)C2	ZINC001111730086	1368432449	/nfs/dbraw/zinc/43/24/49/1368432449.db2.gz	VCTLQGNLLVYWRM-RXVVDRJESA-N	0	3	342.458	3.408	20	30		EGEDHN
O=C(C#CC1CC1)N[C@]12CCC[C@H]1CN(C/C=C/c1ccccc1)C2	ZINC001111739586	1368436934	/nfs/dbraw/zinc/43/69/34/1368436934.db2.gz	BROJFEXYZLMKCM-AUFABGBYSA-N	0	3	334.463	3.084	20	30		EGEDHN
O=C(C#CC1CC1)N[C@]12CCC[C@H]1CN(Cc1cc3ccccc3o1)C2	ZINC001111740934	1368438133	/nfs/dbraw/zinc/43/81/33/1368438133.db2.gz	UREMEHKLJPRDKO-AVRDEDQJSA-N	0	3	348.446	3.317	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)CCc2ccc3[nH]ccc3c2)C1	ZINC001111809750	1368474711	/nfs/dbraw/zinc/47/47/11/1368474711.db2.gz	PMFMUYBNUSZCOO-UGKGYDQZSA-N	0	3	349.478	3.095	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CCCN(CCCc2cccc(F)c2)CC1	ZINC001195785067	1368489374	/nfs/dbraw/zinc/48/93/74/1368489374.db2.gz	AJVLNAROXBGDEC-UHFFFAOYSA-N	0	3	344.474	3.342	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2sc(C3CC3)nc2C)CC1	ZINC001195807543	1368494788	/nfs/dbraw/zinc/49/47/88/1368494788.db2.gz	VPVXUFVHCMPYKP-UHFFFAOYSA-N	0	3	333.501	3.443	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2csc([C@H]3CCCO3)n2)CC1	ZINC001195865165	1368506157	/nfs/dbraw/zinc/50/61/57/1368506157.db2.gz	IQSXXUACFQFQKL-MRXNPFEDSA-N	0	3	349.500	3.109	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)CCn2ccc3ccccc32)C1	ZINC001111974863	1368584046	/nfs/dbraw/zinc/58/40/46/1368584046.db2.gz	HHKVLQGJZBYGIJ-UGKGYDQZSA-N	0	3	349.478	3.025	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)CCCC(C)(C)C)C[C@H]1C(F)(F)F	ZINC001112068844	1368642459	/nfs/dbraw/zinc/64/24/59/1368642459.db2.gz	UBRKXFGXMIOVIF-ZIAGYGMSSA-N	0	3	332.410	3.205	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N1CCCN(CC/C=C/CCC)CC1	ZINC001196665781	1368658327	/nfs/dbraw/zinc/65/83/27/1368658327.db2.gz	GSPYHAJSULIYHX-NDDJGDGRSA-N	0	3	336.520	3.496	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)N1CCCN(CCc2ccc(OC)cc2)CC1	ZINC001196830157	1368692356	/nfs/dbraw/zinc/69/23/56/1368692356.db2.gz	ISRILFCQSLIJBB-MSOLQXFVSA-N	0	3	344.499	3.230	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cc(C3CC3)no2)CC1	ZINC001197301006	1368783058	/nfs/dbraw/zinc/78/30/58/1368783058.db2.gz	ZJHVPRQZVOIAPI-UHFFFAOYSA-N	0	3	331.460	3.446	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cnc(C)nc2C)CC1	ZINC001197477521	1368822643	/nfs/dbraw/zinc/82/26/43/1368822643.db2.gz	JJYMXKRIZQCBDG-UHFFFAOYSA-N	0	3	332.492	3.212	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@@H]2CCC[C@]2(CNCc2ocnc2C)C1	ZINC001112515042	1368909361	/nfs/dbraw/zinc/90/93/61/1368909361.db2.gz	SWYPFKIAZOTNJQ-ZWOKBUDYSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2cc3nc(C)ccc3o2)CC1	ZINC001197893877	1368920428	/nfs/dbraw/zinc/92/04/28/1368920428.db2.gz	ZGSIHVICKNYMDR-UHFFFAOYSA-N	0	3	327.428	3.250	20	30		EGEDHN
CCCCCCCCC(=O)N1CCCN(CCC[C@@H](C)O)CC1	ZINC001197928644	1368926099	/nfs/dbraw/zinc/92/60/99/1368926099.db2.gz	KHAIYDQBFVEOHR-GOSISDBHSA-N	0	3	326.525	3.432	20	30		EGEDHN
C=CCCOCC(=O)N1CCCN(CCCc2ccccc2C)CC1	ZINC001198337322	1369010656	/nfs/dbraw/zinc/01/06/56/1369010656.db2.gz	MQIRTCWZNYIXOI-UHFFFAOYSA-N	0	3	344.499	3.055	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@H]1CC=CCC1)c1ccccc1OC	ZINC001198523325	1369052340	/nfs/dbraw/zinc/05/23/40/1369052340.db2.gz	VQCXNSHOZSWHRF-FUHWJXTLSA-N	0	3	328.456	3.375	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)CCOC(C)C)c1ccccc1OC	ZINC001198552387	1369058844	/nfs/dbraw/zinc/05/88/44/1369058844.db2.gz	DBHXDNKEIGUKQH-SFHVURJKSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)CCOC(C)C)c1ccccc1OC	ZINC001198553980	1369060250	/nfs/dbraw/zinc/06/02/50/1369060250.db2.gz	NDQKGQJQBPJWJT-GOSISDBHSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)CSCCC)c1ccccc1OC	ZINC001198578677	1369065286	/nfs/dbraw/zinc/06/52/86/1369065286.db2.gz	TWJROLIQMZODCE-MRXNPFEDSA-N	0	3	336.501	3.161	20	30		EGEDHN
COc1ccccc1[C@@H](CNC(=O)[C@@H](C)C#N)NCCCC(C)(C)C	ZINC001198617772	1369074677	/nfs/dbraw/zinc/07/46/77/1369074677.db2.gz	SCTMCJXWKIPJQV-DOTOQJQBSA-N	0	3	345.487	3.428	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@H](CC)SC)c1ccccc1OC	ZINC001198669002	1369087053	/nfs/dbraw/zinc/08/70/53/1369087053.db2.gz	WNWQIUCDJBVEKV-RDJZCZTQSA-N	0	3	336.501	3.160	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@H](C)n1cccc1)c1ccccc1OC	ZINC001198669207	1369087515	/nfs/dbraw/zinc/08/75/15/1369087515.db2.gz	XSFVVBSUJMOLDI-FUHWJXTLSA-N	0	3	341.455	3.081	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)c1ccc(CC)o1)c1ccccc1OC	ZINC001198776101	1369111439	/nfs/dbraw/zinc/11/14/39/1369111439.db2.gz	MLRPKGQDCRWENM-QGZVFWFLSA-N	0	3	342.439	3.487	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)C(C)(C)COC)c1ccccc1OC	ZINC001198796045	1369117133	/nfs/dbraw/zinc/11/71/33/1369117133.db2.gz	IOQPIMCNRBGRMZ-KRWDZBQOSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@H](CCC)OCC)c1ccccc1OC	ZINC001198857511	1369131446	/nfs/dbraw/zinc/13/14/46/1369131446.db2.gz	QMWOMIOIJBPWED-MJGOQNOKSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@H]1C[C@H]2C[C@H]2C1)c1ccccc1OC	ZINC001198857436	1369131451	/nfs/dbraw/zinc/13/14/51/1369131451.db2.gz	PJESPZNAQASPSN-LHHMISFZSA-N	0	3	328.456	3.064	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@@]2(C)CC=C(C)CC2)C1	ZINC001198889701	1369140937	/nfs/dbraw/zinc/14/09/37/1369140937.db2.gz	XMSCOFVIZGMWSO-GGPKGHCWSA-N	0	3	334.504	3.031	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@@H](C)C(C)(F)F)c1ccccc1OC	ZINC001198902197	1369144084	/nfs/dbraw/zinc/14/40/84/1369144084.db2.gz	HSASJVXEPHGCSV-UKRRQHHQSA-N	0	3	340.414	3.310	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)c1ccnc(C)c1)c1ccccc1OC	ZINC001198938671	1369152745	/nfs/dbraw/zinc/15/27/45/1369152745.db2.gz	DERGCUHBUHWCSF-GOSISDBHSA-N	0	3	339.439	3.035	20	30		EGEDHN
C=CCCOCC(=O)NC[C@H](NCCC(C)C)c1ccccc1OC	ZINC001199001510	1369170305	/nfs/dbraw/zinc/17/03/05/1369170305.db2.gz	GEJJXHJNWYTVKX-SFHVURJKSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)Cc2ccc(C)c(OC)c2)CC1	ZINC001113085669	1369192014	/nfs/dbraw/zinc/19/20/14/1369192014.db2.gz	ANTIJUCCOCQDHO-KRWDZBQOSA-N	0	3	330.472	3.045	20	30		EGEDHN
CCC(CC)CC(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001186622498	1387988365	/nfs/dbraw/zinc/98/83/65/1387988365.db2.gz	MUFYKSFYMJDCPI-QGZVFWFLSA-N	0	3	331.435	3.214	20	30		EGEDHN
CC/C=C(\C)C(=O)N1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001199575907	1369238873	/nfs/dbraw/zinc/23/88/73/1369238873.db2.gz	CBEXMEAMIXTSLS-LNKIKWGQSA-N	0	3	329.419	3.134	20	30		EGEDHN
C=C(Br)CNC1CCN(C(=O)C[C@H](C)CCC)CC1	ZINC001199690341	1369254749	/nfs/dbraw/zinc/25/47/49/1369254749.db2.gz	JEGXYBSLOJLBHG-GFCCVEGCSA-N	0	3	331.298	3.302	20	30		EGEDHN
CCC[C@H](C)CC(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001199693236	1369255756	/nfs/dbraw/zinc/25/57/56/1369255756.db2.gz	ZMAFRVMGWWTOEH-INIZCTEOSA-N	0	3	327.472	3.465	20	30		EGEDHN
C=CCCC(=O)N1CCC(NCc2cc(-c3ccccc3)no2)CC1	ZINC001199707180	1369258092	/nfs/dbraw/zinc/25/80/92/1369258092.db2.gz	SZAZEHVFOULSHE-UHFFFAOYSA-N	0	3	339.439	3.388	20	30		EGEDHN
C#CCCCC(=O)N1CCC(N[C@H](C)c2nc3ccccc3o2)CC1	ZINC001200325149	1369348878	/nfs/dbraw/zinc/34/88/78/1369348878.db2.gz	PGTYEDGEVLQFJM-OAHLLOKOSA-N	0	3	339.439	3.273	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCCO[C@H](CNCc2ccsc2)C1	ZINC001201232396	1369500629	/nfs/dbraw/zinc/50/06/29/1369500629.db2.gz	FYUXSYWYDIDADP-NVXWUHKLSA-N	0	3	336.501	3.058	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCCO[C@@H](CNCc2ccccc2F)C1	ZINC001201513772	1369562283	/nfs/dbraw/zinc/56/22/83/1369562283.db2.gz	CZHDPIZUICCOOD-KRWDZBQOSA-N	0	3	348.462	3.135	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)CCc2c(C)noc2Cl)CC1	ZINC001113707832	1369579328	/nfs/dbraw/zinc/57/93/28/1369579328.db2.gz	CITWVXPXYOBSTF-CYBMUJFWSA-N	0	3	339.867	3.068	20	30		EGEDHN
CC#CCCCC(=O)N1CCC(NCc2oc(CCC)nc2C)CC1	ZINC001202075904	1369681791	/nfs/dbraw/zinc/68/17/91/1369681791.db2.gz	OGTIVYQNLRUJQF-UHFFFAOYSA-N	0	3	345.487	3.210	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC(NCc2nc(C)sc2C)CC1	ZINC001202107536	1369688180	/nfs/dbraw/zinc/68/81/80/1369688180.db2.gz	BDOKLCVNKSPOOZ-CYBMUJFWSA-N	0	3	335.517	3.443	20	30		EGEDHN
CCC(=O)N[C@H]1C[C@@H](NCC#Cc2cccc(Cl)c2)C12CCC2	ZINC001202257374	1369724177	/nfs/dbraw/zinc/72/41/77/1369724177.db2.gz	AJNGCBAHJQKSMK-SJORKVTESA-N	0	3	330.859	3.119	20	30		EGEDHN
O=C(N[C@@H]1C[C@H](NCC#Cc2ccc(Cl)cc2)C12CCC2)C1CC1	ZINC001202282059	1369728452	/nfs/dbraw/zinc/72/84/52/1369728452.db2.gz	XDZOBZWKVKIXOH-ZWKOTPCHSA-N	0	3	342.870	3.119	20	30		EGEDHN
C=C(Br)CNC1CCN(C(=O)C2(CCC)CC2)CC1	ZINC001202397383	1369760069	/nfs/dbraw/zinc/76/00/69/1369760069.db2.gz	CXJVTIAAUSDZJB-UHFFFAOYSA-N	0	3	329.282	3.056	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@H](NCc2c(C)onc2CC)C12CCC2	ZINC001202589077	1369814958	/nfs/dbraw/zinc/81/49/58/1369814958.db2.gz	BBZJTPKIPPHICL-DLBZAZTESA-N	0	3	331.460	3.029	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001202695223	1369854465	/nfs/dbraw/zinc/85/44/65/1369854465.db2.gz	YWTOTMQOEIUWAQ-UHFFFAOYSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1[C@H]2CN([C@@H](C)c3cccc(OC)c3)C[C@H]21	ZINC001114341269	1369900961	/nfs/dbraw/zinc/90/09/61/1369900961.db2.gz	VTDSWYHMMWRNCH-FEUVXWNVSA-N	0	3	342.483	3.405	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1C[C@@H](NCc2nc(C)c(C)s2)C12CCC2	ZINC001202844802	1369905749	/nfs/dbraw/zinc/90/57/49/1369905749.db2.gz	AAXXEUWFZMLMSX-HZPDHXFCSA-N	0	3	345.512	3.080	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1C[C@@H](NCc2cnc(C)o2)C12CCC2	ZINC001202967793	1369939031	/nfs/dbraw/zinc/93/90/31/1369939031.db2.gz	GSTHEZOTGAJHLU-CVEARBPZSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1C[C@H](NCc2c(C)noc2C)C12CCC2	ZINC001202978792	1369944279	/nfs/dbraw/zinc/94/42/79/1369944279.db2.gz	IYMGODPOFKBNAJ-DLBZAZTESA-N	0	3	331.460	3.165	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1C[C@H](NCc2cc(OC)ns2)C12CCC2	ZINC001202988115	1369947193	/nfs/dbraw/zinc/94/71/93/1369947193.db2.gz	QRGPPTQEOKHKDV-LSDHHAIUSA-N	0	3	349.500	3.025	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)CCc2cncc(C)c2)C12CCC2	ZINC001203161510	1370005619	/nfs/dbraw/zinc/00/56/19/1370005619.db2.gz	RITACRFZDWXXGQ-IRXDYDNUSA-N	0	3	347.890	3.092	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1[C@H]2CN(Cc3cc(C)ccc3OC)C[C@H]21	ZINC001114671778	1370017955	/nfs/dbraw/zinc/01/79/55/1370017955.db2.gz	JOIHKVUHUVJXLZ-DZFIZOCASA-N	0	3	342.483	3.152	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1C[C@@H](NCc2cnc(C)o2)C12CCC2	ZINC001203255647	1370043432	/nfs/dbraw/zinc/04/34/32/1370043432.db2.gz	DHBLYHOWBHYYLF-CVEARBPZSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1C[C@H](NCc2cccc(Cl)n2)C12CCC2	ZINC001203273980	1370055373	/nfs/dbraw/zinc/05/53/73/1370055373.db2.gz	LRCBUEMLEKJCMJ-LSDHHAIUSA-N	0	3	347.890	3.464	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1[C@H]2CN(CCOc3ccccc3C)C[C@H]21	ZINC001114794175	1370085037	/nfs/dbraw/zinc/08/50/37/1370085037.db2.gz	DDVRDHNFOSPHGP-QRKMNUTDSA-N	0	3	342.483	3.023	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H](NCc3conc3C)C23CCC3)CCC1	ZINC001203366947	1370100272	/nfs/dbraw/zinc/10/02/72/1370100272.db2.gz	PYYRHAYCYZFPNT-IRXDYDNUSA-N	0	3	343.471	3.246	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@@H](NCc3cnc(C)o3)C23CCC3)CCC1	ZINC001203368119	1370101894	/nfs/dbraw/zinc/10/18/94/1370101894.db2.gz	YQKQLQWAPXURTH-SJORKVTESA-N	0	3	343.471	3.246	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)CCCC(F)(F)F)C12CCC2	ZINC001203428626	1370122339	/nfs/dbraw/zinc/12/23/39/1370122339.db2.gz	ZEWAUVADTFETIZ-NEPJUHHUSA-N	0	3	338.801	3.489	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(OC)c(C)c3)C[C@H]21	ZINC001114895839	1370135486	/nfs/dbraw/zinc/13/54/86/1370135486.db2.gz	GPQULBKJDXJPKJ-DZFIZOCASA-N	0	3	342.483	3.152	20	30		EGEDHN
CC(C)(C)C(=O)N[C@@H]1C[C@@H](NCC#Cc2ccc(F)cc2)C12CCC2	ZINC001203629664	1370193300	/nfs/dbraw/zinc/19/33/00/1370193300.db2.gz	BKXMZSGSFKYWQW-QZTJIDSGSA-N	0	3	342.458	3.240	20	30		EGEDHN
C=CCN1C(=O)CC[C@@]12CCCN(Cc1ccc(OC)c(F)c1)CC2	ZINC001203792584	1370267016	/nfs/dbraw/zinc/26/70/16/1370267016.db2.gz	MAXAZFCKQCRQFR-HXUWFJFHSA-N	0	3	346.446	3.367	20	30		EGEDHN
C=C[C@H](C(=O)N[C@@H]1[C@H]2CN(Cc3ccsc3)C[C@H]21)c1ccccc1	ZINC001115278797	1370356692	/nfs/dbraw/zinc/35/66/92/1370356692.db2.gz	YELLVXVUTVKFTM-INDMIFKZSA-N	0	3	338.476	3.264	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)CC3CC3)CCCCC2)c(F)c1	ZINC001115378065	1370418144	/nfs/dbraw/zinc/41/81/44/1370418144.db2.gz	SCOYIKNWGIIZOY-UHFFFAOYSA-N	0	3	343.446	3.406	20	30		EGEDHN
C[C@H]1C[C@H]1C(=O)NCC1(NCC#Cc2ccc(F)cc2)CCCCC1	ZINC001115388837	1370425355	/nfs/dbraw/zinc/42/53/55/1370425355.db2.gz	BVBIMCRZGCEBRT-QFBILLFUSA-N	0	3	342.458	3.242	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)Cc2ccsc2)CCCCC1	ZINC001115389289	1370426082	/nfs/dbraw/zinc/42/60/82/1370426082.db2.gz	NNFLEBZSGWWRIM-UHFFFAOYSA-N	0	3	326.893	3.452	20	30		EGEDHN
C=CCOc1ccc(CN2CCC3(CCN(C(C)C)C3=O)CC2)cc1	ZINC001204302369	1370437585	/nfs/dbraw/zinc/43/75/85/1370437585.db2.gz	JFHGIKCZZHMXBS-UHFFFAOYSA-N	0	3	342.483	3.474	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H](C)OCC(C)C)CCCCC1	ZINC001115433473	1370450659	/nfs/dbraw/zinc/45/06/59/1370450659.db2.gz	MJLLSYZKOHXMRX-OAHLLOKOSA-N	0	3	330.900	3.209	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCC1(NCc2ccc(F)cc2F)CCCCC1	ZINC001115451620	1370459206	/nfs/dbraw/zinc/45/92/06/1370459206.db2.gz	AJELCZVNQRZSJZ-ZDUSSCGKSA-N	0	3	335.398	3.033	20	30		EGEDHN
CN1CCN(Cc2cccc(Nc3ccc(Cl)nc3C#N)c2)CC1	ZINC001204490959	1370490330	/nfs/dbraw/zinc/49/03/30/1370490330.db2.gz	HESRXZWRFOQREU-UHFFFAOYSA-N	0	3	341.846	3.098	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H]2CN([C@@H]3CCc4c3c(F)ccc4F)C[C@H]21	ZINC001187232748	1388077493	/nfs/dbraw/zinc/07/74/93/1388077493.db2.gz	HQYSGEWGJIOPFF-MORSLUCNSA-N	0	3	346.421	3.451	20	30		EGEDHN
CC(C)(C)C#CC(=O)NCC1(NCc2cncs2)CCCCC1	ZINC001115529170	1370528133	/nfs/dbraw/zinc/52/81/33/1370528133.db2.gz	CLWNNTOJROSVDM-UHFFFAOYSA-N	0	3	333.501	3.101	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H]2CC[C@@H](CC)O2)CCCCC1	ZINC001115559949	1370559743	/nfs/dbraw/zinc/55/97/43/1370559743.db2.gz	MJKSTMWSXACWBT-HUUCEWRRSA-N	0	3	328.884	3.105	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H]2CCCO[C@@H]2CC)CCCCC1	ZINC001115567510	1370567887	/nfs/dbraw/zinc/56/78/87/1370567887.db2.gz	KBLZVVVGIFMIRM-HZPDHXFCSA-N	0	3	342.911	3.353	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2c(C)[nH]nc2Cl)CCCCC1	ZINC001115567252	1370568030	/nfs/dbraw/zinc/56/80/30/1370568030.db2.gz	XNCCXPOVSXCTRC-UHFFFAOYSA-N	0	3	345.274	3.146	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H]2CCO[C@@H]2C(C)C)CCCCC1	ZINC001115567960	1370569068	/nfs/dbraw/zinc/56/90/68/1370569068.db2.gz	XPCQVMITSQOOMK-JKSUJKDBSA-N	0	3	342.911	3.209	20	30		EGEDHN
CN1CCN(Cc2ccc(Nc3cc(F)c(F)cc3C#N)cc2)CC1	ZINC001204759328	1370569732	/nfs/dbraw/zinc/56/97/32/1370569732.db2.gz	ZNRSJPDXKATYKC-UHFFFAOYSA-N	0	3	342.393	3.327	20	30		EGEDHN
C=CC(C)(C)C(=O)NCC1(NCc2cc(OC)ccn2)CCCCC1	ZINC001115666990	1370648039	/nfs/dbraw/zinc/64/80/39/1370648039.db2.gz	KIVHLSKJTAOCJZ-UHFFFAOYSA-N	0	3	345.487	3.211	20	30		EGEDHN
CC[C@@H](F)C(=O)NCC1(NCc2ccc(C#N)cc2F)CCCCC1	ZINC001115670056	1370651263	/nfs/dbraw/zinc/65/12/63/1370651263.db2.gz	ATAYWJGXVNTXKK-MRXNPFEDSA-N	0	3	349.425	3.354	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)CCCF)CCCCC2)c(F)c1	ZINC001115670458	1370652127	/nfs/dbraw/zinc/65/21/27/1370652127.db2.gz	ISSHFEFGKPMYIS-UHFFFAOYSA-N	0	3	349.425	3.356	20	30		EGEDHN
CC#CCCCC(=O)NCC1(NCc2cncs2)CCCCC1	ZINC001115680297	1370663690	/nfs/dbraw/zinc/66/36/90/1370663690.db2.gz	XVAYYKXUGNKKFF-UHFFFAOYSA-N	0	3	333.501	3.245	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H](CCC)OCC)CCCCC1	ZINC001115681663	1370664714	/nfs/dbraw/zinc/66/47/14/1370664714.db2.gz	URYQTACTXCGRIQ-OAHLLOKOSA-N	0	3	330.900	3.353	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H]2Cc3ccccc32)CCCCC1	ZINC001115701571	1370682724	/nfs/dbraw/zinc/68/27/24/1370682724.db2.gz	VIGCOSOCPJNRNU-KRWDZBQOSA-N	0	3	332.875	3.488	20	30		EGEDHN
C[C@@H]1C[C@@H]1CC(=O)NCC1(NCC#Cc2ccccc2)CCCCC1	ZINC001115710440	1370689281	/nfs/dbraw/zinc/68/92/81/1370689281.db2.gz	KUCAMDIGEYKLMV-UYAOXDASSA-N	0	3	338.495	3.493	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC1(NCc2cnoc2C)CCCCC1	ZINC001115712300	1370691573	/nfs/dbraw/zinc/69/15/73/1370691573.db2.gz	FGELWTGGIPCDAE-GOSISDBHSA-N	0	3	333.476	3.494	20	30		EGEDHN
O=C(NCC1(NCC#Cc2ccccc2)CCCCC1)[C@H]1CC12CC2	ZINC001115747538	1370728176	/nfs/dbraw/zinc/72/81/76/1370728176.db2.gz	PZNJDKQNNAYJEP-LJQANCHMSA-N	0	3	336.479	3.247	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C(C)=C2CCC2)C[C@H]1c1cccc(F)c1	ZINC001205406079	1370745733	/nfs/dbraw/zinc/74/57/33/1370745733.db2.gz	DPDTUVVXHZCFJS-VQTJNVASSA-N	0	3	340.442	3.233	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)CC(C)=C(C)C)C[C@H]1c1cccc(F)c1	ZINC001205427338	1370751857	/nfs/dbraw/zinc/75/18/57/1370751857.db2.gz	XWGUVIIMBCNFDZ-VQTJNVASSA-N	0	3	342.458	3.479	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccc(OC)o2)CCCCC1	ZINC001115785488	1370767389	/nfs/dbraw/zinc/76/73/89/1370767389.db2.gz	FONMQWAZYRVKES-UHFFFAOYSA-N	0	3	326.824	3.063	20	30		EGEDHN
CN1CCN(c2ccc(CN=Nc3ncccc3Cl)cc2F)CC1	ZINC001115863028	1370798559	/nfs/dbraw/zinc/79/85/59/1370798559.db2.gz	MMWLNPHKJVUUFG-UHFFFAOYSA-N	0	3	347.825	3.072	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CCN(Cc3ncccc3C)C2)C1	ZINC001205770748	1370865102	/nfs/dbraw/zinc/86/51/02/1370865102.db2.gz	PJKSFEQWHWJCCG-IBGZPJMESA-N	0	3	329.444	3.001	20	30		EGEDHN
CC#CCCCC(=O)N1CCC(CNCc2ccccc2C#N)CC1	ZINC001205969793	1370925130	/nfs/dbraw/zinc/92/51/30/1370925130.db2.gz	FNHOQKKWCUIWSK-UHFFFAOYSA-N	0	3	337.467	3.080	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC(CNCc2oc(C)nc2C)CC1	ZINC001205989045	1370931555	/nfs/dbraw/zinc/93/15/55/1370931555.db2.gz	OBTUJZAGVPUCED-AWEZNQCLSA-N	0	3	333.476	3.222	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC(CNCc3nccs3)CC2)CC1	ZINC001206181850	1370984107	/nfs/dbraw/zinc/98/41/07/1370984107.db2.gz	VROXGFXPWTVKSK-UHFFFAOYSA-N	0	3	333.501	3.218	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N[C@@]1(C)CCN(Cc2ccccc2)C1	ZINC001118234319	1371151475	/nfs/dbraw/zinc/15/14/75/1371151475.db2.gz	GPECOIKHACJTSA-NRFANRHFSA-N	0	3	333.435	3.261	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CN(Cc2ccc(C)c(OC)c2)C[C@H]1C	ZINC001206885079	1371206087	/nfs/dbraw/zinc/20/60/87/1371206087.db2.gz	SXPUTXGHCOLGLR-IEBWSBKVSA-N	0	3	342.483	3.134	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(CNCc3cnns3)CC2)CCCC1	ZINC001206979833	1371257858	/nfs/dbraw/zinc/25/78/58/1371257858.db2.gz	NDDFOQQTTBNUBI-UHFFFAOYSA-N	0	3	348.516	3.003	20	30		EGEDHN
CC(C)(F)C(=O)N1CCC[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207046434	1371276199	/nfs/dbraw/zinc/27/61/99/1371276199.db2.gz	AORGEUILHMIZHX-INIZCTEOSA-N	0	3	336.838	3.020	20	30		EGEDHN
CN(Cc1cc(C#N)n(C)c1)[C@@H]1CCCC[C@H]1NC(=O)OC(C)(C)C	ZINC001207110190	1371297125	/nfs/dbraw/zinc/29/71/25/1371297125.db2.gz	GHHSSAGWSYBLPY-IAGOWNOFSA-N	0	3	346.475	3.164	20	30		EGEDHN
COCCN(CC[C@](C#N)(C(C)=O)c1ccccc1)C1CCCC1	ZINC001119305506	1371303030	/nfs/dbraw/zinc/30/30/30/1371303030.db2.gz	BLSWCKMWCLAQKT-FQEVSTJZSA-N	0	3	328.456	3.318	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@H](C)CCc2ccc(F)cc2)C1	ZINC001207431841	1371394098	/nfs/dbraw/zinc/39/40/98/1371394098.db2.gz	CVCZGWGAWKOCML-GPMSIDNRSA-N	0	3	332.463	3.407	20	30		EGEDHN
CC/C=C(/C)C(=O)N1CCC[C@@H](NCc2cc(C#N)ccc2OC)C1	ZINC001207566596	1371437648	/nfs/dbraw/zinc/43/76/48/1371437648.db2.gz	ROKCHTWYBTVVDB-HUJBZGQLSA-N	0	3	341.455	3.004	20	30		EGEDHN
CC(C)[C@@H](C)CC(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001207645976	1371462733	/nfs/dbraw/zinc/46/27/33/1371462733.db2.gz	QIVPGZCZIHSYLO-AZUAARDMSA-N	0	3	326.484	3.301	20	30		EGEDHN
O=C(CCC1CC1)N1CCC[C@@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207705044	1371478971	/nfs/dbraw/zinc/47/89/71/1371478971.db2.gz	JCYMTHFKKYFHRF-LJQANCHMSA-N	0	3	344.886	3.462	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207790952	1371505368	/nfs/dbraw/zinc/50/53/68/1371505368.db2.gz	ZJGDWZJYAFPTTI-QGZVFWFLSA-N	0	3	332.394	3.021	20	30		EGEDHN
C#CCCCCC(=O)N1CCC[C@H](NCc2ccnc(Cl)c2)C1	ZINC001207860166	1371522387	/nfs/dbraw/zinc/52/23/87/1371522387.db2.gz	IDLKYFHGBAXNBV-INIZCTEOSA-N	0	3	333.863	3.009	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H](NCc2cc(Cl)ccc2OC)C1	ZINC001207935770	1371542918	/nfs/dbraw/zinc/54/29/18/1371542918.db2.gz	WEGBDFSJKWZMQQ-KRWDZBQOSA-N	0	3	348.874	3.233	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H]([C@@H]2CCCN2Cc2snnc2C)C1	ZINC001120348321	1371543031	/nfs/dbraw/zinc/54/30/31/1371543031.db2.gz	UFGQCJHGUDIINP-CVEARBPZSA-N	0	3	348.516	3.016	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC[C@@H]([C@H]2CCCN2Cc2ccns2)C1	ZINC001120383108	1371556068	/nfs/dbraw/zinc/55/60/68/1371556068.db2.gz	UBESJJXQGDSDMY-SJLPKXTDSA-N	0	3	345.512	3.006	20	30		EGEDHN
COc1ccc(Cl)cc1CN[C@@H]1CCCN(C(=O)C#CC(C)C)C1	ZINC001208008924	1371566295	/nfs/dbraw/zinc/56/62/95/1371566295.db2.gz	OEWHXKMHKJZBIJ-QGZVFWFLSA-N	0	3	348.874	3.089	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001208195136	1371633967	/nfs/dbraw/zinc/63/39/67/1371633967.db2.gz	XCUUHIKLLWSTOA-NRFANRHFSA-N	0	3	336.479	3.387	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@H](NCc2ccc(Cl)nc2)C1	ZINC001208239550	1371672775	/nfs/dbraw/zinc/67/27/75/1371672775.db2.gz	CGBRVGAFKUFSGF-HNNXBMFYSA-N	0	3	335.879	3.418	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC[C@H](NCc2cc(F)ccc2OC)C1	ZINC001208260676	1371687375	/nfs/dbraw/zinc/68/73/75/1371687375.db2.gz	BKCJFUYFAPLNPI-KRWDZBQOSA-N	0	3	334.435	3.271	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CN(CCc2ccccc2F)C[C@H]1C	ZINC001208294620	1371705205	/nfs/dbraw/zinc/70/52/05/1371705205.db2.gz	LGBRAIXYQTZQAX-CRAIPNDOSA-N	0	3	332.463	3.407	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CN(CCc2ccccc2F)C[C@H]1C	ZINC001208389153	1371747354	/nfs/dbraw/zinc/74/73/54/1371747354.db2.gz	ZMYWDOSTXFLFOZ-GPMSIDNRSA-N	0	3	332.463	3.407	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1CN(CCOc2ccccc2)C[C@H]1C	ZINC001208396555	1371753091	/nfs/dbraw/zinc/75/30/91/1371753091.db2.gz	YBUTVMRIKVKRJK-ZIFCJYIRSA-N	0	3	330.472	3.104	20	30		EGEDHN
CC(F)(F)CCC(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001208444839	1371768756	/nfs/dbraw/zinc/76/87/56/1371768756.db2.gz	ZFPBAJYSTPYYML-KRWDZBQOSA-N	0	3	334.410	3.054	20	30		EGEDHN
C[C@@H](NC1CC2(CC(NC(=O)[C@@H](C)C#N)C2)C1)c1c(F)cccc1F	ZINC001120859642	1371786973	/nfs/dbraw/zinc/78/69/73/1371786973.db2.gz	WUEVYIWVVWSMAD-WMEPFVGKSA-N	0	3	347.409	3.202	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1CN(CCOc2cccc(C)c2)C[C@H]1C	ZINC001208497814	1371787970	/nfs/dbraw/zinc/78/79/70/1371787970.db2.gz	AXKDUOPOKRUBCB-QFUCXCTJSA-N	0	3	344.499	3.413	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1CN(CCOc2ccc(C)cc2)C[C@H]1C	ZINC001208498400	1371788992	/nfs/dbraw/zinc/78/89/92/1371788992.db2.gz	UDBRDMLLKYJRCU-YFVAEKQCSA-N	0	3	344.499	3.413	20	30		EGEDHN
C=C(C)CCC(=O)NC1CC2(CC(NCc3oc(CC)nc3C)C2)C1	ZINC001121183333	1371881456	/nfs/dbraw/zinc/88/14/56/1371881456.db2.gz	JMNNBWAKMVZGAU-UHFFFAOYSA-N	0	3	345.487	3.419	20	30		EGEDHN
CC1(C)CCC[C@@H]1C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001209061862	1371987487	/nfs/dbraw/zinc/98/74/87/1371987487.db2.gz	USXZIFFNGSGNQE-VQTJNVASSA-N	0	3	338.495	3.445	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CC2(CC(NCc3nc(C)cs3)C2)C1	ZINC001121516743	1371996422	/nfs/dbraw/zinc/99/64/22/1371996422.db2.gz	ORHIJHBWDIYZAB-UHFFFAOYSA-N	0	3	333.501	3.181	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001209147457	1372015259	/nfs/dbraw/zinc/01/52/59/1372015259.db2.gz	XEMZGIFBOCPWBL-FXAWDEMLSA-N	0	3	342.458	3.360	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC[C@H](NCc2ccnc(Cl)c2)C1	ZINC001209183062	1372028892	/nfs/dbraw/zinc/02/88/92/1372028892.db2.gz	LFGSSQAOGNHQJS-HOCLYGCPSA-N	0	3	335.879	3.418	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC[C@H](NCc2ccc(Cl)nc2)C1	ZINC001209184201	1372029910	/nfs/dbraw/zinc/02/99/10/1372029910.db2.gz	RRPXNRMSQZSQMT-ZBFHGGJFSA-N	0	3	335.879	3.418	20	30		EGEDHN
C=CCCC1(C(=O)NC2CC3(CC(NCc4ocnc4C)C3)C2)CC1	ZINC001121713532	1372056059	/nfs/dbraw/zinc/05/60/59/1372056059.db2.gz	JICPDSNUOKKXQV-UHFFFAOYSA-N	0	3	343.471	3.246	20	30		EGEDHN
C[C@@H](c1ccccc1)N(CCN1CCOCC1)Cc1ccc(C#N)cc1	ZINC001209293767	1372059985	/nfs/dbraw/zinc/05/99/85/1372059985.db2.gz	OENWLUGMCYTVGA-IBGZPJMESA-N	0	3	349.478	3.454	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)CCCC(F)(F)F)C2	ZINC001121823685	1372092418	/nfs/dbraw/zinc/09/24/18/1372092418.db2.gz	YFCRZTCKLMZEII-UHFFFAOYSA-N	0	3	338.801	3.489	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC[C@@H](NCc3cncc(F)c3)C2)CC1	ZINC001209493653	1372120768	/nfs/dbraw/zinc/12/07/68/1372120768.db2.gz	NROWDQJWQFSAJG-QGZVFWFLSA-N	0	3	331.435	3.048	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)C(C)(C)C(F)(F)F)C2	ZINC001122093439	1372173206	/nfs/dbraw/zinc/17/32/06/1372173206.db2.gz	AVXNECHLUMVROE-UHFFFAOYSA-N	0	3	338.801	3.344	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001209707318	1372175454	/nfs/dbraw/zinc/17/54/54/1372175454.db2.gz	FWEJNQVAODHRPF-BHIYHBOVSA-N	0	3	344.886	3.318	20	30		EGEDHN
CC(C)[C@@H]1C[C@H](C(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)CCO1	ZINC001122449228	1372249766	/nfs/dbraw/zinc/24/97/66/1372249766.db2.gz	SARPWHDRCZDOCJ-WQVCFCJDSA-N	0	3	348.830	3.439	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CCCN(C)C2)nnc1N1CC[C@@H](C)[C@H]1CC	ZINC001122631299	1372287570	/nfs/dbraw/zinc/28/75/70/1372287570.db2.gz	PSUILXLYMTZXIE-IXDOHACOSA-N	0	3	331.508	3.288	20	30		EGEDHN
N#CC(C(=O)CCc1nnc(C2CCCC2)o1)c1cccc(F)n1	ZINC001122632198	1372287938	/nfs/dbraw/zinc/28/79/38/1372287938.db2.gz	RKVAUHURBJRDTC-LBPRGKRZSA-N	0	3	328.347	3.070	20	30		EGEDHN
CC(C)C[C@H](C)C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001210357384	1372331273	/nfs/dbraw/zinc/33/12/73/1372331273.db2.gz	AVBOVQTZKFGRDK-AZUAARDMSA-N	0	3	326.484	3.301	20	30		EGEDHN
N#Cc1cccc(C(=O)COC2CCN(Cc3ccccc3)CC2)c1	ZINC001210369403	1372335468	/nfs/dbraw/zinc/33/54/68/1372335468.db2.gz	QASMEHITCXTCEH-UHFFFAOYSA-N	0	3	334.419	3.422	20	30		EGEDHN
CC1(C(=O)N2CCC[C@@H](NCC#Cc3ccccc3)C2)CC(F)(F)C1	ZINC001210626836	1372394894	/nfs/dbraw/zinc/39/48/94/1372394894.db2.gz	WTLJVWFZVXCUJX-QGZVFWFLSA-N	0	3	346.421	3.054	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCCC(=O)c1ccc(OC)cc1	ZINC001123236917	1372403778	/nfs/dbraw/zinc/40/37/78/1372403778.db2.gz	IWGDGFBCDBAVJZ-MRXNPFEDSA-N	0	3	339.395	3.141	20	30		EGEDHN
CCn1ccnc1C(C#N)=C([O-])c1cnn(CC)c1-c1ccccc1	ZINC001123336809	1372430734	/nfs/dbraw/zinc/43/07/34/1372430734.db2.gz	LDKPEFHMAINFKF-HNNXBMFYSA-N	0	3	333.395	3.276	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)c1cnn(CC)c1-c1ccccc1	ZINC001123336809	1372430737	/nfs/dbraw/zinc/43/07/37/1372430737.db2.gz	LDKPEFHMAINFKF-HNNXBMFYSA-N	0	3	333.395	3.276	20	30		EGEDHN
Cc1ccc(C(=O)N2CCC[C@H](NCC#Cc3ccccc3)C2)cc1	ZINC001210824241	1372433754	/nfs/dbraw/zinc/43/37/54/1372433754.db2.gz	JJXHRBJWILZRNE-NRFANRHFSA-N	0	3	332.447	3.241	20	30		EGEDHN
C#CCC1(C(=O)N2CCC[C@@H](NCc3ccns3)C2)CCCCC1	ZINC001211348159	1372537692	/nfs/dbraw/zinc/53/76/92/1372537692.db2.gz	YXTKCDTVAZNPSX-MRXNPFEDSA-N	0	3	345.512	3.198	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1CN(Cc2ccc(C3CC3)cc2)C[C@H]1C	ZINC001211422970	1372555812	/nfs/dbraw/zinc/55/58/12/1372555812.db2.gz	VWSVGXRWVDAZPO-OXQOHEQNSA-N	0	3	342.483	3.093	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CCOCC(C)C)C[C@H]2C)CCCC1	ZINC001211492545	1372567883	/nfs/dbraw/zinc/56/78/83/1372567883.db2.gz	DLFIGZJLNSSRPF-QZTJIDSGSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCC[NH2+][C@@H]1CN(C(=O)c2ccccc2[O-])C[C@H]1c1ccccc1	ZINC001211533869	1372575183	/nfs/dbraw/zinc/57/51/83/1372575183.db2.gz	GXIAAPFHQBBSIU-RBUKOAKNSA-N	0	3	336.435	3.166	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@H](CC)CC(F)F)C[C@H]1c1ccccc1	ZINC001211616061	1372591228	/nfs/dbraw/zinc/59/12/28/1372591228.db2.gz	UBXXVONBCCLONX-BPQIPLTHSA-N	0	3	348.437	3.275	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2ccc(C)cc2)C[C@H]1c1ccccc1	ZINC001211713392	1372607419	/nfs/dbraw/zinc/60/74/19/1372607419.db2.gz	JSUPNBWKKLXHHV-LEWJYISDSA-N	0	3	332.447	3.216	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN([C@@H](C)c2cccc(C)c2)C[C@H]1OC	ZINC001212345043	1372691450	/nfs/dbraw/zinc/69/14/50/1372691450.db2.gz	YHCKEZDFEVOCPJ-QXAKKESOSA-N	0	3	330.472	3.228	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN(CCCCc2ccccc2)C[C@H]1OC	ZINC001212349343	1372692053	/nfs/dbraw/zinc/69/20/53/1372692053.db2.gz	QSUNLXYLOOLVJS-WOJBJXKFSA-N	0	3	344.499	3.181	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)C[C@@H]2CC=CCC2)[C@H](OC)C1	ZINC001213266800	1372870564	/nfs/dbraw/zinc/87/05/64/1372870564.db2.gz	KLEYMQUNSNETKN-GUDVDZBRSA-N	0	3	334.504	3.295	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2occc2CC)[C@H](OC)C1	ZINC001213387233	1372898266	/nfs/dbraw/zinc/89/82/66/1372898266.db2.gz	RGFWEVPMOWZYCL-IAGOWNOFSA-N	0	3	336.476	3.241	20	30		EGEDHN
C#CCCCC(=O)NCCN[C@@H]1CCc2c1cc(Cl)cc2Cl	ZINC001126338443	1372958372	/nfs/dbraw/zinc/95/83/72/1372958372.db2.gz	ANJYKZXFLCYPEY-MRXNPFEDSA-N	0	3	339.266	3.490	20	30		EGEDHN
CCCCCCCCC(=O)N[C@@H]1CN(CC[C@@H](C)F)C[C@H]1OC	ZINC001213771096	1372959564	/nfs/dbraw/zinc/95/95/64/1372959564.db2.gz	SUKCZISQLGSWFR-BRWVUGGUSA-N	0	3	330.488	3.301	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CCCC2)C[C@H]1NCC#Cc1ccccc1Cl	ZINC001214026401	1372995757	/nfs/dbraw/zinc/99/57/57/1372995757.db2.gz	VUBZBRVLYWBOMJ-DNVCBOLYSA-N	0	3	344.886	3.318	20	30		EGEDHN
CC/C=C(\C)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001214255170	1373030986	/nfs/dbraw/zinc/03/09/86/1373030986.db2.gz	PLXHCHFESQEBDF-NENMWUPCSA-N	0	3	344.886	3.484	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H]2CN(CCc3ccccc3F)C[C@H]21	ZINC001188080627	1388237979	/nfs/dbraw/zinc/23/79/79/1388237979.db2.gz	FASGCBXDBOFUSZ-PKOBYXMFSA-N	0	3	330.447	3.257	20	30		EGEDHN
CC(C)n1cccc1C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2)C1	ZINC001216763040	1373340221	/nfs/dbraw/zinc/34/02/21/1373340221.db2.gz	UYIUEWDQIPILIB-UYAOXDASSA-N	0	3	349.478	3.171	20	30		EGEDHN
CCC(C)(CC)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001216795742	1373343920	/nfs/dbraw/zinc/34/39/20/1373343920.db2.gz	VOHOKCGOIIUAIP-VQIMIIECSA-N	0	3	344.474	3.440	20	30		EGEDHN
CCCCCCCCOCC(=O)NCCNCc1cnc(C)s1	ZINC001129523065	1373393765	/nfs/dbraw/zinc/39/37/65/1373393765.db2.gz	SMIQWQBPVSLZQH-UHFFFAOYSA-N	0	3	341.521	3.034	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)[C@H]3[C@@H]4CCCC[C@@H]43)[C@H]2C1	ZINC001217595183	1373470606	/nfs/dbraw/zinc/47/06/06/1373470606.db2.gz	MIBBWEJGHNOAOM-PXTPFGJHSA-N	0	3	348.531	3.305	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)[C@H](C)CC(C)(C)C)C1	ZINC001130431393	1373535969	/nfs/dbraw/zinc/53/59/69/1373535969.db2.gz	XBYHIQSKAFAQLT-HUUCEWRRSA-N	0	3	332.492	3.074	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)[C@H]3CCCC34CC4)[C@H]2C1	ZINC001218168789	1373572369	/nfs/dbraw/zinc/57/23/69/1373572369.db2.gz	UKKIXLJWFROZSL-CEXWTWQISA-N	0	3	348.531	3.449	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)CCC(C)(F)F)[C@H]2C1	ZINC001218195097	1373576551	/nfs/dbraw/zinc/57/65/51/1373576551.db2.gz	CTPZAXJJSMWLDD-JKSUJKDBSA-N	0	3	344.446	3.080	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)c2ccc(Cl)cc2F)ccc1F	ZINC001131010726	1373624429	/nfs/dbraw/zinc/62/44/29/1373624429.db2.gz	AERCBTVIXDLKEH-UHFFFAOYSA-N	0	3	349.768	3.009	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCO[C@@H]2CN(CCCC(C)(C)C)C[C@@H]21	ZINC001218522527	1373629894	/nfs/dbraw/zinc/62/98/94/1373629894.db2.gz	BERFUAOEYSTFBW-FGTMMUONSA-N	0	3	336.520	3.327	20	30		EGEDHN
CCn1cc(C(=O)NCCNCc2ccc(C#N)cc2)c2ccccc21	ZINC001131055449	1373634197	/nfs/dbraw/zinc/63/41/97/1373634197.db2.gz	WHLLGRDIBKNBSO-UHFFFAOYSA-N	0	3	346.434	3.052	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)[C@@H]3CCC(C)(C)C3)[C@H]2C1	ZINC001218599639	1373635697	/nfs/dbraw/zinc/63/56/97/1373635697.db2.gz	DBBIORNDYKFTNZ-CEXWTWQISA-N	0	3	348.531	3.471	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)CCCC(C)C)[C@H]2C1	ZINC001218688899	1373643752	/nfs/dbraw/zinc/64/37/52/1373643752.db2.gz	QKKYHJJBBWNZBQ-RBUKOAKNSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)Nc1cnc(-c2ccc(O)cc2)nc1	ZINC001218702557	1373645837	/nfs/dbraw/zinc/64/58/37/1373645837.db2.gz	PTVCJFBHPQUYSC-KRWDZBQOSA-N	0	3	340.427	3.252	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)NC[C@@H](C)Oc1ccc(OC)cc1	ZINC001219945507	1373740709	/nfs/dbraw/zinc/74/07/09/1373740709.db2.gz	LPKMEGWDOCFRFN-QAPCUYQASA-N	0	3	334.460	3.043	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C1(CCC)CCC1)C[C@@H](C)O2	ZINC001131673458	1373755514	/nfs/dbraw/zinc/75/55/14/1373755514.db2.gz	MLPWBZRJZKJRLV-XLIONFOSSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCCC1(C(=O)N2C[C@H](C)O[C@]3(CCN(CC(=C)C)C3)C2)CC1	ZINC001131688822	1373763924	/nfs/dbraw/zinc/76/39/24/1373763924.db2.gz	RYSKWBYOMBIGSG-PXNSSMCTSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=CCCCCCN1C[C@H](NC(=O)c2snnc2C)CC[C@@H]1C	ZINC001131779767	1373800594	/nfs/dbraw/zinc/80/05/94/1373800594.db2.gz	JZDKSIBUNYWNDL-DZGCQCFKSA-N	0	3	336.505	3.176	20	30		EGEDHN
Cc1ccc(C)c(CN2C[C@@H](NC(=O)CSCC#N)CC[C@@H]2C)c1	ZINC001131830768	1373827455	/nfs/dbraw/zinc/82/74/55/1373827455.db2.gz	UTUMVSFKNCWWEC-WMZOPIPTSA-N	0	3	345.512	3.029	20	30		EGEDHN
O=C(Nc1cccc(Cl)c1F)N1CCC2SC(=O)C=C2C1	ZINC001188386941	1388300123	/nfs/dbraw/zinc/30/01/23/1388300123.db2.gz	NJGJBXOVAWPEIC-LLVKDONJSA-N	0	3	326.780	3.285	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC[C@H](C)N(CCOc2cccc(C)c2)C1	ZINC001131896905	1375033392	/nfs/dbraw/zinc/03/33/92/1375033392.db2.gz	WZTUNCDNVMGZTF-ROUUACIJSA-N	0	3	330.472	3.309	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@@H](C)c2ccc(Cl)cc2)CC1	ZINC001224318930	1375063966	/nfs/dbraw/zinc/06/39/66/1375063966.db2.gz	OCFDXRMMXCQBNV-HNNXBMFYSA-N	0	3	332.875	3.295	20	30		EGEDHN
CCc1ccccc1CCN1C[C@@H](NC(=O)C#CC(C)C)CC[C@H]1C	ZINC001132022162	1375103703	/nfs/dbraw/zinc/10/37/03/1375103703.db2.gz	VTPYIJMBFSKJOL-NQIIRXRSSA-N	0	3	340.511	3.420	20	30		EGEDHN
C[C@@H](C#N)C(=O)N[C@@H]1CCCC[C@H]1NCc1cc(Cl)ccc1F	ZINC001225395854	1375108040	/nfs/dbraw/zinc/10/80/40/1375108040.db2.gz	UBOJDHASAZECQY-IUIKQTSFSA-N	0	3	337.826	3.156	20	30		EGEDHN
C[C@H]1CC[C@@H](NC(=O)C#CC2CC2)CN1Cc1ccc2c(c1)CCC2	ZINC001132034178	1375108894	/nfs/dbraw/zinc/10/88/94/1375108894.db2.gz	PEJIONRPUKJOLJ-HRAATJIYSA-N	0	3	336.479	3.058	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H](C)CCC	ZINC001225441036	1375110797	/nfs/dbraw/zinc/11/07/97/1375110797.db2.gz	VZEBEGXEIZALDM-IACUBPJLSA-N	0	3	331.298	3.348	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N[C@H]2CC[C@H](C)N(CCCF)C2)cc1	ZINC001132041762	1375112693	/nfs/dbraw/zinc/11/26/93/1375112693.db2.gz	KIEIXUFKNPODMZ-WMZOPIPTSA-N	0	3	346.446	3.031	20	30		EGEDHN
C[C@H](C(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccc(F)cc1)C1CC1	ZINC001225532964	1375120405	/nfs/dbraw/zinc/12/04/05/1375120405.db2.gz	CPLIUKPFCGTUAV-CWFSZBLJSA-N	0	3	342.458	3.240	20	30		EGEDHN
C=CCOCCCC(=O)N[C@@H]1CCCC[C@H]1NCC=C(Cl)Cl	ZINC001225553041	1375123732	/nfs/dbraw/zinc/12/37/32/1375123732.db2.gz	RLGUMXBKVVVHLS-ZIAGYGMSSA-N	0	3	349.302	3.305	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCOc2cc(C)cc(C)c2)CC[C@H]1C	ZINC001132097262	1375145007	/nfs/dbraw/zinc/14/50/07/1375145007.db2.gz	HRXAUGUMXCTAJH-MSOLQXFVSA-N	0	3	330.472	3.227	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCOc2cccc(F)c2)CC[C@@H]1C	ZINC001132097414	1375146424	/nfs/dbraw/zinc/14/64/24/1375146424.db2.gz	JKXWXEXQNQYJOG-DOTOQJQBSA-N	0	3	334.435	3.140	20	30		EGEDHN
C=CCCCN1C[C@H](NC(=O)c2sc3nccn3c2C)CC[C@H]1C	ZINC001132116871	1375157371	/nfs/dbraw/zinc/15/73/71/1375157371.db2.gz	XIJFOSUTIFPKKG-UKRRQHHQSA-N	0	3	346.500	3.253	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)COc2ccc(C(C)C)cc2)CC[C@@H]1C	ZINC001132160019	1375177822	/nfs/dbraw/zinc/17/78/22/1375177822.db2.gz	HSGKLCRUQAKRGS-PKOBYXMFSA-N	0	3	342.483	3.181	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2ncc(Cl)s2)CC[C@@H]1C	ZINC001132170501	1375186305	/nfs/dbraw/zinc/18/63/05/1375186305.db2.gz	ZKBZMBLCHXVLOB-RYUDHWBXSA-N	0	3	327.881	3.345	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCCOc2ccc(F)cc2)CC[C@H]1C	ZINC001132214150	1375212620	/nfs/dbraw/zinc/21/26/20/1375212620.db2.gz	CLIDPOZZKFUUNW-WBVHZDCISA-N	0	3	334.435	3.140	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2c(C)cc(F)cc2C)CC[C@@H]1C	ZINC001132215562	1375214401	/nfs/dbraw/zinc/21/44/01/1375214401.db2.gz	ZSSKKGQGUPSBOY-WMZOPIPTSA-N	0	3	348.462	3.228	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CC[C@H](C)N(CCn2nc(C)cc2C)C1	ZINC001132218542	1375216684	/nfs/dbraw/zinc/21/66/84/1375216684.db2.gz	RMVKSEIQOZZPDT-FUHWJXTLSA-N	0	3	346.519	3.071	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1CC[C@H](C)N(Cc2cccc(N(C)C)c2)C1	ZINC001132218552	1375216768	/nfs/dbraw/zinc/21/67/68/1375216768.db2.gz	RSIJNKJTAYPAJS-WMZOPIPTSA-N	0	3	343.515	3.434	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1CC[C@@H](C)N(CCOc2ccccc2)C1	ZINC001132249540	1375244227	/nfs/dbraw/zinc/24/42/27/1375244227.db2.gz	QCMSRTQRHBTBLZ-MSOLQXFVSA-N	0	3	330.472	3.391	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)C(C2CCC2)C2CCC2)CC[C@@H]1C	ZINC001132249549	1375245491	/nfs/dbraw/zinc/24/54/91/1375245491.db2.gz	QGMOAQIJDWEBKY-LPHOPBHVSA-N	0	3	348.531	3.375	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)C(C2CCC2)C2CCC2)CC[C@H]1C	ZINC001132249551	1375245627	/nfs/dbraw/zinc/24/56/27/1375245627.db2.gz	QGMOAQIJDWEBKY-VQIMIIECSA-N	0	3	348.531	3.375	20	30		EGEDHN
C=CCCCN1C[C@H](NC(=O)c2snnc2C(C)C)CC[C@H]1C	ZINC001132367951	1375332967	/nfs/dbraw/zinc/33/29/67/1375332967.db2.gz	GWGRXUINCNLCCB-ZIAGYGMSSA-N	0	3	336.505	3.210	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C(C)(C)CC2CCOCC2)CC[C@H]1C	ZINC001132397306	1375352397	/nfs/dbraw/zinc/35/23/97/1375352397.db2.gz	RAOGIMVUHBSSJU-SJLPKXTDSA-N	0	3	336.520	3.375	20	30		EGEDHN
O=C(N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1)C1(F)CCCC1	ZINC001227218365	1375407913	/nfs/dbraw/zinc/40/79/13/1375407913.db2.gz	VCFUAYJZCDHCJJ-RTBURBONSA-N	0	3	342.458	3.337	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2cscc2C(F)F)CC1	ZINC001227419405	1375429816	/nfs/dbraw/zinc/42/98/16/1375429816.db2.gz	KXYYDOPRHMXLCZ-UHFFFAOYSA-N	0	3	344.427	3.083	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1CC[C@H](C)N(Cc2cc(C)cc(C)c2)C1	ZINC001132528257	1375442529	/nfs/dbraw/zinc/44/25/29/1375442529.db2.gz	AWJLTRQHYIYGGR-ICSRJNTNSA-N	0	3	344.499	3.365	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1CC[C@H](C)N(Cc2ccc(C)c(C)c2)C1	ZINC001132533038	1375445088	/nfs/dbraw/zinc/44/50/88/1375445088.db2.gz	JCTLDTOBCBWGQI-ICSRJNTNSA-N	0	3	344.499	3.365	20	30		EGEDHN
CC#CCN1CC[C@H](CN(Cc2scnc2C)C(=O)CC(C)C)C1	ZINC001132558659	1375465352	/nfs/dbraw/zinc/46/53/52/1375465352.db2.gz	ODPZESROEJSXOK-KRWDZBQOSA-N	0	3	347.528	3.171	20	30		EGEDHN
C#CCN1CC[C@H](CN(Cc2scnc2C)C(=O)[C@H](C)C(C)C)C1	ZINC001132562063	1375468426	/nfs/dbraw/zinc/46/84/26/1375468426.db2.gz	DNIJEGZJDMAIKX-WBVHZDCISA-N	0	3	347.528	3.027	20	30		EGEDHN
C#CCN1CC[C@@H](CN(Cc2scnc2C)C(=O)CCCC=C)C1	ZINC001132563581	1375469495	/nfs/dbraw/zinc/46/94/95/1375469495.db2.gz	SYHVXIRRCHVMKB-QGZVFWFLSA-N	0	3	345.512	3.092	20	30		EGEDHN
C[C@]1(C(=O)N[C@@H]2CCCC[C@H]2NCC#Cc2ccccc2)C=CCC1	ZINC001227991684	1375499398	/nfs/dbraw/zinc/49/93/98/1375499398.db2.gz	WWAPBHMLBFITSH-SJBKTWHCSA-N	0	3	336.479	3.411	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](C)[C@@H](CNCc2nc(C)cs2)C1	ZINC001132761692	1375551553	/nfs/dbraw/zinc/55/15/53/1375551553.db2.gz	KRWJGWDSYDNLFO-RDJZCZTQSA-N	0	3	347.528	3.219	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](C)[C@@H](CNCc2csc(C)n2)C1	ZINC001132773709	1375556385	/nfs/dbraw/zinc/55/63/85/1375556385.db2.gz	OYDZAOHXCWGEIO-RDJZCZTQSA-N	0	3	347.528	3.219	20	30		EGEDHN
Cc1nc(O[C@H]2CCCN(C(C)C)C2)c(C#N)cc1Br	ZINC001228797765	1375680487	/nfs/dbraw/zinc/68/04/87/1375680487.db2.gz	BCENBPVGNVOCJZ-ZDUSSCGKSA-N	0	3	338.249	3.276	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)C[C@@H](C)c1cccnc1	ZINC001228948040	1375724393	/nfs/dbraw/zinc/72/43/93/1375724393.db2.gz	BFZAFQADSPTSBS-KBRIMQKVSA-N	0	3	335.879	3.345	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](C)[C@@H](CNCc3cnc(C)o3)C2)CC1	ZINC001133104723	1375777386	/nfs/dbraw/zinc/77/73/86/1375777386.db2.gz	JBSXZROMDGDGJB-WBVHZDCISA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](C)[C@@H](CNCc2ccn(CC)n2)C1	ZINC001133141328	1375802617	/nfs/dbraw/zinc/80/26/17/1375802617.db2.gz	BZWIHJHBUCUAOT-SJORKVTESA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)COc1cccc(C)c1	ZINC001230119695	1375947025	/nfs/dbraw/zinc/94/70/25/1375947025.db2.gz	XZCNTNGMYLWXMU-IAGOWNOFSA-N	0	3	336.863	3.143	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H]1CC=CCC1	ZINC001133376787	1375955773	/nfs/dbraw/zinc/95/57/73/1375955773.db2.gz	BNSGPELWUNLGBL-QGZVFWFLSA-N	0	3	330.859	3.248	20	30		EGEDHN
C=CC[NH2+]CCN(Cc1cccc(Cl)c1)C(=O)c1ccccc1[O-]	ZINC001133382567	1375962938	/nfs/dbraw/zinc/96/29/38/1375962938.db2.gz	OKAVDRHDDWSIIO-UHFFFAOYSA-N	0	3	344.842	3.464	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1ccoc1C	ZINC001133382470	1375963589	/nfs/dbraw/zinc/96/35/89/1375963589.db2.gz	KEYCURANUGPECH-UHFFFAOYSA-N	0	3	344.842	3.497	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)CCc1ccoc1	ZINC001133391004	1375975553	/nfs/dbraw/zinc/97/55/53/1375975553.db2.gz	SILMGQQMWMUTEE-UHFFFAOYSA-N	0	3	344.842	3.117	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)/C=C/C(C)(C)C	ZINC001133392607	1375977306	/nfs/dbraw/zinc/97/73/06/1375977306.db2.gz	FLNPJFXMTNLPPS-MDZDMXLPSA-N	0	3	332.875	3.494	20	30		EGEDHN
C=CCC1(C(=O)NCCNCc2ccccc2OC(C)C)CCC1	ZINC001133392014	1375977469	/nfs/dbraw/zinc/97/74/69/1375977469.db2.gz	CNPOQPZWGFMFEZ-UHFFFAOYSA-N	0	3	330.472	3.426	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H]1CC[C@@H](F)C1	ZINC001133401527	1375985132	/nfs/dbraw/zinc/98/51/32/1375985132.db2.gz	FTGGFBZGVIMYMI-NVXWUHKLSA-N	0	3	336.838	3.030	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@H](C)C(C)(F)F	ZINC001133405680	1375990931	/nfs/dbraw/zinc/99/09/31/1375990931.db2.gz	LBDGXNPTXWFVNN-ZDUSSCGKSA-N	0	3	342.817	3.183	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)/C=C/c1ccco1)NCc1ccccc1C#N	ZINC001133520108	1376053624	/nfs/dbraw/zinc/05/36/24/1376053624.db2.gz	ICWNPYBYXMMDPG-MTQIJDFFSA-N	0	3	337.423	3.238	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)c1ccc(F)cc1)NCc1ccccc1C#N	ZINC001133550172	1376080812	/nfs/dbraw/zinc/08/08/12/1376080812.db2.gz	NYGNYUXCWHUMCF-CABCVRRESA-N	0	3	339.414	3.384	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC([C@H]2CCCN2Cc2ccon2)CC1	ZINC001230569780	1376080896	/nfs/dbraw/zinc/08/08/96/1376080896.db2.gz	VHDNBOYBXDAJHJ-GOSISDBHSA-N	0	3	345.487	3.480	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)c1ccc(F)cc1)Cc1cccnc1	ZINC001230647191	1376114985	/nfs/dbraw/zinc/11/49/85/1376114985.db2.gz	LDWQMDKZXJIVIA-UHFFFAOYSA-N	0	3	341.430	3.419	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)c1cc(C)oc1C	ZINC001133640490	1376131721	/nfs/dbraw/zinc/13/17/21/1376131721.db2.gz	IIIGHGMQILFMEB-MNOVXSKESA-N	0	3	343.265	3.292	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H](C)C[C@H](C)NCc2cc(F)ccc2C#N)o1	ZINC001133652388	1376137324	/nfs/dbraw/zinc/13/73/24/1376137324.db2.gz	ASCPETFPGKXUFG-QWHCGFSZSA-N	0	3	343.402	3.286	20	30		EGEDHN
Cc1ccoc1C(=O)N[C@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001133678726	1376150442	/nfs/dbraw/zinc/15/04/42/1376150442.db2.gz	GEKXGGMLYOWECW-LSDHHAIUSA-N	0	3	325.412	3.146	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCCN(Cc1cccnc1)C[C@@H](C)OC	ZINC001230838772	1376163616	/nfs/dbraw/zinc/16/36/16/1376163616.db2.gz	UPQJSWGOZYJJHU-YLJYHZDGSA-N	0	3	347.503	3.027	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCCN(Cc1cccnc1)C[C@@H](C)OC	ZINC001230838771	1376163948	/nfs/dbraw/zinc/16/39/48/1376163948.db2.gz	UPQJSWGOZYJJHU-XLIONFOSSA-N	0	3	347.503	3.027	20	30		EGEDHN
C#CCCN(CCCNC(=O)[C@H](C)c1ccccc1)Cc1cccnc1	ZINC001230906812	1376180331	/nfs/dbraw/zinc/18/03/31/1376180331.db2.gz	VNOXABUSRCBAIO-LJQANCHMSA-N	0	3	349.478	3.217	20	30		EGEDHN
COc1ccc(CN(C)CCCNC(=O)CC2CCCC2)cc1C#N	ZINC001231379550	1376233616	/nfs/dbraw/zinc/23/36/16/1376233616.db2.gz	UROUIOPMGXUIMW-UHFFFAOYSA-N	0	3	343.471	3.085	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)/C=C\C(C)(C)C	ZINC001133951004	1376280241	/nfs/dbraw/zinc/28/02/41/1376280241.db2.gz	UWNQTMIWBREUIW-XRMAHGQMSA-N	0	3	331.298	3.370	20	30		EGEDHN
C=CCOc1cccc(CN2CCC(N(C)C(=O)C(C)C)CC2)c1	ZINC001231624802	1376284212	/nfs/dbraw/zinc/28/42/12/1376284212.db2.gz	WVECMAKGZIWABG-UHFFFAOYSA-N	0	3	330.472	3.330	20	30		EGEDHN
C#Cc1cccc(CN2CCC[C@@]3(C[C@H](Oc4ccccn4)CO3)C2)c1	ZINC001231656982	1376295990	/nfs/dbraw/zinc/29/59/90/1376295990.db2.gz	KYCJANLQLPFQCJ-RBBKRZOGSA-N	0	3	348.446	3.265	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)CCC1CCC1	ZINC001134036086	1376323105	/nfs/dbraw/zinc/32/31/05/1376323105.db2.gz	ZMTVSLQMSYOPFU-CHWSQXEVSA-N	0	3	331.298	3.348	20	30		EGEDHN
Cc1nscc1C(=O)N[C@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001134127540	1376383199	/nfs/dbraw/zinc/38/31/99/1376383199.db2.gz	PJRFUQGBSIEIDN-QWHCGFSZSA-N	0	3	342.468	3.010	20	30		EGEDHN
COc1ccc(CNCCNC(=O)C[C@@H](C)CC(C)(C)C)cc1C#N	ZINC001134254934	1376438710	/nfs/dbraw/zinc/43/87/10/1376438710.db2.gz	NIAZFVLNYJRJTE-OAHLLOKOSA-N	0	3	345.487	3.235	20	30		EGEDHN
CN(Cc1cc(C#N)ccn1)CC1CCN(C(=O)OC(C)(C)C)CC1	ZINC001232477566	1376466060	/nfs/dbraw/zinc/46/60/60/1376466060.db2.gz	NHPUDOKVEDNJMN-UHFFFAOYSA-N	0	3	344.459	3.032	20	30		EGEDHN
Cc1nc(CN[C@H](C)C[C@@H](C)NC(=O)C#CC(C)(C)C)sc1C	ZINC001134329769	1376480670	/nfs/dbraw/zinc/48/06/70/1376480670.db2.gz	SBPNGWSQCFKQSQ-CHWSQXEVSA-N	0	3	335.517	3.182	20	30		EGEDHN
C=CCO[C@H]1CO[C@]2(C1)CCCN(Cc1c(C)cccc1OC)C2	ZINC001232622672	1376491244	/nfs/dbraw/zinc/49/12/44/1376491244.db2.gz	TUMLVYDOMZRQNT-XLIONFOSSA-N	0	3	331.456	3.330	20	30		EGEDHN
CN(Cc1ccccc1)C1CC[NH+](Cc2cc(C#N)ccc2[O-])CC1	ZINC001232679184	1376500004	/nfs/dbraw/zinc/50/00/04/1376500004.db2.gz	GGOOEKVTSGSYAW-UHFFFAOYSA-N	0	3	335.451	3.360	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)C[C@H](C)NCc2ccccc2C#N)CCC1	ZINC001134593465	1376615657	/nfs/dbraw/zinc/61/56/57/1376615657.db2.gz	NHEJKKBINJSJDF-DLBZAZTESA-N	0	3	337.467	3.125	20	30		EGEDHN
CN(C[C@H]1CCN1CC/C=C\c1ccccc1)C(=O)c1ccc(C#N)[nH]1	ZINC001233691878	1376696260	/nfs/dbraw/zinc/69/62/60/1376696260.db2.gz	CYQPDDQGVJOIQU-FVXMCEBTSA-N	0	3	348.450	3.136	20	30		EGEDHN
CC[C@@H](Cc1cccc(C)c1)C(=O)NCCNCc1cccc(C#N)c1	ZINC001134846625	1376751795	/nfs/dbraw/zinc/75/17/95/1376751795.db2.gz	BFWLWJSZUCSLJX-NRFANRHFSA-N	0	3	349.478	3.341	20	30		EGEDHN
CC(C)C#CC(=O)N(C)C[C@@H]1CCN1CC[C@H]1CCc2ccccc21	ZINC001234159994	1376780063	/nfs/dbraw/zinc/78/00/63/1376780063.db2.gz	FIYLJPUCFCGKCO-UXHICEINSA-N	0	3	338.495	3.299	20	30		EGEDHN
C=CCCCCCN1CC[C@H]1CN(C)C(=O)[C@@H]1CCCc2cn[nH]c21	ZINC001234324131	1376811209	/nfs/dbraw/zinc/81/12/09/1376811209.db2.gz	YKNQQEBOJLDQIS-ZWKOTPCHSA-N	0	3	344.503	3.109	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)COc1cc(C)ccc1F	ZINC001234331772	1376813373	/nfs/dbraw/zinc/81/33/73/1376813373.db2.gz	CGMMYHPDFFAPGN-INIZCTEOSA-N	0	3	334.435	3.012	20	30		EGEDHN
C=CCCCN1CC[C@H]1CN(C)C(=O)c1ocnc1-c1ccccc1	ZINC001235123407	1376854818	/nfs/dbraw/zinc/85/48/18/1376854818.db2.gz	MBGAXKZVSDXXEA-KRWDZBQOSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=CCCCN1CC[C@@H]1CN(C)C(=O)c1ocnc1-c1ccccc1	ZINC001235123409	1376855175	/nfs/dbraw/zinc/85/51/75/1376855175.db2.gz	MBGAXKZVSDXXEA-QGZVFWFLSA-N	0	3	339.439	3.454	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)C1(CCF)CC1)NCc1ccccc1C#N	ZINC001135081472	1376884629	/nfs/dbraw/zinc/88/46/29/1376884629.db2.gz	MVHCTCTYSAKTQN-HUUCEWRRSA-N	0	3	331.435	3.071	20	30		EGEDHN
N#Cc1ccc(Oc2ccc(CN3CC[C@@H](F)[C@H](N)C3)cc2)cc1	ZINC001235911434	1376916655	/nfs/dbraw/zinc/91/66/55/1376916655.db2.gz	SXOINDKQSCPSFL-RTBURBONSA-N	0	3	325.387	3.222	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H](C)C[C@H](C)NC/C(Cl)=C\Cl)cc1	ZINC001135184901	1376957953	/nfs/dbraw/zinc/95/79/53/1376957953.db2.gz	QRIYGONXCFIKDW-HBWTURNESA-N	0	3	339.266	3.473	20	30		EGEDHN
CCOC(=O)COc1cccc(CN(C)Cc2ccc(C#N)cc2)c1	ZINC001237909334	1376988980	/nfs/dbraw/zinc/98/89/80/1376988980.db2.gz	CGECUEZAYCAXBB-UHFFFAOYSA-N	0	3	338.407	3.132	20	30		EGEDHN
CC#CCCCC(=O)N[C@H](C)C[C@@H](C)NCc1ccncc1Cl	ZINC001135234510	1376990897	/nfs/dbraw/zinc/99/08/97/1376990897.db2.gz	AUBIPRUUAUWZBA-HUUCEWRRSA-N	0	3	335.879	3.302	20	30		EGEDHN
CCCCCCCCCCNC(=S)N[C@H]1CC[C@@H]2NCCO[C@@H]12	ZINC001239365731	1377007494	/nfs/dbraw/zinc/00/74/94/1377007494.db2.gz	DJWVAUBQVLWRHM-YESZJQIVSA-N	0	3	341.565	3.111	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)C1(C(C)C)CC1	ZINC001135434457	1377095022	/nfs/dbraw/zinc/09/50/22/1377095022.db2.gz	JITARHYXXFZUTK-OLZOCXBDSA-N	0	3	331.298	3.204	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)c1cc(C)[nH]c1C	ZINC001135561569	1377145592	/nfs/dbraw/zinc/14/55/92/1377145592.db2.gz	SSXASZQVOHQKEI-GHMZBOCLSA-N	0	3	342.281	3.027	20	30		EGEDHN
CC(F)(F)CCC(=O)NC[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001266754548	1377376984	/nfs/dbraw/zinc/37/69/84/1377376984.db2.gz	DBQFIRFPLIDEHV-KRWDZBQOSA-N	0	3	349.425	3.322	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)C1(Cc2ccccc2)CC1)C(C)C	ZINC001268212324	1377495831	/nfs/dbraw/zinc/49/58/31/1377495831.db2.gz	LAYZVSQQYDVKJH-KRWDZBQOSA-N	0	3	334.891	3.492	20	30		EGEDHN
CCC#CC(=O)N1CCC[C@@]2(CCCN(Cc3scnc3C)C2)C1	ZINC001268951165	1377533048	/nfs/dbraw/zinc/53/30/48/1377533048.db2.gz	GADHBSDJQLJEMJ-LJQANCHMSA-N	0	3	345.512	3.070	20	30		EGEDHN
O=C1C=C2CN(Cc3ccc(F)cc3Br)CCC2S1	ZINC001137545362	1377564068	/nfs/dbraw/zinc/56/40/68/1377564068.db2.gz	KMAGVNORGSJXBQ-ZDUSSCGKSA-N	0	3	342.233	3.362	20	30		EGEDHN
CN(c1ccc(C#N)cc1)c1ccc(CN2CC[C@H](F)[C@H](O)C2)cc1	ZINC001137899636	1377640788	/nfs/dbraw/zinc/64/07/88/1377640788.db2.gz	BDDYOFSXLMJCDI-VQTJNVASSA-N	0	3	339.414	3.231	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cc(O)cc(O)c1)[C@@H]2CC	ZINC001138325904	1377702718	/nfs/dbraw/zinc/70/27/18/1377702718.db2.gz	YSEPRZSIXNBIAN-QUCCMNQESA-N	0	3	344.455	3.019	20	30		EGEDHN
C#CCOc1ccc(CN2C[C@@H]3C[C@H]2CN3Cc2ccccc2)cc1	ZINC001138557697	1377741863	/nfs/dbraw/zinc/74/18/63/1377741863.db2.gz	PRRGILVKQOOSBD-SFTDATJTSA-N	0	3	332.447	3.157	20	30		EGEDHN
C#CCOc1ccc(CN2CCC[C@H](Oc3ncccc3C)C2)cc1	ZINC001138560595	1377741924	/nfs/dbraw/zinc/74/19/24/1377741924.db2.gz	BPTLCQVEVYTTFU-FQEVSTJZSA-N	0	3	336.435	3.445	20	30		EGEDHN
C#CCOc1ccc(CN2CCC[C@]3(C[C@H](CCOC)CO3)C2)cc1	ZINC001138559716	1377741988	/nfs/dbraw/zinc/74/19/88/1377741988.db2.gz	QLZLQDCCBZRGDM-FPOVZHCZSA-N	0	3	343.467	3.106	20	30		EGEDHN
C#CCOc1ccc(CN2CC[C@@H](CC(=O)OC(C)(C)C)C2)cc1	ZINC001138560348	1377742030	/nfs/dbraw/zinc/74/20/30/1377742030.db2.gz	SHUMNNTYRZZEPV-KRWDZBQOSA-N	0	3	329.440	3.252	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CCC(NC(=O)C3CCC3)CC2)c1[O-]	ZINC001138629085	1377756661	/nfs/dbraw/zinc/75/66/61/1377756661.db2.gz	NGCOPTKQXYWOKY-UHFFFAOYSA-N	0	3	328.456	3.001	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CCC(N(C)C(=O)C(C)C)CC2)c1[O-]	ZINC001138630770	1377757525	/nfs/dbraw/zinc/75/75/25/1377757525.db2.gz	CXQXJHHFHBMZBP-UHFFFAOYSA-N	0	3	330.472	3.200	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CCC(Oc3nccc(C)n3)CC2)c1[O-]	ZINC001138631639	1377758009	/nfs/dbraw/zinc/75/80/09/1377758009.db2.gz	WUTWZVMTGAFZRD-UHFFFAOYSA-N	0	3	339.439	3.263	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCCc3cc(O)c(O)cc3C2)c1[O-]	ZINC001138630056	1377758094	/nfs/dbraw/zinc/75/80/94/1377758094.db2.gz	PEBCNGLIMWTTPV-UHFFFAOYSA-N	0	3	325.408	3.480	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCCc3cc(O)c(O)cc3C2)c1[O-]	ZINC001138630056	1377758099	/nfs/dbraw/zinc/75/80/99/1377758099.db2.gz	PEBCNGLIMWTTPV-UHFFFAOYSA-N	0	3	325.408	3.480	20	30		EGEDHN
C=C(C)COc1ccccc1CN1CCC2(CCCNC2=O)CC1	ZINC001138665884	1377765198	/nfs/dbraw/zinc/76/51/98/1377765198.db2.gz	ZLKBPJUNMXKMJC-UHFFFAOYSA-N	0	3	328.456	3.134	20	30		EGEDHN
C[C@@]1(O)CCCCN(Cc2ccc(Oc3ccc(C#N)cc3)nc2)C1	ZINC001139425119	1377882230	/nfs/dbraw/zinc/88/22/30/1377882230.db2.gz	ZYLAFHXRYLZMEI-HXUWFJFHSA-N	0	3	337.423	3.482	20	30		EGEDHN
C[C@H]1CC[C@H](CO)CN1Cc1ccc(Oc2ccc(C#N)cc2)nc1	ZINC001139427188	1377882443	/nfs/dbraw/zinc/88/24/43/1377882443.db2.gz	XHAPWLXLJNBUGU-YJBOKZPZSA-N	0	3	337.423	3.338	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CC2)C(=O)N[C@@H]3c2ccccc2)cc1F	ZINC001139527745	1377897271	/nfs/dbraw/zinc/89/72/71/1377897271.db2.gz	OPFLGRGGUXBHEH-LJQANCHMSA-N	0	3	349.409	3.151	20	30		EGEDHN
Cc1ccc(CN2CCC3(CC(=O)N(C(C)C)C3)CC2)cc1C#N	ZINC001139726982	1377942688	/nfs/dbraw/zinc/94/26/88/1377942688.db2.gz	FFAJGCIUSDYHOC-UHFFFAOYSA-N	0	3	325.456	3.090	20	30		EGEDHN
C=CCN1C(=O)CCC12CCN(Cc1cc3ccccc3n1C)CC2	ZINC001139867731	1377967761	/nfs/dbraw/zinc/96/77/61/1377967761.db2.gz	NPXSNODBSPOFQP-UHFFFAOYSA-N	0	3	337.467	3.321	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3cncc4ccccc43)C2)C1=O	ZINC001139894464	1377974392	/nfs/dbraw/zinc/97/43/92/1377974392.db2.gz	RGEZEGCVAKBBMJ-NRFANRHFSA-N	0	3	335.451	3.235	20	30		EGEDHN
COc1cc2c(cc1OC)[C@@H](CN(C)Cc1ccc(C#N)cc1F)C2	ZINC001140140052	1378018229	/nfs/dbraw/zinc/01/82/29/1378018229.db2.gz	KPWCGCDNJOMYFS-MRXNPFEDSA-N	0	3	340.398	3.486	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(CCC[N@H+](Cc3ccccc3[O-])CC2)C1=O	ZINC001272618934	1378076358	/nfs/dbraw/zinc/07/63/58/1378076358.db2.gz	QBDOQZWIFSGYPG-FQEVSTJZSA-N	0	3	328.456	3.173	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(CCC[N@@H+](Cc3ccccc3[O-])CC2)C1=O	ZINC001272618934	1378076365	/nfs/dbraw/zinc/07/63/65/1378076365.db2.gz	QBDOQZWIFSGYPG-FQEVSTJZSA-N	0	3	328.456	3.173	20	30		EGEDHN
C=CCNC(=O)[C@@H]1CC12CCN(Cc1[nH]c3ccccc3c1C)CC2	ZINC001273326372	1378097959	/nfs/dbraw/zinc/09/79/59/1378097959.db2.gz	CQGWSWLELRVAGZ-KRWDZBQOSA-N	0	3	337.467	3.381	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CC[N@@H+](Cc3ccc(C)cc3[O-])C2)C1	ZINC001140948540	1378188145	/nfs/dbraw/zinc/18/81/45/1378188145.db2.gz	MVJKLTROMFTBCD-FQEVSTJZSA-N	0	3	344.455	3.311	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CC[N@H+](Cc3ccc(C)cc3[O-])C2)C1	ZINC001140948540	1378188146	/nfs/dbraw/zinc/18/81/46/1378188146.db2.gz	MVJKLTROMFTBCD-FQEVSTJZSA-N	0	3	344.455	3.311	20	30		EGEDHN
N#Cc1cc[nH]c1CN1CCC2(CN(CCCC(F)(F)F)C2)CC1	ZINC001276837425	1378188460	/nfs/dbraw/zinc/18/84/60/1378188460.db2.gz	BOYFOSVYPVEBTF-UHFFFAOYSA-N	0	3	340.393	3.127	20	30		EGEDHN
COC(=O)c1ccc(C2CN(Cc3c[nH]c4cc(C#N)ccc34)C2)cc1	ZINC001142926070	1378509896	/nfs/dbraw/zinc/50/98/96/1378509896.db2.gz	JBBJZQPESJBXLN-UHFFFAOYSA-N	0	3	345.402	3.426	20	30		EGEDHN
COc1cccnc1O[C@@H]1CCN(Cc2c[nH]c3cc(C#N)ccc23)C1	ZINC001142932115	1378511890	/nfs/dbraw/zinc/51/18/90/1378511890.db2.gz	YBTSFTJMOMJUQE-MRXNPFEDSA-N	0	3	348.406	3.096	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCCN(Cc3ccc4cc[nH]c4n3)C2)cc1	ZINC001144186938	1378694990	/nfs/dbraw/zinc/69/49/90/1378694990.db2.gz	OHBWPBFRHDEYDO-LJQANCHMSA-N	0	3	332.407	3.478	20	30		EGEDHN
C=C(C(=O)N(C)[C@H]1CN(Cc2ccccc2)CC[C@@H]1C)C(F)(F)F	ZINC001144209777	1378699574	/nfs/dbraw/zinc/69/95/74/1378699574.db2.gz	SDEUYHOQJJJVOG-BBRMVZONSA-N	0	3	340.389	3.474	20	30		EGEDHN
C#Cc1ccc(CN2CCC(NC(=O)c3ccccc3OC)CC2)cc1	ZINC001144578619	1378747448	/nfs/dbraw/zinc/74/74/48/1378747448.db2.gz	IBCLBQRIIZQYEZ-UHFFFAOYSA-N	0	3	348.446	3.071	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cccc3ccsc32)s1	ZINC001146649563	1378888164	/nfs/dbraw/zinc/88/81/64/1378888164.db2.gz	PURGVJIAJGOXMP-UHFFFAOYSA-N	0	3	341.461	3.354	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2cc(OC)no2)CCCC1	ZINC001146823099	1378929046	/nfs/dbraw/zinc/92/90/46/1378929046.db2.gz	XZJIMCZWRWMRKQ-GJZGRUSLSA-N	0	3	349.475	3.193	20	30		EGEDHN
C=C(Br)CNC[C@@H](C1CC1)N(C)C(=O)c1ccccc1	ZINC001283481317	1378977052	/nfs/dbraw/zinc/97/70/52/1378977052.db2.gz	UVGRAOCENYRLJU-HNNXBMFYSA-N	0	3	337.261	3.035	20	30		EGEDHN
C[C@H](c1cccc(F)c1)N1CCC2(CN(C(=O)C#CC(C)(C)C)C2)C1	ZINC001147522643	1379036824	/nfs/dbraw/zinc/03/68/24/1379036824.db2.gz	DDEXXHCTSQFTPM-MRXNPFEDSA-N	0	3	342.458	3.471	20	30		EGEDHN
C#CCC1(C(=O)N2CC3(C2)CCN(C/C=C\c2ccccc2)C3)CCC1	ZINC001147710933	1379063497	/nfs/dbraw/zinc/06/34/97/1379063497.db2.gz	BVCFMLNXOLKIEE-POHAHGRESA-N	0	3	348.490	3.428	20	30		EGEDHN
CC1(C)CCC[C@H](CC(=O)NCCNCc2ccc(C#N)cc2)C1	ZINC001147857251	1379091008	/nfs/dbraw/zinc/09/10/08/1379091008.db2.gz	LYMXCRDDGLGITM-GOSISDBHSA-N	0	3	327.472	3.371	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N1CC2(C1)CCN(Cc1ccsc1)C2	ZINC001147991628	1379104263	/nfs/dbraw/zinc/10/42/63/1379104263.db2.gz	CULJAAOJPCIIJW-SFHVURJKSA-N	0	3	348.512	3.011	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)N1CC2(C1)CCN(Cc1sc(C)nc1C)C2	ZINC001148137977	1379123355	/nfs/dbraw/zinc/12/33/55/1379123355.db2.gz	KHUUJEFOZXEIHF-ZIAGYGMSSA-N	0	3	347.528	3.252	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC2(C1)CCN(Cc1ncccc1C)C2	ZINC001148146482	1379124439	/nfs/dbraw/zinc/12/44/39/1379124439.db2.gz	DRRYCLFKLCEECJ-KRWDZBQOSA-N	0	3	327.472	3.027	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H](c3ccccc3)[C@@H](C)CC)C2)C1	ZINC001148726428	1379254323	/nfs/dbraw/zinc/25/43/23/1379254323.db2.gz	HZXBEYXWYCAWAK-ICSRJNTNSA-N	0	3	338.495	3.374	20	30		EGEDHN
CCCCCCCCC(=O)NCCNC[C@H](O)c1ccccc1F	ZINC001148728053	1379254732	/nfs/dbraw/zinc/25/47/32/1379254732.db2.gz	SWQRCZZGHWPJQA-SFHVURJKSA-N	0	3	338.467	3.316	20	30		EGEDHN
CCCCCCCCCC(=O)NCCNCC(=O)NC(C)(C)CC	ZINC001148821028	1379277089	/nfs/dbraw/zinc/27/70/89/1379277089.db2.gz	RLFXBICRWYBQOY-UHFFFAOYSA-N	0	3	341.540	3.138	20	30		EGEDHN
C=CCCOCC(=O)N1CC2(C1)CCN([C@@H](C)c1ccccc1F)C2	ZINC001148874042	1379288717	/nfs/dbraw/zinc/28/87/17/1379288717.db2.gz	HOWYCSCCIYOHRC-INIZCTEOSA-N	0	3	346.446	3.014	20	30		EGEDHN
C=CCCOCC(=O)N1CC2(C1)CCN([C@@H](C)c1cccc(F)c1)C2	ZINC001148874184	1379289086	/nfs/dbraw/zinc/28/90/86/1379289086.db2.gz	LSBXDHZXHHSTMA-INIZCTEOSA-N	0	3	346.446	3.014	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N1CC2(C1)CCN([C@@H](C)c1ccc(F)cc1)C2	ZINC001148899867	1379293834	/nfs/dbraw/zinc/29/38/34/1379293834.db2.gz	IFGUQTQMJWLEAH-JKSUJKDBSA-N	0	3	346.446	3.012	20	30		EGEDHN
CN1CCC[C@@H]2CN(C(=O)c3ccc(C(C)(C)CCC#N)cc3)C[C@H]21	ZINC001148906683	1379296197	/nfs/dbraw/zinc/29/61/97/1379296197.db2.gz	WFAQKELQKQPBKQ-IEBWSBKVSA-N	0	3	339.483	3.434	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H]1CN(Cc2cc(C)cc(C)c2)CCCO1	ZINC001149789047	1379446649	/nfs/dbraw/zinc/44/66/49/1379446649.db2.gz	KXAMAIJNTYMZGJ-HXUWFJFHSA-N	0	3	344.499	3.367	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H]1CN(Cc2ccccc2C)CCCO1	ZINC001149797028	1379448650	/nfs/dbraw/zinc/44/86/50/1379448650.db2.gz	QBLYNCJPDQQUCY-LJQANCHMSA-N	0	3	330.472	3.058	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H]2CN(CC3=CCCCC3)CCCO2)CCC1	ZINC001150268278	1379525431	/nfs/dbraw/zinc/52/54/31/1379525431.db2.gz	TYYRELKFXQKWFH-LJQANCHMSA-N	0	3	346.515	3.440	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@H]2CN(CC3=CCCCC3)CCCO2)C1	ZINC001150299530	1379529717	/nfs/dbraw/zinc/52/97/17/1379529717.db2.gz	PGHGKFNXXFLGGD-SFHVURJKSA-N	0	3	332.488	3.050	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)C(C)(C)Cc2ccccc2)C1	ZINC001150553375	1379567438	/nfs/dbraw/zinc/56/74/38/1379567438.db2.gz	LARGZFSTLQNKGP-LJQANCHMSA-N	0	3	344.499	3.039	20	30		EGEDHN
C#CCCN1CCCO[C@H](CNC(=O)[C@@H](CCCCC)C(C)C)C1	ZINC001150562918	1379569353	/nfs/dbraw/zinc/56/93/53/1379569353.db2.gz	UDZHAYTUNWRIBD-MOPGFXCFSA-N	0	3	336.520	3.069	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)Cc2ccc(C)cc2)CC1	ZINC001151210877	1379677588	/nfs/dbraw/zinc/67/75/88/1379677588.db2.gz	YPFJKAPYSVEGHR-UHFFFAOYSA-N	0	3	344.499	3.101	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@H]2CC[C@H](C)CC2)CC1	ZINC001151402176	1379710914	/nfs/dbraw/zinc/71/09/14/1379710914.db2.gz	AMMUUMRFTPUFBS-IYARVYRRSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2cccc(Cl)c2)CC1	ZINC001151403510	1379711368	/nfs/dbraw/zinc/71/13/68/1379711368.db2.gz	XJWDZQLOZLHMBP-UHFFFAOYSA-N	0	3	336.863	3.127	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)CC1CCCC1	ZINC001151648525	1379756974	/nfs/dbraw/zinc/75/69/74/1379756974.db2.gz	NDHKCAGFFJUAGU-MRXNPFEDSA-N	0	3	327.472	3.465	20	30		EGEDHN
C=CCC1(C(=O)NCCNCc2ccc(C#N)c(F)c2)CCCCC1	ZINC001152010399	1379837433	/nfs/dbraw/zinc/83/74/33/1379837433.db2.gz	HDYJFGDYEPYBFR-UHFFFAOYSA-N	0	3	343.446	3.430	20	30		EGEDHN
CCN(Cc1cccc(C(F)(F)F)c1)[C@H](C)CNC(=O)[C@H](C)C#N	ZINC001152420328	1379931804	/nfs/dbraw/zinc/93/18/04/1379931804.db2.gz	PKPHBHNUJWYLAB-CHWSQXEVSA-N	0	3	341.377	3.192	20	30		EGEDHN
CC(C)(CC(=O)NCCNCc1cccc(C#N)c1)c1ccccc1	ZINC001152452142	1379936515	/nfs/dbraw/zinc/93/65/15/1379936515.db2.gz	UQSJBSBANPOZSE-UHFFFAOYSA-N	0	3	335.451	3.132	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)CC1CCC1	ZINC001152578166	1379952222	/nfs/dbraw/zinc/95/22/22/1379952222.db2.gz	FBPGJHPKFPWISU-CQSZACIVSA-N	0	3	331.435	3.214	20	30		EGEDHN
CC1=C(C)C[C@](C)(C(=O)NCCNCc2ccc(C#N)cc2)CC1	ZINC001152936272	1379996664	/nfs/dbraw/zinc/99/66/64/1379996664.db2.gz	REYNVFSPPFGZOQ-HXUWFJFHSA-N	0	3	325.456	3.291	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)NC[C@@H](C)N(CC)Cc1cc2ccccc2o1	ZINC001153012166	1380007576	/nfs/dbraw/zinc/00/75/76/1380007576.db2.gz	DZOSCCSIZJHEGA-QRWLVFNGSA-N	0	3	344.455	3.087	20	30		EGEDHN
CCN(Cc1cccc(OC)c1)[C@H](C)CNC(=O)C#CC(C)(C)C	ZINC001153281770	1380048810	/nfs/dbraw/zinc/04/88/10/1380048810.db2.gz	ZFPIWHHKXDLDKD-MRXNPFEDSA-N	0	3	330.472	3.071	20	30		EGEDHN
C#CC[C@H](CC(=O)NCCNCc1csc(C)c1)c1ccccc1	ZINC001153714490	1380117136	/nfs/dbraw/zinc/11/71/36/1380117136.db2.gz	NFUUXWMFJXPUML-LJQANCHMSA-N	0	3	340.492	3.460	20	30		EGEDHN
CN(C(=O)CC(C)(C)C)C1CC(NCc2ccc(C#N)cc2F)C1	ZINC001284740694	1380158956	/nfs/dbraw/zinc/15/89/56/1380158956.db2.gz	OBUILTXIUALKGK-UHFFFAOYSA-N	0	3	331.435	3.213	20	30		EGEDHN
C=C(Cl)CN(CC)[C@H](C)CNC(=O)c1n[nH]c2ccc(C)cc21	ZINC001154159200	1380218202	/nfs/dbraw/zinc/21/82/02/1380218202.db2.gz	URUYGNAXLHGJBW-CYBMUJFWSA-N	0	3	334.851	3.064	20	30		EGEDHN
C=C/C(C)=C/CC(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)cc1	ZINC001154677527	1380329776	/nfs/dbraw/zinc/32/97/76/1380329776.db2.gz	ROIHTBGQHSOMHY-DYFCPDHGSA-N	0	3	325.456	3.407	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)cc1	ZINC001154742380	1380344085	/nfs/dbraw/zinc/34/40/85/1380344085.db2.gz	FFRPFZUQUCMPKB-DLBZAZTESA-N	0	3	327.472	3.487	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1cc(F)c(Cl)cc1F	ZINC001154922248	1380376588	/nfs/dbraw/zinc/37/65/88/1380376588.db2.gz	WMZXQCKMOSJVHG-LLVKDONJSA-N	0	3	328.790	3.082	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H](C)N(CC)Cc1ccc2c(c1)OCCO2	ZINC001154957904	1380381103	/nfs/dbraw/zinc/38/11/03/1380381103.db2.gz	RQNVIWSECDVMCL-MRXNPFEDSA-N	0	3	346.471	3.141	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)c1ccc(Cl)[nH]1	ZINC001155090030	1380406518	/nfs/dbraw/zinc/40/65/18/1380406518.db2.gz	WJZAYOYHXKFJJC-CYBMUJFWSA-N	0	3	344.846	3.180	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@@H](C)CCc1ccccc1F	ZINC001155193171	1380422376	/nfs/dbraw/zinc/42/23/76/1380422376.db2.gz	GRPHNUFUUNDIHB-DLBZAZTESA-N	0	3	332.463	3.244	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NCCCNCc1cc(Cl)ccc1F	ZINC001155426584	1380451000	/nfs/dbraw/zinc/45/10/00/1380451000.db2.gz	GIUICXYYZOWPCR-ZDUSSCGKSA-N	0	3	342.842	3.056	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)c1cc(C)[nH]c1C	ZINC001155496724	1380460689	/nfs/dbraw/zinc/46/06/89/1380460689.db2.gz	LSUJVWQMLIZZPY-OAHLLOKOSA-N	0	3	338.455	3.144	20	30		EGEDHN
N#Cc1ccc(-c2ccncc2)nc1N[C@H]1CNCc2ccsc21	ZINC001155563287	1380469267	/nfs/dbraw/zinc/46/92/67/1380469267.db2.gz	ARGUYOYRWLQUPA-INIZCTEOSA-N	0	3	333.420	3.333	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)C[C@H](OCC)C1=CCCC1	ZINC001157965127	1381084004	/nfs/dbraw/zinc/08/40/04/1381084004.db2.gz	OXBPHNXTYQFDCN-MOPGFXCFSA-N	0	3	334.504	3.391	20	30		EGEDHN
C=C(Cl)Cn1c(C(C)C)nnc1N1C[C@H](C)N(CC)C[C@@H]1C	ZINC001286620520	1381122418	/nfs/dbraw/zinc/12/24/18/1381122418.db2.gz	NOCVJAHTRSWYNI-KBPBESRZSA-N	0	3	325.888	3.073	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc2c(c1)C(C)(C)CO2	ZINC001158212263	1381161009	/nfs/dbraw/zinc/16/10/09/1381161009.db2.gz	HFRYYBSCYFYZIV-QGZVFWFLSA-N	0	3	342.483	3.469	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H](C)OCc1ccccc1C	ZINC001158283845	1381185137	/nfs/dbraw/zinc/18/51/37/1381185137.db2.gz	UTTRBLSFZPKAJO-UYAOXDASSA-N	0	3	344.499	3.399	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)C[C@H]1CC=CCC1	ZINC001158316749	1381198357	/nfs/dbraw/zinc/19/83/57/1381198357.db2.gz	QHCRWBLJRMPKFD-RBUKOAKNSA-N	0	3	334.504	3.248	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1CCCC1(C)C	ZINC001158322315	1381200393	/nfs/dbraw/zinc/20/03/93/1381200393.db2.gz	YLAOVEFXSITIBE-MSOLQXFVSA-N	0	3	336.520	3.328	20	30		EGEDHN
CN1CCC(N(Cc2ccc(F)cc2)c2nccc(C#N)c2F)CC1	ZINC001158448963	1381249861	/nfs/dbraw/zinc/24/98/61/1381249861.db2.gz	KBTJMIQAQFEKBY-UHFFFAOYSA-N	0	3	342.393	3.332	20	30		EGEDHN
CN1CCC(N(c2nc(Cl)c(C#N)cc2C#N)C2CCCC2)CC1	ZINC001158488339	1381264944	/nfs/dbraw/zinc/26/49/44/1381264944.db2.gz	UFAOIMTWLMARNA-UHFFFAOYSA-N	0	3	343.862	3.322	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1csc(C)c1	ZINC001158604968	1381316391	/nfs/dbraw/zinc/31/63/91/1381316391.db2.gz	HEGRZOCKDXGEPN-QGZVFWFLSA-N	0	3	336.501	3.186	20	30		EGEDHN
C[C@H]1CCC[C@H]1CC(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001158619079	1381324432	/nfs/dbraw/zinc/32/44/32/1381324432.db2.gz	SIDOAPILYWFHAC-HOCLYGCPSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H](C)n1cnc2ccccc21	ZINC001158709122	1381362597	/nfs/dbraw/zinc/36/25/97/1381362597.db2.gz	JUWQHPCHMGSVDG-IAGOWNOFSA-N	0	3	340.471	3.096	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)C[C@H]1OCCc2ccsc21	ZINC001158764348	1381388632	/nfs/dbraw/zinc/38/86/32/1381388632.db2.gz	QNWJVWNVLUEWSZ-IAGOWNOFSA-N	0	3	348.512	3.251	20	30		EGEDHN
C=C(C)CCC(=O)NCCCNCC(=O)Nc1cccc(C(C)C)c1	ZINC001159032477	1381524750	/nfs/dbraw/zinc/52/47/50/1381524750.db2.gz	HXSUXWUSWDGRLC-UHFFFAOYSA-N	0	3	345.487	3.201	20	30		EGEDHN
C=CCCC(=O)NCCC1=CCN(CCOc2ccccc2)CC1	ZINC001159538900	1381821749	/nfs/dbraw/zinc/82/17/49/1381821749.db2.gz	QYDFXRBLKAWDDW-UHFFFAOYSA-N	0	3	328.456	3.170	20	30		EGEDHN
C=CCOCC(=O)NCCC1=CCN(CCCCC(F)(F)F)CC1	ZINC001159576066	1381834689	/nfs/dbraw/zinc/83/46/89/1381834689.db2.gz	KVCLVKPOBXKDNI-UHFFFAOYSA-N	0	3	348.409	3.060	20	30		EGEDHN
C#CCC1(C(=O)NCCCNCc2nsc3ccccc32)CCC1	ZINC001159643937	1381857189	/nfs/dbraw/zinc/85/71/89/1381857189.db2.gz	ALKPNRJVWUUZCM-UHFFFAOYSA-N	0	3	341.480	3.086	20	30		EGEDHN
C#CCC1(C(=O)NCCCN[C@H](C)c2c(F)cccc2F)CCC1	ZINC001159663859	1381862831	/nfs/dbraw/zinc/86/28/31/1381862831.db2.gz	BTVNGHXTYKIUKV-CQSZACIVSA-N	0	3	334.410	3.315	20	30		EGEDHN
Cc1cc(CN2CC=C(CCNC(=O)C#CC3CC3)CC2)cs1	ZINC001160081136	1381991286	/nfs/dbraw/zinc/99/12/86/1381991286.db2.gz	HDYXOQNUBKGJCH-UHFFFAOYSA-N	0	3	328.481	3.108	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ocnc2-c2ccccc2)CC1	ZINC001160337757	1382076138	/nfs/dbraw/zinc/07/61/38/1382076138.db2.gz	UPYYXGVFWOVUAL-UHFFFAOYSA-N	0	3	349.434	3.117	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc(F)c(C)cc2F)CC1	ZINC001160444666	1382104747	/nfs/dbraw/zinc/10/47/47/1382104747.db2.gz	IRNNWOOLMURKQJ-UHFFFAOYSA-N	0	3	332.394	3.049	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)Cc2cccc(C)c2Cl)CC1	ZINC001160657862	1382161630	/nfs/dbraw/zinc/16/16/30/1382161630.db2.gz	NXBMHFBGOKKSKM-UHFFFAOYSA-N	0	3	344.886	3.353	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCC1=CCN(CCOCC(C)C)CC1	ZINC001160941774	1382244960	/nfs/dbraw/zinc/24/49/60/1382244960.db2.gz	PKLSHZPEYOQTGQ-ZWKOTPCHSA-N	0	3	336.520	3.256	20	30		EGEDHN
C=CCN1CCC[C@H]1CNc1ccc(-c2c(F)cccc2F)nn1	ZINC001160957484	1382251351	/nfs/dbraw/zinc/25/13/51/1382251351.db2.gz	LYCRSJHXOZUWFY-ZDUSSCGKSA-N	0	3	330.382	3.484	20	30		EGEDHN
C=CCCCC(=O)NCCC1=CCN(CCc2ccns2)CC1	ZINC001161063596	1382288039	/nfs/dbraw/zinc/28/80/39/1382288039.db2.gz	XMGJCOGKUWEOID-UHFFFAOYSA-N	0	3	333.501	3.180	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCC1=CCN(CCc2ccns2)CC1	ZINC001161121223	1382308144	/nfs/dbraw/zinc/30/81/44/1382308144.db2.gz	CVVUVNRMGBJJLS-LJQANCHMSA-N	0	3	347.528	3.426	20	30		EGEDHN
C=CCOc1ccc(C(=O)NCCCNCc2ccccc2C#N)cc1	ZINC001161156509	1382318994	/nfs/dbraw/zinc/31/89/94/1382318994.db2.gz	PVHPPUQQPKZPEQ-UHFFFAOYSA-N	0	3	349.434	3.033	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)Cc2csc(C(C)(C)C)n2)CC1	ZINC001161477225	1382418677	/nfs/dbraw/zinc/41/86/77/1382418677.db2.gz	CHAFMDMVGVVICE-UHFFFAOYSA-N	0	3	347.528	3.308	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ncc(Cl)cc2Cl)CC1	ZINC001161548422	1382436914	/nfs/dbraw/zinc/43/69/14/1382436914.db2.gz	QDYKVUXVXZPKQQ-UHFFFAOYSA-N	0	3	340.254	3.326	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cccc(N3CCCC3)c2)CC1	ZINC001161554731	1382438631	/nfs/dbraw/zinc/43/86/31/1382438631.db2.gz	QVDQGXYSEPZAOY-UHFFFAOYSA-N	0	3	339.483	3.225	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C[C@@H]2CCC3(CCC3)CO2)CC1	ZINC001161763414	1382498499	/nfs/dbraw/zinc/49/84/99/1382498499.db2.gz	QTBVOKMXXGKJGW-SFHVURJKSA-N	0	3	332.488	3.050	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1cc(F)ccc1CC	ZINC001161800144	1382509853	/nfs/dbraw/zinc/50/98/53/1382509853.db2.gz	LEYXMKLTEWEIKO-UHFFFAOYSA-N	0	3	343.240	3.006	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc(Cl)cc3c2OCC3)CC1	ZINC001161963586	1382574095	/nfs/dbraw/zinc/57/40/95/1382574095.db2.gz	LXGLPFZLBYVUEO-UHFFFAOYSA-N	0	3	346.858	3.213	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C2(c3ccccc3C)CC2)CC1	ZINC001161998466	1382593767	/nfs/dbraw/zinc/59/37/67/1382593767.db2.gz	YSHVQELAILPDAT-UHFFFAOYSA-N	0	3	336.479	3.188	20	30		EGEDHN
CC(C)N1CCN(Cc2ccc(NCC3(C#N)CCC3)c(F)c2)CC1	ZINC001162416651	1382751761	/nfs/dbraw/zinc/75/17/61/1382751761.db2.gz	BSKOLJIBPZRRGE-UHFFFAOYSA-N	0	3	344.478	3.457	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)CCC2CCCCC2)(COC)CC1	ZINC001162595047	1382802650	/nfs/dbraw/zinc/80/26/50/1382802650.db2.gz	MJOLOJCRCCXUPE-UHFFFAOYSA-N	0	3	348.531	3.215	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)c1ccc(CC)o1	ZINC001162841143	1382891835	/nfs/dbraw/zinc/89/18/35/1382891835.db2.gz	NREFNLZGVVCSLK-UHFFFAOYSA-N	0	3	338.451	3.140	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H](C)C(CC)CC	ZINC001162851822	1382895350	/nfs/dbraw/zinc/89/53/50/1382895350.db2.gz	XKVHGAALYATCQH-SFHVURJKSA-N	0	3	328.500	3.353	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CCCC1(C)C	ZINC001162892794	1382907739	/nfs/dbraw/zinc/90/77/39/1382907739.db2.gz	VTMNQRHYZWWBCE-IBGZPJMESA-N	0	3	326.484	3.107	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C1(CCCC)CC1	ZINC001162918446	1382916149	/nfs/dbraw/zinc/91/61/49/1382916149.db2.gz	DYYURUJENDCVQX-UHFFFAOYSA-N	0	3	326.484	3.251	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H](C)c1ccsc1	ZINC001162929212	1382919196	/nfs/dbraw/zinc/91/91/96/1382919196.db2.gz	SPSLJWBKMOYMPA-KRWDZBQOSA-N	0	3	340.492	3.146	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@H]1C[C@]1(C)C(C)C	ZINC001162970749	1382932135	/nfs/dbraw/zinc/93/21/35/1382932135.db2.gz	JPKFTJVUJUUMGX-IFMALSPDSA-N	0	3	340.511	3.353	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1C[C@@]1(C)CC	ZINC001162971164	1382933060	/nfs/dbraw/zinc/93/30/60/1382933060.db2.gz	ZIROAZUOUUTCSK-PZJWPPBQSA-N	0	3	326.484	3.107	20	30		EGEDHN
CC(C)C(=O)NCCC1(CNCC#Cc2cccc(Cl)c2)CC1	ZINC001163458668	1383055815	/nfs/dbraw/zinc/05/58/15/1383055815.db2.gz	VALGGSSPXXVNSX-UHFFFAOYSA-N	0	3	332.875	3.224	20	30		EGEDHN
CCC[C@H](C)C(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001163840667	1383127840	/nfs/dbraw/zinc/12/78/40/1383127840.db2.gz	JCUCGEXIPQAJGZ-INIZCTEOSA-N	0	3	327.472	3.371	20	30		EGEDHN
C#CCCCCC(=O)NCCC1(CNCc2oc(CC)nc2C)CC1	ZINC001164179063	1383163526	/nfs/dbraw/zinc/16/35/26/1383163526.db2.gz	VCNSBXOTOARRLG-UHFFFAOYSA-N	0	3	345.487	3.115	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCC1(CN[C@@H](C)c2cnccn2)CC1	ZINC001165221382	1383252535	/nfs/dbraw/zinc/25/25/35/1383252535.db2.gz	XLONFRFXXRWBEH-HNNXBMFYSA-N	0	3	330.476	3.016	20	30		EGEDHN
C=C(C)CCC(=O)NCCC1(CNCc2c(C)noc2CC)CC1	ZINC001165265597	1383261931	/nfs/dbraw/zinc/26/19/31/1383261931.db2.gz	DEOWRAWBYQPZMT-UHFFFAOYSA-N	0	3	333.476	3.278	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)CCc2ccsc2)CC1	ZINC001165492514	1383303343	/nfs/dbraw/zinc/30/33/43/1383303343.db2.gz	SAJVLVFVEFCVNV-UHFFFAOYSA-N	0	3	326.893	3.309	20	30		EGEDHN
C[C@@H](C(=O)NCCCNCc1cc(C#N)ccc1F)c1cccs1	ZINC001166511573	1383431729	/nfs/dbraw/zinc/43/17/29/1383431729.db2.gz	ZAERYAGTPSAIOB-CYBMUJFWSA-N	0	3	345.443	3.158	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCCC1(CNCc2c(C)noc2C)CC1	ZINC001166747293	1383470455	/nfs/dbraw/zinc/47/04/55/1383470455.db2.gz	MGJZDYLNUMTUDU-CQSZACIVSA-N	0	3	333.476	3.270	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)C(C)(C)C2CC2)CC1	ZINC001166770229	1383475379	/nfs/dbraw/zinc/47/53/79/1383475379.db2.gz	OCOKUWCPYPCBJR-UHFFFAOYSA-N	0	3	343.309	3.207	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)C(C)(C)CC)CC1	ZINC001166935396	1383501973	/nfs/dbraw/zinc/50/19/73/1383501973.db2.gz	PVMXXVTZVSWCPA-UHFFFAOYSA-N	0	3	331.298	3.207	20	30		EGEDHN
C[C@@H]1C[C@@H]1CC(=O)NCCC1(CNCc2cc(C#N)ccc2F)CC1	ZINC001167011065	1383516630	/nfs/dbraw/zinc/51/66/30/1383516630.db2.gz	AAVXSGIQFCBPRY-GDBMZVCRSA-N	0	3	343.446	3.120	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCC1(CNCc2cc(OC)ccn2)CC1	ZINC001167026258	1383522401	/nfs/dbraw/zinc/52/24/01/1383522401.db2.gz	XICBLMHDWVFICW-IBGZPJMESA-N	0	3	345.487	3.069	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@@H]2CCCC(F)(F)C2)CC1	ZINC001167188611	1383561381	/nfs/dbraw/zinc/56/13/81/1383561381.db2.gz	VRDPOVYNDLASED-CYBMUJFWSA-N	0	3	334.838	3.441	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1ccc(Cl)c(F)c1	ZINC001167266746	1383580120	/nfs/dbraw/zinc/58/01/20/1383580120.db2.gz	QVRFSDHTMCUJJB-UHFFFAOYSA-N	0	3	345.805	3.260	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCCNCc1ccn(C2CCCC2)n1	ZINC001167362819	1383610331	/nfs/dbraw/zinc/61/03/31/1383610331.db2.gz	BSGUPCQYDGDRNR-UHFFFAOYSA-N	0	3	332.492	3.196	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cc3ccccn3c2)CC1	ZINC001167381993	1383617624	/nfs/dbraw/zinc/61/76/24/1383617624.db2.gz	QBIMLACIVYGKCU-UHFFFAOYSA-N	0	3	331.847	3.182	20	30		EGEDHN
C[C@@H]1CC[C@@H](C(=O)NCCC2(CNCc3ccccc3C#N)CC2)C1	ZINC001167382406	1383617704	/nfs/dbraw/zinc/61/77/04/1383617704.db2.gz	UUIPZHGZQCJPBC-IAGOWNOFSA-N	0	3	339.483	3.371	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@@H](C)c1cccc(C)c1	ZINC001167410110	1383626443	/nfs/dbraw/zinc/62/64/43/1383626443.db2.gz	ZHGLEDIJYPKEEM-AWEZNQCLSA-N	0	3	339.277	3.103	20	30		EGEDHN
CC[C@H](Cc1ccccc1)C(=O)NCCCNCc1ccccc1C#N	ZINC001167488706	1383649308	/nfs/dbraw/zinc/64/93/08/1383649308.db2.gz	HTTCGDLTAOZTTE-LJQANCHMSA-N	0	3	349.478	3.423	20	30		EGEDHN
C[C@H](CC(C)(C)C)C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001167665052	1383705004	/nfs/dbraw/zinc/70/50/04/1383705004.db2.gz	XFPSOEQRIFLASG-CQSZACIVSA-N	0	3	333.451	3.366	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc(C(F)F)o2)CC1	ZINC001167916301	1383769254	/nfs/dbraw/zinc/76/92/54/1383769254.db2.gz	MWBYQUWJSNCMMY-UHFFFAOYSA-N	0	3	332.778	3.459	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)CCc2ccccc2F)CC1	ZINC001168097141	1383816138	/nfs/dbraw/zinc/81/61/38/1383816138.db2.gz	ZWYYPJQSGHIRCK-UHFFFAOYSA-N	0	3	338.854	3.387	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cncc3ccccc32)CC1	ZINC001168297280	1383866467	/nfs/dbraw/zinc/86/64/67/1383866467.db2.gz	LUTZJQUSDAEEAP-UHFFFAOYSA-N	0	3	343.858	3.477	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@H]2Oc3ccccc3[C@H]2C)CC1	ZINC001168530093	1383930578	/nfs/dbraw/zinc/93/05/78/1383930578.db2.gz	IHJOMCAZBRSGKZ-PBHICJAKSA-N	0	3	348.874	3.180	20	30		EGEDHN
C[C@@H](CCCCNCc1cc(F)ccc1C#N)NC(=O)C(C)(C)F	ZINC001168759820	1383994892	/nfs/dbraw/zinc/99/48/92/1383994892.db2.gz	QOERXCWOZIGGLJ-ZDUSSCGKSA-N	0	3	337.414	3.210	20	30		EGEDHN
CCC1(CC)[C@H](NCc2cccc(C(=O)OC)c2C#N)[C@@H](C)[C@H]1OC	ZINC001307745411	1384023986	/nfs/dbraw/zinc/02/39/86/1384023986.db2.gz	PHMYJHBNSUKXEC-FSPWUOQZSA-N	0	3	344.455	3.274	20	30		EGEDHN
CSCCC(=O)N[C@@H](C)CCCCNCc1ccccc1C#N	ZINC001169046181	1384100129	/nfs/dbraw/zinc/10/01/29/1384100129.db2.gz	WWTNKNNIHBXXPZ-HNNXBMFYSA-N	0	3	333.501	3.076	20	30		EGEDHN
CC(C)C[C@@H](Cc1ccccc1)N1CCN(c2nccnc2C#N)CC1	ZINC001169079168	1384103984	/nfs/dbraw/zinc/10/39/84/1384103984.db2.gz	QFGBDIKEBFURKI-IBGZPJMESA-N	0	3	349.482	3.128	20	30		EGEDHN
CCC(CC)n1ccc(CNCCCC[C@H](C)NC(=O)[C@H](C)C#N)n1	ZINC001169849447	1384191207	/nfs/dbraw/zinc/19/12/07/1384191207.db2.gz	WQCDPVAWSULHAJ-CVEARBPZSA-N	0	3	347.507	3.168	20	30		EGEDHN
C[C@H](CCCCNCc1cc(F)ccc1C#N)NC(=O)/C=C/C1CC1	ZINC001169981537	1384209821	/nfs/dbraw/zinc/20/98/21/1384209821.db2.gz	GDBSRQWFMZVERS-JOZWUWCOSA-N	0	3	343.446	3.428	20	30		EGEDHN
COc1ccc(C[C@@H](C)NCc2ccccc2C#N)c([N+](=O)[O-])c1	ZINC001170310006	1384287712	/nfs/dbraw/zinc/28/77/12/1384287712.db2.gz	VNCDXOZOTZTWCK-CYBMUJFWSA-N	0	3	325.368	3.196	20	30		EGEDHN
C#CCCCC(=O)N[C@@H](C)CCCCNCc1nc2ccccc2o1	ZINC001170425807	1384315685	/nfs/dbraw/zinc/31/56/85/1384315685.db2.gz	QXUQQQOQNVWQDM-INIZCTEOSA-N	0	3	341.455	3.396	20	30		EGEDHN
C[C@@H](CCCCNCc1c(F)cccc1F)NC(=O)C#CC1CC1	ZINC001170673685	1384361774	/nfs/dbraw/zinc/36/17/74/1384361774.db2.gz	IBEREGROJBCNDK-AWEZNQCLSA-N	0	3	334.410	3.143	20	30		EGEDHN
CC(C)C[C@@H](C)CC(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001170828424	1384393540	/nfs/dbraw/zinc/39/35/40/1384393540.db2.gz	BSRFTLBZSBAUJT-OAHLLOKOSA-N	0	3	333.451	3.366	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H](C)CCCCNCc1cc(C)n(C)n1	ZINC001171007024	1384428393	/nfs/dbraw/zinc/42/83/93/1384428393.db2.gz	CYJAVFXIJJBMBU-HNNXBMFYSA-N	0	3	334.508	3.095	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)n1nc(C(F)(F)F)c2c1CNCC2	ZINC001171228466	1384474365	/nfs/dbraw/zinc/47/43/65/1384474365.db2.gz	GSRCVCVWGYGBPK-LLVKDONJSA-N	0	3	334.345	3.223	20	30		EGEDHN
CC1(CCC(=O)NC[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)CC1	ZINC001316638577	1384498667	/nfs/dbraw/zinc/49/86/67/1384498667.db2.gz	CFKLGQJIOVXNGF-JCNLHEQBSA-N	0	3	343.446	3.262	20	30		EGEDHN
CCCCCCCCC(=O)NCCCNCc1snnc1C	ZINC001171818549	1384650256	/nfs/dbraw/zinc/65/02/56/1384650256.db2.gz	PSVKGRJENQKBHJ-UHFFFAOYSA-N	0	3	326.510	3.193	20	30		EGEDHN
C=CCN1CCN([C@@H]2C[C@H]3CCC[C@@H](C2)N3C(=O)OC(C)(C)C)CC1	ZINC001172095272	1384726392	/nfs/dbraw/zinc/72/63/92/1384726392.db2.gz	PEDPMLNFXXQOIM-BCDXTJNWSA-N	0	3	349.519	3.111	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)N1C[C@@H]2CN(C(=O)OC(C)(C)C)[C@@H]2C1	ZINC001172312598	1384767212	/nfs/dbraw/zinc/76/72/12/1384767212.db2.gz	HLJOXGPVZOYBOY-ZTFGCOKTSA-N	0	3	341.455	3.040	20	30		EGEDHN
C[C@H](CCCC#N)N1CCC(c2ccc(S(C)(=O)=O)cc2)CC1	ZINC001172506549	1384806548	/nfs/dbraw/zinc/80/65/48/1384806548.db2.gz	WANMMWREPBRBCT-OAHLLOKOSA-N	0	3	334.485	3.352	20	30		EGEDHN
CC[C@H](C)[C@H](N[C@@H](C)CSc1ccc(Cl)cc1)C(=O)NO	ZINC001172879270	1384871648	/nfs/dbraw/zinc/87/16/48/1384871648.db2.gz	XWXKRXABZOUMHU-MJVIPROJSA-N	0	3	330.881	3.330	20	30		EGEDHN
C[C@H]1CC[C@@H](NCC#Cc2ccccc2)CN1C(=O)OC(C)(C)C	ZINC001173061767	1384904122	/nfs/dbraw/zinc/90/41/22/1384904122.db2.gz	GWPXPKUZCHSACI-FUHWJXTLSA-N	0	3	328.456	3.416	20	30		EGEDHN
C=CCOC[C@H]1c2c(ncn2C)CCN1C1CCC(OCC=C)CC1	ZINC001173321262	1384958037	/nfs/dbraw/zinc/95/80/37/1384958037.db2.gz	ZHTBPJFZEFQPMP-TVPLGVNVSA-N	0	3	345.487	3.036	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)CCCCNCc2ccn(CC)n2)CCC1	ZINC001175096700	1385193836	/nfs/dbraw/zinc/19/38/36/1385193836.db2.gz	ADOABZHMDDMIDX-QGZVFWFLSA-N	0	3	346.519	3.414	20	30		EGEDHN
C[C@H](CC(=O)NCCCNCc1ccccc1C#N)c1ccccc1	ZINC001175318367	1385251612	/nfs/dbraw/zinc/25/16/12/1385251612.db2.gz	XPOVCOGDLDSECR-QGZVFWFLSA-N	0	3	335.451	3.348	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H](C)CCCCN[C@@H](C)c1nnc(C)[nH]1	ZINC001175468191	1385300659	/nfs/dbraw/zinc/30/06/59/1385300659.db2.gz	CYRUSWQIGLZCFX-KBPBESRZSA-N	0	3	335.496	3.041	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@H](CCNC(=O)C2CCCCC2)C1	ZINC001317773657	1385466144	/nfs/dbraw/zinc/46/61/44/1385466144.db2.gz	SWTFDGYBZMRDBW-KRWDZBQOSA-N	0	3	339.483	3.467	20	30		EGEDHN
C[C@@H](Cc1ccccc1)C(=O)NCCCNCc1ccccc1C#N	ZINC001176681421	1385657869	/nfs/dbraw/zinc/65/78/69/1385657869.db2.gz	GWBCUZTXOOLDJI-KRWDZBQOSA-N	0	3	335.451	3.033	20	30		EGEDHN
C=C[C@H](C(=O)NCCCNCc1cc(C2CC2)no1)c1ccccc1	ZINC001176781446	1385695153	/nfs/dbraw/zinc/69/51/53/1385695153.db2.gz	DFQSRMYPWKGJQH-SFHVURJKSA-N	0	3	339.439	3.118	20	30		EGEDHN
C=CCC1(C(=O)NCCCN[C@@H](C)c2cnccn2)CCCCC1	ZINC001176790686	1385700314	/nfs/dbraw/zinc/70/03/14/1385700314.db2.gz	QHUJPNDVOHKBAP-INIZCTEOSA-N	0	3	330.476	3.160	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)CCCCNCc2nnc(C)[nH]2)CCCC1	ZINC001176853697	1385724778	/nfs/dbraw/zinc/72/47/78/1385724778.db2.gz	FHAAUBPROCZQJI-OAHLLOKOSA-N	0	3	347.507	3.014	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1cncc2ccccc21	ZINC001176875513	1385729934	/nfs/dbraw/zinc/72/99/34/1385729934.db2.gz	CYFMRAPFVRMEHT-UHFFFAOYSA-N	0	3	344.418	3.016	20	30		EGEDHN
CC[C@H](CNC(=O)C1(C)CCCC1)NCc1cc(C#N)ccc1OC	ZINC001318559348	1385756390	/nfs/dbraw/zinc/75/63/90/1385756390.db2.gz	VKCBMAGTGCUJGY-QGZVFWFLSA-N	0	3	343.471	3.132	20	30		EGEDHN
C=C(Br)CNCC1(NC(=O)C(CC)CC)CCCC1	ZINC001318616632	1385798409	/nfs/dbraw/zinc/79/84/09/1385798409.db2.gz	HZAGHOGGXKEVKT-UHFFFAOYSA-N	0	3	331.298	3.350	20	30		EGEDHN
C[C@H]1CC(C(=O)NCCCNCc2ccccc2C#N)C[C@H](C)C1	ZINC001177136502	1385829320	/nfs/dbraw/zinc/82/93/20/1385829320.db2.gz	OGUCPCRGEDFDPA-HZPDHXFCSA-N	0	3	327.472	3.226	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@H]1CCCC(C)(C)C1	ZINC001177156099	1385837509	/nfs/dbraw/zinc/83/75/09/1385837509.db2.gz	SRBYURQIOZNVDK-ZDUSSCGKSA-N	0	3	331.298	3.207	20	30		EGEDHN
C#CCC1(C(=O)NCCCNCc2oc(CC)nc2C)CCCCC1	ZINC001177223695	1385874437	/nfs/dbraw/zinc/87/44/37/1385874437.db2.gz	CHDLZYGOPWDUCU-UHFFFAOYSA-N	0	3	345.487	3.115	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)C[C@H]1CCCO1	ZINC001177232178	1385876849	/nfs/dbraw/zinc/87/68/49/1385876849.db2.gz	KEOOQRKTTBSIBG-QGZVFWFLSA-N	0	3	342.911	3.307	20	30		EGEDHN
N#Cc1ccccc1CNCCCCCCNC(=O)c1ccncc1	ZINC001177754538	1386034739	/nfs/dbraw/zinc/03/47/39/1386034739.db2.gz	OXLMEAFNBVDPOP-UHFFFAOYSA-N	0	3	336.439	3.033	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@H](NCC#Cc2ccccc2Cl)[C@@H]1C	ZINC001178054568	1386117879	/nfs/dbraw/zinc/11/78/79/1386117879.db2.gz	LGGPMVAJVPIIKZ-YJBOKZPZSA-N	0	3	330.859	3.237	20	30		EGEDHN
CC(C)(C)OCC(=O)NCCCCCCNCc1ccccc1C#N	ZINC001178258210	1386175201	/nfs/dbraw/zinc/17/52/01/1386175201.db2.gz	YLPNELQRARKDLN-UHFFFAOYSA-N	0	3	345.487	3.140	20	30		EGEDHN
C[C@H]1[C@@H](NCc2ccc(C#N)s2)CCN1C(=O)/C=C\C(C)(C)C	ZINC001178378766	1386202357	/nfs/dbraw/zinc/20/23/57/1386202357.db2.gz	HZVKWKOAMMITKI-WOLLIAJRSA-N	0	3	331.485	3.301	20	30		EGEDHN
C[C@H]1[C@@H](NCc2ccc(C#N)c(F)c2)CCN1C(=O)/C=C/C(C)(C)C	ZINC001178379329	1386202528	/nfs/dbraw/zinc/20/25/28/1386202528.db2.gz	RFPZXQFCFPXDCL-YEZCYVOASA-N	0	3	343.446	3.379	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2Cl)CCN1C(=O)C1CC=CC1	ZINC001178400997	1386206453	/nfs/dbraw/zinc/20/64/53/1386206453.db2.gz	DRSILPGOVYHMSF-KXBFYZLASA-N	0	3	342.870	3.237	20	30		EGEDHN
CCCC[C@@H](C)C(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C	ZINC001178605172	1386261025	/nfs/dbraw/zinc/26/10/25/1386261025.db2.gz	HMULLVHVAVADSV-HBFSDRIKSA-N	0	3	326.484	3.443	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)CC(C)(C)C1CC1	ZINC001178627621	1386264670	/nfs/dbraw/zinc/26/46/70/1386264670.db2.gz	IPRSPHNZCHTJGM-PXNSSMCTSA-N	0	3	338.495	3.443	20	30		EGEDHN
C#CCC1(C(=O)NCCCCCCNCc2ncc(C)s2)CCC1	ZINC001178672711	1386274740	/nfs/dbraw/zinc/27/47/40/1386274740.db2.gz	WBEKLFFEVDWISU-UHFFFAOYSA-N	0	3	347.528	3.411	20	30		EGEDHN
CC1(C)CCC[C@@]1(O)CNCc1cc(C#N)ccc1Br	ZINC001178795266	1386307176	/nfs/dbraw/zinc/30/71/76/1386307176.db2.gz	JFZFBAXWGXTKIW-MRXNPFEDSA-N	0	3	337.261	3.352	20	30		EGEDHN
C#CCCCCCC(=O)NCCCCCCNCc1cc(OC)no1	ZINC001179240036	1386429748	/nfs/dbraw/zinc/42/97/48/1386429748.db2.gz	SLTLAXFMPZTOSM-UHFFFAOYSA-N	0	3	349.475	3.033	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)[C@@H]1CCCC1(C)C	ZINC001179337820	1386455171	/nfs/dbraw/zinc/45/51/71/1386455171.db2.gz	YRTFVMLVTBQYAX-IHPCNDPISA-N	0	3	338.495	3.443	20	30		EGEDHN
Cc1cccc(CC(=O)N2CC[C@H](NCC#Cc3ccccc3)[C@@H]2C)c1	ZINC001179446432	1386484195	/nfs/dbraw/zinc/48/41/95/1386484195.db2.gz	MYZQLITVXJSOLP-UGKGYDQZSA-N	0	3	346.474	3.168	20	30		EGEDHN
C[C@H]1C[C@H]1CC(=O)NCCCCCCNCc1ccccc1C#N	ZINC001179474225	1386491600	/nfs/dbraw/zinc/49/16/00/1386491600.db2.gz	CVNIDVDLCONNIE-LPHOPBHVSA-N	0	3	327.472	3.371	20	30		EGEDHN
C=CCC1(C(=O)NCCCCCCNCc2nccn2CC)CCC1	ZINC001179487468	1386496299	/nfs/dbraw/zinc/49/62/99/1386496299.db2.gz	IHHOWULUXWTFIN-UHFFFAOYSA-N	0	3	346.519	3.416	20	30		EGEDHN
C=C(C)CN1CCC(NC(=S)Nc2cccc(F)c2F)CC1	ZINC001320123783	1386526354	/nfs/dbraw/zinc/52/63/54/1386526354.db2.gz	RMLTYXLTPJJWEO-UHFFFAOYSA-N	0	3	325.428	3.292	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)NCCCCCCNC/C(Cl)=C\Cl	ZINC001179633716	1386537318	/nfs/dbraw/zinc/53/73/18/1386537318.db2.gz	JDTLLFDTKVFPEH-URQVRESPSA-N	0	3	349.302	3.163	20	30		EGEDHN
CC(C)C[C@H](C)C(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C	ZINC001179794948	1386589583	/nfs/dbraw/zinc/58/95/83/1386589583.db2.gz	XGPIDCCZPVYCAA-BJLQDIEVSA-N	0	3	326.484	3.299	20	30		EGEDHN
C=CCSCC(=O)N(C)[C@H]1CN(Cc2ccccc2)CC[C@@H]1C	ZINC001180559931	1386835519	/nfs/dbraw/zinc/83/55/19/1386835519.db2.gz	MWBWHTUXXNGGFZ-WMZOPIPTSA-N	0	3	332.513	3.275	20	30		EGEDHN
C[C@@H](C(=O)N1C[C@@H](C)[C@](C)(CNCc2ccccc2C#N)C1)C1CC1	ZINC001181036492	1386922051	/nfs/dbraw/zinc/92/20/51/1386922051.db2.gz	BJNPLAALYKKRJX-WHSLLNHNSA-N	0	3	339.483	3.179	20	30		EGEDHN
C/C=C(\C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2cc(F)ccc2C#N)C1	ZINC001181050070	1386925233	/nfs/dbraw/zinc/92/52/33/1386925233.db2.gz	YKAONIXVTQXHRP-XOWKGIQBSA-N	0	3	343.446	3.238	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@@H](C)[C@](C)(CNC/C(Cl)=C/Cl)C1	ZINC001181460677	1386997894	/nfs/dbraw/zinc/99/78/94/1386997894.db2.gz	RDGRDBNPHJKLCZ-CYWBZOCISA-N	0	3	331.287	3.039	20	30		EGEDHN
COc1ccc(C(C)C)cc1CN[C@@H]1CCN(C(=O)C#CC(C)C)C1	ZINC001182431974	1387165077	/nfs/dbraw/zinc/16/50/77/1387165077.db2.gz	MPJMFZIKYFMWHZ-LJQANCHMSA-N	0	3	342.483	3.169	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1c(C)noc1C(F)F	ZINC001329303755	1389056092	/nfs/dbraw/zinc/05/60/92/1389056092.db2.gz	RICIMAVJLZGMHV-UHFFFAOYSA-N	0	3	349.809	3.361	20	30		EGEDHN
C=CCC1(C(=O)N2CCC[C@@H]2CNCC#Cc2ccccc2)CCC1	ZINC001698732283	1406382024	/nfs/dbraw/zinc/38/20/24/1406382024.db2.gz	ALGSUWQAMIXPHA-HXUWFJFHSA-N	0	3	336.479	3.365	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N1CCC2(CCCC2)C1	ZINC001339482861	1390042928	/nfs/dbraw/zinc/04/29/28/1390042928.db2.gz	DLKXLNQFZWRKBL-INIZCTEOSA-N	0	3	329.492	3.044	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N[C@@H](c1nc2ccccc2[nH]1)[C@@H](C)CC	ZINC001340043916	1390214868	/nfs/dbraw/zinc/21/48/68/1390214868.db2.gz	CUHVAYVSCBGKEO-GRDNDAEWSA-N	0	3	328.460	3.450	20	30		EGEDHN
C=CCn1c(-c2ccsc2)nnc1N1CCN(C(C)(C)C)CC1	ZINC001340135964	1390233738	/nfs/dbraw/zinc/23/37/38/1390233738.db2.gz	YYOQBRAALBDUEU-UHFFFAOYSA-N	0	3	331.489	3.113	20	30		EGEDHN
C[C@H](C(=O)C(C#N)C(=O)NC1CCCCC1)c1ccc(F)cc1F	ZINC001341899794	1390546808	/nfs/dbraw/zinc/54/68/08/1390546808.db2.gz	UDCUIVFGWLOJHH-XHDPSFHLSA-N	0	3	334.366	3.226	20	30		EGEDHN
C[C@@H](C(=O)C(C#N)C(=O)NC1CCCCC1)c1ccc(F)cc1F	ZINC001341899789	1390546877	/nfs/dbraw/zinc/54/68/77/1390546877.db2.gz	UDCUIVFGWLOJHH-ABAIWWIYSA-N	0	3	334.366	3.226	20	30		EGEDHN
CCCn1cc(C(=O)C(C#N)c2nccn2Cc2ccccc2)cn1	ZINC001342919360	1390672466	/nfs/dbraw/zinc/67/24/66/1390672466.db2.gz	YNTRQUHGPQOMCR-QGZVFWFLSA-N	0	3	333.395	3.028	20	30		EGEDHN
CC(C)c1c(C(=O)C(C#N)c2nccn2C)cnn1-c1ccccc1	ZINC001342924046	1390673112	/nfs/dbraw/zinc/67/31/12/1390673112.db2.gz	JDIHBFWMRYZCHE-HNNXBMFYSA-N	0	3	333.395	3.219	20	30		EGEDHN
CC[C@@H](C)N1CCN(c2nnc([C@H](C)CCC#N)n2CC(C)C)CC1	ZINC001343482416	1390716802	/nfs/dbraw/zinc/71/68/02/1390716802.db2.gz	LUOBRACSMBLJGN-IAGOWNOFSA-N	0	3	346.523	3.262	20	30		EGEDHN
C=CC1CCN(c2nnc([C@H]3CCCN(C)C3)n2CC(C)C)CC1	ZINC001343486031	1390716949	/nfs/dbraw/zinc/71/69/49/1390716949.db2.gz	DGLXBRYKCJXTGO-KRWDZBQOSA-N	0	3	331.508	3.146	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccc(OC(F)F)cc2F)nc(C)n1	ZINC001343575716	1390723732	/nfs/dbraw/zinc/72/37/32/1390723732.db2.gz	IWGQMOBMYFNDMF-GFCCVEGCSA-N	0	3	335.285	3.324	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CCCN(C)C2)nnc1N(CC1CC1)C1CCC1	ZINC001343786948	1390736847	/nfs/dbraw/zinc/73/68/47/1390736847.db2.gz	IUBFZORTFJPCGU-KRWDZBQOSA-N	0	3	343.519	3.432	20	30		EGEDHN
Cn1c(Cl)cnc1C(C#N)C(=O)C[C@H]1CCc2ccccc2C1	ZINC001344321780	1390782076	/nfs/dbraw/zinc/78/20/76/1390782076.db2.gz	BFJCGPHDNYSGEE-WFASDCNBSA-N	0	3	327.815	3.445	20	30		EGEDHN
CCc1c(C(=O)C(C#N)c2nccn2CC)cnn1Cc1ccccc1	ZINC001344322428	1390782135	/nfs/dbraw/zinc/78/21/35/1390782135.db2.gz	ONFDJXBHTDLTRX-MRXNPFEDSA-N	0	3	347.422	3.200	20	30		EGEDHN
CC(C)n1cc(C(=O)C(C#N)c2nc3c(cccc3Cl)[nH]2)cn1	ZINC001345673446	1390874674	/nfs/dbraw/zinc/87/46/74/1390874674.db2.gz	QDKHGUOOFDXUBM-LLVKDONJSA-N	0	3	327.775	3.484	20	30		EGEDHN
Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@H]1N2C(=O)c1csc(C#N)c1	ZINC001346070002	1390905049	/nfs/dbraw/zinc/90/50/49/1390905049.db2.gz	FPFWMQPVDKQGPK-FUHWJXTLSA-N	0	3	337.448	3.376	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCc1cccc(Br)c1	ZINC001346096241	1390907193	/nfs/dbraw/zinc/90/71/93/1390907193.db2.gz	OUKLJANHRVLQGP-CQSZACIVSA-N	0	3	346.228	3.475	20	30		EGEDHN
CC(C)CN(Cc1ccc(C#N)cc1)C(=O)[C@@H]1CCCN1C(C)C	ZINC001353414864	1392005947	/nfs/dbraw/zinc/00/59/47/1392005947.db2.gz	VBMFYOJKFJVVHW-IBGZPJMESA-N	0	3	327.472	3.416	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)Cc2c[nH]c3ccc(F)cc23)C1	ZINC001479322392	1392214669	/nfs/dbraw/zinc/21/46/69/1392214669.db2.gz	OATBJBTTYZUKNA-JNSHFYNHSA-N	0	3	349.837	3.086	20	30		EGEDHN
CC(C)(CC(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1)C1CC1	ZINC001480137996	1392598630	/nfs/dbraw/zinc/59/86/30/1392598630.db2.gz	QOSLJPCJGCTXTR-QAQDUYKDSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)CCn2ccc3ccccc32)C1	ZINC001480170706	1392607947	/nfs/dbraw/zinc/60/79/47/1392607947.db2.gz	ONORQRTUOOEMOY-WKILWMFISA-N	0	3	331.847	3.021	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@H](C)NCc2ccc(F)c(C#N)c2)c(F)c1	ZINC001480545066	1392787357	/nfs/dbraw/zinc/78/73/57/1392787357.db2.gz	UPTQZLPBWRQXCO-ZDUSSCGKSA-N	0	3	343.377	3.053	20	30		EGEDHN
Cc1coc(C(=O)N[C@H](CNCc2ccc(C#N)s2)CC(C)C)c1	ZINC001698871590	1406591198	/nfs/dbraw/zinc/59/11/98/1406591198.db2.gz	OTTPJUAWZHTIQK-AWEZNQCLSA-N	0	3	345.468	3.456	20	30		EGEDHN
CC1(C(=O)NC[C@@H]2CCN(Cc3cccc(C#N)c3)C2)CCCC1	ZINC001481102600	1393120237	/nfs/dbraw/zinc/12/02/37/1393120237.db2.gz	MNPPZAARGXHLIK-SFHVURJKSA-N	0	3	325.456	3.077	20	30		EGEDHN
CCCN(CCNC(=O)[C@@H]1C[C@H]1C1CC1)Cc1ccc(F)c(C#N)c1	ZINC001481150842	1393135152	/nfs/dbraw/zinc/13/51/52/1393135152.db2.gz	NZLDMZGBPGSHTG-ZWKOTPCHSA-N	0	3	343.446	3.072	20	30		EGEDHN
C[C@@](CNCc1cc(C#N)ccc1F)(NC(=O)CCC1CC1)C1CC1	ZINC001481921756	1394596004	/nfs/dbraw/zinc/59/60/04/1394596004.db2.gz	IYKYRPNFHKMHEF-FQEVSTJZSA-N	0	3	343.446	3.262	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)C1(F)CCCCC1	ZINC001482155183	1394774035	/nfs/dbraw/zinc/77/40/35/1394774035.db2.gz	DEEOXGYBPOQHKU-OAHLLOKOSA-N	0	3	331.435	3.073	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)Cc1csc(C(C)(C)C)n1	ZINC001492098793	1396304193	/nfs/dbraw/zinc/30/41/93/1396304193.db2.gz	LQSGTFNJPYGYHK-GFCCVEGCSA-N	0	3	343.924	3.220	20	30		EGEDHN
CC[C@@H](c1ccc(Cl)cc1)N(C)CCNC(=O)c1cc(C#N)c[nH]1	ZINC001492223412	1396315707	/nfs/dbraw/zinc/31/57/07/1396315707.db2.gz	MYIOTGUALVEGTB-KRWDZBQOSA-N	0	3	344.846	3.353	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H](C)CN(C)Cc2ccc(C#N)cc2)cc1F	ZINC001498331712	1396966501	/nfs/dbraw/zinc/96/65/01/1396966501.db2.gz	MGHSLMYGLPPEHS-HNNXBMFYSA-N	0	3	339.414	3.256	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1n[nH]c2ccccc21	ZINC001689911642	1404204974	/nfs/dbraw/zinc/20/49/74/1404204974.db2.gz	JJJKYJJRINCIAA-XJKSGUPXSA-N	0	3	346.862	3.288	20	30		EGEDHN
CCCC[C@@H](C)C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2OC)C1	ZINC001690274149	1404441300	/nfs/dbraw/zinc/44/13/00/1404441300.db2.gz	HAYXRNTUCCHGPW-ZTFGCOKTSA-N	0	3	343.471	3.130	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@H](C)CCc2ccccc2F)C1	ZINC001690289266	1404449855	/nfs/dbraw/zinc/44/98/55/1404449855.db2.gz	AETYTJQUTURIJR-DAXOMENPSA-N	0	3	338.854	3.384	20	30		EGEDHN
CC(C)(C)CC(=O)NC[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001690374484	1404505173	/nfs/dbraw/zinc/50/51/73/1404505173.db2.gz	RDBJKRAAARCMKO-GOSISDBHSA-N	0	3	327.472	3.323	20	30		EGEDHN
Cc1oc(C)c(C(=O)NC[C@H](C)NCc2ccc(F)c(C#N)c2)c1C	ZINC001690600577	1404647274	/nfs/dbraw/zinc/64/72/74/1404647274.db2.gz	XVRFKTMLRWIKKW-NSHDSACASA-N	0	3	343.402	3.124	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1sc(CC2CC2)nc1C	ZINC001690872583	1404788204	/nfs/dbraw/zinc/78/82/04/1404788204.db2.gz	YEIVSWIMTHGNRC-NSHDSACASA-N	0	3	341.908	3.255	20	30		EGEDHN
C=C(Br)CN[C@@H](C)CCNC(=O)[C@H]1CC[C@H](C)CC1	ZINC001690874049	1404788983	/nfs/dbraw/zinc/78/89/83/1404788983.db2.gz	ANCHBMLKUVOCPH-UBHSHLNASA-N	0	3	331.298	3.206	20	30		EGEDHN
CCN(CCNC(=O)c1sc(C)cc1C)Cc1cccc(C#N)c1	ZINC001691022331	1404935629	/nfs/dbraw/zinc/93/56/29/1404935629.db2.gz	RJUVBYQBRQVCIH-UHFFFAOYSA-N	0	3	341.480	3.489	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)[C@@H](C)C2CCCC2)C1	ZINC001691123987	1405064057	/nfs/dbraw/zinc/06/40/57/1405064057.db2.gz	RFINHLNBBQNKBW-KCQAQPDRSA-N	0	3	343.309	3.206	20	30		EGEDHN
C[C@H](C(=O)NC[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1)C(C)(C)C	ZINC001691150137	1405083701	/nfs/dbraw/zinc/08/37/01/1405083701.db2.gz	BMJSEHIFNKPROK-FRFSOERESA-N	0	3	345.462	3.364	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)C[C@H](C)CCC)C1	ZINC001691694810	1405428421	/nfs/dbraw/zinc/42/84/21/1405428421.db2.gz	UDUKTEVXDUZWJG-BNOWGMLFSA-N	0	3	331.298	3.206	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@@H](c2cccnc2)C(C)C)C1	ZINC001691749285	1405468453	/nfs/dbraw/zinc/46/84/53/1405468453.db2.gz	RNGMAJRBUXFSOZ-HYVNUMGLSA-N	0	3	335.879	3.058	20	30		EGEDHN
Cc1cc(C(=O)NCC[C@H]2CCN(Cc3ccccc3C#N)C2)co1	ZINC001691884011	1405608154	/nfs/dbraw/zinc/60/81/54/1405608154.db2.gz	YTIKZDUDBHRIJZ-INIZCTEOSA-N	0	3	337.423	3.102	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)C2Cc3ccccc3C2)CCCC1	ZINC001732236164	1428482374	/nfs/dbraw/zinc/48/23/74/1428482374.db2.gz	NOPRSZMJJOSRJZ-UHFFFAOYSA-N	0	3	332.875	3.173	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1cnc(C2CC2)s1)C1CC1	ZINC001732251865	1428493770	/nfs/dbraw/zinc/49/37/70/1428493770.db2.gz	TVNISRHYQHLEGK-MRXNPFEDSA-N	0	3	339.892	3.261	20	30		EGEDHN
Cc1cc(Cl)ccc1C(=O)N[C@@H](C)CNCc1ccc(C#N)s1	ZINC001699418954	1412733154	/nfs/dbraw/zinc/73/31/54/1412733154.db2.gz	ORQUAHKWHBWQOJ-LBPRGKRZSA-N	0	3	347.871	3.490	20	30		EGEDHN
C=C(Cl)CN(CC1CC1)C1CCN(C(=O)CC(F)(F)F)CC1	ZINC001699684750	1413081371	/nfs/dbraw/zinc/08/13/71/1413081371.db2.gz	PRMYTWKNFSNYJI-UHFFFAOYSA-N	0	3	338.801	3.394	20	30		EGEDHN
CC(C)CC(=O)N[C@@H](CNCc1ccc(C#N)s1)C1CCCC1	ZINC001699787540	1413192609	/nfs/dbraw/zinc/19/26/09/1413192609.db2.gz	KDNOMAGVWGPHST-KRWDZBQOSA-N	0	3	333.501	3.430	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cc(C)c(OC)c(C)c1)C(C)C	ZINC001732559238	1428748170	/nfs/dbraw/zinc/74/81/70/1428748170.db2.gz	PTGKLKBWMYIWIU-INIZCTEOSA-N	0	3	338.879	3.409	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cc(-c2ccccc2)n[nH]1)C(C)C	ZINC001732560035	1428749249	/nfs/dbraw/zinc/74/92/49/1428749249.db2.gz	DMVRTRXIYKTZMX-KRWDZBQOSA-N	0	3	346.862	3.173	20	30		EGEDHN
CC(=O)N1CCC(CNCc2ccccc2C#N)(c2ccccc2)CC1	ZINC001700296020	1413755475	/nfs/dbraw/zinc/75/54/75/1413755475.db2.gz	JPWIRWXIFQTQHE-UHFFFAOYSA-N	0	3	347.462	3.228	20	30		EGEDHN
C[C@@H](C(=O)NCC[C@H](C)NCc1cc(C#N)ccc1F)C1CCC1	ZINC001700325125	1413794836	/nfs/dbraw/zinc/79/48/36/1413794836.db2.gz	OUKDBHMLXBIYHZ-UONOGXRCSA-N	0	3	331.435	3.118	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)CCC(C)(F)F	ZINC001700356030	1413856640	/nfs/dbraw/zinc/85/66/40/1413856640.db2.gz	FQAHVQOGEDYMBW-KRWDZBQOSA-N	0	3	349.425	3.416	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cccnc1C(F)(F)F)C(C)C	ZINC001732570532	1428765437	/nfs/dbraw/zinc/76/54/37/1428765437.db2.gz	WQCFPEUXWYQVFJ-LBPRGKRZSA-N	0	3	349.784	3.197	20	30		EGEDHN
C=C(Cl)Cn1c(C2CCC2)nnc1N1C[C@@H](C)N(CC)C[C@H]1C	ZINC001705753080	1417133763	/nfs/dbraw/zinc/13/37/63/1417133763.db2.gz	PIOUJBFQDTWXAL-ZIAGYGMSSA-N	0	3	337.899	3.217	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@@H](CC)OC2CCCCC2)C1	ZINC001707060494	1417176101	/nfs/dbraw/zinc/17/61/01/1417176101.db2.gz	LONSEKNEHZFVPF-HLLBOEOZSA-N	0	3	342.911	3.351	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)cc1F)[C@@H]1CCCCN1C(=O)CCCF	ZINC001707433732	1417337526	/nfs/dbraw/zinc/33/75/26/1417337526.db2.gz	CNMKTSXBRCMNEY-KSSFIOAISA-N	0	3	349.425	3.306	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1ccc(COC)o1	ZINC001712998007	1417549272	/nfs/dbraw/zinc/54/92/72/1417549272.db2.gz	DCNYLNZSXRAWNX-UKRRQHHQSA-N	0	3	340.851	3.151	20	30		EGEDHN
Cc1cc(C(=O)NC[C@@H](NCc2ccc(C#N)s2)C2CC2)c(C)o1	ZINC001713105279	1417664919	/nfs/dbraw/zinc/66/49/19/1417664919.db2.gz	LVTMRDNCOADAEC-QGZVFWFLSA-N	0	3	343.452	3.128	20	30		EGEDHN
CC(C)c1cccc(C(=O)NC[C@H](C)NCc2ccc(C#N)s2)n1	ZINC001713322815	1417947190	/nfs/dbraw/zinc/94/71/90/1417947190.db2.gz	VYZBIZSJSQMOTE-ZDUSSCGKSA-N	0	3	342.468	3.046	20	30		EGEDHN
CCC(C)(C)C(=O)NCC[C@H]1CCN(Cc2ccc(C#N)s2)C1	ZINC001713735702	1418529389	/nfs/dbraw/zinc/52/93/89/1418529389.db2.gz	VHSWKKOOLIEASY-AWEZNQCLSA-N	0	3	333.501	3.384	20	30		EGEDHN
N#Cc1ccc(CN[C@@H](CNC(=O)c2cccc(F)c2)C2CC2)s1	ZINC001713859187	1418656368	/nfs/dbraw/zinc/65/63/68/1418656368.db2.gz	AHHCNKVNXZMFFR-KRWDZBQOSA-N	0	3	343.427	3.057	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1nc(C(C)C)oc1C)C1CC1	ZINC001714162343	1418972915	/nfs/dbraw/zinc/97/29/15/1418972915.db2.gz	FEXAQFBAGAFAML-QGZVFWFLSA-N	0	3	339.867	3.347	20	30		EGEDHN
C[C@@H](CNC(=O)c1cccc(Cl)c1)NCc1ccc(C#N)s1	ZINC001714293641	1419071844	/nfs/dbraw/zinc/07/18/44/1419071844.db2.gz	BPZMVVCETRMGJX-NSHDSACASA-N	0	3	333.844	3.181	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)C12CCC(CC1)CC2	ZINC001714453361	1419185973	/nfs/dbraw/zinc/18/59/73/1419185973.db2.gz	MOLIOLQOYRPEMD-ZGGTZUKQSA-N	0	3	339.483	3.371	20	30		EGEDHN
C[C@H](CCNC(=O)CCC(C)(F)F)NCc1cc(C#N)ccc1F	ZINC001714476323	1419199620	/nfs/dbraw/zinc/19/96/20/1419199620.db2.gz	DJSDGIATEIPPQG-GFCCVEGCSA-N	0	3	341.377	3.117	20	30		EGEDHN
CCCN(CCNC(=O)c1cocc1C)Cc1ccc(C#N)cc1	ZINC001714656852	1419438675	/nfs/dbraw/zinc/43/86/75/1419438675.db2.gz	OLGKPYZGEWDANE-UHFFFAOYSA-N	0	3	325.412	3.102	20	30		EGEDHN
CC[C@@H](CNC(=O)Cc1ccccc1C)NCc1ccc(C#N)s1	ZINC001715078490	1419813894	/nfs/dbraw/zinc/81/38/94/1419813894.db2.gz	BRHUDMQTVRAMQO-INIZCTEOSA-N	0	3	341.480	3.155	20	30		EGEDHN
C=C(Br)CNCC1(NC(=O)C2CC(C)(C)C2)CCCC1	ZINC001715092448	1419832779	/nfs/dbraw/zinc/83/27/79/1419832779.db2.gz	OLHGOWFYFQCRAZ-UHFFFAOYSA-N	0	3	343.309	3.350	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)[C@H](CC)OC2CCCC2)CCCC1	ZINC001715107025	1419849412	/nfs/dbraw/zinc/84/94/12/1419849412.db2.gz	UTNDEHPTWLFVEU-INIZCTEOSA-N	0	3	342.911	3.495	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cc(C(C)(C)C)on1)C(C)C	ZINC001715497179	1420178824	/nfs/dbraw/zinc/17/88/24/1420178824.db2.gz	OOHDVUGMZRHZIS-ZDUSSCGKSA-N	0	3	327.856	3.069	20	30		EGEDHN
CCCCC(=O)N1CC[C@H]2[C@@H](CCN2Cc2ccccc2C#N)C1	ZINC001715554505	1420249372	/nfs/dbraw/zinc/24/93/72/1420249372.db2.gz	SPFVNRYPAWFIQA-OALUTQOASA-N	0	3	325.456	3.171	20	30		EGEDHN
C[C@H](CN(C)Cc1cccc(C#N)c1)NC(=O)c1cc2ccccn2c1	ZINC001716043801	1420506881	/nfs/dbraw/zinc/50/68/81/1420506881.db2.gz	ZEABDSOISYHDGY-MRXNPFEDSA-N	0	3	346.434	3.061	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1sccc1OC	ZINC001717460391	1421389973	/nfs/dbraw/zinc/38/99/73/1421389973.db2.gz	LOQIIHYYFPVYHM-UHFFFAOYSA-N	0	3	330.881	3.197	20	30		EGEDHN
C[C@H](CNC(=O)c1cccnc1C1CC1)N(C)Cc1ccc(C#N)cc1	ZINC001717479058	1421413773	/nfs/dbraw/zinc/41/37/73/1421413773.db2.gz	GOJUMDOTGJCOBH-OAHLLOKOSA-N	0	3	348.450	3.081	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@@H](C)N(C)Cc2ccc(C#N)cc2)c(C)c1	ZINC001717498530	1421441124	/nfs/dbraw/zinc/44/11/24/1421441124.db2.gz	JORLQJIKDPMLJX-QGZVFWFLSA-N	0	3	335.451	3.425	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2ccc(F)c(C#N)c2)CN1C(=O)CCC1(C)CC1	ZINC001717825133	1421640010	/nfs/dbraw/zinc/64/00/10/1421640010.db2.gz	BEUGHVNQODPQDL-PBHICJAKSA-N	0	3	343.446	3.357	20	30		EGEDHN
CC(C)(C)[C@H](CNCc1ccc(C#N)s1)NC(=O)[C@H]1CC1(C)C	ZINC001717958758	1421730422	/nfs/dbraw/zinc/73/04/22/1421730422.db2.gz	VXUJDJYKJHENRZ-CABCVRRESA-N	0	3	333.501	3.286	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](NC(=O)C2(F)CCCCC2)C2CC2)s1	ZINC001723341698	1424361092	/nfs/dbraw/zinc/36/10/92/1424361092.db2.gz	PXWPDEFUZTUKDW-INIZCTEOSA-N	0	3	349.475	3.277	20	30		EGEDHN
CC(C)(C)C[C@@H]1C[C@H]1C(=O)NCC1(NCc2cccc(C#N)c2)CC1	ZINC001723517073	1424448763	/nfs/dbraw/zinc/44/87/63/1424448763.db2.gz	FRGHXQZPGYPFOR-ZWKOTPCHSA-N	0	3	339.483	3.369	20	30		EGEDHN
C#CCCCCC(=O)N1CCC[C@@H]1CNCc1cc(F)cc(F)c1	ZINC001723896674	1424599312	/nfs/dbraw/zinc/59/93/12/1424599312.db2.gz	HOPYYWXWPCRQIT-GOSISDBHSA-N	0	3	334.410	3.239	20	30		EGEDHN
N#Cc1ccccc1CN1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)CCCF)C2	ZINC001733563661	1429763163	/nfs/dbraw/zinc/76/31/63/1429763163.db2.gz	OQDZYNPLSMBNGO-IDHPPYADSA-N	0	3	343.446	3.167	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)[C@@]2(C)CCCOC2)CC1	ZINC001725025414	1425443348	/nfs/dbraw/zinc/44/33/48/1425443348.db2.gz	ARFWGGKBVUXNOT-SFHVURJKSA-N	0	3	342.911	3.116	20	30		EGEDHN
CC(C)(C)CC(=O)N[C@@H]1CC[C@H](CNCc2ccccc2C#N)C1	ZINC001725622773	1426288138	/nfs/dbraw/zinc/28/81/38/1426288138.db2.gz	IHTGIPSGCHLDQJ-MAUKXSAKSA-N	0	3	327.472	3.369	20	30		EGEDHN
Cc1cccc(C)c1CN1CCC[C@H](NC(=O)C#CC(C)(C)C)C1	ZINC001731353225	1427293002	/nfs/dbraw/zinc/29/30/02/1427293002.db2.gz	AJWGRDVDKRLOBF-SFHVURJKSA-N	0	3	326.484	3.434	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1CCCN(CCc2ccccc2)C1	ZINC001731353873	1427293061	/nfs/dbraw/zinc/29/30/61/1427293061.db2.gz	CIEISKDEXDCINB-HXUWFJFHSA-N	0	3	326.484	3.393	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H](C)CCc2cccc(F)c2)C1	ZINC001731459582	1427436195	/nfs/dbraw/zinc/43/61/95/1427436195.db2.gz	NDHNOTHOQJMXAH-ZLIFDBKOSA-N	0	3	338.854	3.384	20	30		EGEDHN
CC(C)C#CC(=O)N1CCCC[C@H]1CNCc1ccc(F)c(F)c1	ZINC001731546062	1427562932	/nfs/dbraw/zinc/56/29/32/1427562932.db2.gz	YAMYJRIFTPUDRO-INIZCTEOSA-N	0	3	334.410	3.095	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1cccc2c1OCC2(C)C	ZINC001731741777	1427831122	/nfs/dbraw/zinc/83/11/22/1427831122.db2.gz	UGKFAWGJRJZQBQ-CYBMUJFWSA-N	0	3	336.863	3.207	20	30		EGEDHN
CCCCC(=O)N1CCC[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001733604372	1429813665	/nfs/dbraw/zinc/81/36/65/1429813665.db2.gz	USINEMXZLXSIRW-RBUKOAKNSA-N	0	3	325.456	3.171	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1cn(CCC)nc1C	ZINC001734022452	1437811290	/nfs/dbraw/zinc/81/12/90/1437811290.db2.gz	KQWIHFYHTJQMCF-UHFFFAOYSA-N	0	3	340.899	3.042	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@H](C)N(C)Cc2ccc(C#N)cc2)s1	ZINC001734026617	1437814266	/nfs/dbraw/zinc/81/42/66/1437814266.db2.gz	UMRGRIUJJBBKFK-ZDUSSCGKSA-N	0	3	327.453	3.179	20	30		EGEDHN
C[C@@H](CN(C)C(=O)CCc1ccsc1)NCc1ccc(C#N)s1	ZINC001734328122	1438052747	/nfs/dbraw/zinc/05/27/47/1438052747.db2.gz	HLSXDONBLWXHBW-ZDUSSCGKSA-N	0	3	347.509	3.251	20	30		EGEDHN
CC(C)(C)[C@H](CNCc1ccc(C#N)s1)NC(=O)c1cscn1	ZINC001734555228	1438154358	/nfs/dbraw/zinc/15/43/58/1438154358.db2.gz	FNDKJSFSQNAJCR-AWEZNQCLSA-N	0	3	348.497	3.011	20	30		EGEDHN
C=C(Cl)CNC1CC(N(C)C(=O)CCCc2csc(C)n2)C1	ZINC001734594699	1438180153	/nfs/dbraw/zinc/18/01/53/1438180153.db2.gz	MFLMFDFQZKTKHS-UHFFFAOYSA-N	0	3	341.908	3.106	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1cc(C)nc(C)c1	ZINC001752146756	1440146175	/nfs/dbraw/zinc/14/61/75/1440146175.db2.gz	PBFLLLZWFDVRDU-WBVHZDCISA-N	0	3	335.879	3.424	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1c(C)nsc1C	ZINC001752156806	1440147364	/nfs/dbraw/zinc/14/73/64/1440147364.db2.gz	MESNISOTYZLBLW-SMDDNHRTSA-N	0	3	341.908	3.485	20	30		EGEDHN
CCN(CC#Cc1ccccc1)CCCNC(=O)c1ccoc1Cl	ZINC001752180313	1440150778	/nfs/dbraw/zinc/15/07/78/1440150778.db2.gz	JNZCISIVFWIUDY-UHFFFAOYSA-N	0	3	344.842	3.427	20	30		EGEDHN
CC#CCN(CCCNC(=O)[C@@H]1C[C@H]1c1sccc1C)C1CC1	ZINC001752259675	1440161678	/nfs/dbraw/zinc/16/16/78/1440161678.db2.gz	JEEGCEKQJXEYRN-IAGOWNOFSA-N	0	3	330.497	3.154	20	30		EGEDHN
C=C1CCC(C(=O)NCCCN2CCN(CC/C=C\CC)CC2)CC1	ZINC001752352380	1440171895	/nfs/dbraw/zinc/17/18/95/1440171895.db2.gz	MJRJSTGXMRTGHM-PLNGDYQASA-N	0	3	347.547	3.213	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CC12CCN(Cc1cccc(C#N)c1)CC2	ZINC001752422705	1440176305	/nfs/dbraw/zinc/17/63/05/1440176305.db2.gz	ZADHBLSLQHWRLV-HXUWFJFHSA-N	0	3	349.478	3.223	20	30		EGEDHN
C=CCCC(=O)N(CCC)C1CCN(Cc2ccc(CO)cc2)CC1	ZINC001752432422	1440178827	/nfs/dbraw/zinc/17/88/27/1440178827.db2.gz	UDSUCBRKYBCIAA-UHFFFAOYSA-N	0	3	344.499	3.348	20	30		EGEDHN
C[C@@H](C(=O)NC[C@@H](NCc1ccc(C#N)s1)C1CC1)c1ccco1	ZINC001752481720	1440185780	/nfs/dbraw/zinc/18/57/80/1440185780.db2.gz	GHKXGLQSAOOPEL-MLGOLLRUSA-N	0	3	343.452	3.001	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2c(c1)COC2	ZINC001752564652	1440195332	/nfs/dbraw/zinc/19/53/32/1440195332.db2.gz	HDNYBJNDGVGNQH-RYGJVYDSSA-N	0	3	340.467	3.360	20	30		EGEDHN
Cc1cocc1C(=O)N[C@H]1C[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001752650616	1440197852	/nfs/dbraw/zinc/19/78/52/1440197852.db2.gz	IXFYTDCISDNXRN-QAQDUYKDSA-N	0	3	342.826	3.144	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H](NCc3ccncc3Cl)C2)CCC1	ZINC001752664714	1440198604	/nfs/dbraw/zinc/19/86/04/1440198604.db2.gz	ZFAKLMOOQGVUOS-SHTZXODSSA-N	0	3	333.863	3.218	20	30		EGEDHN
O=C(N[C@H]1C[C@H](NCC#Cc2cccc(Cl)c2)C1)[C@@H]1CC12CCC2	ZINC001752668858	1440198880	/nfs/dbraw/zinc/19/88/80/1440198880.db2.gz	FNRWWYOUIIRKPO-BZSNNMDCSA-N	0	3	342.870	3.119	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C2(CC)CCCC2)C1	ZINC001752673864	1440199055	/nfs/dbraw/zinc/19/90/55/1440199055.db2.gz	JMKNJGIQYUFQMO-JOCQHMNTSA-N	0	3	329.282	3.102	20	30		EGEDHN
C#CCCCC(=O)NC[C@@H]1CCCN(Cc2cc(F)ccc2C)C1	ZINC001752781687	1440209090	/nfs/dbraw/zinc/20/90/90/1440209090.db2.gz	XEWFXCJXDGAOMO-KRWDZBQOSA-N	0	3	330.447	3.266	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)C[C@@H]2C[C@H]2Cc2ccccc2)C1	ZINC001752784402	1440210478	/nfs/dbraw/zinc/21/04/78/1440210478.db2.gz	BMAFARXYTDXKRF-NJYVYQBISA-N	0	3	338.495	3.107	20	30		EGEDHN
C[C@H](C(=O)NC[C@H]1CCCN(Cc2ccc(C#N)cc2)C1)C(C)(F)F	ZINC001752786942	1440211556	/nfs/dbraw/zinc/21/15/56/1440211556.db2.gz	CMDKLIGCWGUXEL-RHSMWYFYSA-N	0	3	349.425	3.178	20	30		EGEDHN
C=CCOCCN1CCCC[C@@H]1CNC(=O)[C@H]1CCC(C)=C(C)C1	ZINC001752820352	1440220137	/nfs/dbraw/zinc/22/01/37/1440220137.db2.gz	DHQYSXFLKGEPCW-RBUKOAKNSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@@H](C)c1cccc(OC)c1	ZINC001752825126	1440223290	/nfs/dbraw/zinc/22/32/90/1440223290.db2.gz	LWMNALBVCGUFEB-WMZOPIPTSA-N	0	3	330.472	3.346	20	30		EGEDHN
C[C@@H](NC(=O)CCC1CC1)[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001752835948	1440227807	/nfs/dbraw/zinc/22/78/07/1440227807.db2.gz	CSMDTKAYNNEARA-UZLBHIALSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)CC(C)(C)CC(F)F)C1	ZINC001752838273	1440228824	/nfs/dbraw/zinc/22/88/24/1440228824.db2.gz	ZYDJVLSJBLILEF-CABCVRRESA-N	0	3	328.447	3.298	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N1CC[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001752950037	1440252014	/nfs/dbraw/zinc/25/20/14/1440252014.db2.gz	RTKSFTSBFOFEST-KUJWUYCRSA-N	0	3	341.430	3.158	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1CCC[C@@H](NCc2ccn(C(C)C)n2)C1	ZINC001752976028	1440256075	/nfs/dbraw/zinc/25/60/75/1440256075.db2.gz	IHTICQXYJNNWEU-SJORKVTESA-N	0	3	332.492	3.337	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2CCC[C@H](NCc3ccn(CC)n3)C2)CCC1	ZINC001752976864	1440256253	/nfs/dbraw/zinc/25/62/53/1440256253.db2.gz	SEZJWFFRMXVGBP-IRXDYDNUSA-N	0	3	344.503	3.166	20	30		EGEDHN
CC#CCN(C)[C@@H]1CCCN(C(=O)[C@@H](CC)c2ccc(OC)cc2)C1	ZINC001752999618	1440263912	/nfs/dbraw/zinc/26/39/12/1440263912.db2.gz	DSGXNCKMXUWCFS-QUCCMNQESA-N	0	3	342.483	3.135	20	30		EGEDHN
CC#CCN(C)[C@@H]1CCCN(C(=O)c2ccccc2CC(C)C)C1	ZINC001753000966	1440264573	/nfs/dbraw/zinc/26/45/73/1440264573.db2.gz	WUEMHOCSKAIVKP-LJQANCHMSA-N	0	3	326.484	3.445	20	30		EGEDHN
C=CC1(CC(=O)NCC[C@H](C)NCc2cnc(C)cn2)CCCCC1	ZINC001753015572	1440268366	/nfs/dbraw/zinc/26/83/66/1440268366.db2.gz	ORUBVSNOVJDLCY-INIZCTEOSA-N	0	3	344.503	3.296	20	30		EGEDHN
C#CCCCCC(=O)NCCN(C)[C@H]1CCCc2ccc(F)cc21	ZINC001753046136	1440277699	/nfs/dbraw/zinc/27/76/99/1440277699.db2.gz	NIXNGJOMBGUYHQ-IBGZPJMESA-N	0	3	330.447	3.445	20	30		EGEDHN
Cc1cc(CN2CCC[C@@H]2CNC(=O)C#CC(C)(C)C)c(C)s1	ZINC001753103120	1440305108	/nfs/dbraw/zinc/30/51/08/1440305108.db2.gz	PJWGCSDXLMTUHX-QGZVFWFLSA-N	0	3	332.513	3.495	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)CCC(C)(C)c2ccccc2)C1	ZINC001753140145	1440320598	/nfs/dbraw/zinc/32/05/98/1440320598.db2.gz	ICZLQJQRFXJQCP-SFHVURJKSA-N	0	3	326.484	3.206	20	30		EGEDHN
CC#CCN(CCC)CCNC(=O)c1ccc(-c2ccco2)s1	ZINC001753149048	1440326610	/nfs/dbraw/zinc/32/66/10/1440326610.db2.gz	SJFXBTBPRZNKEP-UHFFFAOYSA-N	0	3	330.453	3.473	20	30		EGEDHN
C=C1CCC(C(=O)N(C)CCNCc2cn(C(C)C)nc2C)CC1	ZINC001753227892	1440340796	/nfs/dbraw/zinc/34/07/96/1440340796.db2.gz	CJSSGKKGDSXHMR-UHFFFAOYSA-N	0	3	332.492	3.067	20	30		EGEDHN
C=CCN[C@@H](CNC(=O)C[C@@H]1CCCO1)c1ccc(C(C)C)cc1	ZINC001753294775	1440351820	/nfs/dbraw/zinc/35/18/20/1440351820.db2.gz	UYMLRPIJTNLXTO-OALUTQOASA-N	0	3	330.472	3.312	20	30		EGEDHN
C#CCCN[C@@H](CNC(=O)c1ncsc1C1CC1)c1ccccc1	ZINC001753302088	1440354351	/nfs/dbraw/zinc/35/43/51/1440354351.db2.gz	UGTWIAFDRSIFDW-INIZCTEOSA-N	0	3	339.464	3.105	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@H]3CC[C@@H](C2)N3CCCC(C)C)CCOCC1	ZINC001753310222	1440356367	/nfs/dbraw/zinc/35/63/67/1440356367.db2.gz	LUUZITXLPYFDCM-KDURUIRLSA-N	0	3	348.531	3.471	20	30		EGEDHN
CCCN(C(=O)C#CC1CC1)[C@H]1CCN(CCCc2ccsc2)C1	ZINC001753315596	1440359347	/nfs/dbraw/zinc/35/93/47/1440359347.db2.gz	BQYJUPGPDJEWNN-IBGZPJMESA-N	0	3	344.524	3.407	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CCC)C(=O)c2cccc3c2COCC3)C1	ZINC001753317791	1440360794	/nfs/dbraw/zinc/36/07/94/1440360794.db2.gz	VZKHFAILGDRMIJ-SFHVURJKSA-N	0	3	342.483	3.262	20	30		EGEDHN
C=CCCCN1C[C@@H]2C[C@H]1CN2C(=O)c1nsc2ccccc21	ZINC001753421796	1440395710	/nfs/dbraw/zinc/39/57/10/1440395710.db2.gz	XLWIINYUHLTDPY-KBPBESRZSA-N	0	3	327.453	3.161	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H]2C[C@H]1CN2C(=O)c1ccnc(C2CC2)c1	ZINC001753423288	1440395746	/nfs/dbraw/zinc/39/57/46/1440395746.db2.gz	CLMRTBMUADBUIQ-WBAXXEDZSA-N	0	3	325.456	3.212	20	30		EGEDHN
C=CCCCCCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H](C)c1c(C)noc1C	ZINC001753425605	1440396645	/nfs/dbraw/zinc/39/66/45/1440396645.db2.gz	SNLKCSOPJLWUJB-JLSDUUJJSA-N	0	3	345.487	3.426	20	30		EGEDHN
CC(C)c1ccccc1CN1CC[C@H](N(C)C(=O)CSCC#N)C1	ZINC001753429696	1440398256	/nfs/dbraw/zinc/39/82/56/1440398256.db2.gz	JNTCEVBLOPVJCO-KRWDZBQOSA-N	0	3	345.512	3.099	20	30		EGEDHN
C#CCCCCC(=O)N(C)[C@H]1CCN(CCOc2ccccc2C)C1	ZINC001753434650	1440399401	/nfs/dbraw/zinc/39/94/01/1440399401.db2.gz	GHWRWJLKFRNGIZ-IBGZPJMESA-N	0	3	342.483	3.100	20	30		EGEDHN
C[C@H](C#N)C(=O)N(C)[C@H]1CCN(Cc2ccc(C(C)(C)C)cc2)C1	ZINC001753434458	1440399508	/nfs/dbraw/zinc/39/95/08/1440399508.db2.gz	WBIDNWFBZLEZEZ-QAPCUYQASA-N	0	3	327.472	3.176	20	30		EGEDHN
C#CCCCC(=O)N(C)[C@@H]1CCN(CCCOc2ccccc2C)C1	ZINC001753435689	1440400116	/nfs/dbraw/zinc/40/01/16/1440400116.db2.gz	WQRULNPHTCVFIJ-LJQANCHMSA-N	0	3	342.483	3.100	20	30		EGEDHN
C#CCCCCCC(=O)N(C)[C@@H]1CCN(CCc2ccccc2F)C1	ZINC001753442707	1440402366	/nfs/dbraw/zinc/40/23/66/1440402366.db2.gz	ITAFZWKJJJYTBH-LJQANCHMSA-N	0	3	344.474	3.485	20	30		EGEDHN
C=CCC1(C(=O)N(C)[C@H]2CCN(CCc3scnc3C)C2)CCC1	ZINC001753443630	1440402728	/nfs/dbraw/zinc/40/27/28/1440402728.db2.gz	AILHMGSMEANYFD-INIZCTEOSA-N	0	3	347.528	3.273	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)COc2cccc(Cl)c2)C1	ZINC001753460913	1440410796	/nfs/dbraw/zinc/41/07/96/1440410796.db2.gz	BPPQNOPKFMEUFX-MRXNPFEDSA-N	0	3	336.863	3.218	20	30		EGEDHN
CC[C@H](CNC(=O)c1ccsc1C)NCc1ccc(C#N)s1	ZINC001753471400	1440414061	/nfs/dbraw/zinc/41/40/61/1440414061.db2.gz	MDPRKVBIBMMJDL-GFCCVEGCSA-N	0	3	333.482	3.288	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC1(CNCc2ccc(F)cn2)CCCC1	ZINC001753503364	1440423836	/nfs/dbraw/zinc/42/38/36/1440423836.db2.gz	DHFGAWOMXRWBSK-UHFFFAOYSA-N	0	3	333.451	3.342	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1nc(Cl)cs1)C1CC1	ZINC001753523770	1440429132	/nfs/dbraw/zinc/42/91/32/1440429132.db2.gz	PZVKHNRXDQSLBR-CYBMUJFWSA-N	0	3	334.272	3.037	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC[C@H](CCNCc2cc(C#N)ccc2F)C1	ZINC001753541987	1440433689	/nfs/dbraw/zinc/43/36/89/1440433689.db2.gz	YOWZWIQECMGCRY-JKSUJKDBSA-N	0	3	345.462	3.462	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCCN(C(=O)c2cc(OC)cs2)C1	ZINC001753552532	1440435217	/nfs/dbraw/zinc/43/52/17/1440435217.db2.gz	XCMVRANXDDRUAZ-CYBMUJFWSA-N	0	3	342.892	3.341	20	30		EGEDHN
CC[C@H](F)C(=O)NCc1ccc(CNCc2ccc(C#N)s2)cc1	ZINC001753590005	1440442566	/nfs/dbraw/zinc/44/25/66/1440442566.db2.gz	WPEXCQPKLUULLT-KRWDZBQOSA-N	0	3	345.443	3.274	20	30		EGEDHN
C[C@@H](CNCc1ccccc1C#N)CNC(=O)C1CCC2(CC2)CC1	ZINC001753625492	1440451280	/nfs/dbraw/zinc/45/12/80/1440451280.db2.gz	LMLAERWLLWWIQF-INIZCTEOSA-N	0	3	339.483	3.371	20	30		EGEDHN
C=CCOCCN1CC2(C1)CCN(C(=O)[C@@H]1C[C@H]1CC(C)(C)C)CC2	ZINC001753673391	1440462688	/nfs/dbraw/zinc/46/26/88/1440462688.db2.gz	HXFQZKBRIIZTBO-ZWKOTPCHSA-N	0	3	348.531	3.186	20	30		EGEDHN
CCC[C@H](C)CC(=O)N(C)[C@@H](C)CNCc1ccc(F)c(C#N)c1	ZINC001753682501	1440464940	/nfs/dbraw/zinc/46/49/40/1440464940.db2.gz	RGGNRZUROOFLOI-GJZGRUSLSA-N	0	3	333.451	3.460	20	30		EGEDHN
C[C@H](CNCC#Cc1cccc(Cl)c1)N(C)C(=O)[C@@H](C)C1CC1	ZINC001753687666	1440466012	/nfs/dbraw/zinc/46/60/12/1440466012.db2.gz	RKBUJBPQOUSWOY-CABCVRRESA-N	0	3	332.875	3.174	20	30		EGEDHN
C=CC[C@@H](C(=O)N(C)[C@H](C)CNCc1ccccn1)c1ccccc1	ZINC001753729185	1440475122	/nfs/dbraw/zinc/47/51/22/1440475122.db2.gz	HWNKNPSSHXMFEA-YLJYHZDGSA-N	0	3	337.467	3.378	20	30		EGEDHN
O=C(CC#Cc1ccccc1)N[C@H](CNCCF)C1CCCCC1	ZINC001753748965	1440481886	/nfs/dbraw/zinc/48/18/86/1440481886.db2.gz	BDAREGQTLHJATF-LJQANCHMSA-N	0	3	330.447	3.052	20	30		EGEDHN
CCC(=O)N1CCC[C@@H](C)[C@@H]1CNCC#Cc1cccc(Cl)c1	ZINC001753800732	1440490847	/nfs/dbraw/zinc/49/08/47/1440490847.db2.gz	DDOZQWFFWOHYAX-QAPCUYQASA-N	0	3	332.875	3.318	20	30		EGEDHN
Cc1[nH]ccc1C(=O)N1CCC[C@H](C)[C@@H]1CNCC#Cc1ccccc1	ZINC001753805905	1440491811	/nfs/dbraw/zinc/49/18/11/1440491811.db2.gz	SVZNNFBMEOHGAK-UWJYYQICSA-N	0	3	349.478	3.205	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@H]([C@@H](C)NCc2cscn2)C1	ZINC001753815522	1440493728	/nfs/dbraw/zinc/49/37/28/1440493728.db2.gz	OBAIOZRTZWHMAU-CVEARBPZSA-N	0	3	333.501	3.053	20	30		EGEDHN
Cc1ccoc1C(=O)NC[C@@H](NCc1ccc(C#N)cc1F)C(C)C	ZINC001753824193	1440497563	/nfs/dbraw/zinc/49/75/63/1440497563.db2.gz	HPJHUTDTIQISEP-QGZVFWFLSA-N	0	3	343.402	3.143	20	30		EGEDHN
CC(C)[C@H](CNC(=O)C#CC1CC1)NCc1cccc(Cl)c1F	ZINC001753828883	1440499083	/nfs/dbraw/zinc/49/90/83/1440499083.db2.gz	GPYVMEBVNGBHPF-INIZCTEOSA-N	0	3	336.838	3.123	20	30		EGEDHN
Cc1cocc1C(=O)NC[C@@H](NCc1cc(C#N)ccc1F)C(C)C	ZINC001753836060	1440501035	/nfs/dbraw/zinc/50/10/35/1440501035.db2.gz	XAQQUTCDEVZAEM-GOSISDBHSA-N	0	3	343.402	3.143	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)C(C)(C)c1c(C)noc1C)C(C)C	ZINC001753838006	1440501727	/nfs/dbraw/zinc/50/17/27/1440501727.db2.gz	QKKYOXJXWOGQIE-CQSZACIVSA-N	0	3	341.883	3.052	20	30		EGEDHN
CC(C)[C@H](CNC(=O)c1ccc(Cl)[nH]1)NCC#Cc1ccccc1	ZINC001753838511	1440501848	/nfs/dbraw/zinc/50/18/48/1440501848.db2.gz	RPLGRMCTYAVYJS-KRWDZBQOSA-N	0	3	343.858	3.064	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1sc(C)cc1OC)C(C)C	ZINC001753838926	1440501949	/nfs/dbraw/zinc/50/19/49/1440501949.db2.gz	HCOUJIYOIOLMBZ-LBPRGKRZSA-N	0	3	330.881	3.162	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H]2[C@H](CCN2Cc2cc(C)ns2)C1	ZINC001753872847	1440518037	/nfs/dbraw/zinc/51/80/37/1440518037.db2.gz	PAQLXDATZKEYPK-NVXWUHKLSA-N	0	3	347.528	3.477	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CCC[C@@H]1CNCc1nc2ccc(F)cc2o1	ZINC001753882606	1440520578	/nfs/dbraw/zinc/52/05/78/1440520578.db2.gz	MESKWDQGSNZRBV-HIFRSBDPSA-N	0	3	345.418	3.308	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H](C)CCNCc2ccccc2C#N)s1	ZINC001753941282	1440524361	/nfs/dbraw/zinc/52/43/61/1440524361.db2.gz	AEINHFMCDHHSSK-ZDUSSCGKSA-N	0	3	327.453	3.226	20	30		EGEDHN
Cc1sccc1C(=O)N[C@H](C)CCNCc1cc(C#N)ccc1F	ZINC001753962919	1440526399	/nfs/dbraw/zinc/52/63/99/1440526399.db2.gz	APDIVWZFSRXLHZ-GFCCVEGCSA-N	0	3	345.443	3.366	20	30		EGEDHN
C=C(Cl)CNCC[C@@H](C)NC(=O)Cc1coc2cc(F)ccc12	ZINC001753965143	1440526509	/nfs/dbraw/zinc/52/65/09/1440526509.db2.gz	VPPOOFMHRZXIJX-GFCCVEGCSA-N	0	3	338.810	3.351	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)CCNCc2ccccc2C#N)CCC1	ZINC001753996815	1440529721	/nfs/dbraw/zinc/52/97/21/1440529721.db2.gz	NRYUNKLAYSXCEF-INIZCTEOSA-N	0	3	325.456	3.289	20	30		EGEDHN
C=C(Cl)CNCC[C@H](C)NC(=O)[C@@H](CC)c1c(C)noc1C	ZINC001754006554	1440530888	/nfs/dbraw/zinc/53/08/88/1440530888.db2.gz	TVCPERWPAXTWRH-FZMZJTMJSA-N	0	3	327.856	3.022	20	30		EGEDHN
C#CCCCC(=O)NC/C=C\CNCc1cccc(Br)c1	ZINC001754116559	1440542490	/nfs/dbraw/zinc/54/24/90/1440542490.db2.gz	SFDUREDOISILQA-WAYWQWQTSA-N	0	3	349.272	3.015	20	30		EGEDHN
CC(C)[C@]1(C)C[C@@H]1C(=O)NC/C=C/CNCc1cccc(C#N)c1	ZINC001754190182	1440548947	/nfs/dbraw/zinc/54/89/47/1440548947.db2.gz	BOEZAJBMQZVCKG-HSJMLMCGSA-N	0	3	325.456	3.002	20	30		EGEDHN
Cc1cccc(F)c1C(=O)NC/C=C/CNCc1cccc(C#N)c1	ZINC001754211881	1440551272	/nfs/dbraw/zinc/55/12/72/1440551272.db2.gz	LQAKVOLYPSQISZ-NSCUHMNNSA-N	0	3	337.398	3.082	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](C)CNCC#Cc2ccc(Cl)cc2)oc1C	ZINC001754223974	1440552971	/nfs/dbraw/zinc/55/29/71/1440552971.db2.gz	TZOUHBSUFHNJPU-CQSZACIVSA-N	0	3	344.842	3.309	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)NC(=O)[C@H]1CCCC2(CC2)C1	ZINC001754225527	1440553298	/nfs/dbraw/zinc/55/32/98/1440553298.db2.gz	ZREHWPOFIKKVJG-KGLIPLIRSA-N	0	3	331.485	3.184	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@H](C)CNCc1cc(F)c(OC)c(F)c1	ZINC001754241864	1440555944	/nfs/dbraw/zinc/55/59/44/1440555944.db2.gz	XTPYMEDOSFLMDP-KZULUSFZSA-N	0	3	340.414	3.170	20	30		EGEDHN
C=C[C@@H](C(=O)N[C@H](C)CNCc1scnc1C)c1ccccc1	ZINC001754254520	1440558734	/nfs/dbraw/zinc/55/87/34/1440558734.db2.gz	FLQOAPUUPSALMB-CZUORRHYSA-N	0	3	329.469	3.016	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccc(F)cc1)NC(=O)[C@@H]1CCC=CCCC1	ZINC001754272949	1440561746	/nfs/dbraw/zinc/56/17/46/1440561746.db2.gz	YLKPQLKBQOFRSV-PKOBYXMFSA-N	0	3	342.458	3.408	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@@H](C)CN[C@@H](C)c1ccccc1F	ZINC001754294173	1440566040	/nfs/dbraw/zinc/56/60/40/1440566040.db2.gz	YWFFQFMNBQTGNC-HOTGVXAUSA-N	0	3	338.426	3.205	20	30		EGEDHN
Cc1ccccc1C(C)(C)C(=O)N[C@@H](C)CNCC#Cc1ccccc1	ZINC001754296882	1440566578	/nfs/dbraw/zinc/56/65/78/1440566578.db2.gz	CWQSHTZDUQPBEK-IBGZPJMESA-N	0	3	348.490	3.419	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)C1(F)CCCCC1	ZINC001754330496	1440583445	/nfs/dbraw/zinc/58/34/45/1440583445.db2.gz	LPERNPXYPWZTLV-OAHLLOKOSA-N	0	3	331.435	3.167	20	30		EGEDHN
C[C@@H](CN(C)Cc1cccc(C#N)c1)NC(=O)C12CCC(CC1)CC2	ZINC001754333843	1440585623	/nfs/dbraw/zinc/58/56/23/1440585623.db2.gz	VYEMXIUIFJTOMA-BQJIDLTASA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@@H]1CCC[C@@]1(C)C(=O)NCC1(NCc2ccc(C#N)c(F)c2)CC1	ZINC001754523948	1440620540	/nfs/dbraw/zinc/62/05/40/1440620540.db2.gz	NTMLOLHHCRBCNE-AUUYWEPGSA-N	0	3	343.446	3.262	20	30		EGEDHN
C#CCC1(C(=O)NCC2(NCc3ccsc3)CC2)CCCCC1	ZINC001754536372	1440624618	/nfs/dbraw/zinc/62/46/18/1440624618.db2.gz	XYXIGFCWVDWIKW-UHFFFAOYSA-N	0	3	330.497	3.460	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)CCCc1ccccn1	ZINC001754543720	1440626726	/nfs/dbraw/zinc/62/67/26/1440626726.db2.gz	NLSLZAFPPCNVOP-MOPGFXCFSA-N	0	3	327.472	3.046	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@H]2CCC[C@@H](C1)N2C[C@@H](OCC)C1CC1	ZINC001754553176	1440630580	/nfs/dbraw/zinc/63/05/80/1440630580.db2.gz	RUQCTYUXFHXLPP-CEXWTWQISA-N	0	3	348.531	3.469	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)CCC(C)(F)F	ZINC001754596294	1440641563	/nfs/dbraw/zinc/64/15/63/1440641563.db2.gz	DVZUBVUCTLSWRR-RHSMWYFYSA-N	0	3	349.425	3.463	20	30		EGEDHN
CCCC(C)(C)C(=O)N1CCC[C@H]1CNCC#Cc1ccccc1	ZINC001754616269	1440644543	/nfs/dbraw/zinc/64/45/43/1440644543.db2.gz	VUWFZKRQQVMQHB-IBGZPJMESA-N	0	3	326.484	3.445	20	30		EGEDHN
C#CCN(C(=O)C1CCC1)C1CCN(Cc2ccc(CC)cc2)CC1	ZINC001754633483	1440648295	/nfs/dbraw/zinc/64/82/95/1440648295.db2.gz	CLVSNEHVJRPBKR-UHFFFAOYSA-N	0	3	338.495	3.475	20	30		EGEDHN
C#CCN(C(=O)[C@H](C)C(C)(F)F)C1CCN(Cc2ccccc2)CC1	ZINC001754641324	1440649150	/nfs/dbraw/zinc/64/91/50/1440649150.db2.gz	XZJXTRVLASHRTH-INIZCTEOSA-N	0	3	348.437	3.404	20	30		EGEDHN
Cc1ccc(F)c(CNC[C@@H](NC(=O)[C@@H](C)C#N)C2CCCC2)c1	ZINC001754645309	1440650022	/nfs/dbraw/zinc/65/00/22/1440650022.db2.gz	KIBABDZKMDUUFW-KBXCAEBGSA-N	0	3	331.435	3.058	20	30		EGEDHN
C=CCCC(=O)N1CCCC[C@]2(CCN(Cc3cccnc3)C2)C1	ZINC001754660283	1440654561	/nfs/dbraw/zinc/65/45/61/1440654561.db2.gz	CKGAFRIQPONZRO-HXUWFJFHSA-N	0	3	327.472	3.252	20	30		EGEDHN
C#CCCCCC(=O)N[C@]1(C)CCN(Cc2cccc(OC)c2C)C1	ZINC001754671095	1440657840	/nfs/dbraw/zinc/65/78/40/1440657840.db2.gz	BCVBQSLSXLADOW-OAQYLSRUSA-N	0	3	342.483	3.278	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)[C@@H](C)CCOc2ccccc2)C1	ZINC001754686050	1440664847	/nfs/dbraw/zinc/66/48/47/1440664847.db2.gz	XXDAFXFJDCSSCL-PXNSSMCTSA-N	0	3	330.472	3.248	20	30		EGEDHN
C#CCN1CCC(C)(CNC(=O)C[C@H](C)c2ccc(F)cc2)CC1	ZINC001754721978	1440673629	/nfs/dbraw/zinc/67/36/29/1440673629.db2.gz	HZWVMASCBMTKMR-INIZCTEOSA-N	0	3	330.447	3.171	20	30		EGEDHN
CC#CCN1CCC[C@@](C)(CNC(=O)[C@@H](CC)c2c(C)noc2C)C1	ZINC001754732080	1440680192	/nfs/dbraw/zinc/68/01/92/1440680192.db2.gz	NDUYILINRCTXCB-PXNSSMCTSA-N	0	3	345.487	3.027	20	30		EGEDHN
CC#CCN1CCC[C@@](C)(CNC(=O)[C@H](C)Cc2ccc(C)cc2)C1	ZINC001754735323	1440681995	/nfs/dbraw/zinc/68/19/95/1440681995.db2.gz	ZEMIWCBVKKWBPL-KNQAVFIVSA-N	0	3	340.511	3.415	20	30		EGEDHN
C=CCN1CCC[C@@](C)(CNC(=O)[C@@H]2Cc3c2cccc3Cl)C1	ZINC001754735254	1440682025	/nfs/dbraw/zinc/68/20/25/1440682025.db2.gz	XJNRMJLDLOUOGU-APWZRJJASA-N	0	3	332.875	3.384	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H](C2CCN(Cc3conc3C)CC2)C1	ZINC001754784769	1440687389	/nfs/dbraw/zinc/68/73/89/1440687389.db2.gz	ZMINUUPMOXJBTK-SFHVURJKSA-N	0	3	345.487	3.400	20	30		EGEDHN
C=CCN[C@H](CNC(=O)c1cnoc1CC)c1ccccc1CC	ZINC001754788761	1440688282	/nfs/dbraw/zinc/68/82/82/1440688282.db2.gz	GCNJQTNOWISPHU-QGZVFWFLSA-N	0	3	327.428	3.046	20	30		EGEDHN
CCCCCC[C@H](CC)C(=O)N1C[C@H]2CN(CC#CCOC)C[C@H]2C1	ZINC001754843534	1440698455	/nfs/dbraw/zinc/69/84/55/1440698455.db2.gz	HKEHMNYYOVWXIV-SLFFLAALSA-N	0	3	348.531	3.023	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](OCC)c1ccccc1	ZINC001754871243	1440705052	/nfs/dbraw/zinc/70/50/52/1440705052.db2.gz	GNXPKSAFNNPHNZ-OTWHNJEPSA-N	0	3	328.456	3.016	20	30		EGEDHN
N#Cc1ccccc1CNCC[C@H]1CCN(C(=O)CC2CCC2)C1	ZINC001754910858	1440708014	/nfs/dbraw/zinc/70/80/14/1440708014.db2.gz	VTLBDCMQDLESHD-KRWDZBQOSA-N	0	3	325.456	3.077	20	30		EGEDHN
C=C(Br)CNCC[C@H]1CCN(C(=O)/C=C(\C)CC)C1	ZINC001754914880	1440708469	/nfs/dbraw/zinc/70/84/69/1440708469.db2.gz	NZRUGGPJHMKENO-TZIYXEQSSA-N	0	3	329.282	3.080	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](CCNCc3oc(C)nc3C)C2)CC1	ZINC001754930244	1440710413	/nfs/dbraw/zinc/71/04/13/1440710413.db2.gz	GVDNPDZSOFZUAS-KRWDZBQOSA-N	0	3	345.487	3.366	20	30		EGEDHN
CC#CCN[C@H](C)c1ccc(CNC(=O)c2cccc3n[nH]cc32)cc1	ZINC001754948911	1440714433	/nfs/dbraw/zinc/71/44/33/1440714433.db2.gz	RVHYAQWXJWYWRI-OAHLLOKOSA-N	0	3	346.434	3.167	20	30		EGEDHN
C#CCCN(C)Cc1ccccc1CNC(=O)c1cc2c([nH]1)CCCC2	ZINC001754952730	1440715582	/nfs/dbraw/zinc/71/55/82/1440715582.db2.gz	GMYKZEOICRUDJU-UHFFFAOYSA-N	0	3	349.478	3.279	20	30		EGEDHN
C=C(C)CN(C)Cc1ccccc1CNC(=O)[C@]1(C)CCCOC1	ZINC001754955135	1440716178	/nfs/dbraw/zinc/71/61/78/1440716178.db2.gz	VDWPVKGRAAQLIR-HXUWFJFHSA-N	0	3	330.472	3.127	20	30		EGEDHN
CC[C@@H](c1ccc(F)cc1F)N(C)CCCN(C)C(=O)[C@H](C)C#N	ZINC001755035140	1440733845	/nfs/dbraw/zinc/73/38/45/1440733845.db2.gz	JTPUHXCTQQMNCD-DYVFJYSZSA-N	0	3	337.414	3.356	20	30		EGEDHN
C#CCCCCC(=O)N1CCCC[C@@H]1[C@H]1CCCN(CC#CC)C1	ZINC001755048016	1440742257	/nfs/dbraw/zinc/74/22/57/1440742257.db2.gz	SNCHCPYYRLSEBR-VQTJNVASSA-N	0	3	328.500	3.296	20	30		EGEDHN
CCC1(NCc2ncoc2C(C)C)CCN(C(=O)C#CC(C)C)CC1	ZINC001755068893	1440745927	/nfs/dbraw/zinc/74/59/27/1440745927.db2.gz	QANRBVPJKMPETD-UHFFFAOYSA-N	0	3	345.487	3.318	20	30		EGEDHN
C=CCCN1Cc2ccccc2C[C@H]1CNC(=O)CCc1cccnc1	ZINC001755075603	1440748412	/nfs/dbraw/zinc/74/84/12/1440748412.db2.gz	KAUAYESFRYBWDG-NRFANRHFSA-N	0	3	349.478	3.133	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC[C@]2(CCN(Cc3ocnc3C)C2)C1	ZINC001755079482	1440750646	/nfs/dbraw/zinc/75/06/46/1440750646.db2.gz	LASITDINDDLKAE-YLJYHZDGSA-N	0	3	345.487	3.400	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@@](CO)(NCc2cccc(C)c2)C1	ZINC001755088828	1440751153	/nfs/dbraw/zinc/75/11/53/1440751153.db2.gz	BZTBKYYATOYETR-OAQYLSRUSA-N	0	3	344.499	3.040	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@H](NCc2cccc(C(C)C)n2)[C@@H](C)C1	ZINC001755120249	1440755460	/nfs/dbraw/zinc/75/54/60/1440755460.db2.gz	CWAWHDIQDDGFON-LPHOPBHVSA-N	0	3	329.488	3.498	20	30		EGEDHN
CC1(C)CN(Cc2ccc(CF)cc2)CC[C@H]1NC(=O)C#CC1CC1	ZINC001755137892	1440759119	/nfs/dbraw/zinc/75/91/19/1440759119.db2.gz	GHKDJZCFPYBBDA-LJQANCHMSA-N	0	3	342.458	3.286	20	30		EGEDHN
Cc1cc(F)ccc1CN1CC[C@H](NC(=O)[C@@H](C)C#N)C(C)(C)C1	ZINC001755139386	1440759482	/nfs/dbraw/zinc/75/94/82/1440759482.db2.gz	HUMSIFDEHKBOHL-YOEHRIQHSA-N	0	3	331.435	3.011	20	30		EGEDHN
CCC1(C(=O)N[C@@H]2CCN(Cc3cccc(C#N)c3)CC2(C)C)CC1	ZINC001755141323	1440760565	/nfs/dbraw/zinc/76/05/65/1440760565.db2.gz	DRHGELUVGMDXGN-GOSISDBHSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)COc2cccc(C(C)C)c2)C[C@H]1C	ZINC001755161113	1440764822	/nfs/dbraw/zinc/76/48/22/1440764822.db2.gz	UTSJHUYDVUUACG-MJGOQNOKSA-N	0	3	342.483	3.181	20	30		EGEDHN
C=CCCCN1CCOC2(CCN(C(=O)C(C)(C)C(C)C)CC2)C1	ZINC001755174667	1440770282	/nfs/dbraw/zinc/77/02/82/1440770282.db2.gz	XLCYNBVGQPBHIQ-UHFFFAOYSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCCCC(=O)NC1(CO)CCN(Cc2cc(C)cc(C)c2)CC1	ZINC001755180273	1440770991	/nfs/dbraw/zinc/77/09/91/1440770991.db2.gz	YAUZHXRRUSGLAW-UHFFFAOYSA-N	0	3	344.499	3.103	20	30		EGEDHN
C=C(C)CN1CCC(CO)(NC(=O)C[C@@H](C)c2ccccc2C)CC1	ZINC001755181611	1440771203	/nfs/dbraw/zinc/77/12/03/1440771203.db2.gz	UCUGHOWPUQAGJB-GOSISDBHSA-N	0	3	344.499	3.008	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2Cc3ccccc3[C@H]2NC[C@H](C)OC)CC1	ZINC001755186888	1440773280	/nfs/dbraw/zinc/77/32/80/1440773280.db2.gz	KXLNQBVOBNQZDO-CWFSZBLJSA-N	0	3	342.483	3.140	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H]([C@H]2CCN(Cc3conc3C)C2)C1	ZINC001755203346	1440781214	/nfs/dbraw/zinc/78/12/14/1440781214.db2.gz	VALVTHXADZPZSS-SJORKVTESA-N	0	3	331.460	3.010	20	30		EGEDHN
C=CCCOCC(=O)N1CCC[C@H]1CN(C)[C@@H](C)c1ccc(F)cc1	ZINC001755203460	1440781281	/nfs/dbraw/zinc/78/12/81/1440781281.db2.gz	WVOJASRFRPZECM-LPHOPBHVSA-N	0	3	348.462	3.402	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H]([C@@H]2CCN(Cc3conc3C)C2)C1	ZINC001755203343	1440781430	/nfs/dbraw/zinc/78/14/30/1440781430.db2.gz	VALVTHXADZPZSS-DLBZAZTESA-N	0	3	331.460	3.010	20	30		EGEDHN
C=C(Cl)CNCC1CC(NC(=O)c2scnc2C(C)(C)C)C1	ZINC001755218285	1440784414	/nfs/dbraw/zinc/78/44/14/1440784414.db2.gz	YVXSMJGJLNKKJG-UHFFFAOYSA-N	0	3	341.908	3.291	20	30		EGEDHN
C[C@@H](NC(=O)CC1CCC1)[C@H](C)NCC#Cc1cccc(Cl)c1	ZINC001755229191	1440786613	/nfs/dbraw/zinc/78/66/13/1440786613.db2.gz	AAWKHTMVBPNNRK-LSDHHAIUSA-N	0	3	332.875	3.365	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)C[C@@H](C)C(F)(F)F	ZINC001755284739	1440801650	/nfs/dbraw/zinc/80/16/50/1440801650.db2.gz	CQXWHXAXGCQAKC-SNVBAGLBSA-N	0	3	328.806	3.402	20	30		EGEDHN
C[C@H](CNC(=O)c1cc(F)cc(F)c1)N(C)Cc1cccc(C#N)c1	ZINC001755325255	1440821193	/nfs/dbraw/zinc/82/11/93/1440821193.db2.gz	VVMWUHRMCAXMQN-CYBMUJFWSA-N	0	3	343.377	3.087	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@]2(CCN(C(=O)c3cc(C)c(C)o3)C2)C1	ZINC001755400125	1440842832	/nfs/dbraw/zinc/84/28/32/1440842832.db2.gz	CGQJFYLQXJPZHD-OXQOHEQNSA-N	0	3	346.471	3.168	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)[C@@H](OCC)c2ccccc2)C(C)(C)C1	ZINC001755416575	1440849114	/nfs/dbraw/zinc/84/91/14/1440849114.db2.gz	UWGNTFUMTAZWMI-ROUUACIJSA-N	0	3	330.472	3.167	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)[C@H](OCC)c2ccccc2)C(C)(C)C1	ZINC001755416576	1440849252	/nfs/dbraw/zinc/84/92/52/1440849252.db2.gz	UWGNTFUMTAZWMI-ZWKOTPCHSA-N	0	3	330.472	3.167	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCOc2cc(C)ccc2C)C(C)(C)C1	ZINC001755417029	1440849456	/nfs/dbraw/zinc/84/94/56/1440849456.db2.gz	XHEYOFKTRFGASC-GOSISDBHSA-N	0	3	330.472	3.085	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@@H]2CN(Cc3ncoc3C(C)C)C[C@@H]2C1	ZINC001755449720	1440853007	/nfs/dbraw/zinc/85/30/07/1440853007.db2.gz	IXBPNTLZHMVEBN-IXDOHACOSA-N	0	3	345.487	3.481	20	30		EGEDHN
C=CCCC(=O)N1C[C@@]2(C)CN(Cc3ncccc3C)C[C@@]2(C)C1	ZINC001755461118	1440857441	/nfs/dbraw/zinc/85/74/41/1440857441.db2.gz	YEQWWAANTRKKGH-BGYRXZFFSA-N	0	3	327.472	3.027	20	30		EGEDHN
C=C(Cl)CNC[C@H]1C[C@H](NC(=O)c2c(F)ccc(C)c2F)C1	ZINC001755478114	1440859619	/nfs/dbraw/zinc/85/96/19/1440859619.db2.gz	QWMGHRUVPMVNOI-HAQNSBGRSA-N	0	3	328.790	3.124	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC(N(C)[C@H](C)c2cnccn2)CC1	ZINC001755531980	1440867843	/nfs/dbraw/zinc/86/78/43/1440867843.db2.gz	CPHOKSWNNCYYKA-QGZVFWFLSA-N	0	3	342.487	3.044	20	30		EGEDHN
Cc1ccc(CC(=O)N(C)C[C@@H](C)NCC#Cc2ccccc2)cc1	ZINC001755598016	1440883099	/nfs/dbraw/zinc/88/30/99/1440883099.db2.gz	VJFMCNGYRQYSKJ-LJQANCHMSA-N	0	3	334.463	3.026	20	30		EGEDHN
Cc1ccsc1C(=O)N1C[C@@H](NCC#Cc2ccccc2)C[C@@H]1C	ZINC001755670121	1440893972	/nfs/dbraw/zinc/89/39/72/1440893972.db2.gz	PITJGDCTBMPEAP-WMZOPIPTSA-N	0	3	338.476	3.301	20	30		EGEDHN
Cc1cc(F)ccc1CN1CC[C@]2(NC(=O)C#CC3CC3)CCC[C@H]12	ZINC001755700165	1440899808	/nfs/dbraw/zinc/89/98/08/1440899808.db2.gz	ZIWIBPNOUMWAEG-PZJWPPBQSA-N	0	3	340.442	3.161	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)COc2cc(C)cc(C)c2)[C@@H]1C	ZINC001755720287	1440907125	/nfs/dbraw/zinc/90/71/25/1440907125.db2.gz	HDEKJPXQDNGUQV-HKUYNNGSSA-N	0	3	330.472	3.227	20	30		EGEDHN
CCC(=O)NCC[C@H](Cc1ccccc1)NCc1ccccc1C#N	ZINC001755724530	1440908914	/nfs/dbraw/zinc/90/89/14/1440908914.db2.gz	XSDRNKKIJOZUGK-HXUWFJFHSA-N	0	3	335.451	3.175	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CC[C@@H](CNCc3nccs3)C2)CCC1	ZINC001755742265	1440911910	/nfs/dbraw/zinc/91/19/10/1440911910.db2.gz	CJNQXVIVLJHKEY-HUUCEWRRSA-N	0	3	333.501	3.264	20	30		EGEDHN
Cc1cccc(C(=O)N2C[C@H](NCC#Cc3ccccc3)C(C)(C)C2)c1	ZINC001755751353	1440913276	/nfs/dbraw/zinc/91/32/76/1440913276.db2.gz	NFPBIPFVEJMTRZ-NRFANRHFSA-N	0	3	346.474	3.487	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N(CCN(C)Cc1ccc(C)cc1)C(C)C	ZINC001755811746	1440920641	/nfs/dbraw/zinc/92/06/41/1440920641.db2.gz	AFVUMMDKQKTLRS-UXHICEINSA-N	0	3	344.499	3.255	20	30		EGEDHN
C#CCCN(C)CCN(C(=O)c1cncc2sccc21)C(C)C	ZINC001755812699	1440921308	/nfs/dbraw/zinc/92/13/08/1440921308.db2.gz	SYILNOHJSOAOGX-UHFFFAOYSA-N	0	3	329.469	3.102	20	30		EGEDHN
C#CCCN(C)CCN(C(=O)[C@H](C)Cc1cccc(F)c1)C(C)C	ZINC001755815273	1440923143	/nfs/dbraw/zinc/92/31/43/1440923143.db2.gz	GDUOBKRBSSFAGW-QGZVFWFLSA-N	0	3	332.463	3.196	20	30		EGEDHN
C=CCN(C)CCN(C(=O)c1[nH]c2ccccc2c1OC)C(C)C	ZINC001755815464	1440923308	/nfs/dbraw/zinc/92/33/08/1440923308.db2.gz	LOTCQKRHTMYCHP-UHFFFAOYSA-N	0	3	329.444	3.145	20	30		EGEDHN
CC(C)C(=O)N[C@@H](CNCC#Cc1cccc(Cl)c1)C(C)(C)C	ZINC001755818507	1440924929	/nfs/dbraw/zinc/92/49/29/1440924929.db2.gz	NLOMRJYIRQOHOW-KRWDZBQOSA-N	0	3	334.891	3.468	20	30		EGEDHN
CC(C)C(=O)N[C@H](CNCC#Cc1cccc(Cl)c1)C(C)(C)C	ZINC001755818508	1440924945	/nfs/dbraw/zinc/92/49/45/1440924945.db2.gz	NLOMRJYIRQOHOW-QGZVFWFLSA-N	0	3	334.891	3.468	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](CNCC#Cc2ccccc2)C(C)(C)C)co1	ZINC001755823926	1440926496	/nfs/dbraw/zinc/92/64/96/1440926496.db2.gz	PLINXKPTUOMDDH-LJQANCHMSA-N	0	3	338.451	3.374	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCN(CCOC)[C@H](C)c2ccccc2C)C1	ZINC001755840599	1440931599	/nfs/dbraw/zinc/93/15/99/1440931599.db2.gz	DKLHQNDYTLOUQI-GOSISDBHSA-N	0	3	344.499	3.477	20	30		EGEDHN
C[C@@H](NC(=O)[C@@H](C)C1CC1)C1CCN(Cc2cccc(C#N)c2)CC1	ZINC001755843204	1440932174	/nfs/dbraw/zinc/93/21/74/1440932174.db2.gz	XVSNBLPZRWLEKQ-JKSUJKDBSA-N	0	3	339.483	3.321	20	30		EGEDHN
C[C@H](NC(=O)C#CC1CC1)C1CCN(Cc2ccc(Cl)cc2)CC1	ZINC001755846445	1440933578	/nfs/dbraw/zinc/93/35/78/1440933578.db2.gz	AEJJWIKQRQQJEO-HNNXBMFYSA-N	0	3	344.886	3.470	20	30		EGEDHN
C=CCCC(=O)N[C@@H](C)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001755847590	1440933804	/nfs/dbraw/zinc/93/38/04/1440933804.db2.gz	MNVPIPLLVXZPDX-INIZCTEOSA-N	0	3	325.456	3.241	20	30		EGEDHN
C#CCCCCC(=O)NCC1=CCN(CCc2ccccc2F)CC1	ZINC001755883246	1440939821	/nfs/dbraw/zinc/93/98/21/1440939821.db2.gz	FUXDNNQPGYCCHT-UHFFFAOYSA-N	0	3	342.458	3.310	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC1=CCN(C[C@H]2CC(C)(C)CO2)CC1	ZINC001755894529	1440942195	/nfs/dbraw/zinc/94/21/95/1440942195.db2.gz	SDRWFFSBHRSADL-QGZVFWFLSA-N	0	3	334.504	3.152	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H](C)c2cccc(C(F)(F)F)c2)CC1	ZINC000050024660	214040907	/nfs/dbraw/zinc/04/09/07/214040907.db2.gz	RAZKPZPYXSERFM-CYBMUJFWSA-N	0	3	338.373	3.228	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H](C)c2cccc(C(F)(F)F)c2)CC1	ZINC000050024659	214040248	/nfs/dbraw/zinc/04/02/48/214040248.db2.gz	RAZKPZPYXSERFM-ZDUSSCGKSA-N	0	3	338.373	3.228	20	30		EGEDHN
CS[C@H](C)C(=O)C(C#N)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000100819225	219108231	/nfs/dbraw/zinc/10/82/31/219108231.db2.gz	FIQAVPGWTHTJHJ-HQJQHLMTSA-N	0	3	331.224	3.392	20	30		EGEDHN
COc1ccc(CN(C)CCC(=O)Nc2ccccc2C#N)cc1C	ZINC000103144850	219261667	/nfs/dbraw/zinc/26/16/67/219261667.db2.gz	PGMOHOJFUMQPHF-UHFFFAOYSA-N	0	3	337.423	3.336	20	30		EGEDHN
N#Cc1cccc(NC(=O)CN[C@H](C[C@H]2CCOC2)c2ccccc2)c1	ZINC000181183248	234109105	/nfs/dbraw/zinc/10/91/05/234109105.db2.gz	FPLVQWHYQMDLJF-YLJYHZDGSA-N	0	3	349.434	3.254	20	30		EGEDHN
N#Cc1ccc(CN2CCC(NCc3cccc4c3OCO4)CC2)cc1	ZINC000181550803	234228288	/nfs/dbraw/zinc/22/82/88/234228288.db2.gz	GAHQXYKYQJEJIW-UHFFFAOYSA-N	0	3	349.434	3.041	20	30		EGEDHN
CN(C)CCN(C)C(=O)Nc1ccc(Oc2ccccc2C#N)cc1	ZINC000078510110	217065654	/nfs/dbraw/zinc/06/56/54/217065654.db2.gz	TZOVXGRATIIGTM-UHFFFAOYSA-N	0	3	338.411	3.376	20	30		EGEDHN
N#Cc1cccc(CNC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)c1	ZINC000078676595	217100584	/nfs/dbraw/zinc/10/05/84/217100584.db2.gz	CHRDNDAKKXMKQC-HXUWFJFHSA-N	0	3	348.450	3.022	20	30		EGEDHN
Cc1ccc(C#N)cc1NC(=O)NCC1(N(C)C)Cc2ccccc2C1	ZINC000266366772	248267662	/nfs/dbraw/zinc/26/76/62/248267662.db2.gz	BHHMPULEQZBDOD-UHFFFAOYSA-N	0	3	348.450	3.087	20	30		EGEDHN
CCN(C(=O)c1c[nH]c(C#N)c1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1	ZINC000378477004	169126455	/nfs/dbraw/zinc/12/64/55/169126455.db2.gz	XFSCRNQWSYJQRR-HNAYVOBHSA-N	0	3	336.439	3.184	20	30		EGEDHN
CN(C[C@@H]1CCCN1C)C(=O)Nc1ccc(OC(C)(C)C)c(C#N)c1	ZINC000421111468	269690149	/nfs/dbraw/zinc/69/01/49/269690149.db2.gz	KKAQZHHXQRTSAQ-INIZCTEOSA-N	0	3	344.459	3.293	20	30		EGEDHN
CC(C)Oc1ccc(C#N)cc1NC(=O)N(C)C[C@H]1CCCN(C)C1	ZINC000118810946	221187804	/nfs/dbraw/zinc/18/78/04/221187804.db2.gz	USABUJJESKQJJH-INIZCTEOSA-N	0	3	344.459	3.151	20	30		EGEDHN
COC(=O)COc1ccc(CN(C)[C@@H](C)c2cccc(C#N)c2)cc1	ZINC000187728650	533556677	/nfs/dbraw/zinc/55/66/77/533556677.db2.gz	BRBXLEJCKNFAAC-HNNXBMFYSA-N	0	3	338.407	3.303	20	30		EGEDHN
COCC[C@@H](NCC(=O)Nc1sc(C)c(C)c1C#N)C(C)(C)C	ZINC000338366466	141108646	/nfs/dbraw/zinc/10/86/46/141108646.db2.gz	XPPYGTXCTCGGAU-CQSZACIVSA-N	0	3	337.489	3.216	20	30		EGEDHN
CC[C@@H](CC(F)(F)F)N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000354574541	141308355	/nfs/dbraw/zinc/30/83/55/141308355.db2.gz	XZUVZNARZXBFDO-DZGCQCFKSA-N	0	3	339.361	3.374	20	30		EGEDHN
C[C@@H](NC(=O)C1(c2cccc(C#N)c2)CC1)[C@H](c1ccccc1)N(C)C	ZINC000356233336	141324462	/nfs/dbraw/zinc/32/44/62/141324462.db2.gz	PTSIMJRFXSOKHD-OXQOHEQNSA-N	0	3	347.462	3.397	20	30		EGEDHN
C[C@@H](CNC(=O)Nc1cc(C#N)cn1C(C)(C)C)N1CCC(C)CC1	ZINC000171155011	144001552	/nfs/dbraw/zinc/00/15/52/144001552.db2.gz	LZNZLXGBBLRZTR-HNNXBMFYSA-N	0	3	345.491	3.357	20	30		EGEDHN
C[C@H](CNC(=O)Nc1cc(C#N)cn1C(C)(C)C)N1CCC(C)CC1	ZINC000171155025	144001736	/nfs/dbraw/zinc/00/17/36/144001736.db2.gz	LZNZLXGBBLRZTR-OAHLLOKOSA-N	0	3	345.491	3.357	20	30		EGEDHN
N#Cc1ccc(OCCCN2CC[C@]3(C2)OCc2ccccc23)cc1	ZINC000186666331	144140394	/nfs/dbraw/zinc/14/03/94/144140394.db2.gz	AGZPHQAYMJBEBO-OAQYLSRUSA-N	0	3	334.419	3.459	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccc(F)c(C#N)c2)C1	ZINC000341101248	155157421	/nfs/dbraw/zinc/15/74/21/155157421.db2.gz	DRRBSGHPBOYSDT-KBXCAEBGSA-N	0	3	337.398	3.263	20	30		EGEDHN
CC1CCN([C@H](CNc2ccnc(C#N)c2)c2cccs2)CC1	ZINC000341344451	155244338	/nfs/dbraw/zinc/24/43/38/155244338.db2.gz	NQRHEDNSTZOAFA-QGZVFWFLSA-N	0	3	326.469	3.322	20	30		EGEDHN
CCCCNC(=O)[C@H]1CC[C@H](C)N(Cc2ccc(C#N)cc2OC)C1	ZINC000120710776	152295712	/nfs/dbraw/zinc/29/57/12/152295712.db2.gz	HSQIUZQYLHGHEE-YJBOKZPZSA-N	0	3	343.471	3.084	20	30		EGEDHN
C[C@H](N[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O)c1cccs1	ZINC000190629007	153152362	/nfs/dbraw/zinc/15/23/62/153152362.db2.gz	ROZWMFOJAJWZQX-XJKSGUPXSA-N	0	3	325.437	3.071	20	30		EGEDHN
CC[C@@H]1c2ccsc2CCN1C[C@@H](O)COc1ccc(C#N)cc1	ZINC000302807458	154029704	/nfs/dbraw/zinc/02/97/04/154029704.db2.gz	GBLKYIBDVCLAKL-CRAIPNDOSA-N	0	3	342.464	3.369	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CCN1CCOc1ccc(C#N)cc1	ZINC000303902631	154058900	/nfs/dbraw/zinc/05/89/00/154058900.db2.gz	SVJMDKPZPNZYCJ-SFHVURJKSA-N	0	3	335.451	3.143	20	30		EGEDHN
C[C@H]1[C@H](NC(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)CCCN1C	ZINC000345266033	156024859	/nfs/dbraw/zinc/02/48/59/156024859.db2.gz	MEFJJMZWQUAQKP-IINYFYTJSA-N	0	3	340.349	3.181	20	30		EGEDHN
CCCN(CCN1CCCC1)C(=O)Nc1cc(C#N)ccc1OCC	ZINC000348891888	156277469	/nfs/dbraw/zinc/27/74/69/156277469.db2.gz	KUALMNADSZAHJQ-UHFFFAOYSA-N	0	3	344.459	3.297	20	30		EGEDHN
N#Cc1csc(CN[C@@H]2CCCN(c3ccc(C#N)cc3F)C2)c1	ZINC000344238266	164134010	/nfs/dbraw/zinc/13/40/10/164134010.db2.gz	IIUVVGDTWUXOGX-OAHLLOKOSA-N	0	3	340.427	3.389	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)NC[C@@H](C)N1CCC[C@@H](C)C1	ZINC000352394924	165380584	/nfs/dbraw/zinc/38/05/84/165380584.db2.gz	WTVNQYCLGCVNNS-HUUCEWRRSA-N	0	3	344.459	3.199	20	30		EGEDHN
CCN(CC)C(=O)[C@@H](NCCc1cccc(C#N)c1)c1ccccc1	ZINC000355686820	166283282	/nfs/dbraw/zinc/28/32/82/166283282.db2.gz	VPRZILPRJJVEAN-FQEVSTJZSA-N	0	3	335.451	3.300	20	30		EGEDHN
C[C@@H]1[C@H](Cc2ccccc2)CCN1CC(=O)Nc1cccc(C#N)c1	ZINC000472343262	269863338	/nfs/dbraw/zinc/86/33/38/269863338.db2.gz	JUXFIBDDFWMLDZ-APWZRJJASA-N	0	3	333.435	3.450	20	30		EGEDHN
CCN1CCN(Cc2ccccc2CNc2ccc(C#N)cc2)CC1	ZINC000301128789	270043731	/nfs/dbraw/zinc/04/37/31/270043731.db2.gz	YHPRIYVHYMDHTJ-UHFFFAOYSA-N	0	3	334.467	3.308	20	30		EGEDHN
N#Cc1cncc(NCC2CCN(Cc3ccccc3Cl)CC2)n1	ZINC000420603657	270048605	/nfs/dbraw/zinc/04/86/05/270048605.db2.gz	QKUPBOMHGDTYHU-UHFFFAOYSA-N	0	3	341.846	3.326	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CN(C1CC1)[C@H]1CCc2ccccc21	ZINC000528410320	270060233	/nfs/dbraw/zinc/06/02/33/270060233.db2.gz	LBBOZNDEQMQIEK-FPOVZHCZSA-N	0	3	348.446	3.450	20	30		EGEDHN
CCN(Cc1c[nH]c2ccccc12)C[C@@H](O)COc1ccc(C#N)cc1	ZINC000190458263	266135725	/nfs/dbraw/zinc/13/57/25/266135725.db2.gz	SFJWHJDDVYXBLR-GOSISDBHSA-N	0	3	349.434	3.301	20	30		EGEDHN
CCN(Cc1ccc(OC)cc1)C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000279736611	266135777	/nfs/dbraw/zinc/13/57/77/266135777.db2.gz	OKMJPIOSBKUZSQ-IBGZPJMESA-N	0	3	347.418	3.298	20	30		EGEDHN
CCS[C@H]1CCC[C@H]1NCC(=O)Nc1cc(Cl)ccc1C#N	ZINC000286377480	266348176	/nfs/dbraw/zinc/34/81/76/266348176.db2.gz	YYGLWRIXLYJPKK-HIFRSBDPSA-N	0	3	337.876	3.414	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000283468065	266570669	/nfs/dbraw/zinc/57/06/69/266570669.db2.gz	IIZLTWKIAMEZIX-LJQANCHMSA-N	0	3	333.435	3.152	20	30		EGEDHN
CCCC1CCC(N(C)CC(=O)NCc2ccc(C#N)cc2)CC1	ZINC000484895051	267000137	/nfs/dbraw/zinc/00/01/37/267000137.db2.gz	MFPGYDLLJROWCL-UHFFFAOYSA-N	0	3	327.472	3.465	20	30		EGEDHN
CCC[C@@H](CCc1ccccc1)N[C@H](C(N)=O)c1ccc(C#N)cc1	ZINC000439602074	267031753	/nfs/dbraw/zinc/03/17/53/267031753.db2.gz	FBOFVWYGDDTPQI-PMACEKPBSA-N	0	3	335.451	3.476	20	30		EGEDHN
C[C@@H]1C[C@H](Nc2nc3ccccn3c2C#N)CN1Cc1ccccc1	ZINC000302147722	267092386	/nfs/dbraw/zinc/09/23/86/267092386.db2.gz	GXKZOYVCEXYOFV-WBVHZDCISA-N	0	3	331.423	3.281	20	30		EGEDHN
C[C@H](C(=O)N(Cc1ccc(C#N)cc1)C1CC1)N1[C@H](C)CC[C@@H]1C	ZINC000298696225	267125143	/nfs/dbraw/zinc/12/51/43/267125143.db2.gz	SREGAEFUUPBRMR-OWCLPIDISA-N	0	3	325.456	3.311	20	30		EGEDHN
CCOC(=O)Nc1ccc(NC(=O)[C@H](CC)N(CC)CC)cc1C#N	ZINC000493989012	267128244	/nfs/dbraw/zinc/12/82/44/267128244.db2.gz	NZZJUFFMOFYDNB-INIZCTEOSA-N	0	3	346.431	3.186	20	30		EGEDHN
CCO[C@@H]1CCCC[C@H]1NCC(=O)Nc1sc(C)c(C)c1C#N	ZINC000452036669	267146724	/nfs/dbraw/zinc/14/67/24/267146724.db2.gz	RSGMIIYZYJHDJW-HUUCEWRRSA-N	0	3	335.473	3.112	20	30		EGEDHN
C[C@H](CNC(=O)N[C@H](C)c1ccc(C#N)cc1)N1CCC[C@@H](C)C1	ZINC000298614022	267159838	/nfs/dbraw/zinc/15/98/38/267159838.db2.gz	MUAXUOLHFPYRSF-BZUAXINKSA-N	0	3	328.460	3.039	20	30		EGEDHN
C[C@H](CNC(=O)C(C#N)Cc1ccc(C#N)cc1)c1ccc(F)cc1	ZINC000279368523	267161573	/nfs/dbraw/zinc/16/15/73/267161573.db2.gz	RPOVMFORDNUYSA-KDOFPFPSSA-N	0	3	335.382	3.300	20	30		EGEDHN
C[C@H](NC(=O)C(C#N)Cc1ccc(C#N)cc1)c1cccc(F)c1F	ZINC000348418207	267175840	/nfs/dbraw/zinc/17/58/40/267175840.db2.gz	WUYUJIHAZHGUJT-SWLSCSKDSA-N	0	3	339.345	3.396	20	30		EGEDHN
CC[C@H](NC1CCC(Oc2ncccc2C#N)CC1)c1nccn1C	ZINC000527349945	267220963	/nfs/dbraw/zinc/22/09/63/267220963.db2.gz	NVHKWBYQXVQHBC-JCYILVPMSA-N	0	3	339.443	3.118	20	30		EGEDHN
CC[C@](CNCc1ccc(C#N)cc1F)(C(=O)OC)c1ccccc1	ZINC000414583157	267239819	/nfs/dbraw/zinc/23/98/19/267239819.db2.gz	HNTPZXNVRHOHKT-HXUWFJFHSA-N	0	3	340.398	3.308	20	30		EGEDHN
CCn1ccnc1[C@@H](C)NC1CCN(Cc2ccc(C#N)cc2)CC1	ZINC000449562283	267257730	/nfs/dbraw/zinc/25/77/30/267257730.db2.gz	ISHKXQINKYJZCR-MRXNPFEDSA-N	0	3	337.471	3.090	20	30		EGEDHN
CN(C)CC(C)(C)NC(=O)Nc1ccc(OC(C)(C)C)c(C#N)c1	ZINC000455764278	267279289	/nfs/dbraw/zinc/27/92/89/267279289.db2.gz	FDPHRAYMTOBGMO-UHFFFAOYSA-N	0	3	332.448	3.197	20	30		EGEDHN
CN(C)CCOc1ccccc1CNc1cccc(C#N)c1[N+](=O)[O-]	ZINC000450291971	267280335	/nfs/dbraw/zinc/28/03/35/267280335.db2.gz	UEKJIHYLMPCFLC-UHFFFAOYSA-N	0	3	340.383	3.019	20	30		EGEDHN
CN(C)C[C@H]1CCc2ccccc2N1C(=O)Cc1ccc(C#N)cc1	ZINC000425628094	267282868	/nfs/dbraw/zinc/28/28/68/267282868.db2.gz	PIQRLRBUUOJRFT-LJQANCHMSA-N	0	3	333.435	3.010	20	30		EGEDHN
CN(C)Cc1cccc(C(=O)N[C@H]2CCCc3cc(C#N)ccc32)c1	ZINC000416339450	267284289	/nfs/dbraw/zinc/28/42/89/267284289.db2.gz	HHPWVOOHRRLBHV-FQEVSTJZSA-N	0	3	333.435	3.427	20	30		EGEDHN
CN(CC(=O)NCc1cccc(C#N)c1)[C@@H]1CCC[C@H]1c1ccccc1	ZINC000459668028	267297544	/nfs/dbraw/zinc/29/75/44/267297544.db2.gz	BBVKVYQTUWOOHT-LEWJYISDSA-N	0	3	347.462	3.443	20	30		EGEDHN
COC(=O)[C@H]1CN(Cc2ccc(C#N)s2)C[C@@H]1c1ccccc1	ZINC000449752231	267389495	/nfs/dbraw/zinc/38/94/95/267389495.db2.gz	BSTOZMKCLXYYTF-SJORKVTESA-N	0	3	326.421	3.008	20	30		EGEDHN
COC(=O)[C@](C)(CN[C@H](C)c1cccc(C#N)c1)c1ccc(F)cc1	ZINC000447017698	267392859	/nfs/dbraw/zinc/39/28/59/267392859.db2.gz	PLJJOHYIINFUCK-JLTOFOAXSA-N	0	3	340.398	3.479	20	30		EGEDHN
Cc1cncc(CN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1	ZINC000275993163	267535251	/nfs/dbraw/zinc/53/52/51/267535251.db2.gz	GPRADFLSLJPRKL-UHFFFAOYSA-N	0	3	334.423	3.112	20	30		EGEDHN
COc1cc(CNC[C@@]2(O)CCC[C@H](C(F)(F)F)C2)ccc1C#N	ZINC000440638719	267593272	/nfs/dbraw/zinc/59/32/72/267593272.db2.gz	OQVSIFNTAGEJLY-GOEBONIOSA-N	0	3	342.361	3.140	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)C(=O)N[C@@H](C)CN1CCCCC1	ZINC000425465736	267859874	/nfs/dbraw/zinc/85/98/74/267859874.db2.gz	BEURQEPVIFWXGN-JKSUJKDBSA-N	0	3	328.460	3.135	20	30		EGEDHN
Cc1n[nH]c(C)c1[C@H]1CCCN1CCC(=O)Nc1cccc(C#N)c1	ZINC000411413855	268072101	/nfs/dbraw/zinc/07/21/01/268072101.db2.gz	ASWQYKPGEDVERM-QGZVFWFLSA-N	0	3	337.427	3.064	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NC23CC4CC(CC(C4)C2)C3)cc1	ZINC000279348864	268085685	/nfs/dbraw/zinc/08/56/85/268085685.db2.gz	JFUNZZOIRHZZCX-TWJKGYNYSA-N	0	3	333.435	3.326	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCC2CCC(F)(F)CC2)cc1	ZINC000337321035	268089750	/nfs/dbraw/zinc/08/97/50/268089750.db2.gz	JADFHOUJSCFRGO-MRXNPFEDSA-N	0	3	331.366	3.182	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCN2CCC[C@@H](c3ccncc3)C2)cc1	ZINC000289332127	268138093	/nfs/dbraw/zinc/13/80/93/268138093.db2.gz	KZKHJBAMZNEIJM-GOSISDBHSA-N	0	3	334.423	3.161	20	30		EGEDHN
N#Cc1ccc(N2CCN(CCc3ccc4ccccc4c3)CC2)nc1	ZINC000511666654	268234383	/nfs/dbraw/zinc/23/43/83/268234383.db2.gz	OTSFUWYUTYEPHB-UHFFFAOYSA-N	0	3	342.446	3.471	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CN1CCC[C@H]1c1cccc(F)c1	ZINC000528350185	268296063	/nfs/dbraw/zinc/29/60/63/268296063.db2.gz	DAURFQUBPCDZHZ-OALUTQOASA-N	0	3	340.398	3.274	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CN1CCC[C@H]1c1ccc(F)cc1	ZINC000528336386	268296671	/nfs/dbraw/zinc/29/66/71/268296671.db2.gz	BGTPRQMRXURENE-OALUTQOASA-N	0	3	340.398	3.274	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@H]1CCCNCc1ccc(C#N)o1	ZINC000496747678	269588280	/nfs/dbraw/zinc/58/82/80/269588280.db2.gz	GAUMJKDOQSCMFJ-CQSZACIVSA-N	0	3	333.432	3.421	20	30		EGEDHN
CC(C)[C@H]1CN(Cc2ccc(C#N)cc2Br)CCN1C	ZINC000488073065	269633761	/nfs/dbraw/zinc/63/37/61/269633761.db2.gz	KXVXHPJTDHPGAE-MRXNPFEDSA-N	0	3	336.277	3.093	20	30		EGEDHN
COc1cc(OC)c2ncc(C#N)c(N[C@@H]3CCCN(C)[C@H]3C)c2c1	ZINC000342829658	274098115	/nfs/dbraw/zinc/09/81/15/274098115.db2.gz	FCAUWJZIHCRZFS-BLLLJJGKSA-N	0	3	340.427	3.018	20	30		EGEDHN
C[C@@H]1CCC[C@H](NC(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)C1	ZINC000047034927	275140210	/nfs/dbraw/zinc/14/02/10/275140210.db2.gz	PTXNHNNQAOSEMO-APWZRJJASA-N	0	3	342.487	3.210	20	30		EGEDHN
CN1CCC[C@H](CNC(=O)c2ccccc2-c2ccccc2C#N)C1	ZINC000108326958	275174969	/nfs/dbraw/zinc/17/49/69/275174969.db2.gz	SCPDCNHKYGSNMH-MRXNPFEDSA-N	0	3	333.435	3.297	20	30		EGEDHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1ccc(C#N)c(F)c1	ZINC000353564341	278179418	/nfs/dbraw/zinc/17/94/18/278179418.db2.gz	VPDJNGPGCQKDJI-CQSZACIVSA-N	0	3	340.402	3.339	20	30		EGEDHN
C[C@@H](c1ccc(C#N)cc1)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1	ZINC000072665282	307381416	/nfs/dbraw/zinc/38/14/16/307381416.db2.gz	AFPIDMQHPLOAMF-BBRMVZONSA-N	0	3	337.383	3.109	20	30		EGEDHN
C#CCCCCN[C@H](C)c1ccc(S(=O)(=O)C(F)F)c(OC)c1	ZINC000090398443	454300028	/nfs/dbraw/zinc/30/00/28/454300028.db2.gz	XFXIOXNTCAFEOA-GFCCVEGCSA-N	0	3	345.411	3.146	20	30		EGEDHN
Cc1cc(C#N)cnc1C(=O)Nc1cccc(CN2CCCCC2)c1	ZINC000549340354	315088016	/nfs/dbraw/zinc/08/80/16/315088016.db2.gz	RCDTYVOWZAZCHC-UHFFFAOYSA-N	0	3	334.423	3.500	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2NC[C@@H](O)COCc1cccs1	ZINC000562998008	315938431	/nfs/dbraw/zinc/93/84/31/315938431.db2.gz	YPULXONXUPFAAI-APWZRJJASA-N	0	3	342.464	3.164	20	30		EGEDHN
COC(=O)C[C@@H](NCc1ccc(C#N)cc1[N+](=O)[O-])C1CCCCC1	ZINC000565043765	316254946	/nfs/dbraw/zinc/25/49/46/316254946.db2.gz	KIAWVBJQOOLPMU-MRXNPFEDSA-N	0	3	345.399	3.068	20	30		EGEDHN
CN(CCCOc1cccc(C#N)c1)Cc1ccc2c(c1)OCCO2	ZINC000565279695	316302162	/nfs/dbraw/zinc/30/21/62/316302162.db2.gz	AXIGSVIJTCZINL-UHFFFAOYSA-N	0	3	338.407	3.230	20	30		EGEDHN
Cc1ccc2c(c1)[C@@H](NC[C@@H](O)COc1ccc(C#N)cc1)CCC2	ZINC000572115147	317293185	/nfs/dbraw/zinc/29/31/85/317293185.db2.gz	SUQBAOYKJLFRQD-NQIIRXRSSA-N	0	3	336.435	3.274	20	30		EGEDHN
COC(=O)CC[C@H](CC1CCCCC1)NCc1cc(C#N)n(C)c1	ZINC000572524254	317351138	/nfs/dbraw/zinc/35/11/38/317351138.db2.gz	XSPIAGDSGFPSKB-QGZVFWFLSA-N	0	3	331.460	3.279	20	30		EGEDHN
N#Cc1ccc(S(=O)(=O)CCN[C@@H]2CC[C@H]3CCCC[C@H]3C2)cc1	ZINC000579303502	325089412	/nfs/dbraw/zinc/08/94/12/325089412.db2.gz	KVFNRXIYWLPAQA-FGTMMUONSA-N	0	3	346.496	3.280	20	30		EGEDHN
CC[C@@H](Cc1ccc(C)cc1)N(C)Cc1cnc2c(C#N)cnn2c1	ZINC000580432025	325249367	/nfs/dbraw/zinc/24/93/67/325249367.db2.gz	LWELIHUIFCNCHQ-IBGZPJMESA-N	0	3	333.439	3.363	20	30		EGEDHN
C[C@]1(Cc2ccc(F)cc2)CCCN1Cc1cnc2c(C#N)cnn2c1	ZINC000580564657	325268171	/nfs/dbraw/zinc/26/81/71/325268171.db2.gz	CTELTJARBUULDI-HXUWFJFHSA-N	0	3	349.413	3.337	20	30		EGEDHN
CN(C[C@H](O)CNc1cccc(Oc2ccc(C#N)cc2)c1)C1CC1	ZINC000580770319	325294327	/nfs/dbraw/zinc/29/43/27/325294327.db2.gz	YAMQJBGFLXKLBI-GOSISDBHSA-N	0	3	337.423	3.218	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)NCC1CCSCC1)C(C)C	ZINC000355474687	457379715	/nfs/dbraw/zinc/37/97/15/457379715.db2.gz	NKKYLALCKOOPOQ-QGZVFWFLSA-N	0	3	339.549	3.127	20	30		EGEDHN
C=CCN(C)CCN(CC)[C@@H](C)C(=O)Nc1ccccc1SC	ZINC000411640582	457936754	/nfs/dbraw/zinc/93/67/54/457936754.db2.gz	KVMXSLKUQWZUEQ-HNNXBMFYSA-N	0	3	335.517	3.175	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2c3c(nc4ccccc42)CCC3)CC1	ZINC000264527063	455229999	/nfs/dbraw/zinc/22/99/99/455229999.db2.gz	YVWKLOMMLARIMI-UHFFFAOYSA-N	0	3	335.451	3.104	20	30		EGEDHN
N#CC[C@@H]1CCCN(C[C@@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000595609116	459363399	/nfs/dbraw/zinc/36/33/99/459363399.db2.gz	GOAWNVIDBFRCPQ-GXTWGEPZSA-N	0	3	343.254	3.359	20	30		EGEDHN
N#CCCCOc1cccc(CN[C@@H]2CC(=O)N(c3ccccc3)C2)c1	ZINC000238107142	455254154	/nfs/dbraw/zinc/25/41/54/455254154.db2.gz	UFLBYWWCPUMUMP-GOSISDBHSA-N	0	3	349.434	3.264	20	30		EGEDHN
N#C[C@H]1CC[C@@H](NC[C@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000569449708	459452772	/nfs/dbraw/zinc/45/27/72/459452772.db2.gz	OLEOUTHQUKCKSQ-UHTWSYAYSA-N	0	3	329.227	3.015	20	30		EGEDHN
C=CCOc1ccc(CN2CCC[C@@H](C3(C)OCCO3)C2)cc1OC	ZINC000183244365	455258985	/nfs/dbraw/zinc/25/89/85/455258985.db2.gz	GUMOCGFSJIVWOF-QGZVFWFLSA-N	0	3	347.455	3.235	20	30		EGEDHN
CCCC[C@H](NCCNC(=O)C1N=CC=CC1=O)c1ccc(F)cc1	ZINC000180882006	455260753	/nfs/dbraw/zinc/26/07/53/455260753.db2.gz	KXEDVZRMGRUKLD-NXDJFEHLSA-N	0	3	345.418	3.173	20	30		EGEDHN
C#CCCCC(=O)Nc1ccnn1[C@H]1CCN(Cc2ccccc2)C1	ZINC000190446737	455319612	/nfs/dbraw/zinc/31/96/12/455319612.db2.gz	SENPIWYLIOXRSI-SFHVURJKSA-N	0	3	336.439	3.072	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/[C@H](C)c2nnc3ccccn32)c([O-])c1	ZINC000015149782	453559835	/nfs/dbraw/zinc/55/98/35/453559835.db2.gz	XXWFHHRMCHBUGV-GNUZOCDUSA-N	0	3	337.427	3.461	20	30		EGEDHN
CN(C)[C@H](CNc1ccc([N+](=O)[O-])cc1C#N)c1cccc(F)c1	ZINC000024107806	453726157	/nfs/dbraw/zinc/72/61/57/453726157.db2.gz	RTVNGXLINIOTGU-QGZVFWFLSA-N	0	3	328.347	3.320	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)C1(C#N)CCCC1)N1CCc2ccccc2C1	ZINC000025918498	453789779	/nfs/dbraw/zinc/78/97/79/453789779.db2.gz	WBNBZMUOEAKJLT-LJQANCHMSA-N	0	3	339.483	3.269	20	30		EGEDHN
C[C@H](c1ccc(-n2cncn2)cc1)N(C)CCOc1ccc(C#N)cc1	ZINC000026299077	453795983	/nfs/dbraw/zinc/79/59/83/453795983.db2.gz	GVJJOFFYDIXSIK-MRXNPFEDSA-N	0	3	347.422	3.211	20	30		EGEDHN
CC(C)[C@H](C)N(C)CC(=O)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000030150445	453834135	/nfs/dbraw/zinc/83/41/35/453834135.db2.gz	NHCTVLWTBANFMF-AWEZNQCLSA-N	0	3	340.389	3.149	20	30		EGEDHN
CCC(C)(C)CNC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000190783075	455381938	/nfs/dbraw/zinc/38/19/38/455381938.db2.gz	QARNWDYCLDPIQF-UHFFFAOYSA-N	0	3	330.476	3.068	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cc(OC)ccc2OCCCC)CC1	ZINC000067163359	453908707	/nfs/dbraw/zinc/90/87/07/453908707.db2.gz	DQSXDYQLRLNFJR-UHFFFAOYSA-N	0	3	344.455	3.158	20	30		EGEDHN
C[C@@H](CNC(=O)CSCc1ccc(C#N)cc1)N1CCC(C)CC1	ZINC000067270235	453916033	/nfs/dbraw/zinc/91/60/33/453916033.db2.gz	FVQCREWUNYGDCJ-INIZCTEOSA-N	0	3	345.512	3.028	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@@H](C)N1CC[C@H](COCc2ccccc2)C1	ZINC000075866428	453934267	/nfs/dbraw/zinc/93/42/67/453934267.db2.gz	ULOLBDBKPLLMIE-QUCCMNQESA-N	0	3	344.499	3.338	20	30		EGEDHN
CC[C@@H](Cc1ccc(C)cc1)N(C)CC(=O)N[C@@](C)(C#N)C1CC1	ZINC000075885872	453936101	/nfs/dbraw/zinc/93/61/01/453936101.db2.gz	TXIKTXIWBGMUHI-ICSRJNTNSA-N	0	3	327.472	3.056	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1cccc(CC#N)c1	ZINC000076389303	453995260	/nfs/dbraw/zinc/99/52/60/453995260.db2.gz	YVBXUMKUDSZODP-SFHVURJKSA-N	0	3	347.462	3.489	20	30		EGEDHN
CCO[C@H]1CCCN(CCC(=O)Nc2ccc(C#N)c(Cl)c2)C1	ZINC000076406172	453998381	/nfs/dbraw/zinc/99/83/81/453998381.db2.gz	DOWGMYKOMPTKLA-HNNXBMFYSA-N	0	3	335.835	3.041	20	30		EGEDHN
N#Cc1cccc(NC(=O)NCC2(N3CCSCC3)CCCC2)c1	ZINC000043329191	454056580	/nfs/dbraw/zinc/05/65/80/454056580.db2.gz	ZCGPHYVXOABGJD-UHFFFAOYSA-N	0	3	344.484	3.041	20	30		EGEDHN
CN(C)c1cccc(CN(C)CCC(=O)Nc2ccc(C#N)cc2)c1	ZINC000159866087	455411156	/nfs/dbraw/zinc/41/11/56/455411156.db2.gz	GDMWUJPMHZSDDH-UHFFFAOYSA-N	0	3	336.439	3.085	20	30		EGEDHN
CN(C)[C@@H](CNC(=O)Nc1ccc(F)c(C#N)c1)c1ccccc1	ZINC000077499788	454113974	/nfs/dbraw/zinc/11/39/74/454113974.db2.gz	UBJWGGQGBRURBD-KRWDZBQOSA-N	0	3	326.375	3.122	20	30		EGEDHN
N#CC1CCN(CCC(=O)Nc2ccccc2Br)CC1	ZINC000057875565	454154091	/nfs/dbraw/zinc/15/40/91/454154091.db2.gz	LHBGUGUEPPDNAU-UHFFFAOYSA-N	0	3	336.233	3.013	20	30		EGEDHN
CCn1cc(C(=O)C(C#N)c2nnc3n2CCCCC3)c2ccccc21	ZINC000058267328	454176499	/nfs/dbraw/zinc/17/64/99/454176499.db2.gz	VPDKJIJXEDHZCE-HNNXBMFYSA-N	0	3	347.422	3.469	20	30		EGEDHN
Cc1ccc(C#N)cc1NC(=O)N1CCN(CCC(C)(C)C)CC1	ZINC000058451897	454205702	/nfs/dbraw/zinc/20/57/02/454205702.db2.gz	LXNDKKAHSATDJT-UHFFFAOYSA-N	0	3	328.460	3.452	20	30		EGEDHN
C[C@H](NC[C@@H](O)c1ccc(C#N)cc1)c1cccc(N2CCCC2=O)c1	ZINC000095984703	454250137	/nfs/dbraw/zinc/25/01/37/454250137.db2.gz	YLWMDMVMKIGERO-MGPUTAFESA-N	0	3	349.434	3.069	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1cccc(CC#N)c1	ZINC000120071721	454255088	/nfs/dbraw/zinc/25/50/88/454255088.db2.gz	JXUJLFDZNSBIJH-UZLBHIALSA-N	0	3	333.435	3.003	20	30		EGEDHN
C=C[C@@H](CC(=O)N(CCN(C)C)Cc1ccccn1)c1ccccc1	ZINC000131497803	454258692	/nfs/dbraw/zinc/25/86/92/454258692.db2.gz	FTCHHXBXOOWVCZ-SFHVURJKSA-N	0	3	337.467	3.332	20	30		EGEDHN
CN(CCC(C)(C)C#N)C[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000131620081	454270377	/nfs/dbraw/zinc/27/03/77/454270377.db2.gz	RCGBLCJNQQQMRH-CYBMUJFWSA-N	0	3	344.377	3.317	20	30		EGEDHN
C[C@H]1CC[C@H](C)N1CC(=O)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000120214425	454272617	/nfs/dbraw/zinc/27/26/17/454272617.db2.gz	SDTPSVIOMQZGJY-KBPBESRZSA-N	0	3	338.373	3.046	20	30		EGEDHN
Cc1ccc(C)c(C(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)c1	ZINC000047010912	454318521	/nfs/dbraw/zinc/31/85/21/454318521.db2.gz	RLPRAAJSYYAFOA-UHFFFAOYSA-N	0	3	335.451	3.379	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)NCC#Cc2ccccc2)N(C)C)cc1	ZINC000061223276	454333194	/nfs/dbraw/zinc/33/31/94/454333194.db2.gz	FWXAATOVHGKOMQ-NRFANRHFSA-N	0	3	349.478	3.203	20	30		EGEDHN
C[C@H](CNC(=O)CSCc1ccc(C#N)cc1)N1CCC[C@@H](C)C1	ZINC000061571090	454345921	/nfs/dbraw/zinc/34/59/21/454345921.db2.gz	AVQNPEAHHRQAAW-HZPDHXFCSA-N	0	3	345.512	3.028	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)c2ccc(CN3CCCC3=O)cc2)n1	ZINC000047358018	454362528	/nfs/dbraw/zinc/36/25/28/454362528.db2.gz	YMMCKLVGTJTHRS-HNNXBMFYSA-N	0	3	339.420	3.064	20	30		EGEDHN
CN1CCN(C)c2cc(NC(=O)Nc3ccc(C#N)cc3)ccc2C1	ZINC000091043469	454370116	/nfs/dbraw/zinc/37/01/16/454370116.db2.gz	DKFQYCHMZZWDHM-UHFFFAOYSA-N	0	3	335.411	3.084	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H](C)CN1CCCCC1	ZINC000079292341	454392831	/nfs/dbraw/zinc/39/28/31/454392831.db2.gz	WPJFVTRSLJGBQH-KRWDZBQOSA-N	0	3	342.487	3.354	20	30		EGEDHN
CCCCN(CC)CC(=O)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000097205670	454425125	/nfs/dbraw/zinc/42/51/25/454425125.db2.gz	LKJJCZABRPGKHD-UHFFFAOYSA-N	0	3	340.389	3.295	20	30		EGEDHN
Cc1ccc(NC(=O)Nc2cccc(C#N)c2)c(OCCN(C)C)c1	ZINC000121367677	454426370	/nfs/dbraw/zinc/42/63/70/454426370.db2.gz	IXRCMYMAQFOCFX-UHFFFAOYSA-N	0	3	338.411	3.451	20	30		EGEDHN
CC(C)(C)CCN1CCN(C(=O)Nc2ccc(CC#N)cc2)CC1	ZINC000079512484	454429469	/nfs/dbraw/zinc/42/94/69/454429469.db2.gz	OVRCVYQNLQKZNC-UHFFFAOYSA-N	0	3	328.460	3.338	20	30		EGEDHN
CN(C)CCN(Cc1ccc(F)cc1)C(=O)Nc1ccc(C#N)cc1	ZINC000048051697	454437380	/nfs/dbraw/zinc/43/73/80/454437380.db2.gz	BRMPNAUKNICKNY-UHFFFAOYSA-N	0	3	340.402	3.293	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)C1CCCCCC1	ZINC000101860712	454486129	/nfs/dbraw/zinc/48/61/29/454486129.db2.gz	FMAQTEOKAGAQBS-UHFFFAOYSA-N	0	3	327.472	3.419	20	30		EGEDHN
CCC[C@@H]1CN(CC#Cc2ccc(Cl)cc2)CCN1CCOC	ZINC000121858855	454486254	/nfs/dbraw/zinc/48/62/54/454486254.db2.gz	HTNXPOLUIPXLFJ-LJQANCHMSA-N	0	3	334.891	3.124	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2CNCc2ccc(C#N)cc2)C[C@H](C)O1	ZINC000048816788	454518209	/nfs/dbraw/zinc/51/82/09/454518209.db2.gz	BFUNZJBQBJZNFQ-ROUUACIJSA-N	0	3	349.478	3.457	20	30		EGEDHN
CCN(CCC#N)C(=O)CN1CCC[C@H](Cc2ccc(C)cc2)C1	ZINC000065254041	454544829	/nfs/dbraw/zinc/54/48/29/454544829.db2.gz	RDWZCYKJYSIVIC-LJQANCHMSA-N	0	3	327.472	3.012	20	30		EGEDHN
C=CCc1cc(CNCc2ccc([S@](C)=O)cc2)cc(OC)c1O	ZINC000080344750	454569583	/nfs/dbraw/zinc/56/95/83/454569583.db2.gz	AEMKQZOQSQBAFT-XMMPIXPASA-N	0	3	345.464	3.157	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)OC(C)(C)C)CCN1CCCSCC#N	ZINC000134646838	454574208	/nfs/dbraw/zinc/57/42/08/454574208.db2.gz	SEDRHOPGNYLGKS-UONOGXRCSA-N	0	3	327.494	3.011	20	30		EGEDHN
CCC1CCC(N(CC(=O)N(CCC#N)CCC#N)C2CC2)CC1	ZINC000065588913	454597485	/nfs/dbraw/zinc/59/74/85/454597485.db2.gz	TZCVDLRBIXIHNC-UHFFFAOYSA-N	0	3	330.476	3.076	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CN(Cc2cccc(F)c2)C2CC2)cc1	ZINC000051425504	454624046	/nfs/dbraw/zinc/62/40/46/454624046.db2.gz	WFNSCIMRJRDLSB-IBGZPJMESA-N	0	3	340.398	3.102	20	30		EGEDHN
Cc1ccc([O-])c(C[NH2+]C2CCC(Oc3ccc(C#N)cn3)CC2)c1	ZINC000092854029	454645819	/nfs/dbraw/zinc/64/58/19/454645819.db2.gz	RYTQXEVBFJPUFV-UHFFFAOYSA-N	0	3	337.423	3.447	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CCC[C@@H]1[C@H](O)C(F)(F)F	ZINC000135205929	454646379	/nfs/dbraw/zinc/64/63/79/454646379.db2.gz	ICRXFMAEAMFNLM-CABCVRRESA-N	0	3	326.362	3.375	20	30		EGEDHN
CC1CCN(C(=O)C2CCN(Cc3ccc(C#N)cc3)CC2)CC1	ZINC000052157775	454656203	/nfs/dbraw/zinc/65/62/03/454656203.db2.gz	YDMFPMWORKBATH-UHFFFAOYSA-N	0	3	325.456	3.029	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@H]1CCCCN1CCCSCC#N	ZINC000074989914	454670749	/nfs/dbraw/zinc/67/07/49/454670749.db2.gz	JHDBVGNDZBAUOH-CQSZACIVSA-N	0	3	327.494	3.012	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2oc(Br)cc2C)CC1	ZINC000106036084	454674985	/nfs/dbraw/zinc/67/49/85/454674985.db2.gz	ZORZRKMHIQJIMI-UHFFFAOYSA-N	0	3	341.249	3.121	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC[C@@H]2CCCc3ccccc32)CC1	ZINC000106256956	454688758	/nfs/dbraw/zinc/68/87/58/454688758.db2.gz	LOLDDILNRVIGQT-SFHVURJKSA-N	0	3	341.499	3.446	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](C)c2ccc(F)cc2F)CC1	ZINC000106327301	454691284	/nfs/dbraw/zinc/69/12/84/454691284.db2.gz	HPQSTBGMINLQPQ-CYBMUJFWSA-N	0	3	337.414	3.366	20	30		EGEDHN
C=CCc1cc(CN(C)CCC(=O)OC(C)(C)C)cc(OC)c1O	ZINC000093686602	454729034	/nfs/dbraw/zinc/72/90/34/454729034.db2.gz	ZFYAULNXJBWCPI-UHFFFAOYSA-N	0	3	335.444	3.293	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC2(c3ccccc3F)CC2)CC1	ZINC000152938272	454744948	/nfs/dbraw/zinc/74/49/48/454744948.db2.gz	PZXDQTRLVAGHFI-UHFFFAOYSA-N	0	3	331.435	3.155	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H]2CCCC[C@@H]2SCC)CC1	ZINC000176486140	454751108	/nfs/dbraw/zinc/75/11/08/454751108.db2.gz	LAJMKKXYGPQJLG-IRXDYDNUSA-N	0	3	339.549	3.390	20	30		EGEDHN
N#CCCN(CCC#N)C(=O)CN[C@H](c1ccccc1)C1CCCC1	ZINC000109800882	454837101	/nfs/dbraw/zinc/83/71/01/454837101.db2.gz	CTMPQWUIDICOKF-HXUWFJFHSA-N	0	3	338.455	3.163	20	30		EGEDHN
N#Cc1ccccc1NC(=O)CCN1CCS[C@@H]2CCCC[C@@H]21	ZINC000177209348	454837506	/nfs/dbraw/zinc/83/75/06/454837506.db2.gz	CQHXGDAFPNLCOT-DLBZAZTESA-N	0	3	329.469	3.247	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN1CCC[C@@H]1c1ccncc1	ZINC000154033225	454859019	/nfs/dbraw/zinc/85/90/19/454859019.db2.gz	QIEURHGLSPTPKH-OAHLLOKOSA-N	0	3	326.425	3.180	20	30		EGEDHN
C[C@@H](NCc1ccc(N(C)CCC#N)cc1)C(=O)Nc1ccccc1	ZINC000112100260	454879666	/nfs/dbraw/zinc/87/96/66/454879666.db2.gz	IXTPYNMSRQJDTC-MRXNPFEDSA-N	0	3	336.439	3.153	20	30		EGEDHN
COc1ccc(CN2CCC[C@H]2C(C)(C)O)cc1OCCCC#N	ZINC000154466750	454900068	/nfs/dbraw/zinc/90/00/68/454900068.db2.gz	OAFWXUSWCACGCE-SFHVURJKSA-N	0	3	332.444	3.113	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H]2C[C@@H]2c2ccc(F)cc2F)CC1	ZINC000112905828	454905195	/nfs/dbraw/zinc/90/51/95/454905195.db2.gz	HFUDPFBOIFDQKB-IAGOWNOFSA-N	0	3	334.410	3.225	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cccc(C)c1[N+](=O)[O-])C(C)C	ZINC000112919903	454906292	/nfs/dbraw/zinc/90/62/92/454906292.db2.gz	JWPHCQNGEXMMKT-QGZVFWFLSA-N	0	3	345.443	3.332	20	30		EGEDHN
CN(C(=O)C1(C#N)CCCC1)C1CCN(Cc2ccccc2)CC1	ZINC000113094727	454913692	/nfs/dbraw/zinc/91/36/92/454913692.db2.gz	NKWGUEJSAAUOSX-UHFFFAOYSA-N	0	3	325.456	3.193	20	30		EGEDHN
CN(CCOCc1ccccc1)CCC(=O)Nc1ccc(C#N)cc1	ZINC000154654070	454916263	/nfs/dbraw/zinc/91/62/63/454916263.db2.gz	FVDUPQNQTGHWJM-UHFFFAOYSA-N	0	3	337.423	3.035	20	30		EGEDHN
CN(C[C@H]1CCCN(C)C1)C(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000160705309	455490245	/nfs/dbraw/zinc/49/02/45/455490245.db2.gz	SXXMZKLYMXDDAY-WMZOPIPTSA-N	0	3	328.460	3.015	20	30		EGEDHN
COc1ccc(CN(C)[C@@H](C)c2ccc(-n3cncn3)cc2)cc1C#N	ZINC000127135846	454940727	/nfs/dbraw/zinc/94/07/27/454940727.db2.gz	KFVQYKVIJCLPAQ-HNNXBMFYSA-N	0	3	347.422	3.341	20	30		EGEDHN
C[C@@H](c1ccncc1)N1CCC(NC(=O)c2cccc(CC#N)c2)CC1	ZINC000178671296	454967645	/nfs/dbraw/zinc/96/76/45/454967645.db2.gz	RDPMISCIRVFPCB-INIZCTEOSA-N	0	3	348.450	3.103	20	30		EGEDHN
N#Cc1c[nH]c(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)c1	ZINC000155457354	455004182	/nfs/dbraw/zinc/00/41/82/455004182.db2.gz	YRHVGTKBFYGKFY-UHFFFAOYSA-N	0	3	338.411	3.003	20	30		EGEDHN
COc1ccccc1[C@H](CNCc1cc(C#N)n(C)c1)OC(C)C	ZINC000191613469	455504034	/nfs/dbraw/zinc/50/40/34/455504034.db2.gz	HNMAJUXNPVNUHH-IBGZPJMESA-N	0	3	327.428	3.161	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H]2c3ccccc3CC[C@H]2C)CC1	ZINC000179357141	455038661	/nfs/dbraw/zinc/03/86/61/455038661.db2.gz	OSHUVDSRYPWCMJ-DNVCBOLYSA-N	0	3	327.472	3.260	20	30		EGEDHN
Cn1cc(CNCc2ccc(OCC#N)cc2)c(-c2cccs2)n1	ZINC000179423930	455046753	/nfs/dbraw/zinc/04/67/53/455046753.db2.gz	DFQMLIRNSJXJQM-UHFFFAOYSA-N	0	3	338.436	3.341	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCC2(c3ccccc3)CCCC2)CC1	ZINC000171706083	455087897	/nfs/dbraw/zinc/08/78/97/455087897.db2.gz	OAGKPWAMJIFNFT-UHFFFAOYSA-N	0	3	341.499	3.448	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(C(F)(F)F)nc2C)CC1	ZINC000171729113	455089571	/nfs/dbraw/zinc/08/95/71/455089571.db2.gz	IUDGDCDPBVLNPA-UHFFFAOYSA-N	0	3	341.377	3.179	20	30		EGEDHN
CCCNC(=O)C1CCN(Cc2cccc(OCCCC#N)c2)CC1	ZINC000179919366	455099281	/nfs/dbraw/zinc/09/92/81/455099281.db2.gz	JTDFHVWSJUHPOS-UHFFFAOYSA-N	0	3	343.471	3.107	20	30		EGEDHN
C=CCCCN1CCc2cc(OC)c(OC)cc2[C@@H]1CC(=O)OC	ZINC000172173629	455131621	/nfs/dbraw/zinc/13/16/21/455131621.db2.gz	HARUBENVMTXVMY-INIZCTEOSA-N	0	3	333.428	3.132	20	30		EGEDHN
Cc1ccc(F)cc1C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000129884812	455132315	/nfs/dbraw/zinc/13/23/15/455132315.db2.gz	IOJLNKYZQRKQIC-UHFFFAOYSA-N	0	3	339.414	3.210	20	30		EGEDHN
Cc1ncsc1CCN1CCC(Oc2cccc(C#N)c2)CC1	ZINC000172534545	455160403	/nfs/dbraw/zinc/16/04/03/455160403.db2.gz	LFHCRALQBITMQJ-UHFFFAOYSA-N	0	3	327.453	3.409	20	30		EGEDHN
N#CCc1ccc(NC(=O)N2CCN(C3CCCCC3)CC2)cc1	ZINC000157091335	455164387	/nfs/dbraw/zinc/16/43/87/455164387.db2.gz	OFVYNVLDJYJCHE-UHFFFAOYSA-N	0	3	326.444	3.235	20	30		EGEDHN
C[C@@H](NCCC(=O)Nc1ccc(C#N)cc1)c1cccc([N+](=O)[O-])c1	ZINC000180424486	455166363	/nfs/dbraw/zinc/16/63/63/455166363.db2.gz	PCZFMFKDIXOXSJ-CYBMUJFWSA-N	0	3	338.367	3.146	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)NCCCCC#N)c1cccc(OC)c1	ZINC000264111922	455191353	/nfs/dbraw/zinc/19/13/53/455191353.db2.gz	KMLYZUHFRGXUNB-SFHVURJKSA-N	0	3	346.475	3.071	20	30		EGEDHN
N#CCOc1ccc(CN2CCC(C(=O)Nc3ccccc3)CC2)cc1	ZINC000264185075	455194656	/nfs/dbraw/zinc/19/46/56/455194656.db2.gz	ZXISEMZCIUKGTR-UHFFFAOYSA-N	0	3	349.434	3.440	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(Cc2ccccc2F)C(C)C)CC1	ZINC000264370900	455200112	/nfs/dbraw/zinc/20/01/12/455200112.db2.gz	QZVJCVCSJLQYQB-UHFFFAOYSA-N	0	3	333.451	3.396	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccccc2CCOC)CC1	ZINC000189538482	455216740	/nfs/dbraw/zinc/21/67/40/455216740.db2.gz	XEYFQEYFIKPLGW-UHFFFAOYSA-N	0	3	331.460	3.038	20	30		EGEDHN
C[C@H](C#N)CNC1CCN(Cc2ccccc2Br)CC1	ZINC000183836363	455331111	/nfs/dbraw/zinc/33/11/11/455331111.db2.gz	MHFUIFXZMSMFOM-CYBMUJFWSA-N	0	3	336.277	3.163	20	30		EGEDHN
CN1CCCN(C(=O)Nc2cccc(C#Cc3ccccc3)c2)CC1	ZINC000181422208	455333431	/nfs/dbraw/zinc/33/34/31/455333431.db2.gz	GRYTXAMAEHHPAH-UHFFFAOYSA-N	0	3	333.435	3.256	20	30		EGEDHN
Cc1ccc([C@H](C)[NH2+][C@H]2CCN(Cc3ccc(C#N)cc3)C2=O)c([O-])c1	ZINC000190605444	455351611	/nfs/dbraw/zinc/35/16/11/455351611.db2.gz	MEYCQKJYDVGJOW-KXBFYZLASA-N	0	3	349.434	3.024	20	30		EGEDHN
Cc1cccc([C@@H](C)N[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)c1	ZINC000190616703	455354711	/nfs/dbraw/zinc/35/47/11/455354711.db2.gz	KNHHVTJHJCNLFZ-OXQOHEQNSA-N	0	3	333.435	3.318	20	30		EGEDHN
COc1ccc(CN2CC[C@@H]3OCCC[C@H]3C2)cc1OCCCC#N	ZINC000245715399	455362887	/nfs/dbraw/zinc/36/28/87/455362887.db2.gz	GVINYLXQBXITAT-ROUUACIJSA-N	0	3	344.455	3.379	20	30		EGEDHN
C[C@H](C#N)CSc1ccccc1NC(=O)N(C)CCN(C)C1CC1	ZINC000184321705	455371283	/nfs/dbraw/zinc/37/12/83/455371283.db2.gz	HXXDDTGCRZNPFD-CQSZACIVSA-N	0	3	346.500	3.496	20	30		EGEDHN
CC(C)(C#N)CN[C@H]1CCCC[C@@H](N2C(=O)c3ccccc3C2=O)C1	ZINC000612585240	460669953	/nfs/dbraw/zinc/66/99/53/460669953.db2.gz	TWJPUJXVZIOVBC-LSDHHAIUSA-N	0	3	339.439	3.123	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(c3ccccc3Br)C2)o1	ZINC000174381976	455384433	/nfs/dbraw/zinc/38/44/33/455384433.db2.gz	JGNGMPHUAIHWHY-GFCCVEGCSA-N	0	3	346.228	3.282	20	30		EGEDHN
C[C@@H](NCc1ccc(N2CCO[C@H](C)C2)nc1)c1ccc(C#N)cc1	ZINC000245908048	455395440	/nfs/dbraw/zinc/39/54/40/455395440.db2.gz	OVPHWTCIPMEMNL-HZPDHXFCSA-N	0	3	336.439	3.029	20	30		EGEDHN
CCN(CCC#N)C(=O)CN[C@H](c1ccc(Cl)cc1)[C@H]1C[C@H]1C	ZINC000245926560	455400020	/nfs/dbraw/zinc/40/00/20/455400020.db2.gz	RNQNXTNPDTZERQ-RPVQJOFSSA-N	0	3	333.863	3.389	20	30		EGEDHN
COCCOc1cccc(C(=O)C(C#N)c2cnc3ccccc3n2)c1	ZINC000190964855	455415939	/nfs/dbraw/zinc/41/59/39/455415939.db2.gz	QLOPEVGGTMJPNH-MRXNPFEDSA-N	0	3	347.374	3.145	20	30		EGEDHN
COc1cc(OC)cc(C(=O)C(C#N)c2cnc3ccccc3n2)c1	ZINC000190970618	455416702	/nfs/dbraw/zinc/41/67/02/455416702.db2.gz	NIJUSNBQQWVAHF-HNNXBMFYSA-N	0	3	333.347	3.137	20	30		EGEDHN
CC(C)n1cnnc1[C@H]1CCCN(Cc2ccc(OCC#N)cc2)C1	ZINC000266931666	455477952	/nfs/dbraw/zinc/47/79/52/455477952.db2.gz	OSMDWNNUFCBLRL-KRWDZBQOSA-N	0	3	339.443	3.141	20	30		EGEDHN
COc1ccccc1N(CCC#N)C(=O)[C@H](C)N[C@H]1CCCC1(C)C	ZINC000191853977	455526142	/nfs/dbraw/zinc/52/61/42/455526142.db2.gz	OESFYHUOCQANMJ-YJBOKZPZSA-N	0	3	343.471	3.499	20	30		EGEDHN
N#C[C@@H](NC(=O)C1CCN(Cc2ccccc2)CC1)C1CCCCC1	ZINC000267277601	455529936	/nfs/dbraw/zinc/52/99/36/455529936.db2.gz	REGGSAWGJPLDHX-HXUWFJFHSA-N	0	3	339.483	3.487	20	30		EGEDHN
N#Cc1ccc(CN2CCC(Nc3cnn(CC(F)F)c3)CC2)cc1	ZINC000182671875	455565758	/nfs/dbraw/zinc/56/57/58/455565758.db2.gz	RTLGZFCQKZLHFR-UHFFFAOYSA-N	0	3	345.397	3.096	20	30		EGEDHN
N#CCc1ccccc1C(=O)N1CCN(CC2CCCCC2)CC1	ZINC000601020618	460678370	/nfs/dbraw/zinc/67/83/70/460678370.db2.gz	VWFKHGAEHZUYDW-UHFFFAOYSA-N	0	3	325.456	3.091	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](C2CCCC2)C(F)(F)F)CC1	ZINC000185500295	455568946	/nfs/dbraw/zinc/56/89/46/455568946.db2.gz	AZZLSQCTPFRGOT-AWEZNQCLSA-N	0	3	333.398	3.057	20	30		EGEDHN
COc1ccc(CN[C@@H]2CCO[C@H]2c2ccc(F)c(F)c2)cc1C#N	ZINC000182695863	455570650	/nfs/dbraw/zinc/57/06/50/455570650.db2.gz	RPFZZCBNDSHFFN-MJGOQNOKSA-N	0	3	344.361	3.465	20	30		EGEDHN
CC(C)N(CC(=O)N(CCC#N)CCC#N)[C@H](C)c1ccccc1	ZINC000292248595	455608147	/nfs/dbraw/zinc/60/81/47/455608147.db2.gz	QSCYWEGEVRCPJK-QGZVFWFLSA-N	0	3	326.444	3.114	20	30		EGEDHN
C=CCN(C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C)C1CC1	ZINC000271354740	455609076	/nfs/dbraw/zinc/60/90/76/455609076.db2.gz	DUYOFXAWHCAFQE-LPHOPBHVSA-N	0	3	327.472	3.257	20	30		EGEDHN
Cc1ccc(C(=O)C(C(=S)[N-]C2CCC2)[n+]2ccccc2)s1	ZINC000292280036	455616651	/nfs/dbraw/zinc/61/66/51/455616651.db2.gz	HYUOQOXJHKZANS-UHFFFAOYSA-O	0	3	331.486	3.425	20	30		EGEDHN
CC[C@@H](N[C@@H]1CCC[C@H](C#N)C1)c1ccccc1OCC(=O)N(C)C	ZINC000185786617	455622165	/nfs/dbraw/zinc/62/21/65/455622165.db2.gz	MFJJIZMBPXFHSU-LZLYRXPVSA-N	0	3	343.471	3.277	20	30		EGEDHN
C#CCOc1ccccc1CN1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1	ZINC000271423640	455630933	/nfs/dbraw/zinc/63/09/33/455630933.db2.gz	ZTQLKCOMTDBMOO-QGZVFWFLSA-N	0	3	336.439	3.074	20	30		EGEDHN
N#C[C@H]1CCC[C@H](N[C@@H]2CCN(c3ccc(F)c(Cl)c3)C2=O)C1	ZINC000185879792	455640913	/nfs/dbraw/zinc/64/09/13/455640913.db2.gz	XIFJLEHDFIBMFW-MQIPJXDCSA-N	0	3	335.810	3.256	20	30		EGEDHN
CSC[C@H]1CCCN([C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)C1	ZINC000292449223	455665540	/nfs/dbraw/zinc/66/55/40/455665540.db2.gz	PFOKTYDQDURTCU-FUHWJXTLSA-N	0	3	343.496	3.129	20	30		EGEDHN
C/C(=C\c1ccccc1)CN[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000192713830	455675738	/nfs/dbraw/zinc/67/57/38/455675738.db2.gz	KLPHGZVHSWAXDX-ZDJZVTAXSA-N	0	3	345.446	3.352	20	30		EGEDHN
Cc1nc(NC2CCN(CCOC(C)C)CC2)c(Cl)cc1C#N	ZINC000292638788	455719578	/nfs/dbraw/zinc/71/95/78/455719578.db2.gz	ONUOWRKJGXOWHA-UHFFFAOYSA-N	0	3	336.867	3.216	20	30		EGEDHN
C[C@@H](NC[C@@H]1CN(Cc2ccccc2)CCO1)c1ccc(C#N)cc1	ZINC000271703242	455728383	/nfs/dbraw/zinc/72/83/83/455728383.db2.gz	UJRKOKYPYPHCKE-DYESRHJHSA-N	0	3	335.451	3.110	20	30		EGEDHN
COC(=O)N1CCC([C@H](C)NCc2ccc(Cl)cc2C#N)CC1	ZINC000186376870	455755394	/nfs/dbraw/zinc/75/53/94/455755394.db2.gz	PLMJNBXYJPEBHZ-LBPRGKRZSA-N	0	3	335.835	3.168	20	30		EGEDHN
C=CCc1cc(CN2CCCC[C@@H]2CC(=O)NCC)cc(OC)c1O	ZINC000284882268	455756097	/nfs/dbraw/zinc/75/60/97/455756097.db2.gz	FBXIODWILODVKZ-QGZVFWFLSA-N	0	3	346.471	3.010	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCc3cc(F)ccc3[C@H]2C)CC1	ZINC000606511195	460690300	/nfs/dbraw/zinc/69/03/00/460690300.db2.gz	KWXSPDHNCWAFOL-CQSZACIVSA-N	0	3	331.435	3.105	20	30		EGEDHN
CC[C@H](NC[C@@H](O)COc1ccc(F)cc1)c1ccc(C#N)cc1	ZINC000278253495	455798754	/nfs/dbraw/zinc/79/87/54/455798754.db2.gz	MTYBMCFKWORANA-MJGOQNOKSA-N	0	3	328.387	3.178	20	30		EGEDHN
CC[C@@H](NC[C@@H](O)COc1ccc(F)cc1)c1ccc(C#N)cc1	ZINC000278253492	455799306	/nfs/dbraw/zinc/79/93/06/455799306.db2.gz	MTYBMCFKWORANA-IEBWSBKVSA-N	0	3	328.387	3.178	20	30		EGEDHN
N#C[C@@]1(C(=O)NC2CCN(Cc3ccccc3)CC2)CC12CCCC2	ZINC000294232283	455808316	/nfs/dbraw/zinc/80/83/16/455808316.db2.gz	MHEQYIDCHFPSRY-OAQYLSRUSA-N	0	3	337.467	3.241	20	30		EGEDHN
N#C[C@]1(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)CC12CCCC2	ZINC000294454210	455815622	/nfs/dbraw/zinc/81/56/22/455815622.db2.gz	PBQCAMNDTQEQFV-RXVVDRJESA-N	0	3	337.467	3.414	20	30		EGEDHN
N#C[C@@]1(C(=O)NC[C@H](c2ccccc2)N2CCCC2)CC12CCCC2	ZINC000294454216	455816229	/nfs/dbraw/zinc/81/62/29/455816229.db2.gz	PBQCAMNDTQEQFV-WIYYLYMNSA-N	0	3	337.467	3.414	20	30		EGEDHN
COc1cccc(CNCc2cn(CCC#N)nc2-c2ccncc2)c1	ZINC000278597610	455842059	/nfs/dbraw/zinc/84/20/59/455842059.db2.gz	HQERGTYTMPYDJX-UHFFFAOYSA-N	0	3	347.422	3.157	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cc(C)cc(OC)c2C)CC1	ZINC000278663806	455844460	/nfs/dbraw/zinc/84/44/60/455844460.db2.gz	NLANHHJWSUTVHN-UHFFFAOYSA-N	0	3	331.460	3.474	20	30		EGEDHN
Cc1sc(NC(=O)CN[C@@](C)(CO)C2CCCCC2)c(C#N)c1C	ZINC000269428827	455846985	/nfs/dbraw/zinc/84/69/85/455846985.db2.gz	KTIOXGDSTPNZSU-SFHVURJKSA-N	0	3	349.500	3.096	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N2CCN(C3CCC3)C[C@H](C)C2)cc1	ZINC000295430811	455848666	/nfs/dbraw/zinc/84/86/66/455848666.db2.gz	NJCOSZWCAFCOGZ-KRWDZBQOSA-N	0	3	342.483	3.127	20	30		EGEDHN
FC(F)(F)Oc1ccc(C#CCN2CCC3(C2)CCOCC3)cc1	ZINC000269621812	455850606	/nfs/dbraw/zinc/85/06/06/455850606.db2.gz	NWMZEROZWOOUOC-UHFFFAOYSA-N	0	3	339.357	3.439	20	30		EGEDHN
CN(C)[C@H](CNC(=O)NC1(c2cccc(C#N)c2)CC1)c1ccccc1	ZINC000269666054	455851907	/nfs/dbraw/zinc/85/19/07/455851907.db2.gz	KQTJZZLTIIDJNS-LJQANCHMSA-N	0	3	348.450	3.149	20	30		EGEDHN
CC(C)(CNC(=O)C(C#N)Cc1ccc(C#N)cc1)c1ccccc1F	ZINC000279364992	455863764	/nfs/dbraw/zinc/86/37/64/455863764.db2.gz	RIFWEINVTIOHEK-KRWDZBQOSA-N	0	3	349.409	3.474	20	30		EGEDHN
C#CCCOc1ccc(C(=O)Nc2ccccc2CCN(C)C)cc1	ZINC000295973353	455865471	/nfs/dbraw/zinc/86/54/71/455865471.db2.gz	NQPDPOWXNKZREP-UHFFFAOYSA-N	0	3	336.435	3.445	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NC1CCN(Cc2ccccc2)CC1)OCC	ZINC000270152533	455890012	/nfs/dbraw/zinc/89/00/12/455890012.db2.gz	WHNBRGPLFXAGHM-LJQANCHMSA-N	0	3	330.472	3.139	20	30		EGEDHN
C=CCOc1cccc(CN2CCC[C@@H](c3nc(N(C)C)no3)C2)c1	ZINC000194937478	455903195	/nfs/dbraw/zinc/90/31/95/455903195.db2.gz	OXWDMXNYAWVFNI-MRXNPFEDSA-N	0	3	342.443	3.080	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2C[C@H]2c2cccc(F)c2)CC1	ZINC000194955750	455905295	/nfs/dbraw/zinc/90/52/95/455905295.db2.gz	LPJQJWVQPDFWSI-ZWKOTPCHSA-N	0	3	331.435	3.021	20	30		EGEDHN
C=C(C)[C@H](CC(=O)Nc1ccc(C)cc1OCCN(C)C)OCC	ZINC000270229464	455908235	/nfs/dbraw/zinc/90/82/35/455908235.db2.gz	VAPFSUXYUGAGFX-KRWDZBQOSA-N	0	3	334.460	3.245	20	30		EGEDHN
CCc1nc([C@H](C)NC(=O)C(C#N)Cc2ccc(C#N)cc2)cs1	ZINC000280219580	455919987	/nfs/dbraw/zinc/91/99/87/455919987.db2.gz	AMFOUDZXLHVOCG-WFASDCNBSA-N	0	3	338.436	3.137	20	30		EGEDHN
C[C@H]1CCN(C(=O)c2ccc(CC#N)cc2)CCN1Cc1ccccc1	ZINC000270311066	455926241	/nfs/dbraw/zinc/92/62/41/455926241.db2.gz	FQLGHACAUFBKSD-SFHVURJKSA-N	0	3	347.462	3.489	20	30		EGEDHN
C=C(Br)CNC[C@@]1(C)CCN(C(=O)OC(C)(C)C)C1	ZINC000195201320	455932639	/nfs/dbraw/zinc/93/26/39/455932639.db2.gz	VLJCXRPIIJUAJZ-CQSZACIVSA-N	0	3	333.270	3.132	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1C[C@H]2CCCN2Cc2ccccc21)OCC	ZINC000270372854	455941258	/nfs/dbraw/zinc/94/12/58/455941258.db2.gz	ULTUPLRVOWGVBP-MJGOQNOKSA-N	0	3	328.456	3.369	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)c1ccc(CC#N)cc1	ZINC000270381752	455943544	/nfs/dbraw/zinc/94/35/44/455943544.db2.gz	PUCXIGOWDJKCQA-DYESRHJHSA-N	0	3	347.462	3.393	20	30		EGEDHN
C#CC[C@@H](NC(=O)N1CC[C@H](N2CCCCC2)C1)c1ccccc1	ZINC000270403826	455948059	/nfs/dbraw/zinc/94/80/59/455948059.db2.gz	KAWORPDATHNZGS-RBUKOAKNSA-N	0	3	325.456	3.021	20	30		EGEDHN
CN(Cc1ccccc1)CC(C)(C)NC(=O)c1ccc(CC#N)cc1	ZINC000270507209	455971373	/nfs/dbraw/zinc/97/13/73/455971373.db2.gz	KZYBADLMBSHNLH-UHFFFAOYSA-N	0	3	335.451	3.393	20	30		EGEDHN
C#CCCCCC(=O)N[C@H](CN1CCCC1)c1ccc(OC)cc1	ZINC000272659715	456029266	/nfs/dbraw/zinc/02/92/66/456029266.db2.gz	OJVSHBUTSIZZEE-LJQANCHMSA-N	0	3	328.456	3.142	20	30		EGEDHN
C#CCN1CCC(C(=O)NC[C@H](C)Oc2ccc(C(C)C)cc2)CC1	ZINC000287108436	456061348	/nfs/dbraw/zinc/06/13/48/456061348.db2.gz	PSLCWJAWIUZINB-KRWDZBQOSA-N	0	3	342.483	3.039	20	30		EGEDHN
C[C@H]1[C@@H](NC(=O)c2ccc(CC#N)cc2)CCN1Cc1ccccc1	ZINC000288024674	456085071	/nfs/dbraw/zinc/08/50/71/456085071.db2.gz	CIDRITMMZUOTHU-JXFKEZNVSA-N	0	3	333.435	3.145	20	30		EGEDHN
C#Cc1ccc(CN2CCC[C@@H](c3nnc4n3CCCCC4)C2)cc1	ZINC000289128371	456116638	/nfs/dbraw/zinc/11/66/38/456116638.db2.gz	OHBGRSHRVPMCSW-LJQANCHMSA-N	0	3	334.467	3.365	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)Cc1ccc(C#N)cc1F	ZINC000289799097	456141890	/nfs/dbraw/zinc/14/18/90/456141890.db2.gz	MPDLGLHDTCVNIY-UHFFFAOYSA-N	0	3	336.414	3.133	20	30		EGEDHN
C[C@H](N[C@@H]1[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]21)c1cccc(C#N)c1	ZINC000297214060	456152055	/nfs/dbraw/zinc/15/20/55/456152055.db2.gz	GVEFXCLIPGADGE-KKBVYLPWSA-N	0	3	327.428	3.074	20	30		EGEDHN
C=CCOc1c(Br)cc(CNCCCC#N)cc1OC	ZINC000273086525	456174720	/nfs/dbraw/zinc/17/47/20/456174720.db2.gz	RRPJEYRCHBSYMK-UHFFFAOYSA-N	0	3	339.233	3.416	20	30		EGEDHN
CCc1nnc(NC[C@H](c2ccc(F)cc2)N(C)C)c(C#N)c1CC	ZINC000301610103	456160659	/nfs/dbraw/zinc/16/06/59/456160659.db2.gz	BXXAEXICVOBKOE-GOSISDBHSA-N	0	3	341.434	3.327	20	30		EGEDHN
COc1ccc([C@@H](CN2CCCC2)NC(=O)c2cccc(C#N)c2)cc1	ZINC000271257106	456193751	/nfs/dbraw/zinc/19/37/51/456193751.db2.gz	GDFIZJQQZOBZJU-HXUWFJFHSA-N	0	3	349.434	3.134	20	30		EGEDHN
C=CC[C@H](CC)NC(=O)N(Cc1ccncc1)C[C@@H]1CCCN1CC	ZINC000281342057	456206454	/nfs/dbraw/zinc/20/64/54/456206454.db2.gz	MADCDABPILEEIY-OALUTQOASA-N	0	3	344.503	3.432	20	30		EGEDHN
C#CC[C@@H](NC(=O)N(C)[C@H](C)C1CCN(C)CC1)c1ccccc1	ZINC000273406846	456228999	/nfs/dbraw/zinc/22/89/99/456228999.db2.gz	HSTKNOHVVBPXTL-VQIMIIECSA-N	0	3	327.472	3.123	20	30		EGEDHN
CC1CCN([C@H](CNc2nccnc2C#N)c2cccs2)CC1	ZINC000263809909	456230655	/nfs/dbraw/zinc/23/06/55/456230655.db2.gz	MZLOKTKDILCYIR-OAHLLOKOSA-N	0	3	327.457	3.295	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1CNC(=O)c1oc2ccccc2c1CN(C)C	ZINC000281435570	456233771	/nfs/dbraw/zinc/23/37/71/456233771.db2.gz	NXAJAZWDZYMQON-KSSFIOAISA-N	0	3	342.439	3.205	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccccc2OCCF)CC1	ZINC000297500047	456235968	/nfs/dbraw/zinc/23/59/68/456235968.db2.gz	URFIXIAJTAPELF-UHFFFAOYSA-N	0	3	335.423	3.197	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN[C@H]1c2ccccc2CC12CCOCC2	ZINC000290095842	456238961	/nfs/dbraw/zinc/23/89/61/456238961.db2.gz	IEYYJFWZDCIOKT-FQEVSTJZSA-N	0	3	342.483	3.095	20	30		EGEDHN
Cc1nnc([C@H](C)NC2CCN(Cc3ccc(C#N)cc3)CC2)s1	ZINC000274223810	456252420	/nfs/dbraw/zinc/25/24/20/456252420.db2.gz	ONPBLUIWNUQCAQ-ZDUSSCGKSA-N	0	3	341.484	3.033	20	30		EGEDHN
C#C[C@@H](N[C@H](C)CC(=O)Nc1cc(OC)ccc1OC)C(C)(C)C	ZINC000290157215	456255254	/nfs/dbraw/zinc/25/52/54/456255254.db2.gz	LPDRWYGINRRNAE-CXAGYDPISA-N	0	3	332.444	3.058	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000290286772	456280250	/nfs/dbraw/zinc/28/02/50/456280250.db2.gz	DQYHOBWWTKIZQR-PGRDOPGGSA-N	0	3	346.474	3.380	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1C[C@H](C)CC[C@@H]1c1ccccc1	ZINC000352801778	456322484	/nfs/dbraw/zinc/32/24/84/456322484.db2.gz	UFLNIHGTUYQVAH-ZHALLVOQSA-N	0	3	327.472	3.468	20	30		EGEDHN
C=CCN1CC[C@@H](N[C@@H](Cc2ccccc2)c2cccs2)C1=O	ZINC000337205218	456338611	/nfs/dbraw/zinc/33/86/11/456338611.db2.gz	KAQIPWXDBJCBPR-SJORKVTESA-N	0	3	326.465	3.408	20	30		EGEDHN
Cc1ccccc1CN1CCN(CCCC2(C#N)CCOCC2)CC1	ZINC000282020082	456391395	/nfs/dbraw/zinc/39/13/95/456391395.db2.gz	PDGOGFTXXOJZJN-UHFFFAOYSA-N	0	3	341.499	3.213	20	30		EGEDHN
N#Cc1c(NC[C@H]2CCCCN2C2CC2)nc2cc(Cl)ccn21	ZINC000343108876	456412119	/nfs/dbraw/zinc/41/21/19/456412119.db2.gz	SHIIBBFQGAFQCB-CQSZACIVSA-N	0	3	329.835	3.288	20	30		EGEDHN
Cc1ccc(CCC2CCN([C@H](C)C(=O)N(C)CCC#N)CC2)cc1	ZINC000303003084	456441427	/nfs/dbraw/zinc/44/14/27/456441427.db2.gz	YTMQDPGSFJOEHT-GOSISDBHSA-N	0	3	341.499	3.400	20	30		EGEDHN
N#Cc1cc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)C2)ccc1F	ZINC000343171911	456451593	/nfs/dbraw/zinc/45/15/93/456451593.db2.gz	KCRHCKYZZRLYQM-QGZVFWFLSA-N	0	3	338.386	3.093	20	30		EGEDHN
C=CCC(C)(C)C(=O)N(C)C[C@@H]1CCCN(CC)[C@H]1c1cnn(C)c1	ZINC000348067626	456453350	/nfs/dbraw/zinc/45/33/50/456453350.db2.gz	DKOMKXWCESBKNJ-FUHWJXTLSA-N	0	3	346.519	3.254	20	30		EGEDHN
CCN1CCN(c2ccc(F)cc2[C@H](C)N[C@H](C)CCC#N)CC1	ZINC000276364702	456457674	/nfs/dbraw/zinc/45/76/74/456457674.db2.gz	ZQOZHTSSRHDBDC-CVEARBPZSA-N	0	3	332.467	3.310	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)N[C@H](C)CN1CCC[C@@H](C)C1	ZINC000303467155	456461177	/nfs/dbraw/zinc/46/11/77/456461177.db2.gz	MVQFDZFYTUBXHZ-IAGOWNOFSA-N	0	3	345.487	3.171	20	30		EGEDHN
C=CCN(CCc1ccccc1)C(=O)NC[C@@H]1CCCCN1CC	ZINC000303483216	456463894	/nfs/dbraw/zinc/46/38/94/456463894.db2.gz	QHOORAYTKZSCQW-IBGZPJMESA-N	0	3	329.488	3.301	20	30		EGEDHN
C=CCCN(C)CC(=O)N1CCC[C@H]1c1ccc2c(c1)OCCCO2	ZINC000276402855	456470665	/nfs/dbraw/zinc/47/06/65/456470665.db2.gz	KSTKCCLPMKPGGM-KRWDZBQOSA-N	0	3	344.455	3.019	20	30		EGEDHN
N#CC1CCC(CNC(=O)c2cccc(CN3CCCC3)c2)CC1	ZINC000282406914	456503313	/nfs/dbraw/zinc/50/33/13/456503313.db2.gz	RYPKLIWGEIJNQF-UHFFFAOYSA-N	0	3	325.456	3.342	20	30		EGEDHN
C=CC1CCN([C@H](C)C(=O)NC(=O)Nc2ccc(C)cc2C)CC1	ZINC000348184650	456523197	/nfs/dbraw/zinc/52/31/97/456523197.db2.gz	KRXVCJPYAAQIOG-OAHLLOKOSA-N	0	3	329.444	3.238	20	30		EGEDHN
CN1CC=C(CNC(=O)Nc2ccccc2C#Cc2ccccc2)CC1	ZINC000343321840	456529813	/nfs/dbraw/zinc/52/98/13/456529813.db2.gz	XWEPFASOXASHGX-UHFFFAOYSA-N	0	3	345.446	3.470	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000337794463	456550868	/nfs/dbraw/zinc/55/08/68/456550868.db2.gz	CLCGPRMGIJOVGS-IBGZPJMESA-N	0	3	333.435	3.261	20	30		EGEDHN
COc1cc(CN[C@@H]2C[C@H](C)N(Cc3ccccc3)C2)ccc1C#N	ZINC000353215013	456564966	/nfs/dbraw/zinc/56/49/66/456564966.db2.gz	VQNQFBOQYJBYKF-OXJNMPFZSA-N	0	3	335.451	3.319	20	30		EGEDHN
C=CCN(CCc1ccco1)C[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000282640882	456578754	/nfs/dbraw/zinc/57/87/54/456578754.db2.gz	BPLUECCZONLUCF-SFHVURJKSA-N	0	3	338.451	3.472	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@H](N[C@H](Cc1ccccc1)[C@H](O)C(F)F)CC2	ZINC000353250727	456587210	/nfs/dbraw/zinc/58/72/10/456587210.db2.gz	GICYJRNTTNPMNV-QRVBRYPASA-N	0	3	342.389	3.372	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNCc1cn(C)nc1C(F)F)C(C)C	ZINC000291315609	456602371	/nfs/dbraw/zinc/60/23/71/456602371.db2.gz	YHRMEPYCDIQEDN-HNNXBMFYSA-N	0	3	326.435	3.146	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNCc1cn(C)nc1C(F)F)C(C)C	ZINC000291315612	456602788	/nfs/dbraw/zinc/60/27/88/456602788.db2.gz	YHRMEPYCDIQEDN-OAHLLOKOSA-N	0	3	326.435	3.146	20	30		EGEDHN
C#CCCOc1ccc(CN2CC[C@](CO)(c3ccccc3)C2)cc1	ZINC000291339192	456611377	/nfs/dbraw/zinc/61/13/77/456611377.db2.gz	VPSUOJSMUBWXBG-QFIPXVFZSA-N	0	3	335.447	3.225	20	30		EGEDHN
C[C@H](NC[C@H](O)COc1ccccc1C#N)c1ccccc1Cl	ZINC000320417414	456629542	/nfs/dbraw/zinc/62/95/42/456629542.db2.gz	RVQZYLLVFCBKHZ-ZFWWWQNUSA-N	0	3	330.815	3.302	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N[C@H](C)c1ccncc1F)C(C)C	ZINC000338080262	456659108	/nfs/dbraw/zinc/65/91/08/456659108.db2.gz	BFICYIGBWMFRMC-CRAIPNDOSA-N	0	3	348.466	3.280	20	30		EGEDHN
CO[C@@H]1CCCC[C@@H]1N[C@@H](C)C(=O)N(CCC#N)c1ccc(F)cc1	ZINC000277083335	456675429	/nfs/dbraw/zinc/67/54/29/456675429.db2.gz	YFEQNQPQIWLINT-JCGIZDLHSA-N	0	3	347.434	3.008	20	30		EGEDHN
C=CCC[C@@H](NCCCN1C(=O)NC2(CCCC2)C1=O)c1ccco1	ZINC000353444957	456699001	/nfs/dbraw/zinc/69/90/01/456699001.db2.gz	HLVZNQDYPRRKRQ-OAHLLOKOSA-N	0	3	345.443	3.131	20	30		EGEDHN
N#Cc1cccc(NC(=O)CN[C@H]2CCC[C@H]2OCc2ccccc2)c1	ZINC000348520353	456732667	/nfs/dbraw/zinc/73/26/67/456732667.db2.gz	JFHKYVWUWKZUNX-VQTJNVASSA-N	0	3	349.434	3.224	20	30		EGEDHN
CC(C)(C)n1cc(C(=O)NCCN2CCC3(CCCCC3)CC2)nn1	ZINC000328688947	456738763	/nfs/dbraw/zinc/73/87/63/456738763.db2.gz	CUQKDZGOFPTAMS-UHFFFAOYSA-N	0	3	347.507	3.384	20	30		EGEDHN
O=C(CCC(=O)N1CCC[C@H]1CN1CCCCC1)NC1CCCC1	ZINC000328796696	456763444	/nfs/dbraw/zinc/76/34/44/456763444.db2.gz	UZZOATQRFDZEKH-KRWDZBQOSA-N	0	3	335.492	3.143	20	30		EGEDHN
C[C@H](N[C@@H](C)[C@@H]1CCOC1)C(=O)Nc1sc2c(c1C#N)CCC2	ZINC000328814249	456766763	/nfs/dbraw/zinc/76/67/63/456766763.db2.gz	NJVKJOWKFRETKM-SDDRHHMPSA-N	0	3	333.457	3.100	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CNC(C)(C)c1ccc(C)nc1	ZINC000353578015	456777406	/nfs/dbraw/zinc/77/74/06/456777406.db2.gz	CDDVRQLLEMGCBT-IBGZPJMESA-N	0	3	340.467	3.383	20	30		EGEDHN
Cc1cc(C)cc(N(CCC#N)C(=O)CN2CC[C@@H](C3CC3)C2)c1	ZINC000343997103	456787548	/nfs/dbraw/zinc/78/75/48/456787548.db2.gz	ACKAZIVKRCKYRJ-GOSISDBHSA-N	0	3	325.456	3.282	20	30		EGEDHN
Cc1cc(C)n([C@H](C)C(=O)N[C@@H]2CN(C)C[C@H]2c2ccccc2)n1	ZINC000328993237	456808159	/nfs/dbraw/zinc/80/81/59/456808159.db2.gz	VTYVCKHNSQPGOL-BPQIPLTHSA-N	0	3	326.444	3.115	20	30		EGEDHN
CC(C)N(CCOCCO)Cc1ccc(-c2ccccc2C#N)cc1	ZINC000338586114	456842487	/nfs/dbraw/zinc/84/24/87/456842487.db2.gz	YPESMZFVPXKWCV-UHFFFAOYSA-N	0	3	338.451	3.445	20	30		EGEDHN
Cn1ccc(CCC(=O)NCCN2CCC3(CCCCC3)CC2)n1	ZINC000329192403	456851016	/nfs/dbraw/zinc/85/10/16/456851016.db2.gz	SAACWVPSLMXIFB-UHFFFAOYSA-N	0	3	332.492	3.356	20	30		EGEDHN
C[C@H](NC(=O)[C@@H]1CC(=O)N(C2CCC(C)CC2)C1)C1=CCN(C)CC1	ZINC000329263994	456862921	/nfs/dbraw/zinc/86/29/21/456862921.db2.gz	BOTVDUWLVDSTQY-HILOLKJVSA-N	0	3	347.503	3.021	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC(C)(C)c2ccccc2F)CC1	ZINC000292157003	456871539	/nfs/dbraw/zinc/87/15/39/456871539.db2.gz	CTBGYMRLSWZFKZ-UHFFFAOYSA-N	0	3	333.451	3.401	20	30		EGEDHN
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C2CCCC2)[C@@]12CCCO2	ZINC000329545113	456906563	/nfs/dbraw/zinc/90/65/63/456906563.db2.gz	ZEUDZDIIBMLKKQ-BMFAXAFESA-N	0	3	336.476	3.077	20	30		EGEDHN
COc1ccc([C@H](CNC(=O)[C@@H]2C[C@@]23CCOC3)N2CCCC2)cc1	ZINC000329645121	456920461	/nfs/dbraw/zinc/92/04/61/456920461.db2.gz	IPPCINQZHMAPSN-CMKODMSKSA-N	0	3	344.455	3.215	20	30		EGEDHN
[O-]C(N[C@H]1CCSc2ccc(F)cc21)=[NH+][C@@H]1CCc2nc[nH]c2C1	ZINC000329732442	456933174	/nfs/dbraw/zinc/93/31/74/456933174.db2.gz	QDRFRDQFLLIGIH-YPMHNXCESA-N	0	3	346.431	3.147	20	30		EGEDHN
[O-]C(N[C@H]1CCSc2ccc(F)cc21)=[NH+][C@@H]1CCc2[nH]cnc2C1	ZINC000329732442	456933177	/nfs/dbraw/zinc/93/31/77/456933177.db2.gz	QDRFRDQFLLIGIH-YPMHNXCESA-N	0	3	346.431	3.147	20	30		EGEDHN
Cc1ccccc1[C@H]1C[C@H]([NH+]=C([O-])NC[C@@H]2CCc3nccn3C2)C1	ZINC000329818654	456945877	/nfs/dbraw/zinc/94/58/77/456945877.db2.gz	XFJYKWNPVGPTKC-ULQDDVLXSA-N	0	3	338.455	3.204	20	30		EGEDHN
O=C(NC1CCN(C2CCCC2)CC1)[C@H]1CCC(=O)c2cccn21	ZINC000329864853	456952891	/nfs/dbraw/zinc/95/28/91/456952891.db2.gz	SXORFEWDAIGJOF-QGZVFWFLSA-N	0	3	329.444	3.369	20	30		EGEDHN
O=C(NC1CCN(C2CCCC2)CC1)[C@@H]1CCC(=O)c2cccn21	ZINC000329864852	456952960	/nfs/dbraw/zinc/95/29/60/456952960.db2.gz	SXORFEWDAIGJOF-KRWDZBQOSA-N	0	3	329.444	3.369	20	30		EGEDHN
C[C@@H](C1CCN(C)CC1)N(C)C(=O)C1CCC(NC(=O)C2CC2)CC1	ZINC000330011598	456973766	/nfs/dbraw/zinc/97/37/66/456973766.db2.gz	JEJINMNHOROZPS-NNGSBXSVSA-N	0	3	349.519	3.100	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N(CCN(C)C)Cc1ccccc1F)OCC	ZINC000339207158	456992282	/nfs/dbraw/zinc/99/22/82/456992282.db2.gz	GXSCEGOAKHQIND-SFHVURJKSA-N	0	3	336.451	3.087	20	30		EGEDHN
CN1CC[C@@H]2[C@H](CCCN2C(=O)C[C@@H](CC#N)c2ccccc2)C1	ZINC000356464980	457001837	/nfs/dbraw/zinc/00/18/37/457001837.db2.gz	UZDRPRLLBHQCEV-GUDVDZBRSA-N	0	3	325.456	3.017	20	30		EGEDHN
C=C(C)COc1cc(CN[C@H](CC)[C@H](O)C(F)(F)F)ccc1OC	ZINC000345859334	457002079	/nfs/dbraw/zinc/00/20/79/457002079.db2.gz	SGUAHLLOLBPUQZ-CJNGLKHVSA-N	0	3	347.377	3.442	20	30		EGEDHN
CNC(=O)[C@@H]1CCC[C@H]1NCc1cccc(C(=O)N2CCCCC2)c1	ZINC000330232674	457008784	/nfs/dbraw/zinc/00/87/84/457008784.db2.gz	FPLXXPFKHHZBEC-QZTJIDSGSA-N	0	3	343.471	3.157	20	30		EGEDHN
Cc1cccc(N(CCC#N)C(=O)CN2CC[C@H](C3CC3)C2)c1C	ZINC000362702254	457053143	/nfs/dbraw/zinc/05/31/43/457053143.db2.gz	BOCDJABJJIFEJZ-SFHVURJKSA-N	0	3	325.456	3.282	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C)OCC	ZINC000339359251	457066927	/nfs/dbraw/zinc/06/69/27/457066927.db2.gz	OFTHJUBLJISMHO-ICSRJNTNSA-N	0	3	344.499	3.481	20	30		EGEDHN
CC(C)c1ccc(C[C@@H]2CCN([C@@H](C)C(=O)N(C)CCC#N)C2)cc1	ZINC000359256496	457068802	/nfs/dbraw/zinc/06/88/02/457068802.db2.gz	FUXZJENCABYIGS-HKUYNNGSSA-N	0	3	341.499	3.435	20	30		EGEDHN
CC#CCCCc1nc(-c2ccc3c(c2)C(SC)C(=O)N3)no1	ZINC000346634189	457081780	/nfs/dbraw/zinc/08/17/80/457081780.db2.gz	OZRMTVMIYWBRBC-OAHLLOKOSA-N	0	3	327.409	3.439	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1)OCC	ZINC000339383559	457081861	/nfs/dbraw/zinc/08/18/61/457081861.db2.gz	WEZMQJIJXMZKMB-UXHICEINSA-N	0	3	344.499	3.481	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2c(C)cccc2Br)CC1	ZINC000362802695	457101456	/nfs/dbraw/zinc/10/14/56/457101456.db2.gz	VDBZZLJDOMDIPS-UHFFFAOYSA-N	0	3	337.261	3.138	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N[C@H](CN1CCCC1)c1ccccc1)OCC	ZINC000339426224	457108821	/nfs/dbraw/zinc/10/88/21/457108821.db2.gz	RXRQICVJCSFTLZ-MOPGFXCFSA-N	0	3	330.472	3.311	20	30		EGEDHN
C[C@@H]1CCCN(C(C)(C)CNC(=O)c2cc(C#N)ccc2Cl)C1	ZINC000350072853	457162528	/nfs/dbraw/zinc/16/25/28/457162528.db2.gz	HGNYCIMPNOWSQS-CYBMUJFWSA-N	0	3	333.863	3.452	20	30		EGEDHN
CN(CCC#N)C(=O)CCN1CCc2ccccc2[C@@H]1c1ccccc1	ZINC000339609808	457172644	/nfs/dbraw/zinc/17/26/44/457172644.db2.gz	BFJJREGYAWVZBO-QFIPXVFZSA-N	0	3	347.462	3.396	20	30		EGEDHN
CCCN(CCN1CCCC1)C(=O)C[C@H](CC#N)c1ccccc1	ZINC000342276360	457205484	/nfs/dbraw/zinc/20/54/84/457205484.db2.gz	CJFJGOPJFRBADE-IBGZPJMESA-N	0	3	327.472	3.408	20	30		EGEDHN
COc1ccc(C[C@@H](NC(=O)C(C)C#N)c2ccc(OC)cc2)cc1	ZINC000347070531	457215177	/nfs/dbraw/zinc/21/51/77/457215177.db2.gz	OBVGAUIDFQMRFJ-IFXJQAMLSA-N	0	3	338.407	3.263	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Cc2ccc(C#N)cc2)C1	ZINC000347074630	457217380	/nfs/dbraw/zinc/21/73/80/457217380.db2.gz	KKMXFWFCEVNEFU-OXQOHEQNSA-N	0	3	333.435	3.052	20	30		EGEDHN
C=CCn1c(Cc2ccsc2)nnc1N1C[C@@H](C)N(CC)C[C@H]1C	ZINC000351074222	457218642	/nfs/dbraw/zinc/21/86/42/457218642.db2.gz	MDCVZDAEPMHHDP-HUUCEWRRSA-N	0	3	345.516	3.035	20	30		EGEDHN
C=CCn1c(Cc2ccsc2)nnc1N1C[C@@H](C)N(CC)C[C@@H]1C	ZINC000351074220	457218739	/nfs/dbraw/zinc/21/87/39/457218739.db2.gz	MDCVZDAEPMHHDP-CABCVRRESA-N	0	3	345.516	3.035	20	30		EGEDHN
COc1cc([C@@H](C)NC(=O)C(C)C#N)ccc1OCc1ccncc1	ZINC000347077759	457218970	/nfs/dbraw/zinc/21/89/70/457218970.db2.gz	UZHAOOPMXTXTHU-UONOGXRCSA-N	0	3	339.395	3.006	20	30		EGEDHN
C=CCN(Cc1ccc(C)nc1C)[C@@H](C)c1cccc(-n2cnnn2)c1	ZINC000360071957	457238211	/nfs/dbraw/zinc/23/82/11/457238211.db2.gz	NYMGKNSEGULNBG-KRWDZBQOSA-N	0	3	348.454	3.423	20	30		EGEDHN
C=CCN(C[C@@H]1CCC(C)(C)O1)[C@@H](C)c1cccc(-n2cnnn2)c1	ZINC000360072010	457238583	/nfs/dbraw/zinc/23/85/83/457238583.db2.gz	NZQIRZYOKMGXCB-YJBOKZPZSA-N	0	3	341.459	3.169	20	30		EGEDHN
CC(C)[C@@H]1CN(Cc2ccc(Br)cc2C#N)CCN1C	ZINC000347132711	457248336	/nfs/dbraw/zinc/24/83/36/457248336.db2.gz	QAKYDIMFOJTACI-INIZCTEOSA-N	0	3	336.277	3.093	20	30		EGEDHN
N#CC1(CCCN2CCC(Oc3ccccn3)CC2)CCOCC1	ZINC000331916734	457273004	/nfs/dbraw/zinc/27/30/04/457273004.db2.gz	BUPWMGQUNNXHMU-UHFFFAOYSA-N	0	3	329.444	3.025	20	30		EGEDHN
Cc1ccc(CNC(=O)C2CCN([C@H]3CC[C@@H](C#N)C3)CC2)cc1	ZINC000331936394	457276237	/nfs/dbraw/zinc/27/62/37/457276237.db2.gz	MDJWNZSUKCUNHK-MJGOQNOKSA-N	0	3	325.456	3.016	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN1CCC[C@@H]1Cc1ccc(C)cc1	ZINC000354556119	457288726	/nfs/dbraw/zinc/28/87/26/457288726.db2.gz	SEVXYEIVKPWKLL-PKOBYXMFSA-N	0	3	327.472	3.010	20	30		EGEDHN
C=CCSc1ccccc1C(=O)NCCCN1CCCO[C@@H](C)C1	ZINC000347235226	457303558	/nfs/dbraw/zinc/30/35/58/457303558.db2.gz	PMPZYPVZXASDRQ-INIZCTEOSA-N	0	3	348.512	3.195	20	30		EGEDHN
COc1cc(C#N)ccc1CN1CCN(C2CCC(C)CC2)CC1	ZINC000347250522	457310612	/nfs/dbraw/zinc/31/06/12/457310612.db2.gz	GRGYJYCWXSBQIM-UHFFFAOYSA-N	0	3	327.472	3.263	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN[C@H](c2cccs2)C2CC2)cc1	ZINC000342513972	457345513	/nfs/dbraw/zinc/34/55/13/457345513.db2.gz	RHYOWMSSXOQKCZ-QAPCUYQASA-N	0	3	328.437	3.100	20	30		EGEDHN
C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)NCC1(N(C)C)CCC1	ZINC000355348277	457362634	/nfs/dbraw/zinc/36/26/34/457362634.db2.gz	QKSBMGKJPCORRZ-UHFFFAOYSA-N	0	3	347.507	3.036	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)N[C@H](C)CN1CCC[C@H](C)C1	ZINC000352442240	457370768	/nfs/dbraw/zinc/37/07/68/457370768.db2.gz	MRDUXIJNOBXOCD-LSDHHAIUSA-N	0	3	344.459	3.199	20	30		EGEDHN
CN(CCC#N)c1ccc(CN[C@@H]2CN(C)Cc3ccccc32)cc1	ZINC000378273374	457385427	/nfs/dbraw/zinc/38/54/27/457385427.db2.gz	QLLTVUMOQIHETI-OAQYLSRUSA-N	0	3	334.467	3.313	20	30		EGEDHN
C[C@@H](CN1CCC[C@H](C)C1)NC(=O)CSCc1ccc(C#N)cc1	ZINC000347402248	457403875	/nfs/dbraw/zinc/40/38/75/457403875.db2.gz	VSPABBGRAKEQCJ-HOTGVXAUSA-N	0	3	345.512	3.028	20	30		EGEDHN
CN(C)CCN(Cc1ccc(F)cc1)c1nccc(C#N)c1Cl	ZINC000342709077	457470558	/nfs/dbraw/zinc/47/05/58/457470558.db2.gz	WTOHAQPNYBVSNY-UHFFFAOYSA-N	0	3	332.810	3.314	20	30		EGEDHN
CN(Cc1ccccc1)C1CN(C(=O)C(C#N)CCc2ccccc2)C1	ZINC000342723714	457479934	/nfs/dbraw/zinc/47/99/34/457479934.db2.gz	GZYJOQTZOOYIMD-FQEVSTJZSA-N	0	3	347.462	3.102	20	30		EGEDHN
C=CCCN(C)[C@@H](C)C(=O)N(C)Cc1ccc(Br)cc1	ZINC000342738087	457489502	/nfs/dbraw/zinc/48/95/02/457489502.db2.gz	STXFITDPTRHUMD-ZDUSSCGKSA-N	0	3	339.277	3.304	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN1CC[C@@H](Oc2ccccc2)C1	ZINC000374212954	457525698	/nfs/dbraw/zinc/52/56/98/457525698.db2.gz	FZFUBSYUXZRZME-MRXNPFEDSA-N	0	3	341.436	3.102	20	30		EGEDHN
C[C@@H](CNC(=O)N(C)[C@@H](C)c1cccc(C#N)c1)N1CCC[C@@H](C)C1	ZINC000425450307	457559565	/nfs/dbraw/zinc/55/95/65/457559565.db2.gz	XZLOQUAVSZAKGC-IKGGRYGDSA-N	0	3	342.487	3.381	20	30		EGEDHN
CC(C)(C)OC(=O)CC1(NCc2cccc(C#N)c2F)CCOCC1	ZINC000408523453	457578564	/nfs/dbraw/zinc/57/85/64/457578564.db2.gz	KEQQYNNJIWMHIT-UHFFFAOYSA-N	0	3	348.418	3.068	20	30		EGEDHN
COc1ccc(F)cc1CN(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000361141418	457610211	/nfs/dbraw/zinc/61/02/11/457610211.db2.gz	IGGZKHCVYSEPKX-UHFFFAOYSA-N	0	3	341.430	3.270	20	30		EGEDHN
C=CCNC(=O)c1ccc(N[C@@H](C)[C@@H](c2ccccc2)N(C)C)nc1	ZINC000357663010	457646172	/nfs/dbraw/zinc/64/61/72/457646172.db2.gz	PVPQRKIHFLYLDC-KXBFYZLASA-N	0	3	338.455	3.101	20	30		EGEDHN
C[C@H](NCCCS(C)(=O)=O)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000374664821	457683367	/nfs/dbraw/zinc/68/33/67/457683367.db2.gz	PXYZILREKUUQES-HNNXBMFYSA-N	0	3	342.464	3.311	20	30		EGEDHN
C[C@]1(CNC(=O)c2cccc(CC#N)c2)CCN(Cc2ccccc2)C1	ZINC000370623501	457685016	/nfs/dbraw/zinc/68/50/16/457685016.db2.gz	YZGJEHHYFPRRAD-JOCHJYFZSA-N	0	3	347.462	3.395	20	30		EGEDHN
N#Cc1cccc(OCCN2CC[C@H](n3ncc4ccccc43)C2)c1	ZINC000374736157	457697383	/nfs/dbraw/zinc/69/73/83/457697383.db2.gz	QWAAKVUMDVJQLS-SFHVURJKSA-N	0	3	332.407	3.234	20	30		EGEDHN
Cc1ccccc1[C@H]([C@@H](C)NC(=O)c1cccc(CC#N)c1)N(C)C	ZINC000357866717	457717734	/nfs/dbraw/zinc/71/77/34/457717734.db2.gz	JXNSVBBYAZZPDF-UZLBHIALSA-N	0	3	335.451	3.482	20	30		EGEDHN
C[C@H]1Cc2ccccc2N1CCNC(=O)C(C#N)CCc1ccccc1	ZINC000433307180	457805940	/nfs/dbraw/zinc/80/59/40/457805940.db2.gz	UDEQCNJMOFZXKI-PXNSSMCTSA-N	0	3	347.462	3.326	20	30		EGEDHN
CO[C@H](CNCc1cn(CCC#N)nc1-c1ccncc1)C(C)(C)C	ZINC000433324666	457811841	/nfs/dbraw/zinc/81/18/41/457811841.db2.gz	FILPVYFJKBDESL-QGZVFWFLSA-N	0	3	341.459	3.009	20	30		EGEDHN
COc1cc(CNCc2ccc(C#N)c(C)c2)cc(OC)c1OC	ZINC000443985091	457835384	/nfs/dbraw/zinc/83/53/84/457835384.db2.gz	YHAYNRVEHVDELG-UHFFFAOYSA-N	0	3	326.396	3.182	20	30		EGEDHN
CO[C@@H](C)c1nc(CN2CCCN([C@H](C)CCC#N)CC2)cs1	ZINC000411334715	457860220	/nfs/dbraw/zinc/86/02/20/457860220.db2.gz	PMZLRGKSDRDEGI-CABCVRRESA-N	0	3	336.505	3.050	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)NC1CCN([C@H](C)c2ccccc2)CC1	ZINC000366692894	457888192	/nfs/dbraw/zinc/88/81/92/457888192.db2.gz	YZCMOJAIXPNAEQ-CQSZACIVSA-N	0	3	337.423	3.415	20	30		EGEDHN
C=CCN(CCc1ccccc1)C(=O)NC[C@H]1CCCCN1C1CC1	ZINC000433948240	457918684	/nfs/dbraw/zinc/91/86/84/457918684.db2.gz	DALCCFHIOYAVHT-HXUWFJFHSA-N	0	3	341.499	3.444	20	30		EGEDHN
C[C@@H](CN(C)C(=O)C(C#N)CCc1ccccc1)C(=O)OC(C)(C)C	ZINC000458390378	458032873	/nfs/dbraw/zinc/03/28/73/458032873.db2.gz	MWUMBCBEACLOQW-DOTOQJQBSA-N	0	3	344.455	3.195	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@H]2CC(C)(C)Oc3ccccc32)CC1	ZINC000412034189	458054528	/nfs/dbraw/zinc/05/45/28/458054528.db2.gz	FYOSQIKHOMOPPW-KRWDZBQOSA-N	0	3	328.456	3.098	20	30		EGEDHN
N#Cc1ccc(NC(=O)CN[C@@H](c2ccccc2)C2CCOCC2)cc1	ZINC000362254383	458056072	/nfs/dbraw/zinc/05/60/72/458056072.db2.gz	IGZCHIDUWGLZOT-NRFANRHFSA-N	0	3	349.434	3.254	20	30		EGEDHN
C[C@@H](CNC(=O)C1(c2cccc(C#N)c2)CC1)N(C)Cc1ccccc1	ZINC000435003466	458077754	/nfs/dbraw/zinc/07/77/54/458077754.db2.gz	MPSUGFDKJLSHLU-KRWDZBQOSA-N	0	3	347.462	3.227	20	30		EGEDHN
C[C@@H]1CN(CC2CCN(Cc3cccc(F)c3C#N)CC2)C[C@@H](C)O1	ZINC000428240391	458105046	/nfs/dbraw/zinc/10/50/46/458105046.db2.gz	IPLAYXPAEBNQLE-HZPDHXFCSA-N	0	3	345.462	3.019	20	30		EGEDHN
CC1CCC(N2CCN(C(=O)NCC(C)(C)CCC#N)CC2)CC1	ZINC000358733196	458178494	/nfs/dbraw/zinc/17/84/94/458178494.db2.gz	LCAYOZRPXIKOPW-UHFFFAOYSA-N	0	3	334.508	3.222	20	30		EGEDHN
CN1CC[C@@H]2CCN(C(=O)N[C@@H](CCCC#N)c3ccccc3)[C@@H]2C1	ZINC000458805911	458178818	/nfs/dbraw/zinc/17/88/18/458178818.db2.gz	VQQZEXZPNLIBIG-CEXWTWQISA-N	0	3	340.471	3.157	20	30		EGEDHN
C[C@H]1CCN(C)CCN1C(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000458809053	458179698	/nfs/dbraw/zinc/17/96/98/458179698.db2.gz	ZUIDYDDTSUFROT-FUHWJXTLSA-N	0	3	328.460	3.157	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](C)c2ccncc2CC)CC1	ZINC000358785131	458215770	/nfs/dbraw/zinc/21/57/70/458215770.db2.gz	YXGASUPUCAPKOQ-HNNXBMFYSA-N	0	3	330.476	3.045	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCN(CCCc3cccc(F)c3)C2)nc1	ZINC000428813935	458216661	/nfs/dbraw/zinc/21/66/61/458216661.db2.gz	QVJFWRTZQLVTHS-SFHVURJKSA-N	0	3	325.387	3.178	20	30		EGEDHN
CC(C)N(Cc1cc(C#N)cs1)C[C@@H](O)COc1ccccc1	ZINC000446852705	458237911	/nfs/dbraw/zinc/23/79/11/458237911.db2.gz	LQEWOYOJMCQZRZ-MRXNPFEDSA-N	0	3	330.453	3.270	20	30		EGEDHN
CC(C)(NCCOc1cccc(C#N)c1)c1ccccc1[N+](=O)[O-]	ZINC000429224464	458292420	/nfs/dbraw/zinc/29/24/20/458292420.db2.gz	ARVRMWHRSSKPJY-UHFFFAOYSA-N	0	3	325.368	3.370	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NC(=O)NC1CCN(C2CC2)CC1	ZINC000413078793	458292889	/nfs/dbraw/zinc/29/28/89/458292889.db2.gz	WHPNSSJVORZENT-GOSISDBHSA-N	0	3	327.472	3.100	20	30		EGEDHN
COc1ccc2c(c1)OC[C@@H](NCc1ccc(O[C@@H](C)C#N)cc1)C2	ZINC000372428407	458302663	/nfs/dbraw/zinc/30/26/63/458302663.db2.gz	OGJGJBAVSXMZLX-YOEHRIQHSA-N	0	3	338.407	3.079	20	30		EGEDHN
CCS(=O)(=O)c1cc(Cl)cc(CN[C@H]2CCC[C@@H](C#N)C2)c1	ZINC000414206508	458315717	/nfs/dbraw/zinc/31/57/17/458315717.db2.gz	FPFJNLKKBQRJNP-DOMZBBRYSA-N	0	3	340.876	3.306	20	30		EGEDHN
C=CCc1cc(CN2CCC(c3ccncn3)CC2)cc(OC)c1O	ZINC000414472486	458319510	/nfs/dbraw/zinc/31/95/10/458319510.db2.gz	SBHOOZYFYZOGQM-UHFFFAOYSA-N	0	3	339.439	3.299	20	30		EGEDHN
C=CCCC1(C(=O)Nc2ccc(OCCN(C)C)c(OC)c2)CC1	ZINC000416336030	458342511	/nfs/dbraw/zinc/34/25/11/458342511.db2.gz	XOWDEGJUHUEFRY-UHFFFAOYSA-N	0	3	332.444	3.321	20	30		EGEDHN
CN(CCN1CCN([C@H](C#N)c2ccccc2)CC1)Cc1ccccc1	ZINC000429688575	458359033	/nfs/dbraw/zinc/35/90/33/458359033.db2.gz	CITCVTKTJVPKJC-JOCHJYFZSA-N	0	3	348.494	3.001	20	30		EGEDHN
C=CCN(C)CCN(CC)CC(=O)Nc1c(C)cc(C)cc1Cl	ZINC000429720748	458362786	/nfs/dbraw/zinc/36/27/86/458362786.db2.gz	PZLDWORUAGWNQQ-UHFFFAOYSA-N	0	3	337.895	3.335	20	30		EGEDHN
CC(C)(CCC#N)CNC(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000376662369	458363419	/nfs/dbraw/zinc/36/34/19/458363419.db2.gz	WWDNZBVBMUBAPX-SFHVURJKSA-N	0	3	342.487	3.280	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1CNC(=O)NC[C@@H](N)c1ccc(C(C)C)cc1	ZINC000418130947	458371462	/nfs/dbraw/zinc/37/14/62/458371462.db2.gz	GYAYQKAOFIRFEU-OTWHNJEPSA-N	0	3	345.487	3.090	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCc1ccccc1CN1CCN(CC)CC1	ZINC000429857173	458377899	/nfs/dbraw/zinc/37/78/99/458377899.db2.gz	APTONWSAGDFXRJ-UHFFFAOYSA-N	0	3	343.515	3.043	20	30		EGEDHN
CCN1C[C@@H](C)N(CC#Cc2ccc(OC(F)(F)F)cc2)[C@@H](C)C1	ZINC000459460505	458378179	/nfs/dbraw/zinc/37/81/79/458378179.db2.gz	INDXCWOEKVLAEU-GASCZTMLSA-N	0	3	340.389	3.351	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)NCC2(C#N)CCC2)CCN1Cc1ccccc1	ZINC000419496455	458384326	/nfs/dbraw/zinc/38/43/26/458384326.db2.gz	LYUCMNZFAVUVFL-FUHWJXTLSA-N	0	3	340.471	3.033	20	30		EGEDHN
C=CCC[C@@H]1NC(=O)N(C[C@@H](c2ccsc2)N(CC)CC)C1=O	ZINC000419930080	458393422	/nfs/dbraw/zinc/39/34/22/458393422.db2.gz	XLHXXRNHDNISAS-GJZGRUSLSA-N	0	3	335.473	3.018	20	30		EGEDHN
CN1CCN(Cc2cccc(NCc3ccc(C#N)c(F)c3)c2)CC1	ZINC000421342094	458411484	/nfs/dbraw/zinc/41/14/84/458411484.db2.gz	XCLGYPUXDGMGBW-UHFFFAOYSA-N	0	3	338.430	3.057	20	30		EGEDHN
Cc1[nH]c(C#N)cc1C(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1	ZINC000448827940	458411957	/nfs/dbraw/zinc/41/19/57/458411957.db2.gz	HNUFQICVHKDSKG-IBGZPJMESA-N	0	3	336.439	3.070	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCN(Cc3ccc4c(c3)CCCC4)C2)nc1	ZINC000430161156	458412957	/nfs/dbraw/zinc/41/29/57/458412957.db2.gz	CBNXVBAOZKDYRN-HXUWFJFHSA-N	0	3	333.435	3.485	20	30		EGEDHN
C=CCN1CCC(NC(=O)Cc2scnc2-c2ccccc2)CC1	ZINC000448922100	458415550	/nfs/dbraw/zinc/41/55/50/458415550.db2.gz	PRGLIYOGAURSJT-UHFFFAOYSA-N	0	3	341.480	3.119	20	30		EGEDHN
C=CCOc1cccc(CN2CC[C@H](Oc3ccc(C#N)cn3)C2)c1	ZINC000430183896	458416584	/nfs/dbraw/zinc/41/65/84/458416584.db2.gz	BRICZYREIWBDKM-IBGZPJMESA-N	0	3	335.407	3.171	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Cc1ccc2c(c1)NCC2)C(C)C	ZINC000449091953	458420934	/nfs/dbraw/zinc/42/09/34/458420934.db2.gz	RXZMMSZTVDKTCM-FQEVSTJZSA-N	0	3	341.499	3.012	20	30		EGEDHN
COC(=O)CCN(CC#Cc1ccc(OC(F)(F)F)cc1)C(C)C	ZINC000437088383	458426004	/nfs/dbraw/zinc/42/60/04/458426004.db2.gz	DANVAZGJYUUXIR-UHFFFAOYSA-N	0	3	343.345	3.210	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCc1ccc(-c2ccc(C(=O)OC)cc2)o1	ZINC000449521864	458426120	/nfs/dbraw/zinc/42/61/20/458426120.db2.gz	SVSGAKPSXQGZIA-SJORKVTESA-N	0	3	327.380	3.166	20	30		EGEDHN
CCCN(CCN1CCCCC1)C(=O)NCc1ccc(C#N)s1	ZINC000422221020	458426203	/nfs/dbraw/zinc/42/62/03/458426203.db2.gz	WQHZCTJGKQTHIQ-UHFFFAOYSA-N	0	3	334.489	3.027	20	30		EGEDHN
N#CCSCCCN(CCc1ccccn1)Cc1cccnc1	ZINC000430334957	458440471	/nfs/dbraw/zinc/44/04/71/458440471.db2.gz	AGSXAAYRARFZSD-UHFFFAOYSA-N	0	3	326.469	3.168	20	30		EGEDHN
C[C@H](Cc1cccc(F)c1)N(C)C[C@H](O)COc1ccc(C#N)cc1	ZINC000459758370	458470358	/nfs/dbraw/zinc/47/03/58/458470358.db2.gz	QCUSKYULNJUGTR-BEFAXECRSA-N	0	3	342.414	3.000	20	30		EGEDHN
C[C@@H](CC(=O)N(C)Cc1ccccc1Cl)NCC1(CC#N)CC1	ZINC000430724096	458485284	/nfs/dbraw/zinc/48/52/84/458485284.db2.gz	MGYUNGFMXVFBHF-AWEZNQCLSA-N	0	3	333.863	3.360	20	30		EGEDHN
C=CCC1(C(=O)N(CCC)CCN2CCN(CC)CC2)CCCCC1	ZINC000451811039	458488805	/nfs/dbraw/zinc/48/88/05/458488805.db2.gz	OONRTWCKRITSSN-UHFFFAOYSA-N	0	3	349.563	3.389	20	30		EGEDHN
C=C(CC)CN[C@H](CN1CCC(C(N)=O)CC1)c1ccc(Cl)cc1	ZINC000453379447	458525950	/nfs/dbraw/zinc/52/59/50/458525950.db2.gz	WHDXJLVLXCXSPA-GOSISDBHSA-N	0	3	349.906	3.134	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)Nc2cccc(C#Cc3ccccn3)c2)CCN1C	ZINC000438071203	458527218	/nfs/dbraw/zinc/52/72/18/458527218.db2.gz	HQDRJYOGTTYGRJ-UZLBHIALSA-N	0	3	348.450	3.086	20	30		EGEDHN
C=C(C)Cn1c([C@@H]2CC[C@H](C)O2)nnc1N1CCN([C@@H](C)CC)CC1	ZINC000453468761	458534484	/nfs/dbraw/zinc/53/44/84/458534484.db2.gz	YSNFSLDYKNQVHS-ULQDDVLXSA-N	0	3	347.507	3.015	20	30		EGEDHN
CN1CCC2(CCCN2C(=O)C[C@H](CC#N)c2ccccc2)CC1	ZINC000373573817	458537404	/nfs/dbraw/zinc/53/74/04/458537404.db2.gz	OLOYSHMWKLCILX-SFHVURJKSA-N	0	3	325.456	3.161	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N[C@H](Cc1ccccc1)c1ccccc1F	ZINC000424116486	458562336	/nfs/dbraw/zinc/56/23/36/458562336.db2.gz	BUAAUEQZJONLFN-RTBURBONSA-N	0	3	339.414	3.247	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N1CCc2cc(-c3cccc(F)c3)ccc21	ZINC000424118977	458563220	/nfs/dbraw/zinc/56/32/20/458563220.db2.gz	FDJZZUCTGJTEBC-SFHVURJKSA-N	0	3	337.398	3.403	20	30		EGEDHN
Cc1ccsc1[C@@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCC#N	ZINC000424123779	458564099	/nfs/dbraw/zinc/56/40/99/458564099.db2.gz	LINRDMXCZRKQLS-DLBZAZTESA-N	0	3	341.480	3.478	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCCc2cc(C)ccc2F)CC1	ZINC000454468847	458564036	/nfs/dbraw/zinc/56/40/36/458564036.db2.gz	SWMLWJUXFWIEDQ-UHFFFAOYSA-N	0	3	333.451	3.016	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N[C@H](c1ccccc1)c1cccc(F)c1	ZINC000424126138	458565259	/nfs/dbraw/zinc/56/52/59/458565259.db2.gz	SHYYKWJUYINBIU-ZWKOTPCHSA-N	0	3	325.387	3.052	20	30		EGEDHN
C[C@@H](C(=O)NC1CCN(Cc2ccccc2)CC1)c1cccc(C#N)c1	ZINC000461729683	458569654	/nfs/dbraw/zinc/56/96/54/458569654.db2.gz	SLHCAIHSYIVDBO-QGZVFWFLSA-N	0	3	347.462	3.443	20	30		EGEDHN
CC(C)(CNC(=O)[C@H](N)CCCC#N)c1ccc(C(F)(F)F)cc1	ZINC000424172623	458576639	/nfs/dbraw/zinc/57/66/39/458576639.db2.gz	NKCWXTYRQJVOPH-CQSZACIVSA-N	0	3	341.377	3.120	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1ccc(F)cc1OCCC(F)(F)F	ZINC000424176038	458577631	/nfs/dbraw/zinc/57/76/31/458577631.db2.gz	RLGJJCAQIIOJIF-NSHDSACASA-N	0	3	347.312	3.117	20	30		EGEDHN
C[C@H]1C[C@H](CNC(=O)OC(C)(C)C)CN1Cc1ccc(C#N)cc1	ZINC000493915073	458600221	/nfs/dbraw/zinc/60/02/21/458600221.db2.gz	RKLQVSWZYWXADD-WMLDXEAASA-N	0	3	329.444	3.293	20	30		EGEDHN
CC(C)(Cc1ccc(C#N)cc1)C(=O)N1CC[C@@H](N2CCCCC2)C1	ZINC000455554859	458603268	/nfs/dbraw/zinc/60/32/68/458603268.db2.gz	OKNDQKZEZCXTDA-LJQANCHMSA-N	0	3	339.483	3.214	20	30		EGEDHN
C[C@H](C(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)c1cccc(C#N)c1	ZINC000462260671	458608152	/nfs/dbraw/zinc/60/81/52/458608152.db2.gz	TVQWPZOIRPWIMK-UWJYYQICSA-N	0	3	347.462	3.395	20	30		EGEDHN
CC(C)(C)CCN1CCN(C(=O)Nc2cccc(CC#N)c2)CC1	ZINC000455922361	458622959	/nfs/dbraw/zinc/62/29/59/458622959.db2.gz	QJUCXOLVWHDBPC-UHFFFAOYSA-N	0	3	328.460	3.338	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN1CCCC[C@@H]1[C@@H]1C[C@@H](C)CC[C@H]1O	ZINC000439006202	458641266	/nfs/dbraw/zinc/64/12/66/458641266.db2.gz	GPWZMWXBCZLEBW-INDMIFKZSA-N	0	3	336.520	3.063	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NC1CCN([C@@H](C)c2ccccc2)CC1	ZINC000424499871	458650729	/nfs/dbraw/zinc/65/07/29/458650729.db2.gz	GXMKBEFGKBBDJY-DBVUQKKJSA-N	0	3	342.483	3.309	20	30		EGEDHN
CC(C)(CNC(=O)C(C#N)Cc1ccc(C#N)cc1)Oc1ccccc1	ZINC000470954870	458668926	/nfs/dbraw/zinc/66/89/26/458668926.db2.gz	DGOBPULMUPFYHH-SFHVURJKSA-N	0	3	347.418	3.214	20	30		EGEDHN
C[C@H]1C[C@@H](CNC(=O)OC(C)(C)C)CN1Cc1cc(C#N)cs1	ZINC000494470100	458684054	/nfs/dbraw/zinc/68/40/54/458684054.db2.gz	MNWHMOQXVSVMOJ-JSGCOSHPSA-N	0	3	335.473	3.355	20	30		EGEDHN
Cc1c(C#N)cccc1NC(=O)NC[C@@H](Cc1ccccc1)N(C)C	ZINC000432260499	458706895	/nfs/dbraw/zinc/70/68/95/458706895.db2.gz	XVOPVTFRXXPOMH-GOSISDBHSA-N	0	3	336.439	3.161	20	30		EGEDHN
Cc1ccccc1[C@H]([C@@H](C)NC(=O)N1CCC(C)(C#N)CC1)N(C)C	ZINC000508878935	458765703	/nfs/dbraw/zinc/76/57/03/458765703.db2.gz	IMSFXRRNDHVDET-AEFFLSMTSA-N	0	3	342.487	3.322	20	30		EGEDHN
C[C@]1(CO)CCCN1Cc1cccc(OCc2ccccc2C#N)c1	ZINC000530443065	458769096	/nfs/dbraw/zinc/76/90/96/458769096.db2.gz	QIDPBLPXSMJLOK-OAQYLSRUSA-N	0	3	336.435	3.484	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cccc3c2OC(C)(C)C3)CC1	ZINC000530450497	458770900	/nfs/dbraw/zinc/77/09/00/458770900.db2.gz	RPOKYBQEYGNHEM-UHFFFAOYSA-N	0	3	329.444	3.172	20	30		EGEDHN
CCCN(CC(=O)Nc1ccc(Cl)cc1Cl)C(=O)C(C)C#N	ZINC000510378456	458774732	/nfs/dbraw/zinc/77/47/32/458774732.db2.gz	LJQNGUYNEGPXDN-JTQLQIEISA-N	0	3	342.226	3.330	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cccc(C#N)c1C)C(C)C	ZINC000512325929	458784316	/nfs/dbraw/zinc/78/43/16/458784316.db2.gz	NCLHMTVGJRSNAB-IBGZPJMESA-N	0	3	325.456	3.295	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Nc1nc2c(s1)CCC2)C(C)C	ZINC000514823722	458801486	/nfs/dbraw/zinc/80/14/86/458801486.db2.gz	KMWGEYBXVPZXBE-HNNXBMFYSA-N	0	3	348.516	3.452	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@H]1CCCN1Cc1ccc(CC#N)cc1	ZINC000495248622	458819173	/nfs/dbraw/zinc/81/91/73/458819173.db2.gz	BPCPBJYEWDYNOA-QGZVFWFLSA-N	0	3	329.444	3.242	20	30		EGEDHN
CN(CC(C)(C)C#N)C(=O)NC[C@H](c1ccccc1)N1CCCC1	ZINC000457372685	458934316	/nfs/dbraw/zinc/93/43/16/458934316.db2.gz	JANOTQVMEUQQFW-QGZVFWFLSA-N	0	3	328.460	3.015	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@]2(C1)CCCN([C@H]1CC[C@H](C#N)C1)C2	ZINC000495794355	458957728	/nfs/dbraw/zinc/95/77/28/458957728.db2.gz	SBUNKCPPALQDQR-BXWFABGCSA-N	0	3	333.476	3.402	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CCS[C@H](C(C)C)C1	ZINC000441616051	458964394	/nfs/dbraw/zinc/96/43/94/458964394.db2.gz	VCYPWYWAUGBGJE-MJGOQNOKSA-N	0	3	335.513	3.228	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1nc(-c2ccc(Cl)cc2)cs1	ZINC000577363832	459022328	/nfs/dbraw/zinc/02/23/28/459022328.db2.gz	OKNQPLTXMUSPQF-LBPRGKRZSA-N	0	3	334.832	3.423	20	30		EGEDHN
Cc1ccccc1[C@@H]([C@H](C)NC(=O)NCC#Cc1ccccc1)N(C)C	ZINC000477831798	459061700	/nfs/dbraw/zinc/06/17/00/459061700.db2.gz	WSWPYOJVETUFTO-GHTZIAJQSA-N	0	3	349.478	3.337	20	30		EGEDHN
CC1(C)c2ccccc2CCN1C[C@@H](O)COc1ccc(C#N)cc1	ZINC000557342235	459065029	/nfs/dbraw/zinc/06/50/29/459065029.db2.gz	NOZMOJAKKAVVMB-GOSISDBHSA-N	0	3	336.435	3.091	20	30		EGEDHN
CC(C)(NC[C@H](O)COc1ccc(CC#N)cc1)c1ccccc1F	ZINC000590020193	459067452	/nfs/dbraw/zinc/06/74/52/459067452.db2.gz	HDVXWPRQOFCZRP-INIZCTEOSA-N	0	3	342.414	3.156	20	30		EGEDHN
N#CCCCOc1cccc(CN[C@H]2CCc3ccccc3NC2=O)c1	ZINC000594509731	459068519	/nfs/dbraw/zinc/06/85/19/459068519.db2.gz	LUVCNEZLMQJKRU-FQEVSTJZSA-N	0	3	349.434	3.412	20	30		EGEDHN
CC(C)c1ccc([C@@H](N)CNC(=O)N2Cc3ccc(C#N)cc3C2)cc1	ZINC000594534142	459081967	/nfs/dbraw/zinc/08/19/67/459081967.db2.gz	VCDFIRRRSCRSRO-FQEVSTJZSA-N	0	3	348.450	3.407	20	30		EGEDHN
Cc1ccc(C[C@@H]2CCCN2Cc2cnc3c(C#N)cnn3c2)cc1	ZINC000577730980	459085041	/nfs/dbraw/zinc/08/50/41/459085041.db2.gz	OHOLTDBUXOBYMJ-IBGZPJMESA-N	0	3	331.423	3.117	20	30		EGEDHN
Cn1cc(CNC[C@H](c2ccccc2Cl)N2CCCC2)cc1C#N	ZINC000577802110	459096628	/nfs/dbraw/zinc/09/66/28/459096628.db2.gz	ZFYIDZQTPWMHDY-LJQANCHMSA-N	0	3	342.874	3.477	20	30		EGEDHN
CC[C@H](C)N[C@H](CNC(=O)N1CCC(CC#N)CC1)c1ccco1	ZINC000557832051	459112776	/nfs/dbraw/zinc/11/27/76/459112776.db2.gz	PFZPGQNTQOHUEH-GOEBONIOSA-N	0	3	332.448	3.044	20	30		EGEDHN
O=C(N[C@@H]1CCN(CC2CC2)C1)c1ccc(C#Cc2ccccc2)cc1	ZINC000594640510	459118339	/nfs/dbraw/zinc/11/83/39/459118339.db2.gz	HQYQBXYYUGLNJU-JOCHJYFZSA-N	0	3	344.458	3.301	20	30		EGEDHN
CC(C)(C)OC(=O)N1C[C@@H]2CCN(Cc3ccc(CC#N)cc3)[C@@H]2C1	ZINC000496277852	459133482	/nfs/dbraw/zinc/13/34/82/459133482.db2.gz	VKIYCBMTAQBQLI-ZWKOTPCHSA-N	0	3	341.455	3.194	20	30		EGEDHN
C[C@H](C1CC1)N(CC(=O)NCc1cccc(C#N)c1)Cc1ccccc1	ZINC000521820748	459180399	/nfs/dbraw/zinc/18/03/99/459180399.db2.gz	VOPNNGHCDRSWTG-QGZVFWFLSA-N	0	3	347.462	3.475	20	30		EGEDHN
CO[C@H](CNCc1cn(C)nc1-c1ccc(C#N)cc1)C1CCCC1	ZINC000594995303	459208439	/nfs/dbraw/zinc/20/84/39/459208439.db2.gz	RAUHKYSAODNVMM-LJQANCHMSA-N	0	3	338.455	3.254	20	30		EGEDHN
C[C@H]1OCC[C@@]1(O)CN(Cc1cc(C#N)cs1)Cc1ccccc1	ZINC000578579520	459223550	/nfs/dbraw/zinc/22/35/50/459223550.db2.gz	ABOBFJFSBKOXTB-DNVCBOLYSA-N	0	3	342.464	3.162	20	30		EGEDHN
CC#CCN(C)C[C@@H](O)CO[C@H](c1ccccc1)c1ccc(C)cc1	ZINC000559458939	459261712	/nfs/dbraw/zinc/26/17/12/459261712.db2.gz	QFROLZYMNUFDGO-FGZHOGPDSA-N	0	3	337.463	3.417	20	30		EGEDHN
CN1C[C@@H]2CCCN(C(=O)Nc3ccc(C(C)(C)C#N)cc3)[C@@H]2C1	ZINC000581068149	459267861	/nfs/dbraw/zinc/26/78/61/459267861.db2.gz	FHMAPKPZZPOHQF-WMLDXEAASA-N	0	3	326.444	3.046	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)[C@@]2(C#N)CC23CCCC3)CN1Cc1ccccc1	ZINC000581648027	459276379	/nfs/dbraw/zinc/27/63/79/459276379.db2.gz	PPHSBQBRSUVFFE-BLIXFSHQSA-N	0	3	337.467	3.240	20	30		EGEDHN
CN(CCc1ccc(C#N)cc1)Cc1ccc(C(=O)NC2CC2)cc1	ZINC000595352342	459283119	/nfs/dbraw/zinc/28/31/19/459283119.db2.gz	CMCNBAMUONDRBE-UHFFFAOYSA-N	0	3	333.435	3.125	20	30		EGEDHN
CCO[C@@H]1C[C@@H](N[C@@H](C)C(=O)NC2(C#N)CCCCC2)C1(CC)CC	ZINC000482126560	459291370	/nfs/dbraw/zinc/29/13/70/459291370.db2.gz	MLBUSZOIABTKTB-GVDBMIGSSA-N	0	3	349.519	3.291	20	30		EGEDHN
CCO[C@@H]1C[C@@H](N[C@H](C)C(=O)NC2(C#N)CCCCC2)C1(CC)CC	ZINC000482126559	459291643	/nfs/dbraw/zinc/29/16/43/459291643.db2.gz	MLBUSZOIABTKTB-BRWVUGGUSA-N	0	3	349.519	3.291	20	30		EGEDHN
C[C@H](C(=O)N(CCC#N)c1ccccc1)N1CC[C@H](C2CCC2)C1	ZINC000591061767	459303125	/nfs/dbraw/zinc/30/31/25/459303125.db2.gz	HORQMXKZOAWTBR-AEFFLSMTSA-N	0	3	325.456	3.444	20	30		EGEDHN
N#C[C@H]1CC[C@@H](NCc2ccc(N3CCc4ccccc4C3)nc2)C1	ZINC000582101208	459306188	/nfs/dbraw/zinc/30/61/88/459306188.db2.gz	UHWUCOFEQJNKNB-OXJNMPFZSA-N	0	3	332.451	3.426	20	30		EGEDHN
N#C[C@@H]1CC[C@H](NCc2ccc(N3CCc4ccccc4C3)nc2)C1	ZINC000582101210	459306735	/nfs/dbraw/zinc/30/67/35/459306735.db2.gz	UHWUCOFEQJNKNB-UZLBHIALSA-N	0	3	332.451	3.426	20	30		EGEDHN
N#Cc1cnn2cc(CN3CCCC[C@@H]3Cc3ccccc3)cnc12	ZINC000582242266	459332565	/nfs/dbraw/zinc/33/25/65/459332565.db2.gz	RZLIHBDOPLENQU-LJQANCHMSA-N	0	3	331.423	3.198	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2N[C@H]1CCN(c2ccc(F)cc2)C1=O	ZINC000591255927	459342190	/nfs/dbraw/zinc/34/21/90/459342190.db2.gz	HTDPYDXUMRAABQ-UXHICEINSA-N	0	3	349.409	3.470	20	30		EGEDHN
CN(C)[C@@H](CC(=O)N[C@@H]1CCc2cc(C#N)ccc21)c1ccccc1	ZINC000591320374	459354260	/nfs/dbraw/zinc/35/42/60/459354260.db2.gz	HGBMUOODHPBTBZ-UXHICEINSA-N	0	3	333.435	3.355	20	30		EGEDHN
C=CC[C@@H](CC)NC(=O)NC[C@H](c1cccc(OC)c1)N1CCCC1	ZINC000537401415	459364599	/nfs/dbraw/zinc/36/45/99/459364599.db2.gz	SDJQKFAUWFABKD-IEBWSBKVSA-N	0	3	345.487	3.486	20	30		EGEDHN
Cc1ccccc1[C@H](N[C@@H](C)C(=O)N[C@@](C)(C#N)C(C)C)C1CC1	ZINC000540589820	459382487	/nfs/dbraw/zinc/38/24/87/459382487.db2.gz	AMBWBWWCLQOKCC-CVAIRZPRSA-N	0	3	327.472	3.479	20	30		EGEDHN
C=CCN(CCOC)CCOc1cc(F)cc(Br)c1	ZINC000484562510	459419672	/nfs/dbraw/zinc/41/96/72/459419672.db2.gz	ZDWWMEGITLJESE-UHFFFAOYSA-N	0	3	332.213	3.101	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCCC[C@@H]1[C@@H]1CCCC1=Nn1cnnc1	ZINC000496985177	459395497	/nfs/dbraw/zinc/39/54/97/459395497.db2.gz	LCANVMBOCBWNJP-UKRRQHHQSA-N	0	3	333.436	3.072	20	30		EGEDHN
N#Cc1ccccc1OCCN1CC[C@@]2(C1)CCc1ccccc1O2	ZINC000569208859	459414024	/nfs/dbraw/zinc/41/40/24/459414024.db2.gz	KVVQEIPOMLTLFA-OAQYLSRUSA-N	0	3	334.419	3.407	20	30		EGEDHN
Cc1nc(COc2ccc(CN3CCC(CC#N)CC3)cc2)no1	ZINC000540995644	459416508	/nfs/dbraw/zinc/41/65/08/459416508.db2.gz	NKWUXZVYSBOUMY-UHFFFAOYSA-N	0	3	326.400	3.083	20	30		EGEDHN
CCC[C@@H](NC[C@H](O)COc1ccc(CC#N)cc1)c1ccccn1	ZINC000591734588	459426726	/nfs/dbraw/zinc/42/67/26/459426726.db2.gz	UNEGDHKNXMALFC-PKOBYXMFSA-N	0	3	339.439	3.018	20	30		EGEDHN
CC(C)C[C@H](NC[C@@H](O)CN(C)CCC#N)c1ccc(Cl)cc1	ZINC000591742310	459428526	/nfs/dbraw/zinc/42/85/26/459428526.db2.gz	JHGCCPCMYKHWIC-MSOLQXFVSA-N	0	3	337.895	3.223	20	30		EGEDHN
Cc1cc(C)cc(OC[C@H](O)CNCc2ccc(C#N)c(Cl)c2)c1	ZINC000591765719	459431459	/nfs/dbraw/zinc/43/14/59/459431459.db2.gz	CFPUDVGZGCHQDN-QGZVFWFLSA-N	0	3	344.842	3.358	20	30		EGEDHN
N#C[C@H]1CC[C@@H](NC[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000591771488	459432813	/nfs/dbraw/zinc/43/28/13/459432813.db2.gz	KONRGSLARVOPDO-QJPTWQEYSA-N	0	3	329.227	3.015	20	30		EGEDHN
CC[C@@H](NCCCC1(C#N)CCOCC1)c1nnc2n1CCCCC2	ZINC000595800321	459446751	/nfs/dbraw/zinc/44/67/51/459446751.db2.gz	RTTIKXGYVMXTQS-MRXNPFEDSA-N	0	3	345.491	3.146	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@H](Nc2ccc(Cl)c(C#N)n2)C1	ZINC000486932446	459524863	/nfs/dbraw/zinc/52/48/63/459524863.db2.gz	DEZRDRJOBFNZQN-ZFWWWQNUSA-N	0	3	326.831	3.276	20	30		EGEDHN
C=CCN(CCc1ccco1)C(=O)N[C@H](C)CN1CCC[C@H](C)C1	ZINC000497368330	459529735	/nfs/dbraw/zinc/52/97/35/459529735.db2.gz	LDUAKRPAWSFRRE-DLBZAZTESA-N	0	3	333.476	3.140	20	30		EGEDHN
Cc1ccccc1C1(NC[C@@H](O)COc2ccc(CC#N)cc2)CC1	ZINC000592139860	459533681	/nfs/dbraw/zinc/53/36/81/459533681.db2.gz	KWUQNRMNWOUENS-GOSISDBHSA-N	0	3	336.435	3.080	20	30		EGEDHN
Cc1nc(NC[C@H]2CCCN(C)[C@H]2c2cccs2)ccc1C#N	ZINC000488062879	459537866	/nfs/dbraw/zinc/53/78/66/459537866.db2.gz	IEWIRJADAPOJSJ-CRAIPNDOSA-N	0	3	326.469	3.240	20	30		EGEDHN
CN(CCCNC(=O)N1CCC(CCC#N)CC1)Cc1ccccc1	ZINC000569965870	459538941	/nfs/dbraw/zinc/53/89/41/459538941.db2.gz	ZDUIVWMWFDTJBD-UHFFFAOYSA-N	0	3	342.487	3.234	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@@H](c1ccccc1)N(CC)CC	ZINC000488544843	459545894	/nfs/dbraw/zinc/54/58/94/459545894.db2.gz	ATTSXDUEWQLNNH-IBGZPJMESA-N	0	3	325.456	3.487	20	30		EGEDHN
Cc1ccccc1[C@H](C(C)C)N(C)CC(=O)N[C@](C)(C#N)C1CC1	ZINC000488739275	459549895	/nfs/dbraw/zinc/54/98/95/459549895.db2.gz	KSHJDLAATCZTJK-VQTJNVASSA-N	0	3	327.472	3.432	20	30		EGEDHN
CC[C@@H]1CCC[C@@H](CN2CCN(c3nccnc3C#N)C[C@H]2C)C1	ZINC000542465661	459559576	/nfs/dbraw/zinc/55/95/76/459559576.db2.gz	IAIULSSPSAAEST-BRWVUGGUSA-N	0	3	327.476	3.075	20	30		EGEDHN
C=C[C@@](C)(CCOC)c1nc(-c2ccc(OCCN(C)C)cc2)no1	ZINC000571362775	459567485	/nfs/dbraw/zinc/56/74/85/459567485.db2.gz	UKXHUIIYSCGGJP-IBGZPJMESA-N	0	3	345.443	3.157	20	30		EGEDHN
CC(C)[C@H](NC(=O)C(C#N)CCc1ccccc1)C1(CO)CCC1	ZINC000571579279	459570577	/nfs/dbraw/zinc/57/05/77/459570577.db2.gz	DEYPJCHWZNDSML-MSOLQXFVSA-N	0	3	328.456	3.062	20	30		EGEDHN
C=CCN(CCc1ccco1)C(=O)NC[C@H](C)N1CCC[C@@H](C)C1	ZINC000498155014	459571583	/nfs/dbraw/zinc/57/15/83/459571583.db2.gz	HJUXSPFUVASXRF-SJORKVTESA-N	0	3	333.476	3.140	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN2CCC[C@@H]2[C@@H]2CCCOC2)c1C	ZINC000571795403	459573310	/nfs/dbraw/zinc/57/33/10/459573310.db2.gz	WZGBYKALZSBLJG-IEBWSBKVSA-N	0	3	330.472	3.365	20	30		EGEDHN
N#CCC[C@@H](NC(=O)Nc1cccc2c1CCNC2)c1ccccc1	ZINC000572464856	459579991	/nfs/dbraw/zinc/57/99/91/459579991.db2.gz	IGOPFTMGKIYHLN-GOSISDBHSA-N	0	3	334.423	3.499	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H](CC)Cc2ccc(Cl)cc2)CC1	ZINC000490670162	459584052	/nfs/dbraw/zinc/58/40/52/459584052.db2.gz	LHQROVMQKIFNQD-SFHVURJKSA-N	0	3	332.875	3.123	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCc2cc3c(s2)CCCC3)cc1	ZINC000527071550	459585823	/nfs/dbraw/zinc/58/58/23/459585823.db2.gz	MKLLJMICXNSFRQ-KRWDZBQOSA-N	0	3	349.459	3.497	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1F)C(C)C	ZINC000498377694	459587184	/nfs/dbraw/zinc/58/71/84/459587184.db2.gz	RTAYORHRDYGBMV-KRWDZBQOSA-N	0	3	349.406	3.162	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cnn([C@@H](C)CC)c2C2CC2)CC1	ZINC000490900821	459589605	/nfs/dbraw/zinc/58/96/05/459589605.db2.gz	YLEHDMFGWIQHMC-AWEZNQCLSA-N	0	3	328.460	3.015	20	30		EGEDHN
CC[C@@H](N[C@H](C)c1ccc(C#N)cc1)C(=O)NCc1cccs1	ZINC000592396041	459590722	/nfs/dbraw/zinc/59/07/22/459590722.db2.gz	NMWFIPUFEYIOOH-CXAGYDPISA-N	0	3	327.453	3.365	20	30		EGEDHN
C#CCN(C)CCCN[C@H](c1cccnc1)c1ccc(F)c(C)c1	ZINC000491073009	459596241	/nfs/dbraw/zinc/59/62/41/459596241.db2.gz	WZKBGGLLJSUDOS-FQEVSTJZSA-N	0	3	325.431	3.163	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)[C@@]2(C#N)CC23CCCC3)C1	ZINC000562639545	459609337	/nfs/dbraw/zinc/60/93/37/459609337.db2.gz	AOCCSPUGZBWCBH-BLIXFSHQSA-N	0	3	337.467	3.412	20	30		EGEDHN
CCN(Cc1cnc2c(C#N)cnn2c1)[C@@H](C)Cc1ccc(OC)cc1	ZINC000592496644	459614610	/nfs/dbraw/zinc/61/46/10/459614610.db2.gz	CHWRISQDIPUQMA-HNNXBMFYSA-N	0	3	349.438	3.063	20	30		EGEDHN
C#CCNC(=O)C1CCN(Cc2cccc(Oc3ccccc3)c2)CC1	ZINC000491385975	459622405	/nfs/dbraw/zinc/62/24/05/459622405.db2.gz	TYIPAECDEDUGEN-UHFFFAOYSA-N	0	3	348.446	3.440	20	30		EGEDHN
C#CCN(C(=O)Nc1cccc(OCCN(C)C)c1)C1CCCC1	ZINC000491395297	459622841	/nfs/dbraw/zinc/62/28/41/459622841.db2.gz	RTWZVUVDEVAWCJ-UHFFFAOYSA-N	0	3	329.444	3.037	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H]2CCc3ccc(C)cc32)CC1	ZINC000592530664	459628135	/nfs/dbraw/zinc/62/81/35/459628135.db2.gz	VIDYLHFEALTAFV-IBGZPJMESA-N	0	3	327.472	3.322	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1cc(-c2ccccn2)ccc1Cl	ZINC000491666935	459650685	/nfs/dbraw/zinc/65/06/85/459650685.db2.gz	KIDTZTVFASSXOK-UHFFFAOYSA-N	0	3	341.842	3.087	20	30		EGEDHN
C=C[C@@H]1CCCCN1CCC(=O)Nc1sc2c(c1C#N)CCC2	ZINC000584225054	459684307	/nfs/dbraw/zinc/68/43/07/459684307.db2.gz	WEVUYQCVAYRZMU-CYBMUJFWSA-N	0	3	329.469	3.478	20	30		EGEDHN
C#CCCN1CCC(NC(=O)/C=C/c2ccc(C)c(Cl)c2)CC1	ZINC000491909017	459684325	/nfs/dbraw/zinc/68/43/25/459684325.db2.gz	WAGLRPZUCLCZJK-BQYQJAHWSA-N	0	3	330.859	3.266	20	30		EGEDHN
O[C@@H](CNCC#Cc1ccccc1)Cc1ccc(C(F)(F)F)cc1	ZINC000562984711	459686055	/nfs/dbraw/zinc/68/60/55/459686055.db2.gz	ICXUSDXBEAVZQY-GOSISDBHSA-N	0	3	333.353	3.250	20	30		EGEDHN
C=CCN1CCC(NCc2ncc(Cl)cc2Br)CC1	ZINC000527656196	459686854	/nfs/dbraw/zinc/68/68/54/459686854.db2.gz	DFQBZLMOEGJHFS-UHFFFAOYSA-N	0	3	344.684	3.238	20	30		EGEDHN
C[C@@H]1C[C@H](c2ccccc2)[C@H](C)N1Cc1cnc2c(C#N)cnn2c1	ZINC000573802476	459737758	/nfs/dbraw/zinc/73/77/58/459737758.db2.gz	JRRPNEAGUUPUAR-VCBZYWHSSA-N	0	3	331.423	3.367	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)/C=C/C1CCCC1	ZINC000493380679	459742931	/nfs/dbraw/zinc/74/29/31/459742931.db2.gz	FYJYLNPGOAHSBX-VAWYXSNFSA-N	0	3	325.456	3.195	20	30		EGEDHN
CN(C)CCN(Cc1ccsc1)C(=O)/C=C/c1ccc(C#N)cc1	ZINC000493496750	459747171	/nfs/dbraw/zinc/74/71/71/459747171.db2.gz	OYLPQNJWSCVJGW-BQYQJAHWSA-N	0	3	339.464	3.223	20	30		EGEDHN
CN1CCN(CCCOc2cccc(C#N)c2)[C@H](Cc2ccccc2)C1	ZINC000593090402	459769883	/nfs/dbraw/zinc/76/98/83/459769883.db2.gz	WQGDHDDIQBFWEP-OAQYLSRUSA-N	0	3	349.478	3.186	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CC[C@H](c2ccncc2)C1	ZINC000574098567	459778760	/nfs/dbraw/zinc/77/87/60/459778760.db2.gz	QQRRADLCCMRAGY-PMACEKPBSA-N	0	3	338.451	3.039	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CCC[C@H]1[C@H]1CCCOC1	ZINC000565021259	459780778	/nfs/dbraw/zinc/78/07/78/459780778.db2.gz	SAAXGUYJDPSZKR-FHWLQOOXSA-N	0	3	326.440	3.177	20	30		EGEDHN
C[C@@]1(NC(=O)Nc2ccc(C#N)cc2)CCN(Cc2ccccc2)C1	ZINC000593133149	459784210	/nfs/dbraw/zinc/78/42/10/459784210.db2.gz	CVTZQECLQFESIM-HXUWFJFHSA-N	0	3	334.423	3.344	20	30		EGEDHN
CCCN(CCN1CCCCCC1)C(=O)NCC#Cc1ccccc1	ZINC000565921546	459789755	/nfs/dbraw/zinc/78/97/55/459789755.db2.gz	DVSWNKVUEFEFEB-UHFFFAOYSA-N	0	3	341.499	3.336	20	30		EGEDHN
N#Cc1ccc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)cc1F	ZINC000593158158	459791373	/nfs/dbraw/zinc/79/13/73/459791373.db2.gz	SJLOWSYIDHSDOX-RYUDHWBXSA-N	0	3	330.281	3.383	20	30		EGEDHN
C=CCn1c(C)nnc1N1CCN(Cc2ccccc2)[C@H](C(C)C)C1	ZINC000528295541	459801972	/nfs/dbraw/zinc/80/19/72/459801972.db2.gz	NDWQFXDFTOFFRE-IBGZPJMESA-N	0	3	339.487	3.119	20	30		EGEDHN
C[C@H]1O[C@@H](C)[C@@H](C)[C@H]1C(=O)C(C#N)c1nc(-c2ccncc2)cs1	ZINC000528932589	459818560	/nfs/dbraw/zinc/81/85/60/459818560.db2.gz	HSLVBRTYMJKGFM-YCSFKOBZSA-N	0	3	341.436	3.441	20	30		EGEDHN
C[C@H](NC[C@@H]1CNc2c(C#N)cnn2C1)c1cc2cccc(F)c2o1	ZINC000566243267	459828159	/nfs/dbraw/zinc/82/81/59/459828159.db2.gz	RSEOTPOAEGDHAX-NWDGAFQWSA-N	0	3	339.374	3.033	20	30		EGEDHN
C[C@H](CN1CCC(C)CC1)NC(=O)C(C)(C)c1cc(F)cc(C#N)c1	ZINC000598259642	459841539	/nfs/dbraw/zinc/84/15/39/459841539.db2.gz	CGZKPPPAOZKPNZ-OAHLLOKOSA-N	0	3	345.462	3.212	20	30		EGEDHN
N#C[C@H]1CC[C@@H](NC[C@@H](O)COc2cc(Cl)ccc2Cl)C1	ZINC000574804051	459874682	/nfs/dbraw/zinc/87/46/82/459874682.db2.gz	PYOWHPUEXAMAJU-CYZMBNFOSA-N	0	3	329.227	3.015	20	30		EGEDHN
CCCN(CCN1CCCC1)C(=O)c1cc2ccccc2n1CC#N	ZINC000587973206	459897067	/nfs/dbraw/zinc/89/70/67/459897067.db2.gz	OHGPLJAAICVAPS-UHFFFAOYSA-N	0	3	338.455	3.113	20	30		EGEDHN
COc1ccc2nc(C3CC3)cc(C(=O)C(C#N)c3ccncn3)c2c1	ZINC000546153545	459901208	/nfs/dbraw/zinc/90/12/08/459901208.db2.gz	NSPKGMFPXSSULR-INIZCTEOSA-N	0	3	344.374	3.401	20	30		EGEDHN
CC(C)(CNCc1cnc2c(C#N)cnn2c1)c1ccccc1Cl	ZINC000609075892	459902360	/nfs/dbraw/zinc/90/23/60/459902360.db2.gz	NIYWLURLSZXBIL-UHFFFAOYSA-N	0	3	339.830	3.322	20	30		EGEDHN
C=C(C)[C@H](Cc1nc(-c2ccc(OCCN(C)C)cc2)no1)OCC	ZINC000546295951	459908476	/nfs/dbraw/zinc/90/84/76/459908476.db2.gz	PAQRLQDNRYWDGU-KRWDZBQOSA-N	0	3	345.443	3.201	20	30		EGEDHN
CN(C)Cc1ccccc1NC(=O)c1cc2ccccc2n1CC#N	ZINC000609163307	459916581	/nfs/dbraw/zinc/91/65/81/459916581.db2.gz	ZLXLDKYHERTNHY-UHFFFAOYSA-N	0	3	332.407	3.479	20	30		EGEDHN
C[C@H](CN1CCC[C@@H](C)C1)NC(=O)c1cc2ccccc2n1CC#N	ZINC000609166887	459917639	/nfs/dbraw/zinc/91/76/39/459917639.db2.gz	NVMHOSLIMAAAIM-HZPDHXFCSA-N	0	3	338.455	3.015	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCN2CCCO[C@@H](c3ccccc3)C2)cc1	ZINC000609234349	459928585	/nfs/dbraw/zinc/92/85/85/459928585.db2.gz	QILACDXORAZNQE-HXUWFJFHSA-N	0	3	349.434	3.350	20	30		EGEDHN
C[C@H]1c2ccccc2CCN1C[C@@H](O)COc1ccc(CC#N)cc1	ZINC000609316940	459942986	/nfs/dbraw/zinc/94/29/86/459942986.db2.gz	DWDITGJYBHXVCZ-QFBILLFUSA-N	0	3	336.435	3.112	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN1CCC(OCCc2ccccc2)CC1	ZINC000598585914	459953175	/nfs/dbraw/zinc/95/31/75/459953175.db2.gz	BHUUCRGJFAWTMF-SFHVURJKSA-N	0	3	330.472	3.011	20	30		EGEDHN
Cc1ncsc1CNC1CCN(Cc2cccc(C#N)c2)CC1	ZINC000593692333	459953283	/nfs/dbraw/zinc/95/32/83/459953283.db2.gz	BUAFIOWKEFWJEZ-UHFFFAOYSA-N	0	3	326.469	3.077	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN1CCC(OCCc2ccccc2)CC1	ZINC000598585902	459953492	/nfs/dbraw/zinc/95/34/92/459953492.db2.gz	BHUUCRGJFAWTMF-GOSISDBHSA-N	0	3	330.472	3.011	20	30		EGEDHN
COc1ccc(OC)c([C@@H]2CCCN2C[C@H](O)CC(C)(C)C#N)c1	ZINC000598587180	459953556	/nfs/dbraw/zinc/95/35/56/459953556.db2.gz	OMGGLCVDWYYOQQ-PBHICJAKSA-N	0	3	332.444	3.141	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN[C@@H](CCO)c1ccc(Cl)c(Cl)c1	ZINC000598617499	459965386	/nfs/dbraw/zinc/96/53/86/459965386.db2.gz	SQVNBYPUDLRICO-WFASDCNBSA-N	0	3	345.270	3.307	20	30		EGEDHN
CC[C@H](C#N)C(=O)Nc1cc(Cl)ccc1OC1CCN(C)CC1	ZINC000593739275	459969022	/nfs/dbraw/zinc/96/90/22/459969022.db2.gz	XQXRYITZBXWTKP-GFCCVEGCSA-N	0	3	335.835	3.301	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN1CCC2(C=Cc3ccccc3O2)CC1	ZINC000598628795	459969183	/nfs/dbraw/zinc/96/91/83/459969183.db2.gz	SCPAAHMZDCSULU-KRWDZBQOSA-N	0	3	326.440	3.228	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN1CCC2(C=Cc3ccccc3O2)CC1	ZINC000598628796	459969355	/nfs/dbraw/zinc/96/93/55/459969355.db2.gz	SCPAAHMZDCSULU-QGZVFWFLSA-N	0	3	326.440	3.228	20	30		EGEDHN
C[C@@H](c1ccncc1)N1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000609487786	459969671	/nfs/dbraw/zinc/96/96/71/459969671.db2.gz	XLKZIMWJPBMFAK-HNNXBMFYSA-N	0	3	334.423	3.365	20	30		EGEDHN
CCN1CCC[C@H]1CN(Cc1ccncc1)C(=O)CCCCCC#N	ZINC000588751338	459976464	/nfs/dbraw/zinc/97/64/64/459976464.db2.gz	UNBMNGFZJOZEGB-IBGZPJMESA-N	0	3	342.487	3.369	20	30		EGEDHN
C[C@H](NCC1(c2ccccc2)CCCCC1)C(=O)N(C)CCC#N	ZINC000609574368	459984520	/nfs/dbraw/zinc/98/45/20/459984520.db2.gz	NCSZBWZBPCSGFC-KRWDZBQOSA-N	0	3	327.472	3.239	20	30		EGEDHN
CC1(C)[C@@H](c2cccc(F)c2)CCN1C(=O)[C@H](N)CCCCC#N	ZINC000602552331	459993918	/nfs/dbraw/zinc/99/39/18/459993918.db2.gz	OKNFPEJYSDEXAJ-IAGOWNOFSA-N	0	3	331.435	3.331	20	30		EGEDHN
COc1ccc(CNC[C@H](O)CC(C)(C)C#N)c(C(F)(F)F)c1	ZINC000598720540	460006827	/nfs/dbraw/zinc/00/68/27/460006827.db2.gz	OOGSOOGUICADGX-GFCCVEGCSA-N	0	3	330.350	3.104	20	30		EGEDHN
CN(CCCN(C)C(=O)CC1(C#N)CCCCC1)Cc1ccncc1	ZINC000597655815	460018917	/nfs/dbraw/zinc/01/89/17/460018917.db2.gz	HVIBFNYFADUHLX-UHFFFAOYSA-N	0	3	342.487	3.226	20	30		EGEDHN
Cc1ncc([C@@H](C)N(CCN(C)C)Cc2ccc(C#N)cc2)c(C)n1	ZINC000602659188	460048513	/nfs/dbraw/zinc/04/85/13/460048513.db2.gz	JNRPZOHOEKPVCW-MRXNPFEDSA-N	0	3	337.471	3.090	20	30		EGEDHN
CC[C@@H](NCc1ccc2c(c1)CCS2(=O)=O)c1ccc(C#N)cc1	ZINC000618572104	460067606	/nfs/dbraw/zinc/06/76/06/460067606.db2.gz	ZBXDLGIDVCVJAV-GOSISDBHSA-N	0	3	340.448	3.129	20	30		EGEDHN
CC[C@@H](C#N)N(C)C(=O)c1ccccc1OCCN1CCCC[C@H]1C	ZINC000594095065	460099235	/nfs/dbraw/zinc/09/92/35/460099235.db2.gz	SOOBDJMXBZQTIO-SJORKVTESA-N	0	3	343.471	3.314	20	30		EGEDHN
CCO[C@@H]1C[C@H](N[C@H](C)C(=O)Nc2ccccc2C#N)C12CCCC2	ZINC000610345465	460127576	/nfs/dbraw/zinc/12/75/76/460127576.db2.gz	ZCLPJORTHOILLV-FHLIZLRMSA-N	0	3	341.455	3.213	20	30		EGEDHN
CC(C)[C@H](NCc1cccc(OCCCC#N)c1)[C@H](O)C(F)(F)F	ZINC000589820531	460143009	/nfs/dbraw/zinc/14/30/09/460143009.db2.gz	KIIKXAPRFMRPPT-HOTGVXAUSA-N	0	3	344.377	3.407	20	30		EGEDHN
C[C@@H]1CCc2c(F)cccc2[C@H]1NCc1cnc2c(C#N)cnn2c1	ZINC000576466061	460147700	/nfs/dbraw/zinc/14/77/00/460147700.db2.gz	MKTJDPLGRRACBV-XIKOKIGWSA-N	0	3	335.386	3.153	20	30		EGEDHN
CC[C@](C)(NCC(=O)NCc1cccc(C#N)c1)c1ccc(F)cc1	ZINC000602927981	460191367	/nfs/dbraw/zinc/19/13/67/460191367.db2.gz	UYLUSZOINYVCTQ-FQEVSTJZSA-N	0	3	339.414	3.229	20	30		EGEDHN
COc1ccc2cc(CN(C)C(=O)[C@H](N)CCCCC#N)ccc2c1	ZINC000594425993	460215779	/nfs/dbraw/zinc/21/57/79/460215779.db2.gz	OAXQRESFJNHPGP-LJQANCHMSA-N	0	3	339.439	3.218	20	30		EGEDHN
CCc1nnc(N2CC[C@@H](N(C)Cc3ccccc3)C2)c(C#N)c1CC	ZINC000610717231	460224017	/nfs/dbraw/zinc/22/40/17/460224017.db2.gz	STDSNUSFVFDXKC-QGZVFWFLSA-N	0	3	349.482	3.184	20	30		EGEDHN
N#CC[C@@H](CC(=O)N1CCCN(c2ccncc2)CC1)c1ccccc1	ZINC000603084968	460239985	/nfs/dbraw/zinc/23/99/85/460239985.db2.gz	YZGHEMLWXFLLFK-IBGZPJMESA-N	0	3	348.450	3.208	20	30		EGEDHN
C[C@@H](NC1CCN(CC#N)CC1)c1ccccc1OC(F)(F)F	ZINC000610812958	460241253	/nfs/dbraw/zinc/24/12/53/460241253.db2.gz	QQASKMIFHBZCJV-GFCCVEGCSA-N	0	3	327.350	3.224	20	30		EGEDHN
C[C@H](NCCC(=O)N1CCc2ccccc2C1)c1cccc(C#N)c1	ZINC000614911569	460244367	/nfs/dbraw/zinc/24/43/67/460244367.db2.gz	NGUQIBAKOUXYNV-INIZCTEOSA-N	0	3	333.435	3.184	20	30		EGEDHN
CC(C)(C#N)CCCCN(Cc1ccccc1)[C@]1(CO)CCOC1	ZINC000599395647	460245459	/nfs/dbraw/zinc/24/54/59/460245459.db2.gz	GXKVTNYNPMEGLS-FQEVSTJZSA-N	0	3	330.472	3.360	20	30		EGEDHN
C[C@@H](N[C@@H](C)c1cccc(NS(C)(=O)=O)c1)c1cccc(C#N)c1	ZINC000610830415	460245479	/nfs/dbraw/zinc/24/54/79/460245479.db2.gz	RKAMBOMYYSFVAT-KGLIPLIRSA-N	0	3	343.452	3.342	20	30		EGEDHN
C[C@@H](NC(=O)N1CCN(C2CCCCC2)CC1)c1cccc(C#N)c1	ZINC000610846908	460247318	/nfs/dbraw/zinc/24/73/18/460247318.db2.gz	WPPOWXXSWKOWER-MRXNPFEDSA-N	0	3	340.471	3.279	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CCCN(C[C@H]2CCCO2)CC1	ZINC000610859569	460249558	/nfs/dbraw/zinc/24/95/58/460249558.db2.gz	OJANHNKJLLJKGK-LJQANCHMSA-N	0	3	341.499	3.174	20	30		EGEDHN
Cc1ncc([C@H](C)N2CCCN(Cc3ccc(C#N)cc3)CC2)c(C)n1	ZINC000614963549	460253257	/nfs/dbraw/zinc/25/32/57/460253257.db2.gz	HLMCAPZNYZAYMC-KRWDZBQOSA-N	0	3	349.482	3.234	20	30		EGEDHN
COc1ccc(CN2CC[C@@H](N(C)Cc3ccccc3)C2)cc1C#N	ZINC000610994625	460274742	/nfs/dbraw/zinc/27/47/42/460274742.db2.gz	KZEJLRVUTANMLJ-HXUWFJFHSA-N	0	3	335.451	3.273	20	30		EGEDHN
C=CCC1(NCCS(=O)(=O)c2ccc(F)cc2)CCCCC1	ZINC000625934445	460308697	/nfs/dbraw/zinc/30/86/97/460308697.db2.gz	NUFRFCDWZMUDON-UHFFFAOYSA-N	0	3	325.449	3.468	20	30		EGEDHN
Cn1c2ccc(C(=O)C(C#N)c3ccc4ccccc4n3)cc2[nH]c1=O	ZINC000603627824	460328565	/nfs/dbraw/zinc/32/85/65/460328565.db2.gz	XGKQOVFKTGCVBT-CQSZACIVSA-N	0	3	342.358	3.317	20	30		EGEDHN
C[C@H](NCCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1cccc(C#N)c1	ZINC000611387197	460349975	/nfs/dbraw/zinc/34/99/75/460349975.db2.gz	GZTZWZRYTIABDK-ZDUSSCGKSA-N	0	3	338.367	3.146	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2NCCC(=O)N1CCCCCC1	ZINC000611391973	460353989	/nfs/dbraw/zinc/35/39/89/460353989.db2.gz	DAGXBPIXINIDQJ-IBGZPJMESA-N	0	3	325.456	3.318	20	30		EGEDHN
CN(Cc1ccccc1)C[C@H](O)CN[C@H](CCC#N)c1ccccc1	ZINC000611407024	460356648	/nfs/dbraw/zinc/35/66/48/460356648.db2.gz	VCGFFJBGBMRSQC-NHCUHLMSSA-N	0	3	337.467	3.114	20	30		EGEDHN
C[C@H](NCCC(=O)N1CCc2sccc2C1)c1cccc(C#N)c1	ZINC000611438347	460365576	/nfs/dbraw/zinc/36/55/76/460365576.db2.gz	ZCSSABNIJXLJGU-AWEZNQCLSA-N	0	3	339.464	3.245	20	30		EGEDHN
Cc1cccc(C)c1OC[C@@H](O)CN[C@H](C)c1ccc(C#N)c(F)c1	ZINC000611465531	460370661	/nfs/dbraw/zinc/37/06/61/460370661.db2.gz	LIEMZMWROJTPTL-QAPCUYQASA-N	0	3	342.414	3.405	20	30		EGEDHN
C[C@H](N[C@@H]1CCN(C(=O)C2CCCC2)C1)c1ccc(C#N)c(F)c1	ZINC000611466030	460370671	/nfs/dbraw/zinc/37/06/71/460370671.db2.gz	OHUCDOKMFAWAHH-SUMWQHHRSA-N	0	3	329.419	3.139	20	30		EGEDHN
C[C@H](CNC(=O)NCc1ccc(C#N)c(Cl)c1)N1CCCC[C@@H]1C	ZINC000619756016	460431845	/nfs/dbraw/zinc/43/18/45/460431845.db2.gz	PTCJCODPTWIXDB-UONOGXRCSA-N	0	3	348.878	3.274	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC[C@@H]2CCc3ccccc3C2)CC1	ZINC000605017474	460525104	/nfs/dbraw/zinc/52/51/04/460525104.db2.gz	VOFWTSATCLVUBG-QGZVFWFLSA-N	0	3	341.499	3.131	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](CN(C)Cc3scnc3C)C2)C1	ZINC000632634915	460789602	/nfs/dbraw/zinc/78/96/02/460789602.db2.gz	YWEFYTXFUJCIMB-OAHLLOKOSA-N	0	3	333.501	3.088	20	30		EGEDHN
C[C@@H](NC(=O)C(C#N)CCc1ccccc1)c1ccc2[nH]c(=O)oc2c1	ZINC000601864969	460929990	/nfs/dbraw/zinc/92/99/90/460929990.db2.gz	NLMVPVFHKZFRNB-CZUORRHYSA-N	0	3	349.390	3.483	20	30		EGEDHN
N#C[C@H]1CC[C@@H](NC[C@H](O)COc2cc(Cl)cc(Cl)c2)C1	ZINC000601962806	460964319	/nfs/dbraw/zinc/96/43/19/460964319.db2.gz	AZALFSHDMSMGTA-GDLCADMTSA-N	0	3	329.227	3.015	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)C(=O)N[C@@H]1CCN(C(C)(C)C)C1	ZINC000665556962	461125260	/nfs/dbraw/zinc/12/52/60/461125260.db2.gz	INGHOKSHJGXRBV-QGZVFWFLSA-N	0	3	345.487	3.266	20	30		EGEDHN
C=CCn1c(C)nnc1N1C[C@H](C)N(Cc2ccccc2)[C@@H](C)[C@@H]1C	ZINC000652567379	461267583	/nfs/dbraw/zinc/26/75/83/461267583.db2.gz	UESINPZCDBGXAH-ULQDDVLXSA-N	0	3	339.487	3.260	20	30		EGEDHN
C=CCOc1cccc(CN[C@@H](CC)C(=O)NCc2cccs2)c1	ZINC000647242537	461583627	/nfs/dbraw/zinc/58/36/27/461583627.db2.gz	YRYOLILNHLFMPO-SFHVURJKSA-N	0	3	344.480	3.498	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCOc3ccccc3[C@H]2C)CC1	ZINC000660596305	461871171	/nfs/dbraw/zinc/87/11/71/461871171.db2.gz	DLMLUTLXANNVBI-MRXNPFEDSA-N	0	3	343.471	3.192	20	30		EGEDHN
C=CCCn1cc(CN[C@H](C)Cc2cn(C)c3ccc(F)cc23)nn1	ZINC000657494412	462155886	/nfs/dbraw/zinc/15/58/86/462155886.db2.gz	AJMLOOBFVFQWLX-CQSZACIVSA-N	0	3	341.434	3.206	20	30		EGEDHN
C=CCN(Cc1ccc(OCc2nccn2C)cc1)[C@@H](C)COC	ZINC000661242054	462165509	/nfs/dbraw/zinc/16/55/09/462165509.db2.gz	IURSGNGWNWDKEL-INIZCTEOSA-N	0	3	329.444	3.022	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)N[C@H]1CCCN2CCCC[C@H]12	ZINC000654439616	462225753	/nfs/dbraw/zinc/22/57/53/462225753.db2.gz	SJJYGHNYHHHSKI-ZWKOTPCHSA-N	0	3	343.471	3.068	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC2(c3ccccc3C)CC2)CC1	ZINC000645265451	462260274	/nfs/dbraw/zinc/26/02/74/462260274.db2.gz	ZDONVIQAHFXZOE-UHFFFAOYSA-N	0	3	327.472	3.324	20	30		EGEDHN
C=CCN(CC(=O)N(CC)Cc1ccc(OC)c(OC)c1)C(C)(C)C	ZINC000661754681	462397600	/nfs/dbraw/zinc/39/76/00/462397600.db2.gz	AQHVUJOJRKRMKY-UHFFFAOYSA-N	0	3	348.487	3.339	20	30		EGEDHN
C=CCNC(=O)CN(CC)[C@H](C)Cc1ccc(C(F)(F)F)cc1	ZINC000662159048	462532677	/nfs/dbraw/zinc/53/26/77/462532677.db2.gz	YRPXSOPNQYLCNT-CYBMUJFWSA-N	0	3	328.378	3.261	20	30		EGEDHN
C[C@@H]1CCSCCN1Cc1cn(C)nc1-c1ccc(C#N)cc1	ZINC000191818679	534122874	/nfs/dbraw/zinc/12/28/74/534122874.db2.gz	UGIVUNYULGDGKB-CQSZACIVSA-N	0	3	326.469	3.286	20	30		EGEDHN
Cc1oc(NC(=O)[C@H](C)N[C@@H]2CC(C)(C)OC2(C)C)c(C#N)c1C	ZINC000132529781	534547840	/nfs/dbraw/zinc/54/78/40/534547840.db2.gz	GKCQPUFLSJIVSM-SMDDNHRTSA-N	0	3	333.432	3.031	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc3c(cccc3OC(F)F)[nH]2)CC1	ZINC000171721137	526445974	/nfs/dbraw/zinc/44/59/74/526445974.db2.gz	ZBYXUYSMEFIZLB-UHFFFAOYSA-N	0	3	349.381	3.150	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(Oc3cccnc3)cc2)CC1	ZINC000171714752	526447711	/nfs/dbraw/zinc/44/77/11/526447711.db2.gz	NEJXPMMCNUGONR-UHFFFAOYSA-N	0	3	337.423	3.254	20	30		EGEDHN
CC1(C)C[C@H](NCC(=O)Nc2ccc(C#N)c(Cl)c2)C(C)(C)O1	ZINC000132433665	527741144	/nfs/dbraw/zinc/74/11/44/527741144.db2.gz	GMHSBAMFNUTJQN-AWEZNQCLSA-N	0	3	335.835	3.086	20	30		EGEDHN
CN(C)C[C@H](NC(=O)Nc1cccc(C#N)c1)c1ccc(F)cc1	ZINC000338359118	535951765	/nfs/dbraw/zinc/95/17/65/535951765.db2.gz	OOHFJMPRDCBKPL-KRWDZBQOSA-N	0	3	326.375	3.122	20	30		EGEDHN
COC1CCC(N(C)CC(=O)Nc2ccc(C#N)c(Cl)c2)CC1	ZINC000265221317	536732338	/nfs/dbraw/zinc/73/23/38/536732338.db2.gz	OQWJUKFSBOUWBO-UHFFFAOYSA-N	0	3	335.835	3.040	20	30		EGEDHN
Cc1cc2c(o1)CC(C)(C)C[C@@H]2NC(=O)N[C@H]1CCN(C2CC2)C1	ZINC000329307322	547494747	/nfs/dbraw/zinc/49/47/47/547494747.db2.gz	POOGGYMGFNAYFF-BBRMVZONSA-N	0	3	331.460	3.342	20	30		EGEDHN
N#C[C@@H]1CCC[C@H]1NC(=O)NCCN1CCC2(CCCCC2)CC1	ZINC000333028998	547527617	/nfs/dbraw/zinc/52/76/17/547527617.db2.gz	BTUZRPUREJOJDA-DLBZAZTESA-N	0	3	332.492	3.024	20	30		EGEDHN
N#CC(C(=O)c1ccc(C(F)F)cc1)c1nnc2n1CCCCC2	ZINC000338857140	547565984	/nfs/dbraw/zinc/56/59/84/547565984.db2.gz	OHTVPECEVSYYIQ-ZDUSSCGKSA-N	0	3	330.338	3.432	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2C[C@H](C(F)(F)F)CC[C@H]2C)CC1	ZINC000679490745	549719889	/nfs/dbraw/zinc/71/98/89/549719889.db2.gz	UZYTWMFNLCRDOZ-CHWSQXEVSA-N	0	3	333.398	3.009	20	30		EGEDHN
C[C@H](CNC(=O)N(Cc1ccc(C#N)cc1)C1CC1)N1CCCCC1	ZINC000727601104	574677714	/nfs/dbraw/zinc/67/77/14/574677714.db2.gz	QHTOYDYFMWAVNK-MRXNPFEDSA-N	0	3	340.471	3.107	20	30		EGEDHN
CCCCCCCCCN(C)C(=O)NC[C@@H]1CN2CCC[C@@H]2CO1	ZINC000729504346	574866349	/nfs/dbraw/zinc/86/63/49/574866349.db2.gz	HREPRMHGMUGSFC-QZTJIDSGSA-N	0	3	339.524	3.242	20	30		EGEDHN
C#CCOc1ccc(NC(=O)NC[C@H](C)N2CCCC[C@H]2C)cc1	ZINC000731114604	575055577	/nfs/dbraw/zinc/05/55/77/575055577.db2.gz	IYTDXNPXMAMHKI-CVEARBPZSA-N	0	3	329.444	3.083	20	30		EGEDHN
CN(Cc1ccc(OCC#N)cc1)Cc1ccc(C(=O)NC2CC2)cc1	ZINC000731210453	575060344	/nfs/dbraw/zinc/06/03/44/575060344.db2.gz	OCNNQGKRSBAVFA-UHFFFAOYSA-N	0	3	349.434	3.113	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1Cl)C(=O)[C@@H]1COc2ccccc21	ZINC000733678885	575381255	/nfs/dbraw/zinc/38/12/55/575381255.db2.gz	NIVIWGPNSVUNEP-QWHCGFSZSA-N	0	3	340.766	3.164	20	30		EGEDHN
C#CCOc1ccc(CNC[C@H](NC(=O)OC(C)(C)C)C(C)C)cc1	ZINC000734512666	575504958	/nfs/dbraw/zinc/50/49/58/575504958.db2.gz	VRJOLFUVAVFKAY-SFHVURJKSA-N	0	3	346.471	3.338	20	30		EGEDHN
C#CCCN1CCC(NC(=O)CSc2ccccc2Cl)CC1	ZINC000740737689	576621953	/nfs/dbraw/zinc/62/19/53/576621953.db2.gz	JDXCEUVMHVUSBV-UHFFFAOYSA-N	0	3	336.888	3.036	20	30		EGEDHN
CCCCCCCCOCC(=O)N1CCN(c2ccncc2)CC1	ZINC000741662138	576709326	/nfs/dbraw/zinc/70/93/26/576709326.db2.gz	KRBGIMNNRQHVMX-UHFFFAOYSA-N	0	3	333.476	3.107	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2ccc(Oc3ccccc3)nc2)CC1	ZINC000743493564	576810409	/nfs/dbraw/zinc/81/04/09/576810409.db2.gz	ZLIJWFCSZFMRNR-UHFFFAOYSA-N	0	3	349.434	3.091	20	30		EGEDHN
C#Cc1ccc(C(=O)N(CC)C[C@H]2CCN(Cc3ccccc3)C2)nc1	ZINC000743781776	576815858	/nfs/dbraw/zinc/81/58/58/576815858.db2.gz	GJOHZIUFQQOFMD-FQEVSTJZSA-N	0	3	347.462	3.047	20	30		EGEDHN
C#CCNC(=O)[C@H](C)N[C@H](Cc1ccccc1Cl)c1ccccc1	ZINC000745175783	576843003	/nfs/dbraw/zinc/84/30/03/576843003.db2.gz	JNDALKLBHIZMPE-HNAYVOBHSA-N	0	3	340.854	3.351	20	30		EGEDHN
C=CCN(Cc1cccc(C#N)c1)C(=O)NC[C@H](C)N1CCCCC1	ZINC000745277253	576844920	/nfs/dbraw/zinc/84/49/20/576844920.db2.gz	LPRURBOJGBKMIJ-KRWDZBQOSA-N	0	3	340.471	3.130	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CNCc2cc(Br)ccc2F)cc1	ZINC000041069389	1291411740	/nfs/dbraw/zinc/41/17/40/1291411740.db2.gz	LZQWPUQIIJUPAF-INIZCTEOSA-N	0	3	349.203	3.283	20	30		EGEDHN
N#CC(C(=O)CCCc1nc(-c2cccs2)no1)c1ccccn1	ZINC000049458136	1291628170	/nfs/dbraw/zinc/62/81/70/1291628170.db2.gz	WAQZCDIMFJHJHA-LBPRGKRZSA-N	0	3	338.392	3.392	20	30		EGEDHN
C=C(C)CNC(=S)NC[C@H](c1cccc(OC)c1)N(CC)CC	ZINC000053584695	1291726708	/nfs/dbraw/zinc/72/67/08/1291726708.db2.gz	CAYXFWLKCFDYAX-QGZVFWFLSA-N	0	3	335.517	3.118	20	30		EGEDHN
N#CCCCOC(=O)C1CCN(c2cc(Cl)ccc2Cl)C1=O	ZINC000064072364	1292040210	/nfs/dbraw/zinc/04/02/10/1292040210.db2.gz	RFYKKZFKMVJFBZ-NSHDSACASA-N	0	3	341.194	3.193	20	30		EGEDHN
COc1ccc(CNCc2ccc(OCC#N)cc2)cc1OC(F)F	ZINC000075756222	1292408047	/nfs/dbraw/zinc/40/80/47/1292408047.db2.gz	VLJAMZPWFFXDEE-UHFFFAOYSA-N	0	3	348.349	3.489	20	30		EGEDHN
COc1ccc(OCCC(=O)C(C#N)c2nc3ccccc3o2)cc1	ZINC000078735900	1292523264	/nfs/dbraw/zinc/52/32/64/1292523264.db2.gz	FXZXHVSHLBXJPE-OAHLLOKOSA-N	0	3	336.347	3.482	20	30		EGEDHN
N#Cc1ccccc1-c1ccc(CN2CC[C@H]3COC(=O)N[C@@H]3C2)cc1	ZINC000830934170	1292787202	/nfs/dbraw/zinc/78/72/02/1292787202.db2.gz	NDGYBFVEIDHKGE-AZUAARDMSA-N	0	3	347.418	3.156	20	30		EGEDHN
C#CCN1CCC(C(=O)NC[C@H]2CCC(C)(C)c3ccccc32)CC1	ZINC000091803695	1292842622	/nfs/dbraw/zinc/84/26/22/1292842622.db2.gz	GGTFHYOLJPGFHC-GOSISDBHSA-N	0	3	338.495	3.303	20	30		EGEDHN
COc1ccccc1OCCN(C)Cc1ccc(O[C@H](C)C#N)cc1	ZINC000091899855	1292847592	/nfs/dbraw/zinc/84/75/92/1292847592.db2.gz	REXCURCIFHDEDW-MRXNPFEDSA-N	0	3	340.423	3.497	20	30		EGEDHN
C#Cc1cccc(CN[C@H](C)c2ccc(N3CCOCC3)c(F)c2)c1	ZINC000834902341	1293170025	/nfs/dbraw/zinc/17/00/25/1293170025.db2.gz	GXGYORJRYXZXFI-MRXNPFEDSA-N	0	3	338.426	3.494	20	30		EGEDHN
CCC[C@H](OC)C(=O)C(C#N)C(=O)Nc1c(CC)cccc1CC	ZINC000835062931	1293196727	/nfs/dbraw/zinc/19/67/27/1293196727.db2.gz	GRNGWMURQJNVOS-CVEARBPZSA-N	0	3	330.428	3.274	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(Cl)cc1Cl)C(=O)[C@@H]1CCCCO1	ZINC000121989122	1293398453	/nfs/dbraw/zinc/39/84/53/1293398453.db2.gz	UGLQUERERDFKRE-MFKMUULPSA-N	0	3	341.194	3.210	20	30		EGEDHN
Cc1ccc(SCCC(=O)C(C#N)C(=O)N2CCCC2)cc1C	ZINC000124734645	1293483411	/nfs/dbraw/zinc/48/34/11/1293483411.db2.gz	ZLFXYQAFVKCDBE-INIZCTEOSA-N	0	3	330.453	3.117	20	30		EGEDHN
N#CC(C(=O)CCc1ccc(Cl)cc1)C(=O)Nc1ccccn1	ZINC000125052579	1293493920	/nfs/dbraw/zinc/49/39/20/1293493920.db2.gz	WWKWIBXXCBTVAL-CQSZACIVSA-N	0	3	327.771	3.015	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)[C@@H](C)Oc2cccc(F)c2)c1	ZINC000127751298	1293572234	/nfs/dbraw/zinc/57/22/34/1293572234.db2.gz	JNZGNUXHIGEUFA-DYVFJYSZSA-N	0	3	340.354	3.249	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)c1cc(F)cc(F)c1	ZINC000128933721	1293608504	/nfs/dbraw/zinc/60/85/04/1293608504.db2.gz	ZRSVQVZUWVZOIC-CQSZACIVSA-N	0	3	344.317	3.325	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)CCc1ccc(-c2ccccc2F)o1	ZINC000130735230	1293667126	/nfs/dbraw/zinc/66/71/26/1293667126.db2.gz	WBTGZGATRNAFQR-OAHLLOKOSA-N	0	3	342.370	3.252	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)CCCc2ccccc2)cc1	ZINC000131784576	1293700588	/nfs/dbraw/zinc/70/05/88/1293700588.db2.gz	IRPXFZRDCSVGLV-SFHVURJKSA-N	0	3	336.391	3.365	20	30		EGEDHN
C#CCCCCNCc1c(Br)cc(OC)cc1OC	ZINC000133661075	1293750451	/nfs/dbraw/zinc/75/04/51/1293750451.db2.gz	OLZKPOAJGNQCHZ-UHFFFAOYSA-N	0	3	326.234	3.359	20	30		EGEDHN
CCc1nccn1CC(=O)C(C#N)c1nc(-c2ccccc2)cs1	ZINC000158386353	1294204549	/nfs/dbraw/zinc/20/45/49/1294204549.db2.gz	FHNISQALWXIQHH-AWEZNQCLSA-N	0	3	336.420	3.445	20	30		EGEDHN
Cc1oc(-c2ccco2)nc1CC(=O)C(C#N)C(=O)Nc1ccccc1	ZINC000159764727	1294246310	/nfs/dbraw/zinc/24/63/10/1294246310.db2.gz	PDNVSWHGURZEKZ-CQSZACIVSA-N	0	3	349.346	3.133	20	30		EGEDHN
CCN(CCCCCCN1C(=O)c2ccccc2C1=O)C[C@H](C)C#N	ZINC000181194930	1294947696	/nfs/dbraw/zinc/94/76/96/1294947696.db2.gz	VDAAKXRBBRVZGA-MRXNPFEDSA-N	0	3	341.455	3.325	20	30		EGEDHN
CC(C)CN(C(=O)/C=C/c1ccccc1C#N)C1CCN(C)CC1	ZINC000193435023	1295869119	/nfs/dbraw/zinc/86/91/19/1295869119.db2.gz	SDVZTXFUKSHFJD-CMDGGOBGSA-N	0	3	325.456	3.150	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)COCC2CC2)cc1	ZINC000193451993	1295870117	/nfs/dbraw/zinc/87/01/17/1295870117.db2.gz	KNWYFWIEAJTRRQ-QGZVFWFLSA-N	0	3	328.412	3.103	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)C[C@H]2CCCO2)cc1	ZINC000193451782	1295870816	/nfs/dbraw/zinc/87/08/16/1295870816.db2.gz	AYBGQSLYQGATBO-SJORKVTESA-N	0	3	328.412	3.246	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)[C@H]1C[C@H]1c1ccc(Cl)cc1Cl	ZINC000245904551	1296328963	/nfs/dbraw/zinc/32/89/63/1296328963.db2.gz	HECABHIFSKPFOL-RWMBFGLXSA-N	0	3	339.222	3.330	20	30		EGEDHN
CCO[C@@H]1C[C@@H]1C(=O)C(C#N)C(=O)Nc1ccc([C@@H](C)CC)cc1	ZINC000249739238	1296451543	/nfs/dbraw/zinc/45/15/43/1296451543.db2.gz	XCYIDFPMOYQIIR-KKBVYLPWSA-N	0	3	328.412	3.272	20	30		EGEDHN
C[C@H](NCCC(C)(C)C#N)c1cc(F)ccc1N1CCC(O)CC1	ZINC000305769567	1297047271	/nfs/dbraw/zinc/04/72/71/1297047271.db2.gz	GRNUTTLWNPRGFU-AWEZNQCLSA-N	0	3	333.451	3.377	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@H](NC(=O)OC(C)(C)C)C1(C)C	ZINC000404746197	1297759023	/nfs/dbraw/zinc/75/90/23/1297759023.db2.gz	SQBDTCDHXFSBCO-MNOVXSKESA-N	0	3	333.270	3.176	20	30		EGEDHN
Cc1ccc2c(CCC(=O)C(C#N)C(=O)NC3CCCC3)c[nH]c2c1	ZINC000745947501	1298502707	/nfs/dbraw/zinc/50/27/07/1298502707.db2.gz	BGRDZJLGSDIIFI-KRWDZBQOSA-N	0	3	337.423	3.177	20	30		EGEDHN
Cc1ccc2c(CCC(=O)C(C#N)C(=O)Nc3ccccn3)c[nH]c2c1	ZINC000745949691	1298503781	/nfs/dbraw/zinc/50/37/81/1298503781.db2.gz	UCYMKNLAENOBML-MRXNPFEDSA-N	0	3	346.390	3.152	20	30		EGEDHN
C[C@@H]1CCN(C(=O)C#Cc2ccccc2)CCN1Cc1ccccc1	ZINC000747411290	1298776210	/nfs/dbraw/zinc/77/62/10/1298776210.db2.gz	BCZYIBNONBBPCD-LJQANCHMSA-N	0	3	332.447	3.161	20	30		EGEDHN
C=C(Cl)C[C@H](N)C(=O)Nc1cc(Cl)ccc1OCCOCC	ZINC000876644905	1298894435	/nfs/dbraw/zinc/89/44/35/1298894435.db2.gz	GDSJIZRBZXREIJ-LBPRGKRZSA-N	0	3	347.242	3.164	20	30		EGEDHN
CCCCCCNC(=O)[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC000748320494	1298984354	/nfs/dbraw/zinc/98/43/54/1298984354.db2.gz	WYVFXOCGBLGLQR-IBGZPJMESA-N	0	3	327.472	3.467	20	30		EGEDHN
C[C@]1(Cc2ccc(F)c(F)c2)CCCN1C(=O)[C@H](N)CCCCC#N	ZINC000877224733	1299214261	/nfs/dbraw/zinc/21/42/61/1299214261.db2.gz	NCZCRLGUKJVPRV-IEBWSBKVSA-N	0	3	349.425	3.300	20	30		EGEDHN
COC(=O)Cc1ccccc1CN(Cc1ccc(C#N)cc1)C1CC1	ZINC000751965275	1299667087	/nfs/dbraw/zinc/66/70/87/1299667087.db2.gz	KLTWRMRIDLWDQU-UHFFFAOYSA-N	0	3	334.419	3.438	20	30		EGEDHN
Cc1cc(C)c(O)c(CN2CCN(c3cccc(F)c3C#N)CC2)c1	ZINC000754726637	1300201783	/nfs/dbraw/zinc/20/17/83/1300201783.db2.gz	RTGFMTNWAQCXBD-UHFFFAOYSA-N	0	3	339.414	3.342	20	30		EGEDHN
C[C@@H]([NH2+][C@@H](C)C(=O)N(CCC#N)c1ccccc1)c1ccccc1[O-]	ZINC000879648356	1300647920	/nfs/dbraw/zinc/64/79/20/1300647920.db2.gz	LJMDKVYHJCYXEL-CVEARBPZSA-N	0	3	337.423	3.378	20	30		EGEDHN
CC[C@@]1(C)CCN(Cc2cc(=O)n3c4ccccc4[nH]c3c2C#N)C1	ZINC000758738128	1300948645	/nfs/dbraw/zinc/94/86/45/1300948645.db2.gz	ANTRGHRLOHTKBV-QRWLVFNGSA-N	0	3	334.423	3.346	20	30		EGEDHN
COC(=O)c1ccccc1CCC(=O)C(C#N)c1nc2ccccc2o1	ZINC000759237061	1301046619	/nfs/dbraw/zinc/04/66/19/1301046619.db2.gz	HADJFINJUKDKBS-OAHLLOKOSA-N	0	3	348.358	3.423	20	30		EGEDHN
C#CCCCC(=O)C(C#N)C(=O)Nc1cc(C)c(Cl)cc1OC	ZINC000759432219	1301091331	/nfs/dbraw/zinc/09/13/31/1301091331.db2.gz	TVJVQIFKUKOZRP-LBPRGKRZSA-N	0	3	332.787	3.108	20	30		EGEDHN
C[C@@H](c1ccc(C#N)cc1)N1CC[C@@H](N2CC(=O)Nc3ccccc32)C1	ZINC000759892056	1301185078	/nfs/dbraw/zinc/18/50/78/1301185078.db2.gz	FKHHDJVHCMIGFD-MAUKXSAKSA-N	0	3	346.434	3.152	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)CSCC(F)(F)F)nc21	ZINC000762063642	1301605143	/nfs/dbraw/zinc/60/51/43/1301605143.db2.gz	JMEQUHZJTFIZQP-VIFPVBQESA-N	0	3	327.331	3.343	20	30		EGEDHN
Cc1cccc2nc(C(C#N)C(=O)CSCC(F)(F)F)[nH]c21	ZINC000762063642	1301605156	/nfs/dbraw/zinc/60/51/56/1301605156.db2.gz	JMEQUHZJTFIZQP-VIFPVBQESA-N	0	3	327.331	3.343	20	30		EGEDHN
CCCCCCCC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1CO	ZINC000762111396	1301616282	/nfs/dbraw/zinc/61/62/82/1301616282.db2.gz	KFJLTHXRNABONI-UXHICEINSA-N	0	3	346.515	3.346	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)C(F)=C1CCCC1	ZINC000763003226	1301801568	/nfs/dbraw/zinc/80/15/68/1301801568.db2.gz	HIPIPFOASLFSRT-UHFFFAOYSA-N	0	3	329.419	3.246	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)[C@H]2C[C@@]23CCOC3)cc1	ZINC000764762187	1302129226	/nfs/dbraw/zinc/12/92/26/1302129226.db2.gz	RKOXFHCSYRDBDR-MBOZVWFJSA-N	0	3	340.423	3.103	20	30		EGEDHN
CCS(=O)(=O)Nc1ccc([C@H](C)NCc2ccc(C#N)cc2)cc1	ZINC000765015063	1302185378	/nfs/dbraw/zinc/18/53/78/1302185378.db2.gz	NTOUDCKLMGKFPN-AWEZNQCLSA-N	0	3	343.452	3.171	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)NC[C@H]1CCCCN1C1CC1	ZINC000765663691	1302300624	/nfs/dbraw/zinc/30/06/24/1302300624.db2.gz	PUJURGYWPZNHDX-MRXNPFEDSA-N	0	3	342.443	3.095	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCc2ccc(SCC)cc2)CC1	ZINC000883343740	1302400454	/nfs/dbraw/zinc/40/04/54/1302400454.db2.gz	XXCBGVKWDMUTTK-UHFFFAOYSA-N	0	3	333.501	3.248	20	30		EGEDHN
C[C@@H]1CCN(CC(=O)C(C#N)c2nc3ccccc3s2)C[C@H]1C	ZINC000766984823	1302558389	/nfs/dbraw/zinc/55/83/89/1302558389.db2.gz	MTZYHFVTYOSSKP-MGPQQGTHSA-N	0	3	327.453	3.450	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)[C@@H](F)c1ccccc1	ZINC000769285451	1303084717	/nfs/dbraw/zinc/08/47/17/1303084717.db2.gz	ZUUBGFAUJWBWLS-BBRMVZONSA-N	0	3	326.327	3.053	20	30		EGEDHN
C#CCCOc1ccc(CN(C)[C@H](C)CNC(=O)OC(C)(C)C)cc1	ZINC000769400940	1303107552	/nfs/dbraw/zinc/10/75/52/1303107552.db2.gz	ASSSBKWSENUXBG-MRXNPFEDSA-N	0	3	346.471	3.434	20	30		EGEDHN
C#CCOc1ccc([C@H](C)N[C@@H]2CCN(Cc3ccccc3)C2=O)cc1	ZINC000772950489	1303597656	/nfs/dbraw/zinc/59/76/56/1303597656.db2.gz	LPTJUDGNCHKWPX-LAUBAEHRSA-N	0	3	348.446	3.150	20	30		EGEDHN
C#CCOc1ccccc1CN[C@@H](C)CC(=O)Nc1ccc(F)cc1	ZINC000772989656	1303603095	/nfs/dbraw/zinc/60/30/95/1303603095.db2.gz	YKYBWDLGCAPTIL-HNNXBMFYSA-N	0	3	340.398	3.345	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](C)c2ccc(N(C)C)cc2)CC1	ZINC000773287545	1303655999	/nfs/dbraw/zinc/65/59/99/1303655999.db2.gz	UUQISFFZYAFIDN-INIZCTEOSA-N	0	3	344.503	3.153	20	30		EGEDHN
C[C@@H](N[C@@H](C)c1ccc(N(C)C)cc1)C(=O)NC1(C#N)CCCCC1	ZINC000774484678	1303816765	/nfs/dbraw/zinc/81/67/65/1303816765.db2.gz	PLONEHHHXBYHOE-JKSUJKDBSA-N	0	3	342.487	3.134	20	30		EGEDHN
CN(CC(=O)N1CCC(c2ccc(C#N)cc2)CC1)CC(C)(C)C	ZINC000887698971	1303897617	/nfs/dbraw/zinc/89/76/17/1303897617.db2.gz	HSOVJFFYAAIBKI-UHFFFAOYSA-N	0	3	327.472	3.242	20	30		EGEDHN
CCC[C@@H](NCC(=O)NCCC#N)c1cccc(C(F)(F)F)c1	ZINC000775322881	1303939114	/nfs/dbraw/zinc/93/91/14/1303939114.db2.gz	BFTFCAWIBISAFV-CQSZACIVSA-N	0	3	327.350	3.166	20	30		EGEDHN
C#CCCN1CCN(CCCOc2ccc(C(C)(C)C)cc2)CC1	ZINC000776595602	1304177674	/nfs/dbraw/zinc/17/76/74/1304177674.db2.gz	NSFXDHVYCAMAPQ-UHFFFAOYSA-N	0	3	328.500	3.394	20	30		EGEDHN
N#Cc1ccc(OCCCN2CC[C@](O)(c3ccc(F)cc3)C2)cc1	ZINC000777736695	1304342141	/nfs/dbraw/zinc/34/21/41/1304342141.db2.gz	GOVRTXFDLPHUSY-HXUWFJFHSA-N	0	3	340.398	3.060	20	30		EGEDHN
C#CCCOc1ccc(CNC2(C(=O)NCCC)CCCCC2)cc1	ZINC000779170038	1304538212	/nfs/dbraw/zinc/53/82/12/1304538212.db2.gz	YEWONWHDJXGLFG-UHFFFAOYSA-N	0	3	342.483	3.407	20	30		EGEDHN
C#CCCCCCC(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000779937441	1304624967	/nfs/dbraw/zinc/62/49/67/1304624967.db2.gz	ULAVVXSLDPQTJU-UHFFFAOYSA-N	0	3	325.456	3.032	20	30		EGEDHN
COc1ccc(C(C)=NN[C@H]2CCCOC2)cc1CN1CCCCC1	ZINC000780259094	1304667033	/nfs/dbraw/zinc/66/70/33/1304667033.db2.gz	ZASQEVNDGGSESA-IBGZPJMESA-N	0	3	345.487	3.174	20	30		EGEDHN
CC[C@@H]1C[C@@H](C(=O)C(C#N)C(=O)Nc2ccccc2Cl)CCO1	ZINC000780304694	1304674870	/nfs/dbraw/zinc/67/48/70/1304674870.db2.gz	ADXXHLJMUYSZBF-XQQFMLRXSA-N	0	3	334.803	3.193	20	30		EGEDHN
COc1cc(CN2CCC(CC#N)CC2)ccc1OC(=O)C1CC1	ZINC000781928331	1304892984	/nfs/dbraw/zinc/89/29/84/1304892984.db2.gz	YAKIHFZRXZVCAC-UHFFFAOYSA-N	0	3	328.412	3.136	20	30		EGEDHN
C#CCSc1ccc(COC(=O)C2CCN(C3CC3)CC2)cc1	ZINC000785096561	1305312554	/nfs/dbraw/zinc/31/25/54/1305312554.db2.gz	UGBXBYSDAWPVJC-UHFFFAOYSA-N	0	3	329.465	3.330	20	30		EGEDHN
Cc1nc(C)c(CC(=O)C(C#N)C(=O)Nc2ccccc2Cl)s1	ZINC000892490059	1305402460	/nfs/dbraw/zinc/40/24/60/1305402460.db2.gz	OWVQVLQIASLVDM-LLVKDONJSA-N	0	3	347.827	3.303	20	30		EGEDHN
Cc1cccc(CNC(=O)C(C#N)C(=O)CCCC(F)(F)F)c1	ZINC000786538202	1305592712	/nfs/dbraw/zinc/59/27/12/1305592712.db2.gz	DRFSWNGTXMDGTD-CYBMUJFWSA-N	0	3	326.318	3.053	20	30		EGEDHN
C[C@H](NC1(c2cccc(C#N)c2)CC1)c1ccc(N2CCNC2=O)cc1	ZINC000786888753	1305650897	/nfs/dbraw/zinc/65/08/97/1305650897.db2.gz	JVKIUHFKJWBVBH-HNNXBMFYSA-N	0	3	346.434	3.428	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@H]1CCCCC[C@H]1NCc1ccc(C#N)cn1	ZINC000788259242	1305909988	/nfs/dbraw/zinc/90/99/88/1305909988.db2.gz	MBPPUWIIPCGJKR-SJORKVTESA-N	0	3	344.459	3.269	20	30		EGEDHN
CN(Cc1ccc(F)c(C#N)c1)[C@H](CNC(=O)OC(C)(C)C)C1CC1	ZINC000790079057	1306258611	/nfs/dbraw/zinc/25/86/11/1306258611.db2.gz	IKKLODCCVVAYPG-QGZVFWFLSA-N	0	3	347.434	3.432	20	30		EGEDHN
N#CCc1ccc(CN2CCC(Oc3ccc(F)nc3)CC2)cc1	ZINC000792387135	1309168983	/nfs/dbraw/zinc/16/89/83/1309168983.db2.gz	XUQODPHHQGXNQB-UHFFFAOYSA-N	0	3	325.387	3.330	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN2CCN(C)[C@@H](Cc3ccccc3)C2)cc1	ZINC000793621042	1309418778	/nfs/dbraw/zinc/41/87/78/1309418778.db2.gz	WYLTUEKVAOOPQP-NQIIRXRSSA-N	0	3	349.478	3.336	20	30		EGEDHN
CC(C)(C)OC(=O)NCC[C@H]1CCN(Cc2cc(C#N)cs2)C1	ZINC000896985108	1310119313	/nfs/dbraw/zinc/11/93/13/1310119313.db2.gz	QXWOBAJCRDYLLL-ZDUSSCGKSA-N	0	3	335.473	3.356	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000798817316	1310445728	/nfs/dbraw/zinc/44/57/28/1310445728.db2.gz	WUEMBZBUAPXYOL-MFKMUULPSA-N	0	3	326.318	3.042	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)[C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000798817315	1310446255	/nfs/dbraw/zinc/44/62/55/1310446255.db2.gz	WUEMBZBUAPXYOL-GXFFZTMASA-N	0	3	326.318	3.042	20	30		EGEDHN
C[C@@H](C(=O)C(C#N)c1ncc(C(C)(C)C)s1)N(C)CC(F)(F)F	ZINC000798865000	1310451821	/nfs/dbraw/zinc/45/18/21/1310451821.db2.gz	QAESETOVXHSRFO-UWVGGRQHSA-N	0	3	347.406	3.499	20	30		EGEDHN
C=CCN1CC[C@@H](N2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)C1=O	ZINC000799164512	1310497058	/nfs/dbraw/zinc/49/70/58/1310497058.db2.gz	KSRMSOYSXZRIET-GDBMZVCRSA-N	0	3	338.373	3.282	20	30		EGEDHN
Cc1ccc(C(=O)N2CCN(C3CCC(C)CC3)CC2)cc1C#N	ZINC000799337018	1310527467	/nfs/dbraw/zinc/52/74/67/1310527467.db2.gz	SMXPFUCIMLBAFW-UHFFFAOYSA-N	0	3	325.456	3.203	20	30		EGEDHN
C[C@@H]1C[C@H](C)[C@@H](C(=O)C(C#N)C(=O)Nc2cccc3ccccc32)O1	ZINC000800384923	1310747081	/nfs/dbraw/zinc/74/70/81/1310747081.db2.gz	NGEPXWXBVUPQQG-CFNLKKDLSA-N	0	3	336.391	3.301	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc3ccccc3n2CC)C1	ZINC001023759808	1319906781	/nfs/dbraw/zinc/90/67/81/1319906781.db2.gz	KHCVGHTWEMNIHN-QGZVFWFLSA-N	0	3	337.467	3.126	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N[C@@H](CC)c1ccc(Cl)s1	ZINC000836488952	1320493909	/nfs/dbraw/zinc/49/39/09/1320493909.db2.gz	SBZPPUGVKQHCRF-LBPRGKRZSA-N	0	3	327.881	3.107	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N(CCCC)[C@@H](C)c1ccc(C)o1	ZINC000836488886	1320494258	/nfs/dbraw/zinc/49/42/58/1320494258.db2.gz	SYTQWTHSLIGFBX-KRWDZBQOSA-N	0	3	333.476	3.416	20	30		EGEDHN
COc1ccc(CNC(=O)C(C#N)C(=O)CCCCC(C)C)cc1	ZINC000838785613	1320816474	/nfs/dbraw/zinc/81/64/74/1320816474.db2.gz	AYJIWOPOTDIQOX-QGZVFWFLSA-N	0	3	330.428	3.237	20	30		EGEDHN
C#C[C@@H](NCCC(=O)Nc1ccccc1-c1ccccc1)[C@@H]1CCCO1	ZINC000839563273	1320938359	/nfs/dbraw/zinc/93/83/59/1320938359.db2.gz	GQLIQZMEHUUJCU-CTNGQTDRSA-N	0	3	348.446	3.453	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CC[C@H](N[C@@H](C)c3ccccc3F)C2)cc1	ZINC001019224719	1317112166	/nfs/dbraw/zinc/11/21/66/1317112166.db2.gz	FBGGHEZSURWMBX-YJBOKZPZSA-N	0	3	336.410	3.372	20	30		EGEDHN
CC1(C)CC(CC(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)C1	ZINC001019278776	1317142590	/nfs/dbraw/zinc/14/25/90/1317142590.db2.gz	UORHEIKMNSCSKS-AWEZNQCLSA-N	0	3	331.485	3.137	20	30		EGEDHN
Cc1ccc([C@@H](C)C(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)o1	ZINC001019480834	1317271035	/nfs/dbraw/zinc/27/10/35/1317271035.db2.gz	HIXGUEBOXMVODJ-KGLIPLIRSA-N	0	3	343.452	3.015	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@H](NCc2ccc(F)c(C#N)c2)C1)C1CCCC1	ZINC001019632230	1317310298	/nfs/dbraw/zinc/31/02/98/1317310298.db2.gz	FNJNGYWOCDZVPH-KDOFPFPSSA-N	0	3	343.446	3.214	20	30		EGEDHN
CCCNC(=O)OC[C@@H]1CCCCN1Cc1ccc(CC#N)cc1	ZINC000805772164	1317421529	/nfs/dbraw/zinc/42/15/29/1317421529.db2.gz	CLAOSYQGXXIIPK-SFHVURJKSA-N	0	3	329.444	3.243	20	30		EGEDHN
Cc1cccc(C(=O)N[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)c1	ZINC001019963450	1317478835	/nfs/dbraw/zinc/47/88/35/1317478835.db2.gz	GFSNJAAXUQHEFN-IYARVYRRSA-N	0	3	337.398	3.056	20	30		EGEDHN
C#CCOc1ccc(C(=O)NC[C@H](N[C@H](C)CC)c2ccco2)cc1	ZINC000807680096	1317577588	/nfs/dbraw/zinc/57/75/88/1317577588.db2.gz	LRRZDYYIXNJDNL-QAPCUYQASA-N	0	3	340.423	3.151	20	30		EGEDHN
COc1ccc(C(C)=NN[C@H]2CCSC2)cc1CN1CCCC1	ZINC000808002139	1317610362	/nfs/dbraw/zinc/61/03/62/1317610362.db2.gz	VIMDCHKAPATSSH-KRWDZBQOSA-N	0	3	333.501	3.110	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC(CN(CC)Cc2ccnn2C)CC1	ZINC000957749273	1317614294	/nfs/dbraw/zinc/61/42/94/1317614294.db2.gz	BJBBLRXMUNUZQN-HXUWFJFHSA-N	0	3	346.519	3.083	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@H](NC(=O)C[C@H]3C=CCCC3)C2)c1	ZINC001020284016	1317624570	/nfs/dbraw/zinc/62/45/70/1317624570.db2.gz	QSDIGSWXGLNMRW-WBAXXEDZSA-N	0	3	341.430	3.181	20	30		EGEDHN
N#CC[C@@H](O)CN1CCC(OCc2ccc(Cl)c(Cl)c2)CC1	ZINC000929834269	1328714637	/nfs/dbraw/zinc/71/46/37/1328714637.db2.gz	IJBPASUMCDGBKE-CYBMUJFWSA-N	0	3	343.254	3.249	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2c(C)occ2C(F)(F)F)C1	ZINC001020400378	1317679827	/nfs/dbraw/zinc/67/98/27/1317679827.db2.gz	QANXPKAJPGZUKS-MGCOHNPYSA-N	0	3	336.741	3.210	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C2CCC3(CC3)CC2)C1	ZINC001020400136	1317680396	/nfs/dbraw/zinc/68/03/96/1317680396.db2.gz	DDAPNIZZIOKZLA-HDJSIYSDSA-N	0	3	341.293	3.102	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)c2cncc(C(F)(F)F)c2)c1	ZINC000808979706	1317756128	/nfs/dbraw/zinc/75/61/28/1317756128.db2.gz	LCFAJHPVOVLQHE-AWEZNQCLSA-N	0	3	347.296	3.370	20	30		EGEDHN
CCCCOc1ccc(/C=C2/C(=O)c3ncnn3C2C)cc1OC	ZINC000905080915	1317921039	/nfs/dbraw/zinc/92/10/39/1317921039.db2.gz	OFOBKHVPMDSBJC-IGVUGNCQSA-N	0	3	327.384	3.307	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)Cc1ccc(Cl)c(F)c1	ZINC000810528583	1318018128	/nfs/dbraw/zinc/01/81/28/1318018128.db2.gz	VGKDUUGMCRFDMR-CYBMUJFWSA-N	0	3	338.810	3.427	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)c2cc(C)ccc2C)C1	ZINC001020976920	1318027107	/nfs/dbraw/zinc/02/71/07/1318027107.db2.gz	AHCBQTLVLRGHLM-HDJSIYSDSA-N	0	3	337.261	3.062	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2sc(CCC)nc2C)C1	ZINC001021051807	1318059750	/nfs/dbraw/zinc/05/97/50/1318059750.db2.gz	PVSNJVYKFBYIHN-HAQNSBGRSA-N	0	3	327.881	3.007	20	30		EGEDHN
C=CCN1CCC(NC(=O)Cc2coc3c2ccc(F)c3F)CC1	ZINC000906593911	1318122368	/nfs/dbraw/zinc/12/23/68/1318122368.db2.gz	VZQBDSXUHQTJME-UHFFFAOYSA-N	0	3	334.366	3.020	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/Cc2ncccc2N(C)C)c([O-])c1	ZINC000811625505	1318214892	/nfs/dbraw/zinc/21/48/92/1318214892.db2.gz	OMXIUSDLNQJZGR-DEDYPNTBSA-N	0	3	326.444	3.319	20	30		EGEDHN
C=C1CC(C)(C(=O)NC2C[C@H]3CC[C@@H](C2)N3Cc2conc2CC)C1	ZINC001021373383	1318218554	/nfs/dbraw/zinc/21/85/54/1318218554.db2.gz	KQGWAXWLKIPROK-ALOPSCKCSA-N	0	3	343.471	3.205	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)CC2CCC2)cc1F	ZINC000959934356	1318272876	/nfs/dbraw/zinc/27/28/76/1318272876.db2.gz	ADRKJHCUVWYWNA-SFHVURJKSA-N	0	3	343.446	3.358	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)cc1F	ZINC000959961030	1318291168	/nfs/dbraw/zinc/29/11/68/1318291168.db2.gz	IKFASMJMCQJFKT-DLBZAZTESA-N	0	3	343.446	3.214	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@@H](CCCN3C(=O)C3CCC3)C2)cc1	ZINC001021494048	1318295030	/nfs/dbraw/zinc/29/50/30/1318295030.db2.gz	YGMZTJQMVDJYKU-PMACEKPBSA-N	0	3	337.467	3.171	20	30		EGEDHN
CCCC(=O)N1CCC[C@@H]2CN(Cc3cccc(C#N)c3)CC[C@@H]21	ZINC001021495340	1318298921	/nfs/dbraw/zinc/29/89/21/1318298921.db2.gz	CGHHBJIEOFBJFV-MOPGFXCFSA-N	0	3	325.456	3.171	20	30		EGEDHN
C#C[C@H](C)N(C)C(=O)NC[C@@H](c1ccc(CC(C)C)cc1)N(C)C	ZINC000812390263	1318380955	/nfs/dbraw/zinc/38/09/55/1318380955.db2.gz	ZFUXCZKTRCSCFA-LPHOPBHVSA-N	0	3	329.488	3.151	20	30		EGEDHN
COc1cccc([C@@H](C/N=C/c2c(O)cccc2OC)N(C)C)c1	ZINC000812396612	1318381884	/nfs/dbraw/zinc/38/18/84/1318381884.db2.gz	WYWKUWAXNBSPHW-XNHPLOEXSA-N	0	3	328.412	3.131	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@H]2CN(Cc3ccc(F)cc3)CC[C@@H]21	ZINC001021582706	1318428056	/nfs/dbraw/zinc/42/80/56/1318428056.db2.gz	YRNYVZJOHZZVFV-ICSRJNTNSA-N	0	3	340.442	3.052	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2sccc2Cl)C1	ZINC001021589704	1318434936	/nfs/dbraw/zinc/43/49/36/1318434936.db2.gz	BJDKGVLMXKJFIB-UKRRQHHQSA-N	0	3	336.888	3.351	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc3c(o2)CCCC3)C1	ZINC001021603487	1318447698	/nfs/dbraw/zinc/44/76/98/1318447698.db2.gz	PTKUXCUNILVWET-ZWKOTPCHSA-N	0	3	340.467	3.108	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ncsc1C(C)C	ZINC000960323497	1318460967	/nfs/dbraw/zinc/46/09/67/1318460967.db2.gz	GYFRTJDOGNJLBZ-HZPDHXFCSA-N	0	3	341.480	3.438	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)Cc2ccc(C)cc2Cl)C1	ZINC001021617647	1318467236	/nfs/dbraw/zinc/46/72/36/1318467236.db2.gz	WXOJPBGXPWCWHR-MJGOQNOKSA-N	0	3	344.886	3.137	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)CCc2ccc(F)cc2)C1	ZINC001021621501	1318470979	/nfs/dbraw/zinc/47/09/79/1318470979.db2.gz	BNLPONLBCGGSHF-ICSRJNTNSA-N	0	3	342.458	3.095	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2cccc(C(C)C)c2)C1	ZINC001021623700	1318473447	/nfs/dbraw/zinc/47/34/47/1318473447.db2.gz	KXSAMDSORUBSND-LEWJYISDSA-N	0	3	338.495	3.299	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cccc(-n3cccc3)c2)C1	ZINC001021627070	1318478444	/nfs/dbraw/zinc/47/84/44/1318478444.db2.gz	LBPBQUSMIVNPEI-CTNGQTDRSA-N	0	3	347.462	3.037	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(F)c(C)c2)C1	ZINC001021655383	1318516163	/nfs/dbraw/zinc/51/61/63/1318516163.db2.gz	OHNRUCBLFRQIMV-IEBWSBKVSA-N	0	3	328.431	3.084	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)C[C@@H]1C=CCC1	ZINC000960397814	1318525818	/nfs/dbraw/zinc/52/58/18/1318525818.db2.gz	HPKLKQZMGOIQOX-YLJYHZDGSA-N	0	3	337.467	3.337	20	30		EGEDHN
Cc1ccoc1C(=O)N1CCC[C@H]1CN(C)Cc1cccc(C#N)c1	ZINC000960420063	1318544854	/nfs/dbraw/zinc/54/48/54/1318544854.db2.gz	XSNFYXDZDXDSPZ-SFHVURJKSA-N	0	3	337.423	3.196	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)[C@H]1CC=CCC1	ZINC000960421289	1318545158	/nfs/dbraw/zinc/54/51/58/1318545158.db2.gz	VHYGJLYXTYXRTM-PMACEKPBSA-N	0	3	337.467	3.337	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(Cl)cs2)C1	ZINC001021677526	1318545763	/nfs/dbraw/zinc/54/57/63/1318545763.db2.gz	QPKFBGFTXBDDGJ-ZFWWWQNUSA-N	0	3	336.888	3.351	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cccc(F)c2Cl)C1	ZINC001021678228	1318547970	/nfs/dbraw/zinc/54/79/70/1318547970.db2.gz	WRYMPDZEQPVTCJ-CJNGLKHVSA-N	0	3	334.822	3.039	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc3cc[nH]c3c2)C1	ZINC001021679877	1318550979	/nfs/dbraw/zinc/55/09/79/1318550979.db2.gz	UAPUYPUQHOFWJD-ICSRJNTNSA-N	0	3	335.451	3.118	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2csc(C(C)(C)C)n2)C1	ZINC001021689742	1318564693	/nfs/dbraw/zinc/56/46/93/1318564693.db2.gz	ZRWFLEFIZJTYHC-GDBMZVCRSA-N	0	3	345.512	3.000	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cccc3c2ccn3C)C1	ZINC001021693031	1318565968	/nfs/dbraw/zinc/56/59/68/1318565968.db2.gz	XIFANMYAUQIIAJ-FXAWDEMLSA-N	0	3	349.478	3.128	20	30		EGEDHN
C/C(=C\C(=O)N1CCC[C@H]1CN(C)Cc1ccc(C#N)cc1)C1CC1	ZINC000960465416	1318582691	/nfs/dbraw/zinc/58/26/91/1318582691.db2.gz	LXKHOWDKDAKIMW-GRFAERAESA-N	0	3	337.467	3.337	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)CCc2c[nH]c3ccccc23)C1	ZINC001021723316	1318612650	/nfs/dbraw/zinc/61/26/50/1318612650.db2.gz	DNCYNAVYQSHDIY-WIYYLYMNSA-N	0	3	349.478	3.047	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)[C@H]1[C@@H]2CCC[C@@H]21	ZINC000960529161	1318646925	/nfs/dbraw/zinc/64/69/25/1318646925.db2.gz	MWKAULZFUVRBCK-ZRNYENFQSA-N	0	3	337.467	3.027	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CCC[C@H]1CN(C)Cc1cccc(C#N)c1	ZINC000960563354	1318694321	/nfs/dbraw/zinc/69/43/21/1318694321.db2.gz	OHFXNKAHXOMXOJ-KRWDZBQOSA-N	0	3	329.419	3.244	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)C1CC(C)(C)C1	ZINC000960608689	1318733207	/nfs/dbraw/zinc/73/32/07/1318733207.db2.gz	PUBQPCPQXYNQOX-IBGZPJMESA-N	0	3	339.483	3.417	20	30		EGEDHN
C[C@@H](c1cccc(F)c1)N(C)C[C@H]1CCCN1C(=O)C#CC1CC1	ZINC000960624897	1318750671	/nfs/dbraw/zinc/75/06/71/1318750671.db2.gz	ROIJZMMXNGUWPB-HNAYVOBHSA-N	0	3	328.431	3.223	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N(C)Cc1ccc(N2CCCCC2)cc1	ZINC000911632634	1318754098	/nfs/dbraw/zinc/75/40/98/1318754098.db2.gz	IFGULROVXBCWFD-IBGZPJMESA-N	0	3	329.488	3.319	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)C1C=CC=CC=C1	ZINC000960663294	1318780912	/nfs/dbraw/zinc/78/09/12/1318780912.db2.gz	MPCHOYHEOHPEOS-OAQYLSRUSA-N	0	3	347.462	3.279	20	30		EGEDHN
Cc1csc(C(=O)N[C@H]2C[C@@H](NCc3ccc(C#N)cc3F)C2)c1	ZINC001022050001	1318781024	/nfs/dbraw/zinc/78/10/24/1318781024.db2.gz	ISJJZLUKUBMQBX-GASCZTMLSA-N	0	3	343.427	3.118	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H]1CN(C)Cc1cccc(C#N)c1)C1CCC1	ZINC000960701549	1318803253	/nfs/dbraw/zinc/80/32/53/1318803253.db2.gz	LTDHYWHXCODENN-JXFKEZNVSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)c2csc(C)c2C)C1	ZINC001022134919	1318814512	/nfs/dbraw/zinc/81/45/12/1318814512.db2.gz	SGWOUXKETDYIJE-TXEJJXNPSA-N	0	3	343.290	3.124	20	30		EGEDHN
Cc1coc(C(=O)N2CCC[C@@H]2CN(C)Cc2cccc(C#N)c2)c1	ZINC000960808548	1318923187	/nfs/dbraw/zinc/92/31/87/1318923187.db2.gz	LFDKDBCUEIFIRJ-GOSISDBHSA-N	0	3	337.423	3.196	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)[C@H]1C[C@H]2C[C@H]2C1	ZINC000960810319	1318927166	/nfs/dbraw/zinc/92/71/66/1318927166.db2.gz	RIZJIRGAYUSETI-NMLBUPMWSA-N	0	3	337.467	3.027	20	30		EGEDHN
CC(C)C1(C(=O)N2CCC[C@H]2CN(C)Cc2ccc(C#N)cc2)CC1	ZINC000960845861	1318982896	/nfs/dbraw/zinc/98/28/96/1318982896.db2.gz	HJDPKSFQURAXMW-IBGZPJMESA-N	0	3	339.483	3.417	20	30		EGEDHN
C[C@@H]1[C@H](OC(=O)c2cccc(C#N)n2)CCCN1Cc1ccccc1	ZINC000816468529	1319161248	/nfs/dbraw/zinc/16/12/48/1319161248.db2.gz	ITERPRQEJPFPIM-DNVCBOLYSA-N	0	3	335.407	3.163	20	30		EGEDHN
C[C@@H](CC(=O)N1CCC[C@@H]1CN(C)Cc1cccc(C#N)c1)C1CC1	ZINC000961038247	1319162389	/nfs/dbraw/zinc/16/23/89/1319162389.db2.gz	QRWUIVPXKFHDBV-OXJNMPFZSA-N	0	3	339.483	3.417	20	30		EGEDHN
CCC(=O)N1CCC[C@H]([C@@H]2CCN(Cc3ccc(F)c(C#N)c3)C2)C1	ZINC000961080829	1319194605	/nfs/dbraw/zinc/19/46/05/1319194605.db2.gz	SIPRCGLVHIQZLO-DLBZAZTESA-N	0	3	343.446	3.168	20	30		EGEDHN
C=CCC[N@H+]1CC[C@H]([C@H]2CCCN(C(=O)c3ccccc3[O-])C2)C1	ZINC000961092950	1319203150	/nfs/dbraw/zinc/20/31/50/1319203150.db2.gz	MHRCBKVQFKISGC-IRXDYDNUSA-N	0	3	328.456	3.142	20	30		EGEDHN
C=CCC[N@@H+]1CC[C@H]([C@H]2CCCN(C(=O)c3ccccc3[O-])C2)C1	ZINC000961092950	1319203156	/nfs/dbraw/zinc/20/31/56/1319203156.db2.gz	MHRCBKVQFKISGC-IRXDYDNUSA-N	0	3	328.456	3.142	20	30		EGEDHN
CCCC(=O)N1CCC[C@@H]([C@H]2CCN(Cc3ccccc3C#N)C2)C1	ZINC000961100703	1319210718	/nfs/dbraw/zinc/21/07/18/1319210718.db2.gz	RAEGVIUYIMMFLD-UXHICEINSA-N	0	3	339.483	3.419	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)N1CCC[C@H](C#N)C1)c1ccsc1	ZINC000914066254	1319223679	/nfs/dbraw/zinc/22/36/79/1319223679.db2.gz	RLQXLMHSFOAXQQ-GDBMZVCRSA-N	0	3	334.489	3.076	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)Cc2coc3cc(C)ccc23)C1	ZINC001023060567	1319245794	/nfs/dbraw/zinc/24/57/94/1319245794.db2.gz	CMIMRCURBCLLOP-GASCZTMLSA-N	0	3	332.831	3.273	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cccc(OCC(C)C)c2)C1	ZINC001023068544	1319251059	/nfs/dbraw/zinc/25/10/59/1319251059.db2.gz	CVXICPJVYULDLG-IYBDPMFKSA-N	0	3	336.863	3.324	20	30		EGEDHN
C[C@H](C#N)OCCN1CCC[C@H]1Cc1ccccc1Br	ZINC000817276514	1319309683	/nfs/dbraw/zinc/30/96/83/1319309683.db2.gz	HDCBKHWTFZYROM-HIFRSBDPSA-N	0	3	337.261	3.385	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]([C@H]2CCN(Cc3conc3C)C2)C1	ZINC000961223254	1319350201	/nfs/dbraw/zinc/35/02/01/1319350201.db2.gz	AJLJNSGYPNJHQM-IRXDYDNUSA-N	0	3	345.487	3.256	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]\C[C@@H](O)COc2ccccc2)c([O-])c1	ZINC000915113159	1319424216	/nfs/dbraw/zinc/42/42/16/1319424216.db2.gz	PIPKMHIPWIPDKH-LZAZYHHXSA-N	0	3	342.439	3.097	20	30		EGEDHN
N#Cc1cc(C(=O)NC[C@H]2CCCN(C/C=C/c3ccccc3)C2)c[nH]1	ZINC001023314399	1319439037	/nfs/dbraw/zinc/43/90/37/1319439037.db2.gz	LKFPAAFFRAKTQU-SBLNNXNXSA-N	0	3	348.450	3.042	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](C2CCN(C(=O)[C@@H](CC)OC)CC2)C1	ZINC000961342933	1319498339	/nfs/dbraw/zinc/49/83/39/1319498339.db2.gz	RVWXGYMEWOYBEF-DLBZAZTESA-N	0	3	342.911	3.115	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H](CNC(=O)C3C=CC=CC=C3)C2)cc1	ZINC001023395735	1319503397	/nfs/dbraw/zinc/50/33/97/1319503397.db2.gz	MASAFZZOICJACT-FQEVSTJZSA-N	0	3	347.462	3.185	20	30		EGEDHN
Cc1cc(O)c(CN2CCN(Cc3ccc(C#N)cc3)CC2)cc1C	ZINC000915835597	1319545070	/nfs/dbraw/zinc/54/50/70/1319545070.db2.gz	RNXFXAKVTKDQDB-UHFFFAOYSA-N	0	3	335.451	3.199	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NC[C@@H]1CCCN(C[C@@H](F)CC)C1	ZINC001023448001	1319550347	/nfs/dbraw/zinc/55/03/47/1319550347.db2.gz	BYTYJBGQYIKSAS-IRXDYDNUSA-N	0	3	348.462	3.441	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2coc3cc(F)ccc23)C1	ZINC001023454472	1319559238	/nfs/dbraw/zinc/55/92/38/1319559238.db2.gz	WWENXBPVMSWTFM-AWEZNQCLSA-N	0	3	328.387	3.037	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Cc1coc2ccc3ccccc3c12	ZINC000818599429	1319566814	/nfs/dbraw/zinc/56/68/14/1319566814.db2.gz	QKZBGMQQTRQYOV-UHFFFAOYSA-N	0	3	334.419	3.200	20	30		EGEDHN
C#CCN(C)CCCNC(=O)[C@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1	ZINC000818615346	1319569208	/nfs/dbraw/zinc/56/92/08/1319569208.db2.gz	JQWWZUKMSVZAQS-KGLIPLIRSA-N	0	3	339.266	3.168	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1ccccc1SCc1ccco1	ZINC000818609329	1319569631	/nfs/dbraw/zinc/56/96/31/1319569631.db2.gz	QUNJTPSTBMGGSO-UHFFFAOYSA-N	0	3	342.464	3.257	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1ccc(OCCCC)cc1Cl	ZINC000818615218	1319570185	/nfs/dbraw/zinc/57/01/85/1319570185.db2.gz	DFFQMWADFGCTMP-UHFFFAOYSA-N	0	3	336.863	3.204	20	30		EGEDHN
CC(=NNCCN1CCCCC1)c1[nH]c(-c2ccccc2)nc1C	ZINC000915973243	1319576985	/nfs/dbraw/zinc/57/69/85/1319576985.db2.gz	DMUUBLOWQXWMNH-UHFFFAOYSA-N	0	3	325.460	3.185	20	30		EGEDHN
CC1=CC(=NNC(=S)NC2CCN(Cc3ccccc3)CC2)CC1	ZINC000916307202	1319637147	/nfs/dbraw/zinc/63/71/47/1319637147.db2.gz	WLPXLLNRBQTERR-UHFFFAOYSA-N	0	3	342.512	3.211	20	30		EGEDHN
C=CCN1CCC[C@@H](CNC(=O)c2csc(-c3ccco3)n2)C1	ZINC001023561472	1319672380	/nfs/dbraw/zinc/67/23/80/1319672380.db2.gz	BCTDGDJIKVBASF-ZDUSSCGKSA-N	0	3	331.441	3.031	20	30		EGEDHN
C=CCN1CCC[C@H](CNC(=O)c2csc(-c3ccco3)n2)C1	ZINC001023561471	1319674001	/nfs/dbraw/zinc/67/40/01/1319674001.db2.gz	BCTDGDJIKVBASF-CYBMUJFWSA-N	0	3	331.441	3.031	20	30		EGEDHN
Cc1ccc(-c2csc(C(C#N)C(=O)c3cc[n+]([O-])cc3)n2)cc1	ZINC000916628280	1319688385	/nfs/dbraw/zinc/68/83/85/1319688385.db2.gz	PDEJPFKPKDENPJ-HNNXBMFYSA-N	0	3	335.388	3.242	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc(C(F)F)c(F)c2)C1	ZINC001023589027	1319710429	/nfs/dbraw/zinc/71/04/29/1319710429.db2.gz	QNVJBGIGKPPECK-ZDUSSCGKSA-N	0	3	338.373	3.228	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)COc1cccc(Cl)c1	ZINC000916876348	1319718389	/nfs/dbraw/zinc/71/83/89/1319718389.db2.gz	ZTTHLPHHYIAKAB-HNNXBMFYSA-N	0	3	336.819	3.124	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)COc1ccccc1C(C)(C)C	ZINC000916877532	1319718968	/nfs/dbraw/zinc/71/89/68/1319718968.db2.gz	UAYTYOUNLCKJOC-OAHLLOKOSA-N	0	3	344.455	3.378	20	30		EGEDHN
CC1(C)CC(C(=O)NC2CC(CNCc3cc(C#N)ccc3F)C2)C1	ZINC000961796464	1319736140	/nfs/dbraw/zinc/73/61/40/1319736140.db2.gz	YZLSOBUNMDDJTI-UHFFFAOYSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NC[C@@H]1CCCN(Cc2ccsc2)C1	ZINC001023643215	1319764107	/nfs/dbraw/zinc/76/41/07/1319764107.db2.gz	RRMCVYQZOPJEFT-SZMVWBNQSA-N	0	3	348.512	3.058	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc(C)c(F)cc2Cl)C1	ZINC001023724471	1319863377	/nfs/dbraw/zinc/86/33/77/1319863377.db2.gz	FNEFPXCTQSTMGB-CQSZACIVSA-N	0	3	336.838	3.253	20	30		EGEDHN
C#CCN1CCC[C@H](CNC(=O)c2cc3c(s2)CCCCC3)C1	ZINC001023736280	1319879697	/nfs/dbraw/zinc/87/96/97/1319879697.db2.gz	YXEKIINMMOWQRF-OAHLLOKOSA-N	0	3	330.497	3.092	20	30		EGEDHN
C=C1CC(C)(C(=O)NC2CC(CNCc3oc(C(C)C)nc3C)C2)C1	ZINC000962268008	1319892953	/nfs/dbraw/zinc/89/29/53/1319892953.db2.gz	WJMVPSACJWGCSU-UHFFFAOYSA-N	0	3	345.487	3.447	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)[C@@H]2CCCCc3ccccc32)C1	ZINC001023764339	1319911120	/nfs/dbraw/zinc/91/11/20/1319911120.db2.gz	BAVAHLBLYDFSPJ-GHTZIAJQSA-N	0	3	338.495	3.348	20	30		EGEDHN
C#C[C@H](NC(=O)N(CCN(C)C)Cc1cccs1)c1ccccc1	ZINC000820599515	1319918801	/nfs/dbraw/zinc/91/88/01/1319918801.db2.gz	NIVMTWDEDWHHBJ-SFHVURJKSA-N	0	3	341.480	3.196	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCN(C(=O)c2ccsc2)C1	ZINC001023831121	1319973938	/nfs/dbraw/zinc/97/39/38/1319973938.db2.gz	HJFJUYLIXMSRJT-OAHLLOKOSA-N	0	3	339.464	3.262	20	30		EGEDHN
C[C@@H](CCCCCN1C(=O)c2ccccc2C1=O)NCC1(C#N)CC1	ZINC000824326816	1320248324	/nfs/dbraw/zinc/24/83/24/1320248324.db2.gz	KMELQXIAEJWREO-HNNXBMFYSA-N	0	3	339.439	3.125	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)C#CC(C)(C)C)c1cccc(OC)c1	ZINC000837326945	1320597908	/nfs/dbraw/zinc/59/79/08/1320597908.db2.gz	UUPBOZQAPFMLHW-SFHVURJKSA-N	0	3	330.472	3.244	20	30		EGEDHN
C[C@@H]1C[C@H](OC(=O)c2cccc(C#N)n2)CN(Cc2ccccc2)C1	ZINC000839089305	1320866651	/nfs/dbraw/zinc/86/66/51/1320866651.db2.gz	CWDHAZDTBJDHBW-QAPCUYQASA-N	0	3	335.407	3.021	20	30		EGEDHN
Cc1ccc([C@H](C)N[C@H]2CCN(c3ccc(C#N)cc3)C2=O)s1	ZINC000839551607	1320936540	/nfs/dbraw/zinc/93/65/40/1320936540.db2.gz	DJGAWQVBISUBAZ-BBRMVZONSA-N	0	3	325.437	3.384	20	30		EGEDHN
CN(CCCN(C)C(=O)OC(C)(C)C)Cc1ccc(C#N)c(F)c1	ZINC000839658792	1320953099	/nfs/dbraw/zinc/95/30/99/1320953099.db2.gz	VLKOGTLQTUKFII-UHFFFAOYSA-N	0	3	335.423	3.386	20	30		EGEDHN
N#Cc1cccc([C@@H]2C[C@H]2C(=O)O[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000840607200	1321114513	/nfs/dbraw/zinc/11/45/13/1321114513.db2.gz	TWDQULBXOLTHNT-QHAWAJNXSA-N	0	3	346.430	3.479	20	30		EGEDHN
N#CC(C(=O)NC1CCCC1)C(=O)[C@@H]1CCSc2ccccc21	ZINC000842291246	1321367804	/nfs/dbraw/zinc/36/78/04/1321367804.db2.gz	GJWXROBSJCMGFO-CABCVRRESA-N	0	3	328.437	3.034	20	30		EGEDHN
CC[C@H](OC1CCCC1)C(=O)C(C#N)C(=O)Nc1cccc(OC)c1	ZINC000842288769	1321368162	/nfs/dbraw/zinc/36/81/62/1321368162.db2.gz	LLCLLNWRXMRBCI-IRXDYDNUSA-N	0	3	344.411	3.080	20	30		EGEDHN
C[C@H](NCc1cc(C#N)cs1)c1ccc(N2CCNC2=O)cc1	ZINC000842743370	1321426640	/nfs/dbraw/zinc/42/66/40/1321426640.db2.gz	GRXFHZUKCVVTOU-LBPRGKRZSA-N	0	3	326.425	3.000	20	30		EGEDHN
C[C@H](NC(=O)C1CCCCC1)C(=O)C(C#N)c1nc(C2CC2)cs1	ZINC000842941041	1321452093	/nfs/dbraw/zinc/45/20/93/1321452093.db2.gz	GXUIAIXLTDUQNN-SMDDNHRTSA-N	0	3	345.468	3.282	20	30		EGEDHN
N#CC(C(=O)CCCc1ccc(F)cc1)C(=O)NCc1ccccc1	ZINC000847623220	1321884623	/nfs/dbraw/zinc/88/46/23/1321884623.db2.gz	GLAPHCGUAUFWSF-GOSISDBHSA-N	0	3	338.382	3.174	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@@H]1CCCc2ccc(OC)cc21	ZINC000847622342	1321884860	/nfs/dbraw/zinc/88/48/60/1321884860.db2.gz	IIXWGSVSQCHIQO-SJLPKXTDSA-N	0	3	342.439	3.130	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)CCc1c(Cl)cccc1Cl	ZINC000847624268	1321885598	/nfs/dbraw/zinc/88/55/98/1321885598.db2.gz	NFWRMSCMCNJHEH-NSHDSACASA-N	0	3	327.211	3.159	20	30		EGEDHN
CCc1ccc(C(=O)NC2CC(CNCc3ccccc3C#N)C2)cc1	ZINC000962633849	1323035078	/nfs/dbraw/zinc/03/50/78/1323035078.db2.gz	YYTSVNAPSZRLFR-UHFFFAOYSA-N	0	3	347.462	3.419	20	30		EGEDHN
C#C[C@@](C)(CC)NCC(=O)N[C@@H](c1cccs1)c1ccc(F)cc1	ZINC000852097112	1323145882	/nfs/dbraw/zinc/14/58/82/1323145882.db2.gz	LSFBJFIOSJFVSJ-MOPGFXCFSA-N	0	3	344.455	3.484	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@@H](CNCc3cc(C)no3)C2)CC1	ZINC001024132749	1323156868	/nfs/dbraw/zinc/15/68/68/1323156868.db2.gz	DUJSXLYPUBTDOW-INIZCTEOSA-N	0	3	331.460	3.058	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@@H](CNCc3ccccc3C#N)C2)CC1	ZINC001024138179	1323162888	/nfs/dbraw/zinc/16/28/88/1323162888.db2.gz	BLAIMYKOCZMAIF-INIZCTEOSA-N	0	3	325.456	3.077	20	30		EGEDHN
CC(=O)N1CCC[C@H]([C@H]2CCCN2CC#Cc2cccc(Cl)c2)C1	ZINC000963209274	1323236330	/nfs/dbraw/zinc/23/63/30/1323236330.db2.gz	PMAKTKUUVCMQGB-AZUAARDMSA-N	0	3	344.886	3.414	20	30		EGEDHN
CCc1cccc(CC)c1NC(=O)C(C#N)C(=O)Cc1cscn1	ZINC000853098125	1323281127	/nfs/dbraw/zinc/28/11/27/1323281127.db2.gz	HJXJHXPHZNFUCY-HNNXBMFYSA-N	0	3	341.436	3.158	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)[C@@H]1[C@@H](c2ccccc2)C1(C)C	ZINC001024440038	1323401884	/nfs/dbraw/zinc/40/18/84/1323401884.db2.gz	JQOBZPSYWQGZSJ-ZCNNSNEGSA-N	0	3	338.495	3.420	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cn(C)c2ccccc12	ZINC001024537929	1323479534	/nfs/dbraw/zinc/47/95/34/1323479534.db2.gz	KKXLDCCJKQIZJW-INIZCTEOSA-N	0	3	325.456	3.339	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cc(C)nc2onc(C)c21	ZINC001024577649	1323512553	/nfs/dbraw/zinc/51/25/53/1323512553.db2.gz	FLPINFKAWMWIDZ-OAHLLOKOSA-N	0	3	342.443	3.000	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccc(N2CC=CC2)cc1	ZINC001024647625	1323574068	/nfs/dbraw/zinc/57/40/68/1323574068.db2.gz	QBYZQFZEVAMKKJ-FQEVSTJZSA-N	0	3	339.483	3.223	20	30		EGEDHN
C=CCCN1CCCC[C@H]1CNC(=O)c1c(C)noc1C(F)(F)F	ZINC001024683965	1323598304	/nfs/dbraw/zinc/59/83/04/1323598304.db2.gz	RSPNZRWTEZANKZ-LBPRGKRZSA-N	0	3	345.365	3.162	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccnc(OC2CCC2)c1	ZINC001024731744	1323631886	/nfs/dbraw/zinc/63/18/86/1323631886.db2.gz	KZTHQLHBIPAUJE-KRWDZBQOSA-N	0	3	343.471	3.173	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@H]1CCCc2sc(C)nc21	ZINC001024756726	1323656051	/nfs/dbraw/zinc/65/60/51/1323656051.db2.gz	UVJLOIOFNNJWQD-HOTGVXAUSA-N	0	3	347.528	3.418	20	30		EGEDHN
C=CCCN1CCCC[C@@H]1CNC(=O)c1ccc(P(C)(C)=O)cc1	ZINC001024808302	1323710605	/nfs/dbraw/zinc/71/06/05/1323710605.db2.gz	FNOXDKUSHHAGSR-QGZVFWFLSA-N	0	3	348.427	3.095	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1[nH]c2ccccc2c1OC	ZINC001024820348	1323726085	/nfs/dbraw/zinc/72/60/85/1323726085.db2.gz	YILGECIJKOOUSX-OAHLLOKOSA-N	0	3	341.455	3.337	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cc(NC(C)=O)ccc1C	ZINC001024828334	1323731484	/nfs/dbraw/zinc/73/14/84/1323731484.db2.gz	CENZTZFIPWJHNP-GOSISDBHSA-N	0	3	343.471	3.114	20	30		EGEDHN
C[C@H](C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)cc1F)C1CC1	ZINC001024915512	1323780384	/nfs/dbraw/zinc/78/03/84/1323780384.db2.gz	ZMGPPUFTBHQUNV-KBXCAEBGSA-N	0	3	343.446	3.214	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)C2(F)CCCC2)s1	ZINC001025006349	1323823870	/nfs/dbraw/zinc/82/38/70/1323823870.db2.gz	XQAYUVVNCUNYGO-CQSZACIVSA-N	0	3	349.475	3.373	20	30		EGEDHN
CCC1(C(=O)N2CCCC[C@H]2CNCc2ccc(C#N)cc2F)CC1	ZINC001025072506	1323874047	/nfs/dbraw/zinc/87/40/47/1323874047.db2.gz	XKJZBBXNLSKORQ-KRWDZBQOSA-N	0	3	343.446	3.358	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cccc(C)c1F	ZINC001025234264	1324021980	/nfs/dbraw/zinc/02/19/80/1324021980.db2.gz	GNNSMVPBGXOUOA-QZTJIDSGSA-N	0	3	328.431	3.226	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1scnc1CC	ZINC001025238485	1324029701	/nfs/dbraw/zinc/02/97/01/1324029701.db2.gz	RVSVDUQPRGNFON-HZPDHXFCSA-N	0	3	333.501	3.351	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccnc(CCC)c1	ZINC001025240084	1324033184	/nfs/dbraw/zinc/03/31/84/1324033184.db2.gz	LAMZPIKCRSMZMU-VQTJNVASSA-N	0	3	339.483	3.126	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)CCc1ccc(F)cc1	ZINC001025248362	1324049019	/nfs/dbraw/zinc/04/90/19/1324049019.db2.gz	YWKZDXCIHYGYFA-WOJBJXKFSA-N	0	3	342.458	3.237	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ncc(C)cc1C	ZINC001025252094	1324055618	/nfs/dbraw/zinc/05/56/18/1324055618.db2.gz	MHPREUIOFWSNCQ-OALUTQOASA-N	0	3	339.483	3.181	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(OCC)no1	ZINC001025252411	1324057416	/nfs/dbraw/zinc/05/74/16/1324057416.db2.gz	OMOYFTOZLKUZTK-HOTGVXAUSA-N	0	3	347.459	3.109	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc2ccccc2n1C	ZINC001025261897	1324073595	/nfs/dbraw/zinc/07/35/95/1324073595.db2.gz	ZAHHOYLNQJJZNK-PMACEKPBSA-N	0	3	349.478	3.271	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc2[nH]ccc2c1	ZINC001025263805	1324075435	/nfs/dbraw/zinc/07/54/35/1324075435.db2.gz	RNBSTHUNLHNOIZ-PMACEKPBSA-N	0	3	335.451	3.260	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc2cnccc2c1	ZINC001025286797	1324107243	/nfs/dbraw/zinc/10/72/43/1324107243.db2.gz	LETXSLGEJIWOBU-NHCUHLMSSA-N	0	3	347.462	3.327	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ncoc1C1CC1	ZINC001025288156	1324111698	/nfs/dbraw/zinc/11/16/98/1324111698.db2.gz	SLHZXJSHXUXZHE-CVEARBPZSA-N	0	3	329.444	3.197	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1coc(CCC)n1	ZINC001025289845	1324113198	/nfs/dbraw/zinc/11/31/98/1324113198.db2.gz	UCXRMYNZOTUBBZ-SJORKVTESA-N	0	3	331.460	3.272	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc(Cl)cn1	ZINC001025292388	1324117270	/nfs/dbraw/zinc/11/72/70/1324117270.db2.gz	ICIGXNPYAIWOAG-QZTJIDSGSA-N	0	3	345.874	3.217	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cccc(Cl)c1	ZINC001025292430	1324117474	/nfs/dbraw/zinc/11/74/74/1324117474.db2.gz	INFNRPGIAANOQN-ZWKOTPCHSA-N	0	3	330.859	3.432	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cccc3c2CCCCC3)C1	ZINC001025450660	1324292999	/nfs/dbraw/zinc/29/29/99/1324292999.db2.gz	LFPAHHLHHGIIFM-PKOBYXMFSA-N	0	3	338.495	3.419	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cccc3cccnc32)C1	ZINC001025473019	1324318447	/nfs/dbraw/zinc/31/84/47/1324318447.db2.gz	YAQNPHAHSHRDEB-FUHWJXTLSA-N	0	3	335.451	3.088	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(OC)c(C(C)C)c2)C1	ZINC001025475994	1324321026	/nfs/dbraw/zinc/32/10/26/1324321026.db2.gz	WDWQLAMCBMYWAG-WMZOPIPTSA-N	0	3	342.483	3.282	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccnc3ccccc32)C1	ZINC001025480642	1324327866	/nfs/dbraw/zinc/32/78/66/1324327866.db2.gz	YTWPONWFXKLJKK-DLBZAZTESA-N	0	3	335.451	3.088	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2nc3ccccc3cc2C)C1	ZINC001025485978	1324334517	/nfs/dbraw/zinc/33/45/17/1324334517.db2.gz	QYMRVILLOCHHNE-FUHWJXTLSA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cnc3ccccc3c2C)C1	ZINC001025488278	1324338629	/nfs/dbraw/zinc/33/86/29/1324338629.db2.gz	JVIMZPJEKUZXNB-ROUUACIJSA-N	0	3	349.478	3.397	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(C)c(Cl)c2F)C1	ZINC001025489025	1324340281	/nfs/dbraw/zinc/34/02/81/1324340281.db2.gz	NKAGDRIRBUSMQV-KBPBESRZSA-N	0	3	336.838	3.251	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(C)c(Cl)cc2C)C1	ZINC001025500592	1324349145	/nfs/dbraw/zinc/34/91/45/1324349145.db2.gz	UVDXDLCMBUWIFJ-HZPDHXFCSA-N	0	3	332.875	3.420	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc3ncccc3c2)C1	ZINC001025524524	1324369616	/nfs/dbraw/zinc/36/96/16/1324369616.db2.gz	UQGUWJJRSKWQIQ-LPHOPBHVSA-N	0	3	335.451	3.088	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cccc(F)c2Cl)C1	ZINC001025538355	1324385166	/nfs/dbraw/zinc/38/51/66/1324385166.db2.gz	GJSFKZOXAWGXMX-UONOGXRCSA-N	0	3	336.838	3.333	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(C)c(OCC)c2)C1	ZINC001025548425	1324396494	/nfs/dbraw/zinc/39/64/94/1324396494.db2.gz	ISJRBEGIVLPRIE-IEBWSBKVSA-N	0	3	342.483	3.247	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc3cc(F)ccc3o2)C1	ZINC001025550056	1324399163	/nfs/dbraw/zinc/39/91/63/1324399163.db2.gz	ZQHDGGQUMIPPIB-CABCVRRESA-N	0	3	342.414	3.426	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2csc(C(C)C)n2)C1	ZINC001025556680	1324406582	/nfs/dbraw/zinc/40/65/82/1324406582.db2.gz	XPINEPLCOSVWFC-HUUCEWRRSA-N	0	3	333.501	3.120	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(C(F)F)cc2)C1	ZINC001025557934	1324406743	/nfs/dbraw/zinc/40/67/43/1324406743.db2.gz	JVLQHKYUWNVSKF-YOEHRIQHSA-N	0	3	334.410	3.478	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cccn2C2CCCC2)C1	ZINC001025574873	1324413640	/nfs/dbraw/zinc/41/36/40/1324413640.db2.gz	WEKFXKNYOIYYAA-ROUUACIJSA-N	0	3	341.499	3.457	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(C)c(C)c2Cl)C1	ZINC001025592622	1324440469	/nfs/dbraw/zinc/44/04/69/1324440469.db2.gz	QLMLDFJIWBPSMJ-CVEARBPZSA-N	0	3	332.875	3.420	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(CC)c(C)s2)C1	ZINC001025614072	1324467325	/nfs/dbraw/zinc/46/73/25/1324467325.db2.gz	FZMCKIKOYQUCIR-PBHICJAKSA-N	0	3	332.513	3.473	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2c[nH]c3ccc(C)cc23)C1	ZINC001025629749	1324481372	/nfs/dbraw/zinc/48/13/72/1324481372.db2.gz	JWOMUZIGIFARHQ-SJORKVTESA-N	0	3	337.467	3.330	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(C(C)(F)F)cc2)C1	ZINC001025637508	1324489717	/nfs/dbraw/zinc/48/97/17/1324489717.db2.gz	UYXGKLFNPJBKBM-ZBFHGGJFSA-N	0	3	334.410	3.262	20	30		EGEDHN
CC(C)(C)CC(=O)N1C[C@@H]2CC[C@@H](NCc3ccccc3C#N)[C@H]2C1	ZINC001026200750	1324660270	/nfs/dbraw/zinc/66/02/70/1324660270.db2.gz	LIZHSUZBZLWIQD-GBESFXJTSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H]2CC[C@@H](NCc3cc(C4CC4)no3)[C@H]2C1	ZINC001026329051	1324729190	/nfs/dbraw/zinc/72/91/90/1324729190.db2.gz	UXMWBOJEAWGMNL-BHYGNILZSA-N	0	3	343.471	3.091	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H]2CC[C@@H](NCc3ccn(C(C)C)n3)[C@H]2C1	ZINC001026329592	1324730345	/nfs/dbraw/zinc/73/03/45/1324730345.db2.gz	ZIEVNRPPGJRMNV-RYQLBKOJSA-N	0	3	344.503	3.003	20	30		EGEDHN
C=C1CC(C)(C(=O)NC2CCC(NCc3ccccc3C#N)CC2)C1	ZINC001026555045	1324891832	/nfs/dbraw/zinc/89/18/32/1324891832.db2.gz	INQQZOBZAZOGJY-UHFFFAOYSA-N	0	3	337.467	3.432	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCN(C(=O)CCC2CCCC2)C1	ZINC001026660626	1324958645	/nfs/dbraw/zinc/95/86/45/1324958645.db2.gz	SVNALLWYIMKMQP-GOSISDBHSA-N	0	3	339.483	3.467	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)C2CCCCCC2)C1	ZINC001026725075	1324993104	/nfs/dbraw/zinc/99/31/04/1324993104.db2.gz	HGMDNJKJHNAMDA-KRWDZBQOSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)c2cncs2)C1	ZINC000963273562	1325051727	/nfs/dbraw/zinc/05/17/27/1325051727.db2.gz	WSTNPZSAMIRGNC-KBPBESRZSA-N	0	3	339.892	3.212	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@H](CNCc2nc3ccccc3o2)C1	ZINC001027039292	1325173529	/nfs/dbraw/zinc/17/35/29/1325173529.db2.gz	ZPTNOYVTAGWGOK-YWZLYKJASA-N	0	3	341.455	3.368	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)C[C@H]2C=CCC2)C1	ZINC001027290354	1325424459	/nfs/dbraw/zinc/42/44/59/1325424459.db2.gz	UFBODKLTNDGUPB-FXAWDEMLSA-N	0	3	337.467	3.337	20	30		EGEDHN
C=C(CN(C)C)C(=O)N(OC)[C@H](C)c1cccc(C(F)(F)F)c1	ZINC000856342747	1325482243	/nfs/dbraw/zinc/48/22/43/1325482243.db2.gz	WUYLKESNJQRULN-GFCCVEGCSA-N	0	3	330.350	3.274	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC[C@@H](N(C)Cc2ccc(Cl)c(F)c2)C1	ZINC001027336836	1325495584	/nfs/dbraw/zinc/49/55/84/1325495584.db2.gz	UTJJBJDPMMAKCV-GXTWGEPZSA-N	0	3	337.826	3.062	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@@H](N(C)Cc2ccc(F)c(C#N)c2)C1)C1CC1	ZINC001027351668	1325520162	/nfs/dbraw/zinc/52/01/62/1325520162.db2.gz	MDLZIDAGUVVQAK-RDTXWAMCSA-N	0	3	343.446	3.166	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)[C@@H](OCC)C2CC2)cc1	ZINC000860468932	1329320893	/nfs/dbraw/zinc/32/08/93/1329320893.db2.gz	GLKVRROMEITYNC-HKUYNNGSSA-N	0	3	342.439	3.492	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)[C@H](OCC)C2CC2)cc1	ZINC000860468933	1329321077	/nfs/dbraw/zinc/32/10/77/1329321077.db2.gz	GLKVRROMEITYNC-IEBWSBKVSA-N	0	3	342.439	3.492	20	30		EGEDHN
C[C@H]1O[C@@H](C)[C@@H](C)[C@H]1C(=O)C(C#N)C(=O)Nc1ccccc1Cl	ZINC000860469570	1329321243	/nfs/dbraw/zinc/32/12/43/1329321243.db2.gz	IUGQMCVQIXDUDP-NVGYGPBWSA-N	0	3	334.803	3.047	20	30		EGEDHN
CCC[C@@H](OCC)C(=O)C(C#N)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000860474049	1329321676	/nfs/dbraw/zinc/32/16/76/1329321676.db2.gz	VRLONIPAMPSKQM-SMDDNHRTSA-N	0	3	340.782	3.332	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](N(C)Cc2cccc(OC)c2)C1	ZINC001027521799	1327793305	/nfs/dbraw/zinc/79/33/05/1327793305.db2.gz	LLDMQFCMGQYRMP-KRWDZBQOSA-N	0	3	330.472	3.330	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](N(C)Cc2ccc(C)nc2C)C1	ZINC001027521884	1327794859	/nfs/dbraw/zinc/79/48/59/1327794859.db2.gz	NJQHOFJCWDTWAD-SFHVURJKSA-N	0	3	329.488	3.333	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)[C@]2(C)C=CCC2)C1	ZINC001027531260	1327813239	/nfs/dbraw/zinc/81/32/39/1327813239.db2.gz	HLCOAAILQCDELV-TZIWHRDSSA-N	0	3	337.467	3.337	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H](N(C)CCc2ccns2)C1	ZINC001027559539	1327872890	/nfs/dbraw/zinc/87/28/90/1327872890.db2.gz	AMLZOGJRFGBBCC-MAUKXSAKSA-N	0	3	335.517	3.211	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)[C@H](Cc2ccccc2)C(C)C)C1	ZINC001027571785	1327906232	/nfs/dbraw/zinc/90/62/32/1327906232.db2.gz	GURXNOAMUWWPOO-VQTJNVASSA-N	0	3	326.484	3.057	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)c2cc3c(cccc3F)s2)C1	ZINC001027674257	1328070047	/nfs/dbraw/zinc/07/00/47/1328070047.db2.gz	SXRSQMQAGBANIB-CYBMUJFWSA-N	0	3	330.428	3.210	20	30		EGEDHN
C=C(Cl)CN(C)[C@@H]1CCCN(C(=O)c2ccccc2CN(C)C)C1	ZINC001027693095	1328098253	/nfs/dbraw/zinc/09/82/53/1328098253.db2.gz	RMTZQQACLGYHML-QGZVFWFLSA-N	0	3	349.906	3.037	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cscc2C(F)F)C1	ZINC000966165157	1328210989	/nfs/dbraw/zinc/21/09/89/1328210989.db2.gz	DLYFSYKATFULTQ-RISCZKNCSA-N	0	3	326.412	3.149	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2cccc(NC(=O)CC)c2)C1	ZINC000966456384	1328303415	/nfs/dbraw/zinc/30/34/15/1328303415.db2.gz	ONQFQHHLDKCQRM-QAPCUYQASA-N	0	3	343.471	3.051	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NC[C@@H]1CCCN1Cc1ccc(C)cc1	ZINC001027889532	1328355977	/nfs/dbraw/zinc/35/59/77/1328355977.db2.gz	BRKFMTGMVXHSRY-ZCNNSNEGSA-N	0	3	342.483	3.057	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cc3ccncc3s2)C1	ZINC000966667295	1328372077	/nfs/dbraw/zinc/37/20/77/1328372077.db2.gz	NPOBEARCNCQYFP-HIFRSBDPSA-N	0	3	329.469	3.313	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)Cc2cccc3cnccc32)C1	ZINC000966907859	1328468268	/nfs/dbraw/zinc/46/82/68/1328468268.db2.gz	HHLGPFWEAMBEQV-JXFKEZNVSA-N	0	3	337.467	3.180	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H]1CNC(=O)c1scnc1C(F)F	ZINC001028022509	1328484050	/nfs/dbraw/zinc/48/40/50/1328484050.db2.gz	KFCWTAIKXDYPGV-LLVKDONJSA-N	0	3	329.416	3.241	20	30		EGEDHN
N#Cc1ccc(C2CCN([C@@H]3C[C@H]4CCCC[C@@H]4NC3=O)CC2)cc1	ZINC000933606285	1329905600	/nfs/dbraw/zinc/90/56/00/1329905600.db2.gz	HONFDZJBXDENIL-HSALFYBXSA-N	0	3	337.467	3.185	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(-c3ccon3)cc2)CC1	ZINC000933729839	1329917827	/nfs/dbraw/zinc/91/78/27/1329917827.db2.gz	ZHFKHDIQCJHOAO-UHFFFAOYSA-N	0	3	326.400	3.114	20	30		EGEDHN
CC(C)N1CCC[C@@H]1C(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1	ZINC000933858674	1329928724	/nfs/dbraw/zinc/92/87/24/1329928724.db2.gz	QRGUSBXKTZKSBZ-IPMKNSEASA-N	0	3	325.456	3.158	20	30		EGEDHN
C=C[C@H](CC)CC(=O)Nc1cccc(CN2CCC(CO)CC2)c1	ZINC000934430687	1329978317	/nfs/dbraw/zinc/97/83/17/1329978317.db2.gz	WSGMOILRWYPPJT-MRXNPFEDSA-N	0	3	330.472	3.432	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@@H](N[C@H](c3ccncc3)C3CC3)C2=O)cc1	ZINC000934695924	1330000695	/nfs/dbraw/zinc/00/06/95/1330000695.db2.gz	DUDBFSCCQUPLOP-UXHICEINSA-N	0	3	346.434	3.190	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](NC(=O)c2cccc3nc[nH]c32)C(C)(C)C1	ZINC000941119518	1331340404	/nfs/dbraw/zinc/34/04/04/1331340404.db2.gz	JDLVFHNXQIYKPP-HNNXBMFYSA-N	0	3	346.862	3.146	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](NC(=O)c2n[nH]c3ccccc32)C(C)(C)C1	ZINC000941200334	1331382937	/nfs/dbraw/zinc/38/29/37/1331382937.db2.gz	DSUZANDUJJWPJU-OAHLLOKOSA-N	0	3	346.862	3.146	20	30		EGEDHN
C[C@H]1CN(Cc2ccc(C#N)cc2)CC[C@H]1NC(=O)C1(C2CC2)CC1	ZINC000942159651	1331852362	/nfs/dbraw/zinc/85/23/62/1331852362.db2.gz	HRBKFOOZGZABBH-HNAYVOBHSA-N	0	3	337.467	3.075	20	30		EGEDHN
C[C@H]1CN(Cc2ccc(C#N)cc2)CC[C@@H]1NC(=O)C1(C2CC2)CC1	ZINC000942159652	1331852557	/nfs/dbraw/zinc/85/25/57/1331852557.db2.gz	HRBKFOOZGZABBH-KXBFYZLASA-N	0	3	337.467	3.075	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccccc2CC(C)(C)C)[C@H](C)C1	ZINC000942163535	1331855399	/nfs/dbraw/zinc/85/53/99/1331855399.db2.gz	MRHOJYFZQPRJFY-APWZRJJASA-N	0	3	326.484	3.349	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2sc(C)nc2CC(C)C)[C@@H](C)C1	ZINC000942312891	1331900369	/nfs/dbraw/zinc/90/03/69/1331900369.db2.gz	CRKXCIRUZSHBMT-HOCLYGCPSA-N	0	3	347.528	3.114	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cnc3ccccc3c2C)[C@@H](C)C1	ZINC000942523372	1331954388	/nfs/dbraw/zinc/95/43/88/1331954388.db2.gz	PIWGMIXFBNXLHC-HNAYVOBHSA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C3CC3)oc2C2CC2)[C@@H](C)C1	ZINC000942525592	1331956169	/nfs/dbraw/zinc/95/61/69/1331956169.db2.gz	RPUUZFTZVTWONP-KSSFIOAISA-N	0	3	340.467	3.498	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2oc3ccccc3c2OC)[C@H](C)C1	ZINC000942546861	1331968244	/nfs/dbraw/zinc/96/82/44/1331968244.db2.gz	BKWUGLYHKXDGIW-HIFRSBDPSA-N	0	3	328.412	3.068	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3cccnc3C)C[C@H]2C)cc1	ZINC000942554162	1331970941	/nfs/dbraw/zinc/97/09/41/1331970941.db2.gz	ZLIITQWVFOLPFU-IERDGZPVSA-N	0	3	347.462	3.012	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3cnccc3C)C[C@H]2C)C1	ZINC000942602081	1331999072	/nfs/dbraw/zinc/99/90/72/1331999072.db2.gz	CTDBJEJFDQEODD-SJLPKXTDSA-N	0	3	327.472	3.073	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3cccnc3C)C[C@H]2C)C1	ZINC000942603391	1332001310	/nfs/dbraw/zinc/00/13/10/1332001310.db2.gz	WUFWSXKRPIYSRJ-QAPCUYQASA-N	0	3	327.472	3.073	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc3nc(C)ccc3c2)[C@H](C)C1	ZINC000943737972	1332250074	/nfs/dbraw/zinc/25/00/74/1332250074.db2.gz	JDJYDWJVJFFVSI-BEFAXECRSA-N	0	3	335.451	3.007	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccc(-c3ccccc3)nc2)[C@@H](C)C1	ZINC000943756627	1332255442	/nfs/dbraw/zinc/25/54/42/1332255442.db2.gz	SMXLAUMIMXAQJN-QFBILLFUSA-N	0	3	335.451	3.375	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cnc(CC(C)(C)C)s2)[C@H](C)C1	ZINC000944031770	1332311722	/nfs/dbraw/zinc/31/17/22/1332311722.db2.gz	DFYYNFPUUDGFTD-HUUCEWRRSA-N	0	3	347.528	3.195	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cnn(C(CC)CC)c2C)[C@H](C)C1	ZINC000944033473	1332312376	/nfs/dbraw/zinc/31/23/76/1332312376.db2.gz	MHOXFFIVXBDUKW-BEFAXECRSA-N	0	3	344.503	3.016	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccc(-c3ccoc3)c2)[C@@H](C)C1	ZINC000944045262	1332315268	/nfs/dbraw/zinc/31/52/68/1332315268.db2.gz	CQMJQGMWILAYMN-OXJNMPFZSA-N	0	3	336.435	3.410	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C(C)(C)c2ccc(CC)cc2)[C@@H](C)C1	ZINC000944080849	1332323205	/nfs/dbraw/zinc/32/32/05/1332323205.db2.gz	OWHFVOAYGGAZDQ-FXAWDEMLSA-N	0	3	340.511	3.377	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2[nH]ccc2-c2ccccc2)[C@H](C)C1	ZINC000944135245	1332333460	/nfs/dbraw/zinc/33/34/60/1332333460.db2.gz	JHXSBCVKOPRKBS-VQIMIIECSA-N	0	3	335.451	3.145	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(-c3cccs3)o2)[C@H](C)C1	ZINC000944531861	1332415359	/nfs/dbraw/zinc/41/53/59/1332415359.db2.gz	KESYGZANAUVWFI-HUUCEWRRSA-N	0	3	342.464	3.472	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccccc2CC(C)C)[C@H](C)C1	ZINC000945365127	1332567785	/nfs/dbraw/zinc/56/77/85/1332567785.db2.gz	ILOSGMARIZNNRM-XLIONFOSSA-N	0	3	326.484	3.349	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(CC)c(CC)c2)[C@@H](C)C1	ZINC000946309618	1332783629	/nfs/dbraw/zinc/78/36/29/1332783629.db2.gz	CFKSOHTZEYQIOT-OXJNMPFZSA-N	0	3	326.484	3.275	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@@H]3CCC[C@H](F)C3)CC[C@@H]2C1	ZINC000946590906	1332859042	/nfs/dbraw/zinc/85/90/42/1332859042.db2.gz	KXYIDIAUOLGRCL-NCOADZHNSA-N	0	3	342.886	3.438	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CN([C@@H](C)c3ncc(C)o3)C[C@H]2CC1	ZINC000946713996	1332882634	/nfs/dbraw/zinc/88/26/34/1332882634.db2.gz	COLVKAJLEYSNOD-YESZJQIVSA-N	0	3	345.487	3.427	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3coc(C4CC4)n3)CC[C@@H]2C1	ZINC000946811142	1332906283	/nfs/dbraw/zinc/90/62/83/1332906283.db2.gz	XLWZCXIYQLKMBR-GASCZTMLSA-N	0	3	349.862	3.089	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@H]2CN(Cc3ccccc3C#N)C[C@H]2CC1	ZINC000946869344	1332920300	/nfs/dbraw/zinc/92/03/00/1332920300.db2.gz	LOXBVXCYZYJRDF-KDURUIRLSA-N	0	3	339.483	3.275	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2cccs2)CCN1Cc1cccc(C#N)c1	ZINC000947018340	1332975847	/nfs/dbraw/zinc/97/58/47/1332975847.db2.gz	XDOQJEYOKUHIDQ-PBHICJAKSA-N	0	3	339.464	3.403	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@@H](C)C2)o1	ZINC000947025494	1332979045	/nfs/dbraw/zinc/97/90/45/1332979045.db2.gz	DZLMVPPZQPMHQY-KBXCAEBGSA-N	0	3	337.423	3.243	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)CC2CCC2)CCN1Cc1cccc(C#N)c1	ZINC000947162721	1333029696	/nfs/dbraw/zinc/02/96/96/1333029696.db2.gz	LYVSDKQWMUTTER-BEFAXECRSA-N	0	3	325.456	3.218	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)CC2CCC2)CCN1Cc1cccc(C#N)c1	ZINC000947162722	1333029827	/nfs/dbraw/zinc/02/98/27/1333029827.db2.gz	LYVSDKQWMUTTER-DNVCBOLYSA-N	0	3	325.456	3.218	20	30		EGEDHN
Cc1cc(CN2CC[C@@H](NC(=O)c3cc(C#N)c[nH]3)C[C@@H]2C)cs1	ZINC000947171605	1333035851	/nfs/dbraw/zinc/03/58/51/1333035851.db2.gz	YELSMRXQINIAIP-BLLLJJGKSA-N	0	3	342.468	3.039	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnc(-c3ccccc3)o2)C[C@H]1C	ZINC000947417195	1333120722	/nfs/dbraw/zinc/12/07/22/1333120722.db2.gz	NDUWVWKXNWKOKB-GDBMZVCRSA-N	0	3	325.412	3.110	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(C)cc2Cl)C[C@@H]1C	ZINC000947459678	1333136406	/nfs/dbraw/zinc/13/64/06/1333136406.db2.gz	OFJHEQVVZGUHGS-RDJZCZTQSA-N	0	3	332.875	3.183	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(-c3ccccc3)no2)C[C@@H]1C	ZINC000947487576	1333144647	/nfs/dbraw/zinc/14/46/47/1333144647.db2.gz	GDELUSOJIMIGBG-GOEBONIOSA-N	0	3	325.412	3.110	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(-c3ccccc3)no2)C[C@H]1C	ZINC000947487578	1333144666	/nfs/dbraw/zinc/14/46/66/1333144666.db2.gz	GDELUSOJIMIGBG-ZBFHGGJFSA-N	0	3	325.412	3.110	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(OC)c(C(C)C)c2)C[C@@H]1C	ZINC000947506167	1333149692	/nfs/dbraw/zinc/14/96/92/1333149692.db2.gz	KYGXVPWXCJFXKJ-DOTOQJQBSA-N	0	3	328.456	3.035	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc(-n3cccc3)c2)C[C@@H]1C	ZINC000947512041	1333151200	/nfs/dbraw/zinc/15/12/00/1333151200.db2.gz	SQWCMGXRQPJJST-HKUYNNGSSA-N	0	3	335.451	3.083	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3cccc(C)c3)CCC2)C[C@@H]1C	ZINC000947602215	1333189918	/nfs/dbraw/zinc/18/99/18/1333189918.db2.gz	JCWJXMALNXAATL-AZUAARDMSA-N	0	3	338.495	3.409	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3cnccc3C)[C@@H](C)C2)C1	ZINC000947702790	1333232510	/nfs/dbraw/zinc/23/25/10/1333232510.db2.gz	SIUYQULIYWPAHF-FUHWJXTLSA-N	0	3	327.472	3.215	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3cnccc3C)[C@H](C)C2)C1	ZINC000947702789	1333232720	/nfs/dbraw/zinc/23/27/20/1333232720.db2.gz	SIUYQULIYWPAHF-AEFFLSMTSA-N	0	3	327.472	3.215	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3cncc(C)c3)[C@H](C)C2)C1	ZINC000947702607	1333233174	/nfs/dbraw/zinc/23/31/74/1333233174.db2.gz	QFZVPOBMHPOVTC-SJLPKXTDSA-N	0	3	327.472	3.215	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccccc2OC(C)C)C[C@H]1C	ZINC000947801882	1333265295	/nfs/dbraw/zinc/26/52/95/1333265295.db2.gz	QFPFSHZTFOHSIH-IEBWSBKVSA-N	0	3	342.483	3.009	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccccc2OC(C)C)C[C@H]1C	ZINC000947801883	1333265625	/nfs/dbraw/zinc/26/56/25/1333265625.db2.gz	QFPFSHZTFOHSIH-MJGOQNOKSA-N	0	3	342.483	3.009	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2csc(-c3ccoc3)n2)C[C@@H]1C	ZINC000947820252	1333270951	/nfs/dbraw/zinc/27/09/51/1333270951.db2.gz	JUFITMONJNXSTO-ZFWWWQNUSA-N	0	3	343.452	3.009	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@@H](C)C2)ccn1	ZINC000947833483	1333273227	/nfs/dbraw/zinc/27/32/27/1333273227.db2.gz	UKJRBZCZTIXPAF-OXJNMPFZSA-N	0	3	348.450	3.045	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnc3ccc(F)cc3c2)C[C@@H]1C	ZINC000947895641	1333295518	/nfs/dbraw/zinc/29/55/18/1333295518.db2.gz	PQVZNNGXVQUSFZ-GUYCJALGSA-N	0	3	327.403	3.143	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C(C)(C)c2ccc(CC)cc2)C[C@H]1C	ZINC000947907273	1333301594	/nfs/dbraw/zinc/30/15/94/1333301594.db2.gz	FYZVWOGIBNYMHY-APWZRJJASA-N	0	3	326.484	3.129	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cnn(C(CC)CC)c2C)C[C@H]1C	ZINC000947908270	1333302407	/nfs/dbraw/zinc/30/24/07/1333302407.db2.gz	QUEPNCGTWRQSCX-NVXWUHKLSA-N	0	3	344.503	3.159	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)C(C)(C)C)CCN1Cc1ccc(OCC#N)cc1	ZINC000947957553	1333320364	/nfs/dbraw/zinc/32/03/64/1333320364.db2.gz	LBSGENBHHSGZKV-WBVHZDCISA-N	0	3	343.471	3.104	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2)C[C@@H]1C	ZINC000947962856	1333322655	/nfs/dbraw/zinc/32/26/55/1333322655.db2.gz	OWFBEJUYKIDYRM-SWLSCSKDSA-N	0	3	326.362	3.474	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc(C(F)(F)F)cc2)C[C@H]1C	ZINC000947962854	1333323007	/nfs/dbraw/zinc/32/30/07/1333323007.db2.gz	OWFBEJUYKIDYRM-DOMZBBRYSA-N	0	3	326.362	3.474	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2c(F)cccc2Cl)C[C@H]1C	ZINC000947967233	1333324920	/nfs/dbraw/zinc/32/49/20/1333324920.db2.gz	NBODQMZGPVOKRX-KGLIPLIRSA-N	0	3	336.838	3.014	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(F)c3occc32)C[C@H]1C	ZINC000948044292	1333352046	/nfs/dbraw/zinc/35/20/46/1333352046.db2.gz	OUPJDKIPPRETIF-KGLIPLIRSA-N	0	3	328.387	3.178	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(OC3CCC3)cc2)C[C@@H]1C	ZINC000948061816	1333360433	/nfs/dbraw/zinc/36/04/33/1333360433.db2.gz	ZPFORTUSVKQVEX-FUHWJXTLSA-N	0	3	340.467	3.224	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2nc(C(C)C)oc2C)CC1	ZINC000948368308	1333497139	/nfs/dbraw/zinc/49/71/39/1333497139.db2.gz	HYFINETURICOSV-INIZCTEOSA-N	0	3	331.460	3.056	20	30		EGEDHN
CN(C(=O)C1(C)CC1)[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948397032	1333508363	/nfs/dbraw/zinc/50/83/63/1333508363.db2.gz	ILXIKWPPBCDFQR-GOSISDBHSA-N	0	3	325.456	3.171	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2sc(Cl)nc2C)CC1	ZINC000948408417	1333514413	/nfs/dbraw/zinc/51/44/13/1333514413.db2.gz	PLXYTDNTVYFDAB-CYBMUJFWSA-N	0	3	339.892	3.055	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2ccc3nccc(C)c3c2)CC1	ZINC000948408624	1333514228	/nfs/dbraw/zinc/51/42/28/1333514228.db2.gz	QOGPUAFWKDAKTE-LJQANCHMSA-N	0	3	349.478	3.493	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2cccc3ccc(C)nc32)CC1	ZINC000948471443	1333538991	/nfs/dbraw/zinc/53/89/91/1333538991.db2.gz	SFCVESYTDPWENT-SFHVURJKSA-N	0	3	335.451	3.103	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)C(C)(C)c2cc(C)ccn2)CC1	ZINC000948471319	1333539102	/nfs/dbraw/zinc/53/91/02/1333539102.db2.gz	OWQKMHWZONGTTQ-SFHVURJKSA-N	0	3	341.499	3.004	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](N(C)C(=O)c2cc(CCC)[nH]n2)CC1	ZINC000948665189	1333620207	/nfs/dbraw/zinc/62/02/07/1333620207.db2.gz	GVEGEVCFBLFSJT-OAHLLOKOSA-N	0	3	338.883	3.041	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2ccc(F)c(Cl)c2)CC1	ZINC000948729084	1333649493	/nfs/dbraw/zinc/64/94/93/1333649493.db2.gz	AMEAILQOQKQOIU-HNNXBMFYSA-N	0	3	336.838	3.429	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)[C@@H](C)c2ccc(Cl)cc2)CC1	ZINC000948742484	1333654903	/nfs/dbraw/zinc/65/49/03/1333654903.db2.gz	KYRBWMOSMLQDAY-MAUKXSAKSA-N	0	3	332.875	3.390	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2cc(C(C)(C)C)oc2C)CC1	ZINC000948805378	1333688669	/nfs/dbraw/zinc/68/86/69/1333688669.db2.gz	ZKFUYGVUZDNLEO-INIZCTEOSA-N	0	3	330.472	3.445	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2ccccc2O[C@@H](C)CC)CC1	ZINC000948820898	1333698066	/nfs/dbraw/zinc/69/80/66/1333698066.db2.gz	UQCBOJBUQJERLH-ZWKOTPCHSA-N	0	3	342.483	3.424	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2ccn(C(CC)CC)n2)CC1	ZINC000948833447	1333703484	/nfs/dbraw/zinc/70/34/84/1333703484.db2.gz	TWOCWEIYRUPIHE-GOSISDBHSA-N	0	3	344.503	3.194	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@H]1CNC(=O)c1cnc(C)[nH]1	ZINC000948899555	1333725117	/nfs/dbraw/zinc/72/51/17/1333725117.db2.gz	ZGZYKUBUFLRXNS-LJQANCHMSA-N	0	3	338.455	3.014	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@@H]1CNC(=O)[C@H]1CCCOCC1	ZINC000948913238	1333731226	/nfs/dbraw/zinc/73/12/26/1333731226.db2.gz	QTKAIMDPASPFGA-ICSRJNTNSA-N	0	3	342.483	3.095	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@H]1CNC(=O)[C@H]1CCCOCC1	ZINC000948913237	1333731413	/nfs/dbraw/zinc/73/14/13/1333731413.db2.gz	QTKAIMDPASPFGA-AZUAARDMSA-N	0	3	342.483	3.095	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C(C)(C)C1CCCC1)CCO2	ZINC000949114631	1333779757	/nfs/dbraw/zinc/77/97/57/1333779757.db2.gz	FOPVVVZJOXWVDE-UHFFFAOYSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C13CC(C(C)(C)C)(C1)C3)CCO2	ZINC000949251750	1333804259	/nfs/dbraw/zinc/80/42/59/1333804259.db2.gz	WBYFFVXBXDWJCP-UHFFFAOYSA-N	0	3	346.515	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)c3ccc(CC)o3)CC2)C1	ZINC000949398416	1333837301	/nfs/dbraw/zinc/83/73/01/1333837301.db2.gz	MFGZBRDNKLZYDD-UHFFFAOYSA-N	0	3	346.471	3.115	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@H](C)C3CCCC3)CC2)C1	ZINC000949509083	1333863179	/nfs/dbraw/zinc/86/31/79/1333863179.db2.gz	LARKQHMITOLETN-GOSISDBHSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C[C@@H](C(=O)N1CCC2(CC1)CN(CCC)CCO2)c1ccccc1	ZINC000949529542	1333868666	/nfs/dbraw/zinc/86/86/66/1333868666.db2.gz	ZCAHRQPNNLFULU-LJQANCHMSA-N	0	3	342.483	3.060	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C34CCC(CC3)CC4)CC2)C1	ZINC000949531885	1333868840	/nfs/dbraw/zinc/86/88/40/1333868840.db2.gz	SKOCGMVAYLEABK-UHFFFAOYSA-N	0	3	346.515	3.226	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C[C@H]3CCCC[C@H]3C)CC2)C1	ZINC000949533700	1333869900	/nfs/dbraw/zinc/86/99/00/1333869900.db2.gz	DRWIQZWABVWWDV-RTBURBONSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N1CCN(CC2CCCCCC2)CC1	ZINC000951711814	1334305527	/nfs/dbraw/zinc/30/55/27/1334305527.db2.gz	DGZMFZBUZBVMFQ-OALUTQOASA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2cccc(-n3cccc3)c2)C1	ZINC000967268214	1335681449	/nfs/dbraw/zinc/68/14/49/1335681449.db2.gz	CVZQAXAIDOAIQC-YLJYHZDGSA-N	0	3	337.467	3.494	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2cnc3ccccc3c2C)C1	ZINC000967410019	1335729530	/nfs/dbraw/zinc/72/95/30/1335729530.db2.gz	XHCIUCMCWRWFKU-MGPUTAFESA-N	0	3	335.451	3.007	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2ccc(C)c(Cl)c2F)C1	ZINC000967420883	1335732981	/nfs/dbraw/zinc/73/29/81/1335732981.db2.gz	ZHIIMDFVALXWJD-SWLSCSKDSA-N	0	3	336.838	3.251	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2cc(-c3cccs3)on2)C1	ZINC000967524022	1335767092	/nfs/dbraw/zinc/76/70/92/1335767092.db2.gz	KIZHOIMTWWGTND-UKRRQHHQSA-N	0	3	345.468	3.419	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccc(F)c(Cl)c2F)C1	ZINC000968216099	1335874370	/nfs/dbraw/zinc/87/43/70/1335874370.db2.gz	ZRRXBFKUNLLZKY-BXUZGUMPSA-N	0	3	340.801	3.082	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)C(C)(C)c2cccc(Cl)c2)C1	ZINC000968364060	1335903535	/nfs/dbraw/zinc/90/35/35/1335903535.db2.gz	DLBPZHOAZSGPDH-YJBOKZPZSA-N	0	3	346.902	3.468	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2cccc(C(C)(C)C)c2)C1	ZINC000968453757	1335930408	/nfs/dbraw/zinc/93/04/08/1335930408.db2.gz	GGAWEYPHDAEKMY-VQIMIIECSA-N	0	3	326.484	3.448	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cnn(C(CC)CC)c2C)C1	ZINC000968518058	1335950899	/nfs/dbraw/zinc/95/08/99/1335950899.db2.gz	XGDDPVCBDYRYFT-BEFAXECRSA-N	0	3	344.503	3.016	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2cnn(C(CC)CC)c2C)C1	ZINC000968518059	1335951021	/nfs/dbraw/zinc/95/10/21/1335951021.db2.gz	XGDDPVCBDYRYFT-DNVCBOLYSA-N	0	3	344.503	3.016	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccc(C(F)(F)F)cc2)C1	ZINC000968580538	1335971607	/nfs/dbraw/zinc/97/16/07/1335971607.db2.gz	WGWBPCZLWQEXAD-CZUORRHYSA-N	0	3	338.373	3.169	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2coc3ccc(F)cc23)C1	ZINC000968597206	1335978240	/nfs/dbraw/zinc/97/82/40/1335978240.db2.gz	UGKKLMDVFRVQEN-DYVFJYSZSA-N	0	3	328.387	3.035	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(OC)c(OCC)c2)C1	ZINC000968624164	1335987934	/nfs/dbraw/zinc/98/79/34/1335987934.db2.gz	OKKOWDAMWMXFRF-WBVHZDCISA-N	0	3	346.471	3.110	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2cc(C)n(C(C)C)c2C)C1	ZINC000968630694	1335990096	/nfs/dbraw/zinc/99/00/96/1335990096.db2.gz	APWIQJAHTANGTR-DNVCBOLYSA-N	0	3	329.488	3.149	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2c[nH]c3ccc(C)cc23)C1	ZINC000968685585	1336011292	/nfs/dbraw/zinc/01/12/92/1336011292.db2.gz	VXQROFQVWVCLKK-DNVCBOLYSA-N	0	3	325.456	3.493	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2csc(CC(C)C)n2)C1	ZINC000968694845	1336013921	/nfs/dbraw/zinc/01/39/21/1336013921.db2.gz	BIWQUNSRHPPCRQ-LSDHHAIUSA-N	0	3	335.517	3.358	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)C(C)(C)c2ccccc2OC)C1	ZINC000968697776	1336016522	/nfs/dbraw/zinc/01/65/22/1336016522.db2.gz	IVWGTZFROCAHII-SJLPKXTDSA-N	0	3	344.499	3.376	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)Cc2c(C)oc3ccccc32)C1	ZINC000968713569	1336021289	/nfs/dbraw/zinc/02/12/89/1336021289.db2.gz	SLSBKADPJKGJAE-HNAYVOBHSA-N	0	3	338.451	3.134	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1csc([C@H]2CCCO2)n1	ZINC000968856109	1336069824	/nfs/dbraw/zinc/06/98/24/1336069824.db2.gz	DYSSEMBXSUKQFP-GDBMZVCRSA-N	0	3	349.500	3.155	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccc(N(C)C)cc1F	ZINC000968890522	1336081510	/nfs/dbraw/zinc/08/15/10/1336081510.db2.gz	JSRZJBFDJANZNK-INIZCTEOSA-N	0	3	333.451	3.052	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cc2ccccc2n1C	ZINC000969007429	1336116167	/nfs/dbraw/zinc/11/61/67/1336116167.db2.gz	CGBTVSTZLIFKJH-QGZVFWFLSA-N	0	3	325.456	3.339	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)[C@H]1CCCC(F)(F)C1	ZINC000969025819	1336121813	/nfs/dbraw/zinc/12/18/13/1336121813.db2.gz	WDYLJRCDWKRBOY-JKSUJKDBSA-N	0	3	326.431	3.196	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1noc2c1C[C@H](C)CC2	ZINC000969097449	1336141710	/nfs/dbraw/zinc/14/17/10/1336141710.db2.gz	LPJWKYFYJXEPPR-HZPDHXFCSA-N	0	3	345.487	3.350	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cncc(C(F)(F)F)c1	ZINC000969103377	1336144632	/nfs/dbraw/zinc/14/46/32/1336144632.db2.gz	QJOXEEKDGPGJAI-HNNXBMFYSA-N	0	3	341.377	3.261	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ncccc1OC(C)C	ZINC000969133667	1336155650	/nfs/dbraw/zinc/15/56/50/1336155650.db2.gz	RZLWQDMUMGWJQS-INIZCTEOSA-N	0	3	331.460	3.029	20	30		EGEDHN
C#CCCN1CCCCC[C@@H]1CNC(=O)c1cnc(CC(C)C)s1	ZINC000969161424	1336168143	/nfs/dbraw/zinc/16/81/43/1336168143.db2.gz	WFWRCXKMWPDDOW-MRXNPFEDSA-N	0	3	347.528	3.339	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1ncccc1OCC	ZINC000969173585	1336171246	/nfs/dbraw/zinc/17/12/46/1336171246.db2.gz	NHVCYLUOLZUZIP-INIZCTEOSA-N	0	3	331.460	3.031	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(C(=O)C[C@@H]3CC=CCC3)C2)cc1F	ZINC000969597088	1336226646	/nfs/dbraw/zinc/22/66/46/1336226646.db2.gz	MXXJNQWQEUHLHM-CRAIPNDOSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](C)C2CN(CCc3scnc3C)C2)CC1	ZINC000970375262	1336300179	/nfs/dbraw/zinc/30/01/79/1336300179.db2.gz	COTSXSAGZAZOLI-AWEZNQCLSA-N	0	3	347.528	3.177	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccoc2C(F)(F)F)CC1	ZINC001005453677	1336352817	/nfs/dbraw/zinc/35/28/17/1336352817.db2.gz	NLOGYMYOGMRTDT-UHFFFAOYSA-N	0	3	330.350	3.411	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cc(C)n([C@@H](C)CC)n2)CC1	ZINC001005632204	1336385974	/nfs/dbraw/zinc/38/59/74/1336385974.db2.gz	MBMFIAAPBTXDSU-HNNXBMFYSA-N	0	3	332.492	3.275	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2oc(CC(C)C)nc2C)CC1	ZINC001006097315	1336451495	/nfs/dbraw/zinc/45/14/95/1336451495.db2.gz	INHNGRQGRMOXKX-UHFFFAOYSA-N	0	3	333.476	3.294	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)[C@@H]2C[C@@H]2c2cc(F)ccc2F)CC1	ZINC001006429489	1336504324	/nfs/dbraw/zinc/50/43/24/1336504324.db2.gz	POGSUJHAIZKRDM-NVXWUHKLSA-N	0	3	334.410	3.177	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCN(CCc3ccc(C)cc3)C2)C1	ZINC001008466401	1336863745	/nfs/dbraw/zinc/86/37/45/1336863745.db2.gz	WERNPPQPKXDTET-LJQANCHMSA-N	0	3	326.484	3.474	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H](NC(=O)c2cc(Br)co2)C1	ZINC001008760098	1336920976	/nfs/dbraw/zinc/92/09/76/1336920976.db2.gz	HYCAZGFTHJTDDO-CYBMUJFWSA-N	0	3	341.249	3.203	20	30		EGEDHN
C#CCCN1CCC[C@H](NC(=O)c2ccc(Cl)c(Cl)c2)C1	ZINC001009311050	1337003272	/nfs/dbraw/zinc/00/32/72/1337003272.db2.gz	BKDSMOOSBSUDPT-ZDUSSCGKSA-N	0	3	325.239	3.211	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(CCc3ccccc3CC)C2)cc1	ZINC001015481808	1338155417	/nfs/dbraw/zinc/15/54/17/1338155417.db2.gz	IHONDCYBWVXGRV-JOCHJYFZSA-N	0	3	346.474	3.277	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CC12CCN(C/C=C\Cl)CC2	ZINC001016658714	1338681860	/nfs/dbraw/zinc/68/18/60/1338681860.db2.gz	JRFBMNPIIZXNGM-FAOGRTBUSA-N	0	3	333.863	3.011	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2[nH]c3ccccc3c2Cl)CC1	ZINC001016706875	1338697496	/nfs/dbraw/zinc/69/74/96/1338697496.db2.gz	NNXWDWMEWVAZQJ-OAHLLOKOSA-N	0	3	341.842	3.039	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(Cl)cc2F)CC1	ZINC001016717827	1338701382	/nfs/dbraw/zinc/70/13/82/1338701382.db2.gz	WCTQKFASRJTUAF-INIZCTEOSA-N	0	3	334.822	3.087	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2c(C)[nH]c3ccccc32)CC1	ZINC001016719864	1338702070	/nfs/dbraw/zinc/70/20/70/1338702070.db2.gz	SUKZZPFYCCDCDH-SFHVURJKSA-N	0	3	335.451	3.084	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2cc3c(o2)c(F)ccc3C)CC1	ZINC001016746463	1338710314	/nfs/dbraw/zinc/71/03/14/1338710314.db2.gz	USAJHTJIFWZFPR-KRWDZBQOSA-N	0	3	340.398	3.098	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cc3c(cc(C)cc3C)[nH]2)CC1	ZINC001016753198	1338712340	/nfs/dbraw/zinc/71/23/40/1338712340.db2.gz	IPEKQGMMRIMGNU-FQEVSTJZSA-N	0	3	349.478	3.392	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CC23CCN(C[C@H](F)CC)CC3)cc1	ZINC001016760716	1338715266	/nfs/dbraw/zinc/71/52/66/1338715266.db2.gz	CIRQOJOIVGLKHI-MSOLQXFVSA-N	0	3	328.431	3.000	20	30		EGEDHN
C[C@@]1(C(=O)N[C@H]2CC23CCN(Cc2cccc(C#N)c2)CC3)C=CCC1	ZINC001016776637	1338722573	/nfs/dbraw/zinc/72/25/73/1338722573.db2.gz	ZQCRFCSGOSJCPG-PZJWPPBQSA-N	0	3	349.478	3.385	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccc(Cl)cc2C)CC1	ZINC001016803140	1338731543	/nfs/dbraw/zinc/73/15/43/1338731543.db2.gz	JLHXNAODZNDGHC-QGZVFWFLSA-N	0	3	330.859	3.256	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CC23CCN(Cc2c(C)noc2C)CC3)C1	ZINC001016807989	1338732730	/nfs/dbraw/zinc/73/27/30/1338732730.db2.gz	NHWXYEQJYUCZGQ-QGZVFWFLSA-N	0	3	343.471	3.118	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2cc(C(C)(C)C)oc2C)CC1	ZINC001016843290	1338743765	/nfs/dbraw/zinc/74/37/65/1338743765.db2.gz	OZYWZXUBPIEKMR-MRXNPFEDSA-N	0	3	328.456	3.103	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2scnc2C(C)(C)C)CC1	ZINC001016867750	1338752921	/nfs/dbraw/zinc/75/29/21/1338752921.db2.gz	MTQCPRZQAASSEI-AWEZNQCLSA-N	0	3	345.512	3.048	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)[C@@H](C)c2ccc(C)s2)CC1	ZINC001016926912	1338772912	/nfs/dbraw/zinc/77/29/12/1338772912.db2.gz	OFADGIGFVVZWPV-DOTOQJQBSA-N	0	3	330.497	3.154	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)C23CC4CC(CC(C4)C2)C3)CC1	ZINC001016940081	1338776944	/nfs/dbraw/zinc/77/69/44/1338776944.db2.gz	MRRZCGCSKRSCIG-RQJZOYDLSA-N	0	3	340.511	3.197	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)CC2C3CC4CC(C3)CC2C4)CC1	ZINC001016979531	1338790723	/nfs/dbraw/zinc/79/07/23/1338790723.db2.gz	AWXGTLIKMTWCTE-NSDIEPNESA-N	0	3	340.511	3.053	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001017032724	1338823674	/nfs/dbraw/zinc/82/36/74/1338823674.db2.gz	YKEMGPMALIFJJQ-OAHLLOKOSA-N	0	3	331.485	3.256	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCCN(C(=O)CCC2CC2)C1	ZINC001017080734	1338852134	/nfs/dbraw/zinc/85/21/34/1338852134.db2.gz	GZZUUDJJNDUQNO-INIZCTEOSA-N	0	3	345.512	3.480	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H](CN(C)Cc2ccc(C#N)s2)C1)C1CC1	ZINC001017087635	1338855686	/nfs/dbraw/zinc/85/56/86/1338855686.db2.gz	NOCNUZWRSKCPQM-GJZGRUSLSA-N	0	3	345.512	3.336	20	30		EGEDHN
CC[C@H](F)C(=O)N1CCC[C@@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001017183109	1338928059	/nfs/dbraw/zinc/92/80/59/1338928059.db2.gz	BIZVISXTEUURER-BBRMVZONSA-N	0	3	337.464	3.038	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H](CN(C)[C@@H](C)c3cnccn3)C2)C1	ZINC001017208671	1338954781	/nfs/dbraw/zinc/95/47/81/1338954781.db2.gz	UBNOKMVXQGBNEO-IRXDYDNUSA-N	0	3	342.487	3.064	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@H]1CCCC1(F)F	ZINC001017851377	1339430451	/nfs/dbraw/zinc/43/04/51/1339430451.db2.gz	TZSYVBSSLACCGI-OAGGEKHMSA-N	0	3	326.431	3.453	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccc(OC(C)C)c1	ZINC001018327207	1339578956	/nfs/dbraw/zinc/57/89/56/1339578956.db2.gz	RWJSOLPGKYCAEV-KDURUIRLSA-N	0	3	342.483	3.268	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](OC)c1ccc(F)cc1	ZINC001018327860	1339579350	/nfs/dbraw/zinc/57/93/50/1339579350.db2.gz	ZJPBPLAKXWGDFG-CEXWTWQISA-N	0	3	346.446	3.155	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1cc(F)c2ncccc2c1	ZINC001028204414	1340482769	/nfs/dbraw/zinc/48/27/69/1340482769.db2.gz	UJWZDTGHVAVNTA-INIZCTEOSA-N	0	3	327.403	3.144	20	30		EGEDHN
C#CCCN1CCC[C@@H]1CNC(=O)c1ccc(O[C@@H](C)CC)cc1	ZINC001028247073	1340508336	/nfs/dbraw/zinc/50/83/36/1340508336.db2.gz	GEAQZHNJMMNSKH-FUHWJXTLSA-N	0	3	328.456	3.081	20	30		EGEDHN
C#CCCN1CCC[C@H]1CNC(=O)c1csc2c1CC[C@@H](C)C2	ZINC001028300918	1340549432	/nfs/dbraw/zinc/54/94/32/1340549432.db2.gz	KBFKJLNYBCAZBY-CABCVRRESA-N	0	3	330.497	3.090	20	30		EGEDHN
C#CCCN1CCC[C@@H]1CNC(=O)c1csc2c1CC[C@H](C)C2	ZINC001028300921	1340549590	/nfs/dbraw/zinc/54/95/90/1340549590.db2.gz	KBFKJLNYBCAZBY-LSDHHAIUSA-N	0	3	330.497	3.090	20	30		EGEDHN
Cc1sccc1C(=O)NC[C@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC001028531300	1340690097	/nfs/dbraw/zinc/69/00/97/1340690097.db2.gz	FJXSREVOUJIXKK-QGZVFWFLSA-N	0	3	339.464	3.180	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H](CNC(=O)C34CCC(CC3)C4)C2)c1	ZINC001028631592	1340734729	/nfs/dbraw/zinc/73/47/29/1340734729.db2.gz	LRRXAOHWOVXENX-IPFXWSOASA-N	0	3	337.467	3.077	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](CNC(=O)C34CCC(CC3)C4)C2)cc1	ZINC001028634324	1340736852	/nfs/dbraw/zinc/73/68/52/1340736852.db2.gz	ZVXIJCHEICSXBX-BSLVTKGXSA-N	0	3	337.467	3.077	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](CNC(=O)c3ccoc3C3CC3)C2)cc1	ZINC001028762290	1340797854	/nfs/dbraw/zinc/79/78/54/1340797854.db2.gz	IVJDNJLGUTYFBZ-KRWDZBQOSA-N	0	3	349.434	3.281	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CCN(CCc3csc(C)n3)C2)CC1	ZINC001028780825	1340812584	/nfs/dbraw/zinc/81/25/84/1340812584.db2.gz	NILNYIUXJBILQD-INIZCTEOSA-N	0	3	347.528	3.179	20	30		EGEDHN
Cc1cccc(C)c1C(=O)NC[C@H]1CCN(Cc2ccc(C#N)cc2)C1	ZINC001028821297	1340835176	/nfs/dbraw/zinc/83/51/76/1340835176.db2.gz	RWUHJUXDLNCOAY-HXUWFJFHSA-N	0	3	347.462	3.427	20	30		EGEDHN
Cc1cc(C(=O)NC[C@H]2CCN(Cc3cccc(C#N)c3)C2)cs1	ZINC001028865820	1340867916	/nfs/dbraw/zinc/86/79/16/1340867916.db2.gz	AXIWXUMVHPAXEV-QGZVFWFLSA-N	0	3	339.464	3.180	20	30		EGEDHN
Cc1ccc(C)c(C(=O)NC[C@@H]2CCN(Cc3ccc(C#N)cc3)C2)c1	ZINC001028951182	1340892579	/nfs/dbraw/zinc/89/25/79/1340892579.db2.gz	ACMKUEJZZRESNG-FQEVSTJZSA-N	0	3	347.462	3.427	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)c2ccc(-c3cccs3)o2)C1	ZINC001028963364	1340894465	/nfs/dbraw/zinc/89/44/65/1340894465.db2.gz	MMVGWXDQUYJSRA-AWEZNQCLSA-N	0	3	328.437	3.083	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H](CNC(=O)c3ccc(F)s3)C2)c1	ZINC001029016427	1340910576	/nfs/dbraw/zinc/91/05/76/1340910576.db2.gz	XHFRNCFWCXKONX-OAHLLOKOSA-N	0	3	343.427	3.011	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC([C@H](C)NCc2cnc(C)o2)CC1	ZINC001029125643	1340936088	/nfs/dbraw/zinc/93/60/88/1340936088.db2.gz	FTWWVQYZESCLRN-AWEZNQCLSA-N	0	3	333.476	3.302	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC([C@H](C)NCc3ocnc3C)CC2)CC1	ZINC001029136773	1340939749	/nfs/dbraw/zinc/93/97/49/1340939749.db2.gz	LNVSHDDLTYHCPP-HNNXBMFYSA-N	0	3	345.487	3.446	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1C[C@H]2CC[C@@H](C1)N2CC[C@@H](C)F	ZINC001029364903	1340978267	/nfs/dbraw/zinc/97/82/67/1340978267.db2.gz	POSNNXMVCSWWKV-ZACQAIPSSA-N	0	3	346.446	3.288	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CC[C@@H](C1)N2CC1CC(OCC)C1	ZINC001029420348	1340986378	/nfs/dbraw/zinc/98/63/78/1340986378.db2.gz	YYIDLTAXVDBGHY-ZTOOSOLZSA-N	0	3	334.504	3.079	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@@H](CN(C)Cc3ccc(C#N)s3)C2)co1	ZINC001029716895	1341053443	/nfs/dbraw/zinc/05/34/43/1341053443.db2.gz	GUUGZHKVHXNOCC-AWEZNQCLSA-N	0	3	343.452	3.115	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](CN(C)Cc2cncc(C)c2)C1	ZINC001029797990	1341076380	/nfs/dbraw/zinc/07/63/80/1341076380.db2.gz	DHEMEAFBUZHVMS-KRWDZBQOSA-N	0	3	329.488	3.273	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](CN(C)Cc2cnn(C(C)(C)C)c2)C1	ZINC001029802821	1341078186	/nfs/dbraw/zinc/07/81/86/1341078186.db2.gz	FFVJIMIAOVTUDB-INIZCTEOSA-N	0	3	346.519	3.131	20	30		EGEDHN
C#CCCN1CCC[C@H](N(Cc2ccccc2)C(=O)c2cc[nH]c2)C1	ZINC001029920367	1341119863	/nfs/dbraw/zinc/11/98/63/1341119863.db2.gz	VQMHGQSPSPZPJS-FQEVSTJZSA-N	0	3	335.451	3.145	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)CC1CCN(C(=O)/C=C/C2CC2)CC1	ZINC001029950126	1341131708	/nfs/dbraw/zinc/13/17/08/1341131708.db2.gz	JBDJIPKQFXJGCP-QPJJXVBHSA-N	0	3	343.496	3.256	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NCC1CN([C@H](C)c2ccccc2C)C1	ZINC001031680283	1341387212	/nfs/dbraw/zinc/38/72/12/1341387212.db2.gz	ZFCGIVFPCSVWLP-AHRSYUTCSA-N	0	3	342.483	3.085	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cccc([C@@H]2CCOC2)c1	ZINC001032485179	1341521478	/nfs/dbraw/zinc/52/14/78/1341521478.db2.gz	DFVXUSQWBZUDAO-AABGKKOBSA-N	0	3	340.467	3.055	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)CCc1ccc(C)c(Cl)c1	ZINC001032544662	1341536709	/nfs/dbraw/zinc/53/67/09/1341536709.db2.gz	DJCZREIWEXFEOJ-IRXDYDNUSA-N	0	3	332.875	3.442	20	30		EGEDHN
C#Cc1ccc(C(=O)N2C[C@@H]3C[C@H]2CN3CC2CC3(CCC3)C2)cc1	ZINC001032555281	1341539275	/nfs/dbraw/zinc/53/92/75/1341539275.db2.gz	GWMFFAARSHRTMT-PMACEKPBSA-N	0	3	334.463	3.147	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1nsc2ccc(C)cc21	ZINC001032558873	1341540097	/nfs/dbraw/zinc/54/00/97/1341540097.db2.gz	MWEZNBWHOCASQO-GJZGRUSLSA-N	0	3	341.480	3.470	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(O[C@H](C)CC)cc1	ZINC001032717896	1341590247	/nfs/dbraw/zinc/59/02/47/1341590247.db2.gz	YKSFOMQUUKOTFF-NJAFHUGGSA-N	0	3	328.456	3.339	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(OCC2CC2)cc1	ZINC001032789331	1341613833	/nfs/dbraw/zinc/61/38/33/1341613833.db2.gz	MACQEVGVBWCSHY-OALUTQOASA-N	0	3	340.467	3.340	20	30		EGEDHN
C#CCCN1CC[C@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccc(Cl)s2)C1	ZINC001033365137	1341797138	/nfs/dbraw/zinc/79/71/38/1341797138.db2.gz	LKCPWTCPJBIMBO-BFHYXJOUSA-N	0	3	336.888	3.061	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N(C)[C@H]1CCN(Cc2cccc(C)c2)C1	ZINC001033498129	1341847644	/nfs/dbraw/zinc/84/76/44/1341847644.db2.gz	TWCFJKDVSARADP-UFYCRDLUSA-N	0	3	342.483	3.009	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2c[nH]nc2C2CCCCC2)C1	ZINC001033570237	1341878503	/nfs/dbraw/zinc/87/85/03/1341878503.db2.gz	GLBMYBGBBALSSY-MRXNPFEDSA-N	0	3	330.476	3.180	20	30		EGEDHN
C=CCCN1CC[C@@H](N(C)C(=O)c2cnc(-c3ccco3)s2)C1	ZINC001033600064	1341891195	/nfs/dbraw/zinc/89/11/95/1341891195.db2.gz	XQJIRMUODOPFOP-CYBMUJFWSA-N	0	3	331.441	3.126	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N(C)[C@H]1CCN(Cc2ccc(C)cc2)C1	ZINC001033615887	1341903868	/nfs/dbraw/zinc/90/38/68/1341903868.db2.gz	CPSVTYKBCIQEEK-QFIPXVFZSA-N	0	3	346.474	3.252	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)Cc2ccc(OC(C)C)cc2)C1	ZINC001033678706	1341946143	/nfs/dbraw/zinc/94/61/43/1341946143.db2.gz	MMYLERJIHAITSP-GOSISDBHSA-N	0	3	330.472	3.125	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@H]2CCc3ccc(OC)cc32)C1	ZINC001033860647	1342048594	/nfs/dbraw/zinc/04/85/94/1342048594.db2.gz	GLRKMVHOBUWZGM-HKUYNNGSSA-N	0	3	342.483	3.224	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cc3ccccc3[nH]c2=O)C1	ZINC001033917490	1342086641	/nfs/dbraw/zinc/08/66/41/1342086641.db2.gz	ZEQLMCXSCICHKF-INIZCTEOSA-N	0	3	339.439	3.053	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N(CC)[C@@H]1CCN(Cc2ccc(C)cc2)C1	ZINC001033960475	1342113679	/nfs/dbraw/zinc/11/36/79/1342113679.db2.gz	VFHGTUDDBDCKAQ-AQNXPRMDSA-N	0	3	342.483	3.009	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cc(F)c3ncccc3c2)C1	ZINC001033988029	1342131819	/nfs/dbraw/zinc/13/18/19/1342131819.db2.gz	GBJKNCYBUFVTDO-QGZVFWFLSA-N	0	3	341.430	3.486	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3csc4cc(C)ccc43)[C@@H]2C1	ZINC001075833524	1356431700	/nfs/dbraw/zinc/43/17/00/1356431700.db2.gz	WWZWUIQOCLZQGM-MAUKXSAKSA-N	0	3	338.476	3.379	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2cc(C)n(C(C)C)c2C)C1	ZINC001034035012	1342173936	/nfs/dbraw/zinc/17/39/36/1342173936.db2.gz	OMJIZWQOLVTGSD-SFHVURJKSA-N	0	3	329.488	3.246	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cc3c(cccc3OC)[nH]2)C1	ZINC001034037900	1342178657	/nfs/dbraw/zinc/17/86/57/1342178657.db2.gz	MXSKSXJRRVZAMW-OAHLLOKOSA-N	0	3	341.455	3.289	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccc(OC)c(Cl)c2)C1	ZINC001034040047	1342180445	/nfs/dbraw/zinc/18/04/45/1342180445.db2.gz	QSURRUSESKACLL-OAHLLOKOSA-N	0	3	336.863	3.461	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3coc4cc(F)ccc43)[C@@H]2C1	ZINC001075972783	1356459389	/nfs/dbraw/zinc/45/93/89/1356459389.db2.gz	JKJIMNDZGCQGJY-SUMWQHHRSA-N	0	3	328.387	3.294	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)Cc2coc3cc(F)ccc23)C1	ZINC001034200879	1342311238	/nfs/dbraw/zinc/31/12/38/1342311238.db2.gz	SSODBNQRMBLLTM-INIZCTEOSA-N	0	3	330.403	3.271	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cn(-c3ccccc3)cn2)C1	ZINC001034218245	1342324065	/nfs/dbraw/zinc/32/40/65/1342324065.db2.gz	XZVRMVDBWHFGSF-KRWDZBQOSA-N	0	3	338.455	3.033	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2cc3ccccc3nc2C)C1	ZINC001034228109	1342332040	/nfs/dbraw/zinc/33/20/40/1342332040.db2.gz	AGWSOBLMFJWHAY-GOSISDBHSA-N	0	3	335.451	3.151	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc(OC(C)C)nc2)C1	ZINC001034230345	1342334774	/nfs/dbraw/zinc/33/47/74/1342334774.db2.gz	DBVBZMOPJHPRJK-KRWDZBQOSA-N	0	3	331.460	3.029	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2c(Cl)n[nH]c2C2CC2)C1	ZINC001034240813	1342341001	/nfs/dbraw/zinc/34/10/01/1342341001.db2.gz	MFNQLLNTOHOTES-CYBMUJFWSA-N	0	3	336.867	3.101	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)C2CCc3ccccc3CC2)C1	ZINC001034278355	1342368929	/nfs/dbraw/zinc/36/89/29/1342368929.db2.gz	HQGIZSXTWZAAPN-FQEVSTJZSA-N	0	3	326.484	3.338	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2csc(C(F)(F)F)c2)C1	ZINC001034290893	1342376386	/nfs/dbraw/zinc/37/63/86/1342376386.db2.gz	NSJVFQLEZRZVFD-CYBMUJFWSA-N	0	3	344.402	3.375	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2[nH]c3ccccc3c2Cl)C1	ZINC001034293204	1342376726	/nfs/dbraw/zinc/37/67/26/1342376726.db2.gz	MFFGXBSMWKXRCZ-AWEZNQCLSA-N	0	3	343.858	3.429	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cc(-c3ccco3)on2)C1	ZINC001034338286	1342412611	/nfs/dbraw/zinc/41/26/11/1342412611.db2.gz	VWCJPDYURFZQCB-CQSZACIVSA-N	0	3	329.400	3.095	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)[C@@]2(C)CCCc3ccccc32)C1	ZINC001034441659	1342503530	/nfs/dbraw/zinc/50/35/30/1342503530.db2.gz	GYDSEDLCISPYOF-RXVVDRJESA-N	0	3	326.484	3.437	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cccc(OC(C)C)n2)C1	ZINC001034462758	1342518609	/nfs/dbraw/zinc/51/86/09/1342518609.db2.gz	MKCQMWCJKMYSOY-MRXNPFEDSA-N	0	3	331.460	3.029	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)c2ccc3nc(C)sc3c2)C1	ZINC001034471158	1342526055	/nfs/dbraw/zinc/52/60/55/1342526055.db2.gz	FKDIMJOEPAZGBO-HNNXBMFYSA-N	0	3	329.469	3.375	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)C2(c3ccccc3F)CC2)C1	ZINC001034474841	1342530014	/nfs/dbraw/zinc/53/00/14/1342530014.db2.gz	MVYZIACRWJUWSE-INIZCTEOSA-N	0	3	330.447	3.404	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2ccccc2C(F)(F)F)C1	ZINC001034498412	1342555339	/nfs/dbraw/zinc/55/53/39/1342555339.db2.gz	MJFWWNIAPJJHCM-AWEZNQCLSA-N	0	3	338.373	3.313	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cnn(C(C)(C)C)c2CC)C1	ZINC001034534279	1342590076	/nfs/dbraw/zinc/59/00/76/1342590076.db2.gz	FITOBOHYIYLRLG-MRXNPFEDSA-N	0	3	346.519	3.361	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)c2cocc2C)CC1	ZINC001034709125	1342704946	/nfs/dbraw/zinc/70/49/46/1342704946.db2.gz	WQVYEWKDPBZBHW-JOCQHMNTSA-N	0	3	341.249	3.127	20	30		EGEDHN
CCC(CC)C(=O)N1CCC[C@@H]1CNCc1cc(C#N)ccc1OC	ZINC001034869035	1342814109	/nfs/dbraw/zinc/81/41/09/1342814109.db2.gz	MJNXYROIHGBHMR-GOSISDBHSA-N	0	3	343.471	3.084	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC[C@@H]1CNCc1c(Cl)oc2ccccc21	ZINC001034886308	1342821435	/nfs/dbraw/zinc/82/14/35/1342821435.db2.gz	ISBSZGCULDVLBB-QWHCGFSZSA-N	0	3	345.830	3.326	20	30		EGEDHN
C[C@H](NC[C@H]1CCCN1C(=O)C#CC1CC1)c1cc(F)ccc1F	ZINC001034930158	1342840659	/nfs/dbraw/zinc/84/06/59/1342840659.db2.gz	KMEXHDBHTMJWAY-XJKSGUPXSA-N	0	3	332.394	3.020	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC[C@@H]1CNCc1cncc(C)c1	ZINC001034947727	1342848421	/nfs/dbraw/zinc/84/84/21/1342848421.db2.gz	XFNLJXQFMUTIAE-MRXNPFEDSA-N	0	3	335.879	3.249	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]1CNCc1cccc(Cl)n1	ZINC001035011551	1342874752	/nfs/dbraw/zinc/87/47/52/1342874752.db2.gz	DXDWWHHMNDGSRE-OAHLLOKOSA-N	0	3	335.879	3.418	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC3(CCN(Cc4conc4C)C3)CC2)C1	ZINC001035227735	1343049559	/nfs/dbraw/zinc/04/95/59/1343049559.db2.gz	TUUVHGJUPRTREN-UHFFFAOYSA-N	0	3	343.471	3.154	20	30		EGEDHN
CC(C)c1ccc(CN2CC3(C2)CCN(C(=O)[C@H](C)C#N)CC3)cc1	ZINC001035672852	1343131819	/nfs/dbraw/zinc/13/18/19/1343131819.db2.gz	JSZXOAHABIQFLX-QGZVFWFLSA-N	0	3	339.483	3.394	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)CO[C@H]1CCCC[C@H]1CC)CC2	ZINC001035704185	1343143728	/nfs/dbraw/zinc/14/37/28/1343143728.db2.gz	ZDRXMNAACFGGBK-MOPGFXCFSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc(C(C)(C)C)cn1)CC2	ZINC001035707353	1343144222	/nfs/dbraw/zinc/14/42/22/1343144222.db2.gz	HJTUOHXATOMSIL-UHFFFAOYSA-N	0	3	341.499	3.493	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc(F)c(COC)c1)CC2	ZINC001035790028	1343201333	/nfs/dbraw/zinc/20/13/33/1343201333.db2.gz	HQNUOACQLDNDGS-UHFFFAOYSA-N	0	3	346.446	3.086	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H]1[C@@H]3Cc4ccccc4[C@@H]31)CC2	ZINC001035814358	1343212447	/nfs/dbraw/zinc/21/24/47/1343212447.db2.gz	MZTLVKBAGXUZMI-HSALFYBXSA-N	0	3	336.479	3.073	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C[C@H]1CCO[C@H](CC)C1)CC2	ZINC001035832664	1343220140	/nfs/dbraw/zinc/22/01/40/1343220140.db2.gz	NTOZVELVYQSGEP-ZWKOTPCHSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C[C@@H]1CCO[C@H](CC)C1)CC2	ZINC001035832662	1343220248	/nfs/dbraw/zinc/22/02/48/1343220248.db2.gz	NTOZVELVYQSGEP-QZTJIDSGSA-N	0	3	334.504	3.082	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cc(C)c(F)cc1Cl)CC2	ZINC001035842731	1343224973	/nfs/dbraw/zinc/22/49/73/1343224973.db2.gz	AVUCSLQBMXVSAE-UHFFFAOYSA-N	0	3	348.849	3.349	20	30		EGEDHN
C[C@H]1CN(C(=O)C2=CCCC2)CC[C@H]1NCc1cc(F)ccc1C#N	ZINC001035994795	1343305545	/nfs/dbraw/zinc/30/55/45/1343305545.db2.gz	ZDZLKQZTNXFENQ-IFXJQAMLSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H](NCc2cc(C)no2)[C@H](C)C1	ZINC001036041939	1343309692	/nfs/dbraw/zinc/30/96/92/1343309692.db2.gz	HLTDZNHGFKVJLC-IAQYHMDHSA-N	0	3	339.867	3.088	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2(C)CCC2)CC[C@H]1NCc1cc(F)ccc1C#N	ZINC001036139856	1343324156	/nfs/dbraw/zinc/32/41/56/1343324156.db2.gz	AWYMIEISUGIKNV-RDTXWAMCSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](NCc2cc(F)ccc2C#N)[C@@H](C)C1	ZINC001036140980	1343325455	/nfs/dbraw/zinc/32/54/55/1343325455.db2.gz	FJJXFEXHDLLHOZ-KSSFIOAISA-N	0	3	343.446	3.236	20	30		EGEDHN
C[C@@H]1CN(C(=O)C(C)(C)C2CC2)CC[C@H]1NCc1ccccc1C#N	ZINC001036143294	1343325996	/nfs/dbraw/zinc/32/59/96/1343325996.db2.gz	BOJFHINWFCCBKS-DNVCBOLYSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](NCc2ccccc2C#N)[C@H](C)C1	ZINC001036144942	1343327436	/nfs/dbraw/zinc/32/74/36/1343327436.db2.gz	VVMCVJSDTCAERI-QAPCUYQASA-N	0	3	325.456	3.097	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3cscn3)[C@@H](C)C2)CC1	ZINC001036163561	1343338479	/nfs/dbraw/zinc/33/84/79/1343338479.db2.gz	LMCXORQTBDKWQC-YOEHRIQHSA-N	0	3	333.501	3.216	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](NCc3ncc(C)s3)[C@@H](C)C2)C1	ZINC001036168668	1343341872	/nfs/dbraw/zinc/34/18/72/1343341872.db2.gz	JJZTUDFSJLCMKN-ZFWWWQNUSA-N	0	3	333.501	3.134	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@H]([C@H](C)NCc2ccccc2C#N)C1	ZINC001036343937	1343430473	/nfs/dbraw/zinc/43/04/73/1343430473.db2.gz	JKRVZCFGFLPTPH-LPHOPBHVSA-N	0	3	327.472	3.321	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@H]([C@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001036354516	1343437562	/nfs/dbraw/zinc/43/75/62/1343437562.db2.gz	YMLKRTIRTBADJW-HOCLYGCPSA-N	0	3	331.435	3.070	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCCN(C(=O)C2=CCCC2)C1	ZINC001036389127	1343459621	/nfs/dbraw/zinc/45/96/21/1343459621.db2.gz	QVPQCULSLXNPKL-JXFKEZNVSA-N	0	3	337.467	3.385	20	30		EGEDHN
C[C@@H](NCc1c(F)cccc1F)[C@@H]1CCCN(C(=O)C#CC2CC2)C1	ZINC001036405035	1343467376	/nfs/dbraw/zinc/46/73/76/1343467376.db2.gz	OOPSREWYCFRNMH-GDBMZVCRSA-N	0	3	346.421	3.095	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCCN(C(=O)CC(C)(F)F)C1	ZINC001036437873	1343487158	/nfs/dbraw/zinc/48/71/58/1343487158.db2.gz	JJVJVQYVECNVON-RHSMWYFYSA-N	0	3	349.425	3.320	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)C2CCC2)[C@@H]1CNCc1cc(C#N)ccc1F	ZINC001036487642	1343510641	/nfs/dbraw/zinc/51/06/41/1343510641.db2.gz	NCBBOSYCODVWNP-AUUYWEPGSA-N	0	3	343.446	3.214	20	30		EGEDHN
CCCC(=O)N1CCC[C@@H](C)[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001036492076	1343514989	/nfs/dbraw/zinc/51/49/89/1343514989.db2.gz	BMAIQOSVJLITIY-KDOFPFPSSA-N	0	3	331.435	3.214	20	30		EGEDHN
C[C@H]1CCCN(C(=O)c2ccoc2)[C@@H]1CNCc1ccc(C#N)s1	ZINC001036501825	1343520208	/nfs/dbraw/zinc/52/02/08/1343520208.db2.gz	OGWCDHJSOJDXDL-SUMWQHHRSA-N	0	3	343.452	3.243	20	30		EGEDHN
O=C(C1CCCC1)N1CC[C@H]2[C@H](CCN2CC#Cc2ccccc2)C1	ZINC001036621545	1343580412	/nfs/dbraw/zinc/58/04/12/1343580412.db2.gz	VIQFXHSMMJHBNX-RTWAWAEBSA-N	0	3	336.479	3.151	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@H]2[C@H](CCN2Cc2ccc(C#N)c(F)c2)C1	ZINC001036631621	1343588976	/nfs/dbraw/zinc/58/89/76/1343588976.db2.gz	AKKIDKAIIPBJPD-MJGOQNOKSA-N	0	3	341.430	3.086	20	30		EGEDHN
Cc1ccoc1C(=O)N1CC[C@H]2[C@@H](CCN2CC#Cc2ccccc2)C1	ZINC001036648199	1343598762	/nfs/dbraw/zinc/59/87/62/1343598762.db2.gz	DJTLTGBKPUXHDY-PMACEKPBSA-N	0	3	348.446	3.176	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3CN(C(=O)CCC4CC4)CC[C@@H]32)s1	ZINC001036670502	1343613874	/nfs/dbraw/zinc/61/38/74/1343613874.db2.gz	VHIZOHPFLDXGOW-YJBOKZPZSA-N	0	3	343.496	3.233	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3CN(C(=O)CC4CCC4)CC[C@@H]32)s1	ZINC001036677822	1343618596	/nfs/dbraw/zinc/61/85/96/1343618596.db2.gz	IDNAMIOMRGOQGN-YJBOKZPZSA-N	0	3	343.496	3.233	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@@H]2CN(C(=O)CC3CCC3)CC[C@@H]21	ZINC001036678400	1343618620	/nfs/dbraw/zinc/61/86/20/1343618620.db2.gz	PXQUTVIDBSPAPY-UXHICEINSA-N	0	3	337.467	3.171	20	30		EGEDHN
C/C=C(/C)C(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccc(F)c(C#N)c2)C1	ZINC001036683466	1343626529	/nfs/dbraw/zinc/62/65/29/1343626529.db2.gz	SVBGGBZWYLDQSS-XBMWNUSXSA-N	0	3	341.430	3.086	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccccc2C#N)C1	ZINC001036789874	1343719776	/nfs/dbraw/zinc/71/97/76/1343719776.db2.gz	YXFLNTREQUBNNK-RTBURBONSA-N	0	3	337.467	3.193	20	30		EGEDHN
Cc1coc(C(=O)N2CC[C@H]3[C@H](CCN3CC#Cc3ccccc3)C2)c1	ZINC001036796748	1343730306	/nfs/dbraw/zinc/73/03/06/1343730306.db2.gz	IHMUQXQMEGKMMC-UXHICEINSA-N	0	3	348.446	3.176	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]3[C@@H](CCN3Cc3ccccc3C#N)C2)C1	ZINC001036815935	1343753589	/nfs/dbraw/zinc/75/35/89/1343753589.db2.gz	NEUMHVHEXKLPGQ-PMACEKPBSA-N	0	3	349.478	3.337	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCC[C@@H]1NC(=O)C1CCCC1	ZINC001036923039	1343866732	/nfs/dbraw/zinc/86/67/32/1343866732.db2.gz	ZLKOHELCWIRTMQ-MOPGFXCFSA-N	0	3	325.456	3.123	20	30		EGEDHN
Cc1coc(C(=O)N[C@H]2CCC[C@H]2CNCc2ccccc2C#N)c1	ZINC001037061021	1343956738	/nfs/dbraw/zinc/95/67/38/1343956738.db2.gz	WVPKRJSJUGXIGV-ROUUACIJSA-N	0	3	337.423	3.148	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCC[C@@H]1NC(=O)C1=CCCC1	ZINC001037199150	1344036789	/nfs/dbraw/zinc/03/67/89/1344036789.db2.gz	WNKQOVMSVKDOKX-UXHICEINSA-N	0	3	337.467	3.433	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCCC[C@@H]2CNCc2cc(C)no2)CC1	ZINC001037228239	1344057060	/nfs/dbraw/zinc/05/70/60/1344057060.db2.gz	ARQQNQRVOOXHOR-IEBWSBKVSA-N	0	3	345.487	3.494	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](NCc2cc(C)no2)[C@@H](CC)C1	ZINC001037907520	1344171285	/nfs/dbraw/zinc/17/12/85/1344171285.db2.gz	USHHZJJDLYWNII-DOTOQJQBSA-N	0	3	333.476	3.302	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](NCc3nccs3)[C@H](CC)C2)C1	ZINC001037914286	1344175033	/nfs/dbraw/zinc/17/50/33/1344175033.db2.gz	KMQUSRIRNNGQDI-CABCVRRESA-N	0	3	333.501	3.216	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](NCc3cscn3)[C@@H](CC)C2)C1	ZINC001037913960	1344175148	/nfs/dbraw/zinc/17/51/48/1344175148.db2.gz	IQBFEIZJNNHSMU-HOCLYGCPSA-N	0	3	333.501	3.216	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CCN2C[C@H](OC)C2CCCC2)CC1	ZINC001038667852	1344531724	/nfs/dbraw/zinc/53/17/24/1344531724.db2.gz	QBWHJXJTOKBTER-MOPGFXCFSA-N	0	3	334.504	3.129	20	30		EGEDHN
C#CCOc1ccc(C(=O)NC[C@H]2CCN2CCC2CCCC2)cc1	ZINC001038785374	1344583152	/nfs/dbraw/zinc/58/31/52/1344583152.db2.gz	ZVFSXGGTZHCNGB-LJQANCHMSA-N	0	3	340.467	3.083	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)c3cncc(C)c3)CC2)C1	ZINC001039114821	1344786721	/nfs/dbraw/zinc/78/67/21/1344786721.db2.gz	HRPXBUBNKYLECW-KRWDZBQOSA-N	0	3	347.890	3.317	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)/C=C\c3ccc[nH]3)CC2)C1	ZINC001039126763	1344803625	/nfs/dbraw/zinc/80/36/25/1344803625.db2.gz	IUEVSZPYRAXXEK-CHYADLBTSA-N	0	3	347.890	3.341	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)c3ccnc(C)c3)CC2)C1	ZINC001039171335	1344861427	/nfs/dbraw/zinc/86/14/27/1344861427.db2.gz	RNMQLWIPIHSGTP-GOSISDBHSA-N	0	3	347.890	3.317	20	30		EGEDHN
CCC(=O)N1CCCC[C@@H]1[C@H]1CCN(Cc2ccc(F)c(C#N)c2)C1	ZINC001039181178	1344878121	/nfs/dbraw/zinc/87/81/21/1344878121.db2.gz	SBXACWIOMZNROY-QFBILLFUSA-N	0	3	343.446	3.310	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc(C)cs2)C1	ZINC001039200772	1344910005	/nfs/dbraw/zinc/91/00/05/1344910005.db2.gz	RFYZPBBDGSEYTR-IAGOWNOFSA-N	0	3	330.497	3.396	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)CC2CC(F)(F)C2)C1	ZINC001039211976	1344926429	/nfs/dbraw/zinc/92/64/29/1344926429.db2.gz	HRNIJMMXVDNUEG-IAGOWNOFSA-N	0	3	338.442	3.148	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc(F)c(C)cc2F)C1	ZINC001039215595	1344931653	/nfs/dbraw/zinc/93/16/53/1344931653.db2.gz	VOGCHCCAAMHOAZ-DNVCBOLYSA-N	0	3	346.421	3.223	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc(F)ccc2CC)C1	ZINC001039220347	1344937835	/nfs/dbraw/zinc/93/78/35/1344937835.db2.gz	YGPVAJOKCBLAIR-YLJYHZDGSA-N	0	3	342.458	3.338	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2csc(Cl)c2)C1	ZINC001039229484	1344949425	/nfs/dbraw/zinc/94/94/25/1344949425.db2.gz	DTISLQWEUTZKQB-UKRRQHHQSA-N	0	3	336.888	3.351	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(F)cc2Cl)C1	ZINC001039241297	1344966506	/nfs/dbraw/zinc/96/65/06/1344966506.db2.gz	YXMGMXUTDOFOKG-RDTXWAMCSA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccoc2C2CC2)C1	ZINC001039242106	1344967779	/nfs/dbraw/zinc/96/77/79/1344967779.db2.gz	ADWJIXIEHZKEIU-IEBWSBKVSA-N	0	3	340.467	3.497	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc(C)c(F)c(C)c2)C1	ZINC001039244615	1344972933	/nfs/dbraw/zinc/97/29/33/1344972933.db2.gz	YGIXLWNYNLGECR-PKOBYXMFSA-N	0	3	342.458	3.392	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)Cc2c[nH]c3ccccc23)C1	ZINC001039246114	1344975567	/nfs/dbraw/zinc/97/55/67/1344975567.db2.gz	PEALFLQYSOTWGJ-LAUBAEHRSA-N	0	3	349.478	3.047	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccc3[nH]ccc3c2)C1	ZINC001039247251	1344977139	/nfs/dbraw/zinc/97/71/39/1344977139.db2.gz	XBJSKRGYLMOFJT-UYAOXDASSA-N	0	3	335.451	3.118	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)CCc2ccc(C)s2)C1	ZINC001039252819	1344984305	/nfs/dbraw/zinc/98/43/05/1344984305.db2.gz	PUZBRDBTWBDWDY-PKOBYXMFSA-N	0	3	344.524	3.325	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)Oc1ccccc1F	ZINC001039378768	1345034767	/nfs/dbraw/zinc/03/47/67/1345034767.db2.gz	HTZIHZGUQZQMBF-BBWFWOEESA-N	0	3	346.446	3.234	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)Oc1cccc(F)c1	ZINC001039378707	1345034904	/nfs/dbraw/zinc/03/49/04/1345034904.db2.gz	FJKUUHBFNVKWHS-NXHRZFHOSA-N	0	3	346.446	3.234	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(F)cc2ccoc21	ZINC001039396568	1345044563	/nfs/dbraw/zinc/04/45/63/1345044563.db2.gz	WVQRZUSMWCLOLW-SJORKVTESA-N	0	3	340.398	3.274	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(C)n([C@@H](C)CC)n1	ZINC001039398400	1345045880	/nfs/dbraw/zinc/04/58/80/1345045880.db2.gz	WHBCRVIWQQJFSW-JQHSSLGASA-N	0	3	344.503	3.418	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(-c2ccco2)o1	ZINC001039403297	1345048920	/nfs/dbraw/zinc/04/89/20/1345048920.db2.gz	OJSPUSWBPUQZCF-CVEARBPZSA-N	0	3	338.407	3.242	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1csc(C2CC2)n1	ZINC001039450113	1345073661	/nfs/dbraw/zinc/07/36/61/1345073661.db2.gz	KJOIUIXGTKXVDZ-SJORKVTESA-N	0	3	345.512	3.204	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1c[nH]c2cc(C)ccc12	ZINC001039451414	1345074699	/nfs/dbraw/zinc/07/46/99/1345074699.db2.gz	WAYMSTFPGGTTAV-MSOLQXFVSA-N	0	3	337.467	3.270	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(Cl)ccc1OC	ZINC001039465859	1345083413	/nfs/dbraw/zinc/08/34/13/1345083413.db2.gz	DMHQGGOJLWKINA-CVEARBPZSA-N	0	3	346.858	3.051	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)COc1ccc(C)cc1C	ZINC001039469246	1345086709	/nfs/dbraw/zinc/08/67/09/1345086709.db2.gz	CHAQKJBOQRUASA-MOPGFXCFSA-N	0	3	342.483	3.324	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)c1cccc(OC)c1	ZINC001039475023	1345089392	/nfs/dbraw/zinc/08/93/92/1345089392.db2.gz	ZMAXYMDSPGHUIY-UHOSZYNNSA-N	0	3	342.483	3.440	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(C)c2c1CCC2	ZINC001039475356	1345090330	/nfs/dbraw/zinc/09/03/30/1345090330.db2.gz	PPXHFRVBBNREGG-MSOLQXFVSA-N	0	3	336.479	3.186	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H]3CCC[C@@H](C2)N3CC2CCOCC2)CC1	ZINC001039887315	1345230655	/nfs/dbraw/zinc/23/06/55/1345230655.db2.gz	BDLQTVJMVRSCOL-BGYRXZFFSA-N	0	3	346.515	3.225	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC[C@@H]1CCCO1	ZINC001039897115	1345239784	/nfs/dbraw/zinc/23/97/84/1345239784.db2.gz	USZCSRYAGWBDGU-HLNWXESRSA-N	0	3	334.504	3.223	20	30		EGEDHN
CC(C)(F)C(=O)N1CC[C@@]2(C1)CCCN(Cc1cccc(C#N)c1)C2	ZINC001040037827	1345304561	/nfs/dbraw/zinc/30/45/61/1345304561.db2.gz	IFTUBAITBBCYPZ-FQEVSTJZSA-N	0	3	343.446	3.121	20	30		EGEDHN
Cc1ccc(F)cc1CN1CCC[C@@]2(CCN(C(=O)[C@H](C)C#N)C2)C1	ZINC001040121594	1345340176	/nfs/dbraw/zinc/34/01/76/1345340176.db2.gz	SOMLCRGPJONBBI-OXQOHEQNSA-N	0	3	343.446	3.108	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cccc(F)c3C)C2)C1	ZINC001040220848	1345380186	/nfs/dbraw/zinc/38/01/86/1345380186.db2.gz	MSLSTKPTQZKJEZ-HXUWFJFHSA-N	0	3	328.431	3.086	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3ccc4nccc(C)c4c3)C2)C1	ZINC001040220528	1345380680	/nfs/dbraw/zinc/38/06/80/1345380680.db2.gz	KCIAUINIUMPIJT-QFIPXVFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)C[C@@H]3CCC(F)(F)C3)C2)C1	ZINC001040233117	1345387667	/nfs/dbraw/zinc/38/76/67/1345387667.db2.gz	WTDNJGXEIJIPCU-WMZOPIPTSA-N	0	3	338.442	3.150	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cncc(Cl)c3C)C2)C1	ZINC001040253756	1345396948	/nfs/dbraw/zinc/39/69/48/1345396948.db2.gz	QYTVKYHKXYQEJC-GOSISDBHSA-N	0	3	333.863	3.158	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cccnc3C(F)F)C2)C1	ZINC001040292161	1345415891	/nfs/dbraw/zinc/41/58/91/1345415891.db2.gz	RGGQTLZBSFFWKN-SFHVURJKSA-N	0	3	335.398	3.133	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)CCc3ccc4[nH]ccc4c3)C2)C1	ZINC001040293629	1345416587	/nfs/dbraw/zinc/41/65/87/1345416587.db2.gz	XRDYTYWYXIRJAM-QFIPXVFZSA-N	0	3	349.478	3.048	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)CCc3ccc4[nH]ccc4c3)C2)C1	ZINC001040293628	1345416861	/nfs/dbraw/zinc/41/68/61/1345416861.db2.gz	XRDYTYWYXIRJAM-JOCHJYFZSA-N	0	3	349.478	3.048	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cccc4c3O[C@H](C)C4)C2)C1	ZINC001040301439	1345422437	/nfs/dbraw/zinc/42/24/37/1345422437.db2.gz	YJANBRIZANRKGZ-IERDGZPVSA-N	0	3	340.467	3.124	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)CCc3cccc(Cl)c3)C2)C1	ZINC001040315635	1345427152	/nfs/dbraw/zinc/42/71/52/1345427152.db2.gz	CFIGDOYAOGRTDN-FQEVSTJZSA-N	0	3	344.886	3.220	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3nccc4ccccc43)C2)C1	ZINC001040361188	1345454457	/nfs/dbraw/zinc/45/44/57/1345454457.db2.gz	QGHKZPLKSCBRFW-NRFANRHFSA-N	0	3	335.451	3.349	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@]3(C2)CCCN(Cc2ccccn2)C3)C1	ZINC001040379641	1345465689	/nfs/dbraw/zinc/46/56/89/1345465689.db2.gz	LXJRKXDOFGFTRZ-NRFANRHFSA-N	0	3	339.483	3.252	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3cc(F)ccc3Cl)C2)C1	ZINC001040417047	1345485221	/nfs/dbraw/zinc/48/52/21/1345485221.db2.gz	ABSWVHJGBKRCFY-SFHVURJKSA-N	0	3	334.822	3.040	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3ccc(C)c(F)c3F)C2)C1	ZINC001040416456	1345485316	/nfs/dbraw/zinc/48/53/16/1345485316.db2.gz	VRZXSWFLTJLAJU-IBGZPJMESA-N	0	3	334.410	3.387	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)C3CCC(F)(F)CC3)C2)C1	ZINC001040417092	1345485532	/nfs/dbraw/zinc/48/55/32/1345485532.db2.gz	BCKPGQXCGHGOHQ-GOSISDBHSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@H](C)Cc3cccs3)C2)C1	ZINC001040424249	1345490961	/nfs/dbraw/zinc/49/09/61/1345490961.db2.gz	YHLRCEYJZXKJDI-XLIONFOSSA-N	0	3	344.524	3.265	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@@H](F)c3ccccc3)C2)C1	ZINC001040425014	1345490996	/nfs/dbraw/zinc/49/09/96/1345490996.db2.gz	PGVIMOLJSDYEQO-ICSRJNTNSA-N	0	3	328.431	3.035	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@@H]3C[C@H]3c3ccccc3C)C2)C1	ZINC001040443669	1345503259	/nfs/dbraw/zinc/50/32/59/1345503259.db2.gz	KMNYXGAYHOBZCS-VWPQPMDRSA-N	0	3	336.479	3.046	20	30		EGEDHN
Fc1c(F)c(C(F)(F)F)c(F)c(F)c1O[C@@H]1CCNC[C@H]1F	ZINC001218064609	1373550957	/nfs/dbraw/zinc/55/09/57/1373550957.db2.gz	NPDGKSYDJDCJKS-RFZPGFLSSA-N	0	3	335.194	3.341	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ccc4cccnc4c3)C2)C1	ZINC001040456828	1345509269	/nfs/dbraw/zinc/50/92/69/1345509269.db2.gz	SEHAOJHPGYLLOQ-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ccc(F)cc3C)C2)C1	ZINC001040499703	1345521212	/nfs/dbraw/zinc/52/12/12/1345521212.db2.gz	FYYZGHQBOONRAI-FQEVSTJZSA-N	0	3	328.431	3.086	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)Cc3c[nH]c4ccccc34)C2)C1	ZINC001040504908	1345524320	/nfs/dbraw/zinc/52/43/20/1345524320.db2.gz	CDWRBSIINLZDLE-JOCHJYFZSA-N	0	3	349.478	3.048	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cccc4oc(C)nc43)C2)C1	ZINC001040546852	1345541448	/nfs/dbraw/zinc/54/14/48/1345541448.db2.gz	HNSKPZBTEHDKKN-FQEVSTJZSA-N	0	3	339.439	3.250	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3coc4cc(F)ccc34)C2)CC1	ZINC001040753518	1345574624	/nfs/dbraw/zinc/57/46/24/1345574624.db2.gz	AKTRUQYXZSCUKU-UHFFFAOYSA-N	0	3	340.398	3.133	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccc(F)c(Cl)c3)C2)CC1	ZINC001040825560	1345583459	/nfs/dbraw/zinc/58/34/59/1345583459.db2.gz	CLTVBOLGNKATRM-UHFFFAOYSA-N	0	3	348.849	3.431	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC2(C1)CCN(Cc1ocnc1C)CC2	ZINC001040836097	1345585854	/nfs/dbraw/zinc/58/58/54/1345585854.db2.gz	PYMFEWOMFUZFQF-IBGZPJMESA-N	0	3	345.487	3.400	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@@H]3CCCC(F)(F)C3)C2)CC1	ZINC001040846145	1345587010	/nfs/dbraw/zinc/58/70/10/1345587010.db2.gz	MZBJTURJAPGJID-MRXNPFEDSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cc(F)ccc3Cl)C2)CC1	ZINC001040861387	1345588994	/nfs/dbraw/zinc/58/89/94/1345588994.db2.gz	LTBAMQAJBRDMGP-UHFFFAOYSA-N	0	3	348.849	3.431	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cccc(F)c3Cl)C2)CC1	ZINC001040864965	1345589500	/nfs/dbraw/zinc/58/95/00/1345589500.db2.gz	MBOYJVKGBPKSIQ-UHFFFAOYSA-N	0	3	348.849	3.431	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@H](C)c3ccc(CC)cc3)C2)CC1	ZINC001040882390	1345593747	/nfs/dbraw/zinc/59/37/47/1345593747.db2.gz	AZGCQZAWIWOKEM-GOSISDBHSA-N	0	3	338.495	3.300	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cccc(C)c3Cl)C2)CC1	ZINC001040884984	1345594614	/nfs/dbraw/zinc/59/46/14/1345594614.db2.gz	GBAZNXCBFVLBHE-UHFFFAOYSA-N	0	3	330.859	3.210	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cccc4ccncc43)C2)CC1	ZINC001040901521	1345596312	/nfs/dbraw/zinc/59/63/12/1345596312.db2.gz	LYLKWKLQJXMIFJ-UHFFFAOYSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccc(F)cc3Cl)C2)CC1	ZINC001040928851	1345602943	/nfs/dbraw/zinc/60/29/43/1345602943.db2.gz	BCWPAVINLGESQT-UHFFFAOYSA-N	0	3	334.822	3.040	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)CCc3ccccc3Cl)C2)CC1	ZINC001040929830	1345603274	/nfs/dbraw/zinc/60/32/74/1345603274.db2.gz	DTVAQDUOXSXYPF-UHFFFAOYSA-N	0	3	344.886	3.220	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@]3(CCN(C(=O)C4CCCC4)C3)C2)cc1	ZINC001040994686	1345617902	/nfs/dbraw/zinc/61/79/02/1345617902.db2.gz	OTVRFQKKZWHIJW-NRFANRHFSA-N	0	3	337.467	3.173	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1)C1CC1	ZINC001041174041	1345666354	/nfs/dbraw/zinc/66/63/54/1345666354.db2.gz	NMGPFYPIUJCXFJ-IIBYNOLFSA-N	0	3	337.467	3.029	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3oc4c(cccc4F)c3C)C2)C1	ZINC001041354074	1345708605	/nfs/dbraw/zinc/70/86/05/1345708605.db2.gz	LWDMWONZMCBINI-HXUWFJFHSA-N	0	3	340.398	3.052	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3cc(C4CC4)oc3C3CC3)C2)C1	ZINC001041492889	1345743872	/nfs/dbraw/zinc/74/38/72/1345743872.db2.gz	SNTRIJLPKYZGRC-OAQYLSRUSA-N	0	3	338.451	3.206	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001041621827	1345798520	/nfs/dbraw/zinc/79/85/20/1345798520.db2.gz	FJONTQJALNBMGJ-OAQYLSRUSA-N	0	3	339.483	3.419	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@]3(CCN(Cc4cccnc4)C3)C2)CC1	ZINC001041635257	1345804791	/nfs/dbraw/zinc/80/47/91/1345804791.db2.gz	KLJXRWAAOYRMRN-NRFANRHFSA-N	0	3	339.483	3.252	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@]2(CCN(Cc3oc(C)nc3C)C2)C1	ZINC001041638088	1345805604	/nfs/dbraw/zinc/80/56/04/1345805604.db2.gz	HTSLPKMDBYXLPC-VQTJNVASSA-N	0	3	345.487	3.318	20	30		EGEDHN
CCC1(C(=O)N2CC[C@@]3(CCN(Cc4cccc(C#N)c4)C3)C2)CC1	ZINC001041642985	1345808368	/nfs/dbraw/zinc/80/83/68/1345808368.db2.gz	RLXBQLVCDOJVCB-HXUWFJFHSA-N	0	3	337.467	3.173	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cc(F)ccc3Cl)C2)C1	ZINC001041709288	1345825426	/nfs/dbraw/zinc/82/54/26/1345825426.db2.gz	URMKZGLHAXPKPP-SFHVURJKSA-N	0	3	334.822	3.040	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3ccc(Cl)c4occc43)C2)C1	ZINC001041784471	1345849219	/nfs/dbraw/zinc/84/92/19/1345849219.db2.gz	PRLSYFKAMMPBEZ-IBGZPJMESA-N	0	3	342.826	3.257	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cccc(C(F)F)c3)C2)C1	ZINC001041794105	1345852765	/nfs/dbraw/zinc/85/27/65/1345852765.db2.gz	QFNAFFHYVUJXFR-IBGZPJMESA-N	0	3	332.394	3.186	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccccc3OC(C)C)C2)C1	ZINC001041796095	1345852999	/nfs/dbraw/zinc/85/29/99/1345852999.db2.gz	FXIKDCZIZFGGAC-OAQYLSRUSA-N	0	3	340.467	3.035	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3c(F)cccc3Cl)C2)C1	ZINC001041798034	1345854128	/nfs/dbraw/zinc/85/41/28/1345854128.db2.gz	VTLSLWZPLBVNDD-SFHVURJKSA-N	0	3	334.822	3.040	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3CCN(C(=O)C=C4CCC4)C[C@H]32)c1	ZINC001042006895	1345922279	/nfs/dbraw/zinc/92/22/79/1345922279.db2.gz	RMLZGKUMVRDYCD-VQTJNVASSA-N	0	3	335.451	3.091	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cccc(C(F)F)c3F)C[C@@H]21	ZINC001042065325	1345933618	/nfs/dbraw/zinc/93/36/18/1345933618.db2.gz	RGLNXQWAWVYVRL-DOMZBBRYSA-N	0	3	338.373	3.486	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)COc3cccc(C(C)C)c3)C[C@H]21	ZINC001042074855	1345938033	/nfs/dbraw/zinc/93/80/33/1345938033.db2.gz	ZKJDWFQFCUSRNN-FXAWDEMLSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3c(C)noc3C(C)C)C[C@@H]21	ZINC001042100452	1345943815	/nfs/dbraw/zinc/94/38/15/1345943815.db2.gz	GCZJKPKJBJHKJE-CVEARBPZSA-N	0	3	331.460	3.219	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3c(C)noc3C(F)F)C[C@H]21	ZINC001042100456	1345944142	/nfs/dbraw/zinc/94/41/42/1345944142.db2.gz	GGRVVGHRLGVBSA-CHWSQXEVSA-N	0	3	339.386	3.033	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(C)cc(OC)c3C)C[C@@H]21	ZINC001042132586	1345951667	/nfs/dbraw/zinc/95/16/67/1345951667.db2.gz	DVXKTCUTTBQKIB-AEFFLSMTSA-N	0	3	328.456	3.034	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)Cc3c(C)cccc3Cl)C[C@@H]21	ZINC001042136637	1345953541	/nfs/dbraw/zinc/95/35/41/1345953541.db2.gz	VTDGIFIXPRJYRG-APWZRJJASA-N	0	3	344.886	3.137	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(C)c4cccnc34)C[C@H]21	ZINC001042155801	1345958571	/nfs/dbraw/zinc/95/85/71/1345958571.db2.gz	NARVCESKLJTYDZ-QFBILLFUSA-N	0	3	335.451	3.266	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)Cc3ccc(C4CCC4)cc3)C[C@@H]21	ZINC001042167425	1345963257	/nfs/dbraw/zinc/96/32/57/1345963257.db2.gz	LSDWOOHGKWJEMV-RTWAWAEBSA-N	0	3	336.479	3.053	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3cc4ncccc4s3)C[C@@H]21	ZINC001042185113	1345972742	/nfs/dbraw/zinc/97/27/42/1345972742.db2.gz	QCPODNSKAOTIIU-HOCLYGCPSA-N	0	3	341.480	3.409	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]2CCN(CCc3ccns3)[C@H]2C1	ZINC001042185575	1345972908	/nfs/dbraw/zinc/97/29/08/1345972908.db2.gz	VFDTTWVOAVAXEM-RDJZCZTQSA-N	0	3	347.528	3.211	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc(C)c(Cl)c3)C[C@@H]21	ZINC001042216011	1345989285	/nfs/dbraw/zinc/98/92/85/1345989285.db2.gz	KOORQGNOGHSGEY-QAPCUYQASA-N	0	3	330.859	3.208	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]3CCN(Cc4cccnc4C)[C@H]3C2)C1	ZINC001042224819	1345995077	/nfs/dbraw/zinc/99/50/77/1345995077.db2.gz	RLIFAOCRFUHDMT-MJGOQNOKSA-N	0	3	339.483	3.169	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)CC(C3CCC3)C3CCC3)C[C@H]21	ZINC001042237070	1345999160	/nfs/dbraw/zinc/99/91/60/1345999160.db2.gz	FQFSNBQGDJVTOF-UYAOXDASSA-N	0	3	328.500	3.149	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(C(C)C)nc3C)C[C@@H]21	ZINC001042238317	1345999757	/nfs/dbraw/zinc/99/97/57/1345999757.db2.gz	RSEAYRFEBBRANY-LPHOPBHVSA-N	0	3	327.472	3.236	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3ccc(C)c(F)c3F)C[C@H]21	ZINC001042240234	1346000659	/nfs/dbraw/zinc/00/06/59/1346000659.db2.gz	KOEAPGFQNNWBSP-GOEBONIOSA-N	0	3	334.410	3.386	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3sc(CC)nc3C)C[C@H]21	ZINC001042264637	1346010799	/nfs/dbraw/zinc/01/07/99/1346010799.db2.gz	CJDWUVPZDYNIIG-HUUCEWRRSA-N	0	3	333.501	3.126	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cc(Cl)ccc3C)C[C@@H]21	ZINC001042275153	1346015036	/nfs/dbraw/zinc/01/50/36/1346015036.db2.gz	RHAWJGVUVYTNHI-QAPCUYQASA-N	0	3	330.859	3.208	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc4nc(C)ccc4c3)C[C@H]21	ZINC001042278959	1346015589	/nfs/dbraw/zinc/01/55/89/1346015589.db2.gz	CIHXVUJDFDHYCZ-OXQOHEQNSA-N	0	3	335.451	3.266	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cccc4ccsc43)C[C@@H]21	ZINC001042301430	1346024455	/nfs/dbraw/zinc/02/44/55/1346024455.db2.gz	HZKCQWNBSQZFIF-QAPCUYQASA-N	0	3	338.476	3.461	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3c[nH]nc3C3CCCCC3)C[C@@H]21	ZINC001042310496	1346028017	/nfs/dbraw/zinc/02/80/17/1346028017.db2.gz	SZYKDZGKRQVGAM-QAPCUYQASA-N	0	3	342.487	3.180	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3sccc3COC)C[C@@H]21	ZINC001042311329	1346028305	/nfs/dbraw/zinc/02/83/05/1346028305.db2.gz	JDKSBCCYCLXPMF-ZBFHGGJFSA-N	0	3	334.485	3.007	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C34CC5CC(CC(C5)C3)C4)C[C@@H]21	ZINC001042325598	1346034473	/nfs/dbraw/zinc/03/44/73/1346034473.db2.gz	DQDBEJYYPSJWBE-VQIYKNCMSA-N	0	3	328.500	3.312	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)Cc3ccc4ccccc4c3)C[C@@H]21	ZINC001042349297	1346050272	/nfs/dbraw/zinc/05/02/72/1346050272.db2.gz	PMAFGMYTFFMICD-IRLDBZIGSA-N	0	3	346.474	3.328	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc4cccc(F)c4o3)C[C@@H]21	ZINC001042366956	1346058612	/nfs/dbraw/zinc/05/86/12/1346058612.db2.gz	YNQLAVZZDNIKJA-CJNGLKHVSA-N	0	3	328.387	3.294	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3csc(CC(C)C)n3)C[C@@H]21	ZINC001042372742	1346062217	/nfs/dbraw/zinc/06/22/17/1346062217.db2.gz	ATXWDNNHINEYNO-HOCLYGCPSA-N	0	3	333.501	3.064	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@H](NCc3ccccc3C#N)C[C@H]2C)cn1	ZINC001044472338	1346342898	/nfs/dbraw/zinc/34/28/98/1346342898.db2.gz	LHEILQDZYKJXOV-UZLBHIALSA-N	0	3	348.450	3.045	20	30		EGEDHN
C/C=C(/C)C(=O)N1CC[C@H](NCc2cc(F)ccc2C#N)C[C@H]1C	ZINC001044528521	1346358043	/nfs/dbraw/zinc/35/80/43/1346358043.db2.gz	AVLDQOYHTNVLPA-JPHOINKJSA-N	0	3	329.419	3.133	20	30		EGEDHN
C[C@H]1C[C@@H](NCc2cc(F)ccc2C#N)CCN1C(=O)C1=CCCC1	ZINC001044544783	1346365619	/nfs/dbraw/zinc/36/56/19/1346365619.db2.gz	VYOYXGDKQKVFBT-LIRRHRJNSA-N	0	3	341.430	3.277	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)C1CC(F)(F)C1	ZINC001044545464	1346366378	/nfs/dbraw/zinc/36/63/78/1346366378.db2.gz	QGSGYHOAJWNQOO-CXAGYDPISA-N	0	3	347.409	3.073	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)[C@H]1C[C@H]2C[C@H]2C1	ZINC001044711765	1346408171	/nfs/dbraw/zinc/40/81/71/1346408171.db2.gz	JVLJGLUUTNATII-JIKAWYKTSA-N	0	3	337.467	3.073	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)[C@H]2CC=CCC2)cc1F	ZINC001044919518	1346462624	/nfs/dbraw/zinc/46/26/24/1346462624.db2.gz	OUPCEVABXQHAFG-WMZOPIPTSA-N	0	3	341.430	3.134	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CCC[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC001044990814	1346476853	/nfs/dbraw/zinc/47/68/53/1346476853.db2.gz	SEFUNNHADQCQOL-HNNXBMFYSA-N	0	3	333.382	3.041	20	30		EGEDHN
Cc1cc(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)s2)oc1C	ZINC001044995736	1346477741	/nfs/dbraw/zinc/47/77/41/1346477741.db2.gz	ITAVTGUUFINIFY-AWEZNQCLSA-N	0	3	343.452	3.224	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H]1CNCc1cnn(C(C)(C)C)c1	ZINC001045148726	1346506069	/nfs/dbraw/zinc/50/60/69/1346506069.db2.gz	FZZJUIMIRGPFHN-KRWDZBQOSA-N	0	3	346.519	3.321	20	30		EGEDHN
CCC(C)(C)C(=O)N1CCC[C@H]1CNCc1cc(C#N)ccc1OC	ZINC001045178586	1346516349	/nfs/dbraw/zinc/51/63/49/1346516349.db2.gz	MNTCNMBPGCGPKU-KRWDZBQOSA-N	0	3	343.471	3.084	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)[C@]23C[C@H]2CCCC3)s1	ZINC001045190323	1346524220	/nfs/dbraw/zinc/52/42/20/1346524220.db2.gz	AYHOVDQRIJWUFW-ZRGWGRIASA-N	0	3	343.496	3.281	20	30		EGEDHN
CC1(NC(=O)[C@@H]2CC[C@H](F)C2)CCN(Cc2cccc(C#N)c2)CC1	ZINC001045536572	1346620857	/nfs/dbraw/zinc/62/08/57/1346620857.db2.gz	AOMVZIUCUIKLQY-MSOLQXFVSA-N	0	3	343.446	3.167	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)[C@@H]2C[C@H]2c2ccc(C)c(C)c2)CC1	ZINC001045580853	1346636154	/nfs/dbraw/zinc/63/61/54/1346636154.db2.gz	UGWLTSUADDYUHU-VQTJNVASSA-N	0	3	338.495	3.401	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2cccc(-c3cnco3)c2)CC1	ZINC001045606622	1346643891	/nfs/dbraw/zinc/64/38/91/1346643891.db2.gz	XWAYTZGXRJLSOC-UHFFFAOYSA-N	0	3	325.412	3.112	20	30		EGEDHN
CC[C@]1(C)C[C@@H]1C(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045607264	1346644422	/nfs/dbraw/zinc/64/44/22/1346644422.db2.gz	SECCLGMDPBASCK-UYAOXDASSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2ccc(N(CC)CC)cc2)CC1	ZINC001045627940	1346651938	/nfs/dbraw/zinc/65/19/38/1346651938.db2.gz	KVLWDOAODVRDLP-UHFFFAOYSA-N	0	3	329.488	3.303	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2ccc(COC(C)C)cc2)CC1	ZINC001045636295	1346654970	/nfs/dbraw/zinc/65/49/70/1346654970.db2.gz	OQPAEZCHEUJGHJ-UHFFFAOYSA-N	0	3	342.483	3.219	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1ccc(C#N)cc1	ZINC001045717782	1346678575	/nfs/dbraw/zinc/67/85/75/1346678575.db2.gz	BLXSQFGZVRABEO-LZQZEXGQSA-N	0	3	325.456	3.170	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2CC[C@@H](C1)N2CCc1ccns1	ZINC001045826099	1346710050	/nfs/dbraw/zinc/71/00/50/1346710050.db2.gz	QDOKODZXNNZZML-CVEARBPZSA-N	0	3	347.528	3.353	20	30		EGEDHN
C=CCC[N@H+]1CC[C@@]2(C1)CCCCN(C(=O)c1ccccc1[O-])C2	ZINC001045918957	1346755614	/nfs/dbraw/zinc/75/56/14/1346755614.db2.gz	OJEVKKTZYFWTBE-HXUWFJFHSA-N	0	3	328.456	3.287	20	30		EGEDHN
C=CCC[N@@H+]1CC[C@@]2(C1)CCCCN(C(=O)c1ccccc1[O-])C2	ZINC001045918957	1346755615	/nfs/dbraw/zinc/75/56/15/1346755615.db2.gz	OJEVKKTZYFWTBE-HXUWFJFHSA-N	0	3	328.456	3.287	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCCC[C@]2(CCN(Cc3ccc(F)cc3)C2)C1	ZINC001045925922	1346762007	/nfs/dbraw/zinc/76/20/07/1346762007.db2.gz	XNGKFDWXIWPJNO-OXJNMPFZSA-N	0	3	343.446	3.190	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cccc(F)c1C)C2	ZINC001045940159	1346775771	/nfs/dbraw/zinc/77/57/71/1346775771.db2.gz	RGHXPRVIGUBUQS-OAQYLSRUSA-N	0	3	342.458	3.476	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc3c(o1)CCCC3)C2	ZINC001045945109	1346780850	/nfs/dbraw/zinc/78/08/50/1346780850.db2.gz	UAZIJUPESQQCKP-OAQYLSRUSA-N	0	3	340.467	3.110	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc(OC)cs1)C2	ZINC001045956824	1346792141	/nfs/dbraw/zinc/79/21/41/1346792141.db2.gz	UESCHPQMBOKFAN-LJQANCHMSA-N	0	3	346.496	3.098	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc(F)ccc1C)C2	ZINC001045958660	1346793624	/nfs/dbraw/zinc/79/36/24/1346793624.db2.gz	VRGRHINMHXMKCV-OAQYLSRUSA-N	0	3	342.458	3.476	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@]2(CCN(Cc3conc3C)C2)C1	ZINC001045958913	1346794004	/nfs/dbraw/zinc/79/40/04/1346794004.db2.gz	ZMXSBRUXSQDDJP-HXUWFJFHSA-N	0	3	345.487	3.400	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)Cc1cc(C)ccc1C)C2	ZINC001045960655	1346795720	/nfs/dbraw/zinc/79/57/20/1346795720.db2.gz	PGEHBOBNNCYJHI-QFIPXVFZSA-N	0	3	338.495	3.184	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1coc(C(F)F)c1)C2	ZINC001045960842	1346796550	/nfs/dbraw/zinc/79/65/50/1346796550.db2.gz	UJTRTZSMFBMMGB-GOSISDBHSA-N	0	3	336.382	3.169	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc[nH]c1CCC)C2	ZINC001045962212	1346797411	/nfs/dbraw/zinc/79/74/11/1346797411.db2.gz	YUFBLUAUBRMACK-NRFANRHFSA-N	0	3	341.499	3.309	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@H](C)c1ccsc1)C2	ZINC001045964805	1346799565	/nfs/dbraw/zinc/79/95/65/1346799565.db2.gz	BRYASWOQYLZWAD-VQIMIIECSA-N	0	3	330.497	3.189	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc(C)cc(F)c1)C2	ZINC001045967945	1346802788	/nfs/dbraw/zinc/80/27/88/1346802788.db2.gz	FWMREDXRKCBUKW-HXUWFJFHSA-N	0	3	328.431	3.086	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc3cc[nH]c3c1)C2	ZINC001045968841	1346803684	/nfs/dbraw/zinc/80/36/84/1346803684.db2.gz	HXXPNLPTCIYJBN-OAQYLSRUSA-N	0	3	335.451	3.119	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)C1(C(F)(F)F)CC1)C2	ZINC001045970776	1346806594	/nfs/dbraw/zinc/80/65/94/1346806594.db2.gz	LEQPUZDREDQAKU-MRXNPFEDSA-N	0	3	342.405	3.057	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc(C)c(CC)o1)C2	ZINC001045979529	1346816761	/nfs/dbraw/zinc/81/67/61/1346816761.db2.gz	HDWRKISHKRZVNV-HXUWFJFHSA-N	0	3	328.456	3.102	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)Cc1ccc(C)c(C)c1)C2	ZINC001045982987	1346822534	/nfs/dbraw/zinc/82/25/34/1346822534.db2.gz	HNZAUZBTCOOMQZ-QFIPXVFZSA-N	0	3	338.495	3.184	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc3ccccc3o1)C2	ZINC001045984046	1346824897	/nfs/dbraw/zinc/82/48/97/1346824897.db2.gz	VTSUENNBCDLTJW-OAQYLSRUSA-N	0	3	336.435	3.384	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc(CF)cc1)C2	ZINC001045986867	1346828450	/nfs/dbraw/zinc/82/84/50/1346828450.db2.gz	CYBHLQFLFSGOHY-FQEVSTJZSA-N	0	3	328.431	3.108	20	30		EGEDHN
C#CCCN1CC[C@@](C)(NC(=O)c2cc3c(o2)c(F)ccc3C)C1	ZINC001046508884	1346998891	/nfs/dbraw/zinc/99/88/91/1346998891.db2.gz	ULQCBMXQGCEKQJ-LJQANCHMSA-N	0	3	328.387	3.098	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2F)C1	ZINC001046509595	1346999004	/nfs/dbraw/zinc/99/90/04/1346999004.db2.gz	ZNDBJCSUFYGRIN-FRQCXROJSA-N	0	3	334.410	3.225	20	30		EGEDHN
C#CCCN1CC[C@](C)(NC(=O)c2ccc(O[C@H](C)CC)cc2)C1	ZINC001046754290	1347085211	/nfs/dbraw/zinc/08/52/11/1347085211.db2.gz	NPMAWYRRPUSSRA-UZLBHIALSA-N	0	3	328.456	3.081	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2ccnc(O[C@@H](C)CC)c2)C1	ZINC001046760913	1347088642	/nfs/dbraw/zinc/08/86/42/1347088642.db2.gz	UJWYJPSFDLLTST-KXBFYZLASA-N	0	3	331.460	3.029	20	30		EGEDHN
C#CCCN1CC[C@@](C)(NC(=O)c2ccc(Cl)cc2Cl)C1	ZINC001046791576	1347104059	/nfs/dbraw/zinc/10/40/59/1347104059.db2.gz	JMLIUXXLPKOABW-MRXNPFEDSA-N	0	3	325.239	3.211	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2ccnc(C3CC3)c2)C1	ZINC001046953549	1347162308	/nfs/dbraw/zinc/16/23/08/1347162308.db2.gz	GHQQWCQDBVXGJF-MRXNPFEDSA-N	0	3	349.425	3.222	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2cc(F)cc(F)c2)C1	ZINC001046997257	1347180007	/nfs/dbraw/zinc/18/00/07/1347180007.db2.gz	YXMIRBVQOGHAHY-CYBMUJFWSA-N	0	3	344.352	3.228	20	30		EGEDHN
O=C(N[C@@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1cccc(Cl)c1)C2)C1CC1	ZINC001047007473	1347183870	/nfs/dbraw/zinc/18/38/70/1347183870.db2.gz	KPHKHBJTXVCINJ-IPELMVKDSA-N	0	3	342.870	3.071	20	30		EGEDHN
O=C(N[C@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1ccccc1)C2)C1=CCCC1	ZINC001047046091	1347195241	/nfs/dbraw/zinc/19/52/41/1347195241.db2.gz	DUZJHGWMJRYBBG-JBACZVJFSA-N	0	3	334.463	3.118	20	30		EGEDHN
CC1(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2C#N)C3)CCC1	ZINC001047127094	1347213876	/nfs/dbraw/zinc/21/38/76/1347213876.db2.gz	ICCVUPWYTGYMCK-IPELMVKDSA-N	0	3	337.467	3.218	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)CC3=CCCCC3)C2)CC1	ZINC001047230317	1347259471	/nfs/dbraw/zinc/25/94/71/1347259471.db2.gz	YOWZSKMJYMSJAC-FQEVSTJZSA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3ccsc3C)C2)CC1	ZINC001047240174	1347266180	/nfs/dbraw/zinc/26/61/80/1347266180.db2.gz	DFFNUWCLQGSDRP-KRWDZBQOSA-N	0	3	330.497	3.254	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)C[C@H]3C=CCCC3)C2)CC1	ZINC001047245602	1347271184	/nfs/dbraw/zinc/27/11/84/1347271184.db2.gz	ZSJGLAZPJANLPL-AZUAARDMSA-N	0	3	328.500	3.317	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3ccn4ccccc34)C2)CC1	ZINC001047249778	1347274082	/nfs/dbraw/zinc/27/40/82/1347274082.db2.gz	BVQXABKAWKLKBF-LJQANCHMSA-N	0	3	349.478	3.137	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)CC3CC(C)(C)C3)C2)CC1	ZINC001047250027	1347274800	/nfs/dbraw/zinc/27/48/00/1347274800.db2.gz	ZMMROCCTUWWPFW-IBGZPJMESA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)[C@@H](C)c3ccco3)C2)CC1	ZINC001047254707	1347278624	/nfs/dbraw/zinc/27/86/24/1347278624.db2.gz	QXUCPGWKWLQWAR-PKOBYXMFSA-N	0	3	342.483	3.357	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)[C@H](C)C(C)(F)F)C2)CC1	ZINC001047255550	1347279154	/nfs/dbraw/zinc/27/91/54/1347279154.db2.gz	ASOJEAGUJJWHJY-DOTOQJQBSA-N	0	3	340.458	3.252	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@@H]3CCC(C)(C)C3)C2)CC1	ZINC001047255167	1347279229	/nfs/dbraw/zinc/27/92/29/1347279229.db2.gz	WIULENAZDMMXCC-RTBURBONSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@@H]3CC34CCCC4)C2)CC1	ZINC001047262501	1347283679	/nfs/dbraw/zinc/28/36/79/1347283679.db2.gz	QXRSVDZYAMBTGQ-MOPGFXCFSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3cc4ccccc4[nH]3)C2)CC1	ZINC001047264736	1347286086	/nfs/dbraw/zinc/28/60/86/1347286086.db2.gz	NGCSIWMZIIDQHF-LJQANCHMSA-N	0	3	349.478	3.365	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)/C=C/c2ccco2)C1	ZINC001047689775	1347332301	/nfs/dbraw/zinc/33/23/01/1347332301.db2.gz	BNMFZGZLOHHZSS-XERWZBGXSA-N	0	3	349.434	3.191	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)/C=C\c2ccco2)C1	ZINC001047689772	1347332590	/nfs/dbraw/zinc/33/25/90/1347332590.db2.gz	BNMFZGZLOHHZSS-JCRZBSBLSA-N	0	3	349.434	3.191	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@H]([C@@H](C)NCc2nccs2)C1	ZINC001047852061	1347388898	/nfs/dbraw/zinc/38/88/98/1347388898.db2.gz	DHGFGHBYBSQUKC-YPMHNXCESA-N	0	3	341.908	3.248	20	30		EGEDHN
C[C@@H](NCc1cc(F)ccc1C#N)[C@H]1CCN(C(=O)CC2(C)CC2)C1	ZINC001047908022	1347405541	/nfs/dbraw/zinc/40/55/41/1347405541.db2.gz	HPHVIYRRAQZJJF-ZBFHGGJFSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]([C@@H](C)NCc2csc(C)n2)C1	ZINC001047924338	1347411194	/nfs/dbraw/zinc/41/11/94/1347411194.db2.gz	NFSBBCJARNZXDW-UKRRQHHQSA-N	0	3	335.517	3.380	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]([C@@H](C)NCc2ccn(C(C)C)n2)C1	ZINC001047924862	1347411834	/nfs/dbraw/zinc/41/18/34/1347411834.db2.gz	QZIRSZQTKWEDSG-SJORKVTESA-N	0	3	346.519	3.393	20	30		EGEDHN
CCC1(C(=O)N2CC[C@@H]([C@H](C)NCc3ccccc3C#N)C2)CCC1	ZINC001047935808	1347416025	/nfs/dbraw/zinc/41/60/25/1347416025.db2.gz	JGZKSMJEGRPYRN-QFBILLFUSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]([C@H](C)NCc3ccn(C(C)C)n3)C2)C1	ZINC001047966275	1347427298	/nfs/dbraw/zinc/42/72/98/1347427298.db2.gz	QYPCZWDWYBITLG-DLBZAZTESA-N	0	3	344.503	3.147	20	30		EGEDHN
C[C@H]1CN(C(=O)c2cccs2)C[C@@H]1CNCc1ccccc1C#N	ZINC001048118700	1347472676	/nfs/dbraw/zinc/47/26/76/1347472676.db2.gz	MUFVJEHQGKMURW-YOEHRIQHSA-N	0	3	339.464	3.118	20	30		EGEDHN
CCC(CC)C(=O)N1C[C@H](C)[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001048153596	1347482764	/nfs/dbraw/zinc/48/27/64/1347482764.db2.gz	VTEQUMYZWOKCNE-KBXCAEBGSA-N	0	3	345.462	3.318	20	30		EGEDHN
C[C@H]1CN(C(=O)C2(C)CCCC2)C[C@@H]1CNCc1ccccc1C#N	ZINC001048328638	1347519689	/nfs/dbraw/zinc/51/96/89/1347519689.db2.gz	NWEYNQIENMGODT-LPHOPBHVSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)[C@@H](CNCc2nc3ccccc3o2)C1	ZINC001048346508	1347525963	/nfs/dbraw/zinc/52/59/63/1347525963.db2.gz	YSZQNDJQDLIXBG-CABCVRRESA-N	0	3	341.455	3.224	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](C)[C@@H](CNCc3nc(C)sc3C)C2)C1	ZINC001048375503	1347535492	/nfs/dbraw/zinc/53/54/92/1347535492.db2.gz	YCJXAAQKIRBCKF-CJNGLKHVSA-N	0	3	347.528	3.300	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](C)[C@@H](CNCc3nc(C)c(C)s3)C2)C1	ZINC001048375388	1347535700	/nfs/dbraw/zinc/53/57/00/1347535700.db2.gz	XOXSEFMFXFPUBE-CJNGLKHVSA-N	0	3	347.528	3.300	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)[C@H]2CC[C@H](C)C2)CC1	ZINC001048626524	1347624528	/nfs/dbraw/zinc/62/45/28/1347624528.db2.gz	RRIKZJWFSDQVBF-ROUUACIJSA-N	0	3	341.499	3.497	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)[C@H]2[C@@H]3CCC[C@@H]32)cc1	ZINC001049400850	1347824474	/nfs/dbraw/zinc/82/44/74/1347824474.db2.gz	KBCQOEXXUAXAMG-XNTOXWQXSA-N	0	3	349.478	3.170	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1sc(C2CC2)nc1C	ZINC001049475120	1347866580	/nfs/dbraw/zinc/86/65/80/1347866580.db2.gz	NFBPCZHSSFOVFL-HZPDHXFCSA-N	0	3	343.496	3.031	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1c(F)cccc1OC	ZINC001049492058	1347875630	/nfs/dbraw/zinc/87/56/30/1347875630.db2.gz	WNSNMHKONBFYBH-JKSUJKDBSA-N	0	3	332.419	3.089	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(CCC)s1	ZINC001049499126	1347879023	/nfs/dbraw/zinc/87/90/23/1347879023.db2.gz	UYRHYHRLBZCGBZ-DLBZAZTESA-N	0	3	330.497	3.403	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1c(Cl)n[nH]c1C1CC1	ZINC001049514465	1347886494	/nfs/dbraw/zinc/88/64/94/1347886494.db2.gz	FSAFONIJUKBCAG-KBPBESRZSA-N	0	3	348.878	3.196	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccnc(-c2ccco2)c1	ZINC001049544702	1347900495	/nfs/dbraw/zinc/90/04/95/1347900495.db2.gz	OOTZKTOFLDXFQR-ZWKOTPCHSA-N	0	3	337.423	3.207	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)Cc2coc3ccc(C)cc23)C1	ZINC001079782970	1357379430	/nfs/dbraw/zinc/37/94/30/1357379430.db2.gz	SOGXXVDGYLLVSE-CRAIPNDOSA-N	0	3	326.440	3.296	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(-c2ccco2)o1	ZINC001049587530	1347923564	/nfs/dbraw/zinc/92/35/64/1347923564.db2.gz	HCJVFWLHVBLCIB-JKSUJKDBSA-N	0	3	338.407	3.242	20	30		EGEDHN
CC1(CC(=O)N2CCC[C@H]3[C@H]2CCN3Cc2cccc(C#N)c2)CC1	ZINC001049600766	1347930360	/nfs/dbraw/zinc/93/03/60/1347930360.db2.gz	CPFIRDJBEJMKDH-RBUKOAKNSA-N	0	3	337.467	3.314	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1noc2c1CC(C)(C)CC2	ZINC001049614180	1347936120	/nfs/dbraw/zinc/93/61/20/1347936120.db2.gz	WDIBDYMIMFIQDC-JKSUJKDBSA-N	0	3	343.471	3.054	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1cc2ccccc2o1	ZINC001049631571	1347943962	/nfs/dbraw/zinc/94/39/62/1347943962.db2.gz	WRBQAEKXJJGVRL-MOPGFXCFSA-N	0	3	336.435	3.064	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cnc2ccsc2c1	ZINC001049638028	1347947530	/nfs/dbraw/zinc/94/75/30/1347947530.db2.gz	JSDLGQCGZDAQHJ-CVEARBPZSA-N	0	3	327.453	3.161	20	30		EGEDHN
CC1(C(=O)N2CCC[C@H]3[C@@H]2CCN3Cc2ccc(C#N)cc2)CCC1	ZINC001049644286	1347951406	/nfs/dbraw/zinc/95/14/06/1347951406.db2.gz	ICSOMEKZLFLDDZ-OALUTQOASA-N	0	3	337.467	3.314	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1csc(-c2ccco2)n1	ZINC001049677119	1347967913	/nfs/dbraw/zinc/96/79/13/1347967913.db2.gz	RSZNZLMXLVKKFT-GJZGRUSLSA-N	0	3	343.452	3.268	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(C(C)C)nc1C	ZINC001049729887	1347991967	/nfs/dbraw/zinc/99/19/67/1347991967.db2.gz	YBNFXCQETJHLHY-RTBURBONSA-N	0	3	327.472	3.378	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1ccc(C(C)(C)C)cc1	ZINC001049748792	1347999135	/nfs/dbraw/zinc/99/91/35/1347999135.db2.gz	PFPKVEHLLNATGZ-WOJBJXKFSA-N	0	3	338.495	3.225	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1ccc(C(C)(C)C)cc1	ZINC001049748790	1347999166	/nfs/dbraw/zinc/99/91/66/1347999166.db2.gz	PFPKVEHLLNATGZ-UXHICEINSA-N	0	3	338.495	3.225	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)[C@@H]2CC23CCC3)cc1	ZINC001049753913	1348002424	/nfs/dbraw/zinc/00/24/24/1348002424.db2.gz	LYBBJUDRRZTWRU-SLFFLAALSA-N	0	3	349.478	3.314	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1c[nH]c2c1cccc2C	ZINC001049763071	1348007938	/nfs/dbraw/zinc/00/79/38/1348007938.db2.gz	UCSLHGDALRWXPG-UXHICEINSA-N	0	3	349.478	3.107	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1c[nH]c2c1cccc2C	ZINC001049763070	1348007947	/nfs/dbraw/zinc/00/79/47/1348007947.db2.gz	UCSLHGDALRWXPG-PMACEKPBSA-N	0	3	349.478	3.107	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)COc1ccsc1Cl	ZINC001049784047	1348020944	/nfs/dbraw/zinc/02/09/44/1348020944.db2.gz	WSPDQJIUQDWELJ-CHWSQXEVSA-N	0	3	340.876	3.032	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(C)nc1OCCC	ZINC001049810637	1348031194	/nfs/dbraw/zinc/03/11/94/1348031194.db2.gz	BYVQUXLXLJMSHB-ROUUACIJSA-N	0	3	343.471	3.044	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(OC)c(C2CC2)c1	ZINC001049815219	1348033833	/nfs/dbraw/zinc/03/38/33/1348033833.db2.gz	DFRPBSMGBTYPBI-MOPGFXCFSA-N	0	3	340.467	3.438	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc2scnc2c1	ZINC001049820358	1348037517	/nfs/dbraw/zinc/03/75/17/1348037517.db2.gz	KAWFIRLKMSEJOW-CVEARBPZSA-N	0	3	327.453	3.161	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1[nH]c2ccc(C)cc2c1C	ZINC001049821697	1348038559	/nfs/dbraw/zinc/03/85/59/1348038559.db2.gz	HSGUKDSRAZKJFI-WOJBJXKFSA-N	0	3	349.478	3.487	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)CCc1cc(C)cc(C)c1	ZINC001049832241	1348045623	/nfs/dbraw/zinc/04/56/23/1348045623.db2.gz	UTDBYYDWJJYSIV-RTWAWAEBSA-N	0	3	338.495	3.325	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](CC)Oc1ccccc1F	ZINC001049850149	1348058600	/nfs/dbraw/zinc/05/86/00/1348058600.db2.gz	SDHYTYMCRUQLRC-KURKYZTESA-N	0	3	346.446	3.234	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc2[nH]ccc2s1	ZINC001049867441	1348073289	/nfs/dbraw/zinc/07/32/89/1348073289.db2.gz	NGSYDJJLPBXABE-CABCVRRESA-N	0	3	329.469	3.484	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)COc1c(C)cc(C)cc1C	ZINC001049877587	1348082533	/nfs/dbraw/zinc/08/25/33/1348082533.db2.gz	QVEGYEZICBQVDZ-RTBURBONSA-N	0	3	342.483	3.242	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H]1CCCN2C(=O)CC(C)(C)c1ccc(C)cc1	ZINC001049885949	1348090526	/nfs/dbraw/zinc/09/05/26/1348090526.db2.gz	QSMUBSVQVSVXKP-UXHICEINSA-N	0	3	338.495	3.361	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](C)c1cccc(OC)c1	ZINC001049923289	1348115289	/nfs/dbraw/zinc/11/52/89/1348115289.db2.gz	UIRZVTVYOLIGBN-KFKAGJAMSA-N	0	3	328.456	3.050	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cnc(C(C)(C)C)nc1	ZINC001049927317	1348118027	/nfs/dbraw/zinc/11/80/27/1348118027.db2.gz	JCFATPKZBNQWSP-IRXDYDNUSA-N	0	3	342.487	3.029	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1cccnc1OC(C)C	ZINC001049936748	1348121979	/nfs/dbraw/zinc/12/19/79/1348121979.db2.gz	XMYODYDLZOUPRW-MSOLQXFVSA-N	0	3	343.471	3.124	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H]2CN(Cc3cccc(C#N)c3)C[C@H]21)C1CC1	ZINC001050010464	1348153162	/nfs/dbraw/zinc/15/31/62/1348153162.db2.gz	QYELTQBZPRSTGZ-RYGJVYDSSA-N	0	3	337.467	3.027	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cc(C)nn3C(CC)CC)[C@@H]2C1	ZINC001050078957	1348174971	/nfs/dbraw/zinc/17/49/71/1348174971.db2.gz	WSRPBXCVZNLCRJ-QFBILLFUSA-N	0	3	344.503	3.275	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)[C@@H]3C[C@H]3c3ccc(F)cc3F)[C@@H]2C1	ZINC001050102302	1348184308	/nfs/dbraw/zinc/18/43/08/1348184308.db2.gz	URGDTDXECMVVSO-CKNFYHOISA-N	0	3	346.421	3.177	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)C[C@H](C)c3cccc(F)c3)[C@@H]2C1	ZINC001050137186	1348193471	/nfs/dbraw/zinc/19/34/71/1348193471.db2.gz	QMMWIHQDQXVCNK-XKGZKEIXSA-N	0	3	342.458	3.265	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3cc([C@@H](C)CC)no3)[C@@H]2C1	ZINC001050160132	1348199556	/nfs/dbraw/zinc/19/95/56/1348199556.db2.gz	RHMGJFAUBGECIK-YQQAZPJKSA-N	0	3	331.460	3.301	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3cnn(CCCC)c3C)[C@@H]2C1	ZINC001050181060	1348204056	/nfs/dbraw/zinc/20/40/56/1348204056.db2.gz	CUKDGCTZINLEPU-PKOBYXMFSA-N	0	3	344.503	3.104	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3csc4cc(C)ccc34)C2)CC1	ZINC001050532684	1348284997	/nfs/dbraw/zinc/28/49/97/1348284997.db2.gz	ZVNMLGCZHYXDIU-UHFFFAOYSA-N	0	3	338.476	3.381	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3cc(F)c4ccccc4c3)C2)CC1	ZINC001050539634	1348286442	/nfs/dbraw/zinc/28/64/42/1348286442.db2.gz	RAXMOSBSZKHNGC-UHFFFAOYSA-N	0	3	336.410	3.150	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1ncccc1C)CC2	ZINC001050645573	1348313999	/nfs/dbraw/zinc/31/39/99/1348313999.db2.gz	QYQUVTLWSVZGRX-HXUWFJFHSA-N	0	3	341.499	3.417	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC3(C2)CCN(Cc2cccc(C#N)c2)CC3)C1	ZINC001050656435	1348319178	/nfs/dbraw/zinc/31/91/78/1348319178.db2.gz	DCBXLIVREIDGSX-UHFFFAOYSA-N	0	3	349.478	3.339	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cccc4ccsc43)C2)CC1	ZINC001050723322	1348337803	/nfs/dbraw/zinc/33/78/03/1348337803.db2.gz	HMRRIEHHPXRYHO-UHFFFAOYSA-N	0	3	338.476	3.463	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@H](C)c3ccc(Cl)s3)C2)CC1	ZINC001050723633	1348338233	/nfs/dbraw/zinc/33/82/33/1348338233.db2.gz	UFYAQOONQYPREX-CYBMUJFWSA-N	0	3	336.888	3.063	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H](C)c3ccc(C)s3)C2)CC1	ZINC001050726408	1348338636	/nfs/dbraw/zinc/33/86/36/1348338636.db2.gz	BIAOLSOYHGHHPM-INIZCTEOSA-N	0	3	330.497	3.108	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@@H]3CCCCc4ccccc43)C2)CC1	ZINC001050767426	1348352985	/nfs/dbraw/zinc/35/29/85/1348352985.db2.gz	CRPYIDGGFQSXLE-HXUWFJFHSA-N	0	3	336.479	3.054	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)CCc3cc(C)sc3C)C2)CC1	ZINC001050769128	1348353730	/nfs/dbraw/zinc/35/37/30/1348353730.db2.gz	NIWKGANYZDJRPW-UHFFFAOYSA-N	0	3	344.524	3.245	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@@H](C)Cc3cccc(Cl)c3)C2)CC1	ZINC001050774017	1348355464	/nfs/dbraw/zinc/35/54/64/1348355464.db2.gz	AFDJFFPDNPOMBQ-INIZCTEOSA-N	0	3	344.886	3.076	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3ccc(OC)cc3)cccc2C1	ZINC001051306762	1348428275	/nfs/dbraw/zinc/42/82/75/1348428275.db2.gz	OSCOKZIFXWPWGF-UHFFFAOYSA-N	0	3	348.446	3.007	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cc(C(F)F)ccc2F)CC1	ZINC001052387228	1348538426	/nfs/dbraw/zinc/53/84/26/1348538426.db2.gz	FJLODVUFEPYMOR-AWEZNQCLSA-N	0	3	338.373	3.371	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2[nH]c3ccccc3c2Cl)CC1	ZINC001052526164	1348566211	/nfs/dbraw/zinc/56/62/11/1348566211.db2.gz	XIDANZZFBWJUJF-ZDUSSCGKSA-N	0	3	329.831	3.039	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2sc(C)nc2CC(C)C)CC1	ZINC001052532271	1348568133	/nfs/dbraw/zinc/56/81/33/1348568133.db2.gz	BVRBXCHOIWJCNK-INIZCTEOSA-N	0	3	347.528	3.258	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2nc3ccccc3cc2C)CC1	ZINC001052571410	1348583079	/nfs/dbraw/zinc/58/30/79/1348583079.db2.gz	GIYIEDKYVQQJQF-SFHVURJKSA-N	0	3	335.451	3.151	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN(Cc3cnccc3C)CC2)cc1	ZINC001052614037	1348597035	/nfs/dbraw/zinc/59/70/35/1348597035.db2.gz	JMUCFOGNOUSKAG-OAQYLSRUSA-N	0	3	347.462	3.156	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCN(Cc3cccc(C#N)c3)CC2)C1	ZINC001052691081	1348634602	/nfs/dbraw/zinc/63/46/02/1348634602.db2.gz	RFUXHWGKKSWGIF-LJQANCHMSA-N	0	3	337.467	3.385	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H](NC(=O)C3CC4(CC4)C3)CC2)cc1	ZINC001052698939	1348640100	/nfs/dbraw/zinc/64/01/00/1348640100.db2.gz	SNMKPLXQAMNPEH-IBGZPJMESA-N	0	3	337.467	3.219	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cccn2C2CCCC2)CC1	ZINC001052825710	1348691439	/nfs/dbraw/zinc/69/14/39/1348691439.db2.gz	FPINQDXOKFDRLC-QGZVFWFLSA-N	0	3	327.472	3.211	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2coc3ccc(F)cc23)CC1	ZINC001052896486	1348732762	/nfs/dbraw/zinc/73/27/62/1348732762.db2.gz	CGAYVNUFNRYNTF-HNNXBMFYSA-N	0	3	328.387	3.180	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc(OCC(C)C)cc2)CC1	ZINC001052911720	1348743584	/nfs/dbraw/zinc/74/35/84/1348743584.db2.gz	NKDQOQPEXZGAIN-IBGZPJMESA-N	0	3	342.483	3.329	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@@H](C)c2cccc(Cl)c2)CC1	ZINC001052946673	1348762913	/nfs/dbraw/zinc/76/29/13/1348762913.db2.gz	BLCJRWMLAFAKRO-MAUKXSAKSA-N	0	3	332.875	3.438	20	30		EGEDHN
CC(=O)N1CCC[C@@H]([C@H]2CCCN(Cc3ccc(C#N)cc3F)C2)C1	ZINC001052997537	1348794119	/nfs/dbraw/zinc/79/41/19/1348794119.db2.gz	RMCSOEFGLGCGNU-ZWKOTPCHSA-N	0	3	343.446	3.168	20	30		EGEDHN
CC(=O)N1CCC[C@H]([C@@H]2CCCN(CC#Cc3ccc(F)cc3)C2)C1	ZINC001052998083	1348794644	/nfs/dbraw/zinc/79/46/44/1348794644.db2.gz	VGKQKARCFCPGMV-UXHICEINSA-N	0	3	342.458	3.148	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)/C=C\c2ccco2)C1	ZINC001053060068	1348869578	/nfs/dbraw/zinc/86/95/78/1348869578.db2.gz	CRRYOAKHLPXIRD-XHDCIHGFSA-N	0	3	326.440	3.019	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccsc2)C1	ZINC001053063648	1348874990	/nfs/dbraw/zinc/87/49/90/1348874990.db2.gz	POBZTMFTEHGMMN-AEFFLSMTSA-N	0	3	330.497	3.478	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cccc(F)c2C)C1	ZINC001053086520	1348908538	/nfs/dbraw/zinc/90/85/38/1348908538.db2.gz	MUCDUXHUWFMNLD-XLIONFOSSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cc(F)ccc2F)C1	ZINC001053087291	1348910418	/nfs/dbraw/zinc/91/04/18/1348910418.db2.gz	JUNQWFMGSZBLBW-KXBFYZLASA-N	0	3	346.421	3.305	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cc(C)[nH]c2C)C1	ZINC001053098092	1348928891	/nfs/dbraw/zinc/92/88/91/1348928891.db2.gz	KBMMSRDGAYWHHX-UYAOXDASSA-N	0	3	341.499	3.362	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cncc(Cl)c2)C1	ZINC001053100830	1348934470	/nfs/dbraw/zinc/93/44/70/1348934470.db2.gz	JKDWVWUGPZOSNM-YJBOKZPZSA-N	0	3	345.874	3.075	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2sccc2OC)C1	ZINC001053103701	1348938755	/nfs/dbraw/zinc/93/87/55/1348938755.db2.gz	KWGWPXOCEFNYBR-HOTGVXAUSA-N	0	3	346.496	3.097	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)[C@H]2[C@H]3[C@@H]2[C@@H]2CC[C@H]3C2)C1	ZINC001053107900	1348947281	/nfs/dbraw/zinc/94/72/81/1348947281.db2.gz	NBPPUTAWWQEALD-DTGNRIQCSA-N	0	3	340.511	3.005	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1oc(C(F)F)cc1C)C2	ZINC001054148287	1349155037	/nfs/dbraw/zinc/15/50/37/1349155037.db2.gz	LIKHTWDVYDRPPC-SFHVURJKSA-N	0	3	336.382	3.087	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@H]1CCCCC1(F)F)C2	ZINC001054170438	1349172158	/nfs/dbraw/zinc/17/21/58/1349172158.db2.gz	PGFDAICRRTZGMP-AEFFLSMTSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC[C@H](F)C(=O)N1CCC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001054177688	1349179947	/nfs/dbraw/zinc/17/99/47/1349179947.db2.gz	QCEPTPBXXIKJLF-ICSRJNTNSA-N	0	3	343.446	3.121	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@H](C)c1cccs1)C2	ZINC001054196566	1349198802	/nfs/dbraw/zinc/19/88/02/1349198802.db2.gz	JKOOKKHOETXHQK-VQIMIIECSA-N	0	3	330.497	3.189	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cccc3[nH]ccc31)C2	ZINC001054201422	1349203577	/nfs/dbraw/zinc/20/35/77/1349203577.db2.gz	DOUPVCUGXRHZLI-OAQYLSRUSA-N	0	3	335.451	3.119	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)C13CCC(CC1)C3(C)C)C2	ZINC001054210628	1349211301	/nfs/dbraw/zinc/21/13/01/1349211301.db2.gz	SZZFRCYPOKSIDV-TWMPVWRBSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H]1C[C@H]1c1ccc(C)s1)C2	ZINC001054212289	1349212090	/nfs/dbraw/zinc/21/20/90/1349212090.db2.gz	FDXIKHSPUCJKJB-HLIPFELVSA-N	0	3	342.508	3.108	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)C1CC(C(C)(C)C)C1)C2	ZINC001054247615	1349243465	/nfs/dbraw/zinc/24/34/65/1349243465.db2.gz	ZAQFYETUWQGDTM-NGICGMGXSA-N	0	3	330.516	3.397	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3ccnn3C(F)F)cc2C1	ZINC001054267323	1349264776	/nfs/dbraw/zinc/26/47/76/1349264776.db2.gz	NGMRVSOWEQSOLL-UHFFFAOYSA-N	0	3	346.381	3.100	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3ccc4cc[nH]c4n3)cc2C1	ZINC001054268906	1349267620	/nfs/dbraw/zinc/26/76/20/1349267620.db2.gz	BMJROOXXLBVXDE-UHFFFAOYSA-N	0	3	346.434	3.385	20	30		EGEDHN
C=C(C)CN1Cc2ccc(CNC(=O)c3ccc4cncn4c3)cc2C1	ZINC001054274052	1349273836	/nfs/dbraw/zinc/27/38/36/1349273836.db2.gz	PAIFGSXOTDSFMW-UHFFFAOYSA-N	0	3	346.434	3.156	20	30		EGEDHN
C#Cc1ccc(C(=O)NCc2ccc3c(c2)CN(CCCC)C3)nc1	ZINC001054290274	1349294990	/nfs/dbraw/zinc/29/49/90/1349294990.db2.gz	JWQIIORVWOMTSX-UHFFFAOYSA-N	0	3	333.435	3.109	20	30		EGEDHN
Cc1cccc(C(=O)N2C[C@H](C)[C@H](NCc3ccc(C#N)s3)C2)c1	ZINC001054354400	1349332185	/nfs/dbraw/zinc/33/21/85/1349332185.db2.gz	AFGDDCMNPWNGSA-KBXCAEBGSA-N	0	3	339.464	3.179	20	30		EGEDHN
C[C@H]1CN(C(=O)CCC2CCC2)C[C@@H]1NCc1ccc(C#N)c(F)c1	ZINC001054523060	1349382927	/nfs/dbraw/zinc/38/29/27/1349382927.db2.gz	CESLPIHZYYURQP-LIRRHRJNSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@@H](C)[C@H](NCc2cnc(C)s2)C1	ZINC001054677202	1349434246	/nfs/dbraw/zinc/43/42/46/1349434246.db2.gz	DWHKPHJSDOPEGT-QMTHXVAHSA-N	0	3	341.908	3.167	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@@H](C)[C@@H](NCc2ncccc2C)C1	ZINC001054680053	1349435379	/nfs/dbraw/zinc/43/53/79/1349435379.db2.gz	LXRCBNAEXOIFLE-CJNGLKHVSA-N	0	3	335.879	3.105	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@@H](NCc2cc(F)ccc2OC)C1	ZINC001054970992	1349531944	/nfs/dbraw/zinc/53/19/44/1349531944.db2.gz	KYFCLRVNNVHWFL-PBHICJAKSA-N	0	3	348.462	3.373	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](NC(=O)CC2CCCC2)C2CC2)c(F)c1	ZINC001322955320	1387255752	/nfs/dbraw/zinc/25/57/52/1387255752.db2.gz	SQCGXGQNVAKKOC-LJQANCHMSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CN(CCOc3ccccc3)C[C@H]2C)CC1	ZINC001080384519	1357597855	/nfs/dbraw/zinc/59/78/55/1357597855.db2.gz	BLGDQQUOXLSCRP-YLJYHZDGSA-N	0	3	342.483	3.248	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)[C@H]2CCCC(C)(C)C2)C1	ZINC001070435352	1354348416	/nfs/dbraw/zinc/34/84/16/1354348416.db2.gz	DOHJGHCBQUPDHG-HOTGVXAUSA-N	0	3	344.503	3.218	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C1=CCCCCC1)C[C@@H](C)O2	ZINC001071161300	1354482840	/nfs/dbraw/zinc/48/28/40/1354482840.db2.gz	IADILRHCHZAYMW-XLIONFOSSA-N	0	3	332.488	3.145	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)CC1(C)CCCC1)C[C@@H](C)O2	ZINC001071164123	1354484328	/nfs/dbraw/zinc/48/43/28/1354484328.db2.gz	HMQPXAUIRKOYPQ-XLIONFOSSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C(C)(C)C1CCCC1)C[C@H](C)O2	ZINC001071178651	1354488455	/nfs/dbraw/zinc/48/84/55/1354488455.db2.gz	UGULKUZCDMBEGO-LAUBAEHRSA-N	0	3	348.531	3.471	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cccc(C)c3F)C2)CC1	ZINC001086924062	1359249671	/nfs/dbraw/zinc/24/96/71/1359249671.db2.gz	JBHYYFWYNXJRKR-MRXNPFEDSA-N	0	3	328.431	3.084	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)Cc2coc3ccc(C)cc23)CC[C@H]1C	ZINC001071541557	1354754953	/nfs/dbraw/zinc/75/49/53/1354754953.db2.gz	AOZGLLXRDCGOBQ-AEFFLSMTSA-N	0	3	338.451	3.276	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2(c3cccc(Cl)c3)CC2)CC[C@@H]1C	ZINC001071544456	1354757497	/nfs/dbraw/zinc/75/74/97/1354757497.db2.gz	YWJKVHWXGFFXPZ-MAUKXSAKSA-N	0	3	344.886	3.364	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(N(C)C)cc2F)CC[C@H]1C	ZINC001071567665	1354767018	/nfs/dbraw/zinc/76/70/18/1354767018.db2.gz	AWOJPMWOZVXGQK-HUUCEWRRSA-N	0	3	333.451	3.051	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2cn3cc(C)nc3s2)CC[C@@H]1C	ZINC001071568496	1354768831	/nfs/dbraw/zinc/76/88/31/1354768831.db2.gz	OEEJRYUUVSYLLA-GJZGRUSLSA-N	0	3	346.500	3.253	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc(C)n(C(CC)CC)n2)CC[C@@H]1C	ZINC001071627275	1354812038	/nfs/dbraw/zinc/81/20/38/1354812038.db2.gz	BROHIWVUMKCARL-DOTOQJQBSA-N	0	3	344.503	3.159	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc(C(C)C)nn2CC)CC[C@H]1C	ZINC001071642599	1354821866	/nfs/dbraw/zinc/82/18/66/1354821866.db2.gz	SZIDGHDGMKUVOX-CVEARBPZSA-N	0	3	332.492	3.185	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(-n3cccc3)cc2)CC[C@H]1C	ZINC001071653884	1354829246	/nfs/dbraw/zinc/82/92/46/1354829246.db2.gz	AOZWNIWZHLPAOO-IEBWSBKVSA-N	0	3	335.451	3.083	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2c(C)occ2C(F)(F)F)CC[C@H]1C	ZINC001071689166	1354852047	/nfs/dbraw/zinc/85/20/47/1354852047.db2.gz	GTJUNAQPBGOCPC-YPMHNXCESA-N	0	3	342.361	3.213	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(C)c(Cl)c2F)CC[C@@H]1C	ZINC001071701259	1354860330	/nfs/dbraw/zinc/86/03/30/1354860330.db2.gz	FRONDASDVWMKOI-KBPBESRZSA-N	0	3	336.838	3.394	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)Cc2cccc(Cl)c2F)CC[C@@H]1C	ZINC001071843770	1354973945	/nfs/dbraw/zinc/97/39/45/1354973945.db2.gz	APKWXOHAOHXLQE-ZFWWWQNUSA-N	0	3	336.838	3.014	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2c(C)noc2C(F)(F)F)CC[C@@H]1C	ZINC001071854727	1354982541	/nfs/dbraw/zinc/98/25/41/1354982541.db2.gz	FFWXDIWKBVUDRG-CMPLNLGQSA-N	0	3	345.365	3.161	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)Cc2c[nH]c3cc(C)ccc23)CC[C@@H]1C	ZINC001071886627	1355006433	/nfs/dbraw/zinc/00/64/33/1355006433.db2.gz	HLAJRHJBHDWSIW-DOTOQJQBSA-N	0	3	325.456	3.174	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2csc(-c3ccoc3)n2)CC[C@H]1C	ZINC001071908596	1355019016	/nfs/dbraw/zinc/01/90/16/1355019016.db2.gz	YYMSKDQHLOEUNZ-HIFRSBDPSA-N	0	3	343.452	3.009	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2cc3nc(C)ccc3o2)CC[C@H]1C	ZINC001072012771	1355076942	/nfs/dbraw/zinc/07/69/42/1355076942.db2.gz	SCPIMUCFZWJDRO-CABCVRRESA-N	0	3	327.428	3.295	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccccc2C(F)(F)F)CC[C@@H]1C	ZINC001072016035	1355079269	/nfs/dbraw/zinc/07/92/69/1355079269.db2.gz	LKMQAILUTVZFHX-KBPBESRZSA-N	0	3	338.373	3.311	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)Cc2c(F)cccc2Cl)CC[C@H]1C	ZINC001072019136	1355081126	/nfs/dbraw/zinc/08/11/26/1355081126.db2.gz	DBLSXLWOPBUEGP-KGLIPLIRSA-N	0	3	336.838	3.014	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc(F)c(F)cc2Cl)CC[C@H]1C	ZINC001072046090	1355101337	/nfs/dbraw/zinc/10/13/37/1355101337.db2.gz	VFHPLVIGOFEHCR-VXGBXAGGSA-N	0	3	340.801	3.224	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc(C)nc3ccccc32)CC[C@H]1C	ZINC001072049636	1355103291	/nfs/dbraw/zinc/10/32/91/1355103291.db2.gz	QFMMFLAMVVDNED-IAGOWNOFSA-N	0	3	335.451	3.149	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc3c(cccc3OC)[nH]2)CC[C@H]1C	ZINC001072070965	1355112289	/nfs/dbraw/zinc/11/22/89/1355112289.db2.gz	UGOQLBDYTZTTGN-HUUCEWRRSA-N	0	3	341.455	3.335	20	30		EGEDHN
C[C@@H]1CCN(C(=O)c2ccco2)C[C@@H]1CNCc1ccccc1C#N	ZINC001072167375	1355162890	/nfs/dbraw/zinc/16/28/90/1355162890.db2.gz	PPFCAUPWFVAMNF-QAPCUYQASA-N	0	3	337.423	3.039	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](C)[C@@H](CNCc3ocnc3C)C2)CC1	ZINC001072356067	1355253786	/nfs/dbraw/zinc/25/37/86/1355253786.db2.gz	FQMCRYJVRDIJSW-QAPCUYQASA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](C)[C@H](CNCc3cc(C)no3)C2)CC1	ZINC001072356962	1355255077	/nfs/dbraw/zinc/25/50/77/1355255077.db2.gz	SSGYGEWLMBLYDO-MAUKXSAKSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](C)[C@@H](CNCc3nc(C)cs3)C2)C1	ZINC001072359863	1355255826	/nfs/dbraw/zinc/25/58/26/1355255826.db2.gz	IHRGEWGXLVCOPX-HOCLYGCPSA-N	0	3	347.528	3.382	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](C)[C@H](CNCc3csc(C)n3)C2)C1	ZINC001072364125	1355258395	/nfs/dbraw/zinc/25/83/95/1355258395.db2.gz	OYONRSYDYDJQPN-GDBMZVCRSA-N	0	3	347.528	3.382	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)C3(CC)CCC(F)(F)CC3)C2)C1	ZINC001072860959	1355471259	/nfs/dbraw/zinc/47/12/59/1355471259.db2.gz	PPMFABKESOHURV-UHFFFAOYSA-N	0	3	326.431	3.312	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)C[C@@H]4CC[C@H]5C[C@H]54)C3)C2)c1	ZINC001072874791	1355477828	/nfs/dbraw/zinc/47/78/28/1355477828.db2.gz	FRFHZTWVAMFFBZ-SLFFLAALSA-N	0	3	349.478	3.029	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)[C@@H]4CC[C@H]5C[C@H]5C4)C3)C2)c1	ZINC001072879683	1355480877	/nfs/dbraw/zinc/48/08/77/1355480877.db2.gz	WOMFNIKPNIRPOG-ZCNNSNEGSA-N	0	3	349.478	3.029	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@H](Cc3ccccc3)C(C)C)C2)C1	ZINC001072975917	1355531811	/nfs/dbraw/zinc/53/18/11/1355531811.db2.gz	OSZBAJICKABUOR-LJQANCHMSA-N	0	3	326.484	3.222	20	30		EGEDHN
C[C@@H]1CC[C@H](C(=O)N2CC3(C2)CCN(Cc2ccc(C#N)cc2)C3)C1	ZINC001073033598	1355561368	/nfs/dbraw/zinc/56/13/68/1355561368.db2.gz	PFKNKAGVNXZUCU-APWZRJJASA-N	0	3	337.467	3.029	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)[C@@H]4C[C@H]4C4CCC4)C3)C2)c1	ZINC001073050016	1355568496	/nfs/dbraw/zinc/56/84/96/1355568496.db2.gz	GBRNHRAWYYKRRD-VQTJNVASSA-N	0	3	349.478	3.029	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H]3CCCCc4ccccc43)C2)C1	ZINC001073470126	1355803974	/nfs/dbraw/zinc/80/39/74/1355803974.db2.gz	ZNIPNQRMOGNNQR-HXUWFJFHSA-N	0	3	336.479	3.054	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2ccc(CCCC)cc2)C1	ZINC001073686808	1355864799	/nfs/dbraw/zinc/86/47/99/1355864799.db2.gz	BDMKVSYTZOSHEH-HXUWFJFHSA-N	0	3	344.499	3.426	20	30		EGEDHN
CS[C@@H](C)C(=O)N1CCCC[C@@H]1CN(C)Cc1cccc(C#N)c1	ZINC001073954658	1355991501	/nfs/dbraw/zinc/99/15/01/1355991501.db2.gz	ZWYMTOYJEZOBMR-MAUKXSAKSA-N	0	3	345.512	3.123	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCCC[C@@H]1CN(C)Cc1cccc(C#N)c1	ZINC001074067633	1356064312	/nfs/dbraw/zinc/06/43/12/1356064312.db2.gz	JFQUPLJBUKYETE-VAMGGRTRSA-N	0	3	339.483	3.417	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)[C@@H]1C)C1CCC1	ZINC001074706718	1356225741	/nfs/dbraw/zinc/22/57/41/1356225741.db2.gz	PINMSMYUHXCAOU-NJSLBKSFSA-N	0	3	343.446	3.213	20	30		EGEDHN
CC#CCN1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)[C@H]2C[C@@H]2C)C1	ZINC001075422009	1356364673	/nfs/dbraw/zinc/36/46/73/1356364673.db2.gz	FYETUVOIJKAQLT-ZSXHRAQDSA-N	0	3	342.458	3.027	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@@H]3CC[C@H](c4ccccc4)O3)[C@@H]2C1	ZINC001075800986	1356423432	/nfs/dbraw/zinc/42/34/32/1356423432.db2.gz	OSGOFWYUNLBWHT-NMLBUPMWSA-N	0	3	340.467	3.016	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3nccc4ccsc43)[C@@H]2C1	ZINC001075907000	1356444098	/nfs/dbraw/zinc/44/40/98/1356444098.db2.gz	LELRWOBCXYOIIN-LSDHHAIUSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)Cc3csc(C(C)(C)C)n3)[C@@H]2C1	ZINC001076363614	1356560132	/nfs/dbraw/zinc/56/01/32/1356560132.db2.gz	RCFAJKRLFWUUDY-GOEBONIOSA-N	0	3	347.528	3.092	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)C[C@@H](NC(=O)C(C)(C)C)c1ccccc1O2	ZINC001098545867	1363368320	/nfs/dbraw/zinc/36/83/20/1363368320.db2.gz	ZNZOYKDFYOKNAU-UTKZUKDTSA-N	0	3	340.467	3.140	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3cccc(Cl)c3Cl)[C@@H]2C1	ZINC001076495263	1356596414	/nfs/dbraw/zinc/59/64/14/1356596414.db2.gz	CDKGOPHRWHMTMW-SWLSCSKDSA-N	0	3	337.250	3.163	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2ccccc2CC)C[C@H]1C(F)(F)F	ZINC001099298616	1363737135	/nfs/dbraw/zinc/73/71/35/1363737135.db2.gz	XSWFKGXGYKOZLG-HUUCEWRRSA-N	0	3	326.362	3.028	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H](F)Cc1ccccc1	ZINC001099349667	1363766371	/nfs/dbraw/zinc/76/63/71/1363766371.db2.gz	RJPCXDKTLGNWPP-MOPGFXCFSA-N	0	3	344.474	3.197	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@@H](NC(=O)C3CCC3)C23CCC3)c(F)c1	ZINC001078523453	1356992845	/nfs/dbraw/zinc/99/28/45/1356992845.db2.gz	KZUAFJQCAXFELM-ZWKOTPCHSA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2cncc(CC)c2)C12CCC2	ZINC001078683719	1357053647	/nfs/dbraw/zinc/05/36/47/1357053647.db2.gz	VXCHUWXEFODRJH-CVEARBPZSA-N	0	3	333.863	3.027	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2occ3c2CCC3)C12CCC2	ZINC001078688616	1357054240	/nfs/dbraw/zinc/05/42/40/1357054240.db2.gz	SINAGPJCNRKNRU-HUUCEWRRSA-N	0	3	334.847	3.151	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2oc(C3CC3)nc2C)C12CCC2	ZINC001078744397	1357069187	/nfs/dbraw/zinc/06/91/87/1357069187.db2.gz	TUJZFYQTXMAXLL-UONOGXRCSA-N	0	3	349.862	3.244	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc(C)cc2OC)C12CCC2	ZINC001078785325	1357080816	/nfs/dbraw/zinc/08/08/16/1357080816.db2.gz	BRHPGDLFJBQPEY-DLBZAZTESA-N	0	3	348.874	3.387	20	30		EGEDHN
C=C(C)CCN1C[C@@H](C)[C@H](NC(=O)c2cnc(C(C)(C)C)s2)C1	ZINC001081005236	1357778221	/nfs/dbraw/zinc/77/82/21/1357778221.db2.gz	DBMDILXLINADCN-ZIAGYGMSSA-N	0	3	335.517	3.457	20	30		EGEDHN
CCCCCCCCOCC(=O)N1CC[C@@H](NC[C@H](F)CC)C1	ZINC001183296211	1387293253	/nfs/dbraw/zinc/29/32/53/1387293253.db2.gz	WNZGZGPASQTENX-IAGOWNOFSA-N	0	3	330.488	3.302	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H]2CC[C@@H]3C[C@@H]3CC2)C[C@H]1c1ccccc1	ZINC001081150774	1357845348	/nfs/dbraw/zinc/84/53/48/1357845348.db2.gz	AYPGDXIIBKCIOE-HGJUEJDCSA-N	0	3	336.479	3.030	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)CCc2ccccc2C)C[C@H]1c1ccccc1	ZINC001081187818	1357848214	/nfs/dbraw/zinc/84/82/14/1357848214.db2.gz	XLWBUWKJOOBIMF-FCHUYYIVSA-N	0	3	346.474	3.145	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H](C)c2ccccc2)C[C@H]1c1ccccc1	ZINC001081215676	1357849555	/nfs/dbraw/zinc/84/95/55/1357849555.db2.gz	QWUNPFOHWHTNRR-DZFGPLHGSA-N	0	3	332.447	3.008	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2ccc3c(c2)CCC3)C[C@H]1c1ccccc1	ZINC001081224580	1357851216	/nfs/dbraw/zinc/85/12/16/1357851216.db2.gz	NZMYULBIDFWQRD-FCHUYYIVSA-N	0	3	344.458	3.006	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2ccc(C3CCCC3)cc2)[C@H](OC)C1	ZINC001081952135	1357901894	/nfs/dbraw/zinc/90/18/94/1357901894.db2.gz	VXMXIUQMLDSJSY-WOJBJXKFSA-N	0	3	342.483	3.349	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2ccc(C)cc2Cl)[C@H](OC)C1	ZINC001082160774	1357964508	/nfs/dbraw/zinc/96/45/08/1357964508.db2.gz	NWZYQUVCLIRUFF-IAGOWNOFSA-N	0	3	336.863	3.044	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)c3csc4ccccc34)[C@H]2C1	ZINC001083155736	1358121994	/nfs/dbraw/zinc/12/19/94/1358121994.db2.gz	KOXSJFYIMTURAF-DLBZAZTESA-N	0	3	342.464	3.003	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)[C@H]3[C@@H]4CCCCCC[C@@H]43)[C@H]2C1	ZINC001083203208	1358122165	/nfs/dbraw/zinc/12/21/65/1358122165.db2.gz	GZSPCQOYJCNMJR-PXTPFGJHSA-N	0	3	346.515	3.081	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)c3cccc(C(C)(C)C)c3)[C@H]2C1	ZINC001083230547	1358126076	/nfs/dbraw/zinc/12/60/76/1358126076.db2.gz	FJAHPQVFZJADEB-RBUKOAKNSA-N	0	3	342.483	3.085	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3cc(C)n([C@H](C)CC)n3)C[C@@H]21	ZINC001084977329	1358358039	/nfs/dbraw/zinc/35/80/39/1358358039.db2.gz	YVAKJXUHAKKAQG-SUMDDJOVSA-N	0	3	344.503	3.275	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@H](C)Cc3ccc(C)cc3)C[C@@H]21	ZINC001085102774	1358392441	/nfs/dbraw/zinc/39/24/41/1358392441.db2.gz	VLUMYSHYGWPSKK-SXLOBPIMSA-N	0	3	326.484	3.282	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccccc1	ZINC001085120265	1358399093	/nfs/dbraw/zinc/39/90/93/1358399093.db2.gz	BHTHJCRBLYAUPV-HUUCEWRRSA-N	0	3	337.261	3.226	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1nccc2cccnc21	ZINC001085228969	1358438418	/nfs/dbraw/zinc/43/84/18/1358438418.db2.gz	QOUYEFIVQLFEAV-HUUCEWRRSA-N	0	3	344.846	3.013	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)[C@]12C[C@H]1CCC2	ZINC001085279078	1358450205	/nfs/dbraw/zinc/45/02/05/1358450205.db2.gz	OZPQLKWEXOLNFS-IXYNUQLISA-N	0	3	341.293	3.102	20	30		EGEDHN
CC1(C(=O)N[C@@H]2CCCC[C@H]2NCc2cc(C#N)ccc2F)CCC1	ZINC001085299531	1358457341	/nfs/dbraw/zinc/45/73/41/1358457341.db2.gz	ZPYPXDIMNYIIRY-QZTJIDSGSA-N	0	3	343.446	3.405	20	30		EGEDHN
CC[C@@H](c1ccccc1)N1CC[C@H]1CN(C)C(=O)c1cc(C#N)c[nH]1	ZINC001085535816	1358573213	/nfs/dbraw/zinc/57/32/13/1358573213.db2.gz	PXRCPYWWEZCZBW-HKUYNNGSSA-N	0	3	336.439	3.184	20	30		EGEDHN
CN(C[C@@H]1CCN1[C@@H]1CCCc2ccccc21)C(=O)c1cc(C#N)c[nH]1	ZINC001085535740	1358573338	/nfs/dbraw/zinc/57/33/38/1358573338.db2.gz	OUMXMQLGPJQLGR-FXAWDEMLSA-N	0	3	348.450	3.110	20	30		EGEDHN
CN(C[C@@H]1CCN1[C@H]1CCCc2ccccc21)C(=O)c1cc(C#N)c[nH]1	ZINC001085535741	1358573419	/nfs/dbraw/zinc/57/34/19/1358573419.db2.gz	OUMXMQLGPJQLGR-PXNSSMCTSA-N	0	3	348.450	3.110	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1c(C)nn(C(C)(C)C)c1C	ZINC001085629251	1358646996	/nfs/dbraw/zinc/64/69/96/1358646996.db2.gz	PYVUDNFQLCWQRW-KRWDZBQOSA-N	0	3	346.519	3.367	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@H]1CCOc2c(F)cccc21	ZINC001085714473	1358706225	/nfs/dbraw/zinc/70/62/25/1358706225.db2.gz	LHMMQQGIGHJHPS-RDJZCZTQSA-N	0	3	346.446	3.191	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@H]1CCc2cc(C)ccc2O1	ZINC001085722975	1358712306	/nfs/dbraw/zinc/71/23/06/1358712306.db2.gz	KYGXNDWKPBFEQS-AZUAARDMSA-N	0	3	342.483	3.188	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@@H]1COc2cc(C)c(C)cc21	ZINC001085742948	1358726329	/nfs/dbraw/zinc/72/63/29/1358726329.db2.gz	CFJGPWVUBOYEEP-PKOBYXMFSA-N	0	3	342.483	3.278	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@H]1CCc2ccccc2C1	ZINC001085844016	1358811346	/nfs/dbraw/zinc/81/13/46/1358811346.db2.gz	BPHDDYNDZUEUBC-VQTJNVASSA-N	0	3	326.484	3.290	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc(F)cc2cccnc21	ZINC001085852655	1358820375	/nfs/dbraw/zinc/82/03/75/1358820375.db2.gz	CNYAJZMYWLSQEZ-QGZVFWFLSA-N	0	3	341.430	3.486	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc(N(C)C)c(F)c1	ZINC001085989520	1358941682	/nfs/dbraw/zinc/94/16/82/1358941682.db2.gz	SJUMQSZCVUYWCQ-MRXNPFEDSA-N	0	3	333.451	3.004	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)[C@H]2C[C@]2(C)C(C)C)C1	ZINC001086241793	1359039210	/nfs/dbraw/zinc/03/92/10/1359039210.db2.gz	UFHGYAJFNZMZEP-HLPPOEQASA-N	0	3	343.309	3.062	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(F)c3occc32)C1	ZINC001086276391	1359051037	/nfs/dbraw/zinc/05/10/37/1359051037.db2.gz	OGJLHUKDUSTONZ-TXEJJXNPSA-N	0	3	336.794	3.422	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(-c3ccncc3)o2)C1	ZINC001086387095	1359084718	/nfs/dbraw/zinc/08/47/18/1359084718.db2.gz	RKGDGYGQHQOHJP-CTYIDZIISA-N	0	3	345.830	3.192	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)NC[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)C1	ZINC001086496096	1359120239	/nfs/dbraw/zinc/12/02/39/1359120239.db2.gz	NAYYXABQHCGBCF-MBGYTDRXSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc(Cl)ccc2C)C1	ZINC001086507718	1359123520	/nfs/dbraw/zinc/12/35/20/1359123520.db2.gz	ISHARCUCNBPBDK-MQMHXKEQSA-N	0	3	327.255	3.499	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc(Cl)cc(OC)c2)C1	ZINC001086510653	1359123594	/nfs/dbraw/zinc/12/35/94/1359123594.db2.gz	AKCVGJJZEIOWTI-YEORSEQZSA-N	0	3	343.254	3.199	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc3nc(C)ccc3c2)C1	ZINC001086509279	1359123892	/nfs/dbraw/zinc/12/38/92/1359123892.db2.gz	IYFRDSJKVFRBHB-CZIWCDLHSA-N	0	3	343.858	3.394	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2cc(C)oc2C)C1	ZINC001086574548	1359153010	/nfs/dbraw/zinc/15/30/10/1359153010.db2.gz	VXERCZCLGXWYNS-VQTJNVASSA-N	0	3	336.435	3.118	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2[nH]ccc2C2CC2)C1	ZINC001086591980	1359158375	/nfs/dbraw/zinc/15/83/75/1359158375.db2.gz	PHUQRZOSKNALJN-VQTJNVASSA-N	0	3	347.462	3.113	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)Cc2cccc(C)c2)C1	ZINC001086606476	1359162233	/nfs/dbraw/zinc/16/22/33/1359162233.db2.gz	GOBUFPGCMNKWHL-FCHUYYIVSA-N	0	3	346.474	3.145	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cccc(OC)c2F)C1	ZINC001086835983	1359210971	/nfs/dbraw/zinc/21/09/71/1359210971.db2.gz	HUJRBSCHHPEBAF-QWHCGFSZSA-N	0	3	340.826	3.075	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@H]3CCCC4(CC4)C3)C2)CC1	ZINC001086923453	1359249263	/nfs/dbraw/zinc/24/92/63/1359249263.db2.gz	RSPLVRPVNIJLAB-ROUUACIJSA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc4occc4c3)C2)CC1	ZINC001086924712	1359250303	/nfs/dbraw/zinc/25/03/03/1359250303.db2.gz	ZTVRVCQEABGHKS-MRXNPFEDSA-N	0	3	336.435	3.383	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc(C(C)C)nc3)C2)CC1	ZINC001086926870	1359252085	/nfs/dbraw/zinc/25/20/85/1359252085.db2.gz	MQXAYXVFRDDCBC-KRWDZBQOSA-N	0	3	339.483	3.155	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc4cc(C)ccc4[nH]3)C2)CC1	ZINC001086936223	1359259578	/nfs/dbraw/zinc/25/95/78/1359259578.db2.gz	LDRVMGCSBFOQTM-QGZVFWFLSA-N	0	3	349.478	3.426	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc4[nH]ccc4c3)C2)CC1	ZINC001086939095	1359261442	/nfs/dbraw/zinc/26/14/42/1359261442.db2.gz	IFNYOROZCWMJIS-INIZCTEOSA-N	0	3	335.451	3.118	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H]3CCCC(F)(F)C3)C2)CC1	ZINC001086941085	1359263139	/nfs/dbraw/zinc/26/31/39/1359263139.db2.gz	IPYZLPHMCROVES-HZPDHXFCSA-N	0	3	338.442	3.148	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H](C)c3ccc(C)o3)C2)CC1	ZINC001086946985	1359267998	/nfs/dbraw/zinc/26/79/98/1359267998.db2.gz	NLBIEVUGCWRAOA-WBVHZDCISA-N	0	3	328.456	3.028	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3ccsc3Cl)C2)CC1	ZINC001086947121	1359268420	/nfs/dbraw/zinc/26/84/20/1359268420.db2.gz	PZDNPOLBOKRZBI-ZDUSSCGKSA-N	0	3	336.888	3.351	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H](C)c3cc(C)oc3C)C2)CC1	ZINC001086949025	1359270147	/nfs/dbraw/zinc/27/01/47/1359270147.db2.gz	PIWRFUBYBWPPRL-RDJZCZTQSA-N	0	3	342.483	3.336	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)Cc3c[nH]c4ccccc34)C2)CC1	ZINC001086954450	1359274562	/nfs/dbraw/zinc/27/45/62/1359274562.db2.gz	LPSHATMEFWLVTP-QGZVFWFLSA-N	0	3	349.478	3.047	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccc(C#N)s1	ZINC001087123650	1359297296	/nfs/dbraw/zinc/29/72/96/1359297296.db2.gz	ULEOLJHDTIEXAD-KFWWJZLASA-N	0	3	333.501	3.383	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccc(C#N)s1)C1CC1	ZINC001087143030	1359304208	/nfs/dbraw/zinc/30/42/08/1359304208.db2.gz	NXXKEHVAZXQICO-FMKPAKJESA-N	0	3	345.512	3.383	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](CNCc2cc(C3CC3)no2)[C@H](C)C1	ZINC001184079193	1387389688	/nfs/dbraw/zinc/38/96/88/1387389688.db2.gz	VBWOYMRWQDSGSF-GDBMZVCRSA-N	0	3	331.460	3.092	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3sccc3C)C(C)(C)[C@H]21	ZINC001087265332	1359334148	/nfs/dbraw/zinc/33/41/48/1359334148.db2.gz	SWDIGPCVPAJRHH-PVAVHDDUSA-N	0	3	330.497	3.299	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(C)oc3C)C(C)(C)[C@@H]21	ZINC001087271180	1359343679	/nfs/dbraw/zinc/34/36/79/1359343679.db2.gz	NLBKKIVSXGWLHP-KBAYOESNSA-N	0	3	328.456	3.139	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc(C)oc3C)C(C)(C)[C@H]21	ZINC001087271181	1359345442	/nfs/dbraw/zinc/34/54/42/1359345442.db2.gz	NLBKKIVSXGWLHP-NJAFHUGGSA-N	0	3	328.456	3.139	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)C3C(C)(C)C3(C)C)C(C)(C)[C@H]21	ZINC001087280056	1359357446	/nfs/dbraw/zinc/35/74/46/1359357446.db2.gz	IXQRZUMYOSXQNC-OIISXLGYSA-N	0	3	330.516	3.297	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)C3C(C)(C)C3(C)C)C(C)(C)[C@@H]21	ZINC001087280054	1359357641	/nfs/dbraw/zinc/35/76/41/1359357641.db2.gz	IXQRZUMYOSXQNC-DJIMGWMZSA-N	0	3	330.516	3.297	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3c(C)coc3C)C(C)(C)[C@@H]21	ZINC001087286264	1359364740	/nfs/dbraw/zinc/36/47/40/1359364740.db2.gz	OPDKCBKBTPQYFN-KBAYOESNSA-N	0	3	328.456	3.139	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc4occc4[nH]3)C(C)(C)[C@H]21	ZINC001087288798	1359367854	/nfs/dbraw/zinc/36/78/54/1359367854.db2.gz	CANHBNJCMCRKLR-XWIAVFTESA-N	0	3	339.439	3.003	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc4cc(C)cn4c3)C(C)(C)[C@H]21	ZINC001087290099	1359369163	/nfs/dbraw/zinc/36/91/63/1359369163.db2.gz	XEVBRBLXWZJQED-AABGKKOBSA-N	0	3	349.478	3.100	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(C)c(F)c3)C(C)(C)[C@@H]21	ZINC001087295592	1359376989	/nfs/dbraw/zinc/37/69/89/1359376989.db2.gz	LHOXQDXPXRCALC-BHIYHBOVSA-N	0	3	342.458	3.376	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc2c(c1)C=CCC2	ZINC001087307776	1359394839	/nfs/dbraw/zinc/39/48/39/1359394839.db2.gz	GQUCEMJOAMVZNQ-QHAWAJNXSA-N	0	3	348.490	3.498	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(C(F)F)o3)C(C)(C)[C@@H]21	ZINC001087316419	1359406586	/nfs/dbraw/zinc/40/65/86/1359406586.db2.gz	RFOHYZFBAVZCIB-KCPJHIHWSA-N	0	3	336.382	3.069	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc(F)cc(F)c1	ZINC001087316045	1359406795	/nfs/dbraw/zinc/40/67/95/1359406795.db2.gz	MAQKIDYYJGQFJA-FGTMMUONSA-N	0	3	346.421	3.207	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(Cl)cn3CC)C(C)(C)[C@@H]21	ZINC001087319362	1359411730	/nfs/dbraw/zinc/41/17/30/1359411730.db2.gz	MMSPIIFOMGCONW-DJIMGWMZSA-N	0	3	347.890	3.013	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc(C4CC4)c3)C(C)(C)[C@H]21	ZINC001087319563	1359412528	/nfs/dbraw/zinc/41/25/28/1359412528.db2.gz	PSWIOQPISRJWOP-AQNXPRMDSA-N	0	3	336.479	3.416	20	30		EGEDHN
CCCC(=O)N1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1CC#Cc1ccccc1	ZINC001087329682	1359418954	/nfs/dbraw/zinc/41/89/54/1359418954.db2.gz	SKLUWBXFJPULRG-BQJUDKOJSA-N	0	3	336.479	3.007	20	30		EGEDHN
C=C(C)CCN1CC[C@H](c2ccc(F)cc2)[C@H](NC(=O)C(F)F)C1	ZINC001087460804	1359476550	/nfs/dbraw/zinc/47/65/50/1359476550.db2.gz	CMKVDUWAXJACMT-HZPDHXFCSA-N	0	3	340.389	3.331	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)[C@@H]2CC=CCC2)CCN1Cc1ccc(C#N)cc1	ZINC001087500638	1359499022	/nfs/dbraw/zinc/49/90/22/1359499022.db2.gz	TXHRVQIXYJKGQG-HSALFYBXSA-N	0	3	337.467	3.384	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(C3CCC3)cc2)[C@H]1CC	ZINC001087676172	1359584841	/nfs/dbraw/zinc/58/48/41/1359584841.db2.gz	ZMKNLMFPVBJOKU-LEWJYISDSA-N	0	3	338.495	3.489	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)C2(c3cccc(F)c3)CCC2)[C@H]1CC	ZINC001087680711	1359587501	/nfs/dbraw/zinc/58/75/01/1359587501.db2.gz	HNTHOEZYSOLRSO-ZWKOTPCHSA-N	0	3	330.447	3.403	20	30		EGEDHN
N#Cc1cccc(CNC2(CNC(=O)c3cccc(C4CC4)c3)CC2)c1	ZINC001323624369	1387410443	/nfs/dbraw/zinc/41/04/43/1387410443.db2.gz	NFMFCTJQKPGRFY-UHFFFAOYSA-N	0	3	345.446	3.488	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cccnc2OC(C)C)[C@H]1CC	ZINC001087853473	1359682316	/nfs/dbraw/zinc/68/23/16/1359682316.db2.gz	RROLUFIWRUUOHE-DLBZAZTESA-N	0	3	331.460	3.028	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CCN(Cc3c(C)noc3C)C[C@H]2C1	ZINC001088093527	1359754001	/nfs/dbraw/zinc/75/40/01/1359754001.db2.gz	ZOLPMTAZVPSLSB-UWVAXJGDSA-N	0	3	345.487	3.174	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CCN(CCC(F)(F)F)C[C@H]3C2)C1	ZINC001088098544	1359755546	/nfs/dbraw/zinc/75/55/46/1359755546.db2.gz	OXVZJGHWDBXTLW-KGLIPLIRSA-N	0	3	330.394	3.075	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CN(C(=O)C4CC5(CC5)C4)C[C@@H]3C2)c1	ZINC001088100746	1359756585	/nfs/dbraw/zinc/75/65/85/1359756585.db2.gz	AELFQFGCCYJNFD-QUCCMNQESA-N	0	3	349.478	3.029	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)[C@@H](F)CC3CCCCC3)C[C@@H]2C1	ZINC001088171547	1359779755	/nfs/dbraw/zinc/77/97/55/1359779755.db2.gz	UXGYLTCYSMYLJD-QYZOEREBSA-N	0	3	334.479	3.099	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)C3(C4CCCCC4)CC3)C[C@@H]2C1	ZINC001088184195	1359785788	/nfs/dbraw/zinc/78/57/88/1359785788.db2.gz	SIZMWSYLHUSOOQ-MSOLQXFVSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](CNCc2ncc(C)s2)[C@H](C)C1	ZINC001184232121	1387417095	/nfs/dbraw/zinc/41/70/95/1387417095.db2.gz	RKLVUWUALCGWFJ-NVXWUHKLSA-N	0	3	347.528	3.219	20	30		EGEDHN
C=C(Br)CN[C@H]1CCCCCN(C(=O)[C@@H](C)SC)C1	ZINC001088267484	1359822326	/nfs/dbraw/zinc/82/23/26/1359822326.db2.gz	VWJMHCPKPFEGLI-OLZOCXBDSA-N	0	3	349.338	3.007	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCCC[C@@H](NCc2ncccc2C)C1	ZINC001088360314	1359844163	/nfs/dbraw/zinc/84/41/63/1359844163.db2.gz	VVCPVAXJFQSXNQ-QGZVFWFLSA-N	0	3	329.488	3.463	20	30		EGEDHN
C=C(Br)CN[C@H]1CCCCCN(C(=O)[C@@H]2C[C@H]2CC)C1	ZINC001088384981	1359866144	/nfs/dbraw/zinc/86/61/44/1359866144.db2.gz	UMPDWWQJLVYWIL-QLFBSQMISA-N	0	3	343.309	3.302	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)Cc2cccc(F)c2)C1	ZINC001088422195	1359891346	/nfs/dbraw/zinc/89/13/46/1359891346.db2.gz	JKBTUERIZYPBHQ-KRWDZBQOSA-N	0	3	338.854	3.482	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2c(C)nsc2C)C1	ZINC001088432224	1359900366	/nfs/dbraw/zinc/90/03/66/1359900366.db2.gz	PDLQXOYUAIGEMD-CQSZACIVSA-N	0	3	341.908	3.487	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)CN(C)c2ccccc2)C1	ZINC001088433349	1359902233	/nfs/dbraw/zinc/90/22/33/1359902233.db2.gz	UMSOLAIIGRZAQC-KRWDZBQOSA-N	0	3	349.906	3.236	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ncoc2-c2ccccc2)[C@H]1C	ZINC001088605898	1359989181	/nfs/dbraw/zinc/98/91/81/1359989181.db2.gz	OOSANIWCWDGLIA-ZBFHGGJFSA-N	0	3	325.412	3.110	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cc(C)n(C(CC)CC)n2)[C@H]1C	ZINC001088687738	1360013761	/nfs/dbraw/zinc/01/37/61/1360013761.db2.gz	PREXMFSYZJNDPF-WBVHZDCISA-N	0	3	332.492	3.321	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cnn(CCCC)c2CC)[C@H]1C	ZINC001088968108	1360118782	/nfs/dbraw/zinc/11/87/82/1360118782.db2.gz	IGKMYWARHHQNJK-WBVHZDCISA-N	0	3	332.492	3.014	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3ccccc3CC)[C@@H]2C)nc1	ZINC001088988394	1360125462	/nfs/dbraw/zinc/12/54/62/1360125462.db2.gz	SOENLXDFTIMLHS-UZLBHIALSA-N	0	3	347.462	3.018	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCCN1C(=O)c1ccccn1	ZINC001089103141	1360168780	/nfs/dbraw/zinc/16/87/80/1360168780.db2.gz	MPQAONZMZGTPHT-IBGZPJMESA-N	0	3	348.450	3.080	20	30		EGEDHN
Cc1nc(CNC[C@H]2CCN(C(=O)C#CC(C)(C)C)C[C@@H]2C)cs1	ZINC001184371395	1387442565	/nfs/dbraw/zinc/44/25/65/1387442565.db2.gz	LZYCISUUQUUQAU-GOEBONIOSA-N	0	3	347.528	3.075	20	30		EGEDHN
CC(C)[C@H](F)C(=O)N1CCCC[C@H]1CN(C)Cc1cccc(C#N)c1	ZINC001089214358	1360259755	/nfs/dbraw/zinc/25/97/55/1360259755.db2.gz	XZVFPMTZMRSHEF-OALUTQOASA-N	0	3	345.462	3.365	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCCN1C(=O)[C@H]1CC12CC2	ZINC001089232970	1360271711	/nfs/dbraw/zinc/27/17/11/1360271711.db2.gz	GGLLXOIJGQXHNU-RBUKOAKNSA-N	0	3	337.467	3.171	20	30		EGEDHN
CC1(C(=O)N[C@H]2CCN(CC#Cc3ccccc3)CC(C)(C)C2)CC1	ZINC001089395382	1360395355	/nfs/dbraw/zinc/39/53/55/1360395355.db2.gz	UTXKSDZBTVRILW-IBGZPJMESA-N	0	3	338.495	3.445	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C[C@@H]2CCC(F)(F)C2)CC(C)(C)C1	ZINC001089403284	1360402518	/nfs/dbraw/zinc/40/25/18/1360402518.db2.gz	QGLGHXJBXPVBSS-GJZGRUSLSA-N	0	3	326.431	3.052	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2nc(C(C)(C)C)cs2)CC(C)(C)C1	ZINC001089410515	1360408316	/nfs/dbraw/zinc/40/83/16/1360408316.db2.gz	QTRRZAJDLXBYHD-AWEZNQCLSA-N	0	3	347.528	3.294	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2c(F)cc(C)cc2F)CC(C)(C)C1	ZINC001089435546	1360426511	/nfs/dbraw/zinc/42/65/11/1360426511.db2.gz	LVAURNFWZYWMPI-AWEZNQCLSA-N	0	3	334.410	3.127	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2ccc(C(F)F)cc2)CC(C)(C)C1	ZINC001089440147	1360430404	/nfs/dbraw/zinc/43/04/04/1360430404.db2.gz	WVBHKHDVALESJO-QGZVFWFLSA-N	0	3	348.437	3.407	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@@H]2CCc3cc(F)ccc32)CC(C)(C)C1	ZINC001089440491	1360430939	/nfs/dbraw/zinc/43/09/39/1360430939.db2.gz	OJVGHDACZZQGDT-PKOBYXMFSA-N	0	3	342.458	3.096	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2c(C)onc2C2CC2)CC(C)(C)C1	ZINC001089441223	1360431611	/nfs/dbraw/zinc/43/16/11/1360431611.db2.gz	WKFRQAHGNMJSDF-INIZCTEOSA-N	0	3	343.471	3.104	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C[C@@H]2CCCC2(F)F)CC(C)(C)C1	ZINC001089478232	1360460800	/nfs/dbraw/zinc/46/08/00/1360460800.db2.gz	SDRWJAQUMISAEI-LSDHHAIUSA-N	0	3	326.431	3.052	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc[nH]c2C2CCC2)CC(C)(C)C1	ZINC001089493069	1360470317	/nfs/dbraw/zinc/47/03/17/1360470317.db2.gz	SONDIRWOWXQQHY-INIZCTEOSA-N	0	3	327.472	3.136	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc(F)cc(Cl)c2)CC(C)(C)C1	ZINC001089501054	1360474920	/nfs/dbraw/zinc/47/49/20/1360474920.db2.gz	YVLTWCZDOIOXGN-MRXNPFEDSA-N	0	3	336.838	3.333	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(C(F)F)cc2)CC(C)(C)C1	ZINC001089516556	1360486691	/nfs/dbraw/zinc/48/66/91/1360486691.db2.gz	GLHWISUKCWCSER-INIZCTEOSA-N	0	3	334.410	3.478	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc(OC)c2F)CC(C)(C)C1	ZINC001089526715	1360490581	/nfs/dbraw/zinc/49/05/81/1360490581.db2.gz	FPTKEKKMRRVVSM-HNNXBMFYSA-N	0	3	346.446	3.078	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cnc(C3CC3)s2)CC(C)(C)C1	ZINC001089539266	1360497424	/nfs/dbraw/zinc/49/74/24/1360497424.db2.gz	JTSACVHJRGWLMZ-OAHLLOKOSA-N	0	3	345.512	3.264	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(C/C=C\Cl)CC(C)(C)C2)cn1	ZINC001089544616	1360500181	/nfs/dbraw/zinc/50/01/81/1360500181.db2.gz	WETIXQMRUFDOCD-VWTAQGJOSA-N	0	3	345.874	3.036	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)[C@H]1CCCO[C@H]1C(C)C	ZINC001089642352	1360555256	/nfs/dbraw/zinc/55/52/56/1360555256.db2.gz	JVFRWZUKIKYFIW-BZSNNMDCSA-N	0	3	336.520	3.230	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cccnc1C(F)F	ZINC001089667076	1360577556	/nfs/dbraw/zinc/57/75/56/1360577556.db2.gz	AMLWZBGJOYQWSE-AWEZNQCLSA-N	0	3	349.425	3.263	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)[C@H]1CCc2cccnc21	ZINC001089687069	1360592529	/nfs/dbraw/zinc/59/25/29/1360592529.db2.gz	DTBOARCSZMBLME-ROUUACIJSA-N	0	3	341.499	3.294	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1oc(C(C)C)nc1C	ZINC001089709726	1360614344	/nfs/dbraw/zinc/61/43/44/1360614344.db2.gz	WMZPPMDEBFOLNU-INIZCTEOSA-N	0	3	345.487	3.350	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc2c([nH]1)CCCC2	ZINC001089720485	1360622641	/nfs/dbraw/zinc/62/26/41/1360622641.db2.gz	YILQCLCTLJDFHC-MRXNPFEDSA-N	0	3	329.488	3.300	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(C)n(C)c1C	ZINC001089731489	1360635379	/nfs/dbraw/zinc/63/53/79/1360635379.db2.gz	RGAWYGXHZNAWHE-QGZVFWFLSA-N	0	3	331.504	3.438	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(Cl)cn1CC	ZINC001089732006	1360636327	/nfs/dbraw/zinc/63/63/27/1360636327.db2.gz	JSRFMLRWWPYHHI-MRXNPFEDSA-N	0	3	349.906	3.405	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)Cc1ccc(C)o1	ZINC001089797109	1360668050	/nfs/dbraw/zinc/66/80/50/1360668050.db2.gz	JVWUGLIFBRGSFG-RANZSIQMSA-N	0	3	348.874	3.052	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1(F)CCCC1	ZINC001089832808	1360685346	/nfs/dbraw/zinc/68/53/46/1360685346.db2.gz	ZQCIYOTVKLRPGK-JONQDZQNSA-N	0	3	340.870	3.190	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2c(C)coc2C)CC2(CCOCC2)C1	ZINC001089939628	1360755040	/nfs/dbraw/zinc/75/50/40/1360755040.db2.gz	VLMBNSMRZAYNLH-QGZVFWFLSA-N	0	3	346.471	3.073	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)[C@H]2CCCC23CC3)CC2(CCOCC2)C1	ZINC001089943881	1360756954	/nfs/dbraw/zinc/75/69/54/1360756954.db2.gz	VJZMVDHKWRRDQT-ZWKOTPCHSA-N	0	3	346.515	3.130	20	30		EGEDHN
CCCN(C)CC(=O)N[C@H](C)CCCCNc1cccc(F)c1C#N	ZINC001090102349	1360825873	/nfs/dbraw/zinc/82/58/73/1360825873.db2.gz	IPNJFGQZFDLBHO-OAHLLOKOSA-N	0	3	348.466	3.126	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2coc3c2cccc3OC)C1	ZINC001091029551	1360982734	/nfs/dbraw/zinc/98/27/34/1360982734.db2.gz	MJOCOOHIBUZVCZ-UHFFFAOYSA-N	0	3	348.830	3.292	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cnc3c(F)cccc3c2)C1	ZINC001091146034	1360997662	/nfs/dbraw/zinc/99/76/62/1360997662.db2.gz	ORKNBSYQPHCARC-UHFFFAOYSA-N	0	3	347.821	3.224	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cccc3ncccc32)C1	ZINC001091170942	1361000589	/nfs/dbraw/zinc/00/05/89/1361000589.db2.gz	VJCVTJRZUOLLJE-UHFFFAOYSA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(C)c(Cl)c2)C1	ZINC001091214376	1361009598	/nfs/dbraw/zinc/00/95/98/1361009598.db2.gz	JWMJHYMRGDVNJD-UHFFFAOYSA-N	0	3	327.255	3.499	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(F)c(Cl)c2F)C1	ZINC001091216740	1361010742	/nfs/dbraw/zinc/01/07/42/1361010742.db2.gz	CUZNQSOKBHSZMG-UHFFFAOYSA-N	0	3	349.208	3.469	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cnc3ccccc3c2)C1	ZINC001091258293	1361024186	/nfs/dbraw/zinc/02/41/86/1361024186.db2.gz	IMGOIJUWRFDONO-UHFFFAOYSA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cccc(-c3cnco3)c2)C1	ZINC001091306335	1361037588	/nfs/dbraw/zinc/03/75/88/1361037588.db2.gz	IWIMEQNQTPMECJ-UHFFFAOYSA-N	0	3	345.830	3.192	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc(C)c(CC)s2)C1	ZINC001091356202	1361058615	/nfs/dbraw/zinc/05/86/15/1361058615.db2.gz	MTIXRAYSFUQNCD-UHFFFAOYSA-N	0	3	326.893	3.469	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cncc3ccccc32)C1	ZINC001091377740	1361068259	/nfs/dbraw/zinc/06/82/59/1361068259.db2.gz	XIOVIQQPIPNBFD-UHFFFAOYSA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2[nH]c3ccccc3c2OC)C1	ZINC001091381739	1361071440	/nfs/dbraw/zinc/07/14/40/1361071440.db2.gz	CZWMMFKYGVPJTD-UHFFFAOYSA-N	0	3	347.846	3.027	20	30		EGEDHN
CCN(CCNC(=O)[C@H](C)C#N)[C@@H](C)c1ccc(F)c(Cl)c1	ZINC001480968386	1393054176	/nfs/dbraw/zinc/05/41/76/1393054176.db2.gz	WIKMLKBSTBJJRI-NEPJUHHUSA-N	0	3	325.815	3.138	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3csc4cc(C)ccc43)C[C@]2(C)C1	ZINC001091703214	1361185754	/nfs/dbraw/zinc/18/57/54/1361185754.db2.gz	OEFNVWQKGDHQHT-QRWLVFNGSA-N	0	3	338.476	3.237	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3ccc(C(C)(C)CC)cc3)C[C@]2(C)C1	ZINC001091768915	1361215368	/nfs/dbraw/zinc/21/53/68/1361215368.db2.gz	ZOFGGJFSAQUVOQ-KNQAVFIVSA-N	0	3	338.495	3.401	20	30		EGEDHN
C[C@@]12CN(Cc3ccc(C#N)cc3)C[C@@H]1CN(C(=O)C1CC3(CC3)C1)C2	ZINC001092001399	1361271614	/nfs/dbraw/zinc/27/16/14/1361271614.db2.gz	YATOVEIBGQOHHV-CTNGQTDRSA-N	0	3	349.478	3.029	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CNC(=O)C1CC(C)(C)C1	ZINC001092586060	1361417057	/nfs/dbraw/zinc/41/70/57/1361417057.db2.gz	VRSVPAMYHLMUHM-UKRRQHHQSA-N	0	3	345.512	3.240	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CN(Cc3conc3CC)C[C@H]2C)CC1	ZINC001092940519	1361490931	/nfs/dbraw/zinc/49/09/31/1361490931.db2.gz	QIWCGFIUBAMFNN-NVXWUHKLSA-N	0	3	345.487	3.168	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)[C@@H]2CCCC23CC3)CC1	ZINC001093372509	1361581983	/nfs/dbraw/zinc/58/19/83/1361581983.db2.gz	DYVLHGHZRBQIJO-RBUKOAKNSA-N	0	3	340.511	3.293	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)c2ccc(CC)o2)CC1	ZINC001093373785	1361583538	/nfs/dbraw/zinc/58/35/38/1361583538.db2.gz	SEZRPMPFJCIEBQ-LJQANCHMSA-N	0	3	340.467	3.182	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@@H]2C[C@H]2C(C)(C)C)CC1	ZINC001093373878	1361583978	/nfs/dbraw/zinc/58/39/78/1361583978.db2.gz	TXGNWDSMKBBJOX-QRVBRYPASA-N	0	3	342.527	3.395	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C2(CC)CCC2)CC1	ZINC001093375900	1361586608	/nfs/dbraw/zinc/58/66/08/1361586608.db2.gz	DTWIDRPROGNIGO-GOSISDBHSA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C2CC3(CCC3)C2)CC1	ZINC001093376534	1361587024	/nfs/dbraw/zinc/58/70/24/1361587024.db2.gz	LIBPHBFXOMKHOJ-LJQANCHMSA-N	0	3	340.511	3.293	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C(C)(C)C(F)F)CC1	ZINC001093378485	1361589397	/nfs/dbraw/zinc/58/93/97/1361589397.db2.gz	PAJZEEMPUFSOOC-OAHLLOKOSA-N	0	3	338.442	3.004	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3nc4ccccc4cc3C)CCC[C@@H]12	ZINC001094470899	1361818039	/nfs/dbraw/zinc/81/80/39/1361818039.db2.gz	AOCYWCXGLICXMF-DENIHFKCSA-N	0	3	347.462	3.151	20	30		EGEDHN
CCCCCCN(C)CC(=O)NCCCNc1cccc(F)c1C#N	ZINC001094539105	1361850119	/nfs/dbraw/zinc/85/01/19/1361850119.db2.gz	HGEWGRVZOKRACD-UHFFFAOYSA-N	0	3	348.466	3.128	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1C[C@H]2C[C@@H](C1)N(C(=O)CC1CCC1)C2	ZINC001094887713	1361934372	/nfs/dbraw/zinc/93/43/72/1361934372.db2.gz	JVYRUXSLHBRVLD-VDGAXYAQSA-N	0	3	337.467	3.218	20	30		EGEDHN
N#CCOc1cccc(CN[C@@H](c2nnc[nH]2)C2CCCCC2)c1	ZINC001324130565	1387545989	/nfs/dbraw/zinc/54/59/89/1387545989.db2.gz	UXAADYCHOWRSEL-QGZVFWFLSA-N	0	3	325.416	3.118	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1c(C)noc1CCC)C2	ZINC001095406372	1362130543	/nfs/dbraw/zinc/13/05/43/1362130543.db2.gz	XCBKATBZMIFGKM-PMPSAXMXSA-N	0	3	331.460	3.237	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc(-c3ccccc3)no1)C2	ZINC001095674595	1362200161	/nfs/dbraw/zinc/20/01/61/1362200161.db2.gz	AALRKNMBMFDCLV-NJAFHUGGSA-N	0	3	337.423	3.253	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc(C)cc(OC)c1C)C2	ZINC001095692176	1362203101	/nfs/dbraw/zinc/20/31/01/1362203101.db2.gz	HLKNBNHMQNGJLE-NJAFHUGGSA-N	0	3	328.456	3.223	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cnc(CC3CC3)s1)C2	ZINC001095808863	1362239638	/nfs/dbraw/zinc/23/96/38/1362239638.db2.gz	DIIWSOXHOJEERL-PMPSAXMXSA-N	0	3	345.512	3.397	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc(C)c(Cl)cc1C)C2	ZINC001095858589	1362257641	/nfs/dbraw/zinc/25/76/41/1362257641.db2.gz	ARJHWZTVEZABNB-JLSDUUJJSA-N	0	3	330.859	3.315	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H]1C[C@H]1c1ccc(OC)cc1)C2	ZINC001096132520	1362399404	/nfs/dbraw/zinc/39/94/04/1362399404.db2.gz	OAWCQBVOVLCARZ-XZEJUNMKSA-N	0	3	340.467	3.096	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@]1(C)CCc3ccccc3C1)C2	ZINC001096688457	1362639454	/nfs/dbraw/zinc/63/94/54/1362639454.db2.gz	WLWOSGHUGIYYGL-FCIYXJNOSA-N	0	3	338.495	3.479	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](N[C@H](C)c2ccc(F)c(F)c2)C1	ZINC001185006783	1387588638	/nfs/dbraw/zinc/58/86/38/1387588638.db2.gz	GGXKUCWOSIBCDX-GDBMZVCRSA-N	0	3	334.410	3.410	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(-c3cc[nH]n3)s1)C2	ZINC001097276122	1362910384	/nfs/dbraw/zinc/91/03/84/1362910384.db2.gz	SJSXCDFMIGSAQP-YUELXQCFSA-N	0	3	342.468	3.049	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1c(C)cccc1Cl)C2	ZINC001097435063	1362986010	/nfs/dbraw/zinc/98/60/10/1362986010.db2.gz	ICUVHISCUHWNSA-OLMNPRSZSA-N	0	3	332.875	3.489	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H]1COc3ccc(Cl)cc31)C2	ZINC001097544500	1363052771	/nfs/dbraw/zinc/05/27/71/1363052771.db2.gz	ALZROVVHGYGUGB-DZUCGIPZSA-N	0	3	346.858	3.114	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cncc3sccc31)C2	ZINC001097705301	1363105671	/nfs/dbraw/zinc/10/56/71/1363105671.db2.gz	KWKHQHJICIZHIM-WQVCFCJDSA-N	0	3	327.453	3.208	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@H](CNCc3cc(C)no3)[C@@H](C)C2)CC1	ZINC001185094959	1387617490	/nfs/dbraw/zinc/61/74/90/1387617490.db2.gz	MTEKTQPFAFQANB-DOTOQJQBSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](CNCc3cc(C)no3)[C@@H](C)C2)CCC1	ZINC001185095466	1387617475	/nfs/dbraw/zinc/61/74/75/1387617475.db2.gz	PVBLIIRQUQVJFS-RDJZCZTQSA-N	0	3	345.487	3.304	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1coc3cc(C)ccc13)C2	ZINC001098335742	1363302718	/nfs/dbraw/zinc/30/27/18/1363302718.db2.gz	HMSZNNLXXGQXRZ-QRQLOZEOSA-N	0	3	336.435	3.029	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc3cccc(F)c3o1)C2	ZINC001098444933	1363327312	/nfs/dbraw/zinc/32/73/12/1363327312.db2.gz	YZSIFJMYXKCQLZ-BMFZPTHFSA-N	0	3	328.387	3.483	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc3ccccc3n1CC)C2	ZINC001098458734	1363332183	/nfs/dbraw/zinc/33/21/83/1363332183.db2.gz	ZTGLGLUPYOVBBR-LMMKCTJWSA-N	0	3	335.451	3.020	20	30		EGEDHN
CCCCCCCNCc1cn([C@@H]2CCN(C(=O)[C@H](C)CC)C2)nn1	ZINC001098622442	1363403711	/nfs/dbraw/zinc/40/37/11/1363403711.db2.gz	JAWSVLXKBMXEFZ-SJLPKXTDSA-N	0	3	349.523	3.158	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1CCCC1(C)C)C[C@@H](C)O2	ZINC001098627111	1363405895	/nfs/dbraw/zinc/40/58/95/1363405895.db2.gz	JHRYERFWZSTFDZ-IAGOWNOFSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccccc1Cl)C[C@H](C)O2	ZINC001098656416	1363421519	/nfs/dbraw/zinc/42/15/19/1363421519.db2.gz	RERBBRPWQPYXOL-HNNXBMFYSA-N	0	3	348.874	3.222	20	30		EGEDHN
C=CCCCNCc1cn([C@@H]2CCN(C(=O)CCCCCC)C2)nn1	ZINC001098780472	1363465315	/nfs/dbraw/zinc/46/53/15/1363465315.db2.gz	WMRPNYTXVOJNRX-GOSISDBHSA-N	0	3	347.507	3.078	20	30		EGEDHN
CC1(C)CC[C@H](CNC(=O)CSCC#N)N(CC2=CCCCC2)C1	ZINC001098921434	1363521817	/nfs/dbraw/zinc/52/18/17/1363521817.db2.gz	JAPQFKLETLPWQW-QGZVFWFLSA-N	0	3	349.544	3.350	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)Cn2cc(C)c3ccccc32)C1	ZINC001099074990	1363609302	/nfs/dbraw/zinc/60/93/02/1363609302.db2.gz	FLFHDEOYQASBAQ-UWJYYQICSA-N	0	3	337.467	3.106	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ncc(Cl)cc2Cl)C1	ZINC001099095246	1363619338	/nfs/dbraw/zinc/61/93/38/1363619338.db2.gz	PRPZLYKWLOQEJW-ZBEGNZNMSA-N	0	3	340.254	3.159	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H](CC(C)C)n1ccnc1	ZINC001099117084	1363633568	/nfs/dbraw/zinc/63/35/68/1363633568.db2.gz	ZKNFVTPVZKUSBR-MSOLQXFVSA-N	0	3	346.519	3.263	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)C(C)(C)c1cccnc1	ZINC001099130008	1363641363	/nfs/dbraw/zinc/64/13/63/1363641363.db2.gz	GGUFKJRNSULDRC-QGZVFWFLSA-N	0	3	329.488	3.152	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)Cc1cc(C)ccc1OC	ZINC001099135379	1363646858	/nfs/dbraw/zinc/64/68/58/1363646858.db2.gz	JUTZUEDZCQNVPJ-SFHVURJKSA-N	0	3	344.499	3.339	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)C2CCC(C3CC3)CC2)C1	ZINC001099142993	1363652111	/nfs/dbraw/zinc/65/21/11/1363652111.db2.gz	HIDXOABIRRUNKO-XSNSTOHYSA-N	0	3	328.500	3.197	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(F)c3occc32)C1	ZINC001099168733	1363667254	/nfs/dbraw/zinc/66/72/54/1363667254.db2.gz	HMUGUICTJCDVPQ-XOBRGWDASA-N	0	3	340.398	3.180	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)C2CC(c3cccc(F)c3)C2)C1	ZINC001099186401	1363679739	/nfs/dbraw/zinc/67/97/39/1363679739.db2.gz	BNBOFJXRYIRJAP-XVAHUTHZSA-N	0	3	342.458	3.476	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)CCOc1ccc(F)cc1	ZINC001099208286	1363693096	/nfs/dbraw/zinc/69/30/96/1363693096.db2.gz	PUPXVAQJFAXQKK-KRWDZBQOSA-N	0	3	348.462	3.387	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)C2=CCCCCC2)C[C@H]1C(F)(F)F	ZINC001099243565	1363710506	/nfs/dbraw/zinc/71/05/06/1363710506.db2.gz	YHYFSEQTJHJHIT-HUUCEWRRSA-N	0	3	330.394	3.432	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H](C)c1c(C)noc1C	ZINC001099271363	1363725907	/nfs/dbraw/zinc/72/59/07/1363725907.db2.gz	XEEXFZLSYGJXJB-WMLDXEAASA-N	0	3	345.487	3.025	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2ccc(CC)o2)C[C@H]1C(F)(F)F	ZINC001099272263	1363726113	/nfs/dbraw/zinc/72/61/13/1363726113.db2.gz	MVCZQPBLWGQUFA-CHWSQXEVSA-N	0	3	330.350	3.011	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@H](C)c2ccccc2F)C[C@H]1C(F)(F)F	ZINC001099322952	1363750076	/nfs/dbraw/zinc/75/00/76/1363750076.db2.gz	MQMFWGJUTGWATK-UXIGCNINSA-N	0	3	344.352	3.094	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)C(C)(C)C(F)(F)F)C[C@H]1C(F)(F)F	ZINC001099334146	1363756403	/nfs/dbraw/zinc/75/64/03/1363756403.db2.gz	ISODNNBWANKIGW-NXEZZACHSA-N	0	3	346.315	3.130	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2ocnc2C)C1	ZINC001099488773	1363817222	/nfs/dbraw/zinc/81/72/22/1363817222.db2.gz	ANNCFEUATRXGRN-VDGAXYAQSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1(CCF)CC1	ZINC001099507266	1363825016	/nfs/dbraw/zinc/82/50/16/1363825016.db2.gz	ZKOYYNCEDSGYTD-JONQDZQNSA-N	0	3	340.870	3.048	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)CCCC#CC	ZINC001099513494	1363828289	/nfs/dbraw/zinc/82/82/89/1363828289.db2.gz	PXRMZHVCWCHXLC-FJIDUMEYSA-N	0	3	334.891	3.101	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@H]1CN(CC(=C)C)CC2(CCOCC2)C1	ZINC001099588890	1363870142	/nfs/dbraw/zinc/87/01/42/1363870142.db2.gz	LKCLOSPDMXJDGO-QZTJIDSGSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C2(CCC)CC2)CC2(CCOCC2)C1	ZINC001099590494	1363872618	/nfs/dbraw/zinc/87/26/18/1363872618.db2.gz	CAEAZMKSKCVVNF-QGZVFWFLSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1CN(CC(=C)C)CC2(CCOCC2)C1	ZINC001099593082	1363875826	/nfs/dbraw/zinc/87/58/26/1363875826.db2.gz	QRFQJZWVOCKIAL-QGZVFWFLSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CCN(Cc2ccc(C(C)C)cc2)C[C@H]1O	ZINC001099975784	1363994445	/nfs/dbraw/zinc/99/44/45/1363994445.db2.gz	GXLYLFVDBKMUQR-WOJBJXKFSA-N	0	3	344.499	3.218	20	30		EGEDHN
C=CC1(CC(=O)N[C@H]2CCN(CC=C(C)C)C[C@@H]2O)CCCCC1	ZINC001100034526	1364003270	/nfs/dbraw/zinc/00/32/70/1364003270.db2.gz	RVRDJAUSICOCNF-ROUUACIJSA-N	0	3	334.504	3.031	20	30		EGEDHN
CCCCCCCCCCC(=O)N[C@@H]1CCN(CCCF)C[C@@H]1O	ZINC001100083616	1364011725	/nfs/dbraw/zinc/01/17/25/1364011725.db2.gz	UTWXLNGLQGHGNO-MSOLQXFVSA-N	0	3	344.515	3.428	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)CC(C)(C)C)C[C@H]1c1ccc(OC)cc1	ZINC001100151312	1364027480	/nfs/dbraw/zinc/02/74/80/1364027480.db2.gz	CQTXDAGZYVPZON-RBUKOAKNSA-N	0	3	342.483	3.039	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C[C@@H]2C[C@H]2c2ccccc2)C1	ZINC001100339745	1364084474	/nfs/dbraw/zinc/08/44/74/1364084474.db2.gz	YAMOSEWNUNEICF-STCOUPBVSA-N	0	3	332.875	3.417	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NCC1CC(NCc2ccccc2F)C1)OCC	ZINC001100376778	1364096152	/nfs/dbraw/zinc/09/61/52/1364096152.db2.gz	YVIGXXLNLHVPNI-GXOAENINSA-N	0	3	348.462	3.181	20	30		EGEDHN
C[C@H](C(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1)C1CCC1	ZINC001100436597	1364113593	/nfs/dbraw/zinc/11/35/93/1364113593.db2.gz	DMCVJOVDZUFKJI-UQHVZDHRSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)C[C@H]2C=CCCC2)C1	ZINC001100439303	1364115424	/nfs/dbraw/zinc/11/54/24/1364115424.db2.gz	WBBNMMIATZUKQE-NFOMZHRRSA-N	0	3	341.293	3.126	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC1CC(NCc2cccc(OCC)n2)C1	ZINC001100560870	1364162666	/nfs/dbraw/zinc/16/26/66/1364162666.db2.gz	OQBFQCDKNJPGGS-UHFFFAOYSA-N	0	3	345.487	3.067	20	30		EGEDHN
C#CCCCCCC(=O)NCC1CC(NCc2c(C)noc2CC)C1	ZINC001100570420	1364167444	/nfs/dbraw/zinc/16/74/44/1364167444.db2.gz	SFIQIUGQPYFNHC-UHFFFAOYSA-N	0	3	345.487	3.114	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCC1CC(NCc2cc(F)ccc2OC)C1	ZINC001100596773	1364181700	/nfs/dbraw/zinc/18/17/00/1364181700.db2.gz	CXQQUOANTHLACZ-KSTDHSDQSA-N	0	3	348.462	3.421	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)CCC(C)(C)C)C1	ZINC001100769567	1364253614	/nfs/dbraw/zinc/25/36/14/1364253614.db2.gz	PYOGRITWYKPKNY-UHFFFAOYSA-N	0	3	331.298	3.206	20	30		EGEDHN
Cc1cc(CN2C[C@@H]3CN(C(=O)C#CC(C)(C)C)C[C@]3(C)C2)cs1	ZINC001101232339	1364477327	/nfs/dbraw/zinc/47/73/27/1364477327.db2.gz	QTLQTOXSGNHCMC-XLIONFOSSA-N	0	3	344.524	3.386	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@H]2CN(Cc3scnc3C)C[C@@]2(C)C1	ZINC001101336597	1364515601	/nfs/dbraw/zinc/51/56/01/1364515601.db2.gz	JYJZNRDVXPALNF-GMBSWORKSA-N	0	3	347.528	3.334	20	30		EGEDHN
C=CC[C@H](C(=O)N1C[C@H]2CN(CC#CC)C[C@@]2(C)C1)c1ccccc1	ZINC001101469352	1364574090	/nfs/dbraw/zinc/57/40/90/1364574090.db2.gz	MPPBRUFGCCKLNX-URVUXULASA-N	0	3	336.479	3.150	20	30		EGEDHN
CCC(=O)N1CCC(C(C)(C)CNCc2cc(F)ccc2C#N)CC1	ZINC001101496919	1364581874	/nfs/dbraw/zinc/58/18/74/1364581874.db2.gz	IWMVNBLRVPVFQL-UHFFFAOYSA-N	0	3	345.462	3.462	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC(C(C)(C)CNCc2nccn2C)CC1	ZINC001101545925	1364610406	/nfs/dbraw/zinc/61/04/06/1364610406.db2.gz	ZBQSOXUPLKAMKN-UHFFFAOYSA-N	0	3	346.519	3.131	20	30		EGEDHN
C=CCCCC(=O)N1CCC(C(C)(C)CNCc2ccon2)CC1	ZINC001101567994	1364623610	/nfs/dbraw/zinc/62/36/10/1364623610.db2.gz	JHYBRCCYCHURPK-UHFFFAOYSA-N	0	3	333.476	3.385	20	30		EGEDHN
C=CCC[C@@H](C)N1CC2(C1)C[C@@H](NC(=O)C(F)=C(C)C)c1nccn12	ZINC001101622861	1364659967	/nfs/dbraw/zinc/65/99/67/1364659967.db2.gz	RQOPBQOJOOUOPL-HUUCEWRRSA-N	0	3	346.450	3.073	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CC2(CN(C[C@@H](C)CC)C2)n2ccnc21	ZINC001101646677	1364669366	/nfs/dbraw/zinc/66/93/66/1364669366.db2.gz	UKLMRSUNWFFSAG-JKSUJKDBSA-N	0	3	344.503	3.103	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H]1CN(Cc2cnn(C(C)(C)C)c2)C[C@H]1C	ZINC001102011558	1364811629	/nfs/dbraw/zinc/81/16/29/1364811629.db2.gz	FFYOFOZAQJQLNU-SJLPKXTDSA-N	0	3	346.519	3.179	20	30		EGEDHN
C=C/C(C)=C\CC(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001102244394	1364958701	/nfs/dbraw/zinc/95/87/01/1364958701.db2.gz	GZDDATAZQCYRCM-MUBWJSQFSA-N	0	3	343.496	3.326	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@@H]1CN(Cc2oc(C)nc2C)C[C@H]1C	ZINC001102262552	1364974465	/nfs/dbraw/zinc/97/44/65/1364974465.db2.gz	DLOWYCCAVYIQMH-XOKHGSTOSA-N	0	3	333.476	3.078	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@@H]1CN(Cc2cnc(C)s2)C[C@H]1C	ZINC001102263235	1364975392	/nfs/dbraw/zinc/97/53/92/1364975392.db2.gz	ZJOIGLYKRPFDGV-VNQPRFMTSA-N	0	3	335.517	3.238	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CNC(=O)C(C)(C)C1CC1	ZINC001102264625	1364976028	/nfs/dbraw/zinc/97/60/28/1364976028.db2.gz	SDPRBNBVLAVMRF-ZIAGYGMSSA-N	0	3	345.512	3.240	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@H]2CN(Cc3c(C)noc3CC)C[C@H]2C)C1	ZINC001102349873	1365016145	/nfs/dbraw/zinc/01/61/45/1365016145.db2.gz	YLEUEZAZFWABLM-GDBMZVCRSA-N	0	3	345.487	3.086	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](NCc3cc(F)cc(F)c3)C2)CCC1	ZINC001185462902	1387721977	/nfs/dbraw/zinc/72/19/77/1387721977.db2.gz	FKEKDOKSUSACNP-QGZVFWFLSA-N	0	3	334.410	3.402	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](NCc3cc(C)ccc3OC)C2)CCC1	ZINC001185469385	1387723344	/nfs/dbraw/zinc/72/33/44/1387723344.db2.gz	URNQMTRFSNTJKU-GOSISDBHSA-N	0	3	342.483	3.441	20	30		EGEDHN
C=C(C)CCC(=O)NCC[C@@H]1CN(Cc2cncc(F)c2)C[C@H]1C	ZINC001103040324	1365350518	/nfs/dbraw/zinc/35/05/18/1365350518.db2.gz	QAJLAZAIYRFDDT-NVXWUHKLSA-N	0	3	333.451	3.151	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)C[C@H](OCC)C(C)C)C1	ZINC001103082659	1365370122	/nfs/dbraw/zinc/37/01/22/1365370122.db2.gz	XWATZGMMRVCQIW-OIISXLGYSA-N	0	3	344.927	3.264	20	30		EGEDHN
CC(C)SCC(=O)N1CC[C@@](C)(CNCc2ccccc2C#N)C1	ZINC001324695915	1387741081	/nfs/dbraw/zinc/74/10/81/1387741081.db2.gz	UCJNRESWSQPMLQ-IBGZPJMESA-N	0	3	345.512	3.028	20	30		EGEDHN
C=CC(C)(C)C(=O)NCC[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1C	ZINC001103311621	1365487606	/nfs/dbraw/zinc/48/76/06/1365487606.db2.gz	DMTDHGQKMVOSGG-SJLPKXTDSA-N	0	3	339.483	3.345	20	30		EGEDHN
C=CC(C)(C)C(=O)NCC[C@@H]1CN(Cc2cc(C3CC3)no2)C[C@H]1C	ZINC001103313639	1365488790	/nfs/dbraw/zinc/48/87/90/1365488790.db2.gz	TYJKRADKBJJHBC-GDBMZVCRSA-N	0	3	345.487	3.338	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CCNC(=O)C1(C)CCC1	ZINC001103322080	1365493038	/nfs/dbraw/zinc/49/30/38/1365493038.db2.gz	IWPVRISMNVLUJI-HUUCEWRRSA-N	0	3	345.512	3.384	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)[C@H](CCC)OCC)C1	ZINC001103343107	1365509306	/nfs/dbraw/zinc/50/93/06/1365509306.db2.gz	MUYYJDBUJUSTIW-BMFZPTHFSA-N	0	3	330.900	3.018	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)[C@@H]2Cc3ccccc32)C1	ZINC001103383616	1365527838	/nfs/dbraw/zinc/52/78/38/1365527838.db2.gz	DZUVTBQUIFDWQT-MZMPZRCHSA-N	0	3	332.875	3.153	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2c[nH]cc2C2CC2)C1	ZINC001103590268	1365656856	/nfs/dbraw/zinc/65/68/56/1365656856.db2.gz	XPNDEOCKSYQKQB-IUODEOHRSA-N	0	3	335.879	3.332	20	30		EGEDHN
CC[C@@H](C)C(=O)N1C[C@@H](C)[C@H](CCNCc2cc(C#N)ccc2F)C1	ZINC001103904498	1365828960	/nfs/dbraw/zinc/82/89/60/1365828960.db2.gz	HEDHOONLHJRYIR-BFYDXBDKSA-N	0	3	345.462	3.318	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@H](CCNCc2ccccc2C#N)C1	ZINC001103979280	1365857902	/nfs/dbraw/zinc/85/79/02/1365857902.db2.gz	IKIHCADCTIAQGF-VQIMIIECSA-N	0	3	325.456	3.099	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CC=CC2)C[C@H]1CCNCc1ccccc1C#N	ZINC001104023937	1365879619	/nfs/dbraw/zinc/87/96/19/1365879619.db2.gz	GNTAAUQITPXEJK-OXQOHEQNSA-N	0	3	337.467	3.099	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CN(C(=O)/C=C(\C)CC)C[C@H]1C	ZINC001104159872	1365930460	/nfs/dbraw/zinc/93/04/60/1365930460.db2.gz	DIPLGSIZKHOTEZ-OSEPDQNXSA-N	0	3	343.309	3.326	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@H](CCNCc2ccc(F)cn2)C1	ZINC001104485721	1366044791	/nfs/dbraw/zinc/04/47/91/1366044791.db2.gz	KPQBYJBAFQXCKV-HZPDHXFCSA-N	0	3	347.478	3.397	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(c2ccccc2)C[C@H](NC(=O)c2cc[nH]c2)C1	ZINC001105425189	1366461055	/nfs/dbraw/zinc/46/10/55/1366461055.db2.gz	AQQLHGVCQWJPCI-IZAXUBKRSA-N	0	3	343.858	3.187	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](CNCc2csc(C3CC3)n2)[C@H](C)C1	ZINC001105926688	1366599244	/nfs/dbraw/zinc/59/92/44/1366599244.db2.gz	BPAPNVIDOTXAHZ-UKRRQHHQSA-N	0	3	333.501	3.171	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H](CNCc2ncc(C)s2)[C@H](C)C1	ZINC001106175541	1366616634	/nfs/dbraw/zinc/61/66/34/1366616634.db2.gz	JPFBIWVGSLXFJK-RHSMWYFYSA-N	0	3	347.528	3.404	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H](CNCc2ccn(C(C)C)n2)[C@H](C)C1	ZINC001106563658	1366737428	/nfs/dbraw/zinc/73/74/28/1366737428.db2.gz	HPMDIGKZHRWODQ-KZNAEPCWSA-N	0	3	346.519	3.250	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](CNCc2csc(CC)n2)[C@H](C)C1	ZINC001106612883	1366755088	/nfs/dbraw/zinc/75/50/88/1366755088.db2.gz	RCEFJHQYZNELMB-HUUCEWRRSA-N	0	3	335.517	3.246	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](CNCc3cnc(C)o3)[C@H](C)C2)CCCC1	ZINC001107099981	1366874947	/nfs/dbraw/zinc/87/49/47/1366874947.db2.gz	QLMZBFVKHMFBNM-NVXWUHKLSA-N	0	3	345.487	3.304	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@]3(CNC(=O)CC4CC4)CCC[C@@H]23)s1	ZINC001107253833	1366905091	/nfs/dbraw/zinc/90/50/91/1366905091.db2.gz	IWIRCUMVMKOKHL-IEBWSBKVSA-N	0	3	343.496	3.281	20	30		EGEDHN
Cc1ccc(F)c(CN2CC[C@@]3(CNC(=O)[C@@H](C)C#N)CCC[C@@H]23)c1	ZINC001107336068	1366931814	/nfs/dbraw/zinc/93/18/14/1366931814.db2.gz	GWGBEOOISJDXQM-QKYXUNIQSA-N	0	3	343.446	3.155	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@]12CCC[C@H]1N(Cc1cnc(C)o1)CC2	ZINC001107424483	1366960467	/nfs/dbraw/zinc/96/04/67/1366960467.db2.gz	QFMWQTOCQKKVPK-IEBWSBKVSA-N	0	3	331.460	3.200	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@]12CCC[C@H]1N(Cc1cnc(C)o1)CC2	ZINC001107514865	1367012897	/nfs/dbraw/zinc/01/28/97/1367012897.db2.gz	AAAPHLNGLJYCCS-YVWKXTFCSA-N	0	3	345.487	3.446	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@]12CCC[C@H]1N(Cc1cnc(C)o1)CC2	ZINC001107514344	1367013160	/nfs/dbraw/zinc/01/31/60/1367013160.db2.gz	BZBVUTGSXITOLL-QKYXUNIQSA-N	0	3	345.487	3.446	20	30		EGEDHN
CC(C)c1ccccc1CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C#CC1CC1)C2	ZINC001109257816	1367028964	/nfs/dbraw/zinc/02/89/64/1367028964.db2.gz	NXZSWYJLSXVAPQ-GIVPXCGWSA-N	0	3	336.479	3.445	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)COC/C=C\c1ccccc1)C2	ZINC001109440309	1367121623	/nfs/dbraw/zinc/12/16/23/1367121623.db2.gz	OAEVMSZQHUYILI-QVYSETLCSA-N	0	3	340.467	3.014	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](N(C)CCOc2cccc(Cl)c2)C1	ZINC001189926982	1367133816	/nfs/dbraw/zinc/13/38/16/1367133816.db2.gz	VJOBUCKJIMZNJT-KRWDZBQOSA-N	0	3	348.874	3.055	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@@H](C)c1c(C)noc1C)C2	ZINC001109462850	1367136515	/nfs/dbraw/zinc/13/65/15/1367136515.db2.gz	SZESIJUGNVGAOT-VZEFYGNVSA-N	0	3	331.460	3.083	20	30		EGEDHN
CCCOc1cccc(CN(C)[C@@H]2CCN(C(=O)C#CC(C)C)C2)c1	ZINC001190055354	1367162139	/nfs/dbraw/zinc/16/21/39/1367162139.db2.gz	XYAUFUXHRAGLPJ-LJQANCHMSA-N	0	3	342.483	3.168	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ncc(Cl)s1)C2	ZINC001109517079	1367172251	/nfs/dbraw/zinc/17/22/51/1367172251.db2.gz	UGBCPJQPTZXBSU-WOPDTQHZSA-N	0	3	325.865	3.098	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)C(C)(C)CC(F)F)C1	ZINC001107988871	1367232629	/nfs/dbraw/zinc/23/26/29/1367232629.db2.gz	KYJWJHVXNDLZKQ-RDTXWAMCSA-N	0	3	346.462	3.230	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](N(C)Cc2cccc(COC)c2)C1	ZINC001190428750	1367263051	/nfs/dbraw/zinc/26/30/51/1367263051.db2.gz	OQGIYLWTXREIPO-IBGZPJMESA-N	0	3	330.472	3.222	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](C)CCc1ccccc1F)C2	ZINC001109716001	1367291058	/nfs/dbraw/zinc/29/10/58/1367291058.db2.gz	NGGWIOAPNHQGJK-BEKAIBRUSA-N	0	3	342.458	3.139	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C1[C@H]3CCCCCC[C@H]13)C2	ZINC001109759002	1367305501	/nfs/dbraw/zinc/30/55/01/1367305501.db2.gz	JJLBFTHWHVNGRV-BCYZHJNNSA-N	0	3	346.515	3.127	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCc1scnc1C	ZINC001109769478	1367312027	/nfs/dbraw/zinc/31/20/27/1367312027.db2.gz	FICNYVAGTLMHQE-PMPSAXMXSA-N	0	3	347.528	3.318	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)Cc2cccc(C)c2)C1	ZINC001108176702	1367325072	/nfs/dbraw/zinc/32/50/72/1367325072.db2.gz	CVFPRMRJITWVMW-NQIIRXRSSA-N	0	3	344.499	3.099	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@]2(C)CN(CC3CCCC3)CCO2)CC1	ZINC001108186686	1367330425	/nfs/dbraw/zinc/33/04/25/1367330425.db2.gz	SYOJTKAGRHDUOV-FQEVSTJZSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2oc(CC)cc2C)C1	ZINC001108344268	1367402129	/nfs/dbraw/zinc/40/21/29/1367402129.db2.gz	KSBPPANCICUKIX-JXFKEZNVSA-N	0	3	348.487	3.326	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2ccc(C)c(C)c2)C1	ZINC001108378162	1367424425	/nfs/dbraw/zinc/42/44/25/1367424425.db2.gz	CCQIIFSFCYFRGM-NQIIRXRSSA-N	0	3	344.499	3.479	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2ccc(C)c(C)c2)C1	ZINC001108378161	1367424833	/nfs/dbraw/zinc/42/48/33/1367424833.db2.gz	CCQIIFSFCYFRGM-GHTZIAJQSA-N	0	3	344.499	3.479	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCc1ccc(Cl)s1)C2	ZINC001110103457	1367504400	/nfs/dbraw/zinc/50/44/00/1367504400.db2.gz	VKTMDUSXYQTEHN-SNPRPXQTSA-N	0	3	336.888	3.079	20	30		EGEDHN
C=CCC[C@H](C)N1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1scnc1Cl)C2	ZINC001110105024	1367505388	/nfs/dbraw/zinc/50/53/88/1367505388.db2.gz	DLRCCHAIYICVJU-RNJOBUHISA-N	0	3	339.892	3.486	20	30		EGEDHN
O=C(CC#Cc1ccccc1)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccccc1	ZINC001110135414	1367518111	/nfs/dbraw/zinc/51/81/11/1367518111.db2.gz	BBXCLNNECLHZMM-FSSWDIPSSA-N	0	3	344.458	3.350	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](C)c1ccccc1C)C2	ZINC001110135181	1367518170	/nfs/dbraw/zinc/51/81/70/1367518170.db2.gz	PDGLETFKRBGBNF-JYBIWHBTSA-N	0	3	342.483	3.023	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@H](C)c1ccc(F)cc1)C2	ZINC001110142567	1367524398	/nfs/dbraw/zinc/52/43/98/1367524398.db2.gz	HCUGMLNYVWYLCL-VLQPXKRTSA-N	0	3	328.431	3.064	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H](N(C)Cc2ccc(COC)cc2)C1	ZINC001191867457	1367618854	/nfs/dbraw/zinc/61/88/54/1367618854.db2.gz	BOCRKCSQKSINKN-FXAWDEMLSA-N	0	3	344.499	3.468	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@@H](N(C)Cc2ccc(COC)cc2)C1	ZINC001191867461	1367619275	/nfs/dbraw/zinc/61/92/75/1367619275.db2.gz	BOCRKCSQKSINKN-YLJYHZDGSA-N	0	3	344.499	3.468	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@H](N(C)Cc2cccc(OC)c2)C1	ZINC001191911246	1367635546	/nfs/dbraw/zinc/63/55/46/1367635546.db2.gz	DCDQDGPWWZADJK-AEFFLSMTSA-N	0	3	330.472	3.330	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H](N(C)CCOc2ccc(F)cc2)C1	ZINC001191913609	1367638673	/nfs/dbraw/zinc/63/86/73/1367638673.db2.gz	ZQDBBPJXMCOHAP-FUHWJXTLSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H](N(C)CCOc2cccc(F)c2)C1	ZINC001192161916	1367704396	/nfs/dbraw/zinc/70/43/96/1367704396.db2.gz	LUPZHQKQGNNRDN-FXAWDEMLSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](N(C)CCOc3ccccc3)C2)CC1	ZINC001192218877	1367721631	/nfs/dbraw/zinc/72/16/31/1367721631.db2.gz	XJRSSQUCTXNRBP-GOSISDBHSA-N	0	3	342.483	3.345	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](N(C)CCOc2cccc(F)c2)C1	ZINC001192579352	1367823819	/nfs/dbraw/zinc/82/38/19/1367823819.db2.gz	ZLBAAOCCEJCJEB-KRWDZBQOSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)[C@H](CC)CC2CCCC2)C1	ZINC001192657698	1367843486	/nfs/dbraw/zinc/84/34/86/1367843486.db2.gz	ZHBNQWYTTCEZHV-MOPGFXCFSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2C[C@@H]1CC(C)(C)CO1	ZINC001110595211	1367855711	/nfs/dbraw/zinc/85/57/11/1367855711.db2.gz	GBDMDBMDDQELOP-HCXYKTFWSA-N	0	3	346.515	3.291	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)C2(CC(C)C)CCCC2)C1	ZINC001192896477	1367898932	/nfs/dbraw/zinc/89/89/32/1367898932.db2.gz	LNVZVLHDFOHARZ-GOSISDBHSA-N	0	3	336.520	3.328	20	30		EGEDHN
CC(C)C[C@H](C)C(=O)N1CC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001193099184	1367943482	/nfs/dbraw/zinc/94/34/82/1367943482.db2.gz	KJWSJVZYXACPPK-QFBILLFUSA-N	0	3	327.472	3.273	20	30		EGEDHN
CCC[C@H](CC)C(=O)N1CC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001193109439	1367946988	/nfs/dbraw/zinc/94/69/88/1367946988.db2.gz	IFRQHQMXQAVUHJ-OALUTQOASA-N	0	3	327.472	3.417	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccccc1	ZINC001110863845	1368042700	/nfs/dbraw/zinc/04/27/00/1368042700.db2.gz	YASJEBDHEFZFGO-WERVVEIQSA-N	0	3	342.483	3.137	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCc1ccc(F)cc1F)C2	ZINC001111219953	1368197005	/nfs/dbraw/zinc/19/70/05/1368197005.db2.gz	PKWQKZNVXLOFEA-NXHRZFHOSA-N	0	3	334.410	3.195	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2cc3cccc(C)c3o2)C1	ZINC001194305455	1368227304	/nfs/dbraw/zinc/22/73/04/1368227304.db2.gz	LNHQASGJCBKYAP-KRWDZBQOSA-N	0	3	342.439	3.090	20	30		EGEDHN
N#Cc1cccc([C@@H](O)CN2CC[C@@H](Oc3ccc(Cl)cc3)C2)c1	ZINC001194633355	1368299816	/nfs/dbraw/zinc/29/98/16/1368299816.db2.gz	RYMQPPHADQDTFV-MOPGFXCFSA-N	0	3	342.826	3.398	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](C)CCc1cccc(F)c1)C2	ZINC001111434545	1368306775	/nfs/dbraw/zinc/30/67/75/1368306775.db2.gz	SKLYOGHCIBRZCU-OBZTUIKSSA-N	0	3	342.458	3.139	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)OC2(CCN(Cc3ccsc3)CC2)C1	ZINC001111540413	1368335590	/nfs/dbraw/zinc/33/55/90/1368335590.db2.gz	KWVHLRXONRAIAJ-MRXNPFEDSA-N	0	3	348.512	3.296	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H](C)CC(C)(C)C)C[C@@H](C)O2	ZINC001111550913	1368343175	/nfs/dbraw/zinc/34/31/75/1368343175.db2.gz	NPCYGMGIQZHHBL-DLBZAZTESA-N	0	3	336.520	3.327	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@@H](CC)C(C)C)C[C@@H](C)O2	ZINC001111552957	1368344668	/nfs/dbraw/zinc/34/46/68/1368344668.db2.gz	QUUNRGHTGMWIDN-QZTJIDSGSA-N	0	3	336.520	3.327	20	30		EGEDHN
CC(C)CCC(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(C#N)cc1)C2	ZINC001111584221	1368353364	/nfs/dbraw/zinc/35/33/64/1368353364.db2.gz	JXCZDMDTFREYAN-FPOVZHCZSA-N	0	3	339.483	3.465	20	30		EGEDHN
C/C(=C/C(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(C#N)cc1)C2)C1CC1	ZINC001111627351	1368387775	/nfs/dbraw/zinc/38/77/75/1368387775.db2.gz	MJVKAMKEDYMQPV-FUIXMSNNSA-N	0	3	349.478	3.385	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CN(CCC2CCCCCC2)C[C@H]1O	ZINC001195262123	1368410075	/nfs/dbraw/zinc/41/00/75/1368410075.db2.gz	JJSQSRTYOPTQLX-QZTJIDSGSA-N	0	3	336.520	3.111	20	30		EGEDHN
C=CCCC(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(C)nc1C)C2	ZINC001111648961	1368411187	/nfs/dbraw/zinc/41/11/87/1368411187.db2.gz	WZYNLHPVFIVYDJ-ICSRJNTNSA-N	0	3	327.472	3.135	20	30		EGEDHN
CC(C)C#CC(=O)N[C@]12CCC[C@H]1CN(C/C=C\c1ccccc1)C2	ZINC001111735703	1368435187	/nfs/dbraw/zinc/43/51/87/1368435187.db2.gz	MCZGASJTVLYEQI-JZANTTBESA-N	0	3	336.479	3.330	20	30		EGEDHN
C=CCOCCCC(=O)N1CCCN(CCc2ccc(C)cc2)CC1	ZINC001195451632	1368439239	/nfs/dbraw/zinc/43/92/39/1368439239.db2.gz	FRFIHWHGLHKDMQ-UHFFFAOYSA-N	0	3	344.499	3.055	20	30		EGEDHN
C#CCCCCC(=O)N1CCCN(CCCOc2ccccc2)CC1	ZINC001195563073	1368454492	/nfs/dbraw/zinc/45/44/92/1368454492.db2.gz	STANXAPVKGMTDY-UHFFFAOYSA-N	0	3	342.483	3.183	20	30		EGEDHN
CC#CCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1cccc(F)c1)C2	ZINC001111846056	1368500258	/nfs/dbraw/zinc/50/02/58/1368500258.db2.gz	ONZZXIHKBREHOG-RXVVDRJESA-N	0	3	342.458	3.490	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@]12CCC[C@H]1CN(CCc1ccns1)C2	ZINC001111850273	1368503737	/nfs/dbraw/zinc/50/37/37/1368503737.db2.gz	HUEXGVLQHQBRNI-GJYPPUQNSA-N	0	3	347.528	3.259	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cc(C3CC3)nn2C)CC1	ZINC001196004429	1368533354	/nfs/dbraw/zinc/53/33/54/1368533354.db2.gz	XPTXOGVDEUMLDE-UHFFFAOYSA-N	0	3	344.503	3.192	20	30		EGEDHN
C=C(C)CN1CCCN(C(=O)CCOc2ccc(C)cc2C)CC1	ZINC001196060141	1368541583	/nfs/dbraw/zinc/54/15/83/1368541583.db2.gz	LATKIVPNWREHQV-UHFFFAOYSA-N	0	3	330.472	3.183	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2coc(Br)c2)CC1	ZINC001196060526	1368542598	/nfs/dbraw/zinc/54/25/98/1368542598.db2.gz	YYGIKCFXTXNWOH-UHFFFAOYSA-N	0	3	341.249	3.156	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H](CC)Oc2cccc(C)c2)C1	ZINC001111899018	1368543720	/nfs/dbraw/zinc/54/37/20/1368543720.db2.gz	AJMYBMDEJGYSGZ-DSKINZAPSA-N	0	3	342.483	3.309	20	30		EGEDHN
C#CCC1(C(=O)N2CCCN(Cc3ccccc3CC)CC2)CCC1	ZINC001196139145	1368556550	/nfs/dbraw/zinc/55/65/50/1368556550.db2.gz	SIDJDSUYBUBQDL-UHFFFAOYSA-N	0	3	338.495	3.477	20	30		EGEDHN
CN(CCN(C)C(=S)Nc1ccccc1C#N)Cc1ccccc1	ZINC001196313058	1368586813	/nfs/dbraw/zinc/58/68/13/1368586813.db2.gz	KCLDMXVEFQLILG-UHFFFAOYSA-N	0	3	338.480	3.319	20	30		EGEDHN
C=CCC[C@@H](C)N1CCCN(C(=O)c2ncoc2C(F)(F)F)CC1	ZINC001196357238	1368596335	/nfs/dbraw/zinc/59/63/35/1368596335.db2.gz	CHUSKGKHYFHEBF-GFCCVEGCSA-N	0	3	345.365	3.196	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H](C)Cc2ccc(OC)cc2)C1	ZINC001111999582	1368603223	/nfs/dbraw/zinc/60/32/23/1368603223.db2.gz	PSJGTHVHRYCANP-MDKPJZGXSA-N	0	3	342.483	3.031	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)C2[C@H]3CCCCCC[C@H]23)C1	ZINC001196408318	1368609326	/nfs/dbraw/zinc/60/93/26/1368609326.db2.gz	ZTYCAYLAHROUNJ-INDMIFKZSA-N	0	3	348.531	3.111	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H](O)[C@H](NC(=O)c2cc(C(C)(C)C)oc2C)C1	ZINC001196453797	1368618100	/nfs/dbraw/zinc/61/81/00/1368618100.db2.gz	UYANEYVWNIPJAE-KBRIMQKVSA-N	0	3	348.487	3.015	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)c2csc(Cl)c2)C1	ZINC001196677433	1368660132	/nfs/dbraw/zinc/66/01/32/1368660132.db2.gz	XMUVUMCWUWQOJF-ZIAGYGMSSA-N	0	3	344.908	3.147	20	30		EGEDHN
CC#CCCCC(=O)N1C[C@@H](C(F)(F)F)[C@H](NCC=C(C)C)C1	ZINC001112146787	1368681167	/nfs/dbraw/zinc/68/11/67/1368681167.db2.gz	ODGUMHNJZJMBQV-HUUCEWRRSA-N	0	3	330.394	3.125	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@@H](F)CCCCCC)C[C@H]1C(F)(F)F	ZINC001112193976	1368708059	/nfs/dbraw/zinc/70/80/59/1368708059.db2.gz	FQEPZYVEGCBHBF-HZSPNIEDSA-N	0	3	338.389	3.460	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)C2CC(C(C)(C)C)C2)C[C@H]1C(F)(F)F	ZINC001112214089	1368722229	/nfs/dbraw/zinc/72/22/29/1368722229.db2.gz	MHGGHMREEKAMSN-NEXFUWMNSA-N	0	3	344.421	3.061	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H]2CCC[C@]2(CNCc2nc(C)c(C)s2)C1	ZINC001112282375	1368747918	/nfs/dbraw/zinc/74/79/18/1368747918.db2.gz	WTQCCONYUJLYTG-LPHOPBHVSA-N	0	3	347.528	3.444	20	30		EGEDHN
CN(CCN(C)C(=S)Nc1cccc(C#N)c1)Cc1ccccc1	ZINC001197705071	1368876767	/nfs/dbraw/zinc/87/67/67/1368876767.db2.gz	JJTJIPIWUNFSGN-UHFFFAOYSA-N	0	3	338.480	3.319	20	30		EGEDHN
CCCCCCCCCCC(=O)N1CCCN(C[C@@H](C)O)CC1	ZINC001197928390	1368925931	/nfs/dbraw/zinc/92/59/31/1368925931.db2.gz	HGFLOBBVNSPYNO-GOSISDBHSA-N	0	3	326.525	3.432	20	30		EGEDHN
CCCCCCCCCC(=O)N[C@@H]1CN(CC[C@H](C)F)C[C@H]1O	ZINC001198096449	1368959732	/nfs/dbraw/zinc/95/97/32/1368959732.db2.gz	LRZCISFVWGOEME-GVDBMIGSSA-N	0	3	330.488	3.037	20	30		EGEDHN
C=C(C)CN1CCCN(C(=O)CCCOc2cccc(F)c2)CC1	ZINC001198136192	1368966484	/nfs/dbraw/zinc/96/64/84/1368966484.db2.gz	JRLGWLKFJSCXBF-UHFFFAOYSA-N	0	3	334.435	3.095	20	30		EGEDHN
C=CCCOCC(=O)N1CCCN([C@@H](C)c2ccccc2C)CC1	ZINC001198324062	1369009289	/nfs/dbraw/zinc/00/92/89/1369009289.db2.gz	KSNWPUATIPJBRZ-SFHVURJKSA-N	0	3	330.472	3.183	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)C[C@H]1C=CCC1)c1ccccc1OC	ZINC001198522330	1369051323	/nfs/dbraw/zinc/05/13/23/1369051323.db2.gz	JTKCTUYNXKWOKC-WMZOPIPTSA-N	0	3	328.456	3.375	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)c1ccc[nH]1)c1ccccc1OC	ZINC001198522763	1369051989	/nfs/dbraw/zinc/05/19/89/1369051989.db2.gz	PVRJOYBHSBIXIB-KRWDZBQOSA-N	0	3	327.428	3.050	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)CCOCC(C)C)c1ccccc1OC	ZINC001198569020	1369062986	/nfs/dbraw/zinc/06/29/86/1369062986.db2.gz	YGNDQNRCANHRCQ-SFHVURJKSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC[C@H](NCCCC)c1ccccc1OC	ZINC001198594949	1369068547	/nfs/dbraw/zinc/06/85/47/1369068547.db2.gz	FPGBLKHHBCRADA-WMZOPIPTSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)c1cscn1)c1ccccc1OC	ZINC001198605897	1369071899	/nfs/dbraw/zinc/07/18/99/1369071899.db2.gz	LOXYIMVUJMMSIH-HNNXBMFYSA-N	0	3	345.468	3.179	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)c1cscn1)c1ccccc1OC	ZINC001198605898	1369072336	/nfs/dbraw/zinc/07/23/36/1369072336.db2.gz	LOXYIMVUJMMSIH-OAHLLOKOSA-N	0	3	345.468	3.179	20	30		EGEDHN
C=CCCCCCN[C@H](CNC(=O)[C@@H](C)C#N)c1ccccc1OC	ZINC001198618007	1369074629	/nfs/dbraw/zinc/07/46/29/1369074629.db2.gz	VMBYEHVWCZAEEJ-FUHWJXTLSA-N	0	3	343.471	3.348	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)[C@@H]1CC1(C)C)c1ccccc1OC	ZINC001198669306	1369087342	/nfs/dbraw/zinc/08/73/42/1369087342.db2.gz	YYFZWEBPZWNFBB-IRXDYDNUSA-N	0	3	330.472	3.454	20	30		EGEDHN
C#CCCCCC(=O)NC[C@H](NCC(C)C)c1ccccc1OC	ZINC001198677002	1369089177	/nfs/dbraw/zinc/08/91/77/1369089177.db2.gz	GTXNTJINLCHYNS-SFHVURJKSA-N	0	3	330.472	3.292	20	30		EGEDHN
CCCCCN[C@H](CNC(=O)C#CC(C)C)c1ccccc1OC	ZINC001198713882	1369097742	/nfs/dbraw/zinc/09/77/42/1369097742.db2.gz	UGCJMDRFCQMRBW-GOSISDBHSA-N	0	3	330.472	3.292	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)C1(C2CC2)CC1)c1ccccc1OC	ZINC001198766720	1369108574	/nfs/dbraw/zinc/10/85/74/1369108574.db2.gz	GXAKPDGSNQDOBY-KRWDZBQOSA-N	0	3	328.456	3.208	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@]1(C)C=CCC1)c1ccccc1OC	ZINC001198833532	1369124527	/nfs/dbraw/zinc/12/45/27/1369124527.db2.gz	BNISMCIPXXIIRW-YLJYHZDGSA-N	0	3	328.456	3.375	20	30		EGEDHN
C#CCC1(C(=O)N2CCC([C@@H]3CCCN(CCF)CC3)CC2)CCC1	ZINC001186598199	1387981735	/nfs/dbraw/zinc/98/17/35/1387981735.db2.gz	REWJRWVITSMUSW-GOSISDBHSA-N	0	3	348.506	3.490	20	30		EGEDHN
CC#CCCCC(=O)NC[C@H](NCC1CC1)c1ccccc1OC	ZINC001198855546	1369130800	/nfs/dbraw/zinc/13/08/00/1369130800.db2.gz	DAQZFTCEBIMLDO-SFHVURJKSA-N	0	3	328.456	3.046	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@H](CC(C)C)OC)c1ccccc1OC	ZINC001198885441	1369139186	/nfs/dbraw/zinc/13/91/86/1369139186.db2.gz	HYZUSYJCASDKPE-HKUYNNGSSA-N	0	3	348.487	3.079	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@H](NCCCF)c1ccccc1OC	ZINC001198885158	1369139295	/nfs/dbraw/zinc/13/92/95/1369139295.db2.gz	BLWFUQRLABHCDB-QFBILLFUSA-N	0	3	336.451	3.404	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)[C@H]1CC12CC2)c1ccccc1OC	ZINC001198916865	1369148195	/nfs/dbraw/zinc/14/81/95/1369148195.db2.gz	VPUJBXIVVCMNEA-SJORKVTESA-N	0	3	328.456	3.208	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NC[C@H](NCCC(C)C)c1ccccc1OC	ZINC001199002785	1369169895	/nfs/dbraw/zinc/16/98/95/1369169895.db2.gz	ZYSIAXYXJNNIIB-AEFFLSMTSA-N	0	3	348.487	3.079	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N1CCN(CC2CCC(C)CC2)CC1	ZINC001113164750	1369237465	/nfs/dbraw/zinc/23/74/65/1369237465.db2.gz	YOBABGIROBDISY-AFMYVXGZSA-N	0	3	336.520	3.186	20	30		EGEDHN
C=CCCC(=O)N1CCC(NCc2coc(-c3ccccc3)n2)CC1	ZINC001199706978	1369257918	/nfs/dbraw/zinc/25/79/18/1369257918.db2.gz	SRTQWFYNYAKZEG-UHFFFAOYSA-N	0	3	339.439	3.388	20	30		EGEDHN
C=CCCC(=O)N1CCC(NCc2csc(-c3ccoc3)n2)CC1	ZINC001199706059	1369258359	/nfs/dbraw/zinc/25/83/59/1369258359.db2.gz	BPQFWWYXZGFSJV-UHFFFAOYSA-N	0	3	345.468	3.450	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)CCc2cccc(N(C)C)c2)CC1	ZINC001113248182	1369290766	/nfs/dbraw/zinc/29/07/66/1369290766.db2.gz	UHNRGDSSGYBJNZ-GOSISDBHSA-N	0	3	343.515	3.184	20	30		EGEDHN
CCCCCCCCCCNC(=S)N1CCO[C@@H](CN(C)C)C1	ZINC001200208726	1369329105	/nfs/dbraw/zinc/32/91/05/1369329105.db2.gz	OQKSPFQVJPVVJN-KRWDZBQOSA-N	0	3	343.581	3.264	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC(NCc2cc(F)ccc2Cl)CC1	ZINC001200449106	1369370859	/nfs/dbraw/zinc/37/08/59/1369370859.db2.gz	ZCBLUKDTMSVMLS-UHFFFAOYSA-N	0	3	336.838	3.219	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCCO[C@@H](CNCc2ccsc2)C1	ZINC001200591431	1369397415	/nfs/dbraw/zinc/39/74/15/1369397415.db2.gz	YTXFAPDNZXFIJO-SFHVURJKSA-N	0	3	348.512	3.224	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC(N[C@@H](C)c2cnc(C)cn2)CC1	ZINC001200748214	1369422691	/nfs/dbraw/zinc/42/26/91/1369422691.db2.gz	WMIIVLQSRASIRH-INIZCTEOSA-N	0	3	342.487	3.195	20	30		EGEDHN
C=C(Br)CNC1CCN(C(=O)[C@](C)(F)CCCC)CC1	ZINC001201348983	1369525115	/nfs/dbraw/zinc/52/51/15/1369525115.db2.gz	QWQVFUSJKAUJKN-OAHLLOKOSA-N	0	3	349.288	3.394	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)CCOc2cccc(C)c2)CC1	ZINC001113628332	1369529872	/nfs/dbraw/zinc/52/98/72/1369529872.db2.gz	ZAXFZBJDFPDDFW-GOSISDBHSA-N	0	3	330.472	3.263	20	30		EGEDHN
CCCCCCCCCCS(=O)(=O)N[C@@H]1CCN(C)C[C@H]1C	ZINC001201837829	1369631564	/nfs/dbraw/zinc/63/15/64/1369631564.db2.gz	VEMJFHYUFQDWLC-IAGOWNOFSA-N	0	3	332.554	3.387	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)N1CCC(NCc2ccncc2Cl)CC1	ZINC001202092788	1369686383	/nfs/dbraw/zinc/68/63/83/1369686383.db2.gz	RHHOCOSVJANOAZ-UONOGXRCSA-N	0	3	335.879	3.274	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)N1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001202101812	1369687748	/nfs/dbraw/zinc/68/77/48/1369687748.db2.gz	SZMZKYPYUWNWJT-CABCVRRESA-N	0	3	343.446	3.236	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC(N[C@@H](C)c2cnc(C)cn2)CC1	ZINC001202122734	1369692913	/nfs/dbraw/zinc/69/29/13/1369692913.db2.gz	GGIOMFYPAXKBIN-ZBFHGGJFSA-N	0	3	330.476	3.029	20	30		EGEDHN
C=CCC1(C(=O)N2CCCO[C@H](CNC/C=C/Cl)C2)CCCC1	ZINC001202250856	1369723069	/nfs/dbraw/zinc/72/30/69/1369723069.db2.gz	MFTCVVMUQJNVMN-ZWIJEDICSA-N	0	3	340.895	3.083	20	30		EGEDHN
CC(C)C(=O)N[C@H]1C[C@@H](NCC#Cc2cccc(Cl)c2)C12CCC2	ZINC001202459386	1369778463	/nfs/dbraw/zinc/77/84/63/1369778463.db2.gz	OKIPZIUPOYZPIL-MSOLQXFVSA-N	0	3	344.886	3.365	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@@H](NC(=O)CC(C)(C)C)C12CCC2	ZINC001202503613	1369793384	/nfs/dbraw/zinc/79/33/84/1369793384.db2.gz	YTMZVNAQYMGNEU-CHWSQXEVSA-N	0	3	343.309	3.348	20	30		EGEDHN
C/C=C(\C)C(=O)N[C@@H]1C[C@@H](NCc2cc(C#N)ccc2F)C12CCC2	ZINC001202725548	1369867941	/nfs/dbraw/zinc/86/79/41/1369867941.db2.gz	OEMIDSQLDCXUCX-KXVSIHCVSA-N	0	3	341.430	3.181	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1[C@H]2CN(Cc3cc(F)ccc3C)C[C@H]21	ZINC001114319824	1369881627	/nfs/dbraw/zinc/88/16/27/1369881627.db2.gz	PLWSUBXGBHQSAE-PMOLBWCYSA-N	0	3	342.458	3.449	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1[C@H]2CN(CC[C@H]3CC3(Cl)Cl)C[C@H]21	ZINC001114340295	1369900549	/nfs/dbraw/zinc/90/05/49/1369900549.db2.gz	DMTZQBWQXHMTIP-RMRHIDDWSA-N	0	3	345.314	3.219	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1[C@H]2CN(CCOc3ccc(Cl)cc3)C[C@H]21	ZINC001114353216	1369907805	/nfs/dbraw/zinc/90/78/05/1369907805.db2.gz	NYOUXZJMAPYFGT-DZFIZOCASA-N	0	3	348.874	3.122	20	30		EGEDHN
C[C@H](c1ccccc1)N(Cc1cccc(C#N)c1)C[C@@H]1CCC(=O)N1	ZINC001202897980	1369921097	/nfs/dbraw/zinc/92/10/97/1369921097.db2.gz	FXDLUURHSBYQPZ-UZLBHIALSA-N	0	3	333.435	3.400	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1C[C@H](NCc2oc(C)nc2C)C12CCC2	ZINC001202987811	1369946839	/nfs/dbraw/zinc/94/68/39/1369946839.db2.gz	OUOVYFCEMUCNMC-IRXDYDNUSA-N	0	3	331.460	3.165	20	30		EGEDHN
CC[C@@H](C)[C@@H](C)C(=O)N1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001203093859	1369981188	/nfs/dbraw/zinc/98/11/88/1369981188.db2.gz	ZLVZAQGIARBPEW-HUUCEWRRSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC(C)C[C@H](C)C(=O)N1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001203108535	1369986155	/nfs/dbraw/zinc/98/61/55/1369986155.db2.gz	MVLKIEYJTHFLCP-HNNXBMFYSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CCN(Cc3cccn3C)CC2)CC1	ZINC001203254138	1370042631	/nfs/dbraw/zinc/04/26/31/1370042631.db2.gz	GRXRVCCPWURFKM-UHFFFAOYSA-N	0	3	331.460	3.026	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1C[C@@H](NCc2ccns2)C12CCC2	ZINC001203258291	1370044651	/nfs/dbraw/zinc/04/46/51/1370044651.db2.gz	QXGJIQDRXCOJKC-CABCVRRESA-N	0	3	333.501	3.262	20	30		EGEDHN
CC1(C(=O)N[C@@H]2C[C@@H](NCC#Cc3ccccc3)C23CCC3)CCC1	ZINC001203259013	1370046237	/nfs/dbraw/zinc/04/62/37/1370046237.db2.gz	UKEZSMXWBYSFLL-RTBURBONSA-N	0	3	336.479	3.245	20	30		EGEDHN
Cc1cocc1C(=O)N[C@@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001203266899	1370050788	/nfs/dbraw/zinc/05/07/88/1370050788.db2.gz	WRAJBCONWOUVJQ-WOJBJXKFSA-N	0	3	348.446	3.270	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1C[C@H](NCC(=C)Br)C12CCC2	ZINC001203275287	1370056054	/nfs/dbraw/zinc/05/60/54/1370056054.db2.gz	SBMHSQHDISEEQL-QWHCGFSZSA-N	0	3	341.293	3.124	20	30		EGEDHN
CC#CCCCC(=O)N[C@H]1C[C@H](NCc2ncccc2C)C12CCC2	ZINC001203281110	1370059054	/nfs/dbraw/zinc/05/90/54/1370059054.db2.gz	MUDPBWFFJSCBAU-OALUTQOASA-N	0	3	339.483	3.101	20	30		EGEDHN
CC#CCCCC(=O)N[C@H]1C[C@H](NCc2oc(C)nc2C)C12CCC2	ZINC001203280787	1370059675	/nfs/dbraw/zinc/05/96/75/1370059675.db2.gz	JWLTVAAJYLGCAD-ROUUACIJSA-N	0	3	343.471	3.002	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1C[C@@H](NCc2c(C)noc2CC)C12CCC2	ZINC001203281516	1370060506	/nfs/dbraw/zinc/06/05/06/1370060506.db2.gz	PWEKYJAPMYOATE-SJORKVTESA-N	0	3	345.487	3.275	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1C[C@H](NCc2conc2C)C12CCC2	ZINC001203295267	1370067400	/nfs/dbraw/zinc/06/74/00/1370067400.db2.gz	JCXSVHRXQVRAKX-ROUUACIJSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2[C@H]3CN(Cc4cc(F)ccc4C)C[C@H]32)CCC1	ZINC001114785891	1370079438	/nfs/dbraw/zinc/07/94/38/1370079438.db2.gz	WUBJLAAVRSYZKK-BWTSREIZSA-N	0	3	342.458	3.427	20	30		EGEDHN
CC1(C(=O)N[C@@H]2C[C@@H](NCC#Cc3ccccc3)C23CCC3)CC=CC1	ZINC001203341522	1370089889	/nfs/dbraw/zinc/08/98/89/1370089889.db2.gz	RMRUZPOONWACAW-WOJBJXKFSA-N	0	3	348.490	3.411	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2C[C@@H](NCc3cncs3)C23CCC3)CCC1	ZINC001203366562	1370100845	/nfs/dbraw/zinc/10/08/45/1370100845.db2.gz	NUNSHDQGJWQWJH-HZPDHXFCSA-N	0	3	345.512	3.407	20	30		EGEDHN
C=CC1(CC(=O)N[C@@H]2[C@H]3CN(CCOC4CCC4)C[C@H]32)CCCCC1	ZINC001114965852	1370181720	/nfs/dbraw/zinc/18/17/20/1370181720.db2.gz	SGKYNLMNOIBUSA-RUYXUALKSA-N	0	3	346.515	3.129	20	30		EGEDHN
CCC[C@@](C)(CC)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001115028412	1370223896	/nfs/dbraw/zinc/22/38/96/1370223896.db2.gz	MRGKTLOZNYOWJS-XODKDNOYSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)CCc2cccs2)C12CCC2	ZINC001203712333	1370231285	/nfs/dbraw/zinc/23/12/85/1370231285.db2.gz	PBWICLNOZGJIDF-GJZGRUSLSA-N	0	3	338.904	3.450	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)COc2cccc(C)c2)C12CCC2	ZINC001203737550	1370241793	/nfs/dbraw/zinc/24/17/93/1370241793.db2.gz	HYIPUKKITGZDNX-DLBZAZTESA-N	0	3	348.874	3.143	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@H](Oc4cccnc4)CO3)CC2)c1	ZINC001203757165	1370251150	/nfs/dbraw/zinc/25/11/50/1370251150.db2.gz	HRCXNSXGAWFPIK-FQEVSTJZSA-N	0	3	349.434	3.156	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CCN(Cc3cccc(O)c3)C2)C1	ZINC001203859181	1370292269	/nfs/dbraw/zinc/29/22/69/1370292269.db2.gz	HHCLETQJRSYGRH-LJQANCHMSA-N	0	3	330.428	3.003	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(C[C@@H](c4ccccc4)C(=O)N3)CC2)cc1	ZINC001203902289	1370306673	/nfs/dbraw/zinc/30/66/73/1370306673.db2.gz	ZAXWDWRYKMSLSW-FQEVSTJZSA-N	0	3	345.446	3.197	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)C3CCC3)CCCCC2)c(F)c1	ZINC001115377678	1370416982	/nfs/dbraw/zinc/41/69/82/1370416982.db2.gz	WJCFMRSBAPBOBQ-UHFFFAOYSA-N	0	3	343.446	3.406	20	30		EGEDHN
C=CCOc1ccc(CN2CCC(N(C)C(=O)C(C)C)CC2)cc1	ZINC001204302147	1370437592	/nfs/dbraw/zinc/43/75/92/1370437592.db2.gz	DEFNBAWXVNAAIS-UHFFFAOYSA-N	0	3	330.472	3.330	20	30		EGEDHN
CC(C)C(=O)NCC1(NCc2ccc(C#N)cc2F)CCCCC1	ZINC001115412267	1370441267	/nfs/dbraw/zinc/44/12/67/1370441267.db2.gz	WQTRQEMTWPSWSS-UHFFFAOYSA-N	0	3	331.435	3.262	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H]2CN(CCOc3cc(C)cc(C)c3)C[C@H]21	ZINC001187210804	1388073058	/nfs/dbraw/zinc/07/30/58/1388073058.db2.gz	ZSZPWNSIWUAPLS-AZUAARDMSA-N	0	3	342.483	3.181	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2oc(C)nc2C)CCCCC1	ZINC001115463218	1370467630	/nfs/dbraw/zinc/46/76/30/1370467630.db2.gz	GBJMYRWAUSAMOM-UHFFFAOYSA-N	0	3	325.840	3.066	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3ccc(F)cc3Cl)C2)C1=O	ZINC001204436854	1370477217	/nfs/dbraw/zinc/47/72/17/1370477217.db2.gz	JBPACOGVIYYEPP-SFHVURJKSA-N	0	3	336.838	3.480	20	30		EGEDHN
C=CCN1C(=O)CCC[C@@]12CCCN(Cc1ccc3c(c1)CCO3)C2	ZINC001204489146	1370489916	/nfs/dbraw/zinc/48/99/16/1370489916.db2.gz	HMMJIGQFFCFRDV-NRFANRHFSA-N	0	3	340.467	3.155	20	30		EGEDHN
C#CCCCCC(=O)NCC1(NCc2cncc(F)c2)CCCCC1	ZINC001115490851	1370494293	/nfs/dbraw/zinc/49/42/93/1370494293.db2.gz	XVXSUVIFCNWVRC-UHFFFAOYSA-N	0	3	345.462	3.323	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC1(NCc2cnc(C)nc2)CCCCC1	ZINC001115661937	1370645851	/nfs/dbraw/zinc/64/58/51/1370645851.db2.gz	VQLRDIYEWJRXOS-UHFFFAOYSA-N	0	3	344.503	3.296	20	30		EGEDHN
Cc1cnc(C#N)c(Nc2ccc(C3(N4CCN(C)CC4)CC3)cc2)c1	ZINC001205102481	1370651305	/nfs/dbraw/zinc/65/13/05/1370651305.db2.gz	RKPBDMTVFMMYOG-UHFFFAOYSA-N	0	3	347.466	3.242	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC1(NCc2cnc(C)cn2)CCCCC1	ZINC001115712275	1370691306	/nfs/dbraw/zinc/69/13/06/1370691306.db2.gz	DEBAQCAIOMUQLQ-IBGZPJMESA-N	0	3	344.503	3.296	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2conc2CC)CCCCC1	ZINC001115718568	1370697488	/nfs/dbraw/zinc/69/74/88/1370697488.db2.gz	OFFRUMPGBNRYQI-UHFFFAOYSA-N	0	3	325.840	3.012	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C[C@@H](C)CC)CC[C@H]1c1ccc(F)cc1	ZINC001205276467	1370704171	/nfs/dbraw/zinc/70/41/71/1370704171.db2.gz	ZCCZWFBYKQXTFI-ZYSHUDEJSA-N	0	3	330.447	3.169	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H](C)CC(C)C)CC[C@H]1c1ccc(F)cc1	ZINC001205318882	1370720893	/nfs/dbraw/zinc/72/08/93/1370720893.db2.gz	SRPMJAASYQWNHY-LSTHTHJFSA-N	0	3	344.474	3.415	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC(CNCc2oc(C)nc2C)CC1	ZINC001205397715	1370743692	/nfs/dbraw/zinc/74/36/92/1370743692.db2.gz	JIQBKHALWGKCID-UHFFFAOYSA-N	0	3	333.476	3.222	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)C[C@H](CC)C(C)C)[C@@H]3COC[C@@H]32)CC1	ZINC001205516542	1370778139	/nfs/dbraw/zinc/77/81/39/1370778139.db2.gz	JJCNEVYBTXKZKE-GBESFXJTSA-N	0	3	348.531	3.184	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CCN(Cc3ccncc3C)C2)C1	ZINC001205827997	1370884924	/nfs/dbraw/zinc/88/49/24/1370884924.db2.gz	IWIZYZCJZXYBIU-IBGZPJMESA-N	0	3	329.444	3.001	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)N1CCC(CNCc2oc(C)nc2C)CC1	ZINC001205953906	1370921401	/nfs/dbraw/zinc/92/14/01/1370921401.db2.gz	AZUDFJYCERNLBO-UONOGXRCSA-N	0	3	333.476	3.078	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)N1CCC(CNCc2cc(C3CC3)no2)CC1	ZINC001205955327	1370922403	/nfs/dbraw/zinc/92/24/03/1370922403.db2.gz	PRUIFWUSEXYBTQ-LSDHHAIUSA-N	0	3	345.487	3.338	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC(CNCc2ncc(C)s2)CC1	ZINC001205988146	1370930026	/nfs/dbraw/zinc/93/00/26/1370930026.db2.gz	BJFWLNPUAHZFOV-CQSZACIVSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC(CNCc2oc(CC)nc2C)CC1	ZINC001205988133	1370930196	/nfs/dbraw/zinc/93/01/96/1370930196.db2.gz	BFVGJYWHPMRGNT-INIZCTEOSA-N	0	3	347.503	3.476	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC(CN[C@H](C)c2cnc(C)cn2)CC1	ZINC001205989861	1370931616	/nfs/dbraw/zinc/93/16/16/1370931616.db2.gz	XUUJGGHODJYXME-NVXWUHKLSA-N	0	3	344.503	3.277	20	30		EGEDHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)Nc1cc(C#N)ccc1F	ZINC001206062407	1370951549	/nfs/dbraw/zinc/95/15/49/1370951549.db2.gz	VPLFWFWAVORRBO-CQSZACIVSA-N	0	3	340.402	3.339	20	30		EGEDHN
CC(C)c1ccccc1CN1C[C@@H](C)[C@H](NC(=O)CSCC#N)C1	ZINC001206096375	1370959548	/nfs/dbraw/zinc/95/95/48/1370959548.db2.gz	RJJAQOXWSLOYDP-CRAIPNDOSA-N	0	3	345.512	3.003	20	30		EGEDHN
CC1(C(=O)OCc2ccc(C#N)cn2)CCN(Cc2ccccc2)CC1	ZINC001116793594	1370975928	/nfs/dbraw/zinc/97/59/28/1370975928.db2.gz	YLAULQZFEHSNPR-UHFFFAOYSA-N	0	3	349.434	3.299	20	30		EGEDHN
C[C@H](NCc1cccc(OCC#N)c1)c1ccccc1-n1ccnn1	ZINC001117113958	1371011903	/nfs/dbraw/zinc/01/19/03/1371011903.db2.gz	XPLRAOPMSISYAN-HNNXBMFYSA-N	0	3	333.395	3.020	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC(CNCc2nc(C)cs2)CC1	ZINC001206427166	1371050709	/nfs/dbraw/zinc/05/07/09/1371050709.db2.gz	AFYPIFCTNFKOLH-UHFFFAOYSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC(CNCc2ccccc2C#N)CC1	ZINC001206427407	1371051493	/nfs/dbraw/zinc/05/14/93/1371051493.db2.gz	FIXBDWAYHSZOGK-UHFFFAOYSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=CCOCCCC(=O)N[C@@H]1CN(Cc2ccc(CF)cc2)C[C@H]1C	ZINC001206778630	1371162380	/nfs/dbraw/zinc/16/23/80/1371162380.db2.gz	CCVDMOVJBVYXKL-VQIMIIECSA-N	0	3	348.462	3.075	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1S[C@H]1CCSC1	ZINC001118412860	1371176978	/nfs/dbraw/zinc/17/69/78/1371176978.db2.gz	NQEOUZIMIFYRAX-AWEZNQCLSA-N	0	3	338.546	3.090	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CN([C@H]2CCc3c2cccc3F)C[C@H]1C	ZINC001206886970	1371207829	/nfs/dbraw/zinc/20/78/29/1371207829.db2.gz	PGCHNEAJHOGEBQ-YSGRDPCXSA-N	0	3	342.458	3.443	20	30		EGEDHN
O=C(C1CCC1)N1CCC[C@@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207011595	1371267115	/nfs/dbraw/zinc/26/71/15/1371267115.db2.gz	BTMRTIXPBLBFBD-GOSISDBHSA-N	0	3	330.859	3.072	20	30		EGEDHN
CC(C)(F)C(=O)N1CCC[C@@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207046692	1371276194	/nfs/dbraw/zinc/27/61/94/1371276194.db2.gz	FQQVLMIDSOGQLP-MRXNPFEDSA-N	0	3	336.838	3.020	20	30		EGEDHN
O=C(c1ccco1)N1CCC[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207072970	1371285496	/nfs/dbraw/zinc/28/54/96/1371285496.db2.gz	TUZXDLXVHDPOEQ-KRWDZBQOSA-N	0	3	342.826	3.179	20	30		EGEDHN
Cc1cc(C(=O)N2CCC[C@@H](NCC#Cc3ccccc3)C2)c(C)o1	ZINC001207252183	1371342036	/nfs/dbraw/zinc/34/20/36/1371342036.db2.gz	YADJTSURHZUJEO-LJQANCHMSA-N	0	3	336.435	3.142	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H](NCc2cc(Cl)ccc2OC)C1	ZINC001207656634	1371466112	/nfs/dbraw/zinc/46/61/12/1371466112.db2.gz	KIRHMTFHVFBXML-MRXNPFEDSA-N	0	3	336.863	3.395	20	30		EGEDHN
O=C(CC1CCC1)N1CCC[C@@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207737181	1371489236	/nfs/dbraw/zinc/48/92/36/1371489236.db2.gz	BAXGEJPTVFYBRP-LJQANCHMSA-N	0	3	344.886	3.462	20	30		EGEDHN
O=C(c1ccoc1Cl)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001207909209	1371535472	/nfs/dbraw/zinc/53/54/72/1371535472.db2.gz	PVXFPSZDIJRTCE-INIZCTEOSA-N	0	3	342.826	3.179	20	30		EGEDHN
CC[C@@H](C)CC(=O)N1CCC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001207913627	1371537343	/nfs/dbraw/zinc/53/73/43/1371537343.db2.gz	CDGPXTBWIZLDEK-RHSMWYFYSA-N	0	3	331.435	3.214	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H](N[C@H]2CCc3c2c(F)ccc3F)C1	ZINC001207943972	1371544986	/nfs/dbraw/zinc/54/49/86/1371544986.db2.gz	GXHTZWPVBFMULQ-KDOFPFPSSA-N	0	3	346.421	3.336	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CCC[C@H](NCc2ccc(F)c(F)c2)C1	ZINC001208011090	1371567332	/nfs/dbraw/zinc/56/73/32/1371567332.db2.gz	VISUZHJVCUNOOU-HNNXBMFYSA-N	0	3	334.410	3.095	20	30		EGEDHN
C#CCOCCC(=O)N1CCC[C@H](N[C@H](C)c2ccccc2Cl)C1	ZINC001208029491	1371573497	/nfs/dbraw/zinc/57/34/97/1371573497.db2.gz	XKRFOMCVGSXABV-CVEARBPZSA-N	0	3	348.874	3.022	20	30		EGEDHN
C=C(C)[C@@H]1CC=C(CN2CCC[C@@]3(CCN(CCOC)C3=O)C2)CC1	ZINC001208174704	1371618090	/nfs/dbraw/zinc/61/80/90/1371618090.db2.gz	HXAYITYEMYGBCJ-TZIWHRDSSA-N	0	3	346.515	3.250	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@@H](NCc2cnn(C(C)(C)C)c2)C1	ZINC001208241186	1371675744	/nfs/dbraw/zinc/67/57/44/1371675744.db2.gz	UQNKAOFABDZHFC-QGZVFWFLSA-N	0	3	346.519	3.321	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001208255878	1371685983	/nfs/dbraw/zinc/68/59/83/1371685983.db2.gz	SQLNEXGXYDXKGP-IBGZPJMESA-N	0	3	328.431	3.114	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC[C@H](NCc2cnn(C(C)(C)C)c2)C1	ZINC001208258364	1371687071	/nfs/dbraw/zinc/68/70/71/1371687071.db2.gz	IDWZNNGGMKGRGC-KRWDZBQOSA-N	0	3	332.492	3.075	20	30		EGEDHN
O=C([C@H]1CCCC12CC2)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001208414262	1371759026	/nfs/dbraw/zinc/75/90/26/1371759026.db2.gz	LJZPYGBUYCSALQ-VQTJNVASSA-N	0	3	336.479	3.199	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1CCC[C@H](NC[C@H](F)CC)C1	ZINC001208433005	1371764518	/nfs/dbraw/zinc/76/45/18/1371764518.db2.gz	PSRXIDAXVNJBHG-CVEARBPZSA-N	0	3	334.435	3.194	20	30		EGEDHN
O=C(CC1CC(F)(F)C1)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001208439783	1371766841	/nfs/dbraw/zinc/76/68/41/1371766841.db2.gz	UPVPEZIULCXORH-GOSISDBHSA-N	0	3	346.421	3.054	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN(C[C@@H](O)c2ccc(CC)cc2)C[C@H]1C	ZINC001208452585	1371771163	/nfs/dbraw/zinc/77/11/63/1371771163.db2.gz	SXLRHUUTNXMTHH-NSISKUIASA-N	0	3	344.499	3.075	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN(Cc2ccccc2N(C)C)C[C@H]1C	ZINC001208452370	1371771269	/nfs/dbraw/zinc/77/12/69/1371771269.db2.gz	IEXGJFXRPDNUTB-SJLPKXTDSA-N	0	3	329.488	3.045	20	30		EGEDHN
C=C(Br)CNC[C@H](C1CC1)N(C)C(=O)C1(CCC)CC1	ZINC001734305518	1438036856	/nfs/dbraw/zinc/03/68/56/1438036856.db2.gz	SQDMCBNZNQRMNQ-CQSZACIVSA-N	0	3	343.309	3.302	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC1CC2(CC(NCc3cnoc3C)C2)C1	ZINC001121155731	1371870140	/nfs/dbraw/zinc/87/01/40/1371870140.db2.gz	SKGJKGLUADYHJU-UHFFFAOYSA-N	0	3	343.471	3.268	20	30		EGEDHN
COC(=O)[C@@H](C)CN(Cc1ccc(C#N)cc1)Cc1ccc(C#N)cc1	ZINC001208726408	1371875336	/nfs/dbraw/zinc/87/53/36/1371875336.db2.gz	PEBQKWRUPOZRQX-INIZCTEOSA-N	0	3	347.418	3.241	20	30		EGEDHN
N#Cc1cccc(CCCN2CC[C@@H](N3CCCCC3)[C@@H](F)C2)c1	ZINC001208860681	1371922345	/nfs/dbraw/zinc/92/23/45/1371922345.db2.gz	RWGOMJZNBZQMLA-VQTJNVASSA-N	0	3	329.463	3.389	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CN(CCc2ccccc2F)C[C@H]1C	ZINC001208955021	1371962825	/nfs/dbraw/zinc/96/28/25/1371962825.db2.gz	YFMHRTVKCWTVCC-CRAIPNDOSA-N	0	3	332.463	3.407	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CN(Cc2ccccc2N(C)C)C[C@H]1C	ZINC001208964158	1371965453	/nfs/dbraw/zinc/96/54/53/1371965453.db2.gz	UMHISWZMHVCPGO-SJLPKXTDSA-N	0	3	343.515	3.291	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001209182522	1372027676	/nfs/dbraw/zinc/02/76/76/1372027676.db2.gz	FCIPLDMJANXAHC-XLIONFOSSA-N	0	3	342.458	3.360	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC[C@H](NCc2ccc(C#N)s2)C1	ZINC001209192928	1372033073	/nfs/dbraw/zinc/03/30/73/1372033073.db2.gz	DTYFQPZDZHMAJW-GJZGRUSLSA-N	0	3	331.485	3.303	20	30		EGEDHN
C=CCCCN1C[C@@H](C)[C@H](NC(=O)c2cnc([C@H]3CCCO3)s2)C1	ZINC001209255053	1372051812	/nfs/dbraw/zinc/05/18/12/1372051812.db2.gz	SMNLDYAUUWCENJ-RBSFLKMASA-N	0	3	349.500	3.011	20	30		EGEDHN
CCC(C)(C)C(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001209334358	1372071170	/nfs/dbraw/zinc/07/11/70/1372071170.db2.gz	CORPUPZJTBQVLX-SFHVURJKSA-N	0	3	330.447	3.194	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@@H](NCc2cnn(C(C)(C)C)c2)C1	ZINC001209373481	1372080286	/nfs/dbraw/zinc/08/02/86/1372080286.db2.gz	CAHIPGARDAIJAF-QGZVFWFLSA-N	0	3	332.492	3.075	20	30		EGEDHN
C[C@@H]1CC(CN2CCN(c3ccc(C#N)cc3F)CC2)C[C@@H](C)O1	ZINC001209400103	1372092167	/nfs/dbraw/zinc/09/21/67/1372092167.db2.gz	XFZOKJTZLPYNOQ-HUUCEWRRSA-N	0	3	331.435	3.023	20	30		EGEDHN
C=CCC1(C(=O)N2CCC[C@@H](NCc3scnc3C)C2)CCC1	ZINC001209504008	1372122525	/nfs/dbraw/zinc/12/25/25/1372122525.db2.gz	OOEDHFAJHDQESF-OAHLLOKOSA-N	0	3	333.501	3.279	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001209526246	1372128568	/nfs/dbraw/zinc/12/85/68/1372128568.db2.gz	YGWNCOMYJRWOKW-MISYRCLQSA-N	0	3	342.458	3.194	20	30		EGEDHN
O=C([C@@H]1C[C@H]1C1CCC1)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001210051915	1372263278	/nfs/dbraw/zinc/26/32/78/1372263278.db2.gz	LMIJRWGYFFKZEF-QHAWAJNXSA-N	0	3	336.479	3.055	20	30		EGEDHN
N#CC(C(=O)c1cnn(CC2CC2)c1)c1nccn1Cc1ccccc1	ZINC001122512908	1372263845	/nfs/dbraw/zinc/26/38/45/1372263845.db2.gz	BRJJMWGZCGKZRQ-GOSISDBHSA-N	0	3	345.406	3.028	20	30		EGEDHN
CC(C)(C)CCC(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001210206538	1372294413	/nfs/dbraw/zinc/29/44/13/1372294413.db2.gz	NMERQTKOOOQNAM-LJQANCHMSA-N	0	3	326.484	3.445	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)C[C@@H]2CCCC(C)(C)C2)C1	ZINC001210277888	1372313667	/nfs/dbraw/zinc/31/36/67/1372313667.db2.gz	XIENZTMMDGXKRV-FGTMMUONSA-N	0	3	336.520	3.232	20	30		EGEDHN
N#Cc1ccc(Oc2ccc(CN3CCNC[C@H](F)C3)cc2)cc1	ZINC001210611754	1372390860	/nfs/dbraw/zinc/39/08/60/1372390860.db2.gz	UGAUUVQHEVBAOZ-KRWDZBQOSA-N	0	3	325.387	3.094	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCCC(=O)c1cccc(OC)c1	ZINC001123336023	1372431020	/nfs/dbraw/zinc/43/10/20/1372431020.db2.gz	BRFSPJGCYNBSNW-MRXNPFEDSA-N	0	3	339.395	3.141	20	30		EGEDHN
C=C(CN1CCCCC1)c1nc(-c2cncc(Br)c2)no1	ZINC001211436582	1372558884	/nfs/dbraw/zinc/55/88/84/1372558884.db2.gz	QLFFWDKTXSZSKM-UHFFFAOYSA-N	0	3	349.232	3.393	20	30		EGEDHN
C=C(CN1CCCCC1)c1nc(-c2cccc(C3OCCO3)c2)no1	ZINC001211436194	1372559010	/nfs/dbraw/zinc/55/90/10/1372559010.db2.gz	FBFXEUJLRVYRJP-UHFFFAOYSA-N	0	3	341.411	3.281	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](c2ccccc2)[C@H](NCc2cncc(C)c2)C1	ZINC001211551229	1372578813	/nfs/dbraw/zinc/57/88/13/1372578813.db2.gz	DKRWAOJACJRZHV-LEWJYISDSA-N	0	3	349.478	3.440	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)CCCC(C)(C)C)C[C@H]1c1ccccc1	ZINC001211559894	1372580758	/nfs/dbraw/zinc/58/07/58/1372580758.db2.gz	XHKPPOCJZDGGGN-RBUKOAKNSA-N	0	3	326.484	3.420	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@H]2CCCC23CC3)C[C@H]1c1ccccc1	ZINC001211623762	1372592120	/nfs/dbraw/zinc/59/21/20/1372592120.db2.gz	RYACONYRWMMKDD-XUVXKRRUSA-N	0	3	336.479	3.174	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2cc[nH]c2C2CC2)C[C@H]1c1ccccc1	ZINC001211659055	1372598309	/nfs/dbraw/zinc/59/83/09/1372598309.db2.gz	FLLUZROABJWBNV-VQTJNVASSA-N	0	3	347.462	3.113	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)CCCc2ccccc2)C[C@H]1c1ccccc1	ZINC001211667174	1372600069	/nfs/dbraw/zinc/60/00/69/1372600069.db2.gz	XRTDORRWOWXEJX-FCHUYYIVSA-N	0	3	346.474	3.227	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H](CC)CC(C)C)C[C@H]1c1ccccc1	ZINC001211705340	1372606227	/nfs/dbraw/zinc/60/62/27/1372606227.db2.gz	FUWOTZGSKWRTCE-YSIASYRMSA-N	0	3	326.484	3.276	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2cc(Cl)c[nH]2)[C@H](OC)C1	ZINC001211842691	1372619472	/nfs/dbraw/zinc/61/94/72/1372619472.db2.gz	ZGKNLCJBJZDBID-HZPDHXFCSA-N	0	3	341.883	3.068	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CN([C@@H](CC)c2ccccc2)C[C@H]1OC	ZINC001212148519	1372664788	/nfs/dbraw/zinc/66/47/88/1372664788.db2.gz	LAXKFWOPVNPWHJ-HSALFYBXSA-N	0	3	342.483	3.147	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2ccoc2CC)[C@H](OC)C1	ZINC001212195957	1372669315	/nfs/dbraw/zinc/66/93/15/1372669315.db2.gz	IMQAEKOSGLMHOD-SJLPKXTDSA-N	0	3	336.476	3.241	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)C(C)(C)C(C)C)[C@H](OC)C1	ZINC001212327538	1372687646	/nfs/dbraw/zinc/68/76/46/1372687646.db2.gz	JVESDRVOLGIJBD-IAGOWNOFSA-N	0	3	326.525	3.454	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)CCCC[C@H](C)CC)[C@@H]2C1	ZINC001188043912	1388227460	/nfs/dbraw/zinc/22/74/60/1388227460.db2.gz	PHMUYPIQZHLRDG-CEXWTWQISA-N	0	3	336.520	3.328	20	30		EGEDHN
CN1CCN(c2ccc(Nc3cc(F)c(O)c(F)c3)cc2C#N)CC1	ZINC001213381724	1372897106	/nfs/dbraw/zinc/89/71/06/1372897106.db2.gz	CAFVTAZLCXGWFA-UHFFFAOYSA-N	0	3	344.365	3.037	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1CN(CCC2=CCCCC2)C[C@H]1OC	ZINC001213389811	1372899007	/nfs/dbraw/zinc/89/90/07/1372899007.db2.gz	IFJSSENAUVJFAO-GGPKGHCWSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)C[C@@H](C)c2ccc(CC)cc2)[C@H](OC)C1	ZINC001213442699	1372906558	/nfs/dbraw/zinc/90/65/58/1372906558.db2.gz	URXDZDQVXTXSDF-NSISKUIASA-N	0	3	344.499	3.134	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)[C@@H](CC)CC2CCCC2)[C@H](OC)C1	ZINC001213526379	1372919629	/nfs/dbraw/zinc/91/96/29/1372919629.db2.gz	KQHBKDWQAUMHOX-IPMKNSEASA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H](NC(=O)c2cc(Cl)cs2)[C@H](OC)C1	ZINC001213529113	1372919697	/nfs/dbraw/zinc/91/96/97/1372919697.db2.gz	LPCUWJXZUXGBKG-IACUBPJLSA-N	0	3	342.892	3.185	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)C(C)(C)C2CCCCC2)[C@H](OC)C1	ZINC001213547289	1372924077	/nfs/dbraw/zinc/92/40/77/1372924077.db2.gz	MRCYNBVWYLDOMX-QZTJIDSGSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H](NC(=O)c2ccc(C3CC3)s2)[C@H](OC)C1	ZINC001213717493	1372950099	/nfs/dbraw/zinc/95/00/99/1372950099.db2.gz	SLIBFYDDLNQRLZ-NUEKZKHPSA-N	0	3	348.512	3.409	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)CC(C)(C)c2ccc(C)cc2)[C@H](OC)C1	ZINC001213827432	1372968170	/nfs/dbraw/zinc/96/81/70/1372968170.db2.gz	LEAZAPYVQFNDGE-RTBURBONSA-N	0	3	344.499	3.054	20	30		EGEDHN
Cc1ccsc1C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2)C1	ZINC001214054039	1373001122	/nfs/dbraw/zinc/00/11/22/1373001122.db2.gz	GGXNAOUGRONXJI-SJLPKXTDSA-N	0	3	338.476	3.158	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC(C)(C)C)C[C@H]1NCC#Cc1ccc(F)cc1	ZINC001214144658	1373014924	/nfs/dbraw/zinc/01/49/24/1373014924.db2.gz	SGSPUBQDNQLKIC-CRAIPNDOSA-N	0	3	330.447	3.050	20	30		EGEDHN
CC/C=C(/C)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001214254680	1373030959	/nfs/dbraw/zinc/03/09/59/1373030959.db2.gz	DLJBPVHRJVJYRE-FCSMGOPFSA-N	0	3	344.886	3.484	20	30		EGEDHN
CC(C)[C@H](C)CC(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001214307723	1373042090	/nfs/dbraw/zinc/04/20/90/1373042090.db2.gz	LFXQGCWAUVICIJ-SPYBWZPUSA-N	0	3	345.462	3.316	20	30		EGEDHN
C[C@@H]1CN(C(=O)/C=C\C2CC2)C[C@H]1NCC#Cc1ccccc1Cl	ZINC001214391367	1373053539	/nfs/dbraw/zinc/05/35/39/1373053539.db2.gz	IMTCINHHYLQAMG-LWRVRWKQSA-N	0	3	342.870	3.094	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@]2(C)CC=CCC2)C[C@H]1NCC#Cc1ccccc1	ZINC001214704872	1373105265	/nfs/dbraw/zinc/10/52/65/1373105265.db2.gz	KBSTWWYZVMSJMK-SYYKKAFVSA-N	0	3	336.479	3.221	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCNCc1csc(Br)c1	ZINC001128264067	1373243460	/nfs/dbraw/zinc/24/34/60/1373243460.db2.gz	OOPJJTXKORMNOM-UHFFFAOYSA-N	0	3	345.306	3.319	20	30		EGEDHN
CCC[C@@H](CC)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001216104982	1373264454	/nfs/dbraw/zinc/26/44/54/1373264454.db2.gz	QVISNEDFEXQXHL-YVWKXTFCSA-N	0	3	344.474	3.440	20	30		EGEDHN
Cc1ccc2occ(CC(=O)NCCNCc3cccc(C#N)c3)c2c1	ZINC001128432049	1373266100	/nfs/dbraw/zinc/26/61/00/1373266100.db2.gz	KVSUWFXXTDZINY-UHFFFAOYSA-N	0	3	347.418	3.061	20	30		EGEDHN
CC(C)(C)c1ccccc1C(=O)NCCNCc1cccc(C#N)c1	ZINC001130047995	1373448518	/nfs/dbraw/zinc/44/85/18/1373448518.db2.gz	CMHOOBNAYQGJAZ-UHFFFAOYSA-N	0	3	335.451	3.375	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cc(C3CC3)[nH]c2C2CC2)cc1	ZINC001130224647	1373476076	/nfs/dbraw/zinc/47/60/76/1373476076.db2.gz	WJVDDHOKGNMLHP-UHFFFAOYSA-N	0	3	348.450	3.161	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2OCCN(C(=O)C(F)=C3CCCC3)[C@H]2C1	ZINC001217631549	1373477823	/nfs/dbraw/zinc/47/78/23/1373477823.db2.gz	NVPVAEFSFIZOFN-BHYGNILZSA-N	0	3	336.451	3.050	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NCCN[C@H](C)c1cccc(F)c1	ZINC001130376391	1373510254	/nfs/dbraw/zinc/51/02/54/1373510254.db2.gz	TYLOZQCIIFHXLQ-OAHLLOKOSA-N	0	3	342.414	3.471	20	30		EGEDHN
C#CCCCCCC(=O)N1CCO[C@@H]2CN(CC/C=C/CCC)C[C@@H]21	ZINC001218455090	1373617324	/nfs/dbraw/zinc/61/73/24/1373617324.db2.gz	MGKHRPVNAIOGCM-BJIJGURPSA-N	0	3	346.515	3.228	20	30		EGEDHN
CC#CCCCC(=O)N1CCO[C@@H]2CN(CCC3CCCCC3)C[C@@H]21	ZINC001218504364	1373627309	/nfs/dbraw/zinc/62/73/09/1373627309.db2.gz	UNMGFQJAVSQXCX-VQTJNVASSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)c3ccc(Cl)cc3C)[C@H]2C1	ZINC001218576072	1373633518	/nfs/dbraw/zinc/63/35/18/1373633518.db2.gz	UFOLSEDOGNARKC-ZWKOTPCHSA-N	0	3	348.874	3.140	20	30		EGEDHN
CC(C)CC1(C(=O)NCCNCc2ccc(C#N)c(F)c2)CCC1	ZINC001131141528	1373650817	/nfs/dbraw/zinc/65/08/17/1373650817.db2.gz	CXGMNRYBPBLUPL-UHFFFAOYSA-N	0	3	331.435	3.120	20	30		EGEDHN
COc1ccc(CNCCNC(=O)C2CCCCCCC2)cc1C#N	ZINC001131145564	1373652405	/nfs/dbraw/zinc/65/24/05/1373652405.db2.gz	AOKPTSUHQJRDHP-UHFFFAOYSA-N	0	3	343.471	3.133	20	30		EGEDHN
N#Cc1c(F)ccc(NC(=O)[C@@H]2C[C@H](c3ccccc3)CCN2)c1F	ZINC001218914136	1373666471	/nfs/dbraw/zinc/66/64/71/1373666471.db2.gz	QVTQNKCEYJUOKT-DYVFJYSZSA-N	0	3	341.361	3.311	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)C[C@H](C)CCCCCC)[C@H]2C1	ZINC001218946313	1373669757	/nfs/dbraw/zinc/66/97/57/1373669757.db2.gz	OKQOTRJFRJURFJ-CEXWTWQISA-N	0	3	336.520	3.471	20	30		EGEDHN
C[Si](C)(C)C#Cc1cccc(NC(=O)C[C@H]2CCNC[C@H]2F)c1	ZINC001219311153	1373700413	/nfs/dbraw/zinc/70/04/13/1373700413.db2.gz	TXVHWTDASLQWHG-NVXWUHKLSA-N	0	3	332.495	3.192	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)Nc1ccc(F)c2c1OCCC2=O	ZINC001219483060	1373711816	/nfs/dbraw/zinc/71/18/16/1373711816.db2.gz	OGXMJMAHDFVHFD-ZDUSSCGKSA-N	0	3	334.391	3.193	20	30		EGEDHN
Cc1ccc(C(=O)NCCNCc2ccc(C#N)cc2)c(F)c1Cl	ZINC001131691952	1373765454	/nfs/dbraw/zinc/76/54/54/1373765454.db2.gz	ASHOOABPHKNFMQ-UHFFFAOYSA-N	0	3	345.805	3.179	20	30		EGEDHN
C=CCC[C@H](C)N1CC[C@@H]2CN(C(=O)c3ncc(Cl)s3)[C@@H]2C1	ZINC001221686012	1373789721	/nfs/dbraw/zinc/78/97/21/1373789721.db2.gz	KUMWCTROWRKMJH-YNEHKIRRSA-N	0	3	339.892	3.298	20	30		EGEDHN
CC(C)=CC(=O)N[C@H]1CC[C@@H](C)N(Cc2ccc(OCC#N)cc2)C1	ZINC001131771642	1373794955	/nfs/dbraw/zinc/79/49/55/1373794955.db2.gz	JWAVALAWFFATID-AEFFLSMTSA-N	0	3	341.455	3.024	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)CC3(C)CCCCC3)[C@@H]2C1	ZINC001188510469	1388322360	/nfs/dbraw/zinc/32/23/60/1388322360.db2.gz	VXHBGUNGXBHNFY-ZWKOTPCHSA-N	0	3	334.504	3.082	20	30		EGEDHN
C#CCN1CCC(CNC(=O)CCc2ccc(C)c(Cl)c2)CC1	ZINC001223957673	1375049513	/nfs/dbraw/zinc/04/95/13/1375049513.db2.gz	DJTXBHATTDLQEX-UHFFFAOYSA-N	0	3	332.875	3.042	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCC1CCN(Cc2ncccc2C)CC1	ZINC001224187410	1375060348	/nfs/dbraw/zinc/06/03/48/1375060348.db2.gz	PKZYKJUKQBBCFN-KRWDZBQOSA-N	0	3	329.488	3.321	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@H](C)N(CCOC2CCCCCC2)C1	ZINC001131996659	1375089729	/nfs/dbraw/zinc/08/97/29/1375089729.db2.gz	WZFLEJAPGDDQTF-RBUKOAKNSA-N	0	3	348.531	3.498	20	30		EGEDHN
Cc1cc(C)cc(CN2C[C@@H](NC(=O)C#CC(C)C)CC[C@@H]2C)c1	ZINC001132015930	1375100007	/nfs/dbraw/zinc/10/00/07/1375100007.db2.gz	BQZZWGZSEBPZTJ-ICSRJNTNSA-N	0	3	326.484	3.432	20	30		EGEDHN
Cc1ccc(C)c(CN2C[C@H](NC(=O)C#CC(C)C)CC[C@H]2C)c1	ZINC001132017263	1375100532	/nfs/dbraw/zinc/10/05/32/1375100532.db2.gz	NJADDAFEQDMIKZ-UYAOXDASSA-N	0	3	326.484	3.432	20	30		EGEDHN
C[C@@H]1CC[C@H](NC(=O)C#CC2CC2)CN1Cc1ccccc1C1CC1	ZINC001132033405	1375107631	/nfs/dbraw/zinc/10/76/31/1375107631.db2.gz	FXCHMYZUGBBDNT-UZLBHIALSA-N	0	3	336.479	3.447	20	30		EGEDHN
C[C@@H]1CC[C@@H](NC(=O)C#CC2CC2)CN1Cc1ccc2ncccc2c1	ZINC001132047298	1375116143	/nfs/dbraw/zinc/11/61/43/1375116143.db2.gz	WFEKIHUOVXDWHF-OXQOHEQNSA-N	0	3	347.462	3.117	20	30		EGEDHN
C[C@H](CC(=O)NCC1CCN(Cc2ccc(C#N)cc2)CC1)C1CC1	ZINC001225596136	1375129961	/nfs/dbraw/zinc/12/99/61/1375129961.db2.gz	AEZRNSQICHDWTI-MRXNPFEDSA-N	0	3	339.483	3.323	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@@H](CC)c2ccc(F)cc2)CC1	ZINC001225610805	1375131694	/nfs/dbraw/zinc/13/16/94/1375131694.db2.gz	DBUCPBQLYGOJAG-IBGZPJMESA-N	0	3	330.447	3.171	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2cn3cc(C)nc3s2)CC[C@H]1C	ZINC001132097270	1375144845	/nfs/dbraw/zinc/14/48/45/1375144845.db2.gz	HUKLASLUOUKYKZ-CABCVRRESA-N	0	3	346.500	3.253	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)C2(CC(C)C)CCC2)CC[C@H]1C	ZINC001132169643	1375185062	/nfs/dbraw/zinc/18/50/62/1375185062.db2.gz	RTVQVRZXBURJHX-MSOLQXFVSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)C2CCC3(CC3)CC2)CC[C@@H]1C	ZINC001132173007	1375188115	/nfs/dbraw/zinc/18/81/15/1375188115.db2.gz	GAEKWKHKEUEDSA-WMZOPIPTSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCc2ccc3[nH]ccc3c2)CC[C@H]1C	ZINC001132177583	1375189986	/nfs/dbraw/zinc/18/99/86/1375189986.db2.gz	BXWTWEYDSBNLIW-CRAIPNDOSA-N	0	3	325.456	3.256	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCCOc2ccccc2C)CC[C@H]1C	ZINC001132212447	1375213068	/nfs/dbraw/zinc/21/30/68/1375213068.db2.gz	YOCZFDUIBOEFCS-QZTJIDSGSA-N	0	3	330.472	3.309	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2CC[C@@H](C)N(CCOCC3CC3)C2)CC1	ZINC001132277622	1375261135	/nfs/dbraw/zinc/26/11/35/1375261135.db2.gz	HVQMRPUDCIFWKH-SJLPKXTDSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H]1CCCC[C@H]1NCc1ccns1	ZINC001226468240	1375263944	/nfs/dbraw/zinc/26/39/44/1375263944.db2.gz	ISKIHSYWXKVOOM-ZIAGYGMSSA-N	0	3	341.908	3.439	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2cc[nH]c2C2CCC2)CC[C@H]1C	ZINC001132306231	1375285134	/nfs/dbraw/zinc/28/51/34/1375285134.db2.gz	TYRBITDPMVTEGG-WBVHZDCISA-N	0	3	345.487	3.068	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1CC[C@H](C)N(Cc2ccc(CO)cc2)C1	ZINC001132330276	1375309319	/nfs/dbraw/zinc/30/93/19/1375309319.db2.gz	DOKZNZDJCOIKKH-LPHOPBHVSA-N	0	3	344.499	3.250	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)C23CCC(CC2)C3(C)C)CC[C@@H]1C	ZINC001132340193	1375320056	/nfs/dbraw/zinc/32/00/56/1375320056.db2.gz	OLCSHRPGJWPNFW-LCUHEZEJSA-N	0	3	348.531	3.375	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCNCc1cc(F)cc(Br)c1	ZINC001132395696	1375350134	/nfs/dbraw/zinc/35/01/34/1375350134.db2.gz	LPPLKSKWBAHTLL-UHFFFAOYSA-N	0	3	343.240	3.006	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2c[nH]c(C)cc2=O)CC[C@H]1C	ZINC001132403505	1375355350	/nfs/dbraw/zinc/35/53/50/1375355350.db2.gz	XWNMXAIYUCUFLZ-SJORKVTESA-N	0	3	347.503	3.236	20	30		EGEDHN
O=C(N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1)C1(C2CC2)CC1	ZINC001226965769	1375372907	/nfs/dbraw/zinc/37/29/07/1375372907.db2.gz	XVIBZUBBDAFDCO-WOJBJXKFSA-N	0	3	336.479	3.245	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)COc2ccccc2C(C)C)CC[C@@H]1C	ZINC001132469883	1375411331	/nfs/dbraw/zinc/41/13/31/1375411331.db2.gz	YHFBVEVTZQHZIZ-ROUUACIJSA-N	0	3	342.483	3.181	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COc2cc(C)ccc2C)CC[C@@H]1C	ZINC001132498997	1375426545	/nfs/dbraw/zinc/42/65/45/1375426545.db2.gz	ACSNERDQSZBDNP-ROUUACIJSA-N	0	3	330.472	3.227	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)C23CC(C(C)(C)C)(C2)C3)CC[C@@H]1C	ZINC001132525199	1375441414	/nfs/dbraw/zinc/44/14/14/1375441414.db2.gz	OYSOPKKHKOFGJR-AMZMEHNNSA-N	0	3	348.531	3.375	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1CC[C@@H](C)N(Cc2cccc(C)c2)C1	ZINC001132529818	1375443943	/nfs/dbraw/zinc/44/39/43/1375443943.db2.gz	RPIGDHPPMRUDLE-IEBWSBKVSA-N	0	3	330.472	3.057	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1CC[C@H](C)N(Cc2ccc(CC)cc2)C1	ZINC001132532633	1375444610	/nfs/dbraw/zinc/44/46/10/1375444610.db2.gz	GDOXUFSVOLEFBU-FXAWDEMLSA-N	0	3	344.499	3.311	20	30		EGEDHN
C#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)CCCC)CC1	ZINC001132552590	1375458630	/nfs/dbraw/zinc/45/86/30/1375458630.db2.gz	XGAKIAOMMCLARA-LJQANCHMSA-N	0	3	327.472	3.088	20	30		EGEDHN
C#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)C[C@@H](C)CC)CC1	ZINC001132554729	1375460688	/nfs/dbraw/zinc/46/06/88/1375460688.db2.gz	LBTCDZAHXPJKJZ-AZUAARDMSA-N	0	3	341.499	3.334	20	30		EGEDHN
C=CCN1CCC[C@H](N(Cc2ccccn2)C(=O)C#CC(C)C)CC1	ZINC001132554583	1375460744	/nfs/dbraw/zinc/46/07/44/1375460744.db2.gz	JVOYFGACLSJIFM-FQEVSTJZSA-N	0	3	339.483	3.110	20	30		EGEDHN
O=C(N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1)C1(CCF)CC1	ZINC001227688884	1375461586	/nfs/dbraw/zinc/46/15/86/1375461586.db2.gz	PDMSHVCLBGMTMG-RTBURBONSA-N	0	3	342.458	3.195	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCNCc1ccc(Br)s1	ZINC001132577301	1375473776	/nfs/dbraw/zinc/47/37/76/1375473776.db2.gz	SJHMUEZJLMIZSG-MNOVXSKESA-N	0	3	345.306	3.175	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCNCc1ccc(Br)s1	ZINC001132577300	1375473852	/nfs/dbraw/zinc/47/38/52/1375473852.db2.gz	SJHMUEZJLMIZSG-GHMZBOCLSA-N	0	3	345.306	3.175	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CCCC[C@H]1NCc1ccc(C#N)cc1F	ZINC001227973396	1375496510	/nfs/dbraw/zinc/49/65/10/1375496510.db2.gz	QOYNVKNDMKZGBR-QZTJIDSGSA-N	0	3	343.446	3.427	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CCCC[C@H]1NCc1cccnc1OC	ZINC001228112541	1375518961	/nfs/dbraw/zinc/51/89/61/1375518961.db2.gz	KWQIPVTUOUBEHE-CGTJXYLNSA-N	0	3	345.487	3.210	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](C)[C@@H](CNC/C(Cl)=C/Cl)C1	ZINC001132786372	1375564055	/nfs/dbraw/zinc/56/40/55/1375564055.db2.gz	TYGFWRJVBUWOJL-DDBGXBMASA-N	0	3	331.287	3.183	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](C)[C@H](CNCc2cnc(C)o2)C1	ZINC001132843345	1375595596	/nfs/dbraw/zinc/59/55/96/1375595596.db2.gz	LNZGPSOAOMFTSS-MAUKXSAKSA-N	0	3	345.487	3.326	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](C)[C@H](CNCc2cscn2)C1	ZINC001132847137	1375600650	/nfs/dbraw/zinc/60/06/50/1375600650.db2.gz	SLIXLLAWBGFFRA-HUUCEWRRSA-N	0	3	335.517	3.320	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC001228747450	1375661243	/nfs/dbraw/zinc/66/12/43/1375661243.db2.gz	AYMAXCXVQXFFAT-HZPDHXFCSA-N	0	3	348.462	3.243	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NC1CCN(CCOc2cccc(C)c2)CC1	ZINC001228748881	1375661794	/nfs/dbraw/zinc/66/17/94/1375661794.db2.gz	NXEHBIFZNKALFA-ZWKOTPCHSA-N	0	3	344.499	3.413	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)CCCc2ccc(C)cc2)CC1	ZINC001228970332	1375727459	/nfs/dbraw/zinc/72/74/59/1375727459.db2.gz	AWPMEMLRBMBZCQ-UHFFFAOYSA-N	0	3	344.499	3.101	20	30		EGEDHN
C[C@@H]1CCN(C(=O)CCCF)C[C@@H]1CNCc1cc(F)ccc1C#N	ZINC001133059294	1375749743	/nfs/dbraw/zinc/74/97/43/1375749743.db2.gz	OFLMIVFGXMUWQF-PBHICJAKSA-N	0	3	349.425	3.021	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@H](C)[C@H](CNCc3cc(C)no3)C2)CC1	ZINC001133104824	1375777113	/nfs/dbraw/zinc/77/71/13/1375777113.db2.gz	KUMAZNJORGZEGL-DOTOQJQBSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC1CCN(Cc2ccc3c(c2)COC3)CC1	ZINC001229377210	1375822674	/nfs/dbraw/zinc/82/26/74/1375822674.db2.gz	RMELCCKLVOAKMV-UHFFFAOYSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=C[C@H](C(=O)NC1CCN(CCOCCCC)CC1)c1ccccc1	ZINC001230334078	1375999745	/nfs/dbraw/zinc/99/97/45/1375999745.db2.gz	GNOPHDAWYWCOBU-FQEVSTJZSA-N	0	3	344.499	3.354	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)C[C@@H](C)c2ccc(F)cc2)CC1	ZINC001230342901	1376004286	/nfs/dbraw/zinc/00/42/86/1376004286.db2.gz	ZVRMZBITGVDOEA-MRXNPFEDSA-N	0	3	348.462	3.103	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)C/C=C\c2ccc(C)cc2)CC1	ZINC001230496593	1376041494	/nfs/dbraw/zinc/04/14/94/1376041494.db2.gz	DBCBUQJUJJUQIW-PLNGDYQASA-N	0	3	342.483	3.182	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)c1ccccc1	ZINC001133524622	1376058174	/nfs/dbraw/zinc/05/81/74/1376058174.db2.gz	HUBJJVXIQUNTHY-CHWSQXEVSA-N	0	3	325.250	3.082	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1C1CCN(C(=O)[C@@H](C)CSC)CC1	ZINC001230537787	1376060270	/nfs/dbraw/zinc/06/02/70/1376060270.db2.gz	KRVACQZPRSCNMF-XJKSGUPXSA-N	0	3	344.952	3.441	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1C1CCN(C(=O)[C@H](C)CSC)CC1	ZINC001230537786	1376061551	/nfs/dbraw/zinc/06/15/51/1376061551.db2.gz	KRVACQZPRSCNMF-CZUORRHYSA-N	0	3	344.952	3.441	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1cc(F)ccc1C#N)NC(=O)c1cccs1	ZINC001133580833	1376103793	/nfs/dbraw/zinc/10/37/93/1376103793.db2.gz	DCTLIFRRNMUJKH-QWHCGFSZSA-N	0	3	345.443	3.446	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)c1cccc(F)c1)Cc1cccnc1	ZINC001230656038	1376117636	/nfs/dbraw/zinc/11/76/36/1376117636.db2.gz	ORAGAEJEWNMIIJ-UHFFFAOYSA-N	0	3	341.430	3.419	20	30		EGEDHN
C[C@@H](CC(=O)NCCNCc1ccc(C#N)cc1)c1cccc(F)c1	ZINC001133612464	1376121220	/nfs/dbraw/zinc/12/12/20/1376121220.db2.gz	POPMUCHGMPTMTC-HNNXBMFYSA-N	0	3	339.414	3.097	20	30		EGEDHN
C=C(C)CCC(=O)NCCCN(CC[C@H](C)F)Cc1cccnc1	ZINC001230771895	1376148307	/nfs/dbraw/zinc/14/83/07/1376148307.db2.gz	VHNNOSTWGYKDQY-KRWDZBQOSA-N	0	3	335.467	3.494	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)c1csc(C)n1)Cc1cccnc1	ZINC001230824435	1376160217	/nfs/dbraw/zinc/16/02/17/1376160217.db2.gz	ATFYHTTVBSMKCE-UHFFFAOYSA-N	0	3	344.484	3.045	20	30		EGEDHN
C#CCCN(CCCNC(=O)CCCC(C)C)Cc1cccnc1	ZINC001230859569	1376166514	/nfs/dbraw/zinc/16/65/14/1376166514.db2.gz	FJWZMWIIKCOLRA-UHFFFAOYSA-N	0	3	329.488	3.240	20	30		EGEDHN
CC(C)SCC(=O)N[C@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001133726237	1376178652	/nfs/dbraw/zinc/17/86/52/1376178652.db2.gz	FZZZQNUTDGMROI-HUUCEWRRSA-N	0	3	333.501	3.073	20	30		EGEDHN
Cc1ncsc1C(=O)N[C@@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001133784046	1376205969	/nfs/dbraw/zinc/20/59/69/1376205969.db2.gz	FFBNRYVRXHMCGJ-STQMWFEESA-N	0	3	342.468	3.010	20	30		EGEDHN
C=CCOCC(=O)N(C)C[C@@H]1CCN1Cc1cccc2ccccc21	ZINC001231233609	1376217402	/nfs/dbraw/zinc/21/74/02/1376217402.db2.gz	LMDQOYKEJRWLCI-IBGZPJMESA-N	0	3	338.451	3.075	20	30		EGEDHN
C[C@@H](C#N)C(=O)N(C)C[C@@H]1CCN1CCCc1cccc2ccccc21	ZINC001231294695	1376222915	/nfs/dbraw/zinc/22/29/15/1376222915.db2.gz	ZWIRYWKZWOATIL-PXNSSMCTSA-N	0	3	349.478	3.465	20	30		EGEDHN
C=CCOCC(=O)N[C@H](C)C[C@H](C)NCc1cc(F)ccc1Cl	ZINC001133909044	1376259704	/nfs/dbraw/zinc/25/97/04/1376259704.db2.gz	GJESWFHDUFSDJA-QWHCGFSZSA-N	0	3	342.842	3.055	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1ccc(F)cc1OC)CC2	ZINC001231600713	1376275548	/nfs/dbraw/zinc/27/55/48/1376275548.db2.gz	BHSLHJYRQWLEBC-FQEVSTJZSA-N	0	3	346.446	3.367	20	30		EGEDHN
C#Cc1cccc(CN2CCC3(CC2)C(=O)N(C)[C@@H]3c2ccccc2)c1	ZINC001231656966	1376295428	/nfs/dbraw/zinc/29/54/28/1376295428.db2.gz	KMCCEJXMTVPOEW-OAQYLSRUSA-N	0	3	344.458	3.463	20	30		EGEDHN
C#Cc1cccc(CN2CCC[C@@]3(C[C@H](Oc4cccnc4)CO3)C2)c1	ZINC001231657875	1376298084	/nfs/dbraw/zinc/29/80/84/1376298084.db2.gz	WHMTUFZZOIGCAJ-FCHUYYIVSA-N	0	3	348.446	3.265	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)C1C(C)(C)C1(C)C	ZINC001134076362	1376353065	/nfs/dbraw/zinc/35/30/65/1376353065.db2.gz	KOBAQVXAMRTERX-VXGBXAGGSA-N	0	3	345.325	3.450	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3C(=O)Nc4ccccc4[C@H]3C2)cc1Cl	ZINC001232112569	1376400701	/nfs/dbraw/zinc/40/07/01/1376400701.db2.gz	XZOPQNJAGGKXID-CVEARBPZSA-N	0	3	337.810	3.379	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2ccc(-c3ccccc3)o2)c1	ZINC001134179106	1376403286	/nfs/dbraw/zinc/40/32/86/1376403286.db2.gz	XCGIYLAMRIEODY-UHFFFAOYSA-N	0	3	345.402	3.338	20	30		EGEDHN
N#CCC1CCN(Cc2ccc(N3CCOCC3)c(Cl)c2)CC1	ZINC001232203084	1376416567	/nfs/dbraw/zinc/41/65/67/1376416567.db2.gz	OHYMIHXIFHRYCR-UHFFFAOYSA-N	0	3	333.863	3.302	20	30		EGEDHN
CCc1occc1C(=O)N[C@@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001134273441	1376448894	/nfs/dbraw/zinc/44/88/94/1376448894.db2.gz	GHEBMFHDSFZDRR-GJZGRUSLSA-N	0	3	339.439	3.400	20	30		EGEDHN
Cc1cc[nH]c1C(=O)N[C@H](C)C[C@@H](C)NCc1cc(F)ccc1C#N	ZINC001134273697	1376449845	/nfs/dbraw/zinc/44/98/45/1376449845.db2.gz	ITSZPNSODTXKMT-ZIAGYGMSSA-N	0	3	342.418	3.021	20	30		EGEDHN
C=CCN(Cc1ccccc1)Cc1ccc(N2CCN(C)CC2)nc1	ZINC001232362014	1376450137	/nfs/dbraw/zinc/45/01/37/1376450137.db2.gz	IVXSSHPJWSNEJP-UHFFFAOYSA-N	0	3	336.483	3.022	20	30		EGEDHN
CC/C(C)=C/C(=O)N[C@H](C)C[C@H](C)NCc1cc(F)ccc1C#N	ZINC001134285409	1376458509	/nfs/dbraw/zinc/45/85/09/1376458509.db2.gz	RPJVZJDPUDFBJC-WAYTWBJWSA-N	0	3	331.435	3.427	20	30		EGEDHN
CC(C(=O)N[C@@H](C)C[C@H](C)NCc1ccccc1C#N)=C1CCC1	ZINC001134307428	1376466241	/nfs/dbraw/zinc/46/62/41/1376466241.db2.gz	MCIFXCNUWKRTKM-GJZGRUSLSA-N	0	3	325.456	3.432	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)C2[C@@H]3CCCCCC[C@@H]23)ccc1F	ZINC001134314191	1376469277	/nfs/dbraw/zinc/46/92/77/1376469277.db2.gz	CDCUNPSGMLVFDO-IAGOWNOFSA-N	0	3	343.446	3.120	20	30		EGEDHN
CCC(CC)n1ccc(CN[C@H](C)C[C@@H](C)NC(=O)C#CC(C)C)n1	ZINC001134346072	1376488345	/nfs/dbraw/zinc/48/83/45/1376488345.db2.gz	YSMPFRPRFTZXRC-IAGOWNOFSA-N	0	3	346.519	3.277	20	30		EGEDHN
CCC(CC)n1ccc(CN[C@H](C)C[C@H](C)NC(=O)C#CC(C)C)n1	ZINC001134346074	1376488422	/nfs/dbraw/zinc/48/84/22/1376488422.db2.gz	YSMPFRPRFTZXRC-SJORKVTESA-N	0	3	346.519	3.277	20	30		EGEDHN
CN(CCc1ccccn1)Cc1ccc(Br)c(C#N)c1	ZINC001232892123	1376535134	/nfs/dbraw/zinc/53/51/34/1376535134.db2.gz	AJDVYDQIMGFRNX-UHFFFAOYSA-N	0	3	330.229	3.390	20	30		EGEDHN
CCN(Cc1cccc(C#N)n1)C[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC001232926783	1376538426	/nfs/dbraw/zinc/53/84/26/1376538426.db2.gz	BQTPRSLFIVHDRM-OAHLLOKOSA-N	0	3	344.459	3.032	20	30		EGEDHN
C=CCN1C(=O)CCC[C@]12CCCN(Cc1ccc3ncoc3c1)C2	ZINC001232941278	1376542262	/nfs/dbraw/zinc/54/22/62/1376542262.db2.gz	VVWPQZQIRSMHAC-HXUWFJFHSA-N	0	3	339.439	3.361	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H](C)C[C@H](C)NCc1cnc(C)o1	ZINC001134449789	1376544146	/nfs/dbraw/zinc/54/41/46/1376544146.db2.gz	WZDZQRAVCKMROG-QWRGUYRKSA-N	0	3	327.856	3.135	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H](C)C[C@H](C)NCc1csnc1OC	ZINC001134457711	1376548405	/nfs/dbraw/zinc/54/84/05/1376548405.db2.gz	SCDDDLZFVHOERC-STQMWFEESA-N	0	3	339.505	3.127	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CC[C@H]2O[C@@H](COCC3CC3)CC[C@H]21	ZINC001233081731	1376567891	/nfs/dbraw/zinc/56/78/91/1376567891.db2.gz	NGRGXORVCXVKIZ-NJDAHSKKSA-N	0	3	340.467	3.415	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2ccncc2Cl)CCC1	ZINC001134589122	1376612843	/nfs/dbraw/zinc/61/28/43/1376612843.db2.gz	PBABELJRHFRHID-GJZGRUSLSA-N	0	3	347.890	3.302	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)C[C@@H](C)NC/C(Cl)=C/Cl)CCC1	ZINC001134593199	1376615716	/nfs/dbraw/zinc/61/57/16/1376615716.db2.gz	JFNUHYIBXSAORH-OFLZDLGMSA-N	0	3	331.287	3.372	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1ccccc1C#N)NC(=O)C1(C2CC2)CC1	ZINC001134694420	1376664904	/nfs/dbraw/zinc/66/49/04/1376664904.db2.gz	RKAPBCOKRYNXMF-LSDHHAIUSA-N	0	3	325.456	3.121	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)CC1CC(F)(F)C1)NCc1ccccc1C#N	ZINC001134779526	1376716736	/nfs/dbraw/zinc/71/67/36/1376716736.db2.gz	WOIRYIOHCPLERE-ZIAGYGMSSA-N	0	3	349.425	3.367	20	30		EGEDHN
CN(CCCNC(=O)c1ccc(Cl)o1)Cc1ccc(C#N)c(F)c1	ZINC001233953258	1376743967	/nfs/dbraw/zinc/74/39/67/1376743967.db2.gz	LRWFRGMUXVGGJF-UHFFFAOYSA-N	0	3	349.793	3.196	20	30		EGEDHN
CN(C[C@H]1CCN1C[C@@H]1CCCC(F)(F)C1)C(=O)C#CC(C)(C)C	ZINC001234215562	1376788354	/nfs/dbraw/zinc/78/83/54/1376788354.db2.gz	MORGWZGHHBDZJE-HZPDHXFCSA-N	0	3	340.458	3.394	20	30		EGEDHN
C=CCCCCCN1CC[C@@H]1CN(C)C(=O)[C@@H]1CCCc2cn[nH]c21	ZINC001234324127	1376810863	/nfs/dbraw/zinc/81/08/63/1376810863.db2.gz	YKNQQEBOJLDQIS-QZTJIDSGSA-N	0	3	344.503	3.109	20	30		EGEDHN
C=CC1(CC(=O)NCCNCc2ccc([N+](=O)[O-])cc2)CCCCC1	ZINC001135186886	1376959281	/nfs/dbraw/zinc/95/92/81/1376959281.db2.gz	MVTAFXSXSPJLDM-UHFFFAOYSA-N	0	3	345.443	3.327	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H](C)C[C@H](C)NCc1conc1CC	ZINC001135188233	1376961474	/nfs/dbraw/zinc/96/14/74/1376961474.db2.gz	IGJYXHRADBLDMY-HOTGVXAUSA-N	0	3	333.476	3.194	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H](C)C[C@@H](C)NCc1cc(C2CC2)no1	ZINC001135230832	1376989871	/nfs/dbraw/zinc/98/98/71/1376989871.db2.gz	SGAQZWMBSKTVPV-CABCVRRESA-N	0	3	331.460	3.119	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H](C)C[C@@H](C)NCc1nc(C)sc1C	ZINC001135238920	1376996010	/nfs/dbraw/zinc/99/60/10/1376996010.db2.gz	SDPQCAWIWOTMCK-KGLIPLIRSA-N	0	3	335.517	3.326	20	30		EGEDHN
CCc1ccc([C@@H](C)C(=O)NCCNCc2ccc(C#N)cc2)cc1	ZINC001135368878	1377059286	/nfs/dbraw/zinc/05/92/86/1377059286.db2.gz	JLSGGKRDGPMWKQ-MRXNPFEDSA-N	0	3	335.451	3.130	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc(C(F)F)cc2)cc1F	ZINC001135384701	1377066768	/nfs/dbraw/zinc/06/67/68/1377066768.db2.gz	JNVNVWMNUZIMQP-UHFFFAOYSA-N	0	3	347.340	3.155	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2nccn2CC)CC1	ZINC001135383896	1377066811	/nfs/dbraw/zinc/06/68/11/1377066811.db2.gz	XGHCDQNNJRYHDH-CVEARBPZSA-N	0	3	332.492	3.022	20	30		EGEDHN
C=C[C@@H](NC[C@@H](O)COc1ccc(CCOC)cc1)c1ccccc1	ZINC001253076483	1377096119	/nfs/dbraw/zinc/09/61/19/1377096119.db2.gz	GGVKUCPFHFWGCM-TZIWHRDSSA-N	0	3	341.451	3.132	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)C1(C(C)(F)F)CC1)NCc1ccccc1C#N	ZINC001135493270	1377116886	/nfs/dbraw/zinc/11/68/86/1377116886.db2.gz	SGWPVHMNGJUVPY-KGLIPLIRSA-N	0	3	349.425	3.367	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H](C)C[C@H](C)NCc1ncc(Cl)n1C	ZINC001135560971	1377144920	/nfs/dbraw/zinc/14/49/20/1377144920.db2.gz	NTRWNQFZVYUDIB-QWHCGFSZSA-N	0	3	340.899	3.049	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)c1csc(C)c1	ZINC001135690711	1377184965	/nfs/dbraw/zinc/18/49/65/1377184965.db2.gz	KEIMTICSWAEMJD-MNOVXSKESA-N	0	3	345.306	3.452	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)C(C1CC1)C1CC1	ZINC001135902802	1377255399	/nfs/dbraw/zinc/25/53/99/1377255399.db2.gz	ZDWYPLZEHSGEBH-NEPJUHHUSA-N	0	3	343.309	3.204	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)C1(Cc2ccccc2)CC1)C(C)C	ZINC001268212325	1377495761	/nfs/dbraw/zinc/49/57/61/1377495761.db2.gz	LAYZVSQQYDVKJH-QGZVFWFLSA-N	0	3	334.891	3.492	20	30		EGEDHN
CN(CCNCc1ccc(C#N)s1)C(=O)c1ccc(Cl)s1	ZINC001753258056	1440343962	/nfs/dbraw/zinc/34/39/62/1440343962.db2.gz	UGYVYBWVECEEFU-UHFFFAOYSA-N	0	3	339.873	3.196	20	30		EGEDHN
C#CCOc1ccc(CN(CCOC(C)C)CCOC(C)C)cc1	ZINC001138558625	1377741919	/nfs/dbraw/zinc/74/19/19/1377741919.db2.gz	BOROHEQXEXNQTL-UHFFFAOYSA-N	0	3	333.472	3.351	20	30		EGEDHN
O=C1C=C2CN(Cc3cccc(Oc4ncccn4)c3)CCC2S1	ZINC001138619432	1377754936	/nfs/dbraw/zinc/75/49/36/1377754936.db2.gz	GWLHIDFMWFTKMA-INIZCTEOSA-N	0	3	339.420	3.043	20	30		EGEDHN
C=CCO[C@H]1CO[C@@]2(C1)CCC[N@@H+](Cc1cccc(CC=C)c1[O-])C2	ZINC001138628846	1377756567	/nfs/dbraw/zinc/75/65/67/1377756567.db2.gz	HKJBGESBXJWDAT-TZIWHRDSSA-N	0	3	343.467	3.447	20	30		EGEDHN
C=CCO[C@H]1CO[C@@]2(C1)CCC[N@H+](Cc1cccc(CC=C)c1[O-])C2	ZINC001138628846	1377756568	/nfs/dbraw/zinc/75/65/68/1377756568.db2.gz	HKJBGESBXJWDAT-TZIWHRDSSA-N	0	3	343.467	3.447	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@@H]3[C@@H](CCN3C(=O)C(C)C)C2)c1[O-]	ZINC001138627244	1377756932	/nfs/dbraw/zinc/75/69/32/1377756932.db2.gz	AJZPDRDBDYJZSI-PKOBYXMFSA-N	0	3	342.483	3.200	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@@H]3[C@@H](CCN3C(=O)C(C)C)C2)c1[O-]	ZINC001138627244	1377756933	/nfs/dbraw/zinc/75/69/33/1377756933.db2.gz	AJZPDRDBDYJZSI-PKOBYXMFSA-N	0	3	342.483	3.200	20	30		EGEDHN
C=CCN1C(=O)CCC[C@@]12CCCN(Cc1c(C)nn(CC)c1C)C2	ZINC001138643391	1377760959	/nfs/dbraw/zinc/76/09/59/1377760959.db2.gz	YJKBDOUOFXWBKC-FQEVSTJZSA-N	0	3	344.503	3.053	20	30		EGEDHN
CCn1nc(C)c(CN2CCC[C@H](Oc3cccc(C#N)c3)C2)c1C	ZINC001138646555	1377761895	/nfs/dbraw/zinc/76/18/95/1377761895.db2.gz	RYMWWJDWIZOIFC-IBGZPJMESA-N	0	3	338.455	3.435	20	30		EGEDHN
C=C(C)COc1ccccc1CN1CC[C@H]2[C@@H](CCC(=O)N2C)C1	ZINC001138666179	1377765263	/nfs/dbraw/zinc/76/52/63/1377765263.db2.gz	LAPFPAOFECHZEL-WMZOPIPTSA-N	0	3	328.456	3.084	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3ccccc3OCCC)C2)C1=O	ZINC001138997286	1377815753	/nfs/dbraw/zinc/81/57/53/1377815753.db2.gz	YNFHIJCSNFBJIN-OAQYLSRUSA-N	0	3	342.483	3.476	20	30		EGEDHN
C[C@H]1CCN(Cc2ccc(Oc3ccc(C#N)cc3)nc2)CC[C@H]1O	ZINC001139424659	1377882244	/nfs/dbraw/zinc/88/22/44/1377882244.db2.gz	SVQRTZLBEHFJQO-HNAYVOBHSA-N	0	3	337.423	3.338	20	30		EGEDHN
C[C@@H]1CCN(Cc2ccc(Oc3ccc(C#N)cc3)nc2)CC[C@H]1O	ZINC001139424658	1377882266	/nfs/dbraw/zinc/88/22/66/1377882266.db2.gz	SVQRTZLBEHFJQO-DNVCBOLYSA-N	0	3	337.423	3.338	20	30		EGEDHN
CN(CCCCNC(=O)OC(C)(C)C)Cc1ccc(C#N)c(F)c1	ZINC001139530987	1377898769	/nfs/dbraw/zinc/89/87/69/1377898769.db2.gz	ZXRXOGFGQABSFH-UHFFFAOYSA-N	0	3	335.423	3.434	20	30		EGEDHN
N#Cc1cccc2c(CN3CCC(Oc4ccccn4)CC3)c[nH]c21	ZINC001139702812	1377937628	/nfs/dbraw/zinc/93/76/28/1377937628.db2.gz	AWSFOIHMBMRIOR-UHFFFAOYSA-N	0	3	332.407	3.478	20	30		EGEDHN
N#Cc1cccc2c(CN3C[C@@H]4C(=O)c5ccccc5[C@@H]4C3)c[nH]c21	ZINC001139704819	1377938069	/nfs/dbraw/zinc/93/80/69/1377938069.db2.gz	YPBSOQPLGLMSRR-OALUTQOASA-N	0	3	327.387	3.451	20	30		EGEDHN
CCC(=O)N(CC)C1CCN(Cc2c[nH]c3c2cccc3C#N)CC1	ZINC001139707412	1377938217	/nfs/dbraw/zinc/93/82/17/1377938217.db2.gz	ZVAIXSZPLXLRMV-UHFFFAOYSA-N	0	3	338.455	3.262	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CCN(Cc3ccc(C)nc3)C2)C1	ZINC001139929248	1377978258	/nfs/dbraw/zinc/97/82/58/1377978258.db2.gz	SVTGZXGWHILTPF-LJQANCHMSA-N	0	3	329.444	3.001	20	30		EGEDHN
N#Cc1cccc(O[C@H]2CCC[N@@H+](Cc3cc(F)ccc3[O-])C2)c1	ZINC001140058935	1377997990	/nfs/dbraw/zinc/99/79/90/1377997990.db2.gz	PSKPMVZBJDKTFC-SFHVURJKSA-N	0	3	326.371	3.446	20	30		EGEDHN
N#Cc1cccc(O[C@H]2CCC[N@H+](Cc3cc(F)ccc3[O-])C2)c1	ZINC001140058935	1377997992	/nfs/dbraw/zinc/99/79/92/1377997992.db2.gz	PSKPMVZBJDKTFC-SFHVURJKSA-N	0	3	326.371	3.446	20	30		EGEDHN
N#Cc1ccc2[nH]cc(CN3CCCN(c4ccccn4)CC3)c2c1	ZINC001140111000	1378010545	/nfs/dbraw/zinc/01/05/45/1378010545.db2.gz	WEFWPZZDFLYDCP-UHFFFAOYSA-N	0	3	331.423	3.147	20	30		EGEDHN
CCCC(=O)N1CCCC[C@@H]1CNCC#Cc1ccccc1Cl	ZINC001272923536	1378083286	/nfs/dbraw/zinc/08/32/86/1378083286.db2.gz	LBDKVWDXNJJBFH-QGZVFWFLSA-N	0	3	332.875	3.462	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3cc(C#N)ccc3Cl)C2)C1=O	ZINC001140598785	1378094513	/nfs/dbraw/zinc/09/45/13/1378094513.db2.gz	DNBGTEQLQPNWAP-IBGZPJMESA-N	0	3	343.858	3.212	20	30		EGEDHN
CCN1CCC2(CCN(Cc3cc(C#N)ccc3Cl)CC2)C1=O	ZINC001140604211	1378096328	/nfs/dbraw/zinc/09/63/28/1378096328.db2.gz	UVAWBZATNGRUHT-UHFFFAOYSA-N	0	3	331.847	3.046	20	30		EGEDHN
N#CCCCN1CC[C@]2(CCN(Cc3cc(F)ccc3Cl)C2)C1=O	ZINC001273374376	1378100627	/nfs/dbraw/zinc/10/06/27/1378100627.db2.gz	MCXGYKVOCRAVJZ-SFHVURJKSA-N	0	3	349.837	3.207	20	30		EGEDHN
C=C(C)CN1CC[C@]2(CCCN2CCCc2ccccc2OC)C1=O	ZINC001273439906	1378101582	/nfs/dbraw/zinc/10/15/82/1378101582.db2.gz	UWQGUUDSTLUUSM-OAQYLSRUSA-N	0	3	342.483	3.271	20	30		EGEDHN
C#CCN1CCC2(CCN(Cc3cc(C)ccc3Cl)CC2)C1=O	ZINC001274492756	1378128415	/nfs/dbraw/zinc/12/84/15/1378128415.db2.gz	SKDFRAIOXROZGO-UHFFFAOYSA-N	0	3	330.859	3.096	20	30		EGEDHN
N#Cc1ccc(Br)c(CN2CCC3SC(=O)C=C3C2)c1	ZINC001141655846	1378359776	/nfs/dbraw/zinc/35/97/76/1378359776.db2.gz	LKUMJOYASOYSHZ-AWEZNQCLSA-N	0	3	349.253	3.095	20	30		EGEDHN
CN(C)C(=O)CCN(C)Cc1ccc(C#Cc2ccccc2)s1	ZINC001141978047	1378400638	/nfs/dbraw/zinc/40/06/38/1378400638.db2.gz	YHRHGTDSPUOBMN-UHFFFAOYSA-N	0	3	326.465	3.058	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)C2(COCC)CC2)CC1	ZINC001281833842	1378454982	/nfs/dbraw/zinc/45/49/82/1378454982.db2.gz	SGYXPLQWQCTVKX-UHFFFAOYSA-N	0	3	342.911	3.116	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@H]1CCN(Cc1cc3cccnc3[nH]1)C2	ZINC001143214350	1378561862	/nfs/dbraw/zinc/56/18/62/1378561862.db2.gz	OCJMAPFNICPJOX-AZUAARDMSA-N	0	3	341.455	3.137	20	30		EGEDHN
CN1CCC(C(=O)NC2=C(c3ccccc3)C(=O)c3ccccc32)CC1	ZINC001143316316	1378578585	/nfs/dbraw/zinc/57/85/85/1378578585.db2.gz	FGWSEVKIOGHRKA-UHFFFAOYSA-N	0	3	346.430	3.209	20	30		EGEDHN
COc1c(F)cc(CN2CCC3SC(=O)C=C3C2)cc1Cl	ZINC001143841684	1378652529	/nfs/dbraw/zinc/65/25/29/1378652529.db2.gz	OCBGNUPHRSFKCB-CYBMUJFWSA-N	0	3	327.808	3.262	20	30		EGEDHN
CCN(Cc1ccc(C#N)cn1)C[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC001144166462	1378690637	/nfs/dbraw/zinc/69/06/37/1378690637.db2.gz	HEVUBMDPWMGQCD-INIZCTEOSA-N	0	3	344.459	3.032	20	30		EGEDHN
C#Cc1ccc(CN2CCC[C@@]3(C[C@H](Oc4ccccn4)CO3)C2)cc1	ZINC001144571990	1378746692	/nfs/dbraw/zinc/74/66/92/1378746692.db2.gz	MPRALMQHZRMOMP-RBBKRZOGSA-N	0	3	348.446	3.265	20	30		EGEDHN
C#Cc1ccc(CN2CCC3(CN(c4cccc(F)c4)C3=O)CC2)cc1	ZINC001144573109	1378747060	/nfs/dbraw/zinc/74/70/60/1378747060.db2.gz	BCHQDVPXADXNKS-UHFFFAOYSA-N	0	3	348.421	3.436	20	30		EGEDHN
Cc1ccccc1CC(=O)N[C@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001146205673	1378795061	/nfs/dbraw/zinc/79/50/61/1378795061.db2.gz	OLBXMXCLOHQNJK-ZWKOTPCHSA-N	0	3	349.478	3.482	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C[C@H](C)NCc2cnc(C)cn2)CCCC1	ZINC001146819529	1378927019	/nfs/dbraw/zinc/92/70/19/1378927019.db2.gz	AUJUECGDMNEVSS-JKSUJKDBSA-N	0	3	344.503	3.294	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2cnc(C)o2)CCCC1	ZINC001146819609	1378927841	/nfs/dbraw/zinc/92/78/41/1378927841.db2.gz	BFYIMGVTSIDLGQ-HUUCEWRRSA-N	0	3	333.476	3.492	20	30		EGEDHN
C[C@H](CN(C)C(=O)c1ccccc1F)NCc1ccc(C#N)s1	ZINC001283567325	1379024654	/nfs/dbraw/zinc/02/46/54/1379024654.db2.gz	SYBWXUCMIFXGKC-GFCCVEGCSA-N	0	3	331.416	3.009	20	30		EGEDHN
C[C@@H](CN(C)C(=O)C1=CCCCCC1)NCc1ccc(C#N)s1	ZINC001283598697	1379044433	/nfs/dbraw/zinc/04/44/33/1379044433.db2.gz	PLODQLGZZSLSNA-AWEZNQCLSA-N	0	3	331.485	3.447	20	30		EGEDHN
CC[C@H](Cc1ccccc1C)C(=O)NCCNCc1ccc(C#N)cc1	ZINC001147857903	1379092413	/nfs/dbraw/zinc/09/24/13/1379092413.db2.gz	QXGLPVQXDOBRRD-HXUWFJFHSA-N	0	3	349.478	3.341	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)N1CC2(C1)CCN(CCOc1ccccc1)C2	ZINC001148095207	1379116564	/nfs/dbraw/zinc/11/65/64/1379116564.db2.gz	DVEAAICZDWIFOL-ZWKOTPCHSA-N	0	3	342.483	3.058	20	30		EGEDHN
CC#CCCCC(=O)N1CC2(C1)CCN(C/C=C/c1ccccc1)C2	ZINC001148104532	1379119265	/nfs/dbraw/zinc/11/92/65/1379119265.db2.gz	OEQFEMLGLJXQEU-FMIVXFBMSA-N	0	3	336.479	3.428	20	30		EGEDHN
CCC(C)(CC)C(=O)N(C)C[C@@H](C)NCc1ccc(OC)c(C#N)c1	ZINC001283714807	1379138488	/nfs/dbraw/zinc/13/84/88/1379138488.db2.gz	PNMWNCSWZGMFOU-OAHLLOKOSA-N	0	3	345.487	3.330	20	30		EGEDHN
Cc1ccc(C(C)(C)C(=O)NCCNCc2cccc(C#N)c2)cc1	ZINC001148329767	1379153995	/nfs/dbraw/zinc/15/39/95/1379153995.db2.gz	SYGOEAVPDFIZJU-UHFFFAOYSA-N	0	3	335.451	3.050	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H](CC(C)C)c3ccccc3)C2)C1	ZINC001148402096	1379165879	/nfs/dbraw/zinc/16/58/79/1379165879.db2.gz	GKXGTOJUUBCBQC-HXUWFJFHSA-N	0	3	338.495	3.374	20	30		EGEDHN
CC(C)C[C@@H](C)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001148496997	1379190681	/nfs/dbraw/zinc/19/06/81/1379190681.db2.gz	UBMYOSMKBJSCLD-QGZVFWFLSA-N	0	3	339.483	3.275	20	30		EGEDHN
CCc1cc(NC(=O)c2ccc(NC(=N)N)cc2)cc(CC)c1C#N	ZINC001148650052	1379234149	/nfs/dbraw/zinc/23/41/49/1379234149.db2.gz	CUGUNXTUYRZYSB-UHFFFAOYSA-N	0	3	335.411	3.241	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)Cc2cccc3ccccc32)cc1	ZINC001148710480	1379248267	/nfs/dbraw/zinc/24/82/67/1379248267.db2.gz	LBLNKWMUQXZYRK-UHFFFAOYSA-N	0	3	343.430	3.160	20	30		EGEDHN
CCCCCCCCC(=O)NCCN[C@@H](C)C(=O)NC(CC)CC	ZINC001148727990	1379254826	/nfs/dbraw/zinc/25/48/26/1379254826.db2.gz	RAUQSRSVSFSNNU-INIZCTEOSA-N	0	3	341.540	3.136	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)CCC(C)(C)c3ccccc3)C2)C1	ZINC001148893620	1379292565	/nfs/dbraw/zinc/29/25/65/1379292565.db2.gz	QLKHZJHWVACZDE-UHFFFAOYSA-N	0	3	338.495	3.302	20	30		EGEDHN
Cc1csc(Cl)c1C(=O)NCCNCc1ccc(C#N)s1	ZINC001149166592	1379337564	/nfs/dbraw/zinc/33/75/64/1379337564.db2.gz	JAQPKAGHYMPSCE-UHFFFAOYSA-N	0	3	339.873	3.163	20	30		EGEDHN
C=CCCCC(=O)NC[C@H]1CN(Cc2ccc(C)cc2C)CCCO1	ZINC001150210356	1379516323	/nfs/dbraw/zinc/51/63/23/1379516323.db2.gz	DAJROSZZAMDWEI-FQEVSTJZSA-N	0	3	344.499	3.367	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)C[C@H](C)c2ccccc2F)C1	ZINC001150445201	1379553740	/nfs/dbraw/zinc/55/37/40/1379553740.db2.gz	SYMJUFYNALGDAD-IRXDYDNUSA-N	0	3	348.462	3.103	20	30		EGEDHN
C#CCCN1CCCO[C@H](CNC(=O)CC(C)(C)C2CCCCC2)C1	ZINC001150586900	1379573198	/nfs/dbraw/zinc/57/31/98/1379573198.db2.gz	BUELHXMHHGZECO-LJQANCHMSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)CC(C)(C)c2ccccc2)C1	ZINC001150773198	1379611942	/nfs/dbraw/zinc/61/19/42/1379611942.db2.gz	YTHIIHAWQVELBG-IBGZPJMESA-N	0	3	344.499	3.138	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@H]2CCC[C@@H]2CCC)CC1	ZINC001151210251	1379677184	/nfs/dbraw/zinc/67/71/84/1379677184.db2.gz	RWCVCDRYQSAJJU-ROUUACIJSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@@H]2CC23CCCC3)CC1	ZINC001151387260	1379709556	/nfs/dbraw/zinc/70/95/56/1379709556.db2.gz	FJEVZYCBNQKDLP-KRWDZBQOSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)C[C@H]2CCCC[C@@H]2C)CC1	ZINC001151412378	1379713927	/nfs/dbraw/zinc/71/39/27/1379713927.db2.gz	AQWARRISYZQXFO-ZWKOTPCHSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@@H]2CC3CCC2CC3)CC1	ZINC001151412522	1379714082	/nfs/dbraw/zinc/71/40/82/1379714082.db2.gz	HIJBVCCBQWQDBJ-CTWPCTMYSA-N	0	3	348.531	3.376	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)C[C@H]1C=CCC1	ZINC001151801591	1379784657	/nfs/dbraw/zinc/78/46/57/1379784657.db2.gz	WFMJWGCTNOZBPE-CVEARBPZSA-N	0	3	343.446	3.380	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)c1occc1C	ZINC001151921878	1379815840	/nfs/dbraw/zinc/81/58/40/1379815840.db2.gz	ONDPWXZTKDPVRQ-OAHLLOKOSA-N	0	3	325.412	3.100	20	30		EGEDHN
C=C[C@@H](C(=O)NCCNCc1ccc(C)c(F)c1)c1ccccc1	ZINC001151998216	1379835119	/nfs/dbraw/zinc/83/51/19/1379835119.db2.gz	RIBJRBDETYXJEG-GOSISDBHSA-N	0	3	326.415	3.310	20	30		EGEDHN
CCc1cccc2c(C(=O)NCCNCc3cccc(C#N)c3)c[nH]c21	ZINC001152420812	1379931446	/nfs/dbraw/zinc/93/14/46/1379931446.db2.gz	KEQQHYNYDBYSID-UHFFFAOYSA-N	0	3	346.434	3.122	20	30		EGEDHN
CCc1cccc2c(C(=O)NCCNCc3ccc(C#N)cc3)c[nH]c21	ZINC001152427121	1379933038	/nfs/dbraw/zinc/93/30/38/1379933038.db2.gz	SBAPUOBEBLTCLB-UHFFFAOYSA-N	0	3	346.434	3.122	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)CCCC2CCCC2)cc1F	ZINC001152684376	1379970130	/nfs/dbraw/zinc/97/01/30/1379970130.db2.gz	MYMOMNBYNPHTIA-UHFFFAOYSA-N	0	3	331.435	3.264	20	30		EGEDHN
CCN(Cc1ccc(OC)c(C#N)c1)[C@H](C)CNC(=O)C=C1CCC1	ZINC001152706418	1379973562	/nfs/dbraw/zinc/97/35/62/1379973562.db2.gz	IAGKJXDIUQHPQI-OAHLLOKOSA-N	0	3	341.455	3.004	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC[C@@H](C)N(CC)CCc1ccns1	ZINC001153570942	1380096100	/nfs/dbraw/zinc/09/61/00/1380096100.db2.gz	QRPUKESEFGHLSY-OAHLLOKOSA-N	0	3	335.517	3.281	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NC[C@@H](C)N(CC)CCc1ccns1	ZINC001153588475	1380099084	/nfs/dbraw/zinc/09/90/84/1380099084.db2.gz	VLGZFIFPTCIENC-GFCCVEGCSA-N	0	3	343.924	3.291	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)[C@H]1CCC1(C)C	ZINC001154757236	1380346686	/nfs/dbraw/zinc/34/66/86/1380346686.db2.gz	MKKBPGJOCOUEEM-RHSMWYFYSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)cc1	ZINC001155066628	1380401650	/nfs/dbraw/zinc/40/16/50/1380401650.db2.gz	LSVJGYBSAWQOFK-UZLBHIALSA-N	0	3	327.472	3.487	20	30		EGEDHN
N#Cc1ccc(-c2ccncc2)nc1N[C@@H]1CNCc2ccsc21	ZINC001155563288	1380469179	/nfs/dbraw/zinc/46/91/79/1380469179.db2.gz	ARGUYOYRWLQUPA-MRXNPFEDSA-N	0	3	333.420	3.333	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NC[C@@H](C)N(CC)Cc1ccsc1	ZINC001155757273	1380489332	/nfs/dbraw/zinc/48/93/32/1380489332.db2.gz	FCGLVQGNAUNDHE-PVAVHDDUSA-N	0	3	336.501	3.056	20	30		EGEDHN
C=CCOCCCC(=O)NCCCN[C@@H](C)c1cc(F)ccc1F	ZINC001156165131	1380534307	/nfs/dbraw/zinc/53/43/07/1380534307.db2.gz	BKPYRFUDUNPZKT-AWEZNQCLSA-N	0	3	340.414	3.105	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C1(c2ccccc2)CCCC1	ZINC001156751338	1380626539	/nfs/dbraw/zinc/62/65/39/1380626539.db2.gz	RKJCMYMHWCQJGM-GOSISDBHSA-N	0	3	326.484	3.348	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C1(c2cc(C)cc(C)c2)CC1	ZINC001156928017	1380731920	/nfs/dbraw/zinc/73/19/20/1380731920.db2.gz	SFJSKMZGSLISCG-GOSISDBHSA-N	0	3	326.484	3.185	20	30		EGEDHN
O=C(C#CC1CC1)NCCCNCc1c(Cl)cccc1Cl	ZINC001157689078	1381003074	/nfs/dbraw/zinc/00/30/74/1381003074.db2.gz	GTBQOPZTIWKGEW-UHFFFAOYSA-N	0	3	325.239	3.003	20	30		EGEDHN
C#CCCCCC(=O)N1CCCC[C@@H]1CN(C)C[C@@H]1CC(C)(C)CO1	ZINC001157857138	1381052725	/nfs/dbraw/zinc/05/27/25/1381052725.db2.gz	RNEAYCBLFKUTHX-MOPGFXCFSA-N	0	3	348.531	3.308	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cccc2scnc21	ZINC001157951359	1381079613	/nfs/dbraw/zinc/07/96/13/1381079613.db2.gz	WNIUZROYQCIOCD-CQSZACIVSA-N	0	3	329.469	3.409	20	30		EGEDHN
CN(C[C@H]1CC(C)(C)CO1)C[C@H]1CCCCN1C(=O)C#CC(C)(C)C	ZINC001157965041	1381083429	/nfs/dbraw/zinc/08/34/29/1381083429.db2.gz	LOAQDNAZECPYDS-QZTJIDSGSA-N	0	3	348.531	3.164	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc(C(C)(C)C)cn1	ZINC001157967824	1381086758	/nfs/dbraw/zinc/08/67/58/1381086758.db2.gz	WUSICBZXZOWYPK-QGZVFWFLSA-N	0	3	329.488	3.492	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)CCC(C)(F)F)CCN1Cc1ccc(C#N)cc1	ZINC001328260649	1388702049	/nfs/dbraw/zinc/70/20/49/1388702049.db2.gz	SVXXKSVHSSJBIU-RHSMWYFYSA-N	0	3	349.425	3.463	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)C1CCC2(CC2)CC1	ZINC001158232635	1381169547	/nfs/dbraw/zinc/16/95/47/1381169547.db2.gz	BNKCSUGUKJEBOM-LJQANCHMSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H](C)OCc1cccc(C)c1	ZINC001158283628	1381184931	/nfs/dbraw/zinc/18/49/31/1381184931.db2.gz	OVRMCBDSYPOZPC-AZUAARDMSA-N	0	3	344.499	3.399	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc(C(F)(F)F)nc1	ZINC001158305225	1381194419	/nfs/dbraw/zinc/19/44/19/1381194419.db2.gz	ZHZCQBFRZCVQEW-CQSZACIVSA-N	0	3	341.377	3.213	20	30		EGEDHN
C#CCCCCCC(=O)N1CCCC[C@@H]1CN(C)CCOCC=C	ZINC001158316142	1381198190	/nfs/dbraw/zinc/19/81/90/1381198190.db2.gz	BDHZYUIFYJZPLR-LJQANCHMSA-N	0	3	334.504	3.086	20	30		EGEDHN
CN1CCN(C(F)(F)c2ccc(C#N)c(Cl)n2)C2(CCCC2)C1	ZINC001158404282	1381231698	/nfs/dbraw/zinc/23/16/98/1381231698.db2.gz	GTGNWHGPRIVHEJ-UHFFFAOYSA-N	0	3	340.805	3.216	20	30		EGEDHN
C=C(Cl)CNCCC[C@H](C)NC(=O)c1c(Cl)n[nH]c1C1CC1	ZINC001755502639	1440862772	/nfs/dbraw/zinc/86/27/72/1440862772.db2.gz	KBVLZZTUPFLOAR-JTQLQIEISA-N	0	3	345.274	3.181	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc(C)n(C(C)(C)C)n1	ZINC001158866212	1381441700	/nfs/dbraw/zinc/44/17/00/1381441700.db2.gz	POCMNCMKIQILMW-MRXNPFEDSA-N	0	3	332.492	3.059	20	30		EGEDHN
C[C@@H](CCNC(=O)[C@@H](C)c1ccsc1)NCc1ccccc1C#N	ZINC001328399704	1388736815	/nfs/dbraw/zinc/73/68/15/1388736815.db2.gz	JEQGSBVYQNOTQS-GJZGRUSLSA-N	0	3	341.480	3.408	20	30		EGEDHN
CCOC(=O)c1c(NC2=CC(=O)CC(C)(C)C2)sc2c1CCNC2	ZINC001159208973	1381731576	/nfs/dbraw/zinc/73/15/76/1381731576.db2.gz	QQXDFIHYOATWFG-UHFFFAOYSA-N	0	3	348.468	3.255	20	30		EGEDHN
C=CCC[C@H](C)[N@H+]1CC=C(CCNC(=O)c2ccccc2[O-])CC1	ZINC001159314830	1381760134	/nfs/dbraw/zinc/76/01/34/1381760134.db2.gz	QSYNUDVTSSQTFO-INIZCTEOSA-N	0	3	328.456	3.499	20	30		EGEDHN
C=CCC[C@H](C)[N@@H+]1CC=C(CCNC(=O)c2ccccc2[O-])CC1	ZINC001159314830	1381760136	/nfs/dbraw/zinc/76/01/36/1381760136.db2.gz	QSYNUDVTSSQTFO-INIZCTEOSA-N	0	3	328.456	3.499	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc(-c3ccncc3)o2)CC1	ZINC001160353111	1382080885	/nfs/dbraw/zinc/08/08/85/1382080885.db2.gz	PVLOMLHGEQJIRM-UHFFFAOYSA-N	0	3	349.434	3.117	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C/C=C\Cc2ccccc2)CC1	ZINC001160400742	1382094418	/nfs/dbraw/zinc/09/44/18/1382094418.db2.gz	XMNDVCMRXRNCTF-FPLPWBNLSA-N	0	3	336.479	3.337	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)Cc2cncc3ccccc32)CC1	ZINC001160400224	1382094683	/nfs/dbraw/zinc/09/46/83/1382094683.db2.gz	MBVGFJYMQNOWOW-UHFFFAOYSA-N	0	3	335.451	3.102	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc(C)c3ccccc3n2)CC1	ZINC001160538434	1382136327	/nfs/dbraw/zinc/13/63/27/1382136327.db2.gz	UEXFJZMVGIHFPW-UHFFFAOYSA-N	0	3	347.462	3.319	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2nc(Cl)sc2C)CC1	ZINC001160641530	1382158341	/nfs/dbraw/zinc/15/83/41/1382158341.db2.gz	ZWGZHRSLGHBBCZ-UHFFFAOYSA-N	0	3	325.865	3.043	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)Cc2cccc(C(F)F)c2)CC1	ZINC001160666175	1382165512	/nfs/dbraw/zinc/16/55/12/1382165512.db2.gz	QLCNGTPZYQMMAP-UHFFFAOYSA-N	0	3	346.421	3.328	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)Cc2cc3ccccc3o2)CC1	ZINC001160828789	1382210916	/nfs/dbraw/zinc/21/09/16/1382210916.db2.gz	VPNPBRIUDMWSOS-UHFFFAOYSA-N	0	3	336.435	3.137	20	30		EGEDHN
CC[C@@H]1CCC[C@]1(C)C(=O)NCCCNCc1ccccc1C#N	ZINC001160978433	1382259514	/nfs/dbraw/zinc/25/95/14/1382259514.db2.gz	IJOASIWFADIJIK-QUCCMNQESA-N	0	3	327.472	3.371	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)Cc2c(C)[nH]c3ccccc32)CC1	ZINC001161071192	1382290759	/nfs/dbraw/zinc/29/07/59/1382290759.db2.gz	VXNQPAOMJCUDMY-UHFFFAOYSA-N	0	3	337.467	3.343	20	30		EGEDHN
N#Cc1cc(Cl)cnc1NC1CCN(Cc2ccc(O)cc2)CC1	ZINC001161137012	1382314530	/nfs/dbraw/zinc/31/45/30/1382314530.db2.gz	OIYDNSTTXBBXEA-UHFFFAOYSA-N	0	3	342.830	3.389	20	30		EGEDHN
C[C@H](c1ccccc1)N(C(=O)[C@H]1CCNC[C@H]1F)C1=CC(=O)CCC1	ZINC001161509433	1382426738	/nfs/dbraw/zinc/42/67/38/1382426738.db2.gz	PEZMCMDNEFEFLD-MDASCCDHSA-N	0	3	344.430	3.161	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccccc2OC(C)C)CC1	ZINC001161755438	1382495910	/nfs/dbraw/zinc/49/59/10/1382495910.db2.gz	XXRUXMCYRLSSJU-UHFFFAOYSA-N	0	3	340.467	3.249	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2coc3ccc(F)cc23)CC1	ZINC001161785961	1382505322	/nfs/dbraw/zinc/50/53/22/1382505322.db2.gz	WYMZXSRSQWHCDC-UHFFFAOYSA-N	0	3	340.398	3.347	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cnn(C(C)(C)C)c2CC)CC1	ZINC001161879102	1382537451	/nfs/dbraw/zinc/53/74/51/1382537451.db2.gz	DZPBESBWSWCKCJ-UHFFFAOYSA-N	0	3	344.503	3.139	20	30		EGEDHN
CCc1ccc(C(=O)NCCCNCc2cc(C#N)ccc2F)s1	ZINC001161986013	1382588773	/nfs/dbraw/zinc/58/87/73/1382588773.db2.gz	KUFRZSHCRWIPPF-UHFFFAOYSA-N	0	3	345.443	3.231	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@H]1[C@H](C=C(C)C)C1(C)C	ZINC001162150167	1382640092	/nfs/dbraw/zinc/64/00/92/1382640092.db2.gz	JMBRZUDDCUAIIO-UONOGXRCSA-N	0	3	343.309	3.229	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)C2CCC(C)(C)CC2)(COC)CC1	ZINC001162623302	1382814081	/nfs/dbraw/zinc/81/40/81/1382814081.db2.gz	PYPQSLFTCGUGEW-UHFFFAOYSA-N	0	3	348.531	3.071	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)CCC1CCCC1	ZINC001162678562	1382830852	/nfs/dbraw/zinc/83/08/52/1382830852.db2.gz	TXNRWOONVYTUOD-UHFFFAOYSA-N	0	3	326.484	3.251	20	30		EGEDHN
C[C@H](N)c1nc2ccccc2n1-c1c(F)c(F)c(C#N)c(F)c1F	ZINC001162778032	1382869853	/nfs/dbraw/zinc/86/98/53/1382869853.db2.gz	XEQHCBCXAUDJRC-ZETCQYMHSA-N	0	3	334.276	3.473	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1c[nH]c2ccccc12	ZINC001162857016	1382897115	/nfs/dbraw/zinc/89/71/15/1382897115.db2.gz	WUDVMHUUSNWIFH-UHFFFAOYSA-N	0	3	345.446	3.076	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1ccc2c(c1)CCC2	ZINC001162996891	1382942117	/nfs/dbraw/zinc/94/21/17/1382942117.db2.gz	FHYICPWHDOACLV-UHFFFAOYSA-N	0	3	346.474	3.083	20	30		EGEDHN
c1ccc([C@H]2CC(=NNCC3CCOCC3)CCN2C2CC2)cc1	ZINC001328709858	1388820670	/nfs/dbraw/zinc/82/06/70/1388820670.db2.gz	ZRLYIDWOVWHFOR-HXUWFJFHSA-N	0	3	327.472	3.358	20	30		EGEDHN
COCCN(C)[C@@H](CNc1ncccc1C#N)c1ccc(Cl)cc1	ZINC001163385671	1383039287	/nfs/dbraw/zinc/03/92/87/1383039287.db2.gz	OOHQDQLIWDOYJY-KRWDZBQOSA-N	0	3	344.846	3.338	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCCNCc1ccc(-c2ncco2)cc1F	ZINC001163953251	1383139179	/nfs/dbraw/zinc/13/91/79/1383139179.db2.gz	MPISUJTXIKWCKX-UHFFFAOYSA-N	0	3	345.418	3.289	20	30		EGEDHN
N#Cc1ccccc1CNCC1(CCNC(=O)CC2CCC2)CC1	ZINC001163959880	1383139959	/nfs/dbraw/zinc/13/99/59/1383139959.db2.gz	RHZNMEFNPLVNEH-UHFFFAOYSA-N	0	3	325.456	3.125	20	30		EGEDHN
C#CCCCCCC(=O)NCCCNCc1ccn(C(CC)CC)n1	ZINC001163969389	1383141447	/nfs/dbraw/zinc/14/14/47/1383141447.db2.gz	IFPANEHKYNUSLD-UHFFFAOYSA-N	0	3	346.519	3.424	20	30		EGEDHN
CC/C(C)=C/C(=O)NCCC1(CNCc2ccc(C#N)cc2F)CC1	ZINC001164446613	1383187435	/nfs/dbraw/zinc/18/74/35/1383187435.db2.gz	AGCSNXOIZQHAPL-XNTDXEJSSA-N	0	3	343.446	3.430	20	30		EGEDHN
CC/C(C)=C\C(=O)NCCC1(CNCc2cc(C#N)ccc2F)CC1	ZINC001164446708	1383187554	/nfs/dbraw/zinc/18/75/54/1383187554.db2.gz	DBIMCYIABBXLBQ-GDNBJRDFSA-N	0	3	343.446	3.430	20	30		EGEDHN
C[C@H](NCC1(CCNC(=O)C#CC2CC2)CC1)c1ccc(F)cc1F	ZINC001164482936	1383191575	/nfs/dbraw/zinc/19/15/75/1383191575.db2.gz	RYIUZFNMQYJFRG-AWEZNQCLSA-N	0	3	346.421	3.315	20	30		EGEDHN
C=C(C)CCC(=O)NCCC1(CNCc2ccncc2Cl)CC1	ZINC001165258851	1383259690	/nfs/dbraw/zinc/25/96/90/1383259690.db2.gz	UGOAAAKJUZWNQL-UHFFFAOYSA-N	0	3	335.879	3.467	20	30		EGEDHN
C[C@@H]1CCC[C@H](C(=O)NCCCNCc2cc(C#N)ccc2F)C1	ZINC001165423265	1383293029	/nfs/dbraw/zinc/29/30/29/1383293029.db2.gz	GKNZLUCPXBNZCQ-ZBFHGGJFSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=CCCCC(=O)NCCCNCC(=O)Nc1c(C)cc(C)cc1C	ZINC001165535249	1383307768	/nfs/dbraw/zinc/30/77/68/1383307768.db2.gz	GREMRUMZLPTQAY-UHFFFAOYSA-N	0	3	345.487	3.003	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)[C@@H](C)C2CCC2)CC1	ZINC001165711534	1383329864	/nfs/dbraw/zinc/32/98/64/1383329864.db2.gz	RHZJKYREVRSAAT-ZDUSSCGKSA-N	0	3	343.309	3.207	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCCNCc2cnc(-c3ccccc3)o2)C1	ZINC001166245944	1383406801	/nfs/dbraw/zinc/40/68/01/1383406801.db2.gz	WKFORJZXKAMNCE-UHFFFAOYSA-N	0	3	339.439	3.294	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCC1(CNCc2oc(C)nc2C)CC1	ZINC001166541657	1383435545	/nfs/dbraw/zinc/43/55/45/1383435545.db2.gz	HVBZJDQKFVKEBR-UHFFFAOYSA-N	0	3	333.476	3.270	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCC1(CNCc2conc2CC)CC1	ZINC001166694683	1383462216	/nfs/dbraw/zinc/46/22/16/1383462216.db2.gz	OBWDAGRQFBCWBF-CABCVRRESA-N	0	3	333.476	3.071	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@@H](C)Oc2ccccc2)CC1	ZINC001167965736	1383780442	/nfs/dbraw/zinc/78/04/42/1383780442.db2.gz	ADFSFZXXAJCBEH-OAHLLOKOSA-N	0	3	336.863	3.083	20	30		EGEDHN
C=CC1(CC(=O)NCCCNCc2ccn(CC)n2)CCCCC1	ZINC001168182353	1383836851	/nfs/dbraw/zinc/83/68/51/1383836851.db2.gz	CQSRNBBCSVVZHK-UHFFFAOYSA-N	0	3	332.492	3.026	20	30		EGEDHN
COCCN(CCC(=O)OC(C)(C)C)[C@@H](C)c1cccc(C#N)c1	ZINC001308142261	1384100873	/nfs/dbraw/zinc/10/08/73/1384100873.db2.gz	KMCOFINLLLOBLG-HNNXBMFYSA-N	0	3	332.444	3.299	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)[C@H]2C[C@H]2C2CCCC2)c(F)c1	ZINC001169678504	1384172431	/nfs/dbraw/zinc/17/24/31/1384172431.db2.gz	CWNQOMODFYZOJT-ROUUACIJSA-N	0	3	343.446	3.120	20	30		EGEDHN
CC1(C)CC(NC(=N)c2ccc3ccccc3n2)CC(C)(C)N1O	ZINC001169980701	1384208855	/nfs/dbraw/zinc/20/88/55/1384208855.db2.gz	HBPOEUNYVQKZBU-UHFFFAOYSA-N	0	3	326.444	3.351	20	30		EGEDHN
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C)[C@@H]1NCc1cc(C#N)ccn1	ZINC001170050745	1384225277	/nfs/dbraw/zinc/22/52/77/1384225277.db2.gz	CWCYGUWYORDFCD-CKEIUWERSA-N	0	3	344.459	3.077	20	30		EGEDHN
CO[C@@H]1[C@@H](C)[C@H](NCc2ccc(C#N)cc2Br)C1(C)C	ZINC001170398978	1384307601	/nfs/dbraw/zinc/30/76/01/1384307601.db2.gz	GOSQBTLEEPSAJG-NZVBXONLSA-N	0	3	337.261	3.470	20	30		EGEDHN
C#CCCCC(=O)N[C@H](C)CCCCNCc1nc(C)c(C)s1	ZINC001170425408	1384315760	/nfs/dbraw/zinc/31/57/60/1384315760.db2.gz	NMXDTNZWPRVGJH-CQSZACIVSA-N	0	3	335.517	3.328	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H](C)CCCCNCc1nc2ccccc2o1	ZINC001170639034	1384355584	/nfs/dbraw/zinc/35/55/84/1384355584.db2.gz	QWKHBFMDHXPPJT-INIZCTEOSA-N	0	3	341.455	3.252	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)C#CC(C)(C)C	ZINC001170708870	1384371406	/nfs/dbraw/zinc/37/14/06/1384371406.db2.gz	FDWOPWZVZSUTPV-KRWDZBQOSA-N	0	3	339.483	3.372	20	30		EGEDHN
N#Cc1cccc([C@H](O)CN2CC[C@]3(C2)CCc2ccccc2O3)c1	ZINC001170733026	1384375116	/nfs/dbraw/zinc/37/51/16/1384375116.db2.gz	PTCDSUPGTBRXTM-CTNGQTDRSA-N	0	3	334.419	3.061	20	30		EGEDHN
N=C(N[C@@H]1CCc2ccc(Br)cc2C1)c1ccc(F)cn1	ZINC001170853401	1384399298	/nfs/dbraw/zinc/39/92/98/1384399298.db2.gz	HIJBKTVVEWWZIH-CQSZACIVSA-N	0	3	348.219	3.246	20	30		EGEDHN
CCc1oc(C(=O)NCCCNCc2cc(C#N)ccc2F)cc1C	ZINC001170994954	1384426887	/nfs/dbraw/zinc/42/68/87/1384426887.db2.gz	SIQQXHRZPCPLBX-UHFFFAOYSA-N	0	3	343.402	3.071	20	30		EGEDHN
N#Cc1cccc(N2CCN([C@@H]3CCc4cccc(F)c4C3)CC2)c1	ZINC001171004507	1384428110	/nfs/dbraw/zinc/42/81/10/1384428110.db2.gz	GHZJKLSGMQEORO-LJQANCHMSA-N	0	3	335.426	3.377	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H](C)CCCCN[C@@H](C)c1nnc(CC)[nH]1	ZINC001171043890	1384435747	/nfs/dbraw/zinc/43/57/47/1384435747.db2.gz	QNYIXLCWVITPQO-GJZGRUSLSA-N	0	3	335.496	3.049	20	30		EGEDHN
Cc1cccn2cc(C(=O)NCCCNCc3ccccc3C#N)cc12	ZINC001171053300	1384437681	/nfs/dbraw/zinc/43/76/81/1384437681.db2.gz	APRUVCQFKNWGJM-UHFFFAOYSA-N	0	3	346.434	3.029	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1ccc(C2CC2)s1	ZINC001171094821	1384445013	/nfs/dbraw/zinc/44/50/13/1384445013.db2.gz	DLPZHKZVXJSFBV-UHFFFAOYSA-N	0	3	339.464	3.407	20	30		EGEDHN
C[C@@H](Cc1cccc(C#N)c1)N1CCC[C@@H](C(F)(F)F)[C@H]1CO	ZINC001171208974	1384469752	/nfs/dbraw/zinc/46/97/52/1384469752.db2.gz	GUQDDRNVDXOTGI-APHBMKBZSA-N	0	3	326.362	3.124	20	30		EGEDHN
C[C@@H](Cc1cccc(C#N)c1)N1CCN(c2ccc(C#N)cc2)CC1	ZINC001171221383	1384471958	/nfs/dbraw/zinc/47/19/58/1384471958.db2.gz	MBOBANFUFGPVMU-KRWDZBQOSA-N	0	3	330.435	3.183	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)[C@@H](C)CCCC)C1	ZINC001316629742	1384493781	/nfs/dbraw/zinc/49/37/81/1384493781.db2.gz	CZVJHIRLYAMZLR-UBHSHLNASA-N	0	3	331.298	3.206	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)[C@@H]1CCC1(F)F	ZINC001171446260	1384526580	/nfs/dbraw/zinc/52/65/80/1384526580.db2.gz	YNHRTOKMKNNIFM-PBHICJAKSA-N	0	3	349.425	3.368	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1cccc(CC)n1	ZINC001316878730	1384663298	/nfs/dbraw/zinc/66/32/98/1384663298.db2.gz	WFONRLYBAQXUTF-RHSMWYFYSA-N	0	3	335.879	3.369	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)N1CCN(c2ccc(Cl)cn2)CC1	ZINC001172319003	1384769246	/nfs/dbraw/zinc/76/92/46/1384769246.db2.gz	KKNAIJFQRGBVQR-OAHLLOKOSA-N	0	3	340.858	3.360	20	30		EGEDHN
Cc1cc(N2CCN([C@H](C)CCCC#N)CC2)n(-c2ccccc2)n1	ZINC001172498050	1384805345	/nfs/dbraw/zinc/80/53/45/1384805345.db2.gz	INBGJDSKHMASGY-GOSISDBHSA-N	0	3	337.471	3.385	20	30		EGEDHN
COC(=O)C1(C#N)CCN([C@@H]2CCC[C@@H](c3ccccc3)C2)CC1	ZINC001172549374	1384810597	/nfs/dbraw/zinc/81/05/97/1384810597.db2.gz	OZWRLUCRNIWSSM-QZTJIDSGSA-N	0	3	326.440	3.492	20	30		EGEDHN
N#Cc1ccc2c(c1)CN([C@@H]1CCN(Cc3ccccc3)C(=O)C1)CC2	ZINC001172668722	1384830291	/nfs/dbraw/zinc/83/02/91/1384830291.db2.gz	GQSYCLQMNXKGCO-OAQYLSRUSA-N	0	3	345.446	3.108	20	30		EGEDHN
C[C@@H]1CC[C@H](NCc2csc(C#N)c2)CN1C(=O)OC(C)(C)C	ZINC001173062377	1384904938	/nfs/dbraw/zinc/90/49/38/1384904938.db2.gz	UKAIPEAWFUITLV-OCCSQVGLSA-N	0	3	335.473	3.497	20	30		EGEDHN
CC1(CCC(=O)N2CCC[C@@H](CNCc3ccccc3C#N)C2)CC1	ZINC001317161271	1384924665	/nfs/dbraw/zinc/92/46/65/1384924665.db2.gz	KOKGXCPHYSFCBO-KRWDZBQOSA-N	0	3	339.483	3.467	20	30		EGEDHN
C#Cc1nc(Br)cnc1Nc1ccccc1CN(C)C	ZINC001173929406	1385032212	/nfs/dbraw/zinc/03/22/12/1385032212.db2.gz	PRYQFULWJJFSKU-UHFFFAOYSA-N	0	3	331.217	3.026	20	30		EGEDHN
CCC[C@@H](OC)C(=O)N[C@H](C)CCCCNCc1ccccc1C#N	ZINC001174649891	1385130346	/nfs/dbraw/zinc/13/03/46/1385130346.db2.gz	KWNCOVDWWKILDR-VQIMIIECSA-N	0	3	345.487	3.138	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H](C)CCCCN[C@@H](C)c1nnc(C)[nH]1	ZINC001174694411	1385135676	/nfs/dbraw/zinc/13/56/76/1385135676.db2.gz	ODJXRADIKHDHQY-HOTGVXAUSA-N	0	3	347.507	3.022	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H](C)CCCCNCc1cn(C(C)C)nn1	ZINC001174850108	1385160166	/nfs/dbraw/zinc/16/01/66/1385160166.db2.gz	UCTOOMKELOTMOQ-DLBZAZTESA-N	0	3	349.523	3.226	20	30		EGEDHN
CCCC1(C(=O)NCCN(CC)Cc2cccc(C#N)c2)CCC1	ZINC001317485476	1385182859	/nfs/dbraw/zinc/18/28/59/1385182859.db2.gz	UJFAOJQYWYAPRJ-UHFFFAOYSA-N	0	3	327.472	3.467	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H](C)CCCCNCc1ccn(CC)n1	ZINC001175469499	1385301629	/nfs/dbraw/zinc/30/16/29/1385301629.db2.gz	SGTORXOCHOULTF-INIZCTEOSA-N	0	3	334.508	3.270	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)CCCc1cccs1	ZINC001175508186	1385316730	/nfs/dbraw/zinc/31/67/30/1385316730.db2.gz	YTTWKIQLPQGHLL-UHFFFAOYSA-N	0	3	345.306	3.075	20	30		EGEDHN
CCN1CCN(c2ccc(-n3cc(C#N)c4ccc(N)cc43)cc2)CC1	ZINC001175781431	1385403344	/nfs/dbraw/zinc/40/33/44/1385403344.db2.gz	HTRZTZLVLGDBMJ-UHFFFAOYSA-N	0	3	345.450	3.226	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)C(=O)NCCCNCc1conc1C	ZINC001176744632	1385679911	/nfs/dbraw/zinc/67/99/11/1385679911.db2.gz	JSLICNXMBWGDCX-SFHVURJKSA-N	0	3	341.455	3.014	20	30		EGEDHN
O=C(CC#Cc1ccccc1)NCCCNCc1ccc(F)cc1F	ZINC001176762995	1385687754	/nfs/dbraw/zinc/68/77/54/1385687754.db2.gz	NYMNMCCQBDBHCH-UHFFFAOYSA-N	0	3	342.389	3.003	20	30		EGEDHN
C=CCCOCC(=O)NCCCNCc1cc(Cl)ccc1Cl	ZINC001177260684	1385887680	/nfs/dbraw/zinc/88/76/80/1385887680.db2.gz	SMSWWHZFARNBNU-UHFFFAOYSA-N	0	3	345.270	3.182	20	30		EGEDHN
CSCCC(=O)NCCCCCCNCc1ccccc1C#N	ZINC001177863230	1386066649	/nfs/dbraw/zinc/06/66/49/1386066649.db2.gz	HMWRALKPFSPAKR-UHFFFAOYSA-N	0	3	333.501	3.078	20	30		EGEDHN
C[C@H](C(=O)NC1(CNCc2ccc(C#N)cc2F)CCCC1)C1CC1	ZINC001698628092	1406270241	/nfs/dbraw/zinc/27/02/41/1406270241.db2.gz	PXFZYWYTRDYPEZ-AWEZNQCLSA-N	0	3	343.446	3.262	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CC[C@H](NCC#Cc2cccc(Cl)c2)[C@@H]1C	ZINC001178140197	1386139941	/nfs/dbraw/zinc/13/99/41/1386139941.db2.gz	YJQQFZDMOZKOOD-VKJFTORMSA-N	0	3	332.875	3.317	20	30		EGEDHN
CCC(CC)CC(=O)N(C)[C@H](C)CNCc1ccc(F)c(C#N)c1	ZINC001319550244	1386174544	/nfs/dbraw/zinc/17/45/44/1386174544.db2.gz	BQDKKOGJBAVFKD-CQSZACIVSA-N	0	3	333.451	3.460	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](NC(=O)C2CC2)C2CCCCC2)s1	ZINC001319643651	1386228984	/nfs/dbraw/zinc/22/89/84/1386228984.db2.gz	RXEDKLLISWLAEO-KRWDZBQOSA-N	0	3	331.485	3.184	20	30		EGEDHN
CC1(C#N)CN(C(=O)C2CN(C(c3ccccc3)c3ccccc3)C2)C1	ZINC001178588312	1386256792	/nfs/dbraw/zinc/25/67/92/1386256792.db2.gz	FADOOAIAEFXYPI-UHFFFAOYSA-N	0	3	345.446	3.080	20	30		EGEDHN
C=CCn1cccc1C(=O)NCCCCCCNCc1nccs1	ZINC001178702352	1386282973	/nfs/dbraw/zinc/28/29/73/1386282973.db2.gz	MMIAMYPEINARMW-UHFFFAOYSA-N	0	3	346.500	3.211	20	30		EGEDHN
C[C@H](NCc1cccc(OCC#N)c1)c1ccc(-n2cncn2)cc1	ZINC001319783875	1386295574	/nfs/dbraw/zinc/29/55/74/1386295574.db2.gz	IMSVJUPKIZYWDH-HNNXBMFYSA-N	0	3	333.395	3.020	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)C[C@@H]1C[C@H]1C1CC1	ZINC001179179223	1386418715	/nfs/dbraw/zinc/41/87/15/1386418715.db2.gz	MJGRGDCRIOLQOU-FIRPJDEBSA-N	0	3	336.479	3.053	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)c1occ2c1CCC2	ZINC001179234784	1386428109	/nfs/dbraw/zinc/42/81/09/1386428109.db2.gz	ZQFDAFOFIQFMMM-JXFKEZNVSA-N	0	3	348.446	3.013	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCCCCCNCc1nccn1CC	ZINC001179307045	1386446076	/nfs/dbraw/zinc/44/60/76/1386446076.db2.gz	PMFTYZQFXUDZRR-IRXDYDNUSA-N	0	3	334.508	3.127	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCCCCCCNCc1ccn(CC)n1	ZINC001179335400	1386454766	/nfs/dbraw/zinc/45/47/66/1386454766.db2.gz	JQJHFSRKCZEGQD-KRWDZBQOSA-N	0	3	334.508	3.272	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)[C@H]1CCCC1(C)C	ZINC001179337821	1386455831	/nfs/dbraw/zinc/45/58/31/1386455831.db2.gz	YRTFVMLVTBQYAX-SXLOBPIMSA-N	0	3	338.495	3.443	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCCCCCCNCc1cn(C(C)C)nn1	ZINC001179339862	1386456221	/nfs/dbraw/zinc/45/62/21/1386456221.db2.gz	NHVRUHGUGQARQW-KRWDZBQOSA-N	0	3	349.523	3.228	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCCCCCCN[C@H](C)c1nnc(C)[nH]1	ZINC001179340335	1386457377	/nfs/dbraw/zinc/45/73/77/1386457377.db2.gz	ZIYYDTSPNHISDV-GDBMZVCRSA-N	0	3	335.496	3.043	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)CCc1ccccc1F)C1CC1	ZINC001698653630	1406303393	/nfs/dbraw/zinc/30/33/93/1406303393.db2.gz	QLFSVPVRHDYEOS-GOSISDBHSA-N	0	3	338.854	3.385	20	30		EGEDHN
CCCCCCCCCC(=O)N1CC[C@H](NCc2n[nH]c(C)n2)[C@@H]1C	ZINC001179994456	1386662384	/nfs/dbraw/zinc/66/23/84/1386662384.db2.gz	OVYAHPUWZSHPRK-RDJZCZTQSA-N	0	3	349.523	3.333	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2csc(CC)n2)C1	ZINC001180852155	1386884154	/nfs/dbraw/zinc/88/41/54/1386884154.db2.gz	ILHUURZSLFZOHY-RDTXWAMCSA-N	0	3	335.517	3.246	20	30		EGEDHN
COc1cc(CN[C@@H]2CCN(C(=O)C#CC(C)(C)C)C2)ccc1Cl	ZINC001182458815	1387169594	/nfs/dbraw/zinc/16/95/94/1387169594.db2.gz	OIYVOLKVNYHCFS-OAHLLOKOSA-N	0	3	348.874	3.089	20	30		EGEDHN
CCc1cc(NC(=O)[C@@H]2CCCN2CC2CC2)cc(CC)c1C#N	ZINC001182558462	1387186991	/nfs/dbraw/zinc/18/69/91/1387186991.db2.gz	WSPZZQLEHZQYIQ-IBGZPJMESA-N	0	3	325.456	3.496	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1nc(Cl)cs1	ZINC001329328161	1389063861	/nfs/dbraw/zinc/06/38/61/1389063861.db2.gz	PVVPYZHKPXFTDN-UHFFFAOYSA-N	0	3	336.288	3.237	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)Nc1ccc(C(=O)NC)cc1C	ZINC001336690983	1389136763	/nfs/dbraw/zinc/13/67/63/1389136763.db2.gz	CCIDLLPHKZGPEJ-MRXNPFEDSA-N	0	3	333.476	3.371	20	30		EGEDHN
C=CCC1(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)s2)CCC1	ZINC001698732568	1406381648	/nfs/dbraw/zinc/38/16/48/1406381648.db2.gz	YRDAGCWYIPHEPT-OAHLLOKOSA-N	0	3	343.496	3.447	20	30		EGEDHN
C=C(Br)CNC[C@@H](C1CC1)N(C)C(=O)c1ccsc1	ZINC001331251249	1389667767	/nfs/dbraw/zinc/66/77/67/1389667767.db2.gz	APEXHVBTMCIYQL-ZDUSSCGKSA-N	0	3	343.290	3.097	20	30		EGEDHN
CCC(CC)C(=O)N(C)[C@@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001331260287	1389674726	/nfs/dbraw/zinc/67/47/26/1389674726.db2.gz	WEUUZLGVQCSGNW-KRWDZBQOSA-N	0	3	333.501	3.383	20	30		EGEDHN
C=CCn1c([C@H](C)OC(C)(C)C)nnc1N1C[C@@H](C)N(CC)C[C@H]1C	ZINC001338994551	1389853814	/nfs/dbraw/zinc/85/38/14/1389853814.db2.gz	FRILHZQEBHSBRX-OAGGEKHMSA-N	0	3	349.523	3.259	20	30		EGEDHN
C[C@@H]1[C@@H](NCc2ccc(C#N)s2)CCN1C(=O)CCC(F)(F)F	ZINC001331869559	1389894288	/nfs/dbraw/zinc/89/42/88/1389894288.db2.gz	LLBWLKPSXVLWGG-MFKMUULPSA-N	0	3	345.390	3.041	20	30		EGEDHN
C=C(Br)CNC[C@@H](NC(=O)C1CCCC1)C(C)(C)C	ZINC001332754544	1390181029	/nfs/dbraw/zinc/18/10/29/1390181029.db2.gz	UWCGMMMUUZHHSK-CYBMUJFWSA-N	0	3	331.298	3.206	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N[C@H](C)c1ccc(-n2nc(C)cc2C)cc1	ZINC001340880397	1390392682	/nfs/dbraw/zinc/39/26/82/1390392682.db2.gz	NGBFMKPVSSWYOJ-APWZRJJASA-N	0	3	340.471	3.350	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N(Cc1nc2ccccc2s1)C1CC1	ZINC001341006455	1390423890	/nfs/dbraw/zinc/42/38/90/1390423890.db2.gz	XFOITUFVZMSLPW-CQSZACIVSA-N	0	3	329.469	3.471	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N[C@@H](C)c1ccc(OCC(F)(F)F)cc1	ZINC001341497910	1390494499	/nfs/dbraw/zinc/49/44/99/1390494499.db2.gz	ZODIZVFNYCMSMW-WFASDCNBSA-N	0	3	344.377	3.489	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)NCc1cc(Cl)ccc1OC(F)F	ZINC001341501848	1390495000	/nfs/dbraw/zinc/49/50/00/1390495000.db2.gz	IAQRGZKYILEAFX-LBPRGKRZSA-N	0	3	332.778	3.241	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N[C@@H](CC(C)C)c1nc2ccccc2[nH]1	ZINC001341540723	1390499576	/nfs/dbraw/zinc/49/95/76/1390499576.db2.gz	RVKYSMPSZJBHCT-PBHICJAKSA-N	0	3	328.460	3.450	20	30		EGEDHN
N#Cc1c2[nH]c3ccccc3n2c(=O)cc1CN1CC2CCC1CC2	ZINC001341666020	1390515351	/nfs/dbraw/zinc/51/53/51/1390515351.db2.gz	IVPTXVTYXPQYKQ-AVVWSFFYSA-N	0	3	332.407	3.098	20	30		EGEDHN
N#CC(C(=O)CCc1nc(-c2cccs2)no1)c1cccc(F)n1	ZINC001342556835	1390626014	/nfs/dbraw/zinc/62/60/14/1390626014.db2.gz	BWVZHBJUWUKPKP-SNVBAGLBSA-N	0	3	342.355	3.141	20	30		EGEDHN
CC[C@@H](C)c1ccc(NC(=O)C(C#N)C(=O)Cc2cc(C)on2)cc1	ZINC001343599465	1390725466	/nfs/dbraw/zinc/72/54/66/1390725466.db2.gz	LNZKGYMNEQRUPR-SJKOYZFVSA-N	0	3	339.395	3.387	20	30		EGEDHN
N#Cc1ccc(COC(=O)c2cccc(CN3CCCCC3)c2)nc1	ZINC001345802212	1390885617	/nfs/dbraw/zinc/88/56/17/1390885617.db2.gz	VCBRTVNXOVHCFQ-UHFFFAOYSA-N	0	3	335.407	3.296	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CCCN(C)C2)nnc1N1CCCC[C@@H](C)C1	ZINC001346670706	1390968399	/nfs/dbraw/zinc/96/83/99/1390968399.db2.gz	NGRFDCJSDQWVNL-SJORKVTESA-N	0	3	331.508	3.290	20	30		EGEDHN
Cc1cccc(CN(CCN(C)C)C(=O)c2csc(C#N)c2)c1	ZINC001347770858	1391122910	/nfs/dbraw/zinc/12/29/10/1391122910.db2.gz	LMYLYLPIDNUUMU-UHFFFAOYSA-N	0	3	327.453	3.132	20	30		EGEDHN
Cn1c(Cl)cnc1C(C#N)C(=O)C1CC(OCc2ccccc2)C1	ZINC001349702629	1391356014	/nfs/dbraw/zinc/35/60/14/1391356014.db2.gz	RGPHOBYWRKPZJB-YMAMQOFZSA-N	0	3	343.814	3.245	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)NC1(c2ccc(Br)cc2)CC1	ZINC001353202854	1391958142	/nfs/dbraw/zinc/95/81/42/1391958142.db2.gz	ZCUPMSGAZDNXHL-CQSZACIVSA-N	0	3	337.261	3.238	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N1CCC(Oc2cc(C)ccc2C)CC1	ZINC001353223428	1391964724	/nfs/dbraw/zinc/96/47/24/1391964724.db2.gz	OPPAGMBSSSBQFH-GOSISDBHSA-N	0	3	330.472	3.357	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1cc(F)cc(N2C[C@@H](C)O[C@@H](C)C2)c1	ZINC001354191650	1392126135	/nfs/dbraw/zinc/12/61/35/1392126135.db2.gz	YEUOVEGVOXURII-IYOUNJFTSA-N	0	3	349.450	3.061	20	30		EGEDHN
C[C@@H](C(=O)NC[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1)C1CCC1	ZINC001479303488	1392208364	/nfs/dbraw/zinc/20/83/64/1392208364.db2.gz	YOPXBLPDDXGAAV-SIIHOXLZSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1cnc2ccccn21	ZINC001479828013	1392415445	/nfs/dbraw/zinc/41/54/45/1392415445.db2.gz	VGRYUBSPGOHXOW-LSDHHAIUSA-N	0	3	346.862	3.060	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1cccc(OC)c1	ZINC001479834224	1392420060	/nfs/dbraw/zinc/42/00/60/1392420060.db2.gz	OAKGEWXONJCMFK-YOEHRIQHSA-N	0	3	336.863	3.421	20	30		EGEDHN
C[C@H](CNC(=O)CCCC(F)(F)F)NCc1ccc(F)c(C#N)c1	ZINC001480540436	1392784873	/nfs/dbraw/zinc/78/48/73/1392784873.db2.gz	RRSJMSVZGYTMKP-LLVKDONJSA-N	0	3	345.340	3.024	20	30		EGEDHN
C[C@@H](N[C@@H](C)CCNC(=O)c1cc(C#N)c[nH]1)c1c(F)cccc1F	ZINC001480759496	1392917641	/nfs/dbraw/zinc/91/76/41/1392917641.db2.gz	VCSWXJWSJVADSY-NWDGAFQWSA-N	0	3	346.381	3.024	20	30		EGEDHN
C=CC[C@H](C(=O)N[C@H]1CCN(CCOC2CCC2)C1)c1ccccc1	ZINC001490577110	1394271222	/nfs/dbraw/zinc/27/12/22/1394271222.db2.gz	RXFSRWIFDYHAKW-ICSRJNTNSA-N	0	3	342.483	3.106	20	30		EGEDHN
CC[C@@H](CNC(=O)CCc1ccsc1)NCc1ccc(C#N)s1	ZINC001481819660	1394545483	/nfs/dbraw/zinc/54/54/83/1394545483.db2.gz	AJCFDPAWGSNIST-AWEZNQCLSA-N	0	3	347.509	3.298	20	30		EGEDHN
CC[C@H](CNC(=O)c1cccn1C(C)C)NCc1ccc(C#N)s1	ZINC001481877979	1394573207	/nfs/dbraw/zinc/57/32/07/1394573207.db2.gz	GGJUJLCYJIKTBI-CQSZACIVSA-N	0	3	344.484	3.300	20	30		EGEDHN
Cc1ccc(CNCc2ccc(CNC(=O)[C@@H](C)C#N)cc2)cc1F	ZINC001482029611	1394688964	/nfs/dbraw/zinc/68/89/64/1394688964.db2.gz	HPXOECWLFJJOEY-HNNXBMFYSA-N	0	3	339.414	3.200	20	30		EGEDHN
Cc1cc(C)c(C(=O)NC[C@@H](C)CNCc2ccccc2C#N)s1	ZINC001482105113	1394749129	/nfs/dbraw/zinc/74/91/29/1394749129.db2.gz	DTRXXOFVOGXHQL-ZDUSSCGKSA-N	0	3	341.480	3.392	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1ccc(C2CC2)nc1C)C(C)C	ZINC001482552076	1395085226	/nfs/dbraw/zinc/08/52/26/1395085226.db2.gz	BXOTYQIBVXHXJT-KRWDZBQOSA-N	0	3	335.879	3.364	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)Cc2ccsc2C)CCCC1	ZINC001495949027	1396575587	/nfs/dbraw/zinc/57/55/87/1396575587.db2.gz	MZWKARIKGBURAU-UHFFFAOYSA-N	0	3	326.893	3.370	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2c[nH]nc2C(C)(C)C)CCCC1	ZINC001495953225	1396576874	/nfs/dbraw/zinc/57/68/74/1396576874.db2.gz	UGGPXOJRZOYMCL-UHFFFAOYSA-N	0	3	338.883	3.092	20	30		EGEDHN
Cc1cscc1C(=O)N(C)[C@H](C)CNCc1ccc(C#N)s1	ZINC001496031031	1396588529	/nfs/dbraw/zinc/58/85/29/1396588529.db2.gz	JQZOWNIYFGTPRT-GFCCVEGCSA-N	0	3	333.482	3.240	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)NC(=O)c1cccc2cc[nH]c21	ZINC001498119829	1396922718	/nfs/dbraw/zinc/92/27/18/1396922718.db2.gz	WXMVWHAZAWAOJR-LBPRGKRZSA-N	0	3	338.436	3.009	20	30		EGEDHN
Cc1cc(C)c(C(=O)N[C@@H](C)CN(C)Cc2ccc(C#N)cc2)s1	ZINC001498295462	1396962552	/nfs/dbraw/zinc/96/25/52/1396962552.db2.gz	SMZZPOLMIQXNAX-AWEZNQCLSA-N	0	3	341.480	3.487	20	30		EGEDHN
Cc1ccc(C)c(CC(=O)N[C@H](C)CN(C)Cc2ccc(C#N)cc2)c1	ZINC001498377259	1396980811	/nfs/dbraw/zinc/98/08/11/1396980811.db2.gz	XGLNFSKSAFNFSB-GOSISDBHSA-N	0	3	349.478	3.354	20	30		EGEDHN
C[C@@H](CN(C)Cc1cccc(C#N)c1)NC(=O)c1c(F)cccc1F	ZINC001498436886	1396994691	/nfs/dbraw/zinc/99/46/91/1396994691.db2.gz	NYIUKVZEFFAPCD-ZDUSSCGKSA-N	0	3	343.377	3.087	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)CCc1cccnc1	ZINC001689904830	1404197776	/nfs/dbraw/zinc/19/77/76/1404197776.db2.gz	DCROOWHEMVLGSC-RDJZCZTQSA-N	0	3	335.879	3.126	20	30		EGEDHN
CC1(CCC(=O)NC[C@H]2CCCN(Cc3ccc(C#N)cc3)C2)CC1	ZINC001690391947	1404532731	/nfs/dbraw/zinc/53/27/31/1404532731.db2.gz	MJPKNXZQZDWLTK-LJQANCHMSA-N	0	3	339.483	3.467	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)C2(c3ccccc3)CCC2)C1	ZINC001691104839	1405044109	/nfs/dbraw/zinc/04/41/09/1405044109.db2.gz	HMISLZDKNVKKLH-WOVMCDHWSA-N	0	3	332.875	3.345	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)Cc2ccc(F)cc2Cl)C1	ZINC001691111220	1405051996	/nfs/dbraw/zinc/05/19/96/1405051996.db2.gz	ATXHOXDGDNPCHR-VDISTLRHSA-N	0	3	345.245	3.259	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)C2(c3cccc(C)c3)CC2)C1	ZINC001691128456	1405066454	/nfs/dbraw/zinc/06/64/54/1405066454.db2.gz	JQKBGEZGDGUWMT-WOVMCDHWSA-N	0	3	332.875	3.264	20	30		EGEDHN
CCCN(CCNC(=O)c1ccccc1F)Cc1cccc(C#N)c1	ZINC001691173808	1405109390	/nfs/dbraw/zinc/10/93/90/1405109390.db2.gz	LRUYOISKLPSQOF-UHFFFAOYSA-N	0	3	339.414	3.339	20	30		EGEDHN
CCCN(CCNC(=O)C1(C)CCCC1)Cc1cccc(C#N)c1	ZINC001691187725	1405126063	/nfs/dbraw/zinc/12/60/63/1405126063.db2.gz	SLJRYRZNQBAWNS-UHFFFAOYSA-N	0	3	327.472	3.467	20	30		EGEDHN
CC[C@@H](CNC(=O)C12CCC(CC1)C2)NCc1ccc(C#N)s1	ZINC001732205156	1428454938	/nfs/dbraw/zinc/45/49/38/1428454938.db2.gz	HTZMZMCXAHSPOH-FVRSWCFKSA-N	0	3	331.485	3.184	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)CC2(OC)CCC2)CCCC[C@@H]1C	ZINC001732255836	1428496706	/nfs/dbraw/zinc/49/67/06/1428496706.db2.gz	BKHHEENQBFMLSI-KBXCAEBGSA-N	0	3	342.911	3.353	20	30		EGEDHN
CCc1ccc(C(=O)NC[C@@H](C)CNCc2ccccc2C#N)s1	ZINC001732348847	1428544158	/nfs/dbraw/zinc/54/41/58/1428544158.db2.gz	MICYOGMGCYRFLR-AWEZNQCLSA-N	0	3	341.480	3.338	20	30		EGEDHN
C[C@@H](CNCc1ccccc1C#N)CNC(=O)C(C)(C)C1CCC1	ZINC001732356666	1428546415	/nfs/dbraw/zinc/54/64/15/1428546415.db2.gz	UZNSZNIIBPAZTJ-HNNXBMFYSA-N	0	3	327.472	3.226	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)c1ccc2cc[nH]c2c1	ZINC001732365617	1428549847	/nfs/dbraw/zinc/54/98/47/1428549847.db2.gz	RPBZWKOACYXAJU-OAHLLOKOSA-N	0	3	346.434	3.195	20	30		EGEDHN
C[C@@H](CNCc1ccccc1C#N)CNC(=O)c1ccc(Cl)cc1	ZINC001732369160	1428551555	/nfs/dbraw/zinc/55/15/55/1428551555.db2.gz	GZOXBAIEEZRQRZ-AWEZNQCLSA-N	0	3	341.842	3.367	20	30		EGEDHN
C[C@@H](CC(=O)NCC1(NCc2ccc(C#N)cc2)CC1)c1ccccc1	ZINC001699672304	1413063294	/nfs/dbraw/zinc/06/32/94/1413063294.db2.gz	WZRPEPQGCOJGGD-KRWDZBQOSA-N	0	3	347.462	3.490	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@]3(CCN(C(=O)CCCF)C3)C2)cc1	ZINC001699695652	1413105259	/nfs/dbraw/zinc/10/52/59/1413105259.db2.gz	RGLSCGPUZRAZLH-FQEVSTJZSA-N	0	3	343.446	3.122	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1ccc(Cl)cc1OC)C(C)C	ZINC001732564020	1428755235	/nfs/dbraw/zinc/75/52/35/1428755235.db2.gz	DAILUDNEHVOFJD-AWEZNQCLSA-N	0	3	345.270	3.445	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)Cc1cccc2cccnc21)C(C)C	ZINC001732565350	1428757329	/nfs/dbraw/zinc/75/73/29/1428757329.db2.gz	MPVGNZVFRHBNOM-KRWDZBQOSA-N	0	3	345.874	3.260	20	30		EGEDHN
CCCC[C@H](CNCc1ccc(C#N)s1)NC(=O)C1=COCCC1	ZINC001700516792	1414169072	/nfs/dbraw/zinc/16/90/72/1414169072.db2.gz	KJJLDUODNPZYSO-OAHLLOKOSA-N	0	3	347.484	3.079	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1ccc2c(c1)CCO2	ZINC001712998959	1417550736	/nfs/dbraw/zinc/55/07/36/1417550736.db2.gz	ISCYMPNQHZXXGR-RHSMWYFYSA-N	0	3	348.874	3.347	20	30		EGEDHN
C[C@H](NC(=O)CC1CC1)[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001713272188	1417885922	/nfs/dbraw/zinc/88/59/22/1417885922.db2.gz	SLEUYVIDFRJYRQ-HNAYVOBHSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@H](NC(=O)C(C)(C)F)[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001713272428	1417887925	/nfs/dbraw/zinc/88/79/25/1417887925.db2.gz	VOTLFVCWIBPEHN-WMLDXEAASA-N	0	3	331.435	3.023	20	30		EGEDHN
N#Cc1ccc(CN[C@H](CNC(=O)c2cccc(F)c2)C2CC2)s1	ZINC001713859188	1418656351	/nfs/dbraw/zinc/65/63/51/1418656351.db2.gz	AHHCNKVNXZMFFR-QGZVFWFLSA-N	0	3	343.427	3.057	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](NCc2ccccc2N(C)C)C1	ZINC001713932356	1418721990	/nfs/dbraw/zinc/72/19/90/1418721990.db2.gz	QHRJFCZBHNFPGF-KRWDZBQOSA-N	0	3	329.488	3.045	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@@H]1CCN(Cc2ccc(-c3ccccc3)cc2)C1	ZINC001713967580	1418746888	/nfs/dbraw/zinc/74/68/88/1418746888.db2.gz	IFKQBQWVFNFFMQ-OXQOHEQNSA-N	0	3	333.435	3.204	20	30		EGEDHN
CC[C@@H](C)C(=O)NC1(CNCc2cc(C#N)ccc2F)CCCC1	ZINC001714128596	1418932450	/nfs/dbraw/zinc/93/24/50/1418932450.db2.gz	GKGMUTOYSTTYMW-CQSZACIVSA-N	0	3	331.435	3.262	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2cc(F)ccc2OC)CCCC1	ZINC001714139960	1418942357	/nfs/dbraw/zinc/94/23/57/1418942357.db2.gz	YULPIAKDDVTZSG-UHFFFAOYSA-N	0	3	340.826	3.219	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1ccc2ncccc2c1)C1CC1	ZINC001714171105	1418978860	/nfs/dbraw/zinc/97/88/60/1418978860.db2.gz	AHFZEVZDXHADCO-IBGZPJMESA-N	0	3	343.858	3.475	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@H](C)CNCc2ccccc2C#N)c(C)c1	ZINC001714453355	1419185640	/nfs/dbraw/zinc/18/56/40/1419185640.db2.gz	VTFGVLGHZIUVHU-MRXNPFEDSA-N	0	3	335.451	3.331	20	30		EGEDHN
C=C(Br)CN[C@@H](C)CCNC(=O)c1ccsc1C	ZINC001714465976	1419194808	/nfs/dbraw/zinc/19/48/08/1419194808.db2.gz	IBYVODZWYGYYJS-JTQLQIEISA-N	0	3	331.279	3.063	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2conc2C(C)C)CCCC1	ZINC001714497424	1419221505	/nfs/dbraw/zinc/22/15/05/1419221505.db2.gz	SQRYOLQMGOWJJR-UHFFFAOYSA-N	0	3	325.840	3.183	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)Cc2c(F)cccc2F)CCCC1	ZINC001714502240	1419228249	/nfs/dbraw/zinc/22/82/49/1419228249.db2.gz	IYKUJOHPQDPZPF-UHFFFAOYSA-N	0	3	342.817	3.278	20	30		EGEDHN
CC[C@@H](CNC(=O)c1ccc(C)cc1)NCc1ccc(C#N)s1	ZINC001715083220	1419820435	/nfs/dbraw/zinc/82/04/35/1419820435.db2.gz	UBSIBYITKOIYOC-HNNXBMFYSA-N	0	3	327.453	3.226	20	30		EGEDHN
C=C(Br)CNCC1(NC(=O)C[C@@H](C)CC)CCCC1	ZINC001715093913	1419835173	/nfs/dbraw/zinc/83/51/73/1419835173.db2.gz	ZCALELHZCMCPPH-LBPRGKRZSA-N	0	3	331.298	3.350	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2ncoc2C)CCCC[C@@H]1C	ZINC001715133353	1419882478	/nfs/dbraw/zinc/88/24/78/1419882478.db2.gz	WMFFHSCBUYDEJG-MEDUHNTESA-N	0	3	325.840	3.004	20	30		EGEDHN
C[C@@H](CNCc1ccccc1C#N)CNC(=O)c1cccc(Cl)c1	ZINC001715268940	1419985267	/nfs/dbraw/zinc/98/52/67/1419985267.db2.gz	FJTIBLQBZQXMSY-AWEZNQCLSA-N	0	3	341.842	3.367	20	30		EGEDHN
CC(C)(C)CC(=O)N[C@@H]1CCC[C@H]1CNCc1ccccc1C#N	ZINC001716056935	1420520062	/nfs/dbraw/zinc/52/00/62/1420520062.db2.gz	YMSSZVONULMNIU-ZWKOTPCHSA-N	0	3	327.472	3.369	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)NC(=O)c1cccc2[nH]ccc21	ZINC001716413096	1420642599	/nfs/dbraw/zinc/64/25/99/1420642599.db2.gz	ASZVETXBFFSANK-GFCCVEGCSA-N	0	3	338.436	3.009	20	30		EGEDHN
C[C@@H](CN(C)Cc1cccc(C#N)c1)NC(=O)c1ccc2c(c1)CCC2	ZINC001716504382	1420734927	/nfs/dbraw/zinc/73/49/27/1420734927.db2.gz	LLTVCLDFEVRYGH-INIZCTEOSA-N	0	3	347.462	3.297	20	30		EGEDHN
C=C(Cl)CN(CC1CC1)C1CCN(C(=O)c2cnccc2C)CC1	ZINC001733276866	1429441880	/nfs/dbraw/zinc/44/18/80/1429441880.db2.gz	CMSHILNAHVJCER-UHFFFAOYSA-N	0	3	347.890	3.459	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)s1	ZINC001716785508	1420921502	/nfs/dbraw/zinc/92/15/02/1420921502.db2.gz	HMSBOHYPLAHOPM-CQSZACIVSA-N	0	3	331.485	3.303	20	30		EGEDHN
Cc1ccccc1C(=O)N[C@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001723273739	1424326947	/nfs/dbraw/zinc/32/69/47/1424326947.db2.gz	JUYRGFBEBAXXAU-GOSISDBHSA-N	0	3	339.464	3.226	20	30		EGEDHN
C[C@]1(CNCc2ccccc2C#N)CCN(C(=O)C2CCCC2)C1	ZINC001724190463	1424723325	/nfs/dbraw/zinc/72/33/25/1424723325.db2.gz	VCMPEMJJIMDIAQ-HXUWFJFHSA-N	0	3	325.456	3.077	20	30		EGEDHN
CC(C)[C@H](F)C(=O)N(C)CC(C)(C)CNCc1ccccc1C#N	ZINC001725147305	1425629969	/nfs/dbraw/zinc/62/99/69/1425629969.db2.gz	IRMKHKWJQGOVNU-KRWDZBQOSA-N	0	3	333.451	3.127	20	30		EGEDHN
CCCC[C@H](CNCc1ccc(C#N)s1)NC(=O)c1ccns1	ZINC001725235376	1425818768	/nfs/dbraw/zinc/81/87/68/1425818768.db2.gz	VRRXFCMPHPMVQX-GFCCVEGCSA-N	0	3	348.497	3.155	20	30		EGEDHN
Cc1ccoc1C(=O)N(C)[C@@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001725451512	1426117228	/nfs/dbraw/zinc/11/72/28/1426117228.db2.gz	PPKHLRSLGKVJAG-INIZCTEOSA-N	0	3	343.452	3.162	20	30		EGEDHN
C=C(Br)CNC[C@@H](C1CC1)N(C)C(=O)C1(F)CCCC1	ZINC001725461539	1426127621	/nfs/dbraw/zinc/12/76/21/1426127621.db2.gz	NJFUPOOLRQOTBQ-ZDUSSCGKSA-N	0	3	347.272	3.004	20	30		EGEDHN
CCCCC(=O)N[C@@H](CNCc1cc(C#N)ccc1OC)C(C)(C)C	ZINC001725750548	1426428643	/nfs/dbraw/zinc/42/86/43/1426428643.db2.gz	YMSPOQNAQACBRG-SFHVURJKSA-N	0	3	345.487	3.378	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)CCOc2ccc(C)c(C)c2)C1	ZINC001731446186	1427424110	/nfs/dbraw/zinc/42/41/10/1427424110.db2.gz	QKVVNCPCJPPJCG-WKILWMFISA-N	0	3	336.863	3.062	20	30		EGEDHN
CC[C@@H](CC(=O)N1CC[C@H](NCc2ccc(F)c(C#N)c2)C1)C(C)C	ZINC001731647353	1427705062	/nfs/dbraw/zinc/70/50/62/1427705062.db2.gz	NLNKKQBXEKYSLY-WMZOPIPTSA-N	0	3	345.462	3.460	20	30		EGEDHN
Cc1ccc(C(=O)N(C)C[C@@H](C)NCc2ccc(F)c(C#N)c2)cc1	ZINC001734352543	1438070435	/nfs/dbraw/zinc/07/04/35/1438070435.db2.gz	QTAZJZATGGFFDP-OAHLLOKOSA-N	0	3	339.414	3.256	20	30		EGEDHN
C=CCCCC(=O)N1CCCC[C@H]1[C@H](C)NCc1cccc(OC)n1	ZINC001752157833	1440147697	/nfs/dbraw/zinc/14/76/97/1440147697.db2.gz	LOJPZHACISDLGY-WMZOPIPTSA-N	0	3	345.487	3.306	20	30		EGEDHN
CCC[C@H](C)C(=O)NCCCN(CC)CC#Cc1ccc(F)cc1	ZINC001752170310	1440149676	/nfs/dbraw/zinc/14/96/76/1440149676.db2.gz	APEWCKVVKKQCBZ-KRWDZBQOSA-N	0	3	332.463	3.442	20	30		EGEDHN
CCN(CC#Cc1ccc(F)cc1)CCCNC(=O)C1(F)CCCC1	ZINC001752192564	1440152802	/nfs/dbraw/zinc/15/28/02/1440152802.db2.gz	FEOJOJGMRBQMOG-UHFFFAOYSA-N	0	3	348.437	3.288	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)CCOc2ccccc2CC)C1	ZINC001752329912	1440171230	/nfs/dbraw/zinc/17/12/30/1440171230.db2.gz	GNJYYUUYKSCXCK-GOSISDBHSA-N	0	3	330.472	3.175	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1CC12CCN(Cc1ncccc1C)CC2	ZINC001752423032	1440176153	/nfs/dbraw/zinc/17/61/53/1440176153.db2.gz	FNCODNJUYBUGHR-SFHVURJKSA-N	0	3	341.499	3.463	20	30		EGEDHN
C[C@@H](C#N)C(=O)N[C@H]1CC12CCN(Cc1cccc(C(F)F)c1)CC2	ZINC001752424181	1440176422	/nfs/dbraw/zinc/17/64/22/1440176422.db2.gz	SSQIBNXNKWKQGX-BBRMVZONSA-N	0	3	347.409	3.255	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1CC12CCN(Cc1cccnc1C)CC2	ZINC001752427268	1440177604	/nfs/dbraw/zinc/17/76/04/1440177604.db2.gz	OGCJEDUGAQHHBJ-SFHVURJKSA-N	0	3	341.499	3.463	20	30		EGEDHN
C#CCCN1CCC(N(CCC)C(=O)c2sc(C)nc2C)CC1	ZINC001752441122	1440181339	/nfs/dbraw/zinc/18/13/39/1440181339.db2.gz	ABEKVHKPTMJEMV-UHFFFAOYSA-N	0	3	333.501	3.100	20	30		EGEDHN
C=CCN1CCC(N(CCC)C(=O)C[C@@H](C)n2nc(C)cc2C)CC1	ZINC001752441295	1440181421	/nfs/dbraw/zinc/18/14/21/1440181421.db2.gz	DHHMMTPPXDYKJY-GOSISDBHSA-N	0	3	346.519	3.340	20	30		EGEDHN
CCC(C)(C)CC(=O)NC[C@H](NCc1ccc(C#N)s1)C1CC1	ZINC001752458443	1440183297	/nfs/dbraw/zinc/18/32/97/1440183297.db2.gz	GIRBYGWKJVFGHQ-INIZCTEOSA-N	0	3	333.501	3.430	20	30		EGEDHN
CCC(C)(C)CC(=O)NC[C@@H](NCc1ccc(C#N)s1)C1CC1	ZINC001752458444	1440183388	/nfs/dbraw/zinc/18/33/88/1440183388.db2.gz	GIRBYGWKJVFGHQ-MRXNPFEDSA-N	0	3	333.501	3.430	20	30		EGEDHN
CC1(C(=O)NC[C@H](NCC#Cc2ccccc2Cl)C2CC2)CCC1	ZINC001752472397	1440184600	/nfs/dbraw/zinc/18/46/00/1440184600.db2.gz	IDSGHNVEJPVOTI-SFHVURJKSA-N	0	3	344.886	3.366	20	30		EGEDHN
CC1(C(=O)NC[C@@H](NCC#Cc2ccccc2)C2CC2)CCCCC1	ZINC001752482177	1440185755	/nfs/dbraw/zinc/18/57/55/1440185755.db2.gz	LMAWKMNWBVDNMY-HXUWFJFHSA-N	0	3	338.495	3.493	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H]2CN(Cc3cccnc3C)CC[C@@H]21	ZINC001752708356	1440203369	/nfs/dbraw/zinc/20/33/69/1440203369.db2.gz	ZZRYLOYJGZBEHV-PMACEKPBSA-N	0	3	339.483	3.006	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N[C@H]1C[C@@H](N[C@H](C)c2ccccc2F)C1	ZINC001752714281	1440203638	/nfs/dbraw/zinc/20/36/38/1440203638.db2.gz	GRRUQGGAOMLKJQ-QXSJWSMHSA-N	0	3	334.435	3.105	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001752786009	1440211411	/nfs/dbraw/zinc/21/14/11/1440211411.db2.gz	IRPAPBQZNRXYJK-XLIONFOSSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=CCN1CCCC[C@H]1CNC(=O)CCCOc1ccc(F)cc1	ZINC001752828228	1440224625	/nfs/dbraw/zinc/22/46/25/1440224625.db2.gz	SLOSROAROZYAFA-KRWDZBQOSA-N	0	3	334.435	3.141	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)C(CC)CC)CC1	ZINC001752847559	1440232861	/nfs/dbraw/zinc/23/28/61/1440232861.db2.gz	VJAOUVUTTNAEJI-UHFFFAOYSA-N	0	3	331.298	3.348	20	30		EGEDHN
C=CCC1(C(=O)NC2CCC(NCc3nccn3C)CC2)CCCC1	ZINC001752855226	1440234674	/nfs/dbraw/zinc/23/46/74/1440234674.db2.gz	OGJLERNBTHYPHX-UHFFFAOYSA-N	0	3	344.503	3.074	20	30		EGEDHN
C[C@H](CNC(=O)c1ccoc1C1CC1)NCc1ccc(C#N)c(F)c1	ZINC001752893547	1440241350	/nfs/dbraw/zinc/24/13/50/1440241350.db2.gz	CEBYIIVEDGRLAR-GFCCVEGCSA-N	0	3	341.386	3.076	20	30		EGEDHN
C=CCC1(C(=O)NC[C@H](C)N[C@H](C)c2ccccc2F)CCOCC1	ZINC001752916197	1440247093	/nfs/dbraw/zinc/24/70/93/1440247093.db2.gz	KWZJEUNUFRXRER-JKSUJKDBSA-N	0	3	348.462	3.354	20	30		EGEDHN
CC[C@@H](C)CC(=O)N1CC[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001752936770	1440250503	/nfs/dbraw/zinc/25/05/03/1440250503.db2.gz	VVZVGBCAQGFETL-CABCVRRESA-N	0	3	331.435	3.072	20	30		EGEDHN
CCCC[C@](C)(F)C(=O)N1CC[C@@H](CNCc2ccccc2C#N)C1	ZINC001752943307	1440251111	/nfs/dbraw/zinc/25/11/11/1440251111.db2.gz	KRWXUFGLEZBTEF-JXFKEZNVSA-N	0	3	345.462	3.415	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@H](CNCc2ccn(C(C)C)n2)C1	ZINC001752949860	1440251927	/nfs/dbraw/zinc/25/19/27/1440251927.db2.gz	OZQQTNXALKFBAM-IAGOWNOFSA-N	0	3	332.492	3.004	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CCC[C@@H](NCc2oc(CCC)nc2C)C1	ZINC001752964687	1440254024	/nfs/dbraw/zinc/25/40/24/1440254024.db2.gz	GVCQKFYJXSOUEI-CVEARBPZSA-N	0	3	333.476	3.419	20	30		EGEDHN
CC/C=C(\C)C(=O)N1CCC[C@H](N(C)Cc2ccc(F)c(C#N)c2)C1	ZINC001752988125	1440258817	/nfs/dbraw/zinc/25/88/17/1440258817.db2.gz	HNOAEVJOLYCYDH-WCLIJEPQSA-N	0	3	343.446	3.476	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1csc(CC(C)C)n1	ZINC001753018064	1440269062	/nfs/dbraw/zinc/26/90/62/1440269062.db2.gz	FEZHVECJDHAOFV-GFCCVEGCSA-N	0	3	329.897	3.192	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1CCCNC(=O)c1ccn(C)c1CC	ZINC001753033981	1440273818	/nfs/dbraw/zinc/27/38/18/1440273818.db2.gz	XJKRDORECLDZSW-HNNXBMFYSA-N	0	3	337.895	3.314	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1CCCNC(=O)CN(C)c1ccccc1	ZINC001753040461	1440276341	/nfs/dbraw/zinc/27/63/41/1440276341.db2.gz	XWUQSCHDATYRKG-SFHVURJKSA-N	0	3	349.906	3.236	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCN(C)Cc1ccc([C@H](C)C(F)(F)F)cc1	ZINC001753043658	1440277163	/nfs/dbraw/zinc/27/71/63/1440277163.db2.gz	HVJZKZHLFNOFEL-OLZOCXBDSA-N	0	3	341.377	3.060	20	30		EGEDHN
C=CCC1(C(=O)NC[C@H]2CCN(Cc3sc(C)nc3C)C2)CCC1	ZINC001753133153	1440317540	/nfs/dbraw/zinc/31/75/40/1440317540.db2.gz	HGDPNUNWUORHJP-MRXNPFEDSA-N	0	3	347.528	3.444	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC001753136057	1440318855	/nfs/dbraw/zinc/31/88/55/1440318855.db2.gz	SEUYUMYXFLXGCS-SFHVURJKSA-N	0	3	325.456	3.099	20	30		EGEDHN
C=C(C)CN[C@@H](CNC(=O)Cc1ccc(F)cc1)c1ccccc1	ZINC001753302763	1440354493	/nfs/dbraw/zinc/35/44/93/1440354493.db2.gz	JBJINEQSVCEECA-IBGZPJMESA-N	0	3	326.415	3.391	20	30		EGEDHN
C#CCCN[C@@H](CNC(=O)c1ccc2c(c1)C[C@H](C)O2)c1ccccc1	ZINC001753309019	1440356098	/nfs/dbraw/zinc/35/60/98/1440356098.db2.gz	AUQANVWPZGXOGY-JXFKEZNVSA-N	0	3	348.446	3.094	20	30		EGEDHN
C=CCOCCN1CC[C@H](N(CCC)C(=O)c2ccsc2C)C1	ZINC001753316660	1440360145	/nfs/dbraw/zinc/36/01/45/1440360145.db2.gz	XNDFOBYATMASAP-INIZCTEOSA-N	0	3	336.501	3.186	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CCC)C(=O)c2cc(C)c(F)cc2F)C1	ZINC001753316949	1440360408	/nfs/dbraw/zinc/36/04/08/1440360408.db2.gz	DSSJIQHLENPGKA-OAHLLOKOSA-N	0	3	334.410	3.223	20	30		EGEDHN
C[C@H](C(=O)NCC[C@H]1CCN(Cc2ccc(F)c(C#N)c2)C1)C1CC1	ZINC001753325077	1440366016	/nfs/dbraw/zinc/36/60/16/1440366016.db2.gz	PBDCDOWTQYHGPZ-GJZGRUSLSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=CCOCCN1CC[C@H](N(CCC)C(=O)[C@@H]2CCC(C)(C)C2)C1	ZINC001753329198	1440368266	/nfs/dbraw/zinc/36/82/66/1440368266.db2.gz	WOXBSIQMYFUHRB-MSOLQXFVSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=C(C)CCC(=O)NCC[C@@H]1CCN(Cc2cnn(C(C)(C)C)c2)C1	ZINC001753332575	1440370444	/nfs/dbraw/zinc/37/04/44/1440370444.db2.gz	QJYXOOHDKOSMJZ-QGZVFWFLSA-N	0	3	346.519	3.323	20	30		EGEDHN
CC(C)(C(=O)NCC[C@H]1CCN(CC#Cc2ccccc2)C1)C(F)F	ZINC001753335240	1440371710	/nfs/dbraw/zinc/37/17/10/1440371710.db2.gz	PQYQGSKMJZXTBJ-KRWDZBQOSA-N	0	3	348.437	3.158	20	30		EGEDHN
C=CCC1(C(=O)NCC[C@H]2CCN(Cc3cnc(C)o3)C2)CCC1	ZINC001753336488	1440372566	/nfs/dbraw/zinc/37/25/66/1440372566.db2.gz	UORPIDCOYUISSQ-INIZCTEOSA-N	0	3	331.460	3.058	20	30		EGEDHN
C=CCC1(C(=O)NCC[C@H]2CCN([C@H](C)c3cnccn3)C2)CCC1	ZINC001753336565	1440372734	/nfs/dbraw/zinc/37/27/34/1440372734.db2.gz	WCGOQCHJDTWTCI-SJORKVTESA-N	0	3	342.487	3.112	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001753348943	1440376902	/nfs/dbraw/zinc/37/69/02/1440376902.db2.gz	GHOIJLWKMQRFOR-HNNXBMFYSA-N	0	3	331.485	3.256	20	30		EGEDHN
C=CCCCC(=O)N(C)[C@@H]1CCN(Cc2cccc(OC)c2C)C1	ZINC001753441574	1440401996	/nfs/dbraw/zinc/40/19/96/1440401996.db2.gz	LWRISPGUVMDYFT-GOSISDBHSA-N	0	3	330.472	3.393	20	30		EGEDHN
C=CCOCCN1CC[C@@H](N(C)C(=O)c2cc(C)n(C(C)C)c2C)C1	ZINC001753448908	1440405250	/nfs/dbraw/zinc/40/52/50/1440405250.db2.gz	DGJBOYJAFWQIFH-GOSISDBHSA-N	0	3	347.503	3.035	20	30		EGEDHN
C=CCN1CC[C@@H](N(CC)C(=O)CCn2ccc3ccccc32)C1	ZINC001753462728	1440411642	/nfs/dbraw/zinc/41/16/42/1440411642.db2.gz	ZWBNPQYRGUGEMQ-GOSISDBHSA-N	0	3	325.456	3.140	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)[C@H](C)Cc2ccc(C)cc2)C1	ZINC001753463958	1440412108	/nfs/dbraw/zinc/41/21/08/1440412108.db2.gz	LETQSEHQSJFLQR-QUCCMNQESA-N	0	3	326.484	3.120	20	30		EGEDHN
CC[C@@H](CNC(=O)[C@H]1C[C@H]2C[C@H]2C1)NCC#Cc1ccccc1Cl	ZINC001753483415	1440417132	/nfs/dbraw/zinc/41/71/32/1440417132.db2.gz	KDOLQXSFDBPVEQ-MLHJIOFPSA-N	0	3	344.886	3.222	20	30		EGEDHN
CC[C@@H](CNC(=O)C1(CC)CC1)NCC#Cc1ccc(Cl)cc1	ZINC001753488050	1440418416	/nfs/dbraw/zinc/41/84/16/1440418416.db2.gz	BGZJFRNEQAOEAP-KRWDZBQOSA-N	0	3	332.875	3.366	20	30		EGEDHN
CC[C@H](CNC(=O)c1cc2ccccn2c1)NCC#Cc1ccccc1	ZINC001753487874	1440418439	/nfs/dbraw/zinc/41/84/39/1440418439.db2.gz	KJNNUYXJUVGCCB-HXUWFJFHSA-N	0	3	345.446	3.089	20	30		EGEDHN
CC[C@H](CNC(=O)C1(CC)CC1)NCC#Cc1ccc(Cl)cc1	ZINC001753488051	1440418456	/nfs/dbraw/zinc/41/84/56/1440418456.db2.gz	BGZJFRNEQAOEAP-QGZVFWFLSA-N	0	3	332.875	3.366	20	30		EGEDHN
CC[C@@H](CNC(=O)c1occc1Cl)NCC#Cc1ccccc1	ZINC001753490562	1440419448	/nfs/dbraw/zinc/41/94/48/1440419448.db2.gz	ZNBQVFQSKNENOY-HNNXBMFYSA-N	0	3	330.815	3.083	20	30		EGEDHN
CC[C@@H](CNC(=O)c1ccc(F)s1)NCc1ccc(C#N)c(F)c1	ZINC001753498837	1440422632	/nfs/dbraw/zinc/42/26/32/1440422632.db2.gz	ZQPUCHBYJJJVGJ-ZDUSSCGKSA-N	0	3	349.406	3.196	20	30		EGEDHN
CC#CCNCc1ccc(CNC(=O)c2cnc3ccsc3c2)cc1	ZINC001753589896	1440442524	/nfs/dbraw/zinc/44/25/24/1440442524.db2.gz	RFOMJLCMMDTAOR-UHFFFAOYSA-N	0	3	349.459	3.339	20	30		EGEDHN
C#CCNCc1ccc(CNC(=O)[C@]2(c3ccccc3)CC2(C)C)cc1	ZINC001753591905	1440443108	/nfs/dbraw/zinc/44/31/08/1440443108.db2.gz	RTJYYNYCVNLFOF-HSZRJFAPSA-N	0	3	346.474	3.394	20	30		EGEDHN
C[C@@H](C(=O)NC[C@@H](C)CNCc1ccccc1C#N)c1ccsc1	ZINC001753630865	1440452182	/nfs/dbraw/zinc/45/21/82/1440452182.db2.gz	PUVGPSREBLIYBH-LSDHHAIUSA-N	0	3	341.480	3.265	20	30		EGEDHN
C[C@H](NC1(CNC(=O)C#CC2CC2)CCCC1)c1cc(F)ccc1F	ZINC001753664303	1440459675	/nfs/dbraw/zinc/45/96/75/1440459675.db2.gz	RHSQSULHVYDGPV-AWEZNQCLSA-N	0	3	346.421	3.458	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)[C@H](C)C2CCC2)CCCC1	ZINC001753665216	1440460007	/nfs/dbraw/zinc/46/00/07/1440460007.db2.gz	UBJSRSKDFUKWPT-CYBMUJFWSA-N	0	3	343.309	3.350	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC1(NCc2cccnc2OC)CCCC1	ZINC001753667923	1440460926	/nfs/dbraw/zinc/46/09/26/1440460926.db2.gz	ODPSEDOXNUMNTH-LJQANCHMSA-N	0	3	345.487	3.211	20	30		EGEDHN
COc1ccc(C#N)cc1CNC[C@@H](C)N(C)C(=O)C1(C)CCCC1	ZINC001753704748	1440469324	/nfs/dbraw/zinc/46/93/24/1440469324.db2.gz	JUECBTKQICNCTP-OAHLLOKOSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N(C)[C@@H](C)CNCc1ccc(C#N)c(F)c1	ZINC001753709384	1440470119	/nfs/dbraw/zinc/47/01/19/1440470119.db2.gz	XSVUORICRXALEP-GJZGRUSLSA-N	0	3	331.435	3.236	20	30		EGEDHN
C[C@H](CNCC#Cc1ccccc1)N(C)C(=O)c1occc1Cl	ZINC001753710368	1440470478	/nfs/dbraw/zinc/47/04/78/1440470478.db2.gz	COIFSCNLILOAGS-CQSZACIVSA-N	0	3	330.815	3.035	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)C1CCCC1)NCc1ccc(C#N)cc1F	ZINC001753822236	1440496657	/nfs/dbraw/zinc/49/66/57/1440496657.db2.gz	FGANQMDAHOKPIE-GOSISDBHSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C(Br)CN[C@@H](CNC(=O)c1ccc(F)s1)C(C)C	ZINC001753846062	1440504399	/nfs/dbraw/zinc/50/43/99/1440504399.db2.gz	YIYZTMDOWWHKFG-JTQLQIEISA-N	0	3	349.269	3.140	20	30		EGEDHN
C[C@@H](C#N)C(=O)N(C)CCN(C)CCc1cc(Cl)ccc1Cl	ZINC001753850069	1440506109	/nfs/dbraw/zinc/50/61/09/1440506109.db2.gz	QUSFOVOYZLCDEG-LBPRGKRZSA-N	0	3	342.270	3.086	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CCC[C@@H]1CNCc1csc(C)n1	ZINC001753897118	1440523076	/nfs/dbraw/zinc/52/30/76/1440523076.db2.gz	ZZOIWMGECTYOHV-NVXWUHKLSA-N	0	3	333.501	3.020	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](C)CCNCc2ccncc2Cl)CC1	ZINC001753996466	1440529599	/nfs/dbraw/zinc/52/95/99/1440529599.db2.gz	FTVDQOIHSTVALF-CQSZACIVSA-N	0	3	335.879	3.466	20	30		EGEDHN
C=C[C@H](C(=O)N[C@@H](C)CCNCc1ncc(C)s1)c1ccccc1	ZINC001754024340	1440532953	/nfs/dbraw/zinc/53/29/53/1440532953.db2.gz	OQFZGLYJCVXNMO-YOEHRIQHSA-N	0	3	343.496	3.406	20	30		EGEDHN
C[C@@H](CCNCc1ccccc1C#N)NC(=O)c1ccc2c(c1)CCC2	ZINC001754035005	1440534137	/nfs/dbraw/zinc/53/41/37/1440534137.db2.gz	VQFOHZJBZRGVTJ-INIZCTEOSA-N	0	3	347.462	3.345	20	30		EGEDHN
CCN(CCNCc1cccc(C#N)c1)C(=O)[C@]1(C)CCC[C@@H]1C	ZINC001754066099	1440537413	/nfs/dbraw/zinc/53/74/13/1440537413.db2.gz	YBMMRZOEZOINEX-OXJNMPFZSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C[C@@H](C(=O)NC/C=C/CNCc1ccc(C)nc1C)c1ccccc1	ZINC001754210248	1440551039	/nfs/dbraw/zinc/55/10/39/1440551039.db2.gz	SXNRHUFLMINEBO-MHNQQFQPSA-N	0	3	349.478	3.430	20	30		EGEDHN
C[C@H](CN[C@H](C)c1ccccc1F)NC(=O)CC#Cc1ccccc1	ZINC001754254438	1440558655	/nfs/dbraw/zinc/55/86/55/1440558655.db2.gz	BKTXYMWWAMXKBU-IAGOWNOFSA-N	0	3	338.426	3.423	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccccc1)NC(=O)CCCc1cccs1	ZINC001754293033	1440565704	/nfs/dbraw/zinc/56/57/04/1440565704.db2.gz	CWKNBDZETLRDSJ-KRWDZBQOSA-N	0	3	340.492	3.217	20	30		EGEDHN
C=C[C@@H](C(=O)N[C@@H](C)CNCc1c(C)nsc1C)c1ccccc1	ZINC001754294931	1440566194	/nfs/dbraw/zinc/56/61/94/1440566194.db2.gz	GOJCTLDSMVWECI-SUMWQHHRSA-N	0	3	343.496	3.324	20	30		EGEDHN
Cc1ccsc1C(=O)N[C@H](C)CN(C)Cc1ccc(C#N)cc1	ZINC001754298637	1440567028	/nfs/dbraw/zinc/56/70/28/1440567028.db2.gz	JPGZSQYFAGOJQT-CQSZACIVSA-N	0	3	327.453	3.179	20	30		EGEDHN
CCc1cccc(CC(=O)N[C@H](C)CN(C)Cc2cccc(C#N)c2)c1	ZINC001754315414	1440575268	/nfs/dbraw/zinc/57/52/68/1440575268.db2.gz	VITPXDLJRJQEBY-QGZVFWFLSA-N	0	3	349.478	3.300	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H](C)CN(C)Cc1ccc2c(c1)COC2	ZINC001754329525	1440582638	/nfs/dbraw/zinc/58/26/38/1440582638.db2.gz	YRAVTXVLDOFRAE-HNNXBMFYSA-N	0	3	330.472	3.256	20	30		EGEDHN
CN(CCCNCc1ccc(C#N)cc1F)C(=O)C[C@@H]1CC[C@@H]2C[C@@H]21	ZINC001754381074	1440593467	/nfs/dbraw/zinc/59/34/67/1440593467.db2.gz	NOZRTBASXBSTMF-RYRKJORJSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=CCC1(C(=O)N(C)CCCN[C@H](C)c2cnc(C)cn2)CCCC1	ZINC001754419334	1440597178	/nfs/dbraw/zinc/59/71/78/1440597178.db2.gz	RWMLJABLTZNZKQ-QGZVFWFLSA-N	0	3	344.503	3.421	20	30		EGEDHN
C=CCCCCCN1CC[C@H]1CNC(=O)[C@H]1CCc2cccnc21	ZINC001754492175	1440610606	/nfs/dbraw/zinc/61/06/06/1440610606.db2.gz	XFQYBLPSNRXWPZ-ROUUACIJSA-N	0	3	327.472	3.048	20	30		EGEDHN
CCCCCCCN1CC[C@H]1CNC(=O)[C@@H]1Cc2cc(F)ccc2O1	ZINC001754495021	1440611797	/nfs/dbraw/zinc/61/17/97/1440611797.db2.gz	CVWIJCKMIHUTOT-HKUYNNGSSA-N	0	3	348.462	3.290	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H]2CCN2C[C@@H](OC)C2CCC2)CCCC1	ZINC001754505577	1440616217	/nfs/dbraw/zinc/61/62/17/1440616217.db2.gz	VTCHGVCKASHGEA-ZWKOTPCHSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NCC1(N[C@H]2CCc3c2cccc3F)CC1	ZINC001754509243	1440617010	/nfs/dbraw/zinc/61/70/10/1440617010.db2.gz	CKFKELKXIBONLI-KSSFIOAISA-N	0	3	346.446	3.033	20	30		EGEDHN
C#Cc1ccc(C(=O)NCC2(NCc3ccc(C)c(OC)c3)CC2)cc1	ZINC001754521811	1440619895	/nfs/dbraw/zinc/61/98/95/1440619895.db2.gz	UAEIMEAIPCVLFU-UHFFFAOYSA-N	0	3	348.446	3.037	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)CCC(F)(F)F)C1	ZINC001754537834	1440625296	/nfs/dbraw/zinc/62/52/96/1440625296.db2.gz	DZNDVPRNILAXMQ-CABCVRRESA-N	0	3	330.394	3.055	20	30		EGEDHN
C=CCOCC(=O)N1C[C@H]2CCC[C@@H](C1)N2CC[C@H]1CCC[C@@H](C)C1	ZINC001754549961	1440629556	/nfs/dbraw/zinc/62/95/56/1440629556.db2.gz	AZNZOFMVBAEXCS-WTGUMLROSA-N	0	3	348.531	3.471	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)C1(CCF)CC1	ZINC001754596859	1440641656	/nfs/dbraw/zinc/64/16/56/1440641656.db2.gz	ICGQIRPSWDNTNV-QAPCUYQASA-N	0	3	343.446	3.167	20	30		EGEDHN
Cc1ccc(C(=O)N2CCC[C@H]2CNCC#Cc2ccccc2)s1	ZINC001754605765	1440643266	/nfs/dbraw/zinc/64/32/66/1440643266.db2.gz	PQEWSQVGCXUJKJ-SFHVURJKSA-N	0	3	338.476	3.302	20	30		EGEDHN
C#CCN(C(=O)[C@H](C)c1ccccc1F)C1CCN(CC(=C)C)CC1	ZINC001754641682	1440649083	/nfs/dbraw/zinc/64/90/83/1440649083.db2.gz	JTZSFMVWGWBVQD-QGZVFWFLSA-N	0	3	342.458	3.432	20	30		EGEDHN
C#CCN(C(=O)[C@H]1CC[C@@H](C)C1)C1CCN(CCOCC(C)C)CC1	ZINC001754640963	1440649104	/nfs/dbraw/zinc/64/91/04/1440649104.db2.gz	KURHNNMDVKFACE-MOPGFXCFSA-N	0	3	348.531	3.021	20	30		EGEDHN
C#CCN(C(=O)c1ccc(C)c(F)c1F)C1CCN(CC(=C)C)CC1	ZINC001754641270	1440649138	/nfs/dbraw/zinc/64/91/38/1440649138.db2.gz	WADGNMAKCKBSCS-UHFFFAOYSA-N	0	3	346.421	3.389	20	30		EGEDHN
CC#CCCCC(=O)N[C@]1(C)CCN(CCCCC(F)(F)F)C1	ZINC001754677714	1440660657	/nfs/dbraw/zinc/66/06/57/1440660657.db2.gz	MBCBJNZEFICYFH-MRXNPFEDSA-N	0	3	332.410	3.493	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@](C)(CN[C@@H](C)c2cnc(C)cn2)C1	ZINC001754694367	1440666780	/nfs/dbraw/zinc/66/67/80/1440666780.db2.gz	BPYKIDQTEOVHCB-QFBILLFUSA-N	0	3	330.476	3.031	20	30		EGEDHN
CCC1(C(=O)N2CC[C@@](C)(CNCc3ccccc3C#N)C2)CC1	ZINC001754704711	1440668760	/nfs/dbraw/zinc/66/87/60/1440668760.db2.gz	NUCPPHUGSZTUEK-IBGZPJMESA-N	0	3	325.456	3.077	20	30		EGEDHN
C/C=C(\C)C(=O)NC[C@]1(C)CCCN(Cc2cccc(C#N)c2)C1	ZINC001754725260	1440675393	/nfs/dbraw/zinc/67/53/93/1440675393.db2.gz	KINJFQTZKVQKHH-XLTSXLIKSA-N	0	3	325.456	3.243	20	30		EGEDHN
CC#CCN1CCC[C@@](C)(CNC(=O)c2ccc(C)c3c2CCC3)C1	ZINC001754735014	1440681659	/nfs/dbraw/zinc/68/16/59/1440681659.db2.gz	RMYBUMMYFANSCZ-QFIPXVFZSA-N	0	3	338.495	3.339	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@]1(C)CCCN(CCc2ccns2)C1	ZINC001754735801	1440682244	/nfs/dbraw/zinc/68/22/44/1440682244.db2.gz	LAIZKHLBMIWLFR-SFHVURJKSA-N	0	3	335.517	3.116	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)C[C@H](OCC)C(C)C)C2)CC1	ZINC001754784339	1440687201	/nfs/dbraw/zinc/68/72/01/1440687201.db2.gz	UYECASLIVOBGBJ-UXHICEINSA-N	0	3	348.531	3.021	20	30		EGEDHN
CC/C=C(\C)C(=O)N1CC[C@H]([C@@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001754787935	1440688159	/nfs/dbraw/zinc/68/81/59/1440688159.db2.gz	PWSHBRIKBCVHOW-CBXCUOSBSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H]([C@@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001754798953	1440690066	/nfs/dbraw/zinc/69/00/66/1440690066.db2.gz	JBXWWRNICJEULM-WBVHZDCISA-N	0	3	343.446	3.380	20	30		EGEDHN
C#CCNCCN(Cc1ccccc1)C(=O)[C@@]1(C)CCc2ccccc21	ZINC001754839135	1440697452	/nfs/dbraw/zinc/69/74/52/1440697452.db2.gz	DZGNGNRTQYOGDU-QHCPKHFHSA-N	0	3	346.474	3.142	20	30		EGEDHN
C=CC[C@@H](C(=O)N1C[C@H]2CN(C[C@H](F)CC)C[C@H]2C1)c1ccccc1	ZINC001754847885	1440699533	/nfs/dbraw/zinc/69/95/33/1440699533.db2.gz	KIOYXKIADKUQPL-IYWMVGAKSA-N	0	3	344.474	3.485	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1cccc(C#N)c1	ZINC001754867152	1440703348	/nfs/dbraw/zinc/70/33/48/1440703348.db2.gz	HCCXSWACKOLMRI-SFTDATJTSA-N	0	3	349.478	3.317	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)CCCc1sccc1C	ZINC001754872434	1440705628	/nfs/dbraw/zinc/70/56/28/1440705628.db2.gz	YSDQNFWHKAXNEC-ROUUACIJSA-N	0	3	344.524	3.468	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)CCCc3ccsc3)[C@@H]2C1	ZINC001754874137	1440706359	/nfs/dbraw/zinc/70/63/59/1440706359.db2.gz	LOXULDVNZQFVDG-ZWKOTPCHSA-N	0	3	330.497	3.017	20	30		EGEDHN
CCCCCC(=O)N1CC[C@@H](CCNCc2ccccc2C#N)C1	ZINC001754902417	1440707106	/nfs/dbraw/zinc/70/71/06/1440707106.db2.gz	JKTMCQGZKRJMQU-QGZVFWFLSA-N	0	3	327.472	3.467	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCN(C(=O)[C@@H](CC)OC2CCCC2)C1	ZINC001754934072	1440710942	/nfs/dbraw/zinc/71/09/42/1440710942.db2.gz	IPHBJBDJMBWGCD-DOTOQJQBSA-N	0	3	342.911	3.305	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)C[C@@H]3C[C@H]3C3CC3)CCC2)s1	ZINC001754989614	1440723855	/nfs/dbraw/zinc/72/38/55/1440723855.db2.gz	QPJJXUVMRXJYTH-YOEHRIQHSA-N	0	3	343.496	3.184	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)C[C@H](C)c2cccc(F)c2)CC1	ZINC001755028955	1440730258	/nfs/dbraw/zinc/73/02/58/1440730258.db2.gz	KACYYHQZQSFNAS-LPHOPBHVSA-N	0	3	330.447	3.313	20	30		EGEDHN
CC#CCN(C)CCCN(C)C(=O)CCc1ccc([C@H]2C[C@H]2C)o1	ZINC001755040153	1440736688	/nfs/dbraw/zinc/73/66/88/1440736688.db2.gz	LAJKPOZSBQGFPH-AEFFLSMTSA-N	0	3	330.472	3.139	20	30		EGEDHN
CCC(=CC(=O)N1C[C@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1)CC	ZINC001755108125	1440753914	/nfs/dbraw/zinc/75/39/14/1440753914.db2.gz	ZUUCSBHWXYSORA-IFXJQAMLSA-N	0	3	343.446	3.380	20	30		EGEDHN
CCC(C)(C)CC(=O)N1C[C@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001755120514	1440755588	/nfs/dbraw/zinc/75/55/88/1440755588.db2.gz	HVXKBNSUMPEXMH-XJKSGUPXSA-N	0	3	333.501	3.383	20	30		EGEDHN
Cc1ccccc1CC(=O)N1C[C@H](C)[C@H](NCC#Cc2ccccc2)C1	ZINC001755121426	1440755723	/nfs/dbraw/zinc/75/57/23/1440755723.db2.gz	HVOZPDSNBKPGAE-SIKLNZKXSA-N	0	3	346.474	3.026	20	30		EGEDHN
C=CCOCC(=O)N[C@H]1CCN([C@@H](C)c2ccc(F)cc2)CC1(C)C	ZINC001755139884	1440759837	/nfs/dbraw/zinc/75/98/37/1440759837.db2.gz	NJTJVEUJTCOKLG-YJBOKZPZSA-N	0	3	348.462	3.306	20	30		EGEDHN
C=CCCCN1CCc2ccccc2[C@@H]1CNC(=O)[C@H](C)OCC	ZINC001755171627	1440769167	/nfs/dbraw/zinc/76/91/67/1440769167.db2.gz	ALSJQYDJLAGGPF-LPHOPBHVSA-N	0	3	330.472	3.093	20	30		EGEDHN
C=CCCCN1CCOC2(CCN(C(=O)[C@H]3CCC[C@@H]3CC)CC2)C1	ZINC001755174038	1440770046	/nfs/dbraw/zinc/77/00/46/1440770046.db2.gz	HJYVQPKRMJQIRK-OALUTQOASA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC[C@@H]1CN(C)CCOc1ccccc1	ZINC001755194932	1440776585	/nfs/dbraw/zinc/77/65/85/1440776585.db2.gz	FQJGZVJLKRFENL-GOSISDBHSA-N	0	3	330.472	3.345	20	30		EGEDHN
C=CCN(C)C[C@@H]1CCCN1C(=O)CCc1ncc(C(C)(C)C)o1	ZINC001755195704	1440776876	/nfs/dbraw/zinc/77/68/76/1440776876.db2.gz	WRHJMZYJDMPETC-HNNXBMFYSA-N	0	3	333.476	3.014	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H]([C@H]2CCN(Cc3cncs3)C2)C1	ZINC001755203184	1440781109	/nfs/dbraw/zinc/78/11/09/1440781109.db2.gz	SCUKXAOEFILDTN-CVEARBPZSA-N	0	3	333.501	3.170	20	30		EGEDHN
C=CCCOCC(=O)N1CCC[C@H]1CN(C)[C@H](C)c1ccc(F)cc1	ZINC001755203459	1440781322	/nfs/dbraw/zinc/78/13/22/1440781322.db2.gz	WVOJASRFRPZECM-APWZRJJASA-N	0	3	348.462	3.402	20	30		EGEDHN
C=C(Cl)CNCC1CC(NC(=O)C2C3CC4CC(C3)CC2C4)C1	ZINC001755212702	1440783516	/nfs/dbraw/zinc/78/35/16/1440783516.db2.gz	CXWBZNDCIDTFIN-UHFFFAOYSA-N	0	3	336.907	3.296	20	30		EGEDHN
C=C(Cl)CNCC1CC(NC(=O)c2c(F)cccc2Cl)C1	ZINC001755221429	1440784758	/nfs/dbraw/zinc/78/47/58/1440784758.db2.gz	XXPZLDGAZFGALJ-UHFFFAOYSA-N	0	3	331.218	3.330	20	30		EGEDHN
C=C(Cl)CNCC1CC(NC(=O)[C@]2(C)CCc3ccccc32)C1	ZINC001755224929	1440785610	/nfs/dbraw/zinc/78/56/10/1440785610.db2.gz	ZVXYJUMAQNJZJY-GSQSYGFSSA-N	0	3	332.875	3.127	20	30		EGEDHN
C#CCCCCC(=O)N(C)C1CCC(NCc2conc2CC)CC1	ZINC001755273176	1440798320	/nfs/dbraw/zinc/79/83/20/1440798320.db2.gz	QJSUXYHAKCEGIQ-UHFFFAOYSA-N	0	3	345.487	3.290	20	30		EGEDHN
C=CCOCCN(C)[C@@H](C)CNC(=O)c1c(Cl)cccc1Cl	ZINC001755322398	1440819298	/nfs/dbraw/zinc/81/92/98/1440819298.db2.gz	HXEIBVVJPNUXHO-LBPRGKRZSA-N	0	3	345.270	3.246	20	30		EGEDHN
CCCC[C@@H](CNCC#Cc1ccc(Cl)cc1)NC(=O)C1CC1	ZINC001755356762	1440829854	/nfs/dbraw/zinc/82/98/54/1440829854.db2.gz	WLQISVFJHVCGSV-SFHVURJKSA-N	0	3	332.875	3.366	20	30		EGEDHN
CCCC[C@@H](CNCc1ccc(F)c(C#N)c1)NC(=O)[C@H]1C[C@@H]1C	ZINC001755359842	1440831192	/nfs/dbraw/zinc/83/11/92/1440831192.db2.gz	KZRFHXRXSGDDTF-JQFCIGGWSA-N	0	3	331.435	3.118	20	30		EGEDHN
C#CCCCC(=O)NC[C@H]1CCCCCN1Cc1ccc(OC)cc1	ZINC001755363125	1440832866	/nfs/dbraw/zinc/83/28/66/1440832866.db2.gz	CHNLXDDTXXATBS-LJQANCHMSA-N	0	3	342.483	3.360	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H](C)C1CN(Cc2ccc3ncccc3c2)C1	ZINC001755385067	1440840435	/nfs/dbraw/zinc/84/04/35/1440840435.db2.gz	YRUGFZJPACXBOZ-OAHLLOKOSA-N	0	3	337.467	3.384	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1CN(CCOc2ccccc2)CC1(C)C	ZINC001755413935	1440847686	/nfs/dbraw/zinc/84/76/86/1440847686.db2.gz	MFWRNKHKEXJXQW-SFHVURJKSA-N	0	3	330.472	3.248	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@@H]1[C@H]2CN(Cc3cccc(F)c3)C[C@H]21	ZINC001755430823	1440851189	/nfs/dbraw/zinc/85/11/89/1440851189.db2.gz	GROBHJRWDDNBMV-GNBUJSLZSA-N	0	3	330.447	3.222	20	30		EGEDHN
C=CCCC(=O)N1CC2(C1)CCCN(Cc1sc(C)nc1C)C2	ZINC001755454679	1440854839	/nfs/dbraw/zinc/85/48/39/1440854839.db2.gz	LTZQZFSANLGOCK-UHFFFAOYSA-N	0	3	333.501	3.151	20	30		EGEDHN
C=C(Cl)CNC[C@H]1C[C@H](NC(=O)c2cccc3cccnc32)C1	ZINC001755474834	1440859285	/nfs/dbraw/zinc/85/92/85/1440859285.db2.gz	QONGBOLOESPXGA-CTYIDZIISA-N	0	3	329.831	3.085	20	30		EGEDHN
C[C@H](CCCNCC#Cc1ccccc1Cl)NC(=O)[C@@H]1C[C@H]1C	ZINC001755511499	1440863577	/nfs/dbraw/zinc/86/35/77/1440863577.db2.gz	OXNDJXZMUYNERE-BFYDXBDKSA-N	0	3	332.875	3.222	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N[C@@H](C)CCCNCc1cc(C#N)ccc1F	ZINC001755517368	1440864474	/nfs/dbraw/zinc/86/44/74/1440864474.db2.gz	SKDAWHCAQSVEHW-YSVLISHTSA-N	0	3	331.435	3.118	20	30		EGEDHN
CCC1(C(=O)N2CCC(N(C)CC#Cc3ccc(F)cc3)CC2)CC1	ZINC001755533051	1440868132	/nfs/dbraw/zinc/86/81/32/1440868132.db2.gz	GVZKODCXPVCGIQ-UHFFFAOYSA-N	0	3	342.458	3.290	20	30		EGEDHN
C=CC(C)(C)C(=O)N(C)[C@H](CNCC#Cc1ccc(F)cc1)C1CC1	ZINC001755563639	1440875130	/nfs/dbraw/zinc/87/51/30/1440875130.db2.gz	CJYIPHPVXOIGHJ-LJQANCHMSA-N	0	3	342.458	3.216	20	30		EGEDHN
Cc1ccccc1C(=O)N(C)C[C@H](C)NCc1ccc(F)c(C#N)c1	ZINC001755575935	1440878100	/nfs/dbraw/zinc/87/81/00/1440878100.db2.gz	NZDRPOMUKXFDFZ-HNNXBMFYSA-N	0	3	339.414	3.256	20	30		EGEDHN
Cc1ccc(CN[C@@H](C)CN(C)C(=O)c2cc(C#N)c[nH]2)c(Cl)c1	ZINC001755583442	1440879891	/nfs/dbraw/zinc/87/98/91/1440879891.db2.gz	GPLUAAKHHFWCON-ZDUSSCGKSA-N	0	3	344.846	3.099	20	30		EGEDHN
Cc1ccc(CC(=O)N(C)C[C@H](C)NCC#Cc2ccccc2)cc1	ZINC001755598015	1440883190	/nfs/dbraw/zinc/88/31/90/1440883190.db2.gz	VJFMCNGYRQYSKJ-IBGZPJMESA-N	0	3	334.463	3.026	20	30		EGEDHN
C[C@H](CN(C)C(=O)c1ccnc(C2CC2)c1)NCC#Cc1ccccc1	ZINC001755597528	1440883220	/nfs/dbraw/zinc/88/32/20/1440883220.db2.gz	MMXGMARRCMYPID-QGZVFWFLSA-N	0	3	347.462	3.061	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](NCc2ncccc2C)[C@@H]1C	ZINC001755654028	1440891664	/nfs/dbraw/zinc/89/16/64/1440891664.db2.gz	KHJPBSKPKBYCNR-FUHWJXTLSA-N	0	3	327.472	3.237	20	30		EGEDHN
Cc1ccsc1C(=O)N1C[C@@H](NCC#Cc2ccccc2)C[C@H]1C	ZINC001755670118	1440893899	/nfs/dbraw/zinc/89/38/99/1440893899.db2.gz	PITJGDCTBMPEAP-AEFFLSMTSA-N	0	3	338.476	3.301	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](NCc2cn(C(C)C)nc2C)C[C@@H]1C	ZINC001755673802	1440894361	/nfs/dbraw/zinc/89/43/61/1440894361.db2.gz	BQRCQPSYODLKGG-YJBOKZPZSA-N	0	3	332.492	3.208	20	30		EGEDHN
C=CCN1CC[C@]2(NC(=O)[C@H](OCC)c3ccccc3)CCC[C@@H]12	ZINC001755705041	1440902446	/nfs/dbraw/zinc/90/24/46/1440902446.db2.gz	TZLDMFVAIDXAFJ-QWFCFKBJSA-N	0	3	328.456	3.063	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1CCCN(CCn2nc(C)cc2C)[C@H]1C	ZINC001755716241	1440905309	/nfs/dbraw/zinc/90/53/09/1440905309.db2.gz	KTXZGTYIGJUWEE-ROUUACIJSA-N	0	3	346.519	3.071	20	30		EGEDHN
Cc1nc(C(C)C)oc1CNC[C@@H]1CC[C@H](NC(=O)C#CC(C)C)C1	ZINC001755734846	1440910720	/nfs/dbraw/zinc/91/07/20/1440910720.db2.gz	XDRJOEKMUJGVGU-SJORKVTESA-N	0	3	345.487	3.140	20	30		EGEDHN
CC1(C)CN(C(=O)/C=C/c2ccco2)C[C@@H]1NCC#Cc1ccccc1	ZINC001755751484	1440913233	/nfs/dbraw/zinc/91/32/33/1440913233.db2.gz	PZBLMAXBCSDHRB-SJFMBGHLSA-N	0	3	348.446	3.171	20	30		EGEDHN
C/C=C(/C)C(=O)N1C[C@H](NCC#Cc2ccc(Cl)cc2)C(C)(C)C1	ZINC001755754528	1440913786	/nfs/dbraw/zinc/91/37/86/1440913786.db2.gz	WZGRLSOAVALFOE-LQBXZKJLSA-N	0	3	344.886	3.484	20	30		EGEDHN
CC1(C(=O)N2C[C@@H](NCC#Cc3cccc(Cl)c3)C(C)(C)C2)CC1	ZINC001755759104	1440914634	/nfs/dbraw/zinc/91/46/34/1440914634.db2.gz	LADBANQOLCHCRI-QGZVFWFLSA-N	0	3	344.886	3.318	20	30		EGEDHN
C=CCCC(=O)N(CCN(C)Cc1cccc2nsnc21)C(C)C	ZINC001755809441	1440919218	/nfs/dbraw/zinc/91/92/18/1440919218.db2.gz	QLULDCSGYBZYJC-UHFFFAOYSA-N	0	3	346.500	3.326	20	30		EGEDHN
C=C(Br)CNC[C@H](NC(=O)C1CC(C)(C)C1)C(C)(C)C	ZINC001755823956	1440926717	/nfs/dbraw/zinc/92/67/17/1440926717.db2.gz	QCROZGOHCXZKMY-ZDUSSCGKSA-N	0	3	345.325	3.452	20	30		EGEDHN
C=CCCCC(=O)N[C@@H](CNCc1n[nH]c(C(C)(C)C)n1)C(C)(C)C	ZINC001755829955	1440928454	/nfs/dbraw/zinc/92/84/54/1440928454.db2.gz	GYTFQTVBXQZVAK-AWEZNQCLSA-N	0	3	349.523	3.079	20	30		EGEDHN
C#CCN1CCC([C@@H](C)NC(=O)C(C)(C)c2ccccc2Cl)CC1	ZINC001755846006	1440933431	/nfs/dbraw/zinc/93/34/31/1440933431.db2.gz	IMPIYUNJKZKQSE-OAHLLOKOSA-N	0	3	346.902	3.468	20	30		EGEDHN
C/C=C(\C)C(=O)N(C)C1CC(NCC#Cc2cccc(Cl)c2)C1	ZINC001755855566	1440935675	/nfs/dbraw/zinc/93/56/75/1440935675.db2.gz	UPUQSOZSHIIGGT-LNKIKWGQSA-N	0	3	330.859	3.237	20	30		EGEDHN
CN(C(=O)[C@H]1CCCC1(C)C)C1CC(NCC#Cc2ccccc2)C1	ZINC001755859760	1440936487	/nfs/dbraw/zinc/93/64/87/1440936487.db2.gz	FTDFRJWONYXKAC-SOAGJPPSSA-N	0	3	338.495	3.443	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCC1=CCN(Cc2ccc(C(C)(C)C)cc2)CC1	ZINC001755883814	1440940055	/nfs/dbraw/zinc/94/00/55/1440940055.db2.gz	BKUUHIJAWHENFN-INIZCTEOSA-N	0	3	339.483	3.392	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC1=CCN(C[C@@H]2CC(C)(C)CO2)CC1	ZINC001755891204	1440941662	/nfs/dbraw/zinc/94/16/62/1440941662.db2.gz	VQGVHFLVRZUFPG-KRWDZBQOSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=CC1(CC(=O)NCC2=CCN(CCOCC)CC2)CCCCC1	ZINC001755895868	1440942392	/nfs/dbraw/zinc/94/23/92/1440942392.db2.gz	YJJXFRWLFFFLTH-UHFFFAOYSA-N	0	3	334.504	3.298	20	30		EGEDHN
C=C(Cl)Cn1c(N2C[C@H](C)N(CC)C[C@@H]2C)nnc1C(C)(C)C	ZINC001760386495	1441368116	/nfs/dbraw/zinc/36/81/16/1441368116.db2.gz	AOISMKXXZOMBOU-KBPBESRZSA-N	0	3	339.915	3.247	20	30		EGEDHN
C=CCCC1(C[NH2+]Cc2ccc(-c3nnn[n-]3)c(OC)c2)CCCC1	ZINC001573334864	947463968	/nfs/dbraw/zinc/46/39/68/947463968.db2.gz	SKJRFNOAVIREAJ-UHFFFAOYSA-N	0	3	341.459	3.492	20	30		EGEDHN
C=CCCC1(C[NH2+]Cc2ccc(-c3nn[n-]n3)c(OC)c2)CCCC1	ZINC001573334864	947463973	/nfs/dbraw/zinc/46/39/73/947463973.db2.gz	SKJRFNOAVIREAJ-UHFFFAOYSA-N	0	3	341.459	3.492	20	30		EGEDHN
COc1ccccc1[C@@H](CNCc1cccc(C#N)c1)N1CCCC1	ZINC000053095296	214163595	/nfs/dbraw/zinc/16/35/95/214163595.db2.gz	WIRLRAXVZFJQAU-HXUWFJFHSA-N	0	3	335.451	3.494	20	30		EGEDHN
CN(CCC(=O)N1CCc2sccc2C1)Cc1ccc(C#N)cc1	ZINC000055901782	214347898	/nfs/dbraw/zinc/34/78/98/214347898.db2.gz	JGSUKFARONBXSB-UHFFFAOYSA-N	0	3	339.464	3.027	20	30		EGEDHN
COc1ccc([C@@H](CNCc2ccc(C#N)o2)N2CCCC2)cc1	ZINC000174243140	231159092	/nfs/dbraw/zinc/15/90/92/231159092.db2.gz	JDUKFEDOZVSMKP-LJQANCHMSA-N	0	3	325.412	3.087	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CN2CCC[C@@H]2c2cccs2)cc1	ZINC000040475826	213311293	/nfs/dbraw/zinc/31/12/93/213311293.db2.gz	NSQNREJSIXMHHZ-DOTOQJQBSA-N	0	3	328.437	3.197	20	30		EGEDHN
CN(c1ccc(NC(=O)c2ccc(C#N)cc2)cc1)C1CCN(C)CC1	ZINC000079147271	217199388	/nfs/dbraw/zinc/19/93/88/217199388.db2.gz	CKCRHMVUNGOCKC-UHFFFAOYSA-N	0	3	348.450	3.341	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H]2CCOc3c(CC)cccc32)CC1	ZINC000264346245	246382820	/nfs/dbraw/zinc/38/28/20/246382820.db2.gz	KCYWXWWXPAZFEY-GOSISDBHSA-N	0	3	343.471	3.022	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2coc3ccccc23)CC1	ZINC000265173504	247268995	/nfs/dbraw/zinc/26/89/95/247268995.db2.gz	UXWSUDWDWZXVHP-UHFFFAOYSA-N	0	3	327.428	3.273	20	30		EGEDHN
C[C@@H]1C[C@@H](c2ccccc2)CN1CC(=O)NCc1ccc(C#N)cc1	ZINC000265258523	247346306	/nfs/dbraw/zinc/34/63/06/247346306.db2.gz	XSJNGDVZLHLXNT-OXQOHEQNSA-N	0	3	333.435	3.052	20	30		EGEDHN
C=C(C)COc1cc(CNC[C@@H](O)c2ccc(C)o2)ccc1OC	ZINC000266032575	248048453	/nfs/dbraw/zinc/04/84/53/248048453.db2.gz	SJZKALAIBLECKA-MRXNPFEDSA-N	0	3	331.412	3.375	20	30		EGEDHN
CN(C[C@H](O)c1ccc(C#N)cc1)[C@H]1CCCN(c2ccccc2)C1	ZINC000268703594	252154890	/nfs/dbraw/zinc/15/48/90/252154890.db2.gz	RUDLJXFATAQPJP-SFTDATJTSA-N	0	3	335.451	3.192	20	30		EGEDHN
C#CCOc1ccc([C@H](C)NC[C@H](O)c2ccc(OC)cc2)cc1	ZINC000268761618	252211848	/nfs/dbraw/zinc/21/18/48/252211848.db2.gz	OBVJTVHVKFGFBB-YWZLYKJASA-N	0	3	325.408	3.091	20	30		EGEDHN
N#Cc1ccccc1-c1ccc(CN2CCC[C@@H]2C(=O)NC2CC2)cc1	ZINC000097258991	219006001	/nfs/dbraw/zinc/00/60/01/219006001.db2.gz	XQORYIOBOTYCNM-OAQYLSRUSA-N	0	3	345.446	3.468	20	30		EGEDHN
C[C@@H](NCCCS(=O)(=O)Cc1ccccc1)c1ccc(C#N)cc1	ZINC000181543483	533388604	/nfs/dbraw/zinc/38/86/04/533388604.db2.gz	QJTCWXLZYUNEJC-MRXNPFEDSA-N	0	3	342.464	3.214	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2CNCc2ccc(C#N)o2)C[C@H](C)O1	ZINC000237621488	141010735	/nfs/dbraw/zinc/01/07/35/141010735.db2.gz	ZCUYLSSYPBLUHD-HOTGVXAUSA-N	0	3	339.439	3.050	20	30		EGEDHN
C[C@H](NC1CCN(Cc2ccc(C#N)cc2)CC1)c1ccncc1F	ZINC000338010947	141073058	/nfs/dbraw/zinc/07/30/58/141073058.db2.gz	JGEGDZGBMDLKEY-HNNXBMFYSA-N	0	3	338.430	3.408	20	30		EGEDHN
N#Cc1cc(C(=O)NC[C@H]2CCCN2Cc2ccccc2)ccc1F	ZINC000341117398	155169380	/nfs/dbraw/zinc/16/93/80/155169380.db2.gz	CNOSKNKMCIGVON-GOSISDBHSA-N	0	3	337.398	3.092	20	30		EGEDHN
COCC#CCN1CCCC[C@@H]1CCc1ccc(OC)c(OC)c1	ZINC000677817987	549336702	/nfs/dbraw/zinc/33/67/02/549336702.db2.gz	DQTSQJRUXCRUET-GOSISDBHSA-N	0	3	331.456	3.141	20	30		EGEDHN
CC[C@@H](N[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O)c1cccs1	ZINC000190603781	153150474	/nfs/dbraw/zinc/15/04/74/153150474.db2.gz	MKAHUPVECVACBF-SJORKVTESA-N	0	3	339.464	3.462	20	30		EGEDHN
N#Cc1cccc(NC(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000193638535	153298800	/nfs/dbraw/zinc/29/88/00/153298800.db2.gz	OABMFYVWDGNIFW-SFHVURJKSA-N	0	3	334.423	3.202	20	30		EGEDHN
C[C@H](N[C@H]1CCCC[C@H]1OC(F)F)C(=O)Nc1cccc(C#N)c1	ZINC000337383072	154323093	/nfs/dbraw/zinc/32/30/93/154323093.db2.gz	DSABWNSHSNRNPK-TUKIKUTGSA-N	0	3	337.370	3.025	20	30		EGEDHN
Cc1cc(F)cc2c1CN(CCC(=O)Nc1cccc(C#N)c1)CC2	ZINC000337445250	154356966	/nfs/dbraw/zinc/35/69/66/154356966.db2.gz	HZMZKJWYHPGQBB-UHFFFAOYSA-N	0	3	337.398	3.393	20	30		EGEDHN
COc1cc(CN[C@H]2CCCN(c3ccc(C#N)cc3)C2=O)ccc1C	ZINC000351889546	165139588	/nfs/dbraw/zinc/13/95/88/165139588.db2.gz	MKPBIKKIERTSHP-IBGZPJMESA-N	0	3	349.434	3.161	20	30		EGEDHN
Cc1nc(NCc2ccccc2OCCN(C)C)c(Cl)cc1C#N	ZINC000359884440	167257217	/nfs/dbraw/zinc/25/72/17/167257217.db2.gz	WFDQERAXEKDOEV-UHFFFAOYSA-N	0	3	344.846	3.468	20	30		EGEDHN
C[C@H](C(=O)N1CC=C(c2ccc(C#N)cc2)CC1)N1[C@H](C)CC[C@H]1C	ZINC000367228864	168196363	/nfs/dbraw/zinc/19/63/63/168196363.db2.gz	NOXXCUCPKWNNGJ-BRWVUGGUSA-N	0	3	337.467	3.435	20	30		EGEDHN
CC[C@@H](N[C@H]1CCCN(c2ccc(C#N)cc2F)C1)c1nccn1C	ZINC000367746116	168265948	/nfs/dbraw/zinc/26/59/48/168265948.db2.gz	FASLQGDGRSQWBL-DOTOQJQBSA-N	0	3	341.434	3.141	20	30		EGEDHN
CCCOc1cccc(CN2CC[C@@H](Oc3ccc(C#N)cn3)C2)c1	ZINC000430184500	270050261	/nfs/dbraw/zinc/05/02/61/270050261.db2.gz	GBLMBWLFWRTXKS-LJQANCHMSA-N	0	3	337.423	3.395	20	30		EGEDHN
CC1(C#N)CCN(CCC(=O)Nc2ccc(C#N)c(Cl)c2)CC1	ZINC000272615309	265945726	/nfs/dbraw/zinc/94/57/26/265945726.db2.gz	TVXHPTXDARIBDA-UHFFFAOYSA-N	0	3	330.819	3.166	20	30		EGEDHN
CCN1CCCN(c2nc3c(c(C#N)c2C#N)CCCCCC3)CC1	ZINC000330115129	266144628	/nfs/dbraw/zinc/14/46/28/266144628.db2.gz	TXVREYGTIHDXSV-UHFFFAOYSA-N	0	3	337.471	3.016	20	30		EGEDHN
CCOC(=O)Nc1ccc(NC(=O)[C@H](C)NC(C)(C)CC)cc1C#N	ZINC000275056711	266266832	/nfs/dbraw/zinc/26/68/32/266266832.db2.gz	MOEOCGVTDYJKBE-LBPRGKRZSA-N	0	3	346.431	3.232	20	30		EGEDHN
CCS[C@@H]1CCC[C@@H](NC(=O)C(C#N)Cc2ccc(C#N)cc2)C1	ZINC000280351234	266346003	/nfs/dbraw/zinc/34/60/03/266346003.db2.gz	IIOXSENDFJTKAD-RCCFBDPRSA-N	0	3	341.480	3.421	20	30		EGEDHN
CN(CCn1cc(C#N)c(=O)c2ccccc21)Cc1ccc(F)cc1	ZINC000193491540	266552190	/nfs/dbraw/zinc/55/21/90/266552190.db2.gz	NVHHZVDUUVTGHO-UHFFFAOYSA-N	0	3	335.382	3.144	20	30		EGEDHN
CN1CC[C@@H]2[C@H](CCCN2C(=O)C(C)(C)Cc2ccc(C#N)cc2)C1	ZINC000410596360	266602330	/nfs/dbraw/zinc/60/23/30/266602330.db2.gz	ZCXPNGINICOURV-RTBURBONSA-N	0	3	339.483	3.070	20	30		EGEDHN
CCCCNC(=O)[C@@H]1CC[C@H](C)N(Cc2ccc(C#N)c(OC)c2)C1	ZINC000442800400	267009674	/nfs/dbraw/zinc/00/96/74/267009674.db2.gz	JVLHUWQIOBISMO-MAUKXSAKSA-N	0	3	343.471	3.084	20	30		EGEDHN
C[C@@H]1CN(CCC2CCN(c3ccc(F)cc3C#N)CC2)C[C@@H](C)O1	ZINC000301511620	267048476	/nfs/dbraw/zinc/04/84/76/267048476.db2.gz	ATKSRUFCNSPHBD-HZPDHXFCSA-N	0	3	345.462	3.413	20	30		EGEDHN
C[C@@H]1c2ccccc2CCN1C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000280544554	267113262	/nfs/dbraw/zinc/11/32/62/267113262.db2.gz	TYAMPOLHHDOMQM-DNVCBOLYSA-N	0	3	329.403	3.386	20	30		EGEDHN
CCOC(=O)[C@](C)(CNCc1ccc(C#N)c(F)c1)c1ccccc1	ZINC000421395916	267135478	/nfs/dbraw/zinc/13/54/78/267135478.db2.gz	QMDNTLXZGRYISO-HXUWFJFHSA-N	0	3	340.398	3.308	20	30		EGEDHN
CCO[C@@H]1C[C@@H](NCc2ccc(C#N)c(F)c2)[C@H]1Oc1ccccc1	ZINC000453368723	267150519	/nfs/dbraw/zinc/15/05/19/267150519.db2.gz	DTSUHVZIBLUSBR-VAMGGRTRSA-N	0	3	340.398	3.412	20	30		EGEDHN
C[C@H](CNC(=O)C(C#N)Cc1ccc(C#N)cc1)c1ccc(F)cc1	ZINC000279368529	267160696	/nfs/dbraw/zinc/16/06/96/267160696.db2.gz	RPOVMFORDNUYSA-RDTXWAMCSA-N	0	3	335.382	3.300	20	30		EGEDHN
C[C@H](NC(=O)C(C#N)Cc1ccc(C#N)cc1)c1ccc(Cl)cn1	ZINC000338902651	267175804	/nfs/dbraw/zinc/17/58/04/267175804.db2.gz	KPBYIYYAGOLBIK-SWLSCSKDSA-N	0	3	338.798	3.166	20	30		EGEDHN
C[C@H](NC(=O)C1C[C@H](c2ccccc2)OC1=O)c1ccc(C#N)cc1	ZINC000289223159	267176851	/nfs/dbraw/zinc/17/68/51/267176851.db2.gz	JLORIFHVLAXIOG-MORSLUCNSA-N	0	3	334.375	3.040	20	30		EGEDHN
C[C@H](NC1(c2cccc(C#N)c2)CC1)c1ccc(-n2cncn2)cc1	ZINC000272165991	267180224	/nfs/dbraw/zinc/18/02/24/267180224.db2.gz	CGLISMWPDZCWQO-HNNXBMFYSA-N	0	3	329.407	3.479	20	30		EGEDHN
C[C@H](NCc1ccccc1CN1CCC(O)CC1)c1cccc(C#N)c1	ZINC000271862235	267185778	/nfs/dbraw/zinc/18/57/78/267185778.db2.gz	KUMRHNHXGGAYOD-KRWDZBQOSA-N	0	3	349.478	3.366	20	30		EGEDHN
CC[C@@H](NC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1)C(C)(C)C	ZINC000521554110	267190377	/nfs/dbraw/zinc/19/03/77/267190377.db2.gz	HPVFLGZTXZYSTH-GOSISDBHSA-N	0	3	344.503	3.456	20	30		EGEDHN
C[C@H](O)[C@@H]1CCN(Cc2cccc(OCc3cccc(C#N)c3)c2)C1	ZINC000272470345	267194421	/nfs/dbraw/zinc/19/44/21/267194421.db2.gz	AEUBJMVHIULWLC-OXJNMPFZSA-N	0	3	336.435	3.340	20	30		EGEDHN
CN(C)C[C@@H]1CCc2ccccc2N1C(=O)c1cc(C#N)cs1	ZINC000436721222	267282846	/nfs/dbraw/zinc/28/28/46/267282846.db2.gz	HFVUCINBEWWYEN-HNNXBMFYSA-N	0	3	325.437	3.143	20	30		EGEDHN
COC(=O)[C@]1(c2ccccc2)CCN(Cc2ccc(C#N)c(F)c2)C1	ZINC000428788827	267395282	/nfs/dbraw/zinc/39/52/82/267395282.db2.gz	SHVISLYDJULICF-HXUWFJFHSA-N	0	3	338.382	3.014	20	30		EGEDHN
C[C@@H](CNc1c(C#N)cnc2ccccc21)N1CCc2ccccc2C1	ZINC000461455526	267694074	/nfs/dbraw/zinc/69/40/74/267694074.db2.gz	ZLUHJTSGRXIUGK-INIZCTEOSA-N	0	3	342.446	3.387	20	30		EGEDHN
C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)C(C)(C)Cc1ccc(C#N)cc1	ZINC000456065980	267784576	/nfs/dbraw/zinc/78/45/76/267784576.db2.gz	VEDRYKORHZVHKV-APWZRJJASA-N	0	3	339.483	3.212	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)s1)C[C@@H](O)COc1ccccc1	ZINC000278556195	268039092	/nfs/dbraw/zinc/03/90/92/268039092.db2.gz	ALENJUBYKXMMBF-OAHLLOKOSA-N	0	3	330.453	3.270	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CC[C@@H](c3ccc(F)cc3)C2)cc1	ZINC000280199782	268084049	/nfs/dbraw/zinc/08/40/49/268084049.db2.gz	UPEIODBMKLQGRI-MOPGFXCFSA-N	0	3	347.393	3.396	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NC[C@H]2CCc3ccccc32)cc1	ZINC000348229056	268085074	/nfs/dbraw/zinc/08/50/74/268085074.db2.gz	LMBXNFSUODCTFR-MOPGFXCFSA-N	0	3	329.403	3.087	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N(Cc2ccccc2)C2CC2)cc1	ZINC000280323666	268088439	/nfs/dbraw/zinc/08/84/39/268088439.db2.gz	GWBOTVKLFQEBMN-LJQANCHMSA-N	0	3	329.403	3.432	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NC[C@@H]2CCc3ccccc32)cc1	ZINC000348229058	268091181	/nfs/dbraw/zinc/09/11/81/268091181.db2.gz	LMBXNFSUODCTFR-RBUKOAKNSA-N	0	3	329.403	3.087	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@@H]([NH2+][C@@H]3CCc4cccc([O-])c43)C2=O)cc1	ZINC000296360892	268111894	/nfs/dbraw/zinc/11/18/94/268111894.db2.gz	IAIQYTLLDWNMCL-QZTJIDSGSA-N	0	3	347.418	3.036	20	30		EGEDHN
N#Cc1ccc2c(c1)N(C(=O)c1ccc(CN3CCCC3)cc1)CC2	ZINC000270305244	268222463	/nfs/dbraw/zinc/22/24/63/268222463.db2.gz	XTBWSLHQBQSMIZ-UHFFFAOYSA-N	0	3	331.419	3.357	20	30		EGEDHN
N#Cc1ccc(CNC[C@]2(CO)C[C@@H]2c2ccc(F)cc2)cc1F	ZINC000421391177	268233081	/nfs/dbraw/zinc/23/30/81/268233081.db2.gz	NBTBQRQLINRZJX-MJGOQNOKSA-N	0	3	328.362	3.092	20	30		EGEDHN
N#Cc1cccc(NCC2(N3CCSCC3)CCCC2)c1[N+](=O)[O-]	ZINC000450259221	268281913	/nfs/dbraw/zinc/28/19/13/268281913.db2.gz	VTSSRUZFYDTGRA-UHFFFAOYSA-N	0	3	346.456	3.240	20	30		EGEDHN
C[C@@H](CN1CCC[C@H](C)C1)NC(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000352283034	274218233	/nfs/dbraw/zinc/21/82/33/274218233.db2.gz	ZPGMAIHBCXUBKE-STQMWFEESA-N	0	3	334.851	3.454	20	30		EGEDHN
CC(C)(CO)[C@@H](NCCOc1ccccc1C#N)c1cccs1	ZINC000289459725	276342384	/nfs/dbraw/zinc/34/23/84/276342384.db2.gz	YDBDIWYOOFDMMH-KRWDZBQOSA-N	0	3	330.453	3.348	20	30		EGEDHN
Cc1ccc2c(c1)[C@H]1CN(C)CC[C@@H]1N2C(=O)c1ccc(C#N)cc1	ZINC000010045349	281127904	/nfs/dbraw/zinc/12/79/04/281127904.db2.gz	QYMDIFHQTYTRQT-QUCCMNQESA-N	0	3	331.419	3.315	20	30		EGEDHN
C[C@H](N[C@@H]1CC(=O)N([C@H]2C[C@H]2c2ccccc2)C1)c1ccc(C#N)cc1	ZINC000344316543	290000421	/nfs/dbraw/zinc/00/04/21/290000421.db2.gz	DTXZLRIBECEQBI-ZFCZOSEKSA-N	0	3	345.446	3.366	20	30		EGEDHN
Cc1ccccc1[C@H]([C@H](C)NC(=O)c1cccc(F)c1C#N)N(C)C	ZINC000357879214	302207790	/nfs/dbraw/zinc/20/77/90/302207790.db2.gz	VJXNBBJXRZOYTN-LIRRHRJNSA-N	0	3	339.414	3.427	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)cc1)C[C@@H](O)COc1ccccc1F	ZINC000069520483	307375442	/nfs/dbraw/zinc/37/54/42/307375442.db2.gz	METFQLZRUJNPPO-GOSISDBHSA-N	0	3	342.414	3.348	20	30		EGEDHN
CCC1(CC)[C@H](NCC(=O)Nc2oc(C)c(C)c2C#N)[C@@H](C)[C@H]1OC	ZINC000248838653	308012785	/nfs/dbraw/zinc/01/27/85/308012785.db2.gz	OSZCQMWDCCXNPE-CSMYWGQOSA-N	0	3	347.459	3.136	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@@H](N[C@@H](COC(N)=O)Cc1ccccc1)CC2	ZINC000495884861	311627015	/nfs/dbraw/zinc/62/70/15/311627015.db2.gz	JNUGNQAEFFFMLP-MJGOQNOKSA-N	0	3	335.407	3.256	20	30		EGEDHN
CN1CC[C@@H](NC(=O)C2(c3cccc(C#N)c3)CC2)[C@H]1c1ccccc1	ZINC000536262654	314103650	/nfs/dbraw/zinc/10/36/50/314103650.db2.gz	IRCMXQICQDRXLK-WOJBJXKFSA-N	0	3	345.446	3.151	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN[C@H](C)c1cnn(C(C)C)c1	ZINC000542574864	314560132	/nfs/dbraw/zinc/56/01/32/314560132.db2.gz	XTRDKZFOPDDDBD-CQSZACIVSA-N	0	3	328.416	3.074	20	30		EGEDHN
CCc1nc2ccccc2c(N(C)CCCc2[nH]nc(N)c2C#N)c1C	ZINC000554284820	315307151	/nfs/dbraw/zinc/30/71/51/315307151.db2.gz	CSOCFUDGUPGWMI-UHFFFAOYSA-N	0	3	348.454	3.182	20	30		EGEDHN
N#Cc1ccc(C(=O)N2CCN(c3ccnc4ccccc43)CC2)cc1	ZINC000556833541	315471835	/nfs/dbraw/zinc/47/18/35/315471835.db2.gz	WTPWFMDQCOYYTB-UHFFFAOYSA-N	0	3	342.402	3.069	20	30		EGEDHN
Cc1cc(C)cc(OC[C@@H](O)CNC2(c3cccc(C#N)c3)CC2)c1	ZINC000560174670	315665538	/nfs/dbraw/zinc/66/55/38/315665538.db2.gz	MORYPNOUSJSRFG-IBGZPJMESA-N	0	3	336.435	3.194	20	30		EGEDHN
Cc1cccc([C@@H]2CCCN2CCC(=O)Nc2cccc(C#N)c2)n1	ZINC000564271077	316129573	/nfs/dbraw/zinc/12/95/73/316129573.db2.gz	UYQRQCBWXNBMSX-IBGZPJMESA-N	0	3	334.423	3.427	20	30		EGEDHN
C[C@@H](CC1CCCCC1)NCCS(=O)(=O)c1ccc(C#N)cc1	ZINC000564865241	316221874	/nfs/dbraw/zinc/22/18/74/316221874.db2.gz	XKNXVUXRUKKLJL-HNNXBMFYSA-N	0	3	334.485	3.280	20	30		EGEDHN
N#Cc1csc(CN2CC[C@](CO)(Cc3ccc(F)cc3)C2)c1	ZINC000565272338	316301732	/nfs/dbraw/zinc/30/17/32/316301732.db2.gz	MAQHXMADLSXULW-SFHVURJKSA-N	0	3	330.428	3.186	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](O)CO[C@H]2CCCc3ccccc32)s1	ZINC000570564028	317073907	/nfs/dbraw/zinc/07/39/07/317073907.db2.gz	FJBLZMHGFIPYGK-KXBFYZLASA-N	0	3	342.464	3.164	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@H]1Nc1ccc(C#N)c([N+](=O)[O-])c1	ZINC000389832260	324279860	/nfs/dbraw/zinc/27/98/60/324279860.db2.gz	IDEPGKNGFFKJAI-KBXCAEBGSA-N	0	3	336.395	3.399	20	30		EGEDHN
CCC1CCC(CNCCS(=O)(=O)c2ccc(C#N)cc2)CC1	ZINC000391222139	324286366	/nfs/dbraw/zinc/28/63/66/324286366.db2.gz	ZGBFOMFUEQFOSX-UHFFFAOYSA-N	0	3	334.485	3.138	20	30		EGEDHN
C[C@@H]1C[C@@H]1N1CCN(C(=O)c2ccc(Cl)c(C#N)c2)C[C@@H](C)C1	ZINC000579020229	325051656	/nfs/dbraw/zinc/05/16/56/325051656.db2.gz	FMHJXXQFQFBECO-AHIWAGSCSA-N	0	3	331.847	3.014	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](NC[C@H]3C[C@@H]3c3ccccc3)C2=O)cc1	ZINC000579123144	325066386	/nfs/dbraw/zinc/06/63/86/325066386.db2.gz	GWMXSJPNVASDPI-NJYVYQBISA-N	0	3	345.446	3.052	20	30		EGEDHN
N#Cc1nccc(N(CCN2CCCC2)Cc2ccc(Cl)cc2)n1	ZINC000581083126	325328994	/nfs/dbraw/zinc/32/89/94/325328994.db2.gz	UKSSPKMESLGOJM-UHFFFAOYSA-N	0	3	341.846	3.104	20	30		EGEDHN
CN(C)[C@@H](CNc1ccc([N+](=O)[O-])c(C#N)c1)c1ccc(F)cc1	ZINC000157695249	455221718	/nfs/dbraw/zinc/22/17/18/455221718.db2.gz	KMNBBAQPDYIRLK-KRWDZBQOSA-N	0	3	328.347	3.320	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(-c3ccccc3Cl)on2)CC1	ZINC000264509410	455226862	/nfs/dbraw/zinc/22/68/62/455226862.db2.gz	SOVYUANNAAHMHA-UHFFFAOYSA-N	0	3	345.830	3.375	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@@H](C)N1CC[C@H](c2ccccc2OC)C1	ZINC000157812550	455235256	/nfs/dbraw/zinc/23/52/56/455235256.db2.gz	FWTDHGUIRGYHJR-SJORKVTESA-N	0	3	330.472	3.298	20	30		EGEDHN
CC(C)(C)n1cc(C#N)cc1NC(=O)N1CC[C@@H](N2CCCCC2)C1	ZINC000264574715	455240246	/nfs/dbraw/zinc/24/02/46/455240246.db2.gz	IKIYPDLCUJVFTC-MRXNPFEDSA-N	0	3	343.475	3.207	20	30		EGEDHN
COc1ccc(CN(C)C[C@@H]2CCCC[C@@H]2O)cc1OCCCC#N	ZINC000181091383	455286222	/nfs/dbraw/zinc/28/62/22/455286222.db2.gz	UUKYQJOXUVYMNG-ROUUACIJSA-N	0	3	346.471	3.361	20	30		EGEDHN
CC[C@@]1(CO)CCCN(Cc2ccc(OC)c(OCCCC#N)c2)C1	ZINC000190228802	455289968	/nfs/dbraw/zinc/28/99/68/455289968.db2.gz	BMMWMIAHDYHECP-HXUWFJFHSA-N	0	3	346.471	3.362	20	30		EGEDHN
Cc1ccc(NC(=O)N2CCC[C@@](C)(C#N)C2)c(OCCN(C)C)c1	ZINC000612309611	460590310	/nfs/dbraw/zinc/59/03/10/460590310.db2.gz	AOCWOLDSVUBATN-IBGZPJMESA-N	0	3	344.459	3.093	20	30		EGEDHN
C[C@@H](NC(C)(C)CNC(=O)N1CCC[C@](C)(C#N)C1)c1ccccc1	ZINC000612372306	460608471	/nfs/dbraw/zinc/60/84/71/460608471.db2.gz	OGPRVEYIWNWSEB-OXQOHEQNSA-N	0	3	342.487	3.451	20	30		EGEDHN
CCN1CCN(c2ccc(NC(=O)c3cccc(C#N)c3)c(C)c2)CC1	ZINC000025186017	453761624	/nfs/dbraw/zinc/76/16/24/453761624.db2.gz	GISBUKBVXXPFEY-UHFFFAOYSA-N	0	3	348.450	3.261	20	30		EGEDHN
N#Cc1ccccc1/C=C/C(=O)N1CCCN(Cc2ccccc2)CC1	ZINC000032466759	453874151	/nfs/dbraw/zinc/87/41/51/453874151.db2.gz	BFGJWJMNDANEEA-VAWYXSNFSA-N	0	3	345.446	3.306	20	30		EGEDHN
CCN(C[C@H]1CCN(Cc2ccccc2)C1)C(=O)C1(C#N)CCC1	ZINC000075325161	453879446	/nfs/dbraw/zinc/87/94/46/453879446.db2.gz	IEFVRVUDJHNNCY-SFHVURJKSA-N	0	3	325.456	3.051	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N[C@@H](CN1CCCCC1)c1ccccc1	ZINC000075630651	453912838	/nfs/dbraw/zinc/91/28/38/453912838.db2.gz	JBBHGOZJEZHIBL-MJGOQNOKSA-N	0	3	330.472	3.311	20	30		EGEDHN
C[C@H](CNC(=O)CSCc1ccc(C#N)cc1)N1CCC(C)CC1	ZINC000067270236	453915903	/nfs/dbraw/zinc/91/59/03/453915903.db2.gz	FVQCREWUNYGDCJ-MRXNPFEDSA-N	0	3	345.512	3.028	20	30		EGEDHN
Cc1cccc([C@@H]2CCCN2C[C@H](O)COc2ccc(C#N)cc2)c1	ZINC000055157056	453966718	/nfs/dbraw/zinc/96/67/18/453966718.db2.gz	JMIPHTZZUUBNHQ-FPOVZHCZSA-N	0	3	336.435	3.444	20	30		EGEDHN
CN(C)CCN(Cc1cccs1)C(=O)Nc1ccc(CC#N)cc1	ZINC000084297628	453982527	/nfs/dbraw/zinc/98/25/27/453982527.db2.gz	QLAJOVUGANQCGM-UHFFFAOYSA-N	0	3	342.468	3.410	20	30		EGEDHN
C[C@H](NC(C)(C)CNC(=O)c1cc(C#N)cs1)c1ccccc1	ZINC000084293111	453982560	/nfs/dbraw/zinc/98/25/60/453982560.db2.gz	BDAOYNRVLQRRIJ-ZDUSSCGKSA-N	0	3	327.453	3.479	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@@H](C)N1CCC(OCc2ccccc2)CC1	ZINC000042563702	454013671	/nfs/dbraw/zinc/01/36/71/454013671.db2.gz	KJXKUFOHTXORGZ-GOSISDBHSA-N	0	3	342.483	3.257	20	30		EGEDHN
CN1CCC(NC(=O)Nc2cccc(C#Cc3cccs3)c2)CC1	ZINC000043996517	454085284	/nfs/dbraw/zinc/08/52/84/454085284.db2.gz	HNKUCYXKIZMMDA-UHFFFAOYSA-N	0	3	339.464	3.364	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H]2CCCC[C@@H]2Cc2ccccc2)CC1	ZINC000077309575	454088947	/nfs/dbraw/zinc/08/89/47/454088947.db2.gz	INWMRASZADSSHH-RTWAWAEBSA-N	0	3	338.495	3.249	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)N1CCC(C#N)CC1)c1ccsc1	ZINC000057991419	454159837	/nfs/dbraw/zinc/15/98/37/454159837.db2.gz	XTKIGAHCJOQGAS-MRXNPFEDSA-N	0	3	334.489	3.076	20	30		EGEDHN
C[C@H]1C[C@H]1c1ccc(CN(CCC(=O)N(C)CCC#N)C2CC2)o1	ZINC000130905608	454225363	/nfs/dbraw/zinc/22/53/63/454225363.db2.gz	GWXWVXIIAHJRMR-WMLDXEAASA-N	0	3	329.444	3.130	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H]2CCCC[C@@H]2SCC)CC1	ZINC000078331644	454232878	/nfs/dbraw/zinc/23/28/78/454232878.db2.gz	ADOFBHZNTHCHMT-HOTGVXAUSA-N	0	3	325.522	3.000	20	30		EGEDHN
C=CCc1cc(C(=O)N(CCN(C)C)CC(C)C)cc(OC)c1OC	ZINC000058884344	454240251	/nfs/dbraw/zinc/24/02/51/454240251.db2.gz	ZMOUKORUGWJWMJ-UHFFFAOYSA-N	0	3	348.487	3.092	20	30		EGEDHN
N#Cc1cccc(OCCNC2(c3ccc(F)cc3)CCOCC2)c1	ZINC000071886842	454243553	/nfs/dbraw/zinc/24/35/53/454243553.db2.gz	NFHVDMQECJBUAV-UHFFFAOYSA-N	0	3	340.398	3.372	20	30		EGEDHN
COc1ccc(CN(C[C@H]2CCCO2)[C@@H]2CCSC2)cc1C#N	ZINC000089952692	454245599	/nfs/dbraw/zinc/24/55/99/454245599.db2.gz	RIIXKMGOBHHTLB-IAGOWNOFSA-N	0	3	332.469	3.053	20	30		EGEDHN
COCCOc1ccc(CN[C@H](C)c2ccc(C#N)cc2)cc1OC	ZINC000078447635	454254473	/nfs/dbraw/zinc/25/44/73/454254473.db2.gz	UJMRSTRTVHNNSN-OAHLLOKOSA-N	0	3	340.423	3.443	20	30		EGEDHN
C[C@@H]1CC[C@H](C)N1CC(=O)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000120214263	454271917	/nfs/dbraw/zinc/27/19/17/454271917.db2.gz	SDTPSVIOMQZGJY-OKILXGFUSA-N	0	3	338.373	3.046	20	30		EGEDHN
C#CCOc1ccc([C@@H](C)N[C@H](CCO)c2ccc(OC)cc2)cc1	ZINC000120374366	454292868	/nfs/dbraw/zinc/29/28/68/454292868.db2.gz	RXEFNTCIBYQJBJ-IIBYNOLFSA-N	0	3	339.435	3.482	20	30		EGEDHN
CC[C@@H](Cc1ccccc1)N(CC)CC(=O)N[C@@](C)(C#N)C1CC1	ZINC000120427605	454300789	/nfs/dbraw/zinc/30/07/89/454300789.db2.gz	IARZCMDPLDDGHO-ICSRJNTNSA-N	0	3	327.472	3.138	20	30		EGEDHN
Cc1ccc(C(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)cc1C	ZINC000047010944	454318233	/nfs/dbraw/zinc/31/82/33/454318233.db2.gz	JDZRPXQYQCNBKI-UHFFFAOYSA-N	0	3	335.451	3.379	20	30		EGEDHN
C=C(C)COc1cccc(NC(=O)N(C)C[C@@H]2CCCN(C)C2)c1	ZINC000078801420	454321122	/nfs/dbraw/zinc/32/11/22/454321122.db2.gz	JRVYXVURABUMNC-MRXNPFEDSA-N	0	3	331.460	3.447	20	30		EGEDHN
C=C(C)COc1cccc(NC(=O)N2CC[C@@H]3CC[C@H](C2)N3C)c1	ZINC000072944245	454368337	/nfs/dbraw/zinc/36/83/37/454368337.db2.gz	GPGYXOUFOUDWGL-DLBZAZTESA-N	0	3	329.444	3.342	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N[C@@H](C)c1cccnc1)C(C)C	ZINC000079268995	454390334	/nfs/dbraw/zinc/39/03/34/454390334.db2.gz	WXNKZCMVAXORHI-WMZOPIPTSA-N	0	3	330.476	3.140	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/[C@H]2CCN(c3ccccn3)C2)c([O-])c1	ZINC000133119493	454393960	/nfs/dbraw/zinc/39/39/60/454393960.db2.gz	NDZHYEVRVUAFLC-NIZGNDASSA-N	0	3	338.455	3.331	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N[C@H](C)c1c(C)noc1C)C(C)C	ZINC000073202758	454406852	/nfs/dbraw/zinc/40/68/52/454406852.db2.gz	WYMUASLLKSQYOV-PBHICJAKSA-N	0	3	348.491	3.350	20	30		EGEDHN
C[C@@H](C(=O)N(CCN(C)C)Cc1cccc(C#N)c1)c1ccccc1	ZINC000121268556	454413338	/nfs/dbraw/zinc/41/33/38/454413338.db2.gz	ULQIGYZOHYUBFZ-QGZVFWFLSA-N	0	3	335.451	3.252	20	30		EGEDHN
N#CCSc1cccc(C(=O)N2CCC[C@H]2CN2CCCC2)c1	ZINC000079536939	454432619	/nfs/dbraw/zinc/43/26/19/454432619.db2.gz	QXWCVNZDLDGNEW-INIZCTEOSA-N	0	3	329.469	3.003	20	30		EGEDHN
C[C@@H]1CN(CC2CCN(c3ccc(F)cc3C#N)CC2)C[C@@H](C)O1	ZINC000091478920	454440223	/nfs/dbraw/zinc/44/02/23/454440223.db2.gz	DGHVYJPCGKEYAA-HUUCEWRRSA-N	0	3	331.435	3.023	20	30		EGEDHN
N#Cc1ccccc1OCCN1CCN(CC2CCCCC2)CC1	ZINC000064130181	454467063	/nfs/dbraw/zinc/46/70/63/454467063.db2.gz	VKSQGZJVJQHFAJ-UHFFFAOYSA-N	0	3	327.472	3.135	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)n1	ZINC000121705659	454468136	/nfs/dbraw/zinc/46/81/36/454468136.db2.gz	JXWYACAMEQDVTB-SECBINFHSA-N	0	3	336.760	3.259	20	30		EGEDHN
CCCCN(CCCO)[C@@H](C)C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000182154977	455448940	/nfs/dbraw/zinc/44/89/40/455448940.db2.gz	KCCUDEMZORSHBF-ZDUSSCGKSA-N	0	3	337.851	3.023	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2CNCc2cccc(C#N)c2)C[C@@H](C)O1	ZINC000048816760	454518500	/nfs/dbraw/zinc/51/85/00/454518500.db2.gz	QSLBYWONKSGKLV-QZTJIDSGSA-N	0	3	349.478	3.457	20	30		EGEDHN
C=CCSCCNC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000080104199	454533186	/nfs/dbraw/zinc/53/31/86/454533186.db2.gz	VOFHXMKRYDEZLE-SJLPKXTDSA-N	0	3	347.528	3.258	20	30		EGEDHN
CN(C)[C@@H](CNC(=O)c1ccc(C#N)c(Cl)c1)Cc1ccccc1	ZINC000122583967	454549833	/nfs/dbraw/zinc/54/98/33/454549833.db2.gz	CATMYBDLSZIACG-QGZVFWFLSA-N	0	3	341.842	3.114	20	30		EGEDHN
CCOC(=O)[C@@H]1CCCN(Cc2cccc(OCCCC#N)c2)C1	ZINC000092456197	454568351	/nfs/dbraw/zinc/56/83/51/454568351.db2.gz	WHSBWLZWJBTKDH-QGZVFWFLSA-N	0	3	330.428	3.144	20	30		EGEDHN
CCN1CCCC[C@@H]1C(=O)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000104228886	454579531	/nfs/dbraw/zinc/57/95/31/454579531.db2.gz	GECUHFDPRASMFG-MRXNPFEDSA-N	0	3	338.373	3.048	20	30		EGEDHN
N#CC1(NC(=O)CN[C@@H](c2ccccc2)C2CCC2)CCCCC1	ZINC000104701535	454596342	/nfs/dbraw/zinc/59/63/42/454596342.db2.gz	XFLIFZWHFWCWQI-IBGZPJMESA-N	0	3	325.456	3.460	20	30		EGEDHN
C=C(C)COc1cc(CN2CCC[C@@H](CCC(N)=O)C2)ccc1OC	ZINC000092660748	454603455	/nfs/dbraw/zinc/60/34/55/454603455.db2.gz	PWGBANYKTMYURY-INIZCTEOSA-N	0	3	346.471	3.128	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)CCc2ccc(C#N)cc2)CN1Cc1ccccc1	ZINC000134887928	454604044	/nfs/dbraw/zinc/60/40/44/454604044.db2.gz	LSDSLNAZGJFORA-DYESRHJHSA-N	0	3	347.462	3.270	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1	ZINC000135170343	454640844	/nfs/dbraw/zinc/64/08/44/454640844.db2.gz	OVAXUODHOCJQIF-HXUWFJFHSA-N	0	3	330.472	3.432	20	30		EGEDHN
Cc1cc(C)cc(C(=O)N(CCN(C)C)Cc2cccc(C#N)c2)c1	ZINC000065931258	454640944	/nfs/dbraw/zinc/64/09/44/454640944.db2.gz	NKUVQCQLCCAWAN-UHFFFAOYSA-N	0	3	335.451	3.379	20	30		EGEDHN
Cc1noc(C)c1CNC1CCC(Oc2ccc(C#N)cn2)CC1	ZINC000092854319	454645375	/nfs/dbraw/zinc/64/53/75/454645375.db2.gz	OUDYXDAPKLWHNV-UHFFFAOYSA-N	0	3	326.400	3.038	20	30		EGEDHN
N#Cc1cccc(CN2CCC(C(=O)NC3CCCCC3)CC2)c1	ZINC000065964714	454646816	/nfs/dbraw/zinc/64/68/16/454646816.db2.gz	CPDGMTMJXBOGCY-UHFFFAOYSA-N	0	3	325.456	3.219	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cccc(Br)c2)CC1	ZINC000106040020	454675627	/nfs/dbraw/zinc/67/56/27/454675627.db2.gz	JTJCWBIIIXWFCV-UHFFFAOYSA-N	0	3	337.261	3.219	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Cc2coc3cc(C)ccc23)CC1	ZINC000106040305	454675693	/nfs/dbraw/zinc/67/56/93/454675693.db2.gz	HOVHTSBDVZDHRL-UHFFFAOYSA-N	0	3	326.440	3.440	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCCOc2ccc(C)cc2)CC1	ZINC000106039373	454676153	/nfs/dbraw/zinc/67/61/53/454676153.db2.gz	OUFBONQIRFHWAU-UHFFFAOYSA-N	0	3	330.472	3.311	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1SCCOC(C)C	ZINC000052485700	454677076	/nfs/dbraw/zinc/67/70/76/454677076.db2.gz	JQVVZERGUQWAMN-UHFFFAOYSA-N	0	3	338.521	3.010	20	30		EGEDHN
C=C(C)CN1CCC(NCc2cc([N+](=O)[O-])ccc2OCC)CC1	ZINC000106245438	454687905	/nfs/dbraw/zinc/68/79/05/454687905.db2.gz	KIQSTPGHASWWQD-UHFFFAOYSA-N	0	3	333.432	3.124	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCC[C@H]2Cc2ccccc2)CC1	ZINC000106275110	454689822	/nfs/dbraw/zinc/68/98/22/454689822.db2.gz	NYSSWEXUWRFLHN-FQEVSTJZSA-N	0	3	341.499	3.444	20	30		EGEDHN
C[C@H](CNC(=O)OC(C)(C)C)N(C)Cc1ccc(O[C@@H](C)C#N)cc1	ZINC000093360160	454708643	/nfs/dbraw/zinc/70/86/43/454708643.db2.gz	NVMWOKUSFOTIJF-CABCVRRESA-N	0	3	347.459	3.322	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2CCCC[C@@H]2SCC)CC1	ZINC000176486161	454751059	/nfs/dbraw/zinc/75/10/59/454751059.db2.gz	LAJMKKXYGPQJLG-SJORKVTESA-N	0	3	339.549	3.390	20	30		EGEDHN
CC(C)(C)OC1CCN(CCC(=O)Nc2ccccc2C#N)CC1	ZINC000162352817	454769100	/nfs/dbraw/zinc/76/91/00/454769100.db2.gz	TXYZRGKWCUCMEG-UHFFFAOYSA-N	0	3	329.444	3.166	20	30		EGEDHN
N#Cc1ccc(C(=O)N2CCC[C@@H]2CN2CCCCC2)cc1Cl	ZINC000125934982	454857837	/nfs/dbraw/zinc/85/78/37/454857837.db2.gz	NRNLZCMGSQAWGM-MRXNPFEDSA-N	0	3	331.847	3.302	20	30		EGEDHN
C[C@@H](NCc1cc(C#N)cs1)c1cccc(N2CCOC2=O)c1	ZINC000177691128	454892302	/nfs/dbraw/zinc/89/23/02/454892302.db2.gz	PZFCUAOWCBHTLG-GFCCVEGCSA-N	0	3	327.409	3.427	20	30		EGEDHN
C#CCOc1ccc(CNCc2ccc(CN3CCCC3=O)cc2)cc1	ZINC000113325697	454923398	/nfs/dbraw/zinc/92/33/98/454923398.db2.gz	QDONJCHAWCPRQQ-UHFFFAOYSA-N	0	3	348.446	3.111	20	30		EGEDHN
CC(C)(C#N)CCCN1CCCN(C(=O)Cc2cccc(F)c2)CC1	ZINC000178036550	454929017	/nfs/dbraw/zinc/92/90/17/454929017.db2.gz	HHQUMNFAAHZGJT-UHFFFAOYSA-N	0	3	345.462	3.232	20	30		EGEDHN
CCc1ccc(CC(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)cc1	ZINC000151145992	454943964	/nfs/dbraw/zinc/94/39/64/454943964.db2.gz	GNTHMFIRSZEUOG-UHFFFAOYSA-N	0	3	349.478	3.254	20	30		EGEDHN
CC(=O)Nc1cccc(CN2CCCN(c3ccccc3C#N)CC2)c1	ZINC000170643413	454947391	/nfs/dbraw/zinc/94/73/91/454947391.db2.gz	HUAFHXHNXJATDN-UHFFFAOYSA-N	0	3	348.450	3.229	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2sc(C)cc2OC(F)F)CC1	ZINC000114331228	454951570	/nfs/dbraw/zinc/95/15/70/454951570.db2.gz	ILLFZMFFWXHUQB-UHFFFAOYSA-N	0	3	344.427	3.428	20	30		EGEDHN
Cc1ccc(CN2CCCC2)cc1NC(=O)c1ccc(C#N)c(C)n1	ZINC000178820490	454981201	/nfs/dbraw/zinc/98/12/01/454981201.db2.gz	YDUUAOSRRSDYJZ-UHFFFAOYSA-N	0	3	334.423	3.418	20	30		EGEDHN
C[C@H](NCC(=O)N[C@](C)(C#N)C1CC1)c1ccc2c(c1)CCCC2	ZINC000128214485	455035374	/nfs/dbraw/zinc/03/53/74/455035374.db2.gz	JYCJCNNXCHTENO-VBKZILBWSA-N	0	3	325.456	3.024	20	30		EGEDHN
N#CC(=C([O-])c1ccc(OCC(F)F)nc1)c1nc2ccccc2[nH]1	ZINC000155863653	455054533	/nfs/dbraw/zinc/05/45/33/455054533.db2.gz	VWMFFPFMXAGROL-NSHDSACASA-N	0	3	342.305	3.092	20	30		EGEDHN
N#CC(C(=O)c1ccc(OCC(F)F)nc1)c1nc2ccccc2[nH]1	ZINC000155863653	455054538	/nfs/dbraw/zinc/05/45/38/455054538.db2.gz	VWMFFPFMXAGROL-NSHDSACASA-N	0	3	342.305	3.092	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1	ZINC000155998478	455070773	/nfs/dbraw/zinc/07/07/73/455070773.db2.gz	GREYSIOXCCYYPH-UHFFFAOYSA-N	0	3	332.404	3.065	20	30		EGEDHN
N#CCc1ccccc1C(=O)NC[C@H](c1cccs1)N1CCCC1	ZINC000600966303	460660320	/nfs/dbraw/zinc/66/03/20/460660320.db2.gz	MFOKWXKJJAXRPC-QGZVFWFLSA-N	0	3	339.464	3.381	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)c2ccccc2CC#N)N(C)C)cc1	ZINC000600966355	460661201	/nfs/dbraw/zinc/66/12/01/460661201.db2.gz	MYWKQXXOIYZIAF-HXUWFJFHSA-N	0	3	335.451	3.348	20	30		EGEDHN
CCCCNC(=O)[C@@H]1CC[C@H](C)N(CC#Cc2ccc(F)cc2)C1	ZINC000156357694	455109408	/nfs/dbraw/zinc/10/94/08/455109408.db2.gz	WESXCWKXEJHAEL-FUHWJXTLSA-N	0	3	330.447	3.194	20	30		EGEDHN
C=CC[C@@H](C)NC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C	ZINC000172050793	455113434	/nfs/dbraw/zinc/11/34/34/455113434.db2.gz	WRACTRVAGIUEPV-MRXNPFEDSA-N	0	3	330.476	3.223	20	30		EGEDHN
CCN(CCC#N)C(=O)CN[C@H](c1ccc(Cl)cc1)[C@H]1C[C@@H]1C	ZINC000180035466	455120241	/nfs/dbraw/zinc/12/02/41/455120241.db2.gz	RNQNXTNPDTZERQ-QANKJYHBSA-N	0	3	333.863	3.389	20	30		EGEDHN
N#Cc1ccccc1-c1ccc(CN2CCC[C@@H](OCCO)C2)cc1	ZINC000172303277	455144384	/nfs/dbraw/zinc/14/43/84/455144384.db2.gz	ZWSHFAWAQJTDII-HXUWFJFHSA-N	0	3	336.435	3.199	20	30		EGEDHN
C[C@@](C#N)(NC(=O)CN[C@H](c1ccc(F)cc1)C1CCCC1)C1CC1	ZINC000180283043	455154632	/nfs/dbraw/zinc/15/46/32/455154632.db2.gz	XOZOGUICUFMWKB-PMACEKPBSA-N	0	3	343.446	3.455	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H](CC)c2ccc(OC)cc2)CC1	ZINC000180479688	455178427	/nfs/dbraw/zinc/17/84/27/455178427.db2.gz	OXKLHUBYRRFHER-IBGZPJMESA-N	0	3	330.472	3.346	20	30		EGEDHN
C[C@H](c1ccc(-n2cncn2)cc1)N(C)Cc1ccc(OCC#N)cc1	ZINC000264089153	455190294	/nfs/dbraw/zinc/19/02/94/455190294.db2.gz	FQOKMJFBXXXDAI-MRXNPFEDSA-N	0	3	347.422	3.363	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2ccc(F)c(Cl)c2)CC1	ZINC000264418598	455209447	/nfs/dbraw/zinc/20/94/47/455209447.db2.gz	WENDZNKKAQMFAX-UHFFFAOYSA-N	0	3	339.842	3.319	20	30		EGEDHN
C[C@@H](NCC(=O)Nc1cccc(C#N)c1)c1cccc(-n2cccn2)c1	ZINC000183566570	455306891	/nfs/dbraw/zinc/30/68/91/455306891.db2.gz	JNCGEGZBYKWXHZ-OAHLLOKOSA-N	0	3	345.406	3.033	20	30		EGEDHN
C=CCCCN(C)CC(=O)N[C@H](C)c1ccc(OCC)c(OC)c1	ZINC000265493684	455334656	/nfs/dbraw/zinc/33/46/56/455334656.db2.gz	CVLSOXTYTXOKCM-OAHLLOKOSA-N	0	3	334.460	3.169	20	30		EGEDHN
Cc1ccc([C@@H](C)[NH2+][C@H]2CCN(Cc3ccc(C#N)cc3)C2=O)c([O-])c1	ZINC000190605422	455351847	/nfs/dbraw/zinc/35/18/47/455351847.db2.gz	MEYCQKJYDVGJOW-BEFAXECRSA-N	0	3	349.434	3.024	20	30		EGEDHN
COc1ccc([C@H](C)N[C@H]2CCN(Cc3ccc(C#N)cc3)C2=O)cc1	ZINC000190606085	455352225	/nfs/dbraw/zinc/35/22/25/455352225.db2.gz	PAHFNPOCGIXNCI-YWZLYKJASA-N	0	3	349.434	3.019	20	30		EGEDHN
Cc1ccccc1C[C@@H](C)N[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000190626001	455355863	/nfs/dbraw/zinc/35/58/63/455355863.db2.gz	BJANWHQEERHHGU-DYESRHJHSA-N	0	3	347.462	3.188	20	30		EGEDHN
C[C@@H](N[C@H]1CCN(c2ncccc2F)C1)c1ccc(OCC#N)cc1	ZINC000181884920	455393546	/nfs/dbraw/zinc/39/35/46/455393546.db2.gz	MYHMYHHWFPMNQC-ZBFHGGJFSA-N	0	3	340.402	3.053	20	30		EGEDHN
CCCC[C@@H](NCC(=O)N[C@](C)(C#N)C1CC1)c1ccc(OC)cc1	ZINC000182141108	455445824	/nfs/dbraw/zinc/44/58/24/455445824.db2.gz	VSFZHVKSLSWTKN-UYAOXDASSA-N	0	3	343.471	3.325	20	30		EGEDHN
CCCC[C@H](NCC(=O)N[C@@](C)(C#N)C1CC1)c1ccc(OC)cc1	ZINC000182141052	455445890	/nfs/dbraw/zinc/44/58/90/455445890.db2.gz	VSFZHVKSLSWTKN-ICSRJNTNSA-N	0	3	343.471	3.325	20	30		EGEDHN
C=CCn1c(SC[C@@H]2CCN(C)C2)nnc1-c1ccccc1C	ZINC000191198444	455462789	/nfs/dbraw/zinc/46/27/89/455462789.db2.gz	QGBWUUJIDNEOIS-OAHLLOKOSA-N	0	3	328.485	3.483	20	30		EGEDHN
CC#CCCCC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C	ZINC000184991844	455482621	/nfs/dbraw/zinc/48/26/21/455482621.db2.gz	UCJWWGGPOWFSIZ-UHFFFAOYSA-N	0	3	327.472	3.269	20	30		EGEDHN
C[C@H](N[C@@H](Cc1ccccc1)c1cccs1)C(=O)N(C)CCC#N	ZINC000184988638	455482985	/nfs/dbraw/zinc/48/29/85/455482985.db2.gz	ZRADGRSVSZADEM-RDJZCZTQSA-N	0	3	341.480	3.382	20	30		EGEDHN
C=CCCCC(=O)Nc1ccc(NC(=O)NC2CCN(C)CC2)cc1	ZINC000175723291	455487495	/nfs/dbraw/zinc/48/74/95/455487495.db2.gz	MRZYSTQHPZPFCT-UHFFFAOYSA-N	0	3	344.459	3.197	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1CCC[C@H]1c1cc(C)ccc1C	ZINC000246651774	455514060	/nfs/dbraw/zinc/51/40/60/455514060.db2.gz	ZLSILJBGTPZCPG-APWZRJJASA-N	0	3	327.472	3.449	20	30		EGEDHN
CN(C)Cc1cccc(CNC(=O)c2cccc(SCC#N)c2)c1	ZINC000176008826	455527750	/nfs/dbraw/zinc/52/77/50/455527750.db2.gz	PBQQFRCOKBVLQY-UHFFFAOYSA-N	0	3	339.464	3.294	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1	ZINC000192050931	455548140	/nfs/dbraw/zinc/54/81/40/455548140.db2.gz	QGZJWFAGESDVPQ-BMGDILEWSA-N	0	3	348.874	3.349	20	30		EGEDHN
C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)N[C@H](CCC#N)c1ccccc1	ZINC000247062116	455553790	/nfs/dbraw/zinc/55/37/90/455553790.db2.gz	ZVHAPLBELRWNNV-NXHRZFHOSA-N	0	3	328.460	3.013	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CCCN(Cc2ccccc2)C[C@@H]1C	ZINC000247065783	455554683	/nfs/dbraw/zinc/55/46/83/455554683.db2.gz	RVQRBZOWZZDAHD-ROUUACIJSA-N	0	3	330.472	3.091	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CC[C@@H](c3ccc(F)cc3)C2)CC1	ZINC000267938334	455566641	/nfs/dbraw/zinc/56/66/41/455566641.db2.gz	HXRKUAWWVHVJMP-QGZVFWFLSA-N	0	3	345.462	3.365	20	30		EGEDHN
C[C@@H](NCC(=O)N(CCC#N)c1ccccc1)[C@@H]1COc2ccccc21	ZINC000185600962	455583403	/nfs/dbraw/zinc/58/34/03/455583403.db2.gz	SOJZITFZHARKGB-APWZRJJASA-N	0	3	349.434	3.088	20	30		EGEDHN
CCN(Cc1ccc(CN(C)C)cc1)C(=O)c1ccccc1CC#N	ZINC000601033398	460682361	/nfs/dbraw/zinc/68/23/61/460682361.db2.gz	YNGMTWWFNGYSOJ-UHFFFAOYSA-N	0	3	335.451	3.477	20	30		EGEDHN
C=CC[C@@H](CC)NC(=O)NCc1ccc(OC2CCN(C)CC2)cc1	ZINC000284177477	455647063	/nfs/dbraw/zinc/64/70/63/455647063.db2.gz	KVBFJWBFTHFJIQ-QGZVFWFLSA-N	0	3	345.487	3.314	20	30		EGEDHN
CCN(CC)[C@H](CNc1nccc(C#N)c1[N+](=O)[O-])c1ccsc1	ZINC000268491646	455697044	/nfs/dbraw/zinc/69/70/44/455697044.db2.gz	NUMSFWFEJSXRLR-CQSZACIVSA-N	0	3	345.428	3.418	20	30		EGEDHN
C[C@@H](NC(=O)c1ccc(F)c(C#N)c1)[C@@H](c1ccccc1)N(C)C	ZINC000284594980	455711674	/nfs/dbraw/zinc/71/16/74/455711674.db2.gz	HDWHZVNRSCYSRD-ACJLOTCBSA-N	0	3	325.387	3.119	20	30		EGEDHN
N#C[C@H]1CC[C@@H]([NH+]2CCC(C(=O)Nc3cc(Cl)ccc3[O-])CC2)C1	ZINC000292668547	455727197	/nfs/dbraw/zinc/72/71/97/455727197.db2.gz	AYIIBXIQSBVYFL-SWLSCSKDSA-N	0	3	347.846	3.388	20	30		EGEDHN
CN1CCO[C@H]([C@H](N[C@H]2CCC[C@H](C#N)C2)c2ccc(Cl)cc2)C1	ZINC000248747819	455728260	/nfs/dbraw/zinc/72/82/60/455728260.db2.gz	FPODCTBXHNWGEE-UDTPNQRGSA-N	0	3	347.890	3.384	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)N[C@@H]1CCO[C@H]1c1ccc(Cl)cc1	ZINC000249069794	455743658	/nfs/dbraw/zinc/74/36/58/455743658.db2.gz	QGZJWFAGESDVPQ-QGTPRVQTSA-N	0	3	348.874	3.349	20	30		EGEDHN
CCOC(C)(C)CNCc1cn(CCC#N)nc1-c1ccccc1	ZINC000186537742	455789267	/nfs/dbraw/zinc/78/92/67/455789267.db2.gz	QVBYMWCHVNCYLJ-UHFFFAOYSA-N	0	3	326.444	3.368	20	30		EGEDHN
C[C@H](N[C@H](CO)Cc1c[nH]c2ccccc12)c1ccc(C#N)c(F)c1	ZINC000271929906	455799268	/nfs/dbraw/zinc/79/92/68/455799268.db2.gz	HNUDIACRUXANPN-GUYCJALGSA-N	0	3	337.398	3.433	20	30		EGEDHN
CC[C@@](C)(C#N)C(=O)Nc1ccc(N(C)C2CCN(C)CC2)cc1	ZINC000285178835	455801280	/nfs/dbraw/zinc/80/12/80/455801280.db2.gz	UMJZQAJWDFMAOM-IBGZPJMESA-N	0	3	328.460	3.095	20	30		EGEDHN
C=CCc1cc(CN2CCC[C@@](CO)(C(C)C)C2)cc(OC)c1O	ZINC000293972684	455802517	/nfs/dbraw/zinc/80/25/17/455802517.db2.gz	KGCYIIJYRMHYNW-HXUWFJFHSA-N	0	3	333.472	3.360	20	30		EGEDHN
CC[C@H](N[C@H]1CCCN(CC(F)(F)F)C1=O)c1ccc(C#N)cc1	ZINC000278358542	455829006	/nfs/dbraw/zinc/82/90/06/455829006.db2.gz	BFDYRWXAQVWQTP-GJZGRUSLSA-N	0	3	339.361	3.152	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)[C@@H]1CCCCC1(F)F	ZINC000294856304	455829586	/nfs/dbraw/zinc/82/95/86/455829586.db2.gz	ZTDVKMSKNOZIKJ-KRWDZBQOSA-N	0	3	349.425	3.274	20	30		EGEDHN
CC[C@H](NC[C@H](O)c1cc(OC)cc(OC)c1)c1ccc(C#N)cc1	ZINC000278668003	455843894	/nfs/dbraw/zinc/84/38/94/455843894.db2.gz	JBGBIELILPRZTP-PMACEKPBSA-N	0	3	340.423	3.350	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000278918186	455852982	/nfs/dbraw/zinc/85/29/82/455852982.db2.gz	CRTNOXCTCKYZRH-MTFMMBMASA-N	0	3	342.483	3.137	20	30		EGEDHN
C=CC[C@@H](C(=O)N1CCN(C2CCOCC2)C[C@H]1C)c1ccccc1	ZINC000278898547	455853197	/nfs/dbraw/zinc/85/31/97/455853197.db2.gz	RIGYWYWRDPZPAS-YLJYHZDGSA-N	0	3	342.483	3.058	20	30		EGEDHN
C=CCCCN1CCC(C(=O)OCC)(C(=O)c2ccccc2)CC1	ZINC000295687256	455857034	/nfs/dbraw/zinc/85/70/34/455857034.db2.gz	SIJBQAMIWVRFCR-UHFFFAOYSA-N	0	3	329.440	3.481	20	30		EGEDHN
Cc1noc(C)c1C(=O)C(C(=S)[N-]C(C)(C)C)[n+]1cccc(C)c1	ZINC000186963937	455857221	/nfs/dbraw/zinc/85/72/21/455857221.db2.gz	PAONGLYIQJMATO-UHFFFAOYSA-O	0	3	346.476	3.214	20	30		EGEDHN
C[C@@H](N[C@H](c1ccccc1)C1CC1)C(=O)NC1(C#N)CCCCC1	ZINC000194553074	455857517	/nfs/dbraw/zinc/85/75/17/455857517.db2.gz	MDLVGIGKOSHFIT-CRAIPNDOSA-N	0	3	325.456	3.458	20	30		EGEDHN
Cc1ccc2c(c1)CC[C@H]2NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000279281360	455861600	/nfs/dbraw/zinc/86/16/00/455861600.db2.gz	KGCPJMVFEPEYHE-AZUAARDMSA-N	0	3	329.403	3.353	20	30		EGEDHN
CC[C@H](NCc1ccc(C#N)o1)[C@H](c1ccc(C)cc1)n1cncn1	ZINC000270097927	455876903	/nfs/dbraw/zinc/87/69/03/455876903.db2.gz	LLINSNRMKPQGRB-OALUTQOASA-N	0	3	335.411	3.209	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCCc2cc3ccccc3s2)CC1	ZINC000296309491	455906861	/nfs/dbraw/zinc/90/68/61/455906861.db2.gz	GFSVODMNAIZFPF-UHFFFAOYSA-N	0	3	343.496	3.393	20	30		EGEDHN
C[C@@H](CC(=O)N1CCCCCC1)NC1(c2cccc(C#N)c2)CC1	ZINC000272309097	455909057	/nfs/dbraw/zinc/90/90/57/455909057.db2.gz	SUOGFKYMQDCWQL-INIZCTEOSA-N	0	3	325.456	3.318	20	30		EGEDHN
CN1CCC(N(Cc2ccco2)C(=O)c2ccc(CC#N)cc2)CC1	ZINC000270404353	455948067	/nfs/dbraw/zinc/94/80/67/455948067.db2.gz	GFAXVYRNDSOHKV-UHFFFAOYSA-N	0	3	337.423	3.082	20	30		EGEDHN
CC(C)c1nnc([C@@H](C)[NH2+]C2CCN(c3ccc(C#N)cc3)CC2)[n-]1	ZINC000286000706	455957450	/nfs/dbraw/zinc/95/74/50/455957450.db2.gz	HNKPWYQJHZFVHN-CQSZACIVSA-N	0	3	338.459	3.119	20	30		EGEDHN
CCS[C@@H]1CCC[C@H]1NCC(=O)N(CCC#N)c1ccccc1	ZINC000286205513	455999410	/nfs/dbraw/zinc/99/94/10/455999410.db2.gz	QHNZXVIQVZLGJQ-IAGOWNOFSA-N	0	3	331.485	3.197	20	30		EGEDHN
C[C@@H]1C[C@H](c2ccccc2)[C@H](C)N1CC(=O)N[C@@](C)(C#N)C1CC1	ZINC000296660057	456004228	/nfs/dbraw/zinc/00/42/28/456004228.db2.gz	JVQTUTDWHPSLMD-QIJLZVCCSA-N	0	3	325.456	3.061	20	30		EGEDHN
CC1(C#N)CCN(CCC(=O)N[C@@H]2CCCc3ccccc32)CC1	ZINC000272604499	456009915	/nfs/dbraw/zinc/00/99/15/456009915.db2.gz	RGRXDXQQGYRAKT-GOSISDBHSA-N	0	3	325.456	3.196	20	30		EGEDHN
C=C(C)COc1cccc(NC(=O)N[C@H](C)C2=CCN(C)CC2)c1	ZINC000272630971	456019494	/nfs/dbraw/zinc/01/94/94/456019494.db2.gz	AKXRBHRPQSLCBQ-OAHLLOKOSA-N	0	3	329.444	3.413	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1CN[C@@H](C(=O)N(CC)CC)c1ccccc1	ZINC000280715446	456037156	/nfs/dbraw/zinc/03/71/56/456037156.db2.gz	UKODVGIWKQBFJB-QRVBRYPASA-N	0	3	330.472	3.167	20	30		EGEDHN
Cc1nsc(NCc2ccc(OC3CCN(C)CC3)cc2)c1C#N	ZINC000286452154	456047697	/nfs/dbraw/zinc/04/76/97/456047697.db2.gz	NDOSMOSKSQMGRD-UHFFFAOYSA-N	0	3	342.468	3.408	20	30		EGEDHN
CC(C)Oc1ccc([C@@H](CNC(=O)CC(C)(C)C#N)N(C)C)cc1	ZINC000286836039	456055217	/nfs/dbraw/zinc/05/52/17/456055217.db2.gz	PCAUDEIHXLQCHU-QGZVFWFLSA-N	0	3	331.460	3.133	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N(Cc1ccco1)Cc1cccs1	ZINC000296865858	456055609	/nfs/dbraw/zinc/05/56/09/456055609.db2.gz	KVEAOCWVBQWNNA-UHFFFAOYSA-N	0	3	345.468	3.008	20	30		EGEDHN
C=CCNC(=O)[C@@H](C)N[C@@H](C)c1ccc(Oc2cccnc2)cc1	ZINC000287245353	456064586	/nfs/dbraw/zinc/06/45/86/456064586.db2.gz	PCADSRQITZBOFG-LSDHHAIUSA-N	0	3	325.412	3.215	20	30		EGEDHN
CCCN(CCN1CCCC1)C(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000287366919	456067497	/nfs/dbraw/zinc/06/74/97/456067497.db2.gz	NYDUYBGSBFEIGD-UHFFFAOYSA-N	0	3	327.472	3.436	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)N(C)[C@@H](C)C2CCN(C)CC2)cc1	ZINC000287982235	456083687	/nfs/dbraw/zinc/08/36/87/456083687.db2.gz	HQJGBJFZRFUODC-INIZCTEOSA-N	0	3	345.487	3.123	20	30		EGEDHN
C=C[C@](C)(CCOC)c1nc(-c2ccccc2OCCN(C)C)no1	ZINC000289013516	456111585	/nfs/dbraw/zinc/11/15/85/456111585.db2.gz	KMDBOOQZJIRGSO-LJQANCHMSA-N	0	3	345.443	3.157	20	30		EGEDHN
COc1ccc2c(c1)C1(CC1)CN(C[C@@H](O)c1ccc(C#N)cc1)C2	ZINC000289661803	456135236	/nfs/dbraw/zinc/13/52/36/456135236.db2.gz	UJBZQCMQLQVSER-HXUWFJFHSA-N	0	3	334.419	3.148	20	30		EGEDHN
N#Cc1cc(Cl)ccc1NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000273048496	456158888	/nfs/dbraw/zinc/15/88/88/456158888.db2.gz	BFQCBRAVGLIXBL-GOSISDBHSA-N	0	3	341.842	3.390	20	30		EGEDHN
C[C@@](C#N)(NC(=O)CN[C@@H]1CC(C)(C)CCc2ccccc21)C1CC1	ZINC000333272923	456189758	/nfs/dbraw/zinc/18/97/58/456189758.db2.gz	HPKBLIFBJRTXRR-NQIIRXRSSA-N	0	3	339.483	3.488	20	30		EGEDHN
C=C[C@H](CO)N[C@H]1CCCc2c3cc(Br)ccc3[nH]c21	ZINC000289991907	456208887	/nfs/dbraw/zinc/20/88/87/456208887.db2.gz	YNFJUYOGLXQXDY-ABAIWWIYSA-N	0	3	335.245	3.444	20	30		EGEDHN
COc1cc(Br)c(CNCCCCC#N)cc1OC	ZINC000237075427	456227009	/nfs/dbraw/zinc/22/70/09/456227009.db2.gz	CWTHOBPXKXBGFD-UHFFFAOYSA-N	0	3	327.222	3.250	20	30		EGEDHN
COc1ccccc1O[C@H](C)CNCc1ccc(C#N)c(OC)c1	ZINC000281652205	456283329	/nfs/dbraw/zinc/28/33/29/456283329.db2.gz	KBXZUCUDUKZNEX-CQSZACIVSA-N	0	3	326.396	3.133	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](CC)CNc2ccccc2)CC1	ZINC000297851642	456309770	/nfs/dbraw/zinc/30/97/70/456309770.db2.gz	ZQIXTXOEAMPFBK-KRWDZBQOSA-N	0	3	344.503	3.217	20	30		EGEDHN
CC1(C)CN(C[C@H](O)COc2ccc(C#N)cc2)Cc2ccccc21	ZINC000340240081	456334542	/nfs/dbraw/zinc/33/45/42/456334542.db2.gz	RCPSXUBDBVWOKV-SFHVURJKSA-N	0	3	336.435	3.091	20	30		EGEDHN
CCN(CCOc1ccccc1C#N)C[C@H]1COc2ccccc2O1	ZINC000342996994	456344589	/nfs/dbraw/zinc/34/45/89/456344589.db2.gz	WRKYLSCRBAEKDB-KRWDZBQOSA-N	0	3	338.407	3.099	20	30		EGEDHN
CCC(O)(CC)CCNCc1ccc(OC)c(OCCCC#N)c1	ZINC000276182613	456408054	/nfs/dbraw/zinc/40/80/54/456408054.db2.gz	FMVNJDWGFREXEW-UHFFFAOYSA-N	0	3	334.460	3.409	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2c(C)cc(OC)c(C)c2C)CC1	ZINC000352931641	456421232	/nfs/dbraw/zinc/42/12/32/456421232.db2.gz	XEBZJZKWJHOHEO-UHFFFAOYSA-N	0	3	331.460	3.392	20	30		EGEDHN
CN(C[C@@H](O)COc1ccc(Oc2ccc(C#N)cc2)cc1)C1CC1	ZINC000290797466	456431270	/nfs/dbraw/zinc/43/12/70/456431270.db2.gz	PBYXIUNQYVPKEE-QGZVFWFLSA-N	0	3	338.407	3.184	20	30		EGEDHN
C[C@H](C#N)CSc1ccccc1NC(=O)N1CCN(C)CC[C@H]1C	ZINC000340385840	456431550	/nfs/dbraw/zinc/43/15/50/456431550.db2.gz	YUNUXLFWOZSYLM-HUUCEWRRSA-N	0	3	346.500	3.496	20	30		EGEDHN
C=CCOCCCN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000348039282	456442705	/nfs/dbraw/zinc/44/27/05/456442705.db2.gz	CPWLLSDDXBECSW-KRWDZBQOSA-N	0	3	342.439	3.220	20	30		EGEDHN
CCn1cc([C@@H](C)NCCC(=O)Nc2ccc(C#N)c(Cl)c2)cn1	ZINC000298453339	456461551	/nfs/dbraw/zinc/46/15/51/456461551.db2.gz	RDTLZVOKJVHOCL-GFCCVEGCSA-N	0	3	345.834	3.107	20	30		EGEDHN
CCCN(C)[C@@H](CNc1nccnc1C#N)c1ccc(Cl)cc1	ZINC000343223411	456462655	/nfs/dbraw/zinc/46/26/55/456462655.db2.gz	GXVKZGJBINLGCC-INIZCTEOSA-N	0	3	329.835	3.497	20	30		EGEDHN
Cc1noc(C)c1C(C)(C)NCCC(=O)Nc1ccccc1C#N	ZINC000298499681	456473172	/nfs/dbraw/zinc/47/31/72/456473172.db2.gz	JZTRNNFQJULFIJ-UHFFFAOYSA-N	0	3	326.400	3.017	20	30		EGEDHN
CC(C)(C)[C@H]1NC(=O)CC[C@@H]1NCc1cccc(OCCCC#N)c1	ZINC000353116039	456500242	/nfs/dbraw/zinc/50/02/42/456500242.db2.gz	ZJLSNPHXUWNTHN-HKUYNNGSSA-N	0	3	343.471	3.152	20	30		EGEDHN
C[C@@H](NC(=O)NC[C@H](C)N1CCC[C@@H](C)C1)c1ccc(C#N)cc1	ZINC000298614028	456501416	/nfs/dbraw/zinc/50/14/16/456501416.db2.gz	MUAXUOLHFPYRSF-OWCLPIDISA-N	0	3	328.460	3.039	20	30		EGEDHN
C=CCCC[C@@H](C)NC(=O)Nc1cc(C)nn1C1CCN(C)CC1	ZINC000343318352	456528034	/nfs/dbraw/zinc/52/80/34/456528034.db2.gz	GPYJXOYIUSRIOO-CQSZACIVSA-N	0	3	333.480	3.325	20	30		EGEDHN
C=CCCC[C@H](C)NC(=O)Nc1cc(C)nn1C1CCN(C)CC1	ZINC000343318351	456528121	/nfs/dbraw/zinc/52/81/21/456528121.db2.gz	GPYJXOYIUSRIOO-AWEZNQCLSA-N	0	3	333.480	3.325	20	30		EGEDHN
CN(CC(C)(C)C#N)C(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F	ZINC000353165444	456533556	/nfs/dbraw/zinc/53/35/56/456533556.db2.gz	TWWLRLDKCZRYOK-MRXNPFEDSA-N	0	3	349.425	3.152	20	30		EGEDHN
C=CCn1c(C2CCC2)nnc1N1CCN(C2CCC(C)CC2)CC1	ZINC000337828319	456567512	/nfs/dbraw/zinc/56/75/12/456567512.db2.gz	XRKBAPYMMCZMSN-UHFFFAOYSA-N	0	3	343.519	3.432	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1	ZINC000337877280	456582703	/nfs/dbraw/zinc/58/27/03/456582703.db2.gz	RLNBDJNMVMKTPG-LPHOPBHVSA-N	0	3	333.435	3.432	20	30		EGEDHN
Cc1nccn1CCNCc1cccc(OCc2ccccc2C#N)c1	ZINC000343415209	456604508	/nfs/dbraw/zinc/60/45/08/456604508.db2.gz	VZACYIHHJHJALO-UHFFFAOYSA-N	0	3	346.434	3.432	20	30		EGEDHN
C[C@@H](CNC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)N(C)C	ZINC000299330735	456658568	/nfs/dbraw/zinc/65/85/68/456658568.db2.gz	QXYZMNKPSOGPBZ-AWEZNQCLSA-N	0	3	338.411	3.422	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@@H](NCc1cccc(N3CCCC3=O)c1)CC2	ZINC000353421791	456690068	/nfs/dbraw/zinc/69/00/68/456690068.db2.gz	AQALUYSDNCBKAJ-FQEVSTJZSA-N	0	3	331.419	3.462	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H](NCc2ccc(C#N)o2)C(C)(C)C1	ZINC000283129288	456718196	/nfs/dbraw/zinc/71/81/96/456718196.db2.gz	ZOYYNJQSOKAOKS-HNNXBMFYSA-N	0	3	333.432	3.276	20	30		EGEDHN
N#Cc1cccc(NC(=O)CN[C@@H]2CCC[C@H]2OCc2ccccc2)c1	ZINC000348520354	456732296	/nfs/dbraw/zinc/73/22/96/456732296.db2.gz	JFHKYVWUWKZUNX-WOJBJXKFSA-N	0	3	349.434	3.224	20	30		EGEDHN
Cc1nc(NC(=O)[C@H](C)N[C@@H]2CCC(=O)NC23CCC3)sc1C	ZINC000328703720	456741005	/nfs/dbraw/zinc/74/10/05/456741005.db2.gz	OIQNBUUMTWVJLC-CMPLNLGQSA-N	0	3	336.461	3.368	20	30		EGEDHN
CN(C)[C@H](CNC(=O)Nc1ccc(C#N)c(F)c1)c1ccccc1	ZINC000353537415	456742355	/nfs/dbraw/zinc/74/23/55/456742355.db2.gz	DOGXZEGWYWFEJR-QGZVFWFLSA-N	0	3	326.375	3.122	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000283381548	456769316	/nfs/dbraw/zinc/76/93/16/456769316.db2.gz	CWTIUEIAEVNWSU-LJQANCHMSA-N	0	3	333.435	3.152	20	30		EGEDHN
CNC(=O)[C@@H]1CCC[C@@H]1N[C@@H]1CCCN(c2ccccc2Cl)C1=O	ZINC000328929472	456793602	/nfs/dbraw/zinc/79/36/02/456793602.db2.gz	AFMTXNQJMJQBAW-VHDGCEQUSA-N	0	3	349.862	3.180	20	30		EGEDHN
O=C(CN[C@@H]1CCC(=O)N[C@@H]1C1CC1)Nc1nc2c(s1)CCCC2	ZINC000328930634	456794208	/nfs/dbraw/zinc/79/42/08/456794208.db2.gz	ZDDRZRKGDASOKJ-MLGOLLRUSA-N	0	3	348.472	3.097	20	30		EGEDHN
C[C@@H](C(=O)N(CCC#N)c1ccccc1)N1CCC[C@@H](C2CC2)C1	ZINC000344079392	456794468	/nfs/dbraw/zinc/79/44/68/456794468.db2.gz	YDZSERJWKPMNOK-FUHWJXTLSA-N	0	3	325.456	3.444	20	30		EGEDHN
COc1cc2c(cc1OC)[C@@H](NCc1ccc(C#N)c(OC)c1)CC2	ZINC000353615703	456804335	/nfs/dbraw/zinc/80/43/35/456804335.db2.gz	ZQBJMLJSPDXTAZ-KRWDZBQOSA-N	0	3	338.407	3.361	20	30		EGEDHN
Cc1nc([C@H]2CCCOC2)sc1C(=O)NCC1(N(C)C)CCC1	ZINC000329014133	456814388	/nfs/dbraw/zinc/81/43/88/456814388.db2.gz	PQGUMGOZSZPHLJ-ZDUSSCGKSA-N	0	3	337.489	3.134	20	30		EGEDHN
CCc1nc2cc(CNCc3cc(C#N)n(C)c3)ccc2n1C1CC1	ZINC000338443474	456823381	/nfs/dbraw/zinc/82/33/81/456823381.db2.gz	LCEKFTFVIHPMSL-UHFFFAOYSA-N	0	3	333.439	3.434	20	30		EGEDHN
Cc1noc2nc(C(C)C)cc(C(=O)N[C@@H]3CCN(C4CC4)C3)c12	ZINC000329081882	456831260	/nfs/dbraw/zinc/83/12/60/456831260.db2.gz	RWSRXQLKKOGCIN-GFCCVEGCSA-N	0	3	328.416	3.196	20	30		EGEDHN
Cc1ccc([C@@H](CNc2cc(N)c([N+](=O)[O-])c(C#N)c2)N(C)C)cc1	ZINC000283792823	456840502	/nfs/dbraw/zinc/84/05/02/456840502.db2.gz	SICXCLHSOQRZJH-QGZVFWFLSA-N	0	3	339.399	3.072	20	30		EGEDHN
C=C(CNC(=O)N1CCN(C2CCC2)C[C@@H](C)C1)c1ccccc1	ZINC000292049532	456840943	/nfs/dbraw/zinc/84/09/43/456840943.db2.gz	NMDAVJCFGSXTRU-MRXNPFEDSA-N	0	3	327.472	3.216	20	30		EGEDHN
C=C(CNC(=O)Nc1cccc(OCCN(C)C)c1)c1ccccc1	ZINC000348795025	456858979	/nfs/dbraw/zinc/85/89/79/456858979.db2.gz	PIGVFKKQEWIRBT-UHFFFAOYSA-N	0	3	339.439	3.462	20	30		EGEDHN
C=CCN(CCc1ccco1)C(=O)NCc1ccc(CN(C)C)cc1	ZINC000353701209	456861606	/nfs/dbraw/zinc/86/16/06/456861606.db2.gz	KXSWTFMMSOLTBR-UHFFFAOYSA-N	0	3	341.455	3.282	20	30		EGEDHN
N#CC(=C([O-])c1cnn(CCF)c1)c1nc2ccccc2n1C(F)F	ZINC000344854892	456868558	/nfs/dbraw/zinc/86/85/58/456868558.db2.gz	RNQAWTWJNCPKQL-LLVKDONJSA-N	0	3	347.300	3.087	20	30		EGEDHN
N#CC(C(=O)c1cnn(CCF)c1)c1nc2ccccc2n1C(F)F	ZINC000344854892	456868561	/nfs/dbraw/zinc/86/85/61/456868561.db2.gz	RNQAWTWJNCPKQL-LLVKDONJSA-N	0	3	347.300	3.087	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H]2C[C@H]2c2c(F)cccc2F)CC1	ZINC000341596688	456879669	/nfs/dbraw/zinc/87/96/69/456879669.db2.gz	DJMJUBRWYNZXPT-PBHICJAKSA-N	0	3	349.425	3.160	20	30		EGEDHN
C[C@H](c1ccncc1)N1CCC(NC(=O)[C@@H]2CC(=O)N[C@H](C)C2)CC1	ZINC000329404889	456885848	/nfs/dbraw/zinc/88/58/48/456885848.db2.gz	CLGCISSHVVLLPG-FMKPAKJESA-N	0	3	344.459	3.319	20	30		EGEDHN
Cc1nnc([C@@H]2CCCN([C@H](C)C(=O)N[C@@H]3CCCC[C@H]3C)C2)[nH]1	ZINC000329452541	456893420	/nfs/dbraw/zinc/89/34/20/456893420.db2.gz	NIZOXERUUBQOFF-RRCSTGOVSA-N	0	3	333.480	3.216	20	30		EGEDHN
CC(C#N)C(=O)N1CCC[C@@H]1c1cc(F)cc(Br)c1	ZINC000345004792	456893611	/nfs/dbraw/zinc/89/36/11/456893611.db2.gz	QXSFTFFCIWGJNL-NOZJJQNGSA-N	0	3	325.181	3.411	20	30		EGEDHN
CCSc1ccc([C@@H](C)N[C@@H](C)C(=O)NC2(C#N)CCC2)cc1	ZINC000345110331	456929391	/nfs/dbraw/zinc/92/93/91/456929391.db2.gz	IDLUOCHURMEEKD-KGLIPLIRSA-N	0	3	331.485	3.400	20	30		EGEDHN
CC(C)[C@@H](C(=O)NCC(=O)N(C)C1CCCCC1)N1CCCCC1	ZINC000329775618	456938829	/nfs/dbraw/zinc/93/88/29/456938829.db2.gz	NEHKCWMMXRRXDM-SFHVURJKSA-N	0	3	337.508	3.245	20	30		EGEDHN
C[C@@H]1CC[C@@H](C)N1CC(=O)N1CCC(NC(=O)CC2CCCC2)CC1	ZINC000329878783	456955018	/nfs/dbraw/zinc/95/50/18/456955018.db2.gz	LGTUMURVKCSMPH-HZPDHXFCSA-N	0	3	349.519	3.387	20	30		EGEDHN
[O-]C(=[NH+]C[C@@H]1CCc2nccn2C1)N1CCC[C@@]2(CC=CCC2)C1	ZINC000329965596	456968179	/nfs/dbraw/zinc/96/81/79/456968179.db2.gz	UKFLXBLRVGOPHN-LPHOPBHVSA-N	0	3	328.460	3.182	20	30		EGEDHN
Cc1ncoc1C(=O)N[C@@H]1CC2(CCN(C)CC2)Oc2ccccc21	ZINC000329985495	456970913	/nfs/dbraw/zinc/97/09/13/456970913.db2.gz	DIBORRYDIDXQPZ-OAHLLOKOSA-N	0	3	341.411	3.276	20	30		EGEDHN
CC(C(=O)N[C@H]1CCC(C)(C)C[C@H]1C)S(=O)(=O)C1CCOCC1	ZINC000330071992	456981555	/nfs/dbraw/zinc/98/15/55/456981555.db2.gz	JIWKDPBWVLLUNW-IPYPFGDCSA-N	0	3	345.505	3.140	20	30		EGEDHN
CCN(CCNC(=O)c1cn(CCCC#N)c2ccccc12)C1CC1	ZINC000345761921	456991772	/nfs/dbraw/zinc/99/17/72/456991772.db2.gz	HDRBNLGOFSUVGT-UHFFFAOYSA-N	0	3	338.455	3.159	20	30		EGEDHN
C[C@@H]1CCc2c(F)cccc2[C@@H]1NC(=O)N[C@H]1CCn2ccnc2C1	ZINC000330187980	456998502	/nfs/dbraw/zinc/99/85/02/456998502.db2.gz	KUQGWMZEAJMXKC-FHSNZYRGSA-N	0	3	342.418	3.164	20	30		EGEDHN
C=C(C)COc1cc(CN[C@H](CC)[C@@H](O)C(F)(F)F)ccc1OC	ZINC000345859335	457002213	/nfs/dbraw/zinc/00/22/13/457002213.db2.gz	SGUAHLLOLBPUQZ-CZUORRHYSA-N	0	3	347.377	3.442	20	30		EGEDHN
CNC(=O)[C@@H]1CCC[C@@H]1NCc1cccc(C(=O)N2CCCCC2)c1	ZINC000330232673	457008967	/nfs/dbraw/zinc/00/89/67/457008967.db2.gz	FPLXXPFKHHZBEC-MSOLQXFVSA-N	0	3	343.471	3.157	20	30		EGEDHN
C[C@@H]1CCCN(CCNC(=O)N[C@H]2CCOC3(CCCCC3)C2)C1	ZINC000330257344	457014023	/nfs/dbraw/zinc/01/40/23/457014023.db2.gz	LKPQABMNODQICL-SJORKVTESA-N	0	3	337.508	3.104	20	30		EGEDHN
Cc1ccccc1[C@@H]1CCN([C@@H](C)C(=O)NC(=O)NC(C)(C)C)C1	ZINC000330414493	457040578	/nfs/dbraw/zinc/04/05/78/457040578.db2.gz	NDMJLSIKOTXYOX-LSDHHAIUSA-N	0	3	331.460	3.002	20	30		EGEDHN
CNC(=O)c1cccc(NC(=O)[C@H](C(C)C)N2CCCCC2)c1C	ZINC000330609414	457061230	/nfs/dbraw/zinc/06/12/30/457061230.db2.gz	RZWDMCFRYAWUFW-KRWDZBQOSA-N	0	3	331.460	3.378	20	30		EGEDHN
CN(C(=O)C(C#N)CCc1ccccc1)[C@H](CCO)c1ccccc1	ZINC000339352576	457064353	/nfs/dbraw/zinc/06/43/53/457064353.db2.gz	NZSZAIQXTABCQV-VQTJNVASSA-N	0	3	336.435	3.341	20	30		EGEDHN
Cc1cccc(CN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)n1	ZINC000346640039	457085624	/nfs/dbraw/zinc/08/56/24/457085624.db2.gz	IISXHLXHWNMGHZ-UHFFFAOYSA-N	0	3	334.423	3.112	20	30		EGEDHN
CC(C)Oc1c(F)cc(NC(=O)NC2CCN(C)CC2)cc1F	ZINC000330817401	457088927	/nfs/dbraw/zinc/08/89/27/457088927.db2.gz	LVCMDFLRBNHYSE-UHFFFAOYSA-N	0	3	327.375	3.172	20	30		EGEDHN
C=CC[C@H](CC)NC(=O)NCc1ccc(OCCN2CCCC2)cc1	ZINC000359679010	457112028	/nfs/dbraw/zinc/11/20/28/457112028.db2.gz	NKDGYXMXDFUHHC-SFHVURJKSA-N	0	3	345.487	3.315	20	30		EGEDHN
Cc1nsc(NCc2ccc(OCCN3CCCC3)cc2)c1C#N	ZINC000342196662	457162699	/nfs/dbraw/zinc/16/26/99/457162699.db2.gz	DFVMXJPYIMMFTL-UHFFFAOYSA-N	0	3	342.468	3.410	20	30		EGEDHN
CC(C)CN(Cc1ccc(C#N)cc1)Cc1cc(=O)n2ccccc2n1	ZINC000346783026	457167723	/nfs/dbraw/zinc/16/77/23/457167723.db2.gz	VNQZRKKEUWMCLM-UHFFFAOYSA-N	0	3	346.434	3.224	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)[C@H](C)C#N)c1ccc(C(F)(F)F)cc1	ZINC000347038429	457197636	/nfs/dbraw/zinc/19/76/36/457197636.db2.gz	OZZAZISMZWDNOL-IUODEOHRSA-N	0	3	341.377	3.364	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N(C)[C@H](C)C2CCC2)cc1	ZINC000350917005	457212370	/nfs/dbraw/zinc/21/23/70/457212370.db2.gz	GNYXYVAHDHWUNN-QWHCGFSZSA-N	0	3	349.456	3.025	20	30		EGEDHN
C=CCN(C[C@H]1CCC(C)(C)O1)[C@H](C)c1cccc(-n2cnnn2)c1	ZINC000360072004	457238503	/nfs/dbraw/zinc/23/85/03/457238503.db2.gz	NZQIRZYOKMGXCB-CRAIPNDOSA-N	0	3	341.459	3.169	20	30		EGEDHN
C[C@@H](CNC(=O)C(C)(C)Oc1ccc(C#N)cc1)N1CCCC[C@@H]1C	ZINC000360073257	457240414	/nfs/dbraw/zinc/24/04/14/457240414.db2.gz	UXDAGOWYTGDPFP-HOTGVXAUSA-N	0	3	343.471	3.095	20	30		EGEDHN
C=CCN(C(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F)C1CC1	ZINC000354465478	457240639	/nfs/dbraw/zinc/24/06/39/457240639.db2.gz	XYKFDTKHRHLHME-QGZVFWFLSA-N	0	3	334.410	3.321	20	30		EGEDHN
C[C@H](C#N)CSc1ccccc1NC(=O)CSCCN(C)C	ZINC000339742267	457244056	/nfs/dbraw/zinc/24/40/56/457244056.db2.gz	JYSIYMUTMSSOFH-CYBMUJFWSA-N	0	3	337.514	3.172	20	30		EGEDHN
CC(C#N)C(=O)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1	ZINC000347139676	457251429	/nfs/dbraw/zinc/25/14/29/457251429.db2.gz	SJPYTCYIOOHPNM-YPMHNXCESA-N	0	3	344.802	3.256	20	30		EGEDHN
C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)CN1[C@H](C)CC[C@@H]1C	ZINC000342455163	457312913	/nfs/dbraw/zinc/31/29/13/457312913.db2.gz	CXYLTLODRRDEMH-CALCHBBNSA-N	0	3	332.492	3.242	20	30		EGEDHN
CC1(C)CCCN(CCNC(=O)C[C@@H](CC#N)c2ccccc2)C1	ZINC000357112844	457329695	/nfs/dbraw/zinc/32/96/95/457329695.db2.gz	DKYNRJGRRNQGHN-GOSISDBHSA-N	0	3	327.472	3.312	20	30		EGEDHN
CO[C@]1(C)CCCN([C@@H](C)C(=O)N(CCC#N)c2ccccc2)CC1	ZINC000332350494	457352974	/nfs/dbraw/zinc/35/29/74/457352974.db2.gz	URPXOTHSWFHZPC-FXAWDEMLSA-N	0	3	343.471	3.213	20	30		EGEDHN
N#CC(C(=O)c1ccc2nc(C(F)(F)F)cn2c1)c1ccccn1	ZINC000352308810	457354259	/nfs/dbraw/zinc/35/42/59/457354259.db2.gz	LRUAJQQJDCOQSJ-LLVKDONJSA-N	0	3	330.269	3.238	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1)OCC	ZINC000425002667	457400501	/nfs/dbraw/zinc/40/05/01/457400501.db2.gz	GSTTXPOUESGFQJ-XUVXKRRUSA-N	0	3	342.483	3.091	20	30		EGEDHN
C=CCCC1(C(=O)N(C)C[C@H]2CCN(C)[C@@H]2c2cccnc2)CC1	ZINC000356088777	457446806	/nfs/dbraw/zinc/44/68/06/457446806.db2.gz	JPIHQTBCJMNXTL-QZTJIDSGSA-N	0	3	327.472	3.279	20	30		EGEDHN
CCO[C@@H]1C[C@H](NCc2cccc(OCCCC#N)c2)[C@]12CCCO2	ZINC000363979898	457470374	/nfs/dbraw/zinc/47/03/74/457470374.db2.gz	OWKJGAZSGHDZEH-XUVXKRRUSA-N	0	3	344.455	3.185	20	30		EGEDHN
CCO[C@@H]1C[C@@H](NCc2cccc(OCCCC#N)c2)[C@]12CCCO2	ZINC000363979897	457471127	/nfs/dbraw/zinc/47/11/27/457471127.db2.gz	OWKJGAZSGHDZEH-VAMGGRTRSA-N	0	3	344.455	3.185	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)C1(C#N)CCCC1	ZINC000398171761	457497338	/nfs/dbraw/zinc/49/73/38/457497338.db2.gz	PAGFWIDHMUXMCJ-AEFFLSMTSA-N	0	3	325.456	3.097	20	30		EGEDHN
COc1cc(CN2CC3(CCC3)[C@@H]2C2CCOCC2)ccc1C#N	ZINC000425367308	457522993	/nfs/dbraw/zinc/52/29/93/457522993.db2.gz	BXDDHABVQWJKIP-IBGZPJMESA-N	0	3	326.440	3.348	20	30		EGEDHN
COc1cc(CN2CC3(CCC3)[C@H]2C2CCOCC2)ccc1C#N	ZINC000425367311	457523062	/nfs/dbraw/zinc/52/30/62/457523062.db2.gz	BXDDHABVQWJKIP-LJQANCHMSA-N	0	3	326.440	3.348	20	30		EGEDHN
CCNC(=O)C[C@H]1CCCCN1Cc1cccc(OCCCC#N)c1	ZINC000342825010	457543130	/nfs/dbraw/zinc/54/31/30/457543130.db2.gz	QFCUKPNTTXFFKE-GOSISDBHSA-N	0	3	343.471	3.250	20	30		EGEDHN
C[C@H](CNC(=O)N(C)[C@H](C)c1cccc(C#N)c1)N1CCC(C)CC1	ZINC000425471299	457567407	/nfs/dbraw/zinc/56/74/07/457567407.db2.gz	HVZJCWGIWSEKME-IAGOWNOFSA-N	0	3	342.487	3.381	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@H](C)N1CC2(CCC2)[C@@H]1C1CCOCC1	ZINC000425555622	457596155	/nfs/dbraw/zinc/59/61/55/457596155.db2.gz	QYNYXQZHUUVNEO-WMZOPIPTSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC3(CCC3)c3ccccc32)CC1	ZINC000364480505	457619662	/nfs/dbraw/zinc/61/96/62/457619662.db2.gz	QGAQDQIBSGNIBK-UHFFFAOYSA-N	0	3	325.456	3.288	20	30		EGEDHN
CC(C)[C@@H]1CN(Cc2ccc(C#N)cc2C(F)(F)F)CCN1C	ZINC000356430704	457621491	/nfs/dbraw/zinc/62/14/91/457621491.db2.gz	RPYGOSKJWVZZTG-INIZCTEOSA-N	0	3	325.378	3.349	20	30		EGEDHN
C=CCN(CCc1ccccc1)Cc1cc(C(=O)OC)c(C)n1C	ZINC000361185827	457635860	/nfs/dbraw/zinc/63/58/60/457635860.db2.gz	IUCVNIUGZJJFSK-UHFFFAOYSA-N	0	3	326.440	3.351	20	30		EGEDHN
N#CC(C(=O)c1ccc(OC(F)F)cn1)c1nc2ccccc2[nH]1	ZINC000357777527	457685669	/nfs/dbraw/zinc/68/56/69/457685669.db2.gz	DWTWORQSPNYECQ-JTQLQIEISA-N	0	3	328.278	3.049	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)N[C@@H](C)[C@H](c1ccccc1C)N(C)C	ZINC000357859386	457714421	/nfs/dbraw/zinc/71/44/21/457714421.db2.gz	VMIVHGSSNQCXQF-SCLBCKFNSA-N	0	3	325.412	3.189	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN(CC)CC2CCC2)cc1	ZINC000361485903	457747858	/nfs/dbraw/zinc/74/78/58/457747858.db2.gz	PLLONDLFKPMLOX-UHFFFAOYSA-N	0	3	343.471	3.454	20	30		EGEDHN
C[C@H](CNC(=O)Nc1ccc(C#N)cc1Cl)N1CCC(C)CC1	ZINC000426165638	457780872	/nfs/dbraw/zinc/78/08/72/457780872.db2.gz	ZXRJJLDRIVOXDP-CYBMUJFWSA-N	0	3	334.851	3.454	20	30		EGEDHN
CN(C)[C@@H](CNC(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1)c1ccccc1	ZINC000411150201	457813659	/nfs/dbraw/zinc/81/36/59/457813659.db2.gz	YYRIZJGDRNJELD-ZCNNSNEGSA-N	0	3	333.435	3.081	20	30		EGEDHN
CCc1nc(CCNC(=O)C(C#N)CCc2ccccc2)cs1	ZINC000433343637	457815043	/nfs/dbraw/zinc/81/50/43/457815043.db2.gz	OQQRKFXDVOXIRK-OAHLLOKOSA-N	0	3	327.453	3.137	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2cnc(-c3ccccc3)nc2C)nc(C)n1	ZINC000361670649	457815584	/nfs/dbraw/zinc/81/55/84/457815584.db2.gz	KNINSTWHUOQRFM-INIZCTEOSA-N	0	3	343.390	3.349	20	30		EGEDHN
CN(CCOCc1ccccc1)C(=O)C(C#N)CCc1ccccc1	ZINC000433379505	457824616	/nfs/dbraw/zinc/82/46/16/457824616.db2.gz	VAFWXAPOBOLOQL-HXUWFJFHSA-N	0	3	336.435	3.434	20	30		EGEDHN
Cc1cc(CNCCOc2ccc(C(F)(F)F)cn2)ccc1C#N	ZINC000443993039	457836118	/nfs/dbraw/zinc/83/61/18/457836118.db2.gz	IGYBDKBQWHFGDN-UHFFFAOYSA-N	0	3	335.329	3.449	20	30		EGEDHN
CN1CC[C@]2(CCN(C(=O)Nc3ccc(C(C)(C)C#N)cc3)C2)C1	ZINC000366632433	457873764	/nfs/dbraw/zinc/87/37/64/457873764.db2.gz	SOABPOHPPDSYGJ-IBGZPJMESA-N	0	3	326.444	3.047	20	30		EGEDHN
CC(C)(CC#N)CNC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000457987446	457892403	/nfs/dbraw/zinc/89/24/03/457892403.db2.gz	KHTADLQHIGTBCX-INIZCTEOSA-N	0	3	331.435	3.094	20	30		EGEDHN
CNS(=O)(=O)c1cccc([C@H](C)NCCC2(C#N)CCCCC2)c1	ZINC000411463981	457895109	/nfs/dbraw/zinc/89/51/09/457895109.db2.gz	MBXHBRRMBBNORV-HNNXBMFYSA-N	0	3	349.500	3.109	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc(C)c(NC(C)=O)c2)CC1	ZINC000358355077	457954020	/nfs/dbraw/zinc/95/40/20/457954020.db2.gz	RMGKTDTYSRAQBR-UHFFFAOYSA-N	0	3	344.459	3.115	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NC(=O)NCC(C)(C)N[C@H](C)c1ccccc1	ZINC000458374363	458027372	/nfs/dbraw/zinc/02/73/72/458027372.db2.gz	OJGJLIGITBAFCS-NXHRZFHOSA-N	0	3	345.487	3.149	20	30		EGEDHN
C[C@@H]1CN(CC2CCN(Cc3cccc(F)c3C#N)CC2)C[C@H](C)O1	ZINC000428240399	458104850	/nfs/dbraw/zinc/10/48/50/458104850.db2.gz	IPLAYXPAEBNQLE-IYBDPMFKSA-N	0	3	345.462	3.019	20	30		EGEDHN
Cc1ccc([O-])c([C@H](C)[NH2+]C2CCN(c3ccc(C#N)cn3)CC2)c1	ZINC000371877500	458105696	/nfs/dbraw/zinc/10/56/96/458105696.db2.gz	WRFQPRRDGOXBHD-HNNXBMFYSA-N	0	3	336.439	3.287	20	30		EGEDHN
CC(C)[C@@H](CC(F)(F)F)NCC(=O)N(C)C1(C#N)CCCCC1	ZINC000445887466	458111093	/nfs/dbraw/zinc/11/10/93/458111093.db2.gz	QMFPYQVFMTWGDP-CYBMUJFWSA-N	0	3	333.398	3.238	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H]([C@@H](C)CC)C(F)(F)F)CC1	ZINC000446291772	458172204	/nfs/dbraw/zinc/17/22/04/458172204.db2.gz	BZEQDNMQSPYXIF-GXTWGEPZSA-N	0	3	335.414	3.303	20	30		EGEDHN
C=CC(C)(C)CNC(=O)N(Cc1ccncc1)C[C@@H]1CCCN1CC	ZINC000458989044	458236384	/nfs/dbraw/zinc/23/63/84/458236384.db2.gz	OVVXRWGTSRWMMO-SFHVURJKSA-N	0	3	344.503	3.290	20	30		EGEDHN
C=CCC1(CNC(=O)N(CCN(C)C)Cc2ccco2)CCCC1	ZINC000459048471	458252634	/nfs/dbraw/zinc/25/26/34/458252634.db2.gz	JBXWBPOTWOPHDD-UHFFFAOYSA-N	0	3	333.476	3.489	20	30		EGEDHN
COC(=O)[C@@](C)(CNCc1ccc(C#N)cc1F)c1ccc(F)cc1	ZINC000447088979	458264506	/nfs/dbraw/zinc/26/45/06/458264506.db2.gz	UKVYZAYLIDJLQD-IBGZPJMESA-N	0	3	344.361	3.057	20	30		EGEDHN
C=CCN(CCC(=O)Nc1ccc(C)cn1)Cc1cccc(C#N)c1	ZINC000447169565	458270739	/nfs/dbraw/zinc/27/07/39/458270739.db2.gz	WOBWFEZAPOBHHU-UHFFFAOYSA-N	0	3	334.423	3.279	20	30		EGEDHN
CCN(C(=O)NCC(C)(C)CC#N)[C@H]1CCN(Cc2ccccc2)C1	ZINC000459238750	458298844	/nfs/dbraw/zinc/29/88/44/458298844.db2.gz	OJUGJBMSZDJSEB-SFHVURJKSA-N	0	3	342.487	3.232	20	30		EGEDHN
C[C@@H]1C[C@@H](c2cccnc2)N(CCC(=O)Nc2sccc2C#N)C1	ZINC000376552630	458336200	/nfs/dbraw/zinc/33/62/00/458336200.db2.gz	KYAQCBSVRMQVEY-CJNGLKHVSA-N	0	3	340.452	3.426	20	30		EGEDHN
N#Cc1ccc2c(c1)CCN2C(=O)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000416022201	458336641	/nfs/dbraw/zinc/33/66/41/458336641.db2.gz	QBVOPFPMMAHISC-HXUWFJFHSA-N	0	3	345.446	3.360	20	30		EGEDHN
CC[C@H](NCC(=O)N[C@H]1CCOc2ccccc21)c1ccc(C#N)cc1	ZINC000376573175	458341757	/nfs/dbraw/zinc/34/17/57/458341757.db2.gz	VCZYNJVRHYJBKC-OALUTQOASA-N	0	3	349.434	3.239	20	30		EGEDHN
CN(CCN1CCCN(c2ccccc2C#N)CC1)Cc1ccccc1	ZINC000429677193	458357191	/nfs/dbraw/zinc/35/71/91/458357191.db2.gz	AAERWGMIDMMSNC-UHFFFAOYSA-N	0	3	348.494	3.202	20	30		EGEDHN
C=CCN(C)CCN(CC)[C@@H](C)C(=O)Nc1nc2ccccc2s1	ZINC000429716370	458361483	/nfs/dbraw/zinc/36/14/83/458361483.db2.gz	ACLHPOPOVJXQJX-AWEZNQCLSA-N	0	3	346.500	3.063	20	30		EGEDHN
COCCCCN(C)[C@H](C)C(=O)N(CCC#N)c1cc(C)cc(C)c1	ZINC000419384881	458381410	/nfs/dbraw/zinc/38/14/10/458381410.db2.gz	KMEXKYYGARDQIT-GOSISDBHSA-N	0	3	345.487	3.297	20	30		EGEDHN
CCN1CCC[C@H]1CNC(=O)c1sc2ccc(C#N)cc2c1C	ZINC000429935970	458384019	/nfs/dbraw/zinc/38/40/19/458384019.db2.gz	JUFGMFONHDIPCP-AWEZNQCLSA-N	0	3	327.453	3.296	20	30		EGEDHN
CN(Cc1ccccc1)C1(CNC(=O)NCC2(C#N)CCC2)CCC1	ZINC000419519433	458384489	/nfs/dbraw/zinc/38/44/89/458384489.db2.gz	FXHUAXUHYMYYAB-UHFFFAOYSA-N	0	3	340.471	3.034	20	30		EGEDHN
C[C@@H]1C[C@H](N2CCN([C@H](C#N)c3cccc(Cl)c3)CC2)CCO1	ZINC000420969274	458405799	/nfs/dbraw/zinc/40/57/99/458405799.db2.gz	XXJCFLBVDSSVHU-ZTFGCOKTSA-N	0	3	333.863	3.090	20	30		EGEDHN
Cc1cc(CN[C@@H]2C[C@H](OC(C)(C)C)[C@H]2n2cccn2)ccc1C#N	ZINC000449657468	458428839	/nfs/dbraw/zinc/42/88/39/458428839.db2.gz	PEMQQFNSJNKBDT-QYZOEREBSA-N	0	3	338.455	3.350	20	30		EGEDHN
COc1ccccc1NC(=O)C[C@H](C)NCc1ccc(C#N)c(F)c1	ZINC000449735906	458430165	/nfs/dbraw/zinc/43/01/65/458430165.db2.gz	KOICAOYXZIUERU-ZDUSSCGKSA-N	0	3	341.386	3.213	20	30		EGEDHN
C[C@@H](N[C@@H](C)CCCc1cccnc1)C(=O)Nc1cccc(C#N)c1	ZINC000459631142	458430729	/nfs/dbraw/zinc/43/07/29/458430729.db2.gz	BPDOHRGUBJCIPT-JKSUJKDBSA-N	0	3	336.439	3.281	20	30		EGEDHN
C=CCN1CCC(Nc2ncnc3cc(Br)ccc32)CC1	ZINC000450314102	458445639	/nfs/dbraw/zinc/44/56/39/458445639.db2.gz	AKWIYLOZEIAQDG-UHFFFAOYSA-N	0	3	347.260	3.455	20	30		EGEDHN
CO[C@@H]1C[C@@H](NCc2ccc(C#N)cc2Br)C12CCC2	ZINC000459748910	458467669	/nfs/dbraw/zinc/46/76/69/458467669.db2.gz	GVWSTWYLVUNWQL-HUUCEWRRSA-N	0	3	335.245	3.368	20	30		EGEDHN
CO[C@H]1C[C@H](NCc2ccc(C#N)cc2Br)C12CCC2	ZINC000459748906	458467743	/nfs/dbraw/zinc/46/77/43/458467743.db2.gz	GVWSTWYLVUNWQL-GJZGRUSLSA-N	0	3	335.245	3.368	20	30		EGEDHN
O=C(NCC#Cc1cccc(F)c1)[C@H]1CCCCN1C1CCCC1	ZINC000451512204	458479856	/nfs/dbraw/zinc/47/98/56/458479856.db2.gz	QXSLKICWDVJLFS-LJQANCHMSA-N	0	3	328.431	3.091	20	30		EGEDHN
C=CCNC(=O)CN[C@H]1CCCCc2ccc(Br)cc21	ZINC000453186991	458521485	/nfs/dbraw/zinc/52/14/85/458521485.db2.gz	UZDVEWUZWOPGNI-HNNXBMFYSA-N	0	3	337.261	3.108	20	30		EGEDHN
C=CCC[C@@H](C(=O)N1CCCN(CCCOC)CC1)c1ccccc1	ZINC000373535722	458522039	/nfs/dbraw/zinc/52/20/39/458522039.db2.gz	SVACPWMKJMKAMS-HXUWFJFHSA-N	0	3	344.499	3.307	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1cccc(OCc2cccc(F)c2)c1	ZINC000424093000	458556777	/nfs/dbraw/zinc/55/67/77/458556777.db2.gz	QENDFOPAMCENMP-SFHVURJKSA-N	0	3	341.386	3.364	20	30		EGEDHN
CC(C)(C)Cc1nc2cc(NC(=O)[C@H](N)CCCC#N)ccc2o1	ZINC000424111274	458560901	/nfs/dbraw/zinc/56/09/01/458560901.db2.gz	ACXYPNMCSZIAPG-CYBMUJFWSA-N	0	3	328.416	3.376	20	30		EGEDHN
C[C@@H](CNC(=O)[C@@H](N)CCCC#N)c1c(Cl)cccc1Cl	ZINC000424112906	458561083	/nfs/dbraw/zinc/56/10/83/458561083.db2.gz	LEDNKHLBAWUFPQ-GWCFXTLKSA-N	0	3	328.243	3.234	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1ccc(Cl)c(Br)c1	ZINC000424118130	458561981	/nfs/dbraw/zinc/56/19/81/458561981.db2.gz	BESYLWRGPITNFV-NSHDSACASA-N	0	3	330.613	3.062	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1ccccc1N1CCc2ccccc21	ZINC000424116224	458562279	/nfs/dbraw/zinc/56/22/79/458562279.db2.gz	XDFIKZAPDPIDBF-INIZCTEOSA-N	0	3	334.423	3.340	20	30		EGEDHN
CN(Cc1ccccc1)C1(CNC(=O)NCCCCC#N)CCC1	ZINC000454439025	458562501	/nfs/dbraw/zinc/56/25/01/458562501.db2.gz	AMIQYLSJTRFLMU-UHFFFAOYSA-N	0	3	328.460	3.034	20	30		EGEDHN
Cc1ccc(CNC(=O)[C@H](N)CCCC#N)c(O[C@@H](C)CC(C)C)c1	ZINC000424124211	458563936	/nfs/dbraw/zinc/56/39/36/458563936.db2.gz	LRAQBSXLKJSJGF-FUHWJXTLSA-N	0	3	345.487	3.446	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N(CCc1cccc(F)c1)C1CCCC1	ZINC000424131921	458566683	/nfs/dbraw/zinc/56/66/83/458566683.db2.gz	GZCGRZJZGBZTFQ-GOSISDBHSA-N	0	3	331.435	3.161	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1ncccc1OCC1CCCCC1	ZINC000424140062	458569519	/nfs/dbraw/zinc/56/95/19/458569519.db2.gz	AXCWWHXXKACJBA-OAHLLOKOSA-N	0	3	330.432	3.000	20	30		EGEDHN
CC[C@H](C(=O)N1CCC[C@@H]1[C@H](C#N)c1ccccc1)N(CC)CC	ZINC000461757889	458572687	/nfs/dbraw/zinc/57/26/87/458572687.db2.gz	YADOUYPKUZBQJF-GUDVDZBRSA-N	0	3	327.472	3.405	20	30		EGEDHN
C[C@H]1CCCCN1CCNC(=O)C(C)(C)Cc1ccc(C#N)cc1	ZINC000454746789	458573156	/nfs/dbraw/zinc/57/31/56/458573156.db2.gz	VPMDVQUNWHAAMR-INIZCTEOSA-N	0	3	327.472	3.118	20	30		EGEDHN
C[C@H](C#N)CSc1ccccc1NC(=O)N1C[C@@H]2CCN(C)[C@@H]2C1	ZINC000454749017	458573308	/nfs/dbraw/zinc/57/33/08/458573308.db2.gz	IVZLJSZPAPLDIU-IJEWVQPXSA-N	0	3	344.484	3.106	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N1CCc2ccccc2[C@H]1Cc1ccccc1	ZINC000424172803	458577605	/nfs/dbraw/zinc/57/76/05/458577605.db2.gz	MEXSGWOWULNDQJ-NHCUHLMSSA-N	0	3	347.462	3.376	20	30		EGEDHN
C[C@H]1CC=C(C(=O)N(CCN(C)C)Cc2cccc(C#N)c2)CC1	ZINC000455125005	458585992	/nfs/dbraw/zinc/58/59/92/458585992.db2.gz	DMVMPYUMUWIPAX-INIZCTEOSA-N	0	3	325.456	3.195	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Nc1ccc(C(C)=O)cn1)C(C)C	ZINC000455115754	458586099	/nfs/dbraw/zinc/58/60/99/458586099.db2.gz	HYHRKJPOYHRYLJ-QGZVFWFLSA-N	0	3	344.459	3.104	20	30		EGEDHN
C[C@@H](CNC(=O)Nc1ccc(Oc2ccccc2)c(C#N)c1)N(C)C	ZINC000455223234	458588502	/nfs/dbraw/zinc/58/85/02/458588502.db2.gz	CYVPJMFFKXDQAV-AWEZNQCLSA-N	0	3	338.411	3.422	20	30		EGEDHN
C[C@H]1C[C@@H](N(C)C(=O)C(C)(C)Cc2ccc(C#N)cc2)CCN1C	ZINC000455734135	458609775	/nfs/dbraw/zinc/60/97/75/458609775.db2.gz	GMLHQKVGYSDCSK-YJBOKZPZSA-N	0	3	327.472	3.068	20	30		EGEDHN
N#CCc1cccc(NC(=O)NCC2CCN(c3ccncc3)CC2)c1	ZINC000455913650	458621498	/nfs/dbraw/zinc/62/14/98/458621498.db2.gz	ZNVOGQWZTYETRN-UHFFFAOYSA-N	0	3	349.438	3.186	20	30		EGEDHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@@H](C)c1cccc(C#N)c1	ZINC000462472576	458622844	/nfs/dbraw/zinc/62/28/44/458622844.db2.gz	GLBZXMJZENMQQH-SJORKVTESA-N	0	3	335.451	3.298	20	30		EGEDHN
C=CCC1(C(=O)NC2CCN(Cc3ccccc3)CC2)CCOCC1	ZINC000424527105	458655421	/nfs/dbraw/zinc/65/54/21/458655421.db2.gz	OVBBMTJCCBGNKW-UHFFFAOYSA-N	0	3	342.483	3.140	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(Cl)cc3c2OCC3)CC1	ZINC000462994961	458669531	/nfs/dbraw/zinc/66/95/31/458669531.db2.gz	KSSHFTNIHLXSID-UHFFFAOYSA-N	0	3	334.847	3.045	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN1CCC(Cc2ccc(F)cc2)CC1	ZINC000507182454	458754379	/nfs/dbraw/zinc/75/43/79/458754379.db2.gz	QDEHVWSPNHGTED-UHFFFAOYSA-N	0	3	330.447	3.281	20	30		EGEDHN
CC(C)CN(C(=O)[C@H](C)c1cccc(C#N)c1)C1CCN(C)CC1	ZINC000464538667	458759436	/nfs/dbraw/zinc/75/94/36/458759436.db2.gz	PZZYCKCEIWTGMP-MRXNPFEDSA-N	0	3	327.472	3.241	20	30		EGEDHN
C=C(C)CN(Cc1ccccc1)C(=O)N[C@H]1C[C@H](C)N(C2CC2)C1	ZINC000472036203	458763159	/nfs/dbraw/zinc/76/31/59/458763159.db2.gz	BWMUJSOHZNGVQJ-WMZOPIPTSA-N	0	3	327.472	3.400	20	30		EGEDHN
C[C@H](C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H]1C)c1cccc(C#N)c1	ZINC000464640414	458763255	/nfs/dbraw/zinc/76/32/55/458763255.db2.gz	SIBOXZDDBFECJU-CSODHUTKSA-N	0	3	347.462	3.441	20	30		EGEDHN
C=CCn1c(CCCC)nnc1N1CCN(C2CCCCC2)CC1	ZINC000508882420	458766200	/nfs/dbraw/zinc/76/62/00/458766200.db2.gz	XIGRSHNDONFLBH-UHFFFAOYSA-N	0	3	331.508	3.261	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cccc(C#N)c1C)C(C)C	ZINC000512325930	458784262	/nfs/dbraw/zinc/78/42/62/458784262.db2.gz	NCLHMTVGJRSNAB-LJQANCHMSA-N	0	3	325.456	3.295	20	30		EGEDHN
C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(Cc2ccc(CC#N)cc2)C1	ZINC000495033176	458785531	/nfs/dbraw/zinc/78/55/31/458785531.db2.gz	UTMIUTVWLIOZGR-CRAIPNDOSA-N	0	3	343.471	3.488	20	30		EGEDHN
C[C@@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(Cc2cc(C#N)cs2)C1	ZINC000495068374	458793653	/nfs/dbraw/zinc/79/36/53/458793653.db2.gz	RMQJFBOSGJNVFE-TZMCWYRMSA-N	0	3	335.473	3.355	20	30		EGEDHN
CC(C)Cc1ccc([C@H](CNC(=O)N(C)C[C@@H](C)C#N)N(C)C)cc1	ZINC000513397572	458794134	/nfs/dbraw/zinc/79/41/34/458794134.db2.gz	WBBABMAJTMIEJG-LPHOPBHVSA-N	0	3	344.503	3.289	20	30		EGEDHN
COC(=O)c1ccc(N2CCN(CCCC(C)(C)C#N)[C@H](C)C2)cc1	ZINC000472435393	458795025	/nfs/dbraw/zinc/79/50/25/458795025.db2.gz	GKZLTPYYQGCHHC-MRXNPFEDSA-N	0	3	343.471	3.314	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCC2(c3ccccc3C)CC2)CC1	ZINC000517998283	458835213	/nfs/dbraw/zinc/83/52/13/458835213.db2.gz	XOJDWKUAYXDLJT-UHFFFAOYSA-N	0	3	341.499	3.366	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H]2CCN(c3ccccc3)[C@H]2C)CC1	ZINC000473571806	458836296	/nfs/dbraw/zinc/83/62/96/458836296.db2.gz	VMLNVNGGGKSBOS-PXNSSMCTSA-N	0	3	341.499	3.058	20	30		EGEDHN
N#CCCCCN1CCC[C@H](NC(=O)c2cc3ccccc3o2)C1	ZINC000440935926	458867187	/nfs/dbraw/zinc/86/71/87/458867187.db2.gz	LNYLOKDBPFCJEM-INIZCTEOSA-N	0	3	325.412	3.321	20	30		EGEDHN
N#CCCC1CCN(C[C@H]2CN(Cc3ccccc3)CCCO2)CC1	ZINC000518765344	458891008	/nfs/dbraw/zinc/89/10/08/458891008.db2.gz	WNWTVQHOKVVRPF-NRFANRHFSA-N	0	3	341.499	3.293	20	30		EGEDHN
C=CCn1c(CC2CCCC2)nnc1N1C[C@@H](C)N(CC)C[C@@H]1C	ZINC000554924329	458902249	/nfs/dbraw/zinc/90/22/49/458902249.db2.gz	KAWISFFHZIASGQ-CVEARBPZSA-N	0	3	331.508	3.116	20	30		EGEDHN
C=CCn1c(CC2CCCCC2)nnc1N(C)[C@H]1CCN(C2CC2)C1	ZINC000554931467	458902414	/nfs/dbraw/zinc/90/24/14/458902414.db2.gz	CYXRVVDKBWAGLF-SFHVURJKSA-N	0	3	343.519	3.260	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@]1(C)CCN(Cc2ccc(C#N)cc2)C1	ZINC000495659114	458911266	/nfs/dbraw/zinc/91/12/66/458911266.db2.gz	RDJRTVPXJUSCSQ-LJQANCHMSA-N	0	3	329.444	3.295	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N[C@@]1(C)CCN(Cc2ccccc2)C1)OCC	ZINC000519757552	458999485	/nfs/dbraw/zinc/99/94/85/458999485.db2.gz	IMCBKOKNWDLWBY-QUCCMNQESA-N	0	3	330.472	3.139	20	30		EGEDHN
C[C@H](c1ccccc1)[C@H](C)N[C@@H]1CCN(c2ccc(C#N)cc2)C1=O	ZINC000476824484	459019272	/nfs/dbraw/zinc/01/92/72/459019272.db2.gz	OTZYKZVNNJLTEO-TWOQFEAHSA-N	0	3	333.435	3.445	20	30		EGEDHN
C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NCc1cccc(F)c1C#N	ZINC000495966954	459022562	/nfs/dbraw/zinc/02/25/62/459022562.db2.gz	FZDPCKWSLIPCJP-SUMWQHHRSA-N	0	3	347.434	3.432	20	30		EGEDHN
N#C[C@@H]1CC[C@H](NCc2ccc(OCCOc3ccccc3)nc2)C1	ZINC000442721775	459027341	/nfs/dbraw/zinc/02/73/41/459027341.db2.gz	ULVLFPSPBNHCFO-AEFFLSMTSA-N	0	3	337.423	3.321	20	30		EGEDHN
C=CCN(CC=C)C(=O)NCc1ccc(OCCN2CCCC2)cc1	ZINC000477661264	459052691	/nfs/dbraw/zinc/05/26/91/459052691.db2.gz	LPOHDINGSLFCBP-UHFFFAOYSA-N	0	3	343.471	3.045	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1cccc(C#N)n1	ZINC000577630553	459066458	/nfs/dbraw/zinc/06/64/58/459066458.db2.gz	MVCHBRZMUDWZRI-INIZCTEOSA-N	0	3	349.438	3.082	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2N[C@@H]1CCc2ccccc2NC1=O	ZINC000594510354	459069019	/nfs/dbraw/zinc/06/90/19/459069019.db2.gz	IXCNWZCGXNLUKM-WOJBJXKFSA-N	0	3	331.419	3.479	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N(C)C[C@H]1CN(c2ccccc2)CCO1	ZINC000577765648	459091319	/nfs/dbraw/zinc/09/13/19/459091319.db2.gz	HSRXPTSQSPIHQX-UWJYYQICSA-N	0	3	335.451	3.456	20	30		EGEDHN
CO[C@H](C)c1nc(CN2CCCN([C@H]3CC[C@H](C#N)C3)CC2)cs1	ZINC000590161293	459095345	/nfs/dbraw/zinc/09/53/45/459095345.db2.gz	SODBCHSYFCAKOQ-VYDXJSESSA-N	0	3	348.516	3.050	20	30		EGEDHN
C#CC[C@@H](CC(F)(F)F)N[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000496208299	459108751	/nfs/dbraw/zinc/10/87/51/459108751.db2.gz	URIAGXPQSCVTSI-QWHCGFSZSA-N	0	3	334.382	3.320	20	30		EGEDHN
C[C@@H](O)CN(Cc1cccc(OCc2ccccc2C#N)c1)C1CC1	ZINC000594613852	459115811	/nfs/dbraw/zinc/11/58/11/459115811.db2.gz	FDXUNGZBEOAGDT-MRXNPFEDSA-N	0	3	336.435	3.482	20	30		EGEDHN
C=CCn1cccc1-c1nc(-c2ccc(OCCN(C)C)cc2)no1	ZINC000567516417	459117791	/nfs/dbraw/zinc/11/77/91/459117791.db2.gz	SGFAQWQTNNOGDH-UHFFFAOYSA-N	0	3	338.411	3.332	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNC[C@H](C#N)CCC#N)C1	ZINC000496276135	459133625	/nfs/dbraw/zinc/13/36/25/459133625.db2.gz	QLVRVGYORLXCQY-YJBOKZPZSA-N	0	3	334.464	3.057	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1CN[C@H](C)c1cnccc1NC(=O)OC(C)(C)C	ZINC000496282590	459136090	/nfs/dbraw/zinc/13/60/90/459136090.db2.gz	JGLDYGLJPGKJMA-KEYYUXOJSA-N	0	3	347.459	3.092	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N(C)C(=O)NC[C@@H]1CCCCN1C1CC1	ZINC000567728457	459156218	/nfs/dbraw/zinc/15/62/18/459156218.db2.gz	AJPPFYYGMIGDSP-KXBFYZLASA-N	0	3	340.471	3.278	20	30		EGEDHN
C[C@](C#N)(NC(=O)[C@H]1CCN(Cc2ccccc2)C1)C1CCCCC1	ZINC000578336776	459184791	/nfs/dbraw/zinc/18/47/91/459184791.db2.gz	PJRITSSNSOTFPY-GHTZIAJQSA-N	0	3	339.483	3.487	20	30		EGEDHN
CCO[C@@H]1C[C@@H](NCC(=O)Nc2oc(C)c(C)c2C#N)C12CCCC2	ZINC000590739515	459201199	/nfs/dbraw/zinc/20/11/99/459201199.db2.gz	SBYJVPIOYHJOIO-HZPDHXFCSA-N	0	3	345.443	3.034	20	30		EGEDHN
C=CC[C@@H](C)NC(=O)NCC1(N2CCOC(C)(C)C2)CCCCC1	ZINC000522663124	459254330	/nfs/dbraw/zinc/25/43/30/459254330.db2.gz	XHNVHPPKPVTJDW-MRXNPFEDSA-N	0	3	337.508	3.064	20	30		EGEDHN
CN(CC#Cc1ccc(OC(F)(F)F)cc1)C[C@H]1CCCC[C@@H]1O	ZINC000481546532	459260462	/nfs/dbraw/zinc/26/04/62/459260462.db2.gz	TXADXUQKVUBOIL-WBVHZDCISA-N	0	3	341.373	3.420	20	30		EGEDHN
CC(C#N)C(=O)N1CC(CN2CC(C)(C)c3ccc(C4CC4)cc32)C1	ZINC000595285653	459266268	/nfs/dbraw/zinc/26/62/68/459266268.db2.gz	SJNONEIPBHYLFS-CQSZACIVSA-N	0	3	337.467	3.280	20	30		EGEDHN
CC(C)(CC#N)CNC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000590918522	459267455	/nfs/dbraw/zinc/26/74/55/459267455.db2.gz	YBHUABVXOQINFU-SFHVURJKSA-N	0	3	342.487	3.138	20	30		EGEDHN
CC(C)(CC#N)CNC(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000590918521	459267641	/nfs/dbraw/zinc/26/76/41/459267641.db2.gz	YBHUABVXOQINFU-GOSISDBHSA-N	0	3	342.487	3.138	20	30		EGEDHN
Cc1cccnc1C(C)(C)CNC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000568339700	459270779	/nfs/dbraw/zinc/27/07/79/459270779.db2.gz	CTBIKCGWTSEKKK-GOSISDBHSA-N	0	3	346.434	3.038	20	30		EGEDHN
C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1CN[C@H]1CC[C@@H](C#N)C1	ZINC000496716514	459297397	/nfs/dbraw/zinc/29/73/97/459297397.db2.gz	MZXNIHKAXGYQSV-LJISPDSOSA-N	0	3	337.464	3.029	20	30		EGEDHN
COC(=O)[C@H](C)Oc1ccc(CN2CCC(CCC#N)CC2)cc1	ZINC000568513318	459300693	/nfs/dbraw/zinc/30/06/93/459300693.db2.gz	ZDRRYSNRZOLBER-HNNXBMFYSA-N	0	3	330.428	3.143	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N2CCC[C@H](CC#N)C2)C1	ZINC000595467019	459312721	/nfs/dbraw/zinc/31/27/21/459312721.db2.gz	WRYSBFJCUWRVBK-LMMKCTJWSA-N	0	3	340.471	3.157	20	30		EGEDHN
C=CC1CCN(C[C@H](O)COc2ccc(Br)cc2)CC1	ZINC000523607559	459316547	/nfs/dbraw/zinc/31/65/47/459316547.db2.gz	IXGGFLRZTZWNBM-HNNXBMFYSA-N	0	3	340.261	3.087	20	30		EGEDHN
C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NCc1ccc(F)cc1C#N	ZINC000496776198	459319921	/nfs/dbraw/zinc/31/99/21/459319921.db2.gz	NVBNKQZWGQKVKP-GUYCJALGSA-N	0	3	347.434	3.432	20	30		EGEDHN
Cc1ccccc1[C@@H]1C[C@@H](C)N(CC(=O)NCc2cccc(C#N)c2)C1	ZINC000524593497	459373879	/nfs/dbraw/zinc/37/38/79/459373879.db2.gz	CLNBSHDVMLTMQJ-YLJYHZDGSA-N	0	3	347.462	3.361	20	30		EGEDHN
Cc1n[nH]cc1C1CCN(C(=O)C(C#N)CCc2ccccc2)CC1	ZINC000560807748	459397706	/nfs/dbraw/zinc/39/77/06/459397706.db2.gz	AAMQECLIKHIYGB-GOSISDBHSA-N	0	3	336.439	3.197	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H](NCc2ccc(C#N)cn2)C(C)(C)C1	ZINC000497005830	459402195	/nfs/dbraw/zinc/40/21/95/459402195.db2.gz	VAUIXYPLYNZQNM-MRXNPFEDSA-N	0	3	344.459	3.078	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N(C)C(=O)N[C@@H]1CCN(C(C)(C)C)C1	ZINC000595704360	459406447	/nfs/dbraw/zinc/40/64/47/459406447.db2.gz	PXKAVNLCHBSDEB-WMLDXEAASA-N	0	3	328.460	3.133	20	30		EGEDHN
C=C(C)CN(CCC(=O)OC)Cc1cccc(Br)c1	ZINC000484300090	459410822	/nfs/dbraw/zinc/41/08/22/459410822.db2.gz	BCINOUGSOAKVEV-UHFFFAOYSA-N	0	3	326.234	3.390	20	30		EGEDHN
CC(C)(C)OC(=O)NCC12CCC(CC1)CN2[C@@H]1CC[C@H](C#N)C1	ZINC000497100042	459438817	/nfs/dbraw/zinc/43/88/17/459438817.db2.gz	PXCUAWCZHYTERZ-YJTLQXIOSA-N	0	3	333.476	3.448	20	30		EGEDHN
N#C[C@H]1CC[C@@H](NC[C@@H](O)COc2ccc(Cl)cc2Cl)C1	ZINC000569449706	459452864	/nfs/dbraw/zinc/45/28/64/459452864.db2.gz	OLEOUTHQUKCKSQ-CYZMBNFOSA-N	0	3	329.227	3.015	20	30		EGEDHN
CSc1cc(C)ccc1CNC[C@@H](O)COc1ccc(C#N)cc1	ZINC000582959442	459458805	/nfs/dbraw/zinc/45/88/05/459458805.db2.gz	AJSSQCZPPUZTLK-QGZVFWFLSA-N	0	3	342.464	3.118	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2ccc(C#Cc3ccccc3)cc2)CCN1C	ZINC000525618158	459469522	/nfs/dbraw/zinc/46/95/22/459469522.db2.gz	LKKSKZNEQYUVMV-UTKZUKDTSA-N	0	3	332.447	3.299	20	30		EGEDHN
Cc1nnc(-c2ccc(C(=O)C(C#N)c3nc4ccccc4[nH]3)cc2)o1	ZINC000541720103	459483735	/nfs/dbraw/zinc/48/37/35/459483735.db2.gz	KSZMWCAHSJDSCL-CQSZACIVSA-N	0	3	343.346	3.411	20	30		EGEDHN
CC1(C)CCC[C@@H](CNCCS(=O)(=O)c2ccc(C#N)cc2)C1	ZINC000583140040	459489503	/nfs/dbraw/zinc/48/95/03/459489503.db2.gz	JKJAVFKSKSVYCB-MRXNPFEDSA-N	0	3	334.485	3.138	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H]2CN(Cc3ccc(C#N)cc3)C[C@@H]2C1	ZINC000497215258	459489623	/nfs/dbraw/zinc/48/96/23/459489623.db2.gz	QJHPBNOCVBVYLF-ZWKOTPCHSA-N	0	3	341.455	3.247	20	30		EGEDHN
N#CC1(NC(=O)CN2C[C@H](c3ccccc3)[C@H]3CCCC[C@H]32)CCC1	ZINC000525886118	459511486	/nfs/dbraw/zinc/51/14/86/459511486.db2.gz	CGUMTUHLPVVXMA-GUDVDZBRSA-N	0	3	337.467	3.207	20	30		EGEDHN
N#CC[C@@H]1CCCN(C(=O)NC[C@H](c2cccs2)N2CCCC2)C1	ZINC000596092006	459517399	/nfs/dbraw/zinc/51/73/99/459517399.db2.gz	HFWMQKOICCJDJO-JKSUJKDBSA-N	0	3	346.500	3.220	20	30		EGEDHN
C[C@H]1C[C@H](NC2CCC(Oc3ncccc3C#N)CC2)c2nccn21	ZINC000569901449	459527078	/nfs/dbraw/zinc/52/70/78/459527078.db2.gz	SBFBIZYRBNSANR-LYAPFXNSSA-N	0	3	337.427	3.135	20	30		EGEDHN
CCCCCNC(=O)C1CCN(Cc2ccc(CC#N)cc2)CC1	ZINC000542210611	459534406	/nfs/dbraw/zinc/53/44/06/459534406.db2.gz	VCVMGJSQTLFAOO-UHFFFAOYSA-N	0	3	327.472	3.271	20	30		EGEDHN
Cc1ccc2nc(CNC(=O)C(C#N)CCc3ccccc3)cn2c1	ZINC000487976664	459536256	/nfs/dbraw/zinc/53/62/56/459536256.db2.gz	ZOMTWQPFNKBFFV-QGZVFWFLSA-N	0	3	332.407	3.032	20	30		EGEDHN
N#CC[C@]1(O)CCN(CC/C=C\c2ccc(Br)cc2)C1	ZINC000592151179	459538420	/nfs/dbraw/zinc/53/84/20/459538420.db2.gz	NSVCYXGVDBBDGA-SWQCVOCJSA-N	0	3	335.245	3.203	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000488742365	459550040	/nfs/dbraw/zinc/55/00/40/459550040.db2.gz	FAQIIIFNCYKFMV-HKUYNNGSSA-N	0	3	337.467	3.457	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2c(C)cc(C)cc2C)CC1	ZINC000592296504	459573560	/nfs/dbraw/zinc/57/35/60/459573560.db2.gz	NQXCQOJRBZJPPA-UHFFFAOYSA-N	0	3	329.488	3.452	20	30		EGEDHN
N#CCCC1CCN(C(=O)Nc2ccc3c(c2F)CCNC3)CC1	ZINC000583693381	459581679	/nfs/dbraw/zinc/58/16/79/459581679.db2.gz	NQHHIYQDJIWMDL-UHFFFAOYSA-N	0	3	330.407	3.019	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cnn([C@H](C)CC)c2C2CC2)CC1	ZINC000490900822	459590589	/nfs/dbraw/zinc/59/05/89/459590589.db2.gz	YLEHDMFGWIQHMC-CQSZACIVSA-N	0	3	328.460	3.015	20	30		EGEDHN
CC[C@@H](N[C@H]1CCc2ccc(C#N)cc21)C(=O)NCc1cccs1	ZINC000592396204	459591132	/nfs/dbraw/zinc/59/11/32/459591132.db2.gz	OYRRUPCGFYTTPT-MSOLQXFVSA-N	0	3	339.464	3.292	20	30		EGEDHN
CC[C@@H](Cc1ccc(C)cc1)N(CC)CC(=O)NC1(C#N)CCC1	ZINC000527128145	459595914	/nfs/dbraw/zinc/59/59/14/459595914.db2.gz	BJONLBKRVPATQF-SFHVURJKSA-N	0	3	327.472	3.201	20	30		EGEDHN
Cc1ccc(C2(CNCc3cnc4c(C#N)cnn4c3)CCC2)cc1C	ZINC000592514108	459619873	/nfs/dbraw/zinc/61/98/73/459619873.db2.gz	VNDZKNZEODCPSD-UHFFFAOYSA-N	0	3	345.450	3.429	20	30		EGEDHN
CC#CCCNCc1cc(Br)c(OC)c(OCC)c1	ZINC000499218758	459627928	/nfs/dbraw/zinc/62/79/28/459627928.db2.gz	YJZJFCDUGFILAY-UHFFFAOYSA-N	0	3	326.234	3.359	20	30		EGEDHN
C=CCN1CC[C@H](N2CCC(C)(c3cccc(Cl)c3)CC2)C1=O	ZINC000499790406	459652854	/nfs/dbraw/zinc/65/28/54/459652854.db2.gz	CBEQSEWKNJXPAE-KRWDZBQOSA-N	0	3	332.875	3.480	20	30		EGEDHN
COC[C@H](NCC(=O)Nc1ccccc1S[C@@H](C)CC#N)C(C)C	ZINC000543452132	459659635	/nfs/dbraw/zinc/65/96/35/459659635.db2.gz	KUYMSYGXWHYYDP-HOCLYGCPSA-N	0	3	349.500	3.280	20	30		EGEDHN
Cc1ccc(NC(=O)/C=C/c2ccc(C#N)cc2)c(OCCN(C)C)c1	ZINC000491904868	459684492	/nfs/dbraw/zinc/68/44/92/459684492.db2.gz	LEPVGEFACYUHIG-PKNBQFBNSA-N	0	3	349.434	3.459	20	30		EGEDHN
C=C(C)COc1cc(CNc2cccc(N(C)C)n2)ccc1OC	ZINC000543800783	459701330	/nfs/dbraw/zinc/70/13/30/459701330.db2.gz	FSNCJWMYFYFBCM-UHFFFAOYSA-N	0	3	327.428	3.145	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NC(=O)N[C@H](C)[C@@H](c1ccccc1C)N(C)C	ZINC000563064672	459710086	/nfs/dbraw/zinc/71/00/86/459710086.db2.gz	UDVOAHBFQZLXPH-YSHGAJCASA-N	0	3	345.487	3.019	20	30		EGEDHN
C[C@@H](CCC1CCCCC1)NCCS(=O)(=O)c1ccc(C#N)cn1	ZINC000584464995	459745693	/nfs/dbraw/zinc/74/56/93/459745693.db2.gz	OWOSUHYNJYZFPH-HNNXBMFYSA-N	0	3	349.500	3.066	20	30		EGEDHN
CN(C(=O)C(C[C@H]1CCCO1)C(F)(F)F)c1ccc(C#N)cc1	ZINC000593073071	459764947	/nfs/dbraw/zinc/76/49/47/459764947.db2.gz	OTYSSIJCCDAILL-KGLIPLIRSA-N	0	3	326.318	3.269	20	30		EGEDHN
C[C@H](CN1CCC(C)CC1)NC(=O)Nc1ccc(C#N)cc1Cl	ZINC000596802211	459766066	/nfs/dbraw/zinc/76/60/66/459766066.db2.gz	RMUFPVFEKHXQHQ-CYBMUJFWSA-N	0	3	334.851	3.454	20	30		EGEDHN
Cc1cc2cc(CNC[C@H](O)COc3ccc(CC#N)cc3)ccc2[nH]1	ZINC000563618154	459767446	/nfs/dbraw/zinc/76/74/46/459767446.db2.gz	MZUGAWNXZOZVCI-IBGZPJMESA-N	0	3	349.434	3.072	20	30		EGEDHN
CCn1cc(CN(CCCOc2cccc(C#N)c2)C(C)C)cn1	ZINC000593083026	459767739	/nfs/dbraw/zinc/76/77/39/459767739.db2.gz	YDHNHGNYCRZITL-UHFFFAOYSA-N	0	3	326.444	3.454	20	30		EGEDHN
CCc1ccc([C@@H](C#N)NC(=O)[C@@H]2CCN(Cc3ccccc3)C2)cc1	ZINC000564224636	459771945	/nfs/dbraw/zinc/77/19/45/459771945.db2.gz	NULFNJDSPYLIDA-NHCUHLMSSA-N	0	3	347.462	3.452	20	30		EGEDHN
CC1(C)CN(C(=O)C(C#N)Cc2ccc(C#N)cc2)[C@@H]1c1ccncc1	ZINC000564212752	459772093	/nfs/dbraw/zinc/77/20/93/459772093.db2.gz	FMSBHDJYMUIGFA-RTBURBONSA-N	0	3	344.418	3.245	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)Nc1cccc2c1CCNC2	ZINC000564641968	459775328	/nfs/dbraw/zinc/77/53/28/459775328.db2.gz	VTIYQJQSONTXPC-UHFFFAOYSA-N	0	3	337.423	3.219	20	30		EGEDHN
C[C@H](C(=O)NC1(C#N)CCC1)N1CCC[C@H](c2ccc(F)cc2)CC1	ZINC000565456363	459784910	/nfs/dbraw/zinc/78/49/10/459784910.db2.gz	TUDWRFPNRQTEGG-CVEARBPZSA-N	0	3	343.446	3.346	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)NCCCC2CCC2)cc1	ZINC000596877809	459785290	/nfs/dbraw/zinc/78/52/90/459785290.db2.gz	VTHBSNCJPGTWJF-ZDUSSCGKSA-N	0	3	349.456	3.074	20	30		EGEDHN
N#C[C@@H]1CC[C@@H](NCc2cccc(NC(=O)NCc3ccncc3)c2)C1	ZINC000565636970	459786437	/nfs/dbraw/zinc/78/64/37/459786437.db2.gz	DBKIMMIXWFWZCJ-SJLPKXTDSA-N	0	3	349.438	3.185	20	30		EGEDHN
C[C@H]1CC[C@@H](N(CC#Cc2ccc(OC(F)(F)F)cc2)CCO)C1	ZINC000565919522	459789502	/nfs/dbraw/zinc/78/95/02/459789502.db2.gz	DBICXAZVCBGXST-GOEBONIOSA-N	0	3	341.373	3.420	20	30		EGEDHN
COCCN(Cc1ccc(C#N)cc1[N+](=O)[O-])C[C@H]1CC=CCC1	ZINC000566299386	459837528	/nfs/dbraw/zinc/83/75/28/459837528.db2.gz	BMMRTTBWMHMSHW-HNNXBMFYSA-N	0	3	329.400	3.271	20	30		EGEDHN
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCc1ccc(C#N)cc1C	ZINC000585755344	459842496	/nfs/dbraw/zinc/84/24/96/459842496.db2.gz	HIMGIIYWMOHVCO-OXQOHEQNSA-N	0	3	336.435	3.377	20	30		EGEDHN
CCCN1CC[C@H](NC(=O)c2cn(CCCC#N)c3ccccc23)C1	ZINC000598344084	459873235	/nfs/dbraw/zinc/87/32/35/459873235.db2.gz	ZSNGXSMRAZTSJD-INIZCTEOSA-N	0	3	338.455	3.159	20	30		EGEDHN
CN(c1ccccc1)[C@H]1CCN(C(=O)C(C#N)CCc2ccccc2)C1	ZINC000598378050	459882995	/nfs/dbraw/zinc/88/29/95/459882995.db2.gz	FHOJNCNVVXOYTI-FPOVZHCZSA-N	0	3	347.462	3.496	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CC[C@@H](Oc2ccccc2)C1	ZINC000598398587	459888548	/nfs/dbraw/zinc/88/85/48/459888548.db2.gz	KJPMFQMVMSLFKB-UYAOXDASSA-N	0	3	334.419	3.439	20	30		EGEDHN
CN(C)CCOc1ccc(-c2noc(-c3cccc(CC#N)c3)n2)cc1	ZINC000546290145	459908048	/nfs/dbraw/zinc/90/80/48/459908048.db2.gz	ZYXFPWATJLWXOB-UHFFFAOYSA-N	0	3	348.406	3.410	20	30		EGEDHN
C[C@H](CNC(=O)c1cc2ccccc2n1CC#N)N1CCCC[C@@H]1C	ZINC000609163436	459916009	/nfs/dbraw/zinc/91/60/09/459916009.db2.gz	LEVDFVHBAAMFRJ-JKSUJKDBSA-N	0	3	338.455	3.158	20	30		EGEDHN
N#Cc1ccccc1NC(=O)CCN1CCCO[C@H](c2ccccc2)C1	ZINC000609233553	459929342	/nfs/dbraw/zinc/92/93/42/459929342.db2.gz	GLDRIFZVHAIQBX-FQEVSTJZSA-N	0	3	349.434	3.350	20	30		EGEDHN
CCC(C#N)C(=O)N[C@](C)(C(=O)OC)c1ccc(Cl)c(Cl)c1	ZINC000593614750	459934087	/nfs/dbraw/zinc/93/40/87/459934087.db2.gz	AFRMDROXTBFMSP-VFZGTOFNSA-N	0	3	343.210	3.048	20	30		EGEDHN
COc1ccc(Cl)cc1CN1CCN(C[C@H](C)CCC#N)CC1	ZINC000602440960	459939145	/nfs/dbraw/zinc/93/91/45/459939145.db2.gz	KRLBIRUFFKYFOE-OAHLLOKOSA-N	0	3	335.879	3.406	20	30		EGEDHN
C[C@H](CCC#N)CN1CCN(Cc2csc(C(C)(C)C)n2)CC1	ZINC000602444643	459940560	/nfs/dbraw/zinc/94/05/60/459940560.db2.gz	JYQZMBCMJQCXMD-OAHLLOKOSA-N	0	3	334.533	3.498	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN1CCC(OCc2ccc(F)cc2)CC1	ZINC000598599945	459958702	/nfs/dbraw/zinc/95/87/02/459958702.db2.gz	LNRLSETTZVQSQL-KRWDZBQOSA-N	0	3	334.435	3.107	20	30		EGEDHN
CCCN(C)[C@H](CNC(=O)NCC1(C#N)CC1)c1ccc(Cl)cc1	ZINC000588670062	459963866	/nfs/dbraw/zinc/96/38/66/459963866.db2.gz	MOBQBOOVJNKFMH-MRXNPFEDSA-N	0	3	348.878	3.326	20	30		EGEDHN
CC(C)C(=O)Nc1ccc(CN[C@H](C)CC2(C#N)CCOCC2)cc1	ZINC000602505530	459972735	/nfs/dbraw/zinc/97/27/35/459972735.db2.gz	FCCFBJHVQOJOAY-MRXNPFEDSA-N	0	3	343.471	3.470	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CNCc1cccc(NC(=O)C2CCCC2)c1	ZINC000598718369	460005317	/nfs/dbraw/zinc/00/53/17/460005317.db2.gz	AKSZVMDHQJTLNE-SFHVURJKSA-N	0	3	343.471	3.206	20	30		EGEDHN
CC(=O)N1CC[C@@H](N[C@@H](C)CC2(C#N)CCOCC2)c2ccccc21	ZINC000602578972	460005550	/nfs/dbraw/zinc/00/55/50/460005550.db2.gz	XRJVDOSRLAURBV-MAUKXSAKSA-N	0	3	341.455	3.173	20	30		EGEDHN
COc1ccc(CNC[C@@H](O)CC(C)(C)C#N)c(OC2CCCC2)c1	ZINC000598722592	460006427	/nfs/dbraw/zinc/00/64/27/460006427.db2.gz	BQNAKHMZXCRKDS-INIZCTEOSA-N	0	3	346.471	3.407	20	30		EGEDHN
Cc1cc(CN(C)Cc2ccc(C(=O)NC3CC3)cc2)ccc1C#N	ZINC000618592926	460079052	/nfs/dbraw/zinc/07/90/52/460079052.db2.gz	YWINYEZVXZWXAR-UHFFFAOYSA-N	0	3	333.435	3.391	20	30		EGEDHN
CN(C)c1cccc(CN2CCCN(Cc3ccc(C#N)cc3)CC2)c1	ZINC000610211542	460084091	/nfs/dbraw/zinc/08/40/91/460084091.db2.gz	PHDLHDFEPNZPEM-UHFFFAOYSA-N	0	3	348.494	3.332	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)N[C@H]1CCCN2CCCC[C@H]12	ZINC000594071564	460087175	/nfs/dbraw/zinc/08/71/75/460087175.db2.gz	PSZBTJQWBAZWEU-DOTOQJQBSA-N	0	3	342.443	3.095	20	30		EGEDHN
CC(C)(C)N1CC[C@H](NC(=O)c2c(Cl)cc(C#N)cc2Cl)C1	ZINC000597920416	460112375	/nfs/dbraw/zinc/11/23/75/460112375.db2.gz	BQBPRHQAMZVIJD-NSHDSACASA-N	0	3	340.254	3.468	20	30		EGEDHN
CN(C[C@@H](O)COc1ccccc1C(F)(F)F)CC1(CC#N)CC1	ZINC000602783609	460122241	/nfs/dbraw/zinc/12/22/41/460122241.db2.gz	QWBWLUNHGZWUSR-CYBMUJFWSA-N	0	3	342.361	3.071	20	30		EGEDHN
CCc1ccc([C@H](C#N)N(C)C(=O)C2CCN(C3CC3)CC2)cc1	ZINC000589829233	460143106	/nfs/dbraw/zinc/14/31/06/460143106.db2.gz	AZJNXTRMUQJBNS-IBGZPJMESA-N	0	3	325.456	3.146	20	30		EGEDHN
CC(C)c1ccc(C[C@H](C)NCc2cnc3c(C#N)cnn3c2)cc1	ZINC000576517500	460158558	/nfs/dbraw/zinc/15/85/58/460158558.db2.gz	NPNSAZXZXSVLQH-HNNXBMFYSA-N	0	3	333.439	3.445	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)C(=O)NC[C@H](Cc1ccccc1)N(C)C	ZINC000594227022	460160509	/nfs/dbraw/zinc/16/05/09/460160509.db2.gz	QSNGQPRXSOBESQ-UWJYYQICSA-N	0	3	349.478	3.026	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)C(=O)N1CCCN(C(C)(C)C)CC1	ZINC000594258589	460175190	/nfs/dbraw/zinc/17/51/90/460175190.db2.gz	OTJIQAJVXVGZAU-INIZCTEOSA-N	0	3	327.472	3.070	20	30		EGEDHN
CN(CCc1ccccc1)[C@H]1CCN(C(=O)c2ccc(C#N)s2)C1	ZINC000598195129	460200250	/nfs/dbraw/zinc/20/02/50/460200250.db2.gz	KYGLYNBXQMIJEM-INIZCTEOSA-N	0	3	339.464	3.009	20	30		EGEDHN
COCc1csc(CNC(=O)C(C#N)CCc2ccccc2)c1	ZINC000598207568	460204573	/nfs/dbraw/zinc/20/45/73/460204573.db2.gz	SZVHHZJOJNJBGX-MRXNPFEDSA-N	0	3	328.437	3.283	20	30		EGEDHN
CCO[C@@H]1C[C@@H](NCC(=O)NC2(C#N)CCCCC2)C12CCCCC2	ZINC000618902416	460215123	/nfs/dbraw/zinc/21/51/23/460215123.db2.gz	AGWOIYUPPZASBR-IAGOWNOFSA-N	0	3	347.503	3.047	20	30		EGEDHN
CC[C@H](CN1CCCC1)NC(=O)Nc1cc(C#N)ccc1OC(C)C	ZINC000610717893	460224117	/nfs/dbraw/zinc/22/41/17/460224117.db2.gz	UMGMNXZZMTUHNX-MRXNPFEDSA-N	0	3	344.459	3.341	20	30		EGEDHN
C[C@H](NC[C@@H](O)CC1(C#N)CCOCC1)c1cc2ccccc2o1	ZINC000599358132	460237627	/nfs/dbraw/zinc/23/76/27/460237627.db2.gz	FABQCHHOBCIJEA-HOCLYGCPSA-N	0	3	328.412	3.155	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN1CCc2cc(C(F)(F)F)ccc2C1	ZINC000599636131	460293929	/nfs/dbraw/zinc/29/39/29/460293929.db2.gz	OBAXIAFCKYHGIX-OAHLLOKOSA-N	0	3	326.362	3.364	20	30		EGEDHN
CCOC(=O)C[C@@H](c1ccccc1)C1CCN(CC#CCOC)CC1	ZINC000611194835	460306237	/nfs/dbraw/zinc/30/62/37/460306237.db2.gz	UWZYBQUMTXRCAP-FQEVSTJZSA-N	0	3	343.467	3.085	20	30		EGEDHN
C[C@@H]1CC[C@H](C(F)(F)F)CN1C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000619306665	460325423	/nfs/dbraw/zinc/32/54/23/460325423.db2.gz	QMVDXRDSMGFABF-KCXAZCMYSA-N	0	3	349.356	3.430	20	30		EGEDHN
Cc1nnc2ccc(C(=O)C(C#N)c3ccc4ccccc4n3)cn12	ZINC000603627832	460328646	/nfs/dbraw/zinc/32/86/46/460328646.db2.gz	YKJGZFDDAIICEE-OAHLLOKOSA-N	0	3	327.347	3.076	20	30		EGEDHN
Cc1cccc(C(=O)NCCN[C@H]2CCCc3cc(C#N)ccc32)c1	ZINC000611391005	460352350	/nfs/dbraw/zinc/35/23/50/460352350.db2.gz	MFVJACWPDACOCD-FQEVSTJZSA-N	0	3	333.435	3.264	20	30		EGEDHN
N#CCC[C@@H](NC[C@H](O)COc1ccc(F)cc1)c1ccccc1	ZINC000611406933	460357002	/nfs/dbraw/zinc/35/70/02/460357002.db2.gz	CLKHUFPQMWKFRK-PKOBYXMFSA-N	0	3	328.387	3.200	20	30		EGEDHN
CCC(C#N)(CC)C(=O)NC[C@@H](CN(C)C)c1ccc(Cl)cc1	ZINC000599937599	460362043	/nfs/dbraw/zinc/36/20/43/460362043.db2.gz	XTHXHCMSRPCSTR-HNNXBMFYSA-N	0	3	335.879	3.431	20	30		EGEDHN
CCC(C#N)(CC)C(=O)NC[C@@H](c1ccc(SC)cc1)N(C)C	ZINC000599980350	460366238	/nfs/dbraw/zinc/36/62/38/460366238.db2.gz	YLZKWTHMEXVZJE-INIZCTEOSA-N	0	3	333.501	3.457	20	30		EGEDHN
N#Cc1cccc(CN2CCC(NCc3cnc(C4CC4)o3)CC2)c1	ZINC000600174666	460420095	/nfs/dbraw/zinc/42/00/95/460420095.db2.gz	DUPPDFSTGWECIV-UHFFFAOYSA-N	0	3	336.439	3.178	20	30		EGEDHN
CCN(Cc1ccc(C)cc1)C[C@@H](O)COc1ccc(CC#N)cc1	ZINC000604501434	460436006	/nfs/dbraw/zinc/43/60/06/460436006.db2.gz	QJCBGXAQNUWXNR-HXUWFJFHSA-N	0	3	338.451	3.323	20	30		EGEDHN
CC(C)[C@@H](C(=O)NCc1ccc(C#N)c(Cl)c1)N1CCCCC1	ZINC000619780779	460442888	/nfs/dbraw/zinc/44/28/88/460442888.db2.gz	BNHZWAYIOCNXCS-KRWDZBQOSA-N	0	3	333.863	3.338	20	30		EGEDHN
C[C@@H]1CCN(C(=O)c2ccccc2CC#N)CCN1Cc1ccccc1	ZINC000601262352	460768169	/nfs/dbraw/zinc/76/81/69/460768169.db2.gz	YUJITTKETJHKAU-GOSISDBHSA-N	0	3	347.462	3.489	20	30		EGEDHN
C=CCCC(C)(C)NC(=O)CCCN1CCN(c2ccccc2)CC1	ZINC000620858660	460811785	/nfs/dbraw/zinc/81/17/85/460811785.db2.gz	NNDLPVLJBJYDAL-UHFFFAOYSA-N	0	3	343.515	3.450	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@H]2CCCN3CCCC[C@H]23)cc1OC	ZINC000655350085	461200434	/nfs/dbraw/zinc/20/04/34/461200434.db2.gz	WPJMSBRCVUCSQD-DLBZAZTESA-N	0	3	344.455	3.007	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(F)c3ccncc23)CC1	ZINC000668369739	461259510	/nfs/dbraw/zinc/25/95/10/461259510.db2.gz	DCJNERIXKUJAGI-UHFFFAOYSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1CNCc1cc(OC)c(OC)cc1Cl	ZINC000631127758	461574316	/nfs/dbraw/zinc/57/43/16/461574316.db2.gz	VHUPBYZAGQCSRC-PXAZEXFGSA-N	0	3	325.836	3.428	20	30		EGEDHN
C=C(C)[C@H](NCCc1nnn(C(C)(C)C)n1)c1ccc(F)c(F)c1	ZINC000660311390	461701231	/nfs/dbraw/zinc/70/12/31/461701231.db2.gz	GZXNYPPKAZVYNG-INIZCTEOSA-N	0	3	335.402	3.156	20	30		EGEDHN
C=CCOc1cccc(NC[C@@H](O)CN(C)Cc2ccccc2)c1	ZINC000644686626	462038639	/nfs/dbraw/zinc/03/86/39/462038639.db2.gz	IJPMJSVQSIOPSH-LJQANCHMSA-N	0	3	326.440	3.156	20	30		EGEDHN
C=CCCn1cc(CN[C@@H](C)Cc2cccc(Br)c2)nn1	ZINC000657330184	462050721	/nfs/dbraw/zinc/05/07/21/462050721.db2.gz	LTQCZFAVDBUAEJ-ZDUSSCGKSA-N	0	3	349.276	3.338	20	30		EGEDHN
C=CC[C@@H]1CCCN([C@H](C)C(=O)Nc2ccc(OC)c(OC)c2)C1	ZINC000661379970	462225735	/nfs/dbraw/zinc/22/57/35/462225735.db2.gz	KBYFYEVCJBGCOB-HUUCEWRRSA-N	0	3	332.444	3.319	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H](C)Cc2ccc(OCC)cc2)CC1	ZINC000665243172	462366410	/nfs/dbraw/zinc/36/64/10/462366410.db2.gz	FEEDCORLWALXPY-KRWDZBQOSA-N	0	3	344.499	3.421	20	30		EGEDHN
C=CCN(Cc1ccc(Cl)s1)C(=O)C1(N)Cc2ccccc2C1	ZINC000649266350	462461235	/nfs/dbraw/zinc/46/12/35/462461235.db2.gz	DKIOPWAANNPFSF-UHFFFAOYSA-N	0	3	346.883	3.412	20	30		EGEDHN
C=CCN1CCC(NC(=O)CCCOc2ccccc2OCC)CC1	ZINC000171723731	526420157	/nfs/dbraw/zinc/42/01/57/526420157.db2.gz	KNMDPFHPHWIDCZ-UHFFFAOYSA-N	0	3	346.471	3.011	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](C)c2ccc(OC(C)C)cc2)CC1	ZINC000171710425	526436351	/nfs/dbraw/zinc/43/63/51/526436351.db2.gz	CUGGWVLQXMCLAE-INIZCTEOSA-N	0	3	345.487	3.484	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)CC1	ZINC000189728270	526448108	/nfs/dbraw/zinc/44/81/08/526448108.db2.gz	WCPQAJUIAITZET-UHFFFAOYSA-N	0	3	331.416	3.098	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)[C@H]2CCc3ccccc32)CC1	ZINC000171607324	526583381	/nfs/dbraw/zinc/58/33/81/526583381.db2.gz	GEXGRFTUKPNIFC-IBGZPJMESA-N	0	3	327.472	3.356	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H](c1ccc(OC)cc1)N1CCCC1	ZINC000179637619	526688947	/nfs/dbraw/zinc/68/89/47/526688947.db2.gz	QUFBSHFMBUCCCW-IBGZPJMESA-N	0	3	328.456	3.142	20	30		EGEDHN
CC(C)(C)[C@H](CCO)NCc1cc(C#N)ccc1Br	ZINC000191822577	526693111	/nfs/dbraw/zinc/69/31/11/526693111.db2.gz	NZDQNCHMEVIIMS-AWEZNQCLSA-N	0	3	325.250	3.207	20	30		EGEDHN
C=C(CNC(=O)NC[C@H](Cc1ccccc1)N(C)C)c1ccccc1	ZINC000672681368	548461630	/nfs/dbraw/zinc/46/16/30/548461630.db2.gz	NTNCTEXSUXYKQI-FQEVSTJZSA-N	0	3	337.467	3.172	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@H](CN(C)C)c2ccc(F)cc2)cc1	ZINC000673341142	548549604	/nfs/dbraw/zinc/54/96/04/548549604.db2.gz	GLYTXPYINRSJRF-LJQANCHMSA-N	0	3	342.414	3.423	20	30		EGEDHN
CCC#C[C@H](C)N(C)C[C@H](O)COc1ccccc1C(F)(F)F	ZINC000677479676	549277271	/nfs/dbraw/zinc/27/72/71/549277271.db2.gz	LOLQUQJGSXKKKT-KBPBESRZSA-N	0	3	329.362	3.179	20	30		EGEDHN
C=CCOc1ccc(CNCc2ccc(CC(N)=O)cc2)cc1Cl	ZINC000685624480	550433683	/nfs/dbraw/zinc/43/36/83/550433683.db2.gz	VYVMQPRQBKMXQQ-UHFFFAOYSA-N	0	3	344.842	3.222	20	30		EGEDHN
C=CCc1cc(OCC)cc(C[N@@H+]2CCCC[C@H]2CC(=O)OC)c1[O-]	ZINC000726588487	574562697	/nfs/dbraw/zinc/56/26/97/574562697.db2.gz	POXTXOSYTXEUBX-KRWDZBQOSA-N	0	3	347.455	3.437	20	30		EGEDHN
C=CCc1cc(OCC)cc(C[N@H+]2CCCC[C@H]2CC(=O)OC)c1[O-]	ZINC000726588487	574562698	/nfs/dbraw/zinc/56/26/98/574562698.db2.gz	POXTXOSYTXEUBX-KRWDZBQOSA-N	0	3	347.455	3.437	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CNC[C@@H](c2ccsc2)N(C)C)cc1	ZINC000728712897	574767776	/nfs/dbraw/zinc/76/77/76/574767776.db2.gz	CAZXIDCGUVRCLB-KSSFIOAISA-N	0	3	329.469	3.431	20	30		EGEDHN
COc1cccc(O)c1/C=N/CCc1ccc(OCCN(C)C)cc1	ZINC000729150069	574818941	/nfs/dbraw/zinc/81/89/41/574818941.db2.gz	QPJCPCFEJIWIHB-RCCKNPSSSA-N	0	3	342.439	3.003	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/CCCN2CCCCC2=O)c([O-])c1	ZINC000730146868	574925258	/nfs/dbraw/zinc/92/52/58/574925258.db2.gz	HMTSPOAKELYYCS-HMMYKYKNSA-N	0	3	331.460	3.060	20	30		EGEDHN
C=CCNC(=O)C(C#N)C(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl	ZINC000730686514	575010127	/nfs/dbraw/zinc/01/01/27/575010127.db2.gz	GUCXYRALMDEDGF-YNEHKIRRSA-N	0	3	337.206	3.108	20	30		EGEDHN
C=CCN(C(=O)NCC1(N2CCSCC2)CCCCC1)C(C)C	ZINC000732702944	575283535	/nfs/dbraw/zinc/28/35/35/575283535.db2.gz	FAQMSXLTGVFUAH-UHFFFAOYSA-N	0	3	339.549	3.344	20	30		EGEDHN
C=CCn1c2ccccc2n(CN2CCN(C3CCC3)CC2)c1=S	ZINC000733296060	575325933	/nfs/dbraw/zinc/32/59/33/575325933.db2.gz	JTXMMBHYWSLVMB-UHFFFAOYSA-N	0	3	342.512	3.486	20	30		EGEDHN
C#CCOc1ccc(CNC[C@H]2CCCN2C(=O)OC(C)(C)C)cc1	ZINC000733328364	575328137	/nfs/dbraw/zinc/32/81/37/575328137.db2.gz	SBKICGUGSGYGCX-QGZVFWFLSA-N	0	3	344.455	3.188	20	30		EGEDHN
Cc1nc(CCC(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)cs1	ZINC000733679056	575381208	/nfs/dbraw/zinc/38/12/08/575381208.db2.gz	SKTUHTBPJPQSHD-AWEZNQCLSA-N	0	3	347.827	3.385	20	30		EGEDHN
CC[C@H](C#N)Oc1cccc(CNCc2ccccc2-n2cncn2)c1	ZINC000733800104	575397909	/nfs/dbraw/zinc/39/79/09/575397909.db2.gz	HVOYHRYQYKHCOQ-GOSISDBHSA-N	0	3	347.422	3.238	20	30		EGEDHN
CCOCCCN1CCC(=NNC(=S)Nc2ccccc2)[C@@H](C)C1	ZINC000735224429	575618977	/nfs/dbraw/zinc/61/89/77/575618977.db2.gz	RGWWFPAKCMZMGC-HNNXBMFYSA-N	0	3	348.516	3.097	20	30		EGEDHN
C=CCc1cc(C(=O)N[C@@H](CC)CN2CCCC2)cc(OC)c1OC	ZINC000735924172	575737529	/nfs/dbraw/zinc/73/75/29/575737529.db2.gz	PIPMUOHXICBSET-KRWDZBQOSA-N	0	3	346.471	3.037	20	30		EGEDHN
C#CCSCCNCc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1	ZINC000740015058	576532371	/nfs/dbraw/zinc/53/23/71/576532371.db2.gz	SNHNRTFKHIYJML-UHFFFAOYSA-N	0	3	346.408	3.319	20	30		EGEDHN
C=C(C)CN1CCC(NC(=S)N[C@H]2CCOc3ccccc32)CC1	ZINC000741491893	576692065	/nfs/dbraw/zinc/69/20/65/576692065.db2.gz	WEDGNLYUDLDTKQ-KRWDZBQOSA-N	0	3	345.512	3.015	20	30		EGEDHN
C#CCOc1ccc(C(=O)NC2CCN(Cc3ccccc3)CC2)cc1	ZINC000741527691	576697094	/nfs/dbraw/zinc/69/70/94/576697094.db2.gz	KMSZQXPBHSWIGM-UHFFFAOYSA-N	0	3	348.446	3.093	20	30		EGEDHN
C#CCOc1ccc(C(=O)N(CCN(C)C)CC2CCCCC2)cc1	ZINC000741677576	576710498	/nfs/dbraw/zinc/71/04/98/576710498.db2.gz	WAAFYVWDUYMNHH-UHFFFAOYSA-N	0	3	342.483	3.283	20	30		EGEDHN
C/C(=C\C(=O)N(CCN(C)C)Cc1cccc(C#N)c1)C(C)(C)C	ZINC000742592366	576791222	/nfs/dbraw/zinc/79/12/22/576791222.db2.gz	AGHJIFZMSJRPQC-FOWTUZBSSA-N	0	3	327.472	3.441	20	30		EGEDHN
C#CCOc1ccc(C(=O)N2CC[C@H](N(C)Cc3ccccc3)C2)cc1	ZINC000742793138	576795560	/nfs/dbraw/zinc/79/55/60/576795560.db2.gz	KSPPMVPCOROIMY-FQEVSTJZSA-N	0	3	348.446	3.045	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2ccc(OCCCCC)cc2)CC1	ZINC000743491303	576810298	/nfs/dbraw/zinc/81/02/98/576810298.db2.gz	DVBCUJQKSNWMBM-UHFFFAOYSA-N	0	3	342.483	3.473	20	30		EGEDHN
C[C@H](C(=O)C(C#N)C(=O)NCc1ccccc1)c1cccc(Cl)c1	ZINC000744027271	576819147	/nfs/dbraw/zinc/81/91/47/576819147.db2.gz	OMOVOLDAGZQQJR-GUYCJALGSA-N	0	3	340.810	3.469	20	30		EGEDHN
CC(C)CN(Cc1nc2ccccc2c(=O)n1CC#N)C1CCCC1	ZINC000744391839	576826967	/nfs/dbraw/zinc/82/69/67/576826967.db2.gz	MAWLEJWLOQHCIQ-UHFFFAOYSA-N	0	3	338.455	3.321	20	30		EGEDHN
C#CCN(Cc1ccc(F)cc1)C(=O)N[C@@H](C)CN1CCC[C@@H](C)C1	ZINC000744857804	576835683	/nfs/dbraw/zinc/83/56/83/576835683.db2.gz	ZDGOYYLLWCBBLH-SJORKVTESA-N	0	3	345.462	3.091	20	30		EGEDHN
CCc1ccc(C(=O)N(CCN(C)C)Cc2cccc(C#N)c2)s1	ZINC000065930996	1292098575	/nfs/dbraw/zinc/09/85/75/1292098575.db2.gz	KNVYYGPPFLSRBV-UHFFFAOYSA-N	0	3	341.480	3.386	20	30		EGEDHN
C#CCOc1ccccc1CN1CCC[C@@H]1C[C@H](O)c1ccco1	ZINC000091958670	1292850487	/nfs/dbraw/zinc/85/04/87/1292850487.db2.gz	BIKMKHVGQRIVCI-MSOLQXFVSA-N	0	3	325.408	3.380	20	30		EGEDHN
CCN1CCN(c2ccc(NC(=O)c3ccc(C)c(C#N)c3)cc2)CC1	ZINC000096617930	1292951000	/nfs/dbraw/zinc/95/10/00/1292951000.db2.gz	PHCFEGUHOLVURE-UHFFFAOYSA-N	0	3	348.450	3.261	20	30		EGEDHN
COc1ccccc1[C@H](C)CC(=O)C(C#N)C(=O)NC1CCCCC1	ZINC000103329980	1293002771	/nfs/dbraw/zinc/00/27/71/1293002771.db2.gz	WXUXGZVCQMNYQP-PBHICJAKSA-N	0	3	342.439	3.347	20	30		EGEDHN
C#CCOc1cccc(NC(=O)NC[C@@H](c2ccccc2)N(C)C)c1	ZINC000108520486	1293082726	/nfs/dbraw/zinc/08/27/26/1293082726.db2.gz	SSLLAPOOQLQEGZ-IBGZPJMESA-N	0	3	337.423	3.123	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1N[C@@H](C)c1cc(Br)ncc1F	ZINC000834891535	1293165356	/nfs/dbraw/zinc/16/53/56/1293165356.db2.gz	IZFHQOWZSIFDJP-BIMULSAOSA-N	0	3	329.213	3.367	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)COCC2CCCC2)cc1	ZINC000835061629	1293196114	/nfs/dbraw/zinc/19/61/14/1293196114.db2.gz	ILCASLRYWKGGRX-QGZVFWFLSA-N	0	3	328.412	3.103	20	30		EGEDHN
CN(C)Cc1cccc(C(=O)OC[C@H](C#N)Cc2cccs2)c1	ZINC000835261659	1293246464	/nfs/dbraw/zinc/24/64/64/1293246464.db2.gz	WWQTWAAZPRZQRQ-HNNXBMFYSA-N	0	3	328.437	3.349	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)CSCCC(C)C)c1	ZINC000121264364	1293362313	/nfs/dbraw/zinc/36/23/13/1293362313.db2.gz	IPLSGDGOLOFWBB-HNNXBMFYSA-N	0	3	334.441	3.122	20	30		EGEDHN
CCc1ccc([C@H](C)CC(=O)C(C#N)C(=O)Nc2ccccn2)cc1	ZINC000121866486	1293394009	/nfs/dbraw/zinc/39/40/09/1293394009.db2.gz	NSAWQELJFDIYLU-RHSMWYFYSA-N	0	3	335.407	3.485	20	30		EGEDHN
C#CCCCCNC(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1	ZINC000122468907	1293412948	/nfs/dbraw/zinc/41/29/48/1293412948.db2.gz	ZHJNYDAIDSVXGT-LJQANCHMSA-N	0	3	327.472	3.235	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)CCC(=O)c1cccs1	ZINC000122631916	1293420080	/nfs/dbraw/zinc/42/00/80/1293420080.db2.gz	LDXLCMFQXCAAOS-LBPRGKRZSA-N	0	3	337.404	3.474	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)CCc1ccc(C#N)cc1	ZINC000122967608	1293430568	/nfs/dbraw/zinc/43/05/68/1293430568.db2.gz	ALGSFXJUGXSITK-INIZCTEOSA-N	0	3	328.375	3.254	20	30		EGEDHN
N#CC(C(=O)COc1ccccc1-c1ccccc1)C(=O)N1CCCC1	ZINC000124443700	1293475388	/nfs/dbraw/zinc/47/53/88/1293475388.db2.gz	CLRPTQYULLAAAO-SFHVURJKSA-N	0	3	348.402	3.064	20	30		EGEDHN
Cc1ccc(C(C)C)cc1O[C@@H](C)C(=O)C(C#N)C(=O)N1CCCC1	ZINC000124844797	1293487090	/nfs/dbraw/zinc/48/70/90/1293487090.db2.gz	KTCJBLMUPAWOGL-RDJZCZTQSA-N	0	3	342.439	3.217	20	30		EGEDHN
CCc1ccc(OCC(=O)C(C#N)C(=O)Nc2cccc(C)c2)cc1	ZINC000127496301	1293565869	/nfs/dbraw/zinc/56/58/69/1293565869.db2.gz	XIHFNSBISMLIGM-SFHVURJKSA-N	0	3	336.391	3.284	20	30		EGEDHN
COc1ccc(CCCC(=O)C(C#N)C(=O)Nc2ccccc2)cc1	ZINC000127888189	1293576098	/nfs/dbraw/zinc/57/60/98/1293576098.db2.gz	IEPDJVSHTKXCIL-GOSISDBHSA-N	0	3	336.391	3.365	20	30		EGEDHN
N#CC(C(=O)CC(c1ccccc1)c1ccccc1)C(=O)NC1CC1	ZINC000129098565	1293613549	/nfs/dbraw/zinc/61/35/49/1293613549.db2.gz	BVNCZKUHESZQSM-LJQANCHMSA-N	0	3	332.403	3.196	20	30		EGEDHN
C[C@H](CC(=O)C(C#N)C(=O)Nc1ccccn1)c1ccc(F)cc1F	ZINC000152703763	1293982367	/nfs/dbraw/zinc/98/23/67/1293982367.db2.gz	FMKFWKIFMYHKQN-BXUZGUMPSA-N	0	3	343.333	3.201	20	30		EGEDHN
C[C@H](C(=O)C(C#N)C(=O)Nc1ccccc1)c1c(F)cccc1F	ZINC000153292844	1294007229	/nfs/dbraw/zinc/00/72/29/1294007229.db2.gz	CVOCIMDYRQRNNC-AAEUAGOBSA-N	0	3	328.318	3.416	20	30		EGEDHN
Cc1nc(CCCC(=O)C(C#N)C(=O)Nc2ccccc2)cs1	ZINC000175106962	1294540898	/nfs/dbraw/zinc/54/08/98/1294540898.db2.gz	QDAFOVDYLXGYRX-HNNXBMFYSA-N	0	3	327.409	3.122	20	30		EGEDHN
C[C@H](NCc1ccc([S@](C)=O)cc1)c1ccc(OCC#N)cc1	ZINC000175992508	1294584188	/nfs/dbraw/zinc/58/41/88/1294584188.db2.gz	JVQYHRGKSRQUSI-PSLXWICFSA-N	0	3	328.437	3.177	20	30		EGEDHN
CC[C@H](NC(C)=O)C(=O)C(C#N)c1nc(-c2ccc(C)cc2)cs1	ZINC000870150023	1295704477	/nfs/dbraw/zinc/70/44/77/1295704477.db2.gz	POUMCPNDFOWWBP-GJZGRUSLSA-N	0	3	341.436	3.210	20	30		EGEDHN
CC[C@H](NC(C)=O)C(=O)C(C#N)c1nc(-c2ccc(C)cc2)cs1	ZINC000870150021	1295705222	/nfs/dbraw/zinc/70/52/22/1295705222.db2.gz	POUMCPNDFOWWBP-CABCVRRESA-N	0	3	341.436	3.210	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(Cl)cc1Cl)C(=O)c1cccnc1	ZINC000193465224	1295872600	/nfs/dbraw/zinc/87/26/00/1295872600.db2.gz	MZTMXGAJOWVRJD-LLVKDONJSA-N	0	3	334.162	3.350	20	30		EGEDHN
N#CC(C(=O)C[C@H]1CCCO1)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000193481726	1295875215	/nfs/dbraw/zinc/87/52/15/1295875215.db2.gz	BLNOFRFBYMPTLO-CHWSQXEVSA-N	0	3	341.194	3.210	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CNCc2ccc(-n3cccn3)cc2)cc1	ZINC000237495584	1296245684	/nfs/dbraw/zinc/24/56/84/1296245684.db2.gz	QKSVOLMNDXVZNX-INIZCTEOSA-N	0	3	332.407	3.453	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1	ZINC000245928003	1296330609	/nfs/dbraw/zinc/33/06/09/1296330609.db2.gz	OVPCLUGMIVBILC-ARFHVFGLSA-N	0	3	332.831	3.459	20	30		EGEDHN
N#CC(C(=O)NC1CC1)C(=O)[C@@H]1C[C@H]1c1cc(Cl)cc(Cl)c1	ZINC000246484417	1296355356	/nfs/dbraw/zinc/35/53/56/1296355356.db2.gz	CUBQFLDMAWAUPT-MJBXVCDLSA-N	0	3	337.206	3.084	20	30		EGEDHN
Cc1cccc(CN(CCN(C)C)C(=O)/C=C\c2ccccc2C#N)c1	ZINC000254943596	1296481883	/nfs/dbraw/zinc/48/18/83/1296481883.db2.gz	CXJRBPDNMKPULU-QXMHVHEDSA-N	0	3	347.462	3.470	20	30		EGEDHN
C[C@H](NC[C@@H](O)COc1ccccc1C#N)c1ccc(Cl)s1	ZINC000315440780	1297136924	/nfs/dbraw/zinc/13/69/24/1297136924.db2.gz	ZBZNEWKTOWLFQX-WCQYABFASA-N	0	3	336.844	3.364	20	30		EGEDHN
CC[C@H](Cc1cccc(C)c1)C(=O)C(C#N)C(=O)NC1CCCC1	ZINC000873498932	1297544911	/nfs/dbraw/zinc/54/49/11/1297544911.db2.gz	UUULPQWFRHBMJN-SJLPKXTDSA-N	0	3	326.440	3.331	20	30		EGEDHN
C#CCOc1ccc(Br)cc1CNC[C@@H](OC)C(C)C	ZINC000381696442	1297553935	/nfs/dbraw/zinc/55/39/35/1297553935.db2.gz	NMGZLOYRRSWEJY-MRXNPFEDSA-N	0	3	340.261	3.222	20	30		EGEDHN
C#CCOc1ccc(CN[C@H](C)c2ccc(N3CCNC3=O)cc2)cc1	ZINC000585086977	1298026115	/nfs/dbraw/zinc/02/61/15/1298026115.db2.gz	PDZYIUYAEIUURE-MRXNPFEDSA-N	0	3	349.434	3.079	20	30		EGEDHN
C#CCN(C[C@H](O)COCc1ccccc1)[C@@H]1CCc2ccccc21	ZINC000747528051	1298795119	/nfs/dbraw/zinc/79/51/19/1298795119.db2.gz	HVMMOESLKWZKDU-RBBKRZOGSA-N	0	3	335.447	3.187	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(F)c(Cl)c1)C(=O)C1CC(F)(F)C1	ZINC000753801555	1300021710	/nfs/dbraw/zinc/02/17/10/1300021710.db2.gz	KCTBJLKSEXDDDB-VIFPVBQESA-N	0	3	330.693	3.172	20	30		EGEDHN
CC(=O)[C@@](C#N)(CCN1CCC([C@@H]2CCCO2)CC1)c1ccccc1	ZINC000878483075	1300027735	/nfs/dbraw/zinc/02/77/35/1300027735.db2.gz	GCBLYSMWULXOEK-SFTDATJTSA-N	0	3	340.467	3.318	20	30		EGEDHN
C#CC(=O)N(CCN1CCCC1)Cc1ccc(Cl)c(Cl)c1	ZINC000753963490	1300054117	/nfs/dbraw/zinc/05/41/17/1300054117.db2.gz	NYANBNLVGXQQEM-UHFFFAOYSA-N	0	3	325.239	3.051	20	30		EGEDHN
C[C@@H](C(=O)N(CCC#N)c1ccc(F)cc1)N1C[C@@H]2CC=CC[C@@H]2C1	ZINC000879528550	1300583281	/nfs/dbraw/zinc/58/32/81/1300583281.db2.gz	GQOWVDMTRCOGEK-YESZJQIVSA-N	0	3	341.430	3.359	20	30		EGEDHN
CCOC(=O)c1sc(C2CCN([C@@H]3CC[C@H](C#N)C3)CC2)nc1C	ZINC000879679273	1300671934	/nfs/dbraw/zinc/67/19/34/1300671934.db2.gz	JCJYGWFDAQEYBW-DZGCQCFKSA-N	0	3	347.484	3.500	20	30		EGEDHN
CCCN(CCN1CCCC1)C(=O)Nc1cc(C#N)c(F)cc1F	ZINC000880712177	1301237290	/nfs/dbraw/zinc/23/72/90/1301237290.db2.gz	FHJIUTGWDJUQJQ-UHFFFAOYSA-N	0	3	336.386	3.176	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cnccc2C(F)(F)F)CC1	ZINC000880971407	1301367064	/nfs/dbraw/zinc/36/70/64/1301367064.db2.gz	NWGUDXDBZKATTB-UHFFFAOYSA-N	0	3	342.365	3.262	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@H](C)c1cccc([N+](=O)[O-])c1	ZINC000763928160	1301982736	/nfs/dbraw/zinc/98/27/36/1301982736.db2.gz	BOACVQANVCMYKP-CJNGLKHVSA-N	0	3	345.399	3.104	20	30		EGEDHN
C#CC[C@@H](CO)NCc1cn(C(C)(C)C)nc1-c1ccccc1Cl	ZINC000883123619	1302260602	/nfs/dbraw/zinc/26/06/02/1302260602.db2.gz	FBCHMBDJWGZTER-HNNXBMFYSA-N	0	3	345.874	3.432	20	30		EGEDHN
CC(C)(C)n1cc(C#N)cc1NC(=O)NC[C@@H]1CCCCN1C1CC1	ZINC000766237282	1302413753	/nfs/dbraw/zinc/41/37/53/1302413753.db2.gz	YGEMORKIBYLMSF-INIZCTEOSA-N	0	3	343.475	3.253	20	30		EGEDHN
N#CC(C(=O)Nc1ccccn1)C(=O)c1ccc(-c2ccco2)s1	ZINC000766279072	1302419802	/nfs/dbraw/zinc/41/98/02/1302419802.db2.gz	XRABRFBZDKWSDV-NSHDSACASA-N	0	3	337.360	3.364	20	30		EGEDHN
C#CCOc1ccc(CN2CCC[C@H](CC(=O)OC(C)C)C2)cc1	ZINC000768529489	1302925983	/nfs/dbraw/zinc/92/59/83/1302925983.db2.gz	PGSIXGAMQJMDNK-GOSISDBHSA-N	0	3	329.440	3.252	20	30		EGEDHN
CCOc1ccc(CN(CCOC)Cc2ccc(C#N)cc2)c(O)c1	ZINC000768619794	1302946774	/nfs/dbraw/zinc/94/67/74/1302946774.db2.gz	MIFOCJCYHCEJNR-UHFFFAOYSA-N	0	3	340.423	3.311	20	30		EGEDHN
CCOc1ccc(C[N@H+](CCOC)Cc2ccc(C#N)cc2)c([O-])c1	ZINC000768619794	1302946783	/nfs/dbraw/zinc/94/67/83/1302946783.db2.gz	MIFOCJCYHCEJNR-UHFFFAOYSA-N	0	3	340.423	3.311	20	30		EGEDHN
CCOc1ccc(C[N@@H+](CCOC)Cc2ccc(C#N)cc2)c([O-])c1	ZINC000768619794	1302946791	/nfs/dbraw/zinc/94/67/91/1302946791.db2.gz	MIFOCJCYHCEJNR-UHFFFAOYSA-N	0	3	340.423	3.311	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)[C@H](F)c1ccccc1	ZINC000769280679	1303084169	/nfs/dbraw/zinc/08/41/69/1303084169.db2.gz	BXJRXZQFDJMBHG-WMLDXEAASA-N	0	3	340.354	3.443	20	30		EGEDHN
C[C@@H](C#N)Oc1ccccc1NC(=O)NCCN1CCCC(C)(C)C1	ZINC000770655034	1303300485	/nfs/dbraw/zinc/30/04/85/1303300485.db2.gz	SUPUXIMMCIWJFO-HNNXBMFYSA-N	0	3	344.459	3.221	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@H]1CNCc1ccc(C#N)cc1F	ZINC000772929477	1303596790	/nfs/dbraw/zinc/59/67/90/1303596790.db2.gz	SXHGCZGUTDBOHB-HNNXBMFYSA-N	0	3	333.407	3.186	20	30		EGEDHN
C=C(C)[C@H](NC(=S)NC1CCN(C)CC1)c1ccc(F)c(F)c1	ZINC000774206197	1303786422	/nfs/dbraw/zinc/78/64/22/1303786422.db2.gz	NGHYJKIZIIACEO-INIZCTEOSA-N	0	3	339.455	3.140	20	30		EGEDHN
C#C[C@@H](C)N(C)Cc1sc(N2CCOCC2)nc1-c1ccccc1	ZINC000775182562	1303920161	/nfs/dbraw/zinc/92/01/61/1303920161.db2.gz	CYQGQSOVTWCCOP-OAHLLOKOSA-N	0	3	341.480	3.100	20	30		EGEDHN
Cc1ccc(CC(=O)C(C#N)C(=O)Nc2ccc(F)c(Cl)c2)o1	ZINC000775227359	1303927331	/nfs/dbraw/zinc/92/73/31/1303927331.db2.gz	OPJBWPSCJOMPIX-LBPRGKRZSA-N	0	3	334.734	3.271	20	30		EGEDHN
CC(C)(C)c1ccc(C2(NCC(=O)NCCC#N)CCCC2)cc1	ZINC000775544941	1303981855	/nfs/dbraw/zinc/98/18/55/1303981855.db2.gz	LYQPJVCQONJLHU-UHFFFAOYSA-N	0	3	327.472	3.373	20	30		EGEDHN
N#CCC[C@@H](NC[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1	ZINC000776606114	1304179516	/nfs/dbraw/zinc/17/95/16/1304179516.db2.gz	RQXGFQXHDOYVJZ-MSOLQXFVSA-N	0	3	325.368	3.263	20	30		EGEDHN
C=C[C@@](C)(O)CC(=O)N(CCC)C1CCN(Cc2ccccc2)CC1	ZINC000889489690	1304500952	/nfs/dbraw/zinc/50/09/52/1304500952.db2.gz	UCZHNWUWWMZLNZ-OAQYLSRUSA-N	0	3	344.499	3.217	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)[C@H]1CCCCS1	ZINC000783352975	1305083285	/nfs/dbraw/zinc/08/32/85/1305083285.db2.gz	NZKOUKZJOOMTQA-SWLSCSKDSA-N	0	3	332.425	3.018	20	30		EGEDHN
C[C@@]1(C#N)CCCN(CC(=O)C(C#N)c2nc3ccccc3s2)C1	ZINC000784453128	1305245997	/nfs/dbraw/zinc/24/59/97/1305245997.db2.gz	HJXFYAIGEPBSPS-ACJLOTCBSA-N	0	3	338.436	3.098	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)[C@H]3CC(=O)c4ccccc43)nc21	ZINC000789376512	1306149276	/nfs/dbraw/zinc/14/92/76/1306149276.db2.gz	AAEULFWGKQQGBI-GJZGRUSLSA-N	0	3	329.359	3.418	20	30		EGEDHN
Cc1cccc2nc(C(C#N)C(=O)[C@H]3CC(=O)c4ccccc43)[nH]c21	ZINC000789376512	1306149280	/nfs/dbraw/zinc/14/92/80/1306149280.db2.gz	AAEULFWGKQQGBI-GJZGRUSLSA-N	0	3	329.359	3.418	20	30		EGEDHN
CCCCCCCCNS(=O)(=O)c1ccc(CN(C)C)cc1	ZINC000790041418	1306252915	/nfs/dbraw/zinc/25/29/15/1306252915.db2.gz	GHWUAAQHPYDYSV-UHFFFAOYSA-N	0	3	326.506	3.387	20	30		EGEDHN
Cc1nn(Cc2ccccc2)c(Cl)c1C=NNc1nccn1C	ZINC000790306301	1306296821	/nfs/dbraw/zinc/29/68/21/1306296821.db2.gz	WTUKVWLPTIHOJT-UHFFFAOYSA-N	0	3	328.807	3.073	20	30		EGEDHN
C[C@H](NC[C@@H](O)c1ccc(C#N)cc1)c1ccc(Br)cn1	ZINC000796498628	1310015295	/nfs/dbraw/zinc/01/52/95/1310015295.db2.gz	NMKCZAFTAJIHMU-MEDUHNTESA-N	0	3	346.228	3.100	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)COC2CCC(C)CC2)cc1	ZINC000796637248	1310051939	/nfs/dbraw/zinc/05/19/39/1310051939.db2.gz	UGOQBGPWZQFLRM-UYJHFMRCSA-N	0	3	342.439	3.492	20	30		EGEDHN
CC(C)(C)c1cnc(C(C#N)C(=O)c2ccc(N)c([N+](=O)[O-])c2)s1	ZINC000797568925	1310212909	/nfs/dbraw/zinc/21/29/09/1310212909.db2.gz	XZRUHPVEAOFXAT-SNVBAGLBSA-N	0	3	344.396	3.421	20	30		EGEDHN
CC(C)[C@@H](C(=O)C(C#N)c1ncc(C(C)(C)C)s1)N1CCCC1=O	ZINC000797572440	1310214005	/nfs/dbraw/zinc/21/40/05/1310214005.db2.gz	ZSJVNEXQBFCMHK-DOMZBBRYSA-N	0	3	347.484	3.264	20	30		EGEDHN
C#C[C@H](NC(=O)NC[C@H](c1cccc(OC)c1)N(CC)CC)C(C)C	ZINC000798510177	1310374597	/nfs/dbraw/zinc/37/45/97/1310374597.db2.gz	LSJHOUFFAYAVAQ-RBUKOAKNSA-N	0	3	345.487	3.035	20	30		EGEDHN
COc1ccc([C@H](NC(C)C)C(=O)NCC(C)(C)CCC#N)cc1	ZINC000897769186	1310461028	/nfs/dbraw/zinc/46/10/28/1310461028.db2.gz	AHIWZFUJDKSWJG-KRWDZBQOSA-N	0	3	331.460	3.180	20	30		EGEDHN
N#CC1(CCCOC(=O)[C@H]2CCCN2C2CCCC2)CCOCC1	ZINC000800219838	1310705747	/nfs/dbraw/zinc/70/57/47/1310705747.db2.gz	AJHYQMJDSDKFJZ-QGZVFWFLSA-N	0	3	334.460	3.037	20	30		EGEDHN
C[C@@H]1C[C@H](C)[C@H](C(=O)C(C#N)C(=O)Nc2cccc3ccccc32)O1	ZINC000800384924	1310746824	/nfs/dbraw/zinc/74/68/24/1310746824.db2.gz	NGEPXWXBVUPQQG-HAELCTKSSA-N	0	3	336.391	3.301	20	30		EGEDHN
CC(C)(CC#N)CNCc1cc2ccccc2nc1N1CCOCC1	ZINC000839162808	1320883055	/nfs/dbraw/zinc/88/30/55/1320883055.db2.gz	BXAXRGWKEQDPFE-UHFFFAOYSA-N	0	3	338.455	3.101	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CC[C@H](N[C@H](C)c2ccccc2F)C1	ZINC001018968874	1316988989	/nfs/dbraw/zinc/98/89/89/1316988989.db2.gz	AJUWGLNXEVGKPA-CVEARBPZSA-N	0	3	341.430	3.379	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)C[C@@H]3CC=CCC3)C2)cc1F	ZINC001019243951	1317120815	/nfs/dbraw/zinc/12/08/15/1317120815.db2.gz	MXXJNQWQEUHLHM-QAPCUYQASA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3ccnc(Cl)c3)C2)CC1	ZINC001019331172	1317172022	/nfs/dbraw/zinc/17/20/22/1317172022.db2.gz	LGGAJFNZNZLQCX-INIZCTEOSA-N	0	3	333.863	3.172	20	30		EGEDHN
CC1(C)CC[C@@H](C(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)C1	ZINC001019347853	1317183120	/nfs/dbraw/zinc/18/31/20/1317183120.db2.gz	QPSLSBQDGGDXTQ-KGLIPLIRSA-N	0	3	331.485	3.137	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@H](NCc3ccc(F)c(C#N)c3)C2)cc1	ZINC001019699540	1317348300	/nfs/dbraw/zinc/34/83/00/1317348300.db2.gz	FRZUKUHNATUQIP-SFHVURJKSA-N	0	3	337.398	3.010	20	30		EGEDHN
CC1(C(=O)OCCCSCC#N)CCN(Cc2ccccc2)CC1	ZINC000805531956	1317381687	/nfs/dbraw/zinc/38/16/87/1317381687.db2.gz	KAQAGWISBIHHHS-UHFFFAOYSA-N	0	3	346.496	3.479	20	30		EGEDHN
C=CCC[NH+]1CCC2(CCN(C(=O)c3ccccc3[O-])CC2)CC1	ZINC000957504476	1317411801	/nfs/dbraw/zinc/41/18/01/1317411801.db2.gz	IBASFLUIUWZTFV-UHFFFAOYSA-N	0	3	328.456	3.287	20	30		EGEDHN
CC1=CC[C@@](C)(C(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)CC1	ZINC001019803837	1317431691	/nfs/dbraw/zinc/43/16/91/1317431691.db2.gz	RDTCYZDDHLZPHP-HNAYVOBHSA-N	0	3	343.496	3.447	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1)=C([O-])c1ccc(C[NH+]2CCCC2)cc1	ZINC000805852988	1317432027	/nfs/dbraw/zinc/43/20/27/1317432027.db2.gz	DLGCNCPUCUSPIR-IBGZPJMESA-N	0	3	347.418	3.244	20	30		EGEDHN
N#C[C@H](C(=O)Nc1ccccc1)C(=O)c1ccc(CN2CCCC2)cc1	ZINC000805852988	1317432034	/nfs/dbraw/zinc/43/20/34/1317432034.db2.gz	DLGCNCPUCUSPIR-IBGZPJMESA-N	0	3	347.418	3.244	20	30		EGEDHN
C[C@H](Cc1cncc2ccccc21)C(=O)C(C#N)C(=O)NC1CCCC1	ZINC000805858529	1317432634	/nfs/dbraw/zinc/43/26/34/1317432634.db2.gz	RQRQCUKLBUKSNK-KUHUBIRLSA-N	0	3	349.434	3.181	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)[C@@H]2CCCC3(CC3)C2)C1	ZINC001020150439	1317563903	/nfs/dbraw/zinc/56/39/03/1317563903.db2.gz	UMIOFMUPMSHHTA-MGPQQGTHSA-N	0	3	341.293	3.102	20	30		EGEDHN
CC[C@H](NCc1cccc(NS(C)(=O)=O)c1)c1cccc(C#N)c1	ZINC000902732467	1317609381	/nfs/dbraw/zinc/60/93/81/1317609381.db2.gz	DLBUXNOWPNDWGU-SFHVURJKSA-N	0	3	343.452	3.171	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc(C)c3ccccc3n2)C1	ZINC001020307312	1317638573	/nfs/dbraw/zinc/63/85/73/1317638573.db2.gz	ATKOQVAFJNYCND-HDJSIYSDSA-N	0	3	329.831	3.146	20	30		EGEDHN
C[C@H](NCc1cc(C#N)ccc1F)C1(NC(=O)OC(C)(C)C)CC1	ZINC000903122117	1317656727	/nfs/dbraw/zinc/65/67/27/1317656727.db2.gz	VQUNJVCKRPVQQJ-LBPRGKRZSA-N	0	3	333.407	3.233	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)c2cc(C)sc2C)C1	ZINC001020361759	1317661326	/nfs/dbraw/zinc/66/13/26/1317661326.db2.gz	GXMFHJPTXBLZNZ-HAQNSBGRSA-N	0	3	343.290	3.124	20	30		EGEDHN
COc1ccc(CNCc2ccc(OC)c(OC)c2C)cc1C#N	ZINC000808399782	1317671659	/nfs/dbraw/zinc/67/16/59/1317671659.db2.gz	RSIIPLRPDFDYIY-UHFFFAOYSA-N	0	3	326.396	3.182	20	30		EGEDHN
CC1(C)CCC[C@H]1C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001020478441	1317713239	/nfs/dbraw/zinc/71/32/39/1317713239.db2.gz	MSTNGAKBZSVAFK-ULQDDVLXSA-N	0	3	343.446	3.260	20	30		EGEDHN
C[C@@H]1CC[C@H](CC(=O)N[C@H]2C[C@H](NCc3ccc(C#N)cc3F)C2)C1	ZINC001020482548	1317718063	/nfs/dbraw/zinc/71/80/63/1317718063.db2.gz	GPVYUBJLVVSNSR-LTCOOKNTSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc3cccc(OC)c3o2)C1	ZINC001020524485	1317743685	/nfs/dbraw/zinc/74/36/85/1317743685.db2.gz	SVJSLAXHNUZBAO-JOCQHMNTSA-N	0	3	334.803	3.044	20	30		EGEDHN
C[C@H]1CCCC[C@H]1C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001020525914	1317745967	/nfs/dbraw/zinc/74/59/67/1317745967.db2.gz	NHRIOOLMCJNISU-XDKFSHSGSA-N	0	3	343.446	3.260	20	30		EGEDHN
N#Cc1ccc(CN2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)C2CCCCCC2)cc1	ZINC000958381832	1317782990	/nfs/dbraw/zinc/78/29/90/1317782990.db2.gz	CSTAFTYIXINYSF-PMOLBWCYSA-N	0	3	337.467	3.075	20	30		EGEDHN
CCC(=O)N1CCc2ccccc2[C@@H]1CNCc1ccc(C#N)s1	ZINC000958766780	1317827792	/nfs/dbraw/zinc/82/77/92/1317827792.db2.gz	NUZXBBLSWOTBSV-SFHVURJKSA-N	0	3	339.464	3.245	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N[C@H]1C[C@H](N[C@H](C)c2ccccc2F)C1	ZINC001020726641	1317893252	/nfs/dbraw/zinc/89/32/52/1317893252.db2.gz	PWRRLKMLQZWJHM-CMQWMLGXSA-N	0	3	346.446	3.105	20	30		EGEDHN
CCOc1cc(/C=C2/C(=O)c3ncnn3C2C)cc(Cl)c1OC	ZINC000905081473	1317921586	/nfs/dbraw/zinc/92/15/86/1317921586.db2.gz	QVEARNUNEXKZFM-WUFUFFIZSA-N	0	3	333.775	3.180	20	30		EGEDHN
C[C@@H](N[C@H]1CCc2ccc(C#N)cc21)c1ccc2c(c1)CC(=O)N2C	ZINC000810216577	1317978286	/nfs/dbraw/zinc/97/82/86/1317978286.db2.gz	XMQAJFLQQCLLSQ-YJYMSZOUSA-N	0	3	331.419	3.415	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@H](C)c2ccc(F)c(F)c2)C1	ZINC001021072009	1318067587	/nfs/dbraw/zinc/06/75/87/1318067587.db2.gz	UZSZHNQFBHLQDD-RAIGVLPGSA-N	0	3	328.790	3.058	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@@H](CCCN3C(=O)C3CCC3)C2)c1	ZINC001021493726	1318295882	/nfs/dbraw/zinc/29/58/82/1318295882.db2.gz	VPQDQFZGLLNOEV-PMACEKPBSA-N	0	3	337.467	3.171	20	30		EGEDHN
O=C(C#CC1CC1)N1CCCC[C@H]1CNCc1ccccc1Cl	ZINC000960002410	1318307997	/nfs/dbraw/zinc/30/79/97/1318307997.db2.gz	FHISUFXIDNJDJS-KRWDZBQOSA-N	0	3	330.859	3.224	20	30		EGEDHN
C#C[C@@H](NC(=O)N[C@H](CN1CCCCC1)c1ccccc1)C(C)C	ZINC000812045852	1318315388	/nfs/dbraw/zinc/31/53/88/1318315388.db2.gz	RSSAWZQFFPZMQS-RTBURBONSA-N	0	3	327.472	3.171	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@@H]2CN(Cc3cccc(C#N)c3)CC[C@H]21	ZINC001021528582	1318363936	/nfs/dbraw/zinc/36/39/36/1318363936.db2.gz	YXSUHATZEKXIGQ-RTBURBONSA-N	0	3	325.456	3.027	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@@H](CCCN3C(=O)/C=C/C3CC3)C2)c1	ZINC001021542564	1318380481	/nfs/dbraw/zinc/38/04/81/1318380481.db2.gz	UYQSLQJMCSVPLD-FIKIWUFISA-N	0	3	349.478	3.337	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccoc1Cl	ZINC000960258329	1318433769	/nfs/dbraw/zinc/43/37/69/1318433769.db2.gz	ZUXKDHNXPXSGJF-HZPDHXFCSA-N	0	3	330.815	3.495	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cccc3c2CCCC3)C1	ZINC001021593283	1318438431	/nfs/dbraw/zinc/43/84/31/1318438431.db2.gz	VLTUKRLQEBHUGP-RXVVDRJESA-N	0	3	336.479	3.125	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)CC2(c3ccccc3)CC2)C1	ZINC001021601016	1318444855	/nfs/dbraw/zinc/44/48/55/1318444855.db2.gz	BKXVLGBVDMMGPB-QUCCMNQESA-N	0	3	336.479	3.054	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@@H]1Cc2ccccc21	ZINC000960301621	1318451580	/nfs/dbraw/zinc/45/15/80/1318451580.db2.gz	FLYRHPPYDIOJBY-NJDAHSKKSA-N	0	3	332.447	3.274	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1conc1C1CC1	ZINC000960309088	1318452816	/nfs/dbraw/zinc/45/28/16/1318452816.db2.gz	VGDDFZPTBQKGPM-IEBWSBKVSA-N	0	3	337.423	3.114	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)C1(C)CC(F)(F)C1	ZINC000960322764	1318460391	/nfs/dbraw/zinc/46/03/91/1318460391.db2.gz	AIEQTKXQEPTMRM-HZPDHXFCSA-N	0	3	334.410	3.370	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(Cl)cc2F)C1	ZINC001021627634	1318479815	/nfs/dbraw/zinc/47/98/15/1318479815.db2.gz	OMCRZGBQQMKGCR-SUMWQHHRSA-N	0	3	334.822	3.039	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(C)sc2C)C1	ZINC001021628020	1318480229	/nfs/dbraw/zinc/48/02/29/1318480229.db2.gz	RWCMPKVHFYQUHK-SJLPKXTDSA-N	0	3	330.497	3.315	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)C2CCC3(CC3)CC2)C1	ZINC001021636323	1318490244	/nfs/dbraw/zinc/49/02/44/1318490244.db2.gz	PIGNYLNCBRVOHL-MOPGFXCFSA-N	0	3	328.500	3.293	20	30		EGEDHN
CO[C@](C)(C(=O)C(C#N)c1nc2ccccc2n1C(F)F)C1CC1	ZINC000813061197	1318492665	/nfs/dbraw/zinc/49/26/65/1318492665.db2.gz	UFMDADGPFUIPFA-GTNSWQLSSA-N	0	3	333.338	3.423	20	30		EGEDHN
Cc1cc(C#N)ccc1Oc1ccc(C(=O)OCC(C)[N+](=O)[O-])cc1	ZINC000813115749	1318503037	/nfs/dbraw/zinc/50/30/37/1318503037.db2.gz	ZDMYMNPWMCGSII-CYBMUJFWSA-N	0	3	340.335	3.481	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc3[nH]ccc3c2)C1	ZINC001021651887	1318511969	/nfs/dbraw/zinc/51/19/69/1318511969.db2.gz	FTQHBSUOOTZIOJ-QUCCMNQESA-N	0	3	335.451	3.118	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc[nH]c2C(C)C)C1	ZINC001021654557	1318516191	/nfs/dbraw/zinc/51/61/91/1318516191.db2.gz	FVJXHJAKNXLAAA-FUHWJXTLSA-N	0	3	327.472	3.088	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(Cl)cc2C)C1	ZINC001021663705	1318524871	/nfs/dbraw/zinc/52/48/71/1318524871.db2.gz	DIGLFZLMRNJAEK-QAPCUYQASA-N	0	3	330.859	3.208	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)C[C@@H]1C=CCC1	ZINC000960397813	1318525297	/nfs/dbraw/zinc/52/52/97/1318525297.db2.gz	HPKLKQZMGOIQOX-XLIONFOSSA-N	0	3	337.467	3.337	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)Cc2cccc(Cl)c2)C1	ZINC001021664841	1318527191	/nfs/dbraw/zinc/52/71/91/1318527191.db2.gz	IVLDDBOLFIDSMK-MJGOQNOKSA-N	0	3	344.886	3.219	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cccc(Cl)c2F)C1	ZINC001021667032	1318530154	/nfs/dbraw/zinc/53/01/54/1318530154.db2.gz	YMGQJUFDAQJQPM-CZUORRHYSA-N	0	3	334.822	3.039	20	30		EGEDHN
CCC(CC)C(=O)N1CCC[C@H]1CN(C)Cc1ccc(C#N)cc1	ZINC000960420032	1318542857	/nfs/dbraw/zinc/54/28/57/1318542857.db2.gz	LZPGKNASHWBAEC-IBGZPJMESA-N	0	3	327.472	3.417	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(F)ccc2Cl)C1	ZINC001021676817	1318543429	/nfs/dbraw/zinc/54/34/29/1318543429.db2.gz	NGJKOCCLSQGSIE-KSSFIOAISA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc3c(c2)C=CCC3)C1	ZINC001021685270	1318559146	/nfs/dbraw/zinc/55/91/46/1318559146.db2.gz	PQUHLWCYUJMCEE-LEWJYISDSA-N	0	3	334.463	3.206	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc3c(C)cccn3c2)C1	ZINC001021709659	1318586565	/nfs/dbraw/zinc/58/65/65/1318586565.db2.gz	CYCHRGNFLGNNRZ-ICSRJNTNSA-N	0	3	349.478	3.198	20	30		EGEDHN
CC(C)Oc1cccc(CN(C)C[C@H]2CCCN2C(=O)[C@H](C)C#N)c1	ZINC000960496876	1318607183	/nfs/dbraw/zinc/60/71/83/1318607183.db2.gz	UNJXLCOGGWDECU-SJLPKXTDSA-N	0	3	343.471	3.056	20	30		EGEDHN
CCCOc1cccc(CN(C)C[C@@H]2CCCN2C(=O)[C@@H](C)C#N)c1	ZINC000960502418	1318612269	/nfs/dbraw/zinc/61/22/69/1318612269.db2.gz	NGPNWAIVNRVFSU-WMZOPIPTSA-N	0	3	343.471	3.058	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)CCc2ccccc2Cl)C1	ZINC001021726523	1318621633	/nfs/dbraw/zinc/62/16/33/1318621633.db2.gz	CYQBHKMNPYCJKK-MJGOQNOKSA-N	0	3	344.886	3.219	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc3c(c2)CCCC3)C1	ZINC001021726893	1318622119	/nfs/dbraw/zinc/62/21/19/1318622119.db2.gz	HNLXAGMAKFZVCN-LEWJYISDSA-N	0	3	336.479	3.125	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc3c(s2)CCC3)C1	ZINC001021727898	1318626232	/nfs/dbraw/zinc/62/62/32/1318626232.db2.gz	OZDBBKVYVLQVPE-IRXDYDNUSA-N	0	3	342.508	3.187	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H]1CN(C)Cc1ccc(C#N)cc1)C1CC1	ZINC000960529151	1318646073	/nfs/dbraw/zinc/64/60/73/1318646073.db2.gz	MUENBYOKYIDXQX-BEFAXECRSA-N	0	3	325.456	3.027	20	30		EGEDHN
C[C@H](NCc1cc2ccccc2n(C)c1=O)c1ccc(OCC#N)cc1	ZINC000813881878	1318650459	/nfs/dbraw/zinc/65/04/59/1318650459.db2.gz	WWJUAVWEHQUGLQ-HNNXBMFYSA-N	0	3	347.418	3.292	20	30		EGEDHN
N#Cc1ccc(CN2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)[C@H]2CCC=CCCC2)cc1	ZINC000960531678	1318651474	/nfs/dbraw/zinc/65/14/74/1318651474.db2.gz	AYRZRBDYAFLZTE-UWHLTILDSA-N	0	3	349.478	3.241	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cccc3c2CCC3)C1	ZINC001021742070	1318654075	/nfs/dbraw/zinc/65/40/75/1318654075.db2.gz	BTAPRXZOSKIMSP-NQIIRXRSSA-N	0	3	336.479	3.125	20	30		EGEDHN
CC[C@H](SC)C(=O)N1CCC[C@@H]1CN(C)Cc1cccc(C#N)c1	ZINC000960558336	1318689850	/nfs/dbraw/zinc/68/98/50/1318689850.db2.gz	SRCZAQHALSDYAL-MSOLQXFVSA-N	0	3	345.512	3.123	20	30		EGEDHN
C[C@H](N[C@H]1C[C@@H](NC(=O)c2cc(C#N)c[nH]2)C1)c1ccccc1Cl	ZINC001021945875	1318741838	/nfs/dbraw/zinc/74/18/38/1318741838.db2.gz	FABKKXCMGLDOOY-FPMFFAJLSA-N	0	3	342.830	3.151	20	30		EGEDHN
CC(C(=O)N1CCC[C@H]1CN(C)Cc1ccc(C#N)cc1)=C1CCC1	ZINC000960615801	1318743576	/nfs/dbraw/zinc/74/35/76/1318743576.db2.gz	ZOPQJEBBPOLQBC-FQEVSTJZSA-N	0	3	337.467	3.481	20	30		EGEDHN
C[C@@H]1CCC[C@H]1CC(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001022121270	1318802278	/nfs/dbraw/zinc/80/22/78/1318802278.db2.gz	BLEWJTKJDVNSMS-SIUPPRGNSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N[C@@H](C)c1ccc(OC(C)C)c(OC)c1	ZINC000912391136	1318880770	/nfs/dbraw/zinc/88/07/70/1318880770.db2.gz	PJAPLWLZVJDVHC-GOEBONIOSA-N	0	3	334.460	3.343	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2csc(C(F)(F)F)c2)C1	ZINC001022361619	1318905348	/nfs/dbraw/zinc/90/53/48/1318905348.db2.gz	XEWHTQMKXYBNOH-AOOOYVTPSA-N	0	3	338.782	3.370	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)C1(C)CC=CC1	ZINC000960840046	1318974656	/nfs/dbraw/zinc/97/46/56/1318974656.db2.gz	UAWIQBRIIGYUCL-IBGZPJMESA-N	0	3	337.467	3.337	20	30		EGEDHN
CCC(C)(C)C(=O)N1CCC[C@H]1CN(C)Cc1cccc(C#N)c1	ZINC000960840363	1318975705	/nfs/dbraw/zinc/97/57/05/1318975705.db2.gz	NCJMAZATRLCHSM-SFHVURJKSA-N	0	3	327.472	3.417	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)CC(C)(F)F	ZINC000960845515	1318982454	/nfs/dbraw/zinc/98/24/54/1318982454.db2.gz	TUZIHEHCJGZVHT-MRXNPFEDSA-N	0	3	335.398	3.026	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc3cccc(OC)c3o2)C1	ZINC001022620898	1319020781	/nfs/dbraw/zinc/02/07/81/1319020781.db2.gz	SVJSLAXHNUZBAO-BETUJISGSA-N	0	3	334.803	3.044	20	30		EGEDHN
C[C@@H]1CCC[C@H](C(=O)N[C@H]2C[C@@H](NCc3ccc(C#N)cc3F)C2)C1	ZINC001022623792	1319024728	/nfs/dbraw/zinc/02/47/28/1319024728.db2.gz	XTUJOHJKBMSYQP-SIUPPRGNSA-N	0	3	343.446	3.260	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)[C@@H]1CC12CCC2	ZINC000960916411	1319062515	/nfs/dbraw/zinc/06/25/15/1319062515.db2.gz	XNZCABKAZOAKJB-MOPGFXCFSA-N	0	3	337.467	3.171	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)CCc1cncs1)c1ccccc1	ZINC000816038565	1319092438	/nfs/dbraw/zinc/09/24/38/1319092438.db2.gz	ATARHBMBCZFDMR-CVEARBPZSA-N	0	3	341.436	3.052	20	30		EGEDHN
CN(Cc1ccc(OCC#N)cc1)C[C@@H]1CCCN1C(=O)C(C)(C)C	ZINC000960994039	1319124243	/nfs/dbraw/zinc/12/42/43/1319124243.db2.gz	PYQULDFHQDERBT-KRWDZBQOSA-N	0	3	343.471	3.058	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC[C@H]([C@@H]2CCN(CCF)C2)C1	ZINC000961165650	1319284462	/nfs/dbraw/zinc/28/44/62/1319284462.db2.gz	ICQBMNCQZWBTBN-LSDHHAIUSA-N	0	3	330.875	3.295	20	30		EGEDHN
Cc1ccoc1C(=O)NC[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001023222951	1319361983	/nfs/dbraw/zinc/36/19/83/1319361983.db2.gz	GATISNJWZDINNL-SFHVURJKSA-N	0	3	337.423	3.102	20	30		EGEDHN
C=CC[C@@H](CO)CN[C@@H](c1nc(Br)cs1)C1CC1	ZINC000817581222	1319403557	/nfs/dbraw/zinc/40/35/57/1319403557.db2.gz	QRJKYUYAAZMRKL-BXKDBHETSA-N	0	3	331.279	3.131	20	30		EGEDHN
CC(=O)N[C@H](C)C(=O)C(C#N)c1nc(-c2ccc(Cl)cc2)cs1	ZINC000915101820	1319422971	/nfs/dbraw/zinc/42/29/71/1319422971.db2.gz	LUOYPVWHPXHDGD-RNCFNFMXSA-N	0	3	347.827	3.164	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1ccc(COC(C)(C)C)cc1	ZINC000930297587	1328828295	/nfs/dbraw/zinc/82/82/95/1328828295.db2.gz	BOANCKDKTNGKDX-UHFFFAOYSA-N	0	3	331.460	3.078	20	30		EGEDHN
CC[C@@H](C#N)Oc1cc(CN[C@@H](C)c2cnccc2N)ccc1OC	ZINC000817917038	1319460477	/nfs/dbraw/zinc/46/04/77/1319460477.db2.gz	DKUCBAGDRHHCOZ-ZFWWWQNUSA-N	0	3	340.427	3.035	20	30		EGEDHN
C#CCN(C)CCCNC(=O)[C@H](C)c1ccc(Cl)c(Cl)c1	ZINC000818602734	1319566979	/nfs/dbraw/zinc/56/69/79/1319566979.db2.gz	BAYTUOKVIUMJKO-GFCCVEGCSA-N	0	3	327.255	3.168	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1csc(-c2ccc(Cl)cc2)n1	ZINC000818609330	1319569959	/nfs/dbraw/zinc/56/99/59/1319569959.db2.gz	QWEJVJCFZZVQHA-UHFFFAOYSA-N	0	3	347.871	3.148	20	30		EGEDHN
COCCn1c(C)cc(C=[NH+][N-]c2nc3ccccc3n2C)c1C	ZINC000915968070	1319573964	/nfs/dbraw/zinc/57/39/64/1319573964.db2.gz	RFJPTKKQYQAZHG-UHFFFAOYSA-N	0	3	325.416	3.084	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN[C@@H](c2ccc(F)cc2)[C@@H]2CCCO2)cc1	ZINC000818968345	1319595884	/nfs/dbraw/zinc/59/58/84/1319595884.db2.gz	RLMJZHRILJZWAG-AABGKKOBSA-N	0	3	340.398	3.241	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN[C@H]2CCCOc3c(F)cccc32)cc1	ZINC000819214832	1319670559	/nfs/dbraw/zinc/67/05/59/1319670559.db2.gz	UVGIRIYYFSETTQ-ZWKOTPCHSA-N	0	3	326.371	3.234	20	30		EGEDHN
N#CC[C@@H](O)CN[C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1	ZINC000930372418	1328843940	/nfs/dbraw/zinc/84/39/40/1328843940.db2.gz	MCZJPYHVPCJPTF-HZPDHXFCSA-N	0	3	342.361	3.037	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc(F)c(Cl)c2F)C1	ZINC001023569404	1319683975	/nfs/dbraw/zinc/68/39/75/1319683975.db2.gz	IWBJNGADUJMUCR-GFCCVEGCSA-N	0	3	340.801	3.083	20	30		EGEDHN
Cc1cc(C(=O)NC2CC(CNCc3ccccc3C#N)C2)oc1C	ZINC000961715559	1319710688	/nfs/dbraw/zinc/71/06/88/1319710688.db2.gz	MLDQDBGNXYNZNY-UHFFFAOYSA-N	0	3	337.423	3.066	20	30		EGEDHN
COc1ccc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)cc1F	ZINC000916910660	1319724342	/nfs/dbraw/zinc/72/43/42/1319724342.db2.gz	SGBWVFAOOCQRTM-NSHDSACASA-N	0	3	346.745	3.449	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@H](CNC(=O)[C@H]3CC34CCC4)C2)c1	ZINC001023620469	1319738824	/nfs/dbraw/zinc/73/88/24/1319738824.db2.gz	VFDWSYGNAGHUHP-RTBURBONSA-N	0	3	337.467	3.077	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccccc2O[C@H](C)CC)C1	ZINC001023620961	1319741076	/nfs/dbraw/zinc/74/10/76/1319741076.db2.gz	CTOBYNABLBXVID-MSOLQXFVSA-N	0	3	342.483	3.329	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc3cc(F)ccc3o2)C1	ZINC001023626545	1319748554	/nfs/dbraw/zinc/74/85/54/1319748554.db2.gz	BLANXIMVYPTZMY-CQSZACIVSA-N	0	3	328.387	3.037	20	30		EGEDHN
N#Cc1ccccc1CNCC1CC(NC(=O)C2CC3(CCC3)C2)C1	ZINC000962189862	1319851068	/nfs/dbraw/zinc/85/10/68/1319851068.db2.gz	FVRKNYGPVWHETA-UHFFFAOYSA-N	0	3	337.467	3.123	20	30		EGEDHN
C=C1CCC(C(=O)NC2CC(CNCc3oc(C)nc3C)C2)CC1	ZINC000962264158	1319888696	/nfs/dbraw/zinc/88/86/96/1319888696.db2.gz	BLFWAQRHHKQAGT-UHFFFAOYSA-N	0	3	331.460	3.022	20	30		EGEDHN
C=Cc1ccc(C(=O)NC2CC(CNCc3ccccc3C#N)C2)cc1	ZINC000962344350	1319919927	/nfs/dbraw/zinc/91/99/27/1319919927.db2.gz	IXUWEFYDLKNOBZ-UHFFFAOYSA-N	0	3	345.446	3.499	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N(C)C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000823618137	1320192711	/nfs/dbraw/zinc/19/27/11/1320192711.db2.gz	NWSRZSGQAWPLON-UGSOOPFHSA-N	0	3	325.368	3.193	20	30		EGEDHN
COc1ccc(OC)c([C@@H](O)CN(C)[C@H](C)c2cccc(C#N)c2)c1	ZINC000823617941	1320192807	/nfs/dbraw/zinc/19/28/07/1320192807.db2.gz	NTPVUHHXJVHIFP-KUHUBIRLSA-N	0	3	340.423	3.302	20	30		EGEDHN
C#Cc1cccc(CNCc2ccc(OC(=O)C3CC3)c(OC)c2)c1	ZINC000825227681	1320319977	/nfs/dbraw/zinc/31/99/77/1320319977.db2.gz	XVGRKSNNKUDYBT-UHFFFAOYSA-N	0	3	335.403	3.282	20	30		EGEDHN
CC(C)Oc1ccc([C@H](CNC(=O)C#CC(C)(C)C)N(C)C)cc1	ZINC000837653937	1320660891	/nfs/dbraw/zinc/66/08/91/1320660891.db2.gz	PBMJRAAGFVAMNC-SFHVURJKSA-N	0	3	330.472	3.242	20	30		EGEDHN
C#Cc1cccc(CNC(=O)NC[C@@H](N[C@H](C)CC)c2ccco2)c1	ZINC000838587908	1320793106	/nfs/dbraw/zinc/79/31/06/1320793106.db2.gz	RXAVAFBDMMGLBS-CRAIPNDOSA-N	0	3	339.439	3.190	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N1CC[C@H](C)C[C@@H]1c1ccc(C)o1	ZINC000838622793	1320796039	/nfs/dbraw/zinc/79/60/39/1320796039.db2.gz	NLUCKQKNDZQBPS-DOTOQJQBSA-N	0	3	331.460	3.026	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N(C1CC1)[C@H]1CCCc2ccccc21	ZINC000838622775	1320796189	/nfs/dbraw/zinc/79/61/89/1320796189.db2.gz	MFASJMVOVNPXFV-FQEVSTJZSA-N	0	3	339.483	3.193	20	30		EGEDHN
Cc1cc(C#N)cnc1C(=O)O[C@H]1C[C@@H](C)CN(Cc2ccccc2)C1	ZINC000839091999	1320867541	/nfs/dbraw/zinc/86/75/41/1320867541.db2.gz	VKWOIXITOMDYGN-BEFAXECRSA-N	0	3	349.434	3.329	20	30		EGEDHN
C[C@H]1CC(C)(C)CN1Cc1cc(=O)n2c3ccccc3[nH]c2c1C#N	ZINC000839658405	1320954434	/nfs/dbraw/zinc/95/44/34/1320954434.db2.gz	MSOSFXMIMSPGQP-DZGCQCFKSA-N	0	3	334.423	3.344	20	30		EGEDHN
CSc1ccc([C@H](C/N=C\c2ccc(O)c(O)c2O)N(C)C)cc1	ZINC000840707105	1321131239	/nfs/dbraw/zinc/13/12/39/1321131239.db2.gz	SHXMMFPMRBTBAM-HNIBHBHRSA-N	0	3	346.452	3.247	20	30		EGEDHN
N#CC(C(=O)NC1CCCCC1)C(=O)[C@H]1CCSc2ccccc21	ZINC000842289507	1321368324	/nfs/dbraw/zinc/36/83/24/1321368324.db2.gz	RIGNXFBPOZWNJU-HOTGVXAUSA-N	0	3	342.464	3.424	20	30		EGEDHN
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NCC3(C#N)CCC3)C[C@H]2C1	ZINC000843413320	1321513685	/nfs/dbraw/zinc/51/36/85/1321513685.db2.gz	LCXUWBBRWJOICQ-JYJNAYRXSA-N	0	3	333.476	3.305	20	30		EGEDHN
CC(C)(C)N1CC[C@H]1COC(=O)C(C)(C)Oc1ccc(C#N)cc1	ZINC000845731881	1321738002	/nfs/dbraw/zinc/73/80/02/1321738002.db2.gz	BYZFLWDELLZOMA-HNNXBMFYSA-N	0	3	330.428	3.132	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-]	ZINC000845876002	1321748684	/nfs/dbraw/zinc/74/86/84/1321748684.db2.gz	PEHZAZAJGWWCKX-LALPHHSUSA-N	0	3	325.336	3.056	20	30		EGEDHN
N#CC1(COC(=O)[C@@H]2CCSC2)CCN(Cc2ccccc2)CC1	ZINC000847749632	1321900790	/nfs/dbraw/zinc/90/07/90/1321900790.db2.gz	WXWYYTRWTOJQDH-QGZVFWFLSA-N	0	3	344.480	3.089	20	30		EGEDHN
C=C[C@H](CO)NCc1ccc(N2CCCCC2)c(Br)c1	ZINC000850410140	1322240663	/nfs/dbraw/zinc/24/06/63/1322240663.db2.gz	HDPDKXMKXIHYGE-CQSZACIVSA-N	0	3	339.277	3.076	20	30		EGEDHN
N#C[C@H](NC(=O)c1cccc(CN2CCCCC2)c1)C1CCCC1	ZINC000921551734	1322350316	/nfs/dbraw/zinc/35/03/16/1322350316.db2.gz	VBNSVMUVLOTCCI-IBGZPJMESA-N	0	3	325.456	3.485	20	30		EGEDHN
CN1CC[C@@H]2CC[C@H](C1)N2C(=O)c1c(Cl)cc(C#N)cc1Cl	ZINC000923275271	1322724434	/nfs/dbraw/zinc/72/44/34/1322724434.db2.gz	WZIYCFCQBDKVDB-NWDGAFQWSA-N	0	3	338.238	3.174	20	30		EGEDHN
C=CCC1(O)CCN(C(=O)c2oc3ccccc3c2CN(C)C)CC1	ZINC000924432156	1323022418	/nfs/dbraw/zinc/02/24/18/1323022418.db2.gz	GWJSVQZAUBJAKS-UHFFFAOYSA-N	0	3	342.439	3.038	20	30		EGEDHN
C=CCC[C@H](c1ccccc1)N1C(=O)N[C@@H](CN2CCCCC2)C1=O	ZINC000924711728	1323126911	/nfs/dbraw/zinc/12/69/11/1323126911.db2.gz	DEXIFAOGCZFHNP-ZWKOTPCHSA-N	0	3	341.455	3.100	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H](CNCc2ccn(C(C)C)n2)C1	ZINC001024138108	1323162821	/nfs/dbraw/zinc/16/28/21/1323162821.db2.gz	ZRCSUCYTQAHANM-XLIONFOSSA-N	0	3	346.519	3.395	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H](CNCc3nc(C)sc3C)C2)C1	ZINC001024145731	1323170434	/nfs/dbraw/zinc/17/04/34/1323170434.db2.gz	GBFQVYAJNYZSSQ-INIZCTEOSA-N	0	3	347.528	3.444	20	30		EGEDHN
C=C(Br)CNC1CCC(N(C)C(=O)C2CCC2)CC1	ZINC000962966313	1323176203	/nfs/dbraw/zinc/17/62/03/1323176203.db2.gz	AJQABNNPGZABFZ-UHFFFAOYSA-N	0	3	329.282	3.054	20	30		EGEDHN
C=C(Br)CNC1CCC(N(C)C(=O)c2ccoc2)CC1	ZINC000963073888	1323200646	/nfs/dbraw/zinc/20/06/46/1323200646.db2.gz	CAVNXZFXDUKLPW-UHFFFAOYSA-N	0	3	341.249	3.161	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccc(C)c(NC(C)=O)c1	ZINC001024454442	1323413439	/nfs/dbraw/zinc/41/34/39/1323413439.db2.gz	FWTLJCDJCSGCCX-GOSISDBHSA-N	0	3	343.471	3.114	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NC[C@@H]1CCCCN1CCCF	ZINC001024515625	1323465728	/nfs/dbraw/zinc/46/57/28/1323465728.db2.gz	XRRULUPLYPURNR-INIZCTEOSA-N	0	3	334.435	3.195	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccc(F)c(COC)c1	ZINC001024635964	1323561406	/nfs/dbraw/zinc/56/14/06/1323561406.db2.gz	LVDJKRJDYCFZFY-KRWDZBQOSA-N	0	3	334.435	3.133	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccc(C(C)C)nc1C	ZINC001024652540	1323575285	/nfs/dbraw/zinc/57/52/85/1323575285.db2.gz	PHAZSZIMOQHYLF-QGZVFWFLSA-N	0	3	327.472	3.121	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1cc(F)c(F)cc1Cl	ZINC001024788107	1323692679	/nfs/dbraw/zinc/69/26/79/1323692679.db2.gz	FDOBBWWKTDHSAO-LBPRGKRZSA-N	0	3	340.801	3.226	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccc(OC(C)C)cc1	ZINC001024789139	1323694387	/nfs/dbraw/zinc/69/43/87/1323694387.db2.gz	SZQQEJFJHXHZNS-GOSISDBHSA-N	0	3	328.456	3.081	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccc(OCC(C)C)cc1	ZINC001024791303	1323696273	/nfs/dbraw/zinc/69/62/73/1323696273.db2.gz	YKRONPOUVKWZIX-LJQANCHMSA-N	0	3	342.483	3.329	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)[C@@H]2CC=CCC2)s1	ZINC001024865397	1323755469	/nfs/dbraw/zinc/75/54/69/1323755469.db2.gz	VFXFBWFXPGUVLQ-HZPDHXFCSA-N	0	3	343.496	3.447	20	30		EGEDHN
C[C@@H](NC[C@H]1CCCCN1C(=O)C#CC1CC1)c1ccc(F)cc1F	ZINC001024957295	1323799823	/nfs/dbraw/zinc/79/98/23/1323799823.db2.gz	BTCXNMCOUOZFGF-RHSMWYFYSA-N	0	3	346.421	3.410	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCCC[C@@H]1CNCc1ncccc1C	ZINC001025037858	1323840919	/nfs/dbraw/zinc/84/09/19/1323840919.db2.gz	NHMWAMMCUOICSU-QGZVFWFLSA-N	0	3	329.488	3.463	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@@H]1CNCc1cnn(C(C)(C)C)c1	ZINC001025040791	1323842917	/nfs/dbraw/zinc/84/29/17/1323842917.db2.gz	LWVWBXAYNWSERG-QGZVFWFLSA-N	0	3	346.519	3.321	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCCC[C@H]1CNCc1cncc(F)c1	ZINC001025069357	1323870402	/nfs/dbraw/zinc/87/04/02/1323870402.db2.gz	IVDHHIQJIJCDHN-HKUYNNGSSA-N	0	3	333.451	3.294	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCCC[C@@H]1CNCc1ncccc1C	ZINC001025070281	1323872695	/nfs/dbraw/zinc/87/26/95/1323872695.db2.gz	WYGYHCWQHIKGDW-XLIONFOSSA-N	0	3	329.488	3.463	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)s1	ZINC001025101640	1323895256	/nfs/dbraw/zinc/89/52/56/1323895256.db2.gz	HMZOGYIUBKDAGB-HUUCEWRRSA-N	0	3	333.501	3.383	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(F)ccc1F	ZINC001025239879	1324032951	/nfs/dbraw/zinc/03/29/51/1324032951.db2.gz	JSXQBFBZPJFYIK-RTBURBONSA-N	0	3	346.421	3.447	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc(F)c(F)c1	ZINC001025241041	1324036638	/nfs/dbraw/zinc/03/66/38/1324036638.db2.gz	SVYMYFUCIOYDEC-RTBURBONSA-N	0	3	346.421	3.447	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)C12CCC(CC1)C2	ZINC001025243995	1324040923	/nfs/dbraw/zinc/04/09/23/1324040923.db2.gz	GGWJFZLSKWYBON-LSNYBQGISA-N	0	3	328.500	3.436	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(C)sc1C	ZINC001025248454	1324048137	/nfs/dbraw/zinc/04/81/37/1324048137.db2.gz	ZYIJESWTKYYPPU-ZWKOTPCHSA-N	0	3	330.497	3.457	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc(C)c(OC)c1	ZINC001025250032	1324050287	/nfs/dbraw/zinc/05/02/87/1324050287.db2.gz	GNUQDCKFHBATCO-RBUKOAKNSA-N	0	3	340.467	3.096	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1onc2c1CCCC2	ZINC001025250136	1324050649	/nfs/dbraw/zinc/05/06/49/1324050649.db2.gz	HETDDMLNVCTPJC-MSOLQXFVSA-N	0	3	343.471	3.199	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccnc(C2CC2)c1	ZINC001025250786	1324053050	/nfs/dbraw/zinc/05/30/50/1324053050.db2.gz	NJYXZAOWHLRNIG-WOJBJXKFSA-N	0	3	337.467	3.051	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)CCc1ccc(C)cc1	ZINC001025251542	1324054622	/nfs/dbraw/zinc/05/46/22/1324054622.db2.gz	SFVRWWLNGWXQQR-RTWAWAEBSA-N	0	3	338.495	3.406	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc2ncccc2o1	ZINC001025251755	1324056018	/nfs/dbraw/zinc/05/60/18/1324056018.db2.gz	KLDVHDPPEWMEAK-IAGOWNOFSA-N	0	3	339.439	3.473	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cccc2ncccc21	ZINC001025256703	1324064383	/nfs/dbraw/zinc/06/43/83/1324064383.db2.gz	ZLAMPIZJJPPYTA-SFTDATJTSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cccc2ncccc21	ZINC001025256701	1324064847	/nfs/dbraw/zinc/06/48/47/1324064847.db2.gz	ZLAMPIZJJPPYTA-NHCUHLMSSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc2ccccc2n1C	ZINC001025261898	1324073824	/nfs/dbraw/zinc/07/38/24/1324073824.db2.gz	ZAHHOYLNQJJZNK-UXHICEINSA-N	0	3	349.478	3.271	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc[nH]c1CCC	ZINC001025263553	1324074994	/nfs/dbraw/zinc/07/49/94/1324074994.db2.gz	NQYPVKNVYBUNAI-OALUTQOASA-N	0	3	327.472	3.060	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc2cc[nH]c2c1	ZINC001025270537	1324084603	/nfs/dbraw/zinc/08/46/03/1324084603.db2.gz	DHNXQTXSQWSVRL-VQTJNVASSA-N	0	3	335.451	3.260	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)C1(C(C)(F)F)CC1	ZINC001025273546	1324088968	/nfs/dbraw/zinc/08/89/68/1324088968.db2.gz	QBICDDQHBAZIKN-JKSUJKDBSA-N	0	3	338.442	3.291	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1csc(Cl)c1	ZINC001025273174	1324089090	/nfs/dbraw/zinc/08/90/90/1324089090.db2.gz	BGAHXIHZEWYLRL-HUUCEWRRSA-N	0	3	336.888	3.494	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(C)ccc1F	ZINC001025274370	1324091495	/nfs/dbraw/zinc/09/14/95/1324091495.db2.gz	XLCYSUUDOHYRLS-OALUTQOASA-N	0	3	328.431	3.226	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc2ccncc2c1	ZINC001025286904	1324108724	/nfs/dbraw/zinc/10/87/24/1324108724.db2.gz	MBQPXIYSSCESLV-RTWAWAEBSA-N	0	3	347.462	3.327	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1sccc1OC	ZINC001025289956	1324114800	/nfs/dbraw/zinc/11/48/00/1324114800.db2.gz	VWNFDIYPTWUMEB-HUUCEWRRSA-N	0	3	334.485	3.402	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc(OC)cc1	ZINC001025292441	1324116881	/nfs/dbraw/zinc/11/68/81/1324116881.db2.gz	IOTPNJPBYIMEOX-VQTJNVASSA-N	0	3	340.467	3.178	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc(Cl)cn1	ZINC001025292390	1324117414	/nfs/dbraw/zinc/11/74/14/1324117414.db2.gz	ICIGXNPYAIWOAG-ZWKOTPCHSA-N	0	3	345.874	3.217	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc(F)cc1C	ZINC001025292995	1324119095	/nfs/dbraw/zinc/11/90/95/1324119095.db2.gz	OOZDMUMIQPBWNE-OALUTQOASA-N	0	3	328.431	3.226	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)Cc1c[nH]c2ccccc12	ZINC001025293676	1324121249	/nfs/dbraw/zinc/12/12/49/1324121249.db2.gz	UFFUMNHKRPDHAI-RTWAWAEBSA-N	0	3	349.478	3.189	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1sc(C)nc1C	ZINC001025294405	1324124105	/nfs/dbraw/zinc/12/41/05/1324124105.db2.gz	AOLKCCBBPJNXSU-JKSUJKDBSA-N	0	3	333.501	3.405	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(F)cc(F)c1	ZINC001025294445	1324124500	/nfs/dbraw/zinc/12/45/00/1324124500.db2.gz	BGCSCFIKZXREJU-OALUTQOASA-N	0	3	346.421	3.447	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1c(C)onc1CC	ZINC001025297551	1324131096	/nfs/dbraw/zinc/13/10/96/1324131096.db2.gz	YJRASTALPTVIFV-SJORKVTESA-N	0	3	331.460	3.191	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)Cc1ccc(C)c(C)c1	ZINC001025298248	1324131499	/nfs/dbraw/zinc/13/14/99/1324131499.db2.gz	VNGPJXKXPHOIMC-NHCUHLMSSA-N	0	3	338.495	3.325	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)CC(C1CC1)C1CC1	ZINC001025301549	1324135165	/nfs/dbraw/zinc/13/51/65/1324135165.db2.gz	LRIGGMATADOJAV-UXHICEINSA-N	0	3	328.500	3.291	20	30		EGEDHN
C[C@H](NC(=O)c1ccoc1)[C@H]1CCCN(Cc2ccc(C#N)cc2)C1	ZINC001025347073	1324192284	/nfs/dbraw/zinc/19/22/84/1324192284.db2.gz	XFGXFYRWNCPJTE-YJBOKZPZSA-N	0	3	337.423	3.182	20	30		EGEDHN
C[C@@H](NC(=O)c1ccoc1)[C@@H]1CCCN(Cc2ccc(C#N)cc2)C1	ZINC001025347070	1324192643	/nfs/dbraw/zinc/19/26/43/1324192643.db2.gz	XFGXFYRWNCPJTE-CRAIPNDOSA-N	0	3	337.423	3.182	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(C3CC3)[nH]c2C2CC2)C1	ZINC001025456913	1324297659	/nfs/dbraw/zinc/29/76/59/1324297659.db2.gz	SWGBIWVNHAKHFW-PBHICJAKSA-N	0	3	339.483	3.233	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cn(CC)c3ccccc23)C1	ZINC001025478162	1324322896	/nfs/dbraw/zinc/32/28/96/1324322896.db2.gz	KKQCBCDMHSNOSF-DLBZAZTESA-N	0	3	337.467	3.125	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(CCCC)cc2)C1	ZINC001025477908	1324323218	/nfs/dbraw/zinc/32/32/18/1324323218.db2.gz	IPMPEHCOVNLGPQ-FXAWDEMLSA-N	0	3	326.484	3.493	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc3c(o2)c(F)ccc3C)C1	ZINC001025487138	1324337863	/nfs/dbraw/zinc/33/78/63/1324337863.db2.gz	BATVRBMSTASSQN-LSDHHAIUSA-N	0	3	342.414	3.344	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(C)nc2C(C)C)C1	ZINC001025489754	1324340800	/nfs/dbraw/zinc/34/08/00/1324340800.db2.gz	QIZUYMRXIBBVSI-ZWKOTPCHSA-N	0	3	341.499	3.367	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H](C)[C@H]2CCCN(Cc3ccccn3)C2)cc1	ZINC001025504060	1324353470	/nfs/dbraw/zinc/35/34/70/1324353470.db2.gz	XYARHFIUFGJHEY-XLIONFOSSA-N	0	3	347.462	3.093	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc3c(ccc(C)c3C)[nH]2)C1	ZINC001025506115	1324354770	/nfs/dbraw/zinc/35/47/70/1324354770.db2.gz	OQPGOAFCXWQYMX-IAGOWNOFSA-N	0	3	337.467	3.248	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(F)c(Cl)cc2F)C1	ZINC001025520096	1324364420	/nfs/dbraw/zinc/36/44/20/1324364420.db2.gz	ASRGFOIVRIPLRI-VXGBXAGGSA-N	0	3	340.801	3.082	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc[nH]c2C2CCC2)C1	ZINC001025536900	1324383618	/nfs/dbraw/zinc/38/36/18/1324383618.db2.gz	YTAWDYOGCCDVOH-NVXWUHKLSA-N	0	3	327.472	3.136	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)C23CCC(CC2)C3(C)C)C1	ZINC001025556656	1324404647	/nfs/dbraw/zinc/40/46/47/1324404647.db2.gz	XETSOYNQWZKSRC-NSSZEPTDSA-N	0	3	330.516	3.443	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)C23CCC(CC2)C3(C)C)C1	ZINC001025556655	1324405232	/nfs/dbraw/zinc/40/52/32/1324405232.db2.gz	XETSOYNQWZKSRC-IRDVNMAFSA-N	0	3	330.516	3.443	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc3[nH]ccc3s2)C1	ZINC001025602636	1324450344	/nfs/dbraw/zinc/45/03/44/1324450344.db2.gz	JEISJYXCCWKEOE-KGLIPLIRSA-N	0	3	329.469	3.083	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2c(C)cc(C)cc2C)C1	ZINC001025611569	1324463450	/nfs/dbraw/zinc/46/34/50/1324463450.db2.gz	MLLIXDGEWYUHGS-MOPGFXCFSA-N	0	3	326.484	3.465	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cccc(OCC(C)C)c2)C1	ZINC001025615594	1324469587	/nfs/dbraw/zinc/46/95/87/1324469587.db2.gz	WNKDEROBPAPDGW-HKUYNNGSSA-N	0	3	342.483	3.185	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2oc3ccccc3c2CC)C1	ZINC001025633581	1324485657	/nfs/dbraw/zinc/48/56/57/1324485657.db2.gz	WNBQNTKTRVDBSB-HOTGVXAUSA-N	0	3	338.451	3.459	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cscc2C(F)(F)F)C1	ZINC001025636946	1324488124	/nfs/dbraw/zinc/48/81/24/1324488124.db2.gz	JGISMOIGRFWZCD-NEPJUHHUSA-N	0	3	344.402	3.230	20	30		EGEDHN
CCC(CC)C(=O)N1C[C@@H]2CC[C@H](NCc3ccccc3C#N)[C@H]2C1	ZINC001026203858	1324662667	/nfs/dbraw/zinc/66/26/67/1324662667.db2.gz	YCSVWRSDODGNIP-UFYCRDLUSA-N	0	3	339.483	3.321	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CC[C@@H]2CN(C(=O)C3(C4CC4)CC3)C[C@@H]12	ZINC001026291707	1324706757	/nfs/dbraw/zinc/70/67/57/1324706757.db2.gz	UUJCCPGFQNTRPE-MISYRCLQSA-N	0	3	349.478	3.075	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H]2CC[C@@H](NCc3cscn3)[C@H]2C1	ZINC001026331888	1324731786	/nfs/dbraw/zinc/73/17/86/1324731786.db2.gz	ZKVPLZNXAJHPOA-CWRNSKLLSA-N	0	3	333.501	3.072	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)CC2CCC2)CC1	ZINC001026470785	1324828283	/nfs/dbraw/zinc/82/82/83/1324828283.db2.gz	QAGXREKDMNZSKO-UHFFFAOYSA-N	0	3	329.282	3.102	20	30		EGEDHN
Cc1ccccc1C(=O)N1CC[C@@H](CNCc2ccccc2C#N)C1	ZINC001026655596	1324955501	/nfs/dbraw/zinc/95/55/01/1324955501.db2.gz	ZSWMUMBTQNMLLZ-KRWDZBQOSA-N	0	3	333.435	3.119	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)c2cc[nH]c2C)C1	ZINC000963282026	1325063029	/nfs/dbraw/zinc/06/30/29/1325063029.db2.gz	NMJZHOMIKWLNRE-NVXWUHKLSA-N	0	3	335.879	3.392	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)C23CCC(CC2)C3)C1	ZINC001026921073	1325084160	/nfs/dbraw/zinc/08/41/60/1325084160.db2.gz	LZZNRDFIGZNOOL-BATSVXPKSA-N	0	3	337.467	3.077	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001026988691	1325127448	/nfs/dbraw/zinc/12/74/48/1325127448.db2.gz	MXJKVNNDQVJZFU-HNNXBMFYSA-N	0	3	343.446	3.238	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](CNCc2csc(C3CC3)n2)C1	ZINC001026993499	1325131077	/nfs/dbraw/zinc/13/10/77/1325131077.db2.gz	DXMRVNCLDISRTG-ZDUSSCGKSA-N	0	3	333.501	3.171	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCN(C(=O)[C@H]2CC23CCCC3)C1	ZINC001027155478	1325258993	/nfs/dbraw/zinc/25/89/93/1325258993.db2.gz	NNVNZUWIAOMWLG-VQIMIIECSA-N	0	3	337.467	3.077	20	30		EGEDHN
C[C@@H](NC1(c2cccc(C#N)c2)CC1)c1cccc(-n2cnnc2)c1	ZINC000925926991	1325360560	/nfs/dbraw/zinc/36/05/60/1325360560.db2.gz	VYEDCXDPGAOTDW-OAHLLOKOSA-N	0	3	329.407	3.479	20	30		EGEDHN
CN(Cc1ccc(C#N)c(F)c1)[C@@H]1CCCN(C(=O)c2ccco2)C1	ZINC001027274489	1325382236	/nfs/dbraw/zinc/38/22/36/1325382236.db2.gz	XVRWILWCBUJWBL-MRXNPFEDSA-N	0	3	341.386	3.027	20	30		EGEDHN
COc1ccc(CN(C)[C@@H]2CCCN(C(=O)CC(C)C)C2)cc1C#N	ZINC001027277165	1325394809	/nfs/dbraw/zinc/39/48/09/1325394809.db2.gz	XFVWXSSYQATKKX-GOSISDBHSA-N	0	3	343.471	3.036	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)[C@@H]2CC=CCC2)C1	ZINC001027294542	1325429295	/nfs/dbraw/zinc/42/92/95/1325429295.db2.gz	WMHPEAIQEXKWJL-UXHICEINSA-N	0	3	337.467	3.337	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)c(F)c2)C1	ZINC001027305110	1325449944	/nfs/dbraw/zinc/44/99/44/1325449944.db2.gz	HTMYYZCXEYACET-WMLDXEAASA-N	0	3	331.435	3.166	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1cc3ncccc3o1)C2	ZINC000964394130	1325504839	/nfs/dbraw/zinc/50/48/39/1325504839.db2.gz	UXQCALAYZHNJCF-UHFFFAOYSA-N	0	3	345.830	3.211	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)c(F)c2)C1	ZINC001027355792	1325531014	/nfs/dbraw/zinc/53/10/14/1325531014.db2.gz	AYMOPJJODOYTKQ-SHDIAVBESA-N	0	3	329.419	3.086	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)COCc2ccccc2C)c1	ZINC000857010439	1325553636	/nfs/dbraw/zinc/55/36/36/1325553636.db2.gz	NTKCQXJMDQSEIF-SFHVURJKSA-N	0	3	336.391	3.168	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)/C=C/c2ccc[nH]2)C1	ZINC001027381778	1325579724	/nfs/dbraw/zinc/57/97/24/1325579724.db2.gz	HKGRLSDJLJIUKO-SQUSKLHYSA-N	0	3	348.450	3.023	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H](N(C)C[C@@H](O)c2ccccc2)C1	ZINC001027519398	1327789327	/nfs/dbraw/zinc/78/93/27/1327789327.db2.gz	LTZZFTSTFVRDEK-RTBURBONSA-N	0	3	344.499	3.245	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H](N(C)CCn2nc(C)cc2C)C1	ZINC001027519603	1327791425	/nfs/dbraw/zinc/79/14/25/1327791425.db2.gz	QZFMLPGQIFVKRY-GOSISDBHSA-N	0	3	346.519	3.025	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)C2(C)CC=CC2)C1	ZINC001027558545	1327868690	/nfs/dbraw/zinc/86/86/90/1327868690.db2.gz	ZJAGKBBLHKIVFG-IBGZPJMESA-N	0	3	337.467	3.337	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)C2(C)CC=CC2)C1	ZINC001027559197	1327870329	/nfs/dbraw/zinc/87/03/29/1327870329.db2.gz	PUKPPSJRIWRTHF-LJQANCHMSA-N	0	3	337.467	3.337	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1sccc1OC)C2	ZINC000965860175	1328054810	/nfs/dbraw/zinc/05/48/10/1328054810.db2.gz	GAFOTMHUHAPFPN-UHFFFAOYSA-N	0	3	340.876	3.140	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)[C@H](CC)c2ccc(Cl)cc2)C1	ZINC001027690550	1328094826	/nfs/dbraw/zinc/09/48/26/1328094826.db2.gz	OWRAIDTVXDIURE-QZTJIDSGSA-N	0	3	332.875	3.390	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)C(CC)(CC)c2ccccc2)C1	ZINC001027690455	1328094864	/nfs/dbraw/zinc/09/48/64/1328094864.db2.gz	GYDGCHDUYCSLMO-IBGZPJMESA-N	0	3	326.484	3.300	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)[C@@H](CC)c2ccc(Cl)cc2)C1	ZINC001027690549	1328094959	/nfs/dbraw/zinc/09/49/59/1328094959.db2.gz	OWRAIDTVXDIURE-MSOLQXFVSA-N	0	3	332.875	3.390	20	30		EGEDHN
C=C(C)CN(C)[C@@H]1CCCN(C(=O)c2ccc(P(C)(C)=O)cc2)C1	ZINC001027692030	1328095925	/nfs/dbraw/zinc/09/59/25/1328095925.db2.gz	ZEJFIHGBQAFEEU-QGZVFWFLSA-N	0	3	348.427	3.047	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2c(F)ccc3ccncc32)C1	ZINC000966239601	1328234226	/nfs/dbraw/zinc/23/42/26/1328234226.db2.gz	WDEOGUJBELUDFX-KSSFIOAISA-N	0	3	341.430	3.390	20	30		EGEDHN
Cc1ccccc1C(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC000966543374	1328337146	/nfs/dbraw/zinc/33/71/46/1328337146.db2.gz	MKTAQMDTAJVQMH-QGZVFWFLSA-N	0	3	337.398	3.010	20	30		EGEDHN
C=C(C)CCN1CC[C@H](C)[C@H](NC(=O)c2nc3cccnc3s2)C1	ZINC000966750399	1328399879	/nfs/dbraw/zinc/39/98/79/1328399879.db2.gz	HQEVQTZASBYFPR-DZGCQCFKSA-N	0	3	344.484	3.098	20	30		EGEDHN
C=C(C)CCN1CC[C@H](C)[C@@H](NC(=O)c2cc(C(F)(F)F)no2)C1	ZINC000966889387	1328454809	/nfs/dbraw/zinc/45/48/09/1328454809.db2.gz	YAVIVQWOGBLXHR-RYUDHWBXSA-N	0	3	345.365	3.100	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1ccc2c(c1)C(C)(C)CO2	ZINC001028023873	1328485876	/nfs/dbraw/zinc/48/58/76/1328485876.db2.gz	YJJGWBCFVNLDES-MRXNPFEDSA-N	0	3	328.456	3.127	20	30		EGEDHN
CC(=NNc1ccnc(C)c1)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C	ZINC000863158854	1329531031	/nfs/dbraw/zinc/53/10/31/1329531031.db2.gz	UNRTXVJALZKSDQ-UHFFFAOYSA-N	0	3	343.343	3.081	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC2(C1)CCN(Cc1cccc(F)c1)CC2	ZINC001050618198	1348304310	/nfs/dbraw/zinc/30/43/10/1348304310.db2.gz	SJHIHWDFBLSWBO-UHFFFAOYSA-N	0	3	330.447	3.462	20	30		EGEDHN
C#CCCOc1ccc(CNCc2cc3c([nH]c2=O)CCCC3)cc1	ZINC000865880212	1329748416	/nfs/dbraw/zinc/74/84/16/1329748416.db2.gz	WEJHZUKPWUWNBR-UHFFFAOYSA-N	0	3	336.435	3.358	20	30		EGEDHN
C=CCC[C@@H](O)CN[C@H]1CCOc2ccc(Br)cc21	ZINC000932209814	1329796196	/nfs/dbraw/zinc/79/61/96/1329796196.db2.gz	XZTXSWKUQNRVDF-OCCSQVGLSA-N	0	3	326.234	3.189	20	30		EGEDHN
CCC(C)(CC)C(=O)N1C[C@H](NCc2ccc(C#N)s2)[C@@H](C)C1	ZINC000939797877	1330986596	/nfs/dbraw/zinc/98/65/96/1330986596.db2.gz	WWDFHTRZQFUVAM-BBRMVZONSA-N	0	3	333.501	3.383	20	30		EGEDHN
C[C@H]1CN(Cc2ccc(C#N)cc2)CC[C@@H]1NC(=O)C1C=CC=CC=C1	ZINC000942093240	1331825945	/nfs/dbraw/zinc/82/59/45/1331825945.db2.gz	ZBMRZLWMNXZHDD-UWJYYQICSA-N	0	3	347.462	3.183	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(F)c3ccccc3c2)[C@H](C)C1	ZINC000942109484	1331833931	/nfs/dbraw/zinc/83/39/31/1331833931.db2.gz	ONAWTEIMTDAYOW-FOIQADDNSA-N	0	3	338.426	3.442	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)cc2)CC[C@@H]1NC(=O)Cc1ccccc1	ZINC000942189660	1331870088	/nfs/dbraw/zinc/87/00/88/1331870088.db2.gz	UVUNWCOAKJKYQI-UTKZUKDTSA-N	0	3	347.462	3.128	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc3c4c(cccc42)CC3)[C@H](C)C1	ZINC000942393895	1331923187	/nfs/dbraw/zinc/92/31/87/1331923187.db2.gz	QGKYEOKKUVSASW-FOIQADDNSA-N	0	3	332.447	3.012	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3cscc3s2)[C@@H](C)C1	ZINC000942521589	1331952929	/nfs/dbraw/zinc/95/29/29/1331952929.db2.gz	WXVHWEKKQOSHQY-GXTWGEPZSA-N	0	3	332.494	3.426	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C)c(Cl)c2F)[C@@H](C)C1	ZINC000942527798	1331957006	/nfs/dbraw/zinc/95/70/06/1331957006.db2.gz	RRYYEPVPHOPMLT-DZGCQCFKSA-N	0	3	336.838	3.251	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3c(C)nsc3C)C[C@H]2C)C1	ZINC000942602888	1332000582	/nfs/dbraw/zinc/00/05/82/1332000582.db2.gz	OSXPFINCVOGINL-DYVFJYSZSA-N	0	3	347.528	3.443	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C(F)F)c(F)c2)[C@@H](C)C1	ZINC000942823767	1332043128	/nfs/dbraw/zinc/04/31/28/1332043128.db2.gz	VSYLWUZMWBFTSV-LRDDRELGSA-N	0	3	338.373	3.227	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C(C)C)nc2CC)[C@@H](C)C1	ZINC000942859896	1332049757	/nfs/dbraw/zinc/04/97/57/1332049757.db2.gz	OWOBHWKJVPOKEL-JXFKEZNVSA-N	0	3	341.499	3.231	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(-c3ccccc3)o2)[C@@H](C)C1	ZINC000942937193	1332062667	/nfs/dbraw/zinc/06/26/67/1332062667.db2.gz	HTJQHAVOLCPLNX-FUHWJXTLSA-N	0	3	336.435	3.410	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C(CC)CC)no2)[C@@H](C)C1	ZINC000943374654	1332161144	/nfs/dbraw/zinc/16/11/44/1332161144.db2.gz	ONDHNZLPDBYMOR-HOCLYGCPSA-N	0	3	331.460	3.042	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(-c3ccccc3)nc2)[C@@H](C)C1	ZINC000943757025	1332255590	/nfs/dbraw/zinc/25/55/90/1332255590.db2.gz	ZDAGKEGSQBUKFV-FXAWDEMLSA-N	0	3	347.462	3.212	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(-c3ccccc3)ccn2)[C@@H](C)C1	ZINC000943767177	1332259034	/nfs/dbraw/zinc/25/90/34/1332259034.db2.gz	RQDOOXUKGHRUPM-QFBILLFUSA-N	0	3	335.451	3.375	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(-c3ccccc3)ccn2)[C@H](C)C1	ZINC000943767175	1332259245	/nfs/dbraw/zinc/25/92/45/1332259245.db2.gz	RQDOOXUKGHRUPM-APWZRJJASA-N	0	3	335.451	3.375	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C(C)(C)c2ccccc2Cl)[C@H](C)C1	ZINC000944213816	1332346448	/nfs/dbraw/zinc/34/64/48/1332346448.db2.gz	GLOUXZRKUFEIOD-QAPCUYQASA-N	0	3	346.902	3.468	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(Cl)c(Cl)c2)[C@H](C)C1	ZINC000944306531	1332369043	/nfs/dbraw/zinc/36/90/43/1332369043.db2.gz	SGQNMLVSEPHFTB-MLGOLLRUSA-N	0	3	339.266	3.457	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3ccccc3C)CCC2)[C@H](C)C1	ZINC000944444171	1332413369	/nfs/dbraw/zinc/41/33/69/1332413369.db2.gz	JRZSEOOUSGDGDJ-QUCCMNQESA-N	0	3	338.495	3.267	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2c3ccccc3oc2CC)[C@@H](C)C1	ZINC000945178715	1332525746	/nfs/dbraw/zinc/52/57/46/1332525746.db2.gz	GMYXQLZLUFLSHZ-RDJZCZTQSA-N	0	3	338.451	3.459	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3cc4occc4[nH]3)CC[C@@H]2C1	ZINC000946612528	1332862499	/nfs/dbraw/zinc/86/24/99/1332862499.db2.gz	NFRKXYKUKJEVKL-OKILXGFUSA-N	0	3	347.846	3.297	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@@H]3CC[C@H]4C[C@H]4C3)CC[C@@H]2C1	ZINC000946652095	1332871024	/nfs/dbraw/zinc/87/10/24/1332871024.db2.gz	LSWWOVRKPCVVOK-RZFLPCETSA-N	0	3	336.907	3.346	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2CN(Cc3ccns3)C[C@H]2CC1	ZINC000946714276	1332882514	/nfs/dbraw/zinc/88/25/14/1332882514.db2.gz	LXWSVCZJYLSMOL-IYBDPMFKSA-N	0	3	347.528	3.416	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@@H](C)c3ccco3)CC[C@@H]2C1	ZINC000946776596	1332896956	/nfs/dbraw/zinc/89/69/56/1332896956.db2.gz	PFJMDSPGWSQTBC-HRCADAONSA-N	0	3	336.863	3.306	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H]2CCN(Cc3cccc(C#N)c3)[C@@H](C)C2)cn1	ZINC000947052465	1332990754	/nfs/dbraw/zinc/99/07/54/1332990754.db2.gz	KQNFJQZKUDYWGU-OXJNMPFZSA-N	0	3	348.450	3.045	20	30		EGEDHN
Cc1ccoc1C(=O)N[C@H]1CCN(Cc2ccc(C#N)cc2)[C@H](C)C1	ZINC000947058349	1332995895	/nfs/dbraw/zinc/99/58/95/1332995895.db2.gz	YHHUQOAWMLYYIG-QAPCUYQASA-N	0	3	337.423	3.243	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2cc(C#N)c[nH]2)CCN1C/C=C\c1ccccc1	ZINC000947173869	1333036675	/nfs/dbraw/zinc/03/66/75/1333036675.db2.gz	AUPXDFXFDZAFNF-AZTIMDOBSA-N	0	3	348.450	3.182	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)C2CC(C)(C)C2)CCN1Cc1ccc(C#N)cc1	ZINC000947278176	1333075421	/nfs/dbraw/zinc/07/54/21/1333075421.db2.gz	XJBLOPQNYWEQEF-BEFAXECRSA-N	0	3	339.483	3.464	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)C2(F)CCCC2)CCN1Cc1ccc(C#N)cc1	ZINC000947464605	1333138433	/nfs/dbraw/zinc/13/84/33/1333138433.db2.gz	WPUFDEKQLCTMOH-MAUKXSAKSA-N	0	3	343.446	3.310	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc3c4c(cccc42)CC3)C[C@@H]1C	ZINC000947520671	1333155447	/nfs/dbraw/zinc/15/54/47/1333155447.db2.gz	QTCUCKVBFDMNAE-MAUKXSAKSA-N	0	3	332.447	3.154	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cn(CC)c3ccccc23)C[C@H]1C	ZINC000947523717	1333157367	/nfs/dbraw/zinc/15/73/67/1333157367.db2.gz	HSJCRFUMQFNARG-IAGOWNOFSA-N	0	3	337.467	3.267	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cn(CC)c3ccccc23)C[C@H]1C	ZINC000947524194	1333158101	/nfs/dbraw/zinc/15/81/01/1333158101.db2.gz	PIGXRFOWSAJDKQ-HZPDHXFCSA-N	0	3	325.456	3.430	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(-c3ccco3)o2)C[C@@H]1C	ZINC000947538145	1333163459	/nfs/dbraw/zinc/16/34/59/1333163459.db2.gz	VWLSGWQURDLJCP-GJZGRUSLSA-N	0	3	326.396	3.146	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnc3c(F)cccc3c2)C[C@@H]1C	ZINC000947547467	1333168025	/nfs/dbraw/zinc/16/80/25/1333168025.db2.gz	RNOKRTRSRIAXEQ-BBRMVZONSA-N	0	3	327.403	3.143	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cnc3ccccc3c2C)C[C@@H]1C	ZINC000947556934	1333171061	/nfs/dbraw/zinc/17/10/61/1333171061.db2.gz	UTXCGFANMOMCBI-DOTOQJQBSA-N	0	3	335.451	3.149	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc3cc(Cl)ccc3[nH]2)C[C@@H]1C	ZINC000947607084	1333190630	/nfs/dbraw/zinc/19/06/30/1333190630.db2.gz	JXWMPUPSVFMXME-WFASDCNBSA-N	0	3	329.831	3.037	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(CCC(F)(F)F)[C@H](C)C2)cc1	ZINC000947612113	1333192716	/nfs/dbraw/zinc/19/27/16/1333192716.db2.gz	UAAGOSDWWXMNGN-CZUORRHYSA-N	0	3	338.373	3.203	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2nsc3ccc(C)cc32)C[C@@H]1C	ZINC000947621791	1333196159	/nfs/dbraw/zinc/19/61/59/1333196159.db2.gz	WKIZICZGLDRBAV-UONOGXRCSA-N	0	3	329.469	3.373	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2csc(-c3ccco3)n2)C[C@@H]1C	ZINC000947661836	1333212747	/nfs/dbraw/zinc/21/27/47/1333212747.db2.gz	AWOSTZKXZFVPHO-UONOGXRCSA-N	0	3	343.452	3.009	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3ccccc3)CCCC2)C[C@@H]1C	ZINC000948001679	1333338235	/nfs/dbraw/zinc/33/82/35/1333338235.db2.gz	DHALBUYBIZIQSL-ICSRJNTNSA-N	0	3	338.495	3.491	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2csc3c2CCCC3)C[C@@H]1C	ZINC000948008135	1333340116	/nfs/dbraw/zinc/34/01/16/1333340116.db2.gz	ZYHSOPGKXHEFKJ-GJZGRUSLSA-N	0	3	330.497	3.233	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2c[nH]cc2-c2ccccc2)C[C@H]1C	ZINC000948035139	1333348318	/nfs/dbraw/zinc/34/83/18/1333348318.db2.gz	CSCWSYABKOTCJJ-SJLPKXTDSA-N	0	3	335.451	3.288	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)CC2C3CC4CC(C3)CC2C4)C[C@@H]1C	ZINC000948057743	1333358465	/nfs/dbraw/zinc/35/84/65/1333358465.db2.gz	YXCLHVZRHPLMNN-PPHBOOHOSA-N	0	3	328.500	3.051	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C(C)(C)c2ccccc2C)C[C@@H]1C	ZINC000948089302	1333371612	/nfs/dbraw/zinc/37/16/12/1333371612.db2.gz	BVWPTJKZKACDDD-ZWKOTPCHSA-N	0	3	326.484	3.265	20	30		EGEDHN
CN(C(=O)CC1CC1)[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948136745	1333387123	/nfs/dbraw/zinc/38/71/23/1333387123.db2.gz	RFSNYNJWYNTXGW-LJQANCHMSA-N	0	3	325.456	3.171	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)Cc2coc3cc(F)ccc23)CC1	ZINC000948354490	1333490642	/nfs/dbraw/zinc/49/06/42/1333490642.db2.gz	SNHQITLPTJPXLB-KRWDZBQOSA-N	0	3	342.414	3.061	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2cncc(-c3ccccc3)c2)CC1	ZINC000948426118	1333520720	/nfs/dbraw/zinc/52/07/20/1333520720.db2.gz	VPLMYDNNJAPQBJ-OAQYLSRUSA-N	0	3	347.462	3.308	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cc3ccncc3s2)CC1	ZINC000948435192	1333523670	/nfs/dbraw/zinc/52/36/70/1333523670.db2.gz	IMGDYRDLOAAHAX-INIZCTEOSA-N	0	3	341.480	3.246	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2oc3c(cccc3F)c2C)CC1	ZINC000948439003	1333525887	/nfs/dbraw/zinc/52/58/87/1333525887.db2.gz	FQVANBPVUPFPAN-HNNXBMFYSA-N	0	3	342.414	3.440	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)C(C)(C)c2cc(C)ccn2)CC1	ZINC000948471318	1333539133	/nfs/dbraw/zinc/53/91/33/1333539133.db2.gz	OWQKMHWZONGTTQ-GOSISDBHSA-N	0	3	341.499	3.004	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2sccc2OC)C12CCC2	ZINC001078786301	1357081959	/nfs/dbraw/zinc/08/19/59/1357081959.db2.gz	SLYWDASDMHZQKB-CHWSQXEVSA-N	0	3	340.876	3.140	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2coc3cc(F)ccc23)CC1	ZINC000948571110	1333581557	/nfs/dbraw/zinc/58/15/57/1333581557.db2.gz	ZNOSGQOUHDUUCJ-HNNXBMFYSA-N	0	3	328.387	3.132	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cc(C)n(CC)c2C)CC1	ZINC000948594147	1333588676	/nfs/dbraw/zinc/58/86/76/1333588676.db2.gz	KZIVVCGBXMFHPY-SFHVURJKSA-N	0	3	329.488	3.075	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2cc(C)oc2C(F)(F)F)CC1	ZINC000948820162	1333697361	/nfs/dbraw/zinc/69/73/61/1333697361.db2.gz	AVPWXQFICBUQPW-CYBMUJFWSA-N	0	3	342.361	3.167	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@H]1CNC(=O)c1cc(C#N)c[nH]1	ZINC000948902813	1333726878	/nfs/dbraw/zinc/72/68/78/1333726878.db2.gz	VMPZICVSZQEERP-HXUWFJFHSA-N	0	3	348.450	3.182	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@@H]1CNC(=O)c1ccn(C)c1	ZINC000948906167	1333728212	/nfs/dbraw/zinc/72/82/12/1333728212.db2.gz	KHLYTUVPGZTPOQ-FQEVSTJZSA-N	0	3	337.467	3.321	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccc(C(C)C)s1)CCO2	ZINC000949253560	1333804631	/nfs/dbraw/zinc/80/46/31/1333804631.db2.gz	GFUHFAVCZSMATP-UHFFFAOYSA-N	0	3	348.512	3.365	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C=C3CCCCC3)CC2)C1	ZINC000949311599	1333821543	/nfs/dbraw/zinc/82/15/43/1333821543.db2.gz	RBMRZCIKFMXUGO-UHFFFAOYSA-N	0	3	332.488	3.146	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C(C)=C3CCC3)CC2)C1	ZINC000949362370	1333830470	/nfs/dbraw/zinc/83/04/70/1333830470.db2.gz	LLZHVNOTWLKJBE-UHFFFAOYSA-N	0	3	332.488	3.146	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3csc(C)c3C)CC2)C1	ZINC000949369741	1333831945	/nfs/dbraw/zinc/83/19/45/1333831945.db2.gz	BQKCRQGTEVPQKV-UHFFFAOYSA-N	0	3	348.512	3.248	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@H](C)C(C)(C)C)CC2)C1	ZINC000949398330	1333837237	/nfs/dbraw/zinc/83/72/37/1333837237.db2.gz	IVOUIUONXJMOLN-KRWDZBQOSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C(C)(C)C3CCC3)CC2)C1	ZINC000949427095	1333845047	/nfs/dbraw/zinc/84/50/47/1333845047.db2.gz	DWQHCGKKRQINPM-UHFFFAOYSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC3(CC2)CN(CCC2CC2)CCO3)CC1	ZINC000949455145	1333851872	/nfs/dbraw/zinc/85/18/72/1333851872.db2.gz	UCIUWUHEEMQERL-UHFFFAOYSA-N	0	3	346.515	3.226	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@@H](C)c3ccsc3)CC2)C1	ZINC000949468256	1333856399	/nfs/dbraw/zinc/85/63/99/1333856399.db2.gz	BBKKZQMBNYRRDM-INIZCTEOSA-N	0	3	348.512	3.121	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@@H]3C[C@H]3CC(C)C)CC2)C1	ZINC000949476815	1333858615	/nfs/dbraw/zinc/85/86/15/1333858615.db2.gz	JOSXNDPJLNODJH-RTBURBONSA-N	0	3	348.531	3.328	20	30		EGEDHN
C=C[C@@H](C(=O)N1CCC2(CC1)CN(C(C)C)CCO2)c1ccccc1	ZINC000949529175	1333868608	/nfs/dbraw/zinc/86/86/08/1333868608.db2.gz	MFHPUKYXHJHECG-LJQANCHMSA-N	0	3	342.483	3.058	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2cc(C)n(C(CC)CC)n2)C1	ZINC000967082592	1335658252	/nfs/dbraw/zinc/65/82/52/1335658252.db2.gz	DJIIFWLEJMQWDX-KXBFYZLASA-N	0	3	344.503	3.016	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2ccc(-n3cccc3)cc2)C1	ZINC000967273992	1335683401	/nfs/dbraw/zinc/68/34/01/1335683401.db2.gz	ODLIADFCKBTISI-FXAWDEMLSA-N	0	3	337.467	3.494	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2ccc3cc(C)ccc3n2)C1	ZINC000967293642	1335692669	/nfs/dbraw/zinc/69/26/69/1335692669.db2.gz	WICYNOXWLHSJQG-OXJNMPFZSA-N	0	3	335.451	3.007	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)Cc2cc3ccccc3s2)C1	ZINC000967331755	1335703185	/nfs/dbraw/zinc/70/31/85/1335703185.db2.gz	COBMJWOYWPNGOC-CRAIPNDOSA-N	0	3	340.492	3.294	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2cc(C3CC3)oc2C2CC2)C1	ZINC000967418537	1335732464	/nfs/dbraw/zinc/73/24/64/1335732464.db2.gz	BCMZQCKRCKTQJJ-KBXCAEBGSA-N	0	3	340.467	3.498	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)Cc2c(C)cc(C)cc2C)C1	ZINC000968170978	1335865745	/nfs/dbraw/zinc/86/57/45/1335865745.db2.gz	ANGSTTGSLLWLTP-UZLBHIALSA-N	0	3	326.484	3.004	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2ccc(N3CC=CC3)cc2)C1	ZINC000968320957	1335889655	/nfs/dbraw/zinc/88/96/55/1335889655.db2.gz	BQAQDQCESPHFLU-YLJYHZDGSA-N	0	3	339.483	3.079	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2ccc3sccc3c2)C1	ZINC000968489676	1335939488	/nfs/dbraw/zinc/93/94/88/1335939488.db2.gz	SGAJDLIGXICJCC-WMLDXEAASA-N	0	3	326.465	3.365	20	30		EGEDHN
CC[C@H](N[C@@H]1CCN(C(=O)C#CC2CC2)C1)c1ccc(F)cc1F	ZINC000968617483	1335985301	/nfs/dbraw/zinc/98/53/01/1335985301.db2.gz	ADQPSARCEDWQRE-QAPCUYQASA-N	0	3	332.394	3.020	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2cc(C3CCCC3)no2)C1	ZINC000968670404	1336003953	/nfs/dbraw/zinc/00/39/53/1336003953.db2.gz	XFMLKKMVINIUQR-RHSMWYFYSA-N	0	3	331.460	3.349	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2c(CC)oc3ccccc32)C1	ZINC000968685693	1336011087	/nfs/dbraw/zinc/01/10/87/1336011087.db2.gz	XQSLOGPPOFYKFQ-NVXWUHKLSA-N	0	3	338.451	3.459	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2c(CC)oc3ccccc32)C1	ZINC000968685694	1336011198	/nfs/dbraw/zinc/01/11/98/1336011198.db2.gz	XQSLOGPPOFYKFQ-RDJZCZTQSA-N	0	3	338.451	3.459	20	30		EGEDHN
C[C@]1(C(=O)N2CC[C@@H](NCc3ccc(C#N)s3)C2)CC=CCC1	ZINC000968783093	1336049089	/nfs/dbraw/zinc/04/90/89/1336049089.db2.gz	LLNPPCBXOJQRAV-KDOFPFPSSA-N	0	3	329.469	3.057	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1ccn(C(C)(C)C)n1	ZINC000968881854	1336078461	/nfs/dbraw/zinc/07/84/61/1336078461.db2.gz	ARJTYCPYZAJJRQ-INIZCTEOSA-N	0	3	332.492	3.189	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cnn(C(C)(C)C)c1C	ZINC000968883058	1336079741	/nfs/dbraw/zinc/07/97/41/1336079741.db2.gz	YVRWKAZTXUAJTI-INIZCTEOSA-N	0	3	332.492	3.107	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NC[C@@H]1CCCCCN1CC=C	ZINC000968923520	1336091609	/nfs/dbraw/zinc/09/16/09/1336091609.db2.gz	VWJXKTVATDCFAP-KRWDZBQOSA-N	0	3	328.456	3.412	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1cccc(-n2cccc2)c1	ZINC000968938987	1336097232	/nfs/dbraw/zinc/09/72/32/1336097232.db2.gz	YWWJDXCDKJKLDD-OAQYLSRUSA-N	0	3	349.478	3.475	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1cc2ccccc2nn1	ZINC000968974471	1336106541	/nfs/dbraw/zinc/10/65/41/1336106541.db2.gz	URQFPLKEKQVUHN-QGZVFWFLSA-N	0	3	338.455	3.180	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1c(F)ccc(F)c1OC	ZINC000968980016	1336108401	/nfs/dbraw/zinc/10/84/01/1336108401.db2.gz	OPRQTHNMWOWAIT-ZDUSSCGKSA-N	0	3	338.398	3.134	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cn(CCCC)nc1C	ZINC000969108487	1336146637	/nfs/dbraw/zinc/14/66/37/1336146637.db2.gz	CSYSWYUIZUINFS-QGZVFWFLSA-N	0	3	332.492	3.152	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cn(CCCC)nc1C	ZINC000969108486	1336146890	/nfs/dbraw/zinc/14/68/90/1336146890.db2.gz	CSYSWYUIZUINFS-KRWDZBQOSA-N	0	3	332.492	3.152	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cnn([C@H](C)CC)c1C	ZINC000969109127	1336147378	/nfs/dbraw/zinc/14/73/78/1336147378.db2.gz	VJTHASPPSYSCCR-WBVHZDCISA-N	0	3	332.492	3.323	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1cc2c(C)cccn2c1	ZINC000969115425	1336149719	/nfs/dbraw/zinc/14/97/19/1336149719.db2.gz	PJOXXUCOQHXGLA-IBGZPJMESA-N	0	3	337.467	3.245	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccc(N(C)CC)cc1	ZINC000969165539	1336170075	/nfs/dbraw/zinc/17/00/75/1336170075.db2.gz	ZYIXEOZBAFMYGY-LJQANCHMSA-N	0	3	329.488	3.303	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@@H](NCc3ccc(C#N)s3)C2)cc1F	ZINC000969250690	1336187751	/nfs/dbraw/zinc/18/77/51/1336187751.db2.gz	VXICMWGCVYVZFT-CQSZACIVSA-N	0	3	343.427	3.072	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)c2cc3c(ccc(C)c3C)[nH]2)C1	ZINC000970269492	1336291581	/nfs/dbraw/zinc/29/15/81/1336291581.db2.gz	XJURXIDIMASVCN-OAHLLOKOSA-N	0	3	325.456	3.411	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2coc3ccc(OC)cc23)CC1	ZINC001005692597	1336393884	/nfs/dbraw/zinc/39/38/84/1336393884.db2.gz	YZIQRKUYAZGWNF-UHFFFAOYSA-N	0	3	328.412	3.164	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2ccc3c(c2)C(C)(C)CO3)CC1	ZINC001005698844	1336394674	/nfs/dbraw/zinc/39/46/74/1336394674.db2.gz	KOLMCVWILJQHKU-UHFFFAOYSA-N	0	3	328.456	3.079	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cccc3c2O[C@@H](C)C3)CC1	ZINC001005732289	1336397839	/nfs/dbraw/zinc/39/78/39/1336397839.db2.gz	RNTXACLHUBSZCN-HNNXBMFYSA-N	0	3	328.456	3.123	20	30		EGEDHN
CN(C(=O)[C@H]1CCC1(C)C)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001005847046	1336408743	/nfs/dbraw/zinc/40/87/43/1336408743.db2.gz	GBGSQGXPFFMVCT-LJQANCHMSA-N	0	3	339.483	3.417	20	30		EGEDHN
C[C@@H]1C[C@@H]1CC(=O)N(C)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001005929651	1336423675	/nfs/dbraw/zinc/42/36/75/1336423675.db2.gz	KRUHYCCSYCPEFL-CRAIPNDOSA-N	0	3	325.456	3.027	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2c(F)ccc(F)c2Cl)CC1	ZINC001006040414	1336441183	/nfs/dbraw/zinc/44/11/83/1336441183.db2.gz	YWZCFZOVYAVXBN-UHFFFAOYSA-N	0	3	328.790	3.341	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ncccc2C(F)(F)F)CC1	ZINC001006240907	1336474767	/nfs/dbraw/zinc/47/47/67/1336474767.db2.gz	ABKWZKGOJUQZPY-UHFFFAOYSA-N	0	3	341.377	3.213	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cc3cccnc3s2)CC1	ZINC001006240934	1336474775	/nfs/dbraw/zinc/47/47/75/1336474775.db2.gz	CNVOBDFTIXCIDN-UHFFFAOYSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)C2(c3ccc(Cl)cc3)CC2)CC1	ZINC001006368459	1336496260	/nfs/dbraw/zinc/49/62/60/1336496260.db2.gz	AQEUMMTYRBORSM-UHFFFAOYSA-N	0	3	332.875	3.480	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2ccc(OCC3CC3)cc2)CC1	ZINC001006416530	1336501525	/nfs/dbraw/zinc/50/15/25/1336501525.db2.gz	MLLZVYMXDRCMTF-UHFFFAOYSA-N	0	3	328.456	3.198	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2cc(C3CCCCC3)n[nH]2)C1	ZINC001007512292	1336661211	/nfs/dbraw/zinc/66/12/11/1336661211.db2.gz	GQGAMAAHUDZNFZ-INIZCTEOSA-N	0	3	330.476	3.228	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)Cc2c[nH]c3ccc(F)cc23)C1	ZINC001008660873	1336905620	/nfs/dbraw/zinc/90/56/20/1336905620.db2.gz	SIEOYNXXTDLCTG-MRXNPFEDSA-N	0	3	329.419	3.006	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCN(Cc3c(C)cccc3C)C2)cn1	ZINC001009269367	1336994422	/nfs/dbraw/zinc/99/44/22/1336994422.db2.gz	OBKCHOHIGZMWHM-FQEVSTJZSA-N	0	3	347.462	3.074	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)Cc2coc3cc(C)ccc23)C1	ZINC001009438891	1337023866	/nfs/dbraw/zinc/02/38/66/1337023866.db2.gz	YWOPPKOIHOFIII-QGZVFWFLSA-N	0	3	326.440	3.440	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N[C@@H]1CCN(Cc2ccc(C)cc2)C1	ZINC001015815780	1338324036	/nfs/dbraw/zinc/32/40/36/1338324036.db2.gz	BWWULXMKHTWVRO-AABGKKOBSA-N	0	3	342.483	3.057	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3ccccc3C(C)C)C2)cn1	ZINC001016032990	1338417960	/nfs/dbraw/zinc/41/79/60/1338417960.db2.gz	HHTQTCRXXZFYHX-FQEVSTJZSA-N	0	3	347.462	3.191	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@@H]3NC(=O)c3ccccc3)CC2)c1	ZINC001016478537	1338617728	/nfs/dbraw/zinc/61/77/28/1338617728.db2.gz	FKYZPPUSTAQGPH-FQEVSTJZSA-N	0	3	345.446	3.343	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)[C@H](C)c2ccc(Cl)cc2)CC1	ZINC001016809622	1338733660	/nfs/dbraw/zinc/73/36/60/1338733660.db2.gz	ZQTJKENNYBHLFQ-PBHICJAKSA-N	0	3	330.859	3.047	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2ccc(O[C@H](C)CC)cc2)CC1	ZINC001016912422	1338767433	/nfs/dbraw/zinc/76/74/33/1338767433.db2.gz	BLIGFFDNLOEISQ-VQIMIIECSA-N	0	3	340.467	3.081	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)C2(c3cccc(C)c3)CC2)CC1	ZINC001016989574	1338795083	/nfs/dbraw/zinc/79/50/83/1338795083.db2.gz	ZFFYBRJOIPKEHB-IBGZPJMESA-N	0	3	336.479	3.021	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC[C@@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001017092657	1338861210	/nfs/dbraw/zinc/86/12/10/1338861210.db2.gz	IOLHBXOXDKTIHZ-XCROGBHMSA-N	0	3	331.485	3.256	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](CN(C)Cc2cnc(C)s2)C1	ZINC001017179713	1338923820	/nfs/dbraw/zinc/92/38/20/1338923820.db2.gz	NHBYODRLLYMBST-OAHLLOKOSA-N	0	3	335.517	3.334	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H](CN(C)Cc2cn(C)nc2C)C1	ZINC001017201673	1338947482	/nfs/dbraw/zinc/94/74/82/1338947482.db2.gz	KRXGZBBRMGGPRU-FXAWDEMLSA-N	0	3	346.519	3.001	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCCN(C(=O)C(C)(C)C)C1	ZINC001017251369	1338982075	/nfs/dbraw/zinc/98/20/75/1338982075.db2.gz	NZMXUFNEIWIMNN-CQSZACIVSA-N	0	3	333.501	3.336	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cnn(C(C)(C)C)c1C	ZINC001017601141	1339375522	/nfs/dbraw/zinc/37/55/22/1339375522.db2.gz	ZZGPUEMVAJMSQW-CALCHBBNSA-N	0	3	344.503	3.202	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(F)c(COC)c1	ZINC001017933585	1339458642	/nfs/dbraw/zinc/45/86/42/1339458642.db2.gz	WZRUSYMSFAFABU-HDICACEKSA-N	0	3	346.446	3.227	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C1CCC(F)(F)CC1	ZINC001017994645	1339477532	/nfs/dbraw/zinc/47/75/32/1339477532.db2.gz	AYWVPRXOPOCHCB-IYBDPMFKSA-N	0	3	326.431	3.453	20	30		EGEDHN
C[C@H](N[C@H]1CCN(C(=O)c2ccc(C#N)[nH]2)C1)c1ccccc1Cl	ZINC001018724479	1339712972	/nfs/dbraw/zinc/71/29/72/1339712972.db2.gz	WQTWXSQAGANCRW-JSGCOSHPSA-N	0	3	342.830	3.105	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCCN2Cc2ccc(C)c(C)c2)nc1	ZINC001028269118	1340523531	/nfs/dbraw/zinc/52/35/31/1340523531.db2.gz	GMYJLIQDHHQLHM-HXUWFJFHSA-N	0	3	347.462	3.074	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1ccccc1C(F)(F)F	ZINC001028281644	1340535963	/nfs/dbraw/zinc/53/59/63/1340535963.db2.gz	NGTOAIXOWPTYQG-CYBMUJFWSA-N	0	3	326.362	3.476	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1cccc(OCC(C)C)c1	ZINC001028305728	1340555292	/nfs/dbraw/zinc/55/52/92/1340555292.db2.gz	WTTQISMXDRDTEP-GOSISDBHSA-N	0	3	330.472	3.492	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1ccc(N(C)CCC)cc1	ZINC001028349539	1340587547	/nfs/dbraw/zinc/58/75/47/1340587547.db2.gz	OOXSPLDLHNONNC-IBGZPJMESA-N	0	3	329.488	3.303	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H](CNC(=O)[C@H]3CCCC34CC4)C2)cc1	ZINC001028628665	1340733750	/nfs/dbraw/zinc/73/37/50/1340733750.db2.gz	XNIZEOWIBBTJIY-RTBURBONSA-N	0	3	337.467	3.077	20	30		EGEDHN
CC1(C)CCC[C@H]1C(=O)NC[C@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC001028747024	1340787594	/nfs/dbraw/zinc/78/75/94/1340787594.db2.gz	WARMIOSYQZIQGI-MOPGFXCFSA-N	0	3	339.483	3.323	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@@H]2CCN(Cc3cccc(C#N)c3)C2)cc1	ZINC001028948048	1340891028	/nfs/dbraw/zinc/89/10/28/1340891028.db2.gz	DWRWUUYMMBDENA-IBGZPJMESA-N	0	3	333.435	3.119	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC([C@@H](C)NCc2cc(F)ccc2C#N)CC1	ZINC001029054073	1340919969	/nfs/dbraw/zinc/91/99/69/1340919969.db2.gz	OWWQRTPOOCNZJC-LSDHHAIUSA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@H](NCc1cc(F)ccc1C#N)C1CCN(C(=O)C2(C)CC2)CC1	ZINC001029104593	1340930905	/nfs/dbraw/zinc/93/09/05/1340930905.db2.gz	VJNIVLQYRZGYNG-AWEZNQCLSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC([C@H](C)NCc2ocnc2C)CC1	ZINC001029126462	1340936373	/nfs/dbraw/zinc/93/63/73/1340936373.db2.gz	TUAVZKLPTTZUBK-AWEZNQCLSA-N	0	3	333.476	3.302	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC([C@H](C)NCc3cc(C)no3)CC2)C1	ZINC001029140957	1340941295	/nfs/dbraw/zinc/94/12/95/1340941295.db2.gz	LJPLIXKTVAJHRU-HNNXBMFYSA-N	0	3	331.460	3.056	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N1C[C@H]2CC[C@@H](C1)N2[C@@H](C)c1ccccc1	ZINC001029482179	1340998644	/nfs/dbraw/zinc/99/86/44/1340998644.db2.gz	YMEIKNJFDXWOAJ-FLNBYBTLSA-N	0	3	340.467	3.014	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001029702484	1341049410	/nfs/dbraw/zinc/04/94/10/1341049410.db2.gz	ITCGIJAXCUXXQI-CYBMUJFWSA-N	0	3	335.448	3.163	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](CN(C)Cc2cnn(C(C)(C)C)c2)C1	ZINC001029802822	1341078199	/nfs/dbraw/zinc/07/81/99/1341078199.db2.gz	FFVJIMIAOVTUDB-MRXNPFEDSA-N	0	3	346.519	3.131	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](CN(C)Cc3cnc(C)s3)C2)CC1	ZINC001029825773	1341087292	/nfs/dbraw/zinc/08/72/92/1341087292.db2.gz	HXWRTLAQZIDJCZ-INIZCTEOSA-N	0	3	347.528	3.478	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCN(C(=O)[C@@H]2CC23CCC3)C1	ZINC001029856092	1341097109	/nfs/dbraw/zinc/09/71/09/1341097109.db2.gz	XFNXAFPKKRKPIH-YOEHRIQHSA-N	0	3	343.496	3.090	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCC(CN(C)Cc2ccc(C#N)s2)CC1	ZINC001029998586	1341151766	/nfs/dbraw/zinc/15/17/66/1341151766.db2.gz	YEOKVLPDRPAZGA-CRAIPNDOSA-N	0	3	345.512	3.336	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)NCC1CN([C@H](C)c2ccccc2)C1	ZINC001032040021	1341443900	/nfs/dbraw/zinc/44/39/00/1341443900.db2.gz	MYIZHUJOJSIPMH-UXPWSPDFSA-N	0	3	342.483	3.167	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NCC1CN([C@@H](C)c2cccc(C)c2)C1	ZINC001032043702	1341445026	/nfs/dbraw/zinc/44/50/26/1341445026.db2.gz	KDSHOOTUDVJCAC-VDGAXYAQSA-N	0	3	342.483	3.085	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H]2C[C@H]1CN2C[C@@H]1CCCC(F)(F)C1	ZINC001032562346	1341540870	/nfs/dbraw/zinc/54/08/70/1341540870.db2.gz	QLRLHLNOSCGWTP-ILXRZTDVSA-N	0	3	326.431	3.309	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H](Cc1ccccc1)C(C)C	ZINC001032624313	1341563783	/nfs/dbraw/zinc/56/37/83/1341563783.db2.gz	IQWJFCSIWSISFD-UFYCRDLUSA-N	0	3	326.484	3.363	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(C)c(OCC)c1	ZINC001032663378	1341575059	/nfs/dbraw/zinc/57/50/59/1341575059.db2.gz	JAEVPIQPUAQALB-ROUUACIJSA-N	0	3	328.456	3.259	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(OC)c(C2CC2)c1	ZINC001032707228	1341585861	/nfs/dbraw/zinc/58/58/61/1341585861.db2.gz	QRINKRHAMJBFTA-IRXDYDNUSA-N	0	3	326.440	3.047	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cnn(CCC(C)C)c1C	ZINC001032723514	1341592372	/nfs/dbraw/zinc/59/23/72/1341592372.db2.gz	KVQONZIMHXTRJW-ROUUACIJSA-N	0	3	344.503	3.103	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H](C)c1ccc(F)c(F)c1	ZINC001032794168	1341615614	/nfs/dbraw/zinc/61/56/14/1341615614.db2.gz	LLUNBLBANOQYNB-KBMXLJTQSA-N	0	3	334.410	3.320	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C12CC(c3ccccc3)(C1)C2	ZINC001032808876	1341621935	/nfs/dbraw/zinc/62/19/35/1341621935.db2.gz	VCDJMAJQZONSHB-CDNGDFIJSA-N	0	3	336.479	3.360	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1cccc(OC(C)C)c1	ZINC001032811890	1341624022	/nfs/dbraw/zinc/62/40/22/1341624022.db2.gz	SRAAWOOWGKEJOC-OALUTQOASA-N	0	3	342.483	3.268	20	30		EGEDHN
C=CCn1cccc1C(=O)N(C)[C@@H]1CCN(Cc2cccc(C)c2)C1	ZINC001033146508	1341739304	/nfs/dbraw/zinc/73/93/04/1341739304.db2.gz	PSDQNJSIKDKDHO-LJQANCHMSA-N	0	3	337.467	3.329	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)C2(c3ccc(F)cc3)CCC2)C1	ZINC001033315487	1341778842	/nfs/dbraw/zinc/77/88/42/1341778842.db2.gz	KGBGBHCREUPIBF-SFHVURJKSA-N	0	3	330.447	3.356	20	30		EGEDHN
C#Cc1cncc(C(=O)N(C)[C@@H]2CCN([C@@H](C)c3cccc(C)c3)C2)c1	ZINC001033405897	1341816786	/nfs/dbraw/zinc/81/67/86/1341816786.db2.gz	PZNBTCSIDGGEQB-LAUBAEHRSA-N	0	3	347.462	3.279	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)C(C)(C)c2cccc(OC)c2)C1	ZINC001033554192	1341869257	/nfs/dbraw/zinc/86/92/57/1341869257.db2.gz	BINQGXIQMLYCFJ-KRWDZBQOSA-N	0	3	330.472	3.082	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)C2(c3ccccc3F)CCC2)C1	ZINC001033573146	1341879053	/nfs/dbraw/zinc/87/90/53/1341879053.db2.gz	ACDYXEYOTXSCKA-INIZCTEOSA-N	0	3	330.447	3.356	20	30		EGEDHN
C#CCCN1CC[C@H](N(C)C(=O)c2csc3c2CC[C@H](C)C3)C1	ZINC001033634516	1341916768	/nfs/dbraw/zinc/91/67/68/1341916768.db2.gz	QNBSRHNSRCKBJY-GJZGRUSLSA-N	0	3	330.497	3.043	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2ccc(OCC(C)C)cc2)C1	ZINC001033639178	1341921169	/nfs/dbraw/zinc/92/11/69/1341921169.db2.gz	DBSHCUACJIWYFO-SFHVURJKSA-N	0	3	330.472	3.444	20	30		EGEDHN
C=CCCN1CC[C@@H](N(CC)C(=O)c2cc3ccncc3s2)C1	ZINC001033855229	1342046140	/nfs/dbraw/zinc/04/61/40/1342046140.db2.gz	IKOLYOUHJVYAJO-OAHLLOKOSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=CCCN1CC[C@H](N(CC)C(=O)c2cc3ccncc3s2)C1	ZINC001033855227	1342046266	/nfs/dbraw/zinc/04/62/66/1342046266.db2.gz	IKOLYOUHJVYAJO-HNNXBMFYSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cc(-c3ccccc3)n[nH]2)C1	ZINC001033890495	1342063604	/nfs/dbraw/zinc/06/36/04/1342063604.db2.gz	PSXAZPWVEUYZQG-KRWDZBQOSA-N	0	3	338.455	3.189	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@@H]2CCOc3c(F)cccc32)C1	ZINC001033893025	1342066165	/nfs/dbraw/zinc/06/61/65/1342066165.db2.gz	QPFGQQAFJPYCSY-DOTOQJQBSA-N	0	3	346.446	3.191	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@@H]2CCc3cc(F)ccc32)C1	ZINC001033902529	1342075949	/nfs/dbraw/zinc/07/59/49/1342075949.db2.gz	KFNNHADFNPHLDJ-IEBWSBKVSA-N	0	3	330.447	3.354	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cc(Cl)c(Cl)[nH]2)C1	ZINC001033912221	1342081891	/nfs/dbraw/zinc/08/18/91/1342081891.db2.gz	GXASNKDSTUNGGI-NSHDSACASA-N	0	3	330.259	3.434	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2csc3ccccc32)C1	ZINC001033918813	1342087813	/nfs/dbraw/zinc/08/78/13/1342087813.db2.gz	OOQXSRLNNKVOJW-HNNXBMFYSA-N	0	3	326.465	3.461	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@H]2CCCc3cccnc32)C1	ZINC001033932059	1342095812	/nfs/dbraw/zinc/09/58/12/1342095812.db2.gz	GDMYYCOPCVWHSB-MSOLQXFVSA-N	0	3	327.472	3.000	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2ccc3sccc3c2)C1	ZINC001034004690	1342142553	/nfs/dbraw/zinc/14/25/53/1342142553.db2.gz	PNYNLRXQEFXGCX-KRWDZBQOSA-N	0	3	326.465	3.461	20	30		EGEDHN
C=CCCN1CCCC[C@H](NC(=O)c2sc(C3CC3)nc2C)C1	ZINC001034202959	1342312707	/nfs/dbraw/zinc/31/27/07/1342312707.db2.gz	CNIJHLDPOULSMU-HNNXBMFYSA-N	0	3	333.501	3.489	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC001034208777	1342318301	/nfs/dbraw/zinc/31/83/01/1342318301.db2.gz	GBXLWJILTCADHB-AWEZNQCLSA-N	0	3	338.373	3.371	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2c(C)nn(C(C)(C)C)c2C)C1	ZINC001034232908	1342336879	/nfs/dbraw/zinc/33/68/79/1342336879.db2.gz	ZDAUOOHCJPVXHM-KRWDZBQOSA-N	0	3	346.519	3.415	20	30		EGEDHN
C=CCCN1CCCC[C@H](NC(=O)c2scnc2C(F)(F)F)C1	ZINC001034244313	1342343023	/nfs/dbraw/zinc/34/30/23/1342343023.db2.gz	XQUZSKKJUDWOFM-NSHDSACASA-N	0	3	347.406	3.322	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2cc(C3CCCCC3)n[nH]2)C1	ZINC001034243637	1342343246	/nfs/dbraw/zinc/34/32/46/1342343246.db2.gz	HLGBOKRBWVOQCE-KRWDZBQOSA-N	0	3	342.487	3.065	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2[nH]nc3ccc(C)cc32)C1	ZINC001034287605	1342373933	/nfs/dbraw/zinc/37/39/33/1342373933.db2.gz	WNEMXXLBPPIQNA-OAHLLOKOSA-N	0	3	326.444	3.032	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)C[C@@H]2C[C@H]2Cc2ccccc2)C1	ZINC001034318585	1342396710	/nfs/dbraw/zinc/39/67/10/1342396710.db2.gz	IBIQCARTXOYHBV-HSALFYBXSA-N	0	3	326.484	3.412	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(N(C)C)cc2)C1	ZINC001034322356	1342399053	/nfs/dbraw/zinc/39/90/53/1342399053.db2.gz	FRAABQLHCKPRGP-YSIASYRMSA-N	0	3	341.499	3.013	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2ccc(C(C)C)nc2CC)C1	ZINC001034395636	1342463476	/nfs/dbraw/zinc/46/34/76/1342463476.db2.gz	AICVNPRBKXMNKH-QGZVFWFLSA-N	0	3	341.499	3.375	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)C2(c3ccccc3F)CCC2)C1	ZINC001034481489	1342539164	/nfs/dbraw/zinc/53/91/64/1342539164.db2.gz	BRFHKHLVVUEGOD-MRXNPFEDSA-N	0	3	330.447	3.404	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cc3c(cccc3OC)[nH]2)C1	ZINC001034528175	1342584076	/nfs/dbraw/zinc/58/40/76/1342584076.db2.gz	PHFUPSYIDXCLTA-HNNXBMFYSA-N	0	3	341.455	3.337	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)Cn2ccc3ccccc32)C1	ZINC001034533095	1342588795	/nfs/dbraw/zinc/58/87/95/1342588795.db2.gz	XPFLCMJIPZNPTE-SFHVURJKSA-N	0	3	325.456	3.188	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cc(OC)c(OC)cc2C)C1	ZINC001034534523	1342590470	/nfs/dbraw/zinc/59/04/70/1342590470.db2.gz	MATXIGSFIBADSK-INIZCTEOSA-N	0	3	346.471	3.173	20	30		EGEDHN
C=C(Cl)CN1CCCC[C@@H](NC(=O)c2cccc(CN(C)C)c2)C1	ZINC001034537956	1342595032	/nfs/dbraw/zinc/59/50/32/1342595032.db2.gz	PGBZZDUKEMTIIY-GOSISDBHSA-N	0	3	349.906	3.085	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)c2ccoc2C)CC1	ZINC001034590517	1342635610	/nfs/dbraw/zinc/63/56/10/1342635610.db2.gz	HDBWLZARDVBIJY-JOCQHMNTSA-N	0	3	341.249	3.127	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CC[C@H](N[C@H](C)c3cnccn3)CC2)CC1	ZINC001034722458	1342715712	/nfs/dbraw/zinc/71/57/12/1342715712.db2.gz	AFXJUJPRRYEFKU-KBAYOESNSA-N	0	3	342.487	3.301	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1CC[C@H](NC(=O)C2CC3(CC3)C2)CC1	ZINC001034731070	1342725959	/nfs/dbraw/zinc/72/59/59/1342725959.db2.gz	GWYQELNPKXLHMD-WGSAOQKQSA-N	0	3	337.467	3.265	20	30		EGEDHN
CC(C)[C@H]1C[C@@H]1C(=O)N[C@H]1CC[C@H](NCc2ccccc2C#N)CC1	ZINC001034771778	1342751057	/nfs/dbraw/zinc/75/10/57/1342751057.db2.gz	STAXEBQWWUDGCX-WTGUMLROSA-N	0	3	339.483	3.367	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2cccc(OC)c2)C12CCC2	ZINC001078793653	1357087607	/nfs/dbraw/zinc/08/76/07/1357087607.db2.gz	ZNVCXKIBMOLLMW-HZPDHXFCSA-N	0	3	334.847	3.078	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)Cc2cccc(OC)c2)C12CCC2	ZINC001078797686	1357090272	/nfs/dbraw/zinc/09/02/72/1357090272.db2.gz	LCVHKOOTGSCOBN-SJORKVTESA-N	0	3	348.874	3.007	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC[C@@H]1CNCc1c(C)noc1C	ZINC001034947412	1342849182	/nfs/dbraw/zinc/84/91/82/1342849182.db2.gz	PVPPOBRLUNNWMN-CQSZACIVSA-N	0	3	339.867	3.151	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H]1CNCc1cnc(Cl)s1	ZINC001035034883	1342889052	/nfs/dbraw/zinc/88/90/52/1342889052.db2.gz	AAJMSYQXYIHXPH-WBMJQRKESA-N	0	3	341.908	3.479	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@@H]2CNCc2c(C)onc2CC)CC1	ZINC001035039829	1342892596	/nfs/dbraw/zinc/89/25/96/1342892596.db2.gz	RRDBUMGMEXDKKR-QGZVFWFLSA-N	0	3	345.487	3.372	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001035042212	1342894516	/nfs/dbraw/zinc/89/45/16/1342894516.db2.gz	XYMXYCSQQFPGRR-KBAYOESNSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1CCC2(CCN(CCF)C2)CC1	ZINC001035198494	1343011683	/nfs/dbraw/zinc/01/16/83/1343011683.db2.gz	GFXBAJSDRKKPNW-UHFFFAOYSA-N	0	3	346.446	3.149	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC2(CCN(Cc3cnc(C)o3)C2)CC1	ZINC001035226153	1343047150	/nfs/dbraw/zinc/04/71/50/1343047150.db2.gz	HNCZHACLGYQOKS-IBGZPJMESA-N	0	3	345.487	3.400	20	30		EGEDHN
C=C[C@H](C(=O)N1CCC2(CCN(CCF)C2)CC1)c1ccccc1	ZINC001035257032	1343083003	/nfs/dbraw/zinc/08/30/03/1343083003.db2.gz	QZJJZMPDSBICEF-SFHVURJKSA-N	0	3	330.447	3.240	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC2(CN(Cc3ccc(C4CC4)cc3)C2)CC1	ZINC001035671758	1343130600	/nfs/dbraw/zinc/13/06/00/1343130600.db2.gz	ZMTUEGLHPYZAFX-MRXNPFEDSA-N	0	3	337.467	3.148	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1c(C)noc1CCC)CC2	ZINC001035706501	1343144150	/nfs/dbraw/zinc/14/41/50/1343144150.db2.gz	IRXMGHDXHKLXQK-UHFFFAOYSA-N	0	3	331.460	3.050	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1nc(C(C)(C)C)cs1)CC2	ZINC001035726466	1343154903	/nfs/dbraw/zinc/15/49/03/1343154903.db2.gz	SMZQWSARXWJSIW-UHFFFAOYSA-N	0	3	345.512	3.002	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@H]1[C@H](C=C(C)C)C1(C)C)CC2	ZINC001035747085	1343167100	/nfs/dbraw/zinc/16/71/00/1343167100.db2.gz	JHYXIKZOSYLABO-ZWKOTPCHSA-N	0	3	328.500	3.173	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C[C@H]1CCCC1(F)F)CC2	ZINC001035775515	1343186209	/nfs/dbraw/zinc/18/62/09/1343186209.db2.gz	FAIKLVJRERZOLQ-OAHLLOKOSA-N	0	3	326.431	3.312	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1c(C)cccc1Cl)CC2	ZINC001035782353	1343193767	/nfs/dbraw/zinc/19/37/67/1343193767.db2.gz	LTGMKUZKOATXIQ-UHFFFAOYSA-N	0	3	330.859	3.210	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccccc1-n1cccc1)CC2	ZINC001035786222	1343197252	/nfs/dbraw/zinc/19/72/52/1343197252.db2.gz	RWGFAVXOZKGZJL-UHFFFAOYSA-N	0	3	347.462	3.039	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@H]1CCCC(F)(F)C1)CC2	ZINC001035794696	1343202745	/nfs/dbraw/zinc/20/27/45/1343202745.db2.gz	KRNDYGFMMDIZGI-HNNXBMFYSA-N	0	3	326.431	3.312	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)CCc1ccccc1C)CC2	ZINC001035803178	1343205576	/nfs/dbraw/zinc/20/55/76/1343205576.db2.gz	CMYDJFSRUVVJGT-UHFFFAOYSA-N	0	3	326.484	3.428	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@@H](C)c1ccc(CC)cc1)CC2	ZINC001035818366	1343213975	/nfs/dbraw/zinc/21/39/75/1343213975.db2.gz	TVNTUNPVVNMDLU-SFHVURJKSA-N	0	3	338.495	3.300	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cccc(F)c1OCC)CC2	ZINC001035829419	1343218468	/nfs/dbraw/zinc/21/84/68/1343218468.db2.gz	QLKQXNRFJPBBPG-UHFFFAOYSA-N	0	3	346.446	3.339	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C[C@@H]1CCO[C@@H](C(C)C)C1)CC2	ZINC001035832292	1343219864	/nfs/dbraw/zinc/21/98/64/1343219864.db2.gz	FXSNCOIQIUUPDB-RTBURBONSA-N	0	3	348.531	3.328	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ncsc1C(C)C)CC2	ZINC001035839304	1343221690	/nfs/dbraw/zinc/22/16/90/1343221690.db2.gz	QGLZFIJCGFXKFL-UHFFFAOYSA-N	0	3	333.501	3.381	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)COc1ccc(Cl)cc1)CC2	ZINC001035844481	1343225898	/nfs/dbraw/zinc/22/58/98/1343225898.db2.gz	ISWUKENTGPRBPD-UHFFFAOYSA-N	0	3	348.874	3.219	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cc1ccccc1Cl)CC2	ZINC001035847360	1343228048	/nfs/dbraw/zinc/22/80/48/1343228048.db2.gz	KSRXTZLTVXKDKX-UHFFFAOYSA-N	0	3	332.875	3.383	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1c(Cl)cccc1OC)CC2	ZINC001035855963	1343232215	/nfs/dbraw/zinc/23/22/15/1343232215.db2.gz	FLUHEHBVZLXVFV-UHFFFAOYSA-N	0	3	348.874	3.463	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cc1cccc(OCC)c1)CC2	ZINC001035856770	1343233276	/nfs/dbraw/zinc/23/32/76/1343233276.db2.gz	CEXYPGSWQYQDRE-UHFFFAOYSA-N	0	3	342.483	3.128	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@H](CC)c1ccc(F)cc1)CC2	ZINC001035859010	1343235157	/nfs/dbraw/zinc/23/51/57/1343235157.db2.gz	OLYYWIWFGUNXOD-LJQANCHMSA-N	0	3	342.458	3.267	20	30		EGEDHN
C[C@H]1CN(C(=O)C2CCCC2)CC[C@@H]1NCc1cc(F)ccc1C#N	ZINC001035872969	1343241602	/nfs/dbraw/zinc/24/16/02/1343241602.db2.gz	ABRPCRQQSHVORD-LIRRHRJNSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@H]1CN(C(=O)CC2CCCC2)CC[C@@H]1NCc1ccccc1C#N	ZINC001035919917	1343272618	/nfs/dbraw/zinc/27/26/18/1343272618.db2.gz	XHBGYQUEXCHZHK-JXFKEZNVSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2(C)CC2)CC[C@@H]1NCc1ccccc1C#N	ZINC001036123991	1343317736	/nfs/dbraw/zinc/31/77/36/1343317736.db2.gz	PZZNBOUASLOSHW-QAPCUYQASA-N	0	3	325.456	3.075	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](NCc2ccccc2C#N)[C@@H](C)C1	ZINC001036136701	1343322681	/nfs/dbraw/zinc/32/26/81/1343322681.db2.gz	KEMBWILCIOAMDP-LPHOPBHVSA-N	0	3	339.483	3.487	20	30		EGEDHN
Cc1cocc1C(=O)N1CC[C@H](NCc2ccccc2C#N)[C@H](C)C1	ZINC001036139793	1343324122	/nfs/dbraw/zinc/32/41/22/1343324122.db2.gz	AOEKPTOKIYCKAQ-KUHUBIRLSA-N	0	3	337.423	3.100	20	30		EGEDHN
CCC1(C(=O)N2CC[C@@H](NCc3cc(F)ccc3C#N)[C@H](C)C2)CC1	ZINC001036163969	1343338626	/nfs/dbraw/zinc/33/86/26/1343338626.db2.gz	DJROSZWBDFBEBA-RDTXWAMCSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](NCc3csc(CC)n3)[C@@H](C)C2)C1	ZINC001036169763	1343342601	/nfs/dbraw/zinc/34/26/01/1343342601.db2.gz	NSLIMIQWVQIHET-GOEBONIOSA-N	0	3	347.528	3.388	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](NCc3nc(C)cs3)[C@@H](C)C2)C1	ZINC001036170214	1343343311	/nfs/dbraw/zinc/34/33/11/1343343311.db2.gz	QVNHUEKNVYXEGQ-DZGCQCFKSA-N	0	3	333.501	3.134	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3cc(C)no3)[C@H](C)C2)CC1	ZINC001036172810	1343345333	/nfs/dbraw/zinc/34/53/33/1343345333.db2.gz	KNXYEXUMBOHQNV-KDOFPFPSSA-N	0	3	331.460	3.056	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3nc(C)oc3C)[C@@H](C)C2)CC1	ZINC001036176065	1343347371	/nfs/dbraw/zinc/34/73/71/1343347371.db2.gz	VOSHVKBXCSKXST-KBXCAEBGSA-N	0	3	345.487	3.364	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@@H]([C@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001036338472	1343423819	/nfs/dbraw/zinc/42/38/19/1343423819.db2.gz	LOFVMCXESKHWAS-DOTOQJQBSA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCCN(C(=O)C2CCC2)C1	ZINC001036341702	1343427818	/nfs/dbraw/zinc/42/78/18/1343427818.db2.gz	WBTJZPXXOLDYDK-HNAYVOBHSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@@H]([C@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001036354515	1343437616	/nfs/dbraw/zinc/43/76/16/1343437616.db2.gz	YMLKRTIRTBADJW-GOEBONIOSA-N	0	3	331.435	3.070	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCCN(C(=O)CCC2CC2)C1	ZINC001036372364	1343449964	/nfs/dbraw/zinc/44/99/64/1343449964.db2.gz	WXNBTUUVMJFRIT-UZLBHIALSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCCN(C(=O)CC2(C)CC2)C1	ZINC001036425559	1343479199	/nfs/dbraw/zinc/47/91/99/1343479199.db2.gz	LTLVWSZDACTKPN-APWZRJJASA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H]([C@H](C)NCc2cscn2)C1	ZINC001036443628	1343491494	/nfs/dbraw/zinc/49/14/94/1343491494.db2.gz	WBWXQPFXUGNQAS-GJZGRUSLSA-N	0	3	335.517	3.462	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@H](C)[C@@H]1CNCc1ccc(C#N)s1	ZINC001036490371	1343513206	/nfs/dbraw/zinc/51/32/06/1343513206.db2.gz	GCZKVMWKNRKVFN-YOEHRIQHSA-N	0	3	333.501	3.383	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)c2ccco2)[C@@H]1CNCc1ccc(C#N)s1	ZINC001036490275	1343513272	/nfs/dbraw/zinc/51/32/72/1343513272.db2.gz	FKBVQACSEYDUGD-CZUORRHYSA-N	0	3	343.452	3.243	20	30		EGEDHN
CCC(=O)N1CC[C@H]2[C@@H](CCN2CC#Cc2cccc(Cl)c2)C1	ZINC001036607806	1343572257	/nfs/dbraw/zinc/57/22/57/1343572257.db2.gz	BGOIRKHPWCAGDO-WMZOPIPTSA-N	0	3	330.859	3.024	20	30		EGEDHN
CCC(=O)N1CC[C@H]2[C@H](CCN2CC#Cc2ccc(Cl)cc2)C1	ZINC001036609023	1343572607	/nfs/dbraw/zinc/57/26/07/1343572607.db2.gz	UGAOQPLHLQHFRG-AEFFLSMTSA-N	0	3	330.859	3.024	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CN(C(=O)C4CCCC4)CC[C@@H]32)s1	ZINC001036621441	1343580467	/nfs/dbraw/zinc/58/04/67/1343580467.db2.gz	UPQRLACVDVMXHS-QAPCUYQASA-N	0	3	343.496	3.233	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CN(C(=O)C4CC=CC4)CC[C@H]32)s1	ZINC001036674579	1343615939	/nfs/dbraw/zinc/61/59/39/1343615939.db2.gz	IBYHLEHQBVQIKP-CRAIPNDOSA-N	0	3	341.480	3.009	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@@H]2[C@H](CCN2CC#Cc2ccccc2)C1	ZINC001036686694	1343629554	/nfs/dbraw/zinc/62/95/54/1343629554.db2.gz	RDVDPWSRWDTLNC-RTBURBONSA-N	0	3	340.442	3.224	20	30		EGEDHN
O=C([C@H]1C[C@H]2C[C@H]2C1)N1CC[C@H]2[C@@H](CCN2CC#Cc2ccccc2)C1	ZINC001036798308	1343732169	/nfs/dbraw/zinc/73/21/69/1343732169.db2.gz	IZOTVNFENBVWQB-ITBHCLRTSA-N	0	3	348.490	3.007	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001036805289	1343741238	/nfs/dbraw/zinc/74/12/38/1343741238.db2.gz	XLGPSMKGYJEIFR-WMLDXEAASA-N	0	3	345.512	3.479	20	30		EGEDHN
Cc1ccoc1C(=O)N[C@@H]1CCC[C@@H]1CNCc1ccccc1C#N	ZINC001036948392	1343889251	/nfs/dbraw/zinc/88/92/51/1343889251.db2.gz	QARNEHOFILFXPK-QZTJIDSGSA-N	0	3	337.423	3.148	20	30		EGEDHN
Cc1coc(C(=O)N[C@H]2CCC[C@@H]2CNCc2ccccc2C#N)c1	ZINC001037061019	1343955922	/nfs/dbraw/zinc/95/59/22/1343955922.db2.gz	WVPKRJSJUGXIGV-MSOLQXFVSA-N	0	3	337.423	3.148	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCC[C@@H]2CNCc2cnc(C)o2)CC1	ZINC001037070187	1343963405	/nfs/dbraw/zinc/96/34/05/1343963405.db2.gz	NMDIFMSPUBRNBE-AEFFLSMTSA-N	0	3	331.460	3.104	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](NCc2cc(C)no2)[C@@H](CC)C1	ZINC001037907527	1344171159	/nfs/dbraw/zinc/17/11/59/1344171159.db2.gz	USHHZJJDLYWNII-RDJZCZTQSA-N	0	3	333.476	3.302	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)[C@@H]1C[C@H]1c1ccc(F)cc1F	ZINC001038543179	1344476757	/nfs/dbraw/zinc/47/67/57/1344476757.db2.gz	OECZEOMKEPVHLP-BHYGNILZSA-N	0	3	334.410	3.225	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(Cl)o2)C1	ZINC001039193471	1344899369	/nfs/dbraw/zinc/89/93/69/1344899369.db2.gz	NRVLHDRAUIFPNI-HUUCEWRRSA-N	0	3	334.847	3.273	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2sccc2F)C1	ZINC001039200154	1344910088	/nfs/dbraw/zinc/91/00/88/1344910088.db2.gz	HCPZLRDYBZJGOD-ZBFHGGJFSA-N	0	3	334.460	3.227	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc(C)c(F)cc2F)C1	ZINC001039210525	1344923905	/nfs/dbraw/zinc/92/39/05/1344923905.db2.gz	BGYJSFJLUILAAC-HNAYVOBHSA-N	0	3	346.421	3.223	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc(C)nc(C)c2)C1	ZINC001039211379	1344925552	/nfs/dbraw/zinc/92/55/52/1344925552.db2.gz	TWOGTTMZKUZUBW-AZUAARDMSA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cn(C)c3ccccc23)C1	ZINC001039217265	1344933985	/nfs/dbraw/zinc/93/39/85/1344933985.db2.gz	GVMOIJPKCHNCMH-XLIONFOSSA-N	0	3	349.478	3.128	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(C)c(F)c2F)C1	ZINC001039237508	1344960374	/nfs/dbraw/zinc/96/03/74/1344960374.db2.gz	IUFDPUMTHJMPML-RDJZCZTQSA-N	0	3	346.421	3.223	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cccc(F)c2Cl)C1	ZINC001039237828	1344960419	/nfs/dbraw/zinc/96/04/19/1344960419.db2.gz	LAHHOFYECIWVQU-WMLDXEAASA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)CCc2ccccc2C)C1	ZINC001039238295	1344961155	/nfs/dbraw/zinc/96/11/55/1344961155.db2.gz	NBJIKZPXHCPHDP-NHCUHLMSSA-N	0	3	338.495	3.264	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)Cc2ccccc2C)C1	ZINC001039241121	1344966033	/nfs/dbraw/zinc/96/60/33/1344966033.db2.gz	XSIHDNKJFHFHFW-LEWJYISDSA-N	0	3	338.495	3.264	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2nc(C)c(C)s2)C1	ZINC001039242501	1344969030	/nfs/dbraw/zinc/96/90/30/1344969030.db2.gz	PDTSCDILGGNDDJ-SJORKVTESA-N	0	3	345.512	3.100	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc(C)c(CC)o2)C1	ZINC001039242984	1344969896	/nfs/dbraw/zinc/96/98/96/1344969896.db2.gz	DYQBTASYHKLESV-ROUUACIJSA-N	0	3	342.483	3.490	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2sccc2CC)C1	ZINC001039244750	1344972967	/nfs/dbraw/zinc/97/29/67/1344972967.db2.gz	YTJCVEQRBREGQM-IRXDYDNUSA-N	0	3	330.497	3.260	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc3sccc3[nH]2)C1	ZINC001039256532	1344985867	/nfs/dbraw/zinc/98/58/67/1344985867.db2.gz	LAPLBOYJGWVQSC-RHSMWYFYSA-N	0	3	341.480	3.179	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(C#N)[nH]1	ZINC001039358257	1345027799	/nfs/dbraw/zinc/02/77/99/1345027799.db2.gz	SBHNILAQVMSLJC-IPELMVKDSA-N	0	3	348.450	3.326	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccc(Cl)c1C	ZINC001039378515	1345034300	/nfs/dbraw/zinc/03/43/00/1345034300.db2.gz	UVVKARIEAWMIBS-CVEARBPZSA-N	0	3	330.859	3.351	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc(F)cc1F	ZINC001039378584	1345035026	/nfs/dbraw/zinc/03/50/26/1345035026.db2.gz	YAFRYFTWTRKZCY-SJORKVTESA-N	0	3	334.410	3.149	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1c(C)oc2ccccc21	ZINC001039379301	1345035339	/nfs/dbraw/zinc/03/53/39/1345035339.db2.gz	JUCBRPFKNMZQND-SJORKVTESA-N	0	3	336.435	3.443	20	30		EGEDHN
C=C(C)CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1scnc1CC	ZINC001039382459	1345037115	/nfs/dbraw/zinc/03/71/15/1345037115.db2.gz	OZYXNDKXIGLEKL-CABCVRRESA-N	0	3	333.501	3.351	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H]1CCC(F)(F)C1	ZINC001039384375	1345038303	/nfs/dbraw/zinc/03/83/03/1345038303.db2.gz	RROYBRFHZDGMCC-XHSDSOJGSA-N	0	3	326.431	3.453	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C1(C)CCC(F)(F)CC1	ZINC001039395808	1345044692	/nfs/dbraw/zinc/04/46/92/1345044692.db2.gz	KWSUGECLKMJYFO-CVEARBPZSA-N	0	3	338.442	3.291	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CCCc2cccnc21	ZINC001039423731	1345061652	/nfs/dbraw/zinc/06/16/52/1345061652.db2.gz	JGLGFYDVWUHVKO-CEXWTWQISA-N	0	3	339.483	3.143	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C(C)(C)c1cccc(F)c1	ZINC001039434129	1345066040	/nfs/dbraw/zinc/06/60/40/1345066040.db2.gz	BAVNYRWVIOXGSY-MOPGFXCFSA-N	0	3	342.458	3.192	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cnc(C(C)C)nc1C	ZINC001039450397	1345074394	/nfs/dbraw/zinc/07/43/94/1345074394.db2.gz	ZGNSDHVHIPORJG-SJORKVTESA-N	0	3	342.487	3.163	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)c1ccccc1F	ZINC001039453156	1345075876	/nfs/dbraw/zinc/07/58/76/1345075876.db2.gz	LEAAXJDMOPGMDK-ZACQAIPSSA-N	0	3	328.431	3.018	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1oc2ccccc2c1C	ZINC001039465962	1345083760	/nfs/dbraw/zinc/08/37/60/1345083760.db2.gz	JQSKBWLBDYLOHG-SJORKVTESA-N	0	3	336.435	3.443	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)n1c(C)ccc1C	ZINC001039474433	1345089076	/nfs/dbraw/zinc/08/90/76/1345089076.db2.gz	IAMLJIFORCMJMC-OTWHNJEPSA-N	0	3	329.488	3.307	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccc(OC(C)C)c1	ZINC001039476143	1345090920	/nfs/dbraw/zinc/09/09/20/1345090920.db2.gz	CKRNOEFIHSKRNZ-MOPGFXCFSA-N	0	3	342.483	3.268	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CCC[C@@H](C1)N2C[C@@H](OC)C1CCCC1	ZINC001039821547	1345199524	/nfs/dbraw/zinc/19/95/24/1345199524.db2.gz	TXJUDVWQBVZLFP-CEXWTWQISA-N	0	3	348.531	3.469	20	30		EGEDHN
C=C(C)CC[N@@H+]1CCC[C@@]2(CCN(C(=O)c3ccccc3[O-])C2)C1	ZINC001040083579	1345328993	/nfs/dbraw/zinc/32/89/93/1345328993.db2.gz	NXOZDJKXVSHMPE-HXUWFJFHSA-N	0	3	328.456	3.287	20	30		EGEDHN
C=C(C)CC[N@H+]1CCC[C@@]2(CCN(C(=O)c3ccccc3[O-])C2)C1	ZINC001040083579	1345328997	/nfs/dbraw/zinc/32/89/97/1345328997.db2.gz	NXOZDJKXVSHMPE-HXUWFJFHSA-N	0	3	328.456	3.287	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@]3(CCN(C(=O)C=C4CCC4)C3)C2)cc1	ZINC001040153668	1345357473	/nfs/dbraw/zinc/35/74/73/1345357473.db2.gz	QDGOFDONXGBWTJ-QFIPXVFZSA-N	0	3	349.478	3.483	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@@]2(C1)CCCN(C/C=C/c1ccccc1)C2	ZINC001040203473	1345374502	/nfs/dbraw/zinc/37/45/02/1345374502.db2.gz	ZBEJJTGUQBLYSA-WAWJGKILSA-N	0	3	348.490	3.428	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3csc(C)c3C)C2)C1	ZINC001040220327	1345380456	/nfs/dbraw/zinc/38/04/56/1345380456.db2.gz	JIJILKAPNCUNHD-LJQANCHMSA-N	0	3	330.497	3.316	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)Cc3ccc(C)c(Cl)c3)C2)C1	ZINC001040262960	1345401509	/nfs/dbraw/zinc/40/15/09/1345401509.db2.gz	WVAFTHXGAPQEQN-FQEVSTJZSA-N	0	3	344.886	3.139	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)C3(c4ccccc4)CCC3)C2)C1	ZINC001040284158	1345411502	/nfs/dbraw/zinc/41/15/02/1345411502.db2.gz	SHPXNCZWZQWRIH-OAQYLSRUSA-N	0	3	336.479	3.056	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)C(C)(C)c3cccs3)C2)C1	ZINC001040322806	1345431639	/nfs/dbraw/zinc/43/16/39/1345431639.db2.gz	MLXBQDZKOQWODO-FQEVSTJZSA-N	0	3	344.524	3.364	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cncc4sccc43)C2)C1	ZINC001040352800	1345449328	/nfs/dbraw/zinc/44/93/28/1345449328.db2.gz	AUERSDRVZPFKAG-IBGZPJMESA-N	0	3	341.480	3.410	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)Cc3cc(C)cc(C)c3)C2)C1	ZINC001040368790	1345458822	/nfs/dbraw/zinc/45/88/22/1345458822.db2.gz	KGUURPKNFZWJIU-JOCHJYFZSA-N	0	3	338.495	3.184	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@@H](C)c3ccc(Cl)cc3)C2)C1	ZINC001040371989	1345460420	/nfs/dbraw/zinc/46/04/20/1345460420.db2.gz	NOETVHFHLFWQOX-OXJNMPFZSA-N	0	3	344.886	3.391	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3ccc(C)cc3Cl)C2)C1	ZINC001040407095	1345480301	/nfs/dbraw/zinc/48/03/01/1345480301.db2.gz	FYOGFFCSTXBKLD-IBGZPJMESA-N	0	3	330.859	3.210	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)C34CCC(CC3)C4(C)C)C2)C1	ZINC001040434004	1345496889	/nfs/dbraw/zinc/49/68/89/1345496889.db2.gz	BWSJBSSMXPVJRI-TWMPVWRBSA-N	0	3	328.500	3.151	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3sccc3COC)C2)C1	ZINC001040494306	1345519440	/nfs/dbraw/zinc/51/94/40/1345519440.db2.gz	WGOUXXFNYCGCLO-GOSISDBHSA-N	0	3	334.485	3.009	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3ccc4ccccc4n3)C2)C1	ZINC001040502898	1345523091	/nfs/dbraw/zinc/52/30/91/1345523091.db2.gz	QDCODNBQJXLOKD-OAQYLSRUSA-N	0	3	335.451	3.349	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)Cc3cccc4ccccc43)C2)C1	ZINC001040503848	1345523924	/nfs/dbraw/zinc/52/39/24/1345523924.db2.gz	VLWVWTXXGUKYRJ-QHCPKHFHSA-N	0	3	346.474	3.330	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3occ4c3CCCC4)C2)C1	ZINC001040506024	1345524579	/nfs/dbraw/zinc/52/45/79/1345524579.db2.gz	KNJWVOJEUHJJRO-FQEVSTJZSA-N	0	3	328.456	3.273	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3occ4c3CCCC4)C2)C1	ZINC001040505863	1345524909	/nfs/dbraw/zinc/52/49/09/1345524909.db2.gz	IVMRIIBQYLAFBS-OAQYLSRUSA-N	0	3	340.467	3.110	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cc(Cl)cn3CC)C2)C1	ZINC001040535186	1345535634	/nfs/dbraw/zinc/53/56/34/1345535634.db2.gz	PFUPSWHRFHMLRD-IBGZPJMESA-N	0	3	347.890	3.113	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)CC(C3CC3)C3CC3)C2)C1	ZINC001040543130	1345538818	/nfs/dbraw/zinc/53/88/18/1345538818.db2.gz	HLDGEYCTRURINW-NRFANRHFSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@H](C)Cc3ccccc3C)C2)C1	ZINC001040546323	1345540799	/nfs/dbraw/zinc/54/07/99/1345540799.db2.gz	CJEHOLXKHNIAEE-DENIHFKCSA-N	0	3	338.495	3.121	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3ccccc3CC(C)C)C2)C1	ZINC001040547185	1345542367	/nfs/dbraw/zinc/54/23/67/1345542367.db2.gz	JJJXCHMBIMZAPM-QFIPXVFZSA-N	0	3	338.495	3.446	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC2(C1)CCN(Cc1cccc(Cl)c1)CC2	ZINC001040644812	1345559391	/nfs/dbraw/zinc/55/93/91/1345559391.db2.gz	RMKAXFVDHPVGQB-HNNXBMFYSA-N	0	3	345.874	3.314	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cccc4c3CCCC4)C2)CC1	ZINC001040713971	1345569130	/nfs/dbraw/zinc/56/91/30/1345569130.db2.gz	CYBSVYUGBLSECI-UHFFFAOYSA-N	0	3	336.479	3.127	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3nc(C(C)(C)C)cs3)C2)CC1	ZINC001040734798	1345572320	/nfs/dbraw/zinc/57/23/20/1345572320.db2.gz	ANFUXMFWKVNSSL-UHFFFAOYSA-N	0	3	345.512	3.002	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@H]3CCCC(F)(F)C3)C2)CC1	ZINC001040846143	1345587203	/nfs/dbraw/zinc/58/72/03/1345587203.db2.gz	MZBJTURJAPGJID-INIZCTEOSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccc(C)c(F)c3F)C2)CC1	ZINC001040862890	1345589815	/nfs/dbraw/zinc/58/98/15/1345589815.db2.gz	XTQUILQPSRCZQX-UHFFFAOYSA-N	0	3	346.421	3.225	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@@H]3C[C@]3(CC)C(C)C)C2)CC1	ZINC001040902563	1345596975	/nfs/dbraw/zinc/59/69/75/1345596975.db2.gz	WFSPOFMNGLCKAE-GHTZIAJQSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cc4cccc(C)c4o3)C2)CC1	ZINC001040950834	1345607910	/nfs/dbraw/zinc/60/79/10/1345607910.db2.gz	CWBWHGMOTQQBKR-UHFFFAOYSA-N	0	3	336.435	3.303	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@]3(CCN(C(=O)c4ccccc4)C3)C2)cc1	ZINC001041025200	1345626637	/nfs/dbraw/zinc/62/66/37/1345626637.db2.gz	ABGQLJOIXDCJSY-JOCHJYFZSA-N	0	3	345.446	3.296	20	30		EGEDHN
CC[C@H](C)C(=O)N1CC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001041088945	1345650699	/nfs/dbraw/zinc/65/06/99/1345650699.db2.gz	SOXUONNPANTXOW-OXJNMPFZSA-N	0	3	325.456	3.029	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3cc4cc(Cl)ccc4o3)C2)C1	ZINC001041452874	1345731672	/nfs/dbraw/zinc/73/16/72/1345731672.db2.gz	XXUYONZVFJYJMH-LJQANCHMSA-N	0	3	342.826	3.257	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)Cc3ccc(C(F)F)cc3)C2)C1	ZINC001041464768	1345735862	/nfs/dbraw/zinc/73/58/62/1345735862.db2.gz	TWEXQIFCHLTOEV-HXUWFJFHSA-N	0	3	346.421	3.114	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)Cc3cccc(C(F)F)c3)C2)C1	ZINC001041469139	1345736704	/nfs/dbraw/zinc/73/67/04/1345736704.db2.gz	XUGSTDCISPSMIE-FQEVSTJZSA-N	0	3	346.421	3.114	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cc(C)cc(Cl)c3)C2)C1	ZINC001041474239	1345738582	/nfs/dbraw/zinc/73/85/82/1345738582.db2.gz	AARGRLGIISUYIO-LJQANCHMSA-N	0	3	330.859	3.210	20	30		EGEDHN
Cc1cocc1C(=O)N1CC[C@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001041559942	1345769333	/nfs/dbraw/zinc/76/93/33/1345769333.db2.gz	OFEKIUMWUKRMAK-NRFANRHFSA-N	0	3	349.434	3.198	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)C(C)(C)c3ccc(Cl)cc3)C2)C1	ZINC001041613023	1345794391	/nfs/dbraw/zinc/79/43/91/1345794391.db2.gz	DOSXJYQDAWEZMM-HXUWFJFHSA-N	0	3	344.886	3.175	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)C[C@H](C)c3ccc(CC)cc3)C2)C1	ZINC001041669781	1345817433	/nfs/dbraw/zinc/81/74/33/1345817433.db2.gz	XLBCIUPILIVOPZ-PGRDOPGGSA-N	0	3	338.495	3.300	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)[C@@H](Cc3ccccc3)C(C)C)C2)C1	ZINC001041670915	1345817842	/nfs/dbraw/zinc/81/78/42/1345817842.db2.gz	KCTJNNILOAOYEG-RBBKRZOGSA-N	0	3	338.495	3.059	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)[C@H]3[C@@H]4CCCCCC[C@@H]43)C2)C1	ZINC001041708374	1345825345	/nfs/dbraw/zinc/82/53/45/1345825345.db2.gz	HQCNXCDZCVACHX-PXCRPINLSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001041720941	1345831369	/nfs/dbraw/zinc/83/13/69/1345831369.db2.gz	YMDFRTRMQRILOA-LAUBAEHRSA-N	0	3	339.483	3.275	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)[C@@H]3C[C@H]3c3ccc(Cl)cc3)C2)C1	ZINC001041736541	1345836128	/nfs/dbraw/zinc/83/61/28/1345836128.db2.gz	TUSXEKWPLWJPNB-NLWGTHIKSA-N	0	3	342.870	3.001	20	30		EGEDHN
C=CCN1CC[C@]2(CCN(C(=O)c3ncoc3-c3cccs3)C2)C1	ZINC001041744714	1345838962	/nfs/dbraw/zinc/83/89/62/1345838962.db2.gz	JFIXZLXSCAHZSH-SFHVURJKSA-N	0	3	343.452	3.127	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)CCc3cc(C)cc(C)c3)C2)C1	ZINC001041775483	1345846182	/nfs/dbraw/zinc/84/61/82/1345846182.db2.gz	PQSNNTZHTZVGEX-JOCHJYFZSA-N	0	3	338.495	3.184	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)C3CCC(C(C)(C)C)CC3)C2)C1	ZINC001041814091	1345860354	/nfs/dbraw/zinc/86/03/54/1345860354.db2.gz	MQJLMMBFNOVXBZ-NGICGMGXSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3csc4c3CC[C@H](C)C4)C2)C1	ZINC001041816321	1345861292	/nfs/dbraw/zinc/86/12/92/1345861292.db2.gz	MQSDSPAIEJXDHU-MGPUTAFESA-N	0	3	342.508	3.044	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)C[C@H](C)c3ccc(F)cc3)C2)C1	ZINC001041842510	1345869768	/nfs/dbraw/zinc/86/97/68/1345869768.db2.gz	HROJUQSNMBYDSX-UWJYYQICSA-N	0	3	342.458	3.267	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3c[nH]c4c3cccc4CC)C2)C1	ZINC001041845547	1345871655	/nfs/dbraw/zinc/87/16/55/1345871655.db2.gz	HRJFYTSMQSSFFN-QFIPXVFZSA-N	0	3	349.478	3.292	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)C34CC(C(C)(C)C)(C3)C4)C2)C1	ZINC001041851606	1345873210	/nfs/dbraw/zinc/87/32/10/1345873210.db2.gz	JVJGDFPDFGGGAG-QNGMFEMESA-N	0	3	328.500	3.151	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CCN(C(=O)C4CCCC4)C[C@H]32)cc1	ZINC001041886142	1345883201	/nfs/dbraw/zinc/88/32/01/1345883201.db2.gz	WEOXJZAIMWVDGT-UYAOXDASSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3c(C)noc3CCC)C[C@@H]21	ZINC001042053658	1345932237	/nfs/dbraw/zinc/93/22/37/1345932237.db2.gz	CQDIEOZIDJFXID-CVEARBPZSA-N	0	3	331.460	3.048	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccoc3C(F)(F)F)C[C@@H]21	ZINC001042075777	1345938132	/nfs/dbraw/zinc/93/81/32/1345938132.db2.gz	NRTSEHQZPXLHCS-YPMHNXCESA-N	0	3	328.334	3.021	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(C)c4ccccc4n3)C[C@H]21	ZINC001042115211	1345947694	/nfs/dbraw/zinc/94/76/94/1345947694.db2.gz	SWCHMGBBOAHLTB-OXQOHEQNSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(-n4cccc4)cc3)C[C@H]21	ZINC001042142005	1345955067	/nfs/dbraw/zinc/95/50/67/1345955067.db2.gz	JPEULEBSFHDFIE-FXAWDEMLSA-N	0	3	335.451	3.200	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)Cc3cccc(C)c3Cl)C[C@@H]21	ZINC001042150026	1345957230	/nfs/dbraw/zinc/95/72/30/1345957230.db2.gz	VUTOQZIYQMCIQR-WMZOPIPTSA-N	0	3	344.886	3.137	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3nc4ccccc4cc3C)C[C@@H]21	ZINC001042155819	1345958610	/nfs/dbraw/zinc/95/86/10/1345958610.db2.gz	NJBYITOABKFVQC-APWZRJJASA-N	0	3	335.451	3.266	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3cccc(F)c3)[C@H]2C1	ZINC001042183686	1345971216	/nfs/dbraw/zinc/97/12/16/1345971216.db2.gz	PZFWVFJAWGDMGJ-WMZOPIPTSA-N	0	3	330.447	3.461	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3cncc(C)c3)[C@@H]2C1	ZINC001042188857	1345975595	/nfs/dbraw/zinc/97/55/95/1345975595.db2.gz	WYQBKWUEXZGBPJ-QZTJIDSGSA-N	0	3	327.472	3.025	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3cncc(C)c3)[C@H]2C1	ZINC001042188856	1345976238	/nfs/dbraw/zinc/97/62/38/1345976238.db2.gz	WYQBKWUEXZGBPJ-MSOLQXFVSA-N	0	3	327.472	3.025	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(Cl)cc3OC)C[C@@H]21	ZINC001042206190	1345984163	/nfs/dbraw/zinc/98/41/63/1345984163.db2.gz	DAKHXBVXDNXRRO-CJNGLKHVSA-N	0	3	334.847	3.071	20	30		EGEDHN
CC1(C(=O)N2CC[C@@H]3CCN(Cc4cccc(C#N)c4)[C@H]3C2)CC=CC1	ZINC001042222731	1345993677	/nfs/dbraw/zinc/99/36/77/1345993677.db2.gz	XUBGQVJWXLHMOA-PMACEKPBSA-N	0	3	349.478	3.337	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccccc3C3(C)CC3)C[C@@H]21	ZINC001042232431	1345998677	/nfs/dbraw/zinc/99/86/77/1345998677.db2.gz	LUQHCEBTFTZBHD-XLIONFOSSA-N	0	3	336.479	3.298	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3ccc(C)c(F)c3F)C[C@H]21	ZINC001042240231	1346000265	/nfs/dbraw/zinc/00/02/65/1346000265.db2.gz	KOEAPGFQNNWBSP-GDBMZVCRSA-N	0	3	334.410	3.386	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(F)cc4cccnc43)C[C@H]21	ZINC001042254637	1346007950	/nfs/dbraw/zinc/00/79/50/1346007950.db2.gz	MUTPFTHUYZZNTN-RDTXWAMCSA-N	0	3	339.414	3.096	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)Cn3cc(C)c4ccccc43)C[C@@H]21	ZINC001042262088	1346010663	/nfs/dbraw/zinc/01/06/63/1346010663.db2.gz	FREFOZSKRWDGEK-XLIONFOSSA-N	0	3	337.467	3.059	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc4c(c3)C=CCC4)C[C@H]21	ZINC001042263784	1346011309	/nfs/dbraw/zinc/01/13/09/1346011309.db2.gz	YSJABZYIWHXACW-WIYYLYMNSA-N	0	3	334.463	3.206	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C(C)(C)c3ccccc3F)C[C@H]21	ZINC001042268541	1346013167	/nfs/dbraw/zinc/01/31/67/1346013167.db2.gz	DFRZDBQGBMCNRD-MAUKXSAKSA-N	0	3	330.447	3.212	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C(C)(C)Cc3ccccc3)C[C@@H]21	ZINC001042305243	1346025485	/nfs/dbraw/zinc/02/54/85/1346025485.db2.gz	XPKVFMBXZJBUJG-OALUTQOASA-N	0	3	326.484	3.364	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3cc4[nH]ccc4s3)C[C@@H]21	ZINC001042327338	1346036696	/nfs/dbraw/zinc/03/66/96/1346036696.db2.gz	WGWFWRPOCJDZAZ-HIFRSBDPSA-N	0	3	329.469	3.342	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)COc3c(C)cc(C)cc3C)C[C@@H]21	ZINC001042331904	1346039173	/nfs/dbraw/zinc/03/91/73/1346039173.db2.gz	GBVWQOFYVVYUKC-MOPGFXCFSA-N	0	3	342.483	3.099	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3cc4c(s3)CCC4)C[C@@H]21	ZINC001042337946	1346042615	/nfs/dbraw/zinc/04/26/15/1346042615.db2.gz	ICGQJUWALNIQDL-ZBFHGGJFSA-N	0	3	330.497	3.349	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)CCc3ccccc3Cl)C[C@H]21	ZINC001042341324	1346045812	/nfs/dbraw/zinc/04/58/12/1346045812.db2.gz	MTFHICMXDYEILO-IEBWSBKVSA-N	0	3	344.886	3.219	20	30		EGEDHN
C/C(=C/C(=O)N1CC[C@H](NCc2ccccc2C#N)C[C@@H]1C)C1CC1	ZINC001044491569	1346347151	/nfs/dbraw/zinc/34/71/51/1346347151.db2.gz	SSSFOKOQQPQJBS-SKBXDANDSA-N	0	3	337.467	3.384	20	30		EGEDHN
Cc1ccncc1C(=O)N1CC[C@@H](NCc2ccccc2C#N)C[C@@H]1C	ZINC001044516964	1346354513	/nfs/dbraw/zinc/35/45/13/1346354513.db2.gz	GESOGMBTOGPBMM-QFBILLFUSA-N	0	3	348.450	3.045	20	30		EGEDHN
Cc1cnccc1C(=O)N1CC[C@H](NCc2ccccc2C#N)C[C@H]1C	ZINC001044590342	1346377375	/nfs/dbraw/zinc/37/73/75/1346377375.db2.gz	ZJAWSKYCHVLSAU-APWZRJJASA-N	0	3	348.450	3.045	20	30		EGEDHN
Cc1cocc1C(=O)N1CC[C@H](NCc2ccccc2C#N)C[C@H]1C	ZINC001044706551	1346406867	/nfs/dbraw/zinc/40/68/67/1346406867.db2.gz	CEMCLPSHMVIWKW-QAPCUYQASA-N	0	3	337.423	3.243	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)C1CC2(CC2)C1	ZINC001044738866	1346417438	/nfs/dbraw/zinc/41/74/38/1346417438.db2.gz	GYOHEIDMPFWXRD-BEFAXECRSA-N	0	3	337.467	3.218	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@@H](NCc3ccccc3C#N)C[C@H]2C)ccn1	ZINC001044786131	1346428136	/nfs/dbraw/zinc/42/81/36/1346428136.db2.gz	ZLESAZOUBSCYDR-OXQOHEQNSA-N	0	3	348.450	3.045	20	30		EGEDHN
C#Cc1ccc(C(=O)NC2(C)CCN(Cc3cnccc3C)CC2)cc1	ZINC001045520757	1346616105	/nfs/dbraw/zinc/61/61/05/1346616105.db2.gz	TXXIVOUOYGGWFQ-UHFFFAOYSA-N	0	3	347.462	3.156	20	30		EGEDHN
C=C(Cl)CN1CCC(C)(NC(=O)c2cccc(CN(C)C)c2)CC1	ZINC001045647269	1346658302	/nfs/dbraw/zinc/65/83/02/1346658302.db2.gz	ZBZOHUXQLGMVBV-UHFFFAOYSA-N	0	3	349.906	3.085	20	30		EGEDHN
CC[C@H](C)C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1ccc(C#N)cc1	ZINC001045717781	1346678152	/nfs/dbraw/zinc/67/81/52/1346678152.db2.gz	BLXSQFGZVRABEO-IPELMVKDSA-N	0	3	325.456	3.170	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCCC[C@@]2(CCN(Cc3cccc(F)c3)C2)C1	ZINC001045920863	1346757723	/nfs/dbraw/zinc/75/77/23/1346757723.db2.gz	BVVIZYZPZCMBHM-UZLBHIALSA-N	0	3	343.446	3.190	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cccc(C)c1F)C2	ZINC001045940048	1346775914	/nfs/dbraw/zinc/77/59/14/1346775914.db2.gz	OPTKETMEHMHGOY-OAQYLSRUSA-N	0	3	342.458	3.476	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@H]1CCC(F)(F)C1)C2	ZINC001045944255	1346780157	/nfs/dbraw/zinc/78/01/57/1346780157.db2.gz	IVBYIJZTVBKSAR-WMZOPIPTSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc[nH]c1C1CCC1)C2	ZINC001045966388	1346801589	/nfs/dbraw/zinc/80/15/89/1346801589.db2.gz	VFMMIEANFCQXGS-NRFANRHFSA-N	0	3	339.483	3.234	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ncccc1Cl)C2	ZINC001045980991	1346818768	/nfs/dbraw/zinc/81/87/68/1346818768.db2.gz	ORFPIEYQJMBPKC-IBGZPJMESA-N	0	3	345.874	3.077	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc(OC)cc1)C2	ZINC001045980817	1346819048	/nfs/dbraw/zinc/81/90/48/1346819048.db2.gz	KAZUFEAVKQFJFZ-NRFANRHFSA-N	0	3	340.467	3.037	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)C(C)(C)c1ccccc1)C2	ZINC001045981219	1346819504	/nfs/dbraw/zinc/81/95/04/1346819504.db2.gz	APTBBYDBZMWMBU-JOCHJYFZSA-N	0	3	338.495	3.302	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccccc1Cl)C2	ZINC001045981719	1346820553	/nfs/dbraw/zinc/82/05/53/1346820553.db2.gz	YREPARSPYUOEHU-IBGZPJMESA-N	0	3	330.859	3.291	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)C[C@H](C)n1cccc1)C2	ZINC001045981625	1346820559	/nfs/dbraw/zinc/82/05/59/1346820559.db2.gz	WBEYMYOSZDMQAK-PZJWPPBQSA-N	0	3	341.499	3.167	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)Cc1ccc(Cl)cc1)C2	ZINC001045984264	1346824915	/nfs/dbraw/zinc/82/49/15/1346824915.db2.gz	ZCBGGXPEYLAJOU-HXUWFJFHSA-N	0	3	344.886	3.220	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)C1CCC=CCC1)C2	ZINC001045985318	1346826366	/nfs/dbraw/zinc/82/63/66/1346826366.db2.gz	RDRQWJYOIGLKBG-OAQYLSRUSA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCCN1CC[C@](C)(NC(=O)c2c(Cl)oc3ccccc32)C1	ZINC001046565410	1347019429	/nfs/dbraw/zinc/01/94/29/1347019429.db2.gz	LQUYWUGWYBFGET-SFHVURJKSA-N	0	3	330.815	3.304	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2cnn(C(CC)CC)c2C)C1	ZINC001046764668	1347090555	/nfs/dbraw/zinc/09/05/55/1347090555.db2.gz	YHRDBWRJYBQTDD-LJQANCHMSA-N	0	3	332.492	3.323	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2ccsc2C)C1	ZINC001046936348	1347157081	/nfs/dbraw/zinc/15/70/81/1347157081.db2.gz	UPCSFHYCIUBMKY-CYBMUJFWSA-N	0	3	328.428	3.320	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2ccoc2CC)C1	ZINC001046936927	1347157424	/nfs/dbraw/zinc/15/74/24/1347157424.db2.gz	YUYPCJMJNNOUOG-CYBMUJFWSA-N	0	3	326.387	3.105	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2coc(C(F)F)c2)C1	ZINC001046965390	1347169040	/nfs/dbraw/zinc/16/90/40/1347169040.db2.gz	AFCMFPNVOMPDFC-GFCCVEGCSA-N	0	3	348.340	3.480	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2scnc2Cl)C1	ZINC001046993131	1347176551	/nfs/dbraw/zinc/17/65/51/1347176551.db2.gz	LHAJOXDUHMUCDN-SNVBAGLBSA-N	0	3	349.834	3.060	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(C/C=C/Cl)C2	ZINC001047084252	1347204179	/nfs/dbraw/zinc/20/41/79/1347204179.db2.gz	JBCHSYDKIOMWKA-VTTDZUNHSA-N	0	3	333.863	3.009	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@H]3C[C@@H](C2)N(Cc2cnc(C)s2)C3)C1	ZINC001047143144	1347219246	/nfs/dbraw/zinc/21/92/46/1347219246.db2.gz	KZFTYYJRWLDARQ-JYJNAYRXSA-N	0	3	345.512	3.277	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)C3CC(F)(F)C3)C2)CC1	ZINC001047234989	1347263301	/nfs/dbraw/zinc/26/33/01/1347263301.db2.gz	UXYVMQYXRHGXBI-INIZCTEOSA-N	0	3	338.442	3.006	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)c3cc[nH]c3CC)C2)CC1	ZINC001047235705	1347263928	/nfs/dbraw/zinc/26/39/28/1347263928.db2.gz	ARJACGVASZKTFJ-SFHVURJKSA-N	0	3	341.499	3.165	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@H](C2CCN(C/C=C/Cl)CC2)C1	ZINC001047236949	1347264376	/nfs/dbraw/zinc/26/43/76/1347264376.db2.gz	LFXFBSUAHPKDFF-OUOXKOSGSA-N	0	3	334.891	3.103	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)c3cc(C)sn3)C2)CC1	ZINC001047241025	1347267102	/nfs/dbraw/zinc/26/71/02/1347267102.db2.gz	MKZUPDPANQMBSB-KRWDZBQOSA-N	0	3	345.512	3.039	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@@H]3CCCC3(C)C)C2)CC1	ZINC001047250008	1347274751	/nfs/dbraw/zinc/27/47/51/1347274751.db2.gz	YWHNETQOZURXRL-OALUTQOASA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)[C@@H]3CC34CCC4)C2)CC1	ZINC001047258372	1347281121	/nfs/dbraw/zinc/28/11/21/1347281121.db2.gz	BFWBVWQAUCIREV-OALUTQOASA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)C(C3CC3)C3CC3)C2)CC1	ZINC001047262793	1347283941	/nfs/dbraw/zinc/28/39/41/1347283941.db2.gz	UVDNKLHHXGRCEL-IBGZPJMESA-N	0	3	328.500	3.006	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3c(F)cccc3F)C2)CC1	ZINC001047265365	1347286497	/nfs/dbraw/zinc/28/64/97/1347286497.db2.gz	QEANCCOQXJMFMC-MRXNPFEDSA-N	0	3	346.421	3.162	20	30		EGEDHN
C=C(C)CCN1C[C@H](O)[C@@H](N(C)C(=O)c2ccccc2C(C)(C)C)C1	ZINC001047422396	1347301086	/nfs/dbraw/zinc/30/10/86/1347301086.db2.gz	QOXFNWUAKVJGMX-OALUTQOASA-N	0	3	344.499	3.067	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@@H]([C@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001047680322	1347327118	/nfs/dbraw/zinc/32/71/18/1347327118.db2.gz	ATTHSZDMIJQZNF-GOEBONIOSA-N	0	3	331.435	3.070	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@H]([C@@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001047733088	1347354904	/nfs/dbraw/zinc/35/49/04/1347354904.db2.gz	RCPYCIQAPLBZRF-PBHICJAKSA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)C2CC(C)(C)C2)C1	ZINC001047829769	1347382960	/nfs/dbraw/zinc/38/29/60/1347382960.db2.gz	IIBSROOMGVMSEN-CRAIPNDOSA-N	0	3	339.483	3.321	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@@H]([C@@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001047960503	1347424694	/nfs/dbraw/zinc/42/46/94/1347424694.db2.gz	WZZMXPNXFLMBGD-GDBMZVCRSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]([C@H](C)NCc3ccn(C(C)C)n3)C2)C1	ZINC001047966279	1347427364	/nfs/dbraw/zinc/42/73/64/1347427364.db2.gz	QYPCZWDWYBITLG-IRXDYDNUSA-N	0	3	344.503	3.147	20	30		EGEDHN
CC(C)=C(F)C(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001048203847	1347493197	/nfs/dbraw/zinc/49/31/97/1347493197.db2.gz	KXIDRRSKXHEITE-RHSMWYFYSA-N	0	3	329.419	3.006	20	30		EGEDHN
N#Cc1ccccc1CN1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@H]1CC13CC3)C2	ZINC001048569842	1347597749	/nfs/dbraw/zinc/59/77/49/1347597749.db2.gz	VUXKMACYEXYLAH-XWPNQZOQSA-N	0	3	349.478	3.218	20	30		EGEDHN
C=C(C)CN1CCC(N(Cc2ccccn2)C(=O)[C@H]2CC2(F)F)CC1	ZINC001048628515	1347624685	/nfs/dbraw/zinc/62/46/85/1347624685.db2.gz	ZRMROVFFXZDXPT-QGZVFWFLSA-N	0	3	349.425	3.106	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CN(C(=O)[C@@H]4CCCC45CC5)C[C@@H]3C2)c1	ZINC001048891253	1347677721	/nfs/dbraw/zinc/67/77/21/1347677721.db2.gz	QUHYFROUTGVCNU-ZCNNSNEGSA-N	0	3	349.478	3.029	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C3CC(C)(C)CC(C)(C)C3)C[C@@H]2C1	ZINC001048960817	1347692157	/nfs/dbraw/zinc/69/21/57/1347692157.db2.gz	NPSWWDAAUBAXDJ-HDICACEKSA-N	0	3	330.516	3.252	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CN(C(=O)C[C@H]4CC=CCC4)C[C@@H]3C2)c1	ZINC001048983664	1347697800	/nfs/dbraw/zinc/69/78/00/1347697800.db2.gz	IJWSLNBMTIGFQS-DZFGPLHGSA-N	0	3	349.478	3.195	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)CC(C3CCC3)C3CCC3)C[C@@H]2C1	ZINC001049063345	1347717866	/nfs/dbraw/zinc/71/78/66/1347717866.db2.gz	PDCMHCZUGGVKPY-KDURUIRLSA-N	0	3	328.500	3.006	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C3CCC(CCCC)CC3)C[C@@H]2C1	ZINC001049202778	1347746721	/nfs/dbraw/zinc/74/67/21/1347746721.db2.gz	CDVJPCSKIBVRFM-KHSMEXAKSA-N	0	3	330.516	3.397	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1csc([C@@H](C)OC)n1	ZINC001049472287	1347864936	/nfs/dbraw/zinc/86/49/36/1347864936.db2.gz	AVZDDNRCIMHKKB-FVQBIDKESA-N	0	3	349.500	3.106	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccn(C2CCCCC2)n1	ZINC001049476136	1347868018	/nfs/dbraw/zinc/86/80/18/1347868018.db2.gz	WNWIEICNPJZPBW-OALUTQOASA-N	0	3	342.487	3.253	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1nsc2ccccc21	ZINC001049494005	1347875952	/nfs/dbraw/zinc/87/59/52/1347875952.db2.gz	FGTJWLFBRVOCDX-CABCVRRESA-N	0	3	327.453	3.161	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cccc2c1CCCC2	ZINC001049496761	1347877420	/nfs/dbraw/zinc/87/74/20/1347877420.db2.gz	CXDQHWYJLWXSTH-NHCUHLMSSA-N	0	3	336.479	3.268	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(CCC)s1	ZINC001049499128	1347878691	/nfs/dbraw/zinc/87/86/91/1347878691.db2.gz	UYRHYHRLBZCGBZ-IAGOWNOFSA-N	0	3	330.497	3.403	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cn(CC)nc1C1CC1	ZINC001049501892	1347880732	/nfs/dbraw/zinc/88/07/32/1347880732.db2.gz	LSDKWGCWISJYDF-QZTJIDSGSA-N	0	3	342.487	3.035	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(Cl)c(Cl)n1C	ZINC001049509341	1347884626	/nfs/dbraw/zinc/88/46/26/1347884626.db2.gz	TUWIPRRJLJFDAH-STQMWFEESA-N	0	3	342.270	3.197	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)CC1(c2ccccc2)CC1	ZINC001049513083	1347886339	/nfs/dbraw/zinc/88/63/39/1347886339.db2.gz	VTSFPSYKFBSEKD-VQTJNVASSA-N	0	3	336.479	3.197	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C1C2CC3CC(C2)CC1C3	ZINC001049521756	1347890145	/nfs/dbraw/zinc/89/01/45/1347890145.db2.gz	MWTMMWONTUTPTF-GOGARBTCSA-N	0	3	340.511	3.147	20	30		EGEDHN
C=C(C)CCN1C[C@@H](C)[C@H](NC(=O)c2sc(Cl)nc2C)C1	ZINC001079775211	1357378331	/nfs/dbraw/zinc/37/83/31/1357378331.db2.gz	ATPQQZJKQVDJRZ-ZYHUDNBSSA-N	0	3	327.881	3.121	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1c(C)noc1C(F)F	ZINC001049544809	1347900324	/nfs/dbraw/zinc/90/03/24/1347900324.db2.gz	PFEXUYMRFLLQON-OLZOCXBDSA-N	0	3	339.386	3.176	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(C)nn1C(CC)CC	ZINC001049561506	1347909946	/nfs/dbraw/zinc/90/99/46/1347909946.db2.gz	MEAGYJNGRZLZCF-MSOLQXFVSA-N	0	3	344.503	3.418	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)C1CCc2ccccc2CC1	ZINC001049562297	1347911135	/nfs/dbraw/zinc/91/11/35/1347911135.db2.gz	VOLDZMGTBPOMBI-RTWAWAEBSA-N	0	3	338.495	3.433	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(C)n([C@@H](C)CC)n1	ZINC001049564689	1347912302	/nfs/dbraw/zinc/91/23/02/1347912302.db2.gz	PITPMPUBTKAHAT-JCGIZDLHSA-N	0	3	330.476	3.027	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1c(C)cccc1Cl	ZINC001049566240	1347913387	/nfs/dbraw/zinc/91/33/87/1347913387.db2.gz	ASIUXKDYANSNFP-ROUUACIJSA-N	0	3	332.875	3.442	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1c(C)[nH]c2ccccc21	ZINC001049582821	1347921606	/nfs/dbraw/zinc/92/16/06/1347921606.db2.gz	QHMQMPRCWOLSLD-MOPGFXCFSA-N	0	3	335.451	3.179	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCNCc1csc(Br)c1	ZINC001133382994	1375964022	/nfs/dbraw/zinc/96/40/22/1375964022.db2.gz	FKKIHIHJQHJMFZ-AWEZNQCLSA-N	0	3	345.306	3.319	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1coc2ccc(OC)cc21	ZINC001049586663	1347923256	/nfs/dbraw/zinc/92/32/56/1347923256.db2.gz	UXIWMARMBNKOMJ-QZTJIDSGSA-N	0	3	340.423	3.306	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc2c(c1)C(C)(C)CO2	ZINC001049587027	1347923545	/nfs/dbraw/zinc/92/35/45/1347923545.db2.gz	DMQFHYDQSFDYBR-QZTJIDSGSA-N	0	3	340.467	3.222	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)CCc1ccc(C(C)C)cc1	ZINC001049594746	1347927603	/nfs/dbraw/zinc/92/76/03/1347927603.db2.gz	RWBUMOXGJGXPEJ-LEWJYISDSA-N	0	3	338.495	3.441	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(C)c2cccnc12	ZINC001049598282	1347930142	/nfs/dbraw/zinc/93/01/42/1347930142.db2.gz	MIJOXJBEQJDGOK-UXHICEINSA-N	0	3	347.462	3.245	20	30		EGEDHN
CC1(CC(=O)N2CCC[C@@H]3[C@H]2CCN3Cc2cccc(C#N)c2)CC1	ZINC001049600769	1347930373	/nfs/dbraw/zinc/93/03/73/1347930373.db2.gz	CPFIRDJBEJMKDH-RTBURBONSA-N	0	3	337.467	3.314	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1ncccc1C	ZINC001049635904	1347946438	/nfs/dbraw/zinc/94/64/38/1347946438.db2.gz	NQVZBUINXACWSV-MSOLQXFVSA-N	0	3	327.472	3.168	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]2[C@H]1CCN2CCc1csc(C)n1	ZINC001049643089	1347950687	/nfs/dbraw/zinc/95/06/87/1347950687.db2.gz	CPFTVDSJFMQUIX-DLBZAZTESA-N	0	3	347.528	3.272	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1ccc(F)cc1Cl	ZINC001049688287	1347971788	/nfs/dbraw/zinc/97/17/88/1347971788.db2.gz	AAIRCDWBUFALEY-IAGOWNOFSA-N	0	3	336.838	3.273	20	30		EGEDHN
CC1(C(=O)N2CCC[C@H]3[C@H]2CCN3Cc2cccc(C#N)c2)CC=CC1	ZINC001049690302	1347973940	/nfs/dbraw/zinc/97/39/40/1347973940.db2.gz	OVVHPQHKOSDUOS-VQTJNVASSA-N	0	3	349.478	3.480	20	30		EGEDHN
CC(F)(F)CC(=O)N1CCC[C@H]2[C@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049694049	1347976156	/nfs/dbraw/zinc/97/61/56/1347976156.db2.gz	ANQIPFIMYATGKU-DLBZAZTESA-N	0	3	347.409	3.169	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc2occc2s1	ZINC001049718264	1347989505	/nfs/dbraw/zinc/98/95/05/1347989505.db2.gz	LIZBECVYEHXKBN-KBPBESRZSA-N	0	3	328.437	3.197	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(C)oc1C(F)(F)F	ZINC001049754955	1348003148	/nfs/dbraw/zinc/00/31/48/1348003148.db2.gz	PDQGKICXFMSYJC-KGLIPLIRSA-N	0	3	342.361	3.472	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1cccc2sccc21	ZINC001049762633	1348007608	/nfs/dbraw/zinc/00/76/08/1348007608.db2.gz	QWCQVNZISPIFPP-ROUUACIJSA-N	0	3	338.476	3.142	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(F)c2ncccc2c1	ZINC001049789857	1348023456	/nfs/dbraw/zinc/02/34/56/1348023456.db2.gz	IABGQGJTCKXPSC-MSOLQXFVSA-N	0	3	339.414	3.239	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccnc(O[C@@H](C)CC)c1	ZINC001049843209	1348054176	/nfs/dbraw/zinc/05/41/76/1348054176.db2.gz	OEEKGHTWQHUTBV-CGTJXYLNSA-N	0	3	343.471	3.124	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)C1CCC(C(F)F)CC1	ZINC001049869438	1348074872	/nfs/dbraw/zinc/07/48/72/1348074872.db2.gz	GXUODFVDQYKJMU-FJBKBRRZSA-N	0	3	326.431	3.309	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(OC(C)C)cc1	ZINC001049871538	1348076600	/nfs/dbraw/zinc/07/66/00/1348076600.db2.gz	MFZMNUSGKSKGQD-MOPGFXCFSA-N	0	3	328.456	3.339	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H]1Cc2ccc(Cl)cc21	ZINC001049871271	1348076727	/nfs/dbraw/zinc/07/67/27/1348076727.db2.gz	PZOGWGHZDYBEGU-GBESFXJTSA-N	0	3	342.870	3.068	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc2c(s1)CCCC2	ZINC001049875976	1348080715	/nfs/dbraw/zinc/08/07/15/1348080715.db2.gz	GWUFDSWBLKPWJS-IRXDYDNUSA-N	0	3	342.508	3.329	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1csc2c1CCCC2	ZINC001049880560	1348085690	/nfs/dbraw/zinc/08/56/90/1348085690.db2.gz	GQMWQRHKQAUZCE-IRXDYDNUSA-N	0	3	330.497	3.492	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(CC)c(C)s1	ZINC001049880490	1348085843	/nfs/dbraw/zinc/08/58/43/1348085843.db2.gz	BNIKTACCGCGFSE-DLBZAZTESA-N	0	3	330.497	3.321	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc2c(cccc2OC)[nH]1	ZINC001049892057	1348095656	/nfs/dbraw/zinc/09/56/56/1348095656.db2.gz	YZGXHGUPEVPVJD-ZWKOTPCHSA-N	0	3	339.439	3.041	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc2cccc(F)c2o1	ZINC001049903919	1348103099	/nfs/dbraw/zinc/10/30/99/1348103099.db2.gz	LMYRYIXLCOFOOV-DLBZAZTESA-N	0	3	340.398	3.274	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](C)Cc1ccccc1C	ZINC001049916570	1348110596	/nfs/dbraw/zinc/11/05/96/1348110596.db2.gz	IFERVRGBVKRVEF-HLAWJBBLSA-N	0	3	338.495	3.262	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](C)c1cccc(OC)c1	ZINC001049923286	1348115187	/nfs/dbraw/zinc/11/51/87/1348115187.db2.gz	UIRZVTVYOLIGBN-AYOQOUSVSA-N	0	3	328.456	3.050	20	30		EGEDHN
CC1CC(C(=O)N2CCC[C@H]3CN(Cc4cccc(C#N)c4)C[C@H]32)C1	ZINC001050015568	1348155236	/nfs/dbraw/zinc/15/52/36/1348155236.db2.gz	ZWLRHRKKIONJCT-FOCMDNRUSA-N	0	3	337.467	3.027	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3cnc4ccsc4c3)[C@@H]2C1	ZINC001050110661	1348185855	/nfs/dbraw/zinc/18/58/55/1348185855.db2.gz	UZKAZTKAIJQIIC-WMLDXEAASA-N	0	3	341.480	3.409	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3CCCN(C(=O)[C@@H]4CC45CCC5)[C@@H]3C2)cc1	ZINC001050151548	1348197278	/nfs/dbraw/zinc/19/72/78/1348197278.db2.gz	ADFNYAFXXBUSJI-SLFFLAALSA-N	0	3	349.478	3.171	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3coc4ccc(F)cc34)[C@@H]2C1	ZINC001050191589	1348207373	/nfs/dbraw/zinc/20/73/73/1348207373.db2.gz	CJUDRBHAYHCDOA-SUMWQHHRSA-N	0	3	328.387	3.294	20	30		EGEDHN
C[C@@H]1C[C@@H]1C(=O)N[C@H]1CC[C@H](CNCc2cc(F)ccc2C#N)CC1	ZINC001050284383	1348226612	/nfs/dbraw/zinc/22/66/12/1348226612.db2.gz	KKXHWBDIZJWGEV-OHHBCXFOSA-N	0	3	343.446	3.118	20	30		EGEDHN
O=C(C#CC1CC1)N1CC2(C1)CCN(Cc1ccccc1Cl)CC2	ZINC001050515825	1348282220	/nfs/dbraw/zinc/28/22/20/1348282220.db2.gz	PGTSHIVTZRFWML-UHFFFAOYSA-N	0	3	342.870	3.178	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C3(C)CCC(F)(F)CC3)C2)CC1	ZINC001050567829	1348291428	/nfs/dbraw/zinc/29/14/28/1348291428.db2.gz	CHDKIFCAXCDBPL-UHFFFAOYSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3cc4cc(Cl)ccc4o3)C2)CC1	ZINC001050584201	1348293501	/nfs/dbraw/zinc/29/35/01/1348293501.db2.gz	ISFMTMXPKJYENI-UHFFFAOYSA-N	0	3	342.826	3.257	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3cc4ccccc4cc3F)C2)CC1	ZINC001050586102	1348294163	/nfs/dbraw/zinc/29/41/63/1348294163.db2.gz	BYOUAEXJUHVSKI-UHFFFAOYSA-N	0	3	336.410	3.150	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3c(Cl)oc4ccccc43)C2)CC1	ZINC001050630125	1348308562	/nfs/dbraw/zinc/30/85/62/1348308562.db2.gz	KRRQEALRILEMKP-UHFFFAOYSA-N	0	3	342.826	3.257	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C(C3CCC3)C3CCC3)C2)CC1	ZINC001050637102	1348310324	/nfs/dbraw/zinc/31/03/24/1348310324.db2.gz	YICCRDWPHCMUKO-UHFFFAOYSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)Cc3ccc(C(C)(C)C)cc3)C2)CC1	ZINC001050679115	1348324440	/nfs/dbraw/zinc/32/44/40/1348324440.db2.gz	RFVGDDNANQMIRG-UHFFFAOYSA-N	0	3	338.495	3.084	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H](CC)Cc3ccccc3)C2)CC1	ZINC001050683277	1348325732	/nfs/dbraw/zinc/32/57/32/1348325732.db2.gz	DHSLZRMMWDROLE-HXUWFJFHSA-N	0	3	338.495	3.203	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc4nc(C)ccc4c3)C2)CC1	ZINC001050706668	1348332277	/nfs/dbraw/zinc/33/22/77/1348332277.db2.gz	WXANKLRTKVUDCK-UHFFFAOYSA-N	0	3	347.462	3.105	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3ccc(-c4ccco4)s3)C2)CC1	ZINC001050717867	1348336144	/nfs/dbraw/zinc/33/61/44/1348336144.db2.gz	VAZWDNIKCVRJBC-UHFFFAOYSA-N	0	3	340.448	3.179	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc4c(c3)CCC=C4)C2)CC1	ZINC001050731456	1348340115	/nfs/dbraw/zinc/34/01/15/1348340115.db2.gz	GUIKRXSQUMMFGC-UHFFFAOYSA-N	0	3	334.463	3.207	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3sccc3C(F)F)C2)CC1	ZINC001050740851	1348344924	/nfs/dbraw/zinc/34/49/24/1348344924.db2.gz	WZOGWEPUIIOUDH-UHFFFAOYSA-N	0	3	338.423	3.247	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccccc3CC(C)C)C2)CC1	ZINC001050769529	1348354239	/nfs/dbraw/zinc/35/42/39/1348354239.db2.gz	VWMFDZFYOVFULS-UHFFFAOYSA-N	0	3	338.495	3.446	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@H](C)Cc3cccc(Cl)c3)C2)CC1	ZINC001050774018	1348355186	/nfs/dbraw/zinc/35/51/86/1348355186.db2.gz	AFDJFFPDNPOMBQ-MRXNPFEDSA-N	0	3	344.886	3.076	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3cc(C)c(C)cn3)cccc2C1	ZINC001051294878	1348423178	/nfs/dbraw/zinc/42/31/78/1348423178.db2.gz	SYIZWEZKQMBFDD-UHFFFAOYSA-N	0	3	347.462	3.010	20	30		EGEDHN
C[C@@H](C(=O)N[C@H]1CCCN(Cc2cccc(C#N)c2)CC1)C1CCC1	ZINC001052484734	1348552799	/nfs/dbraw/zinc/55/27/99/1348552799.db2.gz	RYJRFZUJUFWDAU-UZLBHIALSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cccc3ccc(C)nc32)CC1	ZINC001052485028	1348552892	/nfs/dbraw/zinc/55/28/92/1348552892.db2.gz	YDAUFQPSTGYFCH-GOSISDBHSA-N	0	3	335.451	3.151	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2[nH]c3ccccc3c2Cl)CC1	ZINC001052524534	1348565476	/nfs/dbraw/zinc/56/54/76/1348565476.db2.gz	CQNPHBYGCZDVPW-AWEZNQCLSA-N	0	3	343.858	3.429	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc(OC)c(C(C)C)c2)CC1	ZINC001052532036	1348567782	/nfs/dbraw/zinc/56/77/82/1348567782.db2.gz	WGCAWTLLNXACNR-SFHVURJKSA-N	0	3	342.483	3.426	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)Cc2cc3ccccc3s2)CC1	ZINC001052553430	1348577029	/nfs/dbraw/zinc/57/70/29/1348577029.db2.gz	FDYWBCTUGWJVRR-INIZCTEOSA-N	0	3	326.465	3.048	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2nc3ccccc3cc2C)CC1	ZINC001052571405	1348583005	/nfs/dbraw/zinc/58/30/05/1348583005.db2.gz	GIYIEDKYVQQJQF-GOSISDBHSA-N	0	3	335.451	3.151	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cc3c(o2)c(F)ccc3C)CC1	ZINC001052588698	1348587594	/nfs/dbraw/zinc/58/75/94/1348587594.db2.gz	ZKXVGXSZKICBMZ-OAHLLOKOSA-N	0	3	342.414	3.488	20	30		EGEDHN
Cc1cocc1C(=O)N[C@H]1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC001052628682	1348601638	/nfs/dbraw/zinc/60/16/38/1348601638.db2.gz	FEALWHYWIOVREX-SFHVURJKSA-N	0	3	337.423	3.244	20	30		EGEDHN
CC(C)(C(=O)N[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1)C1CC1	ZINC001052637325	1348606898	/nfs/dbraw/zinc/60/68/98/1348606898.db2.gz	IUNZOCJTOLRRAM-LJQANCHMSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@@H](C)c2ccc(Cl)cc2)CC1	ZINC001052676484	1348625270	/nfs/dbraw/zinc/62/52/70/1348625270.db2.gz	HESCQXVWULABFW-MAUKXSAKSA-N	0	3	332.875	3.438	20	30		EGEDHN
CC1(C(=O)N[C@H]2CCCN(Cc3cccc(C#N)c3)CC2)CC=CC1	ZINC001052682165	1348628632	/nfs/dbraw/zinc/62/86/32/1348628632.db2.gz	QKQLTNSQARDNCC-IBGZPJMESA-N	0	3	337.467	3.385	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCCN(Cc3ccc(C#N)cc3)CC2)C1	ZINC001052691912	1348634801	/nfs/dbraw/zinc/63/48/01/1348634801.db2.gz	ZEXHNSHTNVLSEX-IBGZPJMESA-N	0	3	337.467	3.385	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc(OC)c(C3CC3)c2)CC1	ZINC001052829127	1348693696	/nfs/dbraw/zinc/69/36/96/1348693696.db2.gz	LUYWWIBEMSGITN-GOSISDBHSA-N	0	3	340.467	3.180	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cnc(CC(C)(C)C)s2)CC1	ZINC001052849017	1348700665	/nfs/dbraw/zinc/70/06/65/1348700665.db2.gz	KFWHCABGDJWBJS-OAHLLOKOSA-N	0	3	347.528	3.339	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2cccc(Cl)c2Cl)CC1	ZINC001052891151	1348727227	/nfs/dbraw/zinc/72/72/27/1348727227.db2.gz	LKKJNUGZNNRVQP-GFCCVEGCSA-N	0	3	325.239	3.211	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cc(F)c(F)cc2Cl)CC1	ZINC001052910993	1348743345	/nfs/dbraw/zinc/74/33/45/1348743345.db2.gz	ZBIHLDJAHFADAV-GFCCVEGCSA-N	0	3	340.801	3.226	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2cc3c(s2)CCCCC3)CC1	ZINC001052913158	1348744556	/nfs/dbraw/zinc/74/45/56/1348744556.db2.gz	ILKSZBTYBFTQMP-INIZCTEOSA-N	0	3	330.497	3.235	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cc3c(s2)CC[C@H](C)C3)CC1	ZINC001052924158	1348750681	/nfs/dbraw/zinc/75/06/81/1348750681.db2.gz	VPCWXABKGIQQKL-RDJZCZTQSA-N	0	3	344.524	3.481	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc(F)c3occc32)CC1	ZINC001052946725	1348763105	/nfs/dbraw/zinc/76/31/05/1348763105.db2.gz	CDHSDEJLGZZJCG-CQSZACIVSA-N	0	3	328.387	3.180	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)C23CC(c4ccccc4)(C2)C3)CC1	ZINC001052962715	1348774329	/nfs/dbraw/zinc/77/43/29/1348774329.db2.gz	JSNHXYTWSCHNQW-JSRJAPPDSA-N	0	3	336.479	3.102	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc(CC)c(CC)c2)CC1	ZINC001052983624	1348788472	/nfs/dbraw/zinc/78/84/72/1348788472.db2.gz	QBSSGYFVOHZQHD-HXUWFJFHSA-N	0	3	326.484	3.419	20	30		EGEDHN
CC(=O)N1CCC[C@@H]([C@@H]2CCCN(Cc3ccc(C#N)c(F)c3)C2)C1	ZINC001052998337	1348794710	/nfs/dbraw/zinc/79/47/10/1348794710.db2.gz	XTJLVMBAACFAMF-RTBURBONSA-N	0	3	343.446	3.168	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(Cl)c[nH]2)C1	ZINC001053066568	1348878684	/nfs/dbraw/zinc/87/86/84/1348878684.db2.gz	AZPYKXYGLDYPHK-QAPCUYQASA-N	0	3	347.890	3.398	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(C)oc2C)C1	ZINC001053067413	1348880135	/nfs/dbraw/zinc/88/01/35/1348880135.db2.gz	RCPRARORQFNJDN-MJGOQNOKSA-N	0	3	328.456	3.236	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(C)sn2)C1	ZINC001053080107	1348901609	/nfs/dbraw/zinc/90/16/09/1348901609.db2.gz	AKMIIKAPAMZZLU-AEFFLSMTSA-N	0	3	345.512	3.182	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)COC2CCCCC2)C1	ZINC001053086918	1348909384	/nfs/dbraw/zinc/90/93/84/1348909384.db2.gz	GQLBGSARHZRLBY-QUCCMNQESA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(F)c(F)c2)C1	ZINC001053088437	1348912777	/nfs/dbraw/zinc/91/27/77/1348912777.db2.gz	VIYVMZYHRVATHZ-LPHOPBHVSA-N	0	3	346.421	3.305	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)Cc2ccccc2)C1	ZINC001053088495	1348912914	/nfs/dbraw/zinc/91/29/14/1348912914.db2.gz	WJHFHDRDLQYOQT-SFTDATJTSA-N	0	3	338.495	3.346	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(C)c(F)c2)C1	ZINC001053089517	1348914898	/nfs/dbraw/zinc/91/48/98/1348914898.db2.gz	BKCNFJVLOPPXGL-ICSRJNTNSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)C2CC3(CCC3)C2)C1	ZINC001053092757	1348919631	/nfs/dbraw/zinc/91/96/31/1348919631.db2.gz	IUDCMBUYOGBPNP-MJGOQNOKSA-N	0	3	328.500	3.293	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2csc(C)n2)C1	ZINC001053095574	1348925471	/nfs/dbraw/zinc/92/54/71/1348925471.db2.gz	KALUTTHPMAMOSK-SJLPKXTDSA-N	0	3	345.512	3.182	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cc(Cl)no2)C1	ZINC001053104341	1348939092	/nfs/dbraw/zinc/93/90/92/1348939092.db2.gz	OFRRTMUXZYEXFR-LSDHHAIUSA-N	0	3	349.862	3.058	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2Cc3ccccc3CN2CCC)cc1	ZINC001054049555	1349138523	/nfs/dbraw/zinc/13/85/23/1349138523.db2.gz	BINDCTQLHPKWQG-OAQYLSRUSA-N	0	3	332.447	3.235	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2Cc3ccccc3CN2CC(C)C)cc1	ZINC001054049625	1349139523	/nfs/dbraw/zinc/13/95/23/1349139523.db2.gz	CZPMGOSTADCGLL-JOCHJYFZSA-N	0	3	346.474	3.481	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cscc1Cl)C2	ZINC001054149870	1349155827	/nfs/dbraw/zinc/15/58/27/1349155827.db2.gz	PUCXYMGIUFZZOU-KRWDZBQOSA-N	0	3	336.888	3.353	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cccc3cccnc31)C2	ZINC001054161148	1349163396	/nfs/dbraw/zinc/16/33/96/1349163396.db2.gz	YHLCXHPNHSJOHF-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(C)c(Cl)c1F)C2	ZINC001054171898	1349173047	/nfs/dbraw/zinc/17/30/47/1349173047.db2.gz	ZULSKGBRFJWATL-IBGZPJMESA-N	0	3	348.849	3.349	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccoc1C1CC1)C2	ZINC001054184409	1349186902	/nfs/dbraw/zinc/18/69/02/1349186902.db2.gz	CUZLJVVQMVBYQA-FQEVSTJZSA-N	0	3	326.440	3.108	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)C13CCC(CC1)C3(C)C)C2	ZINC001054210627	1349211674	/nfs/dbraw/zinc/21/16/74/1349211674.db2.gz	SZZFRCYPOKSIDV-SGDIKTSBSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1oc(C(C)C)nc1C)C2	ZINC001054210385	1349211863	/nfs/dbraw/zinc/21/18/63/1349211863.db2.gz	NBMUVRURSIQHRR-HXUWFJFHSA-N	0	3	343.471	3.058	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc(CC)c(CC)o1)C2	ZINC001054229169	1349222434	/nfs/dbraw/zinc/22/24/34/1349222434.db2.gz	LTARPLIGMVRTAA-OAQYLSRUSA-N	0	3	342.483	3.356	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)Cc1c[nH]c3ccccc13)C2	ZINC001054231708	1349224901	/nfs/dbraw/zinc/22/49/01/1349224901.db2.gz	XWDKWLBWJNROJR-QFIPXVFZSA-N	0	3	349.478	3.048	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)Cc1ccc(Cl)cc1)C2	ZINC001054234266	1349226972	/nfs/dbraw/zinc/22/69/72/1349226972.db2.gz	BDYSUTWCAMDPID-HXUWFJFHSA-N	0	3	344.886	3.220	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@H](C)Cc1ccccc1C)C2	ZINC001054247429	1349243064	/nfs/dbraw/zinc/24/30/64/1349243064.db2.gz	WKGBQWUCBNCXHM-DENIHFKCSA-N	0	3	338.495	3.121	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)CCc1ccc(C)s1)C2	ZINC001054248993	1349244888	/nfs/dbraw/zinc/24/48/88/1349244888.db2.gz	IMFNHFANYSRRQL-FQEVSTJZSA-N	0	3	344.524	3.327	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@H]3OCC[C@H]3CC)cc2C1	ZINC001054268998	1349267975	/nfs/dbraw/zinc/26/79/75/1349267975.db2.gz	GLNMUTMOKJSTFX-XLIONFOSSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cc(C4CC4)n[nH]3)cc2C1	ZINC001054282736	1349284576	/nfs/dbraw/zinc/28/45/76/1349284576.db2.gz	UGZVVHVYDRBXKU-UHFFFAOYSA-N	0	3	336.439	3.109	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3cn(CC)cn3)cc2C1	ZINC001054290701	1349295424	/nfs/dbraw/zinc/29/54/24/1349295424.db2.gz	UVUICYSWHSUMAF-UHFFFAOYSA-N	0	3	338.455	3.115	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2C(C)(C)C2(C)C)C[C@H]1NCc1ccc(C#N)s1	ZINC001054543496	1349392943	/nfs/dbraw/zinc/39/29/43/1349392943.db2.gz	VQLMIXREAOWBIE-IUODEOHRSA-N	0	3	345.512	3.238	20	30		EGEDHN
Cc1cc(C(=O)N2C[C@H](NCc3ccc(C#N)s3)[C@@H](C)C2)oc1C	ZINC001054570794	1349403015	/nfs/dbraw/zinc/40/30/15/1349403015.db2.gz	WVMLNNSQIZFWPU-LRDDRELGSA-N	0	3	343.452	3.080	20	30		EGEDHN
C[C@H]1CN(C(=O)C2=CCCCCC2)C[C@H]1NCc1ccc(C#N)s1	ZINC001054599207	1349411036	/nfs/dbraw/zinc/41/10/36/1349411036.db2.gz	MXPRCQPKQUESQJ-KBXCAEBGSA-N	0	3	343.496	3.447	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CC(C)(C)C2)C[C@@H]1NCc1ccc(C#N)c(F)c1	ZINC001054617074	1349416072	/nfs/dbraw/zinc/41/60/72/1349416072.db2.gz	CBYZRBGYKHQZEM-ACJLOTCBSA-N	0	3	343.446	3.070	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](C)[C@H](NCc2ccnc(Cl)c2)C1	ZINC001054970408	1349531552	/nfs/dbraw/zinc/53/15/52/1349531552.db2.gz	CIMLYWNLKAPVCM-DZGCQCFKSA-N	0	3	335.879	3.274	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@@H](NCc2cn(C(C)C)nc2C)C1	ZINC001054971376	1349531998	/nfs/dbraw/zinc/53/19/98/1349531998.db2.gz	POXKRBWOXUWGQN-QAPCUYQASA-N	0	3	346.519	3.311	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2sccc2-n2cccc2)C1	ZINC001080228827	1357530542	/nfs/dbraw/zinc/53/05/42/1357530542.db2.gz	SOYOBOZNEDHYPH-HUUCEWRRSA-N	0	3	329.469	3.165	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H](CNCc2ccc(C#N)s2)C2CC2)s1	ZINC001322957412	1387255926	/nfs/dbraw/zinc/25/59/26/1387255926.db2.gz	ZTXFRAPWOJUSKA-OAHLLOKOSA-N	0	3	345.493	3.288	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(C)c(C)c2)C1	ZINC001080584956	1357687202	/nfs/dbraw/zinc/68/72/02/1357687202.db2.gz	ZPJDEAYQNGINAQ-GSEOLPGOSA-N	0	3	326.484	3.420	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C1(C3CCC3)CCC1)C[C@@H](C)O2	ZINC001071196808	1354498499	/nfs/dbraw/zinc/49/84/99/1354498499.db2.gz	IQOQGJJYJZNZHB-XLIONFOSSA-N	0	3	346.515	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)CC1CC(C)(C)C1)C[C@H](C)O2	ZINC001071201396	1354502226	/nfs/dbraw/zinc/50/22/26/1354502226.db2.gz	DMRDOVDZAMZYSD-OXJNMPFZSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc3c(c2)OCCCO3)CC[C@@H]1C	ZINC001071568789	1354768891	/nfs/dbraw/zinc/76/88/91/1354768891.db2.gz	SUTPXZKCLDBDGN-RDJZCZTQSA-N	0	3	344.455	3.007	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccnc(-n3cccc3)c2)CC[C@@H]1C	ZINC001071594674	1354784749	/nfs/dbraw/zinc/78/47/49/1354784749.db2.gz	WIXNWZNPVRVUPU-WMZOPIPTSA-N	0	3	338.455	3.031	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cnoc2-c2ccco2)CC[C@@H]1C	ZINC001071623195	1354805295	/nfs/dbraw/zinc/80/52/95/1354805295.db2.gz	SKWABQOUUYDMFH-KBPBESRZSA-N	0	3	329.400	3.093	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)c2cn(CC)c3ccccc23)CC[C@H]1C	ZINC001071670585	1354840660	/nfs/dbraw/zinc/84/06/60/1354840660.db2.gz	NHKPFTBGXYQOME-HZPDHXFCSA-N	0	3	325.456	3.430	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(C)nc2C2CC2)CC[C@@H]1C	ZINC001071704513	1354862996	/nfs/dbraw/zinc/86/29/96/1354862996.db2.gz	AJLCCFJCDUQWCH-RDJZCZTQSA-N	0	3	327.472	3.426	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(C(F)(F)F)nc2)CC[C@H]1C	ZINC001071721430	1354880083	/nfs/dbraw/zinc/88/00/83/1354880083.db2.gz	QNABWHROQVIBJF-TZMCWYRMSA-N	0	3	341.377	3.259	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CC[C@@H](C)N(CCc3scnc3C)C2)C1	ZINC001071808244	1354952095	/nfs/dbraw/zinc/95/20/95/1354952095.db2.gz	YIDWMHNBFIDJMX-GDBMZVCRSA-N	0	3	347.528	3.319	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@H]2CC[C@@H](C)N(CC=C(C)C)C2)cc1	ZINC001071868045	1354994218	/nfs/dbraw/zinc/99/42/18/1354994218.db2.gz	GSUSXOCAINORCH-MJGOQNOKSA-N	0	3	340.467	3.248	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2ccc(Cl)s2)CC[C@@H]1C	ZINC001071870519	1354996487	/nfs/dbraw/zinc/99/64/87/1354996487.db2.gz	BBQPIVPLIHIKRM-QWHCGFSZSA-N	0	3	326.893	3.489	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)Cc2c[nH]c3c2cccc3C)CC[C@H]1C	ZINC001071873316	1354998655	/nfs/dbraw/zinc/99/86/55/1354998655.db2.gz	UQVCEJUWWXUZOG-NVXWUHKLSA-N	0	3	325.456	3.174	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2noc3ccc(F)cc23)CC[C@@H]1C	ZINC001071884031	1355004655	/nfs/dbraw/zinc/00/46/55/1355004655.db2.gz	WOYZNTZODOSSLE-DZGCQCFKSA-N	0	3	345.418	3.055	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cccc(N3CCCC3)c2)CC[C@@H]1C	ZINC001071930511	1355030777	/nfs/dbraw/zinc/03/07/77/1355030777.db2.gz	GBSIFKZPAKTJFK-HKUYNNGSSA-N	0	3	341.499	3.446	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cnn(CCCC)c2CC)CC[C@@H]1C	ZINC001071977277	1355056068	/nfs/dbraw/zinc/05/60/68/1355056068.db2.gz	OVORAARRRWGNSF-DLBZAZTESA-N	0	3	346.519	3.404	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CC[C@@H](C)N(Cc3ccccc3C)C2)nc1	ZINC001072000694	1355066323	/nfs/dbraw/zinc/06/63/23/1355066323.db2.gz	ZBGYVESEIBYYTO-YLJYHZDGSA-N	0	3	347.462	3.154	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(OC(C)C)cc2)CC[C@H]1C	ZINC001072049588	1355103250	/nfs/dbraw/zinc/10/32/50/1355103250.db2.gz	PUDMLFBXVWVYSR-AEFFLSMTSA-N	0	3	328.456	3.080	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc(OC)c(C)c(OC)c2)CC[C@H]1C	ZINC001072050500	1355104403	/nfs/dbraw/zinc/10/44/03/1355104403.db2.gz	YNSKBYYBUGDZOR-RHSMWYFYSA-N	0	3	346.471	3.171	20	30		EGEDHN
C=C(C)CCN1C[C@H](NC(=O)c2scnc2Cl)CC[C@@H]1C	ZINC001072072352	1355113138	/nfs/dbraw/zinc/11/31/38/1355113138.db2.gz	JALUFZRMHAVITG-NWDGAFQWSA-N	0	3	327.881	3.345	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(OC3CCC3)cc2)CC[C@@H]1C	ZINC001072095686	1355127555	/nfs/dbraw/zinc/12/75/55/1355127555.db2.gz	MTPYDDFPCKZMJM-WMZOPIPTSA-N	0	3	340.467	3.224	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C23CC(c4ccccc4)(C2)C3)CC[C@H]1C	ZINC001072110319	1355136796	/nfs/dbraw/zinc/13/67/96/1355136796.db2.gz	WDOUGRHMBJVJSI-AZIUHJDESA-N	0	3	336.479	3.101	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(-c3ccccc3)[nH]2)CC[C@H]1C	ZINC001072113007	1355137910	/nfs/dbraw/zinc/13/79/10/1355137910.db2.gz	LVZKXNUAEXWUMB-AEFFLSMTSA-N	0	3	335.451	3.288	20	30		EGEDHN
C/C=C(\C)C(=O)N1CC[C@H](C)[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001072240889	1355201142	/nfs/dbraw/zinc/20/11/42/1355201142.db2.gz	ONVNKNYKAJGGKP-HKSUGUPZSA-N	0	3	343.446	3.238	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](C)[C@@H](CNCc2cc(C3CC3)no2)C1	ZINC001072337568	1355245533	/nfs/dbraw/zinc/24/55/33/1355245533.db2.gz	YRWALHSTKOLZKT-HOCLYGCPSA-N	0	3	345.487	3.338	20	30		EGEDHN
C[C@@H]1CCN(C(=O)CC(C)(F)F)C[C@H]1CNCc1ccccc1C#N	ZINC001072359814	1355255637	/nfs/dbraw/zinc/25/56/37/1355255637.db2.gz	HXEAPPXSHOIWSI-RHSMWYFYSA-N	0	3	349.425	3.178	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](C)[C@@H](CNCc3cscn3)C2)C1	ZINC001072364170	1355258472	/nfs/dbraw/zinc/25/84/72/1355258472.db2.gz	POLOKWOPIWNNQL-GJZGRUSLSA-N	0	3	333.501	3.074	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC2(C1)CCN([C@@H](C)c1ccccc1Cl)C2	ZINC001072544220	1355326716	/nfs/dbraw/zinc/32/67/16/1355326716.db2.gz	FMEUBGHNWXKVNJ-KBPBESRZSA-N	0	3	331.847	3.095	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2coc3c2cccc3C)C1	ZINC001073639513	1355849990	/nfs/dbraw/zinc/84/99/90/1355849990.db2.gz	HPBMWFQSYPXNGD-INIZCTEOSA-N	0	3	342.439	3.138	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)[C@H]2CC[C@H](C3CCC3)CC2)C1	ZINC001073642740	1355850428	/nfs/dbraw/zinc/85/04/28/1355850428.db2.gz	SOSAFBBLQFDVHZ-VAMGGRTRSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2ccccc2C2(C)CC2)C1	ZINC001073759941	1355891465	/nfs/dbraw/zinc/89/14/65/1355891465.db2.gz	MSPDCYDLQCLVRC-QGZVFWFLSA-N	0	3	342.483	3.135	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2cc(C)c(CC)s2)C1	ZINC001073880351	1355938288	/nfs/dbraw/zinc/93/82/88/1355938288.db2.gz	GVNGALYSOJIFPR-OAHLLOKOSA-N	0	3	336.501	3.016	20	30		EGEDHN
Cc1cc(F)ccc1CN(C)C[C@H]1CCCCN1C(=O)[C@@H](C)C#N	ZINC001073972993	1356004702	/nfs/dbraw/zinc/00/47/02/1356004702.db2.gz	MZIQSAIEZRLALQ-MAUKXSAKSA-N	0	3	331.435	3.107	20	30		EGEDHN
C[C@@H](C(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(C#N)cc1)C1CC1	ZINC001073981412	1356009544	/nfs/dbraw/zinc/00/95/44/1356009544.db2.gz	AYCLTTIRXHQVHX-OXQOHEQNSA-N	0	3	339.483	3.417	20	30		EGEDHN
C[C@H]1[C@@H](NCc2ccc(C#N)c(F)c2)CCN1C(=O)C[C@@H]1C=CCC1	ZINC001074520112	1356202992	/nfs/dbraw/zinc/20/29/92/1356202992.db2.gz	RRXRZBVXLVYPJX-KHYOSLBOSA-N	0	3	341.430	3.133	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCO[C@@H]1C1CCN(C(=O)/C(C)=C/C)CC1	ZINC001075408978	1356359970	/nfs/dbraw/zinc/35/99/70/1356359970.db2.gz	PPYOFFNBADZYST-RSSSTFLOSA-N	0	3	340.895	3.081	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3cc(C4CC4)oc3C3CC3)[C@@H]2C1	ZINC001076071572	1356481468	/nfs/dbraw/zinc/48/14/68/1356481468.db2.gz	LLKKFMCPWSXFSL-FUHWJXTLSA-N	0	3	338.451	3.204	20	30		EGEDHN
C=CCCN1C[C@@H]2CCN(C(=O)c3cnc(C(C)(C)C)s3)[C@@H]2C1	ZINC001076611553	1356631401	/nfs/dbraw/zinc/63/14/01/1356631401.db2.gz	YSSCUMJDIWQXTQ-UONOGXRCSA-N	0	3	333.501	3.163	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)Cc1ccc(OC)cc1C	ZINC001099098329	1363620997	/nfs/dbraw/zinc/62/09/97/1363620997.db2.gz	NUIXYNKEZCUFCZ-GOSISDBHSA-N	0	3	344.499	3.339	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)Cc1ccccc1	ZINC001099120793	1363634772	/nfs/dbraw/zinc/63/47/72/1363634772.db2.gz	FRJCJWMKHYZTKR-LJQANCHMSA-N	0	3	344.499	3.039	20	30		EGEDHN
CCCCCCCCC(=O)NCC[C@H](C)NC(=O)CN(C)C(C)C	ZINC001078328240	1356953259	/nfs/dbraw/zinc/95/32/59/1356953259.db2.gz	NQQKTEBTKNOSNT-KRWDZBQOSA-N	0	3	341.540	3.088	20	30		EGEDHN
C=C1CCC(C(=O)N2CCCO[C@H](CNCc3ccsc3)C2)CC1	ZINC001078460406	1356977923	/nfs/dbraw/zinc/97/79/23/1356977923.db2.gz	SACDHFMMFRXHDR-GOSISDBHSA-N	0	3	348.512	3.202	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2cc(CC)ccn2)C12CCC2	ZINC001078628293	1357040832	/nfs/dbraw/zinc/04/08/32/1357040832.db2.gz	BXTJXKMZEJCZTM-HZPDHXFCSA-N	0	3	333.863	3.027	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2cc(C)ccc2OC)C12CCC2	ZINC001078676631	1357050792	/nfs/dbraw/zinc/05/07/92/1357050792.db2.gz	ZOYCWMUOXSGFLR-SJORKVTESA-N	0	3	348.874	3.387	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@@H](NCc3ccns3)C23CCC3)CC1	ZINC001078716808	1357062719	/nfs/dbraw/zinc/06/27/19/1357062719.db2.gz	YWAQPZAHGAHSJQ-SJORKVTESA-N	0	3	345.512	3.407	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@@H](NCc3ncccc3C)C23CCC3)C1	ZINC001078720578	1357065606	/nfs/dbraw/zinc/06/56/06/1357065606.db2.gz	NIRYVNDZQKPIRU-MSOLQXFVSA-N	0	3	339.483	3.263	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2ncccc2Cl)C12CCC2	ZINC001078785286	1357080956	/nfs/dbraw/zinc/08/09/56/1357080956.db2.gz	AXPYFJVZNSOTLX-OLZOCXBDSA-N	0	3	340.254	3.118	20	30		EGEDHN
CCC(=O)N1C[C@@H](c2ccccc2)[C@H](NCc2ccc(C#N)s2)C1	ZINC001081072054	1357812403	/nfs/dbraw/zinc/81/24/03/1357812403.db2.gz	BWNYZNBVWBUGCQ-ZWKOTPCHSA-N	0	3	339.464	3.114	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2cc(CC(C)C)c[nH]2)C[C@H]1c1ccccc1	ZINC001081215653	1357850028	/nfs/dbraw/zinc/85/00/28/1357850028.db2.gz	PGPQBQNBEZORHM-PZJWPPBQSA-N	0	3	349.478	3.044	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2ccc(Cl)s2)C[C@H]1c1ccccc1	ZINC001081219492	1357850884	/nfs/dbraw/zinc/85/08/84/1357850884.db2.gz	FGSQRWGSCIKXBJ-LSDHHAIUSA-N	0	3	344.867	3.233	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2cccc(C(C)C)c2)[C@H](OC)C1	ZINC001082299423	1358010503	/nfs/dbraw/zinc/01/05/03/1358010503.db2.gz	XEEXTDIZCQOVSI-RTBURBONSA-N	0	3	330.472	3.205	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2ccsc2C(F)F)[C@H](OC)C1	ZINC001082348227	1358020203	/nfs/dbraw/zinc/02/02/03/1358020203.db2.gz	PXDALPVGFTXFOF-CHWSQXEVSA-N	0	3	344.427	3.081	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H](C)[C@H](NCc2cnn(C(C)(C)C)c2)C1	ZINC001082722823	1358080826	/nfs/dbraw/zinc/08/08/26/1358080826.db2.gz	JLXXFQJTDXQWEX-MDYRTPRTSA-N	0	3	346.519	3.177	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CCN(CCc3scnc3C)C[C@H]21	ZINC001084574041	1358241268	/nfs/dbraw/zinc/24/12/68/1358241268.db2.gz	NPLFNPVXIOHDED-HZPDHXFCSA-N	0	3	347.528	3.129	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)CCc3ccc(F)cc3F)[C@@H]2C1	ZINC001084751230	1358300509	/nfs/dbraw/zinc/30/05/09/1358300509.db2.gz	BERFPENCFVTUHH-CRAIPNDOSA-N	0	3	334.410	3.006	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@H](CC)c3ccc(OC)cc3)[C@@H]2C1	ZINC001084845868	1358327568	/nfs/dbraw/zinc/32/75/68/1358327568.db2.gz	KUBBYACOXASRRL-MISYRCLQSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)Cc3ccc(OC(C)C)cc3)[C@@H]2C1	ZINC001084847721	1358327716	/nfs/dbraw/zinc/32/77/16/1358327716.db2.gz	IMWPFDOSXWZTLL-UYAOXDASSA-N	0	3	342.483	3.125	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)c3c[nH]c4ccc(F)cc34)[C@@H]2C1	ZINC001084871042	1358336366	/nfs/dbraw/zinc/33/63/66/1358336366.db2.gz	PSFMEXGORDDEON-FZKQIMNGSA-N	0	3	327.403	3.029	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3c3sccc3C)C[C@@H]21	ZINC001084938713	1358352507	/nfs/dbraw/zinc/35/25/07/1358352507.db2.gz	BZACORSASMWREO-TVFCKZIOSA-N	0	3	342.508	3.106	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3c3c(F)cccc3F)C[C@@H]21	ZINC001085028385	1358371569	/nfs/dbraw/zinc/37/15/69/1358371569.db2.gz	IAVWJJXAMHESMG-ADAWSYLGSA-N	0	3	346.421	3.177	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CCN(C(=O)[C@H]4CC45CCC5)C[C@@H]32)cc1	ZINC001085044577	1358375694	/nfs/dbraw/zinc/37/56/94/1358375694.db2.gz	BQYVEXSEUKFVPN-AQNXPRMDSA-N	0	3	349.478	3.171	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@@H](C)c3ccc(C)s3)C[C@@H]21	ZINC001085074248	1358383857	/nfs/dbraw/zinc/38/38/57/1358383857.db2.gz	SPZXDCBCERMURP-BBWFWOEESA-N	0	3	330.497	3.106	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@H]3Cc4ccc(Cl)cc43)C[C@@H]21	ZINC001085085031	1358387379	/nfs/dbraw/zinc/38/73/79/1358387379.db2.gz	SSXSMQGCEOMNEZ-XWIAVFTESA-N	0	3	330.859	3.089	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@H](C)c3ccc(F)c(F)c3)C[C@@H]21	ZINC001085097762	1358389731	/nfs/dbraw/zinc/38/97/31/1358389731.db2.gz	WTGFCXRBYNEONM-LBTNJELSSA-N	0	3	334.410	3.177	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@H](CC)c3ccc(OC)cc3)C[C@@H]21	ZINC001085099311	1358390859	/nfs/dbraw/zinc/39/08/59/1358390859.db2.gz	MQMIVMLNWOCXJO-HOJAQTOUSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccc(OC)cc1F	ZINC001085262195	1358446353	/nfs/dbraw/zinc/44/63/53/1358446353.db2.gz	BEMQPXWJIXFFES-HZPDHXFCSA-N	0	3	340.826	3.217	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCC[C@H]2N[C@H](C)c2cnc(C)cn2)C1	ZINC001085325304	1358468280	/nfs/dbraw/zinc/46/82/80/1358468280.db2.gz	HGOXCMBFGHXNSV-BRWVUGGUSA-N	0	3	342.487	3.219	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cccc(OC)c1C	ZINC001085346244	1358474420	/nfs/dbraw/zinc/47/44/20/1358474420.db2.gz	MLQYSSMDWQQVHV-HZPDHXFCSA-N	0	3	336.863	3.387	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccccc1OCC	ZINC001085411388	1358492581	/nfs/dbraw/zinc/49/25/81/1358492581.db2.gz	SFRCYELDWBEMJX-HZPDHXFCSA-N	0	3	336.863	3.468	20	30		EGEDHN
CN(C[C@H]1CCN1CCC1CCCCCC1)C(=O)c1cc(C#N)c[nH]1	ZINC001085534454	1358571821	/nfs/dbraw/zinc/57/18/21/1358571821.db2.gz	KXIRIKXFOHPCEC-GOSISDBHSA-N	0	3	342.487	3.393	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1oc(CC2CC2)nc1C	ZINC001085597107	1358622099	/nfs/dbraw/zinc/62/20/99/1358622099.db2.gz	QEBHEKBGVKIFPL-MRXNPFEDSA-N	0	3	331.460	3.048	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccoc1C(F)(F)F	ZINC001085618710	1358639674	/nfs/dbraw/zinc/63/96/74/1358639674.db2.gz	UPADARRMYRSPES-GFCCVEGCSA-N	0	3	330.350	3.411	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)[C@@H]1CCCC[C@H]1C(F)(F)F	ZINC001085649526	1358659517	/nfs/dbraw/zinc/65/95/17/1358659517.db2.gz	RXUQPMBJQSUSBK-RRFJBIMHSA-N	0	3	332.410	3.464	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc(OC)c(OC)c1C	ZINC001085662429	1358666322	/nfs/dbraw/zinc/66/63/22/1358666322.db2.gz	ZIHIWJFSZXDTEG-MRXNPFEDSA-N	0	3	346.471	3.125	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc2c(cn1)CCCC2	ZINC001085710282	1358703836	/nfs/dbraw/zinc/70/38/36/1358703836.db2.gz	FAMKQIDQENGLNL-SFHVURJKSA-N	0	3	327.472	3.073	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1c[nH]nc1-c1ccccc1	ZINC001085748507	1358730404	/nfs/dbraw/zinc/73/04/04/1358730404.db2.gz	JTAFSXRVWNCJDQ-QGZVFWFLSA-N	0	3	338.455	3.189	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1nsc2ccc(C)cc21	ZINC001085761176	1358740256	/nfs/dbraw/zinc/74/02/56/1358740256.db2.gz	CELJENBFRGYGRG-AWEZNQCLSA-N	0	3	329.469	3.327	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)[C@@H]1C[C@H]1c1ccccc1CC	ZINC001085787484	1358761657	/nfs/dbraw/zinc/76/16/57/1358761657.db2.gz	PWQIZUXTAJTBDZ-YSIASYRMSA-N	0	3	326.484	3.461	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1oc(CC(C)C)nc1C	ZINC001085862640	1358829201	/nfs/dbraw/zinc/82/92/01/1358829201.db2.gz	FQMHXXNQGKUPJJ-INIZCTEOSA-N	0	3	333.476	3.294	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc(F)c2ncccc2c1	ZINC001085876054	1358839917	/nfs/dbraw/zinc/83/99/17/1358839917.db2.gz	PZOUQNMBGQHAMZ-KRWDZBQOSA-N	0	3	341.430	3.486	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccnc(C(F)(F)F)c1	ZINC001085907908	1358866885	/nfs/dbraw/zinc/86/68/85/1358866885.db2.gz	RCAOXEJEEZTGJV-CQSZACIVSA-N	0	3	341.377	3.213	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cnn([C@H](C)CC)c1C	ZINC001085916884	1358876129	/nfs/dbraw/zinc/87/61/29/1358876129.db2.gz	LHJOIUXEDAIDAV-WBVHZDCISA-N	0	3	332.492	3.275	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1cnn(C2CCCC2)c1C	ZINC001085917914	1358877478	/nfs/dbraw/zinc/87/74/78/1358877478.db2.gz	NVSCAJDEVZCFGC-QGZVFWFLSA-N	0	3	330.476	3.029	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cnn(CCCC)c1C	ZINC001085917619	1358877885	/nfs/dbraw/zinc/87/78/85/1358877885.db2.gz	FNHAJHWYXJOPEZ-KRWDZBQOSA-N	0	3	332.492	3.104	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C[C@H]2CCN2[C@@H](CC)c2ccccc2)nc1	ZINC001085934076	1358889626	/nfs/dbraw/zinc/88/96/26/1358889626.db2.gz	RCJAKRSSYUEIAJ-CTNGQTDRSA-N	0	3	347.462	3.361	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cccc(Cl)c2C)C1	ZINC001086094152	1358994249	/nfs/dbraw/zinc/99/42/49/1358994249.db2.gz	YVHGUMQWEVUDKO-BETUJISGSA-N	0	3	327.255	3.499	20	30		EGEDHN
C=Cc1ccc(C(=O)NC[C@H]2C[C@@H](NCC(=C)Br)C2)cc1	ZINC001086206931	1359026351	/nfs/dbraw/zinc/02/63/51/1359026351.db2.gz	QSMVAEMQIVLLFF-FZNQNYSPSA-N	0	3	349.272	3.336	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccnc(-c3ccco3)c2)C1	ZINC001086396326	1359085734	/nfs/dbraw/zinc/08/57/34/1359085734.db2.gz	BTPJZZIDBGKYBR-CTYIDZIISA-N	0	3	345.830	3.192	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@@H]2CC[C@H](C(F)(F)F)C2)C1	ZINC001086459736	1359104215	/nfs/dbraw/zinc/10/42/15/1359104215.db2.gz	WGKKABZBUKYCCI-FVCCEPFGSA-N	0	3	338.801	3.202	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)[C@@H]2CCC[C@@H](C)C2)C1	ZINC001086462409	1359105887	/nfs/dbraw/zinc/10/58/87/1359105887.db2.gz	MSTFKFBRQCYLDE-NMFUWQPSSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(C(C)C)nc2C)C1	ZINC001086477966	1359113753	/nfs/dbraw/zinc/11/37/53/1359113753.db2.gz	DOJIDNHHHYNZCI-SHTZXODSSA-N	0	3	335.879	3.364	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H](c3ccccc3)[C@H](NC(=O)C3CC3)C2)cc1	ZINC001086570396	1359151163	/nfs/dbraw/zinc/15/11/63/1359151163.db2.gz	XAKNMJXAFYSHKM-LEWJYISDSA-N	0	3	345.446	3.052	20	30		EGEDHN
C=C(C)CCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2ccns2)C1	ZINC001086591411	1359157856	/nfs/dbraw/zinc/15/78/56/1359157856.db2.gz	KLNZYCAGWPOHRP-DLBZAZTESA-N	0	3	341.480	3.307	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccc(C(F)F)nc2)C1	ZINC001086714066	1359190439	/nfs/dbraw/zinc/19/04/39/1359190439.db2.gz	JZJPAOKEHPVHCJ-WCQYABFASA-N	0	3	343.805	3.260	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cccc(OC)c2C)C1	ZINC001086815047	1359207012	/nfs/dbraw/zinc/20/70/12/1359207012.db2.gz	ATXHICXNSFFQKC-LSDHHAIUSA-N	0	3	336.863	3.244	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cc3[nH]ccc3s2)C1	ZINC001086863836	1359216560	/nfs/dbraw/zinc/21/65/60/1359216560.db2.gz	PYXWQTGOWVPCSL-NWDGAFQWSA-N	0	3	337.876	3.470	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)[C@H]3[C@@H]4CCCC[C@@H]43)C2)CC1	ZINC001086913754	1359241499	/nfs/dbraw/zinc/24/14/99/1359241499.db2.gz	WREAVSGLYBDFAN-YRXWBPOGSA-N	0	3	328.500	3.149	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@H]3CCCC4(CC4)C3)C2)CC1	ZINC001086923451	1359249167	/nfs/dbraw/zinc/24/91/67/1359249167.db2.gz	RSPLVRPVNIJLAB-MSOLQXFVSA-N	0	3	328.500	3.293	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)Cc3cccc(C)c3)C2)CC1	ZINC001086939826	1359262130	/nfs/dbraw/zinc/26/21/30/1359262130.db2.gz	AFTPJAPTYSPZFE-LJQANCHMSA-N	0	3	338.495	3.264	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H]3C[C@H]3CC(C)C)C2)CC1	ZINC001086943672	1359264557	/nfs/dbraw/zinc/26/45/57/1359264557.db2.gz	ASLCLJWYSRWLQZ-GUDVDZBRSA-N	0	3	330.516	3.395	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@H]3C[C@@H]3c3ccccc3)C2)CC1	ZINC001086947208	1359268558	/nfs/dbraw/zinc/26/85/58/1359268558.db2.gz	RWMYOVSJCVQZLO-RLLQIKCJSA-N	0	3	336.479	3.126	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H](C)c3ccc(C)cc3)C2)CC1	ZINC001086952706	1359272809	/nfs/dbraw/zinc/27/28/09/1359272809.db2.gz	OBZZRJVOWDNPGW-OALUTQOASA-N	0	3	338.495	3.435	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3sccc3OC)C2)CC1	ZINC001086953186	1359273327	/nfs/dbraw/zinc/27/33/27/1359273327.db2.gz	AGJPVYPHXMBETJ-HNNXBMFYSA-N	0	3	346.496	3.097	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)C[C@H](C)n3cccc3)C2)CC1	ZINC001086953473	1359273493	/nfs/dbraw/zinc/27/34/93/1359273493.db2.gz	JLBULUQOGDWWFY-OALUTQOASA-N	0	3	341.499	3.166	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)CCc3ccc(C)s3)C2)CC1	ZINC001086960432	1359280333	/nfs/dbraw/zinc/28/03/33/1359280333.db2.gz	UDNKLLNNDVSORS-INIZCTEOSA-N	0	3	344.524	3.325	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](CNCc2nc(C)sc2C)[C@@H](C)C1	ZINC001184077196	1387389018	/nfs/dbraw/zinc/38/90/18/1387389018.db2.gz	HQMZROWJSBPTSB-BBRMVZONSA-N	0	3	335.517	3.300	20	30		EGEDHN
CCC(=O)N[C@@H]1[C@H]2CCCN(Cc3cccc(C#N)c3)[C@H]2C1(C)C	ZINC001087262415	1359331670	/nfs/dbraw/zinc/33/16/70/1359331670.db2.gz	BVYQVSGNLSLQCQ-BHIYHBOVSA-N	0	3	325.456	3.073	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc(Cl)o1	ZINC001087272309	1359345744	/nfs/dbraw/zinc/34/57/44/1359345744.db2.gz	FVUGBANEAMKIBH-UHOFOFEASA-N	0	3	334.847	3.175	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3sc(C)cc3C)C(C)(C)[C@@H]21	ZINC001087289991	1359368314	/nfs/dbraw/zinc/36/83/14/1359368314.db2.gz	VQZUPPMVXODTRA-DJIMGWMZSA-N	0	3	330.497	3.217	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(F)ccc3F)C(C)(C)[C@H]21	ZINC001087289761	1359369047	/nfs/dbraw/zinc/36/90/47/1359369047.db2.gz	RQBLFEJFRIDIJL-OLMNPRSZSA-N	0	3	346.421	3.207	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc[nH]c3C3CC3)C(C)(C)[C@H]21	ZINC001087300541	1359383051	/nfs/dbraw/zinc/38/30/51/1359383051.db2.gz	MMKILZRXQGNIAO-QRQLOZEOSA-N	0	3	339.483	3.134	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc[nH]c3C3CC3)C(C)(C)[C@@H]21	ZINC001087300538	1359383086	/nfs/dbraw/zinc/38/30/86/1359383086.db2.gz	MMKILZRXQGNIAO-BHIYHBOVSA-N	0	3	339.483	3.134	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)C3CC4(CCC4)C3)C(C)(C)[C@H]21	ZINC001087301115	1359384270	/nfs/dbraw/zinc/38/42/70/1359384270.db2.gz	WJBHEVZCGCHHHR-KURKYZTESA-N	0	3	328.500	3.195	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1nccc2ccccc21	ZINC001087302313	1359385451	/nfs/dbraw/zinc/38/54/51/1359385451.db2.gz	QQMJPIXTLCSCRQ-YZGWKJHDSA-N	0	3	347.462	3.087	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)Cc1ccc(CC)cc1	ZINC001087307285	1359393847	/nfs/dbraw/zinc/39/38/47/1359393847.db2.gz	XEPDJNXDBRDZJI-HLAWJBBLSA-N	0	3	338.495	3.030	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1oc(CC)cc1C	ZINC001087312230	1359399584	/nfs/dbraw/zinc/39/95/84/1359399584.db2.gz	AZHPGSPREUUTDE-BPQIPLTHSA-N	0	3	328.456	3.002	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc2c(C)cccn2c1	ZINC001087312417	1359400448	/nfs/dbraw/zinc/40/04/48/1359400448.db2.gz	DZJBSAFAIJZGPY-YZGWKJHDSA-N	0	3	349.478	3.100	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc(C4CC4)s3)C(C)(C)[C@H]21	ZINC001087313203	1359401579	/nfs/dbraw/zinc/40/15/79/1359401579.db2.gz	QRDZZCJJZLMCKO-JLSDUUJJSA-N	0	3	342.508	3.478	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc4ccccc4n3)C(C)(C)[C@@H]21	ZINC001087315189	1359405192	/nfs/dbraw/zinc/40/51/92/1359405192.db2.gz	XORRESLZFXQNCL-NSISKUIASA-N	0	3	347.462	3.087	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cccc2cnccc21	ZINC001087317688	1359408705	/nfs/dbraw/zinc/40/87/05/1359408705.db2.gz	LJEGOGWKGDBQQF-HSALFYBXSA-N	0	3	347.462	3.087	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)Cc3ccccc3C)C(C)(C)[C@@H]21	ZINC001087317940	1359410084	/nfs/dbraw/zinc/41/00/84/1359410084.db2.gz	OYGKZNGIZGSVFM-HMXCVIKNSA-N	0	3	338.495	3.166	20	30		EGEDHN
C=CCCN1CC[C@@H](c2ccc(OC)c(F)c2)[C@@H](NC(=O)C2CC2)C1	ZINC001087477400	1359483678	/nfs/dbraw/zinc/48/36/78/1359483678.db2.gz	MRMQGADTEUNWEB-WMZOPIPTSA-N	0	3	346.446	3.095	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)C[C@@H]2C[C@H]2c2ccc(OC)cc2)[C@H]1CC	ZINC001087608895	1359552472	/nfs/dbraw/zinc/55/24/72/1359552472.db2.gz	JZSLNMIVBDXSLQ-FRYIKTPZSA-N	0	3	342.483	3.344	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C[C@@H]2C[C@H]2Cc2ccccc2)[C@H]1CC	ZINC001087668260	1359580782	/nfs/dbraw/zinc/58/07/82/1359580782.db2.gz	LMRSTOKMSRKFOO-IVAOSVALSA-N	0	3	338.495	3.248	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccc(C3CC3)nc2C)[C@H]1CC	ZINC001087730860	1359614291	/nfs/dbraw/zinc/61/42/91/1359614291.db2.gz	IDZUMBCKYANRFO-RBUKOAKNSA-N	0	3	327.472	3.426	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnc3ccc(F)cc3c2)[C@H]1CC	ZINC001087784803	1359643405	/nfs/dbraw/zinc/64/34/05/1359643405.db2.gz	ZGCYUABTHZFUKS-ZWKOTPCHSA-N	0	3	327.403	3.143	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cccc3ccccc32)[C@H]1CC	ZINC001087805056	1359654270	/nfs/dbraw/zinc/65/42/70/1359654270.db2.gz	MIWCQXIAPYLPJN-LEWJYISDSA-N	0	3	334.463	3.375	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc(OCC(C)C)cc2)[C@H]1CC	ZINC001087819396	1359664091	/nfs/dbraw/zinc/66/40/91/1359664091.db2.gz	VVYOPHHZGQLOPP-RBUKOAKNSA-N	0	3	330.472	3.490	20	30		EGEDHN
CCC(CC)C(=O)N1C[C@H]2CCN(Cc3ccc(C#N)cc3)C[C@H]2C1	ZINC001087890571	1359699902	/nfs/dbraw/zinc/69/99/02/1359699902.db2.gz	NPSSDHFSUCWFRX-UXHICEINSA-N	0	3	339.483	3.275	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3cc4cccc(C)c4s3)C[C@@H]2C1	ZINC001088018480	1359725890	/nfs/dbraw/zinc/72/58/90/1359725890.db2.gz	ZQIPIHZFZRIHLQ-SJORKVTESA-N	0	3	338.476	3.237	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CN(C(=O)[C@]45C[C@H]4CCC5)C[C@@H]3C2)c1	ZINC001088047341	1359734767	/nfs/dbraw/zinc/73/47/67/1359734767.db2.gz	SWIBUSXCTOBYAA-XAPVIXHLSA-N	0	3	349.478	3.029	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)[C@H](CC)CC3CCCCC3)C[C@@H]2C1	ZINC001088127232	1359765837	/nfs/dbraw/zinc/76/58/37/1359765837.db2.gz	STGLIWNFENUNSU-AQNXPRMDSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)C3CCC(C4CC4)CC3)C[C@@H]2C1	ZINC001088186976	1359786429	/nfs/dbraw/zinc/78/64/29/1359786429.db2.gz	ZLISCJFFDGIZIX-TUNPWDSISA-N	0	3	328.500	3.006	20	30		EGEDHN
C=CCN1CC[C@@H](OCC2CCN(C(=O)CC3CCCC3)CC2)C1	ZINC001088228705	1359807688	/nfs/dbraw/zinc/80/76/88/1359807688.db2.gz	YCHBWARMCOBRPI-LJQANCHMSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCN1CC[C@H](OCC2CCN(C(=O)[C@@H](C)C3CCCC3)CC2)C1	ZINC001088240426	1359812216	/nfs/dbraw/zinc/81/22/16/1359812216.db2.gz	YQUZXXWSHYVYMU-PXNSSMCTSA-N	0	3	348.531	3.328	20	30		EGEDHN
C=CCN1CC[C@H](OCC2CCN(C(=O)C3CCC=CCC3)CC2)C1	ZINC001088241217	1359812734	/nfs/dbraw/zinc/81/27/34/1359812734.db2.gz	SUBMUUFVFINESH-FQEVSTJZSA-N	0	3	346.515	3.248	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2ocnc2C(F)F)C1	ZINC001088382755	1359864815	/nfs/dbraw/zinc/86/48/15/1359864815.db2.gz	LJYZVOATRZUQKJ-LLVKDONJSA-N	0	3	347.793	3.339	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)CCC2CCOCC2)C1	ZINC001088393831	1359870191	/nfs/dbraw/zinc/87/01/91/1359870191.db2.gz	OFVRAPJTEQJAHH-KRWDZBQOSA-N	0	3	342.911	3.307	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)[C@H]2COc3ccccc32)C1	ZINC001088433783	1359902131	/nfs/dbraw/zinc/90/21/31/1359902131.db2.gz	FTEVTWILDPFVQP-RDJZCZTQSA-N	0	3	348.874	3.276	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CCN(Cc2ccc(C)cc2)[C@@H]1C	ZINC001088623607	1359995410	/nfs/dbraw/zinc/99/54/10/1359995410.db2.gz	JYULGVHOMMDYQT-MJGOQNOKSA-N	0	3	337.467	3.375	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@H]2CCN(CC=C(C)C)[C@@H]2C)cc1	ZINC001088672258	1360009926	/nfs/dbraw/zinc/00/99/26/1360009926.db2.gz	SGBAQJFEIWCPOB-APWZRJJASA-N	0	3	328.456	3.410	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2[nH]c3ccccc3c2Cl)[C@H]1C	ZINC001088701880	1360016181	/nfs/dbraw/zinc/01/61/81/1360016181.db2.gz	OYTGWWHYBFIUNJ-OCCSQVGLSA-N	0	3	329.831	3.037	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N[C@H]1CCN(Cc2cccc(C)c2)[C@@H]1C	ZINC001088913776	1360102470	/nfs/dbraw/zinc/10/24/70/1360102470.db2.gz	OUPBMZRNOJMRLG-GTAWCEEGSA-N	0	3	342.483	3.055	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)[C@@H]2CCCc3sc(C)nc32)[C@H]1C	ZINC001088975711	1360121268	/nfs/dbraw/zinc/12/12/68/1360121268.db2.gz	LOBXCXYVPOJFNM-YUELXQCFSA-N	0	3	333.501	3.027	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3ccc(CC)cc3)[C@@H]2C)nc1	ZINC001088990612	1360126791	/nfs/dbraw/zinc/12/67/91/1360126791.db2.gz	GLWKWVRJNUUUKM-UZLBHIALSA-N	0	3	347.462	3.018	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCCC[C@H]2CN(C)Cc2ccccc2)cn1	ZINC001089253587	1360284540	/nfs/dbraw/zinc/28/45/40/1360284540.db2.gz	MAVNSLVYLIWOLI-NRFANRHFSA-N	0	3	347.462	3.190	20	30		EGEDHN
CC(C)C(=O)N[C@@H]1CCN(Cc2ccc(C#N)s2)CC(C)(C)C1	ZINC001089320119	1360338783	/nfs/dbraw/zinc/33/87/83/1360338783.db2.gz	HBENJSQLFUMLGL-CQSZACIVSA-N	0	3	333.501	3.383	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2c(C)noc2CCC)CC(C)(C)C1	ZINC001089381793	1360384176	/nfs/dbraw/zinc/38/41/76/1360384176.db2.gz	NYPQRYHSVUFFJN-MRXNPFEDSA-N	0	3	345.487	3.179	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2c(F)cccc2OC)CC(C)(C)C1	ZINC001089391850	1360392327	/nfs/dbraw/zinc/39/23/27/1360392327.db2.gz	QGARJYBSWKNHIN-OAHLLOKOSA-N	0	3	346.446	3.078	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2ccc(C)cc2Cl)CC(C)(C)C1	ZINC001089424865	1360417914	/nfs/dbraw/zinc/41/79/14/1360417914.db2.gz	ZRKZKHQNMUVARZ-KRWDZBQOSA-N	0	3	346.902	3.431	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2cccc(C)c2Cl)CC(C)(C)C1	ZINC001089438525	1360428828	/nfs/dbraw/zinc/42/88/28/1360428828.db2.gz	JHMHHLQOZUUWBC-QGZVFWFLSA-N	0	3	346.902	3.431	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@@H]2CCc3cc(F)ccc32)CC(C)(C)C1	ZINC001089440483	1360431060	/nfs/dbraw/zinc/43/10/60/1360431060.db2.gz	OJVGHDACZZQGDT-IEBWSBKVSA-N	0	3	342.458	3.096	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc3cc(C)ccc3[nH]2)CC(C)(C)C1	ZINC001089456736	1360443499	/nfs/dbraw/zinc/44/34/99/1360443499.db2.gz	LZEMRCMBCMKXBH-KRWDZBQOSA-N	0	3	337.467	3.330	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C[C@H]2CCCC2(F)F)CC(C)(C)C1	ZINC001089478229	1360460853	/nfs/dbraw/zinc/46/08/53/1360460853.db2.gz	SDRWJAQUMISAEI-CABCVRRESA-N	0	3	326.431	3.052	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(C)c(F)c2F)CC(C)(C)C1	ZINC001089495489	1360472021	/nfs/dbraw/zinc/47/20/21/1360472021.db2.gz	WZLXWEQNQSPLLO-CQSZACIVSA-N	0	3	334.410	3.127	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@@H]2CCc3ccccc3C2)CC(C)(C)C1	ZINC001089501799	1360475469	/nfs/dbraw/zinc/47/54/69/1360475469.db2.gz	HDSGPFWLHSDJFK-WOJBJXKFSA-N	0	3	338.495	3.032	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc3cc(F)ccc3o2)CC(C)(C)C1	ZINC001089503222	1360476691	/nfs/dbraw/zinc/47/66/91/1360476691.db2.gz	TWIXZXRRMOSRKT-MRXNPFEDSA-N	0	3	342.414	3.426	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(OCC)c(C)c2)CC(C)(C)C1	ZINC001089510556	1360482110	/nfs/dbraw/zinc/48/21/10/1360482110.db2.gz	XHLOOTSMKUFKPL-GOSISDBHSA-N	0	3	342.483	3.247	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2csc(C(C)(C)C)n2)CC(C)(C)C1	ZINC001089516351	1360486586	/nfs/dbraw/zinc/48/65/86/1360486586.db2.gz	FJNPWKKHQMRUET-AWEZNQCLSA-N	0	3	347.528	3.294	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2nc(C3CC3)oc2C)CC(C)(C)C1	ZINC001089531783	1360493399	/nfs/dbraw/zinc/49/33/99/1360493399.db2.gz	QBMWRRAHGOCHDF-INIZCTEOSA-N	0	3	343.471	3.104	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C2(c3ccccc3F)CC2)CC(C)(C)C1	ZINC001089533728	1360494022	/nfs/dbraw/zinc/49/40/22/1360494022.db2.gz	IAAHEYMFTYTMJB-INIZCTEOSA-N	0	3	342.458	3.097	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C(C)(C)c2ccc(F)cc2)CC(C)(C)C1	ZINC001089539028	1360496687	/nfs/dbraw/zinc/49/66/87/1360496687.db2.gz	IHVNJOGYWPPXRO-SFHVURJKSA-N	0	3	344.474	3.343	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@]2(C)CCc3ccccc32)CC(C)(C)C1	ZINC001089565255	1360511943	/nfs/dbraw/zinc/51/19/43/1360511943.db2.gz	QHKJGTJFVLQTND-XMSQKQJNSA-N	0	3	338.495	3.131	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1nc(C(C)C)oc1C	ZINC001089640104	1360553094	/nfs/dbraw/zinc/55/30/94/1360553094.db2.gz	AVTNCTKZWIDXCJ-MRXNPFEDSA-N	0	3	345.487	3.350	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1c(C)noc1CCC	ZINC001089639752	1360553244	/nfs/dbraw/zinc/55/32/44/1360553244.db2.gz	YYALOMMFYKDFPY-MRXNPFEDSA-N	0	3	345.487	3.179	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccnn1C1CCC1	ZINC001089641079	1360553729	/nfs/dbraw/zinc/55/37/29/1360553729.db2.gz	KIHPLEGXFKHEMV-QGZVFWFLSA-N	0	3	344.503	3.405	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H]1CCCc2c[nH]nc21	ZINC001089641627	1360554433	/nfs/dbraw/zinc/55/44/33/1360554433.db2.gz	PIXWROWMMNOUET-DLBZAZTESA-N	0	3	344.503	3.013	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(C(F)F)nc1	ZINC001089649108	1360561753	/nfs/dbraw/zinc/56/17/53/1360561753.db2.gz	AXGHPWVUTYKVQZ-HNNXBMFYSA-N	0	3	349.425	3.263	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](CNCc2cnc(C)o2)[C@@H](C)C1	ZINC001184447622	1387462861	/nfs/dbraw/zinc/46/28/61/1387462861.db2.gz	JVLSKONVGJNQGZ-MAUKXSAKSA-N	0	3	345.487	3.326	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc2c(o1)CCCC2	ZINC001089651384	1360564317	/nfs/dbraw/zinc/56/43/17/1360564317.db2.gz	BLTYSXZPXVLVEU-QGZVFWFLSA-N	0	3	342.483	3.402	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(OC)c(F)c1	ZINC001089653795	1360566538	/nfs/dbraw/zinc/56/65/38/1360566538.db2.gz	UEMAMRIQFAVTSK-MRXNPFEDSA-N	0	3	346.446	3.078	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cnc2cc[nH]c2c1	ZINC001089656854	1360568298	/nfs/dbraw/zinc/56/82/98/1360568298.db2.gz	NFYMDQOECAGVDA-INIZCTEOSA-N	0	3	340.471	3.359	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(C(C)C)no1	ZINC001089705771	1360607907	/nfs/dbraw/zinc/60/79/07/1360607907.db2.gz	AAKAYJKCBWNRCP-HNNXBMFYSA-N	0	3	331.460	3.042	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H]1CCCO[C@H]1C(=C)C	ZINC001089708035	1360612165	/nfs/dbraw/zinc/61/21/65/1360612165.db2.gz	AGNFIBMEBHPPSD-SQNIBIBYSA-N	0	3	334.504	3.151	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc2nccn2c1	ZINC001089721773	1360624214	/nfs/dbraw/zinc/62/42/14/1360624214.db2.gz	KVIBBONDRMKTCA-QGZVFWFLSA-N	0	3	340.471	3.131	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(C)cc1OC	ZINC001089727056	1360629879	/nfs/dbraw/zinc/62/98/79/1360629879.db2.gz	XNMFCMDSWSRIEL-QGZVFWFLSA-N	0	3	342.483	3.247	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)c2cc(C)co2)C1	ZINC001089850938	1360697538	/nfs/dbraw/zinc/69/75/38/1360697538.db2.gz	RKWBGEUTRKDNAD-VGWMRTNUSA-N	0	3	334.847	3.123	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)C2(C(C)C)CC2)C1	ZINC001089861830	1360706743	/nfs/dbraw/zinc/70/67/43/1360706743.db2.gz	KJQUIZWQHMEANW-QAETUUGQSA-N	0	3	336.907	3.344	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1(CF)CCC1	ZINC001089867444	1360709505	/nfs/dbraw/zinc/70/95/05/1360709505.db2.gz	JFOSIRSMPTYRFH-JONQDZQNSA-N	0	3	340.870	3.048	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccccc2C(C)(C)CC)[C@H](O)C1	ZINC001090348498	1360894813	/nfs/dbraw/zinc/89/48/13/1360894813.db2.gz	YGARPARHDZCUOS-RBUKOAKNSA-N	0	3	344.499	3.115	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)C2CCCCCC2)C1	ZINC001090949783	1360958840	/nfs/dbraw/zinc/95/88/40/1360958840.db2.gz	XBUBJMWPOFBHLE-UHFFFAOYSA-N	0	3	343.309	3.350	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2nsc3ccccc32)C1	ZINC001091044548	1360985950	/nfs/dbraw/zinc/98/59/50/1360985950.db2.gz	DGXNNNLJBXZWCW-UHFFFAOYSA-N	0	3	335.860	3.147	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cccc(F)c2OCC)C1	ZINC001091301843	1361036507	/nfs/dbraw/zinc/03/65/07/1361036507.db2.gz	TWUMFVFVBDWPBS-UHFFFAOYSA-N	0	3	340.826	3.075	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc3c(C)cccn3c2)C1	ZINC001091322743	1361043780	/nfs/dbraw/zinc/04/37/80/1361043780.db2.gz	KTTBCPYWNHCOIA-UHFFFAOYSA-N	0	3	331.847	3.098	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3cc(Cl)ccc3Cl)C[C@]2(C)C1	ZINC001092225039	1361331496	/nfs/dbraw/zinc/33/14/96/1361331496.db2.gz	RHFNVKDYQMDFBI-PXAZEXFGSA-N	0	3	337.250	3.021	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3c[nH]c4c3cccc4CC)C[C@]2(C)C1	ZINC001092302950	1361359151	/nfs/dbraw/zinc/35/91/51/1361359151.db2.gz	JCICZRZDEZEDEW-VGSWGCGISA-N	0	3	349.478	3.148	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CN(Cc3cncs3)C[C@H]2C)CC1	ZINC001092940572	1361491235	/nfs/dbraw/zinc/49/12/35/1361491235.db2.gz	SSSOGTNQYSVVNG-GDBMZVCRSA-N	0	3	333.501	3.074	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)c2ccsc2)CC1	ZINC001093352375	1361565873	/nfs/dbraw/zinc/56/58/73/1361565873.db2.gz	YZGOOZHULOHCDD-QGZVFWFLSA-N	0	3	328.481	3.088	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)Cc2cccs2)CC1	ZINC001093352221	1361565976	/nfs/dbraw/zinc/56/59/76/1361565976.db2.gz	VMXCSGOTRHGERK-IBGZPJMESA-N	0	3	342.508	3.017	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)c2cc(C)c(C)o2)CC1	ZINC001093368279	1361578161	/nfs/dbraw/zinc/57/81/61/1361578161.db2.gz	VMTYGZKQUSAPQZ-IBGZPJMESA-N	0	3	340.467	3.236	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C2CC(C)(C)C2)CC1	ZINC001093369711	1361578674	/nfs/dbraw/zinc/57/86/74/1361578674.db2.gz	JZOYTZCGXYUPBZ-GOSISDBHSA-N	0	3	328.500	3.149	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C(C)(C)C(F)F)CC1	ZINC001093378484	1361588886	/nfs/dbraw/zinc/58/88/86/1361588886.db2.gz	PAJZEEMPUFSOOC-HNNXBMFYSA-N	0	3	338.442	3.004	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C2(C)CC(=C)C2)CC1	ZINC001093378686	1361589222	/nfs/dbraw/zinc/58/92/22/1361589222.db2.gz	REYSWXRYCOCLDY-GOSISDBHSA-N	0	3	326.484	3.069	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3oc(C(F)F)cc3C)CCC[C@@H]12	ZINC001094439266	1361802485	/nfs/dbraw/zinc/80/24/85/1361802485.db2.gz	ABMYMIYRAIEIRS-RDTXWAMCSA-N	0	3	336.382	3.133	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3ccc(C)c(Cl)c3)CCC[C@@H]12	ZINC001094503707	1361833731	/nfs/dbraw/zinc/83/37/31/1361833731.db2.gz	PALQOKQFPYNEPL-IEBWSBKVSA-N	0	3	330.859	3.256	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3ccc4[nH]c(C)c(C)c4c3)CCC[C@@H]12	ZINC001094576196	1361867131	/nfs/dbraw/zinc/86/71/31/1361867131.db2.gz	XLSBULKVPGUPEC-IFMALSPDSA-N	0	3	349.478	3.392	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CC1CC(F)(F)C1	ZINC001095538042	1362164384	/nfs/dbraw/zinc/16/43/84/1362164384.db2.gz	VWFWUECBRCMCNW-PMPSAXMXSA-N	0	3	349.425	3.055	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1nccc3ccsc31)C2	ZINC001095564695	1362170569	/nfs/dbraw/zinc/17/05/69/1362170569.db2.gz	CHLNOTRGTMJZCZ-ILXRZTDVSA-N	0	3	327.453	3.208	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1ccc3cccnc3c1)C2	ZINC001095603369	1362182052	/nfs/dbraw/zinc/18/20/52/1362182052.db2.gz	CETXKRGAIKRDOO-HOJAQTOUSA-N	0	3	335.451	3.075	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cn1c(C)cc3ccccc31)C2	ZINC001095715989	1362210182	/nfs/dbraw/zinc/21/01/82/1362210182.db2.gz	OXPZCOAIASNAQN-HBFSDRIKSA-N	0	3	337.467	3.247	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1ccc(C3CCC3)cc1)C2	ZINC001095827101	1362247287	/nfs/dbraw/zinc/24/72/87/1362247287.db2.gz	VTLULXWYZFDNKD-HKBOAZHASA-N	0	3	336.479	3.241	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc(-c3cccs3)on1)C2	ZINC001095832993	1362249683	/nfs/dbraw/zinc/24/96/83/1362249683.db2.gz	PNKPPRYNEVAZSJ-IPYPFGDCSA-N	0	3	343.452	3.314	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc(C(CC)CC)no1)C2	ZINC001096125535	1362396436	/nfs/dbraw/zinc/39/64/36/1362396436.db2.gz	RZUAWRWDIQEXQN-PVAVHDDUSA-N	0	3	331.460	3.489	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1oc(C3CC3)nc1C)C2	ZINC001096131506	1362399378	/nfs/dbraw/zinc/39/93/78/1362399378.db2.gz	TVSGWQYMGWKMRW-PMPSAXMXSA-N	0	3	329.444	3.162	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C(C)(C)c1ccccc1Cl)C2	ZINC001096385132	1362481208	/nfs/dbraw/zinc/48/12/08/1362481208.db2.gz	ZTNPQUFFZWKZOR-JLSDUUJJSA-N	0	3	344.886	3.362	20	30		EGEDHN
CC1(NC(=O)CC2CCC2)CCN(Cc2cccc(C#N)c2)CC1	ZINC001324310001	1387589459	/nfs/dbraw/zinc/58/94/59/1387589459.db2.gz	ZOBBPQSRJVHQCD-UHFFFAOYSA-N	0	3	325.456	3.219	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](NCc2ccccc2OC(C)C)C1	ZINC001185020313	1387590178	/nfs/dbraw/zinc/59/01/78/1387590178.db2.gz	VBONKMQXTTVPRQ-LJQANCHMSA-N	0	3	342.483	3.358	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cn(C)c3ccc(F)cc13)C2	ZINC001097235495	1362895843	/nfs/dbraw/zinc/89/58/43/1362895843.db2.gz	RSSAEMBAHWWZMK-BJZITVGISA-N	0	3	341.430	3.229	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc3c(cc(C)cc3C)[nH]1)C2	ZINC001097593624	1363063412	/nfs/dbraw/zinc/06/34/12/1363063412.db2.gz	MRYXATJIWQIJGM-ZTNFWEORSA-N	0	3	335.451	3.143	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cccc(N3CCCC3)c1)C2	ZINC001098096717	1363221875	/nfs/dbraw/zinc/22/18/75/1363221875.db2.gz	CDLVHJHZXXUCEU-AQNXPRMDSA-N	0	3	339.483	3.198	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](CNCc3nccs3)[C@H](C)C2)CC1	ZINC001185094459	1387617444	/nfs/dbraw/zinc/61/74/44/1387617444.db2.gz	IRRQUDXXOAZPAQ-CVEARBPZSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@H]1OCCc3ccsc31)C2	ZINC001098246738	1363269206	/nfs/dbraw/zinc/26/92/06/1363269206.db2.gz	QRAULQXDYJFYAQ-WCXIOVBPSA-N	0	3	346.496	3.050	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1(C3CCC3)CCC1)C[C@H](C)O2	ZINC001098620216	1363401807	/nfs/dbraw/zinc/40/18/07/1363401807.db2.gz	UTDHNXHQZDNOAX-KRWDZBQOSA-N	0	3	346.515	3.225	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1CCC=CCC1)C[C@H](C)O2	ZINC001098659995	1363423245	/nfs/dbraw/zinc/42/32/45/1363423245.db2.gz	PGVDVSYINCBJGQ-KRWDZBQOSA-N	0	3	332.488	3.001	20	30		EGEDHN
Cc1cccc(CN2CC(C)(C)CC[C@@H]2CNC(=O)[C@H](C)C#N)c1	ZINC001098976557	1363551495	/nfs/dbraw/zinc/55/14/95/1363551495.db2.gz	VLZPIQGULNPDDE-SJLPKXTDSA-N	0	3	327.472	3.262	20	30		EGEDHN
C[C@H](C#N)C(=O)NC[C@@H]1CCC(C)(C)CN1CCCCC(F)(F)F	ZINC001098982355	1363555222	/nfs/dbraw/zinc/55/52/22/1363555222.db2.gz	KFSQNRPNJYVRCV-KGLIPLIRSA-N	0	3	347.425	3.485	20	30		EGEDHN
C#CCCCCC(=O)NC[C@H]1CCC(C)(C)CN1CCOCC1CC1	ZINC001099029087	1363584242	/nfs/dbraw/zinc/58/42/42/1363584242.db2.gz	RISYRWIRXVVLFO-LJQANCHMSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccoc1CC	ZINC001099039176	1363587735	/nfs/dbraw/zinc/58/77/35/1363587735.db2.gz	UIHRYSFKEQESTR-MRXNPFEDSA-N	0	3	348.487	3.265	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1coc(C)c1	ZINC001099039452	1363589177	/nfs/dbraw/zinc/58/91/77/1363589177.db2.gz	XAGYXWGIBJBKEW-QGZVFWFLSA-N	0	3	334.460	3.011	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3CCC[C@]3(NC(=O)[C@@H]3C[C@H]3C3CC3)C2)cc1	ZINC001099073404	1363608211	/nfs/dbraw/zinc/60/82/11/1363608211.db2.gz	ZRARWBDZDUAORQ-KEZQHZCBSA-N	0	3	349.478	3.075	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)C1(CCOCC)CCC1	ZINC001099074739	1363609440	/nfs/dbraw/zinc/60/94/40/1363609440.db2.gz	QHQRBWJSJHTKNU-KRWDZBQOSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)C[C@H](C)n1ccnc1CC	ZINC001099080120	1363611921	/nfs/dbraw/zinc/61/19/21/1363611921.db2.gz	MOVKKUUWNAPQHU-DLBZAZTESA-N	0	3	346.519	3.189	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2[nH]ccc2-c2ccccc2)C1	ZINC001099116024	1363631774	/nfs/dbraw/zinc/63/17/74/1363631774.db2.gz	HQOBAEZPQIDEOD-UWJYYQICSA-N	0	3	335.451	3.452	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H](CC(C)C)n1ccnc1	ZINC001099117085	1363632975	/nfs/dbraw/zinc/63/29/75/1363632975.db2.gz	ZKNFVTPVZKUSBR-QZTJIDSGSA-N	0	3	346.519	3.263	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc3ccccc3n2)C1	ZINC001099132529	1363644238	/nfs/dbraw/zinc/64/42/38/1363644238.db2.gz	QGWBVYVRPRXQFX-UWJYYQICSA-N	0	3	335.451	3.395	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)C(C)(C)C1CCOCC1	ZINC001099140178	1363649553	/nfs/dbraw/zinc/64/95/53/1363649553.db2.gz	RISAAFVDNHFLFQ-SFHVURJKSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H](C)CC(F)F	ZINC001099145253	1363653776	/nfs/dbraw/zinc/65/37/76/1363653776.db2.gz	VUYACPMFBMAWGP-GJZGRUSLSA-N	0	3	346.462	3.087	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NC[C@@H]1CCC(C)(C)CN1CC(=C)C	ZINC001099157986	1363662118	/nfs/dbraw/zinc/66/21/18/1363662118.db2.gz	CAECSGODBZFRMU-FXAWDEMLSA-N	0	3	336.520	3.398	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@H](OCC)C1CCCC1	ZINC001099159353	1363662933	/nfs/dbraw/zinc/66/29/33/1363662933.db2.gz	QYMAEPDBBPUFQW-RBUKOAKNSA-N	0	3	348.531	3.212	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H](C)c2ccc(F)cc2F)C1	ZINC001099170545	1363668385	/nfs/dbraw/zinc/66/83/85/1363668385.db2.gz	GXJJUIKEKUTKTE-SIFCLUCFSA-N	0	3	346.421	3.062	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2csc(CC(C)C)n2)C1	ZINC001099182675	1363678391	/nfs/dbraw/zinc/67/83/91/1363678391.db2.gz	NPDPWJKCLUCSNK-KSSFIOAISA-N	0	3	333.501	3.112	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1occc1CC	ZINC001099221117	1363699472	/nfs/dbraw/zinc/69/94/72/1363699472.db2.gz	XZDSJYLKUUDMOP-QGZVFWFLSA-N	0	3	348.487	3.265	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2ccoc2CCC)C[C@H]1C(F)(F)F	ZINC001099330638	1363753587	/nfs/dbraw/zinc/75/35/87/1363753587.db2.gz	BLXPCSWURINJOG-CHWSQXEVSA-N	0	3	330.350	3.011	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@@H](C)c2ccc(C)cc2)C[C@H]1C(F)(F)F	ZINC001099333754	1363755280	/nfs/dbraw/zinc/75/52/80/1363755280.db2.gz	WSEDHLLFPISLPA-NUEKZKHPSA-N	0	3	340.389	3.263	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2cc(C)cc(C)c2)C[C@H]1C(F)(F)F	ZINC001099335972	1363757875	/nfs/dbraw/zinc/75/78/75/1363757875.db2.gz	ZNPOSGBZYAKTEZ-HZPDHXFCSA-N	0	3	340.389	3.472	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H](C)COc1ccccc1	ZINC001099340576	1363760319	/nfs/dbraw/zinc/76/03/19/1363760319.db2.gz	VQZITCKVFARELN-QZTJIDSGSA-N	0	3	344.499	3.494	20	30		EGEDHN
C=C[C@@H](C(=O)NC[C@@H]1CCC(C)(C)CN1CCOC)c1ccccc1	ZINC001099348734	1363764696	/nfs/dbraw/zinc/76/46/96/1363764696.db2.gz	LKVYLAFGNFFQPX-RBUKOAKNSA-N	0	3	344.499	3.209	20	30		EGEDHN
CC[C@@H](C)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2ccccc2C#N)C1	ZINC001099380227	1363781278	/nfs/dbraw/zinc/78/12/78/1363781278.db2.gz	USIFCJCENFZGCJ-PBEJRMEISA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C(C)(C)C(C)C)CC2(CCOCC2)C1	ZINC001099583405	1363865224	/nfs/dbraw/zinc/86/52/24/1363865224.db2.gz	QNQVLMZTOGAOPC-KRWDZBQOSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)[C@@H](C)CC2CCCC2)CC2(CCOCC2)C1	ZINC001099594481	1363877155	/nfs/dbraw/zinc/87/71/55/1363877155.db2.gz	DSTAQTOLURDQAN-HKUYNNGSSA-N	0	3	348.531	3.376	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C(CC)(CC)CC)CC2(CCOCC2)C1	ZINC001099595223	1363878369	/nfs/dbraw/zinc/87/83/69/1363878369.db2.gz	WAGDDFBYLJNNRF-GOSISDBHSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1CCN(Cc2ccc(C(C)C)cc2)C[C@@H]1O	ZINC001099975781	1363994707	/nfs/dbraw/zinc/99/47/07/1363994707.db2.gz	GXLYLFVDBKMUQR-PMACEKPBSA-N	0	3	344.499	3.218	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](CNCc2ocnc2C)[C@@H](C)C1	ZINC001185224666	1387656174	/nfs/dbraw/zinc/65/61/74/1387656174.db2.gz	GIDHQAUEQXIGPZ-HOCLYGCPSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCC1CC(NCc2cc(F)ccc2OC)C1	ZINC001100594652	1364179647	/nfs/dbraw/zinc/17/96/47/1364179647.db2.gz	CPHICQJISCOCLX-KSTDHSDQSA-N	0	3	348.462	3.421	20	30		EGEDHN
CC(C)(C(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1)C1CC1	ZINC001100598307	1364182418	/nfs/dbraw/zinc/18/24/18/1364182418.db2.gz	UCSRWQCNXKXRJN-UHFFFAOYSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=CCCCC(=O)NCC1CC(NCc2cnc(Cl)s2)C1	ZINC001100623297	1364194431	/nfs/dbraw/zinc/19/44/31/1364194431.db2.gz	HHWBMBUBQBBORB-UHFFFAOYSA-N	0	3	327.881	3.137	20	30		EGEDHN
C=CCCCC(=O)NCC1CC(NCc2cc(F)ccc2OC)C1	ZINC001100624488	1364194790	/nfs/dbraw/zinc/19/47/90/1364194790.db2.gz	NSTVLHUFQWVSHK-UHFFFAOYSA-N	0	3	334.435	3.175	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@H](C)OC2CCCCCC2)C1	ZINC001100659139	1364207270	/nfs/dbraw/zinc/20/72/70/1364207270.db2.gz	IMJHTJDSMXLFSK-FHERZECASA-N	0	3	342.911	3.351	20	30		EGEDHN
CC(C)C[C@H](C)C(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100795573	1364265115	/nfs/dbraw/zinc/26/51/15/1364265115.db2.gz	ACNKGHZDKUTWIS-VQSBYGRUSA-N	0	3	344.474	3.344	20	30		EGEDHN
C=CC[C@@H](C(=O)NCC1CC(NCc2ccccn2)C1)c1ccccc1	ZINC001101012564	1364371697	/nfs/dbraw/zinc/37/16/97/1364371697.db2.gz	GHIVVMSKYGYTDA-FBPXKMNZSA-N	0	3	349.478	3.426	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H](C)Cc2cccc(F)c2)C1	ZINC001101061704	1364397054	/nfs/dbraw/zinc/39/70/54/1364397054.db2.gz	LCJHUDINSGHMKO-VWDMACCTSA-N	0	3	338.854	3.241	20	30		EGEDHN
C=CCC1(C(=O)NCC2CC(NCc3ccc(F)cn3)C2)CCCC1	ZINC001101080228	1364403817	/nfs/dbraw/zinc/40/38/17/1364403817.db2.gz	FINLCCCDSKDSJN-UHFFFAOYSA-N	0	3	345.462	3.342	20	30		EGEDHN
C=C(C)CN1CC[C@@H](Oc2ccnc(CNC(=O)C(CC)CC)c2)C1	ZINC001101090563	1364408416	/nfs/dbraw/zinc/40/84/16/1364408416.db2.gz	MLIHRWYYMRFDEW-LJQANCHMSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@H]2CN(CCC(F)(F)F)C[C@@]2(C)C1	ZINC001101249857	1364485477	/nfs/dbraw/zinc/48/54/77/1364485477.db2.gz	PWBQQJVKGLQZHK-WBVHZDCISA-N	0	3	344.421	3.488	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@H]2CN(Cc3sc(C)nc3C)C[C@@]2(C)C1	ZINC001101253164	1364487216	/nfs/dbraw/zinc/48/72/16/1364487216.db2.gz	HSMKHXGNQWZEGS-APWZRJJASA-N	0	3	347.528	3.397	20	30		EGEDHN
CC(=O)N1CCC(C(C)(C)CNCc2cc(F)ccc2C#N)CC1	ZINC001101501397	1364584013	/nfs/dbraw/zinc/58/40/13/1364584013.db2.gz	PZGQANBQFZDLDA-UHFFFAOYSA-N	0	3	331.435	3.072	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC2(CN(C[C@H](C)CC(C)C)C2)n2ccnc21	ZINC001101615204	1364656762	/nfs/dbraw/zinc/65/67/62/1364656762.db2.gz	CDHVEUIQNOHTBI-SJORKVTESA-N	0	3	344.503	3.103	20	30		EGEDHN
C=CCC[C@H](C)N1CC2(C1)C[C@H](NC(=O)/C=C(\C)CC)c1nccn12	ZINC001101627887	1364661291	/nfs/dbraw/zinc/66/12/91/1364661291.db2.gz	PSTWJNCBHWJYHG-JBAYFQIUSA-N	0	3	342.487	3.166	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CC2(CN(CCC(C)(C)C)C2)n2ccnc21	ZINC001101641584	1364667254	/nfs/dbraw/zinc/66/72/54/1364667254.db2.gz	UPRNUZGHYJGXFQ-MRXNPFEDSA-N	0	3	344.503	3.248	20	30		EGEDHN
C#CCCCC(=O)NC[C@@H]1CN(Cc2oc(C(C)C)nc2C)C[C@H]1C	ZINC001101922270	1364776088	/nfs/dbraw/zinc/77/60/88/1364776088.db2.gz	YXNQKJHNKDNAGZ-NVXWUHKLSA-N	0	3	345.487	3.094	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC[C@@H]1CN(Cc2ccccn2)C[C@H]1C	ZINC001101997040	1364804461	/nfs/dbraw/zinc/80/44/61/1364804461.db2.gz	UZITVWZIWAXLIQ-SJLPKXTDSA-N	0	3	327.472	3.034	20	30		EGEDHN
C[C@@H](C(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C)C1CCC1	ZINC001102079789	1364841957	/nfs/dbraw/zinc/84/19/57/1364841957.db2.gz	FJIBOZXENIEBMP-IIAWOOMASA-N	0	3	345.512	3.240	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1CNC(=O)CC1(C)CC1	ZINC001102163263	1364902870	/nfs/dbraw/zinc/90/28/70/1364902870.db2.gz	ZBHKIKXFXQSOTG-SJLPKXTDSA-N	0	3	342.458	3.052	20	30		EGEDHN
C[C@@H](CC(F)F)C(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C	ZINC001102162772	1364903359	/nfs/dbraw/zinc/90/33/59/1364903359.db2.gz	HLLARCABBSLAKI-LZLYRXPVSA-N	0	3	348.437	3.014	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C	ZINC001102263209	1364975424	/nfs/dbraw/zinc/97/54/24/1364975424.db2.gz	YOQXCQDTKHOQKO-SVFBPWRDSA-N	0	3	338.495	3.325	20	30		EGEDHN
C=CCCC1(C(=O)NC[C@@H]2CN(Cc3oc(C)nc3C)C[C@H]2C)CC1	ZINC001102326125	1365002518	/nfs/dbraw/zinc/00/25/18/1365002518.db2.gz	JKNLTWWLHOAHTG-RHSMWYFYSA-N	0	3	345.487	3.222	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001102409956	1365042788	/nfs/dbraw/zinc/04/27/88/1365042788.db2.gz	CWKKIAPAMOVZIQ-HUUCEWRRSA-N	0	3	345.512	3.406	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](NCc3ccc(C#N)c(F)c3)C2)CCC1	ZINC001185463469	1387722133	/nfs/dbraw/zinc/72/21/33/1387722133.db2.gz	RXXZKWINPNXHNB-QGZVFWFLSA-N	0	3	341.430	3.134	20	30		EGEDHN
CC(C)=CC(=O)NCC[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1C	ZINC001102648108	1365154903	/nfs/dbraw/zinc/15/49/03/1365154903.db2.gz	QJAIIGDGGRUTNU-IEBWSBKVSA-N	0	3	342.458	3.218	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cc(Cl)c[nH]2)C1	ZINC001102661441	1365160112	/nfs/dbraw/zinc/16/01/12/1365160112.db2.gz	AJLODWDSVAUEFH-ZYHUDNBSSA-N	0	3	330.259	3.108	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)[C@H](C)OCCCC)C1	ZINC001102748058	1365200137	/nfs/dbraw/zinc/20/01/37/1365200137.db2.gz	QFNKTZBWKKMAKZ-VNQPRFMTSA-N	0	3	330.900	3.018	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)[C@@H]2C[C@H]2C(C)(C)C)C1	ZINC001103220195	1365441436	/nfs/dbraw/zinc/44/14/36/1365441436.db2.gz	BAEQGWYKGOSJEA-DTZQCDIJSA-N	0	3	326.912	3.495	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCC[C@@H]1CN(Cc2cnc(C)o2)C[C@H]1C	ZINC001103346145	1365511033	/nfs/dbraw/zinc/51/10/33/1365511033.db2.gz	FSDZYHWYFZVFEP-HYVNUMGLSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=CCCC1(C(=O)NCC[C@@H]2CN(Cc3cc(C)no3)C[C@H]2C)CC1	ZINC001103402800	1365538702	/nfs/dbraw/zinc/53/87/02/1365538702.db2.gz	MUMNSEJAMQBQDY-NVXWUHKLSA-N	0	3	345.487	3.304	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)NCC[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1C	ZINC001103453308	1365569273	/nfs/dbraw/zinc/56/92/73/1365569273.db2.gz	RVDSNBBRBZBRIT-QQTQMKHKSA-N	0	3	339.483	3.179	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2ccncc2Cl)C1	ZINC001103465656	1365578667	/nfs/dbraw/zinc/57/86/67/1365578667.db2.gz	RVYJRFVPTRFGDH-DGCLKSJQSA-N	0	3	342.270	3.175	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC[C@@H]1CN(Cc2cncs2)C[C@H]1C	ZINC001103474717	1365583566	/nfs/dbraw/zinc/58/35/66/1365583566.db2.gz	KIDSTFMGHVFXQU-HUUCEWRRSA-N	0	3	335.517	3.320	20	30		EGEDHN
C[C@@H]1CN(C(=O)C(C)(C)F)C[C@H]1CCNCc1ccc(C#N)cc1F	ZINC001103813910	1365794071	/nfs/dbraw/zinc/79/40/71/1365794071.db2.gz	ZADVCSACHBJJNP-CZUORRHYSA-N	0	3	349.425	3.020	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccco2)C[C@H]1CCNCc1ccccc1C#N	ZINC001103824870	1365799238	/nfs/dbraw/zinc/79/92/38/1365799238.db2.gz	FWOPKVADRFVIRH-CRAIPNDOSA-N	0	3	337.423	3.039	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccoc2)C[C@H]1CCNCc1ccccc1C#N	ZINC001103880512	1365822665	/nfs/dbraw/zinc/82/26/65/1365822665.db2.gz	BDHNGKKHZDSWDX-CRAIPNDOSA-N	0	3	337.423	3.039	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@H](CCNCc2cc(C#N)ccc2F)C1	ZINC001103977965	1365857016	/nfs/dbraw/zinc/85/70/16/1365857016.db2.gz	OIXZVTWLZYVEKK-NVXWUHKLSA-N	0	3	343.446	3.238	20	30		EGEDHN
C[C@@H]1CN(C(=O)/C=C\C2CC2)C[C@H]1CCNCc1ccccc1C#N	ZINC001104036755	1365884095	/nfs/dbraw/zinc/88/40/95/1365884095.db2.gz	GJGIQOLXCIHGCM-JKUVKPIWSA-N	0	3	337.467	3.099	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N1C[C@@H](C)[C@H](CCNCC(=C)Cl)C1	ZINC001104455314	1366035086	/nfs/dbraw/zinc/03/50/86/1366035086.db2.gz	NHJQTZBSMBOFTG-KYJSFNMBSA-N	0	3	342.911	3.042	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H](C)[C@H](CCNCc2nccn2CC)C1	ZINC001104631229	1366110028	/nfs/dbraw/zinc/11/00/28/1366110028.db2.gz	FSUPZBSQWMSUKC-MBOZVWFJSA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2ccc(Cl)[nH]2)C[C@H]1C	ZINC001104651048	1366118266	/nfs/dbraw/zinc/11/82/66/1366118266.db2.gz	UCCYDMFCQLWRMR-ZYHUDNBSSA-N	0	3	330.259	3.108	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1C[C@@H](C)[C@H](CCNCc2ccccc2C#N)C1	ZINC001104702663	1366137170	/nfs/dbraw/zinc/13/71/70/1366137170.db2.gz	AIAAAEUJAYXANI-XNFNUYLZSA-N	0	3	339.483	3.179	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)[C@H](C)OCCC(C)C)C[C@H]1C	ZINC001105090675	1366320295	/nfs/dbraw/zinc/32/02/95/1366320295.db2.gz	FXIMJAUGAKPTGV-HYVNUMGLSA-N	0	3	344.927	3.264	20	30		EGEDHN
C=CCC[C@@H](C)NCc1cn(C2CN(C(=O)CCCCCC)C2)nn1	ZINC001105370170	1366429300	/nfs/dbraw/zinc/42/93/00/1366429300.db2.gz	XLGRSWAANGYJBQ-MRXNPFEDSA-N	0	3	347.507	3.076	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C[C@@H](C=C)CC)CC1	ZINC001105394467	1366443206	/nfs/dbraw/zinc/44/32/06/1366443206.db2.gz	XULSHKPZQNBFJT-FXAWDEMLSA-N	0	3	328.500	3.315	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)CCC(C)(F)F)CC1	ZINC001105394234	1366443286	/nfs/dbraw/zinc/44/32/86/1366443286.db2.gz	RDCRFHQIWVJLLW-QGZVFWFLSA-N	0	3	338.442	3.148	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)N[C@H]1C[C@@](CNCCF)(c2ccccc2)C1	ZINC001105433642	1366465906	/nfs/dbraw/zinc/46/59/06/1366465906.db2.gz	KMVSAVPVNZHFGN-ZTTFOMCMSA-N	0	3	332.463	3.220	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@@](CNCCF)(c3ccccc3)C2)C1	ZINC001105438818	1366468781	/nfs/dbraw/zinc/46/87/81/1366468781.db2.gz	OPSIJGJFFVJSET-MSEWRSJXSA-N	0	3	330.447	3.118	20	30		EGEDHN
C[C@@H]1CN(C(=O)C#CC(C)(C)C)C[C@H]1CNCc1c(F)cccc1F	ZINC001106109275	1366611675	/nfs/dbraw/zinc/61/16/75/1366611675.db2.gz	IMRJQUJBXYBPRF-HUUCEWRRSA-N	0	3	348.437	3.198	20	30		EGEDHN
C[C@H](CC(F)F)C(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001106444143	1366697350	/nfs/dbraw/zinc/69/73/50/1366697350.db2.gz	SOEPOFQGICRIFQ-CKEIUWERSA-N	0	3	349.425	3.034	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](CNC/C(Cl)=C\Cl)[C@H](C)C2)C1	ZINC001106647389	1366765311	/nfs/dbraw/zinc/76/53/11/1366765311.db2.gz	NRQOWVWWZWBALU-MJSVBIRZSA-N	0	3	331.287	3.346	20	30		EGEDHN
C=CCCC(=O)NC[C@]12CCC[C@H]1N(Cc1c(C)onc1CC)CC2	ZINC001107327264	1366929009	/nfs/dbraw/zinc/92/90/09/1366929009.db2.gz	VHBGRUCZGRVQNX-UYAOXDASSA-N	0	3	345.487	3.372	20	30		EGEDHN
O=C(/C=C/C1CC1)NC[C@]12CCC[C@H]1N(CC#Cc1ccccc1)CC2	ZINC001107351907	1366938154	/nfs/dbraw/zinc/93/81/54/1366938154.db2.gz	ASCBWWDCSSFARK-KPEHQHOOSA-N	0	3	348.490	3.365	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1cccc2cccnc21	ZINC001109245901	1367024730	/nfs/dbraw/zinc/02/47/30/1367024730.db2.gz	FRXMOAMRBMMBGV-AABGKKOBSA-N	0	3	347.462	3.116	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](N(C)Cc2ccc(F)cc2C)C1	ZINC001189743858	1367100221	/nfs/dbraw/zinc/10/02/21/1367100221.db2.gz	JVAOXMXXNCXHMM-LJQANCHMSA-N	0	3	330.447	3.360	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](N(C)Cc2ccc(C)c(F)c2)C1	ZINC001189744805	1367100638	/nfs/dbraw/zinc/10/06/38/1367100638.db2.gz	ZRPIWXCBLHPXRD-SFHVURJKSA-N	0	3	330.447	3.360	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CC(C)(C)c1ccc(F)cc1)C2	ZINC001109408520	1367108156	/nfs/dbraw/zinc/10/81/56/1367108156.db2.gz	SQQQEBITMATGGI-QYZOEREBSA-N	0	3	342.458	3.238	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](N(C)CCOc2cc(C)ccc2C)C1	ZINC001189925662	1367132935	/nfs/dbraw/zinc/13/29/35/1367132935.db2.gz	DSSUKGDNVBWWHG-IBGZPJMESA-N	0	3	342.483	3.018	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)CC2=CCCCC2)C1	ZINC001107813105	1367157320	/nfs/dbraw/zinc/15/73/20/1367157320.db2.gz	NOXTXUCCGXNGLM-XLIONFOSSA-N	0	3	334.504	3.439	20	30		EGEDHN
Cc1cc(CN(C)[C@@H]2CCN(C(=O)C#CC(C)(C)C)C2)c(C)s1	ZINC001190084257	1367168764	/nfs/dbraw/zinc/16/87/64/1367168764.db2.gz	LQZYLVBDDGRLDK-QGZVFWFLSA-N	0	3	332.513	3.447	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2cscc2C)C1	ZINC001107850965	1367174661	/nfs/dbraw/zinc/17/46/61/1367174661.db2.gz	USOMBUQPQALPLU-CRAIPNDOSA-N	0	3	336.501	3.232	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N2CC[C@@H](N(C)CC=C(C)C)C2)cc1	ZINC001190121766	1367178040	/nfs/dbraw/zinc/17/80/40/1367178040.db2.gz	RGOUHAKJZLHIDO-LJQANCHMSA-N	0	3	340.467	3.201	20	30		EGEDHN
C#CCCCCC(=O)NC[C@]1(C)CN(CC2CCCCCC2)CCO1	ZINC001107883106	1367190647	/nfs/dbraw/zinc/19/06/47/1367190647.db2.gz	KZLDAZXTUFOUBN-OAQYLSRUSA-N	0	3	348.531	3.358	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCCOc1ccc(F)cc1)C2	ZINC001109584445	1367211180	/nfs/dbraw/zinc/21/11/80/1367211180.db2.gz	JLVMZEQLKNBQJT-NEWSRXKRSA-N	0	3	346.446	3.282	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC[C@@]1(C)CN(CC(CC)CC)CCO1	ZINC001107967259	1367222337	/nfs/dbraw/zinc/22/23/37/1367222337.db2.gz	QLBDCUFJWYFPOY-FQEVSTJZSA-N	0	3	336.520	3.398	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@]1(C)CN(CC2CCC(C)CC2)CCO1	ZINC001107976595	1367227127	/nfs/dbraw/zinc/22/71/27/1367227127.db2.gz	QATWTMXBCDZZOE-QLOJAFMTSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCc1scnc1C	ZINC001109634605	1367253744	/nfs/dbraw/zinc/25/37/44/1367253744.db2.gz	RMGPXFVEDFHJJC-NCOADZHNSA-N	0	3	347.528	3.318	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](N(C)Cc2ccccc2N(C)C)C1	ZINC001190423643	1367261773	/nfs/dbraw/zinc/26/17/73/1367261773.db2.gz	SEZWSZPCUCVFGO-SFHVURJKSA-N	0	3	329.488	3.142	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](N(C)Cc2ccc3c(c2)COC3)C1	ZINC001190428105	1367263187	/nfs/dbraw/zinc/26/31/87/1367263187.db2.gz	BWEMEXZYQSLASC-LJQANCHMSA-N	0	3	328.456	3.106	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](N(C)CCOc2ccccc2F)C1	ZINC001190435952	1367264730	/nfs/dbraw/zinc/26/47/30/1367264730.db2.gz	MSRNMJVQGKIHRK-INIZCTEOSA-N	0	3	334.435	3.094	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)CC3CCC(C)(C)CC3)[C@@H]2C1	ZINC001190542858	1367290298	/nfs/dbraw/zinc/29/02/98/1367290298.db2.gz	KDWUDVMURSESJI-RBUKOAKNSA-N	0	3	348.531	3.328	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@]1(C)CN([C@H](C)CCC=C)CCO1	ZINC001108121731	1367291856	/nfs/dbraw/zinc/29/18/56/1367291856.db2.gz	FLZISQGCTBXHAF-UYAOXDASSA-N	0	3	334.504	3.132	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@H](N(C)Cc3cccc(F)c3)C2)CCC1	ZINC001190603450	1367304818	/nfs/dbraw/zinc/30/48/18/1367304818.db2.gz	CKNGDCHMIWRSRH-SFHVURJKSA-N	0	3	328.431	3.052	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2C[C@@H]1CC(C)(C)CO1	ZINC001109767858	1367311230	/nfs/dbraw/zinc/31/12/30/1367311230.db2.gz	OAAUCWLNVJWOGV-QZWWFDLISA-N	0	3	334.504	3.125	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2cc[nH]c2C2CC2)C1	ZINC001108164090	1367318397	/nfs/dbraw/zinc/31/83/97/1367318397.db2.gz	UBPXUMKFMXZYRM-FOIQADDNSA-N	0	3	345.487	3.068	20	30		EGEDHN
C=CCC1(C(=O)NC[C@]2(C)CN(CC3CC(C)(C)C3)CCO2)CCC1	ZINC001108187549	1367330723	/nfs/dbraw/zinc/33/07/23/1367330723.db2.gz	JXEJCHXNOIWKPH-HXUWFJFHSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@]2(C)CN(C[C@H](C)CC(C)C)CCO2)C1	ZINC001108201821	1367340377	/nfs/dbraw/zinc/34/03/77/1367340377.db2.gz	SHOWTGBJYBQYJK-OXQOHEQNSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2ccoc2CCC)C1	ZINC001108340402	1367398316	/nfs/dbraw/zinc/39/83/16/1367398316.db2.gz	AULBQACEMUXAEX-OXQOHEQNSA-N	0	3	348.487	3.408	20	30		EGEDHN
C[C@H](CC(C)(C)C)C(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001186111103	1387873064	/nfs/dbraw/zinc/87/30/64/1387873064.db2.gz	PEIPZCXIIYMAIJ-RHSMWYFYSA-N	0	3	345.462	3.460	20	30		EGEDHN
CCCCCCCNC(=O)N1C[C@H]2CN(Cc3ccccn3)C[C@@H]2C1	ZINC001191091814	1367422441	/nfs/dbraw/zinc/42/24/41/1367422441.db2.gz	VCULJDQLQSKICN-QZTJIDSGSA-N	0	3	344.503	3.125	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)COc1cccc(Cl)c1)C2	ZINC001110078331	1367495341	/nfs/dbraw/zinc/49/53/41/1367495341.db2.gz	HHSDMKHUSYJOKU-PVAVHDDUSA-N	0	3	334.847	3.016	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](N(C)CCOC2CCCCCC2)C1	ZINC001191727784	1367571388	/nfs/dbraw/zinc/57/13/88/1367571388.db2.gz	PRVCNLAYAVBGBQ-KRWDZBQOSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001191912031	1367634845	/nfs/dbraw/zinc/63/48/45/1367634845.db2.gz	MFINNAQITWCBTB-APWZRJJASA-N	0	3	325.456	3.193	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1cccc2cccnc21	ZINC001110367528	1367672656	/nfs/dbraw/zinc/67/26/56/1367672656.db2.gz	KLVRCPUAMJWBPV-QRVBRYPASA-N	0	3	335.451	3.423	20	30		EGEDHN
CCCC(C)(C)C(=O)N1CC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001192082761	1367682923	/nfs/dbraw/zinc/68/29/23/1367682923.db2.gz	MSHCBBKJDHOTNX-SFHVURJKSA-N	0	3	327.472	3.417	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](N(C)Cc3ccc(C#N)cc3)C2)CC1	ZINC001192179893	1367708371	/nfs/dbraw/zinc/70/83/71/1367708371.db2.gz	BPMPXLFWDWTNPD-LJQANCHMSA-N	0	3	337.467	3.337	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](N(C)CCOCC3CCC3)C2)CC1	ZINC001192180454	1367708593	/nfs/dbraw/zinc/70/85/93/1367708593.db2.gz	IPTRBOLAWMHJDJ-LJQANCHMSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@H](N(C)Cc3ccc(OC)cc3)C2)CC1	ZINC001192181575	1367709493	/nfs/dbraw/zinc/70/94/93/1367709493.db2.gz	VZUCWAHSPKCQLO-SFHVURJKSA-N	0	3	342.483	3.474	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1CN([C@@H](CC)c2ccccc2)C[C@H]1O	ZINC001193241648	1367975532	/nfs/dbraw/zinc/97/55/32/1367975532.db2.gz	WQCBHSWAACKQQG-HSALFYBXSA-N	0	3	342.483	3.067	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2cccc(C(C)C)c2)C1	ZINC001193244205	1367978026	/nfs/dbraw/zinc/97/80/26/1367978026.db2.gz	NXHYGGXFHXJREJ-LJQANCHMSA-N	0	3	330.472	3.159	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCN(C(=O)CCC2(C)CC2)C1	ZINC001193257919	1367982199	/nfs/dbraw/zinc/98/21/99/1367982199.db2.gz	PFVFAXXNXJROJB-GOSISDBHSA-N	0	3	325.456	3.171	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCc1ccc3[nH]ccc3c1)C2	ZINC001110820189	1368009579	/nfs/dbraw/zinc/00/95/79/1368009579.db2.gz	LMPAAHQQELMVOA-RLLQIKCJSA-N	0	3	337.467	3.398	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](CCC)c1ccccn1)C2	ZINC001110950480	1368116883	/nfs/dbraw/zinc/11/68/83/1368116883.db2.gz	LYCXXDAQRKKMDG-JFRXWTBNSA-N	0	3	327.472	3.263	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@H](C)CC(C)(C)C)C2	ZINC001111061911	1368150790	/nfs/dbraw/zinc/15/07/90/1368150790.db2.gz	PQYSXUOCXSJXJD-MLHJIOFPSA-N	0	3	336.520	3.373	20	30		EGEDHN
C=CC1(CC(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3[C@H](C)COC)CCCCC1	ZINC001111135594	1368163678	/nfs/dbraw/zinc/16/36/78/1368163678.db2.gz	XQJODXJXOOCHJH-TVFCKZIOSA-N	0	3	334.504	3.269	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](N(C)CCOCC3CC3)C2)CCCCC1	ZINC001194201471	1368207638	/nfs/dbraw/zinc/20/76/38/1368207638.db2.gz	UHYZASPVNAEWLY-LJQANCHMSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)CC2CCC(C)(C)CC2)C1	ZINC001194547797	1368283482	/nfs/dbraw/zinc/28/34/82/1368283482.db2.gz	YXEBDBVMNOBBEV-GOSISDBHSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](N(C)CCOC3CCC3)C2)CCCC1	ZINC001194555233	1368285393	/nfs/dbraw/zinc/28/53/93/1368285393.db2.gz	KJDYXQCQHRDKTH-KRWDZBQOSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)C[C@@H](NC(=O)CCC)c1ccccc1O2	ZINC001111529104	1368327719	/nfs/dbraw/zinc/32/77/19/1368327719.db2.gz	DOIJDFWHGVLJSP-XLIONFOSSA-N	0	3	328.456	3.447	20	30		EGEDHN
CCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1cccc(C#N)c1)C2	ZINC001111596901	1368362116	/nfs/dbraw/zinc/36/21/16/1368362116.db2.gz	CPOJZCYGIQDOIM-ICSRJNTNSA-N	0	3	325.456	3.219	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CCCN(CCc2ccc(C)cc2)CC1	ZINC001195174078	1368393605	/nfs/dbraw/zinc/39/36/05/1368393605.db2.gz	IRZVJJNCDNCUHI-LJQANCHMSA-N	0	3	344.499	3.053	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CCCN(CC[C@@H]2CCCC2(F)F)CC1	ZINC001195791579	1368491299	/nfs/dbraw/zinc/49/12/99/1368491299.db2.gz	GBILFLPIAKTDKI-INIZCTEOSA-N	0	3	340.458	3.396	20	30		EGEDHN
CC#CCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1cncc(C)c1)C2	ZINC001111846283	1368500388	/nfs/dbraw/zinc/50/03/88/1368500388.db2.gz	ZKYHWSOQEBGDNW-FPOVZHCZSA-N	0	3	339.483	3.054	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)C[C@@H](C)c2ccccc2F)C1	ZINC001111903971	1368548066	/nfs/dbraw/zinc/54/80/66/1368548066.db2.gz	ZVIZDNSZWYFYBX-WWMYMODYSA-N	0	3	342.458	3.313	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N1CCCN(CC2=CCCCC2)CC1	ZINC001196665394	1368657882	/nfs/dbraw/zinc/65/78/82/1368657882.db2.gz	BZDXTRGUZQLBHB-HXUWFJFHSA-N	0	3	334.504	3.250	20	30		EGEDHN
C=CCCN1CCCN(C(=O)[C@@H](C)OCc2cccc(C)c2)CC1	ZINC001196690801	1368664584	/nfs/dbraw/zinc/66/45/84/1368664584.db2.gz	XAMXVDIHJXSQPA-GOSISDBHSA-N	0	3	330.472	3.011	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@@H](C)CC(C)(C)C)C1	ZINC001196725496	1368670701	/nfs/dbraw/zinc/67/07/01/1368670701.db2.gz	GEWLZJNKXYUZSL-GVDBMIGSSA-N	0	3	326.525	3.190	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)CCCCC(C)C)C[C@H]1C(F)(F)F	ZINC001112180835	1368703520	/nfs/dbraw/zinc/70/35/20/1368703520.db2.gz	RKZDPEFXRIKNAZ-HUUCEWRRSA-N	0	3	332.410	3.205	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)[C@](C)(CC)CCC)C[C@H]1C(F)(F)F	ZINC001112184910	1368705072	/nfs/dbraw/zinc/70/50/72/1368705072.db2.gz	KJUHDWUKZBKIFW-IIAWOOMASA-N	0	3	332.410	3.205	20	30		EGEDHN
C=CCCCC(=O)N1CCCN(C[C@@H](O)[C@@H](C)c2ccccc2)CC1	ZINC001197000719	1368728875	/nfs/dbraw/zinc/72/88/75/1368728875.db2.gz	YFGFZNLNIIVKNV-AZUAARDMSA-N	0	3	344.499	3.042	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2c[nH]nc2C2CC2)CC1	ZINC001197669499	1368869460	/nfs/dbraw/zinc/86/94/60/1368869460.db2.gz	POFHZWPRLDVRIP-UHFFFAOYSA-N	0	3	332.492	3.405	20	30		EGEDHN
CC[C@H](C)CCC(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001186537051	1387965628	/nfs/dbraw/zinc/96/56/28/1387965628.db2.gz	JYJUDXIUIXVYPC-WMLDXEAASA-N	0	3	331.435	3.214	20	30		EGEDHN
CC[C@H](C)CCC(=O)N1CC[C@@H](NCc2ccc(OC)c(C#N)c2)C1	ZINC001186537395	1387966001	/nfs/dbraw/zinc/96/60/01/1387966001.db2.gz	OEKMAFYQZQOYJI-MAUKXSAKSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2coc(-c3ccccc3)n2)CC1	ZINC001197850835	1368913188	/nfs/dbraw/zinc/91/31/88/1368913188.db2.gz	YIWZZAQWNYUNLB-UHFFFAOYSA-N	0	3	339.439	3.456	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2c(Cl)cccc2OC)CC1	ZINC001198243803	1368987822	/nfs/dbraw/zinc/98/78/22/1368987822.db2.gz	NTNTZMLYOBEKNO-UHFFFAOYSA-N	0	3	336.863	3.463	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2ncccc2OCC)CC1	ZINC001198417318	1369027565	/nfs/dbraw/zinc/02/75/65/1369027565.db2.gz	FOMURHIRHFFFLG-UHFFFAOYSA-N	0	3	345.487	3.375	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)c1ccc(C)o1)c1ccccc1OC	ZINC001198508722	1369049208	/nfs/dbraw/zinc/04/92/08/1369049208.db2.gz	PNQABJMRKALAQF-MRXNPFEDSA-N	0	3	328.412	3.233	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)[C@H](C)SC)c1ccccc1OC	ZINC001198551628	1369058903	/nfs/dbraw/zinc/05/89/03/1369058903.db2.gz	AMKXLFHPDWAIPR-HOCLYGCPSA-N	0	3	336.501	3.160	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@@H](C)OCC(C)C)c1ccccc1OC	ZINC001198577352	1369064437	/nfs/dbraw/zinc/06/44/37/1369064437.db2.gz	IXYSNYPOZZGOAS-AEFFLSMTSA-N	0	3	348.487	3.079	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NC[C@H](NC(C)C)c1ccccc1OC)OCC	ZINC001198751904	1369105360	/nfs/dbraw/zinc/10/53/60/1369105360.db2.gz	KMKCWUOCGNEZIV-HKUYNNGSSA-N	0	3	348.487	3.222	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)CCC(C)(F)F)c1ccccc1OC	ZINC001198776390	1369111080	/nfs/dbraw/zinc/11/10/80/1369111080.db2.gz	QILYXHGYWWBNPT-HNNXBMFYSA-N	0	3	340.414	3.454	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)[C@@H](F)C(C)C)c1ccccc1OC	ZINC001198843992	1369128235	/nfs/dbraw/zinc/12/82/35/1369128235.db2.gz	YWYIFWISDZUZLQ-AEFFLSMTSA-N	0	3	336.451	3.402	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@H](NCCCC)c1ccccc1OC	ZINC001198856205	1369130426	/nfs/dbraw/zinc/13/04/26/1369130426.db2.gz	GXUKBUVUKHTGQV-GOSISDBHSA-N	0	3	330.472	3.436	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@H](NCCC1CC1)c1ccccc1OC	ZINC001198856929	1369131706	/nfs/dbraw/zinc/13/17/06/1369131706.db2.gz	LUKGUOITJRCLQI-LJQANCHMSA-N	0	3	342.483	3.436	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)C1(C)CC=CC1)c1ccccc1OC	ZINC001198876837	1369137328	/nfs/dbraw/zinc/13/73/28/1369137328.db2.gz	YRNKDWCGUHLWKF-QGZVFWFLSA-N	0	3	328.456	3.375	20	30		EGEDHN
CCCCCCCC[C@@H](C)C(=O)N[C@@H]1CN(CC(C)C)C[C@H]1O	ZINC001198905016	1369145303	/nfs/dbraw/zinc/14/53/03/1369145303.db2.gz	UBKQFNFPFQJAQF-KZNAEPCWSA-N	0	3	326.525	3.190	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)c1ccnc(C)c1)c1ccccc1OC	ZINC001198938672	1369153115	/nfs/dbraw/zinc/15/31/15/1369153115.db2.gz	DERGCUHBUHWCSF-SFHVURJKSA-N	0	3	339.439	3.035	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@@H](C)CCCOC)c1ccccc1OC	ZINC001198961331	1369159530	/nfs/dbraw/zinc/15/95/30/1369159530.db2.gz	VMJRDHJZCIZNNP-WMZOPIPTSA-N	0	3	348.487	3.081	20	30		EGEDHN
C#CCC1(C(=O)NC[C@H](NCC)c2ccccc2OC)CCCCC1	ZINC001199002108	1369169924	/nfs/dbraw/zinc/16/99/24/1369169924.db2.gz	QDEAWSCOXSPPPT-SFHVURJKSA-N	0	3	342.483	3.436	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)Cc2cc(C)ccc2OC)CC1	ZINC001113076252	1369183828	/nfs/dbraw/zinc/18/38/28/1369183828.db2.gz	ZYWYNGBQWXULAF-QGZVFWFLSA-N	0	3	330.472	3.045	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)CCc2ccc(N(C)C)cc2)CC1	ZINC001113078729	1369185440	/nfs/dbraw/zinc/18/54/40/1369185440.db2.gz	WVNWZBVSSFFUPN-SFHVURJKSA-N	0	3	343.515	3.184	20	30		EGEDHN
CC(C)[C@@H](C)CC(=O)N1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001199733729	1369263789	/nfs/dbraw/zinc/26/37/89/1369263789.db2.gz	UOSZNIRGNVIUOZ-HNNXBMFYSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC(C)(C)/C=C/C(=O)N1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001199848098	1369280947	/nfs/dbraw/zinc/28/09/47/1369280947.db2.gz	UWYWFDGYKZMAHW-RMKNXTFCSA-N	0	3	343.446	3.380	20	30		EGEDHN
CC(C)(C#N)c1cccc(NC(=S)NCCN2CCCCC2)c1	ZINC001200431349	1369366670	/nfs/dbraw/zinc/36/66/70/1369366670.db2.gz	WWDCBDSPKRIHFT-UHFFFAOYSA-N	0	3	330.501	3.260	20	30		EGEDHN
C=CC1(CC(=O)N2CCN(C[C@@H]3CCO[C@H](C)C3)CC2)CCCCC1	ZINC001113428274	1369420767	/nfs/dbraw/zinc/42/07/67/1369420767.db2.gz	NWCFHCQTLCEZHB-RTBURBONSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)CCN(C)c2ccccc2)CC1	ZINC001113440743	1369430543	/nfs/dbraw/zinc/43/05/43/1369430543.db2.gz	MSAKELOYYHYFFV-SFHVURJKSA-N	0	3	329.488	3.012	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC(NCc2ccn(C3CCCC3)n2)CC1	ZINC001200816579	1369433677	/nfs/dbraw/zinc/43/36/77/1369433677.db2.gz	ZOQUWNOQPKXKKH-UHFFFAOYSA-N	0	3	344.503	3.435	20	30		EGEDHN
CC#CCNC[C@@H]1CN(C(=O)[C@@H](CC)CCCCCC)CCCO1	ZINC001201147371	1369485706	/nfs/dbraw/zinc/48/57/06/1369485706.db2.gz	LWBYSJHXERELFO-RBUKOAKNSA-N	0	3	336.520	3.213	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCCO[C@H](CNCc2ccccc2F)C1	ZINC001201233392	1369501685	/nfs/dbraw/zinc/50/16/85/1369501685.db2.gz	PABRKXZBYWXBHQ-SJLPKXTDSA-N	0	3	348.462	3.135	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)CCCOc2ccccc2F)CC1	ZINC001113674600	1369559914	/nfs/dbraw/zinc/55/99/14/1369559914.db2.gz	AQUUYEWJRBSUNO-QGZVFWFLSA-N	0	3	348.462	3.484	20	30		EGEDHN
CC#CCNC[C@@H]1CN(C(=O)CCCCCCCCC)CCCO1	ZINC001201935808	1369646088	/nfs/dbraw/zinc/64/60/88/1369646088.db2.gz	CQKRBXKLCQFUCT-LJQANCHMSA-N	0	3	336.520	3.358	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)N1CCC(NCc2cc(C3CC3)no2)CC1	ZINC001202084382	1369683208	/nfs/dbraw/zinc/68/32/08/1369683208.db2.gz	BLSIQTKNCRLOGW-KBPBESRZSA-N	0	3	331.460	3.091	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)N1CCC(NCc2oc(CCC)nc2C)CC1	ZINC001202084424	1369683753	/nfs/dbraw/zinc/68/37/53/1369683753.db2.gz	CGZXFTLINBNNCZ-HUUCEWRRSA-N	0	3	347.503	3.474	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC(NCc2cc(C3CC3)no2)CC1	ZINC001202137664	1369698343	/nfs/dbraw/zinc/69/83/43/1369698343.db2.gz	ITWMRLXGSRPOHP-AWEZNQCLSA-N	0	3	331.460	3.235	20	30		EGEDHN
CCC(=O)N[C@H]1C[C@@H](NCC#Cc2ccc(Cl)cc2)C12CCC2	ZINC001202259480	1369724375	/nfs/dbraw/zinc/72/43/75/1369724375.db2.gz	NMKOISVIQPQCOL-SJORKVTESA-N	0	3	330.859	3.119	20	30		EGEDHN
C=CCCCC(=O)N1CCC(NCc2ccn(C3CCCC3)n2)CC1	ZINC001202266869	1369725366	/nfs/dbraw/zinc/72/53/66/1369725366.db2.gz	NMIVNSGNNIVYNY-UHFFFAOYSA-N	0	3	344.503	3.435	20	30		EGEDHN
C=C(Br)CNC1CCN(C(=O)C(C)(C)CCC)CC1	ZINC001202273587	1369727283	/nfs/dbraw/zinc/72/72/83/1369727283.db2.gz	QIXIQTSVZTXVPI-UHFFFAOYSA-N	0	3	331.298	3.302	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(NCc3cc(C4CC4)no3)CC2)CCC1	ZINC001202373005	1369753605	/nfs/dbraw/zinc/75/36/05/1369753605.db2.gz	ZTRWKYXJNGLAHE-UHFFFAOYSA-N	0	3	343.471	3.379	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(N[C@H](C)c3cnc(C)cn3)CC2)CCC1	ZINC001202372266	1369753685	/nfs/dbraw/zinc/75/36/85/1369753685.db2.gz	PLCRKGWFWFOMKN-MRXNPFEDSA-N	0	3	342.487	3.173	20	30		EGEDHN
CC[C@@H](CC(C)C)C(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C1	ZINC001186894790	1388023809	/nfs/dbraw/zinc/02/38/09/1388023809.db2.gz	DLXUHPFJHXTDNK-LSDHHAIUSA-N	0	3	333.501	3.383	20	30		EGEDHN
CC(C)=CC(=O)N[C@@H]1C[C@@H](NCC#Cc2ccc(F)cc2)C12CCC2	ZINC001202408318	1369764177	/nfs/dbraw/zinc/76/41/77/1369764177.db2.gz	SRHUYVVYLZLIKN-RTBURBONSA-N	0	3	340.442	3.160	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)CCCC)C12CCC2	ZINC001202489476	1369788675	/nfs/dbraw/zinc/78/86/75/1369788675.db2.gz	LBMDSBPPDRVJAC-STQMWFEESA-N	0	3	329.282	3.102	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC(N[C@H](C)c2cnc(C)cn2)CC1	ZINC001202694028	1369853828	/nfs/dbraw/zinc/85/38/28/1369853828.db2.gz	IPUPCWHBQWIYOX-OAHLLOKOSA-N	0	3	330.476	3.029	20	30		EGEDHN
CC/C(C)=C/C(=O)N[C@@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202887858	1369917634	/nfs/dbraw/zinc/91/76/34/1369917634.db2.gz	MMZLUJKQVMVDQK-TWMXPDRFSA-N	0	3	336.479	3.411	20	30		EGEDHN
CC/C(C)=C\C(=O)N[C@@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202887855	1369918074	/nfs/dbraw/zinc/91/80/74/1369918074.db2.gz	MMZLUJKQVMVDQK-GGKMABOFSA-N	0	3	336.479	3.411	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(CF)cc3)C[C@H]21	ZINC001114678148	1370020645	/nfs/dbraw/zinc/02/06/45/1370020645.db2.gz	JRIQRUSWDJRTJV-PIIMJCKOSA-N	0	3	330.447	3.305	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(OC)c(C)c3)C[C@H]21	ZINC001114680522	1370022031	/nfs/dbraw/zinc/02/20/31/1370022031.db2.gz	JCNHLWJDHVBOJQ-DZFIZOCASA-N	0	3	342.483	3.152	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1C[C@@H](NCc2oc(C)nc2C)C12CCC2	ZINC001203257583	1370045349	/nfs/dbraw/zinc/04/53/49/1370045349.db2.gz	NGCYPBDXDXJDNO-SJORKVTESA-N	0	3	345.487	3.411	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1C[C@H](NCc2nc(C)c(C)s2)C12CCC2	ZINC001203274481	1370054818	/nfs/dbraw/zinc/05/48/18/1370054818.db2.gz	NWQDONFIGSAJGH-GJZGRUSLSA-N	0	3	347.528	3.489	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1C[C@H](NCc2oc(CC)nc2C)C12CCC2	ZINC001203279914	1370058368	/nfs/dbraw/zinc/05/83/68/1370058368.db2.gz	CEGGSESAHBHLLG-HOTGVXAUSA-N	0	3	345.487	3.275	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1C[C@H](NCc2ocnc2C)C12CCC2	ZINC001203297037	1370069699	/nfs/dbraw/zinc/06/96/99/1370069699.db2.gz	WNWNONDXOQTBQJ-ROUUACIJSA-N	0	3	343.471	3.084	20	30		EGEDHN
CCCCC1(C(=O)N[C@@H]2[C@H]3CN(Cc4ccc(C#N)cc4)C[C@H]32)CC1	ZINC001114786998	1370080683	/nfs/dbraw/zinc/08/06/83/1370080683.db2.gz	KCENHOPGRGIALF-BWTSREIZSA-N	0	3	337.467	3.075	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1[C@H]2CN(CCOc3ccccc3C)C[C@H]21	ZINC001114794174	1370084849	/nfs/dbraw/zinc/08/48/49/1370084849.db2.gz	DDVRDHNFOSPHGP-DIJFTKHXSA-N	0	3	342.483	3.023	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2C[C@H](NCc3cnoc3C)C23CCC3)CCC1	ZINC001203365601	1370099946	/nfs/dbraw/zinc/09/99/46/1370099946.db2.gz	HZANPOMBKJPEIB-DLBZAZTESA-N	0	3	343.471	3.246	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2C[C@H](NCc3cncs3)C23CCC3)CCC1	ZINC001203366570	1370100546	/nfs/dbraw/zinc/10/05/46/1370100546.db2.gz	NUNSHDQGJWQWJH-JKSUJKDBSA-N	0	3	345.512	3.407	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H]2C[C@H](NCc3cnc(C)o3)C23CCC3)CC1	ZINC001203374062	1370103256	/nfs/dbraw/zinc/10/32/56/1370103256.db2.gz	JTZFAARGGPUZJD-IRXDYDNUSA-N	0	3	343.471	3.246	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1[C@H]2CN(CC[C@H]3CC3(Cl)Cl)C[C@H]21	ZINC001114897510	1370136519	/nfs/dbraw/zinc/13/65/19/1370136519.db2.gz	ZSUYEKFUAMYTQM-IGQOVBAYSA-N	0	3	345.314	3.219	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1[C@H]2CN(CCCCC(F)(F)F)C[C@H]21	ZINC001114898687	1370137147	/nfs/dbraw/zinc/13/71/47/1370137147.db2.gz	DZUNEZSFIJBTKC-WDNDVIMCSA-N	0	3	332.410	3.368	20	30		EGEDHN
C[C@@H](CC(C)(C)C)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001114937026	1370163727	/nfs/dbraw/zinc/16/37/27/1370163727.db2.gz	HFNMBNMPNITQEC-WQANXHIZSA-N	0	3	339.483	3.177	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@H]2CCC(=O)N3c2ccccc2)c1	ZINC001203762701	1370254678	/nfs/dbraw/zinc/25/46/78/1370254678.db2.gz	URCZHCWNTTYLGF-WOJBJXKFSA-N	0	3	331.419	3.328	20	30		EGEDHN
C=CCOc1ccc(CN2CCC(NC(=O)CC(C)C)CC2)cc1	ZINC001204300676	1370436598	/nfs/dbraw/zinc/43/65/98/1370436598.db2.gz	ZLHZYMYRNRNDMZ-UHFFFAOYSA-N	0	3	330.472	3.378	20	30		EGEDHN
C=CCOc1ccc(CN2CC[C@H](Oc3cc(OC)ccn3)C2)cc1	ZINC001204302598	1370437298	/nfs/dbraw/zinc/43/72/98/1370437298.db2.gz	OKNXKEVNCSAJBK-IBGZPJMESA-N	0	3	340.423	3.308	20	30		EGEDHN
C=CCCC(=O)NCC1(NCc2oc(CC)nc2C)CCCCC1	ZINC001115442967	1370456028	/nfs/dbraw/zinc/45/60/28/1370456028.db2.gz	YFQUBQTTXDURRB-UHFFFAOYSA-N	0	3	333.476	3.420	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ncoc2CC)CCCCC1	ZINC001115458646	1370463445	/nfs/dbraw/zinc/46/34/45/1370463445.db2.gz	POFMYMKADXMAON-UHFFFAOYSA-N	0	3	325.840	3.012	20	30		EGEDHN
C=CCN(CC=C)CCN1CCN(Cc2ccc(Cl)s2)CC1	ZINC001204445430	1370479122	/nfs/dbraw/zinc/47/91/22/1370479122.db2.gz	YTFQFNJCHCJTQG-UHFFFAOYSA-N	0	3	339.936	3.193	20	30		EGEDHN
O=C1C=C2CN(Cc3cc(F)ccc3Br)CCC2S1	ZINC001204539472	1370509723	/nfs/dbraw/zinc/50/97/23/1370509723.db2.gz	NNQYXSHNFXIMAI-ZDUSSCGKSA-N	0	3	342.233	3.362	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H]2C[C@H]2c2ccncc2)CCCCC1	ZINC001115543366	1370540369	/nfs/dbraw/zinc/54/03/69/1370540369.db2.gz	DHRGIPOWHRRACA-DLBZAZTESA-N	0	3	347.890	3.346	20	30		EGEDHN
CN1CCN(Cc2ccc(Nc3nc(Cl)ccc3C#N)cc2)CC1	ZINC001204733566	1370558291	/nfs/dbraw/zinc/55/82/91/1370558291.db2.gz	CUKAWFSWMXAXTI-UHFFFAOYSA-N	0	3	341.846	3.098	20	30		EGEDHN
C#CCCCCC(=O)N1CCC(CNCc2ccccc2C#N)CC1	ZINC001205026563	1370632401	/nfs/dbraw/zinc/63/24/01/1370632401.db2.gz	BEPUEOWAMXWTGP-UHFFFAOYSA-N	0	3	337.467	3.080	20	30		EGEDHN
C=CCCN1C[C@@H](O)[C@H](N(Cc2ccccc2)C(=O)C[C@@H](C)CC)C1	ZINC001205133078	1370659848	/nfs/dbraw/zinc/65/98/48/1370659848.db2.gz	YOPZUTJPBUUWDT-DFQSSKMNSA-N	0	3	344.499	3.073	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC1(NCc2conc2C)CCCCC1	ZINC001115712463	1370691289	/nfs/dbraw/zinc/69/12/89/1370691289.db2.gz	MUJWMLYLYRODLB-GOSISDBHSA-N	0	3	333.476	3.494	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C[C@H]2C=CCC2)C[C@H]1c1cccc(F)c1	ZINC001205355110	1370730094	/nfs/dbraw/zinc/73/00/94/1370730094.db2.gz	QQQSLFVFQCRHNB-FFZOFVMBSA-N	0	3	340.442	3.089	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC(CNCc2ccn(C(C)C)n2)CC1	ZINC001205397576	1370742888	/nfs/dbraw/zinc/74/28/88/1370742888.db2.gz	BXGGIJAXBFYHBK-UHFFFAOYSA-N	0	3	346.519	3.395	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N1CCC(CNCc2ccccc2C#N)CC1	ZINC001205939496	1370918041	/nfs/dbraw/zinc/91/80/41/1370918041.db2.gz	VTAZVJIJETXELJ-CAOOACKPSA-N	0	3	337.467	3.409	20	30		EGEDHN
CC(C)(C)OC(=O)NCc1ccccc1CN[C@H]1CC[C@H](C#N)C1	ZINC001116910364	1371000042	/nfs/dbraw/zinc/00/00/42/1371000042.db2.gz	FTOQOPCJIJROHF-YOEHRIQHSA-N	0	3	329.444	3.493	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@@H]1CN(Cc2ccc(C3CCC3)cc2)C[C@H]1C	ZINC001206659170	1371124508	/nfs/dbraw/zinc/12/45/08/1371124508.db2.gz	DWUSHQVUOGIQEX-SPYBWZPUSA-N	0	3	325.456	3.050	20	30		EGEDHN
C=CCOCCCC(=O)N[C@@H]1CN(Cc2cccc(CC)c2)C[C@H]1C	ZINC001206778740	1371162408	/nfs/dbraw/zinc/16/24/08/1371162408.db2.gz	IDVYPLOHZHNDEY-YLJYHZDGSA-N	0	3	344.499	3.168	20	30		EGEDHN
C=C[C@@H](COC)NC[C@](C)(O)c1ccc(Br)cc1Cl	ZINC001326157147	1388120331	/nfs/dbraw/zinc/12/03/31/1388120331.db2.gz	VPSJWGBNJRSGMX-FZMZJTMJSA-N	0	3	348.668	3.101	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CN(Cc2ccc(CCC)cc2)C[C@H]1C	ZINC001206913773	1371223531	/nfs/dbraw/zinc/22/35/31/1371223531.db2.gz	XPVQCGIWMVSWJS-YLJYHZDGSA-N	0	3	326.484	3.379	20	30		EGEDHN
C=CCOC(=O)N1CCCC2(CCN(Cc3cnc(C)s3)CC2)C1	ZINC001207058846	1371281458	/nfs/dbraw/zinc/28/14/58/1371281458.db2.gz	NLSCTYPQDVUZSE-UHFFFAOYSA-N	0	3	349.500	3.452	20	30		EGEDHN
O=C(c1ccco1)N1CCC[C@@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207072974	1371285388	/nfs/dbraw/zinc/28/53/88/1371285388.db2.gz	TUZXDLXVHDPOEQ-QGZVFWFLSA-N	0	3	342.826	3.179	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H]1CN(CCOCCCC)C[C@H]1C	ZINC001207113209	1371298046	/nfs/dbraw/zinc/29/80/46/1371298046.db2.gz	DKYDNSJWJWEWLZ-UKRRQHHQSA-N	0	3	330.900	3.018	20	30		EGEDHN
O=C(c1ccoc1)N1CCC[C@@H](NCC#Cc2ccccc2Cl)C1	ZINC001207276859	1371347863	/nfs/dbraw/zinc/34/78/63/1371347863.db2.gz	MEWGVZVTKCMFFI-QGZVFWFLSA-N	0	3	342.826	3.179	20	30		EGEDHN
CCCCCC(=O)N1CCC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001207344870	1371366578	/nfs/dbraw/zinc/36/65/78/1371366578.db2.gz	ZZHZBQBIGOUSLK-QGZVFWFLSA-N	0	3	331.435	3.358	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC[C@@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207361714	1371373926	/nfs/dbraw/zinc/37/39/26/1371373926.db2.gz	ACQJIGTZZNHOEL-CRAIPNDOSA-N	0	3	332.875	3.318	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC[C@@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207362433	1371374755	/nfs/dbraw/zinc/37/47/55/1371374755.db2.gz	HKMUYQHDAJRESJ-MAUKXSAKSA-N	0	3	332.875	3.318	20	30		EGEDHN
CC(C)[C@@H](C)CC(=O)N1CCC[C@@H](NCc2ccc(C#N)s2)C1	ZINC001207645409	1371463211	/nfs/dbraw/zinc/46/32/11/1371463211.db2.gz	MROJJXCASRKCPO-LSDHHAIUSA-N	0	3	333.501	3.383	20	30		EGEDHN
O=C(CCC1CC1)N1CCC[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207704632	1371478696	/nfs/dbraw/zinc/47/86/96/1371478696.db2.gz	GAJVUDWJUSLFEW-IBGZPJMESA-N	0	3	344.886	3.462	20	30		EGEDHN
O=C(CCC1CC1)N1CCC[C@@H](NCC#Cc2ccccc2Cl)C1	ZINC001207706704	1371480168	/nfs/dbraw/zinc/48/01/68/1371480168.db2.gz	ZATZAPAEDYSLLG-GOSISDBHSA-N	0	3	344.886	3.462	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2c[nH]c3ncccc23)CCCCC1	ZINC001120159114	1371496875	/nfs/dbraw/zinc/49/68/75/1371496875.db2.gz	PUBBZLHVCGOZAB-UHFFFAOYSA-N	0	3	346.862	3.338	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)COCCCC)C1	ZINC001120355219	1371544606	/nfs/dbraw/zinc/54/46/06/1371544606.db2.gz	GIQRHPTVJDIBNO-DLBZAZTESA-N	0	3	342.911	3.259	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H](NCc2ccc(Cl)cc2F)C1	ZINC001207944144	1371544648	/nfs/dbraw/zinc/54/46/48/1371544648.db2.gz	JKHCMDYYBRTOLD-INIZCTEOSA-N	0	3	336.838	3.363	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC[C@@H](NCc2ccc(Cl)cc2F)C1	ZINC001207995849	1371562275	/nfs/dbraw/zinc/56/22/75/1371562275.db2.gz	QZDQXLOGXRZEHF-MRXNPFEDSA-N	0	3	336.838	3.219	20	30		EGEDHN
CCCCCCC/C=C/CN1CC[C@@H]2CN(C(C)=O)CCO[C@@H]2C1	ZINC001208120242	1371602465	/nfs/dbraw/zinc/60/24/65/1371602465.db2.gz	OWLXHTZSKZUYRJ-RMQQFATJSA-N	0	3	336.520	3.472	20	30		EGEDHN
C=C(C)[C@@H]1CC=C(CN2CCC[C@]3(CCN(CCOC)C3=O)C2)CC1	ZINC001208174703	1371617974	/nfs/dbraw/zinc/61/79/74/1371617974.db2.gz	HXAYITYEMYGBCJ-CTNGQTDRSA-N	0	3	346.515	3.250	20	30		EGEDHN
CCC(C)(C)CC(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001208214241	1371656947	/nfs/dbraw/zinc/65/69/47/1371656947.db2.gz	XMSQJTFBJCNXDX-LJQANCHMSA-N	0	3	326.484	3.445	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@H](NCc2cc(CO)ccc2F)C1	ZINC001208239858	1371676016	/nfs/dbraw/zinc/67/60/16/1371676016.db2.gz	GFGIGKQFIIQPIF-KRWDZBQOSA-N	0	3	348.462	3.001	20	30		EGEDHN
O=C([C@H]1CCC(F)(F)C1)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001208296092	1371704656	/nfs/dbraw/zinc/70/46/56/1371704656.db2.gz	LWWMDXGUEIMYJP-ROUUACIJSA-N	0	3	346.421	3.054	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN(Cc2cccc(OC)c2C)C[C@H]1C	ZINC001208315315	1371713543	/nfs/dbraw/zinc/71/35/43/1371713543.db2.gz	UOELWQDNFLZZNU-RHSMWYFYSA-N	0	3	330.472	3.152	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1CN(Cc2cccc(OC)c2)C[C@H]1C	ZINC001208392730	1371750101	/nfs/dbraw/zinc/75/01/01/1371750101.db2.gz	CJZHDAVQAFWQQH-GPMSIDNRSA-N	0	3	330.472	3.234	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN(Cc2cccc(COC)c2)C[C@H]1C	ZINC001208452505	1371771922	/nfs/dbraw/zinc/77/19/22/1371771922.db2.gz	OJFKMXOXZWRQOY-VQIMIIECSA-N	0	3	330.472	3.126	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN(Cc2ccc(C)c(OC)c2)C[C@H]1C	ZINC001208455675	1371772652	/nfs/dbraw/zinc/77/26/52/1371772652.db2.gz	ZTWSJCJIXSGYJR-SJLPKXTDSA-N	0	3	330.472	3.296	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)CCCCc2ccccc2)C1	ZINC001208477894	1371783212	/nfs/dbraw/zinc/78/32/12/1371783212.db2.gz	VCGCUOWGUZHLJZ-UYAOXDASSA-N	0	3	344.499	3.039	20	30		EGEDHN
C#CCCCC(=O)NC1CC2(CC(NCc3nc(C)sc3C)C2)C1	ZINC001121026220	1371837270	/nfs/dbraw/zinc/83/72/70/1371837270.db2.gz	AFQOYHFWDXIXFF-UHFFFAOYSA-N	0	3	345.512	3.080	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC1CC2(CC(NCc3cc(C)no3)C2)C1	ZINC001121155386	1371870203	/nfs/dbraw/zinc/87/02/03/1371870203.db2.gz	CIQNPFWBPRZABW-UHFFFAOYSA-N	0	3	343.471	3.268	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC1CC2(CC(NCc3cnc(C)o3)C2)C1	ZINC001121155734	1371870362	/nfs/dbraw/zinc/87/03/62/1371870362.db2.gz	SLCHAVKFMYIOKX-UHFFFAOYSA-N	0	3	343.471	3.268	20	30		EGEDHN
COC(=O)[C@H](C)CN(Cc1ccc(C#N)cc1)Cc1ccc(C#N)cc1	ZINC001208726410	1371875149	/nfs/dbraw/zinc/87/51/49/1371875149.db2.gz	PEBQKWRUPOZRQX-MRXNPFEDSA-N	0	3	347.418	3.241	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)C[C@H](C)CCC=C(C)C)C1	ZINC001208828611	1371908288	/nfs/dbraw/zinc/90/82/88/1371908288.db2.gz	XGADCKVVUFAWJH-GUDVDZBRSA-N	0	3	336.520	3.398	20	30		EGEDHN
N#Cc1cccc(CCCN2CCN(Cc3ccc(F)cc3)CC2)c1	ZINC001208845018	1371915557	/nfs/dbraw/zinc/91/55/57/1371915557.db2.gz	NQQYYOKJTQJRRP-UHFFFAOYSA-N	0	3	337.442	3.448	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)OC(C)(C)C)CN(CCc2ccc(C#N)cc2)C1	ZINC001208927425	1371948559	/nfs/dbraw/zinc/94/85/59/1371948559.db2.gz	HSTZDQNHKDJMII-QAPCUYQASA-N	0	3	343.471	3.336	20	30		EGEDHN
C=CCN(CCN1CCC[C@H]1c1ccccc1OC)C(=O)OCC	ZINC001209021721	1371976414	/nfs/dbraw/zinc/97/64/14/1371976414.db2.gz	DFSVXQOCWONOFU-KRWDZBQOSA-N	0	3	332.444	3.477	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC1CC2(CC(NCc3nccn3CC)C2)C1	ZINC001121523296	1371998858	/nfs/dbraw/zinc/99/88/58/1371998858.db2.gz	YBUJCAOORJAQEO-UHFFFAOYSA-N	0	3	344.503	3.022	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC[C@H](NCc2ccc(Cl)nc2)C1	ZINC001209146480	1372013887	/nfs/dbraw/zinc/01/38/87/1372013887.db2.gz	ORHVWNIOQQIMOG-HOCLYGCPSA-N	0	3	335.879	3.418	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC[C@H](NCc2c(C)nsc2C)C1	ZINC001209193109	1372033177	/nfs/dbraw/zinc/03/31/77/1372033177.db2.gz	GGCIXJCDFCJURR-HOTGVXAUSA-N	0	3	335.517	3.443	20	30		EGEDHN
C#CCCCN(Cc1ccncc1)[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC001209268006	1372055213	/nfs/dbraw/zinc/05/52/13/1372055213.db2.gz	PGVNPOXLRCQTBV-SFHVURJKSA-N	0	3	343.471	3.306	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)CC[C@@H]1CCCCO1)C2	ZINC001121853476	1372102986	/nfs/dbraw/zinc/10/29/86/1372102986.db2.gz	GJYADQPTTCBULS-HVEGKCCWSA-N	0	3	340.895	3.105	20	30		EGEDHN
C=CCCCCCCN1CC[C@@]2(CC(C(=O)N(C)C(C)C)=NO2)C1	ZINC001209436235	1372105792	/nfs/dbraw/zinc/10/57/92/1372105792.db2.gz	SHTAHNIFPAIIJS-LJQANCHMSA-N	0	3	335.492	3.211	20	30		EGEDHN
C=CCCCCCCCN1CC[C@@H]2[C@H]1CC(=O)N2c1cnn(C)c1	ZINC001209440541	1372106901	/nfs/dbraw/zinc/10/69/01/1372106901.db2.gz	FGWCMLKGVQFPAU-QZTJIDSGSA-N	0	3	330.476	3.126	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N1CCC(C(F)(F)F)(C(F)(F)F)C1	ZINC001121882205	1372112525	/nfs/dbraw/zinc/11/25/25/1372112525.db2.gz	WOJIGIQPIUUHFA-VIFPVBQESA-N	0	3	332.288	3.013	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)[C@H](C)Cc1ccco1)C2	ZINC001121908878	1372120295	/nfs/dbraw/zinc/12/02/95/1372120295.db2.gz	RIEUDIWLAGGYRG-WCZUTWHYSA-N	0	3	336.863	3.228	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@H](NCc2cc(CO)ccc2F)C1	ZINC001209875067	1372220047	/nfs/dbraw/zinc/22/00/47/1372220047.db2.gz	NABSCNAFQZNGJY-KRWDZBQOSA-N	0	3	348.462	3.001	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)COC(F)(F)F)cc1	ZINC001122542402	1372270325	/nfs/dbraw/zinc/27/03/25/1372270325.db2.gz	OBVOHVATERCPMP-ZDUSSCGKSA-N	0	3	342.317	3.213	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)N1CCC(c2cncn2C)CC1	ZINC001122602281	1372282017	/nfs/dbraw/zinc/28/20/17/1372282017.db2.gz	OPWNGCLAGAAAJK-KRWDZBQOSA-N	0	3	334.508	3.204	20	30		EGEDHN
CCCN1CCc2c(N)sc(Nc3cnc(C#N)c(C)c3)c2C1	ZINC001210202305	1372293428	/nfs/dbraw/zinc/29/34/28/1372293428.db2.gz	GWEVQOXGQJQJDL-UHFFFAOYSA-N	0	3	327.457	3.417	20	30		EGEDHN
CN1CCN(c2ccc(Nc3cccc(Cl)c3O)cc2C#N)CC1	ZINC001210222197	1372296278	/nfs/dbraw/zinc/29/62/78/1372296278.db2.gz	SYQUQHMEOPFLMV-UHFFFAOYSA-N	0	3	342.830	3.413	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1)C1CCCC1	ZINC001210584988	1372385150	/nfs/dbraw/zinc/38/51/50/1372385150.db2.gz	NUBAMFRGTWMEIX-RXVVDRJESA-N	0	3	338.495	3.445	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CC#Cc1ccccc1	ZINC001211232232	1372507990	/nfs/dbraw/zinc/50/79/90/1372507990.db2.gz	IACYKPXUMACORM-WIYYLYMNSA-N	0	3	332.447	3.065	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)C(CC(C)C)CC(C)C)C1	ZINC001211393257	1372548369	/nfs/dbraw/zinc/54/83/69/1372548369.db2.gz	JSPTVOMDDCRRKE-IEBWSBKVSA-N	0	3	338.536	3.334	20	30		EGEDHN
C=C(CN1CCCCC1)c1nc(-c2ncccc2Br)no1	ZINC001211436677	1372558915	/nfs/dbraw/zinc/55/89/15/1372558915.db2.gz	SMGHYDVBDYYICJ-UHFFFAOYSA-N	0	3	349.232	3.393	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)CCCC(C)C)C[C@H]1c1ccccc1	ZINC001211680111	1372601437	/nfs/dbraw/zinc/60/14/37/1372601437.db2.gz	HDTSNUALECLLBV-VQTJNVASSA-N	0	3	326.484	3.420	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)CC(CC)CC)C[C@H]1c1ccccc1	ZINC001211698429	1372604147	/nfs/dbraw/zinc/60/41/47/1372604147.db2.gz	NSHBFZSYFOVABI-VQTJNVASSA-N	0	3	326.484	3.420	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@H](C)C2CCCC2)C[C@H]1c1ccccc1	ZINC001211705186	1372606216	/nfs/dbraw/zinc/60/62/16/1372606216.db2.gz	COVAXJRAZMGQTG-JRGCBEDISA-N	0	3	338.495	3.420	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)C(=O)N1CC[C@@H](NC/C=C/Cl)C1	ZINC001188009154	1388212056	/nfs/dbraw/zinc/21/20/56/1388212056.db2.gz	FBQQQUUWCOWEEE-OEQDPHDDSA-N	0	3	332.875	3.364	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2ccccc2CCC)[C@H](OC)C1	ZINC001213145094	1372848859	/nfs/dbraw/zinc/84/88/59/1372848859.db2.gz	HCOKYQNMAZYLAO-RTBURBONSA-N	0	3	330.472	3.034	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CN(CCCc2ccccc2)C[C@H]1OC	ZINC001213319742	1372883414	/nfs/dbraw/zinc/88/34/14/1372883414.db2.gz	AURSXQQYUMKDGI-MISYRCLQSA-N	0	3	344.499	3.037	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2CN(CCCC3CCC3)C[C@H]2OC)CC1	ZINC001213395244	1372899669	/nfs/dbraw/zinc/89/96/69/1372899669.db2.gz	UHPYDMXNVRYWEL-QZTJIDSGSA-N	0	3	334.504	3.129	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2cccc(OC)c2)[C@H](OC)C1	ZINC001213770617	1372959215	/nfs/dbraw/zinc/95/92/15/1372959215.db2.gz	CHVNVAKDXRBJFK-RTBURBONSA-N	0	3	348.487	3.095	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H](NC(=O)c2ccoc2C(C)C)[C@H](OC)C1	ZINC001213953483	1372985873	/nfs/dbraw/zinc/98/58/73/1372985873.db2.gz	IMRZVJZTZIEYGX-USXIJHARSA-N	0	3	334.460	3.187	20	30		EGEDHN
C[C@@H]1CN(C(=O)/C=C/C(C)(C)C)C[C@H]1NCc1ccc(C#N)c(F)c1	ZINC001214356004	1373048608	/nfs/dbraw/zinc/04/86/08/1373048608.db2.gz	LXFZXSUKJIDGEH-WXVPVVBVSA-N	0	3	343.446	3.236	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2(C)CC2)C[C@H]1NCC#Cc1ccc(Cl)cc1	ZINC001215173444	1373182988	/nfs/dbraw/zinc/18/29/88/1373182988.db2.gz	SJIMXCWHQFYYLP-CRAIPNDOSA-N	0	3	344.886	3.318	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001215312074	1373197417	/nfs/dbraw/zinc/19/74/17/1373197417.db2.gz	PLERMUJRYUDPDG-CRAIPNDOSA-N	0	3	344.886	3.340	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](Oc2cnccc2CNCC(=C)C)C1	ZINC001127898635	1373197706	/nfs/dbraw/zinc/19/77/06/1373197706.db2.gz	WFMCJTUDGSNQPX-SFHVURJKSA-N	0	3	343.471	3.083	20	30		EGEDHN
C#CCCCCCC(=O)N1C[C@@H](C)[C@H](NCc2ccc(Cl)nc2)C1	ZINC001215323149	1373197808	/nfs/dbraw/zinc/19/78/08/1373197808.db2.gz	WOUCLAPGWMAVTC-NVXWUHKLSA-N	0	3	347.890	3.255	20	30		EGEDHN
CC(C)C[C@H](C)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001216099635	1373263189	/nfs/dbraw/zinc/26/31/89/1373263189.db2.gz	WDOGMKCHKONGDC-SQGPQFPESA-N	0	3	344.474	3.296	20	30		EGEDHN
CCCCCCCCOCC(=O)NCCNCc1cccc(F)c1	ZINC001129522589	1373393957	/nfs/dbraw/zinc/39/39/57/1373393957.db2.gz	FQRWADURJWUVBY-UHFFFAOYSA-N	0	3	338.467	3.409	20	30		EGEDHN
C=C(C)CN1CC[C@H](Oc2cnccc2CNC(=O)[C@H](C)CCC)C1	ZINC001130313160	1373489849	/nfs/dbraw/zinc/48/98/49/1373489849.db2.gz	NWMNWYJAPQIUDZ-AEFFLSMTSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCO[C@@H]2CN(CC/C=C/CC)C[C@@H]21	ZINC001217986535	1373527244	/nfs/dbraw/zinc/52/72/44/1373527244.db2.gz	JBXFXUSTKLNBPO-YZPMEYCISA-N	0	3	332.488	3.023	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCO[C@@H]2CN(CCC3=CCCCC3)C[C@@H]21	ZINC001218023461	1373540365	/nfs/dbraw/zinc/54/03/65/1373540365.db2.gz	UFPHBQVPSQYIIM-RBUKOAKNSA-N	0	3	346.515	3.391	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)[C@H](C)CCC(C)(C)C)C1	ZINC001130441712	1373540363	/nfs/dbraw/zinc/54/03/63/1373540363.db2.gz	DPMSAYMFDBBAEF-CVEARBPZSA-N	0	3	346.519	3.464	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)[C@H](CCCC)C(C)C)C1	ZINC001130450406	1373544478	/nfs/dbraw/zinc/54/44/78/1373544478.db2.gz	NTPHTPGSQPIXKG-SJLPKXTDSA-N	0	3	346.519	3.464	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)[C@]2(C)CC=C(C)CC2)C1	ZINC001130450594	1373544494	/nfs/dbraw/zinc/54/44/94/1373544494.db2.gz	PQYBTNMWJVMVPL-OXJNMPFZSA-N	0	3	342.487	3.138	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)C2(C)CCC(C)CC2)C1	ZINC001130452311	1373545183	/nfs/dbraw/zinc/54/51/83/1373545183.db2.gz	ATKXEWLADNNTCG-LFDOHDQPSA-N	0	3	344.503	3.218	20	30		EGEDHN
O=C(/C=C/c1ccc(O[C@@H]2CC[C@@H]3NCCO[C@@H]23)cc1)c1ccccc1	ZINC001218127542	1373565947	/nfs/dbraw/zinc/56/59/47/1373565947.db2.gz	SKXTVYITAQPFAM-FYAOESRLSA-N	0	3	349.430	3.481	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)[C@H](C)C(C)(F)F)[C@H]2C1	ZINC001218639814	1373638828	/nfs/dbraw/zinc/63/88/28/1373638828.db2.gz	VKCQNTPXMFCYMJ-HRCADAONSA-N	0	3	346.462	3.160	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)[C@@H]3C[C@H]3CC(C)C)[C@H]2C1	ZINC001218657729	1373641124	/nfs/dbraw/zinc/64/11/24/1373641124.db2.gz	LHNZKDIIUOZEGX-YSTOQKLRSA-N	0	3	348.531	3.327	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)c3cccc(C)c3Cl)[C@H]2C1	ZINC001218804347	1373655870	/nfs/dbraw/zinc/65/58/70/1373655870.db2.gz	WUNYCQYQTKZKRP-DLBZAZTESA-N	0	3	348.874	3.140	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)C[C@H]3CCCCC3(C)C)[C@H]2C1	ZINC001219073273	1373685474	/nfs/dbraw/zinc/68/54/74/1373685474.db2.gz	FYLRZQOAAZAQGW-CEXWTWQISA-N	0	3	348.531	3.471	20	30		EGEDHN
N#Cc1ccc(NC(=O)[C@@H](N)CCCc2ccccc2)c2cccnc12	ZINC001219467710	1373710691	/nfs/dbraw/zinc/71/06/91/1373710691.db2.gz	OMQHQTUMKPRRRE-SFHVURJKSA-N	0	3	344.418	3.395	20	30		EGEDHN
N#C[C@H](NC(=O)C[C@@H](N)c1ccc(C(F)(F)F)cc1)c1ccccc1	ZINC001219558538	1373716387	/nfs/dbraw/zinc/71/63/87/1373716387.db2.gz	QHOBWPRUQQLLIS-CVEARBPZSA-N	0	3	347.340	3.476	20	30		EGEDHN
C=CCCCC(=O)N1CCC([C@@H]2OCC[C@H]2NCC(=C)Cl)CC1	ZINC001131552068	1373719624	/nfs/dbraw/zinc/71/96/24/1373719624.db2.gz	AAXMIZZKMGAIKG-AEFFLSMTSA-N	0	3	340.895	3.081	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](C)O[C@@]2(CCN(Cc3ccccc3)C2)C1	ZINC001131677199	1373758007	/nfs/dbraw/zinc/75/80/07/1373758007.db2.gz	JOFDHFLJTNMMHJ-WIYYLYMNSA-N	0	3	342.483	3.235	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H](C)O[C@]2(CCN(CC=C(C)C)C2)C1	ZINC001131688995	1373764212	/nfs/dbraw/zinc/76/42/12/1373764212.db2.gz	VQKWDNUKUVCWBW-XLIONFOSSA-N	0	3	334.504	3.247	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)[C@H]2CCCC[C@@H]2C2CC2)cc1F	ZINC001131741955	1373780785	/nfs/dbraw/zinc/78/07/85/1373780785.db2.gz	NYOZREQSPRZLBA-MSOLQXFVSA-N	0	3	343.446	3.120	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCCC[C@@H]1CNCC#Cc1ccc(F)cc1	ZINC001326699366	1388285897	/nfs/dbraw/zinc/28/58/97/1388285897.db2.gz	XRDYEISFYUEOIA-QVEXUMCLSA-N	0	3	328.431	3.114	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](NCc3cnc(C)s3)C2)CCCC1	ZINC001188483529	1388316578	/nfs/dbraw/zinc/31/65/78/1388316578.db2.gz	USDITGVBRAUVCZ-OAHLLOKOSA-N	0	3	333.501	3.279	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](NCc3cnccc3C)C2)CCCC1	ZINC001188490568	1388318072	/nfs/dbraw/zinc/31/80/72/1388318072.db2.gz	RTMWDTNLJAMDFX-GOSISDBHSA-N	0	3	327.472	3.217	20	30		EGEDHN
C#CCCCC(=O)NCC1CCN(Cc2cc(C)ccc2OC)CC1	ZINC001223012231	1375029605	/nfs/dbraw/zinc/02/96/05/1375029605.db2.gz	FWXYGFVPRYTGMG-UHFFFAOYSA-N	0	3	342.483	3.135	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CC[C@@H](C)N(CCOC2CCCCCC2)C1	ZINC001131996657	1375089218	/nfs/dbraw/zinc/08/92/18/1375089218.db2.gz	WZFLEJAPGDDQTF-MOPGFXCFSA-N	0	3	348.531	3.498	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H]1CC[C@@H](C)N(Cc2ccc3cc[nH]c3c2)C1	ZINC001132021669	1375102152	/nfs/dbraw/zinc/10/21/52/1375102152.db2.gz	OANOTWTUODBPKE-APWZRJJASA-N	0	3	337.467	3.296	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N[C@@H]2CC[C@H](C)N(CC(=C)C)C2)cc1	ZINC001132041482	1375113114	/nfs/dbraw/zinc/11/31/14/1375113114.db2.gz	FQZOURTYQHEIOH-PKOBYXMFSA-N	0	3	340.467	3.248	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@H](C)Cc2ccccc2C)CC1	ZINC001225604079	1375131410	/nfs/dbraw/zinc/13/14/10/1375131410.db2.gz	TXMLQSAFRLOIPD-GOSISDBHSA-N	0	3	326.484	3.025	20	30		EGEDHN
O=C(C=C1CCC1)N[C@@H]1CCCC[C@H]1NCC#Cc1ccc(F)cc1	ZINC001225621476	1375133090	/nfs/dbraw/zinc/13/30/90/1375133090.db2.gz	BINBLYBZDMALES-WOJBJXKFSA-N	0	3	340.442	3.305	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@H]1CC[C@H](C)N(CCOCC(C)C)C1	ZINC001132079379	1375136280	/nfs/dbraw/zinc/13/62/80/1375136280.db2.gz	XOXXPAWITKKVRN-HOCLYGCPSA-N	0	3	344.927	3.407	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2CC[C@H](C)N(CCOCCC(C)C)C2)CCC1	ZINC001132101781	1375148300	/nfs/dbraw/zinc/14/83/00/1375148300.db2.gz	OITSPYVPUCVRNB-RBUKOAKNSA-N	0	3	348.531	3.212	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H]2CCCC[C@H]2NCC#Cc2ccccc2)co1	ZINC001225844143	1375163184	/nfs/dbraw/zinc/16/31/84/1375163184.db2.gz	ACQNNOHIMZGLIQ-WOJBJXKFSA-N	0	3	336.435	3.270	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CC[C@H](C)N(CCc2ccc(OC)cc2)C1	ZINC001132228076	1375223587	/nfs/dbraw/zinc/22/35/87/1375223587.db2.gz	LTYFTFZUIQWPNJ-FUHWJXTLSA-N	0	3	344.499	3.419	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CC[C@@H](C)N(CCc2scnc2C)C1	ZINC001132235909	1375231665	/nfs/dbraw/zinc/23/16/65/1375231665.db2.gz	VJSOYDLGPZODKJ-NVXWUHKLSA-N	0	3	347.528	3.157	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1CC[C@H](C)N(CCOCC(C)C)C1	ZINC001132240362	1375234774	/nfs/dbraw/zinc/23/47/74/1375234774.db2.gz	FTVXQXKGAFGJQR-RBUKOAKNSA-N	0	3	336.520	3.212	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CC[C@H](C)N(CCc2scnc2C)C1	ZINC001132257469	1375250415	/nfs/dbraw/zinc/25/04/15/1375250415.db2.gz	WHJOUVSDAHDOIU-GOEBONIOSA-N	0	3	335.517	3.319	20	30		EGEDHN
Cc1cc(C(=O)NCCNCc2cccc(C#N)c2)c(C)cc1Cl	ZINC001132268446	1375256442	/nfs/dbraw/zinc/25/64/42/1375256442.db2.gz	HKQFKOGVYUTLDI-UHFFFAOYSA-N	0	3	341.842	3.348	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CCCC[C@H]1N[C@@H](C)c1cnc(C)cn1	ZINC001226481112	1375265425	/nfs/dbraw/zinc/26/54/25/1375265425.db2.gz	AUUBXJVABGGVNJ-GVDBMIGSSA-N	0	3	344.503	3.465	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COc2ccsc2Cl)CC[C@@H]1C	ZINC001132344058	1375323007	/nfs/dbraw/zinc/32/30/07/1375323007.db2.gz	LTACEAGQIRQDCY-QWHCGFSZSA-N	0	3	342.892	3.326	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2(Cc3ccccc3F)CC2)CC[C@H]1C	ZINC001132346194	1375323919	/nfs/dbraw/zinc/32/39/19/1375323919.db2.gz	VXAXVICVFBQLTM-AEFFLSMTSA-N	0	3	342.458	3.141	20	30		EGEDHN
C#CCCCCC(=O)NC1CCN(Cc2ccc(COC)cc2)CC1	ZINC001226952201	1375368606	/nfs/dbraw/zinc/36/86/06/1375368606.db2.gz	VGTXHZYUCUBEKG-UHFFFAOYSA-N	0	3	342.483	3.107	20	30		EGEDHN
C#CCCCCC(=O)NC1CCN(Cc2cccc(OC)c2C)CC1	ZINC001226962080	1375372564	/nfs/dbraw/zinc/37/25/64/1375372564.db2.gz	ZTOZMFQCEQYHNZ-UHFFFAOYSA-N	0	3	342.483	3.278	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2ccc(C)cc2C)CC[C@H]1C	ZINC001132458185	1375401512	/nfs/dbraw/zinc/40/15/12/1375401512.db2.gz	QXZFZINJAVNJKE-QZTJIDSGSA-N	0	3	330.472	3.089	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCCOc2cccc(C)c2)CC[C@H]1C	ZINC001132462019	1375404578	/nfs/dbraw/zinc/40/45/78/1375404578.db2.gz	VCQFVXMFPMQVJM-QZTJIDSGSA-N	0	3	330.472	3.309	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COc2cccc(CC)c2)CC[C@H]1C	ZINC001132469007	1375410396	/nfs/dbraw/zinc/41/03/96/1375410396.db2.gz	PVKHUHLRRDAWHD-AEFFLSMTSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCOc2ccccc2F)CC[C@@H]1C	ZINC001132472114	1375412069	/nfs/dbraw/zinc/41/20/69/1375412069.db2.gz	BKTWRJVUJCKRJM-JKSUJKDBSA-N	0	3	334.435	3.140	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCn2ccc3ccccc32)CC[C@H]1C	ZINC001132469959	1375412158	/nfs/dbraw/zinc/41/21/58/1375412158.db2.gz	ZGHUMKDGPCBZEO-SJLPKXTDSA-N	0	3	325.456	3.187	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCCc2nc(C(C)C)no2)CC[C@H]1C	ZINC001132486927	1375420957	/nfs/dbraw/zinc/42/09/57/1375420957.db2.gz	QFOSSGMKPFAWTQ-CVEARBPZSA-N	0	3	348.491	3.061	20	30		EGEDHN
C=CCCCN1C[C@H](NC(=O)c2scnc2Cl)CC[C@@H]1C	ZINC001132489976	1375422370	/nfs/dbraw/zinc/42/23/70/1375422370.db2.gz	PMDGYWMDZDJHHH-NWDGAFQWSA-N	0	3	327.881	3.345	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2cc(C)c(F)c(C)c2)CC[C@@H]1C	ZINC001132490673	1375422807	/nfs/dbraw/zinc/42/28/07/1375422807.db2.gz	XBWGRXGROZTHTR-WMZOPIPTSA-N	0	3	348.462	3.228	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCCOc2ccccc2F)CC[C@@H]1C	ZINC001132504476	1375429525	/nfs/dbraw/zinc/42/95/25/1375429525.db2.gz	JKCXVLCEMLJYCG-HOTGVXAUSA-N	0	3	334.435	3.140	20	30		EGEDHN
C[C@@H](CC(F)F)C(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1	ZINC001227582970	1375447337	/nfs/dbraw/zinc/44/73/37/1375447337.db2.gz	OCTGQRZGUGFLSQ-CGTJXYLNSA-N	0	3	348.437	3.346	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CC(F)(F)C(F)(F)F)CC[C@H]1C	ZINC001132541121	1375448518	/nfs/dbraw/zinc/44/85/18/1375448518.db2.gz	ADPBVSXSHBDQCY-GHMZBOCLSA-N	0	3	328.325	3.119	20	30		EGEDHN
C#CCN1CC[C@H](CN(Cc2scnc2C)C(=O)/C=C(\C)CC)C1	ZINC001132563266	1375469228	/nfs/dbraw/zinc/46/92/28/1375469228.db2.gz	QBQGDBCWWDNDOO-OBHPCNEJSA-N	0	3	345.512	3.092	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCNCc1ccc(Br)s1	ZINC001132577302	1375473705	/nfs/dbraw/zinc/47/37/05/1375473705.db2.gz	SJHMUEZJLMIZSG-QWRGUYRKSA-N	0	3	345.306	3.175	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CCCC[C@H]1N[C@@H](C)c1cnc(C)cn1	ZINC001227925560	1375492025	/nfs/dbraw/zinc/49/20/25/1375492025.db2.gz	MASJTCIVBXNFCL-GVDBMIGSSA-N	0	3	344.503	3.465	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](C)[C@@H](CNCc2ncc(C)s2)C1	ZINC001132865443	1375609022	/nfs/dbraw/zinc/60/90/22/1375609022.db2.gz	NAFJCPOSFGQVCK-ZBFHGGJFSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC1CCN(CCOc2cccc(F)c2)CC1	ZINC001228596617	1375609644	/nfs/dbraw/zinc/60/96/44/1375609644.db2.gz	KCTSTBCCPLFCKK-UHFFFAOYSA-N	0	3	348.462	3.387	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](C)[C@H](CNCc2ccccc2C#N)C1	ZINC001132865816	1375610580	/nfs/dbraw/zinc/61/05/80/1375610580.db2.gz	SKVIWUGIUAZDCT-FXAWDEMLSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NC1CCN(CCc2scnc2C)CC1	ZINC001228749105	1375662483	/nfs/dbraw/zinc/66/24/83/1375662483.db2.gz	POCRAJBJXHRVCV-ZIAGYGMSSA-N	0	3	335.517	3.033	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NC1CCN(CCOc2ccc(C)cc2)CC1	ZINC001228750123	1375663590	/nfs/dbraw/zinc/66/35/90/1375663590.db2.gz	WLAKCURNLHXESN-QZTJIDSGSA-N	0	3	344.499	3.413	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC1CCN(C[C@H](O)c2ccc(F)cc2)CC1	ZINC001228795173	1375678957	/nfs/dbraw/zinc/67/89/57/1375678957.db2.gz	RXGOBGUNMGPWAE-KXBFYZLASA-N	0	3	348.462	3.042	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC1CCN(Cc2ccc3c(c2)COC3)CC1	ZINC001228809134	1375682928	/nfs/dbraw/zinc/68/29/28/1375682928.db2.gz	FJMNNYKEZHKGSP-MRXNPFEDSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](C)[C@H](CNCc2ccccc2C#N)C1	ZINC001133090899	1375769026	/nfs/dbraw/zinc/76/90/26/1375769026.db2.gz	LPZZTQOJUVOQKM-FXAWDEMLSA-N	0	3	339.483	3.489	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)c2ccc(F)c(Cl)c2)ccc1F	ZINC001133097116	1375772260	/nfs/dbraw/zinc/77/22/60/1375772260.db2.gz	OCOHDWVUOLIVNW-UHFFFAOYSA-N	0	3	349.768	3.009	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@H](C)[C@@H](CNCc3cscn3)C2)CC1	ZINC001133105541	1375777855	/nfs/dbraw/zinc/77/78/55/1375777855.db2.gz	VCTQKIRZYHMDMX-HOTGVXAUSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](C)[C@H](CNCc2nccn2CC)C1	ZINC001133142861	1375803606	/nfs/dbraw/zinc/80/36/06/1375803606.db2.gz	PSGIMDYFWKENGR-IAGOWNOFSA-N	0	3	346.519	3.080	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](C)[C@H](CNCc2nccs2)C1	ZINC001133142224	1375804290	/nfs/dbraw/zinc/80/42/90/1375804290.db2.gz	MHQAPDVSHRGJLJ-LSDHHAIUSA-N	0	3	335.517	3.320	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](C)[C@@H](CNCc2cnc(C)o2)C1	ZINC001133143715	1375805464	/nfs/dbraw/zinc/80/54/64/1375805464.db2.gz	WZEAEICIRPMJRE-HOCLYGCPSA-N	0	3	333.476	3.160	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)CCCCc2ccccc2)s1	ZINC001133209170	1375842655	/nfs/dbraw/zinc/84/26/55/1375842655.db2.gz	XPSNUYQUQATJFF-UHFFFAOYSA-N	0	3	341.480	3.239	20	30		EGEDHN
C=CCCC1(C(=O)NCCN[C@@H]2CCc3c2cc(F)cc3F)CC1	ZINC001133368815	1375951055	/nfs/dbraw/zinc/95/10/55/1375951055.db2.gz	IJRTZOYCWUWJIN-QGZVFWFLSA-N	0	3	334.410	3.404	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1ccccc1F	ZINC001133376847	1375956252	/nfs/dbraw/zinc/95/62/52/1375956252.db2.gz	DNYUDALMJXZDJG-UHFFFAOYSA-N	0	3	344.817	3.344	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1occc1C	ZINC001133379745	1375959012	/nfs/dbraw/zinc/95/90/12/1375959012.db2.gz	DCRWFTFJZLJBAB-UHFFFAOYSA-N	0	3	330.815	3.107	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1ccoc1CC	ZINC001133396119	1375980510	/nfs/dbraw/zinc/98/05/10/1375980510.db2.gz	RTLBABJBGYYYEI-UHFFFAOYSA-N	0	3	344.842	3.361	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@](C)(C=C)CC	ZINC001133403647	1375988305	/nfs/dbraw/zinc/98/83/05/1375988305.db2.gz	CCYQKJLFFCGAGE-IBGZPJMESA-N	0	3	332.875	3.494	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)CCCC#CC	ZINC001133403770	1375988383	/nfs/dbraw/zinc/98/83/83/1375988383.db2.gz	HWQOBMLNTMYSLJ-UHFFFAOYSA-N	0	3	330.859	3.085	20	30		EGEDHN
C=CC(C)(C)C(=O)N(CCNCC#CC)Cc1cccc(Cl)c1	ZINC001133404107	1375990072	/nfs/dbraw/zinc/99/00/72/1375990072.db2.gz	YENMAQAICJRONK-UHFFFAOYSA-N	0	3	332.875	3.494	20	30		EGEDHN
C#CCC1(C(=O)NC2CCN(CCOC3CCC3)CC2)CCCCC1	ZINC001230404556	1376020714	/nfs/dbraw/zinc/02/07/14/1376020714.db2.gz	JUSXAVIHKJHZJY-UHFFFAOYSA-N	0	3	346.515	3.110	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NC1CCN([C@H](C)c2cccc(F)c2)CC1	ZINC001230415762	1376024022	/nfs/dbraw/zinc/02/40/22/1376024022.db2.gz	YHJIUGZTKUAWNC-HUUCEWRRSA-N	0	3	334.435	3.058	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)/C=C/c1ccco1	ZINC001133516166	1376051596	/nfs/dbraw/zinc/05/15/96/1376051596.db2.gz	XAGTVFLGBWYLQT-VWWYUBIBSA-N	0	3	341.249	3.074	20	30		EGEDHN
C=CCCC(=O)N1CCC([C@H]2CCCN2Cc2nocc2C)CC1	ZINC001230537756	1376060690	/nfs/dbraw/zinc/06/06/90/1376060690.db2.gz	JSRAQROONCHDBM-GOSISDBHSA-N	0	3	331.460	3.152	20	30		EGEDHN
C#CCCN(CCCNC(=O)[C@H]1CCCC[C@H]1C)Cc1cccnc1	ZINC001230829328	1376161763	/nfs/dbraw/zinc/16/17/63/1376161763.db2.gz	FLRICUNBBMXVJW-QUCCMNQESA-N	0	3	341.499	3.240	20	30		EGEDHN
C#CCCN(CCCNC(=O)CC(CC)CC)Cc1cccnc1	ZINC001230882025	1376176759	/nfs/dbraw/zinc/17/67/59/1376176759.db2.gz	LMSJGHDIZPIRJA-UHFFFAOYSA-N	0	3	329.488	3.240	20	30		EGEDHN
Cc1ccc2ccccc2c1CN1CC[C@@H]1CN(C)C(=O)[C@H](C)C#N	ZINC001231284797	1376221860	/nfs/dbraw/zinc/22/18/60/1376221860.db2.gz	WKGCGHIRRANOIJ-SJLPKXTDSA-N	0	3	335.451	3.341	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H]2CN(Cc3sc(C)nc3C)C[C@H]21	ZINC001188999397	1388432059	/nfs/dbraw/zinc/43/20/59/1388432059.db2.gz	NBJFYIPBLVAHFG-JKSUJKDBSA-N	0	3	333.501	3.149	20	30		EGEDHN
C=CCOC[C@H]1CCC[C@@]12CN(Cc1cccc(C)c1O)CCO2	ZINC001231592561	1376273871	/nfs/dbraw/zinc/27/38/71/1376273871.db2.gz	IVMYTRWQHLJMBK-UYAOXDASSA-N	0	3	331.456	3.274	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H]2CN(CCOc3cccc(C)c3)C[C@H]21	ZINC001189006931	1388434357	/nfs/dbraw/zinc/43/43/57/1388434357.db2.gz	MXFVNHJHJWGJJE-AZUAARDMSA-N	0	3	342.483	3.263	20	30		EGEDHN
C#CCCCCC(=O)N[C@H](C)C[C@H](C)NCc1nc(C)c(C)s1	ZINC001134113205	1376373606	/nfs/dbraw/zinc/37/36/06/1376373606.db2.gz	ALFDUYSVEULHGK-UONOGXRCSA-N	0	3	335.517	3.326	20	30		EGEDHN
C#CCCCCC(=O)N[C@H](C)C[C@@H](C)NCc1nc(C)sc1C	ZINC001134119173	1376377073	/nfs/dbraw/zinc/37/70/73/1376377073.db2.gz	MSWVOXYNFDMHFE-ZIAGYGMSSA-N	0	3	335.517	3.326	20	30		EGEDHN
C=CCOC[C@@H]1CCC[C@@]12CN(Cc1cc3c[nH]ccc-3n1)CCO2	ZINC001232014948	1376384269	/nfs/dbraw/zinc/38/42/69/1376384269.db2.gz	PGMCVOMHSYVMPM-FXAWDEMLSA-N	0	3	341.455	3.137	20	30		EGEDHN
C=CCOC[C@@H]1CCC[C@@]12CN(Cc1cc3cnccc3[nH]1)CCO2	ZINC001232014948	1376384276	/nfs/dbraw/zinc/38/42/76/1376384276.db2.gz	PGMCVOMHSYVMPM-FXAWDEMLSA-N	0	3	341.455	3.137	20	30		EGEDHN
CC(C)N1CCC2(CCN(Cc3ccc(C#N)c(Cl)c3)CC2)C1=O	ZINC001232118433	1376403726	/nfs/dbraw/zinc/40/37/26/1376403726.db2.gz	MCVUWIHHXZACPB-UHFFFAOYSA-N	0	3	345.874	3.435	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)C#CC(C)(C)C)NCc1ccncc1Cl	ZINC001134330208	1376480620	/nfs/dbraw/zinc/48/06/20/1376480620.db2.gz	XJLUYVMAVUCJGV-KGLIPLIRSA-N	0	3	335.879	3.157	20	30		EGEDHN
COC(=O)[C@H](c1ccccc1)[C@H]1CCCCN1Cc1cccc(C#N)n1	ZINC001232926440	1376538659	/nfs/dbraw/zinc/53/86/59/1376538659.db2.gz	PDSLBPSQKVVXRA-WOJBJXKFSA-N	0	3	349.434	3.265	20	30		EGEDHN
C=CCOC(=O)N1CC2(C1)CCN(Cc1ccc3ncoc3c1)CC2	ZINC001232938034	1376540908	/nfs/dbraw/zinc/54/09/08/1376540908.db2.gz	NKRFTVJVYSZFFW-UHFFFAOYSA-N	0	3	341.411	3.048	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H](C)C[C@H](C)NCc1ncc(Cl)n1C	ZINC001134454361	1376546540	/nfs/dbraw/zinc/54/65/40/1376546540.db2.gz	VXOPRCVIXOBHSV-QWHCGFSZSA-N	0	3	340.899	3.049	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CC[C@H]2[C@@H]1CCN2C(=O)OC(C)(C)C	ZINC001233080065	1376567174	/nfs/dbraw/zinc/56/71/74/1376567174.db2.gz	CMAKNQRPIJOFDW-ROUUACIJSA-N	0	3	341.455	3.450	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)C1(C2CC2)CC1)NCc1ccccc1C#N	ZINC001134694417	1376664961	/nfs/dbraw/zinc/66/49/61/1376664961.db2.gz	RKAPBCOKRYNXMF-CABCVRRESA-N	0	3	325.456	3.121	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1cc(F)ccc1C#N)NC(=O)C1(C2CC2)CC1	ZINC001134694511	1376665314	/nfs/dbraw/zinc/66/53/14/1376665314.db2.gz	SWOKFEUAMINOSO-UONOGXRCSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=CCC[C@H](C)N1CC[C@@H]1CN(C)C(=O)c1coc(C(C)(C)C)n1	ZINC001234265090	1376794718	/nfs/dbraw/zinc/79/47/18/1376794718.db2.gz	HBODPBXIXBQDJH-LSDHHAIUSA-N	0	3	333.476	3.473	20	30		EGEDHN
C[C@H](CC(=O)NCCNCc1ccc(C#N)s1)C1CCCCC1	ZINC001135227641	1376987565	/nfs/dbraw/zinc/98/75/65/1376987565.db2.gz	JBRBFHSJTXNWDQ-CQSZACIVSA-N	0	3	333.501	3.432	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H](C)C[C@H](C)NCc1nc2ccccc2o1	ZINC001135229457	1376988924	/nfs/dbraw/zinc/98/89/24/1376988924.db2.gz	ANIBKBQIEMEFFK-UONOGXRCSA-N	0	3	329.444	3.413	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H](C)C[C@@H](C)NCc1ccn(C(C)C)n1	ZINC001135230631	1376990331	/nfs/dbraw/zinc/99/03/31/1376990331.db2.gz	PRFWHQZKERFLAI-SJORKVTESA-N	0	3	332.492	3.031	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)C(C)(C)C1CC1	ZINC001135252390	1377003040	/nfs/dbraw/zinc/00/30/40/1377003040.db2.gz	RSLZGKXRTPQBMJ-NWDGAFQWSA-N	0	3	331.298	3.204	20	30		EGEDHN
Cc1nc(C(=O)N[C@H](C)C[C@H](C)NCc2ccccc2C#N)cs1	ZINC001135275394	1377017101	/nfs/dbraw/zinc/01/71/01/1377017101.db2.gz	XIPFSHSANZBTAC-QWHCGFSZSA-N	0	3	342.468	3.010	20	30		EGEDHN
C=CCCCC(=O)N[C@H](C)C[C@@H](C)NCc1nccn1C(F)F	ZINC001135353202	1377049102	/nfs/dbraw/zinc/04/91/02/1377049102.db2.gz	DDIJYQWNNYOOSY-CHWSQXEVSA-N	0	3	328.407	3.007	20	30		EGEDHN
C=CCCCC(=O)N[C@H](C)C[C@H](C)NCc1nc2ccccc2n1C	ZINC001135358041	1377050710	/nfs/dbraw/zinc/05/07/10/1377050710.db2.gz	LRZBGGWTGIBSKD-JKSUJKDBSA-N	0	3	342.487	3.303	20	30		EGEDHN
C=CCCCC(=O)N[C@@H](C)C[C@H](C)NCc1cc(F)ccc1C#N	ZINC001135358367	1377051564	/nfs/dbraw/zinc/05/15/64/1377051564.db2.gz	QYSUUDNBEUHNDU-GJZGRUSLSA-N	0	3	331.435	3.427	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)C1(CCC)CC1	ZINC001135401827	1377075596	/nfs/dbraw/zinc/07/55/96/1377075596.db2.gz	JVKGOWBIGWQETF-CHWSQXEVSA-N	0	3	331.298	3.348	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)c1ccc(Cl)[nH]1)NCc1ccccc1C#N	ZINC001135435832	1377097262	/nfs/dbraw/zinc/09/72/62/1377097262.db2.gz	WTGUCDVVNAHYHJ-OLZOCXBDSA-N	0	3	344.846	3.226	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H](C)C[C@H](C)NCC(=C)Br	ZINC001135560140	1377144196	/nfs/dbraw/zinc/14/41/96/1377144196.db2.gz	BYLQXDGRLRJVII-STQMWFEESA-N	0	3	331.298	3.370	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H](C)C[C@@H](C)NCc1ncc(Cl)n1C	ZINC001135560969	1377144907	/nfs/dbraw/zinc/14/49/07/1377144907.db2.gz	NTRWNQFZVYUDIB-CHWSQXEVSA-N	0	3	340.899	3.049	20	30		EGEDHN
CC1(C)C[C@]1(C(=O)NCCNCc1cccc(C#N)c1)c1ccccc1	ZINC001135650429	1377175529	/nfs/dbraw/zinc/17/55/29/1377175529.db2.gz	PCIDVHYJMFZSHO-JOCHJYFZSA-N	0	3	347.462	3.132	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)CCC1(C)CC1	ZINC001135840516	1377228972	/nfs/dbraw/zinc/22/89/72/1377228972.db2.gz	KEBZAUXTDMDYTR-CHWSQXEVSA-N	0	3	331.298	3.348	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C2(CC)CCCCC2)C1	ZINC001266640531	1377356615	/nfs/dbraw/zinc/35/66/15/1377356615.db2.gz	XGOSFNUDKHLHTL-HDJSIYSDSA-N	0	3	343.309	3.492	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3c[nH]c4c3cccc4F)C2)C1=O	ZINC001137053102	1377468651	/nfs/dbraw/zinc/46/86/51/1377468651.db2.gz	YCIXHKGGXJAPJN-HXUWFJFHSA-N	0	3	341.430	3.308	20	30		EGEDHN
C[C@H]1CN(Cc2ccc(OCC#N)cc2)CCC[C@]1(O)C(F)(F)F	ZINC001137115317	1377481269	/nfs/dbraw/zinc/48/12/69/1377481269.db2.gz	IJCTXDXZQYNCDL-XJKSGUPXSA-N	0	3	342.361	3.114	20	30		EGEDHN
Cc1ccnc(O[C@H]2CCCN(Cc3ccc(OCC#N)cc3)C2)c1	ZINC001137122558	1377481972	/nfs/dbraw/zinc/48/19/72/1377481972.db2.gz	HHBVZJUDEAGGGN-IBGZPJMESA-N	0	3	337.423	3.336	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)C2(C(F)(F)F)CCC2)CCCC1	ZINC001268045056	1377483564	/nfs/dbraw/zinc/48/35/64/1377483564.db2.gz	GTLOEHKUCNFRSR-UHFFFAOYSA-N	0	3	338.801	3.490	20	30		EGEDHN
CCCCC(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001268260885	1377503582	/nfs/dbraw/zinc/50/35/82/1377503582.db2.gz	AIQHDJSGBJEBKU-WMLDXEAASA-N	0	3	331.485	3.233	20	30		EGEDHN
N#Cc1ccc(N2CCCN(Cc3c[nH]c4ccc(F)cc34)CC2)nc1	ZINC001137339956	1377524898	/nfs/dbraw/zinc/52/48/98/1377524898.db2.gz	KVLQNUQCVQTPTH-UHFFFAOYSA-N	0	3	349.413	3.286	20	30		EGEDHN
C#CCOc1ccc(CN(C)C[C@H]2Cc3ccccc3O2)cc1OC	ZINC001138346982	1377707407	/nfs/dbraw/zinc/70/74/07/1377707407.db2.gz	BSVIXTVGFSQWCY-GOSISDBHSA-N	0	3	337.419	3.143	20	30		EGEDHN
C#CCOc1ccc(CN2CCC3(CCCCN3C(C)=O)CC2)cc1	ZINC001138559647	1377741905	/nfs/dbraw/zinc/74/19/05/1377741905.db2.gz	ZPOXUEROXINAHQ-UHFFFAOYSA-N	0	3	340.467	3.066	20	30		EGEDHN
C=CCN1C(=O)CCC[C@]12CCCN(Cc1cnc3[nH]ccc3c1)C2	ZINC001138744917	1377779395	/nfs/dbraw/zinc/77/93/95/1377779395.db2.gz	YORUQCBFEDBLOR-HXUWFJFHSA-N	0	3	338.455	3.096	20	30		EGEDHN
O=C1C=C2CN(Cc3cc(F)cc(Br)c3)CCC2S1	ZINC001139174576	1377843689	/nfs/dbraw/zinc/84/36/89/1377843689.db2.gz	ZKKAZHOLTGRKSN-CYBMUJFWSA-N	0	3	342.233	3.362	20	30		EGEDHN
CCCCc1nc(Cl)c(CN2CCC3SC(=O)C=C3C2)[nH]1	ZINC001139178578	1377844347	/nfs/dbraw/zinc/84/43/47/1377844347.db2.gz	VUSQSNYHIRSFGJ-LBPRGKRZSA-N	0	3	325.865	3.180	20	30		EGEDHN
N#Cc1ccc(Oc2ccc(CN3CC[C@@H]4OCC[C@H]4C3)cn2)cc1	ZINC001139427685	1377882197	/nfs/dbraw/zinc/88/21/97/1377882197.db2.gz	NQFUBEOSIAXBBC-HKUYNNGSSA-N	0	3	335.407	3.356	20	30		EGEDHN
N#Cc1ccc(Oc2ccc(CN3CCN(C4CCC4)CC3)cn2)cc1	ZINC001139424945	1377882290	/nfs/dbraw/zinc/88/22/90/1377882290.db2.gz	XCAWSSJUZVGUBI-UHFFFAOYSA-N	0	3	348.450	3.416	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3ccc(Cl)c(OC)c3)C2)C1=O	ZINC001139613499	1377917930	/nfs/dbraw/zinc/91/79/30/1377917930.db2.gz	WBQRXLGTIOWMMM-LJQANCHMSA-N	0	3	348.874	3.349	20	30		EGEDHN
C=CCO[C@@H]1CO[C@@]2(C1)CCCN(Cc1ccc(COC)s1)C2	ZINC001139830759	1377958258	/nfs/dbraw/zinc/95/82/58/1377958258.db2.gz	XCSGZDGPYSNXBN-MAUKXSAKSA-N	0	3	337.485	3.221	20	30		EGEDHN
COc1ccc(CCN(Cc2ccc(C#N)cc2F)C[C@H](C)O)cc1	ZINC001140135284	1378016563	/nfs/dbraw/zinc/01/65/63/1378016563.db2.gz	ZMNAYOTWUFTFTB-HNNXBMFYSA-N	0	3	342.414	3.131	20	30		EGEDHN
N#Cc1ccccc1OC1CCN(Cc2ccc3n[nH]cc3c2)CC1	ZINC001140388578	1378055927	/nfs/dbraw/zinc/05/59/27/1378055927.db2.gz	YAOCGUKZBUNGAI-UHFFFAOYSA-N	0	3	332.407	3.478	20	30		EGEDHN
C[C@H](CNC(=O)c1cccc2cc[nH]c21)N(C)Cc1ccc(C#N)cc1	ZINC001275936769	1378164003	/nfs/dbraw/zinc/16/40/03/1378164003.db2.gz	VWTIJAPAXSXQMA-OAHLLOKOSA-N	0	3	346.434	3.290	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@@H]1CCN(Cc1cnc(CCCC)[nH]1)C2	ZINC001141068224	1378226026	/nfs/dbraw/zinc/22/60/26/1378226026.db2.gz	BCELKKSZYGYOKB-QUCCMNQESA-N	0	3	347.503	3.326	20	30		EGEDHN
Cc1cccnc1N1CCC[C@@]2(CCN(Cc3cc(C#N)n(C)c3)C2)C1	ZINC001280101428	1378328013	/nfs/dbraw/zinc/32/80/13/1378328013.db2.gz	FXUPBJMYVWPXLL-NRFANRHFSA-N	0	3	349.482	3.093	20	30		EGEDHN
C=CCN1C(=O)CCC[C@]12CCCN(Cc1cc3cccnc3[nH]1)C2	ZINC001143214602	1378561873	/nfs/dbraw/zinc/56/18/73/1378561873.db2.gz	PVVQEOKDUZBABI-HXUWFJFHSA-N	0	3	338.455	3.096	20	30		EGEDHN
CN(Cc1cncc(C#N)c1)CC1CCN(C(=O)OC(C)(C)C)CC1	ZINC001144076014	1378679860	/nfs/dbraw/zinc/67/98/60/1378679860.db2.gz	XWZNCMVEZXCXKL-UHFFFAOYSA-N	0	3	344.459	3.032	20	30		EGEDHN
C#Cc1ccc(CN2CCC3(CC2)NC(=O)Nc2ccccc23)cc1	ZINC001144576973	1378747564	/nfs/dbraw/zinc/74/75/64/1378747564.db2.gz	ZAONGMLUYPLRHM-UHFFFAOYSA-N	0	3	331.419	3.294	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1ccccc1C#N)NC(=O)c1ccc(F)s1	ZINC001146735630	1378910898	/nfs/dbraw/zinc/91/08/98/1378910898.db2.gz	PGSCCVIEBAVVQJ-QWHCGFSZSA-N	0	3	345.443	3.446	20	30		EGEDHN
C#CCCCC(=O)N1CC2(C1)CCN(Cc1cc3ccccc3o1)C2	ZINC001147440162	1379022212	/nfs/dbraw/zinc/02/22/12/1379022212.db2.gz	KKNHGSUDXPMBBO-UHFFFAOYSA-N	0	3	336.435	3.271	20	30		EGEDHN
C#CCCCC(=O)N1CC2(C1)CCN([C@@H](C)c1ccc(F)cc1)C2	ZINC001147461973	1379025086	/nfs/dbraw/zinc/02/50/86/1379025086.db2.gz	JYNUYZWRNKGUSB-INIZCTEOSA-N	0	3	328.431	3.225	20	30		EGEDHN
CCCC[C@H](C)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001147467014	1379027451	/nfs/dbraw/zinc/02/74/51/1379027451.db2.gz	BJUVSMWRBXCEHU-KRWDZBQOSA-N	0	3	339.483	3.419	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2ccc(C3CC3)s2)c1	ZINC001147739082	1379069580	/nfs/dbraw/zinc/06/95/80/1379069580.db2.gz	PWTIHMYEJMHVHO-UHFFFAOYSA-N	0	3	325.437	3.017	20	30		EGEDHN
C=CCCCC(=O)N1CC2(C1)CCN(CC[C@H]1CC1(Cl)Cl)C2	ZINC001148199670	1379133052	/nfs/dbraw/zinc/13/30/52/1379133052.db2.gz	OYTHMEWXBZOUHE-AWEZNQCLSA-N	0	3	345.314	3.461	20	30		EGEDHN
C=CCC1(C(=O)N2CC3(C2)CCN(Cc2cnccc2C)C3)CCC1	ZINC001148226718	1379136124	/nfs/dbraw/zinc/13/61/24/1379136124.db2.gz	PORHHLZRNZZFIN-UHFFFAOYSA-N	0	3	339.483	3.171	20	30		EGEDHN
CCCCCCCCC(=O)NCCN[C@H](C)C(=O)NC(CC)CC	ZINC001148727991	1379255229	/nfs/dbraw/zinc/25/52/29/1379255229.db2.gz	RAUQSRSVSFSNNU-MRXNPFEDSA-N	0	3	341.540	3.136	20	30		EGEDHN
CC(C)(C)c1ccc(C(=O)NCCNCc2ccc(C#N)cc2)cc1	ZINC001148751957	1379260529	/nfs/dbraw/zinc/26/05/29/1379260529.db2.gz	UVDYLAWDVUNVFY-UHFFFAOYSA-N	0	3	335.451	3.375	20	30		EGEDHN
CC(C)Oc1ccc(C(=O)NCCc2cnc3cc[nH]cc2-3)cc1C#N	ZINC001148777568	1379266074	/nfs/dbraw/zinc/26/60/74/1379266074.db2.gz	LWNYPARJBMDAMZ-UHFFFAOYSA-N	0	3	348.406	3.194	20	30		EGEDHN
CC(C)Oc1ccc(C(=O)NCCc2c[nH]c3ccncc23)cc1C#N	ZINC001148777568	1379266075	/nfs/dbraw/zinc/26/60/75/1379266075.db2.gz	LWNYPARJBMDAMZ-UHFFFAOYSA-N	0	3	348.406	3.194	20	30		EGEDHN
CCCCCCCCCC(=O)NCCN[C@H](C)C(=O)NCCCC	ZINC001148825746	1379277104	/nfs/dbraw/zinc/27/71/04/1379277104.db2.gz	KWNZYFPEBNREAU-QGZVFWFLSA-N	0	3	341.540	3.138	20	30		EGEDHN
CCCCCCCCCC(=O)NCCN[C@H](C)C(=O)N(CC)CC	ZINC001148827048	1379277509	/nfs/dbraw/zinc/27/75/09/1379277509.db2.gz	UDYJLXSZBDOAIM-QGZVFWFLSA-N	0	3	341.540	3.090	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)CCC(C)(C)c3ccccc3)C2)C1	ZINC001148893653	1379292543	/nfs/dbraw/zinc/29/25/43/1379292543.db2.gz	RJPKGDMDITYKMJ-UHFFFAOYSA-N	0	3	326.484	3.465	20	30		EGEDHN
C#CCCCC(=O)NC[C@H]1CN([C@@H](C)c2cccc(C)c2)CCCO1	ZINC001149646471	1379418634	/nfs/dbraw/zinc/41/86/34/1379418634.db2.gz	NIFBUCACYOMUHJ-ICSRJNTNSA-N	0	3	342.483	3.067	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)c1cc(Cl)nc2ccccc21	ZINC001149670201	1379424556	/nfs/dbraw/zinc/42/45/56/1379424556.db2.gz	IZCJEBRQACRVMY-ZDUSSCGKSA-N	0	3	329.831	3.268	20	30		EGEDHN
C[C@@H](CC(=O)NCCNCc1ccc(F)c(C#N)c1)c1ccccc1	ZINC001149980651	1379478088	/nfs/dbraw/zinc/47/80/88/1379478088.db2.gz	UYMPJNVEDUXEEP-HNNXBMFYSA-N	0	3	339.414	3.097	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@@H]1CN(Cc2cccc(C)c2)CCCO1	ZINC001150138810	1379501037	/nfs/dbraw/zinc/50/10/37/1379501037.db2.gz	FXRFMYUXUDQLDL-AZUAARDMSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@@H]1CN(CC2=CCCCC2)CCCO1	ZINC001150247883	1379523520	/nfs/dbraw/zinc/52/35/20/1379523520.db2.gz	RFSPFXYVBCHEKX-UYAOXDASSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)C[C@@H](C)c2ccccc2F)C1	ZINC001150445202	1379553809	/nfs/dbraw/zinc/55/38/09/1379553809.db2.gz	SYMJUFYNALGDAD-SJORKVTESA-N	0	3	348.462	3.103	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)C(F)=C2CCCC2)CC1	ZINC001151080246	1379659055	/nfs/dbraw/zinc/65/90/55/1379659055.db2.gz	ODOHCFTYFMWEIZ-UHFFFAOYSA-N	0	3	338.467	3.347	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)C[C@H]2CCC[C@@H]2C)CC1	ZINC001151131931	1379664922	/nfs/dbraw/zinc/66/49/22/1379664922.db2.gz	JUDLDTROLQBIDM-ZWKOTPCHSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@H]2CCC[C@@H](C)C2)CC1	ZINC001151281264	1379691818	/nfs/dbraw/zinc/69/18/18/1379691818.db2.gz	IFPNCWQLPWWCKU-MSOLQXFVSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@H](C)[C@H](C)C(C)(C)C)CC1	ZINC001151357028	1379705185	/nfs/dbraw/zinc/70/51/85/1379705185.db2.gz	OBJSXXPUKFXBEG-SJORKVTESA-N	0	3	338.536	3.478	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2cc(C)c(CC)o2)CC1	ZINC001151398696	1379711086	/nfs/dbraw/zinc/71/10/86/1379711086.db2.gz	DXDPTDDFSQCNIA-UHFFFAOYSA-N	0	3	348.487	3.327	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2cc(C)c(F)c(C)c2)CC1	ZINC001151410150	1379713161	/nfs/dbraw/zinc/71/31/61/1379713161.db2.gz	RKTLEUYMSITOHP-UHFFFAOYSA-N	0	3	348.462	3.229	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)c1ccc(F)cc1	ZINC001151572483	1379740243	/nfs/dbraw/zinc/74/02/43/1379740243.db2.gz	RMMQKCJMFHPJIB-OAHLLOKOSA-N	0	3	339.414	3.338	20	30		EGEDHN
C[C@H](NCCNC(=O)CC#Cc1ccccc1)c1ccc(F)c(F)c1	ZINC001151958999	1379825935	/nfs/dbraw/zinc/82/59/35/1379825935.db2.gz	WNKZLUNMEIAKEK-HNNXBMFYSA-N	0	3	342.389	3.173	20	30		EGEDHN
C=C[C@H](C(=O)NCCNCc1cc(F)cc(F)c1)c1ccccc1	ZINC001151990614	1379832860	/nfs/dbraw/zinc/83/28/60/1379832860.db2.gz	KLBSJVHBXVHCNW-SFHVURJKSA-N	0	3	330.378	3.140	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cccc(C3CC3)c2)s1	ZINC001152722122	1379975716	/nfs/dbraw/zinc/97/57/16/1379975716.db2.gz	QJGOTWXCAFOWBA-UHFFFAOYSA-N	0	3	325.437	3.017	20	30		EGEDHN
C[C@H](CCCc1ccccc1)C(=O)NCCNCc1cccc(C#N)c1	ZINC001152761758	1379979029	/nfs/dbraw/zinc/97/90/29/1379979029.db2.gz	FYWFJGILACSXBZ-GOSISDBHSA-N	0	3	349.478	3.423	20	30		EGEDHN
CCN(Cc1cccc(Cl)c1)[C@H](C)CNC(=O)c1c[nH]c(C#N)c1	ZINC001152855052	1379987855	/nfs/dbraw/zinc/98/78/55/1379987855.db2.gz	VKDHCDRAKYUQCM-CYBMUJFWSA-N	0	3	344.846	3.180	20	30		EGEDHN
CCN(Cc1ccc(Cl)cc1)[C@H](C)CNC(=O)c1c[nH]c(C#N)c1	ZINC001152879348	1379990064	/nfs/dbraw/zinc/99/00/64/1379990064.db2.gz	ZEOIBVXRJFDEDK-CYBMUJFWSA-N	0	3	344.846	3.180	20	30		EGEDHN
CCc1c2ccccc2oc1C(=O)NCCNCc1cccc(C#N)c1	ZINC001152992494	1380003963	/nfs/dbraw/zinc/00/39/63/1380003963.db2.gz	AZKPRVVMAJIOIY-UHFFFAOYSA-N	0	3	347.418	3.386	20	30		EGEDHN
CCN(Cc1cccc(OC(C)C)c1)[C@H](C)CNC(=O)C#CC(C)C	ZINC001153207913	1380035582	/nfs/dbraw/zinc/03/55/82/1380035582.db2.gz	WGBOFHIOVOTJJI-GOSISDBHSA-N	0	3	344.499	3.460	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NC[C@@H](C)N(CC)Cc1ccsc1	ZINC001153441606	1380077356	/nfs/dbraw/zinc/07/73/56/1380077356.db2.gz	GBIOHAAOYSDTLD-OIISXLGYSA-N	0	3	336.501	3.056	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H](C)N(CC)C[C@@H]1COc2ccccc2O1	ZINC001153625950	1380106782	/nfs/dbraw/zinc/10/67/82/1380106782.db2.gz	QTICWORAZMGFRV-IAGOWNOFSA-N	0	3	346.471	3.009	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)[C@H](C)C1CCC1	ZINC001153974948	1380166869	/nfs/dbraw/zinc/16/68/69/1380166869.db2.gz	RRFDMAHIUHZQIK-HUUCEWRRSA-N	0	3	345.462	3.460	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)CCC2CCCC2)c(F)c1	ZINC001154278283	1380245215	/nfs/dbraw/zinc/24/52/15/1380245215.db2.gz	WKGGSZKABVWFQV-UHFFFAOYSA-N	0	3	331.435	3.264	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NC[C@@H](C)N(CC)Cc1ccsc1	ZINC001154477564	1380284934	/nfs/dbraw/zinc/28/49/34/1380284934.db2.gz	POJIJPYXRNCAMV-CRAIPNDOSA-N	0	3	338.517	3.304	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)C1(C)CCCC1	ZINC001154516153	1380295039	/nfs/dbraw/zinc/29/50/39/1380295039.db2.gz	VAZMEXPRSCCRFW-MRXNPFEDSA-N	0	3	327.472	3.465	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H](C)N(CC)CCc1csc(C)n1	ZINC001154584733	1380310636	/nfs/dbraw/zinc/31/06/36/1380310636.db2.gz	VZMKIFCBQCYBSW-CQSZACIVSA-N	0	3	337.533	3.423	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)CCCC1CC1	ZINC001154735340	1380342729	/nfs/dbraw/zinc/34/27/29/1380342729.db2.gz	CORYAJBQHLUMBT-MRXNPFEDSA-N	0	3	327.472	3.465	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)Cc1cccc(C)c1	ZINC001154980995	1380384075	/nfs/dbraw/zinc/38/40/75/1380384075.db2.gz	UNQOUTNPNUMVNM-GOSISDBHSA-N	0	3	349.478	3.436	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)[C@@]12C[C@@H]1CCCC2	ZINC001155120434	1380412423	/nfs/dbraw/zinc/41/24/23/1380412423.db2.gz	RFOGQEZXFBPDTQ-PBEJRMEISA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@H](C)N(CC)Cc2cccc(C#N)c2)C1	ZINC001155132792	1380414997	/nfs/dbraw/zinc/41/49/97/1380414997.db2.gz	YLTKVLCZZGVTSQ-MRXNPFEDSA-N	0	3	325.456	3.241	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)NC[C@@H](C)N(CC)C/C=C/c1ccccc1	ZINC001155321318	1380436850	/nfs/dbraw/zinc/43/68/50/1380436850.db2.gz	MHLKZYHPTYSEHV-BOXHGLORSA-N	0	3	342.483	3.118	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NCCCN[C@@H](C)c1cc(F)ccc1F	ZINC001155438350	1380453373	/nfs/dbraw/zinc/45/33/73/1380453373.db2.gz	AMBORKYTYWYQMU-UONOGXRCSA-N	0	3	340.414	3.103	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C(C)(C)c1cccc(Cl)c1	ZINC001155514350	1380463131	/nfs/dbraw/zinc/46/31/31/1380463131.db2.gz	JXYWBMXVPKZFLC-OAHLLOKOSA-N	0	3	334.891	3.468	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)C2CCCCCC2)c1	ZINC001155573645	1380470111	/nfs/dbraw/zinc/47/01/11/1380470111.db2.gz	SCPZPVSXWNTRJP-UHFFFAOYSA-N	0	3	331.435	3.264	20	30		EGEDHN
CCCCCC[C@@H](C)CC(=O)NC[C@@H](C)N(CC)CC#CCOC	ZINC001156310859	1380556089	/nfs/dbraw/zinc/55/60/89/1380556089.db2.gz	JXHSVNPADHYXNB-RTBURBONSA-N	0	3	338.536	3.459	20	30		EGEDHN
N#Cc1cnc(Cl)cc1C(F)(F)n1nc(CN)c2ccccc21	ZINC001156855317	1380699338	/nfs/dbraw/zinc/69/93/38/1380699338.db2.gz	CKIZXOLRLRKATD-UHFFFAOYSA-N	0	3	333.729	3.013	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NC[C@@H](C)N(CC)Cc1cc2ccccc2o1	ZINC001157217974	1380814621	/nfs/dbraw/zinc/81/46/21/1380814621.db2.gz	ZFLJYQDRXPOBRN-CVEARBPZSA-N	0	3	344.455	3.351	20	30		EGEDHN
CCCN(CCN1CCCCC1)C(=O)[C@@H](C)Cc1ccc(C#N)cc1	ZINC001157557742	1380965579	/nfs/dbraw/zinc/96/55/79/1380965579.db2.gz	QNGJAFMRDFQTKK-SFHVURJKSA-N	0	3	341.499	3.461	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)CC(C)(C)C)CCN1Cc1ccc(C#N)cc1	ZINC001328224743	1388693147	/nfs/dbraw/zinc/69/31/47/1388693147.db2.gz	ULSDASVYVDUCLB-MAUKXSAKSA-N	0	3	327.472	3.464	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCCC[C@@H]1CN(C)CCOC1CCC1	ZINC001158005327	1381101075	/nfs/dbraw/zinc/10/10/75/1381101075.db2.gz	OSOCKSBCVCIRJL-QGZVFWFLSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccnn1C(CC)CC	ZINC001158065129	1381118564	/nfs/dbraw/zinc/11/85/64/1381118564.db2.gz	GWZXSGZZGQBXCS-QGZVFWFLSA-N	0	3	332.492	3.357	20	30		EGEDHN
C#CCCCCCC(=O)N1CCCC[C@@H]1CN(C)C[C@H]1CCCCO1	ZINC001158316224	1381197777	/nfs/dbraw/zinc/19/77/77/1381197777.db2.gz	DIQPGZVHUZTRQV-WOJBJXKFSA-N	0	3	348.531	3.452	20	30		EGEDHN
C[C@H](N)c1ccn(-c2cc(F)c(C#N)cc2-c2ccnc(Cl)n2)n1	ZINC001158350012	1381211139	/nfs/dbraw/zinc/21/11/39/1381211139.db2.gz	GUHGVOKQDRQLKV-VIFPVBQESA-N	0	3	342.765	3.013	20	30		EGEDHN
C[C@@H](N)c1ccn(-c2cc(F)c(C#N)cc2-c2ccnc(Cl)n2)n1	ZINC001158350011	1381211887	/nfs/dbraw/zinc/21/18/87/1381211887.db2.gz	GUHGVOKQDRQLKV-SECBINFHSA-N	0	3	342.765	3.013	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)C1CC2(CCC2)C1	ZINC001158349350	1381211895	/nfs/dbraw/zinc/21/18/95/1381211895.db2.gz	FVJVKZPBQGWUKK-GOSISDBHSA-N	0	3	334.504	3.082	20	30		EGEDHN
CN1CCC(N(Cc2ccc(F)cc2)c2ncc(C#N)cc2F)CC1	ZINC001158448915	1381249741	/nfs/dbraw/zinc/24/97/41/1381249741.db2.gz	HXYUVRPJKLPWNX-UHFFFAOYSA-N	0	3	342.393	3.332	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)CCc1ccc(OC)cc1	ZINC001158829558	1381422879	/nfs/dbraw/zinc/42/28/79/1381422879.db2.gz	AIRHONFXDJGRPM-GOSISDBHSA-N	0	3	330.472	3.127	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001158857033	1381437786	/nfs/dbraw/zinc/43/77/86/1381437786.db2.gz	LAHKRLUHWZVJKK-UHFFFAOYSA-N	0	3	337.826	3.072	20	30		EGEDHN
CCCC(=O)NCCC1=CCN(Cc2ccc(OCC#N)cc2)CC1	ZINC001159080448	1381565951	/nfs/dbraw/zinc/56/59/51/1381565951.db2.gz	XRQFGZDTUDPQCX-UHFFFAOYSA-N	0	3	341.455	3.027	20	30		EGEDHN
C[C@H](N)c1ncc(-c2ccccc2)n1-c1ccc2[nH]c(C#N)cc2n1	ZINC001159595904	1381842695	/nfs/dbraw/zinc/84/26/95/1381842695.db2.gz	QMHATJVPENGHSU-LBPRGKRZSA-N	0	3	328.379	3.307	20	30		EGEDHN
C#CCC1(C(=O)NCCCNCc2cccc(F)c2Cl)CCC1	ZINC001159638712	1381856526	/nfs/dbraw/zinc/85/65/26/1381856526.db2.gz	ZYBZDKMTOAGRNW-UHFFFAOYSA-N	0	3	336.838	3.269	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)[C@@H](C)Cc1cccc(F)c1	ZINC001328459767	1388751301	/nfs/dbraw/zinc/75/13/01/1388751301.db2.gz	SOEJVORDEGTTAE-JSGCOSHPSA-N	0	3	326.843	3.241	20	30		EGEDHN
C#CCCCC(=O)NCCC1=CCN(CCc2ccccc2F)CC1	ZINC001159964234	1381951773	/nfs/dbraw/zinc/95/17/73/1381951773.db2.gz	HEEXIRFFBMDDGU-UHFFFAOYSA-N	0	3	342.458	3.310	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H](CC)OC2CCCCC2)CC1	ZINC001160131808	1382009716	/nfs/dbraw/zinc/00/97/16/1382009716.db2.gz	WCSAXOQERXSAIO-LJQANCHMSA-N	0	3	334.504	3.439	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc(Cl)ccc2F)CC1	ZINC001160628404	1382156576	/nfs/dbraw/zinc/15/65/76/1382156576.db2.gz	NGEKFHPWEJTYMB-UHFFFAOYSA-N	0	3	334.822	3.254	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc(-c3ccccc3)on2)CC1	ZINC001160629110	1382156688	/nfs/dbraw/zinc/15/66/88/1382156688.db2.gz	ZKTMZDKQQBBNEL-UHFFFAOYSA-N	0	3	337.423	3.280	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@H]2CCc3cc(F)ccc32)CC1	ZINC001160688886	1382171462	/nfs/dbraw/zinc/17/14/62/1382171462.db2.gz	QZQIIXSWEVMXKF-FQEVSTJZSA-N	0	3	340.442	3.017	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H]2CCc3cc(F)ccc32)CC1	ZINC001160687609	1382171526	/nfs/dbraw/zinc/17/15/26/1382171526.db2.gz	CMNOFMLUCANETO-LJQANCHMSA-N	0	3	328.431	3.180	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2noc3c2CC(C)(C)CC3)CC1	ZINC001160779419	1382193561	/nfs/dbraw/zinc/19/35/61/1382193561.db2.gz	YSTZHBAUSXBLNP-UHFFFAOYSA-N	0	3	343.471	3.128	20	30		EGEDHN
C=CCN1CCC[C@H]1CNc1cc(C#N)c2cc([N+](=O)[O-])ccc2n1	ZINC001160957470	1382250855	/nfs/dbraw/zinc/25/08/55/1382250855.db2.gz	LTUCKJSMGCKMFO-HNNXBMFYSA-N	0	3	337.383	3.077	20	30		EGEDHN
COc1cccc(CN2CC[C@H](Nc3cc(Cl)cc(C#N)n3)C2)c1	ZINC001161187574	1382333315	/nfs/dbraw/zinc/33/33/15/1382333315.db2.gz	GGVIFAMEVOBMHM-HNNXBMFYSA-N	0	3	342.830	3.302	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C2[C@@H]3CCCCCC[C@@H]23)CC1	ZINC001161314408	1382369070	/nfs/dbraw/zinc/36/90/70/1382369070.db2.gz	YCPKQLPCJRCNMP-RTBURBONSA-N	0	3	328.500	3.365	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C(C)(C)c2ccccc2F)CC1	ZINC001161472092	1382417856	/nfs/dbraw/zinc/41/78/56/1382417856.db2.gz	KPCMALYOQRGFHZ-UHFFFAOYSA-N	0	3	330.447	3.428	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2c[nH]nc2-c2ccsc2)CC1	ZINC001161591511	1382449151	/nfs/dbraw/zinc/44/91/51/1382449151.db2.gz	ZUUILCKJZPUDJO-UHFFFAOYSA-N	0	3	342.468	3.076	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc(OC(C)C)cc2)CC1	ZINC001161818182	1382518735	/nfs/dbraw/zinc/51/87/35/1382518735.db2.gz	QLIYLKMPJAARFJ-UHFFFAOYSA-N	0	3	328.456	3.412	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)c1scnc1C1CCCC1	ZINC001161907747	1382548068	/nfs/dbraw/zinc/54/80/68/1382548068.db2.gz	XWVOGYXEHURBCK-UHFFFAOYSA-N	0	3	327.881	3.263	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H](C)Cc2ccccc2C)CC1	ZINC001161968333	1382576557	/nfs/dbraw/zinc/57/65/57/1382576557.db2.gz	OTFNOHDSWGEXFB-GOSISDBHSA-N	0	3	326.484	3.498	20	30		EGEDHN
CCc1ccc(C(=O)NCCCNCc2ccccc2C#N)s1	ZINC001161986453	1382589117	/nfs/dbraw/zinc/58/91/17/1382589117.db2.gz	YIEKWOQOJZOFJS-UHFFFAOYSA-N	0	3	327.453	3.092	20	30		EGEDHN
CC(C)=C[C@@H]1[C@@H](C(=O)NCCCNCc2ccccc2C#N)C1(C)C	ZINC001162157130	1382643187	/nfs/dbraw/zinc/64/31/87/1382643187.db2.gz	ROWVVIPKZNTMDI-MOPGFXCFSA-N	0	3	339.483	3.393	20	30		EGEDHN
CCCc1ccccc1C(=O)NCCCNCc1ccccc1C#N	ZINC001162214253	1382659025	/nfs/dbraw/zinc/65/90/25/1382659025.db2.gz	RRLOOEOXTBKBJF-UHFFFAOYSA-N	0	3	335.451	3.420	20	30		EGEDHN
Cc1nc(NCC2(N3CCOC(C)(C)C3)CCCCC2)ccc1C#N	ZINC001162470972	1382767094	/nfs/dbraw/zinc/76/70/94/1382767094.db2.gz	IFKHVMIPBKQUIZ-UHFFFAOYSA-N	0	3	342.487	3.487	20	30		EGEDHN
C[C@@H](N)c1nc2ccccc2n1-c1nc(C(F)(F)F)ccc1C#N	ZINC001162759952	1382862198	/nfs/dbraw/zinc/86/21/98/1382862198.db2.gz	KFQCDJIZVCZKBG-SECBINFHSA-N	0	3	331.301	3.331	20	30		EGEDHN
C[C@@H](N)c1nc2ccccc2n1-c1nccc(Br)c1C#N	ZINC001162777313	1382869805	/nfs/dbraw/zinc/86/98/05/1382869805.db2.gz	PRCDMUBOKWPQNT-SECBINFHSA-N	0	3	342.200	3.074	20	30		EGEDHN
CC[C@@H](F)CNCCN(CCc1ccccc1)C(=O)C#CC(C)C	ZINC001162806876	1382878875	/nfs/dbraw/zinc/87/88/75/1382878875.db2.gz	MWTNEKOXYRHGKH-LJQANCHMSA-N	0	3	332.463	3.055	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CCC=CCCC1	ZINC001162840925	1382891523	/nfs/dbraw/zinc/89/15/23/1382891523.db2.gz	IOAMZVROHRTHHG-OAQYLSRUSA-N	0	3	338.495	3.417	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C[C@@H]1CC[C@H](C)C1	ZINC001162892070	1382906821	/nfs/dbraw/zinc/90/68/21/1382906821.db2.gz	GMUDCWKHVYBIII-PZJWPPBQSA-N	0	3	340.511	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1coc(C(F)F)c1	ZINC001162897619	1382908461	/nfs/dbraw/zinc/90/84/61/1382908461.db2.gz	DNUOYLCJNZEKNI-UHFFFAOYSA-N	0	3	346.377	3.125	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C1(C(C)C)CC1	ZINC001162923861	1382917806	/nfs/dbraw/zinc/91/78/06/1382917806.db2.gz	AZYMWIXNQOOXTP-UHFFFAOYSA-N	0	3	326.484	3.107	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C1CCC(F)(F)CC1	ZINC001162946935	1382924257	/nfs/dbraw/zinc/92/42/57/1382924257.db2.gz	TZSDTSZEBRQNAQ-UHFFFAOYSA-N	0	3	348.437	3.106	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@H](C)[C@H](C)CC	ZINC001162964311	1382929647	/nfs/dbraw/zinc/92/96/47/1382929647.db2.gz	VTWZZPRQDFUJTC-RTBURBONSA-N	0	3	328.500	3.353	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H]1C[C@@H]1C1CCCC1	ZINC001162970777	1382932128	/nfs/dbraw/zinc/93/21/28/1382932128.db2.gz	KVZQMCJCKHQFNY-RTWAWAEBSA-N	0	3	338.495	3.107	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H]1C[C@@]1(CC)C(C)C	ZINC001162970862	1382932687	/nfs/dbraw/zinc/93/26/87/1382932687.db2.gz	NOFGCIIUPRQFQA-IRLDBZIGSA-N	0	3	340.511	3.353	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H](C)C1CCCC1	ZINC001162977188	1382935145	/nfs/dbraw/zinc/93/51/45/1382935145.db2.gz	JMOVLACMTPGNLU-SFHVURJKSA-N	0	3	326.484	3.107	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CC[C@H](C)CC1	ZINC001162987748	1382938627	/nfs/dbraw/zinc/93/86/27/1382938627.db2.gz	WVERJZCRHORNOO-KESTWPANSA-N	0	3	326.484	3.107	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1cccc(C2CC2)c1	ZINC001163007748	1382947331	/nfs/dbraw/zinc/94/73/31/1382947331.db2.gz	YHEQGYMKFNHGBB-UHFFFAOYSA-N	0	3	346.474	3.472	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)NCCC1(CNCC#Cc2cccc(Cl)c2)CC1	ZINC001163235302	1383001848	/nfs/dbraw/zinc/00/18/48/1383001848.db2.gz	HNOPXXYQSYUVSN-YJBOKZPZSA-N	0	3	344.886	3.224	20	30		EGEDHN
N#Cc1ccc(F)c(CNCC2(CCNC(=O)C3CC=CC3)CC2)c1	ZINC001163919157	1383135521	/nfs/dbraw/zinc/13/55/21/1383135521.db2.gz	YIFXBPGCOBQJCW-UHFFFAOYSA-N	0	3	341.430	3.040	20	30		EGEDHN
CC(C)=C(F)C(=O)NCCC1(CNCc2cc(C#N)ccc2F)CC1	ZINC001164071098	1383152925	/nfs/dbraw/zinc/15/29/25/1383152925.db2.gz	RODFNBLSWGXDLI-UHFFFAOYSA-N	0	3	347.409	3.337	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCCNCc1nsc2ccccc12	ZINC001164222280	1383167745	/nfs/dbraw/zinc/16/77/45/1383167745.db2.gz	JXTJNDARUJHHDW-UONOGXRCSA-N	0	3	331.485	3.350	20	30		EGEDHN
CC1(C(=O)NCCC2(CNCC#Cc3cccc(Cl)c3)CC2)CC1	ZINC001164608216	1383207582	/nfs/dbraw/zinc/20/75/82/1383207582.db2.gz	ASCBFXMUXOXZCI-UHFFFAOYSA-N	0	3	344.886	3.368	20	30		EGEDHN
Cc1ccc([C@H](C#N)c2ccc(N3CCN(C(C)C)[C@H](C)C3)nn2)cc1	ZINC001165199179	1383245280	/nfs/dbraw/zinc/24/52/80/1383245280.db2.gz	VSXXVZUQTAVQRP-MJGOQNOKSA-N	0	3	349.482	3.359	20	30		EGEDHN
C#CCC1(C(=O)NCCC2(CNCc3nc(C)cs3)CC2)CCC1	ZINC001165401738	1383287202	/nfs/dbraw/zinc/28/72/02/1383287202.db2.gz	NLPIDYBQLSKRBZ-UHFFFAOYSA-N	0	3	345.512	3.021	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cccc3c2COCC3)CC1	ZINC001165441155	1383296695	/nfs/dbraw/zinc/29/66/95/1383296695.db2.gz	ZWKDZUVZACQKLW-UHFFFAOYSA-N	0	3	348.874	3.002	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccn3ccccc23)CC1	ZINC001166107982	1383390919	/nfs/dbraw/zinc/39/09/19/1383390919.db2.gz	YLQMKKXGJSVOBA-UHFFFAOYSA-N	0	3	331.847	3.182	20	30		EGEDHN
CC1(C)CC[C@H](C(=O)NCCCNCc2ccc(C#N)cc2F)C1	ZINC001166199930	1383401178	/nfs/dbraw/zinc/40/11/78/1383401178.db2.gz	LPNUVNWGBXDPFQ-HNNXBMFYSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCC1(CNCc2cnc(Cl)s2)CC1	ZINC001166574545	1383440492	/nfs/dbraw/zinc/44/04/92/1383440492.db2.gz	QISYDOQZOVRTIL-UHFFFAOYSA-N	0	3	341.908	3.385	20	30		EGEDHN
C#CCCCCCC(=O)NCCC1(CNCc2conc2CC)CC1	ZINC001166589024	1383441965	/nfs/dbraw/zinc/44/19/65/1383441965.db2.gz	OFLSZTZURBSNEC-UHFFFAOYSA-N	0	3	345.487	3.197	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCC1(CNCc2c(C)onc2CC)CC1	ZINC001166696177	1383462903	/nfs/dbraw/zinc/46/29/03/1383462903.db2.gz	XORZVIWTOXIBSB-GJZGRUSLSA-N	0	3	347.503	3.380	20	30		EGEDHN
C=CCC1(C(=O)NCCC2(CN[C@H](C)c3cnccn3)CC2)CCC1	ZINC001167035397	1383524700	/nfs/dbraw/zinc/52/47/00/1383524700.db2.gz	GJDHWEFTRWRECM-MRXNPFEDSA-N	0	3	342.487	3.160	20	30		EGEDHN
CCC(CC)N(CC)c1nccnc1C(C#N)C(=O)OC(C)(C)C	ZINC001167107612	1383540641	/nfs/dbraw/zinc/54/06/41/1383540641.db2.gz	ZCABYTBUGLORHU-AWEZNQCLSA-N	0	3	332.448	3.440	20	30		EGEDHN
Cc1cccc(C)c1C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001167248729	1383574472	/nfs/dbraw/zinc/57/44/72/1383574472.db2.gz	DPWUSMPJCHWGQB-UHFFFAOYSA-N	0	3	339.414	3.224	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCC1(CNCc2conc2CC)CC1	ZINC001167339630	1383603040	/nfs/dbraw/zinc/60/30/40/1383603040.db2.gz	JFEKUNVRIWVTBJ-UHFFFAOYSA-N	0	3	333.476	3.215	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)NCCC1(CNCc2ccc(C#N)cc2F)CC1	ZINC001167366872	1383611526	/nfs/dbraw/zinc/61/15/26/1383611526.db2.gz	UHOBSLOOXGUKSK-OAHLLOKOSA-N	0	3	345.462	3.366	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)CO[C@H]2CCCC[C@H]2C)CC1	ZINC001167370031	1383612476	/nfs/dbraw/zinc/61/24/76/1383612476.db2.gz	DHTNWCZBMGRDGI-ZBFHGGJFSA-N	0	3	342.911	3.210	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)[C@H](C)CC(C)C)CC1	ZINC001167556248	1383666710	/nfs/dbraw/zinc/66/67/10/1383666710.db2.gz	FSTXHHYTGZOLFA-CYBMUJFWSA-N	0	3	345.325	3.453	20	30		EGEDHN
C[C@H](CC(C)(C)C)C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001167664967	1383703916	/nfs/dbraw/zinc/70/39/16/1383703916.db2.gz	VIKMTOOPPQFPKP-CQSZACIVSA-N	0	3	333.451	3.366	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2c(C)[nH]nc2C(C)C)CC1	ZINC001167682159	1383708370	/nfs/dbraw/zinc/70/83/70/1383708370.db2.gz	RQUIJEOUEMFDBF-UHFFFAOYSA-N	0	3	338.883	3.084	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H](NCC2(C#N)CC2)C[C@H]1C(F)(F)F	ZINC001168523770	1383929783	/nfs/dbraw/zinc/92/97/83/1383929783.db2.gz	MGQMXTMDOONODJ-RYUDHWBXSA-N	0	3	347.381	3.210	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)c1cccnc1	ZINC001168805981	1384012351	/nfs/dbraw/zinc/01/23/51/1384012351.db2.gz	MYIYQUALQSWJEG-INIZCTEOSA-N	0	3	336.439	3.032	20	30		EGEDHN
C[C@@H](CCCCNCc1cc(F)ccc1C#N)NC(=O)c1ccco1	ZINC001168830908	1384023087	/nfs/dbraw/zinc/02/30/87/1384023087.db2.gz	IULBTQRKODEVLK-AWEZNQCLSA-N	0	3	343.402	3.369	20	30		EGEDHN
N#CC1(c2ccccc2F)CCN([C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1	ZINC001169055895	1384101613	/nfs/dbraw/zinc/10/16/13/1384101613.db2.gz	RACWMHWFFIJBLF-CABCVRRESA-N	0	3	331.391	3.128	20	30		EGEDHN
CCOC(=O)[C@@H]1[C@H](C)C[C@H](C)N(Cc2ccc(C#N)cc2OC)[C@@H]1C	ZINC001308154775	1384102018	/nfs/dbraw/zinc/10/20/18/1384102018.db2.gz	DAFXRISZKJHLII-NXEZDXNNSA-N	0	3	344.455	3.365	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)c1ccc(-c2ccccc2)nc1	ZINC001169060029	1384102279	/nfs/dbraw/zinc/10/22/79/1384102279.db2.gz	LYDXINFCPHZKQD-UHFFFAOYSA-N	0	3	329.831	3.211	20	30		EGEDHN
C[C@H]1CCN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(CC#N)cc1	ZINC001169527868	1384156545	/nfs/dbraw/zinc/15/65/45/1384156545.db2.gz	QZZCZSDHCJPUER-UWJYYQICSA-N	0	3	347.462	3.393	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1(C)C	ZINC001308941209	1384160998	/nfs/dbraw/zinc/16/09/98/1384160998.db2.gz	OEYFJGMNZRHQCH-HOTGVXAUSA-N	0	3	347.434	3.479	20	30		EGEDHN
CCC1(C(=O)NCCCNCc2ccc(C#N)cc2F)CCCC1	ZINC001169863750	1384192769	/nfs/dbraw/zinc/19/27/69/1384192769.db2.gz	XJTHDEOSASGICX-UHFFFAOYSA-N	0	3	331.435	3.264	20	30		EGEDHN
C[C@@H](CCCCNCc1cc(F)ccc1C#N)NC(=O)C1CC=CC1	ZINC001169926694	1384199574	/nfs/dbraw/zinc/19/95/74/1384199574.db2.gz	AOIKSHPDCSVVAV-HNNXBMFYSA-N	0	3	343.446	3.428	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1cccc2ccncc21	ZINC001169931283	1384199999	/nfs/dbraw/zinc/19/99/99/1384199999.db2.gz	MPKJZSRSICITIB-UHFFFAOYSA-N	0	3	344.418	3.016	20	30		EGEDHN
CCOC(=O)C1=C(Nc2ccc(-c3ccc(C#N)o3)cc2)CCNC1	ZINC001170517952	1384333589	/nfs/dbraw/zinc/33/35/89/1384333589.db2.gz	WCTFEPFHEFGQON-UHFFFAOYSA-N	0	3	337.379	3.041	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H](C)CCCCNCc1ccn(CC)n1	ZINC001170997210	1384426678	/nfs/dbraw/zinc/42/66/78/1384426678.db2.gz	DRKZWIAGNDWDCX-MRXNPFEDSA-N	0	3	334.508	3.270	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H](C)CCCCN[C@@H](C)c1nnc(C)[nH]1	ZINC001170998528	1384427178	/nfs/dbraw/zinc/42/71/78/1384427178.db2.gz	SZMBIJXIZHARCS-KBPBESRZSA-N	0	3	335.496	3.041	20	30		EGEDHN
N=C(Nc1ccc2c(c1)NC(=O)CC2)c1ccc2cc(O)ccc2c1	ZINC001171184267	1384462505	/nfs/dbraw/zinc/46/25/05/1384462505.db2.gz	HVHWSZGEXZSTLI-UHFFFAOYSA-N	0	3	331.375	3.467	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@H](F)CC1CCCCC1	ZINC001171279743	1384484357	/nfs/dbraw/zinc/48/43/57/1384484357.db2.gz	ZXLIISUGQZTZBX-CQSZACIVSA-N	0	3	349.288	3.299	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)[C@H](C)CCCC)C1	ZINC001316629741	1384493660	/nfs/dbraw/zinc/49/36/60/1384493660.db2.gz	CZVJHIRLYAMZLR-MRVWCRGKSA-N	0	3	331.298	3.206	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1CCN(Cc2cc3ccccc3s2)C1	ZINC001316994864	1384751383	/nfs/dbraw/zinc/75/13/83/1384751383.db2.gz	PPTJWQMDKFUGDQ-INIZCTEOSA-N	0	3	344.480	3.185	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)N1CCN(c2ccc(C#N)cc2)CC1	ZINC001172306007	1384764508	/nfs/dbraw/zinc/76/45/08/1384764508.db2.gz	HWUTXWUVWPJISD-KRWDZBQOSA-N	0	3	330.435	3.183	20	30		EGEDHN
COC(=O)c1ccc2c(c1)CN([C@@H](C)Cc1ccc(C#N)cc1)CC2	ZINC001172318802	1384768965	/nfs/dbraw/zinc/76/89/65/1384768965.db2.gz	JBLKYYFKJYCPHX-HNNXBMFYSA-N	0	3	334.419	3.334	20	30		EGEDHN
CC(C)(C(=O)NC[C@H](NCc1ccc(C#N)cc1F)C1CC1)C1CC1	ZINC001317027271	1384794674	/nfs/dbraw/zinc/79/46/74/1384794674.db2.gz	PKQSODIWYMBICU-SFHVURJKSA-N	0	3	343.446	3.118	20	30		EGEDHN
C[C@H](CCCC#N)N1CCO[C@@H]2[C@H](COCc3cccnc3)CC[C@@H]21	ZINC001172498255	1384806080	/nfs/dbraw/zinc/80/60/80/1384806080.db2.gz	KFUMRPQRWXDYNG-BTHPGYMESA-N	0	3	343.471	3.160	20	30		EGEDHN
N#Cc1nccnc1N1CCN([C@@H]2CCC[C@@H](c3ccccc3)C2)CC1	ZINC001172553951	1384811176	/nfs/dbraw/zinc/81/11/76/1384811176.db2.gz	TXHSFQTZBFOLKU-RTBURBONSA-N	0	3	347.466	3.197	20	30		EGEDHN
COC(=O)[C@@H]1CCC[C@@H](N2CCC(C#N)(c3ccccc3)CC2)C1	ZINC001172612267	1384819063	/nfs/dbraw/zinc/81/90/63/1384819063.db2.gz	TWESWPGXRODQDV-SJLPKXTDSA-N	0	3	326.440	3.276	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@@H]1C[C@@H](N[C@@H](C)c2cc(Cl)ccc2Cl)C1	ZINC001317073723	1384841292	/nfs/dbraw/zinc/84/12/92/1384841292.db2.gz	UVCNNNRZTNIVLN-LYIQGSDWSA-N	0	3	340.254	3.451	20	30		EGEDHN
C[C@H]([NH2+][C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C#N)C1)c1ccccc1[O-]	ZINC001172976747	1384894400	/nfs/dbraw/zinc/89/44/00/1384894400.db2.gz	TWRMYAMGFQLNCE-ZNMIVQPWSA-N	0	3	345.443	3.334	20	30		EGEDHN
C=CCOC1CCC(N2CCN(c3ccccc3C#N)CC2)CC1	ZINC001173319640	1384957794	/nfs/dbraw/zinc/95/77/94/1384957794.db2.gz	PYONUGGVNFLSEI-UHFFFAOYSA-N	0	3	325.456	3.194	20	30		EGEDHN
Cc1ccccc1CCC(=O)NC[C@@H](C)NCc1ccc(C#N)s1	ZINC001317271029	1385041189	/nfs/dbraw/zinc/04/11/89/1385041189.db2.gz	LLEKYQICZWMCDU-OAHLLOKOSA-N	0	3	341.480	3.155	20	30		EGEDHN
CCCC1(C(=O)N2CC[C@@H](CNCc3ccccc3C#N)C2)CC1	ZINC001317334160	1385087644	/nfs/dbraw/zinc/08/76/44/1385087644.db2.gz	KTCPFKKHUZJQQU-INIZCTEOSA-N	0	3	325.456	3.077	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)C1C(C)(C)C1(C)C	ZINC001317390936	1385110590	/nfs/dbraw/zinc/11/05/90/1385110590.db2.gz	OYSMKQLXKNHMIQ-LLVKDONJSA-N	0	3	331.298	3.062	20	30		EGEDHN
CCCC1(C(=O)NCC[C@@H](C)NCc2cc(C#N)ccc2F)CC1	ZINC001317405604	1385118634	/nfs/dbraw/zinc/11/86/34/1385118634.db2.gz	LNJDDZXMJTVDHN-CQSZACIVSA-N	0	3	331.435	3.262	20	30		EGEDHN
CCC[C@H](OC)C(=O)N[C@H](C)CCCCNCc1ccccc1C#N	ZINC001174649886	1385129922	/nfs/dbraw/zinc/12/99/22/1385129922.db2.gz	KWNCOVDWWKILDR-APWZRJJASA-N	0	3	345.487	3.138	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H](C)CCCCN[C@H](C)c1nnc(CC)[nH]1	ZINC001174672846	1385132381	/nfs/dbraw/zinc/13/23/81/1385132381.db2.gz	RDDFTDYQRBRIST-HUUCEWRRSA-N	0	3	349.523	3.295	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H](C)CCCCNCc1ocnc1C	ZINC001174694407	1385135580	/nfs/dbraw/zinc/13/55/80/1385135580.db2.gz	OAMBRBLCNWDKNB-MRXNPFEDSA-N	0	3	333.476	3.331	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@H](C)CCCCNCc1cc2n(n1)CCC2	ZINC001174834044	1385157252	/nfs/dbraw/zinc/15/72/52/1385157252.db2.gz	VDKMWTMUQVJLFP-SJORKVTESA-N	0	3	346.519	3.196	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)CCCCN[C@H](C)c2nnc(C)[nH]2)CCC1	ZINC001175097387	1385194279	/nfs/dbraw/zinc/19/42/79/1385194279.db2.gz	JHWLABDHNZHVJY-HUUCEWRRSA-N	0	3	347.507	3.185	20	30		EGEDHN
CCC(CC)C(=O)NC[C@@H]1CCCN1Cc1ccc(OCC#N)cc1	ZINC001317494765	1385196241	/nfs/dbraw/zinc/19/62/41/1385196241.db2.gz	PXOCMYKKGOBMSR-SFHVURJKSA-N	0	3	343.471	3.106	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)CC(C)(F)F	ZINC001175115053	1385197453	/nfs/dbraw/zinc/19/74/53/1385197453.db2.gz	KHUULXWTQSSQNB-CQSZACIVSA-N	0	3	337.414	3.368	20	30		EGEDHN
C[C@@H](CC(=O)NCCCNCc1ccccc1C#N)c1ccccc1	ZINC001175318366	1385251568	/nfs/dbraw/zinc/25/15/68/1385251568.db2.gz	XPOVCOGDLDSECR-KRWDZBQOSA-N	0	3	335.451	3.348	20	30		EGEDHN
CCCN(CCNC(=O)[C@]12C[C@H]1CCC2)Cc1ccc(F)c(C#N)c1	ZINC001317543727	1385286378	/nfs/dbraw/zinc/28/63/78/1385286378.db2.gz	SXSQDVLNBDODAW-YLJYHZDGSA-N	0	3	343.446	3.216	20	30		EGEDHN
C[C@H](CCCCNCc1cc(F)ccc1C#N)NC(=O)[C@H]1CC12CC2	ZINC001175442305	1385291069	/nfs/dbraw/zinc/29/10/69/1385291069.db2.gz	KJAGSRTVHAUTPF-RDTXWAMCSA-N	0	3	343.446	3.262	20	30		EGEDHN
Cc1cc(C)c(C(=O)NCCCNCc2ccccc2C#N)c(C)c1	ZINC001175447871	1385292737	/nfs/dbraw/zinc/29/27/37/1385292737.db2.gz	YITCRORSMNREGR-UHFFFAOYSA-N	0	3	335.451	3.393	20	30		EGEDHN
Cc1c[nH]cc1C(=O)N[C@@H](C)CCCCNCc1ccccc1C#N	ZINC001176563536	1385626122	/nfs/dbraw/zinc/62/61/22/1385626122.db2.gz	FRBISPDWZJPMOY-INIZCTEOSA-N	0	3	338.455	3.273	20	30		EGEDHN
C[C@H](C(=O)NCCCNCc1ccccc1C#N)c1cccc(F)c1	ZINC001176564945	1385626788	/nfs/dbraw/zinc/62/67/88/1385626788.db2.gz	ATWLNLWARRXVKL-HNNXBMFYSA-N	0	3	339.414	3.097	20	30		EGEDHN
C=CCC1(C(=O)NCCCNCc2oc(C)nc2C)CCCCC1	ZINC001176790397	1385699496	/nfs/dbraw/zinc/69/94/96/1385699496.db2.gz	LUNXQIUJTKGUIF-UHFFFAOYSA-N	0	3	333.476	3.414	20	30		EGEDHN
C#CCC1(C(=O)NCCCNCc2ncc(C)s2)CCCCC1	ZINC001177217781	1385870717	/nfs/dbraw/zinc/87/07/17/1385870717.db2.gz	NIDUOACFFXJFFV-UHFFFAOYSA-N	0	3	333.501	3.021	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@H]1CC1(F)F	ZINC001177308656	1385907304	/nfs/dbraw/zinc/90/73/04/1385907304.db2.gz	MFFRYJDIAQXBRW-CQSZACIVSA-N	0	3	334.838	3.393	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)N(CCCNCC(=C)Cl)CC1CCCC1	ZINC001177311431	1385908560	/nfs/dbraw/zinc/90/85/60/1385908560.db2.gz	FCXRBMXEQPFOMV-SFHVURJKSA-N	0	3	342.911	3.065	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCC1CCN(Cc2ccccc2Cl)CC1	ZINC001319018995	1385928105	/nfs/dbraw/zinc/92/81/05/1385928105.db2.gz	DZIRIFZNYIMAGX-AWEZNQCLSA-N	0	3	333.863	3.218	20	30		EGEDHN
CCc1ccccc1C(=O)NC[C@@H](C)CNCc1ccccc1C#N	ZINC001319230923	1386015504	/nfs/dbraw/zinc/01/55/04/1386015504.db2.gz	DIIVGPNKYYULIU-INIZCTEOSA-N	0	3	335.451	3.276	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)N(C)C(=O)C1C(C)(C)C1(C)C	ZINC001319438800	1386122026	/nfs/dbraw/zinc/12/20/26/1386122026.db2.gz	HLJBHWMCZDHVQC-LBPRGKRZSA-N	0	3	333.501	3.238	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](NCc2cc(OC)ccc2Cl)[C@@H]1C	ZINC001178324122	1386189256	/nfs/dbraw/zinc/18/92/56/1386189256.db2.gz	IMZGUMYERSUZBY-GUYCJALGSA-N	0	3	336.863	3.394	20	30		EGEDHN
CCc1nc(CNCCCCCCNC(=O)C#CC(C)C)cs1	ZINC001178419481	1386212754	/nfs/dbraw/zinc/21/27/54/1386212754.db2.gz	ZJIVCIJAQGXWSJ-UHFFFAOYSA-N	0	3	335.517	3.131	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@H](NCC#Cc2ccccc2Cl)[C@@H]1C)C1CC1	ZINC001178426769	1386213971	/nfs/dbraw/zinc/21/39/71/1386213971.db2.gz	HVSNBMJDYFBTEP-DOXZYTNZSA-N	0	3	344.886	3.317	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccc(Cl)cc2)CCN1C(=O)C1=CCCC1	ZINC001178459465	1386224242	/nfs/dbraw/zinc/22/42/42/1386224242.db2.gz	QHWVFYWKABHGST-KXBFYZLASA-N	0	3	342.870	3.381	20	30		EGEDHN
CC/C(C)=C\C(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)[C@@H]1C	ZINC001178660002	1386270551	/nfs/dbraw/zinc/27/05/51/1386270551.db2.gz	PKDQENCHNVGXAA-MXGCPKOUSA-N	0	3	329.419	3.133	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](NCc2c(C)nsc2C)[C@@H]1C	ZINC001178795047	1386307550	/nfs/dbraw/zinc/30/75/50/1386307550.db2.gz	HFNFQXPVGXPNSX-BBRMVZONSA-N	0	3	335.517	3.441	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](NCc2cc(C)ccc2OC)[C@@H]1C	ZINC001178805348	1386311679	/nfs/dbraw/zinc/31/16/79/1386311679.db2.gz	CMUAOWMMPACYRO-WMZOPIPTSA-N	0	3	330.472	3.439	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1ccc(C(F)F)nc1)C(C)C	ZINC001319919140	1386390416	/nfs/dbraw/zinc/39/04/16/1386390416.db2.gz	SMYBWIZTOAFCHY-ZDUSSCGKSA-N	0	3	331.794	3.116	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCCCCCN[C@H](C)c1nnc(CC)[nH]1	ZINC001179212816	1386425366	/nfs/dbraw/zinc/42/53/66/1386425366.db2.gz	XWJZPQOBGCUULZ-OAHLLOKOSA-N	0	3	349.523	3.297	20	30		EGEDHN
C[C@@H](C#N)C(=O)N(C)CCN(C)CCc1cc(Cl)cc(Cl)c1	ZINC001319981768	1386434324	/nfs/dbraw/zinc/43/43/24/1386434324.db2.gz	UCIYAMPVAYIUFT-LBPRGKRZSA-N	0	3	342.270	3.086	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H](NCc2ccnc(Cl)c2)[C@@H]1C	ZINC001179364625	1386463990	/nfs/dbraw/zinc/46/39/90/1386463990.db2.gz	NUKLGMIXNHZFEI-YCPHGPKFSA-N	0	3	335.879	3.416	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@@H]1C	ZINC001179384561	1386469674	/nfs/dbraw/zinc/46/96/74/1386469674.db2.gz	QEHOZWXHSHXMTG-QKLQHJQFSA-N	0	3	342.458	3.359	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCCCCCNCc1nccn1CC	ZINC001179481494	1386494371	/nfs/dbraw/zinc/49/43/71/1386494371.db2.gz	GKPFLXHGVVGWFJ-LJQANCHMSA-N	0	3	334.508	3.272	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCCCCCNCc1cc2n(n1)CCC2	ZINC001179482676	1386494981	/nfs/dbraw/zinc/49/49/81/1386494981.db2.gz	ZOEORLVHAUIYSI-FQEVSTJZSA-N	0	3	346.519	3.198	20	30		EGEDHN
CCC[C@@H](CC)C(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C	ZINC001179807028	1386593620	/nfs/dbraw/zinc/59/36/20/1386593620.db2.gz	OKRIITKZPNIHQA-SXLOBPIMSA-N	0	3	326.484	3.443	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccccc2)C[C@@]1(C)CNCc1ccccc1C#N	ZINC001180467359	1386806638	/nfs/dbraw/zinc/80/66/38/1386806638.db2.gz	CQEMYPBHOHCNTK-VGOFRKELSA-N	0	3	347.462	3.446	20	30		EGEDHN
CC[C@@H](NC[C@@H](C)NC(=O)c1cc(C#N)c[nH]1)c1ccc(F)cc1F	ZINC001321479732	1386913995	/nfs/dbraw/zinc/91/39/95/1386913995.db2.gz	CTCQWNBYTDVMJY-BDJLRTHQSA-N	0	3	346.381	3.024	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](C)CNCc2ccc(C#N)s2)sc1C	ZINC001321736190	1386970983	/nfs/dbraw/zinc/97/09/83/1386970983.db2.gz	SQLJSJFHYZAACO-LLVKDONJSA-N	0	3	333.482	3.206	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2nc(C)cs2)C1	ZINC001182437953	1387166241	/nfs/dbraw/zinc/16/62/41/1387166241.db2.gz	YSPALKDNBDKZMO-RDTXWAMCSA-N	0	3	335.517	3.382	20	30		EGEDHN
C[C@H](C(=O)NC[C@@H]1CCCN1Cc1ccccc1)c1ccc(C#N)cc1	ZINC001182801007	1387226800	/nfs/dbraw/zinc/22/68/00/1387226800.db2.gz	WXVGNFQKLYDOAW-UWJYYQICSA-N	0	3	347.462	3.443	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](NCc2ccc(F)c(F)c2)C1	ZINC001182818521	1387229661	/nfs/dbraw/zinc/22/96/61/1387229661.db2.gz	JMTCLGVPHDOZSP-MRXNPFEDSA-N	0	3	334.410	3.424	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccc2[nH]ccc2c1)N(C)Cc1ccc(C#N)cc1	ZINC001329532274	1389145189	/nfs/dbraw/zinc/14/51/89/1389145189.db2.gz	PBGJGQPNVOPCEX-HNNXBMFYSA-N	0	3	346.434	3.290	20	30		EGEDHN
CC(C)(C)n1c2ccccc2nc1NC(=O)[C@@H](N)CCCCC#N	ZINC001329933534	1389262507	/nfs/dbraw/zinc/26/25/07/1389262507.db2.gz	LPLZUIBISAVLNG-ZDUSSCGKSA-N	0	3	327.432	3.141	20	30		EGEDHN
C=C(Br)CNC[C@H](NC(=O)C1CCCC1)C(C)(C)C	ZINC001332754545	1390180715	/nfs/dbraw/zinc/18/07/15/1390180715.db2.gz	UWCGMMMUUZHHSK-ZDUSSCGKSA-N	0	3	331.298	3.206	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N[C@@H](COC)c1cccc(C(F)(F)F)c1	ZINC001339954745	1390198621	/nfs/dbraw/zinc/19/86/21/1390198621.db2.gz	HPYZDDVSDIPATN-CABCVRRESA-N	0	3	344.377	3.193	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N[C@@H](CC)c1nc(C(F)(F)F)cs1	ZINC001339993453	1390204874	/nfs/dbraw/zinc/20/48/74/1390204874.db2.gz	ROQAVWGSTXLRKN-UWVGGRQHSA-N	0	3	335.395	3.413	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)NCc1ccc(OC)c(OC2CCCC2)c1	ZINC001340048348	1390215765	/nfs/dbraw/zinc/21/57/65/1390215765.db2.gz	WQSUGXKGSBSOBY-QGZVFWFLSA-N	0	3	346.471	3.316	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc2[nH]c([C@@H]3CCCO3)nc2c1	ZINC001340185241	1390245145	/nfs/dbraw/zinc/24/51/45/1390245145.db2.gz	SFDIITRAKYANJG-BBRMVZONSA-N	0	3	328.416	3.037	20	30		EGEDHN
C=CCC[C@H]1CCCN1c1nnc([C@H]2CCCN(C)C2)n1CC=C	ZINC001340207081	1390250445	/nfs/dbraw/zinc/25/04/45/1390250445.db2.gz	JMOGEIJHJMGYAO-IRXDYDNUSA-N	0	3	329.492	3.208	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)N1CCSC2(CCOCC2)C1	ZINC001340667862	1390341318	/nfs/dbraw/zinc/34/13/18/1390341318.db2.gz	VVCVQHWKSYATHX-INIZCTEOSA-N	0	3	342.549	3.189	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N[C@H]1CCc2c1cccc2Br	ZINC001341421778	1390485052	/nfs/dbraw/zinc/48/50/52/1390485052.db2.gz	FNCGVCDGGPBXBE-CABCVRRESA-N	0	3	337.261	3.236	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc(C(=O)N2CCCCCC2)cc1	ZINC001341483383	1390492505	/nfs/dbraw/zinc/49/25/05/1390492505.db2.gz	WFZIFCMTYHEZDQ-SFHVURJKSA-N	0	3	343.471	3.325	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)NCc1ccc(C)cc1OCC(F)(F)F	ZINC001341496228	1390494585	/nfs/dbraw/zinc/49/45/85/1390494585.db2.gz	IUMQOXCQQBSNKA-CQSZACIVSA-N	0	3	344.377	3.236	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N[C@@H](C)c1nc(-c2ccc(CC)cc2)no1	ZINC001341513746	1390496603	/nfs/dbraw/zinc/49/66/03/1390496603.db2.gz	CZJOVQFDIRFIIC-BBRMVZONSA-N	0	3	342.443	3.160	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)NCc1cccc(NC(=O)C2CCCC2)c1	ZINC001343180912	1390697769	/nfs/dbraw/zinc/69/77/69/1390697769.db2.gz	QRSCSRACJUGKGO-GOSISDBHSA-N	0	3	343.471	3.115	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)NCCc1ccc(N2CCCCC2)cc1	ZINC001343393526	1390711079	/nfs/dbraw/zinc/71/10/79/1390711079.db2.gz	SIQJCBHBBPOHSU-LJQANCHMSA-N	0	3	329.488	3.019	20	30		EGEDHN
C[C@H](NC(=O)C(C#N)C(=O)[C@H]1C[C@@H]1F)c1ccc(Cl)cc1Cl	ZINC001343442781	1390714272	/nfs/dbraw/zinc/71/42/72/1390714272.db2.gz	SFRIIIDTAKOHDV-CXSMTQNASA-N	0	3	343.185	3.237	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccc(OC)cc1Br	ZINC001343855430	1390740320	/nfs/dbraw/zinc/74/03/20/1390740320.db2.gz	YFDZQUSKPFBZJP-GFCCVEGCSA-N	0	3	327.222	3.080	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCc1ccc(OC(F)F)cc1	ZINC001347338596	1391057245	/nfs/dbraw/zinc/05/72/45/1391057245.db2.gz	SEEWQXTWSOFDNZ-AWEZNQCLSA-N	0	3	333.338	3.313	20	30		EGEDHN
CCCN1CCCC[C@H]1C(=O)N[C@@H]1CCCc2cc(C#N)ccc21	ZINC001348538139	1391234289	/nfs/dbraw/zinc/23/42/89/1391234289.db2.gz	UTSFFIAFEBFOHF-MOPGFXCFSA-N	0	3	325.456	3.316	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1ccccc1SC[C@H](C)C#N	ZINC001351187903	1391609106	/nfs/dbraw/zinc/60/91/06/1391609106.db2.gz	VTDHFOTXGHWQFL-OAHLLOKOSA-N	0	3	344.484	3.015	20	30		EGEDHN
CCC[C@@H](C)C(=O)NC[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001488818678	1391728990	/nfs/dbraw/zinc/72/89/90/1391728990.db2.gz	VKMQVGBNCCLWTA-FRFSOERESA-N	0	3	331.435	3.118	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@@H](CNC(=O)CCC3CCC3)C2)c(F)c1	ZINC001479288595	1392206034	/nfs/dbraw/zinc/20/60/34/1392206034.db2.gz	DHJSWRAQWOQXHT-MAEOIBBWSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C(Br)CN[C@H](C)[C@H]1CCCCN1C(=O)C(C)(C)F	ZINC001479817436	1392408912	/nfs/dbraw/zinc/40/89/12/1392408912.db2.gz	GLQAIQQIIWHZJC-VXGBXAGGSA-N	0	3	335.261	3.002	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H](CC)OC2CCCCC2)C1	ZINC001480138750	1392599082	/nfs/dbraw/zinc/59/90/82/1392599082.db2.gz	LMQLWWFAJNWPFT-IIAWOOMASA-N	0	3	328.884	3.104	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@H](C)NCc2ccc(C#N)s2)c(Cl)c1	ZINC001480540877	1392785631	/nfs/dbraw/zinc/78/56/31/1392785631.db2.gz	XMRAEJDPYARXQE-LBPRGKRZSA-N	0	3	347.871	3.490	20	30		EGEDHN
C[C@@H](CNC(=O)c1cccc2c1CCC2)NCc1ccc(C#N)s1	ZINC001491691741	1394527121	/nfs/dbraw/zinc/52/71/21/1394527121.db2.gz	HSSKBHBGOVTOMF-ZDUSSCGKSA-N	0	3	339.464	3.017	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2ccc(F)cn2)CCCC[C@@H]1C	ZINC001481955291	1394617214	/nfs/dbraw/zinc/61/72/14/1394617214.db2.gz	DWWJKLZGVNGVOV-SJCJKPOMSA-N	0	3	339.842	3.242	20	30		EGEDHN
Cc1cccc(CCC(=O)NC[C@@H](C)CNCc2ccccc2C#N)c1	ZINC001482126875	1394759158	/nfs/dbraw/zinc/75/91/58/1394759158.db2.gz	DBIJIRWHIATFJF-SFHVURJKSA-N	0	3	349.478	3.341	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)C3CCCC3)CCCC2)c(F)c1	ZINC001482208088	1394800981	/nfs/dbraw/zinc/80/09/81/1394800981.db2.gz	NOACNEDVUOWSBJ-UHFFFAOYSA-N	0	3	343.446	3.406	20	30		EGEDHN
CSC[C@@H](C)C(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001483962076	1395164563	/nfs/dbraw/zinc/16/45/63/1395164563.db2.gz	FNPXVRWZKBCKHZ-OAHLLOKOSA-N	0	3	345.512	3.028	20	30		EGEDHN
C[C@H](CNC(=O)c1ccc(Cl)cc1)N(C)Cc1ccc(C#N)cc1	ZINC001485374516	1395853877	/nfs/dbraw/zinc/85/38/77/1395853877.db2.gz	IWAHDKDDUVTATM-CQSZACIVSA-N	0	3	341.842	3.462	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)CC(C)(F)F)CCN1Cc1ccc(C#N)cc1	ZINC001502985339	1396237195	/nfs/dbraw/zinc/23/71/95/1396237195.db2.gz	FRAOJIJYXMDUCD-XJKSGUPXSA-N	0	3	335.398	3.073	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)c2cnoc2CC)CC1	ZINC001505399158	1396286704	/nfs/dbraw/zinc/28/67/04/1396286704.db2.gz	BKUVIQYIYRAMMR-UHFFFAOYSA-N	0	3	339.867	3.164	20	30		EGEDHN
Cc1cscc1C(=O)N(C)[C@@H](C)CNCc1ccc(C#N)s1	ZINC001496031033	1396588559	/nfs/dbraw/zinc/58/85/59/1396588559.db2.gz	JQZOWNIYFGTPRT-LBPRGKRZSA-N	0	3	333.482	3.240	20	30		EGEDHN
C=C(Br)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1ccco1	ZINC001689897362	1404192410	/nfs/dbraw/zinc/19/24/10/1404192410.db2.gz	XCQIXZKUMGJEAS-STQMWFEESA-N	0	3	341.249	3.161	20	30		EGEDHN
CCC1(C(=O)N[C@H](C)[C@@H]2CCCN(Cc3cccc(C#N)c3)C2)CC1	ZINC001690501235	1404613989	/nfs/dbraw/zinc/61/39/89/1404613989.db2.gz	IGARRYKXGNNAJA-VQIMIIECSA-N	0	3	339.483	3.465	20	30		EGEDHN
CCCc1occc1C(=O)NC[C@H](C)NCc1ccc(C#N)s1	ZINC001690638967	1404671234	/nfs/dbraw/zinc/67/12/34/1404671234.db2.gz	SKPHNHCLSVNZKM-LBPRGKRZSA-N	0	3	331.441	3.073	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)CCn1ccc2ccccc21	ZINC001690877990	1404791686	/nfs/dbraw/zinc/79/16/86/1404791686.db2.gz	ONAGIOJVZYZTJA-OAHLLOKOSA-N	0	3	333.863	3.268	20	30		EGEDHN
CCN(CCNC(=O)c1cccnc1C1CC1)Cc1ccc(C#N)cc1	ZINC001691029979	1404940189	/nfs/dbraw/zinc/94/01/89/1404940189.db2.gz	ZLJPYWNHKWYLHR-UHFFFAOYSA-N	0	3	348.450	3.083	20	30		EGEDHN
CCCc1occc1C(=O)NCCN(CC)Cc1ccc(C#N)cc1	ZINC001691048297	1404961704	/nfs/dbraw/zinc/96/17/04/1404961704.db2.gz	WJKCAKJUZZSVFB-UHFFFAOYSA-N	0	3	339.439	3.356	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)Cc2ccc(Cl)s2)C1	ZINC001691466357	1405286500	/nfs/dbraw/zinc/28/65/00/1405286500.db2.gz	DDMQJHCPMWWAOS-PHIMTYICSA-N	0	3	333.284	3.181	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)C2(c3ccccc3F)CC2)C1	ZINC001691474169	1405291510	/nfs/dbraw/zinc/29/15/10/1405291510.db2.gz	YUUOHBSCSFCQMG-OKILXGFUSA-N	0	3	336.838	3.094	20	30		EGEDHN
CC[C@@H](CNC(=O)c1c(C)oc(C)c1C)NCc1ccc(C#N)s1	ZINC001698606273	1406234018	/nfs/dbraw/zinc/23/40/18/1406234018.db2.gz	PXXVQTVJPKEBRV-AWEZNQCLSA-N	0	3	345.468	3.436	20	30		EGEDHN
CC[C@H](CNC(=O)CCc1ccccc1)NCc1ccc(C#N)s1	ZINC001732217756	1428465591	/nfs/dbraw/zinc/46/55/91/1428465591.db2.gz	OLJOWAKPPSXRCW-MRXNPFEDSA-N	0	3	341.480	3.237	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)CCC2CC2)CC1	ZINC001732305934	1428521771	/nfs/dbraw/zinc/52/17/71/1428521771.db2.gz	SLWBRTVNAYMVKB-HDJSIYSDSA-N	0	3	329.282	3.102	20	30		EGEDHN
Cc1oc(C)c(C(=O)N[C@@H](C)CNCc2ccc(F)c(C#N)c2)c1C	ZINC001699412959	1412726846	/nfs/dbraw/zinc/72/68/46/1412726846.db2.gz	IDZRCIXZGKCDKM-NSHDSACASA-N	0	3	343.402	3.124	20	30		EGEDHN
N#Cc1cc(CNC2(CNC(=O)C3CCCCCC3)CC2)ccc1F	ZINC001699647548	1413029008	/nfs/dbraw/zinc/02/90/08/1413029008.db2.gz	QDMZXIJFYJQUDR-UHFFFAOYSA-N	0	3	343.446	3.406	20	30		EGEDHN
C[C@@H](CC(=O)N(C)CCCN(C)Cc1ccc(F)c(C#N)c1)C1CC1	ZINC001700195546	1413634628	/nfs/dbraw/zinc/63/46/28/1413634628.db2.gz	QPLRXTYBVYBWPR-HNNXBMFYSA-N	0	3	345.462	3.414	20	30		EGEDHN
CCC(C)(C)C(=O)N[C@@H]1CCN(Cc2cccc(C#N)c2)[C@@H](C)C1	ZINC001700317231	1413778024	/nfs/dbraw/zinc/77/80/24/1413778024.db2.gz	FJBKQUHAWFJWKU-MAUKXSAKSA-N	0	3	327.472	3.464	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)Cc1c[nH]c2cccc(C)c12	ZINC001700327648	1413798671	/nfs/dbraw/zinc/79/86/71/1413798671.db2.gz	UIDWUCKGUARLAN-AWEZNQCLSA-N	0	3	333.863	3.256	20	30		EGEDHN
Cc1cccc(C(=O)NC[C@@H](C)N(C)Cc2ccc(C#N)cc2)c1F	ZINC001700461593	1414060657	/nfs/dbraw/zinc/06/06/57/1414060657.db2.gz	AESWLDLRPCRDOV-OAHLLOKOSA-N	0	3	339.414	3.256	20	30		EGEDHN
Cc1cccc(C(=O)NC[C@H](C)N(C)Cc2ccc(C#N)cc2)c1F	ZINC001700461591	1414061893	/nfs/dbraw/zinc/06/18/93/1414061893.db2.gz	AESWLDLRPCRDOV-HNNXBMFYSA-N	0	3	339.414	3.256	20	30		EGEDHN
C[C@H](CNC(=O)C1(C)CCCCC1)N(C)Cc1cccc(C#N)c1	ZINC001700473247	1414094113	/nfs/dbraw/zinc/09/41/13/1414094113.db2.gz	GJFRQGXZPHKRCJ-MRXNPFEDSA-N	0	3	327.472	3.465	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)C/C=C/c2ccc(F)cc2)C1	ZINC001707084102	1417191583	/nfs/dbraw/zinc/19/15/83/1417191583.db2.gz	GHCMTXNRSDAMIL-PDYYIGBGSA-N	0	3	336.838	3.466	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)Cc2ccc(F)c(Cl)c2)C1	ZINC001707089120	1417195566	/nfs/dbraw/zinc/19/55/66/1417195566.db2.gz	IGFYEDNXRMQFMT-JOCQHMNTSA-N	0	3	345.245	3.259	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1ccc2cc[nH]c2n1	ZINC001712998398	1417550126	/nfs/dbraw/zinc/55/01/26/1417550126.db2.gz	GTQODNVVUSIZOV-CJNGLKHVSA-N	0	3	346.862	3.288	20	30		EGEDHN
CC1(C(=O)NC[C@@H]2CCN(Cc3ccc(C#N)cc3)C2)CCCC1	ZINC001713533744	1418285081	/nfs/dbraw/zinc/28/50/81/1418285081.db2.gz	JOFBIAZFIYFCCQ-SFHVURJKSA-N	0	3	325.456	3.077	20	30		EGEDHN
CCCN(CCNC(=O)C1(F)CCCC1)Cc1cccc(C#N)c1	ZINC001713547726	1418320716	/nfs/dbraw/zinc/32/07/16/1418320716.db2.gz	HQEYLVODMJLZTJ-UHFFFAOYSA-N	0	3	331.435	3.169	20	30		EGEDHN
C=CCOCC(=O)N[C@H]1CCN(C2c3ccccc3-c3ccccc32)C1	ZINC001713817265	1418621124	/nfs/dbraw/zinc/62/11/24/1418621124.db2.gz	FWYOTJRQENCACJ-INIZCTEOSA-N	0	3	348.446	3.150	20	30		EGEDHN
N#Cc1ccc(CN[C@@H](CNC(=O)C2CCCCC2)C2CC2)s1	ZINC001713859637	1418656716	/nfs/dbraw/zinc/65/67/16/1418656716.db2.gz	IQHWQFBTHBGQGP-KRWDZBQOSA-N	0	3	331.485	3.184	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1cccc2ccncc21)C1CC1	ZINC001714174934	1418982499	/nfs/dbraw/zinc/98/24/99/1418982499.db2.gz	TUGINRWGTCCLCW-LJQANCHMSA-N	0	3	343.858	3.475	20	30		EGEDHN
Cc1ccc(C(=O)NCC[C@H](C)NCc2ccccc2C#N)cc1F	ZINC001714478833	1419201633	/nfs/dbraw/zinc/20/16/33/1419201633.db2.gz	XTRUIVIMIAPSTM-HNNXBMFYSA-N	0	3	339.414	3.304	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1oc(C(C)C)nc1C)C1CC1	ZINC001715119092	1419863838	/nfs/dbraw/zinc/86/38/38/1419863838.db2.gz	IYEQCIRSBXMAQI-KRWDZBQOSA-N	0	3	339.867	3.347	20	30		EGEDHN
CC(C)c1ccc(C(=O)N[C@@H](C)CNCc2ccc(C#N)s2)nc1	ZINC001716452514	1420667792	/nfs/dbraw/zinc/66/77/92/1420667792.db2.gz	GJMRFXGMAUFXGM-ZDUSSCGKSA-N	0	3	342.468	3.046	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](C)CN(C)Cc2cccc(C#N)c2)ccc1F	ZINC001716492855	1420714884	/nfs/dbraw/zinc/71/48/84/1420714884.db2.gz	XNGPFCDPASDNNC-OAHLLOKOSA-N	0	3	339.414	3.256	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)C[C@H]2CCCCO2)CC1	ZINC001717355014	1421289182	/nfs/dbraw/zinc/28/91/82/1421289182.db2.gz	AUCHYHBXWCDONI-QGZVFWFLSA-N	0	3	342.911	3.259	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)[C@@H](C)C(F)(F)F)CC1	ZINC001717356103	1421291028	/nfs/dbraw/zinc/29/10/28/1421291028.db2.gz	MJPBZYUIFVALKE-GFCCVEGCSA-N	0	3	340.817	3.498	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)Cc1ccc(F)cc1F	ZINC001717453490	1421383125	/nfs/dbraw/zinc/38/31/25/1421383125.db2.gz	RNQRJOYEOFCTBH-UHFFFAOYSA-N	0	3	344.833	3.334	20	30		EGEDHN
CC1(CNC(=O)CCCF)CCN(Cc2cccc(C#N)c2)CC1	ZINC001733450629	1429662570	/nfs/dbraw/zinc/66/25/70/1429662570.db2.gz	WQSNUHXFCRUYTN-UHFFFAOYSA-N	0	3	331.435	3.026	20	30		EGEDHN
C[C@@H](C(=O)NCC1(NCc2cccc(C#N)c2)CC1)c1ccsc1	ZINC001723558746	1424465394	/nfs/dbraw/zinc/46/53/94/1424465394.db2.gz	UYJGQNGANSVOON-CQSZACIVSA-N	0	3	339.464	3.162	20	30		EGEDHN
N#Cc1cc(CNC2(CNC(=O)[C@@H]3CC34CCC4)CCC2)ccc1F	ZINC001724797041	1425165300	/nfs/dbraw/zinc/16/53/00/1425165300.db2.gz	PSCATACGBBGOJN-INIZCTEOSA-N	0	3	341.430	3.016	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CCN(Cc3ccccc3C)C2)CCOCC1	ZINC001731374793	1427306968	/nfs/dbraw/zinc/30/69/68/1427306968.db2.gz	GCBIBAOAGXHOTE-LJQANCHMSA-N	0	3	342.483	3.058	20	30		EGEDHN
CC(C)(C(=O)NC[C@H]1CCCN(Cc2ccc(C#N)cc2)C1)C1CC1	ZINC001731500680	1427480460	/nfs/dbraw/zinc/48/04/60/1427480460.db2.gz	YOLOSHPKCVFDNL-GOSISDBHSA-N	0	3	339.483	3.323	20	30		EGEDHN
CCCN(CCNC(=O)c1ccc(C)o1)Cc1cccc(C#N)c1	ZINC001731863676	1428107464	/nfs/dbraw/zinc/10/74/64/1428107464.db2.gz	BUEYDCTVWVEXRR-UHFFFAOYSA-N	0	3	325.412	3.102	20	30		EGEDHN
CN(CCCN(C)C(=O)[C@H]1CC12CCC2)Cc1ccc(F)c(C#N)c1	ZINC001733778930	1430034918	/nfs/dbraw/zinc/03/49/18/1430034918.db2.gz	XTLYMSQFGWNJBU-QGZVFWFLSA-N	0	3	343.446	3.168	20	30		EGEDHN
CCc1ccccc1CC(=O)NC[C@@H](C)N(C)Cc1ccc(C#N)cc1	ZINC001734048637	1437837966	/nfs/dbraw/zinc/83/79/66/1437837966.db2.gz	XCEWZCDJSUWLBF-QGZVFWFLSA-N	0	3	349.478	3.300	20	30		EGEDHN
C=C(Br)CNC[C@H](C1CC1)N(C)C(=O)C1CC(C)(C)C1	ZINC001734298064	1438029693	/nfs/dbraw/zinc/02/96/93/1438029693.db2.gz	JAVLGFCZPNKOOS-CQSZACIVSA-N	0	3	343.309	3.158	20	30		EGEDHN
C[C@@H](CN(C)C(=O)C1C(C)(C)C1(C)C)NCc1ccc(C#N)s1	ZINC001734317778	1438046521	/nfs/dbraw/zinc/04/65/21/1438046521.db2.gz	CFSFWQXTRBUWTP-LBPRGKRZSA-N	0	3	333.501	3.238	20	30		EGEDHN
CN(CCCNC(=O)C[C@H]1C=CCCC1)Cc1ccc(C#N)c(F)c1	ZINC001751997074	1440131622	/nfs/dbraw/zinc/13/16/22/1440131622.db2.gz	CQQUMDQMHBSMLY-INIZCTEOSA-N	0	3	343.446	3.382	20	30		EGEDHN
Cc1cc[nH]c1C(=O)N1CCCC[C@@H]1[C@@H](C)NCC#Cc1ccccc1	ZINC001752144190	1440145384	/nfs/dbraw/zinc/14/53/84/1440145384.db2.gz	CFTCUFXOIXSZNV-UYAOXDASSA-N	0	3	349.478	3.348	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCCN(CC)Cc2scnc2C)cc1	ZINC001752201832	1440153785	/nfs/dbraw/zinc/15/37/85/1440153785.db2.gz	KJQQHZXPOLTAEY-UHFFFAOYSA-N	0	3	341.480	3.075	20	30		EGEDHN
CC#CCN(CCCNC(=O)c1ccc(-c2ccccc2)nc1)C1CC1	ZINC001752283109	1440164833	/nfs/dbraw/zinc/16/48/33/1440164833.db2.gz	LIPGHTCPEZGGJQ-UHFFFAOYSA-N	0	3	347.462	3.356	20	30		EGEDHN
CC1(CC(=O)N[C@H]2CC23CCN(Cc2cccc(C#N)c2)CC3)CC1	ZINC001752425235	1440176797	/nfs/dbraw/zinc/17/67/97/1440176797.db2.gz	CPXIQCQQQRGEKE-SFHVURJKSA-N	0	3	337.467	3.219	20	30		EGEDHN
CC(C)(C)CC(=O)NC[C@H](NCc1cc(C#N)ccc1F)C1CC1	ZINC001752453513	1440182765	/nfs/dbraw/zinc/18/27/65/1440182765.db2.gz	YILLASJHKFHFEZ-KRWDZBQOSA-N	0	3	331.435	3.118	20	30		EGEDHN
CC(C)C[C@@H](C)CC(=O)N[C@H]1C[C@H](NCC#Cc2ccccc2)C1	ZINC001752682532	1440199726	/nfs/dbraw/zinc/19/97/26/1440199726.db2.gz	RHPKXNLMGLYLHG-MISYRCLQSA-N	0	3	326.484	3.347	20	30		EGEDHN
C#CCCCCC(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1oc(C)nc1C	ZINC001752693706	1440200718	/nfs/dbraw/zinc/20/07/18/1440200718.db2.gz	GHTSENLTDNTODZ-AYHJJNSGSA-N	0	3	343.471	3.097	20	30		EGEDHN
CC[C@@H](C)[C@H](C)C(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001752771010	1440206098	/nfs/dbraw/zinc/20/60/98/1440206098.db2.gz	BOZOQUAIGIHXRD-GFOFROLCSA-N	0	3	331.435	3.116	20	30		EGEDHN
CC[C@H](C)[C@H](C)C(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001752771012	1440206106	/nfs/dbraw/zinc/20/61/06/1440206106.db2.gz	BOZOQUAIGIHXRD-MGBSGCIJSA-N	0	3	331.435	3.116	20	30		EGEDHN
C#CCCCC(=O)NC[C@@H]1CCCCN1Cc1ccc(COC)cc1	ZINC001752818332	1440219110	/nfs/dbraw/zinc/21/91/10/1440219110.db2.gz	AFQIPKFHHLTEGB-FQEVSTJZSA-N	0	3	342.483	3.107	20	30		EGEDHN
C=CCN1CCCC[C@H]1CNC(=O)Cc1coc2cc(F)ccc12	ZINC001752819378	1440219340	/nfs/dbraw/zinc/21/93/40/1440219340.db2.gz	USOOPDQJQXORSO-INIZCTEOSA-N	0	3	330.403	3.271	20	30		EGEDHN
C=CCOCCN1CCCC[C@H]1CNC(=O)[C@H]1CCC(C)=C(C)C1	ZINC001752820351	1440220287	/nfs/dbraw/zinc/22/02/87/1440220287.db2.gz	DHQYSXFLKGEPCW-OALUTQOASA-N	0	3	334.504	3.296	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@](C)(OC)c1ccccc1	ZINC001752823925	1440222594	/nfs/dbraw/zinc/22/25/94/1440222594.db2.gz	MUKXBZLLTITGDK-AZUAARDMSA-N	0	3	330.472	3.095	20	30		EGEDHN
C[C@H](NC(=O)CCC1CC1)[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001752835946	1440227795	/nfs/dbraw/zinc/22/77/95/1440227795.db2.gz	CSMDTKAYNNEARA-OXJNMPFZSA-N	0	3	339.483	3.465	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H](C)[C@@H]1CCCN(Cc2cnoc2C)C1	ZINC001752841874	1440230879	/nfs/dbraw/zinc/23/08/79/1440230879.db2.gz	SVXPXXGPZWIBTJ-FUHWJXTLSA-N	0	3	345.487	3.283	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@H](C)NCc1ccccc1OC1CC1	ZINC001752891621	1440241013	/nfs/dbraw/zinc/24/10/13/1440241013.db2.gz	NSBYNXMEPIBIAE-HNNXBMFYSA-N	0	3	330.472	3.424	20	30		EGEDHN
C[C@@H](CNC(=O)CCCC(F)(F)F)NCc1ccc(C#N)c(F)c1	ZINC001752906047	1440244200	/nfs/dbraw/zinc/24/42/00/1440244200.db2.gz	YLQWCKWWKBPQAZ-NSHDSACASA-N	0	3	345.340	3.024	20	30		EGEDHN
C=C(Cl)CNCCc1ccc(CNC(=O)Cc2cccs2)cc1	ZINC001752981816	1440257212	/nfs/dbraw/zinc/25/72/12/1440257212.db2.gz	RXMCUDAMNXIBGV-UHFFFAOYSA-N	0	3	348.899	3.492	20	30		EGEDHN
CC#CCN(C)[C@@H]1CCCN(C(=O)c2ccc(N(C)CCC)cc2)C1	ZINC001753001010	1440264703	/nfs/dbraw/zinc/26/47/03/1440264703.db2.gz	RBGXOISBWIOAMC-HXUWFJFHSA-N	0	3	341.499	3.093	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)Cc1c(C)[nH]c2ccccc21	ZINC001753013070	1440267585	/nfs/dbraw/zinc/26/75/85/1440267585.db2.gz	XIFIMGDRIYZAJD-CYBMUJFWSA-N	0	3	333.863	3.256	20	30		EGEDHN
CCN(CCNC(=O)[C@H]1CC[C@@H]2C[C@@H]2CC1)Cc1ccc(C#N)cc1	ZINC001753089619	1440298292	/nfs/dbraw/zinc/29/82/92/1440298292.db2.gz	XRKHTUNTZYZJCY-ACDBMABISA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@H]1CCN(Cc2c(C)noc2CC)C1	ZINC001753131105	1440316780	/nfs/dbraw/zinc/31/67/80/1440316780.db2.gz	MYBKFPDWFSELJK-OAHLLOKOSA-N	0	3	333.476	3.086	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCN(CCC)Cc2ccc(F)cc2)cc1	ZINC001753146288	1440324864	/nfs/dbraw/zinc/32/48/64/1440324864.db2.gz	PFAUQTJJELCOON-UHFFFAOYSA-N	0	3	338.426	3.449	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCN(Cc2cccc(N(C)C)c2)C2CC2)C1	ZINC001753159447	1440332917	/nfs/dbraw/zinc/33/29/17/1440332917.db2.gz	RULVMNIWNNHVIA-UHFFFAOYSA-N	0	3	341.499	3.190	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC([C@@H](C)NCc2cnc(C)o2)CC1	ZINC001753278864	1440346780	/nfs/dbraw/zinc/34/67/80/1440346780.db2.gz	VUPSKXPRKSJPLT-GDBMZVCRSA-N	0	3	333.476	3.302	20	30		EGEDHN
Cc1c[nH]cc1C(=O)NCCCN(Cc1ccc(C#N)s1)C(C)C	ZINC001753295562	1440352058	/nfs/dbraw/zinc/35/20/58/1440352058.db2.gz	WLXCHPPBNFOTAW-UHFFFAOYSA-N	0	3	344.484	3.287	20	30		EGEDHN
C=C(C)CN[C@H](CNC(=O)COc1ccc(F)cc1)c1ccccc1	ZINC001753302663	1440354501	/nfs/dbraw/zinc/35/45/01/1440354501.db2.gz	HRKVGKLBJCVAMK-LJQANCHMSA-N	0	3	342.414	3.228	20	30		EGEDHN
C=CCN[C@H](CNC(=O)c1ccnc(OC(C)C)c1)c1ccccc1	ZINC001753311251	1440356629	/nfs/dbraw/zinc/35/66/29/1440356629.db2.gz	KLLDZPHDHZGDHL-GOSISDBHSA-N	0	3	339.439	3.116	20	30		EGEDHN
C=C[C@@](C)(O)CC(=O)N(CCC)[C@@H]1CCN(Cc2cccc(C)c2)C1	ZINC001753316301	1440359869	/nfs/dbraw/zinc/35/98/69/1440359869.db2.gz	PEDQXZMOJATQFC-TZIWHRDSSA-N	0	3	344.499	3.135	20	30		EGEDHN
CC(C)CC(=O)NCC[C@H]1CCN(Cc2ccc(C#N)c(F)c2)C1	ZINC001753320842	1440363447	/nfs/dbraw/zinc/36/34/47/1440363447.db2.gz	JJABYYVUAIOTEU-HNNXBMFYSA-N	0	3	331.435	3.072	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@@H](CCNC(=O)CCC2CC2)C1	ZINC001753325635	1440366174	/nfs/dbraw/zinc/36/61/74/1440366174.db2.gz	YOLQPGDBFJHTCK-QGZVFWFLSA-N	0	3	325.456	3.077	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCC[C@@H]1CCN(Cc2ccccc2C#N)C1	ZINC001753336637	1440372744	/nfs/dbraw/zinc/37/27/44/1440372744.db2.gz	XKRSYDUTSUAFRU-QZTJIDSGSA-N	0	3	339.483	3.489	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@H](CN(C)Cc2cccc(C(C)C)n2)C1	ZINC001753348573	1440377042	/nfs/dbraw/zinc/37/70/42/1440377042.db2.gz	XESTYJIVVUUJAH-GOSISDBHSA-N	0	3	341.499	3.145	20	30		EGEDHN
C#CCCCCCC(=O)NCC1CN(Cc2cccc3cccnc32)C1	ZINC001753407510	1440392291	/nfs/dbraw/zinc/39/22/91/1440392291.db2.gz	MLLGADUPLMBPAZ-UHFFFAOYSA-N	0	3	349.478	3.367	20	30		EGEDHN
CCCCCCCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H]1CC12CCOCC2	ZINC001753427555	1440397440	/nfs/dbraw/zinc/39/74/40/1440397440.db2.gz	LEOWFTJUOYNLFR-OKZBNKHCSA-N	0	3	334.504	3.059	20	30		EGEDHN
C=CCCCCCN1CC[C@H](N(C)C(=O)c2snnc2C2CC2)C1	ZINC001753439666	1440401217	/nfs/dbraw/zinc/40/12/17/1440401217.db2.gz	QBOBYOXXHLZQPG-HNNXBMFYSA-N	0	3	348.516	3.308	20	30		EGEDHN
C=CCCCC(=O)N(C)[C@H]1CCN(CC[C@@H]2CC2(Cl)Cl)C1	ZINC001753442117	1440402069	/nfs/dbraw/zinc/40/20/69/1440402069.db2.gz	WAGXNDQBVHTUMN-KGLIPLIRSA-N	0	3	333.303	3.459	20	30		EGEDHN
CCN(C(=O)C#CC(C)C)[C@H]1CCN(Cc2cc(C)ccc2C)C1	ZINC001753455102	1440407957	/nfs/dbraw/zinc/40/79/57/1440407957.db2.gz	GVDWFHFEJIBOHS-FQEVSTJZSA-N	0	3	326.484	3.386	20	30		EGEDHN
C=CCOCCN1CC[C@H](N(CC)C(=O)c2cc(F)ccc2CC)C1	ZINC001753461525	1440410834	/nfs/dbraw/zinc/41/08/34/1440410834.db2.gz	MIRGALIYXOCIPZ-SFHVURJKSA-N	0	3	348.462	3.127	20	30		EGEDHN
C#CCC1(C(=O)NC[C@@H](CC)NCc2scnc2C)CCCCC1	ZINC001753497088	1440421998	/nfs/dbraw/zinc/42/19/98/1440421998.db2.gz	KOYZXOPAKDDSJX-MRXNPFEDSA-N	0	3	347.528	3.410	20	30		EGEDHN
Cc1nsc(C)c1CNC[C@](C)(NC(=O)C#CC(C)(C)C)C1CC1	ZINC001753518408	1440428070	/nfs/dbraw/zinc/42/80/70/1440428070.db2.gz	HPOASFDFDXJBLV-IBGZPJMESA-N	0	3	347.528	3.184	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)Cc2cncc(C)c2)CCCC[C@@H]1C	ZINC001753534388	1440432077	/nfs/dbraw/zinc/43/20/77/1440432077.db2.gz	SOQVYIVGLJQUQR-HNAYVOBHSA-N	0	3	349.906	3.340	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H](CCNCc2ccncc2Cl)C1	ZINC001753542790	1440433793	/nfs/dbraw/zinc/43/37/93/1440433793.db2.gz	OVPNOQABGJCGRQ-OAHLLOKOSA-N	0	3	335.879	3.420	20	30		EGEDHN
CC#CCCCC(=O)N[C@H]1CC[C@H](NCc2ccn(C(C)C)n2)CC1	ZINC001753583468	1440440689	/nfs/dbraw/zinc/44/06/89/1440440689.db2.gz	KNUOLFMJKHVAJX-IYARVYRRSA-N	0	3	344.503	3.175	20	30		EGEDHN
O=C(NCc1ccc(CNCC#Cc2ccccc2)cc1)c1ccoc1	ZINC001753597999	1440445423	/nfs/dbraw/zinc/44/54/23/1440445423.db2.gz	LFIBRLRTKWXXAL-UHFFFAOYSA-N	0	3	344.414	3.351	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC2(CCN(Cc3c(C)noc3C)C2)CC1	ZINC001753604276	1440447699	/nfs/dbraw/zinc/44/76/99/1440447699.db2.gz	XJRRPHPIGDDWFQ-UHFFFAOYSA-N	0	3	345.487	3.462	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)C[C@@H](C)C2CC2)CCCC1	ZINC001753671142	1440462238	/nfs/dbraw/zinc/46/22/38/1440462238.db2.gz	SDRFLBSHXBJSMQ-GFCCVEGCSA-N	0	3	343.309	3.350	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2sccc2OC)CCCC1	ZINC001753671630	1440462307	/nfs/dbraw/zinc/46/23/07/1440462307.db2.gz	WOVULHOUYHMOMR-UHFFFAOYSA-N	0	3	328.865	3.141	20	30		EGEDHN
C=CC1(CC(=O)N2CCC3(CN([C@H](C)COC)C3)CC2)CCCCC1	ZINC001753674663	1440462996	/nfs/dbraw/zinc/46/29/96/1440462996.db2.gz	BHPSGGLJSIOTPV-GOSISDBHSA-N	0	3	348.531	3.472	20	30		EGEDHN
C[C@H](CNCC#Cc1ccccc1Cl)N(C)C(=O)CCC1CC1	ZINC001753684087	1440465214	/nfs/dbraw/zinc/46/52/14/1440465214.db2.gz	XYZFGZPPPDEIJV-OAHLLOKOSA-N	0	3	332.875	3.318	20	30		EGEDHN
C[C@@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)C1CC(C)(C)C1	ZINC001753690963	1440466593	/nfs/dbraw/zinc/46/65/93/1440466593.db2.gz	ZGDDURXNZPFDNG-ZDUSSCGKSA-N	0	3	331.435	3.070	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N(C)[C@H](C)CNCc1cccc(NC(C)=O)c1	ZINC001753708036	1440469878	/nfs/dbraw/zinc/46/98/78/1440469878.db2.gz	XLKOQBOHTIUPBQ-OAHLLOKOSA-N	0	3	345.487	3.184	20	30		EGEDHN
C[C@@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)[C@@H]1CC[C@@H](C)CC1	ZINC001753723796	1440473827	/nfs/dbraw/zinc/47/38/27/1440473827.db2.gz	POGXJOBVTXXADM-ZOBUZTSGSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC(C)C[C@H](CNCc1ccc(C#N)s1)NC(=O)c1ccoc1	ZINC001753732823	1440476724	/nfs/dbraw/zinc/47/67/24/1440476724.db2.gz	KUYMHWMFXIQWGP-CQSZACIVSA-N	0	3	331.441	3.147	20	30		EGEDHN
Cc1nn(C(C)C)cc1CNC[C@@H](CC(C)C)NC(=O)C#CC(C)C	ZINC001753734429	1440477119	/nfs/dbraw/zinc/47/71/19/1440477119.db2.gz	AUUUSPYPWNTCSN-LJQANCHMSA-N	0	3	346.519	3.052	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H](CNCc1cn(C)nc1C)C1CCCCC1	ZINC001753746437	1440481212	/nfs/dbraw/zinc/48/12/12/1440481212.db2.gz	VZWSLTVEZBQKFR-LJQANCHMSA-N	0	3	346.519	3.240	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H](C)[C@H]1CNCc1cn(C(C)C)nc1C	ZINC001753805821	1440491723	/nfs/dbraw/zinc/49/17/23/1440491723.db2.gz	RZSAEVFADXFODJ-VQIMIIECSA-N	0	3	346.519	3.455	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@@H]([C@H](C)NCc2cscn2)C1	ZINC001753815525	1440493674	/nfs/dbraw/zinc/49/36/74/1440493674.db2.gz	OBAIOZRTZWHMAU-JKSUJKDBSA-N	0	3	333.501	3.053	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@H](NCc1cccc(Cl)n1)C(C)C	ZINC001753837026	1440501470	/nfs/dbraw/zinc/50/14/70/1440501470.db2.gz	JDNUWWKKBRAFMY-MRXNPFEDSA-N	0	3	335.879	3.159	20	30		EGEDHN
C=C(Br)CN[C@H](CNC(=O)c1occc1Cl)C(C)C	ZINC001753838089	1440501681	/nfs/dbraw/zinc/50/16/81/1440501681.db2.gz	NJHJDHMKHQZFTG-LLVKDONJSA-N	0	3	349.656	3.186	20	30		EGEDHN
CC(C)[C@H](CNC(=O)C1(C(C)(F)F)CC1)NCC#Cc1ccccc1	ZINC001753840769	1440502482	/nfs/dbraw/zinc/50/24/82/1440502482.db2.gz	LRPQXMOKZBQHSB-KRWDZBQOSA-N	0	3	348.437	3.204	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H]2[C@@H](CCN2Cc2oc(CC)nc2C)C1	ZINC001753873356	1440518237	/nfs/dbraw/zinc/51/82/37/1440518237.db2.gz	SCZYWYPUBNRWGJ-IRXDYDNUSA-N	0	3	345.487	3.325	20	30		EGEDHN
CCN(CCNCc1ccc(F)c(C#N)c1)C(=O)c1ccccc1C	ZINC001754030988	1440533789	/nfs/dbraw/zinc/53/37/89/1440533789.db2.gz	NJFRZCLRPUDFQN-UHFFFAOYSA-N	0	3	339.414	3.258	20	30		EGEDHN
Cc1cc(C)c(C(=O)N[C@H](C)CNCc2ccc(C#N)c(F)c2)s1	ZINC001754227952	1440553591	/nfs/dbraw/zinc/55/35/91/1440553591.db2.gz	VPAXXNJYRBLANO-GFCCVEGCSA-N	0	3	345.443	3.284	20	30		EGEDHN
CCCC[C@@](C)(F)C(=O)N[C@@H](C)CNCc1ccc(F)c(C#N)c1	ZINC001754273588	1440561925	/nfs/dbraw/zinc/56/19/25/1440561925.db2.gz	XTOFZVBSWSFOMG-SCLBCKFNSA-N	0	3	337.414	3.210	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H](C)CN(C)CCOc1cccc(Cl)c1	ZINC001754318785	1440576971	/nfs/dbraw/zinc/57/69/71/1440576971.db2.gz	KDHQQOGPCYDSFL-CQSZACIVSA-N	0	3	338.879	3.368	20	30		EGEDHN
C=C(Cl)CNCCCN(C)C(=O)c1c(C)nn(C(C)(C)C)c1C	ZINC001754373551	1440592759	/nfs/dbraw/zinc/59/27/59/1440592759.db2.gz	IDBNNLWKWOKKAH-UHFFFAOYSA-N	0	3	340.899	3.059	20	30		EGEDHN
C=C(Br)CNCCCN(C)C(=O)c1ccoc1C(C)C	ZINC001754417988	1440597034	/nfs/dbraw/zinc/59/70/34/1440597034.db2.gz	QSDZDRVQBOGCPB-UHFFFAOYSA-N	0	3	343.265	3.363	20	30		EGEDHN
CC(C(=O)N[C@H](CNCc1ccc(C#N)s1)C1CC1)=C1CCC1	ZINC001754440120	1440598954	/nfs/dbraw/zinc/59/89/54/1440598954.db2.gz	UGHYCPFTTSJHJT-QGZVFWFLSA-N	0	3	329.469	3.105	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@H]1CCN1CC1CCC(C(F)(F)F)CC1	ZINC001754484378	1440608394	/nfs/dbraw/zinc/60/83/94/1440608394.db2.gz	ZZVSFFKPXXIWIL-UYSNPLJNSA-N	0	3	344.421	3.205	20	30		EGEDHN
C[C@@H]1CCC[C@]1(C)C(=O)NCC1(NCc2ccc(C#N)c(F)c2)CC1	ZINC001754523950	1440620516	/nfs/dbraw/zinc/62/05/16/1440620516.db2.gz	NTMLOLHHCRBCNE-KUHUBIRLSA-N	0	3	343.446	3.262	20	30		EGEDHN
CC[C@H](C)[C@@H](C)C(=O)NCC1(NCc2ccc(F)c(C#N)c2)CC1	ZINC001754530625	1440622373	/nfs/dbraw/zinc/62/23/73/1440622373.db2.gz	YNRPDPZLNAMNAT-UONOGXRCSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@H]2CCC[C@@H](C1)N2C[C@H](OCC)C1CC1	ZINC001754553142	1440630600	/nfs/dbraw/zinc/63/06/00/1440630600.db2.gz	WJXJBFKFSZBNMA-LMCOJAPRSA-N	0	3	348.531	3.469	20	30		EGEDHN
C#CCN(C(=O)CC)C1CCN([C@@H]2CCc3ccc(F)cc32)CC1	ZINC001754632150	1440648071	/nfs/dbraw/zinc/64/80/71/1440648071.db2.gz	LHUVVTWSNSITNA-LJQANCHMSA-N	0	3	328.431	3.149	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)Cc2coc3ccc(C)cc23)C1	ZINC001754674053	1440659258	/nfs/dbraw/zinc/65/92/58/1440659258.db2.gz	MLBHSBGGYXLODA-FQEVSTJZSA-N	0	3	326.440	3.440	20	30		EGEDHN
C=CCOCCN1CC[C@](C)(NC(=O)C/C=C/c2ccc(F)cc2)C1	ZINC001754675542	1440659581	/nfs/dbraw/zinc/65/95/81/1440659581.db2.gz	RAYJOEACCLFHMZ-SGSXCFNPSA-N	0	3	346.446	3.012	20	30		EGEDHN
CC[C@H](F)C(=O)NC[C@@]1(C)CCCN(Cc2cccc(C#N)c2)C1	ZINC001754730930	1440679236	/nfs/dbraw/zinc/67/92/36/1440679236.db2.gz	ZMUKZZRCLQVRAC-PKOBYXMFSA-N	0	3	331.435	3.025	20	30		EGEDHN
C=CCN1CCC[C@](C)(CNC(=O)c2cc3nc(C)ccc3o2)C1	ZINC001754732794	1440680733	/nfs/dbraw/zinc/68/07/33/1440680733.db2.gz	CFUDNHKUOFRRCD-LJQANCHMSA-N	0	3	327.428	3.154	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@]1(O)CCN([C@@H](C)c2ccc(F)cc2)C1	ZINC001754756384	1440685199	/nfs/dbraw/zinc/68/51/99/1440685199.db2.gz	MHOZYCJRXAMJDN-YWZLYKJASA-N	0	3	348.462	3.042	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)C2(CCF)CC2)C1	ZINC001754796456	1440689523	/nfs/dbraw/zinc/68/95/23/1440689523.db2.gz	BVPGSLKTQQNIHY-QAPCUYQASA-N	0	3	343.446	3.025	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@]1(CO)CCCN([C@@H](C)c2ccccc2)C1	ZINC001754856613	1440700566	/nfs/dbraw/zinc/70/05/66/1440700566.db2.gz	NWYGZCANBXVJPI-UWJYYQICSA-N	0	3	344.499	3.293	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@]1(CO)CCCN(Cc2ccccc2C)C1	ZINC001754858157	1440700588	/nfs/dbraw/zinc/70/05/88/1440700588.db2.gz	VNDBPEOSOXHYKQ-WIYYLYMNSA-N	0	3	344.499	3.040	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@H]2[C@H]1CCN2CCc1ccns1	ZINC001754869545	1440704616	/nfs/dbraw/zinc/70/46/16/1440704616.db2.gz	YWOOBHNMPVNXIH-DLBZAZTESA-N	0	3	333.501	3.107	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCN(C(=O)c2ccc3nc(C)oc3c2)C1	ZINC001754919443	1440709111	/nfs/dbraw/zinc/70/91/11/1440709111.db2.gz	SEEUVCBCDRIMDG-CQSZACIVSA-N	0	3	347.846	3.331	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](CCNCc2cccnc2OC)C1	ZINC001754926926	1440709885	/nfs/dbraw/zinc/70/98/85/1440709885.db2.gz	WSQPVYIWBXDWPA-INIZCTEOSA-N	0	3	345.487	3.021	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CC[C@@H](CCNCc2ccccc2C#N)C1	ZINC001754934806	1440711142	/nfs/dbraw/zinc/71/11/42/1440711142.db2.gz	SINCEGULKYLDDM-DLBZAZTESA-N	0	3	327.472	3.179	20	30		EGEDHN
C#CCN[C@@H](C)c1ccc(CNC(=O)c2coc(C(F)F)c2)cc1	ZINC001754947965	1440713974	/nfs/dbraw/zinc/71/39/74/1440713974.db2.gz	CUIUOHDRUASTQF-LBPRGKRZSA-N	0	3	332.350	3.431	20	30		EGEDHN
C#CCN[C@@H](C)c1ccc(CNC(=O)CCCc2cccnc2)cc1	ZINC001754948230	1440714131	/nfs/dbraw/zinc/71/41/31/1440714131.db2.gz	GUZJWLVLXPITRN-KRWDZBQOSA-N	0	3	335.451	3.005	20	30		EGEDHN
C#CCN[C@@H](C)c1ccc(CNC(=O)[C@@H]2Cc3ccc(F)cc32)cc1	ZINC001754948593	1440714248	/nfs/dbraw/zinc/71/42/48/1440714248.db2.gz	LDNNGAQQNUHHCT-VBKZILBWSA-N	0	3	336.410	3.066	20	30		EGEDHN
C#CCN[C@H](C)c1ccc(CNC(=O)c2ccc3cnccc3c2)cc1	ZINC001754949135	1440714584	/nfs/dbraw/zinc/71/45/84/1440714584.db2.gz	WQCZWHUYQZJAAE-MRXNPFEDSA-N	0	3	343.430	3.449	20	30		EGEDHN
COCC#CCN[C@H](C)c1ccc(CNC(=O)/C=C/C(C)(C)C)cc1	ZINC001754954375	1440715989	/nfs/dbraw/zinc/71/59/89/1440715989.db2.gz	RWCHKYRCYDZVAK-GZKZCVOOSA-N	0	3	342.483	3.206	20	30		EGEDHN
C=CCN(C)Cc1ccccc1CNC(=O)c1cn2c(cccc2C)n1	ZINC001754955281	1440716296	/nfs/dbraw/zinc/71/62/96/1440716296.db2.gz	ZIWXXAVKKQVHOF-UHFFFAOYSA-N	0	3	348.450	3.191	20	30		EGEDHN
CC/C=C(\C)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001754958406	1440716992	/nfs/dbraw/zinc/71/69/92/1440716992.db2.gz	GPQMQPLJROQRJF-YAXRCOADSA-N	0	3	337.467	3.339	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCC1(NCc2ccc(C#N)s2)CCC1	ZINC001754985518	1440722622	/nfs/dbraw/zinc/72/26/22/1440722622.db2.gz	UVTWTTIQMDLMJC-CQSZACIVSA-N	0	3	331.485	3.351	20	30		EGEDHN
C=CCC1(C(=O)N2CCO[C@@H](CNCc3ccsc3)C2)CCCC1	ZINC001755018316	1440726307	/nfs/dbraw/zinc/72/63/07/1440726307.db2.gz	WTDLEQFJDDMYFP-KRWDZBQOSA-N	0	3	348.512	3.202	20	30		EGEDHN
C/C(=C/C(=O)N[C@H]1CCCN(Cc2cccc(C#N)c2)CC1)C1CC1	ZINC001755022082	1440727067	/nfs/dbraw/zinc/72/70/67/1440727067.db2.gz	YNZOVSRGEMXNON-WNJRYGEDSA-N	0	3	337.467	3.385	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CCCN(Cc2c(C)onc2CC)CC1	ZINC001755027565	1440729493	/nfs/dbraw/zinc/72/94/93/1440729493.db2.gz	BYYKDKIAHFFCQW-MRXNPFEDSA-N	0	3	333.476	3.372	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)C[C@H](C)c2cccc(F)c2)CC1	ZINC001755028956	1440730279	/nfs/dbraw/zinc/73/02/79/1440730279.db2.gz	KACYYHQZQSFNAS-QFBILLFUSA-N	0	3	330.447	3.313	20	30		EGEDHN
CC(F)(F)CC(=O)N[C@H]1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC001755030293	1440731059	/nfs/dbraw/zinc/73/10/59/1440731059.db2.gz	XILQSZJJLRXZRC-INIZCTEOSA-N	0	3	335.398	3.074	20	30		EGEDHN
CCCCC[C@H](CC)C(=O)N[C@H]1CCCN(CC#CCOC)CC1	ZINC001755033797	1440733069	/nfs/dbraw/zinc/73/30/69/1440733069.db2.gz	FHEKTGZCULOBMN-OALUTQOASA-N	0	3	336.520	3.213	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H]([C@H]2CCCN(C/C=C\Cl)C2)C1	ZINC001755048299	1440742432	/nfs/dbraw/zinc/74/24/32/1440742432.db2.gz	VQPIULDBWXJHSM-UZORRUGTSA-N	0	3	336.907	3.493	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)NCc1ccc2c(c1)CN(CC/C=C/CC)C2	ZINC001755100814	1440752138	/nfs/dbraw/zinc/75/21/38/1440752138.db2.gz	HZZHHXDRFYAGDR-BXKJMJEDSA-N	0	3	342.483	3.302	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)Cc3c(C)noc3C)cc2C1	ZINC001755101532	1440752619	/nfs/dbraw/zinc/75/26/19/1440752619.db2.gz	NQBOTSSJNLXPOF-UHFFFAOYSA-N	0	3	339.439	3.042	20	30		EGEDHN
Cc1cc(F)ccc1CN1CC[C@H](NC(=O)[C@H](C)C#N)C(C)(C)C1	ZINC001755139380	1440759531	/nfs/dbraw/zinc/75/95/31/1440759531.db2.gz	HUMSIFDEHKBOHL-PBHICJAKSA-N	0	3	331.435	3.011	20	30		EGEDHN
C=CCCCCCN1CCOC2(CCN(C(=O)[C@@H](C)C3CC3)CC2)C1	ZINC001755174152	1440770260	/nfs/dbraw/zinc/77/02/60/1440770260.db2.gz	LMUAMKXLHBHJSR-SFHVURJKSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)CCc2cccnc2)CC1	ZINC001755183798	1440771990	/nfs/dbraw/zinc/77/19/90/1440771990.db2.gz	SAKPESQWIDLFCK-UHFFFAOYSA-N	0	3	349.906	3.327	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCN1C(=O)C(C)(C)c1ccccc1OC	ZINC001755202346	1440780637	/nfs/dbraw/zinc/78/06/37/1440780637.db2.gz	DGMCJKGICISBHX-MRXNPFEDSA-N	0	3	330.472	3.082	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H]([C@H]2CCN(Cc3conc3C)C2)C1	ZINC001755203345	1440781403	/nfs/dbraw/zinc/78/14/03/1440781403.db2.gz	VALVTHXADZPZSS-IRXDYDNUSA-N	0	3	331.460	3.010	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H](C)[C@H](C)NCC#Cc2cccc(Cl)c2)co1	ZINC001755235121	1440787935	/nfs/dbraw/zinc/78/79/35/1440787935.db2.gz	YMYZQHHLXUPDNN-GJZGRUSLSA-N	0	3	344.842	3.390	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)s1)[C@H](C)NC(=O)CCc1ccsc1	ZINC001755237573	1440788673	/nfs/dbraw/zinc/78/86/73/1440788673.db2.gz	NPEHHCXVWAOIBQ-OLZOCXBDSA-N	0	3	347.509	3.297	20	30		EGEDHN
C=C(Br)CNCC(C)(C)CN(C)C(=O)C(C)=C1CCC1	ZINC001755280534	1440800448	/nfs/dbraw/zinc/80/04/48/1440800448.db2.gz	KCQGGNSPLZNZBQ-UHFFFAOYSA-N	0	3	343.309	3.470	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)Cc1ccc(CC)cn1	ZINC001755285226	1440801823	/nfs/dbraw/zinc/80/18/23/1440801823.db2.gz	GUAPRYJPKLFQHS-UHFFFAOYSA-N	0	3	337.895	3.013	20	30		EGEDHN
CCc1ccccc1C(=O)NC[C@@H](C)N(C)Cc1ccc(C#N)cc1	ZINC001755315170	1440815372	/nfs/dbraw/zinc/81/53/72/1440815372.db2.gz	ZCAREZXJOJAWLP-MRXNPFEDSA-N	0	3	335.451	3.371	20	30		EGEDHN
CCc1ccsc1C(=O)NC[C@H](C)N(C)Cc1cccc(C#N)c1	ZINC001755328945	1440823386	/nfs/dbraw/zinc/82/33/86/1440823386.db2.gz	VFCSRGLHWIFOPZ-AWEZNQCLSA-N	0	3	341.480	3.432	20	30		EGEDHN
O=C(NC1(CNCC#Cc2ccccc2)CCCCC1)c1ccco1	ZINC001755346832	1440826708	/nfs/dbraw/zinc/82/67/08/1440826708.db2.gz	RZQOLDLNBJKPBD-UHFFFAOYSA-N	0	3	336.435	3.354	20	30		EGEDHN
C#CCN1CCCCC[C@H]1CNC(=O)[C@H](CC)c1ccc(OC)cc1	ZINC001755367319	1440835394	/nfs/dbraw/zinc/83/53/94/1440835394.db2.gz	FSESBPBRIWLHFZ-AZUAARDMSA-N	0	3	342.483	3.183	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)COc1ccccc1CC	ZINC001755369012	1440836738	/nfs/dbraw/zinc/83/67/38/1440836738.db2.gz	ZFLANRQUXMSXAE-LJQANCHMSA-N	0	3	342.483	3.012	20	30		EGEDHN
CC#CCCCC(=O)N[C@H](C)C1CN(Cc2cc(C)sc2C)C1	ZINC001755383079	1440839895	/nfs/dbraw/zinc/83/98/95/1440839895.db2.gz	HLUFTJZTOHGRSR-OAHLLOKOSA-N	0	3	332.513	3.495	20	30		EGEDHN
C#CCCN1CC([C@@H](C)NC(=O)C[C@H](c2ccccc2)C(C)C)C1	ZINC001755388195	1440841135	/nfs/dbraw/zinc/84/11/35/1440841135.db2.gz	AOOXTJHFJNQOMC-XLIONFOSSA-N	0	3	326.484	3.276	20	30		EGEDHN
C=CCOCC(=O)N[C@@H]1CN([C@H](CC)c2ccc(F)cc2)CC1(C)C	ZINC001755406124	1440844392	/nfs/dbraw/zinc/84/43/92/1440844392.db2.gz	KFKSZNIAVCLHGR-QZTJIDSGSA-N	0	3	348.462	3.306	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@H]2[C@H]3CN(Cc4ccc(Cl)cc4)C[C@H]32)C1	ZINC001755430075	1440850995	/nfs/dbraw/zinc/85/09/95/1440850995.db2.gz	AQFXBZBIRQOOMK-NNZMDNLPSA-N	0	3	344.886	3.490	20	30		EGEDHN
C=C(Br)CNC[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2C(C)(C)C)C1	ZINC001755474701	1440859311	/nfs/dbraw/zinc/85/93/11/1440859311.db2.gz	OZMRNJDRJWSDHV-AAVRWANBSA-N	0	3	343.309	3.062	20	30		EGEDHN
C=C(Br)CNC[C@@H](C1CC1)N(C)C(=O)[C@H](C)C(C)(C)C	ZINC001755559895	1440874248	/nfs/dbraw/zinc/87/42/48/1440874248.db2.gz	LUBPCNZOUWPALK-JSGCOSHPSA-N	0	3	345.325	3.404	20	30		EGEDHN
Cc1ccc(CN[C@H](C)CN(C)C(=O)c2cc(C#N)c[nH]2)c(Cl)c1	ZINC001755583441	1440879846	/nfs/dbraw/zinc/87/98/46/1440879846.db2.gz	GPLUAAKHHFWCON-CYBMUJFWSA-N	0	3	344.846	3.099	20	30		EGEDHN
C#Cc1cncc(C(=O)N(C)C[C@@H](C)N[C@H](C)c2ccccc2F)c1	ZINC001755604339	1440885058	/nfs/dbraw/zinc/88/50/58/1440885058.db2.gz	UJQPDFFEHLCGOW-HUUCEWRRSA-N	0	3	339.414	3.013	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@H](NCc2cc(Cl)ccc2F)[C@H]1C	ZINC001755653889	1440891706	/nfs/dbraw/zinc/89/17/06/1440891706.db2.gz	LPZHVDVNOFFBFU-DYVFJYSZSA-N	0	3	336.838	3.218	20	30		EGEDHN
CCC(CC)CC(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@H]1C	ZINC001755662709	1440893019	/nfs/dbraw/zinc/89/30/19/1440893019.db2.gz	BLQWBVPUYZJXGO-XLIONFOSSA-N	0	3	326.484	3.443	20	30		EGEDHN
C=CCCC(=O)N1C[C@H](NCc2cc(Cl)cc3c2OCC3)C[C@H]1C	ZINC001755671783	1440894102	/nfs/dbraw/zinc/89/41/02/1440894102.db2.gz	BWCIIPFBZLWDRS-CXAGYDPISA-N	0	3	348.874	3.320	20	30		EGEDHN
Cc1cc(C)cc(CN2CCC[C@H](NC(=O)CSCC#N)[C@@H]2C)c1	ZINC001755715126	1440904809	/nfs/dbraw/zinc/90/48/09/1440904809.db2.gz	UQQRZTJMFGLNLV-WMZOPIPTSA-N	0	3	345.512	3.029	20	30		EGEDHN
Cc1cc(C)cc(CN2CCC[C@@H](NC(=O)CSCC#N)[C@@H]2C)c1	ZINC001755715124	1440904867	/nfs/dbraw/zinc/90/48/67/1440904867.db2.gz	UQQRZTJMFGLNLV-FUHWJXTLSA-N	0	3	345.512	3.029	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1CCCN(CCOCC2CCC2)[C@H]1C	ZINC001755718730	1440906405	/nfs/dbraw/zinc/90/64/05/1440906405.db2.gz	OZWRQAHLXOYNSF-WMZOPIPTSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1CCCN(CCOCC2CCC2)[C@@H]1C	ZINC001755718727	1440906410	/nfs/dbraw/zinc/90/64/10/1440906410.db2.gz	OZWRQAHLXOYNSF-AEFFLSMTSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1CC[C@H](CNCc2nc(C)sc2C)C1	ZINC001755742884	1440911906	/nfs/dbraw/zinc/91/19/06/1440911906.db2.gz	GEBAHWLNYZWZJE-GJZGRUSLSA-N	0	3	335.517	3.347	20	30		EGEDHN
CC1(C)CN(C(=O)/C=C\c2ccco2)C[C@H]1NCC#Cc1ccccc1	ZINC001755751483	1440913267	/nfs/dbraw/zinc/91/32/67/1440913267.db2.gz	PZBLMAXBCSDHRB-GHYICZDASA-N	0	3	348.446	3.171	20	30		EGEDHN
C=C(Br)CNC[C@H](NC(=O)CC1CCC1)C(C)(C)C	ZINC001755820442	1440925458	/nfs/dbraw/zinc/92/54/58/1440925458.db2.gz	PVOOKUULBMCROJ-ZDUSSCGKSA-N	0	3	331.298	3.206	20	30		EGEDHN
CC(C)(C)[C@@H](CNCc1ccc(C#N)s1)NC(=O)CCC(F)F	ZINC001755828441	1440928022	/nfs/dbraw/zinc/92/80/22/1440928022.db2.gz	IJOTZWCMXWLWJE-CYBMUJFWSA-N	0	3	343.443	3.286	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H](C)C1CCN(Cc2cccnc2C)CC1	ZINC001755847490	1440933886	/nfs/dbraw/zinc/93/38/86/1440933886.db2.gz	BOQCCIDAVNLHMX-INIZCTEOSA-N	0	3	329.488	3.319	20	30		EGEDHN
C#CCN1CCC([C@H](C)NC(=O)CCc2cc(Cl)cs2)CC1	ZINC001755850292	1440934654	/nfs/dbraw/zinc/93/46/54/1440934654.db2.gz	JPLXDLOQKNQVKC-ZDUSSCGKSA-N	0	3	338.904	3.184	20	30		EGEDHN
C#CCCCC(=O)NCc1ccc(CNCCC(F)(F)F)cc1F	ZINC001755901289	1440944007	/nfs/dbraw/zinc/94/40/07/1440944007.db2.gz	LXEFSXLWNFBJPI-UHFFFAOYSA-N	0	3	344.352	3.287	20	30		EGEDHN
N#CC1(c2ccccc2)CC(N[C@H](COC(N)=O)Cc2ccccc2)C1	ZINC001771735177	1441415597	/nfs/dbraw/zinc/41/55/97/1441415597.db2.gz	TXINTAJJQBPRQV-JSOIOWGOSA-N	0	3	349.434	3.321	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(Br)c(C)c2)CC1	ZINC000050027112	214039892	/nfs/dbraw/zinc/03/98/92/214039892.db2.gz	AATZBNIKQDBAPE-UHFFFAOYSA-N	0	3	335.245	3.041	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNc1ncc(Br)cn1)C(C)C	ZINC000078582932	217080952	/nfs/dbraw/zinc/08/09/52/217080952.db2.gz	HLAJTQOAZNRLRS-AWEZNQCLSA-N	0	3	339.281	3.350	20	30		EGEDHN
CCOCCCN1CC[C@H](Nc2snc(Cl)c2C#N)[C@H](C)C1	ZINC000265177039	247271482	/nfs/dbraw/zinc/27/14/82/247271482.db2.gz	CYOLZSMRWSQJEE-YPMHNXCESA-N	0	3	342.896	3.217	20	30		EGEDHN
COCCN1CCC(Nc2c(C#N)cnc3ccc(Cl)cc32)CC1	ZINC000266418324	248291473	/nfs/dbraw/zinc/29/14/73/248291473.db2.gz	ROGOKXJKUNTKBF-UHFFFAOYSA-N	0	3	344.846	3.283	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CCC(N2CCCC2=O)CC1	ZINC000095425734	218367365	/nfs/dbraw/zinc/36/73/65/218367365.db2.gz	BILYIOVXKNXVPY-UHFFFAOYSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@H](c1ccccn1)N1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000267384740	251006686	/nfs/dbraw/zinc/00/66/86/251006686.db2.gz	NKLZVXZBCGWJHR-OAHLLOKOSA-N	0	3	334.423	3.365	20	30		EGEDHN
CCN(CC(=O)Nc1c(C#N)cnn1-c1ccccc1)[C@H](C)C(C)C	ZINC000118833314	221191757	/nfs/dbraw/zinc/19/17/57/221191757.db2.gz	UIVZBXGIYUXTFS-OAHLLOKOSA-N	0	3	339.443	3.049	20	30		EGEDHN
N#Cc1ccc(CNc2cccc(CN3CCC(CO)CC3)c2)s1	ZINC000119702220	221382262	/nfs/dbraw/zinc/38/22/62/221382262.db2.gz	CQDZUNSQJBJRDN-UHFFFAOYSA-N	0	3	341.480	3.436	20	30		EGEDHN
C[C@@H](NC[C@H]1CN(Cc2ccccc2)CCCO1)c1cccc(C#N)c1	ZINC000191831394	533436636	/nfs/dbraw/zinc/43/66/36/533436636.db2.gz	CNBWTRPQTZUAQT-GCJKJVERSA-N	0	3	349.478	3.500	20	30		EGEDHN
C[C@H](NCCCS(=O)(=O)c1ccc(F)cc1)c1ccc(C#N)cc1	ZINC000338367723	141109021	/nfs/dbraw/zinc/10/90/21/141109021.db2.gz	VNLYTVKUZCMIEM-AWEZNQCLSA-N	0	3	346.427	3.212	20	30		EGEDHN
Cc1ncccc1CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000352936141	141272177	/nfs/dbraw/zinc/27/21/77/141272177.db2.gz	UZUKONLXRUABJB-UHFFFAOYSA-N	0	3	334.423	3.112	20	30		EGEDHN
N#Cc1ccccc1NC(=O)CCN1CC[C@]2(C1)OCc1ccccc12	ZINC000186599827	144138533	/nfs/dbraw/zinc/13/85/33/144138533.db2.gz	HELZZAVHPOJKKO-OAQYLSRUSA-N	0	3	347.418	3.018	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCN[C@@H]2CCCc3c(O)cccc32)cc1	ZINC000192360448	144173877	/nfs/dbraw/zinc/17/38/77/144173877.db2.gz	YRHLKHZYFVBUBW-GOSISDBHSA-N	0	3	335.407	3.260	20	30		EGEDHN
N#Cc1ccc(CNCCc2ccn(-c3ccc(F)cc3)n2)c(F)c1	ZINC000344727192	144216469	/nfs/dbraw/zinc/21/64/69/144216469.db2.gz	JRRCODFXOUNVSQ-UHFFFAOYSA-N	0	3	338.361	3.354	20	30		EGEDHN
C[C@@H](N[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O)c1cccs1	ZINC000190629029	153152444	/nfs/dbraw/zinc/15/24/44/153152444.db2.gz	ROZWMFOJAJWZQX-CZUORRHYSA-N	0	3	325.437	3.071	20	30		EGEDHN
C[C@@H]1CN(CC2CCN(Cc3ccc(C#N)c(F)c3)CC2)C[C@@H](C)O1	ZINC000191984267	153234393	/nfs/dbraw/zinc/23/43/93/153234393.db2.gz	CXENKFXVFATMKM-HZPDHXFCSA-N	0	3	345.462	3.019	20	30		EGEDHN
C[C@@H](NC(=O)c1cccc(F)c1C#N)[C@@H](c1ccccc1)N(C)C	ZINC000193654168	153298573	/nfs/dbraw/zinc/29/85/73/153298573.db2.gz	PAUJOCHJSKIKFK-ACJLOTCBSA-N	0	3	325.387	3.119	20	30		EGEDHN
CCOCCN1CCN(Cc2ccc(-c3ccccc3C#N)cc2)CC1	ZINC000303241164	154040260	/nfs/dbraw/zinc/04/02/60/154040260.db2.gz	BMKMWRDFGJZHEK-UHFFFAOYSA-N	0	3	349.478	3.379	20	30		EGEDHN
C[C@H](N[C@@H]1CCCC[C@@H]1OC(F)F)C(=O)Nc1ccccc1C#N	ZINC000337373810	154316867	/nfs/dbraw/zinc/31/68/67/154316867.db2.gz	ADYSRSOMRVKSBN-GLQYFDAESA-N	0	3	337.370	3.025	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)[C@H]1CC2CCC1CC2	ZINC000339885777	155018387	/nfs/dbraw/zinc/01/83/87/155018387.db2.gz	KFYBNCGRYYMFOD-GQOXECLESA-N	0	3	339.483	3.275	20	30		EGEDHN
CN(C)CCN(Cc1cc(C#N)cs1)Cc1ccc(F)cc1F	ZINC000349038416	156327039	/nfs/dbraw/zinc/32/70/39/156327039.db2.gz	VBPHUXPBMZPGHJ-UHFFFAOYSA-N	0	3	335.423	3.462	20	30		EGEDHN
Cn1cc(CNCc2ccc(OCc3ccccn3)cc2)cc1C#N	ZINC000359963654	156855243	/nfs/dbraw/zinc/85/52/43/156855243.db2.gz	LQSOKGPIUFGZSY-UHFFFAOYSA-N	0	3	332.407	3.161	20	30		EGEDHN
C[C@@]1(O)CCCN(Cc2cccc(OCc3cccc(C#N)c3)c2)C1	ZINC000129537616	162359066	/nfs/dbraw/zinc/35/90/66/162359066.db2.gz	XDVMXMFJRLNYHW-OAQYLSRUSA-N	0	3	336.435	3.484	20	30		EGEDHN
CSc1ccc([C@H](CNc2cc(C#N)cc(C)n2)N(C)C)cc1	ZINC000338835017	163359098	/nfs/dbraw/zinc/35/90/98/163359098.db2.gz	GLWGUJPBOCMRBX-KRWDZBQOSA-N	0	3	326.469	3.120	20	30		EGEDHN
N#Cc1ccccc1COc1cccc(CN2CCC[C@H](O)CC2)c1	ZINC000354750921	166023178	/nfs/dbraw/zinc/02/31/78/166023178.db2.gz	WJXJKERNBXMFJA-FQEVSTJZSA-N	0	3	336.435	3.484	20	30		EGEDHN
CN(CCCN(C)c1c(C#N)nnc2ccccc21)Cc1ccco1	ZINC000343798133	164036604	/nfs/dbraw/zinc/03/66/04/164036604.db2.gz	XLNWXAWIHLRFKI-UHFFFAOYSA-N	0	3	335.411	3.053	20	30		EGEDHN
CN(CCOCc1ccc(C#N)cc1)CCc1ccc([N+](=O)[O-])cc1	ZINC000344101429	164103649	/nfs/dbraw/zinc/10/36/49/164103649.db2.gz	DQOKBVOUQZTLMK-UHFFFAOYSA-N	0	3	339.395	3.158	20	30		EGEDHN
C[C@@H](c1cccc(O)c1)N(C)CCC(=O)Nc1sccc1C#N	ZINC000345993935	164312076	/nfs/dbraw/zinc/31/20/76/164312076.db2.gz	KZXOZBCVWDDXFX-LBPRGKRZSA-N	0	3	329.425	3.347	20	30		EGEDHN
CC[C@H](C)N[C@@H](CNC(=O)NCc1cccc(C#N)c1)c1ccco1	ZINC000350394920	165040737	/nfs/dbraw/zinc/04/07/37/165040737.db2.gz	BNUZMPYTROUAMM-YOEHRIQHSA-N	0	3	340.427	3.080	20	30		EGEDHN
N#Cc1cccc(OCCCN2CC3(CCC3)[C@@H]2[C@@H]2CCCO2)c1	ZINC000352423409	165393591	/nfs/dbraw/zinc/39/35/91/165393591.db2.gz	NXGMUMPESDTGRN-OALUTQOASA-N	0	3	326.440	3.361	20	30		EGEDHN
CN(CCN1CCCC1)c1nc2c(c(C#N)c1C#N)CCCCCC2	ZINC000359477637	167167241	/nfs/dbraw/zinc/16/72/41/167167241.db2.gz	DALNLIGHPLZWAW-UHFFFAOYSA-N	0	3	337.471	3.016	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)N(CCN1CCCCCC1)C1CCC1	ZINC000359811815	167239509	/nfs/dbraw/zinc/23/95/09/167239509.db2.gz	VSJFKVUNQRPBND-UHFFFAOYSA-N	0	3	329.444	3.330	20	30		EGEDHN
CC(C)Cc1ccc([C@H](CNC(=O)c2c[nH]c(C#N)c2)N(C)C)cc1	ZINC000359884289	167257800	/nfs/dbraw/zinc/25/78/00/167257800.db2.gz	XMMHBWFRDCTSER-IBGZPJMESA-N	0	3	338.455	3.118	20	30		EGEDHN
Cc1ccc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)cc1C#N	ZINC000366942356	168159278	/nfs/dbraw/zinc/15/92/78/168159278.db2.gz	ZJQBEDMYVAGDTB-UHFFFAOYSA-N	0	3	337.423	3.196	20	30		EGEDHN
COc1cc(CN[C@@H](C)COc2ccc(F)cc2F)ccc1C#N	ZINC000440808943	269769505	/nfs/dbraw/zinc/76/95/05/269769505.db2.gz	NJJRSKCRRYCVHR-LBPRGKRZSA-N	0	3	332.350	3.402	20	30		EGEDHN
N#Cc1c(Cl)cccc1NCc1ccccc1CN1CC[C@H](O)C1	ZINC000294921909	270042387	/nfs/dbraw/zinc/04/23/87/270042387.db2.gz	INCOLZDKADTCTK-INIZCTEOSA-N	0	3	341.842	3.390	20	30		EGEDHN
N#Cc1cccc(Nc2cccc(N3CCN(CC4CC4)CC3)c2)n1	ZINC000301852842	270044596	/nfs/dbraw/zinc/04/45/96/270044596.db2.gz	PZCWEZSORKCVAK-UHFFFAOYSA-N	0	3	333.439	3.229	20	30		EGEDHN
CCc1ccccc1[C@H](N)CNC(=O)N[C@H](C)c1ccc(C#N)cc1	ZINC000417107998	270047702	/nfs/dbraw/zinc/04/77/02/270047702.db2.gz	IDBNVHQKKOLVHX-AUUYWEPGSA-N	0	3	336.439	3.181	20	30		EGEDHN
N#Cc1ccc(CN2CCC(N[C@@H]3COCc4ccccc43)CC2)cc1	ZINC000417367623	270048087	/nfs/dbraw/zinc/04/80/87/270048087.db2.gz	PXYKXLYXWMWPLV-JOCHJYFZSA-N	0	3	347.462	3.384	20	30		EGEDHN
CCc1ccc([C@@H](CNc2nccc(C#N)c2Cl)N(C)C)cc1	ZINC000429215443	270050191	/nfs/dbraw/zinc/05/01/91/270050191.db2.gz	POZDTMDBRFYNBO-MRXNPFEDSA-N	0	3	328.847	3.306	20	30		EGEDHN
Cc1ccc(F)c(CCNC(=O)C(C#N)Cc2ccc(C#N)cc2)c1	ZINC000456340766	270054302	/nfs/dbraw/zinc/05/43/02/270054302.db2.gz	ZFZKJLKTECFXOR-SFHVURJKSA-N	0	3	335.382	3.047	20	30		EGEDHN
CCC(CC)(CNC(=O)OC(C)(C)C)NCc1cc(C#N)n(C)c1	ZINC000190993466	266000830	/nfs/dbraw/zinc/00/08/30/266000830.db2.gz	UYTDTXHWFYUVLW-UHFFFAOYSA-N	0	3	334.464	3.070	20	30		EGEDHN
CCN(CC(=O)Nc1ccc(C#N)c(Cl)c1)[C@@H]1CCOC(C)(C)C1	ZINC000289965465	266106332	/nfs/dbraw/zinc/10/63/32/266106332.db2.gz	WTJPAFVFOWDWPK-OAHLLOKOSA-N	0	3	349.862	3.430	20	30		EGEDHN
CCOC(=O)N1CCC(N[C@H](C)c2ccc(C#N)cc2Cl)CC1	ZINC000279182148	266257544	/nfs/dbraw/zinc/25/75/44/266257544.db2.gz	VQTXHPVNGJTDEA-GFCCVEGCSA-N	0	3	335.835	3.483	20	30		EGEDHN
CCOC(=O)N1CCC([C@H](C)NCc2cc(C#N)ccc2F)CC1	ZINC000186409387	266257912	/nfs/dbraw/zinc/25/79/12/266257912.db2.gz	YATVXHVFUAYWOL-ZDUSSCGKSA-N	0	3	333.407	3.044	20	30		EGEDHN
CCOCCCN1CC[C@H](Nc2nc(Cl)c(C#N)s2)[C@H](C)C1	ZINC000287263797	266273119	/nfs/dbraw/zinc/27/31/19/266273119.db2.gz	KWSZDWMHUTXQQZ-NEPJUHHUSA-N	0	3	342.896	3.217	20	30		EGEDHN
CCOCCCN1CC[C@@H](Nc2nc(Cl)c(C#N)s2)[C@@H](C)C1	ZINC000287263803	266274203	/nfs/dbraw/zinc/27/42/03/266274203.db2.gz	KWSZDWMHUTXQQZ-NWDGAFQWSA-N	0	3	342.896	3.217	20	30		EGEDHN
CCS[C@@H]1CCCC[C@H]1N[C@H]1CCN(c2sccc2C#N)C1=O	ZINC000299204475	266346940	/nfs/dbraw/zinc/34/69/40/266346940.db2.gz	GAVYUZUEVCHAOG-QLFBSQMISA-N	0	3	349.525	3.379	20	30		EGEDHN
CCN(Cc1ccc(CN(C)C)cc1)C(=O)c1ccc(C#N)s1	ZINC000487302736	267069891	/nfs/dbraw/zinc/06/98/91/267069891.db2.gz	RFMANCSIAPKJLX-UHFFFAOYSA-N	0	3	327.453	3.344	20	30		EGEDHN
C[C@H](C(=O)N(Cc1ccc(C#N)cc1)C1CC1)N1[C@H](C)CC[C@H]1C	ZINC000298696221	267125886	/nfs/dbraw/zinc/12/58/86/267125886.db2.gz	SREGAEFUUPBRMR-BZUAXINKSA-N	0	3	325.456	3.311	20	30		EGEDHN
C[C@H](C(=O)Nc1cccc(C#N)c1)N1CC[C@H](C2CCOCC2)C1	ZINC000328856901	267144655	/nfs/dbraw/zinc/14/46/55/267144655.db2.gz	UJGSETJDNKLGPW-PBHICJAKSA-N	0	3	327.428	3.283	20	30		EGEDHN
CC[C@@H](C)N1CCN(c2c(C#N)cnc3c(F)cc(F)cc32)CC1	ZINC000450864698	267184872	/nfs/dbraw/zinc/18/48/72/267184872.db2.gz	VQKZJWPWKLOMDV-GFCCVEGCSA-N	0	3	330.382	3.305	20	30		EGEDHN
CC[C@@H](C)N[C@@H](CNC(=O)NCc1ccc(C#N)s1)c1ccco1	ZINC000422205105	267186060	/nfs/dbraw/zinc/18/60/60/267186060.db2.gz	ONJGBNRBYKGXBE-DOMZBBRYSA-N	0	3	346.456	3.141	20	30		EGEDHN
C[C@H]1CCN(c2nc3ccccn3c2C#N)CCN1Cc1ccccc1	ZINC000302140029	267218577	/nfs/dbraw/zinc/21/85/77/267218577.db2.gz	FBSPPQKTCAJQDD-KRWDZBQOSA-N	0	3	345.450	3.307	20	30		EGEDHN
CN(C)[C@@H](CNc1ccc(C(F)(F)F)c(C#N)n1)c1ccccc1	ZINC000443408851	267286281	/nfs/dbraw/zinc/28/62/81/267286281.db2.gz	LVZOSESGAFUOQN-HNNXBMFYSA-N	0	3	334.345	3.109	20	30		EGEDHN
CN(C)[C@H](CNc1ncc(Br)cc1C#N)c1ccccc1	ZINC000450220541	267289147	/nfs/dbraw/zinc/28/91/47/267289147.db2.gz	ZPNWMEKIPNRCRK-OAHLLOKOSA-N	0	3	345.244	3.431	20	30		EGEDHN
CN(Cc1ccc(C#N)cn1)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1	ZINC000514870518	267314767	/nfs/dbraw/zinc/31/47/67/267314767.db2.gz	LPDFTCINZDQVFW-RBUKOAKNSA-N	0	3	325.387	3.444	20	30		EGEDHN
Cc1ccnc(NCc2ccc(OC3CCN(C)CC3)cc2)c1C#N	ZINC000286301885	267517380	/nfs/dbraw/zinc/51/73/80/267517380.db2.gz	DRACTROHLKTBPM-UHFFFAOYSA-N	0	3	336.439	3.347	20	30		EGEDHN
Cc1cc(CNCCNC(=O)c2ccccc2Cl)ccc1C#N	ZINC000443976866	267996810	/nfs/dbraw/zinc/99/68/10/267996810.db2.gz	BHURFAPJWBZIPE-UHFFFAOYSA-N	0	3	327.815	3.040	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)[C@H](C)c2cccc(C#N)c2)N(C)C)cc1	ZINC000462000837	268046289	/nfs/dbraw/zinc/04/62/89/268046289.db2.gz	QRNSPYBAQLLGNP-UZLBHIALSA-N	0	3	335.451	3.389	20	30		EGEDHN
N#Cc1ccc(CNC(=O)c2ccc(CN3CCCCC3)cc2)cc1	ZINC000298352813	268072485	/nfs/dbraw/zinc/07/24/85/268072485.db2.gz	KZMBXMWUKDXCTB-UHFFFAOYSA-N	0	3	333.435	3.474	20	30		EGEDHN
N#Cc1ccc(CNC[C@]2(Cc3ccc(F)cc3)CCC[C@@H]2O)o1	ZINC000277423355	268074469	/nfs/dbraw/zinc/07/44/69/268074469.db2.gz	GVLMGXXZAPWHRS-RBUKOAKNSA-N	0	3	328.387	3.154	20	30		EGEDHN
Cc1noc(C)c1C(C)(C)NCCC(=O)Nc1cccc(C#N)c1	ZINC000411728010	268096377	/nfs/dbraw/zinc/09/63/77/268096377.db2.gz	KAZQWDYRGDPGCB-UHFFFAOYSA-N	0	3	326.400	3.017	20	30		EGEDHN
N#Cc1ccc(N2CCN(CC3CCCCC3)CC2)c([N+](=O)[O-])c1	ZINC000301075127	268117549	/nfs/dbraw/zinc/11/75/49/268117549.db2.gz	GGKNXSBYQZPGAF-UHFFFAOYSA-N	0	3	328.416	3.169	20	30		EGEDHN
N#Cc1ccc(OC2CCC(NCc3cc(F)ncc3F)CC2)nc1	ZINC000295690979	268164862	/nfs/dbraw/zinc/16/48/62/268164862.db2.gz	LRORLDNQXRMVPW-UHFFFAOYSA-N	0	3	344.365	3.106	20	30		EGEDHN
N#Cc1cc(Br)ccc1CN[C@@H]1[C@H]2CCO[C@H]2C12CCC2	ZINC000451487715	268174489	/nfs/dbraw/zinc/17/44/89/268174489.db2.gz	HNBBSTLJKSAODL-BZUAXINKSA-N	0	3	347.256	3.368	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(CCc3ccccc3F)CC2)cc1	ZINC000469074652	268216867	/nfs/dbraw/zinc/21/68/67/268216867.db2.gz	RSIIKGVRBVLIBZ-UHFFFAOYSA-N	0	3	337.442	3.448	20	30		EGEDHN
N#Cc1ccc(CN2CCN(C[C@H]3C[C@@H]3c3ccccc3)CC2)cc1	ZINC000506086557	268220657	/nfs/dbraw/zinc/22/06/57/268220657.db2.gz	PZHDEOGZPATHBU-FGZHOGPDSA-N	0	3	331.463	3.480	20	30		EGEDHN
CN(C)CCOc1ccc(NC(=O)/C=C\c2cccc(C#N)c2)cc1	ZINC000046722947	275138376	/nfs/dbraw/zinc/13/83/76/275138376.db2.gz	XOGFSARQSZCDMA-WDZFZDKYSA-N	0	3	335.407	3.151	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N[C@H]1CCOC2(CCC2)C1)C(C)C	ZINC000269183490	277851695	/nfs/dbraw/zinc/85/16/95/277851695.db2.gz	CENJJNCVCKBPKN-ZWKOTPCHSA-N	0	3	349.519	3.086	20	30		EGEDHN
CS[C@H]1CN(c2ccc(C(F)(F)F)cc2C#N)C[C@@H]1N(C)C	ZINC000340737091	278167868	/nfs/dbraw/zinc/16/78/68/278167868.db2.gz	CXBXKVVTEZUIRL-KBPBESRZSA-N	0	3	329.391	3.059	20	30		EGEDHN
CC(C)(NCCOc1ccccc1C#N)C(=O)NCC1CCCCC1	ZINC000155269043	307811108	/nfs/dbraw/zinc/81/11/08/307811108.db2.gz	DIMRSTWUYLKCSF-UHFFFAOYSA-N	0	3	343.471	3.002	20	30		EGEDHN
C[C@@H](CCN1CCN(c2nccnc2C#N)C[C@@H]1C)c1ccccc1	ZINC000248828325	308012485	/nfs/dbraw/zinc/01/24/85/308012485.db2.gz	GTWKXQQJMRWWSO-IRXDYDNUSA-N	0	3	335.455	3.053	20	30		EGEDHN
CCN1CCC(n2nccc2NC(=O)/C=C\c2cccc(C#N)c2)CC1	ZINC000255075337	308039602	/nfs/dbraw/zinc/03/96/02/308039602.db2.gz	WONHGCIEDXLYIE-SREVYHEPSA-N	0	3	349.438	3.063	20	30		EGEDHN
COc1ccc(CN[C@H](C)C[C@H](O)c2ccc(F)cc2)cc1C#N	ZINC000130731612	533698450	/nfs/dbraw/zinc/69/84/50/533698450.db2.gz	WITQOYQUWPAGMC-ACJLOTCBSA-N	0	3	328.387	3.308	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2cccc(Br)c2)nc(C)n1	ZINC000041574290	453972678	/nfs/dbraw/zinc/97/26/78/453972678.db2.gz	LTODEFJVQLAERM-ZDUSSCGKSA-N	0	3	330.185	3.346	20	30		EGEDHN
N#Cc1ccc(CNC(=O)CNC2(c3ccccc3)CCCC2)cc1	ZINC000538189277	314231699	/nfs/dbraw/zinc/23/16/99/314231699.db2.gz	UVCHNLQVKUKHIW-UHFFFAOYSA-N	0	3	333.435	3.234	20	30		EGEDHN
CC(C)(C)n1cc(C#N)cc1NC(=O)N1CCCN(C(C)(C)C)CC1	ZINC000548881262	315058171	/nfs/dbraw/zinc/05/81/71/315058171.db2.gz	SSDBFMABHDWSQX-UHFFFAOYSA-N	0	3	345.491	3.453	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)NCCN1CC[C@H](C)C1	ZINC000551276744	315148036	/nfs/dbraw/zinc/14/80/36/315148036.db2.gz	TULNUDPSFFQUKQ-LBPRGKRZSA-N	0	3	327.453	3.153	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)N(C)[C@H]1CCN(C)C[C@@H]1C	ZINC000551409243	315153382	/nfs/dbraw/zinc/15/33/82/315153382.db2.gz	MLDFVNDQTBFOSM-LRDDRELGSA-N	0	3	341.480	3.494	20	30		EGEDHN
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCc1cccc(C#N)c1F	ZINC000560178445	315665535	/nfs/dbraw/zinc/66/55/35/315665535.db2.gz	OAHCBCPDDHHFDV-KBXCAEBGSA-N	0	3	340.398	3.207	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2NC[C@H](O)COCc1cccs1	ZINC000562998009	315938738	/nfs/dbraw/zinc/93/87/38/315938738.db2.gz	YPULXONXUPFAAI-LPHOPBHVSA-N	0	3	342.464	3.164	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CN[C@H]2CCc3c2cccc3Cl)cc1	ZINC000566059649	316409230	/nfs/dbraw/zinc/40/92/30/316409230.db2.gz	QLLCMUXSNBVYNJ-LIRRHRJNSA-N	0	3	342.826	3.228	20	30		EGEDHN
C[C@H](NC(C)(C)CNC(=O)Nc1cccc(C#N)n1)c1ccccc1	ZINC000568746498	316817930	/nfs/dbraw/zinc/81/79/30/316817930.db2.gz	OPOSLZOBLFPHAI-AWEZNQCLSA-N	0	3	337.427	3.204	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](O)CO[C@H]2CCCc3ccccc32)s1	ZINC000570564022	317074289	/nfs/dbraw/zinc/07/42/89/317074289.db2.gz	FJBLZMHGFIPYGK-BEFAXECRSA-N	0	3	342.464	3.164	20	30		EGEDHN
N#Cc1ccc2c(c1)CCCC[C@H]2NCCC(=O)N1CCCCC1	ZINC000571139499	317155616	/nfs/dbraw/zinc/15/56/16/317155616.db2.gz	LKVPEWRQXDVCME-LJQANCHMSA-N	0	3	325.456	3.318	20	30		EGEDHN
CC(C)C1CCC(N2CCN(Cc3ccc(C#N)cn3)CC2)CC1	ZINC000572420221	317336026	/nfs/dbraw/zinc/33/60/26/317336026.db2.gz	QDWBBKDXRSHOKI-UHFFFAOYSA-N	0	3	326.488	3.286	20	30		EGEDHN
CC[C@](C)(COc1ncccc1Cl)NCc1ccc(C#N)cn1	ZINC000572852725	317401796	/nfs/dbraw/zinc/40/17/96/317401796.db2.gz	KYHVNFHOCNVGNL-QGZVFWFLSA-N	0	3	330.819	3.339	20	30		EGEDHN
CN1CCC[C@@H]1CNC(=O)c1cccc(Oc2ccc(C#N)cc2)c1	ZINC000171479899	323237692	/nfs/dbraw/zinc/23/76/92/323237692.db2.gz	LMYDKMWTBPSXIJ-QGZVFWFLSA-N	0	3	335.407	3.175	20	30		EGEDHN
N#Cc1ccc(CNCCc2nc(-c3ccccn3)cs2)s1	ZINC000176972758	323335000	/nfs/dbraw/zinc/33/50/00/323335000.db2.gz	JTGLUNCWANUBIB-UHFFFAOYSA-N	0	3	326.450	3.471	20	30		EGEDHN
Cc1ccc(C#N)c(N2CCN(c3ccnc4ccccc43)CC2)n1	ZINC000580453509	325253491	/nfs/dbraw/zinc/25/34/91/325253491.db2.gz	AXCBYUINRYXEPF-UHFFFAOYSA-N	0	3	329.407	3.137	20	30		EGEDHN
Cc1ccc2c(c1)[C@H](NC[C@@H](O)COc1ccc(C#N)cc1)CCC2	ZINC000580947921	325312805	/nfs/dbraw/zinc/31/28/05/325312805.db2.gz	SUQBAOYKJLFRQD-WIYYLYMNSA-N	0	3	336.435	3.274	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C2(c3cc(C)cc(C)c3)CC2)CC1	ZINC000264485746	455222617	/nfs/dbraw/zinc/22/26/17/455222617.db2.gz	MUTIDUCEKPSZPU-UHFFFAOYSA-N	0	3	326.484	3.492	20	30		EGEDHN
N#Cc1ccc(NC(=O)N2CC[C@H](N3CCCCC3)C2)cc1Cl	ZINC000264501149	455225478	/nfs/dbraw/zinc/22/54/78/455225478.db2.gz	RFIKCAQUHOTBTE-HNNXBMFYSA-N	0	3	332.835	3.304	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H]2SCCc3ccccc32)CC1	ZINC000173102334	455232174	/nfs/dbraw/zinc/23/21/74/455232174.db2.gz	WMSANNPEULHDRZ-GOSISDBHSA-N	0	3	330.497	3.174	20	30		EGEDHN
CC(C)Oc1ccc(NC(=O)N(C)C[C@@H]2CCCN(C)C2)cc1C#N	ZINC000157877380	455243800	/nfs/dbraw/zinc/24/38/00/455243800.db2.gz	XYWGKZCUKZVUEU-OAHLLOKOSA-N	0	3	344.459	3.151	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCC[C@@H](C)c2ccc(OC)cc2)CC1	ZINC000173199712	455246311	/nfs/dbraw/zinc/24/63/11/455246311.db2.gz	ZUBRMPHKRFUTNH-MRXNPFEDSA-N	0	3	345.487	3.138	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@H](C)N[C@@H](C)c1cccc(-n2cccn2)c1	ZINC000173206545	455247999	/nfs/dbraw/zinc/24/79/99/455247999.db2.gz	SLMHMXCQNIOEFY-IRXDYDNUSA-N	0	3	340.471	3.336	20	30		EGEDHN
CC(C)Cc1ccc([C@H](C)NCCNC(=O)C2N=CC=CC2=O)cc1	ZINC000180866261	455258814	/nfs/dbraw/zinc/25/88/14/455258814.db2.gz	OWJRXDIIXKFAQG-DNTCVELPSA-N	0	3	341.455	3.062	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@@H](CO)C/C=C\C)cc1OC	ZINC000623495115	460581496	/nfs/dbraw/zinc/58/14/96/460581496.db2.gz	RDCOBMYQDHNKRG-KXQLTZBTSA-N	0	3	325.836	3.330	20	30		EGEDHN
CC[C@@H]([NH2+][C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O)c1ccccc1[O-]	ZINC000190602161	455351047	/nfs/dbraw/zinc/35/10/47/455351047.db2.gz	SQJPRLLBCWNBSK-RTBURBONSA-N	0	3	349.434	3.106	20	30		EGEDHN
C=CCOc1c(Cl)cc(CNC[C@H](OC)C2CC2)cc1OC	ZINC000623533596	460600390	/nfs/dbraw/zinc/60/03/90/460600390.db2.gz	HOXALZAFDGVCFV-INIZCTEOSA-N	0	3	325.836	3.428	20	30		EGEDHN
C=CCNC(=O)NC(=O)CN[C@@H](c1ccc(C(C)C)cc1)C(C)C	ZINC000015521034	453574529	/nfs/dbraw/zinc/57/45/29/453574529.db2.gz	JMADSZGSWJBSGI-GOSISDBHSA-N	0	3	331.460	3.109	20	30		EGEDHN
N#CCc1ccc(OC[C@@H](O)CN[C@@H](c2ccccc2)C2CC2)cc1	ZINC000023678818	453715341	/nfs/dbraw/zinc/71/53/41/453715341.db2.gz	ZHKRJPQPOAYZKL-FPOVZHCZSA-N	0	3	336.435	3.233	20	30		EGEDHN
N#Cc1ccc(CCC(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1	ZINC000023741862	453717351	/nfs/dbraw/zinc/71/73/51/453717351.db2.gz	KRJGJHQOGNJZJG-NRFANRHFSA-N	0	3	347.462	3.444	20	30		EGEDHN
C[C@@H](CC1(C#N)CCOCC1)NC[C@H](c1ccco1)N1CCCC1	ZINC000600848177	460620526	/nfs/dbraw/zinc/62/05/26/460620526.db2.gz	DLQSQVYOBAPOLL-DLBZAZTESA-N	0	3	331.460	3.105	20	30		EGEDHN
C[C@H](c1cccs1)N(C)C[C@@H](O)COc1ccc(CC#N)cc1	ZINC000028694668	453824321	/nfs/dbraw/zinc/82/43/21/453824321.db2.gz	LEEJJUHRURJSRH-GDBMZVCRSA-N	0	3	330.453	3.247	20	30		EGEDHN
N#Cc1ccnc(N2CCN(Cc3cccc4ccccc43)CC2)c1	ZINC000029444588	453829033	/nfs/dbraw/zinc/82/90/33/453829033.db2.gz	CHVOZRVPMMYNOL-UHFFFAOYSA-N	0	3	328.419	3.429	20	30		EGEDHN
N#Cc1ccc(NCC2(N3CCSCC3)CCCC2)c([N+](=O)[O-])c1	ZINC000029620756	453830328	/nfs/dbraw/zinc/83/03/28/453830328.db2.gz	VKZDSGVUDVBDHJ-UHFFFAOYSA-N	0	3	346.456	3.240	20	30		EGEDHN
C[C@H](NC[C@H](O)COCc1ccc(Cl)cc1)c1ccc(C#N)cc1	ZINC000030532591	453836415	/nfs/dbraw/zinc/83/64/15/453836415.db2.gz	SYAWUWXSQXLIDF-LIRRHRJNSA-N	0	3	344.842	3.440	20	30		EGEDHN
CCN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)C1(C#N)CCC1	ZINC000075325158	453879526	/nfs/dbraw/zinc/87/95/26/453879526.db2.gz	IEFVRVUDJHNNCY-GOSISDBHSA-N	0	3	325.456	3.051	20	30		EGEDHN
N#CCSCCCN(Cc1ccccc1)C[C@@H](O)c1ccco1	ZINC000084134762	453971851	/nfs/dbraw/zinc/97/18/51/453971851.db2.gz	DDMKUWDQSIZEFN-QGZVFWFLSA-N	0	3	330.453	3.462	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2cccc(Br)c2)nc(C)n1	ZINC000041574289	453972715	/nfs/dbraw/zinc/97/27/15/453972715.db2.gz	LTODEFJVQLAERM-CYBMUJFWSA-N	0	3	330.185	3.346	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)c2cc(C#N)cs2)N(C)C)cc1	ZINC000084179717	453975182	/nfs/dbraw/zinc/97/51/82/453975182.db2.gz	FLBVNDFSCMKMSF-MRXNPFEDSA-N	0	3	327.453	3.215	20	30		EGEDHN
Cc1ccc(C)c(CC(=O)N(CCN(C)C)Cc2cccc(C#N)c2)c1	ZINC000076205027	453979086	/nfs/dbraw/zinc/97/90/86/453979086.db2.gz	LJELBAUUQIYMDE-UHFFFAOYSA-N	0	3	349.478	3.308	20	30		EGEDHN
N#CC(C(=O)c1cccc2c1OCO2)c1ccc(C(F)(F)F)cn1	ZINC000077430795	454105654	/nfs/dbraw/zinc/10/56/54/454105654.db2.gz	JLQJVACZUMAKQK-LLVKDONJSA-N	0	3	334.253	3.319	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc(C)c3c[nH]nc32)CC1	ZINC000077482208	454111404	/nfs/dbraw/zinc/11/14/04/454111404.db2.gz	PVLNQOJHUGRCHV-UHFFFAOYSA-N	0	3	327.432	3.033	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)C2(C#N)CCCCC2)C1	ZINC000057398020	454125162	/nfs/dbraw/zinc/12/51/62/454125162.db2.gz	IHMOYHLEJGBQHJ-WMZOPIPTSA-N	0	3	325.456	3.412	20	30		EGEDHN
CN(C)CCN(C(=O)/C=C/c1ccc(OCC#N)cc1)c1ccccc1	ZINC000058297999	454181998	/nfs/dbraw/zinc/18/19/98/454181998.db2.gz	VSYNFTNTIVIVLF-JLHYYAGUSA-N	0	3	349.434	3.197	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)NCc1cccc(C#N)c1)C(C)C	ZINC000046039000	454210310	/nfs/dbraw/zinc/21/03/10/454210310.db2.gz	MAZNNEUBVJNGNE-LJQANCHMSA-N	0	3	340.471	3.056	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(OC3CCCC3)c(F)c2)CC1	ZINC000078232385	454214080	/nfs/dbraw/zinc/21/40/80/454214080.db2.gz	YLEPCLAGNGJIPS-UHFFFAOYSA-N	0	3	344.430	3.431	20	30		EGEDHN
C=CCOc1cccc(CN2CCC[C@@H](c3nnc4n3CCC4)C2)c1	ZINC000119835900	454225671	/nfs/dbraw/zinc/22/56/71/454225671.db2.gz	GVSJGDUPBCRJIJ-QGZVFWFLSA-N	0	3	338.455	3.169	20	30		EGEDHN
N#Cc1cnc(NCC2(N3CCCCC3)CCOCC2)c(Cl)c1	ZINC000119904193	454234965	/nfs/dbraw/zinc/23/49/65/454234965.db2.gz	SGASMGVRCVGDDP-UHFFFAOYSA-N	0	3	334.851	3.054	20	30		EGEDHN
Cc1nnc(N2CC[C@H](C)N(Cc3ccccc3)CC2)c(C#N)c1C	ZINC000078689549	454300553	/nfs/dbraw/zinc/30/05/53/454300553.db2.gz	YNLUAVZWFAMRGE-HNNXBMFYSA-N	0	3	335.455	3.066	20	30		EGEDHN
Cc1cc(C)cc(C(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)c1	ZINC000047010910	454318137	/nfs/dbraw/zinc/31/81/37/454318137.db2.gz	PVIWZVXPMWJWER-UHFFFAOYSA-N	0	3	335.451	3.379	20	30		EGEDHN
C=CCCOCCNCc1c(C)nn(-c2ccc(F)cc2F)c1C	ZINC000120875218	454358888	/nfs/dbraw/zinc/35/88/88/454358888.db2.gz	MRENVRKXEWJJGU-UHFFFAOYSA-N	0	3	335.398	3.450	20	30		EGEDHN
N#Cc1ccc(N2CCCN(Cc3ccccc3)CC2)c([N+](=O)[O-])c1	ZINC000073109757	454395758	/nfs/dbraw/zinc/39/57/58/454395758.db2.gz	NKMKDHJJXLNMJV-UHFFFAOYSA-N	0	3	336.395	3.179	20	30		EGEDHN
C[C@@H](NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1)c1ccc(C#N)cc1	ZINC000047966358	454424401	/nfs/dbraw/zinc/42/44/01/454424401.db2.gz	CLEQSBXTFZSXHT-OXQOHEQNSA-N	0	3	348.450	3.193	20	30		EGEDHN
C[C@](C#N)(NC(=O)CN(CCc1ccccc1)C1CCCC1)C1CC1	ZINC000063754896	454444344	/nfs/dbraw/zinc/44/43/44/454444344.db2.gz	VXAYLDBGARJQES-OAQYLSRUSA-N	0	3	339.483	3.282	20	30		EGEDHN
C=CCCC[C@H](C)N1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000091596694	454449302	/nfs/dbraw/zinc/44/93/02/454449302.db2.gz	WUHBBPKPQCQDKB-INIZCTEOSA-N	0	3	336.501	3.174	20	30		EGEDHN
C[C@@H](CNC(=O)CSCc1ccc(C#N)cc1)N1CCC[C@@H](C)C1	ZINC000048230532	454459572	/nfs/dbraw/zinc/45/95/72/454459572.db2.gz	AVQNPEAHHRQAAW-CVEARBPZSA-N	0	3	345.512	3.028	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(F)c(Cl)cc2F)CC1	ZINC000121636009	454459996	/nfs/dbraw/zinc/45/99/96/454459996.db2.gz	FWTHATSSCXJJNX-UHFFFAOYSA-N	0	3	328.790	3.389	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)c1cccc2cc[nH]c21	ZINC000079790201	454480011	/nfs/dbraw/zinc/48/00/11/454480011.db2.gz	NGTDMSBKCYVAKO-UHFFFAOYSA-N	0	3	346.434	3.244	20	30		EGEDHN
COc1ccc(CNc2ccc(C)cc2OCCN(C)C)cc1C#N	ZINC000133963191	454487691	/nfs/dbraw/zinc/48/76/91/454487691.db2.gz	ZXFWASAUQJOTPL-UHFFFAOYSA-N	0	3	339.439	3.428	20	30		EGEDHN
C=CCNC(=O)NC(=O)[C@@H](C)N[C@H](C)c1ccc(SC(C)C)cc1	ZINC000103499425	454561402	/nfs/dbraw/zinc/56/14/02/454561402.db2.gz	HJNGVTAKXAPROF-ZIAGYGMSSA-N	0	3	349.500	3.238	20	30		EGEDHN
N#CC(C(=O)CCc1cccc(Cl)c1)C(=O)Nc1ccccn1	ZINC000103717486	454565029	/nfs/dbraw/zinc/56/50/29/454565029.db2.gz	UWHVAPFZTGFUAA-CQSZACIVSA-N	0	3	327.771	3.015	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000050028782	454569352	/nfs/dbraw/zinc/56/93/52/454569352.db2.gz	CDARCRDIUIQKOV-QFIPXVFZSA-N	0	3	346.474	3.432	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN[C@H](c1ccc(F)cc1)C1CCC1	ZINC000104702993	454596833	/nfs/dbraw/zinc/59/68/33/454596833.db2.gz	ICWFJMKPAUSDTI-KUHUBIRLSA-N	0	3	331.435	3.265	20	30		EGEDHN
C[C@H](Oc1ccc(C#N)cc1)C(=O)N(CCN(C)C)C1CCCCC1	ZINC000065746049	454618842	/nfs/dbraw/zinc/61/88/42/454618842.db2.gz	LLLGUWRGOMXKBI-INIZCTEOSA-N	0	3	343.471	3.048	20	30		EGEDHN
Cc1ccc(C(=O)N(CCN(C)C)Cc2cccc(C#N)c2)c(C)c1	ZINC000065931190	454641359	/nfs/dbraw/zinc/64/13/59/454641359.db2.gz	VMQTYOUSMRXQMJ-UHFFFAOYSA-N	0	3	335.451	3.379	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(-c3ccccc3)no2)CC1	ZINC000106036201	454674520	/nfs/dbraw/zinc/67/45/20/454674520.db2.gz	YRSUDXFOOICCLW-UHFFFAOYSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC000106039464	454676025	/nfs/dbraw/zinc/67/60/25/454676025.db2.gz	AWWVBVYFVRJLTM-UHFFFAOYSA-N	0	3	326.362	3.476	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](c2ccccc2)C2CC2)CC1	ZINC000106256572	454689100	/nfs/dbraw/zinc/68/91/00/454689100.db2.gz	WZDBPFAWLZXRQV-LJQANCHMSA-N	0	3	327.472	3.477	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H](c2ccccc2)N(CC)CC)CC1	ZINC000106290899	454689856	/nfs/dbraw/zinc/68/98/56/454689856.db2.gz	IVZDMXLMFNOMEP-HXUWFJFHSA-N	0	3	343.515	3.226	20	30		EGEDHN
CC(C)N(CCC(=O)Nc1sccc1C#N)Cc1cccnc1	ZINC000093224656	454693790	/nfs/dbraw/zinc/69/37/90/454693790.db2.gz	JKPOBEGHTSBMQN-UHFFFAOYSA-N	0	3	328.441	3.254	20	30		EGEDHN
COc1ccccc1N(CCC#N)C(=O)[C@H](C)N1C[C@@H]2CCC[C@@H]2C1	ZINC000152764291	454722666	/nfs/dbraw/zinc/72/26/66/454722666.db2.gz	XDQVNLQTRNJQKX-YESZJQIVSA-N	0	3	341.455	3.062	20	30		EGEDHN
CC(C)C1(CNC(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)CC1	ZINC000176356977	454734230	/nfs/dbraw/zinc/73/42/30/454734230.db2.gz	SDNNUOUFLNNFBF-UHFFFAOYSA-N	0	3	342.487	3.068	20	30		EGEDHN
CC(C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1)=C1CCCC1	ZINC000176557483	454759582	/nfs/dbraw/zinc/75/95/82/454759582.db2.gz	GKNPAZRJVPITRD-UHFFFAOYSA-N	0	3	325.456	3.339	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC(NCc2ccc(C#N)cc2F)CC1	ZINC000177308351	454849950	/nfs/dbraw/zinc/84/99/50/454849950.db2.gz	WYYGYHIZBAKHIL-UHFFFAOYSA-N	0	3	333.407	3.186	20	30		EGEDHN
CO/N=C/c1ccc(C(=O)Nc2cc(CN(C)C)ccc2C)cc1	ZINC000177315621	454850897	/nfs/dbraw/zinc/85/08/97/454850897.db2.gz	OAIAVWIELVRTPP-UDWIEESQSA-N	0	3	325.412	3.289	20	30		EGEDHN
N#Cc1ccc(C(=O)N2CCC[C@H]2CN2CCCCC2)cc1Cl	ZINC000125935183	454857852	/nfs/dbraw/zinc/85/78/52/454857852.db2.gz	NRNLZCMGSQAWGM-INIZCTEOSA-N	0	3	331.847	3.302	20	30		EGEDHN
C[C@H](NCC1(c2ccc(F)cc2)CCCCC1)C(=O)N(C)CCC#N	ZINC000112534791	454889576	/nfs/dbraw/zinc/88/95/76/454889576.db2.gz	BFNWQHHPGLMGAI-INIZCTEOSA-N	0	3	345.462	3.378	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@@H](CC)[C@@H]1CCCO1	ZINC000182326487	455489513	/nfs/dbraw/zinc/48/95/13/455489513.db2.gz	BFQIINGAUNUXRY-HOCLYGCPSA-N	0	3	334.485	3.450	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(F)cc2OCCC)CC1	ZINC000178052087	454930458	/nfs/dbraw/zinc/93/04/58/454930458.db2.gz	QVDFSKBJXHHMPF-UHFFFAOYSA-N	0	3	335.423	3.386	20	30		EGEDHN
C[C@@H](CNC(=O)c1c(F)cc(C#N)cc1F)N(C)Cc1ccccc1	ZINC000151136727	454943007	/nfs/dbraw/zinc/94/30/07/454943007.db2.gz	ATUBJGMVMYHPAP-ZDUSSCGKSA-N	0	3	343.377	3.087	20	30		EGEDHN
COc1ccc(CNCCSCc2ccccc2C#N)cc1O	ZINC000170670731	454953173	/nfs/dbraw/zinc/95/31/73/454953173.db2.gz	CJOAABKZRTVJLF-UHFFFAOYSA-N	0	3	328.437	3.295	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H]2C[C@H]2c2c(F)cccc2F)CC1	ZINC000116194024	455047325	/nfs/dbraw/zinc/04/73/25/455047325.db2.gz	YDWQZSRUZKLCMA-CABCVRRESA-N	0	3	334.410	3.225	20	30		EGEDHN
Cc1cccc(CN(CCN(C)C)C(=O)c2cccc(CC#N)c2)c1	ZINC000171337783	455063577	/nfs/dbraw/zinc/06/35/77/455063577.db2.gz	MDDYFGRQEHVZFA-UHFFFAOYSA-N	0	3	335.451	3.265	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN[C@@H](CCCO)c1ccccc1	ZINC000179760577	455075414	/nfs/dbraw/zinc/07/54/14/455075414.db2.gz	LNQOQPRSHGBDCE-SFHVURJKSA-N	0	3	340.423	3.049	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2nccc3ccccc32)CC1	ZINC000171560530	455077589	/nfs/dbraw/zinc/07/75/89/455077589.db2.gz	SRWODXNCQREYSI-UHFFFAOYSA-N	0	3	338.455	3.075	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCCc2ccc3ccccc3c2)CC1	ZINC000171716682	455088655	/nfs/dbraw/zinc/08/86/55/455088655.db2.gz	RXEOWXZBJOCIQA-UHFFFAOYSA-N	0	3	337.467	3.332	20	30		EGEDHN
C[C@H](CC#N)Sc1ccccc1NC(=O)N1CCN2CCC[C@@H]2C1	ZINC000171894989	455101063	/nfs/dbraw/zinc/10/10/63/455101063.db2.gz	CLWQIVRTJYFRRB-HUUCEWRRSA-N	0	3	344.484	3.393	20	30		EGEDHN
CC[C@@H](NCC(=O)N(CC)C[C@@H](C)C#N)C(C)(C)c1ccccc1	ZINC000180008305	455114707	/nfs/dbraw/zinc/11/47/07/455114707.db2.gz	BIEOAUYTNJTDPB-FUHWJXTLSA-N	0	3	329.488	3.341	20	30		EGEDHN
CC[C@H](NCC(=O)N[C@](C)(C#N)C1CC1)C(C)(C)c1ccccc1	ZINC000180008514	455115809	/nfs/dbraw/zinc/11/58/09/455115809.db2.gz	MRUXLORHFBTNTL-FXAWDEMLSA-N	0	3	327.472	3.141	20	30		EGEDHN
C=CC[C@H](C)NC(=O)NC[C@H](c1ccc(OC)cc1)N1CCCC1	ZINC000172077961	455118470	/nfs/dbraw/zinc/11/84/70/455118470.db2.gz	NSRWQYBDQOPXSV-MAUKXSAKSA-N	0	3	331.460	3.096	20	30		EGEDHN
COCc1ccc(CNCc2cn(C)nc2-c2ccc(C#N)cc2)cc1	ZINC000180045038	455121932	/nfs/dbraw/zinc/12/19/32/455121932.db2.gz	AJMXNXRUFWLCMP-UHFFFAOYSA-N	0	3	346.434	3.395	20	30		EGEDHN
N#CCc1cccc(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)c1	ZINC000172112703	455124040	/nfs/dbraw/zinc/12/40/40/455124040.db2.gz	DWDATNMDMFCAJD-FQEVSTJZSA-N	0	3	333.435	3.147	20	30		EGEDHN
COC(=O)c1cc(CNCCSCc2ccccc2C#N)oc1C	ZINC000180357948	455161255	/nfs/dbraw/zinc/16/12/55/455161255.db2.gz	NZTGDISXFUIMJF-UHFFFAOYSA-N	0	3	344.436	3.269	20	30		EGEDHN
C[C@H](NCc1ccc(OCC#N)cc1)c1ccc([S@@](C)=O)cc1	ZINC000180558427	455196518	/nfs/dbraw/zinc/19/65/18/455196518.db2.gz	OAFYJJNIEBSRCT-LFVRLGFBSA-N	0	3	328.437	3.177	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC=C(CNCc2ccc(C#N)s2)CC1	ZINC000189477171	455202612	/nfs/dbraw/zinc/20/26/12/455202612.db2.gz	APKPEKBRCFLHEL-UHFFFAOYSA-N	0	3	333.457	3.277	20	30		EGEDHN
CN(CCC(=O)Nc1ccc(C#N)c(Cl)c1)CCc1nccs1	ZINC000157569587	455208105	/nfs/dbraw/zinc/20/81/05/455208105.db2.gz	RCSFQZRRSNCKAV-UHFFFAOYSA-N	0	3	348.859	3.171	20	30		EGEDHN
CCS[C@@H]1CCCC[C@@H]1N[C@@H](C)C(=O)NC1(C#N)CCCCC1	ZINC000189511902	455211714	/nfs/dbraw/zinc/21/17/14/455211714.db2.gz	IFJNGMNWEKVIQA-HRCADAONSA-N	0	3	337.533	3.371	20	30		EGEDHN
COC(=O)COc1ccc(CN(C)[C@@H](C)c2ccc(C#N)cc2)cc1	ZINC000183047011	455216549	/nfs/dbraw/zinc/21/65/49/455216549.db2.gz	JVXPDMZCPQFUIZ-HNNXBMFYSA-N	0	3	338.407	3.303	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2NCc1ccc2c(c1)C(=O)NCC2	ZINC000612574241	460666295	/nfs/dbraw/zinc/66/62/95/460666295.db2.gz	UHFMTZCJKHBDAX-FQEVSTJZSA-N	0	3	331.419	3.011	20	30		EGEDHN
C=CCOCCCC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1	ZINC000173533124	455301522	/nfs/dbraw/zinc/30/15/22/455301522.db2.gz	WUDXAUXSKHFAQI-GOSISDBHSA-N	0	3	330.472	3.092	20	30		EGEDHN
C[C@H](NCC(=O)Nc1cccc(C#N)c1)c1cccc(-n2cccn2)c1	ZINC000183566555	455306926	/nfs/dbraw/zinc/30/69/26/455306926.db2.gz	JNCGEGZBYKWXHZ-HNNXBMFYSA-N	0	3	345.406	3.033	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc3c(c2)O[C@](C)(CC)O3)CC1	ZINC000190498980	455333818	/nfs/dbraw/zinc/33/38/18/455333818.db2.gz	PUNMVQHQFUHBKP-LJQANCHMSA-N	0	3	345.443	3.356	20	30		EGEDHN
COc1ccc(CN2CCC(CNc3cccc(C#N)n3)CC2)cc1	ZINC000265512641	455336331	/nfs/dbraw/zinc/33/63/31/455336331.db2.gz	KNZXUCCEYYFIAN-UHFFFAOYSA-N	0	3	336.439	3.286	20	30		EGEDHN
Cc1ccc(O)c([C@@H](C)N[C@H]2CCN(Cc3ccc(C#N)cc3)C2=O)c1	ZINC000190618258	455353992	/nfs/dbraw/zinc/35/39/92/455353992.db2.gz	CPFGSMQOIRZAEU-BEFAXECRSA-N	0	3	349.434	3.024	20	30		EGEDHN
CCN1CCN(c2cccc(NC(=O)C3(C#N)CCCCC3)c2)CC1	ZINC000184270507	455368042	/nfs/dbraw/zinc/36/80/42/455368042.db2.gz	JMOLDJDVJCVUGX-UHFFFAOYSA-N	0	3	340.471	3.241	20	30		EGEDHN
C[C@@H]1C[C@@H]1[C@@H](NCCC(=O)N(C)CCC#N)c1ccc(Cl)cc1	ZINC000245835935	455384418	/nfs/dbraw/zinc/38/44/18/455384418.db2.gz	CPGRNMVXDALQSD-SKDZVZGDSA-N	0	3	333.863	3.389	20	30		EGEDHN
N#CC(C(=O)c1ccc(N2CCCC2)nc1)c1cnc2ccccc2n1	ZINC000190883534	455397366	/nfs/dbraw/zinc/39/73/66/455397366.db2.gz	VIWPQDLMAKBMKQ-OAHLLOKOSA-N	0	3	343.390	3.115	20	30		EGEDHN
COc1cc(OC)cc(OCCN[C@@H](C)c2cccc(C#N)c2)c1	ZINC000182020504	455418519	/nfs/dbraw/zinc/41/85/19/455418519.db2.gz	YZAFQLAGIGSKCY-AWEZNQCLSA-N	0	3	326.396	3.305	20	30		EGEDHN
Cc1cc([C@@](C)(O)CNCc2ccc(N(C)CCC#N)cc2)c(C)o1	ZINC000266128274	455423896	/nfs/dbraw/zinc/42/38/96/455423896.db2.gz	CCOMUGKYQJXDLD-FQEVSTJZSA-N	0	3	341.455	3.244	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@@H](C)N1CC[C@H](COCC)C1	ZINC000246101578	455426741	/nfs/dbraw/zinc/42/67/41/455426741.db2.gz	BBFFNZLERGNGEM-CVEARBPZSA-N	0	3	336.501	3.010	20	30		EGEDHN
COc1cc(NC(=O)C(C#N)c2nc(C)c(C)s2)cc(OC)c1	ZINC000160148829	455432668	/nfs/dbraw/zinc/43/26/68/455432668.db2.gz	DKYIXYIDWSLFIX-AWEZNQCLSA-N	0	3	331.397	3.023	20	30		EGEDHN
C=CCOc1ccc(-c2nnc(SC[C@@H]3CCN(C)C3)o2)cc1	ZINC000191202617	455463466	/nfs/dbraw/zinc/46/34/66/455463466.db2.gz	CFDOHMSZZPFZLR-CYBMUJFWSA-N	0	3	331.441	3.345	20	30		EGEDHN
C[C@H](N[C@H](Cc1ccccc1)c1cccs1)C(=O)N(C)CCC#N	ZINC000184988677	455482718	/nfs/dbraw/zinc/48/27/18/455482718.db2.gz	ZRADGRSVSZADEM-DOTOQJQBSA-N	0	3	341.480	3.382	20	30		EGEDHN
C[C@H]1CN(C)CC[C@@H]1N(C)C(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000160730910	455492691	/nfs/dbraw/zinc/49/26/91/455492691.db2.gz	ZVHAPLBELRWNNV-SZMVWBNQSA-N	0	3	328.460	3.013	20	30		EGEDHN
CCOC(=O)[C@@](C)(CNCc1cc(C#N)cs1)c1ccccc1	ZINC000191634111	455505841	/nfs/dbraw/zinc/50/58/41/455505841.db2.gz	VWPHHFAWWKHGME-SFHVURJKSA-N	0	3	328.437	3.230	20	30		EGEDHN
CC[C@H](NCCC(=O)Nc1sccc1C#N)c1c(C)noc1C	ZINC000182452772	455516951	/nfs/dbraw/zinc/51/69/51/455516951.db2.gz	JPOVTRASTQQFFY-ZDUSSCGKSA-N	0	3	332.429	3.294	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@H](NCc1ccc(F)c(C#N)c1)C1CC1	ZINC000185227378	455525698	/nfs/dbraw/zinc/52/56/98/455525698.db2.gz	WDWAWXRZQTYLCQ-MRXNPFEDSA-N	0	3	333.407	3.090	20	30		EGEDHN
COc1ccccc1N(CCC#N)C(=O)[C@@H](C)N[C@H]1CCCC1(C)C	ZINC000191853990	455526193	/nfs/dbraw/zinc/52/61/93/455526193.db2.gz	OESFYHUOCQANMJ-QAPCUYQASA-N	0	3	343.471	3.499	20	30		EGEDHN
CN(C)CCN(C(=O)c1cccc(SCC#N)c1)C1CCCC1	ZINC000176030049	455530682	/nfs/dbraw/zinc/53/06/82/455530682.db2.gz	QOTHYJAIXZJCHI-UHFFFAOYSA-N	0	3	331.485	3.249	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)Cc1ccc(C#N)cc1	ZINC000267342880	455542885	/nfs/dbraw/zinc/54/28/85/455542885.db2.gz	BWXUKFAEPXGSNP-UWJYYQICSA-N	0	3	347.462	3.128	20	30		EGEDHN
N#Cc1ccc(NC2CCN(CCOc3ccc(F)cc3)CC2)nc1	ZINC000267949424	455569084	/nfs/dbraw/zinc/56/90/84/455569084.db2.gz	PWJWWZGNUVGGKD-UHFFFAOYSA-N	0	3	340.402	3.048	20	30		EGEDHN
CCN1CCN(Cc2ccc(N[C@H]3CCC[C@H](C#N)C3)cc2)CC1	ZINC000185726442	455607220	/nfs/dbraw/zinc/60/72/20/455607220.db2.gz	AZYBRJQHFXAQOQ-ICSRJNTNSA-N	0	3	326.488	3.318	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N(C)CCN(C)C1CC1)c1ccc(F)c(F)c1	ZINC000185842528	455633868	/nfs/dbraw/zinc/63/38/68/455633868.db2.gz	GLOVXESPSKUFIV-KRWDZBQOSA-N	0	3	337.414	3.318	20	30		EGEDHN
C[C@@H](NCCOc1ccccc1C#N)[C@@H]1OCCc2sccc21	ZINC000292373062	455645125	/nfs/dbraw/zinc/64/51/25/455645125.db2.gz	IZYRXNNRUWKXNR-ACJLOTCBSA-N	0	3	328.437	3.291	20	30		EGEDHN
C=CCSCCN[C@@H](C)c1ccc(OCCOC)c(OC)c1	ZINC000271507624	455663928	/nfs/dbraw/zinc/66/39/28/455663928.db2.gz	RVJKGOKGWJMONP-AWEZNQCLSA-N	0	3	325.474	3.290	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(Cl)cc2OC(F)F)CC1	ZINC000186025432	455678722	/nfs/dbraw/zinc/67/87/22/455678722.db2.gz	IFETXFVHZRQLNP-UHFFFAOYSA-N	0	3	342.773	3.225	20	30		EGEDHN
C[C@H](NC[C@H](O)COc1cccc2[nH]ccc21)c1ccc(C#N)cc1	ZINC000268462251	455689659	/nfs/dbraw/zinc/68/96/59/455689659.db2.gz	UWWLGWDVDRVKJP-YOEHRIQHSA-N	0	3	335.407	3.130	20	30		EGEDHN
C[C@@H](NCc1ccc(OCC#N)cc1)[C@H]1OCCc2sccc21	ZINC000292562155	455697437	/nfs/dbraw/zinc/69/74/37/455697437.db2.gz	ZIDYNVQASALXQR-FZKQIMNGSA-N	0	3	328.437	3.443	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@@H](C)N1CCCN(C(C)C)CC1	ZINC000292592045	455707038	/nfs/dbraw/zinc/70/70/38/455707038.db2.gz	VGOODMLFLNDAHK-QGZVFWFLSA-N	0	3	349.544	3.067	20	30		EGEDHN
C[C@@H]1CN(CC(=O)N(CCC#N)c2ccccc2)[C@@H]2CCCC[C@H]21	ZINC000248432233	455714693	/nfs/dbraw/zinc/71/46/93/455714693.db2.gz	QGNFIPSTDRKGFB-NZSAHSFTSA-N	0	3	325.456	3.444	20	30		EGEDHN
N#C[C@H]1CC[C@@H](N2CCC(NC(=O)Nc3ccc(F)cc3)CC2)C1	ZINC000292711993	455737787	/nfs/dbraw/zinc/73/77/87/455737787.db2.gz	FFORPEOBIVXQAK-SUMWQHHRSA-N	0	3	330.407	3.104	20	30		EGEDHN
CC(C)C(=O)NC1CCN(Cc2ccccc2C(C)(C)C#N)CC1	ZINC000268946032	455740491	/nfs/dbraw/zinc/74/04/91/455740491.db2.gz	CWKXJPICFIQDTE-UHFFFAOYSA-N	0	3	327.472	3.224	20	30		EGEDHN
CC(C)(C)C[C@H](NCC(=O)N(CCC#N)CCC#N)c1ccccc1	ZINC000271774777	455754263	/nfs/dbraw/zinc/75/42/63/455754263.db2.gz	OHRMZQPLTFGMAA-SFHVURJKSA-N	0	3	340.471	3.409	20	30		EGEDHN
CC[C@@H](CN(CC)CC(=O)N[C@](C)(C#N)C1CC1)c1ccccc1	ZINC000249430486	455755472	/nfs/dbraw/zinc/75/54/72/455755472.db2.gz	JOWPEZYDNSXKFE-OXJNMPFZSA-N	0	3	327.472	3.311	20	30		EGEDHN
CCO[C@@H]1C[C@H](NCc2ccc(C#N)s2)[C@H]1Oc1ccccc1	ZINC000249443386	455755685	/nfs/dbraw/zinc/75/56/85/455755685.db2.gz	MNTYCZZANISWGA-RCCFBDPRSA-N	0	3	328.437	3.334	20	30		EGEDHN
C#CCOc1cccc(NC(=O)N2CCN(C3CCC3)C[C@@H](C)C2)c1	ZINC000292970353	455769036	/nfs/dbraw/zinc/76/90/36/455769036.db2.gz	PYHVAVRRZXWWEL-MRXNPFEDSA-N	0	3	341.455	3.037	20	30		EGEDHN
CC[C@H](C)[N-]C(=S)C(C(=O)c1nccs1)[n+]1cccc(C)c1	ZINC000278161060	455774823	/nfs/dbraw/zinc/77/48/23/455774823.db2.gz	CEPOUQIKFJXJAT-LBPRGKRZSA-O	0	3	334.490	3.066	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)CC(C)(C)C1CC1	ZINC000293221143	455779330	/nfs/dbraw/zinc/77/93/30/455779330.db2.gz	VNPDJZBXPUMWMS-UHFFFAOYSA-N	0	3	327.472	3.275	20	30		EGEDHN
C=CCN(CCC#N)C(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F	ZINC000293927134	455801558	/nfs/dbraw/zinc/80/15/58/455801558.db2.gz	SZGZYIVGHQZYAU-KRWDZBQOSA-N	0	3	347.409	3.072	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(CC[C@@H](O)c3ccccc3)CC2)cc1	ZINC000285295825	455819854	/nfs/dbraw/zinc/81/98/54/455819854.db2.gz	UFAWOXWTTKOFIM-JOCHJYFZSA-N	0	3	349.478	3.190	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(-c3ccc(C)c(C)c3)n[nH]2)CC1	ZINC000186688118	455819929	/nfs/dbraw/zinc/81/99/29/455819929.db2.gz	DNVHACBJKZJRLW-UHFFFAOYSA-N	0	3	338.455	3.074	20	30		EGEDHN
C[C@H](CC#N)Sc1ccccc1NC(=O)CN[C@@H](CO)C(C)(C)C	ZINC000278578049	455841758	/nfs/dbraw/zinc/84/17/58/455841758.db2.gz	CLFNMNXMPCPUGD-CJNGLKHVSA-N	0	3	349.500	3.016	20	30		EGEDHN
Cn1cc(CNCCOC2CCCCC2)c(-c2ccc(C#N)cc2)n1	ZINC000272096417	455845353	/nfs/dbraw/zinc/84/53/53/455845353.db2.gz	FVDCNKWSQXZPEP-UHFFFAOYSA-N	0	3	338.455	3.398	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@@H](C)Cn2ccc3ccccc32)CC1	ZINC000285479537	455855155	/nfs/dbraw/zinc/85/51/55/455855155.db2.gz	VUKKNKZLCNGXTQ-INIZCTEOSA-N	0	3	325.456	3.044	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2[C@@H]3CCO[C@H]3C23CCC3)c(Br)c1	ZINC000295878208	455861698	/nfs/dbraw/zinc/86/16/98/455861698.db2.gz	FZMPFUMLQHKHHL-NUEKZKHPSA-N	0	3	347.256	3.368	20	30		EGEDHN
Cc1cccc(OC[C@H](C)NC(=O)C(C#N)Cc2ccc(C#N)cc2)c1	ZINC000279291173	455862544	/nfs/dbraw/zinc/86/25/44/455862544.db2.gz	LCENJIJILCAXBC-LPHOPBHVSA-N	0	3	347.418	3.133	20	30		EGEDHN
C[C@](C#N)(NC(=O)CN1C[C@H](c2ccccc2)[C@@H]2CCC[C@H]21)C1CC1	ZINC000285556023	455868570	/nfs/dbraw/zinc/86/85/70/455868570.db2.gz	VASZZBPICGREMP-QEUVDIPISA-N	0	3	337.467	3.063	20	30		EGEDHN
C#CCOc1ccc(CNCc2ccc(NC(=O)N(C)C)cc2)cc1	ZINC000279909192	455876470	/nfs/dbraw/zinc/87/64/70/455876470.db2.gz	RJGKPRPCKAQYTJ-UHFFFAOYSA-N	0	3	337.423	3.082	20	30		EGEDHN
C[C@H]1COc2ccccc2CN1C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000280019294	455880834	/nfs/dbraw/zinc/88/08/34/455880834.db2.gz	MLGBREXPICFWKS-HNAYVOBHSA-N	0	3	345.402	3.050	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NC1CCN([C@@H](C)c2ccncc2)CC1)OCC	ZINC000270166872	455893058	/nfs/dbraw/zinc/89/30/58/455893058.db2.gz	BSCHACROSRNBRE-QFBILLFUSA-N	0	3	345.487	3.095	20	30		EGEDHN
C[C@H](CCN[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O)c1ccccc1	ZINC000194891841	455897292	/nfs/dbraw/zinc/89/72/92/455897292.db2.gz	JPCAPQYSOJADSX-DYESRHJHSA-N	0	3	347.462	3.443	20	30		EGEDHN
C=CCC[C@H](NCCNC(=O)c1ccc(OC)cc1)c1ccco1	ZINC000285893221	455936926	/nfs/dbraw/zinc/93/69/26/455936926.db2.gz	CJJRVDXGNMNBNS-KRWDZBQOSA-N	0	3	328.412	3.315	20	30		EGEDHN
C#CCOc1ccc(CNC(=O)Nc2cccc(CN(C)C)c2)cc1	ZINC000296474413	455948868	/nfs/dbraw/zinc/94/88/68/455948868.db2.gz	XDFYSSMCCANOQR-UHFFFAOYSA-N	0	3	337.423	3.082	20	30		EGEDHN
C#CCOc1ccc(CN[C@@H](C)c2ccc(C(=O)N(C)C)cc2)cc1	ZINC000296508096	455958090	/nfs/dbraw/zinc/95/80/90/455958090.db2.gz	PIURYTZUCQBUHO-INIZCTEOSA-N	0	3	336.435	3.251	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@H](NCc1ccc(C#N)o1)C1CCCC1	ZINC000195458207	455963825	/nfs/dbraw/zinc/96/38/25/455963825.db2.gz	VXAVVIXYXQNKBR-INIZCTEOSA-N	0	3	333.432	3.324	20	30		EGEDHN
C[C@@H](OC[C@@H](O)CN1CCC(C)(C#N)CC1)c1ccc(Cl)cc1	ZINC000272505094	455973981	/nfs/dbraw/zinc/97/39/81/455973981.db2.gz	FEKJGWJUMJHZOD-PBHICJAKSA-N	0	3	336.863	3.404	20	30		EGEDHN
CS[C@@H]1CCC[C@@H](NC(=O)C(C#N)Cc2ccc(C#N)cc2)C1	ZINC000280463938	455976161	/nfs/dbraw/zinc/97/61/61/455976161.db2.gz	ONWCKRGOKVKTLN-GVDBMIGSSA-N	0	3	327.453	3.031	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)N(CCN(C)C)Cc1cccc(Cl)c1	ZINC000280508540	455986371	/nfs/dbraw/zinc/98/63/71/455986371.db2.gz	CRKJDABKRSBDTG-UHFFFAOYSA-N	0	3	345.830	3.317	20	30		EGEDHN
C[C@@H]([NH2+][C@H]1CCCN(c2ccc(C#N)cc2)C1=O)c1ccccc1[O-]	ZINC000272553040	455991674	/nfs/dbraw/zinc/99/16/74/455991674.db2.gz	SUVMSSOUASECJW-KDOFPFPSSA-N	0	3	335.407	3.110	20	30		EGEDHN
Cc1nnc(N2CC[C@]3(CCN(Cc4ccccc4)C3)C2)c(C#N)c1C	ZINC000286247006	456008630	/nfs/dbraw/zinc/00/86/30/456008630.db2.gz	FTPWPKAKVCMDOT-NRFANRHFSA-N	0	3	347.466	3.068	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN2CC[C@H](N3CCCC3)[C@H]2C)c1C	ZINC000286813617	456053973	/nfs/dbraw/zinc/05/39/73/456053973.db2.gz	JTOWRBLNFTUKLA-MJGOQNOKSA-N	0	3	329.488	3.032	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)NC2(C)CCCCC2)cc1	ZINC000287492184	456070157	/nfs/dbraw/zinc/07/01/57/456070157.db2.gz	ZSHHHPJWJMMPIW-CYBMUJFWSA-N	0	3	349.456	3.217	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)NC2(C)CCCCC2)cc1	ZINC000287492186	456071496	/nfs/dbraw/zinc/07/14/96/456071496.db2.gz	ZSHHHPJWJMMPIW-ZDUSSCGKSA-N	0	3	349.456	3.217	20	30		EGEDHN
CC1=CCCN(CCC(=O)Nc2sc3c(c2C#N)CCCC3)C1	ZINC000280944906	456089693	/nfs/dbraw/zinc/08/96/93/456089693.db2.gz	WQQIXIXCPWWJPP-UHFFFAOYSA-N	0	3	329.469	3.479	20	30		EGEDHN
C=CCN(CCc1ccccc1)C(=O)N[C@H](C)C1=CCN(C)CC1	ZINC000272900590	456106459	/nfs/dbraw/zinc/10/64/59/456106459.db2.gz	IPVMJMREMWBQNA-QGZVFWFLSA-N	0	3	327.472	3.077	20	30		EGEDHN
CC(C)c1nc2n(n1)C[C@@H](N[C@@H](C)c1ccc(C#N)cc1F)CC2	ZINC000332690520	456112530	/nfs/dbraw/zinc/11/25/30/456112530.db2.gz	WHOLFOKRMUBUBF-JSGCOSHPSA-N	0	3	327.407	3.078	20	30		EGEDHN
C#Cc1ccc(CNCc2cccc(NC(=O)[C@@H]3CCCO3)c2)cc1	ZINC000289295315	456120493	/nfs/dbraw/zinc/12/04/93/456120493.db2.gz	QDINKOLLAQOXHS-FQEVSTJZSA-N	0	3	334.419	3.075	20	30		EGEDHN
COC[C@@]1(CN[C@@H](C)c2cccc(C#N)c2)OCCc2ccccc21	ZINC000289765955	456140922	/nfs/dbraw/zinc/14/09/22/456140922.db2.gz	LWXSRKYTSLVHMN-HRAATJIYSA-N	0	3	336.435	3.323	20	30		EGEDHN
COC[C@@]1(CN[C@H](C)c2cccc(C#N)c2)OCCc2ccccc21	ZINC000289765960	456141118	/nfs/dbraw/zinc/14/11/18/456141118.db2.gz	LWXSRKYTSLVHMN-IIBYNOLFSA-N	0	3	336.435	3.323	20	30		EGEDHN
N#CCC[C@H](NC(=O)C1C[C@H](c2ccccc2)OC1=O)c1ccccc1	ZINC000289816562	456143365	/nfs/dbraw/zinc/14/33/65/456143365.db2.gz	NVVDWKNHPVXPIS-GBESFXJTSA-N	0	3	348.402	3.452	20	30		EGEDHN
COc1ccc(CN[C@@]2(C)CCO[C@H]2C2CC2)cc1OCCCC#N	ZINC000273046120	456159571	/nfs/dbraw/zinc/15/95/71/456159571.db2.gz	BNGJEMBDZZZMAT-PMACEKPBSA-N	0	3	344.455	3.425	20	30		EGEDHN
COCCOCc1ccc(CNCc2ccc(OC)c(C#N)c2)cc1	ZINC000289893408	456171794	/nfs/dbraw/zinc/17/17/94/456171794.db2.gz	YAXXNHORPFVFBB-UHFFFAOYSA-N	0	3	340.423	3.020	20	30		EGEDHN
Cc1nc(CCN2CCCN(c3ccccc3C#N)CC2)cs1	ZINC000271282872	456205975	/nfs/dbraw/zinc/20/59/75/456205975.db2.gz	KZJHQHVEOAIIPT-UHFFFAOYSA-N	0	3	326.469	3.078	20	30		EGEDHN
COc1ccc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)cc1C#N	ZINC000281342687	456206977	/nfs/dbraw/zinc/20/69/77/456206977.db2.gz	ZJFNXDATJUKGDZ-KRWDZBQOSA-N	0	3	349.434	3.052	20	30		EGEDHN
CC(C)(C)[C@@](C)(C#N)NC(=O)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000274387994	456257478	/nfs/dbraw/zinc/25/74/78/456257478.db2.gz	ZVLDYPPHQXTQIW-YLJYHZDGSA-N	0	3	327.472	3.343	20	30		EGEDHN
CN(CCN(C)C1CC1)C(=O)Nc1cccc(C#Cc2ccccn2)c1	ZINC000274615367	456262566	/nfs/dbraw/zinc/26/25/66/456262566.db2.gz	RNIBKVLPPCDJGP-UHFFFAOYSA-N	0	3	348.450	3.039	20	30		EGEDHN
CN(CC(=O)N[C@](C)(C#N)C1CC1)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000297622492	456266057	/nfs/dbraw/zinc/26/60/57/456266057.db2.gz	VYVNVHRNVKICKG-QWFCFKBJSA-N	0	3	325.456	3.063	20	30		EGEDHN
N#Cc1c(NCCCN2CCc3ccccc3C2)nc2ccccn12	ZINC000302104215	456287430	/nfs/dbraw/zinc/28/74/30/456287430.db2.gz	RFCUWGYKFQMPGO-UHFFFAOYSA-N	0	3	331.423	3.066	20	30		EGEDHN
CCCn1ccnc1CCCN(C)Cc1ccc(C#N)c(OC)c1	ZINC000290363394	456306143	/nfs/dbraw/zinc/30/61/43/456306143.db2.gz	GXTKZLORPVDYDP-UHFFFAOYSA-N	0	3	326.444	3.238	20	30		EGEDHN
CN(CCCn1ccnc1)Cc1cn(CCC#N)nc1-c1ccccc1	ZINC000290450404	456331690	/nfs/dbraw/zinc/33/16/90/456331690.db2.gz	MIMVNPFBWCTTKE-UHFFFAOYSA-N	0	3	348.454	3.182	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)c1ncnc2cccc(F)c21	ZINC000347749750	456348585	/nfs/dbraw/zinc/34/85/85/456348585.db2.gz	GTSCKFBJDTUJIO-UHFFFAOYSA-N	0	3	349.413	3.209	20	30		EGEDHN
CCCN(C)[C@H](CNc1nccnc1C#N)c1ccc(Cl)cc1	ZINC000343223413	456463391	/nfs/dbraw/zinc/46/33/91/456463391.db2.gz	GXVKZGJBINLGCC-MRXNPFEDSA-N	0	3	329.835	3.497	20	30		EGEDHN
C=CCc1cc(CNC[C@H](O)[C@H](C)c2ccccc2)cc(OC)c1O	ZINC000657797014	462272839	/nfs/dbraw/zinc/27/28/39/462272839.db2.gz	YNXJDWILFVWZLP-BEFAXECRSA-N	0	3	341.451	3.384	20	30		EGEDHN
C[C@@H](C(=O)N(Cc1ccc(C#N)cc1)C1CC1)N1[C@H](C)CC[C@H]1C	ZINC000298696223	456520142	/nfs/dbraw/zinc/52/01/42/456520142.db2.gz	SREGAEFUUPBRMR-OAGGEKHMSA-N	0	3	325.456	3.311	20	30		EGEDHN
COc1cc(CN[C@@H]2CCN([C@H](C)c3ccccc3)C2)ccc1C#N	ZINC000353194356	456551069	/nfs/dbraw/zinc/55/10/69/456551069.db2.gz	TVUHDSAVBPIKRV-OXQOHEQNSA-N	0	3	335.451	3.492	20	30		EGEDHN
Cn1cc(CN[C@@]2(Cc3ccc(Cl)cc3)CCOC2)cc1C#N	ZINC000282590520	456562501	/nfs/dbraw/zinc/56/25/01/456562501.db2.gz	GTKOATQCGJGDMY-GOSISDBHSA-N	0	3	329.831	3.042	20	30		EGEDHN
C=CCn1c(C2CC2)nnc1N1CCN(C2CCC(C)CC2)CC1	ZINC000337824944	456567024	/nfs/dbraw/zinc/56/70/24/456567024.db2.gz	VELGNSUYZWETNE-UHFFFAOYSA-N	0	3	329.492	3.042	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)N[C@H]1CCN(C)[C@@H](C)C1	ZINC000340694468	456632626	/nfs/dbraw/zinc/63/26/26/456632626.db2.gz	FEQMINCQOYHEHC-FZMZJTMJSA-N	0	3	327.453	3.294	20	30		EGEDHN
C#CCCCC(=O)Nc1cc(C)cc(N2CCN(C(C)C)CC2)c1	ZINC000276964227	456634460	/nfs/dbraw/zinc/63/44/60/456634460.db2.gz	DQLGQWQRDHZKJV-UHFFFAOYSA-N	0	3	327.472	3.267	20	30		EGEDHN
CO[C@H]1CCCC[C@H]1NCC(=O)N(CCC#N)c1cccc(Cl)c1	ZINC000277065377	456668410	/nfs/dbraw/zinc/66/84/10/456668410.db2.gz	WLSXAYOFRWPIDP-SJORKVTESA-N	0	3	349.862	3.134	20	30		EGEDHN
C=C(C)COc1cccc(NC(=O)N2C[C@@H](SC)[C@@H](N(C)C)C2)c1	ZINC000353409997	456682930	/nfs/dbraw/zinc/68/29/30/456682930.db2.gz	WWXUMVKWPXSRFG-DLBZAZTESA-N	0	3	349.500	3.151	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)NCc1oc(CC)nc1C)C(C)C	ZINC000291597617	456691157	/nfs/dbraw/zinc/69/11/57/456691157.db2.gz	IERZSBOHNDOYEO-INIZCTEOSA-N	0	3	348.491	3.043	20	30		EGEDHN
N#CCN(C(=O)[C@H]1CCCN(Cc2ccccc2)C1)C1CCCC1	ZINC000348466050	456699368	/nfs/dbraw/zinc/69/93/68/456699368.db2.gz	PALSOESHSHLOAM-SFHVURJKSA-N	0	3	325.456	3.193	20	30		EGEDHN
C[C@H](C1CCN(C)CC1)N(C)C(=O)Nc1nccn1-c1ccccc1	ZINC000328732106	456747494	/nfs/dbraw/zinc/74/74/94/456747494.db2.gz	GYRCOCCZPGCPAY-OAHLLOKOSA-N	0	3	341.459	3.080	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cc(Cl)c(OC)c(Cl)c2)CC1	ZINC000299673523	456761729	/nfs/dbraw/zinc/76/17/29/456761729.db2.gz	NQANEKWCUFECIE-UHFFFAOYSA-N	0	3	341.238	3.286	20	30		EGEDHN
C[C@H](CC(=O)N1CCCN(CC2CCC2)CC1)NC(=O)C1CCCC1	ZINC000328797134	456762713	/nfs/dbraw/zinc/76/27/13/456762713.db2.gz	VMPFVJGSPGAJHE-MRXNPFEDSA-N	0	3	349.519	3.246	20	30		EGEDHN
CC(C#N)C(=O)N1C[C@@H](c2cccc(C(F)(F)F)c2)OC[C@H]1C	ZINC000341000799	456808095	/nfs/dbraw/zinc/80/80/95/456808095.db2.gz	JCGUUUDVANGALO-GYSYKLTISA-N	0	3	326.318	3.153	20	30		EGEDHN
C=C(C)CN1CCC(Nc2ncnc3nc(SC)sc32)CC1	ZINC000301152303	456809682	/nfs/dbraw/zinc/80/96/82/456809682.db2.gz	BBABRKQPUSQDCK-UHFFFAOYSA-N	0	3	335.502	3.261	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)[C@@H]1CC12CCCC2	ZINC000353661128	456838732	/nfs/dbraw/zinc/83/87/32/456838732.db2.gz	OFVYJYONOLBMFJ-SFHVURJKSA-N	0	3	325.456	3.029	20	30		EGEDHN
CN(C)c1cc(Br)cc(C(=O)C(C#N)c2ccccn2)c1	ZINC000344749338	456854187	/nfs/dbraw/zinc/85/41/87/456854187.db2.gz	UCRSEBIZUHTDQE-AWEZNQCLSA-N	0	3	344.212	3.400	20	30		EGEDHN
O=C(N[C@H]1CC(=O)N(c2ccccc2)C1)[C@H]1CCCN1C1CCCC1	ZINC000329249261	456861268	/nfs/dbraw/zinc/86/12/68/456861268.db2.gz	WZFUIDXOWQASIS-MAUKXSAKSA-N	0	3	341.455	3.155	20	30		EGEDHN
Cc1cc(N2CCCCCC2)ccc1NC([O-])=[NH+][C@H]1[C@@H]2COC[C@@H]21	ZINC000329261173	456863136	/nfs/dbraw/zinc/86/31/36/456863136.db2.gz	ZCJPITGFNDVDRO-VQFNDLOPSA-N	0	3	329.444	3.346	20	30		EGEDHN
CC(C)(C)c1cc(NC(=O)CN2CC[C@@H](N3CCCCC3)C2)on1	ZINC000329278619	456866007	/nfs/dbraw/zinc/86/60/07/456866007.db2.gz	JSDWJTBYJQLBOS-CQSZACIVSA-N	0	3	334.464	3.120	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2sc([C@H]3CCCO3)nc2C)CC1	ZINC000341586800	456878351	/nfs/dbraw/zinc/87/83/51/456878351.db2.gz	CPTWMIHUUCNBOK-OAHLLOKOSA-N	0	3	349.500	3.073	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C2CCOCC2)CCO1	ZINC000329490772	456899633	/nfs/dbraw/zinc/89/96/33/456899633.db2.gz	SPFJLRRMXSEUAK-NXHRZFHOSA-N	0	3	338.492	3.180	20	30		EGEDHN
N#Cc1ccc(C2=CCN(C[C@@H](O)Cc3ccc(F)cc3)CC2)cc1	ZINC000339060188	456921779	/nfs/dbraw/zinc/92/17/79/456921779.db2.gz	FTIFSCPVTJTKBH-NRFANRHFSA-N	0	3	336.410	3.390	20	30		EGEDHN
C[C@@H](C(=O)Nc1ccc2c(c1)OCO2)N1CCC2(CCOCC2)[C@@H]1C	ZINC000329666870	456923987	/nfs/dbraw/zinc/92/39/87/456923987.db2.gz	LBYVXODMAWJPAV-KBPBESRZSA-N	0	3	346.427	3.283	20	30		EGEDHN
C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH+]=C([O-])N[C@H]1CCc2nc[nH]c2C1	ZINC000329727691	456932274	/nfs/dbraw/zinc/93/22/74/456932274.db2.gz	OVNGZWNPTTYFAH-FTLABTOESA-N	0	3	342.418	3.233	20	30		EGEDHN
[O-]C(N[C@@H]1CCc2nc[nH]c2C1)=[NH+][C@@H]1CCc2c1cccc2Cl	ZINC000329743311	456934233	/nfs/dbraw/zinc/93/42/33/456934233.db2.gz	XCZNWPUPPCRAIC-QMTHXVAHSA-N	0	3	330.819	3.112	20	30		EGEDHN
[O-]C(N[C@@H]1CCc2[nH]cnc2C1)=[NH+][C@@H]1CCc2c1cccc2Cl	ZINC000329743311	456934238	/nfs/dbraw/zinc/93/42/38/456934238.db2.gz	XCZNWPUPPCRAIC-QMTHXVAHSA-N	0	3	330.819	3.112	20	30		EGEDHN
Cc1cc(NC(=O)NC2CCN(C3CC3)CC2)nn1C1CCCCC1	ZINC000329770533	456938643	/nfs/dbraw/zinc/93/86/43/456938643.db2.gz	GCKHXPRQNSNVST-UHFFFAOYSA-N	0	3	345.491	3.071	20	30		EGEDHN
Cc1onc(CC(=O)Nc2cccc(CN3CCCCC3)c2)c1C#N	ZINC000353888610	456951890	/nfs/dbraw/zinc/95/18/90/456951890.db2.gz	PTOYFCVNUVGEOY-UHFFFAOYSA-N	0	3	338.411	3.022	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCc2nccc3ccccc32)cc1	ZINC000349422388	456967056	/nfs/dbraw/zinc/96/70/56/456967056.db2.gz	IVNSHAOVFNYBQQ-GOSISDBHSA-N	0	3	340.386	3.105	20	30		EGEDHN
CCCN(Cc1nnc(-c2ccccc2Cl)o1)C(=O)C(C)C#N	ZINC000345551972	456982328	/nfs/dbraw/zinc/98/23/28/456982328.db2.gz	UQPFPLCDDAQYBA-NSHDSACASA-N	0	3	332.791	3.288	20	30		EGEDHN
Cc1nccc(NC(=O)NC2CCN([C@H](C)c3ccccc3)CC2)n1	ZINC000330105190	456985810	/nfs/dbraw/zinc/98/58/10/456985810.db2.gz	IGARCJYPFDWLTO-CQSZACIVSA-N	0	3	339.443	3.337	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc3nc(C)sc3c2)CC1	ZINC000346006447	457011506	/nfs/dbraw/zinc/01/15/06/457011506.db2.gz	SFMOUXJFAYSAPA-UHFFFAOYSA-N	0	3	329.469	3.375	20	30		EGEDHN
C[C@@H]1C[C@H]1N1CCN(C(=O)c2ccc(C3(C#N)CC3)cc2)C[C@@H](C)C1	ZINC000346221311	457024155	/nfs/dbraw/zinc/02/41/55/457024155.db2.gz	VPDZGZVXQRJGCD-FRQCXROJSA-N	0	3	337.467	3.044	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CCC2(CCOCC2)CC1	ZINC000341984018	457040990	/nfs/dbraw/zinc/04/09/90/457040990.db2.gz	GPYLIMWWFNXGCP-LJQANCHMSA-N	0	3	345.483	3.047	20	30		EGEDHN
CN(C)CCOc1ccc(CCNc2nccc(C#N)c2Cl)cc1	ZINC000341989359	457046112	/nfs/dbraw/zinc/04/61/12/457046112.db2.gz	VZKWCCCGBYLXGJ-UHFFFAOYSA-N	0	3	344.846	3.202	20	30		EGEDHN
C[C@@H]1[C@H](NC(=O)Nc2cccc(C#N)c2)CCN1Cc1ccccc1	ZINC000359006096	457046374	/nfs/dbraw/zinc/04/63/74/457046374.db2.gz	HEGGYKKXNJMLRI-DNVCBOLYSA-N	0	3	334.423	3.343	20	30		EGEDHN
CC(C)C[C@@](C)(C#N)NC(=O)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000330484765	457049073	/nfs/dbraw/zinc/04/90/73/457049073.db2.gz	YUPJBNDRKUAWHS-QUCCMNQESA-N	0	3	327.472	3.343	20	30		EGEDHN
CN(C(=O)C(C#N)CCc1ccccc1)[C@H](CCO)c1ccccc1	ZINC000339352577	457064359	/nfs/dbraw/zinc/06/43/59/457064359.db2.gz	NZSZAIQXTABCQV-WOJBJXKFSA-N	0	3	336.435	3.341	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N[C@@H](C)c1cncc(F)c1)C(C)C	ZINC000359346802	457075250	/nfs/dbraw/zinc/07/52/50/457075250.db2.gz	ZMDVBOWGGCEUPL-YJBOKZPZSA-N	0	3	348.466	3.280	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1)OCC	ZINC000339383561	457081665	/nfs/dbraw/zinc/08/16/65/457081665.db2.gz	WEZMQJIJXMZKMB-WOJBJXKFSA-N	0	3	344.499	3.481	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCCN(C(=O)CCC(F)(F)F)C2)s1	ZINC000342186894	457156601	/nfs/dbraw/zinc/15/66/01/457156601.db2.gz	FFLBIYZKKYPMCD-NSHDSACASA-N	0	3	345.390	3.043	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)C(C)(C)c1cccnc1)C(C)C	ZINC000350084953	457163538	/nfs/dbraw/zinc/16/35/38/457163538.db2.gz	WZGTUDAMXJUNDC-GOSISDBHSA-N	0	3	329.488	3.174	20	30		EGEDHN
C=C(CN[C@H](C)c1ccc(NS(C)(=O)=O)cc1)c1ccccc1	ZINC000346778068	457165155	/nfs/dbraw/zinc/16/51/55/457165155.db2.gz	LTWLALLSARMZHX-OAHLLOKOSA-N	0	3	330.453	3.422	20	30		EGEDHN
CCc1cnccc1[C@H](C)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000350824395	457208424	/nfs/dbraw/zinc/20/84/24/457208424.db2.gz	DWQPSIKLMFFYTE-KSSFIOAISA-N	0	3	332.407	3.075	20	30		EGEDHN
CC(C#N)C(=O)N(Cc1cc(Br)ccc1F)C1CC1	ZINC000347074567	457217359	/nfs/dbraw/zinc/21/73/59/457217359.db2.gz	RQRNMTCWLCEPCX-SECBINFHSA-N	0	3	325.181	3.239	20	30		EGEDHN
N#CCCCOc1cccc(CNCc2ccc(-n3ccnc3)nc2)c1	ZINC000363086352	457218523	/nfs/dbraw/zinc/21/85/23/457218523.db2.gz	UYVRQDHPGZYRIP-UHFFFAOYSA-N	0	3	347.422	3.240	20	30		EGEDHN
Cc1cc(C(=O)C(C#N)c2ccncn2)c(C)cc1Br	ZINC000354460713	457238679	/nfs/dbraw/zinc/23/86/79/457238679.db2.gz	FQFKXJQRPGBEGP-LBPRGKRZSA-N	0	3	330.185	3.346	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN1CCCN(Cc2ccccc2)C[C@@H]1C	ZINC000354472792	457246006	/nfs/dbraw/zinc/24/60/06/457246006.db2.gz	YREXJLOTHYTRFG-IBGZPJMESA-N	0	3	343.515	3.007	20	30		EGEDHN
N#CC(C(=O)c1ccccc1NC(=O)c1cccs1)c1ccncn1	ZINC000354473652	457246513	/nfs/dbraw/zinc/24/65/13/457246513.db2.gz	VVVINLNVPSCGSR-CYBMUJFWSA-N	0	3	348.387	3.280	20	30		EGEDHN
C[C@@H](CCC#N)N(C)C[C@@H](O)COc1ccccc1C(F)(F)F	ZINC000351269696	457249404	/nfs/dbraw/zinc/24/94/04/457249404.db2.gz	MPWIUEZHHLOUKX-QWHCGFSZSA-N	0	3	330.350	3.069	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1)OCC	ZINC000354733607	457316891	/nfs/dbraw/zinc/31/68/91/457316891.db2.gz	DEFADNKEAALKBV-PMACEKPBSA-N	0	3	344.499	3.481	20	30		EGEDHN
N#CC[C@H](CC(=O)NC[C@@H]1CCCCN1C1CC1)c1ccccc1	ZINC000357154700	457349926	/nfs/dbraw/zinc/34/99/26/457349926.db2.gz	WCNGRYNZDLATLT-MJGOQNOKSA-N	0	3	325.456	3.207	20	30		EGEDHN
C=CCCCCCN(C)C(=O)NCC(C)(C)N1CCC(OC)CC1	ZINC000352447351	457373914	/nfs/dbraw/zinc/37/39/14/457373914.db2.gz	KUOGHHRBDNHJTH-UHFFFAOYSA-N	0	3	339.524	3.264	20	30		EGEDHN
CCC(C#N)(CC)C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000379717605	457418496	/nfs/dbraw/zinc/41/84/96/457418496.db2.gz	OPPWKICQLITOKT-SJLPKXTDSA-N	0	3	327.472	3.486	20	30		EGEDHN
C=CC[C@@H](CO)CNCc1ccc(-c2ccc(C(=O)OC)cc2)o1	ZINC000360907889	457425475	/nfs/dbraw/zinc/42/54/75/457425475.db2.gz	BWGSHRYBSMJGTB-CQSZACIVSA-N	0	3	329.396	3.007	20	30		EGEDHN
CC[C@@H]1CN(C(C)=O)[C@@H](CC)CN1CCCOc1cccc(C#N)c1	ZINC000357319466	457444234	/nfs/dbraw/zinc/44/42/34/457444234.db2.gz	VNLXGBXDUVEQJR-MOPGFXCFSA-N	0	3	343.471	3.048	20	30		EGEDHN
C=CCSCCNC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000357372661	457479598	/nfs/dbraw/zinc/47/95/98/457479598.db2.gz	KOSUDTGPFABREQ-WMZOPIPTSA-N	0	3	347.528	3.115	20	30		EGEDHN
COC[C@@H]1CCCCN([C@@H](C)C(=O)N(C)C2(C#N)CCC(C)CC2)C1	ZINC000342740467	457491345	/nfs/dbraw/zinc/49/13/45/457491345.db2.gz	KSMOERKKMDEZIH-AGYKMIKPSA-N	0	3	349.519	3.054	20	30		EGEDHN
COc1ccc(C#N)cc1CN1CCC[C@@H]1[C@@H]1C[C@H](C)CC[C@H]1O	ZINC000374150410	457498326	/nfs/dbraw/zinc/49/83/26/457498326.db2.gz	FMWVPMLFEGQKJF-ZWQIFLOQSA-N	0	3	328.456	3.328	20	30		EGEDHN
N#Cc1ccc(OCCN2CCC(CCCn3ccnc3)CC2)cc1	ZINC000361063637	457558744	/nfs/dbraw/zinc/55/87/44/457558744.db2.gz	TYUITWASXGELIT-UHFFFAOYSA-N	0	3	338.455	3.326	20	30		EGEDHN
C[C@H](CN1CCCCC1)NC(=O)N(C)[C@H](C)c1cccc(C#N)c1	ZINC000425454637	457560842	/nfs/dbraw/zinc/56/08/42/457560842.db2.gz	BEURQEPVIFWXGN-HZPDHXFCSA-N	0	3	328.460	3.135	20	30		EGEDHN
COC(=O)c1cc(CN(Cc2ccc(C#N)cc2)CC(C)C)cn1C	ZINC000347635692	457565854	/nfs/dbraw/zinc/56/58/54/457565854.db2.gz	KIHPUUVMRSYGJO-UHFFFAOYSA-N	0	3	339.439	3.342	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)c1cccc(CC#N)c1	ZINC000370163989	457570838	/nfs/dbraw/zinc/57/08/38/457570838.db2.gz	VFQUHJFRDXDYCZ-UWJYYQICSA-N	0	3	347.462	3.393	20	30		EGEDHN
CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)N[C@@H]1CC[C@H](C#N)C1	ZINC000425500227	457578188	/nfs/dbraw/zinc/57/81/88/457578188.db2.gz	LJKSDJRAKWPBGL-OTWHNJEPSA-N	0	3	342.487	3.134	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N(C)C[C@@H](O)COc1cccc2[nH]ccc21	ZINC000425541256	457590997	/nfs/dbraw/zinc/59/09/97/457590997.db2.gz	WIMOLLBFAPTQEW-MAUKXSAKSA-N	0	3	349.434	3.472	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN[C@@H](C)c1ccncc1CC	ZINC000361130716	457601179	/nfs/dbraw/zinc/60/11/79/457601179.db2.gz	HATSZDWVKCZAFI-QFBILLFUSA-N	0	3	340.467	3.463	20	30		EGEDHN
N#CC1(c2ccccc2)CC(NCCOCC(F)(F)C(F)F)C1	ZINC000364761582	457689046	/nfs/dbraw/zinc/68/90/46/457689046.db2.gz	VUKGGMCDQFCQHY-UHFFFAOYSA-N	0	3	330.325	3.117	20	30		EGEDHN
CCC[C@@H](C#N)N(C)C(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F	ZINC000410836467	457761539	/nfs/dbraw/zinc/76/15/39/457761539.db2.gz	RTDGXVBRBMNOHG-IRXDYDNUSA-N	0	3	349.425	3.294	20	30		EGEDHN
C=C[C@@H]1CCCCN1C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000426243184	457794399	/nfs/dbraw/zinc/79/43/99/457794399.db2.gz	ZOTBTZMURWRYSG-QXAKKESOSA-N	0	3	327.472	3.257	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CCC[C@H](NCc2ccccc2)C1)OCC	ZINC000371120970	457797132	/nfs/dbraw/zinc/79/71/32/457797132.db2.gz	YUWFYQMKDFCGKW-RBUKOAKNSA-N	0	3	330.472	3.139	20	30		EGEDHN
N#CCCN(C(=O)CN(CC1CC1)CC1CCC1)c1ccccc1	ZINC000361567833	457800413	/nfs/dbraw/zinc/80/04/13/457800413.db2.gz	VYDQMGQCSRXTBD-UHFFFAOYSA-N	0	3	325.456	3.445	20	30		EGEDHN
COc1ccc(CN2CC[C@H](C)C[C@H]2[C@H](C)O)cc1OCCCC#N	ZINC000443783627	457810378	/nfs/dbraw/zinc/81/03/78/457810378.db2.gz	DIDYYXXVQSAYTP-BQFCYCMXSA-N	0	3	346.471	3.359	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N[C@H](CCCO)c1ccccc1	ZINC000433370122	457823187	/nfs/dbraw/zinc/82/31/87/457823187.db2.gz	CQNQSTZVMSJOIW-WOJBJXKFSA-N	0	3	336.435	3.389	20	30		EGEDHN
Cc1cc(CNCCOc2cccc(C(F)(F)F)n2)ccc1C#N	ZINC000443984155	457834732	/nfs/dbraw/zinc/83/47/32/457834732.db2.gz	FDKMIORHXWLVMO-UHFFFAOYSA-N	0	3	335.329	3.449	20	30		EGEDHN
Cc1cc(CN[C@@H](Cc2ccccc2)C(=O)N2CCCC2)ccc1C#N	ZINC000443995170	457836446	/nfs/dbraw/zinc/83/64/46/457836446.db2.gz	UYIUXYPKUIHIKE-NRFANRHFSA-N	0	3	347.462	3.190	20	30		EGEDHN
Cc1cccc(N(CCC#N)C(=O)CN2CC[C@@H]3CCC[C@@H]32)c1C	ZINC000426476728	457837832	/nfs/dbraw/zinc/83/78/32/457837832.db2.gz	VVIJWZXLAKACRX-HKUYNNGSSA-N	0	3	325.456	3.425	20	30		EGEDHN
C[C@H](c1ccccc1)N1CCC(NC(=O)NCC2(CC#N)CC2)CC1	ZINC000366626012	457872857	/nfs/dbraw/zinc/87/28/57/457872857.db2.gz	LFDSMMKRGDVCOV-MRXNPFEDSA-N	0	3	340.471	3.205	20	30		EGEDHN
N#Cc1cccc(C2(NCCC(=O)Nc3cc(F)cc(F)c3)CC2)c1	ZINC000411475417	457897376	/nfs/dbraw/zinc/89/73/76/457897376.db2.gz	ZOULPZHGNZXQJK-UHFFFAOYSA-N	0	3	341.361	3.444	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN[C@@]2(CO)CCCc3ccccc32)cc1	ZINC000366921356	457910985	/nfs/dbraw/zinc/91/09/85/457910985.db2.gz	KNCXDKQLXRUJLM-IIBYNOLFSA-N	0	3	336.435	3.291	20	30		EGEDHN
N#CC1(CCN2CCC(n3ccc([N+](=O)[O-])n3)CC2)CCCCC1	ZINC000411658038	457941990	/nfs/dbraw/zinc/94/19/90/457941990.db2.gz	VTDMCTLPTSDCFM-UHFFFAOYSA-N	0	3	331.420	3.292	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccccc2-n2cccn2)CC1	ZINC000358348586	457950005	/nfs/dbraw/zinc/95/00/05/457950005.db2.gz	UXHAAVUCBZQBKS-UHFFFAOYSA-N	0	3	339.443	3.034	20	30		EGEDHN
CN(C)CCN(Cc1ccsc1)C(=O)CCc1ccc(C#N)cc1	ZINC000458205001	457968879	/nfs/dbraw/zinc/96/88/79/457968879.db2.gz	RCUNNNJEPJORIO-UHFFFAOYSA-N	0	3	341.480	3.143	20	30		EGEDHN
N#CC(CCN1C[C@H]2[C@H](CO)[C@H]2C1)(c1ccccc1)c1ccccc1	ZINC000367797858	457981474	/nfs/dbraw/zinc/98/14/74/457981474.db2.gz	MQGSPLFGHSCVJF-AERCQKQUSA-N	0	3	332.447	3.056	20	30		EGEDHN
C=CCN(Cc1ccccc1)C(=O)NC[C@H]1CCCCN1C1CC1	ZINC000434355823	457981924	/nfs/dbraw/zinc/98/19/24/457981924.db2.gz	QPNKWEPCQDSSHZ-LJQANCHMSA-N	0	3	327.472	3.401	20	30		EGEDHN
C=C(C)[C@H](CC(=O)Nc1ccc(OCCN(C)C)c(F)c1)OCC	ZINC000458282355	457999879	/nfs/dbraw/zinc/99/98/79/457999879.db2.gz	IIELNPSUHIWWGD-KRWDZBQOSA-N	0	3	338.423	3.076	20	30		EGEDHN
C[C@H](NC(C)(C)CNC(=O)N(C)CC(C)(C)C#N)c1ccccc1	ZINC000458372097	458027802	/nfs/dbraw/zinc/02/78/02/458027802.db2.gz	MGZBPUCLGSBQSZ-HNNXBMFYSA-N	0	3	330.476	3.307	20	30		EGEDHN
C[C@@H](CN1CCOCC1)N(C)Cc1ccc(-c2ccccc2C#N)cc1	ZINC000434708536	458039829	/nfs/dbraw/zinc/03/98/29/458039829.db2.gz	CNIQMNFNOACWME-SFHVURJKSA-N	0	3	349.478	3.378	20	30		EGEDHN
CC(C)(C)O[C@@H]1C[C@H](NCC(=O)Nc2ccc(C#N)cc2)C1(C)C	ZINC000412063276	458077060	/nfs/dbraw/zinc/07/70/60/458077060.db2.gz	CSJHTQWXEZSGGN-JKSUJKDBSA-N	0	3	329.444	3.069	20	30		EGEDHN
C[C@@](Cc1ccccc1)(NCC(=O)NC1(C#N)CCC1)c1ccccc1	ZINC000412096529	458088890	/nfs/dbraw/zinc/08/88/90/458088890.db2.gz	NEVQHXRDYLSFQU-NRFANRHFSA-N	0	3	347.462	3.297	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@@H](NCc3cnn4ccccc34)C2)c(F)c1	ZINC000369156744	458105437	/nfs/dbraw/zinc/10/54/37/458105437.db2.gz	PUBGXUBMOWCGJG-QGZVFWFLSA-N	0	3	349.413	3.104	20	30		EGEDHN
N#CC1(CCCN2CC[C@]3(C2)OCc2ccccc23)CCOCC1	ZINC000369195433	458118977	/nfs/dbraw/zinc/11/89/77/458118977.db2.gz	ASKIDVPKIDSIDD-HXUWFJFHSA-N	0	3	326.440	3.218	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Cc1ccc(F)cc1F)C(C)C	ZINC000446114973	458150630	/nfs/dbraw/zinc/15/06/30/458150630.db2.gz	XZZHIXTVMYSQID-GOSISDBHSA-N	0	3	336.426	3.322	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N[C@H](C)c1cccc(O)c1)C(C)C	ZINC000428489729	458157915	/nfs/dbraw/zinc/15/79/15/458157915.db2.gz	WWKGPXRPOXNDRG-APWZRJJASA-N	0	3	345.487	3.451	20	30		EGEDHN
CCCCOC1CCN(CCOc2ccc(C#N)cc2OC)CC1	ZINC000362453047	458187819	/nfs/dbraw/zinc/18/78/19/458187819.db2.gz	NWUHJXUBESUUPP-UHFFFAOYSA-N	0	3	332.444	3.227	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCN(CCOc3cccc(Cl)c3)C2)nc1	ZINC000428786991	458211939	/nfs/dbraw/zinc/21/19/39/458211939.db2.gz	SYOLUOKOGXPMOL-QGZVFWFLSA-N	0	3	343.814	3.139	20	30		EGEDHN
COC1(CO)CCN(Cc2ccc(-c3ccccc3C#N)cc2)CC1	ZINC000447404886	458294435	/nfs/dbraw/zinc/29/44/35/458294435.db2.gz	MCLMXUDLFGQPHP-UHFFFAOYSA-N	0	3	336.435	3.199	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC[C@H](CC)CC(F)(F)F)CC1	ZINC000413232140	458296686	/nfs/dbraw/zinc/29/66/86/458296686.db2.gz	GLAUHNVJHILDGD-CYBMUJFWSA-N	0	3	335.414	3.305	20	30		EGEDHN
C[C@H]1CN(c2cc(C(F)(F)F)cnc2C#N)CCN(C2CCC2)C1	ZINC000413305556	458297389	/nfs/dbraw/zinc/29/73/89/458297389.db2.gz	RYTQOFDSAIFRPV-GFCCVEGCSA-N	0	3	338.377	3.283	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NC(=O)N[C@H]1C[C@@H](C)N(C2CC2)C1	ZINC000413388427	458299204	/nfs/dbraw/zinc/29/92/04/458299204.db2.gz	WZOSTKOQEOFTRN-NXHRZFHOSA-N	0	3	327.472	3.098	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NC(=O)N[C@H]1C[C@H](C)N(C2CC2)C1	ZINC000413388424	458299611	/nfs/dbraw/zinc/29/96/11/458299611.db2.gz	WZOSTKOQEOFTRN-JQHSSLGASA-N	0	3	327.472	3.098	20	30		EGEDHN
COc1ccc2c(c1)OC[C@H](NCc1ccc(O[C@H](C)C#N)cc1)C2	ZINC000372428405	458302689	/nfs/dbraw/zinc/30/26/89/458302689.db2.gz	OGJGJBAVSXMZLX-RHSMWYFYSA-N	0	3	338.407	3.079	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@@]2(C1)CCCN(C)C2	ZINC000413825675	458308395	/nfs/dbraw/zinc/30/83/95/458308395.db2.gz	GSWPYOBDTGVEKF-FPOVZHCZSA-N	0	3	341.499	3.301	20	30		EGEDHN
C=CCN(C)CCN(CC)Cc1coc(-c2ccc(OC)cc2)n1	ZINC000429698987	458359554	/nfs/dbraw/zinc/35/95/54/458359554.db2.gz	DHBVGRWKFSVALY-UHFFFAOYSA-N	0	3	329.444	3.290	20	30		EGEDHN
CC(C)c1ccc([C@H](N)CNC(=O)NCC(C)(C)CCC#N)cc1	ZINC000418212245	458374018	/nfs/dbraw/zinc/37/40/18/458374018.db2.gz	URABVEBNCUGEQU-QGZVFWFLSA-N	0	3	330.476	3.439	20	30		EGEDHN
COC1(C(F)(F)F)CCN(CCCOc2cccc(C#N)c2)CC1	ZINC000419346607	458380778	/nfs/dbraw/zinc/38/07/78/458380778.db2.gz	IQXGEFVVFIFJHX-UHFFFAOYSA-N	0	3	342.361	3.370	20	30		EGEDHN
N#CCCCOc1cccc(CNC[C@@H]2COC3(CCCC3)O2)c1	ZINC000376804519	458392883	/nfs/dbraw/zinc/39/28/83/458392883.db2.gz	NQADNUCLMXDTOL-GOSISDBHSA-N	0	3	330.428	3.144	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N(C)C2CC(C)(C)C2)cc1	ZINC000459522000	458398772	/nfs/dbraw/zinc/39/87/72/458398772.db2.gz	WINHTTVFESOSRH-GFCCVEGCSA-N	0	3	349.456	3.025	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](CC(F)F)c2ccccc2)CC1	ZINC000420918576	458404361	/nfs/dbraw/zinc/40/43/61/458404361.db2.gz	PZUWVJLOIOOZAI-MRXNPFEDSA-N	0	3	337.414	3.333	20	30		EGEDHN
CN(C)CCN(Cc1cccc(F)c1)Cc1ccc(C#N)c(F)c1	ZINC000421350562	458411356	/nfs/dbraw/zinc/41/13/56/458411356.db2.gz	AUKFKCWRCKLOSG-UHFFFAOYSA-N	0	3	329.394	3.400	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cc(C)n(C(C)C)n1)C(C)C	ZINC000448975558	458417606	/nfs/dbraw/zinc/41/76/06/458417606.db2.gz	PQUZSXKCDKWPEP-SFHVURJKSA-N	0	3	332.492	3.201	20	30		EGEDHN
CC(C)(C)O[C@@H]1C[C@H](NCc2ccc(C#N)s2)[C@@H]1n1cccn1	ZINC000449657170	458428533	/nfs/dbraw/zinc/42/85/33/458428533.db2.gz	NWYNTCBXMIFRNG-XHSDSOJGSA-N	0	3	330.457	3.103	20	30		EGEDHN
CC(C)(CCC#N)CNC(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000376986777	458434980	/nfs/dbraw/zinc/43/49/80/458434980.db2.gz	FEIOPHJZISYARI-SFHVURJKSA-N	0	3	342.487	3.138	20	30		EGEDHN
COCCN(Cc1ccc(C#N)cc1)C[C@H](Cc1ccccc1)OC	ZINC000450319734	458444938	/nfs/dbraw/zinc/44/49/38/458444938.db2.gz	ZFLNEPRCTIXYFW-NRFANRHFSA-N	0	3	338.451	3.264	20	30		EGEDHN
CN1CCN(CC2(C)CCN(c3cccc(Cl)c3C#N)CC2)CC1	ZINC000450438613	458448084	/nfs/dbraw/zinc/44/80/84/458448084.db2.gz	KXURLPNBJAEVHU-UHFFFAOYSA-N	0	3	346.906	3.066	20	30		EGEDHN
C[C@@H]1CCC[C@@H](C)N1CCNC(=O)c1cccc(SCC#N)c1	ZINC000430692854	458480873	/nfs/dbraw/zinc/48/08/73/458480873.db2.gz	WRFJERKPDWEXBP-HUUCEWRRSA-N	0	3	331.485	3.295	20	30		EGEDHN
C[C@]12CN([C@H]3CCN(c4sccc4C#N)C3=O)C[C@H]1[C@@H]1CC[C@H]2C1	ZINC000452053076	458494142	/nfs/dbraw/zinc/49/41/42/458494142.db2.gz	NWXIMKKYQQDWCE-NVTBQPJSSA-N	0	3	341.480	3.093	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1C(=O)NC[C@@H]1CCCN(C)[C@@H]1c1cccs1	ZINC000377465391	458501264	/nfs/dbraw/zinc/50/12/64/458501264.db2.gz	QTCMXEXHOSKAOV-CIRFHOKZSA-N	0	3	348.512	3.228	20	30		EGEDHN
CC[C@@H](Cc1ccccc1)N(CC)CC(=O)N(CC)C[C@@H](C)C#N	ZINC000468916599	458544192	/nfs/dbraw/zinc/54/41/92/458544192.db2.gz	JFCRRPSBHXFGIS-HKUYNNGSSA-N	0	3	329.488	3.338	20	30		EGEDHN
CCOc1ccc(C(F)(F)F)cc1NC(=O)[C@H](N)CCCC#N	ZINC000424100376	458557785	/nfs/dbraw/zinc/55/77/85/458557785.db2.gz	KQFDHFJCGDCPIT-LLVKDONJSA-N	0	3	329.322	3.064	20	30		EGEDHN
C[C@H]1c2c(Cl)cc(Cl)cc2CCN1C(=O)[C@@H](N)CCCC#N	ZINC000424153267	458573021	/nfs/dbraw/zinc/57/30/21/458573021.db2.gz	MVTRPBYMNNJAHN-HZMBPMFUSA-N	0	3	340.254	3.460	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)Nc1cc(CN)cc(C(F)(F)F)c1	ZINC000424158450	458573949	/nfs/dbraw/zinc/57/39/49/458573949.db2.gz	OURVKQSZUOWBOM-KGLIPLIRSA-N	0	3	328.334	3.084	20	30		EGEDHN
C[C@@H](CC#N)Sc1ccccc1NC(=O)N1C[C@@H]2CCN(C)[C@@H]2C1	ZINC000454759347	458574197	/nfs/dbraw/zinc/57/41/97/458574197.db2.gz	LKHZDTDAQWNOSI-OFQRWUPVSA-N	0	3	344.484	3.249	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N1CCCC[C@@H]1CCCc1ccccc1	ZINC000424167636	458575164	/nfs/dbraw/zinc/57/51/64/458575164.db2.gz	FEKHTDUUBJQVMX-MOPGFXCFSA-N	0	3	327.472	3.412	20	30		EGEDHN
CC[C@@H](CN(CC)[C@H](C)C(=O)NC1(C#N)CCC1)c1ccccc1	ZINC000469790541	458592136	/nfs/dbraw/zinc/59/21/36/458592136.db2.gz	KKVNUEYKGABZIS-SJORKVTESA-N	0	3	327.472	3.453	20	30		EGEDHN
C=C(C)CCNC(=O)N1CCCN(CCCc2ccccc2)CC1	ZINC000455315437	458592609	/nfs/dbraw/zinc/59/26/09/458592609.db2.gz	UBVBNHAKZYMHLD-UHFFFAOYSA-N	0	3	329.488	3.303	20	30		EGEDHN
C=C(CC)CNC(=O)N1CC[C@]2(CCN(Cc3ccccc3)C2)C1	ZINC000455550851	458603190	/nfs/dbraw/zinc/60/31/90/458603190.db2.gz	ZBTKIDRPHDZGDX-FQEVSTJZSA-N	0	3	327.472	3.260	20	30		EGEDHN
C[C@@H]1C[C@H](N(C)C(=O)C(C)(C)Cc2ccc(C#N)cc2)CCN1C	ZINC000455734131	458610117	/nfs/dbraw/zinc/61/01/17/458610117.db2.gz	GMLHQKVGYSDCSK-CRAIPNDOSA-N	0	3	327.472	3.068	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)Nc1cccc(CC#N)c1	ZINC000455911624	458621729	/nfs/dbraw/zinc/62/17/29/458621729.db2.gz	WJQCXKDUQZVPDI-OXQOHEQNSA-N	0	3	348.450	3.395	20	30		EGEDHN
CC(C)N1CCC[C@@H](NC(=O)C(C)(C)Cc2ccc(C#N)cc2)C1	ZINC000456067142	458630675	/nfs/dbraw/zinc/63/06/75/458630675.db2.gz	MZYCXEKKFQIUNV-GOSISDBHSA-N	0	3	327.472	3.116	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN1CC[C@](C)(CCc2ccccc2)C1	ZINC000470366435	458632519	/nfs/dbraw/zinc/63/25/19/458632519.db2.gz	DYMWECBAERKYGZ-RXVVDRJESA-N	0	3	341.499	3.339	20	30		EGEDHN
CC(C)[C@H](CO)[C@@H](NC(=O)C(C#N)CCc1ccccc1)C(C)C	ZINC000456179226	458634096	/nfs/dbraw/zinc/63/40/96/458634096.db2.gz	NGKDRZYTYJTLHR-QYZOEREBSA-N	0	3	330.472	3.164	20	30		EGEDHN
C=C[C@@H]1CCCCN1C(=O)NC1CCN(CCc2ccccc2)CC1	ZINC000494182194	458637794	/nfs/dbraw/zinc/63/77/94/458637794.db2.gz	IBHGVCHWRVCFQT-HXUWFJFHSA-N	0	3	341.499	3.444	20	30		EGEDHN
C=CCOCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1	ZINC000470725672	458645871	/nfs/dbraw/zinc/64/58/71/458645871.db2.gz	ICYPFTHCZFBSSY-UHFFFAOYSA-N	0	3	328.378	3.420	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCCc2ccc(Cl)s2)cc1	ZINC000470824863	458654386	/nfs/dbraw/zinc/65/43/86/458654386.db2.gz	BEPVFDRWBHBZCQ-AWEZNQCLSA-N	0	3	343.839	3.314	20	30		EGEDHN
C=CCN1CCC(Nc2nnc(-c3cccc(F)c3)cc2C)CC1	ZINC000462827896	458659838	/nfs/dbraw/zinc/65/98/38/458659838.db2.gz	WQTNMUFVPAGILE-UHFFFAOYSA-N	0	3	326.419	3.075	20	30		EGEDHN
C=CCCCCNC(=O)NC[C@@H](c1ccc(OC)cc1)N1CCCC1	ZINC000471444358	458695227	/nfs/dbraw/zinc/69/52/27/458695227.db2.gz	QJLQPSFGRJTWMW-IBGZPJMESA-N	0	3	345.487	3.488	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)N[C@H](C)CN1CCC[C@@H](C)C1	ZINC000463518807	458707814	/nfs/dbraw/zinc/70/78/14/458707814.db2.gz	RPIQHNZUKDKPPE-HZPDHXFCSA-N	0	3	346.471	3.110	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@@H](C)N1CC[C@H](COc2ccccc2)C1	ZINC000505862811	458749494	/nfs/dbraw/zinc/74/94/94/458749494.db2.gz	ONYNWISVUZMAGN-MSOLQXFVSA-N	0	3	330.472	3.200	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCc2cc3ccccc3[nH]2)cc1	ZINC000471968226	458757537	/nfs/dbraw/zinc/75/75/37/458757537.db2.gz	FDTJCEYCJLBTCL-QGZVFWFLSA-N	0	3	328.375	3.038	20	30		EGEDHN
C[C@@H]1[C@H](Cc2ccccc2)CCN1CC(=O)Nc1ccc(C#N)cc1	ZINC000472350414	458789508	/nfs/dbraw/zinc/78/95/08/458789508.db2.gz	UAODGLPSEBJCBQ-APWZRJJASA-N	0	3	333.435	3.450	20	30		EGEDHN
C[C@@H](C(=O)N(C)CCC#N)N1CCC[C@@]2(CCCc3ccccc32)C1	ZINC000440314699	458803248	/nfs/dbraw/zinc/80/32/48/458803248.db2.gz	LAHCFVOLRHTKRS-UWJYYQICSA-N	0	3	339.483	3.117	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN1CCN(C2CCC(C(C)C)CC2)CC1	ZINC000440322229	458804730	/nfs/dbraw/zinc/80/47/30/458804730.db2.gz	DFAYREDJDBXOSC-UHFFFAOYSA-N	0	3	349.563	3.243	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC2(Cc3ccccc3)CCC2)CC1	ZINC000473961665	458852301	/nfs/dbraw/zinc/85/23/01/458852301.db2.gz	WUTQUONHZAFTAN-UHFFFAOYSA-N	0	3	341.499	3.492	20	30		EGEDHN
CC(C)N1CC[C@@H](N(C)C(=O)C(C)(C)Cc2ccc(C#N)cc2)C1	ZINC000457094671	458864249	/nfs/dbraw/zinc/86/42/49/458864249.db2.gz	PCXFABGXJNGKFW-GOSISDBHSA-N	0	3	327.472	3.068	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)COc2ccccc2C(C)C)CC1	ZINC000518496375	458872165	/nfs/dbraw/zinc/87/21/65/458872165.db2.gz	XOKPGTOTERXGQB-UHFFFAOYSA-N	0	3	330.472	3.346	20	30		EGEDHN
CC(C)CN(Cc1ccc(C#N)cc1)C(=O)N[C@@H]1CCN(C)[C@H](C)C1	ZINC000466032515	458872885	/nfs/dbraw/zinc/87/28/85/458872885.db2.gz	ISPFVFCYGOBWHR-VQIMIIECSA-N	0	3	342.487	3.209	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1c[nH]c(C(F)(F)F)c1)C(C)C	ZINC000551095824	458888118	/nfs/dbraw/zinc/88/81/18/458888118.db2.gz	SMPVZUBMVAUFMI-AWEZNQCLSA-N	0	3	343.393	3.462	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1C[C@@H](c2ccccc2)C(C)(C)C1	ZINC000441097061	458888160	/nfs/dbraw/zinc/88/81/60/458888160.db2.gz	YGHWCYXHFSMGMP-AEFFLSMTSA-N	0	3	327.472	3.120	20	30		EGEDHN
Cc1cc(C)cc([C@H](C)NC[C@@H](O)COc2ccc(CC#N)cc2)c1	ZINC000553300619	458894598	/nfs/dbraw/zinc/89/45/98/458894598.db2.gz	UQIKVNOVLFIDBO-FXAWDEMLSA-N	0	3	338.451	3.460	20	30		EGEDHN
N#CCC[C@@H](NC[C@@H](O)COc1ccc(CC#N)cc1)c1ccccc1	ZINC000553385952	458895264	/nfs/dbraw/zinc/89/52/64/458895264.db2.gz	IULOHXCMHJXJDU-TZIWHRDSSA-N	0	3	349.434	3.127	20	30		EGEDHN
C=CC1CCN(C(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)CC1	ZINC000466523324	458904040	/nfs/dbraw/zinc/90/40/40/458904040.db2.gz	VYRDLFDBOHOKBT-VQIMIIECSA-N	0	3	327.472	3.257	20	30		EGEDHN
CCN(CCC#N)C(=O)CN(C)[C@H]1CCC[C@@H]1c1ccc(C)cc1	ZINC000441339770	458922633	/nfs/dbraw/zinc/92/26/33/458922633.db2.gz	IEJLQFIFQJTLIO-MOPGFXCFSA-N	0	3	327.472	3.325	20	30		EGEDHN
COc1cc(CNCC2(CO)CC(c3ccccc3)C2)ccc1C#N	ZINC000441354794	458924580	/nfs/dbraw/zinc/92/45/80/458924580.db2.gz	IRTDPVULGLANMM-UHFFFAOYSA-N	0	3	336.435	3.213	20	30		EGEDHN
CC[C@@H](Cc1ccc(C)cc1)N(CC)CC(=O)N[C@@](C)(C#N)C1CC1	ZINC000441358822	458926777	/nfs/dbraw/zinc/92/67/77/458926777.db2.gz	OQTJONCVWJJMJS-FPOVZHCZSA-N	0	3	341.499	3.447	20	30		EGEDHN
CN(C)C[C@@H](NC(=O)c1ccc(C#N)c(Cl)c1)c1ccc(F)cc1	ZINC000576853212	458935280	/nfs/dbraw/zinc/93/52/80/458935280.db2.gz	OHWUPUXJMMLMTK-QGZVFWFLSA-N	0	3	345.805	3.383	20	30		EGEDHN
C[C@H]1CC[C@H](CNC(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)C1	ZINC000475476057	458944624	/nfs/dbraw/zinc/94/46/24/458944624.db2.gz	DMVDQOFBQFSYKL-LPHOPBHVSA-N	0	3	342.487	3.068	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC(=O)Nc1cc(Cl)ccc1Cl	ZINC000556330461	458949509	/nfs/dbraw/zinc/94/95/09/458949509.db2.gz	DCMNNHWJGDSSHF-OCCSQVGLSA-N	0	3	329.227	3.255	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CCS[C@@H](C(C)C)C1	ZINC000441616047	458964110	/nfs/dbraw/zinc/96/41/10/458964110.db2.gz	VCYPWYWAUGBGJE-IEBWSBKVSA-N	0	3	335.513	3.228	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)NCC(C)(C)CC#N)N(C)C)cc1	ZINC000457470264	458967753	/nfs/dbraw/zinc/96/77/53/458967753.db2.gz	GBVHRMKXZUCLQY-QGZVFWFLSA-N	0	3	330.476	3.091	20	30		EGEDHN
CCc1nnc(NC[C@H](Cc2ccccc2)N(C)C)c(C#N)c1CC	ZINC000467717948	458983356	/nfs/dbraw/zinc/98/33/56/458983356.db2.gz	JGCWHGRGZZXSMS-INIZCTEOSA-N	0	3	337.471	3.058	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cnn(CCC(C)C)c2C)CC1	ZINC000442233439	458998661	/nfs/dbraw/zinc/99/86/61/458998661.db2.gz	ZLJIBSYXTAMTTC-UHFFFAOYSA-N	0	3	333.480	3.010	20	30		EGEDHN
C[C@@H]1OCC[C@]1(O)CN(Cc1ccccc1)Cc1cccc(C#N)c1	ZINC000566882181	459015870	/nfs/dbraw/zinc/01/58/70/459015870.db2.gz	JFONJFZCBNDCRK-UWJYYQICSA-N	0	3	336.435	3.100	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Cn1ccc2ccccc21)C(C)C	ZINC000495982278	459026743	/nfs/dbraw/zinc/02/67/43/459026743.db2.gz	ONJJCSIEEKVGQP-HXUWFJFHSA-N	0	3	339.483	3.456	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)N[C@H](c1ccc(OC)cc1)C1CC1	ZINC000477336375	459041118	/nfs/dbraw/zinc/04/11/18/459041118.db2.gz	HHOAIHSEHUVLTG-KXBFYZLASA-N	0	3	328.456	3.325	20	30		EGEDHN
CN1CCCC(C)(C)[C@H]1CNC(=O)C(C)(C)c1cc(F)cc(C#N)c1	ZINC000557040923	459045152	/nfs/dbraw/zinc/04/51/52/459045152.db2.gz	UWDPBCDZDMJMCB-QGZVFWFLSA-N	0	3	345.462	3.212	20	30		EGEDHN
Cc1cc(CN[C@@H]2CC[C@@H](C#N)C2)ccc1I	ZINC000442854318	459046538	/nfs/dbraw/zinc/04/65/38/459046538.db2.gz	ADLQWNSZZXIKHU-DGCLKSJQSA-N	0	3	340.208	3.382	20	30		EGEDHN
C=C(C)CS(=O)(=O)NC[C@H](CC(C)C)N[C@@H](C)c1ccccc1	ZINC000477600482	459050594	/nfs/dbraw/zinc/05/05/94/459050594.db2.gz	IFYVKKKKRLYAPA-WMZOPIPTSA-N	0	3	338.517	3.247	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccc(C#Cc2ccccc2)cc1)N(C)C1CC1	ZINC000589965743	459058843	/nfs/dbraw/zinc/05/88/43/459058843.db2.gz	OZTDAHHYELLIMH-KRWDZBQOSA-N	0	3	332.447	3.299	20	30		EGEDHN
Cc1ccccc1[C@@H]([C@@H](C)NC(=O)NCC#Cc1ccccc1)N(C)C	ZINC000477831801	459062143	/nfs/dbraw/zinc/06/21/43/459062143.db2.gz	WSWPYOJVETUFTO-WIYYLYMNSA-N	0	3	349.478	3.337	20	30		EGEDHN
CCC(C)(C)N1CCN(c2ncc(Br)cc2C#N)CC1	ZINC000594592187	459102516	/nfs/dbraw/zinc/10/25/16/459102516.db2.gz	QGFDMCCDPYKHAZ-UHFFFAOYSA-N	0	3	337.265	3.026	20	30		EGEDHN
CCCN(CC(=O)Nc1c(C#N)c(C)c(C)n1CCCOC)C(C)C	ZINC000578024205	459133797	/nfs/dbraw/zinc/13/37/97/459133797.db2.gz	QKRNNOIIORXXPU-UHFFFAOYSA-N	0	3	348.491	3.072	20	30		EGEDHN
Cc1cnccc1CCN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000521867708	459186774	/nfs/dbraw/zinc/18/67/74/459186774.db2.gz	OAVWKNWSSSVBLU-UHFFFAOYSA-N	0	3	348.450	3.155	20	30		EGEDHN
N#Cc1ccc(CNCc2ccc(O[C@H]3CCOC3)cc2)cc1F	ZINC000594955457	459192594	/nfs/dbraw/zinc/19/25/94/459192594.db2.gz	KUENRWIUMGDXIO-SFHVURJKSA-N	0	3	326.371	3.155	20	30		EGEDHN
C=CCCSCCN[C@@H](C)c1ccc(S(C)(=O)=O)c(F)c1	ZINC000595059889	459232176	/nfs/dbraw/zinc/23/21/76/459232176.db2.gz	RBNPJCAAICMINW-LBPRGKRZSA-N	0	3	331.478	3.189	20	30		EGEDHN
C[C@H](NC[C@@H](O)COc1ccc(CC#N)cc1)c1ccccc1Cl	ZINC000580456051	459260778	/nfs/dbraw/zinc/26/07/78/459260778.db2.gz	LRKNCYDRFIKYOD-GOEBONIOSA-N	0	3	344.842	3.497	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CC2(CCC2)[C@H]1C1CC1	ZINC000581222581	459270014	/nfs/dbraw/zinc/27/00/14/459270014.db2.gz	ADXLLTGCASPEFO-UYAOXDASSA-N	0	3	327.468	3.419	20	30		EGEDHN
N#Cc1cnn2cc(CNCCc3ccc4ccccc4c3)cnc12	ZINC000559888354	459283087	/nfs/dbraw/zinc/28/30/87/459283087.db2.gz	PLOMEVNYMGAWMH-UHFFFAOYSA-N	0	3	327.391	3.086	20	30		EGEDHN
Cc1cc(C#N)cnc1C(=O)N(c1ccccc1)C1CCN(C)CC1	ZINC000590978862	459287369	/nfs/dbraw/zinc/28/73/69/459287369.db2.gz	UVNRNKFFSPVUBH-UHFFFAOYSA-N	0	3	334.423	3.003	20	30		EGEDHN
CCO[C@@H]1C[C@H](N[C@H](C)C(=O)NC2(C#N)CCCCC2)C1(CC)CC	ZINC000482126561	459292132	/nfs/dbraw/zinc/29/21/32/459292132.db2.gz	MLBUSZOIABTKTB-IXDOHACOSA-N	0	3	349.519	3.291	20	30		EGEDHN
C=C(C)CN1CCC(NCc2cc(C(=O)OC)ccc2Cl)CC1	ZINC000482256244	459299656	/nfs/dbraw/zinc/29/96/56/459299656.db2.gz	MAZNCHCOGKFNKQ-UHFFFAOYSA-N	0	3	336.863	3.257	20	30		EGEDHN
C[C@@H](C(=O)N(CCC#N)c1ccccc1)N1CC[C@H](C2CCC2)C1	ZINC000591061770	459303450	/nfs/dbraw/zinc/30/34/50/459303450.db2.gz	HORQMXKZOAWTBR-WMZOPIPTSA-N	0	3	325.456	3.444	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N2CCC[C@@H](CC#N)C2)C1	ZINC000595467014	459312312	/nfs/dbraw/zinc/31/23/12/459312312.db2.gz	WRYSBFJCUWRVBK-AOIWGVFYSA-N	0	3	340.471	3.157	20	30		EGEDHN
N#Cc1ccncc1N1CCN(CC[C@@H]2CCc3ccccc32)CC1	ZINC000595502923	459328021	/nfs/dbraw/zinc/32/80/21/459328021.db2.gz	XLBYNAPDZFEJEI-SFHVURJKSA-N	0	3	332.451	3.195	20	30		EGEDHN
C[C@@]1(C#N)CCCN(C(=O)Nc2cc(CN)cc(C(F)(F)F)c2)C1	ZINC000591311147	459351648	/nfs/dbraw/zinc/35/16/48/459351648.db2.gz	HRDVQVZRKZMUOX-HNNXBMFYSA-N	0	3	340.349	3.322	20	30		EGEDHN
CC(C)(C)[C@H]1CCCN([C@H]2CCN(c3ccc(C#N)cc3)C2=O)C1	ZINC000483243791	459352213	/nfs/dbraw/zinc/35/22/13/459352213.db2.gz	YKYIXOAEANSJTD-WMZOPIPTSA-N	0	3	325.456	3.422	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N1CCN(C)CC[C@@H]1C)c1ccc(F)c(F)c1	ZINC000483300124	459357709	/nfs/dbraw/zinc/35/77/09/459357709.db2.gz	YVVADLYDZLUBEC-GUYCJALGSA-N	0	3	337.414	3.318	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@@H](N[C@@H]1CCN(C(=O)Nc3ccccc3)C1)CC2	ZINC000582479428	459371152	/nfs/dbraw/zinc/37/11/52/459371152.db2.gz	WNPHQKRLSHDISB-QUCCMNQESA-N	0	3	346.434	3.442	20	30		EGEDHN
C[C@H](NCC(=O)NCC#N)c1ccc(-c2ccc(Cl)cc2)s1	ZINC000582513457	459376911	/nfs/dbraw/zinc/37/69/11/459376911.db2.gz	FSEGAVSTWOXUFJ-NSHDSACASA-N	0	3	333.844	3.359	20	30		EGEDHN
C=CC1CCN(C(=O)N[C@@H]2CCN([C@H](C)c3ccccc3)C2)CC1	ZINC000524640390	459377870	/nfs/dbraw/zinc/37/78/70/459377870.db2.gz	OLQRMVOVUMCRFS-VQIMIIECSA-N	0	3	327.472	3.430	20	30		EGEDHN
C=CC[C@H](CO)CN[C@@H](C)c1ccccc1I	ZINC000540393426	459380271	/nfs/dbraw/zinc/38/02/71/459380271.db2.gz	JANBWICTQLENEQ-RYUDHWBXSA-N	0	3	345.224	3.126	20	30		EGEDHN
C[C@H]1CCN(CCNC(=O)c2cccc(Nc3ccc(C#N)cc3)c2)C1	ZINC000524720271	459382893	/nfs/dbraw/zinc/38/28/93/459382893.db2.gz	GMSJFNJEGDSBRK-INIZCTEOSA-N	0	3	348.450	3.373	20	30		EGEDHN
C[C@@H](NC1CCN(c2ccc(C#N)cn2)CC1)c1ccncc1Cl	ZINC000591531629	459396572	/nfs/dbraw/zinc/39/65/72/459396572.db2.gz	TZULVRRKOMOASG-CYBMUJFWSA-N	0	3	341.846	3.321	20	30		EGEDHN
CCc1cccc(OC[C@@H](O)CNCc2ccc(C#N)c(Cl)c2)c1	ZINC000591765860	459431259	/nfs/dbraw/zinc/43/12/59/459431259.db2.gz	MBLAAKRMIDJBCJ-KRWDZBQOSA-N	0	3	344.842	3.304	20	30		EGEDHN
CN1CCC[C@H](CNC(=O)Nc2ccc(OC(C)(C)C)c(C#N)c2)C1	ZINC000583127610	459487855	/nfs/dbraw/zinc/48/78/55/459487855.db2.gz	SBXHEYVXSYWEDL-CQSZACIVSA-N	0	3	344.459	3.199	20	30		EGEDHN
O[C@H](CNCC#Cc1ccccc1)Cc1ccccc1C(F)(F)F	ZINC000583316955	459519908	/nfs/dbraw/zinc/51/99/08/459519908.db2.gz	FJFORIAYEWSNEV-KRWDZBQOSA-N	0	3	333.353	3.250	20	30		EGEDHN
CN(C)CCN(CCCc1ccccc1)C(=O)c1ccc(C#N)s1	ZINC000486892775	459525275	/nfs/dbraw/zinc/52/52/75/459525275.db2.gz	BHZKBDBOYMLVRE-UHFFFAOYSA-N	0	3	341.480	3.256	20	30		EGEDHN
C[C@H]1C[C@@H](NC2CCC(Oc3ncccc3C#N)CC2)c2nccn21	ZINC000569901454	459527149	/nfs/dbraw/zinc/52/71/49/459527149.db2.gz	SBFBIZYRBNSANR-YJNKEBTESA-N	0	3	337.427	3.135	20	30		EGEDHN
C[C@@H]1C[C@H](NC2CCC(Oc3ncccc3C#N)CC2)c2nccn21	ZINC000569901451	459527402	/nfs/dbraw/zinc/52/74/02/459527402.db2.gz	SBFBIZYRBNSANR-MFNRNEDNSA-N	0	3	337.427	3.135	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N1CCSC[C@H](C)C1)C(C)C	ZINC000487371941	459530318	/nfs/dbraw/zinc/53/03/18/459530318.db2.gz	GCRQFLGVKYHJMB-SJORKVTESA-N	0	3	339.549	3.080	20	30		EGEDHN
COc1ccc([C@@H](CCC#N)N[C@@H]2CCN(CC(F)(F)F)C2)cc1	ZINC000569955695	459537788	/nfs/dbraw/zinc/53/77/88/459537788.db2.gz	GGBKHLAOLVTIMM-GDBMZVCRSA-N	0	3	341.377	3.266	20	30		EGEDHN
C[C@H]1OCC[C@@]1(O)CN(Cc1ccc(C#N)s1)Cc1ccccc1	ZINC000583468228	459542602	/nfs/dbraw/zinc/54/26/02/459542602.db2.gz	METDQSRMTBXEGD-DNVCBOLYSA-N	0	3	342.464	3.162	20	30		EGEDHN
C=C[C@H]1CCCCN1C(=O)c1ccc(N2CCN(C(C)C)CC2)cc1	ZINC000488865280	459553681	/nfs/dbraw/zinc/55/36/81/459553681.db2.gz	DRKLRZQQUDAQDT-IBGZPJMESA-N	0	3	341.499	3.398	20	30		EGEDHN
CCCc1ccc([C@@H](NCC(=O)NC2(C#N)CCC2)C(C)C)cc1	ZINC000526135192	459554588	/nfs/dbraw/zinc/55/45/88/459554588.db2.gz	BEZZCUMBRVGWEU-IBGZPJMESA-N	0	3	327.472	3.488	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@H](C1CC1)N(C)Cc1ccccc1	ZINC000488900337	459556058	/nfs/dbraw/zinc/55/60/58/459556058.db2.gz	RIOYHJOLFKBOMK-HXUWFJFHSA-N	0	3	337.467	3.315	20	30		EGEDHN
C=C[C@@H]1CCCCN1C[C@H](O)COc1ccc(Br)cc1	ZINC000489487466	459565242	/nfs/dbraw/zinc/56/52/42/459565242.db2.gz	VNHNOYWDCWSTRY-CABCVRRESA-N	0	3	340.261	3.229	20	30		EGEDHN
C=C[C@@H]1CCCCN1C[C@H](O)COc1cccc(C(F)(F)F)c1	ZINC000489481105	459566373	/nfs/dbraw/zinc/56/63/73/459566373.db2.gz	OGTOUUCRILPWOA-CABCVRRESA-N	0	3	329.362	3.486	20	30		EGEDHN
CN(C)CCOc1cccc(NC(=O)c2ccc(Cl)c(C#N)c2)c1	ZINC000542536919	459569016	/nfs/dbraw/zinc/56/90/16/459569016.db2.gz	CFYKSOHHLADWDY-UHFFFAOYSA-N	0	3	343.814	3.404	20	30		EGEDHN
CC(C)(CO)[C@H](NCC#Cc1ccc(OC(F)(F)F)cc1)C1CC1	ZINC000571533683	459569367	/nfs/dbraw/zinc/56/93/67/459569367.db2.gz	AUMWRENPQYZFJO-MRXNPFEDSA-N	0	3	341.373	3.323	20	30		EGEDHN
C[C@H]1[C@@H](Nc2nc(C#N)c(Cl)s2)CCN1Cc1ccccc1	ZINC000596236478	459570418	/nfs/dbraw/zinc/57/04/18/459570418.db2.gz	XKDJPUQIBPKOFN-AAEUAGOBSA-N	0	3	332.860	3.165	20	30		EGEDHN
C=CCC(C)(C)CNC(=O)CCCN1CCN(c2ccccc2)CC1	ZINC000489824032	459571683	/nfs/dbraw/zinc/57/16/83/459571683.db2.gz	BZEYXHIRKQXPFM-UHFFFAOYSA-N	0	3	343.515	3.307	20	30		EGEDHN
Cc1ccc(Cl)c(OC[C@H](O)CN2CCC(CCC#N)CC2)c1	ZINC000572117920	459577318	/nfs/dbraw/zinc/57/73/18/459577318.db2.gz	GDPBKSJDPLUBBY-MRXNPFEDSA-N	0	3	336.863	3.404	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H](C)c2cc3cccc(F)c3o2)CC1	ZINC000490741487	459586007	/nfs/dbraw/zinc/58/60/07/459586007.db2.gz	SBEYPNATWMWHCP-ZDUSSCGKSA-N	0	3	328.387	3.094	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c(C)c1)C(C)C	ZINC000498378597	459587807	/nfs/dbraw/zinc/58/78/07/459587807.db2.gz	WAHLYLTWXHMKLP-SFHVURJKSA-N	0	3	345.443	3.332	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cc(Cc3ccccn3)ccc2C)CC1	ZINC000491102564	459598111	/nfs/dbraw/zinc/59/81/11/459598111.db2.gz	MWSSWZZIKAMULB-UHFFFAOYSA-N	0	3	347.462	3.265	20	30		EGEDHN
Cc1nc(N2CCC[C@H](CC#N)C2)cc(N2CCC[C@@H](CC#N)C2)n1	ZINC000596330243	459598505	/nfs/dbraw/zinc/59/85/05/459598505.db2.gz	RQGOKSQTQVBIKA-CALCHBBNSA-N	0	3	338.459	3.045	20	30		EGEDHN
C#CCNC(=O)CCN[C@@H](C)c1sc(-c2ccc(F)cc2)nc1C	ZINC000491167144	459601890	/nfs/dbraw/zinc/60/18/90/459601890.db2.gz	WMLFWQZPZZEGIM-LBPRGKRZSA-N	0	3	345.443	3.048	20	30		EGEDHN
C#CCN(C(=O)Nc1ccc(OCCN2CCCCC2)cc1)C1CC1	ZINC000491255127	459610558	/nfs/dbraw/zinc/61/05/58/459610558.db2.gz	WANHGZNGCPOCKZ-UHFFFAOYSA-N	0	3	341.455	3.181	20	30		EGEDHN
CC[C@@H]1CN([C@H](C)C(=O)NC2(C#N)CCC2)CC[C@@H]1c1ccccc1	ZINC000527298024	459625141	/nfs/dbraw/zinc/62/51/41/459625141.db2.gz	LDSHHSMQXDRBFE-LMMKCTJWSA-N	0	3	339.483	3.453	20	30		EGEDHN
C[C@H](N[C@@H](c1ccc(F)cc1)C1CCC1)C(=O)NC1(C#N)CCC1	ZINC000583976895	459627297	/nfs/dbraw/zinc/62/72/97/459627297.db2.gz	SCMYAPUEDHIKEP-SUMWQHHRSA-N	0	3	329.419	3.207	20	30		EGEDHN
CC#CCCNCc1cc(Br)ccc1OCCOCC	ZINC000499218388	459627716	/nfs/dbraw/zinc/62/77/16/459627716.db2.gz	XXLQMVWJQKDKFP-UHFFFAOYSA-N	0	3	340.261	3.367	20	30		EGEDHN
CC(C)COc1ccc(C(C)(C)NCC(=O)NC2(C#N)CCC2)cc1	ZINC000527384793	459639775	/nfs/dbraw/zinc/63/97/75/459639775.db2.gz	ZYJROPFDMHLEIH-UHFFFAOYSA-N	0	3	343.471	3.109	20	30		EGEDHN
Cc1ccc(C[C@H]2CCCN2CC(=O)NCc2ccc(C#N)cc2)cc1	ZINC000500208719	459671417	/nfs/dbraw/zinc/67/14/17/459671417.db2.gz	FIWQFHVKRJWPAT-OAQYLSRUSA-N	0	3	347.462	3.190	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)N1CCC(CC#N)CC1)c1ccccc1	ZINC000543776992	459700405	/nfs/dbraw/zinc/70/04/05/459700405.db2.gz	IBAFXUSVVDLZNE-LJQANCHMSA-N	0	3	342.487	3.405	20	30		EGEDHN
COc1ccc(C#N)cc1NC(=O)C(C[C@@H]1CCCO1)C(F)(F)F	ZINC000593047254	459753255	/nfs/dbraw/zinc/75/32/55/459753255.db2.gz	XHGMLJNNVHBYMV-RYUDHWBXSA-N	0	3	342.317	3.253	20	30		EGEDHN
CSc1ccc([C@@H](CNC(=O)C2(C#N)CC(C)C2)N(C)C)cc1	ZINC000563475506	459765915	/nfs/dbraw/zinc/76/59/15/459765915.db2.gz	TXTDSAIDQXPCNS-CRPOECCBSA-N	0	3	331.485	3.067	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)C1CCC2(CC2)CC1	ZINC000596829669	459773272	/nfs/dbraw/zinc/77/32/72/459773272.db2.gz	WQFQTFQWFSWLTO-UHFFFAOYSA-N	0	3	339.483	3.419	20	30		EGEDHN
CC(C)Oc1ccc([C@@H](CNC[C@@H](C#N)CCC#N)N(C)C)cc1	ZINC000564868901	459778110	/nfs/dbraw/zinc/77/81/10/459778110.db2.gz	KGKASTXYBYBPTR-VQIMIIECSA-N	0	3	328.460	3.110	20	30		EGEDHN
CC(C)O[C@@H]1CCN(Cc2cn(CCC#N)nc2-c2ccccc2)C1	ZINC000564984858	459779553	/nfs/dbraw/zinc/77/95/53/459779553.db2.gz	BYWQCFXYEZLXCH-LJQANCHMSA-N	0	3	338.455	3.463	20	30		EGEDHN
N#CCc1ccc(OC[C@@H](O)CN[C@@H]2CCCc3ccccc32)cc1	ZINC000574107059	459779542	/nfs/dbraw/zinc/77/95/42/459779542.db2.gz	RPORWSHKAVHJRC-GHTZIAJQSA-N	0	3	336.435	3.160	20	30		EGEDHN
CN(C)CCOc1ccc(-c2noc(Cc3ccc(C#N)cc3)n2)cc1	ZINC000544971048	459794459	/nfs/dbraw/zinc/79/44/59/459794459.db2.gz	IRZSDYNITBVHSF-UHFFFAOYSA-N	0	3	348.406	3.139	20	30		EGEDHN
N#Cc1ccc2c(c1)CCN2C(=O)C(C[C@@H]1CCCO1)C(F)(F)F	ZINC000593174244	459796823	/nfs/dbraw/zinc/79/68/23/459796823.db2.gz	UGYJXVYGLYULQJ-UONOGXRCSA-N	0	3	338.329	3.195	20	30		EGEDHN
CN(CCC#N)C[C@H](O)CN[C@H](CC(C)(C)C)c1ccc(F)cc1	ZINC000566106283	459806414	/nfs/dbraw/zinc/80/64/14/459806414.db2.gz	LYKIPTWCQBDICS-QZTJIDSGSA-N	0	3	335.467	3.099	20	30		EGEDHN
COc1ccc(C#N)cc1NC(=O)NC[C@H]1CCN1C1CCCCC1	ZINC000528950211	459819003	/nfs/dbraw/zinc/81/90/03/459819003.db2.gz	ALYBDOJJICBMRI-MRXNPFEDSA-N	0	3	342.443	3.095	20	30		EGEDHN
Cc1cc(C#N)cc(NC(=O)NC[C@H]2CCN2C2CCCCC2)c1	ZINC000529118281	459823437	/nfs/dbraw/zinc/82/34/37/459823437.db2.gz	ZCKKVNROSJRSDU-GOSISDBHSA-N	0	3	326.444	3.395	20	30		EGEDHN
CN1CCC(N(C(=O)c2ccc(F)c(C#N)c2)c2ccccc2)CC1	ZINC000585739559	459838814	/nfs/dbraw/zinc/83/88/14/459838814.db2.gz	SGOBKCNLHZTTTL-UHFFFAOYSA-N	0	3	337.398	3.438	20	30		EGEDHN
CC(C)c1ccc(O[C@@H](C)CNCc2cnc3c(C#N)cnn3c2)cc1	ZINC000574813024	459875779	/nfs/dbraw/zinc/87/57/79/459875779.db2.gz	MWLQDMVWFZZVPY-HNNXBMFYSA-N	0	3	349.438	3.281	20	30		EGEDHN
Cc1cc(F)ccc1N(CC#N)C(=O)C1Oc2ccccc2O[C@@H]1C	ZINC000602393718	459913535	/nfs/dbraw/zinc/91/35/35/459913535.db2.gz	HKYZIJMNICDNIH-FZKQIMNGSA-N	0	3	340.354	3.219	20	30		EGEDHN
C[C@H]1CCCCN1CCOc1ccccc1C(=O)NCCCCC#N	ZINC000609202454	459924853	/nfs/dbraw/zinc/92/48/53/459924853.db2.gz	JPNGITPZVFPCGX-KRWDZBQOSA-N	0	3	343.471	3.363	20	30		EGEDHN
C[C@H](CCC#N)CN1CCN(CCOc2ccccc2Cl)CC1	ZINC000602436783	459937397	/nfs/dbraw/zinc/93/73/97/459937397.db2.gz	ZYMJZVUJTXPXHS-MRXNPFEDSA-N	0	3	335.879	3.276	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)N1CCN[C@H](C(C)C)C1	ZINC000598575617	459946434	/nfs/dbraw/zinc/94/64/34/459946434.db2.gz	VEWVHXGYBWDXBI-HNNXBMFYSA-N	0	3	327.453	3.151	20	30		EGEDHN
CCCN(CCN1CCCC1)C(=O)N[C@H](C)c1cccc(C#N)c1	ZINC000588375659	459953542	/nfs/dbraw/zinc/95/35/42/459953542.db2.gz	QXNBPZVHNMANIV-MRXNPFEDSA-N	0	3	328.460	3.137	20	30		EGEDHN
COc1ccc([C@@H]2CCCN2C[C@H](O)CC(C)(C)C#N)cc1OC	ZINC000598584574	459953538	/nfs/dbraw/zinc/95/35/38/459953538.db2.gz	OEWKHLUOHCWAQO-CVEARBPZSA-N	0	3	332.444	3.141	20	30		EGEDHN
N#Cc1ccccc1-c1ccccc1C(=O)N[C@@H]1CCN(CC2CC2)C1	ZINC000609383263	459955985	/nfs/dbraw/zinc/95/59/85/459955985.db2.gz	KPZJPDDQEHXMRR-GOSISDBHSA-N	0	3	345.446	3.439	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN1CCC[C@H](c2nc3ccccc3o2)C1	ZINC000598594922	459958023	/nfs/dbraw/zinc/95/80/23/459958023.db2.gz	ODOHDYPUCIKODW-GJZGRUSLSA-N	0	3	327.428	3.308	20	30		EGEDHN
C[C@H](NC1CCN(Cc2cccc(C#N)c2)CC1)c1cncs1	ZINC000593719336	459962077	/nfs/dbraw/zinc/96/20/77/459962077.db2.gz	CANNGRCEAJSGEG-AWEZNQCLSA-N	0	3	326.469	3.330	20	30		EGEDHN
C[C@@H]1[C@H](C)N(Cc2ccccc2)[C@@H](C)CN1C[C@H](O)CC(C)(C)C#N	ZINC000598622321	459966700	/nfs/dbraw/zinc/96/67/00/459966700.db2.gz	HUFDBKABOLKLKH-HLNWXESRSA-N	0	3	343.515	3.270	20	30		EGEDHN
C[C@@H]1CN(C[C@@H](O)CC(C)(C)C#N)[C@H](C)[C@H](C)N1Cc1ccccc1	ZINC000598622322	459966939	/nfs/dbraw/zinc/96/69/39/459966939.db2.gz	HUFDBKABOLKLKH-XSYGEPLQSA-N	0	3	343.515	3.270	20	30		EGEDHN
CCc1csc(CC2CCN(C[C@@H](O)CC(C)(C)C#N)CC2)n1	ZINC000598624080	459967534	/nfs/dbraw/zinc/96/75/34/459967534.db2.gz	WSLXOFXGIFIBON-INIZCTEOSA-N	0	3	335.517	3.261	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN1CCC2(CCc3ccccc3O2)CC1	ZINC000598628746	459969005	/nfs/dbraw/zinc/96/90/05/459969005.db2.gz	QOHYXBQFGCGJRH-KRWDZBQOSA-N	0	3	328.456	3.147	20	30		EGEDHN
C[C@H](NC(=O)N1CCC[C@@](C)(C#N)C1)[C@@H](c1ccccc1)N(C)C	ZINC000588721187	459973807	/nfs/dbraw/zinc/97/38/07/459973807.db2.gz	XXJRRPSLRIYVEP-IEZWGBDMSA-N	0	3	328.460	3.013	20	30		EGEDHN
CC(C)CN(Cc1ccc(F)c(Cl)c1)C(=O)[C@H](N)CCCC#N	ZINC000602535712	459987179	/nfs/dbraw/zinc/98/71/79/459987179.db2.gz	YAWYEKKSUQRGLF-MRXNPFEDSA-N	0	3	339.842	3.485	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CNCc1ccccc1OCC(F)(F)F	ZINC000598700557	459998056	/nfs/dbraw/zinc/99/80/56/459998056.db2.gz	OQUNHSBWEXHQBY-ZDUSSCGKSA-N	0	3	330.350	3.018	20	30		EGEDHN
C[C@H](CCC#N)CN[C@@H](c1ccc(Cl)cc1)[C@H]1CN(C)CCO1	ZINC000602579273	460005901	/nfs/dbraw/zinc/00/59/01/460005901.db2.gz	ISRPLZIFESTRGW-OLMNPRSZSA-N	0	3	335.879	3.241	20	30		EGEDHN
CN(CCN1CCCCC1)C(=O)CCCCOc1cccc(C#N)c1	ZINC000593882738	460008485	/nfs/dbraw/zinc/00/84/85/460008485.db2.gz	ILGNWTGMDZHXML-UHFFFAOYSA-N	0	3	343.471	3.052	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)C(=O)N(CCN(C)C)Cc1ccccc1	ZINC000593955659	460026343	/nfs/dbraw/zinc/02/63/43/460026343.db2.gz	UNVLYIBNMOIHCK-SFHVURJKSA-N	0	3	349.478	3.327	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)C(=O)NC[C@@H](C)N1CCCC[C@H]1C	ZINC000593963468	460029417	/nfs/dbraw/zinc/02/94/17/460029417.db2.gz	NNUYBVGOPSBSBZ-BRWVUGGUSA-N	0	3	327.472	3.116	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)cn2)[C@H](C)[C@@H](C)N1Cc1ccccc1	ZINC000594015140	460057062	/nfs/dbraw/zinc/05/70/62/460057062.db2.gz	GQJHGZVEQPZNEC-KZNAEPCWSA-N	0	3	334.467	3.437	20	30		EGEDHN
N#C[C@@H]1CCC[C@H](N[C@@H](Cc2ccccc2)[C@@H](O)C(F)(F)F)C1	ZINC000618573806	460068998	/nfs/dbraw/zinc/06/89/98/460068998.db2.gz	QKYFKGTXMXHHEJ-FXUDXRNXSA-N	0	3	326.362	3.193	20	30		EGEDHN
N#Cc1ccc(NC(=O)N[C@H]2CCCN3CCCC[C@H]23)cc1Cl	ZINC000594058754	460079828	/nfs/dbraw/zinc/07/98/28/460079828.db2.gz	QTBZWLHUKVVIAM-JKSUJKDBSA-N	0	3	332.835	3.350	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2c(F)ccc(F)c2Cl)CC1	ZINC000621859085	460087574	/nfs/dbraw/zinc/08/75/74/460087574.db2.gz	SWPCKHIISZRMRZ-UHFFFAOYSA-N	0	3	328.790	3.389	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@H](C)[C@H](CO)SC)cc1OC	ZINC000598963220	460105257	/nfs/dbraw/zinc/10/52/57/460105257.db2.gz	AWEYSGVFPOBVBU-ABAIWWIYSA-N	0	3	345.892	3.115	20	30		EGEDHN
Cc1ccc2c(c1)CN(C(=O)C(C#N)Cc1ccc(C#N)cc1)CC2	ZINC000597965017	460127824	/nfs/dbraw/zinc/12/78/24/460127824.db2.gz	IPVSYDWTHJRTBW-IBGZPJMESA-N	0	3	329.403	3.134	20	30		EGEDHN
C[C@H](NC(=O)NCCN(C)Cc1ccccc1)c1cccc(C#N)c1	ZINC000610348980	460129709	/nfs/dbraw/zinc/12/97/09/460129709.db2.gz	LBAZEZKOWGTZAV-INIZCTEOSA-N	0	3	336.439	3.050	20	30		EGEDHN
CN1CCC(C(=O)Nc2ccc(Oc3ccc(C#N)cc3)nc2)CC1	ZINC000610422628	460148009	/nfs/dbraw/zinc/14/80/09/460148009.db2.gz	YTDIYTIBXCXWPV-UHFFFAOYSA-N	0	3	336.395	3.026	20	30		EGEDHN
N#CCC[C@H](NC(=O)N[C@H]1CCCN2CCCC[C@H]12)c1ccccc1	ZINC000594228766	460161185	/nfs/dbraw/zinc/16/11/85/460161185.db2.gz	DLOHKPYUZQWOAW-GBESFXJTSA-N	0	3	340.471	3.348	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN[C@H]([C@H]1CCCO1)C1(CO)CCC1	ZINC000602890279	460173585	/nfs/dbraw/zinc/17/35/85/460173585.db2.gz	GCHCCAPXGPDHSH-RTBURBONSA-N	0	3	342.483	3.288	20	30		EGEDHN
CN(C)[C@@H](CNC(=O)N[C@@H]1CCc2cc(C#N)ccc21)c1ccccc1	ZINC000618795255	460178124	/nfs/dbraw/zinc/17/81/24/460178124.db2.gz	LRVUBWRMIXSTTR-UXHICEINSA-N	0	3	348.450	3.148	20	30		EGEDHN
C[C@@H](c1ccc(C#N)cc1)N(C)CCCN1C(=O)c2ccccc2C1=O	ZINC000576608932	460179508	/nfs/dbraw/zinc/17/95/08/460179508.db2.gz	JKNXEYBKHSCCPK-HNNXBMFYSA-N	0	3	347.418	3.237	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)C(=O)N[C@H]1CCCN2CCCC[C@H]12	ZINC000594282881	460179762	/nfs/dbraw/zinc/17/97/62/460179762.db2.gz	AXENVRSOSUEPCM-AYOQOUSVSA-N	0	3	340.471	3.278	20	30		EGEDHN
CCc1nnc(N2CC[C@H](N(C)Cc3ccccc3)C2)c(C#N)c1CC	ZINC000610717230	460223911	/nfs/dbraw/zinc/22/39/11/460223911.db2.gz	STDSNUSFVFDXKC-KRWDZBQOSA-N	0	3	349.482	3.184	20	30		EGEDHN
CC[C@@H](CN1CCCC1)NC(=O)N(Cc1ccc(C#N)cc1)C(C)C	ZINC000610721309	460225560	/nfs/dbraw/zinc/22/55/60/460225560.db2.gz	PWVZBMLQRQETAL-IBGZPJMESA-N	0	3	342.487	3.353	20	30		EGEDHN
C[C@@H](NC1CCN(CC#N)CC1)c1ccc(F)cc1Br	ZINC000610812663	460241197	/nfs/dbraw/zinc/24/11/97/460241197.db2.gz	HFODALNPRDZIPR-LLVKDONJSA-N	0	3	340.240	3.227	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@H](C)CN2CCC(C)CC2)cc1OC	ZINC000618991996	460245699	/nfs/dbraw/zinc/24/56/99/460245699.db2.gz	ISVFTCACRCWYCJ-MRXNPFEDSA-N	0	3	346.471	3.110	20	30		EGEDHN
CSc1ccc([C@H](C)NC[C@@H](O)COc2ccccc2C#N)cc1	ZINC000599397575	460246665	/nfs/dbraw/zinc/24/66/65/460246665.db2.gz	RCTJEQCDBMPNCO-WMLDXEAASA-N	0	3	342.464	3.371	20	30		EGEDHN
CSc1ccc([C@@H](C)NC[C@@H](O)COc2ccccc2C#N)cc1	ZINC000599397574	460247189	/nfs/dbraw/zinc/24/71/89/460247189.db2.gz	RCTJEQCDBMPNCO-RHSMWYFYSA-N	0	3	342.464	3.371	20	30		EGEDHN
Cc1ccccc1[C@@H]([C@@H](C)NC(=O)Nc1ccnc(C#N)c1)N(C)C	ZINC000603125816	460248207	/nfs/dbraw/zinc/24/82/07/460248207.db2.gz	LWOBGWVIHKKARU-RDTXWAMCSA-N	0	3	337.427	3.075	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)Nc1ccnc(C#N)c1	ZINC000603130524	460249975	/nfs/dbraw/zinc/24/99/75/460249975.db2.gz	QNSWFJOSRIALLQ-INIZCTEOSA-N	0	3	349.438	3.082	20	30		EGEDHN
Cc1ccc2c(c1)[C@H](NC(=O)C(C#N)Cc1ccc(C#N)cc1)CC2	ZINC000619285413	460321244	/nfs/dbraw/zinc/32/12/44/460321244.db2.gz	SZVCLMSXTTYJBZ-AZUAARDMSA-N	0	3	329.403	3.353	20	30		EGEDHN
C[C@H](NC[C@H](O)COc1cccc2[nH]ccc21)c1cccc(C#N)c1	ZINC000611388491	460351131	/nfs/dbraw/zinc/35/11/31/460351131.db2.gz	PFOWVNJZMNZGMN-YOEHRIQHSA-N	0	3	335.407	3.130	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2NCc1cccc(-n2cncn2)c1	ZINC000611393664	460353518	/nfs/dbraw/zinc/35/35/18/460353518.db2.gz	ZIHORQCIFJKRDX-FQEVSTJZSA-N	0	3	329.407	3.306	20	30		EGEDHN
CC(C)[C@H](N[C@H]1CCCc2cc(C#N)ccc21)C(=O)N1CCCC1	ZINC000611394957	460354797	/nfs/dbraw/zinc/35/47/97/460354797.db2.gz	XSOGAKRVNKFWHM-OALUTQOASA-N	0	3	325.456	3.172	20	30		EGEDHN
CC(C)(NC[C@@H](O)COc1ccc(CC#N)cc1)c1cccc(F)c1	ZINC000611396318	460355213	/nfs/dbraw/zinc/35/52/13/460355213.db2.gz	RXOIPDYJSCKIHY-GOSISDBHSA-N	0	3	342.414	3.156	20	30		EGEDHN
C[C@@H](N[C@@H]1CCN(C(=O)C2CCCC2)C1)c1ccc(C#N)c(F)c1	ZINC000611466026	460370530	/nfs/dbraw/zinc/37/05/30/460370530.db2.gz	OHUCDOKMFAWAHH-CXAGYDPISA-N	0	3	329.419	3.139	20	30		EGEDHN
CC(C)C[C@@](C)(C#N)NC(=O)C1CCN(Cc2ccccc2)CC1	ZINC000604545210	460443590	/nfs/dbraw/zinc/44/35/90/460443590.db2.gz	HOEHOVPPLWAFGJ-FQEVSTJZSA-N	0	3	327.472	3.343	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN(C)CCc1ccccc1	ZINC000613372091	460925643	/nfs/dbraw/zinc/92/56/43/460925643.db2.gz	IOSACQSCWPMMIF-FQEVSTJZSA-N	0	3	325.452	3.329	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN(Cc1ccccn1)C(C)C	ZINC000613378622	460928470	/nfs/dbraw/zinc/92/84/70/460928470.db2.gz	HGSKCSVFFSAGLQ-HXUWFJFHSA-N	0	3	340.467	3.460	20	30		EGEDHN
N#C[C@H]1CC[C@@H](NC[C@@H](O)COc2cc(Cl)cc(Cl)c2)C1	ZINC000601962808	460963726	/nfs/dbraw/zinc/96/37/26/460963726.db2.gz	AZALFSHDMSMGTA-ZLKJLUDKSA-N	0	3	329.227	3.015	20	30		EGEDHN
C=CCCOCC(=O)N(c1cccc(SC)c1)C1CCN(C)CC1	ZINC000601981870	460969842	/nfs/dbraw/zinc/96/98/42/460969842.db2.gz	MSGPTGMNJPGVGT-UHFFFAOYSA-N	0	3	348.512	3.428	20	30		EGEDHN
C[C@H](CNC(=O)c1ccc(C#Cc2ccccc2)cc1)N1CCCC1	ZINC000613625186	461018426	/nfs/dbraw/zinc/01/84/26/461018426.db2.gz	UPTCREGWLIGOTF-GOSISDBHSA-N	0	3	332.447	3.301	20	30		EGEDHN
CN1CCN(CCC(C)(C)Nc2nc(C(C)(C)C)ccc2C#N)CC1	ZINC000613705190	461038917	/nfs/dbraw/zinc/03/89/17/461038917.db2.gz	MVLVCSDJOCPKPT-UHFFFAOYSA-N	0	3	343.519	3.079	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CC[C@@H]2c2cccc(F)c2)CC1	ZINC000608426155	461059690	/nfs/dbraw/zinc/05/96/90/461059690.db2.gz	FPRYZLUDLLZKDB-GOSISDBHSA-N	0	3	331.435	3.323	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cccc(-c3cnco3)c2)CC1	ZINC000668369717	461259147	/nfs/dbraw/zinc/25/91/47/461259147.db2.gz	CHPDXXBWNCAHEJ-UHFFFAOYSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(OC)nc3ccccc32)CC1	ZINC000668369967	461259346	/nfs/dbraw/zinc/25/93/46/461259346.db2.gz	JVPGTRHOINZFCT-UHFFFAOYSA-N	0	3	339.439	3.014	20	30		EGEDHN
C=C1CC(C)(C(=O)Nc2ccc(CN3CCN(CC)CC3)cc2)C1	ZINC000630731933	461272636	/nfs/dbraw/zinc/27/26/36/461272636.db2.gz	CZZCJBKXTVCDCZ-UHFFFAOYSA-N	0	3	327.472	3.119	20	30		EGEDHN
C=CCN(C(=O)NC[C@@H](N)c1ccc(C(C)C)cc1)[C@H](C)COC	ZINC000659510897	461369658	/nfs/dbraw/zinc/36/96/58/461369658.db2.gz	CMHXRLWGMPIOPH-CRAIPNDOSA-N	0	3	333.476	3.042	20	30		EGEDHN
N#CC(C(=O)c1cccc2ccncc21)c1nnc2n1CCCCC2	ZINC000647195396	461556705	/nfs/dbraw/zinc/55/67/05/461556705.db2.gz	OJOQEMGBEVVTSH-OAHLLOKOSA-N	0	3	331.379	3.043	20	30		EGEDHN
C=CCc1ccc(OC[C@@H](O)CN2C[C@@H]3CCCC[C@@H]32)c(OC)c1	ZINC000656699168	461847466	/nfs/dbraw/zinc/84/74/66/461847466.db2.gz	BBNXYBBKPBYBGL-BZSNNMDCSA-N	0	3	331.456	3.038	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCC[C@@H]([C@H]3CCCCO3)C2)CC1	ZINC000660597452	461871219	/nfs/dbraw/zinc/87/12/19/461871219.db2.gz	PKNQLVOKTVGGGY-IEBWSBKVSA-N	0	3	349.519	3.018	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCc2cc(Cl)cc(Cl)c2)CC1	ZINC000660707718	461931021	/nfs/dbraw/zinc/93/10/21/461931021.db2.gz	RIXJYEDMKAOOGK-UHFFFAOYSA-N	0	3	342.270	3.443	20	30		EGEDHN
C=CCCn1cc(CNCC2(c3ccccc3OC)CCCC2)nn1	ZINC000657325640	462048573	/nfs/dbraw/zinc/04/85/73/462048573.db2.gz	OLXURXLLMFCMGC-UHFFFAOYSA-N	0	3	340.471	3.464	20	30		EGEDHN
C=CCCn1cc(CNCC2(c3ccc(OC)cc3)CCC2)nn1	ZINC000657432405	462120030	/nfs/dbraw/zinc/12/00/30/462120030.db2.gz	GIWVRSGIHQRLIW-UHFFFAOYSA-N	0	3	326.444	3.074	20	30		EGEDHN
C=CCN(C[C@H](O)COc1cccc2ccccc21)[C@H](C)COC	ZINC000661248172	462170350	/nfs/dbraw/zinc/17/03/50/462170350.db2.gz	SVZZDSYKKPJAIC-AEFFLSMTSA-N	0	3	329.440	3.102	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N(C(C)C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000648564703	462179606	/nfs/dbraw/zinc/17/96/06/462179606.db2.gz	IHEZPADIXJNBSV-AQNXPRMDSA-N	0	3	342.483	3.089	20	30		EGEDHN
C=CC[C@@H]1CCCN(CC(=O)N2CCO[C@H](c3ccc(F)cc3)C2)C1	ZINC000661381277	462225426	/nfs/dbraw/zinc/22/54/26/462225426.db2.gz	ZBQBQXAFWXHUOT-APWZRJJASA-N	0	3	346.446	3.014	20	30		EGEDHN
C=CC[C@H]1CCCN(CC(=O)NCCc2cccc3cccnc32)C1	ZINC000661379856	462225618	/nfs/dbraw/zinc/22/56/18/462225618.db2.gz	BLVHHIPAXSBGRM-KRWDZBQOSA-N	0	3	337.467	3.182	20	30		EGEDHN
C=CC[C@@H]1CCCN([C@H]2CCN(Cc3ccc(OC)cc3)C2=O)C1	ZINC000661384671	462225825	/nfs/dbraw/zinc/22/58/25/462225825.db2.gz	KGPAVJAHGGTSFE-APWZRJJASA-N	0	3	328.456	3.084	20	30		EGEDHN
C=CC[C@H]1CCCC[C@H]1NCc1ccccc1S(=O)(=O)N(C)C	ZINC000657830393	462288563	/nfs/dbraw/zinc/28/85/63/462288563.db2.gz	IESFQHPRFQYHIW-DOTOQJQBSA-N	0	3	336.501	3.161	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)N[C@H]1CCCN2CCCC[C@H]12	ZINC000654726623	462355114	/nfs/dbraw/zinc/35/51/14/462355114.db2.gz	XFWWNZYXWVMLIM-DLBZAZTESA-N	0	3	333.501	3.463	20	30		EGEDHN
C=CCN1CCC(N[C@@H](c2ccc(OC)cc2)c2ccccn2)CC1	ZINC000652151139	462452504	/nfs/dbraw/zinc/45/25/04/462452504.db2.gz	KEZNYEWIZUTGOI-NRFANRHFSA-N	0	3	337.467	3.420	20	30		EGEDHN
Cc1ccc2c(c1)[C@@H](N[C@H]1CCN(Cc3ccc(C#N)cc3)C1=O)CC2	ZINC000190633858	534438375	/nfs/dbraw/zinc/43/83/75/534438375.db2.gz	TUEWZKLQMYDEAC-SFTDATJTSA-N	0	3	345.446	3.245	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]2CN(Cc3ccc(C#N)o3)C[C@H]21	ZINC000363844125	534895167	/nfs/dbraw/zinc/89/51/67/534895167.db2.gz	IAESLMUXPUOEGE-IAOVAPTHSA-N	0	3	345.443	3.276	20	30		EGEDHN
C=CCN1CCC(NC(=O)CSCc2cccc(Cl)c2)CC1	ZINC000171727278	526421855	/nfs/dbraw/zinc/42/18/55/526421855.db2.gz	QZPOMEPTJXVSMI-UHFFFAOYSA-N	0	3	338.904	3.340	20	30		EGEDHN
C=CCN1CCC(NC(=O)COc2ccccc2[C@@H](C)CC)CC1	ZINC000171720758	526422457	/nfs/dbraw/zinc/42/24/57/526422457.db2.gz	PITXDCNGFGLSOQ-INIZCTEOSA-N	0	3	330.472	3.346	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCCCc2ccc(Cl)cc2)CC1	ZINC000171730245	526432207	/nfs/dbraw/zinc/43/22/07/526432207.db2.gz	DZMZNKGNHJPVCQ-UHFFFAOYSA-N	0	3	335.879	3.222	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](C)C(C)(C)c2ccccc2)CC1	ZINC000171733597	526439028	/nfs/dbraw/zinc/43/90/28/526439028.db2.gz	GHHROWFANXPDSY-MRXNPFEDSA-N	0	3	329.488	3.302	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H]2CC(C)(C)c3ccccc32)CC1	ZINC000178247410	526439892	/nfs/dbraw/zinc/43/98/92/526439892.db2.gz	FAADUASMJQMZGR-SFHVURJKSA-N	0	3	327.472	3.359	20	30		EGEDHN
C#CCCCCNC(=O)N1CC[C@@H](C)N(Cc2ccccc2)CC1	ZINC000155104569	526699543	/nfs/dbraw/zinc/69/95/43/526699543.db2.gz	GHCDOOSZKCFMEZ-GOSISDBHSA-N	0	3	327.472	3.096	20	30		EGEDHN
C=C(C)[C@@H](N[C@H](C)C1CCS(=O)(=O)CC1)c1ccc(F)c(F)c1	ZINC000187567758	526758604	/nfs/dbraw/zinc/75/86/04/526758604.db2.gz	JEXGJCWQKKEHED-SJKOYZFVSA-N	0	3	343.439	3.385	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccccc2N(C)C2CCCC2)CC1	ZINC000153551625	526932595	/nfs/dbraw/zinc/93/25/95/526932595.db2.gz	APMUCXPTHYNDKX-UHFFFAOYSA-N	0	3	339.483	3.349	20	30		EGEDHN
CCN1CCN(c2cccc(NC(=O)c3cc(C#N)cs3)c2)CC1	ZINC000184258446	527709833	/nfs/dbraw/zinc/70/98/33/527709833.db2.gz	UWTKTNLBWHWVHH-UHFFFAOYSA-N	0	3	340.452	3.014	20	30		EGEDHN
CC1CCN([C@H](CNC(=O)c2c[nH]c(C#N)c2)c2ccccc2)CC1	ZINC000181242233	528261430	/nfs/dbraw/zinc/26/14/30/528261430.db2.gz	WFSKEJDIGMNELW-LJQANCHMSA-N	0	3	336.439	3.089	20	30		EGEDHN
C=CCOc1ccc(CNCC2(OC)CCOCC2)cc1Cl	ZINC000123064703	546737285	/nfs/dbraw/zinc/73/72/85/546737285.db2.gz	IQKYCZQGEMFNFQ-UHFFFAOYSA-N	0	3	325.836	3.190	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCC2(O)CCCCC2)C1	ZINC000329034979	547489841	/nfs/dbraw/zinc/48/98/41/547489841.db2.gz	CBYVQJHACVZQAN-SJLPKXTDSA-N	0	3	345.487	3.021	20	30		EGEDHN
O=C(NCC1CCN(c2ccncc2)CC1)[C@H]1CCc2cccnc21	ZINC000329219358	547492030	/nfs/dbraw/zinc/49/20/30/547492030.db2.gz	SKWQTRHWGDYCIU-SFHVURJKSA-N	0	3	336.439	3.380	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N[C@@H]1CCC(F)(F)C1)C(C)C	ZINC000675662256	548955559	/nfs/dbraw/zinc/95/55/59/548955559.db2.gz	VPYCNVYBJXDYJA-HUUCEWRRSA-N	0	3	329.435	3.172	20	30		EGEDHN
C=CCn1c(-c2ccccc2C)nnc1N1C[C@@H](C)N(CC)C[C@@H]1C	ZINC000685543379	550427532	/nfs/dbraw/zinc/42/75/32/550427532.db2.gz	FRZQAORDVABOJK-SJORKVTESA-N	0	3	339.487	3.358	20	30		EGEDHN
C#Cc1ccc(C(=O)N(CC)[C@@H]2CCN([C@@H](C)c3ccccc3)C2)cn1	ZINC000728861207	574779818	/nfs/dbraw/zinc/77/98/18/574779818.db2.gz	IONNYDCRAMEPFI-LAUBAEHRSA-N	0	3	347.462	3.361	20	30		EGEDHN
C#CCCN1CCC(NC(=O)Cc2ccc(Cl)cc2Cl)CC1	ZINC000740736013	574810354	/nfs/dbraw/zinc/81/03/54/574810354.db2.gz	AHDDJMKUSRAKKZ-UHFFFAOYSA-N	0	3	339.266	3.140	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2c(C)oc3ccc(OC)cc32)CC1	ZINC000729977648	574900783	/nfs/dbraw/zinc/90/07/83/574900783.db2.gz	XTXUTOPVSFUXTP-UHFFFAOYSA-N	0	3	328.412	3.130	20	30		EGEDHN
CC(C)(C)CC(=O)NCC(=O)C(C#N)c1nc2cc(F)ccc2s1	ZINC000730420368	574986313	/nfs/dbraw/zinc/98/63/13/574986313.db2.gz	COEASDNLDPRKCP-NSHDSACASA-N	0	3	347.415	3.164	20	30		EGEDHN
CS(=O)(=O)c1ccccc1N=NC1CCN(C2CCCCC2)CC1	ZINC000731933970	575222431	/nfs/dbraw/zinc/22/24/31/575222431.db2.gz	SLMLSGKPAKAQBM-UHFFFAOYSA-N	0	3	349.500	3.287	20	30		EGEDHN
Clc1nccnc1N=NCc1ccc(OCCN2CCCC2)cc1	ZINC000733080026	575306170	/nfs/dbraw/zinc/30/61/70/575306170.db2.gz	ATTQBTINBSKZEW-UHFFFAOYSA-N	0	3	345.834	3.051	20	30		EGEDHN
CC[C@H](C#N)Oc1cccc(CNC(=O)[C@H](C)N2[C@@H](C)CC[C@@H]2C)c1	ZINC000733810040	575393349	/nfs/dbraw/zinc/39/33/49/575393349.db2.gz	QQIMZFIHVJAELX-NBOOPKSLSA-N	0	3	343.471	3.245	20	30		EGEDHN
CC1CCC(N2CCN(Cc3ccc(OCC#N)cc3)CC2)CC1	ZINC000734488493	575493237	/nfs/dbraw/zinc/49/32/37/575493237.db2.gz	FSCNFWTZNYVOJX-UHFFFAOYSA-N	0	3	327.472	3.285	20	30		EGEDHN
C=CC[C@H](NC(=O)N[C@@H](C)CN1CCC[C@H](C)C1)c1ccncc1	ZINC000734661780	575533448	/nfs/dbraw/zinc/53/34/48/575533448.db2.gz	QJKYHGINCKYMHW-BQFCYCMXSA-N	0	3	330.476	3.118	20	30		EGEDHN
CN(C)Cc1ccc(CN(C)C(=O)CCc2ccc(C#N)cc2)cc1	ZINC000738522314	576334358	/nfs/dbraw/zinc/33/43/58/576334358.db2.gz	SSTHSZDKGUBJIR-UHFFFAOYSA-N	0	3	335.451	3.211	20	30		EGEDHN
C#CCCN1CCC(NC(=O)C2(c3cccc(Cl)c3)CCC2)CC1	ZINC000740735524	576621435	/nfs/dbraw/zinc/62/14/35/576621435.db2.gz	IZCSRMMPKIPFOW-UHFFFAOYSA-N	0	3	344.886	3.366	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2ccc(-c3ccccc3F)o2)CC1	ZINC000740737197	576621712	/nfs/dbraw/zinc/62/17/12/576621712.db2.gz	DMVFQGKCGVRESF-UHFFFAOYSA-N	0	3	340.398	3.303	20	30		EGEDHN
C#CCOc1ccc(C(=O)N(c2ccccc2)C2CCN(C)CC2)cc1	ZINC000741540288	576698528	/nfs/dbraw/zinc/69/85/28/576698528.db2.gz	PAETWNSWVOSTPZ-UHFFFAOYSA-N	0	3	348.446	3.440	20	30		EGEDHN
C#CCOc1ccc(F)cc1NCc1ccc(OCCN(C)C)cc1	ZINC000742374926	576775519	/nfs/dbraw/zinc/77/55/19/576775519.db2.gz	BHWVVMSTJYNILB-UHFFFAOYSA-N	0	3	342.414	3.390	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)C=C(C)C(C)(C)C)cc1OC	ZINC000744031884	576819307	/nfs/dbraw/zinc/81/93/07/576819307.db2.gz	CWNBAMOBAVNOFR-FWLQQBITSA-N	0	3	344.411	3.344	20	30		EGEDHN
CC(C)N(Cc1nc2ccccc2c(=O)n1CC#N)C1CCCCC1	ZINC000744392255	576827049	/nfs/dbraw/zinc/82/70/49/576827049.db2.gz	JUJCSIZMJZQLDJ-UHFFFAOYSA-N	0	3	338.455	3.463	20	30		EGEDHN
C[C@H](Oc1ccc(F)c(F)c1)C(=O)C(C#N)c1nc2ccccc2[nH]1	ZINC000744929823	576837130	/nfs/dbraw/zinc/83/71/30/576837130.db2.gz	OUUVNCUEVVUHLP-CMPLNLGQSA-N	0	3	341.317	3.485	20	30		EGEDHN
C[C@H]1CCCN(Cc2cc(=O)n3c4ccccc4[nH]c3c2C#N)CC1	ZINC000745170918	576842908	/nfs/dbraw/zinc/84/29/08/576842908.db2.gz	VAGPJTGWUKZCKH-GOEBONIOSA-N	0	3	334.423	3.346	20	30		EGEDHN
C[C@@H]([NH2+][C@@H](C)c1ccc(-c2nnn[n-]2)c(F)c1)c1ccc(C#N)cc1	ZINC000824528782	609136284	/nfs/dbraw/zinc/13/62/84/609136284.db2.gz	CEMRCMRCNURVHP-NEPJUHHUSA-N	0	3	336.374	3.289	20	30		EGEDHN
CN(C[C@H]1CCCCN1Cc1ccccc1)C(=O)c1cccc(C#N)n1	ZINC000830970745	1292793024	/nfs/dbraw/zinc/79/30/24/1292793024.db2.gz	YVRFIJTVMMYACZ-LJQANCHMSA-N	0	3	348.450	3.080	20	30		EGEDHN
CN(Cc1cccs1)c1ccc(C=NNCC(C)(C)CO)cc1	ZINC000834975499	1293183240	/nfs/dbraw/zinc/18/32/40/1293183240.db2.gz	NPSHOYWZHUPYQV-UHFFFAOYSA-N	0	3	331.485	3.327	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)CCCC(=O)C(C)(C)C)c1	ZINC000835060880	1293196106	/nfs/dbraw/zinc/19/61/06/1293196106.db2.gz	GQHFOWSOHHLZTP-OAHLLOKOSA-N	0	3	344.411	3.128	20	30		EGEDHN
N#CC(C(=O)COCC1CCCC1)C(=O)Nc1ccccc1Cl	ZINC000835062354	1293196544	/nfs/dbraw/zinc/19/65/44/1293196544.db2.gz	BJVDBWYPZUQQNT-CYBMUJFWSA-N	0	3	334.803	3.194	20	30		EGEDHN
CCC[C@@H](OC)C(=O)C(C#N)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000835066229	1293197765	/nfs/dbraw/zinc/19/77/65/1293197765.db2.gz	XAQRVKFBJGXIDT-QWHCGFSZSA-N	0	3	343.210	3.456	20	30		EGEDHN
C=CCNC(=O)C(C#N)C(=O)CCCc1cc(Cl)sc1Cl	ZINC000120035386	1293299842	/nfs/dbraw/zinc/29/98/42/1293299842.db2.gz	VRHOBWUPNSTCPL-SNVBAGLBSA-N	0	3	345.251	3.389	20	30		EGEDHN
CCc1nc(CC(=O)C(C#N)C(=O)Nc2ccc(CC)cc2)cs1	ZINC000121300970	1293364746	/nfs/dbraw/zinc/36/47/46/1293364746.db2.gz	DYQJVPJIEFMXJS-OAHLLOKOSA-N	0	3	341.436	3.158	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1)C(=O)c1coc(-c2ccccc2)n1	ZINC000121690715	1293384582	/nfs/dbraw/zinc/38/45/82/1293384582.db2.gz	QZHRESBQICEULV-OAHLLOKOSA-N	0	3	331.331	3.303	20	30		EGEDHN
N#CC(C(=O)CSc1ccccc1Cl)C(=O)Nc1ccccn1	ZINC000125119541	1293496737	/nfs/dbraw/zinc/49/67/37/1293496737.db2.gz	SAQPOYMBMLHTTI-NSHDSACASA-N	0	3	345.811	3.175	20	30		EGEDHN
CCOCCCC(=O)C(C#N)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000130498650	1293659489	/nfs/dbraw/zinc/65/94/89/1293659489.db2.gz	WDZYZJQUTGHVLK-CYBMUJFWSA-N	0	3	343.210	3.457	20	30		EGEDHN
N#CC(C(=O)Cc1c(Cl)cccc1Cl)C(=O)Nc1ccccn1	ZINC000138989873	1293839816	/nfs/dbraw/zinc/83/98/16/1293839816.db2.gz	HESQHHXTSLATIM-LLVKDONJSA-N	0	3	348.189	3.278	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)C[C@H](C)c1ccc(F)cc1F	ZINC000152188674	1293957754	/nfs/dbraw/zinc/95/77/54/1293957754.db2.gz	DPUKPFZPNHEADL-SWLSCSKDSA-N	0	3	336.382	3.474	20	30		EGEDHN
C#CCOc1ccccc1CN1CCC(C(=O)NCCCCC)CC1	ZINC000153016340	1293996378	/nfs/dbraw/zinc/99/63/78/1293996378.db2.gz	SIOUSXWNSDRWBZ-UHFFFAOYSA-N	0	3	342.483	3.217	20	30		EGEDHN
C#CCN(C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@@H]1CCc2ccccc21	ZINC000153763433	1294027448	/nfs/dbraw/zinc/02/74/48/1294027448.db2.gz	AKHQBGAYHWCTNJ-WOJBJXKFSA-N	0	3	336.391	3.251	20	30		EGEDHN
C[C@@H](OC1CCCCCC1)C(=O)C(C#N)c1nnc2n1CCCCC2	ZINC000162681242	1294320080	/nfs/dbraw/zinc/32/00/80/1294320080.db2.gz	NGMHFPNMPDULOI-ZBFHGGJFSA-N	0	3	344.459	3.309	20	30		EGEDHN
CC(C)(C)c1nc(CC(=O)C(C#N)C(=O)Nc2ccccc2)cs1	ZINC000170672717	1294376617	/nfs/dbraw/zinc/37/66/17/1294376617.db2.gz	VZWOXNCPFQGHIW-CQSZACIVSA-N	0	3	341.436	3.331	20	30		EGEDHN
N#CC(C(=O)CCC(F)(F)F)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000173979694	1294475330	/nfs/dbraw/zinc/47/53/30/1294475330.db2.gz	HSZHCISEEPTESR-MRVPVSSYSA-N	0	3	336.672	3.469	20	30		EGEDHN
CC(=O)CSCC(=O)C(C#N)c1nc(-c2ccccc2)cs1	ZINC000176748659	1294628365	/nfs/dbraw/zinc/62/83/65/1294628365.db2.gz	NUIRSQPMNWWOFE-ZDUSSCGKSA-N	0	3	330.434	3.309	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)c1cc2nc(C)ccc2o1	ZINC000179616868	1294807987	/nfs/dbraw/zinc/80/79/87/1294807987.db2.gz	UZHYYHAPIMKDAV-GFCCVEGCSA-N	0	3	349.346	3.106	20	30		EGEDHN
C=CCC[C@H](NCC(=O)Nc1ccccc1C(N)=O)c1ccccc1	ZINC000180049243	1294856266	/nfs/dbraw/zinc/85/62/66/1294856266.db2.gz	VKZREUUFBUTIRR-KRWDZBQOSA-N	0	3	337.423	3.021	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)Cc1c(F)cccc1Cl	ZINC000193364492	1295855824	/nfs/dbraw/zinc/85/58/24/1295855824.db2.gz	IFGILWCUXGUARD-ZDUSSCGKSA-N	0	3	338.810	3.427	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)Cc1c(F)cccc1Cl	ZINC000193364502	1295856211	/nfs/dbraw/zinc/85/62/11/1295856211.db2.gz	IFGILWCUXGUARD-CYBMUJFWSA-N	0	3	338.810	3.427	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(Cl)cc1)C(=O)c1cccc([N+](=O)[O-])c1	ZINC000193398707	1295862548	/nfs/dbraw/zinc/86/25/48/1295862548.db2.gz	VGWICHSCYMLTLL-AWEZNQCLSA-N	0	3	343.726	3.209	20	30		EGEDHN
Cc1noc(C)c1[C@H](C)C(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1	ZINC000195491939	1296072034	/nfs/dbraw/zinc/07/20/34/1296072034.db2.gz	IRNNAGRMJSFJEC-XPTSAGLGSA-N	0	3	345.786	3.396	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@H]1C[C@H]1c1c(F)cccc1F	ZINC000247568573	1296397032	/nfs/dbraw/zinc/39/70/32/1296397032.db2.gz	WEEQKJBKNLICKD-FRRDWIJNSA-N	0	3	334.366	3.084	20	30		EGEDHN
N#Cc1ccc(CNCc2cccc(I)c2)cc1	ZINC000381054646	1297549040	/nfs/dbraw/zinc/54/90/40/1297549040.db2.gz	SKGZMESONQGVJS-UHFFFAOYSA-N	0	3	348.187	3.453	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC000584908657	1298024179	/nfs/dbraw/zinc/02/41/79/1298024179.db2.gz	IJHYZCDRUSLKIL-INIZCTEOSA-N	0	3	330.472	3.378	20	30		EGEDHN
C[C@@H](CN(C)C(=O)OC(C)(C)C)NC1CC(C#N)(c2ccccc2)C1	ZINC000701889608	1298189179	/nfs/dbraw/zinc/18/91/79/1298189179.db2.gz	GAODEICLUHSZQX-FVWXCPNNSA-N	0	3	343.471	3.455	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@H]2C[C@@H](O)c2ccc(F)cc2)n1	ZINC000876809000	1299002954	/nfs/dbraw/zinc/00/29/54/1299002954.db2.gz	OQONPGILVLFZQK-RTBURBONSA-N	0	3	325.387	3.180	20	30		EGEDHN
C[C@@]1(Cc2ccc(F)c(F)c2)CCCN1C(=O)[C@H](N)CCCCC#N	ZINC000877224734	1299214584	/nfs/dbraw/zinc/21/45/84/1299214584.db2.gz	NCZCRLGUKJVPRV-MJGOQNOKSA-N	0	3	349.425	3.300	20	30		EGEDHN
COC[C@@H](C#N)OC(=O)c1cccc(CN(C)Cc2ccccc2)c1	ZINC000751780348	1299623289	/nfs/dbraw/zinc/62/32/89/1299623289.db2.gz	KLEREIJQKXYYRS-LJQANCHMSA-N	0	3	338.407	3.014	20	30		EGEDHN
N#Cc1ccc(C(=O)C(C#N)c2nc3ccccc3n2C(F)F)[nH]1	ZINC000752475972	1299744499	/nfs/dbraw/zinc/74/44/99/1299744499.db2.gz	HPHZDHZHWRNBGC-SNVBAGLBSA-N	0	3	325.278	3.121	20	30		EGEDHN
CCn1cc([C@H](O)CN(Cc2ccccc2)CC2(CC#N)CC2)cn1	ZINC000878500613	1300037872	/nfs/dbraw/zinc/03/78/72/1300037872.db2.gz	BNJCZKPFOMSYCA-LJQANCHMSA-N	0	3	338.455	3.132	20	30		EGEDHN
CN(C)[C@@H]1Cc2ccccc2N(C(=O)c2ccc(Cl)c(C#N)c2)C1	ZINC000754263099	1300112195	/nfs/dbraw/zinc/11/21/95/1300112195.db2.gz	GXIZVPGJTBXUAL-MRXNPFEDSA-N	0	3	339.826	3.345	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)OC(C)(C)C)CN1CCc1ccc(C#N)cc1	ZINC000879221635	1300434415	/nfs/dbraw/zinc/43/44/15/1300434415.db2.gz	CWQJBMCSBUXHJZ-WMLDXEAASA-N	0	3	329.444	3.088	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)OC(C)(C)C)CN1Cc1ccc(CC#N)cc1	ZINC000879226486	1300436898	/nfs/dbraw/zinc/43/68/98/1300436898.db2.gz	PJIGCFPUYQNXST-RHSMWYFYSA-N	0	3	329.444	3.240	20	30		EGEDHN
N#Cc1cccn(CNC2(c3cccc(Cl)c3)CCCC2)c1=O	ZINC000758246647	1300830835	/nfs/dbraw/zinc/83/08/35/1300830835.db2.gz	BPNWCGYYAVWVLE-UHFFFAOYSA-N	0	3	327.815	3.390	20	30		EGEDHN
CC1(C)CC(N=Nc2ccc([N+](=O)[O-])cn2)CN1Cc1ccccc1	ZINC000761261802	1301431129	/nfs/dbraw/zinc/43/11/29/1301431129.db2.gz	QOXJGSGADMAYCS-UHFFFAOYSA-N	0	3	339.399	3.442	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN[C@@H]2CCCOc3ccc(F)cc32)cc1	ZINC000763236745	1301854954	/nfs/dbraw/zinc/85/49/54/1301854954.db2.gz	SOROIYZXUWLJCZ-QZTJIDSGSA-N	0	3	326.371	3.234	20	30		EGEDHN
C#CCN(C(=O)NC[C@H](c1ccccc1)N1CCC(C)CC1)C1CC1	ZINC000764685741	1302117246	/nfs/dbraw/zinc/11/72/46/1302117246.db2.gz	UDUCTOUXMHSMSH-HXUWFJFHSA-N	0	3	339.483	3.267	20	30		EGEDHN
COc1ccc(CNCc2cccc(C3(C)OCCO3)c2)cc1C#N	ZINC000883128242	1302263031	/nfs/dbraw/zinc/26/30/31/1302263031.db2.gz	YWNYBSHIRYSNRZ-UHFFFAOYSA-N	0	3	338.407	3.076	20	30		EGEDHN
CC[C@H](C(=O)NCc1cccc(-c2ccc(C#N)s2)c1)N(C)C	ZINC000765621230	1302290991	/nfs/dbraw/zinc/29/09/91/1302290991.db2.gz	APWGZRANRHDSTG-MRXNPFEDSA-N	0	3	327.453	3.243	20	30		EGEDHN
N#CC(C(=O)C=Cc1ccc2[nH]ccc2c1)c1nnc2n1CCCCC2	ZINC000765914596	1302347453	/nfs/dbraw/zinc/34/74/53/1302347453.db2.gz	DOXOIKRINISBON-BVBGJJFLSA-N	0	3	345.406	3.375	20	30		EGEDHN
N#CC(C(=O)C=Cc1ccc2[nH]ccc2c1)c1nnc2n1CCCCC2	ZINC000765914597	1302347519	/nfs/dbraw/zinc/34/75/19/1302347519.db2.gz	DOXOIKRINISBON-IOBAAEILSA-N	0	3	345.406	3.375	20	30		EGEDHN
C#CCCCN[C@@H](C)c1nnn(-c2cccc(Br)c2)c1C	ZINC000766223535	1302412926	/nfs/dbraw/zinc/41/29/26/1302412926.db2.gz	QJBKCZMRRSKUKR-LBPRGKRZSA-N	0	3	347.260	3.402	20	30		EGEDHN
C[C@@H]1CN(C[C@H](O)c2ccc(C#N)cc2)[C@H](C)CN1Cc1ccccc1	ZINC000766965043	1302553184	/nfs/dbraw/zinc/55/31/84/1302553184.db2.gz	WQPVAXQPQWBSBM-HMFYCAOWSA-N	0	3	349.478	3.186	20	30		EGEDHN
Cc1oc2ccccc2c1CC(=O)C(C#N)C(=O)NC1CCCCC1	ZINC000767958528	1302793150	/nfs/dbraw/zinc/79/31/50/1302793150.db2.gz	GCQVTTKURVXFNV-QGZVFWFLSA-N	0	3	338.407	3.442	20	30		EGEDHN
C=CCc1cc(CNCc2cccc3nccn32)cc(OC)c1OC	ZINC000769692411	1303160111	/nfs/dbraw/zinc/16/01/11/1303160111.db2.gz	NPMXZPCQLLIPJH-UHFFFAOYSA-N	0	3	337.423	3.370	20	30		EGEDHN
C#CCOc1ccc([C@H](C)N[C@H]2CCN(Cc3ccccc3)C2=O)cc1	ZINC000772950493	1303597997	/nfs/dbraw/zinc/59/79/97/1303597997.db2.gz	LPTJUDGNCHKWPX-UWJYYQICSA-N	0	3	348.446	3.150	20	30		EGEDHN
CC1(OCC(=O)C(C#N)C(=O)Nc2ccc(F)c(Cl)c2)CCC1	ZINC000772970192	1303599412	/nfs/dbraw/zinc/59/94/12/1303599412.db2.gz	ASYMJZGSWGUAMM-NSHDSACASA-N	0	3	338.766	3.086	20	30		EGEDHN
C#CCOc1ccccc1CN[C@H](C)CC(=O)N(C)c1ccccc1	ZINC000772987494	1303602949	/nfs/dbraw/zinc/60/29/49/1303602949.db2.gz	IRWQMGMQBIZXQM-QGZVFWFLSA-N	0	3	336.435	3.230	20	30		EGEDHN
C[C@H](N[C@@H](C)c1ccc(N(C)C)cc1)C(=O)Nc1ccccc1C#N	ZINC000774482865	1303814803	/nfs/dbraw/zinc/81/48/03/1303814803.db2.gz	IHHDNJZTXKHCIS-GJZGRUSLSA-N	0	3	336.439	3.302	20	30		EGEDHN
CC(C)CCN(CCC#N)Cc1ccc(N2CCN(C)CC2)cc1	ZINC000775677385	1304013474	/nfs/dbraw/zinc/01/34/74/1304013474.db2.gz	NGNVSXKYYJULAB-UHFFFAOYSA-N	0	3	328.504	3.200	20	30		EGEDHN
C[C@@H](NCc1ccccc1Cn1cncn1)c1ccc(OCC#N)cc1	ZINC000776154762	1304102399	/nfs/dbraw/zinc/10/23/99/1304102399.db2.gz	WBYXWLAAJACEGM-MRXNPFEDSA-N	0	3	347.422	3.080	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CN[C@@H]1CCC[C@H](C(=O)N(C)C)C1	ZINC000778168273	1304408647	/nfs/dbraw/zinc/40/86/47/1304408647.db2.gz	AMMGJZUTQOFRAO-LSDHHAIUSA-N	0	3	348.874	3.089	20	30		EGEDHN
C[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1NCc1cc(C#N)ccc1F	ZINC000779121118	1304531083	/nfs/dbraw/zinc/53/10/83/1304531083.db2.gz	SQICETTUMDOFKF-DYVFJYSZSA-N	0	3	347.434	3.432	20	30		EGEDHN
CC(=NNC1=N[C@H](C)CN1)[C@@H](C)Oc1ccc(Cl)cc1Cl	ZINC000779798409	1304606607	/nfs/dbraw/zinc/60/66/07/1304606607.db2.gz	CMEMYLTUORKYOY-PSASIEDQSA-N	0	3	329.231	3.074	20	30		EGEDHN
COc1ccc([C@H](CCn2cncn2)NCc2ccc(C#N)cc2)cc1	ZINC000783223107	1305065232	/nfs/dbraw/zinc/06/52/32/1305065232.db2.gz	LYYAKNIVIYKVQY-FQEVSTJZSA-N	0	3	347.422	3.080	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)CC(C)(C)OC)cc1	ZINC000786311857	1305555094	/nfs/dbraw/zinc/55/50/94/1305555094.db2.gz	NANZCLVDRAFXEB-MRXNPFEDSA-N	0	3	330.428	3.492	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)C(=O)NC1CCCC1)c1c[nH]c2ccccc21	ZINC000786320827	1305556604	/nfs/dbraw/zinc/55/66/04/1305556604.db2.gz	CVBKAYHTFUFKMH-BBRMVZONSA-N	0	3	337.423	3.429	20	30		EGEDHN
N#CC(C(=O)CCCC(F)(F)F)C(=O)NCc1cccc(Cl)c1	ZINC000786531235	1305590438	/nfs/dbraw/zinc/59/04/38/1305590438.db2.gz	NNSACNGUQFDITO-GFCCVEGCSA-N	0	3	346.736	3.398	20	30		EGEDHN
C[C@@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccc(N2CCNC2=O)cc1	ZINC000787028775	1305678403	/nfs/dbraw/zinc/67/84/03/1305678403.db2.gz	WHZCINIOIMIQCL-VLIAUNLRSA-N	0	3	346.434	3.426	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CC1N=Nc1ccc2c(cc[nH]c2=O)c1	ZINC000789070153	1306082107	/nfs/dbraw/zinc/08/21/07/1306082107.db2.gz	GGUPTQYBURQBJD-HNNXBMFYSA-N	0	3	346.434	3.448	20	30		EGEDHN
CC1(C)CC(N=Nc2nc3ccccn3n2)CN1Cc1ccccc1	ZINC000790198808	1306275932	/nfs/dbraw/zinc/27/59/32/1306275932.db2.gz	TUELNTJDUSQXSP-UHFFFAOYSA-N	0	3	334.427	3.182	20	30		EGEDHN
N#Cc1ccncc1N1CC[NH+](Cc2c([O-])ccc3ccccc32)CC1	ZINC000793672089	1309426666	/nfs/dbraw/zinc/42/66/66/1309426666.db2.gz	GFPVWDZWGMHCTR-UHFFFAOYSA-N	0	3	344.418	3.134	20	30		EGEDHN
C[C@H](NC(=O)c1ccco1)C(=O)C(C#N)c1ncc(C(C)(C)C)s1	ZINC000797567407	1310212915	/nfs/dbraw/zinc/21/29/15/1310212915.db2.gz	HSBWEKZAPCNYET-WDEREUQCSA-N	0	3	345.424	3.028	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)[C@H]2CCCC(F)(F)C2)cc1	ZINC000800385318	1310746945	/nfs/dbraw/zinc/74/69/45/1310746945.db2.gz	ACIQLJNPPZYOAM-FZMZJTMJSA-N	0	3	336.338	3.168	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N1CCC[C@H]1c1ccccc1Cl	ZINC000836487266	1320493856	/nfs/dbraw/zinc/49/38/56/1320493856.db2.gz	CGYILMLWPBMRMC-KRWDZBQOSA-N	0	3	333.863	3.142	20	30		EGEDHN
C[C@H](C#N)OCCN1CCN(C2c3ccccc3-c3ccccc32)CC1	ZINC000801933532	1316968871	/nfs/dbraw/zinc/96/88/71/1316968871.db2.gz	CJNJIRYRPPUQKS-QGZVFWFLSA-N	0	3	347.462	3.303	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)c1ccc(Cl)nc1	ZINC000802040661	1316975499	/nfs/dbraw/zinc/97/54/99/1316975499.db2.gz	JAWVSQTWCLPOEI-LBPRGKRZSA-N	0	3	343.770	3.095	20	30		EGEDHN
CN(C)C[C@H](NC(=O)C#Cc1ccccc1)c1ccc(Cl)cc1	ZINC000802381657	1317003669	/nfs/dbraw/zinc/00/36/69/1317003669.db2.gz	LKUILDOHVDSSBZ-SFHVURJKSA-N	0	3	326.827	3.111	20	30		EGEDHN
CCNc1nc(NCc2cc(C#N)ccc2F)nc(NC(C)(C)C)n1	ZINC000804511201	1317253976	/nfs/dbraw/zinc/25/39/76/1317253976.db2.gz	KZCBEQKAVCZZDY-UHFFFAOYSA-N	0	3	343.410	3.137	20	30		EGEDHN
CCCN1CCC(N(C)C(=O)/C=C/C(=O)c2ccc(C)cc2)CC1	ZINC000900323450	1317272124	/nfs/dbraw/zinc/27/21/24/1317272124.db2.gz	VLXGIELSMPMYEP-MDZDMXLPSA-N	0	3	328.456	3.067	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)C1)C1CCCC1	ZINC001019632612	1317311930	/nfs/dbraw/zinc/31/19/30/1317311930.db2.gz	SHYAQHYREGIVCF-KSSFIOAISA-N	0	3	343.446	3.214	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1CCN(CC2CCC(C)CC2)CC1	ZINC000957467514	1317383158	/nfs/dbraw/zinc/38/31/58/1317383158.db2.gz	RSVZFZXQFKKRLI-UHFFFAOYSA-N	0	3	338.495	3.181	20	30		EGEDHN
N#CCCCCCC(=O)C(C#N)C(=O)NCc1cccc(Cl)c1	ZINC000805926579	1317440379	/nfs/dbraw/zinc/44/03/79/1317440379.db2.gz	SNRAKHGIOZNMLR-HNNXBMFYSA-N	0	3	331.803	3.139	20	30		EGEDHN
CC(C)(C)C1CC(C(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)C1	ZINC001019853906	1317452120	/nfs/dbraw/zinc/45/21/20/1317452120.db2.gz	DKDFRNYXOGBUPB-NRXISQOPSA-N	0	3	345.512	3.383	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@H](NC(=O)C(F)=C3CCCC3)C2)c1	ZINC001020071594	1317533489	/nfs/dbraw/zinc/53/34/89/1317533489.db2.gz	KORNHAZOMGDPKH-WKILWMFISA-N	0	3	345.393	3.232	20	30		EGEDHN
CCN(Cc1ccccc1C#N)CC1CCN(C(=O)C(C)C)CC1	ZINC000957676743	1317548496	/nfs/dbraw/zinc/54/84/96/1317548496.db2.gz	AHRSGZUVPAIGMC-UHFFFAOYSA-N	0	3	327.472	3.275	20	30		EGEDHN
C[C@@H]1[C@@H](NC(=O)Cc2ccccc2CC#N)CCN1Cc1ccccc1	ZINC000807738867	1317581060	/nfs/dbraw/zinc/58/10/60/1317581060.db2.gz	HVBIFQHDTCMPSE-UTKZUKDTSA-N	0	3	347.462	3.074	20	30		EGEDHN
C[C@@]1(C(=O)N[C@H]2C[C@H](NCc3ccc(C#N)cc3F)C2)CC=CCC1	ZINC001020193131	1317587861	/nfs/dbraw/zinc/58/78/61/1317587861.db2.gz	JIYVMFGWUULALD-MBOZVWFJSA-N	0	3	341.430	3.181	20	30		EGEDHN
CCN1CCN(c2ccc(Nc3snc(C)c3C#N)cc2)CC1	ZINC000807918223	1317601258	/nfs/dbraw/zinc/60/12/58/1317601258.db2.gz	YEBOXHUMYOJHAK-UHFFFAOYSA-N	0	3	327.457	3.209	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC(CN(CC)Cc2ccnn2C)CC1	ZINC000957737723	1317601711	/nfs/dbraw/zinc/60/17/11/1317601711.db2.gz	WJYJMGZMJPXTDC-UHFFFAOYSA-N	0	3	346.519	3.083	20	30		EGEDHN
CC[C@H](N[C@H](C)C(=O)NCCc1ccccc1)c1cccc(C#N)c1	ZINC000903016647	1317640657	/nfs/dbraw/zinc/64/06/57/1317640657.db2.gz	LIIDSMDIXAZWRD-UZLBHIALSA-N	0	3	335.451	3.346	20	30		EGEDHN
C[C@H]1CC[C@H](CC(=O)N[C@H]2C[C@H](NCc3ccc(C#N)cc3F)C2)C1	ZINC001020482550	1317717529	/nfs/dbraw/zinc/71/75/29/1317717529.db2.gz	GPVYUBJLVVSNSR-USJZOSNVSA-N	0	3	343.446	3.260	20	30		EGEDHN
C[C@@H]1CCC[C@H](C(=O)N[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)C1	ZINC001020524764	1317743845	/nfs/dbraw/zinc/74/38/45/1317743845.db2.gz	ZWHVWUDSXXDKIT-AETAKHFUSA-N	0	3	343.446	3.260	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1)C(=O)c1ccnc(C(F)(F)F)c1	ZINC000808979223	1317755596	/nfs/dbraw/zinc/75/55/96/1317755596.db2.gz	GFPFKBPGVSZKGL-LBPRGKRZSA-N	0	3	333.269	3.062	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@H](NCc3oc(CC)nc3C)C2)CC1	ZINC001020550430	1317762892	/nfs/dbraw/zinc/76/28/92/1317762892.db2.gz	XCTWYJJNZXANDZ-WKILWMFISA-N	0	3	331.460	3.029	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@H](NCc3oc(CCC)nc3C)C2)C1	ZINC001020562997	1317774879	/nfs/dbraw/zinc/77/48/79/1317774879.db2.gz	ZDFVXJOLPXRENK-SHTZXODSSA-N	0	3	331.460	3.029	20	30		EGEDHN
C=C(C)COc1cc(/C=C2/C(=O)c3ncnn3C2C)ccc1OC	ZINC000905080477	1317921102	/nfs/dbraw/zinc/92/11/02/1317921102.db2.gz	LFBINHWQHZGSTK-FUEWVNAISA-N	0	3	325.368	3.083	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc3nc(C)ccc3c2)C1	ZINC001020791284	1317931259	/nfs/dbraw/zinc/93/12/59/1317931259.db2.gz	VZTHYSIFWGFXDY-WKILWMFISA-N	0	3	329.831	3.146	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@H](NC(=O)[C@H]3CC34CCCC4)C2)c(F)c1	ZINC001020882042	1317982369	/nfs/dbraw/zinc/98/23/69/1317982369.db2.gz	JALCIBZLLQBYKM-BRWVUGGUSA-N	0	3	341.430	3.014	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@H](NC(=O)[C@@H]3CC34CCCC4)C2)c(F)c1	ZINC001020882043	1317982494	/nfs/dbraw/zinc/98/24/94/1317982494.db2.gz	JALCIBZLLQBYKM-ULQDDVLXSA-N	0	3	341.430	3.014	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NC1C[C@H]2CC[C@@H](C1)N2C[C@H](F)CC	ZINC001021447386	1318256882	/nfs/dbraw/zinc/25/68/82/1318256882.db2.gz	KQEHPRHPBMGKMT-XUBOLADHSA-N	0	3	342.458	3.070	20	30		EGEDHN
C=CCc1cc(CN2CC[C@@H](n3cc(Cl)cn3)C2)c(O)c(OC)c1	ZINC000811801286	1318268068	/nfs/dbraw/zinc/26/80/68/1318268068.db2.gz	IAVKDFQKIAZOER-MRXNPFEDSA-N	0	3	347.846	3.426	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)C=C2CCC2)cc1F	ZINC000959950342	1318285045	/nfs/dbraw/zinc/28/50/45/1318285045.db2.gz	KZVWMMLJGWHUNH-SFHVURJKSA-N	0	3	341.430	3.278	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@@H](CCCN3C(=O)CC3CC3)C2)cc1	ZINC001021497321	1318303461	/nfs/dbraw/zinc/30/34/61/1318303461.db2.gz	XAQOFMBHQSTKOE-VQTJNVASSA-N	0	3	337.467	3.171	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@@H](CCCN3C(=O)CC3CC3)C2)c1	ZINC001021497628	1318305385	/nfs/dbraw/zinc/30/53/85/1318305385.db2.gz	ZIKMQBDLFSKUPO-PMACEKPBSA-N	0	3	337.467	3.171	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@H]2CN(Cc3cccc(C#N)c3)CC[C@@H]21	ZINC001021505289	1318319462	/nfs/dbraw/zinc/31/94/62/1318319462.db2.gz	JSFDTUMBMBSHDM-PMACEKPBSA-N	0	3	339.483	3.417	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2sccc2Cl)C1	ZINC001021589703	1318434116	/nfs/dbraw/zinc/43/41/16/1318434116.db2.gz	BJDKGVLMXKJFIB-HIFRSBDPSA-N	0	3	336.888	3.351	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2sccc2Cl)C1	ZINC001021589702	1318434145	/nfs/dbraw/zinc/43/41/45/1318434145.db2.gz	BJDKGVLMXKJFIB-DZGCQCFKSA-N	0	3	336.888	3.351	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cccc(F)c2C)C1	ZINC001021594207	1318438585	/nfs/dbraw/zinc/43/85/85/1318438585.db2.gz	KETRLVUUABWDBV-APWZRJJASA-N	0	3	328.431	3.084	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1nccc2ccsc21	ZINC000960278742	1318441013	/nfs/dbraw/zinc/44/10/13/1318441013.db2.gz	NINKWSMZWVUBMI-IAGOWNOFSA-N	0	3	349.459	3.468	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)Cc1cc(C)ccc1C	ZINC000960298447	1318449296	/nfs/dbraw/zinc/44/92/96/1318449296.db2.gz	DTBOFCBGPKKFBJ-IFMALSPDSA-N	0	3	334.463	3.404	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc2ncccc2c1	ZINC000960303001	1318451462	/nfs/dbraw/zinc/45/14/62/1318451462.db2.gz	OSVHWIWZSYHGQA-NHCUHLMSSA-N	0	3	343.430	3.406	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2oc(C(F)F)cc2C)C1	ZINC001021609219	1318456547	/nfs/dbraw/zinc/45/65/47/1318456547.db2.gz	XBMWJHPDKDLIMO-KGLIPLIRSA-N	0	3	336.382	3.085	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@@H]1C[C@H]1c1cccnc1	ZINC000960315297	1318457196	/nfs/dbraw/zinc/45/71/96/1318457196.db2.gz	PWQHCUDQFVIPKN-DOIPELPJSA-N	0	3	347.462	3.133	20	30		EGEDHN
C[C@@H](NCc1cc(C#N)cs1)c1ccc(N2CCCNC2=O)cc1	ZINC000812801906	1318459504	/nfs/dbraw/zinc/45/95/04/1318459504.db2.gz	RBNNWOSNIUEAOP-CYBMUJFWSA-N	0	3	340.452	3.390	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1coc(C2CCC2)n1	ZINC000960324162	1318461355	/nfs/dbraw/zinc/46/13/55/1318461355.db2.gz	LBIMIVHNAFLUGT-SJLPKXTDSA-N	0	3	337.423	3.114	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)Cc1ccc(C)c(C)c1	ZINC000960335465	1318468877	/nfs/dbraw/zinc/46/88/77/1318468877.db2.gz	TUZDXSDRPQJSKX-IFMALSPDSA-N	0	3	334.463	3.404	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc3cc(C)ccc3n2)C1	ZINC001021627027	1318479289	/nfs/dbraw/zinc/47/92/89/1318479289.db2.gz	KJMRWRDKZJXLBB-NQIIRXRSSA-N	0	3	347.462	3.103	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(C)sc2C)C1	ZINC001021628021	1318480697	/nfs/dbraw/zinc/48/06/97/1318480697.db2.gz	RWCMPKVHFYQUHK-WMZOPIPTSA-N	0	3	330.497	3.315	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N(CCN1CCCC1)c1ccccc1	ZINC000813017350	1318489607	/nfs/dbraw/zinc/48/96/07/1318489607.db2.gz	JZNKRMBIFLQSGX-UHFFFAOYSA-N	0	3	332.447	3.339	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)c1cccs1	ZINC000960376134	1318498493	/nfs/dbraw/zinc/49/84/93/1318498493.db2.gz	CZWAGXVPGBRDDP-KRWDZBQOSA-N	0	3	339.464	3.356	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)CCc2ccc(C)cc2C)C1	ZINC001021641925	1318500358	/nfs/dbraw/zinc/50/03/58/1318500358.db2.gz	MVWICPJKNQZWEE-SFTDATJTSA-N	0	3	338.495	3.182	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)c1ccccc1	ZINC000960397241	1318524264	/nfs/dbraw/zinc/52/42/64/1318524264.db2.gz	XGZDHRZNVJPFFY-FQEVSTJZSA-N	0	3	333.435	3.295	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc[nH]c2C2CCC2)C1	ZINC001021666855	1318529912	/nfs/dbraw/zinc/52/99/12/1318529912.db2.gz	CIQXFSOSEPACOL-PKOBYXMFSA-N	0	3	339.483	3.232	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2noc3c2CCCCC3)C1	ZINC001021677355	1318546296	/nfs/dbraw/zinc/54/62/96/1318546296.db2.gz	HTADHGSKQYQGKW-RDJZCZTQSA-N	0	3	343.471	3.056	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2csc(Cl)c2)C1	ZINC001021677114	1318546557	/nfs/dbraw/zinc/54/65/57/1318546557.db2.gz	OLPRYDOMADPOKV-UKRRQHHQSA-N	0	3	336.888	3.351	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(Cl)c(F)c2)C1	ZINC001021677848	1318546843	/nfs/dbraw/zinc/54/68/43/1318546843.db2.gz	SSZLLHJKKXRNBA-YOEHRIQHSA-N	0	3	334.822	3.039	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)CCc2ccccc2C)C1	ZINC001021678405	1318547681	/nfs/dbraw/zinc/54/76/81/1318547681.db2.gz	YCUBOUSNIKARNP-LEWJYISDSA-N	0	3	338.495	3.264	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc3cc[nH]c3c2)C1	ZINC001021679879	1318550933	/nfs/dbraw/zinc/55/09/33/1318550933.db2.gz	UAPUYPUQHOFWJD-UYAOXDASSA-N	0	3	335.451	3.118	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(Cl)ccc2C)C1	ZINC001021694588	1318567853	/nfs/dbraw/zinc/56/78/53/1318567853.db2.gz	XICVBPNPMDHOKA-MAUKXSAKSA-N	0	3	330.859	3.208	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc3sccc3c2)C1	ZINC001021706624	1318580436	/nfs/dbraw/zinc/58/04/36/1318580436.db2.gz	MSNYJKIBEUNCRX-MSOLQXFVSA-N	0	3	338.476	3.461	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)CCC1CC1	ZINC000960489223	1318599269	/nfs/dbraw/zinc/59/92/69/1318599269.db2.gz	CAIBYBHHMWAMLW-IBGZPJMESA-N	0	3	325.456	3.171	20	30		EGEDHN
Cc1cc(Cl)ccc1CN(C)C[C@@H]1CCCN1C(=O)[C@H](C)C#N	ZINC000960502888	1318611518	/nfs/dbraw/zinc/61/15/18/1318611518.db2.gz	ONMQRTWIVMQPCG-PBHICJAKSA-N	0	3	333.863	3.231	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(OCC)cc2)C1	ZINC001021724849	1318616504	/nfs/dbraw/zinc/61/65/04/1318616504.db2.gz	OVDDVXLWBQXIFL-UYAOXDASSA-N	0	3	340.467	3.035	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(OC(C)C)cc2)C1	ZINC001021726800	1318621696	/nfs/dbraw/zinc/62/16/96/1318621696.db2.gz	GIGJEXHXPHYDHF-UYAOXDASSA-N	0	3	340.467	3.034	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)CCc2cccs2)C1	ZINC001021731206	1318633839	/nfs/dbraw/zinc/63/38/39/1318633839.db2.gz	TUYOZYLPURQAEV-AEFFLSMTSA-N	0	3	330.497	3.017	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)CCc2ccccc2F)C1	ZINC001021732725	1318636709	/nfs/dbraw/zinc/63/67/09/1318636709.db2.gz	HCQWMDXGIQUQEQ-AZUAARDMSA-N	0	3	342.458	3.095	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(Cl)cn2CC)C1	ZINC001021738844	1318645916	/nfs/dbraw/zinc/64/59/16/1318645916.db2.gz	CKPOJYZSRLMSHF-DOTOQJQBSA-N	0	3	347.890	3.111	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(C(C)C)s2)C1	ZINC001021743705	1318657389	/nfs/dbraw/zinc/65/73/89/1318657389.db2.gz	QVQFAKRKVPNBHW-JKSUJKDBSA-N	0	3	330.497	3.431	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(CC)c(CC)c2)C1	ZINC001021746218	1318660525	/nfs/dbraw/zinc/66/05/25/1318660525.db2.gz	JSCOMPHBGGAXLO-NHCUHLMSSA-N	0	3	338.495	3.371	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(CC)c(CC)c2)C1	ZINC001021746220	1318661644	/nfs/dbraw/zinc/66/16/44/1318661644.db2.gz	JSCOMPHBGGAXLO-SFTDATJTSA-N	0	3	338.495	3.371	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2coc3ccccc23)C1	ZINC001021749672	1318664849	/nfs/dbraw/zinc/66/48/49/1318664849.db2.gz	GVWZNZLKHKKSJR-VQIMIIECSA-N	0	3	336.435	3.383	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)[C@H]1CC1(C)C	ZINC000960550828	1318682455	/nfs/dbraw/zinc/68/24/55/1318682455.db2.gz	RRFUUELTNRXPDE-QZTJIDSGSA-N	0	3	325.456	3.027	20	30		EGEDHN
C[C@H](c1ccc(F)cc1)N(C)C[C@H]1CCCN1C(=O)C#CC1CC1	ZINC000960618132	1318744273	/nfs/dbraw/zinc/74/42/73/1318744273.db2.gz	OTTLOWAZSDKBTN-DNVCBOLYSA-N	0	3	328.431	3.223	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@@H]2[C@@H](c3ccccc3)C2(C)C)C1	ZINC001022086433	1318793782	/nfs/dbraw/zinc/79/37/82/1318793782.db2.gz	WBLHXACEZZEAMV-TWMKSMIVSA-N	0	3	332.875	3.416	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)[C@H]1CCC1(F)F	ZINC000960692112	1318796081	/nfs/dbraw/zinc/79/60/81/1318796081.db2.gz	HYOZREJHIQKSNA-IAGOWNOFSA-N	0	3	347.409	3.026	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)[C@]12C[C@H]1CCC2	ZINC000960755228	1318858320	/nfs/dbraw/zinc/85/83/20/1318858320.db2.gz	IAAGWAONQONUMT-SFHLNBCPSA-N	0	3	337.467	3.171	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)Nc1cccc(C(=O)NC)c1C	ZINC000912314727	1318865970	/nfs/dbraw/zinc/86/59/70/1318865970.db2.gz	VCMISEIRKGLLNI-MRXNPFEDSA-N	0	3	333.476	3.371	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1nc(-c2ccccc2OC)cs1	ZINC000912316202	1318866563	/nfs/dbraw/zinc/86/65/63/1318866563.db2.gz	PXRFPVISLWDXTJ-CYBMUJFWSA-N	0	3	331.441	3.441	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc(C3CC3)[nH]c2C2CC2)C1	ZINC001022279846	1318872577	/nfs/dbraw/zinc/87/25/77/1318872577.db2.gz	BKWUUVHPKKPPSM-OKILXGFUSA-N	0	3	333.863	3.372	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@@H]2CN(C)Cc2ccc(C#N)cc2)CC1	ZINC000960843779	1318978075	/nfs/dbraw/zinc/97/80/75/1318978075.db2.gz	KFQXPNGMXMBRJI-GOSISDBHSA-N	0	3	325.456	3.171	20	30		EGEDHN
C=C(C)CN1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1scnc1C1CCCC1	ZINC000960857290	1319001235	/nfs/dbraw/zinc/00/12/35/1319001235.db2.gz	SWCYEENHKBOESN-FOLVSLTJSA-N	0	3	331.485	3.037	20	30		EGEDHN
C[C@@H]1CCC[C@@H](C(=O)N[C@H]2C[C@@H](NCc3ccc(C#N)cc3F)C2)C1	ZINC001022623794	1319025361	/nfs/dbraw/zinc/02/53/61/1319025361.db2.gz	XTUJOHJKBMSYQP-UWIFEVILSA-N	0	3	343.446	3.260	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCC[C@@H]1CN(C)Cc1cccc(C#N)c1	ZINC000960904502	1319047066	/nfs/dbraw/zinc/04/70/66/1319047066.db2.gz	HBQWUMSPJUDKKY-QFBILLFUSA-N	0	3	327.472	3.273	20	30		EGEDHN
C[C@@H]1CCC[C@]1(C)C(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001022666780	1319057218	/nfs/dbraw/zinc/05/72/18/1319057218.db2.gz	RGWAZDZRVZWEDY-JPUXWFAOSA-N	0	3	343.446	3.260	20	30		EGEDHN
CO[C@@H]1CCC[C@H](C(=O)C(C#N)C(=O)Nc2ccccc2Cl)C1	ZINC000815907446	1319071561	/nfs/dbraw/zinc/07/15/61/1319071561.db2.gz	ATKOKONCOPEKHQ-YNEHKIRRSA-N	0	3	334.803	3.193	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc3nc(C)ccc3c2)C1	ZINC001022876043	1319146607	/nfs/dbraw/zinc/14/66/07/1319146607.db2.gz	VZTHYSIFWGFXDY-IYBDPMFKSA-N	0	3	329.831	3.146	20	30		EGEDHN
C[C@@H]1[C@@H](OC(=O)c2cccc(C#N)n2)CCCN1Cc1ccccc1	ZINC000816468528	1319161844	/nfs/dbraw/zinc/16/18/44/1319161844.db2.gz	ITERPRQEJPFPIM-BEFAXECRSA-N	0	3	335.407	3.163	20	30		EGEDHN
CCC(=O)N1CCC[C@@H]([C@H]2CCN(Cc3cc(C#N)ccc3F)C2)C1	ZINC000961070592	1319183353	/nfs/dbraw/zinc/18/33/53/1319183353.db2.gz	URXDSNANGAUWAW-SJORKVTESA-N	0	3	343.446	3.168	20	30		EGEDHN
CC(=O)N1CCC[C@@H]([C@H]2CCN(CC#Cc3ccc(Cl)cc3)C2)C1	ZINC000961095015	1319208226	/nfs/dbraw/zinc/20/82/26/1319208226.db2.gz	XSORVCDFBBFCLR-MOPGFXCFSA-N	0	3	344.886	3.272	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@@H](C)c2cccc(Cl)c2)C1	ZINC001023110127	1319264813	/nfs/dbraw/zinc/26/48/13/1319264813.db2.gz	PWBCMFOOCCYNSO-TUKIKUTGSA-N	0	3	327.255	3.433	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)C2C[C@H](C)C[C@@H](C)C2)C1	ZINC001023137520	1319281085	/nfs/dbraw/zinc/28/10/85/1319281085.db2.gz	KYEFGSRAWAURSF-FKGLVLAHSA-N	0	3	343.309	3.204	20	30		EGEDHN
C[C@@H](C#N)OCCN1CCC[C@H]1Cc1ccccc1Br	ZINC000817276516	1319309444	/nfs/dbraw/zinc/30/94/44/1319309444.db2.gz	HDCBKHWTFZYROM-ZFWWWQNUSA-N	0	3	337.261	3.385	20	30		EGEDHN
C#CC[C@H](NCc1cccc(CN2CCOCC2)c1)c1ccccc1	ZINC000817276292	1319311259	/nfs/dbraw/zinc/31/12/59/1319311259.db2.gz	XODOEBPQRTVFIP-QFIPXVFZSA-N	0	3	334.463	3.373	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H](CNC(=O)C3CCCC3)C2)cc1	ZINC001023196777	1319322570	/nfs/dbraw/zinc/32/25/70/1319322570.db2.gz	XEIOEMHWSYYCMW-GOSISDBHSA-N	0	3	325.456	3.077	20	30		EGEDHN
CC(=O)N1CCC([C@H]2CCCN(Cc3ccccc3C#N)C2)CC1	ZINC000961302805	1319462911	/nfs/dbraw/zinc/46/29/11/1319462911.db2.gz	DIVUSYLGHURFSN-IBGZPJMESA-N	0	3	325.456	3.029	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](C2CCN(C(=O)[C@H](C)SC)CC2)C1	ZINC000961328952	1319484892	/nfs/dbraw/zinc/48/48/92/1319484892.db2.gz	CVJHYKFPPDKRBY-HOCLYGCPSA-N	0	3	344.952	3.441	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NC[C@@H]1CCCN(Cc2ccsc2)C1	ZINC001023375159	1319485736	/nfs/dbraw/zinc/48/57/36/1319485736.db2.gz	HZKJJCQDRFJAKL-JQHSSLGASA-N	0	3	348.512	3.058	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc(C3CC3)[nH]c2C2CC2)C1	ZINC001023444531	1319540691	/nfs/dbraw/zinc/54/06/91/1319540691.db2.gz	OOZOXKUPSOMQSJ-OAHLLOKOSA-N	0	3	339.483	3.235	20	30		EGEDHN
C#CCN(C)CCCNC(=O)C[C@@H](C)c1ccc(C(F)(F)F)cc1	ZINC000818583997	1319564224	/nfs/dbraw/zinc/56/42/24/1319564224.db2.gz	ACBRNDHDSXOQSX-CQSZACIVSA-N	0	3	340.389	3.270	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](C2CCN(C(=O)C3(CF)CC3)CC2)C1	ZINC000961407611	1319565192	/nfs/dbraw/zinc/56/51/92/1319565192.db2.gz	YBFVPAKWLMCZJU-MRXNPFEDSA-N	0	3	342.886	3.439	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2sc(C)nc2CC(C)C)C1	ZINC001023470408	1319568853	/nfs/dbraw/zinc/56/88/53/1319568853.db2.gz	WNMGZGKHWUVSCG-INIZCTEOSA-N	0	3	347.528	3.115	20	30		EGEDHN
C#Cc1ccc(C(=O)NC2[C@H]3CN(C/C=C\c4ccccc4)C[C@@H]23)cc1	ZINC000961444508	1319596638	/nfs/dbraw/zinc/59/66/38/1319596638.db2.gz	SIKPCHZXUZLNBS-CFIHZIHDSA-N	0	3	342.442	3.041	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H](CNC(=O)[C@]34C[C@H]3CCC4)C2)cc1	ZINC001023504049	1319611204	/nfs/dbraw/zinc/61/12/04/1319611204.db2.gz	YPHGSCVYGDYEIZ-SFHLNBCPSA-N	0	3	337.467	3.077	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccccc2OC2CCC2)C1	ZINC001023582789	1319706626	/nfs/dbraw/zinc/70/66/26/1319706626.db2.gz	QLXVRTYHJDEJSL-QGZVFWFLSA-N	0	3	340.467	3.083	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@H]1C[C@H]1c1ccc(F)cc1	ZINC000916875154	1319718936	/nfs/dbraw/zinc/71/89/36/1319718936.db2.gz	TWDHXXFUBQIPEN-YESZJQIVSA-N	0	3	330.403	3.335	20	30		EGEDHN
N#CC(C(=O)CSCc1ccc(F)cc1)C(=O)NC1CCCCC1	ZINC000916893155	1319720082	/nfs/dbraw/zinc/72/00/82/1319720082.db2.gz	UBTQVBVMIXVABE-INIZCTEOSA-N	0	3	348.443	3.217	20	30		EGEDHN
CCc1cccc(OCC(=O)C(C#N)C(=O)Nc2cccc(C)c2)c1	ZINC000916897832	1319721016	/nfs/dbraw/zinc/72/10/16/1319721016.db2.gz	OYEFBZGSXOARLU-SFHVURJKSA-N	0	3	336.391	3.284	20	30		EGEDHN
C[C@H](Oc1ccccc1)C(=O)C(C#N)C(=O)Nc1ccccc1Cl	ZINC000916905891	1319722775	/nfs/dbraw/zinc/72/27/75/1319722775.db2.gz	NZAUQACNUMKARZ-JSGCOSHPSA-N	0	3	342.782	3.455	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc(-c3ccccc3)o2)C1	ZINC001023609539	1319723305	/nfs/dbraw/zinc/72/33/05/1319723305.db2.gz	SRTIEZBUVNMFNA-QGZVFWFLSA-N	0	3	336.435	3.412	20	30		EGEDHN
COCCN(CC(=O)C(C#N)c1nc2ccccc2s1)CC(C)C	ZINC000917100034	1319757209	/nfs/dbraw/zinc/75/72/09/1319757209.db2.gz	AGMGTVYQHSDMMK-AWEZNQCLSA-N	0	3	345.468	3.077	20	30		EGEDHN
N#Cc1ccccc1CNCC1CC(NC(=O)[C@@H]2CCCC23CC3)C1	ZINC000961987737	1319795018	/nfs/dbraw/zinc/79/50/18/1319795018.db2.gz	DEXMRECBDOYVNJ-PPSBMQLTSA-N	0	3	337.467	3.123	20	30		EGEDHN
C=CCN1CCC[C@@H](CNC(=O)c2cnc(-c3ccco3)s2)C1	ZINC001023713225	1319841655	/nfs/dbraw/zinc/84/16/55/1319841655.db2.gz	XBUBPSNFGBTTNZ-ZDUSSCGKSA-N	0	3	331.441	3.031	20	30		EGEDHN
C=C1CC(C)(C(=O)NC2CC(CNCc3c(F)cccc3F)C2)C1	ZINC000962267606	1319892588	/nfs/dbraw/zinc/89/25/88/1319892588.db2.gz	UEXGEAJJLCSXCX-UHFFFAOYSA-N	0	3	334.410	3.306	20	30		EGEDHN
COC(=O)[C@@]1(C(F)(F)F)CCN(CCCCC2(C#N)CCC2)C1	ZINC000930451793	1328858602	/nfs/dbraw/zinc/85/86/02/1328858602.db2.gz	TXVHLPMCSGIMPN-OAHLLOKOSA-N	0	3	332.366	3.278	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2sc(C(C)(C)C)nc2C)C1	ZINC001023774493	1319925480	/nfs/dbraw/zinc/92/54/80/1319925480.db2.gz	LEHGMBUNUCVJBF-HNNXBMFYSA-N	0	3	347.528	3.214	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc(CC)c(CC)c2)C1	ZINC001023779744	1319928395	/nfs/dbraw/zinc/92/83/95/1319928395.db2.gz	LCLDDAZNTYFYFQ-KRWDZBQOSA-N	0	3	326.484	3.277	20	30		EGEDHN
CC(C)(C)CC(=O)N1CCC[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001023840749	1319981694	/nfs/dbraw/zinc/98/16/94/1319981694.db2.gz	ISIQQINEUGZHGC-HNNXBMFYSA-N	0	3	345.462	3.462	20	30		EGEDHN
CN(C)Cc1cccc(C(=O)OC[C@H](C#N)Cc2ccc(F)cc2)c1	ZINC000821623018	1320023105	/nfs/dbraw/zinc/02/31/05/1320023105.db2.gz	ZUUFJNLCPAHAHD-KRWDZBQOSA-N	0	3	340.398	3.427	20	30		EGEDHN
CC(C)(C)OC(=O)N1C[C@@H]2C[C@]2(CNCc2cc(C#N)ccc2F)C1	ZINC000823949701	1320217536	/nfs/dbraw/zinc/21/75/36/1320217536.db2.gz	QRWPJBNOVGINMA-KXBFYZLASA-N	0	3	345.418	3.044	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCN2CC[C@H](C(F)(F)F)C2)cc1Cl	ZINC000839535646	1320934269	/nfs/dbraw/zinc/93/42/69/1320934269.db2.gz	ZBDCYAZPJOWJCU-NSHDSACASA-N	0	3	345.752	3.424	20	30		EGEDHN
CC[C@H](NC[C@@H](O)COc1ccccc1C#N)c1ccccc1OC	ZINC000859228615	1328951434	/nfs/dbraw/zinc/95/14/34/1328951434.db2.gz	UTWDBXUJAFCSDG-AEFFLSMTSA-N	0	3	340.423	3.047	20	30		EGEDHN
CCCCCCO[C@H](C)C(=O)C(C#N)c1nnc2n1CCCCC2	ZINC000842292133	1321367851	/nfs/dbraw/zinc/36/78/51/1321367851.db2.gz	SCHMXXXPMPUTTO-CABCVRRESA-N	0	3	332.448	3.166	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)c1ccc(C)c(C)n1	ZINC000842290045	1321367881	/nfs/dbraw/zinc/36/78/81/1321367881.db2.gz	YRIFYKVZSSAHAP-CQSZACIVSA-N	0	3	337.379	3.058	20	30		EGEDHN
CC[C@@H](OC1CCCC1)C(=O)C(C#N)C(=O)NCc1cccc(C)c1	ZINC000842344048	1321375237	/nfs/dbraw/zinc/37/52/37/1321375237.db2.gz	XCMLCQZPIMRPOH-QZTJIDSGSA-N	0	3	342.439	3.058	20	30		EGEDHN
CCN(Cc1ccccc1)c1ccc(C=NN(C)[C@H](C)CO)cc1	ZINC000842544264	1321401309	/nfs/dbraw/zinc/40/13/09/1321401309.db2.gz	GOBAFWDWJVPYSM-QGZVFWFLSA-N	0	3	325.456	3.360	20	30		EGEDHN
N#Cc1cnn2cc(C[N@@H+](Cc3ccccc3[O-])C3CCCC3)cnc12	ZINC000843396383	1321511483	/nfs/dbraw/zinc/51/14/83/1321511483.db2.gz	BWBYIXHBUZXXJY-UHFFFAOYSA-N	0	3	347.422	3.251	20	30		EGEDHN
N#Cc1cnn2cc(C[N@H+](Cc3ccccc3[O-])C3CCCC3)cnc12	ZINC000843396383	1321511486	/nfs/dbraw/zinc/51/14/86/1321511486.db2.gz	BWBYIXHBUZXXJY-UHFFFAOYSA-N	0	3	347.422	3.251	20	30		EGEDHN
C=CCc1ccc(OCC(=O)OC[C@@H]2CCN2C(C)(C)C)c(OC)c1	ZINC000845739420	1321740527	/nfs/dbraw/zinc/74/05/27/1321740527.db2.gz	FYRSWLTYEWYLEU-INIZCTEOSA-N	0	3	347.455	3.219	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN2CCN(C)C[C@H]2Cc2ccccc2)cc1	ZINC000846066808	1321765665	/nfs/dbraw/zinc/76/56/65/1321765665.db2.gz	GWBQVNWZORBMKU-WIYYLYMNSA-N	0	3	349.478	3.336	20	30		EGEDHN
N#Cc1cccc(CN2CCC([NH2+]Cc3cc(F)ccc3[O-])CC2)c1	ZINC000846114230	1321769185	/nfs/dbraw/zinc/76/91/85/1321769185.db2.gz	IMOFGOAVSOAGMC-UHFFFAOYSA-N	0	3	339.414	3.157	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H]2C[C@@H](O)c2ccc(F)cc2)nc1	ZINC000846831708	1321813687	/nfs/dbraw/zinc/81/36/87/1321813687.db2.gz	KSEJURKZHRMBCS-RBUKOAKNSA-N	0	3	325.387	3.180	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)CCCc1c(F)cccc1F	ZINC000847622462	1321884964	/nfs/dbraw/zinc/88/49/64/1321884964.db2.gz	LMPGXHVYJHXYDY-AWEZNQCLSA-N	0	3	336.382	3.303	20	30		EGEDHN
CC[C@H](SC)C(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847748506	1321900317	/nfs/dbraw/zinc/90/03/17/1321900317.db2.gz	BCUFMNUIQSZBLI-KRWDZBQOSA-N	0	3	346.496	3.477	20	30		EGEDHN
COC[C@H](C)Oc1ccc(CNCc2ccc(OC)c(C#N)c2)cc1	ZINC000850222279	1322209528	/nfs/dbraw/zinc/20/95/28/1322209528.db2.gz	UQNPSJWJFSZHGP-HNNXBMFYSA-N	0	3	340.423	3.270	20	30		EGEDHN
N#Cc1ccc(Br)c(CN[C@H]2CCCc3cn[nH]c32)c1	ZINC000921858769	1322413982	/nfs/dbraw/zinc/41/39/82/1322413982.db2.gz	AYBBICRYQWTOFN-AWEZNQCLSA-N	0	3	331.217	3.211	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CCC[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001023929971	1323036680	/nfs/dbraw/zinc/03/66/80/1323036680.db2.gz	LYAAOLFNEXHGBN-CQSZACIVSA-N	0	3	347.409	3.289	20	30		EGEDHN
C#CCOCCN[C@@H](Cn1cnc2ccccc21)c1ccc(F)cc1	ZINC000851921662	1323114180	/nfs/dbraw/zinc/11/41/80/1323114180.db2.gz	YLVVADHSDOAWKT-IBGZPJMESA-N	0	3	337.398	3.156	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@H](CNCc3cnc(C)o3)C2)CC1	ZINC001024134138	1323159516	/nfs/dbraw/zinc/15/95/16/1323159516.db2.gz	XKDXSEXRYAHMOI-MRXNPFEDSA-N	0	3	331.460	3.058	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H](CNCc2ccccc2C#N)C1	ZINC001024136420	1323161755	/nfs/dbraw/zinc/16/17/55/1323161755.db2.gz	ZXNZDLNKBKPTCZ-UTKZUKDTSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H](CNCc2ccccc2C#N)C1	ZINC001024136419	1323161900	/nfs/dbraw/zinc/16/19/00/1323161900.db2.gz	ZXNZDLNKBKPTCZ-LAUBAEHRSA-N	0	3	339.483	3.489	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCN(C(=O)[C@@H]2CC23CCC3)C1	ZINC001024182815	1323195327	/nfs/dbraw/zinc/19/53/27/1323195327.db2.gz	YDVIEZRYXHKYNE-APWZRJJASA-N	0	3	337.467	3.077	20	30		EGEDHN
CCC(=O)N1CCC[C@@H]([C@@H]2CCCN2Cc2ccc(C#N)cc2F)C1	ZINC000963213640	1323238747	/nfs/dbraw/zinc/23/87/47/1323238747.db2.gz	BYCGENKYJFSDEM-MJGOQNOKSA-N	0	3	343.446	3.310	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1sccc1C	ZINC001024438477	1323400855	/nfs/dbraw/zinc/40/08/55/1323400855.db2.gz	PDFFLELNZLCRLA-BRWVUGGUSA-N	0	3	330.497	3.154	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccn(C2CCCC2)n1	ZINC001024467414	1323423208	/nfs/dbraw/zinc/42/32/08/1323423208.db2.gz	FRSUAICAQAIAPA-KRWDZBQOSA-N	0	3	330.476	3.159	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@@H]1CCc2cc(OC)ccc21	ZINC001024472372	1323427134	/nfs/dbraw/zinc/42/71/34/1323427134.db2.gz	SBNGZBPOSFLJHV-YLJYHZDGSA-N	0	3	342.483	3.272	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@H]1CCc2cc(OC)ccc21	ZINC001024472371	1323427181	/nfs/dbraw/zinc/42/71/81/1323427181.db2.gz	SBNGZBPOSFLJHV-XLIONFOSSA-N	0	3	342.483	3.272	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@H]1CCc2ccc(OC)cc21	ZINC001024484282	1323438433	/nfs/dbraw/zinc/43/84/33/1323438433.db2.gz	PCCKJWDOZQSOCN-HKUYNNGSSA-N	0	3	342.483	3.272	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC001024508530	1323456501	/nfs/dbraw/zinc/45/65/01/1323456501.db2.gz	LRHRLABXHMXPLQ-BZUAXINKSA-N	0	3	342.405	3.125	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cc(C)n([C@@H](C)C2CC2)n1	ZINC001024518008	1323467243	/nfs/dbraw/zinc/46/72/43/1323467243.db2.gz	DYMXZRBUMFZAOO-WMZOPIPTSA-N	0	3	344.503	3.323	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cc2c(cn1)CCCC2	ZINC001024542670	1323486135	/nfs/dbraw/zinc/48/61/35/1323486135.db2.gz	ZRXUWQFTYOJHBQ-SFHVURJKSA-N	0	3	327.472	3.121	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1cc(-c2cccs2)on1	ZINC001024578735	1323515513	/nfs/dbraw/zinc/51/55/13/1323515513.db2.gz	ABFMBSSXFSCOKI-AWEZNQCLSA-N	0	3	343.452	3.011	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1sccc1-n1cccc1	ZINC001024585687	1323521098	/nfs/dbraw/zinc/52/10/98/1323521098.db2.gz	DTHANOCIPASIGW-MRXNPFEDSA-N	0	3	341.480	3.146	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cc2ccccc2[nH]c1=O	ZINC001024586975	1323522123	/nfs/dbraw/zinc/52/21/23/1323522123.db2.gz	XASBUGSUSWGJED-INIZCTEOSA-N	0	3	339.439	3.101	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccc(-n2cccc2)nc1	ZINC001024715499	1323623126	/nfs/dbraw/zinc/62/31/26/1323623126.db2.gz	GMFYHWIRGJRQPH-GOSISDBHSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cc(-n2cccc2)ccn1	ZINC001024746942	1323648330	/nfs/dbraw/zinc/64/83/30/1323648330.db2.gz	JSYVRLKMUJISSU-SFHVURJKSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=C(Cl)CN1CCCC[C@H]1CNC(=O)c1cccc2nc(C)[nH]c21	ZINC001024748620	1323651493	/nfs/dbraw/zinc/65/14/93/1323651493.db2.gz	LGQFAYLIVUDJLU-AWEZNQCLSA-N	0	3	346.862	3.208	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cnn([C@@H](C)CC)c1C	ZINC001024750033	1323652405	/nfs/dbraw/zinc/65/24/05/1323652405.db2.gz	KIKRBYPREPOTCZ-RDJZCZTQSA-N	0	3	332.492	3.323	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccc(O[C@@H](C)CC)cc1	ZINC001024750056	1323653675	/nfs/dbraw/zinc/65/36/75/1323653675.db2.gz	KPKMEBHEERFGBV-PKOBYXMFSA-N	0	3	342.483	3.472	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1cc(C)n(C(C)C)c1C	ZINC001024795073	1323701474	/nfs/dbraw/zinc/70/14/74/1323701474.db2.gz	YFBKGZFNDLJVCK-GOSISDBHSA-N	0	3	329.488	3.293	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccc(N(C)CCC)cc1	ZINC001024824125	1323727436	/nfs/dbraw/zinc/72/74/36/1323727436.db2.gz	CAQVAIRHRVMLHL-HXUWFJFHSA-N	0	3	341.499	3.140	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)C2CCCC2)cc1F	ZINC001024842566	1323740041	/nfs/dbraw/zinc/74/00/41/1323740041.db2.gz	YNMUPAFIJOTDCU-GOSISDBHSA-N	0	3	343.446	3.358	20	30		EGEDHN
COc1ccc(C#N)cc1CNC[C@H]1CCCCN1C(=O)CC(C)C	ZINC001024850525	1323745340	/nfs/dbraw/zinc/74/53/40/1323745340.db2.gz	SDJRQSSARUDXAL-GOSISDBHSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCCC[C@H]1CNCc1cccnc1	ZINC001024974750	1323808701	/nfs/dbraw/zinc/80/87/01/1323808701.db2.gz	NIWVQINUQOVTFZ-INIZCTEOSA-N	0	3	335.879	3.331	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCCC[C@H]1CNCc1ncccc1C	ZINC001025037857	1323840236	/nfs/dbraw/zinc/84/02/36/1323840236.db2.gz	NHMWAMMCUOICSU-KRWDZBQOSA-N	0	3	329.488	3.463	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCCC[C@H]1CNCc1c(C)noc1C	ZINC001025069579	1323870717	/nfs/dbraw/zinc/87/07/17/1323870717.db2.gz	LUUKBDBNUABCMA-QFBILLFUSA-N	0	3	333.476	3.364	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@H]2[C@H]2CCCCN2C(=O)C(F)F)c1	ZINC001025182795	1323950137	/nfs/dbraw/zinc/95/01/37/1323950137.db2.gz	GXBADXOEMJTJGW-DLBZAZTESA-N	0	3	347.409	3.169	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccncc1CC	ZINC001025244418	1324041200	/nfs/dbraw/zinc/04/12/00/1324041200.db2.gz	JLOCCAUGDGGJBN-WOJBJXKFSA-N	0	3	339.483	3.126	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ncccc1CC	ZINC001025244700	1324041911	/nfs/dbraw/zinc/04/19/11/1324041911.db2.gz	JSFPTPWCUALVFV-ZWKOTPCHSA-N	0	3	327.472	3.289	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)CCc1ccc(C)cc1	ZINC001025251544	1324054785	/nfs/dbraw/zinc/05/47/85/1324054785.db2.gz	SFVRWWLNGWXQQR-SFTDATJTSA-N	0	3	338.495	3.406	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)C(C)(C)C(F)F	ZINC001025268501	1324079394	/nfs/dbraw/zinc/07/93/94/1324079394.db2.gz	BUSKUVGVOLFENV-CABCVRRESA-N	0	3	326.431	3.147	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(Cl)no1	ZINC001025289581	1324113841	/nfs/dbraw/zinc/11/38/41/1324113841.db2.gz	QVLWLYIYBWXWPY-ZIAGYGMSSA-N	0	3	337.851	3.363	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)CCc1ccccc1	ZINC001025293476	1324120892	/nfs/dbraw/zinc/12/08/92/1324120892.db2.gz	RZJXZWQLYJSBCB-RTWAWAEBSA-N	0	3	338.495	3.488	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1sc(C)nc1C	ZINC001025294400	1324124566	/nfs/dbraw/zinc/12/45/66/1324124566.db2.gz	AOLKCCBBPJNXSU-HOTGVXAUSA-N	0	3	333.501	3.405	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(C)n(C)c1C	ZINC001025297122	1324128902	/nfs/dbraw/zinc/12/89/02/1324128902.db2.gz	OJJLJKXFJNDEPL-WOJBJXKFSA-N	0	3	341.499	3.124	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc(F)cc1F	ZINC001025298750	1324132708	/nfs/dbraw/zinc/13/27/08/1324132708.db2.gz	ZUJMMBAAJUATPK-RBUKOAKNSA-N	0	3	346.421	3.447	20	30		EGEDHN
C[C@@H](NC(=O)C1CC=CC1)[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001025373684	1324214940	/nfs/dbraw/zinc/21/49/40/1324214940.db2.gz	UZISGORCJYTIGA-OXQOHEQNSA-N	0	3	337.467	3.241	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc3c(o2)CCCC3)C1	ZINC001025438766	1324278087	/nfs/dbraw/zinc/27/80/87/1324278087.db2.gz	IBFHHHOKSJLZGJ-WBVHZDCISA-N	0	3	328.456	3.012	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H](C)[C@@H]1CCCN(C/C=C\Cl)C1	ZINC001025438151	1324278575	/nfs/dbraw/zinc/27/85/75/1324278575.db2.gz	DBRVJRQODRNVGV-PDTSHOSPSA-N	0	3	335.879	3.257	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccccc2-c2ccncc2)C1	ZINC001025455369	1324296015	/nfs/dbraw/zinc/29/60/15/1324296015.db2.gz	CHEOGUNGOQZBML-PKOBYXMFSA-N	0	3	347.462	3.212	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@@H](C)[C@H]2CCCN(CC#CC)C2)cc1	ZINC001025461376	1324307563	/nfs/dbraw/zinc/30/75/63/1324307563.db2.gz	TWRYVRUSXVCMQZ-HKUYNNGSSA-N	0	3	340.467	3.105	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2c(C)[nH]c3ccccc32)C1	ZINC001025480601	1324327230	/nfs/dbraw/zinc/32/72/30/1324327230.db2.gz	XZKDQWMGFVIBOO-WBVHZDCISA-N	0	3	337.467	3.330	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(C)c(C)cc2Cl)C1	ZINC001025502197	1324352317	/nfs/dbraw/zinc/35/23/17/1324352317.db2.gz	KWOIOJMWSNEERL-CVEARBPZSA-N	0	3	332.875	3.420	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cncc3sccc32)C1	ZINC001025517913	1324361540	/nfs/dbraw/zinc/36/15/40/1324361540.db2.gz	CBCUBMYMQQWQNK-CABCVRRESA-N	0	3	341.480	3.150	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(C(C)C)nc2C)C1	ZINC001025530472	1324376672	/nfs/dbraw/zinc/37/66/72/1324376672.db2.gz	IRYIHZPKOLRSNC-AEFFLSMTSA-N	0	3	341.499	3.367	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cnc3ccccc3c2)C1	ZINC001025543021	1324390325	/nfs/dbraw/zinc/39/03/25/1324390325.db2.gz	GIWTWXDXJCWMBT-SJLPKXTDSA-N	0	3	335.451	3.088	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(C(CC)CC)no2)C1	ZINC001025555572	1324403983	/nfs/dbraw/zinc/40/39/83/1324403983.db2.gz	OVOAJFTURDQOMP-NVXWUHKLSA-N	0	3	345.487	3.432	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cccc(C(C)(C)C)c2)C1	ZINC001025576610	1324416207	/nfs/dbraw/zinc/41/62/07/1324416207.db2.gz	LMMZEMGEAQOUJV-SJLPKXTDSA-N	0	3	326.484	3.448	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc3nc(C)sc3c2)C1	ZINC001025587426	1324431397	/nfs/dbraw/zinc/43/13/97/1324431397.db2.gz	MMSQVNKNEXVYCC-CZUORRHYSA-N	0	3	341.480	3.068	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cccc3ccsc32)C1	ZINC001025588408	1324432770	/nfs/dbraw/zinc/43/27/70/1324432770.db2.gz	VPAJGKBITPDOKC-HOCLYGCPSA-N	0	3	326.465	3.365	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(CC)c(CC)o2)C1	ZINC001025598877	1324447020	/nfs/dbraw/zinc/44/70/20/1324447020.db2.gz	CFEAZXAERUTKLU-NVXWUHKLSA-N	0	3	330.472	3.258	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)C23CC4CC(CC(C4)C2)C3)C1	ZINC001025606445	1324455742	/nfs/dbraw/zinc/45/57/42/1324455742.db2.gz	FOVCJFPAENTYEQ-VJRVKHOTSA-N	0	3	328.500	3.053	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(F)c(F)cc2Cl)C1	ZINC001025609737	1324460006	/nfs/dbraw/zinc/46/00/06/1324460006.db2.gz	HOYASLIJIIEAFU-RYUDHWBXSA-N	0	3	340.801	3.082	20	30		EGEDHN
Cc1coc(C(=O)N2C[C@@H]3CC[C@@H](NCc4ccccc4C#N)[C@H]3C2)c1	ZINC001026334640	1324734423	/nfs/dbraw/zinc/73/44/23/1324734423.db2.gz	LSNYPDMHBMKTPK-GBESFXJTSA-N	0	3	349.434	3.100	20	30		EGEDHN
CCC(C)(C)C(=O)N1C[C@@H]2CC[C@H](NCc3ccccc3C#N)[C@H]2C1	ZINC001026344539	1324742273	/nfs/dbraw/zinc/74/22/73/1324742273.db2.gz	SFISTTWUGLDIEG-FHWLQOOXSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H]3CC[C@H](NCc4nocc4C)[C@@H]3C2)CC1	ZINC001026348672	1324744006	/nfs/dbraw/zinc/74/40/06/1324744006.db2.gz	PQCDQCCIAVOVAZ-KSZLIROESA-N	0	3	343.471	3.056	20	30		EGEDHN
N#Cc1ccc(C[NH2+]C2CCC(NC(=O)c3ccccc3[O-])CC2)cc1	ZINC001026456414	1324819349	/nfs/dbraw/zinc/81/93/49/1324819349.db2.gz	NGWYHWSOKTZZHS-UHFFFAOYSA-N	0	3	349.434	3.095	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC[C@H](CNCc2c(Cl)cccc2Cl)C1	ZINC001026728330	1324994020	/nfs/dbraw/zinc/99/40/20/1324994020.db2.gz	FWODYRSHTQLEDI-VXGBXAGGSA-N	0	3	340.254	3.091	20	30		EGEDHN
CC(C)(C(=O)N1CC[C@H](CNCc2ccccc2C#N)C1)C1CCC1	ZINC001026975470	1325119060	/nfs/dbraw/zinc/11/90/60/1325119060.db2.gz	ZUHQMIAFWPASHW-MRXNPFEDSA-N	0	3	339.483	3.323	20	30		EGEDHN
N#Cc1ncc(Br)cc1NC[C@@H]1CCCCN1C1CC1	ZINC000853539011	1325119470	/nfs/dbraw/zinc/11/94/70/1325119470.db2.gz	ZODCBCIRKLFAQG-ZDUSSCGKSA-N	0	3	335.249	3.145	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](CNCc2cc(C3CC3)no2)C1	ZINC001026988627	1325127669	/nfs/dbraw/zinc/12/76/69/1325127669.db2.gz	LMCVKEQQBJLMRZ-AWEZNQCLSA-N	0	3	331.460	3.092	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](CNCc2oc(CC)nc2C)C1	ZINC001027038048	1325171909	/nfs/dbraw/zinc/17/19/09/1325171909.db2.gz	GUXYEPDPYMNLMX-HNAYVOBHSA-N	0	3	333.476	3.086	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H](CNCc2nc3ccccc3o2)C1	ZINC001027039289	1325173161	/nfs/dbraw/zinc/17/31/61/1325173161.db2.gz	ZPTNOYVTAGWGOK-FOIQADDNSA-N	0	3	341.455	3.368	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](CNCc2nc3ccccc3o2)C1	ZINC001027039290	1325173728	/nfs/dbraw/zinc/17/37/28/1325173728.db2.gz	ZPTNOYVTAGWGOK-MGPUTAFESA-N	0	3	341.455	3.368	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)C2CCC(F)CC2)C1	ZINC001027040597	1325175587	/nfs/dbraw/zinc/17/55/87/1325175587.db2.gz	GSOXDILNWNVLIS-LYGPFTKASA-N	0	3	343.446	3.025	20	30		EGEDHN
C[C@@H](CC(C)(C)C#N)N[C@@H]1CCN(CCCc2ccccc2)C1=O	ZINC000925499043	1325179634	/nfs/dbraw/zinc/17/96/34/1325179634.db2.gz	LYAHVXGCLKADQB-FUHWJXTLSA-N	0	3	327.472	3.138	20	30		EGEDHN
CC(C)C#CC(=O)Nc1cc(Cl)ccc1OC1CCN(C)CC1	ZINC000854888490	1325319438	/nfs/dbraw/zinc/31/94/38/1325319438.db2.gz	NMVOROLFNCCACN-UHFFFAOYSA-N	0	3	334.847	3.411	20	30		EGEDHN
CN(Cc1ccc(F)c(C#N)c1)[C@@H]1CCCN(C(=O)C2CCCC2)C1	ZINC001027268325	1325368850	/nfs/dbraw/zinc/36/88/50/1325368850.db2.gz	OHYVRFOTWTVODX-GOSISDBHSA-N	0	3	343.446	3.310	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@H](N(C)Cc2cc3ccccc3o2)C1	ZINC001027335259	1325495593	/nfs/dbraw/zinc/49/55/93/1325495593.db2.gz	FBEYLKALMCZRCR-ZBFHGGJFSA-N	0	3	325.412	3.015	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1c(C)onc1C1CC1)C2	ZINC000964371771	1325496125	/nfs/dbraw/zinc/49/61/25/1325496125.db2.gz	HOAUVUHEZKFWLQ-UHFFFAOYSA-N	0	3	349.862	3.244	20	30		EGEDHN
CN(Cc1ccc(C#N)c(F)c1)[C@H]1CCCN(C(=O)C2CC=CC2)C1	ZINC001027345711	1325509074	/nfs/dbraw/zinc/50/90/74/1325509074.db2.gz	UZYKDIPCAPAHFE-SFHVURJKSA-N	0	3	341.430	3.086	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)CC2CCC2)C1	ZINC001027352047	1325519376	/nfs/dbraw/zinc/51/93/76/1325519376.db2.gz	YJPWAQCTLFAFEX-LJQANCHMSA-N	0	3	325.456	3.171	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)C2CC(OC)C2)cc1	ZINC000860471157	1329321615	/nfs/dbraw/zinc/32/16/15/1329321615.db2.gz	ZHSPPXLNLPPXFM-PREGVCBESA-N	0	3	328.412	3.102	20	30		EGEDHN
COC1CC(C(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2Cl)C1	ZINC000860473289	1329321708	/nfs/dbraw/zinc/32/17/08/1329321708.db2.gz	KLTXIUFKKJKDQV-RFBVYIQQSA-N	0	3	341.194	3.066	20	30		EGEDHN
COC1CC(C(=O)C(C#N)C(=O)Nc2cc(Cl)cc(Cl)c2)C1	ZINC000860473126	1329321949	/nfs/dbraw/zinc/32/19/49/1329321949.db2.gz	IKRTVZMTNZWACH-FMFXKYEUSA-N	0	3	341.194	3.066	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1cc(Cl)c(Cl)n1C	ZINC001038321800	1344379771	/nfs/dbraw/zinc/37/97/71/1344379771.db2.gz	OHZFRXXRJGOAQB-NSHDSACASA-N	0	3	330.259	3.102	20	30		EGEDHN
CN(Cc1ccc(Cl)cc1)[C@H]1CCCN(C(=O)C#CC2CC2)C1	ZINC001027405378	1327631394	/nfs/dbraw/zinc/63/13/94/1327631394.db2.gz	GMJZZMXKJBKTGJ-SFHVURJKSA-N	0	3	330.859	3.176	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)c2ccccc2CC(C)(C)C)C1	ZINC001027456876	1327699704	/nfs/dbraw/zinc/69/97/04/1327699704.db2.gz	PTALBANWXHQWOF-SFHVURJKSA-N	0	3	326.484	3.445	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)[C@]23C[C@H]2CCC3)C1	ZINC001027499980	1327762929	/nfs/dbraw/zinc/76/29/29/1327762929.db2.gz	RZHWVTJCUGMBKV-SFHLNBCPSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](N(C)Cc2ccccc2N(C)C)C1	ZINC001027522600	1327796368	/nfs/dbraw/zinc/79/63/68/1327796368.db2.gz	XZMFHPUTLZFNGL-SFHVURJKSA-N	0	3	343.515	3.388	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H](N(C)Cc3cccc(C#N)c3)C2)C1	ZINC001027567739	1327898051	/nfs/dbraw/zinc/89/80/51/1327898051.db2.gz	ZNHSMKLBVUIBEO-IBGZPJMESA-N	0	3	337.467	3.337	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)[C@H]2CC23CCC3)C1	ZINC001027597026	1327947219	/nfs/dbraw/zinc/94/72/19/1327947219.db2.gz	FWMPZZBFEBPNNZ-RTBURBONSA-N	0	3	337.467	3.171	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)c2ccc(Cl)c(CCC)c2)C1	ZINC001027648854	1328028066	/nfs/dbraw/zinc/02/80/66/1328028066.db2.gz	WUJAVLGWWWAGGF-KRWDZBQOSA-N	0	3	332.875	3.462	20	30		EGEDHN
C=C(C)CN(C)[C@H]1CCCN(C(=O)c2ccc(P(C)(C)=O)cc2)C1	ZINC001027692029	1328095876	/nfs/dbraw/zinc/09/58/76/1328095876.db2.gz	ZEJFIHGBQAFEEU-KRWDZBQOSA-N	0	3	348.427	3.047	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2coc3c2cccc3OC)C1	ZINC000966136395	1328202843	/nfs/dbraw/zinc/20/28/43/1328202843.db2.gz	TUGIVDXIXAMARN-YOEHRIQHSA-N	0	3	342.439	3.458	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2cc(F)c3ccccc3c2)C1	ZINC000966600760	1328350614	/nfs/dbraw/zinc/35/06/14/1328350614.db2.gz	PLMWVPPGLPSSAY-MGPUTAFESA-N	0	3	338.426	3.442	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2cc3ccncc3s2)C1	ZINC000966667299	1328372045	/nfs/dbraw/zinc/37/20/45/1328372045.db2.gz	NPOBEARCNCQYFP-UKRRQHHQSA-N	0	3	329.469	3.313	20	30		EGEDHN
C=C(C)CCN1CCC[C@H]1CNC(=O)c1sc(Cl)nc1C	ZINC001027906282	1328377949	/nfs/dbraw/zinc/37/79/49/1328377949.db2.gz	NDBYEVWKKAPFRV-LBPRGKRZSA-N	0	3	327.881	3.265	20	30		EGEDHN
C[C@@H](NC(=O)Nc1sccc1C#N)[C@H](c1ccccc1)N(C)C	ZINC000931836781	1329765329	/nfs/dbraw/zinc/76/53/29/1329765329.db2.gz	AOXQSNQDMDGSLT-IUODEOHRSA-N	0	3	328.441	3.433	20	30		EGEDHN
N#Cc1ccsc1NC(=O)N[C@@H]1CCN(Cc2ccccc2)C1	ZINC000931848433	1329766227	/nfs/dbraw/zinc/76/62/27/1329766227.db2.gz	AGKSYZYQQLDGTB-OAHLLOKOSA-N	0	3	326.425	3.016	20	30		EGEDHN
CC(C)[C@H](N[C@@H](C)c1ccc(OCC#N)cc1)[C@H](O)C(F)(F)F	ZINC000866464527	1330115898	/nfs/dbraw/zinc/11/58/98/1330115898.db2.gz	WHAANYZFZUUDBL-CQDKDKBSSA-N	0	3	330.350	3.187	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2oc3ccc(F)cc3c2C)[C@@H](C)C1	ZINC000942122009	1331838555	/nfs/dbraw/zinc/83/85/55/1331838555.db2.gz	JTIKTNCZBPMNEN-GUYCJALGSA-N	0	3	342.414	3.344	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc(F)c3ccncc23)[C@@H](C)C1	ZINC000942574898	1331983822	/nfs/dbraw/zinc/98/38/22/1331983822.db2.gz	OGJYPLHXSCUEBD-UGSOOPFHSA-N	0	3	327.403	3.000	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C(C)(C)c2ccc(Cl)cc2)[C@@H](C)C1	ZINC000942594767	1331995006	/nfs/dbraw/zinc/99/50/06/1331995006.db2.gz	OBFDHUOSPWTVNK-MAUKXSAKSA-N	0	3	346.902	3.468	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3ccc(OC)cc3)C[C@H]2C)C1	ZINC000942603217	1332001112	/nfs/dbraw/zinc/00/11/12/1332001112.db2.gz	UFZYRSDRYJLKDJ-APWZRJJASA-N	0	3	342.483	3.378	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccccc2OC2CCC2)[C@H](C)C1	ZINC000942703329	1332023478	/nfs/dbraw/zinc/02/34/78/1332023478.db2.gz	XTWLUKPRFDQDQQ-CRAIPNDOSA-N	0	3	328.456	3.244	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C(F)F)c(F)c2)[C@H](C)C1	ZINC000942823770	1332043347	/nfs/dbraw/zinc/04/33/47/1332043347.db2.gz	VSYLWUZMWBFTSV-MLGOLLRUSA-N	0	3	338.373	3.227	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C(C)(C)C)oc2C)[C@H](C)C1	ZINC000943029854	1332084659	/nfs/dbraw/zinc/08/46/59/1332084659.db2.gz	UKSABSCGRJNLBK-RHSMWYFYSA-N	0	3	330.472	3.349	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc3nc(C)ccc3c2)[C@@H](C)C1	ZINC000943737975	1332249801	/nfs/dbraw/zinc/24/98/01/1332249801.db2.gz	JDJYDWJVJFFVSI-KXBFYZLASA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(Cl)cc2Cl)[C@@H](C)C1	ZINC000944303156	1332366863	/nfs/dbraw/zinc/36/68/63/1332366863.db2.gz	BIECOASAANWIHU-BLLLJJGKSA-N	0	3	339.266	3.457	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc(Cl)cc(Cl)c2)[C@H](C)C1	ZINC000944303327	1332366964	/nfs/dbraw/zinc/36/69/64/1332366964.db2.gz	CAEJWRAISJOKQU-ABAIWWIYSA-N	0	3	325.239	3.067	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3ccccc3C)CCC2)[C@@H](C)C1	ZINC000944444169	1332412933	/nfs/dbraw/zinc/41/29/33/1332412933.db2.gz	JRZSEOOUSGDGDJ-AZUAARDMSA-N	0	3	338.495	3.267	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)n(C(C)C)c2C)[C@H](C)C1	ZINC000944890680	1332445175	/nfs/dbraw/zinc/44/51/75/1332445175.db2.gz	MXKDPIHEMVLMCQ-DNVCBOLYSA-N	0	3	329.488	3.149	20	30		EGEDHN
CC[C@H](C)C(=O)N1CC[C@H]2CN(Cc3ccccc3C#N)C[C@H]2CC1	ZINC000946489878	1332842407	/nfs/dbraw/zinc/84/24/07/1332842407.db2.gz	IPJNJXTUBIDXAH-FFZOFVMBSA-N	0	3	339.483	3.275	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@H]3CCC(F)(F)C3)CC[C@@H]2C1	ZINC000946618143	1332864006	/nfs/dbraw/zinc/86/40/06/1332864006.db2.gz	VJUPRYBRFLELDK-SOUVJXGZSA-N	0	3	346.849	3.345	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@@H]3CCCC34CC4)CC[C@@H]2C1	ZINC000946642834	1332869761	/nfs/dbraw/zinc/86/97/61/1332869761.db2.gz	REPNNRHRKZXKOH-BBWFWOEESA-N	0	3	336.907	3.490	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)C3CCC(F)CC3)CC[C@@H]2C1	ZINC000946761700	1332894158	/nfs/dbraw/zinc/89/41/58/1332894158.db2.gz	DIGRVLMVUWXVOC-HPZPOOBXSA-N	0	3	342.886	3.438	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)C[C@H](C)n3cccc3)CC[C@@H]2C1	ZINC000946866458	1332919401	/nfs/dbraw/zinc/91/94/01/1332919401.db2.gz	HBTZUGUPUYJQQJ-OKZBNKHCSA-N	0	3	349.906	3.362	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)c2ccccc2)CCN1Cc1ccc(C#N)cc1	ZINC000947005193	1332966928	/nfs/dbraw/zinc/96/69/28/1332966928.db2.gz	LUQBMODWDYAUOW-JXFKEZNVSA-N	0	3	333.435	3.341	20	30		EGEDHN
Cc1ccncc1C(=O)N[C@@H]1CCN(Cc2ccc(C#N)cc2)[C@H](C)C1	ZINC000947163240	1333030626	/nfs/dbraw/zinc/03/06/26/1333030626.db2.gz	SOKVRWSGBUYDJO-VQIMIIECSA-N	0	3	348.450	3.045	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@@H](C)C2)co1	ZINC000947245267	1333063625	/nfs/dbraw/zinc/06/36/25/1333063625.db2.gz	ROOPOSPABRBZID-IFXJQAMLSA-N	0	3	337.423	3.243	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2coc3cc(F)ccc23)C[C@H]1C	ZINC000947293027	1333079642	/nfs/dbraw/zinc/07/96/42/1333079642.db2.gz	ZEVQKHNUAZENQS-RHSMWYFYSA-N	0	3	342.414	3.107	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2coc3c2cccc3OC)C[C@H]1C	ZINC000947314534	1333085595	/nfs/dbraw/zinc/08/55/95/1333085595.db2.gz	GUTZTHLVEGEZSB-CABCVRRESA-N	0	3	340.423	3.047	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2c(C)nn(C(C)(C)C)c2C)C[C@H]1C	ZINC000947369188	1333106860	/nfs/dbraw/zinc/10/68/60/1333106860.db2.gz	HSJSFGBIIUDWAZ-CJNGLKHVSA-N	0	3	332.492	3.024	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ncoc2-c2ccccc2)C[C@H]1C	ZINC000947371569	1333107052	/nfs/dbraw/zinc/10/70/52/1333107052.db2.gz	ZWHOTIDSSFLKOV-ZBFHGGJFSA-N	0	3	325.412	3.110	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)C2(C3CC3)CC2)CCN1Cc1ccc(C#N)cc1	ZINC000947425715	1333122406	/nfs/dbraw/zinc/12/24/06/1333122406.db2.gz	KRZIBGDVGVJDPK-DNVCBOLYSA-N	0	3	337.467	3.218	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3c(o2)c(F)ccc3C)C[C@@H]1C	ZINC000947560541	1333172977	/nfs/dbraw/zinc/17/29/77/1333172977.db2.gz	SCCVTZKHSQVHLU-LSDHHAIUSA-N	0	3	342.414	3.486	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3cc(Cl)ccc3[nH]2)C[C@@H]1C	ZINC000947606097	1333190270	/nfs/dbraw/zinc/19/02/70/1333190270.db2.gz	BNUUGFYJPMMJFW-BBRMVZONSA-N	0	3	343.858	3.427	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3cnccc3C)[C@@H](C)C2)cc1	ZINC000947610774	1333191172	/nfs/dbraw/zinc/19/11/72/1333191172.db2.gz	CLLAVIWFVFHRQE-UWJYYQICSA-N	0	3	347.462	3.154	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2c(Cl)cncc2Cl)C[C@H]1C	ZINC000947689901	1333225408	/nfs/dbraw/zinc/22/54/08/1333225408.db2.gz	NMXVFCFTBGAJSP-MNOVXSKESA-N	0	3	328.243	3.157	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C(C)C)nc2C)C[C@H]1C	ZINC000947727550	1333242448	/nfs/dbraw/zinc/24/24/48/1333242448.db2.gz	YXCNDMMFOIZGPF-WBVHZDCISA-N	0	3	327.472	3.119	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2ccc(C(C)(C)C)cc2)C[C@H]1C	ZINC000947751264	1333250948	/nfs/dbraw/zinc/25/09/48/1333250948.db2.gz	WPCMEBULZNJANV-APWZRJJASA-N	0	3	326.484	3.129	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc3[nH]c(C)c(C)c3c2)C[C@@H]1C	ZINC000948025301	1333345072	/nfs/dbraw/zinc/34/50/72/1333345072.db2.gz	GCRRCBOISTZLNW-KBXCAEBGSA-N	0	3	337.467	3.391	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2sc(C(C)C)nc2C)C[C@@H]1C	ZINC000948029366	1333346394	/nfs/dbraw/zinc/34/63/94/1333346394.db2.gz	AFHMDUIBIIMYKQ-ZFWWWQNUSA-N	0	3	333.501	3.181	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(OC3CCC3)cc2)C[C@@H]1C	ZINC000948061818	1333360267	/nfs/dbraw/zinc/36/02/67/1333360267.db2.gz	ZPFORTUSVKQVEX-WMZOPIPTSA-N	0	3	340.467	3.224	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccccc2CC(C)C)C[C@@H]1C	ZINC000948082458	1333369538	/nfs/dbraw/zinc/36/95/38/1333369538.db2.gz	DBMFVGYXEQKKDD-HKUYNNGSSA-N	0	3	326.484	3.491	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cccc(OC(C)C)c2)C[C@H]1C	ZINC000948083768	1333371007	/nfs/dbraw/zinc/37/10/07/1333371007.db2.gz	YQNINQOBQBSSSD-MJGOQNOKSA-N	0	3	342.483	3.009	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2nc(C(C)C)oc2C)CC1	ZINC000948368309	1333497070	/nfs/dbraw/zinc/49/70/70/1333497070.db2.gz	HYFINETURICOSV-MRXNPFEDSA-N	0	3	331.460	3.056	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)C2CCc3ccccc3CC2)CC1	ZINC000948565346	1333578972	/nfs/dbraw/zinc/57/89/72/1333578972.db2.gz	COQQXSJUWIFWGM-OAQYLSRUSA-N	0	3	338.495	3.128	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@@H](CC)CC(C)C)C1	ZINC001197583672	1368844522	/nfs/dbraw/zinc/84/45/22/1368844522.db2.gz	RKJPWKKARSKHBS-RCCFBDPRSA-N	0	3	326.525	3.190	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2ccc(-c3ccco3)o2)CC1	ZINC000948605046	1333593533	/nfs/dbraw/zinc/59/35/33/1333593533.db2.gz	LVCZHZHPWPXIJJ-MRXNPFEDSA-N	0	3	340.423	3.489	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)C2([C@@H]3CCCCO3)CCC2)CC1	ZINC000948612351	1333596584	/nfs/dbraw/zinc/59/65/84/1333596584.db2.gz	NLTIIIPMYRZXQH-OALUTQOASA-N	0	3	346.515	3.062	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2ccc3ncccc3c2)CC1	ZINC000948733204	1333651935	/nfs/dbraw/zinc/65/19/35/1333651935.db2.gz	JMKJKNUTRHPELR-IBGZPJMESA-N	0	3	335.451	3.185	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2ccc(C(F)F)c(F)c2)CC1	ZINC000948775339	1333673933	/nfs/dbraw/zinc/67/39/33/1333673933.db2.gz	GFPRDIMUEXDJTN-AWEZNQCLSA-N	0	3	338.373	3.323	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cc[nH]c2C2CCC2)CC1	ZINC000948775667	1333674237	/nfs/dbraw/zinc/67/42/37/1333674237.db2.gz	NZBBKFKLCNCVLD-KRWDZBQOSA-N	0	3	327.472	3.232	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2cc3cc(F)ccc3o2)CC1	ZINC000948816724	1333695652	/nfs/dbraw/zinc/69/56/52/1333695652.db2.gz	MIJWXEDGWXYQSD-INIZCTEOSA-N	0	3	328.387	3.132	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2)CC1	ZINC000948845906	1333707466	/nfs/dbraw/zinc/70/74/66/1333707466.db2.gz	YNPOPNGAVVZKEZ-CEXWTWQISA-N	0	3	344.886	3.390	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@@H]1CNC(=O)c1ccncc1C	ZINC000948912557	1333731242	/nfs/dbraw/zinc/73/12/42/1333731242.db2.gz	HGSFLXIBJADHJO-FQEVSTJZSA-N	0	3	335.451	3.295	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@H]1CNC(=O)[C@H]1CC1(F)F	ZINC000948915934	1333732253	/nfs/dbraw/zinc/73/22/53/1333732253.db2.gz	IJFANEMWQFUZJL-IAGOWNOFSA-N	0	3	334.410	3.323	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2CCN(CC(CC)CC)CC2)cc1	ZINC000948918976	1333733549	/nfs/dbraw/zinc/73/35/49/1333733549.db2.gz	MJWICTPRVBTIPG-UHFFFAOYSA-N	0	3	330.472	3.445	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@H]1CNC(=O)c1cccnc1C	ZINC000948955185	1333747032	/nfs/dbraw/zinc/74/70/32/1333747032.db2.gz	UBKMZNWEUVZZMR-HXUWFJFHSA-N	0	3	335.451	3.295	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1(C)CCCCCC1)CCO2	ZINC000949114597	1333779552	/nfs/dbraw/zinc/77/95/52/1333779552.db2.gz	DALXXQSYYPPVMB-UHFFFAOYSA-N	0	3	334.504	3.226	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)CC1(C)CCCCC1)CCO2	ZINC000949135286	1333783229	/nfs/dbraw/zinc/78/32/29/1333783229.db2.gz	IVEFCKVYGVEKPW-UHFFFAOYSA-N	0	3	334.504	3.226	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1c(C)cccc1Cl)CCO2	ZINC000949179780	1333789977	/nfs/dbraw/zinc/78/99/77/1333789977.db2.gz	NLUKQBVNWNLPTH-UHFFFAOYSA-N	0	3	348.874	3.141	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C(C)(C)C1CCCCC1)CCO2	ZINC000949207036	1333796116	/nfs/dbraw/zinc/79/61/16/1333796116.db2.gz	HXGJZSDITGVTQC-UHFFFAOYSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@H]1CCCC[C@@H]1C)CCO2	ZINC000949253868	1333804493	/nfs/dbraw/zinc/80/44/93/1333804493.db2.gz	OYORILXLNNNYOD-ZWKOTPCHSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1CCCC(C)(C)C1)CCO2	ZINC000949253950	1333804830	/nfs/dbraw/zinc/80/48/30/1333804830.db2.gz	RSYJWLCWAHZVLJ-KRWDZBQOSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)c3ccc(C)s3)CC2)C1	ZINC000949282624	1333814984	/nfs/dbraw/zinc/81/49/84/1333814984.db2.gz	PYJBDERISJYMQP-UHFFFAOYSA-N	0	3	348.512	3.330	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@H]3CCC[C@@H]3CC)CC2)C1	ZINC000949466841	1333855612	/nfs/dbraw/zinc/85/56/12/1333855612.db2.gz	UMJDQDSSZWFNDE-ROUUACIJSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C[C@H](C)C3CC3)CC2)C1	ZINC000949532041	1333869410	/nfs/dbraw/zinc/86/94/10/1333869410.db2.gz	VWKBFRMFCIFLCH-KRWDZBQOSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N(CC)C1CN(CC2CCCCCC2)C1	ZINC000950353435	1334048165	/nfs/dbraw/zinc/04/81/65/1334048165.db2.gz	WUCBUDVUYXMCJV-UXHICEINSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2cn(C)c3ccccc23)C1	ZINC000967272353	1335681991	/nfs/dbraw/zinc/68/19/91/1335681991.db2.gz	BBSYRLISYYKICY-CRAIPNDOSA-N	0	3	325.456	3.195	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)Cc2ccc(CC(C)C)cc2)C1	ZINC000967274682	1335684063	/nfs/dbraw/zinc/68/40/63/1335684063.db2.gz	RQYIJDJBQRCOIV-RXVVDRJESA-N	0	3	340.511	3.278	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2ccc(C)c3cccnc23)C1	ZINC000967410068	1335729511	/nfs/dbraw/zinc/72/95/11/1335729511.db2.gz	YFQAJHUAPGEVBY-QFBILLFUSA-N	0	3	335.451	3.007	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2c(F)cc(F)cc2F)C1	ZINC000968076294	1335853507	/nfs/dbraw/zinc/85/35/07/1335853507.db2.gz	CVAZDVXMOSIEDE-XHDPSFHLSA-N	0	3	326.362	3.120	20	30		EGEDHN
Cc1cscc1C(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC000968346880	1335897007	/nfs/dbraw/zinc/89/70/07/1335897007.db2.gz	KGWKBXJYAZBFRD-OAHLLOKOSA-N	0	3	343.427	3.072	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](C)[C@@H](NC(=O)c2scnc2C2CC2)C1	ZINC000968399655	1335919691	/nfs/dbraw/zinc/91/96/91/1335919691.db2.gz	GUHXUTIVZCEPRG-HIFRSBDPSA-N	0	3	333.501	3.427	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cnc(-c3ccoc3)s2)C1	ZINC000968400155	1335920130	/nfs/dbraw/zinc/92/01/30/1335920130.db2.gz	MVYACYWCPJCNAI-HIFRSBDPSA-N	0	3	345.468	3.419	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(C(=O)C(F)=C3CCCC3)C2)s1	ZINC000968403854	1335921967	/nfs/dbraw/zinc/92/19/67/1335921967.db2.gz	YFHQKFOZIHCHCC-CYBMUJFWSA-N	0	3	333.432	3.108	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(C(F)F)cc2F)C1	ZINC000968459084	1335931684	/nfs/dbraw/zinc/93/16/84/1335931684.db2.gz	IZALJTDSPDCDRI-WBMJQRKESA-N	0	3	338.373	3.227	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2[nH]c3ccc(C)cc3c2C)C1	ZINC000968488766	1335938652	/nfs/dbraw/zinc/93/86/52/1335938652.db2.gz	LSDXBAWPJOTHEM-DNVCBOLYSA-N	0	3	337.467	3.248	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2cccc(-c3cnco3)c2)C1	ZINC000968492535	1335940884	/nfs/dbraw/zinc/94/08/84/1335940884.db2.gz	JMSNKCLNNXTOJK-CRAIPNDOSA-N	0	3	339.439	3.358	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2ccc(-c3c[nH]cn3)cc2)C1	ZINC000968500832	1335943232	/nfs/dbraw/zinc/94/32/32/1335943232.db2.gz	KGVZMZIFDUHKST-DNVCBOLYSA-N	0	3	338.455	3.093	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccoc2Br)C1	ZINC000968503891	1335944742	/nfs/dbraw/zinc/94/47/42/1335944742.db2.gz	CAFBUHNQPXDRHH-AAEUAGOBSA-N	0	3	341.249	3.058	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)C(C)(C)c2ccc(CC)cc2)C1	ZINC000968520488	1335952279	/nfs/dbraw/zinc/95/22/79/1335952279.db2.gz	JPHDPGOEQAVFNS-PXNSSMCTSA-N	0	3	340.511	3.377	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)C(C)(C)c2ccc(CC)cc2)C1	ZINC000968520489	1335952295	/nfs/dbraw/zinc/95/22/95/1335952295.db2.gz	JPHDPGOEQAVFNS-XLIONFOSSA-N	0	3	340.511	3.377	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC000968579809	1335970146	/nfs/dbraw/zinc/97/01/46/1335970146.db2.gz	QKSCBSWUSYOBHP-CZUORRHYSA-N	0	3	338.373	3.169	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2cc(Cl)cc(Cl)c2)C1	ZINC000968583924	1335973608	/nfs/dbraw/zinc/97/36/08/1335973608.db2.gz	RBXHVLRUOLHUHF-MLGOLLRUSA-N	0	3	339.266	3.457	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)C2(c3ccccc3C)CCC2)C1	ZINC000968592161	1335975936	/nfs/dbraw/zinc/97/59/36/1335975936.db2.gz	LHOBPBYMUNDTCG-QUCCMNQESA-N	0	3	338.495	3.267	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2coc3ccc(F)cc23)C1	ZINC000968597208	1335977904	/nfs/dbraw/zinc/97/79/04/1335977904.db2.gz	UGKKLMDVFRVQEN-SUMWQHHRSA-N	0	3	328.387	3.035	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)[C@@]2(c3ccccc3)C[C@H](F)C2)C1	ZINC000968598487	1335978943	/nfs/dbraw/zinc/97/89/43/1335978943.db2.gz	GNHPQKKLJHPOAV-WBKMXMRLSA-N	0	3	344.474	3.459	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2ccc(OCC)c(OC)c2)C1	ZINC000968635117	1335991254	/nfs/dbraw/zinc/99/12/54/1335991254.db2.gz	FUBXQYCZQDPFIA-NVXWUHKLSA-N	0	3	346.471	3.110	20	30		EGEDHN
Cc1c(F)cccc1C(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C1	ZINC000968755349	1336039938	/nfs/dbraw/zinc/03/99/38/1336039938.db2.gz	MFNDZFVXMUMBCT-CYBMUJFWSA-N	0	3	343.427	3.072	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cn(C(C)(C)C)nc1C	ZINC000968856715	1336069480	/nfs/dbraw/zinc/06/94/80/1336069480.db2.gz	NFURIDKNPFVFRJ-INIZCTEOSA-N	0	3	332.492	3.107	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cncn1-c1ccccc1	ZINC000968890276	1336081266	/nfs/dbraw/zinc/08/12/66/1336081266.db2.gz	FUZWYEJKNPUOFT-GOSISDBHSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)[C@H]1CCN(c2ccccc2)C1	ZINC000968914633	1336087521	/nfs/dbraw/zinc/08/75/21/1336087521.db2.gz	YDEBHBQFRJFHMN-ICSRJNTNSA-N	0	3	341.499	3.060	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000968914634	1336087567	/nfs/dbraw/zinc/08/75/67/1336087567.db2.gz	YDEBHBQFRJFHMN-QUCCMNQESA-N	0	3	341.499	3.060	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccncc1OC(C)C	ZINC000968965514	1336104262	/nfs/dbraw/zinc/10/42/62/1336104262.db2.gz	RBCZMWRWAXYKQZ-INIZCTEOSA-N	0	3	331.460	3.029	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cc(F)c(F)cc1F	ZINC000969007952	1336116490	/nfs/dbraw/zinc/11/64/90/1336116490.db2.gz	JPDMXMJUOAUCRA-GFCCVEGCSA-N	0	3	326.362	3.264	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccc(F)c(F)c1F	ZINC000969008202	1336116749	/nfs/dbraw/zinc/11/67/49/1336116749.db2.gz	OEXWQJDLWZHRQR-LBPRGKRZSA-N	0	3	326.362	3.264	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)NC[C@@H]1CCCCCN1Cc1ccc(C#N)cc1	ZINC000969039411	1336123291	/nfs/dbraw/zinc/12/32/91/1336123291.db2.gz	KPDQNGGIEBVLOG-HSALFYBXSA-N	0	3	339.483	3.465	20	30		EGEDHN
N#Cc1cccc(CN2CCCCC[C@H]2CNC(=O)[C@@H]2CC23CC3)c1	ZINC000969044488	1336125452	/nfs/dbraw/zinc/12/54/52/1336125452.db2.gz	RAJAAVYVSLRENK-OALUTQOASA-N	0	3	337.467	3.219	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccc(C)nc1OCCC	ZINC000969090792	1336139456	/nfs/dbraw/zinc/13/94/56/1336139456.db2.gz	KPIUKPOWIRMXEY-QGZVFWFLSA-N	0	3	345.487	3.339	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1coc(CC2CC2)n1	ZINC000969097564	1336141938	/nfs/dbraw/zinc/14/19/38/1336141938.db2.gz	NIVFKFWWYNMWDT-INIZCTEOSA-N	0	3	331.460	3.178	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccncc1C(F)(F)F	ZINC000969101265	1336143679	/nfs/dbraw/zinc/14/36/79/1336143679.db2.gz	WPHWCIXMPJMNTP-ZDUSSCGKSA-N	0	3	341.377	3.261	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cnn(CCC)c1C1CC1	ZINC000969108471	1336146609	/nfs/dbraw/zinc/14/66/09/1336146609.db2.gz	CHQYAFWOXSKDCU-QGZVFWFLSA-N	0	3	344.503	3.331	20	30		EGEDHN
C#CCCN1CCCCC[C@H]1CNC(=O)c1cnc(C(C)(C)C)s1	ZINC000969158584	1336166730	/nfs/dbraw/zinc/16/67/30/1336166730.db2.gz	OZOUQCDFPXULQA-HNNXBMFYSA-N	0	3	347.528	3.438	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(C(=O)C[C@H]3CC=CCC3)C2)s1	ZINC000969598985	1336226856	/nfs/dbraw/zinc/22/68/56/1336226856.db2.gz	ZFJVTWHLYOTVKD-LSDHHAIUSA-N	0	3	329.469	3.057	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](C)C2CN(CCc3scnc3C)C2)CC1	ZINC000970375263	1336300062	/nfs/dbraw/zinc/30/00/62/1336300062.db2.gz	COTSXSAGZAZOLI-CQSZACIVSA-N	0	3	347.528	3.177	20	30		EGEDHN
C#CCCN1CC([C@@H](C)NC(=O)[C@@H]2C[C@H]2c2ccc3ccccc3c2)C1	ZINC000970594807	1336325699	/nfs/dbraw/zinc/32/56/99/1336325699.db2.gz	YABCZABQAQCNIP-URZJWIJPSA-N	0	3	346.474	3.403	20	30		EGEDHN
C[C@H](C(=O)N(C)C1CCN(Cc2ccc(C#N)cc2)CC1)C1CCC1	ZINC001005567714	1336372397	/nfs/dbraw/zinc/37/23/97/1336372397.db2.gz	CPWVBGAWQNVOCG-INIZCTEOSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2sc(C)nc2CC(C)C)CC1	ZINC001005669479	1336390054	/nfs/dbraw/zinc/39/00/54/1336390054.db2.gz	BACCJFDXHGLTBR-UHFFFAOYSA-N	0	3	335.517	3.372	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)Cc2c(C)[nH]c3ccccc32)CC1	ZINC001005917876	1336421510	/nfs/dbraw/zinc/42/15/10/1336421510.db2.gz	LZTSSFRGGDISAJ-UHFFFAOYSA-N	0	3	325.456	3.128	20	30		EGEDHN
C[C@H]1CC[C@@H](C(=O)N(C)C2CCN(Cc3ccc(C#N)cc3)CC2)C1	ZINC001006082072	1336448693	/nfs/dbraw/zinc/44/86/93/1336448693.db2.gz	JXALLSMNSKBIKR-QFBILLFUSA-N	0	3	339.483	3.417	20	30		EGEDHN
C#CCCN1CCC(N(C)C(=O)c2cc(C(CC)CC)no2)CC1	ZINC001006103990	1336452914	/nfs/dbraw/zinc/45/29/14/1336452914.db2.gz	LLMOWVPYRHPUBA-UHFFFAOYSA-N	0	3	331.460	3.138	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2c[nH]nc2-c2ccsc2)CC1	ZINC001006203116	1336466428	/nfs/dbraw/zinc/46/64/28/1336466428.db2.gz	WVNLUKRZCQFDNL-UHFFFAOYSA-N	0	3	344.484	3.251	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cnc3ccc(F)cc3c2)CC1	ZINC001006251395	1336477167	/nfs/dbraw/zinc/47/71/67/1336477167.db2.gz	KBGXCJXTNQZFML-UHFFFAOYSA-N	0	3	327.403	3.096	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)Cc2cccc(OCCC)c2)CC1	ZINC001006259801	1336478202	/nfs/dbraw/zinc/47/82/02/1336478202.db2.gz	POSPJHKLBPIIED-UHFFFAOYSA-N	0	3	330.472	3.127	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cnn(CCC)c2C2CC2)CC1	ZINC001006268450	1336478930	/nfs/dbraw/zinc/47/89/30/1336478930.db2.gz	XPMHDWUIJSWPJU-UHFFFAOYSA-N	0	3	344.503	3.283	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2coc(-c3ccccc3)n2)CC1	ZINC001006305810	1336486973	/nfs/dbraw/zinc/48/69/73/1336486973.db2.gz	JQENJFUFXLWPKK-UHFFFAOYSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2ccccc2C(F)(F)F)CC1	ZINC001006324944	1336489328	/nfs/dbraw/zinc/48/93/28/1336489328.db2.gz	DHWDNFNHMVRLOU-UHFFFAOYSA-N	0	3	326.362	3.428	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)C[C@@H]2C[C@H]2Cc2ccccc2)C1	ZINC001008036408	1336754860	/nfs/dbraw/zinc/75/48/60/1336754860.db2.gz	HYIAVDUKKCHOMA-HSALFYBXSA-N	0	3	326.484	3.412	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCN(CCc3ccccc3)C2)cc1	ZINC001008150350	1336780408	/nfs/dbraw/zinc/78/04/08/1336780408.db2.gz	UCCIJWUHBLAGPD-NRFANRHFSA-N	0	3	332.447	3.105	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H](NC(=O)c2c(F)ccc(F)c2OC)C1	ZINC001008158935	1336782109	/nfs/dbraw/zinc/78/21/09/1336782109.db2.gz	QJUNWRMANCPUJX-CYBMUJFWSA-N	0	3	338.398	3.134	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2oc3ccccc3c2OC)C1	ZINC001008169438	1336783925	/nfs/dbraw/zinc/78/39/25/1336783925.db2.gz	MAKTYRXXTULKKB-AWEZNQCLSA-N	0	3	328.412	3.212	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N[C@H]1CCCN(Cc2cccc(C)c2)C1	ZINC001008848190	1336933061	/nfs/dbraw/zinc/93/30/61/1336933061.db2.gz	XCXHVVGNBKFOSD-UFYCRDLUSA-N	0	3	342.483	3.057	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H](NC(=O)c2ccoc2Br)C1	ZINC001009102278	1336969730	/nfs/dbraw/zinc/96/97/30/1336969730.db2.gz	HVXZHILKEFHESK-GFCCVEGCSA-N	0	3	341.249	3.203	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@@H]1CCCN(CC2=CCCCC2)C1	ZINC001009350520	1337009377	/nfs/dbraw/zinc/00/93/77/1337009377.db2.gz	FHHDXFKFGMXJGJ-OAQYLSRUSA-N	0	3	336.479	3.291	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@@H]1CCCN(Cc2ccccc2C)C1	ZINC001009356911	1337010974	/nfs/dbraw/zinc/01/09/74/1337010974.db2.gz	ZXZATRPATANPBI-JOCHJYFZSA-N	0	3	346.474	3.300	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(Cc3cc(C)ccc3C)C2)cc1	ZINC001015477973	1338153979	/nfs/dbraw/zinc/15/39/79/1338153979.db2.gz	UFDULRTYRDBJBQ-OAQYLSRUSA-N	0	3	332.447	3.289	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(CCCc3cccc(F)c3)C2)C1	ZINC001015675697	1338252553	/nfs/dbraw/zinc/25/25/53/1338252553.db2.gz	CNYOEIKZUFDKGT-SFHVURJKSA-N	0	3	330.447	3.305	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H]1CCN(Cc2ccccc2C(C)C)C1	ZINC001015725903	1338274165	/nfs/dbraw/zinc/27/41/65/1338274165.db2.gz	FGDQEGIHFRCKCN-RLLQIKCJSA-N	0	3	342.483	3.092	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](NC(=O)c2cnc(-c3ccoc3)s2)C1	ZINC001015805796	1338318621	/nfs/dbraw/zinc/31/86/21/1338318621.db2.gz	LCFHRMGZGGRFMI-CQSZACIVSA-N	0	3	331.441	3.173	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@H]2CCN(CC3=CCCCC3)C2)cc1	ZINC001015809482	1338321798	/nfs/dbraw/zinc/32/17/98/1338321798.db2.gz	OXSKIRNFVOUTPZ-IBGZPJMESA-N	0	3	338.451	3.003	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@@H]1CCN(Cc2cc(C)cc(C)c2)C1	ZINC001016108756	1338465892	/nfs/dbraw/zinc/46/58/92/1338465892.db2.gz	WPOJFFFNQPKHSP-JOCHJYFZSA-N	0	3	346.474	3.218	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cc3ccccc3nc2C)CC1	ZINC001016651513	1338679300	/nfs/dbraw/zinc/67/93/00/1338679300.db2.gz	IPVPEOGMZPCNNS-FQEVSTJZSA-N	0	3	347.462	3.151	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cc(F)cc3ccoc32)CC1	ZINC001016698220	1338694944	/nfs/dbraw/zinc/69/49/44/1338694944.db2.gz	KAZZRDYQYFLCFM-QGZVFWFLSA-N	0	3	340.398	3.180	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cc(Cl)ccc2F)CC1	ZINC001016719881	1338701962	/nfs/dbraw/zinc/70/19/62/1338701962.db2.gz	TVYUSZYRYZCSRN-INIZCTEOSA-N	0	3	334.822	3.087	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cnc3ccccc3c2C)CC1	ZINC001016732835	1338706083	/nfs/dbraw/zinc/70/60/83/1338706083.db2.gz	DFWNYLDPCVDADS-HXUWFJFHSA-N	0	3	347.462	3.151	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)Cc2cccc(C3CC3)c2)CC1	ZINC001016744501	1338709827	/nfs/dbraw/zinc/70/98/27/1338709827.db2.gz	HKCAUXSWUGXQQR-FQEVSTJZSA-N	0	3	336.479	3.101	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccc(C)c(Cl)c2)CC1	ZINC001016805316	1338732028	/nfs/dbraw/zinc/73/20/28/1338732028.db2.gz	WBMXVINFXVQORO-QGZVFWFLSA-N	0	3	330.859	3.256	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(Cl)c(C)c2)CC1	ZINC001016806166	1338732806	/nfs/dbraw/zinc/73/28/06/1338732806.db2.gz	HFYZDVZASKTOSN-KRWDZBQOSA-N	0	3	330.859	3.256	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccccc2-n2cccc2)CC1	ZINC001016808909	1338733580	/nfs/dbraw/zinc/73/35/80/1338733580.db2.gz	SRGKIGGJJZXCHX-FQEVSTJZSA-N	0	3	347.462	3.085	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)C(C)(C)c2cccc(F)c2)CC1	ZINC001016820872	1338738046	/nfs/dbraw/zinc/73/80/46/1338738046.db2.gz	VWUWRMRIBHITKT-SFHVURJKSA-N	0	3	342.458	3.097	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)Cc2ccc(C(C)(C)C)cc2)CC1	ZINC001016843971	1338744383	/nfs/dbraw/zinc/74/43/83/1338744383.db2.gz	SZDNJMXBYZZXTE-LJQANCHMSA-N	0	3	338.495	3.131	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)[C@@H]2C[C@H]2c2ccccc2C)CC1	ZINC001016874061	1338755162	/nfs/dbraw/zinc/75/51/62/1338755162.db2.gz	SVFNGXWBTWHSQA-XUVXKRRUSA-N	0	3	336.479	3.093	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccc(C(F)F)cc2)CC1	ZINC001016877790	1338756695	/nfs/dbraw/zinc/75/66/95/1338756695.db2.gz	OWCWYPGORXWTCV-MRXNPFEDSA-N	0	3	332.394	3.232	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)C2(C3CCCCC3)CC2)CC1	ZINC001016946262	1338780281	/nfs/dbraw/zinc/78/02/81/1338780281.db2.gz	ANNDUZACJJBZCB-GOSISDBHSA-N	0	3	328.500	3.341	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2c(CC)oc3ccccc32)CC1	ZINC001016988959	1338794986	/nfs/dbraw/zinc/79/49/86/1338794986.db2.gz	JVLRWLLDQUGASK-GOSISDBHSA-N	0	3	336.435	3.213	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)[C@@H]2CCCCc3ccccc32)CC1	ZINC001016990939	1338796053	/nfs/dbraw/zinc/79/60/53/1338796053.db2.gz	WCWBBYAXUZJPEA-WOJBJXKFSA-N	0	3	336.479	3.101	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccc(CC)c(CC)c2)CC1	ZINC001017005317	1338801347	/nfs/dbraw/zinc/80/13/47/1338801347.db2.gz	WVZJVENIZSBKJX-HXUWFJFHSA-N	0	3	338.495	3.419	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCCN(C(=O)/C=C/C2CC2)C1	ZINC001017089876	1338858515	/nfs/dbraw/zinc/85/85/15/1338858515.db2.gz	YRTWZGODNOIHIC-YXMGTMDOSA-N	0	3	343.496	3.256	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](CN(C)Cc2scnc2C)C1	ZINC001017179572	1338922533	/nfs/dbraw/zinc/92/25/33/1338922533.db2.gz	KROFIYLLMGFDQY-OAHLLOKOSA-N	0	3	335.517	3.334	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](CN(C)Cc2ccc(F)cn2)C1	ZINC001017179117	1338923254	/nfs/dbraw/zinc/92/32/54/1338923254.db2.gz	DKQLOXBRRXPLCA-HNNXBMFYSA-N	0	3	333.451	3.103	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)Oc1cccc(F)c1	ZINC001017578777	1339371222	/nfs/dbraw/zinc/37/12/22/1339371222.db2.gz	WBAGNXILMKYWCE-RYQLBKOJSA-N	0	3	346.446	3.234	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cc(C2CC2)nn1CC	ZINC001017644505	1339381078	/nfs/dbraw/zinc/38/10/78/1339381078.db2.gz	ISJOFHXVJKLGFO-CALCHBBNSA-N	0	3	342.487	3.035	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H](C)c1ccncc1	ZINC001017654146	1339383853	/nfs/dbraw/zinc/38/38/53/1339383853.db2.gz	ASFBOKPNOGUAML-QRQLOZEOSA-N	0	3	327.472	3.217	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(C)c(OC)c1	ZINC001017719026	1339400416	/nfs/dbraw/zinc/40/04/16/1339400416.db2.gz	KIASUWSYSMWODB-HDICACEKSA-N	0	3	328.456	3.259	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](c1ccncc1)C(C)C	ZINC001017851922	1339430835	/nfs/dbraw/zinc/43/08/35/1339430835.db2.gz	UVJJYBPFNJHVBW-CEXWTWQISA-N	0	3	327.472	3.073	20	30		EGEDHN
N#Cc1cc(CN[C@H]2CCN(C(=O)CC3=CCCCC3)C2)ccc1F	ZINC001018621798	1339684479	/nfs/dbraw/zinc/68/44/79/1339684479.db2.gz	MHOCJVZZTYYERG-SFHVURJKSA-N	0	3	341.430	3.278	20	30		EGEDHN
CC(C(=O)N1CC[C@H](NCc2ccc(F)c(C#N)c2)C1)=C1CCCC1	ZINC001018699081	1339704753	/nfs/dbraw/zinc/70/47/53/1339704753.db2.gz	HYBNJYKOBRPFKU-SFHVURJKSA-N	0	3	341.430	3.278	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1c(F)ccc(F)c1Cl	ZINC001028156878	1340457460	/nfs/dbraw/zinc/45/74/60/1340457460.db2.gz	UZNLPLMYAIUVJN-NSHDSACASA-N	0	3	328.790	3.389	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1ncoc1-c1cccs1	ZINC001028208855	1340485760	/nfs/dbraw/zinc/48/57/60/1340485760.db2.gz	XIMFYLUKNHAVJW-CYBMUJFWSA-N	0	3	331.441	3.173	20	30		EGEDHN
C#CCCN1CCC[C@H]1CNC(=O)c1ccc(Cl)cc1Cl	ZINC001028280133	1340533840	/nfs/dbraw/zinc/53/38/40/1340533840.db2.gz	GRJCKBMQCIUQBU-ZDUSSCGKSA-N	0	3	325.239	3.211	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1ccc(N(CC)CC)cc1	ZINC001028282999	1340537841	/nfs/dbraw/zinc/53/78/41/1340537841.db2.gz	SOPCZGZZRBBLIH-IBGZPJMESA-N	0	3	329.488	3.303	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](CNC(=O)C3=CCCCCC3)C2)cc1	ZINC001028502182	1340674805	/nfs/dbraw/zinc/67/48/05/1340674805.db2.gz	RSOXDXUCQINBHM-IBGZPJMESA-N	0	3	337.467	3.387	20	30		EGEDHN
Cc1coc(C)c1C(=O)NC[C@@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC001028515670	1340681634	/nfs/dbraw/zinc/68/16/34/1340681634.db2.gz	LIPKPSOOIXGMRN-SFHVURJKSA-N	0	3	337.423	3.020	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@H]2CCN(Cc3ccc(C#N)cc3)C2)c(C)c1	ZINC001028965742	1340895354	/nfs/dbraw/zinc/89/53/54/1340895354.db2.gz	NBBTYQTXGCQIDM-HXUWFJFHSA-N	0	3	347.462	3.427	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC([C@H](C)NCc2ncc(C)s2)CC1	ZINC001029124717	1340935921	/nfs/dbraw/zinc/93/59/21/1340935921.db2.gz	BHIPKIFVFXGVDE-AWEZNQCLSA-N	0	3	335.517	3.380	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC([C@H](C)NCc2cc(C)n(C)n2)CC1	ZINC001029124983	1340935953	/nfs/dbraw/zinc/93/59/53/1340935953.db2.gz	PJJMAQSLPOJOPS-INIZCTEOSA-N	0	3	346.519	3.048	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC([C@@H](C)NCc2ocnc2C)CC1	ZINC001029139281	1340940514	/nfs/dbraw/zinc/94/05/14/1340940514.db2.gz	BUSCNBKKGXNWRS-KUHUBIRLSA-N	0	3	333.476	3.302	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H]3CC[C@@H](C2)N3CC2CC(OCC)C2)CC1	ZINC001029457214	1340994645	/nfs/dbraw/zinc/99/46/45/1340994645.db2.gz	IHJMOWHTZVJEMF-JUNHRQJPSA-N	0	3	346.515	3.223	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCN(C(=O)C[C@@H]2C=CCC2)C1	ZINC001029642213	1341030924	/nfs/dbraw/zinc/03/09/24/1341030924.db2.gz	YGRAQUIZTZVSSV-HZPDHXFCSA-N	0	3	343.496	3.256	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCN(C(=O)[C@H]2CC=CCC2)C1	ZINC001029644784	1341031505	/nfs/dbraw/zinc/03/15/05/1341031505.db2.gz	DXNNPQLEHJMFPV-CVEARBPZSA-N	0	3	343.496	3.256	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](CN(C)Cc2ccc(F)cn2)C1	ZINC001029798371	1341076680	/nfs/dbraw/zinc/07/66/80/1341076680.db2.gz	JQXZWBNPPTVRCO-HNNXBMFYSA-N	0	3	333.451	3.103	20	30		EGEDHN
C=C[C@@H](C(=O)N1CC[C@H](CN(C)Cc2ccccn2)C1)c1ccccc1	ZINC001029907957	1341112485	/nfs/dbraw/zinc/11/24/85/1341112485.db2.gz	WJQIXZDPLIFHFJ-WIYYLYMNSA-N	0	3	349.478	3.332	20	30		EGEDHN
C[C@H](CC(=O)N1CC[C@H](CN(C)Cc2ccc(C#N)s2)C1)C1CC1	ZINC001029911878	1341114431	/nfs/dbraw/zinc/11/44/31/1341114431.db2.gz	SOIYLZSUZXCPHJ-HUUCEWRRSA-N	0	3	345.512	3.336	20	30		EGEDHN
C#Cc1ccc(C(=O)N(Cc2ccccc2)[C@@H]2CCCN(CC)C2)nc1	ZINC001029920814	1341120189	/nfs/dbraw/zinc/12/01/89/1341120189.db2.gz	LXMIYCXZYNMIEA-HXUWFJFHSA-N	0	3	347.462	3.190	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)CC1CCN(C(=O)C(C)(C)C)CC1	ZINC001030011108	1341157437	/nfs/dbraw/zinc/15/74/37/1341157437.db2.gz	YNWZOHIPYWDDPI-UHFFFAOYSA-N	0	3	333.501	3.336	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H](CC)Oc1ccccc1C	ZINC001032657384	1341572348	/nfs/dbraw/zinc/57/23/48/1341572348.db2.gz	JVAUVFKSZDFQKN-GBESFXJTSA-N	0	3	342.483	3.404	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H](CC)Cc1cccc(C)c1	ZINC001032667108	1341576334	/nfs/dbraw/zinc/57/63/34/1341576334.db2.gz	SQFZNOXHQFDWEP-UFYCRDLUSA-N	0	3	326.484	3.425	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H](C)c1cccc(OC)c1	ZINC001032803916	1341619560	/nfs/dbraw/zinc/61/95/60/1341619560.db2.gz	QFAXOOOQNWOBAN-NJAFHUGGSA-N	0	3	328.456	3.050	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)[C@@H]2CC[C@H](c3ccccc3)O2)C1	ZINC001033089241	1341719685	/nfs/dbraw/zinc/71/96/85/1341719685.db2.gz	ZHOLIAGGHCIEEI-QRVBRYPASA-N	0	3	328.456	3.016	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2ncoc2-c2ccccc2)C1	ZINC001033126667	1341734061	/nfs/dbraw/zinc/73/40/61/1341734061.db2.gz	OACSNAGENBCXSG-MRXNPFEDSA-N	0	3	325.412	3.064	20	30		EGEDHN
C=CCCN1CC[C@H](N(C)C(=O)c2oc3ccccc3c2OC)C1	ZINC001033319854	1341780000	/nfs/dbraw/zinc/78/00/00/1341780000.db2.gz	GMKSMOQPUAPPFZ-AWEZNQCLSA-N	0	3	328.412	3.164	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3N(C)C)C2)C1	ZINC001033399301	1341813504	/nfs/dbraw/zinc/81/35/04/1341813504.db2.gz	OGEVGNURXDJEJC-GOSISDBHSA-N	0	3	341.499	3.142	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)Cc2cccc(OCCC)c2)C1	ZINC001033562578	1341874199	/nfs/dbraw/zinc/87/41/99/1341874199.db2.gz	OMENLBAFOOTNLT-SFHVURJKSA-N	0	3	330.472	3.127	20	30		EGEDHN
C#CCCN1CC[C@@H](N(C)C(=O)CC23CC4CC(CC(C4)C2)C3)C1	ZINC001033611792	1341901927	/nfs/dbraw/zinc/90/19/27/1341901927.db2.gz	FHUJCSJBDOOPSP-VJJCQHNBSA-N	0	3	328.500	3.149	20	30		EGEDHN
C=C(C)CCN1CC[C@H](N(C)C(=O)c2cnc(CC(C)C)s2)C1	ZINC001033699940	1341966572	/nfs/dbraw/zinc/96/65/72/1341966572.db2.gz	NWUXTJDNACOCFT-HNNXBMFYSA-N	0	3	335.517	3.454	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2cccc3c2OCC3(C)C)C1	ZINC001033717852	1341974943	/nfs/dbraw/zinc/97/49/43/1341974943.db2.gz	GMPOEAPBDIMMOH-OAHLLOKOSA-N	0	3	328.456	3.079	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccc3cc(C)cn3c2)C1	ZINC001033852938	1342044501	/nfs/dbraw/zinc/04/45/01/1342044501.db2.gz	OYXXWJOKFXFQTC-LJQANCHMSA-N	0	3	325.456	3.360	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2[nH]c3ccccc3c2Cl)C1	ZINC001033887314	1342060893	/nfs/dbraw/zinc/06/08/93/1342060893.db2.gz	HZLIOCYXBRYISO-AWEZNQCLSA-N	0	3	343.858	3.381	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2[nH]c3ccccc3c2Cl)C1	ZINC001033887316	1342060912	/nfs/dbraw/zinc/06/09/12/1342060912.db2.gz	HZLIOCYXBRYISO-CQSZACIVSA-N	0	3	343.858	3.381	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccc3c(c2)C(C)(C)CO3)C1	ZINC001033897453	1342069926	/nfs/dbraw/zinc/06/99/26/1342069926.db2.gz	NWTMVQCZHGFZDM-QGZVFWFLSA-N	0	3	342.483	3.469	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2ccc(C(F)F)c(F)c2)C1	ZINC001033951741	1342109876	/nfs/dbraw/zinc/10/98/76/1342109876.db2.gz	KNRULQLGCHMKJT-AWEZNQCLSA-N	0	3	338.373	3.323	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2cnn(C(CC)CC)c2C)C1	ZINC001034017072	1342153853	/nfs/dbraw/zinc/15/38/53/1342153853.db2.gz	PIUQEXRIMKNSPR-SFHVURJKSA-N	0	3	344.503	3.112	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2cc(C)nc3ccccc32)C1	ZINC001034032108	1342171086	/nfs/dbraw/zinc/17/10/86/1342171086.db2.gz	LWACFOYMAINRIF-KRWDZBQOSA-N	0	3	335.451	3.103	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cc(F)cc4ccoc43)[C@@H]2C1	ZINC001075972057	1356459684	/nfs/dbraw/zinc/45/96/84/1356459684.db2.gz	RFPWAIMJDYQQMR-WMLDXEAASA-N	0	3	328.387	3.294	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2cc(-c3cccs3)on2)C1	ZINC001034334789	1342409382	/nfs/dbraw/zinc/40/93/82/1342409382.db2.gz	SAWFQTYJLBAPBD-CQSZACIVSA-N	0	3	343.452	3.011	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cncc3sccc32)C1	ZINC001034362096	1342432984	/nfs/dbraw/zinc/43/29/84/1342432984.db2.gz	YNMDXHFEHCMTIU-AWEZNQCLSA-N	0	3	329.469	3.457	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2ccccc2O[C@H](C)CC)C1	ZINC001034420537	1342482244	/nfs/dbraw/zinc/48/22/44/1342482244.db2.gz	JCXCTQGCPVLDFM-QZTJIDSGSA-N	0	3	342.483	3.472	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2oc(CC(C)C)nc2C)C1	ZINC001034432816	1342494933	/nfs/dbraw/zinc/49/49/33/1342494933.db2.gz	LEEBNIIAVNMLSV-MRXNPFEDSA-N	0	3	333.476	3.342	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(OC)cc2)C1	ZINC001034435005	1342496874	/nfs/dbraw/zinc/49/68/74/1342496874.db2.gz	CYUPOPNRPBHKRI-YSIASYRMSA-N	0	3	342.483	3.346	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@@H]2CCOc3ccccc32)C1	ZINC001034446119	1342507669	/nfs/dbraw/zinc/50/76/69/1342507669.db2.gz	LOKQQEYKHRYECE-SJLPKXTDSA-N	0	3	328.456	3.100	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccnc(C3CCCC3)n2)C1	ZINC001034465414	1342520476	/nfs/dbraw/zinc/52/04/76/1342520476.db2.gz	PJKUBLKOOVHGEJ-KRWDZBQOSA-N	0	3	342.487	3.295	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC001034503891	1342561682	/nfs/dbraw/zinc/56/16/82/1342561682.db2.gz	QYAKUFUYFVEKRN-INIZCTEOSA-N	0	3	338.373	3.313	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2csc3c2CC[C@H](C)C3)C1	ZINC001034513180	1342572246	/nfs/dbraw/zinc/57/22/46/1342572246.db2.gz	VFZBFKZAUULENH-HOTGVXAUSA-N	0	3	344.524	3.481	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc(OCC)c(OC)c2)C1	ZINC001034518767	1342577555	/nfs/dbraw/zinc/57/75/55/1342577555.db2.gz	BXRAJQYWISMKCG-KRWDZBQOSA-N	0	3	346.471	3.254	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@H](C)c2cccc(OC)c2)C1	ZINC001034539674	1342598539	/nfs/dbraw/zinc/59/85/39/1342598539.db2.gz	BFCFRXBPPTWHCL-SJLPKXTDSA-N	0	3	330.472	3.346	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)c2cc3ccccc3n2CC)C1	ZINC001034540908	1342600533	/nfs/dbraw/zinc/60/05/33/1342600533.db2.gz	LQHHSNRKWLFJDC-KRWDZBQOSA-N	0	3	325.456	3.432	20	30		EGEDHN
N#Cc1ccc(F)cc1CN[C@H]1CC[C@H](NC(=O)c2ccco2)CC1	ZINC001034580960	1342627064	/nfs/dbraw/zinc/62/70/64/1342627064.db2.gz	NYKJDQIVJUMKHJ-QAQDUYKDSA-N	0	3	341.386	3.121	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1CC[C@H](NC(=O)C[C@H]2C=CCC2)CC1	ZINC001034589626	1342634362	/nfs/dbraw/zinc/63/43/62/1342634362.db2.gz	MEGVISFHFBRKAE-VDGAXYAQSA-N	0	3	337.467	3.432	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)c2ccsc2)CC1	ZINC001034591156	1342635701	/nfs/dbraw/zinc/63/57/01/1342635701.db2.gz	SBDCGOIOAKMAKB-JOCQHMNTSA-N	0	3	343.290	3.287	20	30		EGEDHN
Cc1ccncc1C(=O)N[C@H]1CC[C@H](NCc2ccccc2C#N)CC1	ZINC001034616407	1342650304	/nfs/dbraw/zinc/65/03/04/1342650304.db2.gz	UHKAIRXBBUEWBC-WGSAOQKQSA-N	0	3	348.450	3.093	20	30		EGEDHN
Cc1[nH]ccc1C(=O)N[C@H]1CC[C@H](NCc2ccccc2C#N)CC1	ZINC001034618809	1342652613	/nfs/dbraw/zinc/65/26/13/1342652613.db2.gz	DJNKEYCMXYKCTO-IYARVYRRSA-N	0	3	336.439	3.026	20	30		EGEDHN
C[C@H]1C[C@@H]1CC(=O)N[C@H]1CC[C@H](NCc2cc(F)ccc2C#N)CC1	ZINC001034724412	1342718029	/nfs/dbraw/zinc/71/80/29/1342718029.db2.gz	MABZYDYDRWZUIK-UAFONNFLSA-N	0	3	343.446	3.260	20	30		EGEDHN
C[C@H]1C[C@@H]1CC(=O)N[C@H]1CC[C@H](NCc2ccccc2C#N)CC1	ZINC001034724859	1342718894	/nfs/dbraw/zinc/71/88/94/1342718894.db2.gz	VTJAVVRAOXJIPX-VLQPXKRTSA-N	0	3	325.456	3.121	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)[C@H]2C[C@@H]2C(C)C)CC1	ZINC001034772758	1342752285	/nfs/dbraw/zinc/75/22/85/1342752285.db2.gz	YCXWKHSJAHBLEA-TUVASFSCSA-N	0	3	343.309	3.204	20	30		EGEDHN
N#Cc1cccc(CNCc2ccc(CNC(=O)c3ccco3)cc2)c1	ZINC001034805549	1342770014	/nfs/dbraw/zinc/77/00/14/1342770014.db2.gz	QKSLXJFKKSMRGX-UHFFFAOYSA-N	0	3	345.402	3.371	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2cccc(N(C)C)c2)C12CCC2	ZINC001078794416	1357088480	/nfs/dbraw/zinc/08/84/80/1357088480.db2.gz	HOMFQFFHGHOAEN-IAGOWNOFSA-N	0	3	347.890	3.136	20	30		EGEDHN
N#Cc1ccc(CNCc2ccc(CNC(=O)[C@@H]3CC34CC4)cc2)cc1	ZINC001034830611	1342791610	/nfs/dbraw/zinc/79/16/10/1342791610.db2.gz	XXSVIHHPJFEYAQ-FQEVSTJZSA-N	0	3	345.446	3.264	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)c2cccc(F)c2)s1	ZINC001034846550	1342799153	/nfs/dbraw/zinc/79/91/53/1342799153.db2.gz	DHSOSBSJVNBFOQ-OAHLLOKOSA-N	0	3	343.427	3.153	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)c2cccs2)c(F)c1	ZINC001034849641	1342801960	/nfs/dbraw/zinc/80/19/60/1342801960.db2.gz	MVVQDPTUSCYVGO-OAHLLOKOSA-N	0	3	343.427	3.153	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc(F)cc(F)c2)C12CCC2	ZINC001078800136	1357091266	/nfs/dbraw/zinc/09/12/66/1357091266.db2.gz	JBVBGNOHELGJGT-LSDHHAIUSA-N	0	3	340.801	3.348	20	30		EGEDHN
CC1(C)CC(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)c(F)c2)C1	ZINC001034925966	1342838275	/nfs/dbraw/zinc/83/82/75/1342838275.db2.gz	ODPINKSQHFZPCB-QGZVFWFLSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)c(F)c1)C1CCC1	ZINC001034969578	1342856671	/nfs/dbraw/zinc/85/66/71/1342856671.db2.gz	HFWZVMULWADIDK-RDTXWAMCSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]1CNCc1cccc(C(C)C)n1	ZINC001035014864	1342876854	/nfs/dbraw/zinc/87/68/54/1342876854.db2.gz	TTWNSRSGXPHLCK-QGZVFWFLSA-N	0	3	329.488	3.498	20	30		EGEDHN
CC1(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)s2)CC=CC1	ZINC001035036174	1342889770	/nfs/dbraw/zinc/88/97/70/1342889770.db2.gz	XDOXJYUYTYBKJK-CQSZACIVSA-N	0	3	329.469	3.057	20	30		EGEDHN
CC(F)(F)C(=O)N1CCC2(CCN(Cc3ccccc3C#N)C2)CC1	ZINC001035150189	1342962901	/nfs/dbraw/zinc/96/29/01/1342962901.db2.gz	OZSDJRGXSKCNDG-UHFFFAOYSA-N	0	3	347.409	3.028	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC2(CCN(Cc3cc(C)no3)C2)CC1	ZINC001035223327	1343043991	/nfs/dbraw/zinc/04/39/91/1343043991.db2.gz	OKOQAAGCCXBPRB-LJQANCHMSA-N	0	3	345.487	3.400	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC2(CCN(Cc3ocnc3C)C2)CC1	ZINC001035225905	1343047414	/nfs/dbraw/zinc/04/74/14/1343047414.db2.gz	GELVKNFVNZPMCN-LJQANCHMSA-N	0	3	345.487	3.400	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1sc(C3CC3)nc1C)CC2	ZINC001035707919	1343144430	/nfs/dbraw/zinc/14/44/30/1343144430.db2.gz	ZHDARSHKWZPBIT-UHFFFAOYSA-N	0	3	345.512	3.443	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1c(C)oc3ccccc31)CC2	ZINC001035714844	1343149228	/nfs/dbraw/zinc/14/92/28/1343149228.db2.gz	SMECUXFJDNXCGK-UHFFFAOYSA-N	0	3	336.435	3.303	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)C1(c3ccccc3)CCC1)CC2	ZINC001035747916	1343167437	/nfs/dbraw/zinc/16/74/37/1343167437.db2.gz	TZJYRDHXGHYZFP-UHFFFAOYSA-N	0	3	336.479	3.056	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H]1CCCCC1(F)F)CC2	ZINC001035758127	1343173328	/nfs/dbraw/zinc/17/33/28/1343173328.db2.gz	UXBBLORDDDLTKI-HNNXBMFYSA-N	0	3	326.431	3.312	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc(-c3ccco3)on1)CC2	ZINC001035760386	1343174104	/nfs/dbraw/zinc/17/41/04/1343174104.db2.gz	ACKDTEFAUOCGJS-UHFFFAOYSA-N	0	3	341.411	3.049	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC2(CN(CCOC3CCC3)C2)CC1	ZINC001035787607	1343198826	/nfs/dbraw/zinc/19/88/26/1343198826.db2.gz	QVRKUNTYHJCZFS-LJQANCHMSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1scnc1C(C)C)CC2	ZINC001035811887	1343211162	/nfs/dbraw/zinc/21/11/62/1343211162.db2.gz	DHMIGIOAHAWWFA-UHFFFAOYSA-N	0	3	333.501	3.381	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cc1coc3ccccc13)CC2	ZINC001035823146	1343215748	/nfs/dbraw/zinc/21/57/48/1343215748.db2.gz	WAFXFCZXXGWDBQ-UHFFFAOYSA-N	0	3	338.451	3.476	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc3scnc3c1)CC2	ZINC001035825941	1343216430	/nfs/dbraw/zinc/21/64/30/1343216430.db2.gz	IFXIHEMVPKKIPL-UHFFFAOYSA-N	0	3	341.480	3.410	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C[C@H]1CCC3(CCC3)CO1)CC2	ZINC001035841470	1343223816	/nfs/dbraw/zinc/22/38/16/1343223816.db2.gz	NIXGXHOCNZCPAG-GOSISDBHSA-N	0	3	346.515	3.226	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cc3cc(C)ccc3o1)CC2	ZINC001035856370	1343233372	/nfs/dbraw/zinc/23/33/72/1343233372.db2.gz	MULZDVKQWNMXBA-UHFFFAOYSA-N	0	3	336.435	3.303	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@H](OC)c1ccc(F)cc1)CC2	ZINC001035860397	1343236509	/nfs/dbraw/zinc/23/65/09/1343236509.db2.gz	MHASWINOHLVUNJ-GOSISDBHSA-N	0	3	346.446	3.014	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](NCc2cc(F)ccc2C#N)[C@H](C)C1	ZINC001036140983	1343325438	/nfs/dbraw/zinc/32/54/38/1343325438.db2.gz	FJJXFEXHDLLHOZ-RDTXWAMCSA-N	0	3	343.446	3.236	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](NCc3csc(C)n3)[C@H](C)C2)C1	ZINC001036167071	1343340283	/nfs/dbraw/zinc/34/02/83/1343340283.db2.gz	CPVXYYROEXXERV-CJNGLKHVSA-N	0	3	333.501	3.134	20	30		EGEDHN
CCCC(=O)N1CCC[C@@H]([C@@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001036337029	1343422076	/nfs/dbraw/zinc/42/20/76/1343422076.db2.gz	WYTFPSXBLOPBDO-GDBMZVCRSA-N	0	3	331.435	3.214	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCCN(C(=O)C2CCCC2)C1	ZINC001036356597	1343439449	/nfs/dbraw/zinc/43/94/49/1343439449.db2.gz	JDZIUWFYSVFENU-UZLBHIALSA-N	0	3	339.483	3.465	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@@H]([C@@H](C)NCc3ccccc3C#N)C2)CC1	ZINC001036439562	1343488480	/nfs/dbraw/zinc/48/84/80/1343488480.db2.gz	PWYNDSCQAOIOJP-VQIMIIECSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@H]1CCCN(C(=O)C(C)(C)F)[C@H]1CNCc1cc(C#N)ccc1F	ZINC001036501047	1343519673	/nfs/dbraw/zinc/51/96/73/1343519673.db2.gz	NRMRQGVQUGVKFM-GUYCJALGSA-N	0	3	349.425	3.162	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001036791681	1343721926	/nfs/dbraw/zinc/72/19/26/1343721926.db2.gz	CKEFXFAAGFKBKX-WMLDXEAASA-N	0	3	343.496	3.255	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H]3[C@@H](CCN3Cc3cncs3)C2)CC1	ZINC001036810462	1343744617	/nfs/dbraw/zinc/74/46/17/1343744617.db2.gz	CJTSVYBPUGKODF-WMZOPIPTSA-N	0	3	345.512	3.312	20	30		EGEDHN
CC(C(=O)N[C@H]1CCC[C@@H]1CNCc1ccccc1C#N)=C1CCC1	ZINC001037005980	1343925186	/nfs/dbraw/zinc/92/51/86/1343925186.db2.gz	KWVLBVFZYGOJOE-UXHICEINSA-N	0	3	337.467	3.433	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCC[C@@H]2CNCc2ocnc2C)CC1	ZINC001037070796	1343963874	/nfs/dbraw/zinc/96/38/74/1343963874.db2.gz	WXIOWQJLBCQQDW-IAGOWNOFSA-N	0	3	331.460	3.104	20	30		EGEDHN
CC(C)(F)C(=O)N[C@H]1CCCC[C@@H]1CNCc1ccccc1C#N	ZINC001037156072	1344006672	/nfs/dbraw/zinc/00/66/72/1344006672.db2.gz	LPSIELDXUUNGSK-SJORKVTESA-N	0	3	331.435	3.071	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](NCc2csc(C)n2)[C@H](CC)C1	ZINC001037895340	1344166647	/nfs/dbraw/zinc/16/66/47/1344166647.db2.gz	FNOGRWNXOXYSKY-ZBFHGGJFSA-N	0	3	335.517	3.380	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](NCc2nc(C)cs2)[C@H](CC)C1	ZINC001037906793	1344171025	/nfs/dbraw/zinc/17/10/25/1344171025.db2.gz	SKYWATLUFUSHQE-HUUCEWRRSA-N	0	3	335.517	3.380	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NC[C@@H]1CCN1CCCC1CCCC1	ZINC001038267187	1344349663	/nfs/dbraw/zinc/34/96/63/1344349663.db2.gz	QJTOVNOCKCGNPN-OTWHNJEPSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@H]1CCN1CCC1=CCCCC1	ZINC001038344277	1344387793	/nfs/dbraw/zinc/38/77/93/1344387793.db2.gz	GQTFPXDOHGCDBS-GOSISDBHSA-N	0	3	327.472	3.369	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@@H]1CCN1CCC1=CCCCC1	ZINC001038344279	1344388305	/nfs/dbraw/zinc/38/83/05/1344388305.db2.gz	GQTFPXDOHGCDBS-SFHVURJKSA-N	0	3	327.472	3.369	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@@H]2CCN2CCC2CCCCCC2)c1	ZINC001038684308	1344542118	/nfs/dbraw/zinc/54/21/18/1344542118.db2.gz	ITUULYAVUSKLRW-FQEVSTJZSA-N	0	3	339.483	3.228	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)NC[C@H]1CCN1CCC1CCCC1	ZINC001038798684	1344588948	/nfs/dbraw/zinc/58/89/48/1344588948.db2.gz	GLIHQHZQNAYDCU-QYZOEREBSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1ccc(OC2CCC2)cc1	ZINC001039045228	1344731584	/nfs/dbraw/zinc/73/15/84/1344731584.db2.gz	FIHLGVCSZMHQLO-KRWDZBQOSA-N	0	3	328.456	3.388	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)c3ccn(C)c3C)CC2)C1	ZINC001039156999	1344841810	/nfs/dbraw/zinc/84/18/10/1344841810.db2.gz	AUERWSQZWXNAET-KRWDZBQOSA-N	0	3	349.906	3.260	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]([C@@H]3CCCCN3C(=O)C3CC3)C2)s1	ZINC001039183525	1344882531	/nfs/dbraw/zinc/88/25/31/1344882531.db2.gz	LBDPGBDHMWSSED-YJBOKZPZSA-N	0	3	343.496	3.233	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2sccc2F)C1	ZINC001039200152	1344910051	/nfs/dbraw/zinc/91/00/51/1344910051.db2.gz	HCPZLRDYBZJGOD-GOEBONIOSA-N	0	3	334.460	3.227	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cscc2C)C1	ZINC001039204463	1344916168	/nfs/dbraw/zinc/91/61/68/1344916168.db2.gz	XZBWYZVXCVPAJT-FUHWJXTLSA-N	0	3	330.497	3.396	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)C3(C4CC4)CC3)CC2)C1	ZINC001039205319	1344916344	/nfs/dbraw/zinc/91/63/44/1344916344.db2.gz	POPKGELQXJYROX-MRXNPFEDSA-N	0	3	336.907	3.490	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cccc(C)c2F)C1	ZINC001039210207	1344923679	/nfs/dbraw/zinc/92/36/79/1344923679.db2.gz	OPTCMDFSOHGJRZ-HKUYNNGSSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(C(C)C)nc2)C1	ZINC001039212523	1344927154	/nfs/dbraw/zinc/92/71/54/1344927154.db2.gz	GXXJGBYRMKWUSX-QUCCMNQESA-N	0	3	339.483	3.155	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)CCc2ccsc2)C1	ZINC001039214960	1344930632	/nfs/dbraw/zinc/93/06/32/1344930632.db2.gz	RFYACAKHLUPUFV-OALUTQOASA-N	0	3	344.524	3.407	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc(F)c(C)cc2F)C1	ZINC001039215599	1344931590	/nfs/dbraw/zinc/93/15/90/1344931590.db2.gz	VOGCHCCAAMHOAZ-KXBFYZLASA-N	0	3	346.421	3.223	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccsc2Cl)C1	ZINC001039232220	1344952074	/nfs/dbraw/zinc/95/20/74/1344952074.db2.gz	UKLFMKYBKHGOKS-UKRRQHHQSA-N	0	3	336.888	3.351	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc3[nH]ccc3s2)C1	ZINC001039249457	1344979684	/nfs/dbraw/zinc/97/96/84/1344979684.db2.gz	IQWRFQQLHRGFFK-GOEBONIOSA-N	0	3	341.480	3.179	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)CCc2ccc(C)o2)C1	ZINC001039250428	1344981448	/nfs/dbraw/zinc/98/14/48/1344981448.db2.gz	KJCOJQSNWRTXEV-UYAOXDASSA-N	0	3	342.483	3.247	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)COc1cc(C)ccc1F	ZINC001039375800	1345033642	/nfs/dbraw/zinc/03/36/42/1345033642.db2.gz	XZEPQISPAHVAGG-SJORKVTESA-N	0	3	346.446	3.154	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(C)c2ccccc2n1	ZINC001039395490	1345044019	/nfs/dbraw/zinc/04/40/19/1345044019.db2.gz	TZIDBGHJEGJORP-MSOLQXFVSA-N	0	3	347.462	3.245	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(C)cc(OC)c1C	ZINC001039399100	1345046754	/nfs/dbraw/zinc/04/67/54/1345046754.db2.gz	GHNQWTPUCWLKJV-MSOLQXFVSA-N	0	3	340.467	3.014	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc2cnccc2c1	ZINC001039403616	1345049616	/nfs/dbraw/zinc/04/96/16/1345049616.db2.gz	FOFTUCANKLACQF-RTWAWAEBSA-N	0	3	349.478	3.419	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccc2ncccc21	ZINC001039412214	1345054368	/nfs/dbraw/zinc/05/43/68/1345054368.db2.gz	HNFQBNHQJBRZAE-SJORKVTESA-N	0	3	335.451	3.490	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](c1ccncc1)C(C)C	ZINC001039424625	1345062198	/nfs/dbraw/zinc/06/21/98/1345062198.db2.gz	AHUYDNPTXBBWRH-AABGKKOBSA-N	0	3	341.499	3.463	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1c(C)cc(C)cc1C	ZINC001039428181	1345063484	/nfs/dbraw/zinc/06/34/84/1345063484.db2.gz	BEWKVQHBMMMCSG-MOPGFXCFSA-N	0	3	326.484	3.406	20	30		EGEDHN
C=CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1sc(C)cc1OC	ZINC001039447169	1345071814	/nfs/dbraw/zinc/07/18/14/1345071814.db2.gz	AVAUPHLKJPNYOX-CABCVRRESA-N	0	3	334.485	3.320	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cn1cc(C)c2ccccc21	ZINC001039450649	1345074107	/nfs/dbraw/zinc/07/41/07/1345074107.db2.gz	MNOLPGDGLGTINA-MOPGFXCFSA-N	0	3	349.478	3.038	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@]1(C)C[C@@H]1c1ccccc1	ZINC001039452922	1345076171	/nfs/dbraw/zinc/07/61/71/1345076171.db2.gz	XNYFXPJPCRWOTH-DYQZNNLLSA-N	0	3	336.479	3.269	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](F)Cc1ccccc1	ZINC001039473279	1345088727	/nfs/dbraw/zinc/08/87/27/1345088727.db2.gz	FHYVMSZAOKZUBW-QYZOEREBSA-N	0	3	330.447	3.209	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@]2(C1)CCCN(C/C=C\c1ccccc1)C2	ZINC001040203471	1345374165	/nfs/dbraw/zinc/37/41/65/1345374165.db2.gz	ZBEJJTGUQBLYSA-IZPOICSHSA-N	0	3	348.490	3.428	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3ccoc3C(F)(F)F)C2)C1	ZINC001040223832	1345383028	/nfs/dbraw/zinc/38/30/28/1345383028.db2.gz	AEHPEECACVBVDH-INIZCTEOSA-N	0	3	342.361	3.413	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3cc(C)c4ccccc4n3)C2)C1	ZINC001040263099	1345401376	/nfs/dbraw/zinc/40/13/76/1345401376.db2.gz	XXMDBCDIGHJOLH-QFIPXVFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cccc4ncccc43)C2)C1	ZINC001040320493	1345429855	/nfs/dbraw/zinc/42/98/55/1345429855.db2.gz	RGPZSVOAEPTZDD-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@]2(C1)CCCN(Cc1cccnc1)C2	ZINC001040328375	1345434806	/nfs/dbraw/zinc/43/48/06/1345434806.db2.gz	LLCISWDZZMJXHH-FQEVSTJZSA-N	0	3	327.472	3.108	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)C(C3CCC3)C3CCC3)C2)C1	ZINC001040357129	1345452257	/nfs/dbraw/zinc/45/22/57/1345452257.db2.gz	NOVUITRNXYJABG-NRFANRHFSA-N	0	3	328.500	3.151	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3ccc(C(C)C)cn3)C2)C1	ZINC001040394138	1345474345	/nfs/dbraw/zinc/47/43/45/1345474345.db2.gz	IHUMDBQBBHVSOZ-FQEVSTJZSA-N	0	3	327.472	3.319	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)C[C@@H](C)c3ccccc3C)C2)C1	ZINC001040433797	1345497402	/nfs/dbraw/zinc/49/74/02/1345497402.db2.gz	ZIMNYQQUJBXTOT-DENIHFKCSA-N	0	3	338.495	3.436	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3sc(CC)nc3C)C2)C1	ZINC001040446099	1345504260	/nfs/dbraw/zinc/50/42/60/1345504260.db2.gz	JFRQPLBGNWFFCC-SFHVURJKSA-N	0	3	333.501	3.128	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@@]2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001040502193	1345522325	/nfs/dbraw/zinc/52/23/25/1345522325.db2.gz	KRNYBKZVJDMIPO-NRFANRHFSA-N	0	3	339.483	3.419	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cc4[nH]ccc4s3)C2)C1	ZINC001040509456	1345526165	/nfs/dbraw/zinc/52/61/65/1345526165.db2.gz	HBFOFCFTNJGPHZ-SFHVURJKSA-N	0	3	329.469	3.344	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@H](C)Cc3ccccc3)C2)C1	ZINC001040539084	1345536707	/nfs/dbraw/zinc/53/67/07/1345536707.db2.gz	MXZCAOCHGANKDU-DENIHFKCSA-N	0	3	338.495	3.203	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@@H](C)c3ccc(F)c(F)c3)C2)C1	ZINC001040540800	1345537611	/nfs/dbraw/zinc/53/76/11/1345537611.db2.gz	WOMLZGGPRRKFLE-MGPUTAFESA-N	0	3	346.421	3.016	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@@H](C)Cc3ccccc3C)C2)C1	ZINC001040546325	1345540852	/nfs/dbraw/zinc/54/08/52/1345540852.db2.gz	CJEHOLXKHNIAEE-SIKLNZKXSA-N	0	3	338.495	3.121	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cccc4oc(C)nc43)C2)C1	ZINC001040546853	1345541326	/nfs/dbraw/zinc/54/13/26/1345541326.db2.gz	HNSKPZBTEHDKKN-HXUWFJFHSA-N	0	3	339.439	3.250	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3c[nH]c4ccc(C)cc34)C2)C1	ZINC001040549074	1345542876	/nfs/dbraw/zinc/54/28/76/1345542876.db2.gz	YIAOTVDLFIYYEX-NRFANRHFSA-N	0	3	335.451	3.038	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccc4occc4c3)C2)CC1	ZINC001040711537	1345568650	/nfs/dbraw/zinc/56/86/50/1345568650.db2.gz	VOLKBFLFGLVPMS-UHFFFAOYSA-N	0	3	336.435	3.384	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cccc4c(C)c(C)[nH]c43)C2)CC1	ZINC001040747434	1345573915	/nfs/dbraw/zinc/57/39/15/1345573915.db2.gz	QVPQISXSAFNCDI-UHFFFAOYSA-N	0	3	349.478	3.346	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3c(C)c(F)ccc3Cl)C2)CC1	ZINC001040753058	1345574691	/nfs/dbraw/zinc/57/46/91/1345574691.db2.gz	PMQBJDOTKFSHIW-UHFFFAOYSA-N	0	3	348.849	3.349	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccc(Cl)cc3F)C2)CC1	ZINC001040765145	1345576636	/nfs/dbraw/zinc/57/66/36/1345576636.db2.gz	GDUNAEAAJBLEDW-UHFFFAOYSA-N	0	3	334.822	3.040	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cc4cc(C)ccc4[nH]3)C2)CC1	ZINC001040796310	1345579101	/nfs/dbraw/zinc/57/91/01/1345579101.db2.gz	QCKTUBGQRSHXKO-UHFFFAOYSA-N	0	3	335.451	3.038	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cc(F)cc(Cl)c3)C2)CC1	ZINC001040861428	1345588986	/nfs/dbraw/zinc/58/89/86/1345588986.db2.gz	MQKILGDMFYEPPG-UHFFFAOYSA-N	0	3	348.849	3.431	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3[nH]c4ccc(C)cc4c3C)C2)CC1	ZINC001040902595	1345596996	/nfs/dbraw/zinc/59/69/96/1345596996.db2.gz	WLQVXGBQRWZDLQ-UHFFFAOYSA-N	0	3	349.478	3.346	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@H](C)c3ccc(C)s3)C2)CC1	ZINC001040911771	1345598825	/nfs/dbraw/zinc/59/88/25/1345598825.db2.gz	IYOJZBACECWODU-MRXNPFEDSA-N	0	3	330.497	3.108	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3c(C)csc3Cl)C2)CC1	ZINC001040925043	1345602285	/nfs/dbraw/zinc/60/22/85/1345602285.db2.gz	BYEOXTVCDTWEKI-UHFFFAOYSA-N	0	3	336.888	3.271	20	30		EGEDHN
Cc1ccoc1C(=O)N1CC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001041067852	1345642480	/nfs/dbraw/zinc/64/24/80/1345642480.db2.gz	BNVUGYSEQPNQLR-OAQYLSRUSA-N	0	3	349.434	3.198	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001041077868	1345646147	/nfs/dbraw/zinc/64/61/47/1345646147.db2.gz	PCGGSDXVUOOQLC-NRFANRHFSA-N	0	3	339.483	3.419	20	30		EGEDHN
Cc1cc(Br)cc(C#N)c1O[C@@H]1CNCCC1(F)F	ZINC001218452335	1373616049	/nfs/dbraw/zinc/61/60/49/1373616049.db2.gz	JCXQYBLHHHKZBS-LLVKDONJSA-N	0	3	331.160	3.005	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@]2(CCN(Cc3c(C)noc3C)C2)C1	ZINC001041535244	1345754166	/nfs/dbraw/zinc/75/41/66/1345754166.db2.gz	FBSMVPCIJHPTEG-FQEVSTJZSA-N	0	3	345.487	3.318	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@]2(CCN(Cc3cnc(C)s3)C2)C1	ZINC001041541658	1345757598	/nfs/dbraw/zinc/75/75/98/1345757598.db2.gz	YSEXBGHUQFUSKL-SFHVURJKSA-N	0	3	333.501	3.088	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@]2(CCN(Cc3cncc(C)c3)C2)C1	ZINC001041544645	1345758940	/nfs/dbraw/zinc/75/89/40/1345758940.db2.gz	OZSMDVCETTYLGW-HXUWFJFHSA-N	0	3	327.472	3.027	20	30		EGEDHN
C[C@@]1(C(=O)N2CC[C@@]3(CCN(Cc4cccc(C#N)c4)C3)C2)C=CCC1	ZINC001041557041	1345766811	/nfs/dbraw/zinc/76/68/11/1345766811.db2.gz	CUDFNGLAUNDKHZ-FGZHOGPDSA-N	0	3	349.478	3.339	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cccc(Cl)c3F)C2)C1	ZINC001041618354	1345796713	/nfs/dbraw/zinc/79/67/13/1345796713.db2.gz	TZKQRVZKDNEQHL-GOSISDBHSA-N	0	3	334.822	3.040	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@]2(CCN(Cc3scnc3C)C2)C1	ZINC001041626422	1345801553	/nfs/dbraw/zinc/80/15/53/1345801553.db2.gz	SJRUAKSHGZFXDY-MOPGFXCFSA-N	0	3	347.528	3.478	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)CC(C3CCC3)C3CCC3)C2)C1	ZINC001041684593	1345820100	/nfs/dbraw/zinc/82/01/00/1345820100.db2.gz	CREYJBLOYFBRSC-NRFANRHFSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CC[C@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001041720942	1345831381	/nfs/dbraw/zinc/83/13/81/1345831381.db2.gz	YMDFRTRMQRILOA-UTKZUKDTSA-N	0	3	339.483	3.275	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)C3(c4ccccc4)CCCC3)C2)C1	ZINC001041817624	1345861885	/nfs/dbraw/zinc/86/18/85/1345861885.db2.gz	KFCKKUHQBIVYRX-NRFANRHFSA-N	0	3	336.479	3.056	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)C(CC)(CC)c3ccccc3)C2)C1	ZINC001041841688	1345869471	/nfs/dbraw/zinc/86/94/71/1345869471.db2.gz	RJYVWHHVLMJKGO-NRFANRHFSA-N	0	3	338.495	3.302	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3ccc(C(C)(C)C)s3)C2)C1	ZINC001041842012	1345870158	/nfs/dbraw/zinc/87/01/58/1345870158.db2.gz	YSYMTFALMOSLCL-LJQANCHMSA-N	0	3	330.497	3.217	20	30		EGEDHN
CC(C)(C)CC(=O)N1CC[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@@H]2C1	ZINC001041926797	1345899763	/nfs/dbraw/zinc/89/97/63/1345899763.db2.gz	FENHKJRAYYUJJF-RBUKOAKNSA-N	0	3	339.483	3.417	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3CCN(C(=O)CC4CCC4)C[C@@H]32)c1	ZINC001041997934	1345917607	/nfs/dbraw/zinc/91/76/07/1345917607.db2.gz	WDTYHOGWMPKIMM-PMACEKPBSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3nsc4ccccc43)C[C@H]21	ZINC001042078750	1345939216	/nfs/dbraw/zinc/93/92/16/1345939216.db2.gz	YDGBFLUOVUOTQU-UKRRQHHQSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3cc4c(o3)CCCC4)C[C@H]21	ZINC001042090291	1345940920	/nfs/dbraw/zinc/94/09/20/1345940920.db2.gz	JGULZILWAFFNII-NVXWUHKLSA-N	0	3	328.456	3.271	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)Cc3c(C)cccc3Cl)C[C@H]21	ZINC001042136640	1345953408	/nfs/dbraw/zinc/95/34/08/1345953408.db2.gz	VTDGIFIXPRJYRG-VQIMIIECSA-N	0	3	344.886	3.137	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)Cc3ccc(C(F)F)cc3)C[C@H]21	ZINC001042148351	1345957099	/nfs/dbraw/zinc/95/70/99/1345957099.db2.gz	IZYVGUNSULNWMO-FUHWJXTLSA-N	0	3	346.421	3.113	20	30		EGEDHN
C#CCN1CC[C@H]2CCN(C(=O)CCc3ccc(C(C)C)cc3)C[C@H]21	ZINC001042150726	1345957251	/nfs/dbraw/zinc/95/72/51/1345957251.db2.gz	YXLHHTYOCAJLEW-LEWJYISDSA-N	0	3	338.495	3.299	20	30		EGEDHN
CC1(CC(=O)N2CC[C@H]3CCN(Cc4cccc(C#N)c4)[C@H]3C2)CC1	ZINC001042157118	1345959309	/nfs/dbraw/zinc/95/93/09/1345959309.db2.gz	ZMWNIRDVNTWQFE-MOPGFXCFSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3nsc4ccc(C)cc43)C[C@H]21	ZINC001042183290	1345971202	/nfs/dbraw/zinc/97/12/02/1345971202.db2.gz	IUBJCZMSSGRNIA-GOEBONIOSA-N	0	3	341.480	3.327	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3cnccc3C)[C@H]2C1	ZINC001042186838	1345974378	/nfs/dbraw/zinc/97/43/78/1345974378.db2.gz	JVPPKDRPMFGQAE-WMZOPIPTSA-N	0	3	327.472	3.025	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3scnc3C3CC3)C[C@H]21	ZINC001042261890	1346009974	/nfs/dbraw/zinc/00/99/74/1346009974.db2.gz	AYHDKHYSOSXMJG-DZGCQCFKSA-N	0	3	331.485	3.133	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3oc(C(C)C)nc3C)C[C@@H]21	ZINC001042262688	1346010563	/nfs/dbraw/zinc/01/05/63/1346010563.db2.gz	OLTOIAXQARVJOM-CVEARBPZSA-N	0	3	331.460	3.219	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(C)n(CC4CC4)c3C)C[C@H]21	ZINC001042315797	1346030024	/nfs/dbraw/zinc/03/00/24/1346030024.db2.gz	CNKRLHISOSLLCT-UYAOXDASSA-N	0	3	341.499	3.237	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccccc3OC(C)C)C[C@@H]21	ZINC001042320532	1346031507	/nfs/dbraw/zinc/03/15/07/1346031507.db2.gz	RTUXTYVXYHTUJE-WMZOPIPTSA-N	0	3	328.456	3.196	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cccc4ccccc43)C[C@@H]21	ZINC001042339803	1346044991	/nfs/dbraw/zinc/04/49/91/1346044991.db2.gz	BMKOEBGYVBOCOH-RXVVDRJESA-N	0	3	332.447	3.400	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc4c(c3)CCCC4)C[C@@H]21	ZINC001042343788	1346046808	/nfs/dbraw/zinc/04/68/08/1346046808.db2.gz	OKKSWEREVWPDHY-NQIIRXRSSA-N	0	3	336.479	3.125	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3sc(C(C)C)nc3C)C[C@H]21	ZINC001042355211	1346053014	/nfs/dbraw/zinc/05/30/14/1346053014.db2.gz	WVAWNCBKVHTRAR-JKSUJKDBSA-N	0	3	345.512	3.135	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(F)c4occc43)C[C@@H]21	ZINC001042363752	1346057233	/nfs/dbraw/zinc/05/72/33/1346057233.db2.gz	XMVVTORZNZRAOB-GUYCJALGSA-N	0	3	328.387	3.294	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cc4ccccc4n3CC)C[C@H]21	ZINC001042367232	1346058633	/nfs/dbraw/zinc/05/86/33/1346058633.db2.gz	CURCQRMDNUUMSM-LAUBAEHRSA-N	0	3	349.478	3.221	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)CC(C)(C)c3ccccc3)C[C@@H]21	ZINC001042367842	1346059667	/nfs/dbraw/zinc/05/96/67/1346059667.db2.gz	MCNPHNIEUOCOFG-ICSRJNTNSA-N	0	3	338.495	3.300	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cccc4c3OCC4(C)C)C[C@@H]21	ZINC001042382637	1346066221	/nfs/dbraw/zinc/06/62/21/1346066221.db2.gz	KIZPLFKCTMUPID-YJBOKZPZSA-N	0	3	340.467	3.079	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N(C)C1CN(CC2CCCCCC2)C1	ZINC001044231823	1346280987	/nfs/dbraw/zinc/28/09/87/1346280987.db2.gz	ZMWPROHKHPSHOJ-UHFFFAOYSA-N	0	3	338.495	3.323	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)c1cccs1	ZINC001044442363	1346333760	/nfs/dbraw/zinc/33/37/60/1346333760.db2.gz	KRLIYFYHXZZYGX-RHSMWYFYSA-N	0	3	339.464	3.403	20	30		EGEDHN
Cc1coc(C(=O)N2CC[C@@H](NCc3ccccc3C#N)C[C@H]2C)c1	ZINC001044717024	1346409942	/nfs/dbraw/zinc/40/99/42/1346409942.db2.gz	QFPZYEKEYZHSKE-CRAIPNDOSA-N	0	3	337.423	3.243	20	30		EGEDHN
CC(C)(C)CC(=O)N1CCC[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC001044927058	1346464653	/nfs/dbraw/zinc/46/46/53/1346464653.db2.gz	CDHXSXJNGPNXLF-INIZCTEOSA-N	0	3	331.435	3.214	20	30		EGEDHN
CCC(CC)C(=O)N1CCC[C@H]1CNCc1ccc(C#N)cc1F	ZINC001044935110	1346465909	/nfs/dbraw/zinc/46/59/09/1346465909.db2.gz	NSPGUWGORKHWSI-KRWDZBQOSA-N	0	3	331.435	3.214	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@H]1CNC1c2ccccc2-c2ccccc21	ZINC001044963224	1346470713	/nfs/dbraw/zinc/47/07/13/1346470713.db2.gz	YFFVHPGSUWIWLD-CVEARBPZSA-N	0	3	345.446	3.497	20	30		EGEDHN
C[C@]1(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)s2)C=CCC1	ZINC001045156341	1346509145	/nfs/dbraw/zinc/50/91/45/1346509145.db2.gz	WXCAKLVOZXWEQK-KSSFIOAISA-N	0	3	329.469	3.057	20	30		EGEDHN
C[C@@]1(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)c(F)c2)C=CCC1	ZINC001045155943	1346509234	/nfs/dbraw/zinc/50/92/34/1346509234.db2.gz	MDCNSENMPYYWIZ-FXAWDEMLSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H]1CNCc1ccc(C#N)cc1F	ZINC001045186101	1346521991	/nfs/dbraw/zinc/52/19/91/1346521991.db2.gz	YHKQQUBRWGPQIX-FXAWDEMLSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]2CNCc2c(C)nsc2C)C1	ZINC001045191409	1346525770	/nfs/dbraw/zinc/52/57/70/1346525770.db2.gz	WXGGEBUUGJTGQZ-HNNXBMFYSA-N	0	3	333.501	3.197	20	30		EGEDHN
Cc1ccc(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)s2)cc1	ZINC001045287796	1346550785	/nfs/dbraw/zinc/55/07/85/1346550785.db2.gz	NGYOUESFOVLEOB-INIZCTEOSA-N	0	3	339.464	3.323	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2cn(C)c3ccc(F)cc23)CC1	ZINC001045461823	1346599887	/nfs/dbraw/zinc/59/98/87/1346599887.db2.gz	PKKQDOGYNUKRMV-UHFFFAOYSA-N	0	3	329.419	3.088	20	30		EGEDHN
CC1(NC(=O)[C@H]2CCC2(F)F)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045475243	1346602527	/nfs/dbraw/zinc/60/25/27/1346602527.db2.gz	HGXCNGDLPWGVFT-MRXNPFEDSA-N	0	3	347.409	3.074	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2cc(C)nn2C(CC)CC)CC1	ZINC001045490874	1346607831	/nfs/dbraw/zinc/60/78/31/1346607831.db2.gz	SVEDCZBWBXXEIA-UHFFFAOYSA-N	0	3	332.492	3.323	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2cc3cc(Cl)ccc3[nH]2)CC1	ZINC001045520858	1346616075	/nfs/dbraw/zinc/61/60/75/1346616075.db2.gz	YZDBWASREZPRRT-UHFFFAOYSA-N	0	3	343.858	3.429	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)[C@@H]2CCCCc3ccccc32)CC1	ZINC001045647623	1346658176	/nfs/dbraw/zinc/65/81/76/1346658176.db2.gz	NBSOEQOIAJEOSY-HXUWFJFHSA-N	0	3	338.495	3.491	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1cccc(C#N)c1)C1CC1	ZINC001045747743	1346687580	/nfs/dbraw/zinc/68/75/80/1346687580.db2.gz	RDCSHYYNOGFVRD-BEVDRBHNSA-N	0	3	337.467	3.170	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@H]2CC[C@@H](C1)N2Cc1cc2ccccc2o1	ZINC001045775909	1346695400	/nfs/dbraw/zinc/69/54/00/1346695400.db2.gz	XFXHDMICIWRJAP-MOPGFXCFSA-N	0	3	348.446	3.412	20	30		EGEDHN
CC1(C(=O)N2CC[C@H]3CC[C@@H](C2)N3Cc2cccc(C#N)c2)CCC1	ZINC001045828629	1346711818	/nfs/dbraw/zinc/71/18/18/1346711818.db2.gz	KELNRZPRVHWBES-MOPGFXCFSA-N	0	3	337.467	3.314	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cccc(Cl)c1F)C2	ZINC001045962802	1346798086	/nfs/dbraw/zinc/79/80/86/1346798086.db2.gz	REUXSBZLTXQNJV-LJQANCHMSA-N	0	3	348.849	3.431	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cccc(Cl)c1F)C2	ZINC001045962800	1346798113	/nfs/dbraw/zinc/79/81/13/1346798113.db2.gz	REUXSBZLTXQNJV-IBGZPJMESA-N	0	3	348.849	3.431	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1oc(CC)cc1C)C2	ZINC001045980027	1346817692	/nfs/dbraw/zinc/81/76/92/1346817692.db2.gz	PGIMEGQLHYQYKX-HXUWFJFHSA-N	0	3	328.456	3.102	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc3c(c1)CCC3)C2	ZINC001045982741	1346821576	/nfs/dbraw/zinc/82/15/76/1346821576.db2.gz	DYXHEZSYBMPMPH-QFIPXVFZSA-N	0	3	336.479	3.127	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)Cc1ccccc1Cl)C2	ZINC001045982755	1346821879	/nfs/dbraw/zinc/82/18/79/1346821879.db2.gz	FKSQUMKKSWBPNS-HXUWFJFHSA-N	0	3	344.886	3.220	20	30		EGEDHN
C=C1CCC(C(=O)N[C@]2(C)CCN(Cc3ccc(CO)cc3)C2)CC1	ZINC001046594369	1347030439	/nfs/dbraw/zinc/03/04/39/1347030439.db2.gz	GZFHXYYLQGORIF-OAQYLSRUSA-N	0	3	342.483	3.006	20	30		EGEDHN
C#CCCN1CC[C@@](C)(NC(=O)c2csc3c2CC[C@@H](C)C3)C1	ZINC001046817023	1347116455	/nfs/dbraw/zinc/11/64/55/1347116455.db2.gz	RYDYRLPYLTXDJU-AUUYWEPGSA-N	0	3	330.497	3.090	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2ccc(N(C)C(C)C)cc2)C1	ZINC001046870945	1347140952	/nfs/dbraw/zinc/14/09/52/1347140952.db2.gz	SRNFKBWGHMXGHM-FQEVSTJZSA-N	0	3	329.488	3.302	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2ccc(F)c(F)c2)C1	ZINC001046947159	1347160389	/nfs/dbraw/zinc/16/03/89/1347160389.db2.gz	ICFPFVHHNIPWCN-CYBMUJFWSA-N	0	3	344.352	3.228	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)N(Cc2ccccc2C#N)C3)C1	ZINC001047144008	1347219577	/nfs/dbraw/zinc/21/95/77/1347219577.db2.gz	WTPNIHZFIBKZJF-DBVUQKKJSA-N	0	3	349.478	3.384	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)c3ccc(F)cc3)C2)CC1	ZINC001047219711	1347251252	/nfs/dbraw/zinc/25/12/52/1347251252.db2.gz	PYVRCXYCLXIWTJ-IBGZPJMESA-N	0	3	342.458	3.413	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)c3ccccc3F)C2)CC1	ZINC001047219697	1347251298	/nfs/dbraw/zinc/25/12/98/1347251298.db2.gz	PRISGVFBKNZOMJ-GOSISDBHSA-N	0	3	342.458	3.413	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3cc(C)oc3C)C2)CC1	ZINC001047223738	1347254063	/nfs/dbraw/zinc/25/40/63/1347254063.db2.gz	NUKUWZNRPHGJPZ-GOSISDBHSA-N	0	3	328.456	3.094	20	30		EGEDHN
CC[C@H](F)CN1CCC([C@H]2CCCN(C(=O)C#CC3CC3)C2)CC1	ZINC001047235689	1347263756	/nfs/dbraw/zinc/26/37/56/1347263756.db2.gz	AQFHMJGDOSSMHB-OALUTQOASA-N	0	3	334.479	3.099	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)[C@H](C)n3cccc3)C2)CC1	ZINC001047236451	1347264371	/nfs/dbraw/zinc/26/43/71/1347264371.db2.gz	JZXQNWFGXMAYKJ-AZUAARDMSA-N	0	3	341.499	3.023	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)c3csc(C)n3)C2)CC1	ZINC001047249295	1347273965	/nfs/dbraw/zinc/27/39/65/1347273965.db2.gz	TWZMWVZNCSZQST-KRWDZBQOSA-N	0	3	345.512	3.039	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@H](C)c3ccsc3)C2)CC1	ZINC001047253875	1347277829	/nfs/dbraw/zinc/27/78/29/1347277829.db2.gz	JRXGKLMXAWRHAM-SJLPKXTDSA-N	0	3	344.524	3.435	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)[C@@H](C)C(C)(F)F)C2)CC1	ZINC001047255554	1347279017	/nfs/dbraw/zinc/27/90/17/1347279017.db2.gz	ASOJEAGUJJWHJY-NVXWUHKLSA-N	0	3	340.458	3.252	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3cccc4[nH]ccc43)C2)CC1	ZINC001047256123	1347279631	/nfs/dbraw/zinc/27/96/31/1347279631.db2.gz	HOWWQKBPBMRGRL-GOSISDBHSA-N	0	3	349.478	3.365	20	30		EGEDHN
C/C(=C\C(=O)N1CC[C@H]([C@H](C)NCc2ccccc2C#N)C1)C1CC1	ZINC001047736168	1347356087	/nfs/dbraw/zinc/35/60/87/1347356087.db2.gz	OBDAIVJAPIXUON-QWSHPKPYSA-N	0	3	337.467	3.241	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@H]([C@@H](C)NCc2cscn2)C1	ZINC001047855873	1347390667	/nfs/dbraw/zinc/39/06/67/1347390667.db2.gz	ONNWTFWBPVEXIE-YPMHNXCESA-N	0	3	341.908	3.248	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)C2C=CC=CC=C2)C1	ZINC001047859738	1347391618	/nfs/dbraw/zinc/39/16/18/1347391618.db2.gz	WMMQMQCOSGSEME-UWJYYQICSA-N	0	3	347.462	3.183	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)C2(C3CC3)CC2)C1	ZINC001047878730	1347396828	/nfs/dbraw/zinc/39/68/28/1347396828.db2.gz	CXTAHMYOXGQAKQ-YJBOKZPZSA-N	0	3	337.467	3.075	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@H]([C@@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001047960512	1347424777	/nfs/dbraw/zinc/42/47/77/1347424777.db2.gz	WZZMXPNXFLMBGD-ZBFHGGJFSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H](CNCc3nc(C)cs3)[C@H](C)C2)CC1	ZINC001048370634	1347533146	/nfs/dbraw/zinc/53/31/46/1347533146.db2.gz	SVUQPCRQEILSQD-RHSMWYFYSA-N	0	3	347.528	3.382	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](CNCc3nc(C)c(C)s3)[C@H](C)C2)C1	ZINC001048375389	1347535396	/nfs/dbraw/zinc/53/53/96/1347535396.db2.gz	XOXSEFMFXFPUBE-CZUORRHYSA-N	0	3	347.528	3.300	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](CNCc3nc(C)sc3C)[C@H](C)C2)C1	ZINC001048375504	1347535433	/nfs/dbraw/zinc/53/54/33/1347535433.db2.gz	YCJXAAQKIRBCKF-CZUORRHYSA-N	0	3	347.528	3.300	20	30		EGEDHN
C=C(C)CC[N@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)c1ccccc1[O-])C2	ZINC001048505593	1347571757	/nfs/dbraw/zinc/57/17/57/1347571757.db2.gz	XQGFWQJYLWOBJP-BJWYYQGGSA-N	0	3	328.456	3.331	20	30		EGEDHN
C=C(C)CC[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)c1ccccc1[O-])C2	ZINC001048505593	1347571759	/nfs/dbraw/zinc/57/17/59/1347571759.db2.gz	XQGFWQJYLWOBJP-BJWYYQGGSA-N	0	3	328.456	3.331	20	30		EGEDHN
O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)N2CC#Cc1ccccc1)[C@@H]1CC12CC2	ZINC001048568592	1347597068	/nfs/dbraw/zinc/59/70/68/1347597068.db2.gz	FATGNEGORJIZPQ-WOZUAGRISA-N	0	3	348.490	3.197	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)C2CC=CC2)CC1	ZINC001048626065	1347624075	/nfs/dbraw/zinc/62/40/75/1347624075.db2.gz	XDLPEQWIPGBPFI-UHFFFAOYSA-N	0	3	325.456	3.027	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2C[C@H]3CN(C[C@H](F)CC)C[C@H]3C2)cc1	ZINC001048898843	1347679708	/nfs/dbraw/zinc/67/97/08/1347679708.db2.gz	DIHXGZLJFFVZOZ-FGTMMUONSA-N	0	3	346.446	3.003	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3sc4ccccc4c3C)C[C@@H]2C1	ZINC001048926819	1347685342	/nfs/dbraw/zinc/68/53/42/1347685342.db2.gz	OZSZRNYYSFCKFI-IYBDPMFKSA-N	0	3	338.476	3.237	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CN(Cc4cccc(F)c4)C[C@H]3C2)C1	ZINC001049044057	1347714487	/nfs/dbraw/zinc/71/44/87/1347714487.db2.gz	WSUCMUJZJZYQMV-CALCHBBNSA-N	0	3	328.431	3.072	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc(Cl)c(Cl)c3)C[C@@H]2C1	ZINC001049187711	1347742481	/nfs/dbraw/zinc/74/24/81/1347742481.db2.gz	RHEMGLQSCFBPGX-OKILXGFUSA-N	0	3	337.250	3.021	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3oc4ccccc4c3CC)C[C@@H]2C1	ZINC001049243669	1347756107	/nfs/dbraw/zinc/75/61/07/1347756107.db2.gz	ZCMXIYATUHDWKY-IYBDPMFKSA-N	0	3	336.435	3.022	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)C2=CCCC2)c1	ZINC001049414177	1347836752	/nfs/dbraw/zinc/83/67/52/1347836752.db2.gz	BTRHNBNXDTXANM-VQTJNVASSA-N	0	3	335.451	3.234	20	30		EGEDHN
Cc1cc[nH]c1C(=O)N1CCC[C@H]2[C@H]1CCN2Cc1cccc(C#N)c1	ZINC001049459031	1347858850	/nfs/dbraw/zinc/85/88/50/1347858850.db2.gz	SGVMWYMWFWCHHL-RBUKOAKNSA-N	0	3	348.450	3.074	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc2oc(C)nc2c1	ZINC001049542141	1347899479	/nfs/dbraw/zinc/89/94/79/1347899479.db2.gz	UKKJZGKVWWTPDP-IRXDYDNUSA-N	0	3	325.412	3.001	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2CCC[C@@H]3[C@H]2CCN3CC=C)cc1	ZINC001049556849	1347907500	/nfs/dbraw/zinc/90/75/00/1347907500.db2.gz	ZDHVMJNKFGQRPB-RTBURBONSA-N	0	3	326.440	3.116	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2CCC[C@H]3[C@H]2CCN3CC=C)cc1	ZINC001049556848	1347907601	/nfs/dbraw/zinc/90/76/01/1347907601.db2.gz	ZDHVMJNKFGQRPB-RBUKOAKNSA-N	0	3	326.440	3.116	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(C)n([C@H](C)C2CC2)n1	ZINC001049565026	1347912418	/nfs/dbraw/zinc/91/24/18/1347912418.db2.gz	RNCCQIXRPAQMKD-AYOQOUSVSA-N	0	3	342.487	3.027	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(C)cc(OC)c1C	ZINC001049572722	1347916051	/nfs/dbraw/zinc/91/60/51/1347916051.db2.gz	NGQQNMJIPNKJNO-QZTJIDSGSA-N	0	3	328.456	3.177	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cccc(C(C)C)n1	ZINC001049572841	1347916788	/nfs/dbraw/zinc/91/67/88/1347916788.db2.gz	OYZJVSFYAGPBII-RTBURBONSA-N	0	3	327.472	3.460	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1ccc(CC(C)C)cc1	ZINC001049583525	1347922095	/nfs/dbraw/zinc/92/20/95/1347922095.db2.gz	WMDDVGPCCOEMQV-NHCUHLMSSA-N	0	3	338.495	3.126	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H]1CCc2cc(F)ccc21	ZINC001049596650	1347928962	/nfs/dbraw/zinc/92/89/62/1347928962.db2.gz	VKJWPBLNPJXING-IPMKNSEASA-N	0	3	328.431	3.107	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1nc2ccccc2cc1C	ZINC001049606706	1347933731	/nfs/dbraw/zinc/93/37/31/1347933731.db2.gz	URIMXWJSMHVOEP-RTBURBONSA-N	0	3	335.451	3.408	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccncc1OC(C)C	ZINC001049615832	1347936109	/nfs/dbraw/zinc/93/61/09/1347936109.db2.gz	ODAYGFAVDADRLT-QZTJIDSGSA-N	0	3	343.471	3.124	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1c(C)ccnc1OCC	ZINC001049616647	1347936185	/nfs/dbraw/zinc/93/61/85/1347936185.db2.gz	YOYFHXGJWHLBTA-SJORKVTESA-N	0	3	343.471	3.044	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)CCc1ccc(Cl)cc1	ZINC001049620553	1347938511	/nfs/dbraw/zinc/93/85/11/1347938511.db2.gz	FTXFEKYOVFQGDW-OALUTQOASA-N	0	3	344.886	3.361	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(-c2ccco2)on1	ZINC001049620412	1347938569	/nfs/dbraw/zinc/93/85/69/1347938569.db2.gz	KLDJCRVQVFBKRR-HOTGVXAUSA-N	0	3	341.411	3.190	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)CCc1ccc(C)cc1C	ZINC001049620652	1347938625	/nfs/dbraw/zinc/93/86/25/1347938625.db2.gz	LKLLGWJIFMHAEH-LEWJYISDSA-N	0	3	338.495	3.325	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H]1CCCN2C(=O)CCc1ccc(C)c(Cl)c1	ZINC001049627882	1347941913	/nfs/dbraw/zinc/94/19/13/1347941913.db2.gz	VFOLBGBQUQRXHK-MOPGFXCFSA-N	0	3	344.886	3.280	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]2[C@H]1CCN2Cc1cccc(C#N)c1	ZINC001049635032	1347945642	/nfs/dbraw/zinc/94/56/42/1347945642.db2.gz	JFXOEGHMSGIWRL-RBUKOAKNSA-N	0	3	337.467	3.336	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]2[C@H]1CCN2CCOc1ccccc1	ZINC001049639168	1347948842	/nfs/dbraw/zinc/94/88/42/1347948842.db2.gz	NXBVZERTGBNHAZ-RTBURBONSA-N	0	3	342.483	3.343	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1c(C)[nH]c2ccccc21	ZINC001049681607	1347970389	/nfs/dbraw/zinc/97/03/89/1347970389.db2.gz	PJTGHHSEUZBCOI-NHCUHLMSSA-N	0	3	349.478	3.107	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1ccc(F)cc1Cl	ZINC001049688288	1347972086	/nfs/dbraw/zinc/97/20/86/1347972086.db2.gz	AAIRCDWBUFALEY-IRXDYDNUSA-N	0	3	336.838	3.273	20	30		EGEDHN
CC(F)(F)CC(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049694050	1347976107	/nfs/dbraw/zinc/97/61/07/1347976107.db2.gz	ANQIPFIMYATGKU-IAGOWNOFSA-N	0	3	347.409	3.169	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@@H]2CCCN3C(=O)C2CC3(CC3)C2)cc1	ZINC001049711184	1347985970	/nfs/dbraw/zinc/98/59/70/1347985970.db2.gz	RQBIIPWCFUKDLT-PMACEKPBSA-N	0	3	349.478	3.314	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc2occc2s1	ZINC001049718266	1347989620	/nfs/dbraw/zinc/98/96/20/1347989620.db2.gz	LIZBECVYEHXKBN-KGLIPLIRSA-N	0	3	328.437	3.197	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(F)c(F)c(F)c1	ZINC001049743602	1347996877	/nfs/dbraw/zinc/99/68/77/1347996877.db2.gz	QOGWDPJHLMIYQI-HOTGVXAUSA-N	0	3	338.373	3.359	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1cccc(Cl)c1F	ZINC001049747848	1347998313	/nfs/dbraw/zinc/99/83/13/1347998313.db2.gz	KUQGBRGGEVDKIZ-JKSUJKDBSA-N	0	3	336.838	3.273	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1cccc(Cl)c1F	ZINC001049747847	1347998554	/nfs/dbraw/zinc/99/85/54/1347998554.db2.gz	KUQGBRGGEVDKIZ-HZPDHXFCSA-N	0	3	336.838	3.273	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](CC)Cc1ccccc1	ZINC001049763996	1348008784	/nfs/dbraw/zinc/00/87/84/1348008784.db2.gz	STEFJRGJGBARQQ-QHAWAJNXSA-N	0	3	338.495	3.344	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C1(Cc2ccccc2F)CC1	ZINC001049784350	1348020485	/nfs/dbraw/zinc/02/04/85/1348020485.db2.gz	VWDSQTQZILEKSA-RBUKOAKNSA-N	0	3	342.458	3.400	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1cccc(C)c1	ZINC001049784793	1348020605	/nfs/dbraw/zinc/02/06/05/1348020605.db2.gz	XNZOZJFFEMHGFT-BQJUDKOJSA-N	0	3	336.479	3.187	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C(C)(C)c1ccccc1F	ZINC001049788820	1348022623	/nfs/dbraw/zinc/02/26/23/1348022623.db2.gz	RIDVDPGINXUBDU-ZWKOTPCHSA-N	0	3	330.447	3.355	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(OC)cc1Cl	ZINC001049793853	1348024174	/nfs/dbraw/zinc/02/41/74/1348024174.db2.gz	QYIMGPDTVIFFAD-DLBZAZTESA-N	0	3	334.847	3.214	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cnn(C2CCCCC2)c1	ZINC001049830616	1348044747	/nfs/dbraw/zinc/04/47/47/1348044747.db2.gz	HHHYLEYMHJUIEN-OALUTQOASA-N	0	3	342.487	3.253	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cnn(CCCC)c1CC	ZINC001049835237	1348048261	/nfs/dbraw/zinc/04/82/61/1348048261.db2.gz	HBAGEHILKNWUNZ-RTBURBONSA-N	0	3	344.503	3.111	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H]1CCCc2sc(C)nc21	ZINC001049844543	1348054533	/nfs/dbraw/zinc/05/45/33/1348054533.db2.gz	QVLKFSVZFOIJGH-ARFHVFGLSA-N	0	3	345.512	3.123	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(F)c(F)c(F)c1F	ZINC001049853887	1348060538	/nfs/dbraw/zinc/06/05/38/1348060538.db2.gz	HSOPJKJYAVPWIS-STQMWFEESA-N	0	3	342.336	3.108	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(C)nc2ccccc21	ZINC001049871553	1348077578	/nfs/dbraw/zinc/07/75/78/1348077578.db2.gz	MLLLMXVKJLCLPW-WOJBJXKFSA-N	0	3	335.451	3.408	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)CCc1c[nH]c2ccccc12	ZINC001049876720	1348081726	/nfs/dbraw/zinc/08/17/26/1348081726.db2.gz	LRENFHBXPXIKEH-RTWAWAEBSA-N	0	3	349.478	3.189	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)C12CC(c3ccccc3)(C1)C2	ZINC001049916983	1348111117	/nfs/dbraw/zinc/11/11/17/1348111117.db2.gz	KCJMZFRPAGWGSF-ONZKCSKKSA-N	0	3	336.479	3.360	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](CC)c1ccc(F)cc1	ZINC001049917660	1348111492	/nfs/dbraw/zinc/11/14/92/1348111492.db2.gz	NPCJWDILNHFHGY-SLFFLAALSA-N	0	3	342.458	3.408	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(C)c2c1CCC2	ZINC001049918150	1348111725	/nfs/dbraw/zinc/11/17/25/1348111725.db2.gz	PZKFLTOYOWQMII-NHCUHLMSSA-N	0	3	336.479	3.186	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](C)Cc1cccc(F)c1	ZINC001049923517	1348115098	/nfs/dbraw/zinc/11/50/98/1348115098.db2.gz	MZNCIHHUADRJOT-KFKAGJAMSA-N	0	3	330.447	3.256	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc2c(cccc2C)o1	ZINC001049924639	1348115934	/nfs/dbraw/zinc/11/59/34/1348115934.db2.gz	SIYXIZQZOPSKEM-QZTJIDSGSA-N	0	3	336.435	3.443	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)C(C)(C)c1ccccc1OC	ZINC001049933744	1348121082	/nfs/dbraw/zinc/12/10/82/1348121082.db2.gz	SAIWJJPQVHRNOQ-MSOLQXFVSA-N	0	3	342.483	3.224	20	30		EGEDHN
C/C(=C\C(=O)N1CCC[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21)C1CC1	ZINC001049987635	1348145389	/nfs/dbraw/zinc/14/53/89/1348145389.db2.gz	OVZZEYVYSYOQRP-DJRZKHRSSA-N	0	3	349.478	3.337	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H]2CN(Cc3cccc(C#N)c3)C[C@H]21)C1CC1	ZINC001050010465	1348153260	/nfs/dbraw/zinc/15/32/60/1348153260.db2.gz	QYELTQBZPRSTGZ-UIAACRFSSA-N	0	3	337.467	3.027	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3cnn(C(C)(C)C)c3C)[C@@H]2C1	ZINC001050060459	1348169788	/nfs/dbraw/zinc/16/97/88/1348169788.db2.gz	XXKWJLXSCZPFCM-FUHWJXTLSA-N	0	3	344.503	3.059	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3ccc4nc(C)oc4c3)[C@@H]2C1	ZINC001050070123	1348172065	/nfs/dbraw/zinc/17/20/65/1348172065.db2.gz	XUHTVMFYXHZRCN-FUHWJXTLSA-N	0	3	339.439	3.249	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)COc3ccc(C(C)C)cc3)[C@@H]2C1	ZINC001050090057	1348179614	/nfs/dbraw/zinc/17/96/14/1348179614.db2.gz	ZNWFWAUSHPZRLU-AZUAARDMSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cnc4c(F)cccc4c3)[C@@H]2C1	ZINC001050096639	1348181601	/nfs/dbraw/zinc/18/16/01/1348181601.db2.gz	UICLPLBCHYGYKT-MAUKXSAKSA-N	0	3	339.414	3.096	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)CCc3ccc4[nH]ccc4c3)[C@@H]2C1	ZINC001050095862	1348181797	/nfs/dbraw/zinc/18/17/97/1348181797.db2.gz	BIMONJBWRFSKFY-PZJWPPBQSA-N	0	3	349.478	3.047	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CCC[C@H]2CN(Cc3cccc(C#N)c3)C[C@H]21	ZINC001050154029	1348198730	/nfs/dbraw/zinc/19/87/30/1348198730.db2.gz	JSCDPLYTCYSFQT-LSTHTHJFSA-N	0	3	339.483	3.273	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)C[C@@H]4C=CCC4)C3)CC2)c1	ZINC001050425348	1348261946	/nfs/dbraw/zinc/26/19/46/1348261946.db2.gz	NAWKPYHYYVIPSS-GOSISDBHSA-N	0	3	349.478	3.339	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3coc4cc(F)ccc34)C2)CC1	ZINC001050575006	1348292159	/nfs/dbraw/zinc/29/21/59/1348292159.db2.gz	AHNHTORWHDXDBG-UHFFFAOYSA-N	0	3	340.398	3.133	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H]3CCCC[C@H]3C3CC3)C2)CC1	ZINC001050603955	1348298933	/nfs/dbraw/zinc/29/89/33/1348298933.db2.gz	JAMUMMNAOKJEIE-OALUTQOASA-N	0	3	328.500	3.151	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC2(C1)CCN(Cc1oc(C)nc1C)CC2	ZINC001050614414	1348302924	/nfs/dbraw/zinc/30/29/24/1348302924.db2.gz	ZQKFMQZGASBBCF-UHFFFAOYSA-N	0	3	345.487	3.318	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1ocnc1C)CC2	ZINC001050651937	1348317120	/nfs/dbraw/zinc/31/71/20/1348317120.db2.gz	XCKRDRULRYTPEN-SFHVURJKSA-N	0	3	331.460	3.010	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C(C)(C)c3ccc(F)cc3)C2)CC1	ZINC001050733493	1348340808	/nfs/dbraw/zinc/34/08/08/1348340808.db2.gz	MFEQHEFDJRBEAZ-UHFFFAOYSA-N	0	3	342.458	3.051	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3cc(Cl)cc(Cl)c3)C2)CC1	ZINC001050737865	1348343078	/nfs/dbraw/zinc/34/30/78/1348343078.db2.gz	MQEAQUHBDZUCDS-UHFFFAOYSA-N	0	3	337.250	3.165	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H](C)c3ccc(F)cc3F)C2)CC1	ZINC001050759481	1348350621	/nfs/dbraw/zinc/35/06/21/1348350621.db2.gz	LPLDFOPLQFRRJV-HNNXBMFYSA-N	0	3	346.421	3.016	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@H](NC(=O)c3ccsc3)CC2)c1	ZINC001052180243	1348510626	/nfs/dbraw/zinc/51/06/26/1348510626.db2.gz	XUXSLJHBTKBHAW-GOSISDBHSA-N	0	3	339.464	3.404	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc(C)c3cccnc23)CC1	ZINC001052567720	1348581792	/nfs/dbraw/zinc/58/17/92/1348581792.db2.gz	HDSOECQLMLCYRQ-QGZVFWFLSA-N	0	3	335.451	3.151	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)Cc2ccc(C3CCC3)cc2)CC1	ZINC001052601380	1348591810	/nfs/dbraw/zinc/59/18/10/1348591810.db2.gz	IYYDLBSAQIDENW-OAQYLSRUSA-N	0	3	338.495	3.491	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H](NC(=O)C3CC4(CC4)C3)CC2)cc1	ZINC001052698940	1348640176	/nfs/dbraw/zinc/64/01/76/1348640176.db2.gz	SNMKPLXQAMNPEH-LJQANCHMSA-N	0	3	337.467	3.219	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2ccc(O[C@H](C)CC)cc2)CC1	ZINC001052848960	1348700706	/nfs/dbraw/zinc/70/07/06/1348700706.db2.gz	JEFHVQCLNHGBQL-AEFFLSMTSA-N	0	3	328.456	3.081	20	30		EGEDHN
CC(=O)N1CCC[C@H]([C@H]2CCCN(CC#Cc3ccc(F)cc3)C2)C1	ZINC001052998082	1348795501	/nfs/dbraw/zinc/79/55/01/1348795501.db2.gz	VGKQKARCFCPGMV-PMACEKPBSA-N	0	3	342.458	3.148	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2sccc2C)C1	ZINC001053062295	1348872753	/nfs/dbraw/zinc/87/27/53/1348872753.db2.gz	YDGBHARKMOOFGM-IAGOWNOFSA-N	0	3	330.497	3.396	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(Cl)o2)C1	ZINC001053067932	1348881323	/nfs/dbraw/zinc/88/13/23/1348881323.db2.gz	TWDIHXUDEQXRFO-GJZGRUSLSA-N	0	3	334.847	3.273	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)COC2CCCCC2)C1	ZINC001053086915	1348909891	/nfs/dbraw/zinc/90/98/91/1348909891.db2.gz	GQLBGSARHZRLBY-AZUAARDMSA-N	0	3	346.515	3.062	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)Cc2ccccc2)C1	ZINC001053088492	1348912862	/nfs/dbraw/zinc/91/28/62/1348912862.db2.gz	WJHFHDRDLQYOQT-LEWJYISDSA-N	0	3	338.495	3.346	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)Cc2occc2C)C1	ZINC001053093823	1348922964	/nfs/dbraw/zinc/92/29/64/1348922964.db2.gz	AECYGXWQXWTJMF-RBUKOAKNSA-N	0	3	342.483	3.247	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cc[nH]c2C(C)C)C1	ZINC001053094110	1348923007	/nfs/dbraw/zinc/92/30/07/1348923007.db2.gz	CTHHJQMNHQUWPC-HKUYNNGSSA-N	0	3	341.499	3.478	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cc[nH]c2CCC)C1	ZINC001053095806	1348925936	/nfs/dbraw/zinc/92/59/36/1348925936.db2.gz	LLAWOEOIDWSSLS-YLJYHZDGSA-N	0	3	341.499	3.307	20	30		EGEDHN
C=C(C)CCN1Cc2ccccc2C[C@@H]1CNC(=O)c1cc[nH]c1C	ZINC001054037109	1349133134	/nfs/dbraw/zinc/13/31/34/1349133134.db2.gz	XCNRVUZSFZZDPD-LJQANCHMSA-N	0	3	337.467	3.446	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)Cc1ccc(C)cc1Cl)C2	ZINC001054153982	1349157554	/nfs/dbraw/zinc/15/75/54/1349157554.db2.gz	NMXYTFHYJSQFDZ-HXUWFJFHSA-N	0	3	344.886	3.139	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc(F)ccc1CC)C2	ZINC001054160167	1349162125	/nfs/dbraw/zinc/16/21/25/1349162125.db2.gz	XODVZDDAGGVUJE-NRFANRHFSA-N	0	3	342.458	3.340	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc3cc(C)ccc3[nH]1)C2	ZINC001054173628	1349174359	/nfs/dbraw/zinc/17/43/59/1349174359.db2.gz	DFMSZSYRTYXUOE-OAQYLSRUSA-N	0	3	335.451	3.038	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@]2(CCN(Cc3cccnc3)C2)C1	ZINC001054192089	1349194078	/nfs/dbraw/zinc/19/40/78/1349194078.db2.gz	QWGXMCNKUIVYRE-NHCUHLMSSA-N	0	3	341.499	3.498	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(C)cc1Cl)C2	ZINC001054201066	1349202243	/nfs/dbraw/zinc/20/22/43/1349202243.db2.gz	SBMAIDSPWAQACF-IBGZPJMESA-N	0	3	330.859	3.210	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc(C(C)(C)C)oc1C)C2	ZINC001054204647	1349206240	/nfs/dbraw/zinc/20/62/40/1349206240.db2.gz	ZWATYFSBQWCOPC-NRFANRHFSA-N	0	3	342.483	3.447	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc([C@H](C)CC)no1)C2	ZINC001054209369	1349210628	/nfs/dbraw/zinc/21/06/28/1349210628.db2.gz	PPDGAEKFTMGTLJ-UZLBHIALSA-N	0	3	343.471	3.140	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)[C@H](C)c1ccc(CC)cc1)C2	ZINC001054214786	1349213897	/nfs/dbraw/zinc/21/38/97/1349213897.db2.gz	HAKVLBNZNOKHIV-GCJKJVERSA-N	0	3	338.495	3.300	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccccc1OCC)C2	ZINC001054237009	1349230201	/nfs/dbraw/zinc/23/02/01/1349230201.db2.gz	PYZWKPVWPSLCNW-NRFANRHFSA-N	0	3	340.467	3.037	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc3c(s1)CCCC3)C2	ZINC001054236868	1349230451	/nfs/dbraw/zinc/23/04/51/1349230451.db2.gz	OEAUHHSQIYUJEI-FQEVSTJZSA-N	0	3	342.508	3.188	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@H](C)c1ccc(F)c(F)c1)C2	ZINC001054243211	1349236920	/nfs/dbraw/zinc/23/69/20/1349236920.db2.gz	ZBTISSKPICVCLS-FOIQADDNSA-N	0	3	346.421	3.016	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)C[C@@H](C)c1ccc(F)cc1)C2	ZINC001054243819	1349237432	/nfs/dbraw/zinc/23/74/32/1349237432.db2.gz	OPXVOEYJLOVWAH-UTKZUKDTSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)CC(C)(C)c1ccccc1)C2	ZINC001054245646	1349239425	/nfs/dbraw/zinc/23/94/25/1349239425.db2.gz	XLHQYBBCHAUWGA-JOCHJYFZSA-N	0	3	338.495	3.302	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3cncs3)cc2C1	ZINC001054257347	1349252343	/nfs/dbraw/zinc/25/23/43/1349252343.db2.gz	HNSOAPIFSREUEM-UHFFFAOYSA-N	0	3	327.453	3.355	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@]34CCC[C@H]3OCC4)cc2C1	ZINC001054274148	1349274993	/nfs/dbraw/zinc/27/49/93/1349274993.db2.gz	UYUYCINEYPPHSU-CTNGQTDRSA-N	0	3	340.467	3.154	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@@H]3CCC[C@@H](OC)C3)cc2C1	ZINC001054278883	1349279679	/nfs/dbraw/zinc/27/96/79/1349279679.db2.gz	QECLVYJFTCRVRQ-YLJYHZDGSA-N	0	3	342.483	3.400	20	30		EGEDHN
Cc1cc(C(=O)N2C[C@H](NCc3ccc(C#N)s3)[C@@H](C)C2)c(C)o1	ZINC001054375007	1349340124	/nfs/dbraw/zinc/34/01/24/1349340124.db2.gz	IAEWWTVRXRRODX-GTNSWQLSSA-N	0	3	343.452	3.080	20	30		EGEDHN
Cc1cc(C)c(C(=O)N2C[C@H](NCc3ccc(C#N)s3)[C@@H](C)C2)o1	ZINC001054524959	1349383709	/nfs/dbraw/zinc/38/37/09/1349383709.db2.gz	MHBKYDZLRJUDAJ-LRDDRELGSA-N	0	3	343.452	3.080	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCC2CCC2)C[C@H]1NCc1ccc(C#N)s1	ZINC001054525238	1349384570	/nfs/dbraw/zinc/38/45/70/1349384570.db2.gz	NPRBQNPRNKKAAZ-CXAGYDPISA-N	0	3	331.485	3.137	20	30		EGEDHN
CCc1occc1C(=O)N1C[C@@H](C)[C@@H](NCc2ccc(C#N)s2)C1	ZINC001054615066	1349415158	/nfs/dbraw/zinc/41/51/58/1349415158.db2.gz	NZZMBBCOAGDHOZ-WBMJQRKESA-N	0	3	343.452	3.025	20	30		EGEDHN
C[C@H]1CN(C(=O)c2ccoc2Cl)C[C@H]1NCc1ccc(C#N)s1	ZINC001054615002	1349415410	/nfs/dbraw/zinc/41/54/10/1349415410.db2.gz	WNDLKZJBBAAGGO-IINYFYTJSA-N	0	3	349.843	3.116	20	30		EGEDHN
Cc1coc(C)c1C(=O)N1C[C@H](NCc2ccc(C#N)s2)[C@@H](C)C1	ZINC001054616399	1349415742	/nfs/dbraw/zinc/41/57/42/1349415742.db2.gz	AXSOVNDUOKYFPT-ZBEGNZNMSA-N	0	3	343.452	3.080	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H](C)[C@H](NCc2cc(C)ccc2OC)C1	ZINC001054966300	1349529932	/nfs/dbraw/zinc/52/99/32/1349529932.db2.gz	LYXXCZKVVCHKNV-DOTOQJQBSA-N	0	3	330.472	3.152	20	30		EGEDHN
CCC(C)(C)C(=O)N1C[C@H](NCc2ccc(C#N)c(F)c2)[C@@H](C)C1	ZINC001055026288	1349555593	/nfs/dbraw/zinc/55/55/93/1349555593.db2.gz	MMUZUDZNIZQILS-GUYCJALGSA-N	0	3	331.435	3.070	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C1CCC3(CC3)CC1)C[C@H](C)O2	ZINC001071189740	1354494896	/nfs/dbraw/zinc/49/48/96/1354494896.db2.gz	OWTSWMNOHVSWTJ-LAUBAEHRSA-N	0	3	346.515	3.225	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](C)O[C@@]2(CCN(CC=C(C)C)C2)C1	ZINC001071199897	1354500551	/nfs/dbraw/zinc/50/05/51/1354500551.db2.gz	QWLANHHFUGRFDB-FXAWDEMLSA-N	0	3	334.504	3.247	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1ccc(C)cc1F)C[C@@H](C)O2	ZINC001071213935	1354509081	/nfs/dbraw/zinc/50/90/81/1354509081.db2.gz	MMFWXZKTKBMGEK-OXQOHEQNSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C1CCC=CCC1)C[C@@H](C)O2	ZINC001071244552	1354524376	/nfs/dbraw/zinc/52/43/76/1354524376.db2.gz	WSRXUZXEKATECL-XLIONFOSSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1sccc1CC)C[C@@H](C)O2	ZINC001071244495	1354524876	/nfs/dbraw/zinc/52/48/76/1354524876.db2.gz	WGRNAWCHKSNQRZ-DNVCBOLYSA-N	0	3	348.512	3.192	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cnn(CC(C)C)c2CC)CC[C@@H]1C	ZINC001071501217	1354729918	/nfs/dbraw/zinc/72/99/18/1354729918.db2.gz	LQRBFMUISFNVFZ-IRXDYDNUSA-N	0	3	346.519	3.260	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cccc3scnc32)CC[C@H]1C	ZINC001071508086	1354732335	/nfs/dbraw/zinc/73/23/35/1354732335.db2.gz	HVGMFTSMCGXLMT-ZIAGYGMSSA-N	0	3	329.469	3.455	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cccc3scnc32)CC[C@@H]1C	ZINC001071508083	1354732892	/nfs/dbraw/zinc/73/28/92/1354732892.db2.gz	HVGMFTSMCGXLMT-KBPBESRZSA-N	0	3	329.469	3.455	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCCC[C@H](NCc2c(C)noc2C)C1	ZINC001088359323	1359843442	/nfs/dbraw/zinc/84/34/42/1359843442.db2.gz	WNQFFQABTXLHLZ-INIZCTEOSA-N	0	3	333.476	3.364	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2csc(C(F)(F)F)c2)CC[C@@H]1C	ZINC001071645879	1354823725	/nfs/dbraw/zinc/82/37/25/1354823725.db2.gz	ORBLECUWHVILDU-AAEUAGOBSA-N	0	3	344.402	3.373	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(C)c(Cl)c2F)CC[C@H]1C	ZINC001071701260	1354859765	/nfs/dbraw/zinc/85/97/65/1354859765.db2.gz	FRONDASDVWMKOI-KGLIPLIRSA-N	0	3	336.838	3.394	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc3cc(Cl)ccc3[nH]2)CC[C@@H]1C	ZINC001071728882	1354883685	/nfs/dbraw/zinc/88/36/85/1354883685.db2.gz	UYYNAKRCVGUPFE-XJKSGUPXSA-N	0	3	343.858	3.427	20	30		EGEDHN
C=C(C)CCN1C[C@H](NC(=O)c2nc(Cl)cs2)CC[C@H]1C	ZINC001071769418	1354915720	/nfs/dbraw/zinc/91/57/20/1354915720.db2.gz	QNABGZJWZZJRPZ-VXGBXAGGSA-N	0	3	327.881	3.345	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2cn(C)c3ccccc23)CC[C@H]1C	ZINC001071779723	1354927518	/nfs/dbraw/zinc/92/75/18/1354927518.db2.gz	ODYMRLIRHWIWMT-AEFFLSMTSA-N	0	3	339.483	3.266	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CC[C@@H](C)N(Cc3cccc(C)c3)C2)c1	ZINC001071813673	1354956177	/nfs/dbraw/zinc/95/61/77/1354956177.db2.gz	CYNWHNMPXRMMDX-UTKZUKDTSA-N	0	3	347.462	3.154	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccccc2OC2CCC2)CC[C@@H]1C	ZINC001071819631	1354959894	/nfs/dbraw/zinc/95/98/94/1354959894.db2.gz	WBUQFXYABCXLHW-DLBZAZTESA-N	0	3	340.467	3.224	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(C(C)C)nc2C)CC[C@@H]1C	ZINC001071827723	1354964904	/nfs/dbraw/zinc/96/49/04/1354964904.db2.gz	CCPWLUWBZZEQEO-DOTOQJQBSA-N	0	3	327.472	3.119	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)Cc2c[nH]c3c2cccc3C)CC[C@@H]1C	ZINC001071873317	1354998751	/nfs/dbraw/zinc/99/87/51/1354998751.db2.gz	UQVCEJUWWXUZOG-RDJZCZTQSA-N	0	3	325.456	3.174	20	30		EGEDHN
C=C(C)CCN1C[C@H](NC(=O)c2snnc2C(C)C)CC[C@@H]1C	ZINC001071919677	1355024376	/nfs/dbraw/zinc/02/43/76/1355024376.db2.gz	GCVKDUOYRFAKOT-UONOGXRCSA-N	0	3	336.505	3.210	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(C)nc2OCCC)CC[C@H]1C	ZINC001071937780	1355034449	/nfs/dbraw/zinc/03/44/49/1355034449.db2.gz	HISBVVNWMVIPRC-IAGOWNOFSA-N	0	3	345.487	3.338	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)Cc2cccc(OCCC)c2)CC[C@H]1C	ZINC001071969685	1355051372	/nfs/dbraw/zinc/05/13/72/1355051372.db2.gz	AUHDYPVJPROULQ-SJLPKXTDSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2c(C)nn(C(C)C)c2C)CC[C@@H]1C	ZINC001071982716	1355058178	/nfs/dbraw/zinc/05/81/78/1355058178.db2.gz	PSEDUMOEAYDSMP-MAUKXSAKSA-N	0	3	346.519	3.169	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc(C)nc3ccccc32)CC[C@@H]1C	ZINC001072049635	1355103717	/nfs/dbraw/zinc/10/37/17/1355103717.db2.gz	QFMMFLAMVVDNED-DLBZAZTESA-N	0	3	335.451	3.149	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2ccc(OCC)cc2)CC[C@@H]1C	ZINC001072049260	1355103752	/nfs/dbraw/zinc/10/37/52/1355103752.db2.gz	OLFMHQZAJXIGEL-WMZOPIPTSA-N	0	3	330.472	3.173	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cccc(OCC(C)C)c2)CC[C@@H]1C	ZINC001072058966	1355107666	/nfs/dbraw/zinc/10/76/66/1355107666.db2.gz	WCXOLGWEBVATHD-PKOBYXMFSA-N	0	3	342.483	3.327	20	30		EGEDHN
C#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)c2ccccc2)CC1	ZINC001072127333	1355143572	/nfs/dbraw/zinc/14/35/72/1355143572.db2.gz	RFABIOHRFACBFA-NRFANRHFSA-N	0	3	347.462	3.212	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@@H](C)[C@@H](CNCc2ccccc2C#N)C1	ZINC001072171778	1355166978	/nfs/dbraw/zinc/16/69/78/1355166978.db2.gz	PMJSOZUOCQCRPM-APWZRJJASA-N	0	3	325.456	3.099	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)c4ccc(F)cc4)C3)C2)c1	ZINC001072398071	1355271938	/nfs/dbraw/zinc/27/19/38/1355271938.db2.gz	XCBXSWPAYOEXIP-UHFFFAOYSA-N	0	3	349.409	3.045	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CN(C(=O)c4ccc(F)cc4)C3)C2)cc1	ZINC001072397871	1355272181	/nfs/dbraw/zinc/27/21/81/1355272181.db2.gz	QWXOQYHYPOAQFX-UHFFFAOYSA-N	0	3	349.409	3.045	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3scnc3C3CCCC3)C2)C1	ZINC001072898742	1355487858	/nfs/dbraw/zinc/48/78/58/1355487858.db2.gz	RBGVXQDWGFBSGD-UHFFFAOYSA-N	0	3	331.485	3.135	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)[C@]45C[C@H]4CCCC5)C3)C2)c1	ZINC001072964209	1355526835	/nfs/dbraw/zinc/52/68/35/1355526835.db2.gz	NTAUHKNPOKXNID-DENIHFKCSA-N	0	3	349.478	3.173	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc(F)c4ccccc34)C2)C1	ZINC001073007611	1355544825	/nfs/dbraw/zinc/54/48/25/1355544825.db2.gz	RNHVRRPZTZJDAR-UHFFFAOYSA-N	0	3	336.410	3.150	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3ccccc3OCC(C)C)C2)C1	ZINC001073062826	1355575851	/nfs/dbraw/zinc/57/58/51/1355575851.db2.gz	UETIHGQJBRVYML-UHFFFAOYSA-N	0	3	328.456	3.055	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3ccsc3C(F)(F)F)C2)C1	ZINC001073150587	1355628377	/nfs/dbraw/zinc/62/83/77/1355628377.db2.gz	XXFIZEWUKDMIBR-UHFFFAOYSA-N	0	3	330.375	3.101	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2ccc(C3CCC3)cc2)C1	ZINC001073625687	1355847416	/nfs/dbraw/zinc/84/74/16/1355847416.db2.gz	HXBULEKUADIMRY-FQEVSTJZSA-N	0	3	342.483	3.351	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2ccccc2CC(C)C)C1	ZINC001073904457	1355948245	/nfs/dbraw/zinc/94/82/45/1355948245.db2.gz	FNRDOXPYXZPMQS-LJQANCHMSA-N	0	3	344.499	3.282	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2ccccc2C(F)(F)F)C1	ZINC001080830548	1357747888	/nfs/dbraw/zinc/74/78/88/1357747888.db2.gz	ALHLANINDFONAA-IUODEOHRSA-N	0	3	326.362	3.332	20	30		EGEDHN
C=C[C@@H](C(=O)N1CC[C@H](NCc2ccns2)[C@@H]1C)c1ccccc1	ZINC001075124942	1356319713	/nfs/dbraw/zinc/31/97/13/1356319713.db2.gz	ODKWUJUKRNPHFN-QGTPRVQTSA-N	0	3	341.480	3.192	20	30		EGEDHN
C=CCN1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)c2ccoc2)C1	ZINC001075419029	1356363271	/nfs/dbraw/zinc/36/32/71/1356363271.db2.gz	OHABBSCAPOGSTI-IEBWSBKVSA-N	0	3	342.414	3.440	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3cc4ccccc4cc3F)[C@@H]2C1	ZINC001076029570	1356469376	/nfs/dbraw/zinc/46/93/76/1356469376.db2.gz	SHIGUIIZYGIQHF-FXAWDEMLSA-N	0	3	336.410	3.149	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3coc4cc(C)c(C)cc43)[C@@H]2C1	ZINC001076083797	1356485503	/nfs/dbraw/zinc/48/55/03/1356485503.db2.gz	RSUSFYOTNVQNPY-QFBILLFUSA-N	0	3	336.435	3.219	20	30		EGEDHN
C=CCCN1C[C@@H]2CCN(C(=O)c3ccc(C(F)(F)F)s3)[C@@H]2C1	ZINC001076627125	1356637913	/nfs/dbraw/zinc/63/79/13/1356637913.db2.gz	RPNJMGWHTYJJMY-NWDGAFQWSA-N	0	3	344.402	3.489	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)Cc3c(C)oc4ccccc43)[C@@H]2C1	ZINC001076649867	1356641859	/nfs/dbraw/zinc/64/18/59/1356641859.db2.gz	DVGRGSVNUVOTCD-QFBILLFUSA-N	0	3	338.451	3.393	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@H](C)c2ccsc2)C[C@H]1C(F)(F)F	ZINC001099306007	1363741107	/nfs/dbraw/zinc/74/11/07/1363741107.db2.gz	JHEIMGPCWAQFQL-MRVWCRGKSA-N	0	3	346.418	3.407	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc(Cl)cn2C)C12CCC2	ZINC001078676568	1357050718	/nfs/dbraw/zinc/05/07/18/1357050718.db2.gz	YLWCXBODGVWZNN-KBPBESRZSA-N	0	3	342.270	3.062	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2ccc(C)c(C)n2)C12CCC2	ZINC001078679491	1357052797	/nfs/dbraw/zinc/05/27/97/1357052797.db2.gz	CGOLRRFBVXZHLK-CVEARBPZSA-N	0	3	333.863	3.082	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@H](NC(=O)C2(C)CCC2)C12CCC2	ZINC001078701259	1357061820	/nfs/dbraw/zinc/06/18/20/1357061820.db2.gz	YVCOFCGSUDXOGK-OLZOCXBDSA-N	0	3	341.293	3.102	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2C[C@H](NCc3ccns3)C23CCC3)C1	ZINC001078720585	1357065529	/nfs/dbraw/zinc/06/55/29/1357065529.db2.gz	NJMOGMIPQLCOFX-LSDHHAIUSA-N	0	3	331.485	3.016	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)Cc2ccsc2C)C12CCC2	ZINC001078742526	1357067969	/nfs/dbraw/zinc/06/79/69/1357067969.db2.gz	XOBACNFQGSGROK-GJZGRUSLSA-N	0	3	338.904	3.369	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2ccc(OC3CCC3)cc2)C1	ZINC001080976575	1357772315	/nfs/dbraw/zinc/77/23/15/1357772315.db2.gz	BGSNPWHOJSIVHM-DNVCBOLYSA-N	0	3	328.456	3.244	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2cccc(C3CC3)c2)C[C@H]1c1ccccc1	ZINC001081233098	1357851979	/nfs/dbraw/zinc/85/19/79/1357851979.db2.gz	RGIATOWCLZIZRC-FCHUYYIVSA-N	0	3	344.458	3.395	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2coc3ccccc23)C[C@H]1c1ccccc1	ZINC001081233845	1357852089	/nfs/dbraw/zinc/85/20/89/1357852089.db2.gz	NTZPLPOJEBNHSP-AZUAARDMSA-N	0	3	344.414	3.264	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)[C@]2(C)CCC(C)=C(C)C2)[C@H](OC)C1	ZINC001082390766	1358025461	/nfs/dbraw/zinc/02/54/61/1358025461.db2.gz	CQXIHVGHVFCERK-QWFCFKBJSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)[C@@H]3CCC=CCCC3)[C@H]2C1	ZINC001083119425	1358120027	/nfs/dbraw/zinc/12/00/27/1358120027.db2.gz	RUNYDINTCUPRTA-CEXWTWQISA-N	0	3	332.488	3.001	20	30		EGEDHN
C[Si](C)(C)C#Cc1cccc(NC(=O)C23CCCN2CCC3)c1	ZINC001183558908	1387319045	/nfs/dbraw/zinc/31/90/45/1387319045.db2.gz	QOKGHZSYXLVVRD-UHFFFAOYSA-N	0	3	326.516	3.482	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3scnc3C(F)F)[C@@H]2C1	ZINC001084511389	1358229125	/nfs/dbraw/zinc/22/91/25/1358229125.db2.gz	WHQDZPJKFIODKD-VXGBXAGGSA-N	0	3	341.427	3.193	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3csc(-c4ccoc4)n3)[C@@H]2C1	ZINC001084727583	1358293856	/nfs/dbraw/zinc/29/38/56/1358293856.db2.gz	QSYNQHJACQDNHS-CZUORRHYSA-N	0	3	343.452	3.126	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3sccc3COC)[C@@H]2C1	ZINC001084773864	1358306043	/nfs/dbraw/zinc/30/60/43/1358306043.db2.gz	HGJMXKBZNRIGTB-GDBMZVCRSA-N	0	3	334.485	3.007	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)Cc3c(F)cccc3Cl)[C@@H]2C1	ZINC001084794108	1358312782	/nfs/dbraw/zinc/31/27/82/1358312782.db2.gz	JYDUXLGTOKHTIM-CXAGYDPISA-N	0	3	336.838	3.130	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@H]3Cc4ccc(Cl)cc43)[C@@H]2C1	ZINC001084804500	1358315521	/nfs/dbraw/zinc/31/55/21/1358315521.db2.gz	UKSDOLHSHMLJAC-FHLIZLRMSA-N	0	3	330.859	3.089	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)C(CC)(CC)c3ccccc3)[C@@H]2C1	ZINC001084846067	1358327070	/nfs/dbraw/zinc/32/70/70/1358327070.db2.gz	RLTOHJSYGGVLDV-UYAOXDASSA-N	0	3	338.495	3.300	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)C3CC(c4ccc(F)cc4)C3)[C@@H]2C1	ZINC001084869601	1358336299	/nfs/dbraw/zinc/33/62/99/1358336299.db2.gz	VCIOIUYHHMSCSQ-CKVGWXAMSA-N	0	3	342.458	3.428	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@H]3CCc4c3cccc4Cl)C[C@@H]21	ZINC001084990910	1358361342	/nfs/dbraw/zinc/36/13/42/1358361342.db2.gz	NQYQTZPDZNBBKG-LJHODMEESA-N	0	3	344.886	3.479	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H]2CCN(CCc3ccns3)[C@H]2C1	ZINC001085024454	1358370301	/nfs/dbraw/zinc/37/03/01/1358370301.db2.gz	XZWMVMKTWJJLIN-HHXXYDBFSA-N	0	3	347.528	3.211	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@H](CC)Cc3ccccc3)C[C@@H]21	ZINC001085047425	1358377792	/nfs/dbraw/zinc/37/77/92/1358377792.db2.gz	PNLXYXUCSFCGDX-NJYVYQBISA-N	0	3	338.495	3.201	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C[C@H](C)c3ccc(F)cc3)C[C@@H]21	ZINC001085099236	1358390911	/nfs/dbraw/zinc/39/09/11/1358390911.db2.gz	KBNKTUFCFVDQHT-HQRMLTQVSA-N	0	3	342.458	3.265	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1nc2c(s1)CCC2	ZINC001085273414	1358448844	/nfs/dbraw/zinc/44/88/44/1358448844.db2.gz	FJMUOKNOUAYKJD-VXGBXAGGSA-N	0	3	339.892	3.015	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cccc2nccnc21	ZINC001085373514	1358481358	/nfs/dbraw/zinc/48/13/58/1358481358.db2.gz	TUTRIWWJWOQMDX-HUUCEWRRSA-N	0	3	344.846	3.013	20	30		EGEDHN
CC[C@@H](c1ccccc1)N1CC[C@@H]1CN(C)C(=O)c1ccc(C#N)[nH]1	ZINC001085542546	1358582084	/nfs/dbraw/zinc/58/20/84/1358582084.db2.gz	ADSMXFAXYGIGOJ-MJGOQNOKSA-N	0	3	336.439	3.184	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@@H]1CC[C@H](c2ccccc2)O1	ZINC001085599362	1358624664	/nfs/dbraw/zinc/62/46/64/1358624664.db2.gz	PJZODNIHCYHEQT-AQNXPRMDSA-N	0	3	342.483	3.406	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC001085672613	1358677401	/nfs/dbraw/zinc/67/74/01/1358677401.db2.gz	CAXHTMRHNMBUKJ-RRFJBIMHSA-N	0	3	330.394	3.240	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N(C)C[C@H]1CCN1CC1CCC1	ZINC001085678664	1358681305	/nfs/dbraw/zinc/68/13/05/1358681305.db2.gz	OYAVWLNTGXVJJW-QGZVFWFLSA-N	0	3	328.456	3.198	20	30		EGEDHN
C=CCOc1ccc(C(=O)N(C)C[C@@H]2CCN2CC[C@@H](C)F)cc1	ZINC001085679008	1358682636	/nfs/dbraw/zinc/68/26/36/1358682636.db2.gz	YGSZYROAQWOWBQ-WBVHZDCISA-N	0	3	334.435	3.146	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1cn(CC)c2ccccc12	ZINC001085709440	1358702328	/nfs/dbraw/zinc/70/23/28/1358702328.db2.gz	HYDVAQYLBWCIRJ-MRXNPFEDSA-N	0	3	325.456	3.384	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)[C@H]1CCc2c1cccc2Cl	ZINC001085726119	1358713888	/nfs/dbraw/zinc/71/38/88/1358713888.db2.gz	PMURCKFREFKNGF-PBHICJAKSA-N	0	3	332.875	3.479	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc(N2CC=CC2)cc1	ZINC001085816287	1358792418	/nfs/dbraw/zinc/79/24/18/1358792418.db2.gz	SKRFXPXADYSDLM-HXUWFJFHSA-N	0	3	339.483	3.175	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1ccccc1OCC(C)C	ZINC001085878374	1358843166	/nfs/dbraw/zinc/84/31/66/1358843166.db2.gz	ZWHUNYARSKTUGJ-KRWDZBQOSA-N	0	3	330.472	3.444	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1ccc(OC)c(C2CC2)c1	ZINC001085898610	1358856950	/nfs/dbraw/zinc/85/69/50/1358856950.db2.gz	JJROVKBNMRTWSJ-QGZVFWFLSA-N	0	3	328.456	3.295	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C[C@H]2CCN2[C@H](CC)c2ccccc2)nc1	ZINC001085934079	1358889707	/nfs/dbraw/zinc/88/97/07/1358889707.db2.gz	RCJAKRSSYUEIAJ-TZIWHRDSSA-N	0	3	347.462	3.361	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc(C)n(C(C)(C)C)n1	ZINC001085973936	1358928774	/nfs/dbraw/zinc/92/87/74/1358928774.db2.gz	KADVMPUKIJDZNJ-INIZCTEOSA-N	0	3	332.492	3.059	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@H]1Cc2cc(C)c(C)cc2O1	ZINC001085982915	1358934907	/nfs/dbraw/zinc/93/49/07/1358934907.db2.gz	UTROEGJLSQISIF-AZUAARDMSA-N	0	3	342.483	3.106	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@@H]1Cc2cc(C)c(C)cc2O1	ZINC001085982917	1358935332	/nfs/dbraw/zinc/93/53/32/1358935332.db2.gz	UTROEGJLSQISIF-QUCCMNQESA-N	0	3	342.483	3.106	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2c(F)cc(C)cc2F)C1	ZINC001086144333	1359007550	/nfs/dbraw/zinc/00/75/50/1359007550.db2.gz	LBFWNDKHILXEGK-TXEJJXNPSA-N	0	3	328.790	3.124	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)[C@H]2CCC(C)(C)C2)C1	ZINC001086191639	1359023000	/nfs/dbraw/zinc/02/30/00/1359023000.db2.gz	BKEUKWSCFRBGHN-MELADBBJSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2C[C@@H](NCc3c(C)onc3CC)C2)CC1	ZINC001086187099	1359020811	/nfs/dbraw/zinc/02/08/11/1359020811.db2.gz	GFXJPFXSLAYOJN-WOVMCDHWSA-N	0	3	345.487	3.276	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2C[C@@H](NCc3ccncc3Cl)C2)CC1	ZINC001086187297	1359020930	/nfs/dbraw/zinc/02/09/30/1359020930.db2.gz	OTZLHONIBKBMCK-KDYLLFBJSA-N	0	3	347.890	3.466	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(C)c(OCC)c2)C1	ZINC001086215533	1359029648	/nfs/dbraw/zinc/02/96/48/1359029648.db2.gz	RPKVGSLYPKKVLH-FZNQNYSPSA-N	0	3	336.863	3.244	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@H]2C[C@H](NCC(=C)Cl)C2)cc1	ZINC001086403995	1359089234	/nfs/dbraw/zinc/08/92/34/1359089234.db2.gz	LLGRRADMXYGUPN-KOMQPUFPSA-N	0	3	334.847	3.102	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc3cc(F)ccc3[nH]2)C1	ZINC001086443524	1359098078	/nfs/dbraw/zinc/09/80/78/1359098078.db2.gz	AXZQAFXZCKDMFU-YEORSEQZSA-N	0	3	335.810	3.158	20	30		EGEDHN
CC1(C)CC[C@@H]1C(=O)NC[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001086451632	1359100334	/nfs/dbraw/zinc/10/03/34/1359100334.db2.gz	RGZGOGDJWWJVNQ-DJIMGWMZSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(C)cc2Cl)C1	ZINC001086486579	1359115560	/nfs/dbraw/zinc/11/55/60/1359115560.db2.gz	DWFPQTXYTPMYQC-JOCQHMNTSA-N	0	3	327.255	3.499	20	30		EGEDHN
CC[C@]1(C)C[C@H]1C(=O)NC[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001086520414	1359128597	/nfs/dbraw/zinc/12/85/97/1359128597.db2.gz	FCAVKWUNBPCAMK-JWWIWJDOSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cnc(CC(C)C)s2)C1	ZINC001086564520	1359149339	/nfs/dbraw/zinc/14/93/39/1359149339.db2.gz	ORIJEJOQGNKCDR-JOCQHMNTSA-N	0	3	341.908	3.192	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccc(F)c(F)c2)C1	ZINC001086717386	1359190950	/nfs/dbraw/zinc/19/09/50/1359190950.db2.gz	VENCGKCTIUYLLT-WCQYABFASA-N	0	3	328.790	3.205	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccnc(CCC)c2)C1	ZINC001086723839	1359191504	/nfs/dbraw/zinc/19/15/04/1359191504.db2.gz	XYGSCZCTIMYSDE-WMLDXEAASA-N	0	3	335.879	3.275	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)[C@H]2CCCc3cccnc32)C1	ZINC001086784728	1359201284	/nfs/dbraw/zinc/20/12/84/1359201284.db2.gz	OMPIZVKANOTWOJ-UAGQMJEPSA-N	0	3	347.890	3.129	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)[C@H]2C[C@@H]2c2ccccc2)C1	ZINC001086821654	1359209017	/nfs/dbraw/zinc/20/90/17/1359209017.db2.gz	VNYKTGIUZCNYFF-HPBDAGMYSA-N	0	3	332.875	3.417	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cc(CC(C)C)c[nH]2)C1	ZINC001086855479	1359214441	/nfs/dbraw/zinc/21/44/41/1359214441.db2.gz	AYXOFIGOUIRFCA-GOEBONIOSA-N	0	3	337.895	3.454	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccc(F)cc2F)C1	ZINC001086867367	1359217353	/nfs/dbraw/zinc/21/73/53/1359217353.db2.gz	HCNSWHQGAVKURE-WCQYABFASA-N	0	3	328.790	3.205	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc(C)nc(C)c3)C2)CC1	ZINC001086925363	1359250721	/nfs/dbraw/zinc/25/07/21/1359250721.db2.gz	UUAHPZARNZIVLB-GOSISDBHSA-N	0	3	339.483	3.038	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3cc(Cl)cn3C)C2)CC1	ZINC001086931815	1359255898	/nfs/dbraw/zinc/25/58/98/1359255898.db2.gz	RTFRYZYIFXFNAD-HNNXBMFYSA-N	0	3	347.890	3.018	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)C[C@@H]3CCCC3(F)F)C2)CC1	ZINC001086939194	1359261587	/nfs/dbraw/zinc/26/15/87/1359261587.db2.gz	KCOVCPVBPRKIKO-HOTGVXAUSA-N	0	3	338.442	3.148	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)[C@H](C)c3ccc(C)o3)C2)CC1	ZINC001086946883	1359267941	/nfs/dbraw/zinc/26/79/41/1359267941.db2.gz	KTJOHNFGLFFWCF-FUHWJXTLSA-N	0	3	342.483	3.418	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3cc4ccccn4c3)C2)CC1	ZINC001086947181	1359268671	/nfs/dbraw/zinc/26/86/71/1359268671.db2.gz	RJIZAEFGXSYGNK-SFHVURJKSA-N	0	3	349.478	3.279	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc4ccccn4c3)C2)CC1	ZINC001086947180	1359268757	/nfs/dbraw/zinc/26/87/57/1359268757.db2.gz	RJIZAEFGXSYGNK-GOSISDBHSA-N	0	3	349.478	3.279	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@H](C)c3cc(C)oc3C)C2)CC1	ZINC001086949024	1359270275	/nfs/dbraw/zinc/27/02/75/1359270275.db2.gz	PIWRFUBYBWPPRL-NVXWUHKLSA-N	0	3	342.483	3.336	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cccc4ccncc43)C2)CC1	ZINC001086952079	1359272031	/nfs/dbraw/zinc/27/20/31/1359272031.db2.gz	ZPMDNAXQGHJZHE-QGZVFWFLSA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)C3(F)CCCCC3)C2)CC1	ZINC001086951731	1359272076	/nfs/dbraw/zinc/27/20/76/1359272076.db2.gz	ODRFDFZEWJKRIC-QGZVFWFLSA-N	0	3	334.479	3.385	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc(C)c(F)c(C)c3)C2)CC1	ZINC001086956332	1359277133	/nfs/dbraw/zinc/27/71/33/1359277133.db2.gz	KXDNKYGHCWENKN-QGZVFWFLSA-N	0	3	342.458	3.392	20	30		EGEDHN
C=C(C)C[N@@H+]1CCC[C@@H]2[C@H](NC(=O)c3ccccc3[O-])C(C)(C)[C@H]21	ZINC001087271541	1359345087	/nfs/dbraw/zinc/34/50/87/1359345087.db2.gz	SSCFMEKYLNLVPL-NJAFHUGGSA-N	0	3	328.456	3.187	20	30		EGEDHN
C=C(C)C[N@H+]1CCC[C@@H]2[C@H](NC(=O)c3ccccc3[O-])C(C)(C)[C@H]21	ZINC001087271541	1359345092	/nfs/dbraw/zinc/34/50/92/1359345092.db2.gz	SSCFMEKYLNLVPL-NJAFHUGGSA-N	0	3	328.456	3.187	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(C)cs3)C(C)(C)[C@H]21	ZINC001087285421	1359364162	/nfs/dbraw/zinc/36/41/62/1359364162.db2.gz	YFFJLBWBHFVUDU-OIISXLGYSA-N	0	3	330.497	3.299	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)Cc1ccccc1CC	ZINC001087290645	1359370355	/nfs/dbraw/zinc/37/03/55/1359370355.db2.gz	GJJJQBISHWJUDI-HLAWJBBLSA-N	0	3	338.495	3.030	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3occ4c3CCC4)C(C)(C)[C@@H]21	ZINC001087297000	1359378607	/nfs/dbraw/zinc/37/86/07/1359378607.db2.gz	JMYUPMMJJCLVAM-BHIYHBOVSA-N	0	3	340.467	3.010	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(CCC)cc3)C(C)(C)[C@@H]21	ZINC001087301225	1359384298	/nfs/dbraw/zinc/38/42/98/1359384298.db2.gz	ZPESGDUORHNOKZ-VAMGGRTRSA-N	0	3	338.495	3.491	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc(CCC)cc1	ZINC001087301224	1359384423	/nfs/dbraw/zinc/38/44/23/1359384423.db2.gz	ZPESGDUORHNOKZ-HSALFYBXSA-N	0	3	338.495	3.491	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3csc(C)c3)C(C)(C)[C@H]21	ZINC001087308266	1359395318	/nfs/dbraw/zinc/39/53/18/1359395318.db2.gz	NSERDKGWYKICFC-IKGGRYGDSA-N	0	3	330.497	3.299	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(F)cc3F)C(C)(C)[C@@H]21	ZINC001087316670	1359407644	/nfs/dbraw/zinc/40/76/44/1359407644.db2.gz	VZZHLYKUIXQSAC-KBAYOESNSA-N	0	3	346.421	3.207	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(CC)c(C)s3)C(C)(C)[C@H]21	ZINC001087316904	1359408042	/nfs/dbraw/zinc/40/80/42/1359408042.db2.gz	ZBUPXZBDIYEQCO-NXHRZFHOSA-N	0	3	344.524	3.471	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3sccc3CC)C(C)(C)[C@@H]21	ZINC001087317682	1359409217	/nfs/dbraw/zinc/40/92/17/1359409217.db2.gz	LIUFIUWPZNJFDS-DJIMGWMZSA-N	0	3	330.497	3.163	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3c(C)nsc3C)C(C)(C)[C@@H]21	ZINC001087319578	1359412354	/nfs/dbraw/zinc/41/23/54/1359412354.db2.gz	QBKCBMODBCZDFC-DJIMGWMZSA-N	0	3	345.512	3.002	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)[C@H]2CCC2(F)F)CCN1Cc1ccc(C#N)cc1	ZINC001087618649	1359556439	/nfs/dbraw/zinc/55/64/39/1359556439.db2.gz	FHSNYIKPNQZZNK-IXDOHACOSA-N	0	3	347.409	3.073	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2cc(C(CC)CC)no2)[C@H]1CC	ZINC001087753301	1359628782	/nfs/dbraw/zinc/62/87/82/1359628782.db2.gz	BIWKHNNKFQTIGA-DOTOQJQBSA-N	0	3	331.460	3.184	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cccc(C(F)(F)F)n2)[C@H]1CC	ZINC001087772257	1359636274	/nfs/dbraw/zinc/63/62/74/1359636274.db2.gz	YUHYLDZMFNOOHV-GXTWGEPZSA-N	0	3	341.377	3.259	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)[C@@H](C)c2cccc(Cl)c2)[C@H]1CC	ZINC001087835583	1359671402	/nfs/dbraw/zinc/67/14/02/1359671402.db2.gz	HAYRGRZJWRGXNY-JCGIZDLHSA-N	0	3	332.875	3.436	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cccc3c2OCC3(C)C)[C@H]1CC	ZINC001087851638	1359680724	/nfs/dbraw/zinc/68/07/24/1359680724.db2.gz	HRSRJZXJRIBHHA-DLBZAZTESA-N	0	3	328.456	3.125	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2cscc2C(F)(F)F)[C@H]1CC	ZINC001087852274	1359681142	/nfs/dbraw/zinc/68/11/42/1359681142.db2.gz	NQQYUACXVCYRSY-UONOGXRCSA-N	0	3	344.402	3.373	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)Cc2c(C)oc3ccccc32)[C@H]1CC	ZINC001087853052	1359682268	/nfs/dbraw/zinc/68/22/68/1359682268.db2.gz	WDSXVWFWERKJIR-ZWKOTPCHSA-N	0	3	326.440	3.439	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CN(C(=O)CC4CCC4)C[C@@H]3C2)c1	ZINC001087921317	1359707827	/nfs/dbraw/zinc/70/78/27/1359707827.db2.gz	YEGDEZDLBIKHMV-UXHICEINSA-N	0	3	337.467	3.029	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CCN(Cc4cnccc4C)C[C@H]3C2)C1	ZINC001088098088	1359755184	/nfs/dbraw/zinc/75/51/84/1359755184.db2.gz	USVZCEDNZXBVPQ-MJGOQNOKSA-N	0	3	339.483	3.027	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3cc4c(s3)CCCCC4)C[C@@H]2C1	ZINC001088190812	1359788916	/nfs/dbraw/zinc/78/89/16/1359788916.db2.gz	UHZJHAQOODAMOT-SJORKVTESA-N	0	3	342.508	3.044	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)Cc3ccc4ccccc4c3)C[C@@H]2C1	ZINC001088194610	1359790215	/nfs/dbraw/zinc/79/02/15/1359790215.db2.gz	NGGRDEDMOHGVGS-YADHBBJMSA-N	0	3	346.474	3.186	20	30		EGEDHN
C=C(Br)CN[C@H]1CCCCCN(C(=O)C(C)(C)F)C1	ZINC001088247372	1359817463	/nfs/dbraw/zinc/81/74/63/1359817463.db2.gz	QFPVVJFJMFSZEK-LBPRGKRZSA-N	0	3	335.261	3.004	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2cccc3cn[nH]c32)C1	ZINC001088356950	1359840643	/nfs/dbraw/zinc/84/06/43/1359840643.db2.gz	OJIHUIFUTAIVQF-OAHLLOKOSA-N	0	3	346.862	3.290	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2cccc3c[nH]nc32)C1	ZINC001088356950	1359840646	/nfs/dbraw/zinc/84/06/46/1359840646.db2.gz	OJIHUIFUTAIVQF-OAHLLOKOSA-N	0	3	346.862	3.290	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)[C@@H]2Cc3ccccc32)C1	ZINC001088371528	1359854106	/nfs/dbraw/zinc/85/41/06/1359854106.db2.gz	JWTLHUBPUIJRLP-FUHWJXTLSA-N	0	3	332.875	3.440	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2cnn(CCC)c2)C1	ZINC001088392331	1359869764	/nfs/dbraw/zinc/86/97/64/1359869764.db2.gz	GPTPXUAFNDAOPK-INIZCTEOSA-N	0	3	338.883	3.020	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2cn3ccccc3n2)C1	ZINC001088420855	1359890779	/nfs/dbraw/zinc/89/07/79/1359890779.db2.gz	AJJGHMIOMSHMNP-HNNXBMFYSA-N	0	3	346.862	3.061	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2c(C)onc2CC)C1	ZINC001088423920	1359893311	/nfs/dbraw/zinc/89/33/11/1359893311.db2.gz	GCYMESOFZVTSND-CQSZACIVSA-N	0	3	339.867	3.272	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2c(F)ccc3ccncc32)[C@H]1C	ZINC001088581252	1359978682	/nfs/dbraw/zinc/97/86/82/1359978682.db2.gz	GIKMRWKEMRCMHP-DYVFJYSZSA-N	0	3	327.403	3.143	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2ccc(OC)c(C(C)C)c2)[C@H]1C	ZINC001088710900	1360017530	/nfs/dbraw/zinc/01/75/30/1360017530.db2.gz	BJBVHFIMSJEHPF-QAPCUYQASA-N	0	3	328.456	3.035	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2ccc(Cl)cc2Cl)[C@H]1C	ZINC001088999094	1360131882	/nfs/dbraw/zinc/13/18/82/1360131882.db2.gz	HDZTTWAKIWBALG-ABAIWWIYSA-N	0	3	325.239	3.209	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccc(OC3CCC3)cc2)[C@H]1C	ZINC001089052705	1360148786	/nfs/dbraw/zinc/14/87/86/1360148786.db2.gz	SDIOFAVVFCCCLN-BEFAXECRSA-N	0	3	328.456	3.387	20	30		EGEDHN
Cc1cc(CN(C)C[C@@H]2CCCCN2C(=O)[C@H](C)C#N)c(C)s1	ZINC001089136939	1360195513	/nfs/dbraw/zinc/19/55/13/1360195513.db2.gz	QYHCQCUQCMCABJ-DYVFJYSZSA-N	0	3	333.501	3.338	20	30		EGEDHN
CCC(=O)N[C@@H]1CCN(Cc2ccc(OC)c(C#N)c2)CC(C)(C)C1	ZINC001089283256	1360302020	/nfs/dbraw/zinc/30/20/20/1360302020.db2.gz	IULPVIJMXVVRPV-QGZVFWFLSA-N	0	3	343.471	3.084	20	30		EGEDHN
CC(C)(F)C(=O)N[C@@H]1CCN(CC#Cc2ccccc2)CC(C)(C)C1	ZINC001089293967	1360311344	/nfs/dbraw/zinc/31/13/44/1360311344.db2.gz	VTFBCNBHDBYMFX-GOSISDBHSA-N	0	3	344.474	3.393	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2ccccc2CC)CC(C)(C)C1	ZINC001089416041	1360410165	/nfs/dbraw/zinc/41/01/65/1360410165.db2.gz	FWMFVEAJUALRMZ-IBGZPJMESA-N	0	3	326.484	3.032	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2coc(C(F)F)c2)CC(C)(C)C1	ZINC001089477071	1360459534	/nfs/dbraw/zinc/45/95/34/1360459534.db2.gz	LAMXPEZXEQFGAN-AWEZNQCLSA-N	0	3	338.398	3.461	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(C3CC3)nc2C)CC(C)(C)C1	ZINC001089494355	1360471058	/nfs/dbraw/zinc/47/10/58/1360471058.db2.gz	MMALUMQKEQRYSW-QGZVFWFLSA-N	0	3	339.483	3.121	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C2[C@@H]3CCCCCC[C@@H]23)CC(C)(C)C1	ZINC001089502045	1360476260	/nfs/dbraw/zinc/47/62/60/1360476260.db2.gz	LDVABRCIJGSXHV-RCCFBDPRSA-N	0	3	330.516	3.443	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc([C@@H](C)CC)no2)CC(C)(C)C1	ZINC001089512051	1360483195	/nfs/dbraw/zinc/48/31/95/1360483195.db2.gz	YQWOLYBACSCGRL-GJZGRUSLSA-N	0	3	331.460	3.042	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cccn2C2CCCC2)CC(C)(C)C1	ZINC001089525885	1360489901	/nfs/dbraw/zinc/48/99/01/1360489901.db2.gz	ZVTYIRLLZTWQGT-KRWDZBQOSA-N	0	3	341.499	3.457	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc3cccnc3s2)CC(C)(C)C1	ZINC001089535351	1360495162	/nfs/dbraw/zinc/49/51/62/1360495162.db2.gz	JEHVXKOYRKQLGQ-HNNXBMFYSA-N	0	3	341.480	3.150	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1c(C2CC2)cnn1C	ZINC001089651601	1360564483	/nfs/dbraw/zinc/56/44/83/1360564483.db2.gz	HLBBJQQHEFVQIO-MRXNPFEDSA-N	0	3	344.503	3.094	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cncc(COC)c1	ZINC001089653695	1360566983	/nfs/dbraw/zinc/56/69/83/1360566983.db2.gz	SKCYNSLUYYVDPR-GOSISDBHSA-N	0	3	345.487	3.025	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cnn(C(C)(C)C)c1	ZINC001089660537	1360571619	/nfs/dbraw/zinc/57/16/19/1360571619.db2.gz	KXGDBMUOQQHUOD-KRWDZBQOSA-N	0	3	346.519	3.435	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cccn2nccc12	ZINC001089664464	1360575010	/nfs/dbraw/zinc/57/50/10/1360575010.db2.gz	LVMPNQAJDFKMCZ-MRXNPFEDSA-N	0	3	340.471	3.131	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ncc2ccccn21	ZINC001089666803	1360576350	/nfs/dbraw/zinc/57/63/50/1360576350.db2.gz	XCYNUCOUDQICSC-MRXNPFEDSA-N	0	3	340.471	3.131	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@H]2CCC(C)(C)CN2CC=C(C)C)c1	ZINC001089692720	1360598091	/nfs/dbraw/zinc/59/80/91/1360598091.db2.gz	BFIQOUABOLVDKY-LJQANCHMSA-N	0	3	339.483	3.250	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc2nccnc2c1	ZINC001089731550	1360634657	/nfs/dbraw/zinc/63/46/57/1360634657.db2.gz	SGBLGEJUOOBFPX-MRXNPFEDSA-N	0	3	338.455	3.036	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1occc1C	ZINC001089774061	1360658625	/nfs/dbraw/zinc/65/86/25/1360658625.db2.gz	SSUKSJNDXYYDSW-FZKCQIBNSA-N	0	3	334.847	3.123	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)C2(F)CCCC2)C1	ZINC001089832809	1360685585	/nfs/dbraw/zinc/68/55/85/1360685585.db2.gz	ZQCIYOTVKLRPGK-VGWMRTNUSA-N	0	3	340.870	3.190	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](CNCc2cc(C)no2)[C@@H](C)C1	ZINC001184484876	1387469570	/nfs/dbraw/zinc/46/95/70/1387469570.db2.gz	DJKXDAYCPXDOMQ-HOCLYGCPSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C=C2CCCCC2)CC2(CCOCC2)C1	ZINC001089926703	1360748863	/nfs/dbraw/zinc/74/88/63/1360748863.db2.gz	MFFOZNVQAUUVMF-IBGZPJMESA-N	0	3	346.515	3.440	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2oc(C)cc2C)CC2(CCOCC2)C1	ZINC001089930438	1360749695	/nfs/dbraw/zinc/74/96/95/1360749695.db2.gz	GXWRNQXCQHDENN-KRWDZBQOSA-N	0	3	346.471	3.073	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cscc2C)CC2(CCOCC2)C1	ZINC001089931054	1360750009	/nfs/dbraw/zinc/75/00/09/1360750009.db2.gz	RCJMKCGADPKQLO-INIZCTEOSA-N	0	3	348.512	3.234	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C2(C3CC3)CCC2)CC2(CCOCC2)C1	ZINC001089950389	1360760649	/nfs/dbraw/zinc/76/06/49/1360760649.db2.gz	TYSGRRKFTDTHKX-SFHVURJKSA-N	0	3	346.515	3.130	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2nc(C(C)(C)C)cs2)C1	ZINC001091081688	1360989572	/nfs/dbraw/zinc/98/95/72/1360989572.db2.gz	ZZMMPKCASLQNSH-UHFFFAOYSA-N	0	3	341.908	3.291	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc3cc(C)ccc3n2)C1	ZINC001091134261	1360996465	/nfs/dbraw/zinc/99/64/65/1360996465.db2.gz	NPIBHQYZLZNIBH-UHFFFAOYSA-N	0	3	343.858	3.394	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc3ncccc3s2)C1	ZINC001091179679	1361001117	/nfs/dbraw/zinc/00/11/17/1361001117.db2.gz	DROVNDQQFIXYEE-UHFFFAOYSA-N	0	3	335.860	3.147	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc(F)c(F)cc2Cl)C1	ZINC001091351552	1361056100	/nfs/dbraw/zinc/05/61/00/1361056100.db2.gz	AWRZZTQJMBSNLM-UHFFFAOYSA-N	0	3	349.208	3.469	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cnc(C(C)(C)C)s2)C1	ZINC001091381205	1361070617	/nfs/dbraw/zinc/07/06/17/1361070617.db2.gz	HJHVPMYVAKRCSJ-UHFFFAOYSA-N	0	3	341.908	3.291	20	30		EGEDHN
C=CCOc1ccc(-c2nc([C@@H]3CN4CCC3CC4)no2)cc1OC	ZINC001323913536	1387495203	/nfs/dbraw/zinc/49/52/03/1387495203.db2.gz	ANUZQSHONCEYSA-OAHLLOKOSA-N	0	3	341.411	3.119	20	30		EGEDHN
CCC(CC)C(=O)N1C[C@H]2CN(Cc3ccc(C#N)cc3)C[C@@]2(C)C1	ZINC001091492954	1361120877	/nfs/dbraw/zinc/12/08/77/1361120877.db2.gz	LOJYXDWJZAABKQ-CTNGQTDRSA-N	0	3	339.483	3.275	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3cc4cc(Cl)ccc4o3)C[C@]2(C)C1	ZINC001091832576	1361232002	/nfs/dbraw/zinc/23/20/02/1361232002.db2.gz	BXXXQEUYTJPKIR-KUHUBIRLSA-N	0	3	342.826	3.113	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)[C@H](CC3CCCC3)C(C)C)C[C@]2(C)C1	ZINC001092065479	1361286482	/nfs/dbraw/zinc/28/64/82/1361286482.db2.gz	NGECCXRSCASNTJ-SBHAEUEKSA-N	0	3	330.516	3.252	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3cc4cc(C)c(C)cc4o3)C[C@]2(C)C1	ZINC001092203195	1361322132	/nfs/dbraw/zinc/32/21/32/1361322132.db2.gz	HWMHENITMIJACY-UTKZUKDTSA-N	0	3	336.435	3.077	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3c(C)csc3Cl)C[C@]2(C)C1	ZINC001092232570	1361335079	/nfs/dbraw/zinc/33/50/79/1361335079.db2.gz	SBKPGCQOIPZBBY-DYVFJYSZSA-N	0	3	336.888	3.127	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CN(Cc3cccnc3)C[C@H]2C)CC1	ZINC001092940724	1361491626	/nfs/dbraw/zinc/49/16/26/1361491626.db2.gz	YRPSFIDFSPCQBD-VQIMIIECSA-N	0	3	327.472	3.012	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001092946966	1361493334	/nfs/dbraw/zinc/49/33/34/1361493334.db2.gz	FBZVGCZIEVBMEJ-ATNYBXOESA-N	0	3	345.512	3.240	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)c2cccc(F)c2)CC1	ZINC001093353048	1361566819	/nfs/dbraw/zinc/56/68/19/1361566819.db2.gz	PSVPWDZOPQBKEW-IBGZPJMESA-N	0	3	340.442	3.166	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)c2c(C)coc2C)CC1	ZINC001093370663	1361580046	/nfs/dbraw/zinc/58/00/46/1361580046.db2.gz	WQBMTJHMITYDCH-IBGZPJMESA-N	0	3	340.467	3.236	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)c2ccc(CC)o2)CC1	ZINC001093373784	1361583660	/nfs/dbraw/zinc/58/36/60/1361583660.db2.gz	SEZRPMPFJCIEBQ-IBGZPJMESA-N	0	3	340.467	3.182	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C2CCC(=C)CC2)CC1	ZINC001093375880	1361586312	/nfs/dbraw/zinc/58/63/12/1361586312.db2.gz	DPQSAEBZBPJQAE-FQEVSTJZSA-N	0	3	340.511	3.459	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cc(C(CC)CC)no3)CCC[C@@H]12	ZINC001094529677	1361846769	/nfs/dbraw/zinc/84/67/69/1361846769.db2.gz	HPWHFIIUANLNLL-UYAOXDASSA-N	0	3	343.471	3.186	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1nc(Cl)sc1Cl)C2	ZINC001095865452	1362259335	/nfs/dbraw/zinc/25/93/35/1362259335.db2.gz	CGTVZWZYGGIJOY-UTLUCORTSA-N	0	3	346.283	3.361	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1c[nH]c3ccc(F)cc13)C2	ZINC001096066620	1362363217	/nfs/dbraw/zinc/36/32/17/1362363217.db2.gz	RWJVXSHACBUOEZ-MNEFBYGVSA-N	0	3	341.430	3.147	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccccc1O[C@H](C)CC)C2	ZINC001096083668	1362376106	/nfs/dbraw/zinc/37/61/06/1362376106.db2.gz	AIHCXFADNQGQNC-FPAYPSAMSA-N	0	3	340.467	3.222	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1c[nH]c3cc(C)ccc13)C2	ZINC001096151435	1362407269	/nfs/dbraw/zinc/40/72/69/1362407269.db2.gz	BYNCHPAFXUCXRL-UXPWSPDFSA-N	0	3	337.467	3.316	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C(C)(C)c1ccc(F)cc1)C2	ZINC001096376570	1362479111	/nfs/dbraw/zinc/47/91/11/1362479111.db2.gz	WOFNKGHVFAKHRA-SQNIBIBYSA-N	0	3	330.447	3.401	20	30		EGEDHN
Cc1cccc(C)c1CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc(C#N)c[nH]1)C2	ZINC001096928731	1362780035	/nfs/dbraw/zinc/78/00/35/1362780035.db2.gz	KFLPZVSHHNUFNQ-POAQFYNOSA-N	0	3	348.450	3.039	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H]1C[C@H]1c1sccc1C)C2	ZINC001097067730	1362832227	/nfs/dbraw/zinc/83/22/27/1362832227.db2.gz	NWVBNLPTCYECGK-HHARLNAUSA-N	0	3	330.497	3.458	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](CNCc2nc(C)cs2)[C@@H](C)C1	ZINC001185061350	1387604099	/nfs/dbraw/zinc/60/40/99/1387604099.db2.gz	LSUZEELKKGTYGY-GOEBONIOSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](CNCc2oc(C)nc2C)[C@H](C)C1	ZINC001185062781	1387605429	/nfs/dbraw/zinc/60/54/29/1387605429.db2.gz	VLALCVACNTZNMD-PBHICJAKSA-N	0	3	333.476	3.222	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C(C)(C)c1ccc(F)cc1)C2	ZINC001098239182	1363265685	/nfs/dbraw/zinc/26/56/85/1363265685.db2.gz	WOFNKGHVFAKHRA-KURKYZTESA-N	0	3	330.447	3.401	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(Cl)c(Cl)c1)C2	ZINC001098267412	1363279956	/nfs/dbraw/zinc/27/99/56/1363279956.db2.gz	OLBIMXSDRUSFRV-WQVCFCJDSA-N	0	3	337.250	3.352	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1ccc3c(c1)CCCC3)C2	ZINC001098367364	1363308406	/nfs/dbraw/zinc/30/84/06/1363308406.db2.gz	YUHJQKLIGCANEG-NJYVYQBISA-N	0	3	338.495	3.406	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)CC1(C)CCCC1)C[C@@H](C)O2	ZINC001098596291	1363392202	/nfs/dbraw/zinc/39/22/02/1363392202.db2.gz	ONRQGDWZCGVLPT-QGZVFWFLSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@H]1C=CCCC1)C[C@H](C)O2	ZINC001098604816	1363395447	/nfs/dbraw/zinc/39/54/47/1363395447.db2.gz	BOMBBANZOWZJSI-ROUUACIJSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H](C)CC1CCCC1)C[C@H](C)O2	ZINC001098642910	1363413032	/nfs/dbraw/zinc/41/30/32/1363413032.db2.gz	PAGATGNKEFGFJM-MSOLQXFVSA-N	0	3	348.531	3.471	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](NC(=O)C2CCC2)C2CCCC2)s1	ZINC001324450611	1387625539	/nfs/dbraw/zinc/62/55/39/1387625539.db2.gz	MJWMJBKSPAFMCQ-KRWDZBQOSA-N	0	3	331.485	3.184	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(C)o1	ZINC001098872657	1363499934	/nfs/dbraw/zinc/49/99/34/1363499934.db2.gz	CYWXHDSUIDDMEC-INIZCTEOSA-N	0	3	334.460	3.011	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2cc3c(o2)CCCC3)C1	ZINC001098870804	1363500030	/nfs/dbraw/zinc/50/00/30/1363500030.db2.gz	OQVXBNKGNKZOCS-JXFKEZNVSA-N	0	3	328.456	3.319	20	30		EGEDHN
C=CCCC(=O)NC[C@H]1CCC(C)(C)CN1C[C@@H](O)c1ccccc1	ZINC001098966705	1363544988	/nfs/dbraw/zinc/54/49/88/1363544988.db2.gz	TWGWACLNFVFWBR-RTBURBONSA-N	0	3	344.499	3.293	20	30		EGEDHN
C[C@H](C#N)C(=O)NC[C@@H]1CCC(C)(C)CN1Cc1ccc(CF)cc1	ZINC001098977001	1363551318	/nfs/dbraw/zinc/55/13/18/1363551318.db2.gz	YTDGKTHXRSLBSF-QAPCUYQASA-N	0	3	345.462	3.423	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(F)c(F)c2F)C1	ZINC001099002978	1363566864	/nfs/dbraw/zinc/56/68/64/1363566864.db2.gz	XJYMVLDADDPPEB-SGTLLEGYSA-N	0	3	338.373	3.264	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)C1(c2ccccn2)CC1	ZINC001099073945	1363608951	/nfs/dbraw/zinc/60/89/51/1363608951.db2.gz	FLMIIODJFFKEKW-QGZVFWFLSA-N	0	3	341.499	3.296	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cccn2C2CCCC2)C1	ZINC001099096878	1363619508	/nfs/dbraw/zinc/61/95/08/1363619508.db2.gz	CFMWRXCUVCCNNM-UWJYYQICSA-N	0	3	339.483	3.211	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)C[C@@H]1CCC(C)(C)CO1	ZINC001099144406	1363652514	/nfs/dbraw/zinc/65/25/14/1363652514.db2.gz	HCYOGHLGZGQKOX-IRXDYDNUSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H](C)CC(F)F	ZINC001099145255	1363653902	/nfs/dbraw/zinc/65/39/02/1363653902.db2.gz	VUYACPMFBMAWGP-LSDHHAIUSA-N	0	3	346.462	3.087	20	30		EGEDHN
CN1CCC[C@H](CNC(=O)C#Cc2cccs2)[C@H]1c1cccs1	ZINC001324476955	1387636399	/nfs/dbraw/zinc/63/63/99/1387636399.db2.gz	YRZGPCPBRTZJKC-KDOFPFPSSA-N	0	3	344.505	3.360	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@H]1CCC(C)(C)CN1CCOCC1CC1	ZINC001099170192	1363668630	/nfs/dbraw/zinc/66/86/30/1363668630.db2.gz	DQPLWWUCOPGAHL-QGZVFWFLSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(N(C)C(C)C)cc2)C1	ZINC001099184213	1363678899	/nfs/dbraw/zinc/67/88/99/1363678899.db2.gz	FONRQQKLCREQMH-RXVVDRJESA-N	0	3	341.499	3.302	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@@H]2CCCC3(CC3)C2)C[C@H]1C(F)(F)F	ZINC001099252275	1363715291	/nfs/dbraw/zinc/71/52/91/1363715291.db2.gz	KSYFHBOGRWIWIG-MGPQQGTHSA-N	0	3	330.394	3.122	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@]2(C)CC=CCC2)C[C@H]1C(F)(F)F	ZINC001099256267	1363716975	/nfs/dbraw/zinc/71/69/75/1363716975.db2.gz	JIZPLFNMCNOAAM-IIAWOOMASA-N	0	3	330.394	3.288	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@H](C)c1c(C)noc1C	ZINC001099271361	1363725227	/nfs/dbraw/zinc/72/52/27/1363725227.db2.gz	XEEXFZLSYGJXJB-PBHICJAKSA-N	0	3	345.487	3.025	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)CCc2cccc(C)c2)C[C@H]1C(F)(F)F	ZINC001099289080	1363733882	/nfs/dbraw/zinc/73/38/82/1363733882.db2.gz	QDEDVGOJUXJXHG-HZPDHXFCSA-N	0	3	340.389	3.093	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@H](OC)c1ccccc1	ZINC001099310134	1363743349	/nfs/dbraw/zinc/74/33/49/1363743349.db2.gz	IHHJKIPJUBRFRD-RBUKOAKNSA-N	0	3	342.483	3.004	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)[C@H](C)COc1ccccc1	ZINC001099340575	1363760906	/nfs/dbraw/zinc/76/09/06/1363760906.db2.gz	VQZITCKVFARELN-MSOLQXFVSA-N	0	3	344.499	3.494	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)CN(CC)c1ccccc1	ZINC001099345084	1363762385	/nfs/dbraw/zinc/76/23/85/1363762385.db2.gz	UKLIUYFQZVJOPZ-IBGZPJMESA-N	0	3	343.515	3.306	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H](C)n1c(C)ccc1C	ZINC001099353585	1363768361	/nfs/dbraw/zinc/76/83/61/1363768361.db2.gz	COHZQAFKWMAERQ-MSOLQXFVSA-N	0	3	331.504	3.459	20	30		EGEDHN
N#Cc1ccccc1CNC[C@]12CCC[C@H]1CN(C(=O)c1ccco1)C2	ZINC001099362354	1363773998	/nfs/dbraw/zinc/77/39/98/1363773998.db2.gz	RHUMWMCKMIYYES-RXVVDRJESA-N	0	3	349.434	3.183	20	30		EGEDHN
C=CCCC[N@@H+]1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1ccccc1[O-]	ZINC001099400635	1363787381	/nfs/dbraw/zinc/78/73/81/1363787381.db2.gz	FXAFPTMNMZVHOP-KANFNMMFSA-N	0	3	340.467	3.141	20	30		EGEDHN
C=CCCC[N@H+]1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1ccccc1[O-]	ZINC001099400635	1363787385	/nfs/dbraw/zinc/78/73/85/1363787385.db2.gz	FXAFPTMNMZVHOP-KANFNMMFSA-N	0	3	340.467	3.141	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)[C@H](C)C(C)(C)C)CC2(CCOCC2)C1	ZINC001099583317	1363864420	/nfs/dbraw/zinc/86/44/20/1363864420.db2.gz	NZFCBVVLYYZVAE-DLBZAZTESA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CCN(Cc2ccc(C(C)(C)C)cc2)C[C@@H]1O	ZINC001099728462	1363927619	/nfs/dbraw/zinc/92/76/19/1363927619.db2.gz	XIIRQJOHYCGSRB-OALUTQOASA-N	0	3	344.499	3.002	20	30		EGEDHN
C=CC1(CC(=O)N[C@@H]2CCN(CC=C(C)C)C[C@@H]2O)CCCCC1	ZINC001100034522	1364003644	/nfs/dbraw/zinc/00/36/44/1364003644.db2.gz	RVRDJAUSICOCNF-MSOLQXFVSA-N	0	3	334.504	3.031	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](c2ccc(OC)cc2)[C@H](NC/C=C\Cl)C1	ZINC001100154947	1364029007	/nfs/dbraw/zinc/02/90/07/1364029007.db2.gz	MXEUOESSWKUSBR-KIAIORRVSA-N	0	3	348.874	3.298	20	30		EGEDHN
O=C(CC1=CCCCC1)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100184448	1364038393	/nfs/dbraw/zinc/03/83/93/1364038393.db2.gz	JXIFINNRXOMUSC-UHFFFAOYSA-N	0	3	336.479	3.413	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](CNCc2ccn(CC)n2)[C@H](C)C1	ZINC001185223989	1387656203	/nfs/dbraw/zinc/65/62/03/1387656203.db2.gz	CEIWVWVRRZMMNT-SJORKVTESA-N	0	3	346.519	3.080	20	30		EGEDHN
C=CCOCCCC(=O)NCC1CC(NCc2cc(C)ccc2F)C1	ZINC001100216438	1364045997	/nfs/dbraw/zinc/04/59/97/1364045997.db2.gz	RGQJVHJTZZEYHC-UHFFFAOYSA-N	0	3	348.462	3.101	20	30		EGEDHN
Cc1cc(C(=O)NCC2CC(NCC#Cc3ccccc3)C2)oc1C	ZINC001100245181	1364056234	/nfs/dbraw/zinc/05/62/34/1364056234.db2.gz	WBBQHMYYDRKMJJ-UHFFFAOYSA-N	0	3	336.435	3.046	20	30		EGEDHN
C#CCCCCC(=O)NCC1CC(NCc2oc(C(C)C)nc2C)C1	ZINC001100259329	1364060829	/nfs/dbraw/zinc/06/08/29/1364060829.db2.gz	GTEZPAPZSCPVHC-UHFFFAOYSA-N	0	3	345.487	3.284	20	30		EGEDHN
CC[C@H](C)CC(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100280987	1364066687	/nfs/dbraw/zinc/06/66/87/1364066687.db2.gz	QFGZIPFJMYGUFH-DMKPSLHHSA-N	0	3	330.447	3.098	20	30		EGEDHN
C#CCCCC(=O)NCC1CC(NCc2cccc(F)c2Cl)C1	ZINC001100283476	1364066961	/nfs/dbraw/zinc/06/69/61/1364066961.db2.gz	MZBXNODGGLPFGZ-UHFFFAOYSA-N	0	3	336.838	3.267	20	30		EGEDHN
CCC(C)(C)CC(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100361919	1364091731	/nfs/dbraw/zinc/09/17/31/1364091731.db2.gz	IBOROLFWGWVVBK-UHFFFAOYSA-N	0	3	344.474	3.488	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)C(C)(C)C(=C)Cl)C1	ZINC001100361949	1364091879	/nfs/dbraw/zinc/09/18/79/1364091879.db2.gz	JNWGOTYBGSSDFC-UHFFFAOYSA-N	0	3	349.700	3.158	20	30		EGEDHN
C#CCC1(C(=O)NCC2CC(NCc3cc(C)ccc3F)C2)CCC1	ZINC001100396631	1364101793	/nfs/dbraw/zinc/10/17/93/1364101793.db2.gz	LDXBUKIIKITTJS-UHFFFAOYSA-N	0	3	342.458	3.312	20	30		EGEDHN
C[C@H](C(=O)NCC1CC(NCC#Cc2ccccc2)C1)C(C)(C)C	ZINC001100448479	1364118857	/nfs/dbraw/zinc/11/88/57/1364118857.db2.gz	VRDULECLSJTFPA-IPJUCJBFSA-N	0	3	326.484	3.205	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H](c2ccccc2)C2CC2)C1	ZINC001100505654	1364139378	/nfs/dbraw/zinc/13/93/78/1364139378.db2.gz	LYBNJHSYVIOICT-UYJHFMRCSA-N	0	3	332.875	3.417	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@H](C)c2c(F)cccc2F)C1	ZINC001100506912	1364139887	/nfs/dbraw/zinc/13/98/87/1364139887.db2.gz	MUIMFBWGEIMHNS-PNESKVBLSA-N	0	3	342.817	3.305	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NCC1CC(NCC=C(Cl)Cl)C1	ZINC001100540352	1364152380	/nfs/dbraw/zinc/15/23/80/1364152380.db2.gz	LAJUVGVYPYUDFP-SEEARECTSA-N	0	3	349.302	3.019	20	30		EGEDHN
C[C@@]1(C(=O)NCC2CC(NCc3cc(C#N)ccc3F)C2)C=CCC1	ZINC001100584318	1364174597	/nfs/dbraw/zinc/17/45/97/1364174597.db2.gz	DDJGVUNTTJUAHK-MKJPBZQASA-N	0	3	341.430	3.038	20	30		EGEDHN
CCC1(C(=O)NCC2CC(NCC#Cc3ccccc3Cl)C2)CC1	ZINC001100649655	1364204387	/nfs/dbraw/zinc/20/43/87/1364204387.db2.gz	MFPDHYVZUKHERP-UHFFFAOYSA-N	0	3	344.886	3.366	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1	ZINC001100711584	1364230879	/nfs/dbraw/zinc/23/08/79/1364230879.db2.gz	WRLJIDDLHOPJCE-UHFFFAOYSA-N	0	3	343.446	3.284	20	30		EGEDHN
C=C[C@H](C(=O)NCC1CC(NCc2ccccn2)C1)c1ccccc1	ZINC001101017231	1364376150	/nfs/dbraw/zinc/37/61/50/1364376150.db2.gz	ZGYLAWZTXZTFEX-GQOXECLESA-N	0	3	335.451	3.036	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H](C)Cc2ccccc2C)C1	ZINC001101049306	1364391734	/nfs/dbraw/zinc/39/17/34/1364391734.db2.gz	HFMVFXLIUWBFPR-NXVRBGIVSA-N	0	3	334.891	3.411	20	30		EGEDHN
O=C(NCC1CC(NCC#Cc2ccccc2)C1)c1ccc(F)s1	ZINC001101064196	1364397857	/nfs/dbraw/zinc/39/78/57/1364397857.db2.gz	WVELZXDGUDVEED-UHFFFAOYSA-N	0	3	342.439	3.037	20	30		EGEDHN
C=C(C)CN1CC[C@@H](Oc2ccnc(CNC(=O)/C(C)=C/CC)c2)C1	ZINC001101092116	1364408976	/nfs/dbraw/zinc/40/89/76/1364408976.db2.gz	MGHMCNLAIWQVTO-ZHPQLQEBSA-N	0	3	343.471	3.083	20	30		EGEDHN
C=CCN1CC[C@H](Oc2ccnc(CNC(=O)C[C@@H](C)C(C)C)c2)C1	ZINC001101092717	1364409473	/nfs/dbraw/zinc/40/94/73/1364409473.db2.gz	WBZFVAUCDPSXBI-APWZRJJASA-N	0	3	345.487	3.019	20	30		EGEDHN
C=CCC[C@H](C)[N@@H+]1C[C@@H]2CN(C(=O)c3ccccc3[O-])C[C@]2(C)C1	ZINC001101129026	1364423529	/nfs/dbraw/zinc/42/35/29/1364423529.db2.gz	XCRUBDDDEASJQI-YRNRMSPPSA-N	0	3	328.456	3.141	20	30		EGEDHN
C=CCC[C@H](C)[N@H+]1C[C@@H]2CN(C(=O)c3ccccc3[O-])C[C@]2(C)C1	ZINC001101129026	1364423532	/nfs/dbraw/zinc/42/35/32/1364423532.db2.gz	XCRUBDDDEASJQI-YRNRMSPPSA-N	0	3	328.456	3.141	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@H]2CN(Cc3cnc(C)s3)C[C@@]2(C)C1	ZINC001101253324	1364487638	/nfs/dbraw/zinc/48/76/38/1364487638.db2.gz	KAASUJFZDNYNOY-QAPCUYQASA-N	0	3	333.501	3.088	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@H]2CN(Cc3scnc3C)C[C@@]2(C)C1	ZINC001101337770	1364516263	/nfs/dbraw/zinc/51/62/63/1364516263.db2.gz	KTDVLBRGTPFZIO-MDZRGWNJSA-N	0	3	347.528	3.334	20	30		EGEDHN
CCCCCCCCC(=O)N1C[C@H]2CN(CC#CCOC)C[C@@]2(C)C1	ZINC001101442340	1364566865	/nfs/dbraw/zinc/56/68/65/1364566865.db2.gz	GBCGYUKHHSAXSU-CTNGQTDRSA-N	0	3	348.531	3.167	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1CC2(CN(CCC(C)C)C2)n2ccnc21	ZINC001101630358	1364662205	/nfs/dbraw/zinc/66/22/05/1364662205.db2.gz	FOWXRIQHTLYTDS-INIZCTEOSA-N	0	3	344.503	3.103	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CC2(CN(CC3CCCC3)C2)n2ccnc21	ZINC001101630421	1364662551	/nfs/dbraw/zinc/66/25/51/1364662551.db2.gz	GTZHPAHGLMWTKE-QGZVFWFLSA-N	0	3	342.487	3.002	20	30		EGEDHN
C=CCC[C@H](C)N1CC2(C1)C[C@H](NC(=O)C(C)(C)CC)c1nccn12	ZINC001101642939	1364667390	/nfs/dbraw/zinc/66/73/90/1364667390.db2.gz	QFMNPJBCQKEQIZ-HOTGVXAUSA-N	0	3	344.503	3.246	20	30		EGEDHN
CC(C)[C@H](C)CC(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C	ZINC001101808293	1364735438	/nfs/dbraw/zinc/73/54/38/1364735438.db2.gz	ZXUMSSFTRJRCNG-SFHLNBCPSA-N	0	3	340.511	3.404	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CNC(=O)/C=C\C(C)(C)C	ZINC001101824957	1364740144	/nfs/dbraw/zinc/74/01/44/1364740144.db2.gz	JPASQHXKOCTAGM-AZJURWTESA-N	0	3	345.512	3.406	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H]1CN(Cc2oc(CC)nc2C)C[C@H]1C	ZINC001102219868	1364940594	/nfs/dbraw/zinc/94/05/94/1364940594.db2.gz	ZWLXRNNCXQGGRW-GDBMZVCRSA-N	0	3	347.503	3.332	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1C	ZINC001102226104	1364943698	/nfs/dbraw/zinc/94/36/98/1364943698.db2.gz	CULVYRAFFUYQAJ-RHSMWYFYSA-N	0	3	343.446	3.094	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H]1CN(Cc2ccc(OC)c(F)c2)C[C@H]1C	ZINC001102226269	1364943798	/nfs/dbraw/zinc/94/37/98/1364943798.db2.gz	JBQJRVOWNWMCIQ-GDBMZVCRSA-N	0	3	348.462	3.231	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@@H]1CN(Cc2c(C)noc2C)C[C@H]1C	ZINC001102326384	1365002354	/nfs/dbraw/zinc/00/23/54/1365002354.db2.gz	PROGPHZXBFENLP-NRXGSXMXSA-N	0	3	333.476	3.078	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1CCNC(=O)CC1CC1	ZINC001102633987	1365146717	/nfs/dbraw/zinc/14/67/17/1365146717.db2.gz	SUJVFJHQEMRQKY-RDTXWAMCSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)Cc2cccs2)C1	ZINC001102639491	1365149102	/nfs/dbraw/zinc/14/91/02/1365149102.db2.gz	YHUQGRMRPPOZEF-TZMCWYRMSA-N	0	3	326.893	3.117	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1CCNC(=O)CC1CCC1	ZINC001102824452	1365237903	/nfs/dbraw/zinc/23/79/03/1365237903.db2.gz	UFKSQNMRSVRIJX-VQIMIIECSA-N	0	3	339.483	3.323	20	30		EGEDHN
C/C=C(/C)C(=O)NCC[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1C	ZINC001102841087	1365246194	/nfs/dbraw/zinc/24/61/94/1365246194.db2.gz	ARVGNJVLXSYSSH-BJBSRSQVSA-N	0	3	325.456	3.099	20	30		EGEDHN
C/C=C(/C)C(=O)NCC[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1C	ZINC001102842186	1365247142	/nfs/dbraw/zinc/24/71/42/1365247142.db2.gz	RSWBLBINLUATPM-PBJXVYCASA-N	0	3	342.458	3.218	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1CCNC(=O)C=C1CCC1	ZINC001102850748	1365251273	/nfs/dbraw/zinc/25/12/73/1365251273.db2.gz	SMTSVSDCQDJFMV-VQIMIIECSA-N	0	3	337.467	3.243	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2sccc2F)C1	ZINC001102946141	1365309815	/nfs/dbraw/zinc/30/98/15/1365309815.db2.gz	ZYRIRILJGCJVLB-ZYHUDNBSSA-N	0	3	330.856	3.328	20	30		EGEDHN
C=C1CCC(C(=O)NCC[C@@H]2CN(Cc3cc(C)no3)C[C@H]2C)CC1	ZINC001103403086	1365539173	/nfs/dbraw/zinc/53/91/73/1365539173.db2.gz	ZHXMEFNNFUPCBW-CRAIPNDOSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)[C@@H]2C[C@H]2CC(C)C)C1	ZINC001103452039	1365567734	/nfs/dbraw/zinc/56/77/34/1365567734.db2.gz	JUFGNEGNVMKINO-MWQQHZPXSA-N	0	3	326.912	3.495	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2c[nH]c3cccnc32)C1	ZINC001103644929	1365697962	/nfs/dbraw/zinc/69/79/62/1365697962.db2.gz	YIMAHOCGWYXXLU-TZMCWYRMSA-N	0	3	346.862	3.003	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H](C)[C@H](CCNCc2oc(C)nc2C)C1	ZINC001104563804	1366079050	/nfs/dbraw/zinc/07/90/50/1366079050.db2.gz	VQGXFTSTHSXDAI-IIDMSEBBSA-N	0	3	347.503	3.468	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cc[nH]c2CCC)C[C@H]1C	ZINC001104566079	1366079905	/nfs/dbraw/zinc/07/99/05/1366079905.db2.gz	DUXLNWWXVWHWHL-UKRRQHHQSA-N	0	3	337.895	3.408	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2oc(CC)nc2C)C1	ZINC001104607511	1366099103	/nfs/dbraw/zinc/09/91/03/1366099103.db2.gz	XMLCVPUAOQFTLE-NVXWUHKLSA-N	0	3	347.503	3.476	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2c(C)noc2CC)C1	ZINC001104606960	1366099341	/nfs/dbraw/zinc/09/93/41/1366099341.db2.gz	IZIHWRKMICBALN-NVXWUHKLSA-N	0	3	347.503	3.476	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)[C@H](C)c2cccnc2)C[C@H]1C	ZINC001104920453	1366224103	/nfs/dbraw/zinc/22/41/03/1366224103.db2.gz	QSYBRCYLNCGAOY-FRFSOERESA-N	0	3	335.879	3.012	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)CCCc2ccccn2)C[C@H]1C	ZINC001104936270	1366230725	/nfs/dbraw/zinc/23/07/25/1366230725.db2.gz	MCFPXKHRURRYQG-NVXWUHKLSA-N	0	3	349.906	3.231	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cccc(N(C)C)c2)C[C@H]1C	ZINC001104948891	1366238224	/nfs/dbraw/zinc/23/82/24/1366238224.db2.gz	TWMSZOZHMQYYHR-RHSMWYFYSA-N	0	3	349.906	3.193	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)CC(C)(C)C=C)CC1	ZINC001105392279	1366441529	/nfs/dbraw/zinc/44/15/29/1366441529.db2.gz	XANWOXLMMDSSRZ-IBGZPJMESA-N	0	3	328.500	3.315	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@H]1C[C@@](CNCCF)(c2ccccc2)C1	ZINC001105435295	1366466901	/nfs/dbraw/zinc/46/69/01/1366466901.db2.gz	HGMXWAIHRPBXJU-POAQFYNOSA-N	0	3	332.463	3.364	20	30		EGEDHN
C=CCCCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1coc(CC)n1)C2	ZINC001109174509	1366986554	/nfs/dbraw/zinc/98/65/54/1366986554.db2.gz	PPIGUMLMOMHKIO-VYDXJSESSA-N	0	3	331.460	3.319	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@]12CCC[C@H]1N(Cc1cnc(C)o1)CC2	ZINC001107503396	1367001048	/nfs/dbraw/zinc/00/10/48/1367001048.db2.gz	ZMQSGFBLQWNAMD-VQIMIIECSA-N	0	3	331.460	3.056	20	30		EGEDHN
C=CCCCC(=O)NC[C@]12CCC[C@H]1N(Cc1cncs1)CC2	ZINC001107524284	1367017502	/nfs/dbraw/zinc/01/75/02/1367017502.db2.gz	QPDILOWZENBYDE-SJLPKXTDSA-N	0	3	333.501	3.360	20	30		EGEDHN
Cc1ccccc1CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C#CC1CC1)C2	ZINC001109259780	1367030557	/nfs/dbraw/zinc/03/05/57/1367030557.db2.gz	SAXMCQYYXFNSRU-HKBOAZHASA-N	0	3	336.479	3.063	20	30		EGEDHN
COCC#CCN1CC[C@@]2(CNC(=O)C[C@@H](C)CC(C)C)CCC[C@@H]12	ZINC001107605911	1367068042	/nfs/dbraw/zinc/06/80/42/1367068042.db2.gz	CFYPTIVRNVRABP-QKNQBKEWSA-N	0	3	348.531	3.069	20	30		EGEDHN
C#CCC1(C(=O)NC[C@]23CCC[C@H]2N(CCF)CC3)CCCCC1	ZINC001107649290	1367093010	/nfs/dbraw/zinc/09/30/10/1367093010.db2.gz	QFSJARWTOGPNKW-YLJYHZDGSA-N	0	3	334.479	3.291	20	30		EGEDHN
C=CCCC(=O)NC[C@]1(C)CN(CC2CCC3(CC3)CC2)CCO1	ZINC001107802259	1367153196	/nfs/dbraw/zinc/15/31/96/1367153196.db2.gz	NCRKSGRXCBKATD-LJQANCHMSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)CCC3CCCCC3)[C@@H]2C1	ZINC001190019516	1367153842	/nfs/dbraw/zinc/15/38/42/1367153842.db2.gz	DFMWWZMWTQYODC-RBUKOAKNSA-N	0	3	334.504	3.082	20	30		EGEDHN
CN(C/C=C\c1ccc(Cl)cc1)[C@@H]1CCN(C(=O)C#CC2CC2)C1	ZINC001190037574	1367158814	/nfs/dbraw/zinc/15/88/14/1367158814.db2.gz	UNGJTGLRIKJSEL-FFPCURRISA-N	0	3	342.870	3.299	20	30		EGEDHN
COc1cccc(CN(C)[C@H]2CCN(C(=O)C#CC(C)(C)C)C2)c1C	ZINC001190084039	1367169033	/nfs/dbraw/zinc/16/90/33/1367169033.db2.gz	JSKKXGHFZZHISH-SFHVURJKSA-N	0	3	342.483	3.086	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1c(C)onc1C1CC1)C2	ZINC001109532235	1367182434	/nfs/dbraw/zinc/18/24/34/1367182434.db2.gz	RMMADESNIYYOHL-PMPSAXMXSA-N	0	3	329.444	3.162	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)C2=CCCCCC2)C1	ZINC001107894525	1367193336	/nfs/dbraw/zinc/19/33/36/1367193336.db2.gz	ZCRDDVWCXTZSKM-FXAWDEMLSA-N	0	3	334.504	3.439	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)CC(C)(C)C2CC2)C1	ZINC001107922016	1367203376	/nfs/dbraw/zinc/20/33/76/1367203376.db2.gz	KLTRHWIKLHXWMD-OXJNMPFZSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2cccc(F)c2C)C1	ZINC001107957914	1367216495	/nfs/dbraw/zinc/21/64/95/1367216495.db2.gz	QGCGPKHHGXMBMH-MGPUTAFESA-N	0	3	348.462	3.310	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@]1(C)CN(CC2CC(C)(C)C2)CCO1	ZINC001108114439	1367288574	/nfs/dbraw/zinc/28/85/74/1367288574.db2.gz	DPTZIJAXYNPDOJ-HXUWFJFHSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@]1(C)CN(CC2CC(C)(C)C2)CCO1	ZINC001108151886	1367312169	/nfs/dbraw/zinc/31/21/69/1367312169.db2.gz	VWLGBTCEPRLTDZ-OXJNMPFZSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CC1CC(F)(F)C1	ZINC001109770890	1367313861	/nfs/dbraw/zinc/31/38/61/1367313861.db2.gz	FWAXSDXYCDKKGX-ILXRZTDVSA-N	0	3	326.431	3.356	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@@]1(C)CN(C[C@@H](C)CC(C)C)CCO1	ZINC001108246781	1367360493	/nfs/dbraw/zinc/36/04/93/1367360493.db2.gz	VECFYHZNMPCTIO-PXNSSMCTSA-N	0	3	338.536	3.478	20	30		EGEDHN
C=CCC1(S(=O)(=O)N[C@H]2CCN(Cc3ccccc3)[C@H](C)C2)CC1	ZINC001190822523	1367360748	/nfs/dbraw/zinc/36/07/48/1367360748.db2.gz	YXZDORLQDYQIOP-AEFFLSMTSA-N	0	3	348.512	3.068	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2cc(C)cc(C)c2)C1	ZINC001108365457	1367414054	/nfs/dbraw/zinc/41/40/54/1367414054.db2.gz	KCTQDBGHVSQXIJ-GHTZIAJQSA-N	0	3	344.499	3.479	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2ccc(C)cc2C)C1	ZINC001108377110	1367423757	/nfs/dbraw/zinc/42/37/57/1367423757.db2.gz	WYACCONAVQUWFC-WIYYLYMNSA-N	0	3	344.499	3.479	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)CCc2ccc(C)o2)C1	ZINC001108417428	1367444825	/nfs/dbraw/zinc/44/48/25/1367444825.db2.gz	AQGKFVHTBJYLAF-JXFKEZNVSA-N	0	3	348.487	3.082	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H]1CC[C@H](CC)CC1)C2	ZINC001110007337	1367455656	/nfs/dbraw/zinc/45/56/56/1367455656.db2.gz	ROXYGARZPJYPID-QQXKLLMISA-N	0	3	334.504	3.127	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCOc1ccccc1C)C2	ZINC001110097794	1367502635	/nfs/dbraw/zinc/50/26/35/1367502635.db2.gz	VVBWVRZOLKUHAV-SQNIBIBYSA-N	0	3	328.456	3.062	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](C)CCc1cccc(F)c1)C2	ZINC001110129152	1367513746	/nfs/dbraw/zinc/51/37/46/1367513746.db2.gz	SKLYOGHCIBRZCU-XCLNPWKQSA-N	0	3	342.458	3.139	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2cc(C)ccc2C2CC2)C1	ZINC001191499815	1367515513	/nfs/dbraw/zinc/51/55/13/1367515513.db2.gz	HUAMKQTUTDEJBX-SFHVURJKSA-N	0	3	342.483	3.221	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](N(C)CCOCc2ccccc2)C1	ZINC001191684665	1367560495	/nfs/dbraw/zinc/56/04/95/1367560495.db2.gz	TUNLUNRAKVAKTE-LJQANCHMSA-N	0	3	344.499	3.338	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3C[C@H](CC)OC)CCCC1	ZINC001110214583	1367568907	/nfs/dbraw/zinc/56/89/07/1367568907.db2.gz	NCHFUYCVIRRCMO-OWSLCNJRSA-N	0	3	334.504	3.269	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](N(C)CCOc2cc(C)ccc2C)C1	ZINC001191727078	1367571069	/nfs/dbraw/zinc/57/10/69/1367571069.db2.gz	FRLBDIOXFHSSDV-SFHVURJKSA-N	0	3	344.499	3.427	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](N(C)CCOc2cccc(CC)c2)C1	ZINC001191726785	1367571340	/nfs/dbraw/zinc/57/13/40/1367571340.db2.gz	BVHFJRGAHVXGHC-GOSISDBHSA-N	0	3	344.499	3.373	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](N(C)CCOCCC(C)C)C1	ZINC001191726949	1367571930	/nfs/dbraw/zinc/57/19/30/1367571930.db2.gz	FAJHSEDNHMKOCX-IBGZPJMESA-N	0	3	336.520	3.166	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](N(C)Cc2ccc(COC)cc2)C1	ZINC001191840598	1367608508	/nfs/dbraw/zinc/60/85/08/1367608508.db2.gz	YZXHOYCNARTLHP-FQEVSTJZSA-N	0	3	342.483	3.059	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@@H](N(C)Cc2ccccc2N(C)C)C1	ZINC001191868087	1367620707	/nfs/dbraw/zinc/62/07/07/1367620707.db2.gz	NVPABBOUQDPMGC-IEBWSBKVSA-N	0	3	343.515	3.388	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@@H](N(C)CCc2scnc2C)C1	ZINC001191902927	1367631200	/nfs/dbraw/zinc/63/12/00/1367631200.db2.gz	UDQWRHMNIVUVKW-GDBMZVCRSA-N	0	3	335.517	3.129	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H](N(C)CCOc2ccccc2F)C1	ZINC001191913332	1367636652	/nfs/dbraw/zinc/63/66/52/1367636652.db2.gz	WZJJJSOTMBHHAV-DLBZAZTESA-N	0	3	348.462	3.340	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](N(C)C[C@H](O)c2ccc(CC)cc2)C1	ZINC001192093940	1367686186	/nfs/dbraw/zinc/68/61/86/1367686186.db2.gz	OKJJNTOHWBEKTM-PMACEKPBSA-N	0	3	344.499	3.171	20	30		EGEDHN
CC#CCN1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)[C@@H](F)CC)C1	ZINC001186196511	1387894963	/nfs/dbraw/zinc/89/49/63/1387894963.db2.gz	KXAROSBGQWHRKD-QRQLOZEOSA-N	0	3	348.437	3.119	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)C[C@H](C)c2ccccc2F)C1	ZINC001192877432	1367893328	/nfs/dbraw/zinc/89/33/28/1367893328.db2.gz	LKXOWRCQJZCYQS-DLBZAZTESA-N	0	3	348.462	3.055	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1sc3nccn3c1C)C2	ZINC001110678387	1367921286	/nfs/dbraw/zinc/92/12/86/1367921286.db2.gz	XEDNVFYGPKFJKI-KFWWJZLASA-N	0	3	344.484	3.006	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2ccc(C(C)C)cc2)C1	ZINC001193662643	1368087932	/nfs/dbraw/zinc/08/79/32/1368087932.db2.gz	HZEWOGHJRNNIFQ-LJQANCHMSA-N	0	3	330.472	3.159	20	30		EGEDHN
C=C[C@H](CC(=O)N1CC[C@@H](N(C)CCOC(C)C)C1)c1ccccc1	ZINC001194199376	1368206264	/nfs/dbraw/zinc/20/62/64/1368206264.db2.gz	BTZHEOKAVBEWBP-UYAOXDASSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)CC(C)(C)c2ccccc2)C1	ZINC001194284012	1368223194	/nfs/dbraw/zinc/22/31/94/1368223194.db2.gz	DSOKUAXQYRRTPE-IBGZPJMESA-N	0	3	344.499	3.090	20	30		EGEDHN
C=CCCOCC(=O)N1CC[C@@H](N(C)[C@H](C)c2cccc(F)c2)C1	ZINC001194396537	1368251552	/nfs/dbraw/zinc/25/15/52/1368251552.db2.gz	FBRKJYPCJQJVCA-CRAIPNDOSA-N	0	3	334.435	3.012	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)C2CCCCCCC2)C1	ZINC001194611009	1368296384	/nfs/dbraw/zinc/29/63/84/1368296384.db2.gz	IMZWAGXBKPTOHQ-RTBURBONSA-N	0	3	338.536	3.479	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3[C@H](C)COC)CCCCC1	ZINC001111442589	1368308519	/nfs/dbraw/zinc/30/85/19/1368308519.db2.gz	YQLOTLMJUFXBTN-TVFCKZIOSA-N	0	3	334.504	3.269	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3CC[C@@H](C)F)CCCCC1	ZINC001111483988	1368319140	/nfs/dbraw/zinc/31/91/40/1368319140.db2.gz	RBSJZUXKZCVCBF-TVFCKZIOSA-N	0	3	334.479	3.430	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3C[C@@H](CC)OC)CCCC1	ZINC001111522936	1368325188	/nfs/dbraw/zinc/32/51/88/1368325188.db2.gz	NCHFUYCVIRRCMO-TVFCKZIOSA-N	0	3	334.504	3.269	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)C[C@@H](NC(=O)CC(C)C)c1ccccc1O2	ZINC001111530670	1368331089	/nfs/dbraw/zinc/33/10/89/1368331089.db2.gz	XTNVYOATEWFVQD-NQIIRXRSSA-N	0	3	340.467	3.140	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1(CC(C)C)CC1)C[C@H](C)O2	ZINC001111545598	1368338078	/nfs/dbraw/zinc/33/80/78/1368338078.db2.gz	KYFKOTDOSMZHIW-KRWDZBQOSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H](C)CC(C)(C)C)C[C@@H](C)O2	ZINC001111550914	1368343017	/nfs/dbraw/zinc/34/30/17/1368343017.db2.gz	NPCYGMGIQZHHBL-IAGOWNOFSA-N	0	3	336.520	3.327	20	30		EGEDHN
CC(C)(C)CC(=O)N[C@]12CCC[C@H]1CN(Cc1cccc(C#N)c1)C2	ZINC001111593683	1368357864	/nfs/dbraw/zinc/35/78/64/1368357864.db2.gz	LTDKMLPDMZGEPN-RXVVDRJESA-N	0	3	339.483	3.465	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CCCN(CCCC2CCCC2)CC1	ZINC001195174851	1368393851	/nfs/dbraw/zinc/39/38/51/1368393851.db2.gz	VBGFKQPEAYPHGE-SFHVURJKSA-N	0	3	336.520	3.472	20	30		EGEDHN
C[C@@H](C#N)C(=O)N[C@]12CCC[C@H]1CN(CCc1ccccc1Cl)C2	ZINC001111668211	1368416893	/nfs/dbraw/zinc/41/68/93/1368416893.db2.gz	CUIXSFIZXJLJHT-QOKNQOGYSA-N	0	3	345.874	3.013	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3CCC[C@]3(NC(=O)CCC3CC3)C2)cc1	ZINC001111671964	1368417531	/nfs/dbraw/zinc/41/75/31/1368417531.db2.gz	RCDLMUATAVXGLO-FPOVZHCZSA-N	0	3	337.467	3.219	20	30		EGEDHN
C#CCCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1scnc1C)C2	ZINC001111711250	1368427339	/nfs/dbraw/zinc/42/73/39/1368427339.db2.gz	JXKSZQBYXOZBAU-LPHOPBHVSA-N	0	3	345.512	3.116	20	30		EGEDHN
C#CCCCC(=O)N1CCCN(CC[C@@H]2CCCC2(F)F)CC1	ZINC001195674990	1368469961	/nfs/dbraw/zinc/46/99/61/1368469961.db2.gz	OPFFWWQCCDRGLM-INIZCTEOSA-N	0	3	326.431	3.150	20	30		EGEDHN
CC(C)C#CC(=O)N1CCCN(CCCCOc2ccccc2)CC1	ZINC001195754496	1368482829	/nfs/dbraw/zinc/48/28/29/1368482829.db2.gz	OXZFWTAGIMRAKD-UHFFFAOYSA-N	0	3	342.483	3.039	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@]12CCC[C@H]1CN(Cc1cccnc1C)C2	ZINC001111851965	1368506311	/nfs/dbraw/zinc/50/63/11/1368506311.db2.gz	WQVRYBQXDJVBLJ-LMNJBCLMSA-N	0	3	341.499	3.463	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cnc3[nH]cnc3c2)CC1	ZINC001195997465	1368531587	/nfs/dbraw/zinc/53/15/87/1368531587.db2.gz	VKLCQTOJGRNKTF-UHFFFAOYSA-N	0	3	343.475	3.076	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CCCN(CC2=CCCCC2)CC1)OCC	ZINC001196024682	1368538171	/nfs/dbraw/zinc/53/81/71/1368538171.db2.gz	JGWWFWPNGPQNFZ-LJQANCHMSA-N	0	3	334.504	3.392	20	30		EGEDHN
C#CCN1C[C@@H]2CCC[C@]2(NC(=O)CCCCCc2cccs2)C1	ZINC001111905732	1368548972	/nfs/dbraw/zinc/54/89/72/1368548972.db2.gz	KWZHBQIFHNLLSY-PXNSSMCTSA-N	0	3	344.524	3.455	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2ncc(C)cc2OC)CC1	ZINC001196178079	1368563380	/nfs/dbraw/zinc/56/33/80/1368563380.db2.gz	XFXHERPRCNFCMY-UHFFFAOYSA-N	0	3	345.487	3.293	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H](CC)Oc2ccccc2F)C1	ZINC001111941521	1368568952	/nfs/dbraw/zinc/56/89/52/1368568952.db2.gz	WMGUXXJFUHZHPX-KNBMTAEXSA-N	0	3	346.446	3.140	20	30		EGEDHN
C=CCC[C@@H](C)N1CCCN(C(=O)c2nc3c(s2)CCC3)CC1	ZINC001196499749	1368627735	/nfs/dbraw/zinc/62/77/35/1368627735.db2.gz	DJJWJQZWAMCHIF-CQSZACIVSA-N	0	3	333.501	3.134	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@@H](CC)CC(F)F)C[C@H]1C(F)(F)F	ZINC001112114474	1368664337	/nfs/dbraw/zinc/66/43/37/1368664337.db2.gz	RXQXJNNBZNCVJW-QJPTWQEYSA-N	0	3	342.352	3.223	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)C2(CC(C)C)CCC2)C[C@H]1C(F)(F)F	ZINC001112130109	1368674618	/nfs/dbraw/zinc/67/46/18/1368674618.db2.gz	AHQHVHWTBMHRLQ-HUUCEWRRSA-N	0	3	344.421	3.205	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)C[C@@H](C)CC(C)(C)C)C[C@H]1C(F)(F)F	ZINC001112169969	1368698157	/nfs/dbraw/zinc/69/81/57/1368698157.db2.gz	AAMWTNIPKNABOH-RBSFLKMASA-N	0	3	346.437	3.451	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)C[C@H](CC)C(C)(C)C)C[C@H]1C(F)(F)F	ZINC001112192019	1368707171	/nfs/dbraw/zinc/70/71/71/1368707171.db2.gz	FCRQEYNQODCUCL-RRFJBIMHSA-N	0	3	346.437	3.451	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCCN(C[C@@H](O)C2CCCCC2)CC1	ZINC001197291827	1368781289	/nfs/dbraw/zinc/78/12/89/1368781289.db2.gz	MIWBSROEPMRNDH-GOSISDBHSA-N	0	3	336.520	3.064	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2cc(C(F)(F)F)ccn2)CC1	ZINC001197669356	1368869852	/nfs/dbraw/zinc/86/98/52/1368869852.db2.gz	NPVKIMQDLINNSH-UHFFFAOYSA-N	0	3	341.377	3.215	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2cc(C)no2)C1	ZINC001112513357	1368908532	/nfs/dbraw/zinc/90/85/32/1368908532.db2.gz	VCILUGYIHUXADY-SYNHAJSKSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@@H]2CCC[C@]2(CNCc2cc(C)no2)C1	ZINC001112514943	1368908797	/nfs/dbraw/zinc/90/87/97/1368908797.db2.gz	PEMMRNRVJJJTBN-UWVAXJGDSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C[C@H](C(=O)N1CCCN(CCCOC(C)C)CC1)c1ccccc1	ZINC001198205453	1368980759	/nfs/dbraw/zinc/98/07/59/1368980759.db2.gz	XJBJXLKNAUTGJH-FQEVSTJZSA-N	0	3	344.499	3.306	20	30		EGEDHN
C=CCC1(C(=O)N2CCCN(CCCOC(C)C)CC2)CCCC1	ZINC001198422534	1369028826	/nfs/dbraw/zinc/02/88/26/1369028826.db2.gz	AVIHAOZFJIIWJE-UHFFFAOYSA-N	0	3	336.520	3.472	20	30		EGEDHN
C=CCC[C@H](C)N[C@H](CNC(=O)CSC)c1ccccc1OC	ZINC001198516215	1369050408	/nfs/dbraw/zinc/05/04/08/1369050408.db2.gz	VTLRDWRWBQRXCG-GOEBONIOSA-N	0	3	336.501	3.160	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)c1cccn1C)c1ccccc1OC	ZINC001198530041	1369054901	/nfs/dbraw/zinc/05/49/01/1369054901.db2.gz	MLNCYAJJUZQZML-QGZVFWFLSA-N	0	3	341.455	3.061	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)c1ncoc1C)c1ccccc1OC	ZINC001198584958	1369067283	/nfs/dbraw/zinc/06/72/83/1369067283.db2.gz	ONLXEZRPQXXJIM-INIZCTEOSA-N	0	3	343.427	3.019	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@@H](C)OCCCC)c1ccccc1OC	ZINC001198595390	1369068918	/nfs/dbraw/zinc/06/89/18/1369068918.db2.gz	LESVDBUIWKGBFT-AEFFLSMTSA-N	0	3	348.487	3.223	20	30		EGEDHN
CCC/C=C\CCN[C@H](CNC(=O)[C@H](C)C#N)c1ccccc1OC	ZINC001198616542	1369073998	/nfs/dbraw/zinc/07/39/98/1369073998.db2.gz	IPLZEBXBDSMJAN-MYOVTOPRSA-N	0	3	343.471	3.348	20	30		EGEDHN
C=CCCCCCN[C@H](CNC(=O)[C@H](C)C#N)c1ccccc1OC	ZINC001198618008	1369074646	/nfs/dbraw/zinc/07/46/46/1369074646.db2.gz	VMBYEHVWCZAEEJ-SJLPKXTDSA-N	0	3	343.471	3.348	20	30		EGEDHN
C=CCOCCCC(=O)NC[C@H](NCCCC)c1ccccc1OC	ZINC001198635908	1369078309	/nfs/dbraw/zinc/07/83/09/1369078309.db2.gz	ITVQUWOSLGPBRT-SFHVURJKSA-N	0	3	348.487	3.225	20	30		EGEDHN
C#CCCCC(=O)NC[C@H](NCC1CCC1)c1ccccc1OC	ZINC001198693787	1369092443	/nfs/dbraw/zinc/09/24/43/1369092443.db2.gz	CWRARPPXWVOPOB-SFHVURJKSA-N	0	3	328.456	3.046	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)c1ccncc1C)c1ccccc1OC	ZINC001198714677	1369098078	/nfs/dbraw/zinc/09/80/78/1369098078.db2.gz	ZOXQSCGHFSJGTD-SFHVURJKSA-N	0	3	339.439	3.035	20	30		EGEDHN
CC/C=C/CCN[C@@H](CNC(=O)C#CC1CC1)c1ccccc1OC	ZINC001198723409	1369099971	/nfs/dbraw/zinc/09/99/71/1369099971.db2.gz	GOZYFWUVIDMRSA-PXPVJAHISA-N	0	3	340.467	3.212	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)C1(F)CCCC1)c1ccccc1OC	ZINC001198784535	1369113695	/nfs/dbraw/zinc/11/36/95/1369113695.db2.gz	HMGPDYCRKBASLU-MRXNPFEDSA-N	0	3	334.435	3.301	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)[C@@H](CCC)OC)c1ccccc1OC	ZINC001198827021	1369122716	/nfs/dbraw/zinc/12/27/16/1369122716.db2.gz	PBLGAGXHBJIKPW-PKOBYXMFSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@@]1(C)C=CCC1)c1ccccc1OC	ZINC001198833531	1369124961	/nfs/dbraw/zinc/12/49/61/1369124961.db2.gz	BNISMCIPXXIIRW-XLIONFOSSA-N	0	3	328.456	3.375	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@H]1CCC1(C)C)c1ccccc1OC	ZINC001198855634	1369130592	/nfs/dbraw/zinc/13/05/92/1369130592.db2.gz	DNWWECYNXCMHCS-IAGOWNOFSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)c1cccnc1C)c1ccccc1OC	ZINC001198875780	1369136365	/nfs/dbraw/zinc/13/63/65/1369136365.db2.gz	JBJXBAFRDHZIKO-GOSISDBHSA-N	0	3	339.439	3.035	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)C1CC2(CC2)C1)c1ccccc1OC	ZINC001198902881	1369145326	/nfs/dbraw/zinc/14/53/26/1369145326.db2.gz	QZZYIACWLDQXDX-KRWDZBQOSA-N	0	3	328.456	3.208	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)[C@H]1CC12CC2)c1ccccc1OC	ZINC001198916863	1369148399	/nfs/dbraw/zinc/14/83/99/1369148399.db2.gz	VPUJBXIVVCMNEA-IAGOWNOFSA-N	0	3	328.456	3.208	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CC/C=C\CCC)C[C@H]2O)CCCCC1	ZINC001198944139	1369154537	/nfs/dbraw/zinc/15/45/37/1369154537.db2.gz	BTJQWKKUDMSFTO-PWBPZBFBSA-N	0	3	348.531	3.421	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)C[C@H](C)COC)c1ccccc1OC	ZINC001198945725	1369155115	/nfs/dbraw/zinc/15/51/15/1369155115.db2.gz	PRKRBDVZYFNMPG-FUHWJXTLSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)c1cccn1CC)c1ccccc1OC	ZINC001198984535	1369165301	/nfs/dbraw/zinc/16/53/01/1369165301.db2.gz	PBLJQSRLXHKIGQ-KRWDZBQOSA-N	0	3	341.455	3.153	20	30		EGEDHN
C=CCCC(=O)N1CCC(NCc2cc(-c3cccs3)on2)CC1	ZINC001199707326	1369258249	/nfs/dbraw/zinc/25/82/49/1369258249.db2.gz	VHSXCNJZOZFNRZ-UHFFFAOYSA-N	0	3	345.468	3.450	20	30		EGEDHN
CC#CCCCC(=O)N1CCN(C[C@H]2CCc3ccccc3C2)CC1	ZINC001113226022	1369275486	/nfs/dbraw/zinc/27/54/86/1369275486.db2.gz	HCGYGWHAVOAHPP-IBGZPJMESA-N	0	3	338.495	3.129	20	30		EGEDHN
CCCCCCCN1CCN(C(=O)[C@H]2C[C@@H](C)Cc3c[nH]nc32)CC1	ZINC001113257084	1369296353	/nfs/dbraw/zinc/29/63/53/1369296353.db2.gz	OZORZWDCJHEDMA-WMZOPIPTSA-N	0	3	346.519	3.190	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCCO[C@H](CNCc2ccccc2F)C1	ZINC001201209670	1369496826	/nfs/dbraw/zinc/49/68/26/1369496826.db2.gz	CAQXXFLEZATZAG-SJLPKXTDSA-N	0	3	348.462	3.135	20	30		EGEDHN
C=CCCCC(=O)N1CCCO[C@H](CN[C@H](C)c2ccccc2F)C1	ZINC001201284499	1369510476	/nfs/dbraw/zinc/51/04/76/1369510476.db2.gz	UZBWMPOITGZGDE-IAGOWNOFSA-N	0	3	348.462	3.450	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)NCc1ccc(C(F)(F)F)cc1	ZINC001186830015	1388012256	/nfs/dbraw/zinc/01/22/56/1388012256.db2.gz	AVELSFVOKWBUDD-HNNXBMFYSA-N	0	3	341.377	3.155	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)Cc2cccc(OCC)c2)CC1	ZINC001113689446	1369565458	/nfs/dbraw/zinc/56/54/58/1369565458.db2.gz	PKORDNIKNIWGCL-KRWDZBQOSA-N	0	3	330.472	3.127	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)N1CCC(NCc2oc(CC)nc2C)CC1	ZINC001202085399	1369684317	/nfs/dbraw/zinc/68/43/17/1369684317.db2.gz	TYOZMBOBIQJXIG-ZIAGYGMSSA-N	0	3	333.476	3.084	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)N1CCC(NCc2ccn(C(C)C)n2)CC1	ZINC001202085569	1369685128	/nfs/dbraw/zinc/68/51/28/1369685128.db2.gz	VYUHIHGQWKVJBK-JKSUJKDBSA-N	0	3	332.492	3.003	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC(NCc2cc(C3CC3)no2)CC1	ZINC001202123484	1369692851	/nfs/dbraw/zinc/69/28/51/1369692851.db2.gz	READANYFLQLYSR-CQSZACIVSA-N	0	3	331.460	3.235	20	30		EGEDHN
CCC(=O)N[C@@H]1C[C@@H](NCC#Cc2cccc(Cl)c2)C12CCC2	ZINC001202257371	1369724423	/nfs/dbraw/zinc/72/44/23/1369724423.db2.gz	AJNGCBAHJQKSMK-IAGOWNOFSA-N	0	3	330.859	3.119	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@H](NCc2c(C)noc2CC)C12CCC2	ZINC001202618032	1369825607	/nfs/dbraw/zinc/82/56/07/1369825607.db2.gz	RPQCBLNYHRVQLO-IRXDYDNUSA-N	0	3	331.460	3.029	20	30		EGEDHN
CC[C@@H](c1ccc(F)cc1)N1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)C#CC(C)(C)C	ZINC001114257496	1369832990	/nfs/dbraw/zinc/83/29/90/1369832990.db2.gz	ACCAKEWPTVEYIR-HLNWXESRSA-N	0	3	342.458	3.373	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)CCC2CC2)C12CCC2	ZINC001202655003	1369838636	/nfs/dbraw/zinc/83/86/36/1369838636.db2.gz	NOSCTUAZWXMTAC-KBPBESRZSA-N	0	3	341.293	3.102	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H]1C[C@@H](NCc2ccccc2F)C12CCC2	ZINC001202867368	1369912388	/nfs/dbraw/zinc/91/23/88/1369912388.db2.gz	QIPADEKRJKAAKD-MSOLQXFVSA-N	0	3	328.431	3.002	20	30		EGEDHN
C[C@@H](c1ccccc1)N(Cc1cccc(C#N)c1)C[C@H]1CCC(=O)N1	ZINC001202897978	1369921446	/nfs/dbraw/zinc/92/14/46/1369921446.db2.gz	FXDLUURHSBYQPZ-OXJNMPFZSA-N	0	3	333.435	3.400	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2[C@H]3CN([C@@H](C)c4cccc(F)c4)C[C@H]32)CCC1	ZINC001114396765	1369931965	/nfs/dbraw/zinc/93/19/65/1369931965.db2.gz	DGKPGMWSAAYVJQ-WQANXHIZSA-N	0	3	340.442	3.127	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1C[C@H](NCc2cnoc2C)C12CCC2	ZINC001202970736	1369942383	/nfs/dbraw/zinc/94/23/83/1369942383.db2.gz	ZBGJIVLNZWVVSV-HOTGVXAUSA-N	0	3	331.460	3.102	20	30		EGEDHN
CC(C)C[C@H](C)C(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001203108973	1369986110	/nfs/dbraw/zinc/98/61/10/1369986110.db2.gz	OVXOIJKMOKRYGG-INIZCTEOSA-N	0	3	327.472	3.321	20	30		EGEDHN
CC1(CC(=O)N[C@@H]2C[C@@H](NCC#Cc3ccccc3)C23CCC3)CC1	ZINC001203214712	1370028160	/nfs/dbraw/zinc/02/81/60/1370028160.db2.gz	XUUQKBPBQBDUKL-RTBURBONSA-N	0	3	336.479	3.245	20	30		EGEDHN
CCCC1(C(=O)N[C@@H]2[C@H]3CN(Cc4ccc(C#N)cc4)C[C@H]32)CCC1	ZINC001114717640	1370043361	/nfs/dbraw/zinc/04/33/61/1370043361.db2.gz	YYSWLSPCYAVXRE-BWTSREIZSA-N	0	3	337.467	3.075	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1C[C@H](NCc2cncs2)C12CCC2	ZINC001203255505	1370043490	/nfs/dbraw/zinc/04/34/90/1370043490.db2.gz	BWGCKEUWGNFWLZ-LSDHHAIUSA-N	0	3	333.501	3.262	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C)c(OC)c3)C[C@H]21	ZINC001114724290	1370047085	/nfs/dbraw/zinc/04/70/85/1370047085.db2.gz	JWQMMVCBGUMORH-WOGUSJMUSA-N	0	3	342.483	3.152	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1[C@H]2CN(Cc3cc(C)ccc3OC)C[C@H]21	ZINC001114724345	1370047355	/nfs/dbraw/zinc/04/73/55/1370047355.db2.gz	KYDXWTRJEKJMOX-LBKNJMOBSA-N	0	3	342.483	3.152	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1[C@H]2CN(CCOc3cc(C)ccc3C)C[C@H]21	ZINC001114758996	1370064702	/nfs/dbraw/zinc/06/47/02/1370064702.db2.gz	AHRYVWWCXZMLQK-WGMWDUQUSA-N	0	3	342.483	3.085	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(OC)c(C)c3)C[C@H]21	ZINC001114792375	1370083566	/nfs/dbraw/zinc/08/35/66/1370083566.db2.gz	RVAVDRAKIQDWFW-QRKMNUTDSA-N	0	3	342.483	3.152	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1C[C@@H](NCc2c(C)noc2C)C12CCC2	ZINC001203451114	1370131180	/nfs/dbraw/zinc/13/11/80/1370131180.db2.gz	IGGRFJSUZFZBQA-SJORKVTESA-N	0	3	345.487	3.411	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1C[C@H](NCc2cnoc2C)C12CCC2	ZINC001203451027	1370131266	/nfs/dbraw/zinc/13/12/66/1370131266.db2.gz	HMKDEGQSOHKBQO-JKSUJKDBSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1[C@H]2CN(Cc3cc(C)ccc3OC)C[C@H]21	ZINC001114895602	1370135216	/nfs/dbraw/zinc/13/52/16/1370135216.db2.gz	AWDWYFVGICOLEY-DZFIZOCASA-N	0	3	342.483	3.152	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)C(C)(C)C(F)(F)F)C12CCC2	ZINC001203642185	1370198828	/nfs/dbraw/zinc/19/88/28/1370198828.db2.gz	XAEUQKWTCBSUDW-QWRGUYRKSA-N	0	3	338.801	3.344	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)C[C@H]1CN(Cc2ccccc2)CCO1	ZINC001203905789	1370309974	/nfs/dbraw/zinc/30/99/74/1370309974.db2.gz	BZVVYWNEHBPRFT-QFIPXVFZSA-N	0	3	349.478	3.281	20	30		EGEDHN
C=CCN1C(=O)CCC12CCN(Cc1ccc(OCC)cc1)CC2	ZINC001203962200	1370332783	/nfs/dbraw/zinc/33/27/83/1370332783.db2.gz	NYLIOOMTRFRBOL-UHFFFAOYSA-N	0	3	328.456	3.228	20	30		EGEDHN
C=CCN(CC=C)CCN1CCN(Cc2ccc(SC)cc2)CC1	ZINC001204146397	1370390004	/nfs/dbraw/zinc/39/00/04/1370390004.db2.gz	NTTRXHUAWINBCV-UHFFFAOYSA-N	0	3	345.556	3.200	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2c(C)noc2C)CCCCC1	ZINC001115402558	1370434997	/nfs/dbraw/zinc/43/49/97/1370434997.db2.gz	DVDKLKVGHDAIRU-UHFFFAOYSA-N	0	3	325.840	3.066	20	30		EGEDHN
C=CCCC(=O)NCC1(NCC(=C)Br)CCCCC1	ZINC001115441303	1370453858	/nfs/dbraw/zinc/45/38/58/1370453858.db2.gz	BMOGEIQOMFWKEP-UHFFFAOYSA-N	0	3	329.282	3.270	20	30		EGEDHN
C#CCCCCC(=O)NCC1(NCc2c(C)noc2C)CCCCC1	ZINC001115490693	1370493248	/nfs/dbraw/zinc/49/32/48/1370493248.db2.gz	IWDJRKTVBZGJGU-UHFFFAOYSA-N	0	3	345.487	3.394	20	30		EGEDHN
CN1CCN(Cc2cccc(Nc3ccc(C(C)(C)C#N)nc3)c2)CC1	ZINC001204502531	1370494740	/nfs/dbraw/zinc/49/47/40/1370494740.db2.gz	HPACXRRLAAVWQF-UHFFFAOYSA-N	0	3	349.482	3.374	20	30		EGEDHN
O=C(C#CC1CC1)NCC1(NCc2cc(F)ccc2F)CCCCC1	ZINC001115527368	1370525873	/nfs/dbraw/zinc/52/58/73/1370525873.db2.gz	PCAQBRNOSXSLPH-UHFFFAOYSA-N	0	3	346.421	3.287	20	30		EGEDHN
O=C(C#CC1CC1)NCC1(NCC=C(Cl)Cl)CCCCC1	ZINC001115528072	1370527149	/nfs/dbraw/zinc/52/71/49/1370527149.db2.gz	AVLRNHJYRGGVPM-UHFFFAOYSA-N	0	3	329.271	3.128	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cnc3[nH]ccc3c2)CCCCC1	ZINC001115583555	1370585523	/nfs/dbraw/zinc/58/55/23/1370585523.db2.gz	LJUZFXUQJHWDMH-UHFFFAOYSA-N	0	3	346.862	3.289	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccn3cncc3c2)CCCCC1	ZINC001115617231	1370614056	/nfs/dbraw/zinc/61/40/56/1370614056.db2.gz	KLTRZMATNSVFER-UHFFFAOYSA-N	0	3	346.862	3.109	20	30		EGEDHN
Cc1cc(Nc2ccc(C3(N4CCN(C)CC4)CC3)cc2)cnc1C#N	ZINC001205102459	1370650616	/nfs/dbraw/zinc/65/06/16/1370650616.db2.gz	QMMIRGICSKFZSG-UHFFFAOYSA-N	0	3	347.466	3.242	20	30		EGEDHN
CC[C@H](C)CC(=O)N1CCC(CNCc2cc(F)ccc2C#N)CC1	ZINC001205108505	1370652578	/nfs/dbraw/zinc/65/25/78/1370652578.db2.gz	ZKFCCHXZTJGIGB-HNNXBMFYSA-N	0	3	345.462	3.462	20	30		EGEDHN
O=C(CCCF)NCC1(NCC#Cc2ccccc2)CCCCC1	ZINC001115671071	1370653207	/nfs/dbraw/zinc/65/32/07/1370653207.db2.gz	SJDOIXLOEHYQPQ-UHFFFAOYSA-N	0	3	330.447	3.197	20	30		EGEDHN
C#CCCCC(=O)N1CCC(CNCc2c(F)cccc2F)CC1	ZINC001205131780	1370659350	/nfs/dbraw/zinc/65/93/50/1370659350.db2.gz	UPHGPAJSXYYLBQ-UHFFFAOYSA-N	0	3	334.410	3.097	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCC1(NCc2ccccn2)CCCCC1	ZINC001115678502	1370660828	/nfs/dbraw/zinc/66/08/28/1370660828.db2.gz	JBZDPDYWJWTHOA-SJORKVTESA-N	0	3	329.488	3.449	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCC1(NCc2cnc(C)nc2)CCCCC1	ZINC001115679465	1370661628	/nfs/dbraw/zinc/66/16/28/1370661628.db2.gz	FMSDBKKMVFCNBI-JKSUJKDBSA-N	0	3	344.503	3.152	20	30		EGEDHN
CC#CCCCC(=O)NCC1(NCc2conc2C)CCCCC1	ZINC001115679610	1370663129	/nfs/dbraw/zinc/66/31/29/1370663129.db2.gz	KFFXOHKTCQSBIB-UHFFFAOYSA-N	0	3	331.460	3.085	20	30		EGEDHN
CC#CCCCC(=O)NCC1(NCc2cncc(F)c2)CCCCC1	ZINC001115681335	1370663587	/nfs/dbraw/zinc/66/35/87/1370663587.db2.gz	HNUKZZHVYMCDDS-UHFFFAOYSA-N	0	3	345.462	3.323	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@H](C)C2CCC2)C[C@H]1c1cccc(F)c1	ZINC001205416813	1370748451	/nfs/dbraw/zinc/74/84/51/1370748451.db2.gz	DNZWDPUPVSDONE-UIAACRFSSA-N	0	3	342.458	3.169	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@@H]2CCC2(C)C)C[C@H]1c1cccc(F)c1	ZINC001205426452	1370750987	/nfs/dbraw/zinc/75/09/87/1370750987.db2.gz	IJGKDSZBKVWJPI-GBESFXJTSA-N	0	3	342.458	3.169	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)C[C@H](C)C(C)(C)C)[C@@H]3COC[C@@H]32)CC1	ZINC001205516383	1370777673	/nfs/dbraw/zinc/77/76/73/1370777673.db2.gz	BOFHNUTYAOERJB-OKZBNKHCSA-N	0	3	348.531	3.184	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CCN(Cc3sc(C)nc3C)C2)C1	ZINC001206144717	1370971376	/nfs/dbraw/zinc/97/13/76/1370971376.db2.gz	YIHIYGJLAWQTOT-SFHVURJKSA-N	0	3	349.500	3.370	20	30		EGEDHN
C=C[C@H](COC)NC[C@](C)(O)c1ccc(Br)cc1Cl	ZINC001326157148	1388120182	/nfs/dbraw/zinc/12/01/82/1388120182.db2.gz	VPSJWGBNJRSGMX-RISCZKNCSA-N	0	3	348.668	3.101	20	30		EGEDHN
N#Cc1cccnc1NCCNCc1ccsc1C(F)(F)F	ZINC001118799683	1371231685	/nfs/dbraw/zinc/23/16/85/1371231685.db2.gz	ULZMKRAGCBAWQI-UHFFFAOYSA-N	0	3	326.347	3.235	20	30		EGEDHN
CCc1ccccc1CN1C[C@@H](C)[C@H](NC(=O)C#CC(C)(C)C)C1	ZINC001206951123	1371242718	/nfs/dbraw/zinc/24/27/18/1371242718.db2.gz	YTLHOLLTIKAWII-VQIMIIECSA-N	0	3	326.484	3.235	20	30		EGEDHN
O=C(C1CCCC1)N1CCC[C@@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207021818	1371269326	/nfs/dbraw/zinc/26/93/26/1371269326.db2.gz	PEAOZMHAIDAAQI-LJQANCHMSA-N	0	3	344.886	3.462	20	30		EGEDHN
O=C(c1ccc(F)cc1)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001207055590	1371280450	/nfs/dbraw/zinc/28/04/50/1371280450.db2.gz	MQENBJXBXSLEPD-FQEVSTJZSA-N	0	3	336.410	3.072	20	30		EGEDHN
O=C(c1ccco1)N1CCC[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001207082208	1371289105	/nfs/dbraw/zinc/28/91/05/1371289105.db2.gz	PQLWICWAOFHNFE-INIZCTEOSA-N	0	3	342.826	3.179	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1CN(CCOc2ccccc2)C[C@H]1C	ZINC001207107554	1371295792	/nfs/dbraw/zinc/29/57/92/1371295792.db2.gz	LNJYANCGUCJVHP-YLJYHZDGSA-N	0	3	342.483	3.270	20	30		EGEDHN
C=CCN(CCN1CCC(n2nccc2C)CC1)C(=O)OC(C)(C)C	ZINC001207204433	1371328871	/nfs/dbraw/zinc/32/88/71/1371328871.db2.gz	NPSAKDXEPZDQSA-UHFFFAOYSA-N	0	3	348.491	3.252	20	30		EGEDHN
O=C([C@H]1CC=CCC1)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207257998	1371342515	/nfs/dbraw/zinc/34/25/15/1371342515.db2.gz	CCIMFVHXCHCYSL-ICSRJNTNSA-N	0	3	340.442	3.114	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207763564	1371497695	/nfs/dbraw/zinc/49/76/95/1371497695.db2.gz	FBFOVDGTKWUKQN-FDDPXEEKSA-N	0	3	330.859	3.238	20	30		EGEDHN
O=C(C1=CCCC1)N1CCC[C@@H](NCC#Cc2ccccc2Cl)C1	ZINC001207789829	1371505225	/nfs/dbraw/zinc/50/52/25/1371505225.db2.gz	OPXKAIXKACKRFT-GOSISDBHSA-N	0	3	342.870	3.382	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N1CCC[C@@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207819277	1371512001	/nfs/dbraw/zinc/51/20/01/1371512001.db2.gz	HPPBTDJPFAYEAS-QZTJIDSGSA-N	0	3	344.886	3.318	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H](NCc2ccc(Cl)cc2OC)C1	ZINC001207934340	1371542238	/nfs/dbraw/zinc/54/22/38/1371542238.db2.gz	CDKSDMGIWFFSEH-KRWDZBQOSA-N	0	3	348.874	3.233	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H]([C@@H]2CCCN2Cc2cncc(F)c2)C1	ZINC001120348223	1371543154	/nfs/dbraw/zinc/54/31/54/1371543154.db2.gz	RORXDOZAJAGNNR-MJGOQNOKSA-N	0	3	345.462	3.390	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H](NCc2cc(Cl)ccc2OC)C1	ZINC001207935771	1371543326	/nfs/dbraw/zinc/54/33/26/1371543326.db2.gz	WEGBDFSJKWZMQQ-QGZVFWFLSA-N	0	3	348.874	3.233	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H](NCc2cccc(Cl)c2F)C1	ZINC001207943567	1371544710	/nfs/dbraw/zinc/54/47/10/1371544710.db2.gz	BEUNUCOHEQYMFQ-HNNXBMFYSA-N	0	3	336.838	3.363	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H](NCc2ccccc2OC(C)C)C1	ZINC001207944524	1371545652	/nfs/dbraw/zinc/54/56/52/1371545652.db2.gz	PKHLCMHMHNYUHO-LJQANCHMSA-N	0	3	342.483	3.358	20	30		EGEDHN
CC/C(C)=C/C(=O)N1CCC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001208001822	1371564349	/nfs/dbraw/zinc/56/43/49/1371564349.db2.gz	JOZRLABEVFFPGQ-ZGUWOUCSSA-N	0	3	329.419	3.134	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC[C@H](NCc2cnc(C)s2)C1	ZINC001208194314	1371634948	/nfs/dbraw/zinc/63/49/48/1371634948.db2.gz	PVZBIFINTJHKSG-INIZCTEOSA-N	0	3	333.501	3.301	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@H](NCc2ccc(C#N)s2)C1	ZINC001208240187	1371676103	/nfs/dbraw/zinc/67/61/03/1371676103.db2.gz	KIGGGNFHYZBVGM-AWEZNQCLSA-N	0	3	331.485	3.303	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN(CCCOc2ccc(F)cc2)C[C@H]1C	ZINC001208318077	1371715655	/nfs/dbraw/zinc/71/56/55/1371715655.db2.gz	IITMHMGBMJLRKS-CRAIPNDOSA-N	0	3	348.462	3.243	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN(Cc2ccc(COC)cc2)C[C@H]1C	ZINC001208452611	1371771493	/nfs/dbraw/zinc/77/14/93/1371771493.db2.gz	UOPQNIVFFNTRPK-VQIMIIECSA-N	0	3	330.472	3.126	20	30		EGEDHN
C=C(C)CCC(=O)NC1CC2(CC(NCc3conc3CC)C2)C1	ZINC001121179733	1371879971	/nfs/dbraw/zinc/87/99/71/1371879971.db2.gz	DSMBQMIXQUASMA-UHFFFAOYSA-N	0	3	331.460	3.110	20	30		EGEDHN
CC(C)(C)OC(=O)NCC1(C)CN(CCCc2cccc(C#N)c2)C1	ZINC001208854721	1371918643	/nfs/dbraw/zinc/91/86/43/1371918643.db2.gz	SVMMOJBKVUFESV-UHFFFAOYSA-N	0	3	343.471	3.337	20	30		EGEDHN
COC(=O)c1ccc2c(c1)CN(CCCc1ccc(C#N)cc1)CC2	ZINC001208859212	1371922071	/nfs/dbraw/zinc/92/20/71/1371922071.db2.gz	UMLVRLZQXPNXLX-UHFFFAOYSA-N	0	3	334.419	3.336	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H]2[C@H](CN2CCc2ccc(C#N)cc2)C1	ZINC001208925754	1371946837	/nfs/dbraw/zinc/94/68/37/1371946837.db2.gz	QAILHCBOQZRTLX-MSOLQXFVSA-N	0	3	341.455	3.042	20	30		EGEDHN
C[C@H]1[C@H](NC(=O)OC(C)(C)C)CCCN1CCc1ccc(C#N)cc1	ZINC001208928442	1371948315	/nfs/dbraw/zinc/94/83/15/1371948315.db2.gz	CEUHILRZIGRCEF-MAUKXSAKSA-N	0	3	343.471	3.478	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N1CCC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001209051427	1371983607	/nfs/dbraw/zinc/98/36/07/1371983607.db2.gz	JCDZTAROGDIDEG-WCLIJEPQSA-N	0	3	341.430	3.300	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CC2(CC(NCc3ccncc3Cl)C2)C1	ZINC001121516862	1371996516	/nfs/dbraw/zinc/99/65/16/1371996516.db2.gz	QUHJLFJVAYSIAO-UHFFFAOYSA-N	0	3	347.890	3.464	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC1CC2(CC(NCc3cc(C)no3)C2)C1	ZINC001121522977	1371998939	/nfs/dbraw/zinc/99/89/39/1371998939.db2.gz	VIDQEKJOUYOATQ-UHFFFAOYSA-N	0	3	331.460	3.102	20	30		EGEDHN
CC1(C)CC[C@@H]1C(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001209120475	1372004170	/nfs/dbraw/zinc/00/41/70/1372004170.db2.gz	FLDQFCQOFNKJME-RTBURBONSA-N	0	3	342.458	3.194	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)[C@@H](CC)CC2CCCC2)C1	ZINC001209126185	1372006033	/nfs/dbraw/zinc/00/60/33/1372006033.db2.gz	ZCUTVDKLZJIBDZ-NZSAHSFTSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC1CC2(CC(NCc3cc(C)no3)C2)C1	ZINC001121611734	1372024350	/nfs/dbraw/zinc/02/43/50/1372024350.db2.gz	XZBAFXSIZXFFFM-DKWICNMVSA-N	0	3	331.460	3.102	20	30		EGEDHN
CCCc1ccc(CN2C[C@@H]3CCN(C(=O)C#CC(C)C)[C@@H]3C2)cc1	ZINC001187840520	1388175166	/nfs/dbraw/zinc/17/51/66/1388175166.db2.gz	FYFSTGVTDRZAOY-LEWJYISDSA-N	0	3	338.495	3.331	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC1CC2(CC(NCc3cnc(C)o3)C2)C1	ZINC001121713383	1372056276	/nfs/dbraw/zinc/05/62/76/1372056276.db2.gz	HYDZGARTJJQHLE-XHVMPKOQSA-N	0	3	331.460	3.102	20	30		EGEDHN
CC(C)(C)OC(=O)NCCCCN1CCc2cc(C#N)ccc2C1	ZINC001209360782	1372078433	/nfs/dbraw/zinc/07/84/33/1372078433.db2.gz	XVKNHTZIWFMBHE-UHFFFAOYSA-N	0	3	329.444	3.221	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N1CCC(C(=O)c2ccc(C)cc2C)CC1	ZINC001121843987	1372099743	/nfs/dbraw/zinc/09/97/43/1372099743.db2.gz	ARZSHZNLIRALNE-LJQANCHMSA-N	0	3	342.483	3.408	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N[C@@H](CC)c1nc(-c2ccccc2)c[nH]1	ZINC001121856816	1372104311	/nfs/dbraw/zinc/10/43/11/1372104311.db2.gz	CENOJYHWGMBAJE-HOTGVXAUSA-N	0	3	326.444	3.328	20	30		EGEDHN
C=CCCCCCCN1C[C@H]2C[C@@H](C(=O)NCc3ccco3)[C@@H](C1)O2	ZINC001209437893	1372106353	/nfs/dbraw/zinc/10/63/53/1372106353.db2.gz	YEIGJFLCBTWUJW-GUDVDZBRSA-N	0	3	346.471	3.122	20	30		EGEDHN
C=CCOC(=O)N[C@@H]1CCCN(Cc2c[nH]c3c2cccc3C)C1	ZINC001209490200	1372119350	/nfs/dbraw/zinc/11/93/50/1372119350.db2.gz	RUJCVQRXEOIJKQ-MRXNPFEDSA-N	0	3	327.428	3.353	20	30		EGEDHN
C=CCC1(C(=O)N2CCC[C@H](NCC#Cc3ccccc3)C2)CCC1	ZINC001209502986	1372122333	/nfs/dbraw/zinc/12/23/33/1372122333.db2.gz	DTSLWIHZDJUKMD-FQEVSTJZSA-N	0	3	336.479	3.365	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CN(Cc3ccc4cc[nH]c4c3)C2)CC1	ZINC001209507998	1372124441	/nfs/dbraw/zinc/12/44/41/1372124441.db2.gz	WZFMTIMEOFHFHW-UHFFFAOYSA-N	0	3	339.439	3.388	20	30		EGEDHN
CC(C)C[C@H](C)C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001210357385	1372331026	/nfs/dbraw/zinc/33/10/26/1372331026.db2.gz	AVBOVQTZKFGRDK-ICSRJNTNSA-N	0	3	326.484	3.301	20	30		EGEDHN
F[C@H]1CNCCN(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)C1	ZINC001210580967	1372384236	/nfs/dbraw/zinc/38/42/36/1372384236.db2.gz	NMJSIWPOQZHLAA-LBPRGKRZSA-N	0	3	344.274	3.468	20	30		EGEDHN
C=C(CN1CCCCC1)c1nc(-c2cc(OC)cc(OC)c2)no1	ZINC001211436493	1372558652	/nfs/dbraw/zinc/55/86/52/1372558652.db2.gz	ODXCRWVKFVHQTF-UHFFFAOYSA-N	0	3	329.400	3.253	20	30		EGEDHN
C=C(CN1CCCCC1)c1nc(-c2ccncc2Br)no1	ZINC001211436436	1372558738	/nfs/dbraw/zinc/55/87/38/1372558738.db2.gz	LAWWHZQFYFIZGS-UHFFFAOYSA-N	0	3	349.232	3.393	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2ccc(C)s2)C[C@H]1c1ccccc1	ZINC001211516756	1372571179	/nfs/dbraw/zinc/57/11/79/1372571179.db2.gz	GJUDHFGZXGXPOZ-ZWKOTPCHSA-N	0	3	338.476	3.278	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2occc2Cl)C[C@H]1c1ccccc1	ZINC001211669093	1372599961	/nfs/dbraw/zinc/59/99/61/1372599961.db2.gz	INMFOCSXTXCWNO-DOTOQJQBSA-N	0	3	342.826	3.154	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2c[nH]cc2C2CC2)C[C@H]1c1ccccc1	ZINC001211698191	1372603930	/nfs/dbraw/zinc/60/39/30/1372603930.db2.gz	CMOMNBAIQJBHNW-LEWJYISDSA-N	0	3	347.462	3.113	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2ccc(F)cc2)[C@H](OC)C1	ZINC001211764802	1372612970	/nfs/dbraw/zinc/61/29/70/1372612970.db2.gz	PVUMZZBOTNKMCS-QZTJIDSGSA-N	0	3	334.435	3.001	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2ccc(F)cc2)[C@H](OC)C1	ZINC001211764777	1372613064	/nfs/dbraw/zinc/61/30/64/1372613064.db2.gz	OEYIUPHLXVOWSI-QZTJIDSGSA-N	0	3	336.451	3.225	20	30		EGEDHN
CN1CCN(c2ccc(Nc3ccc(O)c(F)c3F)cc2C#N)CC1	ZINC001212009917	1372646572	/nfs/dbraw/zinc/64/65/72/1372646572.db2.gz	ZATRDSNQVSNTQJ-UHFFFAOYSA-N	0	3	344.365	3.037	20	30		EGEDHN
CN1CCN(Cc2cccc(Nc3ccc(OCC#N)cc3)c2)CC1	ZINC001212609252	1372736773	/nfs/dbraw/zinc/73/67/73/1372736773.db2.gz	CUBHRNRYDLGPOY-UHFFFAOYSA-N	0	3	336.439	3.080	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CN(Cc2c(C)cccc2C)C[C@H]1OC	ZINC001213317490	1372882882	/nfs/dbraw/zinc/88/28/82/1372882882.db2.gz	MBTNPPNIVPJDGL-MISYRCLQSA-N	0	3	344.499	3.221	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN([C@@H]2CCCc3ccccc32)C[C@H]1OC	ZINC001213357300	1372891231	/nfs/dbraw/zinc/89/12/31/1372891231.db2.gz	NVIOAIVUIGEFTH-VAMGGRTRSA-N	0	3	342.483	3.236	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2CN(CCCC(C)(C)C)C[C@H]2OC)CC1	ZINC001213394974	1372899686	/nfs/dbraw/zinc/89/96/86/1372899686.db2.gz	HIGNCRUAEKPFEK-IAGOWNOFSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)[C@@H](c2ccccc2)C(C)C)[C@H](OC)C1	ZINC001213493843	1372914107	/nfs/dbraw/zinc/91/41/07/1372914107.db2.gz	IXISLTAFYXMEFU-VAMGGRTRSA-N	0	3	344.499	3.208	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)[C@H](c2ccccc2)C(C)C)[C@H](OC)C1	ZINC001213496607	1372914150	/nfs/dbraw/zinc/91/41/50/1372914150.db2.gz	UFGMZWDERBPAMW-AQNXPRMDSA-N	0	3	344.499	3.208	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CN([C@H](C)c2ccccc2C)C[C@H]1OC	ZINC001213497912	1372914982	/nfs/dbraw/zinc/91/49/82/1372914982.db2.gz	NJPOKZOOFLYPAB-BHIYHBOVSA-N	0	3	344.499	3.474	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CN([C@@H](C)c2ccccc2C)C[C@H]1OC	ZINC001213497913	1372915082	/nfs/dbraw/zinc/91/50/82/1372915082.db2.gz	NJPOKZOOFLYPAB-QXAKKESOSA-N	0	3	344.499	3.474	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)[C@@H](C)CC2CCCCC2)[C@H](OC)C1	ZINC001213524315	1372918424	/nfs/dbraw/zinc/91/84/24/1372918424.db2.gz	AAIOHTCFEJBKFD-QXAKKESOSA-N	0	3	336.520	3.375	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2cc(C)n(C)c2C)[C@H](OC)C1	ZINC001213827315	1372967923	/nfs/dbraw/zinc/96/79/23/1372967923.db2.gz	KDYJOERDVZAEJA-RTBURBONSA-N	0	3	349.519	3.041	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)C[C@H](C)CCc2ccccc2)[C@H](OC)C1	ZINC001213966186	1372987968	/nfs/dbraw/zinc/98/79/68/1372987968.db2.gz	JWSSHVVBOPLBDW-MISYRCLQSA-N	0	3	344.499	3.037	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccco2)C[C@H]1NCC#Cc1ccccc1Cl	ZINC001214049844	1372999973	/nfs/dbraw/zinc/99/99/73/1372999973.db2.gz	WYRHWOKFNNOKOM-RHSMWYFYSA-N	0	3	342.826	3.035	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H]2CN(Cc3ccc4c(c3)COC4)C[C@H]21	ZINC001188080968	1388237408	/nfs/dbraw/zinc/23/74/08/1388237408.db2.gz	SFEDFKIHTDKFPZ-FXAWDEMLSA-N	0	3	340.467	3.106	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CC=CC2)C[C@H]1NCC#Cc1ccc(Cl)cc1	ZINC001214379936	1373052028	/nfs/dbraw/zinc/05/20/28/1373052028.db2.gz	HJFGDDDDQRZORY-DNVCBOLYSA-N	0	3	342.870	3.094	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2CCC2)C[C@H]1NCC#Cc1ccc(Cl)cc1	ZINC001214391743	1373053427	/nfs/dbraw/zinc/05/34/27/1373053427.db2.gz	VPNPFJSQTRHVJW-DNVCBOLYSA-N	0	3	344.886	3.318	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2(C)CCCC2)C[C@H]1NCC#Cc1ccc(F)cc1	ZINC001215256919	1373190981	/nfs/dbraw/zinc/19/09/81/1373190981.db2.gz	CLRFVWKJUHTHMN-VQIMIIECSA-N	0	3	342.458	3.194	20	30		EGEDHN
C=C(C)CNCc1ccncc1O[C@H]1CCN(C(=O)C(C)(C)CC)C1	ZINC001127898564	1373198146	/nfs/dbraw/zinc/19/81/46/1373198146.db2.gz	TVCCVSYMHDXMKQ-KRWDZBQOSA-N	0	3	345.487	3.163	20	30		EGEDHN
CC(C)C[C@H](C)C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001216099096	1373262399	/nfs/dbraw/zinc/26/23/99/1373262399.db2.gz	HMKOGHMBJTVIOV-QMTMVMCOSA-N	0	3	345.462	3.316	20	30		EGEDHN
CCC[C@H](CC)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001216104981	1373264407	/nfs/dbraw/zinc/26/44/07/1373264407.db2.gz	QVISNEDFEXQXHL-IMFGXOCKSA-N	0	3	344.474	3.440	20	30		EGEDHN
Cc1ccc2occ(CC(=O)NCCNCc3ccc(C#N)cc3)c2c1	ZINC001128432426	1373266436	/nfs/dbraw/zinc/26/64/36/1373266436.db2.gz	SHHCFLONUPUXNN-UHFFFAOYSA-N	0	3	347.418	3.061	20	30		EGEDHN
CC(C)(C)c1ccncc1CNCCC(=O)Nc1cccc(C#N)c1	ZINC001326597199	1388252333	/nfs/dbraw/zinc/25/23/33/1388252333.db2.gz	SRISYTVRKGLYQD-UHFFFAOYSA-N	0	3	336.439	3.369	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](C)[C@H](NCc3cncc(F)c3)C2)CCCC1	ZINC001217106415	1373388211	/nfs/dbraw/zinc/38/82/11/1373388211.db2.gz	QPCPCNRAOLSEKO-CRAIPNDOSA-N	0	3	345.462	3.294	20	30		EGEDHN
CC[C@H]1CCC[C@]1(C)C(=O)NCCNCc1ccc(C#N)c(F)c1	ZINC001130259047	1373479850	/nfs/dbraw/zinc/47/98/50/1373479850.db2.gz	VCNBDWBDRAGIFO-LPHOPBHVSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)[C@@H](C)C(CC)CC)C1	ZINC001130402111	1373521660	/nfs/dbraw/zinc/52/16/60/1373521660.db2.gz	WCBMUGXCMDBDTE-HOCLYGCPSA-N	0	3	332.492	3.074	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)CCC[C@@H](C)CCC)[C@H]2C1	ZINC001218003833	1373532894	/nfs/dbraw/zinc/53/28/94/1373532894.db2.gz	IIIHDBZISOSCPU-GBESFXJTSA-N	0	3	336.520	3.471	20	30		EGEDHN
COc1ccc(/C=C/C(=O)c2ccccc2O[C@H]2CNC[C@@H]2F)cc1	ZINC001218016164	1373538486	/nfs/dbraw/zinc/53/84/86/1373538486.db2.gz	BKZLICAJXIYIST-GZVGFQSESA-N	0	3	341.382	3.280	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2OCCN(C(=O)c3cc(C)sc3C)[C@H]2C1	ZINC001218252579	1373583730	/nfs/dbraw/zinc/58/37/30/1373583730.db2.gz	DZDUPSOGJNERDI-DOPJRALCSA-N	0	3	348.512	3.245	20	30		EGEDHN
Cc1noc2nc(O[C@@H](C)c3ccccc3C#N)c3c(c12)CCNC3	ZINC001218409112	1373609339	/nfs/dbraw/zinc/60/93/39/1373609339.db2.gz	PWERGHNXRANVBC-LBPRGKRZSA-N	0	3	334.379	3.189	20	30		EGEDHN
C#CCCCCCC(=O)N1CCO[C@@H]2CN(CCCC(C)(C)C)C[C@@H]21	ZINC001218454186	1373616679	/nfs/dbraw/zinc/61/66/79/1373616679.db2.gz	BBDFEQOUSLBTPP-RBUKOAKNSA-N	0	3	348.531	3.308	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)c3ccc(Cl)c(C)c3)[C@H]2C1	ZINC001218566243	1373633677	/nfs/dbraw/zinc/63/36/77/1373633677.db2.gz	MLIGHIFPQCMLNR-ZWKOTPCHSA-N	0	3	348.874	3.140	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)Nc1ccnc(-c2cc(N)ccn2)c1	ZINC001218612302	1373636546	/nfs/dbraw/zinc/63/65/46/1373636546.db2.gz	QWYOBBSAWGYGEY-INIZCTEOSA-N	0	3	339.443	3.128	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)c3ccc(C)cc3Cl)[C@H]2C1	ZINC001218665406	1373642529	/nfs/dbraw/zinc/64/25/29/1373642529.db2.gz	CQMXWDAQTGHOLA-ZWKOTPCHSA-N	0	3	348.874	3.140	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)C[C@@H]2C[C@H]2Cc2ccccc2)c1	ZINC001131626652	1373735962	/nfs/dbraw/zinc/73/59/62/1373735962.db2.gz	CJQRWTYFMBODJE-RTWAWAEBSA-N	0	3	347.462	3.033	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)CN(C(=O)CCCCCC(C)C)C[C@H](C)O2	ZINC001131688014	1373762959	/nfs/dbraw/zinc/76/29/59/1373762959.db2.gz	GNPUFDFWHGOLJG-PZJWPPBQSA-N	0	3	348.531	3.308	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C(C)(C)CC(C)C)C[C@H](C)O2	ZINC001131691828	1373765647	/nfs/dbraw/zinc/76/56/47/1373765647.db2.gz	AMOADXYPXNGQFT-FXAWDEMLSA-N	0	3	336.520	3.327	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)[C@@H]2CCCC[C@@H]2C2CC2)s1	ZINC001131742038	1373780646	/nfs/dbraw/zinc/78/06/46/1373780646.db2.gz	PTTWEYFFJRZLEI-IAGOWNOFSA-N	0	3	331.485	3.042	20	30		EGEDHN
C=CCOCCN1CC[C@@H]2CN(C(=O)CC3CCCCCC3)[C@@H]2C1	ZINC001221835295	1373795401	/nfs/dbraw/zinc/79/54/01/1373795401.db2.gz	FUTQWVYFEZTQOI-RTBURBONSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2snnc2C)CC[C@H]1C	ZINC001131779768	1373799215	/nfs/dbraw/zinc/79/92/15/1373799215.db2.gz	JZDKSIBUNYWNDL-HIFRSBDPSA-N	0	3	336.505	3.176	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@H]3CCN(CCOC(C)C)C[C@H]32)CCCC1	ZINC001222150992	1373817640	/nfs/dbraw/zinc/81/76/40/1373817640.db2.gz	CECHIQHSDKQLHF-QZTJIDSGSA-N	0	3	334.504	3.081	20	30		EGEDHN
Cc1ccc(CN2C[C@H](NC(=O)CSCC#N)CC[C@H]2C)c(C)c1	ZINC001131830307	1373827608	/nfs/dbraw/zinc/82/76/08/1373827608.db2.gz	PSNCAIGOPFVNAD-SJLPKXTDSA-N	0	3	345.512	3.029	20	30		EGEDHN
Cc1ccc(CN2C[C@@H](NC(=O)CSCC#N)CC[C@H]2C)c(C)c1	ZINC001131830305	1373828044	/nfs/dbraw/zinc/82/80/44/1373828044.db2.gz	PSNCAIGOPFVNAD-AEFFLSMTSA-N	0	3	345.512	3.029	20	30		EGEDHN
O=C(Nc1cccc(Cl)c1F)N1CCC2SC(=O)C=C2C1	ZINC001188386943	1388300138	/nfs/dbraw/zinc/30/01/38/1388300138.db2.gz	NJGJBXOVAWPEIC-NSHDSACASA-N	0	3	326.780	3.285	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](NCc3ncccc3C)C2)CCCC1	ZINC001188490736	1388318032	/nfs/dbraw/zinc/31/80/32/1388318032.db2.gz	YWPFZVYFLZFXEA-QGZVFWFLSA-N	0	3	327.472	3.217	20	30		EGEDHN
CC[C@H](C)C(=O)N[C@@H]1CCCC[C@H]1NCc1ccc(C#N)cc1F	ZINC001224861443	1375080593	/nfs/dbraw/zinc/08/05/93/1375080593.db2.gz	SXBOAPJUEDFCKP-MORSLUCNSA-N	0	3	331.435	3.260	20	30		EGEDHN
C=CCCCCCN1C[C@H](NC(=O)c2cc(OC)no2)CC[C@H]1C	ZINC001131979776	1375080835	/nfs/dbraw/zinc/08/08/35/1375080835.db2.gz	AXHYOACSHXPAKP-HUUCEWRRSA-N	0	3	335.448	3.012	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H]1CC[C@H](C)N(Cc2ccc3ncccc3c2)C1	ZINC001132016474	1375099463	/nfs/dbraw/zinc/09/94/63/1375099463.db2.gz	HHBKOCRZPAJQJS-PXNSSMCTSA-N	0	3	349.478	3.363	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H]1CC[C@H](C)N(Cc2ccc3c(c2)CCC3)C1	ZINC001132017148	1375100559	/nfs/dbraw/zinc/10/05/59/1375100559.db2.gz	MIKPLWQLYPKECA-UWJYYQICSA-N	0	3	338.495	3.304	20	30		EGEDHN
C[C@@H](C#N)C(=O)N[C@@H]1CCCC[C@H]1NCc1ccc(Cl)cc1F	ZINC001225396135	1375107792	/nfs/dbraw/zinc/10/77/92/1375107792.db2.gz	ZLWSQGCAZLCLQO-IUIKQTSFSA-N	0	3	337.826	3.156	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COc2cc(C)ccc2F)CC[C@H]1C	ZINC001132041753	1375112976	/nfs/dbraw/zinc/11/29/76/1375112976.db2.gz	KEZOVIIDHFIXSN-HZPDHXFCSA-N	0	3	334.435	3.058	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1CC[C@@H](C)N(CCOCC(C)C)C1	ZINC001132057234	1375122899	/nfs/dbraw/zinc/12/28/99/1375122899.db2.gz	LTAABIRGVYFETQ-IEBWSBKVSA-N	0	3	336.520	3.397	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NCC1CCN([C@@H](C)c2ccc(F)cc2)CC1	ZINC001225631237	1375135773	/nfs/dbraw/zinc/13/57/73/1375135773.db2.gz	JVPDNYNZBUDOPK-JKSUJKDBSA-N	0	3	348.462	3.306	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2cc(F)ccc2CC)CC[C@@H]1C	ZINC001132148970	1375170688	/nfs/dbraw/zinc/17/06/88/1375170688.db2.gz	DRUMLZVJSXOBPL-YJBOKZPZSA-N	0	3	348.462	3.173	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CC[C@H](C)N(Cc2cccc(N(C)C)c2)C1	ZINC001132218550	1375217561	/nfs/dbraw/zinc/21/75/61/1375217561.db2.gz	RSIJNKJTAYPAJS-FUHWJXTLSA-N	0	3	343.515	3.434	20	30		EGEDHN
O=C(N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1)C1(C(F)F)CC1	ZINC001226259515	1375229044	/nfs/dbraw/zinc/22/90/44/1375229044.db2.gz	OVOUIRCVSMREMZ-IAGOWNOFSA-N	0	3	346.421	3.100	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)CCCc2ccccc2)CC[C@H]1C	ZINC001132260735	1375251344	/nfs/dbraw/zinc/25/13/44/1375251344.db2.gz	HJRUZGXAKQVTCA-UYAOXDASSA-N	0	3	344.499	3.181	20	30		EGEDHN
C=C1C(=O)O[C@H]2[C@H]1CCC(C)=C1CC[C@@](C)(Oc3ccnc(N)c3)[C@@H]12	ZINC001226658072	1375301099	/nfs/dbraw/zinc/30/10/99/1375301099.db2.gz	UWWGEQQANBEARJ-TXJVSEOTSA-N	0	3	340.423	3.419	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2(Cc3ccc(F)cc3)CC2)CC[C@@H]1C	ZINC001132340673	1375320634	/nfs/dbraw/zinc/32/06/34/1375320634.db2.gz	XCBNGIJXWAUCDL-LPHOPBHVSA-N	0	3	342.458	3.141	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCCOc2ccccc2)CC[C@H]1C	ZINC001132464366	1375407629	/nfs/dbraw/zinc/40/76/29/1375407629.db2.gz	RSFSLYRZQXPQII-MSOLQXFVSA-N	0	3	330.472	3.391	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)COc2ccccc2C(C)C)CC[C@H]1C	ZINC001132469882	1375411351	/nfs/dbraw/zinc/41/13/51/1375411351.db2.gz	YHFBVEVTZQHZIZ-QZTJIDSGSA-N	0	3	342.483	3.181	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCCOc2cccc(F)c2)CC[C@H]1C	ZINC001132508442	1375431619	/nfs/dbraw/zinc/43/16/19/1375431619.db2.gz	KAESGMJRASSKTG-WBVHZDCISA-N	0	3	334.435	3.140	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCc2cc(F)ccc2F)CC[C@H]1C	ZINC001132524831	1375440537	/nfs/dbraw/zinc/44/05/37/1375440537.db2.gz	MMMBZVQNDORPNT-PBHICJAKSA-N	0	3	336.426	3.443	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCc2cccc(OCC)c2)CC[C@H]1C	ZINC001132525187	1375441479	/nfs/dbraw/zinc/44/14/79/1375441479.db2.gz	ORIJETFRVOFSAD-AEFFLSMTSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1CC[C@@H](C)N(Cc2ccc(C)cc2)C1	ZINC001132528297	1375442932	/nfs/dbraw/zinc/44/29/32/1375442932.db2.gz	BHKURXGVVJCGKQ-IEBWSBKVSA-N	0	3	330.472	3.057	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2(C(F)(F)F)CCCCC2)CC[C@@H]1C	ZINC001132543448	1375450845	/nfs/dbraw/zinc/45/08/45/1375450845.db2.gz	YIJYVEBAAOCOBH-LSDHHAIUSA-N	0	3	344.421	3.492	20	30		EGEDHN
C#CCC1(C(=O)NC2CCN(CCc3ccccc3F)CC2)CCC1	ZINC001227755065	1375472250	/nfs/dbraw/zinc/47/22/50/1375472250.db2.gz	XSDBSCSQIKLVPN-UHFFFAOYSA-N	0	3	342.458	3.142	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](C)[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001132696240	1375518146	/nfs/dbraw/zinc/51/81/46/1375518146.db2.gz	IJCGILVGXOOUCW-QAPCUYQASA-N	0	3	343.446	3.238	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](C)[C@@H](CNCc2cc(C3CC3)no2)C1	ZINC001132700480	1375521152	/nfs/dbraw/zinc/52/11/52/1375521152.db2.gz	ILWJSWLYAUUHNL-HOCLYGCPSA-N	0	3	331.460	3.092	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CCCC[C@H]1NCc1cccc(OCC)n1	ZINC001228270112	1375538167	/nfs/dbraw/zinc/53/81/67/1375538167.db2.gz	MWMKQKYLXMDVPS-QZTJIDSGSA-N	0	3	345.487	3.354	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CCN(CCOc2cc(C)cc(C)c2)CC1	ZINC001228631210	1375621980	/nfs/dbraw/zinc/62/19/80/1375621980.db2.gz	GYTKUHXUTSMDQP-UHFFFAOYSA-N	0	3	344.499	3.475	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC001228809120	1375683984	/nfs/dbraw/zinc/68/39/84/1375683984.db2.gz	FIJPLTAWPGZVKW-INIZCTEOSA-N	0	3	330.472	3.378	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H](C)C(C)C	ZINC001228900499	1375708425	/nfs/dbraw/zinc/70/84/25/1375708425.db2.gz	FCQDDPHDHFOANJ-MGPQQGTHSA-N	0	3	331.298	3.204	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](C)[C@@H](CNCc2ccccc2C#N)C1	ZINC001133090900	1375769194	/nfs/dbraw/zinc/76/91/94/1375769194.db2.gz	LPZZTQOJUVOQKM-PXNSSMCTSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](C)[C@H](CNCc2ocnc2C)C1	ZINC001133142327	1375804165	/nfs/dbraw/zinc/80/41/65/1375804165.db2.gz	NPXLUHMYIIRQCY-GOEBONIOSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](C)[C@H](CNCc2cscn2)C1	ZINC001133143708	1375804717	/nfs/dbraw/zinc/80/47/17/1375804717.db2.gz	WTQJXVLKTPQXIM-LSDHHAIUSA-N	0	3	335.517	3.320	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C[C@@H]1C=CCC1	ZINC001133382474	1375963712	/nfs/dbraw/zinc/96/37/12/1375963712.db2.gz	KNHUIXWRWCBITC-MRXNPFEDSA-N	0	3	330.859	3.248	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C[C@H](C)SC	ZINC001133392600	1375976721	/nfs/dbraw/zinc/97/67/21/1375976721.db2.gz	FBXWOIDPZMLSOW-AWEZNQCLSA-N	0	3	338.904	3.033	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@]12C[C@H]1CCC2	ZINC001133399161	1375982661	/nfs/dbraw/zinc/98/26/61/1375982661.db2.gz	GBBJWQULNYWDQX-VQIMIIECSA-N	0	3	330.859	3.082	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H](C)c1ccco1	ZINC001133407433	1375991512	/nfs/dbraw/zinc/99/15/12/1375991512.db2.gz	GZJIWDAQZIBDFZ-HNNXBMFYSA-N	0	3	344.842	3.288	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@H]1CC12CCCC2	ZINC001133410654	1375993356	/nfs/dbraw/zinc/99/33/56/1375993356.db2.gz	UBIIELNIQAXOMI-GOSISDBHSA-N	0	3	344.886	3.472	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)CC2CCC(C)(C)CC2)CC1	ZINC001230469875	1376033853	/nfs/dbraw/zinc/03/38/53/1376033853.db2.gz	UOFJMXXVBGXWIE-UHFFFAOYSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1C1CCN(C(=O)CCCOCC)CC1	ZINC001230522952	1376054507	/nfs/dbraw/zinc/05/45/07/1376054507.db2.gz	WVDZKIVNRIHWBD-KRWDZBQOSA-N	0	3	342.911	3.259	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)c1ccc(F)cc1	ZINC001133550476	1376079627	/nfs/dbraw/zinc/07/96/27/1376079627.db2.gz	PZNNDXZDIXVVHF-VXGBXAGGSA-N	0	3	343.240	3.221	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)CC1CCCC1	ZINC001133572739	1376098630	/nfs/dbraw/zinc/09/86/30/1376098630.db2.gz	KGCFNMVYNCYBQQ-STQMWFEESA-N	0	3	331.298	3.348	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1ccccc1C#N)NC(=O)c1cccs1	ZINC001133576501	1376101805	/nfs/dbraw/zinc/10/18/05/1376101805.db2.gz	HWIHDLXJQYRUKI-UONOGXRCSA-N	0	3	327.453	3.306	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H](C)C[C@@H](C)NCc2ccccc2C#N)o1	ZINC001133653623	1376139783	/nfs/dbraw/zinc/13/97/83/1376139783.db2.gz	TWBBAYIQFYXOLT-KGLIPLIRSA-N	0	3	325.412	3.146	20	30		EGEDHN
C#CCCN(CCCNC(=O)C[C@H](CC)C(C)C)Cc1cccnc1	ZINC001230906307	1376180933	/nfs/dbraw/zinc/18/09/33/1376180933.db2.gz	QWDHADDUXNBXLS-FQEVSTJZSA-N	0	3	343.515	3.486	20	30		EGEDHN
Cc1ncsc1C(=O)N[C@@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001133784044	1376206138	/nfs/dbraw/zinc/20/61/38/1376206138.db2.gz	FFBNRYVRXHMCGJ-OLZOCXBDSA-N	0	3	342.468	3.010	20	30		EGEDHN
C=CCCC(=O)N(C)C[C@H]1CCN1CC[C@@H](C)OCc1ccccc1	ZINC001231168873	1376212279	/nfs/dbraw/zinc/21/22/79/1376212279.db2.gz	BXLZFYKUJURRTD-UYAOXDASSA-N	0	3	344.499	3.481	20	30		EGEDHN
Cc1c(C)c(C)c(CN2CC[C@H]2CN(C)C(=O)[C@@H](C)C#N)c(C)c1C	ZINC001231284865	1376220612	/nfs/dbraw/zinc/22/06/12/1376220612.db2.gz	WVEJXQIDYTYFOD-DJJJIMSYSA-N	0	3	341.499	3.421	20	30		EGEDHN
C=CCCC(=O)N[C@@H](C)C[C@@H](C)NCc1ccn(C2CCCC2)n1	ZINC001133888013	1376250375	/nfs/dbraw/zinc/25/03/75/1376250375.db2.gz	FDJIXHHLGVOZNR-CVEARBPZSA-N	0	3	332.492	3.337	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1ccc(OCC)nc1)CC2	ZINC001231653745	1376293620	/nfs/dbraw/zinc/29/36/20/1376293620.db2.gz	NWIFOFMMIZDPFR-FQEVSTJZSA-N	0	3	343.471	3.013	20	30		EGEDHN
C#CCCCCC(=O)N[C@H](C)C[C@H](C)NCc1ccn(C(C)C)n1	ZINC001134118958	1376377161	/nfs/dbraw/zinc/37/71/61/1376377161.db2.gz	JRPKJSJFLTUTPP-DLBZAZTESA-N	0	3	332.492	3.031	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)[C@H]2[C@@H]3CCCCCC[C@@H]32)cc1F	ZINC001134315469	1376471435	/nfs/dbraw/zinc/47/14/35/1376471435.db2.gz	ZOYKOQRLFXRHDN-DZFIZOCASA-N	0	3	343.446	3.120	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1c(F)cccc1Cl)NC(=O)C#CC1CC1	ZINC001134321938	1376475682	/nfs/dbraw/zinc/47/56/82/1376475682.db2.gz	NCZCSLDYAABSPR-QWHCGFSZSA-N	0	3	336.838	3.265	20	30		EGEDHN
COC(=O)c1cccc2c(CN(C)Cc3cccc(C#N)c3)c[nH]c21	ZINC001232711502	1376507538	/nfs/dbraw/zinc/50/75/38/1376507538.db2.gz	PWWXIOLZWUAEHX-UHFFFAOYSA-N	0	3	333.391	3.458	20	30		EGEDHN
C=CCCCCC[NH2+][C@H](C)C[C@H](C)NC(=O)c1cccc2n[n-]nc21	ZINC001134410631	1376515951	/nfs/dbraw/zinc/51/59/51/1376515951.db2.gz	ZDCCGEAOUBVPAI-CABCVRRESA-N	0	3	343.475	3.191	20	30		EGEDHN
Cc1oc(C(C)(C)C)cc1C(=O)NCCNCc1cccc(C#N)c1	ZINC001134428735	1376529867	/nfs/dbraw/zinc/52/98/67/1376529867.db2.gz	ZHTSYCMNOTXCIV-UHFFFAOYSA-N	0	3	339.439	3.277	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cc(C)ns1)[C@@H]2CC	ZINC001233310414	1376609740	/nfs/dbraw/zinc/60/97/40/1376609740.db2.gz	GDBSTHIGASPUNW-AEFFLSMTSA-N	0	3	333.501	3.373	20	30		EGEDHN
CC[C@@H](Cc1ccccc1)C(=O)NCCNCc1ccc(C#N)cc1	ZINC001134589283	1376612823	/nfs/dbraw/zinc/61/28/23/1376612823.db2.gz	RFJFQSGKNXTGOK-FQEVSTJZSA-N	0	3	335.451	3.033	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)Cc2cccc3sccc32)cc1	ZINC001134821994	1376742435	/nfs/dbraw/zinc/74/24/35/1376742435.db2.gz	WXILWAFDMMDHIB-UHFFFAOYSA-N	0	3	349.459	3.221	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)N(C)C[C@H]1CCN1Cc1ccccc1C(C)C	ZINC001233978031	1376748026	/nfs/dbraw/zinc/74/80/26/1376748026.db2.gz	QLDWEJDAYIBBAW-NQIIRXRSSA-N	0	3	344.499	3.170	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)CCOc1ccc(C)c(C)c1	ZINC001235036392	1376834165	/nfs/dbraw/zinc/83/41/65/1376834165.db2.gz	MUQMWZIJUHYMJQ-GOSISDBHSA-N	0	3	330.472	3.181	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)CCC(F)F)NCc1cc(F)ccc1C#N	ZINC001135011499	1376844560	/nfs/dbraw/zinc/84/45/60/1376844560.db2.gz	FLUXDFUEZOEESI-NEPJUHHUSA-N	0	3	341.377	3.116	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H](C)C[C@H](C)NCc1nc(C)cs1	ZINC001135188747	1376961749	/nfs/dbraw/zinc/96/17/49/1376961749.db2.gz	OYDFFOHHPSFUEZ-LSDHHAIUSA-N	0	3	335.517	3.408	20	30		EGEDHN
C[C@@H](CC(=O)NCCNCc1ccc(C#N)s1)C1CCCCC1	ZINC001135227640	1376987491	/nfs/dbraw/zinc/98/74/91/1376987491.db2.gz	JBRBFHSJTXNWDQ-AWEZNQCLSA-N	0	3	333.501	3.432	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H](C)C[C@H](C)NCc1cc(F)ccc1C#N	ZINC001135231346	1376990811	/nfs/dbraw/zinc/99/08/11/1376990811.db2.gz	ZJGQQEPTZBPWLI-UONOGXRCSA-N	0	3	331.435	3.282	20	30		EGEDHN
CC#CCCCC(=O)N[C@H](C)C[C@H](C)NCc1cc(F)ccc1C#N	ZINC001135236431	1376993170	/nfs/dbraw/zinc/99/31/70/1376993170.db2.gz	SENWVHOUVMGUJP-JKSUJKDBSA-N	0	3	343.446	3.264	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)C(C)(C)C1CC1)NCc1ccccc1C#N	ZINC001135248294	1377001579	/nfs/dbraw/zinc/00/15/79/1377001579.db2.gz	YGZWMNNFIOGTJV-HUUCEWRRSA-N	0	3	327.472	3.367	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H](C)C[C@H](C)NCc2nccn2CC)CC1	ZINC001135383899	1377066591	/nfs/dbraw/zinc/06/65/91/1377066591.db2.gz	XGHCDQNNJRYHDH-JKSUJKDBSA-N	0	3	332.492	3.022	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)c1occc1Cl	ZINC001135399033	1377074025	/nfs/dbraw/zinc/07/40/25/1377074025.db2.gz	PEEUZUSNDKAAFL-NXEZZACHSA-N	0	3	349.656	3.328	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](C)C[C@@H](C)NCc2oc(C)nc2C)CC1	ZINC001135416192	1377083175	/nfs/dbraw/zinc/08/31/75/1377083175.db2.gz	RGMBUFSNWIYTJK-ZIAGYGMSSA-N	0	3	333.476	3.411	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](C)C[C@H](C)NCc2nccn2CC)CC1	ZINC001135416446	1377083230	/nfs/dbraw/zinc/08/32/30/1377083230.db2.gz	UKCDBNUPNYDABD-HOTGVXAUSA-N	0	3	332.492	3.022	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)C(C)(C)C(F)F)NCc1ccccc1C#N	ZINC001135422174	1377087008	/nfs/dbraw/zinc/08/70/08/1377087008.db2.gz	FWSGRYKPUZSXMJ-OLZOCXBDSA-N	0	3	337.414	3.222	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H](C)C[C@@H](C)NCc2cc(C3CC3)no2)C1	ZINC001135426292	1377089726	/nfs/dbraw/zinc/08/97/26/1377089726.db2.gz	BVHKVBORNNCFRV-ZIAGYGMSSA-N	0	3	331.460	3.281	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H](C)C[C@@H](C)NCc2ccn(C(C)C)n2)C1	ZINC001135428054	1377091851	/nfs/dbraw/zinc/09/18/51/1377091851.db2.gz	YHKMBMPNEKOWHD-CVEARBPZSA-N	0	3	332.492	3.193	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CC[C@@H](N(C)Cc2ccc(F)cc2C)C1	ZINC001189242801	1388493365	/nfs/dbraw/zinc/49/33/65/1388493365.db2.gz	MCFLZMFYYGAWCG-VQIMIIECSA-N	0	3	348.462	3.148	20	30		EGEDHN
CCCc1noc([C@@H]2CCCN(Cc3ccc(OCC#N)cc3)C2)n1	ZINC001137121486	1377481956	/nfs/dbraw/zinc/48/19/56/1377481956.db2.gz	NTTVXJUAJKJKKL-MRXNPFEDSA-N	0	3	340.427	3.304	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3cnc4ccccc4c3)C2)C1=O	ZINC001137279062	1377509495	/nfs/dbraw/zinc/50/94/95/1377509495.db2.gz	BDHBLXXOVVOCMA-OAQYLSRUSA-N	0	3	335.451	3.235	20	30		EGEDHN
C=CCO[C@H]1CO[C@@]2(C1)CCCN(Cc1cc3ccccc3[nH]1)C2	ZINC001137317808	1377518068	/nfs/dbraw/zinc/51/80/68/1377518068.db2.gz	SSVTVLWHELTPIB-UYAOXDASSA-N	0	3	326.440	3.494	20	30		EGEDHN
CCC#CC(=O)N1CCC[C@]2(CCCN(Cc3scnc3C)C2)C1	ZINC001268951164	1377532834	/nfs/dbraw/zinc/53/28/34/1377532834.db2.gz	GADHBSDJQLJEMJ-IBGZPJMESA-N	0	3	345.512	3.070	20	30		EGEDHN
CC(=O)N(C)[C@@H]1CCN(Cc2ccc(C#Cc3ccccc3)cc2)C1	ZINC001138335847	1377704486	/nfs/dbraw/zinc/70/44/86/1377704486.db2.gz	DFIXSZZKLAXYAL-JOCHJYFZSA-N	0	3	332.447	3.139	20	30		EGEDHN
Cc1nc(CCN(C)Cc2ccc(C#Cc3ccccc3)cc2)no1	ZINC001138335114	1377704822	/nfs/dbraw/zinc/70/48/22/1377704822.db2.gz	GLASFMPXFIYFTO-UHFFFAOYSA-N	0	3	331.419	3.452	20	30		EGEDHN
C#CCOc1ccc(CN2CCC(c3cccnc3)CC2)cc1OC	ZINC001138347417	1377707687	/nfs/dbraw/zinc/70/76/87/1377707687.db2.gz	WUYVDAHNMCQQBJ-UHFFFAOYSA-N	0	3	336.435	3.482	20	30		EGEDHN
C#CCOc1ccc(CN2CCC3(CC2)C(=O)Nc2ccccc23)cc1	ZINC001138556372	1377741720	/nfs/dbraw/zinc/74/17/20/1377741720.db2.gz	SBQVHIQYTCPIKD-UHFFFAOYSA-N	0	3	346.430	3.185	20	30		EGEDHN
C#CCOc1ccc(CN2CCC[C@]3(C[C@H](OCC=C)CO3)C2)cc1	ZINC001138558758	1377741973	/nfs/dbraw/zinc/74/19/73/1377741973.db2.gz	IFVPYGRESKQFSR-SFTDATJTSA-N	0	3	341.451	3.025	20	30		EGEDHN
C#CCOc1ccc(CN2CCC[C@]3(CCCCN3C(C)=O)C2)cc1	ZINC001138558212	1377742159	/nfs/dbraw/zinc/74/21/59/1377742159.db2.gz	MYGQNIHLJJWVNY-OAQYLSRUSA-N	0	3	340.467	3.066	20	30		EGEDHN
C=CCN1C(=O)CCC[C@]12CCCN(Cc1c[nH]nc1C(C)(C)C)C2	ZINC001138576903	1377745524	/nfs/dbraw/zinc/74/55/24/1377745524.db2.gz	GTQMOPCDYYOWNF-HXUWFJFHSA-N	0	3	344.503	3.240	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@]3(CCC(=O)N3C)[C@@H]2CC)c1[O-]	ZINC001138628590	1377756618	/nfs/dbraw/zinc/75/66/18/1377756618.db2.gz	YFZILYYUNPLJFX-RXVVDRJESA-N	0	3	342.483	3.486	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@]3(CCC(=O)N3C)[C@@H]2CC)c1[O-]	ZINC001138628590	1377756621	/nfs/dbraw/zinc/75/66/21/1377756621.db2.gz	YFZILYYUNPLJFX-RXVVDRJESA-N	0	3	342.483	3.486	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@]3(CCCCN3C(C)=O)C2)c1[O-]	ZINC001138627577	1377756995	/nfs/dbraw/zinc/75/69/95/1377756995.db2.gz	MJOXEXBPYRFTEA-OAQYLSRUSA-N	0	3	342.483	3.488	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@]3(CCCCN3C(C)=O)C2)c1[O-]	ZINC001138627577	1377756996	/nfs/dbraw/zinc/75/69/96/1377756996.db2.gz	MJOXEXBPYRFTEA-OAQYLSRUSA-N	0	3	342.483	3.488	20	30		EGEDHN
C=C(C)COc1ccccc1CN1CCC2(CCN(CC)C2=O)CC1	ZINC001138666132	1377765127	/nfs/dbraw/zinc/76/51/27/1377765127.db2.gz	JNOWOOPCANQJGU-UHFFFAOYSA-N	0	3	342.483	3.476	20	30		EGEDHN
COc1cc(Cl)cc(CN2CCC3SC(=O)C=C3C2)c1OC	ZINC001138743056	1377778451	/nfs/dbraw/zinc/77/84/51/1377778451.db2.gz	LQYZYIKPCHONAW-CQSZACIVSA-N	0	3	339.844	3.131	20	30		EGEDHN
C=CCOc1ccccc1CN1CC[C@]2(C[C@@H](OCC3CC3)CO2)C1	ZINC001139032357	1377820263	/nfs/dbraw/zinc/82/02/63/1377820263.db2.gz	LMXYTBXOYRBKJN-CTNGQTDRSA-N	0	3	343.467	3.411	20	30		EGEDHN
C=CCOc1ccccc1CN1CC[C@@H]2[C@@H](CCN2C(=O)C(C)C)C1	ZINC001139032588	1377820445	/nfs/dbraw/zinc/82/04/45/1377820445.db2.gz	PWYDKMSEZVDITA-PKOBYXMFSA-N	0	3	342.483	3.330	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cnn(CCC)c1)[C@H]2CC	ZINC001139038585	1377821068	/nfs/dbraw/zinc/82/10/68/1377821068.db2.gz	FXGYQGAEJBIIKR-ICSRJNTNSA-N	0	3	344.503	3.215	20	30		EGEDHN
N#Cc1ccc(N2CCCN(Cc3cc4ccccc4o3)CC2)nc1	ZINC001139064466	1377823686	/nfs/dbraw/zinc/82/36/86/1377823686.db2.gz	DVEAFMDKMXIGAH-UHFFFAOYSA-N	0	3	332.407	3.412	20	30		EGEDHN
N#Cc1ccc(Oc2ccc(CN3CCc4nccn4CC3)cn2)cc1	ZINC001139427836	1377883276	/nfs/dbraw/zinc/88/32/76/1377883276.db2.gz	TZJCDFUYWDTJPY-UHFFFAOYSA-N	0	3	345.406	3.000	20	30		EGEDHN
CCN(CCC(=O)OC)Cc1ccc(Oc2ccc(C#N)cc2)nc1	ZINC001139428599	1377883627	/nfs/dbraw/zinc/88/36/27/1377883627.db2.gz	MNBIRUUNZQBJOO-UHFFFAOYSA-N	0	3	339.395	3.131	20	30		EGEDHN
CCO[C@@H]1CO[C@@]2(C1)CCCN(Cc1c[nH]c3c1cccc3C#N)C2	ZINC001139701022	1377936636	/nfs/dbraw/zinc/93/66/36/1377936636.db2.gz	FLGCFXFONLITFR-FXAWDEMLSA-N	0	3	339.439	3.200	20	30		EGEDHN
Cc1ccc(CN2CCC3(CCN(CC4CC4)C3=O)CC2)cc1C#N	ZINC001139727801	1377942952	/nfs/dbraw/zinc/94/29/52/1377942952.db2.gz	ZCDLRJQXMHBGOX-UHFFFAOYSA-N	0	3	337.467	3.091	20	30		EGEDHN
Cc1ccc(CN2CC[C@@H]3[C@@H]2CCN3Cc2ccc(C#N)cc2F)o1	ZINC001140136960	1378017462	/nfs/dbraw/zinc/01/74/62/1378017462.db2.gz	USTQKEAHTFJEBB-UXHICEINSA-N	0	3	339.414	3.448	20	30		EGEDHN
C=CCO[C@@H]1CO[C@@]2(C1)CCCN(Cc1c[nH]c3cccc(O)c13)C2	ZINC001140233833	1378035331	/nfs/dbraw/zinc/03/53/31/1378035331.db2.gz	VQMDERJRRHLSDO-OXJNMPFZSA-N	0	3	342.439	3.200	20	30		EGEDHN
CCCN(CCN1CCCCC1)C(=O)[C@@H](CC#N)c1ccccc1	ZINC001140514933	1378076879	/nfs/dbraw/zinc/07/68/79/1378076879.db2.gz	SQWRDSYQXSLGDE-IBGZPJMESA-N	0	3	327.472	3.408	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3cc(F)cc(Cl)c3)C2)C1=O	ZINC001140537904	1378081005	/nfs/dbraw/zinc/08/10/05/1378081005.db2.gz	XJFOQCKHSSJCFK-SFHVURJKSA-N	0	3	336.838	3.480	20	30		EGEDHN
C#CCN1C[C@@]2(CC1=O)CCCCN2Cc1cccc(OC(C)C)c1	ZINC001272923149	1378083403	/nfs/dbraw/zinc/08/34/03/1378083403.db2.gz	CONRVNPUDASMSS-NRFANRHFSA-N	0	3	340.467	3.064	20	30		EGEDHN
C=C(C)CN1CC[C@]2(CCCN2Cc2cccc3cnccc32)C1=O	ZINC001273303718	1378095856	/nfs/dbraw/zinc/09/58/56/1378095856.db2.gz	DBUPPWUJSBTHQH-OAQYLSRUSA-N	0	3	335.451	3.378	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@@]23CCN(CC(C)C)C3=O)c1[O-]	ZINC001273360527	1378098634	/nfs/dbraw/zinc/09/86/34/1378098634.db2.gz	QDXPRTURWNNBJX-NRFANRHFSA-N	0	3	342.483	3.344	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@@]23CCN(CC(C)C)C3=O)c1[O-]	ZINC001273360527	1378098636	/nfs/dbraw/zinc/09/86/36/1378098636.db2.gz	QDXPRTURWNNBJX-NRFANRHFSA-N	0	3	342.483	3.344	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(CCN(Cc3ccc(C#N)c(Cl)c3)C2)C1=O	ZINC001274491854	1378128346	/nfs/dbraw/zinc/12/83/46/1378128346.db2.gz	BBELEBGANFNXDZ-LJQANCHMSA-N	0	3	343.858	3.212	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1ccc2c(c1)COC2	ZINC001275725786	1378154566	/nfs/dbraw/zinc/15/45/66/1378154566.db2.gz	OROBBHWJANGMMJ-UHFFFAOYSA-N	0	3	336.863	3.157	20	30		EGEDHN
Cc1cnc2n1CCC21CCN(Cc2c[nH]c3cc(C#N)ccc23)CC1	ZINC001142917030	1378508272	/nfs/dbraw/zinc/50/82/72/1378508272.db2.gz	POVWCMRQRFMHBY-UHFFFAOYSA-N	0	3	345.450	3.482	20	30		EGEDHN
COc1cc(O[C@@H]2CCN(Cc3c[nH]c4cc(C#N)ccc34)C2)ccn1	ZINC001142929331	1378511921	/nfs/dbraw/zinc/51/19/21/1378511921.db2.gz	CVVCRGZHFMTHLZ-QGZVFWFLSA-N	0	3	348.406	3.096	20	30		EGEDHN
CC(C)(C)C(=O)NC[C@H]1CCCCCN1Cc1ccc(C#N)cc1	ZINC001282677982	1378549476	/nfs/dbraw/zinc/54/94/76/1378549476.db2.gz	LOKYUDPPWAQYKS-GOSISDBHSA-N	0	3	327.472	3.465	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@H]1CCN(Cc1cccc(F)c1OC)C2	ZINC001143524363	1378608527	/nfs/dbraw/zinc/60/85/27/1378608527.db2.gz	QBVOGPYLDXRDIG-ICSRJNTNSA-N	0	3	349.446	3.408	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C[C@H](C)NCc2ocnc2C)CCCC1	ZINC001146819441	1378926837	/nfs/dbraw/zinc/92/68/37/1378926837.db2.gz	AHJVMJXRQNJNFD-LSDHHAIUSA-N	0	3	333.476	3.492	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2cc(C)n(C)n2)CCCC1	ZINC001146822652	1378928704	/nfs/dbraw/zinc/92/87/04/1378928704.db2.gz	UBFKZJVFECKRKA-HZPDHXFCSA-N	0	3	346.519	3.238	20	30		EGEDHN
C=CCCC(=O)N1CC2(C1)CCN(Cc1cccc(OC(C)C)c1)C2	ZINC001147159738	1378979286	/nfs/dbraw/zinc/97/92/86/1378979286.db2.gz	XSALWFDFLDLEEF-UHFFFAOYSA-N	0	3	342.483	3.474	20	30		EGEDHN
CCC(=CC(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2)CC	ZINC001147329048	1379005616	/nfs/dbraw/zinc/00/56/16/1379005616.db2.gz	MARKXEGNXWQVEX-UHFFFAOYSA-N	0	3	337.467	3.339	20	30		EGEDHN
C#CCCCCC(=O)N1CC2(C1)CCN(Cc1ccc(F)cc1C)C2	ZINC001147374750	1379011659	/nfs/dbraw/zinc/01/16/59/1379011659.db2.gz	RXYWNSHRHZDFNV-UHFFFAOYSA-N	0	3	342.458	3.362	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CC2(C1)CCN(C/C=C\c1ccccc1)C2	ZINC001147540912	1379039814	/nfs/dbraw/zinc/03/98/14/1379039814.db2.gz	AQBWWWCHPKAIQK-YFHOEESVSA-N	0	3	336.479	3.284	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@@H](C)CCc3ccc(F)cc3)C2)C1	ZINC001147690435	1379061191	/nfs/dbraw/zinc/06/11/91/1379061191.db2.gz	SODQALSYCKLXDI-INIZCTEOSA-N	0	3	330.447	3.115	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)CCCc3ccc(Cl)cc3)C2)C1	ZINC001147841525	1379089348	/nfs/dbraw/zinc/08/93/48/1379089348.db2.gz	MYRHFKWWNGCMRN-UHFFFAOYSA-N	0	3	332.875	3.383	20	30		EGEDHN
CC1(C)CCC[C@H](CC(=O)NCCNCc2ccc(C#N)s2)C1	ZINC001147856106	1379091111	/nfs/dbraw/zinc/09/11/11/1379091111.db2.gz	HCFCENGZKYXULZ-CQSZACIVSA-N	0	3	333.501	3.432	20	30		EGEDHN
CC(C)=C(C)CC(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001148065035	1379111816	/nfs/dbraw/zinc/11/18/16/1379111816.db2.gz	PFOALZWBFHCMGK-UHFFFAOYSA-N	0	3	337.467	3.339	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)N1CC2(C1)CCN(Cc1ccc(C)nc1C)C2	ZINC001148086926	1379114252	/nfs/dbraw/zinc/11/42/52/1379114252.db2.gz	AZTJNXSANSSDPV-DOTOQJQBSA-N	0	3	341.499	3.191	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC2(C1)CCN(Cc1ccc(OC)cc1)C2	ZINC001148147532	1379124595	/nfs/dbraw/zinc/12/45/95/1379124595.db2.gz	VWEQJROKKBDBDX-QGZVFWFLSA-N	0	3	342.483	3.332	20	30		EGEDHN
C=CCCC1(C(=O)N2CC3(C2)CCN(Cc2cccnc2C)C3)CC1	ZINC001148263036	1379140810	/nfs/dbraw/zinc/14/08/10/1379140810.db2.gz	UTTDKYUPQSGMGE-UHFFFAOYSA-N	0	3	339.483	3.171	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001148357326	1379156184	/nfs/dbraw/zinc/15/61/84/1379156184.db2.gz	JEHSWJFPHXGNCX-UHFFFAOYSA-N	0	3	337.467	3.195	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H](c3ccccc3)[C@@H](C)CC)C2)C1	ZINC001148726427	1379254340	/nfs/dbraw/zinc/25/43/40/1379254340.db2.gz	HZXBEYXWYCAWAK-AZUAARDMSA-N	0	3	338.495	3.374	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N1CC2(C1)CCN([C@@H](C)c1ccccc1F)C2	ZINC001148899876	1379294035	/nfs/dbraw/zinc/29/40/35/1379294035.db2.gz	IMISQXQAWVYZKE-HOTGVXAUSA-N	0	3	346.446	3.012	20	30		EGEDHN
C=CCCC(=O)NC[C@@H]1CN(Cc2ccc(C(C)C)cc2)CCCO1	ZINC001149341893	1379366394	/nfs/dbraw/zinc/36/63/94/1379366394.db2.gz	RJZGIEIRCAUZMF-HXUWFJFHSA-N	0	3	344.499	3.483	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H]1CN(Cc2cccc(CC)c2)CCCO1	ZINC001149789908	1379446934	/nfs/dbraw/zinc/44/69/34/1379446934.db2.gz	RSRZZJMWVQVKDL-HXUWFJFHSA-N	0	3	344.499	3.312	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@@H]1CN(Cc2ccc(C)cc2)CCCO1	ZINC001150138525	1379501100	/nfs/dbraw/zinc/50/11/00/1379501100.db2.gz	AKQAXBWTPMLWHF-AZUAARDMSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@H]1CN(Cc2cccc(C)c2)CCCO1	ZINC001150140757	1379501597	/nfs/dbraw/zinc/50/15/97/1379501597.db2.gz	VNANIKSAMGIKFW-ICSRJNTNSA-N	0	3	344.499	3.304	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@H]1CN([C@@H](C)c2ccccc2)CCCO1	ZINC001150165480	1379507864	/nfs/dbraw/zinc/50/78/64/1379507864.db2.gz	LQRKLQWVAGZUMS-AZUAARDMSA-N	0	3	342.483	3.148	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@H]1CN(Cc2ccc(C)cc2)CCCO1	ZINC001150253697	1379523283	/nfs/dbraw/zinc/52/32/83/1379523283.db2.gz	FREBXONIGBONQC-FPOVZHCZSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)[C@@H](CC)CC2CCCC2)C1	ZINC001150402097	1379546845	/nfs/dbraw/zinc/54/68/45/1379546845.db2.gz	ABFICEUQTDOJKJ-OALUTQOASA-N	0	3	336.520	3.376	20	30		EGEDHN
C#CCCN1CCCO[C@H](CNC(=O)[C@@H](CC2CCCC2)C(C)C)C1	ZINC001150404307	1379549427	/nfs/dbraw/zinc/54/94/27/1379549427.db2.gz	XVGPCBVQOJRIEO-UXHICEINSA-N	0	3	348.531	3.069	20	30		EGEDHN
C#CCCN1CCCO[C@@H](CNC(=O)C[C@@H](C)CCCCCC)C1	ZINC001150579540	1379572353	/nfs/dbraw/zinc/57/23/53/1379572353.db2.gz	NJQMYIIFKBWTPG-OALUTQOASA-N	0	3	336.520	3.213	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)[C@@H](F)CC2CCCCC2)C1	ZINC001150595853	1379576484	/nfs/dbraw/zinc/57/64/84/1379576484.db2.gz	DUUDXFLBQRXTFW-ROUUACIJSA-N	0	3	340.483	3.078	20	30		EGEDHN
Cc1[nH]c2ccc(C(=O)NCCNCc3cccc(C#N)c3)cc2c1C	ZINC001150647989	1379589743	/nfs/dbraw/zinc/58/97/43/1379589743.db2.gz	VTIOCSAZZFTVQS-UHFFFAOYSA-N	0	3	346.434	3.176	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2cccc(F)c2)CC1	ZINC001150919027	1379631945	/nfs/dbraw/zinc/63/19/45/1379631945.db2.gz	WZJWFZYZEZXEST-UHFFFAOYSA-N	0	3	334.435	3.003	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)Cc2c(C)cccc2C)CC1	ZINC001151144123	1379667003	/nfs/dbraw/zinc/66/70/03/1379667003.db2.gz	BDPLKTKBVCQJBU-UHFFFAOYSA-N	0	3	344.499	3.019	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@@H]2CCC[C@@H](C)C2)CC1	ZINC001151281265	1379691651	/nfs/dbraw/zinc/69/16/51/1379691651.db2.gz	IFPNCWQLPWWCKU-QZTJIDSGSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@H](C)c2ccccc2F)CC1	ZINC001151374336	1379707027	/nfs/dbraw/zinc/70/70/27/1379707027.db2.gz	GXUMWVCTGMDWFF-MRXNPFEDSA-N	0	3	348.462	3.103	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)/C=C/c1ccco1	ZINC001151598178	1379744294	/nfs/dbraw/zinc/74/42/94/1379744294.db2.gz	YYTAOXWVXRSHGZ-ZNFPLGDCSA-N	0	3	337.423	3.191	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)c1cccc(F)c1	ZINC001151648329	1379756137	/nfs/dbraw/zinc/75/61/37/1379756137.db2.gz	IGZFRJRUJHONRF-OAHLLOKOSA-N	0	3	339.414	3.338	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)c1ccoc1C	ZINC001151792359	1379781406	/nfs/dbraw/zinc/78/14/06/1379781406.db2.gz	LLKMJWHIFRTYBY-CYBMUJFWSA-N	0	3	343.402	3.239	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)C(=O)NCCNCc1ccc(C#N)cc1	ZINC001151922783	1379816020	/nfs/dbraw/zinc/81/60/20/1379816020.db2.gz	FHWDEZYIVPIQLR-NRFANRHFSA-N	0	3	347.462	3.199	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)C(=O)NCCNCc1cncc(C)c1	ZINC001151923298	1379816176	/nfs/dbraw/zinc/81/61/76/1379816176.db2.gz	UYNZIZKUPDQOKH-FQEVSTJZSA-N	0	3	337.467	3.031	20	30		EGEDHN
O=C(CC#Cc1ccccc1)NCCNCc1ccc(Cl)s1	ZINC001151953139	1379824468	/nfs/dbraw/zinc/82/44/68/1379824468.db2.gz	UJDWQODIDGGFTC-UHFFFAOYSA-N	0	3	332.856	3.049	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC[C@@H](C)N(CC)Cc1csc(C)c1	ZINC001152259410	1379894134	/nfs/dbraw/zinc/89/41/34/1379894134.db2.gz	CQJIEQQVCFIBRJ-GDBMZVCRSA-N	0	3	338.517	3.364	20	30		EGEDHN
CCC[C@H](C)C(=O)NC[C@@H](C)N(CC)Cc1ccc(OC)c(C#N)c1	ZINC001152459517	1379936759	/nfs/dbraw/zinc/93/67/59/1379936759.db2.gz	FFTIVLHJXUFOEV-JKSUJKDBSA-N	0	3	345.487	3.330	20	30		EGEDHN
CC(C)c1ccc(C(=O)NCCNCc2ccc(C#N)c(F)c2)s1	ZINC001152776682	1379980571	/nfs/dbraw/zinc/98/05/71/1379980571.db2.gz	ALMCFWQQRDOUIV-UHFFFAOYSA-N	0	3	345.443	3.402	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)c1coc(C)c1	ZINC001152955303	1379999058	/nfs/dbraw/zinc/99/90/58/1379999058.db2.gz	NSGJGKIXVHYHFM-CYBMUJFWSA-N	0	3	343.402	3.239	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H](C)N(CC)Cc1ccccc1N(C)C	ZINC001153642322	1380109254	/nfs/dbraw/zinc/10/92/54/1380109254.db2.gz	XNXMHOZIUAJRBA-QGZVFWFLSA-N	0	3	331.504	3.436	20	30		EGEDHN
C=CCC[C@@H](C(=O)NCCNCc1scnc1C)c1ccccc1	ZINC001153816648	1380135609	/nfs/dbraw/zinc/13/56/09/1380135609.db2.gz	GEZXHCUAFLCFSJ-QGZVFWFLSA-N	0	3	343.496	3.407	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)C1(CCF)CC1	ZINC001154444204	1380279261	/nfs/dbraw/zinc/27/92/61/1380279261.db2.gz	XXJXRGOCHNLLTM-OAHLLOKOSA-N	0	3	331.435	3.025	20	30		EGEDHN
CCCCCC[C@H](CC)C(=O)NC[C@@H](C)N(CC)CC#CCOC	ZINC001154626153	1380320294	/nfs/dbraw/zinc/32/02/94/1380320294.db2.gz	SHWSQOJBTSADBM-MOPGFXCFSA-N	0	3	338.536	3.459	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)C1(C)CC=CC1	ZINC001155005016	1380389128	/nfs/dbraw/zinc/38/91/28/1380389128.db2.gz	DKNVFVKOOCNMEN-OAHLLOKOSA-N	0	3	343.446	3.380	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)CC(C)(F)F	ZINC001155073191	1380403216	/nfs/dbraw/zinc/40/32/16/1380403216.db2.gz	SCELHSXJCYYSTP-GFCCVEGCSA-N	0	3	341.377	3.069	20	30		EGEDHN
C=CCCC(=O)NCCCNCc1cscc1Br	ZINC001155586826	1380470837	/nfs/dbraw/zinc/47/08/37/1380470837.db2.gz	LSKVMPDUMGDQFR-UHFFFAOYSA-N	0	3	331.279	3.073	20	30		EGEDHN
C=CCCC(=O)NCCCNCc1cc(F)ccc1Br	ZINC001155593851	1380471388	/nfs/dbraw/zinc/47/13/88/1380471388.db2.gz	RWLSGRBUCSVIER-UHFFFAOYSA-N	0	3	343.240	3.150	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1[nH]c2ccc(C)cc2c1C	ZINC001156125869	1380528650	/nfs/dbraw/zinc/52/86/50/1380528650.db2.gz	OOXHVBRWAGAXRG-OAHLLOKOSA-N	0	3	325.456	3.248	20	30		EGEDHN
C=CCOCCCC(=O)NCCCNCc1c(F)cccc1Cl	ZINC001156159988	1380533280	/nfs/dbraw/zinc/53/32/80/1380533280.db2.gz	KNHMISZRTQQABU-UHFFFAOYSA-N	0	3	342.842	3.058	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1ccc2nc(C)sc2c1	ZINC001156183236	1380538496	/nfs/dbraw/zinc/53/84/96/1380538496.db2.gz	WJUUTGMICGNCOV-CYBMUJFWSA-N	0	3	329.469	3.068	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1cccc(OCC(C)C)c1	ZINC001156813843	1380643619	/nfs/dbraw/zinc/64/36/19/1380643619.db2.gz	CMZWBUYUWMZQCX-QGZVFWFLSA-N	0	3	330.472	3.185	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@H](CC)c1ccc(OC)cc1	ZINC001157046976	1380760472	/nfs/dbraw/zinc/76/04/72/1380760472.db2.gz	GNOYIJYWDZLXQM-VQIMIIECSA-N	0	3	330.472	3.039	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@H](C)CCCc1ccccc1	ZINC001157178228	1380797440	/nfs/dbraw/zinc/79/74/40/1380797440.db2.gz	YIFPGWNJETXWMZ-RTBURBONSA-N	0	3	328.500	3.495	20	30		EGEDHN
CCN(CC#CCOC)[C@H](C)CNC(=O)C[C@@H]1CCCCC1(C)C	ZINC001157347993	1380849405	/nfs/dbraw/zinc/84/94/05/1380849405.db2.gz	ZUDOFQUJGKSRHF-MSOLQXFVSA-N	0	3	336.520	3.069	20	30		EGEDHN
CCN(CC#CCOC)[C@H](C)CNC(=O)CC1CCC(C)(C)CC1	ZINC001157377095	1380857952	/nfs/dbraw/zinc/85/79/52/1380857952.db2.gz	JMZVPZIFCNLKHB-QGZVFWFLSA-N	0	3	336.520	3.069	20	30		EGEDHN
CC(C)(CC(=O)NCCCNCc1ccc(C#N)cc1F)C1CC1	ZINC001157532842	1380958951	/nfs/dbraw/zinc/95/89/51/1380958951.db2.gz	NKFMEXFOLZOVTR-UHFFFAOYSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=CCCC(=O)N1CCCC[C@@H]1CN(C)CCOc1ccccc1	ZINC001157661900	1380992865	/nfs/dbraw/zinc/99/28/65/1380992865.db2.gz	OAGYWVPHXYIQGL-GOSISDBHSA-N	0	3	330.472	3.345	20	30		EGEDHN
CN(C/C=C\c1ccccc1)C[C@H]1CCCCN1C(=O)C#CC1CC1	ZINC001157920076	1381071557	/nfs/dbraw/zinc/07/15/57/1381071557.db2.gz	QUQUAERSJKQMQM-PWYGHMFVSA-N	0	3	336.479	3.426	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1cc(C)ccc1F	ZINC001158521951	1381279380	/nfs/dbraw/zinc/27/93/80/1381279380.db2.gz	JCULVQKLGGHTJQ-QGZVFWFLSA-N	0	3	348.462	3.263	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1CCc2cccc(OC)c21	ZINC001158565698	1381302816	/nfs/dbraw/zinc/30/28/16/1381302816.db2.gz	YWQUHGJYSYVHKD-QZTJIDSGSA-N	0	3	342.483	3.224	20	30		EGEDHN
C[C@@H]1CCC[C@H]1CC(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001158619080	1381325113	/nfs/dbraw/zinc/32/51/13/1381325113.db2.gz	SIDOAPILYWFHAC-ZBFHGGJFSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1coc(-c2ccccc2)n1	ZINC001158758065	1381386334	/nfs/dbraw/zinc/38/63/34/1381386334.db2.gz	IVYXJLUFZGZNNA-QGZVFWFLSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)[C@H]1CC2CCC1CC2	ZINC001158928448	1381469169	/nfs/dbraw/zinc/46/91/69/1381469169.db2.gz	VDUWXUNDWALDGA-TUNPWDSISA-N	0	3	348.531	3.328	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)C1(c2ccc(F)cc2)CCC1	ZINC001328389100	1388735089	/nfs/dbraw/zinc/73/50/89/1388735089.db2.gz	NJVVVYJAGURUID-AWEZNQCLSA-N	0	3	338.854	3.484	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H]2C[C@H]2c2sccc2C)CC1	ZINC001160131596	1382008781	/nfs/dbraw/zinc/00/87/81/1382008781.db2.gz	QPYJMRVQXMEOAP-QZTJIDSGSA-N	0	3	342.508	3.322	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc(C(C)(C)C)cn2)CC1	ZINC001160190170	1382029129	/nfs/dbraw/zinc/02/91/29/1382029129.db2.gz	URIMENHUFTXFMP-UHFFFAOYSA-N	0	3	339.483	3.154	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CCOc2ccc(C)c(C)c2)CC1	ZINC001160285928	1382062028	/nfs/dbraw/zinc/06/20/28/1382062028.db2.gz	LLAWVXHDELXJNA-UHFFFAOYSA-N	0	3	342.483	3.397	20	30		EGEDHN
CSc1nc(-c2ccccc2)nc(Nc2ccc(CN)nc2)c1C#N	ZINC001160402455	1382095247	/nfs/dbraw/zinc/09/52/47/1382095247.db2.gz	QEJCDFCIZPMITK-UHFFFAOYSA-N	0	3	348.435	3.334	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc(C)c(F)cc2F)CC1	ZINC001160466945	1382112877	/nfs/dbraw/zinc/11/28/77/1382112877.db2.gz	LUUGZVVPLMKVCH-UHFFFAOYSA-N	0	3	332.394	3.049	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NCCC1=CCN(CC#CC)CC1	ZINC001160515198	1382128599	/nfs/dbraw/zinc/12/85/99/1382128599.db2.gz	SQYWGTQKURRIRI-UHFFFAOYSA-N	0	3	338.451	3.027	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc(Cl)cc2F)CC1	ZINC001160628643	1382156752	/nfs/dbraw/zinc/15/67/52/1382156752.db2.gz	RUTRVGGOIMBZQM-UHFFFAOYSA-N	0	3	334.822	3.254	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)C[C@@H]2C=CCCC2)c1	ZINC001160803077	1382201634	/nfs/dbraw/zinc/20/16/34/1382201634.db2.gz	HFTSPNOKTNMGGQ-OAHLLOKOSA-N	0	3	329.419	3.040	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CCc2cccc(N(C)C)c2)CC1	ZINC001160980343	1382260396	/nfs/dbraw/zinc/26/03/96/1382260396.db2.gz	VFHMYEHNIXFKSJ-UHFFFAOYSA-N	0	3	341.499	3.010	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)Cc2ccc(F)cc2Cl)CC1	ZINC001161102123	1382298092	/nfs/dbraw/zinc/29/80/92/1382298092.db2.gz	UDWBASKUKXURAI-UHFFFAOYSA-N	0	3	336.838	3.346	20	30		EGEDHN
N#Cc1cnc(NCC2CCN(Cc3ccccn3)CC2)c(Cl)c1	ZINC001161240860	1382351738	/nfs/dbraw/zinc/35/17/38/1382351738.db2.gz	GNWAAIRKBUFZNT-UHFFFAOYSA-N	0	3	341.846	3.326	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cccc(F)c2Cl)CC1	ZINC001161321394	1382371105	/nfs/dbraw/zinc/37/11/05/1382371105.db2.gz	YNJGVAKYHMBAJN-UHFFFAOYSA-N	0	3	334.822	3.254	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccn(C(CC)CC)n2)CC1	ZINC001161383309	1382392276	/nfs/dbraw/zinc/39/22/76/1382392276.db2.gz	QYHYESGBRDFQFA-UHFFFAOYSA-N	0	3	342.487	3.020	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)[C@H]1CCC[C@H](C(F)(F)F)C1	ZINC001161596720	1382450097	/nfs/dbraw/zinc/45/00/97/1382450097.db2.gz	VBLSKOORRPMNNJ-RYUDHWBXSA-N	0	3	326.790	3.204	20	30		EGEDHN
CC(C)N1CCN(c2ccc(N[C@H](C#N)c3ccccc3)cn2)CC1	ZINC001161717617	1382488251	/nfs/dbraw/zinc/48/82/51/1382488251.db2.gz	FEUZFMQRJTZMLP-LJQANCHMSA-N	0	3	335.455	3.289	20	30		EGEDHN
N#C[C@H](Nc1cccc2cc([C@H]3CNCCO3)cn21)c1ccccc1	ZINC001161721162	1382489011	/nfs/dbraw/zinc/48/90/11/1382489011.db2.gz	LIXKPLDWOQKJME-RBUKOAKNSA-N	0	3	332.407	3.277	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc3nc(C)ccc3o2)CC1	ZINC001161750026	1382494965	/nfs/dbraw/zinc/49/49/65/1382494965.db2.gz	TXZWTNHDGZLTBR-UHFFFAOYSA-N	0	3	325.412	3.074	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C[C@H]2CCC3(CCC3)CO2)CC1	ZINC001161763413	1382498198	/nfs/dbraw/zinc/49/81/98/1382498198.db2.gz	QTBVOKMXXGKJGW-GOSISDBHSA-N	0	3	332.488	3.050	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2csc3c2CCCC3)CC1	ZINC001161829001	1382522901	/nfs/dbraw/zinc/52/29/01/1382522901.db2.gz	DDISTVMSULVOAQ-UHFFFAOYSA-N	0	3	342.508	3.402	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)COc2ccccc2Cl)CC1	ZINC001161853460	1382530859	/nfs/dbraw/zinc/53/08/59/1382530859.db2.gz	PTJCLJJEWCVDRT-UHFFFAOYSA-N	0	3	334.847	3.043	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)CC1	ZINC001161982681	1382586142	/nfs/dbraw/zinc/58/61/42/1382586142.db2.gz	LXBRCGXGRXSOKB-RBUKOAKNSA-N	0	3	328.431	3.254	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C1CCCCCC1	ZINC001162732334	1382850578	/nfs/dbraw/zinc/85/05/78/1382850578.db2.gz	DSARNGNUGBSYOB-UHFFFAOYSA-N	0	3	326.484	3.251	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)CC(C)(C)C1CC1	ZINC001162803328	1382877856	/nfs/dbraw/zinc/87/78/56/1382877856.db2.gz	YGIKFYMHUIYDPH-UHFFFAOYSA-N	0	3	326.484	3.107	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)CC1CC(C)(C)C1	ZINC001162897558	1382908089	/nfs/dbraw/zinc/90/80/89/1382908089.db2.gz	AYVOKOAZCCAWAX-UHFFFAOYSA-N	0	3	326.484	3.107	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CCC(C)(C)C1	ZINC001162925037	1382918433	/nfs/dbraw/zinc/91/84/33/1382918433.db2.gz	ZABSPCNLGYVNDI-IBGZPJMESA-N	0	3	326.484	3.107	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H](C)c1ccco1	ZINC001162928840	1382919144	/nfs/dbraw/zinc/91/91/44/1382919144.db2.gz	PNUGLEXCPZDMID-SFHVURJKSA-N	0	3	338.451	3.067	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C1(CCC)CC1	ZINC001162928061	1382919230	/nfs/dbraw/zinc/91/92/30/1382919230.db2.gz	CLCQFKCKKLRFBB-UHFFFAOYSA-N	0	3	326.484	3.251	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1ccccc1Cl	ZINC001162992799	1382940889	/nfs/dbraw/zinc/94/08/89/1382940889.db2.gz	WXUJHASPCQHOOB-UHFFFAOYSA-N	0	3	340.854	3.248	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1ccc(C(F)F)o1	ZINC001162992808	1382941209	/nfs/dbraw/zinc/94/12/09/1382941209.db2.gz	XDRWSXBWFSMBFF-UHFFFAOYSA-N	0	3	346.377	3.125	20	30		EGEDHN
C[C@@H]1C[C@@H]1C(=O)NCCC1(CNCC#Cc2cccc(Cl)c2)CC1	ZINC001163235301	1383002070	/nfs/dbraw/zinc/00/20/70/1383002070.db2.gz	HNOPXXYQSYUVSN-QAPCUYQASA-N	0	3	344.886	3.224	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)C(CC)CC)CC1	ZINC001163510826	1383069831	/nfs/dbraw/zinc/06/98/31/1383069831.db2.gz	SADUXTDGRBWUDC-UHFFFAOYSA-N	0	3	331.298	3.207	20	30		EGEDHN
C[C@@H]1CC[C@@H](CC(=O)NCCCNCc2ccc(C#N)cc2F)C1	ZINC001164187292	1383164414	/nfs/dbraw/zinc/16/44/14/1383164414.db2.gz	HIBYRZHEOPMAPJ-HUUCEWRRSA-N	0	3	331.435	3.120	20	30		EGEDHN
C[C@@H]1CC[C@H](CC(=O)NCCCNCc2ccc(C#N)cc2F)C1	ZINC001164187287	1383164430	/nfs/dbraw/zinc/16/44/30/1383164430.db2.gz	HIBYRZHEOPMAPJ-CABCVRRESA-N	0	3	331.435	3.120	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCC1(CNCc2conc2CC)CC1	ZINC001164647750	1383213722	/nfs/dbraw/zinc/21/37/22/1383213722.db2.gz	HYSSYDATEQLVLA-UHFFFAOYSA-N	0	3	345.487	3.382	20	30		EGEDHN
N#Cc1cnc(N2C[C@H]3CCN(Cc4ccccc4)[C@@H]3C2)c(Cl)c1	ZINC001165082057	1383224042	/nfs/dbraw/zinc/22/40/42/1383224042.db2.gz	ANTONCCNERKNST-SJLPKXTDSA-N	0	3	338.842	3.317	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)CC2(C(F)(F)F)CC2)CC1	ZINC001165449290	1383297849	/nfs/dbraw/zinc/29/78/49/1383297849.db2.gz	BNKWCUSHDYSJPQ-UHFFFAOYSA-N	0	3	338.801	3.348	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc(F)c(F)c2)CC1	ZINC001165509365	1383305133	/nfs/dbraw/zinc/30/51/33/1383305133.db2.gz	ZHAZLTVUNMXFRA-UHFFFAOYSA-N	0	3	328.790	3.207	20	30		EGEDHN
Cc1cc(C(=O)NCCCNCc2ccc(C#N)cc2F)ccc1F	ZINC001165559783	1383310380	/nfs/dbraw/zinc/31/03/80/1383310380.db2.gz	LAHYRBIOUYECQH-UHFFFAOYSA-N	0	3	343.377	3.055	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C[C@H](C)c2ccncc2)CC1	ZINC001165718724	1383331088	/nfs/dbraw/zinc/33/10/88/1383331088.db2.gz	PFZKUSNWJYNWGT-AWEZNQCLSA-N	0	3	335.879	3.204	20	30		EGEDHN
Cc1cccc(Cl)c1C(=O)NCCCNCc1ccccc1C#N	ZINC001165806052	1383347803	/nfs/dbraw/zinc/34/78/03/1383347803.db2.gz	NTUQQIOANNSIQG-UHFFFAOYSA-N	0	3	341.842	3.430	20	30		EGEDHN
C=C1CCC(C(=O)NCCCNCc2oc(CCC)nc2C)CC1	ZINC001165906638	1383362755	/nfs/dbraw/zinc/36/27/55/1383362755.db2.gz	DZIYDLWIRPYMAR-UHFFFAOYSA-N	0	3	333.476	3.278	20	30		EGEDHN
CC[C@H]1CCC[C@@H]1C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001166036239	1383379683	/nfs/dbraw/zinc/37/96/83/1383379683.db2.gz	MAHASJHDEXHMSI-RDJZCZTQSA-N	0	3	331.435	3.120	20	30		EGEDHN
CC1(C(=O)NCCC2(CNCc3cc(C#N)ccc3F)CC2)CCC1	ZINC001166613861	1383447385	/nfs/dbraw/zinc/44/73/85/1383447385.db2.gz	NAFSMHUURSNBDG-UHFFFAOYSA-N	0	3	343.446	3.264	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)NCCC1(CNCc2cc(C#N)ccc2F)CC1	ZINC001166722957	1383467349	/nfs/dbraw/zinc/46/73/49/1383467349.db2.gz	MJOQAUMBMMOKNK-QGZVFWFLSA-N	0	3	349.425	3.068	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCCC1(CNCc2cccc(OC)n2)CC1	ZINC001166748352	1383471136	/nfs/dbraw/zinc/47/11/36/1383471136.db2.gz	ZSZCOIYREBMAMQ-MRXNPFEDSA-N	0	3	345.487	3.069	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCCC1(CNCc2cccnc2OC)CC1	ZINC001166756100	1383473000	/nfs/dbraw/zinc/47/30/00/1383473000.db2.gz	SHMXMWBNLXLDBJ-MRXNPFEDSA-N	0	3	345.487	3.069	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCC1(CN[C@H](C)c2cnccn2)CC1	ZINC001167018091	1383519047	/nfs/dbraw/zinc/51/90/47/1383519047.db2.gz	ARSFECAPEJGZDU-CRAIPNDOSA-N	0	3	330.476	3.016	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cnc3ccccc3c2)CC1	ZINC001167333560	1383600754	/nfs/dbraw/zinc/60/07/54/1383600754.db2.gz	GHSDRFGYWIYCCX-UHFFFAOYSA-N	0	3	343.858	3.477	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@@H]2CCO[C@H](C(C)C)C2)CC1	ZINC001167652354	1383699079	/nfs/dbraw/zinc/69/90/79/1383699079.db2.gz	YFMCYOYFPKAUBB-CVEARBPZSA-N	0	3	342.911	3.066	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cc(F)cc(F)c2)CC1	ZINC001167996345	1383791684	/nfs/dbraw/zinc/79/16/84/1383791684.db2.gz	AQIYIJKVPOSTRP-UHFFFAOYSA-N	0	3	328.790	3.207	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)CN(CC)c2ccccc2)CC1	ZINC001168297146	1383866600	/nfs/dbraw/zinc/86/66/00/1383866600.db2.gz	HYZJIAPNYMDMSL-UHFFFAOYSA-N	0	3	349.906	3.142	20	30		EGEDHN
C=CCC1(C(=O)NCCC2(CNCc3ocnc3C)CC2)CCCC1	ZINC001168590788	1383943684	/nfs/dbraw/zinc/94/36/84/1383943684.db2.gz	ZLRNMTVFUWSISQ-UHFFFAOYSA-N	0	3	345.487	3.496	20	30		EGEDHN
C[C@@H](N[C@@H](C)COCC1CCCCC1)C(=O)Nc1cccc(C#N)c1	ZINC001308093389	1384090092	/nfs/dbraw/zinc/09/00/92/1384090092.db2.gz	UEQHDFWBBFGMEA-JKSUJKDBSA-N	0	3	343.471	3.460	20	30		EGEDHN
CN(C)/C=N/c1ccc(N[C@H]2CCc3ccccc3[C@H]2O)cc1C#N	ZINC001169627462	1384166662	/nfs/dbraw/zinc/16/66/62/1384166662.db2.gz	IHKDZXIVEPHMLG-OTJXSCFISA-N	0	3	334.423	3.240	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1cc(C(C)C)oc1C	ZINC001169931568	1384200228	/nfs/dbraw/zinc/20/02/28/1384200228.db2.gz	WCZHSFLGJVHTPR-UHFFFAOYSA-N	0	3	343.265	3.330	20	30		EGEDHN
N#CC1(c2ccccc2)CCC(N2CCN(c3ncccn3)CC2)CC1	ZINC001170376567	1384303368	/nfs/dbraw/zinc/30/33/68/1384303368.db2.gz	PNLOAMZRFZUSSP-UHFFFAOYSA-N	0	3	347.466	3.003	20	30		EGEDHN
CC(C)c1scnc1C(=O)NCCCNCc1ccccc1C#N	ZINC001170925983	1384412669	/nfs/dbraw/zinc/41/26/69/1384412669.db2.gz	YUWFHRKZPYEFLN-UHFFFAOYSA-N	0	3	342.468	3.048	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H](C)CCCCNCc1cc(C)n(C)n1	ZINC001170961905	1384418973	/nfs/dbraw/zinc/41/89/73/1384418973.db2.gz	FVQWHVPUGSCWTH-MRXNPFEDSA-N	0	3	346.519	3.262	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H](C)CCCCN[C@@H](C)c1nnc(C)[nH]1	ZINC001170963529	1384419399	/nfs/dbraw/zinc/41/93/99/1384419399.db2.gz	QCDQORHPZMCBAB-GJZGRUSLSA-N	0	3	347.507	3.207	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H](C)CCCCNCc1nccn1CC	ZINC001170974711	1384421476	/nfs/dbraw/zinc/42/14/76/1384421476.db2.gz	UDZWLLUJCLNTCJ-KRWDZBQOSA-N	0	3	346.519	3.436	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H](C)CCCCN[C@H](C)c1nnc(CC)[nH]1	ZINC001171043892	1384435777	/nfs/dbraw/zinc/43/57/77/1384435777.db2.gz	QNYIXLCWVITPQO-LSDHHAIUSA-N	0	3	335.496	3.049	20	30		EGEDHN
CN1CCN(c2ccc(N[C@@H]3CCc4c3cccc4C#N)cc2)CC1	ZINC001171062454	1384439586	/nfs/dbraw/zinc/43/95/86/1384439586.db2.gz	BOYYVORRLKDZLI-OAQYLSRUSA-N	0	3	332.451	3.409	20	30		EGEDHN
N=C(Nc1cc2c(cc1[N+](=O)[O-])CNC2)c1ccc2cc(O)ccc2c1	ZINC001171182902	1384462088	/nfs/dbraw/zinc/46/20/88/1384462088.db2.gz	WFZZHKHQRUQRRX-UHFFFAOYSA-N	0	3	348.362	3.094	20	30		EGEDHN
COC(=O)c1cccc2c1CCN([C@H](C)Cc1cccc(C#N)c1)C2	ZINC001171232562	1384475337	/nfs/dbraw/zinc/47/53/37/1384475337.db2.gz	UCSARZODXFRDMF-OAHLLOKOSA-N	0	3	334.419	3.334	20	30		EGEDHN
Cc1c(C)c(OCC(C)C)ccc1NC(=N)c1ccc(C(N)=O)cc1	ZINC001171260785	1384480901	/nfs/dbraw/zinc/48/09/01/1384480901.db2.gz	NQNGMJDRLCBKDE-UHFFFAOYSA-N	0	3	339.439	3.474	20	30		EGEDHN
CN(C)/C=N/c1ccc(NC2CCN(c3cccnc3)CC2)cc1C#N	ZINC001171472908	1384532428	/nfs/dbraw/zinc/53/24/28/1384532428.db2.gz	GBIZPEVJXWEBKA-HZHRSRAPSA-N	0	3	348.454	3.256	20	30		EGEDHN
O=C1C=C2CN([C@H]3CCc4cc(F)c(F)c(F)c4C3)CCC2S1	ZINC001171534060	1384554632	/nfs/dbraw/zinc/55/46/32/1384554632.db2.gz	DKMSDVYRQYSBLU-SMDDNHRTSA-N	0	3	339.382	3.235	20	30		EGEDHN
C=CCOC(=O)[C@H](CC(C)C)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1	ZINC001171728539	1384615578	/nfs/dbraw/zinc/61/55/78/1384615578.db2.gz	PVYPPPXFJGPLRM-IHPCNDPISA-N	0	3	344.499	3.383	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)N1CCN(CCOc2ccccc2)CC1	ZINC001172308032	1384765216	/nfs/dbraw/zinc/76/52/16/1384765216.db2.gz	SNJSUXYYOIZTFH-LJQANCHMSA-N	0	3	349.478	3.186	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)N1CC[C@@H](C)[C@](O)(C(F)(F)F)C1	ZINC001172316300	1384768253	/nfs/dbraw/zinc/76/82/53/1384768253.db2.gz	RLFAAMMDDLLTNO-WWGRRREGSA-N	0	3	326.362	3.124	20	30		EGEDHN
N#Cc1ccc2c(c1)CN([C@H]1CCN(Cc3ccccc3)C(=O)C1)CC2	ZINC001172668721	1384830472	/nfs/dbraw/zinc/83/04/72/1384830472.db2.gz	GQSYCLQMNXKGCO-NRFANRHFSA-N	0	3	345.446	3.108	20	30		EGEDHN
C=CCOC1CCC(N2CC3(CN(C(=O)OC(C)(C)C)C3)C2)CC1	ZINC001173322155	1384958323	/nfs/dbraw/zinc/95/83/23/1384958323.db2.gz	WRZLQVALLHGXDO-UHFFFAOYSA-N	0	3	336.476	3.053	20	30		EGEDHN
CC(C)N(C)Cc1cnc2n1CCN(C1CCC(C)(C#N)CC1)C2	ZINC001173594864	1384983753	/nfs/dbraw/zinc/98/37/53/1384983753.db2.gz	NDRGCSOHYYXWHO-UHFFFAOYSA-N	0	3	329.492	3.011	20	30		EGEDHN
C[C@@H](CC(=O)NCCCNCc1ccc(C#N)cc1F)C(C)(C)C	ZINC001174572274	1385121186	/nfs/dbraw/zinc/12/11/86/1385121186.db2.gz	VJZVYSVJUGWCPE-AWEZNQCLSA-N	0	3	333.451	3.366	20	30		EGEDHN
C[C@H](CCNC(=O)c1ccc(CF)cc1)NCc1ccccc1C#N	ZINC001317415958	1385126095	/nfs/dbraw/zinc/12/60/95/1385126095.db2.gz	PXHBODYMPMMKPW-OAHLLOKOSA-N	0	3	339.414	3.326	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](C)CCCCN[C@H](C)c1nnc(C)[nH]1	ZINC001174673492	1385132408	/nfs/dbraw/zinc/13/24/08/1385132408.db2.gz	XSVLDFJXUXXXFA-UONOGXRCSA-N	0	3	335.496	3.041	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H](C)CCCCNCc1ncc(Cl)n1C	ZINC001174681479	1385133594	/nfs/dbraw/zinc/13/35/94/1385133594.db2.gz	DGDAAVGBRUWYHC-CYBMUJFWSA-N	0	3	340.899	3.050	20	30		EGEDHN
CC[C@@H](F)C(=O)N[C@@H](C)CCCCNCc1cc(F)ccc1C#N	ZINC001174725401	1385140743	/nfs/dbraw/zinc/14/07/43/1385140743.db2.gz	OPCZFMXSDHBYAB-SUMWQHHRSA-N	0	3	337.414	3.210	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H](C)CCCCNCc1ccn(CC)n1	ZINC001174833546	1385156829	/nfs/dbraw/zinc/15/68/29/1385156829.db2.gz	PNOKMSOJURYQLI-DLBZAZTESA-N	0	3	334.508	3.270	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H](C)CCCCNCc1cc(OC)no1	ZINC001174848796	1385159444	/nfs/dbraw/zinc/15/94/44/1385159444.db2.gz	IESUUWNMJXEKTQ-GJZGRUSLSA-N	0	3	337.464	3.050	20	30		EGEDHN
C=CCCCC(=O)N[C@H](C)CCCCN[C@H](C)c1nnc(CC)[nH]1	ZINC001174979381	1385177952	/nfs/dbraw/zinc/17/79/52/1385177952.db2.gz	YPTXJROQVJKPGX-HUUCEWRRSA-N	0	3	335.496	3.049	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H](C)CCCCNCc2cc(C)no2)CC1	ZINC001175074441	1385190203	/nfs/dbraw/zinc/19/02/03/1385190203.db2.gz	RXWOQRMTBQJOQE-HNNXBMFYSA-N	0	3	333.476	3.494	20	30		EGEDHN
C[C@@H](CCCCNCc1cc(F)ccc1C#N)NC(=O)[C@H]1CC12CC2	ZINC001175442302	1385290826	/nfs/dbraw/zinc/29/08/26/1385290826.db2.gz	KJAGSRTVHAUTPF-KBXCAEBGSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H](C)CCCCNCc1cc2n(n1)CCC2	ZINC001175468616	1385300773	/nfs/dbraw/zinc/30/07/73/1385300773.db2.gz	IFBTVROHGLTQPA-MRXNPFEDSA-N	0	3	346.519	3.196	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](CCNC(=O)c3ccccc3)C2)s1	ZINC001317774589	1385468273	/nfs/dbraw/zinc/46/82/73/1385468273.db2.gz	ZXYJOWRGULEKHM-OAHLLOKOSA-N	0	3	339.464	3.262	20	30		EGEDHN
Cc1ccoc1C(=O)NCC[C@H]1CCN(Cc2ccccc2C#N)C1	ZINC001317776093	1385470406	/nfs/dbraw/zinc/47/04/06/1385470406.db2.gz	XYMPOIMLRGSJIJ-INIZCTEOSA-N	0	3	337.423	3.102	20	30		EGEDHN
C=C[C@@H](C(=O)NCCCNCc1cccc(Cl)n1)c1ccccc1	ZINC001176777449	1385692858	/nfs/dbraw/zinc/69/28/58/1385692858.db2.gz	APTBJOKHCZXGBA-QGZVFWFLSA-N	0	3	343.858	3.301	20	30		EGEDHN
C=C(Br)CNC[C@@]1(NC(=O)C(C)C)CCCC[C@H]1C	ZINC001318739243	1385848190	/nfs/dbraw/zinc/84/81/90/1385848190.db2.gz	BKONEDSBXXFBIW-DOMZBBRYSA-N	0	3	331.298	3.206	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@H](CCC)CC(C)C	ZINC001177188662	1385852377	/nfs/dbraw/zinc/85/23/77/1385852377.db2.gz	VHSYAHYEIMZGOX-CQSZACIVSA-N	0	3	333.314	3.453	20	30		EGEDHN
CC(C)(C)C12CC(C(=O)NCCCNCc3ccccc3C#N)(C1)C2	ZINC001177211973	1385866353	/nfs/dbraw/zinc/86/63/53/1385866353.db2.gz	MSPZXTIDTKQTTO-UHFFFAOYSA-N	0	3	339.483	3.371	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)C[C@H]1CCCC[C@H]1C	ZINC001177310471	1385908060	/nfs/dbraw/zinc/90/80/60/1385908060.db2.gz	XDNLUMGEZWBMQY-TZMCWYRMSA-N	0	3	331.298	3.207	20	30		EGEDHN
C[C@H]1CCCC[C@@H]1CC(=O)NCCCNCc1ccccc1C#N	ZINC001177309866	1385908167	/nfs/dbraw/zinc/90/81/67/1385908167.db2.gz	JRAFEWZVKIQUTD-DLBZAZTESA-N	0	3	327.472	3.371	20	30		EGEDHN
C=CC(C)(C)C(=O)N(CCCNCc1ccn(C)n1)CC1CCCC1	ZINC001177384723	1385938179	/nfs/dbraw/zinc/93/81/79/1385938179.db2.gz	NKUVRQQYXVMMDN-UHFFFAOYSA-N	0	3	346.519	3.131	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cc(C)cc3c[nH]nc32)CCCC1	ZINC001319378960	1386092127	/nfs/dbraw/zinc/09/21/27/1386092127.db2.gz	KYTGLDASZAABPI-UHFFFAOYSA-N	0	3	346.862	3.256	20	30		EGEDHN
C=CCCC(=O)NCCCCCCNCc1nccn1C(F)F	ZINC001178018606	1386109626	/nfs/dbraw/zinc/10/96/26/1386109626.db2.gz	XJMADHGMKIIQGN-UHFFFAOYSA-N	0	3	328.407	3.011	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2cccc(Cl)c2)CCN1C(=O)C1CCC1	ZINC001178026118	1386111242	/nfs/dbraw/zinc/11/12/42/1386111242.db2.gz	LEUBTUSCGFWDOV-KSSFIOAISA-N	0	3	330.859	3.071	20	30		EGEDHN
N#Cc1ccccc1CNCCCCCCNC(=O)C=C1CCC1	ZINC001178171650	1386148917	/nfs/dbraw/zinc/14/89/17/1386148917.db2.gz	WHRBFXGKQNAMDT-UHFFFAOYSA-N	0	3	325.456	3.435	20	30		EGEDHN
C[C@@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)C1CC2(CCC2)C1	ZINC001319514287	1386155075	/nfs/dbraw/zinc/15/50/75/1386155075.db2.gz	KHTVOSMFKUEUBI-AWEZNQCLSA-N	0	3	343.446	3.214	20	30		EGEDHN
N#Cc1ccc(C(=O)NCCCCCCNC/C(Cl)=C/Cl)[nH]1	ZINC001178227885	1386165221	/nfs/dbraw/zinc/16/52/21/1386165221.db2.gz	NRMVUFXDHMLDET-XFXZXTDPSA-N	0	3	343.258	3.085	20	30		EGEDHN
CC/C=C(/C)C(=O)N1CC[C@H](NCc2cc(C#N)ccc2OC)[C@@H]1C	ZINC001178245459	1386170428	/nfs/dbraw/zinc/17/04/28/1386170428.db2.gz	IZMYYUGNNFCJBX-HUEAFNJVSA-N	0	3	341.455	3.002	20	30		EGEDHN
C=C(Cl)CNC[C@@H](NC(=O)c1ccccc1O)C1CCCCC1	ZINC001319645546	1386229697	/nfs/dbraw/zinc/22/96/97/1386229697.db2.gz	AEQOFWNGOIHCDP-MRXNPFEDSA-N	0	3	336.863	3.413	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCCCCCNCc1ccn(CC)n1	ZINC001178580268	1386254953	/nfs/dbraw/zinc/25/49/53/1386254953.db2.gz	SYTYCBZGUHJSIL-UHFFFAOYSA-N	0	3	334.508	3.272	20	30		EGEDHN
CCOc1ccc(CN(C)CCOc2ccccc2C#N)cc1OC	ZINC001319706554	1386261076	/nfs/dbraw/zinc/26/10/76/1386261076.db2.gz	QXOIZHCKZCOWDM-UHFFFAOYSA-N	0	3	340.423	3.476	20	30		EGEDHN
C=C(Br)CNC[C@H]1[C@H](C)CCCN1C(=O)c1ccco1	ZINC001319830867	1386324207	/nfs/dbraw/zinc/32/42/07/1386324207.db2.gz	GWUMSUAIEVUZEM-YPMHNXCESA-N	0	3	341.249	3.019	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@@H]1C)C1CCC1	ZINC001178973223	1386364810	/nfs/dbraw/zinc/36/48/10/1386364810.db2.gz	IAACYJBFUVIZGO-GUXCAODWSA-N	0	3	342.458	3.192	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCCCCCCNCc1nnc(C(C)C)[nH]1	ZINC001179339500	1386455450	/nfs/dbraw/zinc/45/54/50/1386455450.db2.gz	FWOOQBNXRJLTEW-MRXNPFEDSA-N	0	3	349.523	3.297	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@H](NCc2c(C)nsc2C)[C@@H]1C	ZINC001179384495	1386470289	/nfs/dbraw/zinc/47/02/89/1386470289.db2.gz	OGWIPTLLKVGSJJ-LXZKKBNFSA-N	0	3	335.517	3.441	20	30		EGEDHN
C=C1CCC(C(=O)NCCCCCCNCc2nccn2CC)CC1	ZINC001179475786	1386492801	/nfs/dbraw/zinc/49/28/01/1386492801.db2.gz	YLXYFEVFKZSNKB-UHFFFAOYSA-N	0	3	346.519	3.416	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCCCCCNCc1cc(OC)no1	ZINC001179481827	1386494456	/nfs/dbraw/zinc/49/44/56/1386494456.db2.gz	MTSSVAQKIVAEFK-GOSISDBHSA-N	0	3	337.464	3.052	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2Cl)CCN1C(=O)[C@@H]1CC12CC2	ZINC001179598220	1386528120	/nfs/dbraw/zinc/52/81/20/1386528120.db2.gz	BWXBZEKLIQQPCI-ZVZYQTTQSA-N	0	3	342.870	3.071	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)COc1cc(C)ccc1C(C)C	ZINC001180512801	1386820120	/nfs/dbraw/zinc/82/01/20/1386820120.db2.gz	RVHNMSAGBCFNCD-KRWDZBQOSA-N	0	3	330.472	3.264	20	30		EGEDHN
Cc1cc(C)cc(C(=O)N[C@@H](C)CNCc2ccc(C#N)s2)c1	ZINC001322054290	1387040632	/nfs/dbraw/zinc/04/06/32/1387040632.db2.gz	KLYAMHJQIAAOER-AWEZNQCLSA-N	0	3	327.453	3.145	20	30		EGEDHN
O=C(CC1CCN(Cc2ccccc2)CC1)NC1=CC(=O)CCC1	ZINC001182041688	1387098498	/nfs/dbraw/zinc/09/84/98/1387098498.db2.gz	ZXGBHVFCMCDRID-UHFFFAOYSA-N	0	3	326.440	3.042	20	30		EGEDHN
C#CCCCCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2cc(C)no2)C1	ZINC001182208751	1387121028	/nfs/dbraw/zinc/12/10/28/1387121028.db2.gz	ZJPNRCJRXGGZDB-OXQOHEQNSA-N	0	3	345.487	3.141	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](NCc2ccc(Cl)c(Cl)c2)C1	ZINC001182214747	1387121504	/nfs/dbraw/zinc/12/15/04/1387121504.db2.gz	GZFYVADKCJJNQH-CQSZACIVSA-N	0	3	339.266	3.487	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2nccn2CC)C1	ZINC001182305740	1387142966	/nfs/dbraw/zinc/14/29/66/1387142966.db2.gz	MXAMRSMIPQDKAU-MBOZVWFJSA-N	0	3	346.519	3.080	20	30		EGEDHN
CN(C(=O)CCCF)C1CCC(NCc2ccccc2C#N)CC1	ZINC001329243649	1389033673	/nfs/dbraw/zinc/03/36/73/1389033673.db2.gz	ODNMUPPLDRIPPB-UHFFFAOYSA-N	0	3	331.435	3.167	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1ccc(C)c(OC)c1	ZINC001329306008	1389057178	/nfs/dbraw/zinc/05/71/78/1389057178.db2.gz	BYQHYPQYANMPMQ-UHFFFAOYSA-N	0	3	338.879	3.444	20	30		EGEDHN
C[C@H](CNC(=O)c1ccc2[nH]ccc2c1)N(C)Cc1ccc(C#N)cc1	ZINC001329532291	1389145586	/nfs/dbraw/zinc/14/55/86/1389145586.db2.gz	PBGJGQPNVOPCEX-OAHLLOKOSA-N	0	3	346.434	3.290	20	30		EGEDHN
C=CCn1c(-c2ccco2)nnc1N1CCN(C(C)(C)CC)CC1	ZINC001337996477	1389508951	/nfs/dbraw/zinc/50/89/51/1389508951.db2.gz	NVCKJPSGIMNZSS-UHFFFAOYSA-N	0	3	329.448	3.035	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N[C@H](C)c1ccc(-n2nc(C)cc2C)cc1	ZINC001340880400	1390393409	/nfs/dbraw/zinc/39/34/09/1390393409.db2.gz	NGBFMKPVSSWYOJ-VQIMIIECSA-N	0	3	340.471	3.350	20	30		EGEDHN
C=CCC[C@H](NCCN1C(=O)COc2ccccc21)c1ccco1	ZINC001340993017	1390421075	/nfs/dbraw/zinc/42/10/75/1390421075.db2.gz	UUTDSZUUYHUXHN-HNNXBMFYSA-N	0	3	326.396	3.302	20	30		EGEDHN
CCSc1ccccc1CC(=O)C(C#N)C(=O)NC1CCCCC1	ZINC001341940567	1390552200	/nfs/dbraw/zinc/55/22/00/1390552200.db2.gz	MPYFHZLPWBVRMQ-MRXNPFEDSA-N	0	3	344.480	3.499	20	30		EGEDHN
Cn1ccnc1C(C#N)C(=O)CCCOc1ccc2c(c1)CCCC2	ZINC001342267816	1390593263	/nfs/dbraw/zinc/59/32/63/1390593263.db2.gz	GQIZWVNQTCXYQK-SFHVURJKSA-N	0	3	337.423	3.334	20	30		EGEDHN
CC(C)(C)c1ccc(CSCC(=O)C(C#N)C(=O)NC2CC2)cc1	ZINC001342722234	1390645345	/nfs/dbraw/zinc/64/53/45/1390645345.db2.gz	LOYGHQRCAJJGJI-INIZCTEOSA-N	0	3	344.480	3.205	20	30		EGEDHN
Cc1c(C(=O)C(C#N)c2ncc(Cl)n2C)cnn1C1CCCC1	ZINC001344864521	1390820230	/nfs/dbraw/zinc/82/02/30/1390820230.db2.gz	RPHKUFUEKGKFFJ-GFCCVEGCSA-N	0	3	331.807	3.184	20	30		EGEDHN
CCN1C[C@H](C)N(c2nnc([C@@H](C)CCC#N)n2CC2CC2)C[C@H]1C	ZINC001346901828	1390985709	/nfs/dbraw/zinc/98/57/09/1390985709.db2.gz	SFNUWLWGZDERTD-XHSDSOJGSA-N	0	3	344.507	3.014	20	30		EGEDHN
Cc1cc(C(=O)NC2CCN(CCC3(C#N)CCCCC3)CC2)no1	ZINC001348449654	1391221378	/nfs/dbraw/zinc/22/13/78/1391221378.db2.gz	LQNHIWDANVLVML-UHFFFAOYSA-N	0	3	344.459	3.041	20	30		EGEDHN
Cc1ccc(C#N)cc1C(=O)N(CCN(C)C)Cc1cccc(F)c1	ZINC001352871761	1391867339	/nfs/dbraw/zinc/86/73/39/1391867339.db2.gz	CQMXZXAZDUQUHA-UHFFFAOYSA-N	0	3	339.414	3.210	20	30		EGEDHN
Cc1c(C(=O)NC[C@@H](C)NCc2ccc(C#N)s2)ccn1C(C)C	ZINC001480522569	1392777919	/nfs/dbraw/zinc/77/79/19/1392777919.db2.gz	QVEDUZWVDAAQSO-CYBMUJFWSA-N	0	3	344.484	3.219	20	30		EGEDHN
C=CC[C@@H](C(=O)N[C@H]1CCN(CCOC2CCC2)C1)c1ccccc1	ZINC001490577107	1394271675	/nfs/dbraw/zinc/27/16/75/1394271675.db2.gz	RXFSRWIFDYHAKW-AZUAARDMSA-N	0	3	342.483	3.106	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCCN(C(=O)CCCF)C1	ZINC001490768977	1394331882	/nfs/dbraw/zinc/33/18/82/1394331882.db2.gz	XRSWUMMLVIRYCO-CQSZACIVSA-N	0	3	337.464	3.040	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCC1(N[C@@H](C)c2ccc(F)cc2F)CCCC1	ZINC001482213658	1394807081	/nfs/dbraw/zinc/80/70/81/1394807081.db2.gz	UTTOUGAKRJCUBQ-STQMWFEESA-N	0	3	335.398	3.204	20	30		EGEDHN
C[C@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)CCC1CCC1	ZINC001482270319	1394857811	/nfs/dbraw/zinc/85/78/11/1394857811.db2.gz	YOGUWRAIJVQKFE-CQSZACIVSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1ccc(-c2cn[nH]c2)cc1)C(C)C	ZINC001482558566	1395088901	/nfs/dbraw/zinc/08/89/01/1395088901.db2.gz	FCNLIVBMFGYEKH-QGZVFWFLSA-N	0	3	346.862	3.173	20	30		EGEDHN
CCCC[C@H](CNCc1ccc(C#N)s1)NC(=O)c1ccccn1	ZINC001485460130	1395934363	/nfs/dbraw/zinc/93/43/63/1395934363.db2.gz	ITWDUCWCWVFHIA-CQSZACIVSA-N	0	3	342.468	3.093	20	30		EGEDHN
CC[C@H](CNC(=O)c1cscc1C)NCc1ccc(C#N)s1	ZINC001494959288	1396511353	/nfs/dbraw/zinc/51/13/53/1396511353.db2.gz	CMFWGVIBPZYKTO-GFCCVEGCSA-N	0	3	333.482	3.288	20	30		EGEDHN
CC1(C)CC(C(=O)NC[C@@H](NCc2ccc(C#N)cc2F)C2CC2)C1	ZINC001690150096	1404349877	/nfs/dbraw/zinc/34/98/77/1404349877.db2.gz	XROADGSFBVJYTC-GOSISDBHSA-N	0	3	343.446	3.118	20	30		EGEDHN
CC1(C(=O)NC[C@@H]2CCCN(Cc3ccc(C#N)cc3)C2)CCC1	ZINC001690387705	1404522592	/nfs/dbraw/zinc/52/25/92/1404522592.db2.gz	VCFLQXCSNZNBRY-SFHVURJKSA-N	0	3	325.456	3.077	20	30		EGEDHN
Cc1oc(C)c(C(=O)NC[C@@H](C)NCc2ccc(F)c(C#N)c2)c1C	ZINC001690600576	1404647064	/nfs/dbraw/zinc/64/70/64/1404647064.db2.gz	XVRFKTMLRWIKKW-LLVKDONJSA-N	0	3	343.402	3.124	20	30		EGEDHN
C[C@@H](CCNC(=O)c1c[nH]c2ccccc21)NCc1ccccc1C#N	ZINC001690851724	1404776958	/nfs/dbraw/zinc/77/69/58/1404776958.db2.gz	GVYASOAPEFFOFS-HNNXBMFYSA-N	0	3	346.434	3.338	20	30		EGEDHN
CC[C@@H](C)CC(=O)NC[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001691093227	1405029271	/nfs/dbraw/zinc/02/92/71/1405029271.db2.gz	KTVMTCOSPTVEJV-UNEWFSDZSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)[C@H](CC)CCC)C1	ZINC001691120431	1405062458	/nfs/dbraw/zinc/06/24/58/1405062458.db2.gz	UMXAJZNLVQITCJ-MCIONIFRSA-N	0	3	331.298	3.206	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)CCOc2cccc(C)c2)C1	ZINC001691537472	1405329317	/nfs/dbraw/zinc/32/93/17/1405329317.db2.gz	CWURYFOLONCLQU-WKILWMFISA-N	0	3	336.863	3.001	20	30		EGEDHN
C[C@H](C(=O)NC[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1)C1CCC1	ZINC001691795117	1405506369	/nfs/dbraw/zinc/50/63/69/1405506369.db2.gz	YOPXBLPDDXGAAV-YEWWUXTCSA-N	0	3	343.446	3.118	20	30		EGEDHN
Cc1cccc(Cl)c1CNC1(CNC(=O)[C@H](C)C#N)CCCC1	ZINC001732388359	1428558751	/nfs/dbraw/zinc/55/87/51/1428558751.db2.gz	IUGNSCQHKMFQRG-CQSZACIVSA-N	0	3	333.863	3.327	20	30		EGEDHN
C=C(Cl)CN(CC1CC1)C1CCN(C(=O)CCOC(C)C)CC1	ZINC001699684043	1413079723	/nfs/dbraw/zinc/07/97/23/1413079723.db2.gz	HAARXQZQBNAGTA-UHFFFAOYSA-N	0	3	342.911	3.257	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)NC[C@]1(C)CCCN(Cc2cccc(C#N)c2)C1	ZINC001699869615	1413315227	/nfs/dbraw/zinc/31/52/27/1413315227.db2.gz	GEOJXEVLJPFMSH-NQIIRXRSSA-N	0	3	339.483	3.323	20	30		EGEDHN
CC(C)SCC(=O)N[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC001700172071	1413578808	/nfs/dbraw/zinc/57/88/08/1413578808.db2.gz	CGRPPNCHKCDMEU-GOSISDBHSA-N	0	3	345.512	3.171	20	30		EGEDHN
CC(F)(F)CC(=O)N[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC001700181728	1413595573	/nfs/dbraw/zinc/59/55/73/1413595573.db2.gz	ZAIPEWALNBPWCF-MRXNPFEDSA-N	0	3	335.398	3.074	20	30		EGEDHN
C[C@H](CNC(=O)c1cc(C#N)c[nH]1)N(C)[C@@H](C)c1cccc(Cl)c1	ZINC001700454448	1414041366	/nfs/dbraw/zinc/04/13/66/1414041366.db2.gz	HBHCTZAEYRDZRX-OLZOCXBDSA-N	0	3	344.846	3.351	20	30		EGEDHN
CC(C)(C)[C@@H](CNCc1ccc(C#N)s1)NC(=O)c1ccns1	ZINC001700987392	1414630140	/nfs/dbraw/zinc/63/01/40/1414630140.db2.gz	IWGFSUAZIZAMSV-CQSZACIVSA-N	0	3	348.497	3.011	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)cc1F)[C@H]1CCCCN1C(=O)CCCF	ZINC001707433728	1417337517	/nfs/dbraw/zinc/33/75/17/1417337517.db2.gz	CNMKTSXBRCMNEY-KBXCAEBGSA-N	0	3	349.425	3.306	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1cccc2[nH]ncc21	ZINC001707443985	1417347655	/nfs/dbraw/zinc/34/76/55/1417347655.db2.gz	QJSAVGIKSDXTOK-SUMWQHHRSA-N	0	3	346.862	3.288	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)CCc1cncs1	ZINC001707446285	1417350515	/nfs/dbraw/zinc/35/05/15/1417350515.db2.gz	VGEDYYPQLZSBEU-DZGCQCFKSA-N	0	3	341.908	3.187	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1scnc1C	ZINC001712995299	1417546354	/nfs/dbraw/zinc/54/63/54/1417546354.db2.gz	XAJKOVHAACYAFH-WCQYABFASA-N	0	3	327.881	3.177	20	30		EGEDHN
C[C@H](CN(C)Cc1cccc(C#N)c1)NC(=O)c1cccc2cc[nH]c21	ZINC001733052857	1429193447	/nfs/dbraw/zinc/19/34/47/1429193447.db2.gz	HKDMQORARWTOKM-OAHLLOKOSA-N	0	3	346.434	3.290	20	30		EGEDHN
CCCC1(C(=O)N2CC[C@@H](CN(C)Cc3ccc(C#N)s3)C2)CC1	ZINC001713755808	1418559304	/nfs/dbraw/zinc/55/93/04/1418559304.db2.gz	IDMVONXQZKNDRF-HNNXBMFYSA-N	0	3	345.512	3.480	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CCCN(CCCOCc2ccccc2)C1	ZINC001713790742	1418608582	/nfs/dbraw/zinc/60/85/82/1418608582.db2.gz	FCDIAAHENQZZME-LJQANCHMSA-N	0	3	344.499	3.386	20	30		EGEDHN
C[C@H](CNC(=O)Cc1ccccc1Cl)NCc1ccc(C#N)s1	ZINC001714300763	1419080189	/nfs/dbraw/zinc/08/01/89/1419080189.db2.gz	VUUUBUMPUSIQJR-GFCCVEGCSA-N	0	3	347.871	3.110	20	30		EGEDHN
C[C@H](CNCc1cc(Cl)sc1Cl)CNC(=O)[C@H](C)C#N	ZINC001714377264	1419132403	/nfs/dbraw/zinc/13/24/03/1419132403.db2.gz	KSAUAYAHOWBYDH-RKDXNWHRSA-N	0	3	334.272	3.056	20	30		EGEDHN
C[C@H](CC(=O)NC[C@@H](C)CNCc1ccccc1C#N)c1ccco1	ZINC001714443587	1419175422	/nfs/dbraw/zinc/17/54/22/1419175422.db2.gz	DHMFJYBXADNBAJ-JKSUJKDBSA-N	0	3	339.439	3.187	20	30		EGEDHN
CCCc1occc1C(=O)NCC[C@@H](C)NCc1ccccc1C#N	ZINC001714495536	1419219553	/nfs/dbraw/zinc/21/95/53/1419219553.db2.gz	OOCPBYXWWVQVPC-OAHLLOKOSA-N	0	3	339.439	3.402	20	30		EGEDHN
CC[C@H](CNC(=O)c1ccccc1F)NCc1ccc(C#N)s1	ZINC001715050292	1419792103	/nfs/dbraw/zinc/79/21/03/1419792103.db2.gz	LFHBAPKAHFBUIN-GFCCVEGCSA-N	0	3	331.416	3.057	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)C2=COCCC2)CCCC[C@H]1C	ZINC001715131843	1419881533	/nfs/dbraw/zinc/88/15/33/1419881533.db2.gz	SVPJAULOUXZNCB-CXAGYDPISA-N	0	3	326.868	3.088	20	30		EGEDHN
CC(F)(F)C(=O)NCc1ccc(CNCc2cccc(C#N)c2)cc1	ZINC001715193278	1419925550	/nfs/dbraw/zinc/92/55/50/1419925550.db2.gz	LOHXFBBVOORMQD-UHFFFAOYSA-N	0	3	343.377	3.119	20	30		EGEDHN
COc1ccc(C#N)cc1CNC[C@H](CC(C)C)NC(=O)C(C)(C)C	ZINC001715389411	1420086299	/nfs/dbraw/zinc/08/62/99/1420086299.db2.gz	DSAJECYQLKJTBN-KRWDZBQOSA-N	0	3	345.487	3.233	20	30		EGEDHN
C=C(Br)CN[C@H](CNC(=O)c1ccsc1)C(C)C	ZINC001715517743	1420203797	/nfs/dbraw/zinc/20/37/97/1420203797.db2.gz	SBXCGYNXHBJGOI-GFCCVEGCSA-N	0	3	331.279	3.001	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1ncccc1C(F)(F)F)C(C)C	ZINC001715693136	1420297768	/nfs/dbraw/zinc/29/77/68/1420297768.db2.gz	VMAKPDLVKFWRKE-LBPRGKRZSA-N	0	3	349.784	3.197	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)Cn1ccc2ccccc21)C(C)C	ZINC001715727893	1420313537	/nfs/dbraw/zinc/31/35/37/1420313537.db2.gz	IWXRQHUWTKVIFM-INIZCTEOSA-N	0	3	333.863	3.124	20	30		EGEDHN
CCC[C@H](C(=O)NCC1(NCc2ccc(C#N)cc2)CC1)C(C)C	ZINC001733258811	1429411685	/nfs/dbraw/zinc/41/16/85/1429411685.db2.gz	KNNGBGJVVAIXPI-SFHVURJKSA-N	0	3	327.472	3.369	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](C)CN(C)Cc2cccc(C#N)c2)c(C)o1	ZINC001716011157	1420464313	/nfs/dbraw/zinc/46/43/13/1420464313.db2.gz	AGTVHKGCVYLIJC-CYBMUJFWSA-N	0	3	325.412	3.018	20	30		EGEDHN
Cc1ccc(C(=O)NCC2(NCc3ccc(C#N)cc3)CC2)cc1C	ZINC001716700264	1420852952	/nfs/dbraw/zinc/85/29/52/1420852952.db2.gz	WCQHBJYRHXQWNE-UHFFFAOYSA-N	0	3	333.435	3.227	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@@H]1CNCc1cn(C(C)C)nc1C	ZINC001716778301	1420918014	/nfs/dbraw/zinc/91/80/14/1420918014.db2.gz	NBDFIVOZUWLBGD-GOSISDBHSA-N	0	3	346.519	3.455	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1cn(C(C)C)nc1C	ZINC001717459306	1421388870	/nfs/dbraw/zinc/38/88/70/1421388870.db2.gz	XXRKSEOSRYPDCA-UHFFFAOYSA-N	0	3	340.899	3.213	20	30		EGEDHN
CC(F)(F)CC(=O)NC[C@H]1CCCCCN1Cc1cccc(C#N)c1	ZINC001717537800	1421476117	/nfs/dbraw/zinc/47/61/17/1421476117.db2.gz	BAHBUURROKXJQN-QGZVFWFLSA-N	0	3	349.425	3.464	20	30		EGEDHN
Cc1ccc(C)c(C(=O)N(C)C[C@@H](C)NCc2ccc(C#N)s2)c1	ZINC001717752956	1421615862	/nfs/dbraw/zinc/61/58/62/1421615862.db2.gz	YYBXNHUOOKGTHR-OAHLLOKOSA-N	0	3	341.480	3.487	20	30		EGEDHN
CC(C)(C)[C@H](CNCc1ccc(C#N)s1)NC(=O)C1CCCC1	ZINC001717952490	1421723712	/nfs/dbraw/zinc/72/37/12/1421723712.db2.gz	JGSZDIOLVGTSFT-INIZCTEOSA-N	0	3	333.501	3.430	20	30		EGEDHN
CC1(C(=O)N2CC[C@@](C)(CNCc3ccccc3C#N)C2)CCCC1	ZINC001733434738	1429641719	/nfs/dbraw/zinc/64/17/19/1429641719.db2.gz	ZWDKREOXFVKBGL-FQEVSTJZSA-N	0	3	339.483	3.467	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCC1(NCc2ccc(-c3ccccc3)cc2)CC1	ZINC001723502062	1424443651	/nfs/dbraw/zinc/44/36/51/1424443651.db2.gz	XYSLAACBHMCREP-INIZCTEOSA-N	0	3	333.435	3.252	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)Cc1ccc(F)c(F)c1	ZINC001725145250	1425626774	/nfs/dbraw/zinc/62/67/74/1425626774.db2.gz	JUDCSCRIOSUOGR-UHFFFAOYSA-N	0	3	344.833	3.334	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1cccc2[nH]ncc21	ZINC001725147201	1425630257	/nfs/dbraw/zinc/63/02/57/1425630257.db2.gz	HMELWDIIUGUKRE-UHFFFAOYSA-N	0	3	334.851	3.003	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@@H](C)N(C)Cc2ccc(C#N)cc2)c(F)c1	ZINC001725188486	1425727164	/nfs/dbraw/zinc/72/71/64/1425727164.db2.gz	ZUDGSCTTZSKGMK-OAHLLOKOSA-N	0	3	339.414	3.256	20	30		EGEDHN
C[C@@H](CNC(=O)C1(F)CCCCC1)N(C)Cc1cccc(C#N)c1	ZINC001725189952	1425731073	/nfs/dbraw/zinc/73/10/73/1425731073.db2.gz	WONZOFRCJWDKSH-HNNXBMFYSA-N	0	3	331.435	3.167	20	30		EGEDHN
C=C(Br)CNC[C@H](NC(=O)c1ccc(C)o1)C(C)(C)C	ZINC001725738906	1426413902	/nfs/dbraw/zinc/41/39/02/1426413902.db2.gz	WEEUMNUCQMVDAQ-ZDUSSCGKSA-N	0	3	343.265	3.231	20	30		EGEDHN
CC(C)CCC(=O)N1CCC[C@H](CNCc2ccccc2C#N)C1	ZINC001731507464	1427495379	/nfs/dbraw/zinc/49/53/79/1427495379.db2.gz	BQXWWGJVMNYFAO-QGZVFWFLSA-N	0	3	327.472	3.323	20	30		EGEDHN
CCN(CCNC(=O)c1c(C)coc1C)Cc1ccc(C#N)cc1	ZINC001731800387	1427962212	/nfs/dbraw/zinc/96/22/12/1427962212.db2.gz	AKGYEBASNYXUJE-UHFFFAOYSA-N	0	3	325.412	3.020	20	30		EGEDHN
CCCN(CCNC(=O)[C@@H](C)c1ccco1)Cc1ccc(C#N)cc1	ZINC001731868783	1428120976	/nfs/dbraw/zinc/12/09/76/1428120976.db2.gz	GFHIAHCQIOHIRO-INIZCTEOSA-N	0	3	339.439	3.283	20	30		EGEDHN
CCCCC(=O)N[C@@H]1CCN(Cc2ccc(OCC#N)cc2)[C@@H](C)C1	ZINC001733897211	1437714763	/nfs/dbraw/zinc/71/47/63/1437714763.db2.gz	ZUQURBPRDDSWTQ-FUHWJXTLSA-N	0	3	343.471	3.248	20	30		EGEDHN
C[C@@H](CNC(=O)C1=CCCCCC1)N(C)Cc1ccc(C#N)cc1	ZINC001734034151	1437821981	/nfs/dbraw/zinc/82/19/81/1437821981.db2.gz	CJEIMVPJMADFTE-INIZCTEOSA-N	0	3	325.456	3.385	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccnc(C2CC2)c1)N(C)Cc1cccc(C#N)c1	ZINC001734046270	1437835244	/nfs/dbraw/zinc/83/52/44/1437835244.db2.gz	YDMYGEYWHNMERN-HNNXBMFYSA-N	0	3	348.450	3.081	20	30		EGEDHN
C=C(Br)CNC[C@@H](C1CC1)N(C)C(=O)C1CC(C)(C)C1	ZINC001734298063	1438029636	/nfs/dbraw/zinc/02/96/36/1438029636.db2.gz	JAVLGFCZPNKOOS-AWEZNQCLSA-N	0	3	343.309	3.158	20	30		EGEDHN
C[C@@H](C(=O)NCCCN(C)Cc1ccc(C#N)c(F)c1)C(C)(C)C	ZINC001752012672	1440132676	/nfs/dbraw/zinc/13/26/76/1440132676.db2.gz	HDGONDYOSPJHJW-AWEZNQCLSA-N	0	3	333.451	3.318	20	30		EGEDHN
CN(CCCNC(=O)[C@H]1CCC(C)(C)C1)Cc1ccc(C#N)c(F)c1	ZINC001752057732	1440136891	/nfs/dbraw/zinc/13/68/91/1440136891.db2.gz	ADUZOUGJPLNEHJ-INIZCTEOSA-N	0	3	345.462	3.462	20	30		EGEDHN
CC#CCCCC(=O)N1CCCC[C@@H]1[C@@H](C)NCc1ccns1	ZINC001752143465	1440145279	/nfs/dbraw/zinc/14/52/79/1440145279.db2.gz	MSCLFLGAUOYXMK-NVXWUHKLSA-N	0	3	333.501	3.196	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCCC[C@@H]2[C@H](C)NCC(=C)Cl)cc1	ZINC001752145256	1440145685	/nfs/dbraw/zinc/14/56/85/1440145685.db2.gz	UFHHFLXULZJSJW-MAUKXSAKSA-N	0	3	330.859	3.393	20	30		EGEDHN
CCCCCCCN1CC[C@H](NC(=O)c2ncoc2C(F)(F)F)C1	ZINC001752391975	1440173353	/nfs/dbraw/zinc/17/33/53/1440173353.db2.gz	KBOVUMWEWRLHAI-LBPRGKRZSA-N	0	3	347.381	3.468	20	30		EGEDHN
C=CCN1CCC(N(CCC)C(=O)c2c3ccccc3nn2C)CC1	ZINC001752441208	1440181375	/nfs/dbraw/zinc/18/13/75/1440181375.db2.gz	BGAAEQJNWDHDFK-UHFFFAOYSA-N	0	3	340.471	3.076	20	30		EGEDHN
C=CCN1CCC(N(CCC)C(=O)C[C@H]2CCO[C@@H](CC)C2)CC1	ZINC001752442259	1440181597	/nfs/dbraw/zinc/18/15/97/1440181597.db2.gz	RXNPQYJTSKVETR-HKUYNNGSSA-N	0	3	336.520	3.471	20	30		EGEDHN
CC1(C)CC[C@H](C(=O)NC[C@H](NCC#Cc2ccccc2)C2CC2)C1	ZINC001752483314	1440186099	/nfs/dbraw/zinc/18/60/99/1440186099.db2.gz	YBNNDIZZVBATFJ-PMACEKPBSA-N	0	3	338.495	3.349	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2n[nH]cc2c1	ZINC001752543398	1440194822	/nfs/dbraw/zinc/19/48/22/1440194822.db2.gz	YOLRTEYTTNXAMY-OLMNPRSZSA-N	0	3	338.455	3.206	20	30		EGEDHN
C=CCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc2c(c1)CCC2	ZINC001752545369	1440195130	/nfs/dbraw/zinc/19/51/30/1440195130.db2.gz	QKVWVZFJDQPCQP-OYRHEFFESA-N	0	3	338.495	3.359	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)Cc1ccco1	ZINC001752567497	1440195584	/nfs/dbraw/zinc/19/55/84/1440195584.db2.gz	RZSDBGXQFUPVFT-TVFCKZIOSA-N	0	3	330.472	3.488	20	30		EGEDHN
CC[C@H](C)CCC(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001752595565	1440195855	/nfs/dbraw/zinc/19/58/55/1440195855.db2.gz	DTHLSJZEKJPQGM-YOEHRIQHSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1C[C@@H](NCc2cc(F)ccc2OC)C1	ZINC001752770113	1440205849	/nfs/dbraw/zinc/20/58/49/1440205849.db2.gz	ZRMMDKJOEAHRFL-IYBDPMFKSA-N	0	3	334.435	3.173	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@H]1CCCN(CCOc2ccccc2F)C1	ZINC001752784432	1440210350	/nfs/dbraw/zinc/21/03/50/1440210350.db2.gz	BVQJJVLVRGFVRQ-MRXNPFEDSA-N	0	3	348.462	3.245	20	30		EGEDHN
C=C[C@@](C)(O)CC(=O)NC[C@@H]1CCCCN1Cc1cccc(CC)c1	ZINC001752819424	1440219825	/nfs/dbraw/zinc/21/98/25/1440219825.db2.gz	VLNOEZBXAXNPAW-PZJWPPBQSA-N	0	3	344.499	3.047	20	30		EGEDHN
C=CCN1CCCC[C@@H]1CNC(=O)CCn1ccc2ccccc21	ZINC001752824689	1440222951	/nfs/dbraw/zinc/22/29/51/1440222951.db2.gz	CDPIPNOGQZIPMQ-GOSISDBHSA-N	0	3	325.456	3.188	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)CCc1cccc(F)c1F	ZINC001752826073	1440223716	/nfs/dbraw/zinc/22/37/16/1440223716.db2.gz	LSZYAGFOIHUTEH-INIZCTEOSA-N	0	3	336.426	3.444	20	30		EGEDHN
C=CCOCCN1CCCC[C@@H]1CNC(=O)c1cc2ccsc2[nH]1	ZINC001752828121	1440224380	/nfs/dbraw/zinc/22/43/80/1440224380.db2.gz	QEEKXUYQLZKSMF-OAHLLOKOSA-N	0	3	347.484	3.016	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)CCC2CCC2)CC1	ZINC001752849266	1440233177	/nfs/dbraw/zinc/23/31/77/1440233177.db2.gz	DKYYYYGXJMEKKA-UHFFFAOYSA-N	0	3	343.309	3.492	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)[C@@H](C)C(C)C)CC1	ZINC001752852889	1440233956	/nfs/dbraw/zinc/23/39/56/1440233956.db2.gz	VJMWSIQTHMRATA-HSBZDZAISA-N	0	3	331.298	3.204	20	30		EGEDHN
C=CCCCC(=O)NC1CCC(NCc2ccccc2C#N)CC1	ZINC001752854048	1440234404	/nfs/dbraw/zinc/23/44/04/1440234404.db2.gz	QFCURJAWUYQXPP-UHFFFAOYSA-N	0	3	325.456	3.432	20	30		EGEDHN
Cc1scc(C(=O)NC[C@H](C)NCc2ccc(C#N)c(F)c2)c1C	ZINC001752874450	1440237747	/nfs/dbraw/zinc/23/77/47/1440237747.db2.gz	HNUBVGRLBZKGQA-NSHDSACASA-N	0	3	345.443	3.284	20	30		EGEDHN
C[C@@H](CNC(=O)[C@@H]1CC[C@@H]2C[C@@H]2CC1)NCc1ccc(C#N)s1	ZINC001752889361	1440240532	/nfs/dbraw/zinc/24/05/32/1440240532.db2.gz	PMCAVQLAXCUCLZ-ZQDZILKHSA-N	0	3	331.485	3.040	20	30		EGEDHN
C=C[C@H](C(=O)NC[C@@H](C)NCc1c(C)nsc1C)c1ccccc1	ZINC001752920956	1440248630	/nfs/dbraw/zinc/24/86/30/1440248630.db2.gz	JFXKNWOTNPSEBA-DYVFJYSZSA-N	0	3	343.496	3.324	20	30		EGEDHN
C=CCC1(C(=O)NC[C@H](C)NCc2ccc(F)c(C#N)c2)CCCC1	ZINC001752923971	1440249473	/nfs/dbraw/zinc/24/94/73/1440249473.db2.gz	KMIGHJZHCMDYRN-HNNXBMFYSA-N	0	3	343.446	3.428	20	30		EGEDHN
CC#CCN(C)[C@@H]1CCCN(C(=O)C2(c3cccc(C)c3)CCC2)C1	ZINC001752995171	1440261538	/nfs/dbraw/zinc/26/15/38/1440261538.db2.gz	PEXNXMILSACAPL-HXUWFJFHSA-N	0	3	338.495	3.363	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)NCCC[C@@H]1CCCN1Cc1ccccc1C#N	ZINC001753026554	1440271529	/nfs/dbraw/zinc/27/15/29/1440271529.db2.gz	QRNJGINIUZVXKD-RTBURBONSA-N	0	3	339.483	3.465	20	30		EGEDHN
CN(CCNC(=O)C#CC(C)(C)C)CCc1ccc2ccccc2c1	ZINC001753049173	1440278708	/nfs/dbraw/zinc/27/87/08/1440278708.db2.gz	UHARWRXWBZRQDD-UHFFFAOYSA-N	0	3	336.479	3.480	20	30		EGEDHN
C=C1CCC(C(=O)NCCN(C)Cc2ccc(COC)cc2)CC1	ZINC001753062913	1440284418	/nfs/dbraw/zinc/28/44/18/1440284418.db2.gz	BRAXLFSZRZGFDX-UHFFFAOYSA-N	0	3	330.472	3.127	20	30		EGEDHN
C=CCC1(C(=O)NCCN(C)[C@@H](C)c2ccc(F)cc2)CCOCC1	ZINC001753072493	1440289335	/nfs/dbraw/zinc/28/93/35/1440289335.db2.gz	USUCIUZVNZBLHW-INIZCTEOSA-N	0	3	348.462	3.308	20	30		EGEDHN
CC[C@@H](CC(F)F)C(=O)NC[C@@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC001753126992	1440315242	/nfs/dbraw/zinc/31/52/42/1440315242.db2.gz	GCJGFGWZDSNYLE-IRXDYDNUSA-N	0	3	349.425	3.178	20	30		EGEDHN
CN(CCNCc1ccc(C#N)s1)C(=O)c1cccc(C(F)F)c1	ZINC001753254797	1440343591	/nfs/dbraw/zinc/34/35/91/1440343591.db2.gz	NUXCWFIOLZBYTH-UHFFFAOYSA-N	0	3	349.406	3.419	20	30		EGEDHN
C#CCCN[C@@H](CNC(=O)C1(c2ccccc2C)CC1)c1ccccc1	ZINC001753302871	1440354667	/nfs/dbraw/zinc/35/46/67/1440354667.db2.gz	LLWWLKLENCQIMV-NRFANRHFSA-N	0	3	346.474	3.497	20	30		EGEDHN
C#CCCN[C@@H](CNC(=O)c1ccc2cc[nH]c2c1)c1ccccc1	ZINC001753311281	1440356514	/nfs/dbraw/zinc/35/65/14/1440356514.db2.gz	LDCRYAZQSJOKBM-FQEVSTJZSA-N	0	3	331.419	3.252	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)N(CCC)[C@@H]1CCN(Cc2cccc(C)c2)C1	ZINC001753316298	1440359732	/nfs/dbraw/zinc/35/97/32/1440359732.db2.gz	PEDQXZMOJATQFC-CTNGQTDRSA-N	0	3	344.499	3.135	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)NCC[C@@H]1CCN(Cc2ccc(C#N)c(F)c2)C1	ZINC001753326106	1440366643	/nfs/dbraw/zinc/36/66/43/1440366643.db2.gz	GZXIGXPBCZKPEF-PBHICJAKSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=CCC1(C(=O)NCC[C@@H]2CCN([C@H](C)c3cnccn3)C2)CCC1	ZINC001753336563	1440372649	/nfs/dbraw/zinc/37/26/49/1440372649.db2.gz	WCGOQCHJDTWTCI-IAGOWNOFSA-N	0	3	342.487	3.112	20	30		EGEDHN
C=CCOCCN1CCC[C@H](N(Cc2ccccc2)C(=O)C(C)C)C1	ZINC001753362059	1440383388	/nfs/dbraw/zinc/38/33/88/1440383388.db2.gz	UGQPQZGCRAUMCO-FQEVSTJZSA-N	0	3	344.499	3.338	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](CN(C)Cc3ocnc3C)C2)CCCC1	ZINC001753362093	1440383550	/nfs/dbraw/zinc/38/35/50/1440383550.db2.gz	URXZVRMLTGJTFM-QGZVFWFLSA-N	0	3	345.487	3.400	20	30		EGEDHN
C=CCC1(C(=O)NCC2CN(C[C@@H]3CC[C@@H](C)O3)C2)CCCCC1	ZINC001753417379	1440394526	/nfs/dbraw/zinc/39/45/26/1440394526.db2.gz	OJZMXBXSODQATA-AEFFLSMTSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C1(CCOCC)CCCC1	ZINC001753426116	1440396759	/nfs/dbraw/zinc/39/67/59/1440396759.db2.gz	MNKLOOWVOPWOAU-ROUUACIJSA-N	0	3	334.504	3.225	20	30		EGEDHN
CCCCCCCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1cccc(OC)c1	ZINC001753426722	1440397050	/nfs/dbraw/zinc/39/70/50/1440397050.db2.gz	NHXNGJHBZYAIAR-OALUTQOASA-N	0	3	344.499	3.493	20	30		EGEDHN
C=CCOCCN1CC[C@H](N(C)C(=O)[C@@H](CC)c2ccc(F)cc2)C1	ZINC001753450121	1440405612	/nfs/dbraw/zinc/40/56/12/1440405612.db2.gz	MYUWVOMJVPTXFB-OALUTQOASA-N	0	3	348.462	3.055	20	30		EGEDHN
C=CCCC(=O)N(CC)[C@@H]1CCN(Cc2ccc(C)c(OC)c2)C1	ZINC001753452634	1440406670	/nfs/dbraw/zinc/40/66/70/1440406670.db2.gz	BZLLPQPDWXNVPO-GOSISDBHSA-N	0	3	330.472	3.393	20	30		EGEDHN
CCN(C(=O)[C@H](C)C#N)[C@@H]1CCN(Cc2cc3ccccc3s2)C1	ZINC001753453914	1440407541	/nfs/dbraw/zinc/40/75/41/1440407541.db2.gz	ZJGYQOMIMUJUAG-GDBMZVCRSA-N	0	3	341.480	3.484	20	30		EGEDHN
C=C(Br)CNC[C@](C)(NC(=O)C(CC)CC)C1CC1	ZINC001753513702	1440426881	/nfs/dbraw/zinc/42/68/81/1440426881.db2.gz	UPOOMPXKUWDKBK-HNNXBMFYSA-N	0	3	331.298	3.206	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2nccs2)CCCC[C@@H]1C	ZINC001753536212	1440432662	/nfs/dbraw/zinc/43/26/62/1440432662.db2.gz	RAXUWDDEAYWKJO-NHYWBVRUSA-N	0	3	327.881	3.164	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@H](CCNCc2cc(C#N)ccc2F)C1	ZINC001753541899	1440433680	/nfs/dbraw/zinc/43/36/80/1440433680.db2.gz	XSFSNAUORDPYLB-OAHLLOKOSA-N	0	3	331.435	3.072	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H](CCNCc2ccncc2Cl)C1	ZINC001753546607	1440434259	/nfs/dbraw/zinc/43/42/59/1440434259.db2.gz	OSPXSAPHQYGFCW-MRXNPFEDSA-N	0	3	347.890	3.257	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@@H](CCNCc2cccc(F)c2F)C1	ZINC001753547192	1440434381	/nfs/dbraw/zinc/43/43/81/1440434381.db2.gz	ZUDQNEYRAAJJQQ-INIZCTEOSA-N	0	3	346.421	3.097	20	30		EGEDHN
C=C(Br)CNCC[C@H]1CCCN(C(=O)C(C)(C)C)C1	ZINC001753558350	1440436352	/nfs/dbraw/zinc/43/63/52/1440436352.db2.gz	AVGFLCIYANRDSU-CYBMUJFWSA-N	0	3	331.298	3.159	20	30		EGEDHN
C#CCNCc1ccc(CNC(=O)Cc2ccc3ccccc3c2)cc1	ZINC001753592523	1440443319	/nfs/dbraw/zinc/44/33/19/1440443319.db2.gz	QULISNFRODBUKD-UHFFFAOYSA-N	0	3	342.442	3.422	20	30		EGEDHN
C[C@@H](CNCc1cc(F)ccc1C#N)CNC(=O)C[C@@H]1C=CCCC1	ZINC001753620883	1440450425	/nfs/dbraw/zinc/45/04/25/1440450425.db2.gz	DGDIHXDDJLKMPC-JKSUJKDBSA-N	0	3	343.446	3.286	20	30		EGEDHN
CC(C)C(=O)NCC1(NCC#Cc2ccccc2Cl)CCCC1	ZINC001753660764	1440458490	/nfs/dbraw/zinc/45/84/90/1440458490.db2.gz	NKOJPANXGFNNLM-UHFFFAOYSA-N	0	3	332.875	3.366	20	30		EGEDHN
CC(C)[C@H](F)C(=O)NCC1(NCc2cc(C#N)ccc2F)CCCC1	ZINC001753666328	1440460358	/nfs/dbraw/zinc/46/03/58/1440460358.db2.gz	DATTYOJCPYMCEM-KRWDZBQOSA-N	0	3	349.425	3.210	20	30		EGEDHN
O=C(NCC1(NCC#Cc2ccccc2)CCCC1)[C@@H]1CC[C@H](F)C1	ZINC001753667663	1440460862	/nfs/dbraw/zinc/46/08/62/1440460862.db2.gz	FGBRKYRDNMAZNX-MOPGFXCFSA-N	0	3	342.458	3.195	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC1(N[C@@H](C)c2n[nH]c(CC)n2)CCCC1	ZINC001753667930	1440460992	/nfs/dbraw/zinc/46/09/92/1440460992.db2.gz	OKDITCXPHQWTHI-KSSFIOAISA-N	0	3	347.507	3.049	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)N(C)C(=O)CCc1ccsc1	ZINC001753694769	1440467319	/nfs/dbraw/zinc/46/73/19/1440467319.db2.gz	GCEDLDGJHKVJIA-CYBMUJFWSA-N	0	3	347.509	3.251	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N(C)[C@H](C)CNCc1ccc(F)c(C#N)c1	ZINC001753711115	1440470610	/nfs/dbraw/zinc/47/06/10/1440470610.db2.gz	NJCAXOLVSJIPFJ-FRFSOERESA-N	0	3	331.435	3.070	20	30		EGEDHN
C=CC1(CC(=O)N(C)[C@H](C)CN[C@H](C)c2n[nH]c(C)n2)CCCCC1	ZINC001753716625	1440472045	/nfs/dbraw/zinc/47/20/45/1440472045.db2.gz	YBZHZTLHBFDYGU-HUUCEWRRSA-N	0	3	347.507	3.137	20	30		EGEDHN
N#Cc1ccccc1CNCC[C@@H]1CCCCN1C(=O)c1cccnc1	ZINC001753766438	1440484912	/nfs/dbraw/zinc/48/49/12/1440484912.db2.gz	QGVJKEXKFNTISW-FQEVSTJZSA-N	0	3	348.450	3.128	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCCC[C@@H]1CCNCc1cnc(C)o1	ZINC001753776365	1440486505	/nfs/dbraw/zinc/48/65/05/1440486505.db2.gz	DHNAWXRSSKXBEG-MRXNPFEDSA-N	0	3	333.476	3.446	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)C1C=CC=CC=C1)NCC#Cc1ccccc1	ZINC001753831075	1440499690	/nfs/dbraw/zinc/49/96/90/1440499690.db2.gz	MHNRMCVKFXQNPL-OAQYLSRUSA-N	0	3	334.463	3.067	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cnoc1-c1ccco1)C(C)C	ZINC001753834447	1440500555	/nfs/dbraw/zinc/50/05/55/1440500555.db2.gz	MFHDUUUQPKGYAX-ZDUSSCGKSA-N	0	3	337.807	3.031	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N(C)CCN(C)Cc1cccc2c1CCOC2	ZINC001753860542	1440511052	/nfs/dbraw/zinc/51/10/52/1440511052.db2.gz	BQDLROWTVOTYHW-KRWDZBQOSA-N	0	3	344.499	3.252	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccccc2Cl)C1	ZINC001753872175	1440517622	/nfs/dbraw/zinc/51/76/22/1440517622.db2.gz	KKDKATPEPRAUNY-IEBWSBKVSA-N	0	3	344.886	3.422	20	30		EGEDHN
CCCSCC(=O)N[C@H]1CCC[C@@H]1CNCc1ccccc1C#N	ZINC001753880621	1440520468	/nfs/dbraw/zinc/52/04/68/1440520468.db2.gz	RIGOKWAZHHNGCJ-MSOLQXFVSA-N	0	3	345.512	3.076	20	30		EGEDHN
C[C@@H](CCNCc1cc(C#N)ccc1F)NC(=O)c1sccc1F	ZINC001753962970	1440526345	/nfs/dbraw/zinc/52/63/45/1440526345.db2.gz	BJECZLOCWVIGMB-NSHDSACASA-N	0	3	349.406	3.196	20	30		EGEDHN
CCN(CCNCc1ccc(C#N)s1)C(=O)Cc1ccc(C)cc1	ZINC001754056172	1440536170	/nfs/dbraw/zinc/53/61/70/1440536170.db2.gz	SFMONPLLZNBYSX-UHFFFAOYSA-N	0	3	341.480	3.109	20	30		EGEDHN
C[C@H](C#N)C(=O)NC/C=C\CNCc1cccc(Oc2ccccc2)c1	ZINC001754102484	1440541301	/nfs/dbraw/zinc/54/13/01/1440541301.db2.gz	BPHDYNHMQUKBTD-KEGWNNHHSA-N	0	3	349.434	3.401	20	30		EGEDHN
N#Cc1cccc(CNC/C=C\CNC(=O)C(F)=C2CCCC2)c1	ZINC001754110962	1440542007	/nfs/dbraw/zinc/54/20/07/1440542007.db2.gz	OBIXTYJMUPCAQT-ARJAWSKDSA-N	0	3	327.403	3.118	20	30		EGEDHN
N#Cc1cccc(CNC/C=C/CNC(=O)C2(C3CCC3)CCC2)c1	ZINC001754153690	1440545452	/nfs/dbraw/zinc/54/54/52/1440545452.db2.gz	LBCCSTGSHHTQNE-OWOJBTEDSA-N	0	3	337.467	3.291	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC/C=C\CNCc1cccc2c1CCOC2	ZINC001754166601	1440546485	/nfs/dbraw/zinc/54/64/85/1440546485.db2.gz	PDZMVMUMIKFVST-NGXITPROSA-N	0	3	342.483	3.124	20	30		EGEDHN
CCc1ccccc1C(=O)NC/C=C\CNCc1ccc(C#N)cc1	ZINC001754170967	1440547134	/nfs/dbraw/zinc/54/71/34/1440547134.db2.gz	CXZJIFPTYXWXOA-WAYWQWQTSA-N	0	3	333.435	3.196	20	30		EGEDHN
CC(C)(C(=O)NC/C=C/CNCc1cccc(C#N)c1)c1ccccc1	ZINC001754204469	1440550581	/nfs/dbraw/zinc/55/05/81/1440550581.db2.gz	PLNVBKDVOWABSO-VOTSOKGWSA-N	0	3	347.462	3.298	20	30		EGEDHN
C=C[C@H](C(=O)NC/C=C/CNCc1ccc(C)nc1C)c1ccccc1	ZINC001754210249	1440551094	/nfs/dbraw/zinc/55/10/94/1440551094.db2.gz	SXNRHUFLMINEBO-SHBDEGQCSA-N	0	3	349.478	3.430	20	30		EGEDHN
C[C@H](CNCC#Cc1ccccc1)NC(=O)c1cncc2sccc21	ZINC001754239352	1440555440	/nfs/dbraw/zinc/55/54/40/1440555440.db2.gz	TWCPIPPTEXHYHP-OAHLLOKOSA-N	0	3	349.459	3.056	20	30		EGEDHN
C=CCCC(=O)N[C@@H](C)CNCc1cc(F)cc(Br)c1	ZINC001754260492	1440559911	/nfs/dbraw/zinc/55/99/11/1440559911.db2.gz	BZPLPTDMROVQOY-NSHDSACASA-N	0	3	343.240	3.149	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@@H](C)CN[C@H](C)c1ccccc1F	ZINC001754294174	1440566009	/nfs/dbraw/zinc/56/60/09/1440566009.db2.gz	YWFFQFMNBQTGNC-JKSUJKDBSA-N	0	3	338.426	3.205	20	30		EGEDHN
C=C[C@@H](C(=O)N[C@@H](C)CNCc1ccnc(Cl)c1)c1ccccc1	ZINC001754294817	1440566225	/nfs/dbraw/zinc/56/62/25/1440566225.db2.gz	BJIIZLAIQBOOSM-WMLDXEAASA-N	0	3	343.858	3.299	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)c1ccoc1Cl	ZINC001754307430	1440571521	/nfs/dbraw/zinc/57/15/21/1440571521.db2.gz	BNCKOLKELCTOJM-GFCCVEGCSA-N	0	3	331.803	3.055	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)c1ccc2[nH]ccc2c1	ZINC001754324456	1440579670	/nfs/dbraw/zinc/57/96/70/1440579670.db2.gz	VRPAOUJBNDQUJD-OAHLLOKOSA-N	0	3	346.434	3.290	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CCCC[C@@H]1CNCc1ccccc1C#N	ZINC001754339197	1440587838	/nfs/dbraw/zinc/58/78/38/1440587838.db2.gz	DNPRWLHWOYQWES-RTBURBONSA-N	0	3	325.456	3.289	20	30		EGEDHN
C=CC(C)(C)C(=O)N(C)CCCNCc1ccn(C2CCCC2)n1	ZINC001754388782	1440594121	/nfs/dbraw/zinc/59/41/21/1440594121.db2.gz	KNZVZJVXBLRMMN-UHFFFAOYSA-N	0	3	332.492	3.149	20	30		EGEDHN
C[C@]1(C(=O)N[C@@H](CNCc2ccc(C#N)c(F)c2)C2CC2)C=CCC1	ZINC001754449738	1440600815	/nfs/dbraw/zinc/60/08/15/1440600815.db2.gz	YCAGMRCTUQMXPL-ICSRJNTNSA-N	0	3	341.430	3.038	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CCC[C@H]1CNCc1ccccc1F)OCC	ZINC001754610357	1440643766	/nfs/dbraw/zinc/64/37/66/1440643766.db2.gz	DTHJTAMNLFXARJ-PKOBYXMFSA-N	0	3	348.462	3.278	20	30		EGEDHN
CC1(CCC(=O)N2CCC[C@H]2CNCC#Cc2ccc(F)cc2)CC1	ZINC001754619253	1440644985	/nfs/dbraw/zinc/64/49/85/1440644985.db2.gz	UQUAOBXMSKTCQZ-IBGZPJMESA-N	0	3	342.458	3.338	20	30		EGEDHN
CC#CCNC[C@H](NC(=O)[C@@H]1CC12CC2)c1ccc2ccccc2c1	ZINC001754643963	1440649575	/nfs/dbraw/zinc/64/95/75/1440649575.db2.gz	LGFXHKBGGRHXFD-PMACEKPBSA-N	0	3	332.447	3.410	20	30		EGEDHN
Cc1cc[nH]c1C(=O)N[C@H](CNCC#Cc1ccccc1)C1CCCC1	ZINC001754646604	1440650660	/nfs/dbraw/zinc/65/06/60/1440650660.db2.gz	IYEKRKCXSAOOSB-HXUWFJFHSA-N	0	3	349.478	3.253	20	30		EGEDHN
CCC1(C(=O)N2CC[C@](C)(CNCc3ccccc3C#N)C2)CC1	ZINC001754704712	1440668723	/nfs/dbraw/zinc/66/87/23/1440668723.db2.gz	NUCPPHUGSZTUEK-LJQANCHMSA-N	0	3	325.456	3.077	20	30		EGEDHN
Cc1cccnc1CN1CCC[C@@](C)(CNC(=O)C#CC(C)(C)C)C1	ZINC001754726729	1440676616	/nfs/dbraw/zinc/67/66/16/1440676616.db2.gz	HANCZWHXPSBNPZ-NRFANRHFSA-N	0	3	341.499	3.158	20	30		EGEDHN
CC#CCN1CCC[C@](C)(CNC(=O)[C@@H](C)OC2CCCCCC2)C1	ZINC001754729932	1440678409	/nfs/dbraw/zinc/67/84/09/1440678409.db2.gz	ABIDDAZFEQZBLF-WIYYLYMNSA-N	0	3	348.531	3.356	20	30		EGEDHN
CC#CCN1CCC[C@@](C)(CNC(=O)c2cc(C)c(CC)s2)C1	ZINC001754734385	1440681520	/nfs/dbraw/zinc/68/15/20/1440681520.db2.gz	UVYOFBUWYXSCKN-IBGZPJMESA-N	0	3	332.513	3.474	20	30		EGEDHN
C=C(C)CN1CC[C@](O)(CNC(=O)c2ccccc2CC(C)(C)C)C1	ZINC001754754755	1440684948	/nfs/dbraw/zinc/68/49/48/1440684948.db2.gz	QVFBYYIDBPNHCT-NRFANRHFSA-N	0	3	344.499	3.018	20	30		EGEDHN
C#CCCCCC(=O)N1CCC[C@H]2CN(CCC(F)(F)F)C[C@H]21	ZINC001754872755	1440705594	/nfs/dbraw/zinc/70/55/94/1440705594.db2.gz	JPEPSICIXKVJAF-LSDHHAIUSA-N	0	3	330.394	3.055	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCN(C(=O)c2cnc3ccsc3c2)C1	ZINC001754926520	1440709881	/nfs/dbraw/zinc/70/98/81/1440709881.db2.gz	SKOTYMQHQNONPA-CYBMUJFWSA-N	0	3	349.887	3.491	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCN(C(=O)c2cc3c(s2)CCC3)C1	ZINC001754940956	1440711849	/nfs/dbraw/zinc/71/18/49/1440711849.db2.gz	AWVADQYJTCSXHG-CYBMUJFWSA-N	0	3	338.904	3.431	20	30		EGEDHN
C#CCN[C@H](C)c1ccc(CNC(=O)[C@H]2CCCc3cccnc32)cc1	ZINC001754948825	1440714229	/nfs/dbraw/zinc/71/42/29/1440714229.db2.gz	PYDVUMORBPHINP-UZLBHIALSA-N	0	3	347.462	3.102	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@H]1CC[C@H](NC(=O)CCCF)CC1	ZINC001754955903	1440716518	/nfs/dbraw/zinc/71/65/18/1440716518.db2.gz	VZCZCEDKNKBTMR-PPUGGXLSSA-N	0	3	349.425	3.212	20	30		EGEDHN
CC[C@H](c1ccc(F)cc1F)N(C)CCCN(C)C(=O)[C@H](C)C#N	ZINC001755035139	1440733827	/nfs/dbraw/zinc/73/38/27/1440733827.db2.gz	JTPUHXCTQQMNCD-CXAGYDPISA-N	0	3	337.414	3.356	20	30		EGEDHN
C=CCCCN1Cc2ccccc2C[C@@H]1CNC(=O)c1ccncc1	ZINC001755073767	1440747643	/nfs/dbraw/zinc/74/76/43/1440747643.db2.gz	FENDVKQWCOOYLC-HXUWFJFHSA-N	0	3	335.451	3.205	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC(C)(NCc2ccn(C(C)C)n2)CC1	ZINC001755129036	1440756752	/nfs/dbraw/zinc/75/67/52/1440756752.db2.gz	AFWVSBJKVNYYMN-UHFFFAOYSA-N	0	3	332.492	3.291	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CCN(Cc2ccc3c(c2)COC3)CC1(C)C	ZINC001755137013	1440758552	/nfs/dbraw/zinc/75/85/52/1440758552.db2.gz	KWFPKOUPPBKRLX-IBGZPJMESA-N	0	3	342.483	3.400	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@H]1CNC(=O)C1(CCOC)CC1	ZINC001755171759	1440768955	/nfs/dbraw/zinc/76/89/55/1440768955.db2.gz	CKIGDPHQOYLVDM-LJQANCHMSA-N	0	3	342.483	3.095	20	30		EGEDHN
C=CCCCN1CCOC2(CCN(C(=O)C[C@H]3CC=CCC3)CC2)C1	ZINC001755174618	1440770420	/nfs/dbraw/zinc/77/04/20/1440770420.db2.gz	WMIPKONMZTYQIH-IBGZPJMESA-N	0	3	346.515	3.392	20	30		EGEDHN
C=CCCCN1CCOC2(CCN(C(=O)[C@@H]3CC[C@@H]4C[C@@H]4C3)CC2)C1	ZINC001755174865	1440770604	/nfs/dbraw/zinc/77/06/04/1440770604.db2.gz	ZDZGWFGADPKBJV-GUDVDZBRSA-N	0	3	346.515	3.082	20	30		EGEDHN
C[C@@H](NC(=O)CC1CCCCC1)[C@H](C)NCC#Cc1ccccc1	ZINC001755226339	1440785992	/nfs/dbraw/zinc/78/59/92/1440785992.db2.gz	NBQGFYBJMWCOMQ-ZWKOTPCHSA-N	0	3	326.484	3.491	20	30		EGEDHN
C[C@@H](NCC#Cc1cccc(Cl)c1)[C@H](C)NC(=O)CC1CCC1	ZINC001755229188	1440786647	/nfs/dbraw/zinc/78/66/47/1440786647.db2.gz	AAWKHTMVBPNNRK-CABCVRRESA-N	0	3	332.875	3.365	20	30		EGEDHN
C[C@@H](NCC#Cc1ccc(F)cc1)[C@H](C)NC(=O)C(C1CC1)C1CC1	ZINC001755264372	1440795685	/nfs/dbraw/zinc/79/56/85/1440795685.db2.gz	WCXNBQDVUFQUHX-CABCVRRESA-N	0	3	342.458	3.096	20	30		EGEDHN
C#CCCCCC(=O)NC1(CNCc2cncc(F)c2)CCCCC1	ZINC001755349807	1440827394	/nfs/dbraw/zinc/82/73/94/1440827394.db2.gz	FMSAAFUJHLBMRP-UHFFFAOYSA-N	0	3	345.462	3.323	20	30		EGEDHN
C#CCCCC(=O)NC[C@H]1CCCCCN1Cc1cnccc1C	ZINC001755363835	1440833465	/nfs/dbraw/zinc/83/34/65/1440833465.db2.gz	NNKZPTIJGDEGFU-LJQANCHMSA-N	0	3	327.472	3.054	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)[C@@]1(c2ccccc2)CCCO1	ZINC001755367491	1440835417	/nfs/dbraw/zinc/83/54/17/1440835417.db2.gz	HFWPELRMDNNJOY-CTNGQTDRSA-N	0	3	342.483	3.239	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)[C@@]1(C)CCc2ccccc21	ZINC001755371969	1440837390	/nfs/dbraw/zinc/83/73/90/1440837390.db2.gz	YJXLKZCPKZPOEI-KNQAVFIVSA-N	0	3	338.495	3.275	20	30		EGEDHN
CC#CCCCC(=O)N[C@H](C)C1CN(Cc2cc(C)ccc2C)C1	ZINC001755384326	1440840321	/nfs/dbraw/zinc/84/03/21/1440840321.db2.gz	OWRCAAPKILUHJQ-GOSISDBHSA-N	0	3	326.484	3.434	20	30		EGEDHN
Cc1ccccc1CN1C[C@@H](NC(=O)C#CC(C)(C)C)C(C)(C)C1	ZINC001755406079	1440844351	/nfs/dbraw/zinc/84/43/51/1440844351.db2.gz	BUQGJRMCWLFZRS-GOSISDBHSA-N	0	3	326.484	3.371	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1CN(Cc2cccc(CC)c2)CC1(C)C	ZINC001755415019	1440848132	/nfs/dbraw/zinc/84/81/32/1440848132.db2.gz	DIGPMOZLKORXIC-IBGZPJMESA-N	0	3	344.499	3.168	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@H]2[C@H]3CN(Cc4cccc(Cl)c4)C[C@H]32)C1	ZINC001755432048	1440851350	/nfs/dbraw/zinc/85/13/50/1440851350.db2.gz	QUHJLDLECVRYND-NNZMDNLPSA-N	0	3	344.886	3.490	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CC[C@H](NC(=O)C3(C(F)F)CC3)C[C@H]2C1	ZINC001755453041	1440854310	/nfs/dbraw/zinc/85/43/10/1440854310.db2.gz	MICGZVVFQQCHKV-AVGNSLFASA-N	0	3	332.822	3.001	20	30		EGEDHN
COc1ccc(Cl)c(CNCCC[C@@H](C)NC(=O)C#CC2CC2)c1	ZINC001755497694	1440862290	/nfs/dbraw/zinc/86/22/90/1440862290.db2.gz	STOPGSUQGDXNQR-CQSZACIVSA-N	0	3	348.874	3.137	20	30		EGEDHN
C=C(Cl)CNCCC[C@@H](C)NC(=O)[C@@H]1CCN(C)c2ccccc21	ZINC001755501292	1440862590	/nfs/dbraw/zinc/86/25/90/1440862590.db2.gz	JUIQXFSGZZLUGL-NVXWUHKLSA-N	0	3	349.906	3.237	20	30		EGEDHN
C=CCCC(=O)N1CCC(N(C)Cc2cn(C(C)C)nc2C)CC1	ZINC001755528156	1440866275	/nfs/dbraw/zinc/86/62/75/1440866275.db2.gz	ANJWKJSZWKCBPU-UHFFFAOYSA-N	0	3	332.492	3.161	20	30		EGEDHN
C#CCCCCC(=O)N1CCC(N(C)CC#Cc2ccccc2)CC1	ZINC001755529047	1440866450	/nfs/dbraw/zinc/86/64/50/1440866450.db2.gz	HSLKXFREVMEUCY-UHFFFAOYSA-N	0	3	336.479	3.155	20	30		EGEDHN
CN(CC#Cc1ccccc1)C1CCN(C(=O)[C@]23C[C@H]2CCC3)CC1	ZINC001755531593	1440867574	/nfs/dbraw/zinc/86/75/74/1440867574.db2.gz	RVLCXWUQYFMGPW-DENIHFKCSA-N	0	3	336.479	3.151	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)N2CCC(N(C)CC#Cc3ccccc3)CC2)C1	ZINC001755534412	1440868676	/nfs/dbraw/zinc/86/86/76/1440868676.db2.gz	LYYDDMWIBLPQCJ-ICSRJNTNSA-N	0	3	338.495	3.397	20	30		EGEDHN
CN(C(=O)[C@@H]1CC1(C)C)[C@@H](CNCC#Cc1ccc(F)cc1)C1CC1	ZINC001755558860	1440874020	/nfs/dbraw/zinc/87/40/20/1440874020.db2.gz	QNAYJEQNNYEFSY-OALUTQOASA-N	0	3	342.458	3.050	20	30		EGEDHN
C=C(C)CCC(=O)N(C)[C@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001755562351	1440874783	/nfs/dbraw/zinc/87/47/83/1440874783.db2.gz	METNFJPZZDEXKI-QGZVFWFLSA-N	0	3	331.485	3.303	20	30		EGEDHN
CC[C@H](C)CC(=O)N(C)[C@@H](CNCc1cc(C#N)ccc1F)C1CC1	ZINC001755570570	1440876835	/nfs/dbraw/zinc/87/68/35/1440876835.db2.gz	DMQCQRVXRRPZSC-LIRRHRJNSA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@@H]1[C@H](NCC#Cc2ccccc2Cl)CCN1C(=O)C(C)(C)F	ZINC001755648798	1440891215	/nfs/dbraw/zinc/89/12/15/1440891215.db2.gz	JRXHRWCAGHZJHM-CZUORRHYSA-N	0	3	336.838	3.019	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)[C@H]1C	ZINC001755655379	1440891913	/nfs/dbraw/zinc/89/19/13/1440891913.db2.gz	VWCNCVKJYKMEQY-RDTXWAMCSA-N	0	3	329.419	3.133	20	30		EGEDHN
C[C@@H]1[C@@H](NCC#Cc2cccc(Cl)c2)CCN1C(=O)CCCF	ZINC001755658964	1440892413	/nfs/dbraw/zinc/89/24/13/1440892413.db2.gz	NDTJORGUPGFRDQ-PBHICJAKSA-N	0	3	336.838	3.020	20	30		EGEDHN
CCCCCC(=O)N1C[C@H](NCc2ccc(F)c(C#N)c2)C[C@H]1C	ZINC001755670383	1440893912	/nfs/dbraw/zinc/89/39/12/1440893912.db2.gz	QMSVWRSPSNINMB-RHSMWYFYSA-N	0	3	331.435	3.357	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](NCc2ccc(OC)c(C#N)c2)C[C@H]1C	ZINC001755675125	1440894397	/nfs/dbraw/zinc/89/43/97/1440894397.db2.gz	INOZHAKLSXVANG-QAPCUYQASA-N	0	3	341.455	3.002	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](NCc2cnn(C(C)(C)C)c2)C[C@H]1C	ZINC001755680258	1440895102	/nfs/dbraw/zinc/89/51/02/1440895102.db2.gz	CNISDPTXOWMFSO-WBVHZDCISA-N	0	3	332.492	3.073	20	30		EGEDHN
CC#CCN[C@H]1C[C@H](C)N(C(=O)c2cc3c(s2)CCCCC3)C1	ZINC001755688393	1440896357	/nfs/dbraw/zinc/89/63/57/1440896357.db2.gz	IIQALJGKGDMCLS-HOCLYGCPSA-N	0	3	330.497	3.233	20	30		EGEDHN
C[C@H]1C[C@@H](NCC#Cc2ccccc2)CN1C(=O)C1CCC=CCC1	ZINC001755692431	1440897011	/nfs/dbraw/zinc/89/70/11/1440897011.db2.gz	KYDWKLNOOBXQET-GHTZIAJQSA-N	0	3	336.479	3.364	20	30		EGEDHN
CC#CCN1CC[C@@]2(NC(=O)CCCc3ccc(F)cc3)CCC[C@H]12	ZINC001755699652	1440899109	/nfs/dbraw/zinc/89/91/09/1440899109.db2.gz	CHAFUENKRAAGCZ-FPOVZHCZSA-N	0	3	342.458	3.285	20	30		EGEDHN
C#CCN1CC[C@]2(NC(=O)CCCc3ccccc3Cl)CCC[C@@H]12	ZINC001755700092	1440899803	/nfs/dbraw/zinc/89/98/03/1440899803.db2.gz	CCLPCGITFMTNKH-UYAOXDASSA-N	0	3	344.886	3.409	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CCCN(CCn2nc(C)cc2C)[C@H]1C	ZINC001755716242	1440905229	/nfs/dbraw/zinc/90/52/29/1440905229.db2.gz	KTXZGTYIGJUWEE-ZWKOTPCHSA-N	0	3	346.519	3.071	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)CC(F)(F)C(F)(F)F)[C@H]1C	ZINC001755721787	1440907729	/nfs/dbraw/zinc/90/77/29/1440907729.db2.gz	CYHFAKFJNICQMF-GHMZBOCLSA-N	0	3	328.325	3.119	20	30		EGEDHN
CC1(C)CN(C(=O)/C=C\c2ccco2)C[C@@H]1NCC#Cc1ccccc1	ZINC001755751481	1440913246	/nfs/dbraw/zinc/91/32/46/1440913246.db2.gz	PZBLMAXBCSDHRB-CBUFDYBVSA-N	0	3	348.446	3.171	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](NCC#Cc2ccccc2)C(C)(C)C1	ZINC001755760205	1440914791	/nfs/dbraw/zinc/91/47/91/1440914791.db2.gz	ISXJUGYKZKSRBY-IBGZPJMESA-N	0	3	338.495	3.467	20	30		EGEDHN
C=C(Br)CNC[C@@H](NC(=O)C1(F)CCCC1)C(C)(C)C	ZINC001755827157	1440927641	/nfs/dbraw/zinc/92/76/41/1440927641.db2.gz	GPPRFMYGQUEEJA-GFCCVEGCSA-N	0	3	349.288	3.298	20	30		EGEDHN
C=C(C)CN(CCNC(=O)c1ccc2sccc2c1)CCOC	ZINC001755840735	1440931642	/nfs/dbraw/zinc/93/16/42/1440931642.db2.gz	JJUJSFNSRDXXQN-UHFFFAOYSA-N	0	3	332.469	3.156	20	30		EGEDHN
C#CCN1CCC([C@@H](C)NC(=O)CC23CC4CC(CC(C4)C2)C3)CC1	ZINC001755845939	1440933241	/nfs/dbraw/zinc/93/32/41/1440933241.db2.gz	FPIPOMOUSMVCCQ-GSQFEDNKSA-N	0	3	342.527	3.443	20	30		EGEDHN
C#CCCCC(=O)N(C)C1CC(N[C@@H](C)c2ccc(F)cc2F)C1	ZINC001755856256	1440935856	/nfs/dbraw/zinc/93/58/56/1440935856.db2.gz	RMYWCSCYTGOSJC-JEYLPNPQSA-N	0	3	334.410	3.408	20	30		EGEDHN
CC#CCN1CCC(C2(NC(=O)CC(C)(C)C(F)(F)F)CC2)CC1	ZINC001755869622	1440938705	/nfs/dbraw/zinc/93/87/05/1440938705.db2.gz	LYPVWCNIYVDMQJ-UHFFFAOYSA-N	0	3	344.421	3.349	20	30		EGEDHN
Cc1ccc(NC(=O)[C@H]2CCCN(Cc3ccc(C#N)cc3)C2)nc1	ZINC000174604747	231253135	/nfs/dbraw/zinc/25/31/35/231253135.db2.gz	FFEFIIQCBNWVNY-SFHVURJKSA-N	0	3	334.423	3.112	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)c1cccc(F)c1F	ZINC000102230718	219191368	/nfs/dbraw/zinc/19/13/68/219191368.db2.gz	HSXYMVBABUBPMK-UHFFFAOYSA-N	0	3	343.377	3.040	20	30		EGEDHN
N#Cc1c(CN2CCC[C@@H](c3nc(C4CC4)n[nH]3)C2)cn2ccccc12	ZINC000179517736	233130243	/nfs/dbraw/zinc/13/02/43/233130243.db2.gz	SFMGVDUFGDXUGE-OAHLLOKOSA-N	0	3	346.438	3.186	20	30		EGEDHN
N#Cc1c(CN2CCC[C@@H](c3n[nH]c(C4CC4)n3)C2)cn2ccccc12	ZINC000179517736	233130245	/nfs/dbraw/zinc/13/02/45/233130245.db2.gz	SFMGVDUFGDXUGE-OAHLLOKOSA-N	0	3	346.438	3.186	20	30		EGEDHN
Cc1ccc([C@@H](CN[C@H](C)c2ccc(C#N)cc2)N2CCOCC2)o1	ZINC000181423845	234181384	/nfs/dbraw/zinc/18/13/84/234181384.db2.gz	CEQGYJHRCOSARS-VQIMIIECSA-N	0	3	339.439	3.184	20	30		EGEDHN
N#Cc1ccc(CN2CCC(Nc3cccc(NC(N)=O)c3)CC2)cc1	ZINC000182714205	234730268	/nfs/dbraw/zinc/73/02/68/234730268.db2.gz	RFAZABNNMXFVTK-UHFFFAOYSA-N	0	3	349.438	3.125	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)C1=CCCCCC1	ZINC000185607765	235705313	/nfs/dbraw/zinc/70/53/13/235705313.db2.gz	LIUAVMIRGPJIEI-UHFFFAOYSA-N	0	3	325.456	3.339	20	30		EGEDHN
N#Cc1ccccc1-c1ccc(CN2CCc3n[nH]c(=O)cc3C2)cc1	ZINC000360446408	283213746	/nfs/dbraw/zinc/21/37/46/283213746.db2.gz	UQPKYZSJIGKYBD-UHFFFAOYSA-N	0	3	342.402	3.279	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N1CC[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000187665672	236272525	/nfs/dbraw/zinc/27/25/25/236272525.db2.gz	GLDRRFVSMNTLTL-GDBMZVCRSA-N	0	3	329.444	3.466	20	30		EGEDHN
COc1cc(OC)cc(OCCN[C@@H]2CCc3ccc(C#N)cc32)c1	ZINC000353266024	241784243	/nfs/dbraw/zinc/78/42/43/241784243.db2.gz	NPLZAYHWLSUGIY-HXUWFJFHSA-N	0	3	338.407	3.231	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cccc(N3CCCC3)c2)CC1	ZINC000264326519	246355638	/nfs/dbraw/zinc/35/56/38/246355638.db2.gz	CKSWCRJLDGMJAQ-UHFFFAOYSA-N	0	3	328.460	3.059	20	30		EGEDHN
CC[C@H](N[C@H]1CCN(c2sccc2C#N)C1=O)c1ccccc1	ZINC000267685171	251253930	/nfs/dbraw/zinc/25/39/30/251253930.db2.gz	MXVLRNMZQCYUEW-HOTGVXAUSA-N	0	3	325.437	3.466	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN2CCC([C@@H](O)c3ccccc3)CC2)cc1	ZINC000268736559	252185850	/nfs/dbraw/zinc/18/58/50/252185850.db2.gz	YMKGQWZRRJVXKO-RTWAWAEBSA-N	0	3	336.435	3.037	20	30		EGEDHN
COc1ccc(C#N)cc1NC(=O)N1CCN(C2CCCCC2)CC1	ZINC000268930443	255498244	/nfs/dbraw/zinc/49/82/44/255498244.db2.gz	ZKHGGSSBSUYVOS-UHFFFAOYSA-N	0	3	342.443	3.049	20	30		EGEDHN
Cc1cccc(CNC(=O)CN2CCN(C)C3(CCCCC3)C2)c1	ZINC000328599395	258041779	/nfs/dbraw/zinc/04/17/79/258041779.db2.gz	RKOSQXQZKCCDIV-UHFFFAOYSA-N	0	3	329.488	3.402	20	30		EGEDHN
C[C@@H](N[C@@H]1CC(C)(C)OC1(C)C)C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000132628095	533516243	/nfs/dbraw/zinc/51/62/43/533516243.db2.gz	HIOUBSXVICJKLE-IAQYHMDHSA-N	0	3	349.862	3.474	20	30		EGEDHN
C[C@H](NCc1ccc(Cn2cncn2)cc1)c1ccc(C#N)c(F)c1	ZINC000346207974	141180342	/nfs/dbraw/zinc/18/03/42/141180342.db2.gz	WNBSMYNZCCNFEV-AWEZNQCLSA-N	0	3	335.386	3.188	20	30		EGEDHN
C[C@H](CN1CCCCC1)NC(=O)Nc1cc(C#N)cn1C(C)(C)C	ZINC000171145357	144001604	/nfs/dbraw/zinc/00/16/04/144001604.db2.gz	APPRBKXCUVNTNR-CQSZACIVSA-N	0	3	331.464	3.111	20	30		EGEDHN
CCO[C@H]1C[C@@H](N[C@@H](C)C(=O)Nc2ccccc2C#N)C1(CC)CC	ZINC000178667909	144074603	/nfs/dbraw/zinc/07/46/03/144074603.db2.gz	PWLRHSWCMFNHQE-QGTPRVQTSA-N	0	3	343.471	3.459	20	30		EGEDHN
N#Cc1ccc([C@@H](NC2CCC(c3ccccc3)CC2)C(N)=O)cc1	ZINC000115596602	152023073	/nfs/dbraw/zinc/02/30/73/152023073.db2.gz	PXGSKUAUFVLPAG-LYBXBRPPSA-N	0	3	333.435	3.401	20	30		EGEDHN
Cc1ccccc1[C@H]([C@@H](C)NC(=O)c1ccc(F)c(C#N)c1)N(C)C	ZINC000341566767	155359855	/nfs/dbraw/zinc/35/98/55/155359855.db2.gz	PJEWBLURQHTZGA-KUHUBIRLSA-N	0	3	339.414	3.427	20	30		EGEDHN
CC[C@H](N[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O)c1cccs1	ZINC000190603764	153149901	/nfs/dbraw/zinc/14/99/01/153149901.db2.gz	MKAHUPVECVACBF-IRXDYDNUSA-N	0	3	339.464	3.462	20	30		EGEDHN
CCc1nnc(N[C@@H]2CCN(Cc3ccccc3)C2)c(C#N)c1CC	ZINC000310696620	154142383	/nfs/dbraw/zinc/14/23/83/154142383.db2.gz	PPDKZKJOWLOHML-MRXNPFEDSA-N	0	3	335.455	3.159	20	30		EGEDHN
C[C@H]1[C@@H](NC(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)CCCN1C	ZINC000345266031	156024832	/nfs/dbraw/zinc/02/48/32/156024832.db2.gz	MEFJJMZWQUAQKP-HZMBPMFUSA-N	0	3	340.349	3.181	20	30		EGEDHN
N#Cc1cccc(CN[C@H]2CC(=O)N(c3ccc(Cl)c(F)c3)C2)c1	ZINC000346817323	156148142	/nfs/dbraw/zinc/14/81/42/156148142.db2.gz	DIKBWPUBFQUACT-AWEZNQCLSA-N	0	3	343.789	3.246	20	30		EGEDHN
C[C@H](CN(C)C)NC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1	ZINC000348924778	156289648	/nfs/dbraw/zinc/28/96/48/156289648.db2.gz	YWPVPEJMZZWBTO-CQSZACIVSA-N	0	3	338.411	3.422	20	30		EGEDHN
CSc1ccc([C@H](CNc2ccc(C#N)c(C)n2)N(C)C)cc1	ZINC000338836230	163360562	/nfs/dbraw/zinc/36/05/62/163360562.db2.gz	JOEHZKSPOHRZHY-KRWDZBQOSA-N	0	3	326.469	3.120	20	30		EGEDHN
CN(CCOCc1ccc(C#N)cc1)Cc1cccc(-n2cccn2)c1	ZINC000344106019	164104236	/nfs/dbraw/zinc/10/42/36/164104236.db2.gz	IFCHVFQXQGRWAX-UHFFFAOYSA-N	0	3	346.434	3.393	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@H](NCc3cccc4cc[nH]c43)C2=O)cc1	ZINC000355771058	166302658	/nfs/dbraw/zinc/30/26/58/166302658.db2.gz	VZVBUTAADQKSHI-IBGZPJMESA-N	0	3	344.418	3.325	20	30		EGEDHN
CN(C)C[C@@H](NC(=O)c1ccc(F)c(C#N)c1)c1ccc(Cl)cc1	ZINC000355853006	166328362	/nfs/dbraw/zinc/32/83/62/166328362.db2.gz	DNUUUJLYYALTHA-QGZVFWFLSA-N	0	3	345.805	3.383	20	30		EGEDHN
C[C@H](C(=O)NCC1CCN(c2ccncc2)CC1)c1cccc(C#N)c1	ZINC000360728688	167399762	/nfs/dbraw/zinc/39/97/62/167399762.db2.gz	KYLLDBBXLPPUNU-INIZCTEOSA-N	0	3	348.450	3.090	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)N1C[C@@H]2CCN(Cc3ccccc3)C[C@@H]2C1	ZINC000365728739	168038852	/nfs/dbraw/zinc/03/88/52/168038852.db2.gz	WADSPTPFXSYZHM-ZWKOTPCHSA-N	0	3	349.434	3.054	20	30		EGEDHN
CCN1CCN(c2cccc(Nc3ccc(Cl)c(C#N)n3)c2)CC1	ZINC000302227978	270044399	/nfs/dbraw/zinc/04/43/99/270044399.db2.gz	AJCAJHDKZJMIRF-UHFFFAOYSA-N	0	3	341.846	3.492	20	30		EGEDHN
N#Cc1cccc(CNC(=O)c2cccc(CN3CCCCC3)c2)c1	ZINC000411338437	270046763	/nfs/dbraw/zinc/04/67/63/270046763.db2.gz	NNLOHBNHNMBABE-UHFFFAOYSA-N	0	3	333.435	3.474	20	30		EGEDHN
N#Cc1ccc(CN[C@@H](Cc2ccccc2)[C@H](O)C(F)F)cc1F	ZINC000421368455	270048674	/nfs/dbraw/zinc/04/86/74/270048674.db2.gz	UZXKMUFDUWYMTM-IRXDYDNUSA-N	0	3	334.341	3.024	20	30		EGEDHN
N#Cc1cncc(N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)n1	ZINC000420601190	270048874	/nfs/dbraw/zinc/04/88/74/270048874.db2.gz	MYHFRCYZTLRKDE-AWEZNQCLSA-N	0	3	347.344	3.053	20	30		EGEDHN
CC[C@H](C)N1CCN(c2c(C#N)cnc3c(F)cc(F)cc32)CC1	ZINC000450864701	270053017	/nfs/dbraw/zinc/05/30/17/270053017.db2.gz	VQKZJWPWKLOMDV-LBPRGKRZSA-N	0	3	330.382	3.305	20	30		EGEDHN
CC(C)CN(C(=O)c1cc(C#N)ccc1Cl)C1CCN(C)CC1	ZINC000285582979	265794055	/nfs/dbraw/zinc/79/40/55/265794055.db2.gz	OMULHWSGFSZHSQ-UHFFFAOYSA-N	0	3	333.863	3.404	20	30		EGEDHN
CCCN(CC(=O)Nc1c(C#N)cnn1-c1ccccc1)CC(C)C	ZINC000299387810	266044773	/nfs/dbraw/zinc/04/47/73/266044773.db2.gz	IUYIYSXVMSJOIV-UHFFFAOYSA-N	0	3	339.443	3.050	20	30		EGEDHN
CN(C)[C@H](CNc1ccc(C#N)nn1)c1cccc(C(F)(F)F)c1	ZINC000302216781	266512259	/nfs/dbraw/zinc/51/22/59/266512259.db2.gz	IZIOBMMTDVUUFV-CQSZACIVSA-N	0	3	335.333	3.082	20	30		EGEDHN
CCCCNC(=O)[C@@H]1CC[C@@H](C)N(Cc2ccc(C#N)c(C)c2)C1	ZINC000486702499	267008961	/nfs/dbraw/zinc/00/89/61/267008961.db2.gz	BTMSFETWFHXZPL-VQIMIIECSA-N	0	3	327.472	3.384	20	30		EGEDHN
C[C@H](NC1(c2cccc(C#N)c2)CC1)c1ccccc1-n1ccnn1	ZINC000286093982	267180561	/nfs/dbraw/zinc/18/05/61/267180561.db2.gz	MFIBOHUTGBAMFY-HNNXBMFYSA-N	0	3	329.407	3.479	20	30		EGEDHN
CC[C@H](C)N[C@@H](CNC(=O)NCc1ccc(C#N)cc1)c1ccco1	ZINC000479271335	267204747	/nfs/dbraw/zinc/20/47/47/267204747.db2.gz	FOYSBIMIYMGQLR-YOEHRIQHSA-N	0	3	340.427	3.080	20	30		EGEDHN
C[C@H]1CC[C@H](CC(=O)N(CCN(C)C)Cc2cccc(C#N)c2)C1	ZINC000177689004	267222441	/nfs/dbraw/zinc/22/24/41/267222441.db2.gz	SFLLSMIIKRSRMV-IRXDYDNUSA-N	0	3	327.472	3.275	20	30		EGEDHN
C[C@H]1CN(CCCCNc2c(C#N)cnc3ccccc32)C[C@H](C)O1	ZINC000301704461	267232595	/nfs/dbraw/zinc/23/25/95/267232595.db2.gz	FVYSAJRZIUOVGC-HOTGVXAUSA-N	0	3	338.455	3.408	20	30		EGEDHN
CC[C@H]1c2ccsc2CCN1C[C@H](O)COc1ccccc1C#N	ZINC000528353527	267236896	/nfs/dbraw/zinc/23/68/96/267236896.db2.gz	UDRJTZRWYCPXSF-RDJZCZTQSA-N	0	3	342.464	3.369	20	30		EGEDHN
CN(C)CCOc1cccc(NC(=O)/C=C/c2ccc(C#N)cc2)c1	ZINC000491168980	267281479	/nfs/dbraw/zinc/28/14/79/267281479.db2.gz	VLALSSWTKDJSNL-ZHACJKMWSA-N	0	3	335.407	3.151	20	30		EGEDHN
CN(C)CCOc1cccc(NC(=O)/C=C/c2cccc(C#N)c2)c1	ZINC000491119004	267281505	/nfs/dbraw/zinc/28/15/05/267281505.db2.gz	MSXALUPLWOINKP-MDZDMXLPSA-N	0	3	335.407	3.151	20	30		EGEDHN
CN(C)[C@@H](CC(=O)NC1(c2cccc(C#N)c2)CC1)c1ccccc1	ZINC000416178086	267285538	/nfs/dbraw/zinc/28/55/38/267285538.db2.gz	KAGFVURTKJPTOD-IBGZPJMESA-N	0	3	333.435	3.357	20	30		EGEDHN
CN1CCC(N(Cc2ccccc2)C(=O)c2ccc(C#N)s2)CC1	ZINC000438553217	267331210	/nfs/dbraw/zinc/33/12/10/267331210.db2.gz	KYTXDXDVFRLILW-UHFFFAOYSA-N	0	3	339.464	3.356	20	30		EGEDHN
COC(=O)[C@]1(c2ccccc2)CCN([C@@H](C)c2cccc(C#N)c2)C1	ZINC000428802728	267396825	/nfs/dbraw/zinc/39/68/25/267396825.db2.gz	HQWPIPJHKXFPCH-HRAATJIYSA-N	0	3	334.419	3.436	20	30		EGEDHN
C[C@H](CCCc1cccnc1)N[C@@H](C)C(=O)Nc1ccccc1C#N	ZINC000459631081	267819513	/nfs/dbraw/zinc/81/95/13/267819513.db2.gz	BCBGIFRRWRFKAB-CVEARBPZSA-N	0	3	336.439	3.281	20	30		EGEDHN
N#Cc1cc2c(nc1NCC1CCN(c3ccncc3)CC1)CCC2	ZINC000271403486	268024808	/nfs/dbraw/zinc/02/48/08/268024808.db2.gz	IZXPSHTZYVJUIQ-UHFFFAOYSA-N	0	3	333.439	3.165	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCCc2c[nH]c3ccccc23)cc1	ZINC000349286089	268085743	/nfs/dbraw/zinc/08/57/43/268085743.db2.gz	RQYQAKAUSGKIMM-SFHVURJKSA-N	0	3	342.402	3.081	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCCc2ccc3[nH]ccc3c2)cc1	ZINC000337779513	268091077	/nfs/dbraw/zinc/09/10/77/268091077.db2.gz	LLHUJBGEEWYZEF-LJQANCHMSA-N	0	3	342.402	3.081	20	30		EGEDHN
Cn1cc(CNCC(C)(C)OCC2CC2)c(-c2ccc(C#N)cc2)n1	ZINC000414504851	268128301	/nfs/dbraw/zinc/12/83/01/268128301.db2.gz	PBMLEYOAWMRUMD-UHFFFAOYSA-N	0	3	338.455	3.254	20	30		EGEDHN
N#Cc1ccc(NC(=O)CN[C@@H](CCO)C2CCCCC2)cc1Cl	ZINC000181512443	268141341	/nfs/dbraw/zinc/14/13/41/268141341.db2.gz	LYIWTSOVCZQXLO-KRWDZBQOSA-N	0	3	349.862	3.071	20	30		EGEDHN
N#Cc1cc(Cl)ccc1CNC1(CO)C2CC3CC(C2)CC1C3	ZINC000412002384	268181456	/nfs/dbraw/zinc/18/14/56/268181456.db2.gz	KUMFUIUVJLWIMI-UHFFFAOYSA-N	0	3	330.859	3.488	20	30		EGEDHN
N#Cc1ccc([C@H](NC[C@@H]2CCC[C@H](C(F)(F)F)C2)C(N)=O)cc1	ZINC000437155646	268263780	/nfs/dbraw/zinc/26/37/80/268263780.db2.gz	PWTYYXNGTAUFNU-SNPRPXQTSA-N	0	3	339.361	3.043	20	30		EGEDHN
N#Cc1ccc([C@H](NC[C@H]2CCC[C@@H](C(F)(F)F)C2)C(N)=O)cc1	ZINC000437155642	268263943	/nfs/dbraw/zinc/26/39/43/268263943.db2.gz	PWTYYXNGTAUFNU-CFVMTHIKSA-N	0	3	339.361	3.043	20	30		EGEDHN
N#Cc1cccc(OC2CCN([C@H]3Cc4ccccc4[C@@H]3O)CC2)c1	ZINC000272038269	268270932	/nfs/dbraw/zinc/27/09/32/268270932.db2.gz	XQNDPEYQWGUKIB-SFTDATJTSA-N	0	3	334.419	3.060	20	30		EGEDHN
N#Cc1ccccc1OCCN1CCC([C@H](O)c2ccccc2)CC1	ZINC000299107763	268282539	/nfs/dbraw/zinc/28/25/39/268282539.db2.gz	YAMIQWOHGHRXBR-OAQYLSRUSA-N	0	3	336.435	3.383	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CN[C@@H]1CCCc2ccc(F)cc21	ZINC000530233830	268297548	/nfs/dbraw/zinc/29/75/48/268297548.db2.gz	IIMFYPJABZGRRS-PKOBYXMFSA-N	0	3	340.398	3.104	20	30		EGEDHN
N#Cc1cnn2cc(CN3CC[C@@H](CSc4ccccc4)C3)cnc12	ZINC000517373245	268318210	/nfs/dbraw/zinc/31/82/10/268318210.db2.gz	OVXCADDUNUVZEZ-OAHLLOKOSA-N	0	3	349.463	3.215	20	30		EGEDHN
CO[C@H](CN1CCCN(c2ccccc2C#N)CC1)c1ccccc1	ZINC000338547467	274077138	/nfs/dbraw/zinc/07/71/38/274077138.db2.gz	ONQIWXBLRAIZOL-OAQYLSRUSA-N	0	3	335.451	3.458	20	30		EGEDHN
C[C@H](CNC(=O)Nc1ccc(F)c(C#N)c1)N(C)Cc1ccccc1	ZINC000111756594	275185040	/nfs/dbraw/zinc/18/50/40/275185040.db2.gz	GVYHCCAWNULEKJ-CQSZACIVSA-N	0	3	340.402	3.339	20	30		EGEDHN
CCN(CCNC(=O)c1sc2ccc(C#N)cc2c1C)C1CC1	ZINC000339885664	276130701	/nfs/dbraw/zinc/13/07/01/276130701.db2.gz	YOZFIWFLGNBLDD-UHFFFAOYSA-N	0	3	327.453	3.296	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N[C@H]1CCOC2(CCC2)C1)C(C)C	ZINC000269183489	277848684	/nfs/dbraw/zinc/84/86/84/277848684.db2.gz	CENJJNCVCKBPKN-ROUUACIJSA-N	0	3	349.519	3.086	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)Nc1cccc(F)c1	ZINC000062369071	307353434	/nfs/dbraw/zinc/35/34/34/307353434.db2.gz	BWTPANABKRAYGT-UHFFFAOYSA-N	0	3	340.402	3.293	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)c1ccc(Cl)o1	ZINC000065930739	307360783	/nfs/dbraw/zinc/36/07/83/307360783.db2.gz	BWDSLUBYCWJMGX-UHFFFAOYSA-N	0	3	331.803	3.009	20	30		EGEDHN
C[C@@H](N[C@H]1CCN(c2ncccc2F)C1)c1ccc(C#N)c(F)c1	ZINC000537406288	314179197	/nfs/dbraw/zinc/17/91/97/314179197.db2.gz	CLFZSJGAVNFYNN-DOMZBBRYSA-N	0	3	328.366	3.161	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCN2CCC=C(c3ccccn3)C2)cc1	ZINC000564035444	316104044	/nfs/dbraw/zinc/10/40/44/316104044.db2.gz	NAHRYASMMYFMRG-UHFFFAOYSA-N	0	3	332.407	3.071	20	30		EGEDHN
CS[C@H]1CN(c2c(C#N)cnc3c(Cl)cccc32)C[C@H]1N(C)C	ZINC000567749115	316668966	/nfs/dbraw/zinc/66/89/66/316668966.db2.gz	UTEIFRUBQJSQBE-CABCVRRESA-N	0	3	346.887	3.242	20	30		EGEDHN
C[C@@H](O)CN(Cc1ccc(C#N)cn1)[C@@H](C)Cc1ccc(Cl)cc1	ZINC000570104132	317008228	/nfs/dbraw/zinc/00/82/28/317008228.db2.gz	GFMSIGKPFWEMEM-LSDHHAIUSA-N	0	3	343.858	3.421	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](O)CO[C@@H]2CCCc3ccccc32)s1	ZINC000570564027	317074049	/nfs/dbraw/zinc/07/40/49/317074049.db2.gz	FJBLZMHGFIPYGK-HNAYVOBHSA-N	0	3	342.464	3.164	20	30		EGEDHN
C[C@H](N[C@@H]1CCC[C@H](N2CCCC2=O)C1)c1ccc(C#N)cc1F	ZINC000572497855	317348183	/nfs/dbraw/zinc/34/81/83/317348183.db2.gz	ACCMWXYHJCEJKI-IMJJTQAJSA-N	0	3	329.419	3.282	20	30		EGEDHN
CC(C)(NC[C@H](O)COc1ccc(C#N)cc1)c1cccc(Cl)c1	ZINC000179605905	323396024	/nfs/dbraw/zinc/39/60/24/323396024.db2.gz	BAYBDNJNLCEVRL-KRWDZBQOSA-N	0	3	344.842	3.476	20	30		EGEDHN
N#Cc1cc(Br)ccc1CN(CCO)C1CCCCC1	ZINC000312251157	456592896	/nfs/dbraw/zinc/59/28/96/456592896.db2.gz	FNHJUSSLRRCQPH-UHFFFAOYSA-N	0	3	337.261	3.448	20	30		EGEDHN
CCSc1cccc(CNC[C@H](O)COc2ccc(C#N)cc2)c1	ZINC000579113697	325064938	/nfs/dbraw/zinc/06/49/38/325064938.db2.gz	WJNPUIOGWBDQJZ-KRWDZBQOSA-N	0	3	342.464	3.200	20	30		EGEDHN
COC[C@]1(CN[C@H]2CCc3ccc(C#N)cc32)OCCc2ccccc21	ZINC000581696490	325383144	/nfs/dbraw/zinc/38/31/44/325383144.db2.gz	MZPPMJRIZRILKK-VXKWHMMOSA-N	0	3	348.446	3.250	20	30		EGEDHN
N#Cc1cnn2cc(CNCCc3c(Cl)cccc3Cl)cnc12	ZINC000583277721	325510644	/nfs/dbraw/zinc/51/06/44/325510644.db2.gz	IUWRIJYEUPTVAO-UHFFFAOYSA-N	0	3	346.221	3.240	20	30		EGEDHN
CC(C#N)C(=O)NC1CCN(Cc2cc(Cl)cc(Cl)c2)CC1	ZINC000345117385	456931438	/nfs/dbraw/zinc/93/14/38/456931438.db2.gz	DIGXUOUOQIHJPJ-LLVKDONJSA-N	0	3	340.254	3.234	20	30		EGEDHN
Cc1cc(CN(C)C(=O)C(C)C#N)cc(C)c1OCC(F)(F)F	ZINC000347066511	457212550	/nfs/dbraw/zinc/21/25/50/457212550.db2.gz	JXRWKTDIWWWRDC-LBPRGKRZSA-N	0	3	328.334	3.363	20	30		EGEDHN
CCCCO[C@@H]1C[C@H](N[C@@H](C)C(=O)N[C@](C)(C#N)C(C)C)C1(C)C	ZINC000450964110	458461024	/nfs/dbraw/zinc/46/10/24/458461024.db2.gz	BRPDEEJXWDJELB-YIOZNXECSA-N	0	3	337.508	3.003	20	30		EGEDHN
C=CCOc1ccc(CNC[C@](C)(O)c2ccc(F)cc2)cc1OC	ZINC000157820239	455236487	/nfs/dbraw/zinc/23/64/87/455236487.db2.gz	IMBLNSWKGLENGF-FQEVSTJZSA-N	0	3	345.414	3.396	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC[C@H](c3ccccc3)[C@@H](C)C2)CC1	ZINC000173199146	455246068	/nfs/dbraw/zinc/24/60/68/455246068.db2.gz	FEAIJVUGASOOSD-PXNSSMCTSA-N	0	3	341.499	3.472	20	30		EGEDHN
CC(C)Cc1ccc([C@@H](C)NCCNC(=O)C2N=CC=CC2=O)cc1	ZINC000180866242	455258677	/nfs/dbraw/zinc/25/86/77/455258677.db2.gz	OWJRXDIIXKFAQG-MVZUJROASA-N	0	3	341.455	3.062	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CNC[C@@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000181085108	455285441	/nfs/dbraw/zinc/28/54/41/455285441.db2.gz	UKBJLUOFJPPJMB-QKJKXLBDSA-N	0	3	344.455	3.389	20	30		EGEDHN
CSc1cc(C)ccc1CNC[C@@H](O)COc1ccccc1C#N	ZINC000600728796	460581705	/nfs/dbraw/zinc/58/17/05/460581705.db2.gz	BQFKWVUPKUUSFY-QGZVFWFLSA-N	0	3	342.464	3.118	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCN2CC=C(c3ccc(O)cc3)CC2)cc1	ZINC000012821159	453411452	/nfs/dbraw/zinc/41/14/52/453411452.db2.gz	SXWZFINQIUBWBO-UHFFFAOYSA-N	0	3	347.418	3.382	20	30		EGEDHN
C=CCOc1c(Cl)cc(CNCCc2nccnc2C)cc1OC	ZINC000623533632	460600276	/nfs/dbraw/zinc/60/02/76/460600276.db2.gz	JGBUOTVUIJGXAX-UHFFFAOYSA-N	0	3	347.846	3.344	20	30		EGEDHN
C[C@H](c1ccc(F)cc1)N(C)C[C@@H](O)COc1ccc(CC#N)cc1	ZINC000025302301	453764733	/nfs/dbraw/zinc/76/47/33/453764733.db2.gz	SOEWMZBSQXOARZ-DNVCBOLYSA-N	0	3	342.414	3.324	20	30		EGEDHN
C[C@@H](c1ccc(-n2cncn2)cc1)N(C)CCOc1ccc(C#N)cc1	ZINC000026299082	453796017	/nfs/dbraw/zinc/79/60/17/453796017.db2.gz	GVJJOFFYDIXSIK-INIZCTEOSA-N	0	3	347.422	3.211	20	30		EGEDHN
N#Cc1ccc(NC(=O)NC2CCN(CCc3ccccc3)CC2)cc1	ZINC000031090034	453838115	/nfs/dbraw/zinc/83/81/15/453838115.db2.gz	BMXYMUOAZPGDOI-UHFFFAOYSA-N	0	3	348.450	3.387	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@@H](C)N2CCCC[C@@H]2C)cc1OC	ZINC000032734294	453886585	/nfs/dbraw/zinc/88/65/85/453886585.db2.gz	AXVGANKSELAAAK-JKSUJKDBSA-N	0	3	346.471	3.253	20	30		EGEDHN
N#Cc1ccc(N2CCN(c3ccncc3)CC2)cc1C(F)(F)F	ZINC000067347745	453923552	/nfs/dbraw/zinc/92/35/52/453923552.db2.gz	ICLROASWCPSUEC-UHFFFAOYSA-N	0	3	332.329	3.299	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccc(C#N)cc1	ZINC000076389097	453995454	/nfs/dbraw/zinc/99/54/54/453995454.db2.gz	RPRGZKUZYDGFLN-KRWDZBQOSA-N	0	3	333.435	3.295	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CCCN(Cc2ccccc2)C[C@H]1C	ZINC000076389279	453995694	/nfs/dbraw/zinc/99/56/94/453995694.db2.gz	RVQRBZOWZZDAHD-QZTJIDSGSA-N	0	3	330.472	3.091	20	30		EGEDHN
CN(CCCOc1ccc([N+](=O)[O-])cc1)Cc1ccc(C#N)cc1	ZINC000055901820	454024057	/nfs/dbraw/zinc/02/40/57/454024057.db2.gz	NXHZNMJDNGCKLW-UHFFFAOYSA-N	0	3	325.368	3.367	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@H](NCc3cccc(O)c3)C2)c(F)c1	ZINC000068991271	454071041	/nfs/dbraw/zinc/07/10/41/454071041.db2.gz	BNESWTZDDJZVHM-INIZCTEOSA-N	0	3	325.387	3.162	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1c2ccc(C)cc2[C@@H]2CN(C)CC[C@@H]21	ZINC000069335602	454095967	/nfs/dbraw/zinc/09/59/67/454095967.db2.gz	QDZMAONZQTYNNO-AYBZRNKSSA-N	0	3	328.456	3.111	20	30		EGEDHN
C[C@H]1CN(Cc2ccc(C#N)cc2)CC[C@@H]1NC(=O)OC(C)(C)C	ZINC000265884946	455399635	/nfs/dbraw/zinc/39/96/35/455399635.db2.gz	ZVFXLQWSSKPAIE-YOEHRIQHSA-N	0	3	329.444	3.293	20	30		EGEDHN
N#CC1(C(=O)NC[C@H](c2ccccc2)N2CCCC2)CCCCC1	ZINC000057383323	454123977	/nfs/dbraw/zinc/12/39/77/454123977.db2.gz	JREAFFDDODORNZ-GOSISDBHSA-N	0	3	325.456	3.414	20	30		EGEDHN
Cc1ccc(N2CC[C@@H](N[C@@H](C)c3ccc(OCC#N)cc3)C2=O)cc1	ZINC000095404407	454204050	/nfs/dbraw/zinc/20/40/50/454204050.db2.gz	BSPIDVVDIRSPGK-OXJNMPFZSA-N	0	3	349.434	3.354	20	30		EGEDHN
C[C@H](N[C@@H]1CC(C)(C)OC1(C)C)C(=O)N(C)C1(C#N)CCC(C)CC1	ZINC000119693156	454213411	/nfs/dbraw/zinc/21/34/11/454213411.db2.gz	IUZUCHBEMWILJW-QNBXZPKWSA-N	0	3	349.519	3.241	20	30		EGEDHN
C[C@@H]1CN(CC2CCN(Cc3ccc(F)c(C#N)c3)CC2)C[C@H](C)O1	ZINC000119795406	454220904	/nfs/dbraw/zinc/22/09/04/454220904.db2.gz	MVDPYRMTEOCRMS-IYBDPMFKSA-N	0	3	345.462	3.019	20	30		EGEDHN
CCOC(=O)N(C)C1CCN(Cc2ccc(O[C@H](C)C#N)cc2)CC1	ZINC000130842927	454221053	/nfs/dbraw/zinc/22/10/53/454221053.db2.gz	PVOMHDPNERBBED-OAHLLOKOSA-N	0	3	345.443	3.030	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2ccc(C)cc2OCC)CC1	ZINC000119952043	454239955	/nfs/dbraw/zinc/23/99/55/454239955.db2.gz	SJDDWCCIIBYOAY-UHFFFAOYSA-N	0	3	345.487	3.233	20	30		EGEDHN
CCOC(=O)COc1ccc(CN(C)Cc2ccc(C#N)cc2)cc1	ZINC000131194500	454240930	/nfs/dbraw/zinc/24/09/30/454240930.db2.gz	DLWFJJXSNZHSKL-UHFFFAOYSA-N	0	3	338.407	3.132	20	30		EGEDHN
Cn1ccnc1C[C@H]1CCCN(CC#Cc2ccc(Cl)cc2)C1	ZINC000090003635	454260446	/nfs/dbraw/zinc/26/04/46/454260446.db2.gz	LXABKEJTNMFNMV-QGZVFWFLSA-N	0	3	327.859	3.380	20	30		EGEDHN
C[C@@H](CN1CCOCC1)N(CCC(C)(C)C#N)Cc1ccccc1	ZINC000131546507	454263699	/nfs/dbraw/zinc/26/36/99/454263699.db2.gz	ZYEKUCMPDSFFSX-SFHVURJKSA-N	0	3	329.488	3.149	20	30		EGEDHN
CCc1ccc([C@H](C)NC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000120230244	454274346	/nfs/dbraw/zinc/27/43/46/454274346.db2.gz	NTPUKCAYVDYHGL-OXJNMPFZSA-N	0	3	338.451	3.406	20	30		EGEDHN
CN(C)CCOc1ccc(NC(=O)CCc2ccc(C#N)cc2)cc1	ZINC000046723847	454277421	/nfs/dbraw/zinc/27/74/21/454277421.db2.gz	LSWOHMOKGRNLEQ-UHFFFAOYSA-N	0	3	337.423	3.070	20	30		EGEDHN
CN(CCC#N)C(=O)CCN1CCCC[C@@H]1c1cc2ccccc2[nH]1	ZINC000131865140	454293171	/nfs/dbraw/zinc/29/31/71/454293171.db2.gz	YLHRRSBHRDIISB-LJQANCHMSA-N	0	3	338.455	3.457	20	30		EGEDHN
N#CCCCOc1cccc(CN[C@H]2CCN(c3ccccn3)C2)c1	ZINC000120581305	454322379	/nfs/dbraw/zinc/32/23/79/454322379.db2.gz	UHQCAVXOPGMWLG-SFHVURJKSA-N	0	3	336.439	3.133	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCc3ccc(Cl)cc3C2)CC1	ZINC000090561527	454322479	/nfs/dbraw/zinc/32/24/79/454322479.db2.gz	SOZRUYIEFTVBRN-UHFFFAOYSA-N	0	3	347.890	3.448	20	30		EGEDHN
Cc1ccc(NC(=O)Cc2ccc(OCC#N)cc2)c(CN(C)C)c1	ZINC000072839507	454349081	/nfs/dbraw/zinc/34/90/81/454349081.db2.gz	FYHVKOUVRSBMGC-UHFFFAOYSA-N	0	3	337.423	3.140	20	30		EGEDHN
N#CC(C(=O)c1cccc(NC(N)=O)c1)c1ccc(C(F)(F)F)cn1	ZINC000047371492	454364474	/nfs/dbraw/zinc/36/44/74/454364474.db2.gz	BJAONPFOWFBYIO-LBPRGKRZSA-N	0	3	348.284	3.081	20	30		EGEDHN
C[C@H](CO)SCC(=O)C(C#N)c1nc(-c2ccccc2)cs1	ZINC000079099168	454368260	/nfs/dbraw/zinc/36/82/60/454368260.db2.gz	PVAFUALCZPMCLA-YPMHNXCESA-N	0	3	332.450	3.100	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CNC1(c2cccc(C)c2)CCCC1	ZINC000072962961	454372510	/nfs/dbraw/zinc/37/25/10/454372510.db2.gz	SBHSDHYABKWQCX-QGZVFWFLSA-N	0	3	327.472	3.362	20	30		EGEDHN
N#Cc1ccccc1NC(=O)CCN1CCC(OC2CCCC2)CC1	ZINC000121123883	454395283	/nfs/dbraw/zinc/39/52/83/454395283.db2.gz	OGNACNLFOUFDDI-UHFFFAOYSA-N	0	3	341.455	3.310	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccc(C#N)cc1	ZINC000047671755	454397750	/nfs/dbraw/zinc/39/77/50/454397750.db2.gz	YSRVAEUNGQMQLM-UHFFFAOYSA-N	0	3	347.422	3.026	20	30		EGEDHN
C=CCNC(=O)CNC(Cc1ccccc1F)Cc1ccccc1F	ZINC000133319538	454412574	/nfs/dbraw/zinc/41/25/74/454412574.db2.gz	WSEDYNMOPZWTIA-UHFFFAOYSA-N	0	3	344.405	3.010	20	30		EGEDHN
Cc1ccc([C@H](C)N(C)C[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000047964681	454424841	/nfs/dbraw/zinc/42/48/41/454424841.db2.gz	JCHQSKIBSKNAHB-PXNSSMCTSA-N	0	3	338.451	3.494	20	30		EGEDHN
CN(C)Cc1cccc(C(=O)N[C@@H](C#N)c2ccc(Cl)cc2)c1	ZINC000073455069	454437254	/nfs/dbraw/zinc/43/72/54/454437254.db2.gz	BEHZQCTZSPXPCS-KRWDZBQOSA-N	0	3	327.815	3.396	20	30		EGEDHN
COCCN(CCC(=O)Nc1ccccc1)Cc1ccc(C#N)cc1	ZINC000063753988	454444624	/nfs/dbraw/zinc/44/46/24/454444624.db2.gz	RWSUAMONZNGKCO-UHFFFAOYSA-N	0	3	337.423	3.035	20	30		EGEDHN
C#CCCCCNC(=O)NC1CCN([C@H](C)c2ccccc2)CC1	ZINC000133691123	454456911	/nfs/dbraw/zinc/45/69/11/454456911.db2.gz	SLGUYTQFEDZBLO-QGZVFWFLSA-N	0	3	327.472	3.315	20	30		EGEDHN
C#CCCOc1ccc(CN2CCC[C@H](c3nc(C)no3)C2)cc1	ZINC000091832899	454478139	/nfs/dbraw/zinc/47/81/39/454478139.db2.gz	RKYDORHUKLKRCN-KRWDZBQOSA-N	0	3	325.412	3.160	20	30		EGEDHN
COc1ccc([C@H](NCC(=O)N[C@@](C)(C#N)C(C)C)C(C)C)cc1	ZINC000102693299	454516349	/nfs/dbraw/zinc/51/63/49/454516349.db2.gz	OEFBKMBTNHYQIF-MOPGFXCFSA-N	0	3	331.460	3.036	20	30		EGEDHN
CCCCN(CCCO)[C@H](C)C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000182154997	455449174	/nfs/dbraw/zinc/44/91/74/455449174.db2.gz	KCCUDEMZORSHBF-CYBMUJFWSA-N	0	3	337.851	3.023	20	30		EGEDHN
C#CCNC(=O)[C@@H](C)N[C@H](Cc1ccccc1)c1sccc1C	ZINC000122766939	454567410	/nfs/dbraw/zinc/56/74/10/454567410.db2.gz	KKGZHEBELTULGO-NVXWUHKLSA-N	0	3	326.465	3.068	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)OC(C)(C)C)CCN1CCCSCC#N	ZINC000134646816	454573936	/nfs/dbraw/zinc/57/39/36/454573936.db2.gz	SEDRHOPGNYLGKS-ZIAGYGMSSA-N	0	3	327.494	3.011	20	30		EGEDHN
N#CC(C(=O)C=Cc1ccc(Cl)cc1)C(=O)Nc1ccccn1	ZINC000104130213	454574739	/nfs/dbraw/zinc/57/47/39/454574739.db2.gz	AXRVNIRPJJZWDQ-PIZKADEWSA-N	0	3	325.755	3.096	20	30		EGEDHN
CC(C)c1csc(C(C#N)C(=O)c2ccc3c(c2)NC(=O)CO3)n1	ZINC000080455205	454583408	/nfs/dbraw/zinc/58/34/08/454583408.db2.gz	OPEINAAMRHXTOH-NSHDSACASA-N	0	3	341.392	3.087	20	30		EGEDHN
C=CCSCCN[C@H](c1ccc(Cl)cc1)[C@H]1CN(C)CCO1	ZINC000134767606	454586338	/nfs/dbraw/zinc/58/63/38/454586338.db2.gz	FQQLHFMIMJNJKX-IAGOWNOFSA-N	0	3	340.920	3.221	20	30		EGEDHN
COc1cccc(CN(CCCSCC#N)C[C@H]2CCCO2)c1	ZINC000080632800	454609935	/nfs/dbraw/zinc/60/99/35/454609935.db2.gz	MBOUETJLLALRDE-GOSISDBHSA-N	0	3	334.485	3.323	20	30		EGEDHN
Cc1cc2ncn(C[C@H](O)CN(C)Cc3ccc(C#N)cc3)c2cc1C	ZINC000051322711	454618671	/nfs/dbraw/zinc/61/86/71/454618671.db2.gz	WACOLGKHYAEFKJ-LJQANCHMSA-N	0	3	348.450	3.018	20	30		EGEDHN
COc1ccc(CN(CCCO)[C@@H]2CCc3ccccc32)cc1C#N	ZINC000135128314	454636902	/nfs/dbraw/zinc/63/69/02/454636902.db2.gz	NRAMFLHGGADXNB-HXUWFJFHSA-N	0	3	336.435	3.439	20	30		EGEDHN
C=C(C)COc1cc(CNC[C@@H](O)Cc2ccccc2)ccc1OC	ZINC000105493118	454640392	/nfs/dbraw/zinc/64/03/92/454640392.db2.gz	TZPTVSPBAADTEC-IBGZPJMESA-N	0	3	341.451	3.343	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)CCc1ccsc1	ZINC000065931133	454641351	/nfs/dbraw/zinc/64/13/51/454641351.db2.gz	BKWNYUVJKQHSIT-UHFFFAOYSA-N	0	3	341.480	3.143	20	30		EGEDHN
CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1ccc(C#N)cc1	ZINC000065938176	454642630	/nfs/dbraw/zinc/64/26/30/454642630.db2.gz	SCEHJOSQHDVQAF-UHFFFAOYSA-N	0	3	343.377	3.040	20	30		EGEDHN
C=CCN(CCc1ccccc1)C[C@H](O)COc1ccc(C#N)cc1	ZINC000065959642	454644863	/nfs/dbraw/zinc/64/48/63/454644863.db2.gz	CBIXLNSEBXXUGI-FQEVSTJZSA-N	0	3	336.435	3.029	20	30		EGEDHN
N#Cc1ccsc1C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000052029880	454649201	/nfs/dbraw/zinc/64/92/01/454649201.db2.gz	LQQOTSCSCGNYJA-UHFFFAOYSA-N	0	3	325.437	3.014	20	30		EGEDHN
N#Cc1ccsc1C(=O)NCC1CCN(Cc2cccs2)CC1	ZINC000052050658	454652245	/nfs/dbraw/zinc/65/22/45/454652245.db2.gz	XWRIZUWOPKPAMA-UHFFFAOYSA-N	0	3	345.493	3.323	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCCOc2ccccc2F)CC1	ZINC000106034907	454674783	/nfs/dbraw/zinc/67/47/83/454674783.db2.gz	WFGCHPPSGPFSCL-UHFFFAOYSA-N	0	3	334.435	3.141	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)COc2ccc(F)cc2Cl)CC1	ZINC000106039090	454675981	/nfs/dbraw/zinc/67/59/81/454675981.db2.gz	KOYYMXUOFYPMAS-UHFFFAOYSA-N	0	3	340.826	3.015	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CC[C@H](c3ccccc3)C2)CC1	ZINC000106275745	454689515	/nfs/dbraw/zinc/68/95/15/454689515.db2.gz	OCHCLAOLYRWTJA-SFHVURJKSA-N	0	3	327.472	3.226	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H]2CCc3c2cccc3C)CC1	ZINC000106275370	454689598	/nfs/dbraw/zinc/68/95/98/454689598.db2.gz	RMSZIPVIQNGCHF-IBGZPJMESA-N	0	3	327.472	3.322	20	30		EGEDHN
CC[C@@]1(NCC(=O)Nc2ccccc2S[C@H](C)CC#N)CCOC1	ZINC000616865342	460649024	/nfs/dbraw/zinc/64/90/24/460649024.db2.gz	LGKZWHLUBCWUIT-RDTXWAMCSA-N	0	3	347.484	3.178	20	30		EGEDHN
C=CCc1cc(CN2CCC(CCC(=O)OC)CC2)cc(OC)c1O	ZINC000093341487	454703983	/nfs/dbraw/zinc/70/39/83/454703983.db2.gz	LIILUPXTTSMBHD-UHFFFAOYSA-N	0	3	347.455	3.295	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](c2ncc(C)s2)C2CC2)CC1	ZINC000176501219	454752533	/nfs/dbraw/zinc/75/25/33/454752533.db2.gz	RYLRBRVUPZAWIW-MRXNPFEDSA-N	0	3	348.516	3.242	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2C[C@H](C)[C@@H]2c2ccccc2)CC1	ZINC000176498540	454752798	/nfs/dbraw/zinc/75/27/98/454752798.db2.gz	WAQZAUZOJXQMLT-QFBILLFUSA-N	0	3	327.472	3.430	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN2CCC[C@@H]2C(C)C)cc1	ZINC000140495251	454821805	/nfs/dbraw/zinc/82/18/05/454821805.db2.gz	IVGIFWRRCRZHQI-LJQANCHMSA-N	0	3	343.471	3.452	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)NCc2ccc(C#N)cc2)CN1Cc1ccccc1	ZINC000177210969	454837368	/nfs/dbraw/zinc/83/73/68/454837368.db2.gz	SZQDZNXGYWQDFV-JXFKEZNVSA-N	0	3	348.450	3.020	20	30		EGEDHN
C=CCc1ccc(OC[C@@H](O)CN2CCC(C=C)CC2)c(OC)c1	ZINC000111256308	454858632	/nfs/dbraw/zinc/85/86/32/454858632.db2.gz	FQADYVRDHRBVPC-SFHVURJKSA-N	0	3	331.456	3.061	20	30		EGEDHN
C=CC1CCN([C@@H](C)C(=O)N[C@H](C)c2cc(OC)ccc2OC)CC1	ZINC000111258569	454859863	/nfs/dbraw/zinc/85/98/63/454859863.db2.gz	XECMKAYFBDLKIZ-CABCVRRESA-N	0	3	346.471	3.168	20	30		EGEDHN
C=CC1CCN([C@H](C)C(=O)NCCc2c[nH]c3ccccc23)CC1	ZINC000111259544	454860309	/nfs/dbraw/zinc/86/03/09/454860309.db2.gz	ZGADBDYHLKOKEO-OAHLLOKOSA-N	0	3	325.456	3.113	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCCC[C@@H](SCC)C2)CC1	ZINC000112138308	454881200	/nfs/dbraw/zinc/88/12/00/454881200.db2.gz	DQERFPVLMSJGNE-QGZVFWFLSA-N	0	3	339.549	3.344	20	30		EGEDHN
CC[C@H](NCC(=O)N(CCC#N)c1cccc(Cl)c1)[C@@H]1CCCO1	ZINC000182325770	455489298	/nfs/dbraw/zinc/48/92/98/455489298.db2.gz	MSDOYAONBWRXBV-IRXDYDNUSA-N	0	3	349.862	3.134	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@H](CC)[C@@H]1CCCO1	ZINC000182326506	455490004	/nfs/dbraw/zinc/49/00/04/455490004.db2.gz	BFQIINGAUNUXRY-ZBFHGGJFSA-N	0	3	334.485	3.450	20	30		EGEDHN
C=CC[C@@H](C)[C@@H](C)NCc1ccccc1S(=O)(=O)NC(C)(C)C	ZINC000155099074	454963330	/nfs/dbraw/zinc/96/33/30/454963330.db2.gz	IGBHTJNIJXQKHT-HUUCEWRRSA-N	0	3	338.517	3.454	20	30		EGEDHN
CC[C@H](CC#N)NC(=O)Nc1ccc(CCN2CCSCC2)cc1	ZINC000155931201	455063730	/nfs/dbraw/zinc/06/37/30/455063730.db2.gz	RFKDGRFUJQJKQN-MRXNPFEDSA-N	0	3	346.500	3.092	20	30		EGEDHN
C[C@@H](C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1)c1ccsc1	ZINC000152091587	455071371	/nfs/dbraw/zinc/07/13/71/455071371.db2.gz	QKCRTQXDERQTRH-OAHLLOKOSA-N	0	3	341.480	3.314	20	30		EGEDHN
N#CC(C(=O)c1cccc(C(F)F)c1)c1nnc2n1CCCCC2	ZINC000171567542	455078410	/nfs/dbraw/zinc/07/84/10/455078410.db2.gz	GYQZEZYLIHKYRN-CYBMUJFWSA-N	0	3	330.338	3.432	20	30		EGEDHN
C=CCOc1cccc(CN2CCC(CN3CCCCC3=O)CC2)c1	ZINC000128777412	455082757	/nfs/dbraw/zinc/08/27/57/455082757.db2.gz	WFEVHOYVWGVQPH-UHFFFAOYSA-N	0	3	342.483	3.476	20	30		EGEDHN
CC[C@H](C)CN(C)CC(=O)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000171949230	455103478	/nfs/dbraw/zinc/10/34/78/455103478.db2.gz	SJHIUBSAAUXRDQ-AWEZNQCLSA-N	0	3	340.389	3.151	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccccc2OC2CCC2)CC1	ZINC000118334480	455103866	/nfs/dbraw/zinc/10/38/66/455103866.db2.gz	CFGQSHDZRSYCIP-UHFFFAOYSA-N	0	3	328.456	3.388	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCC(C)(C)c2cccc(F)c2)CC1	ZINC000118481757	455106285	/nfs/dbraw/zinc/10/62/85/455106285.db2.gz	KKJDRKDEWILKFW-UHFFFAOYSA-N	0	3	347.478	3.443	20	30		EGEDHN
CC[C@@H](NCC(=O)N(CC)C[C@H](C)C#N)C(C)(C)c1ccccc1	ZINC000180008335	455114681	/nfs/dbraw/zinc/11/46/81/455114681.db2.gz	BIEOAUYTNJTDPB-SJLPKXTDSA-N	0	3	329.488	3.341	20	30		EGEDHN
C=CCNC(=O)CN[C@@H](C)[C@@H](C)Oc1ccc(Cl)cc1Cl	ZINC000180028982	455118893	/nfs/dbraw/zinc/11/88/93/455118893.db2.gz	RGJSCGLKNBTTLQ-WDEREUQCSA-N	0	3	331.243	3.041	20	30		EGEDHN
CN(C)CCN(C(=O)Nc1cc(C#N)cn1C(C)(C)C)C1CCCC1	ZINC000172118808	455124750	/nfs/dbraw/zinc/12/47/50/455124750.db2.gz	RAOAGQYYPBEMGG-UHFFFAOYSA-N	0	3	345.491	3.453	20	30		EGEDHN
C[C@H](c1ccccc1)N1CCC(NC(=O)NCCCCC#N)CC1	ZINC000172123480	455125505	/nfs/dbraw/zinc/12/55/05/455125505.db2.gz	OFOLJPZCJKIHMO-MRXNPFEDSA-N	0	3	328.460	3.205	20	30		EGEDHN
CC1CCC(N2CCN(C(=O)c3cccc(CC#N)c3)CC2)CC1	ZINC000172156527	455129650	/nfs/dbraw/zinc/12/96/50/455129650.db2.gz	VOOJYXVDLMZDAN-UHFFFAOYSA-N	0	3	325.456	3.089	20	30		EGEDHN
C[C@@H]1CSCCN1CCC(=O)Nc1sc2c(c1C#N)CCCC2	ZINC000172596060	455164090	/nfs/dbraw/zinc/16/40/90/455164090.db2.gz	FXFGXQFXVUYQCP-GFCCVEGCSA-N	0	3	349.525	3.264	20	30		EGEDHN
C[C@H](CC(=O)Nc1cccc(F)c1)NCc1ccc(OCC#N)cc1	ZINC000180552938	455195719	/nfs/dbraw/zinc/19/57/19/455195719.db2.gz	VSEIWFLDRHRZKU-CQSZACIVSA-N	0	3	341.386	3.235	20	30		EGEDHN
N#Cc1cc(F)ccc1CN1CCC(CCCN2CCOCC2)CC1	ZINC000182961646	455200069	/nfs/dbraw/zinc/20/00/69/455200069.db2.gz	ZHVBVLSDJMRBKX-UHFFFAOYSA-N	0	3	345.462	3.022	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](C)c2cccc(OCC)c2)CC1	ZINC000264373532	455200358	/nfs/dbraw/zinc/20/03/58/455200358.db2.gz	JNBCVMIJMOELCL-MRXNPFEDSA-N	0	3	345.487	3.486	20	30		EGEDHN
CC(C)(CNC(=O)c1ccccc1CC#N)N1CCc2ccccc2C1	ZINC000600992250	460667583	/nfs/dbraw/zinc/66/75/83/460667583.db2.gz	VEFLSXZABGOYIU-UHFFFAOYSA-N	0	3	347.462	3.319	20	30		EGEDHN
CCN1CCCC[C@@H]1CNC(=O)N[C@H](CCC#N)c1ccccc1	ZINC000245955828	455407146	/nfs/dbraw/zinc/40/71/46/455407146.db2.gz	QOKANUOJMHMZIJ-QZTJIDSGSA-N	0	3	328.460	3.205	20	30		EGEDHN
CN1CC[C@@H]2[C@H](CCCN2C(=O)N[C@H](CCC#N)c2ccccc2)C1	ZINC000246005672	455412631	/nfs/dbraw/zinc/41/26/31/455412631.db2.gz	SIZJSKBQYUGZPM-GUDVDZBRSA-N	0	3	340.471	3.157	20	30		EGEDHN
C=CCNC(=O)Nc1ccc(NC(=O)[C@H](C)N2CCCCCC2)cc1	ZINC000175204823	455425789	/nfs/dbraw/zinc/42/57/89/455425789.db2.gz	LUFCGNGDHOXTJP-HNNXBMFYSA-N	0	3	344.459	3.197	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC[C@H](c3ccccc3)[C@H]2C)CC1	ZINC000175439478	455448973	/nfs/dbraw/zinc/44/89/73/455448973.db2.gz	VTGCREMQYDCTSF-APWZRJJASA-N	0	3	327.472	3.224	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccccc2CC#N)C1	ZINC000601009779	460673566	/nfs/dbraw/zinc/67/35/66/460673566.db2.gz	IMDKANYNDFOZLH-LPHOPBHVSA-N	0	3	333.435	3.318	20	30		EGEDHN
C=CCCC[C@H](C)N[C@H](C(N)=O)c1cccc(Br)c1	ZINC000182343781	455493609	/nfs/dbraw/zinc/49/36/09/455493609.db2.gz	ZJTHRUOFZRWSRG-FZMZJTMJSA-N	0	3	325.250	3.310	20	30		EGEDHN
C[C@](C#N)(NC(=O)CN1CCC[C@H]1CCCc1ccccc1)C1CC1	ZINC000246560187	455507537	/nfs/dbraw/zinc/50/75/37/455507537.db2.gz	BJLFWSOFGLLQDT-TZIWHRDSSA-N	0	3	339.483	3.282	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN[C@@H]1CCO[C@H]1c1ccccc1	ZINC000191975635	455537534	/nfs/dbraw/zinc/53/75/34/455537534.db2.gz	POYICOACFMTMMP-XLIONFOSSA-N	0	3	338.407	3.065	20	30		EGEDHN
CC[C@H](N[C@H]1CCC[C@H](C#N)C1)c1ccccc1OCC(=O)N(C)C	ZINC000185786631	455621746	/nfs/dbraw/zinc/62/17/46/455621746.db2.gz	MFJJIZMBPXFHSU-BQFCYCMXSA-N	0	3	343.471	3.277	20	30		EGEDHN
N#Cc1ccccc1OCCN1CCC[C@H]1C[C@@H](O)c1ccco1	ZINC000268236078	455626164	/nfs/dbraw/zinc/62/61/64/455626164.db2.gz	FUPFIJWXTGQWJD-DLBZAZTESA-N	0	3	326.396	3.118	20	30		EGEDHN
C[C@@H](NCCOc1ccccc1C#N)[C@H]1OCCc2sccc21	ZINC000292373064	455645144	/nfs/dbraw/zinc/64/51/44/455645144.db2.gz	IZYRXNNRUWKXNR-FZKQIMNGSA-N	0	3	328.437	3.291	20	30		EGEDHN
C=CCN(C(=O)N[C@H]1CCN(Cc2ccccc2)[C@H](C)C1)C1CC1	ZINC000271487629	455656341	/nfs/dbraw/zinc/65/63/41/455656341.db2.gz	JJCXOPYQXHKNCR-AEFFLSMTSA-N	0	3	327.472	3.400	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCc3cc(F)ccc3[C@@H]2C)CC1	ZINC000606501140	460687219	/nfs/dbraw/zinc/68/72/19/460687219.db2.gz	JSKZXHOHOKZEOK-HNNXBMFYSA-N	0	3	345.462	3.495	20	30		EGEDHN
C[C@H](C1CC1)N(CC(=O)N[C@](C)(C#N)C1CC1)Cc1ccccc1	ZINC000268807828	455714063	/nfs/dbraw/zinc/71/40/63/455714063.db2.gz	FQVAZZISMSYGFQ-FOIQADDNSA-N	0	3	325.456	3.096	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCC(OC[C@@H]2CCCCO2)CC1	ZINC000186252740	455726523	/nfs/dbraw/zinc/72/65/23/455726523.db2.gz	GCOVIUDKLAVYJU-FQEVSTJZSA-N	0	3	328.456	3.417	20	30		EGEDHN
C=CCOCCN1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1	ZINC000292677525	455729295	/nfs/dbraw/zinc/72/92/95/455729295.db2.gz	BOHVVMITIRADEQ-OAHLLOKOSA-N	0	3	331.391	3.258	20	30		EGEDHN
C[C@H](N[C@H]1CCC[C@@H](C#N)C1)c1cc(F)ccc1N1CCN(C)CC1	ZINC000248809843	455731519	/nfs/dbraw/zinc/73/15/19/455731519.db2.gz	KKODVTATIYYGEC-JZXOWHBKSA-N	0	3	344.478	3.310	20	30		EGEDHN
CCN1CCO[C@@H](CN[C@@H]2CCC[C@@H](C#N)C2)[C@@H]1c1ccccc1	ZINC000284751328	455736325	/nfs/dbraw/zinc/73/63/25/455736325.db2.gz	YVKPIZMJKYKVQM-LMCOJAPRSA-N	0	3	327.472	3.120	20	30		EGEDHN
C[C@H](CC#N)Sc1ccccc1NC(=O)CN[C@H](CO)C(C)(C)C	ZINC000193107463	455741818	/nfs/dbraw/zinc/74/18/18/455741818.db2.gz	CLFNMNXMPCPUGD-CZUORRHYSA-N	0	3	349.500	3.016	20	30		EGEDHN
Cc1cc(C(=O)C(C#N)c2nnc3n2CCCCC3)c2ccccc2n1	ZINC000193262408	455750844	/nfs/dbraw/zinc/75/08/44/455750844.db2.gz	CLSPJFLGPOXECB-INIZCTEOSA-N	0	3	345.406	3.351	20	30		EGEDHN
C=C(C)CN1CCC(Nc2nc(-c3cccnc3)nc3c2CCC3)CC1	ZINC000269014278	455763046	/nfs/dbraw/zinc/76/30/46/455763046.db2.gz	BGPXZHSPRYIARN-UHFFFAOYSA-N	0	3	349.482	3.480	20	30		EGEDHN
C[C@@H]1CCNC(=O)[C@@H]1NCCC(C#N)(c1ccccc1)c1ccccc1	ZINC000193662636	455769638	/nfs/dbraw/zinc/76/96/38/455769638.db2.gz	LAVVTYMFQHXOAL-YLJYHZDGSA-N	0	3	347.462	3.001	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN2CCSC3(CCOCC3)C2)cc1	ZINC000186499892	455781868	/nfs/dbraw/zinc/78/18/68/455781868.db2.gz	HSHHPEQVYRXNLS-OAHLLOKOSA-N	0	3	332.469	3.075	20	30		EGEDHN
C[C@@H](NCCCS(=O)(=O)c1ccccc1)c1ccc(C#N)c(F)c1	ZINC000271915612	455799545	/nfs/dbraw/zinc/79/95/45/455799545.db2.gz	CBYMPTIAARUTCY-CQSZACIVSA-N	0	3	346.427	3.212	20	30		EGEDHN
COc1ccc(CN[C@@H](C)[C@@H]2CCCCO2)cc1OCCCC#N	ZINC000271941846	455800637	/nfs/dbraw/zinc/80/06/37/455800637.db2.gz	BTURIYYQZHCQCW-RDJZCZTQSA-N	0	3	332.444	3.425	20	30		EGEDHN
COc1ccc2c(c1)OC[C@@H](N[C@@H](C)c1ccc(C#N)c(F)c1)C2	ZINC000271977219	455810686	/nfs/dbraw/zinc/81/06/86/455810686.db2.gz	VVXAIJMFWCOPBW-LRDDRELGSA-N	0	3	326.371	3.360	20	30		EGEDHN
C#CCCN1CCN(CC/C=C/c2ccc(Br)cc2)CC1	ZINC000271993073	455814991	/nfs/dbraw/zinc/81/49/91/455814991.db2.gz	FIXQJNLFKDDDMO-GQCTYLIASA-N	0	3	347.300	3.493	20	30		EGEDHN
C#CCCOc1ccc(C(=O)NCc2cccc(CN(C)C)c2)cc1	ZINC000294569265	455820515	/nfs/dbraw/zinc/82/05/15/455820515.db2.gz	VINAWQSUCVSRIW-UHFFFAOYSA-N	0	3	336.435	3.080	20	30		EGEDHN
CCCc1ccc(CN[C@H]2CCN(Cc3ccc(C#N)cc3)C2=O)cc1	ZINC000616996465	460694928	/nfs/dbraw/zinc/69/49/28/460694928.db2.gz	KTMWFJFROQKFFC-NRFANRHFSA-N	0	3	347.462	3.401	20	30		EGEDHN
C#CCCOc1ccc(CN2CCC[C@H](CC(C)(C)C(N)=O)C2)cc1	ZINC000294729505	455824819	/nfs/dbraw/zinc/82/48/19/455824819.db2.gz	GGMAGRYPIIKXDF-GOSISDBHSA-N	0	3	342.483	3.202	20	30		EGEDHN
C#CCCOc1ccc(CN2CCC[C@@H](CC(C)(C)C(N)=O)C2)cc1	ZINC000294729506	455825061	/nfs/dbraw/zinc/82/50/61/455825061.db2.gz	GGMAGRYPIIKXDF-SFHVURJKSA-N	0	3	342.483	3.202	20	30		EGEDHN
CC1(C)[C@H](NCc2cc(C#N)ccc2Br)[C@@H]2CCO[C@H]21	ZINC000295092038	455838984	/nfs/dbraw/zinc/83/89/84/455838984.db2.gz	ADCJFNTWNLKBTQ-NWANDNLSSA-N	0	3	335.245	3.224	20	30		EGEDHN
COC[C@@]1(C)CCN(Cc2cn(CCC#N)nc2-c2ccccc2)C1	ZINC000295135168	455839945	/nfs/dbraw/zinc/83/99/45/455839945.db2.gz	PCFCGLKGYQCJQY-FQEVSTJZSA-N	0	3	338.455	3.322	20	30		EGEDHN
N#C[C@@H]1CC[C@@H](N2CCC[C@@H](CNC(=O)Nc3cccc(F)c3)C2)C1	ZINC000278618941	455843424	/nfs/dbraw/zinc/84/34/24/455843424.db2.gz	NFGOGDHIVBFLOW-RVKKMQEKSA-N	0	3	344.434	3.351	20	30		EGEDHN
Cc1cccc(CNCc2cn(CCC#N)nc2-c2ccncc2)c1	ZINC000278663625	455844153	/nfs/dbraw/zinc/84/41/53/455844153.db2.gz	NLBTUWKARRBOHQ-UHFFFAOYSA-N	0	3	331.423	3.457	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2nc3c(s2)C[C@H](CC)CC3)CC1	ZINC000194470855	455846149	/nfs/dbraw/zinc/84/61/49/455846149.db2.gz	ALDNXSKLSRJONB-CYBMUJFWSA-N	0	3	348.516	3.430	20	30		EGEDHN
CC[C@H](NCCNC(=O)c1c(F)cccc1F)c1ccc(C#N)cc1	ZINC000278780957	455848538	/nfs/dbraw/zinc/84/85/38/455848538.db2.gz	PXBRWTAZRVHFHD-KRWDZBQOSA-N	0	3	343.377	3.307	20	30		EGEDHN
C[C@@H](c1ccncc1)N1CCC(/N=C/c2cccc(O)c2O)CC1	ZINC000269592687	455848858	/nfs/dbraw/zinc/84/88/58/455848858.db2.gz	IUFCDUYRGGBYER-HADWXUJASA-N	0	3	325.412	3.137	20	30		EGEDHN
CC[C@@H](N[C@H]1CCN(c2ccccc2OC)C1=O)c1ccc(C#N)cc1	ZINC000278891933	455851586	/nfs/dbraw/zinc/85/15/86/455851586.db2.gz	YRIHGNDSSWLYFT-MSOLQXFVSA-N	0	3	349.434	3.413	20	30		EGEDHN
C#CCOc1ccc(CNCc2ccc(OCCCOC)cc2)cc1	ZINC000285480153	455854920	/nfs/dbraw/zinc/85/49/20/455854920.db2.gz	IAOSSXIIZKLPGD-UHFFFAOYSA-N	0	3	339.435	3.404	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1C(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1	ZINC000278981626	455855354	/nfs/dbraw/zinc/85/53/54/455855354.db2.gz	DPRYBCWZNWUOIP-DFQSSKMNSA-N	0	3	342.483	3.091	20	30		EGEDHN
C[C@H]1CCSCCN1Cc1cn(CCC#N)nc1-c1ccncc1	ZINC000279479593	455866042	/nfs/dbraw/zinc/86/60/42/455866042.db2.gz	WPRGCWSKKABZDQ-HNNXBMFYSA-N	0	3	341.484	3.186	20	30		EGEDHN
COc1cccc([C@@H](C)N[C@H]2CCCN(c3ccc(C#N)cc3)C2=O)c1	ZINC000272173828	455866310	/nfs/dbraw/zinc/86/63/10/455866310.db2.gz	GTAPILBMSZIKEL-QRWLVFNGSA-N	0	3	349.434	3.413	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC=C(c3ccccc3)C2)CC1	ZINC000285567035	455870951	/nfs/dbraw/zinc/87/09/51/455870951.db2.gz	VXHSERVIHJUEHJ-UHFFFAOYSA-N	0	3	325.456	3.136	20	30		EGEDHN
C[C@@H](N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O)c1ccc(C#N)cc1	ZINC000272190948	455872453	/nfs/dbraw/zinc/87/24/53/455872453.db2.gz	KHLNIOMSUZXYJE-FOIQADDNSA-N	0	3	344.418	3.276	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NC1CCN([C@@H](C)c2ccncc2)CC1)OCC	ZINC000270166870	455892689	/nfs/dbraw/zinc/89/26/89/455892689.db2.gz	BSCHACROSRNBRE-LPHOPBHVSA-N	0	3	345.487	3.095	20	30		EGEDHN
C[C@H](CNC(=O)c1ccc(C(C)(C)C#N)cc1)N1CCC[C@@H](C)C1	ZINC000280124759	455898168	/nfs/dbraw/zinc/89/81/68/455898168.db2.gz	CTCVOIOCOFTMIB-HZPDHXFCSA-N	0	3	327.472	3.338	20	30		EGEDHN
CC[C@H]1c2ccccc2CCN1C[C@H](O)COc1ccc(C#N)cc1	ZINC000261480636	455906364	/nfs/dbraw/zinc/90/63/64/455906364.db2.gz	MGEXGWRRAWQXFH-RXVVDRJESA-N	0	3	336.435	3.307	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1F)C(=O)c1ccc(CC#N)cc1	ZINC000270241986	455910113	/nfs/dbraw/zinc/91/01/13/455910113.db2.gz	CSRSZWXOBRSMQE-UHFFFAOYSA-N	0	3	339.414	3.096	20	30		EGEDHN
C=C(Br)CNC[C@]1(C)CCN(C(=O)OC(C)(C)C)C1	ZINC000195201332	455932313	/nfs/dbraw/zinc/93/23/13/455932313.db2.gz	VLJCXRPIIJUAJZ-AWEZNQCLSA-N	0	3	333.270	3.132	20	30		EGEDHN
CN(C)CCN(CCCc1ccccc1)C(=O)Cc1ccc(C#N)cc1	ZINC000195234103	455935537	/nfs/dbraw/zinc/93/55/37/455935537.db2.gz	CBJSTFHFNPWNMF-UHFFFAOYSA-N	0	3	349.478	3.124	20	30		EGEDHN
Cc1occc1C(=O)NC1CCN([C@@H](C)c2cccc(C#N)c2)CC1	ZINC000187674251	455937103	/nfs/dbraw/zinc/93/71/03/455937103.db2.gz	WZFURIFHLRCHFE-AWEZNQCLSA-N	0	3	337.423	3.415	20	30		EGEDHN
C=CCC[C@H](NC[C@@H](O)COc1ccc2c(c1)OCO2)c1ccco1	ZINC000285904241	455939155	/nfs/dbraw/zinc/93/91/55/455939155.db2.gz	CVYJMSKIFQKUFA-ZBFHGGJFSA-N	0	3	345.395	3.045	20	30		EGEDHN
C[C@H](c1ccncc1)N1CCC(NC(=O)c2ccc(CC#N)cc2)CC1	ZINC000270448446	455956785	/nfs/dbraw/zinc/95/67/85/455956785.db2.gz	DUSBJQQJCDGHLT-MRXNPFEDSA-N	0	3	348.450	3.103	20	30		EGEDHN
C=CCC[C@H](NCc1ccnc(OCCN(C)C)c1)c1ccco1	ZINC000286166295	455992165	/nfs/dbraw/zinc/99/21/65/455992165.db2.gz	PPDQNOMWWXTVPO-KRWDZBQOSA-N	0	3	329.444	3.412	20	30		EGEDHN
CCCO[C@@H]1CCCN(C(=O)C(C#N)Cc2ccc(C#N)cc2)CC1	ZINC000280555311	455998147	/nfs/dbraw/zinc/99/81/47/455998147.db2.gz	UOINVWVQZSDYGR-RTBURBONSA-N	0	3	339.439	3.048	20	30		EGEDHN
C=CCN(Cc1ccccc1F)C(=O)N[C@@H](C)C1=CCN(C)CC1	ZINC000272653810	456027453	/nfs/dbraw/zinc/02/74/53/456027453.db2.gz	AYKZGQWIIOJYNV-HNNXBMFYSA-N	0	3	331.435	3.174	20	30		EGEDHN
CN(CCCN(C)c1ccc([N+](=O)[O-])c(C#N)c1)Cc1ccco1	ZINC000286600430	456050418	/nfs/dbraw/zinc/05/04/18/456050418.db2.gz	SMRBDDJNBKFFJX-UHFFFAOYSA-N	0	3	328.372	3.018	20	30		EGEDHN
C=CCN1CC[C@H](N2CCC(c3c[nH]c4ccc(F)cc43)CC2)C1=O	ZINC000286949446	456057990	/nfs/dbraw/zinc/05/79/90/456057990.db2.gz	MNDSNDGNVHHWMX-IBGZPJMESA-N	0	3	341.430	3.273	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)N2CC[C@H](N3CCCCC3)C2)cc1	ZINC000287013920	456059606	/nfs/dbraw/zinc/05/96/06/456059606.db2.gz	RPCRJXJMEZIUPT-SFHVURJKSA-N	0	3	343.471	3.021	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@@H]1CNCc1c(Cl)n(C)nc1C(F)(F)F	ZINC000280839838	456063849	/nfs/dbraw/zinc/06/38/49/456063849.db2.gz	YBWLKXJTOMRLPC-MWLCHTKSSA-N	0	3	337.773	3.163	20	30		EGEDHN
C=CCOCCCC(=O)N1CC[C@@]2(CCN(Cc3ccccc3)C2)C1	ZINC000288233323	456090163	/nfs/dbraw/zinc/09/01/63/456090163.db2.gz	FHPJRZAXMHXION-OAQYLSRUSA-N	0	3	342.483	3.094	20	30		EGEDHN
C=CCOc1ccc(CN[C@H](C)[C@H](O)c2ccccc2)cc1OC	ZINC000288528578	456098061	/nfs/dbraw/zinc/09/80/61/456098061.db2.gz	KATJLRKYIPFRAX-QRWLVFNGSA-N	0	3	327.424	3.472	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CC[C@@]2(CCN(Cc3ccccc3)C2)C1	ZINC000288617554	456100341	/nfs/dbraw/zinc/10/03/41/456100341.db2.gz	ZXVHNHVQKAXSCD-GHTZIAJQSA-N	0	3	342.483	3.092	20	30		EGEDHN
C=CCN(CC=C)[C@H](CN[C@@H](c1nc[nH]n1)c1ccccc1)C(C)C	ZINC000289199315	456118130	/nfs/dbraw/zinc/11/81/30/456118130.db2.gz	JOXOHBHUKZMXOM-RTBURBONSA-N	0	3	339.487	3.182	20	30		EGEDHN
C#Cc1ccc(CN2CCC(NC(=O)Nc3ccccc3)CC2)cc1	ZINC000289393064	456123260	/nfs/dbraw/zinc/12/32/60/456123260.db2.gz	RDMGUYFTKPCYHV-UHFFFAOYSA-N	0	3	333.435	3.454	20	30		EGEDHN
CCCCO[C@H]1C[C@H](NCC(=O)Nc2sccc2C#N)C1(C)C	ZINC000289470861	456127429	/nfs/dbraw/zinc/12/74/29/456127429.db2.gz	ZAMASPXDZPAMJI-KBPBESRZSA-N	0	3	335.473	3.132	20	30		EGEDHN
COC1CCN(CCNc2ccc(C#N)c(C(F)(F)F)c2)CC1	ZINC000301512415	456133952	/nfs/dbraw/zinc/13/39/52/456133952.db2.gz	BTTQRRQKTABIHI-UHFFFAOYSA-N	0	3	327.350	3.100	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H](CO)Cc2ccc(F)cc2)cc1OC	ZINC000271169805	456152445	/nfs/dbraw/zinc/15/24/45/456152445.db2.gz	BVVMSGOJWYWORP-GOSISDBHSA-N	0	3	345.414	3.092	20	30		EGEDHN
CN(CCC(=O)Nc1ccccc1C#N)C[C@H]1OCCc2ccccc21	ZINC000263695034	456194561	/nfs/dbraw/zinc/19/45/61/456194561.db2.gz	KMJOMBUKUPCJNV-HXUWFJFHSA-N	0	3	349.434	3.133	20	30		EGEDHN
C#CC[C@H](NC(=O)N(C)[C@H](C)C1CCN(C)CC1)c1ccccc1	ZINC000273406829	456228570	/nfs/dbraw/zinc/22/85/70/456228570.db2.gz	HSTKNOHVVBPXTL-APWZRJJASA-N	0	3	327.472	3.123	20	30		EGEDHN
C=CC[C@@H](CO)NCc1ccc(OCC(F)(F)F)c(OCC)c1	ZINC000273537342	456237558	/nfs/dbraw/zinc/23/75/58/456237558.db2.gz	WMKJVWQFQXPUNU-ZDUSSCGKSA-N	0	3	333.350	3.053	20	30		EGEDHN
CCO[C@@H]1C[C@@H](/[NH+]=C/c2ccc(N(CC)CC)cc2[O-])[C@@]12CCCO2	ZINC000273538211	456237932	/nfs/dbraw/zinc/23/79/32/456237932.db2.gz	SNUWWJNMXYMJNP-ACRRPJSBSA-N	0	3	346.471	3.384	20	30		EGEDHN
CC(C)SCCNCc1cn(CCC#N)nc1-c1ccncc1	ZINC000290228970	456271342	/nfs/dbraw/zinc/27/13/42/456271342.db2.gz	YEEKYOVBIULFOU-UHFFFAOYSA-N	0	3	329.473	3.090	20	30		EGEDHN
C[C@H](CC#N)Sc1ccccc1NC(=O)CN[C@H]1CSC[C@H]1C	ZINC000352814289	456331105	/nfs/dbraw/zinc/33/11/05/456331105.db2.gz	FYHANKUZZGRCMY-NFAWXSAZSA-N	0	3	349.525	3.360	20	30		EGEDHN
C=CCOc1ccc(CN(C)CCCn2ccnc2C)cc1OC	ZINC000290454630	456333470	/nfs/dbraw/zinc/33/34/70/456333470.db2.gz	MQHWPRNBCYGBON-UHFFFAOYSA-N	0	3	329.444	3.287	20	30		EGEDHN
C=CCOc1ccc(CN2CC[C@@H](C(=O)N3CCCC3)C2)cc1Cl	ZINC000290544949	456359602	/nfs/dbraw/zinc/35/96/02/456359602.db2.gz	RMVLCZTXXZKDPI-MRXNPFEDSA-N	0	3	348.874	3.349	20	30		EGEDHN
COc1ccc([C@@H](CNc2ccc(F)cc2C#N)N(C)C)cc1OC	ZINC000302581730	456361781	/nfs/dbraw/zinc/36/17/81/456361781.db2.gz	UDSIOJBQQWHHCU-QGZVFWFLSA-N	0	3	343.402	3.429	20	30		EGEDHN
COC(=O)c1ccc(CN(C)CCCC2(C#N)CCOCC2)cc1	ZINC000281940629	456368602	/nfs/dbraw/zinc/36/86/02/456368602.db2.gz	IVGJWIURWDKVKQ-UHFFFAOYSA-N	0	3	330.428	3.006	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1ccc(F)c(C#N)c1)C(C)C	ZINC000352861139	456371316	/nfs/dbraw/zinc/37/13/16/456371316.db2.gz	IXRFXMMAACNMLP-GOSISDBHSA-N	0	3	329.419	3.126	20	30		EGEDHN
Cc1cc(C#N)ccc1C(=O)N(C)C[C@@H]1CCN(C)[C@@H]1c1cccnc1	ZINC000343128145	456422866	/nfs/dbraw/zinc/42/28/66/456422866.db2.gz	NRVVAPRENAJOFP-AZUAARDMSA-N	0	3	348.450	3.027	20	30		EGEDHN
COc1ccc(C(=O)C(C#N)c2cnc3ccccc3n2)c(C)c1OC	ZINC000347888854	456424062	/nfs/dbraw/zinc/42/40/62/456424062.db2.gz	QDDOBLHFCOVZLT-CQSZACIVSA-N	0	3	347.374	3.446	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@H](NCc1cccc(N3CCOCC3)c1)CC2	ZINC000340435444	456459113	/nfs/dbraw/zinc/45/91/13/456459113.db2.gz	RMMFGSQKGNFZKL-OAQYLSRUSA-N	0	3	333.435	3.172	20	30		EGEDHN
CCCCN(CC)[C@H](C)C(=O)N(CCC#N)c1ccccc1OC	ZINC000343263453	456492968	/nfs/dbraw/zinc/49/29/68/456492968.db2.gz	KVHDOEKVQLSPBI-MRXNPFEDSA-N	0	3	331.460	3.452	20	30		EGEDHN
C=CCC[C@@H](NC[C@H](O)CN1CCc2ccccc2C1)c1ccco1	ZINC000340505223	456498624	/nfs/dbraw/zinc/49/86/24/456498624.db2.gz	NJZTWLADWZCFRX-VQTJNVASSA-N	0	3	340.467	3.296	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000337755714	456526139	/nfs/dbraw/zinc/52/61/39/456526139.db2.gz	BHGNXEYCUIROAC-QRWLVFNGSA-N	0	3	333.435	3.117	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1C	ZINC000310009545	456578271	/nfs/dbraw/zinc/57/82/71/456578271.db2.gz	JNGJGSKXIHKJAH-ZYHUDNBSSA-N	0	3	333.270	3.130	20	30		EGEDHN
CC(C)[C@@H](NCC(=O)N(CCC#N)CCC#N)c1ccc(Cl)cc1	ZINC000299083585	456601349	/nfs/dbraw/zinc/60/13/49/456601349.db2.gz	IVGJJANUDACLJA-GOSISDBHSA-N	0	3	346.862	3.283	20	30		EGEDHN
CC(C)N(Cc1cccs1)C[C@@H](O)COc1ccccc1C#N	ZINC000320963929	456632697	/nfs/dbraw/zinc/63/26/97/456632697.db2.gz	YUSRYXOAHJCQSY-MRXNPFEDSA-N	0	3	330.453	3.270	20	30		EGEDHN
CC(C)N(Cc1cccs1)C[C@H](O)COc1ccccc1C#N	ZINC000320963927	456633597	/nfs/dbraw/zinc/63/35/97/456633597.db2.gz	YUSRYXOAHJCQSY-INIZCTEOSA-N	0	3	330.453	3.270	20	30		EGEDHN
COc1cc(CN2CCCN(Cc3ccccc3)CC2)ccc1C#N	ZINC000323625967	456656402	/nfs/dbraw/zinc/65/64/02/456656402.db2.gz	OSZNBVCLRQTPMP-UHFFFAOYSA-N	0	3	335.451	3.275	20	30		EGEDHN
CS[C@@H]1CN(c2ccc(C#N)c(C(F)(F)F)c2)C[C@@H]1N(C)C	ZINC000340740916	456660925	/nfs/dbraw/zinc/66/09/25/456660925.db2.gz	IOUHHUREMPFTSX-UONOGXRCSA-N	0	3	329.391	3.059	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)N[C@H](CN(C)C)c1ccc(Cl)cc1	ZINC000283016746	456691082	/nfs/dbraw/zinc/69/10/82/456691082.db2.gz	SLSNPJMLYJKTKW-MRXNPFEDSA-N	0	3	331.803	3.146	20	30		EGEDHN
CN(CC(=O)N(CCC#N)CCC#N)C1CCC(C(C)(C)C)CC1	ZINC000353448779	456699291	/nfs/dbraw/zinc/69/92/91/456699291.db2.gz	PKMOPVALFVMJIQ-UHFFFAOYSA-N	0	3	332.492	3.179	20	30		EGEDHN
COc1cc(CN(C)CCc2cccc([N+](=O)[O-])c2)ccc1C#N	ZINC000283052607	456699387	/nfs/dbraw/zinc/69/93/87/456699387.db2.gz	OYRCCOQDYBFPBZ-UHFFFAOYSA-N	0	3	325.368	3.150	20	30		EGEDHN
C=CCN(CCOc1ccccc1)[C@@H](C)c1cccc(-n2cnnn2)c1	ZINC000343558857	456703617	/nfs/dbraw/zinc/70/36/17/456703617.db2.gz	CQTOUMSALGLJFX-KRWDZBQOSA-N	0	3	349.438	3.290	20	30		EGEDHN
Cc1c([C@@H](C)NCCc2cccc(C#N)c2)nnn1-c1ccccc1	ZINC000343572274	456715540	/nfs/dbraw/zinc/71/55/40/456715540.db2.gz	MIUWAEXDQWNDDR-OAHLLOKOSA-N	0	3	331.423	3.341	20	30		EGEDHN
O=C(NC[C@H](c1ccccc1)N1CCCC1)c1cn2c(n1)CCCC2	ZINC000328704687	456741084	/nfs/dbraw/zinc/74/10/84/456741084.db2.gz	KSXKGCXUDRWGFN-GOSISDBHSA-N	0	3	338.455	3.361	20	30		EGEDHN
O=C(CCNC(=O)C1CCCCC1)N1CCN(C2CCCC2)CC1	ZINC000328826357	456770053	/nfs/dbraw/zinc/77/00/53/456770053.db2.gz	STATYKYEGCDHTN-UHFFFAOYSA-N	0	3	335.492	3.000	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)NC[C@H](C)N1CCCC[C@H]1C	ZINC000348571930	456772238	/nfs/dbraw/zinc/77/22/38/456772238.db2.gz	UNQCEXBIVAKVAT-SJORKVTESA-N	0	3	345.487	3.314	20	30		EGEDHN
Cc1ccc(C)c(NC(=O)[C@H](C)N2CCC[C@@H]2[C@H]2COCC[C@H]2O)c1	ZINC000328858323	456778480	/nfs/dbraw/zinc/77/84/80/456778480.db2.gz	YHVVRCGWDKKBJN-QFHJOOASSA-N	0	3	346.471	3.142	20	30		EGEDHN
Cc1nc([C@@H]2CCCOC2)sc1C(=O)NC[C@@H](C)N(C)C1CC1	ZINC000328874160	456781619	/nfs/dbraw/zinc/78/16/19/456781619.db2.gz	RKTRCDJDWRIDTO-DGCLKSJQSA-N	0	3	337.489	3.133	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(OC(F)F)cc2F)CC1	ZINC000283456288	456784636	/nfs/dbraw/zinc/78/46/36/456784636.db2.gz	LFCZGFFSXRTTJV-UHFFFAOYSA-N	0	3	343.349	3.199	20	30		EGEDHN
CC[C@@H](C)n1ncc(NC(=O)N2CC[C@H]3CC[C@@H](C2)N3C)c1C1CC1	ZINC000328924635	456792296	/nfs/dbraw/zinc/79/22/96/456792296.db2.gz	VNXRAZKXAFMGOU-BMFZPTHFSA-N	0	3	345.491	3.446	20	30		EGEDHN
CC(C)n1nccc1[C@@H]1OCCC[C@H]1C(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000328931609	456794199	/nfs/dbraw/zinc/79/41/99/456794199.db2.gz	HZFIVPDOYCHTLO-QGPMSJSTSA-N	0	3	346.475	3.125	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN(C)C1CCC(C(F)(F)F)CC1	ZINC000344139263	456801600	/nfs/dbraw/zinc/80/16/00/456801600.db2.gz	KWFQVRLIPRDMJF-HSBZDZAISA-N	0	3	333.398	3.047	20	30		EGEDHN
C=CCCN(C)C(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1	ZINC000344262600	456811497	/nfs/dbraw/zinc/81/14/97/456811497.db2.gz	JBIIRPZLNHIFRY-KRWDZBQOSA-N	0	3	340.389	3.476	20	30		EGEDHN
C=CC[C@@H](CO)CNCc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1	ZINC000341285170	456832956	/nfs/dbraw/zinc/83/29/56/456832956.db2.gz	XDFYUYFLMQYQCW-CYBMUJFWSA-N	0	3	346.383	3.138	20	30		EGEDHN
Cc1nsc(NC[C@@H]2CCN(CCc3ccccc3)C2)c1C#N	ZINC000283745721	456834042	/nfs/dbraw/zinc/83/40/42/456834042.db2.gz	JYOIUFRUFXOGIW-INIZCTEOSA-N	0	3	326.469	3.300	20	30		EGEDHN
CC(C(=O)NCC1(C)CCCCCC1)S(=O)(=O)C1CCOCC1	ZINC000329250160	456860922	/nfs/dbraw/zinc/86/09/22/456860922.db2.gz	XNKQXWWGRGUCNL-CQSZACIVSA-N	0	3	345.505	3.286	20	30		EGEDHN
C=C(C)Cn1c(C2CCC2)nnc1N1CC[C@H](N2CCCCC2)C1	ZINC000338845230	456863223	/nfs/dbraw/zinc/86/32/23/456863223.db2.gz	FOVURULRSYCYJH-KRWDZBQOSA-N	0	3	329.492	3.186	20	30		EGEDHN
C=C(C)Cn1c(-c2ccc(C)s2)nnc1N1CCN2CCC[C@@H]2C1	ZINC000338850227	456863941	/nfs/dbraw/zinc/86/39/41/456863941.db2.gz	NRAAQLNHUSBOFM-OAHLLOKOSA-N	0	3	343.500	3.176	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C	ZINC000341463417	456865900	/nfs/dbraw/zinc/86/59/00/456865900.db2.gz	AYXZHXBFPNRWGW-KURKYZTESA-N	0	3	348.512	3.109	20	30		EGEDHN
C=CCOc1cccc(NC(=O)N2CC[C@@H](N3CCCCC3)C2)c1	ZINC000341473090	456868014	/nfs/dbraw/zinc/86/80/14/456868014.db2.gz	YSZNORQGTPBEQX-QGZVFWFLSA-N	0	3	329.444	3.344	20	30		EGEDHN
C[C@H](C(=O)N[C@@H](c1nnc[n-]1)c1ccccc1)[NH+]1CCCCCC1	ZINC000329304188	456869334	/nfs/dbraw/zinc/86/93/34/456869334.db2.gz	XTNRYSJEGASMHQ-GDBMZVCRSA-N	0	3	327.432	3.115	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2C[C@H]2c2c(F)cccc2F)CC1	ZINC000341596690	456879733	/nfs/dbraw/zinc/87/97/33/456879733.db2.gz	DJMJUBRWYNZXPT-RHSMWYFYSA-N	0	3	349.425	3.160	20	30		EGEDHN
C[C@@H](c1ccncc1)N1CCC(NC(=O)[C@@H]2CC(=O)N[C@H](C)C2)CC1	ZINC000329404894	456885653	/nfs/dbraw/zinc/88/56/53/456885653.db2.gz	CLGCISSHVVLLPG-YCPHGPKFSA-N	0	3	344.459	3.319	20	30		EGEDHN
COc1ccc(C2(NCCC(=O)Nc3sccc3C#N)CC2)cc1	ZINC000341661240	456888352	/nfs/dbraw/zinc/88/83/52/456888352.db2.gz	UHZAJPABCIXUJE-UHFFFAOYSA-N	0	3	341.436	3.236	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CCOC[C@@H](C2CCC2)C1	ZINC000329512399	456902403	/nfs/dbraw/zinc/90/24/03/456902403.db2.gz	XUTVPJMHGNCDGE-MOPGFXCFSA-N	0	3	326.440	3.034	20	30		EGEDHN
O=C(Nc1nc2c(s1)CCCCCC2)N[C@@H]1CCc2[nH]cnc2C1	ZINC000329522014	456904091	/nfs/dbraw/zinc/90/40/91/456904091.db2.gz	PELVTGBKOARHTB-LLVKDONJSA-N	0	3	345.472	3.409	20	30		EGEDHN
O=C(Nc1nc2c(s1)CCCCCC2)N[C@@H]1CCc2nc[nH]c2C1	ZINC000329522014	456904094	/nfs/dbraw/zinc/90/40/94/456904094.db2.gz	PELVTGBKOARHTB-LLVKDONJSA-N	0	3	345.472	3.409	20	30		EGEDHN
C[C@@H](C(=O)Nc1ccc2c(c1)OCO2)N1CCC2(CCOCC2)[C@H]1C	ZINC000329666873	456924040	/nfs/dbraw/zinc/92/40/40/456924040.db2.gz	LBYVXODMAWJPAV-UONOGXRCSA-N	0	3	346.427	3.283	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cc(F)cc2[nH]cnc21)C(C)C	ZINC000353827256	456925610	/nfs/dbraw/zinc/92/56/10/456925610.db2.gz	NSSCLEDTSFAZPV-KRWDZBQOSA-N	0	3	344.434	3.130	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cc(F)cc2nc[nH]c21)C(C)C	ZINC000353827256	456925614	/nfs/dbraw/zinc/92/56/14/456925614.db2.gz	NSSCLEDTSFAZPV-KRWDZBQOSA-N	0	3	344.434	3.130	20	30		EGEDHN
Cc1cccc(C)c1[C@H](C)NC([O-])=[NH+]C[C@H]1CCc2nccn2C1	ZINC000329873916	456954319	/nfs/dbraw/zinc/95/43/19/456954319.db2.gz	CMDDWRDPFCXTCZ-JKSUJKDBSA-N	0	3	326.444	3.327	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC[C@@H]2CCC3(CCCCC3)O2)CC1	ZINC000330044479	456978535	/nfs/dbraw/zinc/97/85/35/456978535.db2.gz	FUBQUXXSBWAJGM-SFHVURJKSA-N	0	3	349.519	3.412	20	30		EGEDHN
CC(C(=O)NCC[C@H]1CCC[C@@H](C)C1)S(=O)(=O)C1CCOCC1	ZINC000330151810	456992724	/nfs/dbraw/zinc/99/27/24/456992724.db2.gz	LPJCWIFZOLEHCM-QLFBSQMISA-N	0	3	345.505	3.142	20	30		EGEDHN
CCN1CCN([C@H](C)CNC(=O)c2coc(C3CCCCC3)n2)CC1	ZINC000330178346	456996965	/nfs/dbraw/zinc/99/69/65/456996965.db2.gz	LNCGYHDSESALRV-OAHLLOKOSA-N	0	3	348.491	3.053	20	30		EGEDHN
CN(C)[C@H]1CCCN(C(=O)c2cn(CCCC#N)c3ccccc23)C1	ZINC000345816532	456999480	/nfs/dbraw/zinc/99/94/80/456999480.db2.gz	NCIITOLDGKUDCB-INIZCTEOSA-N	0	3	338.455	3.111	20	30		EGEDHN
C=CCOc1ccc(CN2CCC(O[C@H]3CCOC3)CC2)cc1OC	ZINC000354010286	457006825	/nfs/dbraw/zinc/00/68/25/457006825.db2.gz	MUFUNLXFVJKESF-SFHVURJKSA-N	0	3	347.455	3.030	20	30		EGEDHN
O=C(Nc1ccccc1)[C@H]1CCCN(C(=O)[C@H]2CCCN2C2CC2)C1	ZINC000330220271	457006843	/nfs/dbraw/zinc/00/68/43/457006843.db2.gz	QBURSQNRYPWEAR-MAUKXSAKSA-N	0	3	341.455	3.140	20	30		EGEDHN
Cc1nc2c(n1[C@@H]1CCN(CC(=O)NC3CCCC3)C1)CCCC2	ZINC000330342548	457031208	/nfs/dbraw/zinc/03/12/08/457031208.db2.gz	BAWGSXSSGSALLT-MRXNPFEDSA-N	0	3	330.476	3.216	20	30		EGEDHN
Cc1nc(C(C#N)C(=O)Nc2ccc(-c3ncon3)cc2)sc1C	ZINC000346319931	457032447	/nfs/dbraw/zinc/03/24/47/457032447.db2.gz	PSMRUXPHDLNTER-ZDUSSCGKSA-N	0	3	339.380	3.056	20	30		EGEDHN
CN(C)Cc1ccccc1C(=O)N1C[C@H](C#N)[C@@H](c2ccccc2)C1	ZINC000346396936	457039302	/nfs/dbraw/zinc/03/93/02/457039302.db2.gz	LNHRZNOPZSMDCV-AZUAARDMSA-N	0	3	333.435	3.128	20	30		EGEDHN
Cc1ccccc1[C@@H]1CCN([C@H](C)C(=O)NC(=O)NC(C)(C)C)C1	ZINC000330414492	457040252	/nfs/dbraw/zinc/04/02/52/457040252.db2.gz	NDMJLSIKOTXYOX-HUUCEWRRSA-N	0	3	331.460	3.002	20	30		EGEDHN
Cc1nc(NC(=O)CCN2CCCC[C@@H]2C)sc1SCC#N	ZINC000362691957	457046592	/nfs/dbraw/zinc/04/65/92/457046592.db2.gz	JVIWRXJFLSNTLX-NSHDSACASA-N	0	3	338.502	3.270	20	30		EGEDHN
CC[C@H](C)n1nc(NC(=O)NC[C@@H](C)N2CCC(C)CC2)cc1C	ZINC000330693515	457072063	/nfs/dbraw/zinc/07/20/63/457072063.db2.gz	SFCKIKKGDVUYJA-GOEBONIOSA-N	0	3	335.496	3.031	20	30		EGEDHN
CC(C)N(Cc1ccc(F)cc1)C[C@H](O)COc1ccc(C#N)cc1	ZINC000346610601	457078301	/nfs/dbraw/zinc/07/83/01/457078301.db2.gz	WPPVECLTKVTHPT-IBGZPJMESA-N	0	3	342.414	3.348	20	30		EGEDHN
CN(C)CCOc1ccc(-c2noc(CCCCCC#N)n2)cc1	ZINC000349980019	457132026	/nfs/dbraw/zinc/13/20/26/457132026.db2.gz	HHILVCHBCLFFRW-UHFFFAOYSA-N	0	3	328.416	3.303	20	30		EGEDHN
C[C@@H](C(=O)N(CCN(C)C)Cc1ccccc1)c1cccc(C#N)c1	ZINC000359914227	457145487	/nfs/dbraw/zinc/14/54/87/457145487.db2.gz	UCIRBVOHBPZTBO-QGZVFWFLSA-N	0	3	335.451	3.252	20	30		EGEDHN
CC(C)c1nn(C)cc1NC(=O)N1CCN(CCC(C)(C)C)CC1	ZINC000331249827	457153877	/nfs/dbraw/zinc/15/38/77/457153877.db2.gz	SASULGQCEIICEP-UHFFFAOYSA-N	0	3	335.496	3.143	20	30		EGEDHN
C[C@@H]1[C@@H](NC(=O)NCC#Cc2ccccc2)CCN1Cc1ccccc1	ZINC000350124223	457165623	/nfs/dbraw/zinc/16/56/23/457165623.db2.gz	XJCQYUKXKZYPNC-NQIIRXRSSA-N	0	3	347.462	3.000	20	30		EGEDHN
C=C(C)COc1cc(CNCCC(=O)NC(C)(C)C)ccc1OC	ZINC000356858025	457183487	/nfs/dbraw/zinc/18/34/87/457183487.db2.gz	CLQFJQHLWYYQNS-UHFFFAOYSA-N	0	3	334.460	3.045	20	30		EGEDHN
N#CC(C(=O)c1cccc(NC(=O)c2cccs2)c1)c1ccncn1	ZINC000354480117	457249376	/nfs/dbraw/zinc/24/93/76/457249376.db2.gz	WWXOJKUCTNGHRD-CQSZACIVSA-N	0	3	348.387	3.280	20	30		EGEDHN
CN(CCC#N)C(=O)CCN1CCC(=Cc2ccccc2F)CC1	ZINC000356981052	457256240	/nfs/dbraw/zinc/25/62/40/457256240.db2.gz	FSLMCXJNADXTGF-UHFFFAOYSA-N	0	3	329.419	3.067	20	30		EGEDHN
C[C@H](CO)N(Cc1ccc(Br)cc1C#N)C1CCCC1	ZINC000347171320	457268996	/nfs/dbraw/zinc/26/89/96/457268996.db2.gz	QIFWALDUAWQIDM-GFCCVEGCSA-N	0	3	337.261	3.446	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)N(C)C	ZINC000347249427	457310091	/nfs/dbraw/zinc/31/00/91/457310091.db2.gz	NMCGBZPIAAAENA-HNNXBMFYSA-N	0	3	337.423	3.225	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N[C@H](C)CCC2CC2)cc1	ZINC000351686947	457312767	/nfs/dbraw/zinc/31/27/67/457312767.db2.gz	ADYJVWCHYJXAJQ-OLZOCXBDSA-N	0	3	349.456	3.073	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NCC(C)(C)CCC#N)C1	ZINC000351825771	457318589	/nfs/dbraw/zinc/31/85/89/457318589.db2.gz	ALTMVHDCOANFMG-FUHWJXTLSA-N	0	3	342.487	3.451	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1CCC[C@@](C)(c2ccccc2)CC1	ZINC000352204550	457347559	/nfs/dbraw/zinc/34/75/59/457347559.db2.gz	XYUPODIFJOYYOH-WIYYLYMNSA-N	0	3	341.499	3.438	20	30		EGEDHN
N#CCCCCN1CCC[C@H](NC(=O)CCCc2ccccc2)C1	ZINC000352359445	457357325	/nfs/dbraw/zinc/35/73/25/457357325.db2.gz	AEJQDNOZMVXSEB-IBGZPJMESA-N	0	3	327.472	3.284	20	30		EGEDHN
Cc1ccc([C@@H](CNC(=O)NCC(C)(C)CCC#N)N(C)C)cc1	ZINC000352339347	457357475	/nfs/dbraw/zinc/35/74/75/457357475.db2.gz	CHKYATLGBDBEPK-QGZVFWFLSA-N	0	3	330.476	3.227	20	30		EGEDHN
C=C[C@H](CO)NCc1ccc(Oc2cc(OC)cc(OC)c2)cc1	ZINC000352446050	457372954	/nfs/dbraw/zinc/37/29/54/457372954.db2.gz	BAUBPDJRFCHQLF-OAHLLOKOSA-N	0	3	329.396	3.133	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000373862633	457374477	/nfs/dbraw/zinc/37/44/77/457374477.db2.gz	KGLPIJFPJIJIPH-KRWDZBQOSA-N	0	3	337.423	3.102	20	30		EGEDHN
C=C(Cl)CNC(=O)N(CC)C[C@@H]1CCN(Cc2ccccc2)C1	ZINC000369742030	457377706	/nfs/dbraw/zinc/37/77/06/457377706.db2.gz	PEGFBNRMDPENDP-QGZVFWFLSA-N	0	3	335.879	3.293	20	30		EGEDHN
C=C[C@H](CO)NCc1ccc(OC(F)(F)[C@@H](F)C(F)(F)F)cc1	ZINC000352452350	457378719	/nfs/dbraw/zinc/37/87/19/457378719.db2.gz	FDVOQOYZSIDPFF-PWSUYJOCSA-N	0	3	343.267	3.195	20	30		EGEDHN
C=CCS(=O)(=O)CCN[C@@H](C)[C@@H]1C[C@H]1c1ccc(Cl)s1	ZINC000378184496	457381394	/nfs/dbraw/zinc/38/13/94/457381394.db2.gz	PJQBNXZZBRZBEG-SDDRHHMPSA-N	0	3	333.906	3.084	20	30		EGEDHN
CC#CCCNCc1cc(Br)cc(Br)c1N	ZINC000390158897	457437709	/nfs/dbraw/zinc/43/77/09/457437709.db2.gz	YKMPEYNRIUXZRH-UHFFFAOYSA-N	0	3	346.066	3.297	20	30		EGEDHN
CN(CCC#N)c1ccc(CN[C@H]2CN(C)Cc3ccccc32)cc1	ZINC000378273368	457386633	/nfs/dbraw/zinc/38/66/33/457386633.db2.gz	QLLTVUMOQIHETI-NRFANRHFSA-N	0	3	334.467	3.313	20	30		EGEDHN
C[C@@H](NC(=O)NCC(C)(C)CCC#N)[C@@H](c1ccccc1)N(C)C	ZINC000357278868	457416448	/nfs/dbraw/zinc/41/64/48/457416448.db2.gz	FFSXJGKJVOQUJV-WBVHZDCISA-N	0	3	330.476	3.307	20	30		EGEDHN
C=CCOc1cccc(NC(=O)N2CCCC23CCN(C)CC3)c1	ZINC000363950666	457466236	/nfs/dbraw/zinc/46/62/36/457466236.db2.gz	IZJOMXAJAFGTDS-UHFFFAOYSA-N	0	3	329.444	3.344	20	30		EGEDHN
CCOc1cc(C[NH2+][C@@H]2CC[C@H](C#N)C2)cc(Br)c1[O-]	ZINC000425349180	457510406	/nfs/dbraw/zinc/51/04/06/457510406.db2.gz	GDWVEDVZDQGKTC-CMPLNLGQSA-N	0	3	339.233	3.335	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)N[C@@H]1CC[C@H](C#N)C1)c1ccccc1	ZINC000425410227	457540698	/nfs/dbraw/zinc/54/06/98/457540698.db2.gz	WJAQJHYNFHTUBD-JQHSSLGASA-N	0	3	328.460	3.061	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N(C)C[C@H](O)COCc1ccccc1F	ZINC000425540124	457591385	/nfs/dbraw/zinc/59/13/85/457591385.db2.gz	UVJQDZULIQMKKC-KXBFYZLASA-N	0	3	342.414	3.268	20	30		EGEDHN
CCN(c1ccc(C(=O)C(C#N)c2cc(C)nc(C)n2)cn1)C(C)C	ZINC000357790409	457690633	/nfs/dbraw/zinc/69/06/33/457690633.db2.gz	NDSCCIOFRYLAMD-MRXNPFEDSA-N	0	3	337.427	3.213	20	30		EGEDHN
CC(C#N)C(=O)N[C@@H](Cn1cnc2ccccc21)c1ccc(F)cc1	ZINC000357830209	457703648	/nfs/dbraw/zinc/70/36/48/457703648.db2.gz	PLPUKYOQCJHAKY-GUYCJALGSA-N	0	3	336.370	3.193	20	30		EGEDHN
CN(Cc1ccccc1)[C@H]1CCN(C(=O)Nc2ccc(CC#N)cc2)C1	ZINC000365616434	457766157	/nfs/dbraw/zinc/76/61/57/457766157.db2.gz	AGVCLHOYJJMUOL-FQEVSTJZSA-N	0	3	348.450	3.491	20	30		EGEDHN
C=CCOc1ccc(CN2CCC3(CCN(C)C3=O)CC2)cc1Cl	ZINC000365830721	457778572	/nfs/dbraw/zinc/77/85/72/457778572.db2.gz	LNSIDOCWIJRDEN-UHFFFAOYSA-N	0	3	348.874	3.349	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCc1ccc(N2CCCC2)nc1	ZINC000433221177	457782431	/nfs/dbraw/zinc/78/24/31/457782431.db2.gz	SHRVCMOJXZGESJ-IBGZPJMESA-N	0	3	348.450	3.071	20	30		EGEDHN
CN1CCC(CC(=O)N2CCC[C@@H]2[C@H](C#N)c2ccccc2)CC1	ZINC000365959602	457785821	/nfs/dbraw/zinc/78/58/21/457785821.db2.gz	AYWQWMMZPQLZSU-RTBURBONSA-N	0	3	325.456	3.017	20	30		EGEDHN
C=C[C@@H]1CCCCN1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C	ZINC000426243185	457794535	/nfs/dbraw/zinc/79/45/35/457794535.db2.gz	ZOTBTZMURWRYSG-UHOSZYNNSA-N	0	3	327.472	3.257	20	30		EGEDHN
CN(CCNC(=O)[C@@H](C#N)CCc1ccccc1)Cc1ccccc1	ZINC000433305005	457803590	/nfs/dbraw/zinc/80/35/90/457803590.db2.gz	OTFYAJLZKTTYCE-HXUWFJFHSA-N	0	3	335.451	3.007	20	30		EGEDHN
CCc1nc(CCNC(=O)C(C#N)CCc2ccccc2)cs1	ZINC000433343636	457814879	/nfs/dbraw/zinc/81/48/79/457814879.db2.gz	OQQRKFXDVOXIRK-HNNXBMFYSA-N	0	3	327.453	3.137	20	30		EGEDHN
CN(C)Cc1ccccc1CNC(=O)[C@H](C#N)CCc1ccccc1	ZINC000433340664	457815031	/nfs/dbraw/zinc/81/50/31/457815031.db2.gz	FPVFAASJNOARQG-SFHVURJKSA-N	0	3	335.451	3.137	20	30		EGEDHN
C[C@H](c1ccc(S(N)(=O)=O)cc1)N(C)CCC1(C#N)CCCCC1	ZINC000411155530	457815009	/nfs/dbraw/zinc/81/50/09/457815009.db2.gz	NSJVGTSVAKIPHL-OAHLLOKOSA-N	0	3	349.500	3.191	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCCCCNc1ccccn1	ZINC000433340093	457815184	/nfs/dbraw/zinc/81/51/84/457815184.db2.gz	ACNXHTBZVQLXPB-GOSISDBHSA-N	0	3	336.439	3.162	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2cnc(-c3ccccc3)nc2C)nc(C)n1	ZINC000361670652	457816167	/nfs/dbraw/zinc/81/61/67/457816167.db2.gz	KNINSTWHUOQRFM-MRXNPFEDSA-N	0	3	343.390	3.349	20	30		EGEDHN
C[C@H](CNC(=O)C(C#N)CCc1ccccc1)Oc1ccccc1F	ZINC000433379209	457824599	/nfs/dbraw/zinc/82/45/99/457824599.db2.gz	SVXSSUWMEZDVHT-NVXWUHKLSA-N	0	3	340.398	3.482	20	30		EGEDHN
Cc1cc(CN[C@@H]2CC(=O)N([C@H]3C[C@@H]3c3ccccc3)C2)ccc1C#N	ZINC000443981750	457833161	/nfs/dbraw/zinc/83/31/61/457833161.db2.gz	BNNDJYKLBLQYRU-NJYVYQBISA-N	0	3	345.446	3.113	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)[C@@H]1C[C@H]1c1cccc(O)c1)C(C)C	ZINC000411371864	457867362	/nfs/dbraw/zinc/86/73/62/457867362.db2.gz	ZAPBAXGQYAXPQS-ZCNNSNEGSA-N	0	3	342.483	3.311	20	30		EGEDHN
COc1ccc(CN2CCCOC(C)(C)C2)cc1OCCCC#N	ZINC000371331460	457869341	/nfs/dbraw/zinc/86/93/41/457869341.db2.gz	IAFJHPDPQRGVNJ-UHFFFAOYSA-N	0	3	332.444	3.379	20	30		EGEDHN
CN(Cc1c(F)cccc1F)C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000358324053	457933580	/nfs/dbraw/zinc/93/35/80/457933580.db2.gz	OUZIUXCIGJRXOV-HNNXBMFYSA-N	0	3	339.345	3.177	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Nc1cccc2c1CCO2)C(C)C	ZINC000434230130	457963214	/nfs/dbraw/zinc/96/32/14/457963214.db2.gz	VLBBDFSQUHQWFN-SFHVURJKSA-N	0	3	343.471	3.442	20	30		EGEDHN
C=CC[C@@H]1N(CC(=O)NCc2cccc(C#N)c2)CCCC1(C)C	ZINC000444786096	457976698	/nfs/dbraw/zinc/97/66/98/457976698.db2.gz	MZYABYHTFWOOTF-SFHVURJKSA-N	0	3	325.456	3.241	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN2CCC[C@](O)(C(F)(F)F)CC2)cc1	ZINC000368051456	458008100	/nfs/dbraw/zinc/00/81/00/458008100.db2.gz	MVFWKWHQFBUOJJ-CZUORRHYSA-N	0	3	342.361	3.257	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NC1CCN(Cc2cccc(C)c2)CC1	ZINC000368082213	458010171	/nfs/dbraw/zinc/01/01/71/458010171.db2.gz	UAKQFZSQGDIKFQ-UHFFFAOYSA-N	0	3	346.474	3.300	20	30		EGEDHN
N#Cc1cccc(C(=O)N2C[C@H]3CN(Cc4ccccc4)CC[C@@H]3C2)c1	ZINC000368130565	458013362	/nfs/dbraw/zinc/01/33/62/458013362.db2.gz	CXNIYPJEVHPZNT-NHCUHLMSSA-N	0	3	345.446	3.152	20	30		EGEDHN
COC1([C@@H](C)NCC(=O)N(CCC#N)c2cccc(Cl)c2)CCC1	ZINC000412020715	458048108	/nfs/dbraw/zinc/04/81/08/458048108.db2.gz	LVKPNFYYHROUSO-CQSZACIVSA-N	0	3	349.862	3.134	20	30		EGEDHN
C=CCC[C@H](N[C@H]1CCN(c2ccccc2C(N)=O)C1)c1ccco1	ZINC000375789146	458065127	/nfs/dbraw/zinc/06/51/27/458065127.db2.gz	KJARUKQBQDATKQ-RDJZCZTQSA-N	0	3	339.439	3.254	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cccc(CN3CCCCC3)c2)CC1	ZINC000412049763	458066294	/nfs/dbraw/zinc/06/62/94/458066294.db2.gz	ZPJZZQUBQHBLJW-UHFFFAOYSA-N	0	3	341.499	3.053	20	30		EGEDHN
CNC(=O)NC1CCN(Cc2ccc(-c3ccccc3C#N)cc2)CC1	ZINC000412051204	458068982	/nfs/dbraw/zinc/06/89/82/458068982.db2.gz	BMBRWFVTSKPQQB-UHFFFAOYSA-N	0	3	348.450	3.119	20	30		EGEDHN
C[C@@H](N[C@@H]1C[C@H](OC(C)(C)C)C1(C)C)C(=O)Nc1ccccc1C#N	ZINC000412090084	458086080	/nfs/dbraw/zinc/08/60/80/458086080.db2.gz	YOFOEXJAKWRALA-XYPHTWIQSA-N	0	3	343.471	3.457	20	30		EGEDHN
COc1cc(CN2CC[C@@H](n3ncc4ccccc43)C2)ccc1C#N	ZINC000369117034	458088465	/nfs/dbraw/zinc/08/84/65/458088465.db2.gz	PADHYUIMZJEBMD-GOSISDBHSA-N	0	3	332.407	3.364	20	30		EGEDHN
C=C(C)[C@@H](NC(=O)NCC1(N(C)C)CCC1)c1ccc(F)c(F)c1	ZINC000445861360	458104411	/nfs/dbraw/zinc/10/44/11/458104411.db2.gz	AOZULIFYTUXOGX-MRXNPFEDSA-N	0	3	337.414	3.366	20	30		EGEDHN
CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)NCC(C)(C)CC#N	ZINC000458658149	458126542	/nfs/dbraw/zinc/12/65/42/458126542.db2.gz	VBDMXODAPHOWNK-SFHVURJKSA-N	0	3	344.503	3.382	20	30		EGEDHN
Cc1ccc(C)c(OCCN2CC[C@@H](Oc3ccc(C#N)cn3)C2)c1	ZINC000428778012	458209754	/nfs/dbraw/zinc/20/97/54/458209754.db2.gz	HWOHKWLHWUEPJR-GOSISDBHSA-N	0	3	337.423	3.102	20	30		EGEDHN
C=C(CC)CNC(=O)N1C[C@@H]2CCN(Cc3ccccc3)C[C@H]2C1	ZINC000459103873	458266331	/nfs/dbraw/zinc/26/63/31/458266331.db2.gz	UYAXVINHRVDFPM-OALUTQOASA-N	0	3	327.472	3.116	20	30		EGEDHN
COCCN(C)CC[C@H](Nc1ncc(C#N)cc1F)c1ccccc1	ZINC000413122167	458292194	/nfs/dbraw/zinc/29/21/94/458292194.db2.gz	JDCYVHMARNGQHE-SFHVURJKSA-N	0	3	342.418	3.214	20	30		EGEDHN
COc1ccc2c(c1)OC[C@@H](NCc1ccc(O[C@H](C)C#N)cc1)C2	ZINC000372428404	458302579	/nfs/dbraw/zinc/30/25/79/458302579.db2.gz	OGJGJBAVSXMZLX-PBHICJAKSA-N	0	3	338.407	3.079	20	30		EGEDHN
Cc1ccc([C@@H]2CCC[C@H]2N(C)CC(=O)NC2(C#N)CCC2)cc1	ZINC000372613598	458308138	/nfs/dbraw/zinc/30/81/38/458308138.db2.gz	ZQXKZDOOBWBMAD-ZWKOTPCHSA-N	0	3	325.456	3.125	20	30		EGEDHN
N#CC(C(=O)c1cnc2ccccc2c1)c1nnc2n1CCCCC2	ZINC000459321294	458328162	/nfs/dbraw/zinc/32/81/62/458328162.db2.gz	ZVVQAQGUKXLFDI-OAHLLOKOSA-N	0	3	331.379	3.043	20	30		EGEDHN
C=CC[C@@H](CC)NC(=O)c1cnn(CCN(C)C)c1-c1ccccc1	ZINC000415630577	458332369	/nfs/dbraw/zinc/33/23/69/458332369.db2.gz	WNOSULPGLMXCOS-QGZVFWFLSA-N	0	3	340.471	3.196	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N[C@H](CO)CC1CCCCC1	ZINC000416325331	458342479	/nfs/dbraw/zinc/34/24/79/458342479.db2.gz	KADPMECTOPUWBP-OALUTQOASA-N	0	3	328.456	3.206	20	30		EGEDHN
C[C@@H](N[C@@H]1CCCc2cc(C#N)ccc21)c1ccc(-n2cnnn2)cc1	ZINC000417360047	458362748	/nfs/dbraw/zinc/36/27/48/458362748.db2.gz	HKZXVLCUIAQMRZ-JLTOFOAXSA-N	0	3	344.422	3.262	20	30		EGEDHN
C=C(C)COc1cc(CN[C@H]2CCN(CC(F)F)C2)ccc1OC	ZINC000418141985	458372702	/nfs/dbraw/zinc/37/27/02/458372702.db2.gz	XMZYKFSNKNJBIA-HNNXBMFYSA-N	0	3	340.414	3.079	20	30		EGEDHN
C=CCC(C)(C)CN[C@H](Cc1ccc(C(F)(F)F)cc1)C(N)=O	ZINC000419189346	458379683	/nfs/dbraw/zinc/37/96/83/458379683.db2.gz	UEDNIKCVMKYZTB-CQSZACIVSA-N	0	3	328.378	3.294	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)NCC1(C#N)CCC1)c1ccccc1	ZINC000419407979	458381812	/nfs/dbraw/zinc/38/18/12/458381812.db2.gz	XETLPYCJZXHDIJ-QGZVFWFLSA-N	0	3	328.460	3.063	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC(C)(C)Cc2ccc(C)cc2)CC1	ZINC000419456077	458382393	/nfs/dbraw/zinc/38/23/93/458382393.db2.gz	RKGWHESBSBDHHR-UHFFFAOYSA-N	0	3	329.488	3.266	20	30		EGEDHN
N#C[C@]1(C(=O)NCCCN2CCc3ccccc3C2)CC12CCCC2	ZINC000448675910	458404674	/nfs/dbraw/zinc/40/46/74/458404674.db2.gz	PDHRFULZNGSMST-NRFANRHFSA-N	0	3	337.467	3.025	20	30		EGEDHN
C=CCOc1ccc(CC(=O)NCCN(C)Cc2ccccc2)cc1	ZINC000448776955	458410178	/nfs/dbraw/zinc/41/01/78/458410178.db2.gz	ITCUKQHUEOFJEO-UHFFFAOYSA-N	0	3	338.451	3.042	20	30		EGEDHN
C=C(C)COc1cc(CN[C@H](C(=O)N(C)CC)C(C)C)ccc1OC	ZINC000449441261	458424698	/nfs/dbraw/zinc/42/46/98/458424698.db2.gz	QBIGOZZLSGRLHM-IBGZPJMESA-N	0	3	348.487	3.243	20	30		EGEDHN
N#CCCn1cc(CN2C[C@@H](C3CC3)[C@H]2C2CC2)c(-c2ccncc2)n1	ZINC000449543139	458426724	/nfs/dbraw/zinc/42/67/24/458426724.db2.gz	SEPNDFOETNTRPW-PZJWPPBQSA-N	0	3	347.466	3.479	20	30		EGEDHN
Cc1cc(CN[C@@H]2C[C@@H](OC(C)(C)C)[C@@H]2n2cccn2)ccc1C#N	ZINC000449657466	458428973	/nfs/dbraw/zinc/42/89/73/458428973.db2.gz	PEMQQFNSJNKBDT-GUDVDZBRSA-N	0	3	338.455	3.350	20	30		EGEDHN
C=CCNC(=O)Nc1ccc(NC(=O)[C@H](N)CC2CCCCC2)cc1	ZINC000422957732	458429405	/nfs/dbraw/zinc/42/94/05/458429405.db2.gz	VGUIOHPFQPENAD-QGZVFWFLSA-N	0	3	344.459	3.230	20	30		EGEDHN
C=CCC[C@H](CO)NCC1=Cc2cc(Br)ccc2OC1	ZINC000449702592	458429900	/nfs/dbraw/zinc/42/99/00/458429900.db2.gz	ZFIVBLKFKMRMOV-OAHLLOKOSA-N	0	3	338.245	3.142	20	30		EGEDHN
C[C@@H]1C[C@]1(C#N)C(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000450162823	458440448	/nfs/dbraw/zinc/44/04/48/458440448.db2.gz	RCASUWLYPFAPRD-DNVCBOLYSA-N	0	3	327.428	3.040	20	30		EGEDHN
CN(CCN1CCC[C@@]2(CCCCO2)[C@@H]1C#N)Cc1ccccc1	ZINC000450883145	458459508	/nfs/dbraw/zinc/45/95/08/458459508.db2.gz	PCPLCGVHJFWMNE-PMACEKPBSA-N	0	3	327.472	3.046	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC(=O)N(Cc1ccccc1)C(C)(C)C	ZINC000451677639	458485533	/nfs/dbraw/zinc/48/55/33/458485533.db2.gz	VFMBMVCLPGNJSJ-MSOLQXFVSA-N	0	3	330.472	3.137	20	30		EGEDHN
C[C@](CO)(NCCCSCC#N)c1cc(Cl)cc(Cl)c1	ZINC000451912066	458490715	/nfs/dbraw/zinc/49/07/15/458490715.db2.gz	ONYPPNQLKGEVNX-CQSZACIVSA-N	0	3	333.284	3.437	20	30		EGEDHN
C=CCN1CC[C@@H](N2CCC(Cc3cccc(F)c3F)CC2)C1=O	ZINC000451955004	458491686	/nfs/dbraw/zinc/49/16/86/458491686.db2.gz	CELMADRCCDPMDZ-QGZVFWFLSA-N	0	3	334.410	3.006	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@@H]1CCC[C@H]1OCC	ZINC000452029706	458492869	/nfs/dbraw/zinc/49/28/69/458492869.db2.gz	YYTFMALWMHIESO-GDBMZVCRSA-N	0	3	334.485	3.450	20	30		EGEDHN
COC(=O)[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@@H]1c1ccccc1	ZINC000452006325	458492974	/nfs/dbraw/zinc/49/29/74/458492974.db2.gz	NWXPVAJCCDYHEU-QZTJIDSGSA-N	0	3	338.382	3.086	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N1CCC(F)(F)[C@H](C)C1)C(C)C	ZINC000460129943	458501403	/nfs/dbraw/zinc/50/14/03/458501403.db2.gz	WTNIPSOCVFEADG-CVEARBPZSA-N	0	3	343.462	3.372	20	30		EGEDHN
C=C(CC)CN[C@H](CC)c1ccc(Cl)c(S(=O)(=O)NC)c1	ZINC000453368501	458524677	/nfs/dbraw/zinc/52/46/77/458524677.db2.gz	QOBWBLXNIHOMAQ-CQSZACIVSA-N	0	3	330.881	3.255	20	30		EGEDHN
CC(C#N)C(=O)N1CCC[C@@H](Nc2cccc(Br)c2)C1	ZINC000468575909	458528390	/nfs/dbraw/zinc/52/83/90/458528390.db2.gz	OQMLSIMFPDDLNO-BXUZGUMPSA-N	0	3	336.233	3.012	20	30		EGEDHN
C=C(C)Cn1c(N2CCN([C@@H]3C[C@H]3C)C[C@H](C)C2)nnc1C(C)(C)C	ZINC000453457853	458531552	/nfs/dbraw/zinc/53/15/52/458531552.db2.gz	YEOJHENYYRBMPF-GVDBMIGSSA-N	0	3	345.535	3.318	20	30		EGEDHN
CC[C@H](Cc1ccccc1)N(CC)CC(=O)N(CC)C[C@H](C)C#N	ZINC000468916817	458543984	/nfs/dbraw/zinc/54/39/84/458543984.db2.gz	JFCRRPSBHXFGIS-IEBWSBKVSA-N	0	3	329.488	3.338	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N(CCc1ccccc1)Cc1ccccc1	ZINC000424082126	458554245	/nfs/dbraw/zinc/55/42/45/458554245.db2.gz	VUTNWNKNDNSPAK-FQEVSTJZSA-N	0	3	335.451	3.279	20	30		EGEDHN
C[C@@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)[C@H](N)CCCC#N	ZINC000424085934	458555740	/nfs/dbraw/zinc/55/57/40/458555740.db2.gz	CYEYABQQIOZIRY-SMDDNHRTSA-N	0	3	327.350	3.246	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N(Cc1ccccc1C(F)(F)F)C1CC1	ZINC000424089681	458557177	/nfs/dbraw/zinc/55/71/77/458557177.db2.gz	IBAINKBQMVYRLF-HNNXBMFYSA-N	0	3	339.361	3.218	20	30		EGEDHN
Cc1ccc(Cc2cnc(NC(=O)[C@@H](N)CCCC#N)s2)cc1C	ZINC000424095591	458557219	/nfs/dbraw/zinc/55/72/19/458557219.db2.gz	XJNYNUSWYKZGND-INIZCTEOSA-N	0	3	342.468	3.310	20	30		EGEDHN
Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)[C@H](N)CCCC#N	ZINC000424106652	458560074	/nfs/dbraw/zinc/56/00/74/458560074.db2.gz	SQGYGSCEHPURCX-IUODEOHRSA-N	0	3	342.468	3.317	20	30		EGEDHN
COc1ccc(CCN(CC(C)(C)C)C(=O)[C@H](N)CCCC#N)cc1	ZINC000424121086	458562935	/nfs/dbraw/zinc/56/29/35/458562935.db2.gz	HYLVDHJRNKUTNI-GOSISDBHSA-N	0	3	345.487	3.134	20	30		EGEDHN
Cn1c2ccccc2nc1-c1ccc(NC(=O)[C@H](N)CCCC#N)cc1	ZINC000424145770	458570093	/nfs/dbraw/zinc/57/00/93/458570093.db2.gz	ZJDFBMANZAOFKG-MRXNPFEDSA-N	0	3	347.422	3.200	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NC[C@@H]1CCOc2ccccc21	ZINC000469644879	458581997	/nfs/dbraw/zinc/58/19/97/458581997.db2.gz	PHDDKRJABMZAGO-ROUUACIJSA-N	0	3	334.419	3.441	20	30		EGEDHN
C=C(CC)CNC(=O)N1CC[C@@]2(CCN(Cc3ccccc3)C2)C1	ZINC000455550853	458603496	/nfs/dbraw/zinc/60/34/96/458603496.db2.gz	ZBTKIDRPHDZGDX-HXUWFJFHSA-N	0	3	327.472	3.260	20	30		EGEDHN
C=CCn1cc(CN[C@@H]2CCCC[C@H]2c2ccc(OC)c(F)c2)nn1	ZINC000424297270	458608202	/nfs/dbraw/zinc/60/82/02/458608202.db2.gz	QBFWLIKLHBTNAV-FUHWJXTLSA-N	0	3	344.434	3.428	20	30		EGEDHN
C[C@@H]1C[C@H](CNC(=O)OC(C)(C)C)CN1Cc1cccc(C#N)c1	ZINC000493988827	458611922	/nfs/dbraw/zinc/61/19/22/458611922.db2.gz	LOYVTGZAZQBDDI-RHSMWYFYSA-N	0	3	329.444	3.293	20	30		EGEDHN
CN(C)[C@@H](CNC(=O)Nc1cccc(CC#N)c1)Cc1ccccc1	ZINC000455947471	458623874	/nfs/dbraw/zinc/62/38/74/458623874.db2.gz	OCAJZMGJQZVYPD-LJQANCHMSA-N	0	3	336.439	3.047	20	30		EGEDHN
Cc1cc(C#N)cc(NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000456000969	458626817	/nfs/dbraw/zinc/62/68/17/458626817.db2.gz	LPTFVXVWFCBQDX-SFHVURJKSA-N	0	3	334.423	3.263	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)[C@H](CC)c2ccccc2OC)CC1	ZINC000494156983	458634505	/nfs/dbraw/zinc/63/45/05/458634505.db2.gz	PMJOERHJMZUQKN-GOSISDBHSA-N	0	3	345.487	3.438	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCCN1CCN(C)C[C@H]1c1ccccc1	ZINC000424586469	458671248	/nfs/dbraw/zinc/67/12/48/458671248.db2.gz	TUGGNJLMVPYSRK-IBGZPJMESA-N	0	3	343.515	3.084	20	30		EGEDHN
C=C(C)COc1cccc(NC2CCN(CCCC(=O)OC)CC2)c1	ZINC000463293531	458690304	/nfs/dbraw/zinc/69/03/04/458690304.db2.gz	KLFXWYNTJCPIIH-UHFFFAOYSA-N	0	3	346.471	3.471	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)NCc1ccc(C)cc1)C(C)C	ZINC000503439360	458708204	/nfs/dbraw/zinc/70/82/04/458708204.db2.gz	RYUUIUHDQOXJAG-LJQANCHMSA-N	0	3	329.488	3.493	20	30		EGEDHN
Cn1cc2c(n1)CCC[C@@H]2NCCSCc1ccccc1C#N	ZINC000530352010	458753208	/nfs/dbraw/zinc/75/32/08/458753208.db2.gz	MAKIOEURCAWZMG-KRWDZBQOSA-N	0	3	326.469	3.192	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H]1CCC(C)(C)C1	ZINC000511395429	458777472	/nfs/dbraw/zinc/77/74/72/458777472.db2.gz	DKKAGIQKOABMDT-GOSISDBHSA-N	0	3	342.487	3.210	20	30		EGEDHN
CN1CCC(Oc2ccc(Cl)cc2NC(=O)CCCC#N)CC1	ZINC000456791655	458782949	/nfs/dbraw/zinc/78/29/49/458782949.db2.gz	NJZCZXJEIPNDEM-UHFFFAOYSA-N	0	3	335.835	3.445	20	30		EGEDHN
C[C@H]1C[C@@H](N(C)C(=O)NCC(C)(C)C#N)CCN1Cc1ccccc1	ZINC000512797236	458788540	/nfs/dbraw/zinc/78/85/40/458788540.db2.gz	JUCFUQOEHFCFJW-WMZOPIPTSA-N	0	3	342.487	3.231	20	30		EGEDHN
C=CCN(C(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C)C1CC1	ZINC000512911414	458789956	/nfs/dbraw/zinc/78/99/56/458789956.db2.gz	GGOOXVCGNKWWSN-LJQANCHMSA-N	0	3	345.487	3.437	20	30		EGEDHN
C=CC[C@@H](CC)NC(=O)C(=O)Nc1cccc(CN2CCCCC2)c1	ZINC000440255157	458798907	/nfs/dbraw/zinc/79/89/07/458798907.db2.gz	LGHURAHCRKVRCO-QGZVFWFLSA-N	0	3	343.471	3.082	20	30		EGEDHN
CC1(C)[C@H](c2ccccc2)CCN1Cc1cnc2c(C#N)cnn2c1	ZINC000515384147	458808682	/nfs/dbraw/zinc/80/86/82/458808682.db2.gz	ALYVGSVFCOVENR-SFHVURJKSA-N	0	3	331.423	3.369	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN1C[C@H](c2ccccc2)C(C)(C)C1	ZINC000441097065	458888116	/nfs/dbraw/zinc/88/81/16/458888116.db2.gz	YGHWCYXHFSMGMP-FUHWJXTLSA-N	0	3	327.472	3.120	20	30		EGEDHN
CC(C)N(CCC#N)C(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F	ZINC000552063419	458890487	/nfs/dbraw/zinc/89/04/87/458890487.db2.gz	IZERUHONGPXRKZ-QGZVFWFLSA-N	0	3	349.425	3.294	20	30		EGEDHN
C=CCn1c(CC2CCCCC2)nnc1N(C)[C@@H]1CCN(C2CC2)C1	ZINC000554931466	458902065	/nfs/dbraw/zinc/90/20/65/458902065.db2.gz	CYXRVVDKBWAGLF-GOSISDBHSA-N	0	3	343.519	3.260	20	30		EGEDHN
COC(=O)C(C)(C)CCNCC#Cc1ccc(C(F)(F)F)cc1	ZINC000474867124	458904541	/nfs/dbraw/zinc/90/45/41/458904541.db2.gz	HAIKJBATQOAVFK-UHFFFAOYSA-N	0	3	327.346	3.236	20	30		EGEDHN
C=C(C)Cn1c(C2CCCC2)nnc1N1CCN(C)[C@H](C(C)C)C1	ZINC000555269694	458905047	/nfs/dbraw/zinc/90/50/47/458905047.db2.gz	SEIKTFKCPIJSOW-KRWDZBQOSA-N	0	3	331.508	3.288	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccc(C(C)(C)C#N)cc1)N1CCCC[C@H]1C	ZINC000474890226	458905387	/nfs/dbraw/zinc/90/53/87/458905387.db2.gz	UGEPHKRMWGFUHI-CVEARBPZSA-N	0	3	327.472	3.480	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CCC[C@@H]1c1ccccn1	ZINC000531440557	458918914	/nfs/dbraw/zinc/91/89/14/458918914.db2.gz	NBKYRVKDOTVUNN-UYAOXDASSA-N	0	3	338.451	3.387	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)OC(C)(C)C)NCc1ccc(C#N)cc1F	ZINC000495691159	458921520	/nfs/dbraw/zinc/92/15/20/458921520.db2.gz	PZWNPINXLUGLJC-STQMWFEESA-N	0	3	335.423	3.479	20	30		EGEDHN
CC(C#N)C(=O)N(CCCNC(=O)OC(C)(C)C)CC1CCCC1	ZINC000495706579	458925155	/nfs/dbraw/zinc/92/51/55/458925155.db2.gz	NGOCZGFFBUTSQF-CQSZACIVSA-N	0	3	337.464	3.080	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CC[C@H](C(F)(F)F)C2(C)C)CC1	ZINC000468332940	459015242	/nfs/dbraw/zinc/01/52/42/459015242.db2.gz	UVXIKMLIQVLYBL-AWEZNQCLSA-N	0	3	347.425	3.399	20	30		EGEDHN
CN1CCCC(C)(C)[C@H]1CNC(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000477147291	459032773	/nfs/dbraw/zinc/03/27/73/459032773.db2.gz	GVIBGDVXPHHJMM-QGZVFWFLSA-N	0	3	327.472	3.338	20	30		EGEDHN
CN1CCCC(C)(C)[C@@H]1CNC(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000477147284	459033067	/nfs/dbraw/zinc/03/30/67/459033067.db2.gz	GVIBGDVXPHHJMM-KRWDZBQOSA-N	0	3	327.472	3.338	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1C)C(C)C	ZINC000496014676	459037729	/nfs/dbraw/zinc/03/77/29/459037729.db2.gz	PONCOGHMMBGKIY-SFHVURJKSA-N	0	3	345.443	3.332	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@@H]1NC[C@H](C#N)CCC#N	ZINC000496043333	459047833	/nfs/dbraw/zinc/04/78/33/459047833.db2.gz	JPGMNXBECFQBLE-JYJNAYRXSA-N	0	3	334.464	3.103	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)s1)[C@H]1CCCN1C(=O)OC(C)(C)C	ZINC000496137148	459082091	/nfs/dbraw/zinc/08/20/91/459082091.db2.gz	MAANJSUUFZKAFF-IUODEOHRSA-N	0	3	335.473	3.497	20	30		EGEDHN
Cn1ncc(C2CC2)c1CNCCSCc1ccccc1C#N	ZINC000594917925	459175788	/nfs/dbraw/zinc/17/57/88/459175788.db2.gz	LZWDYHXOXUIXTA-UHFFFAOYSA-N	0	3	326.469	3.192	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H]2CCC[C@H]([S@@](C)=O)C2)cc1OC	ZINC000594969490	459200210	/nfs/dbraw/zinc/20/02/10/459200210.db2.gz	ZTBZRXIVDHJEKJ-VBURHUQHSA-N	0	3	337.485	3.039	20	30		EGEDHN
C[C@@H]1CCN(C)CCN1C(=O)c1ccc(C#Cc2ccccc2)cc1	ZINC000522188597	459226354	/nfs/dbraw/zinc/22/63/54/459226354.db2.gz	URXMFVWECIUNBM-GOSISDBHSA-N	0	3	332.447	3.253	20	30		EGEDHN
CC(C#N)C(=O)N[C@H](CCCNC(=O)OC(C)(C)C)c1ccccc1	ZINC000496551557	459237589	/nfs/dbraw/zinc/23/75/89/459237589.db2.gz	SEUMXXQQRSXVNT-GOEBONIOSA-N	0	3	345.443	3.308	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N1CCC(CCC#N)CC1)C(C)C	ZINC000580643046	459262378	/nfs/dbraw/zinc/26/23/78/459262378.db2.gz	ROVOUCMPOKBXNK-IBGZPJMESA-N	0	3	346.519	3.410	20	30		EGEDHN
N#CC1(CCN2CCC(C(N)=O)(c3ccccc3)CC2)CCCCC1	ZINC000591014698	459294086	/nfs/dbraw/zinc/29/40/86/459294086.db2.gz	DUZXPWCLSREYJC-UHFFFAOYSA-N	0	3	339.483	3.370	20	30		EGEDHN
CN(CCC1CCN(c2ccncc2)CC1)c1ncc(C#N)cc1F	ZINC000591153870	459324499	/nfs/dbraw/zinc/32/44/99/459324499.db2.gz	FETPINMFIQKORT-UHFFFAOYSA-N	0	3	339.418	3.230	20	30		EGEDHN
N#CCSCCCN1CCCN(c2cccc(F)c2F)CC1	ZINC000595505978	459326688	/nfs/dbraw/zinc/32/66/88/459326688.db2.gz	AQTTYPHPNDJLFH-UHFFFAOYSA-N	0	3	325.428	3.124	20	30		EGEDHN
N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)Nc1cccc(CN)c1	ZINC000591309993	459350141	/nfs/dbraw/zinc/35/01/41/459350141.db2.gz	XVADPWPZDFUHQW-RTBURBONSA-N	0	3	334.423	3.449	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC(=Nn2cnnc2)C[C@@H]1c1ccccc1	ZINC000496876595	459355367	/nfs/dbraw/zinc/35/53/67/459355367.db2.gz	RBJPQXMGYGAMAW-MRXNPFEDSA-N	0	3	341.415	3.254	20	30		EGEDHN
CC[C@H](CN1CCCC1)NC(=O)N[C@@H]1CCCc2cc(C#N)ccc21	ZINC000591391204	459368940	/nfs/dbraw/zinc/36/89/40/459368940.db2.gz	QMMYBPIVYWSLQA-IEBWSBKVSA-N	0	3	340.471	3.109	20	30		EGEDHN
C=CCNC(=O)NC(=O)CN[C@@H](c1ccc(Cl)cc1)[C@H](C)CC	ZINC000538214726	459369694	/nfs/dbraw/zinc/36/96/94/459369694.db2.gz	JOLQJJXJQLXSAU-MLGOLLRUSA-N	0	3	337.851	3.029	20	30		EGEDHN
N#CC[C@H]1CCCN(C[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000595619537	459372467	/nfs/dbraw/zinc/37/24/67/459372467.db2.gz	CQSOXTULDLFKHD-KGLIPLIRSA-N	0	3	342.361	3.071	20	30		EGEDHN
C=CC[C@H](C)[C@H](C)NCc1ccc(S(=O)(=O)N(CC)CC)s1	ZINC000539083304	459375136	/nfs/dbraw/zinc/37/51/36/459375136.db2.gz	LLILZHSXJPVDAS-KBPBESRZSA-N	0	3	344.546	3.469	20	30		EGEDHN
C=CC[C@H](CO)CNCc1cn(-c2ccccc2)nc1C(C)(C)C	ZINC000540324935	459379419	/nfs/dbraw/zinc/37/94/19/459379419.db2.gz	DUMQLEIOSFAUQW-INIZCTEOSA-N	0	3	327.472	3.444	20	30		EGEDHN
C[C@H](CNC(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1)N1CCCC[C@@H]1C	ZINC000560686605	459386894	/nfs/dbraw/zinc/38/68/94/459386894.db2.gz	WYMKRNJVIHOFIL-QGWWYQLQSA-N	0	3	325.456	3.041	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@H](CN[C@@H]1CCc2ccc(C#N)cc21)C1CC1	ZINC000496983876	459395229	/nfs/dbraw/zinc/39/52/29/459395229.db2.gz	ZURIUZXCSNXUDU-QZTJIDSGSA-N	0	3	341.455	3.438	20	30		EGEDHN
COC[C@H](NCCCC1(C#N)CCOCC1)c1cccc(OC)c1	ZINC000595684546	459396451	/nfs/dbraw/zinc/39/64/51/459396451.db2.gz	OIXHHBKWFJGNHQ-SFHVURJKSA-N	0	3	332.444	3.073	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2NC(=O)[C@H]1CCCN1C1CCCC1	ZINC000561089207	459418634	/nfs/dbraw/zinc/41/86/34/459418634.db2.gz	AACBVRGTXSHSKK-WOJBJXKFSA-N	0	3	337.467	3.459	20	30		EGEDHN
CCc1cccc(OC[C@@H](O)CN[C@@H]2CCc3cc(C#N)ccc32)c1	ZINC000591763700	459429992	/nfs/dbraw/zinc/42/99/92/459429992.db2.gz	CWAVXYOHYHFTDE-GHTZIAJQSA-N	0	3	336.435	3.137	20	30		EGEDHN
Cc1ccc(C)c(OC[C@H](O)CNCc2ccc(C#N)c(Cl)c2)c1	ZINC000591765762	459431233	/nfs/dbraw/zinc/43/12/33/459431233.db2.gz	GGGWDMFLOPFZDQ-QGZVFWFLSA-N	0	3	344.842	3.358	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1CCC[C@H]([C@@H]2CCCCO2)C1	ZINC000595790404	459442926	/nfs/dbraw/zinc/44/29/26/459442926.db2.gz	PSCOHGQINPUEIU-ROUUACIJSA-N	0	3	344.455	3.227	20	30		EGEDHN
CN(CCCN(C)c1cccc(-n2cccn2)c1C#N)Cc1ccco1	ZINC000569501033	459462683	/nfs/dbraw/zinc/46/26/83/459462683.db2.gz	DCGKRHBDKCMYJY-UHFFFAOYSA-N	0	3	349.438	3.295	20	30		EGEDHN
C[C@@H]1CN(C)CC[C@@H]1N(C)c1cc(Br)c(C#N)cc1F	ZINC000569824662	459516188	/nfs/dbraw/zinc/51/61/88/459516188.db2.gz	IXKSHXGSOLGVET-YGRLFVJLSA-N	0	3	340.240	3.236	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](Nc2ccc(Cl)c(C#N)n2)C1	ZINC000486932442	459524882	/nfs/dbraw/zinc/52/48/82/459524882.db2.gz	DEZRDRJOBFNZQN-HIFRSBDPSA-N	0	3	326.831	3.276	20	30		EGEDHN
C=CCn1c(C2CCCC2)nnc1N1CCN([C@@H]2C[C@H]2C)C[C@H](C)C1	ZINC000569901405	459526973	/nfs/dbraw/zinc/52/69/73/459526973.db2.gz	LXFXJPGFPIRDNJ-LZLYRXPVSA-N	0	3	343.519	3.288	20	30		EGEDHN
N#Cc1cccnc1OC1CCC([NH2+]Cc2cc([O-])cc(F)c2)CC1	ZINC000526083501	459544552	/nfs/dbraw/zinc/54/45/52/459544552.db2.gz	LHKNQJIHRJRCTQ-UHFFFAOYSA-N	0	3	341.386	3.278	20	30		EGEDHN
C[C@H](c1ccc(Cl)cc1)[C@@H](C)N(C)CC(=O)NC1(C#N)CCC1	ZINC000526135421	459554377	/nfs/dbraw/zinc/55/43/77/459554377.db2.gz	BYYIYKHWGJXOIA-UONOGXRCSA-N	0	3	333.863	3.326	20	30		EGEDHN
Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@H]2N[C@@H]2CC[C@H](C#N)C2)cc1	ZINC000570624919	459558401	/nfs/dbraw/zinc/55/84/01/459558401.db2.gz	WAFMLCQRVKETBS-ISARSNTHSA-N	0	3	346.496	3.362	20	30		EGEDHN
C[C@@]1(NC(=O)c2ccc(CC#N)cc2)CCN(Cc2ccccc2)C1	ZINC000571527614	459569348	/nfs/dbraw/zinc/56/93/48/459569348.db2.gz	LYCDMTYOYJUKRU-OAQYLSRUSA-N	0	3	333.435	3.147	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCCOc2cc(C)cc(C)c2)CC1	ZINC000592295117	459572543	/nfs/dbraw/zinc/57/25/43/459572543.db2.gz	AIYKNIBJIDJYOL-UHFFFAOYSA-N	0	3	345.487	3.022	20	30		EGEDHN
CC(C)Cn1nccc1CNCCSCc1ccccc1C#N	ZINC000592363365	459580814	/nfs/dbraw/zinc/58/08/14/459580814.db2.gz	XYVOTRYWCVACLE-UHFFFAOYSA-N	0	3	328.485	3.434	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N1CCC(c2c[nH]c3cc(F)ccc32)CC1	ZINC000572537132	459581048	/nfs/dbraw/zinc/58/10/48/459581048.db2.gz	ZKZUXQVXKVCXSZ-KRWDZBQOSA-N	0	3	342.418	3.034	20	30		EGEDHN
Cc1cccc(OC[C@H](O)CN[C@@H]2CCCc3cc(C#N)ccc32)c1	ZINC000572865825	459588008	/nfs/dbraw/zinc/58/80/08/459588008.db2.gz	FCJJLWWMVVGOQA-WIYYLYMNSA-N	0	3	336.435	3.274	20	30		EGEDHN
C#CCN(CC)C(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000490865583	459588456	/nfs/dbraw/zinc/58/84/56/459588456.db2.gz	FAIUGHSZLZNJJK-UHFFFAOYSA-N	0	3	329.444	3.038	20	30		EGEDHN
COc1ccc(CN(C)C)cc1NC(=O)/C=C\c1ccc(C#N)cc1	ZINC000491092698	459596957	/nfs/dbraw/zinc/59/69/57/459596957.db2.gz	NIKVVSKZFZSDMR-LUAWRHEFSA-N	0	3	335.407	3.280	20	30		EGEDHN
N#CC1(NC(=O)CN(CCc2ccccc2)C2CCCC2)CCC1	ZINC000527135712	459597695	/nfs/dbraw/zinc/59/76/95/459597695.db2.gz	UUJYHHXZJYHMFE-UHFFFAOYSA-N	0	3	325.456	3.036	20	30		EGEDHN
N#CCc1ccc(OC[C@H](O)CNCc2cc3ccccc3o2)cc1	ZINC000583824718	459603602	/nfs/dbraw/zinc/60/36/02/459603602.db2.gz	HJBSCELRGHDAEO-QGZVFWFLSA-N	0	3	336.391	3.028	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccc(OC3CCCC3)nc2)nc(C)n1	ZINC000542877170	459606598	/nfs/dbraw/zinc/60/65/98/459606598.db2.gz	OIRHNLDQDJRZQL-MRXNPFEDSA-N	0	3	336.395	3.300	20	30		EGEDHN
C=CCN1CC[C@H](N[C@H]2CCCC[C@H]2Oc2ccccc2C)C1=O	ZINC000499647629	459644897	/nfs/dbraw/zinc/64/48/97/459644897.db2.gz	QPDWKCYCINGDHE-JENIJYKNSA-N	0	3	328.456	3.062	20	30		EGEDHN
C[C@H](CN1CCC(C)CC1)NC(=O)Nc1cc(C#N)cn1C(C)(C)C	ZINC000596477349	459649932	/nfs/dbraw/zinc/64/99/32/459649932.db2.gz	XJOAZFMPIJMEIG-OAHLLOKOSA-N	0	3	345.491	3.357	20	30		EGEDHN
C[C@@H](CN1CCC(C)CC1)Nc1ncc(Br)cc1C#N	ZINC000596488457	459654443	/nfs/dbraw/zinc/65/44/43/459654443.db2.gz	PNIXWFRQVLMEHI-LBPRGKRZSA-N	0	3	337.265	3.248	20	30		EGEDHN
COC[C@H](NCC(=O)Nc1ccccc1S[C@H](C)CC#N)C(C)C	ZINC000543452134	459659240	/nfs/dbraw/zinc/65/92/40/459659240.db2.gz	KUYMSYGXWHYYDP-ZBFHGGJFSA-N	0	3	349.500	3.280	20	30		EGEDHN
C#C[C@@H](NC1CCN(c2cnccn2)CC1)c1ccc(Cl)cc1	ZINC000491752888	459667551	/nfs/dbraw/zinc/66/75/51/459667551.db2.gz	XGONCKFBJSFABM-QGZVFWFLSA-N	0	3	326.831	3.063	20	30		EGEDHN
N#C[C@H](c1cccc(Cl)c1)N1CCN(C[C@H]2CCCC[C@@H]2O)CC1	ZINC000584175470	459673889	/nfs/dbraw/zinc/67/38/89/459673889.db2.gz	AHJVXHHSJXTKKY-QRQLOZEOSA-N	0	3	347.890	3.073	20	30		EGEDHN
CN(C)CCN(Cc1cccs1)C(=O)/C=C\c1ccc(C#N)cc1	ZINC000492067578	459690929	/nfs/dbraw/zinc/69/09/29/459690929.db2.gz	LXCWJJNKXUBHJO-KTKRTIGZSA-N	0	3	339.464	3.223	20	30		EGEDHN
C#CCCN1CCC(NC(=O)/C=C\c2ccc3ccccc3c2)CC1	ZINC000492599585	459712865	/nfs/dbraw/zinc/71/28/65/459712865.db2.gz	XOANZLFUIJDMBG-LUAWRHEFSA-N	0	3	332.447	3.457	20	30		EGEDHN
C=CCOc1ccc(Br)cc1NC(=O)/C=C\CN(C)C	ZINC000493319729	459740682	/nfs/dbraw/zinc/74/06/82/459740682.db2.gz	KGNBHMNOMVEGSP-WAYWQWQTSA-N	0	3	339.233	3.070	20	30		EGEDHN
CC(C#N)C(=O)NCc1ccc([C@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000493445332	459745686	/nfs/dbraw/zinc/74/56/86/459745686.db2.gz	RROMEQXPZULFEZ-OLZOCXBDSA-N	0	3	331.416	3.048	20	30		EGEDHN
CN(C(=O)C(C[C@@H]1CCCO1)C(F)(F)F)c1ccc(C#N)cc1F	ZINC000593051827	459756354	/nfs/dbraw/zinc/75/63/54/459756354.db2.gz	ONKSRSCYBOXOKG-NWDGAFQWSA-N	0	3	344.308	3.408	20	30		EGEDHN
CCn1cc(CN(CCC(=O)Nc2sccc2C#N)C(C)C)cn1	ZINC000593083728	459768025	/nfs/dbraw/zinc/76/80/25/459768025.db2.gz	WTIKYQZAMIGETP-UHFFFAOYSA-N	0	3	345.472	3.075	20	30		EGEDHN
N#Cc1cc(F)ccc1NC(=O)C(C[C@H]1CCCO1)C(F)(F)F	ZINC000593083876	459768043	/nfs/dbraw/zinc/76/80/43/459768043.db2.gz	CQZWBLFVQQTFBV-NEPJUHHUSA-N	0	3	330.281	3.383	20	30		EGEDHN
N#CC1(c2ccccn2)CCN(CCc2ccc3c(c2)CCO3)CC1	ZINC000564188139	459771279	/nfs/dbraw/zinc/77/12/79/459771279.db2.gz	UQDNGFMENIHZOT-UHFFFAOYSA-N	0	3	333.435	3.116	20	30		EGEDHN
CCN1CCN(Cc2ccc(NC(=O)C(C#N)(CC)CC)cc2)CC1	ZINC000527941710	459777679	/nfs/dbraw/zinc/77/76/79/459777679.db2.gz	OEOPUIJFOWHCPS-UHFFFAOYSA-N	0	3	342.487	3.093	20	30		EGEDHN
CC(C)(CC#N)CNC[C@H](O)COc1ccc(Cl)cc1Cl	ZINC000564860555	459777858	/nfs/dbraw/zinc/77/78/58/459777858.db2.gz	RSQYOIFLVLCTSB-LBPRGKRZSA-N	0	3	331.243	3.263	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CCCc3ccccc3CC2)cc1	ZINC000584764127	459798070	/nfs/dbraw/zinc/79/80/70/459798070.db2.gz	NSOVUTGLSTUBPZ-OAQYLSRUSA-N	0	3	343.430	3.258	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)cc1	ZINC000584834251	459810598	/nfs/dbraw/zinc/81/05/98/459810598.db2.gz	GHHMKABKRJTDSD-KRWDZBQOSA-N	0	3	334.341	3.270	20	30		EGEDHN
C[C@@]1(NC(=O)NCc2ccc(C#N)cc2)CCN(Cc2ccccc2)C1	ZINC000593303993	459834932	/nfs/dbraw/zinc/83/49/32/459834932.db2.gz	FARCOQUULGPCDR-OAQYLSRUSA-N	0	3	348.450	3.022	20	30		EGEDHN
CN(C)CCN(Cc1ccccn1)Cc1ccccc1C(C)(C)C#N	ZINC000566424802	459865847	/nfs/dbraw/zinc/86/58/47/459865847.db2.gz	RBWXQIAHIDFYGB-UHFFFAOYSA-N	0	3	336.483	3.447	20	30		EGEDHN
CO[C@@H](CNC(=O)C(C#N)CCc1ccccc1)C1CCCCC1	ZINC000598437840	459898934	/nfs/dbraw/zinc/89/89/34/459898934.db2.gz	QJMDTWFINVRZPQ-OALUTQOASA-N	0	3	328.456	3.470	20	30		EGEDHN
COc1ccc(CN2CC[C@@H](OC(C)C)C2)cc1OCCCC#N	ZINC000575059608	459918290	/nfs/dbraw/zinc/91/82/90/459918290.db2.gz	ATKJGZUSLYHXBT-QGZVFWFLSA-N	0	3	332.444	3.377	20	30		EGEDHN
CC(C)[C@H]1CN(C(=O)c2cn(CCCC#N)c3ccccc23)CCN1	ZINC000598574439	459945293	/nfs/dbraw/zinc/94/52/93/459945293.db2.gz	RBTQHXZRIZHBEG-GOSISDBHSA-N	0	3	338.455	3.015	20	30		EGEDHN
N#CCc1ccc(OC[C@H](O)CN2CCCc3sccc3C2)cc1	ZINC000609338407	459947667	/nfs/dbraw/zinc/94/76/67/459947667.db2.gz	BEOCWPZNCIEPNH-QGZVFWFLSA-N	0	3	342.464	3.002	20	30		EGEDHN
CN(Cc1ccc(OC(F)(F)F)cc1)C[C@H](O)CC(C)(C)C#N	ZINC000598588032	459954526	/nfs/dbraw/zinc/95/45/26/459954526.db2.gz	YAGSHVPWVZVPEE-CYBMUJFWSA-N	0	3	330.350	3.318	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN1CCC[C@@H](c2nc3ccccc3o2)C1	ZINC000598594921	459957813	/nfs/dbraw/zinc/95/78/13/459957813.db2.gz	ODOHDYPUCIKODW-CABCVRRESA-N	0	3	327.428	3.308	20	30		EGEDHN
COC[C@@H](NC[C@H](O)CC(C)(C)C#N)c1cccc(C(F)(F)F)c1	ZINC000598599210	459959264	/nfs/dbraw/zinc/95/92/64/459959264.db2.gz	AVOUPSCFQPUSIR-HUUCEWRRSA-N	0	3	344.377	3.283	20	30		EGEDHN
CCCOc1ccc([C@@H](C)NC[C@H](O)CC(C)(C)C#N)cc1OC	ZINC000598603656	459960906	/nfs/dbraw/zinc/96/09/06/459960906.db2.gz	YDNNXROTBAXMBK-GDBMZVCRSA-N	0	3	334.460	3.435	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN[C@H](CCO)c1ccc(Cl)c(Cl)c1	ZINC000598617498	459965809	/nfs/dbraw/zinc/96/58/09/459965809.db2.gz	SQVNBYPUDLRICO-SWLSCSKDSA-N	0	3	345.270	3.307	20	30		EGEDHN
C[C@H](CC1(C#N)CCOCC1)NCc1ccc(-n2ccnc2)c(F)c1	ZINC000602520137	459979682	/nfs/dbraw/zinc/97/96/82/459979682.db2.gz	FJDXIPZBHLMWFP-OAHLLOKOSA-N	0	3	342.418	3.200	20	30		EGEDHN
CC1(C)[C@H](c2cccc(F)c2)CCN1C(=O)[C@H](N)CCCCC#N	ZINC000602552330	459993757	/nfs/dbraw/zinc/99/37/57/459993757.db2.gz	OKNFPEJYSDEXAJ-DLBZAZTESA-N	0	3	331.435	3.331	20	30		EGEDHN
CC(C#N)C(=O)N1CC2(CCCC2)c2cc3c(cc2[C@H]1C)OCCO3	ZINC000609620023	459996309	/nfs/dbraw/zinc/99/63/09/459996309.db2.gz	ASPRQUVZRDQIKP-UONOGXRCSA-N	0	3	340.423	3.332	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)c2nc3cc(F)ccc3s2)cn1	ZINC000609627618	459998557	/nfs/dbraw/zinc/99/85/57/459998557.db2.gz	VVGUMKRAIPCYRS-LLVKDONJSA-N	0	3	342.355	3.085	20	30		EGEDHN
Cc1cc2c(cc1C#N)[nH]nc2NC(=O)C[C@@H](c1ccccc1)N(C)C	ZINC000593844890	460000389	/nfs/dbraw/zinc/00/03/89/460000389.db2.gz	GNKNRAMGAPDUKQ-SFHVURJKSA-N	0	3	347.422	3.375	20	30		EGEDHN
CC(C)[C@](C)(Cc1ccc(Cl)cc1)NC(=O)[C@@H](N)CCCC#N	ZINC000602586799	460011897	/nfs/dbraw/zinc/01/18/97/460011897.db2.gz	VSSZICJVSBTLHQ-WMZOPIPTSA-N	0	3	335.879	3.435	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)C(=O)NC[C@H](c1ccccc1)N(C)C	ZINC000593943171	460022464	/nfs/dbraw/zinc/02/24/64/460022464.db2.gz	KFGVTSOVNDJKDO-OXJNMPFZSA-N	0	3	335.451	3.156	20	30		EGEDHN
CN(Cc1cccc(C#N)n1)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1	ZINC000602615208	460025138	/nfs/dbraw/zinc/02/51/38/460025138.db2.gz	WLFUHBFPWNIYBV-RTBURBONSA-N	0	3	325.387	3.444	20	30		EGEDHN
CC(C#N)C(=O)NCCOc1ccc2cc(Br)ccc2c1	ZINC000609921024	460040113	/nfs/dbraw/zinc/04/01/13/460040113.db2.gz	FDIUJCYLKUPDHE-LLVKDONJSA-N	0	3	347.212	3.257	20	30		EGEDHN
COCCCOc1ccc(CN[C@@H](C)CC2(C#N)CCOCC2)cc1	ZINC000602651120	460043398	/nfs/dbraw/zinc/04/33/98/460043398.db2.gz	PLFPUDYRNMWIMR-KRWDZBQOSA-N	0	3	346.471	3.290	20	30		EGEDHN
Cc1ncc([C@H](C)N(CCN(C)C)Cc2ccc(C#N)cc2)c(C)n1	ZINC000602659184	460049219	/nfs/dbraw/zinc/04/92/19/460049219.db2.gz	JNRPZOHOEKPVCW-INIZCTEOSA-N	0	3	337.471	3.090	20	30		EGEDHN
CCOC(=O)CCN(Cc1ccc(C#N)cc1OC(F)F)C(C)C	ZINC000594050393	460073689	/nfs/dbraw/zinc/07/36/89/460073689.db2.gz	GEOMUTRQBJCGPA-UHFFFAOYSA-N	0	3	340.370	3.323	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)N[C@H]1CCCN2CCCC[C@@H]12	ZINC000594071566	460086959	/nfs/dbraw/zinc/08/69/59/460086959.db2.gz	PSZBTJQWBAZWEU-RDJZCZTQSA-N	0	3	342.443	3.095	20	30		EGEDHN
CCC[C@H](CNCc1cn(C)nc1-c1ccc(C#N)cc1)OCC	ZINC000598989679	460118376	/nfs/dbraw/zinc/11/83/76/460118376.db2.gz	QPSYNVPCVLRBFS-GOSISDBHSA-N	0	3	326.444	3.254	20	30		EGEDHN
CCO[C@@H]1C[C@@H](N[C@H](C)C(=O)Nc2ccccc2C#N)C12CCCC2	ZINC000610345467	460126670	/nfs/dbraw/zinc/12/66/70/460126670.db2.gz	ZCLPJORTHOILLV-ZTFGCOKTSA-N	0	3	341.455	3.213	20	30		EGEDHN
N#CCC1(CN2CCC[C@H](C(=O)Nc3ccc(Cl)cn3)C2)CC1	ZINC000602790378	460126987	/nfs/dbraw/zinc/12/69/87/460126987.db2.gz	DQBCMZWPIWXPMU-ZDUSSCGKSA-N	0	3	332.835	3.079	20	30		EGEDHN
CCO[C@@H]1C[C@@H](N[C@H](C)C(=O)Nc2cccc(C#N)c2)C12CCCC2	ZINC000610345027	460127033	/nfs/dbraw/zinc/12/70/33/460127033.db2.gz	USLAIQHDNLGSHN-ZTFGCOKTSA-N	0	3	341.455	3.213	20	30		EGEDHN
CCO[C@@H]1C[C@H](N[C@H](C)C(=O)Nc2cccc(C#N)c2)C12CCCC2	ZINC000610345023	460127664	/nfs/dbraw/zinc/12/76/64/460127664.db2.gz	USLAIQHDNLGSHN-FHLIZLRMSA-N	0	3	341.455	3.213	20	30		EGEDHN
C[C@H](CNC(=O)N[C@@H](C)c1cccc(C#N)c1)N1CCCC[C@@H]1C	ZINC000610347631	460128456	/nfs/dbraw/zinc/12/84/56/460128456.db2.gz	XFGNRGZMXVDKKH-XHSDSOJGSA-N	0	3	328.460	3.181	20	30		EGEDHN
COc1cc(N[C@H]2CCCN(CC3(CC#N)CC3)C2)cc(OC)c1	ZINC000602796512	460130964	/nfs/dbraw/zinc/13/09/64/460130964.db2.gz	QALPWCYYJYFINO-HNNXBMFYSA-N	0	3	329.444	3.274	20	30		EGEDHN
C[C@H](CNC(=O)N[C@@H](C)c1cccc(C#N)c1)N1CCC[C@@H](C)C1	ZINC000610351890	460131444	/nfs/dbraw/zinc/13/14/44/460131444.db2.gz	OBLCHDLJNKWPTC-OAGGEKHMSA-N	0	3	328.460	3.039	20	30		EGEDHN
N#CC[C@@H]1CCCN(C[C@@H](O)COc2cc(Cl)cc(Cl)c2)C1	ZINC000602883761	460171648	/nfs/dbraw/zinc/17/16/48/460171648.db2.gz	MGLJBQQFUQECHB-SWLSCSKDSA-N	0	3	343.254	3.359	20	30		EGEDHN
Cc1ccccc1[C@H]([C@H](C)NC(=O)Nc1cccc(C#N)n1)N(C)C	ZINC000576634801	460181782	/nfs/dbraw/zinc/18/17/82/460181782.db2.gz	JDVKPJWDXBYQMQ-KSSFIOAISA-N	0	3	337.427	3.075	20	30		EGEDHN
CC[C@H]1CCCCN1CCNC(=O)[C@H](C)Cc1ccc(C#N)cc1	ZINC000594297369	460182383	/nfs/dbraw/zinc/18/23/83/460182383.db2.gz	WSIXLYFBKUMQNW-APWZRJJASA-N	0	3	327.472	3.118	20	30		EGEDHN
C[C@H](CC(=O)N1CCCCCC1)N[C@@H]1CCc2cc(C#N)ccc21	ZINC000618804622	460182668	/nfs/dbraw/zinc/18/26/68/460182668.db2.gz	LKWVLFAICOHWCY-DNVCBOLYSA-N	0	3	325.456	3.316	20	30		EGEDHN
C[C@H](CCC#N)N(C)C[C@@H](O)COc1cc(Cl)cc(Cl)c1	ZINC000602924556	460187845	/nfs/dbraw/zinc/18/78/45/460187845.db2.gz	FNTUXBYVQSOZAC-BXUZGUMPSA-N	0	3	331.243	3.357	20	30		EGEDHN
CN(C)CCSCC(=O)Nc1sc2c(c1C#N)CCCCC2	ZINC000610672328	460211264	/nfs/dbraw/zinc/21/12/64/460211264.db2.gz	DBEJUESYFAZYRK-UHFFFAOYSA-N	0	3	337.514	3.122	20	30		EGEDHN
N#CCCCC[C@@H](N)C(=O)N[C@H]1CCSc2ccc(Cl)cc21	ZINC000594430096	460217591	/nfs/dbraw/zinc/21/75/91/460217591.db2.gz	VRBHOIYKOFTIHD-KGLIPLIRSA-N	0	3	337.876	3.404	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CCCN(C[C@@H]2CCCO2)CC1	ZINC000610859568	460250082	/nfs/dbraw/zinc/25/00/82/460250082.db2.gz	OJANHNKJLLJKGK-IBGZPJMESA-N	0	3	341.499	3.174	20	30		EGEDHN
C[C@H](c1ccccc1)N1CCC(NC(=O)Nc2ccnc(C#N)c2)CC1	ZINC000603133764	460250673	/nfs/dbraw/zinc/25/06/73/460250673.db2.gz	YLALMNIUTUFQHL-OAHLLOKOSA-N	0	3	349.438	3.300	20	30		EGEDHN
CC[C@@H]1CN(C(=O)C(C)C)CC[C@H]1NCc1ccc(C#N)cc1F	ZINC000610947061	460264192	/nfs/dbraw/zinc/26/41/92/460264192.db2.gz	BUIJQRNLRSYJGY-CRAIPNDOSA-N	0	3	331.435	3.070	20	30		EGEDHN
COc1ccc(C#N)cc1CN1CC[C@H](N(C)Cc2ccccc2)C1	ZINC000610968317	460268058	/nfs/dbraw/zinc/26/80/58/460268058.db2.gz	VBNQLLRTWIBDJZ-FQEVSTJZSA-N	0	3	335.451	3.273	20	30		EGEDHN
CN(Cc1ccccc1)C[C@H](O)COc1ccc(C#N)cc1Cl	ZINC000611112889	460290303	/nfs/dbraw/zinc/29/03/03/460290303.db2.gz	HWRADPKCZGTVHQ-INIZCTEOSA-N	0	3	330.815	3.083	20	30		EGEDHN
CC#CC[C@H](CO)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1	ZINC000603430795	460304619	/nfs/dbraw/zinc/30/46/19/460304619.db2.gz	CSIAQWJNMWEWPX-CQSZACIVSA-N	0	3	330.409	3.187	20	30		EGEDHN
C[C@@H]1CC[C@H](C(F)(F)F)CN1C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000619306667	460325360	/nfs/dbraw/zinc/32/53/60/460325360.db2.gz	QMVDXRDSMGFABF-WQVCFCJDSA-N	0	3	349.356	3.430	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CCCc3sccc3C2)cc1	ZINC000619370981	460337663	/nfs/dbraw/zinc/33/76/63/460337663.db2.gz	AVOSMROCSDOHGE-QGZVFWFLSA-N	0	3	335.432	3.277	20	30		EGEDHN
CC1CCC(N(CC(=O)NCc2cccc(C#N)c2)C2CC2)CC1	ZINC000603895549	460356065	/nfs/dbraw/zinc/35/60/65/460356065.db2.gz	PBHOQLUEQKWKFF-UHFFFAOYSA-N	0	3	325.456	3.218	20	30		EGEDHN
COc1cc(CN2CC[C@H](N(C)Cc3ccccc3)C2)ccc1C#N	ZINC000619674486	460408672	/nfs/dbraw/zinc/40/86/72/460408672.db2.gz	OANVDKRHKVVFSD-FQEVSTJZSA-N	0	3	335.451	3.273	20	30		EGEDHN
CCOC(=O)c1csc(C(C#N)C(=O)c2cc3ccsc3[nH]2)n1	ZINC000604433359	460426952	/nfs/dbraw/zinc/42/69/52/460426952.db2.gz	JDQQWPKHKVGILB-VIFPVBQESA-N	0	3	345.405	3.353	20	30		EGEDHN
CC[C@@H]1CCCCN1CCNC(=O)NCc1ccc(C#N)c(Cl)c1	ZINC000619757980	460434068	/nfs/dbraw/zinc/43/40/68/460434068.db2.gz	LISVNSHJSZJYCX-MRXNPFEDSA-N	0	3	348.878	3.275	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@@H](CO)CC(C)C)cc1OC	ZINC000623372990	460515629	/nfs/dbraw/zinc/51/56/29/460515629.db2.gz	OJSQQQZBJGKRAM-CQSZACIVSA-N	0	3	327.852	3.410	20	30		EGEDHN
Cc1cc(CNCc2ccnc(N3CCSCC3)c2)ccc1C#N	ZINC000601153534	460733896	/nfs/dbraw/zinc/73/38/96/460733896.db2.gz	ZRKYFOQAPBXJDX-UHFFFAOYSA-N	0	3	338.480	3.105	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccccc1CC#N	ZINC000601447106	460812961	/nfs/dbraw/zinc/81/29/61/460812961.db2.gz	HIZYMCMXAAHSED-OXJNMPFZSA-N	0	3	333.435	3.003	20	30		EGEDHN
N#CCc1ccccc1C(=O)N1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1	ZINC000601649033	460856622	/nfs/dbraw/zinc/85/66/22/460856622.db2.gz	UJPSGHNEWBGKFR-PZJWPPBQSA-N	0	3	345.446	3.099	20	30		EGEDHN
C=CCN(C(=O)c1ccc(CN2CCCCC2)cc1)[C@H](C)COC	ZINC000617575932	460916164	/nfs/dbraw/zinc/91/61/64/460916164.db2.gz	ILURPVLQGGVUOE-QGZVFWFLSA-N	0	3	330.472	3.336	20	30		EGEDHN
C=CCN(Cc1ccccc1F)C(=O)N[C@@H]1CCN(C(C)(C)C)C1	ZINC000665557361	461126237	/nfs/dbraw/zinc/12/62/37/461126237.db2.gz	SHFICHMWKQBLDQ-MRXNPFEDSA-N	0	3	333.451	3.396	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@@H]2CCC[C@@H]2Cc2ccccc2)CC1	ZINC000668369117	461259625	/nfs/dbraw/zinc/25/96/25/461259625.db2.gz	OQMGKMDLMCHBPJ-UYAOXDASSA-N	0	3	326.484	3.412	20	30		EGEDHN
C=C(C)[C@H](NC1CCN([C@H]2CCOC2)CC1)c1ccc(F)c(F)c1	ZINC000655757650	461425314	/nfs/dbraw/zinc/42/53/14/461425314.db2.gz	WLWNBFVNAOIFPK-LPHOPBHVSA-N	0	3	336.426	3.425	20	30		EGEDHN
C=CCN(C(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1)[C@@H](C)COC	ZINC000663785802	461805728	/nfs/dbraw/zinc/80/57/28/461805728.db2.gz	ZNJVTBQNJAZTLM-YQVWRLOYSA-N	0	3	345.487	3.054	20	30		EGEDHN
C=CCN(C(=O)NCC(C)(C)N[C@@H](C)c1ccccc1)[C@H](C)COC	ZINC000664106702	461942950	/nfs/dbraw/zinc/94/29/50/461942950.db2.gz	BTDAZTSZBHNRMI-SJORKVTESA-N	0	3	347.503	3.348	20	30		EGEDHN
C=CCCn1cc(CN[C@H](C)Cc2ccc(Br)cc2)nn1	ZINC000657312901	462038403	/nfs/dbraw/zinc/03/84/03/462038403.db2.gz	LWAVAEBYMAOSSK-CYBMUJFWSA-N	0	3	349.276	3.338	20	30		EGEDHN
C=CCN(C[C@H](O)Cc1ccc(C(F)(F)F)cc1)[C@H](C)COC	ZINC000661242389	462165954	/nfs/dbraw/zinc/16/59/54/462165954.db2.gz	NVYUDYSXSYKZIO-CZUORRHYSA-N	0	3	331.378	3.132	20	30		EGEDHN
C=CCN(CCc1nc(-c2ccc(Cl)cc2)no1)[C@@H](C)COC	ZINC000661244607	462169163	/nfs/dbraw/zinc/16/91/63/462169163.db2.gz	WKOWVKJIWPNCRV-ZDUSSCGKSA-N	0	3	335.835	3.455	20	30		EGEDHN
C=CC[C@@H]1N(C(=O)Nc2cnc3c(c2)CNCC3)CCCC1(C)C	ZINC000667804618	462269813	/nfs/dbraw/zinc/26/98/13/462269813.db2.gz	ICXHCMPZCUFHAL-KRWDZBQOSA-N	0	3	328.460	3.326	20	30		EGEDHN
C=CCCNC(=O)N1CC[C@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000661570546	462312899	/nfs/dbraw/zinc/31/28/99/462312899.db2.gz	HHBCORWXVLALBQ-HXUWFJFHSA-N	0	3	327.472	3.260	20	30		EGEDHN
C[C@H](NC[C@H](c1cccs1)N1CCOCC1)c1cccc(C#N)c1	ZINC000181397802	533902793	/nfs/dbraw/zinc/90/27/93/533902793.db2.gz	JTSQAFJXBCMFNN-MAUKXSAKSA-N	0	3	341.480	3.344	20	30		EGEDHN
C[C@H]1CN(CC2CCN(Cc3cc(F)ccc3C#N)CC2)C[C@H](C)O1	ZINC000159586142	533922516	/nfs/dbraw/zinc/92/25/16/533922516.db2.gz	TVWYVKWBPRLJAC-HOTGVXAUSA-N	0	3	345.462	3.019	20	30		EGEDHN
COc1cc(F)c([C@H](C)NCCOc2cccc(C#N)c2)cc1OC	ZINC000183504732	533991555	/nfs/dbraw/zinc/99/15/55/533991555.db2.gz	NGYZSBMWUIKPTE-ZDUSSCGKSA-N	0	3	344.386	3.444	20	30		EGEDHN
C[C@@H]1CN(CCC(=O)Nc2sc3c(c2C#N)CCCC3)CCS1	ZINC000171699577	534461310	/nfs/dbraw/zinc/46/13/10/534461310.db2.gz	UFUURNNQTQNLHI-GFCCVEGCSA-N	0	3	349.525	3.264	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]2CN(Cc3ccc(C#N)o3)C[C@@H]21	ZINC000363844128	534895171	/nfs/dbraw/zinc/89/51/71/534895171.db2.gz	IAESLMUXPUOEGE-RRQGHBQHSA-N	0	3	345.443	3.276	20	30		EGEDHN
C=CCN1CCC(NC(=O)/C=C/c2cc(Cl)ccc2OC)CC1	ZINC000171717528	526416007	/nfs/dbraw/zinc/41/60/07/526416007.db2.gz	FUOMKCHSRLJLFQ-QPJJXVBHSA-N	0	3	334.847	3.128	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(CC)[C@H](C)Cc2ccsc2)CC1	ZINC000187040641	526426000	/nfs/dbraw/zinc/42/60/00/526426000.db2.gz	MZYPSBSRLGTNSG-OAHLLOKOSA-N	0	3	335.517	3.361	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Cc2csc(-c3ccoc3)n2)CC1	ZINC000159232493	526584309	/nfs/dbraw/zinc/58/43/09/526584309.db2.gz	WFQQRRYDMBVCIN-UHFFFAOYSA-N	0	3	345.468	3.102	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc3scnc3c2)CC1	ZINC000171587856	526596183	/nfs/dbraw/zinc/59/61/83/526596183.db2.gz	LTGLVYXWJAPYKS-UHFFFAOYSA-N	0	3	330.457	3.458	20	30		EGEDHN
CC(C)c1nc(C(=O)NCC2(N3CCCC3)CCOCC2)cs1	ZINC000329116342	547490849	/nfs/dbraw/zinc/49/08/49/547490849.db2.gz	UBFXLQJARMBFPQ-UHFFFAOYSA-N	0	3	337.489	3.216	20	30		EGEDHN
CN1CCC(CC(=O)N[C@@H]2CCc3nc(C(C)(C)C)cn3C2)CC1	ZINC000330114725	547513967	/nfs/dbraw/zinc/51/39/67/547513967.db2.gz	FCZLMYMHVFQVPN-OAHLLOKOSA-N	0	3	332.492	3.184	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N[C@H]1CCC(F)(F)C1)C(C)C	ZINC000675662255	548955268	/nfs/dbraw/zinc/95/52/68/548955268.db2.gz	VPYCNVYBJXDYJA-GJZGRUSLSA-N	0	3	329.435	3.172	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN[C@@H](C)c2ccc3c(c2)CC(=O)N3C)cc1	ZINC000728714826	574767784	/nfs/dbraw/zinc/76/77/84/574767784.db2.gz	ABHPTUXUBYHSBQ-GJZGRUSLSA-N	0	3	349.434	3.347	20	30		EGEDHN
C=C(C)CN1CCC(NC(=S)Nc2ccc(F)cc2F)CC1	ZINC000729942836	574897880	/nfs/dbraw/zinc/89/78/80/574897880.db2.gz	ULSWOXRPOQXUSG-UHFFFAOYSA-N	0	3	325.428	3.292	20	30		EGEDHN
C#CCOc1cccc(NC(=O)NCC(C)(C)N2CCCCC2)c1	ZINC000731110903	575055047	/nfs/dbraw/zinc/05/50/47/575055047.db2.gz	JFUGJXDTOWMZMS-UHFFFAOYSA-N	0	3	329.444	3.085	20	30		EGEDHN
C#CCOc1cccc(NC(=O)NC[C@H](C)N2CCCC[C@@H]2C)c1	ZINC000731111118	575055063	/nfs/dbraw/zinc/05/50/63/575055063.db2.gz	JKQYQTVJPTZYCV-HOTGVXAUSA-N	0	3	329.444	3.083	20	30		EGEDHN
C[C@@H]1CC(=NNC(=S)Nc2ccccc2C(F)(F)F)CCN1C	ZINC000741458177	575069293	/nfs/dbraw/zinc/06/92/93/575069293.db2.gz	QMQZUYOHTPLHTL-SNVBAGLBSA-N	0	3	344.406	3.462	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)C[N@H+](Cc1ccccc1[O-])C1CCCC1	ZINC000731848137	575212448	/nfs/dbraw/zinc/21/24/48/575212448.db2.gz	UEIIRMRARJAQFO-HXUWFJFHSA-N	0	3	343.471	3.191	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)C[N@@H+](Cc1ccccc1[O-])C1CCCC1	ZINC000731848137	575212449	/nfs/dbraw/zinc/21/24/49/575212449.db2.gz	UEIIRMRARJAQFO-HXUWFJFHSA-N	0	3	343.471	3.191	20	30		EGEDHN
N#CC(C(=O)C[C@H]1CCc2ccccc2C1)C(=O)NCc1ccccc1	ZINC000732593223	575278721	/nfs/dbraw/zinc/27/87/21/575278721.db2.gz	HSULQKGKLXZQDI-FXAWDEMLSA-N	0	3	346.430	3.207	20	30		EGEDHN
CC(C)n1ccc(C(=O)C(C#N)C(=O)Nc2ccc(F)c(Cl)c2)n1	ZINC000733678740	575381103	/nfs/dbraw/zinc/38/11/03/575381103.db2.gz	IBRYDFQUAFEFNM-NSHDSACASA-N	0	3	348.765	3.218	20	30		EGEDHN
C=CC[C@@H](NC(=O)NCc1cccc(CN(C)C)c1)c1ccncc1	ZINC000734657593	575532784	/nfs/dbraw/zinc/53/27/84/575532784.db2.gz	JJCHFQBOZOPCIU-LJQANCHMSA-N	0	3	338.455	3.260	20	30		EGEDHN
C#Cc1ccc(C(=O)NC2CCN([C@@H](C)c3ccccc3)CC2)cn1	ZINC000734783314	575551402	/nfs/dbraw/zinc/55/14/02/575551402.db2.gz	OHDDKSHFZCRNRY-INIZCTEOSA-N	0	3	333.435	3.018	20	30		EGEDHN
C#CCOc1ccc(CNC2(C(=O)N(CC)CC)CCCCC2)cc1	ZINC000736639472	575997386	/nfs/dbraw/zinc/99/73/86/575997386.db2.gz	YZJSUBSPFUWTTI-UHFFFAOYSA-N	0	3	342.483	3.360	20	30		EGEDHN
CCCCCCCCCCN1CCC(N(C)S(C)(=O)=O)CC1	ZINC000740876171	576632916	/nfs/dbraw/zinc/63/29/16/576632916.db2.gz	OKWGWQWLLUGMCZ-UHFFFAOYSA-N	0	3	332.554	3.483	20	30		EGEDHN
C#CCOc1ccc(F)cc1NC(=O)NCCN1CCCC[C@H]1CC	ZINC000743203469	576803366	/nfs/dbraw/zinc/80/33/66/576803366.db2.gz	JDTZRGBYODEWGX-MRXNPFEDSA-N	0	3	347.434	3.224	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)[C@@H](C)c1ccco1	ZINC000744031444	576819251	/nfs/dbraw/zinc/81/92/51/576819251.db2.gz	XIHWAECJOIZJBW-STQMWFEESA-N	0	3	326.352	3.129	20	30		EGEDHN
C#CCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1	ZINC000819709821	607085275	/nfs/dbraw/zinc/08/52/75/607085275.db2.gz	QOKIBDFVRVRIMX-CABCVRRESA-N	0	3	347.422	3.291	20	30		EGEDHN
C#CCOc1ccc([C@H](C)[NH2+][C@@H](C)c2cccc(-c3nnn[n-]3)c2)cc1	ZINC000819709822	607085277	/nfs/dbraw/zinc/08/52/77/607085277.db2.gz	QOKIBDFVRVRIMX-GJZGRUSLSA-N	0	3	347.422	3.291	20	30		EGEDHN
CCCC(=O)N1CCC[C@H](C(=O)C(C#N)c2nc3ccccc3o2)C1	ZINC000066516606	1292119563	/nfs/dbraw/zinc/11/95/63/1292119563.db2.gz	YFFRTJNRYOPVFP-UONOGXRCSA-N	0	3	339.395	3.043	20	30		EGEDHN
C#CCCN(CCOC)Cc1ccc(OCC(F)(F)F)c(F)c1	ZINC000827823991	1292383978	/nfs/dbraw/zinc/38/39/78/1292383978.db2.gz	ZFFOYMVRYKGQJS-UHFFFAOYSA-N	0	3	333.325	3.239	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@@H](C)CCc1cccc(F)c1	ZINC000076818799	1292444015	/nfs/dbraw/zinc/44/40/15/1292444015.db2.gz	KPZMTTVDEQRWFK-YOEHRIQHSA-N	0	3	332.419	3.410	20	30		EGEDHN
N#CC(C(=O)CCc1cc(Cl)cs1)C(=O)NC1CCCCC1	ZINC000077865896	1292488959	/nfs/dbraw/zinc/48/89/59/1292488959.db2.gz	JGQXFZXXGVPCHX-AWEZNQCLSA-N	0	3	338.860	3.492	20	30		EGEDHN
C#CC[C@@H](C)OC(=O)C1CCN(c2cc(Cl)ccc2Cl)C1=O	ZINC000083784187	1292690561	/nfs/dbraw/zinc/69/05/61/1292690561.db2.gz	SYYQJGYXPOBEMM-PWSUYJOCSA-N	0	3	340.206	3.301	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)[C@@H](C)c1ccccc1F	ZINC000109038809	1293085886	/nfs/dbraw/zinc/08/58/86/1293085886.db2.gz	OUBNIDOCHZPDJT-JSGCOSHPSA-N	0	3	340.354	3.285	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)CC[C@H]2CCCCO2)cc1	ZINC000111945046	1293113829	/nfs/dbraw/zinc/11/38/29/1293113829.db2.gz	NMSXJKAVLZTBAJ-IAGOWNOFSA-N	0	3	328.412	3.246	20	30		EGEDHN
COc1ccc(CNC(=O)C(C#N)C(=O)[C@H](C)CC2CCCC2)cc1	ZINC000114618457	1293173019	/nfs/dbraw/zinc/17/30/19/1293173019.db2.gz	QQYKADAHLMXYGZ-RDTXWAMCSA-N	0	3	342.439	3.237	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)C[C@H]1CCc2ccccc21	ZINC000115904700	1293196463	/nfs/dbraw/zinc/19/64/63/1293196463.db2.gz	XVRFKPAWWMHLDP-NVXWUHKLSA-N	0	3	348.402	3.463	20	30		EGEDHN
C#CCCOc1ccc(CN(Cc2cnn(C)c2)CC(C)C)cc1	ZINC000835076323	1293202275	/nfs/dbraw/zinc/20/22/75/1293202275.db2.gz	HMKPRFXSMBFLCE-UHFFFAOYSA-N	0	3	325.456	3.480	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)C(=O)Nc1ccccn1)c1cccc(F)c1	ZINC000116593550	1293207588	/nfs/dbraw/zinc/20/75/88/1293207588.db2.gz	IQQUANVPLNOURU-SWLSCSKDSA-N	0	3	325.343	3.062	20	30		EGEDHN
C[C@@H](Oc1ccccn1)C(=O)C(C#N)c1cc(C(F)(F)F)ccn1	ZINC000835454250	1293294660	/nfs/dbraw/zinc/29/46/60/1293294660.db2.gz	GGWVOIRRVLXVAF-ZYHUDNBSSA-N	0	3	335.285	3.139	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)CCO[C@H](C)CC(C)C	ZINC000120062665	1293301368	/nfs/dbraw/zinc/30/13/68/1293301368.db2.gz	VACBBSWDPJONET-CABCVRRESA-N	0	3	346.427	3.184	20	30		EGEDHN
N#CC(C(=O)C[C@H]1CCCCO1)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000120071259	1293302376	/nfs/dbraw/zinc/30/23/76/1293302376.db2.gz	PVPMLAGPRFDYST-NEPJUHHUSA-N	0	3	338.766	3.086	20	30		EGEDHN
COc1cccc(C2CC(=O)C(C=Nc3ncccc3C)C(=O)C2)c1	ZINC000120995219	1293349893	/nfs/dbraw/zinc/34/98/93/1293349893.db2.gz	NOJRSJRGINPJQX-UHFFFAOYSA-N	0	3	336.391	3.410	20	30		EGEDHN
C[C@H](CC(=O)C(C#N)C(=O)NC1CC1)c1cccc(C(F)(F)F)c1	ZINC000121738830	1293386911	/nfs/dbraw/zinc/38/69/11/1293386911.db2.gz	AABXYRXAOORBQE-QMTHXVAHSA-N	0	3	338.329	3.186	20	30		EGEDHN
N#CC(C(=O)CCCOc1ccccc1F)C(=O)Nc1ccccc1	ZINC000125527281	1293509772	/nfs/dbraw/zinc/50/97/72/1293509772.db2.gz	OMFFYBRFTOQMAY-HNNXBMFYSA-N	0	3	340.354	3.332	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)CCn1ccc2ccccc21	ZINC000125611805	1293512928	/nfs/dbraw/zinc/51/29/28/1293512928.db2.gz	WPFPRXXCMXNMDQ-KRWDZBQOSA-N	0	3	339.439	3.437	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)[C@H](C)Oc2cccc(F)c2)c1	ZINC000127751730	1293572328	/nfs/dbraw/zinc/57/23/28/1293572328.db2.gz	JNZGNUXHIGEUFA-GUYCJALGSA-N	0	3	340.354	3.249	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)[C@H](C)Oc2ccccc2)cc1	ZINC000128381213	1293591554	/nfs/dbraw/zinc/59/15/54/1293591554.db2.gz	UNPBCIHCHSPHFL-KBXCAEBGSA-N	0	3	336.391	3.364	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CNC1(C(=O)NCC2CC2)CCCC1	ZINC000135282342	1293791346	/nfs/dbraw/zinc/79/13/46/1293791346.db2.gz	FTVCIOBRXGFKGP-UHFFFAOYSA-N	0	3	339.483	3.416	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)C(=O)NC1CCCC1)c1ccc(F)cc1F	ZINC000152459362	1293969868	/nfs/dbraw/zinc/96/98/68/1293969868.db2.gz	AFYDQVORIIKACR-NHYWBVRUSA-N	0	3	334.366	3.226	20	30		EGEDHN
C[C@H](C(=O)C(C#N)C(=O)NCc1ccccc1)c1c(F)cccc1F	ZINC000153272582	1294006418	/nfs/dbraw/zinc/00/64/18/1294006418.db2.gz	LXGNJLWSQKXDGM-GXTWGEPZSA-N	0	3	342.345	3.094	20	30		EGEDHN
C[C@@H](C(=O)C(C#N)C(=O)Nc1ccccn1)c1ccc(Cl)s1	ZINC000175121540	1294540573	/nfs/dbraw/zinc/54/05/73/1294540573.db2.gz	JQENCPVMQIQJCX-NXEZZACHSA-N	0	3	333.800	3.248	20	30		EGEDHN
CCOCCC(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000176094026	1294590623	/nfs/dbraw/zinc/59/06/23/1294590623.db2.gz	GFYBCNNUPDBHNC-JTQLQIEISA-N	0	3	329.183	3.067	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)c2cc(OC)cs2)cc1	ZINC000177599449	1294679926	/nfs/dbraw/zinc/67/99/26/1294679926.db2.gz	CAVYYHGWJHEVGQ-CQSZACIVSA-N	0	3	328.393	3.280	20	30		EGEDHN
C#CCOc1ccc(CN2CC[C@@H](CNC(=O)OC(C)(C)C)C2)cc1	ZINC000179740131	1294819676	/nfs/dbraw/zinc/81/96/76/1294819676.db2.gz	VQMVPOKMKOLNDI-KRWDZBQOSA-N	0	3	344.455	3.045	20	30		EGEDHN
C#CCOc1ccccc1CN1CC[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000179740518	1294819770	/nfs/dbraw/zinc/81/97/70/1294819770.db2.gz	FRKLKTOAALLPDJ-MRXNPFEDSA-N	0	3	344.455	3.045	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccnc(SC(C)(C)C)c2)CC1	ZINC000181621772	1294981561	/nfs/dbraw/zinc/98/15/61/1294981561.db2.gz	HJBYGLYWQIFXKR-UHFFFAOYSA-N	0	3	333.501	3.352	20	30		EGEDHN
C#CCOc1ccccc1NC(=O)N(CCN(C)C)C1CCCC1	ZINC000188086197	1295436354	/nfs/dbraw/zinc/43/63/54/1295436354.db2.gz	SBKDYPYOMYGTTM-UHFFFAOYSA-N	0	3	329.444	3.037	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)CCOc1cc(C)cc(C)c1	ZINC000193380483	1295860602	/nfs/dbraw/zinc/86/06/02/1295860602.db2.gz	VYUUGGXNLJVZPX-QGZVFWFLSA-N	0	3	330.428	3.088	20	30		EGEDHN
CCc1nc(CC(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)cs1	ZINC000193608995	1295891684	/nfs/dbraw/zinc/89/16/84/1295891684.db2.gz	LJNZWHSHTKFCOI-ZDUSSCGKSA-N	0	3	347.827	3.249	20	30		EGEDHN
CO[C@@H](C)CC(=O)C(C#N)C(=O)Nc1ccc(SC(F)F)cc1	ZINC000195491969	1296072983	/nfs/dbraw/zinc/07/29/83/1296072983.db2.gz	JEJFRXXYWQHIRN-JOYOIKCWSA-N	0	3	342.367	3.074	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN1CCC[C@H]1C[C@@H](O)c1ccc(F)cc1	ZINC000246816284	1296370702	/nfs/dbraw/zinc/37/07/02/1296370702.db2.gz	NNGRBEFWNVIYAL-RBUKOAKNSA-N	0	3	348.462	3.138	20	30		EGEDHN
C=C(Br)CNC1CCC(N(C)C(=O)C=C2CCC2)CC1	ZINC000963212237	1323237432	/nfs/dbraw/zinc/23/74/32/1323237432.db2.gz	UKJDHPIUCPMWQT-UHFFFAOYSA-N	0	3	341.293	3.365	20	30		EGEDHN
CC[C@@H](Cc1cccc(C)c1)C(=O)C(C#N)C(=O)NC1CCCC1	ZINC000873498933	1297544678	/nfs/dbraw/zinc/54/46/78/1297544678.db2.gz	UUULPQWFRHBMJN-WMZOPIPTSA-N	0	3	326.440	3.331	20	30		EGEDHN
CN1CC[C@@H]2CC[C@H](C1)N2c1cc(Br)c(C#N)cc1F	ZINC000718905136	1298311795	/nfs/dbraw/zinc/31/17/95/1298311795.db2.gz	JDGIBXDCIFZVAP-NWDGAFQWSA-N	0	3	338.224	3.133	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000724068133	1298346489	/nfs/dbraw/zinc/34/64/89/1298346489.db2.gz	JYLRBFIOIVXHMT-RYUDHWBXSA-N	0	3	333.270	3.178	20	30		EGEDHN
C=C(Cl)C[C@H](N)C(=O)N1CCC(Cc2ccc(F)c(F)c2)CC1	ZINC000876880354	1299048696	/nfs/dbraw/zinc/04/86/96/1299048696.db2.gz	IKELQVIUFBGAHF-INIZCTEOSA-N	0	3	342.817	3.216	20	30		EGEDHN
C=C(Cl)C[C@H](N)C(=O)N1CCCC[C@@H]1Cc1ccc(OC)cc1	ZINC000876949579	1299082550	/nfs/dbraw/zinc/08/25/50/1299082550.db2.gz	ZBPOEOZRQIRUEC-WBVHZDCISA-N	0	3	336.863	3.089	20	30		EGEDHN
C=C(Cl)C[C@H](N)C(=O)NCc1cn(C(F)F)c2ccccc12	ZINC000877061133	1299139370	/nfs/dbraw/zinc/13/93/70/1299139370.db2.gz	YKVZTVZOAIHWHX-LBPRGKRZSA-N	0	3	327.762	3.123	20	30		EGEDHN
Cc1noc(C)c1[C@H](C)C(=O)C(C#N)C(=O)Nc1ccccc1Cl	ZINC000750391353	1299387281	/nfs/dbraw/zinc/38/72/81/1299387281.db2.gz	GFVJKBDYTFIOQW-CABZTGNLSA-N	0	3	345.786	3.396	20	30		EGEDHN
CC[C@H](O)[C@@H]1CCCCN1CC[C@](C#N)(C(C)=O)c1ccccc1	ZINC000878119825	1299760304	/nfs/dbraw/zinc/76/03/04/1299760304.db2.gz	FMHKIRZVEGMGHJ-UFYCRDLUSA-N	0	3	328.456	3.052	20	30		EGEDHN
CC(=O)[C@@](C#N)(CCN1CCC(c2ncc[nH]2)CC1)c1ccccc1	ZINC000878172425	1299796695	/nfs/dbraw/zinc/79/66/95/1299796695.db2.gz	HTTSWYDZKGXDDF-FQEVSTJZSA-N	0	3	336.439	3.030	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]\Cc2cccc(N(C)C)n2)c([O-])c1	ZINC000754685634	1300190746	/nfs/dbraw/zinc/19/07/46/1300190746.db2.gz	HGNCSBWOUOKWEN-MOSHPQCFSA-N	0	3	326.444	3.319	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)C[C@@H](C)COC)cc1	ZINC000756232621	1300453940	/nfs/dbraw/zinc/45/39/40/1300453940.db2.gz	CHTVNLWLCAZCIC-RHSMWYFYSA-N	0	3	330.428	3.349	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)c1cccc(C(C)C)n1	ZINC000762066763	1301606862	/nfs/dbraw/zinc/60/68/62/1301606862.db2.gz	BROPWQQVQOHXLX-CYBMUJFWSA-N	0	3	337.379	3.175	20	30		EGEDHN
C#CCNC(=O)CNC1(c2cccc(C(F)(F)F)c2)CCCCC1	ZINC000763606018	1301932089	/nfs/dbraw/zinc/93/20/89/1301932089.db2.gz	XRFVEABCXVRDGB-UHFFFAOYSA-N	0	3	338.373	3.204	20	30		EGEDHN
Cc1ccc(N(CCC#N)C(=O)CN2CC[C@H](C3CC3)C2)cc1C	ZINC000764484713	1302070372	/nfs/dbraw/zinc/07/03/72/1302070372.db2.gz	MUMULIVKVOUHLD-SFHVURJKSA-N	0	3	325.456	3.282	20	30		EGEDHN
C=CC[N@@H+](CCc1ccccc1)Cc1cc2c(cc1[O-])OC[C@@H]2O	ZINC000768439985	1302902007	/nfs/dbraw/zinc/90/20/07/1302902007.db2.gz	MSDATGVZVTZVCW-IBGZPJMESA-N	0	3	325.408	3.049	20	30		EGEDHN
C=CC[N@H+](CCc1ccccc1)Cc1cc2c(cc1[O-])OC[C@@H]2O	ZINC000768439985	1302902014	/nfs/dbraw/zinc/90/20/14/1302902014.db2.gz	MSDATGVZVTZVCW-IBGZPJMESA-N	0	3	325.408	3.049	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@](C)(NCc1cccc(C#N)c1F)C1CC1	ZINC000769163888	1303059896	/nfs/dbraw/zinc/05/98/96/1303059896.db2.gz	GFBNKMXLCGJOJL-LJQANCHMSA-N	0	3	347.434	3.480	20	30		EGEDHN
C#CCOc1ccccc1CN1CCC[C@@H](C(=O)N[C@H](C)CCC)C1	ZINC000769212500	1303072118	/nfs/dbraw/zinc/07/21/18/1303072118.db2.gz	KBVBJCSZKIPOHP-IEBWSBKVSA-N	0	3	342.483	3.215	20	30		EGEDHN
C#C[C@@H](C)N(C)C[C@@H](O)COc1ccc(Oc2ccccc2)cc1	ZINC000769962067	1303198827	/nfs/dbraw/zinc/19/88/27/1303198827.db2.gz	PVJDROYXGXPYQA-IAGOWNOFSA-N	0	3	325.408	3.172	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)CC1	ZINC000770020255	1303208830	/nfs/dbraw/zinc/20/88/30/1303208830.db2.gz	OYKCSZKDZJSQRG-UHFFFAOYSA-N	0	3	338.795	3.020	20	30		EGEDHN
C=C(Cl)COc1ccc([C@H](C)N[C@@H]2CC(=O)N(C(C)C)C2)cc1	ZINC000773008628	1303605814	/nfs/dbraw/zinc/60/58/14/1303605814.db2.gz	WNCYHUDSMHXHCF-GOEBONIOSA-N	0	3	336.863	3.478	20	30		EGEDHN
CCN1CCCC[C@@H]1C(=O)C(C#N)c1nc2cc(F)ccc2s1	ZINC000774072758	1303771346	/nfs/dbraw/zinc/77/13/46/1303771346.db2.gz	OTODIXXGSYKNNC-GXTWGEPZSA-N	0	3	331.416	3.486	20	30		EGEDHN
CN(CC(=O)C(C#N)c1nc2cc(F)ccc2s1)[C@H]1CCSC1	ZINC000774073139	1303771761	/nfs/dbraw/zinc/77/17/61/1303771761.db2.gz	SCFOZKRNQSXMIW-NWDGAFQWSA-N	0	3	349.456	3.049	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)Cc2ccc(C)o2)cc1Cl	ZINC000775228405	1303927557	/nfs/dbraw/zinc/92/75/57/1303927557.db2.gz	UHWWLHNARLSMEV-CYBMUJFWSA-N	0	3	346.770	3.140	20	30		EGEDHN
N#CCC[C@H](NC[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1	ZINC000776606116	1304178802	/nfs/dbraw/zinc/17/88/02/1304178802.db2.gz	RQXGFQXHDOYVJZ-ROUUACIJSA-N	0	3	325.368	3.263	20	30		EGEDHN
COc1ccc(CN(C)C)cc1NC(=O)Cc1ccccc1CC#N	ZINC000776809918	1304203418	/nfs/dbraw/zinc/20/34/18/1304203418.db2.gz	KZEVGUKSNPBVDA-UHFFFAOYSA-N	0	3	337.423	3.004	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)Cc2ccccc2CC#N)N(C)C)cc1	ZINC000777283218	1304279129	/nfs/dbraw/zinc/27/91/29/1304279129.db2.gz	FSXXWOZKIJJLES-NRFANRHFSA-N	0	3	349.478	3.277	20	30		EGEDHN
N#Cc1ccc(OCCCN2CC[C@@](O)(c3ccc(F)cc3)C2)cc1	ZINC000777736694	1304341490	/nfs/dbraw/zinc/34/14/90/1304341490.db2.gz	GOVRTXFDLPHUSY-FQEVSTJZSA-N	0	3	340.398	3.060	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CN[C@@H]1CCOC2(CCOCC2)C1	ZINC000778174249	1304410108	/nfs/dbraw/zinc/41/01/08/1304410108.db2.gz	MZQWXAADNPOTQA-OAHLLOKOSA-N	0	3	349.858	3.170	20	30		EGEDHN
N#CCC1CCN(C[C@H](O)COc2cc(Cl)ccc2Cl)CC1	ZINC000782087048	1304914137	/nfs/dbraw/zinc/91/41/37/1304914137.db2.gz	BIBURDYVNFENBM-AWEZNQCLSA-N	0	3	343.254	3.359	20	30		EGEDHN
C[C@@]1(COC(=O)c2ccc(C#N)[nH]2)CCCCN1Cc1ccccc1	ZINC000782147891	1304920835	/nfs/dbraw/zinc/92/08/35/1304920835.db2.gz	GEVMUUFVFMJHJD-FQEVSTJZSA-N	0	3	337.423	3.488	20	30		EGEDHN
N#CC(C(=O)CCCc1ccsc1)C(=O)NCc1ccccc1	ZINC000783349262	1305082547	/nfs/dbraw/zinc/08/25/47/1305082547.db2.gz	DVXFCDSCLXVZNC-MRXNPFEDSA-N	0	3	326.421	3.096	20	30		EGEDHN
Cc1c2occ(CC(=O)C(C#N)C(=O)NC(C)C)c2ccc1Cl	ZINC000892499555	1305407931	/nfs/dbraw/zinc/40/79/31/1305407931.db2.gz	YFEPMPCYBWHEGS-ZDUSSCGKSA-N	0	3	332.787	3.171	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)Cc2c(C)cccc2C)CC1	ZINC000892851931	1305579272	/nfs/dbraw/zinc/57/92/72/1305579272.db2.gz	SMWSCHGFQSIOEM-UHFFFAOYSA-N	0	3	329.488	3.485	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)c1cncc(CC)c1	ZINC000789402163	1306154512	/nfs/dbraw/zinc/15/45/12/1306154512.db2.gz	BUDCSGFTXNJIMU-HNNXBMFYSA-N	0	3	337.379	3.004	20	30		EGEDHN
C#C[C@@H](CCC)NC(=O)N1CCCN(Cc2ccccc2C)CC1	ZINC000791068165	1308920598	/nfs/dbraw/zinc/92/05/98/1308920598.db2.gz	QQPDFRMTAOCSRW-IBGZPJMESA-N	0	3	327.472	3.014	20	30		EGEDHN
C=CC[C@H](CC)NC(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000798375518	1310348996	/nfs/dbraw/zinc/34/89/96/1310348996.db2.gz	JQQXPHADQZTSCS-KRWDZBQOSA-N	0	3	331.529	3.470	20	30		EGEDHN
N#Cc1ccc(C2CCN(Cc3cnn(CC(F)F)c3)CC2)cc1	ZINC000897588872	1310396700	/nfs/dbraw/zinc/39/67/00/1310396700.db2.gz	OVUQBWRNOUESNW-UHFFFAOYSA-N	0	3	330.382	3.399	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1C#N	ZINC000799303993	1310520719	/nfs/dbraw/zinc/52/07/19/1310520719.db2.gz	QAWCMFNHRKLDFU-HXUWFJFHSA-N	0	3	333.435	3.434	20	30		EGEDHN
C#Cc1cccc(CNC(=O)[C@H](NC(C)C)c2ccc(OC)cc2)c1	ZINC000897932683	1310523051	/nfs/dbraw/zinc/52/30/51/1310523051.db2.gz	LYUHVRCWDFEXMZ-HXUWFJFHSA-N	0	3	336.435	3.032	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc1C#N	ZINC000799686030	1310599574	/nfs/dbraw/zinc/59/95/74/1310599574.db2.gz	NPXLINVTKZHODO-UZLBHIALSA-N	0	3	333.435	3.260	20	30		EGEDHN
C=C(C)COc1cc(CNCc2ccc(CCO)cc2)ccc1OC	ZINC000898172377	1310612746	/nfs/dbraw/zinc/61/27/46/1310612746.db2.gz	FGMGTZYOMVWBJH-UHFFFAOYSA-N	0	3	341.451	3.475	20	30		EGEDHN
N#CC1(CCCCN2CCNC(=O)C[C@@H]2c2ccccc2)CCC1	ZINC000929464223	1328603819	/nfs/dbraw/zinc/60/38/19/1328603819.db2.gz	LJMNXZRZODAXNE-GOSISDBHSA-N	0	3	325.456	3.414	20	30		EGEDHN
N#Cc1cccc(C(=O)COC(=O)c2ccc(CN3CCCC3)cc2)c1	ZINC000801869766	1316959316	/nfs/dbraw/zinc/95/93/16/1316959316.db2.gz	JZDHAOGCGASKRD-UHFFFAOYSA-N	0	3	348.402	3.194	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@@H](F)c2ccc(C(F)(F)F)cc2)CC1	ZINC000801882433	1316961633	/nfs/dbraw/zinc/96/16/33/1316961633.db2.gz	KNWJNIFOHGAEOI-HNNXBMFYSA-N	0	3	344.352	3.483	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)C3CCC4(CC4)CC3)C2)s1	ZINC001019157610	1317077073	/nfs/dbraw/zinc/07/70/73/1317077073.db2.gz	LCGDIILXRPSGDL-HNNXBMFYSA-N	0	3	343.496	3.281	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)C3(C4CCC4)CCC3)C2)s1	ZINC001019199295	1317097744	/nfs/dbraw/zinc/09/77/44/1317097744.db2.gz	MALALDSNXJSVNB-HNNXBMFYSA-N	0	3	343.496	3.281	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](NCc2ccc(Cl)c(OC)c2)C1	ZINC001019239324	1317118438	/nfs/dbraw/zinc/11/84/38/1317118438.db2.gz	NDZSWOBVFJGYPN-AWEZNQCLSA-N	0	3	336.863	3.251	20	30		EGEDHN
N#Cc1cc(CN[C@H]2CCN(C(=O)C[C@H]3CC=CCC3)C2)ccc1F	ZINC001019244256	1317121246	/nfs/dbraw/zinc/12/12/46/1317121246.db2.gz	ZJYWNWZMDGNFIJ-YJBOKZPZSA-N	0	3	341.430	3.134	20	30		EGEDHN
CCC(=O)N1CCC2(CCN(CC#Cc3ccc(F)cc3)CC2)CC1	ZINC000957481378	1317390014	/nfs/dbraw/zinc/39/00/14/1317390014.db2.gz	GGTDTOPRJCNIDP-UHFFFAOYSA-N	0	3	342.458	3.292	20	30		EGEDHN
CCOC1CC(C(=O)C(C#N)C(=O)Nc2cccc3ccccc32)C1	ZINC000805856262	1317431835	/nfs/dbraw/zinc/43/18/35/1317431835.db2.gz	SNVIYVKFFVHHCQ-VMBOVVBDSA-N	0	3	336.391	3.302	20	30		EGEDHN
C=C[C@@H](C(=O)N1CC[C@H](NCc2scnc2C)C1)c1ccccc1	ZINC001019804993	1317432605	/nfs/dbraw/zinc/43/26/05/1317432605.db2.gz	OYOACVMKCVRWLT-DLBZAZTESA-N	0	3	341.480	3.112	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@H](NC(=O)C3CCCCC3)C2)c1	ZINC001019948900	1317472312	/nfs/dbraw/zinc/47/23/12/1317472312.db2.gz	WITOSHGMQFYJGI-QAQDUYKDSA-N	0	3	329.419	3.014	20	30		EGEDHN
C#CCN(Cc1ccccc1)C(=O)NC[C@@H](c1ccc(C)cc1)N(C)C	ZINC000806611448	1317513095	/nfs/dbraw/zinc/51/30/95/1317513095.db2.gz	CVMZPUAZKMJBDY-NRFANRHFSA-N	0	3	349.478	3.443	20	30		EGEDHN
Cc1csc(C(=O)N[C@H]2C[C@H](NCc3ccc(C#N)cc3F)C2)c1	ZINC001020131461	1317554426	/nfs/dbraw/zinc/55/44/26/1317554426.db2.gz	ISJJZLUKUBMQBX-SHTZXODSSA-N	0	3	343.427	3.118	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N[C@H]1C[C@H](N[C@@H](C)c2ccccc2F)C1	ZINC001020168869	1317572183	/nfs/dbraw/zinc/57/21/83/1317572183.db2.gz	ATJHXWUOASWGHU-XQWZKXDRSA-N	0	3	346.446	3.105	20	30		EGEDHN
CC[C@@H](C)N[C@H](CNC(=O)c1ccccc1OCC#N)c1ccco1	ZINC000807681013	1317577811	/nfs/dbraw/zinc/57/78/11/1317577811.db2.gz	YEVFRAHNTULEJE-GDBMZVCRSA-N	0	3	341.411	3.041	20	30		EGEDHN
CC[C@H](N[C@H]1CCN(c2ccccc2OC)C1=O)c1cccc(C#N)c1	ZINC000902879435	1317626287	/nfs/dbraw/zinc/62/62/87/1317626287.db2.gz	VKNASSNPAQQELM-ROUUACIJSA-N	0	3	349.434	3.413	20	30		EGEDHN
CC[C@@H](N[C@H]1CCCN(Cc2ccccn2)C1=O)c1cccc(C#N)c1	ZINC000902950700	1317633128	/nfs/dbraw/zinc/63/31/28/1317633128.db2.gz	KCQWIMSQLDRWGA-UXHICEINSA-N	0	3	348.450	3.185	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc3c(cc(C)cc3C)[nH]2)C1	ZINC001020444044	1317700062	/nfs/dbraw/zinc/70/00/62/1317700062.db2.gz	MYXPWJQCOXATCV-HDJSIYSDSA-N	0	3	331.847	3.388	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc(C)oc2C(F)(F)F)C1	ZINC001020643430	1317827651	/nfs/dbraw/zinc/82/76/51/1317827651.db2.gz	DXKXLLJDQLBXBK-MGCOHNPYSA-N	0	3	336.741	3.210	20	30		EGEDHN
C#Cc1ccc(CN2CC[C@H](NC(=O)OC(C)(C)C)[C@@H](C)C2)cc1	ZINC000809575405	1317834776	/nfs/dbraw/zinc/83/47/76/1317834776.db2.gz	BRRCMLAGQHSVFU-YJBOKZPZSA-N	0	3	328.456	3.403	20	30		EGEDHN
CC[C@H](C)Oc1cc(/C=C2/C(=O)c3ncnn3C2C)ccc1OC	ZINC000905082767	1317921488	/nfs/dbraw/zinc/92/14/88/1317921488.db2.gz	WXPZVIHBTNHJJP-MHPRJNMPSA-N	0	3	327.384	3.305	20	30		EGEDHN
C[C@H](N[C@H]1CCc2ccc(C#N)cc21)c1ccc2c(c1)CC(=O)N2C	ZINC000810216573	1317978590	/nfs/dbraw/zinc/97/85/90/1317978590.db2.gz	XMQAJFLQQCLLSQ-DJJJIMSYSA-N	0	3	331.419	3.415	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@H](NC(=O)C3(F)CCCCC3)C2)c1	ZINC001020877677	1317979160	/nfs/dbraw/zinc/97/91/60/1317979160.db2.gz	HBQGJOQYGXNUFO-WKILWMFISA-N	0	3	347.409	3.107	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1CC[C@H](C)N(Cc2ccccc2)CC1	ZINC000810456047	1318011167	/nfs/dbraw/zinc/01/11/67/1318011167.db2.gz	GSJRIJAUTPUMSU-IBGZPJMESA-N	0	3	346.474	3.333	20	30		EGEDHN
C[C@]1(COC(=O)c2cccc(C#N)n2)CCCN1Cc1ccccc1	ZINC000810601816	1318029875	/nfs/dbraw/zinc/02/98/75/1318029875.db2.gz	AARPECMPQUOEDJ-HXUWFJFHSA-N	0	3	335.407	3.165	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@H](NC(=O)C3CCC=CCC3)C2)c1	ZINC001021063554	1318064786	/nfs/dbraw/zinc/06/47/86/1318064786.db2.gz	HWZKMSDAUKHOEI-IYARVYRRSA-N	0	3	341.430	3.181	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@H](C)c2ccc(F)cc2F)C1	ZINC001021071383	1318067169	/nfs/dbraw/zinc/06/71/69/1318067169.db2.gz	KSKHEJOQPIJZTJ-RAIGVLPGSA-N	0	3	328.790	3.058	20	30		EGEDHN
N#CCC1(OC(=O)C2CCN(c3ccc(Cl)cc3)C2=O)CCC1	ZINC000810858457	1318068520	/nfs/dbraw/zinc/06/85/20/1318068520.db2.gz	XNSHXSGCPDMGIJ-CQSZACIVSA-N	0	3	332.787	3.072	20	30		EGEDHN
C=C1CCC(C(=O)NC2C[C@H]3CC[C@@H](C2)N3Cc2ocnc2C)CC1	ZINC001021367932	1318213701	/nfs/dbraw/zinc/21/37/01/1318213701.db2.gz	AHIDIQOTFORSJY-AYHJJNSGSA-N	0	3	343.471	3.341	20	30		EGEDHN
C=C1CC(C)(C(=O)NC2C[C@H]3CC[C@@H](C2)N3CCC(F)(F)F)C1	ZINC001021373012	1318217599	/nfs/dbraw/zinc/21/75/99/1318217599.db2.gz	AEGHRTGLWIDASB-AGUYFDCRSA-N	0	3	330.394	3.407	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)C[C@H]2C=CCC2)s1	ZINC000959875759	1318245072	/nfs/dbraw/zinc/24/50/72/1318245072.db2.gz	VVVOQMHIWIXAAG-HOTGVXAUSA-N	0	3	343.496	3.447	20	30		EGEDHN
O=C(C#CC1CC1)N1CCCC[C@H]1CNCc1cc2ccccc2o1	ZINC000960003853	1318308513	/nfs/dbraw/zinc/30/85/13/1318308513.db2.gz	QMCASJUKAFMECC-SFHVURJKSA-N	0	3	336.435	3.317	20	30		EGEDHN
C#C[C@H](C)N(C)C(=O)NC[C@@H](c1ccccc1)N1CCC(C)CC1	ZINC000812010144	1318309097	/nfs/dbraw/zinc/30/90/97/1318309097.db2.gz	GESBDSSGISRFOC-HKUYNNGSSA-N	0	3	327.472	3.123	20	30		EGEDHN
CCCC(=O)N1CCC[C@H]2CN(Cc3ccc(C#N)cc3)CC[C@H]21	ZINC001021500541	1318312984	/nfs/dbraw/zinc/31/29/84/1318312984.db2.gz	YNYUGPGEQNCPJZ-RBUKOAKNSA-N	0	3	325.456	3.171	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@H]2CN(Cc3cccc(C#N)c3)CC[C@@H]21	ZINC001021512095	1318333220	/nfs/dbraw/zinc/33/32/20/1318333220.db2.gz	USIHKMYCUJFRGN-PMACEKPBSA-N	0	3	337.467	3.337	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(CCC)s2)C1	ZINC001021595513	1318439914	/nfs/dbraw/zinc/43/99/14/1318439914.db2.gz	ZHHUCJPZFUTJMA-DOTOQJQBSA-N	0	3	330.497	3.260	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)Cc1ccccc1CC	ZINC000960278658	1318441489	/nfs/dbraw/zinc/44/14/89/1318441489.db2.gz	OCZYSKSWIRNUHQ-IFMALSPDSA-N	0	3	334.463	3.349	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccnc(C2CC2)c1	ZINC000960279352	1318442290	/nfs/dbraw/zinc/44/22/90/1318442290.db2.gz	FMHVRSDBHFZYGT-WOJBJXKFSA-N	0	3	333.435	3.130	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc2n[nH]cc2c1	ZINC000960300654	1318450497	/nfs/dbraw/zinc/45/04/97/1318450497.db2.gz	YFCPLDKOLOOLKC-WOJBJXKFSA-N	0	3	346.434	3.124	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc2c(c1)C[C@@H](C)O2	ZINC000960313232	1318456100	/nfs/dbraw/zinc/45/61/00/1318456100.db2.gz	KHERQMIUSJKUFL-YFZFPPMRSA-N	0	3	348.446	3.181	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cnoc1C(C)C	ZINC000960318498	1318458783	/nfs/dbraw/zinc/45/87/83/1318458783.db2.gz	PEGFJXDWFJGRNA-QZTJIDSGSA-N	0	3	339.439	3.360	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)Cc2ccc(C)c(Cl)c2)C1	ZINC001021614688	1318462731	/nfs/dbraw/zinc/46/27/31/1318462731.db2.gz	QZHSFCRORNNOJX-HKUYNNGSSA-N	0	3	344.886	3.137	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2ccc(C)c(Cl)c2)C1	ZINC001021614697	1318463308	/nfs/dbraw/zinc/46/33/08/1318463308.db2.gz	QZHSFCRORNNOJX-PKOBYXMFSA-N	0	3	344.886	3.137	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cccc3ccc(C)nc32)C1	ZINC001021615073	1318463378	/nfs/dbraw/zinc/46/33/78/1318463378.db2.gz	UUPJWIXQSGWFMK-QUCCMNQESA-N	0	3	347.462	3.103	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@H]1COc2ccccc21	ZINC000960332357	1318465699	/nfs/dbraw/zinc/46/56/99/1318465699.db2.gz	HPJADYFWCWSNQK-QKNQBKEWSA-N	0	3	348.446	3.111	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)Cc1sc(C)cc1C	ZINC000960331641	1318466298	/nfs/dbraw/zinc/46/62/98/1318466298.db2.gz	XDABIIYQLCEIBX-YLJYHZDGSA-N	0	3	340.492	3.465	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cnc(CC)s1	ZINC000960334991	1318469179	/nfs/dbraw/zinc/46/91/79/1318469179.db2.gz	ZVLQJGBUOKVDJK-CRAIPNDOSA-N	0	3	341.480	3.267	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(C)c(F)c2)C1	ZINC001021627688	1318479793	/nfs/dbraw/zinc/47/97/93/1318479793.db2.gz	OTLQSQCVRVSKIZ-MJGOQNOKSA-N	0	3	328.431	3.084	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)C1CCCC1	ZINC000960360304	1318482635	/nfs/dbraw/zinc/48/26/35/1318482635.db2.gz	IGOBCEDKBMMOIZ-LJQANCHMSA-N	0	3	325.456	3.171	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)/C=C\c1ccco1	ZINC000960370392	1318493308	/nfs/dbraw/zinc/49/33/08/1318493308.db2.gz	BOPYZXAENBBBKR-VJIACCKLSA-N	0	3	349.434	3.287	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cccc3ncccc32)C1	ZINC001021644987	1318501577	/nfs/dbraw/zinc/50/15/77/1318501577.db2.gz	JUFBXNPAGPEALX-UWJYYQICSA-N	0	3	347.462	3.185	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(-c3ccco3)on2)C1	ZINC001021645793	1318504319	/nfs/dbraw/zinc/50/43/19/1318504319.db2.gz	MWBBCQCUCAPNRS-GDBMZVCRSA-N	0	3	341.411	3.047	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc3[nH]ccc3c2)C1	ZINC001021651885	1318513436	/nfs/dbraw/zinc/51/34/36/1318513436.db2.gz	FTQHBSUOOTZIOJ-ICSRJNTNSA-N	0	3	335.451	3.118	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(F)c(Cl)c2)C1	ZINC001021658629	1318520931	/nfs/dbraw/zinc/52/09/31/1318520931.db2.gz	OLULOYLPFAVIDG-YOEHRIQHSA-N	0	3	334.822	3.039	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc[nH]c2C2CCC2)C1	ZINC001021666852	1318528844	/nfs/dbraw/zinc/52/88/44/1318528844.db2.gz	CIQXFSOSEPACOL-IEBWSBKVSA-N	0	3	339.483	3.232	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2noc3c2CCCCC3)C1	ZINC001021677353	1318546197	/nfs/dbraw/zinc/54/61/97/1318546197.db2.gz	HTADHGSKQYQGKW-NVXWUHKLSA-N	0	3	343.471	3.056	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc3nc(C)ccc3c2)C1	ZINC001021697048	1318570940	/nfs/dbraw/zinc/57/09/40/1318570940.db2.gz	NMMDDQOBSYDKHB-FPOVZHCZSA-N	0	3	347.462	3.103	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc3sccc3c2)C1	ZINC001021706626	1318580675	/nfs/dbraw/zinc/58/06/75/1318580675.db2.gz	MSNYJKIBEUNCRX-ROUUACIJSA-N	0	3	338.476	3.461	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc3c(C)cccn3c2)C1	ZINC001021709655	1318586748	/nfs/dbraw/zinc/58/67/48/1318586748.db2.gz	CYCHRGNFLGNNRZ-AZUAARDMSA-N	0	3	349.478	3.198	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc3c(c2)CCC=C3)C1	ZINC001021715685	1318593594	/nfs/dbraw/zinc/59/35/94/1318593594.db2.gz	IDDXTHPNJUVLCB-NHCUHLMSSA-N	0	3	334.463	3.206	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)CCc2ccccc2Cl)C1	ZINC001021726522	1318619970	/nfs/dbraw/zinc/61/99/70/1318619970.db2.gz	CYQBHKMNPYCJKK-IEBWSBKVSA-N	0	3	344.886	3.219	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cccc3ccccc32)C1	ZINC001021726908	1318620570	/nfs/dbraw/zinc/62/05/70/1318620570.db2.gz	HPBJXABFCXIONW-GHTZIAJQSA-N	0	3	332.447	3.400	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(CC(C)C)cc2)C1	ZINC001021729776	1318630956	/nfs/dbraw/zinc/63/09/56/1318630956.db2.gz	HHPYXGOVXXGXBB-RTWAWAEBSA-N	0	3	338.495	3.445	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(C)c(F)c(C)c2)C1	ZINC001021734922	1318642300	/nfs/dbraw/zinc/64/23/00/1318642300.db2.gz	ATHFEIKJULCIJQ-SJLPKXTDSA-N	0	3	328.431	3.002	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(CF)cc2)C1	ZINC001021742273	1318655075	/nfs/dbraw/zinc/65/50/75/1318655075.db2.gz	CWAYSGDRXRJWQY-RBUKOAKNSA-N	0	3	328.431	3.106	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)CCc2cc(C)sc2C)C1	ZINC001021742577	1318655136	/nfs/dbraw/zinc/65/51/36/1318655136.db2.gz	GDFSSNHXSBLDFU-RTBURBONSA-N	0	3	344.524	3.244	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)CCc2ccc(C)s2)C1	ZINC001021751705	1318665225	/nfs/dbraw/zinc/66/52/25/1318665225.db2.gz	LCJBRZHFMMAZIV-PKOBYXMFSA-N	0	3	344.524	3.325	20	30		EGEDHN
CC(=O)N(C)c1ccc(CN[C@H](C)c2ccc(OCC#N)cc2)cc1	ZINC000858496141	1328780239	/nfs/dbraw/zinc/78/02/39/1328780239.db2.gz	NVAZNWZXPKFXBZ-OAHLLOKOSA-N	0	3	337.423	3.422	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)NCCN1CCC[C@H]1C	ZINC000814116928	1318677981	/nfs/dbraw/zinc/67/79/81/1318677981.db2.gz	JUKYVFZUPNSAAR-GFCCVEGCSA-N	0	3	327.453	3.296	20	30		EGEDHN
CC[C@H](SC)C(=O)N1CCC[C@@H]1CN(C)Cc1ccc(C#N)cc1	ZINC000960557106	1318687119	/nfs/dbraw/zinc/68/71/19/1318687119.db2.gz	OVXNNQITWLVZMZ-MSOLQXFVSA-N	0	3	345.512	3.123	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)[C@H]1CCC1(F)F	ZINC000960702170	1318805704	/nfs/dbraw/zinc/80/57/04/1318805704.db2.gz	PAFCWJQQAPJWEN-IAGOWNOFSA-N	0	3	347.409	3.026	20	30		EGEDHN
C[C@@H]1CCC(=NNC(=S)NC2CCN(Cc3ccccc3)CC2)C1	ZINC000814727717	1318806808	/nfs/dbraw/zinc/80/68/08/1318806808.db2.gz	VTDLWSKKFKALIO-OAHLLOKOSA-N	0	3	344.528	3.291	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)c2sc(C)cc2C)C1	ZINC001022142814	1318816949	/nfs/dbraw/zinc/81/69/49/1318816949.db2.gz	PHXNVVSEBSUODM-TXEJJXNPSA-N	0	3	343.290	3.124	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)C[C@@H]2C[C@H]2c2ccc(OC)cc2)C1	ZINC001022227894	1318851711	/nfs/dbraw/zinc/85/17/11/1318851711.db2.gz	XUSVWDMNKISMFL-CUSZFKRNSA-N	0	3	348.874	3.178	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)[C@]12C[C@H]1CCC2	ZINC000960752838	1318854575	/nfs/dbraw/zinc/85/45/75/1318854575.db2.gz	RBKIMDMXCBLDPA-SVFBPWRDSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]1CN(C)Cc1cccc(COC)c1	ZINC000960785800	1318886970	/nfs/dbraw/zinc/88/69/70/1318886970.db2.gz	AGBQDASUMYRXEM-LJQANCHMSA-N	0	3	344.499	3.468	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H]1CN(C)Cc1ccc(CO)cc1	ZINC000960787140	1318889220	/nfs/dbraw/zinc/88/92/20/1318889220.db2.gz	MSFXWFQZHCXOSN-IBGZPJMESA-N	0	3	344.499	3.204	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)[C@]1(C)C=CCC1	ZINC000960792972	1318901214	/nfs/dbraw/zinc/90/12/14/1318901214.db2.gz	SHMSIRAEAOATRL-PZJWPPBQSA-N	0	3	337.467	3.337	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc(C)nn2C(CC)CC)C1	ZINC001022341621	1318901249	/nfs/dbraw/zinc/90/12/49/1318901249.db2.gz	HZBRYCSVGNJKSR-OKILXGFUSA-N	0	3	338.883	3.156	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)Cc2cc3ccccc3s2)C1	ZINC001022421858	1318933932	/nfs/dbraw/zinc/93/39/32/1318933932.db2.gz	YNBIRBQZKGNPKP-OKILXGFUSA-N	0	3	334.872	3.433	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1cccc(SC(F)F)c1	ZINC000930160108	1328801431	/nfs/dbraw/zinc/80/14/31/1328801431.db2.gz	YFGPQZWFIPFDNB-UHFFFAOYSA-N	0	3	327.400	3.078	20	30		EGEDHN
C[C@@H](CC(=O)N1CCC[C@H]1CN(C)Cc1cccc(C#N)c1)C1CC1	ZINC000961038245	1319162548	/nfs/dbraw/zinc/16/25/48/1319162548.db2.gz	QRWUIVPXKFHDBV-JXFKEZNVSA-N	0	3	339.483	3.417	20	30		EGEDHN
C[C@H](CC(=O)N1CCC[C@@H]1CN(C)Cc1cccc(C#N)c1)C1CC1	ZINC000961038249	1319162840	/nfs/dbraw/zinc/16/28/40/1319162840.db2.gz	QRWUIVPXKFHDBV-OXQOHEQNSA-N	0	3	339.483	3.417	20	30		EGEDHN
CCC(=O)N1CCC[C@H]([C@@H]2CCN(CC#Cc3ccc(F)cc3)C2)C1	ZINC000961082125	1319194070	/nfs/dbraw/zinc/19/40/70/1319194070.db2.gz	VYCAYLOJCUKEHT-RBUKOAKNSA-N	0	3	342.458	3.148	20	30		EGEDHN
CCc1ccc(C#CC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)cc1	ZINC000816664941	1319205444	/nfs/dbraw/zinc/20/54/44/1319205444.db2.gz	LHPBOPSDFDZMOA-FQEVSTJZSA-N	0	3	338.426	3.159	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)N1CCC[C@@H](C#N)C1)c1ccsc1	ZINC000914066256	1319224022	/nfs/dbraw/zinc/22/40/22/1319224022.db2.gz	RLQXLMHSFOAXQQ-HOCLYGCPSA-N	0	3	334.489	3.076	20	30		EGEDHN
COc1cccc([C@H](Cc2cc(C)cc(C)c2)NC[C@H](O)CC#N)c1	ZINC000930226194	1328816414	/nfs/dbraw/zinc/81/64/14/1328816414.db2.gz	QNHYOUFFMLKCKF-CTNGQTDRSA-N	0	3	338.451	3.460	20	30		EGEDHN
C[C@@H]1CC[C@@H](C(=O)OC(C)(C)C)CN1C[C@H](O)c1ccc(C#N)cc1	ZINC000817280076	1319311526	/nfs/dbraw/zinc/31/15/26/1319311526.db2.gz	YMDYKJAWSBEDCY-OLMNPRSZSA-N	0	3	344.455	3.034	20	30		EGEDHN
C[C@@H]1CC[C@@H](C(=O)OC(C)(C)C)CN1C[C@@H](O)c1ccc(C#N)cc1	ZINC000817280077	1319313330	/nfs/dbraw/zinc/31/33/30/1319313330.db2.gz	YMDYKJAWSBEDCY-ZTFGCOKTSA-N	0	3	344.455	3.034	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@@H]2CCCN(Cc3ccc(C#N)cc3)C2)o1	ZINC001023217454	1319352815	/nfs/dbraw/zinc/35/28/15/1319352815.db2.gz	GTKPGZSBHGBXRE-SFHVURJKSA-N	0	3	337.423	3.102	20	30		EGEDHN
COc1ccc(CN(C)C)cc1NC(=O)/C=C/c1ccccc1C#N	ZINC000914845634	1319387809	/nfs/dbraw/zinc/38/78/09/1319387809.db2.gz	FAYXLJHVCVQIGO-PKNBQFBNSA-N	0	3	335.407	3.280	20	30		EGEDHN
C#CCN(C)CCCNC(=O)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl	ZINC000818593344	1319565153	/nfs/dbraw/zinc/56/51/53/1319565153.db2.gz	VFMWETHSTUGKKS-HUUCEWRRSA-N	0	3	339.266	3.168	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1cncc(-c2ccc(Cl)cc2)c1	ZINC000818603241	1319566605	/nfs/dbraw/zinc/56/66/05/1319566605.db2.gz	VKVRVLNRDVOMDM-UHFFFAOYSA-N	0	3	341.842	3.087	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1cccc(N[C@H](C)C(C)C)c1C	ZINC000818595926	1319567259	/nfs/dbraw/zinc/56/72/59/1319567259.db2.gz	UEDSPWAVWAHDAQ-QGZVFWFLSA-N	0	3	329.488	3.136	20	30		EGEDHN
C#CCN(C)CCCNC(=O)/C=C(/C)c1ccccc1C(F)(F)F	ZINC000818612069	1319570395	/nfs/dbraw/zinc/57/03/95/1319570395.db2.gz	MYQYAOZWJIOZPL-YPKPFQOOSA-N	0	3	338.373	3.180	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc3c(o2)c(F)ccc3C)C1	ZINC001023507511	1319613515	/nfs/dbraw/zinc/61/35/15/1319613515.db2.gz	SIANYCWBWSELFO-OAHLLOKOSA-N	0	3	342.414	3.345	20	30		EGEDHN
CC1(C)CC[C@H]1C(=O)NC[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001023536107	1319642684	/nfs/dbraw/zinc/64/26/84/1319642684.db2.gz	QGYYJJXEPQXCID-MOPGFXCFSA-N	0	3	339.483	3.323	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H](CNC(=O)[C@H]3CC34CCC4)C2)cc1	ZINC001023624835	1319746548	/nfs/dbraw/zinc/74/65/48/1319746548.db2.gz	HKIQGWGPAHTJOC-RBUKOAKNSA-N	0	3	337.467	3.077	20	30		EGEDHN
N#Cc1ccccc1CNCC1CC(NC(=O)C[C@H]2C=CCCC2)C1	ZINC000961982715	1319790565	/nfs/dbraw/zinc/79/05/65/1319790565.db2.gz	QIYJSJLFMBZMIZ-VXESANQCSA-N	0	3	337.467	3.289	20	30		EGEDHN
CC1(C)CC[C@H]1C(=O)NC1CC(CNCc2cc(C#N)ccc2F)C1	ZINC000962205274	1319859327	/nfs/dbraw/zinc/85/93/27/1319859327.db2.gz	XUQDKKOYIIBDAX-PREGVCBESA-N	0	3	343.446	3.118	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc(F)c3occc32)C1	ZINC001023758612	1319903307	/nfs/dbraw/zinc/90/33/07/1319903307.db2.gz	YJTVVAGZWILHBZ-AWEZNQCLSA-N	0	3	328.387	3.037	20	30		EGEDHN
CO[C@H](C)C(=O)C(C#N)C(=O)Nc1ccccc1Oc1ccccc1	ZINC000918488204	1319956447	/nfs/dbraw/zinc/95/64/47/1319956447.db2.gz	XBEIVLDOIPRRIW-HIFRSBDPSA-N	0	3	338.363	3.161	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCN(C(=O)c2ccccc2)C1	ZINC001023816965	1319960533	/nfs/dbraw/zinc/96/05/33/1319960533.db2.gz	NOVUNGSQPHZCAM-KRWDZBQOSA-N	0	3	333.435	3.200	20	30		EGEDHN
CCC(CC)C(=O)N1CCC[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001023852910	1319990081	/nfs/dbraw/zinc/99/00/81/1319990081.db2.gz	KFDOFHBCBSBSCR-HNNXBMFYSA-N	0	3	345.462	3.462	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N(CCN(C)C)C2CCCC2)cc1	ZINC000823298291	1320169224	/nfs/dbraw/zinc/16/92/24/1320169224.db2.gz	PLMKTHBASBCSGB-UHFFFAOYSA-N	0	3	328.456	3.035	20	30		EGEDHN
CC[C@@H](NC(=O)C(C#N)C(=O)COC(C)(C)CC)c1ccccc1	ZINC000838866459	1320825633	/nfs/dbraw/zinc/82/56/33/1320825633.db2.gz	PIOQJHFRXUVDRZ-HZPDHXFCSA-N	0	3	330.428	3.168	20	30		EGEDHN
Cc1ccc([C@H](C)N[C@H]2CCN(c3sccc3C#N)C2=O)s1	ZINC000839553414	1320936706	/nfs/dbraw/zinc/93/67/06/1320936706.db2.gz	QBICDBCQGSCCHW-AAEUAGOBSA-N	0	3	331.466	3.446	20	30		EGEDHN
CCN(CC)Cc1ccc(C(=O)Oc2cccc(OCC#N)c2)o1	ZINC000841342833	1321260784	/nfs/dbraw/zinc/26/07/84/1321260784.db2.gz	PTLWIWFUHHJWJJ-UHFFFAOYSA-N	0	3	328.368	3.243	20	30		EGEDHN
C=CCC[C@@H]1NC(=O)N(C[C@H]2CCCN(C)[C@H]2c2cccs2)C1=O	ZINC000842243690	1321364672	/nfs/dbraw/zinc/36/46/72/1321364672.db2.gz	IJOUTYLILMCIJW-IJEWVQPXSA-N	0	3	347.484	3.018	20	30		EGEDHN
CCOc1ccc(C[C@@H](C)C(=O)C(C#N)C(=O)NC2CCCC2)cc1	ZINC000842291331	1321368308	/nfs/dbraw/zinc/36/83/08/1321368308.db2.gz	IMZWDNJFBCYKLW-KDOFPFPSSA-N	0	3	342.439	3.032	20	30		EGEDHN
C=C[C@@H](C)ONC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1	ZINC000844283932	1321585174	/nfs/dbraw/zinc/58/51/74/1321585174.db2.gz	KDJIHXAPJZJCJW-HUUCEWRRSA-N	0	3	337.489	3.326	20	30		EGEDHN
C=C(C)CONC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1	ZINC000844284354	1321585250	/nfs/dbraw/zinc/58/52/50/1321585250.db2.gz	SSTSLFQUECXXKH-OAHLLOKOSA-N	0	3	337.489	3.328	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN2CCN(C)C[C@H]2Cc2ccccc2)cc1	ZINC000846066805	1321766031	/nfs/dbraw/zinc/76/60/31/1321766031.db2.gz	GWBQVNWZORBMKU-GHTZIAJQSA-N	0	3	349.478	3.336	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccccc2OCCC(C)C)CC1	ZINC000847168579	1321848117	/nfs/dbraw/zinc/84/81/17/1321848117.db2.gz	RDCRLXPTIASIKC-UHFFFAOYSA-N	0	3	328.456	3.395	20	30		EGEDHN
CCC[C@@H](OC)C(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847747080	1321900480	/nfs/dbraw/zinc/90/04/80/1321900480.db2.gz	XARLIVIPEVSRRX-GOSISDBHSA-N	0	3	344.455	3.151	20	30		EGEDHN
COc1cccc(/C=N/CC2CCN(Cc3ccncc3)CC2)c1O	ZINC000849169491	1322093314	/nfs/dbraw/zinc/09/33/14/1322093314.db2.gz	DDXXIMLYYWNVTI-HYARGMPZSA-N	0	3	339.439	3.127	20	30		EGEDHN
C=CCc1cc(OCC)cc(CN2CCN(CC3CC3)CC2)c1O	ZINC000919941840	1322120200	/nfs/dbraw/zinc/12/02/00/1322120200.db2.gz	WAMGHZPKCCBMBM-UHFFFAOYSA-N	0	3	330.472	3.047	20	30		EGEDHN
CC[C@@H](NC(=O)C(C#N)C(=O)CCCc1cccnc1)c1ccccc1	ZINC000850978032	1322318385	/nfs/dbraw/zinc/31/83/85/1322318385.db2.gz	KDKUHUMCEFMTBD-RTBURBONSA-N	0	3	349.434	3.381	20	30		EGEDHN
CC(C)C[C@@H](CCO)CNCc1cc(C#N)ccc1Br	ZINC000921807944	1322401261	/nfs/dbraw/zinc/40/12/61/1322401261.db2.gz	VQVWLEGAGUYOES-CQSZACIVSA-N	0	3	339.277	3.455	20	30		EGEDHN
CCOC(=O)c1c[nH]nc1[C@@H]1CCN([C@@H](C)c2ccc(C#N)cc2)C1	ZINC000931010902	1329027864	/nfs/dbraw/zinc/02/78/64/1329027864.db2.gz	REPCKCOTIRQSAR-XJKSGUPXSA-N	0	3	338.411	3.009	20	30		EGEDHN
CC1CC(C(=O)N2CCC[C@H](CNCc3cc(F)ccc3C#N)C2)C1	ZINC001023926402	1323031673	/nfs/dbraw/zinc/03/16/73/1323031673.db2.gz	GNPQXDSCGACMNO-ISXOHVOVSA-N	0	3	343.446	3.072	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N1CCC[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001023936247	1323041505	/nfs/dbraw/zinc/04/15/05/1323041505.db2.gz	YKJAKKDWICAPFV-KBXCAEBGSA-N	0	3	343.446	3.072	20	30		EGEDHN
CC(=O)N[C@H](c1ccccc1F)[C@@H](C)NCc1cccc(C#N)c1	ZINC000924639816	1323089535	/nfs/dbraw/zinc/08/95/35/1323089535.db2.gz	NENRCHNTOMCIEF-YJYMSZOUSA-N	0	3	325.387	3.053	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC001024042206	1323093320	/nfs/dbraw/zinc/09/33/20/1323093320.db2.gz	KZLPJHOYWBSRCZ-IBGZPJMESA-N	0	3	347.462	3.129	20	30		EGEDHN
C=CCC[C@@H](c1ccccc1)N1C(=O)N[C@H](CN2CCCCC2)C1=O	ZINC000924711717	1323126655	/nfs/dbraw/zinc/12/66/55/1323126655.db2.gz	DEXIFAOGCZFHNP-MSOLQXFVSA-N	0	3	341.455	3.100	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H](CNCc2oc(CC)nc2C)C1	ZINC001024137968	1323162528	/nfs/dbraw/zinc/16/25/28/1323162528.db2.gz	WTCPMHSLZDLIEC-OXQOHEQNSA-N	0	3	347.503	3.476	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H](CNCc2oc(C)nc2C)C1	ZINC001024137890	1323163098	/nfs/dbraw/zinc/16/30/98/1323163098.db2.gz	VBTRDAKJGRLLGX-QFBILLFUSA-N	0	3	333.476	3.222	20	30		EGEDHN
CN(CC(=O)C(C#N)c1nc2ccccc2s1)CC1=CCSC1	ZINC000852747571	1323236505	/nfs/dbraw/zinc/23/65/05/1323236505.db2.gz	OIWNGRCLMRTRRU-ZDUSSCGKSA-N	0	3	343.477	3.078	20	30		EGEDHN
CCC(=O)N1CCC[C@H]([C@@H]2CCCN2Cc2ccc(F)c(C#N)c2)C1	ZINC000963213978	1323239941	/nfs/dbraw/zinc/23/99/41/1323239941.db2.gz	CQEHKRZTLGMGGR-LPHOPBHVSA-N	0	3	343.446	3.310	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@@H]1CC[C@H](c2ccccc2)O1	ZINC001024442664	1323403454	/nfs/dbraw/zinc/40/34/54/1323403454.db2.gz	VGYXCKCCRNUYPB-AQNXPRMDSA-N	0	3	342.483	3.454	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cccc([C@H]2CCOC2)c1	ZINC001024515589	1323464755	/nfs/dbraw/zinc/46/47/55/1323464755.db2.gz	WEIAIWROSVZWLU-VQTJNVASSA-N	0	3	342.483	3.351	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccc(-n2ccnc2)cc1	ZINC001024576081	1323512513	/nfs/dbraw/zinc/51/25/13/1323512513.db2.gz	PHQNTIIYXJAVPU-LJQANCHMSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CCCCN2C[C@@H]2CCCCO2)CC1	ZINC001024632781	1323558845	/nfs/dbraw/zinc/55/88/45/1323558845.db2.gz	BDXGZOQLIPQQGO-OALUTQOASA-N	0	3	334.504	3.273	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cccc(N2CC=CC2)c1	ZINC001024677273	1323589503	/nfs/dbraw/zinc/58/95/03/1323589503.db2.gz	GRROMAFAIVOYLR-HXUWFJFHSA-N	0	3	339.483	3.223	20	30		EGEDHN
C=CCCN1CCCC[C@H]1CNC(=O)c1cc(Br)co1	ZINC001024691655	1323608070	/nfs/dbraw/zinc/60/80/70/1323608070.db2.gz	YQMCNPAQXARYNS-ZDUSSCGKSA-N	0	3	341.249	3.203	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1ccccc1OC	ZINC001024701169	1323615040	/nfs/dbraw/zinc/61/50/40/1323615040.db2.gz	LPOSKCROPHEGOF-NZSAHSFTSA-N	0	3	342.483	3.346	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccc(OC)c(C2CC2)c1	ZINC001024732080	1323631820	/nfs/dbraw/zinc/63/18/20/1323631820.db2.gz	PQKMRQAUDALCSB-SFHVURJKSA-N	0	3	340.467	3.180	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cnn([C@H](C)CC)c1C	ZINC001024750032	1323652609	/nfs/dbraw/zinc/65/26/09/1323652609.db2.gz	KIKRBYPREPOTCZ-NVXWUHKLSA-N	0	3	332.492	3.323	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1cc(C)n(C(C)C)c1C	ZINC001024795074	1323701062	/nfs/dbraw/zinc/70/10/62/1323701062.db2.gz	YFBKGZFNDLJVCK-SFHVURJKSA-N	0	3	329.488	3.293	20	30		EGEDHN
C=C(Cl)CN1CCCC[C@H]1CNC(=O)c1ccccc1CN(C)C	ZINC001024814364	1323717461	/nfs/dbraw/zinc/71/74/61/1323717461.db2.gz	RRXIIJQTIAQMTO-KRWDZBQOSA-N	0	3	349.906	3.085	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1[nH]c2ccccc2c1OC	ZINC001024820347	1323726321	/nfs/dbraw/zinc/72/63/21/1323726321.db2.gz	YILGECIJKOOUSX-HNNXBMFYSA-N	0	3	341.455	3.337	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)C[C@H]2C=CCC2)s1	ZINC001024862675	1323754664	/nfs/dbraw/zinc/75/46/64/1323754664.db2.gz	VVVOQMHIWIXAAG-JKSUJKDBSA-N	0	3	343.496	3.447	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCCC[C@@H]1CNCc1cc2ccccc2o1	ZINC001024902338	1323772488	/nfs/dbraw/zinc/77/24/88/1323772488.db2.gz	OOTLTIHQGDNVEQ-GOEBONIOSA-N	0	3	325.412	3.063	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@@H]1CNCc1cn(C(C)C)nc1C	ZINC001025040924	1323843681	/nfs/dbraw/zinc/84/36/81/1323843681.db2.gz	PEOVDWAXDJKBIH-GOSISDBHSA-N	0	3	346.519	3.455	20	30		EGEDHN
CC(C)[C@H](F)C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)s1	ZINC001025048694	1323852502	/nfs/dbraw/zinc/85/25/02/1323852502.db2.gz	HEJVJXDQEOBUPV-CJNGLKHVSA-N	0	3	337.464	3.085	20	30		EGEDHN
CC1(C(=O)N2CCCC[C@H]2CNCc2ccc(C#N)s2)CC=CC1	ZINC001025066916	1323867029	/nfs/dbraw/zinc/86/70/29/1323867029.db2.gz	HUVDFGVQGUJECQ-HNNXBMFYSA-N	0	3	343.496	3.447	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCCC[C@H]2CNCc2ncccc2C)C1	ZINC001025075236	1323877876	/nfs/dbraw/zinc/87/78/76/1323877876.db2.gz	YMAGVDUORFFFQW-KRWDZBQOSA-N	0	3	327.472	3.217	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cccc(F)c1	ZINC001025195983	1323977939	/nfs/dbraw/zinc/97/79/39/1323977939.db2.gz	PHTAODFGSDIYML-MOPGFXCFSA-N	0	3	328.431	3.308	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc[nH]c1CC	ZINC001025230180	1324016823	/nfs/dbraw/zinc/01/68/23/1324016823.db2.gz	VIWPCLHZKRSONK-MOPGFXCFSA-N	0	3	327.472	3.060	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc(F)c(F)c1	ZINC001025239888	1324032738	/nfs/dbraw/zinc/03/27/38/1324032738.db2.gz	JXCDXRVJQHGCPM-MSOLQXFVSA-N	0	3	332.394	3.057	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc2cnccc2o1	ZINC001025248120	1324048584	/nfs/dbraw/zinc/04/85/84/1324048584.db2.gz	VPSOHKZHOZDHKI-IAGOWNOFSA-N	0	3	339.439	3.473	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(Cl)cn1C	ZINC001025250226	1324050033	/nfs/dbraw/zinc/05/00/33/1324050033.db2.gz	IICFZPBOEURYEV-IRXDYDNUSA-N	0	3	347.890	3.161	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc(C)c(C)n1	ZINC001025252718	1324057988	/nfs/dbraw/zinc/05/79/88/1324057988.db2.gz	QIGJIGAIMBIZSI-UXHICEINSA-N	0	3	339.483	3.181	20	30		EGEDHN
N#CCOc1ccc(CN2C[C@@H]3C[C@H]2CN3Cc2ccccc2)cc1	ZINC000931489623	1329129799	/nfs/dbraw/zinc/12/97/99/1329129799.db2.gz	NJVGRLIIFKQLNC-PMACEKPBSA-N	0	3	333.435	3.048	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)C1(C(F)F)CCCC1	ZINC001025261494	1324071496	/nfs/dbraw/zinc/07/14/96/1324071496.db2.gz	WGGZCTQBVHMXGA-JKSUJKDBSA-N	0	3	338.442	3.291	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccncc1Cl	ZINC001025273933	1324090455	/nfs/dbraw/zinc/09/04/55/1324090455.db2.gz	SJFRXKUZQJFFJM-ZWKOTPCHSA-N	0	3	345.874	3.217	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc(Cl)cn1	ZINC001025292389	1324116591	/nfs/dbraw/zinc/11/65/91/1324116591.db2.gz	ICIGXNPYAIWOAG-ROUUACIJSA-N	0	3	345.874	3.217	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc(F)cc1C	ZINC001025292996	1324119516	/nfs/dbraw/zinc/11/95/16/1324119516.db2.gz	OOZDMUMIQPBWNE-RBUKOAKNSA-N	0	3	328.431	3.226	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc(Cl)cc1	ZINC001025294316	1324123125	/nfs/dbraw/zinc/12/31/25/1324123125.db2.gz	ZHOLUCRUFQDSPJ-ROUUACIJSA-N	0	3	330.859	3.432	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc(OCC)cc1	ZINC001025296555	1324127993	/nfs/dbraw/zinc/12/79/93/1324127993.db2.gz	KFHQWFIGKVUPRE-UXHICEINSA-N	0	3	340.467	3.178	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cccc2cnccc21	ZINC001025296390	1324128181	/nfs/dbraw/zinc/12/81/81/1324128181.db2.gz	SVNUIGXVNCCZIE-LEWJYISDSA-N	0	3	347.462	3.327	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cncnc1C(C)C	ZINC001025301226	1324133954	/nfs/dbraw/zinc/13/39/54/1324133954.db2.gz	IFIXNVNDWZZQTR-ROUUACIJSA-N	0	3	342.487	3.245	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)Cc1ccc(C)s1	ZINC001025301467	1324135542	/nfs/dbraw/zinc/13/55/42/1324135542.db2.gz	KEUMCQKAJATLAI-ZWKOTPCHSA-N	0	3	330.497	3.078	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2oc3ccc(F)cc3c2C)C1	ZINC001025441387	1324281105	/nfs/dbraw/zinc/28/11/05/1324281105.db2.gz	CUTUUELAQRFRRZ-CABCVRRESA-N	0	3	342.414	3.344	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(CC(C)C)s2)C1	ZINC001025441683	1324282104	/nfs/dbraw/zinc/28/21/04/1324282104.db2.gz	GVXRWRUDZXBYQD-CVEARBPZSA-N	0	3	332.513	3.410	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2nc(C(C)(C)C)cs2)C1	ZINC001025445370	1324286464	/nfs/dbraw/zinc/28/64/64/1324286464.db2.gz	LWRSCXBSJAKUFJ-LSDHHAIUSA-N	0	3	347.528	3.294	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccnn2C(CC)CC)C1	ZINC001025443911	1324286744	/nfs/dbraw/zinc/28/67/44/1324286744.db2.gz	VKUYQIMUCAVQPI-IRXDYDNUSA-N	0	3	344.503	3.098	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)C2CCc3ccccc3CC2)C1	ZINC001025464523	1324310867	/nfs/dbraw/zinc/31/08/67/1324310867.db2.gz	QSWQYFPDKRBUSB-UWJYYQICSA-N	0	3	338.495	3.032	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc3cc(C)ccc3n2)C1	ZINC001025478004	1324323720	/nfs/dbraw/zinc/32/37/20/1324323720.db2.gz	KZGXXLCIJCYVRK-HKUYNNGSSA-N	0	3	349.478	3.397	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(Cl)cc2OC)C1	ZINC001025520106	1324364509	/nfs/dbraw/zinc/36/45/09/1324364509.db2.gz	RNAFJGZWDHUDOA-GJZGRUSLSA-N	0	3	348.874	3.202	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccn(C(CC)CC)n2)C1	ZINC001025545722	1324393755	/nfs/dbraw/zinc/39/37/55/1324393755.db2.gz	LBBOVIVEHSDSNC-SJORKVTESA-N	0	3	344.503	3.098	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(C(F)F)cc2)C1	ZINC001025557931	1324405913	/nfs/dbraw/zinc/40/59/13/1324405913.db2.gz	JVLQHKYUWNVSKF-RHSMWYFYSA-N	0	3	334.410	3.478	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cccc3c2ccn3C)C1	ZINC001025560113	1324407934	/nfs/dbraw/zinc/40/79/34/1324407934.db2.gz	ANXGQDYIRNUWDF-DLBZAZTESA-N	0	3	337.467	3.032	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(-c3ccccc3)nc2)C1	ZINC001025577841	1324418346	/nfs/dbraw/zinc/41/83/46/1324418346.db2.gz	VANRCYQMKGGSGB-YLJYHZDGSA-N	0	3	347.462	3.212	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(Cl)cc(OC)c2)C1	ZINC001025578572	1324419712	/nfs/dbraw/zinc/41/97/12/1324419712.db2.gz	YBSLLWBVVVYDTB-LSDHHAIUSA-N	0	3	348.874	3.202	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cccc(C(F)F)c2)C1	ZINC001025598317	1324447545	/nfs/dbraw/zinc/44/75/45/1324447545.db2.gz	YJYQUSAUMCOSST-YOEHRIQHSA-N	0	3	334.410	3.478	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2coc3ccc(F)cc23)C1	ZINC001025607906	1324458363	/nfs/dbraw/zinc/45/83/63/1324458363.db2.gz	JEUNHGBEEYXIEW-LSDHHAIUSA-N	0	3	342.414	3.426	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2sccc2C2CC2)C1	ZINC001025611684	1324464653	/nfs/dbraw/zinc/46/46/53/1324464653.db2.gz	OBBOJZRGXOTLRK-HOCLYGCPSA-N	0	3	330.497	3.479	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc3c(s2)CCCC3)C1	ZINC001025614670	1324467636	/nfs/dbraw/zinc/46/76/36/1324467636.db2.gz	NSIGEURVUGFHRF-NVXWUHKLSA-N	0	3	344.524	3.481	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(OC(C)C)cc2)C1	ZINC001025614718	1324468201	/nfs/dbraw/zinc/46/82/01/1324468201.db2.gz	OIEKNQHVPFRBLI-IEBWSBKVSA-N	0	3	342.483	3.327	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cccc3cnccc32)C1	ZINC001025617089	1324469116	/nfs/dbraw/zinc/46/91/16/1324469116.db2.gz	DMIUZZGWCONSQF-WMZOPIPTSA-N	0	3	335.451	3.088	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)C23CC(C(C)(C)C)(C2)C3)C1	ZINC001025632683	1324484573	/nfs/dbraw/zinc/48/45/73/1324484573.db2.gz	NEJPLVPYEAPITA-AMZMEHNNSA-N	0	3	330.516	3.443	20	30		EGEDHN
Cc1cocc1C(=O)N1C[C@@H]2CC[C@@H](NCc3ccccc3C#N)[C@H]2C1	ZINC001026331166	1324731060	/nfs/dbraw/zinc/73/10/60/1324731060.db2.gz	QAYNXIUYHMUCNY-CMKODMSKSA-N	0	3	349.434	3.100	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CC[C@@H]2CN(C(=O)C3CC4(CC4)C3)C[C@@H]12	ZINC001026357838	1324750251	/nfs/dbraw/zinc/75/02/51/1324750251.db2.gz	KMDRBRDZLRAZRC-MISYRCLQSA-N	0	3	349.478	3.075	20	30		EGEDHN
C=C1CC(C)(C(=O)NC2CCC(NCc3ncc(C)s3)CC2)C1	ZINC001026555181	1324891866	/nfs/dbraw/zinc/89/18/66/1324891866.db2.gz	NSZPVOMCTHZZHA-UHFFFAOYSA-N	0	3	333.501	3.325	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCN(C(=O)c2ccoc2Cl)C1	ZINC001026806244	1325029697	/nfs/dbraw/zinc/02/96/97/1325029697.db2.gz	KILRVYSUCVKSBF-CYBMUJFWSA-N	0	3	343.814	3.057	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](CNCc2nsc3ccccc23)C1	ZINC001026992980	1325131238	/nfs/dbraw/zinc/13/12/38/1325131238.db2.gz	WYKHDVGJZXNVAD-AWEZNQCLSA-N	0	3	343.496	3.447	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](CNCc2oc(C(C)C)nc2C)C1	ZINC001026993810	1325131565	/nfs/dbraw/zinc/13/15/65/1325131565.db2.gz	JJCLUOXINNSFAR-OAHLLOKOSA-N	0	3	333.476	3.257	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCN(C(=O)C2CC3(CCC3)C2)C1	ZINC001027008647	1325147353	/nfs/dbraw/zinc/14/73/53/1325147353.db2.gz	QICBEVFWUJVFCT-MRXNPFEDSA-N	0	3	337.467	3.077	20	30		EGEDHN
CN(C(=O)C1(C)CC1)C1CCC(NCc2ccccc2C#N)CC1	ZINC000963356249	1325150690	/nfs/dbraw/zinc/15/06/90/1325150690.db2.gz	FITWYACRCGCSCU-UHFFFAOYSA-N	0	3	325.456	3.218	20	30		EGEDHN
N#Cc1c(Cl)nsc1NCC1CCN(Cc2ccncc2)CC1	ZINC000853810586	1325166265	/nfs/dbraw/zinc/16/62/65/1325166265.db2.gz	AITVCXHXZCLNAD-UHFFFAOYSA-N	0	3	347.875	3.387	20	30		EGEDHN
N#Cc1sc(NCC2CCN(Cc3ccncc3)CC2)nc1Cl	ZINC000853811083	1325167448	/nfs/dbraw/zinc/16/74/48/1325167448.db2.gz	SJZSIADWMYFADQ-UHFFFAOYSA-N	0	3	347.875	3.387	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H](CNCc2nc(C)sc2C)C1	ZINC001027037879	1325172086	/nfs/dbraw/zinc/17/20/86/1325172086.db2.gz	DDDZVIHXKKATBV-QAPCUYQASA-N	0	3	335.517	3.300	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H](CNCc2ccccc2C#N)C1	ZINC001027038062	1325172424	/nfs/dbraw/zinc/17/24/24/1325172424.db2.gz	HDYQXWFAONIPIU-OXQOHEQNSA-N	0	3	325.456	3.099	20	30		EGEDHN
CC1(C)CC[C@@H](C(=O)N2CC[C@@H](CNCc3ccccc3C#N)C2)C1	ZINC001027045325	1325181484	/nfs/dbraw/zinc/18/14/84/1325181484.db2.gz	QSYCCZURAAESAS-DLBZAZTESA-N	0	3	339.483	3.323	20	30		EGEDHN
N#Cc1ccc(F)c(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)c1	ZINC000854310632	1325241139	/nfs/dbraw/zinc/24/11/39/1325241139.db2.gz	WHBSPYYPZJFERV-IBGZPJMESA-N	0	3	337.398	3.264	20	30		EGEDHN
C/C(=C\C(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)cc2)C1)C1CC1	ZINC001027313215	1325463467	/nfs/dbraw/zinc/46/34/67/1325463467.db2.gz	AUNLRKUXMANLRD-ZRNYNZGJSA-N	0	3	337.467	3.337	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)C(C)(C)c1cccnc1)C2	ZINC000964145169	1325482151	/nfs/dbraw/zinc/48/21/51/1325482151.db2.gz	SCCXUACEJDMSBO-UHFFFAOYSA-N	0	3	347.890	3.129	20	30		EGEDHN
CN(Cc1ccc(F)c(C#N)c1)[C@H]1CCCN(C(=O)/C=C/C2CC2)C1	ZINC001027340918	1325501210	/nfs/dbraw/zinc/50/12/10/1325501210.db2.gz	GTWMTUZCKIHCHM-KOEDOTQGSA-N	0	3	341.430	3.086	20	30		EGEDHN
CCC[C@@H](OCC)C(=O)C(C#N)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000860474044	1329321849	/nfs/dbraw/zinc/32/18/49/1329321849.db2.gz	VRLONIPAMPSKQM-BXUZGUMPSA-N	0	3	340.782	3.332	20	30		EGEDHN
C[C@H](CC(=O)C(C#N)C(=O)NCc1ccc(F)cc1F)c1ccco1	ZINC000860692854	1329344885	/nfs/dbraw/zinc/34/48/85/1329344885.db2.gz	XFQMXVPONXTJOX-BXUZGUMPSA-N	0	3	346.333	3.077	20	30		EGEDHN
CC[C@@H](NC(=O)C(C#N)C(=O)[C@@H]1C[C@H]1c1ccco1)c1ccccc1	ZINC000860693481	1329345021	/nfs/dbraw/zinc/34/50/21/1329345021.db2.gz	HGKLPHRIWBFAPF-QBPKDAKJSA-N	0	3	336.391	3.359	20	30		EGEDHN
CN(Cc1cc2ccccc2o1)[C@H]1CCCN(C(=O)C#CC2CC2)C1	ZINC001027405584	1327631992	/nfs/dbraw/zinc/63/19/92/1327631992.db2.gz	ISMBPZDPLYPWRP-SFHVURJKSA-N	0	3	336.435	3.269	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)c(F)c2)C1	ZINC001027522630	1327795683	/nfs/dbraw/zinc/79/56/83/1327795683.db2.gz	YIIGAVSCYLXZLU-QGZVFWFLSA-N	0	3	343.446	3.332	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H](N(C)CCn2nc(C)cc2C)C1	ZINC001027560106	1327876335	/nfs/dbraw/zinc/87/63/35/1327876335.db2.gz	PUMHOXJLBDFOIK-QUCCMNQESA-N	0	3	346.519	3.025	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)CC(C)(F)F)C1	ZINC001027562905	1327882090	/nfs/dbraw/zinc/88/20/90/1327882090.db2.gz	YOFZNUFGNDDBBG-MRXNPFEDSA-N	0	3	335.398	3.026	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)C(C)(C)C(F)F)C1	ZINC001027567727	1327896901	/nfs/dbraw/zinc/89/69/01/1327896901.db2.gz	ZDDJNGMMXGDHSW-INIZCTEOSA-N	0	3	349.425	3.272	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)C2(CF)CCC2)C1	ZINC001027584992	1327921878	/nfs/dbraw/zinc/92/18/78/1327921878.db2.gz	WTFXOJRCWYDZHV-SFHVURJKSA-N	0	3	343.446	3.121	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)C(C)(C)c2cccc(Cl)c2)C1	ZINC001027595657	1327942663	/nfs/dbraw/zinc/94/26/63/1327942663.db2.gz	FRCIOQKCYQTLCF-QGZVFWFLSA-N	0	3	332.875	3.174	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)c2ccc(Cl)c3occc32)C1	ZINC001027646392	1328024868	/nfs/dbraw/zinc/02/48/68/1328024868.db2.gz	VFNBPFDVQWNHQE-ZDUSSCGKSA-N	0	3	330.815	3.256	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1cc(F)cc2ccncc21	ZINC001027890133	1328355711	/nfs/dbraw/zinc/35/57/11/1328355711.db2.gz	QDEIBTOOWSPZJJ-INIZCTEOSA-N	0	3	327.403	3.144	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN(C)C[C@@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000862541259	1329495017	/nfs/dbraw/zinc/49/50/17/1329495017.db2.gz	RKPOBMDKKGOLNJ-HUUCEWRRSA-N	0	3	347.459	3.322	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001050617314	1348304208	/nfs/dbraw/zinc/30/42/08/1348304208.db2.gz	GZITZGZUEHDOIJ-UHFFFAOYSA-N	0	3	337.467	3.195	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CNCc2cc3c([nH]c2=O)CCCC3)cc1	ZINC000865878856	1329748222	/nfs/dbraw/zinc/74/82/22/1329748222.db2.gz	CPHIFLHAMZXFCP-CQSZACIVSA-N	0	3	337.423	3.247	20	30		EGEDHN
CN(C)CCN(Cc1ccsc1)C(=O)Nc1sccc1C#N	ZINC000931833584	1329765077	/nfs/dbraw/zinc/76/50/77/1329765077.db2.gz	JCMYYYUKZONOOT-UHFFFAOYSA-N	0	3	334.470	3.277	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(OC(F)F)cc2F)CC1	ZINC000932144272	1329788590	/nfs/dbraw/zinc/78/85/90/1329788590.db2.gz	OBDPLPWMOZHMCE-UHFFFAOYSA-N	0	3	342.361	3.197	20	30		EGEDHN
CC(C)(C)OC(=O)NCC[C@H]1CCN(Cc2ccc(C#N)c(F)c2)C1	ZINC000932697426	1329834373	/nfs/dbraw/zinc/83/43/73/1329834373.db2.gz	QTRBFTNMNAUNAA-AWEZNQCLSA-N	0	3	347.434	3.434	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000933219458	1329872696	/nfs/dbraw/zinc/87/26/96/1329872696.db2.gz	QYMQBTLJHMDPCM-INIZCTEOSA-N	0	3	348.462	3.387	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2cc(Cl)ccc2Cl)CC1	ZINC001052891722	1348728850	/nfs/dbraw/zinc/72/88/50/1348728850.db2.gz	ZWODFFKPKBGNMD-ZDUSSCGKSA-N	0	3	325.239	3.211	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3ccccc3nc2C)[C@@H](C)C1	ZINC000942107175	1331833071	/nfs/dbraw/zinc/83/30/71/1331833071.db2.gz	UYCBGRPTBXBJFK-HNAYVOBHSA-N	0	3	335.451	3.007	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CCN(CCC(F)(F)F)C[C@@H]1C	ZINC000942128710	1331841301	/nfs/dbraw/zinc/84/13/01/1331841301.db2.gz	GUWDWDXYMFHZRD-UONOGXRCSA-N	0	3	343.393	3.067	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc3c4c(cccc42)CC3)[C@@H](C)C1	ZINC000942393898	1331923089	/nfs/dbraw/zinc/92/30/89/1331923089.db2.gz	QGKYEOKKUVSASW-YWZLYKJASA-N	0	3	332.447	3.012	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cc3ccccc3s2)[C@H](C)C1	ZINC000942465359	1331939841	/nfs/dbraw/zinc/93/98/41/1331939841.db2.gz	FLDNZZGAOQOSMD-QAPCUYQASA-N	0	3	340.492	3.294	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2c(C)occ2C(F)(F)F)[C@H](C)C1	ZINC000942517574	1331950716	/nfs/dbraw/zinc/95/07/16/1331950716.db2.gz	BOTAGLLNGHGPLZ-BXUZGUMPSA-N	0	3	342.361	3.070	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2sccc2-n2cccc2)[C@H](C)C1	ZINC000942544754	1331967249	/nfs/dbraw/zinc/96/72/49/1331967249.db2.gz	DZTYQKOJZVJPGW-CVEARBPZSA-N	0	3	341.480	3.002	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2sccc2-n2cccc2)[C@@H](C)C1	ZINC000942546353	1331967754	/nfs/dbraw/zinc/96/77/54/1331967754.db2.gz	SVHREGOMJFJPQF-GJZGRUSLSA-N	0	3	329.469	3.165	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3cccc(C)c3)CCC2)[C@@H](C)C1	ZINC000942551384	1331969934	/nfs/dbraw/zinc/96/99/34/1331969934.db2.gz	SJRDESPWJQEILZ-AZUAARDMSA-N	0	3	338.495	3.267	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3cnccc3C)C[C@@H]2C)C1	ZINC000942602082	1331999226	/nfs/dbraw/zinc/99/92/26/1331999226.db2.gz	CTDBJEJFDQEODD-WMZOPIPTSA-N	0	3	327.472	3.073	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C(F)F)c(F)c2)[C@@H](C)C1	ZINC000942823765	1332043183	/nfs/dbraw/zinc/04/31/83/1332043183.db2.gz	VSYLWUZMWBFTSV-BLLLJJGKSA-N	0	3	338.373	3.227	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(F)c3ncccc3c2)[C@@H](C)C1	ZINC000943648632	1332228992	/nfs/dbraw/zinc/22/89/92/1332228992.db2.gz	VLCQJGVIINVHNQ-SUMWQHHRSA-N	0	3	327.403	3.000	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cnn(C(CC)CC)c2C)[C@@H](C)C1	ZINC000944033476	1332312132	/nfs/dbraw/zinc/31/21/32/1332312132.db2.gz	MHOXFFIVXBDUKW-KXBFYZLASA-N	0	3	344.503	3.016	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnn(C(CC)CC)c2C)[C@@H](C)C1	ZINC000944063925	1332319778	/nfs/dbraw/zinc/31/97/78/1332319778.db2.gz	WIXSJHWOWAEPQM-KSSFIOAISA-N	0	3	332.492	3.179	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(Cl)c(CCC)c2)[C@H](C)C1	ZINC000944082738	1332323510	/nfs/dbraw/zinc/32/35/10/1332323510.db2.gz	ZPVRXXRBUXQLRE-RDTXWAMCSA-N	0	3	332.875	3.366	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cccc3ccccc32)[C@H](C)C1	ZINC000944262785	1332355786	/nfs/dbraw/zinc/35/57/86/1332355786.db2.gz	CVKGRTZEBWJKCU-UTKZUKDTSA-N	0	3	334.463	3.232	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2coc3ccc(F)cc23)[C@H](C)C1	ZINC000944492136	1332413663	/nfs/dbraw/zinc/41/36/63/1332413663.db2.gz	OBFQSIINCMZDIA-CXAGYDPISA-N	0	3	328.387	3.035	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)nc3ccccc32)[C@@H](C)C1	ZINC000944619943	1332419454	/nfs/dbraw/zinc/41/94/54/1332419454.db2.gz	PWWVJVVCHSNVOV-HNAYVOBHSA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)n(C(C)C)c2C)[C@@H](C)C1	ZINC000944890683	1332445104	/nfs/dbraw/zinc/44/51/04/1332445104.db2.gz	MXKDPIHEMVLMCQ-KXBFYZLASA-N	0	3	329.488	3.149	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(-c3ccccc3)co2)[C@H](C)C1	ZINC000946314189	1332786014	/nfs/dbraw/zinc/78/60/14/1332786014.db2.gz	SNSQORLCVKTSJQ-VQIMIIECSA-N	0	3	336.435	3.410	20	30		EGEDHN
CCCC(=O)N1CC[C@H]2CN(Cc3ccc(F)c(C#N)c3)C[C@H]2CC1	ZINC000946439678	1332826516	/nfs/dbraw/zinc/82/65/16/1332826516.db2.gz	MHJIXHFTQFPAST-CALCHBBNSA-N	0	3	343.446	3.168	20	30		EGEDHN
C/C=C(\C)C(=O)N1CC[C@H]2CN(Cc3ccccc3C#N)C[C@H]2CC1	ZINC000946542707	1332851400	/nfs/dbraw/zinc/85/14/00/1332851400.db2.gz	XUNHTKNNYCPVOJ-KFKREPOCSA-N	0	3	337.467	3.195	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CN([C@H](C)c3ncc(C)o3)C[C@H]2CC1	ZINC000946713997	1332882466	/nfs/dbraw/zinc/88/24/66/1332882466.db2.gz	COLVKAJLEYSNOD-ZACQAIPSSA-N	0	3	345.487	3.427	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2ccccc2)CCN1Cc1ccc(C#N)cc1	ZINC000947005196	1332967307	/nfs/dbraw/zinc/96/73/07/1332967307.db2.gz	LUQBMODWDYAUOW-UZLBHIALSA-N	0	3	333.435	3.341	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2ccccc2)CCN1Cc1cccc(C#N)c1	ZINC000947006359	1332968103	/nfs/dbraw/zinc/96/81/03/1332968103.db2.gz	ZXAXCZZMMQXWIJ-OXQOHEQNSA-N	0	3	333.435	3.341	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)CC2CCC2)CCN1Cc1ccc(C#N)cc1	ZINC000947166522	1333033452	/nfs/dbraw/zinc/03/34/52/1333033452.db2.gz	ORCRUBZPARNQAQ-HNAYVOBHSA-N	0	3	325.456	3.218	20	30		EGEDHN
Cc1cc(C(=O)N[C@H]2CCN(Cc3cccc(C#N)c3)[C@@H](C)C2)co1	ZINC000947244677	1333063166	/nfs/dbraw/zinc/06/31/66/1333063166.db2.gz	NXYJTQQYMUYFLB-LIRRHRJNSA-N	0	3	337.423	3.243	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2coc3ccc(C)cc23)C[C@@H]1C	ZINC000947356077	1333101207	/nfs/dbraw/zinc/10/12/07/1333101207.db2.gz	HETFOHDNYKQDEW-WMZOPIPTSA-N	0	3	338.451	3.276	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)C2(CC(C)C)CCC2)C[C@H]1C(F)(F)F	ZINC001112130130	1368674425	/nfs/dbraw/zinc/67/44/25/1368674425.db2.gz	BRAMNLXLEZFDHJ-ZIAGYGMSSA-N	0	3	332.410	3.368	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cn(C)c3ccc(F)cc23)C[C@H]1C	ZINC000947399577	1333115243	/nfs/dbraw/zinc/11/52/43/1333115243.db2.gz	HGZPRVAYUGVGDA-UKRRQHHQSA-N	0	3	329.419	3.086	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccccc2-c2ccncc2)C[C@H]1C	ZINC000947442130	1333128647	/nfs/dbraw/zinc/12/86/47/1333128647.db2.gz	QDRQKDSMKWQZAD-IEBWSBKVSA-N	0	3	347.462	3.355	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2ccc(CC(C)C)cc2)C[C@@H]1C	ZINC000947520659	1333155708	/nfs/dbraw/zinc/15/57/08/1333155708.db2.gz	QPHZFPHRZYJOAN-PXNSSMCTSA-N	0	3	326.484	3.030	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(-c3ccco3)o2)C[C@H]1C	ZINC000947538146	1333163538	/nfs/dbraw/zinc/16/35/38/1333163538.db2.gz	VWLSGWQURDLJCP-HUUCEWRRSA-N	0	3	326.396	3.146	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3ccc(F)cc3)CCC2)C[C@@H]1C	ZINC000947597464	1333187986	/nfs/dbraw/zinc/18/79/86/1333187986.db2.gz	HHLKWCFIDGMMDH-LPHOPBHVSA-N	0	3	342.458	3.240	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(Cc3cccnc3C)[C@H](C)C2)cc1	ZINC000947611688	1333192171	/nfs/dbraw/zinc/19/21/71/1333192171.db2.gz	OVLVPZMBLRBQFL-IIBYNOLFSA-N	0	3	347.462	3.154	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2oc3ccccc3c2OC)C[C@H]1C	ZINC000947611831	1333192765	/nfs/dbraw/zinc/19/27/65/1333192765.db2.gz	QUPWGRXJYHLQPX-KGLIPLIRSA-N	0	3	328.412	3.210	20	30		EGEDHN
Cc1cocc1C(=O)N[C@H]1CCN(Cc2cccc(C#N)c2)[C@H](C)C1	ZINC000947623489	1333197161	/nfs/dbraw/zinc/19/71/61/1333197161.db2.gz	BMBAQXUJAZRSIW-QAPCUYQASA-N	0	3	337.423	3.243	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2c(C)[nH]c3ccccc32)C[C@H]1C	ZINC000947669986	1333216501	/nfs/dbraw/zinc/21/65/01/1333216501.db2.gz	ASUYXVKKQYEXHA-NVXWUHKLSA-N	0	3	337.467	3.011	20	30		EGEDHN
Cc1ncccc1C(=O)N[C@H]1CCN(Cc2cccc(C#N)c2)[C@@H](C)C1	ZINC000947669956	1333216819	/nfs/dbraw/zinc/21/68/19/1333216819.db2.gz	ANHGOVJAWCMIME-KXBFYZLASA-N	0	3	348.450	3.045	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C(C)C)nc2C)C[C@@H]1C	ZINC000947727547	1333242482	/nfs/dbraw/zinc/24/24/82/1333242482.db2.gz	YXCNDMMFOIZGPF-DOTOQJQBSA-N	0	3	327.472	3.119	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(Cl)c(F)c2)C[C@@H]1C	ZINC000947750085	1333250032	/nfs/dbraw/zinc/25/00/32/1333250032.db2.gz	LOGOCHHVQNOUDU-ZFWWWQNUSA-N	0	3	336.838	3.014	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C(C)(C)C)oc2C)C[C@H]1C	ZINC000947751240	1333250478	/nfs/dbraw/zinc/25/04/78/1333250478.db2.gz	WIRJWOLNLHMHDP-GDBMZVCRSA-N	0	3	330.472	3.492	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(C)oc2C(F)(F)F)C[C@H]1C	ZINC000947758288	1333253743	/nfs/dbraw/zinc/25/37/43/1333253743.db2.gz	LDQIJKUJXOMCCX-PWSUYJOCSA-N	0	3	330.350	3.376	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C(F)F)cc2F)C[C@@H]1C	ZINC000947850357	1333279507	/nfs/dbraw/zinc/27/95/07/1333279507.db2.gz	ZKLIQBMNAQUIMO-GXTWGEPZSA-N	0	3	338.373	3.369	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccc3nc(C)sc3c2)C[C@@H]1C	ZINC000947894454	1333295359	/nfs/dbraw/zinc/29/53/59/1333295359.db2.gz	AGSVTEMEDMHMQA-SWLSCSKDSA-N	0	3	329.469	3.373	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnn(C3CCCC3)c2C)C[C@H]1C	ZINC000947912608	1333304014	/nfs/dbraw/zinc/30/40/14/1333304014.db2.gz	NUEJHKXWFYNLEI-GDBMZVCRSA-N	0	3	330.476	3.075	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3ccccc3F)CCC2)C[C@@H]1C	ZINC000947917341	1333306350	/nfs/dbraw/zinc/30/63/50/1333306350.db2.gz	VYOAFPVVJGUPIC-IRXDYDNUSA-N	0	3	342.458	3.240	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C(C)(C)c2ccc(F)cc2)C[C@H]1C	ZINC000947943180	1333313798	/nfs/dbraw/zinc/31/37/98/1333313798.db2.gz	JADFFGXRJIKRHH-QAPCUYQASA-N	0	3	330.447	3.096	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)C(C)(C)C)CCN1Cc1ccc(OCC#N)cc1	ZINC000947957551	1333319943	/nfs/dbraw/zinc/31/99/43/1333319943.db2.gz	LBSGENBHHSGZKV-NVXWUHKLSA-N	0	3	343.471	3.104	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(OCC3CC3)cc2)C[C@@H]1C	ZINC000948039465	1333349852	/nfs/dbraw/zinc/34/98/52/1333349852.db2.gz	HLVONKNRSYULFO-LPHOPBHVSA-N	0	3	340.467	3.081	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)CC2C3CC4CC(C3)CC2C4)C[C@H]1C	ZINC000948056096	1333357712	/nfs/dbraw/zinc/35/77/12/1333357712.db2.gz	HBZFWIUDSAEWQG-CWQVBRBPSA-N	0	3	342.527	3.441	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(N(C)C(C)C)cc2)C[C@@H]1C	ZINC000948087369	1333371697	/nfs/dbraw/zinc/37/16/97/1333371697.db2.gz	ZQRDUOZBWYJOFC-PKOBYXMFSA-N	0	3	341.499	3.137	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(N(C)CCC)cc2)C[C@H]1C	ZINC000948095304	1333372925	/nfs/dbraw/zinc/37/29/25/1333372925.db2.gz	VCHDDGYRSUOFSO-IEBWSBKVSA-N	0	3	341.499	3.139	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(CC)c(CC)c2)C[C@H]1C	ZINC000948105303	1333375756	/nfs/dbraw/zinc/37/57/56/1333375756.db2.gz	UNUAGZRQCIZUBJ-OXQOHEQNSA-N	0	3	326.484	3.417	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2ccc(-n3cccc3)cc2)CC1	ZINC000948595455	1333589909	/nfs/dbraw/zinc/58/99/09/1333589909.db2.gz	YVNOEBDHOXXDCQ-LJQANCHMSA-N	0	3	335.451	3.037	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cc(Cl)ccc2F)CC1	ZINC000948602653	1333592353	/nfs/dbraw/zinc/59/23/53/1333592353.db2.gz	QPGPOCYEZYPHGQ-OAHLLOKOSA-N	0	3	336.838	3.429	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cnc3ccccc3c2C)CC1	ZINC000948625688	1333602099	/nfs/dbraw/zinc/60/20/99/1333602099.db2.gz	SHWZNYSLUMSETK-SFHVURJKSA-N	0	3	349.478	3.493	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)N(C)[C@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948680266	1333625423	/nfs/dbraw/zinc/62/54/23/1333625423.db2.gz	GEBRAOHBVCAPHL-AYOQOUSVSA-N	0	3	325.456	3.027	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccccc2CC)CC1	ZINC000948726310	1333648692	/nfs/dbraw/zinc/64/86/92/1333648692.db2.gz	OHJWQOYSRPLFSK-HLAWJBBLSA-N	0	3	338.495	3.299	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)Cc2cccc(Cl)c2)CC1	ZINC000948732276	1333650940	/nfs/dbraw/zinc/65/09/40/1333650940.db2.gz	ACSZAQXGWLCSCG-SFHVURJKSA-N	0	3	332.875	3.219	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)Cc2c(C)cc(C)cc2C)CC1	ZINC000948742202	1333654667	/nfs/dbraw/zinc/65/46/67/1333654667.db2.gz	IBHOSLAYRLHJRT-IBGZPJMESA-N	0	3	326.484	3.100	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2ccc(C)c(F)c2F)CC1	ZINC000948799963	1333684316	/nfs/dbraw/zinc/68/43/16/1333684316.db2.gz	BRZJVVUPUKYCHN-HNNXBMFYSA-N	0	3	334.410	3.223	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cc([C@@H](C)CC)no2)CC1	ZINC000948836260	1333703961	/nfs/dbraw/zinc/70/39/61/1333703961.db2.gz	AHZQBQTWWMIXMV-HOTGVXAUSA-N	0	3	331.460	3.138	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N(C)[C@H]1CCCN(C/C=C/Cl)CC1	ZINC000948852979	1333710224	/nfs/dbraw/zinc/71/02/24/1333710224.db2.gz	ZGDLBNYHRLPNDN-PBTNIWHWSA-N	0	3	340.895	3.033	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@@H]1CNC(=O)c1ccc(C)nc1	ZINC000948890419	1333721274	/nfs/dbraw/zinc/72/12/74/1333721274.db2.gz	QYPXNTIKNBGVJJ-FQEVSTJZSA-N	0	3	335.451	3.295	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@@H]1CNC(=O)c1ccn(C)c1C	ZINC000948958212	1333747962	/nfs/dbraw/zinc/74/79/62/1333747962.db2.gz	LSPAWNJIFWYUBX-FQEVSTJZSA-N	0	3	337.467	3.239	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@H]1CNC(=O)c1ccnc(C)c1	ZINC000948974562	1333753080	/nfs/dbraw/zinc/75/30/80/1333753080.db2.gz	ICUQFESADIKTGD-HXUWFJFHSA-N	0	3	335.451	3.295	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1[C@H]3CCCCCC[C@H]13)CCO2	ZINC000949200153	1333794154	/nfs/dbraw/zinc/79/41/54/1333794154.db2.gz	KNDQFVCKRPTGBJ-ROUUACIJSA-N	0	3	346.515	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)CC3(C)CCCC3)CC2)C1	ZINC000949358391	1333829798	/nfs/dbraw/zinc/82/97/98/1333829798.db2.gz	SDMNOBHLNYFDMF-UHFFFAOYSA-N	0	3	334.504	3.226	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@H]3C[C@@]3(C)C(C)C)CC2)C1	ZINC000949501534	1333861127	/nfs/dbraw/zinc/86/11/27/1333861127.db2.gz	WYGIKJFZZJCPJM-QUCCMNQESA-N	0	3	348.531	3.328	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2cc(C)cc(OC)c2C)C1	ZINC000967258282	1335679324	/nfs/dbraw/zinc/67/93/24/1335679324.db2.gz	OVVDQUZBSKUCSP-MAUKXSAKSA-N	0	3	330.472	3.328	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(C)c3cccnc23)C1	ZINC000967410066	1335729837	/nfs/dbraw/zinc/72/98/37/1335729837.db2.gz	YFQAJHUAPGEVBY-APWZRJJASA-N	0	3	335.451	3.007	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(C(=O)C=C3CCCCC3)C2)cc1F	ZINC000967478346	1335754027	/nfs/dbraw/zinc/75/40/27/1335754027.db2.gz	OLJSOWCDIDWEKC-GOSISDBHSA-N	0	3	341.430	3.278	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2c[nH]nc2-c2ccccc2)C1	ZINC000967553458	1335775928	/nfs/dbraw/zinc/77/59/28/1335775928.db2.gz	APXNRLQHPXLLCO-MAUKXSAKSA-N	0	3	338.455	3.093	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2cc3ccc(OC)cc3[nH]2)C1	ZINC000967655004	1335800804	/nfs/dbraw/zinc/80/08/04/1335800804.db2.gz	GYESVGQFSDXJCZ-KUHUBIRLSA-N	0	3	341.455	3.193	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2cc3ccc(OC)cc3[nH]2)C1	ZINC000967655002	1335801055	/nfs/dbraw/zinc/80/10/55/1335801055.db2.gz	GYESVGQFSDXJCZ-IFXJQAMLSA-N	0	3	341.455	3.193	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccccc2OC2CCC2)C1	ZINC000968316057	1335888288	/nfs/dbraw/zinc/88/82/88/1335888288.db2.gz	DAVICYMOOXDJCE-VQIMIIECSA-N	0	3	340.467	3.081	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CN(CC3=CCCCC3)CC[C@@H]2C)c1	ZINC000968317507	1335888724	/nfs/dbraw/zinc/88/87/24/1335888724.db2.gz	LAIYQGPZCNECQD-JXFKEZNVSA-N	0	3	337.467	3.004	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2ccc(Cl)c(OC)c2)C1	ZINC000968389894	1335916331	/nfs/dbraw/zinc/91/63/31/1335916331.db2.gz	BWRSVPYRBOYGKO-CZUORRHYSA-N	0	3	336.863	3.365	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)Cc2csc(C(C)(C)C)n2)C1	ZINC000968412804	1335924024	/nfs/dbraw/zinc/92/40/24/1335924024.db2.gz	DNQFOSMLIUUCST-HOCLYGCPSA-N	0	3	349.544	3.386	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2ccc(C(F)F)cc2F)C1	ZINC000968459081	1335931450	/nfs/dbraw/zinc/93/14/50/1335931450.db2.gz	IZALJTDSPDCDRI-BLLLJJGKSA-N	0	3	338.373	3.227	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2cccc3ccsc32)C1	ZINC000968506375	1335946258	/nfs/dbraw/zinc/94/62/58/1335946258.db2.gz	SMXOOSQARVCZDV-RHSMWYFYSA-N	0	3	326.465	3.365	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2ccccc2C(F)(F)F)C1	ZINC000968571275	1335965630	/nfs/dbraw/zinc/96/56/30/1335965630.db2.gz	XRKCJIDQYAMWLC-XJKSGUPXSA-N	0	3	338.373	3.169	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)C23CC4CC(CC(C4)C2)C3)C1	ZINC000968575382	1335968091	/nfs/dbraw/zinc/96/80/91/1335968091.db2.gz	VWRFPPRVCGVJBS-CYSNLQCGSA-N	0	3	328.500	3.053	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2cc(C)nc3ccccc32)C1	ZINC000968609442	1335982062	/nfs/dbraw/zinc/98/20/62/1335982062.db2.gz	HHTFOSPDNAMSHN-MGPUTAFESA-N	0	3	335.451	3.007	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)C2(c3ccccc3)CCCC2)C1	ZINC000968623013	1335986706	/nfs/dbraw/zinc/98/67/06/1335986706.db2.gz	DJODEDURYYYKOB-UYAOXDASSA-N	0	3	338.495	3.348	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2ccc3[nH]c(C)c(C)c3c2)C1	ZINC000968634889	1335991530	/nfs/dbraw/zinc/99/15/30/1335991530.db2.gz	BMUCZZUKFMCQRM-VBKZILBWSA-N	0	3	337.467	3.248	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)Cc2cccc(OCC)c2)C1	ZINC000968684976	1336010268	/nfs/dbraw/zinc/01/02/68/1336010268.db2.gz	LIUHRXDVARMSSL-APWZRJJASA-N	0	3	330.472	3.031	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2c(CC)oc3ccccc32)C1	ZINC000968685692	1336011017	/nfs/dbraw/zinc/01/10/17/1336011017.db2.gz	XQSLOGPPOFYKFQ-DOTOQJQBSA-N	0	3	338.451	3.459	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)Cc2cc3ccccc3n2C)C1	ZINC000968685240	1336011186	/nfs/dbraw/zinc/01/11/86/1336011186.db2.gz	PGNJNEPADXOCHE-APWZRJJASA-N	0	3	339.483	3.124	20	30		EGEDHN
CC(C)(C)C[C@@H]1C[C@H]1C(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C1	ZINC000968732021	1336029377	/nfs/dbraw/zinc/02/93/77/1336029377.db2.gz	AMJQMLIYEBGMEF-JJRVBVJISA-N	0	3	345.512	3.383	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC000968795449	1336054327	/nfs/dbraw/zinc/05/43/27/1336054327.db2.gz	NLRXRMJEKRAWKF-OAHLLOKOSA-N	0	3	349.837	3.167	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cnn(CC(C)C)c1CC	ZINC000968856847	1336070224	/nfs/dbraw/zinc/07/02/24/1336070224.db2.gz	PLRWGPXHFDNTAK-QGZVFWFLSA-N	0	3	346.519	3.262	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)[C@@H]1CCN(c2ccccc2)C1	ZINC000968914635	1336087374	/nfs/dbraw/zinc/08/73/74/1336087374.db2.gz	YDEBHBQFRJFHMN-UYAOXDASSA-N	0	3	341.499	3.060	20	30		EGEDHN
C#CCN1CCCCC[C@@H]1CNC(=O)c1cccc2c(C)c(C)[nH]c21	ZINC000968916597	1336087542	/nfs/dbraw/zinc/08/75/42/1336087542.db2.gz	DTZZURVIICQUSE-QGZVFWFLSA-N	0	3	337.467	3.392	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1ccncc1OC(C)C	ZINC000968965839	1336104292	/nfs/dbraw/zinc/10/42/92/1336104292.db2.gz	ZRTBKQGUXSSMFS-QGZVFWFLSA-N	0	3	345.487	3.419	20	30		EGEDHN
N#Cc1cc(CN[C@@H]2CCN(C(=O)C[C@@H]3C=CCCC3)C2)ccc1F	ZINC000969063673	1336135524	/nfs/dbraw/zinc/13/55/24/1336135524.db2.gz	UXMSAIBGYXXEQH-CRAIPNDOSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)[C@@H]1CCOc2ccccc21	ZINC000969072243	1336137517	/nfs/dbraw/zinc/13/75/17/1336137517.db2.gz	CGKNMBRVAXTBAB-FUHWJXTLSA-N	0	3	328.456	3.100	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)[C@@H]1Cc2ccc(Cl)cc21	ZINC000969136471	1336157035	/nfs/dbraw/zinc/15/70/35/1336157035.db2.gz	NBCDTOCUAYLRNZ-PKOBYXMFSA-N	0	3	344.886	3.364	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)[C@@H]1Cc2cc(C)c(C)cc2O1	ZINC000969153145	1336164720	/nfs/dbraw/zinc/16/47/20/1336164720.db2.gz	AZVOZUPXRWGNTO-ICSRJNTNSA-N	0	3	342.483	3.154	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1cc(C)n(C(C)C)n1	ZINC000969165382	1336169628	/nfs/dbraw/zinc/16/96/28/1336169628.db2.gz	WIDSWSHPYCFXGA-KRWDZBQOSA-N	0	3	332.492	3.323	20	30		EGEDHN
Cc1cccc([C@@H](C)N2CC([C@@H](C)NC(=O)c3cc(C#N)c[nH]3)C2)c1	ZINC000969465772	1336214864	/nfs/dbraw/zinc/21/48/64/1336214864.db2.gz	GYOPQSNHHXGIHC-HUUCEWRRSA-N	0	3	336.439	3.006	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(C(=O)C[C@@H]3CC=CCC3)C2)s1	ZINC000969598984	1336227084	/nfs/dbraw/zinc/22/70/84/1336227084.db2.gz	ZFJVTWHLYOTVKD-HUUCEWRRSA-N	0	3	329.469	3.057	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)c2cc(C3CC3)[nH]c2C2CC2)C1	ZINC000969958631	1336266338	/nfs/dbraw/zinc/26/63/38/1336266338.db2.gz	MCMGTHUZIUUMGU-ZDUSSCGKSA-N	0	3	327.472	3.396	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N[C@H](C)C1CN(CC[C@H](C)F)C1	ZINC000969990783	1336269844	/nfs/dbraw/zinc/26/98/44/1336269844.db2.gz	ULXMVVUZCCUGIZ-LSDHHAIUSA-N	0	3	334.435	3.050	20	30		EGEDHN
CN(C(=O)[C@H]1CC[C@@H](F)C1)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001005893328	1336417558	/nfs/dbraw/zinc/41/75/58/1336417558.db2.gz	WBXCWXWSPSSBOB-ZWKOTPCHSA-N	0	3	343.446	3.119	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cn(C)nc2C2CCCC2)CC1	ZINC001005975373	1336432732	/nfs/dbraw/zinc/43/27/32/1336432732.db2.gz	PIQZGRYCKHYBFK-UHFFFAOYSA-N	0	3	344.503	3.190	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2ccc(C(C)C)nc2CC)CC1	ZINC001006004817	1336436027	/nfs/dbraw/zinc/43/60/27/1336436027.db2.gz	QFAYGEHIIYDKNQ-UHFFFAOYSA-N	0	3	329.488	3.490	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cnc(-c3ccoc3)s2)CC1	ZINC001006102803	1336452415	/nfs/dbraw/zinc/45/24/15/1336452415.db2.gz	KMBNWSKSNWADAX-UHFFFAOYSA-N	0	3	331.441	3.126	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2occc2Br)CC1	ZINC001006148507	1336460040	/nfs/dbraw/zinc/46/00/40/1336460040.db2.gz	XAHOAMNQECEVPH-UHFFFAOYSA-N	0	3	341.249	3.155	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cccc(N3CCCC3)c2)CC1	ZINC001006185440	1336463962	/nfs/dbraw/zinc/46/39/62/1336463962.db2.gz	WSKNWSGGHLJXHU-UHFFFAOYSA-N	0	3	327.472	3.009	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cc(-c3ccccc3)ccn2)CC1	ZINC001006189751	1336464495	/nfs/dbraw/zinc/46/44/95/1336464495.db2.gz	UZZAQVKFFKUWSC-UHFFFAOYSA-N	0	3	335.451	3.471	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2csc(CC(C)C)n2)CC1	ZINC001006471236	1336513491	/nfs/dbraw/zinc/51/34/91/1336513491.db2.gz	OLBKIIHFVVJTRH-UHFFFAOYSA-N	0	3	335.517	3.454	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H](NC(=O)c2ncsc2C(F)(F)F)C1	ZINC001007924220	1336734068	/nfs/dbraw/zinc/73/40/68/1336734068.db2.gz	HLWWGJGWZDBETL-LLVKDONJSA-N	0	3	347.406	3.322	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2sc(CC3CC3)nc2C)C1	ZINC001008995645	1336954769	/nfs/dbraw/zinc/95/47/69/1336954769.db2.gz	ROSNAAAENZNYLL-HNNXBMFYSA-N	0	3	333.501	3.174	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCN([C@H](C)c3ccccc3)C2)nc1	ZINC001009270125	1336994040	/nfs/dbraw/zinc/99/40/40/1336994040.db2.gz	QYAGEDAWQDDKNZ-APWZRJJASA-N	0	3	333.435	3.018	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](NC(=O)c2cc(-c3ccccc3)no2)C1	ZINC001015075923	1338009632	/nfs/dbraw/zinc/00/96/32/1338009632.db2.gz	CGVVVAPPRMAZDH-MRXNPFEDSA-N	0	3	325.412	3.112	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3c(C)cccc3C)C2)cc1	ZINC001015481814	1338155300	/nfs/dbraw/zinc/15/53/00/1338155300.db2.gz	IQKBPRRUSDHUCO-FQEVSTJZSA-N	0	3	332.447	3.289	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3cccc4cccnc43)C2)C1	ZINC001015673978	1338250713	/nfs/dbraw/zinc/25/07/13/1338250713.db2.gz	SHMHNUQKJYZLPF-SFHVURJKSA-N	0	3	335.451	3.282	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN([C@H](C)c3cc(C)ccc3C)C2)nc1	ZINC001016026359	1338413661	/nfs/dbraw/zinc/41/36/61/1338413661.db2.gz	FXZFTYYJRKVPHE-IEBWSBKVSA-N	0	3	347.462	3.245	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)Cc2cc3ccccc3s2)CC1	ZINC001016724700	1338702887	/nfs/dbraw/zinc/70/28/87/1338702887.db2.gz	WBEQMXJFDQTSCD-SFHVURJKSA-N	0	3	338.476	3.048	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)Cc2cccc3sccc32)CC1	ZINC001016855862	1338748203	/nfs/dbraw/zinc/74/82/03/1338748203.db2.gz	NCZSQLLUOWSXCD-GOSISDBHSA-N	0	3	338.476	3.048	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)C(C)(C)c2ccccc2F)CC1	ZINC001016876546	1338755873	/nfs/dbraw/zinc/75/58/73/1338755873.db2.gz	HGTIPJDDHKHLSW-SFHVURJKSA-N	0	3	342.458	3.097	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2csc3c2CC[C@H](C)C3)CC1	ZINC001016957030	1338783743	/nfs/dbraw/zinc/78/37/43/1338783743.db2.gz	WCDQCOSADYRLAL-KBXCAEBGSA-N	0	3	342.508	3.090	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cc3cc(C)ccc3o2)CC1	ZINC001016983106	1338791649	/nfs/dbraw/zinc/79/16/49/1338791649.db2.gz	ORGZWWZMVSNDTD-LJQANCHMSA-N	0	3	336.435	3.349	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccc(C(C)C)s2)CC1	ZINC001016991123	1338795934	/nfs/dbraw/zinc/79/59/34/1338795934.db2.gz	YAXZPUUHAUDBFU-QGZVFWFLSA-N	0	3	330.497	3.479	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2ccc(C(C)(F)F)cc2)CC1	ZINC001017001977	1338800391	/nfs/dbraw/zinc/80/03/91/1338800391.db2.gz	JLUXWQNKYKMGAB-MRXNPFEDSA-N	0	3	332.394	3.016	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](CN(C)Cc2ccc(F)cn2)C1	ZINC001017179118	1338922420	/nfs/dbraw/zinc/92/24/20/1338922420.db2.gz	DKQLOXBRRXPLCA-OAHLLOKOSA-N	0	3	333.451	3.103	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCCN(C(=O)[C@@H]2CC23CC3)C1	ZINC001017217354	1338959336	/nfs/dbraw/zinc/95/93/36/1338959336.db2.gz	HXKZJUOGJOJSHN-PBHICJAKSA-N	0	3	343.496	3.090	20	30		EGEDHN
C[C@@H]1CCC[C@H](CCN2C[C@H]3CC[C@@H](C2)N3C(=O)C#CC2CC2)C1	ZINC001017536598	1339363795	/nfs/dbraw/zinc/36/37/95/1339363795.db2.gz	WJMSLQGEXRRKID-AFYVEPGGSA-N	0	3	328.500	3.291	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1F	ZINC001017759180	1339412948	/nfs/dbraw/zinc/41/29/48/1339412948.db2.gz	MSUSNQAISBHLHY-CIRFHOKZSA-N	0	3	346.421	3.320	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cccc2ncccc21	ZINC001017781696	1339419497	/nfs/dbraw/zinc/41/94/97/1339419497.db2.gz	ISVHWEFRXRZAQW-CALCHBBNSA-N	0	3	335.451	3.490	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](c1ccncc1)C(C)C	ZINC001017851926	1339430705	/nfs/dbraw/zinc/43/07/05/1339430705.db2.gz	UVJJYBPFNJHVBW-OTWHNJEPSA-N	0	3	327.472	3.073	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](CC)c1c(C)noc1C	ZINC001018065973	1339493839	/nfs/dbraw/zinc/49/38/39/1339493839.db2.gz	ZSBDZRDRQPIBQH-KSZLIROESA-N	0	3	345.487	3.426	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CCOc2ccccc21	ZINC001018065680	1339493932	/nfs/dbraw/zinc/49/39/32/1339493932.db2.gz	WDZQZKUVNBFNBF-ZIFCJYIRSA-N	0	3	340.467	3.194	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CCO[C@H](CCC)C1	ZINC001018106539	1339502518	/nfs/dbraw/zinc/50/25/18/1339502518.db2.gz	CFHSBMOPGFVZNE-AKHDSKFASA-N	0	3	334.504	3.223	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](CC)c1ccc(OC)cc1	ZINC001018295103	1339566537	/nfs/dbraw/zinc/56/65/37/1339566537.db2.gz	LAHLGSIQMNXWPK-NSHGMRRFSA-N	0	3	342.483	3.440	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)C=C3CCCCC3)C2)s1	ZINC001018590701	1339674648	/nfs/dbraw/zinc/67/46/48/1339674648.db2.gz	GNMSIOQSJUDSHP-HNNXBMFYSA-N	0	3	329.469	3.201	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1ccnc(O[C@H](C)CC)c1	ZINC001028250056	1340509984	/nfs/dbraw/zinc/50/99/84/1340509984.db2.gz	PKKGBROHEYCHJW-NVXWUHKLSA-N	0	3	331.460	3.029	20	30		EGEDHN
Cc1ccsc1C(=O)NC[C@@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC001028369668	1340598030	/nfs/dbraw/zinc/59/80/30/1340598030.db2.gz	QSYMIWJIIHTAGS-KRWDZBQOSA-N	0	3	339.464	3.180	20	30		EGEDHN
CC1(C)C(C(=O)NC[C@H]2CCN(Cc3ccc(C#N)cc3)C2)C1(C)C	ZINC001028468483	1340656596	/nfs/dbraw/zinc/65/65/96/1340656596.db2.gz	WVMDKUVRNPMDSZ-QGZVFWFLSA-N	0	3	339.483	3.179	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@H]1CCN(Cc2ccc(F)cc2)C1	ZINC001028593610	1340718053	/nfs/dbraw/zinc/71/80/53/1340718053.db2.gz	PFDLSDFWRURNKU-QGZVFWFLSA-N	0	3	341.430	3.065	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CCN(Cc3cccnc3C)C2)CC1	ZINC001028780498	1340811993	/nfs/dbraw/zinc/81/19/93/1340811993.db2.gz	JWAKOQVREUVGDY-QGZVFWFLSA-N	0	3	327.472	3.075	20	30		EGEDHN
Cc1ccc(C)c(C(=O)NC[C@@H]2CCN(Cc3cccc(C#N)c3)C2)c1	ZINC001028952443	1340893008	/nfs/dbraw/zinc/89/30/08/1340893008.db2.gz	REBVWCVPSRLOEM-FQEVSTJZSA-N	0	3	347.462	3.427	20	30		EGEDHN
CC(C)=CC(=O)N1CCC([C@H](C)NCc2cc(F)ccc2C#N)CC1	ZINC001029039251	1340914593	/nfs/dbraw/zinc/91/45/93/1340914593.db2.gz	QVCIVIPWXOPVKM-HNNXBMFYSA-N	0	3	343.446	3.380	20	30		EGEDHN
CC(C)CC(=O)N1CCC([C@@H](C)NCc2ccccc2C#N)CC1	ZINC001029041670	1340915703	/nfs/dbraw/zinc/91/57/03/1340915703.db2.gz	SAZXYPDGWNICHM-MRXNPFEDSA-N	0	3	327.472	3.321	20	30		EGEDHN
C[C@@H](NCc1cc(F)ccc1C#N)C1CCN(C(=O)C2(C)CC2)CC1	ZINC001029104596	1340930888	/nfs/dbraw/zinc/93/08/88/1340930888.db2.gz	VJNIVLQYRZGYNG-CQSZACIVSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC([C@@H](C)NCc2nc(C)cs2)CC1	ZINC001029126858	1340936316	/nfs/dbraw/zinc/93/63/16/1340936316.db2.gz	ZFIUXNKPVHTHDY-CQSZACIVSA-N	0	3	335.517	3.380	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1C[C@H]2CC[C@@H](C1)N2[C@H]1CCc2c1cccc2Cl	ZINC001029244621	1340960557	/nfs/dbraw/zinc/96/05/57/1340960557.db2.gz	JVBVTBQYXLKORY-FLTUCWPJSA-N	0	3	343.858	3.162	20	30		EGEDHN
Cc1cccc(Cl)c1CN(C)C[C@@H]1CCN(C(=O)[C@@H](C)C#N)C1	ZINC001029676486	1341040495	/nfs/dbraw/zinc/04/04/95/1341040495.db2.gz	BXANQOIQKZLMID-GJZGRUSLSA-N	0	3	333.863	3.088	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCN(C(=O)[C@]23C[C@H]2CCC3)C1	ZINC001029789234	1341073452	/nfs/dbraw/zinc/07/34/52/1341073452.db2.gz	NTCKUMUOHSFFQM-SPYBWZPUSA-N	0	3	343.496	3.090	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@H](CN(C)Cc2c(C)noc2CC)C1	ZINC001029828628	1341088653	/nfs/dbraw/zinc/08/86/53/1341088653.db2.gz	GXWOOGJIMAPESZ-JXFKEZNVSA-N	0	3	347.503	3.428	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](CN(C)Cc3ccnc(Cl)c3)C2)C1	ZINC001029837179	1341092583	/nfs/dbraw/zinc/09/25/83/1341092583.db2.gz	YRXVJEXGSBAJLD-INIZCTEOSA-N	0	3	347.890	3.372	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC(CN(C)[C@@H](C)c2cc(F)ccc2F)CC1	ZINC001029945454	1341130530	/nfs/dbraw/zinc/13/05/30/1341130530.db2.gz	ISMFVRQZZPFQKF-KBPBESRZSA-N	0	3	349.425	3.356	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC(CN(C)Cc2nccnc2C)CC1	ZINC001029982851	1341143746	/nfs/dbraw/zinc/14/37/46/1341143746.db2.gz	MIBVEWWPKTVOAC-UHFFFAOYSA-N	0	3	344.503	3.058	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC(CN(C)Cc3cnc(C)o3)CC2)CC1	ZINC001029990069	1341147706	/nfs/dbraw/zinc/14/77/06/1341147706.db2.gz	GUMOLVJWXGVBOV-UHFFFAOYSA-N	0	3	345.487	3.400	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC(CN(C)Cc2cnc(C)nc2)CC1	ZINC001029990385	1341148372	/nfs/dbraw/zinc/14/83/72/1341148372.db2.gz	KXWUTTNXBBXJRP-HXUWFJFHSA-N	0	3	344.503	3.058	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC(CN(C)Cc3cnc(C)o3)CC2)C1	ZINC001029994147	1341150457	/nfs/dbraw/zinc/15/04/57/1341150457.db2.gz	XMBPXSRHGSJZLL-UHFFFAOYSA-N	0	3	331.460	3.010	20	30		EGEDHN
C=CCn1cccc1C(=O)NCC1CN(Cc2ccc(C)cc2C)C1	ZINC001031734023	1341395001	/nfs/dbraw/zinc/39/50/01/1341395001.db2.gz	XVLVSSWKZHKYSX-UHFFFAOYSA-N	0	3	337.467	3.153	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cccc([C@H]2CCOC2)c1	ZINC001032485180	1341521319	/nfs/dbraw/zinc/52/13/19/1341521319.db2.gz	DFVXUSQWBZUDAO-UFYCRDLUSA-N	0	3	340.467	3.055	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H]2C[C@H]1CN2CCCC1CCOCC1	ZINC001032606641	1341556550	/nfs/dbraw/zinc/55/65/50/1341556550.db2.gz	YGWLAJCPDJWDMZ-CMKODMSKSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cc(F)c2ncccc2c1	ZINC001032685866	1341581624	/nfs/dbraw/zinc/58/16/24/1341581624.db2.gz	BNWQGQKFOJAFKT-IRXDYDNUSA-N	0	3	339.414	3.239	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)CCc1cccc(OCC)c1	ZINC001032810922	1341623335	/nfs/dbraw/zinc/62/33/35/1341623335.db2.gz	MITHUKDQFAIPCI-OALUTQOASA-N	0	3	342.483	3.269	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@H]2CCN(Cc3ccccc3C)C2)cc1	ZINC001033319204	1341779721	/nfs/dbraw/zinc/77/97/21/1341779721.db2.gz	RGBXJBFWUSXQDZ-NRFANRHFSA-N	0	3	332.447	3.323	20	30		EGEDHN
C=CCCN1CC[C@H](N(C)C(=O)c2cc3cccc(OC)c3o2)C1	ZINC001033383890	1341805037	/nfs/dbraw/zinc/80/50/37/1341805037.db2.gz	MNGRVUAAJWRKDK-HNNXBMFYSA-N	0	3	328.412	3.164	20	30		EGEDHN
C=C1CCC(C(=O)N(C)[C@@H]2CCN(CCc3scnc3C)C2)CC1	ZINC001033388894	1341808119	/nfs/dbraw/zinc/80/81/19/1341808119.db2.gz	GJLKBWLCQDZUMH-QGZVFWFLSA-N	0	3	347.528	3.273	20	30		EGEDHN
C#CCCN1CC[C@@H](N(C)C(=O)c2ccc(Cl)c3occc32)C1	ZINC001033575094	1341880754	/nfs/dbraw/zinc/88/07/54/1341880754.db2.gz	GUQLBTUAVDOOOL-CYBMUJFWSA-N	0	3	330.815	3.256	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2cc3c(o2)c(F)ccc3C)C1	ZINC001033905141	1342077465	/nfs/dbraw/zinc/07/74/65/1342077465.db2.gz	FFDNVUYFCYKNDB-HNNXBMFYSA-N	0	3	342.414	3.440	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccc(C(F)(F)F)cn2)C1	ZINC001033917192	1342085474	/nfs/dbraw/zinc/08/54/74/1342085474.db2.gz	WXIZKPWIFQADJE-AWEZNQCLSA-N	0	3	341.377	3.213	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2cc3cccc(OC)c3o2)C1	ZINC001033942959	1342104600	/nfs/dbraw/zinc/10/46/00/1342104600.db2.gz	NVNXXXYWCRMUQX-MRXNPFEDSA-N	0	3	340.423	3.001	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccc(-c3c[nH]cn3)cc2)C1	ZINC001034009159	1342146362	/nfs/dbraw/zinc/14/63/62/1342146362.db2.gz	HDTXRCBMOMJCHJ-GOSISDBHSA-N	0	3	338.455	3.189	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2cc(C)n(CC3CC3)c2C)C1	ZINC001034012767	1342149529	/nfs/dbraw/zinc/14/95/29/1342149529.db2.gz	JJBSRZRPGMMZBT-LJQANCHMSA-N	0	3	341.499	3.075	20	30		EGEDHN
C=CCCN1CC[C@@H](N(CC)C(=O)c2cc3nc(C)ccc3o2)C1	ZINC001034024369	1342161897	/nfs/dbraw/zinc/16/18/97/1342161897.db2.gz	ABUGMDBXKAJDMD-OAHLLOKOSA-N	0	3	327.428	3.249	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2cc3ccccc3nc2C)C1	ZINC001034228110	1342331720	/nfs/dbraw/zinc/33/17/20/1342331720.db2.gz	AGWSOBLMFJWHAY-SFHVURJKSA-N	0	3	335.451	3.151	20	30		EGEDHN
C=CCCN1CCCC[C@H](NC(=O)c2sc(Cl)nc2C)C1	ZINC001034228800	1342333119	/nfs/dbraw/zinc/33/31/19/1342333119.db2.gz	BCCQEDAOISAMFC-LBPRGKRZSA-N	0	3	327.881	3.265	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@H]2CCc3ccc(OC)cc32)C1	ZINC001034244439	1342344236	/nfs/dbraw/zinc/34/42/36/1342344236.db2.gz	BDZBXGYCYWMWAE-HKUYNNGSSA-N	0	3	342.483	3.272	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc3oc(C)nc3c2)C1	ZINC001034268134	1342358982	/nfs/dbraw/zinc/35/89/82/1342358982.db2.gz	FXCOBAFXWXXJLH-MRXNPFEDSA-N	0	3	327.428	3.297	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2coc3ccc(OC)cc32)C1	ZINC001034304110	1342386393	/nfs/dbraw/zinc/38/63/93/1342386393.db2.gz	OUBBPXPVZAUJGH-HNNXBMFYSA-N	0	3	340.423	3.049	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCCN(Cc3ccccc3)C2)cc1	ZINC001034341776	1342414572	/nfs/dbraw/zinc/41/45/72/1342414572.db2.gz	ZCEZPGDFAWQTQY-OAQYLSRUSA-N	0	3	332.447	3.452	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2c(F)cc(F)cc2F)C1	ZINC001034374435	1342443452	/nfs/dbraw/zinc/44/34/52/1342443452.db2.gz	BQQRLVJYSISNFU-CYBMUJFWSA-N	0	3	326.362	3.264	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@H]2CCc3ccccc3C2)C1	ZINC001034413789	1342474314	/nfs/dbraw/zinc/47/43/14/1342474314.db2.gz	QCNFVTILUPAYGH-PMACEKPBSA-N	0	3	326.484	3.338	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc(-n3cccc3)nc2)C1	ZINC001034443813	1342504375	/nfs/dbraw/zinc/50/43/75/1342504375.db2.gz	JUEZTHGCLILYIO-GOSISDBHSA-N	0	3	338.455	3.033	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2csc3c2CC[C@H](C)C3)C1	ZINC001034513182	1342572309	/nfs/dbraw/zinc/57/23/09/1342572309.db2.gz	VFZBFKZAUULENH-JKSUJKDBSA-N	0	3	344.524	3.481	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)c2ccc(OCC3CC3)cc2)C1	ZINC001034539823	1342598481	/nfs/dbraw/zinc/59/84/81/1342598481.db2.gz	ZGTYCVIWYONRJT-GOSISDBHSA-N	0	3	328.456	3.246	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)[C@]2(C)CCc3ccccc3C2)C1	ZINC001034556824	1342618345	/nfs/dbraw/zinc/61/83/45/1342618345.db2.gz	IREYSGOHGOEMAF-TZIWHRDSSA-N	0	3	326.484	3.338	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cccnc2OC(C)C)C1	ZINC001034561240	1342618805	/nfs/dbraw/zinc/61/88/05/1342618805.db2.gz	BPPGVJDUJXPMBK-INIZCTEOSA-N	0	3	331.460	3.029	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1CC[C@H](NC(=O)[C@@H]2CC=CCC2)CC1	ZINC001034591877	1342636594	/nfs/dbraw/zinc/63/65/94/1342636594.db2.gz	IWFLGTDCQBZAKZ-NSISKUIASA-N	0	3	337.467	3.432	20	30		EGEDHN
C[C@@H]1C[C@@H]1CC(=O)N[C@H]1CC[C@H](NCc2ccccc2C#N)CC1	ZINC001034724858	1342718756	/nfs/dbraw/zinc/71/87/56/1342718756.db2.gz	VTJAVVRAOXJIPX-UTRMSSBJSA-N	0	3	325.456	3.121	20	30		EGEDHN
C[C@H]1C[C@H]1C(=O)NCc1ccc(CNCc2cccc(C#N)c2)cc1	ZINC001034806432	1342771971	/nfs/dbraw/zinc/77/19/71/1342771971.db2.gz	GFGAHORSIYLNSQ-MGPUTAFESA-N	0	3	333.435	3.120	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@@H]2CNCc2scnc2C)CC1	ZINC001035035363	1342889021	/nfs/dbraw/zinc/88/90/21/1342889021.db2.gz	LFKMUBJFMRJIJE-MRXNPFEDSA-N	0	3	333.501	3.279	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C1(c3ccc(F)cc3)CC1)CC2	ZINC001035719285	1343151398	/nfs/dbraw/zinc/15/13/98/1343151398.db2.gz	QWHIHPWLROLIIA-UHFFFAOYSA-N	0	3	342.458	3.358	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1c(F)ccc(C)c1F)CC2	ZINC001035782214	1343192809	/nfs/dbraw/zinc/19/28/09/1343192809.db2.gz	JRENPQCBODAESY-UHFFFAOYSA-N	0	3	334.410	3.387	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccc(Cl)cc1C)CC2	ZINC001035785782	1343196484	/nfs/dbraw/zinc/19/64/84/1343196484.db2.gz	MPQILOLDUNTAQT-UHFFFAOYSA-N	0	3	330.859	3.210	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC3(CN(C[C@H]4CC[C@H](C)O4)C3)CC2)CC1	ZINC001035787285	1343199835	/nfs/dbraw/zinc/19/98/35/1343199835.db2.gz	OFLQCQASCYIGPK-PKOBYXMFSA-N	0	3	346.515	3.225	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)C13CC4CC(CC(C4)C1)C3)CC2	ZINC001035842613	1343224848	/nfs/dbraw/zinc/22/48/48/1343224848.db2.gz	LTOJEMNWRSLKIE-UHFFFAOYSA-N	0	3	340.511	3.151	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H](C)n1c(C)ccc1C)CC2	ZINC001035856108	1343232708	/nfs/dbraw/zinc/23/27/08/1343232708.db2.gz	INRZUCKPRCLCMV-GOSISDBHSA-N	0	3	329.488	3.166	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CCCCC2)CC[C@@H]1NCc1ccccc1C#N	ZINC001035887180	1343249479	/nfs/dbraw/zinc/24/94/79/1343249479.db2.gz	JYGIEQRUNIZPNH-UZLBHIALSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@H]1CN(C(=O)CCC2CC2)CC[C@@H]1NCc1ccccc1C#N	ZINC001035966343	1343292258	/nfs/dbraw/zinc/29/22/58/1343292258.db2.gz	JHXMBRYFOMSWPD-KXBFYZLASA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@H]1CN(C(=O)CCC2CCC2)CC[C@@H]1NCc1ccccc1C#N	ZINC001035975151	1343295582	/nfs/dbraw/zinc/29/55/82/1343295582.db2.gz	TZXLUHAFHCVNHA-JXFKEZNVSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@H](NCc2cc(F)ccc2C#N)[C@H](C)C1	ZINC001035990054	1343303711	/nfs/dbraw/zinc/30/37/11/1343303711.db2.gz	FAPJIUODXKHMOV-DYVFJYSZSA-N	0	3	347.409	3.287	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](NCc2ccn(C(C)C)n2)[C@H](C)C1	ZINC001036140664	1343325071	/nfs/dbraw/zinc/32/50/71/1343325071.db2.gz	CZSLVSLZCBRSMV-WBVHZDCISA-N	0	3	332.492	3.003	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](NCc2nc3ccccc3o2)[C@@H](C)C1	ZINC001036145254	1343327480	/nfs/dbraw/zinc/32/74/80/1343327480.db2.gz	XZOPMAHJBNICQV-GJZGRUSLSA-N	0	3	341.455	3.367	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3cscn3)[C@H](C)C2)CC1	ZINC001036163557	1343338779	/nfs/dbraw/zinc/33/87/79/1343338779.db2.gz	LMCXORQTBDKWQC-RHSMWYFYSA-N	0	3	333.501	3.216	20	30		EGEDHN
C[C@@H]1CN(C(=O)C(C)(C)C(F)F)CC[C@@H]1NCc1ccccc1C#N	ZINC001036167685	1343340783	/nfs/dbraw/zinc/34/07/83/1343340783.db2.gz	BQTUJUCDDCZBTC-CJNGLKHVSA-N	0	3	349.425	3.176	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](NCc3ncc(C)s3)[C@@H](C)C2)C1	ZINC001036168661	1343341824	/nfs/dbraw/zinc/34/18/24/1343341824.db2.gz	JJZTUDFSJLCMKN-DZGCQCFKSA-N	0	3	333.501	3.134	20	30		EGEDHN
C[C@@H]1CN(C(=O)C(C)(C)C)CC[C@H]1NCc1cc(F)ccc1C#N	ZINC001036274379	1343391154	/nfs/dbraw/zinc/39/11/54/1343391154.db2.gz	WOTMFQHQHUOOFQ-CXAGYDPISA-N	0	3	331.435	3.070	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCCN(C(=O)C2=CCCC2)C1	ZINC001036389131	1343459440	/nfs/dbraw/zinc/45/94/40/1343459440.db2.gz	QVPQCULSLXNPKL-UZLBHIALSA-N	0	3	337.467	3.385	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCCN(C(=O)CC2CCC2)C1	ZINC001036389395	1343459549	/nfs/dbraw/zinc/45/95/49/1343459549.db2.gz	RCLLYPPNWZUZDD-OXQOHEQNSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]([C@H](C)NCc2csc(C)n2)C1	ZINC001036429953	1343482184	/nfs/dbraw/zinc/48/21/84/1343482184.db2.gz	XSZLHCXLOYZKFH-DZGCQCFKSA-N	0	3	335.517	3.380	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@H]([C@H](C)NCc3cnc(C)o3)C2)CC1	ZINC001036431739	1343483719	/nfs/dbraw/zinc/48/37/19/1343483719.db2.gz	VLFTWMRUNGFQOX-YJBOKZPZSA-N	0	3	345.487	3.446	20	30		EGEDHN
CCCC(=O)N1CCC[C@@H](C)[C@H]1CNCc1cc(C#N)ccc1OC	ZINC001036483047	1343508591	/nfs/dbraw/zinc/50/85/91/1343508591.db2.gz	AZDZZHIRTRVHBE-CRAIPNDOSA-N	0	3	343.471	3.084	20	30		EGEDHN
O=C(C1CC1)N1CC[C@H]2[C@H](CCN2CC#Cc2cccc(Cl)c2)C1	ZINC001036613869	1343574527	/nfs/dbraw/zinc/57/45/27/1343574527.db2.gz	NJVRULIZPVYHBD-MJGOQNOKSA-N	0	3	342.870	3.024	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@H]2[C@@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001036628490	1343585776	/nfs/dbraw/zinc/58/57/76/1343585776.db2.gz	BUNZQESUCVGGCT-YOEHRIQHSA-N	0	3	331.485	3.089	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@H]2[C@H](CCN2Cc2ccccc2C#N)C1	ZINC001036629971	1343587778	/nfs/dbraw/zinc/58/77/78/1343587778.db2.gz	ZCSLATPCXJDSJK-MOPGFXCFSA-N	0	3	325.456	3.027	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@@H]3[C@H](CCN3CC#Cc3ccccc3)C2)o1	ZINC001036637538	1343592995	/nfs/dbraw/zinc/59/29/95/1343592995.db2.gz	PFRUXRUDQGGYOB-WOJBJXKFSA-N	0	3	348.446	3.176	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3CN(C(=O)C4=CCCC4)CC[C@@H]32)s1	ZINC001036686170	1343628650	/nfs/dbraw/zinc/62/86/50/1343628650.db2.gz	JWXTUVNEZLWIAR-YJBOKZPZSA-N	0	3	341.480	3.153	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3CN(C(=O)C=C4CCC4)CC[C@@H]32)s1	ZINC001036689138	1343632212	/nfs/dbraw/zinc/63/22/12/1343632212.db2.gz	CZDVHTLXZDHBOH-YJBOKZPZSA-N	0	3	341.480	3.153	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H]3[C@H](CCN3Cc3ocnc3C)C2)CC1	ZINC001036811580	1343747094	/nfs/dbraw/zinc/74/70/94/1343747094.db2.gz	SPXYSWDHDVPOFK-QZTJIDSGSA-N	0	3	343.471	3.152	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCC[C@H]2CNCc2cc(C3CC3)no2)C1	ZINC001037075555	1343968512	/nfs/dbraw/zinc/96/85/12/1343968512.db2.gz	RGOMJSHIKRTTCL-DOTOQJQBSA-N	0	3	343.471	3.283	20	30		EGEDHN
CC(C)(F)C(=O)N[C@H]1CCCC[C@@H]1CNCc1cc(F)ccc1C#N	ZINC001037155424	1344006949	/nfs/dbraw/zinc/00/69/49/1344006949.db2.gz	IQTFSEQKPIXJHZ-PBHICJAKSA-N	0	3	349.425	3.210	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](NCc2csc(C)n2)[C@H](CC)C1	ZINC001037895329	1344167016	/nfs/dbraw/zinc/16/70/16/1344167016.db2.gz	FNOGRWNXOXYSKY-GDBMZVCRSA-N	0	3	335.517	3.380	20	30		EGEDHN
N#Cc1ccc(C(=O)NC[C@H]2CCN2CCC2CCCCCC2)[nH]1	ZINC001038173702	1344311405	/nfs/dbraw/zinc/31/14/05/1344311405.db2.gz	PVMKDBJQURDKGP-QGZVFWFLSA-N	0	3	328.460	3.051	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1ocnc1-c1ccccc1	ZINC001038334285	1344384539	/nfs/dbraw/zinc/38/45/39/1344384539.db2.gz	YGNCPOGIDOBUFE-MRXNPFEDSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1cn(C)c2ccc(F)cc12	ZINC001038353936	1344394362	/nfs/dbraw/zinc/39/43/62/1344394362.db2.gz	XLYAPPYZLVYBAH-OAHLLOKOSA-N	0	3	329.419	3.088	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1ccc(OC)c(C2CC2)c1	ZINC001038858491	1344613919	/nfs/dbraw/zinc/61/39/19/1344613919.db2.gz	LBNBVXKVVRIUCJ-KRWDZBQOSA-N	0	3	328.456	3.343	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1ccc(OC)c(C2CC2)c1	ZINC001038858492	1344614471	/nfs/dbraw/zinc/61/44/71/1344614471.db2.gz	LBNBVXKVVRIUCJ-QGZVFWFLSA-N	0	3	328.456	3.343	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1cc(C)n(CC2CC2)c1C	ZINC001038933149	1344659743	/nfs/dbraw/zinc/65/97/43/1344659743.db2.gz	CZXZCNLYURWBJP-GOSISDBHSA-N	0	3	329.488	3.285	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1cccc2c1OCC2(C)C	ZINC001039093185	1344765873	/nfs/dbraw/zinc/76/58/73/1344765873.db2.gz	RDEXDFWGJIUOGX-HNNXBMFYSA-N	0	3	328.456	3.127	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)c3cccc(C)n3)CC2)C1	ZINC001039106652	1344777907	/nfs/dbraw/zinc/77/79/07/1344777907.db2.gz	TZZLUBDGEIWEQU-QGZVFWFLSA-N	0	3	347.890	3.317	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)c3ccsn3)CC2)C1	ZINC001039142455	1344823623	/nfs/dbraw/zinc/82/36/23/1344823623.db2.gz	JFCHKJOYKYUGCY-AWEZNQCLSA-N	0	3	339.892	3.070	20	30		EGEDHN
CCC(=O)N1CCCC[C@H]1[C@@H]1CCN(Cc2ccc(C#N)c(F)c2)C1	ZINC001039179443	1344875437	/nfs/dbraw/zinc/87/54/37/1344875437.db2.gz	FVMWEQHMILDBEN-MJGOQNOKSA-N	0	3	343.446	3.310	20	30		EGEDHN
O=C(C1CC1)N1CCCC[C@H]1[C@H]1CCN(CC#Cc2ccccc2)C1	ZINC001039184186	1344883386	/nfs/dbraw/zinc/88/33/86/1344883386.db2.gz	ORLXKJHBNVAVCQ-SFTDATJTSA-N	0	3	336.479	3.151	20	30		EGEDHN
CC(=O)N1CCCC[C@@H]1[C@H]1CCN(CC#Cc2cccc(Cl)c2)C1	ZINC001039188379	1344889821	/nfs/dbraw/zinc/88/98/21/1344889821.db2.gz	KRQZEPVLNFVQGO-AZUAARDMSA-N	0	3	344.886	3.414	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc(C)c(C)o2)C1	ZINC001039197453	1344906020	/nfs/dbraw/zinc/90/60/20/1344906020.db2.gz	OKBMEIWOBRHIRY-QZTJIDSGSA-N	0	3	328.456	3.236	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cscc2Cl)C1	ZINC001039216524	1344933345	/nfs/dbraw/zinc/93/33/45/1344933345.db2.gz	BAFLCUZCDGLZDO-CJNGLKHVSA-N	0	3	336.888	3.351	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cn(C)c3ccccc23)C1	ZINC001039217266	1344934092	/nfs/dbraw/zinc/93/40/92/1344934092.db2.gz	GVMOIJPKCHNCMH-YLJYHZDGSA-N	0	3	349.478	3.128	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cn(C)c3ccccc23)C1	ZINC001039217264	1344934336	/nfs/dbraw/zinc/93/43/36/1344934336.db2.gz	GVMOIJPKCHNCMH-PXNSSMCTSA-N	0	3	349.478	3.128	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(F)c(Cl)c2)C1	ZINC001039246551	1344976459	/nfs/dbraw/zinc/97/64/59/1344976459.db2.gz	SOWOLNYUUVCUHK-YJBOKZPZSA-N	0	3	348.849	3.429	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C(C)(C)[C@@H]1CCCCO1	ZINC001039375926	1345033446	/nfs/dbraw/zinc/03/34/46/1345033446.db2.gz	DHUTWAREWSSMNH-SQNIBIBYSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)Oc1ccccc1F	ZINC001039378769	1345034914	/nfs/dbraw/zinc/03/49/14/1345034914.db2.gz	HTZIHZGUQZQMBF-ZACQAIPSSA-N	0	3	346.446	3.234	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccccc1CC	ZINC001039393190	1345042906	/nfs/dbraw/zinc/04/29/06/1345042906.db2.gz	VGYBYIBXTUPHRR-UXHICEINSA-N	0	3	326.484	3.433	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1CCCCC1(F)F	ZINC001039410328	1345053071	/nfs/dbraw/zinc/05/30/71/1345053071.db2.gz	DVBAWHWOPQAOQF-OWCLPIDISA-N	0	3	326.431	3.453	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C(C)(C)c1c(C)noc1C	ZINC001039421912	1345060593	/nfs/dbraw/zinc/06/05/93/1345060593.db2.gz	YDFQSJYWZUWFLS-SJORKVTESA-N	0	3	345.487	3.210	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2ncccc2c1	ZINC001039428353	1345063643	/nfs/dbraw/zinc/06/36/43/1345063643.db2.gz	IRAUQPVGEGJQHT-MOPGFXCFSA-N	0	3	335.451	3.490	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)OC1CCCCCC1	ZINC001039432540	1345065250	/nfs/dbraw/zinc/06/52/50/1345065250.db2.gz	BJEGJYGLDCXUJT-OTWHNJEPSA-N	0	3	346.515	3.203	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccc2nc(C)[nH]c21	ZINC001039457896	1345077490	/nfs/dbraw/zinc/07/74/90/1345077490.db2.gz	SWBQBCJMXGJGQW-CVEARBPZSA-N	0	3	338.455	3.126	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@](C)(OC)c1ccccc1	ZINC001039460579	1345079260	/nfs/dbraw/zinc/07/92/60/1345079260.db2.gz	WYBXGRFTSSBVOB-SVFBPWRDSA-N	0	3	342.483	3.190	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccc(N(C)C)c1	ZINC001039464847	1345082496	/nfs/dbraw/zinc/08/24/96/1345082496.db2.gz	ZRNZUAXTBFMPFQ-MJGOQNOKSA-N	0	3	327.472	3.008	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(F)cc1Cl	ZINC001039466428	1345083890	/nfs/dbraw/zinc/08/38/90/1345083890.db2.gz	KBTISOBHGAFTPF-CABCVRRESA-N	0	3	334.822	3.181	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)Cc1ccc(F)cc1	ZINC001039477157	1345091742	/nfs/dbraw/zinc/09/17/42/1345091742.db2.gz	KZBMQVYDHHFJQB-DBVUQKKJSA-N	0	3	342.458	3.093	20	30		EGEDHN
O=C(C#CC1CC1)N1C[C@H]2CCC[C@@H](C1)N2CCC1=CCCCC1	ZINC001039578875	1345145299	/nfs/dbraw/zinc/14/52/99/1345145299.db2.gz	FQRKFGLXQITYHR-BGYRXZFFSA-N	0	3	326.484	3.356	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC[C@H]1CCOC1	ZINC001039823367	1345200382	/nfs/dbraw/zinc/20/03/82/1345200382.db2.gz	QRSIXXZJSZEGCD-OKZBNKHCSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CCC[C@@H](C1)N2C[C@@H]1CCO[C@H](C)C1	ZINC001039823401	1345200561	/nfs/dbraw/zinc/20/05/61/1345200561.db2.gz	RKVJVXYJXRTUMM-MKXGPGLRSA-N	0	3	348.531	3.469	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CCC[C@@H](C2)N3C[C@H]2CCO[C@H](C)C2)C1	ZINC001039906202	1345243556	/nfs/dbraw/zinc/24/35/56/1345243556.db2.gz	JBEPRSZZLLEWKD-HCXYKTFWSA-N	0	3	346.515	3.223	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3c(C)oc(C)c3C)C2)C1	ZINC001040283821	1345411299	/nfs/dbraw/zinc/41/12/99/1345411299.db2.gz	OKPPYWJMPKMIEJ-HXUWFJFHSA-N	0	3	328.456	3.156	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ccnc4ccccc43)C2)C1	ZINC001040284816	1345412038	/nfs/dbraw/zinc/41/20/38/1345412038.db2.gz	XXLGHJRVEXYADW-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cnc4ccsc4c3)C2)C1	ZINC001040332799	1345437702	/nfs/dbraw/zinc/43/77/02/1345437702.db2.gz	PHURHLPXCVWUSI-IBGZPJMESA-N	0	3	341.480	3.410	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cnc4ccsc4c3)C2)C1	ZINC001040332800	1345437811	/nfs/dbraw/zinc/43/78/11/1345437811.db2.gz	PHURHLPXCVWUSI-LJQANCHMSA-N	0	3	341.480	3.410	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@]2(C1)CCCN(Cc1cccnc1)C2	ZINC001040370917	1345460259	/nfs/dbraw/zinc/46/02/59/1345460259.db2.gz	FKWRHVJPPHZJRS-SFTDATJTSA-N	0	3	341.499	3.498	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@]3(CCN(C(=O)[C@@H]4CC45CC5)C3)C2)cc1	ZINC001040421065	1345488423	/nfs/dbraw/zinc/48/84/23/1345488423.db2.gz	DJYAYOIHCNIABL-PZJWPPBQSA-N	0	3	349.478	3.173	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cccc(F)c3OCC)C2)C1	ZINC001040469800	1345511285	/nfs/dbraw/zinc/51/12/85/1345511285.db2.gz	DXRGYPFTJBWBTL-HXUWFJFHSA-N	0	3	346.446	3.339	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)C[C@@H](C)c3ccco3)C2)C1	ZINC001040493461	1345519045	/nfs/dbraw/zinc/51/90/45/1345519045.db2.gz	LIPJJSBHBYYXLN-YLJYHZDGSA-N	0	3	328.456	3.111	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cc(CC)c(CC)o3)C2)C1	ZINC001040498271	1345521377	/nfs/dbraw/zinc/52/13/77/1345521377.db2.gz	YTNXASXOZPYUMK-OAQYLSRUSA-N	0	3	342.483	3.356	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cc4[nH]ccc4s3)C2)C1	ZINC001040509453	1345526227	/nfs/dbraw/zinc/52/62/27/1345526227.db2.gz	HBFOFCFTNJGPHZ-GOSISDBHSA-N	0	3	329.469	3.344	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3ccccc3OCC)C2)C1	ZINC001040515422	1345528787	/nfs/dbraw/zinc/52/87/87/1345528787.db2.gz	JXSBMELAWYIZSD-HXUWFJFHSA-N	0	3	328.456	3.199	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3ccc(OC(C)C)cc3)C2)C1	ZINC001040520253	1345531218	/nfs/dbraw/zinc/53/12/18/1345531218.db2.gz	SPQRNFJPOUFRBN-NRFANRHFSA-N	0	3	340.467	3.035	20	30		EGEDHN
C=C[C@H](C(=O)N1CC[C@]2(C1)CCCN(CC#CC)C2)c1ccccc1	ZINC001040538110	1345536003	/nfs/dbraw/zinc/53/60/03/1345536003.db2.gz	GFBRPQAAOWJNLF-RBBKRZOGSA-N	0	3	336.479	3.294	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@H](C)c3ccccc3C)C2)C1	ZINC001040539640	1345536814	/nfs/dbraw/zinc/53/68/14/1345536814.db2.gz	PXVWZAPMEMFADT-KNQAVFIVSA-N	0	3	338.495	3.436	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@@H](C)Cc3ccc(C)cc3)C2)C1	ZINC001040542870	1345538315	/nfs/dbraw/zinc/53/83/15/1345538315.db2.gz	MKLJXLVJQQDNRO-SIKLNZKXSA-N	0	3	338.495	3.121	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ccoc3C(C)C)C2)C1	ZINC001040542573	1345538454	/nfs/dbraw/zinc/53/84/54/1345538454.db2.gz	AFUWJIWXPJVHMS-HXUWFJFHSA-N	0	3	328.456	3.354	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(CF)cc3)C2)C1	ZINC001040546484	1345541110	/nfs/dbraw/zinc/54/11/10/1345541110.db2.gz	DSWNJUGDUHCFKO-HXUWFJFHSA-N	0	3	328.431	3.108	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)C3CC(C(C)(C)C)C3)C2)C1	ZINC001040546503	1345541143	/nfs/dbraw/zinc/54/11/43/1345541143.db2.gz	FACHPIRJBKKMPS-NGICGMGXSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)C(C)(C)c3ccccc3C)C2)C1	ZINC001040553054	1345544373	/nfs/dbraw/zinc/54/43/73/1345544373.db2.gz	RLPSCBOLXLWYGN-QFIPXVFZSA-N	0	3	338.495	3.220	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3ccc(CC)c(CC)c3)C2)C1	ZINC001040556982	1345545700	/nfs/dbraw/zinc/54/57/00/1345545700.db2.gz	ULNIXBBFOGVMBS-QFIPXVFZSA-N	0	3	338.495	3.373	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC2(C1)CCN(Cc1ccc(Cl)cc1)CC2	ZINC001040644380	1345559282	/nfs/dbraw/zinc/55/92/82/1345559282.db2.gz	OCYDGOKELNGGKN-HNNXBMFYSA-N	0	3	345.874	3.314	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CCN(C(=O)C=C4CCC4)C3)CC2)c1	ZINC001040666632	1345563347	/nfs/dbraw/zinc/56/33/47/1345563347.db2.gz	HLSZXSBQZIIEAQ-UHFFFAOYSA-N	0	3	349.478	3.483	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccc([C@@H]4C[C@@H]4C)o3)C2)CC1	ZINC001040701191	1345567327	/nfs/dbraw/zinc/56/73/27/1345567327.db2.gz	WGTBNKHZSKBDIR-DLBZAZTESA-N	0	3	340.467	3.354	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccc(Cl)cc3F)C2)CC1	ZINC001040765459	1345576716	/nfs/dbraw/zinc/57/67/16/1345576716.db2.gz	KHFWEJFJSFTYDI-UHFFFAOYSA-N	0	3	348.849	3.431	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)Cc3cccc(Cl)c3)C2)CC1	ZINC001040828570	1345583879	/nfs/dbraw/zinc/58/38/79/1345583879.db2.gz	NAYWZYSZLBPRMM-UHFFFAOYSA-N	0	3	344.886	3.220	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@H](C)c3ccc(C)cc3)C2)CC1	ZINC001040919029	1345599775	/nfs/dbraw/zinc/59/97/75/1345599775.db2.gz	GCCALALZJQLIRZ-LJQANCHMSA-N	0	3	338.495	3.436	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cc4c(s3)CCC4)C2)CC1	ZINC001040931475	1345604285	/nfs/dbraw/zinc/60/42/85/1345604285.db2.gz	NXUIIXFMJWCOSV-UHFFFAOYSA-N	0	3	342.508	3.188	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3sc(C(C)C)nc3C)C2)CC1	ZINC001040936476	1345604917	/nfs/dbraw/zinc/60/49/17/1345604917.db2.gz	LBNSIJAWMBSTEN-UHFFFAOYSA-N	0	3	345.512	3.136	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@H](C)Cc3ccc(C)cc3)C2)CC1	ZINC001040947897	1345607727	/nfs/dbraw/zinc/60/77/27/1345607727.db2.gz	HQJYNIHDKRNHIF-LJQANCHMSA-N	0	3	338.495	3.121	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)C3C[C@H](C)C[C@@H](C)C3)C2)CC1	ZINC001040954448	1345610296	/nfs/dbraw/zinc/61/02/96/1345610296.db2.gz	ZUDJMIJMGJXCRB-QZTJIDSGSA-N	0	3	330.516	3.397	20	30		EGEDHN
Cc1ccc(CN2CC[C@@]3(CCN(C(=O)[C@H](C)C#N)C3)C2)c(Cl)c1	ZINC001041136226	1345658310	/nfs/dbraw/zinc/65/83/10/1345658310.db2.gz	GIZTYHMAAWIUNJ-DNVCBOLYSA-N	0	3	345.874	3.233	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@@]2(CCN(C/C=C\c3ccccc3)C2)C1	ZINC001041273566	1345691288	/nfs/dbraw/zinc/69/12/88/1345691288.db2.gz	OBEFSJODVOTRRI-VWTGBZJHSA-N	0	3	334.463	3.038	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)Cc3c(C)cccc3Cl)C2)C1	ZINC001041441101	1345728401	/nfs/dbraw/zinc/72/84/01/1345728401.db2.gz	VVZYRCSUKPWPRY-HXUWFJFHSA-N	0	3	344.886	3.139	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)Cc3ccc(CCCC)cc3)C2)C1	ZINC001041447644	1345730018	/nfs/dbraw/zinc/73/00/18/1345730018.db2.gz	BFBCGKAFTXERGZ-JOCHJYFZSA-N	0	3	338.495	3.129	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3cc(C)c(Cl)cc3C)C2)C1	ZINC001041536510	1345755657	/nfs/dbraw/zinc/75/56/57/1345755657.db2.gz	OLZTZSBCBCXFMK-IBGZPJMESA-N	0	3	330.859	3.128	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@]2(CCN(Cc3c(C)noc3CC)C2)C1	ZINC001041540986	1345756219	/nfs/dbraw/zinc/75/62/19/1345756219.db2.gz	RSAMUEYNVFDRHU-HXUWFJFHSA-N	0	3	345.487	3.182	20	30		EGEDHN
C[C@]1(C(=O)N2CC[C@@]3(CCN(Cc4ccc(C#N)cc4)C3)C2)C=CCC1	ZINC001041560140	1345769305	/nfs/dbraw/zinc/76/93/05/1345769305.db2.gz	PFVKLQZSQLLWLE-FCHUYYIVSA-N	0	3	349.478	3.339	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001041622629	1345798510	/nfs/dbraw/zinc/79/85/10/1345798510.db2.gz	JRPWGQSXECSVHQ-NRFANRHFSA-N	0	3	339.483	3.419	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccccc3-n3cccc3)C2)C1	ZINC001041632196	1345802343	/nfs/dbraw/zinc/80/23/43/1345802343.db2.gz	FULCZQXMKFBXHB-JOCHJYFZSA-N	0	3	347.462	3.039	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccccc3-n3cccc3)C2)C1	ZINC001041632199	1345802459	/nfs/dbraw/zinc/80/24/59/1345802459.db2.gz	FULCZQXMKFBXHB-QFIPXVFZSA-N	0	3	347.462	3.039	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@]2(CCN(CCC(F)(F)F)C2)C1	ZINC001041638116	1345805511	/nfs/dbraw/zinc/80/55/11/1345805511.db2.gz	IGWICBPGJOUWSJ-CVEARBPZSA-N	0	3	332.410	3.466	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cc(C(CC)CC)no3)C2)C1	ZINC001041728606	1345833731	/nfs/dbraw/zinc/83/37/31/1345833731.db2.gz	LGSIMKUJEUOHCZ-FQEVSTJZSA-N	0	3	343.471	3.140	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)[C@@H]3C[C@H]3c3ccc(C)s3)C2)C1	ZINC001041730401	1345834911	/nfs/dbraw/zinc/83/49/11/1345834911.db2.gz	NSFIAPBJIORSGX-HLIPFELVSA-N	0	3	342.508	3.108	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccc4c(c3)C=CCC4)C2)C1	ZINC001041731716	1345835058	/nfs/dbraw/zinc/83/50/58/1345835058.db2.gz	AWIURPYWIFRLCS-JOCHJYFZSA-N	0	3	334.463	3.207	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3ccc(O[C@H](C)CC)cc3)C2)C1	ZINC001041774105	1345845141	/nfs/dbraw/zinc/84/51/41/1345845141.db2.gz	RLLNLCSUVUQCAZ-DYESRHJHSA-N	0	3	340.467	3.035	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccc4c(c3)CCC=C4)C2)C1	ZINC001041791528	1345851820	/nfs/dbraw/zinc/85/18/20/1345851820.db2.gz	MCHQQBLQQIDODA-JOCHJYFZSA-N	0	3	334.463	3.207	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3cc(CC)c(CCC)s3)C2)C1	ZINC001041822216	1345863805	/nfs/dbraw/zinc/86/38/05/1345863805.db2.gz	PYWDWXUIOBKFBR-HXUWFJFHSA-N	0	3	344.524	3.434	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3c[nH]c4c3cccc4CC)C2)C1	ZINC001041845546	1345871652	/nfs/dbraw/zinc/87/16/52/1345871652.db2.gz	HRJFYTSMQSSFFN-JOCHJYFZSA-N	0	3	349.478	3.292	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@@H]2C1	ZINC001041950846	1345907195	/nfs/dbraw/zinc/90/71/95/1345907195.db2.gz	WBLIAPJMWCUZCM-VQTJNVASSA-N	0	3	339.483	3.417	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@H]2CCN(Cc3ccc(C#N)cc3)[C@@H]2C1	ZINC001042014416	1345925717	/nfs/dbraw/zinc/92/57/17/1345925717.db2.gz	RLYSEXHTRQAVOS-QZTJIDSGSA-N	0	3	341.430	3.244	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cccc(Cl)c3C)C[C@H]21	ZINC001042067182	1345934870	/nfs/dbraw/zinc/93/48/70/1345934870.db2.gz	OHOCIPOAFKEDLC-CRAIPNDOSA-N	0	3	330.859	3.208	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3nccc4ccsc43)C[C@H]21	ZINC001042101714	1345944484	/nfs/dbraw/zinc/94/44/84/1345944484.db2.gz	XQIAYNTXZYMUNP-UKRRQHHQSA-N	0	3	327.453	3.019	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3CCN(C(=O)C4(C5CC5)CC4)C[C@@H]32)c1	ZINC001042107511	1345945782	/nfs/dbraw/zinc/94/57/82/1345945782.db2.gz	RKXJGNVQESPXLQ-ICSRJNTNSA-N	0	3	349.478	3.171	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)Cc3ccc(CCCC)cc3)C[C@H]21	ZINC001042138680	1345953952	/nfs/dbraw/zinc/95/39/52/1345953952.db2.gz	RHNXQRIEARDRTH-NHCUHLMSSA-N	0	3	338.495	3.128	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3c(C)[nH]c4ccccc43)C[C@@H]21	ZINC001042142026	1345955136	/nfs/dbraw/zinc/95/51/36/1345955136.db2.gz	KPSYNXZRZBRVKB-LPHOPBHVSA-N	0	3	335.451	3.036	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc4c(c3)C(C)(C)CO4)C[C@@H]21	ZINC001042147744	1345956913	/nfs/dbraw/zinc/95/69/13/1345956913.db2.gz	HJXCHUNWJMADOZ-YJBOKZPZSA-N	0	3	340.467	3.079	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(-c4ccco4)o3)C[C@@H]21	ZINC001042150446	1345957288	/nfs/dbraw/zinc/95/72/88/1345957288.db2.gz	VIBZZXKQRQUURR-GJZGRUSLSA-N	0	3	326.396	3.262	20	30		EGEDHN
CC1(CC(=O)N2CC[C@@H]3CCN(Cc4cccc(C#N)c4)[C@@H]3C2)CC1	ZINC001042157120	1345959131	/nfs/dbraw/zinc/95/91/31/1345959131.db2.gz	ZMWNIRDVNTWQFE-RBUKOAKNSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C3(c4ccc(F)cc4)CCC3)C[C@@H]21	ZINC001042177100	1345968272	/nfs/dbraw/zinc/96/82/72/1345968272.db2.gz	UJTVORZJMHOHSX-APWZRJJASA-N	0	3	342.458	3.356	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3sc(C)nc3C)[C@@H]2C1	ZINC001042183540	1345971190	/nfs/dbraw/zinc/97/11/90/1345971190.db2.gz	KYHIOFXEWMIWQK-HZPDHXFCSA-N	0	3	347.528	3.395	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3c(F)ccc(F)c3F)C[C@H]21	ZINC001042207787	1345986323	/nfs/dbraw/zinc/98/63/23/1345986323.db2.gz	UHJQCLWHMQRQPW-IUODEOHRSA-N	0	3	338.373	3.216	20	30		EGEDHN
CC(F)(F)CC(=O)N1CC[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@@H]2C1	ZINC001042218385	1345990872	/nfs/dbraw/zinc/99/08/72/1345990872.db2.gz	JDBLKLXZKSHIMC-DLBZAZTESA-N	0	3	347.409	3.026	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C(C)(C)c3cccc(F)c3)C[C@H]21	ZINC001042229516	1345997186	/nfs/dbraw/zinc/99/71/86/1345997186.db2.gz	FQUABHXGRMNPPE-VQIMIIECSA-N	0	3	342.458	3.049	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C(C)(C)c3cccc(F)c3)C[C@@H]21	ZINC001042229678	1345997530	/nfs/dbraw/zinc/99/75/30/1345997530.db2.gz	HABLBEQSMYEWFW-QAPCUYQASA-N	0	3	330.447	3.212	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3cc4cc(F)ccc4o3)C[C@@H]21	ZINC001042251925	1346006443	/nfs/dbraw/zinc/00/64/43/1346006443.db2.gz	GPLSDUOHCZXJEJ-PBHICJAKSA-N	0	3	340.398	3.132	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3csc(C(C)C)n3)C[C@H]21	ZINC001042265238	1346011839	/nfs/dbraw/zinc/01/18/39/1346011839.db2.gz	DSOZJHRAGIIHQX-GOEBONIOSA-N	0	3	333.501	3.379	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(OC)cc3Cl)C[C@H]21	ZINC001042272081	1346014598	/nfs/dbraw/zinc/01/45/98/1346014598.db2.gz	LAIFVJNJEUBZIU-SUMWQHHRSA-N	0	3	334.847	3.071	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cnn(C(CC)CC)c3C)C[C@@H]21	ZINC001042305002	1346025798	/nfs/dbraw/zinc/02/57/98/1346025798.db2.gz	VRPGRKXSHFMMIH-APWZRJJASA-N	0	3	344.503	3.275	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)C(C)(C)c3ccc(C)cc3)C[C@@H]21	ZINC001042315767	1346030201	/nfs/dbraw/zinc/03/02/01/1346030201.db2.gz	CDHVSEUNMFBZAC-ICSRJNTNSA-N	0	3	338.495	3.219	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)CC(C)(C)c3ccc(C)cc3)C[C@@H]21	ZINC001042345274	1346048074	/nfs/dbraw/zinc/04/80/74/1346048074.db2.gz	KNWHDKHTXCIHMD-QUCCMNQESA-N	0	3	338.495	3.219	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C3(c4cc(C)cc(C)c4)CC3)C[C@@H]21	ZINC001042360139	1346054416	/nfs/dbraw/zinc/05/44/16/1346054416.db2.gz	NUUVQZIXMVCABX-ICSRJNTNSA-N	0	3	338.495	3.444	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccccc3CC(C)C)C[C@@H]21	ZINC001042373932	1346062517	/nfs/dbraw/zinc/06/25/17/1346062517.db2.gz	FILYRBIKRIYSPN-RXVVDRJESA-N	0	3	338.495	3.445	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cscc3C(F)(F)F)C[C@H]21	ZINC001042383841	1346065958	/nfs/dbraw/zinc/06/59/58/1346065958.db2.gz	YOAWPYKAWGKRJI-SMDDNHRTSA-N	0	3	344.402	3.489	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@H](NCc3ccccc3C#N)C[C@@H]2C)o1	ZINC001044446395	1346335314	/nfs/dbraw/zinc/33/53/14/1346335314.db2.gz	KCGXVYQUEJHKHH-KSSFIOAISA-N	0	3	337.423	3.243	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@H](NCc3ccccc3C#N)C[C@@H]2C)cn1	ZINC001044472335	1346342746	/nfs/dbraw/zinc/34/27/46/1346342746.db2.gz	LHEILQDZYKJXOV-JXFKEZNVSA-N	0	3	348.450	3.045	20	30		EGEDHN
Cc1ccncc1C(=O)N1CC[C@@H](NCc2ccccc2C#N)C[C@H]1C	ZINC001044516965	1346354369	/nfs/dbraw/zinc/35/43/69/1346354369.db2.gz	GESOGMBTOGPBMM-VQIMIIECSA-N	0	3	348.450	3.045	20	30		EGEDHN
C[C@H]1C[C@@H](NCc2cc(F)ccc2C#N)CCN1C(=O)CC1CCC1	ZINC001044532957	1346360013	/nfs/dbraw/zinc/36/00/13/1346360013.db2.gz	UKFPRCBGLQHNIN-LIRRHRJNSA-N	0	3	343.446	3.357	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2cc(F)ccc2C#N)CCN1C(=O)C=C1CCC1	ZINC001044540878	1346363879	/nfs/dbraw/zinc/36/38/79/1346363879.db2.gz	WVVIOHWERFSZGW-AUUYWEPGSA-N	0	3	341.430	3.277	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)C[C@@H]2C=CCC2)c(F)c1	ZINC001044914813	1346462010	/nfs/dbraw/zinc/46/20/10/1346462010.db2.gz	IVYKGJUGCXYUMC-QAPCUYQASA-N	0	3	341.430	3.134	20	30		EGEDHN
C[C@H](NC[C@@H]1CCCN1C(=O)C#CC1CC1)c1ccc(F)cc1F	ZINC001045028679	1346483520	/nfs/dbraw/zinc/48/35/20/1346483520.db2.gz	HDKIORFHKXLTGX-BBRMVZONSA-N	0	3	332.394	3.020	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC[C@H]1CNCc1cc(C)ns1	ZINC001045051990	1346487060	/nfs/dbraw/zinc/48/70/60/1346487060.db2.gz	LCHUIOIKKOLAOD-ZDUSSCGKSA-N	0	3	341.908	3.311	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC[C@H]1CNCc1scnc1C	ZINC001045053737	1346487504	/nfs/dbraw/zinc/48/75/04/1346487504.db2.gz	KEKBQMOUBJWZBO-ZDUSSCGKSA-N	0	3	341.908	3.311	20	30		EGEDHN
CC1(NC(=O)c2cccs2)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045349393	1346569247	/nfs/dbraw/zinc/56/92/47/1346569247.db2.gz	MDQJBRJTSFAHIW-UHFFFAOYSA-N	0	3	339.464	3.404	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)[C@@H]2[C@@H](c3ccccc3)C2(C)C)CC1	ZINC001045441953	1346594657	/nfs/dbraw/zinc/59/46/57/1346594657.db2.gz	NLCLGITYOUYAJW-MOPGFXCFSA-N	0	3	338.495	3.420	20	30		EGEDHN
CC1(NC(=O)[C@H]2CC[C@H](F)C2)CCN(Cc2cccc(C#N)c2)CC1	ZINC001045536574	1346621198	/nfs/dbraw/zinc/62/11/98/1346621198.db2.gz	AOMVZIUCUIKLQY-ROUUACIJSA-N	0	3	343.446	3.167	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2cc(F)c(F)c(F)c2F)CC1	ZINC001045624872	1346651003	/nfs/dbraw/zinc/65/10/03/1346651003.db2.gz	GKAOAGLHPSTIQM-UHFFFAOYSA-N	0	3	330.325	3.013	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2ccc(COC(C)C)cc2)CC1	ZINC001045636233	1346654764	/nfs/dbraw/zinc/65/47/64/1346654764.db2.gz	LKZLTFXRXIZTSG-UHFFFAOYSA-N	0	3	330.472	3.382	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCCC[C@@]2(CCN(Cc3ccccc3F)C2)C1	ZINC001045925009	1346761413	/nfs/dbraw/zinc/76/14/13/1346761413.db2.gz	QATOPBJBCBZHBW-JXFKEZNVSA-N	0	3	343.446	3.190	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc(Cl)cn1C)C2	ZINC001045950647	1346785193	/nfs/dbraw/zinc/78/51/93/1346785193.db2.gz	IFPWPKWXNOJJIC-IBGZPJMESA-N	0	3	347.890	3.020	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@]13C[C@@H]1CCCC3)C2	ZINC001045964087	1346798753	/nfs/dbraw/zinc/79/87/53/1346798753.db2.gz	XZPUPOPZTJQCBO-TYPHKJRUSA-N	0	3	328.500	3.295	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc3cnccc3c1)C2	ZINC001045977723	1346813749	/nfs/dbraw/zinc/81/37/49/1346813749.db2.gz	HGIQJISBXXJIAR-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@H](C)c1ccc(C)s1)C2	ZINC001045978965	1346815817	/nfs/dbraw/zinc/81/58/17/1346815817.db2.gz	LYCNDKXTEYAVPJ-YLJYHZDGSA-N	0	3	344.524	3.498	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1sccc1OC)C2	ZINC001045980444	1346817732	/nfs/dbraw/zinc/81/77/32/1346817732.db2.gz	YPXNAKWKOBCTEZ-LJQANCHMSA-N	0	3	346.496	3.098	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc3c(s1)CCC3)C2	ZINC001045984201	1346824594	/nfs/dbraw/zinc/82/45/94/1346824594.db2.gz	XLXHJZOBBKNXEB-FQEVSTJZSA-N	0	3	342.508	3.188	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)CCc1ccc(C)s1)C2	ZINC001045988237	1346830037	/nfs/dbraw/zinc/83/00/37/1346830037.db2.gz	LCKOIRBKIPREPQ-FQEVSTJZSA-N	0	3	344.524	3.327	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2ccc(OC)c(C3CC3)c2)C1	ZINC001046738190	1347077757	/nfs/dbraw/zinc/07/77/57/1347077757.db2.gz	VUKRUOINAQSBAN-FQEVSTJZSA-N	0	3	328.456	3.343	20	30		EGEDHN
C#CCCN1CC[C@](C)(NC(=O)c2cc(CC)c(CCC)s2)C1	ZINC001046830245	1347121888	/nfs/dbraw/zinc/12/18/88/1347121888.db2.gz	RFNTUKPCZWITDO-IBGZPJMESA-N	0	3	332.513	3.481	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@@H](CNC(=O)[C@@H]2CCC(C)=C(C)C2)C1	ZINC001046941721	1347158565	/nfs/dbraw/zinc/15/85/65/1347158565.db2.gz	PLAFWLFTMQSEPL-SJORKVTESA-N	0	3	338.442	3.220	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3ccc(Cl)o3)C2)CC1	ZINC001047223802	1347253981	/nfs/dbraw/zinc/25/39/81/1347253981.db2.gz	PTIXCYODYMRVJV-HNNXBMFYSA-N	0	3	334.847	3.130	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)C=C3CCCCC3)C2)CC1	ZINC001047224575	1347254644	/nfs/dbraw/zinc/25/46/44/1347254644.db2.gz	GFIRODPXLXWLBZ-HXUWFJFHSA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@H]3CCC(F)(F)C3)C2)CC1	ZINC001047243967	1347269401	/nfs/dbraw/zinc/26/94/01/1347269401.db2.gz	OHHJFNNMYGAFGV-IRXDYDNUSA-N	0	3	338.442	3.006	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)C3(C(F)F)CCC3)C2)CC1	ZINC001047248649	1347273570	/nfs/dbraw/zinc/27/35/70/1347273570.db2.gz	OOJDWQUAUFTVIK-INIZCTEOSA-N	0	3	338.442	3.006	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)[C@]3(C)C=CCC3)C2)CC1	ZINC001047251127	1347275720	/nfs/dbraw/zinc/27/57/20/1347275720.db2.gz	GDCOFPDPXSSSDS-PZJWPPBQSA-N	0	3	328.500	3.317	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)[C@@]3(C)C=CCC3)C2)CC1	ZINC001047251119	1347275734	/nfs/dbraw/zinc/27/57/34/1347275734.db2.gz	GDCOFPDPXSSSDS-CTNGQTDRSA-N	0	3	328.500	3.317	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)C[C@@H](C)c3ccco3)C2)CC1	ZINC001047263164	1347284354	/nfs/dbraw/zinc/28/43/54/1347284354.db2.gz	ATYLWGANSNEDNK-MJGOQNOKSA-N	0	3	342.483	3.357	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3ccc(F)cc3C)C2)CC1	ZINC001047263513	1347284391	/nfs/dbraw/zinc/28/43/91/1347284391.db2.gz	HVEKWNFMDDTXES-SFHVURJKSA-N	0	3	342.458	3.332	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)Cc3ccc(C)s3)C2)CC1	ZINC001047265980	1347286848	/nfs/dbraw/zinc/28/68/48/1347286848.db2.gz	NEPWEIBTMPFIOC-SFHVURJKSA-N	0	3	344.524	3.183	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)C2CC(C)(C)C2)C1	ZINC001047829772	1347382991	/nfs/dbraw/zinc/38/29/91/1347382991.db2.gz	IIBSROOMGVMSEN-YJBOKZPZSA-N	0	3	339.483	3.321	20	30		EGEDHN
C[C@H]1CN(C(=O)c2ccccc2)C[C@@H]1CNCc1ccccc1C#N	ZINC001048111770	1347470256	/nfs/dbraw/zinc/47/02/56/1347470256.db2.gz	FJVZSTNFKZJHIT-JXFKEZNVSA-N	0	3	333.435	3.056	20	30		EGEDHN
C[C@H]1CN(C(=O)C2CCCCC2)C[C@@H]1CNCc1ccccc1C#N	ZINC001048118672	1347472817	/nfs/dbraw/zinc/47/28/17/1347472817.db2.gz	QGGUMCLQBPTVFV-JXFKEZNVSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H](C)[C@@H](CNCc3nc(C)c(C)s3)C2)C1	ZINC001048375387	1347535754	/nfs/dbraw/zinc/53/57/54/1347535754.db2.gz	XOXSEFMFXFPUBE-BBRMVZONSA-N	0	3	347.528	3.300	20	30		EGEDHN
C=C(C)CN1CCC(N(Cc2ccccn2)C(=O)c2ccco2)CC1	ZINC001048623636	1347622750	/nfs/dbraw/zinc/62/27/50/1347622750.db2.gz	FAZBYKKOBCBPPV-UHFFFAOYSA-N	0	3	339.439	3.358	20	30		EGEDHN
C[C@@H](c1ccc(Cl)cc1)N1C[C@@H]2CN(C(=O)C#CC3CC3)C[C@@H]2C1	ZINC001048812179	1347663557	/nfs/dbraw/zinc/66/35/57/1347663557.db2.gz	DNRXTFCUXLHXOZ-JCGIZDLHSA-N	0	3	342.870	3.205	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1C[C@H]2CN(C/C=C/Cl)C[C@H]2C1	ZINC001048898287	1347679408	/nfs/dbraw/zinc/67/94/08/1347679408.db2.gz	MOVAFMFLGZKRTE-PIEANVHJSA-N	0	3	346.858	3.008	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C(C)(C)c3ccccc3Cl)C[C@@H]2C1	ZINC001049179728	1347739974	/nfs/dbraw/zinc/73/99/74/1347739974.db2.gz	KDSASIYSYCMVQC-IYBDPMFKSA-N	0	3	344.886	3.031	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)c2ccccc2)c1	ZINC001049295240	1347777068	/nfs/dbraw/zinc/77/70/68/1347777068.db2.gz	DGTXBEPIOYKGHY-NHCUHLMSSA-N	0	3	345.446	3.437	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)[C@H]2CC=CCC2)cc1	ZINC001049325981	1347792021	/nfs/dbraw/zinc/79/20/21/1347792021.db2.gz	LCAFJUXZLLSWAY-PWRODBHTSA-N	0	3	349.478	3.480	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)CC2CCC2)cc1	ZINC001049395420	1347819453	/nfs/dbraw/zinc/81/94/53/1347819453.db2.gz	GEKFVVIHNPRPNL-WOJBJXKFSA-N	0	3	337.467	3.314	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@H]2CCCN3C(=O)C2=CCCC2)cc1	ZINC001049417085	1347839472	/nfs/dbraw/zinc/83/94/72/1347839472.db2.gz	ZUYMLKHZNDWFBV-UXHICEINSA-N	0	3	335.451	3.234	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@@H]2[C@@H]1CCN2C/C=C\c1ccccc1	ZINC001049469974	1347864422	/nfs/dbraw/zinc/86/44/22/1347864422.db2.gz	FPHJPARYGPQPHQ-BUIZIQSISA-N	0	3	334.463	3.179	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cn(CC)nc1C1CC1	ZINC001049501894	1347881133	/nfs/dbraw/zinc/88/11/33/1347881133.db2.gz	LSDKWGCWISJYDF-ZWKOTPCHSA-N	0	3	342.487	3.035	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1snnc1C1CC1	ZINC001049532310	1347895436	/nfs/dbraw/zinc/89/54/36/1347895436.db2.gz	OKYYYFNOZZTSLG-LSDHHAIUSA-N	0	3	346.500	3.061	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc2c([nH]1)c(F)ccc2C	ZINC001049562506	1347911242	/nfs/dbraw/zinc/91/12/42/1347911242.db2.gz	WFXIEEQDSOWBEJ-ROUUACIJSA-N	0	3	341.430	3.480	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(COC)cs1	ZINC001049572225	1347915884	/nfs/dbraw/zinc/91/58/84/1347915884.db2.gz	JVOZPIVJSYURFC-CVEARBPZSA-N	0	3	334.485	3.150	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H]1COc2ccc(Cl)cc21	ZINC001049589015	1347925091	/nfs/dbraw/zinc/92/50/91/1347925091.db2.gz	JSOURJXMVAJJCM-YESZJQIVSA-N	0	3	346.858	3.067	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1c(C)onc1C1CC1	ZINC001049599487	1347930586	/nfs/dbraw/zinc/93/05/86/1347930586.db2.gz	SCAGLPJZZACMHO-CVEARBPZSA-N	0	3	329.444	3.115	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)[C@]23C[C@H]2CCC3)cc1	ZINC001049602341	1347931687	/nfs/dbraw/zinc/93/16/87/1347931687.db2.gz	QXUNGNUDWBTMBO-XAPVIXHLSA-N	0	3	349.478	3.314	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(C)nc1C(C)C	ZINC001049621802	1347939115	/nfs/dbraw/zinc/93/91/15/1347939115.db2.gz	OSMWUCTWEPOUCX-ROUUACIJSA-N	0	3	327.472	3.378	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1cnccc1C	ZINC001049635682	1347946258	/nfs/dbraw/zinc/94/62/58/1347946258.db2.gz	MAVGVDZKDGWULN-ROUUACIJSA-N	0	3	327.472	3.168	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)[C@H]2C[C@H]3C[C@H]3C2)c1	ZINC001049661587	1347961395	/nfs/dbraw/zinc/96/13/95/1347961395.db2.gz	WMBKTVRSWCYIJA-XIYVOTBMSA-N	0	3	349.478	3.170	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(F)c(F)c1F	ZINC001049676796	1347967783	/nfs/dbraw/zinc/96/77/83/1347967783.db2.gz	QPONQJKBPBJEMN-LSDHHAIUSA-N	0	3	338.373	3.359	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(F)c(Cl)cc1F	ZINC001049678583	1347969003	/nfs/dbraw/zinc/96/90/03/1347969003.db2.gz	CAVZZMUVNZYZFZ-CVEARBPZSA-N	0	3	340.801	3.483	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1c(F)cc(F)cc1F	ZINC001049681466	1347970443	/nfs/dbraw/zinc/97/04/43/1347970443.db2.gz	OZAAJBKXOFIHCQ-HOTGVXAUSA-N	0	3	338.373	3.359	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc2cc(OC)ccc2[nH]1	ZINC001049682980	1347971124	/nfs/dbraw/zinc/97/11/24/1347971124.db2.gz	YVWPSJDXWQMIDO-MOPGFXCFSA-N	0	3	339.439	3.041	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ncccc1OCCC	ZINC001049688771	1347972404	/nfs/dbraw/zinc/97/24/04/1347972404.db2.gz	WXFDOOKEPSRKAZ-IRXDYDNUSA-N	0	3	343.471	3.125	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]3[C@H]2CCN3Cc2ncccc2C)C1	ZINC001049712367	1347986406	/nfs/dbraw/zinc/98/64/06/1347986406.db2.gz	QBVWPYSOCFWIMZ-RTBURBONSA-N	0	3	339.483	3.312	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(C(C)C)cn1	ZINC001049723760	1347990734	/nfs/dbraw/zinc/99/07/34/1347990734.db2.gz	OPHMMXPRFOFDPD-OALUTQOASA-N	0	3	327.472	3.460	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1noc2c1CCCCC2	ZINC001049759763	1348005151	/nfs/dbraw/zinc/00/51/51/1348005151.db2.gz	RVLLJKIIADZLCO-IRXDYDNUSA-N	0	3	343.471	3.199	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCC[C@H]2[C@H]1CCN2Cc1cccc(C#N)c1	ZINC001049766804	1348010624	/nfs/dbraw/zinc/01/06/24/1348010624.db2.gz	DWWKBNZJEVPUKC-FFZOFVMBSA-N	0	3	339.483	3.416	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)[C@@H]2C[C@H]2C2CC2)c1	ZINC001049776929	1348015762	/nfs/dbraw/zinc/01/57/62/1348015762.db2.gz	MWMBRNHNCSFEDT-JSXRDJHFSA-N	0	3	349.478	3.170	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)[C@@H]2C[C@H]2C2CC2)c1	ZINC001049776927	1348015895	/nfs/dbraw/zinc/01/58/95/1348015895.db2.gz	MWMBRNHNCSFEDT-DOIPELPJSA-N	0	3	349.478	3.170	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cn1cc(C)c2ccccc21	ZINC001049775437	1348016115	/nfs/dbraw/zinc/01/61/15/1348016115.db2.gz	DFTKUDFGXAPCNH-SFTDATJTSA-N	0	3	349.478	3.038	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccc(OC)cc1	ZINC001049777107	1348016650	/nfs/dbraw/zinc/01/66/50/1348016650.db2.gz	OCUASNGGURAVMM-NMLBUPMWSA-N	0	3	340.467	3.050	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cccc(-c2cnco2)c1	ZINC001049818905	1348036173	/nfs/dbraw/zinc/03/61/73/1348036173.db2.gz	BGLZPRUWJAHANP-QZTJIDSGSA-N	0	3	337.423	3.207	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1coc(C2CCCC2)n1	ZINC001049828876	1348043868	/nfs/dbraw/zinc/04/38/68/1348043868.db2.gz	RCWLUOMUABLSNW-MSOLQXFVSA-N	0	3	341.455	3.034	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C1(c2ccccc2F)CCC1	ZINC001049845783	1348055011	/nfs/dbraw/zinc/05/50/11/1348055011.db2.gz	YGQZCCLCGJPMMB-RBUKOAKNSA-N	0	3	342.458	3.499	20	30		EGEDHN
CC(C)(C)C(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1cccc(C#N)c1	ZINC001049859913	1348066647	/nfs/dbraw/zinc/06/66/47/1348066647.db2.gz	XXSUUTRXXHCJLJ-ROUUACIJSA-N	0	3	325.456	3.170	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(N(CC)CC)cc1	ZINC001049863746	1348070011	/nfs/dbraw/zinc/07/00/11/1348070011.db2.gz	NQFJVOSTRVSHMD-UXHICEINSA-N	0	3	341.499	3.398	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1oc2ccccc2c1C	ZINC001049877022	1348081768	/nfs/dbraw/zinc/08/17/68/1348081768.db2.gz	OTLRXJYSVJEPCM-ZWKOTPCHSA-N	0	3	336.435	3.443	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(C)n(C(C)C)c1C	ZINC001049884189	1348089556	/nfs/dbraw/zinc/08/95/56/1348089556.db2.gz	AMNCFGVKKHIUGO-PMACEKPBSA-N	0	3	341.499	3.388	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(OCC2CC2)cc1	ZINC001049901276	1348101016	/nfs/dbraw/zinc/10/10/16/1348101016.db2.gz	OCQAIWOZGGQLKK-WOJBJXKFSA-N	0	3	340.467	3.340	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1cccc(F)c1F	ZINC001049906914	1348105004	/nfs/dbraw/zinc/10/50/04/1348105004.db2.gz	GUXMQEXCUMERAH-IDCNUPLLSA-N	0	3	346.421	3.320	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(OC2CCC2)cc1	ZINC001049909700	1348106720	/nfs/dbraw/zinc/10/67/20/1348106720.db2.gz	RWJAOZBVSIWKMI-VQTJNVASSA-N	0	3	340.467	3.483	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](F)Cc1ccccc1	ZINC001049912583	1348108072	/nfs/dbraw/zinc/10/80/72/1348108072.db2.gz	MTNWADQSPLBSTE-CEXWTWQISA-N	0	3	330.447	3.209	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](C)Cc1ccc(C)cc1	ZINC001049914106	1348108832	/nfs/dbraw/zinc/10/88/32/1348108832.db2.gz	MSRYHCDGIMKBHS-DFQSSKMNSA-N	0	3	326.484	3.425	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(N(C)C(C)C)cc1	ZINC001049928914	1348118980	/nfs/dbraw/zinc/11/89/80/1348118980.db2.gz	WJZLRTJZSCTRQI-PMACEKPBSA-N	0	3	341.499	3.396	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CCCN(C(=O)C=C4CCC4)[C@@H]3C2)c1	ZINC001050016859	1348155478	/nfs/dbraw/zinc/15/54/78/1348155478.db2.gz	MZCLTYNYFKCDPJ-VQTJNVASSA-N	0	3	335.451	3.091	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)Cc3ccc(C)c(Cl)c3)[C@@H]2C1	ZINC001050075107	1348173360	/nfs/dbraw/zinc/17/33/60/1348173360.db2.gz	VGUIEZCKLSUDRM-PKOBYXMFSA-N	0	3	344.886	3.137	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3CCCN(C(=O)[C@@H]4C[C@H]4C4CC4)[C@@H]3C2)cc1	ZINC001050161567	1348200400	/nfs/dbraw/zinc/20/04/00/1348200400.db2.gz	CCAQVWUJTAFERL-UWHLTILDSA-N	0	3	349.478	3.027	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3ccc(OC)cc3Cl)[C@@H]2C1	ZINC001050166440	1348202104	/nfs/dbraw/zinc/20/21/04/1348202104.db2.gz	YDHBIRRSZSNNAH-SUMWQHHRSA-N	0	3	334.847	3.071	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3coc(C4CCC4)n3)[C@@H]2C1	ZINC001050179707	1348203520	/nfs/dbraw/zinc/20/35/20/1348203520.db2.gz	PBUXJYIROMFCHR-DOTOQJQBSA-N	0	3	329.444	3.055	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)Cc3ccc4ccccc4c3)[C@@H]2C1	ZINC001050197802	1348208732	/nfs/dbraw/zinc/20/87/32/1348208732.db2.gz	KGPVLOSFQRZMMQ-FCHUYYIVSA-N	0	3	346.474	3.328	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3ccc(N(C)CCC)cc3)[C@@H]2C1	ZINC001050214215	1348212735	/nfs/dbraw/zinc/21/27/35/1348212735.db2.gz	IXMINJQXQXDJNH-AZUAARDMSA-N	0	3	341.499	3.255	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC[C@H](CNCc3nocc3C)CC2)C1	ZINC001050363305	1348239451	/nfs/dbraw/zinc/23/94/51/1348239451.db2.gz	VDAFIOAKWYJCEC-WKILWMFISA-N	0	3	331.460	3.104	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1cccnc1)CC2	ZINC001050645457	1348314054	/nfs/dbraw/zinc/31/40/54/1348314054.db2.gz	NBRFCTHPSQLZGF-LJQANCHMSA-N	0	3	327.472	3.108	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc(C(C)(F)F)cc3)C2)CC1	ZINC001050781244	1348356518	/nfs/dbraw/zinc/35/65/18/1348356518.db2.gz	HJTHQYASODZMFD-UHFFFAOYSA-N	0	3	346.421	3.360	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3c(C)noc3C)cccc2C1	ZINC001051279368	1348415451	/nfs/dbraw/zinc/41/54/51/1348415451.db2.gz	APWOQWVEZAKBKN-UHFFFAOYSA-N	0	3	339.439	3.156	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)[C@@H]3C[C@H]3C3CCC3)cccc2C1	ZINC001051302552	1348425919	/nfs/dbraw/zinc/42/59/19/1348425919.db2.gz	YEOYAEARFOAFGR-LEWJYISDSA-N	0	3	336.479	3.120	20	30		EGEDHN
C=C(C)CCN1CCN([C@@H]2CCN(C(=O)CC3=CCCCC3)C2)CC1	ZINC001051997711	1348495500	/nfs/dbraw/zinc/49/55/00/1348495500.db2.gz	GXBLULVXKLANAV-HXUWFJFHSA-N	0	3	345.531	3.062	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@H](NC(=O)c3ccsc3)CC2)c1	ZINC001052180244	1348510444	/nfs/dbraw/zinc/51/04/44/1348510444.db2.gz	XUXSLJHBTKBHAW-SFHVURJKSA-N	0	3	339.464	3.404	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2c(C)occ2C(F)(F)F)CC1	ZINC001052567333	1348581243	/nfs/dbraw/zinc/58/12/43/1348581243.db2.gz	YRVVPTBXYNALOJ-CYBMUJFWSA-N	0	3	342.361	3.214	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc(C)c(Cl)c2F)CC1	ZINC001052586431	1348587359	/nfs/dbraw/zinc/58/73/59/1348587359.db2.gz	JHNNNNFHBZRUCH-AWEZNQCLSA-N	0	3	336.838	3.395	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2nc(Cl)sc2Cl)CC1	ZINC001052621676	1348598564	/nfs/dbraw/zinc/59/85/64/1348598564.db2.gz	GCLNDYADQKMANL-JTQLQIEISA-N	0	3	346.283	3.058	20	30		EGEDHN
C[C@]1(C(=O)N[C@H]2CCCN(Cc3cccc(C#N)c3)CC2)C=CCC1	ZINC001052636648	1348605507	/nfs/dbraw/zinc/60/55/07/1348605507.db2.gz	VPERLFROWCWZDJ-FPOVZHCZSA-N	0	3	337.467	3.385	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccccc2-n2cccc2)CC1	ZINC001052677685	1348626565	/nfs/dbraw/zinc/62/65/65/1348626565.db2.gz	RBPUNSLTKHSSNB-SFHVURJKSA-N	0	3	335.451	3.085	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc(C(C)C)nc2CC)CC1	ZINC001052718419	1348647182	/nfs/dbraw/zinc/64/71/82/1348647182.db2.gz	ADZWIZLVRZPYHT-QGZVFWFLSA-N	0	3	341.499	3.375	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)Cc2ccc(C(C)(C)C)cc2)CC1	ZINC001052751586	1348662184	/nfs/dbraw/zinc/66/21/84/1348662184.db2.gz	WGPVYRGOKHJABX-LJQANCHMSA-N	0	3	326.484	3.131	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ncoc2-c2cccs2)CC1	ZINC001052798909	1348683730	/nfs/dbraw/zinc/68/37/30/1348683730.db2.gz	YZHIBTOETXCOIB-CQSZACIVSA-N	0	3	343.452	3.011	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc(O[C@H](C)CC)cc2)CC1	ZINC001052849059	1348700804	/nfs/dbraw/zinc/70/08/04/1348700804.db2.gz	LFIRRCPMGLSGTK-IEBWSBKVSA-N	0	3	342.483	3.472	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cnc(C(C)(C)C)s2)CC1	ZINC001052962200	1348773800	/nfs/dbraw/zinc/77/38/00/1348773800.db2.gz	XPLAORAKKJQWJT-CQSZACIVSA-N	0	3	333.501	3.048	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)Cc2cccc(OC(C)C)c2)CC1	ZINC001052968279	1348779407	/nfs/dbraw/zinc/77/94/07/1348779407.db2.gz	XTKFPJLXFPJTCT-IBGZPJMESA-N	0	3	342.483	3.010	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccc(F)cc2)C1	ZINC001053063433	1348875050	/nfs/dbraw/zinc/87/50/50/1348875050.db2.gz	MUONUBLDVMGPFF-PKOBYXMFSA-N	0	3	328.431	3.166	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(C)nc2)C1	ZINC001053070383	1348884274	/nfs/dbraw/zinc/88/42/74/1348884274.db2.gz	YEQDVWFABTZWQG-PMACEKPBSA-N	0	3	339.483	3.120	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2csnc2C)C1	ZINC001053075474	1348893180	/nfs/dbraw/zinc/89/31/80/1348893180.db2.gz	HADSMTQTTZYVED-AEFFLSMTSA-N	0	3	345.512	3.182	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2csnc2C)C1	ZINC001053075476	1348893680	/nfs/dbraw/zinc/89/36/80/1348893680.db2.gz	HADSMTQTTZYVED-SJLPKXTDSA-N	0	3	345.512	3.182	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cc[nH]c2C)C1	ZINC001053076791	1348895166	/nfs/dbraw/zinc/89/51/66/1348895166.db2.gz	UBSBQVXOWBRLBU-PKOBYXMFSA-N	0	3	327.472	3.053	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2nc(C)sc2C)C1	ZINC001053088199	1348913267	/nfs/dbraw/zinc/91/32/67/1348913267.db2.gz	QWOQDUPJYCMFMO-DLBZAZTESA-N	0	3	345.512	3.100	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cocc2C)C1	ZINC001053093261	1348920811	/nfs/dbraw/zinc/92/08/11/1348920811.db2.gz	XKODKOBPCKJQTI-MJGOQNOKSA-N	0	3	328.456	3.318	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2csc(C)c2)C1	ZINC001053100301	1348933801	/nfs/dbraw/zinc/93/38/01/1348933801.db2.gz	GLSWQYGPVKOICW-AEFFLSMTSA-N	0	3	330.497	3.396	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(OC)o2)C1	ZINC001053102945	1348936210	/nfs/dbraw/zinc/93/62/10/1348936210.db2.gz	XWEVXXZAEDUDEJ-IRXDYDNUSA-N	0	3	344.455	3.018	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cc(C)c(CC)o2)C1	ZINC001053103638	1348937320	/nfs/dbraw/zinc/93/73/20/1348937320.db2.gz	JNKOVHWCADAFMH-ROUUACIJSA-N	0	3	342.483	3.490	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cc(C)c(CC)o2)C1	ZINC001053103637	1348937678	/nfs/dbraw/zinc/93/76/78/1348937678.db2.gz	JNKOVHWCADAFMH-QZTJIDSGSA-N	0	3	342.483	3.490	20	30		EGEDHN
C=C(C)CCN1Cc2ccccc2C[C@@H]1CNC(=O)c1ccn(C)c1	ZINC001054037574	1349134061	/nfs/dbraw/zinc/13/40/61/1349134061.db2.gz	JXDCYDDJZVYMQO-HXUWFJFHSA-N	0	3	337.467	3.148	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@]3(C2)CCCN(C(=O)c2ccco2)C3)c1	ZINC001054074100	1349146276	/nfs/dbraw/zinc/14/62/76/1349146276.db2.gz	FADUHZIVCREKEP-NRFANRHFSA-N	0	3	349.434	3.280	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc(C)sc1C)C2	ZINC001054160225	1349162320	/nfs/dbraw/zinc/16/23/20/1349162320.db2.gz	YUPHMQFKZJSJSE-IBGZPJMESA-N	0	3	330.497	3.316	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(-c3ccco3)o1)C2	ZINC001054161782	1349164578	/nfs/dbraw/zinc/16/45/78/1349164578.db2.gz	OJYZENHSWGSOFN-HXUWFJFHSA-N	0	3	338.407	3.101	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N[C@@H]1CN(CC=C(C)C)C[C@H]1C	ZINC001079977876	1357447217	/nfs/dbraw/zinc/44/72/17/1357447217.db2.gz	OXHYWKPQEMQRAI-SJLPKXTDSA-N	0	3	328.456	3.268	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H]1CC[C@@H]3C[C@@H]3CC1)C2	ZINC001054168846	1349170779	/nfs/dbraw/zinc/17/07/79/1349170779.db2.gz	JGRLTPGKDRVAEX-HUUJSLGLSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(C)nc1C(C)C)C2	ZINC001054169825	1349171430	/nfs/dbraw/zinc/17/14/30/1349171430.db2.gz	HORVBZHHJFUNEH-OAQYLSRUSA-N	0	3	339.483	3.075	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc3cc(C)ccc3[nH]1)C2	ZINC001054173627	1349174211	/nfs/dbraw/zinc/17/42/11/1349174211.db2.gz	DFMSZSYRTYXUOE-NRFANRHFSA-N	0	3	335.451	3.038	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(C)c(F)c1F)C2	ZINC001054200759	1349202799	/nfs/dbraw/zinc/20/27/99/1349202799.db2.gz	JKLWBJPSDXLLSI-HXUWFJFHSA-N	0	3	346.421	3.225	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)Cc1ccc(CC)cc1)C2	ZINC001054204976	1349207196	/nfs/dbraw/zinc/20/71/96/1349207196.db2.gz	HMFAXQPWQWXSIC-QFIPXVFZSA-N	0	3	338.495	3.129	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(C3CC3)s1)C2	ZINC001054227666	1349221530	/nfs/dbraw/zinc/22/15/30/1349221530.db2.gz	QFEZNXWHQULZEB-LJQANCHMSA-N	0	3	328.481	3.187	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@H](C)c1ccc(C)cc1)C2	ZINC001054227530	1349221798	/nfs/dbraw/zinc/22/17/98/1349221798.db2.gz	IUXIDHOIDPKWTF-KNQAVFIVSA-N	0	3	338.495	3.436	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1c(C)csc1Cl)C2	ZINC001054233617	1349225824	/nfs/dbraw/zinc/22/58/24/1349225824.db2.gz	ORRKFSYYGXCOHZ-QGZVFWFLSA-N	0	3	336.888	3.271	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@H](C)c1ccccc1C)C2	ZINC001054243504	1349237711	/nfs/dbraw/zinc/23/77/11/1349237711.db2.gz	JBRRQAHMGGPIDJ-DENIHFKCSA-N	0	3	338.495	3.436	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(C(C)(F)F)cc1)C2	ZINC001054250668	1349246108	/nfs/dbraw/zinc/24/61/08/1349246108.db2.gz	YTOFQXOLFOLEGD-HXUWFJFHSA-N	0	3	346.421	3.360	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@@H]3C[C@H]3c3ccncc3)cc2C1	ZINC001054265949	1349264180	/nfs/dbraw/zinc/26/41/80/1349264180.db2.gz	FCJUGQWDFPGUQB-LEWJYISDSA-N	0	3	347.462	3.393	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@H]3CCC[C@@H]3OC)cc2C1	ZINC001054271312	1349271422	/nfs/dbraw/zinc/27/14/22/1349271422.db2.gz	KWDFMCBXDACMMB-OALUTQOASA-N	0	3	328.456	3.010	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cccn4nccc34)cc2C1	ZINC001054272862	1349271968	/nfs/dbraw/zinc/27/19/68/1349271968.db2.gz	IOXVNVXNHVHGGY-UHFFFAOYSA-N	0	3	346.434	3.156	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@@H]3C[C@H](C)CO3)cc2C1	ZINC001054274638	1349274813	/nfs/dbraw/zinc/27/48/13/1349274813.db2.gz	NLCJVDVTAQSHQL-KXBFYZLASA-N	0	3	328.456	3.010	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3ccc4n[nH]cc4c3)cc2C1	ZINC001054278503	1349279162	/nfs/dbraw/zinc/27/91/62/1349279162.db2.gz	DDHAUNAUAAUTHP-UHFFFAOYSA-N	0	3	346.434	3.385	20	30		EGEDHN
C[C@H]1CN(C(=O)CC(C)(C)C)C[C@@H]1NCc1ccc(C#N)c(F)c1	ZINC001054387251	1349344789	/nfs/dbraw/zinc/34/47/89/1349344789.db2.gz	CIJSUMHAORIFSM-GUYCJALGSA-N	0	3	331.435	3.070	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2C(C)(C)C2(C)C)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054543488	1349392928	/nfs/dbraw/zinc/39/29/28/1349392928.db2.gz	VQLMIXREAOWBIE-DOMZBBRYSA-N	0	3	345.512	3.238	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@@H](NCc2ccnc(Cl)c2)C1	ZINC001054970409	1349531310	/nfs/dbraw/zinc/53/13/10/1349531310.db2.gz	CIMLYWNLKAPVCM-HIFRSBDPSA-N	0	3	335.879	3.274	20	30		EGEDHN
CCC1(C(=O)N2C[C@@H](C)[C@H](NCc3ccc(C#N)s3)C2)CCC1	ZINC001054987398	1349539779	/nfs/dbraw/zinc/53/97/79/1349539779.db2.gz	WPGBLYOSPVCYIG-CZUORRHYSA-N	0	3	331.485	3.137	20	30		EGEDHN
C[C@H]1CN(C(=O)CC2CC(C)(C)C2)C[C@H]1NCc1ccc(C#N)s1	ZINC001055001384	1349545681	/nfs/dbraw/zinc/54/56/81/1349545681.db2.gz	HEGZMQZIWKSRRX-SUMWQHHRSA-N	0	3	345.512	3.383	20	30		EGEDHN
C=C(C)CCN1C[C@@H](C)[C@H](NC(=O)c2cnc([C@@H]3CCCO3)s2)C1	ZINC001080579272	1357684342	/nfs/dbraw/zinc/68/43/42/1357684342.db2.gz	XOJBAACYJMOQMX-KFWWJZLASA-N	0	3	349.500	3.011	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1cc(Cl)c(Cl)n1C	ZINC001085627322	1358645289	/nfs/dbraw/zinc/64/52/89/1358645289.db2.gz	DSVLTLPKPHADBL-NSHDSACASA-N	0	3	330.259	3.054	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)C2CCC(C)(C)CC2)C1	ZINC001070435387	1354348497	/nfs/dbraw/zinc/34/84/97/1354348497.db2.gz	FDBSGNHPEIIYQC-INIZCTEOSA-N	0	3	344.503	3.218	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1cccc(C)c1F)C[C@H](C)O2	ZINC001071172097	1354487409	/nfs/dbraw/zinc/48/74/09/1354487409.db2.gz	XIRMZBRLODHNGN-OXJNMPFZSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C(C)(C)C(C)(C)C)C[C@H](C)O2	ZINC001071197202	1354498984	/nfs/dbraw/zinc/49/89/84/1354498984.db2.gz	OOZLEEUDPYUXGW-JXFKEZNVSA-N	0	3	336.520	3.327	20	30		EGEDHN
C=Cc1ccc(C(=O)N2C[C@@H](C)O[C@@]3(CCN(CC(=C)C)C3)C2)cc1	ZINC001071209400	1354506768	/nfs/dbraw/zinc/50/67/68/1354506768.db2.gz	JIUADVGEWOSQOJ-DYESRHJHSA-N	0	3	340.467	3.211	20	30		EGEDHN
C#CCCN1CC[C@]2(C1)CN(C(=O)CC1CCCCCC1)C[C@H](C)O2	ZINC001071215392	1354510616	/nfs/dbraw/zinc/51/06/16/1354510616.db2.gz	AZQJVPHOWUMSNF-RXVVDRJESA-N	0	3	346.515	3.062	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1oc(CC)cc1C)C[C@H](C)O2	ZINC001071227623	1354514770	/nfs/dbraw/zinc/51/47/70/1354514770.db2.gz	ICPAXTMAMAYGNT-OXJNMPFZSA-N	0	3	346.471	3.032	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C1(C)C(C)(C)C1(C)C)C[C@@H](C)O2	ZINC001071248794	1354527374	/nfs/dbraw/zinc/52/73/74/1354527374.db2.gz	SYBBDIZFTFYPML-IIBYNOLFSA-N	0	3	348.531	3.327	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ncn3cc(Cl)ccc23)CC[C@H]1C	ZINC001071516792	1354738959	/nfs/dbraw/zinc/73/89/59/1354738959.db2.gz	BQKSHXBJMFBGFZ-HIFRSBDPSA-N	0	3	346.862	3.147	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cccc(OCCC)c2)CC[C@H]1C	ZINC001071544421	1354757564	/nfs/dbraw/zinc/75/75/64/1354757564.db2.gz	YPTFFKMRZAVSKL-SJLPKXTDSA-N	0	3	328.456	3.081	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cccc(NC(=O)CC)c2)CC[C@@H]1C	ZINC001071544320	1354758020	/nfs/dbraw/zinc/75/80/20/1354758020.db2.gz	WWOYUZLKXXYOSJ-MAUKXSAKSA-N	0	3	343.471	3.194	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCCC[C@H](NCc2cccc(OC)n2)C1	ZINC001088359669	1359843545	/nfs/dbraw/zinc/84/35/45/1359843545.db2.gz	DMEZRVBUFKMJPR-KRWDZBQOSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc3nc(C)oc3c2)CC[C@H]1C	ZINC001071588293	1354780587	/nfs/dbraw/zinc/78/05/87/1354780587.db2.gz	HVOVNGBDZVNXRY-CZUORRHYSA-N	0	3	327.428	3.295	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2[nH]nc3ccc(C)cc32)CC[C@@H]1C	ZINC001071642132	1354821803	/nfs/dbraw/zinc/82/18/03/1354821803.db2.gz	KXRJQDUTRPODIL-GJZGRUSLSA-N	0	3	326.444	3.030	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2nc3ccccc3cc2C)CC[C@@H]1C	ZINC001071696222	1354857339	/nfs/dbraw/zinc/85/73/39/1354857339.db2.gz	XHCRSSJAFRSQAG-WMZOPIPTSA-N	0	3	335.451	3.149	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccncc2OC(C)C)CC[C@@H]1C	ZINC001071701866	1354861182	/nfs/dbraw/zinc/86/11/82/1354861182.db2.gz	PLUUSCJIEYVNGY-JKSUJKDBSA-N	0	3	331.460	3.028	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc(Cl)c(Cl)[nH]2)CC[C@@H]1C	ZINC001071714894	1354872105	/nfs/dbraw/zinc/87/21/05/1354872105.db2.gz	BIFBWIJBCHGYKJ-WDEREUQCSA-N	0	3	330.259	3.480	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CC[C@@H](C)N(CCOC3CCC3)C2)CC1	ZINC001071794421	1354938838	/nfs/dbraw/zinc/93/88/38/1354938838.db2.gz	CDEBZVORUMBDPT-SJLPKXTDSA-N	0	3	334.504	3.271	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cccc(N3CC=CC3)c2)CC[C@H]1C	ZINC001071854929	1354982129	/nfs/dbraw/zinc/98/21/29/1354982129.db2.gz	IIBLKMSROUHWPV-MJGOQNOKSA-N	0	3	339.483	3.222	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2c[nH]c(=O)c3ccccc23)CC[C@@H]1C	ZINC001071871443	1354995867	/nfs/dbraw/zinc/99/58/67/1354995867.db2.gz	ICCMJWOSUNULOP-LSDHHAIUSA-N	0	3	339.439	3.099	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2snnc2C(C)C)CC[C@@H]1C	ZINC001071919675	1355024402	/nfs/dbraw/zinc/02/44/02/1355024402.db2.gz	GCVKDUOYRFAKOT-KBPBESRZSA-N	0	3	336.505	3.210	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cccc(N3CCCC3)c2)CC[C@@H]1C	ZINC001071930514	1355030308	/nfs/dbraw/zinc/03/03/08/1355030308.db2.gz	GBSIFKZPAKTJFK-PKOBYXMFSA-N	0	3	341.499	3.446	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cnn(CC3CCCC3)c2)CC[C@H]1C	ZINC001071931694	1355032375	/nfs/dbraw/zinc/03/23/75/1355032375.db2.gz	YXYPCENWMOIFBD-VQIMIIECSA-N	0	3	344.503	3.232	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cccc(-n3ccnc3)c2)CC[C@@H]1C	ZINC001071954424	1355040102	/nfs/dbraw/zinc/04/01/02/1355040102.db2.gz	OOHSGBXCVYYFSO-FUHWJXTLSA-N	0	3	338.455	3.031	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cnn(CCCC)c2C)CC[C@H]1C	ZINC001071976614	1355055146	/nfs/dbraw/zinc/05/51/46/1355055146.db2.gz	FQLCEUITVNITFM-WBVHZDCISA-N	0	3	332.492	3.150	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccnc(OC(C)C)c2)CC[C@@H]1C	ZINC001071986321	1355060034	/nfs/dbraw/zinc/06/00/34/1355060034.db2.gz	SGHLJVXEHWLPRL-RDJZCZTQSA-N	0	3	331.460	3.028	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cccc(NC(C)=O)c2C)CC[C@@H]1C	ZINC001071993598	1355063772	/nfs/dbraw/zinc/06/37/72/1355063772.db2.gz	UPCSSSZBIABSQB-YOEHRIQHSA-N	0	3	343.471	3.112	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc(C)c(F)cc2Cl)CC[C@@H]1C	ZINC001072028798	1355090214	/nfs/dbraw/zinc/09/02/14/1355090214.db2.gz	BWXVNATZJOBFKH-UONOGXRCSA-N	0	3	336.838	3.394	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc3ncsc3c2)CC[C@@H]1C	ZINC001072043870	1355100282	/nfs/dbraw/zinc/10/02/82/1355100282.db2.gz	FWSSBEWAKWPFCV-ZFWWWQNUSA-N	0	3	329.469	3.455	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(OCC)c(OC)c2)CC[C@@H]1C	ZINC001072058913	1355107641	/nfs/dbraw/zinc/10/76/41/1355107641.db2.gz	UWYAEPUJVMIABH-RDJZCZTQSA-N	0	3	346.471	3.253	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(F)c3occc32)CC[C@H]1C	ZINC001072089044	1355122162	/nfs/dbraw/zinc/12/21/62/1355122162.db2.gz	VEALTQHCDCQVES-KGLIPLIRSA-N	0	3	328.387	3.178	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2cccc(OCC)c2)CC[C@@H]1C	ZINC001072101463	1355130686	/nfs/dbraw/zinc/13/06/86/1355130686.db2.gz	HBHGQCDRPFRERQ-WMZOPIPTSA-N	0	3	330.472	3.173	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@@H](C)[C@@H](CNCc2ccccc2C#N)C1	ZINC001072252255	1355209126	/nfs/dbraw/zinc/20/91/26/1355209126.db2.gz	RTYGPSLJLXTKDK-QAPCUYQASA-N	0	3	343.446	3.396	20	30		EGEDHN
C[C@@H]1CCN(C(=O)CC2(C)CC2)C[C@H]1CNCc1ccccc1C#N	ZINC001072322904	1355236713	/nfs/dbraw/zinc/23/67/13/1355236713.db2.gz	QAHLHUDOBLLTHJ-VQIMIIECSA-N	0	3	339.483	3.323	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)C=C4CCCCC4)C3)C2)c1	ZINC001072527346	1355320051	/nfs/dbraw/zinc/32/00/51/1355320051.db2.gz	OOHQEBHVTORZTL-UHFFFAOYSA-N	0	3	349.478	3.483	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)C45CCC(CC4)C5)C3)C2)c1	ZINC001072857267	1355467989	/nfs/dbraw/zinc/46/79/89/1355467989.db2.gz	RJLYABLPMXMYME-UHFFFAOYSA-N	0	3	349.478	3.173	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3cc4c(s3)CC[C@H](C)C4)C2)C1	ZINC001073420110	1355769294	/nfs/dbraw/zinc/76/92/94/1355769294.db2.gz	NNARYGIRBCZDGR-AWEZNQCLSA-N	0	3	330.497	3.207	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CN(C(=O)C4CCC=CCC4)C3)C2)cc1	ZINC001073437107	1355777819	/nfs/dbraw/zinc/77/78/19/1355777819.db2.gz	IWTNMAOOYUWTCL-UHFFFAOYSA-N	0	3	349.478	3.339	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2ccc(C)cc2Cl)C1	ZINC001073777555	1355894078	/nfs/dbraw/zinc/89/40/78/1355894078.db2.gz	UYNAIYRAUMTNSH-HNNXBMFYSA-N	0	3	336.863	3.045	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2c(C)cc(C)cc2C)C1	ZINC001073880962	1355937457	/nfs/dbraw/zinc/93/74/57/1355937457.db2.gz	YGCSWNSNWMWCRT-GOSISDBHSA-N	0	3	330.472	3.009	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2c(C)cc(C)cc2C)C1	ZINC001073880963	1355938320	/nfs/dbraw/zinc/93/83/20/1355938320.db2.gz	YGCSWNSNWMWCRT-SFHVURJKSA-N	0	3	330.472	3.009	20	30		EGEDHN
C#CCCN1CCCO[C@H](CNC(=O)c2ccc([C@H](C)CC)cc2)C1	ZINC001073899379	1355945744	/nfs/dbraw/zinc/94/57/44/1355945744.db2.gz	RIYRHUOULCMQQL-YLJYHZDGSA-N	0	3	342.483	3.044	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2ccc(C(C)C)s2)C1	ZINC001073906176	1355950376	/nfs/dbraw/zinc/95/03/76/1355950376.db2.gz	TXJCDERHMSBTEB-HNNXBMFYSA-N	0	3	336.501	3.268	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCCN1C(=O)C(C)(C)F	ZINC001073927290	1355961749	/nfs/dbraw/zinc/96/17/49/1355961749.db2.gz	CMHRWAAESHCBHK-QGZVFWFLSA-N	0	3	331.435	3.119	20	30		EGEDHN
CN(Cc1ccc(F)cc1)C[C@H]1CCCCN1C(=O)C#CC1CC1	ZINC001074012615	1356034860	/nfs/dbraw/zinc/03/48/60/1356034860.db2.gz	DMLONOKVPSZIPJ-LJQANCHMSA-N	0	3	328.431	3.052	20	30		EGEDHN
Cc1cc(F)ccc1CN(C)C[C@H]1CCCCN1C(=O)C#CC1CC1	ZINC001074012879	1356035424	/nfs/dbraw/zinc/03/54/24/1356035424.db2.gz	RQGSMUIBMVIMOP-HXUWFJFHSA-N	0	3	342.458	3.360	20	30		EGEDHN
C=C[C@@H](C(=O)N1CC[C@H](NCc2cncs2)[C@@H]1C)c1ccccc1	ZINC001075125350	1356319786	/nfs/dbraw/zinc/31/97/86/1356319786.db2.gz	ZGKQDFACRNLCQJ-QGTPRVQTSA-N	0	3	341.480	3.192	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccoc2)CC[C@H]1CNCc1ccccc1C#N	ZINC001075224670	1356350304	/nfs/dbraw/zinc/35/03/04/1356350304.db2.gz	XNWRAOUWDDMZNN-WBVHZDCISA-N	0	3	337.423	3.039	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3oc4ccc(F)cc4c3C)[C@@H]2C1	ZINC001075883066	1356438904	/nfs/dbraw/zinc/43/89/04/1356438904.db2.gz	SRJKLRIJUZVBCE-WMLDXEAASA-N	0	3	340.398	3.050	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3c3c(F)cccc3F)[C@@H]2C1	ZINC001076224110	1356523813	/nfs/dbraw/zinc/52/38/13/1356523813.db2.gz	DVADPOOEXJQUPZ-LUXYFRNMSA-N	0	3	346.421	3.177	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3cc(C(C)(C)C)oc3C)[C@@H]2C1	ZINC001076293191	1356539388	/nfs/dbraw/zinc/53/93/88/1356539388.db2.gz	NJJKJADOUQGHCJ-DOTOQJQBSA-N	0	3	328.456	3.055	20	30		EGEDHN
C#CCC1(C(=O)NC[C@@H]2CCC(C)(C)CN2CCOC(C)C)CCC1	ZINC001099106840	1363625835	/nfs/dbraw/zinc/62/58/35/1363625835.db2.gz	QBMGYAJBBYBPIV-SFHVURJKSA-N	0	3	348.531	3.212	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2cc3occc3s2)C[C@H]1C(F)(F)F	ZINC001099306640	1363741226	/nfs/dbraw/zinc/74/12/26/1363741226.db2.gz	NTMPSKVMJRERQN-NXEZZACHSA-N	0	3	344.358	3.273	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2C[C@@H](NC(=O)CC3CC3)C23CCC3)c(F)c1	ZINC001078531566	1356998803	/nfs/dbraw/zinc/99/88/03/1356998803.db2.gz	OHTDSUXQKNZEEX-QZTJIDSGSA-N	0	3	341.430	3.014	20	30		EGEDHN
CC1(C(=O)N[C@H]2C[C@H](NCc3ccc(C#N)cc3F)C23CCC3)CC1	ZINC001078628133	1357040528	/nfs/dbraw/zinc/04/05/28/1357040528.db2.gz	AYHVUNPPQCKMRR-IRXDYDNUSA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc3ncccc3o2)C12CCC2	ZINC001078683882	1357053710	/nfs/dbraw/zinc/05/37/10/1357053710.db2.gz	XXABNACDDOOCPF-JKSUJKDBSA-N	0	3	345.830	3.211	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2cc3ncccc3o2)C12CCC2	ZINC001078683881	1357053797	/nfs/dbraw/zinc/05/37/97/1357053797.db2.gz	XXABNACDDOOCPF-HZPDHXFCSA-N	0	3	345.830	3.211	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2C[C@H](NCC(=C)Cl)C23CCC3)cc1	ZINC001078698713	1357060492	/nfs/dbraw/zinc/06/04/92/1357060492.db2.gz	UOVDZTWWVGCTEP-DLBZAZTESA-N	0	3	328.843	3.051	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cnoc2C(C)C)C12CCC2	ZINC001078768275	1357074542	/nfs/dbraw/zinc/07/45/42/1357074542.db2.gz	ODURMFBBRQGHBZ-UONOGXRCSA-N	0	3	337.851	3.181	20	30		EGEDHN
C#CCCN1C[C@@H](C)[C@H](NC(=O)C(C)(C)c2ccccc2Cl)C1	ZINC001080811725	1357741158	/nfs/dbraw/zinc/74/11/58/1357741158.db2.gz	UGCKUIRKLZIRLI-RHSMWYFYSA-N	0	3	332.875	3.077	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2ccc(CCCC)cc2)[C@H](OC)C1	ZINC001081918031	1357894407	/nfs/dbraw/zinc/89/44/07/1357894407.db2.gz	FPVMWGYDJFDTEH-RTBURBONSA-N	0	3	330.472	3.034	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2ccc(C(C)(C)C)cc2)[C@H](OC)C1	ZINC001082340319	1358019502	/nfs/dbraw/zinc/01/95/02/1358019502.db2.gz	GYBHPJJXIMJZIW-RTBURBONSA-N	0	3	344.499	3.379	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@H]2CCCC23CC3)C[C@H]1NCc1ccc(C#N)s1	ZINC001082591403	1358064865	/nfs/dbraw/zinc/06/48/65/1358064865.db2.gz	MXSOZBMJRRIHIC-KBRIMQKVSA-N	0	3	343.496	3.137	20	30		EGEDHN
C=C[C@@H](C(=O)N1C[C@@H](C)[C@H](NCc2cncs2)C1)c1ccccc1	ZINC001082937351	1358106110	/nfs/dbraw/zinc/10/61/10/1358106110.db2.gz	SQYXPSRAMNNDTP-ZTFGCOKTSA-N	0	3	341.480	3.049	20	30		EGEDHN
C=C[C@H](C(=O)N1C[C@@H](C)[C@H](NCc2cncs2)C1)c1ccccc1	ZINC001082937350	1358106249	/nfs/dbraw/zinc/10/62/49/1358106249.db2.gz	SQYXPSRAMNNDTP-FHLIZLRMSA-N	0	3	341.480	3.049	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)c3ccc(C4CCC4)cc3)[C@H]2C1	ZINC001083100036	1358119159	/nfs/dbraw/zinc/11/91/59/1358119159.db2.gz	RFNJRODUIQBTRB-VQTJNVASSA-N	0	3	340.467	3.055	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)CC3CCC(C)(C)CC3)[C@H]2C1	ZINC001083293978	1358128899	/nfs/dbraw/zinc/12/88/99/1358128899.db2.gz	HHPGJDMSORXZBL-ZWKOTPCHSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)c3ccc([C@@H](C)CC)cc3)[C@H]2C1	ZINC001083284651	1358128907	/nfs/dbraw/zinc/12/89/07/1358128907.db2.gz	HHADBJMJDOTOTR-FFZOFVMBSA-N	0	3	342.483	3.301	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CN([C@H](CC)c3ccccc3)C[C@@H]2O)CC1	ZINC001083751159	1358134490	/nfs/dbraw/zinc/13/44/90/1358134490.db2.gz	IWFNNKBJALWAHT-AQNXPRMDSA-N	0	3	342.483	3.045	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3conc3C3CCCC3)[C@@H]2C1	ZINC001084399200	1358208249	/nfs/dbraw/zinc/20/82/49/1358208249.db2.gz	BHBRESSKJDTLFZ-NVXWUHKLSA-N	0	3	329.444	3.055	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)[C@H](Cc3ccccc3)C(C)C)[C@@H]2C1	ZINC001084657792	1358271223	/nfs/dbraw/zinc/27/12/23/1358271223.db2.gz	OSHLYDUXXPMRFM-NJDAHSKKSA-N	0	3	338.495	3.057	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)Cc3ccc(C(C)(C)C)cc3)[C@@H]2C1	ZINC001084686444	1358279461	/nfs/dbraw/zinc/27/94/61/1358279461.db2.gz	FFVHPXGBBNKLOF-UYAOXDASSA-N	0	3	338.495	3.083	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)C(C)(C)c3ccccc3Cl)[C@@H]2C1	ZINC001084785863	1358309087	/nfs/dbraw/zinc/30/90/87/1358309087.db2.gz	JBPAYEPWKJLLDM-CRAIPNDOSA-N	0	3	344.886	3.174	20	30		EGEDHN
CC(C)P(CCNC(=O)[C@H](C#N)Cc1ccc(O)cc1)C(C)C	ZINC001183615798	1387324751	/nfs/dbraw/zinc/32/47/51/1387324751.db2.gz	HDGVELMVVAUADS-INIZCTEOSA-N	0	3	334.400	3.489	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CCN(C(=O)C[C@H]4C=CCC4)C[C@@H]32)c1	ZINC001084886945	1358339891	/nfs/dbraw/zinc/33/98/91/1358339891.db2.gz	KXSOXHXQSVZHFK-WMQCIHAUSA-N	0	3	349.478	3.337	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@H](CC)Oc3ccccc3C)C[C@@H]21	ZINC001085046149	1358376698	/nfs/dbraw/zinc/37/66/98/1358376698.db2.gz	BMZBGSJWHCETRO-QYZOEREBSA-N	0	3	342.483	3.261	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@H](CC)Cc3ccccc3)C[C@@H]21	ZINC001085047286	1358377780	/nfs/dbraw/zinc/37/77/80/1358377780.db2.gz	HMEXADRMWNUMAB-AQNXPRMDSA-N	0	3	326.484	3.364	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccc2c(c1)CCOC2	ZINC001085270687	1358447935	/nfs/dbraw/zinc/44/79/35/1358447935.db2.gz	ROHZSDPBDOTGPU-QZTJIDSGSA-N	0	3	348.874	3.142	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCC[C@H]2NCc2c(C)noc2CC)C1	ZINC001085325260	1358468214	/nfs/dbraw/zinc/46/82/14/1358468214.db2.gz	FPSZWSLAHZAMQP-IAGOWNOFSA-N	0	3	345.487	3.419	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1CCOc2ccccc21	ZINC001085365390	1358480214	/nfs/dbraw/zinc/48/02/14/1358480214.db2.gz	UTHPPXKAVCGHLE-BRWVUGGUSA-N	0	3	348.874	3.322	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1csc(C2CC2)n1	ZINC001085437884	1358500338	/nfs/dbraw/zinc/50/03/38/1358500338.db2.gz	GOHVTFOZABWKAM-CHWSQXEVSA-N	0	3	339.892	3.404	20	30		EGEDHN
C=CCOc1ccc(C(=O)N(C)C[C@H]2CCN2CC[C@H](C)F)cc1	ZINC001085679005	1358683248	/nfs/dbraw/zinc/68/32/48/1358683248.db2.gz	YGSZYROAQWOWBQ-DOTOQJQBSA-N	0	3	334.435	3.146	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)[C@H]1CCc2c1cccc2Cl	ZINC001085726122	1358713946	/nfs/dbraw/zinc/71/39/46/1358713946.db2.gz	PMURCKFREFKNGF-YOEHRIQHSA-N	0	3	332.875	3.479	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1noc2c1CCCCC2	ZINC001085849119	1358818003	/nfs/dbraw/zinc/81/80/03/1358818003.db2.gz	PNMCZMFMEFKUDI-OAHLLOKOSA-N	0	3	331.460	3.056	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1cc(-c2ccccc2)ccn1	ZINC001085892291	1358851326	/nfs/dbraw/zinc/85/13/26/1358851326.db2.gz	VMPNUKAQVKMIIR-LJQANCHMSA-N	0	3	335.451	3.471	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccnc(C2CCCC2)n1	ZINC001085900137	1358858157	/nfs/dbraw/zinc/85/81/57/1358858157.db2.gz	XLACUINOTKKGEY-KRWDZBQOSA-N	0	3	342.487	3.247	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc(C)n(CC3CC3)c2C)C1	ZINC001086254247	1359043237	/nfs/dbraw/zinc/04/32/37/1359043237.db2.gz	QDWSZHVLZKBJEB-CALCHBBNSA-N	0	3	349.906	3.365	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@@H]2CCc3ccccc3C2)C1	ZINC001086490889	1359117625	/nfs/dbraw/zinc/11/76/25/1359117625.db2.gz	GYVWKHILHHVJMH-ZTFGCOKTSA-N	0	3	332.875	3.028	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc(C)n(CC3CC3)c2C)C1	ZINC001086534613	1359135374	/nfs/dbraw/zinc/13/53/74/1359135374.db2.gz	QDWSZHVLZKBJEB-QAQDUYKDSA-N	0	3	349.906	3.365	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2ccccc2C)C1	ZINC001086572928	1359151971	/nfs/dbraw/zinc/15/19/71/1359151971.db2.gz	UMZRWBIAMSKCEI-LEWJYISDSA-N	0	3	332.447	3.216	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2cc[nH]c2C2CC2)C1	ZINC001086606209	1359162181	/nfs/dbraw/zinc/16/21/81/1359162181.db2.gz	RNMDGLBRBUTJEO-VQTJNVASSA-N	0	3	347.462	3.113	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)[C@H](C)c2ccccc2)C1	ZINC001086620277	1359166116	/nfs/dbraw/zinc/16/61/16/1359166116.db2.gz	IYNBIOAGPPKUDR-BVYCBKJFSA-N	0	3	346.474	3.398	20	30		EGEDHN
C=C(Br)CN[C@@H]1CC[C@H](CNC(=O)[C@@H]2CCC2(C)C)C1	ZINC001086779628	1359199767	/nfs/dbraw/zinc/19/97/67/1359199767.db2.gz	UGBFTHBUGHSOEA-MJBXVCDLSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](CNCc2nc(C)c(C)s2)[C@H](C)C1	ZINC001184017978	1387382467	/nfs/dbraw/zinc/38/24/67/1387382467.db2.gz	CSZRWYBOBANZRW-CJNGLKHVSA-N	0	3	335.517	3.300	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc(C)cs3)C2)CC1	ZINC001086921383	1359248170	/nfs/dbraw/zinc/24/81/70/1359248170.db2.gz	OBXZXXPSYUMBLL-MRXNPFEDSA-N	0	3	330.497	3.396	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc(C)c(C)n3)C2)CC1	ZINC001086932218	1359256064	/nfs/dbraw/zinc/25/60/64/1359256064.db2.gz	DTZBQZGKUVOBNX-KRWDZBQOSA-N	0	3	339.483	3.038	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc(C)cc3F)C2)CC1	ZINC001086944569	1359265834	/nfs/dbraw/zinc/26/58/34/1359265834.db2.gz	BSWOIOAWRQYFPR-KRWDZBQOSA-N	0	3	342.458	3.474	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)[C@H](C)Cc3ccco3)C2)CC1	ZINC001086947506	1359269287	/nfs/dbraw/zinc/26/92/87/1359269287.db2.gz	AARSQJREGGVZPI-MSOLQXFVSA-N	0	3	342.483	3.185	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc4ccccc4n3)C2)CC1	ZINC001086953653	1359273547	/nfs/dbraw/zinc/27/35/47/1359273547.db2.gz	PBTBVNDWOBPRMH-QGZVFWFLSA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)Cc3ccc(C)s3)C2)CC1	ZINC001086958410	1359279216	/nfs/dbraw/zinc/27/92/16/1359279216.db2.gz	PNQFGGKDLLVCKD-MRXNPFEDSA-N	0	3	344.524	3.325	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)C3CC(C(C)(C)C)C3)C2)CC1	ZINC001086958289	1359279347	/nfs/dbraw/zinc/27/93/47/1359279347.db2.gz	LTOIZIFNYUXGDC-AOCRQIFASA-N	0	3	330.516	3.395	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccoc3CC)C(C)(C)[C@@H]21	ZINC001087284096	1359363489	/nfs/dbraw/zinc/36/34/89/1359363489.db2.gz	BQPYWTJTUWBSNS-KBAYOESNSA-N	0	3	328.456	3.084	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(C(C)C)nc3)C(C)(C)[C@@H]21	ZINC001087290492	1359369707	/nfs/dbraw/zinc/36/97/07/1359369707.db2.gz	CVRUVHYTPKXXAZ-BHIYHBOVSA-N	0	3	339.483	3.057	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc(Cl)cc1F	ZINC001087294065	1359374045	/nfs/dbraw/zinc/37/40/45/1359374045.db2.gz	NRIMGZAEUOCFDB-HYVNUMGLSA-N	0	3	348.849	3.331	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(CC)s3)C(C)(C)[C@H]21	ZINC001087294606	1359375131	/nfs/dbraw/zinc/37/51/31/1359375131.db2.gz	VZBUPBPYXMARCZ-OIISXLGYSA-N	0	3	330.497	3.163	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc4ccsc4[nH]3)C(C)(C)[C@H]21	ZINC001087296786	1359377541	/nfs/dbraw/zinc/37/75/41/1359377541.db2.gz	FWQHEYPXLBWXKP-KBMXLJTQSA-N	0	3	341.480	3.081	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc4ncccc43)C(C)(C)[C@H]21	ZINC001087299050	1359381282	/nfs/dbraw/zinc/38/12/82/1359381282.db2.gz	PDSSRVQQTQQOKB-RLLQIKCJSA-N	0	3	347.462	3.087	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc4[nH]ccc4c3)C(C)(C)[C@H]21	ZINC001087299938	1359382119	/nfs/dbraw/zinc/38/21/19/1359382119.db2.gz	DPAIYWXTTKUFHO-HOJAQTOUSA-N	0	3	349.478	3.410	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc(F)c(Cl)c1	ZINC001087300292	1359382275	/nfs/dbraw/zinc/38/22/75/1359382275.db2.gz	IYDVGFPUYDRAOQ-XOKHGSTOSA-N	0	3	348.849	3.331	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccn(C(C)C)c3C)C(C)(C)[C@H]21	ZINC001087300233	1359382736	/nfs/dbraw/zinc/38/27/36/1359382736.db2.gz	HZGCQKKWPWKEBL-QYZOEREBSA-N	0	3	341.499	3.229	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)CC3CC(C)(C)C3)C(C)(C)[C@H]21	ZINC001087301947	1359385330	/nfs/dbraw/zinc/38/53/30/1359385330.db2.gz	LGPDBYPOBLOLMS-NEWSRXKRSA-N	0	3	330.516	3.441	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)Cc3cccc(Cl)c3)C(C)(C)[C@@H]21	ZINC001087303064	1359385806	/nfs/dbraw/zinc/38/58/06/1359385806.db2.gz	FTNDAMARMKOESJ-BHIYHBOVSA-N	0	3	344.886	3.121	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)Cc3cc(C)cc(C)c3)C(C)(C)[C@H]21	ZINC001087303652	1359386897	/nfs/dbraw/zinc/38/68/97/1359386897.db2.gz	PVGAKKNMDGDIFN-GIVPXCGWSA-N	0	3	338.495	3.084	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc(C)ccc3F)C(C)(C)[C@H]21	ZINC001087304667	1359388384	/nfs/dbraw/zinc/38/83/84/1359388384.db2.gz	FUNOARZKTPUCQW-MNEFBYGVSA-N	0	3	342.458	3.376	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc(Cl)c(F)c3)C(C)(C)[C@H]21	ZINC001087305420	1359390312	/nfs/dbraw/zinc/39/03/12/1359390312.db2.gz	SEDYMEMIRVPIRK-COXVUDFISA-N	0	3	348.849	3.331	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc(F)cc(Cl)c3)C(C)(C)[C@H]21	ZINC001087305465	1359390332	/nfs/dbraw/zinc/39/03/32/1359390332.db2.gz	SUDDTYMQDYFOAM-IKGGRYGDSA-N	0	3	348.849	3.331	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc(C)cc3F)C(C)(C)[C@H]21	ZINC001087305733	1359391178	/nfs/dbraw/zinc/39/11/78/1359391178.db2.gz	XRRNQMWXOHENBM-NEWSRXKRSA-N	0	3	342.458	3.376	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccoc3CCC)C(C)(C)[C@H]21	ZINC001087312168	1359400141	/nfs/dbraw/zinc/40/01/41/1359400141.db2.gz	AAEKSPQHGIBLJB-NJAFHUGGSA-N	0	3	328.456	3.084	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc4cnccc4c3)C(C)(C)[C@@H]21	ZINC001087313661	1359402929	/nfs/dbraw/zinc/40/29/29/1359402929.db2.gz	YQFIHDJGJVEFOH-VAMGGRTRSA-N	0	3	347.462	3.087	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1occ2c1CCCC2	ZINC001087316663	1359407435	/nfs/dbraw/zinc/40/74/35/1359407435.db2.gz	VXJYYWJFOSQESN-NZSAHSFTSA-N	0	3	340.467	3.010	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3c[nH]c4ccc(C)cc34)C(C)(C)[C@H]21	ZINC001087319844	1359412208	/nfs/dbraw/zinc/41/22/08/1359412208.db2.gz	VGXAOEVZQGVJPC-XPGWFJOJSA-N	0	3	349.478	3.328	20	30		EGEDHN
CC1(C(=O)N2C[C@H]3[C@@H](C2)[C@H]2CC[C@@H]3N(CC#Cc3ccccc3)C2)CC1	ZINC001087360488	1359433719	/nfs/dbraw/zinc/43/37/19/1359433719.db2.gz	MIADDHRDLYCLOU-TUFLPTIASA-N	0	3	348.490	3.007	20	30		EGEDHN
C[C@@H](C(=O)NCC1(NCc2cccc(C#N)c2)CC1)C1CCCC1	ZINC001323591179	1387397838	/nfs/dbraw/zinc/39/78/38/1387397838.db2.gz	GVGYMPGHEDYLHR-OAHLLOKOSA-N	0	3	325.456	3.123	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)[C@@H](C)C2CC2)CCN1Cc1ccc(C#N)cc1	ZINC001087533055	1359515164	/nfs/dbraw/zinc/51/51/64/1359515164.db2.gz	KCRWWMMFKNSNEO-ZOCIIQOWSA-N	0	3	325.456	3.073	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)Cc2ccccc2)CCN1Cc1ccc(C#N)cc1	ZINC001087627344	1359563431	/nfs/dbraw/zinc/56/34/31/1359563431.db2.gz	YTYKGYJMDNOHEF-LEWJYISDSA-N	0	3	347.462	3.270	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cnoc2-c2ccco2)[C@H]1CC	ZINC001087628903	1359563842	/nfs/dbraw/zinc/56/38/42/1359563842.db2.gz	RMDXEEAXLFAIQM-LSDHHAIUSA-N	0	3	329.400	3.093	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cc(-c3ccco3)on2)[C@H]1CC	ZINC001087677545	1359585727	/nfs/dbraw/zinc/58/57/27/1359585727.db2.gz	VMNBKSOYSAZACM-DZGCQCFKSA-N	0	3	329.400	3.093	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2c(Cl)nc3ccccn32)[C@H]1CC	ZINC001087819850	1359663771	/nfs/dbraw/zinc/66/37/71/1359663771.db2.gz	VCTBSDWCZIQOMR-UONOGXRCSA-N	0	3	346.862	3.147	20	30		EGEDHN
Cc1ccc(C(=O)N2C[C@H]3CCN(Cc4cccc(C#N)c4)C[C@H]3C2)o1	ZINC001087875443	1359693115	/nfs/dbraw/zinc/69/31/15/1359693115.db2.gz	XFYZUVPSUNMDMH-MOPGFXCFSA-N	0	3	349.434	3.054	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3cc4ccccc4cc3F)C[C@@H]2C1	ZINC001088037537	1359730648	/nfs/dbraw/zinc/73/06/48/1359730648.db2.gz	SLEYXNVVWXFELZ-MSOLQXFVSA-N	0	3	336.410	3.006	20	30		EGEDHN
CCC(C)(C)C(=O)N1C[C@H]2CCN(Cc3ccc(C#N)cc3)C[C@H]2C1	ZINC001088087811	1359751268	/nfs/dbraw/zinc/75/12/68/1359751268.db2.gz	NIPSGHMYOVQGIP-MOPGFXCFSA-N	0	3	339.483	3.275	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3coc4ccc(Cl)cc34)C[C@@H]2C1	ZINC001088185552	1359785851	/nfs/dbraw/zinc/78/58/51/1359785851.db2.gz	GEYCYFRCGWZRCB-KGLIPLIRSA-N	0	3	342.826	3.113	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)C3CCC(C(C)(C)C)CC3)C[C@@H]2C1	ZINC001088189898	1359787679	/nfs/dbraw/zinc/78/76/79/1359787679.db2.gz	ZXQNHYHLOZRKAE-IAFLDTSXSA-N	0	3	330.516	3.252	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3cc(C)c(CC)s3)C[C@@H]2C1	ZINC001088193492	1359789510	/nfs/dbraw/zinc/78/95/10/1359789510.db2.gz	GMPRIEXCMAQOEG-CVEARBPZSA-N	0	3	330.497	3.036	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1CCCCC[C@H](NCCF)C1	ZINC001088337287	1359832168	/nfs/dbraw/zinc/83/21/68/1359832168.db2.gz	BJBIROMGVBJITK-INIZCTEOSA-N	0	3	334.435	3.195	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2occ3c2CCC3)C1	ZINC001088354401	1359838482	/nfs/dbraw/zinc/83/84/82/1359838482.db2.gz	XGZJKXMBKWEWOH-HNNXBMFYSA-N	0	3	336.863	3.495	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2cc(C3CC3)on2)C1	ZINC001088354944	1359838931	/nfs/dbraw/zinc/83/89/31/1359838931.db2.gz	JXIOWRRFIXBKQX-CQSZACIVSA-N	0	3	337.851	3.279	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)C2CCC(OC)CC2)C1	ZINC001088371702	1359854155	/nfs/dbraw/zinc/85/41/55/1359854155.db2.gz	MYXRXVRHGIPKIF-CGZBRXJRSA-N	0	3	342.911	3.305	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCCCC[C@H](NCc2cnoc2C)C1	ZINC001088374223	1359855647	/nfs/dbraw/zinc/85/56/47/1359855647.db2.gz	BKZLQJNCFIAHED-HKUYNNGSSA-N	0	3	333.476	3.446	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)CCc2cc(C)on2)C1	ZINC001088381088	1359864319	/nfs/dbraw/zinc/86/43/19/1359864319.db2.gz	WRIBWLSNMRYWAJ-MRXNPFEDSA-N	0	3	339.867	3.029	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)Cc2cccnc2C)C1	ZINC001088381897	1359865283	/nfs/dbraw/zinc/86/52/83/1359865283.db2.gz	PNRAHQAKKVGDEI-KRWDZBQOSA-N	0	3	335.879	3.046	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)[C@@H]2C[C@H]2c2cccnc2)C1	ZINC001088387929	1359866576	/nfs/dbraw/zinc/86/65/76/1359866576.db2.gz	IKXVZALWJYUQDO-FGTMMUONSA-N	0	3	347.890	3.298	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2cncc(Cl)c2)C1	ZINC001088398381	1359873222	/nfs/dbraw/zinc/87/32/22/1359873222.db2.gz	HFSZJUZVFLVZJX-HNNXBMFYSA-N	0	3	342.270	3.462	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2cncnc2C2CC2)C1	ZINC001088420716	1359890319	/nfs/dbraw/zinc/89/03/19/1359890319.db2.gz	XALXRUAPUASIHP-OAHLLOKOSA-N	0	3	348.878	3.081	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)Cc2cccc(F)c2)C1	ZINC001088422196	1359891455	/nfs/dbraw/zinc/89/14/55/1359891455.db2.gz	JKBTUERIZYPBHQ-QGZVFWFLSA-N	0	3	338.854	3.482	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2nc(C)c(C)s2)C1	ZINC001088428439	1359896526	/nfs/dbraw/zinc/89/65/26/1359896526.db2.gz	UEBODJUJGXBGNA-AWEZNQCLSA-N	0	3	341.908	3.487	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccc(-c3cnco3)cc2)[C@H]1C	ZINC001088668454	1360009162	/nfs/dbraw/zinc/00/91/62/1360009162.db2.gz	PQXUVGLIYBMHMA-PBHICJAKSA-N	0	3	325.412	3.110	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2cc3c(o2)c(F)ccc3C)[C@H]1C	ZINC001088767119	1360035157	/nfs/dbraw/zinc/03/51/57/1360035157.db2.gz	ZMPUQPRXJZEPAY-CJNGLKHVSA-N	0	3	328.387	3.096	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2nsc3ccc(C)cc32)[C@H]1C	ZINC001088793655	1360046936	/nfs/dbraw/zinc/04/69/36/1360046936.db2.gz	NTUBJMMRRPYCCZ-HIFRSBDPSA-N	0	3	329.469	3.373	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)s2)[C@H]1C	ZINC001088816712	1360061472	/nfs/dbraw/zinc/06/14/72/1360061472.db2.gz	MZAWNLSUHNWRSH-SYQHCUMBSA-N	0	3	336.888	3.107	20	30		EGEDHN
C=C(C)CCN1CC[C@H](NC(=O)c2cc3cccnc3s2)[C@H]1C	ZINC001088956636	1360114502	/nfs/dbraw/zinc/11/45/02/1360114502.db2.gz	ASKQVNHMFPMBTE-HIFRSBDPSA-N	0	3	329.469	3.455	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCCN1C(=O)c1ccoc1	ZINC001089119135	1360182878	/nfs/dbraw/zinc/18/28/78/1360182878.db2.gz	MAQYMGIBIDQAGQ-IBGZPJMESA-N	0	3	337.423	3.278	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C2(c3ccc(F)cc3)CC2)CC(C)(C)C1	ZINC001089398669	1360398591	/nfs/dbraw/zinc/39/85/91/1360398591.db2.gz	KJXHPZGNBTTWSK-SFHVURJKSA-N	0	3	342.458	3.097	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2c(C)noc2C(C)C)CC(C)(C)C1	ZINC001089408569	1360407269	/nfs/dbraw/zinc/40/72/69/1360407269.db2.gz	BWVQHSJKQGXJMB-MRXNPFEDSA-N	0	3	345.487	3.350	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cccc3ccc(C)nc32)CC(C)(C)C1	ZINC001089417172	1360410902	/nfs/dbraw/zinc/41/09/02/1360410902.db2.gz	VWZGLSLQFXERLC-GOSISDBHSA-N	0	3	349.478	3.397	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@@H](c2ccccc2)C2CC2)CC(C)(C)C1	ZINC001089439814	1360429618	/nfs/dbraw/zinc/42/96/18/1360429618.db2.gz	UHQVTIIZMGICSO-PMACEKPBSA-N	0	3	338.495	3.420	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc3ccsc3[nH]2)CC(C)(C)C1	ZINC001089454449	1360441242	/nfs/dbraw/zinc/44/12/42/1360441242.db2.gz	XFNQQRCKIROENH-AWEZNQCLSA-N	0	3	329.469	3.083	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc3cc(F)ccc3[nH]2)CC(C)(C)C1	ZINC001089457300	1360444200	/nfs/dbraw/zinc/44/42/00/1360444200.db2.gz	UNWFAXTVJCUZJP-MRXNPFEDSA-N	0	3	341.430	3.161	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CCN(C/C=C/Cl)CC(C)(C)C2)c1	ZINC001089488529	1360468263	/nfs/dbraw/zinc/46/82/63/1360468263.db2.gz	VOGRRLGQKXPBBQ-QQOXCAACSA-N	0	3	345.874	3.036	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cnc3ccccc3c2)CC(C)(C)C1	ZINC001089504317	1360477160	/nfs/dbraw/zinc/47/71/60/1360477160.db2.gz	BFEBDLMRPXWKPZ-SFHVURJKSA-N	0	3	335.451	3.088	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2sc(CC)nc2C)CC(C)(C)C1	ZINC001089516582	1360486888	/nfs/dbraw/zinc/48/68/88/1360486888.db2.gz	GXMUZAURSLTVAS-OAHLLOKOSA-N	0	3	347.528	3.258	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cnn([C@@H](C)CC)c2C)CC(C)(C)C1	ZINC001089536649	1360496028	/nfs/dbraw/zinc/49/60/28/1360496028.db2.gz	FBSDWDJYGNGWDL-RDJZCZTQSA-N	0	3	344.503	3.016	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2c(C)cc(C)cc2C)CC(C)(C)C1	ZINC001089556276	1360506652	/nfs/dbraw/zinc/50/66/52/1360506652.db2.gz	OSSAYLMLHHJMGJ-SFHVURJKSA-N	0	3	326.484	3.465	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@@H](C)c2ccc(F)cc2F)CC(C)(C)C1	ZINC001089560942	1360509179	/nfs/dbraw/zinc/50/91/79/1360509179.db2.gz	KPMQYVYLQKNJLU-GOEBONIOSA-N	0	3	348.437	3.308	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cnc(C(C)(C)C)s2)CC(C)(C)C1	ZINC001089567350	1360513662	/nfs/dbraw/zinc/51/36/62/1360513662.db2.gz	ZOUUHTOGZFGDNX-AWEZNQCLSA-N	0	3	347.528	3.294	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NC[C@@H]1CCC(C)(C)CN1CC(=C)C	ZINC001089642906	1360556089	/nfs/dbraw/zinc/55/60/89/1360556089.db2.gz	POSQIDCFNYDKSP-KSZLIROESA-N	0	3	334.504	3.151	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc2[nH]ccc2n1	ZINC001089668665	1360578900	/nfs/dbraw/zinc/57/89/00/1360578900.db2.gz	ZYVIKZLENPRNNJ-HNNXBMFYSA-N	0	3	340.471	3.359	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc2[nH]nc(C)c2c1	ZINC001089669217	1360579549	/nfs/dbraw/zinc/57/95/49/1360579549.db2.gz	ISLRZIQZPOPGRC-INIZCTEOSA-N	0	3	340.471	3.278	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H]1Cc2ccc(F)cc21	ZINC001089687372	1360593691	/nfs/dbraw/zinc/59/36/91/1360593691.db2.gz	IYDFYJRMVDOXRJ-SJLPKXTDSA-N	0	3	330.447	3.258	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(F)c(OC)c1	ZINC001089696469	1360600874	/nfs/dbraw/zinc/60/08/74/1360600874.db2.gz	CWXVCJMVSNNSRR-MRXNPFEDSA-N	0	3	346.446	3.078	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](CNCc2cc(C)no2)[C@@H](C)C1	ZINC001184457954	1387465375	/nfs/dbraw/zinc/46/53/75/1387465375.db2.gz	CRDJUFWUBKHNNY-YJBOKZPZSA-N	0	3	345.487	3.326	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc2n(c1)CCCC2	ZINC001089742813	1360646215	/nfs/dbraw/zinc/64/62/15/1360646215.db2.gz	QJFPUJDOPIXHKE-SFHVURJKSA-N	0	3	329.488	3.231	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)CCC2CCC2)C1	ZINC001089789803	1360663867	/nfs/dbraw/zinc/66/38/67/1360663867.db2.gz	OFYKZYFLXUIDKU-XSLAGTTESA-N	0	3	336.907	3.488	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](CNCc2cnc(C)o2)[C@@H](C)C1	ZINC001184474125	1387468222	/nfs/dbraw/zinc/46/82/22/1387468222.db2.gz	TTWBRZJZFLAGSO-GOEBONIOSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](CNCc2cnc(C)o2)[C@@H](C)C1	ZINC001184474127	1387468305	/nfs/dbraw/zinc/46/83/05/1387468305.db2.gz	TTWBRZJZFLAGSO-HOCLYGCPSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1cccn1CC	ZINC001089905037	1360735551	/nfs/dbraw/zinc/73/55/51/1360735551.db2.gz	NGUCBDYKWUYTAN-HZMVEIRTSA-N	0	3	347.890	3.043	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)[C@@H]2C[C@H]2C(C)(C)C)CC2(CCOCC2)C1	ZINC001089947094	1360758952	/nfs/dbraw/zinc/75/89/52/1360758952.db2.gz	WKGZHIJRPRETRC-KZNAEPCWSA-N	0	3	348.531	3.232	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)[C@H]2CCC(C)(C)C2)CC2(CCOCC2)C1	ZINC001089956962	1360765744	/nfs/dbraw/zinc/76/57/44/1360765744.db2.gz	PKYYCKKJFBCNLH-ROUUACIJSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)[C@@H](C)c2ccsc2)CC2(CCOCC2)C1	ZINC001089959915	1360766916	/nfs/dbraw/zinc/76/69/16/1360766916.db2.gz	UKIIDUHVUAXTKZ-RDJZCZTQSA-N	0	3	348.512	3.025	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)[C@@H]2CC23CCCC3)CC2(CCOCC2)C1	ZINC001089965387	1360769997	/nfs/dbraw/zinc/76/99/97/1360769997.db2.gz	ZGLKAXVWZDHIDE-ROUUACIJSA-N	0	3	346.515	3.130	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C2CCC=CCC2)CC2(CCOCC2)C1	ZINC001089968906	1360771936	/nfs/dbraw/zinc/77/19/36/1360771936.db2.gz	PSPQVXPXTJMFDE-IBGZPJMESA-N	0	3	346.515	3.296	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C(C)(CC)CC)C[C@H]1c1ccc(OC)cc1	ZINC001090885532	1360946006	/nfs/dbraw/zinc/94/60/06/1360946006.db2.gz	UKGKTPSVXYLBLK-RBUKOAKNSA-N	0	3	342.483	3.039	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc3ccncc3s2)C1	ZINC001091068352	1360988921	/nfs/dbraw/zinc/98/89/21/1360988921.db2.gz	JUSYVMXPACKHQR-UHFFFAOYSA-N	0	3	335.860	3.147	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cccc3ccc(C)nc32)C1	ZINC001091090183	1360990131	/nfs/dbraw/zinc/99/01/31/1360990131.db2.gz	BZYVGFQXOSQRMW-UHFFFAOYSA-N	0	3	343.858	3.394	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2coc3cc(F)ccc23)C1	ZINC001091108520	1360993125	/nfs/dbraw/zinc/99/31/25/1360993125.db2.gz	HOWNRVVJHUXPDR-UHFFFAOYSA-N	0	3	336.794	3.422	20	30		EGEDHN
CC1(C)CC[C@@H]1C(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1	ZINC001091193198	1361003709	/nfs/dbraw/zinc/00/37/09/1361003709.db2.gz	RGZGOGDJWWJVNQ-BDVYOWHSSA-N	0	3	343.446	3.118	20	30		EGEDHN
CC1(C)CC[C@@H]1C(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1	ZINC001091192710	1361003723	/nfs/dbraw/zinc/00/37/23/1361003723.db2.gz	METXIHRBGOQYLP-BDVYOWHSSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H]2CCO[C@H]2c2ccccc2)C1	ZINC001091277822	1361029495	/nfs/dbraw/zinc/02/94/95/1361029495.db2.gz	FSWFPSJEGCEOIY-SYNTWQANSA-N	0	3	348.874	3.001	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc3nc(C)ccc3c2)C1	ZINC001091290889	1361033268	/nfs/dbraw/zinc/03/32/68/1361033268.db2.gz	IYFRDSJKVFRBHB-UHFFFAOYSA-N	0	3	343.858	3.394	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc3ccncc3c2)C1	ZINC001091313895	1361040177	/nfs/dbraw/zinc/04/01/77/1361040177.db2.gz	IIGFNPRWMSVBDE-UHFFFAOYSA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cccc(C(F)F)c2)C1	ZINC001091334489	1361048419	/nfs/dbraw/zinc/04/84/19/1361048419.db2.gz	PZPYUCAPWQFDOW-UHFFFAOYSA-N	0	3	328.790	3.475	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1C[C@H]2CN(Cc3cccc(C(F)F)c3)C[C@@]2(C)C1	ZINC001091543910	1361141119	/nfs/dbraw/zinc/14/11/19/1361141119.db2.gz	QGGGDPGFNLXKII-CRFBAAHOSA-N	0	3	347.409	3.064	20	30		EGEDHN
C[C@@]12CN(Cc3cccc(C#N)c3)C[C@@H]1CN(C(=O)CCC1CC1)C2	ZINC001091551753	1361142714	/nfs/dbraw/zinc/14/27/14/1361142714.db2.gz	XMIAYPBPHBOGIZ-CTNGQTDRSA-N	0	3	337.467	3.029	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@H]2CN(Cc3ccccn3)C[C@@]2(C)C1	ZINC001091701607	1361185411	/nfs/dbraw/zinc/18/54/11/1361185411.db2.gz	DJLCRDNUGHRZCO-BEFAXECRSA-N	0	3	347.890	3.141	20	30		EGEDHN
C#CCN(CC1CC1)C(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1	ZINC001323975079	1387502362	/nfs/dbraw/zinc/50/23/62/1387502362.db2.gz	MCHRHQBGPNYZPR-HXUWFJFHSA-N	0	3	339.483	3.187	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CN(Cc3cnc(C)s3)C[C@@]2(C)C1	ZINC001091978636	1361265644	/nfs/dbraw/zinc/26/56/44/1361265644.db2.gz	ZBXRLDDIVWQVDR-MNEFBYGVSA-N	0	3	347.528	3.334	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3cc4cc(F)ccc4s3)C[C@]2(C)C1	ZINC001092263398	1361348803	/nfs/dbraw/zinc/34/88/03/1361348803.db2.gz	MOVMZJLGQHMJDJ-KUHUBIRLSA-N	0	3	342.439	3.068	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1CNC(=O)[C@H]1CCC1(C)C	ZINC001092900080	1361481518	/nfs/dbraw/zinc/48/15/18/1361481518.db2.gz	MODCAYGFFVFKMP-MISYRCLQSA-N	0	3	338.495	3.158	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)/C=C\c2ccco2)CC1	ZINC001093353008	1361567088	/nfs/dbraw/zinc/56/70/88/1361567088.db2.gz	OWVXUNISNXYDPF-HCZHMGAMSA-N	0	3	338.451	3.019	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C[C@H]2C=CCC2)CC1	ZINC001093353551	1361567631	/nfs/dbraw/zinc/56/76/31/1361567631.db2.gz	AVIRJMPFDNIFFR-PXNSSMCTSA-N	0	3	326.484	3.069	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)[C@@H]2C[C@H]2C(C)(C)C)CC1	ZINC001093373877	1361583558	/nfs/dbraw/zinc/58/35/58/1361583558.db2.gz	TXGNWDSMKBBJOX-GUDVDZBRSA-N	0	3	342.527	3.395	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C2(C)CC=CC2)CC1	ZINC001093376267	1361586222	/nfs/dbraw/zinc/58/62/22/1361586222.db2.gz	ICNHOBZYAISONW-SFHVURJKSA-N	0	3	326.484	3.069	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)c2csc(C)c2)CC1	ZINC001093380965	1361592386	/nfs/dbraw/zinc/59/23/86/1361592386.db2.gz	CCDIIPWUSJSUJM-SFHVURJKSA-N	0	3	342.508	3.396	20	30		EGEDHN
C/C(=C/C(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1)C1CC1	ZINC001093654041	1361667792	/nfs/dbraw/zinc/66/77/92/1361667792.db2.gz	UQJXLACOOBYYMQ-GSFWWXFPSA-N	0	3	337.467	3.099	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)NC[C@]12CCC[C@H]1N(Cc1ccc(C#N)s1)CC2	ZINC001094491219	1361828052	/nfs/dbraw/zinc/82/80/52/1361828052.db2.gz	VIHCGAIPNBNAKK-CKNFYHOISA-N	0	3	343.496	3.137	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1C[C@H]2C[C@@H](C1)N(C(=O)[C@H]1C[C@H]3C[C@H]3C1)C2	ZINC001094982789	1361975037	/nfs/dbraw/zinc/97/50/37/1361975037.db2.gz	JHEICEXYIJIOJK-SKFPLTDBSA-N	0	3	349.478	3.073	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc(COC)cs1)C2	ZINC001095697623	1362203720	/nfs/dbraw/zinc/20/37/20/1362203720.db2.gz	SQXWKKYOFYGIGB-PMPSAXMXSA-N	0	3	334.485	3.196	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H]1COc3ccc(Cl)cc31)C2	ZINC001095760842	1362222739	/nfs/dbraw/zinc/22/27/39/1362222739.db2.gz	ALZROVVHGYGUGB-SIXLDLHFSA-N	0	3	346.858	3.114	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(C)c(Cl)c1F)C2	ZINC001095806576	1362237844	/nfs/dbraw/zinc/23/78/44/1362237844.db2.gz	KLPGBAUIPKLJKJ-SNPRPXQTSA-N	0	3	334.822	3.146	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C(C)(C)c1cccc(F)c1)C2	ZINC001096002022	1362329907	/nfs/dbraw/zinc/32/99/07/1362329907.db2.gz	HCPCDSSXFJKQRQ-SQNIBIBYSA-N	0	3	330.447	3.401	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cccc(-c3ccoc3)c1)C2	ZINC001096300100	1362457298	/nfs/dbraw/zinc/45/72/98/1362457298.db2.gz	RLSNTRMPRQOXKH-AABGKKOBSA-N	0	3	334.419	3.305	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1c[nH]c3ccc(F)cc13)C2	ZINC001096668000	1362624281	/nfs/dbraw/zinc/62/42/81/1362624281.db2.gz	VGYDLEMBLIJGCN-BVGQSLNGSA-N	0	3	327.403	3.218	20	30		EGEDHN
Cc1cccc([C@@H](C)N2[C@@H]3CC[C@H]2[C@H](NC(=O)c2cc(C#N)c[nH]2)C3)c1	ZINC001096924463	1362778562	/nfs/dbraw/zinc/77/85/62/1362778562.db2.gz	IHZYFHXDAUAHQG-ZESCBINXSA-N	0	3	348.450	3.291	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cccc3scnc31)C2	ZINC001097064157	1362830397	/nfs/dbraw/zinc/83/03/97/1362830397.db2.gz	ASSDOYPRGNWUPY-YUELXQCFSA-N	0	3	327.453	3.208	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1coc3ccc(CC)cc13)C2	ZINC001097079987	1362835330	/nfs/dbraw/zinc/83/53/30/1362835330.db2.gz	RDJMIUWZWFJDBC-LZQZEXGQSA-N	0	3	336.435	3.354	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C1(c3ccc(F)cc3)CC1)C2	ZINC001097178709	1362876085	/nfs/dbraw/zinc/87/60/85/1362876085.db2.gz	DMYYHNNQZITNRG-KURKYZTESA-N	0	3	328.431	3.155	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@@H](NCc2cn(C(C)C)nc2C)C1	ZINC001185056143	1387601364	/nfs/dbraw/zinc/60/13/64/1387601364.db2.gz	KGISJOWOTPMHEI-SJLPKXTDSA-N	0	3	332.492	3.065	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1nc(Cl)sc1Cl)C2	ZINC001097638545	1363085761	/nfs/dbraw/zinc/08/57/61/1363085761.db2.gz	CGTVZWZYGGIJOY-BBBLOLIVSA-N	0	3	346.283	3.361	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](CNCc3cnc(C)o3)[C@H](C)C2)CC1	ZINC001185096096	1387617933	/nfs/dbraw/zinc/61/79/33/1387617933.db2.gz	YGSQUEASPLWYGU-WBVHZDCISA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1cc3ccccc3n1C)C2	ZINC001098478410	1363338193	/nfs/dbraw/zinc/33/81/93/1363338193.db2.gz	LJHRUJMLBMIEPF-POAQFYNOSA-N	0	3	337.467	3.018	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C1CC(c3ccc(F)cc3)C1)C2	ZINC001098503283	1363345467	/nfs/dbraw/zinc/34/54/67/1363345467.db2.gz	GBSRAPLJYOQJIX-XZJNCXDESA-N	0	3	340.442	3.064	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1cc(C)sc1C)C[C@H](C)O2	ZINC001098613842	1363399390	/nfs/dbraw/zinc/39/93/90/1363399390.db2.gz	DMYLYQDVOZNJOJ-AWEZNQCLSA-N	0	3	348.512	3.246	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H](C)c1cccs1)C[C@H](C)O2	ZINC001098635201	1363409230	/nfs/dbraw/zinc/40/92/30/1363409230.db2.gz	DWJDHVOZNRIJGA-JKSUJKDBSA-N	0	3	348.512	3.120	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@H](C)c1ccco1)C[C@H](C)O2	ZINC001098657200	1363421949	/nfs/dbraw/zinc/42/19/49/1363421949.db2.gz	YZJWIRYOUCUGAF-IRXDYDNUSA-N	0	3	346.471	3.041	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N[C@]12CCC[C@H]1CN(Cc1cccc(C#N)c1)C2	ZINC001098796127	1363470762	/nfs/dbraw/zinc/47/07/62/1363470762.db2.gz	GLRIGPGMMYPIIG-UEXGIBASSA-N	0	3	337.467	3.075	20	30		EGEDHN
C#CCN1C[C@@H]2CCC[C@]2(NC(=O)Cc2ccc(C(C)(C)C)cc2)C1	ZINC001099052409	1363596523	/nfs/dbraw/zinc/59/65/23/1363596523.db2.gz	ZGLUMQPYWABGPU-UGKGYDQZSA-N	0	3	338.495	3.131	20	30		EGEDHN
CC(C)(C)C#CC(=O)NC[C@@H]1CCC(C)(C)CN1C[C@H]1CCCCO1	ZINC001099070324	1363606721	/nfs/dbraw/zinc/60/67/21/1363606721.db2.gz	VUUFLCQGTNUVMP-ZWKOTPCHSA-N	0	3	348.531	3.212	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2coc(C3CCC3)n2)C1	ZINC001099112311	1363629963	/nfs/dbraw/zinc/62/99/63/1363629963.db2.gz	KHJBUOVKNVKZHE-KXBFYZLASA-N	0	3	329.444	3.103	20	30		EGEDHN
C#CCCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc3c(s2)CCCC3)C1	ZINC001099148475	1363656624	/nfs/dbraw/zinc/65/66/24/1363656624.db2.gz	KWTIKNZZNOFHEO-JXFKEZNVSA-N	0	3	342.508	3.235	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)C1(C(F)F)CCC1	ZINC001099199271	1363689078	/nfs/dbraw/zinc/68/90/78/1363689078.db2.gz	JUEZTNSQWIPPED-CQSZACIVSA-N	0	3	326.431	3.052	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@@](C)(C=C)CC	ZINC001099214170	1363694842	/nfs/dbraw/zinc/69/48/42/1363694842.db2.gz	HPLJYTBXRJGUQI-PXNSSMCTSA-N	0	3	336.520	3.398	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2c(C)coc2C)C[C@H]1C(F)(F)F	ZINC001099246199	1363712172	/nfs/dbraw/zinc/71/21/72/1363712172.db2.gz	QDRMPKKDQCWLBW-CHWSQXEVSA-N	0	3	330.350	3.065	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H](C)Cc1c(C)noc1C	ZINC001099258649	1363719666	/nfs/dbraw/zinc/71/96/66/1363719666.db2.gz	SHSSHWRVHMDYOU-YOEHRIQHSA-N	0	3	347.503	3.263	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)C2CCC(F)CC2)C[C@H]1C(F)(F)F	ZINC001099301982	1363738739	/nfs/dbraw/zinc/73/87/39/1363738739.db2.gz	BNUIHYSOUIRJTP-NWINJMCUSA-N	0	3	336.373	3.070	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)C1(CCOC)CCC1	ZINC001099321346	1363749635	/nfs/dbraw/zinc/74/96/35/1363749635.db2.gz	UZFCKFKFNJJCMM-QGZVFWFLSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2ccc3cnccc3c2)C[C@H]1C(F)(F)F	ZINC001099328773	1363753259	/nfs/dbraw/zinc/75/32/59/1363753259.db2.gz	CWRZHYSZSZAHHF-HZPDHXFCSA-N	0	3	349.356	3.013	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)C1(c2ccccc2)CC1	ZINC001099334256	1363756555	/nfs/dbraw/zinc/75/65/55/1363756555.db2.gz	GCYGYVRYBKOVPD-IBGZPJMESA-N	0	3	338.495	3.348	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H](C)COc1ccccc1	ZINC001099340577	1363760936	/nfs/dbraw/zinc/76/09/36/1363760936.db2.gz	VQZITCKVFARELN-ROUUACIJSA-N	0	3	344.499	3.494	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@H]2CC3CCC2CC3)C[C@H]1C(F)(F)F	ZINC001099345497	1363763400	/nfs/dbraw/zinc/76/34/00/1363763400.db2.gz	DEFPZMRAQUMOOC-UIEKQHFFSA-N	0	3	344.421	3.368	20	30		EGEDHN
CC(C)=CC(=O)N1C[C@@H]2CCC[C@]2(CNCc2ccccc2C#N)C1	ZINC001099367331	1363776692	/nfs/dbraw/zinc/77/66/92/1363776692.db2.gz	FWTLZPQLUXDDAR-FPOVZHCZSA-N	0	3	337.467	3.243	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)CSC(C)C	ZINC001099425342	1363795114	/nfs/dbraw/zinc/79/51/14/1363795114.db2.gz	QOGMPPZUUACJEB-JJXSEGSLSA-N	0	3	342.936	3.049	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2cc(C)no2)C1	ZINC001099473726	1363810926	/nfs/dbraw/zinc/81/09/26/1363810926.db2.gz	IGCDVHGTDHUIMX-JXFKEZNVSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C2(CC)CCC2)CC2(CCOCC2)C1	ZINC001099587003	1363868292	/nfs/dbraw/zinc/86/82/92/1363868292.db2.gz	NGTRNOVMGQORFK-KRWDZBQOSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCCC(C)C)CC2(CCOCC2)C1	ZINC001099593188	1363875377	/nfs/dbraw/zinc/87/53/77/1363875377.db2.gz	SOOBZELTPLBPSP-SFHVURJKSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CN(CC(=C)C)CC2(CCOCC2)C1	ZINC001099593081	1363875793	/nfs/dbraw/zinc/87/57/93/1363875793.db2.gz	QRFQJZWVOCKIAL-KRWDZBQOSA-N	0	3	334.504	3.152	20	30		EGEDHN
CC(C)[C@H](C)CC(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100172722	1364035859	/nfs/dbraw/zinc/03/58/59/1364035859.db2.gz	CPFBOTSOZIYOPP-PPDQVPDSSA-N	0	3	344.474	3.344	20	30		EGEDHN
CCC[C@@H](C)C(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1	ZINC001100196831	1364042256	/nfs/dbraw/zinc/04/22/56/1364042256.db2.gz	VKMQVGBNCCLWTA-BZOOQXSSSA-N	0	3	331.435	3.118	20	30		EGEDHN
O=C(/C=C\C1CC1)NCC1CC(NCC#Cc2cccc(Cl)c2)C1	ZINC001100218974	1364046893	/nfs/dbraw/zinc/04/68/93/1364046893.db2.gz	NDGQSWYWLOCKRF-HJWRWDBZSA-N	0	3	342.870	3.142	20	30		EGEDHN
O=C(CC1CCC1)NCC1CC(NCC#Cc2ccccc2Cl)C1	ZINC001100222831	1364048681	/nfs/dbraw/zinc/04/86/81/1364048681.db2.gz	NDSJBQKGQIZVEB-UHFFFAOYSA-N	0	3	344.886	3.366	20	30		EGEDHN
N#Cc1ccc(CNC2CC(CNC(=O)CCC3CCC3)C2)c(F)c1	ZINC001100226520	1364049813	/nfs/dbraw/zinc/04/98/13/1364049813.db2.gz	DHJSWRAQWOQXHT-UHFFFAOYSA-N	0	3	343.446	3.262	20	30		EGEDHN
C#CCCCCC(=O)NCC1CC(NCc2oc(CCC)nc2C)C1	ZINC001100259354	1364060640	/nfs/dbraw/zinc/06/06/40/1364060640.db2.gz	IEPUHFDOMNBEOR-UHFFFAOYSA-N	0	3	345.487	3.114	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)CCO[C@@H](C)CC(C)C)C1	ZINC001100325998	1364080709	/nfs/dbraw/zinc/08/07/09/1364080709.db2.gz	GQPQOALUGZLJCT-FHERZECASA-N	0	3	330.900	3.065	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1	ZINC001100364404	1364092529	/nfs/dbraw/zinc/09/25/29/1364092529.db2.gz	CUDMIKMWZKPSMK-UHFFFAOYSA-N	0	3	343.446	3.284	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)Cc2cc3ccccc3o2)C1	ZINC001100554060	1364159297	/nfs/dbraw/zinc/15/92/97/1364159297.db2.gz	WEQMJARHQRLOFI-UHFFFAOYSA-N	0	3	332.831	3.212	20	30		EGEDHN
N#Cc1ccc(CNC2CC(CNC(=O)CCCC3CC3)C2)c(F)c1	ZINC001100593403	1364178768	/nfs/dbraw/zinc/17/87/68/1364178768.db2.gz	JEPYIHCZQUSPGG-UHFFFAOYSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCC1CC(NCc2ccncc2Cl)C1	ZINC001100596326	1364181070	/nfs/dbraw/zinc/18/10/70/1364181070.db2.gz	PDXRIOXSXHIHGR-HLIUYOAVSA-N	0	3	335.879	3.322	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCC1CC(NCc2c(C)noc2CC)C1	ZINC001100596966	1364181823	/nfs/dbraw/zinc/18/18/23/1364181823.db2.gz	LCFYSTVFFVNQTP-QQFBHYJXSA-N	0	3	333.476	3.132	20	30		EGEDHN
CCC(C)(C)C(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1	ZINC001100625613	1364194827	/nfs/dbraw/zinc/19/48/27/1364194827.db2.gz	OJUFHNRAKFMJAP-UHFFFAOYSA-N	0	3	331.435	3.118	20	30		EGEDHN
O=C(NCC1CC(NCC#Cc2ccccc2)C1)[C@@]12C[C@@H]1CCCC2	ZINC001100656894	1364206531	/nfs/dbraw/zinc/20/65/31/1364206531.db2.gz	QLCRLOFWWDOJNF-OYZUSSLQSA-N	0	3	336.479	3.103	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC2CC(NCc3cc(F)ccc3OC)C2)C1	ZINC001100659129	1364207129	/nfs/dbraw/zinc/20/71/29/1364207129.db2.gz	IFBCYGASTSRZES-UHFFFAOYSA-N	0	3	346.446	3.175	20	30		EGEDHN
C[C@@H](C(=O)NCC1CC(NCC#Cc2ccccc2)C1)C1CCCC1	ZINC001100853647	1364292836	/nfs/dbraw/zinc/29/28/36/1364292836.db2.gz	RGFQEHCKLMAGDG-FQVISZRSSA-N	0	3	338.495	3.349	20	30		EGEDHN
Cc1ccc(C)c(C(=O)NCC2CC(NCC#Cc3ccccc3)C2)c1	ZINC001100910072	1364327331	/nfs/dbraw/zinc/32/73/31/1364327331.db2.gz	ZOXWFCQAWZYVJX-UHFFFAOYSA-N	0	3	346.474	3.453	20	30		EGEDHN
C=C[C@@H](C(=O)NCC1CC(NCc2cncs2)C1)c1ccccc1	ZINC001101016964	1364375439	/nfs/dbraw/zinc/37/54/39/1364375439.db2.gz	NHDGRFNVXJKBSQ-JFUPDXTOSA-N	0	3	341.480	3.097	20	30		EGEDHN
C#CCCCC(=O)N1C[C@H]2CN(Cc3ccc(C)c(F)c3)C[C@@]2(C)C1	ZINC001101218256	1364468976	/nfs/dbraw/zinc/46/89/76/1364468976.db2.gz	WYBJCYZBXJADLX-NQIIRXRSSA-N	0	3	342.458	3.218	20	30		EGEDHN
CC/C(C)=C\C(=O)N1C[C@H]2CN(Cc3ccc(C#N)cc3)C[C@@]2(C)C1	ZINC001101225691	1364473516	/nfs/dbraw/zinc/47/35/16/1364473516.db2.gz	RKQDRJVKOSPOND-MGFUJTGMSA-N	0	3	337.467	3.195	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1C[C@H]2CN(Cc3ccc(F)cc3)C[C@@]2(C)C1	ZINC001101229400	1364475967	/nfs/dbraw/zinc/47/59/67/1364475967.db2.gz	XVTQMLTTZRLKSU-UTKZUKDTSA-N	0	3	342.458	3.156	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@H]2CN(CCC(F)(F)F)C[C@@]2(C)C1	ZINC001101338088	1364516221	/nfs/dbraw/zinc/51/62/21/1364516221.db2.gz	WSJZBGNNFYPYBF-FMKPAKJESA-N	0	3	332.410	3.321	20	30		EGEDHN
CCCC(=O)NC[C@@H]1CN(CC#Cc2ccc(Cl)cc2)C[C@H]1C	ZINC001101679872	1364686521	/nfs/dbraw/zinc/68/65/21/1364686521.db2.gz	MHRBVQINXHOQOW-NVXWUHKLSA-N	0	3	332.875	3.176	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1CNC(=O)CC1CCC1	ZINC001101856679	1364752133	/nfs/dbraw/zinc/75/21/33/1364752133.db2.gz	HWOYYNLHJVTAFF-RDTXWAMCSA-N	0	3	343.446	3.072	20	30		EGEDHN
C/C=C(\C)C(=O)NC[C@@H]1CN(CC#Cc2ccc(Cl)cc2)C[C@H]1C	ZINC001101861376	1364755101	/nfs/dbraw/zinc/75/51/01/1364755101.db2.gz	ADBOLVURTWHOJT-YUOGFCRJSA-N	0	3	344.886	3.342	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@@H]1CN(Cc2conc2CC)C[C@H]1C	ZINC001102228480	1364945412	/nfs/dbraw/zinc/94/54/12/1364945412.db2.gz	BVKNKYLFNHNVLC-IAGOWNOFSA-N	0	3	345.487	3.005	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@H]1CN(Cc2c(C)nsc2C)C[C@H]1C	ZINC001102252901	1364966566	/nfs/dbraw/zinc/96/65/66/1364966566.db2.gz	SYBWUMUAEQEASM-RHSMWYFYSA-N	0	3	347.528	3.138	20	30		EGEDHN
CC(C)CC(=O)NCC[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1C	ZINC001102642495	1365150160	/nfs/dbraw/zinc/15/01/60/1365150160.db2.gz	BROIEKVHKPVWIZ-NVXWUHKLSA-N	0	3	345.462	3.318	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2scnc2CC)C1	ZINC001103064076	1365361798	/nfs/dbraw/zinc/36/17/98/1365361798.db2.gz	KOJHWACPSDVDTA-DGCLKSJQSA-N	0	3	341.908	3.146	20	30		EGEDHN
CCCCCCCCOCC(=O)NCC[C@@H]1CN(CCF)C[C@H]1C	ZINC001103088857	1365375060	/nfs/dbraw/zinc/37/50/60/1365375060.db2.gz	YURCXSMHEPNZFE-QZTJIDSGSA-N	0	3	344.515	3.407	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cccnc2C2CC2)C1	ZINC001103187682	1365425775	/nfs/dbraw/zinc/42/57/75/1365425775.db2.gz	ZNYSFPGFFOKQER-CZUORRHYSA-N	0	3	347.890	3.399	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1CCNC(=O)CCCF	ZINC001103323979	1365495209	/nfs/dbraw/zinc/49/52/09/1365495209.db2.gz	FYQJKIHYOFALJS-GDBMZVCRSA-N	0	3	349.425	3.021	20	30		EGEDHN
CC[C@H](C)C(=O)N1C[C@@H](C)[C@H](CCNCc2ccc(C#N)cc2F)C1	ZINC001103904554	1365828948	/nfs/dbraw/zinc/82/89/48/1365828948.db2.gz	IYRXQWLYHPDMQX-HDMKZQKVSA-N	0	3	345.462	3.318	20	30		EGEDHN
C/C=C(/C)C(=O)N1C[C@@H](C)[C@H](CCNCc2ccc(C#N)cc2F)C1	ZINC001104053568	1365891719	/nfs/dbraw/zinc/89/17/19/1365891719.db2.gz	BYMYPYWXOPAKNR-YPHGIUPASA-N	0	3	343.446	3.238	20	30		EGEDHN
CC1CC(C(=O)N2C[C@@H](C)[C@H](CCNCc3ccccc3C#N)C2)C1	ZINC001104057117	1365893528	/nfs/dbraw/zinc/89/35/28/1365893528.db2.gz	GBKCHFGXTALVKD-DNUDUWDPSA-N	0	3	339.483	3.179	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2conc2CC)C1	ZINC001104092413	1365908235	/nfs/dbraw/zinc/90/82/35/1365908235.db2.gz	VLKITECLUZHGMY-IAGOWNOFSA-N	0	3	345.487	3.005	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@@H](C)[C@H](CCNCc2cnoc2C)C1	ZINC001104563251	1366078442	/nfs/dbraw/zinc/07/84/42/1366078442.db2.gz	KKHVMOSMEWLNHS-HYVNUMGLSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H](C)[C@H](CCNCc2nccn2CC)C1	ZINC001104731795	1366148958	/nfs/dbraw/zinc/14/89/58/1366148958.db2.gz	YJPZKZNUOHJHOP-IAGOWNOFSA-N	0	3	346.519	3.080	20	30		EGEDHN
CCN1CCN(c2cc(C)c(C#N)c3nc4ccccc4n32)C[C@@H]1C	ZINC001185818692	1387808197	/nfs/dbraw/zinc/80/81/97/1387808197.db2.gz	BDZJPWJDSSKOHN-HNNXBMFYSA-N	0	3	333.439	3.198	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C[C@@H](C)C(C)C)CC1	ZINC001105388928	1366435994	/nfs/dbraw/zinc/43/59/94/1366435994.db2.gz	FIPNEKHFFHQHIR-XLIONFOSSA-N	0	3	330.516	3.395	20	30		EGEDHN
CC[C@H](F)CN1CC2(CCC2)[C@H]1C1CCN(C(=O)C#CC(C)C)CC1	ZINC001105392053	1366440694	/nfs/dbraw/zinc/44/06/94/1366440694.db2.gz	RJYDARZPOFBPSN-AZUAARDMSA-N	0	3	348.506	3.487	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)CCC2(C)CC2)CC1	ZINC001105396626	1366445281	/nfs/dbraw/zinc/44/52/81/1366445281.db2.gz	QORVOXXJESGPER-IBGZPJMESA-N	0	3	328.500	3.293	20	30		EGEDHN
CCC(=O)N[C@H]1C[C@@](CNCC#Cc2ccccc2)(c2ccccc2)C1	ZINC001105398395	1366446355	/nfs/dbraw/zinc/44/63/55/1366446355.db2.gz	XECDCRGTLROTSQ-DKXQDJALSA-N	0	3	346.474	3.254	20	30		EGEDHN
CCCCCC(=O)N1C[C@@H](CNCc2cc(F)ccc2C#N)[C@H](C)C1	ZINC001105830163	1366593792	/nfs/dbraw/zinc/59/37/92/1366593792.db2.gz	RHSOBSFUMOBTFE-CRAIPNDOSA-N	0	3	345.462	3.462	20	30		EGEDHN
CCCCC(=O)N1C[C@@H](CNCc2cc(F)ccc2C#N)[C@H](C)C1	ZINC001105840125	1366594199	/nfs/dbraw/zinc/59/41/99/1366594199.db2.gz	ZCHVTWCBLDNMJI-RHSMWYFYSA-N	0	3	331.435	3.072	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001105959595	1366602503	/nfs/dbraw/zinc/60/25/03/1366602503.db2.gz	VMVYRLCGYALKEV-GPMSIDNRSA-N	0	3	327.472	3.179	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](CNCc3csc(C)n3)[C@H](C)C2)CCC1	ZINC001106631430	1366761010	/nfs/dbraw/zinc/76/10/10/1366761010.db2.gz	ZOCGLVOEZVJIII-GDBMZVCRSA-N	0	3	347.528	3.382	20	30		EGEDHN
CCC[C@H](C)CC(=O)N1CC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001189281032	1366975613	/nfs/dbraw/zinc/97/56/13/1366975613.db2.gz	WSXCJMFWUPCJPW-QFBILLFUSA-N	0	3	327.472	3.417	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccc2c(c1)CCC2	ZINC001109204393	1367001223	/nfs/dbraw/zinc/00/12/23/1367001223.db2.gz	NXNSCECKHAVXHH-HKBOAZHASA-N	0	3	336.479	3.200	20	30		EGEDHN
C=CCOCC(=O)N1CC[C@H](N(C)C/C=C/c2ccc(Cl)cc2)C1	ZINC001189379632	1367007889	/nfs/dbraw/zinc/00/78/89/1367007889.db2.gz	LECDGLQBOMANJC-WRFKIARRSA-N	0	3	348.874	3.089	20	30		EGEDHN
C=CCCCC(=O)NC[C@]12CCC[C@H]1N(Cc1conc1C)CC2	ZINC001107524062	1367017908	/nfs/dbraw/zinc/01/79/08/1367017908.db2.gz	GDDDIGQESSZPAI-IEBWSBKVSA-N	0	3	331.460	3.200	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@]12CCC[C@H]1N(Cc1conc1C)CC2	ZINC001107534143	1367025906	/nfs/dbraw/zinc/02/59/06/1367025906.db2.gz	ZEYQVOYDPRGIOK-MISYRCLQSA-N	0	3	345.487	3.446	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2[C@@H]1CCc2ccccc21	ZINC001109260720	1367030819	/nfs/dbraw/zinc/03/08/19/1367030819.db2.gz	MGBMVBGOYQUNQR-MDNKFWRPSA-N	0	3	336.479	3.445	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@]23CCC[C@H]2N(Cc2cccnc2)CC3)C1	ZINC001107543675	1367034838	/nfs/dbraw/zinc/03/48/38/1367034838.db2.gz	SLQMIECPUBBPJT-WIYYLYMNSA-N	0	3	339.483	3.299	20	30		EGEDHN
COCC#CCN1CC[C@@]2(CNC(=O)[C@@H](C)CC(C)(C)C)CCC[C@@H]12	ZINC001107567847	1367048600	/nfs/dbraw/zinc/04/86/00/1367048600.db2.gz	NLOIZWCOFOMYTK-WAOWUJCRSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCOc1ccc(C)cc1C)C2	ZINC001109372562	1367091152	/nfs/dbraw/zinc/09/11/52/1367091152.db2.gz	DTKDCKPVYWLVSS-QYZOEREBSA-N	0	3	342.483	3.370	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](N(C)Cc2ccc(OC)c(Cl)c2)C1	ZINC001189909962	1367129645	/nfs/dbraw/zinc/12/96/45/1367129645.db2.gz	JXVVTLSZMDJCMN-MRXNPFEDSA-N	0	3	348.874	3.185	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](N(C)[C@@H]2CCc3c2cc(F)cc3F)C1	ZINC001189911278	1367130071	/nfs/dbraw/zinc/13/00/71/1367130071.db2.gz	ZUZIQKJBZQFHSK-DNVCBOLYSA-N	0	3	346.421	3.288	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@]1(C)CN(CC2CCCCCC2)CCO1	ZINC001107883105	1367190691	/nfs/dbraw/zinc/19/06/91/1367190691.db2.gz	KZLDAZXTUFOUBN-NRFANRHFSA-N	0	3	348.531	3.358	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)C2=CCCCCC2)C1	ZINC001107894527	1367193520	/nfs/dbraw/zinc/19/35/20/1367193520.db2.gz	ZCRDDVWCXTZSKM-XLIONFOSSA-N	0	3	334.504	3.439	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@@]1(C)CN(C[C@H](C)CC(C)C)CCO1	ZINC001107970892	1367224964	/nfs/dbraw/zinc/22/49/64/1367224964.db2.gz	KWIOQVBVSXYYLL-XLIONFOSSA-N	0	3	338.536	3.478	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](N(C)Cc2ccc(COC)cc2)C1	ZINC001190398483	1367254111	/nfs/dbraw/zinc/25/41/11/1367254111.db2.gz	WFKHJUNVOJPXQY-IBGZPJMESA-N	0	3	344.499	3.468	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](N(C)Cc2cccc(NC(C)=O)c2)C1	ZINC001190421714	1367260569	/nfs/dbraw/zinc/26/05/69/1367260569.db2.gz	BATYGZQYCMDWKI-IBGZPJMESA-N	0	3	343.471	3.034	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@]2(C)CN(CC3CC(C)(C)C3)CCO2)CCC1	ZINC001108187548	1367329741	/nfs/dbraw/zinc/32/97/41/1367329741.db2.gz	JXEJCHXNOIWKPH-FQEVSTJZSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)C2(F)CCCCC2)C1	ZINC001108322628	1367390347	/nfs/dbraw/zinc/39/03/47/1367390347.db2.gz	AGAWDXRPOKLQSS-WMZOPIPTSA-N	0	3	340.483	3.221	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1oc(CCC)nc1C)C2	ZINC001109982545	1367442829	/nfs/dbraw/zinc/44/28/29/1367442829.db2.gz	HWTZWDXWNKKABD-PMPSAXMXSA-N	0	3	331.460	3.237	20	30		EGEDHN
C=C[C@H](C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCOC(C)C)c1ccccc1	ZINC001110136627	1367518995	/nfs/dbraw/zinc/51/89/95/1367518995.db2.gz	JPEOWLFVZURQDJ-FYQPLNBISA-N	0	3	342.483	3.103	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](C)Cc1ccc(C)cc1)C2	ZINC001110170560	1367541769	/nfs/dbraw/zinc/54/17/69/1367541769.db2.gz	KFERKKOVCSBAPA-RNQOJCNYSA-N	0	3	326.484	3.471	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](N(C)Cc2ccc(CF)cc2)C1	ZINC001191837822	1367608316	/nfs/dbraw/zinc/60/83/16/1367608316.db2.gz	FDLREZOCLKZAGA-IBGZPJMESA-N	0	3	330.447	3.382	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](N(C)Cc2cccc(COC)c2)C1	ZINC001191838279	1367608499	/nfs/dbraw/zinc/60/84/99/1367608499.db2.gz	ICJACPGFFFPQPM-FQEVSTJZSA-N	0	3	342.483	3.059	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@H](N(C)CCc2csc(C)n2)C1	ZINC001191889598	1367627440	/nfs/dbraw/zinc/62/74/40/1367627440.db2.gz	IPDHJBACWIQKTQ-WBVHZDCISA-N	0	3	335.517	3.129	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001191912034	1367637297	/nfs/dbraw/zinc/63/72/97/1367637297.db2.gz	MFINNAQITWCBTB-VQIMIIECSA-N	0	3	325.456	3.193	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2C[C@@H](OC)c1ccccc1	ZINC001110378733	1367679217	/nfs/dbraw/zinc/67/92/17/1367679217.db2.gz	DYUUUQWCSRKRGN-AKHDSKFASA-N	0	3	328.456	3.062	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](N(C)Cc2ccc3c(c2)COC3)C1	ZINC001192073430	1367680544	/nfs/dbraw/zinc/68/05/44/1367680544.db2.gz	UAKPVPZKCHHTND-IBGZPJMESA-N	0	3	328.456	3.106	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](N(C)CCOc3cccc(F)c3)C2)C1	ZINC001192245319	1367728252	/nfs/dbraw/zinc/72/82/52/1367728252.db2.gz	FDUYEIWMXUKLQH-KRWDZBQOSA-N	0	3	346.446	3.094	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](N(C)CCOc3cccc(F)c3)C2)C1	ZINC001192245320	1367729056	/nfs/dbraw/zinc/72/90/56/1367729056.db2.gz	FDUYEIWMXUKLQH-QGZVFWFLSA-N	0	3	346.446	3.094	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCCc1ccsc1	ZINC001110494867	1367782863	/nfs/dbraw/zinc/78/28/63/1367782863.db2.gz	ZZEBCLVBXDGEQU-KURKYZTESA-N	0	3	330.497	3.206	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccc(CO)cc1	ZINC001110603642	1367865715	/nfs/dbraw/zinc/86/57/15/1367865715.db2.gz	MFMLXSIZLHJKAV-QRVBRYPASA-N	0	3	342.483	3.003	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)CC(C)(C)c1ccc(F)cc1)C2	ZINC001110671111	1367910811	/nfs/dbraw/zinc/91/08/11/1367910811.db2.gz	SQQQEBITMATGGI-QRVBRYPASA-N	0	3	342.458	3.238	20	30		EGEDHN
CC[C@@H](C)CCC(=O)N1CC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001193017698	1367923662	/nfs/dbraw/zinc/92/36/62/1367923662.db2.gz	PAEZRSXMISRKLJ-APWZRJJASA-N	0	3	327.472	3.417	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2c(C)csc2Cl)C1	ZINC001193704805	1368099358	/nfs/dbraw/zinc/09/93/58/1368099358.db2.gz	KBZSDCMEXGLFQK-ZDUSSCGKSA-N	0	3	342.892	3.059	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](C)c1ccc(C)s1)C2	ZINC001111275372	1368241918	/nfs/dbraw/zinc/24/19/18/1368241918.db2.gz	UEGXOTLVALJCOO-HZMVEIRTSA-N	0	3	348.512	3.084	20	30		EGEDHN
C=C[C@H](CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCOCC)c1ccccc1	ZINC001111441287	1368308000	/nfs/dbraw/zinc/30/80/00/1368308000.db2.gz	GUXJJTHDXUNGAU-AFYVEPGGSA-N	0	3	342.483	3.104	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@H](C)c1ccc(F)cc1)C2	ZINC001111449711	1368309776	/nfs/dbraw/zinc/30/97/76/1368309776.db2.gz	HCUGMLNYVWYLCL-PIKADFDJSA-N	0	3	328.431	3.064	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@H](C)c1cccc(OC)c1)C2	ZINC001111479067	1368316854	/nfs/dbraw/zinc/31/68/54/1368316854.db2.gz	DADJTZNTAHKGLV-ZSXHRAQDSA-N	0	3	342.483	3.486	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccc(C)c(C)c1	ZINC001111487571	1368318334	/nfs/dbraw/zinc/31/83/34/1368318334.db2.gz	VOUDWZMJNQLTJG-AQNXPRMDSA-N	0	3	342.483	3.118	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3CC[C@H](C)F)CCCCC1	ZINC001111483986	1368318562	/nfs/dbraw/zinc/31/85/62/1368318562.db2.gz	RBSJZUXKZCVCBF-MLHJIOFPSA-N	0	3	334.479	3.430	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C1(C(F)(F)F)CCCCC1)C2	ZINC001111511655	1368323744	/nfs/dbraw/zinc/32/37/44/1368323744.db2.gz	YTZUXNYCRFSNPT-KFWWJZLASA-N	0	3	342.405	3.244	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H](CC)CCCC)C[C@H](C)O2	ZINC001111535886	1368334295	/nfs/dbraw/zinc/33/42/95/1368334295.db2.gz	SSCFFLVKGRSYRU-ROUUACIJSA-N	0	3	336.520	3.471	20	30		EGEDHN
Cc1cc(C#N)cc(C(=O)NC[C@H](c2ccccc2)N2CCCC2)c1	ZINC001195428861	1368435368	/nfs/dbraw/zinc/43/53/68/1368435368.db2.gz	DAECIUWVJDYYJW-HXUWFJFHSA-N	0	3	333.435	3.434	20	30		EGEDHN
CC(C)C#CC(=O)N1CCCN(CC[C@@H]2CCCC2(F)F)CC1	ZINC001195780689	1368488534	/nfs/dbraw/zinc/48/85/34/1368488534.db2.gz	GOJSXNNIEKNNGP-INIZCTEOSA-N	0	3	326.431	3.006	20	30		EGEDHN
CC#CCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1cnccc1C)C2	ZINC001111845887	1368500152	/nfs/dbraw/zinc/50/01/52/1368500152.db2.gz	FMFFIDPMYRTXBW-FPOVZHCZSA-N	0	3	339.483	3.054	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)CCc2c[nH]c3ccccc23)C1	ZINC001111967156	1368578055	/nfs/dbraw/zinc/57/80/55/1368578055.db2.gz	TVTXCYLPPISPGC-AVRDEDQJSA-N	0	3	349.478	3.095	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2n[nH]c3c2CCCC3)CC1	ZINC001196394977	1368606436	/nfs/dbraw/zinc/60/64/36/1368606436.db2.gz	LYYQJUAEAIKERM-UHFFFAOYSA-N	0	3	344.503	3.183	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2coc(OCC)n2)CC1	ZINC001196416646	1368610623	/nfs/dbraw/zinc/61/06/23/1368610623.db2.gz	BCJDGVPWICDCKD-UHFFFAOYSA-N	0	3	337.464	3.192	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@]12CCC[C@@H]1CN(Cc1ccc(C#N)cc1)C2	ZINC001196469672	1368621723	/nfs/dbraw/zinc/62/17/23/1368621723.db2.gz	IXAXNGHTXQYXNK-YLJYHZDGSA-N	0	3	341.455	3.437	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@H](CCC)C(C)C)C1	ZINC001196534264	1368633840	/nfs/dbraw/zinc/63/38/40/1368633840.db2.gz	BLLMJWOFUMEITB-KZNAEPCWSA-N	0	3	326.525	3.190	20	30		EGEDHN
C=CCCCN1C[C@@H](O)[C@H](NC(=O)[C@H](CC)CC2CCCCC2)C1	ZINC001196609365	1368648153	/nfs/dbraw/zinc/64/81/53/1368648153.db2.gz	ZFVXGBSUTSHEFF-GUDVDZBRSA-N	0	3	336.520	3.111	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@@H](C(F)(F)F)[C@H](NCC2=CCCCC2)C1	ZINC001112099780	1368658165	/nfs/dbraw/zinc/65/81/65/1368658165.db2.gz	KPQBGBUCSNPOGA-HZPDHXFCSA-N	0	3	342.405	3.125	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@H](C)CC(C)(C)C)C1	ZINC001196725495	1368670488	/nfs/dbraw/zinc/67/04/88/1368670488.db2.gz	GEWLZJNKXYUZSL-BRWVUGGUSA-N	0	3	326.525	3.190	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)N1CCCN(CCc2ccc(OC)cc2)CC1	ZINC001196830159	1368692713	/nfs/dbraw/zinc/69/27/13/1368692713.db2.gz	ISRILFCQSLIJBB-QZTJIDSGSA-N	0	3	344.499	3.230	20	30		EGEDHN
C=CCC1(C(=O)N2CCCN(C[C@@H](OC)C3CCC3)CC2)CCC1	ZINC001197076441	1368741169	/nfs/dbraw/zinc/74/11/69/1368741169.db2.gz	IBCLQMRTXHURHT-GOSISDBHSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H]2CCC[C@]2(CNC/C(Cl)=C\Cl)C1	ZINC001112281912	1368746854	/nfs/dbraw/zinc/74/68/54/1368746854.db2.gz	AEQYCQKFHWUAIC-PQKWVXEPSA-N	0	3	331.287	3.490	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cnc(C3CC3)nc2)CC1	ZINC001197346369	1368793360	/nfs/dbraw/zinc/79/33/60/1368793360.db2.gz	POZDZBMBOOJQHQ-UHFFFAOYSA-N	0	3	344.503	3.472	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H]2CCC[C@]2(CNCc2ocnc2C)C1	ZINC001112375553	1368801471	/nfs/dbraw/zinc/80/14/71/1368801471.db2.gz	ZITXICJYUSTTOA-JXFKEZNVSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CC1(CC(=O)N2CCCN(C[C@H](CC)OC)CC2)CCCCC1	ZINC001197440823	1368815350	/nfs/dbraw/zinc/81/53/50/1368815350.db2.gz	NSIQQSDUYCMMLW-SFHVURJKSA-N	0	3	336.520	3.472	20	30		EGEDHN
C=CC1(CC(=O)N2CCCN(CCC[C@H](C)O)CC2)CCCCC1	ZINC001197440654	1368815368	/nfs/dbraw/zinc/81/53/68/1368815368.db2.gz	JPZVBQYLHTVLAE-SFHVURJKSA-N	0	3	336.520	3.208	20	30		EGEDHN
C=CCCOCC(=O)N1CCCN(CCCc2ccc(C)cc2)CC1	ZINC001198324303	1369009151	/nfs/dbraw/zinc/00/91/51/1369009151.db2.gz	MQBJKRHXFMKGPV-UHFFFAOYSA-N	0	3	344.499	3.055	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)c1ccoc1C)c1ccccc1OC	ZINC001198522337	1369051282	/nfs/dbraw/zinc/05/12/82/1369051282.db2.gz	JYYGWSOJSOBNFB-KRWDZBQOSA-N	0	3	328.412	3.233	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)C[C@@H]1C=CCC1)c1ccccc1OC	ZINC001198522329	1369051693	/nfs/dbraw/zinc/05/16/93/1369051693.db2.gz	JTKCTUYNXKWOKC-SJLPKXTDSA-N	0	3	328.456	3.375	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)c1ccoc1)c1ccccc1OC	ZINC001198530349	1369054442	/nfs/dbraw/zinc/05/44/42/1369054442.db2.gz	QKEFEZGCCSXKAV-QGZVFWFLSA-N	0	3	328.412	3.315	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)CSC(C)C)c1ccccc1OC	ZINC001198539334	1369056417	/nfs/dbraw/zinc/05/64/17/1369056417.db2.gz	BRVWFXWCNQZIDE-MRXNPFEDSA-N	0	3	336.501	3.160	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)CCCOCC)c1ccccc1OC	ZINC001198566395	1369061642	/nfs/dbraw/zinc/06/16/42/1369061642.db2.gz	IZAVRFMAHWASEE-GOSISDBHSA-N	0	3	348.487	3.225	20	30		EGEDHN
C=CCC[C@@H](C)N[C@H](CNC(=O)CCCOC)c1ccccc1OC	ZINC001198567242	1369061709	/nfs/dbraw/zinc/06/17/09/1369061709.db2.gz	NWOQVDFUJJZLBQ-SJLPKXTDSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@H]1[C@@H]2CCCC[C@@H]21)c1ccccc1OC	ZINC001198634941	1369078540	/nfs/dbraw/zinc/07/85/40/1369078540.db2.gz	AVHIPRDHZHAVLM-WBQJQJEBSA-N	0	3	342.483	3.454	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)c1ocnc1C)c1ccccc1OC	ZINC001198648213	1369081616	/nfs/dbraw/zinc/08/16/16/1369081616.db2.gz	UKOHNMHLHPWWTQ-INIZCTEOSA-N	0	3	343.427	3.019	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)CC[C@H](C)OC)c1ccccc1OC	ZINC001198676792	1369088600	/nfs/dbraw/zinc/08/86/00/1369088600.db2.gz	CYYSBEUEGYTVOO-WMZOPIPTSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCOCCCCC(=O)NC[C@H](NCC)c1ccccc1OC	ZINC001198723830	1369099837	/nfs/dbraw/zinc/09/98/37/1369099837.db2.gz	LCNARWNTNBAMCO-SFHVURJKSA-N	0	3	348.487	3.225	20	30		EGEDHN
CCCCCCN[C@H](CNC(=O)C#CC1CC1)c1ccccc1OC	ZINC001198724082	1369100915	/nfs/dbraw/zinc/10/09/15/1369100915.db2.gz	PHBIUORJWJEHSA-LJQANCHMSA-N	0	3	342.483	3.436	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)CC(C)(C)COC)c1ccccc1OC	ZINC001198805556	1369118406	/nfs/dbraw/zinc/11/84/06/1369118406.db2.gz	BMWRSTUZBNCLKA-QGZVFWFLSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)c1csc(C)n1)c1ccccc1OC	ZINC001198864699	1369134252	/nfs/dbraw/zinc/13/42/52/1369134252.db2.gz	FXVQVJZAODJCHF-HNNXBMFYSA-N	0	3	345.468	3.097	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@@H](CC(C)C)OC)c1ccccc1OC	ZINC001198885442	1369139346	/nfs/dbraw/zinc/13/93/46/1369139346.db2.gz	HYZUSYJCASDKPE-IEBWSBKVSA-N	0	3	348.487	3.079	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)CC(C)(F)F)c1ccccc1OC	ZINC001198885666	1369140041	/nfs/dbraw/zinc/14/00/41/1369140041.db2.gz	NZQTVVYFMSCUBM-OAHLLOKOSA-N	0	3	340.414	3.454	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@H](NCC2CC2)c2ccccc2OC)C1	ZINC001198894162	1369141987	/nfs/dbraw/zinc/14/19/87/1369141987.db2.gz	FAZPXRLGPBGKAL-QGZVFWFLSA-N	0	3	328.456	3.208	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)c1c[nH]cc1C)c1ccccc1OC	ZINC001198985097	1369166304	/nfs/dbraw/zinc/16/63/04/1369166304.db2.gz	WAWMZTJVZDBXMI-SFHVURJKSA-N	0	3	341.455	3.359	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)Cc2cc(F)c(C)cc2F)CC1	ZINC001113139556	1369224443	/nfs/dbraw/zinc/22/44/43/1369224443.db2.gz	TZTRBYCHRASWOV-HNNXBMFYSA-N	0	3	336.426	3.315	20	30		EGEDHN
C=C(Br)CNC1CCN(C(=O)[C@H](C)CCCC)CC1	ZINC001200380876	1369357633	/nfs/dbraw/zinc/35/76/33/1369357633.db2.gz	BKTZPGGFDMQKCK-GFCCVEGCSA-N	0	3	331.298	3.302	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC(NCc2oc(CC)nc2C)CC1	ZINC001200748009	1369422701	/nfs/dbraw/zinc/42/27/01/1369422701.db2.gz	SKXJOKAOTXXNJI-UHFFFAOYSA-N	0	3	345.487	3.394	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)C[C@H]2OCc3ccccc32)CC1	ZINC001113591940	1369505172	/nfs/dbraw/zinc/50/51/72/1369505172.db2.gz	SGQADCLRQSHGAY-VQIMIIECSA-N	0	3	328.456	3.147	20	30		EGEDHN
C=CCCCC(=O)N1CCCO[C@@H](CN[C@H](C)c2ccccc2F)C1	ZINC001201284501	1369510631	/nfs/dbraw/zinc/51/06/31/1369510631.db2.gz	UZBWMPOITGZGDE-SJORKVTESA-N	0	3	348.462	3.450	20	30		EGEDHN
C=CCCCC(=O)N1CCCO[C@@H](CNCc2cc(C)ccc2F)C1	ZINC001201294112	1369512046	/nfs/dbraw/zinc/51/20/46/1369512046.db2.gz	RCSYZPDHZZODRD-SFHVURJKSA-N	0	3	348.462	3.198	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)CCCOc2ccccc2)CC1	ZINC001113606478	1369515848	/nfs/dbraw/zinc/51/58/48/1369515848.db2.gz	OTLYVVQCLDHYMO-SFHVURJKSA-N	0	3	330.472	3.345	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)c2ccc(CN(CC)CC)o2)CC1	ZINC001113717196	1369584179	/nfs/dbraw/zinc/58/41/79/1369584179.db2.gz	QSYQDTJEKHJSCP-QGZVFWFLSA-N	0	3	347.503	3.234	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)CC(F)(F)C(F)(F)F)CC1	ZINC001113743467	1369597725	/nfs/dbraw/zinc/59/77/25/1369597725.db2.gz	LHYWTTXFXNPDKK-LLVKDONJSA-N	0	3	328.325	3.073	20	30		EGEDHN
CCCCCCCCCN1CC[C@@H]2[C@H]1CC(=O)N2c1cnn(C)c1	ZINC001201840422	1369632225	/nfs/dbraw/zinc/63/22/25/1369632225.db2.gz	ZYWPLGIVMHANHI-QZTJIDSGSA-N	0	3	332.492	3.350	20	30		EGEDHN
CCCCCCCCN1CCN(c2ncccc2C(=O)N(C)C)CC1	ZINC001201839422	1369632312	/nfs/dbraw/zinc/63/23/12/1369632312.db2.gz	CLPKORHUALTOLH-UHFFFAOYSA-N	0	3	346.519	3.266	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001202130169	1369696202	/nfs/dbraw/zinc/69/62/02/1369696202.db2.gz	IFERMUZQQOVTNI-HNNXBMFYSA-N	0	3	343.446	3.380	20	30		EGEDHN
CC(C)CC(=O)N[C@H]1C[C@H](NCC#Cc2ccc(F)cc2)C12CCC2	ZINC001202341041	1369743067	/nfs/dbraw/zinc/74/30/67/1369743067.db2.gz	MAFAIWPFVBQPMF-OALUTQOASA-N	0	3	342.458	3.240	20	30		EGEDHN
CC[C@H](CC(C)C)C(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001186902391	1388025684	/nfs/dbraw/zinc/02/56/84/1388025684.db2.gz	GJCFOOINPQLCSF-SJLPKXTDSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@@H](NC(=O)/C(C)=C/CC)C12CCC2	ZINC001202583610	1369814173	/nfs/dbraw/zinc/81/41/73/1369814173.db2.gz	ZFTGPTHVESHJGY-GFUGXAQUSA-N	0	3	341.293	3.268	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@@H](NCc2cnc(Cl)s2)C12CCC2	ZINC001202593157	1369816928	/nfs/dbraw/zinc/81/69/28/1369816928.db2.gz	XXHPRURDIACBRU-OLZOCXBDSA-N	0	3	339.892	3.280	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@@H](NCc2cc(F)ccc2F)C12CCC2	ZINC001202592504	1369817090	/nfs/dbraw/zinc/81/70/90/1369817090.db2.gz	UDPJFXYGYGSVDS-SJORKVTESA-N	0	3	334.410	3.448	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)CCC2CC2)C12CCC2	ZINC001202655007	1369838781	/nfs/dbraw/zinc/83/87/81/1369838781.db2.gz	NOSCTUAZWXMTAC-UONOGXRCSA-N	0	3	341.293	3.102	20	30		EGEDHN
C/C=C(\C)C(=O)N[C@@H]1C[C@H](NCc2ccc(C#N)cc2F)C12CCC2	ZINC001202726755	1369868652	/nfs/dbraw/zinc/86/86/52/1369868652.db2.gz	USSCMZVXGUZHSZ-XUAIMZCTSA-N	0	3	341.430	3.181	20	30		EGEDHN
O=C(N[C@@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2)C1=CCCC1	ZINC001202755678	1369879568	/nfs/dbraw/zinc/87/95/68/1369879568.db2.gz	PCNGBEHNESYLTM-VQTJNVASSA-N	0	3	334.463	3.165	20	30		EGEDHN
N#Cc1cccc(NC(=O)N2CC[C@@H]3CN(Cc4ccccc4)C[C@H]32)c1	ZINC001202788412	1369892682	/nfs/dbraw/zinc/89/26/82/1369892682.db2.gz	NWQSUEUGKSVNPV-UYAOXDASSA-N	0	3	346.434	3.296	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1C[C@H](NCc2cccc(Cl)n2)C12CCC2	ZINC001202845729	1369906494	/nfs/dbraw/zinc/90/64/94/1369906494.db2.gz	DPWFLJJLNNFUBY-HOTGVXAUSA-N	0	3	345.874	3.056	20	30		EGEDHN
O=C(C#CC1CC1)N[C@@H]1C[C@H](NCc2sccc2Cl)C12CCC2	ZINC001202888769	1369917754	/nfs/dbraw/zinc/91/77/54/1369917754.db2.gz	UBOWLDBHRAZODN-JKSUJKDBSA-N	0	3	348.899	3.332	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1C[C@H](NCc2ocnc2C)C12CCC2	ZINC001202959126	1369936402	/nfs/dbraw/zinc/93/64/02/1369936402.db2.gz	AHUUEXVELGTHGP-ZWKOTPCHSA-N	0	3	343.471	3.268	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@H]1C[C@@H](NCc2ccccn2)C12CCC2	ZINC001202960704	1369937161	/nfs/dbraw/zinc/93/71/61/1369937161.db2.gz	QGQIXFFMLTZJOA-CVEARBPZSA-N	0	3	347.890	3.377	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1C[C@H](NCc2ccc(F)cn2)C12CCC2	ZINC001202960210	1369937176	/nfs/dbraw/zinc/93/71/76/1369937176.db2.gz	KSJRUFGPUDBIAE-DLBZAZTESA-N	0	3	345.462	3.340	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1C[C@@H](NCc2cncs2)C12CCC2	ZINC001202967569	1369939328	/nfs/dbraw/zinc/93/93/28/1369939328.db2.gz	CHAGZQNNOHMJKR-CABCVRRESA-N	0	3	333.501	3.262	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1C[C@H](NCc2cnc(C)o2)C12CCC2	ZINC001202967796	1369939389	/nfs/dbraw/zinc/93/93/89/1369939389.db2.gz	GSTHEZOTGAJHLU-JKSUJKDBSA-N	0	3	331.460	3.102	20	30		EGEDHN
N#Cc1cccc(O[C@@H]2CCCN(Cc3cccc4nonc43)C2)c1	ZINC001203139220	1369995889	/nfs/dbraw/zinc/99/58/89/1369995889.db2.gz	FICNRTVORZUOSR-QGZVFWFLSA-N	0	3	334.379	3.138	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1[C@H]2CN(Cc3cccc(OC)c3C)C[C@H]21	ZINC001114680304	1370021997	/nfs/dbraw/zinc/02/19/97/1370021997.db2.gz	GYBSGTNGRVZSJR-DZFIZOCASA-N	0	3	342.483	3.152	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cc(CC)no1)[C@@H]2CC	ZINC001203217750	1370028933	/nfs/dbraw/zinc/02/89/33/1370028933.db2.gz	ISPFZRAGTSJBOY-MJGOQNOKSA-N	0	3	331.460	3.159	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1C[C@H](NCc2ncccc2C)C12CCC2	ZINC001203273513	1370054413	/nfs/dbraw/zinc/05/44/13/1370054413.db2.gz	IWJNUXKIHCYAEP-DLBZAZTESA-N	0	3	327.472	3.119	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1C[C@@H](NCc2ncccc2C)C12CCC2	ZINC001203281112	1370059704	/nfs/dbraw/zinc/05/97/04/1370059704.db2.gz	MUDPBWFFJSCBAU-RTBURBONSA-N	0	3	339.483	3.101	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1C[C@H](NCc2ccccn2)C12CCC2	ZINC001203295312	1370066928	/nfs/dbraw/zinc/06/69/28/1370066928.db2.gz	JRFIQTBTXICLSK-OALUTQOASA-N	0	3	339.483	3.182	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1C[C@H](NCc2ccc(F)cn2)C12CCC2	ZINC001203339678	1370089011	/nfs/dbraw/zinc/08/90/11/1370089011.db2.gz	IWZBTFOHAXFNOH-DLBZAZTESA-N	0	3	331.435	3.094	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@H](OCC4CC4)CO3)CC2)c1	ZINC001203758298	1370251680	/nfs/dbraw/zinc/25/16/80/1370251680.db2.gz	VTZZFBYSDLUKMD-IBGZPJMESA-N	0	3	326.440	3.108	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)CCCn2cccc2)C12CCC2	ZINC001203770212	1370258047	/nfs/dbraw/zinc/25/80/47/1370258047.db2.gz	FGBJBOSOABMRRT-HOTGVXAUSA-N	0	3	335.879	3.038	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2[C@H]3CN(CCOC4CCC4)C[C@H]32)CCCCC1	ZINC001115278260	1370357100	/nfs/dbraw/zinc/35/71/00/1370357100.db2.gz	PQQMHSGMBMGWJS-BWTSREIZSA-N	0	3	346.515	3.129	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CCCN(Cc3cccnc3)C2)CC1	ZINC001204068783	1370366262	/nfs/dbraw/zinc/36/62/62/1370366262.db2.gz	IAPLURHUUABWCZ-UHFFFAOYSA-N	0	3	329.444	3.082	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)C3CC3)CCCCC2)c(F)c1	ZINC001115374170	1370415489	/nfs/dbraw/zinc/41/54/89/1370415489.db2.gz	NDKRPTXKQUYZBK-UHFFFAOYSA-N	0	3	329.419	3.016	20	30		EGEDHN
C=CCOc1ccc(CN2CCC(N(CC)C(=O)CC)CC2)cc1	ZINC001204302895	1370437645	/nfs/dbraw/zinc/43/76/45/1370437645.db2.gz	WNJGIXYKKSYZJX-UHFFFAOYSA-N	0	3	330.472	3.474	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)[C@H](C)SC)CCCCC1	ZINC001115419496	1370444303	/nfs/dbraw/zinc/44/43/03/1370444303.db2.gz	USGAWVTVQALFQB-LBPRGKRZSA-N	0	3	349.338	3.055	20	30		EGEDHN
CC(C)(C)C#CC(=O)NCC1(NCc2ccns2)CCCCC1	ZINC001115529305	1370528251	/nfs/dbraw/zinc/52/82/51/1370528251.db2.gz	LZWJXUZTHCVDIJ-UHFFFAOYSA-N	0	3	333.501	3.101	20	30		EGEDHN
C=C(C)CCC(=O)NCC1(NCc2snnc2C)CCCCC1	ZINC001115557200	1370555903	/nfs/dbraw/zinc/55/59/03/1370555903.db2.gz	YYLDZTNEPWBVQA-UHFFFAOYSA-N	0	3	336.505	3.112	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccc3[nH]ccc3n2)CCCCC1	ZINC001115627421	1370620544	/nfs/dbraw/zinc/62/05/44/1370620544.db2.gz	DUGSMBBDIWJCQJ-UHFFFAOYSA-N	0	3	346.862	3.338	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ncc(C)cc2C)CCCCC1	ZINC001115640583	1370632475	/nfs/dbraw/zinc/63/24/75/1370632475.db2.gz	CATXJQMKXJQDJU-UHFFFAOYSA-N	0	3	335.879	3.473	20	30		EGEDHN
C#CCCCCC(=O)N1CCC(CNCc2nc(C)sc2C)CC1	ZINC001205027704	1370633541	/nfs/dbraw/zinc/63/35/41/1370633541.db2.gz	XYWPWBIXAVAGNL-UHFFFAOYSA-N	0	3	347.528	3.282	20	30		EGEDHN
C=CCCN1C[C@@H](O)[C@H](N(Cc2ccccc2)C(=O)CCC(C)C)C1	ZINC001205079468	1370644194	/nfs/dbraw/zinc/64/41/94/1370644194.db2.gz	HDSNSFBKGXQUNN-WOJBJXKFSA-N	0	3	344.499	3.073	20	30		EGEDHN
C#CCCCCCC(=O)NCC1(NCc2cnoc2C)CCCCC1	ZINC001115667819	1370648879	/nfs/dbraw/zinc/64/88/79/1370648879.db2.gz	KRUKFLYUGIAOOK-UHFFFAOYSA-N	0	3	345.487	3.475	20	30		EGEDHN
CN(C)Cc1ccc(-c2noc(Cc3ccc(F)c(C#N)c3)n2)cc1	ZINC001205124832	1370657463	/nfs/dbraw/zinc/65/74/63/1370657463.db2.gz	DKUMDGAKQRODAD-UHFFFAOYSA-N	0	3	336.370	3.400	20	30		EGEDHN
CC#CCCCC(=O)NCC1(NCc2ncccc2C)CCCCC1	ZINC001115681241	1370663439	/nfs/dbraw/zinc/66/34/39/1370663439.db2.gz	CPUQPOKOVLEXIA-UHFFFAOYSA-N	0	3	341.499	3.492	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N(Cc1ccccc1)[C@@H]1CN(CCC)C[C@H]1O	ZINC001205181695	1370671729	/nfs/dbraw/zinc/67/17/29/1370671729.db2.gz	GXZVSTUPONERRU-SBHAEUEKSA-N	0	3	344.499	3.073	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CCC(CNCc2c(F)cccc2F)CC1	ZINC001205235652	1370690195	/nfs/dbraw/zinc/69/01/95/1370690195.db2.gz	FQMHPMGEVJGOPN-UHFFFAOYSA-N	0	3	348.437	3.343	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@H]2CC2(C)C)CC[C@H]1c1ccc(F)cc1	ZINC001205270094	1370701041	/nfs/dbraw/zinc/70/10/41/1370701041.db2.gz	LFGKOTPHQWJXBA-IPMKNSEASA-N	0	3	342.458	3.169	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C=C(CC)CC)CC[C@H]1c1ccc(F)cc1	ZINC001205270394	1370702033	/nfs/dbraw/zinc/70/20/33/1370702033.db2.gz	WMJOOCWGPOLRDO-VQTJNVASSA-N	0	3	342.458	3.479	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C[C@H](C=C)CC)CC[C@H]1c1ccc(F)cc1	ZINC001205307196	1370716058	/nfs/dbraw/zinc/71/60/58/1370716058.db2.gz	UEISMCCNXLGKSH-LSTHTHJFSA-N	0	3	342.458	3.335	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)CCCC=C)CC[C@H]1c1ccc(F)cc1	ZINC001205306856	1370716456	/nfs/dbraw/zinc/71/64/56/1370716456.db2.gz	AYMDGZVOUBEHNI-RBUKOAKNSA-N	0	3	328.431	3.089	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C(C)(C)CC=C)CC[C@H]1c1ccc(F)cc1	ZINC001205312940	1370718255	/nfs/dbraw/zinc/71/82/55/1370718255.db2.gz	JVZICFNWDBUZTR-RBUKOAKNSA-N	0	3	342.458	3.335	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](c2cccc(F)c2)[C@H](NC[C@H](F)CC)C1	ZINC001205386037	1370738259	/nfs/dbraw/zinc/73/82/59/1370738259.db2.gz	CHWWOGJANLSYNT-BPQIPLTHSA-N	0	3	336.426	3.424	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC(CNCc2nc(C)cs2)CC1	ZINC001205394856	1370741603	/nfs/dbraw/zinc/74/16/03/1370741603.db2.gz	AQVIAEMISXSMKS-UHFFFAOYSA-N	0	3	335.517	3.382	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](c2cccc(F)c2)[C@H](NC[C@H](F)CC)C1	ZINC001205406062	1370746074	/nfs/dbraw/zinc/74/60/74/1370746074.db2.gz	CUODZBCSFZSGTR-NZSAHSFTSA-N	0	3	348.437	3.261	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](c2cccc(F)c2)[C@H](NCC#CC)C1	ZINC001205412536	1370747345	/nfs/dbraw/zinc/74/73/45/1370747345.db2.gz	VEKFOYXSRNGFFG-RBUKOAKNSA-N	0	3	328.431	3.089	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)C[C@@H](C)CC(C)C)[C@@H]3COC[C@@H]32)CC1	ZINC001205516744	1370778053	/nfs/dbraw/zinc/77/80/53/1370778053.db2.gz	SKDORDYPXTZYKJ-GBESFXJTSA-N	0	3	348.531	3.184	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC(CNCc2oc(C)nc2C)CC1	ZINC001205988303	1370930635	/nfs/dbraw/zinc/93/06/35/1370930635.db2.gz	DSNJTKSJIPGKPV-MRXNPFEDSA-N	0	3	333.476	3.222	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC(CNCc2nc(C)cs2)CC1	ZINC001205988612	1370931050	/nfs/dbraw/zinc/93/10/50/1370931050.db2.gz	ISUKYFPCEDHJEL-OAHLLOKOSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=CCCCC(=O)N1CCC(CNCc2cc(C3CC3)no2)CC1	ZINC001206105826	1370961183	/nfs/dbraw/zinc/96/11/83/1370961183.db2.gz	RPWNEIVEIOAPSC-UHFFFAOYSA-N	0	3	331.460	3.237	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc3c(c2)CCC3)C[C@H]1NC(=O)C#CC(C)(C)C	ZINC001206949814	1371242040	/nfs/dbraw/zinc/24/20/40/1371242040.db2.gz	QPXFQZNXNWUHRV-OXQOHEQNSA-N	0	3	338.495	3.161	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@@H](NCC#Cc2ccccc2Cl)C1	ZINC001207091607	1371290814	/nfs/dbraw/zinc/29/08/14/1371290814.db2.gz	RRHYZKRGEMUNBX-QGZVFWFLSA-N	0	3	332.875	3.318	20	30		EGEDHN
Cn1cc(CN2CCN([C@@H]3CCCc4ccccc43)CC2)cc1C#N	ZINC001207108684	1371295563	/nfs/dbraw/zinc/29/55/63/1371295563.db2.gz	IBHNEKQYFIUNSK-OAQYLSRUSA-N	0	3	334.467	3.092	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CN(Cc2ccc3c(c2)COC3)C[C@H]1C	ZINC001207157968	1371314053	/nfs/dbraw/zinc/31/40/53/1371314053.db2.gz	CDTHURPDPUOMRX-DNVCBOLYSA-N	0	3	342.483	3.256	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CN(C[C@@H](OC)c2ccccc2)C[C@H]1C	ZINC001207165555	1371317213	/nfs/dbraw/zinc/31/72/13/1371317213.db2.gz	TYQBCLWGPPBKIM-BHIYHBOVSA-N	0	3	344.499	3.413	20	30		EGEDHN
C=CCN(CC=C)CCN1CCN(CCc2cccc(Cl)c2)CC1	ZINC001207426126	1371391968	/nfs/dbraw/zinc/39/19/68/1371391968.db2.gz	VXYGVELWTPYAMM-UHFFFAOYSA-N	0	3	347.934	3.174	20	30		EGEDHN
CCOC(=O)C1(C#N)CCN(CC[C@@H](C)CCCC(C)(C)O)CC1	ZINC001207684347	1371474087	/nfs/dbraw/zinc/47/40/87/1371474087.db2.gz	ZWLKXSWVXXVOEZ-INIZCTEOSA-N	0	3	338.492	3.123	20	30		EGEDHN
CCC[C@H](C)C(=O)N1CCC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001207717602	1371484837	/nfs/dbraw/zinc/48/48/37/1371484837.db2.gz	JJTDHMKZHVQCOG-WMLDXEAASA-N	0	3	331.435	3.214	20	30		EGEDHN
O=C(C1CC=CC1)N1CCC[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001207729656	1371487092	/nfs/dbraw/zinc/48/70/92/1371487092.db2.gz	WLKDFFFFSNCVEH-SFHVURJKSA-N	0	3	342.870	3.238	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC[C@@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207763999	1371497750	/nfs/dbraw/zinc/49/77/50/1371497750.db2.gz	JNLBXKUDIRWYMW-TUEGSCMLSA-N	0	3	330.859	3.238	20	30		EGEDHN
C#CCCCCC(=O)N1CCC[C@@H](NCc2c(C)nsc2C)C1	ZINC001207860322	1371522806	/nfs/dbraw/zinc/52/28/06/1371522806.db2.gz	JJEIEMVYXCOVBY-MRXNPFEDSA-N	0	3	333.501	3.034	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H]([C@H]2CCCN2Cc2snnc2C)C1	ZINC001120348324	1371543239	/nfs/dbraw/zinc/54/32/39/1371543239.db2.gz	UFGQCJHGUDIINP-JKSUJKDBSA-N	0	3	348.516	3.016	20	30		EGEDHN
CC1(C(=O)N2CCC[C@H](NCC#Cc3ccc(Cl)cc3)C2)CC1	ZINC001208100879	1371595758	/nfs/dbraw/zinc/59/57/58/1371595758.db2.gz	SBALYYKYKAJBLA-KRWDZBQOSA-N	0	3	330.859	3.072	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H]2CN(CCCCC(F)(F)F)C[C@H]21	ZINC001187737206	1388152581	/nfs/dbraw/zinc/15/25/81/1388152581.db2.gz	UZJLQUVOCWRNTO-LSDHHAIUSA-N	0	3	330.394	3.055	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN(CCOc2ccccc2C)C[C@H]1C	ZINC001208318042	1371715741	/nfs/dbraw/zinc/71/57/41/1371715741.db2.gz	GTWOGXLZELNZTI-IAGOWNOFSA-N	0	3	330.472	3.023	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1)C(C)(C)C	ZINC001208424463	1371762479	/nfs/dbraw/zinc/76/24/79/1371762479.db2.gz	ZFMIDWHWXMRBNK-MJGOQNOKSA-N	0	3	326.484	3.301	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN(Cc2ccc3c(c2)CCC3)C[C@H]1C	ZINC001208452526	1371771547	/nfs/dbraw/zinc/77/15/47/1371771547.db2.gz	PVFMBCZCCIUDPC-OXQOHEQNSA-N	0	3	326.484	3.468	20	30		EGEDHN
C[C@H](C#N)C(=O)NC1CC2(C1)CC(N[C@H](C)c1c(F)cccc1F)C2	ZINC001120859639	1371787171	/nfs/dbraw/zinc/78/71/71/1371787171.db2.gz	WUEVYIWVVWSMAD-JTRJEDKGSA-N	0	3	347.409	3.202	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1CN(Cc2cccc(COC)c2)C[C@H]1C	ZINC001208509186	1371793750	/nfs/dbraw/zinc/79/37/50/1371793750.db2.gz	VWYPRTJEHFXLGW-BSIFCXSSSA-N	0	3	344.499	3.372	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)C[C@@H](OCC)C(=C)C)C2	ZINC001121189376	1371883593	/nfs/dbraw/zinc/88/35/93/1371883593.db2.gz	MXNCHNTWAJXWJG-LMBQMVEXSA-N	0	3	340.895	3.127	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H]2[C@H](CN2CCc2ccc(C#N)cc2)C1	ZINC001208925755	1371947373	/nfs/dbraw/zinc/94/73/73/1371947373.db2.gz	QAILHCBOQZRTLX-QZTJIDSGSA-N	0	3	341.455	3.042	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001209147459	1372014737	/nfs/dbraw/zinc/01/47/37/1372014737.db2.gz	XEMZGIFBOCPWBL-PXNSSMCTSA-N	0	3	342.458	3.360	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001209147333	1372014902	/nfs/dbraw/zinc/01/49/02/1372014902.db2.gz	VXRGVQFTYHHCTN-QAPCUYQASA-N	0	3	343.446	3.380	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001209147390	1372015181	/nfs/dbraw/zinc/01/51/81/1372015181.db2.gz	WRHUHCWSWUPXBL-QAPCUYQASA-N	0	3	343.446	3.380	20	30		EGEDHN
C=CCCCN1Cc2ccnn2C[C@H](COCc2csc(C)n2)C1	ZINC001209161513	1372019760	/nfs/dbraw/zinc/01/97/60/1372019760.db2.gz	MFAFUNNQJFSAHH-MRXNPFEDSA-N	0	3	346.500	3.263	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC1CC2(CC(NCc3nccn3CC)C2)C1	ZINC001121609530	1372023052	/nfs/dbraw/zinc/02/30/52/1372023052.db2.gz	DXFBMUDBTDTFBV-UEBDJUODSA-N	0	3	344.503	3.022	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC1CC2(CC(NCc3cc(C)no3)C2)C1	ZINC001121611735	1372024729	/nfs/dbraw/zinc/02/47/29/1372024729.db2.gz	XZBAFXSIZXFFFM-XYLATYTLSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@@H](NCc2cc(CO)ccc2F)C1	ZINC001209182227	1372027254	/nfs/dbraw/zinc/02/72/54/1372027254.db2.gz	BHSXORABUNPYTK-CRAIPNDOSA-N	0	3	348.462	3.001	20	30		EGEDHN
C=CCCCC(=O)NC1CC2(CC(NCc3ccccc3C#N)C2)C1	ZINC001121663600	1372039720	/nfs/dbraw/zinc/03/97/20/1372039720.db2.gz	PGBPQQYISYADOB-UHFFFAOYSA-N	0	3	337.467	3.432	20	30		EGEDHN
C=CCOC(=O)N[C@H]1CCCN(CCCCOCc2ccccc2)C1	ZINC001209261985	1372053956	/nfs/dbraw/zinc/05/39/56/1372053956.db2.gz	YJZVRXBICVCSHD-IBGZPJMESA-N	0	3	346.471	3.360	20	30		EGEDHN
C=CCC1(C(=O)N2CCC[C@@H](NCc3cnc(C)s3)C2)CCC1	ZINC001209503892	1372122238	/nfs/dbraw/zinc/12/22/38/1372122238.db2.gz	NMMCQQKDWKJCKZ-OAHLLOKOSA-N	0	3	333.501	3.279	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)CCCc1cccnc1)C2	ZINC001121983119	1372145006	/nfs/dbraw/zinc/14/50/06/1372145006.db2.gz	TVGBSLJRUQMTFD-UHFFFAOYSA-N	0	3	347.890	3.174	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H](C)[C@H](NC(=O)c2snnc2C(C)C)C1	ZINC001209664064	1372164240	/nfs/dbraw/zinc/16/42/40/1372164240.db2.gz	KORICVHIIXIHEN-HZSPNIEDSA-N	0	3	336.505	3.066	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)CC[C@@H]1CC[C@@H](C)O1)C2	ZINC001122219480	1372204169	/nfs/dbraw/zinc/20/41/69/1372204169.db2.gz	GVEJCCQLXSZMFJ-UICTUYQUSA-N	0	3	340.895	3.104	20	30		EGEDHN
CC(C)N1CCC[C@H]1C(=O)C(C#N)c1nc(-c2ccncc2)cs1	ZINC001122567811	1372276464	/nfs/dbraw/zinc/27/64/64/1372276464.db2.gz	GSDWGWWXEJDPPS-HOCLYGCPSA-N	0	3	340.452	3.254	20	30		EGEDHN
N#CC(C(=O)CC1c2ccccc2Oc2ccccc21)C(=O)NC1CC1	ZINC001122624412	1372286081	/nfs/dbraw/zinc/28/60/81/1372286081.db2.gz	BLKMYVPAOJZMKQ-KRWDZBQOSA-N	0	3	346.386	3.302	20	30		EGEDHN
CC(C)C[C@H](C)C(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001210359413	1372332924	/nfs/dbraw/zinc/33/29/24/1372332924.db2.gz	WNWJESCRBJHRGA-FXAWDEMLSA-N	0	3	344.474	3.440	20	30		EGEDHN
O=C(N1CCC[C@@H](NCC#Cc2ccccc2)C1)C1(F)CCCCC1	ZINC001210456935	1372358147	/nfs/dbraw/zinc/35/81/47/1372358147.db2.gz	PTPNNKKZALOUTC-LJQANCHMSA-N	0	3	342.458	3.291	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1)C1CCCC1	ZINC001210584991	1372385256	/nfs/dbraw/zinc/38/52/56/1372385256.db2.gz	NUBAMFRGTWMEIX-WIYYLYMNSA-N	0	3	338.495	3.445	20	30		EGEDHN
C[C@H](CC(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1)C1CC1	ZINC001211276320	1372519131	/nfs/dbraw/zinc/51/91/31/1372519131.db2.gz	FKCZMPGJIUFPFM-OXQOHEQNSA-N	0	3	342.458	3.194	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1CN(Cc2ccc(CCC)cc2)C[C@H]1C	ZINC001211420794	1372555186	/nfs/dbraw/zinc/55/51/86/1372555186.db2.gz	QZZSGGJQJDKWNA-YLJYHZDGSA-N	0	3	344.499	3.168	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1CN([C@H](CC)c2ccc(F)cc2)C[C@H]1C	ZINC001211422987	1372555632	/nfs/dbraw/zinc/55/56/32/1372555632.db2.gz	WIIPITWLUDWCOV-ATZDWAIDSA-N	0	3	348.462	3.306	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2cc(C)oc2C)C[C@H]1c1ccccc1	ZINC001211526200	1372573053	/nfs/dbraw/zinc/57/30/53/1372573053.db2.gz	BEPHHEQGIBWCNH-VQTJNVASSA-N	0	3	336.435	3.118	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@H]2CC23CCCC3)C[C@H]1c1ccccc1	ZINC001211703049	1372605749	/nfs/dbraw/zinc/60/57/49/1372605749.db2.gz	ROWKMTJRMPVZPK-XUVXKRRUSA-N	0	3	336.479	3.174	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@@H](C)c2ccccc2)C[C@H]1c1ccccc1	ZINC001211709810	1372606393	/nfs/dbraw/zinc/60/63/93/1372606393.db2.gz	ZDXSOVPFKJXHCV-YUXAGFNASA-N	0	3	346.474	3.398	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C[C@@H](CC)C(C)C)C[C@H]1c1ccccc1	ZINC001211711466	1372606645	/nfs/dbraw/zinc/60/66/45/1372606645.db2.gz	HPXMTVIIRDZLRX-YZGWKJHDSA-N	0	3	326.484	3.276	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2ccc(CC)cc2)C[C@H]1c1ccccc1	ZINC001211715602	1372607536	/nfs/dbraw/zinc/60/75/36/1372607536.db2.gz	FAENMTYKQZWQRY-FCHUYYIVSA-N	0	3	346.474	3.470	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2cccc(C)c2)[C@H](OC)C1	ZINC001211795640	1372616226	/nfs/dbraw/zinc/61/62/26/1372616226.db2.gz	XJRWDKQHPFYYKT-RTBURBONSA-N	0	3	330.472	3.170	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CN(Cc2cccc3ccccc32)C[C@H]1OC	ZINC001211999629	1372645232	/nfs/dbraw/zinc/64/52/32/1372645232.db2.gz	RSQATLFRUHERBZ-WOJBJXKFSA-N	0	3	338.451	3.121	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H](NC(=O)c2sccc2Cl)[C@H](OC)C1	ZINC001212303714	1372684410	/nfs/dbraw/zinc/68/44/10/1372684410.db2.gz	LAHBILRMCSULPQ-MRVWCRGKSA-N	0	3	342.892	3.185	20	30		EGEDHN
C=CCOCCCC(=O)NCCN[C@H](C)c1ccc(F)c(Cl)c1	ZINC001125260359	1372764843	/nfs/dbraw/zinc/76/48/43/1372764843.db2.gz	MNRVGFNTVHMVHF-CYBMUJFWSA-N	0	3	342.842	3.229	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H]2CN(CCOCC3CCC3)C[C@H]21	ZINC001188033841	1388222530	/nfs/dbraw/zinc/22/25/30/1388222530.db2.gz	PBNFJBVFTMWOHP-VQTJNVASSA-N	0	3	346.515	3.104	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)C2(C(C)(F)F)CC2)[C@H](OC)C1	ZINC001213455836	1372908035	/nfs/dbraw/zinc/90/80/35/1372908035.db2.gz	PWBHWMYIAHAPBD-HUUCEWRRSA-N	0	3	346.462	3.208	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)[C@]2(C)CC[C@H](C)C2(C)C)[C@H](OC)C1	ZINC001213532087	1372921329	/nfs/dbraw/zinc/92/13/29/1372921329.db2.gz	RMIXPRPHTYENOF-XLSPSMHOSA-N	0	3	336.520	3.230	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2cccc(C)c2Cl)[C@H](OC)C1	ZINC001213593413	1372931283	/nfs/dbraw/zinc/93/12/83/1372931283.db2.gz	YSNXZQWDHJFSBM-HZPDHXFCSA-N	0	3	336.863	3.044	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)Cc2ccccc2C)[C@H](OC)C1	ZINC001213833482	1372968937	/nfs/dbraw/zinc/96/89/37/1372968937.db2.gz	PXJQBHIDGGPNOT-WOJBJXKFSA-N	0	3	344.499	3.099	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2=CCCCC2)C[C@H]1NCC#Cc1ccccc1	ZINC001214319725	1373043835	/nfs/dbraw/zinc/04/38/35/1373043835.db2.gz	ARPXAVVLZGWXBQ-WIYYLYMNSA-N	0	3	336.479	3.365	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CC=CC2)C[C@H]1NCC#Cc1cccc(Cl)c1	ZINC001214380112	1373051766	/nfs/dbraw/zinc/05/17/66/1373051766.db2.gz	MQTVGTUPFWRMEF-DNVCBOLYSA-N	0	3	342.870	3.094	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCC2CCC2)C[C@H]1NCC#Cc1ccc(F)cc1	ZINC001214409139	1373056666	/nfs/dbraw/zinc/05/66/66/1373056666.db2.gz	KUVOAROFBUNAKL-OXQOHEQNSA-N	0	3	342.458	3.194	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@H]2CC2(C)C)C[C@H]1NCC#Cc1cccc(Cl)c1	ZINC001214445766	1373062665	/nfs/dbraw/zinc/06/26/65/1373062665.db2.gz	MAICAUWDVWEFEC-ZTFGCOKTSA-N	0	3	344.886	3.174	20	30		EGEDHN
C[C@@H]1CN(C(=O)C#CC(C)(C)C)C[C@H]1NCc1sccc1Cl	ZINC001214589478	1373086433	/nfs/dbraw/zinc/08/64/33/1373086433.db2.gz	KMZPEDUOOJEDFP-TZMCWYRMSA-N	0	3	338.904	3.388	20	30		EGEDHN
C=CCCOCCCCC(=O)NCCNCc1ccc(C)c(F)c1	ZINC001127129153	1373092777	/nfs/dbraw/zinc/09/27/77/1373092777.db2.gz	ODNLMZQIBXCXPP-UHFFFAOYSA-N	0	3	336.451	3.103	20	30		EGEDHN
C=CCCOCCCCC(=O)NCCN[C@H](C)c1cccc(F)c1	ZINC001127129523	1373093055	/nfs/dbraw/zinc/09/30/55/1373093055.db2.gz	UGCAPVJWWVAOIC-MRXNPFEDSA-N	0	3	336.451	3.356	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](C)[C@H](NCc2cc(F)ccc2OC)C1	ZINC001214730339	1373111064	/nfs/dbraw/zinc/11/10/64/1373111064.db2.gz	XHJIXGIZMPEPDQ-RHSMWYFYSA-N	0	3	348.462	3.373	20	30		EGEDHN
C[C@H](C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(F)cc2)C1)C1CCC1	ZINC001214938255	1373145216	/nfs/dbraw/zinc/14/52/16/1373145216.db2.gz	IXUJOLIBMNFQID-GQIGUUNPSA-N	0	3	342.458	3.050	20	30		EGEDHN
C[C@@H](C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(F)cc2)C1)C(C)(C)C	ZINC001214967159	1373149251	/nfs/dbraw/zinc/14/92/51/1373149251.db2.gz	QRLATRIBUHXYAY-JTDSTZFVSA-N	0	3	344.474	3.296	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2C(C)(C)C)C[C@H]1NCC#Cc1ccccc1	ZINC001215126111	1373174631	/nfs/dbraw/zinc/17/46/31/1373174631.db2.gz	LQXADPNUALOYMP-VBSBHUPXSA-N	0	3	338.495	3.157	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NCCN[C@@H]1CCc2c1cc(F)cc2F	ZINC001128190309	1373232386	/nfs/dbraw/zinc/23/23/86/1373232386.db2.gz	PBSDRLGFEOUAFX-OAHLLOKOSA-N	0	3	342.817	3.437	20	30		EGEDHN
C#CCC1(C(=O)NCCN[C@@H](C)c2ccc(F)c(Cl)c2)CCC1	ZINC001129142902	1373352664	/nfs/dbraw/zinc/35/26/64/1373352664.db2.gz	NNXCHYVJRYOVQV-ZDUSSCGKSA-N	0	3	336.838	3.440	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCO[C@@H]2CN(CC/C=C/CCC)C[C@@H]21	ZINC001217988757	1373528053	/nfs/dbraw/zinc/52/80/53/1373528053.db2.gz	XUGGDNSXBNOBRQ-GUKSKWGUSA-N	0	3	346.515	3.413	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)[C@@H](C)CC(C)(C)C)C1	ZINC001130431394	1373536175	/nfs/dbraw/zinc/53/61/75/1373536175.db2.gz	XBYHIQSKAFAQLT-LSDHHAIUSA-N	0	3	332.492	3.074	20	30		EGEDHN
C=C(C)CCC(=O)N1CCO[C@@H]2CN(CCC3CCCCC3)C[C@@H]21	ZINC001218036778	1373545218	/nfs/dbraw/zinc/54/52/18/1373545218.db2.gz	CREXHBNCNKMNJR-RBUKOAKNSA-N	0	3	334.504	3.225	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2coc3cc(F)ccc32)s1	ZINC001130634719	1373573263	/nfs/dbraw/zinc/57/32/63/1373573263.db2.gz	RIHRTAXBRKDZEJ-UHFFFAOYSA-N	0	3	343.383	3.025	20	30		EGEDHN
CC(C)=CCCC1=CC(=O)c2c(O)ccc(O[C@@H]3CN[C@H]3C)c2C1=O	ZINC001218391264	1373605289	/nfs/dbraw/zinc/60/52/89/1373605289.db2.gz	LLMORGNOFKWZEL-YVEFUNNKSA-N	0	3	341.407	3.183	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCO[C@@H]2CN(CC3CC4(CCC4)C3)C[C@@H]21	ZINC001218524520	1373629828	/nfs/dbraw/zinc/62/98/28/1373629828.db2.gz	YHWUQFLTCGZQLD-NZSAHSFTSA-N	0	3	346.515	3.081	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCO[C@@H]2CN(CCC3=CCCCC3)C[C@@H]21	ZINC001218523270	1373630347	/nfs/dbraw/zinc/63/03/47/1373630347.db2.gz	JERUMZSWRWPZNS-YSIASYRMSA-N	0	3	346.515	3.391	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)Cc2cccc(C(F)F)c2)s1	ZINC001131260092	1373671036	/nfs/dbraw/zinc/67/10/36/1373671036.db2.gz	NZHBAVFUGMHWGL-UHFFFAOYSA-N	0	3	349.406	3.006	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)CN(C(=O)CCCCC(C)(C)C)C[C@H](C)O2	ZINC001131661111	1373749377	/nfs/dbraw/zinc/74/93/77/1373749377.db2.gz	JPUGNHUYNNWZFT-GHTZIAJQSA-N	0	3	348.531	3.308	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C1(CC(C)C)CCC1)C[C@@H](C)O2	ZINC001131669871	1373753675	/nfs/dbraw/zinc/75/36/75/1373753675.db2.gz	VMLCRPZTXXTYAU-WIYYLYMNSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)CCCCC(C)C)C[C@@H](C)O2	ZINC001131694206	1373767442	/nfs/dbraw/zinc/76/74/42/1373767442.db2.gz	VYLKSISWFBDQOR-UYAOXDASSA-N	0	3	336.520	3.471	20	30		EGEDHN
C#CCCN1CC[C@]2(C1)CN(C(=O)CCCC1CCCC1)C[C@H](C)O2	ZINC001131701357	1373770584	/nfs/dbraw/zinc/77/05/84/1373770584.db2.gz	SRKRCFGLINWQDD-RXVVDRJESA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)CCCCc3ccc(C)cc3)[C@@H]2C1	ZINC001222072401	1373815547	/nfs/dbraw/zinc/81/55/47/1373815547.db2.gz	QOAIWTJWKLRXMO-NHCUHLMSSA-N	0	3	338.495	3.264	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](NCc3ccc(C#N)s3)C2)CCCC1	ZINC001188490585	1388318290	/nfs/dbraw/zinc/31/82/90/1388318290.db2.gz	SLBWBGWKJACRCB-OAHLLOKOSA-N	0	3	343.496	3.447	20	30		EGEDHN
CCCC1(C(=O)NCC2(NCc3ccc(C#N)s3)CCC2)CC1	ZINC001326889075	1388339688	/nfs/dbraw/zinc/33/96/88/1388339688.db2.gz	FYRMWJITSWAFOJ-UHFFFAOYSA-N	0	3	331.485	3.329	20	30		EGEDHN
C=CCOCCCC(=O)N[C@@H]1CC[C@@H](C)N(Cc2cccc(C)c2)C1	ZINC001131938346	1375056623	/nfs/dbraw/zinc/05/66/23/1375056623.db2.gz	FVLZOYKBNPRFDB-UYAOXDASSA-N	0	3	344.499	3.447	20	30		EGEDHN
C=CCOCCCC(=O)N[C@H]1CC[C@@H](C)N(Cc2ccccc2)C1	ZINC001131939253	1375057007	/nfs/dbraw/zinc/05/70/07/1375057007.db2.gz	PAUFFIGMYWCDDJ-MJGOQNOKSA-N	0	3	330.472	3.139	20	30		EGEDHN
C=CCOCCCC(=O)N[C@H]1CC[C@@H](C)N(Cc2cccc(C)c2)C1	ZINC001131938345	1375057359	/nfs/dbraw/zinc/05/73/59/1375057359.db2.gz	FVLZOYKBNPRFDB-QUCCMNQESA-N	0	3	344.499	3.447	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCC1CCN(Cc2cccnc2C)CC1	ZINC001224187350	1375060237	/nfs/dbraw/zinc/06/02/37/1375060237.db2.gz	PFGDWPVEKNSCPO-MRXNPFEDSA-N	0	3	329.488	3.321	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CC[C@@H](C)N(CCOCCC(C)C)C1	ZINC001131975968	1375078521	/nfs/dbraw/zinc/07/85/21/1375078521.db2.gz	GVFONWJVRGBATJ-RTBURBONSA-N	0	3	336.520	3.212	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@@H](C)N(CCOc2cccc(C)c2)C1	ZINC001131995120	1375088500	/nfs/dbraw/zinc/08/85/00/1375088500.db2.gz	GZEDGRHREBMADV-RTBURBONSA-N	0	3	342.483	3.146	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CC[C@@H](C)N(Cc2ccc(CF)cc2)C1	ZINC001132002423	1375093047	/nfs/dbraw/zinc/09/30/47/1375093047.db2.gz	JRLFFZGLJBWUDD-APWZRJJASA-N	0	3	330.447	3.429	20	30		EGEDHN
Cc1ccc(CN2C[C@H](NC(=O)C#CC(C)C)CC[C@H]2C)c(C)c1	ZINC001132021724	1375102231	/nfs/dbraw/zinc/10/22/31/1375102231.db2.gz	OWFJDCPXUSADHI-UYAOXDASSA-N	0	3	326.484	3.432	20	30		EGEDHN
C=C[C@@H](C(=O)NCC1CCN(Cc2ccccn2)CC1)c1ccccc1	ZINC001225535100	1375120778	/nfs/dbraw/zinc/12/07/78/1375120778.db2.gz	VFJQBQYQDQXYCQ-OAQYLSRUSA-N	0	3	349.478	3.380	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2csc(C)c2C)CC[C@H]1C	ZINC001132054415	1375121105	/nfs/dbraw/zinc/12/11/05/1375121105.db2.gz	OVNIXMVFMAHBTQ-CZUORRHYSA-N	0	3	336.501	3.150	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CC[C@@H](C)N(CCc2cnn(CC)c2)C1	ZINC001132060404	1375125170	/nfs/dbraw/zinc/12/51/70/1375125170.db2.gz	FIGUQRNHOKDANP-SJLPKXTDSA-N	0	3	346.519	3.017	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCOc2ccc(C)cc2C)CC[C@H]1C	ZINC001132083785	1375137828	/nfs/dbraw/zinc/13/78/28/1375137828.db2.gz	WVEQHWYBAQMIRW-MSOLQXFVSA-N	0	3	330.472	3.227	20	30		EGEDHN
C[C@H](C(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1)n1cccc1	ZINC001225698484	1375147049	/nfs/dbraw/zinc/14/70/49/1375147049.db2.gz	MEPSSYWSQUXDLL-HMXCVIKNSA-N	0	3	349.478	3.118	20	30		EGEDHN
C=CCCCN1C[C@H](NC(=O)c2nc3cccnc3s2)CC[C@H]1C	ZINC001132110849	1375152928	/nfs/dbraw/zinc/15/29/28/1375152928.db2.gz	MFVUAZXASQSSDI-ZIAGYGMSSA-N	0	3	344.484	3.240	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)C2(CCc3ccccc3)CC2)CC1	ZINC001225780617	1375154687	/nfs/dbraw/zinc/15/46/87/1375154687.db2.gz	NSTXTBROPSGTFM-UHFFFAOYSA-N	0	3	338.495	3.251	20	30		EGEDHN
CC(C)CCC(=O)NC1CCN(Cc2ccc(OCC#N)cc2)CC1	ZINC001225992771	1375185540	/nfs/dbraw/zinc/18/55/40/1375185540.db2.gz	BVGOGAPWFCUJOK-UHFFFAOYSA-N	0	3	343.471	3.106	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCc2ccc3[nH]ccc3c2)CC[C@@H]1C	ZINC001132177584	1375189750	/nfs/dbraw/zinc/18/97/50/1375189750.db2.gz	BXWTWEYDSBNLIW-MAUKXSAKSA-N	0	3	325.456	3.256	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1CC[C@@H](C)N(CCc2scnc2C)C1	ZINC001132257472	1375250740	/nfs/dbraw/zinc/25/07/40/1375250740.db2.gz	WHJOUVSDAHDOIU-ZBFHGGJFSA-N	0	3	335.517	3.319	20	30		EGEDHN
C#CCCCCCC(=O)NCCNCc1ccc(C(C)C)nc1C	ZINC001132398659	1375354238	/nfs/dbraw/zinc/35/42/38/1375354238.db2.gz	IVJRRYKNOWWJMN-UHFFFAOYSA-N	0	3	329.488	3.303	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2ccccc2Cl)CC[C@@H]1C	ZINC001132434385	1375378346	/nfs/dbraw/zinc/37/83/46/1375378346.db2.gz	WJBWYCHRMUJWAL-LSDHHAIUSA-N	0	3	336.863	3.125	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCCOc2ccccc2)CC[C@H]1C	ZINC001132464367	1375406908	/nfs/dbraw/zinc/40/69/08/1375406908.db2.gz	RSFSLYRZQXPQII-QZTJIDSGSA-N	0	3	330.472	3.391	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCOCc2ccccc2)CC[C@H]1C	ZINC001132496613	1375425485	/nfs/dbraw/zinc/42/54/85/1375425485.db2.gz	LTFNSEPBWYMRFM-IEBWSBKVSA-N	0	3	330.472	3.139	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCc2cccc(OCC)c2)CC[C@@H]1C	ZINC001132525188	1375441634	/nfs/dbraw/zinc/44/16/34/1375441634.db2.gz	ORIJETFRVOFSAD-FUHWJXTLSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1CC[C@H](C)N(Cc2cc(C)cc(C)c2)C1	ZINC001132528256	1375442922	/nfs/dbraw/zinc/44/29/22/1375442922.db2.gz	AWJLTRQHYIYGGR-AZUAARDMSA-N	0	3	344.499	3.365	20	30		EGEDHN
C#CCC1(C(=O)N[C@H]2CC[C@@H](C)N(CCOCC=C)C2)CCCCC1	ZINC001132529621	1375443316	/nfs/dbraw/zinc/44/33/16/1375443316.db2.gz	PCNKKXKBQDXTRL-MOPGFXCFSA-N	0	3	346.515	3.132	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2coc3ccccc32)CC[C@H]1C	ZINC001132536460	1375445912	/nfs/dbraw/zinc/44/59/12/1375445912.db2.gz	AVLXOHIOCFZOTL-CVEARBPZSA-N	0	3	342.439	3.218	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCc2cccc(F)c2F)CC[C@@H]1C	ZINC001132545349	1375452304	/nfs/dbraw/zinc/45/23/04/1375452304.db2.gz	AGHMBXUCTRKIKV-HOCLYGCPSA-N	0	3	336.426	3.443	20	30		EGEDHN
C#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)CCCC=C)CC1	ZINC001132553999	1375459809	/nfs/dbraw/zinc/45/98/09/1375459809.db2.gz	AEDCPGOTBLSGHY-FQEVSTJZSA-N	0	3	339.483	3.254	20	30		EGEDHN
C=CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)C#CC(C)C)CC1	ZINC001132554584	1375461163	/nfs/dbraw/zinc/46/11/63/1375461163.db2.gz	JVOYFGACLSJIFM-HXUWFJFHSA-N	0	3	339.483	3.110	20	30		EGEDHN
C#CCN1CC[C@H](CN(Cc2scnc2C)C(=O)[C@@H](C)CCC)C1	ZINC001132558305	1375465115	/nfs/dbraw/zinc/46/51/15/1375465115.db2.gz	KTCHEANNEXADFH-RDJZCZTQSA-N	0	3	347.528	3.171	20	30		EGEDHN
CC/C=C(\C)C(=O)N1CC[C@H](C)[C@H](CNCc2ccccc2C#N)C1	ZINC001132697956	1375520455	/nfs/dbraw/zinc/52/04/55/1375520455.db2.gz	UKEJGCXIZAXALD-PHOFCNKBSA-N	0	3	339.483	3.489	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](C)[C@H](CNCc2nc(C)c(C)s2)C1	ZINC001132785768	1375563387	/nfs/dbraw/zinc/56/33/87/1375563387.db2.gz	LDWYBSQURYOKKK-WMLDXEAASA-N	0	3	347.528	3.138	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2cc(C)ccc2C2CC2)CC1	ZINC001228400372	1375564694	/nfs/dbraw/zinc/56/46/94/1375564694.db2.gz	BGCPSYCOQDEBKE-UHFFFAOYSA-N	0	3	342.483	3.269	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](C)[C@@H](CNCc2cc(C)no2)C1	ZINC001132843242	1375595832	/nfs/dbraw/zinc/59/58/32/1375595832.db2.gz	KDXYCGMVOSLVOZ-QAPCUYQASA-N	0	3	345.487	3.326	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](C)[C@H](CNCc2cscn2)C1	ZINC001132847138	1375600347	/nfs/dbraw/zinc/60/03/47/1375600347.db2.gz	SLIXLLAWBGFFRA-LSDHHAIUSA-N	0	3	335.517	3.320	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](C)[C@H](CNCc2ncc(C)s2)C1	ZINC001132865441	1375609291	/nfs/dbraw/zinc/60/92/91/1375609291.db2.gz	NAFJCPOSFGQVCK-GOEBONIOSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NC1CCN(CCOc2ccccc2)CC1	ZINC001228750438	1375664143	/nfs/dbraw/zinc/66/41/43/1375664143.db2.gz	YRUFMDNMKSUQDK-IRXDYDNUSA-N	0	3	330.472	3.104	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC1CCN(Cc2sc(C)nc2C)CC1	ZINC001228786460	1375675344	/nfs/dbraw/zinc/67/53/44/1375675344.db2.gz	JVJFCDAQWMQFER-CYBMUJFWSA-N	0	3	335.517	3.443	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](C)[C@H](CNCc2cnc(C)o2)C1	ZINC001133038900	1375730174	/nfs/dbraw/zinc/73/01/74/1375730174.db2.gz	HSZUQCBBMCZGKJ-FUHWJXTLSA-N	0	3	345.487	3.141	20	30		EGEDHN
C=CCC1(C(=O)NC2CCN(CCc3scnc3C)CC2)CCC1	ZINC001229029217	1375744833	/nfs/dbraw/zinc/74/48/33/1375744833.db2.gz	BDXPYNUIUGSBHM-UHFFFAOYSA-N	0	3	347.528	3.321	20	30		EGEDHN
C[C@H]1CCN(C(=O)CCCF)C[C@@H]1CNCc1cc(F)ccc1C#N	ZINC001133059297	1375750448	/nfs/dbraw/zinc/75/04/48/1375750448.db2.gz	OFLMIVFGXMUWQF-YOEHRIQHSA-N	0	3	349.425	3.021	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC1CCN(C[C@@H](O)c2ccc(F)cc2)CC1	ZINC001229369318	1375821007	/nfs/dbraw/zinc/82/10/07/1375821007.db2.gz	KVJQSAZPZZMSGN-GOSISDBHSA-N	0	3	348.462	3.042	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)[C@H](F)CC2CCCCC2)CC1	ZINC001230059688	1375939444	/nfs/dbraw/zinc/93/94/44/1375939444.db2.gz	OHBUZCZWZFNJSH-GOSISDBHSA-N	0	3	340.483	3.078	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@H](C)SC	ZINC001133385559	1375968642	/nfs/dbraw/zinc/96/86/42/1375968642.db2.gz	PHEHHEWXMMCFAC-AWEZNQCLSA-N	0	3	338.904	3.033	20	30		EGEDHN
C#CCCCCCC(=O)N(CCNCC#C)Cc1cccc(Cl)c1	ZINC001133404015	1375989250	/nfs/dbraw/zinc/98/92/50/1375989250.db2.gz	UUJUXRRRFZAQNZ-UHFFFAOYSA-N	0	3	344.886	3.475	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C1(CCC)CC1	ZINC001133407883	1375992184	/nfs/dbraw/zinc/99/21/84/1375992184.db2.gz	QYILWKCJRSIHTF-UHFFFAOYSA-N	0	3	332.875	3.472	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)C1CCCC1)NCc1cc(F)ccc1C#N	ZINC001133464995	1376023447	/nfs/dbraw/zinc/02/34/47/1376023447.db2.gz	HUNANAPNJVWALP-KGLIPLIRSA-N	0	3	331.435	3.260	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)c1ccc(C)s1	ZINC001133536198	1376069269	/nfs/dbraw/zinc/06/92/69/1376069269.db2.gz	RTBZRBLXGCVCFR-WDEREUQCSA-N	0	3	345.306	3.452	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)c1sccc1C	ZINC001133560494	1376089392	/nfs/dbraw/zinc/08/93/92/1376089392.db2.gz	VMNQDTOVFQADQM-VXGBXAGGSA-N	0	3	345.306	3.452	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)C(C)=C1CCC1)Cc1cccnc1	ZINC001230756711	1376140149	/nfs/dbraw/zinc/14/01/49/1376140149.db2.gz	GDQWMYOIAHGGQC-UHFFFAOYSA-N	0	3	327.472	3.466	20	30		EGEDHN
Cc1ccoc1C(=O)N[C@H](C)C[C@H](C)NCc1cc(F)ccc1C#N	ZINC001133680330	1376151176	/nfs/dbraw/zinc/15/11/76/1376151176.db2.gz	YDZAIXBZCKKNQA-UONOGXRCSA-N	0	3	343.402	3.286	20	30		EGEDHN
CCCSCC(=O)N[C@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001133821882	1376218335	/nfs/dbraw/zinc/21/83/35/1376218335.db2.gz	WAOUGVIEWZHION-LSDHHAIUSA-N	0	3	333.501	3.074	20	30		EGEDHN
C/C(=C\C(=O)N[C@H](C)C[C@H](C)NCc1cc(F)ccc1C#N)C1CC1	ZINC001133867076	1376242761	/nfs/dbraw/zinc/24/27/61/1376242761.db2.gz	PQBYVGRUEXKXDW-WAYTWBJWSA-N	0	3	343.446	3.427	20	30		EGEDHN
N#Cc1ccccc1O[C@H]1CCCN(Cc2c[nH]c3cnccc23)C1	ZINC001231520711	1376256262	/nfs/dbraw/zinc/25/62/62/1376256262.db2.gz	CKOJIIQFAHYDRQ-KRWDZBQOSA-N	0	3	332.407	3.478	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)/C=C\C(C)(C)C	ZINC001133951002	1376281280	/nfs/dbraw/zinc/28/12/80/1376281280.db2.gz	UWNQTMIWBREUIW-OTHLQRGRSA-N	0	3	331.298	3.370	20	30		EGEDHN
COc1cc(C#N)ccc1CN(C)CCCCNC(=O)OC(C)(C)C	ZINC001231621287	1376282196	/nfs/dbraw/zinc/28/21/96/1376282196.db2.gz	WHEOJIOJYUXLTN-UHFFFAOYSA-N	0	3	347.459	3.304	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)CCC(F)(F)F	ZINC001134003335	1376306370	/nfs/dbraw/zinc/30/63/70/1376306370.db2.gz	IQRGHEUCCGJUSZ-NXEZZACHSA-N	0	3	345.203	3.110	20	30		EGEDHN
CC(C(=O)N[C@H](C)C[C@@H](C)NCc1ccccc1C#N)=C1CCC1	ZINC001134307429	1376466736	/nfs/dbraw/zinc/46/67/36/1376466736.db2.gz	MCIFXCNUWKRTKM-HUUCEWRRSA-N	0	3	325.456	3.432	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)C#CC(C)(C)C)NCc1ccncc1Cl	ZINC001134330207	1376480019	/nfs/dbraw/zinc/48/00/19/1376480019.db2.gz	XJLUYVMAVUCJGV-KBPBESRZSA-N	0	3	335.879	3.157	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H](C)C[C@H](C)NCc1ccn(C2CCCC2)n1	ZINC001134341570	1376484611	/nfs/dbraw/zinc/48/46/11/1376484611.db2.gz	QJXQTFIXMIEQJC-IRXDYDNUSA-N	0	3	344.503	3.031	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H](C)C[C@@H](C)NCc1nccn1C(F)F	ZINC001134448871	1376543659	/nfs/dbraw/zinc/54/36/59/1376543659.db2.gz	PUGSVXSGLGQCED-CHWSQXEVSA-N	0	3	342.434	3.253	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H](C)C[C@H](C)NCc1nccn1CC	ZINC001134456803	1376547897	/nfs/dbraw/zinc/54/78/97/1376547897.db2.gz	DOBDUFYQSCYOAS-STQMWFEESA-N	0	3	340.899	3.055	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CC[C@@]2(C[C@H](OCC3CC3)CO2)C1	ZINC001233080706	1376566341	/nfs/dbraw/zinc/56/63/41/1376566341.db2.gz	AJTBAXXTIKUZJV-VQTJNVASSA-N	0	3	326.440	3.027	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CC[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]21	ZINC001233080207	1376566787	/nfs/dbraw/zinc/56/67/87/1376566787.db2.gz	UXFUTDAOOBEYCJ-ZWKOTPCHSA-N	0	3	341.455	3.308	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCC2(CCC(=O)N2CC2CC2)CC1	ZINC001233081864	1376567942	/nfs/dbraw/zinc/56/79/42/1376567942.db2.gz	RSCPGJZQSLNYHS-UHFFFAOYSA-N	0	3	337.467	3.234	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CCN(Cc3cnc(C)c(C)c3)C2)C1	ZINC001233157075	1376577201	/nfs/dbraw/zinc/57/72/01/1376577201.db2.gz	ZWJRDBJZPHAEMP-HXUWFJFHSA-N	0	3	343.471	3.309	20	30		EGEDHN
N#Cc1ccc(C[N@@H+]2CCC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c([O-])c1	ZINC001233384464	1376635184	/nfs/dbraw/zinc/63/51/84/1376635184.db2.gz	XCORTGNSBRKYOF-CTNGQTDRSA-N	0	3	347.462	3.360	20	30		EGEDHN
N#Cc1ccc(C[N@H+]2CCC[C@@H]3CN(Cc4ccccc4)C[C@@H]32)c([O-])c1	ZINC001233384464	1376635190	/nfs/dbraw/zinc/63/51/90/1376635190.db2.gz	XCORTGNSBRKYOF-CTNGQTDRSA-N	0	3	347.462	3.360	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H]3C[N@H+](Cc4ccccc4)C[C@@H]32)c([O-])c1	ZINC001233384464	1376635198	/nfs/dbraw/zinc/63/51/98/1376635198.db2.gz	XCORTGNSBRKYOF-CTNGQTDRSA-N	0	3	347.462	3.360	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H]3C[N@@H+](Cc4ccccc4)C[C@@H]32)c([O-])c1	ZINC001233384464	1376635207	/nfs/dbraw/zinc/63/52/07/1376635207.db2.gz	XCORTGNSBRKYOF-CTNGQTDRSA-N	0	3	347.462	3.360	20	30		EGEDHN
CC[C@H](CC1CCCC1)C(=O)NCCNCc1ccc(C#N)cc1	ZINC001134688676	1376659424	/nfs/dbraw/zinc/65/94/24/1376659424.db2.gz	VKBPAQHVZNTHIN-LJQANCHMSA-N	0	3	327.472	3.371	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)c1[nH]c(C)cc1C	ZINC001134757024	1376702670	/nfs/dbraw/zinc/70/26/70/1376702670.db2.gz	TVMOGAGSDCKVJQ-DGCLKSJQSA-N	0	3	342.281	3.027	20	30		EGEDHN
CCC(CC)c1cc(C(=O)NCCNCc2ccc(C#N)s2)on1	ZINC001134963604	1376813871	/nfs/dbraw/zinc/81/38/71/1376813871.db2.gz	QLVSMYPOHHEZCS-UHFFFAOYSA-N	0	3	346.456	3.031	20	30		EGEDHN
C[C@H]([C@H](C)C(=O)NCCNCc1ccc(C#N)c(F)c1)C(C)(C)C	ZINC001135177679	1376950461	/nfs/dbraw/zinc/95/04/61/1376950461.db2.gz	KAPRVRBADYHBRF-UONOGXRCSA-N	0	3	333.451	3.221	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)C(C)(C)C(=C)C	ZINC001135183978	1376957228	/nfs/dbraw/zinc/95/72/28/1376957228.db2.gz	AEBLHBCIDPGRTI-QWHCGFSZSA-N	0	3	331.298	3.370	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H](C)C[C@@H](C)NCc2ncc(C)s2)cc1	ZINC001135184973	1376958594	/nfs/dbraw/zinc/95/85/94/1376958594.db2.gz	RQIMKSHAYZCONL-KGLIPLIRSA-N	0	3	341.480	3.120	20	30		EGEDHN
C=CC1(CC(=O)NCCNCc2ccc(F)c(C#N)c2)CCCCC1	ZINC001135187827	1376960806	/nfs/dbraw/zinc/96/08/06/1376960806.db2.gz	ZOORMGSAOSFPKC-UHFFFAOYSA-N	0	3	343.446	3.430	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H](C)C[C@H](C)NCc1oc(C)nc1C	ZINC001135194388	1376965654	/nfs/dbraw/zinc/96/56/54/1376965654.db2.gz	UPNSCGDUMBAVNG-GJZGRUSLSA-N	0	3	333.476	3.248	20	30		EGEDHN
Fc1ccc(CN2CCNC[C@H]2C(F)(F)F)c(F)c1C(F)(F)F	ZINC001236981243	1376969012	/nfs/dbraw/zinc/96/90/12/1376969012.db2.gz	LXBJLWJYFMICAT-VIFPVBQESA-N	0	3	348.237	3.320	20	30		EGEDHN
Cc1cocc1C(=O)N[C@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001135202236	1376972196	/nfs/dbraw/zinc/97/21/96/1376972196.db2.gz	CJRLXKNTGBWZDL-HUUCEWRRSA-N	0	3	325.412	3.146	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H](C)C[C@@H](C)NCc1cc(F)ccc1C#N	ZINC001135231345	1376990844	/nfs/dbraw/zinc/99/08/44/1376990844.db2.gz	ZJGQQEPTZBPWLI-KGLIPLIRSA-N	0	3	331.435	3.282	20	30		EGEDHN
Cc1coc(C(=O)N[C@@H](C)C[C@@H](C)NCc2ccccc2C#N)c1	ZINC001135237779	1376994037	/nfs/dbraw/zinc/99/40/37/1376994037.db2.gz	FKLDEXSUPFMCKH-CABCVRRESA-N	0	3	325.412	3.146	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N[C@H](C)C[C@@H](C)NCC(=C)Br	ZINC001135243318	1376997659	/nfs/dbraw/zinc/99/76/59/1376997659.db2.gz	JRPQFAGUIBFLJO-XAVULWGNSA-N	0	3	329.282	3.290	20	30		EGEDHN
Cc1nc(C(=O)N[C@@H](C)C[C@@H](C)NCc2ccccc2C#N)cs1	ZINC001135275393	1377017087	/nfs/dbraw/zinc/01/70/87/1377017087.db2.gz	XIPFSHSANZBTAC-OLZOCXBDSA-N	0	3	342.468	3.010	20	30		EGEDHN
Cc1ccc(O)c(-c2nccnc2C(C#N)C(=O)OC(C)(C)C)c1	ZINC001244403715	1377036884	/nfs/dbraw/zinc/03/68/84/1377036884.db2.gz	ZCELDHKILXOMKT-ZDUSSCGKSA-N	0	3	325.368	3.107	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1ccccc1C#N)NC(=O)C1CC2(CC2)C1	ZINC001135452398	1377102897	/nfs/dbraw/zinc/10/28/97/1377102897.db2.gz	SXILFEQVFMDNDK-LSDHHAIUSA-N	0	3	325.456	3.121	20	30		EGEDHN
Cc1ccc(Cl)cc1C(=O)NCCNCc1ccc(C#N)c(F)c1	ZINC001135500950	1377120796	/nfs/dbraw/zinc/12/07/96/1377120796.db2.gz	FCLNCOHPJUPUDG-UHFFFAOYSA-N	0	3	345.805	3.179	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@H](C)c2ccc(F)c(F)c2)C1	ZINC001264438993	1377143471	/nfs/dbraw/zinc/14/34/71/1377143471.db2.gz	HTJJSBOOFRMCEK-YRGRVCCFSA-N	0	3	342.817	3.305	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)c1csc(C)c1	ZINC001135690712	1377184943	/nfs/dbraw/zinc/18/49/43/1377184943.db2.gz	KEIMTICSWAEMJD-QWRGUYRKSA-N	0	3	345.306	3.452	20	30		EGEDHN
C=C(Cl)CN[C@H](C)C[C@@H](C)NC(=O)c1cc(=O)c2ccccc2o1	ZINC001136071582	1377326602	/nfs/dbraw/zinc/32/66/02/1377326602.db2.gz	PJPFDZMBJUFOJN-CHWSQXEVSA-N	0	3	348.830	3.032	20	30		EGEDHN
CC1(C)CC(C(=O)NCC[C@H]2CCN(Cc3ccc(C#N)s3)C2)C1	ZINC001267524138	1377452306	/nfs/dbraw/zinc/45/23/06/1377452306.db2.gz	PLAINUZLULITEM-AWEZNQCLSA-N	0	3	345.512	3.384	20	30		EGEDHN
N#Cc1cccc(O[C@@H]2CCCN(Cc3[nH]nc4ccccc43)C2)c1	ZINC001137350702	1377529271	/nfs/dbraw/zinc/52/92/71/1377529271.db2.gz	DKZPDPJJAPDEFT-QGZVFWFLSA-N	0	3	332.407	3.478	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CCN(Cc3ccnc(C)c3)C2)C1	ZINC001137407096	1377542701	/nfs/dbraw/zinc/54/27/01/1377542701.db2.gz	AZVCFAIVRWHILI-LJQANCHMSA-N	0	3	329.444	3.001	20	30		EGEDHN
N#Cc1ccc(CN2CCC3SC(=O)C=C3C2)c(Br)c1	ZINC001137634344	1377578722	/nfs/dbraw/zinc/57/87/22/1377578722.db2.gz	OGQAHQFRQQZKCQ-AWEZNQCLSA-N	0	3	349.253	3.095	20	30		EGEDHN
CC(=O)N[C@@H]1CCN(Cc2ccc(N(C)c3ccc(C#N)cc3)cc2)C1	ZINC001137904244	1377641889	/nfs/dbraw/zinc/64/18/89/1377641889.db2.gz	UGAULKFZLQYZDS-LJQANCHMSA-N	0	3	348.450	3.037	20	30		EGEDHN
CC(=O)N(C)[C@H]1CCN(Cc2ccc(C#Cc3ccccc3)cc2)C1	ZINC001138335848	1377704533	/nfs/dbraw/zinc/70/45/33/1377704533.db2.gz	DFIXSZZKLAXYAL-QFIPXVFZSA-N	0	3	332.447	3.139	20	30		EGEDHN
C#CCOc1ccc(CN2CCN(CCCCC)CC2)cc1OC	ZINC001138345733	1377706625	/nfs/dbraw/zinc/70/66/25/1377706625.db2.gz	NQYIHZXRGGXTQI-UHFFFAOYSA-N	0	3	330.472	3.015	20	30		EGEDHN
C#CCOc1ccc(CN2CCC(O)(Cc3ccccc3)CC2)cc1	ZINC001138555263	1377741670	/nfs/dbraw/zinc/74/16/70/1377741670.db2.gz	SZNNDQGNXVFOFI-UHFFFAOYSA-N	0	3	335.447	3.268	20	30		EGEDHN
C#CCOc1ccc(CN2CCC[C@@]3(C[C@H](CCOC)CO3)C2)cc1	ZINC001138559718	1377741881	/nfs/dbraw/zinc/74/18/81/1377741881.db2.gz	QLZLQDCCBZRGDM-PZJWPPBQSA-N	0	3	343.467	3.106	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@H](Oc3ccnc(OC)c3)C2)c1[O-]	ZINC001138631540	1377757507	/nfs/dbraw/zinc/75/75/07/1377757507.db2.gz	VBHZQXQAFLTKBH-SFHVURJKSA-N	0	3	340.423	3.178	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@H](Oc3ccnc(OC)c3)C2)c1[O-]	ZINC001138631540	1377757512	/nfs/dbraw/zinc/75/75/12/1377757512.db2.gz	VBHZQXQAFLTKBH-SFHVURJKSA-N	0	3	340.423	3.178	20	30		EGEDHN
N#Cc1cccc2c(CN3CCN(CCc4ccccc4)CC3)c[nH]c21	ZINC001139704007	1377937585	/nfs/dbraw/zinc/93/75/85/1377937585.db2.gz	YKSRLDFIWVPNCV-UHFFFAOYSA-N	0	3	344.462	3.400	20	30		EGEDHN
COC(=O)[C@H]1CN(Cc2cc(F)cc(C#N)c2)C[C@H]1c1ccccc1	ZINC001139879801	1377970477	/nfs/dbraw/zinc/97/04/77/1377970477.db2.gz	UEXJCXIRFSCNNB-OALUTQOASA-N	0	3	338.382	3.086	20	30		EGEDHN
Cn1ncc2ccc(CN3CCC[C@@H](Oc4ccc(C#N)cc4)C3)cc21	ZINC001139910299	1377976598	/nfs/dbraw/zinc/97/65/98/1377976598.db2.gz	KXHXFIGSEDEQCO-HXUWFJFHSA-N	0	3	346.434	3.488	20	30		EGEDHN
N#Cc1ccccc1O[C@H]1CCCN(Cc2ccc3n[nH]cc3c2)C1	ZINC001140388441	1378055620	/nfs/dbraw/zinc/05/56/20/1378055620.db2.gz	UBBLILYIRIQQDJ-SFHVURJKSA-N	0	3	332.407	3.478	20	30		EGEDHN
CCCN(Cc1ccc(C#N)nc1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC001140546833	1378082887	/nfs/dbraw/zinc/08/28/87/1378082887.db2.gz	WFRMLQKHGDCPMW-QGZVFWFLSA-N	0	3	344.459	3.175	20	30		EGEDHN
COC(=O)[C@@H](c1ccccc1)[C@@H]1CCCCN1Cc1ccc(C#N)nc1	ZINC001140545939	1378082982	/nfs/dbraw/zinc/08/29/82/1378082982.db2.gz	QNNUXBGEKNPCQW-PMACEKPBSA-N	0	3	349.434	3.265	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3cccc(F)c3Cl)C2)C1=O	ZINC001140561832	1378085994	/nfs/dbraw/zinc/08/59/94/1378085994.db2.gz	YTAOHBHLFFVHLU-GOSISDBHSA-N	0	3	336.838	3.480	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3c(F)cccc3OC)CC2)C1=O	ZINC001273323272	1378098124	/nfs/dbraw/zinc/09/81/24/1378098124.db2.gz	XVSWVPYNXBATMD-FQEVSTJZSA-N	0	3	346.446	3.225	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@]23CCN([C@H](C)CC)C3=O)c1[O-]	ZINC001273360223	1378098972	/nfs/dbraw/zinc/09/89/72/1378098972.db2.gz	JCZRFAVIROLLOV-IIBYNOLFSA-N	0	3	342.483	3.486	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@]23CCN([C@H](C)CC)C3=O)c1[O-]	ZINC001273360223	1378098976	/nfs/dbraw/zinc/09/89/76/1378098976.db2.gz	JCZRFAVIROLLOV-IIBYNOLFSA-N	0	3	342.483	3.486	20	30		EGEDHN
CN(CCN(C)Cc1ccccc1)Cc1sc(N)c(C#N)c1Cl	ZINC001141113449	1378242295	/nfs/dbraw/zinc/24/22/95/1378242295.db2.gz	HPNADWCYVVPTTQ-UHFFFAOYSA-N	0	3	348.903	3.419	20	30		EGEDHN
Cc1ccc(C#N)c(NC(=O)c2[nH]nc3c2CCN(CCC2CC2)C3)c1	ZINC001280273653	1378339391	/nfs/dbraw/zinc/33/93/91/1378339391.db2.gz	BSYVNOQMQNVTIP-UHFFFAOYSA-N	0	3	349.438	3.000	20	30		EGEDHN
C=CCOC[C@@H]1CCC[C@@]12CN(Cc1cccc3nc[nH]c31)CCO2	ZINC001142682761	1378475354	/nfs/dbraw/zinc/47/53/54/1378475354.db2.gz	HSPJQKIMWRFMCZ-FXAWDEMLSA-N	0	3	341.455	3.137	20	30		EGEDHN
COc1ccc(F)c(CN2CCC3SC(=O)C=C3C2)c1Cl	ZINC001143363921	1378587446	/nfs/dbraw/zinc/58/74/46/1378587446.db2.gz	YSXLEOXJTMSKJG-ZDUSSCGKSA-N	0	3	327.808	3.262	20	30		EGEDHN
COC(=O)[C@H](c1ccccc1)[C@H]1CCCCN1Cc1cncc(C#N)c1	ZINC001144083629	1378680808	/nfs/dbraw/zinc/68/08/08/1378680808.db2.gz	LXTNERDUIUOUJQ-WOJBJXKFSA-N	0	3	349.434	3.265	20	30		EGEDHN
N#Cc1cncc(CN2CCCC3(CN(Cc4ccccc4)C3)C2)c1	ZINC001144084787	1378680873	/nfs/dbraw/zinc/68/08/73/1378680873.db2.gz	MNLNTJNWXPVNIM-UHFFFAOYSA-N	0	3	332.451	3.051	20	30		EGEDHN
CCn1cccc1C(=O)N[C@@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001146350756	1378824805	/nfs/dbraw/zinc/82/48/05/1378824805.db2.gz	SSYBSXTZFVPSIZ-CVEARBPZSA-N	0	3	338.455	3.066	20	30		EGEDHN
CCc1ccc(C(C)(C)C(=O)NCCNCc2cccc(C#N)c2)cc1	ZINC001147109042	1378970331	/nfs/dbraw/zinc/97/03/31/1378970331.db2.gz	JETKUGFEAILIEF-UHFFFAOYSA-N	0	3	349.478	3.304	20	30		EGEDHN
C[C@@H](C(=O)NCCNCc1cccc(C#N)c1)c1ccc(Cl)s1	ZINC001147161301	1378979297	/nfs/dbraw/zinc/97/92/97/1378979297.db2.gz	LBVUOBVJCBSLCP-GFCCVEGCSA-N	0	3	347.871	3.283	20	30		EGEDHN
CCCC[C@H](C)C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001147467184	1379027845	/nfs/dbraw/zinc/02/78/45/1379027845.db2.gz	CZJIBOUSPSDADK-KRWDZBQOSA-N	0	3	339.483	3.419	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)N1CC2(C1)CCN(Cc1ccc(OC)cc1)C2	ZINC001148087504	1379114144	/nfs/dbraw/zinc/11/41/44/1379114144.db2.gz	DJJQYNXYEGDVTI-DLBZAZTESA-N	0	3	342.483	3.188	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC2(C1)CCN(Cc1ccc(C)nc1C)C2	ZINC001148147535	1379125814	/nfs/dbraw/zinc/12/58/14/1379125814.db2.gz	WCGRNLZHFYTDIH-INIZCTEOSA-N	0	3	341.499	3.335	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001148357843	1379156476	/nfs/dbraw/zinc/15/64/76/1379156476.db2.gz	SRQFXXWAJAOQPG-UHFFFAOYSA-N	0	3	337.467	3.195	20	30		EGEDHN
CC(C)c1ccc(C(=O)NCCNCc2ccc(C#N)s2)cc1	ZINC001148846525	1379283393	/nfs/dbraw/zinc/28/33/93/1379283393.db2.gz	XEWUEQZNULGXKX-UHFFFAOYSA-N	0	3	327.453	3.263	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2ccc3ccccc3c2)c1	ZINC001148862651	1379285558	/nfs/dbraw/zinc/28/55/58/1379285558.db2.gz	IXFGAEDPIIHYGC-UHFFFAOYSA-N	0	3	329.403	3.231	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc(F)cc2Cl)cc1F	ZINC001149741001	1379438653	/nfs/dbraw/zinc/43/86/53/1379438653.db2.gz	PRKQFWQIWFGBLR-UHFFFAOYSA-N	0	3	349.768	3.009	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cc3c(s2)CCCC3)cc1	ZINC001150004477	1379482891	/nfs/dbraw/zinc/48/28/91/1379482891.db2.gz	YDNZPVBPYCJENH-UHFFFAOYSA-N	0	3	339.464	3.018	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@H]1CN(Cc2ccccc2C)CCCO1	ZINC001150079280	1379491531	/nfs/dbraw/zinc/49/15/31/1379491531.db2.gz	QPNNQWPMPLYSBT-IBGZPJMESA-N	0	3	344.499	3.304	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@@H]1CN(CC2=CCCCC2)CCCO1	ZINC001150159588	1379504906	/nfs/dbraw/zinc/50/49/06/1379504906.db2.gz	KUVKMTATPZMYFR-IEBWSBKVSA-N	0	3	334.504	3.296	20	30		EGEDHN
CC#CCCCC(=O)NC[C@H]1CN([C@@H](C)c2ccccc2)CCCO1	ZINC001150165481	1379507663	/nfs/dbraw/zinc/50/76/63/1379507663.db2.gz	LQRKLQWVAGZUMS-ICSRJNTNSA-N	0	3	342.483	3.148	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)CCc2ccccc2Cl)c1	ZINC001150285631	1379528790	/nfs/dbraw/zinc/52/87/90/1379528790.db2.gz	ZGZAVSKPJFYBOA-UHFFFAOYSA-N	0	3	341.842	3.050	20	30		EGEDHN
C=CC1(CC(=O)NC[C@H]2CN(CCCF)CCCO2)CCCCC1	ZINC001150436556	1379553228	/nfs/dbraw/zinc/55/32/28/1379553228.db2.gz	VBILYEITKRSGKN-KRWDZBQOSA-N	0	3	340.483	3.080	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)Cc2ccc3ccccc3c2)c1	ZINC001150485536	1379557313	/nfs/dbraw/zinc/55/73/13/1379557313.db2.gz	QPFRAKZWYPEFAS-UHFFFAOYSA-N	0	3	343.430	3.160	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)[C@@H](F)CCCCCC)C1	ZINC001150588025	1379574346	/nfs/dbraw/zinc/57/43/46/1379574346.db2.gz	LYURJPAETZERIE-SJORKVTESA-N	0	3	328.472	3.078	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2sccc2C)CC1	ZINC001150896173	1379628722	/nfs/dbraw/zinc/62/87/22/1379628722.db2.gz	UTGXYEBUAVQULQ-UHFFFAOYSA-N	0	3	336.501	3.234	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2cscc2C)CC1	ZINC001151047630	1379654123	/nfs/dbraw/zinc/65/41/23/1379654123.db2.gz	SZLHZEMTSUQJHY-UHFFFAOYSA-N	0	3	336.501	3.234	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@@H](CC)CC(F)F)CC1	ZINC001151161865	1379669895	/nfs/dbraw/zinc/66/98/95/1379669895.db2.gz	FCFLBGIYKNXEER-HNNXBMFYSA-N	0	3	346.462	3.231	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2cc(C)cc(C)c2)CC1	ZINC001151403422	1379711601	/nfs/dbraw/zinc/71/16/01/1379711601.db2.gz	USCGMNHBVSRFAF-UHFFFAOYSA-N	0	3	330.472	3.090	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)c1ccsc1	ZINC001151784622	1379780315	/nfs/dbraw/zinc/78/03/15/1379780315.db2.gz	ZACMBKOBWQOXBP-CYBMUJFWSA-N	0	3	345.443	3.399	20	30		EGEDHN
O=C(CC#Cc1ccccc1)NCCNCc1cc2ccccc2o1	ZINC001151953289	1379825186	/nfs/dbraw/zinc/82/51/86/1379825186.db2.gz	YCEHKXJRKPMSQD-UHFFFAOYSA-N	0	3	332.403	3.080	20	30		EGEDHN
Cc1c2cccc(C)c2oc1C(=O)NCCNCc1ccc(C#N)cc1	ZINC001152439403	1379934848	/nfs/dbraw/zinc/93/48/48/1379934848.db2.gz	KMCKGSJTEHETHJ-UHFFFAOYSA-N	0	3	347.418	3.441	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)CCC(F)(F)F	ZINC001152573175	1379951023	/nfs/dbraw/zinc/95/10/23/1379951023.db2.gz	FHJDXRYGEWLHEO-CYBMUJFWSA-N	0	3	341.377	3.227	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)CCC1CCC1	ZINC001152612251	1379957840	/nfs/dbraw/zinc/95/78/40/1379957840.db2.gz	XHWRIYPLPRQFGD-MRXNPFEDSA-N	0	3	327.472	3.465	20	30		EGEDHN
CC[C@H](SC)C(=O)NC[C@@H](C)N(CC)Cc1cccc(C#N)c1	ZINC001152842508	1379985984	/nfs/dbraw/zinc/98/59/84/1379985984.db2.gz	ZVKVQIMJBZZUKL-PBHICJAKSA-N	0	3	333.501	3.026	20	30		EGEDHN
CC1(C)CCCC[C@H]1C(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001152911257	1379992892	/nfs/dbraw/zinc/99/28/92/1379992892.db2.gz	QLIVCSWVUNPPPU-INIZCTEOSA-N	0	3	331.435	3.120	20	30		EGEDHN
CC1=C(C)C[C@](C)(C(=O)NCCNCc2cccc(C#N)c2)CC1	ZINC001152934425	1379995962	/nfs/dbraw/zinc/99/59/62/1379995962.db2.gz	HJUWYFRDHJTYQW-HXUWFJFHSA-N	0	3	325.456	3.291	20	30		EGEDHN
CCCOc1cccc(CN(CC)[C@H](C)CNC(=O)C#CC(C)C)c1	ZINC001153207211	1380035569	/nfs/dbraw/zinc/03/55/69/1380035569.db2.gz	AUSKFNZUYXSQOP-GOSISDBHSA-N	0	3	344.499	3.461	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)[C@@H]1CCCC12CC2	ZINC001154015839	1380181203	/nfs/dbraw/zinc/18/12/03/1380181203.db2.gz	WKGKPBLFLWDNRE-APWZRJJASA-N	0	3	339.483	3.465	20	30		EGEDHN
CCc1ccc(C(=O)NC[C@@H](C)N(CC)Cc2ccc(C#N)cc2)o1	ZINC001154053824	1380192280	/nfs/dbraw/zinc/19/22/80/1380192280.db2.gz	XSNNCWAHQCRZHF-OAHLLOKOSA-N	0	3	339.439	3.354	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)Cc1ccccc1	ZINC001154059026	1380193811	/nfs/dbraw/zinc/19/38/11/1380193811.db2.gz	MQLYSEVPBGVTEX-QGZVFWFLSA-N	0	3	335.451	3.128	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1scnc1C1CCCC1	ZINC001154198023	1380224871	/nfs/dbraw/zinc/22/48/71/1380224871.db2.gz	IVBSWZLQZSYGDP-CQSZACIVSA-N	0	3	333.501	3.264	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@@H](C)N(CC)C[C@@H](O)c1ccccc1	ZINC001154609565	1380315572	/nfs/dbraw/zinc/31/55/72/1380315572.db2.gz	MXXJEQGKXODAFN-UYAOXDASSA-N	0	3	344.499	3.130	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)[C@@H]1CCC1(C)C	ZINC001154736019	1380342803	/nfs/dbraw/zinc/34/28/03/1380342803.db2.gz	KMPRRAQMEJAVCX-PBHICJAKSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@@H](C)N(CC)Cc1ccc2nonc2c1	ZINC001154750872	1380345572	/nfs/dbraw/zinc/34/55/72/1380345572.db2.gz	DMKTYOSQDLYWTI-CABCVRRESA-N	0	3	344.459	3.152	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)[C@H](C)C(C)(F)F	ZINC001155288989	1380433594	/nfs/dbraw/zinc/43/35/94/1380433594.db2.gz	GHVBXBNMWJZCNE-KGLIPLIRSA-N	0	3	337.414	3.176	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)C1(CF)CCC1	ZINC001155330232	1380437842	/nfs/dbraw/zinc/43/78/42/1380437842.db2.gz	LWCKVKGOQXFWCM-OAHLLOKOSA-N	0	3	331.435	3.025	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)CCCCc1ccc(F)cc1	ZINC001155444882	1380454467	/nfs/dbraw/zinc/45/44/67/1380454467.db2.gz	BISMVLXZWFMWSB-QGZVFWFLSA-N	0	3	332.463	3.388	20	30		EGEDHN
N#Cc1ccc(C(F)(F)n2nc(CN)c3ccccc32)nc1Cl	ZINC001156855775	1380698937	/nfs/dbraw/zinc/69/89/37/1380698937.db2.gz	FTXRSNDOVZGZHK-UHFFFAOYSA-N	0	3	333.729	3.013	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)CCc1ccc(Cl)s1	ZINC001156921895	1380728103	/nfs/dbraw/zinc/72/81/03/1380728103.db2.gz	DCQMNGXBKGCBHA-CYBMUJFWSA-N	0	3	326.893	3.184	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)CC1C2CC3CC(C2)CC1C3	ZINC001157041693	1380758147	/nfs/dbraw/zinc/75/81/47/1380758147.db2.gz	SENAWFUERCNTSM-YDGYHQHPSA-N	0	3	330.516	3.299	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)C[C@@H](C)C1CC1	ZINC001157145856	1380786389	/nfs/dbraw/zinc/78/63/89/1380786389.db2.gz	KRJBAQCIMYQKSH-HUUCEWRRSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NC[C@@H](C)N(CC)C/C=C/c1ccccc1	ZINC001157214168	1380812318	/nfs/dbraw/zinc/81/23/18/1380812318.db2.gz	ZOZHCRQMQRXLFA-NQNZFTEYSA-N	0	3	330.472	3.118	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NC[C@@H](C)N(CC)Cc1ccc(F)cc1C	ZINC001157217621	1380813569	/nfs/dbraw/zinc/81/35/69/1380813569.db2.gz	TZSMUYREPVEHNZ-CVEARBPZSA-N	0	3	336.451	3.052	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1ccc(C)s1	ZINC001157459321	1380910943	/nfs/dbraw/zinc/91/09/43/1380910943.db2.gz	YYNNCAYNCJGNCQ-MRXNPFEDSA-N	0	3	336.501	3.186	20	30		EGEDHN
C=CCCC(=O)N1CCCC[C@@H]1CN(C)C[C@@H](O)c1ccc(F)cc1	ZINC001157661967	1380993095	/nfs/dbraw/zinc/99/30/95/1380993095.db2.gz	RHXADFXQDAAVDQ-RTBURBONSA-N	0	3	348.462	3.138	20	30		EGEDHN
C#CCCCCC(=O)N1CCCC[C@@H]1CN(C)CCOCC1CCC1	ZINC001157855858	1381052570	/nfs/dbraw/zinc/05/25/70/1381052570.db2.gz	BDXALJAUQQARRP-HXUWFJFHSA-N	0	3	348.531	3.310	20	30		EGEDHN
C=C(C)CCC(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(CO)cc1	ZINC001158019232	1381105476	/nfs/dbraw/zinc/10/54/76/1381105476.db2.gz	VWURFGJKFVJCKM-HXUWFJFHSA-N	0	3	344.499	3.348	20	30		EGEDHN
CCCCCCC[N@H+](C)C[C@H]1CCCCN1C(=O)c1cnc[n-]c1=O	ZINC001158107056	1381130469	/nfs/dbraw/zinc/13/04/69/1381130469.db2.gz	AJKAFEDROLNNKQ-MRXNPFEDSA-N	0	3	348.491	3.079	20	30		EGEDHN
CCCCCCC[N@@H+](C)C[C@H]1CCCCN1C(=O)c1cnc[n-]c1=O	ZINC001158107056	1381130472	/nfs/dbraw/zinc/13/04/72/1381130472.db2.gz	AJKAFEDROLNNKQ-MRXNPFEDSA-N	0	3	348.491	3.079	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1C[C@H]1c1ccc(OC)cc1	ZINC001158565122	1381301858	/nfs/dbraw/zinc/30/18/58/1381301858.db2.gz	ITOCLJBKELKAMG-YZGWKJHDSA-N	0	3	342.483	3.298	20	30		EGEDHN
N#Cc1nc(N2CCCc3ccc(CN)nc32)c(Cl)cc1Cl	ZINC001158656160	1381339623	/nfs/dbraw/zinc/33/96/23/1381339623.db2.gz	TYKRDKBGQYIMRS-UHFFFAOYSA-N	0	3	334.210	3.198	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccnc(O[C@H](C)CC)c1	ZINC001158723716	1381368639	/nfs/dbraw/zinc/36/86/39/1381368639.db2.gz	GGPUMVQYHYXGGB-SJLPKXTDSA-N	0	3	345.487	3.371	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)C[C@@H]1OCCc2ccccc21	ZINC001158763614	1381388394	/nfs/dbraw/zinc/38/83/94/1381388394.db2.gz	GXMZNGPKWIKQPL-QUCCMNQESA-N	0	3	342.483	3.189	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H](C)OCCc1ccccc1	ZINC001158811241	1381410892	/nfs/dbraw/zinc/41/08/92/1381410892.db2.gz	DYSTXMSHUWQPQN-AZUAARDMSA-N	0	3	344.499	3.133	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCC1=CCN(Cc2cc3ccccc3o2)CC1	ZINC001159586615	1381836414	/nfs/dbraw/zinc/83/64/14/1381836414.db2.gz	AFMKHYWKJQEXKC-OAHLLOKOSA-N	0	3	337.423	3.231	20	30		EGEDHN
C#CCC1(C(=O)NCCCNCc2cc(OC)ccc2Cl)CCC1	ZINC001159644947	1381857481	/nfs/dbraw/zinc/85/74/81/1381857481.db2.gz	ZIPBHTLDEJWFSS-UHFFFAOYSA-N	0	3	348.874	3.138	20	30		EGEDHN
N#Cc1cc(Nc2cc(Cl)ccc2[O-])ccc1N1CC[NH2+]CC1	ZINC001159749171	1381888558	/nfs/dbraw/zinc/88/85/58/1381888558.db2.gz	YQFGTQQRXGIENZ-UHFFFAOYSA-N	0	3	328.803	3.070	20	30		EGEDHN
C=C(C)CCC(=O)NCCC1=CCN(Cc2ncccc2C)CC1	ZINC001160268840	1382055940	/nfs/dbraw/zinc/05/59/40/1382055940.db2.gz	LXCYFKVGUWRNMF-UHFFFAOYSA-N	0	3	327.472	3.385	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C2(Cc3ccccc3)CC2)CC1	ZINC001160385915	1382089920	/nfs/dbraw/zinc/08/99/20/1382089920.db2.gz	BPCLSRWNZGVZLN-UHFFFAOYSA-N	0	3	336.479	3.171	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C/C=C/c2ccc(F)cc2)CC1	ZINC001160472856	1382115988	/nfs/dbraw/zinc/11/59/88/1382115988.db2.gz	BMMJNUCCEHROQC-SNAWJCMRSA-N	0	3	340.442	3.391	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1cscc1Cl	ZINC001160528121	1382132338	/nfs/dbraw/zinc/13/23/38/1382132338.db2.gz	IGOBKOCIHRJLNU-UHFFFAOYSA-N	0	3	337.670	3.020	20	30		EGEDHN
CC1(CC(=O)NCCC2=CCN(Cc3ccc(C#N)cc3)CC2)CC1	ZINC001160707581	1382175920	/nfs/dbraw/zinc/17/59/20/1382175920.db2.gz	RFHMAMLZHRAATF-UHFFFAOYSA-N	0	3	337.467	3.387	20	30		EGEDHN
C=CCN1CCC[C@H]1CNc1nccc(-c2ccc(N(C)C)cc2)n1	ZINC001160954177	1382249989	/nfs/dbraw/zinc/24/99/89/1382249989.db2.gz	QEQQQUNWNHWOLE-SFHVURJKSA-N	0	3	337.471	3.272	20	30		EGEDHN
C=C1CCC(C(=O)NCCC2=CCN(CCOCC3CC3)CC2)CC1	ZINC001161112516	1382300759	/nfs/dbraw/zinc/30/07/59/1382300759.db2.gz	IKYIPYGIAFSQJC-UHFFFAOYSA-N	0	3	346.515	3.298	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@H](C)OC2CCCCCC2)CC1	ZINC001161178575	1382327258	/nfs/dbraw/zinc/32/72/58/1382327258.db2.gz	VQVMAYVUZYSPHW-SFHVURJKSA-N	0	3	346.515	3.276	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H](C)Cc2ccccc2F)CC1	ZINC001161199337	1382337999	/nfs/dbraw/zinc/33/79/99/1382337999.db2.gz	IFZSIKDQIUICQG-KRWDZBQOSA-N	0	3	342.458	3.166	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc(C(C)C)nc2C)CC1	ZINC001161243663	1382352479	/nfs/dbraw/zinc/35/24/79/1382352479.db2.gz	LZSVWBWLCWYITK-UHFFFAOYSA-N	0	3	339.483	3.289	20	30		EGEDHN
Cc1ccc(CC#N)c(NCC2CCN(Cc3ccccn3)CC2)n1	ZINC001161245490	1382353531	/nfs/dbraw/zinc/35/35/31/1382353531.db2.gz	ARVQEWDCBLLZSL-UHFFFAOYSA-N	0	3	335.455	3.175	20	30		EGEDHN
C=CCN(C(=O)[C@@]1(N)CCc2cc(F)ccc2C1)C1CCCCC1	ZINC001161247753	1382354256	/nfs/dbraw/zinc/35/42/56/1382354256.db2.gz	JEKRHMYOLOZHKV-HXUWFJFHSA-N	0	3	330.447	3.359	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)Cc2ccc(Cl)c(F)c2)CC1	ZINC001161320111	1382369768	/nfs/dbraw/zinc/36/97/68/1382369768.db2.gz	COLQBLKRVIZNDA-UHFFFAOYSA-N	0	3	348.849	3.183	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)N(C)Cc1cn2ccc(C)cc2n1	ZINC001161532463	1382433148	/nfs/dbraw/zinc/43/31/48/1382433148.db2.gz	UJPILTJNBXHYRU-KRWDZBQOSA-N	0	3	328.460	3.065	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc3c(c2)CCC=C3)CC1	ZINC001161709061	1382486897	/nfs/dbraw/zinc/48/68/97/1382486897.db2.gz	IRECRFKYIQLTCZ-UHFFFAOYSA-N	0	3	334.463	3.421	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2coc(-c3ccccc3)n2)CC1	ZINC001161708998	1382486982	/nfs/dbraw/zinc/48/69/82/1382486982.db2.gz	CVZDWECMCXQCGY-UHFFFAOYSA-N	0	3	349.434	3.117	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@]2(C)CCOc3ccccc32)CC1	ZINC001161722769	1382489110	/nfs/dbraw/zinc/48/91/10/1382489110.db2.gz	FOFDCUKTHPDVLQ-NRFANRHFSA-N	0	3	340.467	3.051	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)CCn2ccc3ccccc32)CC1	ZINC001161845233	1382527207	/nfs/dbraw/zinc/52/72/07/1382527207.db2.gz	ZAAIPEGPVFHWPN-UHFFFAOYSA-N	0	3	349.478	3.193	20	30		EGEDHN
N#Cc1c(Cl)ncnc1NC[C@@H]1CCCN1Cc1ccccc1	ZINC001161884946	1382539675	/nfs/dbraw/zinc/53/96/75/1382539675.db2.gz	CMDRGDPOFRSZFI-AWEZNQCLSA-N	0	3	327.819	3.078	20	30		EGEDHN
C#CC[C@@H](CC(=O)NCCC1=CCN(CC#CC)CC1)c1ccccc1	ZINC001162003037	1382595509	/nfs/dbraw/zinc/59/55/09/1382595509.db2.gz	UFNDLQBYSJRUOI-QFIPXVFZSA-N	0	3	348.490	3.345	20	30		EGEDHN
N#Cc1cccc(-c2cc(C(F)(F)F)cnc2-n2cnc(CN)c2)c1	ZINC001162302057	1382727049	/nfs/dbraw/zinc/72/70/49/1382727049.db2.gz	JOLGFWWNEHFATE-UHFFFAOYSA-N	0	3	343.312	3.283	20	30		EGEDHN
C#CCN1CCC(CNC(=O)C[C@@H](C)CCCCC)(COC)CC1	ZINC001162513260	1382778140	/nfs/dbraw/zinc/77/81/40/1382778140.db2.gz	JOENPLZQULUAEN-SFHVURJKSA-N	0	3	336.520	3.071	20	30		EGEDHN
C#CCN1CCC(CNC(=O)[C@H](C)CC2CCCCC2)(COC)CC1	ZINC001162513257	1382778328	/nfs/dbraw/zinc/77/83/28/1382778328.db2.gz	JNWSIKGRUXSCCI-GOSISDBHSA-N	0	3	348.531	3.071	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@]1(C)CC=CCC1	ZINC001162822226	1382886008	/nfs/dbraw/zinc/88/60/08/1382886008.db2.gz	JZXASQGCXLBJJC-JOCHJYFZSA-N	0	3	338.495	3.417	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@]1(C)CCC[C@H]1CC	ZINC001162840902	1382891518	/nfs/dbraw/zinc/89/15/18/1382891518.db2.gz	HOMKOCKBOTYOBY-IFMALSPDSA-N	0	3	340.511	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CCC[C@@H](C)C1	ZINC001162906302	1382911936	/nfs/dbraw/zinc/91/19/36/1382911936.db2.gz	JDOGZOCSKHNCGJ-QUCCMNQESA-N	0	3	326.484	3.107	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1c(C)cccc1C	ZINC001162946543	1382923382	/nfs/dbraw/zinc/92/33/82/1382923382.db2.gz	LCYOOVCWUZDDAW-UHFFFAOYSA-N	0	3	334.463	3.211	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H](C)[C@H](C)CC	ZINC001162964306	1382930040	/nfs/dbraw/zinc/93/00/40/1382930040.db2.gz	VTWZZPRQDFUJTC-MOPGFXCFSA-N	0	3	328.500	3.353	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H](C)c1ccc(C)cc1	ZINC001162987427	1382938607	/nfs/dbraw/zinc/93/86/07/1382938607.db2.gz	RHSYIQWMSIQMAX-HXUWFJFHSA-N	0	3	348.490	3.393	20	30		EGEDHN
C=CCCCCCN1CCN(Cc2ccc(CNC(C)=O)cc2)CC1	ZINC001163013184	1382948617	/nfs/dbraw/zinc/94/86/17/1382948617.db2.gz	KCBUDQZJZXVSGI-UHFFFAOYSA-N	0	3	343.515	3.187	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCC1(CNCc2cc(Cl)ccc2F)CC1	ZINC001163853884	1383129764	/nfs/dbraw/zinc/12/97/64/1383129764.db2.gz	GGTNPMNKGWFOSM-LBPRGKRZSA-N	0	3	337.826	3.015	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCC1(CNCc2ccc(Cl)cc2F)CC1	ZINC001163854096	1383129769	/nfs/dbraw/zinc/12/97/69/1383129769.db2.gz	JNOBVGLWCGVFJF-LBPRGKRZSA-N	0	3	337.826	3.015	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCC1(CNCc2ccc(F)cc2Cl)CC1	ZINC001163853861	1383129835	/nfs/dbraw/zinc/12/98/35/1383129835.db2.gz	FDSRZQMOPUREED-GFCCVEGCSA-N	0	3	337.826	3.015	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCCNCC(=O)Nc1cccc(C(C)C)c1	ZINC001163963964	1383140521	/nfs/dbraw/zinc/14/05/21/1383140521.db2.gz	PPSCNPBVQXCLDB-UHFFFAOYSA-N	0	3	345.487	3.057	20	30		EGEDHN
N#Cc1ccc(F)c(CNCC2(CCNC(=O)C3=CCCC3)CC2)c1	ZINC001164075539	1383153327	/nfs/dbraw/zinc/15/33/27/1383153327.db2.gz	JXFZJXJYYGEYNP-UHFFFAOYSA-N	0	3	341.430	3.184	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)C[C@@H](C)CC)CC1	ZINC001164285120	1383174463	/nfs/dbraw/zinc/17/44/63/1383174463.db2.gz	QCRQTISXQZKYCY-LBPRGKRZSA-N	0	3	331.298	3.207	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCCCNCc1ccn(C2CCCC2)n1	ZINC001164345663	1383179687	/nfs/dbraw/zinc/17/96/87/1383179687.db2.gz	FSBYANOTEOPMSS-INIZCTEOSA-N	0	3	332.492	3.196	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NCCC1(CNCc2ccns2)CC1	ZINC001164692820	1383218352	/nfs/dbraw/zinc/21/83/52/1383218352.db2.gz	NBJYTZZCWKHUGN-UHFFFAOYSA-N	0	3	341.908	3.298	20	30		EGEDHN
CCN1CCC(N(C)C(F)(F)c2cnc(Cl)cc2C#N)CC1	ZINC001165068882	1383221491	/nfs/dbraw/zinc/22/14/91/1383221491.db2.gz	ZFJWVEIKZFJBRX-UHFFFAOYSA-N	0	3	328.794	3.072	20	30		EGEDHN
N#Cc1ccc(Cl)nc1C(F)(F)N1CCN[C@@H](c2ccccc2)C1	ZINC001165195553	1383244877	/nfs/dbraw/zinc/24/48/77/1383244877.db2.gz	IZKAYDHLSKLLTL-CQSZACIVSA-N	0	3	348.784	3.302	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCC1(CNCc2nc(C)cs2)CC1	ZINC001165215028	1383250092	/nfs/dbraw/zinc/25/00/92/1383250092.db2.gz	DIHKCXVUTSUYFY-UHFFFAOYSA-N	0	3	335.517	3.430	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCC1(CNCC(=C)Br)CC1	ZINC001165215419	1383251160	/nfs/dbraw/zinc/25/11/60/1383251160.db2.gz	WWZHCTBKWLZCGF-UHFFFAOYSA-N	0	3	343.309	3.373	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCC1(CNCc2oc(C)nc2C)CC1	ZINC001165221190	1383252032	/nfs/dbraw/zinc/25/20/32/1383252032.db2.gz	RPDLIAKBOCSZIG-UHFFFAOYSA-N	0	3	333.476	3.270	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)CCCC2CCOCC2)CC1	ZINC001165348545	1383279138	/nfs/dbraw/zinc/27/91/38/1383279138.db2.gz	DOQRRROLAXCMRF-UHFFFAOYSA-N	0	3	342.911	3.212	20	30		EGEDHN
C[C@@H]1CCC[C@@H](C(=O)NCCCNCc2ccc(C#N)cc2F)C1	ZINC001165424088	1383293309	/nfs/dbraw/zinc/29/33/09/1383293309.db2.gz	JCMWDAJKYHVDBU-GDBMZVCRSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cccc(C(C)C)n2)CC1	ZINC001165992836	1383374354	/nfs/dbraw/zinc/37/43/54/1383374354.db2.gz	KRKAWYMCGBEGLN-UHFFFAOYSA-N	0	3	335.879	3.447	20	30		EGEDHN
C[C@H]1CCC[C@@]1(C)C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001166053419	1383383259	/nfs/dbraw/zinc/38/32/59/1383383259.db2.gz	CLYBGGKTFFMGHA-IFXJQAMLSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2scnc2C(F)F)CC1	ZINC001166125958	1383392629	/nfs/dbraw/zinc/39/26/29/1383392629.db2.gz	MEKTZZPVUAWLDA-UHFFFAOYSA-N	0	3	349.834	3.323	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCC1(CNCc2oc(C)nc2C)CC1	ZINC001166694296	1383462315	/nfs/dbraw/zinc/46/23/15/1383462315.db2.gz	MYOCCOVDCOXDCN-KBPBESRZSA-N	0	3	333.476	3.126	20	30		EGEDHN
C=C1CCC(C(=O)NCCC2(CNCc3cnoc3C)CC2)CC1	ZINC001167025303	1383521964	/nfs/dbraw/zinc/52/19/64/1383521964.db2.gz	DSOWUYMVVRRINR-UHFFFAOYSA-N	0	3	331.460	3.106	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCC1(CNCC(=C)Br)CC1	ZINC001167026267	1383522508	/nfs/dbraw/zinc/52/25/08/1383522508.db2.gz	XUOBWAIZEQNYEW-OAHLLOKOSA-N	0	3	343.309	3.373	20	30		EGEDHN
C=CCCC1(C(=O)NCCC2(CNCc3cc(C)no3)CC2)CC1	ZINC001167029858	1383523072	/nfs/dbraw/zinc/52/30/72/1383523072.db2.gz	NIRSZPMXCOZIDY-UHFFFAOYSA-N	0	3	331.460	3.106	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)[C@@H]2CC[C@@H](C)C2)CC1	ZINC001167376675	1383615115	/nfs/dbraw/zinc/61/51/15/1383615115.db2.gz	DSTYMNCVKPCJGZ-TZMCWYRMSA-N	0	3	343.309	3.207	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@@H]2CCO[C@H](CCC)C2)CC1	ZINC001167540108	1383660918	/nfs/dbraw/zinc/66/09/18/1383660918.db2.gz	NBLALUVODCNFCW-HZPDHXFCSA-N	0	3	342.911	3.210	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cc3c([nH]2)CCCC3)CC1	ZINC001167656092	1383700123	/nfs/dbraw/zinc/70/01/23/1383700123.db2.gz	DAWGTEXSNGXHSD-UHFFFAOYSA-N	0	3	335.879	3.136	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cnn(C(C)C)c2C)CC1	ZINC001167706024	1383717664	/nfs/dbraw/zinc/71/76/64/1383717664.db2.gz	TZDKGFJUSPIMTC-UHFFFAOYSA-N	0	3	338.883	3.015	20	30		EGEDHN
Cc1cc([C@H](C)C(=O)NCCCNCc2ccccc2C#N)c(C)o1	ZINC001168464246	1383913869	/nfs/dbraw/zinc/91/38/69/1383913869.db2.gz	JYZGVAZEASMKGH-HNNXBMFYSA-N	0	3	339.439	3.168	20	30		EGEDHN
CC[C@@H]1CN(CC)CCN1Cc1cc(C#N)ccc1Br	ZINC001307765749	1384028797	/nfs/dbraw/zinc/02/87/97/1384028797.db2.gz	JTMBEHGECLDWLO-OAHLLOKOSA-N	0	3	336.277	3.237	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)c1ccoc1	ZINC001169165205	1384118065	/nfs/dbraw/zinc/11/80/65/1384118065.db2.gz	FECRXOLRGSKKDA-HNNXBMFYSA-N	0	3	325.412	3.230	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)[C@@H]2C[C@H]2C2CCCC2)c1	ZINC001169681772	1384173039	/nfs/dbraw/zinc/17/30/39/1384173039.db2.gz	RWCQNYAKYAYVIG-ZWKOTPCHSA-N	0	3	343.446	3.120	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)C1=COCCC1	ZINC001169697904	1384174806	/nfs/dbraw/zinc/17/48/06/1384174806.db2.gz	TZYBIXOAJXKQBY-MRXNPFEDSA-N	0	3	341.455	3.017	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)C1CC=CC1	ZINC001169926738	1384199427	/nfs/dbraw/zinc/19/94/27/1384199427.db2.gz	BKMRDBBAQSGQAQ-INIZCTEOSA-N	0	3	325.456	3.289	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1cccc(C(C)C)c1	ZINC001170127428	1384241993	/nfs/dbraw/zinc/24/19/93/1384241993.db2.gz	FDTRHYVOFVCKKS-UHFFFAOYSA-N	0	3	339.277	3.428	20	30		EGEDHN
Cc1nc(CNCCCC[C@@H](C)NC(=O)C#CC(C)C)sc1C	ZINC001170639938	1384355820	/nfs/dbraw/zinc/35/58/20/1384355820.db2.gz	XLOLIGWHSLSBQT-CQSZACIVSA-N	0	3	335.517	3.184	20	30		EGEDHN
Cc1cnc(CNCCCC[C@H](C)NC(=O)C#CC(C)(C)C)s1	ZINC001170708588	1384371236	/nfs/dbraw/zinc/37/12/36/1384371236.db2.gz	BGDPHAUFAUMMBS-AWEZNQCLSA-N	0	3	335.517	3.266	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H](C)CCCCNCc1nccn1C(F)F	ZINC001171034711	1384433539	/nfs/dbraw/zinc/43/35/39/1384433539.db2.gz	CPIPUSVOLSXSRP-AWEZNQCLSA-N	0	3	342.434	3.399	20	30		EGEDHN
N#Cc1cccc2c1CC[C@H]2Nc1cncc([C@H]2CN3CCC2CC3)n1	ZINC001171064614	1384440007	/nfs/dbraw/zinc/44/00/07/1384440007.db2.gz	IPSCINANPYOSNM-RBUKOAKNSA-N	0	3	345.450	3.257	20	30		EGEDHN
CCCc1occc1C(=O)NCCCNCc1ccccc1C#N	ZINC001171114765	1384448728	/nfs/dbraw/zinc/44/87/28/1384448728.db2.gz	CMFFZGJUPHWEBJ-UHFFFAOYSA-N	0	3	325.412	3.013	20	30		EGEDHN
C[C@@H](Cc1cccc(C#N)c1)NCc1ccnc(OCC2CCC2)n1	ZINC001171198525	1384466787	/nfs/dbraw/zinc/46/67/87/1384466787.db2.gz	MVMNMNQCRYTLRD-HNNXBMFYSA-N	0	3	336.439	3.248	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1CC[C@@H](N2CCCCC2)[C@@H](F)C1	ZINC001171234664	1384475810	/nfs/dbraw/zinc/47/58/10/1384475810.db2.gz	XPRZAYDYMDJBKF-LSTHTHJFSA-N	0	3	329.463	3.388	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)N1CCN(c2nccc3occc32)CC1	ZINC001172320059	1384769676	/nfs/dbraw/zinc/76/96/76/1384769676.db2.gz	SRHBRJDAMXUYEL-MRXNPFEDSA-N	0	3	346.434	3.453	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](NCc2ccc(OC)c(F)c2)C1	ZINC001317057154	1384831125	/nfs/dbraw/zinc/83/11/25/1384831125.db2.gz	BENJRTZTMQNRIE-KRWDZBQOSA-N	0	3	346.446	3.293	20	30		EGEDHN
C[C@@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C#N)C1)c1cncc(F)c1	ZINC001172980623	1384894315	/nfs/dbraw/zinc/89/43/15/1384894315.db2.gz	ZJITUADDDARMED-WQVCFCJDSA-N	0	3	348.422	3.163	20	30		EGEDHN
COc1ccc([N+](=O)[O-])c(C[C@@H](C)NCC#Cc2ccccc2)c1F	ZINC001173191197	1384934315	/nfs/dbraw/zinc/93/43/15/1384934315.db2.gz	KDZFCIYYNYEZRX-CQSZACIVSA-N	0	3	342.370	3.315	20	30		EGEDHN
C[C@@H](NC(=O)C1(C)CCC1)[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001317211299	1384991146	/nfs/dbraw/zinc/99/11/46/1384991146.db2.gz	XYUIZVMQHRRAFX-APWZRJJASA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C[C@@H](C(=O)NCC[C@H](C)NCc1nc(C)oc1C)c1ccccc1	ZINC001317415529	1385125532	/nfs/dbraw/zinc/12/55/32/1385125532.db2.gz	LPFDJTRKLXYVAT-KBXCAEBGSA-N	0	3	341.455	3.246	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H](C)CCCCNCc1ccn(C(C)C)n1	ZINC001174798126	1385150525	/nfs/dbraw/zinc/15/05/25/1385150525.db2.gz	IBBNKEKNSKSQJW-SFHVURJKSA-N	0	3	346.519	3.422	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H](C)CCCCNCc1ccn(CC)n1	ZINC001174833548	1385156767	/nfs/dbraw/zinc/15/67/67/1385156767.db2.gz	PNOKMSOJURYQLI-IRXDYDNUSA-N	0	3	334.508	3.270	20	30		EGEDHN
C=CCCCC(=O)N[C@H](C)CCCCNCc1nnc(C(C)C)n1C	ZINC001174987609	1385179532	/nfs/dbraw/zinc/17/95/32/1385179532.db2.gz	QLCHKAWQIRYCCU-MRXNPFEDSA-N	0	3	349.523	3.059	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](C)CCCCNCc2cnc(C)o2)CC1	ZINC001175074122	1385190348	/nfs/dbraw/zinc/19/03/48/1385190348.db2.gz	NVDIZFBXPURCHS-HNNXBMFYSA-N	0	3	333.476	3.494	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H](C)CCCCNCc1ccn(CC)n1	ZINC001175082247	1385191697	/nfs/dbraw/zinc/19/16/97/1385191697.db2.gz	MYHDUZVOVAFPDE-LPHOPBHVSA-N	0	3	334.508	3.270	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)CCCCNCc2cc(C)n(C)n2)CCC1	ZINC001175089431	1385193049	/nfs/dbraw/zinc/19/30/49/1385193049.db2.gz	JGRNOMBXFUQNCF-INIZCTEOSA-N	0	3	346.519	3.240	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H](CNC(=O)CCCC3CC3)C2)c1	ZINC001317538173	1385270020	/nfs/dbraw/zinc/27/00/20/1385270020.db2.gz	UMOUUVJQFRYTNS-LJQANCHMSA-N	0	3	325.456	3.077	20	30		EGEDHN
C[C@@H](C(=O)NCCCNCc1ccccc1C#N)c1cccc(F)c1	ZINC001176564946	1385626514	/nfs/dbraw/zinc/62/65/14/1385626514.db2.gz	ATWLNLWARRXVKL-OAHLLOKOSA-N	0	3	339.414	3.097	20	30		EGEDHN
C=CCC1(C(=O)NCCCNCc2c(C)noc2C)CCCCC1	ZINC001176786259	1385697047	/nfs/dbraw/zinc/69/70/47/1385697047.db2.gz	WAEMWRAYOMDUER-UHFFFAOYSA-N	0	3	333.476	3.414	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1ccc(C2CC2)cc1	ZINC001176737210	1385676641	/nfs/dbraw/zinc/67/66/41/1385676641.db2.gz	WOESZMFVDGWVMJ-UHFFFAOYSA-N	0	3	337.261	3.182	20	30		EGEDHN
CC1=CC[C@](C)(C(=O)NCCCNCc2cc(C#N)ccc2F)CC1	ZINC001176745123	1385679347	/nfs/dbraw/zinc/67/93/47/1385679347.db2.gz	OBPPBXGXRVALIX-FQEVSTJZSA-N	0	3	343.446	3.430	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)C1(CC)CCCCC1	ZINC001176803546	1385707071	/nfs/dbraw/zinc/70/70/71/1385707071.db2.gz	AILAXUOYQNVQCN-UHFFFAOYSA-N	0	3	331.298	3.351	20	30		EGEDHN
CC[C@H](CNC(=O)C1C(C)(C)C1(C)C)NCc1ccc(C#N)s1	ZINC001318512085	1385730790	/nfs/dbraw/zinc/73/07/90/1385730790.db2.gz	MYQIJPAXVVGVIG-GFCCVEGCSA-N	0	3	333.501	3.286	20	30		EGEDHN
Cc1cccc(Cl)c1CNCC1(NC(=O)[C@@H](C)C#N)CCCC1	ZINC001318626810	1385802676	/nfs/dbraw/zinc/80/26/76/1385802676.db2.gz	NTVYDQYOUUNXGN-AWEZNQCLSA-N	0	3	333.863	3.327	20	30		EGEDHN
CC(C)[C@H]1CC[C@@H](C)C[C@H]1CN[C@H](C(N)=O)c1ccc(C#N)cc1	ZINC001318632163	1385806329	/nfs/dbraw/zinc/80/63/29/1385806329.db2.gz	XQCQATUTXGFATC-FDPIWHGQSA-N	0	3	327.472	3.383	20	30		EGEDHN
Cc1csc(CNCCCN(CC2CCCC2)C(=O)[C@@H](C)C#N)n1	ZINC001177256494	1385887122	/nfs/dbraw/zinc/88/71/22/1385887122.db2.gz	FSANBOBSXPMZTL-AWEZNQCLSA-N	0	3	348.516	3.110	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)C(=O)C(C)(C)C	ZINC001177261175	1385888273	/nfs/dbraw/zinc/88/82/73/1385888273.db2.gz	GGXDSOWGZGPVQP-UHFFFAOYSA-N	0	3	342.911	3.353	20	30		EGEDHN
Cc1ncoc1CNCCCN(CC1CCCC1)C(=O)C#CC(C)C	ZINC001177312117	1385909787	/nfs/dbraw/zinc/90/97/87/1385909787.db2.gz	UWMYJVAXYYGNMB-UHFFFAOYSA-N	0	3	345.487	3.141	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)C(C)(C)COC	ZINC001177362864	1385929778	/nfs/dbraw/zinc/92/97/78/1385929778.db2.gz	SMUJWTPPKHDNMP-UHFFFAOYSA-N	0	3	344.927	3.410	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)c1oncc1C	ZINC001177456360	1385962648	/nfs/dbraw/zinc/96/26/48/1385962648.db2.gz	RWTYXKLONQSJKZ-UHFFFAOYSA-N	0	3	339.867	3.348	20	30		EGEDHN
Cc1ccc(CCC(=O)NCCCNCc2ccccc2C#N)s1	ZINC001177524302	1385985181	/nfs/dbraw/zinc/98/51/81/1385985181.db2.gz	IWPHQKRJGLLZDE-UHFFFAOYSA-N	0	3	341.480	3.157	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)[C@@H](C)Cc1ccccc1	ZINC001319281390	1386040130	/nfs/dbraw/zinc/04/01/30/1386040130.db2.gz	JVIONRUCKOQBSB-MSOLQXFVSA-N	0	3	349.478	3.279	20	30		EGEDHN
N#CC(Cc1cccs1)C(=O)NCc1cccc(-c2c[nH]cn2)c1	ZINC001177917155	1386083632	/nfs/dbraw/zinc/08/36/32/1386083632.db2.gz	DMACWISFXKOVOC-OAHLLOKOSA-N	0	3	336.420	3.137	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)CCCC2CC2)CCCC1	ZINC001319372507	1386086806	/nfs/dbraw/zinc/08/68/06/1386086806.db2.gz	MFMPHGQXHZALPT-UHFFFAOYSA-N	0	3	343.309	3.494	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCCCCCN[C@@H](C)c1c(F)cccc1F	ZINC001178059826	1386119198	/nfs/dbraw/zinc/11/91/98/1386119198.db2.gz	RDOVUXNORSCXLO-KBPBESRZSA-N	0	3	337.414	3.452	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccc(F)cc2)CCN1C(=O)c1ccsc1	ZINC001178088737	1386126701	/nfs/dbraw/zinc/12/67/01/1386126701.db2.gz	VPIRMTGJLHYYON-KSSFIOAISA-N	0	3	342.439	3.132	20	30		EGEDHN
Cc1nc(CNCCCCCCNC(=O)C#CC(C)C)sc1C	ZINC001178418529	1386211351	/nfs/dbraw/zinc/21/13/51/1386211351.db2.gz	BIURSVMVSSUCRD-UHFFFAOYSA-N	0	3	335.517	3.186	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccc(F)cc2)CCN1C(=O)CCC1CCC1	ZINC001178437448	1386217263	/nfs/dbraw/zinc/21/72/63/1386217263.db2.gz	HLVCEIQHJZLEFW-JXFKEZNVSA-N	0	3	342.458	3.337	20	30		EGEDHN
C=C(C)CCC(=O)NCCCCCCNCc1nnc(C(C)C)n1C	ZINC001178596765	1386259108	/nfs/dbraw/zinc/25/91/08/1386259108.db2.gz	YXAHRSSUBWCRBT-UHFFFAOYSA-N	0	3	349.523	3.061	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)C[C@H]1C=CCCC1	ZINC001178982931	1386367114	/nfs/dbraw/zinc/36/71/14/1386367114.db2.gz	UHCHLFVBRIFQDG-JBACZVJFSA-N	0	3	336.479	3.364	20	30		EGEDHN
CC[C@@H](F)C(=O)NCCCCCCNCc1cc(F)ccc1C#N	ZINC001179264785	1386433884	/nfs/dbraw/zinc/43/38/84/1386433884.db2.gz	BBCVGIAVARWJBE-QGZVFWFLSA-N	0	3	337.414	3.212	20	30		EGEDHN
CN1CCN(c2ccc(C=NNCc3ccccc3Cl)cc2)CC1	ZINC001319995558	1386441937	/nfs/dbraw/zinc/44/19/37/1386441937.db2.gz	DNXSXJPCFKWXHS-UHFFFAOYSA-N	0	3	342.874	3.216	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCCCCCCNCc1cn(C(C)C)nn1	ZINC001179335805	1386454858	/nfs/dbraw/zinc/45/48/58/1386454858.db2.gz	QZTRRQLXBIUFSE-QGZVFWFLSA-N	0	3	349.523	3.228	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCCCCCCN[C@H](C)c1nnc(C)[nH]1	ZINC001179340338	1386457525	/nfs/dbraw/zinc/45/75/25/1386457525.db2.gz	ZIYYDTSPNHISDV-ZBFHGGJFSA-N	0	3	335.496	3.043	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1ccc2oc(C)nc2c1)C1CC1	ZINC001698648350	1406297124	/nfs/dbraw/zinc/29/71/24/1406297124.db2.gz	YNTYSPCMYJDNFU-SFHVURJKSA-N	0	3	347.846	3.377	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@H](NCc2ccnc(Cl)c2)[C@@H]1C	ZINC001179384348	1386469227	/nfs/dbraw/zinc/46/92/27/1386469227.db2.gz	KEYYHNHVLLFHMP-LZWOXQAQSA-N	0	3	335.879	3.416	20	30		EGEDHN
C=CCCCC(=O)NCCCCCCNCc1nnc(C(C)C)n1C	ZINC001179421890	1386480613	/nfs/dbraw/zinc/48/06/13/1386480613.db2.gz	OCHYIEDJHKXFCB-UHFFFAOYSA-N	0	3	349.523	3.061	20	30		EGEDHN
C=C1CCC(C(=O)NCCCCCCNCc2cc(C)no2)CC1	ZINC001179474841	1386491493	/nfs/dbraw/zinc/49/14/93/1386491493.db2.gz	LCAUTMZONOKYBR-UHFFFAOYSA-N	0	3	333.476	3.496	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@@H]1C	ZINC001179495171	1386497578	/nfs/dbraw/zinc/49/75/78/1386497578.db2.gz	LLVMWQIRLNGWKD-ZSXHRAQDSA-N	0	3	342.458	3.192	20	30		EGEDHN
CC(C)CC(=O)N1C[C@@H](C)[C@](C)(CNCc2ccccc2C#N)C1	ZINC001180430565	1386794119	/nfs/dbraw/zinc/79/41/19/1386794119.db2.gz	JMGHJAWEDJZKIB-OXQOHEQNSA-N	0	3	327.472	3.179	20	30		EGEDHN
CC/C(C)=C/C(=O)N1C[C@@H](C)[C@](C)(CNCc2ccccc2C#N)C1	ZINC001181395398	1386987348	/nfs/dbraw/zinc/98/73/48/1386987348.db2.gz	NCVQSIRHFZLYOA-HPOPOXNVSA-N	0	3	339.483	3.489	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)NC(=O)c1ccc(C(F)F)cc1	ZINC001322023354	1387032977	/nfs/dbraw/zinc/03/29/77/1387032977.db2.gz	HDNWQGICMQQPFB-NSHDSACASA-N	0	3	349.406	3.465	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)c1cc(F)ccc1F	ZINC001322177100	1387089264	/nfs/dbraw/zinc/08/92/64/1387089264.db2.gz	SSNISJBLGIDKES-ZDUSSCGKSA-N	0	3	343.377	3.087	20	30		EGEDHN
CCCC[C@H](C)C(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001182279374	1387136875	/nfs/dbraw/zinc/13/68/75/1387136875.db2.gz	XIVSDRGLDJDALT-WMLDXEAASA-N	0	3	331.435	3.214	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](NCc2ccc(OC)c(F)c2)C1	ZINC001182898246	1387242009	/nfs/dbraw/zinc/24/20/09/1387242009.db2.gz	SOULSMYMLCBPKM-OAHLLOKOSA-N	0	3	334.435	3.127	20	30		EGEDHN
CC(F)(F)CC(=O)NC[C@H]1CCCCCN1Cc1ccc(C#N)cc1	ZINC001329935617	1389263113	/nfs/dbraw/zinc/26/31/13/1389263113.db2.gz	CCBBKJLEBAESQT-QGZVFWFLSA-N	0	3	349.425	3.464	20	30		EGEDHN
C=CCn1c([C@H](C)OC(C)(C)C)nnc1N1C[C@H](C)N(CC)C[C@@H]1C	ZINC001338994550	1389854138	/nfs/dbraw/zinc/85/41/38/1389854138.db2.gz	FRILHZQEBHSBRX-JYJNAYRXSA-N	0	3	349.523	3.259	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N1CCc2cccc(C(F)(F)F)c2C1	ZINC001340847607	1390383647	/nfs/dbraw/zinc/38/36/47/1390383647.db2.gz	LJVFYLLMTNIRBY-OAHLLOKOSA-N	0	3	326.362	3.274	20	30		EGEDHN
CCCc1c(C(=O)C(C#N)c2nccn2C)cnn1C1CCCC1	ZINC001342164709	1390580324	/nfs/dbraw/zinc/58/03/24/1390580324.db2.gz	IAUXRVPPBAXKLY-CQSZACIVSA-N	0	3	325.416	3.174	20	30		EGEDHN
C[C@@H](C(=O)C(C#N)C(=O)NC1CCCCC1)c1ccc(F)c(F)c1	ZINC001342580678	1390628729	/nfs/dbraw/zinc/62/87/29/1390628729.db2.gz	UAEITAWLPJYDAB-BXUZGUMPSA-N	0	3	334.366	3.226	20	30		EGEDHN
CCOC(=O)c1csc(C(C#N)C(=O)c2ccc(OC)c(C)c2)n1	ZINC001343125891	1390693126	/nfs/dbraw/zinc/69/31/26/1390693126.db2.gz	IHOIXJLYINOGGH-LBPRGKRZSA-N	0	3	344.392	3.127	20	30		EGEDHN
N#CCc1cccc(C(=O)C(C#N)c2nccn2Cc2ccccc2)c1	ZINC001343991826	1390748929	/nfs/dbraw/zinc/74/89/29/1390748929.db2.gz	YIADZLGAKXIVNY-IBGZPJMESA-N	0	3	340.386	3.488	20	30		EGEDHN
Cn1c(Cl)cnc1C(C#N)C(=O)CCCC(=O)c1ccccc1	ZINC001346087977	1390906418	/nfs/dbraw/zinc/90/64/18/1390906418.db2.gz	PECAIPVPCQCSDP-CYBMUJFWSA-N	0	3	329.787	3.303	20	30		EGEDHN
COc1cccc([C@H]2CCN(C(=O)[C@@H](N)CCCCC#N)C2(C)C)c1	ZINC001349848522	1391375601	/nfs/dbraw/zinc/37/56/01/1391375601.db2.gz	CEUWWTILFCJLFD-MSOLQXFVSA-N	0	3	343.471	3.201	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N1CC[C@@H]2CCCC[C@H]2C1	ZINC001351542927	1391650180	/nfs/dbraw/zinc/65/01/80/1391650180.db2.gz	ABGFQWQBQJOVDK-BZSNNMDCSA-N	0	3	343.519	3.290	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)C2(C)CCCCC2)C1	ZINC001479319786	1392213568	/nfs/dbraw/zinc/21/35/68/1392213568.db2.gz	UCCDJAKYADVIHK-OKILXGFUSA-N	0	3	343.309	3.350	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1ccn(C(F)F)n1	ZINC001479820738	1392410938	/nfs/dbraw/zinc/41/09/38/1392410938.db2.gz	CRIYCGKXBHMRCM-WCQYABFASA-N	0	3	346.809	3.004	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@H](C)NCc2ccc(F)c(C#N)c2)cc1F	ZINC001480499046	1392770521	/nfs/dbraw/zinc/77/05/21/1392770521.db2.gz	KHMUWNSSXCHGBR-ZDUSSCGKSA-N	0	3	343.377	3.053	20	30		EGEDHN
Cc1coc(C(=O)N[C@@H](CNCc2ccc(C#N)s2)CC(C)C)c1	ZINC001698871591	1406591018	/nfs/dbraw/zinc/59/10/18/1406591018.db2.gz	OTTPJUAWZHTIQK-CQSZACIVSA-N	0	3	345.468	3.456	20	30		EGEDHN
Cc1ccsc1C(=O)NCC[C@@H](C)NCc1ccccc1C#N	ZINC001480745899	1392911132	/nfs/dbraw/zinc/91/11/32/1392911132.db2.gz	GHFQDPGNXKMFLJ-CQSZACIVSA-N	0	3	327.453	3.226	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)C(C)(C)c1cccc(F)c1	ZINC001480790421	1392934902	/nfs/dbraw/zinc/93/49/02/1392934902.db2.gz	MWMGDMSPJNIAMC-CYBMUJFWSA-N	0	3	326.843	3.340	20	30		EGEDHN
CCN(CCNC(=O)[C@H](F)c1ccccc1)Cc1ccc(C#N)cc1	ZINC001481003046	1393081748	/nfs/dbraw/zinc/08/17/48/1393081748.db2.gz	XJPFWRYUFXPEHX-LJQANCHMSA-N	0	3	339.414	3.207	20	30		EGEDHN
CCCC1(C(=O)NC[C@H]2CCN(Cc3cccc(C#N)c3)C2)CC1	ZINC001481110397	1393122302	/nfs/dbraw/zinc/12/23/02/1393122302.db2.gz	LKNPJSGEOXJJQA-GOSISDBHSA-N	0	3	325.456	3.077	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1ccc2cc[nH]c2c1)C1CC1	ZINC001481943247	1394608742	/nfs/dbraw/zinc/60/87/42/1394608742.db2.gz	DEPVQDSVAKCOID-SFHVURJKSA-N	0	3	331.847	3.409	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1cn(C(C)C)nc1C)C1CC1	ZINC001481947649	1394612362	/nfs/dbraw/zinc/61/23/62/1394612362.db2.gz	WABOUWYTHQVXBD-QGZVFWFLSA-N	0	3	338.883	3.013	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1ccc(-c2cn[nH]c2)cc1)C(C)C	ZINC001482558565	1395088885	/nfs/dbraw/zinc/08/88/85/1395088885.db2.gz	FCNLIVBMFGYEKH-KRWDZBQOSA-N	0	3	346.862	3.173	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1coc(C2CCC2)n1)C(C)C	ZINC001698978032	1406750414	/nfs/dbraw/zinc/75/04/14/1406750414.db2.gz	PDMOYNQHYMQWAF-ZDUSSCGKSA-N	0	3	325.840	3.039	20	30		EGEDHN
C[C@H](CN(C)C(=O)C(C)(C)C1CCC1)NCc1ccc(C#N)s1	ZINC001485906896	1396163640	/nfs/dbraw/zinc/16/36/40/1396163640.db2.gz	SYABLEHHJIBCNN-CYBMUJFWSA-N	0	3	333.501	3.383	20	30		EGEDHN
C[C@H](CCNC(=O)[C@@H]1CC[C@@H](C)CC1)NCc1ccccc1C#N	ZINC001492114471	1396305351	/nfs/dbraw/zinc/30/53/51/1396305351.db2.gz	BOSOONCNPIXYOH-BRWVUGGUSA-N	0	3	327.472	3.369	20	30		EGEDHN
Cc1cc(C)c(C(=O)N[C@H](C)CN(C)Cc2ccc(C#N)cc2)s1	ZINC001498295463	1396962098	/nfs/dbraw/zinc/96/20/98/1396962098.db2.gz	SMZZPOLMIQXNAX-CQSZACIVSA-N	0	3	341.480	3.487	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CCCN(CCc2ccc(OC)cc2)C1	ZINC001690038912	1404274090	/nfs/dbraw/zinc/27/40/90/1404274090.db2.gz	KFMCCFOOQGDPMY-GOSISDBHSA-N	0	3	344.499	3.421	20	30		EGEDHN
CC(C)(C(=O)NC1CCC(NCc2ccccc2C#N)CC1)C(F)F	ZINC001690540649	1404626848	/nfs/dbraw/zinc/62/68/48/1404626848.db2.gz	WRQMSIHDPKFXSD-UHFFFAOYSA-N	0	3	349.425	3.367	20	30		EGEDHN
Cc1scc(C(=O)NC[C@H](C)NCc2ccc(F)c(C#N)c2)c1C	ZINC001690579227	1404638485	/nfs/dbraw/zinc/63/84/85/1404638485.db2.gz	KSWRLMHRXODJOS-NSHDSACASA-N	0	3	345.443	3.284	20	30		EGEDHN
Cc1cc(F)cc(C(=O)NC[C@H](C)NCc2ccc(F)c(C#N)c2)c1	ZINC001690624912	1404659584	/nfs/dbraw/zinc/65/95/84/1404659584.db2.gz	GFUYEAYYQKKLME-ZDUSSCGKSA-N	0	3	343.377	3.053	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)CCc2ccc3[nH]ccc3c2)C1	ZINC001691512258	1405312878	/nfs/dbraw/zinc/31/28/78/1405312878.db2.gz	XBFLZSPNHNPJIE-JCNLHEQBSA-N	0	3	345.874	3.337	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)C[C@@H](C)CC(C)C)C1	ZINC001691750554	1405469947	/nfs/dbraw/zinc/46/99/47/1405469947.db2.gz	SMQGPURINRQKLE-AEGPPILISA-N	0	3	345.325	3.452	20	30		EGEDHN
CC[C@H](CNC(=O)c1cc(C)c(C)o1)NCc1ccc(C#N)s1	ZINC001732195500	1428447121	/nfs/dbraw/zinc/44/71/21/1428447121.db2.gz	JAWCLYFOCOANOQ-CYBMUJFWSA-N	0	3	331.441	3.128	20	30		EGEDHN
CC[C@H](CNC(=O)c1cccc(C)c1F)NCc1ccc(C#N)s1	ZINC001732200150	1428450670	/nfs/dbraw/zinc/45/06/70/1428450670.db2.gz	LPFDELPVMDANRJ-CYBMUJFWSA-N	0	3	345.443	3.366	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2c(C)noc2C)CCCC[C@H]1C	ZINC001732254169	1428495475	/nfs/dbraw/zinc/49/54/75/1428495475.db2.gz	TUJDFWFNCQWEKP-DIFFPNOSSA-N	0	3	339.867	3.312	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)c2occc2C)CCCC1	ZINC001732390718	1428560206	/nfs/dbraw/zinc/56/02/06/1428560206.db2.gz	VZZHKYMTYOGGRC-UHFFFAOYSA-N	0	3	341.249	3.129	20	30		EGEDHN
CCc1ccc(C(=O)N(C)[C@H](C)CNCc2ccc(C#N)s2)s1	ZINC001732425971	1428576082	/nfs/dbraw/zinc/57/60/82/1428576082.db2.gz	DDXJNJMABIIAND-GFCCVEGCSA-N	0	3	347.509	3.494	20	30		EGEDHN
CCC1(C(=O)N[C@H](C)CN(C)Cc2ccc(OCC#N)cc2)CCC1	ZINC001699454363	1412797712	/nfs/dbraw/zinc/79/77/12/1412797712.db2.gz	LBFPPPTVBFEPTB-MRXNPFEDSA-N	0	3	343.471	3.106	20	30		EGEDHN
C=C(Br)CN[C@@H](C)CCNC(=O)C=C1CCCCC1	ZINC001700321686	1413788455	/nfs/dbraw/zinc/78/84/55/1413788455.db2.gz	UDUZJWFCKQCAJE-ZDUSSCGKSA-N	0	3	329.282	3.270	20	30		EGEDHN
C[C@H](CNCc1ccc(F)c(C#N)c1)NC(=O)C1(C)CCCCC1	ZINC001732969122	1429093760	/nfs/dbraw/zinc/09/37/60/1429093760.db2.gz	PDMWKNVNGXSYNK-CQSZACIVSA-N	0	3	331.435	3.262	20	30		EGEDHN
C[C@@H](CN(C)Cc1cccc(C#N)c1)NC(=O)c1cc(F)ccc1F	ZINC001733044772	1429177167	/nfs/dbraw/zinc/17/71/67/1429177167.db2.gz	JQMAPRLXUOZJNU-ZDUSSCGKSA-N	0	3	343.377	3.087	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1cccc2[nH]ncc21	ZINC001707443983	1417347781	/nfs/dbraw/zinc/34/77/81/1417347781.db2.gz	QJSAVGIKSDXTOK-GUYCJALGSA-N	0	3	346.862	3.288	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1cc(C)sn1	ZINC001712996157	1417547308	/nfs/dbraw/zinc/54/73/08/1417547308.db2.gz	GRKUFRKRPWCXTK-GXTWGEPZSA-N	0	3	327.881	3.177	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H](CNC(=O)c2cccs2)C2CC2)c1	ZINC001713102513	1417657658	/nfs/dbraw/zinc/65/76/58/1417657658.db2.gz	BCAKFYJOWPCBRQ-MRXNPFEDSA-N	0	3	343.427	3.057	20	30		EGEDHN
N#Cc1ccc(CN[C@@H](CNC(=O)c2ccsc2)C2CC2)c(F)c1	ZINC001713105690	1417665541	/nfs/dbraw/zinc/66/55/41/1417665541.db2.gz	PRDXLBIXKCDBGF-KRWDZBQOSA-N	0	3	343.427	3.057	20	30		EGEDHN
CC[C@@H](C)CCC(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2OC)C1	ZINC001713171265	1417744607	/nfs/dbraw/zinc/74/46/07/1417744607.db2.gz	FYNPCOJDEJIGMQ-ZTFGCOKTSA-N	0	3	343.471	3.130	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)[C@H](C)c1ccccc1	ZINC001733060255	1429207910	/nfs/dbraw/zinc/20/79/10/1429207910.db2.gz	AGWPHDVROIDEFX-IAGOWNOFSA-N	0	3	335.451	3.298	20	30		EGEDHN
CC(C)CCC(=O)NC[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001713210663	1417782627	/nfs/dbraw/zinc/78/26/27/1417782627.db2.gz	VVQNUBIYNADVCE-IBGZPJMESA-N	0	3	327.472	3.323	20	30		EGEDHN
C[C@H](NC(=O)CC1CC1)[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001713272189	1417886649	/nfs/dbraw/zinc/88/66/49/1417886649.db2.gz	SLEUYVIDFRJYRQ-KXBFYZLASA-N	0	3	325.456	3.075	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1ccc(OC)c(C2CC2)c1	ZINC001713419726	1418044188	/nfs/dbraw/zinc/04/41/88/1418044188.db2.gz	GIHRSUIGMXCACO-ZDUSSCGKSA-N	0	3	336.863	3.423	20	30		EGEDHN
CCC1(C(=O)N[C@@H](CNCc2ccc(C#N)cc2F)C2CC2)CCC1	ZINC001733181119	1429282699	/nfs/dbraw/zinc/28/26/99/1429282699.db2.gz	WRWLGSKSPAJZED-SFHVURJKSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)Cc1cccc(F)c1F)C1CC1	ZINC001714172763	1418980388	/nfs/dbraw/zinc/98/03/88/1418980388.db2.gz	CBNCGXDDEJTEGB-QGZVFWFLSA-N	0	3	342.817	3.134	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2[nH]c(C)nc2C)CCCC[C@@H]1C	ZINC001714185752	1418992759	/nfs/dbraw/zinc/99/27/59/1418992759.db2.gz	CQYZFTRJVWAFFS-APPDUMDISA-N	0	3	338.883	3.047	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2[nH]c(C)nc2C)CCCC[C@@H]1C	ZINC001714185754	1418993021	/nfs/dbraw/zinc/99/30/21/1418993021.db2.gz	CQYZFTRJVWAFFS-GTNSWQLSSA-N	0	3	338.883	3.047	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@H]1CC[C@H](NCc2c(F)cccc2Cl)CC1	ZINC001714297554	1419076637	/nfs/dbraw/zinc/07/66/37/1419076637.db2.gz	ZTBCARAYYYUWOY-JHJVBQTASA-N	0	3	337.826	3.156	20	30		EGEDHN
C[C@@H](CNC(=O)[C@@H](C)Cc1ccccc1)NCc1ccc(C#N)s1	ZINC001714303733	1419083814	/nfs/dbraw/zinc/08/38/14/1419083814.db2.gz	HOBLTOICHMMAIL-GJZGRUSLSA-N	0	3	341.480	3.093	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@H]1CCCN(C[C@@H]2CCC(F)(F)C2)C1	ZINC001714923848	1419676630	/nfs/dbraw/zinc/67/66/30/1419676630.db2.gz	PIFPIGCRBUAXSX-CABCVRRESA-N	0	3	326.431	3.052	20	30		EGEDHN
CC(C)SCC(=O)N1CC[C@@H](NCc2ccccc2C#N)[C@H](C)C1	ZINC001714998223	1419729294	/nfs/dbraw/zinc/72/92/94/1419729294.db2.gz	GBFHCEMVGFQQHY-CRAIPNDOSA-N	0	3	345.512	3.026	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)COc1ccc(C)cc1C)C(C)C	ZINC001715502973	1420186030	/nfs/dbraw/zinc/18/60/30/1420186030.db2.gz	BVGJHYHXNGRBOO-MRXNPFEDSA-N	0	3	338.879	3.165	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cnc2ccsc2c1)C(C)C	ZINC001715505388	1420188570	/nfs/dbraw/zinc/18/85/70/1420188570.db2.gz	SEQQGNRUVCOIEV-AWEZNQCLSA-N	0	3	337.876	3.393	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cc2ccccc2n1C)C(C)C	ZINC001715506575	1420190091	/nfs/dbraw/zinc/19/00/91/1420190091.db2.gz	LZDJDHKUACPFDD-HNNXBMFYSA-N	0	3	333.863	3.275	20	30		EGEDHN
CC(C)(C)CC(=O)N[C@@H]1CCC[C@@H]1CNCc1ccccc1C#N	ZINC001716056933	1420520185	/nfs/dbraw/zinc/52/01/85/1420520185.db2.gz	YMSSZVONULMNIU-QZTJIDSGSA-N	0	3	327.472	3.369	20	30		EGEDHN
C[C@H](C#N)C(=O)NC1(C)CCN(Cc2cc3ccccc3o2)CC1	ZINC001716794559	1420927342	/nfs/dbraw/zinc/92/73/42/1420927342.db2.gz	NBNJNNAAVDVGST-CQSZACIVSA-N	0	3	325.412	3.063	20	30		EGEDHN
CC(F)(F)CC(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1	ZINC001716797513	1420930385	/nfs/dbraw/zinc/93/03/85/1420930385.db2.gz	YVYMPHGJBZIYDD-UHFFFAOYSA-N	0	3	335.398	3.074	20	30		EGEDHN
C[C@H](CNC(=O)CC(C1CC1)C1CC1)N(C)Cc1ccc(C#N)cc1	ZINC001717500382	1421443859	/nfs/dbraw/zinc/44/38/59/1421443859.db2.gz	SCRPJAFBSXNIRQ-OAHLLOKOSA-N	0	3	339.483	3.321	20	30		EGEDHN
CN(C(=O)CC1(C)CC1)[C@@H](CNCc1cc(C#N)ccc1F)C1CC1	ZINC001717733490	1421598329	/nfs/dbraw/zinc/59/83/29/1421598329.db2.gz	ICCYJEPSXKLNTD-SFHVURJKSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@H](C#N)C(=O)NCC1(C)CCN(Cc2ccccc2Cl)CC1	ZINC001733445686	1429654685	/nfs/dbraw/zinc/65/46/85/1429654685.db2.gz	BISBRSPWBJLNCZ-CQSZACIVSA-N	0	3	333.863	3.218	20	30		EGEDHN
Cc1ccc(C)c(C(=O)N[C@@H](C)CN(C)Cc2ccc(C#N)cc2)c1	ZINC001722904555	1424229968	/nfs/dbraw/zinc/22/99/68/1424229968.db2.gz	DXVOTQHZQKARHC-KRWDZBQOSA-N	0	3	335.451	3.425	20	30		EGEDHN
C[C@H](CN(C)Cc1cccc(C#N)c1)NC(=O)[C@H](C)c1ccccc1	ZINC001722907186	1424239668	/nfs/dbraw/zinc/23/96/68/1424239668.db2.gz	WHVADFACBDMAGW-IAGOWNOFSA-N	0	3	335.451	3.298	20	30		EGEDHN
CCC(CC)C(=O)N(C)CCCN(C)Cc1ccc(F)c(C#N)c1	ZINC001724844100	1425194216	/nfs/dbraw/zinc/19/42/16/1425194216.db2.gz	JMETXPXEBJOBCB-UHFFFAOYSA-N	0	3	333.451	3.414	20	30		EGEDHN
Cc1occc1C(=O)N(C)CC(C)(C)CNCc1ccccc1C#N	ZINC001725139850	1425617352	/nfs/dbraw/zinc/61/73/52/1425617352.db2.gz	AWTRTMQUGCINON-UHFFFAOYSA-N	0	3	339.439	3.348	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccc(CF)cc1)N(C)Cc1cccc(C#N)c1	ZINC001725202412	1425758987	/nfs/dbraw/zinc/75/89/87/1425758987.db2.gz	OLQGRYLRGMRCGR-HNNXBMFYSA-N	0	3	339.414	3.278	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1c[nH]nc1C1CC1	ZINC001731296144	1427238545	/nfs/dbraw/zinc/23/85/45/1427238545.db2.gz	WTSASOFZEOUPMM-DOMZBBRYSA-N	0	3	336.867	3.012	20	30		EGEDHN
CC(C)(C(=O)NC[C@@H]1CCCN(Cc2ccc(C#N)cc2)C1)C1CC1	ZINC001731500683	1427480263	/nfs/dbraw/zinc/48/02/63/1427480263.db2.gz	YOLOSHPKCVFDNL-SFHVURJKSA-N	0	3	339.483	3.323	20	30		EGEDHN
C[C@@H](CNC(=O)C1CCC2(CC2)CC1)NCc1ccc(F)c(C#N)c1	ZINC001731607530	1427652720	/nfs/dbraw/zinc/65/27/20/1427652720.db2.gz	VATQFQUSHXYMSK-AWEZNQCLSA-N	0	3	343.446	3.262	20	30		EGEDHN
Cc1cccc(CC(=O)NCC[C@@H](C)NCc2ccccc2C#N)c1	ZINC001731733507	1427812157	/nfs/dbraw/zinc/81/21/57/1427812157.db2.gz	YFONMZSYPACWNA-QGZVFWFLSA-N	0	3	335.451	3.094	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCN(C)Cc1ccc(-c2ccsc2)cc1	ZINC001731766991	1427875243	/nfs/dbraw/zinc/87/52/43/1427875243.db2.gz	QYONRDRYILPWOP-AWEZNQCLSA-N	0	3	327.453	3.123	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccoc1C1CC1)N(C)Cc1cccc(C#N)c1	ZINC001734051617	1437841455	/nfs/dbraw/zinc/84/14/55/1437841455.db2.gz	OLINQNBCVHSGDK-AWEZNQCLSA-N	0	3	337.423	3.279	20	30		EGEDHN
C[C@@H](CN(C)C(=O)c1ccoc1Cl)NCc1ccc(F)c(C#N)c1	ZINC001734321218	1438048265	/nfs/dbraw/zinc/04/82/65/1438048265.db2.gz	SMCMFSCDFDXOSN-NSHDSACASA-N	0	3	349.793	3.194	20	30		EGEDHN
Cc1ccccc1CC(=O)N(C)C[C@@H](C)NCc1ccc(C#N)s1	ZINC001734355620	1438073109	/nfs/dbraw/zinc/07/31/09/1438073109.db2.gz	WOGLDHSIKRMRBV-OAHLLOKOSA-N	0	3	341.480	3.107	20	30		EGEDHN
CC(C)(C)[C@H](CNCc1ccc(C#N)cc1F)NC(=O)C1=CCCC1	ZINC001734558835	1438157066	/nfs/dbraw/zinc/15/70/66/1438157066.db2.gz	FDLYVTITVNRCOD-SFHVURJKSA-N	0	3	343.446	3.428	20	30		EGEDHN
C=C(Cl)CNC1CC(N(C)C(=O)COc2c(C)cccc2C)C1	ZINC001734601792	1438183128	/nfs/dbraw/zinc/18/31/28/1438183128.db2.gz	AKYQOLHIEFCZMC-UHFFFAOYSA-N	0	3	336.863	3.014	20	30		EGEDHN
CC#CCCCC(=O)N1CCCC[C@@H]1[C@H](C)NCc1ccns1	ZINC001752143463	1440145236	/nfs/dbraw/zinc/14/52/36/1440145236.db2.gz	MSCLFLGAUOYXMK-DOTOQJQBSA-N	0	3	333.501	3.196	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1cccc2nc[nH]c21	ZINC001752156515	1440147052	/nfs/dbraw/zinc/14/70/52/1440147052.db2.gz	HLECUACPRJDFHU-BBRMVZONSA-N	0	3	346.862	3.288	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)CCc1cscn1	ZINC001752159263	1440148365	/nfs/dbraw/zinc/14/83/65/1440148365.db2.gz	ZEZLABUOSFIKMT-UKRRQHHQSA-N	0	3	341.908	3.187	20	30		EGEDHN
C=C(C)CN1CCC(N(CCC)C(=O)c2ccc(COC)o2)CC1	ZINC001752439736	1440180917	/nfs/dbraw/zinc/18/09/17/1440180917.db2.gz	JGIITCPTUNXTEQ-UHFFFAOYSA-N	0	3	334.460	3.319	20	30		EGEDHN
CC1(C)C(C(=O)NC[C@H](NCc2ccc(C#N)s2)C2CC2)C1(C)C	ZINC001752454958	1440183093	/nfs/dbraw/zinc/18/30/93/1440183093.db2.gz	SNVYDQJRJGEPRY-HNNXBMFYSA-N	0	3	345.512	3.286	20	30		EGEDHN
CC(C)c1cccc(CN[C@H](CNC(=O)C#CC(C)(C)C)C2CC2)n1	ZINC001752465561	1440183977	/nfs/dbraw/zinc/18/39/77/1440183977.db2.gz	ZVJHGBNQWJZJPC-LJQANCHMSA-N	0	3	341.499	3.239	20	30		EGEDHN
C=CCCCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)/C=C/c1ccc[nH]1	ZINC001752531668	1440194020	/nfs/dbraw/zinc/19/40/20/1440194020.db2.gz	CYKFTYKMXQLQKZ-MDLUVKOWSA-N	0	3	327.472	3.450	20	30		EGEDHN
C=CCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H](C)n1nc(C)cc1C	ZINC001752545685	1440195111	/nfs/dbraw/zinc/19/51/11/1440195111.db2.gz	ZEBSSDGNJLEIMN-QRVBRYPASA-N	0	3	344.503	3.092	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)OCCC(C)C	ZINC001752566713	1440195463	/nfs/dbraw/zinc/19/54/63/1440195463.db2.gz	IJAKFKRFKGBCID-MKXGPGLRSA-N	0	3	336.520	3.468	20	30		EGEDHN
O=C(CC1CCC1)N[C@H]1C[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001752619185	1440196539	/nfs/dbraw/zinc/19/65/39/1440196539.db2.gz	DCARMZMGRIQEOU-QAQDUYKDSA-N	0	3	330.859	3.119	20	30		EGEDHN
CCC(C)(C)C(=O)N[C@H]1C[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001752660507	1440198349	/nfs/dbraw/zinc/19/83/49/1440198349.db2.gz	GXMWWHJAWVWLTG-QAQDUYKDSA-N	0	3	332.875	3.365	20	30		EGEDHN
CC(C)(C)/C=C/C(=O)N[C@H]1C[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001752719436	1440203796	/nfs/dbraw/zinc/20/37/96/1440203796.db2.gz	BNZZICQTRGEIAT-BPRGGRAXSA-N	0	3	328.431	3.016	20	30		EGEDHN
CC[C@H](N[C@H]1C[C@@H](NC(=O)C#CC2CC2)C1)c1ccc(F)cc1F	ZINC001752726139	1440204021	/nfs/dbraw/zinc/20/40/21/1440204021.db2.gz	MGLDLTKKDKZWOR-DAYGRLMNSA-N	0	3	332.394	3.066	20	30		EGEDHN
C=CC[C@@H](C(=O)N[C@H]1C[C@@H](NCc2cncs2)C1)c1ccccc1	ZINC001752774174	1440206481	/nfs/dbraw/zinc/20/64/81/1440206481.db2.gz	NATIJQICJZZIHG-SOLBZPMBSA-N	0	3	341.480	3.240	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)[C@@H](C)Cc1ccccc1C	ZINC001752824729	1440222931	/nfs/dbraw/zinc/22/29/31/1440222931.db2.gz	CQLGTPVBYUNCKF-AZUAARDMSA-N	0	3	326.484	3.168	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)COC[C@H](C)c1ccccc1	ZINC001752825281	1440223412	/nfs/dbraw/zinc/22/34/12/1440223412.db2.gz	OXGHJECFZIGMLJ-AZUAARDMSA-N	0	3	344.499	3.354	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)[C@@H](OC(C)C)c1ccccc1	ZINC001752826278	1440223822	/nfs/dbraw/zinc/22/38/22/1440223822.db2.gz	ZCEALFDYYNXIST-UXHICEINSA-N	0	3	342.483	3.147	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@H]1CCCCN1Cc1ccccc1N(C)C	ZINC001752828226	1440224538	/nfs/dbraw/zinc/22/45/38/1440224538.db2.gz	SLDOKYIJCBKPCI-GOSISDBHSA-N	0	3	343.515	3.436	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)CC(C)(C)CC(F)F)C1	ZINC001752838274	1440228647	/nfs/dbraw/zinc/22/86/47/1440228647.db2.gz	ZYDJVLSJBLILEF-GJZGRUSLSA-N	0	3	328.447	3.298	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)CC(C)(C)C(F)(F)F)C1	ZINC001752841377	1440230777	/nfs/dbraw/zinc/23/07/77/1440230777.db2.gz	PUEWGVKKWXGPHC-UONOGXRCSA-N	0	3	332.410	3.205	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H](C)[C@H]1CCCN(Cc2cnoc2C)C1	ZINC001752841873	1440231071	/nfs/dbraw/zinc/23/10/71/1440231071.db2.gz	SVXPXXGPZWIBTJ-AEFFLSMTSA-N	0	3	345.487	3.283	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)CCc2ccc(C)cc2C)C1	ZINC001752842555	1440231472	/nfs/dbraw/zinc/23/14/72/1440231472.db2.gz	XZOJBBSKYTZCCW-CTNGQTDRSA-N	0	3	340.511	3.476	20	30		EGEDHN
C=CCCC(=O)NC[C@@H](C)NCc1cc(F)cc(Br)c1	ZINC001752863572	1440236168	/nfs/dbraw/zinc/23/61/68/1440236168.db2.gz	BCUPCLWXFJYOLD-LLVKDONJSA-N	0	3	343.240	3.149	20	30		EGEDHN
C[C@H](CNC(=O)CC1(C)CCCC1)NCc1ccc(C#N)c(F)c1	ZINC001752871364	1440237105	/nfs/dbraw/zinc/23/71/05/1440237105.db2.gz	YWPMYBBWGKXMSH-CQSZACIVSA-N	0	3	331.435	3.262	20	30		EGEDHN
C#CCCCC(=O)NC[C@@H](C)NCc1ccc(Cl)c(Cl)c1	ZINC001752870893	1440237209	/nfs/dbraw/zinc/23/72/09/1440237209.db2.gz	PYBALRKJHVWJEP-GFCCVEGCSA-N	0	3	327.255	3.391	20	30		EGEDHN
CC(C)(C)/C=C\C(=O)N1CC[C@H](CNCc2ccccc2C#N)C1	ZINC001752934528	1440250209	/nfs/dbraw/zinc/25/02/09/1440250209.db2.gz	HYEQJDMCWGZQNR-SIJIIQCFSA-N	0	3	325.456	3.099	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CCC[C@H](NCc3ccn(CC)n3)C2)CCC1	ZINC001752976860	1440256243	/nfs/dbraw/zinc/25/62/43/1440256243.db2.gz	SEZJWFFRMXVGBP-DLBZAZTESA-N	0	3	344.503	3.166	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1CCCNC(=O)c1coc(CCC)n1	ZINC001753037602	1440274977	/nfs/dbraw/zinc/27/49/77/1440274977.db2.gz	ISXDBBYEVKNPCN-AWEZNQCLSA-N	0	3	339.867	3.354	20	30		EGEDHN
CCN(CCNC(=O)[C@@H]1C[C@H]1CC(C)C)Cc1cccc(C#N)c1	ZINC001753088772	1440297800	/nfs/dbraw/zinc/29/78/00/1440297800.db2.gz	QEVINKKYIUUMHZ-RTBURBONSA-N	0	3	327.472	3.179	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@H]1CCCN1Cc1cccc(COC)c1	ZINC001753108348	1440307397	/nfs/dbraw/zinc/30/73/97/1440307397.db2.gz	KTIABGUTOWJDOZ-GOSISDBHSA-N	0	3	330.472	3.126	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@@H]1CCN(Cc2cn(C(C)C)nc2C)C1	ZINC001753132288	1440317317	/nfs/dbraw/zinc/31/73/17/1440317317.db2.gz	LUMQFMVNHCJGRG-MSOLQXFVSA-N	0	3	346.519	3.313	20	30		EGEDHN
C=CCOCC(=O)N(C)CCN[C@H](C)c1ccc(Cl)c(Cl)c1	ZINC001753176646	1440336633	/nfs/dbraw/zinc/33/66/33/1440336633.db2.gz	WXKNCMDVTCNACE-GFCCVEGCSA-N	0	3	345.270	3.305	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC([C@H](C)NCc2cnc(C)o2)CC1	ZINC001753275621	1440346113	/nfs/dbraw/zinc/34/61/13/1440346113.db2.gz	SZIIFSGCZRPDLD-AWEZNQCLSA-N	0	3	333.476	3.302	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC([C@@H](C)NCc2cnc(C)o2)CC1	ZINC001753278867	1440346794	/nfs/dbraw/zinc/34/67/94/1440346794.db2.gz	VUPSKXPRKSJPLT-ZBFHGGJFSA-N	0	3	333.476	3.302	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@H]2CC[C@@H](C1)N2[C@@H]1CCc2ccc(F)cc21	ZINC001753305063	1440355334	/nfs/dbraw/zinc/35/53/34/1440355334.db2.gz	IPDBUAFNGBQJGG-WSTZPKSXSA-N	0	3	340.442	3.148	20	30		EGEDHN
C=C(C)CN[C@@H](CNC(=O)CCc1scnc1C)c1ccccc1	ZINC001753314448	1440358519	/nfs/dbraw/zinc/35/85/19/1440358519.db2.gz	ZZXAQVYRZLVRDT-KRWDZBQOSA-N	0	3	343.496	3.407	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CCC)C(=O)[C@@H](OC)C2CCCCC2)C1	ZINC001753324226	1440365664	/nfs/dbraw/zinc/36/56/64/1440365664.db2.gz	ZWSFAJWLGLEUHY-MOPGFXCFSA-N	0	3	336.520	3.471	20	30		EGEDHN
C[C@H](c1ccc2c(c1)CCC2)N1CC(CNC(=O)C#CC(C)(C)C)C1	ZINC001753401925	1440391119	/nfs/dbraw/zinc/39/11/19/1440391119.db2.gz	WBGVFJPEDOZIKU-MRXNPFEDSA-N	0	3	338.495	3.334	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1C[C@@H]2C[C@H]1CN2CCC1=CCCCC1	ZINC001753418454	1440394765	/nfs/dbraw/zinc/39/47/65/1440394765.db2.gz	DFKHFHWQGZARHP-WDSOQIARSA-N	0	3	332.488	3.143	20	30		EGEDHN
CCCCCCCN1C[C@@H]2C[C@H]1CN2C(=O)CCc1c(C)n[nH]c1C	ZINC001753427996	1440397772	/nfs/dbraw/zinc/39/77/72/1440397772.db2.gz	SJYWXBGSZOFLNG-ROUUACIJSA-N	0	3	346.519	3.215	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N(C)[C@@H]1CCN(CCc2ccc(OC)cc2)C1	ZINC001753443468	1440402411	/nfs/dbraw/zinc/40/24/11/1440402411.db2.gz	WMVYNNWDNIPOPH-GOSISDBHSA-N	0	3	344.499	3.373	20	30		EGEDHN
C=CCOCCN1CC[C@H](N(C)C(=O)[C@H](CC)c2ccc(F)cc2)C1	ZINC001753450122	1440405721	/nfs/dbraw/zinc/40/57/21/1440405721.db2.gz	MYUWVOMJVPTXFB-RBUKOAKNSA-N	0	3	348.462	3.055	20	30		EGEDHN
CCN(C(=O)C#CC(C)C)[C@@H]1CCN(CCc2ccc(Cl)cc2)C1	ZINC001753456025	1440408119	/nfs/dbraw/zinc/40/81/19/1440408119.db2.gz	QINIXTBNZIVYMO-LJQANCHMSA-N	0	3	346.902	3.465	20	30		EGEDHN
CC[C@@H](CNC(=O)c1occc1C)NCC#Cc1ccc(Cl)cc1	ZINC001753465552	1440412548	/nfs/dbraw/zinc/41/25/48/1440412548.db2.gz	CBSUNAARRGLOCK-KRWDZBQOSA-N	0	3	344.842	3.391	20	30		EGEDHN
CC[C@H](CNC(=O)[C@@H]1CC=CCC1)NCc1ccc(C#N)c(F)c1	ZINC001753466427	1440412869	/nfs/dbraw/zinc/41/28/69/1440412869.db2.gz	KQBIGHIVCFDWAR-NVXWUHKLSA-N	0	3	329.419	3.038	20	30		EGEDHN
CC[C@H](CNC(=O)C#CC(C)C)NCc1cc(C(C)C)ccc1OC	ZINC001753472043	1440414114	/nfs/dbraw/zinc/41/41/14/1440414114.db2.gz	YVCFCTRLVBQGEI-LJQANCHMSA-N	0	3	344.499	3.462	20	30		EGEDHN
CC[C@H](CNC(=O)C[C@@H]1CC=CCC1)NCc1ccc(C#N)c(F)c1	ZINC001753482109	1440416945	/nfs/dbraw/zinc/41/69/45/1440416945.db2.gz	BIYGYMVSDNFIFZ-CRAIPNDOSA-N	0	3	343.446	3.428	20	30		EGEDHN
CC[C@@H](CNC(=O)[C@@H]1C[C@H]1CC)NCC#Cc1ccc(Cl)cc1	ZINC001753486188	1440417781	/nfs/dbraw/zinc/41/77/81/1440417781.db2.gz	KXUVDDYPCVASHH-BPQIPLTHSA-N	0	3	332.875	3.222	20	30		EGEDHN
CCCc1occc1C(=O)NC[C@H](CC)NCC#Cc1ccccc1	ZINC001753495663	1440421339	/nfs/dbraw/zinc/42/13/39/1440421339.db2.gz	JSUMINVJQKHQJX-SFHVURJKSA-N	0	3	338.451	3.382	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)C[C@@H]1Cc2ccccc2O1)C1CC1	ZINC001753519063	1440428175	/nfs/dbraw/zinc/42/81/75/1440428175.db2.gz	WCMCLCMZXLXSPB-LPHOPBHVSA-N	0	3	348.874	3.007	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2nccs2)CCCC[C@H]1C	ZINC001753536211	1440432665	/nfs/dbraw/zinc/43/26/65/1440432665.db2.gz	RAXUWDDEAYWKJO-IAQYHMDHSA-N	0	3	327.881	3.164	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@@H](CCNCc2ccc(C#N)cc2F)C1	ZINC001753538414	1440433070	/nfs/dbraw/zinc/43/30/70/1440433070.db2.gz	CLKDKFFPRALGRT-INIZCTEOSA-N	0	3	345.462	3.462	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCCN(C(=O)CCc2cncs2)C1	ZINC001753556855	1440436167	/nfs/dbraw/zinc/43/61/67/1440436167.db2.gz	YQRLRUIKXDZZLL-CQSZACIVSA-N	0	3	341.908	3.047	20	30		EGEDHN
CC/C(C)=C/C(=O)N[C@H]1CC[C@H](NCc2ccccc2C#N)CC1	ZINC001753580918	1440440234	/nfs/dbraw/zinc/44/02/34/1440440234.db2.gz	XIRJFTUPACTCNT-MVNUTDAASA-N	0	3	325.456	3.432	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)CSCCC)CCCC1	ZINC001753661254	1440458701	/nfs/dbraw/zinc/45/87/01/1440458701.db2.gz	FAVIBVRLFNDIHD-UHFFFAOYSA-N	0	3	349.338	3.057	20	30		EGEDHN
C[C@@H]1C[C@@H]1C(=O)NCc1ccc(CNCC#Cc2ccccc2)cc1	ZINC001753588620	1440442115	/nfs/dbraw/zinc/44/21/15/1440442115.db2.gz	UMWHMGZFTGRCAQ-UTKZUKDTSA-N	0	3	332.447	3.100	20	30		EGEDHN
C=CCCC(=O)N1CCC2(CCN(Cc3ccc(C#N)s3)C2)CC1	ZINC001753602407	1440446670	/nfs/dbraw/zinc/44/66/70/1440446670.db2.gz	MKBNOPRGFITIBE-UHFFFAOYSA-N	0	3	343.496	3.400	20	30		EGEDHN
C[C@@H](CNCc1ccccc1C#N)CNC(=O)CC1=CCCCC1	ZINC001753607938	1440448384	/nfs/dbraw/zinc/44/83/84/1440448384.db2.gz	XFXUJCFDOMKMIM-INIZCTEOSA-N	0	3	325.456	3.291	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H](C)CNCc2ncc(C)s2)CCCC1	ZINC001753648012	1440455970	/nfs/dbraw/zinc/45/59/70/1440455970.db2.gz	XSQOAHNABYGUPN-AWEZNQCLSA-N	0	3	335.517	3.430	20	30		EGEDHN
C[C@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)C12CCC(CC1)C2	ZINC001753698544	1440467974	/nfs/dbraw/zinc/46/79/74/1440467974.db2.gz	FTFALILFHYJGGX-ZUIJCZDSSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=CC1(CC(=O)N(C)[C@@H](C)CN[C@@H](C)c2n[nH]c(C)n2)CCCCC1	ZINC001753716624	1440472108	/nfs/dbraw/zinc/47/21/08/1440472108.db2.gz	YBZHZTLHBFDYGU-GJZGRUSLSA-N	0	3	347.507	3.137	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](CN[C@H](C)c2n[nH]c(C)n2)CC(C)C)CC1	ZINC001753742357	1440479597	/nfs/dbraw/zinc/47/95/97/1440479597.db2.gz	QQRLJTMHDAUQKJ-RHSMWYFYSA-N	0	3	347.507	3.041	20	30		EGEDHN
C=CCCCC(=O)N1CCC(CCN(C)Cc2cnoc2C)CC1	ZINC001753821419	1440496202	/nfs/dbraw/zinc/49/62/02/1440496202.db2.gz	CLWMWLZHYNJHKF-UHFFFAOYSA-N	0	3	333.476	3.400	20	30		EGEDHN
C=CCCC(=O)NC[C@H](NCC#Cc1ccccc1Cl)C(C)C	ZINC001753826220	1440498349	/nfs/dbraw/zinc/49/83/49/1440498349.db2.gz	QXEFYXIVKGLXQH-SFHVURJKSA-N	0	3	332.875	3.388	20	30		EGEDHN
C=C(Br)CNCC[C@@H](C)NC(=O)[C@@]1(C)CC=CCC1	ZINC001753967918	1440526739	/nfs/dbraw/zinc/52/67/39/1440526739.db2.gz	BVOZCHIJOJWDLF-HIFRSBDPSA-N	0	3	329.282	3.126	20	30		EGEDHN
C=C(Cl)CNCC[C@@H](C)NC(=O)c1ncc(Cl)cc1Cl	ZINC001754022235	1440532711	/nfs/dbraw/zinc/53/27/11/1440532711.db2.gz	XQVIHNNFDLLPQY-SECBINFHSA-N	0	3	336.650	3.239	20	30		EGEDHN
C=CCC1(C(=O)NC/C=C/CNCc2ccc(F)c(F)c2)CCC1	ZINC001754166657	1440546431	/nfs/dbraw/zinc/54/64/31/1440546431.db2.gz	QELXUFKCSWYHBM-ONEGZZNKSA-N	0	3	334.410	3.473	20	30		EGEDHN
C=C[C@H](C(=O)NC/C=C\CNCCC(F)(F)F)c1ccccc1	ZINC001754210551	1440551188	/nfs/dbraw/zinc/55/11/88/1440551188.db2.gz	ZCKQOFYVRSWICO-XHPSBEMXSA-N	0	3	326.362	3.171	20	30		EGEDHN
Cc1ccccc1C(=O)N[C@H](C)CNCC#Cc1cccc(Cl)c1	ZINC001754216395	1440551912	/nfs/dbraw/zinc/55/19/12/1440551912.db2.gz	NBGBAXPVXWDQKW-MRXNPFEDSA-N	0	3	340.854	3.408	20	30		EGEDHN
CCc1ccc(F)cc1C(=O)N[C@H](C)CNCc1ccc(C#N)s1	ZINC001754232856	1440554402	/nfs/dbraw/zinc/55/44/02/1440554402.db2.gz	MLQUDBBOFIJNIF-GFCCVEGCSA-N	0	3	345.443	3.229	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CCCC[C@H]1CNCc1ccccc1C#N	ZINC001754339195	1440587804	/nfs/dbraw/zinc/58/78/04/1440587804.db2.gz	DNPRWLHWOYQWES-OALUTQOASA-N	0	3	325.456	3.289	20	30		EGEDHN
CC(C)(C)/C=C\C(=O)N[C@@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001754434351	1440597733	/nfs/dbraw/zinc/59/77/33/1440597733.db2.gz	ACBTWUQOOXSNPI-GIFJBRJJSA-N	0	3	343.446	3.284	20	30		EGEDHN
CC/C=C(/C)C(=O)N[C@@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001754435173	1440597886	/nfs/dbraw/zinc/59/78/86/1440597886.db2.gz	XXYBTYPDLFXNFB-BLWUPGMOSA-N	0	3	329.419	3.038	20	30		EGEDHN
CCCC1(C(=O)N[C@@H](CNCc2ccc(C#N)c(F)c2)C2CC2)CC1	ZINC001754450642	1440600906	/nfs/dbraw/zinc/60/09/06/1440600906.db2.gz	QTWYSMITMTWNMR-SFHVURJKSA-N	0	3	343.446	3.262	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](NC(=O)C2CCC=CCC2)C2CC2)s1	ZINC001754459578	1440603067	/nfs/dbraw/zinc/60/30/67/1440603067.db2.gz	AGJJFSMSNZNGKW-SFHVURJKSA-N	0	3	343.496	3.351	20	30		EGEDHN
C=C[C@H](C(=O)N[C@@H](CNCc1ccns1)C1CC1)c1ccccc1	ZINC001754461299	1440603526	/nfs/dbraw/zinc/60/35/26/1440603526.db2.gz	KKYNUMOCFUXELW-ROUUACIJSA-N	0	3	341.480	3.097	20	30		EGEDHN
C=CCC[C@H](C)N1CC[C@@H]1CNC(=O)c1ccc(OC(C)C)nc1	ZINC001754485603	1440608659	/nfs/dbraw/zinc/60/86/59/1440608659.db2.gz	YQGFIBBYXSLEDE-DOTOQJQBSA-N	0	3	331.460	3.028	20	30		EGEDHN
C=CCC[C@H](C)N1CC[C@H]1CNC(=O)c1c(F)cc(OC)cc1F	ZINC001754493878	1440611057	/nfs/dbraw/zinc/61/10/57/1440611057.db2.gz	HIIVMLLCCGXNRF-STQMWFEESA-N	0	3	338.398	3.132	20	30		EGEDHN
C=CCCCCCN1CC[C@@H]1CNC(=O)c1cc2ccccn2c1	ZINC001754496970	1440612590	/nfs/dbraw/zinc/61/25/90/1440612590.db2.gz	ZFZVEDAFSQWVDV-LJQANCHMSA-N	0	3	325.456	3.490	20	30		EGEDHN
C[C@@H](C(=O)NCC1(NCc2ccc(C#N)c(F)c2)CC1)C(C)(C)C	ZINC001754517900	1440618990	/nfs/dbraw/zinc/61/89/90/1440618990.db2.gz	FDJSJUXCHYZZHL-ZDUSSCGKSA-N	0	3	331.435	3.118	20	30		EGEDHN
C#CCCCC(=O)NCCN(Cc1cnoc1C)C1CCCCCC1	ZINC001754546831	1440627957	/nfs/dbraw/zinc/62/79/57/1440627957.db2.gz	VEYZCPXLUZOPLX-UHFFFAOYSA-N	0	3	345.487	3.428	20	30		EGEDHN
C=C(Cl)CN(CC1CC1)C1CCN(C(=O)Cc2cccnc2)CC1	ZINC001754548096	1440628585	/nfs/dbraw/zinc/62/85/85/1440628585.db2.gz	DEORDXDASQBHCT-UHFFFAOYSA-N	0	3	347.890	3.080	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC1CCOCC1	ZINC001754553733	1440630715	/nfs/dbraw/zinc/63/07/15/1440630715.db2.gz	KIOVILVFANPWHR-HDICACEKSA-N	0	3	334.504	3.081	20	30		EGEDHN
CC/C(C)=C\C(=O)N1CC[C@H](NCc2ccccc2C#N)C[C@H]1C	ZINC001754593840	1440641092	/nfs/dbraw/zinc/64/10/92/1440641092.db2.gz	UJCMUJFBFYGONK-WRHXIEKYSA-N	0	3	325.456	3.384	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)[C@@H](C)c2ccc(F)c(F)c2)CC1	ZINC001754630337	1440647544	/nfs/dbraw/zinc/64/75/44/1440647544.db2.gz	XOPYALFWGIXSID-AWEZNQCLSA-N	0	3	334.410	3.062	20	30		EGEDHN
C#CCN(C(=O)[C@H](F)CC)C1CCN(Cc2ccc(CF)cc2)CC1	ZINC001754639552	1440648814	/nfs/dbraw/zinc/64/88/14/1440648814.db2.gz	MZNTZTGDOPURRH-LJQANCHMSA-N	0	3	348.437	3.330	20	30		EGEDHN
Cc1ccc(F)c(CNC[C@H](NC(=O)[C@H](C)C#N)C2CCCC2)c1	ZINC001754645310	1440650020	/nfs/dbraw/zinc/65/00/20/1440650020.db2.gz	KIBABDZKMDUUFW-KDOFPFPSSA-N	0	3	331.435	3.058	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)[C@@H](C)CCOc2ccccc2)C1	ZINC001754686049	1440664887	/nfs/dbraw/zinc/66/48/87/1440664887.db2.gz	XXDAFXFJDCSSCL-FXAWDEMLSA-N	0	3	330.472	3.248	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@](C)(CN[C@@H](C)c2cnc(C)cn2)C1	ZINC001754694366	1440666788	/nfs/dbraw/zinc/66/67/88/1440666788.db2.gz	BPYKIDQTEOVHCB-LPHOPBHVSA-N	0	3	330.476	3.031	20	30		EGEDHN
C=CCN1CCC[C@](C)(CNC(=O)[C@H](C)n2cnc3ccccc32)C1	ZINC001754731408	1440679455	/nfs/dbraw/zinc/67/94/55/1440679455.db2.gz	GFKCTLKABSBLPG-OXJNMPFZSA-N	0	3	340.471	3.002	20	30		EGEDHN
CC#CCN1CCC[C@@](C)(CNC(=O)C23CCC(CC2)C3(C)C)C1	ZINC001754731957	1440679834	/nfs/dbraw/zinc/67/98/34/1440679834.db2.gz	KUVFIEUPRSOIBB-SGDIKTSBSA-N	0	3	330.516	3.444	20	30		EGEDHN
CC/C=C(/C)C(=O)N1CC[C@H]([C@@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001754787937	1440688194	/nfs/dbraw/zinc/68/81/94/1440688194.db2.gz	PWSHBRIKBCVHOW-VMLNSGBVSA-N	0	3	343.446	3.380	20	30		EGEDHN
CC[C@H](C)C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2CC#Cc1ccccc1	ZINC001754829797	1440694362	/nfs/dbraw/zinc/69/43/62/1440694362.db2.gz	UTJOXRDGGSZBKY-WJMWBRGCSA-N	0	3	338.495	3.443	20	30		EGEDHN
C#CCNCCN(Cc1ccccc1)C(=O)c1sccc1C1CC1	ZINC001754839444	1440697635	/nfs/dbraw/zinc/69/76/35/1440697635.db2.gz	QUMJEBFQNSTLPW-UHFFFAOYSA-N	0	3	338.476	3.491	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@@H](c3ccccc3)[C@H](C)CC)C[C@@H]2C1	ZINC001754847541	1440699641	/nfs/dbraw/zinc/69/96/41/1440699641.db2.gz	FIJPQIPCAIAUJA-AYWYSENESA-N	0	3	338.495	3.230	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1ccc(F)cc1	ZINC001754865237	1440702710	/nfs/dbraw/zinc/70/27/10/1440702710.db2.gz	IRYPGGKJLFUBEQ-OALUTQOASA-N	0	3	328.431	3.195	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CCN(C(=O)/C(C)=C\CC)C1	ZINC001754905097	1440707553	/nfs/dbraw/zinc/70/75/53/1440707553.db2.gz	ATDVXPRZDLZDGS-WTKLMOFPSA-N	0	3	329.282	3.080	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCN(C(=O)c2cc(F)c(C)cc2F)C1	ZINC001754919927	1440709220	/nfs/dbraw/zinc/70/92/20/1440709220.db2.gz	XWMXBZNEVQKYKP-ZDUSSCGKSA-N	0	3	342.817	3.468	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCN(C(=O)c2ccnc(C3CC3)c2)C1	ZINC001754922189	1440709430	/nfs/dbraw/zinc/70/94/30/1440709430.db2.gz	LQHDLTMXFALBNC-CQSZACIVSA-N	0	3	333.863	3.153	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCN(C(=O)Cc2cccc(Cl)c2)C1	ZINC001754929567	1440710276	/nfs/dbraw/zinc/71/02/76/1440710276.db2.gz	ODCHVLAMYYAWJS-CQSZACIVSA-N	0	3	341.282	3.463	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCN(C(=O)c2scnc2C(C)C)C1	ZINC001754934102	1440710955	/nfs/dbraw/zinc/71/09/55/1440710955.db2.gz	IXLYBZVOGFCGMG-CYBMUJFWSA-N	0	3	341.908	3.461	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCN(C(=O)c2cc3c(s2)CCC3)C1	ZINC001754940957	1440711828	/nfs/dbraw/zinc/71/18/28/1440711828.db2.gz	AWVADQYJTCSXHG-ZDUSSCGKSA-N	0	3	338.904	3.431	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCc1ccccc1CN(C)[C@@H](C)COC	ZINC001754946467	1440713290	/nfs/dbraw/zinc/71/32/90/1440713290.db2.gz	JLWIPMCNVWHGIR-INIZCTEOSA-N	0	3	332.488	3.372	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)NCc1ccc([C@@H](C)NC/C=C\Cl)cc1	ZINC001754947561	1440713800	/nfs/dbraw/zinc/71/38/00/1440713800.db2.gz	OMGUOFIIDPTVGY-UFZMMNPQSA-N	0	3	336.863	3.033	20	30		EGEDHN
C#CCN[C@H](C)c1ccc(CNC(=O)CC[C@@H]2CC(C)(C)CO2)cc1	ZINC001754948358	1440714070	/nfs/dbraw/zinc/71/40/70/1440714070.db2.gz	HTKBLUOEXSGRDW-VQIMIIECSA-N	0	3	342.483	3.182	20	30		EGEDHN
C/C=C(/C)C(=O)N[C@H]1CC[C@H](CNCc2cc(F)ccc2C#N)CC1	ZINC001754950480	1440714787	/nfs/dbraw/zinc/71/47/87/1440714787.db2.gz	NATADVVSVPGXLE-SLORPSORSA-N	0	3	343.446	3.428	20	30		EGEDHN
CC#CCN[C@H](C)c1ccc(CNC(=O)c2scnc2Cl)cc1	ZINC001754951348	1440715048	/nfs/dbraw/zinc/71/50/48/1440715048.db2.gz	QNORGIPHRKEFOE-GFCCVEGCSA-N	0	3	347.871	3.400	20	30		EGEDHN
Cc1coc(C)c1C(=O)NCC1(NCc2ccc(C#N)s2)CCC1	ZINC001754980150	1440721110	/nfs/dbraw/zinc/72/11/10/1440721110.db2.gz	RQGVKBRXWCWRBI-UHFFFAOYSA-N	0	3	343.452	3.272	20	30		EGEDHN
C=CCCC(=O)N1CCO[C@@H](CN[C@@H](C)c2ccccc2Cl)C1	ZINC001754994826	1440725441	/nfs/dbraw/zinc/72/54/41/1440725441.db2.gz	CIHFZHKUKZGCAZ-GJZGRUSLSA-N	0	3	336.863	3.184	20	30		EGEDHN
CC#CCCCC(=O)N1CCC(CC)(NCc2cc(C)on2)CC1	ZINC001755070980	1440746488	/nfs/dbraw/zinc/74/64/88/1440746488.db2.gz	DPOBWXPEFZRGNX-UHFFFAOYSA-N	0	3	331.460	3.037	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@H]1Cc2ccccc2CN1C[C@H](CC)OC	ZINC001755075372	1440748314	/nfs/dbraw/zinc/74/83/14/1440748314.db2.gz	FKGPLDROSQYKDX-UXHICEINSA-N	0	3	344.499	3.311	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@](CO)(NCc2cccc(C)c2)C1	ZINC001755088827	1440751151	/nfs/dbraw/zinc/75/11/51/1440751151.db2.gz	BZTBKYYATOYETR-NRFANRHFSA-N	0	3	344.499	3.040	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)CC3(COC)CC3)cc2C1	ZINC001755101090	1440752464	/nfs/dbraw/zinc/75/24/64/1440752464.db2.gz	RFNYYFNUBHOPOS-UHFFFAOYSA-N	0	3	328.456	3.011	20	30		EGEDHN
CC/C(C)=C\C(=O)N1C[C@H](C)[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001755108826	1440753964	/nfs/dbraw/zinc/75/39/64/1440753964.db2.gz	MDLSQDILJILWQG-PVBCSNIWSA-N	0	3	344.886	3.484	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCN1C(=O)C[C@@H](C)c1cccc(OC)c1	ZINC001755202339	1440780584	/nfs/dbraw/zinc/78/05/84/1440780584.db2.gz	DCDAOYZMPCALPK-SJLPKXTDSA-N	0	3	330.472	3.298	20	30		EGEDHN
C[C@@H](C(=O)NC1CC(CNCc2cc(C#N)ccc2F)C1)C(C)(C)C	ZINC001755213437	1440783631	/nfs/dbraw/zinc/78/36/31/1440783631.db2.gz	GUIDENYJBOPJPL-KTAKPFMOSA-N	0	3	345.462	3.364	20	30		EGEDHN
C=C(Cl)CNCC1CC(NC(=O)[C@H](C)c2c(F)cccc2F)C1	ZINC001755213963	1440783660	/nfs/dbraw/zinc/78/36/60/1440783660.db2.gz	BGVVIPQGYSXQRK-PNESKVBLSA-N	0	3	342.817	3.305	20	30		EGEDHN
C=C(Cl)CNCC1CC(NC(=O)c2sc(C(C)C)nc2C)C1	ZINC001755220637	1440784585	/nfs/dbraw/zinc/78/45/85/1440784585.db2.gz	UKFIDQAMQAMGFW-UHFFFAOYSA-N	0	3	341.908	3.425	20	30		EGEDHN
Cc1cscc1C(=O)N[C@H](C)[C@H](C)NCC#Cc1ccccc1	ZINC001755229602	1440786733	/nfs/dbraw/zinc/78/67/33/1440786733.db2.gz	DNDGEBGFJABEAB-JKSUJKDBSA-N	0	3	326.465	3.205	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](C)[C@H](C)NCC#Cc2ccccc2)ccc1F	ZINC001755250193	1440791697	/nfs/dbraw/zinc/79/16/97/1440791697.db2.gz	QMOHBHUXNLEPKJ-DLBZAZTESA-N	0	3	338.426	3.282	20	30		EGEDHN
C[C@H](NCC#Cc1ccccc1)[C@H](C)NC(=O)c1cccc2cc[nH]c21	ZINC001755258782	1440793969	/nfs/dbraw/zinc/79/39/69/1440793969.db2.gz	VSYNKUZCKRDPOI-IRXDYDNUSA-N	0	3	345.446	3.316	20	30		EGEDHN
CN(CC(C)(C)CNCc1ccccc1C#N)C(=O)CC(C)(F)F	ZINC001755286185	1440802063	/nfs/dbraw/zinc/80/20/63/1440802063.db2.gz	RRQGLKAFBBFVLX-UHFFFAOYSA-N	0	3	337.414	3.178	20	30		EGEDHN
C[C@H](CNC(=O)C1(C)CCCC1)N(C)Cc1ccc(OCC#N)cc1	ZINC001755309592	1440812945	/nfs/dbraw/zinc/81/29/45/1440812945.db2.gz	DYNPCWGZLIKIPI-MRXNPFEDSA-N	0	3	343.471	3.106	20	30		EGEDHN
C[C@H](CNC(=O)C1CC2(CCC2)C1)N(C)Cc1ccc(C#N)cc1	ZINC001755312740	1440814008	/nfs/dbraw/zinc/81/40/08/1440814008.db2.gz	INCCVQUFTNSLQF-OAHLLOKOSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H]1C(=O)NC[C@@H](C)N(C)Cc1cccc(C#N)c1	ZINC001755316263	1440815799	/nfs/dbraw/zinc/81/57/99/1440815799.db2.gz	GUZDGTYLTMBJSU-ATZDWAIDSA-N	0	3	327.472	3.177	20	30		EGEDHN
C=CCOCCN(C)[C@@H](C)CNC(=O)c1ccc(Cl)cc1Cl	ZINC001755322970	1440819922	/nfs/dbraw/zinc/81/99/22/1440819922.db2.gz	OGIKNCAGAAQCFM-LBPRGKRZSA-N	0	3	345.270	3.246	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)C[C@H]2CCCCO2)CCCCC1	ZINC001755350434	1440827729	/nfs/dbraw/zinc/82/77/29/1440827729.db2.gz	RROSPNKZQWSEDO-OAHLLOKOSA-N	0	3	328.884	3.107	20	30		EGEDHN
CCCC[C@@H](CNCC#Cc1ccc(F)cc1)NC(=O)c1ccc[nH]1	ZINC001755356167	1440829583	/nfs/dbraw/zinc/82/95/83/1440829583.db2.gz	GVEWDUHXOHIZAW-SFHVURJKSA-N	0	3	341.430	3.084	20	30		EGEDHN
CCCC[C@H](CNCC#CCOC)NC(=O)C1(C)CCCCCC1	ZINC001755358239	1440830661	/nfs/dbraw/zinc/83/06/61/1440830661.db2.gz	MCOXJMWWNVSVLP-GOSISDBHSA-N	0	3	336.520	3.261	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3[C@@H](CNC(=O)C[C@@H]4CC=CCC4)[C@@H]3C2)c1	ZINC001755427818	1440850698	/nfs/dbraw/zinc/85/06/98/1440850698.db2.gz	KQPAGAJXVXHXGD-OTNPHJDUSA-N	0	3	349.478	3.099	20	30		EGEDHN
C=C(Cl)CNC[C@H]1C[C@H](NC(=O)c2ccc3nc(C)ccc3c2)C1	ZINC001755480357	1440860023	/nfs/dbraw/zinc/86/00/23/1440860023.db2.gz	SULOSVZBWXQBQP-CZIWCDLHSA-N	0	3	343.858	3.394	20	30		EGEDHN
C=C(Cl)CNC[C@H]1C[C@H](NC(=O)c2cc(C)n(CC3CC3)c2C)C1	ZINC001755481440	1440860307	/nfs/dbraw/zinc/86/03/07/1440860307.db2.gz	KJECWRFWQRNWLG-QAQDUYKDSA-N	0	3	349.906	3.365	20	30		EGEDHN
Cc1occc1C(=O)N[C@@H](C)CCCNCc1ccccc1C#N	ZINC001755486625	1440860798	/nfs/dbraw/zinc/86/07/98/1440860798.db2.gz	QGSCXBSDWJQULB-AWEZNQCLSA-N	0	3	325.412	3.148	20	30		EGEDHN
C[C@@H](CCCNCc1cc(C#N)ccc1F)NC(=O)[C@H]1CC12CCC2	ZINC001755518951	1440864649	/nfs/dbraw/zinc/86/46/49/1440864649.db2.gz	XRFJAQGMYLHDHJ-WMLDXEAASA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CCC(N(C)C/C=C/Cl)CC1)OCC	ZINC001755530290	1440867053	/nfs/dbraw/zinc/86/70/53/1440867053.db2.gz	ZGYKMDDLXNENHF-FSNWXROXSA-N	0	3	328.884	3.033	20	30		EGEDHN
CN(C(=O)CC1CC1)[C@H](CNCC#Cc1ccccc1Cl)C1CC1	ZINC001755554856	1440873032	/nfs/dbraw/zinc/87/30/32/1440873032.db2.gz	LJOTXZZHVXCPRN-LJQANCHMSA-N	0	3	344.886	3.318	20	30		EGEDHN
CCC1(C(=O)N(C)[C@H](CNCC#Cc2ccc(F)cc2)C2CC2)CC1	ZINC001755566435	1440875888	/nfs/dbraw/zinc/87/58/88/1440875888.db2.gz	UDJRIQYCSSQUQO-LJQANCHMSA-N	0	3	342.458	3.194	20	30		EGEDHN
CC/C(C)=C\C(=O)N(C)[C@H](CNCc1cc(C#N)ccc1F)C1CC1	ZINC001755571635	1440877004	/nfs/dbraw/zinc/87/70/04/1440877004.db2.gz	PRXGVZNDKHRBML-BZPDREMPSA-N	0	3	343.446	3.380	20	30		EGEDHN
C[C@@H](CN(C)C(=O)[C@H]1[C@@H]2CCCC[C@@H]21)NCc1ccc(C#N)c(F)c1	ZINC001755584399	1440880200	/nfs/dbraw/zinc/88/02/00/1440880200.db2.gz	XEZQDNLHKIMVLF-CKNFYHOISA-N	0	3	343.446	3.070	20	30		EGEDHN
C=CC1(CC(=O)N(C)C[C@H](C)NCc2cnc(C)nc2)CCCCC1	ZINC001755609215	1440886652	/nfs/dbraw/zinc/88/66/52/1440886652.db2.gz	SHWDBTBNAIMFCS-INIZCTEOSA-N	0	3	344.503	3.248	20	30		EGEDHN
C[C@@H](CN(C)C(=O)[C@@H]1C[C@H]1c1ccccc1)NCC#Cc1ccccc1	ZINC001755614966	1440888481	/nfs/dbraw/zinc/88/84/81/1440888481.db2.gz	RWWAGQSMGDDRIP-YUXAGFNASA-N	0	3	346.474	3.278	20	30		EGEDHN
C#CCC1(C(=O)N(C)C[C@H](C)NCc2cnc(C)s2)CCCCC1	ZINC001755619435	1440890126	/nfs/dbraw/zinc/89/01/26/1440890126.db2.gz	WLOUJQKORFSPDV-HNNXBMFYSA-N	0	3	347.528	3.362	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](NCc2cc(Cl)ccc2OC)[C@H]1C	ZINC001755651550	1440891440	/nfs/dbraw/zinc/89/14/40/1440891440.db2.gz	GWIOEXDDEYGZDE-CJNGLKHVSA-N	0	3	336.863	3.394	20	30		EGEDHN
CC#CCN[C@@H]1C[C@@H](C)N(C(=O)c2cc3c(s2)CCCCC3)C1	ZINC001755688391	1440896279	/nfs/dbraw/zinc/89/62/79/1440896279.db2.gz	IIQALJGKGDMCLS-GDBMZVCRSA-N	0	3	330.497	3.233	20	30		EGEDHN
C#CCN1CC[C@]2(NC(=O)CC(C3CCC3)C3CCC3)CCC[C@@H]12	ZINC001755700816	1440900006	/nfs/dbraw/zinc/90/00/06/1440900006.db2.gz	LACZUMPKMCECLM-TZIWHRDSSA-N	0	3	328.500	3.339	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@]3(NC(=O)CCC(F)F)CCC[C@H]23)cc1	ZINC001755700909	1440900053	/nfs/dbraw/zinc/90/00/53/1440900053.db2.gz	HNMRIDVMYOLOGR-QFBILLFUSA-N	0	3	347.409	3.217	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@]12CCC[C@@H]1N(Cc1cccnc1)CC2	ZINC001755703508	1440901382	/nfs/dbraw/zinc/90/13/82/1440901382.db2.gz	YIKRDPQFJOZSNI-PXNSSMCTSA-N	0	3	327.472	3.297	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H]2CCC[C@@H](NCc3nc(C)sc3C)[C@H]2C1	ZINC001755708393	1440903130	/nfs/dbraw/zinc/90/31/30/1440903130.db2.gz	BNNFJLBFQXFSTJ-YESZJQIVSA-N	0	3	347.528	3.443	20	30		EGEDHN
C=CCN1CCC[C@H](NC(=O)CCCOc2cccc(C)c2)[C@H]1C	ZINC001755720645	1440907249	/nfs/dbraw/zinc/90/72/49/1440907249.db2.gz	IOMOZRSDCUPUDO-MJGOQNOKSA-N	0	3	330.472	3.309	20	30		EGEDHN
CC1(C(=O)N2C[C@H](NCC#Cc3cccc(Cl)c3)C(C)(C)C2)CC1	ZINC001755759103	1440914640	/nfs/dbraw/zinc/91/46/40/1440914640.db2.gz	LADBANQOLCHCRI-KRWDZBQOSA-N	0	3	344.886	3.318	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H](NCc2ccnc(OC)c2)C(C)(C)C1	ZINC001755763716	1440915598	/nfs/dbraw/zinc/91/55/98/1440915598.db2.gz	ITVCVGRGFACRCR-MRXNPFEDSA-N	0	3	345.487	3.019	20	30		EGEDHN
CC1(C)CN(C(=O)CC#Cc2ccccc2)C[C@@H]1NC/C=C\Cl	ZINC001755767606	1440916587	/nfs/dbraw/zinc/91/65/87/1440916587.db2.gz	ZRAPDXWYLVZJPX-PJCWUCBCSA-N	0	3	330.859	3.007	20	30		EGEDHN
C#Cc1ccc(C(=O)N(CCN(C)Cc2ccccc2)C(C)C)nc1	ZINC001755817414	1440924435	/nfs/dbraw/zinc/92/44/35/1440924435.db2.gz	LCYVFJNNBBMFII-UHFFFAOYSA-N	0	3	335.451	3.046	20	30		EGEDHN
CC(C)(C)[C@@H](CNCC#Cc1ccccc1)NC(=O)[C@]12C[C@H]1CCC2	ZINC001755828701	1440927948	/nfs/dbraw/zinc/92/79/48/1440927948.db2.gz	NUIKMRAYZXJBNI-WOIUINJBSA-N	0	3	338.495	3.349	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@H](CNCc1cnc(C)nc1)C(C)(C)C	ZINC001755831261	1440928656	/nfs/dbraw/zinc/92/86/56/1440928656.db2.gz	WIDPBKUJSVVGCF-DOTOQJQBSA-N	0	3	332.492	3.008	20	30		EGEDHN
C#CCCCC(=O)N[C@@H](C)C1CCN(Cc2c(C)onc2CC)CC1	ZINC001755846685	1440933564	/nfs/dbraw/zinc/93/35/64/1440933564.db2.gz	KAWYGDUJVYGPKG-HNNXBMFYSA-N	0	3	345.487	3.066	20	30		EGEDHN
C#CCCCC(=O)NCC1=CCN(Cc2ccc(CF)cc2)CC1	ZINC001755884665	1440940220	/nfs/dbraw/zinc/94/02/20/1440940220.db2.gz	CXWKFZLFWAHDQK-UHFFFAOYSA-N	0	3	328.431	3.208	20	30		EGEDHN
C=CCN1CC=C(CNC(=O)[C@@H](OC(C)C)c2ccccc2)CC1	ZINC001755900684	1440943868	/nfs/dbraw/zinc/94/38/68/1440943868.db2.gz	OZTFMWALQXJCAL-IBGZPJMESA-N	0	3	328.456	3.087	20	30		EGEDHN
N#Cc1c(CN2CCC[C@H](c3nc(C4CC4)n[nH]3)C2)cn2ccccc12	ZINC000179517726	233128489	/nfs/dbraw/zinc/12/84/89/233128489.db2.gz	SFMGVDUFGDXUGE-HNNXBMFYSA-N	0	3	346.438	3.186	20	30		EGEDHN
N#Cc1c(CN2CCC[C@H](c3n[nH]c(C4CC4)n3)C2)cn2ccccc12	ZINC000179517726	233128492	/nfs/dbraw/zinc/12/84/92/233128492.db2.gz	SFMGVDUFGDXUGE-HNNXBMFYSA-N	0	3	346.438	3.186	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)Nc1ccc(OCCN(C)C)c(Cl)c1	ZINC000078765509	217115512	/nfs/dbraw/zinc/11/55/12/217115512.db2.gz	GUCMMOVXOYZELY-ZDUSSCGKSA-N	0	3	340.851	3.200	20	30		EGEDHN
Cc1cc(F)cc(C(=O)N(CCN(C)C)Cc2cccc(C#N)c2)c1	ZINC000079790208	217254279	/nfs/dbraw/zinc/25/42/79/217254279.db2.gz	PIJSLKSGQMABOY-UHFFFAOYSA-N	0	3	339.414	3.210	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H]2CCOc3c(CC)cccc32)CC1	ZINC000264346249	246382434	/nfs/dbraw/zinc/38/24/34/246382434.db2.gz	KCYWXWWXPAZFEY-SFHVURJKSA-N	0	3	343.471	3.022	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)o1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000266195118	248164766	/nfs/dbraw/zinc/16/47/66/248164766.db2.gz	JMCINUNKDZCRJL-UONOGXRCSA-N	0	3	333.432	3.276	20	30		EGEDHN
CC[C@@H](NCc1ccc(OC)c(C#N)c1)[C@@H](O)c1c(F)cccc1F	ZINC000266307997	248238735	/nfs/dbraw/zinc/23/87/35/248238735.db2.gz	OSXAQIAMYHLCRJ-VQIMIIECSA-N	0	3	346.377	3.447	20	30		EGEDHN
CSc1ccc(C(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)o1	ZINC000112236029	220271326	/nfs/dbraw/zinc/27/13/26/220271326.db2.gz	FQUCDYPMQJBCGE-UHFFFAOYSA-N	0	3	343.452	3.077	20	30		EGEDHN
COC1CCN(CCNc2c(C#N)cnc3c(C)cc(C)cc32)CC1	ZINC000301540347	269722774	/nfs/dbraw/zinc/72/27/74/269722774.db2.gz	NDTNDMBWJQQFKK-UHFFFAOYSA-N	0	3	338.455	3.246	20	30		EGEDHN
CN(C[C@@H](O)c1ccc(C#N)cc1)[C@H]1CCCN(c2ccccc2)C1	ZINC000268703591	252154380	/nfs/dbraw/zinc/15/43/80/252154380.db2.gz	RUDLJXFATAQPJP-LEWJYISDSA-N	0	3	335.451	3.192	20	30		EGEDHN
C[C@@H](c1ccc(C#N)cc1)N1CCC[C@H](CNC(=O)C(C)(C)C)C1	ZINC000118399698	221145989	/nfs/dbraw/zinc/14/59/89/221145989.db2.gz	KBDUUTMITXDJPN-DOTOQJQBSA-N	0	3	327.472	3.494	20	30		EGEDHN
C[C@@H]1[C@H](C)SCCN1CCC(=O)Nc1sc2c(c1C#N)CCC2	ZINC000118415275	221147599	/nfs/dbraw/zinc/14/75/99/221147599.db2.gz	LCJUWFRQCKDOQT-NEPJUHHUSA-N	0	3	349.525	3.263	20	30		EGEDHN
C[C@@H](N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)c1cccc(C#N)c1	ZINC000181638562	533513121	/nfs/dbraw/zinc/51/31/21/533513121.db2.gz	OVKMYJWLIKYJPL-UTKZUKDTSA-N	0	3	347.462	3.443	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1	ZINC000338137849	141100872	/nfs/dbraw/zinc/10/08/72/141100872.db2.gz	UCISUJMXYVQXDR-DNVCBOLYSA-N	0	3	333.435	3.260	20	30		EGEDHN
CC[C@H](CC(F)(F)F)N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000354574544	141308327	/nfs/dbraw/zinc/30/83/27/141308327.db2.gz	XZUVZNARZXBFDO-HIFRSBDPSA-N	0	3	339.361	3.374	20	30		EGEDHN
C[C@H](NC(=O)c1ncc(C#N)cc1Cl)[C@@H](c1ccccc1)N(C)C	ZINC000356236014	141325301	/nfs/dbraw/zinc/32/53/01/141325301.db2.gz	UWFHRNXANAHXQU-SJCJKPOMSA-N	0	3	342.830	3.028	20	30		EGEDHN
CC(C)[C@@]1(C)C[C@H]1C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000185607692	144116214	/nfs/dbraw/zinc/11/62/14/144116214.db2.gz	KCGTXYXQFWAGPX-AZUAARDMSA-N	0	3	327.472	3.131	20	30		EGEDHN
N#Cc1ccc(CC(=O)N2C[C@H]3CCCN3Cc3ccccc32)cc1	ZINC000194746143	153355194	/nfs/dbraw/zinc/35/51/94/153355194.db2.gz	RNOULFIRUGBXCQ-LJQANCHMSA-N	0	3	331.419	3.112	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)Cc1ccc(F)c(F)c1	ZINC000349036204	156327939	/nfs/dbraw/zinc/32/79/39/156327939.db2.gz	NRWYVYAPBLZTEJ-UHFFFAOYSA-N	0	3	329.394	3.400	20	30		EGEDHN
Cc1ccc(F)cc1C(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000078675762	161778371	/nfs/dbraw/zinc/77/83/71/161778371.db2.gz	DAXXZEDWFGWBCR-UHFFFAOYSA-N	0	3	339.414	3.210	20	30		EGEDHN
C[C@@]1(O)CCCN(Cc2cccc(OCc3ccccc3C#N)c2)C1	ZINC000129562454	162360499	/nfs/dbraw/zinc/36/04/99/162360499.db2.gz	SVEPCARLGMNXMG-OAQYLSRUSA-N	0	3	336.435	3.484	20	30		EGEDHN
C[C@@H](NCCNC(=O)c1ccc(Cl)cc1)c1ccc(C#N)cc1	ZINC000344026709	164085353	/nfs/dbraw/zinc/08/53/53/164085353.db2.gz	UUYXANKNCITRSS-CYBMUJFWSA-N	0	3	327.815	3.292	20	30		EGEDHN
CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)c1cccc(C#N)c1	ZINC000346114561	164339809	/nfs/dbraw/zinc/33/98/09/164339809.db2.gz	BUHUOECMTWUULN-HXUWFJFHSA-N	0	3	335.451	3.445	20	30		EGEDHN
C[C@H](CN(C)C)NC(=O)c1ccc(Oc2cccc(F)c2C#N)cc1	ZINC000346128353	164344425	/nfs/dbraw/zinc/34/44/25/164344425.db2.gz	DIJFMCKRXNXUAW-CYBMUJFWSA-N	0	3	341.386	3.170	20	30		EGEDHN
CC[C@H]1CCCCN1CCNC(=O)N[C@H](C)c1ccc(C#N)cc1	ZINC000354865994	166050867	/nfs/dbraw/zinc/05/08/67/166050867.db2.gz	YTWWOEMXNQWEAA-QAPCUYQASA-N	0	3	328.460	3.183	20	30		EGEDHN
C[C@H](CN1CCCCCC1)NC(=O)C1(c2cc(F)cc(C#N)c2)CC1	ZINC000354875954	166053413	/nfs/dbraw/zinc/05/34/13/166053413.db2.gz	JLUAHVXFHKGFPC-OAHLLOKOSA-N	0	3	343.446	3.110	20	30		EGEDHN
COC(=O)c1cc(CN(Cc2ccc(C#N)cc2)CC(C)C)c[nH]1	ZINC000350661500	165063085	/nfs/dbraw/zinc/06/30/85/165063085.db2.gz	QOOMNGWHGILAPB-UHFFFAOYSA-N	0	3	325.412	3.331	20	30		EGEDHN
CC[C@H](C)N[C@H](CNC(=O)c1cccc(F)c1C#N)c1ccco1	ZINC000359528874	167180318	/nfs/dbraw/zinc/18/03/18/167180318.db2.gz	BHVHNJJIPAZSFY-BLLLJJGKSA-N	0	3	329.375	3.150	20	30		EGEDHN
C[C@@H](NCC(=O)N(C)C1CC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000360683399	167386709	/nfs/dbraw/zinc/38/67/09/167386709.db2.gz	ZGMXRSUUNFTFCE-OAHLLOKOSA-N	0	3	333.435	3.497	20	30		EGEDHN
C[C@H](NCC(=O)N(C)C1CC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000360683398	167387056	/nfs/dbraw/zinc/38/70/56/167387056.db2.gz	ZGMXRSUUNFTFCE-HNNXBMFYSA-N	0	3	333.435	3.497	20	30		EGEDHN
C[C@H](N[C@@H]1CCO[C@@H](c2cncn2C)C1)c1ccc(C#N)cc1F	ZINC000332429643	270045266	/nfs/dbraw/zinc/04/52/66/270045266.db2.gz	PTJVNLVFEIXGCV-WPKBUWHJSA-N	0	3	328.391	3.002	20	30		EGEDHN
C#CCCOc1ccc(CN2CC[C@@H](Oc3ccc(C#N)cn3)C2)cc1	ZINC000366544097	270045846	/nfs/dbraw/zinc/04/58/46/270045846.db2.gz	KUSOQGFHIWCGJV-HXUWFJFHSA-N	0	3	347.418	3.009	20	30		EGEDHN
CCc1ccc([C@H](CNc2nccc(C#N)c2Cl)N(C)C)cc1	ZINC000429215442	270050281	/nfs/dbraw/zinc/05/02/81/270050281.db2.gz	POZDTMDBRFYNBO-INIZCTEOSA-N	0	3	328.847	3.306	20	30		EGEDHN
N#Cc1ccccc1OCCN(CCc1ccccc1)[C@H]1CCOC1	ZINC000437536521	270051511	/nfs/dbraw/zinc/05/15/11/270051511.db2.gz	MUZCGZLFJCHDMI-FQEVSTJZSA-N	0	3	336.435	3.271	20	30		EGEDHN
CCN(CC)[C@@H](CNc1cc(N)c([N+](=O)[O-])c(C#N)c1)c1ccco1	ZINC000288603391	266119822	/nfs/dbraw/zinc/11/98/22/266119822.db2.gz	WNDYLXCNYQSZSE-HNNXBMFYSA-N	0	3	343.387	3.137	20	30		EGEDHN
CC[C@H]([NH2+][C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O)c1ccccc1[O-]	ZINC000190602144	266411136	/nfs/dbraw/zinc/41/11/36/266411136.db2.gz	SQJPRLLBCWNBSK-RBUKOAKNSA-N	0	3	349.434	3.106	20	30		EGEDHN
CC(C)CN(Cc1ccc(C#N)cc1)C(=O)NC[C@H](C)N(C)C1CC1	ZINC000520611721	266901512	/nfs/dbraw/zinc/90/15/12/266901512.db2.gz	VECUBVFFXKBUSX-INIZCTEOSA-N	0	3	342.487	3.209	20	30		EGEDHN
C[C@@H](NC(=O)NCc1ccc(C#N)cc1)[C@@H](c1ccccc1)N(C)C	ZINC000287294036	266953806	/nfs/dbraw/zinc/95/38/06/266953806.db2.gz	ZUJOHVPZDGSWLZ-BEFAXECRSA-N	0	3	336.439	3.049	20	30		EGEDHN
C[C@@H]1CCC[C@H]1CC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000185896301	267018552	/nfs/dbraw/zinc/01/85/52/267018552.db2.gz	OSSDDXKVAGNZHO-APWZRJJASA-N	0	3	327.472	3.275	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@H]1Nc1cc(C#N)ccc1[N+](=O)[O-]	ZINC000302211479	267055295	/nfs/dbraw/zinc/05/52/95/267055295.db2.gz	MNEAFKTXKBUQPV-RDTXWAMCSA-N	0	3	336.395	3.399	20	30		EGEDHN
CCOC(=O)N1CCC[C@@H]([C@H](C)NCc2ccc(C#N)cc2F)C1	ZINC000495544243	267124030	/nfs/dbraw/zinc/12/40/30/267124030.db2.gz	VHBBEHLJMKKHDS-XJKSGUPXSA-N	0	3	333.407	3.044	20	30		EGEDHN
C[C@H](O)[C@H]1CCN(Cc2cccc(OCc3cccc(C#N)c3)c2)C1	ZINC000272470339	267194012	/nfs/dbraw/zinc/19/40/12/267194012.db2.gz	AEUBJMVHIULWLC-JXFKEZNVSA-N	0	3	336.435	3.340	20	30		EGEDHN
CC[C@H](CNC(=O)C(C#N)Cc1ccc(C#N)cc1)CC(F)(F)F	ZINC000412656289	267212422	/nfs/dbraw/zinc/21/24/22/267212422.db2.gz	MMPDZLSQRQZZLU-WFASDCNBSA-N	0	3	337.345	3.335	20	30		EGEDHN
CC[C@H](CNC(=O)c1cccc(C#N)c1C)N1CCc2ccccc2C1	ZINC000510465921	267212586	/nfs/dbraw/zinc/21/25/86/267212586.db2.gz	SZFQMUQJUQJEMZ-HXUWFJFHSA-N	0	3	347.462	3.433	20	30		EGEDHN
CC[C@H](NCCNC(=O)c1ccc(C)c(F)c1)c1ccc(C#N)cc1	ZINC000447528721	267220837	/nfs/dbraw/zinc/22/08/37/267220837.db2.gz	JXLWIDKGBXSJAK-IBGZPJMESA-N	0	3	339.414	3.477	20	30		EGEDHN
CN(C)CCOc1ccc(CCNc2cccc(F)c2C#N)cc1	ZINC000511385978	267281520	/nfs/dbraw/zinc/28/15/20/267281520.db2.gz	UDKOPRJTQAWZQG-UHFFFAOYSA-N	0	3	327.403	3.292	20	30		EGEDHN
Cc1cc([C@@H](C)NC[C@@H](O)COc2ccc(C#N)cc2)ccc1F	ZINC000271825025	267362818	/nfs/dbraw/zinc/36/28/18/267362818.db2.gz	VJYNUYQMITXOBV-RHSMWYFYSA-N	0	3	328.387	3.096	20	30		EGEDHN
COC(=O)[C@](C)(CNCc1ccc(C#N)c(F)c1)c1ccc(F)cc1	ZINC000421402696	267393497	/nfs/dbraw/zinc/39/34/97/267393497.db2.gz	WHMJPFJGJRBOFT-LJQANCHMSA-N	0	3	344.361	3.057	20	30		EGEDHN
COC(=O)[C@]1(c2ccccc2)CCN(Cc2ccc(C#N)cc2F)C1	ZINC000428782810	267395945	/nfs/dbraw/zinc/39/59/45/267395945.db2.gz	LXEVLHACEJBMLQ-HXUWFJFHSA-N	0	3	338.382	3.014	20	30		EGEDHN
C[C@@H](C(=O)N[C@H]1CCCc2cc(C#N)ccc21)N1CCCCCC1	ZINC000520766502	267680950	/nfs/dbraw/zinc/68/09/50/267680950.db2.gz	DAUVESNLTJXVNK-KXBFYZLASA-N	0	3	325.456	3.316	20	30		EGEDHN
N#Cc1ccc(CC(=O)N[C@H](CN2CCCC2)c2ccccc2)cc1	ZINC000194728602	268058948	/nfs/dbraw/zinc/05/89/48/268058948.db2.gz	WKQFKJAKYUJTKX-HXUWFJFHSA-N	0	3	333.435	3.054	20	30		EGEDHN
N#Cc1ccc(CN2CCC(N[C@@H](C3CC3)C(F)(F)F)CC2)cc1	ZINC000287369578	268065226	/nfs/dbraw/zinc/06/52/26/268065226.db2.gz	OQAUYLNXMMJXTI-KRWDZBQOSA-N	0	3	337.389	3.453	20	30		EGEDHN
N#Cc1ccc(CN2CCC(N[C@H](C3CC3)C(F)(F)F)CC2)cc1	ZINC000287369581	268065613	/nfs/dbraw/zinc/06/56/13/268065613.db2.gz	OQAUYLNXMMJXTI-QGZVFWFLSA-N	0	3	337.389	3.453	20	30		EGEDHN
N#Cc1ccc(CNCCCC(=O)N2CCc3ccccc32)c(F)c1	ZINC000269420853	268072752	/nfs/dbraw/zinc/07/27/52/268072752.db2.gz	LWVYSEFMRGXUPJ-UHFFFAOYSA-N	0	3	337.398	3.156	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCc2ccc(Cl)s2)cc1	ZINC000348084941	268084918	/nfs/dbraw/zinc/08/49/18/268084918.db2.gz	YXTMOQMQINGHFX-ZDUSSCGKSA-N	0	3	329.812	3.272	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NC2CC(c3ccccc3)C2)cc1	ZINC000280940335	268089491	/nfs/dbraw/zinc/08/94/91/268089491.db2.gz	PRXDDRKAWNQGDS-IOJLRTSASA-N	0	3	329.403	3.303	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NC[C@H]2CCc3ccccc32)cc1	ZINC000348229059	268090621	/nfs/dbraw/zinc/09/06/21/268090621.db2.gz	LMBXNFSUODCTFR-RTBURBONSA-N	0	3	329.403	3.087	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCc2cccc3cc[nH]c32)cc1	ZINC000352043617	268091445	/nfs/dbraw/zinc/09/14/45/268091445.db2.gz	ABZBRMBSTJURTA-GOSISDBHSA-N	0	3	328.375	3.038	20	30		EGEDHN
N#Cc1c(Cl)cccc1NC[C@H]1C[C@H](O)CN1Cc1ccccc1	ZINC000450403945	268158645	/nfs/dbraw/zinc/15/86/45/268158645.db2.gz	DRIIVIAFLWFKFC-CVEARBPZSA-N	0	3	341.842	3.259	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CC[N@@H+](Cc3c([O-])ccc4ccccc43)C2)nc1	ZINC000366282053	268181530	/nfs/dbraw/zinc/18/15/30/268181530.db2.gz	FEBDQIMGIKILPO-QGZVFWFLSA-N	0	3	345.402	3.465	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CC[N@H+](Cc3c([O-])ccc4ccccc43)C2)nc1	ZINC000366282053	268181531	/nfs/dbraw/zinc/18/15/31/268181531.db2.gz	FEBDQIMGIKILPO-QGZVFWFLSA-N	0	3	345.402	3.465	20	30		EGEDHN
N#Cc1ccc(CN2CCN(C[C@@H]3C[C@H]3c3ccccc3)CC2)cc1	ZINC000463074167	268221259	/nfs/dbraw/zinc/22/12/59/268221259.db2.gz	PZHDEOGZPATHBU-VXKWHMMOSA-N	0	3	331.463	3.480	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)c(OC(F)F)c1	ZINC000451692701	268222681	/nfs/dbraw/zinc/22/26/81/268222681.db2.gz	GELSLJXBWHGGLX-YCPHGPKFSA-N	0	3	336.382	3.143	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)NCc1ccc(C#N)s1)C(C)C	ZINC000420892868	269559186	/nfs/dbraw/zinc/55/91/86/269559186.db2.gz	UVUMTZRTKDUMSW-KRWDZBQOSA-N	0	3	346.500	3.118	20	30		EGEDHN
CCC1(CC)[C@H](N[C@H](C)C(=O)Nc2ccccc2C#N)C[C@H]1OC	ZINC000248060341	273602525	/nfs/dbraw/zinc/60/25/25/273602525.db2.gz	YGECSTIFTRQMNG-KBRIMQKVSA-N	0	3	329.444	3.069	20	30		EGEDHN
C[C@H]1CCC[C@H](NC(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)C1	ZINC000047034928	275140213	/nfs/dbraw/zinc/14/02/13/275140213.db2.gz	PTXNHNNQAOSEMO-LPHOPBHVSA-N	0	3	342.487	3.210	20	30		EGEDHN
CCN(C(=O)c1cc(C#N)c[nH]1)[C@H]1CCN([C@H](C)c2ccccc2)C1	ZINC000368537013	276064535	/nfs/dbraw/zinc/06/45/35/276064535.db2.gz	CSERRSTYGJWPDX-QAPCUYQASA-N	0	3	336.439	3.184	20	30		EGEDHN
COc1ccc(CN[C@H](C)C[C@@H](O)c2ccc(F)cc2)cc1C#N	ZINC000130732034	533694530	/nfs/dbraw/zinc/69/45/30/533694530.db2.gz	WITQOYQUWPAGMC-FZKQIMNGSA-N	0	3	328.387	3.308	20	30		EGEDHN
Cc1ccccc1[C@@H](NCC(=O)NCc1cccc(C#N)c1)C1CC1	ZINC000537289503	314172440	/nfs/dbraw/zinc/17/24/40/314172440.db2.gz	FIGPTAOFIWCCOW-NRFANRHFSA-N	0	3	333.435	3.224	20	30		EGEDHN
N#Cc1cnn2cc(CNCCc3cccc(Cl)c3Cl)cnc12	ZINC000550105472	315116692	/nfs/dbraw/zinc/11/66/92/315116692.db2.gz	IHEDTCARRDUKRT-UHFFFAOYSA-N	0	3	346.221	3.240	20	30		EGEDHN
CN(C)C[C@@H](CNC(=O)c1sccc1C#N)c1ccc(Cl)cc1	ZINC000552027715	315190390	/nfs/dbraw/zinc/19/03/90/315190390.db2.gz	XIKPTIBAIHRGOW-CQSZACIVSA-N	0	3	347.871	3.348	20	30		EGEDHN
C[C@H](OC[C@@H](O)CNCc1ccc(C#N)cc1)c1ccc(Cl)cc1	ZINC000564845086	316216833	/nfs/dbraw/zinc/21/68/33/316216833.db2.gz	PTPOYPGYKPFINW-LIRRHRJNSA-N	0	3	344.842	3.440	20	30		EGEDHN
C[C@@H]1C[C@H](C(C)(C)C)CCN1CC(=O)NCc1cccc(C#N)c1	ZINC000565125637	316271057	/nfs/dbraw/zinc/27/10/57/316271057.db2.gz	QYQSWURVBVZRLG-CRAIPNDOSA-N	0	3	327.472	3.321	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2NC[C@H](O)COc1ccccc1F	ZINC000569232093	316885736	/nfs/dbraw/zinc/88/57/36/316885736.db2.gz	ITVPCUXWICPZOW-QFBILLFUSA-N	0	3	340.398	3.104	20	30		EGEDHN
CC(C)n1cc([C@@H](C)NCCC(=O)Nc2ccccc2C#N)cn1	ZINC000572819882	317395418	/nfs/dbraw/zinc/39/54/18/317395418.db2.gz	GUROYHQKLFWZOJ-CQSZACIVSA-N	0	3	325.416	3.015	20	30		EGEDHN
C[C@H](N[C@H]1CCC[C@@H](S(C)(=O)=O)C1)c1ccc(C#N)cc1Cl	ZINC000578588192	324988916	/nfs/dbraw/zinc/98/89/16/324988916.db2.gz	WQKFOCPZYMJHEV-FPMFFAJLSA-N	0	3	340.876	3.218	20	30		EGEDHN
CC(C)[C@@H]1CCC[C@@H](NCCS(=O)(=O)c2ccc(C#N)cc2)C1	ZINC000580947693	325312882	/nfs/dbraw/zinc/31/28/82/325312882.db2.gz	YMEIDZJFKMHKLC-IAGOWNOFSA-N	0	3	334.485	3.136	20	30		EGEDHN
C[C@H](N[C@@H]1CCN(CC(F)(F)F)C1)c1ccc(C#N)cc1Cl	ZINC000581921529	325398392	/nfs/dbraw/zinc/39/83/92/325398392.db2.gz	DXPNDMSJSIRCJQ-CMPLNLGQSA-N	0	3	331.769	3.499	20	30		EGEDHN
C[C@H](CCC#N)N(C)C[C@H](O)COc1ccc(C(F)(F)F)cc1	ZINC000411265736	457843883	/nfs/dbraw/zinc/84/38/83/457843883.db2.gz	PBLFNMTVYXWIPW-OCCSQVGLSA-N	0	3	330.350	3.069	20	30		EGEDHN
CC(C)Oc1ccc(NC(=O)NC2CCN(C3CC3)CC2)cc1C#N	ZINC000157753048	455228070	/nfs/dbraw/zinc/22/80/70/455228070.db2.gz	YCDYFRFZUAZEBT-UHFFFAOYSA-N	0	3	342.443	3.094	20	30		EGEDHN
C[C@H](CCC#N)N1CCC(OCCCNC(=O)OC(C)(C)C)CC1	ZINC000496559180	459238774	/nfs/dbraw/zinc/23/87/74/459238774.db2.gz	OKIJUWGLLLTYMX-OAHLLOKOSA-N	0	3	339.480	3.074	20	30		EGEDHN
Cc1ccccc1[C@@H](CC(C)C)NCC(=O)N[C@](C)(C#N)C1CC1	ZINC000183238800	455257939	/nfs/dbraw/zinc/25/79/39/455257939.db2.gz	QXPLUKAIJGGMJO-UYAOXDASSA-N	0	3	327.472	3.480	20	30		EGEDHN
C[C@@H](NCc1ccc(Cn2cncn2)cc1)c1ccc(OCC#N)cc1	ZINC000181444919	455335244	/nfs/dbraw/zinc/33/52/44/455335244.db2.gz	MYOVSVYEEYLUPO-MRXNPFEDSA-N	0	3	347.422	3.080	20	30		EGEDHN
CCSc1cccc(CNC[C@H](O)COc2ccccc2C#N)c1	ZINC000600739223	460585928	/nfs/dbraw/zinc/58/59/28/460585928.db2.gz	OPRBQUJYLUXUFD-KRWDZBQOSA-N	0	3	342.464	3.200	20	30		EGEDHN
C[C@H](NC(C)(C)CNC(=O)N1CCC[C@@](C)(C#N)C1)c1ccccc1	ZINC000612372302	460608794	/nfs/dbraw/zinc/60/87/94/460608794.db2.gz	OGPRVEYIWNWSEB-JXFKEZNVSA-N	0	3	342.487	3.451	20	30		EGEDHN
C#CCNC(=O)[C@@H](C)NC[C@@H](c1c[nH]c2ccccc21)c1ccccc1	ZINC000029569862	453829927	/nfs/dbraw/zinc/82/99/27/453829927.db2.gz	GNNIJHPVGYUVPW-VQIMIIECSA-N	0	3	345.446	3.027	20	30		EGEDHN
COc1ccc(C)cc1C1(CNC[C@H](C#N)CCC#N)CCOCC1	ZINC000066484196	453848444	/nfs/dbraw/zinc/84/84/44/453848444.db2.gz	SIXKHXBAQZNYQG-KRWDZBQOSA-N	0	3	341.455	3.085	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN(C)[C@H](C)c1ccncc1	ZINC000245755504	455374130	/nfs/dbraw/zinc/37/41/30/455374130.db2.gz	HNSXEVCHGVCSIH-VQIMIIECSA-N	0	3	326.440	3.243	20	30		EGEDHN
CCc1ccsc1C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000053055626	453855396	/nfs/dbraw/zinc/85/53/96/453855396.db2.gz	XJEMSZUTIJGZQA-UHFFFAOYSA-N	0	3	341.480	3.386	20	30		EGEDHN
N#Cc1cccc([C@@H]2C[C@H]2C(=O)N2CCCN(C3CCCC3)CC2)c1	ZINC000081795626	453909414	/nfs/dbraw/zinc/90/94/14/453909414.db2.gz	AURBKOVUSRHCTR-VQTJNVASSA-N	0	3	337.467	3.139	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN[C@@H](C)c1cccc(N2CCCC2)c1	ZINC000181868894	455391704	/nfs/dbraw/zinc/39/17/04/455391704.db2.gz	GOEBSSDDXPUDRL-KRWDZBQOSA-N	0	3	329.488	3.362	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000068216917	454008575	/nfs/dbraw/zinc/00/85/75/454008575.db2.gz	PCPQKRWWVQJADB-NVXWUHKLSA-N	0	3	331.435	3.046	20	30		EGEDHN
C#CCN1CCC(C(=O)NCc2ccc(C)cc2OC(C)(C)C)CC1	ZINC000084795041	454010522	/nfs/dbraw/zinc/01/05/22/454010522.db2.gz	PPQYBRHSEOIPKS-UHFFFAOYSA-N	0	3	342.483	3.134	20	30		EGEDHN
COc1cc(OC)cc(OCCCN(C)Cc2ccc(C#N)cc2)c1	ZINC000084865804	454013696	/nfs/dbraw/zinc/01/36/96/454013696.db2.gz	CUSMKIZHNNIVGG-UHFFFAOYSA-N	0	3	340.423	3.476	20	30		EGEDHN
C[C@@H](CC#N)N(C)C(=O)Nc1ccc(CCN2CCSCC2)cc1	ZINC000086284709	454046764	/nfs/dbraw/zinc/04/67/64/454046764.db2.gz	YLGKWUUTDOFHFZ-HNNXBMFYSA-N	0	3	346.500	3.044	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@@H](NCc3cccc(O)c3)C2)c(F)c1	ZINC000068991266	454071023	/nfs/dbraw/zinc/07/10/23/454071023.db2.gz	BNESWTZDDJZVHM-MRXNPFEDSA-N	0	3	325.387	3.162	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN1CCCN(C(C)C)CC1	ZINC000069082961	454077616	/nfs/dbraw/zinc/07/76/16/454077616.db2.gz	GCWDPDRGJJBMAW-UHFFFAOYSA-N	0	3	347.528	3.319	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc3nc(C4CC4)sc3c2)CC1	ZINC000069328747	454094802	/nfs/dbraw/zinc/09/48/02/454094802.db2.gz	GCFWJRUXYGMCTP-UHFFFAOYSA-N	0	3	339.464	3.457	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H]2CCSc3ccc(Cl)cc32)CC1	ZINC000057138724	454105010	/nfs/dbraw/zinc/10/50/10/454105010.db2.gz	VNYIQNBAIGIGMT-INIZCTEOSA-N	0	3	348.899	3.338	20	30		EGEDHN
N#Cc1ccc(CNC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cc1	ZINC000077789946	454156970	/nfs/dbraw/zinc/15/69/70/454156970.db2.gz	XOZOISWYGGYYRI-FQEVSTJZSA-N	0	3	348.450	3.195	20	30		EGEDHN
CCN1CCN(c2ccc(NC(=O)C3(C#N)CCCC3)c(C)c2)CC1	ZINC000070811526	454177911	/nfs/dbraw/zinc/17/79/11/454177911.db2.gz	BEKQNFSEZVQSEF-UHFFFAOYSA-N	0	3	340.471	3.159	20	30		EGEDHN
N#CCc1ccc(OC[C@@H](O)CN2CCC[C@@H]2c2ccsc2)cc1	ZINC000046089062	454217440	/nfs/dbraw/zinc/21/74/40/454217440.db2.gz	NJIYNNWZBCJOOY-PKOBYXMFSA-N	0	3	342.464	3.391	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2CCCOc3ccccc32)CC1	ZINC000071879845	454239185	/nfs/dbraw/zinc/23/91/85/454239185.db2.gz	GQGGFQUTDFZKHX-GOSISDBHSA-N	0	3	343.471	3.240	20	30		EGEDHN
CC[C@H](c1ccc(F)cc1F)N(C)CCCc1[nH]nc(N)c1C#N	ZINC000089943458	454242703	/nfs/dbraw/zinc/24/27/03/454242703.db2.gz	WDVALNRCDQQIHH-MRXNPFEDSA-N	0	3	333.386	3.157	20	30		EGEDHN
COc1ccc(CN(C[C@@H]2CCCO2)[C@@H]2CCSC2)cc1C#N	ZINC000089952691	454246186	/nfs/dbraw/zinc/24/61/86/454246186.db2.gz	RIIXKMGOBHHTLB-SJORKVTESA-N	0	3	332.469	3.053	20	30		EGEDHN
CCN(CC)C(=O)C[C@@H](C)NCC#Cc1ccc(C(F)(F)F)cc1	ZINC000090180552	454290833	/nfs/dbraw/zinc/29/08/33/454290833.db2.gz	OWRPEXVTYLFIOH-CQSZACIVSA-N	0	3	340.389	3.294	20	30		EGEDHN
C#CCOc1ccc([C@@H](C)N[C@@H](CCO)c2ccc(OC)cc2)cc1	ZINC000120374066	454292668	/nfs/dbraw/zinc/29/26/68/454292668.db2.gz	RXEFNTCIBYQJBJ-IERDGZPVSA-N	0	3	339.435	3.482	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CCCN1C(=O)C1(C#N)CCCC1	ZINC000131981881	454303391	/nfs/dbraw/zinc/30/33/91/454303391.db2.gz	VYLQUKXGSONZQO-KRWDZBQOSA-N	0	3	325.456	3.193	20	30		EGEDHN
N#CCCCOc1cccc(CNC[C@@]2(O)CCc3ccccc32)c1	ZINC000132117870	454315025	/nfs/dbraw/zinc/31/50/25/454315025.db2.gz	QPCUSWZDYGVVEL-NRFANRHFSA-N	0	3	336.435	3.293	20	30		EGEDHN
C[C@@H](NC(=O)NC[C@@H](c1ccccc1)N(C)C)c1ccc(C#N)cc1	ZINC000060954829	454321705	/nfs/dbraw/zinc/32/17/05/454321705.db2.gz	NNJDTDGHINLREO-BEFAXECRSA-N	0	3	336.439	3.221	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCOC3(C2)CCCCCC3)CC1	ZINC000132525344	454346349	/nfs/dbraw/zinc/34/63/49/454346349.db2.gz	FWQGTBXVJMYWDT-UHFFFAOYSA-N	0	3	349.519	3.162	20	30		EGEDHN
C=CCN(CCc1ccccc1)C[C@H](O)COc1ccccc1F	ZINC000062364267	454375327	/nfs/dbraw/zinc/37/53/27/454375327.db2.gz	RCWOXFZCHQLVBI-SFHVURJKSA-N	0	3	329.415	3.296	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/[C@@H]2CCN(c3ccccn3)C2)c([O-])c1	ZINC000133119328	454394305	/nfs/dbraw/zinc/39/43/05/454394305.db2.gz	NDZHYEVRVUAFLC-FEMWLQECSA-N	0	3	338.455	3.331	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cc(C)ccc2Br)CC1	ZINC000121138861	454397548	/nfs/dbraw/zinc/39/75/48/454397548.db2.gz	JWLNSCGKMHNFCJ-UHFFFAOYSA-N	0	3	335.245	3.041	20	30		EGEDHN
N#CC(C(=O)c1cccc(-n2cccn2)n1)c1ccc2ccccc2n1	ZINC000606145674	460636621	/nfs/dbraw/zinc/63/66/21/460636621.db2.gz	JALLEFMWBRLROR-OAHLLOKOSA-N	0	3	339.358	3.306	20	30		EGEDHN
C=CCCC[C@@H](C)N1CCC(NS(=O)(=O)c2ccccc2)CC1	ZINC000091596695	454448726	/nfs/dbraw/zinc/44/87/26/454448726.db2.gz	WUHBBPKPQCQDKB-MRXNPFEDSA-N	0	3	336.501	3.174	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN1CCC[C@@H]1c1cc(C)ccc1C	ZINC000133646088	454449685	/nfs/dbraw/zinc/44/96/85/454449685.db2.gz	ZLSILJBGTPZCPG-QFBILLFUSA-N	0	3	327.472	3.449	20	30		EGEDHN
C[C@@H](C(=O)N(CCC#N)c1ccc(F)cc1)N1C[C@H](C)C[C@H](C)C1	ZINC000073601248	454455018	/nfs/dbraw/zinc/45/50/18/454455018.db2.gz	OBPDZLYQEOFRFK-XHSDSOJGSA-N	0	3	331.435	3.439	20	30		EGEDHN
C=CCOc1ccc(CN2CCC(Cc3nccn3C)CC2)cc1	ZINC000121755324	454473076	/nfs/dbraw/zinc/47/30/76/454473076.db2.gz	CLQUKCBAHOKPRV-UHFFFAOYSA-N	0	3	325.456	3.440	20	30		EGEDHN
Cc1noc([C@@H]2CCCN(Cc3ccc(N(C)CCC#N)cc3)C2)n1	ZINC000091833013	454478399	/nfs/dbraw/zinc/47/83/99/454478399.db2.gz	CPBSNEWAHUQCCC-QGZVFWFLSA-N	0	3	339.443	3.108	20	30		EGEDHN
COc1cc([C@H](C)NCc2ccc(C#N)cc2)cc(OC)c1OC	ZINC000048367555	454481582	/nfs/dbraw/zinc/48/15/82/454481582.db2.gz	KMKJIBMGJOQRLX-ZDUSSCGKSA-N	0	3	326.396	3.435	20	30		EGEDHN
CCCN(CC(=O)N(CC)CCC#N)[C@@H]1CCc2ccccc2C1	ZINC000064632763	454496088	/nfs/dbraw/zinc/49/60/88/454496088.db2.gz	YWNJXXQTVDXSMY-LJQANCHMSA-N	0	3	327.472	3.018	20	30		EGEDHN
CNC(=O)C(C#N)C(=O)COc1ccc(Cl)cc1C1CCCCC1	ZINC000102389121	454503209	/nfs/dbraw/zinc/50/32/09/454503209.db2.gz	CJZFEKHZOSWIQH-HNNXBMFYSA-N	0	3	348.830	3.221	20	30		EGEDHN
Cc1ccc([C@H]2CCCN2C[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000073987133	454514376	/nfs/dbraw/zinc/51/43/76/454514376.db2.gz	GCOUNBSLWDMUIC-PZJWPPBQSA-N	0	3	336.435	3.444	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H]2c3cccc(F)c3CC[C@H]2C)CC1	ZINC000080121060	454537284	/nfs/dbraw/zinc/53/72/84/454537284.db2.gz	MRTTXBQPVKWCQC-KUHUBIRLSA-N	0	3	345.462	3.399	20	30		EGEDHN
N#CC(C(=O)CCc1c[nH]c2ccccc12)C(=O)NCc1ccccc1	ZINC000103503561	454561080	/nfs/dbraw/zinc/56/10/80/454561080.db2.gz	JGITZTLLTXASFV-SFHVURJKSA-N	0	3	345.402	3.126	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1ccc2c(c1)COC2)C(C)C	ZINC000049993139	454566865	/nfs/dbraw/zinc/56/68/65/454566865.db2.gz	ITMXQUSHBHHGLG-IBGZPJMESA-N	0	3	328.456	3.145	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H](Cc2ccccc2)c2ccccc2)CC1	ZINC000050028784	454568793	/nfs/dbraw/zinc/56/87/93/454568793.db2.gz	CDARCRDIUIQKOV-JOCHJYFZSA-N	0	3	346.474	3.432	20	30		EGEDHN
Cc1ccc([O-])c(C[N@@H+]2CCCN(Cc3ccc(C#N)cc3)CC2)c1	ZINC000122832898	454572417	/nfs/dbraw/zinc/57/24/17/454572417.db2.gz	DFZNOUPYJHKUKM-UHFFFAOYSA-N	0	3	335.451	3.280	20	30		EGEDHN
Cc1ccc([O-])c(C[N@H+]2CCCN(Cc3ccc(C#N)cc3)CC2)c1	ZINC000122832898	454572421	/nfs/dbraw/zinc/57/24/21/454572421.db2.gz	DFZNOUPYJHKUKM-UHFFFAOYSA-N	0	3	335.451	3.280	20	30		EGEDHN
N#CC(C(=O)Cc1ccc(Cl)cc1Cl)C(=O)Nc1ccccn1	ZINC000104055941	454574549	/nfs/dbraw/zinc/57/45/49/454574549.db2.gz	OTWSBJFFGSSMPV-GFCCVEGCSA-N	0	3	348.189	3.278	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000074446840	454583673	/nfs/dbraw/zinc/58/36/73/454583673.db2.gz	CWAPBVBRRGINCO-HKUYNNGSSA-N	0	3	330.472	3.091	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)C2(C#N)CCCCC2)CN1Cc1ccccc1	ZINC000134924430	454609625	/nfs/dbraw/zinc/60/96/25/454609625.db2.gz	VKKPRUKWGOQETM-SJLPKXTDSA-N	0	3	325.456	3.240	20	30		EGEDHN
Cc1cc2ncn(C[C@H](O)CN(C)Cc3cccc(C#N)c3)c2cc1C	ZINC000051322653	454618828	/nfs/dbraw/zinc/61/88/28/454618828.db2.gz	YHKNPWVTAIGJDU-LJQANCHMSA-N	0	3	348.450	3.018	20	30		EGEDHN
CCCNC(=O)C1CCN(Cc2ccccc2C(C)(C)C#N)CC1	ZINC000135114732	454635788	/nfs/dbraw/zinc/63/57/88/454635788.db2.gz	VBQAHDWYYOIHDV-UHFFFAOYSA-N	0	3	327.472	3.226	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN(CC(C)C)C2CC2)cc1	ZINC000051735008	454635976	/nfs/dbraw/zinc/63/59/76/454635976.db2.gz	WXSMTJAVDJSZNS-UHFFFAOYSA-N	0	3	343.471	3.452	20	30		EGEDHN
C=CCOc1ccc(CNCc2ccccc2N2CCOCC2)cc1	ZINC000065934916	454641217	/nfs/dbraw/zinc/64/12/17/454641217.db2.gz	SKTKLXPEBHREIF-UHFFFAOYSA-N	0	3	338.451	3.378	20	30		EGEDHN
CN(C)CCN(Cc1ccc(F)c(F)c1)C(=O)c1sccc1C#N	ZINC000052050571	454652160	/nfs/dbraw/zinc/65/21/60/454652160.db2.gz	QZNAFDYYQUIAHT-UHFFFAOYSA-N	0	3	349.406	3.102	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(C3CC3)n(C(C)(C)C)n2)CC1	ZINC000106036005	454674513	/nfs/dbraw/zinc/67/45/13/454674513.db2.gz	YOFAVXCANCSFEP-UHFFFAOYSA-N	0	3	344.503	3.286	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)COc2ccc(F)c(Cl)c2)CC1	ZINC000106036900	454674853	/nfs/dbraw/zinc/67/48/53/454674853.db2.gz	ASXOTOHPGWNXLC-UHFFFAOYSA-N	0	3	340.826	3.015	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H](C)Oc2ccc(Cl)cc2)CC1	ZINC000106039934	454675491	/nfs/dbraw/zinc/67/54/91/454675491.db2.gz	JIAWCQDDHUMDFJ-AWEZNQCLSA-N	0	3	336.863	3.264	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCC2(c3ccccc3)CCC2)CC1	ZINC000106275977	454689797	/nfs/dbraw/zinc/68/97/97/454689797.db2.gz	WAJAUJRBSRXDDJ-UHFFFAOYSA-N	0	3	341.499	3.448	20	30		EGEDHN
N#CCCN(C(=O)CN1CC[C@H](Cc2ccccc2)C1)c1ccccc1	ZINC000124051389	454696658	/nfs/dbraw/zinc/69/66/58/454696658.db2.gz	COJSWVRUHAOEMS-HXUWFJFHSA-N	0	3	347.462	3.498	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc3[nH]c(C(F)F)nc3c2)CC1	ZINC000093351242	454706705	/nfs/dbraw/zinc/70/67/05/454706705.db2.gz	JZIKWUDRDXRJPW-UHFFFAOYSA-N	0	3	349.385	3.272	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc3nc(C(F)F)[nH]c3c2)CC1	ZINC000093351242	454706711	/nfs/dbraw/zinc/70/67/11/454706711.db2.gz	JZIKWUDRDXRJPW-UHFFFAOYSA-N	0	3	349.385	3.272	20	30		EGEDHN
CN(CCC#N)c1ccc(CN(C)[C@H]2CCCc3c2cnn3C)cc1	ZINC000093864178	454740543	/nfs/dbraw/zinc/74/05/43/454740543.db2.gz	ZGTXBYGNJNAOAC-IBGZPJMESA-N	0	3	337.471	3.279	20	30		EGEDHN
N#CC(C(=O)c1ccc(Cl)c(F)c1)c1nnc2n1CCCCC2	ZINC000161985158	454743405	/nfs/dbraw/zinc/74/34/05/454743405.db2.gz	ONIVDCOWLJJVDA-LLVKDONJSA-N	0	3	332.766	3.287	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H](CC)Oc2cccc(C)c2)CC1	ZINC000176523343	454755626	/nfs/dbraw/zinc/75/56/26/454755626.db2.gz	LGUWTJJXRHGNCV-LJQANCHMSA-N	0	3	330.472	3.309	20	30		EGEDHN
CN(CCn1cccn1)Cc1cccc(OCc2cccc(C#N)c2)c1	ZINC000125307628	454813791	/nfs/dbraw/zinc/81/37/91/454813791.db2.gz	ZFVGYLMJNGWUBY-UHFFFAOYSA-N	0	3	346.434	3.466	20	30		EGEDHN
CC[C@@H](NCCS(=O)(=O)c1ccc(C#N)cc1)c1cccs1	ZINC000163149693	454825746	/nfs/dbraw/zinc/82/57/46/454825746.db2.gz	PADDKKIOMJCYDN-OAHLLOKOSA-N	0	3	334.466	3.134	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCN2CCS[C@H]3CCCC[C@@H]32)cc1	ZINC000177194342	454835086	/nfs/dbraw/zinc/83/50/86/454835086.db2.gz	PPEQEFOXKJVUPC-IRXDYDNUSA-N	0	3	329.469	3.247	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](Cc2ccccc2)C2CC2)CC1	ZINC000125675028	454838587	/nfs/dbraw/zinc/83/85/87/454838587.db2.gz	MAMLHKQOXSJMPF-FQEVSTJZSA-N	0	3	341.499	3.347	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN2CCC[C@@H]2CN2CCCC2)c1C	ZINC000177598605	454881824	/nfs/dbraw/zinc/88/18/24/454881824.db2.gz	ULYBEAPQTQRTCA-GOSISDBHSA-N	0	3	329.488	3.034	20	30		EGEDHN
C[C@@H](NCC1(c2cccc(F)c2)CCCCC1)C(=O)N(C)CCC#N	ZINC000112536030	454889481	/nfs/dbraw/zinc/88/94/81/454889481.db2.gz	KQKMSQWXINIZLP-MRXNPFEDSA-N	0	3	345.462	3.378	20	30		EGEDHN
C[C@H](CNc1ccc([N+](=O)[O-])c(C#N)c1)N1CCc2ccccc2C1	ZINC000165571630	454901589	/nfs/dbraw/zinc/90/15/89/454901589.db2.gz	UDUNWHLTMDALJS-CQSZACIVSA-N	0	3	336.395	3.325	20	30		EGEDHN
C=CCOc1ccc(CN(CCN2CCCC2=O)C(C)(C)C)cc1	ZINC000177847350	454912989	/nfs/dbraw/zinc/91/29/89/454912989.db2.gz	MWOLUYIUMDVJCH-UHFFFAOYSA-N	0	3	330.472	3.474	20	30		EGEDHN
C=CCN1CCC(NC(=O)CCOc2cc(C)cc(C)c2C)CC1	ZINC000170949082	455004302	/nfs/dbraw/zinc/00/43/02/455004302.db2.gz	FECFVCVGGQTPJS-UHFFFAOYSA-N	0	3	330.472	3.147	20	30		EGEDHN
CC1CCC(N2CCN(C(=O)CCc3ccc(C#N)cc3)CC2)CC1	ZINC000115255592	455008145	/nfs/dbraw/zinc/00/81/45/455008145.db2.gz	RIHGWDWZUBQNBW-UHFFFAOYSA-N	0	3	339.483	3.214	20	30		EGEDHN
N#CC1(c2ccccc2)CC(NCCCNC(=O)c2cccs2)C1	ZINC000127912409	455008282	/nfs/dbraw/zinc/00/82/82/455008282.db2.gz	VPOWYJWDUMDFID-UHFFFAOYSA-N	0	3	339.464	3.082	20	30		EGEDHN
C[C@@H](N[C@@H]1CC(=O)N(c2c(F)cccc2F)C1)c1ccc(C#N)cc1	ZINC000179798570	455080434	/nfs/dbraw/zinc/08/04/34/455080434.db2.gz	DEQDORFHVQRYOU-IUODEOHRSA-N	0	3	341.361	3.293	20	30		EGEDHN
FC(F)(F)Oc1ccc(C#CCN(C[C@H]2CCOC2)C2CC2)cc1	ZINC000156114113	455082728	/nfs/dbraw/zinc/08/27/28/455082728.db2.gz	GXVBAFHQUYHVKI-OAHLLOKOSA-N	0	3	339.357	3.438	20	30		EGEDHN
Cc1ccccc1[C@@H](NCC(=O)N[C@](C)(C#N)C1CC1)C(C)(C)C	ZINC000180084545	455129505	/nfs/dbraw/zinc/12/95/05/455129505.db2.gz	ZPTCFQFTLRIMOM-UYAOXDASSA-N	0	3	327.472	3.480	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)Nc2cccc(C#N)c2)CN1Cc1ccccc1	ZINC000152595293	455140890	/nfs/dbraw/zinc/14/08/90/455140890.db2.gz	MMIGBXKMGNAEFF-DNVCBOLYSA-N	0	3	334.423	3.343	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccc(C#N)c(Cl)c1)N(C)Cc1ccccc1	ZINC000156644758	455141503	/nfs/dbraw/zinc/14/15/03/455141503.db2.gz	KVKQLCXKORPOAC-AWEZNQCLSA-N	0	3	341.842	3.462	20	30		EGEDHN
CC[C@H](N[C@H](C)C(=O)NC1(C#N)CCCCC1)c1ccc(OC)cc1	ZINC000157029886	455162024	/nfs/dbraw/zinc/16/20/24/455162024.db2.gz	QLCLWSRJGHHWQT-QAPCUYQASA-N	0	3	343.471	3.467	20	30		EGEDHN
COc1cccc2c1OC[C@@H](NCc1ccc(O[C@H](C)C#N)cc1)C2	ZINC000237364368	455178350	/nfs/dbraw/zinc/17/83/50/455178350.db2.gz	VAULZXJJZCUXGM-PBHICJAKSA-N	0	3	338.407	3.079	20	30		EGEDHN
CS[C@H]1CCCCN([C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)C1	ZINC000182914606	455190558	/nfs/dbraw/zinc/19/05/58/455190558.db2.gz	UBBMHZAVPHJEDD-ZWKOTPCHSA-N	0	3	343.496	3.271	20	30		EGEDHN
C[C@@H](NCc1ccc(OCC#N)cc1)c1ccc([S@](C)=O)cc1	ZINC000180558408	455196569	/nfs/dbraw/zinc/19/65/69/455196569.db2.gz	OAFYJJNIEBSRCT-FATZIPQQSA-N	0	3	328.437	3.177	20	30		EGEDHN
CC(C)(C#N)CCN(Cc1ccc(C(=O)NC2CC2)cc1)C1CC1	ZINC000157585943	455210502	/nfs/dbraw/zinc/21/05/02/455210502.db2.gz	NAWBUJSMVSLEDB-UHFFFAOYSA-N	0	3	325.456	3.483	20	30		EGEDHN
CCS[C@@H]1CCCC[C@H]1N[C@@H](C)C(=O)NC1(C#N)CCCCC1	ZINC000189511942	455211563	/nfs/dbraw/zinc/21/15/63/455211563.db2.gz	IFJNGMNWEKVIQA-ARFHVFGLSA-N	0	3	337.533	3.371	20	30		EGEDHN
CC1(CO)CCN(Cc2cn(CCC#N)nc2-c2ccccc2)CC1	ZINC000184075625	455351480	/nfs/dbraw/zinc/35/14/80/455351480.db2.gz	HBWLOFCOHJLSBF-UHFFFAOYSA-N	0	3	338.455	3.058	20	30		EGEDHN
Cc1nccn1-c1ccc(CN[C@H](C)c2ccc(OCC#N)cc2)cn1	ZINC000181540242	455352537	/nfs/dbraw/zinc/35/25/37/455352537.db2.gz	ACTHNURBSGMIJN-OAHLLOKOSA-N	0	3	347.422	3.329	20	30		EGEDHN
C[C@@H](NCCNC(=O)c1ccccc1Cl)c1cccc(C#N)c1	ZINC000181747395	455378090	/nfs/dbraw/zinc/37/80/90/455378090.db2.gz	DANJPNVHTSDAPR-CYBMUJFWSA-N	0	3	327.815	3.292	20	30		EGEDHN
C[C@H](N[C@@H]1CCN(C(=O)C2CCCCC2)C1)c1cccc(C#N)c1	ZINC000181900086	455397094	/nfs/dbraw/zinc/39/70/94/455397094.db2.gz	YEQNRYMMURMNOC-HNAYVOBHSA-N	0	3	325.456	3.390	20	30		EGEDHN
CC#CCN1CCC(C(=O)Nc2ccccc2Br)CC1	ZINC000160224336	455439959	/nfs/dbraw/zinc/43/99/59/455439959.db2.gz	OOIWUERAMNTCKV-UHFFFAOYSA-N	0	3	335.245	3.123	20	30		EGEDHN
Cn1cc(CN[C@@H]2CCCN(c3ccccc3Cl)C2)cc1C#N	ZINC000191187312	455460879	/nfs/dbraw/zinc/46/08/79/455460879.db2.gz	MHGMUCMWWMHOSM-OAHLLOKOSA-N	0	3	328.847	3.309	20	30		EGEDHN
C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)c1cccc(SCC#N)c1	ZINC000246433682	455488590	/nfs/dbraw/zinc/48/85/90/455488590.db2.gz	CUPQDCFXKJSIOO-CABCVRRESA-N	0	3	331.485	3.152	20	30		EGEDHN
C=CCCC[C@H](C)N[C@@H](C(N)=O)c1cccc(Br)c1	ZINC000182343823	455493861	/nfs/dbraw/zinc/49/38/61/455493861.db2.gz	ZJTHRUOFZRWSRG-SMDDNHRTSA-N	0	3	325.250	3.310	20	30		EGEDHN
N#Cc1ccccc1OCCN[C@H]1CCO[C@H]1c1ccc(F)c(F)c1	ZINC000192137660	455563085	/nfs/dbraw/zinc/56/30/85/455563085.db2.gz	IYJSHLOUKNBILI-HKUYNNGSSA-N	0	3	344.361	3.335	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(F)cc(C(F)(F)F)c2)CC1	ZINC000267990429	455575806	/nfs/dbraw/zinc/57/58/06/455575806.db2.gz	QACDGGGGCSEYES-UHFFFAOYSA-N	0	3	330.325	3.225	20	30		EGEDHN
CCc1ccc(CN[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)cc1	ZINC000192244418	455580817	/nfs/dbraw/zinc/58/08/17/455580817.db2.gz	VPQMOSMTLGCZRD-HXUWFJFHSA-N	0	3	333.435	3.011	20	30		EGEDHN
C#CCCCC(=O)N(CCN(C)C)Cc1ccc(C(F)(F)F)cc1	ZINC000192309873	455589843	/nfs/dbraw/zinc/58/98/43/455589843.db2.gz	RONFCINZALQCNR-UHFFFAOYSA-N	0	3	340.389	3.399	20	30		EGEDHN
C[C@@H]1CN(C[C@H](O)COc2ccc(CC#N)cc2)[C@H]1c1ccccc1	ZINC000247380846	455593457	/nfs/dbraw/zinc/59/34/57/455593457.db2.gz	UGHWGKNRVUZVSU-LKUPVBHCSA-N	0	3	336.435	3.185	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCc1ccc(OCCN(C)C)cc1	ZINC000268228545	455624843	/nfs/dbraw/zinc/62/48/43/455624843.db2.gz	UYEIKPUFBIIMSA-UHFFFAOYSA-N	0	3	330.472	3.054	20	30		EGEDHN
C=CC[C@H](CC)NC(=O)NCc1ccc(OC2CCN(C)CC2)cc1	ZINC000284177472	455646555	/nfs/dbraw/zinc/64/65/55/455646555.db2.gz	KVBFJWBFTHFJIQ-KRWDZBQOSA-N	0	3	345.487	3.314	20	30		EGEDHN
C#CCN1CCC(C(=O)NCCCCc2ccc(Cl)s2)CC1	ZINC000284280627	455661428	/nfs/dbraw/zinc/66/14/28/455661428.db2.gz	YUAYGXFNWXRINA-UHFFFAOYSA-N	0	3	338.904	3.186	20	30		EGEDHN
N#C[C@H]1CC[C@H]([NH+]2CCC(C(=O)Nc3cc(Cl)ccc3[O-])CC2)C1	ZINC000292668549	455726620	/nfs/dbraw/zinc/72/66/20/455726620.db2.gz	AYIIBXIQSBVYFL-WFASDCNBSA-N	0	3	347.846	3.388	20	30		EGEDHN
N#C[C@H]1CCC[C@@H](Nc2cccc(CN3CCC(CO)CC3)c2)C1	ZINC000193101889	455741457	/nfs/dbraw/zinc/74/14/57/455741457.db2.gz	LKCLCDDWGOFMJX-PKOBYXMFSA-N	0	3	327.472	3.385	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)c1cc(F)cc2nccnc21	ZINC000193580732	455765316	/nfs/dbraw/zinc/76/53/16/455765316.db2.gz	VTMUPQCZABHDEJ-CYBMUJFWSA-N	0	3	345.337	3.146	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N[C@@H]1CCOC2(CCC2)C1)C(C)C	ZINC000269183487	455806231	/nfs/dbraw/zinc/80/62/31/455806231.db2.gz	CENJJNCVCKBPKN-MSOLQXFVSA-N	0	3	349.519	3.086	20	30		EGEDHN
N#CCOc1ccccc1C(=O)N1C[C@@H]2CCCN2Cc2ccccc21	ZINC000194204986	455815262	/nfs/dbraw/zinc/81/52/62/455815262.db2.gz	GTAGVMLDMJOOAN-KRWDZBQOSA-N	0	3	347.418	3.214	20	30		EGEDHN
CC[C@H](N[C@@H]1CCCN(Cc2ccccn2)C1=O)c1ccc(C#N)cc1	ZINC000278367273	455830965	/nfs/dbraw/zinc/83/09/65/455830965.db2.gz	BVNBHMVSFYFCFO-VQTJNVASSA-N	0	3	348.450	3.185	20	30		EGEDHN
N#Cc1ccc(NC2CCN(CCOc3ccc(F)cc3)CC2)cn1	ZINC000269314287	455833478	/nfs/dbraw/zinc/83/34/78/455833478.db2.gz	CIHZAPWFAQZKKP-UHFFFAOYSA-N	0	3	340.402	3.048	20	30		EGEDHN
C[C@@H]1C[C@H](N(C)C(=O)CC(C)(C)C#N)CCN1Cc1ccccc1	ZINC000278384395	455834480	/nfs/dbraw/zinc/83/44/80/455834480.db2.gz	RCZXKELQSBNBTD-SJLPKXTDSA-N	0	3	327.472	3.438	20	30		EGEDHN
COc1ccc(CN(C)CCc2ccccc2[N+](=O)[O-])cc1C#N	ZINC000285407249	455838377	/nfs/dbraw/zinc/83/83/77/455838377.db2.gz	ULPOSXTYKQXQRJ-UHFFFAOYSA-N	0	3	325.368	3.150	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C(C)(C)c2cc(F)cc(C#N)c2)CC1	ZINC000285403972	455838795	/nfs/dbraw/zinc/83/87/95/455838795.db2.gz	OZKDVEZHQGPRKR-UHFFFAOYSA-N	0	3	343.446	3.132	20	30		EGEDHN
C[C@@H](C1CCN(C)CC1)N(C)C(=O)Nc1cc(C#N)cn1C(C)(C)C	ZINC000272086379	455843711	/nfs/dbraw/zinc/84/37/11/455843711.db2.gz	CEKAWGBECDFKPI-AWEZNQCLSA-N	0	3	345.491	3.309	20	30		EGEDHN
COc1cccc(OC)c1OC1CCN([C@@H]2CC[C@H](C#N)C2)CC1	ZINC000278693007	455844012	/nfs/dbraw/zinc/84/40/12/455844012.db2.gz	SHTKRYLTZWOMCI-LSDHHAIUSA-N	0	3	330.428	3.239	20	30		EGEDHN
CC(C)Oc1ccc(NC(=O)N2CCCN(C(C)C)CC2)cc1C#N	ZINC000269380220	455846313	/nfs/dbraw/zinc/84/63/13/455846313.db2.gz	MVDPLJMIYJLYBN-UHFFFAOYSA-N	0	3	344.459	3.293	20	30		EGEDHN
CC(C)(C)C1CCN(NC(=O)C(C#N)Cc2ccc(C#N)cc2)CC1	ZINC000295387398	455847610	/nfs/dbraw/zinc/84/76/10/455847610.db2.gz	KXDOAOPDAXEAFX-KRWDZBQOSA-N	0	3	338.455	3.030	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N2CCN(C3CCC3)C[C@@H](C)C2)cc1	ZINC000295430813	455848340	/nfs/dbraw/zinc/84/83/40/455848340.db2.gz	NJCOSZWCAFCOGZ-QGZVFWFLSA-N	0	3	342.483	3.127	20	30		EGEDHN
N#CCC[C@H](NC(=O)N1CC[C@H](N2CCCCC2)C1)c1ccccc1	ZINC000269636377	455851316	/nfs/dbraw/zinc/85/13/16/455851316.db2.gz	WBMIAFBHVFTKRY-OALUTQOASA-N	0	3	340.471	3.301	20	30		EGEDHN
N#CCC[C@@H](NC(=O)N1CC[C@@H](N2CCCCC2)C1)c1ccccc1	ZINC000269636385	455852063	/nfs/dbraw/zinc/85/20/63/455852063.db2.gz	WBMIAFBHVFTKRY-RTBURBONSA-N	0	3	340.471	3.301	20	30		EGEDHN
C=CCc1cc(CNC[C@@]2(O)CCc3ccccc32)cc(OC)c1O	ZINC000269814546	455853458	/nfs/dbraw/zinc/85/34/58/455853458.db2.gz	NMKQJMONVQLPMI-NRFANRHFSA-N	0	3	339.435	3.053	20	30		EGEDHN
CC1(C)C[C@H](O)CCN(CC#Cc2ccc(OC(F)(F)F)cc2)C1	ZINC000295931847	455863249	/nfs/dbraw/zinc/86/32/49/455863249.db2.gz	FZUGEYNGLSSSAI-OAHLLOKOSA-N	0	3	341.373	3.420	20	30		EGEDHN
C=CC(C)(C)C(=O)Nc1ccc(NC(=O)NC2CCN(C)CC2)cc1	ZINC000295926112	455863506	/nfs/dbraw/zinc/86/35/06/455863506.db2.gz	SDRZZHUGXLTTTD-UHFFFAOYSA-N	0	3	344.459	3.053	20	30		EGEDHN
Cc1oc(NC(=O)[C@H](C)N[C@@H]2C[C@H](OC(C)C)C2(C)C)c(C#N)c1C	ZINC000296047515	455867551	/nfs/dbraw/zinc/86/75/51/455867551.db2.gz	FNRGNTKENVESRF-MAZHCROVSA-N	0	3	347.459	3.277	20	30		EGEDHN
COc1cccc([C@H](C)NC(=O)C(C#N)Cc2ccc(C#N)cc2)c1	ZINC000279748724	455872672	/nfs/dbraw/zinc/87/26/72/455872672.db2.gz	QBQXNHVZKIVGCC-KBXCAEBGSA-N	0	3	333.391	3.127	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN2C[C@@H](N3CCCC3)C[C@@H]2C)c1C	ZINC000285578534	455874941	/nfs/dbraw/zinc/87/49/41/455874941.db2.gz	OGTUVULSEZGWFI-YJBOKZPZSA-N	0	3	329.488	3.032	20	30		EGEDHN
C=CCOc1ccc(CNCc2ccc3c(c2)CCC(=O)N3C)cc1	ZINC000285609851	455881324	/nfs/dbraw/zinc/88/13/24/455881324.db2.gz	QAGFYWGYNKVKEH-UHFFFAOYSA-N	0	3	336.435	3.450	20	30		EGEDHN
CC(C)(C(=O)N1CC[C@H](N2CCCCC2)C1)c1cc(F)cc(C#N)c1	ZINC000285623440	455883832	/nfs/dbraw/zinc/88/38/32/455883832.db2.gz	ZPVITANFQIPVGD-SFHVURJKSA-N	0	3	343.446	3.062	20	30		EGEDHN
CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)C1(C#N)CCCC1	ZINC000187327505	455895894	/nfs/dbraw/zinc/89/58/94/455895894.db2.gz	BDBRUNRGSFYVCO-SFHVURJKSA-N	0	3	327.472	3.343	20	30		EGEDHN
Cc1ccccc1O[C@H](C)CNC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000280212218	455918026	/nfs/dbraw/zinc/91/80/26/455918026.db2.gz	AENLCMKDFVEROW-VQIMIIECSA-N	0	3	347.418	3.133	20	30		EGEDHN
C[C@@H]1CCN(C(=O)c2ccc(CC#N)cc2)CCN1Cc1ccccc1	ZINC000270311064	455926180	/nfs/dbraw/zinc/92/61/80/455926180.db2.gz	FQLGHACAUFBKSD-GOSISDBHSA-N	0	3	347.462	3.489	20	30		EGEDHN
CS[C@@H]1CCN(CCC(=O)Nc2sc3c(c2C#N)CCCC3)C1	ZINC000296501379	455956131	/nfs/dbraw/zinc/95/61/31/455956131.db2.gz	ZIAYQUCJIDWFST-GFCCVEGCSA-N	0	3	349.525	3.264	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)N1CCCN(CC2CCCCC2)CC1	ZINC000280512493	455986763	/nfs/dbraw/zinc/98/67/63/455986763.db2.gz	DAXCMNZHVJHRRI-UHFFFAOYSA-N	0	3	329.444	3.188	20	30		EGEDHN
CN1CCC[C@]2(CCN(C(=O)Nc3cc(C#N)cn3C(C)(C)C)C2)C1	ZINC000296620254	455991881	/nfs/dbraw/zinc/99/18/81/455991881.db2.gz	QCGLZIDZHDZXOU-IBGZPJMESA-N	0	3	343.475	3.064	20	30		EGEDHN
COc1cc2c(cc1CNC(=N)Nc1cc(F)ccc1F)O[C@H](C)C2	ZINC000262239366	456015664	/nfs/dbraw/zinc/01/56/64/456015664.db2.gz	BDVKGTFYLVXHDJ-SNVBAGLBSA-N	0	3	347.365	3.224	20	30		EGEDHN
CC(C)(C)Oc1ccc(CNC(=N)Nc2cc(F)ccc2F)cn1	ZINC000262258296	456017776	/nfs/dbraw/zinc/01/77/76/456017776.db2.gz	FUZVKBZGYCZLQX-UHFFFAOYSA-N	0	3	334.370	3.464	20	30		EGEDHN
C=CCC[C@H](NC(=O)N1CC[C@H]2CCN(C)C[C@H]21)c1ccccc1	ZINC000272633268	456020543	/nfs/dbraw/zinc/02/05/43/456020543.db2.gz	XFXZUHMQEQWMLG-CEXWTWQISA-N	0	3	327.472	3.430	20	30		EGEDHN
CSCc1ccc(CNC(=O)C(C#N)Cc2ccc(C#N)cc2)cc1	ZINC000286410220	456042783	/nfs/dbraw/zinc/04/27/83/456042783.db2.gz	KHNOXSXGHNHMJC-LJQANCHMSA-N	0	3	349.459	3.420	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CC[C@H](C(F)(F)F)[C@H](CO)C1	ZINC000286549118	456049636	/nfs/dbraw/zinc/04/96/36/456049636.db2.gz	ONPJYQWQPDZRLW-HOCLYGCPSA-N	0	3	340.389	3.480	20	30		EGEDHN
CCCN(C)[C@@H](CNC(=O)NCCCC#N)c1ccc(Cl)cc1	ZINC000286940415	456058165	/nfs/dbraw/zinc/05/81/65/456058165.db2.gz	VWRDBEWCMFMQIC-INIZCTEOSA-N	0	3	336.867	3.326	20	30		EGEDHN
CC(C)N(CCN(C)C)C(=O)Nc1ccc(C#N)c(C(F)(F)F)c1	ZINC000272782185	456069350	/nfs/dbraw/zinc/06/93/50/456069350.db2.gz	ONFZPVJDTMJHBV-UHFFFAOYSA-N	0	3	342.365	3.381	20	30		EGEDHN
CC(C)(C)[C@H](CCO)NCc1ccc(Br)cc1C#N	ZINC000287855443	456080665	/nfs/dbraw/zinc/08/06/65/456080665.db2.gz	RLIRCJOZWSFCLU-AWEZNQCLSA-N	0	3	325.250	3.207	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2Cc3ccccc3OC[C@H]2C)CC1	ZINC000272874275	456097213	/nfs/dbraw/zinc/09/72/13/456097213.db2.gz	BEPIYSQWPHDPEF-MRXNPFEDSA-N	0	3	343.471	3.020	20	30		EGEDHN
C[C@@H]1CN(C(=O)N[C@@H](CCC#N)c2ccccc2)CCN(C2CC2)C1	ZINC000297176524	456141208	/nfs/dbraw/zinc/14/12/08/456141208.db2.gz	FJAVXGKTZXCYGG-LPHOPBHVSA-N	0	3	340.471	3.157	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1)C(=O)Nc1ccc(C#N)c(F)c1	ZINC000289931283	456186121	/nfs/dbraw/zinc/18/61/21/456186121.db2.gz	VMAMTPOXDHUFLI-UHFFFAOYSA-N	0	3	340.402	3.293	20	30		EGEDHN
C[C@](C#N)(NC(=O)CN[C@H]1CC(C)(C)CCc2ccccc21)C1CC1	ZINC000333272922	456190455	/nfs/dbraw/zinc/19/04/55/456190455.db2.gz	HPKBLIFBJRTXRR-GHTZIAJQSA-N	0	3	339.483	3.488	20	30		EGEDHN
Cc1cccc(C[C@@H](CO)NCc2cccc(OCCCC#N)c2)c1	ZINC000189022077	456203669	/nfs/dbraw/zinc/20/36/69/456203669.db2.gz	ZUMOTLTYTGJYEP-FQEVSTJZSA-N	0	3	338.451	3.371	20	30		EGEDHN
C=C[C@H](CO)N[C@@H]1CCCc2c3cc(Br)ccc3[nH]c21	ZINC000289991912	456208912	/nfs/dbraw/zinc/20/89/12/456208912.db2.gz	YNFJUYOGLXQXDY-IAQYHMDHSA-N	0	3	335.245	3.444	20	30		EGEDHN
C=CC[C@H](CO)N[C@H]1C[C@H](NC(=O)OC(C)(C)C)c2ccccc21	ZINC000273378243	456226856	/nfs/dbraw/zinc/22/68/56/456226856.db2.gz	BRGULHGRDIPZSK-COXVUDFISA-N	0	3	332.444	3.224	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN(C)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1	ZINC000273438247	456229708	/nfs/dbraw/zinc/22/97/08/456229708.db2.gz	MURUIXKXLOJXMQ-RBUKOAKNSA-N	0	3	346.446	3.178	20	30		EGEDHN
N#Cc1ccc(C(=O)N2CCCN(CCCc3ccccc3)CC2)cc1	ZINC000263825193	456235911	/nfs/dbraw/zinc/23/59/11/456235911.db2.gz	RUVPOGLJMSWIDD-UHFFFAOYSA-N	0	3	347.462	3.339	20	30		EGEDHN
N#Cc1cc(Cl)ccc1NC[C@@H]1C[C@H](O)CN1Cc1ccccc1	ZINC000301876798	456239263	/nfs/dbraw/zinc/23/92/63/456239263.db2.gz	NHPLTOXVPAERCB-ROUUACIJSA-N	0	3	341.842	3.259	20	30		EGEDHN
CC[C@H](CC#N)N[C@H]1CCCC[C@H](N2C(=O)c3ccccc3C2=O)C1	ZINC000273869989	456246568	/nfs/dbraw/zinc/24/65/68/456246568.db2.gz	OGDWMOSOAMWFFJ-PMPSAXMXSA-N	0	3	339.439	3.266	20	30		EGEDHN
CC#CCCCC(=O)N(Cc1ccncc1)C[C@@H]1CCCN1CC	ZINC000274260638	456253857	/nfs/dbraw/zinc/25/38/57/456253857.db2.gz	BTUVNULHRLJYDF-IBGZPJMESA-N	0	3	327.472	3.088	20	30		EGEDHN
C#CCN(CCC(=O)Nc1ccc(Br)cc1F)C1CC1	ZINC000274248801	456253925	/nfs/dbraw/zinc/25/39/25/456253925.db2.gz	ZCTKAAWKOSAVPR-UHFFFAOYSA-N	0	3	339.208	3.014	20	30		EGEDHN
C=C(C)CCN1CCN(CCCc2nc(-c3cccs3)no2)CC1	ZINC000274742783	456264317	/nfs/dbraw/zinc/26/43/17/456264317.db2.gz	FMUZGYVEUHKILI-UHFFFAOYSA-N	0	3	346.500	3.315	20	30		EGEDHN
C=C(C)[C@H](NC(=O)NC1CCN(CC)CC1)c1ccc(F)c(F)c1	ZINC000274842512	456265939	/nfs/dbraw/zinc/26/59/39/456265939.db2.gz	BNYUBVKLUJVLDX-KRWDZBQOSA-N	0	3	337.414	3.366	20	30		EGEDHN
CC[C@@H](CN(CC)CC(=O)N(CCC#N)CCC#N)c1ccccc1	ZINC000274895093	456267334	/nfs/dbraw/zinc/26/73/34/456267334.db2.gz	KXNIMEJHPDWVFR-SFHVURJKSA-N	0	3	340.471	3.158	20	30		EGEDHN
C#CCCN1CCN(c2ccnc3cc(C(F)(F)F)ccc32)CC1	ZINC000302000956	456267869	/nfs/dbraw/zinc/26/78/69/456267869.db2.gz	WHVDEZRVMREHJM-UHFFFAOYSA-N	0	3	333.357	3.399	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NC[C@@H](c1ccccc1)N1CCCC1	ZINC000275643677	456278429	/nfs/dbraw/zinc/27/84/29/456278429.db2.gz	AWTKDBRACWNJOS-AZUAARDMSA-N	0	3	330.472	3.169	20	30		EGEDHN
COc1cc(CN[C@H](CN2CCCC2)c2ccccc2)ccc1C#N	ZINC000281655556	456282756	/nfs/dbraw/zinc/28/27/56/456282756.db2.gz	KJQVLGAEZPENNV-HXUWFJFHSA-N	0	3	335.451	3.494	20	30		EGEDHN
COc1cc(CNC[C@@H](c2ccc(C)o2)N2CCCC2)ccc1C#N	ZINC000281681665	456292338	/nfs/dbraw/zinc/29/23/38/456292338.db2.gz	MIKKEEKESQNOJN-SFHVURJKSA-N	0	3	339.439	3.395	20	30		EGEDHN
CN(C)[C@H](CNc1ccnc(C#N)c1)c1cccc(C(F)(F)F)c1	ZINC000342887373	456295363	/nfs/dbraw/zinc/29/53/63/456295363.db2.gz	BDCFVFIVEURYIS-MRXNPFEDSA-N	0	3	334.345	3.109	20	30		EGEDHN
COc1cccc([C@@H](CNc2cc(C#N)ccc2[N+](=O)[O-])N(C)C)c1	ZINC000302146573	456299588	/nfs/dbraw/zinc/29/95/88/456299588.db2.gz	JQASZDQPKGNABG-GOSISDBHSA-N	0	3	340.383	3.190	20	30		EGEDHN
CN(C[C@H](O)CSc1nc(-c2ccccc2)ccc1C#N)C1CC1	ZINC000290537720	456358019	/nfs/dbraw/zinc/35/80/19/456358019.db2.gz	DWPWSEJJGMWUBE-KRWDZBQOSA-N	0	3	339.464	3.167	20	30		EGEDHN
N#CCCN(Cc1ccncc1)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000298092989	456362281	/nfs/dbraw/zinc/36/22/81/456362281.db2.gz	IHNMLXZUXLHEGC-OAQYLSRUSA-N	0	3	334.467	3.462	20	30		EGEDHN
NC(=NOCc1ccc(F)cn1)c1ccccc1CN1CCCCC1	ZINC000276095175	456387050	/nfs/dbraw/zinc/38/70/50/456387050.db2.gz	RGQXSCRRCVZXMR-UHFFFAOYSA-N	0	3	342.418	3.044	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)s1)c1ccc(N2CCCNC2=O)cc1	ZINC000291068490	456517532	/nfs/dbraw/zinc/51/75/32/456517532.db2.gz	LGQKKVQIRPTLSD-CYBMUJFWSA-N	0	3	340.452	3.390	20	30		EGEDHN
CN(c1ccc(/N=C/c2cccc([O-])c2O)cc1)C1CC[NH+](C)CC1	ZINC000298762164	456534182	/nfs/dbraw/zinc/53/41/82/456534182.db2.gz	DALOGGFQHGFTBW-KGENOOAVSA-N	0	3	339.439	3.379	20	30		EGEDHN
CN(C)C[C@@H](NC(=O)Nc1ccc(CC#N)cc1)c1ccc(F)cc1	ZINC000348224227	456547051	/nfs/dbraw/zinc/54/70/51/456547051.db2.gz	IFQWMVXDCRKALT-GOSISDBHSA-N	0	3	340.402	3.316	20	30		EGEDHN
COc1cccc(C2(NCCC(=O)Nc3ccccc3C#N)CC2)c1	ZINC000298827556	456549363	/nfs/dbraw/zinc/54/93/63/456549363.db2.gz	GQNYMZZWFURDAT-UHFFFAOYSA-N	0	3	335.407	3.174	20	30		EGEDHN
Cn1cc(CN2CCC(c3nc(-c4ccccc4)n[nH]3)CC2)cc1C#N	ZINC000276731735	456563656	/nfs/dbraw/zinc/56/36/56/456563656.db2.gz	HHYPBHASGGHZNH-UHFFFAOYSA-N	0	3	346.438	3.061	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN[C@@H](C)c1ccc2n[nH]cc2c1	ZINC000353221678	456570693	/nfs/dbraw/zinc/57/06/93/456570693.db2.gz	ZIABGLYNBSGWDU-ZDUSSCGKSA-N	0	3	336.395	3.173	20	30		EGEDHN
N#Cc1ccc(SC[C@H]2CN(Cc3ccccc3)CCCO2)nc1	ZINC000340677902	456618067	/nfs/dbraw/zinc/61/80/67/456618067.db2.gz	UKXXSUJRTYETKO-GOSISDBHSA-N	0	3	339.464	3.336	20	30		EGEDHN
CO[C@H]1CCCC[C@@H]1NCC(=O)N(CCC#N)c1ccc(C)c(C)c1	ZINC000276957121	456631725	/nfs/dbraw/zinc/63/17/25/456631725.db2.gz	LTFKLGIPRDHMHU-OALUTQOASA-N	0	3	343.471	3.097	20	30		EGEDHN
CC[C@@H](NCCS(=O)(=O)c1ccc(C#N)cc1)C1CCCCC1	ZINC000322109427	456645030	/nfs/dbraw/zinc/64/50/30/456645030.db2.gz	UOQWTZCGRINCIS-GOSISDBHSA-N	0	3	334.485	3.280	20	30		EGEDHN
C=CCCC[C@H](C)NC(=O)c1ccc(CN2CCC(CO)CC2)cc1	ZINC000343498336	456661095	/nfs/dbraw/zinc/66/10/95/456661095.db2.gz	AVUBFRIQCBXPKW-KRWDZBQOSA-N	0	3	344.499	3.366	20	30		EGEDHN
C[C@H](C(=O)N(CCN(C)C)Cc1cccc(C#N)c1)c1ccsc1	ZINC000348424879	456683186	/nfs/dbraw/zinc/68/31/86/456683186.db2.gz	RFRPRQZJJLQRMS-HNNXBMFYSA-N	0	3	341.480	3.314	20	30		EGEDHN
CCN1CCN(Cc2ccc(CNc3nccc(C)c3C#N)cc2)CC1	ZINC000343535746	456690997	/nfs/dbraw/zinc/69/09/97/456690997.db2.gz	SAFSELCDSIJASQ-UHFFFAOYSA-N	0	3	349.482	3.011	20	30		EGEDHN
C=CCN(Cc1cccs1)[C@@H](C)c1cccc(-n2cnnn2)c1	ZINC000353494012	456713669	/nfs/dbraw/zinc/71/36/69/456713669.db2.gz	XNIKCLZPWYIQQI-AWEZNQCLSA-N	0	3	325.441	3.473	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N(C)C[C@H]1CCN(C)[C@H]1c1cccnc1	ZINC000338225995	456716671	/nfs/dbraw/zinc/71/66/71/456716671.db2.gz	LNEOSNQVAARZBV-QUCCMNQESA-N	0	3	348.450	3.027	20	30		EGEDHN
C[C@H]1CCN(C)CCN1C(=O)c1cccc(Nc2ccc(C#N)cc2)c1	ZINC000348516288	456726838	/nfs/dbraw/zinc/72/68/38/456726838.db2.gz	QMCLMDQQFNOTMU-INIZCTEOSA-N	0	3	348.450	3.468	20	30		EGEDHN
C#CCCCC(=O)N(Cc1ccc(O)cc1)C[C@H]1CCCN1CC	ZINC000277248305	456743423	/nfs/dbraw/zinc/74/34/23/456743423.db2.gz	DKKRHALBKXKMDQ-GOSISDBHSA-N	0	3	328.456	3.009	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/C2CCC(NC(C)=O)CC2)c([O-])c1	ZINC000299610474	456743900	/nfs/dbraw/zinc/74/39/00/456743900.db2.gz	HQCBVXQHNDQCKB-DEDYPNTBSA-N	0	3	331.460	3.105	20	30		EGEDHN
C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NCc1ccccc1C#N	ZINC000277251966	456745919	/nfs/dbraw/zinc/74/59/19/456745919.db2.gz	AEOHEJRQBVRWAK-PBHICJAKSA-N	0	3	329.444	3.293	20	30		EGEDHN
Cc1cccc(C)c1NC(=O)[C@H](C)N1CCC[C@@H]1[C@H]1COCC[C@H]1O	ZINC000328765566	456755392	/nfs/dbraw/zinc/75/53/92/456755392.db2.gz	FBJJBXVQUKRWAM-BSDSXHPESA-N	0	3	346.471	3.142	20	30		EGEDHN
CN(C)CCN(CCCc1ccccc1)C(=O)c1cccc(CC#N)c1	ZINC000299680746	456762512	/nfs/dbraw/zinc/76/25/12/456762512.db2.gz	RQSWHIVDMQLAMY-UHFFFAOYSA-N	0	3	349.478	3.389	20	30		EGEDHN
CCCN1CCC[C@@H]1C(=O)N[C@@H]1CCN(C(C)=O)c2ccccc21	ZINC000328800102	456764353	/nfs/dbraw/zinc/76/43/53/456764353.db2.gz	HXGGZNQJVQUOJS-SJLPKXTDSA-N	0	3	329.444	3.315	20	30		EGEDHN
O=C(NCC1(N2CCSCC2)CCCCC1)[C@H]1CCCC(=O)N1	ZINC000328833195	456770453	/nfs/dbraw/zinc/77/04/53/456770453.db2.gz	WCIDBIFCOLRLLA-CQSZACIVSA-N	0	3	339.505	3.204	20	30		EGEDHN
C[C@@H]1C[C@@H](C(=O)NCc2ccc(OC3CCN(C)CC3)cc2)CO1	ZINC000328901775	456788093	/nfs/dbraw/zinc/78/80/93/456788093.db2.gz	ZMXLXCOEGDXYTP-GDBMZVCRSA-N	0	3	332.444	3.041	20	30		EGEDHN
CC1=C(C(=O)N[C@@H]2CCN(Cc3ccccc3)C[C@H]2CO)CCC1	ZINC000328904290	456788352	/nfs/dbraw/zinc/78/83/52/456788352.db2.gz	JDPYIHFBXBIWRZ-PKOBYXMFSA-N	0	3	328.456	3.326	20	30		EGEDHN
C[C@@H](C(=O)N(CCC#N)c1ccc(F)cc1)N1CC[C@H](C2CC2)C1	ZINC000344038222	456790269	/nfs/dbraw/zinc/79/02/69/456790269.db2.gz	QXLMCESACQJLRH-HOCLYGCPSA-N	0	3	329.419	3.193	20	30		EGEDHN
CN1CCC(Oc2ccc(CNC(=O)[C@@]3(C)CCOC3)cc2)CC1	ZINC000328926606	456792189	/nfs/dbraw/zinc/79/21/89/456792189.db2.gz	WNIXITIRZKRCRB-IBGZPJMESA-N	0	3	332.444	3.043	20	30		EGEDHN
C[C@@H]1[C@H](NC(=O)c2cccc(CC#N)c2)CCN1Cc1ccccc1	ZINC000291923345	456800010	/nfs/dbraw/zinc/80/00/10/456800010.db2.gz	RXOXOBOKTZRPED-OXQOHEQNSA-N	0	3	333.435	3.145	20	30		EGEDHN
C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H]1CCN(C)[C@@H](C)C1	ZINC000353643835	456823979	/nfs/dbraw/zinc/82/39/79/456823979.db2.gz	PUFQETOFYAPXOS-FUHWJXTLSA-N	0	3	347.507	3.034	20	30		EGEDHN
COc1ccc(CN[C@H]2C[C@H](OC)C2(C)C)cc1OCCCC#N	ZINC000344700568	456849341	/nfs/dbraw/zinc/84/93/41/456849341.db2.gz	QSYFWCULIMBVIG-ROUUACIJSA-N	0	3	332.444	3.281	20	30		EGEDHN
COc1cc(Cl)cc(C(=O)C(C#N)c2nnc3n2CCCCC3)c1	ZINC000344922802	456871440	/nfs/dbraw/zinc/87/14/40/456871440.db2.gz	TTXTZDWZMQIPQI-CQSZACIVSA-N	0	3	344.802	3.157	20	30		EGEDHN
CCN1CCCC[C@@H]1CNC(=O)c1cnc2c(cnn2CC(C)C)c1	ZINC000329388403	456883311	/nfs/dbraw/zinc/88/33/11/456883311.db2.gz	TZTBHZJXEZMYFL-QGZVFWFLSA-N	0	3	343.475	3.266	20	30		EGEDHN
CN(C[C@H](O)COc1ccc(C(F)(F)F)cc1)[C@H]1CC[C@@H](C#N)C1	ZINC000338994514	456891503	/nfs/dbraw/zinc/89/15/03/456891503.db2.gz	WWMICRFVQVHSBK-SNPRPXQTSA-N	0	3	342.361	3.069	20	30		EGEDHN
CCO[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C2CCCC2)[C@]12CCCO2	ZINC000329545115	456906795	/nfs/dbraw/zinc/90/67/95/456906795.db2.gz	ZEUDZDIIBMLKKQ-IMBTUZDBSA-N	0	3	336.476	3.077	20	30		EGEDHN
CCN1C[C@H](C)N(Cc2ccc(OC)c(OCCCC#N)c2)C[C@H]1C	ZINC000353816449	456920323	/nfs/dbraw/zinc/92/03/23/456920323.db2.gz	MOJUQPFLTOOMAT-SJORKVTESA-N	0	3	345.487	3.292	20	30		EGEDHN
CO[C@@H]1CC[C@H](NC(=O)NC[C@@]2(C)CCCN2Cc2ccccc2)C1	ZINC000329911040	456959282	/nfs/dbraw/zinc/95/92/82/456959282.db2.gz	NPARIXBKZCLJRC-NLWGTHIKSA-N	0	3	345.487	3.112	20	30		EGEDHN
COc1cccc(CN(CCN(C)C)Cc2ccc(C#N)s2)c1	ZINC000349403503	456962476	/nfs/dbraw/zinc/96/24/76/456962476.db2.gz	BXXPBOOUJHFALH-UHFFFAOYSA-N	0	3	329.469	3.192	20	30		EGEDHN
CC(C)c1nnc(CCNC(=O)C(C#N)CCc2ccccc2)s1	ZINC000345664951	456986586	/nfs/dbraw/zinc/98/65/86/456986586.db2.gz	QMQVZUDBLHFLNZ-HNNXBMFYSA-N	0	3	342.468	3.093	20	30		EGEDHN
CC[C@@H](C)n1ncc(NC(=O)N2CC[C@H](N3CCCCC3)C2)c1C	ZINC000330133109	456989878	/nfs/dbraw/zinc/98/98/78/456989878.db2.gz	QWWJVNRXSMTYON-ZBFHGGJFSA-N	0	3	333.480	3.268	20	30		EGEDHN
C=CCC[C@H](NCC(=O)Nc1c(C)nn(C)c1C)c1ccccc1	ZINC000341922910	457003738	/nfs/dbraw/zinc/00/37/38/457003738.db2.gz	BLRUNXHUNQDHIE-KRWDZBQOSA-N	0	3	326.444	3.273	20	30		EGEDHN
O=C(CC1CCCC1)NC1CCN(C(=O)[C@H]2CCCN2C2CC2)CC1	ZINC000330214025	457004533	/nfs/dbraw/zinc/00/45/33/457004533.db2.gz	FWBMVYCQDVHHSV-GOSISDBHSA-N	0	3	347.503	3.141	20	30		EGEDHN
C=C[C@@H](C)NC(=O)[C@]1(C(F)(F)F)CCN(Cc2ccccc2)C1	ZINC000362613618	457004943	/nfs/dbraw/zinc/00/49/43/457004943.db2.gz	KUEPBJSTPFNGFF-CJNGLKHVSA-N	0	3	326.362	3.132	20	30		EGEDHN
N#Cc1ccnc(NCC2CCN(Cc3cccs3)CC2)c1Cl	ZINC000341935933	457012953	/nfs/dbraw/zinc/01/29/53/457012953.db2.gz	TUUPQBRBIZFELV-UHFFFAOYSA-N	0	3	346.887	3.414	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)c2cn(CCCC#N)c3ccccc23)CCN1C	ZINC000346104313	457016768	/nfs/dbraw/zinc/01/67/68/457016768.db2.gz	WOYZITDTBVYARL-HOTGVXAUSA-N	0	3	338.455	3.158	20	30		EGEDHN
CN(Cc1ccccc1N(C)C1CCN(C)CC1)CC(C)(C)C#N	ZINC000354041400	457026734	/nfs/dbraw/zinc/02/67/34/457026734.db2.gz	SWWSPXHWJHLWRE-UHFFFAOYSA-N	0	3	328.504	3.199	20	30		EGEDHN
CCN(CCN1CCCCCC1)C(=O)[C@H](C)Oc1ccccc1C#N	ZINC000346297123	457028839	/nfs/dbraw/zinc/02/88/39/457028839.db2.gz	NEBCQISOTGJDLX-KRWDZBQOSA-N	0	3	343.471	3.050	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@@H]1c1nc(-c2ccccc2OCCN(C)C)no1	ZINC000346396988	457039972	/nfs/dbraw/zinc/03/99/72/457039972.db2.gz	UTLQMRFDQQGHDA-DOTOQJQBSA-N	0	3	343.427	3.126	20	30		EGEDHN
C[C@H](NCCC(=O)N(C)CCC#N)c1ccccc1C(F)(F)F	ZINC000341990630	457045721	/nfs/dbraw/zinc/04/57/21/457045721.db2.gz	DITPTMDOAAHVEJ-LBPRGKRZSA-N	0	3	327.350	3.118	20	30		EGEDHN
CN(CC1CCN(c2ccncc2)CC1)C(=O)c1ccc(C#N)s1	ZINC000346594416	457064776	/nfs/dbraw/zinc/06/47/76/457064776.db2.gz	VEUJXSYKALIPTC-UHFFFAOYSA-N	0	3	340.452	3.003	20	30		EGEDHN
CC(C)c1ccc(C[C@H]2CCN([C@H](C)C(=O)N(C)CCC#N)C2)cc1	ZINC000359256497	457069250	/nfs/dbraw/zinc/06/92/50/457069250.db2.gz	FUXZJENCABYIGS-IEBWSBKVSA-N	0	3	341.499	3.435	20	30		EGEDHN
C[C@H]1[C@@H](NC(=O)c2cn(CCCC#N)c3ccccc23)CCCN1C	ZINC000346620232	457082397	/nfs/dbraw/zinc/08/23/97/457082397.db2.gz	RGVBGGZSSOTAGZ-YJBOKZPZSA-N	0	3	338.455	3.158	20	30		EGEDHN
CC[C@@H](C)N[C@@H](CNC(=O)c1ccc(CC#N)cc1)c1ccco1	ZINC000359536409	457092416	/nfs/dbraw/zinc/09/24/16/457092416.db2.gz	DYDJYZIQXMNUHI-PBHICJAKSA-N	0	3	325.412	3.205	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N(CCN(C)C)Cc1ccc(F)cc1)OCC	ZINC000339398582	457094264	/nfs/dbraw/zinc/09/42/64/457094264.db2.gz	CCVSPUAXFAGXIY-SFHVURJKSA-N	0	3	336.451	3.087	20	30		EGEDHN
Cc1nn(C)c2ncc(CN[C@H]3CCCc4cc(C#N)ccc43)cc12	ZINC000346724380	457132373	/nfs/dbraw/zinc/13/23/73/457132373.db2.gz	HAJUUTCCHKYBTL-IBGZPJMESA-N	0	3	331.423	3.316	20	30		EGEDHN
Cc1nc(CCNCc2cn(CCC#N)nc2-c2ccccc2)c(C)o1	ZINC000346831620	457179544	/nfs/dbraw/zinc/17/95/44/457179544.db2.gz	PRPAGNVRNHPUTQ-UHFFFAOYSA-N	0	3	349.438	3.401	20	30		EGEDHN
C[C@@H](O)[C@@H]1CCN(Cc2cccc(OCc3ccccc3C#N)c2)C1	ZINC000356919817	457219870	/nfs/dbraw/zinc/21/98/70/457219870.db2.gz	SCHJYYYFAUJDNF-VQIMIIECSA-N	0	3	336.435	3.340	20	30		EGEDHN
CC(C#N)C(=O)NC[C@@H](c1ccccc1)N1CCc2sccc2C1	ZINC000347084747	457222614	/nfs/dbraw/zinc/22/26/14/457222614.db2.gz	ZLPFWSIGTZVJPQ-YOEHRIQHSA-N	0	3	339.464	3.123	20	30		EGEDHN
CC(C#N)C(=O)N1CCO[C@@H](c2cc(F)c(Cl)cc2Cl)C1	ZINC000347138481	457251134	/nfs/dbraw/zinc/25/11/34/457251134.db2.gz	QXKZUPDOJBNULO-AMIZOPFISA-N	0	3	331.174	3.192	20	30		EGEDHN
C=CCOc1ccc(CN2CCC[C@@](CO)(C(C)C)C2)cc1OC	ZINC000354562164	457289493	/nfs/dbraw/zinc/28/94/93/457289493.db2.gz	IEAIWOSQKTXXBJ-HXUWFJFHSA-N	0	3	333.472	3.491	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H](C)[C@H]2OCCc3sccc32)CC1	ZINC000339998578	457319201	/nfs/dbraw/zinc/31/92/01/457319201.db2.gz	GROUECWJAINSGG-KBXCAEBGSA-N	0	3	348.512	3.155	20	30		EGEDHN
C=CCOCC(=O)N(CCC)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000354843125	457322760	/nfs/dbraw/zinc/32/27/60/457322760.db2.gz	QJBXQCDZEMBSIJ-LJQANCHMSA-N	0	3	330.472	3.092	20	30		EGEDHN
CCN(CCC#N)C(=O)CN(CCc1ccc(Cl)cc1)CC1CC1	ZINC000342491109	457333759	/nfs/dbraw/zinc/33/37/59/457333759.db2.gz	NIKOCYIZXHSNQR-UHFFFAOYSA-N	0	3	347.890	3.357	20	30		EGEDHN
C[C@H](C(=O)N(C)CCC#N)N1CCC[C@](C)(c2ccccc2)CC1	ZINC000352211314	457348700	/nfs/dbraw/zinc/34/87/00/457348700.db2.gz	JTQHBBUDKYRCJH-XLIONFOSSA-N	0	3	327.472	3.191	20	30		EGEDHN
N#CC[C@@H](CC(=O)NC[C@H]1CCCCN1C1CC1)c1ccccc1	ZINC000357154706	457349413	/nfs/dbraw/zinc/34/94/13/457349413.db2.gz	WCNGRYNZDLATLT-PKOBYXMFSA-N	0	3	325.456	3.207	20	30		EGEDHN
C=CCCC1(C(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)CC1	ZINC000357162454	457353567	/nfs/dbraw/zinc/35/35/67/457353567.db2.gz	VCFHDFFIGXGRJV-LJQANCHMSA-N	0	3	342.483	3.140	20	30		EGEDHN
C=CCCN[C@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1	ZINC000357186011	457364663	/nfs/dbraw/zinc/36/46/63/457364663.db2.gz	NPCFGAAAHMYOIL-GOSISDBHSA-N	0	3	333.428	3.484	20	30		EGEDHN
COc1ccc(C(=O)C(C#N)c2ccncn2)c(OCC(C)C)c1	ZINC000355548193	457386766	/nfs/dbraw/zinc/38/67/66/457386766.db2.gz	NAUYXTYAOKDKKC-HNNXBMFYSA-N	0	3	325.368	3.010	20	30		EGEDHN
C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)CSCc1ccc(C#N)cc1	ZINC000347402247	457403718	/nfs/dbraw/zinc/40/37/18/457403718.db2.gz	VSPABBGRAKEQCJ-CVEARBPZSA-N	0	3	345.512	3.028	20	30		EGEDHN
C=CCSCCNC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000357372658	457479467	/nfs/dbraw/zinc/47/94/67/457479467.db2.gz	KOSUDTGPFABREQ-SJLPKXTDSA-N	0	3	347.528	3.115	20	30		EGEDHN
CCN(Cc1cc(C(=O)OC)n(C)c1)[C@H](C)c1ccc(C#N)cc1	ZINC000347603442	457543212	/nfs/dbraw/zinc/54/32/12/457543212.db2.gz	CQLAGABXMJOFDP-CQSZACIVSA-N	0	3	325.412	3.266	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)N[C@@H](C)c1ccc(OC)c(OC)c1C	ZINC000347638434	457567781	/nfs/dbraw/zinc/56/77/81/457567781.db2.gz	JNQQARGRIGZTLD-HOTGVXAUSA-N	0	3	346.471	3.252	20	30		EGEDHN
CC[C@@H](C)N[C@H](CNC(=O)NCC(C)(C)CCC#N)c1ccco1	ZINC000357549286	457589560	/nfs/dbraw/zinc/58/95/60/457589560.db2.gz	USLGMINIMAUWPO-HUUCEWRRSA-N	0	3	334.464	3.338	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N2CC[C@@H](C)C[C@H]2C)cc1	ZINC000425663902	457626002	/nfs/dbraw/zinc/62/60/02/457626002.db2.gz	NIBDEKHFPGWINA-MCIONIFRSA-N	0	3	349.456	3.025	20	30		EGEDHN
CN(C)c1ccccc1CN(C)C(=O)C(C#N)CCc1ccccc1	ZINC000425973397	457750002	/nfs/dbraw/zinc/75/00/02/457750002.db2.gz	IMTLAHFQSAYXBV-GOSISDBHSA-N	0	3	335.451	3.484	20	30		EGEDHN
C=C[C@@H]1CCCCN1C(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1	ZINC000426062484	457768348	/nfs/dbraw/zinc/76/83/48/457768348.db2.gz	QDHOSGHFSIIBKM-YTQUADARSA-N	0	3	327.472	3.400	20	30		EGEDHN
Cc1cccc(N2CCN(C(=O)C(C#N)CCc3ccccc3)CC2)c1	ZINC000433217823	457783011	/nfs/dbraw/zinc/78/30/11/457783011.db2.gz	DPOFBGFVTOLBMG-FQEVSTJZSA-N	0	3	347.462	3.416	20	30		EGEDHN
C[C@H](CNC(=O)C(C#N)CCc1ccccc1)Oc1ccccc1F	ZINC000433379212	457824274	/nfs/dbraw/zinc/82/42/74/457824274.db2.gz	SVXSSUWMEZDVHT-WBVHZDCISA-N	0	3	340.398	3.482	20	30		EGEDHN
C[C@@H](CN(C)C(=O)C(C#N)CCc1ccccc1)c1nccs1	ZINC000433382795	457826316	/nfs/dbraw/zinc/82/63/16/457826316.db2.gz	PXJXBMFONFOPQL-HOCLYGCPSA-N	0	3	327.453	3.478	20	30		EGEDHN
C[C@H](NC(=O)C(C#N)CCc1ccccc1)[C@H]1COc2ccccc21	ZINC000433389413	457827827	/nfs/dbraw/zinc/82/78/27/457827827.db2.gz	XCTMRYQITQDPQO-VDZJLULYSA-N	0	3	334.419	3.440	20	30		EGEDHN
Cc1cc(CN[C@H](Cc2ccccc2)[C@@H](O)C(F)F)ccc1C#N	ZINC000443997517	457837864	/nfs/dbraw/zinc/83/78/64/457837864.db2.gz	MGBOAPTVEIRVKL-QZTJIDSGSA-N	0	3	330.378	3.194	20	30		EGEDHN
COc1ccc(C2(NCCC(=O)Nc3ccccc3C#N)CC2)cc1	ZINC000411466165	457895670	/nfs/dbraw/zinc/89/56/70/457895670.db2.gz	ZEXYBFKOULMSIC-UHFFFAOYSA-N	0	3	335.407	3.174	20	30		EGEDHN
CN(CC(C)(C)C#N)C(=O)NCC1CCN(Cc2cccs2)CC1	ZINC000458098547	457931525	/nfs/dbraw/zinc/93/15/25/457931525.db2.gz	JRNZDIFPJMIYDZ-UHFFFAOYSA-N	0	3	348.516	3.151	20	30		EGEDHN
C=CCN(C)CCN(CC)[C@@H](C)C(=O)Nc1c(C)cc(C)cc1C	ZINC000411635745	457935199	/nfs/dbraw/zinc/93/51/99/457935199.db2.gz	CCFDWXFHFXZKLE-SFHVURJKSA-N	0	3	331.504	3.379	20	30		EGEDHN
C=CCN(Cc1cccc(C#N)c1)C(=O)[C@H](C)N1[C@@H](C)CC[C@@H]1C	ZINC000411713003	457959270	/nfs/dbraw/zinc/95/92/70/457959270.db2.gz	VNAPTGZHXRDQNZ-ULQDDVLXSA-N	0	3	325.456	3.334	20	30		EGEDHN
Cc1cc(CN(C)CCC(=O)Nc2ccc(C#N)cc2)ccc1F	ZINC000444744325	457961424	/nfs/dbraw/zinc/96/14/24/457961424.db2.gz	MCHSRPIZOVJAGE-UHFFFAOYSA-N	0	3	325.387	3.466	20	30		EGEDHN
C=CCC[C@@H](C(=O)NC[C@@]1(N(C)C)CCSC1)c1ccccc1	ZINC000427251262	457968217	/nfs/dbraw/zinc/96/82/17/457968217.db2.gz	RWXDLUVOPCXRNH-MJGOQNOKSA-N	0	3	332.513	3.290	20	30		EGEDHN
C=CC[C@H]1N(CCn2cnc3ccccc3c2=O)CCCC1(C)C	ZINC000444777450	457974305	/nfs/dbraw/zinc/97/43/05/457974305.db2.gz	FSJVZLOBRWFBJR-GOSISDBHSA-N	0	3	325.456	3.463	20	30		EGEDHN
CC1(C)CCCN(CCNC(=O)Nc2ccc(C#N)c(Cl)c2)C1	ZINC000444818392	457984996	/nfs/dbraw/zinc/98/49/96/457984996.db2.gz	OBOFOBUTMUJVFB-UHFFFAOYSA-N	0	3	334.851	3.455	20	30		EGEDHN
CN(C)CCOc1ccc(NC(=O)[C@@]2(C#N)CC23CCCC3)cc1F	ZINC000458281836	457999922	/nfs/dbraw/zinc/99/99/22/457999922.db2.gz	VCALTKXCALQDBD-IBGZPJMESA-N	0	3	345.418	3.179	20	30		EGEDHN
CN(C)CCOc1ccc(NC(=O)C2(C#N)CCCCC2)cc1F	ZINC000458305501	458006845	/nfs/dbraw/zinc/00/68/45/458006845.db2.gz	ZUINJPNEEWHVJA-UHFFFAOYSA-N	0	3	333.407	3.179	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCc3ccc(F)c(F)c32)CC1	ZINC000458325982	458012709	/nfs/dbraw/zinc/01/27/09/458012709.db2.gz	SYESZSHPKWMSTR-UHFFFAOYSA-N	0	3	335.398	3.077	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN(C)[C@H]2CCN(CC)[C@@H](C)C2)c1C	ZINC000362252383	458056246	/nfs/dbraw/zinc/05/62/46/458056246.db2.gz	PLAVQZTYVFQJJP-YJBOKZPZSA-N	0	3	331.504	3.278	20	30		EGEDHN
C=C[C@H]1CCCCN1C(=O)CCN1CCN(c2cccc(C)c2)CC1	ZINC000428042513	458070791	/nfs/dbraw/zinc/07/07/91/458070791.db2.gz	CGGJBMUMGIPWEZ-IBGZPJMESA-N	0	3	341.499	3.074	20	30		EGEDHN
CC(C)N1CC[C@H](N(C)C(=O)N[C@@H](CCC#N)c2ccccc2)C1	ZINC000458579459	458099805	/nfs/dbraw/zinc/09/98/05/458099805.db2.gz	NJXVJAGTYIIFLD-ROUUACIJSA-N	0	3	328.460	3.156	20	30		EGEDHN
C=C(CC)CN1CCC(C(=O)c2ccc3c(c2)NC(=O)[C@@H](C)O3)CC1	ZINC000358610898	458107385	/nfs/dbraw/zinc/10/73/85/458107385.db2.gz	GWUXASZMJDTFGW-CQSZACIVSA-N	0	3	342.439	3.267	20	30		EGEDHN
C=C(C)[C@@H](NC(=O)NC(C)(C)CN(C)C)c1ccc(F)c(F)c1	ZINC000458668090	458129692	/nfs/dbraw/zinc/12/96/92/458129692.db2.gz	KBRIWYNBLIFDBC-OAHLLOKOSA-N	0	3	325.403	3.221	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@H]2c2ccc(F)c(F)c2)CC1	ZINC000369285024	458156942	/nfs/dbraw/zinc/15/69/42/458156942.db2.gz	MTWUVUMICNSNHN-SFHVURJKSA-N	0	3	349.425	3.462	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)N(C)C[C@@H](C)C#N)N(CC)CC)cc1	ZINC000458790218	458171469	/nfs/dbraw/zinc/17/14/69/458171469.db2.gz	IBDSYNLNYIQQIW-LPHOPBHVSA-N	0	3	344.503	3.433	20	30		EGEDHN
N#CCCCn1cc(C(=O)NCCN2CCCCC2)c2ccccc21	ZINC000435786358	458204951	/nfs/dbraw/zinc/20/49/51/458204951.db2.gz	HPNUURUUWMXFSY-UHFFFAOYSA-N	0	3	338.455	3.161	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCc2ccc(-c3ccccc3)o2)CC1	ZINC000358786242	458217164	/nfs/dbraw/zinc/21/71/64/458217164.db2.gz	KUAXYZSOBTYRDM-UHFFFAOYSA-N	0	3	339.439	3.396	20	30		EGEDHN
N#CCc1ccc(C(=O)NC[C@@H]2CCCN(Cc3ccccc3)C2)cc1	ZINC000372291435	458266549	/nfs/dbraw/zinc/26/65/49/458266549.db2.gz	KVIPEHCMPHUVKQ-FQEVSTJZSA-N	0	3	347.462	3.395	20	30		EGEDHN
C[C@@H]1CN(c2cccc3cnccc32)CCN1CCCSCC#N	ZINC000447391996	458292532	/nfs/dbraw/zinc/29/25/32/458292532.db2.gz	AJAVYADZWFIXSK-MRXNPFEDSA-N	0	3	340.496	3.392	20	30		EGEDHN
N#Cc1cnc(NC[C@@H]2CCCN(Cc3cccs3)C2)c(F)c1	ZINC000413112737	458293129	/nfs/dbraw/zinc/29/31/29/458293129.db2.gz	XTNLRMFOBZYRKN-ZDUSSCGKSA-N	0	3	330.432	3.478	20	30		EGEDHN
Cc1cc(NCCCCN2C[C@H](C)O[C@@H](C)C2)c(C#N)cc1[N+](=O)[O-]	ZINC000413180621	458294347	/nfs/dbraw/zinc/29/43/47/458294347.db2.gz	DKGHUGGBJDQNIJ-GJZGRUSLSA-N	0	3	346.431	3.076	20	30		EGEDHN
CN1CCC(N(Cc2ccccc2)C(=O)NCC(C)(C)CC#N)CC1	ZINC000459257943	458304033	/nfs/dbraw/zinc/30/40/33/458304033.db2.gz	LAUSMODUISBWLS-UHFFFAOYSA-N	0	3	342.487	3.232	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NC(=O)N(C)[C@H]1CCN(C)C[C@H]1C	ZINC000413834741	458309305	/nfs/dbraw/zinc/30/93/05/458309305.db2.gz	MLCDQABEAFZAJX-QRQLOZEOSA-N	0	3	329.488	3.155	20	30		EGEDHN
COC(=O)[C@@]1(C)CCCN(Cc2cccc(OCCCC#N)c2)C1	ZINC000414562781	458324379	/nfs/dbraw/zinc/32/43/79/458324379.db2.gz	VJOOZOBLSHILBZ-IBGZPJMESA-N	0	3	330.428	3.144	20	30		EGEDHN
COc1cc(CN2CCNC[C@@H]2c2ccccc2Cl)ccc1C#N	ZINC000414740697	458325506	/nfs/dbraw/zinc/32/55/06/458325506.db2.gz	RJTKUQOKDCJAEP-GOSISDBHSA-N	0	3	341.842	3.367	20	30		EGEDHN
C[C@@H](NC(C)(C)CNC(=O)NCC1(C#N)CCC1)c1ccccc1	ZINC000419454653	458382504	/nfs/dbraw/zinc/38/25/04/458382504.db2.gz	UMTGPYPTZJZHGY-OAHLLOKOSA-N	0	3	328.460	3.109	20	30		EGEDHN
C=CCN(CCc1ccco1)C(=O)NC[C@@H]1N(C)CCCC1(C)C	ZINC000448250920	458399243	/nfs/dbraw/zinc/39/92/43/458399243.db2.gz	ZKHQGWOVFXYGJU-KRWDZBQOSA-N	0	3	333.476	3.140	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CN[C@@H](CC(F)F)c2ccccc2)cc1	ZINC000420990084	458405535	/nfs/dbraw/zinc/40/55/35/458405535.db2.gz	ZSUNRHILUJMUML-WMZOPIPTSA-N	0	3	346.377	3.284	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)NC[C@@H](c1ccccc1)N1CCC(C)CC1	ZINC000448767229	458408783	/nfs/dbraw/zinc/40/87/83/458408783.db2.gz	JTHPLWJRDXXQHR-AABGKKOBSA-N	0	3	342.483	3.167	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C2CC(O)(CCC(C)(C)C)C2)CC1	ZINC000448920736	458415965	/nfs/dbraw/zinc/41/59/65/458415965.db2.gz	IUTZDQPRPXAHAF-UHFFFAOYSA-N	0	3	336.520	3.111	20	30		EGEDHN
C=CCOc1ccc(CN2CC[C@@H]3C[C@@H](O)CC[C@H]3C2)cc1OC	ZINC000449555459	458427162	/nfs/dbraw/zinc/42/71/62/458427162.db2.gz	QHUYOXXGLYWERY-SQNIBIBYSA-N	0	3	331.456	3.243	20	30		EGEDHN
C=CCOc1ccc(CN2CC[C@@H]3C[C@H](O)CC[C@H]3C2)cc1OC	ZINC000449555456	458427228	/nfs/dbraw/zinc/42/72/28/458427228.db2.gz	QHUYOXXGLYWERY-FGTMMUONSA-N	0	3	331.456	3.243	20	30		EGEDHN
Cc1cc(CN[C@@H]2C[C@@H](OC(C)(C)C)[C@H]2n2cccn2)ccc1C#N	ZINC000449657467	458428280	/nfs/dbraw/zinc/42/82/80/458428280.db2.gz	PEMQQFNSJNKBDT-QRVBRYPASA-N	0	3	338.455	3.350	20	30		EGEDHN
C=CCc1ccc(OCC(=O)Nc2ccc3c(c2)CNC3)c(OC)c1	ZINC000449667606	458428567	/nfs/dbraw/zinc/42/85/67/458428567.db2.gz	RGUPVJSJEUJTKJ-UHFFFAOYSA-N	0	3	338.407	3.044	20	30		EGEDHN
Cc1cc(CN2CC[C@H](C(=O)N(C)c3ccccc3)C2)ccc1C#N	ZINC000430288138	458436873	/nfs/dbraw/zinc/43/68/73/458436873.db2.gz	CRPWPBLONXBQRZ-IBGZPJMESA-N	0	3	333.435	3.352	20	30		EGEDHN
CC(C)(C)c1cnc(C(C#N)C(=O)c2ccc(NC(N)=O)cc2)s1	ZINC000430622036	458473063	/nfs/dbraw/zinc/47/30/63/458473063.db2.gz	FCLLNMGIOHNMSE-LBPRGKRZSA-N	0	3	342.424	3.421	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCOC[C@H]1[C@@H]1CCCN1C(=O)OC(C)(C)C	ZINC000373422613	458488628	/nfs/dbraw/zinc/48/86/28/458488628.db2.gz	OOUCXCBTALJHRH-KFWWJZLASA-N	0	3	344.883	3.133	20	30		EGEDHN
C=CCN1CCC(N[C@@H](c2nccn2C)c2ccc(Cl)cc2)CC1	ZINC000453092291	458518539	/nfs/dbraw/zinc/51/85/39/458518539.db2.gz	DHQLGKVHSHEDKX-GOSISDBHSA-N	0	3	344.890	3.403	20	30		EGEDHN
C=C(C)Cn1c([C@@H]2CC[C@H](C)O2)nnc1N1C[C@H](C)N(CC)C[C@H]1C	ZINC000453462644	458533521	/nfs/dbraw/zinc/53/35/21/458533521.db2.gz	PNHBDOIKXZLLRB-YVSFHVDLSA-N	0	3	347.507	3.013	20	30		EGEDHN
CCOc1cccc2cc([C@H](C)NC(=O)[C@H](N)CCCC#N)oc21	ZINC000424063839	458549385	/nfs/dbraw/zinc/54/93/85/458549385.db2.gz	JGAMQANIZOXDPG-GXTWGEPZSA-N	0	3	329.400	3.030	20	30		EGEDHN
Cc1ccc(CCC2CCN(C(=O)[C@H](N)CCCC#N)CC2)cc1	ZINC000424072746	458550375	/nfs/dbraw/zinc/55/03/75/458550375.db2.gz	YXYQUNRXCXJOAA-LJQANCHMSA-N	0	3	327.472	3.187	20	30		EGEDHN
C=CC(C)(C)CNC(=O)NCc1ccc(OCCN2CCCC2)cc1	ZINC000454484263	458563781	/nfs/dbraw/zinc/56/37/81/458563781.db2.gz	LGTGVIZGKSQQDR-UHFFFAOYSA-N	0	3	345.487	3.173	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N(Cc1cc(F)ccc1F)C1CCCC1	ZINC000424126176	458565146	/nfs/dbraw/zinc/56/51/46/458565146.db2.gz	SLXOUWOTJOQHFP-QGZVFWFLSA-N	0	3	335.398	3.257	20	30		EGEDHN
CCc1cccc(Oc2ccc(NC(=O)[C@@H](N)CCCC#N)cn2)c1	ZINC000424132919	458566916	/nfs/dbraw/zinc/56/69/16/458566916.db2.gz	LHCYQAUXLJXMMC-KRWDZBQOSA-N	0	3	338.411	3.396	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)NCC1(Sc2ccccc2)CCCC1	ZINC000424135168	458567508	/nfs/dbraw/zinc/56/75/08/458567508.db2.gz	IYXLLEFHPICWOB-INIZCTEOSA-N	0	3	331.485	3.229	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N1CCC(c2nc3ccccc3s2)CC1	ZINC000424135465	458568297	/nfs/dbraw/zinc/56/82/97/458568297.db2.gz	MKJOQFOYRNSPDK-AWEZNQCLSA-N	0	3	342.468	3.023	20	30		EGEDHN
Cc1cccc(C)c1OC[C@@H](NC(=O)[C@H](N)CCCC#N)C(C)(C)C	ZINC000424145869	458569944	/nfs/dbraw/zinc/56/99/44/458569944.db2.gz	ZTNWCXUFUFECDA-IAGOWNOFSA-N	0	3	345.487	3.234	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](CN)c2ccc3ccccc3c2)CCOCC1	ZINC000424163782	458574840	/nfs/dbraw/zinc/57/48/40/458574840.db2.gz	VYXTYXLPIVQDKM-IBGZPJMESA-N	0	3	338.451	3.329	20	30		EGEDHN
COc1cc(CN[C@@H]2CC[C@H](C#N)C2)cc(OC)c1OCC(F)F	ZINC000424194025	458581974	/nfs/dbraw/zinc/58/19/74/458581974.db2.gz	ABUZSJXTPMPVBM-WCQYABFASA-N	0	3	340.370	3.130	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N[C@@H]1CCc2ccc(-c3ccccc3)cc21	ZINC000424195655	458583370	/nfs/dbraw/zinc/58/33/70/458583370.db2.gz	YFXMBNIVBBIMSJ-VQTJNVASSA-N	0	3	333.435	3.478	20	30		EGEDHN
C=CCC[C@H](C(=O)NCCCN1CCCO[C@H](C)C1)c1ccccc1	ZINC000470095428	458611445	/nfs/dbraw/zinc/61/14/45/458611445.db2.gz	ZHKBTTDPZMFYNO-QUCCMNQESA-N	0	3	344.499	3.354	20	30		EGEDHN
CC#CCN(C)C(=O)Nc1cc(Cl)ccc1OC1CCN(C)CC1	ZINC000455950982	458624279	/nfs/dbraw/zinc/62/42/79/458624279.db2.gz	YXVMFUNXLHMAAS-UHFFFAOYSA-N	0	3	349.862	3.300	20	30		EGEDHN
Cc1cc(C#N)cc(NC(=O)NCC2CCN(c3ccncc3)CC2)c1	ZINC000455961429	458624817	/nfs/dbraw/zinc/62/48/17/458624817.db2.gz	ZELSQNKETXGQDK-UHFFFAOYSA-N	0	3	349.438	3.300	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCc1ccnc(C(F)(F)F)c1	ZINC000456045645	458629564	/nfs/dbraw/zinc/62/95/64/458629564.db2.gz	OGEGQYFRPPGVBK-OAHLLOKOSA-N	0	3	347.340	3.489	20	30		EGEDHN
C=Cc1ccc(CCNC(=O)C(C#N)Cc2ccc(C#N)cc2)cc1	ZINC000462574305	458631900	/nfs/dbraw/zinc/63/19/00/458631900.db2.gz	QEXZPPXYZBRDNM-HXUWFJFHSA-N	0	3	329.403	3.242	20	30		EGEDHN
CC[C@H](Cc1ccc(C)cc1)N(C)CC(=O)N(CC)C[C@H](C)C#N	ZINC000470368392	458632531	/nfs/dbraw/zinc/63/25/31/458632531.db2.gz	BIOSZBBZCYEICP-IEBWSBKVSA-N	0	3	329.488	3.256	20	30		EGEDHN
CO[C@@](C)(CNC(=O)C(C#N)CCc1ccccc1)c1ccccc1	ZINC000456139138	458633022	/nfs/dbraw/zinc/63/30/22/458633022.db2.gz	ZFRONGTZZKPSAB-NQIIRXRSSA-N	0	3	336.435	3.437	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN1CC[C@@H](CSc2ccccc2)C1	ZINC000464762495	458769900	/nfs/dbraw/zinc/76/99/00/458769900.db2.gz	WDROVOCJKNPQGC-QGZVFWFLSA-N	0	3	330.497	3.301	20	30		EGEDHN
CCN(C[C@H]1CCN(Cc2ccccc2)C1)C(=O)NCC(C)(C)C#N	ZINC000512793441	458788846	/nfs/dbraw/zinc/78/88/46/458788846.db2.gz	UPKZUUWLVMZTSW-SFHVURJKSA-N	0	3	342.487	3.090	20	30		EGEDHN
C=C(C)CN(C)C(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000512911037	458790359	/nfs/dbraw/zinc/79/03/59/458790359.db2.gz	BKFBLCJIZYJWJN-GOSISDBHSA-N	0	3	333.476	3.294	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Nc1nc2c(s1)CCC2)C(C)C	ZINC000514823723	458801144	/nfs/dbraw/zinc/80/11/44/458801144.db2.gz	KMWGEYBXVPZXBE-OAHLLOKOSA-N	0	3	348.516	3.452	20	30		EGEDHN
CN(CC(=O)NC1(C#N)CCCCC1)[C@H]1CC[C@@H](C(F)(F)F)CC1	ZINC000516211444	458816261	/nfs/dbraw/zinc/81/62/61/458816261.db2.gz	WCJJNMCWCJECOA-OKILXGFUSA-N	0	3	345.409	3.382	20	30		EGEDHN
CN(CC(=O)N[C@](C)(C#N)C1CC1)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000516417113	458817715	/nfs/dbraw/zinc/81/77/15/458817715.db2.gz	XPPRZDOJMYLEFP-SFHLNBCPSA-N	0	3	339.483	3.453	20	30		EGEDHN
C=CCCCCNC(=O)N(CCN(C)C)Cc1ccc(F)cc1F	ZINC000474095015	458860397	/nfs/dbraw/zinc/86/03/97/458860397.db2.gz	KEWIIOGSNYIVQR-UHFFFAOYSA-N	0	3	339.430	3.394	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CCC=C(c2cccnc2)C1	ZINC000518394697	458864172	/nfs/dbraw/zinc/86/41/72/458864172.db2.gz	WUZURVPIOTUQKD-SFHVURJKSA-N	0	3	331.419	3.470	20	30		EGEDHN
C=C(CN(C)C)C(=O)Nc1cccc(CN(C)C(=O)OC(C)(C)C)c1	ZINC000495509009	458871262	/nfs/dbraw/zinc/87/12/62/458871262.db2.gz	JNXISZCLDGBVTO-UHFFFAOYSA-N	0	3	347.459	3.110	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@H](C1CC1)C(C)(C)CO	ZINC000550103188	458884828	/nfs/dbraw/zinc/88/48/28/458884828.db2.gz	ZRXUQDMAZIQTCO-GOSISDBHSA-N	0	3	348.512	3.290	20	30		EGEDHN
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NCC#Cc1ccc(F)cc1	ZINC000551418025	458888683	/nfs/dbraw/zinc/88/86/83/458888683.db2.gz	AGUYNWRBFZVXBJ-UZLBHIALSA-N	0	3	339.410	3.187	20	30		EGEDHN
CN(CC#Cc1ccccc1Cl)C1CCN(c2cccnn2)CC1	ZINC000441220634	458903289	/nfs/dbraw/zinc/90/32/89/458903289.db2.gz	CVUDEKVPJCSNGD-UHFFFAOYSA-N	0	3	340.858	3.082	20	30		EGEDHN
CC1CC(C#N)(C(=O)NC[C@H]2CCCN(Cc3cccs3)C2)C1	ZINC000531554960	458934575	/nfs/dbraw/zinc/93/45/75/458934575.db2.gz	PLNHUFJRECXNLI-SWKXRBFHSA-N	0	3	331.485	3.016	20	30		EGEDHN
C=CCc1cc(C(=O)Nc2cc(C)cc(CN)c2)cc(OC)c1OC	ZINC000457389190	458939556	/nfs/dbraw/zinc/93/95/56/458939556.db2.gz	ZYBMBJQNBUHKKE-UHFFFAOYSA-N	0	3	340.423	3.452	20	30		EGEDHN
C[C@@H](CNC(=O)N1CCC(CCC#N)CC1)N(C)Cc1ccccc1	ZINC000519537086	458958232	/nfs/dbraw/zinc/95/82/32/458958232.db2.gz	HEBKXUBQTRPKFH-KRWDZBQOSA-N	0	3	342.487	3.232	20	30		EGEDHN
C[C@H](NCC(=O)NC1(C#N)CCC1)c1ccc(F)c2ccccc21	ZINC000566643005	458975504	/nfs/dbraw/zinc/97/55/04/458975504.db2.gz	VNLUHYQCQPAWCS-ZDUSSCGKSA-N	0	3	325.387	3.192	20	30		EGEDHN
CC(C)Oc1ccc([C@@H](CNC(=O)C2(C#N)CC(C)C2)N(C)C)cc1	ZINC000577093454	458979134	/nfs/dbraw/zinc/97/91/34/458979134.db2.gz	MZLGWRUQUNIUEA-RVSXGSNBSA-N	0	3	343.471	3.133	20	30		EGEDHN
CC(C)CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(C)C)C1=O	ZINC000566777315	458997791	/nfs/dbraw/zinc/99/77/91/458997791.db2.gz	LJFZZYVRUKMUTL-LJQANCHMSA-N	0	3	327.472	3.416	20	30		EGEDHN
CCN(Cc1ccc(C(=O)Nc2cc(CC#N)ccn2)cc1)C1CC1	ZINC000531925458	459002416	/nfs/dbraw/zinc/00/24/16/459002416.db2.gz	LBNCAXUCIIRZPT-UHFFFAOYSA-N	0	3	334.423	3.384	20	30		EGEDHN
C[C@@H]1CCN(CC(=O)NCc2cccc(C#N)c2)[C@H]2CCCC[C@@H]12	ZINC000520172947	459035414	/nfs/dbraw/zinc/03/54/14/459035414.db2.gz	WESMOLOTVJXEMO-MNEFBYGVSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@@H]1CCN(CC(=O)NCc2cccc(C#N)c2)[C@@H]2CCCC[C@H]12	ZINC000520172944	459036052	/nfs/dbraw/zinc/03/60/52/459036052.db2.gz	WESMOLOTVJXEMO-ATZDWAIDSA-N	0	3	325.456	3.075	20	30		EGEDHN
Cc1ccc([C@@H]2C[C@@H](C)N([C@H](C)C(=O)NC3(C#N)CCC3)C2)cc1	ZINC000567049870	459040999	/nfs/dbraw/zinc/04/09/99/459040999.db2.gz	CELFGAWMVKMTRC-JFIYKMOQSA-N	0	3	325.456	3.124	20	30		EGEDHN
COC(=O)c1csc(-c2cccc(CN[C@H]3CC[C@@H](C#N)C3)c2)n1	ZINC000442859205	459046835	/nfs/dbraw/zinc/04/68/35/459046835.db2.gz	QHFMTWRPTCHVJI-DOMZBBRYSA-N	0	3	341.436	3.379	20	30		EGEDHN
N#C[C@@H]1CC[C@H](NCCOc2ncc(C(F)(F)F)cc2Cl)C1	ZINC000442879402	459049631	/nfs/dbraw/zinc/04/96/31/459049631.db2.gz	VRIGPDBWVAZYFS-KOLCDFICSA-N	0	3	333.741	3.414	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC2(CC(NCc3ccc(C#N)s3)C2)C1	ZINC000496097679	459065593	/nfs/dbraw/zinc/06/55/93/459065593.db2.gz	ADEZGNFWMBXMDU-UHFFFAOYSA-N	0	3	333.457	3.109	20	30		EGEDHN
CC(C#N)C(=O)N1CCC(C)(c2ccc(Br)cc2)CC1	ZINC000442976506	459070013	/nfs/dbraw/zinc/07/00/13/459070013.db2.gz	XELKZPDLGHLIHB-GFCCVEGCSA-N	0	3	335.245	3.489	20	30		EGEDHN
C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NCc1cc(C#N)ccc1F	ZINC000496144524	459086192	/nfs/dbraw/zinc/08/61/92/459086192.db2.gz	YMVMMVJHEYAQOD-SUMWQHHRSA-N	0	3	347.434	3.432	20	30		EGEDHN
N#Cc1cnn2cc(CN(Cc3ccccc3)CC3CCC3)cnc12	ZINC000567471978	459111766	/nfs/dbraw/zinc/11/17/66/459111766.db2.gz	IDEULOYYSOCVMF-UHFFFAOYSA-N	0	3	331.423	3.403	20	30		EGEDHN
C=CC[C@@H](C)[C@H](C)Nc1ccc2nc(CCN3CCOCC3)[nH]c2c1	ZINC000558274278	459143577	/nfs/dbraw/zinc/14/35/77/459143577.db2.gz	QDGYSHMGJGNNCF-CVEARBPZSA-N	0	3	342.487	3.450	20	30		EGEDHN
CC(C)(C)OC(=O)NC1C[C@H]2CC[C@@H](C1)C2NCc1ccc(C#N)o1	ZINC000496374857	459169639	/nfs/dbraw/zinc/16/96/39/459169639.db2.gz	FGMMUPVYZVWFSG-HFZWIWRYSA-N	0	3	345.443	3.323	20	30		EGEDHN
N#CCN1CCC(NCc2cnc(CCc3ccccc3)s2)CC1	ZINC000590645812	459171658	/nfs/dbraw/zinc/17/16/58/459171658.db2.gz	SBCJACFWEATWNU-UHFFFAOYSA-N	0	3	340.496	3.006	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H](CNCc2ccc(C#N)o2)C1	ZINC000496388183	459174934	/nfs/dbraw/zinc/17/49/34/459174934.db2.gz	RMWMVMFLXCJPDJ-ZIAGYGMSSA-N	0	3	333.432	3.324	20	30		EGEDHN
CN(Cc1ccccc1)[C@H]1CCN(C(=O)[C@@]2(C#N)CC23CCCC3)C1	ZINC000590671443	459177664	/nfs/dbraw/zinc/17/76/64/459177664.db2.gz	SMGBOSBFQYLXAL-RXVVDRJESA-N	0	3	337.467	3.193	20	30		EGEDHN
CC[C@H](C)N1CCN(c2c(C#N)cnc3c(F)ccc(F)c32)CC1	ZINC000590725992	459194487	/nfs/dbraw/zinc/19/44/87/459194487.db2.gz	FKEAURJKMYYWQZ-LBPRGKRZSA-N	0	3	330.382	3.305	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC12CCN(CCCSCC#N)CC2	ZINC000496548427	459236270	/nfs/dbraw/zinc/23/62/70/459236270.db2.gz	LYVGZEGABHWRCJ-UHFFFAOYSA-N	0	3	339.505	3.109	20	30		EGEDHN
C[C@H](NC(=O)[C@]1(C#N)CC12CCCC2)[C@H](c1ccccc1)N(C)C	ZINC000579076090	459242655	/nfs/dbraw/zinc/24/26/55/459242655.db2.gz	UGDVUWKSHZICPL-XAUMDUMWSA-N	0	3	325.456	3.268	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCCCSc1ccccn1	ZINC000579483740	459246959	/nfs/dbraw/zinc/24/69/59/459246959.db2.gz	USVXVUVDRDJDDA-QGZVFWFLSA-N	0	3	339.464	3.453	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CCO[C@H](c2ccccc2)C1	ZINC000559271591	459248074	/nfs/dbraw/zinc/24/80/74/459248074.db2.gz	LETLSZXRFRIRPB-UXHICEINSA-N	0	3	334.419	3.359	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CNCc1sc(C)nc1C	ZINC000580183099	459257027	/nfs/dbraw/zinc/25/70/27/459257027.db2.gz	SYDPRXJJIHXKIJ-MRXNPFEDSA-N	0	3	332.469	3.018	20	30		EGEDHN
CCN(CCOC)c1cccc(CN2CCC(CCC#N)CC2)n1	ZINC000580547836	459261353	/nfs/dbraw/zinc/26/13/53/459261353.db2.gz	XTDGLVZHOTZBHB-UHFFFAOYSA-N	0	3	330.476	3.070	20	30		EGEDHN
OC[C@H](NCC#Cc1ccc(OC(F)(F)F)cc1)C1CCCC1	ZINC000580803459	459264567	/nfs/dbraw/zinc/26/45/67/459264567.db2.gz	QRDOILVNVOMBQA-INIZCTEOSA-N	0	3	327.346	3.077	20	30		EGEDHN
Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@H]2NCC2(CC#N)CC2)cc1	ZINC000581980372	459286252	/nfs/dbraw/zinc/28/62/52/459286252.db2.gz	SYTXNUHVLUCIPB-MSOLQXFVSA-N	0	3	346.496	3.363	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN(C)C[C@H](C)Cc1ccc(OC)cc1	ZINC000534170308	459297117	/nfs/dbraw/zinc/29/71/17/459297117.db2.gz	YKABCDADHRBRDC-QGZVFWFLSA-N	0	3	332.488	3.230	20	30		EGEDHN
N#C[C@@H]1CC[C@@H](NCc2ccc(N3CCc4ccccc4C3)nc2)C1	ZINC000582101209	459306340	/nfs/dbraw/zinc/30/63/40/459306340.db2.gz	UHWUCOFEQJNKNB-OXQOHEQNSA-N	0	3	332.451	3.426	20	30		EGEDHN
N#CCC1CCN(C(=O)NCCN2CCC3(CCCCC3)CC2)CC1	ZINC000582294587	459341615	/nfs/dbraw/zinc/34/16/15/459341615.db2.gz	APYOVCCJAJFVQA-UHFFFAOYSA-N	0	3	346.519	3.368	20	30		EGEDHN
C=CCc1ccc(OC[C@@H](O)CN2CCC(C)=C(C)C2)c(OC)c1	ZINC000483385264	459365014	/nfs/dbraw/zinc/36/50/14/459365014.db2.gz	OUNOFSANUOAGKY-SFHVURJKSA-N	0	3	331.456	3.206	20	30		EGEDHN
C=CC[C@H](C)[C@@H](C)NCc1ccc(S(=O)(=O)N(CC)CC)s1	ZINC000539083312	459374945	/nfs/dbraw/zinc/37/49/45/459374945.db2.gz	LLILZHSXJPVDAS-UONOGXRCSA-N	0	3	344.546	3.469	20	30		EGEDHN
Cn1ccnc1[C@@H](NC1CCN(c2ccc(C#N)cc2)CC1)C1CC1	ZINC000560575170	459375005	/nfs/dbraw/zinc/37/50/05/459375005.db2.gz	VMTLRVFAUSCEBO-IBGZPJMESA-N	0	3	335.455	3.001	20	30		EGEDHN
C=CC1CCN(C(=O)N[C@@H]2CCN([C@@H](C)c3ccccc3)C2)CC1	ZINC000524640389	459377700	/nfs/dbraw/zinc/37/77/00/459377700.db2.gz	OLQRMVOVUMCRFS-QFBILLFUSA-N	0	3	327.472	3.430	20	30		EGEDHN
CC(C)CN1CCCC[C@H]1CNC(=O)c1cc(C#N)ccc1Cl	ZINC000560601544	459378775	/nfs/dbraw/zinc/37/87/75/459378775.db2.gz	RPJBDRJMSZDTNY-HNNXBMFYSA-N	0	3	333.863	3.452	20	30		EGEDHN
C=CCCC[C@H](C)NC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000540573023	459382024	/nfs/dbraw/zinc/38/20/24/459382024.db2.gz	URJNDWZWLZAWAE-KRWDZBQOSA-N	0	3	342.487	3.376	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1ccccc1SCC(F)(F)F	ZINC000591593237	459409004	/nfs/dbraw/zinc/40/90/04/459409004.db2.gz	XZQHONBJZVXQKO-SNVBAGLBSA-N	0	3	331.363	3.301	20	30		EGEDHN
C=CCCSCCNC(=O)N1CCCN(Cc2ccccc2)CC1	ZINC000595722789	459413498	/nfs/dbraw/zinc/41/34/98/459413498.db2.gz	JPCMITIQZLRHOU-UHFFFAOYSA-N	0	3	347.528	3.213	20	30		EGEDHN
N#CCC[C@@H](NC[C@H](O)COc1ccccc1F)c1ccccc1	ZINC000561189947	459429127	/nfs/dbraw/zinc/42/91/27/459429127.db2.gz	BDHGYAJDSSJMGV-FUHWJXTLSA-N	0	3	328.387	3.200	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN[C@@H]2CCCc3ccc(F)cc32)cc1	ZINC000591763975	459431791	/nfs/dbraw/zinc/43/17/91/459431791.db2.gz	ADNKEPLIVFVJKE-YLJYHZDGSA-N	0	3	340.398	3.104	20	30		EGEDHN
CN(C)[C@@H](CNc1nccc(C#N)c1Cl)c1ccc(Cl)cc1	ZINC000561261902	459437134	/nfs/dbraw/zinc/43/71/34/459437134.db2.gz	JSNHNBYRZZTEKT-AWEZNQCLSA-N	0	3	335.238	3.397	20	30		EGEDHN
N#CCC[C@H](NC(=O)NC[C@H]1NCCc2ccccc21)c1ccccc1	ZINC000582954103	459457348	/nfs/dbraw/zinc/45/73/48/459457348.db2.gz	SJDPAMNLAOLHTR-VQTJNVASSA-N	0	3	348.450	3.218	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CCOC2(CCCC2)C1)C(C)C	ZINC000485566805	459459803	/nfs/dbraw/zinc/45/98/03/459459803.db2.gz	WMVZAROJWJJZRH-GOSISDBHSA-N	0	3	349.519	3.040	20	30		EGEDHN
C=CCn1c(-c2sccc2C)nnc1N1C[C@H](C)N(CC)C[C@@H]1C	ZINC000583052542	459473408	/nfs/dbraw/zinc/47/34/08/459473408.db2.gz	DNUKNDBGFMJRJN-GJZGRUSLSA-N	0	3	345.516	3.420	20	30		EGEDHN
N#Cc1cccnc1OC1CCC(NCc2cn3ccccc3n2)CC1	ZINC000525836480	459502484	/nfs/dbraw/zinc/50/24/84/459502484.db2.gz	ZRKXGBSOMVNIRY-UHFFFAOYSA-N	0	3	347.422	3.081	20	30		EGEDHN
C=CCn1c(CC)nnc1N1C[C@@H](C)N(Cc2ccccc2)C[C@@H]1C	ZINC000562030035	459505150	/nfs/dbraw/zinc/50/51/50/459505150.db2.gz	WDFOLNBFJHMIJZ-SJORKVTESA-N	0	3	339.487	3.126	20	30		EGEDHN
CC[C@H](C)N[C@H](CNC(=O)N1CCC(CCC#N)CC1)c1ccco1	ZINC000592022780	459513251	/nfs/dbraw/zinc/51/32/51/459513251.db2.gz	FWZPCNDYJGEMPO-DOTOQJQBSA-N	0	3	346.475	3.434	20	30		EGEDHN
CCN1CCCN(c2c(C#N)cnc3c(F)ccc(Cl)c32)CC1	ZINC000486939979	459525211	/nfs/dbraw/zinc/52/52/11/459525211.db2.gz	PCECMIHCYDDAEX-UHFFFAOYSA-N	0	3	332.810	3.431	20	30		EGEDHN
C=CCOc1ccc(CNCCN2CCO[C@@H](CC)C2)cc1Cl	ZINC000487169736	459526811	/nfs/dbraw/zinc/52/68/11/459526811.db2.gz	VKDJHDLDWXGIKR-INIZCTEOSA-N	0	3	338.879	3.105	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2c(C)c3ccccc3[nH]c2=O)CC1	ZINC000487247985	459527867	/nfs/dbraw/zinc/52/78/67/459527867.db2.gz	VQYIQSJZIJXYDB-UHFFFAOYSA-N	0	3	339.439	3.019	20	30		EGEDHN
CC(C)(NCc1ccc(CC#N)cc1)C(=O)NCC1CCCCC1	ZINC000542257721	459540070	/nfs/dbraw/zinc/54/00/70/459540070.db2.gz	SYMWYIHJNWGQNG-UHFFFAOYSA-N	0	3	327.472	3.317	20	30		EGEDHN
C[C@@H](c1ccc(Cl)cc1)[C@H](C)N(C)CC(=O)NC1(C#N)CCC1	ZINC000526135420	459554354	/nfs/dbraw/zinc/55/43/54/459554354.db2.gz	BYYIYKHWGJXOIA-KGLIPLIRSA-N	0	3	333.863	3.326	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN2CCC[C@H]2[C@H]2CCCOC2)c1C	ZINC000571795402	459573220	/nfs/dbraw/zinc/57/32/20/459573220.db2.gz	WZGBYKALZSBLJG-HKUYNNGSSA-N	0	3	330.472	3.365	20	30		EGEDHN
C=CCC(C)(C)CNC(=O)CCN1CCN(c2cccc(C)c2)CC1	ZINC000490058023	459576008	/nfs/dbraw/zinc/57/60/08/459576008.db2.gz	IUOMVMMSOOSFQA-UHFFFAOYSA-N	0	3	343.515	3.226	20	30		EGEDHN
C=CC[C@H](CC)NCCS(=O)(=O)c1cccc(Br)c1	ZINC000572394800	459579597	/nfs/dbraw/zinc/57/95/97/459579597.db2.gz	VJGNGUVCQKJGJE-ZDUSSCGKSA-N	0	3	346.290	3.167	20	30		EGEDHN
C[C@@H](C(=O)NC1(C#N)CCC1)N1CC[C@@](C)(CCc2ccccc2)C1	ZINC000527048421	459582645	/nfs/dbraw/zinc/58/26/45/459582645.db2.gz	LQSIBIZMHJCUJN-FXAWDEMLSA-N	0	3	339.483	3.282	20	30		EGEDHN
CN(C)[C@H](CNC(=O)c1ccc(Cl)c(C#N)c1)Cc1ccccc1	ZINC000542706862	459584588	/nfs/dbraw/zinc/58/45/88/459584588.db2.gz	AYOJYNRSJPILEB-KRWDZBQOSA-N	0	3	341.842	3.114	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cc(C)cc2c[nH]nc21)C(C)C	ZINC000498367849	459586974	/nfs/dbraw/zinc/58/69/74/459586974.db2.gz	QTVBZOSQMPXIDT-GOSISDBHSA-N	0	3	340.471	3.300	20	30		EGEDHN
C=CCN1CCC(NC(=O)/C=C/c2ccc(OC)c(Cl)c2)CC1	ZINC000491550128	459636292	/nfs/dbraw/zinc/63/62/92/459636292.db2.gz	YPABPUZIZSSLNO-FNORWQNLSA-N	0	3	334.847	3.128	20	30		EGEDHN
C#CCN(Cc1cn(CCC#N)nc1-c1ccncc1)C1CCCC1	ZINC000491659780	459648880	/nfs/dbraw/zinc/64/88/80/459648880.db2.gz	LNKCTZBZZIXRRP-UHFFFAOYSA-N	0	3	333.439	3.237	20	30		EGEDHN
CN(C)C/C=C/C(=O)N[C@H](C#N)c1ccc(OCc2ccccc2)cc1	ZINC000491875078	459683451	/nfs/dbraw/zinc/68/34/51/459683451.db2.gz	YAGVTJDCOIYCAY-AQDCRGGLSA-N	0	3	349.434	3.064	20	30		EGEDHN
CN(C)CCc1ccccc1NC(=O)/C=C/c1ccc(OCC#N)cc1	ZINC000491973178	459687000	/nfs/dbraw/zinc/68/70/00/459687000.db2.gz	OLCSATOWNSIUGS-FMIVXFBMSA-N	0	3	349.434	3.345	20	30		EGEDHN
COC(=O)N1CCC[C@H]([C@H](C)NCc2ccc(C#N)cc2Cl)C1	ZINC000492392069	459702259	/nfs/dbraw/zinc/70/22/59/459702259.db2.gz	RRBVJWXMLUEYSM-WFASDCNBSA-N	0	3	335.835	3.168	20	30		EGEDHN
N#Cc1cc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)ccc1F	ZINC000593050726	459756263	/nfs/dbraw/zinc/75/62/63/459756263.db2.gz	VIZBGSWGDVNOFH-NWDGAFQWSA-N	0	3	330.281	3.383	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)c2ccc(O[C@H]3CCOC3)cc2)n1	ZINC000584697938	459784778	/nfs/dbraw/zinc/78/47/78/459784778.db2.gz	HKPVDJIMGQBZFT-LSDHHAIUSA-N	0	3	328.393	3.109	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](O)Cc2ccc(C(F)(F)F)cc2)cc1	ZINC000584834252	459810563	/nfs/dbraw/zinc/81/05/63/459810563.db2.gz	GHHMKABKRJTDSD-QGZVFWFLSA-N	0	3	334.341	3.270	20	30		EGEDHN
CC(C)[C@@H]1CN(Cc2ccc(C#N)cn2)CCN1Cc1ccccc1	ZINC000528642680	459811780	/nfs/dbraw/zinc/81/17/80/459811780.db2.gz	XYWTZNXXTDYHSJ-NRFANRHFSA-N	0	3	334.467	3.296	20	30		EGEDHN
COCCc1ccc(OC[C@@H](C)NCc2ccc(C#N)c(F)c2)cc1	ZINC000597144413	459851745	/nfs/dbraw/zinc/85/17/45/459851745.db2.gz	QINXGZHQDXTZPS-OAHLLOKOSA-N	0	3	342.414	3.443	20	30		EGEDHN
CC1(C)CCC(O)(CNC(=O)C(C#N)CCc2ccccc2)CC1	ZINC000598338970	459870755	/nfs/dbraw/zinc/87/07/55/459870755.db2.gz	QSQMYTLUZXDPMD-KRWDZBQOSA-N	0	3	328.456	3.206	20	30		EGEDHN
C[C@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccccc1-n1ccnn1	ZINC000586793826	459874950	/nfs/dbraw/zinc/87/49/50/459874950.db2.gz	CNRVHXLETHYSEV-IFXJQAMLSA-N	0	3	329.407	3.477	20	30		EGEDHN
CN(Cc1cccc(OCc2cccc(C#N)c2)c1)C1(CO)CCC1	ZINC000597255987	459897215	/nfs/dbraw/zinc/89/72/15/459897215.db2.gz	QWMWFWDKYSNHGE-UHFFFAOYSA-N	0	3	336.435	3.484	20	30		EGEDHN
N#Cc1cnn2cc(CN[C@@H](c3ccc(F)cc3)C3CCC3)cnc12	ZINC000609222869	459927813	/nfs/dbraw/zinc/92/78/13/459927813.db2.gz	MFSWPYSINZOAMN-GOSISDBHSA-N	0	3	335.386	3.371	20	30		EGEDHN
CC[C@@H](C#N)C(=O)Nc1cc(C)cc(N2CCN(C(C)C)CC2)c1	ZINC000593652107	459941900	/nfs/dbraw/zinc/94/19/00/459941900.db2.gz	RSDKEUGXWYYDEQ-INIZCTEOSA-N	0	3	328.460	3.014	20	30		EGEDHN
CN(CCCc1cc(-c2ccccc2)n[nH]1)Cc1cccc(C#N)n1	ZINC000602454005	459944956	/nfs/dbraw/zinc/94/49/56/459944956.db2.gz	MYLARSCLFCRQTA-UHFFFAOYSA-N	0	3	331.423	3.408	20	30		EGEDHN
C[C@@H](CCC#N)CN1CCCC[C@@H]1C(=O)Nc1ccc2c(c1)CCO2	ZINC000602471844	459953595	/nfs/dbraw/zinc/95/35/95/459953595.db2.gz	LLKKBARNEVNMKB-MAUKXSAKSA-N	0	3	341.455	3.354	20	30		EGEDHN
COc1cc([C@@H](C)NC[C@H](O)CC(C)(C)C#N)ccc1OC(C)C	ZINC000598599513	459958716	/nfs/dbraw/zinc/95/87/16/459958716.db2.gz	BVMVTBDPDDBFDC-GDBMZVCRSA-N	0	3	334.460	3.434	20	30		EGEDHN
C[C@H](CNCc1cccc(C#N)n1)Oc1ccccc1Br	ZINC000602566372	460000122	/nfs/dbraw/zinc/00/01/22/460000122.db2.gz	HPFYWAJRFZIIMQ-GFCCVEGCSA-N	0	3	346.228	3.273	20	30		EGEDHN
N#C[C@H](NC(=O)[C@H]1CCN(Cc2ccccc2)C1)C1CCCCC1	ZINC000575812604	460009578	/nfs/dbraw/zinc/00/95/78/460009578.db2.gz	NGDGKHYIKLOBEM-OALUTQOASA-N	0	3	325.456	3.097	20	30		EGEDHN
N#CCCCCCC(=O)N1CCN(c2ccnc3ccccc32)CC1	ZINC000593897259	460014072	/nfs/dbraw/zinc/01/40/72/460014072.db2.gz	IDPGYGBGYULQLV-UHFFFAOYSA-N	0	3	336.439	3.357	20	30		EGEDHN
N#CCC1(CNCc2ccc(I)s2)CC1	ZINC000602642769	460039026	/nfs/dbraw/zinc/03/90/26/460039026.db2.gz	NANOFOOMWYJIRA-UHFFFAOYSA-N	0	3	332.210	3.136	20	30		EGEDHN
N#Cc1ccc(Nc2cccc(C(=O)N[C@H]3CCN(C4CC4)C3)c2)cc1	ZINC000609987414	460045716	/nfs/dbraw/zinc/04/57/16/460045716.db2.gz	VEQUYOHUDKTBJD-IBGZPJMESA-N	0	3	346.434	3.268	20	30		EGEDHN
CC[C@H]1CN(C(=O)C(C)C)CC[C@@H]1NCc1cc(C#N)ccc1F	ZINC000614204239	460046875	/nfs/dbraw/zinc/04/68/75/460046875.db2.gz	ZBFLMCQYWGBLPC-YJBOKZPZSA-N	0	3	331.435	3.070	20	30		EGEDHN
Cc1cc(CN[C@H](C)CC2(C#N)CCOCC2)cc(N2CCCC2)n1	ZINC000602667608	460055303	/nfs/dbraw/zinc/05/53/03/460055303.db2.gz	QQCKXWUATHBFSZ-QGZVFWFLSA-N	0	3	342.487	3.179	20	30		EGEDHN
C[C@H](CC1(C#N)CCOCC1)NCc1c(F)cccc1-n1cccn1	ZINC000602682911	460063717	/nfs/dbraw/zinc/06/37/17/460063717.db2.gz	UHEAMDPOYDXWNM-OAHLLOKOSA-N	0	3	342.418	3.200	20	30		EGEDHN
Cc1cc(C)c(C#N)c(NC(=O)[C@H]2CCCN(Cc3ccccc3)C2)n1	ZINC000598851964	460067744	/nfs/dbraw/zinc/06/77/44/460067744.db2.gz	FBNHRXUKWXKONM-SFHVURJKSA-N	0	3	348.450	3.421	20	30		EGEDHN
C[C@@]1(Cc2cccc(F)c2)CCCN1Cc1cnc2c(C#N)cnn2c1	ZINC000576161145	460082089	/nfs/dbraw/zinc/08/20/89/460082089.db2.gz	PPGRUFUKNUBINT-FQEVSTJZSA-N	0	3	349.413	3.337	20	30		EGEDHN
N#Cc1ccc(CCNC(=O)c2cccc(CN3CCCC3)c2)cc1	ZINC000597892682	460098629	/nfs/dbraw/zinc/09/86/29/460098629.db2.gz	LGPSKUDNDDAUQQ-UHFFFAOYSA-N	0	3	333.435	3.127	20	30		EGEDHN
N#CC[C@@H]1CCCN(C(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000597911978	460106977	/nfs/dbraw/zinc/10/69/77/460106977.db2.gz	RUZDEBAUSHYWBA-SFHVURJKSA-N	0	3	325.456	3.051	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@@H](C)CC[S@@](C)=O)cc1OC	ZINC000598966774	460108917	/nfs/dbraw/zinc/10/89/17/460108917.db2.gz	HILHRWJIMSVTAQ-AMXDTQDGSA-N	0	3	345.892	3.160	20	30		EGEDHN
CCN1CCN(c2ccc(NC(=O)C(C#N)(CC)CC)c(C)c2)CC1	ZINC000598972253	460110062	/nfs/dbraw/zinc/11/00/62/460110062.db2.gz	HNRRFRZUMZKKMP-UHFFFAOYSA-N	0	3	342.487	3.405	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)C(=O)NCC(C)(C)N1CCCCC1	ZINC000594212367	460153941	/nfs/dbraw/zinc/15/39/41/460153941.db2.gz	UNARBPKIRALYDE-MRXNPFEDSA-N	0	3	327.472	3.118	20	30		EGEDHN
CC[C@@H](C)CN(C)c1ccc(F)cc1CNC1CCN(CC#N)CC1	ZINC000610511413	460170480	/nfs/dbraw/zinc/17/04/80/460170480.db2.gz	RPQCMWJXHRLZAO-MRXNPFEDSA-N	0	3	346.494	3.386	20	30		EGEDHN
CC[C@H]1CCCCN1CCNC(=O)N[C@@H]1CCc2cc(C#N)ccc21	ZINC000618816226	460186499	/nfs/dbraw/zinc/18/64/99/460186499.db2.gz	KDVPRIHWNSFCSC-PKOBYXMFSA-N	0	3	340.471	3.109	20	30		EGEDHN
Cc1ccc(CCNC(=O)C(C#N)Cc2ccc(C#N)cc2)cc1C	ZINC000598144553	460188678	/nfs/dbraw/zinc/18/86/78/460188678.db2.gz	ZSYHMBAWBOEHLG-HXUWFJFHSA-N	0	3	331.419	3.216	20	30		EGEDHN
C[C@@H](c1ccc(F)cc1)N(C)C[C@H](O)COc1ccccc1C#N	ZINC000599249743	460206655	/nfs/dbraw/zinc/20/66/55/460206655.db2.gz	GQFASPYSZCFEIV-KSSFIOAISA-N	0	3	328.387	3.130	20	30		EGEDHN
CC(C)[C@@H](C(=O)N[C@@H]1CCc2cc(C#N)ccc21)N1CCCCC1	ZINC000618892793	460210725	/nfs/dbraw/zinc/21/07/25/460210725.db2.gz	QGEWINGRNHAENA-MOPGFXCFSA-N	0	3	325.456	3.172	20	30		EGEDHN
N#CCCCC[C@@H](N)C(=O)Nc1ncc(Cc2ccccc2)s1	ZINC000594426396	460215351	/nfs/dbraw/zinc/21/53/51/460215351.db2.gz	QVGOPBBDOZVJBE-OAHLLOKOSA-N	0	3	328.441	3.084	20	30		EGEDHN
N#CCCCC[C@H](N)C(=O)N1CCC(c2cccc(F)c2F)CC1	ZINC000594450257	460224730	/nfs/dbraw/zinc/22/47/30/460224730.db2.gz	VXGMYOTZAGOGAC-INIZCTEOSA-N	0	3	335.398	3.082	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CN[C@@H](c1cccs1)C1CC1	ZINC000599348460	460234641	/nfs/dbraw/zinc/23/46/41/460234641.db2.gz	LNEXIXGLANLRPF-CRAIPNDOSA-N	0	3	328.437	3.100	20	30		EGEDHN
CC[C@H](NC[C@@H](O)COc1ccccc1C#N)c1ccc(F)cc1F	ZINC000599355917	460236508	/nfs/dbraw/zinc/23/65/08/460236508.db2.gz	KDJDKNVUQPUOMB-QAPCUYQASA-N	0	3	346.377	3.317	20	30		EGEDHN
C=CCC1(NCCS(=O)(=O)c2ccc(C#N)cc2)CCCCC1	ZINC000599609078	460286280	/nfs/dbraw/zinc/28/62/80/460286280.db2.gz	DKLPYDKPSYBSIS-UHFFFAOYSA-N	0	3	332.469	3.201	20	30		EGEDHN
C[C@@H](NC(=O)NC[C@@H]1N(C)CCCC1(C)C)c1cccc(C#N)c1	ZINC000619204616	460300924	/nfs/dbraw/zinc/30/09/24/460300924.db2.gz	AIDOBCFALXHGQL-PBHICJAKSA-N	0	3	328.460	3.039	20	30		EGEDHN
COc1cc(NC(=O)N(CCN(C)C)C2CCCC2)c(F)cc1C#N	ZINC000599815653	460339873	/nfs/dbraw/zinc/33/98/73/460339873.db2.gz	CGVPZGJADFTLBW-UHFFFAOYSA-N	0	3	348.422	3.044	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2N[C@H]1CC(=O)N(c2ccccc2)C1	ZINC000611391722	460353916	/nfs/dbraw/zinc/35/39/16/460353916.db2.gz	GFVGFAWSNPPLGU-PXNSSMCTSA-N	0	3	331.419	3.331	20	30		EGEDHN
C=CCN(Cc1ccccc1F)C(=O)NCCN1CCC[C@H](C)C1	ZINC000615672555	460371555	/nfs/dbraw/zinc/37/15/55/460371555.db2.gz	ZEGILSVFXBJRKV-INIZCTEOSA-N	0	3	333.451	3.255	20	30		EGEDHN
CC(C)(CNC(=O)NCc1ccc(C#N)c(Cl)c1)N1CCCCC1	ZINC000619754308	460432622	/nfs/dbraw/zinc/43/26/22/460432622.db2.gz	XNLFAPTUOZNXEN-UHFFFAOYSA-N	0	3	348.878	3.275	20	30		EGEDHN
CN(C)CCN(C(=O)NCc1ccc(C#N)c(Cl)c1)C1CCCC1	ZINC000619827272	460450932	/nfs/dbraw/zinc/45/09/32/460450932.db2.gz	YXOQMYSBANUQJH-UHFFFAOYSA-N	0	3	348.878	3.227	20	30		EGEDHN
CN(CCc1ccccc1)[C@H]1CCN(C(=O)c2ccccc2CC#N)C1	ZINC000601670094	460864253	/nfs/dbraw/zinc/86/42/53/460864253.db2.gz	JLDOQBUEMAQNSX-FQEVSTJZSA-N	0	3	347.462	3.142	20	30		EGEDHN
CN(C(=O)c1ccc(C#Cc2ccccc2)cc1)[C@@H]1CCCN(C)C1	ZINC000607578598	460864831	/nfs/dbraw/zinc/86/48/31/460864831.db2.gz	YUQVFTRLUDXHJQ-OAQYLSRUSA-N	0	3	332.447	3.253	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccc3[nH]c(=O)n(C(C)C)c3c2)nc(C)n1	ZINC000659025148	461146379	/nfs/dbraw/zinc/14/63/79/461146379.db2.gz	OFUCPTXSJMFWRH-AWEZNQCLSA-N	0	3	349.394	3.220	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@](C)(CC)c2ccc(F)cc2)CC1	ZINC000636740406	461267909	/nfs/dbraw/zinc/26/79/09/461267909.db2.gz	PZALYBFUHJXVSS-LJQANCHMSA-N	0	3	333.451	3.401	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2c(C(F)F)nc3ccccn32)CC1	ZINC000630942792	461429346	/nfs/dbraw/zinc/42/93/46/461429346.db2.gz	LTDWIPQDKCABRL-UHFFFAOYSA-N	0	3	348.397	3.042	20	30		EGEDHN
C=CCOc1cccc(CN[C@H](CC)C(=O)NCc2cccs2)c1	ZINC000647242536	461585073	/nfs/dbraw/zinc/58/50/73/461585073.db2.gz	YRYOLILNHLFMPO-GOSISDBHSA-N	0	3	344.480	3.498	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H](C(C)C)[C@H](O)C(F)(F)F)cc1OC	ZINC000643883107	461825596	/nfs/dbraw/zinc/82/55/96/461825596.db2.gz	HBDWKEKOCCUGFN-HOTGVXAUSA-N	0	3	347.377	3.297	20	30		EGEDHN
C=CCN(CCC(=O)NCc1cnc(C)s1)Cc1cccs1	ZINC000639435288	461921382	/nfs/dbraw/zinc/92/13/82/461921382.db2.gz	NKCMMWCFHXKBPX-UHFFFAOYSA-N	0	3	335.498	3.208	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](N(C)Cc3ccccc3)C2)CCOCC1	ZINC000644650924	462024588	/nfs/dbraw/zinc/02/45/88/462024588.db2.gz	XPELYQYDCQGLDZ-IBGZPJMESA-N	0	3	342.483	3.092	20	30		EGEDHN
C=CCCn1cc(CNC[C@@H]2CCCO[C@H]2c2ccc(C)cc2)nn1	ZINC000657385817	462088716	/nfs/dbraw/zinc/08/87/16/462088716.db2.gz	WQVSCJAYNKWSAB-ICSRJNTNSA-N	0	3	340.471	3.420	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)N[C@@H]1CCCN2CCCC[C@H]12	ZINC000654318463	462161055	/nfs/dbraw/zinc/16/10/55/462161055.db2.gz	NEUVLDLQECMEOP-QZTJIDSGSA-N	0	3	344.455	3.007	20	30		EGEDHN
C=CCN(C[C@@H](O)Cc1ccccc1C(F)(F)F)[C@@H](C)COC	ZINC000661239696	462166293	/nfs/dbraw/zinc/16/62/93/462166293.db2.gz	INVLGIKEFBPEGZ-ZFWWWQNUSA-N	0	3	331.378	3.132	20	30		EGEDHN
C=CCN(CCC(=O)Nc1ccc(Cl)cc1F)[C@@H](C)COC	ZINC000661242630	462167207	/nfs/dbraw/zinc/16/72/07/462167207.db2.gz	DHOXLHJBGASRGE-LBPRGKRZSA-N	0	3	328.815	3.331	20	30		EGEDHN
C=CCN(CC(=O)NCCc1nc2ccccc2s1)C(C)(C)C	ZINC000661756579	462399769	/nfs/dbraw/zinc/39/97/69/462399769.db2.gz	RCJLYXLVLCKNGC-UHFFFAOYSA-N	0	3	331.485	3.242	20	30		EGEDHN
C=CCC1(NCc2nc3cc(OC)c(OC)cc3c(=O)[nH]2)CCCC1	ZINC000661862207	462443550	/nfs/dbraw/zinc/44/35/50/462443550.db2.gz	DTGGARAQMPGEBN-UHFFFAOYSA-N	0	3	343.427	3.331	20	30		EGEDHN
COc1cc(CN(C)CCCOc2cccc(C#N)c2)ccc1O	ZINC000178316805	533781078	/nfs/dbraw/zinc/78/10/78/533781078.db2.gz	QFLXQNDZZOXPIS-UHFFFAOYSA-N	0	3	326.396	3.173	20	30		EGEDHN
C[C@@H](Cn1cc(Br)cn1)N[C@@H](C)c1ccc(C#N)cc1	ZINC000154331871	534268685	/nfs/dbraw/zinc/26/86/85/534268685.db2.gz	IYXDCRCDXNIXON-RYUDHWBXSA-N	0	3	333.233	3.257	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)[C@@H](C)c2ccc(F)c(F)c2)CC1	ZINC000171740186	526424195	/nfs/dbraw/zinc/42/41/95/526424195.db2.gz	DOZQSVLTXQKQBJ-ZDUSSCGKSA-N	0	3	337.414	3.318	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(CC)[C@H](C)c2cccc(OC)c2)CC1	ZINC000171740958	526425268	/nfs/dbraw/zinc/42/52/68/526425268.db2.gz	OBPDPFNUBDAGGG-MRXNPFEDSA-N	0	3	345.487	3.438	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc3nc(OC)ccc3c2)CC1	ZINC000171640321	526441386	/nfs/dbraw/zinc/44/13/86/526441386.db2.gz	KAVVFNXOVRSTJD-UHFFFAOYSA-N	0	3	340.427	3.015	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@H](C)N[C@@H](C)c1ccc(-n2cccn2)cc1	ZINC000174370473	526543340	/nfs/dbraw/zinc/54/33/40/526543340.db2.gz	UGJFIQOVRQAXRJ-IRXDYDNUSA-N	0	3	340.471	3.336	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)[C@@H]2CCc3ccccc32)CC1	ZINC000171607319	526583213	/nfs/dbraw/zinc/58/32/13/526583213.db2.gz	GEXGRFTUKPNIFC-LJQANCHMSA-N	0	3	327.472	3.356	20	30		EGEDHN
C#CCCCCNC(=O)N(CC)C[C@@H]1CCN(Cc2ccccc2)C1	ZINC000155049268	526696038	/nfs/dbraw/zinc/69/60/38/526696038.db2.gz	OSWJEARGSIFKKT-HXUWFJFHSA-N	0	3	341.499	3.344	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H](c2ccc(Cl)cc2)[C@H]2C[C@H]2C)CC1	ZINC000174635093	526931367	/nfs/dbraw/zinc/93/13/67/526931367.db2.gz	XMSGKXJOYQIOBS-MDASCCDHSA-N	0	3	344.886	3.499	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC(CN2C[C@H](C)O[C@@H](C)C2)CC1	ZINC000130007952	527023975	/nfs/dbraw/zinc/02/39/75/527023975.db2.gz	GUWNKYYGZQAONA-IRXDYDNUSA-N	0	3	334.504	3.103	20	30		EGEDHN
CC1(C)C[C@@H](NCC(=O)Nc2ccc(C#N)c(Cl)c2)C(C)(C)O1	ZINC000132433829	529138943	/nfs/dbraw/zinc/13/89/43/529138943.db2.gz	GMHSBAMFNUTJQN-CQSZACIVSA-N	0	3	335.835	3.086	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H]2C[C@H](OCC)C23CCCCC3)CC1	ZINC000078959135	546591496	/nfs/dbraw/zinc/59/14/96/546591496.db2.gz	HWINUEQVEXJQBV-ROUUACIJSA-N	0	3	349.519	3.064	20	30		EGEDHN
Cc1cc(Cl)cc(C(=O)C(C#N)c2nnc3n2CCCCC3)c1	ZINC000177698539	547029503	/nfs/dbraw/zinc/02/95/03/547029503.db2.gz	REAIKYSASZCXJC-CQSZACIVSA-N	0	3	328.803	3.456	20	30		EGEDHN
O=C(NCc1cccc2cc[nH]c21)N1CCN(C2CCCC2)CC1	ZINC000329800694	547507796	/nfs/dbraw/zinc/50/77/96/547507796.db2.gz	IWEXLBSLAXFIRA-UHFFFAOYSA-N	0	3	326.444	3.142	20	30		EGEDHN
C=CCc1cc(CN2CCc3ccc(O)cc3CC2)cc(OC)c1O	ZINC000678221397	549428586	/nfs/dbraw/zinc/42/85/86/549428586.db2.gz	CYYMFJVKSPAXNL-UHFFFAOYSA-N	0	3	339.435	3.436	20	30		EGEDHN
C#CCCCOC(=O)C1CCN(c2ccc(Cl)c(Cl)c2)C1=O	ZINC000727039699	574635698	/nfs/dbraw/zinc/63/56/98/574635698.db2.gz	YONDPZPUAWLRAD-LBPRGKRZSA-N	0	3	340.206	3.303	20	30		EGEDHN
C[NH+](C)[C@@H]1CCC[C@H](/N=C\c2cc(Br)ccc2[O-])C1	ZINC000749843735	574649553	/nfs/dbraw/zinc/64/95/53/574649553.db2.gz	FXHGAVALVYWWKK-OPABCWLPSA-N	0	3	325.250	3.446	20	30		EGEDHN
Cc1nn(C)c(C)c1CC(=O)C(C#N)c1nc2cc(F)ccc2s1	ZINC000730416782	574984355	/nfs/dbraw/zinc/98/43/55/574984355.db2.gz	ILTXKIGEGOTKGX-CYBMUJFWSA-N	0	3	342.399	3.205	20	30		EGEDHN
C#CCOc1ccc(NC(=O)NC[C@@H](C)N2CCCC[C@H]2C)cc1	ZINC000731114606	575055515	/nfs/dbraw/zinc/05/55/15/575055515.db2.gz	IYTDXNPXMAMHKI-HZPDHXFCSA-N	0	3	329.444	3.083	20	30		EGEDHN
CC(C)n1ccc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)n1	ZINC000733679387	575381235	/nfs/dbraw/zinc/38/12/35/575381235.db2.gz	YUBYRTUVXYBJNZ-NSHDSACASA-N	0	3	330.775	3.079	20	30		EGEDHN
CC[C@@H](C#N)Oc1cccc(CNCc2ccccc2-n2cncn2)c1	ZINC000733800105	575398181	/nfs/dbraw/zinc/39/81/81/575398181.db2.gz	HVOYHRYQYKHCOQ-SFHVURJKSA-N	0	3	347.422	3.238	20	30		EGEDHN
C=CC[C@H](NC(=O)N1CCC[C@@H]1CN1CCCCC1)c1ccncc1	ZINC000734684099	575536854	/nfs/dbraw/zinc/53/68/54/575536854.db2.gz	SDTFZFCVWDMNBI-MOPGFXCFSA-N	0	3	342.487	3.359	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)C[C@@H]2CCOC2)cc1	ZINC000740536473	576594108	/nfs/dbraw/zinc/59/41/08/576594108.db2.gz	UPYOPANDNFKEHV-DOTOQJQBSA-N	0	3	328.412	3.103	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2csc(-c3cccs3)n2)CC1	ZINC000740735395	576621390	/nfs/dbraw/zinc/62/13/90/576621390.db2.gz	DCSJLLUYJVBLNK-UHFFFAOYSA-N	0	3	345.493	3.089	20	30		EGEDHN
C#CCCN1CCC(NC(=O)C2(c3ccccc3F)CCCC2)CC1	ZINC000740736121	576621406	/nfs/dbraw/zinc/62/14/06/576621406.db2.gz	FINMKFXUTHGBNT-UHFFFAOYSA-N	0	3	342.458	3.241	20	30		EGEDHN
C#CCCN1CCC(NC(=O)C2(c3ccc(F)cc3)CCCC2)CC1	ZINC000740736563	576621677	/nfs/dbraw/zinc/62/16/77/576621677.db2.gz	ABMGTXZBLGPMEE-UHFFFAOYSA-N	0	3	342.458	3.241	20	30		EGEDHN
CC(C)OCCCN(C)CC(=O)C(C#N)c1nc2ccccc2s1	ZINC000740881486	576633226	/nfs/dbraw/zinc/63/32/26/576633226.db2.gz	WYAUHDQFUPJTJW-AWEZNQCLSA-N	0	3	345.468	3.219	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)[C@@H](C)c2ccco2)cc1Cl	ZINC000744031933	576819316	/nfs/dbraw/zinc/81/93/16/576819316.db2.gz	DHCGLTSCXCETKV-CMPLNLGQSA-N	0	3	346.770	3.393	20	30		EGEDHN
CN(CCC#N)c1ccc(CNCc2ccc([S@@](C)=O)cc2)cc1	ZINC000751152786	1299517044	/nfs/dbraw/zinc/51/70/44/1299517044.db2.gz	PBOZGFKOVRUKJG-XMMPIXPASA-N	0	3	341.480	3.064	20	30		EGEDHN
C[C@H](SCc1ccccc1)C(=O)C(C#N)C(=O)NC1CCCCC1	ZINC000050683763	1291654200	/nfs/dbraw/zinc/65/42/00/1291654200.db2.gz	ADUWXCLBTHANHH-YOEHRIQHSA-N	0	3	344.480	3.466	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1)C(=O)/C=C/c1ccccc1C#N	ZINC000053834878	1291731109	/nfs/dbraw/zinc/73/11/09/1291731109.db2.gz	ZCLJSEGIDSOOOE-OUKQBFOZSA-N	0	3	333.435	3.162	20	30		EGEDHN
Cc1nn(C)c(C)c1C[C@H](C)C(=O)C(C#N)c1nc2ccccc2o1	ZINC000076842612	1292445713	/nfs/dbraw/zinc/44/57/13/1292445713.db2.gz	HZKGFXPTFVZXJK-NHYWBVRUSA-N	0	3	336.395	3.233	20	30		EGEDHN
C=CC1CCN(Cc2cc(=O)n3c4ccccc4[nH]c3c2C#N)CC1	ZINC000111258061	1293102281	/nfs/dbraw/zinc/10/22/81/1293102281.db2.gz	NUQTVVCYRPZHFD-MRXNPFEDSA-N	0	3	332.407	3.122	20	30		EGEDHN
C=C(CC)CN[C@H](C)c1ccc(S(=O)(=O)C(F)F)c(OC)c1	ZINC000834901999	1293170461	/nfs/dbraw/zinc/17/04/61/1293170461.db2.gz	CRVRLFUHZUBREA-LLVKDONJSA-N	0	3	333.400	3.308	20	30		EGEDHN
CC[C@@H](CC(F)(F)F)C(=O)C(C#N)C(=O)Nc1cccc(OC)c1	ZINC000835060549	1293195931	/nfs/dbraw/zinc/19/59/31/1293195931.db2.gz	FRPOIGFYILTTAC-GXFFZTMASA-N	0	3	342.317	3.321	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)C[C@@H](C)c1cccc(C(F)(F)F)c1	ZINC000121769872	1293388395	/nfs/dbraw/zinc/38/83/95/1293388395.db2.gz	MMFCVFSWYCGTRM-RISCZKNCSA-N	0	3	340.345	3.432	20	30		EGEDHN
C[C@@H]1CCc2sc(C(=O)C(C#N)C(=O)Nc3ccccn3)cc2C1	ZINC000125109942	1293495846	/nfs/dbraw/zinc/49/58/46/1293495846.db2.gz	BLJHJEBADULXJU-DGCLKSJQSA-N	0	3	339.420	3.229	20	30		EGEDHN
N#CC(C(=O)CCCOc1cccc(F)c1)C(=O)Nc1ccccc1	ZINC000125524984	1293510193	/nfs/dbraw/zinc/51/01/93/1293510193.db2.gz	UXGOTZNJULKCHU-KRWDZBQOSA-N	0	3	340.354	3.332	20	30		EGEDHN
COc1cc(CN(C)Cc2ccc(O[C@H](C)C#N)cc2)ccc1O	ZINC000125963338	1293521466	/nfs/dbraw/zinc/52/14/66/1293521466.db2.gz	GRPMHYAIKSZHRZ-CQSZACIVSA-N	0	3	326.396	3.324	20	30		EGEDHN
COCCCC(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000129781031	1293634439	/nfs/dbraw/zinc/63/44/39/1293634439.db2.gz	UURMAXMEKSPZAF-SNVBAGLBSA-N	0	3	329.183	3.067	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H](O)c1ccccc1Br	ZINC000152763979	1293984479	/nfs/dbraw/zinc/98/44/79/1293984479.db2.gz	BGPLUKSEWBNGKZ-KRWDZBQOSA-N	0	3	345.240	3.486	20	30		EGEDHN
CC(C)N1CCN(c2ccc(C(=O)O[C@H](C#N)C(C)(C)C)cc2)CC1	ZINC000154472785	1294057108	/nfs/dbraw/zinc/05/71/08/1294057108.db2.gz	ZBVKZJXVPOTGRZ-GOSISDBHSA-N	0	3	343.471	3.312	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)CCc1cccc(OC2CCCC2)c1	ZINC000171037147	1294391855	/nfs/dbraw/zinc/39/18/55/1294391855.db2.gz	XYHLWEXRVCXLKT-SFHVURJKSA-N	0	3	342.439	3.174	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)C[C@@H](C)c1ccccc1OC	ZINC000171401909	1294405579	/nfs/dbraw/zinc/40/55/79/1294405579.db2.gz	FGZYERNZARYHIB-ZBFHGGJFSA-N	0	3	330.428	3.204	20	30		EGEDHN
C=CCOCCCC(=O)C(C#N)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000173979748	1294475499	/nfs/dbraw/zinc/47/54/99/1294475499.db2.gz	DHPMVMGFFARBCI-GFCCVEGCSA-N	0	3	338.766	3.109	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)c2cncc(OC(C)C)c2)c1	ZINC000179979544	1294848459	/nfs/dbraw/zinc/84/84/59/1294848459.db2.gz	GAGBIVWTQMKJDH-KRWDZBQOSA-N	0	3	337.379	3.138	20	30		EGEDHN
N#CC(C(=O)COC1CCCCC1)C(=O)Nc1ccc(Cl)cc1	ZINC000193402776	1295861891	/nfs/dbraw/zinc/86/18/91/1295861891.db2.gz	NYCDDZBWGPNQMY-OAHLLOKOSA-N	0	3	334.803	3.337	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)CCc1cccs1	ZINC000193457697	1295872100	/nfs/dbraw/zinc/87/21/00/1295872100.db2.gz	YVVOHRNMMAKESQ-AWEZNQCLSA-N	0	3	342.420	3.427	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/CCC(=O)N2CCCCCC2)c([O-])c1	ZINC000194659730	1295997928	/nfs/dbraw/zinc/99/79/28/1295997928.db2.gz	MOKKKDXPOMOWLR-LTGZKZEYSA-N	0	3	345.487	3.450	20	30		EGEDHN
C[C@@H]([NH2+]C1CCN(c2ccc(C#N)cn2)CC1)c1cccc([O-])c1F	ZINC000872032703	1296681297	/nfs/dbraw/zinc/68/12/97/1296681297.db2.gz	YGMJGTFJXRFIEO-CYBMUJFWSA-N	0	3	340.402	3.118	20	30		EGEDHN
C#CCOc1ccc(CN[C@@H](C)c2ccc(N3CCNC3=O)cc2)cc1	ZINC000585086976	1298026152	/nfs/dbraw/zinc/02/61/52/1298026152.db2.gz	PDZYIUYAEIUURE-INIZCTEOSA-N	0	3	349.434	3.079	20	30		EGEDHN
Cc1ccc([C@@H](CNC(=O)C#Cc2ccccc2)N2CCCC2)cc1	ZINC000747371593	1298771736	/nfs/dbraw/zinc/77/17/36/1298771736.db2.gz	SZDCLJMMRNAIII-OAQYLSRUSA-N	0	3	332.447	3.300	20	30		EGEDHN
C[C@]1(Cc2ccc(F)c(F)c2)CCCN1C(=O)[C@@H](N)CCCCC#N	ZINC000877224735	1299214556	/nfs/dbraw/zinc/21/45/56/1299214556.db2.gz	NCZCRLGUKJVPRV-PKOBYXMFSA-N	0	3	349.425	3.300	20	30		EGEDHN
CCOC[C@H]1CCCN(CC[C@@](C#N)(C(C)=O)c2ccccc2)C1	ZINC000878106589	1299751536	/nfs/dbraw/zinc/75/15/36/1299751536.db2.gz	JALMAPOJLZFSME-AZUAARDMSA-N	0	3	328.456	3.176	20	30		EGEDHN
CCCN(CCN1CCCC1)CC[C@](C#N)(C(C)=O)c1ccccc1	ZINC000878607780	1300104578	/nfs/dbraw/zinc/10/45/78/1300104578.db2.gz	YHFJVOWDMMMVAE-NRFANRHFSA-N	0	3	341.499	3.235	20	30		EGEDHN
COc1ccc(CNC(=O)C(C#N)C(=O)[C@H](C)CCC(C)(C)C)cc1	ZINC000755610464	1300366949	/nfs/dbraw/zinc/36/69/49/1300366949.db2.gz	OHBKCVCJFHINCV-RHSMWYFYSA-N	0	3	344.455	3.483	20	30		EGEDHN
Cc1cccn2c(C=NN=c3[nH]c4cc(F)c(F)cc4[nH]3)cnc12	ZINC000755633090	1300369887	/nfs/dbraw/zinc/36/98/87/1300369887.db2.gz	YIPMZJMPYFVUQV-UHFFFAOYSA-N	0	3	326.310	3.243	20	30		EGEDHN
N#CCOc1ccc(CN2CC[C@H](Oc3ccc(F)cc3)C2)cc1	ZINC000879995588	1300825434	/nfs/dbraw/zinc/82/54/34/1300825434.db2.gz	DTTPYUKREQVZLX-IBGZPJMESA-N	0	3	326.371	3.381	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@](C)(NCc1cc(C#N)ccc1F)C1CC1	ZINC000759615867	1301129700	/nfs/dbraw/zinc/12/97/00/1301129700.db2.gz	SYATVIKZPJYLCW-IBGZPJMESA-N	0	3	347.434	3.480	20	30		EGEDHN
Cc1nc2sc3c(c2c(N=NC2C[C@H](C)N(C)C2)n1)CCCC3	ZINC000761801742	1301543841	/nfs/dbraw/zinc/54/38/41/1301543841.db2.gz	NYPFHUBWLVVPGA-JTQLQIEISA-N	0	3	329.473	3.370	20	30		EGEDHN
CCc1nn(C)c(OC)c1C/[NH+]=C/c1ccc(N(CC)CC)cc1[O-]	ZINC000763360470	1301885822	/nfs/dbraw/zinc/88/58/22/1301885822.db2.gz	BOOBLMCJKFUVLU-UDWIEESQSA-N	0	3	344.459	3.162	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN2CC=C(c3c[nH]c4ncccc34)CC2)cc1	ZINC000763479822	1301911997	/nfs/dbraw/zinc/91/19/97/1301911997.db2.gz	UAPBOXMFWIGOMM-HXUWFJFHSA-N	0	3	344.418	3.257	20	30		EGEDHN
C#CC[C@@H](NC(=O)NC[C@@H]1CCCCN1C1CC1)c1ccccc1	ZINC000764799898	1302137696	/nfs/dbraw/zinc/13/76/96/1302137696.db2.gz	MWQQSFREZIAENE-RBUKOAKNSA-N	0	3	325.456	3.067	20	30		EGEDHN
C#CC[C@@H](NC(=O)NC[C@H]1CCCCN1C1CC1)c1ccccc1	ZINC000764799900	1302137739	/nfs/dbraw/zinc/13/77/39/1302137739.db2.gz	MWQQSFREZIAENE-RTBURBONSA-N	0	3	325.456	3.067	20	30		EGEDHN
COc1ccc(C(=O)C(C#N)c2nc3ccccc3n2C)nc1Cl	ZINC000766838307	1302529801	/nfs/dbraw/zinc/52/98/01/1302529801.db2.gz	YZFVDPCHQWTSHW-SNVBAGLBSA-N	0	3	340.770	3.120	20	30		EGEDHN
CC(C)(C)CN(Cc1ccccc1)C(=O)C1CC2(C1)CNC[C@@H]2C#N	ZINC000884125293	1302745877	/nfs/dbraw/zinc/74/58/77/1302745877.db2.gz	VGTMFMDDTMYNSL-WBTXTPOCSA-N	0	3	339.483	3.201	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](Cc2ccccc2)C(C)C)CC1	ZINC000884161237	1302759202	/nfs/dbraw/zinc/75/92/02/1302759202.db2.gz	ABSGHCRSOVISIM-LJQANCHMSA-N	0	3	329.488	3.203	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)[C@H](F)c1ccccc1	ZINC000769280678	1303084209	/nfs/dbraw/zinc/08/42/09/1303084209.db2.gz	BXJRXZQFDJMBHG-RHSMWYFYSA-N	0	3	340.354	3.443	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)CCCC(F)(F)F)c1	ZINC000771257647	1303382046	/nfs/dbraw/zinc/38/20/46/1303382046.db2.gz	BNYABJIOXMIJCD-LBPRGKRZSA-N	0	3	328.290	3.075	20	30		EGEDHN
C#CCOc1ccccc1CN[C@H](C)CC(=O)Nc1ccc(F)cc1	ZINC000772989657	1303602620	/nfs/dbraw/zinc/60/26/20/1303602620.db2.gz	YKYBWDLGCAPTIL-OAHLLOKOSA-N	0	3	340.398	3.345	20	30		EGEDHN
C#C[C@H](N[C@H](C)CC(=O)Nc1ccc(C)cc1Cl)[C@@H]1CCCO1	ZINC000775572026	1303987261	/nfs/dbraw/zinc/98/72/61/1303987261.db2.gz	NWRFAJBKGIRNIB-KMFMINBZSA-N	0	3	334.847	3.136	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1NCc1cc(C#N)ccc1F	ZINC000775628219	1303998182	/nfs/dbraw/zinc/99/81/82/1303998182.db2.gz	ARJVTEJYKRJNMS-JKSUJKDBSA-N	0	3	333.407	3.233	20	30		EGEDHN
CCOC(=O)N1CCC[C@@H]([C@H](C)NCc2ccc(F)cc2C#N)C1	ZINC000776819817	1304205197	/nfs/dbraw/zinc/20/51/97/1304205197.db2.gz	CYFUYVRRALIVGB-DZGCQCFKSA-N	0	3	333.407	3.044	20	30		EGEDHN
CCCN(C(=O)[C@@H](C#N)CC)C1CCN(Cc2ccccc2)CC1	ZINC000889489135	1304500415	/nfs/dbraw/zinc/50/04/15/1304500415.db2.gz	XGBPTVYIFYCFNL-GOSISDBHSA-N	0	3	327.472	3.439	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CN1CCC[C@@H](C2(C)OCCO2)C1	ZINC000779166209	1304537936	/nfs/dbraw/zinc/53/79/36/1304537936.db2.gz	UTRBGQNEPPWFSN-OAHLLOKOSA-N	0	3	349.858	3.327	20	30		EGEDHN
C#CCCCCCC(=O)N(CCN(C)C)Cc1ccc(F)cc1F	ZINC000779934728	1304623875	/nfs/dbraw/zinc/62/38/75/1304623875.db2.gz	DHMOODBTSSCIHP-UHFFFAOYSA-N	0	3	336.426	3.439	20	30		EGEDHN
Fc1ccc(CCN2CCC(N=Nc3ncncc3Cl)CC2)cc1	ZINC000780279971	1304670609	/nfs/dbraw/zinc/67/06/09/1304670609.db2.gz	KMXZFJNPHFRKNO-UHFFFAOYSA-N	0	3	347.825	3.376	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1Cl)C(=O)[C@@H]1CCOC2(CCC2)C1	ZINC000892489449	1305400919	/nfs/dbraw/zinc/40/09/19/1305400919.db2.gz	KIZINFJAEGWMNG-CHWSQXEVSA-N	0	3	346.814	3.337	20	30		EGEDHN
C[C@H](N[C@@H](C)c1ccc(N2CCNC2=O)cc1)c1ccc(C#N)cc1	ZINC000786808803	1305633602	/nfs/dbraw/zinc/63/36/02/1305633602.db2.gz	FWCPIHQDXYLHJY-GJZGRUSLSA-N	0	3	334.423	3.500	20	30		EGEDHN
CC[C@@H](NC(=O)C(C#N)C(=O)C1CCSCC1)c1ccccc1	ZINC000787045122	1305683506	/nfs/dbraw/zinc/68/35/06/1305683506.db2.gz	HXGPSQMVARQEPO-HZPDHXFCSA-N	0	3	330.453	3.106	20	30		EGEDHN
Cc1cc2ncn(CN3CC[C@H](Oc4ccc(C#N)cn4)C3)c2cc1C	ZINC000793606968	1309415091	/nfs/dbraw/zinc/41/50/91/1309415091.db2.gz	MRZICUSGEMEHNG-KRWDZBQOSA-N	0	3	347.422	3.031	20	30		EGEDHN
N#Cc1ccc2c(c1)CCCC[C@@H]2NCc1ccc(-n2cncn2)nc1	ZINC000795778950	1309832244	/nfs/dbraw/zinc/83/22/44/1309832244.db2.gz	VOOAZTUSIUWZFF-IBGZPJMESA-N	0	3	344.422	3.091	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@H](C)[C@H]1OCCc2sccc21	ZINC000796739800	1310077151	/nfs/dbraw/zinc/07/71/51/1310077151.db2.gz	GDRVHFHBTHPGHH-DXCKQFNASA-N	0	3	348.468	3.013	20	30		EGEDHN
C=C1CCC(C(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)CC1	ZINC000897157069	1310202171	/nfs/dbraw/zinc/20/21/71/1310202171.db2.gz	DJQXQPQDZPJILT-INIZCTEOSA-N	0	3	327.472	3.470	20	30		EGEDHN
Cc1ccc(C(=O)Nc2ccc(CN3CCC(O)CC3)cc2)cc1C#N	ZINC000799716577	1310604890	/nfs/dbraw/zinc/60/48/90/1310604890.db2.gz	SQNVSBRMFICOEP-UHFFFAOYSA-N	0	3	349.434	3.076	20	30		EGEDHN
C=CCc1cc(CNCc2c(C)nc3ccccn32)cc(OC)c1O	ZINC000898275796	1310658378	/nfs/dbraw/zinc/65/83/78/1310658378.db2.gz	COELZMJZFBOLCU-UHFFFAOYSA-N	0	3	337.423	3.375	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N[C@@H](C)c1oc2ccccc2c1C	ZINC000836246937	1320464287	/nfs/dbraw/zinc/46/42/87/1320464287.db2.gz	MVWKRGUARWFRQM-HNNXBMFYSA-N	0	3	327.428	3.057	20	30		EGEDHN
C[C@H](C#N)OCCN(Cc1ccccc1)C[C@@H](O)c1cccs1	ZINC000801926894	1316966627	/nfs/dbraw/zinc/96/66/27/1316966627.db2.gz	YGGDFUJIZVDTKU-NVXWUHKLSA-N	0	3	330.453	3.212	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)C1)C(C)(C)C	ZINC001019042167	1317018787	/nfs/dbraw/zinc/01/87/87/1317018787.db2.gz	ACPHQKFEVHOAQY-CJNGLKHVSA-N	0	3	331.435	3.070	20	30		EGEDHN
C#C[C@@H](CCC)NC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F	ZINC000803191250	1317090488	/nfs/dbraw/zinc/09/04/88/1317090488.db2.gz	WKILNIZRVOSUFC-IRXDYDNUSA-N	0	3	334.410	3.062	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CC[C@H](NCc3cc(C)ccc3F)C2)cc1	ZINC001019224605	1317112604	/nfs/dbraw/zinc/11/26/04/1317112604.db2.gz	YPYRUIHSRNOINA-IBGZPJMESA-N	0	3	336.410	3.120	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](NCc2ccc(C(C)C)nc2C)C1	ZINC001019238246	1317117187	/nfs/dbraw/zinc/11/71/87/1317117187.db2.gz	SHDFPFRNOPEYGP-KRWDZBQOSA-N	0	3	329.488	3.416	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)c3ccoc3C3CC3)C2)s1	ZINC001019290740	1317147516	/nfs/dbraw/zinc/14/75/16/1317147516.db2.gz	HMYMZERSJSIXSV-ZDUSSCGKSA-N	0	3	341.436	3.094	20	30		EGEDHN
CCN1CC[C@H](N(C)C(=O)/C=C/C(=O)c2ccc(C)cc2)C[C@@H]1C	ZINC000900803594	1317342953	/nfs/dbraw/zinc/34/29/53/1317342953.db2.gz	ZVDSYHCUJFQKHV-FNPQLZQRSA-N	0	3	328.456	3.065	20	30		EGEDHN
C=C[C@@H](C(=O)N1CC[C@H](NCc2cnc(C)s2)C1)c1ccccc1	ZINC001019804934	1317432785	/nfs/dbraw/zinc/43/27/85/1317432785.db2.gz	MZSXMJRYAHFZBB-FUHWJXTLSA-N	0	3	341.480	3.112	20	30		EGEDHN
C#CCOc1ccc(CNCc2c(C)[nH]c(C(=O)OCC)c2C)cc1	ZINC000858172467	1328702701	/nfs/dbraw/zinc/70/27/01/1328702701.db2.gz	VJJMGOQQNHKIIE-UHFFFAOYSA-N	0	3	340.423	3.110	20	30		EGEDHN
CCN(Cc1cc(C#N)ccc1F)CC1CCN(C(=O)C(C)C)CC1	ZINC000957676871	1317549037	/nfs/dbraw/zinc/54/90/37/1317549037.db2.gz	GTZHTMFXHKPHNY-UHFFFAOYSA-N	0	3	345.462	3.414	20	30		EGEDHN
CC[C@H](C)N[C@H](CNC(=O)c1ccc(C)c(C#N)c1)c1ccco1	ZINC000807679190	1317576173	/nfs/dbraw/zinc/57/61/73/1317576173.db2.gz	GEGFGYYDMMYYEE-WMLDXEAASA-N	0	3	325.412	3.319	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)cc1C#N	ZINC000807703986	1317578615	/nfs/dbraw/zinc/57/86/15/1317578615.db2.gz	QIBLOAHYJBIELI-SFHVURJKSA-N	0	3	325.387	3.039	20	30		EGEDHN
C=CCn1c(C2CC2)nn(CN2CCN(C)C[C@@H]2CC(C)C)c1=S	ZINC000902541907	1317590604	/nfs/dbraw/zinc/59/06/04/1317590604.db2.gz	JLKXESROFPLKTR-INIZCTEOSA-N	0	3	349.548	3.097	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1C[C@H](NCc2cc(C)ccc2F)C1	ZINC001020241671	1317605934	/nfs/dbraw/zinc/60/59/34/1317605934.db2.gz	WNBKLDPZKBXDQR-QAQDUYKDSA-N	0	3	341.430	3.172	20	30		EGEDHN
CC[C@H](NCc1ccc(CS(C)(=O)=O)cc1)c1cccc(C#N)c1	ZINC000902756498	1317612415	/nfs/dbraw/zinc/61/24/15/1317612415.db2.gz	HNACXCQNKXLNRG-IBGZPJMESA-N	0	3	342.464	3.344	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@@H]1C[C@H](NCC1(C#N)CC1)C1CC1	ZINC000903106361	1317654304	/nfs/dbraw/zinc/65/43/04/1317654304.db2.gz	OKNNGBZURSPOHC-CVEARBPZSA-N	0	3	333.476	3.448	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2C[C@H](NCc3sccc3Cl)C2)cc1	ZINC001020457164	1317704414	/nfs/dbraw/zinc/70/44/14/1317704414.db2.gz	JAXNNPZZPDTVFH-SHTZXODSSA-N	0	3	344.867	3.433	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@H](NC(=O)C[C@H]3CC=CCC3)C2)c1	ZINC001020473291	1317710595	/nfs/dbraw/zinc/71/05/95/1317710595.db2.gz	VEFCHHWHLOTRSE-WBAXXEDZSA-N	0	3	341.430	3.181	20	30		EGEDHN
CC(=O)N(C)c1ccc(CNCc2ccc(O[C@H](C)C#N)cc2)cc1	ZINC000858249976	1328722365	/nfs/dbraw/zinc/72/23/65/1328722365.db2.gz	FLPYZLGNQHIZLT-OAHLLOKOSA-N	0	3	337.423	3.250	20	30		EGEDHN
CCC(=O)N1CCc2ccccc2[C@H]1CNCc1ccc(C#N)s1	ZINC000958766775	1317827991	/nfs/dbraw/zinc/82/79/91/1317827991.db2.gz	NUZXBBLSWOTBSV-GOSISDBHSA-N	0	3	339.464	3.245	20	30		EGEDHN
CC(C)n1ncc2cc(/C=C3/C(=O)c4ncnn4C3C)c(Cl)nc21	ZINC000905079886	1317921111	/nfs/dbraw/zinc/92/11/11/1317921111.db2.gz	GNNAIGIAQKODFA-NRIUJFNNSA-N	0	3	342.790	3.098	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)c2ccc(Cl)cc2)C1	ZINC001020959656	1318016019	/nfs/dbraw/zinc/01/60/19/1318016019.db2.gz	PTMNZIKMZFXMAC-JOCQHMNTSA-N	0	3	343.652	3.099	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccccc2C(F)(F)F)C1	ZINC001020959669	1318016241	/nfs/dbraw/zinc/01/62/41/1318016241.db2.gz	QJCBNDSVTGQIRP-XYPYZODXSA-N	0	3	332.753	3.308	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2csc3c2CC[C@H](C)C3)C1	ZINC001021012330	1318044532	/nfs/dbraw/zinc/04/45/32/1318044532.db2.gz	KGJAWANZBJQJBT-DRZSPHRISA-N	0	3	338.904	3.476	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)[C@H]2CCCCC2(C)C)C1	ZINC001021109501	1318091929	/nfs/dbraw/zinc/09/19/29/1318091929.db2.gz	AFERQHVVSUBHJP-MGPQQGTHSA-N	0	3	343.309	3.348	20	30		EGEDHN
Cc1ccc(C(=O)NC2C[C@H]3CC[C@@H](C2)N3Cc2cccc(C#N)c2)o1	ZINC001021183533	1318130236	/nfs/dbraw/zinc/13/02/36/1318130236.db2.gz	RFBVZLSUNDPXFN-YQQQUEKLSA-N	0	3	349.434	3.385	20	30		EGEDHN
N#Cc1cccc(C[NH2+]C[C@@H]2CCCCN2C(=O)c2ccccc2[O-])c1	ZINC000959885367	1318251298	/nfs/dbraw/zinc/25/12/98/1318251298.db2.gz	BCAOXNUWYFQQFI-SFHVURJKSA-N	0	3	349.434	3.048	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)C2=CCCC2)s1	ZINC000959958856	1318289749	/nfs/dbraw/zinc/28/97/49/1318289749.db2.gz	TVYKZTMLABHGFI-HNNXBMFYSA-N	0	3	329.469	3.201	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc3occc3c2)C1	ZINC001021594766	1318439821	/nfs/dbraw/zinc/43/98/21/1318439821.db2.gz	PRVOBTCAFQLLHN-RBUKOAKNSA-N	0	3	336.435	3.383	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cn(C)c2ccccc12	ZINC000960280920	1318442231	/nfs/dbraw/zinc/44/22/31/1318442231.db2.gz	OVURXDGJZCFQDQ-TZIWHRDSSA-N	0	3	345.446	3.350	20	30		EGEDHN
C=CCn1cccc1C(=O)NC1[C@H]2CN(C/C=C/c3ccccc3)C[C@@H]12	ZINC000960282697	1318443974	/nfs/dbraw/zinc/44/39/74/1318443974.db2.gz	QAFUWAYNIWQXJI-LPTQGICKSA-N	0	3	347.462	3.048	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1scnc1Cl	ZINC000960330929	1318464575	/nfs/dbraw/zinc/46/45/75/1318464575.db2.gz	WRMAXGGZEPLYDJ-ZIAGYGMSSA-N	0	3	347.871	3.358	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc(F)cc1F	ZINC000960330719	1318464733	/nfs/dbraw/zinc/46/47/33/1318464733.db2.gz	MWSKNICSBVEFQU-QZTJIDSGSA-N	0	3	328.362	3.136	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@H](C)n1c(C)ccc1C	ZINC000960335256	1318468441	/nfs/dbraw/zinc/46/84/41/1318468441.db2.gz	WAEZYLLYAFOTGI-PWIZWCRZSA-N	0	3	337.467	3.224	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(F)ccc2CC)C1	ZINC001021625361	1318475272	/nfs/dbraw/zinc/47/52/72/1318475272.db2.gz	PCOMALIPOKXUCF-PXNSSMCTSA-N	0	3	342.458	3.338	20	30		EGEDHN
COC[C@H](C)[C@H](C)C(=O)C(C#N)C(=O)Nc1cccc2ccccc21	ZINC000813059516	1318492821	/nfs/dbraw/zinc/49/28/21/1318492821.db2.gz	BBYNRRHVPNNEKK-GRDNDAEWSA-N	0	3	338.407	3.406	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cnc3ccccc3c2C)C1	ZINC001021637220	1318493291	/nfs/dbraw/zinc/49/32/91/1318493291.db2.gz	ZHBJDLUKKXYXTM-UTKZUKDTSA-N	0	3	347.462	3.103	20	30		EGEDHN
COc1ccc(CN(C)C[C@@H]2CCCN2C(=O)CC(C)C)cc1C#N	ZINC000960382614	1318511556	/nfs/dbraw/zinc/51/15/56/1318511556.db2.gz	IPPFLGNNZOZHKR-SFHVURJKSA-N	0	3	343.471	3.036	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(F)c(Cl)c2)C1	ZINC001021658626	1318519569	/nfs/dbraw/zinc/51/95/69/1318519569.db2.gz	OLULOYLPFAVIDG-WMLDXEAASA-N	0	3	334.822	3.039	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2cc(C)cc(C)c2)C1	ZINC001021666044	1318528353	/nfs/dbraw/zinc/52/83/53/1318528353.db2.gz	OBOVWMTWPVFBRB-LEWJYISDSA-N	0	3	338.495	3.182	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(F)ccc2Cl)C1	ZINC001021676820	1318543716	/nfs/dbraw/zinc/54/37/16/1318543716.db2.gz	NGJKOCCLSQGSIE-RDTXWAMCSA-N	0	3	348.849	3.429	20	30		EGEDHN
C/C(=C\C(=O)N1CCC[C@@H]1CN(C)Cc1cccc(C#N)c1)C1CC1	ZINC000960444893	1318567214	/nfs/dbraw/zinc/56/72/14/1318567214.db2.gz	NHXAJQLNRLPODI-MBNYPGIVSA-N	0	3	337.467	3.337	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(C(C)C)oc2C)C1	ZINC001021703642	1318574145	/nfs/dbraw/zinc/57/41/45/1318574145.db2.gz	ANXNKANGZBIXCQ-WMZOPIPTSA-N	0	3	328.456	3.271	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)Cc2cccc3ccccc32)C1	ZINC001021716167	1318596355	/nfs/dbraw/zinc/59/63/55/1318596355.db2.gz	CJXOUWLCKYPWMX-UNMCSNQZSA-N	0	3	346.474	3.328	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(CC)c(CC)o2)C1	ZINC001021718337	1318599514	/nfs/dbraw/zinc/59/95/14/1318599514.db2.gz	WWWZWUCGDIIDDI-MSOLQXFVSA-N	0	3	342.483	3.354	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2ccc(C)c(C)c2)C1	ZINC001021730052	1318632751	/nfs/dbraw/zinc/63/27/51/1318632751.db2.gz	KWJBQPNTHVQZPF-LEWJYISDSA-N	0	3	338.495	3.182	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2c[nH]c3c2cccc3CC)C1	ZINC001021742988	1318656265	/nfs/dbraw/zinc/65/62/65/1318656265.db2.gz	OJARJLRYHVVCLD-FXAWDEMLSA-N	0	3	349.478	3.290	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cccn2C(C)C)C1	ZINC001021744094	1318658415	/nfs/dbraw/zinc/65/84/15/1318658415.db2.gz	URAQDIBNIHJNDK-ROUUACIJSA-N	0	3	327.472	3.019	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)CC(C)(C)c2ccccc2)C1	ZINC001021743964	1318660321	/nfs/dbraw/zinc/66/03/21/1318660321.db2.gz	STLGYTORMONRJO-QUCCMNQESA-N	0	3	338.495	3.300	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@@H](NC(=O)C3CCCCC3)C2)c(F)c1	ZINC001021785514	1318682377	/nfs/dbraw/zinc/68/23/77/1318682377.db2.gz	GXKCSGJGNSXBEE-CALCHBBNSA-N	0	3	329.419	3.014	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)C2CCCCCC2)C1	ZINC001021887514	1318721016	/nfs/dbraw/zinc/72/10/16/1318721016.db2.gz	TYIQPPIFFFCEAU-OKILXGFUSA-N	0	3	329.282	3.102	20	30		EGEDHN
CN(Cc1cc2ccccc2o1)C[C@H]1CCCN1C(=O)C#CC1CC1	ZINC000960626677	1318752649	/nfs/dbraw/zinc/75/26/49/1318752649.db2.gz	KNCQXSBWWPDDLO-GOSISDBHSA-N	0	3	336.435	3.269	20	30		EGEDHN
CN(Cc1cccc(Cl)c1)C[C@@H]1CCCN1C(=O)C#CC1CC1	ZINC000960627849	1318754861	/nfs/dbraw/zinc/75/48/61/1318754861.db2.gz	SHBSRZZDYKMRLV-SFHVURJKSA-N	0	3	330.859	3.176	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cccc(C(F)F)c2F)C1	ZINC001022095504	1318795305	/nfs/dbraw/zinc/79/53/05/1318795305.db2.gz	SHVOJZXZMTZKCC-AOOOYVTPSA-N	0	3	332.753	3.366	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)NCC(=O)Nc1c(C)cccc1C	ZINC000912036156	1318796179	/nfs/dbraw/zinc/79/61/79/1318796179.db2.gz	HJXLDMYZRRWCPR-QGZVFWFLSA-N	0	3	347.503	3.436	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc(N2CCCC2=O)c(Cl)c1	ZINC000912174359	1318837913	/nfs/dbraw/zinc/83/79/13/1318837913.db2.gz	VOJPXHDUOMTXIN-AWEZNQCLSA-N	0	3	335.835	3.089	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)Nc1ccc(C(N)=O)c(Cl)c1	ZINC000912300921	1318862886	/nfs/dbraw/zinc/86/28/86/1318862886.db2.gz	LUXNFBCAAUZJLO-HNNXBMFYSA-N	0	3	339.867	3.455	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@@H](NC(=O)C[C@@H]3C=CCCC3)C2)c(F)c1	ZINC001022269571	1318867144	/nfs/dbraw/zinc/86/71/44/1318867144.db2.gz	BFCHJMCIJDDZCD-OLMNPRSZSA-N	0	3	341.430	3.181	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N(C)Cc1ccc(OC(F)(F)F)cc1	ZINC000912343083	1318875622	/nfs/dbraw/zinc/87/56/22/1318875622.db2.gz	NHRSOQTWXSTBHU-AWEZNQCLSA-N	0	3	330.350	3.227	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]1CN(C)Cc1ccc(C#N)cc1	ZINC000960787164	1318890757	/nfs/dbraw/zinc/89/07/57/1318890757.db2.gz	HRSHKKPWJLYSIA-GOSISDBHSA-N	0	3	325.456	3.193	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]1CN(C)Cc1ccc2c(c1)COC2	ZINC000960792268	1318897199	/nfs/dbraw/zinc/89/71/99/1318897199.db2.gz	UNIMFXLMDONPJI-LJQANCHMSA-N	0	3	342.483	3.352	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@H](C)c2ccc(Cl)cc2)C1	ZINC001022642279	1319033607	/nfs/dbraw/zinc/03/36/07/1319033607.db2.gz	PALMLAUEUBSDBI-DFBGVHRSSA-N	0	3	327.255	3.433	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@@H](NCc3cc(F)ccc3OC)C2)CC1	ZINC001022651798	1319042220	/nfs/dbraw/zinc/04/22/20/1319042220.db2.gz	NSBYUQKLRZJIBO-HDICACEKSA-N	0	3	346.446	3.318	20	30		EGEDHN
C=CCC(C)(C)c1noc([C@]2(O)CCN(Cc3ccccc3)C2)n1	ZINC000815708445	1319045540	/nfs/dbraw/zinc/04/55/40/1319045540.db2.gz	VVRHDWFNZCZJKM-IBGZPJMESA-N	0	3	327.428	3.017	20	30		EGEDHN
CC[C@H]1CCC[C@H]1C(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001022661362	1319049590	/nfs/dbraw/zinc/04/95/90/1319049590.db2.gz	LWIBKEWZPXYWBJ-DZJNRPSUSA-N	0	3	343.446	3.260	20	30		EGEDHN
C[C@H](CC(=O)N1CCC[C@H]1CN(C)Cc1ccc(C#N)cc1)C1CC1	ZINC000961042094	1319165873	/nfs/dbraw/zinc/16/58/73/1319165873.db2.gz	XQBVJJYDZHIHJY-UZLBHIALSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@@H](C)c2ccc(Cl)s2)C1	ZINC001022951600	1319186175	/nfs/dbraw/zinc/18/61/75/1319186175.db2.gz	BNHMVBTXPZANII-GARJFASQSA-N	0	3	333.284	3.494	20	30		EGEDHN
CC(=O)N1CCC[C@H]([C@@H]2CCN(CC#Cc3cccc(Cl)c3)C2)C1	ZINC000961079930	1319192743	/nfs/dbraw/zinc/19/27/43/1319192743.db2.gz	RFUGWFMYMRZZHZ-RBUKOAKNSA-N	0	3	344.886	3.272	20	30		EGEDHN
CC(=O)N1CCC[C@H]([C@H]2CCN(CC#Cc3ccc(Cl)cc3)C2)C1	ZINC000961095018	1319207452	/nfs/dbraw/zinc/20/74/52/1319207452.db2.gz	XSORVCDFBBFCLR-OALUTQOASA-N	0	3	344.886	3.272	20	30		EGEDHN
CCCC(=O)N1CCC[C@H]([C@H]2CCN(Cc3ccccc3C#N)C2)C1	ZINC000961100699	1319211868	/nfs/dbraw/zinc/21/18/68/1319211868.db2.gz	RAEGVIUYIMMFLD-PMACEKPBSA-N	0	3	339.483	3.419	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H](CNC(=O)[C@@H]3CC=CCC3)C2)cc1	ZINC001023229651	1319368505	/nfs/dbraw/zinc/36/85/05/1319368505.db2.gz	MBMBJBLJWGCYEV-WOJBJXKFSA-N	0	3	337.467	3.243	20	30		EGEDHN
CC(=O)N1CCC([C@@H]2CCCN(Cc3ccccc3C#N)C2)CC1	ZINC000961302807	1319463036	/nfs/dbraw/zinc/46/30/36/1319463036.db2.gz	DIVUSYLGHURFSN-LJQANCHMSA-N	0	3	325.456	3.029	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](C2CCN(C(=O)C(C)(C)F)CC2)C1	ZINC000961303331	1319463810	/nfs/dbraw/zinc/46/38/10/1319463810.db2.gz	BCKFHXSIHIRJOY-HNNXBMFYSA-N	0	3	330.875	3.438	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](C2CCN(C(=O)CSC)CC2)C1	ZINC000961324982	1319483816	/nfs/dbraw/zinc/48/38/16/1319483816.db2.gz	YJQPUMDWUCAIRG-OAHLLOKOSA-N	0	3	330.925	3.053	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](C2CCN(C(=O)c3cccn3C)CC2)C1	ZINC000961330509	1319486481	/nfs/dbraw/zinc/48/64/81/1319486481.db2.gz	KPXCNVVZFRLFRJ-QGZVFWFLSA-N	0	3	349.906	3.342	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)[C@@H]2CCCC[C@H]2C(F)(F)F)C1	ZINC001023424465	1319525867	/nfs/dbraw/zinc/52/58/67/1319525867.db2.gz	ZBUYDDJUXJDHHT-BZUAXINKSA-N	0	3	344.421	3.207	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc3c([nH]2)c(F)ccc3C)C1	ZINC001023453931	1319555794	/nfs/dbraw/zinc/55/57/94/1319555794.db2.gz	LFUAOQNBLDOZII-HNNXBMFYSA-N	0	3	341.430	3.081	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc3ccccc3cc2F)C1	ZINC001023484761	1319589071	/nfs/dbraw/zinc/58/90/71/1319589071.db2.gz	QNYSVLDZFMUONW-MRXNPFEDSA-N	0	3	338.426	3.444	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)[C@H]2CCc3c2cccc3Cl)C1	ZINC001023492741	1319597472	/nfs/dbraw/zinc/59/74/72/1319597472.db2.gz	CHNWVQCXHXIAQK-QAPCUYQASA-N	0	3	344.886	3.221	20	30		EGEDHN
C#CCN1CCC[C@H](CNC(=O)c2cc(C3CC3)oc2C2CC2)C1	ZINC001023494795	1319604436	/nfs/dbraw/zinc/60/44/36/1319604436.db2.gz	QRUPBKNILQUWQR-CQSZACIVSA-N	0	3	326.440	3.109	20	30		EGEDHN
N#Cc1ccc(F)c(CNCC2CC(NC(=O)c3ccsc3)C2)c1	ZINC000961523055	1319630782	/nfs/dbraw/zinc/63/07/82/1319630782.db2.gz	INGZSNFMCQBXLF-UHFFFAOYSA-N	0	3	343.427	3.057	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CCCN(Cc3ncccc3C)C2)CC1	ZINC001023573314	1319691047	/nfs/dbraw/zinc/69/10/47/1319691047.db2.gz	WRGCXCMTDMHLNN-SFHVURJKSA-N	0	3	341.499	3.465	20	30		EGEDHN
C#CCOc1ccccc1CNc1ccc(N2CCN(CC)CC2)cc1	ZINC000916840737	1319712715	/nfs/dbraw/zinc/71/27/15/1319712715.db2.gz	WXXSZYZJNQLQAW-UHFFFAOYSA-N	0	3	349.478	3.453	20	30		EGEDHN
C=Cc1ccc(C(=O)N[C@@H]2[C@H]3CN(Cc4ccc(C#N)cc4)C[C@H]32)cc1	ZINC000961872631	1319756679	/nfs/dbraw/zinc/75/66/79/1319756679.db2.gz	PEZYBSGWPZYKNB-AERCQKQUSA-N	0	3	343.430	3.061	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc3cccc(F)c3o2)C1	ZINC001023758661	1319904445	/nfs/dbraw/zinc/90/44/45/1319904445.db2.gz	ZFFWQZCJKQHPDU-CQSZACIVSA-N	0	3	328.387	3.037	20	30		EGEDHN
C#C[C@H](NC(=O)N(CCN(C)C)Cc1ccccc1)c1ccccc1	ZINC000820605007	1319920866	/nfs/dbraw/zinc/92/08/66/1319920866.db2.gz	IVKYLDDVGQDXEL-FQEVSTJZSA-N	0	3	335.451	3.134	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc(-c3ccccc3)co2)C1	ZINC001023785166	1319933069	/nfs/dbraw/zinc/93/30/69/1319933069.db2.gz	GLQMFOLNKMOXOG-QGZVFWFLSA-N	0	3	336.435	3.412	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCN(C(=O)c2cccs2)C1	ZINC001023821043	1319966618	/nfs/dbraw/zinc/96/66/18/1319966618.db2.gz	SDUDVMQFVKGELA-HNNXBMFYSA-N	0	3	339.464	3.262	20	30		EGEDHN
CC(C)(C)CC(=O)N1CCC[C@H](CNCc2ccccc2C#N)C1	ZINC001023841615	1319982548	/nfs/dbraw/zinc/98/25/48/1319982548.db2.gz	WFTSARSTDREDTF-MRXNPFEDSA-N	0	3	327.472	3.323	20	30		EGEDHN
C#CC[C@H](CO)NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1	ZINC000821207772	1320003632	/nfs/dbraw/zinc/00/36/32/1320003632.db2.gz	XXVSBKKDLFXDKB-LJQANCHMSA-N	0	3	349.409	3.152	20	30		EGEDHN
CSc1ccc([C@@H](C/N=C/c2ccc(O)c(O)c2O)N(C)C)cc1	ZINC000840707104	1321131327	/nfs/dbraw/zinc/13/13/27/1321131327.db2.gz	SHXMMFPMRBTBAM-GDXCHIGESA-N	0	3	346.452	3.247	20	30		EGEDHN
C#Cc1ccc(CN[C@@H](c2ccccc2)C2(CO)CCOCC2)cc1	ZINC000840972267	1321191188	/nfs/dbraw/zinc/19/11/88/1321191188.db2.gz	IUQCCSMTCCRBPJ-NRFANRHFSA-N	0	3	335.447	3.288	20	30		EGEDHN
CCCCCCCC[C@H](C)CC(=O)N1CC[C@H](N2CC[C@@H](O)C2)C1	ZINC000861714196	1329437619	/nfs/dbraw/zinc/43/76/19/1329437619.db2.gz	JAGLBLWJXGBUIT-GBESFXJTSA-N	0	3	338.536	3.431	20	30		EGEDHN
COc1ccc(CNCc2cn(C)nc2-c2ccc(C)o2)cc1C#N	ZINC000842692110	1321420204	/nfs/dbraw/zinc/42/02/04/1321420204.db2.gz	AYUAJIKJSLAESQ-UHFFFAOYSA-N	0	3	336.395	3.159	20	30		EGEDHN
C#CCOc1ccc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)cc1	ZINC000844377650	1321595618	/nfs/dbraw/zinc/59/56/18/1321595618.db2.gz	HYCSMMKOZURWTH-HUUCEWRRSA-N	0	3	341.329	3.385	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)CCc1c(Cl)cccc1Cl	ZINC000847624267	1321885754	/nfs/dbraw/zinc/88/57/54/1321885754.db2.gz	NFWRMSCMCNJHEH-LLVKDONJSA-N	0	3	327.211	3.159	20	30		EGEDHN
CC(=O)CCCC(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847747940	1321900351	/nfs/dbraw/zinc/90/03/51/1321900351.db2.gz	SZEFQSJIZCLQFH-UHFFFAOYSA-N	0	3	342.439	3.095	20	30		EGEDHN
CS/C=C\C(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847749582	1321900840	/nfs/dbraw/zinc/90/08/40/1321900840.db2.gz	VSTQFEYDXRTGPU-GHXNOFRVSA-N	0	3	330.453	3.212	20	30		EGEDHN
COC(=O)Cc1ccccc1CN[C@H](C)c1ccc(C#N)c(F)c1	ZINC000848572897	1321978875	/nfs/dbraw/zinc/97/88/75/1321978875.db2.gz	MWPBKQAESXXCMW-CYBMUJFWSA-N	0	3	326.371	3.264	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC[C@H](CNCc2cc(C)no2)C1	ZINC001024004266	1323076590	/nfs/dbraw/zinc/07/65/90/1323076590.db2.gz	YYHXIPDYEPFARX-CQSZACIVSA-N	0	3	339.867	3.090	20	30		EGEDHN
CN(C(=O)OC(C)(C)C)[C@H]1CCN(CCc2ccc(C#N)cc2)C1	ZINC000851804696	1323091634	/nfs/dbraw/zinc/09/16/34/1323091634.db2.gz	TVUKXJZHNBUNSY-KRWDZBQOSA-N	0	3	329.444	3.042	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@H](CNCc3nccs3)C2)CC1	ZINC001024133124	1323156852	/nfs/dbraw/zinc/15/68/52/1323156852.db2.gz	IFDNJANPNFWBNU-OAHLLOKOSA-N	0	3	333.501	3.218	20	30		EGEDHN
C[C@H](CC(=O)N1CCC[C@@H](CNCc2ccccc2C#N)C1)C1CC1	ZINC001024280607	1323258639	/nfs/dbraw/zinc/25/86/39/1323258639.db2.gz	DKLIBWFJRMEOBR-SJORKVTESA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)C2=COCCC2)C1	ZINC000963262036	1323276576	/nfs/dbraw/zinc/27/65/76/1323276576.db2.gz	DFCQHVDMFDNXNQ-RDJZCZTQSA-N	0	3	338.879	3.136	20	30		EGEDHN
CCc1cccc(CC)c1NC(=O)C(C#N)C(=O)Cc1cscn1	ZINC000853098126	1323281738	/nfs/dbraw/zinc/28/17/38/1323281738.db2.gz	HJXJHXPHZNFUCY-OAHLLOKOSA-N	0	3	341.436	3.158	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cnn(CC(C)C)c1CC	ZINC001024434780	1323393604	/nfs/dbraw/zinc/39/36/04/1323393604.db2.gz	HVIOKQWYSQSWTE-QGZVFWFLSA-N	0	3	346.519	3.262	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cc(Cl)c(Cl)n1C	ZINC001024469126	1323424497	/nfs/dbraw/zinc/42/44/97/1323424497.db2.gz	VMJCVWVNMHDSNT-LBPRGKRZSA-N	0	3	344.286	3.492	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1c(C)nn(C(C)(C)C)c1C	ZINC001024469611	1323424511	/nfs/dbraw/zinc/42/45/11/1323424511.db2.gz	UDKSYOAODAJUCR-KRWDZBQOSA-N	0	3	346.519	3.415	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccc2c(c1)OCCCO2	ZINC001024480366	1323434024	/nfs/dbraw/zinc/43/40/24/1323434024.db2.gz	IAHTXHPHFFOEBQ-QGZVFWFLSA-N	0	3	344.455	3.008	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cncn1-c1ccccc1	ZINC001024480285	1323435534	/nfs/dbraw/zinc/43/55/34/1323435534.db2.gz	GAHCNDUINLMYDE-SFHVURJKSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=C(C)CCN1CCCC[C@H]1CNC(=O)c1sc2nccn2c1C	ZINC001024485847	1323440276	/nfs/dbraw/zinc/44/02/76/1323440276.db2.gz	ULXHLSFDHVZUAK-HNNXBMFYSA-N	0	3	346.500	3.255	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1[nH]c2ccccc2c1Cl	ZINC001024529919	1323475142	/nfs/dbraw/zinc/47/51/42/1323475142.db2.gz	ABJRICWJVGCTBS-AWEZNQCLSA-N	0	3	343.858	3.429	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cc(Cl)c(Cl)[nH]1	ZINC001024578213	1323515546	/nfs/dbraw/zinc/51/55/46/1323515546.db2.gz	NZIPYXFUVVMYLH-NSHDSACASA-N	0	3	330.259	3.482	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccc2nc(C)ccc2c1	ZINC001024724615	1323626220	/nfs/dbraw/zinc/62/62/20/1323626220.db2.gz	YANWQKJVZGNMOC-LJQANCHMSA-N	0	3	335.451	3.151	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cncc(C(F)(F)F)c1	ZINC001024743245	1323641469	/nfs/dbraw/zinc/64/14/69/1323641469.db2.gz	FFNFPUKOPUIVBM-OAHLLOKOSA-N	0	3	341.377	3.261	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1cc(C)n(CC2CC2)c1C	ZINC001024759194	1323659488	/nfs/dbraw/zinc/65/94/88/1323659488.db2.gz	GFTHCKAXTPBXCI-LJQANCHMSA-N	0	3	341.499	3.123	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1csc2c1CC[C@@H](C)C2	ZINC001024787179	1323692204	/nfs/dbraw/zinc/69/22/04/1323692204.db2.gz	ZAUFXSRXYYMYRX-CVEARBPZSA-N	0	3	344.524	3.481	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cc(OC)c(C)c(OC)c1	ZINC001024790238	1323693735	/nfs/dbraw/zinc/69/37/35/1323693735.db2.gz	DQMMJUGBSWJNAK-QGZVFWFLSA-N	0	3	346.471	3.173	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccc(OCC2CC2)cc1	ZINC001024805143	1323709319	/nfs/dbraw/zinc/70/93/19/1323709319.db2.gz	QMJSHXOFBHBLJN-IBGZPJMESA-N	0	3	340.467	3.083	20	30		EGEDHN
C=CCCN1CCCC[C@H]1CNC(=O)c1cc(C2CCCC2)no1	ZINC001024807206	1323711050	/nfs/dbraw/zinc/71/10/50/1323711050.db2.gz	RFKMZDZAJCGVSO-INIZCTEOSA-N	0	3	331.460	3.493	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)CC2CCC2)c(F)c1	ZINC001024913413	1323777939	/nfs/dbraw/zinc/77/79/39/1323777939.db2.gz	DRBGZXLRBAGXHM-GOSISDBHSA-N	0	3	343.446	3.358	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)s1	ZINC001024925067	1323787477	/nfs/dbraw/zinc/78/74/77/1323787477.db2.gz	ZGJPPXXQQHIPQY-CYBMUJFWSA-N	0	3	335.448	3.354	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)s1	ZINC001025040539	1323843740	/nfs/dbraw/zinc/84/37/40/1323843740.db2.gz	GCGGWLKREKPXTN-CQSZACIVSA-N	0	3	331.485	3.303	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCCC[C@@H]2CNCc2cc(C)ns2)C1	ZINC001025076914	1323879331	/nfs/dbraw/zinc/87/93/31/1323879331.db2.gz	VYDFATFFZGZSGY-OAHLLOKOSA-N	0	3	333.501	3.279	20	30		EGEDHN
COc1ccc(C#N)cc1CNC[C@H]1CCCCN1C(=O)C(C)(C)C	ZINC001025145443	1323920791	/nfs/dbraw/zinc/92/07/91/1323920791.db2.gz	JWXMUBKYARMXAR-QGZVFWFLSA-N	0	3	343.471	3.084	20	30		EGEDHN
CC(=O)N1CCCC[C@H]1[C@H]1CCCN1Cc1ccc(C#N)c(F)c1	ZINC001025178520	1323944253	/nfs/dbraw/zinc/94/42/53/1323944253.db2.gz	DCYSRLQZZQIMHE-MOPGFXCFSA-N	0	3	329.419	3.063	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H]2[C@H]2CCCCN2C(=O)C(F)F)cc1	ZINC001025186157	1323957870	/nfs/dbraw/zinc/95/78/70/1323957870.db2.gz	XFXHUKZSGGNIFU-DLBZAZTESA-N	0	3	347.409	3.169	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccoc1CC	ZINC001025228998	1324015039	/nfs/dbraw/zinc/01/50/39/1324015039.db2.gz	FMVFVEMTDIZCBQ-MSOLQXFVSA-N	0	3	328.456	3.324	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccn(CC(C)C)n1	ZINC001025236810	1324026132	/nfs/dbraw/zinc/02/61/32/1324026132.db2.gz	HYQXZAONHFPMHU-OALUTQOASA-N	0	3	344.503	3.184	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1c(C)[nH]nc1Cl	ZINC001025237701	1324028616	/nfs/dbraw/zinc/02/86/16/1324028616.db2.gz	OEDJXITWRKYGCY-KGLIPLIRSA-N	0	3	336.867	3.017	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cnc(C2CC2)o1	ZINC001025240095	1324033292	/nfs/dbraw/zinc/03/32/92/1324033292.db2.gz	LBYKLIMPVDTUEL-JKSUJKDBSA-N	0	3	329.444	3.197	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)COC1CCCCC1	ZINC001025245544	1324042710	/nfs/dbraw/zinc/04/27/10/1324042710.db2.gz	NYFRARDIISRLLQ-VQTJNVASSA-N	0	3	346.515	3.205	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ncc(F)cc1F	ZINC001025246344	1324046399	/nfs/dbraw/zinc/04/63/99/1324046399.db2.gz	WCXGHJNYIAIBLB-HOTGVXAUSA-N	0	3	335.398	3.005	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc(C)c(F)c1	ZINC001025250692	1324053064	/nfs/dbraw/zinc/05/30/64/1324053064.db2.gz	MPZOSVNNVRMEOT-RBUKOAKNSA-N	0	3	328.431	3.226	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1c(C)cc(C)nc1C	ZINC001025253860	1324059558	/nfs/dbraw/zinc/05/95/58/1324059558.db2.gz	XMQAPDUDJQUULN-MOPGFXCFSA-N	0	3	339.483	3.099	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(F)ccc1C	ZINC001025255488	1324062582	/nfs/dbraw/zinc/06/25/82/1324062582.db2.gz	QVHGGZSXIMBYNU-OALUTQOASA-N	0	3	328.431	3.226	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cccc2cc[nH]c21	ZINC001025271176	1324086164	/nfs/dbraw/zinc/08/61/64/1324086164.db2.gz	HFUZJSICZOXXJB-RTBURBONSA-N	0	3	335.451	3.260	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)C1CCC(F)(F)CC1	ZINC001025273529	1324089205	/nfs/dbraw/zinc/08/92/05/1324089205.db2.gz	PVTOERAQFLIGRE-IRXDYDNUSA-N	0	3	338.442	3.291	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1noc2c1CCCC2	ZINC001025274062	1324090479	/nfs/dbraw/zinc/09/04/79/1324090479.db2.gz	UAXOHYDSUQKHMG-IAGOWNOFSA-N	0	3	343.471	3.199	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc2ccccn2c1	ZINC001025274650	1324093024	/nfs/dbraw/zinc/09/30/24/1324093024.db2.gz	LVAXEPMNSZSEKE-LEWJYISDSA-N	0	3	349.478	3.422	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cnoc1C1CC1	ZINC001025284211	1324105219	/nfs/dbraw/zinc/10/52/19/1324105219.db2.gz	FHLSVYGBMXOZEE-SJORKVTESA-N	0	3	329.444	3.197	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1csc(Cl)n1	ZINC001025283985	1324105233	/nfs/dbraw/zinc/10/52/33/1324105233.db2.gz	DBPVWTPWXHVEIU-UONOGXRCSA-N	0	3	339.892	3.442	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cccc2ccncc21	ZINC001025287500	1324108545	/nfs/dbraw/zinc/10/85/45/1324108545.db2.gz	OLKYZPVEDHRJOM-LEWJYISDSA-N	0	3	347.462	3.327	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ncoc1C(C)C	ZINC001025286889	1324108664	/nfs/dbraw/zinc/10/86/64/1324108664.db2.gz	LYAXBCPREBJVQB-SJORKVTESA-N	0	3	343.471	3.280	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1sccc1OC	ZINC001025289957	1324114983	/nfs/dbraw/zinc/11/49/83/1324114983.db2.gz	VWNFDIYPTWUMEB-LSDHHAIUSA-N	0	3	334.485	3.402	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc(Cl)cn1	ZINC001025292464	1324116659	/nfs/dbraw/zinc/11/66/59/1324116659.db2.gz	JCAWEXQLVGFPRD-IAGOWNOFSA-N	0	3	333.863	3.380	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)Cc1c[nH]c2ccccc12	ZINC001025293677	1324121728	/nfs/dbraw/zinc/12/17/28/1324121728.db2.gz	UFFUMNHKRPDHAI-SFTDATJTSA-N	0	3	349.478	3.189	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(F)cc(F)c1	ZINC001025296790	1324127751	/nfs/dbraw/zinc/12/77/51/1324127751.db2.gz	LLMWGYUTZGAQFZ-MSOLQXFVSA-N	0	3	332.394	3.057	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)Cc1ccc(C)c(C)c1	ZINC001025298247	1324131391	/nfs/dbraw/zinc/13/13/91/1324131391.db2.gz	VNGPJXKXPHOIMC-LEWJYISDSA-N	0	3	338.495	3.325	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cnc(CC)s1	ZINC001025301612	1324134752	/nfs/dbraw/zinc/13/47/52/1324134752.db2.gz	MWQDVIMBCAICMH-CABCVRRESA-N	0	3	333.501	3.351	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1c(C)cccc1F	ZINC001025303143	1324137111	/nfs/dbraw/zinc/13/71/11/1324137111.db2.gz	FELSNZAKUPMFCM-ROUUACIJSA-N	0	3	328.431	3.226	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2sc(C3CC3)nc2C)C1	ZINC001025418921	1324249732	/nfs/dbraw/zinc/24/97/32/1324249732.db2.gz	GFRTZDHHTLVREP-BBRMVZONSA-N	0	3	345.512	3.183	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccoc2C(F)(F)F)C1	ZINC001025432075	1324267965	/nfs/dbraw/zinc/26/79/65/1324267965.db2.gz	RTKILOLWWRMERQ-STQMWFEESA-N	0	3	342.361	3.152	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)[C@H]2CC[C@H](C3CCC3)CC2)C1	ZINC001025446200	1324287783	/nfs/dbraw/zinc/28/77/83/1324287783.db2.gz	YOZKXIXGHQCHAM-FRYIKTPZSA-N	0	3	330.516	3.443	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccccc2C(C)(C)C)C1	ZINC001025450746	1324293448	/nfs/dbraw/zinc/29/34/48/1324293448.db2.gz	MMPDNZGIVLJJOP-DLBZAZTESA-N	0	3	326.484	3.448	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(C)c3ccccc3n2)C1	ZINC001025457755	1324299982	/nfs/dbraw/zinc/29/99/82/1324299982.db2.gz	FHAXZTOTRVYFQG-SJORKVTESA-N	0	3	335.451	3.007	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2[nH]c3ccccc3c2Cl)C1	ZINC001025469487	1324314913	/nfs/dbraw/zinc/31/49/13/1324314913.db2.gz	PVHLSRGHCFFZQQ-KBPBESRZSA-N	0	3	343.858	3.285	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cccc(-n3cccc3)c2)C1	ZINC001025475148	1324320542	/nfs/dbraw/zinc/32/05/42/1324320542.db2.gz	RSKOVZWTPMQHOF-AZUAARDMSA-N	0	3	349.478	3.331	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(C)c3cccnc23)C1	ZINC001025491594	1324341689	/nfs/dbraw/zinc/34/16/89/1324341689.db2.gz	ZLKSHVYTHHEIDM-MSOLQXFVSA-N	0	3	349.478	3.397	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2sccc2-n2cccc2)C1	ZINC001025493542	1324344883	/nfs/dbraw/zinc/34/48/83/1324344883.db2.gz	PAKCIQPFUXBQNX-CVEARBPZSA-N	0	3	341.480	3.002	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(C3CC3)nc2C)C1	ZINC001025533482	1324378616	/nfs/dbraw/zinc/37/86/16/1324378616.db2.gz	FDKLNTRGVUBBGH-CRAIPNDOSA-N	0	3	339.483	3.121	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc3occc3s2)C1	ZINC001025534922	1324382113	/nfs/dbraw/zinc/38/21/13/1324382113.db2.gz	RDIVXGUCVSIVAF-ZIAGYGMSSA-N	0	3	330.453	3.348	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(C(C)(C)C)oc2C)C1	ZINC001025545596	1324393301	/nfs/dbraw/zinc/39/33/01/1324393301.db2.gz	KINKIYAXYCVGQI-GDBMZVCRSA-N	0	3	330.472	3.349	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(C)c(OCC)c2)C1	ZINC001025548427	1324396898	/nfs/dbraw/zinc/39/68/98/1324396898.db2.gz	ISJRBEGIVLPRIE-PKOBYXMFSA-N	0	3	342.483	3.247	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc3ccn(C)c3c2)C1	ZINC001025586813	1324430335	/nfs/dbraw/zinc/43/03/35/1324430335.db2.gz	FXEGPPNPVIOAGY-APWZRJJASA-N	0	3	337.467	3.032	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2csc3c2CCCC3)C1	ZINC001025613733	1324465962	/nfs/dbraw/zinc/46/59/62/1324465962.db2.gz	ZUFWIDAQCKELKP-HOTGVXAUSA-N	0	3	344.524	3.481	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(Cl)ccc2OC)C1	ZINC001025614979	1324468283	/nfs/dbraw/zinc/46/82/83/1324468283.db2.gz	QTTOPLJVPMOYCO-CABCVRRESA-N	0	3	348.874	3.202	20	30		EGEDHN
N#Cc1ccccc1CNC1CCC(NC(=O)[C@@H]2CCC2(F)F)CC1	ZINC001026512456	1324858096	/nfs/dbraw/zinc/85/80/96/1324858096.db2.gz	HGFSMBHKIWACRX-JCYILVPMSA-N	0	3	347.409	3.121	20	30		EGEDHN
C=C1CCC(C(=O)NC2CCC(NCc3cc(C)ncn3)CC2)CC1	ZINC001026554132	1324890342	/nfs/dbraw/zinc/89/03/42/1324890342.db2.gz	JVLAIMUWHNQTOW-UHFFFAOYSA-N	0	3	342.487	3.048	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCN(C(=O)C2CCCCCC2)C1	ZINC001026725076	1324993413	/nfs/dbraw/zinc/99/34/13/1324993413.db2.gz	HGMDNJKJHNAMDA-QGZVFWFLSA-N	0	3	339.483	3.467	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCN(C(=O)CCC2CCC2)C1	ZINC001026760493	1325007562	/nfs/dbraw/zinc/00/75/62/1325007562.db2.gz	BNCOXJVRNRUAOL-QGZVFWFLSA-N	0	3	325.456	3.077	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)c2ccncc2C)C1	ZINC000963291093	1325077553	/nfs/dbraw/zinc/07/75/53/1325077553.db2.gz	SCOQYGYLPXGKIV-SJLPKXTDSA-N	0	3	347.890	3.459	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)c2ccncc2C)C1	ZINC000963291094	1325078391	/nfs/dbraw/zinc/07/83/91/1325078391.db2.gz	SCOQYGYLPXGKIV-WMZOPIPTSA-N	0	3	347.890	3.459	20	30		EGEDHN
CC1(C(=O)N2CC[C@@H](CNCc3ccccc3C#N)C2)CCCC1	ZINC001026978179	1325121178	/nfs/dbraw/zinc/12/11/78/1325121178.db2.gz	JUIHEWQAVGZWAZ-INIZCTEOSA-N	0	3	325.456	3.077	20	30		EGEDHN
N#Cc1ncc(Br)cc1N[C@H]1CCCN2CCCC[C@H]12	ZINC000853717504	1325152105	/nfs/dbraw/zinc/15/21/05/1325152105.db2.gz	GCBRFBHFMUIGHO-SWLSCSKDSA-N	0	3	335.249	3.145	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)Cc2ccco2)C1	ZINC000963374706	1325181173	/nfs/dbraw/zinc/18/11/73/1325181173.db2.gz	RXSBZRXMDYRYEX-RDJZCZTQSA-N	0	3	336.863	3.278	20	30		EGEDHN
CC1(C)CC[C@H](C(=O)N2CC[C@H](CNCc3ccccc3C#N)C2)C1	ZINC001027045328	1325181733	/nfs/dbraw/zinc/18/17/33/1325181733.db2.gz	QSYCCZURAAESAS-SJORKVTESA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](CNCc3oc(CCC)nc3C)C2)C1	ZINC001027050530	1325189280	/nfs/dbraw/zinc/18/92/80/1325189280.db2.gz	DLUVLPXDMKVTIH-INIZCTEOSA-N	0	3	345.487	3.230	20	30		EGEDHN
Cc1ccccc1CC(=O)N1CC[C@@H](CNCc2ccccc2C#N)C1	ZINC001027208470	1325309319	/nfs/dbraw/zinc/30/93/19/1325309319.db2.gz	DMKWGSAQYXAQAV-SFHVURJKSA-N	0	3	347.462	3.048	20	30		EGEDHN
CCC(C)(CC)C(=O)N1CC[C@H](CNCc2ccccc2C#N)C1	ZINC001027226961	1325320154	/nfs/dbraw/zinc/32/01/54/1325320154.db2.gz	PNOSGCZIHDDCLC-MRXNPFEDSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1cc(C)cc(C)n1)C2	ZINC000964142979	1325482728	/nfs/dbraw/zinc/48/27/28/1325482728.db2.gz	HWDQVDQKZKFJRX-UHFFFAOYSA-N	0	3	333.863	3.082	20	30		EGEDHN
CN(C(=O)C(C)(C)C)C1CCC(NCc2ccccc2C#N)CC1	ZINC000964239412	1325490982	/nfs/dbraw/zinc/49/09/82/1325490982.db2.gz	LKTVLPFZEDMOAX-UHFFFAOYSA-N	0	3	327.472	3.464	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)CCc2ccc(C(C)C)cc2)C1	ZINC001027489310	1327748711	/nfs/dbraw/zinc/74/87/11/1327748711.db2.gz	AMSFBXKTKNFWSU-HXUWFJFHSA-N	0	3	326.484	3.299	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)c2cc(C3CC3)oc2C2CC2)C1	ZINC001027501019	1327764533	/nfs/dbraw/zinc/76/45/33/1327764533.db2.gz	PQWYPULZDXXTOH-MRXNPFEDSA-N	0	3	326.440	3.204	20	30		EGEDHN
CN(Cc1ccc(F)c(C#N)c1)[C@H]1CCCN(C(=O)C2(C)CCC2)C1	ZINC001027528546	1327806272	/nfs/dbraw/zinc/80/62/72/1327806272.db2.gz	XIEMJROUYMGXNJ-KRWDZBQOSA-N	0	3	343.446	3.310	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)[C@@H]2C[C@H]2c2ccc3ccccc3c2)C1	ZINC001027619106	1327983705	/nfs/dbraw/zinc/98/37/05/1327983705.db2.gz	CLIKMUHKOZKGEV-BHIFYINESA-N	0	3	346.474	3.499	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)[C@H](CC)Cc2ccccc2C)C1	ZINC001027650080	1328031281	/nfs/dbraw/zinc/03/12/81/1328031281.db2.gz	AKTNTOGKXOOZAS-UYAOXDASSA-N	0	3	326.484	3.120	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1ccccc1OC)C2	ZINC000965877741	1328070520	/nfs/dbraw/zinc/07/05/20/1328070520.db2.gz	ZWSJMMPYCHOXOH-UHFFFAOYSA-N	0	3	334.847	3.078	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1ccc(OC)cc1)C2	ZINC000965882914	1328074946	/nfs/dbraw/zinc/07/49/46/1328074946.db2.gz	SZTZMHQREQPFQA-UHFFFAOYSA-N	0	3	334.847	3.078	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2c(F)c(F)cc(F)c2F)C1	ZINC000966260877	1328241106	/nfs/dbraw/zinc/24/11/06/1328241106.db2.gz	GFAOAQFSHSDTDJ-ZWNOBZJWSA-N	0	3	344.352	3.259	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2nsc3ccccc32)C1	ZINC000966296975	1328257451	/nfs/dbraw/zinc/25/74/51/1328257451.db2.gz	KUEXELWAVXKTNA-DZGCQCFKSA-N	0	3	329.469	3.313	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)[C@@H]1CC[C@H](c2ccccc2)O1	ZINC001027887062	1328354454	/nfs/dbraw/zinc/35/44/54/1328354454.db2.gz	HDPGKICHGZDTAO-QRVBRYPASA-N	0	3	328.456	3.063	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NC[C@H]1CCCN1Cc1ccc(C)cc1	ZINC001027889531	1328355403	/nfs/dbraw/zinc/35/54/03/1328355403.db2.gz	BRKFMTGMVXHSRY-AQNXPRMDSA-N	0	3	342.483	3.057	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NC[C@H]1CCCN1Cc1csc(C)c1	ZINC001027891522	1328359048	/nfs/dbraw/zinc/35/90/48/1328359048.db2.gz	ZQFZUHSSEPDSCY-KURKYZTESA-N	0	3	348.512	3.118	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1c(C)nn(C(C)(C)C)c1C	ZINC001027916403	1328392487	/nfs/dbraw/zinc/39/24/87/1328392487.db2.gz	LCBZPUDUCGQBBR-INIZCTEOSA-N	0	3	332.492	3.025	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2cn(C)c3ccc(F)cc23)C1	ZINC000966787645	1328412356	/nfs/dbraw/zinc/41/23/56/1328412356.db2.gz	QCPWQTIZOIHERC-KBXCAEBGSA-N	0	3	343.446	3.334	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2cnc(-c3ccccc3)o2)C1	ZINC000966884706	1328451757	/nfs/dbraw/zinc/45/17/57/1328451757.db2.gz	PYHDNUXVBRZVAG-NVXWUHKLSA-N	0	3	339.439	3.358	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NC[C@H]1CCCN1CC=C(C)C	ZINC001027977284	1328452906	/nfs/dbraw/zinc/45/29/06/1328452906.db2.gz	OYUFDDHVROBVCZ-QGZVFWFLSA-N	0	3	328.456	3.412	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2cccc3ccc(C)nc32)C1	ZINC000966899317	1328461123	/nfs/dbraw/zinc/46/11/23/1328461123.db2.gz	GGXOTWSAMWTXOL-HNAYVOBHSA-N	0	3	335.451	3.007	20	30		EGEDHN
C#CCCN1CCC[C@H]1CNC(=O)c1ccc(OC)c(C(C)C)c1	ZINC001028003419	1328464230	/nfs/dbraw/zinc/46/42/30/1328464230.db2.gz	NPHUYNGTBRVLJM-KRWDZBQOSA-N	0	3	328.456	3.036	20	30		EGEDHN
CC(C)(C)OC(=O)N1[C@H](CNCc2ccc(C#N)cc2)COC1(C)C	ZINC000862273540	1329473084	/nfs/dbraw/zinc/47/30/84/1329473084.db2.gz	JTDSBHLQNZWUAL-MRXNPFEDSA-N	0	3	345.443	3.020	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)[C@H](C)N[C@H](C)COCC1CCCCC1	ZINC000932426809	1329814058	/nfs/dbraw/zinc/81/40/58/1329814058.db2.gz	NGNGVWONGQNPLJ-GJYPPUQNSA-N	0	3	337.508	3.004	20	30		EGEDHN
C[C@]12CN(Cc3nnc(-c4cccc(C#N)c4)o3)C[C@H]1[C@H]1CC[C@@H]2C1	ZINC000933709985	1329915283	/nfs/dbraw/zinc/91/52/83/1329915283.db2.gz	ZNLBFUYWNFXXSU-DZIWXPPMSA-N	0	3	334.423	3.476	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@H](N[C@@H](c3ccncc3)C3CC3)C2=O)cc1	ZINC000934695925	1330000690	/nfs/dbraw/zinc/00/06/90/1330000690.db2.gz	DUDBFSCCQUPLOP-VQTJNVASSA-N	0	3	346.434	3.190	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1C[C@@H](C)[C@@H](NCc2ccc(C#N)s2)C1	ZINC001054699159	1349441506	/nfs/dbraw/zinc/44/15/06/1349441506.db2.gz	FEIQJBGULYZHFV-CJNGLKHVSA-N	0	3	333.501	3.238	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](C)[C@H](NCc3cccc(C(C)C)n3)C2)C1	ZINC000939103102	1330376965	/nfs/dbraw/zinc/37/69/65/1330376965.db2.gz	MXIQFTOHMDROAY-VQIMIIECSA-N	0	3	341.499	3.498	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc3c2CCCCC3)[C@H](C)C1	ZINC000942157362	1331851162	/nfs/dbraw/zinc/85/11/62/1331851162.db2.gz	QJXNYJSCGWETEK-UTKZUKDTSA-N	0	3	338.495	3.419	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)cc2)CC[C@H]1NC(=O)C1(C2CC2)CC1	ZINC000942159650	1331852339	/nfs/dbraw/zinc/85/23/39/1331852339.db2.gz	HRBKFOOZGZABBH-DNVCBOLYSA-N	0	3	337.467	3.075	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccc3c(C)c(C)[nH]c32)[C@@H](C)C1	ZINC000942180421	1331863283	/nfs/dbraw/zinc/86/32/83/1331863283.db2.gz	GIEAMIOAXORYNA-IFXJQAMLSA-N	0	3	337.467	3.248	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(C)cc2Cl)[C@H](C)C1	ZINC000942193256	1331873511	/nfs/dbraw/zinc/87/35/11/1331873511.db2.gz	RZJZSUBFPCKYAC-QAPCUYQASA-N	0	3	332.875	3.041	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)n(C(CC)CC)n2)[C@H](C)C1	ZINC000942209285	1331880381	/nfs/dbraw/zinc/88/03/81/1331880381.db2.gz	UZDKWLSKAQZRNU-CRAIPNDOSA-N	0	3	344.503	3.016	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2scnc2C2CCCC2)[C@@H](C)C1	ZINC000942304778	1331899282	/nfs/dbraw/zinc/89/92/82/1331899282.db2.gz	RLYGULGAWWHAOY-DZGCQCFKSA-N	0	3	333.501	3.427	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cc3ccccc3s2)[C@@H](C)C1	ZINC000942465360	1331940018	/nfs/dbraw/zinc/94/00/18/1331940018.db2.gz	FLDNZZGAOQOSMD-YJBOKZPZSA-N	0	3	340.492	3.294	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3cc(Cl)ccc3[nH]2)[C@H](C)C1	ZINC000942556289	1331971100	/nfs/dbraw/zinc/97/11/00/1331971100.db2.gz	YRTDXTFVIOYYIM-CZUORRHYSA-N	0	3	343.858	3.285	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)c(Cl)cc2C)[C@H](C)C1	ZINC000942556271	1331971741	/nfs/dbraw/zinc/97/17/41/1331971741.db2.gz	YPTMJLAVKBKLOO-CRAIPNDOSA-N	0	3	332.875	3.420	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)c(Cl)cc2C)[C@@H](C)C1	ZINC000942556272	1331971748	/nfs/dbraw/zinc/97/17/48/1331971748.db2.gz	YPTMJLAVKBKLOO-MAUKXSAKSA-N	0	3	332.875	3.420	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C(C)(C)c2ccc(Cl)cc2)[C@H](C)C1	ZINC000942594766	1331995055	/nfs/dbraw/zinc/99/50/55/1331995055.db2.gz	OBFDHUOSPWTVNK-CRAIPNDOSA-N	0	3	346.902	3.468	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2c(Cl)cncc2Cl)[C@H](C)C1	ZINC000942593995	1331995136	/nfs/dbraw/zinc/99/51/36/1331995136.db2.gz	BGVLUDCXYJYBBQ-ZWNOBZJWSA-N	0	3	328.243	3.015	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2c(C)cc(C)cc2C)[C@H](C)C1	ZINC000942597568	1331996612	/nfs/dbraw/zinc/99/66/12/1331996612.db2.gz	LRJRWRUUORVMMJ-QUCCMNQESA-N	0	3	326.484	3.004	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccccc2OC2CCC2)[C@H](C)C1	ZINC000942700123	1332022351	/nfs/dbraw/zinc/02/23/51/1332022351.db2.gz	NBEQRHKBXFANNW-APWZRJJASA-N	0	3	340.467	3.081	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C(CC)CC)no2)[C@H](C)C1	ZINC000943374655	1332160914	/nfs/dbraw/zinc/16/09/14/1332160914.db2.gz	ONDHNZLPDBYMOR-ZBFHGGJFSA-N	0	3	331.460	3.042	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ncc(Cl)cc2Cl)[C@H](C)C1	ZINC000943767065	1332259302	/nfs/dbraw/zinc/25/93/02/1332259302.db2.gz	QLCNUVVVULZETE-MFKMUULPSA-N	0	3	328.243	3.015	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cccc3ccccc32)[C@@H](C)C1	ZINC000944262786	1332356326	/nfs/dbraw/zinc/35/63/26/1332356326.db2.gz	CVKGRTZEBWJKCU-UWJYYQICSA-N	0	3	334.463	3.232	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2coc3ccc(F)cc23)[C@H](C)C1	ZINC000944492138	1332413970	/nfs/dbraw/zinc/41/39/70/1332413970.db2.gz	OBFQSIINCMZDIA-DYVFJYSZSA-N	0	3	328.387	3.035	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2coc3cc(C)ccc23)[C@H](C)C1	ZINC000944651125	1332420961	/nfs/dbraw/zinc/42/09/61/1332420961.db2.gz	DIPWIRFULAETIY-VQIMIIECSA-N	0	3	338.451	3.134	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(CCC)c(C)s2)[C@H](C)C1	ZINC000944789930	1332424153	/nfs/dbraw/zinc/42/41/53/1332424153.db2.gz	MNEGXPQVRSXZIS-RHSMWYFYSA-N	0	3	332.513	3.473	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc3[nH]c(C)c(C)c3c2)[C@@H](C)C1	ZINC000944892224	1332445587	/nfs/dbraw/zinc/44/55/87/1332445587.db2.gz	YZLYRQPKSUFHGI-IFXJQAMLSA-N	0	3	337.467	3.248	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2sc(C(C)C)nc2C)[C@H](C)C1	ZINC000944905672	1332450397	/nfs/dbraw/zinc/45/03/97/1332450397.db2.gz	DNMWTBQZQPZMDF-UKRRQHHQSA-N	0	3	333.501	3.038	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2c[nH]c3c2cccc3CC)[C@@H](C)C1	ZINC000945180131	1332526227	/nfs/dbraw/zinc/52/62/27/1332526227.db2.gz	KRWUSTMCGICUFT-HNAYVOBHSA-N	0	3	337.467	3.194	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cscc2C(F)(F)F)[C@H](C)C1	ZINC000946316007	1332786526	/nfs/dbraw/zinc/78/65/26/1332786526.db2.gz	ZHPQFCWSNHQLSQ-RISCZKNCSA-N	0	3	344.402	3.230	20	30		EGEDHN
C=C(C)CC[N@H+]1C[C@@H]2CCN(C(=O)c3ccccc3[O-])CC[C@@H]2C1	ZINC000946490416	1332843232	/nfs/dbraw/zinc/84/32/32/1332843232.db2.gz	QELLDARRVNEOGX-CALCHBBNSA-N	0	3	328.456	3.142	20	30		EGEDHN
C=C(C)CC[N@@H+]1C[C@@H]2CCN(C(=O)c3ccccc3[O-])CC[C@@H]2C1	ZINC000946490416	1332843233	/nfs/dbraw/zinc/84/32/33/1332843233.db2.gz	QELLDARRVNEOGX-CALCHBBNSA-N	0	3	328.456	3.142	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3c(C)cncc3C)CC[C@@H]2C1	ZINC000946675421	1332875775	/nfs/dbraw/zinc/87/57/75/1332875775.db2.gz	OUFDIDAFMLGAPA-CALCHBBNSA-N	0	3	347.890	3.235	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2coc3c2cccc3OC)C[C@H]1C	ZINC000947314044	1333085515	/nfs/dbraw/zinc/08/55/15/1333085515.db2.gz	DLGGPVYWRJLVCQ-KGLIPLIRSA-N	0	3	328.412	3.210	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc(-c3ccncc3)o2)C[C@@H]1C	ZINC000947381809	1333109134	/nfs/dbraw/zinc/10/91/34/1333109134.db2.gz	CFZKEXFBKKHVBO-HOCLYGCPSA-N	0	3	325.412	3.110	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2oc3ccc(F)cc3c2C)C[C@@H]1C	ZINC000947390790	1333111844	/nfs/dbraw/zinc/11/18/44/1333111844.db2.gz	ABFYTWJQVIOGCL-XJKSGUPXSA-N	0	3	342.414	3.486	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)C2(C3CC3)CC2)CCN1Cc1ccc(C#N)cc1	ZINC000947425717	1333122292	/nfs/dbraw/zinc/12/22/92/1333122292.db2.gz	KRZIBGDVGVJDPK-KXBFYZLASA-N	0	3	337.467	3.218	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(C)c(Cl)c2)C[C@@H]1C	ZINC000947441659	1333128838	/nfs/dbraw/zinc/12/88/38/1333128838.db2.gz	KAPWLOGPNYBVBH-RDJZCZTQSA-N	0	3	332.875	3.183	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3c([nH]2)c(F)ccc3C)C[C@@H]1C	ZINC000947467366	1333139690	/nfs/dbraw/zinc/13/96/90/1333139690.db2.gz	AITLPWPJSMQLHN-GJZGRUSLSA-N	0	3	341.430	3.221	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(C)n(C(CC)CC)n2)C[C@@H]1C	ZINC000947472584	1333141503	/nfs/dbraw/zinc/14/15/03/1333141503.db2.gz	HQMDYULWBMSGKA-GOEBONIOSA-N	0	3	332.492	3.321	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2sccc2-n2cccc2)C[C@H]1C	ZINC000947599351	1333188546	/nfs/dbraw/zinc/18/85/46/1333188546.db2.gz	UBPNCVKSFQPKJZ-HZPDHXFCSA-N	0	3	341.480	3.145	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc(F)c3ccncc23)C[C@@H]1C	ZINC000947647273	1333207619	/nfs/dbraw/zinc/20/76/19/1333207619.db2.gz	BINPANBVUXFHCJ-KBPBESRZSA-N	0	3	327.403	3.143	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C(C)(C)C)oc2C)C[C@H]1C	ZINC000947751243	1333250760	/nfs/dbraw/zinc/25/07/60/1333250760.db2.gz	WIRJWOLNLHMHDP-ZBFHGGJFSA-N	0	3	330.472	3.492	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2c[nH]c3cc(C)ccc23)C[C@H]1C	ZINC000947800235	1333265605	/nfs/dbraw/zinc/26/56/05/1333265605.db2.gz	GYIDYGCIZLDMLY-SJLPKXTDSA-N	0	3	337.467	3.011	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3ccccc3F)CCC2)C[C@@H]1C	ZINC000947917339	1333306673	/nfs/dbraw/zinc/30/66/73/1333306673.db2.gz	VYOAFPVVJGUPIC-DLBZAZTESA-N	0	3	342.458	3.240	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccccc2C(F)(F)F)C[C@H]1C	ZINC000947962453	1333323025	/nfs/dbraw/zinc/32/30/25/1333323025.db2.gz	MZIUCBXLRDBBLO-ZIAGYGMSSA-N	0	3	338.373	3.311	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(F)c(F)cc2Cl)C[C@@H]1C	ZINC000947998823	1333337042	/nfs/dbraw/zinc/33/70/42/1333337042.db2.gz	PKNLSVQAIDDCMK-RYUDHWBXSA-N	0	3	340.801	3.224	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3ccc(C)cc3)CCC2)C[C@H]1C	ZINC000948082561	1333369249	/nfs/dbraw/zinc/36/92/49/1333369249.db2.gz	FHZNQPZMXRBMHX-UYAOXDASSA-N	0	3	338.495	3.409	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2cccc(OC(C)C)c2)C[C@H]1C	ZINC000948083766	1333371117	/nfs/dbraw/zinc/37/11/17/1333371117.db2.gz	YQNINQOBQBSSSD-IEBWSBKVSA-N	0	3	342.483	3.009	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cccc3ccc(C)nc32)CC1	ZINC000948471590	1333538773	/nfs/dbraw/zinc/53/87/73/1333538773.db2.gz	XXYQRCIYOUVDKL-IBGZPJMESA-N	0	3	349.478	3.493	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2cc(C)n(C(CC)CC)n2)CC1	ZINC000948571014	1333581698	/nfs/dbraw/zinc/58/16/98/1333581698.db2.gz	XHOUKAWSFHJKQE-GOSISDBHSA-N	0	3	344.503	3.112	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cc(Cl)ccc2F)CC1	ZINC000948602652	1333592286	/nfs/dbraw/zinc/59/22/86/1333592286.db2.gz	QPGPOCYEZYPHGQ-HNNXBMFYSA-N	0	3	336.838	3.429	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2ccc(-c3ccco3)o2)CC1	ZINC000948604541	1333592923	/nfs/dbraw/zinc/59/29/23/1333592923.db2.gz	GCMODJCWGAPNKG-OAHLLOKOSA-N	0	3	326.396	3.099	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)C2([C@@H]3CCCCO3)CCC2)CC1	ZINC000948612350	1333596628	/nfs/dbraw/zinc/59/66/28/1333596628.db2.gz	NLTIIIPMYRZXQH-MOPGFXCFSA-N	0	3	346.515	3.062	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2nc3ccccc3cc2C)CC1	ZINC000948628091	1333602696	/nfs/dbraw/zinc/60/26/96/1333602696.db2.gz	GIWMDANHHIAWJL-IBGZPJMESA-N	0	3	349.478	3.493	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2ccc3c(c2)[C@@H](C)CO3)CC1	ZINC000948701275	1333638821	/nfs/dbraw/zinc/63/88/21/1333638821.db2.gz	UEEYKDYYUPVCCA-WMZOPIPTSA-N	0	3	340.467	3.132	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@@H]2CCCN(Cc3ocnc3C)CC2)C1	ZINC000948758908	1333664133	/nfs/dbraw/zinc/66/41/33/1333664133.db2.gz	NFROFOLSCGJYGG-MRXNPFEDSA-N	0	3	331.460	3.152	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cc([C@@H](C)CC)no2)CC1	ZINC000948836262	1333703826	/nfs/dbraw/zinc/70/38/26/1333703826.db2.gz	AHZQBQTWWMIXMV-JKSUJKDBSA-N	0	3	331.460	3.138	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2cc(C(CC)CC)no2)CC1	ZINC000948836603	1333704119	/nfs/dbraw/zinc/70/41/19/1333704119.db2.gz	KNOWAURPXOMSHW-INIZCTEOSA-N	0	3	331.460	3.138	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2c3ccccc3CCN2CC(C)C)cn1	ZINC000948978915	1333755054	/nfs/dbraw/zinc/75/50/54/1333755054.db2.gz	PIDQSMRZZZYIHH-OAQYLSRUSA-N	0	3	347.462	3.048	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C(C)(C)C3CCCC3)CC2)C1	ZINC000949385797	1333835113	/nfs/dbraw/zinc/83/51/13/1333835113.db2.gz	BFHAANKTKUVYKU-UHFFFAOYSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@@]3(C)C=CCC3)CC2)C1	ZINC000949441410	1333848050	/nfs/dbraw/zinc/84/80/50/1333848050.db2.gz	SUVXYLYVHFQSCE-IBGZPJMESA-N	0	3	332.488	3.002	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@@H]3CCCC[C@@H]3C)CC2)C1	ZINC000949451204	1333850930	/nfs/dbraw/zinc/85/09/30/1333850930.db2.gz	SUAOSJIRNUSZEL-ZWKOTPCHSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@H]3CCC[C@@H](C)C3)CC2)C1	ZINC000949455185	1333851632	/nfs/dbraw/zinc/85/16/32/1333851632.db2.gz	VXUSSWZSYHKEIQ-MSOLQXFVSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3cc(C)ccc3F)CC2)C1	ZINC000949480489	1333859133	/nfs/dbraw/zinc/85/91/33/1333859133.db2.gz	PXRGHNYUEQBGKQ-UHFFFAOYSA-N	0	3	346.446	3.017	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@H](C)c3ccccc3)CC2)C1	ZINC000949515405	1333864828	/nfs/dbraw/zinc/86/48/28/1333864828.db2.gz	PUPVMWJPXMCNML-GOSISDBHSA-N	0	3	342.483	3.060	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N(CC)C1CN(CC2CCCCCC2)C1	ZINC000951785250	1334313964	/nfs/dbraw/zinc/31/39/64/1334313964.db2.gz	FHHZXNLQCOBZNK-MOPGFXCFSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cc(-c3ccccc3)no2)C1	ZINC000967181755	1335675955	/nfs/dbraw/zinc/67/59/55/1335675955.db2.gz	HYCTUEILWSKTOZ-QAPCUYQASA-N	0	3	339.439	3.358	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](C)[C@H](NC(=O)c2ncc(Cl)s2)C1	ZINC000967355579	1335711628	/nfs/dbraw/zinc/71/16/28/1335711628.db2.gz	HOSOBSXSZSAOKU-VXGBXAGGSA-N	0	3	327.881	3.203	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cnc(CC3CC3)s2)C1	ZINC000967402220	1335727134	/nfs/dbraw/zinc/72/71/34/1335727134.db2.gz	ONOVCNNFTIIUIY-HIFRSBDPSA-N	0	3	333.501	3.112	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)Cc2c[nH]c3ccc(F)cc23)C1	ZINC000968354704	1335900103	/nfs/dbraw/zinc/90/01/03/1335900103.db2.gz	VMRMVBGNAPSPKU-LIRRHRJNSA-N	0	3	343.446	3.252	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2coc(C3CCCC3)n2)C1	ZINC000968486864	1335938252	/nfs/dbraw/zinc/93/82/52/1335938252.db2.gz	AOKHCYWEVKEYFM-GDBMZVCRSA-N	0	3	331.460	3.349	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(C(=O)C3=CCCCCC3)C2)s1	ZINC000968494376	1335941501	/nfs/dbraw/zinc/94/15/01/1335941501.db2.gz	FMUKQAOQHAEMAU-OAHLLOKOSA-N	0	3	329.469	3.201	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2ccc(-c3c[nH]cn3)cc2)C1	ZINC000968500834	1335943262	/nfs/dbraw/zinc/94/32/62/1335943262.db2.gz	KGVZMZIFDUHKST-KXBFYZLASA-N	0	3	338.455	3.093	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2csc(C(F)(F)F)n2)C1	ZINC000968500730	1335943508	/nfs/dbraw/zinc/94/35/08/1335943508.db2.gz	IVBJSKWVECPDBI-WDEREUQCSA-N	0	3	347.406	3.178	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)Cc2c(C)nn(C(C)C)c2C)C1	ZINC000968528915	1335954818	/nfs/dbraw/zinc/95/48/18/1335954818.db2.gz	INNYTIBWOIJZOV-BEFAXECRSA-N	0	3	346.519	3.026	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)Cc2c[nH]c3cccc(C)c23)C1	ZINC000968544881	1335958614	/nfs/dbraw/zinc/95/86/14/1335958614.db2.gz	VZIDRSSVZHIJRL-KXBFYZLASA-N	0	3	339.483	3.422	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccccc2C(F)(F)F)C1	ZINC000968571273	1335965785	/nfs/dbraw/zinc/96/57/85/1335965785.db2.gz	XRKCJIDQYAMWLC-CZUORRHYSA-N	0	3	338.373	3.169	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cc(Cl)ccc2Cl)C1	ZINC000968584064	1335973397	/nfs/dbraw/zinc/97/33/97/1335973397.db2.gz	RWBICIQIVQGYNO-WBMJQRKESA-N	0	3	339.266	3.457	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2coc3ccc(F)cc23)C1	ZINC000968597207	1335978313	/nfs/dbraw/zinc/97/83/13/1335978313.db2.gz	UGKKLMDVFRVQEN-GUYCJALGSA-N	0	3	328.387	3.035	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2cc(OC)c(C)c(OC)c2)C1	ZINC000968624689	1335988783	/nfs/dbraw/zinc/98/87/83/1335988783.db2.gz	YFCIXOLZWMDYAH-PBHICJAKSA-N	0	3	346.471	3.029	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)Cc2ccc3ccccc3c2)C1	ZINC000968627497	1335989157	/nfs/dbraw/zinc/98/91/57/1335989157.db2.gz	IXNYBRKFBXEDCM-LAUBAEHRSA-N	0	3	334.463	3.232	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccc(OC3CCC3)cc2)C1	ZINC000968669767	1336004339	/nfs/dbraw/zinc/00/43/39/1336004339.db2.gz	STXQGMOOCJXNSV-JXFKEZNVSA-N	0	3	340.467	3.081	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cc(C3CCCC3)no2)C1	ZINC000968670402	1336004349	/nfs/dbraw/zinc/00/43/49/1336004349.db2.gz	XFMLKKMVINIUQR-PBHICJAKSA-N	0	3	331.460	3.349	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2cccc3oc(C)nc32)C1	ZINC000968688933	1336012534	/nfs/dbraw/zinc/01/25/34/1336012534.db2.gz	QJWBNLCVCYWDAH-CZUORRHYSA-N	0	3	327.428	3.153	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2cnc(CC(C)C)s2)C1	ZINC000968695741	1336015804	/nfs/dbraw/zinc/01/58/04/1336015804.db2.gz	VJILIHUBLVVJGA-LSDHHAIUSA-N	0	3	335.517	3.358	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)Cc2c(C)oc3ccccc32)C1	ZINC000968713567	1336021797	/nfs/dbraw/zinc/02/17/97/1336021797.db2.gz	SLSBKADPJKGJAE-BEFAXECRSA-N	0	3	338.451	3.134	20	30		EGEDHN
C#CCCN1CCCCC[C@@H]1CNC(=O)c1conc1C1CCCC1	ZINC000968888441	1336080854	/nfs/dbraw/zinc/08/08/54/1336080854.db2.gz	VEHDUKYJOANXCV-QGZVFWFLSA-N	0	3	343.471	3.330	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)[C@@H]1CCCc2ccccc21	ZINC000968917206	1336088352	/nfs/dbraw/zinc/08/83/52/1336088352.db2.gz	QEYGXMQNKFEYQD-TZIWHRDSSA-N	0	3	338.495	3.491	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccc(F)c(COC)c1	ZINC000969018159	1336119507	/nfs/dbraw/zinc/11/95/07/1336119507.db2.gz	XCUAVGJWJNFXJB-QGZVFWFLSA-N	0	3	334.435	3.133	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1ccc2cnccc2n1	ZINC000969044485	1336125516	/nfs/dbraw/zinc/12/55/16/1336125516.db2.gz	QZZIEEFITROBFV-KRWDZBQOSA-N	0	3	338.455	3.180	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1cccc(OCC)c1	ZINC000969050844	1336128827	/nfs/dbraw/zinc/12/88/27/1336128827.db2.gz	WALHRQGRQQUOJH-SFHVURJKSA-N	0	3	328.456	3.083	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1oc(C2CC2)nc1C	ZINC000969062509	1336135146	/nfs/dbraw/zinc/13/51/46/1336135146.db2.gz	NVHUEMOMHCQGSP-INIZCTEOSA-N	0	3	331.460	3.411	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1ccc(C)nc1OCC	ZINC000969090891	1336139847	/nfs/dbraw/zinc/13/98/47/1336139847.db2.gz	ORVGGZHJTMDHCS-KRWDZBQOSA-N	0	3	345.487	3.339	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccnc(C(F)(F)F)c1	ZINC000969103215	1336144214	/nfs/dbraw/zinc/14/42/14/1336144214.db2.gz	GYAXCQZDLIEWGT-AWEZNQCLSA-N	0	3	341.377	3.261	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccc(COC)c(F)c1	ZINC000969124849	1336151358	/nfs/dbraw/zinc/15/13/58/1336151358.db2.gz	WAXHKTCVWUNVLJ-KRWDZBQOSA-N	0	3	334.435	3.133	20	30		EGEDHN
CCc1ccc(C(=O)N2CC[C@@H](NCc3ccc(C#N)s3)C2)s1	ZINC000969234944	1336183916	/nfs/dbraw/zinc/18/39/16/1336183916.db2.gz	FPFYSCLMDCZBTD-GFCCVEGCSA-N	0	3	345.493	3.248	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(C(=O)C[C@H]3CC=CCC3)C2)cc1F	ZINC000969597090	1336227051	/nfs/dbraw/zinc/22/70/51/1336227051.db2.gz	MXXJNQWQEUHLHM-MAUKXSAKSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC000969676920	1336236304	/nfs/dbraw/zinc/23/63/04/1336236304.db2.gz	JWFRQUMZVAYDIT-LLVKDONJSA-N	0	3	326.362	3.390	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)c2cncc(-c3ccccc3)c2)C1	ZINC000969796733	1336248630	/nfs/dbraw/zinc/24/86/30/1336248630.db2.gz	MUMAJHRHHHUNRO-INIZCTEOSA-N	0	3	335.451	3.375	20	30		EGEDHN
C=C[C@@H](C(=O)N1CC[C@@H](NCc2ccc(C)nc2C)C1)c1ccccc1	ZINC000970773779	1336336996	/nfs/dbraw/zinc/33/69/96/1336336996.db2.gz	CDBYRXWULYZBCY-NHCUHLMSSA-N	0	3	349.478	3.359	20	30		EGEDHN
CN(C(=O)C1C=CC=CC=C1)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001005454820	1336353134	/nfs/dbraw/zinc/35/31/34/1336353134.db2.gz	KWFJSRSBJCMZSJ-UHFFFAOYSA-N	0	3	347.462	3.279	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)[C@@H]2CCCC[C@H]2C(F)(F)F)CC1	ZINC001005529937	1336368371	/nfs/dbraw/zinc/36/83/71/1336368371.db2.gz	ONKGBPUADMILLM-HUUCEWRRSA-N	0	3	332.410	3.464	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cc(-c3ccccc3)on2)CC1	ZINC001005689266	1336393003	/nfs/dbraw/zinc/39/30/03/1336393003.db2.gz	QMZGDWHIYDZBPN-UHFFFAOYSA-N	0	3	325.412	3.064	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccc(OC)cc2Cl)CC1	ZINC001006149776	1336460512	/nfs/dbraw/zinc/46/05/12/1336460512.db2.gz	DAHMPGJNFDYJBH-UHFFFAOYSA-N	0	3	336.863	3.461	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)[C@]2(C)CCc3ccccc3C2)CC1	ZINC001006489407	1336516269	/nfs/dbraw/zinc/51/62/69/1336516269.db2.gz	OGIGIUCGEPHKSI-OAQYLSRUSA-N	0	3	326.484	3.290	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H](NC(=O)c2c(C)noc2C(F)F)C1	ZINC001007594896	1336673766	/nfs/dbraw/zinc/67/37/66/1336673766.db2.gz	CHVUJQZGHAOVRX-GFCCVEGCSA-N	0	3	327.375	3.081	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)Cn2c(C)cc3ccccc32)C1	ZINC001007848835	1336717150	/nfs/dbraw/zinc/71/71/50/1336717150.db2.gz	KOEPKOAJLSZAIX-SFHVURJKSA-N	0	3	325.456	3.106	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H](NC(=O)c2nc(Cl)sc2C)C1	ZINC001007888942	1336726715	/nfs/dbraw/zinc/72/67/15/1336726715.db2.gz	GXQPTDFYACJDOE-GFCCVEGCSA-N	0	3	327.881	3.265	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H](NC(=O)c2c(F)ccc(F)c2F)C1	ZINC001008351785	1336831419	/nfs/dbraw/zinc/83/14/19/1336831419.db2.gz	XLXOYTWLHRSNCP-GFCCVEGCSA-N	0	3	326.362	3.264	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CCCN(Cc3cc(C)ccc3C)C2)c1	ZINC001008469379	1336864614	/nfs/dbraw/zinc/86/46/14/1336864614.db2.gz	QFRINHXCOZVBPB-NRFANRHFSA-N	0	3	347.462	3.074	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N[C@@H]1CCCN(Cc2cccc(C)c2)C1	ZINC001008848187	1336933192	/nfs/dbraw/zinc/93/31/92/1336933192.db2.gz	XCXHVVGNBKFOSD-AABGKKOBSA-N	0	3	342.483	3.057	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCN([C@@H](C)c3ccccc3C)C2)cn1	ZINC001009273145	1336995038	/nfs/dbraw/zinc/99/50/38/1336995038.db2.gz	DFTNFOBXEYXSEN-PXNSSMCTSA-N	0	3	347.462	3.327	20	30		EGEDHN
N#Cc1c[nH]c(C(=O)N[C@H]2CCN(Cc3cccc4ccccc43)C2)c1	ZINC001010456777	1337199573	/nfs/dbraw/zinc/19/95/73/1337199573.db2.gz	IKJOBSMMDUVXDC-SFHVURJKSA-N	0	3	344.418	3.044	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(CCc3ccc(Cl)cc3)C2)C1	ZINC001015676852	1338254370	/nfs/dbraw/zinc/25/43/70/1338254370.db2.gz	PTZYLQLBZOZBMP-KRWDZBQOSA-N	0	3	332.875	3.429	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(CCc3ccccc3CC)C2)C1	ZINC001015677688	1338254390	/nfs/dbraw/zinc/25/43/90/1338254390.db2.gz	YBFFVABEEQCTJN-LJQANCHMSA-N	0	3	326.484	3.338	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cccc(OCCC)c2)CC1	ZINC001016649518	1338677891	/nfs/dbraw/zinc/67/78/91/1338677891.db2.gz	NJGLIZBVYBYMJU-IBGZPJMESA-N	0	3	340.467	3.083	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)Cc2ccc(C3CCC3)cc2)CC1	ZINC001016751721	1338711893	/nfs/dbraw/zinc/71/18/93/1338711893.db2.gz	NCMRWEZKKZFDLU-HXUWFJFHSA-N	0	3	336.479	3.101	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CC23CCN(Cc2oc(C)nc2C)CC3)C1	ZINC001016817996	1338737107	/nfs/dbraw/zinc/73/71/07/1338737107.db2.gz	QLOTWLXGXYKPQA-QGZVFWFLSA-N	0	3	343.471	3.118	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)Cc2ccc(C(C)(C)C)cc2)CC1	ZINC001016843969	1338744499	/nfs/dbraw/zinc/74/44/99/1338744499.db2.gz	SZDNJMXBYZZXTE-IBGZPJMESA-N	0	3	338.495	3.131	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2ccccc2O[C@@H](C)CC)CC1	ZINC001016854032	1338747834	/nfs/dbraw/zinc/74/78/34/1338747834.db2.gz	SRZAEERRFBZJDN-LPHOPBHVSA-N	0	3	340.467	3.081	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)Cc2c[nH]c3cccc(C)c23)CC1	ZINC001016929987	1338773139	/nfs/dbraw/zinc/77/31/39/1338773139.db2.gz	HGTTXQVIJPLVHO-LJQANCHMSA-N	0	3	349.478	3.013	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccccc2OC(C)C)CC1	ZINC001016942318	1338777783	/nfs/dbraw/zinc/77/77/83/1338777783.db2.gz	XRYOBPOLQQMGOS-LJQANCHMSA-N	0	3	340.467	3.081	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2cc(CC)c(CCC)s2)CC1	ZINC001016967417	1338786823	/nfs/dbraw/zinc/78/68/23/1338786823.db2.gz	HHMAAOGTZBATGW-SFHVURJKSA-N	0	3	344.524	3.481	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2cc(CCC)c(C)s2)CC1	ZINC001016965806	1338786933	/nfs/dbraw/zinc/78/69/33/1338786933.db2.gz	SPGFOHLOXODGDM-KRWDZBQOSA-N	0	3	330.497	3.227	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)[C@@H](C)c2ccc(F)cc2F)CC1	ZINC001016984807	1338792602	/nfs/dbraw/zinc/79/26/02/1338792602.db2.gz	GPMLMVVVENKWFD-KSSFIOAISA-N	0	3	346.421	3.062	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cc3c(cccc3C)o2)CC1	ZINC001016990445	1338795629	/nfs/dbraw/zinc/79/56/29/1338795629.db2.gz	MLLIZWXSMDCHFS-LJQANCHMSA-N	0	3	336.435	3.349	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H](CN(C)Cc2ccccn2)C1	ZINC001017201349	1338946458	/nfs/dbraw/zinc/94/64/58/1338946458.db2.gz	IHHOWCATYICVTC-FXAWDEMLSA-N	0	3	329.488	3.354	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H](CN(C)Cc3ccc(F)cn3)C2)C1	ZINC001017205940	1338952092	/nfs/dbraw/zinc/95/20/92/1338952092.db2.gz	GIZFTZYSIGXLEW-INIZCTEOSA-N	0	3	345.462	3.247	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H](CN(C)Cc3oc(C)nc3C)C2)C1	ZINC001017206941	1338952899	/nfs/dbraw/zinc/95/28/99/1338952899.db2.gz	KLTNLRIBYOQIIB-KRWDZBQOSA-N	0	3	345.487	3.318	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1sccc1CN(C)C	ZINC001017594187	1339374811	/nfs/dbraw/zinc/37/48/11/1339374811.db2.gz	QBAPAVITBXOYIJ-CALCHBBNSA-N	0	3	347.528	3.065	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)CCc1ccc(OCC)cc1	ZINC001017693257	1339392670	/nfs/dbraw/zinc/39/26/70/1339392670.db2.gz	HOLGQYBFLIFIHU-KDURUIRLSA-N	0	3	342.483	3.269	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cccc(OC)c1C	ZINC001017994707	1339478094	/nfs/dbraw/zinc/47/80/94/1339478094.db2.gz	CTZNTVNCHGMHBB-CALCHBBNSA-N	0	3	328.456	3.259	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](CC)OC1CCCC1	ZINC001018013228	1339481748	/nfs/dbraw/zinc/48/17/48/1339481748.db2.gz	ABNINPNANBLPLY-ZIFCJYIRSA-N	0	3	334.504	3.366	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cnn(CC)c1C1CC1	ZINC001018152095	1339516006	/nfs/dbraw/zinc/51/60/06/1339516006.db2.gz	KEEPWXAWPQQPMG-CALCHBBNSA-N	0	3	342.487	3.035	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cnn(C(C)C)c1C	ZINC001018166525	1339519836	/nfs/dbraw/zinc/51/98/36/1339519836.db2.gz	SQWMEQRUUOFZGW-CALCHBBNSA-N	0	3	330.476	3.027	20	30		EGEDHN
N#Cc1cc(CN[C@H]2CCN(C(=O)C=C3CCCCC3)C2)ccc1F	ZINC001018591891	1339675050	/nfs/dbraw/zinc/67/50/50/1339675050.db2.gz	XVUGKVMJNVJRSE-SFHVURJKSA-N	0	3	341.430	3.278	20	30		EGEDHN
CC(C)(C)C(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C12CCC2	ZINC001078788280	1357083649	/nfs/dbraw/zinc/08/36/49/1357083649.db2.gz	FFHVLAHYLVKFLG-SJORKVTESA-N	0	3	343.446	3.260	20	30		EGEDHN
C#CCCN1CCC[C@H]1CNC(=O)c1cccc(Cl)c1Cl	ZINC001028284059	1340539046	/nfs/dbraw/zinc/53/90/46/1340539046.db2.gz	XGTVZVSTJLXZDQ-LBPRGKRZSA-N	0	3	325.239	3.211	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1cccc(C(F)(F)F)c1	ZINC001028280561	1340534607	/nfs/dbraw/zinc/53/46/07/1340534607.db2.gz	OXOXVANMGKZYRZ-OAHLLOKOSA-N	0	3	326.362	3.476	20	30		EGEDHN
C#CCCN1CCC[C@H]1CNC(=O)c1csc2c1CC[C@H](C)C2	ZINC001028300919	1340549404	/nfs/dbraw/zinc/54/94/04/1340549404.db2.gz	KBFKJLNYBCAZBY-GJZGRUSLSA-N	0	3	330.497	3.090	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1ccc(COC(C)C)cc1	ZINC001028308957	1340557334	/nfs/dbraw/zinc/55/73/34/1340557334.db2.gz	OAUNICUXSZTGDO-LJQANCHMSA-N	0	3	330.472	3.382	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1cc2ccccc2n1CC	ZINC001028334326	1340571130	/nfs/dbraw/zinc/57/11/30/1340571130.db2.gz	WKSMMWPDPDIVHT-QGZVFWFLSA-N	0	3	325.456	3.432	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@H]2CCN(Cc3ccc(C#N)cc3)C2)s1	ZINC001028378814	1340607438	/nfs/dbraw/zinc/60/74/38/1340607438.db2.gz	YPBYQMDVAFAFFT-QGZVFWFLSA-N	0	3	339.464	3.180	20	30		EGEDHN
Cc1cscc1C(=O)NC[C@H]1CCN(Cc2ccc(C#N)cc2)C1	ZINC001028469116	1340657318	/nfs/dbraw/zinc/65/73/18/1340657318.db2.gz	LGVOMZKQXVSSEU-QGZVFWFLSA-N	0	3	339.464	3.180	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)c2cc3cc(Cl)ccc3o2)C1	ZINC001028668688	1340748648	/nfs/dbraw/zinc/74/86/48/1340748648.db2.gz	IUVIGNCTIGYDOF-ZDUSSCGKSA-N	0	3	330.815	3.161	20	30		EGEDHN
CC1(C)CCC[C@H]1C(=O)NC[C@H]1CCN(Cc2ccc(C#N)cc2)C1	ZINC001028745580	1340785794	/nfs/dbraw/zinc/78/57/94/1340785794.db2.gz	DUULDXAGYHEBLI-MOPGFXCFSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CCN(Cc3cncc(C)c3)C2)CC1	ZINC001028780707	1340812954	/nfs/dbraw/zinc/81/29/54/1340812954.db2.gz	MPMSEIGACHLIGG-QGZVFWFLSA-N	0	3	327.472	3.075	20	30		EGEDHN
Cc1ccc(C)c(C(=O)NC[C@H]2CCN(Cc3ccc(C#N)cc3)C2)c1	ZINC001028951183	1340892619	/nfs/dbraw/zinc/89/26/19/1340892619.db2.gz	ACMKUEJZZRESNG-HXUWFJFHSA-N	0	3	347.462	3.427	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)c2cc3c(s2)CCCCC3)C1	ZINC001028968405	1340896600	/nfs/dbraw/zinc/89/66/00/1340896600.db2.gz	QCPIIUFBHFFDAP-OAHLLOKOSA-N	0	3	330.497	3.092	20	30		EGEDHN
CS[C@@H](C)C(=O)N1CCC([C@H](C)NCc2ccccc2C#N)CC1	ZINC001029054492	1340920096	/nfs/dbraw/zinc/92/00/96/1340920096.db2.gz	WEVPVDSNFWNWOH-GJZGRUSLSA-N	0	3	345.512	3.026	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CC[C@@H](C1)N2CCC[C@@H]1CCOC1	ZINC001029420336	1340986336	/nfs/dbraw/zinc/98/63/36/1340986336.db2.gz	YGRUVRVTOFDTEF-KURKYZTESA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H]3CC[C@@H](C2)N3CCC[C@H]2CCOC2)CC1	ZINC001029457592	1340994708	/nfs/dbraw/zinc/99/47/08/1340994708.db2.gz	OWHPWCQKMMYWHT-YSIASYRMSA-N	0	3	346.515	3.225	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CC[C@@H](C2)N3C[C@H]2CCC(F)(F)C2)C1	ZINC001029464975	1340996557	/nfs/dbraw/zinc/99/65/57/1340996557.db2.gz	LJCSSKCTVVGLID-HRCADAONSA-N	0	3	338.442	3.453	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@H](CN(C)Cc3ccc(C#N)s3)C2)o1	ZINC001029637206	1341029551	/nfs/dbraw/zinc/02/95/51/1341029551.db2.gz	CHKCNYKQYMCPBL-CQSZACIVSA-N	0	3	343.452	3.115	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCN(C(=O)[C@@]2(C)C=CCC2)C1	ZINC001029806464	1341079816	/nfs/dbraw/zinc/07/98/16/1341079816.db2.gz	LNRJATOXIQRHQR-KXBFYZLASA-N	0	3	343.496	3.256	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCN(C(=O)C2(C)CCC2)C1	ZINC001029809658	1341081559	/nfs/dbraw/zinc/08/15/59/1341081559.db2.gz	YGOCJXLZKJEYDE-CQSZACIVSA-N	0	3	331.485	3.090	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H](CN(C)Cc2c(C)onc2CC)C1	ZINC001029826797	1341087948	/nfs/dbraw/zinc/08/79/48/1341087948.db2.gz	VWZQDMOCIKZBIJ-OXQOHEQNSA-N	0	3	347.503	3.428	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](CN(C)Cc3cncc(C)c3)C2)CC1	ZINC001029826805	1341088057	/nfs/dbraw/zinc/08/80/57/1341088057.db2.gz	VZVRSYRAWINEBG-GOSISDBHSA-N	0	3	341.499	3.417	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](CN(C)Cc2oc(CC)nc2C)C1	ZINC001029828679	1341088909	/nfs/dbraw/zinc/08/89/09/1341088909.db2.gz	IGFXZMHGBWCPNI-OXJNMPFZSA-N	0	3	347.503	3.428	20	30		EGEDHN
C=CCCN1CCC[C@H](N(Cc2ccccc2)C(=O)c2cnco2)C1	ZINC001029921742	1341120503	/nfs/dbraw/zinc/12/05/03/1341120503.db2.gz	QMIOYIBBBAPKFG-SFHVURJKSA-N	0	3	339.439	3.358	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCCN(C(=O)[C@@]34C[C@@H]3CCCC4)C2)s1	ZINC001030021063	1341159820	/nfs/dbraw/zinc/15/98/20/1341159820.db2.gz	BAZCQLXJRAEVCE-DOXZYTNZSA-N	0	3	343.496	3.281	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)NCC1CN([C@@H](C)c2ccccc2)C1	ZINC001032040022	1341444101	/nfs/dbraw/zinc/44/41/01/1341444101.db2.gz	MYIZHUJOJSIPMH-VDGAXYAQSA-N	0	3	342.483	3.167	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1ccc2cccnc2c1	ZINC001032470677	1341515925	/nfs/dbraw/zinc/51/59/25/1341515925.db2.gz	BQTMSYFGVBHZNV-OALUTQOASA-N	0	3	335.451	3.029	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)CCc1ccc2[nH]ccc2c1	ZINC001032522639	1341530499	/nfs/dbraw/zinc/53/04/99/1341530499.db2.gz	BWLXXBNLTYNLKD-OALUTQOASA-N	0	3	337.467	3.352	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1ccc(Cl)c(F)c1	ZINC001032648901	1341569613	/nfs/dbraw/zinc/56/96/13/1341569613.db2.gz	VECGVNJZCPYWAI-GJZGRUSLSA-N	0	3	336.838	3.273	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2cncc(-c3ccccc3)c2)C1	ZINC001033125634	1341733407	/nfs/dbraw/zinc/73/34/07/1341733407.db2.gz	GILVPSZEKLHRGW-HXUWFJFHSA-N	0	3	335.451	3.471	20	30		EGEDHN
C#CCCN1CC[C@@H](N(C)C(=O)c2ccccc2CC(C)(C)C)C1	ZINC001033176772	1341745676	/nfs/dbraw/zinc/74/56/76/1341745676.db2.gz	KRIXGRUQJUURMD-GOSISDBHSA-N	0	3	326.484	3.445	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@@H]2CCN(Cc3ccccc3C)C2)cc1	ZINC001033319205	1341780018	/nfs/dbraw/zinc/78/00/18/1341780018.db2.gz	RGBXJBFWUSXQDZ-OAQYLSRUSA-N	0	3	332.447	3.323	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)[C@]2(c3ccccc3)CC2(C)C)C1	ZINC001033523031	1341858113	/nfs/dbraw/zinc/85/81/13/1341858113.db2.gz	VZMDCUNUONFHQH-WIYYLYMNSA-N	0	3	326.484	3.463	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@H]2CCN([C@H](C)c3cccc(C)c3)C2)cn1	ZINC001033597707	1341890006	/nfs/dbraw/zinc/89/00/06/1341890006.db2.gz	USVJUSCESJTNDA-UTKZUKDTSA-N	0	3	347.462	3.279	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@H]2CCN(Cc3ccc(C)cc3C)C2)cn1	ZINC001033602700	1341892709	/nfs/dbraw/zinc/89/27/09/1341892709.db2.gz	HEUSGOHQRDIVJJ-NRFANRHFSA-N	0	3	347.462	3.026	20	30		EGEDHN
C#CCCN1CC[C@H](N(C)C(=O)c2c(Cl)cccc2Cl)C1	ZINC001033611385	1341901969	/nfs/dbraw/zinc/90/19/69/1341901969.db2.gz	SAPGNZUMHLMGPS-LBPRGKRZSA-N	0	3	325.239	3.163	20	30		EGEDHN
C#CCCN1CC[C@@H](N(C)C(=O)c2csc3c2CC[C@@H](C)C3)C1	ZINC001033634517	1341916380	/nfs/dbraw/zinc/91/63/80/1341916380.db2.gz	QNBSRHNSRCKBJY-HUUCEWRRSA-N	0	3	330.497	3.043	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)C2C3CC4CC(C3)CC2C4)C1	ZINC001033857261	1342047143	/nfs/dbraw/zinc/04/71/43/1342047143.db2.gz	BWMLUBKLRRYLFE-RDOIFFKNSA-N	0	3	328.500	3.005	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@H]2CCc3cc(C)ccc3O2)C1	ZINC001033900953	1342073631	/nfs/dbraw/zinc/07/36/31/1342073631.db2.gz	NMHYNQOUHZKUPK-UYAOXDASSA-N	0	3	342.483	3.188	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)[C@@H]2C[C@H]2c2cccc(Cl)c2)C1	ZINC001033979652	1342127455	/nfs/dbraw/zinc/12/74/55/1342127455.db2.gz	KOSCVUGXQFASJI-GBESFXJTSA-N	0	3	344.886	3.390	20	30		EGEDHN
C=CCCN1CC[C@@H](N(CC)C(=O)c2cnc([C@H]3CCCO3)s2)C1	ZINC001033980538	1342128217	/nfs/dbraw/zinc/12/82/17/1342128217.db2.gz	UXFKRQXGLOUXPU-HUUCEWRRSA-N	0	3	349.500	3.107	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@H]2CCOc3ccccc32)C1	ZINC001033992754	1342136010	/nfs/dbraw/zinc/13/60/10/1342136010.db2.gz	XDWMOHRWFNTJQT-AEFFLSMTSA-N	0	3	328.456	3.052	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccnc(O[C@@H](C)CC)c2)C1	ZINC001034014175	1342150497	/nfs/dbraw/zinc/15/04/97/1342150497.db2.gz	YSKTVCDIKASUCG-WMZOPIPTSA-N	0	3	345.487	3.371	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@@H]2CCCc3sc(C)nc32)C1	ZINC001034015200	1342152781	/nfs/dbraw/zinc/15/27/81/1342152781.db2.gz	MAEYDDXOKZYIKE-JKSUJKDBSA-N	0	3	347.528	3.370	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2ccc(N(CC)CC)cc2)C1	ZINC001034025385	1342163043	/nfs/dbraw/zinc/16/30/43/1342163043.db2.gz	HJKYASGKZCIPAY-FQEVSTJZSA-N	0	3	341.499	3.093	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2cccc(C(F)(F)F)c2)C1	ZINC001034026093	1342164027	/nfs/dbraw/zinc/16/40/27/1342164027.db2.gz	UMIPOTDEJCTKRP-INIZCTEOSA-N	0	3	338.373	3.265	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2ccc3[nH]c(C)c(C)c3c2)C1	ZINC001034038264	1342178112	/nfs/dbraw/zinc/17/81/12/1342178112.db2.gz	RVPVAACVWJUCIY-GOSISDBHSA-N	0	3	337.467	3.344	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](N(CC)C(=O)c2cccc(CN(C)C)c2)C1	ZINC001034045850	1342185976	/nfs/dbraw/zinc/18/59/76/1342185976.db2.gz	NXDQQKJFIVIXCF-SFHVURJKSA-N	0	3	349.906	3.037	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)c2cc(F)cc3ccncc32)C1	ZINC001034212179	1342321009	/nfs/dbraw/zinc/32/10/09/1342321009.db2.gz	GRGWTHVTHPRPPA-MRXNPFEDSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=C(C)CCN1CCCC[C@@H](NC(=O)c2nc3cccnc3s2)C1	ZINC001034251541	1342347730	/nfs/dbraw/zinc/34/77/30/1342347730.db2.gz	USEWPUVXNKJBSN-CQSZACIVSA-N	0	3	344.484	3.242	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)C(C)(C)c2cc(C)ccn2)C1	ZINC001034275157	1342365708	/nfs/dbraw/zinc/36/57/08/1342365708.db2.gz	XITOKZABNSPWQM-QGZVFWFLSA-N	0	3	329.488	3.214	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cc(C)n([C@@H](C)CC)n2)C1	ZINC001034281791	1342371191	/nfs/dbraw/zinc/37/11/91/1342371191.db2.gz	KIXMNMNXDUNYLN-RDJZCZTQSA-N	0	3	332.492	3.323	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@H]2CCc3ccc(F)cc3O2)C1	ZINC001034306055	1342389354	/nfs/dbraw/zinc/38/93/54/1342389354.db2.gz	BLLGIVHYQYIDBK-ZWKOTPCHSA-N	0	3	346.446	3.066	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@H]2CCc3cc(F)ccc32)C1	ZINC001034312638	1342393501	/nfs/dbraw/zinc/39/35/01/1342393501.db2.gz	RAJMNNBBMVFCGG-HKUYNNGSSA-N	0	3	330.447	3.402	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2ccc(F)c(Cl)c2F)C1	ZINC001034376967	1342446176	/nfs/dbraw/zinc/44/61/76/1342446176.db2.gz	QQBWKJIHQVGGSW-GFCCVEGCSA-N	0	3	340.801	3.226	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2c[nH]c(=O)c3ccccc23)C1	ZINC001034430124	1342492294	/nfs/dbraw/zinc/49/22/94/1342492294.db2.gz	AMVJSPQKYWRYDF-OAHLLOKOSA-N	0	3	339.439	3.101	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2OC)C1	ZINC001034433279	1342495320	/nfs/dbraw/zinc/49/53/20/1342495320.db2.gz	OECRNNDQUCFUTP-YTQUADARSA-N	0	3	342.483	3.346	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@H](C)n2cnc3ccccc32)C1	ZINC001034474638	1342529366	/nfs/dbraw/zinc/52/93/66/1342529366.db2.gz	UERYXSBTFXIPHW-IRXDYDNUSA-N	0	3	340.471	3.144	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc(-c3c[nH]cn3)cc2)C1	ZINC001034474889	1342529581	/nfs/dbraw/zinc/52/95/81/1342529581.db2.gz	ZHXSJGIIZARTFM-SFHVURJKSA-N	0	3	338.455	3.237	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc(-c3c[nH]cn3)cc2)C1	ZINC001034474888	1342529967	/nfs/dbraw/zinc/52/99/67/1342529967.db2.gz	ZHXSJGIIZARTFM-GOSISDBHSA-N	0	3	338.455	3.237	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@@]2(C)CCOc3ccccc32)C1	ZINC001034485592	1342544008	/nfs/dbraw/zinc/54/40/08/1342544008.db2.gz	FJZYHAFGPMGOFS-UTKZUKDTSA-N	0	3	342.483	3.274	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCCN(Cc3cccc(C)c3)C2)nc1	ZINC001034493645	1342548912	/nfs/dbraw/zinc/54/89/12/1342548912.db2.gz	OGKBTHBEVDTHJN-FQEVSTJZSA-N	0	3	347.462	3.156	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)[C@@H]2C[C@H]2c2cccc(F)c2F)C1	ZINC001034531694	1342587000	/nfs/dbraw/zinc/58/70/00/1342587000.db2.gz	IMOPMBBYZJCORQ-VNQPRFMTSA-N	0	3	334.410	3.225	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2ccccc2OCC2CC2)C1	ZINC001034540640	1342600490	/nfs/dbraw/zinc/60/04/90/1342600490.db2.gz	JOJHPZLHSPHDDW-GOSISDBHSA-N	0	3	340.467	3.083	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2cc3cccc(F)c3o2)C1	ZINC001034543107	1342603266	/nfs/dbraw/zinc/60/32/66/1342603266.db2.gz	VUWQLEOEXXAAFC-HNNXBMFYSA-N	0	3	328.387	3.180	20	30		EGEDHN
N#Cc1ccc(F)cc1CN[C@H]1CC[C@H](NC(=O)C=C2CCC2)CC1	ZINC001034624913	1342657598	/nfs/dbraw/zinc/65/75/98/1342657598.db2.gz	XTXAIBQMSIPODK-WGSAOQKQSA-N	0	3	341.430	3.325	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N[C@H]1CC[C@H](NCc2ccccc2C#N)CC1	ZINC001034627334	1342659758	/nfs/dbraw/zinc/65/97/58/1342659758.db2.gz	QUEXRITYYZTXHN-KZNAEPCWSA-N	0	3	325.456	3.121	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)[C@@H]2CC[C@@H](F)C2)CC1	ZINC001034719760	1342713513	/nfs/dbraw/zinc/71/35/13/1342713513.db2.gz	XOKBNNCAJZWJIP-AAVRWANBSA-N	0	3	347.272	3.050	20	30		EGEDHN
N#Cc1ccc(CNCc2ccc(CNC(=O)c3ccoc3)cc2)cc1	ZINC001034807090	1342772817	/nfs/dbraw/zinc/77/28/17/1342772817.db2.gz	FOFBWYKDAFPGKQ-UHFFFAOYSA-N	0	3	345.402	3.371	20	30		EGEDHN
C/C(=C/C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)cc1F)C1CC1	ZINC001034873662	1342815375	/nfs/dbraw/zinc/81/53/75/1342815375.db2.gz	LTWVGKODDDTNDK-GIIHOQTISA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)Cc2cccc(OC)c2)C12CCC2	ZINC001078797685	1357090134	/nfs/dbraw/zinc/09/01/34/1357090134.db2.gz	LCVHKOOTGSCOBN-IRXDYDNUSA-N	0	3	348.874	3.007	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)c2ccoc2Cl)s1	ZINC001034917568	1342835905	/nfs/dbraw/zinc/83/59/05/1342835905.db2.gz	DLGFGCSZRVPDNM-LLVKDONJSA-N	0	3	349.843	3.261	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)c(F)c1	ZINC001034944566	1342846537	/nfs/dbraw/zinc/84/65/37/1342846537.db2.gz	GQZCXJGKOHDVOF-QGZVFWFLSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC1(C)CC[C@H]1C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)s1	ZINC001035021640	1342881574	/nfs/dbraw/zinc/88/15/74/1342881574.db2.gz	HPLNXALWZNQLNR-CJNGLKHVSA-N	0	3	331.485	3.137	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H]1CNCc1ccc(Cl)nc1	ZINC001035035209	1342888868	/nfs/dbraw/zinc/88/88/68/1342888868.db2.gz	GZCLMDVWSJLENG-CRAIPNDOSA-N	0	3	335.879	3.418	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)[C@@]23C[C@@H]2CCCC3)s1	ZINC001035040632	1342893108	/nfs/dbraw/zinc/89/31/08/1342893108.db2.gz	AYHOVDQRIJWUFW-KHYOSLBOSA-N	0	3	343.496	3.281	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]2CNCc2cc(C)ccc2OC)C1	ZINC001035043103	1342895126	/nfs/dbraw/zinc/89/51/26/1342895126.db2.gz	QSIPVGHQLXVTFZ-GOSISDBHSA-N	0	3	342.483	3.441	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)c(F)c1	ZINC001035044800	1342896302	/nfs/dbraw/zinc/89/63/02/1342896302.db2.gz	ZLCGXZKNGYZRLO-KBAYOESNSA-N	0	3	343.446	3.214	20	30		EGEDHN
CC(C)=CC(=O)N1CCC2(CCN(Cc3ccc(C#N)s3)C2)CC1	ZINC001035152888	1342966561	/nfs/dbraw/zinc/96/65/61/1342966561.db2.gz	HSLRBLOSZKWWKJ-UHFFFAOYSA-N	0	3	343.496	3.400	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC2(CN(Cc3ccc4ccccc4c3)C2)CC1	ZINC001035668531	1343128867	/nfs/dbraw/zinc/12/88/67/1343128867.db2.gz	HPFSNTOOPCOIMG-QGZVFWFLSA-N	0	3	347.462	3.424	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cccc(Cl)c1F)CC2	ZINC001035781574	1343191925	/nfs/dbraw/zinc/19/19/25/1343191925.db2.gz	HJVJUMWDPDYLQN-UHFFFAOYSA-N	0	3	334.822	3.040	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc[nH]c1C1CCC1)CC2	ZINC001035799520	1343203983	/nfs/dbraw/zinc/20/39/83/1343203983.db2.gz	XLKMTEPJCFWQJG-UHFFFAOYSA-N	0	3	327.472	3.396	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)C(C)(C)c1ccc(F)cc1)CC2	ZINC001035838975	1343221838	/nfs/dbraw/zinc/22/18/38/1343221838.db2.gz	IAUCHDPWFVQBPC-UHFFFAOYSA-N	0	3	342.458	3.051	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cc1ccc(Cl)cc1)CC2	ZINC001035844961	1343225999	/nfs/dbraw/zinc/22/59/99/1343225999.db2.gz	WDMKVWIMLAICBK-UHFFFAOYSA-N	0	3	332.875	3.383	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H](NCc2cc(C)no2)[C@@H](C)C1	ZINC001036041942	1343309559	/nfs/dbraw/zinc/30/95/59/1343309559.db2.gz	HLTDZNHGFKVJLC-XHDPSFHLSA-N	0	3	339.867	3.088	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](NCc2ccccc2C#N)[C@@H](C)C1	ZINC001036144940	1343327757	/nfs/dbraw/zinc/32/77/57/1343327757.db2.gz	VVMCVJSDTCAERI-MAUKXSAKSA-N	0	3	325.456	3.097	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@H](NCc2cc(F)ccc2C#N)[C@H](C)C1	ZINC001036163217	1343338281	/nfs/dbraw/zinc/33/82/81/1343338281.db2.gz	FKJNQQLMNXNANA-KDOFPFPSSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3cscn3)[C@@H](C)C2)CC1	ZINC001036163559	1343338706	/nfs/dbraw/zinc/33/87/06/1343338706.db2.gz	LMCXORQTBDKWQC-WMLDXEAASA-N	0	3	333.501	3.216	20	30		EGEDHN
C[C@@H]1CN(C(=O)C(C)(C)C)CC[C@@H]1NCc1cc(F)ccc1C#N	ZINC001036274380	1343391228	/nfs/dbraw/zinc/39/12/28/1343391228.db2.gz	WOTMFQHQHUOOFQ-DYVFJYSZSA-N	0	3	331.435	3.070	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]([C@H](C)NCc2ncc(C)s2)C1	ZINC001036427212	1343480157	/nfs/dbraw/zinc/48/01/57/1343480157.db2.gz	JUEMWGSEKPZOGM-LSDHHAIUSA-N	0	3	335.517	3.380	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]([C@H](C)NCc2cc(C3CC3)no2)C1	ZINC001036429398	1343481757	/nfs/dbraw/zinc/48/17/57/1343481757.db2.gz	ULYDERLUODWTER-GOEBONIOSA-N	0	3	345.487	3.481	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@@H]([C@@H](C)NCc3cnns3)C2)CC1	ZINC001036431671	1343483366	/nfs/dbraw/zinc/48/33/66/1343483366.db2.gz	UQRNISMIKOKZJG-GDBMZVCRSA-N	0	3	348.516	3.001	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H]([C@@H](C)NCc2ccn(CC)n2)C1	ZINC001036443759	1343491387	/nfs/dbraw/zinc/49/13/87/1343491387.db2.gz	WIGZUZAIONSVMW-SJORKVTESA-N	0	3	346.519	3.222	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCCN(C(=O)C2(CF)CC2)C1	ZINC001036450352	1343494567	/nfs/dbraw/zinc/49/45/67/1343494567.db2.gz	KSDDSUHRDLBISZ-QAPCUYQASA-N	0	3	343.446	3.025	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCCN(C(=O)C(C)(C)C)C1	ZINC001036466045	1343500631	/nfs/dbraw/zinc/50/06/31/1343500631.db2.gz	PEBYKBSFPYIKKT-QAPCUYQASA-N	0	3	327.472	3.321	20	30		EGEDHN
CCCC(=O)N1CCC[C@@H](C)[C@@H]1CNCc1cc(C#N)ccc1F	ZINC001036492094	1343514835	/nfs/dbraw/zinc/51/48/35/1343514835.db2.gz	BOENTANHGGZODK-KDOFPFPSSA-N	0	3	331.435	3.214	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@@H](C)[C@@H]1CNCc1cc(C#N)ccc1F	ZINC001036492251	1343515007	/nfs/dbraw/zinc/51/50/07/1343515007.db2.gz	JODVKMJQOJUTHC-BEFAXECRSA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)CC2CC2)[C@H]1CNCc1ccc(C#N)cc1F	ZINC001036492454	1343515099	/nfs/dbraw/zinc/51/50/99/1343515099.db2.gz	CXPMASHUUINJSK-KUHUBIRLSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)C=C2CCC2)[C@@H]1CNCc1ccc(C#N)s1	ZINC001036534614	1343541843	/nfs/dbraw/zinc/54/18/43/1343541843.db2.gz	IYRLINGSAXWYOO-RDTXWAMCSA-N	0	3	343.496	3.447	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@H]2CN(C(=O)C3CCCC3)CC[C@H]21	ZINC001036621145	1343579825	/nfs/dbraw/zinc/57/98/25/1343579825.db2.gz	PMDOKTJCESNIRW-VQTJNVASSA-N	0	3	337.467	3.171	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccc(C#N)c(F)c2)C1	ZINC001036631620	1343589014	/nfs/dbraw/zinc/58/90/14/1343589014.db2.gz	AKKIDKAIIPBJPD-IEBWSBKVSA-N	0	3	341.430	3.086	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001036632212	1343589215	/nfs/dbraw/zinc/58/92/15/1343589215.db2.gz	KAOKAGJXOYFOSY-RHSMWYFYSA-N	0	3	329.469	3.009	20	30		EGEDHN
Cc1ccoc1C(=O)N1CC[C@@H]2[C@H](CCN2CC#Cc2ccccc2)C1	ZINC001036648202	1343598787	/nfs/dbraw/zinc/59/87/87/1343598787.db2.gz	DJTLTGBKPUXHDY-WOJBJXKFSA-N	0	3	348.446	3.176	20	30		EGEDHN
C/C=C(\C)C(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccc(C#N)cc2F)C1	ZINC001036682868	1343625588	/nfs/dbraw/zinc/62/55/88/1343625588.db2.gz	KQTWFYKUEVDYCO-HVAXQBDLSA-N	0	3	341.430	3.086	20	30		EGEDHN
O=C(C=C1CCC1)N1CC[C@@H]2[C@H](CCN2CC#Cc2ccccc2)C1	ZINC001036688544	1343631564	/nfs/dbraw/zinc/63/15/64/1343631564.db2.gz	URGOTTHOCRGIJH-NHCUHLMSSA-N	0	3	334.463	3.071	20	30		EGEDHN
CC1(CC(=O)N2CC[C@H]3[C@H](CCN3Cc3ccccc3C#N)C2)CC1	ZINC001036775751	1343705478	/nfs/dbraw/zinc/70/54/78/1343705478.db2.gz	ACCKGVPFFFUPGI-MOPGFXCFSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2[C@@H](CCN2Cc2cnoc2C)C1	ZINC001036794417	1343727216	/nfs/dbraw/zinc/72/72/16/1343727216.db2.gz	USZAANPARFYPJR-RDJZCZTQSA-N	0	3	331.460	3.008	20	30		EGEDHN
O=C([C@H]1C[C@H]2C[C@H]2C1)N1CC[C@H]2[C@H](CCN2CC#Cc2ccccc2)C1	ZINC001036798307	1343732253	/nfs/dbraw/zinc/73/22/53/1343732253.db2.gz	IZOTVNFENBVWQB-AANPDWTMSA-N	0	3	348.490	3.007	20	30		EGEDHN
O=C([C@H]1C[C@H]2C[C@H]2C1)N1CC[C@@H]2[C@H](CCN2CC#Cc2ccccc2)C1	ZINC001036798309	1343732748	/nfs/dbraw/zinc/73/27/48/1343732748.db2.gz	IZOTVNFENBVWQB-LXHROKJGSA-N	0	3	348.490	3.007	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@H]2[C@H](CCN2Cc2ccc(F)c(C#N)c2)C1	ZINC001036876701	1343816701	/nfs/dbraw/zinc/81/67/01/1343816701.db2.gz	UKKHLIVRJHSKQC-QAPCUYQASA-N	0	3	343.446	3.166	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H]2CCC[C@H]2CNCc2ccccc2C#N)o1	ZINC001036938537	1343881851	/nfs/dbraw/zinc/88/18/51/1343881851.db2.gz	WTJGMBLUCVHIKU-ROUUACIJSA-N	0	3	337.423	3.148	20	30		EGEDHN
Cc1occc1C(=O)N[C@@H]1CCC[C@@H]1CNCc1ccccc1C#N	ZINC001036940240	1343883775	/nfs/dbraw/zinc/88/37/75/1343883775.db2.gz	WPSDATGMZQMVDN-IEBWSBKVSA-N	0	3	337.423	3.148	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCC[C@@H]2CNCc2cc(C)no2)CC1	ZINC001037070739	1343963665	/nfs/dbraw/zinc/96/36/65/1343963665.db2.gz	WDSHVKNDYMCLAT-AEFFLSMTSA-N	0	3	331.460	3.104	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCC[C@H]2CNCc2nccn2CC)CC1	ZINC001037070505	1343964128	/nfs/dbraw/zinc/96/41/28/1343964128.db2.gz	SEHUFUOTFJJYNJ-ROUUACIJSA-N	0	3	344.503	3.024	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCC[C@H]1NC(=O)c1ccncc1	ZINC001037162797	1344011071	/nfs/dbraw/zinc/01/10/71/1344011071.db2.gz	OHNAVAZJMLCSEC-VQTJNVASSA-N	0	3	348.450	3.032	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCCC[C@H]2CNCc2ccn(CC)n2)C1	ZINC001037243276	1344064623	/nfs/dbraw/zinc/06/46/23/1344064623.db2.gz	VHUOWNMCTHQWPG-WMZOPIPTSA-N	0	3	344.503	3.024	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](NCc2nccn2CC)[C@@H](CC)C1	ZINC001037908359	1344171595	/nfs/dbraw/zinc/17/15/95/1344171595.db2.gz	XKLUVWFKQTUTTQ-DLBZAZTESA-N	0	3	346.519	3.222	20	30		EGEDHN
CC[C@@H]1CN(C(=O)C(C)(C)C)CC[C@H]1NCc1cc(F)ccc1C#N	ZINC001037964148	1344207355	/nfs/dbraw/zinc/20/73/55/1344207355.db2.gz	XLJFPZQCWOHMPA-RDTXWAMCSA-N	0	3	345.462	3.460	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCN2CCCc2ccccc2)cc1	ZINC001038582849	1344493558	/nfs/dbraw/zinc/49/35/58/1344493558.db2.gz	QWGGBEWENGPRTB-NRFANRHFSA-N	0	3	332.447	3.105	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1ccnc(O[C@H](C)CC)c1	ZINC001038895407	1344638514	/nfs/dbraw/zinc/63/85/14/1344638514.db2.gz	VJMSIDPQRFMWFH-WBVHZDCISA-N	0	3	331.460	3.029	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1cnn(CCC(C)C)c1C	ZINC001038898357	1344639006	/nfs/dbraw/zinc/63/90/06/1344639006.db2.gz	ZBXXPQLKRDTFGW-KRWDZBQOSA-N	0	3	332.492	3.008	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2csc(C)c2C)C1	ZINC001039204311	1344915309	/nfs/dbraw/zinc/91/53/09/1344915309.db2.gz	ZIYXYZKKNAUXIG-SJLPKXTDSA-N	0	3	330.497	3.315	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)Cc2cccc(CC)c2)C1	ZINC001039215019	1344930914	/nfs/dbraw/zinc/93/09/14/1344930914.db2.gz	VFRWIJSPZXSJRC-NHCUHLMSSA-N	0	3	338.495	3.128	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)Cc2cccc(CC)c2)C1	ZINC001039215025	1344930966	/nfs/dbraw/zinc/93/09/66/1344930966.db2.gz	VFRWIJSPZXSJRC-SFTDATJTSA-N	0	3	338.495	3.128	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(C)c(F)c2)C1	ZINC001039216715	1344933557	/nfs/dbraw/zinc/93/35/57/1344933557.db2.gz	RGUPSWIPTAUMFQ-IEBWSBKVSA-N	0	3	328.431	3.084	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)CCc2ccc(C)cc2)C1	ZINC001039218410	1344936017	/nfs/dbraw/zinc/93/60/17/1344936017.db2.gz	LQTXDUPOPSRHSV-LEWJYISDSA-N	0	3	338.495	3.264	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(C)c(C)n2)C1	ZINC001039228544	1344947587	/nfs/dbraw/zinc/94/75/87/1344947587.db2.gz	JDBCORUPHXERRC-ICSRJNTNSA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cccc3c2ccn3C)C1	ZINC001039232866	1344952478	/nfs/dbraw/zinc/95/24/78/1344952478.db2.gz	ZGECQWYNJVREIN-FXAWDEMLSA-N	0	3	349.478	3.128	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)Cc2ccccc2F)C1	ZINC001039241330	1344966212	/nfs/dbraw/zinc/96/62/12/1344966212.db2.gz	ZMWIIUQAGPZWSI-AZUAARDMSA-N	0	3	342.458	3.095	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2nc(C)c(C)s2)C1	ZINC001039242499	1344968919	/nfs/dbraw/zinc/96/89/19/1344968919.db2.gz	PDTSCDILGGNDDJ-IAGOWNOFSA-N	0	3	345.512	3.100	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(Cl)cn2CC)C1	ZINC001039243772	1344971027	/nfs/dbraw/zinc/97/10/27/1344971027.db2.gz	WBWXSVQXMQWZPC-WBVHZDCISA-N	0	3	347.890	3.111	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)CC(C2CC2)C2CC2)C1	ZINC001039244922	1344973523	/nfs/dbraw/zinc/97/35/23/1344973523.db2.gz	ZOPOMHZAIRBRDS-QUCCMNQESA-N	0	3	328.500	3.149	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2coc3ccccc23)C1	ZINC001039253564	1344985076	/nfs/dbraw/zinc/98/50/76/1344985076.db2.gz	JYHXLHZGBLTNNI-QFBILLFUSA-N	0	3	336.435	3.383	20	30		EGEDHN
Cc1cc(CN2CC[C@H]3CC[C@@H](C2)N3C(=O)[C@@H](C)C#N)c(C)s1	ZINC001039343270	1345021607	/nfs/dbraw/zinc/02/16/07/1345021607.db2.gz	NMQWYBLUOXEOIV-VUCTXSBTSA-N	0	3	331.485	3.090	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cn(C)c2ccc(F)cc12	ZINC001039387558	1345039762	/nfs/dbraw/zinc/03/97/62/1345039762.db2.gz	XEAUJISRNQGWNT-CVEARBPZSA-N	0	3	341.430	3.182	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cnc2ccccc2c1	ZINC001039442975	1345068895	/nfs/dbraw/zinc/06/88/95/1345068895.db2.gz	CQSPOUYAJNWUFR-MOPGFXCFSA-N	0	3	335.451	3.490	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(Cl)c(OC)c1	ZINC001039448040	1345072538	/nfs/dbraw/zinc/07/25/38/1345072538.db2.gz	SRSFJISBTLPHHL-CVEARBPZSA-N	0	3	346.858	3.051	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccnc(OC(C)C)c1	ZINC001039459606	1345079189	/nfs/dbraw/zinc/07/91/89/1345079189.db2.gz	FFWADYWXSRMTBI-MSOLQXFVSA-N	0	3	343.471	3.124	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H](C)c1ccc(OC)cc1	ZINC001039472959	1345088010	/nfs/dbraw/zinc/08/80/10/1345088010.db2.gz	NZCJQNOIQDSFNO-QRQLOZEOSA-N	0	3	342.483	3.440	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC[C@H]1CCCO1	ZINC001039897116	1345239601	/nfs/dbraw/zinc/23/96/01/1345239601.db2.gz	USZCSRYAGWBDGU-RMJJICAUSA-N	0	3	334.504	3.223	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@]3(CCN(C(=O)/C=C/C4CC4)C3)C2)c1	ZINC001040134261	1345346186	/nfs/dbraw/zinc/34/61/86/1345346186.db2.gz	ORXCXJUPVMSOSE-DORXLWPQSA-N	0	3	349.478	3.339	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cc(C)c(F)cc3F)C2)C1	ZINC001040253465	1345396393	/nfs/dbraw/zinc/39/63/93/1345396393.db2.gz	JANPWGBOWRNBDV-FQEVSTJZSA-N	0	3	346.421	3.225	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3cn(CC)c4ccccc34)C2)C1	ZINC001040283621	1345411567	/nfs/dbraw/zinc/41/15/67/1345411567.db2.gz	NZTKYXPYIXLPBV-JOCHJYFZSA-N	0	3	349.478	3.223	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3cc4c(cc(C)cc4C)[nH]3)C2)C1	ZINC001040317519	1345428785	/nfs/dbraw/zinc/42/87/85/1345428785.db2.gz	MGRWBMKMCRLGLM-QFIPXVFZSA-N	0	3	349.478	3.346	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ccc4ncccc4c3)C2)C1	ZINC001040371357	1345459870	/nfs/dbraw/zinc/45/98/70/1345459870.db2.gz	IDTQRVSVIUBBCB-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3c(F)ccc(C)c3F)C2)C1	ZINC001040372000	1345460484	/nfs/dbraw/zinc/46/04/84/1345460484.db2.gz	NSUCLKQWYAQVSV-IBGZPJMESA-N	0	3	334.410	3.387	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@]2(C1)CCCN(Cc1ccccn1)C2	ZINC001040373990	1345461076	/nfs/dbraw/zinc/46/10/76/1345461076.db2.gz	YFALXPJPSKZCMG-SFTDATJTSA-N	0	3	341.499	3.498	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cn(CC)nc3C(C)C)C2)C1	ZINC001040422015	1345488042	/nfs/dbraw/zinc/48/80/42/1345488042.db2.gz	JGPFNKZTKASBTH-HXUWFJFHSA-N	0	3	344.503	3.141	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@@H](F)c3ccccc3)C2)C1	ZINC001040425012	1345491017	/nfs/dbraw/zinc/49/10/17/1345491017.db2.gz	PGVIMOLJSDYEQO-AZUAARDMSA-N	0	3	328.431	3.035	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3oc(CC(C)C)nc3C)C2)C1	ZINC001040436356	1345499135	/nfs/dbraw/zinc/49/91/35/1345499135.db2.gz	VKUSPYNWVIBJRK-FQEVSTJZSA-N	0	3	345.487	3.296	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@@H](C)c3ccc(CC)cc3)C2)C1	ZINC001040451123	1345507428	/nfs/dbraw/zinc/50/74/28/1345507428.db2.gz	BELWUKDDTNKLRV-AVRDEDQJSA-N	0	3	338.495	3.300	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ccc(Cl)s3)C2)C1	ZINC001040520617	1345530928	/nfs/dbraw/zinc/53/09/28/1345530928.db2.gz	UCFCOANEZUMLQS-KRWDZBQOSA-N	0	3	336.888	3.353	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@]3(C)CC=C(C)CC3)C2)C1	ZINC001040539873	1345537831	/nfs/dbraw/zinc/53/78/31/1345537831.db2.gz	SCJUNENNLGWOKH-NHCUHLMSSA-N	0	3	328.500	3.461	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)Cc3cccc(CC)c3)C2)CC1	ZINC001040754990	1345575230	/nfs/dbraw/zinc/57/52/30/1345575230.db2.gz	ZSUWUARKWSTBTD-UHFFFAOYSA-N	0	3	338.495	3.129	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)C3(c4ccccc4)CCC3)C2)CC1	ZINC001040764988	1345576609	/nfs/dbraw/zinc/57/66/09/1345576609.db2.gz	CUHZIJXTYBTPRK-UHFFFAOYSA-N	0	3	336.479	3.056	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3c(C)cccc3Cl)C2)CC1	ZINC001040830782	1345583947	/nfs/dbraw/zinc/58/39/47/1345583947.db2.gz	NTYXYWHSWFBZHG-UHFFFAOYSA-N	0	3	330.859	3.210	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3csc(Cl)c3)C2)CC1	ZINC001040875365	1345592765	/nfs/dbraw/zinc/59/27/65/1345592765.db2.gz	ZRGICHUQBJBFIW-UHFFFAOYSA-N	0	3	336.888	3.353	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)CCc3ccc(C)s3)C2)CC1	ZINC001040953562	1345609653	/nfs/dbraw/zinc/60/96/53/1345609653.db2.gz	CEJKSCLLPOWJLR-UHFFFAOYSA-N	0	3	344.524	3.327	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N1CC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001041219010	1345681082	/nfs/dbraw/zinc/68/10/82/1345681082.db2.gz	LFMHTQBSDIAJIV-GHTZIAJQSA-N	0	3	337.467	3.029	20	30		EGEDHN
C[C@H](c1ccc(F)cc1)N1CC[C@]2(CCN(C(=O)C#CC3CC3)C2)C1	ZINC001041266463	1345690904	/nfs/dbraw/zinc/69/09/04/1345690904.db2.gz	SDEVGHWDOQALMW-IERDGZPVSA-N	0	3	340.442	3.225	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccc4nccc(C)c4c3)C2)C1	ZINC001041321150	1345701643	/nfs/dbraw/zinc/70/16/43/1345701643.db2.gz	HVJDMFFADIKAFF-QFIPXVFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cc(C)c4ccccc4n3)C2)C1	ZINC001041413939	1345722687	/nfs/dbraw/zinc/72/26/87/1345722687.db2.gz	XWMAKJQPVBLAFG-QFIPXVFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cc4ccc(C)cc4[nH]3)C2)C1	ZINC001041515027	1345748994	/nfs/dbraw/zinc/74/89/94/1345748994.db2.gz	NHSGZKMQWZWRBH-OAQYLSRUSA-N	0	3	335.451	3.038	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cc4ccc(C)cc4[nH]3)C2)C1	ZINC001041515026	1345749520	/nfs/dbraw/zinc/74/95/20/1345749520.db2.gz	NHSGZKMQWZWRBH-NRFANRHFSA-N	0	3	335.451	3.038	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@]2(CCN(Cc3c(C)noc3C)C2)C1	ZINC001041535245	1345754754	/nfs/dbraw/zinc/75/47/54/1345754754.db2.gz	FBSMVPCIJHPTEG-HXUWFJFHSA-N	0	3	345.487	3.318	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@]2(CCN(Cc3cnccc3C)C2)C1	ZINC001041545396	1345759357	/nfs/dbraw/zinc/75/93/57/1345759357.db2.gz	VNAYWMAZFAFOFL-FQEVSTJZSA-N	0	3	327.472	3.027	20	30		EGEDHN
CC1(C(=O)N2CC[C@]3(CCN(Cc4ccc(C#N)cc4)C3)C2)CCC1	ZINC001041557321	1345768077	/nfs/dbraw/zinc/76/80/77/1345768077.db2.gz	VJVGCJFWPZQFKL-NRFANRHFSA-N	0	3	337.467	3.173	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@]2(CCN(Cc3scnc3C)C2)C1	ZINC001041626425	1345801212	/nfs/dbraw/zinc/80/12/12/1345801212.db2.gz	SJRUAKSHGZFXDY-RTBURBONSA-N	0	3	347.528	3.478	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@]3(CCN(Cc4cncc(C)c4)C3)C2)C1	ZINC001041652933	1345812186	/nfs/dbraw/zinc/81/21/86/1345812186.db2.gz	OIKWVUYFIONCRD-OAQYLSRUSA-N	0	3	339.483	3.171	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3cc(C(C)(C)C)oc3C)C2)C1	ZINC001041707879	1345824593	/nfs/dbraw/zinc/82/45/93/1345824593.db2.gz	TUXIUTCZUKCGFW-FQEVSTJZSA-N	0	3	328.456	3.057	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cc4cc(F)ccc4o3)C2)C1	ZINC001041716135	1345828950	/nfs/dbraw/zinc/82/89/50/1345828950.db2.gz	OWFNZTUEYGSSQN-FQEVSTJZSA-N	0	3	340.398	3.133	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@]3(CCN(C(=O)[C@@H]4C[C@H]4C4CC4)C3)C2)c1	ZINC001041731991	1345834950	/nfs/dbraw/zinc/83/49/50/1345834950.db2.gz	COHZDBZAKFVVAW-VWPQPMDRSA-N	0	3	349.478	3.029	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)[C@@]3(C)C[C@@H]3c3ccccc3)C2)C1	ZINC001041733715	1345835172	/nfs/dbraw/zinc/83/51/72/1345835172.db2.gz	CIIHCGHUTWVJHH-HJNYFJLDSA-N	0	3	336.479	3.128	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)[C@H](C)c3ccc(CC)cc3)C2)C1	ZINC001041742259	1345838582	/nfs/dbraw/zinc/83/85/82/1345838582.db2.gz	YZWAWEZTQXTRAP-GCJKJVERSA-N	0	3	338.495	3.300	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cc(Cl)ccc3C)C2)C1	ZINC001041745064	1345838925	/nfs/dbraw/zinc/83/89/25/1345838925.db2.gz	PYYCBAODAGSWLL-LJQANCHMSA-N	0	3	330.859	3.210	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccc4c(c3)CCC=C4)C2)C1	ZINC001041791529	1345851413	/nfs/dbraw/zinc/85/14/13/1345851413.db2.gz	MCHQQBLQQIDODA-QFIPXVFZSA-N	0	3	334.463	3.207	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)C(CC)(CC)c3ccccc3)C2)C1	ZINC001041841689	1345869478	/nfs/dbraw/zinc/86/94/78/1345869478.db2.gz	RJYVWHHVLMJKGO-OAQYLSRUSA-N	0	3	338.495	3.302	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)CCc3cc(C)sc3C)C2)C1	ZINC001041850766	1345872929	/nfs/dbraw/zinc/87/29/29/1345872929.db2.gz	NUVSASRKXQMKHD-FQEVSTJZSA-N	0	3	344.524	3.245	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3nc(C(C)C)oc3C)C[C@@H]21	ZINC001042059891	1345932912	/nfs/dbraw/zinc/93/29/12/1345932912.db2.gz	FSUWSQWJCCNBKY-HOTGVXAUSA-N	0	3	331.460	3.219	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(C(C)(C)C)cn3)C[C@H]21	ZINC001042065077	1345933717	/nfs/dbraw/zinc/93/37/17/1345933717.db2.gz	OJWUYFFJXAWTFP-MAUKXSAKSA-N	0	3	327.472	3.102	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3ccoc3C(F)(F)F)C[C@H]21	ZINC001042076070	1345938801	/nfs/dbraw/zinc/93/88/01/1345938801.db2.gz	QRAFYVHHYIJIFP-TZMCWYRMSA-N	0	3	342.361	3.411	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3c(C)noc3C(F)F)C[C@@H]21	ZINC001042100457	1345944202	/nfs/dbraw/zinc/94/42/02/1345944202.db2.gz	GGRVVGHRLGVBSA-OLZOCXBDSA-N	0	3	339.386	3.033	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3oc(C(F)F)cc3C)C[C@H]21	ZINC001042100207	1345944278	/nfs/dbraw/zinc/94/42/78/1345944278.db2.gz	LLCCSAVFCRPWFZ-UONOGXRCSA-N	0	3	336.382	3.085	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)C3(C)CCC(F)(F)CC3)C[C@@H]21	ZINC001042116296	1345948734	/nfs/dbraw/zinc/94/87/34/1345948734.db2.gz	BHDPWCXHYRNICR-HOTGVXAUSA-N	0	3	338.442	3.148	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(C)n(C(CC)CC)n3)C[C@@H]21	ZINC001042125446	1345950829	/nfs/dbraw/zinc/95/08/29/1345950829.db2.gz	UHBXSKMOPBAPPS-LPHOPBHVSA-N	0	3	344.503	3.275	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(C)cc(OC)c3C)C[C@H]21	ZINC001042132588	1345951791	/nfs/dbraw/zinc/95/17/91/1345951791.db2.gz	DVXKTCUTTBQKIB-SJLPKXTDSA-N	0	3	328.456	3.034	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3scnc3C)[C@H]2C1	ZINC001042187889	1345974456	/nfs/dbraw/zinc/97/44/56/1345974456.db2.gz	OVSDZOORVVDRHP-CABCVRRESA-N	0	3	333.501	3.087	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cncc4sccc43)C[C@H]21	ZINC001042205582	1345983656	/nfs/dbraw/zinc/98/36/56/1345983656.db2.gz	XUQLEHWFEBTCOQ-CZUORRHYSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(F)c(Cl)c3F)C[C@H]21	ZINC001042218852	1345990389	/nfs/dbraw/zinc/99/03/89/1345990389.db2.gz	MICMVMQJAKUXOS-SMDDNHRTSA-N	0	3	340.801	3.341	20	30		EGEDHN
CC1(C(=O)N2CC[C@H]3CCN(Cc4ccc(C#N)cc4)[C@H]3C2)CC=CC1	ZINC001042220832	1345992001	/nfs/dbraw/zinc/99/20/01/1345992001.db2.gz	GBLBIKWVMREHEY-UXHICEINSA-N	0	3	349.478	3.337	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(OCC)c(C)c3)C[C@H]21	ZINC001042252826	1346006227	/nfs/dbraw/zinc/00/62/27/1346006227.db2.gz	NTROJJFFWWXEIB-SJLPKXTDSA-N	0	3	328.456	3.116	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(OCC)c(C)c3)C[C@@H]21	ZINC001042252822	1346006309	/nfs/dbraw/zinc/00/63/09/1346006309.db2.gz	NTROJJFFWWXEIB-AEFFLSMTSA-N	0	3	328.456	3.116	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(Cl)c(OC)c3)C[C@@H]21	ZINC001042257763	1346008415	/nfs/dbraw/zinc/00/84/15/1346008415.db2.gz	LSGGWEORRNUSTO-BBRMVZONSA-N	0	3	334.847	3.071	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3oc(CC(C)C)nc3C)C[C@@H]21	ZINC001042261868	1346009619	/nfs/dbraw/zinc/00/96/19/1346009619.db2.gz	AQMIGBHXVDLQJZ-IRXDYDNUSA-N	0	3	345.487	3.294	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3scnc3C3CC3)C[C@@H]21	ZINC001042261893	1346009937	/nfs/dbraw/zinc/00/99/37/1346009937.db2.gz	AYHDKHYSOSXMJG-ZFWWWQNUSA-N	0	3	331.485	3.133	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3csc(C(C)(C)C)n3)C[C@@H]21	ZINC001042267336	1346012743	/nfs/dbraw/zinc/01/27/43/1346012743.db2.gz	SZMLBGOUIYUZKE-ZFWWWQNUSA-N	0	3	333.501	3.163	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccccc3OCC(C)C)C[C@H]21	ZINC001042271758	1346014204	/nfs/dbraw/zinc/01/42/04/1346014204.db2.gz	FWZRLZIXYBCLAJ-IEBWSBKVSA-N	0	3	342.483	3.444	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cnoc3-c3ccccc3)C[C@@H]21	ZINC001042297900	1346023154	/nfs/dbraw/zinc/02/31/54/1346023154.db2.gz	XEGAXYPFNXAXFM-YJBOKZPZSA-N	0	3	337.423	3.064	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(C(F)(F)F)cc3)C[C@H]21	ZINC001042327814	1346036704	/nfs/dbraw/zinc/03/67/04/1346036704.db2.gz	PDOULZPDNBJQNF-XJKSGUPXSA-N	0	3	338.373	3.428	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)Cc3c(F)cccc3Cl)C[C@H]21	ZINC001042331195	1346038776	/nfs/dbraw/zinc/03/87/76/1346038776.db2.gz	NYQPIRQYXRZFDW-CXAGYDPISA-N	0	3	336.838	3.130	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cc4ccccc4n3CC)C[C@H]21	ZINC001042367231	1346058806	/nfs/dbraw/zinc/05/88/06/1346058806.db2.gz	CURCQRMDNUUMSM-DYESRHJHSA-N	0	3	349.478	3.221	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3cc4cccc(C)c4o3)C[C@@H]21	ZINC001042370181	1346059901	/nfs/dbraw/zinc/05/99/01/1346059901.db2.gz	CHXPVXDZNKTLHJ-WMZOPIPTSA-N	0	3	336.435	3.301	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3coc(C4CCCCC4)n3)C[C@H]21	ZINC001042371280	1346061693	/nfs/dbraw/zinc/06/16/93/1346061693.db2.gz	NZWSTTXOGQCSFQ-MAUKXSAKSA-N	0	3	343.471	3.445	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3csc(C4CC4)n3)C[C@@H]21	ZINC001042375439	1346063600	/nfs/dbraw/zinc/06/36/00/1346063600.db2.gz	XHHCJBGXTZJEQK-CJNGLKHVSA-N	0	3	331.485	3.133	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2cc(F)ccc2C#N)CCN1C(=O)C1CC=CC1	ZINC001044524215	1346356548	/nfs/dbraw/zinc/35/65/48/1346356548.db2.gz	SUQXQXUDCWLLCO-KUHUBIRLSA-N	0	3	341.430	3.133	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)CC1CCC1	ZINC001044533945	1346360703	/nfs/dbraw/zinc/36/07/03/1346360703.db2.gz	YBHLNAPECHOFKI-BEFAXECRSA-N	0	3	325.456	3.218	20	30		EGEDHN
Cc1cccnc1C(=O)N1CC[C@@H](NCc2ccccc2C#N)C[C@@H]1C	ZINC001044540001	1346363682	/nfs/dbraw/zinc/36/36/82/1346363682.db2.gz	QUZITNPFNLAPCW-QFBILLFUSA-N	0	3	348.450	3.045	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2cc(F)ccc2C#N)CCN1C(=O)C=C1CCC1	ZINC001044540883	1346363892	/nfs/dbraw/zinc/36/38/92/1346363892.db2.gz	WVVIOHWERFSZGW-KUHUBIRLSA-N	0	3	341.430	3.277	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)C1CC(C)(C)C1	ZINC001044581049	1346374236	/nfs/dbraw/zinc/37/42/36/1346374236.db2.gz	HYRFIOUEHGJGPE-DNVCBOLYSA-N	0	3	339.483	3.464	20	30		EGEDHN
Cc1coc(C(=O)N2CC[C@H](NCc3ccccc3C#N)C[C@@H]2C)c1	ZINC001044717027	1346409819	/nfs/dbraw/zinc/40/98/19/1346409819.db2.gz	QFPZYEKEYZHSKE-YJBOKZPZSA-N	0	3	337.423	3.243	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)C2CCCCC2)s1	ZINC001044903895	1346459101	/nfs/dbraw/zinc/45/91/01/1346459101.db2.gz	DDVSNOILXNJJRD-HNNXBMFYSA-N	0	3	331.485	3.281	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)c2cccs2)c(F)c1	ZINC001044908318	1346460360	/nfs/dbraw/zinc/46/03/60/1346460360.db2.gz	MVVQDPTUSCYVGO-HNNXBMFYSA-N	0	3	343.427	3.153	20	30		EGEDHN
CCc1ccc(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)s2)o1	ZINC001045095269	1346494572	/nfs/dbraw/zinc/49/45/72/1346494572.db2.gz	HTBQGPGDJGFQNN-ZDUSSCGKSA-N	0	3	343.452	3.170	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)C[C@H]2CC=CCC2)s1	ZINC001045155371	1346507799	/nfs/dbraw/zinc/50/77/99/1346507799.db2.gz	RSJQLCFACZQALX-HOTGVXAUSA-N	0	3	343.496	3.447	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)cc2F)CCC1	ZINC001045161179	1346510840	/nfs/dbraw/zinc/51/08/40/1346510840.db2.gz	CECZFNUQIMZYOI-KRWDZBQOSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]2CNCc2cnc(Cl)s2)C1	ZINC001045191256	1346525137	/nfs/dbraw/zinc/52/51/37/1346525137.db2.gz	SYMHMGPSBAQOFH-LBPRGKRZSA-N	0	3	339.892	3.233	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)c2ccc(F)s2)s1	ZINC001045329164	1346563672	/nfs/dbraw/zinc/56/36/72/1346563672.db2.gz	ZTPZJWGZXPFLCY-NSHDSACASA-N	0	3	349.456	3.215	20	30		EGEDHN
C[C@H]1CC[C@@H](C(=O)NC2(C)CCN(Cc3cccc(C#N)c3)CC2)C1	ZINC001045577250	1346634778	/nfs/dbraw/zinc/63/47/78/1346634778.db2.gz	LSBPFVFLNSTOGN-QFBILLFUSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2ccc(OCC)c(C)c2)CC1	ZINC001045577404	1346634790	/nfs/dbraw/zinc/63/47/90/1346634790.db2.gz	QPWKXSYIPXRGOI-UHFFFAOYSA-N	0	3	328.456	3.001	20	30		EGEDHN
CC[C@@]1(C)C[C@@H]1C(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1	ZINC001045604850	1346642795	/nfs/dbraw/zinc/64/27/95/1346642795.db2.gz	AYOHLIHYSCSFHD-QUCCMNQESA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2cc(C)n(C(C)C)c2C)CC1	ZINC001045636246	1346654716	/nfs/dbraw/zinc/65/47/16/1346654716.db2.gz	MDXBZYSHSMIYDX-UHFFFAOYSA-N	0	3	329.488	3.293	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2ccc(N(C)C(C)C)cc2)CC1	ZINC001045651954	1346660389	/nfs/dbraw/zinc/66/03/89/1346660389.db2.gz	LIJOGLXFSDQIGU-UHFFFAOYSA-N	0	3	341.499	3.139	20	30		EGEDHN
C/C(=C/C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1ccc(C#N)cc1)C1CC1	ZINC001045726998	1346680847	/nfs/dbraw/zinc/68/08/47/1346680847.db2.gz	VAGIEKDQXAVJQC-HEUNSUFQSA-N	0	3	349.478	3.480	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1cc2ccccc2o1	ZINC001045735352	1346683165	/nfs/dbraw/zinc/68/31/65/1346683165.db2.gz	NGRDEYIRNGONHN-OIISXLGYSA-N	0	3	337.423	3.158	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc(F)ccc1F)C2	ZINC001045943361	1346779584	/nfs/dbraw/zinc/77/95/84/1346779584.db2.gz	IMPNFCYSJAKCCY-FQEVSTJZSA-N	0	3	346.421	3.306	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc(Cl)ccc1F)C2	ZINC001045950629	1346785515	/nfs/dbraw/zinc/78/55/15/1346785515.db2.gz	HXGANWPICMAHNE-IBGZPJMESA-N	0	3	348.849	3.431	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)CCc1ccc(F)cc1)C2	ZINC001045950867	1346785964	/nfs/dbraw/zinc/78/59/64/1346785964.db2.gz	NMRRGSQFGHUMRF-NRFANRHFSA-N	0	3	342.458	3.096	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc3ccsc3[nH]1)C2	ZINC001045958305	1346793301	/nfs/dbraw/zinc/79/33/01/1346793301.db2.gz	PDTURWVILUCISU-LJQANCHMSA-N	0	3	341.480	3.181	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1occc1C(C)C)C2	ZINC001045961123	1346796594	/nfs/dbraw/zinc/79/65/94/1346796594.db2.gz	HBMXZLYHLACVOF-HXUWFJFHSA-N	0	3	328.456	3.354	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc[nH]c1C(C)C)C2	ZINC001045961833	1346797140	/nfs/dbraw/zinc/79/71/40/1346797140.db2.gz	UBBURJDZQKWVFV-NRFANRHFSA-N	0	3	341.499	3.480	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc3[nH]ccc3c1)C2	ZINC001045962247	1346797706	/nfs/dbraw/zinc/79/77/06/1346797706.db2.gz	FSLKEIYNCAWYCE-NRFANRHFSA-N	0	3	335.451	3.119	20	30		EGEDHN
C=C1CCC(C(=O)N2CCCC[C@@]3(CCN(CC#CC)C3)C2)CC1	ZINC001045963063	1346798365	/nfs/dbraw/zinc/79/83/65/1346798365.db2.gz	WMFXTPXBZIVZAG-NRFANRHFSA-N	0	3	328.500	3.461	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H](C)C(C)(F)F)C2	ZINC001045967643	1346801956	/nfs/dbraw/zinc/80/19/56/1346801956.db2.gz	ZCDKYEGCEFCAHH-CRAIPNDOSA-N	0	3	326.431	3.006	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1nc(C)c(C)s1)C2	ZINC001045982561	1346821788	/nfs/dbraw/zinc/82/17/88/1346821788.db2.gz	CTYJMVBUBWTYJS-IBGZPJMESA-N	0	3	345.512	3.101	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc(CF)cc1)C2	ZINC001045986692	1346828220	/nfs/dbraw/zinc/82/82/20/1346828220.db2.gz	YJTFRDGSDLMKCF-OAQYLSRUSA-N	0	3	342.458	3.498	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)[C@@H]2C[C@H]2c2ccc(N(C)C)cc2)C1	ZINC001046507578	1346998635	/nfs/dbraw/zinc/99/86/35/1346998635.db2.gz	LZEXQCYBAXRPDE-QKNQBKEWSA-N	0	3	341.499	3.013	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2ccc(N(CC)CC)cc2)C1	ZINC001046796083	1347107480	/nfs/dbraw/zinc/10/74/80/1347107480.db2.gz	ANGUWVPYCRBTLJ-FQEVSTJZSA-N	0	3	329.488	3.303	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2ccc(OCC(C)C)cc2)C1	ZINC001046819461	1347118579	/nfs/dbraw/zinc/11/85/79/1347118579.db2.gz	XQHYYDDBMODQRC-FQEVSTJZSA-N	0	3	330.472	3.492	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2cccc(OCC(C)C)c2)C1	ZINC001046822742	1347119752	/nfs/dbraw/zinc/11/97/52/1347119752.db2.gz	UUWHJZLAGZQTSP-FQEVSTJZSA-N	0	3	330.472	3.492	20	30		EGEDHN
C#CCCN1CC[C@@](C)(NC(=O)c2cc(CC)c(CCC)s2)C1	ZINC001046830246	1347122047	/nfs/dbraw/zinc/12/20/47/1347122047.db2.gz	RFNTUKPCZWITDO-LJQANCHMSA-N	0	3	332.513	3.481	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2c(C)oc(C)c2C)C1	ZINC001046955515	1347164477	/nfs/dbraw/zinc/16/44/77/1347164477.db2.gz	BVQSHOXFYDPLDB-HNNXBMFYSA-N	0	3	340.414	3.468	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2cc(C(C)C)on2)C1	ZINC001046963009	1347167504	/nfs/dbraw/zinc/16/75/04/1347167504.db2.gz	QJDNTQNGOIMTSB-ZDUSSCGKSA-N	0	3	341.402	3.061	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)N(Cc2cc(C)no2)C3)CC1	ZINC001047139053	1347217358	/nfs/dbraw/zinc/21/73/58/1347217358.db2.gz	KNZTXTRXBRYZMO-JQHSSLGASA-N	0	3	343.471	3.199	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3ccc(C)s3)C2)CC1	ZINC001047219678	1347251504	/nfs/dbraw/zinc/25/15/04/1347251504.db2.gz	PKMUPPFLNUSQAR-QGZVFWFLSA-N	0	3	330.497	3.254	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)c3c(C)coc3C)C2)CC1	ZINC001047238468	1347265482	/nfs/dbraw/zinc/26/54/82/1347265482.db2.gz	AHKUMIMFUKXQHD-IBGZPJMESA-N	0	3	342.483	3.484	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3cccc(F)c3C)C2)CC1	ZINC001047240829	1347267233	/nfs/dbraw/zinc/26/72/33/1347267233.db2.gz	IEUXUCNBMKZDPK-GOSISDBHSA-N	0	3	342.458	3.332	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3ccc(CC)o3)C2)CC1	ZINC001047246696	1347271549	/nfs/dbraw/zinc/27/15/49/1347271549.db2.gz	VRFNNHNXUPVGMV-KRWDZBQOSA-N	0	3	328.456	3.039	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3cc(F)ccc3C)C2)CC1	ZINC001047247518	1347273052	/nfs/dbraw/zinc/27/30/52/1347273052.db2.gz	JNBSXHHNUJNPDH-SFHVURJKSA-N	0	3	342.458	3.332	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3cc[nH]c3CCC)C2)CC1	ZINC001047248930	1347273662	/nfs/dbraw/zinc/27/36/62/1347273662.db2.gz	PSONBJZCWWXNDX-GOSISDBHSA-N	0	3	341.499	3.165	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)[C@]3(C)C=CCC3)C2)CC1	ZINC001047251131	1347276216	/nfs/dbraw/zinc/27/62/16/1347276216.db2.gz	GDCOFPDPXSSSDS-TZIWHRDSSA-N	0	3	328.500	3.317	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)[C@@H]3C[C@H]3C3CC3)C2)CC1	ZINC001047257097	1347280335	/nfs/dbraw/zinc/28/03/35/1347280335.db2.gz	GGOGZDRYRMEMPO-HSALFYBXSA-N	0	3	328.500	3.006	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3cc4ccccn4c3)C2)CC1	ZINC001047258367	1347281063	/nfs/dbraw/zinc/28/10/63/1347281063.db2.gz	BDBHQSNONVGKSY-IBGZPJMESA-N	0	3	349.478	3.137	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)c3cccn3CC)C2)CC1	ZINC001047265834	1347286757	/nfs/dbraw/zinc/28/67/57/1347286757.db2.gz	XKCWZPRXAJUMAG-LJQANCHMSA-N	0	3	341.499	3.096	20	30		EGEDHN
Cc1occc1C(=O)N1CC[C@@H]([C@H](C)NCc2ccccc2C#N)C1	ZINC001047706275	1347342439	/nfs/dbraw/zinc/34/24/39/1347342439.db2.gz	TXAAIAIUTITLBH-KBXCAEBGSA-N	0	3	337.423	3.100	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H]([C@H](C)NCc2cscn2)C1	ZINC001047855872	1347390761	/nfs/dbraw/zinc/39/07/61/1347390761.db2.gz	ONNWTFWBPVEXIE-WCQYABFASA-N	0	3	341.908	3.248	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]([C@H](C)NCc2ccn(C(C)C)n2)C1	ZINC001047924860	1347411596	/nfs/dbraw/zinc/41/15/96/1347411596.db2.gz	QZIRSZQTKWEDSG-IRXDYDNUSA-N	0	3	346.519	3.393	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]([C@@H](C)NCc3csc(CC)n3)C2)C1	ZINC001047965107	1347426762	/nfs/dbraw/zinc/42/67/62/1347426762.db2.gz	JEEMUEGEXMEMDP-HUUCEWRRSA-N	0	3	347.528	3.388	20	30		EGEDHN
C[C@H]1CN(C(=O)c2ccsc2)C[C@H]1CNCc1ccccc1C#N	ZINC001048121824	1347474212	/nfs/dbraw/zinc/47/42/12/1347474212.db2.gz	GLWQRZRNWLJSQO-KBXCAEBGSA-N	0	3	339.464	3.118	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H](C)[C@H](CNCc2nc(C)c(C)s2)C1	ZINC001048341194	1347523676	/nfs/dbraw/zinc/52/36/76/1347523676.db2.gz	YSPPWLRDSGDIKX-SWLSCSKDSA-N	0	3	335.517	3.156	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H](C)[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001048345467	1347525321	/nfs/dbraw/zinc/52/53/21/1347525321.db2.gz	UEGXMBFMHWHIIJ-WMLDXEAASA-N	0	3	343.446	3.094	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)[C@H]2C[C@@H]2C(C)C)CC1	ZINC001048628730	1347624720	/nfs/dbraw/zinc/62/47/20/1347624720.db2.gz	GQCZSORMBYLARE-UXHICEINSA-N	0	3	341.499	3.353	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)[C@@H]2C[C@@]2(C)CC)CC1	ZINC001048629181	1347625393	/nfs/dbraw/zinc/62/53/93/1347625393.db2.gz	SALSBXPVRJXAPM-PZJWPPBQSA-N	0	3	341.499	3.497	20	30		EGEDHN
C[C@]1(C(=O)N2C[C@H]3CN(Cc4cccc(C#N)c4)C[C@H]3C2)CC=CCC1	ZINC001048839185	1347669700	/nfs/dbraw/zinc/66/97/00/1347669700.db2.gz	ZMJJRNFPMJURDI-VWPQPMDRSA-N	0	3	349.478	3.195	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2C[C@H]3CN(C/C=C/Cl)C[C@H]3C2)cc1	ZINC001048899117	1347680065	/nfs/dbraw/zinc/68/00/65/1347680065.db2.gz	JNZVOOSSUGTZKT-FZMSVCIDSA-N	0	3	346.858	3.008	20	30		EGEDHN
C#Cc1ccc(C(=O)N2C[C@H]3CN(Cc4ccc(F)cc4)C[C@H]3C2)cc1	ZINC001048973529	1347695406	/nfs/dbraw/zinc/69/54/06/1347695406.db2.gz	NXPKATUBKAZEBV-BGYRXZFFSA-N	0	3	348.421	3.011	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CN(Cc3c(C)noc3CC)C[C@H]2C1	ZINC001049034937	1347711726	/nfs/dbraw/zinc/71/17/26/1347711726.db2.gz	IYMIGRKDHLUJPS-YRNRMSPPSA-N	0	3	345.487	3.038	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc(Cl)ccc3Cl)C[C@@H]2C1	ZINC001049187014	1347742212	/nfs/dbraw/zinc/74/22/12/1347742212.db2.gz	PMLDODZLWGKKDB-BETUJISGSA-N	0	3	337.250	3.021	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)CCC2CC2)cc1	ZINC001049386033	1347814243	/nfs/dbraw/zinc/81/42/43/1347814243.db2.gz	JVEZTZAXLLPKTK-VQTJNVASSA-N	0	3	337.467	3.314	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@@H]2[C@@H]1CCN2C/C=C/c1ccccc1	ZINC001049469986	1347864801	/nfs/dbraw/zinc/86/48/01/1347864801.db2.gz	FPHJPARYGPQPHQ-SZRKRVTOSA-N	0	3	334.463	3.179	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cccc2c1CCCC2	ZINC001049496765	1347877512	/nfs/dbraw/zinc/87/75/12/1347877512.db2.gz	CXDQHWYJLWXSTH-SFTDATJTSA-N	0	3	336.479	3.268	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc2cnccc2o1	ZINC001049572716	1347915738	/nfs/dbraw/zinc/91/57/38/1347915738.db2.gz	NFRNCLZMCKASIA-HOTGVXAUSA-N	0	3	325.412	3.083	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1cccnc1C(F)F	ZINC001049581852	1347921057	/nfs/dbraw/zinc/92/10/57/1347921057.db2.gz	AGQVJGWZCGYFEF-CABCVRRESA-N	0	3	335.398	3.274	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H]1CCCN2C(=O)CCc1cc2ccccc2o1	ZINC001049584452	1347922888	/nfs/dbraw/zinc/92/28/88/1347922888.db2.gz	RWFBBXICOBMMGS-MOPGFXCFSA-N	0	3	336.435	3.064	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(C(C)(C)C)on1	ZINC001049590011	1347925364	/nfs/dbraw/zinc/92/53/64/1347925364.db2.gz	WLHUSOIUOALCGP-JKSUJKDBSA-N	0	3	331.460	3.227	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1ccc(C(F)F)cc1	ZINC001049591165	1347925840	/nfs/dbraw/zinc/92/58/40/1347925840.db2.gz	DSCKWKSMPKPGHM-ZWKOTPCHSA-N	0	3	346.421	3.255	20	30		EGEDHN
CC1(CC(=O)N2CCC[C@@H]3[C@H]2CCN3Cc2ccc(C#N)cc2)CC1	ZINC001049602137	1347931713	/nfs/dbraw/zinc/93/17/13/1347931713.db2.gz	LCYSFTMHGWUWPR-RTBURBONSA-N	0	3	337.467	3.314	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1c(C)ccnc1OCC	ZINC001049616646	1347936129	/nfs/dbraw/zinc/93/61/29/1347936129.db2.gz	YOYFHXGJWHLBTA-IRXDYDNUSA-N	0	3	343.471	3.044	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(C)nc1C(C)C	ZINC001049621805	1347939077	/nfs/dbraw/zinc/93/90/77/1347939077.db2.gz	OSMWUCTWEPOUCX-ZWKOTPCHSA-N	0	3	327.472	3.378	20	30		EGEDHN
CC1(C(=O)N2CCC[C@H]3[C@H]2CCN3Cc2cccc(C#N)c2)CCC1	ZINC001049646593	1347953358	/nfs/dbraw/zinc/95/33/58/1347953358.db2.gz	PDGVCDZLYMNDDW-RBUKOAKNSA-N	0	3	337.467	3.314	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1c[nH]c2c1cccc2C	ZINC001049763073	1348007928	/nfs/dbraw/zinc/00/79/28/1348007928.db2.gz	UCSLHGDALRWXPG-VQTJNVASSA-N	0	3	349.478	3.107	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1oc(CC(C)C)nc1C	ZINC001049774880	1348015380	/nfs/dbraw/zinc/01/53/80/1348015380.db2.gz	YOCRYRVXPBCSGA-DLBZAZTESA-N	0	3	345.487	3.437	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](CC)Oc1cccc(C)c1	ZINC001049779153	1348017896	/nfs/dbraw/zinc/01/78/96/1348017896.db2.gz	SFHJBFSHRPWCAC-ZCNNSNEGSA-N	0	3	342.483	3.404	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cccc(N2CCCC2)c1	ZINC001049805651	1348028262	/nfs/dbraw/zinc/02/82/62/1348028262.db2.gz	KRHJXPQALJLKAK-WOJBJXKFSA-N	0	3	339.483	3.152	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cccc(F)c1OCC	ZINC001049814906	1348033989	/nfs/dbraw/zinc/03/39/89/1348033989.db2.gz	PGGVGDRHACWPBO-IAGOWNOFSA-N	0	3	332.419	3.089	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1csc(Cl)n1	ZINC001049823443	1348040074	/nfs/dbraw/zinc/04/00/74/1348040074.db2.gz	BMDJVSVCFZYWKB-QWHCGFSZSA-N	0	3	325.865	3.052	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1occ2c1CCCC2	ZINC001049863902	1348070604	/nfs/dbraw/zinc/07/06/04/1348070604.db2.gz	PQAOLFVOKZKSII-QZTJIDSGSA-N	0	3	328.456	3.413	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1coc2ccc(F)cc12	ZINC001049867999	1348073813	/nfs/dbraw/zinc/07/38/13/1348073813.db2.gz	QKPTXVOSROCJMD-IRXDYDNUSA-N	0	3	328.387	3.437	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C(C)(C)c1ccc(OC)cc1	ZINC001049902982	1348102727	/nfs/dbraw/zinc/10/27/27/1348102727.db2.gz	DBKVIILYVYNKOX-RBUKOAKNSA-N	0	3	342.483	3.224	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1cccc(F)c1F	ZINC001049906910	1348104767	/nfs/dbraw/zinc/10/47/67/1348104767.db2.gz	GUXMQEXCUMERAH-BURFUSLBSA-N	0	3	346.421	3.320	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1c[nH]c2ccc(C)cc12	ZINC001049919142	1348112280	/nfs/dbraw/zinc/11/22/80/1348112280.db2.gz	ULNDHBUSYYZWLS-UXHICEINSA-N	0	3	335.451	3.179	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3CCCN(C(=O)C[C@H]4C=CCC4)[C@@H]3C2)cc1	ZINC001049965358	1348136691	/nfs/dbraw/zinc/13/66/91/1348136691.db2.gz	LSKPVHHHGYWZMB-DZFGPLHGSA-N	0	3	349.478	3.337	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3ocnc3-c3ccccc3)[C@@H]2C1	ZINC001050061962	1348170333	/nfs/dbraw/zinc/17/03/33/1348170333.db2.gz	GYZSCGHDHMGGIE-DLBZAZTESA-N	0	3	337.423	3.064	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)c3cccc4ccc(C)nc43)[C@@H]2C1	ZINC001050073634	1348173000	/nfs/dbraw/zinc/17/30/00/1348173000.db2.gz	IPAFAIMBDDFLAF-AZUAARDMSA-N	0	3	347.462	3.103	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cn(CC)c4ccccc34)[C@@H]2C1	ZINC001050088874	1348178548	/nfs/dbraw/zinc/17/85/48/1348178548.db2.gz	QEUZXFOXOAUZCX-OXJNMPFZSA-N	0	3	337.467	3.384	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3nsc4ccc(C)cc43)[C@@H]2C1	ZINC001050110691	1348186152	/nfs/dbraw/zinc/18/61/52/1348186152.db2.gz	WIORTLYGKCENOL-GOEBONIOSA-N	0	3	341.480	3.327	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)[C@H](C)c3ccc(CC)cc3)[C@@H]2C1	ZINC001050164883	1348201601	/nfs/dbraw/zinc/20/16/01/1348201601.db2.gz	NODZJKWYRMWQGQ-JRGCBEDISA-N	0	3	338.495	3.299	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC2(C1)CCN(Cc1cccnc1)CC2	ZINC001050532939	1348285055	/nfs/dbraw/zinc/28/50/55/1348285055.db2.gz	DTIAHUSPSKHUKD-UHFFFAOYSA-N	0	3	347.890	3.285	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cc(C)c4ccccc4n3)C2)CC1	ZINC001050563182	1348290522	/nfs/dbraw/zinc/29/05/22/1348290522.db2.gz	HVXXXRFOCCZZMS-UHFFFAOYSA-N	0	3	347.462	3.105	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1ccccn1)CC2	ZINC001050645516	1348313882	/nfs/dbraw/zinc/31/38/82/1348313882.db2.gz	OVORPLUKFQXCFE-LJQANCHMSA-N	0	3	327.472	3.108	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC3(C2)CCN(Cc2c(C)noc2C)CC3)C1	ZINC001050656471	1348319570	/nfs/dbraw/zinc/31/95/70/1348319570.db2.gz	FVVOVKNGLLDLJN-UHFFFAOYSA-N	0	3	343.471	3.072	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cc(C)c(CC)s3)C2)CC1	ZINC001050747645	1348347846	/nfs/dbraw/zinc/34/78/46/1348347846.db2.gz	UEOJRCGAWNKXSW-UHFFFAOYSA-N	0	3	330.497	3.180	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3cccc(C)c3)cccc2C1	ZINC001051274909	1348413498	/nfs/dbraw/zinc/41/34/98/1348413498.db2.gz	NCKIPEQYYOJJFC-UHFFFAOYSA-N	0	3	332.447	3.306	20	30		EGEDHN
CC(C)=CCN1CCc2c(CNC(=O)c3c[nH]c(C#N)c3)cccc2C1	ZINC001051285270	1348418638	/nfs/dbraw/zinc/41/86/38/1348418638.db2.gz	FRULLZGFJOGEJP-UHFFFAOYSA-N	0	3	348.450	3.141	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)[C@@H]3Cc4ccccc43)cccc2C1	ZINC001051300640	1348425263	/nfs/dbraw/zinc/42/52/63/1348425263.db2.gz	XXDWKXLWVPHFPV-JOCHJYFZSA-N	0	3	344.458	3.024	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)[C@@H]3C[C@@]3(C)C(C)C)cccc2C1	ZINC001051306261	1348427604	/nfs/dbraw/zinc/42/76/04/1348427604.db2.gz	QFLAGKYURGQVKL-UNMCSNQZSA-N	0	3	338.495	3.366	20	30		EGEDHN
C=CCCN1CCN([C@H]2CCN(C(=O)CCC3CCCCC3)C2)CC1	ZINC001052113341	1348503515	/nfs/dbraw/zinc/50/35/15/1348503515.db2.gz	SEOZHSRKZKHCKX-FQEVSTJZSA-N	0	3	347.547	3.142	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N[C@@H]1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC001052314418	1348519500	/nfs/dbraw/zinc/51/95/00/1348519500.db2.gz	JVYBWQPAUJAQTN-QZTJIDSGSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cccc(C(F)F)c2F)CC1	ZINC001052387058	1348538131	/nfs/dbraw/zinc/53/81/31/1348538131.db2.gz	WJUVMCPQQVWNET-CYBMUJFWSA-N	0	3	338.373	3.371	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cc(C(F)F)ccc2F)CC1	ZINC001052387229	1348538548	/nfs/dbraw/zinc/53/85/48/1348538548.db2.gz	FJLODVUFEPYMOR-CQSZACIVSA-N	0	3	338.373	3.371	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2[nH]c3ccccc3c2Cl)CC1	ZINC001052524539	1348565794	/nfs/dbraw/zinc/56/57/94/1348565794.db2.gz	CQNPHBYGCZDVPW-CQSZACIVSA-N	0	3	343.858	3.429	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)Cc2cccc(C(C)C)c2)CC1	ZINC001052527059	1348566571	/nfs/dbraw/zinc/56/65/71/1348566571.db2.gz	QFCOCUOKZWPXRG-FQEVSTJZSA-N	0	3	326.484	3.347	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)Cc2ccc(C(F)F)cc2)CC1	ZINC001052554544	1348577517	/nfs/dbraw/zinc/57/75/17/1348577517.db2.gz	LNUUKXYVIJBEET-KRWDZBQOSA-N	0	3	334.410	3.161	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2cc(C3CC3)oc2C2CC2)CC1	ZINC001052577321	1348584746	/nfs/dbraw/zinc/58/47/46/1348584746.db2.gz	BHLJFANWHOHQJM-MRXNPFEDSA-N	0	3	326.440	3.252	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2oc3ccccc3c2OC)CC1	ZINC001052620180	1348598101	/nfs/dbraw/zinc/59/81/01/1348598101.db2.gz	NKEHGTRAURDDQF-HNNXBMFYSA-N	0	3	340.423	3.049	20	30		EGEDHN
Cc1cocc1C(=O)N[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC001052628700	1348601676	/nfs/dbraw/zinc/60/16/76/1348601676.db2.gz	FLHZRQWYIJQMPP-GOSISDBHSA-N	0	3	337.423	3.244	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCCN(Cc3ocnc3C)CC2)CC1	ZINC001052682226	1348629461	/nfs/dbraw/zinc/62/94/61/1348629461.db2.gz	RORCTTNOOBFMFJ-KRWDZBQOSA-N	0	3	331.460	3.200	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCCN(Cc3cnc(C)s3)CC2)C1	ZINC001052689724	1348633812	/nfs/dbraw/zinc/63/38/12/1348633812.db2.gz	IZWVZKPDDUULTD-HNNXBMFYSA-N	0	3	333.501	3.279	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCN(Cc3ncccc3C)CC2)C1	ZINC001052690790	1348634383	/nfs/dbraw/zinc/63/43/83/1348634383.db2.gz	POZZCPAHSKWYML-QGZVFWFLSA-N	0	3	327.472	3.217	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)Cc2ccc(F)c(Cl)c2)CC1	ZINC001052742334	1348656615	/nfs/dbraw/zinc/65/66/15/1348656615.db2.gz	IPSHZOXBRGOPBI-OAHLLOKOSA-N	0	3	336.838	3.016	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cccn2C2CCCC2)CC1	ZINC001052825709	1348691402	/nfs/dbraw/zinc/69/14/02/1348691402.db2.gz	FPINQDXOKFDRLC-KRWDZBQOSA-N	0	3	327.472	3.211	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2[nH]ccc2-c2ccccc2)CC1	ZINC001052862101	1348706610	/nfs/dbraw/zinc/70/66/10/1348706610.db2.gz	GUSSZZMTHRNXOD-SFHVURJKSA-N	0	3	335.451	3.289	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccccc2OC(C)C)CC1	ZINC001052879605	1348716912	/nfs/dbraw/zinc/71/69/12/1348716912.db2.gz	BFRYDEPSDDTYJV-KRWDZBQOSA-N	0	3	328.456	3.081	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc(OC(C)C)cc2)CC1	ZINC001052913775	1348745650	/nfs/dbraw/zinc/74/56/50/1348745650.db2.gz	MNVFIVDXVVHTQR-GOSISDBHSA-N	0	3	328.456	3.081	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2c[nH]cc2-c2ccccc2)CC1	ZINC001052934440	1348755210	/nfs/dbraw/zinc/75/52/10/1348755210.db2.gz	KFOOGAOPBSJUQJ-GOSISDBHSA-N	0	3	335.451	3.289	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@]2(C)CCc3ccccc3C2)CC1	ZINC001052983340	1348787967	/nfs/dbraw/zinc/78/79/67/1348787967.db2.gz	JNHNPTOMSLLVKM-RBBKRZOGSA-N	0	3	338.495	3.176	20	30		EGEDHN
CC(=O)N1CCC[C@H]([C@H]2CCCN(Cc3ccc(C#N)s3)C2)C1	ZINC001052997092	1348794304	/nfs/dbraw/zinc/79/43/04/1348794304.db2.gz	ORFQTLVCOHXAID-HOTGVXAUSA-N	0	3	331.485	3.090	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC[C@@H]([C@@H]3CCCN(CCF)C3)C2)cc1	ZINC001053036194	1348835930	/nfs/dbraw/zinc/83/59/30/1348835930.db2.gz	IMHVJEZQSDWHBD-WOJBJXKFSA-N	0	3	342.458	3.202	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)Cc2cccs2)C1	ZINC001053060119	1348869488	/nfs/dbraw/zinc/86/94/88/1348869488.db2.gz	CZCYNORIDHSICE-HKUYNNGSSA-N	0	3	344.524	3.407	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cccc(F)c2)C1	ZINC001053062842	1348873689	/nfs/dbraw/zinc/87/36/89/1348873689.db2.gz	CXVXYIBHZHWANC-MJGOQNOKSA-N	0	3	328.431	3.166	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccoc2C)C1	ZINC001053065056	1348877886	/nfs/dbraw/zinc/87/78/86/1348877886.db2.gz	BOUZLZZDTAEPLR-MJGOQNOKSA-N	0	3	328.456	3.318	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cc(C)oc2C)C1	ZINC001053067419	1348880500	/nfs/dbraw/zinc/88/05/00/1348880500.db2.gz	RCPRARORQFNJDN-PKOBYXMFSA-N	0	3	328.456	3.236	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)CCc2ccco2)C1	ZINC001053067784	1348881685	/nfs/dbraw/zinc/88/16/85/1348881685.db2.gz	JEHTVOWXDBGZIF-QUCCMNQESA-N	0	3	342.483	3.329	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(C)o2)C1	ZINC001053068760	1348882370	/nfs/dbraw/zinc/88/23/70/1348882370.db2.gz	WABDJFXMUIQFCJ-MSOLQXFVSA-N	0	3	328.456	3.318	20	30		EGEDHN
C#CCC[N@H+]1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001053068854	1348882629	/nfs/dbraw/zinc/88/26/29/1348882629.db2.gz	WPGWXARDWZOXDE-HKUYNNGSSA-N	0	3	340.467	3.122	20	30		EGEDHN
C#CCC[N@@H+]1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001053068854	1348882634	/nfs/dbraw/zinc/88/26/34/1348882634.db2.gz	WPGWXARDWZOXDE-HKUYNNGSSA-N	0	3	340.467	3.122	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)COC2CCCCC2)C1	ZINC001053086916	1348909521	/nfs/dbraw/zinc/90/95/21/1348909521.db2.gz	GQLBGSARHZRLBY-ICSRJNTNSA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(C)c(F)c2)C1	ZINC001053089518	1348915630	/nfs/dbraw/zinc/91/56/30/1348915630.db2.gz	BKCNFJVLOPPXGL-QUCCMNQESA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cc(OC)cs2)C1	ZINC001053092420	1348918908	/nfs/dbraw/zinc/91/89/08/1348918908.db2.gz	GXOKQSHBPWALCC-NVXWUHKLSA-N	0	3	346.496	3.097	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2occc2Cl)C1	ZINC001053096912	1348926531	/nfs/dbraw/zinc/92/65/31/1348926531.db2.gz	BFABDFPRSMDYOO-GDBMZVCRSA-N	0	3	334.847	3.273	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cc(C)[nH]c2C)C1	ZINC001053098089	1348929014	/nfs/dbraw/zinc/92/90/14/1348929014.db2.gz	KBMMSRDGAYWHHX-AZUAARDMSA-N	0	3	341.499	3.362	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2csc(C)c2)C1	ZINC001053100305	1348933343	/nfs/dbraw/zinc/93/33/43/1348933343.db2.gz	GLSWQYGPVKOICW-SJLPKXTDSA-N	0	3	330.497	3.396	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cncc(Cl)c2)C1	ZINC001053100829	1348934669	/nfs/dbraw/zinc/93/46/69/1348934669.db2.gz	JKDWVWUGPZOSNM-QAPCUYQASA-N	0	3	345.874	3.075	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2oc(CC)cc2C)C1	ZINC001053105021	1348941538	/nfs/dbraw/zinc/94/15/38/1348941538.db2.gz	LAESVYDQNDYKFS-PKOBYXMFSA-N	0	3	342.483	3.490	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(C)nc2C)C1	ZINC001053106009	1348943310	/nfs/dbraw/zinc/94/33/10/1348943310.db2.gz	RLCRADFFUKEAGN-QUCCMNQESA-N	0	3	339.483	3.038	20	30		EGEDHN
C=CCCN1Cc2ccccc2C[C@@H]1CNC(=O)C1C=CC=CC=C1	ZINC001054041435	1349136675	/nfs/dbraw/zinc/13/66/75/1349136675.db2.gz	KAOCSOXVQVHHTC-OAQYLSRUSA-N	0	3	334.463	3.404	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001054111492	1349150407	/nfs/dbraw/zinc/15/04/07/1349150407.db2.gz	XNOGYQXPAASFFF-PKJWAPKXSA-N	0	3	337.467	3.339	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc3c(o1)CCCC3)C2	ZINC001054143686	1349153972	/nfs/dbraw/zinc/15/39/72/1349153972.db2.gz	HVECNOPXWIQOCQ-OAQYLSRUSA-N	0	3	340.467	3.110	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)C1(C)CCC(F)(F)CC1)C2	ZINC001054154313	1349158140	/nfs/dbraw/zinc/15/81/40/1349158140.db2.gz	CKJPABOEIQHZAI-GOSISDBHSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)Cc1cccc(C)c1Cl)C2	ZINC001054163624	1349165593	/nfs/dbraw/zinc/16/55/93/1349165593.db2.gz	NFIYTFNOXOOOGU-HXUWFJFHSA-N	0	3	344.886	3.139	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1csc3ccccc13)C2	ZINC001054172245	1349173272	/nfs/dbraw/zinc/17/32/72/1349173272.db2.gz	JTJVWUJJYXNFQO-FQEVSTJZSA-N	0	3	338.476	3.463	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@]2(CCN(Cc3cccnc3C)C2)C1	ZINC001054175746	1349177165	/nfs/dbraw/zinc/17/71/65/1349177165.db2.gz	UIZTUDLPHAJTKE-NRFANRHFSA-N	0	3	341.499	3.417	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)C1(C(F)F)CCCC1)C2	ZINC001054183173	1349185932	/nfs/dbraw/zinc/18/59/32/1349185932.db2.gz	AXPANBYDVWCFBK-GOSISDBHSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(F)c(Cl)c1)C2	ZINC001054187371	1349190545	/nfs/dbraw/zinc/19/05/45/1349190545.db2.gz	PDQQPMPYGNHHSW-IBGZPJMESA-N	0	3	348.849	3.431	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H](C)c1ccsc1)C2	ZINC001054195726	1349198539	/nfs/dbraw/zinc/19/85/39/1349198539.db2.gz	CAHVRNZAZQXWSX-LPHOPBHVSA-N	0	3	330.497	3.189	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(C)cc1Cl)C2	ZINC001054201067	1349202521	/nfs/dbraw/zinc/20/25/21/1349202521.db2.gz	SBMAIDSPWAQACF-LJQANCHMSA-N	0	3	330.859	3.210	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cccc(F)c1Cl)C2	ZINC001054204283	1349206075	/nfs/dbraw/zinc/20/60/75/1349206075.db2.gz	RVDJMPCKIOUPAC-GOSISDBHSA-N	0	3	334.822	3.040	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H](C)c1ccccc1F)C2	ZINC001054215780	1349215057	/nfs/dbraw/zinc/21/50/57/1349215057.db2.gz	FIGWAQQFONABOI-UWJYYQICSA-N	0	3	342.458	3.267	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc(CC(C)C)c[nH]1)C2	ZINC001054228514	1349222339	/nfs/dbraw/zinc/22/23/39/1349222339.db2.gz	RRPYWDDEXVIHDQ-NRFANRHFSA-N	0	3	341.499	3.165	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)C13CC4CC(CC(C4)C1)C3)C2	ZINC001054231814	1349225406	/nfs/dbraw/zinc/22/54/06/1349225406.db2.gz	AQKVXQCXFUVDQV-RKRCHRGQSA-N	0	3	340.511	3.151	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@@H]3C[C@H]3OCC)cc2C1	ZINC001054257717	1349253392	/nfs/dbraw/zinc/25/33/92/1349253392.db2.gz	UFYUBFCBDWSUAZ-RTBURBONSA-N	0	3	328.456	3.010	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3ncoc3C)cc2C1	ZINC001054257543	1349253542	/nfs/dbraw/zinc/25/35/42/1349253542.db2.gz	OLEKPADLDZBBPA-UHFFFAOYSA-N	0	3	325.412	3.195	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@H]3CCO[C@H]3C(C)C)cc2C1	ZINC001054268772	1349267174	/nfs/dbraw/zinc/26/71/74/1349267174.db2.gz	XGJNDZVAGMLKSD-PMACEKPBSA-N	0	3	342.483	3.256	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cnc4cc[nH]c4c3)cc2C1	ZINC001054270207	1349268552	/nfs/dbraw/zinc/26/85/52/1349268552.db2.gz	FHMMMKHRMUXSDO-UHFFFAOYSA-N	0	3	346.434	3.385	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3ncc(F)cc3F)cc2C1	ZINC001054269651	1349268805	/nfs/dbraw/zinc/26/88/05/1349268805.db2.gz	IZFPMJUHVRSMSJ-UHFFFAOYSA-N	0	3	343.377	3.182	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@@H]3Cc4ccncc4C3)cc2C1	ZINC001054281686	1349283231	/nfs/dbraw/zinc/28/32/31/1349283231.db2.gz	WHQZURDEXVKPOD-LJQANCHMSA-N	0	3	347.462	3.005	20	30		EGEDHN
CC(C(=O)N1C[C@H](NCc2ccc(C#N)s2)[C@@H](C)C1)=C1CCCC1	ZINC001054546482	1349394111	/nfs/dbraw/zinc/39/41/11/1349394111.db2.gz	FUULKEPZFXDUSQ-UGSOOPFHSA-N	0	3	343.496	3.447	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2=CCCCCC2)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054599211	1349410958	/nfs/dbraw/zinc/41/09/58/1349410958.db2.gz	MXPRCQPKQUESQJ-KDOFPFPSSA-N	0	3	343.496	3.447	20	30		EGEDHN
CC(C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1)=C1CCC1	ZINC001054638908	1349425092	/nfs/dbraw/zinc/42/50/92/1349425092.db2.gz	RDLLMERDGJGAQU-SJKOYZFVSA-N	0	3	329.469	3.057	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](NCc2ccc(C#N)c(F)c2)[C@@H](C)C1	ZINC001054970326	1349530591	/nfs/dbraw/zinc/53/05/91/1349530591.db2.gz	BEYAJULWWDGGKN-KSSFIOAISA-N	0	3	343.446	3.236	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@H](NCc2cccc(OCC)n2)C1	ZINC001054971584	1349531986	/nfs/dbraw/zinc/53/19/86/1349531986.db2.gz	RDCCKBSGYQIGKJ-NVXWUHKLSA-N	0	3	345.487	3.019	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2ccc(OC)c(C(C)C)c2)C1	ZINC001080054360	1357469220	/nfs/dbraw/zinc/46/92/20/1357469220.db2.gz	VBPLEWHLAHRBME-CRAIPNDOSA-N	0	3	330.472	3.445	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)CN(C(=O)C1CCCCCCC1)C[C@@H](C)O2	ZINC001071188974	1354493786	/nfs/dbraw/zinc/49/37/86/1354493786.db2.gz	DBIGXXLCUKIKPT-WIYYLYMNSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1ccc(F)c(C)c1)C[C@@H](C)O2	ZINC001071203716	1354503680	/nfs/dbraw/zinc/50/36/80/1354503680.db2.gz	GSFQFRPMWKZHRT-OXQOHEQNSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1cccc(C)c1C)C[C@H](C)O2	ZINC001071238523	1354521389	/nfs/dbraw/zinc/52/13/89/1354521389.db2.gz	NSERWCUIYWKKAF-UWJYYQICSA-N	0	3	342.483	3.185	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C1(C)C(C)(C)C1(C)C)C[C@H](C)O2	ZINC001071248795	1354527393	/nfs/dbraw/zinc/52/73/93/1354527393.db2.gz	SYBBDIZFTFYPML-KKSFZXQISA-N	0	3	348.531	3.327	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2oc(CC3CC3)nc2C)CC[C@@H]1C	ZINC001071504646	1354732742	/nfs/dbraw/zinc/73/27/42/1354732742.db2.gz	IKUYJVVTGZANPV-XJKSGUPXSA-N	0	3	331.460	3.094	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc(Cl)c(Cl)n2C)CC[C@H]1C	ZINC001071548515	1354760874	/nfs/dbraw/zinc/76/08/74/1354760874.db2.gz	HHHDKTKFWDLUEP-NEPJUHHUSA-N	0	3	344.286	3.491	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cncn2-c2ccccc2)CC[C@H]1C	ZINC001071560562	1354764131	/nfs/dbraw/zinc/76/41/31/1354764131.db2.gz	CHQAIPZMVRBKLO-SJORKVTESA-N	0	3	338.455	3.031	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2nc3cccnc3s2)CC[C@H]1C	ZINC001071571924	1354771354	/nfs/dbraw/zinc/77/13/54/1354771354.db2.gz	NRTVERXYBGAXRF-KGLIPLIRSA-N	0	3	344.484	3.240	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@@H]2CC[C@H](C)N(CCCF)C2)cc1	ZINC001071619271	1354802181	/nfs/dbraw/zinc/80/21/81/1354802181.db2.gz	MEOOJIQQXMVCCJ-DOTOQJQBSA-N	0	3	334.435	3.194	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc3c([nH]2)c(F)ccc3C)CC[C@H]1C	ZINC001071624716	1354808383	/nfs/dbraw/zinc/80/83/83/1354808383.db2.gz	JKUTUETXNQXGQN-CABCVRRESA-N	0	3	341.430	3.221	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2[nH]c3ccccc3c2Cl)CC[C@@H]1C	ZINC001071646177	1354824415	/nfs/dbraw/zinc/82/44/15/1354824415.db2.gz	SXIRSDOWQRYYSU-UONOGXRCSA-N	0	3	343.858	3.427	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cccc(-n3cccc3)c2)CC[C@H]1C	ZINC001071654668	1354829711	/nfs/dbraw/zinc/82/97/11/1354829711.db2.gz	HIMNESSIBSNRRI-IEBWSBKVSA-N	0	3	335.451	3.083	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cn(C)c3ccccc23)CC[C@H]1C	ZINC001071657591	1354830754	/nfs/dbraw/zinc/83/07/54/1354830754.db2.gz	AIBJWLZMXCQSMO-CVEARBPZSA-N	0	3	325.456	3.337	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc(-c3ccccc3)n[nH]2)CC[C@H]1C	ZINC001071663526	1354835288	/nfs/dbraw/zinc/83/52/88/1354835288.db2.gz	OOVSUFZOLRLCHO-WBVHZDCISA-N	0	3	338.455	3.236	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cnn3cccc(Cl)c23)CC[C@@H]1C	ZINC001071670509	1354840768	/nfs/dbraw/zinc/84/07/68/1354840768.db2.gz	LWKZZYJGKOJUNC-UONOGXRCSA-N	0	3	346.862	3.147	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2c[nH]nc2-c2ccccc2)CC[C@@H]1C	ZINC001071716663	1354874893	/nfs/dbraw/zinc/87/48/93/1354874893.db2.gz	YVJUUCDIFRQKPT-DOTOQJQBSA-N	0	3	338.455	3.236	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2(c3ccc(F)cc3)CCC2)CC[C@@H]1C	ZINC001071729265	1354884795	/nfs/dbraw/zinc/88/47/95/1354884795.db2.gz	YEYHYKRCBCYHEQ-QFBILLFUSA-N	0	3	342.458	3.240	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CC[C@H](C)N(Cc3ccccc3)C2)cc1	ZINC001071731854	1354886501	/nfs/dbraw/zinc/88/65/01/1354886501.db2.gz	LAXRTGLCSUSHLS-UWJYYQICSA-N	0	3	332.447	3.451	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(C(C)C)nc2C)CC[C@H]1C	ZINC001071827724	1354964594	/nfs/dbraw/zinc/96/45/94/1354964594.db2.gz	CCPWLUWBZZEQEO-NVXWUHKLSA-N	0	3	327.472	3.119	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(C(C)C)nc2CC)CC[C@H]1C	ZINC001071828078	1354965753	/nfs/dbraw/zinc/96/57/53/1354965753.db2.gz	IPTYUEBUPCUPQR-SJORKVTESA-N	0	3	341.499	3.373	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)Cc2c[nH]c3ccc(F)cc23)CC[C@H]1C	ZINC001071843764	1354973360	/nfs/dbraw/zinc/97/33/60/1354973360.db2.gz	AMNHCMGIJSJZJW-CJNGLKHVSA-N	0	3	329.419	3.005	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cccc(N3CC=CC3)c2)CC[C@@H]1C	ZINC001071854927	1354982877	/nfs/dbraw/zinc/98/28/77/1354982877.db2.gz	IIBLKMSROUHWPV-HKUYNNGSSA-N	0	3	339.483	3.222	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C2(c3cccc(OC)c3)CC2)CC[C@@H]1C	ZINC001071857032	1354986336	/nfs/dbraw/zinc/98/63/36/1354986336.db2.gz	CVFFRCOSZRSKDT-WMZOPIPTSA-N	0	3	342.483	3.272	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(C(C)C)[nH]c2=O)CC[C@@H]1C	ZINC001071879538	1355002302	/nfs/dbraw/zinc/00/23/02/1355002302.db2.gz	FJNCOFBEWBZUJK-LSDHHAIUSA-N	0	3	331.460	3.069	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cnn(CC3CCCC3)c2)CC[C@@H]1C	ZINC001071931692	1355032404	/nfs/dbraw/zinc/03/24/04/1355032404.db2.gz	YXYPCENWMOIFBD-LPHOPBHVSA-N	0	3	344.503	3.232	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc(-c3ccccc3)ccn2)CC[C@H]1C	ZINC001071934010	1355033789	/nfs/dbraw/zinc/03/37/89/1355033789.db2.gz	FTIDTNXXDLCZFV-YLJYHZDGSA-N	0	3	347.462	3.355	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cn(CCCC)nc2C)CC[C@H]1C	ZINC001071976780	1355056049	/nfs/dbraw/zinc/05/60/49/1355056049.db2.gz	IESBWIYPYQMVAS-NVXWUHKLSA-N	0	3	332.492	3.150	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cnn(C3CCCC3)c2C)CC[C@H]1C	ZINC001071977894	1355057500	/nfs/dbraw/zinc/05/75/00/1355057500.db2.gz	UKQAUBXRMAJESA-WBVHZDCISA-N	0	3	344.503	3.465	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cnn(CC(C)C)c2C)CC[C@H]1C	ZINC001072029806	1355091695	/nfs/dbraw/zinc/09/16/95/1355091695.db2.gz	JUZGJLKRBRSNIZ-WBVHZDCISA-N	0	3	332.492	3.006	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(OC(C)C)cc2)CC[C@@H]1C	ZINC001072049590	1355103540	/nfs/dbraw/zinc/10/35/40/1355103540.db2.gz	PUDMLFBXVWVYSR-FUHWJXTLSA-N	0	3	328.456	3.080	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cn2ccc3ccccc32)CC[C@H]1C	ZINC001072088741	1355122293	/nfs/dbraw/zinc/12/22/93/1355122293.db2.gz	PDFJVMXZJNEWGM-SJLPKXTDSA-N	0	3	325.456	3.187	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(C(C)C)[nH]c1=O	ZINC001089704959	1360607085	/nfs/dbraw/zinc/60/70/85/1360607085.db2.gz	AEFNOVSARKGJHM-HNNXBMFYSA-N	0	3	345.487	3.317	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C2(c3ccccc3OC)CC2)CC[C@H]1C	ZINC001072115872	1355140438	/nfs/dbraw/zinc/14/04/38/1355140438.db2.gz	DLQTYZGNCXLXDX-IAGOWNOFSA-N	0	3	342.483	3.272	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(C(C)(F)F)cc2)CC[C@H]1C	ZINC001072124209	1355142295	/nfs/dbraw/zinc/14/22/95/1355142295.db2.gz	YOUMUTYGRUWCLH-PBHICJAKSA-N	0	3	334.410	3.404	20	30		EGEDHN
C[C@H]1CCN(C(=O)C=C2CCC2)C[C@@H]1CNCc1ccccc1C#N	ZINC001072252725	1355209705	/nfs/dbraw/zinc/20/97/05/1355209705.db2.gz	ZHBSCKCPYXHFST-JXFKEZNVSA-N	0	3	337.467	3.243	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC2(C1)CCN(CCC(F)(F)F)C2	ZINC001072780055	1355433683	/nfs/dbraw/zinc/43/36/83/1355433683.db2.gz	RUFZFJUOJYLYAS-UHFFFAOYSA-N	0	3	338.801	3.252	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CN(C(=O)[C@@H]4CCCC45CC5)C3)C2)cc1	ZINC001072851521	1355465240	/nfs/dbraw/zinc/46/52/40/1355465240.db2.gz	ZCIVXZHMWYYAQM-IBGZPJMESA-N	0	3	349.478	3.173	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1ccc(OC)cc1)C2	ZINC001072944896	1355513620	/nfs/dbraw/zinc/51/36/20/1355513620.db2.gz	NLXNUDSHNHGZGT-HXUWFJFHSA-N	0	3	342.483	3.332	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC3(C2)CCN(Cc2ccc(OC)cc2)C3)C1	ZINC001072963940	1355526150	/nfs/dbraw/zinc/52/61/50/1355526150.db2.gz	BTYPBSAVCPPNQZ-UHFFFAOYSA-N	0	3	340.467	3.086	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@@H](Cc3ccccc3)C(C)C)C2)C1	ZINC001072975916	1355531777	/nfs/dbraw/zinc/53/17/77/1355531777.db2.gz	OSZBAJICKABUOR-IBGZPJMESA-N	0	3	326.484	3.222	20	30		EGEDHN
C[C@H]1CC[C@@H](C(=O)N2CC3(C2)CCN(Cc2cccc(C#N)c2)C3)C1	ZINC001073031950	1355560042	/nfs/dbraw/zinc/56/00/42/1355560042.db2.gz	VXQLALSGVNUNCE-QFBILLFUSA-N	0	3	337.467	3.029	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H](C)Cc3cccc(Cl)c3)C2)C1	ZINC001073489326	1355818799	/nfs/dbraw/zinc/81/87/99/1355818799.db2.gz	SRRXCKDUSZZCTG-MRXNPFEDSA-N	0	3	344.886	3.076	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCCN1C(=O)CC1CC1	ZINC001073928000	1355963319	/nfs/dbraw/zinc/96/33/19/1355963319.db2.gz	YECPBRSARLDGFY-LJQANCHMSA-N	0	3	325.456	3.171	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCCC[C@@H]1CN(C)Cc1cc2ccccc2o1	ZINC001073972836	1356004474	/nfs/dbraw/zinc/00/44/74/1356004474.db2.gz	GXXDBUBFKGGXQG-DOTOQJQBSA-N	0	3	339.439	3.405	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](C2CCN(C(=O)[C@H](C)C#N)CC2)CC1	ZINC001075448227	1356381256	/nfs/dbraw/zinc/38/12/56/1356381256.db2.gz	RBSPPYSZNZOSHR-GDBMZVCRSA-N	0	3	337.895	3.239	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3nsc4ccc(C)cc43)[C@@H]2C1	ZINC001076129687	1356497716	/nfs/dbraw/zinc/49/77/16/1356497716.db2.gz	CWNLSYBZGIIFHC-GOEBONIOSA-N	0	3	341.480	3.327	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3c3ccc(Cl)cc3)[C@@H]2C1	ZINC001076349975	1356555723	/nfs/dbraw/zinc/55/57/23/1356555723.db2.gz	YSYSOWDWRNNOKG-DZJNRPSUSA-N	0	3	330.859	3.162	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3csc4c3CC[C@H](C)C4)[C@@H]2C1	ZINC001076530543	1356606374	/nfs/dbraw/zinc/60/63/74/1356606374.db2.gz	UBOQOILVBFASBA-RLFYNMQTSA-N	0	3	342.508	3.043	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)C[C@@H](C)c1c(C)n[nH]c1C	ZINC001099126660	1363639566	/nfs/dbraw/zinc/63/95/66/1363639566.db2.gz	YBCBKXODMPUNED-RHSMWYFYSA-N	0	3	346.519	3.313	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)CCCOc1cccnc1	ZINC001099343843	1363762181	/nfs/dbraw/zinc/76/21/81/1363762181.db2.gz	CJGIRBKIEPTXEY-QGZVFWFLSA-N	0	3	345.487	3.033	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2cccc3cnccc32)C[C@H]1C(F)(F)F	ZINC001099343036	1363762192	/nfs/dbraw/zinc/76/21/92/1363762192.db2.gz	DDFQLGNZTJOVNC-HZPDHXFCSA-N	0	3	349.356	3.013	20	30		EGEDHN
C=C1CCC(C(=O)N2CCCO[C@@H](CNCc3ccsc3)C2)CC1	ZINC001078460407	1356977974	/nfs/dbraw/zinc/97/79/74/1356977974.db2.gz	SACDHFMMFRXHDR-SFHVURJKSA-N	0	3	348.512	3.202	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@H](NC(=O)CC3CC3)C23CCC3)c1	ZINC001078530887	1356998204	/nfs/dbraw/zinc/99/82/04/1356998204.db2.gz	DETQBMDSBXZDOK-ROUUACIJSA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@@]2(c3ccccc3)C[C@H](F)C2)C1	ZINC001080869815	1357755018	/nfs/dbraw/zinc/75/50/18/1357755018.db2.gz	ZGQWPCYITIMKJH-DLVXIWMQSA-N	0	3	330.447	3.069	20	30		EGEDHN
C#CCCN1C[C@@H](C)[C@H](NC(=O)c2cc(CC)c(CCC)s2)C1	ZINC001080923599	1357765404	/nfs/dbraw/zinc/76/54/04/1357765404.db2.gz	JDFIPHGVCHRMIA-GDBMZVCRSA-N	0	3	332.513	3.336	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2csc(C)c2C)C[C@H]1c1ccccc1	ZINC001081122385	1357840817	/nfs/dbraw/zinc/84/08/17/1357840817.db2.gz	QTPTYVYVVROROU-PKOBYXMFSA-N	0	3	338.476	3.196	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H](C)CC2CCCC2)C[C@H]1c1ccccc1	ZINC001081190912	1357848432	/nfs/dbraw/zinc/84/84/32/1357848432.db2.gz	YCQWGAPJZKFDQT-DZFGPLHGSA-N	0	3	338.495	3.420	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@]2(C)CC=C(C)CC2)C[C@H]1c1ccccc1	ZINC001081229881	1357851378	/nfs/dbraw/zinc/85/13/78/1357851378.db2.gz	DVYZCKSUXPRJID-VWPQPMDRSA-N	0	3	336.479	3.340	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C2CC(C(C)(C)C)C2)C[C@H]1c1ccccc1	ZINC001081232907	1357851846	/nfs/dbraw/zinc/85/18/46/1357851846.db2.gz	GTRUPJITMROKQP-GHBBCFCZSA-N	0	3	338.495	3.276	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CN(CCC3=CCCCC3)C[C@H]2OC)CC1	ZINC001082101510	1357945493	/nfs/dbraw/zinc/94/54/93/1357945493.db2.gz	ZHXBFYLRDJZVIO-WOJBJXKFSA-N	0	3	346.515	3.439	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CN([C@H](C)c3ccccc3C)C[C@H]2OC)C1	ZINC001082111032	1357949813	/nfs/dbraw/zinc/94/98/13/1357949813.db2.gz	QKQFRIMIHGOKDS-BHIYHBOVSA-N	0	3	342.483	3.228	20	30		EGEDHN
COc1ccc([C@@H](NC(C)C)C(=O)N2CCCC(C)(C)[C@H]2C#N)cc1	ZINC001183389801	1387306016	/nfs/dbraw/zinc/30/60/16/1387306016.db2.gz	SGGHPDUHMZYTDB-QZTJIDSGSA-N	0	3	343.471	3.275	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2ccc(C3=CCCC3)cc2)[C@H](OC)C1	ZINC001082402269	1358026419	/nfs/dbraw/zinc/02/64/19/1358026419.db2.gz	DALQFSPIDZLVHU-WOJBJXKFSA-N	0	3	340.467	3.259	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)c3coc4ccc(CC)cc34)[C@@H]2C1	ZINC001084347259	1358197259	/nfs/dbraw/zinc/19/72/59/1358197259.db2.gz	LLDVOCVJCWXXLN-VQIMIIECSA-N	0	3	336.435	3.165	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@@H]3CCc4c3cccc4Cl)[C@@H]2C1	ZINC001084523895	1358230627	/nfs/dbraw/zinc/23/06/27/1358230627.db2.gz	BERZPRXHIHWCQA-LSBZLQRGSA-N	0	3	344.886	3.479	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)C[C@H]3CCOc4ccccc43)[C@@H]2C1	ZINC001084574578	1358241459	/nfs/dbraw/zinc/24/14/59/1358241459.db2.gz	DEKXPOIMMOVBIL-ZHALLVOQSA-N	0	3	340.467	3.052	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)CC[C@H]3CCc4ccccc43)C[C@@H]21	ZINC001085098446	1358390560	/nfs/dbraw/zinc/39/05/60/1358390560.db2.gz	SAOJKVWRAOYZTG-SBHAEUEKSA-N	0	3	336.479	3.053	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)C[C@@H]1C=CCC1	ZINC001085127448	1358404591	/nfs/dbraw/zinc/40/45/91/1358404591.db2.gz	CYVVJGXGPORSOK-RBSFLKMASA-N	0	3	341.293	3.268	20	30		EGEDHN
C[C@H](C(=O)N[C@@H]1CCCC[C@H]1NCc1cc(C#N)ccc1F)C1CC1	ZINC001085162394	1358417676	/nfs/dbraw/zinc/41/76/76/1358417676.db2.gz	NXVWDVJWTVARPY-MJXNMMHHSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)C(C)(C)c1cc(C)ccn1	ZINC001085242688	1358442454	/nfs/dbraw/zinc/44/24/54/1358442454.db2.gz	CJLZIPJNMHRNDU-HZPDHXFCSA-N	0	3	349.906	3.437	20	30		EGEDHN
CN(C[C@H]1CCN1[C@@H]1CCCc2ccccc21)C(=O)c1cc(C#N)c[nH]1	ZINC001085535743	1358572850	/nfs/dbraw/zinc/57/28/50/1358572850.db2.gz	OUMXMQLGPJQLGR-YLJYHZDGSA-N	0	3	348.450	3.110	20	30		EGEDHN
Cc1ccccc1[C@@H](C)N1CC[C@H]1CN(C)C(=O)c1c[nH]c(C#N)c1	ZINC001085556768	1358592625	/nfs/dbraw/zinc/59/26/25/1358592625.db2.gz	ZMKQENHCGQIFSX-QAPCUYQASA-N	0	3	336.439	3.102	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)[C@@H]1CC[C@H](c2ccccc2)O1	ZINC001085599644	1358623976	/nfs/dbraw/zinc/62/39/76/1358623976.db2.gz	XOAVWEPIPIUGQH-OTWHNJEPSA-N	0	3	328.456	3.016	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1ocnc1-c1ccccc1	ZINC001085633084	1358649772	/nfs/dbraw/zinc/64/97/72/1358649772.db2.gz	LQRQGLASKAETRC-MRXNPFEDSA-N	0	3	325.412	3.064	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc2oc(C)nc2c1	ZINC001085664246	1358667896	/nfs/dbraw/zinc/66/78/96/1358667896.db2.gz	GUOBBXIOQXPJBZ-INIZCTEOSA-N	0	3	327.428	3.249	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1ccc(F)c(Cl)c1F	ZINC001085799921	1358775662	/nfs/dbraw/zinc/77/56/62/1358775662.db2.gz	GISYRBKZBSGCDW-NSHDSACASA-N	0	3	328.790	3.341	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cn(CC)nc1C(C)C	ZINC001085845480	1358814036	/nfs/dbraw/zinc/81/40/36/1358814036.db2.gz	MZRTZUDDTVPJKZ-INIZCTEOSA-N	0	3	332.492	3.139	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N(C)C[C@@H]1CCN1CCC1=CCCCC1	ZINC001085869513	1358835424	/nfs/dbraw/zinc/83/54/24/1358835424.db2.gz	SIHKTORDXFEZOD-UFYCRDLUSA-N	0	3	346.515	3.391	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@@H]1CCO[C@H]1c1ccccc1	ZINC001085868494	1358835665	/nfs/dbraw/zinc/83/56/65/1358835665.db2.gz	QWVWKFXQGXIMGN-AQNXPRMDSA-N	0	3	342.483	3.263	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccnc(O[C@@H](C)CC)c1	ZINC001085915452	1358875045	/nfs/dbraw/zinc/87/50/45/1358875045.db2.gz	BGELRTWSBIOQKP-FUHWJXTLSA-N	0	3	345.487	3.371	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C[C@H]2CCN2[C@@H](C)c2ccccc2C)cn1	ZINC001085932914	1358888393	/nfs/dbraw/zinc/88/83/93/1358888393.db2.gz	LTSQIYNRDXGDJS-FXAWDEMLSA-N	0	3	347.462	3.279	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1csc(CC(C)C)n1	ZINC001085999120	1358954579	/nfs/dbraw/zinc/95/45/79/1358954579.db2.gz	AMWSAYYAKQBNMA-HNNXBMFYSA-N	0	3	335.517	3.454	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cccc2c1OCC2(C)C	ZINC001086005407	1358959600	/nfs/dbraw/zinc/95/96/00/1358959600.db2.gz	DRQRYMKAINBANE-INIZCTEOSA-N	0	3	342.483	3.469	20	30		EGEDHN
CCCCC(=O)N1CC[C@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001183913525	1387369695	/nfs/dbraw/zinc/36/96/95/1387369695.db2.gz	SBKJQZCHHSIMFR-SJLPKXTDSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@@H]2CC[C@H](c3ccccc3)O2)C1	ZINC001086088054	1358992709	/nfs/dbraw/zinc/99/27/09/1358992709.db2.gz	BUBSYDJQTUZUKV-SPUZQDLCSA-N	0	3	348.874	3.144	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)[C@H]2CCCC[C@@H]2C)C1	ZINC001086182240	1359018454	/nfs/dbraw/zinc/01/84/54/1359018454.db2.gz	WECFHFYUOAPDIL-MHEUCROKSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc3c(s2)CCCC3)C1	ZINC001086267182	1359048619	/nfs/dbraw/zinc/04/86/19/1359048619.db2.gz	RBBBHNSSQYBLEU-XBXGTLAGSA-N	0	3	338.904	3.477	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)c2cscc2C)C1	ZINC001086335832	1359070212	/nfs/dbraw/zinc/07/02/12/1359070212.db2.gz	FCECHSRXJUEGAM-HAQNSBGRSA-N	0	3	343.290	3.063	20	30		EGEDHN
CC1(C)CC(C(=O)NC[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)C1	ZINC001086358128	1359076411	/nfs/dbraw/zinc/07/64/11/1359076411.db2.gz	RDJFHARLOVUURY-CZIWCDLHSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(C(C)(C)C)cn2)C1	ZINC001086369461	1359079593	/nfs/dbraw/zinc/07/95/93/1359079593.db2.gz	IXWQIXKJULNAGE-CTYIDZIISA-N	0	3	335.879	3.230	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc(F)cc3ccoc32)C1	ZINC001086411742	1359090543	/nfs/dbraw/zinc/09/05/43/1359090543.db2.gz	SFOPURSYHFFMCE-YEORSEQZSA-N	0	3	336.794	3.422	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc(C)nc3ccccc32)C1	ZINC001086547688	1359140942	/nfs/dbraw/zinc/14/09/42/1359140942.db2.gz	XHEAQGZBAKQTQX-SHTZXODSSA-N	0	3	343.858	3.394	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)[C@]2(C)CC=CCC2)C1	ZINC001086590405	1359157548	/nfs/dbraw/zinc/15/75/48/1359157548.db2.gz	BQVTVPRQZXDEIL-TUNNFDKTSA-N	0	3	336.479	3.340	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)CC2CC(F)(F)C2)C1	ZINC001086596387	1359159878	/nfs/dbraw/zinc/15/98/78/1359159878.db2.gz	YSJIVFYRVZGAIF-ZWKOTPCHSA-N	0	3	346.421	3.029	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2csc(C)c2)C1	ZINC001086614638	1359165257	/nfs/dbraw/zinc/16/52/57/1359165257.db2.gz	HLNDZKOFZCDKAB-RBUKOAKNSA-N	0	3	338.476	3.278	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)[C@H](C)C2CCCC2)C1	ZINC001086619585	1359166381	/nfs/dbraw/zinc/16/63/81/1359166381.db2.gz	XZIUYAROJQUSDJ-JRGCBEDISA-N	0	3	338.495	3.420	20	30		EGEDHN
C=C(Br)CN[C@@H]1CC[C@H](CNC(=O)[C@@H]2C[C@H]2CCC)C1	ZINC001086796723	1359203942	/nfs/dbraw/zinc/20/39/42/1359203942.db2.gz	CUPRJXNTUOJTEJ-GBJTYRQASA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cc([C@H](C)CC)no2)C1	ZINC001086823255	1359208621	/nfs/dbraw/zinc/20/86/21/1359208621.db2.gz	UUDBYDKXHHAPIW-KWCYVHTRSA-N	0	3	339.867	3.429	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc(F)c(C)cc3F)C2)CC1	ZINC001086927648	1359252709	/nfs/dbraw/zinc/25/27/09/1359252709.db2.gz	HZPHCMBMKLUFKW-OAHLLOKOSA-N	0	3	346.421	3.223	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)CC3CC(F)(F)C3)C2)CC1	ZINC001086929620	1359254421	/nfs/dbraw/zinc/25/44/21/1359254421.db2.gz	MNHDTAXOGAYSKG-HNNXBMFYSA-N	0	3	338.442	3.148	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cc4ccsc4[nH]3)C2)CC1	ZINC001086935040	1359258433	/nfs/dbraw/zinc/25/84/33/1359258433.db2.gz	HRLJELCRDQKHST-AWEZNQCLSA-N	0	3	341.480	3.179	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc(Cl)[nH]3)C2)CC1	ZINC001086941379	1359263023	/nfs/dbraw/zinc/26/30/23/1359263023.db2.gz	RYYAFKNIFQDVGB-AWEZNQCLSA-N	0	3	333.863	3.008	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)C3CCC(F)CC3)C2)CC1	ZINC001086941162	1359263218	/nfs/dbraw/zinc/26/32/18/1359263218.db2.gz	LCWYFVOWLPSGAT-WWDZGPRUSA-N	0	3	334.479	3.241	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)[C@H](C)C(C)(F)F)C2)CC1	ZINC001086943060	1359264321	/nfs/dbraw/zinc/26/43/21/1359264321.db2.gz	IYSQCVYZVOVFGM-GJZGRUSLSA-N	0	3	326.431	3.004	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc(C)cc3F)C2)CC1	ZINC001086944570	1359265827	/nfs/dbraw/zinc/26/58/27/1359265827.db2.gz	BSWOIOAWRQYFPR-QGZVFWFLSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@H](C)c3cccc(C)c3)C2)CC1	ZINC001086945459	1359266290	/nfs/dbraw/zinc/26/62/90/1359266290.db2.gz	BTXMAUYBSNTWLN-RBUKOAKNSA-N	0	3	338.495	3.435	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cc(CC)c(CC)o3)C2)CC1	ZINC001086953644	1359273710	/nfs/dbraw/zinc/27/37/10/1359273710.db2.gz	OWADZQWTXCWEEI-INIZCTEOSA-N	0	3	342.483	3.354	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc4c(c3)CCC4)C2)CC1	ZINC001086956596	1359277759	/nfs/dbraw/zinc/27/77/59/1359277759.db2.gz	QYHHEBCVYKKYLF-QGZVFWFLSA-N	0	3	336.479	3.125	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@H](C)c3cccc(F)c3)C2)CC1	ZINC001086957284	1359278293	/nfs/dbraw/zinc/27/82/93/1359278293.db2.gz	JJWYWONSHXBTPN-DLBZAZTESA-N	0	3	342.458	3.265	20	30		EGEDHN
CC1(C)[C@H](NC(=O)C2CC2)[C@H]2CCCN(Cc3cccc(C#N)c3)[C@@H]21	ZINC001087266378	1359336808	/nfs/dbraw/zinc/33/68/08/1359336808.db2.gz	KVSFIHGJDZXRAK-QRVBRYPASA-N	0	3	337.467	3.073	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)C(F)=C3CCCC3)C(C)(C)[C@@H]21	ZINC001087281715	1359361236	/nfs/dbraw/zinc/36/12/36/1359361236.db2.gz	LFPJFKIEJWBXMS-KBAYOESNSA-N	0	3	332.463	3.413	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccoc3CC)C(C)(C)[C@H]21	ZINC001087284097	1359363391	/nfs/dbraw/zinc/36/33/91/1359363391.db2.gz	BQPYWTJTUWBSNS-NJAFHUGGSA-N	0	3	328.456	3.084	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)Cc3cccc(CC)c3)C(C)(C)[C@H]21	ZINC001087293191	1359374483	/nfs/dbraw/zinc/37/44/83/1359374483.db2.gz	ZTNKHKWWHHPLPL-NRSPTQNISA-N	0	3	338.495	3.030	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(Cl)ccc3F)C(C)(C)[C@@H]21	ZINC001087295133	1359376450	/nfs/dbraw/zinc/37/64/50/1359376450.db2.gz	FFDWPRRYAYUPLF-KBRIMQKVSA-N	0	3	348.849	3.331	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(F)c(C)c3)C(C)(C)[C@@H]21	ZINC001087300942	1359383839	/nfs/dbraw/zinc/38/38/39/1359383839.db2.gz	STZXTTNKKPOAFO-BHIYHBOVSA-N	0	3	342.458	3.376	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccoc3C3CC3)C(C)(C)[C@@H]21	ZINC001087300898	1359384357	/nfs/dbraw/zinc/38/43/57/1359384357.db2.gz	SHRGYZNFVOAEGQ-BHIYHBOVSA-N	0	3	340.467	3.399	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc(CF)cc3)C(C)(C)[C@H]21	ZINC001087319057	1359411184	/nfs/dbraw/zinc/41/11/84/1359411184.db2.gz	HZFVMRAZZLQPMC-QYZOEREBSA-N	0	3	342.458	3.398	20	30		EGEDHN
O=C(CC1CC1)N1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(CC#Cc2ccccc2)C1	ZINC001087328442	1359417974	/nfs/dbraw/zinc/41/79/74/1359417974.db2.gz	XGLVDCTUWSWOGH-CMOCDZPBSA-N	0	3	348.490	3.007	20	30		EGEDHN
CCCC(=O)N1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(CC#Cc2ccccc2)C1	ZINC001087329684	1359419212	/nfs/dbraw/zinc/41/92/12/1359419212.db2.gz	SKLUWBXFJPULRG-TUFLPTIASA-N	0	3	336.479	3.007	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)c2ccccc2)C1	ZINC001087419977	1359457065	/nfs/dbraw/zinc/45/70/65/1359457065.db2.gz	FOCLCYOTMJLTSR-NHCUHLMSSA-N	0	3	332.447	3.298	20	30		EGEDHN
C=CCCN1CC[C@H](c2ccc(F)cc2)[C@H](NC(=O)C2CCC2)C1	ZINC001087461309	1359477853	/nfs/dbraw/zinc/47/78/53/1359477853.db2.gz	BJGJHMNXDPWAHJ-RTBURBONSA-N	0	3	330.447	3.476	20	30		EGEDHN
C=CCCN1CC[C@@H](c2ccc(OC)cc2)[C@@H](NC(=O)C2(C)CC2)C1	ZINC001087474575	1359482758	/nfs/dbraw/zinc/48/27/58/1359482758.db2.gz	NIUPFBLQOVZRLA-OALUTQOASA-N	0	3	342.483	3.346	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cc(-c3ccccc3)n[nH]2)[C@H]1CC	ZINC001087648256	1359570576	/nfs/dbraw/zinc/57/05/76/1359570576.db2.gz	DAOXDQLWGAJDFY-QFBILLFUSA-N	0	3	338.455	3.236	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)[C@]23C[C@H]2CCC3)CCN1Cc1ccc(C#N)cc1	ZINC001087664293	1359578539	/nfs/dbraw/zinc/57/85/39/1359578539.db2.gz	CVBRDPOTVJVHDO-RCLSDMTESA-N	0	3	337.467	3.218	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2sccc2-n2cccc2)[C@H]1CC	ZINC001087679246	1359586843	/nfs/dbraw/zinc/58/68/43/1359586843.db2.gz	DETWHNXLNASHJO-LSDHHAIUSA-N	0	3	329.469	3.308	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2cc(F)c(Cl)cc2F)[C@H]1CC	ZINC001087708048	1359602155	/nfs/dbraw/zinc/60/21/55/1359602155.db2.gz	PIYWBAHRVIROTH-JKSUJKDBSA-N	0	3	340.801	3.224	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cccc(Cl)c2F)[C@H]1CC	ZINC001087740150	1359620110	/nfs/dbraw/zinc/62/01/10/1359620110.db2.gz	RKRLAPMIDRECPQ-JKSUJKDBSA-N	0	3	336.838	3.014	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccccc2OCC(C)C)[C@H]1CC	ZINC001087765141	1359633720	/nfs/dbraw/zinc/63/37/20/1359633720.db2.gz	BXSSWFDFNRVBNC-ZWKOTPCHSA-N	0	3	330.472	3.490	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccnc(OC(C)C)c2)[C@H]1CC	ZINC001087792415	1359648588	/nfs/dbraw/zinc/64/85/88/1359648588.db2.gz	DCMHGGVJDFWKOJ-DLBZAZTESA-N	0	3	331.460	3.028	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc(COC(C)C)cc2)[C@H]1CC	ZINC001087823905	1359666174	/nfs/dbraw/zinc/66/61/74/1359666174.db2.gz	XJCSYSPBMVEOSW-RBUKOAKNSA-N	0	3	330.472	3.380	20	30		EGEDHN
C[C@H](C#N)C(=O)N1C[C@H]2CCN(Cc3cccc(C(F)F)c3)C[C@H]2C1	ZINC001087912046	1359705149	/nfs/dbraw/zinc/70/51/49/1359705149.db2.gz	VMKVCBSDNTWHPM-XYPHTWIQSA-N	0	3	347.409	3.064	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CCN(Cc3cnc(C)s3)C[C@H]2C1	ZINC001088064351	1359739785	/nfs/dbraw/zinc/73/97/85/1359739785.db2.gz	AEJQAWASYSCEMU-CVEARBPZSA-N	0	3	347.528	3.334	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)[C@@H](C)CC3CCCCC3)C[C@@H]2C1	ZINC001088126872	1359766547	/nfs/dbraw/zinc/76/65/47/1359766547.db2.gz	AWBQQOGRYPXUFR-SXLOBPIMSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)CC3CCC(C)(C)CC3)C[C@@H]2C1	ZINC001088223640	1359802590	/nfs/dbraw/zinc/80/25/90/1359802590.db2.gz	NVVRNJZZKXCYEQ-MOPGFXCFSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC[C@H](F)C(=O)N1CCCCC[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001088360533	1359844495	/nfs/dbraw/zinc/84/44/95/1359844495.db2.gz	APSKMOJPDDDPBN-IRXDYDNUSA-N	0	3	349.425	3.306	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N1CCCCC[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001088363453	1359846142	/nfs/dbraw/zinc/84/61/42/1359846142.db2.gz	PUKGMYIUVHLURF-QGTPRVQTSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2cccc(OC)c2)C1	ZINC001088418469	1359888846	/nfs/dbraw/zinc/88/88/46/1359888846.db2.gz	PSUOTOVIZZMGOS-INIZCTEOSA-N	0	3	336.863	3.422	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)Cc2csc(C)n2)C1	ZINC001088422444	1359892033	/nfs/dbraw/zinc/89/20/33/1359892033.db2.gz	QDTQIGQTYJTSOD-CQSZACIVSA-N	0	3	341.908	3.107	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2sccc2-n2cccc2)[C@H]1C	ZINC001088782907	1360042371	/nfs/dbraw/zinc/04/23/71/1360042371.db2.gz	RGTBMJSUYBCBFG-CABCVRRESA-N	0	3	329.469	3.308	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)C(C)(C)c2ccc(CC)cc2)[C@H]1C	ZINC001088967537	1360118917	/nfs/dbraw/zinc/11/89/17/1360118917.db2.gz	LSIGGMWIJJKWNL-APWZRJJASA-N	0	3	326.484	3.129	20	30		EGEDHN
C=CCCN1CC[C@H](NC(=O)c2cnc(-c3ccco3)s2)[C@H]1C	ZINC001088994850	1360128762	/nfs/dbraw/zinc/12/87/62/1360128762.db2.gz	LNJBDTJSKNUDEZ-OLZOCXBDSA-N	0	3	331.441	3.172	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cccc(OCC(C)C)c2)[C@H]1C	ZINC001089029245	1360143000	/nfs/dbraw/zinc/14/30/00/1360143000.db2.gz	ORXXPNLMTHTOLC-APWZRJJASA-N	0	3	330.472	3.490	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCCC[C@H]1CN(C)Cc1cccc(C#N)c1	ZINC001089122873	1360186221	/nfs/dbraw/zinc/18/62/21/1360186221.db2.gz	FUXGIZHWODPTLG-LPHOPBHVSA-N	0	3	327.472	3.417	20	30		EGEDHN
CC1(C)C[C@H](NC(=O)C2CCC2)CCN(CC#Cc2ccccc2)C1	ZINC001089293453	1360310360	/nfs/dbraw/zinc/31/03/60/1360310360.db2.gz	PNQBOJGXJQOZDQ-HXUWFJFHSA-N	0	3	338.495	3.445	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc3nccc(C)c3c2)CC(C)(C)C1	ZINC001089395907	1360395415	/nfs/dbraw/zinc/39/54/15/1360395415.db2.gz	BUDCTTGYJWBRFZ-GOSISDBHSA-N	0	3	349.478	3.397	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccnc3ccccc32)CC(C)(C)C1	ZINC001089435194	1360425921	/nfs/dbraw/zinc/42/59/21/1360425921.db2.gz	FLMMCRZMCQOAFD-INIZCTEOSA-N	0	3	335.451	3.088	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccccc2CCC)CC(C)(C)C1	ZINC001089434965	1360425990	/nfs/dbraw/zinc/42/59/90/1360425990.db2.gz	AKGPNTDWXZURLM-GOSISDBHSA-N	0	3	326.484	3.493	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc3cc(C)ccc3[nH]2)CC(C)(C)C1	ZINC001089456737	1360443723	/nfs/dbraw/zinc/44/37/23/1360443723.db2.gz	LZEMRCMBCMKXBH-QGZVFWFLSA-N	0	3	337.467	3.330	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2c(C)cc(C)cc2C)CC(C)(C)C1	ZINC001089482989	1360464144	/nfs/dbraw/zinc/46/41/44/1360464144.db2.gz	DPIQULJRBGUOIC-LJQANCHMSA-N	0	3	340.511	3.394	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3conc3C)CC(C)(C)C2)C1	ZINC001089485948	1360465922	/nfs/dbraw/zinc/46/59/22/1360465922.db2.gz	RIUHACBLLXURCC-QGZVFWFLSA-N	0	3	345.487	3.446	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@@H](C)c2cc(C)oc2C)CC(C)(C)C1	ZINC001089519930	1360487985	/nfs/dbraw/zinc/48/79/85/1360487985.db2.gz	PODDWKYXRKRFBD-DOTOQJQBSA-N	0	3	330.472	3.240	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C[C@@H]2CCc3ccccc32)CC(C)(C)C1	ZINC001089523767	1360489372	/nfs/dbraw/zinc/48/93/72/1360489372.db2.gz	HBNGJWIRNBHUQL-RBUKOAKNSA-N	0	3	338.495	3.347	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cccc3ccncc32)CC(C)(C)C1	ZINC001089530606	1360492475	/nfs/dbraw/zinc/49/24/75/1360492475.db2.gz	DHGGKAGJGSRSKY-QGZVFWFLSA-N	0	3	335.451	3.088	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ncsc2C(C)C)CC(C)(C)C1	ZINC001089541329	1360498330	/nfs/dbraw/zinc/49/83/30/1360498330.db2.gz	IRPFBZKISLUZJT-AWEZNQCLSA-N	0	3	333.501	3.120	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc3[nH]ccc3s2)CC(C)(C)C1	ZINC001089549400	1360502742	/nfs/dbraw/zinc/50/27/42/1360502742.db2.gz	XVMZXSRURUHFMG-CYBMUJFWSA-N	0	3	329.469	3.083	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@@]2(C)CCc3ccccc32)CC(C)(C)C1	ZINC001089565248	1360512044	/nfs/dbraw/zinc/51/20/44/1360512044.db2.gz	QHKJGTJFVLQTND-AVRDEDQJSA-N	0	3	338.495	3.131	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cccc(CC)n1	ZINC001089652107	1360565387	/nfs/dbraw/zinc/56/53/87/1360565387.db2.gz	WVRUWWJOUUPYKD-QGZVFWFLSA-N	0	3	329.488	3.441	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1c(C)noc1C1CC1	ZINC001089671859	1360582331	/nfs/dbraw/zinc/58/23/31/1360582331.db2.gz	XIDYERKUSGTBPL-INIZCTEOSA-N	0	3	343.471	3.104	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1occ2c1CCC2	ZINC001089676159	1360584042	/nfs/dbraw/zinc/58/40/42/1360584042.db2.gz	BEYNLPUTWWCWGH-INIZCTEOSA-N	0	3	328.456	3.012	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc2cc[nH]c2c1	ZINC001089706414	1360609472	/nfs/dbraw/zinc/60/94/72/1360609472.db2.gz	TWEVEGIBCNOYPI-SFHVURJKSA-N	0	3	337.467	3.412	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(F)cc1C	ZINC001089723915	1360627000	/nfs/dbraw/zinc/62/70/00/1360627000.db2.gz	QBGLKANBLMRNRL-QGZVFWFLSA-N	0	3	330.447	3.378	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1cccc(F)c1	ZINC001089764830	1360655360	/nfs/dbraw/zinc/65/53/60/1360655360.db2.gz	UTHPZSODXLPKFJ-HPBDAGMYSA-N	0	3	348.849	3.361	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)c2ccoc2C)C1	ZINC001089771301	1360657835	/nfs/dbraw/zinc/65/78/35/1360657835.db2.gz	YKJVAHSFYSRKLR-HJWJTTGWSA-N	0	3	334.847	3.123	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C2CCCCC2)CC2(CCOCC2)C1	ZINC001089921513	1360745839	/nfs/dbraw/zinc/74/58/39/1360745839.db2.gz	BRCOTMOBSNKWAF-SFHVURJKSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001184496396	1387471933	/nfs/dbraw/zinc/47/19/33/1387471933.db2.gz	CBNYMHUZSDNGIT-IEBWSBKVSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)C2CC(C(C)(C)C)C2)CC2(CCOCC2)C1	ZINC001089969344	1360772947	/nfs/dbraw/zinc/77/29/47/1360772947.db2.gz	JEJLHTRNCQHLHH-ABHNRTSZSA-N	0	3	348.531	3.232	20	30		EGEDHN
CC[C@@H](C)CC(=O)N1CC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001323848544	1387474550	/nfs/dbraw/zinc/47/45/50/1387474550.db2.gz	SQCKMCRSQTYEEB-DYESRHJHSA-N	0	3	339.483	3.419	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc3c(c2)C=CCC3)C1	ZINC001091278590	1361030262	/nfs/dbraw/zinc/03/02/62/1361030262.db2.gz	SUCVIWGNCZRBHF-UHFFFAOYSA-N	0	3	330.859	3.497	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc(CC)c(C)s2)C1	ZINC001091357093	1361059342	/nfs/dbraw/zinc/05/93/42/1361059342.db2.gz	DALRPXWVERBAHV-UHFFFAOYSA-N	0	3	326.893	3.469	20	30		EGEDHN
C[C@@]12CN(Cc3ccc(C#N)cc3)C[C@@H]1CN(C(=O)C[C@@H]1C=CCC1)C2	ZINC001091466034	1361108259	/nfs/dbraw/zinc/10/82/59/1361108259.db2.gz	ZJFFBZGBUJLFEJ-ZNLUXHQJSA-N	0	3	349.478	3.195	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cn(CC)c4ccccc34)C[C@]2(C)C1	ZINC001091833851	1361232298	/nfs/dbraw/zinc/23/22/98/1361232298.db2.gz	FHQIJQHTTXPZKW-VGSWGCGISA-N	0	3	349.478	3.078	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CN(Cc3sc(C)nc3C)C[C@@]2(C)C1	ZINC001091916905	1361247491	/nfs/dbraw/zinc/24/74/91/1361247491.db2.gz	PXMZMGVJOXNCJG-BEFAXECRSA-N	0	3	347.528	3.252	20	30		EGEDHN
CCC1(C(=O)N2C[C@H]3CN(Cc4ccc(C#N)cc4)C[C@@]3(C)C2)CC1	ZINC001091982499	1361266379	/nfs/dbraw/zinc/26/63/79/1361266379.db2.gz	IUHOOIKRWNHQEX-QUCCMNQESA-N	0	3	337.467	3.029	20	30		EGEDHN
C[C@@]12CN(Cc3cccc(C#N)c3)C[C@@H]1CN(C(=O)[C@@H]1CC13CCC3)C2	ZINC001092054126	1361283757	/nfs/dbraw/zinc/28/37/57/1361283757.db2.gz	LIGPQPZODPAMAW-DYXWJJEUSA-N	0	3	349.478	3.029	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc4[nH]c(C)c(C)c4c3)C[C@]2(C)C1	ZINC001092267249	1361350085	/nfs/dbraw/zinc/35/00/85/1361350085.db2.gz	PTDDPSCTNCXHRY-GCJKJVERSA-N	0	3	349.478	3.202	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)c2sccc2C)CC1	ZINC001093353054	1361567404	/nfs/dbraw/zinc/56/74/04/1361567404.db2.gz	PXETUWXBWPNHNR-GOSISDBHSA-N	0	3	342.508	3.396	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)c2cc(Cl)c[nH]2)CC1	ZINC001093353849	1361568197	/nfs/dbraw/zinc/56/81/97/1361568197.db2.gz	COMHBRFIIDMEFU-KRWDZBQOSA-N	0	3	345.874	3.008	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C(C)(C)C(C)C)CC1	ZINC001093371537	1361581395	/nfs/dbraw/zinc/58/13/95/1361581395.db2.gz	SUOIWNRRKZWUCD-GOSISDBHSA-N	0	3	330.516	3.395	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)[C@H](C)C(C)(F)F)CC1	ZINC001093380075	1361590619	/nfs/dbraw/zinc/59/06/19/1361590619.db2.gz	QAOITFDBNSOAKE-GOEBONIOSA-N	0	3	338.442	3.004	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@H]2CC23CCCC3)CC1	ZINC001093381100	1361592354	/nfs/dbraw/zinc/59/23/54/1361592354.db2.gz	GRDISHHYJBPRSQ-MOPGFXCFSA-N	0	3	340.511	3.293	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H](CNCc2nc(C)cs2)[C@H](C)C1	ZINC001094015926	1361724142	/nfs/dbraw/zinc/72/41/42/1361724142.db2.gz	MJMPCBJPCVNISN-DDUZABMNSA-N	0	3	335.517	3.238	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cc4cccc(F)c4o3)CCC[C@@H]12	ZINC001094583738	1361870264	/nfs/dbraw/zinc/87/02/64/1361870264.db2.gz	YWLSOTQSNJXJID-YLJYHZDGSA-N	0	3	340.398	3.180	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1c(C)onc1C1CC1)C2	ZINC001095773825	1362225285	/nfs/dbraw/zinc/22/52/85/1362225285.db2.gz	BQUWLBVFYAWTFI-PMPSAXMXSA-N	0	3	329.444	3.162	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cn1cc(C)c3ccccc31)C2	ZINC001096149844	1362407027	/nfs/dbraw/zinc/40/70/27/1362407027.db2.gz	GDMPXBWXGBMVCU-KPFFTGBYSA-N	0	3	337.467	3.247	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](C)c1ccc(Cl)s1)C2	ZINC001096303846	1362457134	/nfs/dbraw/zinc/45/71/34/1362457134.db2.gz	NJPCAGYRJPSYOS-CRWXNKLISA-N	0	3	336.888	3.250	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc3cccc(F)c3o1)C2	ZINC001096580981	1362586224	/nfs/dbraw/zinc/58/62/24/1362586224.db2.gz	YZSIFJMYXKCQLZ-KBMXLJTQSA-N	0	3	328.387	3.483	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](NCc2ccc(C(C)C)nc2C)C1	ZINC001185020020	1387590183	/nfs/dbraw/zinc/59/01/83/1387590183.db2.gz	ONKXOOUHSGEQMG-LJQANCHMSA-N	0	3	341.499	3.398	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001324336593	1387597313	/nfs/dbraw/zinc/59/73/13/1387597313.db2.gz	ZRFZJXYHLCOTFJ-MRXNPFEDSA-N	0	3	327.472	3.321	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H]1CC=CC[C@H]1C(F)(F)F)C2	ZINC001097336933	1362939523	/nfs/dbraw/zinc/93/95/23/1362939523.db2.gz	VGVIWUQDKRZCGE-QCODTGAPSA-N	0	3	342.405	3.429	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](C)c1c(F)cccc1F)C2	ZINC001097549825	1363054059	/nfs/dbraw/zinc/05/40/59/1363054059.db2.gz	DUABMLACDFFVFJ-KFZJALRRSA-N	0	3	334.410	3.366	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](CNCc3cc(C)no3)[C@@H](C)C2)CCC1	ZINC001185095464	1387617479	/nfs/dbraw/zinc/61/74/79/1387617479.db2.gz	PVBLIIRQUQVJFS-DOTOQJQBSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@@H]1CCc3ccccc3C1)C2	ZINC001098280146	1363283618	/nfs/dbraw/zinc/28/36/18/1363283618.db2.gz	JFRFHNXECAWFMH-OTNPHJDUSA-N	0	3	338.495	3.479	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)CCC1CCCC1)C[C@@H](C)O2	ZINC001098559515	1363376491	/nfs/dbraw/zinc/37/64/91/1363376491.db2.gz	IVMCRCXIWTVDDO-QGZVFWFLSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H]1CCC(C)=C(C)C1)C[C@H](C)O2	ZINC001098600316	1363394155	/nfs/dbraw/zinc/39/41/55/1363394155.db2.gz	YTBKSKAEIGSWDD-RBUKOAKNSA-N	0	3	346.515	3.391	20	30		EGEDHN
CCCCCCCNCc1cn([C@@H]2CCN(C(=O)CC(C)C)C2)nn1	ZINC001098601407	1363394220	/nfs/dbraw/zinc/39/42/20/1363394220.db2.gz	PKWVLFMYOGKERP-GOSISDBHSA-N	0	3	349.523	3.158	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1cccc(F)c1C)C[C@@H](C)O2	ZINC001098602675	1363394963	/nfs/dbraw/zinc/39/49/63/1363394963.db2.gz	CWFQSCKLDOLAGI-OAHLLOKOSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H]1CCC=CCCC1)C[C@H](C)O2	ZINC001098606358	1363396489	/nfs/dbraw/zinc/39/64/89/1363396489.db2.gz	QOHSUBJMSLRZFL-RBUKOAKNSA-N	0	3	346.515	3.391	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1c(C)oc(C)c1C)C[C@@H](C)O2	ZINC001098614521	1363399677	/nfs/dbraw/zinc/39/96/77/1363399677.db2.gz	RNYSVDBCPNUVDH-CQSZACIVSA-N	0	3	346.471	3.086	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H]1CCC(C)(C)C1)C[C@@H](C)O2	ZINC001098635916	1363409728	/nfs/dbraw/zinc/40/97/28/1363409728.db2.gz	UZKFGLIYPLESID-IAGOWNOFSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H](C)CC1CCCC1)C[C@@H](C)O2	ZINC001098642911	1363413040	/nfs/dbraw/zinc/41/30/40/1363413040.db2.gz	PAGATGNKEFGFJM-QZTJIDSGSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C13CCC(CC1)CC3)C[C@H](C)O2	ZINC001098659019	1363422844	/nfs/dbraw/zinc/42/28/44/1363422844.db2.gz	IBPMKAXCQYEYAK-ZJRDLVKKSA-N	0	3	346.515	3.225	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3CCC[C@]3(NC(=O)C3=CCCC3)C2)cc1	ZINC001098790238	1363469154	/nfs/dbraw/zinc/46/91/54/1363469154.db2.gz	UUMJSUDAHMLRDU-FPOVZHCZSA-N	0	3	335.451	3.139	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccccc1F	ZINC001098849037	1363491126	/nfs/dbraw/zinc/49/11/26/1363491126.db2.gz	IQZMBDYOGNRFKN-MRXNPFEDSA-N	0	3	348.462	3.249	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2F)C1	ZINC001098957519	1363540464	/nfs/dbraw/zinc/54/04/64/1363540464.db2.gz	YLIULLXUXFVSCP-NYYTWLDWSA-N	0	3	346.421	3.225	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2cc3ncccc3s2)C1	ZINC001098972766	1363548163	/nfs/dbraw/zinc/54/81/63/1363548163.db2.gz	QXZVYXJAZWPQNB-LIRRHRJNSA-N	0	3	341.480	3.457	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(C#N)cc1)C2	ZINC001099039431	1363588618	/nfs/dbraw/zinc/58/86/18/1363588618.db2.gz	YPGUQWMVOZAFQZ-HDAAZOAOSA-N	0	3	337.467	3.075	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccn(C(CC)CC)n2)C1	ZINC001099060807	1363601236	/nfs/dbraw/zinc/60/12/36/1363601236.db2.gz	FISKKAAWUPRNKL-KXBFYZLASA-N	0	3	330.476	3.015	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@@H]1CCC(C)(C)CN1C[C@@H]1CC(C)(C)CO1	ZINC001099065106	1363604497	/nfs/dbraw/zinc/60/44/97/1363604497.db2.gz	MPLOREIFWZCMAO-ROUUACIJSA-N	0	3	348.531	3.068	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)C1(COC)CCCCC1	ZINC001099102444	1363623501	/nfs/dbraw/zinc/62/35/01/1363623501.db2.gz	MCFPLTKPENMKAJ-GOSISDBHSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccnc(O[C@H](C)CC)c2)C1	ZINC001099112328	1363629884	/nfs/dbraw/zinc/62/98/84/1363629884.db2.gz	KZZQQTIEPBOPTA-SYNHAJSKSA-N	0	3	343.471	3.029	20	30		EGEDHN
C#CCN1C[C@@H]2CCC[C@]2(NC(=O)C[C@H]2CCCc3ccccc32)C1	ZINC001099131464	1363643660	/nfs/dbraw/zinc/64/36/60/1363643660.db2.gz	ZPIBMVDZAVPZSJ-DXIQSLLYSA-N	0	3	336.479	3.101	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(C(F)(F)F)cc2)C1	ZINC001099134087	1363645404	/nfs/dbraw/zinc/64/54/04/1363645404.db2.gz	WVYPYMFUBCJXJU-RDJZCZTQSA-N	0	3	338.373	3.476	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc3ncsc3c2)C1	ZINC001099147652	1363655134	/nfs/dbraw/zinc/65/51/34/1363655134.db2.gz	MRLZQWSCJZLRQC-KSSFIOAISA-N	0	3	327.453	3.067	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)Cc1ccn(C(C)C)n1	ZINC001099149172	1363656364	/nfs/dbraw/zinc/65/63/64/1363656364.db2.gz	PTKSXUGIWBOXHU-GOSISDBHSA-N	0	3	346.519	3.189	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(OC)c(Cl)c2)C1	ZINC001099153315	1363659715	/nfs/dbraw/zinc/65/97/15/1363659715.db2.gz	GGRBXXPQSYUSRU-KSSFIOAISA-N	0	3	334.847	3.119	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)C(C)(C)C(=C)C	ZINC001099170603	1363668355	/nfs/dbraw/zinc/66/83/55/1363668355.db2.gz	JFHMWLOFNPQXNR-KRWDZBQOSA-N	0	3	336.520	3.398	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)Cc2c(C)oc3ccccc32)C1	ZINC001099190091	1363683414	/nfs/dbraw/zinc/68/34/14/1363683414.db2.gz	AWLJGWGYTGTIOR-KKSFZXQISA-N	0	3	338.451	3.440	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)C(C)(C)C(F)F	ZINC001099228787	1363701823	/nfs/dbraw/zinc/70/18/23/1363701823.db2.gz	AHLCLHQSFWWSBZ-AWEZNQCLSA-N	0	3	346.462	3.087	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H](F)c1ccccc1	ZINC001099245012	1363711135	/nfs/dbraw/zinc/71/11/35/1363711135.db2.gz	GIRQXPKSNFFOMI-ROUUACIJSA-N	0	3	330.447	3.327	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@H](C)c2cccc(C)c2)C[C@H]1C(F)(F)F	ZINC001099313106	1363744852	/nfs/dbraw/zinc/74/48/52/1363744852.db2.gz	RDTCSNSJJYXXNU-FVQBIDKESA-N	0	3	340.389	3.263	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@@H](F)c2ccccc2)C[C@H]1C(F)(F)F	ZINC001099312788	1363744998	/nfs/dbraw/zinc/74/49/98/1363744998.db2.gz	HHXPSUQFFIBHLJ-KFWWJZLASA-N	0	3	344.352	3.252	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)C2(F)CCCCC2)C[C@H]1C(F)(F)F	ZINC001099329354	1363753549	/nfs/dbraw/zinc/75/35/49/1363753549.db2.gz	RVSPGIJKUNEELU-CHWSQXEVSA-N	0	3	336.373	3.214	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@@H]2CC23CCCC3)C[C@H]1C(F)(F)F	ZINC001099330288	1363753648	/nfs/dbraw/zinc/75/36/48/1363753648.db2.gz	KKUHRSQZWTYLCR-BFHYXJOUSA-N	0	3	330.394	3.122	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2cc(C)ccc2C)C[C@H]1C(F)(F)F	ZINC001099337490	1363757672	/nfs/dbraw/zinc/75/76/72/1363757672.db2.gz	ZCOSFVAZXCNIAR-HUUCEWRRSA-N	0	3	326.362	3.082	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@H](C=C)c2ccccc2)C[C@H]1C(F)(F)F	ZINC001099345895	1363763371	/nfs/dbraw/zinc/76/33/71/1363763371.db2.gz	AASPXYCQSRXSHR-BZUAXINKSA-N	0	3	338.373	3.121	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)C2(C)C(C)(C)C2(C)C)C[C@H]1C(F)(F)F	ZINC001099348625	1363764721	/nfs/dbraw/zinc/76/47/21/1363764721.db2.gz	KPNPYNLABHRXTF-VXGBXAGGSA-N	0	3	332.410	3.224	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NC[C@@H]1CCC(C)(C)CN1Cc1ccccc1	ZINC001099365189	1363775459	/nfs/dbraw/zinc/77/54/59/1363775459.db2.gz	WYQYZXGTFRWXJJ-MJGOQNOKSA-N	0	3	344.499	3.385	20	30		EGEDHN
N#Cc1ccccc1CNC[C@]12CCC[C@H]1CN(C(=O)/C=C\C1CC1)C2	ZINC001099400791	1363787086	/nfs/dbraw/zinc/78/70/86/1363787086.db2.gz	FUORJEOLNLVSCY-TULNTWPASA-N	0	3	349.478	3.243	20	30		EGEDHN
N#Cc1ccccc1CNC[C@]12CCC[C@H]1CN(C(=O)C1CC=CC1)C2	ZINC001099403355	1363787744	/nfs/dbraw/zinc/78/77/44/1363787744.db2.gz	ZTNBWBPWIUXTTO-UNMCSNQZSA-N	0	3	349.478	3.243	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2nccs2)C1	ZINC001099475982	1363811609	/nfs/dbraw/zinc/81/16/09/1363811609.db2.gz	WBBVYTXCNCTVKU-KSSFIOAISA-N	0	3	333.501	3.074	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)[C@H](CC)CCCC)CC2(CCOCC2)C1	ZINC001099566524	1363852585	/nfs/dbraw/zinc/85/25/85/1363852585.db2.gz	QVTICPDCHWNHKM-QZTJIDSGSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1CN(CC=C(C)C)CC2(CCOCC2)C1	ZINC001099583379	1363864151	/nfs/dbraw/zinc/86/41/51/1363864151.db2.gz	PVNVCKRXNRPRRY-GOSISDBHSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C(C)(C)CCC)CC2(CCOCC2)C1	ZINC001099591136	1363873577	/nfs/dbraw/zinc/87/35/77/1363873577.db2.gz	UCPKWHAOHGIBPJ-QGZVFWFLSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CCN(Cc2ccc(CCC)cc2)C[C@H]1O	ZINC001099977351	1363995452	/nfs/dbraw/zinc/99/54/52/1363995452.db2.gz	XMBQTOHQJKRZPA-WOJBJXKFSA-N	0	3	344.499	3.047	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](c2ccc(OC)cc2)[C@H](NC[C@H](F)CC)C1	ZINC001100154699	1364029143	/nfs/dbraw/zinc/02/91/43/1364029143.db2.gz	ARTATOBGXOOSPZ-NZSAHSFTSA-N	0	3	348.462	3.294	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@H](C)CCC)C[C@H]1c1ccc(OC)cc1	ZINC001100156248	1364029556	/nfs/dbraw/zinc/02/95/56/1364029556.db2.gz	WQNLZPXQWKRYSU-LSTHTHJFSA-N	0	3	342.483	3.039	20	30		EGEDHN
O=C(NCC1CC(NCC#Cc2ccc(Cl)cc2)C1)C1=CCCC1	ZINC001100239050	1364054301	/nfs/dbraw/zinc/05/43/01/1364054301.db2.gz	CTLQINVMMKCRHS-UHFFFAOYSA-N	0	3	342.870	3.286	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NCC1CC(NCC=C(Cl)Cl)C1)OCC	ZINC001100376455	1364095737	/nfs/dbraw/zinc/09/57/37/1364095737.db2.gz	IWTXUOUXVLELNA-JXQTWKCFSA-N	0	3	349.302	3.161	20	30		EGEDHN
O=C(C[C@@H]1C=CCCC1)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100440433	1364115435	/nfs/dbraw/zinc/11/54/35/1364115435.db2.gz	VTMFGEIIEBGNDN-QNGMFEMESA-N	0	3	336.479	3.269	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCC1CC(NCc2c(C)noc2CC)C1	ZINC001100594621	1364179586	/nfs/dbraw/zinc/17/95/86/1364179586.db2.gz	BWTNQCZBVUGVHC-IUDNXUCKSA-N	0	3	333.476	3.132	20	30		EGEDHN
C=CCCC1(C(=O)NCC2CC(N[C@@H](C)c3cnc(C)cn3)C2)CC1	ZINC001100642837	1364200967	/nfs/dbraw/zinc/20/09/67/1364200967.db2.gz	QCLFEQWAPZUWOH-GTPINHCMSA-N	0	3	342.487	3.077	20	30		EGEDHN
CC(C)CCCC(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100699512	1364223562	/nfs/dbraw/zinc/22/35/62/1364223562.db2.gz	SSZQJVSLAMWJPF-UHFFFAOYSA-N	0	3	344.474	3.488	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@H](C)Cc2ccccc2C)C1	ZINC001101049305	1364391507	/nfs/dbraw/zinc/39/15/07/1364391507.db2.gz	HFMVFXLIUWBFPR-MXWWQKGMSA-N	0	3	334.891	3.411	20	30		EGEDHN
C=CCN1CC[C@H](Oc2ccnc(CNC(=O)[C@@H](CC)CCC)c2)C1	ZINC001101097514	1364413703	/nfs/dbraw/zinc/41/37/03/1364413703.db2.gz	UQGMCGZKLSBGFW-LPHOPBHVSA-N	0	3	345.487	3.163	20	30		EGEDHN
Cc1ccc(F)c(CN2C[C@@H]3CN(C(=O)C#CC(C)C)C[C@]3(C)C2)c1	ZINC001101229647	1364475958	/nfs/dbraw/zinc/47/59/58/1364475958.db2.gz	IBCPUNTVEQKEEK-NQIIRXRSSA-N	0	3	342.458	3.074	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1C[C@H]2CN(Cc3ccsc3)C[C@@]2(C)C1	ZINC001101232169	1364477481	/nfs/dbraw/zinc/47/74/81/1364477481.db2.gz	KQBDNEPAPKQABY-APWZRJJASA-N	0	3	330.497	3.078	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@H]2CN(Cc3cccc(F)c3)C[C@@]2(C)C1	ZINC001101253322	1364487236	/nfs/dbraw/zinc/48/72/36/1364487236.db2.gz	JVVWFNPXIIWFHE-XLIONFOSSA-N	0	3	330.447	3.462	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@H]2CN(Cc3cnccc3C)C[C@@]2(C)C1	ZINC001101333550	1364513245	/nfs/dbraw/zinc/51/32/45/1364513245.db2.gz	ZWQRQFQIWFTVCZ-QFUCXCTJSA-N	0	3	341.499	3.273	20	30		EGEDHN
C=CCCCC(=O)N1C[C@H]2CN(Cc3sc(C)nc3C)C[C@@]2(C)C1	ZINC001101346872	1364520193	/nfs/dbraw/zinc/52/01/93/1364520193.db2.gz	LFLOJLQCOONKCG-APWZRJJASA-N	0	3	347.528	3.397	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)C[C@H](C)CCc3ccccc3)C[C@]2(C)C1	ZINC001101482528	1364578216	/nfs/dbraw/zinc/57/82/16/1364578216.db2.gz	GMNZKQFSPKSVGZ-UZKOGDIHSA-N	0	3	338.495	3.059	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)[C@@H](CCC=C)c3ccccc3)C[C@]2(C)C1	ZINC001101494078	1364581327	/nfs/dbraw/zinc/58/13/27/1364581327.db2.gz	ZWWPPYWOHTVEML-URVUXULASA-N	0	3	336.479	3.150	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1CC2(CN(CCC(C)(C)C)C2)n2ccnc21	ZINC001101631460	1364662247	/nfs/dbraw/zinc/66/22/47/1364662247.db2.gz	VTOMPHFLHRHGME-INIZCTEOSA-N	0	3	344.503	3.248	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CC2(CN([C@H](C)CCC=C)C2)n2ccnc21	ZINC001101641053	1364666226	/nfs/dbraw/zinc/66/62/26/1364666226.db2.gz	IINUMTNAGZRRAB-IAGOWNOFSA-N	0	3	342.487	3.166	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H]1CN(Cc2c(C)nsc2C)C[C@H]1C	ZINC001102011668	1364811664	/nfs/dbraw/zinc/81/16/64/1364811664.db2.gz	LBDGEUQDVJYWNV-CZUORRHYSA-N	0	3	335.517	3.300	20	30		EGEDHN
CCCCCCCCOCC(=O)NC[C@@H]1CN(CCF)C[C@H]1C	ZINC001102050690	1364823347	/nfs/dbraw/zinc/82/33/47/1364823347.db2.gz	CVYTYKQIHQCDMR-IAGOWNOFSA-N	0	3	330.488	3.017	20	30		EGEDHN
CCCCC1(C(=O)N2CC[C@@H](NCc3ccc(C#N)c(F)c3)C2)CC1	ZINC001185423980	1387711658	/nfs/dbraw/zinc/71/16/58/1387711658.db2.gz	FKMBUSYZJXQWMP-QGZVFWFLSA-N	0	3	343.446	3.358	20	30		EGEDHN
CCC(C)(C)C(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C	ZINC001102299080	1364990180	/nfs/dbraw/zinc/99/01/80/1364990180.db2.gz	KSEJTVCFXYKGSY-IEBWSBKVSA-N	0	3	326.484	3.158	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H]2CN(Cc3cnc(C)s3)C[C@H]2C)CCC1	ZINC001102330304	1365005515	/nfs/dbraw/zinc/00/55/15/1365005515.db2.gz	OBQRJQWQEFWJEI-GDBMZVCRSA-N	0	3	347.528	3.382	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1CNC(=O)C(C)(C)C(F)F	ZINC001102351327	1365016517	/nfs/dbraw/zinc/01/65/17/1365016517.db2.gz	ZQJXSITXZGYAQS-NVXWUHKLSA-N	0	3	348.437	3.014	20	30		EGEDHN
C[C@H](C(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C)C(C)(F)F	ZINC001102382312	1365032927	/nfs/dbraw/zinc/03/29/27/1365032927.db2.gz	XWVDNBGIRRZXDA-JFIYKMOQSA-N	0	3	348.437	3.014	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](NCc3ccc(F)c(C#N)c3)C2)CC1	ZINC001185439179	1387717552	/nfs/dbraw/zinc/71/75/52/1387717552.db2.gz	OAKPJURQPNQCSA-QGZVFWFLSA-N	0	3	341.430	3.134	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CNC(=O)CCC1(C)CC1	ZINC001102494566	1365085911	/nfs/dbraw/zinc/08/59/11/1365085911.db2.gz	FBZGXIHIWZFBKK-HUUCEWRRSA-N	0	3	345.512	3.384	20	30		EGEDHN
C=C(C)CCC(=O)NCC[C@@H]1CN(Cc2cccc(OC)n2)C[C@H]1C	ZINC001103040469	1365351287	/nfs/dbraw/zinc/35/12/87/1365351287.db2.gz	YEGUFLAOBXLWBV-IAGOWNOFSA-N	0	3	345.487	3.021	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cc(F)ccc2F)C1	ZINC001103087715	1365373980	/nfs/dbraw/zinc/37/39/80/1365373980.db2.gz	LYBKNIVICNVETK-DGCLKSJQSA-N	0	3	342.817	3.405	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)C(C)(C)c2cccnc2)C1	ZINC001103169928	1365419580	/nfs/dbraw/zinc/41/95/80/1365419580.db2.gz	QUMBVQBCEIXORJ-GDBMZVCRSA-N	0	3	349.906	3.186	20	30		EGEDHN
C[C@@H]1CN(Cc2cc(C#N)ccc2F)C[C@H]1CCNC(=O)CCCF	ZINC001103324274	1365495767	/nfs/dbraw/zinc/49/57/67/1365495767.db2.gz	ULKZZMHYFYBNBU-GDBMZVCRSA-N	0	3	349.425	3.021	20	30		EGEDHN
C=C1CCC(C(=O)NCC[C@@H]2CN(Cc3cncs3)C[C@H]2C)CC1	ZINC001103402022	1365538017	/nfs/dbraw/zinc/53/80/17/1365538017.db2.gz	XRLSEPFRIUUOSN-NVXWUHKLSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)[C@@H]2C[C@H]2c2cccnc2)C1	ZINC001103458488	1365573455	/nfs/dbraw/zinc/57/34/55/1365573455.db2.gz	UYXQRIMSYQJHNZ-NKGKWGDASA-N	0	3	347.890	3.012	20	30		EGEDHN
C[C@@H]1CN(Cc2cc(C#N)ccc2F)C[C@H]1CCNC(=O)C(C)(C)C	ZINC001103667776	1365715549	/nfs/dbraw/zinc/71/55/49/1365715549.db2.gz	OPGKSEXRERVEEU-GDBMZVCRSA-N	0	3	345.462	3.318	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)CCc2ccccc2)C1	ZINC001103669442	1365716840	/nfs/dbraw/zinc/71/68/40/1365716840.db2.gz	HVMJPNSCIVYQQN-CRAIPNDOSA-N	0	3	334.891	3.446	20	30		EGEDHN
C=CC[C@H](C(=O)NCC[C@@H]1CN(CCF)C[C@H]1C)c1ccccc1	ZINC001103743766	1365759507	/nfs/dbraw/zinc/75/95/07/1365759507.db2.gz	RJNZKVJMWZHCDG-QRQLOZEOSA-N	0	3	332.463	3.390	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2sccc2C)C[C@H]1C	ZINC001103827246	1365800358	/nfs/dbraw/zinc/80/03/58/1365800358.db2.gz	WNYFVZMRNBKWHJ-TZMCWYRMSA-N	0	3	326.893	3.497	20	30		EGEDHN
CC(C)=CC(=O)N1C[C@@H](C)[C@H](CCNCc2ccc(C#N)cc2F)C1	ZINC001103844566	1365810421	/nfs/dbraw/zinc/81/04/21/1365810421.db2.gz	OOINDSFWYLCXCD-CRAIPNDOSA-N	0	3	343.446	3.238	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2c(C)cncc2C)C[C@H]1C	ZINC001104412725	1366012863	/nfs/dbraw/zinc/01/28/63/1366012863.db2.gz	JTNIONJQIPFQGC-GDBMZVCRSA-N	0	3	335.879	3.139	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cc(C(C)C)on2)C[C@H]1C	ZINC001104461585	1366037163	/nfs/dbraw/zinc/03/71/63/1366037163.db2.gz	CYHXHMDPVARQHB-TZMCWYRMSA-N	0	3	339.867	3.238	20	30		EGEDHN
CC#CCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2conc2CC)C1	ZINC001104552828	1366072778	/nfs/dbraw/zinc/07/27/78/1366072778.db2.gz	PTOHKTCJLLYJRO-IAGOWNOFSA-N	0	3	345.487	3.005	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2ncc(C)s2)C1	ZINC001104606722	1366098756	/nfs/dbraw/zinc/09/87/56/1366098756.db2.gz	CBFJCMNIJRLRFS-GDBMZVCRSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)C[C@H](C)C(F)(F)F)C[C@H]1C	ZINC001104620306	1366104509	/nfs/dbraw/zinc/10/45/09/1366104509.db2.gz	FNUJNRZRIZBVRJ-NTZNESFSSA-N	0	3	340.817	3.402	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H](C)[C@H](CCNCc2conc2CC)C1	ZINC001104631421	1366110079	/nfs/dbraw/zinc/11/00/79/1366110079.db2.gz	MYJSVRHLGNZMSH-JXXFODFXSA-N	0	3	347.503	3.414	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](C)[C@H](CCNCc3ncc(C)s3)C2)C1	ZINC001104653407	1366119547	/nfs/dbraw/zinc/11/95/47/1366119547.db2.gz	WEUBCQDUUMRIII-GDBMZVCRSA-N	0	3	347.528	3.382	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccco2)C[C@H]1C	ZINC001104707256	1366138260	/nfs/dbraw/zinc/13/82/60/1366138260.db2.gz	FANDSEXESFWTFB-DTZQCDIJSA-N	0	3	336.863	3.210	20	30		EGEDHN
CCCCCCCNCc1cn(C2CN(C(=O)/C=C(\C)CC)C2)nn1	ZINC001105232990	1366381921	/nfs/dbraw/zinc/38/19/21/1366381921.db2.gz	CICPBYSXZXWDRC-LFIBNONCSA-N	0	3	347.507	3.078	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C/C=C(/C)C=C)CC1	ZINC001105394314	1366443440	/nfs/dbraw/zinc/44/34/40/1366443440.db2.gz	UIEDPIOPBDGRQW-JFLJCTNNSA-N	0	3	326.484	3.235	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)CCCC2CC2)CC1	ZINC001105394378	1366443520	/nfs/dbraw/zinc/44/35/20/1366443520.db2.gz	VUXAWMZCGQAGHN-HXUWFJFHSA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCC1(C(=O)N2C[C@@H](CNC/C(Cl)=C\Cl)[C@H](C)C2)CCC1	ZINC001106236142	1366631051	/nfs/dbraw/zinc/63/10/51/1366631051.db2.gz	BLQQTYBDASVQAK-RNRBBCFGSA-N	0	3	343.298	3.183	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H](n2cc(CNCCCCCC)nn2)C1	ZINC001185908525	1387826217	/nfs/dbraw/zinc/82/62/17/1387826217.db2.gz	YGULCXWOZYMSNE-SFHVURJKSA-N	0	3	347.507	3.078	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC[C@]12CCC[C@H]1N(C/C=C\Cl)CC2	ZINC001107318624	1366925544	/nfs/dbraw/zinc/92/55/44/1366925544.db2.gz	SFIFLZHNLUCGFA-GGNZZIJHSA-N	0	3	340.895	3.081	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)CCCCCC(C)C)[C@@H]2C1	ZINC001189351012	1366999235	/nfs/dbraw/zinc/99/92/35/1366999235.db2.gz	UEKLVWLDKJKQQA-RBUKOAKNSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCOCC(=O)N1CC[C@@H](N(C)C/C=C\c2ccc(Cl)cc2)C1	ZINC001189379628	1367007273	/nfs/dbraw/zinc/00/72/73/1367007273.db2.gz	LECDGLQBOMANJC-PYTPGESOSA-N	0	3	348.874	3.089	20	30		EGEDHN
C=CCOCCCC(=O)N1CC[C@@H](N(C)[C@H](C)c2ccc(F)cc2)C1	ZINC001189526858	1367044689	/nfs/dbraw/zinc/04/46/89/1367044689.db2.gz	KFIWIYQKCJCQPE-VQIMIIECSA-N	0	3	348.462	3.402	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCOCCC(C)C	ZINC001109339758	1367065347	/nfs/dbraw/zinc/06/53/47/1367065347.db2.gz	IOIPMWNEDZCEGV-SQNIBIBYSA-N	0	3	336.520	3.373	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1cccc(N(C)C)c1	ZINC001109350911	1367081837	/nfs/dbraw/zinc/08/18/37/1367081837.db2.gz	ITCUEJALENZLIV-AABGKKOBSA-N	0	3	341.499	3.330	20	30		EGEDHN
C=CCC[C@H](C)N1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1scnc1CC)C2	ZINC001109377078	1367094201	/nfs/dbraw/zinc/09/42/01/1367094201.db2.gz	JKECTECFRDBFNF-XRGAULLZSA-N	0	3	333.501	3.395	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](C)CCc1ccc(F)cc1)C2	ZINC001109387471	1367098464	/nfs/dbraw/zinc/09/84/64/1367098464.db2.gz	OAGBIWKMMMNSPK-XCLNPWKQSA-N	0	3	342.458	3.139	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](N(C)C[C@@H](OC)c2ccccc2)C1	ZINC001189743715	1367100714	/nfs/dbraw/zinc/10/07/14/1367100714.db2.gz	IADVKZQJXCRQFP-VQTJNVASSA-N	0	3	342.483	3.100	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2ccccc2F)C1	ZINC001107701252	1367110421	/nfs/dbraw/zinc/11/04/21/1367110421.db2.gz	YWGKAAJRXDZRMH-DNVCBOLYSA-N	0	3	334.435	3.001	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCc1ncc(C(C)(C)C)o1)C2	ZINC001109414111	1367110701	/nfs/dbraw/zinc/11/07/01/1367110701.db2.gz	YUCGYDLEUOQVRP-PMPSAXMXSA-N	0	3	345.487	3.202	20	30		EGEDHN
CC[C@H](C)CC(=O)N1CC[C@H](N(C)Cc2ccc(OC)c(C#N)c2)C1	ZINC001189883868	1367123395	/nfs/dbraw/zinc/12/33/95/1367123395.db2.gz	ZHQFDZRNEOHRIF-YJBOKZPZSA-N	0	3	343.471	3.036	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](N(C)Cc2cccc(C(F)F)c2)C1	ZINC001189910546	1367129584	/nfs/dbraw/zinc/12/95/84/1367129584.db2.gz	QMVMQXUVLAKHAT-KRWDZBQOSA-N	0	3	334.410	3.460	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](N(C)[C@H]2CCc3c2cc(F)cc3F)C1	ZINC001189911277	1367130320	/nfs/dbraw/zinc/13/03/20/1367130320.db2.gz	ZUZIQKJBZQFHSK-BEFAXECRSA-N	0	3	346.421	3.288	20	30		EGEDHN
Cc1cc(F)ccc1CN(C)[C@H]1CCN(C(=O)C#CC(C)(C)C)C1	ZINC001190076138	1367166318	/nfs/dbraw/zinc/16/63/18/1367166318.db2.gz	KRSSZHQDAYDHHZ-SFHVURJKSA-N	0	3	330.447	3.216	20	30		EGEDHN
Cc1ccc(CN(C)[C@@H]2CCN(C(=O)C#CC(C)(C)C)C2)cc1F	ZINC001190083882	1367168845	/nfs/dbraw/zinc/16/88/45/1367168845.db2.gz	HGGOIZXBZPTLFC-QGZVFWFLSA-N	0	3	330.447	3.216	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)C2(CC(C)C)CC2)C1	ZINC001107989424	1367232069	/nfs/dbraw/zinc/23/20/69/1367232069.db2.gz	RTXPZRKOTYNXRU-PKOBYXMFSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)Nc1c(C)noc1-c1ccccc1	ZINC001190387058	1367247572	/nfs/dbraw/zinc/24/75/72/1367247572.db2.gz	QNRJLWSJZCVZOM-INIZCTEOSA-N	0	3	340.427	3.422	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](N(C)Cc2ccc(OC)cc2)C1	ZINC001190398285	1367253650	/nfs/dbraw/zinc/25/36/50/1367253650.db2.gz	UTKQSNUXHNAFGT-QGZVFWFLSA-N	0	3	330.472	3.330	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2ccc(C)c(F)c2)C1	ZINC001108058292	1367261182	/nfs/dbraw/zinc/26/11/82/1367261182.db2.gz	XVLOFXVJQPVQSE-UZLBHIALSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)C2(C3CC3)CCC2)C1	ZINC001108101922	1367282233	/nfs/dbraw/zinc/28/22/33/1367282233.db2.gz	VPMGNJRYKLWBRZ-QFBILLFUSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)CC2CC(C)(C)C2)C1	ZINC001108156760	1367314392	/nfs/dbraw/zinc/31/43/92/1367314392.db2.gz	JIQGPQNSUHXYGO-UZLBHIALSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCC1(C(=O)NC[C@]2(C)CN(C[C@H](C)CC)CCO2)CCCC1	ZINC001108444061	1367459336	/nfs/dbraw/zinc/45/93/36/1367459336.db2.gz	AEZHYIDSXNNVNW-IEBWSBKVSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@]2(C)CN(C[C@H](C)CC)CCO2)CCCC1	ZINC001108444062	1367459439	/nfs/dbraw/zinc/45/94/39/1367459439.db2.gz	AEZHYIDSXNNVNW-MJGOQNOKSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCOc1cc(C)ccc1C)C2	ZINC001110061266	1367488851	/nfs/dbraw/zinc/48/88/51/1367488851.db2.gz	HNXXRVSQSSBNLW-QYZOEREBSA-N	0	3	342.483	3.370	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3C[C@H](C)OC)CCCCC1	ZINC001110135419	1367517773	/nfs/dbraw/zinc/51/77/73/1367517773.db2.gz	BGEJJSVZPAPVLB-MHORFTMASA-N	0	3	334.504	3.269	20	30		EGEDHN
CC(C)=C(C)CC(=O)N1CC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001191764808	1367581459	/nfs/dbraw/zinc/58/14/59/1367581459.db2.gz	XABIXMKLABZHPC-LJQANCHMSA-N	0	3	325.456	3.337	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](N(C)CCOc2cccc(C)c2)C1	ZINC001191868634	1367622321	/nfs/dbraw/zinc/62/23/21/1367622321.db2.gz	XFLBDEQWHNRGPF-IBGZPJMESA-N	0	3	342.483	3.100	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@H](N(C)CCOc2cccc(F)c2)C1	ZINC001191891030	1367629157	/nfs/dbraw/zinc/62/91/57/1367629157.db2.gz	WDWBKXVAMGEJOL-WMZOPIPTSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](N(C)Cc2cccc(NC(C)=O)c2)C1	ZINC001192059631	1367676955	/nfs/dbraw/zinc/67/69/55/1367676955.db2.gz	IFCIIRCYFUMGBP-LJQANCHMSA-N	0	3	343.471	3.034	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](N(C)Cc2ccc(C)c(OC)c2)C1	ZINC001192093778	1367685777	/nfs/dbraw/zinc/68/57/77/1367685777.db2.gz	NEJSMZJZDOLHOC-GOSISDBHSA-N	0	3	330.472	3.393	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](N(C)CCOc2ccc(F)cc2)C1	ZINC001192094343	1367686466	/nfs/dbraw/zinc/68/64/66/1367686466.db2.gz	RXXVEDQEKNQSEO-QGZVFWFLSA-N	0	3	334.435	3.094	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)CCCCc2ccccc2)C1	ZINC001192114850	1367692075	/nfs/dbraw/zinc/69/20/75/1367692075.db2.gz	NWISISDMVHVXCD-FQEVSTJZSA-N	0	3	344.499	3.135	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCCOc1ccc(F)cc1	ZINC001109042897	1367736682	/nfs/dbraw/zinc/73/66/82/1367736682.db2.gz	FUIWJGHDHYZDIW-NEWSRXKRSA-N	0	3	346.446	3.282	20	30		EGEDHN
C=CCOCCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1cccc(C)c1	ZINC001109120292	1367780038	/nfs/dbraw/zinc/78/00/38/1367780038.db2.gz	MDCZEBWSHPGYAT-AABGKKOBSA-N	0	3	342.483	3.199	20	30		EGEDHN
CC(C)CCCC(=O)N1CC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001192489459	1367794729	/nfs/dbraw/zinc/79/47/29/1367794729.db2.gz	FGLACDVEOLEXSP-LJQANCHMSA-N	0	3	327.472	3.417	20	30		EGEDHN
CC(C)CCCC(=O)N1CC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001192489478	1367794946	/nfs/dbraw/zinc/79/49/46/1367794946.db2.gz	FTRKWRXFKBDCEK-LJQANCHMSA-N	0	3	327.472	3.417	20	30		EGEDHN
C[C@H](c1ccc2c(c1)CCC2)N1[C@@H]2CC[C@H]1[C@H](NC(=O)C#CC1CC1)C2	ZINC001110540258	1367819980	/nfs/dbraw/zinc/81/99/80/1367819980.db2.gz	KRBQRQACBRCIBK-FJGOKHBRSA-N	0	3	348.490	3.371	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](N(C)Cc2ccc3c(c2)COC3)C1	ZINC001192586041	1367824923	/nfs/dbraw/zinc/82/49/23/1367824923.db2.gz	HTQXMZZKRKYLIG-IBGZPJMESA-N	0	3	342.483	3.352	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)CC[C@H](C)c2ccccc2)C1	ZINC001192687789	1367851411	/nfs/dbraw/zinc/85/14/11/1367851411.db2.gz	LTKMWIKFATVKPZ-AZUAARDMSA-N	0	3	344.499	3.306	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3CCc2cccs2)CCC1	ZINC001110652748	1367896498	/nfs/dbraw/zinc/89/64/98/1367896498.db2.gz	SNIKUCWYAMBBCA-NXHRZFHOSA-N	0	3	342.508	3.206	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCc1ncc(C(C)(C)C)o1)C2	ZINC001110678430	1367921445	/nfs/dbraw/zinc/92/14/45/1367921445.db2.gz	YUCGYDLEUOQVRP-OAGGEKHMSA-N	0	3	345.487	3.202	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)C[C@@H](CC)c2ccccc2)C1	ZINC001193434243	1368030771	/nfs/dbraw/zinc/03/07/71/1368030771.db2.gz	XUOCZPPLLSROCS-QUCCMNQESA-N	0	3	344.499	3.306	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)C2(C)CCCCCC2)C1	ZINC001193834874	1368125166	/nfs/dbraw/zinc/12/51/66/1368125166.db2.gz	IMKZXBPHIJMMBK-QZTJIDSGSA-N	0	3	338.536	3.479	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1sc(C)cc1OC)C2	ZINC001111097412	1368158806	/nfs/dbraw/zinc/15/88/06/1368158806.db2.gz	XWLDGFMRWRGIMA-KFWWJZLASA-N	0	3	334.485	3.366	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)[C@H](CC)c2ccc(F)cc2)C1	ZINC001194324260	1368230845	/nfs/dbraw/zinc/23/08/45/1368230845.db2.gz	BABWFOYCVHYGPI-RBUKOAKNSA-N	0	3	348.462	3.055	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc3c(s1)CCOC3)C2	ZINC001111288876	1368255127	/nfs/dbraw/zinc/25/51/27/1368255127.db2.gz	UGLZSMZVVSOVOF-OAGGEKHMSA-N	0	3	346.496	3.122	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2[C@@H](C)c1ccccc1	ZINC001111487576	1368319087	/nfs/dbraw/zinc/31/90/87/1368319087.db2.gz	VXBKGJXVPOYIRF-AITUJVMLSA-N	0	3	328.456	3.062	20	30		EGEDHN
C#CC[C@H](CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCCF)c1ccccc1	ZINC001111511355	1368323188	/nfs/dbraw/zinc/32/31/88/1368323188.db2.gz	JFECXSBORDOOQU-WTGUMLROSA-N	0	3	342.458	3.265	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)C[C@@H](NC(=O)CSC)c1ccccc1O2	ZINC001111529908	1368330104	/nfs/dbraw/zinc/33/01/04/1368330104.db2.gz	RMRRCZCNTAYVOP-VQIMIIECSA-N	0	3	346.496	3.010	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1(CC=C)CCCC1)C[C@@H](C)O2	ZINC001111554238	1368345701	/nfs/dbraw/zinc/34/57/01/1368345701.db2.gz	KNBLBBIKSPJIGP-GOSISDBHSA-N	0	3	346.515	3.391	20	30		EGEDHN
C=CCOCC(=O)N1CCCN([C@H](C)c2cc(C)ccc2C)CC1	ZINC001195283848	1368413439	/nfs/dbraw/zinc/41/34/39/1368413439.db2.gz	KXJBHMITOBFRML-GOSISDBHSA-N	0	3	330.472	3.101	20	30		EGEDHN
C[C@@H](C#N)C(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(C(F)F)cc1)C2	ZINC001111667067	1368416942	/nfs/dbraw/zinc/41/69/42/1368416942.db2.gz	SUCOZIRPZOEZAP-AXHNFQJDSA-N	0	3	347.409	3.255	20	30		EGEDHN
C[C@H](c1ccc(F)cc1)N1C[C@@H]2CCC[C@]2(NC(=O)C#CC2CC2)C1	ZINC001111741763	1368438938	/nfs/dbraw/zinc/43/89/38/1368438938.db2.gz	NQIPWAFUXUNRCS-YWMUFLPLSA-N	0	3	340.442	3.271	20	30		EGEDHN
C#CCCCCC(=O)N1CCCN(CCc2ccc(C)cc2)CC1	ZINC001195541495	1368451178	/nfs/dbraw/zinc/45/11/78/1368451178.db2.gz	WQVSLEITDNVWEH-UHFFFAOYSA-N	0	3	326.484	3.265	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H](C)OCc2ccccc2C)C1	ZINC001111823982	1368483821	/nfs/dbraw/zinc/48/38/21/1368483821.db2.gz	QYVLADPEEWOWBJ-CUWPLCDZSA-N	0	3	342.483	3.057	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)CCc2ccc(C)cc2C)C1	ZINC001111824928	1368484310	/nfs/dbraw/zinc/48/43/10/1368484310.db2.gz	DEWXXESWAFMHSP-UNMCSNQZSA-N	0	3	338.495	3.230	20	30		EGEDHN
C=CCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1cncc(C)c1)C2	ZINC001111858892	1368509716	/nfs/dbraw/zinc/50/97/16/1368509716.db2.gz	DRKTXRZRQNEIRV-ICSRJNTNSA-N	0	3	327.472	3.217	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H](CC)Cc2ccccc2)C1	ZINC001111886848	1368530221	/nfs/dbraw/zinc/53/02/21/1368530221.db2.gz	WJYPEAFVYJUILO-DYXWJJEUSA-N	0	3	326.484	3.412	20	30		EGEDHN
C=CCC[C@@H](C)N1CCCN(C(=O)c2cn3cc(C)nc3s2)CC1	ZINC001196162846	1368559758	/nfs/dbraw/zinc/55/97/58/1368559758.db2.gz	BMJARAUSPCGSGJ-OAHLLOKOSA-N	0	3	346.500	3.207	20	30		EGEDHN
C=CCC[C@H](C)N1CCCN(C(=O)c2c(C)noc2C(F)F)CC1	ZINC001196258558	1368578160	/nfs/dbraw/zinc/57/81/60/1368578160.db2.gz	AZRWTBOBOHKHDQ-LBPRGKRZSA-N	0	3	341.402	3.423	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H](CC)c2ccc(OC)cc2)C1	ZINC001112001057	1368605189	/nfs/dbraw/zinc/60/51/89/1368605189.db2.gz	FQSCFJQLXJUUPT-CUWPLCDZSA-N	0	3	342.483	3.346	20	30		EGEDHN
C=C(C)CCN1C[C@@H](O)[C@H](NC(=O)[C@H](CC)CC2CCCCC2)C1	ZINC001196608743	1368648558	/nfs/dbraw/zinc/64/85/58/1368648558.db2.gz	MHAOFSQOGRMQHA-GUDVDZBRSA-N	0	3	336.520	3.111	20	30		EGEDHN
C=CCCN1CCCN(C(=O)[C@@H](C)OCc2ccccc2C)CC1	ZINC001196689779	1368663752	/nfs/dbraw/zinc/66/37/52/1368663752.db2.gz	NHSZIQDWXQKBPX-GOSISDBHSA-N	0	3	330.472	3.011	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)C(C)(C)C(C)(C)C)C[C@H]1C(F)(F)F	ZINC001112143213	1368678754	/nfs/dbraw/zinc/67/87/54/1368678754.db2.gz	NVJUBWAJEUGYSO-CHWSQXEVSA-N	0	3	332.410	3.061	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)C(C)(C)CC(F)(F)F)C[C@H]1C(F)(F)F	ZINC001112189025	1368706526	/nfs/dbraw/zinc/70/65/26/1368706526.db2.gz	LTWOXISQBSJTOW-NXEZZACHSA-N	0	3	346.315	3.130	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2ccc(C)nc2OCCC)CC1	ZINC001197646878	1368863593	/nfs/dbraw/zinc/86/35/93/1368863593.db2.gz	ILSWSTHCDOPZPQ-UHFFFAOYSA-N	0	3	345.487	3.293	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2cscn2)C1	ZINC001112515619	1368909850	/nfs/dbraw/zinc/90/98/50/1368909850.db2.gz	UHZHEDVKLQZLOM-BXWFABGCSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cc(Cl)no2)CC1	ZINC001197898964	1368922000	/nfs/dbraw/zinc/92/20/00/1368922000.db2.gz	JYOAKHJYDXDUSC-UHFFFAOYSA-N	0	3	325.840	3.222	20	30		EGEDHN
C#CCCN1CCCN(C(=O)[C@H](c2ccccc2)[C@@H](C)CC)CC1	ZINC001198078384	1368955692	/nfs/dbraw/zinc/95/56/92/1368955692.db2.gz	VFTIUFXYFIZHCG-ICSRJNTNSA-N	0	3	326.484	3.374	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cncnc2CC)CC1	ZINC001198121612	1368964127	/nfs/dbraw/zinc/96/41/27/1368964127.db2.gz	LZOLPBRJZUKUGB-UHFFFAOYSA-N	0	3	332.492	3.157	20	30		EGEDHN
C=CCOCC(=O)N1CCN(CC2CCC(C(C)(C)C)CC2)CC1	ZINC001112703767	1368983906	/nfs/dbraw/zinc/98/39/06/1368983906.db2.gz	FEUMGNFGGXTMPT-UHFFFAOYSA-N	0	3	336.520	3.186	20	30		EGEDHN
C#CCC1(C(=O)N2CCCN(CCCOC(C)C)CC2)CCCCC1	ZINC001198315692	1369007283	/nfs/dbraw/zinc/00/72/83/1369007283.db2.gz	DHMJWMBJWWMEPG-UHFFFAOYSA-N	0	3	348.531	3.310	20	30		EGEDHN
C#CCCCC(=O)N1CCN(CC2CCC(C(F)(F)F)CC2)CC1	ZINC001112809485	1369021158	/nfs/dbraw/zinc/02/11/58/1369021158.db2.gz	IFACIDHGBWOTFK-UHFFFAOYSA-N	0	3	344.421	3.303	20	30		EGEDHN
C#CC[C@@H](CC(=O)N1CCCN(CC[C@@H](C)F)CC1)c1ccccc1	ZINC001198394416	1369021942	/nfs/dbraw/zinc/02/19/42/1369021942.db2.gz	IWKWUXDTZKEYJL-QUCCMNQESA-N	0	3	344.474	3.466	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)c1ccc(F)cc1)c1ccccc1OC	ZINC001198492820	1369045195	/nfs/dbraw/zinc/04/51/95/1369045195.db2.gz	WMWDCXMTHRBYAG-SFHVURJKSA-N	0	3	342.414	3.471	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)c1ccco1)c1ccccc1OC	ZINC001198499915	1369047554	/nfs/dbraw/zinc/04/75/54/1369047554.db2.gz	TYVZXEWDXMAADN-MRXNPFEDSA-N	0	3	328.412	3.315	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)C[C@@H](OCC)C2=CCCC2)CC1	ZINC001112856471	1369049832	/nfs/dbraw/zinc/04/98/32/1369049832.db2.gz	MBLIKCGLJJKRKX-PKOBYXMFSA-N	0	3	334.504	3.391	20	30		EGEDHN
C=CCC[NH2+][C@H](CNC(=O)c1ccccc1[O-])c1ccccc1OC	ZINC001198542955	1369057670	/nfs/dbraw/zinc/05/76/70/1369057670.db2.gz	PKYCJGJPAPOFKB-QGZVFWFLSA-N	0	3	340.423	3.038	20	30		EGEDHN
C=CCC[C@@H](C)N[C@@H](CNC(=O)CCCOC)c1ccccc1OC	ZINC001198567239	1369061902	/nfs/dbraw/zinc/06/19/02/1369061902.db2.gz	NWOQVDFUJJZLBQ-AEFFLSMTSA-N	0	3	348.487	3.223	20	30		EGEDHN
COc1ccccc1[C@H](CNC(=O)[C@@H](C)C#N)NCCCC(C)(C)C	ZINC001198617774	1369074712	/nfs/dbraw/zinc/07/47/12/1369074712.db2.gz	SCTMCJXWKIPJQV-RDJZCZTQSA-N	0	3	345.487	3.428	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)[C@H]1[C@@H]2CCC[C@@H]21)c1ccccc1OC	ZINC001198645662	1369080669	/nfs/dbraw/zinc/08/06/69/1369080669.db2.gz	AUUDLGJTTAAIRD-WBQJQJEBSA-N	0	3	342.483	3.454	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)CO[C@H](C)CC)c1ccccc1OC	ZINC001198668736	1369087304	/nfs/dbraw/zinc/08/73/04/1369087304.db2.gz	VBSYKKNGWOQJAB-SJLPKXTDSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)c1coc(C)c1)c1ccccc1OC	ZINC001198686507	1369091343	/nfs/dbraw/zinc/09/13/43/1369091343.db2.gz	POWUQROTBJDNMO-KRWDZBQOSA-N	0	3	328.412	3.233	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)C#CC(C)(C)C)c1ccccc1OC	ZINC001198724795	1369100534	/nfs/dbraw/zinc/10/05/34/1369100534.db2.gz	ZZTFHOJZERYHGE-GOSISDBHSA-N	0	3	342.483	3.458	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NC[C@H](NCCC)c1ccccc1OC)OCC	ZINC001198752171	1369105229	/nfs/dbraw/zinc/10/52/29/1369105229.db2.gz	MYBMMKFRZDGHOB-HKUYNNGSSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)c1ccsn1)c1ccccc1OC	ZINC001198766646	1369108222	/nfs/dbraw/zinc/10/82/22/1369108222.db2.gz	FMFKMMYVGAGBSL-INIZCTEOSA-N	0	3	345.468	3.179	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@H](C)C1CCC1)c1ccccc1OC	ZINC001198777278	1369112154	/nfs/dbraw/zinc/11/21/54/1369112154.db2.gz	XTJOHBXWGAERBB-CRAIPNDOSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)Cc2cccc3cnccc32)CC1	ZINC001113012295	1369135499	/nfs/dbraw/zinc/13/54/99/1369135499.db2.gz	OJRUYRBAYVIBCL-KRWDZBQOSA-N	0	3	337.467	3.276	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@@H](CC(C)C)OC)c1ccccc1OC	ZINC001198885444	1369138967	/nfs/dbraw/zinc/13/89/67/1369138967.db2.gz	HYZUSYJCASDKPE-PKOBYXMFSA-N	0	3	348.487	3.079	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)CC(C)(F)F)c1ccccc1OC	ZINC001198885341	1369139628	/nfs/dbraw/zinc/13/96/28/1369139628.db2.gz	DXSQUGKEKAGWTG-HNNXBMFYSA-N	0	3	340.414	3.454	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@@H](NCC1CC1)c1ccccc1OC	ZINC001198885747	1369140457	/nfs/dbraw/zinc/14/04/57/1369140457.db2.gz	RIERIJUXBLEHJO-XLIONFOSSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@@H](NCCCOC)c1ccccc1OC	ZINC001198916977	1369149472	/nfs/dbraw/zinc/14/94/72/1369149472.db2.gz	YWHRAEQDUFIUJE-QGZVFWFLSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)c1nocc1C)c1ccccc1OC	ZINC001198953981	1369157814	/nfs/dbraw/zinc/15/78/14/1369157814.db2.gz	YHOBKUBKBILGRU-INIZCTEOSA-N	0	3	343.427	3.019	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NC[C@@H](NCCC(C)C)c1ccccc1OC	ZINC001199002788	1369170065	/nfs/dbraw/zinc/17/00/65/1369170065.db2.gz	ZYSIAXYXJNNIIB-SJLPKXTDSA-N	0	3	348.487	3.079	20	30		EGEDHN
C=CCCOCC(=O)NC[C@H](NCCC(=C)C)c1ccccc1OC	ZINC001199001252	1369170365	/nfs/dbraw/zinc/17/03/65/1369170365.db2.gz	CMVQKHQQUQYRDG-SFHVURJKSA-N	0	3	346.471	3.001	20	30		EGEDHN
CC(C)CCC(=O)N1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001199266468	1369200172	/nfs/dbraw/zinc/20/01/72/1369200172.db2.gz	VMOQFMVDQVPKOH-UHFFFAOYSA-N	0	3	331.435	3.214	20	30		EGEDHN
C#CCCCCC(=O)N1CCC(NCc2oc(C(C)C)nc2C)CC1	ZINC001200147892	1369320386	/nfs/dbraw/zinc/32/03/86/1369320386.db2.gz	HXENPAIWPQBBLN-UHFFFAOYSA-N	0	3	345.487	3.381	20	30		EGEDHN
N#Cc1oc2ccccc2c1NC(=S)NCCN1CCCCC1	ZINC001200419227	1369363979	/nfs/dbraw/zinc/36/39/79/1369363979.db2.gz	LYHFZVUAHYTDGO-UHFFFAOYSA-N	0	3	328.441	3.077	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC(NCc2oc(CC)nc2C)CC1	ZINC001200794759	1369430535	/nfs/dbraw/zinc/43/05/35/1369430535.db2.gz	NTSOHLZOROCPEX-UHFFFAOYSA-N	0	3	333.476	3.228	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCCO[C@H](CNCc2cccc(F)c2)C1	ZINC001201233254	1369501955	/nfs/dbraw/zinc/50/19/55/1369501955.db2.gz	MWEYENWIUYNQJZ-VQIMIIECSA-N	0	3	348.462	3.135	20	30		EGEDHN
CCCCCCCCCN1CCCn2cnc(COCCO)c2C1	ZINC001201838696	1369632651	/nfs/dbraw/zinc/63/26/51/1369632651.db2.gz	DGGCVYFMUCIZSN-UHFFFAOYSA-N	0	3	337.508	3.348	20	30		EGEDHN
CC#CCNC[C@@H]1CN(C(=O)[C@](C)(CC)CCCCC)CCCO1	ZINC001202174125	1369707092	/nfs/dbraw/zinc/70/70/92/1369707092.db2.gz	QNIBWBFYDDWFHD-UYAOXDASSA-N	0	3	336.520	3.213	20	30		EGEDHN
CCC(=O)N[C@H]1C[C@H](NCC#Cc2ccccc2Cl)C12CCC2	ZINC001202257773	1369724370	/nfs/dbraw/zinc/72/43/70/1369724370.db2.gz	BIXAHZQFBSQZEI-IRXDYDNUSA-N	0	3	330.859	3.119	20	30		EGEDHN
CC(C)=CC(=O)N[C@@H]1C[C@H](NCC#Cc2ccc(F)cc2)C12CCC2	ZINC001202408315	1369763978	/nfs/dbraw/zinc/76/39/78/1369763978.db2.gz	SRHUYVVYLZLIKN-RBUKOAKNSA-N	0	3	340.442	3.160	20	30		EGEDHN
CC(C)C(=O)N[C@@H]1C[C@H](NCC#Cc2ccc(Cl)cc2)C12CCC2	ZINC001202460553	1369778644	/nfs/dbraw/zinc/77/86/44/1369778644.db2.gz	VYVWWXYSGXDYJB-ZWKOTPCHSA-N	0	3	344.886	3.365	20	30		EGEDHN
CC1(CC(=O)N[C@@H]2[C@H]3CN(Cc4ccc(C#N)cc4)C[C@H]32)CCCC1	ZINC001114232102	1369815546	/nfs/dbraw/zinc/81/55/46/1369815546.db2.gz	OMGWOJFLLZJTHO-RUYXUALKSA-N	0	3	337.467	3.075	20	30		EGEDHN
CCCC[C@@H](CNc1cccc(F)c1C#N)NC(=O)CN(CC)CC	ZINC001114261177	1369834963	/nfs/dbraw/zinc/83/49/63/1369834963.db2.gz	ABIQJPFTMKILCF-HNNXBMFYSA-N	0	3	348.466	3.126	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1C[C@H](NCc2ccccc2F)C12CCC2	ZINC001202830761	1369904076	/nfs/dbraw/zinc/90/40/76/1369904076.db2.gz	ACVHNFVFJFDRBX-ZWKOTPCHSA-N	0	3	328.431	3.146	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1C[C@@H](NCc2cc(F)ccc2F)C12CCC2	ZINC001202847296	1369906988	/nfs/dbraw/zinc/90/69/88/1369906988.db2.gz	RVHQOKXCHJZLRO-MSOLQXFVSA-N	0	3	346.421	3.285	20	30		EGEDHN
O=C(C#CC1CC1)N[C@H]1C[C@H](NCc2ccccc2Cl)C12CCC2	ZINC001202888076	1369918048	/nfs/dbraw/zinc/91/80/48/1369918048.db2.gz	OSWIQYGQVBEYKY-ROUUACIJSA-N	0	3	342.870	3.270	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1C[C@H](NCc2ccc(F)cn2)C12CCC2	ZINC001202988229	1369947124	/nfs/dbraw/zinc/94/71/24/1369947124.db2.gz	RKKKEBMWMGWPQT-DLBZAZTESA-N	0	3	331.435	3.094	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)C(C)(C)CC(F)F)C12CCC2	ZINC001203035441	1369962110	/nfs/dbraw/zinc/96/21/10/1369962110.db2.gz	BBWKQZSRVBAMIY-RYUDHWBXSA-N	0	3	334.838	3.437	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1[C@H]2CN(CCOc3cccc(C)c3)C[C@H]21	ZINC001114672282	1370017935	/nfs/dbraw/zinc/01/79/35/1370017935.db2.gz	OPVJIHFOCARECC-BWTSREIZSA-N	0	3	342.483	3.023	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1[C@H]2CN([C@H](C)c3cccc(OC)c3)C[C@H]21	ZINC001114686984	1370024928	/nfs/dbraw/zinc/02/49/28/1370024928.db2.gz	VOMIEDGIVMHGPI-ZSGPHXLJSA-N	0	3	328.456	3.015	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1C[C@H](NCc2cnoc2C)C12CCC2	ZINC001203259544	1370045729	/nfs/dbraw/zinc/04/57/29/1370045729.db2.gz	XJCOWOUQEFEYGY-HOTGVXAUSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1[C@H]2CN(CCOc3cccc(C)c3)C[C@H]21	ZINC001114724455	1370047255	/nfs/dbraw/zinc/04/72/55/1370047255.db2.gz	NLWXFBHDYZMIIX-LMCOJAPRSA-N	0	3	342.483	3.023	20	30		EGEDHN
CC#CCCCC(=O)N[C@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001203280452	1370059377	/nfs/dbraw/zinc/05/93/77/1370059377.db2.gz	HIRPVNBUJSLLFJ-SFTDATJTSA-N	0	3	348.490	3.249	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(F)cc3C)C[C@H]21	ZINC001114792783	1370083385	/nfs/dbraw/zinc/08/33/85/1370083385.db2.gz	XAVPXOYGJUUDNZ-XFKSJGNHSA-N	0	3	330.447	3.283	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)C2(CC)CC2)C12CCC2	ZINC001203359473	1370097651	/nfs/dbraw/zinc/09/76/51/1370097651.db2.gz	SPKVBFCIFUEOSQ-QWHCGFSZSA-N	0	3	341.293	3.102	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@H]1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC001203905447	1370309549	/nfs/dbraw/zinc/30/95/49/1370309549.db2.gz	NGEISRCJSZVAIN-KRWDZBQOSA-N	0	3	329.444	3.437	20	30		EGEDHN
C=CCCC(=O)NCC1(NCc2c(C)onc2CC)CCCCC1	ZINC001115441588	1370453990	/nfs/dbraw/zinc/45/39/90/1370453990.db2.gz	LRYJQUQIWAVGRK-UHFFFAOYSA-N	0	3	333.476	3.420	20	30		EGEDHN
CCCCCCCOc1ccc(CN2CC[C@H](CO)[C@H](O)C2)cc1	ZINC001204369171	1370456121	/nfs/dbraw/zinc/45/61/21/1370456121.db2.gz	PUIXDEIITWBFRQ-UYAOXDASSA-N	0	3	335.488	3.211	20	30		EGEDHN
Cc1csc(Nc2cccc(CN3CCN(C)CC3)c2)c1C#N	ZINC001204491913	1370491667	/nfs/dbraw/zinc/49/16/67/1370491667.db2.gz	ZPWWOSFFIHHTNP-UHFFFAOYSA-N	0	3	326.469	3.419	20	30		EGEDHN
Cc1cc(CN2CC[C@]3(CC(=O)N(c4cccc(C#N)c4)C3)C2)oc1C	ZINC001204532424	1370507387	/nfs/dbraw/zinc/50/73/87/1370507387.db2.gz	YKZDAXKOJWNFBA-NRFANRHFSA-N	0	3	349.434	3.397	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@@H]1CCN(Cc1ccc(F)c(OC)c1)C2	ZINC001204558327	1370514712	/nfs/dbraw/zinc/51/47/12/1370514712.db2.gz	XMMPDTKLPICQIZ-UXHICEINSA-N	0	3	349.446	3.408	20	30		EGEDHN
CN1CCN(Cc2cccc(Nc3c(F)cc(F)cc3C#N)c2)CC1	ZINC001204574959	1370520680	/nfs/dbraw/zinc/52/06/80/1370520680.db2.gz	UDBBMOAZIGZUHG-UHFFFAOYSA-N	0	3	342.393	3.327	20	30		EGEDHN
CC(C)(C)/C=C\C(=O)N1CCC(CNCc2ccccc2C#N)CC1	ZINC001204818641	1370582546	/nfs/dbraw/zinc/58/25/46/1370582546.db2.gz	KLWYNEXFWKIRBA-FLIBITNWSA-N	0	3	339.483	3.489	20	30		EGEDHN
CC[C@H](F)C(=O)NCC1(NCc2ccc(C#N)cc2F)CCCCC1	ZINC001115670055	1370651298	/nfs/dbraw/zinc/65/12/98/1370651298.db2.gz	ATAYWJGXVNTXKK-INIZCTEOSA-N	0	3	349.425	3.354	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)C2(C)CCC2)CCCCC1	ZINC001115669538	1370651392	/nfs/dbraw/zinc/65/13/92/1370651392.db2.gz	YDAKSUNLOGOVDE-UHFFFAOYSA-N	0	3	343.309	3.494	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N(Cc1ccccc1)[C@@H]1CN(C(C)C)C[C@H]1O	ZINC001205164090	1370667209	/nfs/dbraw/zinc/66/72/09/1370667209.db2.gz	RUVUCHVCGZULGR-RTBURBONSA-N	0	3	344.499	3.071	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H]2Cc3ccccc32)CCCCC1	ZINC001115701572	1370683472	/nfs/dbraw/zinc/68/34/72/1370683472.db2.gz	VIGCOSOCPJNRNU-QGZVFWFLSA-N	0	3	332.875	3.488	20	30		EGEDHN
C=CCCCC(=O)NCC1(NCc2snnc2C)CCCCC1	ZINC001115701664	1370683484	/nfs/dbraw/zinc/68/34/84/1370683484.db2.gz	ZNTFRALUHIBREO-UHFFFAOYSA-N	0	3	336.505	3.112	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)CCC(C)C)CC[C@H]1c1ccc(F)cc1	ZINC001205244740	1370693660	/nfs/dbraw/zinc/69/36/60/1370693660.db2.gz	FXIWCYAYCCIRPG-RBUKOAKNSA-N	0	3	330.447	3.169	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C/C=C(/C)C=C)CC[C@H]1c1ccc(F)cc1	ZINC001205300790	1370712843	/nfs/dbraw/zinc/71/28/43/1370712843.db2.gz	XHQNLEKXILJTTD-WTFIIWGMSA-N	0	3	340.442	3.255	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)/C=C(/C)C2CC2)C[C@H]1c1cccc(F)c1	ZINC001205374774	1370734723	/nfs/dbraw/zinc/73/47/23/1370734723.db2.gz	SXDQGWQDLXWGRE-BHMPTGKFSA-N	0	3	340.442	3.089	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CC[C@@H]2CCCOC2)CCCCC1	ZINC001115796703	1370779378	/nfs/dbraw/zinc/77/93/78/1370779378.db2.gz	NOGFFMNLVAYCBN-INIZCTEOSA-N	0	3	342.911	3.354	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ncoc2C2CC2)CCCCC1	ZINC001115805607	1370789025	/nfs/dbraw/zinc/78/90/25/1370789025.db2.gz	WXSDUUQSOHWXPL-UHFFFAOYSA-N	0	3	337.851	3.327	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2csc(C#N)c2)C1	ZINC001117780749	1371082668	/nfs/dbraw/zinc/08/26/68/1371082668.db2.gz	YUPUSJUFTYJIQR-BBRMVZONSA-N	0	3	325.437	3.185	20	30		EGEDHN
CN1CCN(CCCO[C@H](C#C[Si](C)(C)C)c2ccccc2)CC1	ZINC001206589460	1371101915	/nfs/dbraw/zinc/10/19/15/1371101915.db2.gz	FMENHBIDTSGVOT-HXUWFJFHSA-N	0	3	344.575	3.263	20	30		EGEDHN
CC(C)(F)C(=O)N1CCC[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207046690	1371276928	/nfs/dbraw/zinc/27/69/28/1371276928.db2.gz	FQQVLMIDSOGQLP-INIZCTEOSA-N	0	3	336.838	3.020	20	30		EGEDHN
Cn1cc(CN2CCN([C@H]3CCCc4ccccc43)CC2)cc1C#N	ZINC001207108667	1371295879	/nfs/dbraw/zinc/29/58/79/1371295879.db2.gz	IBHNEKQYFIUNSK-NRFANRHFSA-N	0	3	334.467	3.092	20	30		EGEDHN
COc1ccccc1OCC1CCN(Cc2cc(C#N)n(C)c2)CC1	ZINC001207110632	1371296739	/nfs/dbraw/zinc/29/67/39/1371296739.db2.gz	PMJZAEYMQCYLFY-UHFFFAOYSA-N	0	3	339.439	3.196	20	30		EGEDHN
CCCCCC(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207344067	1371365261	/nfs/dbraw/zinc/36/52/61/1371365261.db2.gz	ROPLWXWGACTLSH-LJQANCHMSA-N	0	3	330.447	3.338	20	30		EGEDHN
CCC[C@H](C)CC(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001207644408	1371462414	/nfs/dbraw/zinc/46/24/14/1371462414.db2.gz	DRIQTIWESPLDFO-AZUAARDMSA-N	0	3	326.484	3.445	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cc(Cl)no2)CCCCC1	ZINC001120041563	1371466952	/nfs/dbraw/zinc/46/69/52/1371466952.db2.gz	YARMMIFFCACGBS-UHFFFAOYSA-N	0	3	332.231	3.103	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)Cc2csc(C)n2)CCCCC1	ZINC001120097991	1371485232	/nfs/dbraw/zinc/48/52/32/1371485232.db2.gz	ONYIJZVIYNRMLQ-UHFFFAOYSA-N	0	3	341.908	3.155	20	30		EGEDHN
O=C(/C=C/C1CC1)N1CCC[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207741740	1371491029	/nfs/dbraw/zinc/49/10/29/1371491029.db2.gz	PHRYWWUVGXNHLZ-DLENHJPASA-N	0	3	342.870	3.238	20	30		EGEDHN
Cc1cc(C)c(C(=O)N2CCC[C@H](NCC#Cc3ccccc3)C2)o1	ZINC001207765266	1371497532	/nfs/dbraw/zinc/49/75/32/1371497532.db2.gz	ZGNZRRKHCCNEQU-IBGZPJMESA-N	0	3	336.435	3.142	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207790951	1371505558	/nfs/dbraw/zinc/50/55/58/1371505558.db2.gz	ZJGDWZJYAFPTTI-KRWDZBQOSA-N	0	3	332.394	3.021	20	30		EGEDHN
C#CCCCCC(=O)N1CCC[C@H](NCc2cc(C)ccc2F)C1	ZINC001207863212	1371523203	/nfs/dbraw/zinc/52/32/03/1371523203.db2.gz	IZTKKIYDOFLHPD-SFHVURJKSA-N	0	3	330.447	3.408	20	30		EGEDHN
CC[C@H](C)CC(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207914707	1371537444	/nfs/dbraw/zinc/53/74/44/1371537444.db2.gz	NMXPYYJFDQVEEI-LPHOPBHVSA-N	0	3	330.447	3.194	20	30		EGEDHN
O=C(c1sccc1F)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001207978713	1371558238	/nfs/dbraw/zinc/55/82/38/1371558238.db2.gz	HXYZYQOGGCCTEC-MRXNPFEDSA-N	0	3	342.439	3.133	20	30		EGEDHN
O=C([C@@H]1C[C@@H]2C=C[C@H]1CC2)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001208090638	1371593904	/nfs/dbraw/zinc/59/39/04/1371593904.db2.gz	USJDBMRUAAECSF-CIAFKFPVSA-N	0	3	348.490	3.221	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H]2CN([C@H](C)c3ccc(F)cc3)C[C@H]21	ZINC001187714474	1388148443	/nfs/dbraw/zinc/14/84/43/1388148443.db2.gz	RZJCECQVZURSCZ-HHXXYDBFSA-N	0	3	328.431	3.223	20	30		EGEDHN
C=C(Br)CNC1CC2(C1)CC(NC(=O)CC(C)(C)C)C2	ZINC001120639366	1371673129	/nfs/dbraw/zinc/67/31/29/1371673129.db2.gz	BLYXNJWYYHFNDE-UHFFFAOYSA-N	0	3	343.309	3.348	20	30		EGEDHN
CCC(C)(C)CC(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001208214239	1371655933	/nfs/dbraw/zinc/65/59/33/1371655933.db2.gz	XMSQJTFBJCNXDX-IBGZPJMESA-N	0	3	326.484	3.445	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN(CC[C@@H]2CC2(Cl)Cl)C[C@H]1C	ZINC001208315035	1371712499	/nfs/dbraw/zinc/71/24/99/1371712499.db2.gz	GVJBFWBPOVHPCZ-JHJVBQTASA-N	0	3	333.303	3.219	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CN(Cc2ccc(COC)cc2)C[C@H]1C	ZINC001208388920	1371747308	/nfs/dbraw/zinc/74/73/08/1371747308.db2.gz	SPHAPJPROZJAJK-MBOZVWFJSA-N	0	3	344.499	3.372	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CN(Cc2ccc3c(c2)COC3)C[C@H]1C	ZINC001208387759	1371748407	/nfs/dbraw/zinc/74/84/07/1371748407.db2.gz	AYCYRCKABRZYDU-JXXFODFXSA-N	0	3	342.483	3.256	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CCOCCC(C)C)C[C@H]2C)CCC1	ZINC001208507396	1371791178	/nfs/dbraw/zinc/79/11/78/1371791178.db2.gz	SRRIOXGHANYCAG-QZTJIDSGSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N1CCC[C@H](NCc2ccccc2F)C1	ZINC001208797822	1371899475	/nfs/dbraw/zinc/89/94/75/1371899475.db2.gz	VGECMELFQUFLEC-PXNSSMCTSA-N	0	3	348.462	3.135	20	30		EGEDHN
COc1ccc(CN2CCN(CCCc3cccc(C#N)c3)CC2)cc1	ZINC001208852467	1371918289	/nfs/dbraw/zinc/91/82/89/1371918289.db2.gz	LLSGFMBYRHRBRH-UHFFFAOYSA-N	0	3	349.478	3.317	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@]12C[C@H]1CN(CCCc1cccc(C#N)c1)C2	ZINC001208852295	1371918322	/nfs/dbraw/zinc/91/83/22/1371918322.db2.gz	ZCQZRPDFPOQUQB-PXNSSMCTSA-N	0	3	341.455	3.090	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@H]1CCCCN1CCc1ccc(C#N)cc1	ZINC001208920337	1371944967	/nfs/dbraw/zinc/94/49/67/1371944967.db2.gz	FZFMHQFYGOVXQN-GOSISDBHSA-N	0	3	343.471	3.480	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)c2cc(C(C)(C)C)oc2C)C1	ZINC001208932159	1371950937	/nfs/dbraw/zinc/95/09/37/1371950937.db2.gz	CGDUDHNKVWGQCA-RHSMWYFYSA-N	0	3	348.487	3.138	20	30		EGEDHN
O=C(C[C@H]1CC=CCC1)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001208993599	1371968898	/nfs/dbraw/zinc/96/88/98/1371968898.db2.gz	LVAWQXCIJWWWIK-LEWJYISDSA-N	0	3	336.479	3.365	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC[C@H](NCc2cncc(C)c2)C1	ZINC001209004999	1371971720	/nfs/dbraw/zinc/97/17/20/1371971720.db2.gz	SCLQQIZPVDDZJZ-IBGZPJMESA-N	0	3	327.472	3.054	20	30		EGEDHN
C=CCN(CCN1CCN([C@H](C)c2ccccc2)CC1)C(=O)OCC	ZINC001209021653	1371977171	/nfs/dbraw/zinc/97/71/71/1371977171.db2.gz	BHIYOJRVTDGDEE-GOSISDBHSA-N	0	3	345.487	3.010	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001209050001	1371983523	/nfs/dbraw/zinc/98/35/23/1371983523.db2.gz	BHTRHWYRXXCRMC-MBNKTHEGSA-N	0	3	340.442	3.280	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CC2(C1)CC(N[C@H](C)c1cnc(C)cn1)C2	ZINC001121534804	1372003032	/nfs/dbraw/zinc/00/30/32/1372003032.db2.gz	WNXZGKUCSMBRSP-NUVKBMONSA-N	0	3	342.487	3.075	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@H](NCc2ccc(C#N)s2)C1	ZINC001209146320	1372014015	/nfs/dbraw/zinc/01/40/15/1372014015.db2.gz	NKWUNQNOSPTKAM-LSDHHAIUSA-N	0	3	331.485	3.303	20	30		EGEDHN
CCCc1[nH]ccc1C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001209168185	1372021995	/nfs/dbraw/zinc/02/19/95/1372021995.db2.gz	CAAZCXSVNSDTHU-LJQANCHMSA-N	0	3	349.478	3.213	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC1CC2(CC(NCc3ocnc3C)C2)C1	ZINC001121617562	1372027802	/nfs/dbraw/zinc/02/78/02/1372027802.db2.gz	VIZBGAUSLSGILC-IZCUCQHTSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=CCCC1(C(=O)NC2CC3(CC(NCc4cc(C)no4)C3)C2)CC1	ZINC001121707257	1372054344	/nfs/dbraw/zinc/05/43/44/1372054344.db2.gz	FYMPLFZKSPYBDB-UHFFFAOYSA-N	0	3	343.471	3.246	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC1CC2(CC(NCc3cc(C)no3)C2)C1	ZINC001121713720	1372056244	/nfs/dbraw/zinc/05/62/44/1372056244.db2.gz	NBALMPHZAQRKAT-XHVMPKOQSA-N	0	3	331.460	3.102	20	30		EGEDHN
CC(F)(F)CC(=O)NC1CC2(CC(NCc3ccccc3C#N)C2)C1	ZINC001121723368	1372059813	/nfs/dbraw/zinc/05/98/13/1372059813.db2.gz	KTUIDVWSBZCNCC-UHFFFAOYSA-N	0	3	347.409	3.121	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001209335905	1372072006	/nfs/dbraw/zinc/07/20/06/1372072006.db2.gz	RZSQIAGAWGDXPP-KRWDZBQOSA-N	0	3	329.419	3.134	20	30		EGEDHN
C=CCCCCCCN1CCO[C@@H]2[C@@H](COc3ncccn3)CC[C@H]21	ZINC001209436900	1372106594	/nfs/dbraw/zinc/10/65/94/1372106594.db2.gz	ZFHANEIBNWDBQR-GUDVDZBRSA-N	0	3	345.487	3.471	20	30		EGEDHN
C=CCCCCCCCN1C[C@@H]2[C@H](C1)OCCN2c1ccc(C)nn1	ZINC001209441302	1372107574	/nfs/dbraw/zinc/10/75/74/1372107574.db2.gz	JRYNYOYZWUVEGG-MOPGFXCFSA-N	0	3	344.503	3.201	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccc(OCc2ccccn2)c(F)c1	ZINC001122005195	1372150929	/nfs/dbraw/zinc/15/09/29/1372150929.db2.gz	GRJNFTBGTMHRDX-QGZVFWFLSA-N	0	3	343.402	3.422	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3c[nH]c4cc(F)ccc34)C2)C1=O	ZINC001209687837	1372170653	/nfs/dbraw/zinc/17/06/53/1372170653.db2.gz	YTOWDPPSDPCYDS-HXUWFJFHSA-N	0	3	341.430	3.308	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001209708807	1372176151	/nfs/dbraw/zinc/17/61/51/1372176151.db2.gz	RIQPMIVZBVTZGU-BHIYHBOVSA-N	0	3	344.886	3.318	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@@H](NCc2ccc(C#N)s2)C1	ZINC001209866175	1372217803	/nfs/dbraw/zinc/21/78/03/1372217803.db2.gz	PDUSCJJXBRGIEO-CQSZACIVSA-N	0	3	331.485	3.303	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001209911303	1372229915	/nfs/dbraw/zinc/22/99/15/1372229915.db2.gz	VJAYISNYUKVQOA-VQIMIIECSA-N	0	3	330.447	3.050	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1Cl)C(=O)c1cnn(C2CCC2)c1	ZINC001122449066	1372249650	/nfs/dbraw/zinc/24/96/50/1372249650.db2.gz	RLTBWRBPSIRJTR-ZDUSSCGKSA-N	0	3	342.786	3.223	20	30		EGEDHN
CCC[C@H](CC)C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001210378061	1372336882	/nfs/dbraw/zinc/33/68/82/1372336882.db2.gz	QDNHKPCNXQGNJR-PMACEKPBSA-N	0	3	326.484	3.445	20	30		EGEDHN
CC1(C(=O)N2CCC[C@H](NCC#Cc3ccccc3)C2)CC(F)(F)C1	ZINC001210626835	1372395389	/nfs/dbraw/zinc/39/53/89/1372395389.db2.gz	WTLJVWFZVXCUJX-KRWDZBQOSA-N	0	3	346.421	3.054	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)c2cccc3ccccc32)C1	ZINC001210729421	1372415218	/nfs/dbraw/zinc/41/52/18/1372415218.db2.gz	FRIGVKLVFLYLAT-OXQOHEQNSA-N	0	3	338.451	3.093	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCc1cccc(OC(F)F)c1	ZINC001123336358	1372430668	/nfs/dbraw/zinc/43/06/68/1372430668.db2.gz	HFIHMPKNUPXLAM-AWEZNQCLSA-N	0	3	333.338	3.313	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)C[C@@H](C)c2ccc(OC)cc2)C1	ZINC001211218537	1372505273	/nfs/dbraw/zinc/50/52/73/1372505273.db2.gz	YHQRTDRCPHMEGL-GPMSIDNRSA-N	0	3	330.472	3.201	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)C[C@H](C)c2cccc(OC)c2)C1	ZINC001211403615	1372552401	/nfs/dbraw/zinc/55/24/01/1372552401.db2.gz	YCXBHAAOIYVEHJ-FRQCXROJSA-N	0	3	330.472	3.201	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](c2ccccc2)[C@H](NC/C=C\Cl)C1	ZINC001211586795	1372586304	/nfs/dbraw/zinc/58/63/04/1372586304.db2.gz	ZQZWHECFXOEKNJ-RFOLTBDASA-N	0	3	330.859	3.127	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2ccn(CC)c2C)C[C@H]1c1ccccc1	ZINC001211657921	1372597492	/nfs/dbraw/zinc/59/74/92/1372597492.db2.gz	SZGPIXVHZPHDGH-LEWJYISDSA-N	0	3	349.478	3.038	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CN([C@@H](C)c2cccc(C)c2)C[C@H]1OC	ZINC001212148183	1372664495	/nfs/dbraw/zinc/66/44/95/1372664495.db2.gz	CHYDTBXBGYLJQO-DFQSSKMNSA-N	0	3	342.483	3.065	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN(Cc2ccccc2C2CC2)C[C@H]1OC	ZINC001212349210	1372692589	/nfs/dbraw/zinc/69/25/89/1372692589.db2.gz	KFWNMXHSVDRMOZ-WOJBJXKFSA-N	0	3	342.483	3.236	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)C2(F)CCCC2)[C@H](OC)C1	ZINC001212494146	1372715454	/nfs/dbraw/zinc/71/54/54/1372715454.db2.gz	URGOFVRFCKAULW-HZPDHXFCSA-N	0	3	328.472	3.055	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)CCCCC(C)(C)C)[C@@H]2C1	ZINC001188026780	1388220062	/nfs/dbraw/zinc/22/00/62/1388220062.db2.gz	YUBOQHNQXRTLMT-ZWKOTPCHSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=C[C@@H](CC(=O)N1CC[C@@H](NCc2cccnc2C)C1)c1ccccc1	ZINC001188040531	1388224898	/nfs/dbraw/zinc/22/48/98/1388224898.db2.gz	QXDPLSAOAVVPOC-GHTZIAJQSA-N	0	3	349.478	3.440	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CN(CCCC2CCCC2)C[C@H]1OC	ZINC001213320072	1372883703	/nfs/dbraw/zinc/88/37/03/1372883703.db2.gz	LMDNQJWDMWSBFI-QXAKKESOSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)C[C@H](CC)c2ccc(C)cc2)[C@H](OC)C1	ZINC001213442688	1372906537	/nfs/dbraw/zinc/90/65/37/1372906537.db2.gz	UGHIXMLNAJKYIB-DFQSSKMNSA-N	0	3	344.499	3.270	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@@H](C)CC(C)C)[C@H](OC)C1	ZINC001213636447	1372938507	/nfs/dbraw/zinc/93/85/07/1372938507.db2.gz	NXBZWZYYHDQBET-RCCFBDPRSA-N	0	3	326.525	3.454	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)CCc2ccccc2)[C@H](OC)C1	ZINC001213775051	1372960278	/nfs/dbraw/zinc/96/02/78/1372960278.db2.gz	YMZNRUGJKNSBHH-WOJBJXKFSA-N	0	3	346.515	3.405	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CCC3CC3)C[C@H]2OC)CCCCC1	ZINC001213903489	1372978330	/nfs/dbraw/zinc/97/83/30/1372978330.db2.gz	YFJOZUZLVYQADW-QZTJIDSGSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CC[C@H](C)F)C[C@H]2OC)CCCCC1	ZINC001213903275	1372978934	/nfs/dbraw/zinc/97/89/34/1372978934.db2.gz	OGQIEGYWAOGVSM-GVDBMIGSSA-N	0	3	340.483	3.077	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H]2CN(CC[C@@H]3CC3(Cl)Cl)C[C@H]21	ZINC001188080870	1388237374	/nfs/dbraw/zinc/23/73/74/1388237374.db2.gz	NWIWELIZYNFSGN-RRFJBIMHSA-N	0	3	345.314	3.459	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H]2CN(Cc3ccccc3N(C)C)C[C@H]21	ZINC001188080974	1388237643	/nfs/dbraw/zinc/23/76/43/1388237643.db2.gz	SJDXJTSUWLNUBS-AZUAARDMSA-N	0	3	341.499	3.142	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H]2CN(CCOc3ccc(F)cc3)C[C@H]21	ZINC001188087360	1388239840	/nfs/dbraw/zinc/23/98/40/1388239840.db2.gz	PEHPJFQWYISQBS-QFBILLFUSA-N	0	3	346.446	3.094	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](C)[C@H](NCc2ccc(Cl)cc2OC)C1	ZINC001214524858	1373074340	/nfs/dbraw/zinc/07/43/40/1373074340.db2.gz	QVWVZOKXPBYSMD-RHSMWYFYSA-N	0	3	348.874	3.089	20	30		EGEDHN
CCC(C)(C)CC(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2)C1	ZINC001214710768	1373107017	/nfs/dbraw/zinc/10/70/17/1373107017.db2.gz	OEXIXXDYWHPRCT-IEBWSBKVSA-N	0	3	326.484	3.301	20	30		EGEDHN
CCC(C)(C)CC(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001214710634	1373107226	/nfs/dbraw/zinc/10/72/26/1373107226.db2.gz	HVXKBNSUMPEXMH-CZUORRHYSA-N	0	3	333.501	3.383	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001215312190	1373197246	/nfs/dbraw/zinc/19/72/46/1373197246.db2.gz	UZWJIIPLUWCKOB-CRAIPNDOSA-N	0	3	344.886	3.340	20	30		EGEDHN
C=CCCC1(C(=O)N2C[C@@H](C)[C@H](NCC=C(Cl)Cl)C2)CC1	ZINC001215481931	1373207820	/nfs/dbraw/zinc/20/78/20/1373207820.db2.gz	FAPAUFKQECMIFH-CHWSQXEVSA-N	0	3	331.287	3.488	20	30		EGEDHN
C=C(C)CNCc1cccc(N2CC[C@H](NC(=O)CCCCC)C2)n1	ZINC001128102373	1373219050	/nfs/dbraw/zinc/21/90/50/1373219050.db2.gz	QQPJHDQUTXQQPZ-SFHVURJKSA-N	0	3	344.503	3.023	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)C[C@@H]3C=CCC3)[C@H]2C1	ZINC001217248228	1373410581	/nfs/dbraw/zinc/41/05/81/1373410581.db2.gz	AKVPTDSGKYFUMS-CEXWTWQISA-N	0	3	334.504	3.225	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)[C@H]2CC[C@H](C3CCC3)CC2)s1	ZINC001129835715	1373427043	/nfs/dbraw/zinc/42/70/43/1373427043.db2.gz	PJCQEEYNDSACIW-WKILWMFISA-N	0	3	345.512	3.432	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)/C=C\C(C)(C)C)[C@H]2C1	ZINC001217572843	1373465726	/nfs/dbraw/zinc/46/57/26/1373465726.db2.gz	FASPRZIFTXDUNY-FWGLOVMOSA-N	0	3	336.520	3.471	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)C/C=C\c2ccccc2F)cc1	ZINC001130170205	1373469116	/nfs/dbraw/zinc/46/91/16/1373469116.db2.gz	RTOZDRHFSRORRE-HYXAFXHYSA-N	0	3	337.398	3.007	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)CCC3CCC3)[C@H]2C1	ZINC001217607972	1373472514	/nfs/dbraw/zinc/47/25/14/1373472514.db2.gz	VHDKNJYFLFRAGZ-RBUKOAKNSA-N	0	3	334.504	3.225	20	30		EGEDHN
CC[C@@H]1CCC[C@]1(C)C(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001130258930	1373480113	/nfs/dbraw/zinc/48/01/13/1373480113.db2.gz	SKQWCQZAEBCFKC-APWZRJJASA-N	0	3	331.435	3.120	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NCCNCc1cc(F)cc(F)c1	ZINC001130374520	1373509181	/nfs/dbraw/zinc/50/91/81/1373509181.db2.gz	UQSXIEQXBJDJIZ-UHFFFAOYSA-N	0	3	346.377	3.049	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCO[C@@H]2CN(CCCC3CCCC3)C[C@@H]21	ZINC001217998311	1373530994	/nfs/dbraw/zinc/53/09/94/1373530994.db2.gz	WGWBYTVCURXGCU-RBUKOAKNSA-N	0	3	348.531	3.471	20	30		EGEDHN
CCC[C@H]1CCC[C@@H]1C(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001130567337	1373561116	/nfs/dbraw/zinc/56/11/16/1373561116.db2.gz	UJDHMARHLMMXAH-RDJZCZTQSA-N	0	3	331.435	3.120	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)Cc3ccccc3)[C@H]2C1	ZINC001218181203	1373574046	/nfs/dbraw/zinc/57/40/46/1373574046.db2.gz	SXPKVRISVRHPMB-VQTJNVASSA-N	0	3	344.499	3.111	20	30		EGEDHN
COc1cc([O-])cc(O[C@H]2C[NH2+][C@@H]2C)c1C(=O)/C=C/c1ccccc1	ZINC001218385922	1373604336	/nfs/dbraw/zinc/60/43/36/1373604336.db2.gz	MLNUDYWXZZYUBW-IEIIEHMNSA-N	0	3	339.391	3.036	20	30		EGEDHN
C=CC[C@@H](Oc1ccc(C[C@H](N)C(N)=O)cc1)c1ccc(Cl)cc1	ZINC001218443187	1373613286	/nfs/dbraw/zinc/61/32/86/1373613286.db2.gz	RGLYOWCMABHBEA-ZWKOTPCHSA-N	0	3	344.842	3.391	20	30		EGEDHN
C#CCCCCCC(=O)N1CCO[C@@H]2CN(CCCC3CCC3)C[C@@H]21	ZINC001218455933	1373617203	/nfs/dbraw/zinc/61/72/03/1373617203.db2.gz	VQCPZUDXSVMZJP-VQTJNVASSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCO[C@@H]2CN(CCCC3CCC3)C[C@@H]21	ZINC001218518182	1373628819	/nfs/dbraw/zinc/62/88/19/1373628819.db2.gz	UHHSZFYJHDYJIB-YTQUADARSA-N	0	3	334.504	3.081	20	30		EGEDHN
CC(C)=C[C@H]1[C@H](C(=O)NCCNCc2ccc(C#N)s2)C1(C)C	ZINC001131088936	1373640951	/nfs/dbraw/zinc/64/09/51/1373640951.db2.gz	UGUXYMWWQBCHAV-JKSUJKDBSA-N	0	3	331.485	3.064	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)C[C@H](C)CC(C)(C)C)[C@H]2C1	ZINC001218682472	1373643683	/nfs/dbraw/zinc/64/36/83/1373643683.db2.gz	DVEZFECLKSDVSU-OKZBNKHCSA-N	0	3	336.520	3.327	20	30		EGEDHN
C[C@@H]1CCN[C@H](C(=O)Nc2nc(-c3ccc(C#N)s3)cs2)C1	ZINC001218787939	1373654716	/nfs/dbraw/zinc/65/47/16/1373654716.db2.gz	OIPBDHYICLRCQY-KOLCDFICSA-N	0	3	332.454	3.070	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)CCC(C)(C)C)[C@H]2C1	ZINC001218820123	1373657717	/nfs/dbraw/zinc/65/77/17/1373657717.db2.gz	YJCUSOLVQIBXPF-ZWKOTPCHSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)Nc1ccc(C2(C(=O)OC)CC2)cc1	ZINC001218976220	1373673891	/nfs/dbraw/zinc/67/38/91/1373673891.db2.gz	WOJKXVRKGAHTNH-KRWDZBQOSA-N	0	3	344.455	3.294	20	30		EGEDHN
CCCCCCCCCC(=O)N1CCO[C@@H]2CN(CC3CC3)C[C@@H]21	ZINC001219008686	1373678117	/nfs/dbraw/zinc/67/81/17/1373678117.db2.gz	VBMLVBLDJREGQI-RBUKOAKNSA-N	0	3	336.520	3.449	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2cc3cscc3s2)c1	ZINC001131475765	1373706609	/nfs/dbraw/zinc/70/66/09/1373706609.db2.gz	ZTUHXPUSKNRHNV-UHFFFAOYSA-N	0	3	341.461	3.354	20	30		EGEDHN
C[C@](N)(Cc1ccc(F)cc1)C(=O)Nc1ccc(C#N)c2ncccc12	ZINC001219467287	1373710957	/nfs/dbraw/zinc/71/09/57/1373710957.db2.gz	GCMNYOJNEAHOBU-FQEVSTJZSA-N	0	3	348.381	3.144	20	30		EGEDHN
C=CCC[C@@H](C)N1CC[C@@H]2CN(C(=O)c3ncc(Cl)s3)[C@@H]2C1	ZINC001221686010	1373789685	/nfs/dbraw/zinc/78/96/85/1373789685.db2.gz	KUMWCTROWRKMJH-JHJVBQTASA-N	0	3	339.892	3.298	20	30		EGEDHN
CCCCCCCN1CC[C@@H]2CN(C(=O)c3ccc(OC)o3)[C@@H]2C1	ZINC001221888014	1373802014	/nfs/dbraw/zinc/80/20/14/1373802014.db2.gz	NQHZAHPZEJCKJL-HZPDHXFCSA-N	0	3	334.460	3.405	20	30		EGEDHN
CCCCCCCOc1ccc(CN2CC3(C2)CNCCO3)cc1	ZINC001222441876	1373846742	/nfs/dbraw/zinc/84/67/42/1373846742.db2.gz	VHVXRABWAUNOQC-UHFFFAOYSA-N	0	3	332.488	3.210	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H]2CCN(Cc3ccsc3)[C@H]2C1	ZINC001222556951	1373853819	/nfs/dbraw/zinc/85/38/19/1373853819.db2.gz	WYQMLXXGWVVPAR-MSOLQXFVSA-N	0	3	330.497	3.365	20	30		EGEDHN
C#CCCCCC(=O)NCC1CCN(Cc2sc(C)nc2C)CC1	ZINC001222872098	1373904666	/nfs/dbraw/zinc/90/46/66/1373904666.db2.gz	JFUDEJXLSKFLAW-UHFFFAOYSA-N	0	3	347.528	3.282	20	30		EGEDHN
C#CCCCCC(=O)NCC1CCN(Cc2cccc(C#N)c2)CC1	ZINC001222872063	1373904744	/nfs/dbraw/zinc/90/47/44/1373904744.db2.gz	IMVNKPHKIVAJBX-UHFFFAOYSA-N	0	3	337.467	3.080	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@@H](C)N(CCCOc2ccccc2)C1	ZINC001131894840	1375032165	/nfs/dbraw/zinc/03/21/65/1375032165.db2.gz	CBKDNALEONOVRZ-QZTJIDSGSA-N	0	3	330.472	3.391	20	30		EGEDHN
C=CCOCCCC(=O)N[C@H]1CC[C@H](C)N(Cc2ccccc2)C1	ZINC001131939251	1375057440	/nfs/dbraw/zinc/05/74/40/1375057440.db2.gz	PAUFFIGMYWCDDJ-HKUYNNGSSA-N	0	3	330.472	3.139	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCC1CCN(Cc2cccc(C#N)c2)CC1	ZINC001224165097	1375058520	/nfs/dbraw/zinc/05/85/20/1375058520.db2.gz	GIARQYJBFWAPHE-IAGOWNOFSA-N	0	3	339.483	3.345	20	30		EGEDHN
Cc1cc2[nH]c(C(=O)NCCNCc3ccc(C#N)cc3)cc2c(C)c1	ZINC001131997903	1375090036	/nfs/dbraw/zinc/09/00/36/1375090036.db2.gz	PQXYQGZEZPSVPX-UHFFFAOYSA-N	0	3	346.434	3.176	20	30		EGEDHN
C#CCN1CCC(CNC(=O)C(C)(C)c2ccccc2Cl)CC1	ZINC001225222109	1375097679	/nfs/dbraw/zinc/09/76/79/1375097679.db2.gz	SANAVKDVYMHZBE-UHFFFAOYSA-N	0	3	332.875	3.079	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1CC[C@H](C)N(CCCOc2ccccc2)C1	ZINC001132025379	1375104338	/nfs/dbraw/zinc/10/43/38/1375104338.db2.gz	PFCBEQQRPNVKRF-RBUKOAKNSA-N	0	3	342.483	3.084	20	30		EGEDHN
C[C@@H]1CC[C@H](NC(=O)C#CC(C)(C)C)CN1CCc1ccccc1	ZINC001132033744	1375108218	/nfs/dbraw/zinc/10/82/18/1375108218.db2.gz	KQLHRNMJRJXGFR-MJGOQNOKSA-N	0	3	326.484	3.248	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)Cc2c(C)cccc2C)CC[C@H]1C	ZINC001132065514	1375129312	/nfs/dbraw/zinc/12/93/12/1375129312.db2.gz	VMWSAIGXFQSKSE-MOPGFXCFSA-N	0	3	344.499	3.018	20	30		EGEDHN
C=CCCOCC(=O)NCC1CCN(Cc2ccc(C)c(F)c2)CC1	ZINC001225625469	1375134652	/nfs/dbraw/zinc/13/46/52/1375134652.db2.gz	JCLQREAGOBNOBZ-UHFFFAOYSA-N	0	3	348.462	3.055	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@H]1CC[C@H](C)N(CCOCC2CC2)C1	ZINC001132077940	1375135653	/nfs/dbraw/zinc/13/56/53/1375135653.db2.gz	JLQAAUMRVKKJIA-BBRMVZONSA-N	0	3	342.911	3.161	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCOc2cccc(F)c2)CC[C@@H]1C	ZINC001132097416	1375146098	/nfs/dbraw/zinc/14/60/98/1375146098.db2.gz	JKXWXEXQNQYJOG-RDJZCZTQSA-N	0	3	334.435	3.140	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CCCC[C@H]1N[C@H](C)c1cnc(C)cn1	ZINC001225771572	1375153703	/nfs/dbraw/zinc/15/37/03/1375153703.db2.gz	PMAKNESZHLYNBO-KZNAEPCWSA-N	0	3	342.487	3.057	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCc2nc3ccccc3[nH]2)CC[C@H]1C	ZINC001132159772	1375176923	/nfs/dbraw/zinc/17/69/23/1375176923.db2.gz	FMYIGKBZKKPYTI-HZPDHXFCSA-N	0	3	340.471	3.041	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCc2cccc(OC)c2)CC[C@@H]1C	ZINC001132168978	1375183737	/nfs/dbraw/zinc/18/37/37/1375183737.db2.gz	ITIWUBGOCZUAGH-WMZOPIPTSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)CCc2cccc(C)c2)CC[C@H]1C	ZINC001132207496	1375209944	/nfs/dbraw/zinc/20/99/44/1375209944.db2.gz	UGGDPLJYUSBSDR-QUCCMNQESA-N	0	3	344.499	3.099	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)CCc2cccc(C)c2)CC[C@H]1C	ZINC001132207497	1375209999	/nfs/dbraw/zinc/20/99/99/1375209999.db2.gz	UGGDPLJYUSBSDR-UYAOXDASSA-N	0	3	344.499	3.099	20	30		EGEDHN
C#Cc1ccc(C(=O)Nc2ccc(CN3CCN(CC)CC3)cc2)cc1	ZINC001188727686	1388369103	/nfs/dbraw/zinc/36/91/03/1388369103.db2.gz	KYIIPYXFVFRKKO-UHFFFAOYSA-N	0	3	347.462	3.058	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC1CCN(Cc2ccc(CF)cc2)CC1	ZINC001226455561	1375262416	/nfs/dbraw/zinc/26/24/16/1375262416.db2.gz	GFUVOJUSEBOHTJ-MRXNPFEDSA-N	0	3	348.462	3.218	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2CC[C@H](C)N(CCOCC(C)C)C2)CCC1	ZINC001132283178	1375266233	/nfs/dbraw/zinc/26/62/33/1375266233.db2.gz	TVZSNIVZFKKGSV-ROUUACIJSA-N	0	3	336.520	3.375	20	30		EGEDHN
O=C(N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1)C1C=CC=CC=C1	ZINC001226498276	1375269497	/nfs/dbraw/zinc/26/94/97/1375269497.db2.gz	WUABIXSKXSUJPC-FGZHOGPDSA-N	0	3	346.474	3.354	20	30		EGEDHN
Cc1cc(C)c(C(=O)N[C@@H]2CCCC[C@H]2NCC#Cc2ccccc2)[nH]1	ZINC001227083218	1375386173	/nfs/dbraw/zinc/38/61/73/1375386173.db2.gz	PUIHQCDXIRBNRH-WOJBJXKFSA-N	0	3	349.478	3.314	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCCOc2ccc(C)cc2)CC[C@H]1C	ZINC001132459653	1375402572	/nfs/dbraw/zinc/40/25/72/1375402572.db2.gz	CLHMFRJVGLUMFE-QZTJIDSGSA-N	0	3	330.472	3.309	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCOc2cc(C)ccc2C)CC[C@@H]1C	ZINC001132472466	1375413519	/nfs/dbraw/zinc/41/35/19/1375413519.db2.gz	HIVOBQPKCYPPAQ-ZWKOTPCHSA-N	0	3	330.472	3.227	20	30		EGEDHN
CC(C)C#CC(=O)NC1CCN([C@H]2CCc3c2cccc3F)CC1	ZINC001227265346	1375414610	/nfs/dbraw/zinc/41/46/10/1375414610.db2.gz	IIANMLILNNLSFL-IBGZPJMESA-N	0	3	328.431	3.053	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCOc2ccc(OC)cc2)CC[C@@H]1C	ZINC001132499007	1375426640	/nfs/dbraw/zinc/42/66/40/1375426640.db2.gz	AJKRCNWVCLSREN-DLBZAZTESA-N	0	3	346.471	3.009	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCOc2ccccc2C)CC[C@@H]1C	ZINC001132501591	1375428134	/nfs/dbraw/zinc/42/81/34/1375428134.db2.gz	ZFKZWXGMKOWSNJ-ROUUACIJSA-N	0	3	330.472	3.309	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2c(C)oc3ccccc32)CC1	ZINC001227487268	1375436974	/nfs/dbraw/zinc/43/69/74/1375436974.db2.gz	HGZXQYOMMRJDDV-UHFFFAOYSA-N	0	3	342.439	3.138	20	30		EGEDHN
C#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)[C@@H](C)C(C)C)CC1	ZINC001132557834	1375464594	/nfs/dbraw/zinc/46/45/94/1375464594.db2.gz	DWQRQXWYCCKTSB-AZUAARDMSA-N	0	3	341.499	3.190	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2N(Cc2ccsc2)C(=O)CC2CC2)CC1	ZINC001132563337	1375469347	/nfs/dbraw/zinc/46/93/47/1375469347.db2.gz	RIVZXEHRPURDDR-GOSISDBHSA-N	0	3	342.508	3.365	20	30		EGEDHN
C#CCC1(C(=O)NC2CCN(CCCCC(F)(F)F)CC2)CCC1	ZINC001227754966	1375472020	/nfs/dbraw/zinc/47/20/20/1375472020.db2.gz	VJAKNFLBXNJJQL-UHFFFAOYSA-N	0	3	344.421	3.493	20	30		EGEDHN
CC#CCCCC(=O)NCCNCc1ccccc1C(F)(F)F	ZINC001132592721	1375478969	/nfs/dbraw/zinc/47/89/69/1375478969.db2.gz	AHEPGIYGPVYYPW-UHFFFAOYSA-N	0	3	326.362	3.105	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CCCC[C@H]1NCc1cncc(F)c1	ZINC001228111496	1375518322	/nfs/dbraw/zinc/51/83/22/1375518322.db2.gz	CFUTZKUBYVFXIV-BMGDILEWSA-N	0	3	333.451	3.340	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](C)[C@@H](CNCc2nccn2CC)C1	ZINC001132846553	1375598610	/nfs/dbraw/zinc/59/86/10/1375598610.db2.gz	JTCYZLWKRBHBKR-IRXDYDNUSA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC1CCN(CCc2scnc2C)CC1	ZINC001228588225	1375606062	/nfs/dbraw/zinc/60/60/62/1375606062.db2.gz	BRDZPCGWXOXPIB-UHFFFAOYSA-N	0	3	335.517	3.177	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CCN(Cc2cccc(OC)c2C)CC1	ZINC001228631598	1375622229	/nfs/dbraw/zinc/62/22/29/1375622229.db2.gz	QHGGXAWYIDKUOH-UHFFFAOYSA-N	0	3	330.472	3.296	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC1CCN(CCOc2cccc(F)c2)CC1	ZINC001228810584	1375684552	/nfs/dbraw/zinc/68/45/52/1375684552.db2.gz	XLHPELBPNPDBKI-MRXNPFEDSA-N	0	3	348.462	3.387	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC1CCN(Cc2ccc(OC)cc2)CC1	ZINC001228810530	1375685306	/nfs/dbraw/zinc/68/53/06/1375685306.db2.gz	WMLQKPWTXDXEPW-MRXNPFEDSA-N	0	3	330.472	3.378	20	30		EGEDHN
C[C@H]1CCN(C(=O)CCC(F)F)C[C@@H]1CNCc1ccccc1C#N	ZINC001132986283	1375694929	/nfs/dbraw/zinc/69/49/29/1375694929.db2.gz	DZQXFXMYLUDPMR-YOEHRIQHSA-N	0	3	349.425	3.178	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)CC[C@H]1CCCCO1	ZINC001228877247	1375702143	/nfs/dbraw/zinc/70/21/43/1375702143.db2.gz	CDBRBAAUEUQRTA-BZUAXINKSA-N	0	3	328.884	3.105	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1	ZINC001228903133	1375709926	/nfs/dbraw/zinc/70/99/26/1375709926.db2.gz	ZKGXRPXCOQSTEE-MISYRCLQSA-N	0	3	326.484	3.347	20	30		EGEDHN
COc1cc2c(Cl)c(C#N)cnc2cc1O[C@@H]1CN2CCC1CC2	ZINC001229106442	1375765600	/nfs/dbraw/zinc/76/56/00/1375765600.db2.gz	NPJXTPFDEKTYJR-QGZVFWFLSA-N	0	3	343.814	3.241	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc(F)c(Cl)c2)cc1F	ZINC001133097322	1375773062	/nfs/dbraw/zinc/77/30/62/1375773062.db2.gz	PVZCHDVGFICNGR-UHFFFAOYSA-N	0	3	349.768	3.009	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H]2CN(Cc3ccc(F)cc3C)C[C@H]21	ZINC001188902868	1388405253	/nfs/dbraw/zinc/40/52/53/1388405253.db2.gz	AOJJNHNRRMCUMD-AZUAARDMSA-N	0	3	342.458	3.360	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@H]1CCCC12CC2	ZINC001133399465	1375984325	/nfs/dbraw/zinc/98/43/25/1375984325.db2.gz	OSOZDJSXHIDFOF-GOSISDBHSA-N	0	3	344.886	3.472	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1cocc1C	ZINC001133401859	1375987186	/nfs/dbraw/zinc/98/71/86/1375987186.db2.gz	RAUXCROZPZXQSB-UHFFFAOYSA-N	0	3	344.842	3.497	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H]1CC12CCC2	ZINC001133405879	1375991933	/nfs/dbraw/zinc/99/19/33/1375991933.db2.gz	VDUHHBBBRUOCCI-SFHVURJKSA-N	0	3	344.886	3.472	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)CCC1(C)CC1	ZINC001133410517	1375993532	/nfs/dbraw/zinc/99/35/32/1375993532.db2.gz	KOZYCHMKZRZXAT-UHFFFAOYSA-N	0	3	332.875	3.472	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC([C@H]2CCCN2Cc2ccon2)CC1	ZINC001230586689	1376088027	/nfs/dbraw/zinc/08/80/27/1376088027.db2.gz	DYRNAHYBQKHJTI-QFBILLFUSA-N	0	3	345.487	3.480	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)c1cccs1)Cc1cccnc1	ZINC001230655910	1376117605	/nfs/dbraw/zinc/11/76/05/1376117605.db2.gz	IASTZXQZURINSX-UHFFFAOYSA-N	0	3	329.469	3.341	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)c1ccsc1	ZINC001133633591	1376129054	/nfs/dbraw/zinc/12/90/54/1376129054.db2.gz	UVZYRDOVMQNTEF-QWRGUYRKSA-N	0	3	331.279	3.143	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)C[C@@H](C)SC)Cc1cccnc1	ZINC001230733998	1376137171	/nfs/dbraw/zinc/13/71/71/1376137171.db2.gz	COBKSMGZVVCNNV-MRXNPFEDSA-N	0	3	335.517	3.108	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H](C)C[C@@H](C)NCc2ccccc2C#N)o1	ZINC001133653625	1376140036	/nfs/dbraw/zinc/14/00/36/1376140036.db2.gz	TWBBAYIQFYXOLT-ZIAGYGMSSA-N	0	3	325.412	3.146	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)C1(F)CCCC1)Cc1cccnc1	ZINC001230796944	1376151966	/nfs/dbraw/zinc/15/19/66/1376151966.db2.gz	QSKPHNCVDVTUQK-UHFFFAOYSA-N	0	3	333.451	3.248	20	30		EGEDHN
C#CCCN(CCCNC(=O)[C@H]1CCCC[C@@H]1C)Cc1cccnc1	ZINC001230829326	1376161915	/nfs/dbraw/zinc/16/19/15/1376161915.db2.gz	FLRICUNBBMXVJW-ICSRJNTNSA-N	0	3	341.499	3.240	20	30		EGEDHN
C#CCCN(CCCNC(=O)C[C@H](C)C(C)(C)C)Cc1cccnc1	ZINC001230912038	1376182836	/nfs/dbraw/zinc/18/28/36/1376182836.db2.gz	VBBHLPDEAIELRB-SFHVURJKSA-N	0	3	343.515	3.486	20	30		EGEDHN
Cc1ccc2ccccc2c1CN1CC[C@@H]1CN(C)C(=O)[C@@H](C)C#N	ZINC001231284794	1376222191	/nfs/dbraw/zinc/22/21/91/1376222191.db2.gz	WKGCGHIRRANOIJ-FUHWJXTLSA-N	0	3	335.451	3.341	20	30		EGEDHN
C[C@H](C#N)C(=O)N(C)C[C@H]1CCN1CCc1ccc2ccccc2c1	ZINC001231292696	1376223024	/nfs/dbraw/zinc/22/30/24/1376223024.db2.gz	FDWQUNFHDBGNDR-OXQOHEQNSA-N	0	3	335.451	3.075	20	30		EGEDHN
C=CCOc1cccc(CN2CCC3(CCN(CC)C3=O)CC2)c1	ZINC001231623967	1376284191	/nfs/dbraw/zinc/28/41/91/1376284191.db2.gz	DQTSMNQAHOSNMB-UHFFFAOYSA-N	0	3	328.456	3.086	20	30		EGEDHN
C=CCOc1cccc(CN2CC[C@@H](Oc3ccnc(OC)c3)C2)c1	ZINC001231624928	1376284818	/nfs/dbraw/zinc/28/48/18/1376284818.db2.gz	NAKXPLIHHSYFFJ-LJQANCHMSA-N	0	3	340.423	3.308	20	30		EGEDHN
C=CCOc1cccc(CN2CC[C@@H](Oc3ccc(OC)cn3)C2)c1	ZINC001231625363	1376285028	/nfs/dbraw/zinc/28/50/28/1376285028.db2.gz	UPLUAJFUSIVOGU-LJQANCHMSA-N	0	3	340.423	3.308	20	30		EGEDHN
C#Cc1cccc(CN2CC[C@@H]3[C@H]2CCC(=O)N3c2ccccc2)c1	ZINC001231656580	1376296160	/nfs/dbraw/zinc/29/61/60/1376296160.db2.gz	AYUVLLIJSIRCIB-NHCUHLMSSA-N	0	3	330.431	3.438	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H]2CN(CCOc3ccccc3C)C[C@H]21	ZINC001189007210	1388435054	/nfs/dbraw/zinc/43/50/54/1388435054.db2.gz	PQMZPNNFBXMMFT-RBUKOAKNSA-N	0	3	342.483	3.263	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)c1cscc1C	ZINC001134035886	1376322839	/nfs/dbraw/zinc/32/28/39/1376322839.db2.gz	WJTHBFRNMBNKEW-NEPJUHHUSA-N	0	3	345.306	3.452	20	30		EGEDHN
C=CCN1C(=O)CCC[C@]12CCCN(Cc1cc(C)nc(C)c1)C2	ZINC001231997060	1376375228	/nfs/dbraw/zinc/37/52/28/1376375228.db2.gz	KKPAKNUJXIIMOC-HXUWFJFHSA-N	0	3	327.472	3.232	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H](C)C[C@@H](C)NCc1ccncc1Cl	ZINC001134115568	1376375718	/nfs/dbraw/zinc/37/57/18/1376375718.db2.gz	UOJXAHVZQXJZBX-CABCVRRESA-N	0	3	335.879	3.302	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H](C)C[C@@H](C)NCc1cc(C2CC2)no1	ZINC001134119314	1376377673	/nfs/dbraw/zinc/37/76/73/1376377673.db2.gz	PFQODQIXGVESHP-CABCVRRESA-N	0	3	331.460	3.119	20	30		EGEDHN
Cc1ccc(CC(=O)N[C@@H](C)C[C@@H](C)NCc2ccccc2C#N)o1	ZINC001134156649	1376390976	/nfs/dbraw/zinc/39/09/76/1376390976.db2.gz	NPXDRTHFDWRHAR-CABCVRRESA-N	0	3	339.439	3.075	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H](C)C[C@@H](C)NCc2cc(F)ccc2C#N)co1	ZINC001134176454	1376400178	/nfs/dbraw/zinc/40/01/78/1376400178.db2.gz	BDGPHJBWYRRXNI-OLZOCXBDSA-N	0	3	343.402	3.286	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3ccc(C#N)c(Cl)c3)C2)C1=O	ZINC001232113396	1376400441	/nfs/dbraw/zinc/40/04/41/1376400441.db2.gz	UIUWEXXQIRWFFA-LJQANCHMSA-N	0	3	343.858	3.212	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)c1ccoc1Cl	ZINC001134250797	1376434071	/nfs/dbraw/zinc/43/40/71/1376434071.db2.gz	AYJAKRGLDZEKNK-ZJUUUORDSA-N	0	3	349.656	3.328	20	30		EGEDHN
CCc1occc1C(=O)N[C@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001134273442	1376449050	/nfs/dbraw/zinc/44/90/50/1376449050.db2.gz	GHEBMFHDSFZDRR-HUUCEWRRSA-N	0	3	339.439	3.400	20	30		EGEDHN
CC/C(C)=C\C(=O)N[C@H](C)C[C@@H](C)NCc1cc(F)ccc1C#N	ZINC001134285406	1376458312	/nfs/dbraw/zinc/45/83/12/1376458312.db2.gz	RPJVZJDPUDFBJC-CDWBCPPQSA-N	0	3	331.435	3.427	20	30		EGEDHN
CCC(CC)n1ccc(CN[C@@H](C)C[C@H](C)NC(=O)C#CC(C)C)n1	ZINC001134346073	1376488232	/nfs/dbraw/zinc/48/82/32/1376488232.db2.gz	YSMPFRPRFTZXRC-IRXDYDNUSA-N	0	3	346.519	3.277	20	30		EGEDHN
CCC(CC)n1ccc(CN[C@@H](C)C[C@@H](C)NC(=O)C#CC(C)C)n1	ZINC001134346071	1376488496	/nfs/dbraw/zinc/48/84/96/1376488496.db2.gz	YSMPFRPRFTZXRC-DLBZAZTESA-N	0	3	346.519	3.277	20	30		EGEDHN
C=CCO[C@@H]1CO[C@]2(C1)CCCN(Cc1c(C)cccc1OC)C2	ZINC001232622670	1376491324	/nfs/dbraw/zinc/49/13/24/1376491324.db2.gz	TUMLVYDOMZRQNT-PXNSSMCTSA-N	0	3	331.456	3.330	20	30		EGEDHN
CC(C)[C@H](C(=O)NCCNCc1cccc(C#N)c1)c1ccccc1	ZINC001134412591	1376516503	/nfs/dbraw/zinc/51/65/03/1376516503.db2.gz	DCTAFYIRBDYKQO-FQEVSTJZSA-N	0	3	335.451	3.204	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCCN(Cc3cc(Cl)ncc3O)C2)cc1	ZINC001233037676	1376559307	/nfs/dbraw/zinc/55/93/07/1376559307.db2.gz	GPTOXBYIHPIIJO-MRXNPFEDSA-N	0	3	343.814	3.356	20	30		EGEDHN
CCc1ccc(C(=O)N[C@H](C)C[C@@H](C)NCc2ccccc2C#N)o1	ZINC001134752685	1376699945	/nfs/dbraw/zinc/69/99/45/1376699945.db2.gz	RNUMPNHIHGFRNB-HUUCEWRRSA-N	0	3	339.439	3.400	20	30		EGEDHN
CC#CCN(C)[C@@H]1CCCN(C(=O)c2cscc2C(F)F)C1	ZINC001752990816	1440259324	/nfs/dbraw/zinc/25/93/24/1440259324.db2.gz	JDTSHQKURZAUJY-GFCCVEGCSA-N	0	3	326.412	3.245	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N(C)C[C@H]2CCN2CCC2CC2)cc1	ZINC001234255659	1376792612	/nfs/dbraw/zinc/79/26/12/1376792612.db2.gz	OXTHVSWUGXRQOC-LJQANCHMSA-N	0	3	340.467	3.035	20	30		EGEDHN
C=CCCOCCCCC(=O)N(C)C[C@@H]1CCN1CC[C@H](C)F	ZINC001234276203	1376797921	/nfs/dbraw/zinc/79/79/21/1376797921.db2.gz	JZFQNZFITSTAJL-IRXDYDNUSA-N	0	3	328.472	3.030	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)CCOc1cccc(C)c1C	ZINC001235035954	1376833929	/nfs/dbraw/zinc/83/39/29/1376833929.db2.gz	IEFLKJOYTIGMHD-SFHVURJKSA-N	0	3	330.472	3.181	20	30		EGEDHN
C=CCCCCCN1CC[C@@H]1CN(C)C(=O)c1cc(C2CC2)n(C)n1	ZINC001235038845	1376836876	/nfs/dbraw/zinc/83/68/76/1376836876.db2.gz	XUHPARHYIMLLAA-QGZVFWFLSA-N	0	3	344.503	3.190	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)[C@@H](C)c1ccccc1	ZINC001753016884	1440268706	/nfs/dbraw/zinc/26/87/06/1440268706.db2.gz	MLYVQPYHTIYOTC-KGLIPLIRSA-N	0	3	339.277	3.183	20	30		EGEDHN
C[C@H]([C@H](C)C(=O)NCCNCc1ccc(F)c(C#N)c1)C(C)(C)C	ZINC001135178334	1376951839	/nfs/dbraw/zinc/95/18/39/1376951839.db2.gz	TWFWRZWGTLQCNF-UONOGXRCSA-N	0	3	333.451	3.221	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc3c(c2)C=CCC3)cc1F	ZINC001135196633	1376967601	/nfs/dbraw/zinc/96/76/01/1376967601.db2.gz	AXNXSZCOJLGHPJ-UHFFFAOYSA-N	0	3	349.409	3.176	20	30		EGEDHN
C=CCCCC(=O)N[C@H](C)C[C@H](C)NCc1cc(F)ccc1C#N	ZINC001135358369	1377051514	/nfs/dbraw/zinc/05/15/14/1377051514.db2.gz	QYSUUDNBEUHNDU-LSDHHAIUSA-N	0	3	331.435	3.427	20	30		EGEDHN
CCc1ccoc1C(=O)N[C@@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001135387272	1377067239	/nfs/dbraw/zinc/06/72/39/1377067239.db2.gz	MRBFYKXBDSMHON-GJZGRUSLSA-N	0	3	339.439	3.400	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)C1(C(C)C)CC1	ZINC001135434455	1377094969	/nfs/dbraw/zinc/09/49/69/1377094969.db2.gz	JITARHYXXFZUTK-CHWSQXEVSA-N	0	3	331.298	3.204	20	30		EGEDHN
Cc1cccc(C(=O)NCCNCc2cccc(C#N)c2)c1Cl	ZINC001135529461	1377131092	/nfs/dbraw/zinc/13/10/92/1377131092.db2.gz	SXFCXNWAZXVFES-UHFFFAOYSA-N	0	3	327.815	3.040	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc(C(F)F)cc2F)cc1	ZINC001135777127	1377209368	/nfs/dbraw/zinc/20/93/68/1377209368.db2.gz	RQLMISLYPGAHQZ-UHFFFAOYSA-N	0	3	347.340	3.155	20	30		EGEDHN
CC[C@@H]1CCCC[C@@H]1C(=O)NCCNCc1ccc(C#N)c(F)c1	ZINC001136081177	1377334195	/nfs/dbraw/zinc/33/41/95/1377334195.db2.gz	QIBBAAHUBQHIGF-WBVHZDCISA-N	0	3	331.435	3.120	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)c1cc(C)c(C)s1	ZINC001267157285	1377419237	/nfs/dbraw/zinc/41/92/37/1377419237.db2.gz	LGUDVJSNZRPKRG-LLVKDONJSA-N	0	3	345.306	3.372	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(OCC#N)cc2)CCC[C@]1(O)C(F)(F)F	ZINC001137115316	1377481248	/nfs/dbraw/zinc/48/12/48/1377481248.db2.gz	IJCTXDXZQYNCDL-CZUORRHYSA-N	0	3	342.361	3.114	20	30		EGEDHN
N#CCOc1ccc(CN2CCC(O)(c3ccc(F)cc3)CC2)cc1	ZINC001137119462	1377481587	/nfs/dbraw/zinc/48/15/87/1377481587.db2.gz	PQKRRDHNGXVSHG-UHFFFAOYSA-N	0	3	340.398	3.212	20	30		EGEDHN
Cc1cccc(O[C@H]2CCCN(Cc3ccc(OCC#N)cc3)C2)n1	ZINC001137122492	1377482355	/nfs/dbraw/zinc/48/23/55/1377482355.db2.gz	DEYVZBJGTDPISV-IBGZPJMESA-N	0	3	337.423	3.336	20	30		EGEDHN
CN(c1ccc(C#N)cc1)c1ccc(CN2CC3(CN(C)C3)C2)cc1	ZINC001137904309	1377641725	/nfs/dbraw/zinc/64/17/25/1377641725.db2.gz	XQYHPUZAMOLABV-UHFFFAOYSA-N	0	3	332.451	3.074	20	30		EGEDHN
C#CCOc1ccc(CN2CCC[C@@](O)(C(F)(F)F)[C@@H](C)C2)cc1	ZINC001138556009	1377741709	/nfs/dbraw/zinc/74/17/09/1377741709.db2.gz	AUSNMSNNCQSSKF-YOEHRIQHSA-N	0	3	341.373	3.224	20	30		EGEDHN
C#CCOc1ccc(CN2CCC[C@@H]2CC(=O)OC(C)(C)C)cc1	ZINC001138560225	1377742167	/nfs/dbraw/zinc/74/21/67/1377742167.db2.gz	MLIJBMJKHHGNGG-QGZVFWFLSA-N	0	3	329.440	3.395	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CC(CCNC(=O)OC(C)(C)C)C2)c1[O-]	ZINC001138627650	1377756741	/nfs/dbraw/zinc/75/67/41/1377756741.db2.gz	DNFONXWLIPTZQY-UHFFFAOYSA-N	0	3	346.471	3.467	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2Cc3ccccc3[C@H](C(=O)OC)C2)c1[O-]	ZINC001138630101	1377757732	/nfs/dbraw/zinc/75/77/32/1377757732.db2.gz	QYJHTLADGOIKHS-LJQANCHMSA-N	0	3	337.419	3.393	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2Cc3ccccc3[C@H](C(=O)OC)C2)c1[O-]	ZINC001138630101	1377757734	/nfs/dbraw/zinc/75/77/34/1377757734.db2.gz	QYJHTLADGOIKHS-LJQANCHMSA-N	0	3	337.419	3.393	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CCN(c3cccc(C#N)c3)CC2)c1[O-]	ZINC001138630021	1377757917	/nfs/dbraw/zinc/75/79/17/1377757917.db2.gz	OAPLNKMZHKEDJB-UHFFFAOYSA-N	0	3	333.435	3.315	20	30		EGEDHN
C=C(C)COc1ccccc1CN1CCC2(CC(=O)N(C)C2)CC1	ZINC001138666248	1377765250	/nfs/dbraw/zinc/76/52/50/1377765250.db2.gz	NCKNUSQQNLHANY-UHFFFAOYSA-N	0	3	328.456	3.086	20	30		EGEDHN
C=CCOc1ccccc1CN1CC[C@@]2(CCCN2C(=O)C(C)C)C1	ZINC001139032593	1377820232	/nfs/dbraw/zinc/82/02/32/1377820232.db2.gz	QDQTXRZEGBFEDK-NRFANRHFSA-N	0	3	342.483	3.474	20	30		EGEDHN
C=CCOc1ccccc1CN1CC[C@]2(C1)CCCCN2C(C)=O	ZINC001139032915	1377820359	/nfs/dbraw/zinc/82/03/59/1377820359.db2.gz	WUXDNEGYJMFTGD-FQEVSTJZSA-N	0	3	328.456	3.228	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(Oc3ccc(C#N)cc3)nc2)CCC[C@@H]1O	ZINC001139426641	1377882269	/nfs/dbraw/zinc/88/22/69/1377882269.db2.gz	HRIRSLMVRBMBIU-BEFAXECRSA-N	0	3	337.423	3.338	20	30		EGEDHN
N#Cc1ccc(F)c(CN2CCC3(CC2)C(=O)N[C@H]3c2ccccc2)c1	ZINC001139649169	1377926576	/nfs/dbraw/zinc/92/65/76/1377926576.db2.gz	QHRHRLOEUWLRJH-IBGZPJMESA-N	0	3	349.409	3.151	20	30		EGEDHN
CCc1nc(C2CCN(Cc3c[nH]c4ccc(C#N)cc34)CC2)no1	ZINC001140115575	1378012128	/nfs/dbraw/zinc/01/21/28/1378012128.db2.gz	HMMDHAVWDHENHM-UHFFFAOYSA-N	0	3	335.411	3.365	20	30		EGEDHN
C=CCOCc1nn(C)c2c1CN(Cc1c(C)ccc(C)c1O)CC2	ZINC001140180382	1378027176	/nfs/dbraw/zinc/02/71/76/1378027176.db2.gz	GIVJJZGNYARXFO-UHFFFAOYSA-N	0	3	341.455	3.003	20	30		EGEDHN
C=C(C)CN1CC[C@]2(CCCN(Cc3cccc(C#N)c3)CC2)C1=O	ZINC001272651671	1378077211	/nfs/dbraw/zinc/07/72/11/1378077211.db2.gz	VPZVQAPQEPQEHT-OAQYLSRUSA-N	0	3	337.467	3.339	20	30		EGEDHN
C=CCN1C[C@@]2(CC1=O)CCCCN2Cc1ccc2ccccc2n1	ZINC001273007160	1378085201	/nfs/dbraw/zinc/08/52/01/1378085201.db2.gz	YKEHYUYENHSRFW-NRFANRHFSA-N	0	3	335.451	3.378	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@]3(CCN(CC(C)C)C3=O)C2)c1[O-]	ZINC001273360777	1378098757	/nfs/dbraw/zinc/09/87/57/1378098757.db2.gz	VYRRTGADUJRQGO-NRFANRHFSA-N	0	3	342.483	3.201	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@]3(CCN(CC(C)C)C3=O)C2)c1[O-]	ZINC001273360777	1378098759	/nfs/dbraw/zinc/09/87/59/1378098759.db2.gz	VYRRTGADUJRQGO-NRFANRHFSA-N	0	3	342.483	3.201	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CN(Cc3ccc(OC)cc3C)C2)CC1	ZINC001140675743	1378111763	/nfs/dbraw/zinc/11/17/63/1378111763.db2.gz	STAGIZSOWLHRJX-UHFFFAOYSA-N	0	3	344.455	3.224	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cc(Cl)ccc1N)CC2	ZINC001140715311	1378122834	/nfs/dbraw/zinc/12/28/34/1378122834.db2.gz	LLARBPHAGKWBKS-IBGZPJMESA-N	0	3	347.890	3.455	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3cc(O)cc(Cl)c3)C2)C1=O	ZINC001140788734	1378136253	/nfs/dbraw/zinc/13/62/53/1378136253.db2.gz	SRLPXCFCUGHPKB-SFHVURJKSA-N	0	3	334.847	3.046	20	30		EGEDHN
N#Cc1cccc(O[C@@H]2CCCN(Cc3ccn4ccnc4c3)C2)c1	ZINC001141046497	1378218453	/nfs/dbraw/zinc/21/84/53/1378218453.db2.gz	CKHHVAZTGZMEJS-LJQANCHMSA-N	0	3	332.407	3.249	20	30		EGEDHN
C=CCN1C(=O)CCC[C@@]12CCCN(Cc1cc3cccnc3[nH]1)C2	ZINC001143214600	1378561548	/nfs/dbraw/zinc/56/15/48/1378561548.db2.gz	PVVQEOKDUZBABI-FQEVSTJZSA-N	0	3	338.455	3.096	20	30		EGEDHN
COc1cc(CN2CCC3SC(=O)C=C3C2)cc(C(F)(F)F)c1	ZINC001143513330	1378606856	/nfs/dbraw/zinc/60/68/56/1378606856.db2.gz	AEWVQKKLWINCLK-CQSZACIVSA-N	0	3	343.370	3.488	20	30		EGEDHN
CN(Cc1cncc(C#N)c1)[C@H]1CC[C@H](NC(=O)OC(C)(C)C)CC1	ZINC001144085161	1378680472	/nfs/dbraw/zinc/68/04/72/1378680472.db2.gz	VJVWOYNLPATWKW-QAQDUYKDSA-N	0	3	344.459	3.221	20	30		EGEDHN
C#Cc1ccc(CN2CCC3(CC2)C(=O)Nc2c3cccc2F)cc1	ZINC001144573960	1378747400	/nfs/dbraw/zinc/74/74/00/1378747400.db2.gz	VZCJLAUMTCLFJD-UHFFFAOYSA-N	0	3	334.394	3.293	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2nccs2)CCCCC1	ZINC001146661852	1378892464	/nfs/dbraw/zinc/89/24/64/1378892464.db2.gz	CTGHLVBDLAYUPT-CVEARBPZSA-N	0	3	347.528	3.490	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)c1ccc(F)s1	ZINC001146712446	1378904972	/nfs/dbraw/zinc/90/49/72/1378904972.db2.gz	BMDWMNOMZZUVPB-NXEZZACHSA-N	0	3	349.269	3.282	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)c1ccc(F)s1)NCc1ccccc1C#N	ZINC001146735628	1378910875	/nfs/dbraw/zinc/91/08/75/1378910875.db2.gz	PGSCCVIEBAVVQJ-OLZOCXBDSA-N	0	3	345.443	3.446	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2nccnc2C)CCCC1	ZINC001146821448	1378928625	/nfs/dbraw/zinc/92/86/25/1378928625.db2.gz	MEVOMRHUQPNGIF-HZPDHXFCSA-N	0	3	344.503	3.294	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2cc(C)n(C)n2)CCCC1	ZINC001146822650	1378928686	/nfs/dbraw/zinc/92/86/86/1378928686.db2.gz	UBFKZJVFECKRKA-CVEARBPZSA-N	0	3	346.519	3.238	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2ccn(CC)n2)CCCC1	ZINC001146823444	1378929253	/nfs/dbraw/zinc/92/92/53/1378929253.db2.gz	ZZEOKMKXXUCSLL-IRXDYDNUSA-N	0	3	346.519	3.412	20	30		EGEDHN
CCCCCC(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001147009494	1378956019	/nfs/dbraw/zinc/95/60/19/1378956019.db2.gz	JUPAOYVGWSIYDO-UHFFFAOYSA-N	0	3	325.456	3.173	20	30		EGEDHN
C[C@H](CN(C)C(=O)C(C)(C)C1CCC1)NCc1ccc(F)c(C#N)c1	ZINC001283649191	1379080254	/nfs/dbraw/zinc/08/02/54/1379080254.db2.gz	NDWICOPKHHXEJG-CQSZACIVSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001148088182	1379114047	/nfs/dbraw/zinc/11/40/47/1379114047.db2.gz	JGXGEUYWFKGBNQ-INGKJJEOSA-N	0	3	335.451	3.115	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)N1CC2(C1)CCN(CCOc1ccccc1)C2	ZINC001148095200	1379116875	/nfs/dbraw/zinc/11/68/75/1379116875.db2.gz	DVEAAICZDWIFOL-MSOLQXFVSA-N	0	3	342.483	3.058	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001148130209	1379122513	/nfs/dbraw/zinc/12/25/13/1379122513.db2.gz	LYUGFEZJUZEXSU-KRWDZBQOSA-N	0	3	337.467	3.195	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)CCCCc3ccc(F)cc3)C2)C1	ZINC001148343542	1379154786	/nfs/dbraw/zinc/15/47/86/1379154786.db2.gz	VOXQLVRVJIPMCM-UHFFFAOYSA-N	0	3	330.447	3.259	20	30		EGEDHN
CCCCCCCCC(=O)N1CC2(C1)CCN(CCn1cccn1)C2	ZINC001148666511	1379236973	/nfs/dbraw/zinc/23/69/73/1379236973.db2.gz	XIGINEOJBOMNMT-UHFFFAOYSA-N	0	3	346.519	3.168	20	30		EGEDHN
CCCCCCCCCCC(=O)NCCNCc1cn(C)nc1C	ZINC001148763901	1379264188	/nfs/dbraw/zinc/26/41/88/1379264188.db2.gz	JFCYSQSGPDFCJC-UHFFFAOYSA-N	0	3	336.524	3.465	20	30		EGEDHN
CCCCCCCCCC(=O)NCCN[C@@H](C)C(=O)N(C)C(C)C	ZINC001148827040	1379277460	/nfs/dbraw/zinc/27/74/60/1379277460.db2.gz	TXXWGKWASLPODM-KRWDZBQOSA-N	0	3	341.540	3.088	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)C/C=C\c2cccc(F)c2)C1	ZINC001149868338	1379458446	/nfs/dbraw/zinc/45/84/46/1379458446.db2.gz	GPOARPRWPWFWJI-BQHGXPCASA-N	0	3	346.446	3.012	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2sccc2C2CC2)cc1F	ZINC001150034581	1379486976	/nfs/dbraw/zinc/48/69/76/1379486976.db2.gz	NAGQYWYOEGDKRD-UHFFFAOYSA-N	0	3	343.427	3.156	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@@H]1CN(Cc2ccccc2C)CCCO1	ZINC001150159346	1379505587	/nfs/dbraw/zinc/50/55/87/1379505587.db2.gz	GUOQWBPJSNJSFS-AZUAARDMSA-N	0	3	344.499	3.304	20	30		EGEDHN
CCc1cc(C(=O)NCCNCc2ccc(F)c(C#N)c2)sc1C	ZINC001150387036	1379544389	/nfs/dbraw/zinc/54/43/89/1379544389.db2.gz	FPIQCPQOMFXTNN-UHFFFAOYSA-N	0	3	345.443	3.149	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)C[C@H]2CCCCC2(C)C)C1	ZINC001150829960	1379620282	/nfs/dbraw/zinc/62/02/82/1379620282.db2.gz	BGZBNHFLLOMQJV-MSOLQXFVSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@@H]2CCC[C@H](C)C2)CC1	ZINC001151281267	1379692351	/nfs/dbraw/zinc/69/23/51/1379692351.db2.gz	IFPNCWQLPWWCKU-ZWKOTPCHSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)C2C[C@H](C)C[C@@H](C)C2)CC1	ZINC001151412556	1379714780	/nfs/dbraw/zinc/71/47/80/1379714780.db2.gz	IZLRGZAMLKJILP-IAGOWNOFSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2sccc2CC)CC1	ZINC001151415079	1379715992	/nfs/dbraw/zinc/71/59/92/1379715992.db2.gz	AWKNYVZAHJSNRC-UHFFFAOYSA-N	0	3	336.501	3.097	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)/C=C\c1ccco1	ZINC001151598177	1379744356	/nfs/dbraw/zinc/74/43/56/1379744356.db2.gz	YYTAOXWVXRSHGZ-ZBTGYSDGSA-N	0	3	337.423	3.191	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)CC1CCCC1	ZINC001151643486	1379753444	/nfs/dbraw/zinc/75/34/44/1379753444.db2.gz	BVRBZAMBVHAIJW-MRXNPFEDSA-N	0	3	327.472	3.465	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)c1ccoc1C	ZINC001151793124	1379781466	/nfs/dbraw/zinc/78/14/66/1379781466.db2.gz	YWZSWWUQZRWOFS-CQSZACIVSA-N	0	3	325.412	3.100	20	30		EGEDHN
C=C[C@@H](CC(=O)NCCNCc1ccc(C)nc1C)c1ccccc1	ZINC001151942329	1379820219	/nfs/dbraw/zinc/82/02/19/1379820219.db2.gz	FIOZUAJALOQURY-SFHVURJKSA-N	0	3	337.467	3.264	20	30		EGEDHN
CCCSCC(=O)NC[C@@H](C)N(CC)Cc1cccc(C#N)c1	ZINC001152114527	1379864068	/nfs/dbraw/zinc/86/40/68/1379864068.db2.gz	DSWSIIOBJVXUAV-OAHLLOKOSA-N	0	3	333.501	3.028	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)/C=C(\C)C1CC1	ZINC001152128118	1379868186	/nfs/dbraw/zinc/86/81/86/1379868186.db2.gz	GJQUAWZMQYBSPY-AAGJOFLKSA-N	0	3	325.456	3.241	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)CCC(F)(F)F	ZINC001152573197	1379951000	/nfs/dbraw/zinc/95/10/00/1379951000.db2.gz	FZFPDJCQLVXZIL-CYBMUJFWSA-N	0	3	341.377	3.227	20	30		EGEDHN
CCN(Cc1cc(C)sc1C)[C@H](C)CNC(=O)c1c[nH]c(C#N)c1	ZINC001152882640	1379990149	/nfs/dbraw/zinc/99/01/49/1379990149.db2.gz	FYUYGWXCOSTGJQ-GFCCVEGCSA-N	0	3	344.484	3.205	20	30		EGEDHN
CCc1occc1C(=O)NC[C@@H](C)N(CC)Cc1cccc(C#N)c1	ZINC001153042121	1380012767	/nfs/dbraw/zinc/01/27/67/1380012767.db2.gz	YXHRAOXBJSTUIY-OAHLLOKOSA-N	0	3	339.439	3.354	20	30		EGEDHN
C=C[C@@](C)(O)CC(=O)NC[C@@H](C)N(CC)Cc1cc(C)sc1C	ZINC001153091093	1380018915	/nfs/dbraw/zinc/01/89/15/1380018915.db2.gz	WGQYCMQKDKYJAT-FZKQIMNGSA-N	0	3	338.517	3.019	20	30		EGEDHN
CCc1[nH]ccc1C(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)cc1	ZINC001153126699	1380026117	/nfs/dbraw/zinc/02/61/17/1380026117.db2.gz	GYJFEYOTGFWGSX-OAHLLOKOSA-N	0	3	338.455	3.089	20	30		EGEDHN
CCCOc1cccc(CN(CC)[C@H](C)CNC(=O)C#CC2CC2)c1	ZINC001153232850	1380041181	/nfs/dbraw/zinc/04/11/81/1380041181.db2.gz	MSOOIJDKEBMIBH-QGZVFWFLSA-N	0	3	342.483	3.215	20	30		EGEDHN
C[C@@H]1CCCC[C@@H]1CC(=O)NCCNCc1ccc(C#N)c(F)c1	ZINC001153251414	1380044642	/nfs/dbraw/zinc/04/46/42/1380044642.db2.gz	BHCPDEPLVBKREA-GDBMZVCRSA-N	0	3	331.435	3.120	20	30		EGEDHN
CCCCCCC[N@H+](CC)[C@H](C)CNC(=O)c1cccc2n[n-]nc21	ZINC001153548653	1380090906	/nfs/dbraw/zinc/09/09/06/1380090906.db2.gz	KAQUDJVRGFXNEQ-OAHLLOKOSA-N	0	3	345.491	3.369	20	30		EGEDHN
CCCCCCC[N@@H+](CC)[C@H](C)CNC(=O)c1cccc2n[n-]nc21	ZINC001153548653	1380090909	/nfs/dbraw/zinc/09/09/09/1380090909.db2.gz	KAQUDJVRGFXNEQ-OAHLLOKOSA-N	0	3	345.491	3.369	20	30		EGEDHN
C#CC[C@H](CC(=O)NCCNCc1ccc(F)cc1)c1ccccc1	ZINC001153714474	1380117261	/nfs/dbraw/zinc/11/72/61/1380117261.db2.gz	MVMNDLSXSJFRTE-LJQANCHMSA-N	0	3	338.426	3.229	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)[C@H]1CCC(F)(F)C1	ZINC001153743806	1380121458	/nfs/dbraw/zinc/12/14/58/1380121458.db2.gz	ONQYDRJDGLZIHB-PBHICJAKSA-N	0	3	349.425	3.320	20	30		EGEDHN
C=CCC1(C(=O)NCCNCc2cc(C)ccc2OC)CCCC1	ZINC001153809123	1380133606	/nfs/dbraw/zinc/13/36/06/1380133606.db2.gz	CBADKAAGQOOLTJ-UHFFFAOYSA-N	0	3	330.472	3.346	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)[C@@H](C)C1CCC1	ZINC001153974949	1380166545	/nfs/dbraw/zinc/16/65/45/1380166545.db2.gz	RTVPUHNDKHMRJI-CVEARBPZSA-N	0	3	327.472	3.321	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)[C@H](C)C1CCC1	ZINC001153974950	1380166746	/nfs/dbraw/zinc/16/67/46/1380166746.db2.gz	RTVPUHNDKHMRJI-HZPDHXFCSA-N	0	3	327.472	3.321	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)CC1CC(F)(F)C1	ZINC001154073941	1380199079	/nfs/dbraw/zinc/19/90/79/1380199079.db2.gz	GNXMJERIDSXNCD-CQSZACIVSA-N	0	3	349.425	3.320	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)C1(F)CCCC1	ZINC001154102693	1380208985	/nfs/dbraw/zinc/20/89/85/1380208985.db2.gz	HZFHNGJXGXKLAN-OAHLLOKOSA-N	0	3	331.435	3.167	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)cc1	ZINC001154719644	1380339725	/nfs/dbraw/zinc/33/97/25/1380339725.db2.gz	JZQKFCOJHZAYKX-QGZVFWFLSA-N	0	3	325.456	3.078	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)cc1	ZINC001154751266	1380346124	/nfs/dbraw/zinc/34/61/24/1380346124.db2.gz	SRVRJKQONKEXRK-IAGOWNOFSA-N	0	3	327.472	3.487	20	30		EGEDHN
CCCC1(C(=O)NC[C@@H](C)N(CC)Cc2cccc(C#N)c2)CC1	ZINC001155086018	1380405909	/nfs/dbraw/zinc/40/59/09/1380405909.db2.gz	YAWVQFUJZZFNFH-MRXNPFEDSA-N	0	3	327.472	3.465	20	30		EGEDHN
N#Cc1ccc(Cl)nc1C(F)(F)n1nc(CN)c2ccccc21	ZINC001156855688	1380697754	/nfs/dbraw/zinc/69/77/54/1380697754.db2.gz	LWLNEIZVKIUXLW-UHFFFAOYSA-N	0	3	333.729	3.013	20	30		EGEDHN
C#CCCCC(=O)NCCCNCc1csc(-c2ccsc2)n1	ZINC001157182871	1380799435	/nfs/dbraw/zinc/79/94/35/1380799435.db2.gz	HSQNYXAJDPCJFL-UHFFFAOYSA-N	0	3	347.509	3.271	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C[C@@H](C)c1cccc(OC)c1	ZINC001157203547	1380808596	/nfs/dbraw/zinc/80/85/96/1380808596.db2.gz	UJXBKCFJZQVOKK-IAGOWNOFSA-N	0	3	330.472	3.039	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NC[C@@H](C)N(CC)C/C=C\c1ccccc1	ZINC001157214169	1380812035	/nfs/dbraw/zinc/81/20/35/1380812035.db2.gz	ZOZHCRQMQRXLFA-QXBCROFQSA-N	0	3	330.472	3.118	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NC[C@@H](C)N(CC)C/C=C/c1ccccc1	ZINC001157214170	1380812210	/nfs/dbraw/zinc/81/22/10/1380812210.db2.gz	ZOZHCRQMQRXLFA-ZQICTRMJSA-N	0	3	330.472	3.118	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCCC[C@@H]1CN(C)CCOC1CCCCCC1	ZINC001157717762	1381013403	/nfs/dbraw/zinc/01/34/03/1381013403.db2.gz	FBYBSVZGADNSNM-ZWKOTPCHSA-N	0	3	349.519	3.198	20	30		EGEDHN
CCC(CC)C(=O)N[C@@H]1CCN(Cc2ccc(C#N)cc2)[C@@H](C)C1	ZINC001328237695	1388694461	/nfs/dbraw/zinc/69/44/61/1388694461.db2.gz	BORXCKQXOQGDBD-HNAYVOBHSA-N	0	3	327.472	3.464	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)CC1(C)CCCC1	ZINC001157897667	1381065280	/nfs/dbraw/zinc/06/52/80/1381065280.db2.gz	JGXQNKVYISSRPQ-GOSISDBHSA-N	0	3	336.520	3.472	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc(C)c(NC(C)=O)c1	ZINC001157995025	1381096682	/nfs/dbraw/zinc/09/66/82/1381096682.db2.gz	ZWVIJLITRPSHOE-GOSISDBHSA-N	0	3	343.471	3.066	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)CCC(C)(F)F)CCN1Cc1ccc(C#N)cc1	ZINC001328260646	1388701240	/nfs/dbraw/zinc/70/12/40/1388701240.db2.gz	SVXXKSVHSSJBIU-PBHICJAKSA-N	0	3	349.425	3.463	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)CCOc1cccc(F)c1	ZINC001158050124	1381111643	/nfs/dbraw/zinc/11/16/43/1381111643.db2.gz	IMMNSPHPMIGEOM-QGZVFWFLSA-N	0	3	334.435	3.094	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc2cc(C)cn2c1	ZINC001158050731	1381113162	/nfs/dbraw/zinc/11/31/62/1381113162.db2.gz	TYUZTVSKCXISBV-LJQANCHMSA-N	0	3	325.456	3.360	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cnn2c1ccc(C)c2C	ZINC001158082612	1381123032	/nfs/dbraw/zinc/12/30/32/1381123032.db2.gz	GQBKMRAEZFYZID-QGZVFWFLSA-N	0	3	340.471	3.064	20	30		EGEDHN
CN1CCN(C(F)(F)c2cc(C#N)cc(Cl)n2)C2(CCCC2)C1	ZINC001158410338	1381235223	/nfs/dbraw/zinc/23/52/23/1381235223.db2.gz	QLXIXVVKVKKZDR-UHFFFAOYSA-N	0	3	340.805	3.216	20	30		EGEDHN
Cc1ccc([C@H](C#N)c2ccc(N3CCN(C(C)C)[C@@H](C)C3)nn2)cc1	ZINC001158494184	1381267525	/nfs/dbraw/zinc/26/75/25/1381267525.db2.gz	VSXXVZUQTAVQRP-HKUYNNGSSA-N	0	3	349.482	3.359	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCCNCc1oc(C(C)C)nc1C	ZINC001158747002	1381381573	/nfs/dbraw/zinc/38/15/73/1381381573.db2.gz	QCQBNPYJJDHWIL-UHFFFAOYSA-N	0	3	333.476	3.471	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)C[C@H]1OCCc2ccccc21	ZINC001158763616	1381387723	/nfs/dbraw/zinc/38/77/23/1381387723.db2.gz	GXMZNGPKWIKQPL-UYAOXDASSA-N	0	3	342.483	3.189	20	30		EGEDHN
C[C@]1(C(=O)NCCCNCc2cc(C#N)ccc2F)CC=CCC1	ZINC001158761889	1381388405	/nfs/dbraw/zinc/38/84/05/1381388405.db2.gz	SUPNHRDUKHJGAU-IBGZPJMESA-N	0	3	329.419	3.040	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H](C)OCc1ccc(F)cc1	ZINC001158806977	1381408003	/nfs/dbraw/zinc/40/80/03/1381408003.db2.gz	VIWAZPFQUMGCGR-QFBILLFUSA-N	0	3	348.462	3.230	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)Cc1ccccc1C	ZINC001158841394	1381426458	/nfs/dbraw/zinc/42/64/58/1381426458.db2.gz	JSAMKMLLYXZFNR-HXUWFJFHSA-N	0	3	344.499	3.053	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)C1(c2cccc(Cl)c2)CC1	ZINC001159341420	1381770377	/nfs/dbraw/zinc/77/03/77/1381770377.db2.gz	XAEUYEXBUSULBN-UHFFFAOYSA-N	0	3	327.255	3.220	20	30		EGEDHN
Cc1cc2ccc(C(=O)NCCCNCc3ccccc3C#N)cn2c1	ZINC001159512541	1381813858	/nfs/dbraw/zinc/81/38/58/1381813858.db2.gz	LAVWTFHWXWNTJN-UHFFFAOYSA-N	0	3	346.434	3.029	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)[C@@H](C)CCc1ccc(F)cc1	ZINC001159559241	1381830340	/nfs/dbraw/zinc/83/03/40/1381830340.db2.gz	FJFZVIDNXNJADB-ZDUSSCGKSA-N	0	3	326.843	3.243	20	30		EGEDHN
C=CCn1cccc1C(=O)NCCCNCc1ccc(F)cc1Cl	ZINC001159974592	1381955322	/nfs/dbraw/zinc/95/53/22/1381955322.db2.gz	HMIQDMGLBYUBMJ-UHFFFAOYSA-N	0	3	349.837	3.376	20	30		EGEDHN
C[C@@H](c1cccc(F)c1)N1CC=C(CCNC(=O)C#CC2CC2)CC1	ZINC001160083929	1381993011	/nfs/dbraw/zinc/99/30/11/1381993011.db2.gz	AGRXGMHJMRUBFB-INIZCTEOSA-N	0	3	340.442	3.439	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc(-c3ccccc3)no2)CC1	ZINC001160579953	1382147429	/nfs/dbraw/zinc/14/74/29/1382147429.db2.gz	AANFLEXKMYADGY-UHFFFAOYSA-N	0	3	349.434	3.117	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CCc2ccc(OCC)cc2)CC1	ZINC001160592754	1382149525	/nfs/dbraw/zinc/14/95/25/1382149525.db2.gz	CDTMUIQUFXSDGA-UHFFFAOYSA-N	0	3	342.483	3.342	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H]2CCOc3c(F)cccc32)CC1	ZINC001160640912	1382158387	/nfs/dbraw/zinc/15/83/87/1382158387.db2.gz	BSJYWUSIIGMSNO-KRWDZBQOSA-N	0	3	344.430	3.016	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H]2CCc3cc(F)ccc32)CC1	ZINC001160687607	1382171360	/nfs/dbraw/zinc/17/13/60/1382171360.db2.gz	CMNOFMLUCANETO-IBGZPJMESA-N	0	3	328.431	3.180	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H]2CCc3cc(C)ccc3O2)CC1	ZINC001160687600	1382171820	/nfs/dbraw/zinc/17/18/20/1382171820.db2.gz	CCSPZPFSQFUPGI-HXUWFJFHSA-N	0	3	340.467	3.013	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@H]2CCCC[C@@H]2C2CC2)CC1	ZINC001160778042	1382192753	/nfs/dbraw/zinc/19/27/53/1382192753.db2.gz	DBSFACIIEOXHNQ-UXHICEINSA-N	0	3	328.500	3.365	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)[C@H]2CCC=CCCC2)c(F)c1	ZINC001160820634	1382208490	/nfs/dbraw/zinc/20/84/90/1382208490.db2.gz	PPKSBTWPZUZHCS-KRWDZBQOSA-N	0	3	343.446	3.430	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCC1=CCN(CCOCC(C)C)CC1	ZINC001160941773	1382244344	/nfs/dbraw/zinc/24/43/44/1382244344.db2.gz	PKLSHZPEYOQTGQ-ROUUACIJSA-N	0	3	336.520	3.256	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H](c2ccncc2)C(C)C)CC1	ZINC001161008968	1382270711	/nfs/dbraw/zinc/27/07/11/1382270711.db2.gz	YWUNVJPHDNKRIS-LJQANCHMSA-N	0	3	327.472	3.146	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2csc(-c3ccco3)n2)CC1	ZINC001161056365	1382284971	/nfs/dbraw/zinc/28/49/71/1382284971.db2.gz	FUMSMFIPFSALQZ-UHFFFAOYSA-N	0	3	343.452	3.341	20	30		EGEDHN
COc1cccc(CN2CC[C@H](Nc3cc(C#N)cc(Cl)n3)C2)c1	ZINC001161186600	1382332189	/nfs/dbraw/zinc/33/21/89/1382332189.db2.gz	AHCODDKVLCLELH-HNNXBMFYSA-N	0	3	342.830	3.302	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc(F)ccc2Cl)CC1	ZINC001161314356	1382368863	/nfs/dbraw/zinc/36/88/63/1382368863.db2.gz	WMQNRIWLQSAWKI-UHFFFAOYSA-N	0	3	334.822	3.254	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2scnc2C(C)(C)C)CC1	ZINC001161422218	1382404281	/nfs/dbraw/zinc/40/42/81/1382404281.db2.gz	HPRZJPYRFKJBLJ-UHFFFAOYSA-N	0	3	333.501	3.379	20	30		EGEDHN
CCC[C@@H]1CCC[C@H]1C(=O)NCCCNCc1ccccc1C#N	ZINC001161428039	1382407503	/nfs/dbraw/zinc/40/75/03/1382407503.db2.gz	QIWFKPDPEZHZQS-VQIMIIECSA-N	0	3	327.472	3.371	20	30		EGEDHN
C[C@H](c1ccccc1)N(C(=O)[C@@H]1CCNC[C@H]1F)C1=CC(=O)CCC1	ZINC001161509434	1382426796	/nfs/dbraw/zinc/42/67/96/1382426796.db2.gz	PEZMCMDNEFEFLD-NIKGAXFTSA-N	0	3	344.430	3.161	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cnn(CC3CCCC3)c2)CC1	ZINC001161591289	1382449540	/nfs/dbraw/zinc/44/95/40/1382449540.db2.gz	VSFLFLGVDZZARO-UHFFFAOYSA-N	0	3	342.487	3.011	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)[C@H]1CCC[C@@H](C(F)(F)F)C1	ZINC001161596717	1382450005	/nfs/dbraw/zinc/45/00/05/1382450005.db2.gz	VBLSKOORRPMNNJ-NWDGAFQWSA-N	0	3	326.790	3.204	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C[C@@H]2OCCc3ccccc32)CC1	ZINC001161733583	1382491281	/nfs/dbraw/zinc/49/12/81/1382491281.db2.gz	DXEMCYAKNQPXNS-FQEVSTJZSA-N	0	3	340.467	3.015	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc(Cl)ccc2OC)CC1	ZINC001161818330	1382518589	/nfs/dbraw/zinc/51/85/89/1382518589.db2.gz	SMVAKPZVJMMYEC-UHFFFAOYSA-N	0	3	346.858	3.124	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)Cc2cccc(OC(C)C)c2)CC1	ZINC001161982656	1382586003	/nfs/dbraw/zinc/58/60/03/1382586003.db2.gz	LNGHQYUDPVQYIE-UHFFFAOYSA-N	0	3	342.483	3.341	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)C(CCC)CCC)(COC)CC1	ZINC001162440856	1382758988	/nfs/dbraw/zinc/75/89/88/1382758988.db2.gz	CLMNDMDGPHMDTF-UHFFFAOYSA-N	0	3	336.520	3.071	20	30		EGEDHN
C#CCN1CCC(CNC(=O)C[C@H]2CCCC(C)(C)C2)(COC)CC1	ZINC001162576456	1382795754	/nfs/dbraw/zinc/79/57/54/1382795754.db2.gz	GJTVMINRPCSVGR-GOSISDBHSA-N	0	3	348.531	3.071	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)C[C@H]2CCCC[C@H]2C)(COC)CC1	ZINC001162623376	1382814062	/nfs/dbraw/zinc/81/40/62/1382814062.db2.gz	SQWOQDAKAODZRJ-RTBURBONSA-N	0	3	348.531	3.071	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CCC(F)(F)C1	ZINC001162832209	1382889670	/nfs/dbraw/zinc/88/96/70/1382889670.db2.gz	LANDSQNVIHZCOD-SFHVURJKSA-N	0	3	348.437	3.106	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CCC[C@@H]2C[C@@H]21	ZINC001162847823	1382893579	/nfs/dbraw/zinc/89/35/79/1382893579.db2.gz	CVWVOYPRUNILRS-NJYVYQBISA-N	0	3	338.495	3.107	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C1(CC(C)C)CCC1	ZINC001162856406	1382896389	/nfs/dbraw/zinc/89/63/89/1382896389.db2.gz	FSVNZHBPXLPYSD-UHFFFAOYSA-N	0	3	340.511	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1ccc(F)c(C)c1	ZINC001162911222	1382913958	/nfs/dbraw/zinc/91/39/58/1382913958.db2.gz	IDNBJPKNHKLJRX-UHFFFAOYSA-N	0	3	338.426	3.042	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1cc(C)cc(F)c1	ZINC001162946572	1382923736	/nfs/dbraw/zinc/92/37/36/1382923736.db2.gz	MFOWTLMPSDQQLK-UHFFFAOYSA-N	0	3	338.426	3.042	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H](C)C1CCCC1	ZINC001162982786	1382936462	/nfs/dbraw/zinc/93/64/62/1382936462.db2.gz	OVJFVPOBQUKBJJ-IBGZPJMESA-N	0	3	340.511	3.497	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H](C)c1ccccc1	ZINC001162987443	1382938856	/nfs/dbraw/zinc/93/88/56/1382938856.db2.gz	RYNBUHPFMXXXNL-FQEVSTJZSA-N	0	3	348.490	3.474	20	30		EGEDHN
N#Cc1nc(N[C@@H]2CNCc3ccsc32)ccc1Br	ZINC001163228430	1382999541	/nfs/dbraw/zinc/99/95/41/1382999541.db2.gz	BBKAWPPFNMTTKP-LLVKDONJSA-N	0	3	335.230	3.034	20	30		EGEDHN
CC(C)C[C@H](Nc1nc(N2CCCC2)cc2ccccc21)C(=O)NO	ZINC001163420566	1383048901	/nfs/dbraw/zinc/04/89/01/1383048901.db2.gz	XLQXJXZJICGNIM-INIZCTEOSA-N	0	3	342.443	3.167	20	30		EGEDHN
Cc1ccc2[nH]c(C(=O)NCCCNCc3ccccc3C#N)cc2c1	ZINC001163714208	1383112650	/nfs/dbraw/zinc/11/26/50/1383112650.db2.gz	IJQGJNHZWQAJTC-UHFFFAOYSA-N	0	3	346.434	3.258	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCC1(CN[C@@H](C)c2cc(F)ccc2F)CC1	ZINC001163842392	1383128171	/nfs/dbraw/zinc/12/81/71/1383128171.db2.gz	YRZZJIXZNZEZDS-STQMWFEESA-N	0	3	335.398	3.062	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCC1(CNCc2cc(C)no2)CC1	ZINC001164649019	1383214358	/nfs/dbraw/zinc/21/43/58/1383214358.db2.gz	SIBXNHWNWJKJFG-UHFFFAOYSA-N	0	3	331.460	3.128	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccnc(CCC)c2)CC1	ZINC001165609158	1383314999	/nfs/dbraw/zinc/31/49/99/1383314999.db2.gz	CETCJTJEAYEGSW-UHFFFAOYSA-N	0	3	335.879	3.276	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)[C@H](C)C2CCC2)CC1	ZINC001165711533	1383330101	/nfs/dbraw/zinc/33/01/01/1383330101.db2.gz	RHZJKYREVRSAAT-CYBMUJFWSA-N	0	3	343.309	3.207	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cccnc2C2CC2)CC1	ZINC001165981175	1383373236	/nfs/dbraw/zinc/37/32/36/1383373236.db2.gz	SXFSLEMBJVRATJ-UHFFFAOYSA-N	0	3	333.863	3.201	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCC1(CNCc2c(C)noc2C)CC1	ZINC001166693189	1383461751	/nfs/dbraw/zinc/46/17/51/1383461751.db2.gz	GWSBICKGPSBWDN-ZIAGYGMSSA-N	0	3	333.476	3.126	20	30		EGEDHN
CC#CCCCC(=O)NCCC1(CNCc2nc(C)c(C)s2)CC1	ZINC001166703360	1383463574	/nfs/dbraw/zinc/46/35/74/1383463574.db2.gz	DNWWYXFNMQPBOH-UHFFFAOYSA-N	0	3	347.528	3.330	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCCC1(CNCc2c(C)noc2C)CC1	ZINC001166755169	1383472312	/nfs/dbraw/zinc/47/23/12/1383472312.db2.gz	FULFNAWCYLONNF-MRXNPFEDSA-N	0	3	333.476	3.270	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C[C@@H]2CCCC2(F)F)CC1	ZINC001166836269	1383485332	/nfs/dbraw/zinc/48/53/32/1383485332.db2.gz	HHOGYHMNBFBBPL-ZDUSSCGKSA-N	0	3	334.838	3.441	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@@H](c2ccncc2)C(C)C)CC1	ZINC001166837085	1383485495	/nfs/dbraw/zinc/48/54/95/1383485495.db2.gz	WYEGXOXHUZUIHC-QGZVFWFLSA-N	0	3	349.906	3.450	20	30		EGEDHN
C=C1CCC(C(=O)NCCC2(CNCc3c(C)noc3C)CC2)CC1	ZINC001167012817	1383518156	/nfs/dbraw/zinc/51/81/56/1383518156.db2.gz	RHQBPPYYMVJCRN-UHFFFAOYSA-N	0	3	345.487	3.414	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCC1(CN[C@H](C)c2cnccn2)CC1	ZINC001167018093	1383520032	/nfs/dbraw/zinc/52/00/32/1383520032.db2.gz	ARSFECAPEJGZDU-QAPCUYQASA-N	0	3	330.476	3.016	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)C1[C@H]2CCCCCC[C@H]12	ZINC001167296044	1383588567	/nfs/dbraw/zinc/58/85/67/1383588567.db2.gz	KAYFDJPTBKMVCA-KBPBESRZSA-N	0	3	343.309	3.207	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@@H](CC)OC2CCCC2)CC1	ZINC001167366638	1383611088	/nfs/dbraw/zinc/61/10/88/1383611088.db2.gz	MVAGVKKIKMEENB-MRXNPFEDSA-N	0	3	342.911	3.353	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@@H]2[C@@H]3Cc4ccccc4[C@@H]32)CC1	ZINC001167402704	1383624100	/nfs/dbraw/zinc/62/41/00/1383624100.db2.gz	HAQQGRLMJLJNFD-FGTMMUONSA-N	0	3	344.886	3.201	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc(OC)c(C)c2)CC1	ZINC001167458631	1383638528	/nfs/dbraw/zinc/63/85/28/1383638528.db2.gz	IMPVLSYFMVGDDA-UHFFFAOYSA-N	0	3	336.863	3.246	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc3ccn(C)c3c2)CC1	ZINC001167636004	1383694584	/nfs/dbraw/zinc/69/45/84/1383694584.db2.gz	OESGRUCQHKYODX-UHFFFAOYSA-N	0	3	345.874	3.421	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2oc(CCC)nc2C)CC1	ZINC001167746641	1383728830	/nfs/dbraw/zinc/72/88/30/1383728830.db2.gz	ROTLVZHBGZRBOV-UHFFFAOYSA-N	0	3	339.867	3.178	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)Cc2ccc3c(c2)CCC3)CC1	ZINC001168087079	1383814162	/nfs/dbraw/zinc/81/41/62/1383814162.db2.gz	HDTMQDOPACDCOT-UHFFFAOYSA-N	0	3	346.902	3.346	20	30		EGEDHN
CC[C@@]1(C(C)C)C[C@H]1C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001169732792	1384180111	/nfs/dbraw/zinc/18/01/11/1384180111.db2.gz	ZYMCJLQMWVASDW-PXNSSMCTSA-N	0	3	345.462	3.366	20	30		EGEDHN
CCCc1nc(CNCCCC[C@@H](C)NC(=O)[C@@H](C)C#N)cs1	ZINC001169849062	1384191151	/nfs/dbraw/zinc/19/11/51/1384191151.db2.gz	UBMFNRXGZMBTIO-UONOGXRCSA-N	0	3	336.505	3.020	20	30		EGEDHN
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C)[C@H]1NCc1cc(C#N)ccn1	ZINC001170050746	1384225346	/nfs/dbraw/zinc/22/53/46/1384225346.db2.gz	CWCYGUWYORDFCD-CPUCHLNUSA-N	0	3	344.459	3.077	20	30		EGEDHN
COc1ccc(C[C@H](C)NCc2ccccc2C#N)c([N+](=O)[O-])c1	ZINC001170310007	1384288128	/nfs/dbraw/zinc/28/81/28/1384288128.db2.gz	VNCDXOZOTZTWCK-ZDUSSCGKSA-N	0	3	325.368	3.196	20	30		EGEDHN
N#CC1(c2ccccc2)CCC(N2CCN(c3cncnc3)CC2)CC1	ZINC001170395692	1384307113	/nfs/dbraw/zinc/30/71/13/1384307113.db2.gz	MQZZRVVPRWVXRN-UHFFFAOYSA-N	0	3	347.466	3.003	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H](C)CCCCNCc1nnc(C)n1C1CC1	ZINC001171035539	1384434106	/nfs/dbraw/zinc/43/41/06/1384434106.db2.gz	MTDUOWWYAGXAQN-HNNXBMFYSA-N	0	3	347.507	3.042	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H](C)CCCCNCc1csnc1OC	ZINC001171043437	1384435173	/nfs/dbraw/zinc/43/51/73/1384435173.db2.gz	MCYUOKFDRFINAM-AWEZNQCLSA-N	0	3	339.505	3.273	20	30		EGEDHN
C[C@@H](Cc1cccc(C#N)c1)N1CC[C@H](NC(=O)OC(C)(C)C)C1	ZINC001171209828	1384469953	/nfs/dbraw/zinc/46/99/53/1384469953.db2.gz	MWRHHXCSJQYFQA-YOEHRIQHSA-N	0	3	329.444	3.088	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1CCCN(C(=O)c2ccccc2)CC1	ZINC001171231005	1384474767	/nfs/dbraw/zinc/47/47/67/1384474767.db2.gz	ZQRFLXSAZJULJP-GOSISDBHSA-N	0	3	347.462	3.337	20	30		EGEDHN
N#Cc1ccccc1CNC1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccccc1	ZINC001171237285	1384476422	/nfs/dbraw/zinc/47/64/22/1384476422.db2.gz	BMNUQZSSQHUXNX-SEJPIABJSA-N	0	3	345.446	3.484	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H](C)CCCCNCc1nccs1	ZINC001171260875	1384480939	/nfs/dbraw/zinc/48/09/39/1384480939.db2.gz	NUMKTMKGVQKNDW-OAHLLOKOSA-N	0	3	346.500	3.209	20	30		EGEDHN
CCCC1(C(=O)NC[C@H]2C[C@@H](NCc3cc(C#N)ccc3F)C2)CC1	ZINC001316620663	1384486699	/nfs/dbraw/zinc/48/66/99/1384486699.db2.gz	PPRDOASMNKVGKD-WOVMCDHWSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1cccc(C(F)F)c1	ZINC001171721191	1384612802	/nfs/dbraw/zinc/61/28/02/1384612802.db2.gz	WDOJRNQLJFUNOS-UHFFFAOYSA-N	0	3	347.203	3.242	20	30		EGEDHN
CCCCCCCCCC(=O)NCCCNCc1cnnn1CC	ZINC001171865254	1384665098	/nfs/dbraw/zinc/66/50/98/1384665098.db2.gz	ZKGUGDJWEICXBR-UHFFFAOYSA-N	0	3	337.512	3.035	20	30		EGEDHN
Cc1ccc(C)c(C(=O)NCCCNCc2ccc(C#N)cc2F)c1	ZINC001171947118	1384692358	/nfs/dbraw/zinc/69/23/58/1384692358.db2.gz	VEIAMUHCOYCJHK-UHFFFAOYSA-N	0	3	339.414	3.224	20	30		EGEDHN
Cc1cc(C(=O)NC[C@H](NCc2ccc(C#N)s2)C2CC2)oc1C	ZINC001317016298	1384781083	/nfs/dbraw/zinc/78/10/83/1384781083.db2.gz	XQAMLVPEISICRQ-INIZCTEOSA-N	0	3	343.452	3.128	20	30		EGEDHN
C[C@@H](Cc1ccc([N+](=O)[O-])cc1)NC(=N)c1ccc2ccccc2n1	ZINC001173219323	1384938639	/nfs/dbraw/zinc/93/86/39/1384938639.db2.gz	NAZNZSGWOJDLJY-ZDUSSCGKSA-N	0	3	334.379	3.480	20	30		EGEDHN
CC(=O)c1ccc(N2CCN(C3CCC(CC#N)CC3)CC2)cc1	ZINC001173339139	1384962190	/nfs/dbraw/zinc/96/21/90/1384962190.db2.gz	MPQYSSAUIARLOK-UHFFFAOYSA-N	0	3	325.456	3.484	20	30		EGEDHN
CCCCC(=O)N[C@@H](C)[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001317202845	1384981203	/nfs/dbraw/zinc/98/12/03/1384981203.db2.gz	WJEJARDRXHWPHX-LPHOPBHVSA-N	0	3	327.472	3.465	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H](C)CCCCNCc1cc2n(n1)CCCC2	ZINC001174682605	1385133744	/nfs/dbraw/zinc/13/37/44/1385133744.db2.gz	MVTZZLZTCJPBOW-MRXNPFEDSA-N	0	3	346.519	3.196	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@H](C)CCCCNCc1cc2n(n1)CCC2	ZINC001174849625	1385159745	/nfs/dbraw/zinc/15/97/45/1385159745.db2.gz	PNDKAKKQWXNWJN-IAGOWNOFSA-N	0	3	346.519	3.196	20	30		EGEDHN
C=CCCCCC[NH2+]CCCC[C@H](C)NC(=O)c1c(C)nc[n-]c1=O	ZINC001174874581	1385163517	/nfs/dbraw/zinc/16/35/17/1385163517.db2.gz	RFCGVMRRHZYUBR-HNNXBMFYSA-N	0	3	348.491	3.115	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@H](C)CCCCNCc1cn(C(C)C)nn1	ZINC001175082262	1385191543	/nfs/dbraw/zinc/19/15/43/1385191543.db2.gz	NHENOCHEVJFMTC-VQIMIIECSA-N	0	3	349.523	3.226	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H](C)CCCCN[C@@H](C)c2nnc(C)[nH]2)CC1	ZINC001175081719	1385191667	/nfs/dbraw/zinc/19/16/67/1385191667.db2.gz	IFFHHBZNJOFGCI-GJZGRUSLSA-N	0	3	347.507	3.185	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)CCCCNCc2cnns2)CCC1	ZINC001175098407	1385194414	/nfs/dbraw/zinc/19/44/14/1385194414.db2.gz	RVLKSGNKNPQGCW-AWEZNQCLSA-N	0	3	336.505	3.049	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H](C)CCCCN[C@@H](C)c1nnc(C)[nH]1	ZINC001175468193	1385301193	/nfs/dbraw/zinc/30/11/93/1385301193.db2.gz	CYRUSWQIGLZCFX-KGLIPLIRSA-N	0	3	335.496	3.041	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)c1cc2c(s1)CC[C@H](C)C2	ZINC001175800991	1385409292	/nfs/dbraw/zinc/40/92/92/1385409292.db2.gz	FRLSJUOMGQAKBX-NSHDSACASA-N	0	3	326.893	3.335	20	30		EGEDHN
C=CCC1(C(=O)NCCCNCc2ccn(CC)n2)CCCCC1	ZINC001176781703	1385695330	/nfs/dbraw/zinc/69/53/30/1385695330.db2.gz	KMRZSJZKAMNJEY-UHFFFAOYSA-N	0	3	332.492	3.026	20	30		EGEDHN
C=C(Br)CNCC1(NC(=O)CCCC2CC2)CCCC1	ZINC001318653922	1385817907	/nfs/dbraw/zinc/81/79/07/1385817907.db2.gz	RFGNCBQHFDDJFE-UHFFFAOYSA-N	0	3	343.309	3.494	20	30		EGEDHN
CC1(C)CCCC[C@H]1C(=O)NCCCNCc1ccccc1C#N	ZINC001177192377	1385854200	/nfs/dbraw/zinc/85/42/00/1385854200.db2.gz	GMFSYYQGZMFNMF-SFHVURJKSA-N	0	3	327.472	3.371	20	30		EGEDHN
CN1CCC(N(Cc2ccco2)C(=O)CC#Cc2ccccc2)CC1	ZINC001319123407	1385967744	/nfs/dbraw/zinc/96/77/44/1385967744.db2.gz	DREQTLZQQLZYKN-UHFFFAOYSA-N	0	3	336.435	3.144	20	30		EGEDHN
Cc1cnc2ccccc2c1N1CCN(c2ccc(C#N)cn2)CC1	ZINC001319130678	1385969837	/nfs/dbraw/zinc/96/98/37/1385969837.db2.gz	GEJGMVYOYGXRLR-UHFFFAOYSA-N	0	3	329.407	3.137	20	30		EGEDHN
C=CCCOCC(=O)N(CCCNCC(=C)Cl)CC1CCCC1	ZINC001177495952	1385979547	/nfs/dbraw/zinc/97/95/47/1385979547.db2.gz	NPRHLVPTZCWGNC-UHFFFAOYSA-N	0	3	342.911	3.330	20	30		EGEDHN
C=CCC[C@@H](C(=O)NCCCNCc1conc1C)c1ccccc1	ZINC001177552886	1385995325	/nfs/dbraw/zinc/99/53/25/1385995325.db2.gz	QSDPFYFYPXKSQV-LJQANCHMSA-N	0	3	341.455	3.329	20	30		EGEDHN
C=CCC[C@H](C(=O)NCCCNCc1cnoc1C)c1ccccc1	ZINC001177552176	1385995356	/nfs/dbraw/zinc/99/53/56/1385995356.db2.gz	ADNSZZBDQXQEOO-IBGZPJMESA-N	0	3	341.455	3.329	20	30		EGEDHN
N#Cc1ccc(F)c(CNC2(CNC(=O)CC3CC3)CCCC2)c1	ZINC001319331670	1386064115	/nfs/dbraw/zinc/06/41/15/1386064115.db2.gz	MGIMEASUZGRDRB-UHFFFAOYSA-N	0	3	329.419	3.016	20	30		EGEDHN
N#CC(Cc1cccs1)C(=O)Nc1cc(-c2ccccc2O)no1	ZINC001177904367	1386079566	/nfs/dbraw/zinc/07/95/66/1386079566.db2.gz	OVWCRRQJPWZWKU-NSHDSACASA-N	0	3	339.376	3.430	20	30		EGEDHN
COCCCN(C(=O)C(C#N)Cc1cccs1)c1ccccc1N	ZINC001177917701	1386083650	/nfs/dbraw/zinc/08/36/50/1386083650.db2.gz	WINOAYJGIYSRJX-AWEZNQCLSA-N	0	3	343.452	3.082	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cc(-c3ccco3)n[nH]2)CCCC1	ZINC001319377200	1386090404	/nfs/dbraw/zinc/09/04/04/1386090404.db2.gz	KMFMEWQUCGVUHP-UHFFFAOYSA-N	0	3	348.834	3.054	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)Cc1ccccc1-c1cccnc1	ZINC001177978956	1386101459	/nfs/dbraw/zinc/10/14/59/1386101459.db2.gz	IVOUOPNNPHHAND-IBGZPJMESA-N	0	3	335.451	3.058	20	30		EGEDHN
CCC(CC)n1ccc(CNCCCCCCNC(=O)[C@@H](C)C#N)n1	ZINC001178053962	1386117754	/nfs/dbraw/zinc/11/77/54/1386117754.db2.gz	XVKRBSHNVMWROV-INIZCTEOSA-N	0	3	347.507	3.170	20	30		EGEDHN
N#Cc1ccccc1CNCCCCCCNC(=O)[C@H]1[C@@H]2CCC[C@@H]21	ZINC001178126141	1386136904	/nfs/dbraw/zinc/13/69/04/1386136904.db2.gz	DCMYCMKEEWBFRY-PMOLBWCYSA-N	0	3	339.483	3.371	20	30		EGEDHN
C/C=C(\C)C(=O)NCCCCCCNCc1cc(F)ccc1C#N	ZINC001178149617	1386143948	/nfs/dbraw/zinc/14/39/48/1386143948.db2.gz	XWGIVKHLPYUZIO-CRKCGEKBSA-N	0	3	331.435	3.430	20	30		EGEDHN
CC[C@H](C)OCC(=O)NCCCCCCNCc1ccccc1C#N	ZINC001178227764	1386165263	/nfs/dbraw/zinc/16/52/63/1386165263.db2.gz	KBEBDFOLHQPLKG-KRWDZBQOSA-N	0	3	345.487	3.140	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CC[C@H](NCc2cc(C)ccc2F)[C@@H]1C	ZINC001178278170	1386178988	/nfs/dbraw/zinc/17/89/88/1386178988.db2.gz	FRCZCIFVNODXFH-FCEWJHQRSA-N	0	3	348.462	3.194	20	30		EGEDHN
C=C(Br)CNCC1(NC(=O)[C@@H]2C[C@H]2CCC)CCCC1	ZINC001698634376	1406278742	/nfs/dbraw/zinc/27/87/42/1406278742.db2.gz	OSFKWMNEXDKJNJ-ZIAGYGMSSA-N	0	3	343.309	3.350	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)[C@H]1[C@@H]2CCCC[C@@H]21	ZINC001178417850	1386211722	/nfs/dbraw/zinc/21/17/22/1386211722.db2.gz	GJZMDMBDKHVLQT-JBINPLMMSA-N	0	3	336.479	3.053	20	30		EGEDHN
C=CCOCCCC(=O)N1CC[C@H](N[C@H](C)c2ccccc2F)[C@@H]1C	ZINC001178432356	1386215238	/nfs/dbraw/zinc/21/52/38/1386215238.db2.gz	YLWOWTSOPFDIRJ-GJYPPUQNSA-N	0	3	348.462	3.449	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](N[C@@H]2CCc3c2c(F)ccc3F)[C@@H]1C	ZINC001178576784	1386253978	/nfs/dbraw/zinc/25/39/78/1386253978.db2.gz	ABXFWIMTXWJAMX-DOPJRALCSA-N	0	3	346.421	3.335	20	30		EGEDHN
C=C(C)CCC(=O)NCCCCCCNCc1nnc(C(C)C)[nH]1	ZINC001178596190	1386258468	/nfs/dbraw/zinc/25/84/68/1386258468.db2.gz	IGDLSUPJWMIIIZ-UHFFFAOYSA-N	0	3	335.496	3.051	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@H](N[C@@H]2CCc3c2c(F)ccc3F)[C@@H]1C	ZINC001178649099	1386268969	/nfs/dbraw/zinc/26/89/69/1386268969.db2.gz	VPUDFXRDMVNNEW-DOPJRALCSA-N	0	3	346.421	3.191	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](NCc2cncc(F)c2)[C@@H]1C	ZINC001178773569	1386299791	/nfs/dbraw/zinc/29/97/91/1386299791.db2.gz	NTLSDOSKGXHTRE-KSSFIOAISA-N	0	3	331.435	3.068	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)[C@@H]1C[C@H]1C(C)(C)C	ZINC001179121950	1386405128	/nfs/dbraw/zinc/40/51/28/1386405128.db2.gz	OMPLCKLZGOJCKL-NBYUQASBSA-N	0	3	338.495	3.299	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](NCc2ccnc(Cl)c2)[C@@H]1C	ZINC001179364624	1386464004	/nfs/dbraw/zinc/46/40/04/1386464004.db2.gz	NUKLGMIXNHZFEI-DZKIICNBSA-N	0	3	335.879	3.416	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccc(F)cc2)CCN1C(=O)[C@@H]1CCC1(C)C	ZINC001179364916	1386464395	/nfs/dbraw/zinc/46/43/95/1386464395.db2.gz	RCTCEAGWPSBHFT-SNRMKQJTSA-N	0	3	342.458	3.192	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@H](NCc2ccnc(Cl)c2)[C@@H]1C	ZINC001179384347	1386468936	/nfs/dbraw/zinc/46/89/36/1386468936.db2.gz	KEYYHNHVLLFHMP-DZKIICNBSA-N	0	3	335.879	3.416	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@H](NCc2cccc(Cl)n2)[C@@H]1C	ZINC001179384051	1386468992	/nfs/dbraw/zinc/46/89/92/1386468992.db2.gz	BFIQCLXELSQAJR-DZKIICNBSA-N	0	3	335.879	3.416	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)[C@@H]1C	ZINC001179384292	1386469084	/nfs/dbraw/zinc/46/90/84/1386469084.db2.gz	IWEGBLJBAJXQQT-KHYOSLBOSA-N	0	3	343.446	3.379	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@@H]1C	ZINC001179384562	1386470155	/nfs/dbraw/zinc/47/01/55/1386470155.db2.gz	QEHOZWXHSHXMTG-ZWOKBUDYSA-N	0	3	342.458	3.359	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)CC1CC(C)(C)C1	ZINC001179392180	1386472954	/nfs/dbraw/zinc/47/29/54/1386472954.db2.gz	GTFFJHYEXMXGEZ-PXNSSMCTSA-N	0	3	338.495	3.443	20	30		EGEDHN
C=C1CCC(C(=O)NCCCCCCNCc2cnc(C)o2)CC1	ZINC001179481780	1386494296	/nfs/dbraw/zinc/49/42/96/1386494296.db2.gz	LIOZXNVQHIEYMU-UHFFFAOYSA-N	0	3	333.476	3.496	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCCCCCN[C@H](C)c1nnc(CC)[nH]1	ZINC001179482600	1386495390	/nfs/dbraw/zinc/49/53/90/1386495390.db2.gz	XOKGGFJLVHKIEI-DNVCBOLYSA-N	0	3	349.523	3.297	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1cccc2cc[nH]c21)C1CC1	ZINC001698650586	1406300784	/nfs/dbraw/zinc/30/07/84/1406300784.db2.gz	ZGRIYKANWYLKSK-GOSISDBHSA-N	0	3	331.847	3.409	20	30		EGEDHN
C=CC1(CC(=O)N2CC[C@H](NCc3cnn(C)c3)[C@@H]2C)CCCCC1	ZINC001179714593	1386563110	/nfs/dbraw/zinc/56/31/10/1386563110.db2.gz	BSDDBYCHAZWYBJ-WMZOPIPTSA-N	0	3	344.503	3.026	20	30		EGEDHN
C=CCC1(C(=O)NCCCCCCNCc2nnc(C)[nH]2)CCCC1	ZINC001180514496	1386820734	/nfs/dbraw/zinc/82/07/34/1386820734.db2.gz	DSWLTBPCWSLLSV-UHFFFAOYSA-N	0	3	347.507	3.016	20	30		EGEDHN
CN(CC(=O)N1CCC(Cc2ccc(C#N)cc2)CC1)C1CCCC1	ZINC001180627148	1386852047	/nfs/dbraw/zinc/85/20/47/1386852047.db2.gz	BUQDRIYNCPBLNU-UHFFFAOYSA-N	0	3	339.483	3.214	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2c(F)cccc2F)C1	ZINC001181271150	1386970220	/nfs/dbraw/zinc/97/02/20/1386970220.db2.gz	BFTYFWTZWQEQPT-FOIQADDNSA-N	0	3	348.437	3.343	20	30		EGEDHN
C=CCOCCCC(=O)N1CC[C@@H](NCc2cc3ccccc3o2)C1	ZINC001181891227	1387071623	/nfs/dbraw/zinc/07/16/23/1387071623.db2.gz	YEZFLFZCKBIKDK-QGZVFWFLSA-N	0	3	342.439	3.106	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H](C)CN(C)Cc2ccc(C#N)cc2)ccc1F	ZINC001322230769	1387111792	/nfs/dbraw/zinc/11/17/92/1387111792.db2.gz	NPQAVDNKHPOSEO-HNNXBMFYSA-N	0	3	339.414	3.256	20	30		EGEDHN
CN(CCN(C)C(=O)CCc1cccc(C#N)c1)Cc1ccccc1	ZINC001182340445	1387152481	/nfs/dbraw/zinc/15/24/81/1387152481.db2.gz	NUPSPCWNSCLEGX-UHFFFAOYSA-N	0	3	335.451	3.081	20	30		EGEDHN
C=CCCOCCCCC(=O)N1CC[C@@H](NCc2cccc(F)c2)C1	ZINC001182530141	1387182538	/nfs/dbraw/zinc/18/25/38/1387182538.db2.gz	JPIHHTLCVKQVMK-LJQANCHMSA-N	0	3	348.462	3.279	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](NCc2ccnc(Cl)c2)C1	ZINC001182818646	1387229733	/nfs/dbraw/zinc/22/97/33/1387229733.db2.gz	LQHOGSVPBBAJHR-MRXNPFEDSA-N	0	3	333.863	3.194	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1ncoc1C(C)C	ZINC001329346049	1389071061	/nfs/dbraw/zinc/07/10/61/1389071061.db2.gz	MVSOQOOXRICYHN-UHFFFAOYSA-N	0	3	327.856	3.238	20	30		EGEDHN
C[C@H](NC(=O)c1ccc(C#N)cc1F)[C@H](c1ccccc1)N(C)C	ZINC001336444823	1389101049	/nfs/dbraw/zinc/10/10/49/1389101049.db2.gz	RXYUMSPXONPGNL-SCLBCKFNSA-N	0	3	325.387	3.119	20	30		EGEDHN
CN(C)CCN(Cc1cccc(F)c1)C(=O)c1ccc(C#N)cc1F	ZINC001337045024	1389243859	/nfs/dbraw/zinc/24/38/59/1389243859.db2.gz	XPLQUVBYIHSKRU-UHFFFAOYSA-N	0	3	343.377	3.040	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CCC[C@@H]1CNCc1cc(C)ccc1F	ZINC001698727780	1406378503	/nfs/dbraw/zinc/37/85/03/1406378503.db2.gz	RGRPNRUFEKGELJ-SJLPKXTDSA-N	0	3	348.462	3.196	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CN1Cc2ccccc2C2(CCC2)C1	ZINC001331589169	1389816007	/nfs/dbraw/zinc/81/60/07/1389816007.db2.gz	DXJVNYUOVZMUAC-IBGZPJMESA-N	0	3	348.446	3.235	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N[C@@H](c1nc2ccccc2[nH]1)[C@H](C)CC	ZINC001340043917	1390214764	/nfs/dbraw/zinc/21/47/64/1390214764.db2.gz	CUHVAYVSCBGKEO-JKIFEVAISA-N	0	3	328.460	3.450	20	30		EGEDHN
C[C@@H](CNCc1ccccc1C#N)CNC(=O)[C@@H]1CCCC(F)(F)C1	ZINC001698769281	1406427541	/nfs/dbraw/zinc/42/75/41/1406427541.db2.gz	XWVCCVAFRFFTIY-LSDHHAIUSA-N	0	3	349.425	3.226	20	30		EGEDHN
C[C@@]1(Cc2ccc(F)cc2)CCCN1C(=O)[C@H](N)CCCCC#N	ZINC001333276613	1390275184	/nfs/dbraw/zinc/27/51/84/1390275184.db2.gz	KZXIDMYIEQGECY-MJGOQNOKSA-N	0	3	331.435	3.161	20	30		EGEDHN
COc1ccc(C(C)N=Nc2ccc(C#N)cn2)cc1CN1CCCC1	ZINC001333670274	1390370315	/nfs/dbraw/zinc/37/03/15/1390370315.db2.gz	OJDVTWSAZAJCCN-UHFFFAOYSA-N	0	3	349.438	3.394	20	30		EGEDHN
CC(C)CN(Cc1ccc(C#N)cc1)C(=O)NC[C@H]1CCCCN1C	ZINC001342985987	1390680740	/nfs/dbraw/zinc/68/07/40/1390680740.db2.gz	ALFPNOWZCJHIDH-LJQANCHMSA-N	0	3	342.487	3.210	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CCCN(C)C2)nnc1N1CCC[C@H](C)CC1	ZINC001343966120	1390747075	/nfs/dbraw/zinc/74/70/75/1390747075.db2.gz	JDZSPZQRRGQALQ-IRXDYDNUSA-N	0	3	331.508	3.290	20	30		EGEDHN
CCc1c(C(=O)C(C#N)c2nccn2CC)cnn1Cc1ccccc1	ZINC001344322427	1390782117	/nfs/dbraw/zinc/78/21/17/1390782117.db2.gz	ONFDJXBHTDLTRX-INIZCTEOSA-N	0	3	347.422	3.200	20	30		EGEDHN
N#CC(C(=O)[C@@H]1C[C@H]2CC(=O)[C@@H]1C2)c1nc2c(cccc2Cl)[nH]1	ZINC001345673687	1390874621	/nfs/dbraw/zinc/87/46/21/1390874621.db2.gz	WNEOZWAYBUWFKN-LNFKQOIKSA-N	0	3	327.771	3.008	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)[C@@H]1C[C@@H]1c1cc(F)c(F)c(F)c1	ZINC001346095199	1390906991	/nfs/dbraw/zinc/90/69/91/1390906991.db2.gz	AKHXWZCGCNXHFY-IJLUTSLNSA-N	0	3	333.313	3.300	20	30		EGEDHN
C=C[C@@H](COC)NCc1cccc2c1CCN(C(=O)OC(C)(C)C)C2	ZINC001346843252	1390981788	/nfs/dbraw/zinc/98/17/88/1390981788.db2.gz	WTWBVACTPOPLOZ-KRWDZBQOSA-N	0	3	346.471	3.270	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)Cc2noc3ccccc32)CCCC1	ZINC001698799252	1406472405	/nfs/dbraw/zinc/47/24/05/1406472405.db2.gz	PMGJMEJOHYKZAD-UHFFFAOYSA-N	0	3	347.846	3.141	20	30		EGEDHN
N#CC(C(=O)C=Cc1nccs1)C(=O)Nc1ccccc1Cl	ZINC001347091939	1390999601	/nfs/dbraw/zinc/99/96/01/1390999601.db2.gz	LASDIHHRGADIHZ-BRAIEQGRSA-N	0	3	331.784	3.157	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCCc1ccc(OC)c(OC)c1	ZINC001349702997	1391355999	/nfs/dbraw/zinc/35/59/99/1391355999.db2.gz	UNFVAUKUIPFEEM-OAHLLOKOSA-N	0	3	341.411	3.119	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)N(C)C(=O)c1ccc(F)cc1	ZINC001698810854	1406497317	/nfs/dbraw/zinc/49/73/17/1406497317.db2.gz	FRCRZVDUEAEVKD-LBPRGKRZSA-N	0	3	331.416	3.009	20	30		EGEDHN
Cc1ccccc1C(=O)N(C)[C@@H](C)CNCc1ccc(F)c(C#N)c1	ZINC001698813034	1406501175	/nfs/dbraw/zinc/50/11/75/1406501175.db2.gz	ZJADIZTWSUOWTA-HNNXBMFYSA-N	0	3	339.414	3.256	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)NCc1cccnc1Oc1cccc(F)c1	ZINC001353469061	1392017765	/nfs/dbraw/zinc/01/77/65/1392017765.db2.gz	MDIHVBMGOVEPBR-QGZVFWFLSA-N	0	3	343.402	3.313	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1cc(C2CC2)n[nH]1	ZINC001479829013	1392416026	/nfs/dbraw/zinc/41/60/26/1392416026.db2.gz	ICWDQBYTMRXOSG-WBMJQRKESA-N	0	3	336.867	3.012	20	30		EGEDHN
COc1ccc(CN[C@H](C)CNC(=O)CC2CCCCC2)cc1C#N	ZINC001480420141	1392750182	/nfs/dbraw/zinc/75/01/82/1392750182.db2.gz	FPTSHOLLLFFPBA-OAHLLOKOSA-N	0	3	343.471	3.132	20	30		EGEDHN
C[C@H](CCNC(=O)c1cc(C#N)c[nH]1)N[C@H](C)c1c(F)cccc1F	ZINC001480759503	1392917679	/nfs/dbraw/zinc/91/76/79/1392917679.db2.gz	VCSWXJWSJVADSY-VXGBXAGGSA-N	0	3	346.381	3.024	20	30		EGEDHN
CCN(CCNC(=O)c1cc(C#N)c[nH]1)Cc1ccccc1C1CC1	ZINC001480968003	1393054713	/nfs/dbraw/zinc/05/47/13/1393054713.db2.gz	ULZUHWPGQXZZAE-UHFFFAOYSA-N	0	3	336.439	3.016	20	30		EGEDHN
CCCN(CCNC(=O)c1cccs1)Cc1ccc(C#N)cc1	ZINC001481129533	1393127884	/nfs/dbraw/zinc/12/78/84/1393127884.db2.gz	RLWMQXVALIOEQE-UHFFFAOYSA-N	0	3	327.453	3.262	20	30		EGEDHN
CCCN(CCNC(=O)C1C=CC=CC=C1)Cc1ccc(C#N)cc1	ZINC001481137579	1393130626	/nfs/dbraw/zinc/13/06/26/1393130626.db2.gz	RUEQWFOITDOELK-UHFFFAOYSA-N	0	3	335.451	3.185	20	30		EGEDHN
CC(C)C(C)(C)C(=O)NC[C@@H](NCc1ccc(C#N)s1)C1CC1	ZINC001490666281	1394289944	/nfs/dbraw/zinc/28/99/44/1394289944.db2.gz	ALHNPKKGFRXUGA-MRXNPFEDSA-N	0	3	333.501	3.286	20	30		EGEDHN
CC(C)C(C)(C)C(=O)NC[C@H](NCc1ccc(C#N)s1)C1CC1	ZINC001490666280	1394290197	/nfs/dbraw/zinc/29/01/97/1394290197.db2.gz	ALHNPKKGFRXUGA-INIZCTEOSA-N	0	3	333.501	3.286	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)C2(Cc3ccccc3F)CC2)C1	ZINC001490935816	1394379603	/nfs/dbraw/zinc/37/96/03/1394379603.db2.gz	XAPBCPGLQNOLOC-SHTZXODSSA-N	0	3	336.838	3.138	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2coc(C)n2)CCCC[C@H]1C	ZINC001481957584	1394619689	/nfs/dbraw/zinc/61/96/89/1394619689.db2.gz	QQUQCJJODFGBCH-BDJLRTHQSA-N	0	3	325.840	3.004	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1sc(CC)nc1C)C(C)C	ZINC001698971733	1406736862	/nfs/dbraw/zinc/73/68/62/1406736862.db2.gz	AZRDAYCKYVXETD-LBPRGKRZSA-N	0	3	329.897	3.110	20	30		EGEDHN
CC(C)CCC(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001483960755	1395163615	/nfs/dbraw/zinc/16/36/15/1395163615.db2.gz	PWIHTJIISMMYEQ-UHFFFAOYSA-N	0	3	327.472	3.465	20	30		EGEDHN
C=C(Br)CN[C@@H](CNC(=O)C1(F)CCCCC1)C(C)C	ZINC001698977432	1406748537	/nfs/dbraw/zinc/74/85/37/1406748537.db2.gz	JLVLVWFTYNHZAC-ZDUSSCGKSA-N	0	3	349.288	3.298	20	30		EGEDHN
CCCC(=O)NCC1(C)CCN(Cc2ccc(OC)c(C#N)c2)CC1	ZINC001484129962	1395269417	/nfs/dbraw/zinc/26/94/17/1395269417.db2.gz	WXDZMRZESUBEGW-UHFFFAOYSA-N	0	3	343.471	3.085	20	30		EGEDHN
C[C@H](C#N)C(=O)N(C)CCN(C)Cc1ccc(-c2ccsc2)cc1	ZINC001698983050	1406763077	/nfs/dbraw/zinc/76/30/77/1406763077.db2.gz	FLTQRVXZEFQAMV-OAHLLOKOSA-N	0	3	341.480	3.465	20	30		EGEDHN
Cc1cc(C)c(C(=O)NC[C@H](C)N(C)Cc2cccc(C#N)c2)s1	ZINC001485306716	1395784657	/nfs/dbraw/zinc/78/46/57/1395784657.db2.gz	OAVLKXUUVZLANO-AWEZNQCLSA-N	0	3	341.480	3.487	20	30		EGEDHN
CCC1(C(=O)N[C@@H]2CC[C@@H](CNCc3ccccc3C#N)C2)CC1	ZINC001486211740	1396183338	/nfs/dbraw/zinc/18/33/38/1396183338.db2.gz	DNGCQVUESOWXOQ-CRAIPNDOSA-N	0	3	325.456	3.123	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)Cc1ccc(F)cc1Cl	ZINC001492079010	1396302772	/nfs/dbraw/zinc/30/27/72/1396302772.db2.gz	ZDBSCJCPLYKXRE-NSHDSACASA-N	0	3	333.234	3.259	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)N(C)C(=O)c1ccc(CF)cc1	ZINC001496251758	1396626585	/nfs/dbraw/zinc/62/65/85/1396626585.db2.gz	VXNQLUOZGQFUBI-CYBMUJFWSA-N	0	3	345.443	3.340	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CCN(Cc2cccc3cccnc32)C1	ZINC001690100516	1404299791	/nfs/dbraw/zinc/29/97/91/1404299791.db2.gz	OYUKTMAAFFPMNZ-LJQANCHMSA-N	0	3	335.451	3.119	20	30		EGEDHN
Cc1cccc(CC(=O)NC[C@@H](C)N(C)Cc2ccc(C#N)cc2)c1	ZINC001725180294	1425704481	/nfs/dbraw/zinc/70/44/81/1425704481.db2.gz	VFOOEYQMHSKXKR-QGZVFWFLSA-N	0	3	335.451	3.046	20	30		EGEDHN
C=Cc1ccc(C(=O)NCC[C@@H](C)NCc2ccccc2C#N)cc1	ZINC001690865475	1404784034	/nfs/dbraw/zinc/78/40/34/1404784034.db2.gz	OGBDVAJCKXTZLI-MRXNPFEDSA-N	0	3	333.435	3.499	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)[C@H](C)C2CCCC2)C1	ZINC001691123988	1405064086	/nfs/dbraw/zinc/06/40/86/1405064086.db2.gz	RFINHLNBBQNKBW-NFAWXSAZSA-N	0	3	343.309	3.206	20	30		EGEDHN
C[C@H](C#N)C(=O)NC[C@H]1C[C@H](NCc2cccc(Cl)c2Cl)C1	ZINC001691138394	1405073057	/nfs/dbraw/zinc/07/30/57/1405073057.db2.gz	QBAIXNPUDCUXBW-NQBHXWOUSA-N	0	3	340.254	3.137	20	30		EGEDHN
C[C@H](C(=O)NC[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1)C1CCC1	ZINC001691506058	1405309589	/nfs/dbraw/zinc/30/95/89/1405309589.db2.gz	DMCVJOVDZUFKJI-YEWWUXTCSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)[C@@H](C)C(C)(C)C)C1	ZINC001691506863	1405310534	/nfs/dbraw/zinc/31/05/34/1405310534.db2.gz	YPYXHEUESFTHQB-JHJVBQTASA-N	0	3	331.298	3.062	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1cccc2[nH]ccc21)C1CC1	ZINC001732248228	1428491425	/nfs/dbraw/zinc/49/14/25/1428491425.db2.gz	PPOKVHBJXHGZLD-GOSISDBHSA-N	0	3	331.847	3.409	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2c(C)noc2C)CCCC[C@@H]1C	ZINC001732254170	1428495559	/nfs/dbraw/zinc/49/55/59/1428495559.db2.gz	TUJDFWFNCQWEKP-GTNSWQLSSA-N	0	3	339.867	3.312	20	30		EGEDHN
C[C@@H](C#N)C(=O)N[C@H]1CC[C@H](N[C@@H](C)c2nc3ccccc3o2)CC1	ZINC001732305894	1428521707	/nfs/dbraw/zinc/52/17/07/1428521707.db2.gz	JEQWEUVRBOBFOF-AJNGGQMLSA-N	0	3	340.427	3.065	20	30		EGEDHN
CCc1ccc(C(=O)N(C)[C@@H](C)CNCc2ccc(C#N)s2)s1	ZINC001732425972	1428576112	/nfs/dbraw/zinc/57/61/12/1428576112.db2.gz	DDXJNJMABIIAND-LBPRGKRZSA-N	0	3	347.509	3.494	20	30		EGEDHN
Cc1csc(C(=O)N[C@H](C)CN(C)Cc2cccc(C#N)c2)c1	ZINC001699444876	1412777289	/nfs/dbraw/zinc/77/72/89/1412777289.db2.gz	BGUNMUYHZNSZKO-CQSZACIVSA-N	0	3	327.453	3.179	20	30		EGEDHN
CC1(NC(=O)CC2CCC2)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001699771746	1413178492	/nfs/dbraw/zinc/17/84/92/1413178492.db2.gz	KVGMNCSAAAZOBE-UHFFFAOYSA-N	0	3	325.456	3.219	20	30		EGEDHN
C[C@@]1(CNCc2ccccc2C#N)CCN(C(=O)C2(F)CCCC2)C1	ZINC001699841782	1413270433	/nfs/dbraw/zinc/27/04/33/1413270433.db2.gz	IUWJQCPRWSJNIB-IBGZPJMESA-N	0	3	343.446	3.169	20	30		EGEDHN
N#Cc1cc(CNC2(CNC(=O)C3CCCCC3)CCC2)ccc1F	ZINC001700128939	1413544500	/nfs/dbraw/zinc/54/45/00/1413544500.db2.gz	HGDMCXRPRILYEN-UHFFFAOYSA-N	0	3	343.446	3.406	20	30		EGEDHN
CCC(C)(C)C(=O)N[C@H]1CCN(Cc2cccc(C#N)c2)[C@H](C)C1	ZINC001700317232	1413777812	/nfs/dbraw/zinc/77/78/12/1413777812.db2.gz	FJBKQUHAWFJWKU-QAPCUYQASA-N	0	3	327.472	3.464	20	30		EGEDHN
C[C@@H](CCNC(=O)[C@@H](C)C1CCC1)NCc1cc(C#N)ccc1F	ZINC001700325124	1413794779	/nfs/dbraw/zinc/79/47/79/1413794779.db2.gz	OUKDBHMLXBIYHZ-KBPBESRZSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cc(Cl)c(Cl)[nH]1)C(C)C	ZINC001732564389	1428755755	/nfs/dbraw/zinc/75/57/55/1428755755.db2.gz	HCYMQZZPOFRYSK-NSHDSACASA-N	0	3	338.666	3.418	20	30		EGEDHN
C[C@@H](CNCc1ccc(F)c(C#N)c1)NC(=O)c1ccc(Cl)cc1	ZINC001733021078	1429140255	/nfs/dbraw/zinc/14/02/55/1429140255.db2.gz	LBJKRJYPKXWMQW-LBPRGKRZSA-N	0	3	345.805	3.259	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@@H](CNC(=O)C2CCCCC2)C2CC2)c1	ZINC001713102968	1417658337	/nfs/dbraw/zinc/65/83/37/1417658337.db2.gz	KWBMMVHUHTYQFH-IBGZPJMESA-N	0	3	343.446	3.262	20	30		EGEDHN
CC[C@@H](SC)C(=O)N1CCCC[C@H]1CNCC#Cc1ccccc1	ZINC001713261517	1417870185	/nfs/dbraw/zinc/87/01/85/1417870185.db2.gz	VZYJAGZFJNHQHL-RBUKOAKNSA-N	0	3	344.524	3.150	20	30		EGEDHN
CCN(CCNC(=O)c1c(C)coc1C)Cc1cccc(C#N)c1	ZINC001713483759	1418174576	/nfs/dbraw/zinc/17/45/76/1418174576.db2.gz	JFSZZBJDBMCECZ-UHFFFAOYSA-N	0	3	325.412	3.020	20	30		EGEDHN
Cc1ccccc1CC(=O)NC[C@@H]1CCN(Cc2ccc(C#N)cc2)C1	ZINC001713540688	1418300935	/nfs/dbraw/zinc/30/09/35/1418300935.db2.gz	BHKRAJUUZJUYHV-FQEVSTJZSA-N	0	3	347.462	3.048	20	30		EGEDHN
N#Cc1ccc(CN[C@@H](CNC(=O)CC2CCCC2)C2CC2)c(F)c1	ZINC001713860168	1418657522	/nfs/dbraw/zinc/65/75/22/1418657522.db2.gz	QTEYXPUFJDPCNG-IBGZPJMESA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2cc(C)no2)CCCC[C@H]1C	ZINC001714177191	1418984725	/nfs/dbraw/zinc/98/47/25/1418984725.db2.gz	DHOOYQBXWDGJGH-BDJLRTHQSA-N	0	3	325.840	3.004	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@@H](C)CNCc2ccccc2C#N)c(F)c1	ZINC001714428063	1419161429	/nfs/dbraw/zinc/16/14/29/1419161429.db2.gz	CIUQXZMCWQTUQU-HNNXBMFYSA-N	0	3	339.414	3.162	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)[C@H]2CC23CCC3)CCCC1	ZINC001714507704	1419235047	/nfs/dbraw/zinc/23/50/47/1419235047.db2.gz	LKACPDXUDRULIJ-CYBMUJFWSA-N	0	3	341.293	3.104	20	30		EGEDHN
CCN(CCNC(=O)c1cc(C)oc1C)Cc1cccc(C#N)c1	ZINC001714576327	1419312374	/nfs/dbraw/zinc/31/23/74/1419312374.db2.gz	PNXNZDABJNVTCB-UHFFFAOYSA-N	0	3	325.412	3.020	20	30		EGEDHN
CCN(CCNC(=O)[C@@H](C)c1cccs1)Cc1ccc(C#N)cc1	ZINC001714592316	1419340675	/nfs/dbraw/zinc/34/06/75/1419340675.db2.gz	LNKMGDKSIFKUJP-HNNXBMFYSA-N	0	3	341.480	3.362	20	30		EGEDHN
C=CC1(CC(=O)N[C@@H]2CCN(CCOC3CCC3)C2)CCCCC1	ZINC001715005240	1419735234	/nfs/dbraw/zinc/73/52/34/1419735234.db2.gz	ADCXAYCMVJGQAB-QGZVFWFLSA-N	0	3	334.504	3.273	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2ccncc2Cl)CCCC1	ZINC001715102965	1419843795	/nfs/dbraw/zinc/84/37/95/1419843795.db2.gz	DYFXEVJUKSTFAV-UHFFFAOYSA-N	0	3	328.243	3.120	20	30		EGEDHN
C[C@](CNCc1ccc(C#N)cc1F)(NC(=O)C1=CCCC1)C1CC1	ZINC001715113550	1419857137	/nfs/dbraw/zinc/85/71/37/1419857137.db2.gz	MLTOEVPWFDGBLK-HXUWFJFHSA-N	0	3	341.430	3.182	20	30		EGEDHN
C[C@](CNCc1ccc(C#N)cc1F)(NC(=O)CC1CCC1)C1CC1	ZINC001715116080	1419860816	/nfs/dbraw/zinc/86/08/16/1419860816.db2.gz	UBZASVOKRFYVNY-HXUWFJFHSA-N	0	3	343.446	3.262	20	30		EGEDHN
N#Cc1cc(CNC2(CNC(=O)[C@H]3CC34CCCC4)CC2)ccc1F	ZINC001733261211	1429414935	/nfs/dbraw/zinc/41/49/35/1429414935.db2.gz	UHOCBKXMHPNAIE-MRXNPFEDSA-N	0	3	341.430	3.016	20	30		EGEDHN
CC(C)CC(=O)NC[C@]1(C)CCCN(Cc2ccc(C#N)cc2)C1	ZINC001716891332	1421016841	/nfs/dbraw/zinc/01/68/41/1421016841.db2.gz	LZQONAQBMSKFCZ-FQEVSTJZSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C(Br)CNC1CC(N(C)C(=O)CCC2CCC2)C1	ZINC001717989820	1421760256	/nfs/dbraw/zinc/76/02/56/1421760256.db2.gz	LVFZGGDVTXCVGF-UHFFFAOYSA-N	0	3	329.282	3.054	20	30		EGEDHN
Cc1occc1C(=O)N1CC[C@@](C)(CNCc2ccccc2C#N)C1	ZINC001733419130	1429624255	/nfs/dbraw/zinc/62/42/55/1429624255.db2.gz	QPZHPSIGDMJALW-FQEVSTJZSA-N	0	3	337.423	3.102	20	30		EGEDHN
C[C@]1(CNC(=O)CC2CC2)CCCN(Cc2ccc(C#N)cc2)C1	ZINC001733453929	1429668343	/nfs/dbraw/zinc/66/83/43/1429668343.db2.gz	AIIVPRJPILZCDE-HXUWFJFHSA-N	0	3	325.456	3.077	20	30		EGEDHN
Cc1nc(C)c(CN(CCNC(=O)[C@H](C)C#N)C2CCCCCC2)o1	ZINC001723639047	1424502449	/nfs/dbraw/zinc/50/24/49/1424502449.db2.gz	DLBZYRAPYVXIIA-CQSZACIVSA-N	0	3	346.475	3.092	20	30		EGEDHN
C[C@H](CC(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1)C1CC1	ZINC001724025022	1424633183	/nfs/dbraw/zinc/63/31/83/1424633183.db2.gz	BNCPKQYAVCBNJJ-MRXNPFEDSA-N	0	3	339.483	3.465	20	30		EGEDHN
CCCC(=O)N[C@H](CNCc1ccc(C#N)cc1F)C1CCCC1	ZINC001724073905	1424649199	/nfs/dbraw/zinc/64/91/99/1424649199.db2.gz	UMVFBENSLQOVDJ-GOSISDBHSA-N	0	3	331.435	3.262	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)C(C)(C)C(F)F)CCN1Cc1cccc(C#N)c1	ZINC001724994502	1425398250	/nfs/dbraw/zinc/39/82/50/1425398250.db2.gz	IACPLZRSDRRSLR-XJKSGUPXSA-N	0	3	349.425	3.319	20	30		EGEDHN
CN(CC(C)(C)CNCc1ccccc1C#N)C(=O)c1ccoc1	ZINC001725142083	1425621798	/nfs/dbraw/zinc/62/17/98/1425621798.db2.gz	UZUWFIJFFCYHJU-UHFFFAOYSA-N	0	3	325.412	3.039	20	30		EGEDHN
C=C(Br)CNC[C@@H](NC(=O)C(CC)CC)C(C)(C)C	ZINC001725742344	1426418787	/nfs/dbraw/zinc/41/87/87/1426418787.db2.gz	BWNFTHKZMHMKBD-CYBMUJFWSA-N	0	3	333.314	3.452	20	30		EGEDHN
CC(C)(C)[C@@H](CNCc1ccc(C#N)s1)NC(=O)CC(F)(F)F	ZINC001725746457	1426424263	/nfs/dbraw/zinc/42/42/63/1426424263.db2.gz	OXRLXBYTZBGPBM-GFCCVEGCSA-N	0	3	347.406	3.193	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccc(Cl)cc1)NCc1ccc(F)c(C#N)c1	ZINC001731630784	1427682714	/nfs/dbraw/zinc/68/27/14/1427682714.db2.gz	KUWMXLOUGKURNG-LBPRGKRZSA-N	0	3	345.805	3.259	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)CC1CCCCC1	ZINC001731722533	1427795336	/nfs/dbraw/zinc/79/53/36/1427795336.db2.gz	QJOKBVFQZFHQMZ-CYBMUJFWSA-N	0	3	331.298	3.350	20	30		EGEDHN
CC1(CC(=O)N[C@@H]2CCN(Cc3cccc(C#N)c3)CC2(C)C)CC1	ZINC001733874911	1437701436	/nfs/dbraw/zinc/70/14/36/1437701436.db2.gz	HNHGAEDWHDWEOW-GOSISDBHSA-N	0	3	339.483	3.465	20	30		EGEDHN
Cc1cc(F)cc(C(=O)NC[C@@H](C)N(C)Cc2ccc(C#N)cc2)c1	ZINC001734056536	1437847990	/nfs/dbraw/zinc/84/79/90/1437847990.db2.gz	XWQZZMYAQVQCOK-OAHLLOKOSA-N	0	3	339.414	3.256	20	30		EGEDHN
CN(CCCNC(=O)[C@H]1CCC[C@@H](F)C1)Cc1ccc(F)c(C#N)c1	ZINC001751976146	1440129994	/nfs/dbraw/zinc/12/99/94/1440129994.db2.gz	ZLVXTTNJPVKKJZ-DOTOQJQBSA-N	0	3	349.425	3.164	20	30		EGEDHN
CC#CCCCC(=O)N1CCCC[C@H]1[C@H](C)NCc1ccns1	ZINC001752143467	1440145149	/nfs/dbraw/zinc/14/51/49/1440145149.db2.gz	MSCLFLGAUOYXMK-RDJZCZTQSA-N	0	3	333.501	3.196	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)CN(C)c1ccccc1	ZINC001752153906	1440146430	/nfs/dbraw/zinc/14/64/30/1440146430.db2.gz	ADDIXZZXBKWCIT-WMZOPIPTSA-N	0	3	349.906	3.235	20	30		EGEDHN
CC#CCN(CCCNC(=O)Cc1c(C)[nH]c2ccccc21)C1CC1	ZINC001752277463	1440164048	/nfs/dbraw/zinc/16/40/48/1440164048.db2.gz	HQYWMOSXUBXRAT-UHFFFAOYSA-N	0	3	337.467	3.013	20	30		EGEDHN
CC#CCN(CCCNC(=O)c1sccc1C(F)F)C1CC1	ZINC001752285163	1440165186	/nfs/dbraw/zinc/16/51/86/1440165186.db2.gz	QCDBTWVVZWESRB-UHFFFAOYSA-N	0	3	326.412	3.293	20	30		EGEDHN
CC#CCN(CCCNC(=O)c1ccc(OC2CCC2)cc1)C1CC1	ZINC001752292619	1440166564	/nfs/dbraw/zinc/16/65/64/1440166564.db2.gz	AIXVUBCFXKIHBM-UHFFFAOYSA-N	0	3	340.467	3.226	20	30		EGEDHN
CC(C)C#CC(=O)N(C)C1CCN(CCOC2CCCCCC2)CC1	ZINC001752299351	1440167254	/nfs/dbraw/zinc/16/72/54/1440167254.db2.gz	DDCQBYKVQZVJGI-UHFFFAOYSA-N	0	3	348.531	3.308	20	30		EGEDHN
C=CCCN1CCN(CCNC(=O)C2CC(C)(C)CC(C)(C)C2)CC1	ZINC001752371192	1440172606	/nfs/dbraw/zinc/17/26/06/1440172606.db2.gz	RYMSVWZMSUZKTR-UHFFFAOYSA-N	0	3	349.563	3.149	20	30		EGEDHN
C=CCOCC(=O)N[C@@H]1CC12CCN([C@H](C)c1ccccc1F)CC2	ZINC001752419015	1440175490	/nfs/dbraw/zinc/17/54/90/1440175490.db2.gz	BIUDDYQZOKTRPS-CRAIPNDOSA-N	0	3	346.446	3.060	20	30		EGEDHN
N#Cc1ccc(CN[C@H](CNC(=O)C2=CCCCCC2)C2CC2)s1	ZINC001752457238	1440183213	/nfs/dbraw/zinc/18/32/13/1440183213.db2.gz	GBAUFUYRISRUPC-GOSISDBHSA-N	0	3	343.496	3.495	20	30		EGEDHN
C[C@@H](C(=O)NC[C@H](NCc1ccc(C#N)cc1F)C1CC1)C(C)(C)C	ZINC001752468567	1440184091	/nfs/dbraw/zinc/18/40/91/1440184091.db2.gz	JPAVRGUAVFVOKH-UGSOOPFHSA-N	0	3	345.462	3.364	20	30		EGEDHN
C[C@@H](C(=O)NC[C@H](NCc1ccc(C#N)s1)C1CC1)c1ccco1	ZINC001752481721	1440185792	/nfs/dbraw/zinc/18/57/92/1440185792.db2.gz	GHKXGLQSAOOPEL-WBMJQRKESA-N	0	3	343.452	3.001	20	30		EGEDHN
C=CCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2ccncc2c1	ZINC001752543743	1440194858	/nfs/dbraw/zinc/19/48/58/1440194858.db2.gz	UKOBQWFYRVSWSH-BGYRXZFFSA-N	0	3	335.451	3.490	20	30		EGEDHN
C[C@H](C#N)C(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1cccc(Cl)c1	ZINC001752690157	1440200470	/nfs/dbraw/zinc/20/04/70/1440200470.db2.gz	QGBBDKLYZBSWIJ-FCLXEUQJSA-N	0	3	331.847	3.111	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@@H]2CN(Cc3c(C)noc3C)CC[C@H]21	ZINC001752705759	1440202260	/nfs/dbraw/zinc/20/22/60/1440202260.db2.gz	BKUDMQZOWGICME-IEBWSBKVSA-N	0	3	345.487	3.461	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H]2CN(Cc3cccnc3C)CC[C@@H]21	ZINC001752708357	1440203247	/nfs/dbraw/zinc/20/32/47/1440203247.db2.gz	ZZRYLOYJGZBEHV-UXHICEINSA-N	0	3	339.483	3.006	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@@H]1CCCCN1CCc1cnn(CC)c1	ZINC001752822149	1440221266	/nfs/dbraw/zinc/22/12/66/1440221266.db2.gz	AKCBLDBOMIWRGI-SFHVURJKSA-N	0	3	346.519	3.019	20	30		EGEDHN
C=CCCC(=O)N1CCCC[C@H]1[C@H]1CCCN1Cc1conc1C	ZINC001752832484	1440225860	/nfs/dbraw/zinc/22/58/60/1440225860.db2.gz	WQXLHRGPCTVGSF-MSOLQXFVSA-N	0	3	331.460	3.295	20	30		EGEDHN
CCCC1(C(=O)N2CCCC[C@H]2[C@H]2CCCN2CC#CCOC)CC1	ZINC001752833021	1440226218	/nfs/dbraw/zinc/22/62/18/1440226218.db2.gz	AJMOQSSEAQMING-MOPGFXCFSA-N	0	3	346.515	3.062	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)CC(C)(C)C(F)(F)F)C1	ZINC001752841384	1440230804	/nfs/dbraw/zinc/23/08/04/1440230804.db2.gz	PUEWGVKKWXGPHC-ZIAGYGMSSA-N	0	3	332.410	3.205	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)CCc2ccc(C)s2)C1	ZINC001752841967	1440231084	/nfs/dbraw/zinc/23/10/84/1440231084.db2.gz	VWLOKCCSUAXLSS-DLBZAZTESA-N	0	3	332.513	3.229	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)CCc2ccc(C)s2)C1	ZINC001752841969	1440231247	/nfs/dbraw/zinc/23/12/47/1440231247.db2.gz	VWLOKCCSUAXLSS-IRXDYDNUSA-N	0	3	332.513	3.229	20	30		EGEDHN
C[C@@H](CNC(=O)[C@@H]1CCC=CCCC1)NCc1ccc(C#N)s1	ZINC001752883920	1440239589	/nfs/dbraw/zinc/23/95/89/1440239589.db2.gz	NAETYMFKCTYOCQ-LSDHHAIUSA-N	0	3	331.485	3.351	20	30		EGEDHN
CCCC[C@@](C)(F)C(=O)N1CC[C@H](CNCc2ccccc2C#N)C1	ZINC001752943309	1440251102	/nfs/dbraw/zinc/25/11/02/1440251102.db2.gz	KRWXUFGLEZBTEF-OXQOHEQNSA-N	0	3	345.462	3.415	20	30		EGEDHN
C/C=C(/C)C(=O)N[C@@H]1CCC[C@@H](NCc2cc(F)ccc2C#N)C1	ZINC001752966825	1440254185	/nfs/dbraw/zinc/25/41/85/1440254185.db2.gz	KNLILVFUZWFTBY-YYQAOVIASA-N	0	3	329.419	3.181	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)c(F)c2)C1	ZINC001752992032	1440259580	/nfs/dbraw/zinc/25/95/80/1440259580.db2.gz	CTDZWPIVRJAIFD-GOSISDBHSA-N	0	3	343.446	3.476	20	30		EGEDHN
CC#CCN(C)[C@H]1CCCN(C(=O)C[C@@H](C)c2ccccc2F)C1	ZINC001752998833	1440263352	/nfs/dbraw/zinc/26/33/52/1440263352.db2.gz	NSHGCNCBDFOEGC-SJORKVTESA-N	0	3	330.447	3.265	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)CCC1CCCC1	ZINC001753001604	1440264848	/nfs/dbraw/zinc/26/48/48/1440264848.db2.gz	GIMOWWXSXUIPAQ-CYBMUJFWSA-N	0	3	331.298	3.350	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1CCCNC(=O)c1cc(OC)cs1	ZINC001753032857	1440273327	/nfs/dbraw/zinc/27/33/27/1440273327.db2.gz	YXYSWHYHAOLOBK-CYBMUJFWSA-N	0	3	342.892	3.484	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCC[C@@H]1CCCN1Cc1nccnc1C	ZINC001753033403	1440273668	/nfs/dbraw/zinc/27/36/68/1440273668.db2.gz	LVTHKLMSJATQCJ-XLIONFOSSA-N	0	3	344.503	3.248	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)NCCN(CC)[C@H](C)c1ccc(Cl)cc1	ZINC001753080688	1440293428	/nfs/dbraw/zinc/29/34/28/1440293428.db2.gz	FJDREJONNXSMPG-KDOFPFPSSA-N	0	3	338.879	3.166	20	30		EGEDHN
CCN(CCNC(=O)CC1(C)CCCC1)Cc1ccc(C#N)cc1	ZINC001753081527	1440294069	/nfs/dbraw/zinc/29/40/69/1440294069.db2.gz	IVQHBMSXMUQVFD-UHFFFAOYSA-N	0	3	327.472	3.467	20	30		EGEDHN
CCN(CCNC(=O)[C@@H]1CCCC[C@H]1C)Cc1ccc(C#N)cc1	ZINC001753087445	1440296984	/nfs/dbraw/zinc/29/69/84/1440296984.db2.gz	FXOLPSKYDXLYDN-VQIMIIECSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@@H]1CCCN1Cc1ccc(OC)cc1	ZINC001753110717	1440308413	/nfs/dbraw/zinc/30/84/13/1440308413.db2.gz	SUBLZQFCOVKWOL-AEFFLSMTSA-N	0	3	330.472	3.378	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@H]1CCN(Cc2cn(C(C)C)nc2C)C1	ZINC001753132291	1440317346	/nfs/dbraw/zinc/31/73/46/1440317346.db2.gz	LUMQFMVNHCJGRG-ZWKOTPCHSA-N	0	3	346.519	3.313	20	30		EGEDHN
COCC#CCN1CC[C@@H](CNC(=O)CC(C)(C)C2CCCCC2)C1	ZINC001753137439	1440319553	/nfs/dbraw/zinc/31/95/53/1440319553.db2.gz	JTIVRARYIHWQIW-SFHVURJKSA-N	0	3	348.531	3.071	20	30		EGEDHN
CCCN(CCNC(=O)[C@@H]1C[C@H]1C1CCC1)Cc1cccc(C#N)c1	ZINC001753148880	1440326616	/nfs/dbraw/zinc/32/66/16/1440326616.db2.gz	QSVZLJGPAAVZEN-VQTJNVASSA-N	0	3	339.483	3.323	20	30		EGEDHN
C#CCCCC(=O)NCCN(C1CC1)[C@H]1CCc2ccc(F)cc21	ZINC001753153090	1440329195	/nfs/dbraw/zinc/32/91/95/1440329195.db2.gz	METFLVQRBXNIQY-IBGZPJMESA-N	0	3	328.431	3.197	20	30		EGEDHN
CC[C@@H]1CCC[C@]1(C)C(=O)N(C)CCNCc1ccc(C#N)s1	ZINC001753202463	1440338409	/nfs/dbraw/zinc/33/84/09/1440338409.db2.gz	SKZRURFNNJHBAU-KDOFPFPSSA-N	0	3	333.501	3.384	20	30		EGEDHN
CC[C@H]1CCC[C@@H]1C(=O)N(C)CCNCc1ccc(F)c(C#N)c1	ZINC001753227976	1440340880	/nfs/dbraw/zinc/34/08/80/1440340880.db2.gz	HBKNLURAMUCRBT-RDJZCZTQSA-N	0	3	331.435	3.072	20	30		EGEDHN
Cc1cc(F)cc(C(=O)N(C)CCNCc2ccc(F)c(C#N)c2)c1	ZINC001753233196	1440341350	/nfs/dbraw/zinc/34/13/50/1440341350.db2.gz	CJPGRLMSCSWEFO-UHFFFAOYSA-N	0	3	343.377	3.007	20	30		EGEDHN
CC[C@H](CC(F)(F)F)C(=O)N(C)CCNCc1cccc(C#N)c1	ZINC001753251834	1440343094	/nfs/dbraw/zinc/34/30/94/1440343094.db2.gz	BKFSPJQRLDDHQO-OAHLLOKOSA-N	0	3	341.377	3.085	20	30		EGEDHN
CC(C)N(CCCNC(=O)C1=COCCC1)Cc1ccc(C#N)s1	ZINC001753284830	1440348419	/nfs/dbraw/zinc/34/84/19/1440348419.db2.gz	MOCKKYNUDMWLPG-UHFFFAOYSA-N	0	3	347.484	3.031	20	30		EGEDHN
C=C(C)CN[C@H](CNC(=O)[C@]1(F)CCOC1)c1ccc(C(C)C)cc1	ZINC001753294542	1440351839	/nfs/dbraw/zinc/35/18/39/1440351839.db2.gz	PBNZSJLMXMFZQL-QUCCMNQESA-N	0	3	348.462	3.262	20	30		EGEDHN
C=C(C)CN[C@@H](CNC(=O)[C@@H](C)Cc1ccco1)c1ccccc1	ZINC001753314425	1440358547	/nfs/dbraw/zinc/35/85/47/1440358547.db2.gz	ZOZGRMUNYNOBIY-LPHOPBHVSA-N	0	3	326.440	3.481	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CCC)C(=O)[C@H](OC)C2CCCCC2)C1	ZINC001753324228	1440365508	/nfs/dbraw/zinc/36/55/08/1440365508.db2.gz	ZWSFAJWLGLEUHY-RBUKOAKNSA-N	0	3	336.520	3.471	20	30		EGEDHN
C#CCCCCC(=O)NCC[C@H]1CCN(CC#Cc2ccccc2)C1	ZINC001753326228	1440366800	/nfs/dbraw/zinc/36/68/00/1440366800.db2.gz	HKAPHQGVHFFIPA-NRFANRHFSA-N	0	3	336.479	3.060	20	30		EGEDHN
C#CCCN1CC[C@H](N(CCC)C(=O)[C@H](C)OC2CCCCCC2)C1	ZINC001753328921	1440368394	/nfs/dbraw/zinc/36/83/94/1440368394.db2.gz	QJLCZNWOSXXBGA-OALUTQOASA-N	0	3	348.531	3.451	20	30		EGEDHN
CC#CCCCC(=O)N(C)[C@@H]1CCN(Cc2cccc(OC)c2C)C1	ZINC001753440969	1440401797	/nfs/dbraw/zinc/40/17/97/1440401797.db2.gz	AAQCOECZIGAOEU-LJQANCHMSA-N	0	3	342.483	3.230	20	30		EGEDHN
C=CCCCC(=O)N(C)[C@@H]1CCN(Cc2ccccc2N(C)C)C1	ZINC001753441864	1440401944	/nfs/dbraw/zinc/40/19/44/1440401944.db2.gz	QIOBMNZOPZKZIR-GOSISDBHSA-N	0	3	329.488	3.142	20	30		EGEDHN
C=CCC1(C(=O)N(C)[C@@H]2CCN(CCOCC(C)C)C2)CCCC1	ZINC001753449851	1440405359	/nfs/dbraw/zinc/40/53/59/1440405359.db2.gz	KHOSZRPHDXLFIQ-GOSISDBHSA-N	0	3	336.520	3.328	20	30		EGEDHN
C#CCCCC(=O)N(CC)[C@@H]1CCN(Cc2ccc3ncccc3c2)C1	ZINC001753454659	1440407729	/nfs/dbraw/zinc/40/77/29/1440407729.db2.gz	AHNFPVFDZAUSSD-HXUWFJFHSA-N	0	3	349.478	3.461	20	30		EGEDHN
C=CCCOCC(=O)N(CC)[C@@H]1CCN(Cc2ccc(C)c(C)c2)C1	ZINC001753463955	1440412111	/nfs/dbraw/zinc/41/21/11/1440412111.db2.gz	LAEJZEPVQQBRLM-HXUWFJFHSA-N	0	3	344.499	3.319	20	30		EGEDHN
CC[C@@H](CNC(=O)[C@@H]1C[C@H]1CC(C)C)NCc1ccc(C#N)c(F)c1	ZINC001753485882	1440417732	/nfs/dbraw/zinc/41/77/32/1440417732.db2.gz	DMWSVHWSCGHOIR-FGTMMUONSA-N	0	3	345.462	3.364	20	30		EGEDHN
CC[C@H](CNC(=O)c1cc2c([nH]1)CCCC2)NCC#Cc1ccccc1	ZINC001753492073	1440419894	/nfs/dbraw/zinc/41/98/94/1440419894.db2.gz	GONWOYZDWWQFGN-LJQANCHMSA-N	0	3	349.478	3.043	20	30		EGEDHN
C=C(Br)CNC[C@](C)(NC(=O)/C=C(\C)C1CC1)C1CC1	ZINC001753514460	1440427018	/nfs/dbraw/zinc/42/70/18/1440427018.db2.gz	ITNVFGDJEVDXME-KXKDPZRNSA-N	0	3	341.293	3.126	20	30		EGEDHN
C#CCCCC(=O)N[C@]1(CNCc2cncs2)CCCC[C@@H]1C	ZINC001753532665	1440431503	/nfs/dbraw/zinc/43/15/03/1440431503.db2.gz	UKGSSKXCRQGXAU-YJBOKZPZSA-N	0	3	333.501	3.101	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1CC[C@H](NCc2oc(C)nc2C)CC1	ZINC001753584092	1440440959	/nfs/dbraw/zinc/44/09/59/1440440959.db2.gz	YMFLGWZGXBMRJH-IYARVYRRSA-N	0	3	345.487	3.392	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@@H](C)CNCc1nc2ccccc2o1	ZINC001753633626	1440452674	/nfs/dbraw/zinc/45/26/74/1440452674.db2.gz	HEXFVNGKJAPQQA-AWEZNQCLSA-N	0	3	329.444	3.272	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC1(N[C@@H](C)c2n[nH]c(CC)n2)CCCC1	ZINC001753667928	1440460952	/nfs/dbraw/zinc/46/09/52/1440460952.db2.gz	OKDITCXPHQWTHI-KBXCAEBGSA-N	0	3	347.507	3.049	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cnc(CC)s2)CCCC1	ZINC001753670876	1440461999	/nfs/dbraw/zinc/46/19/99/1440461999.db2.gz	LTKUNDUCYLBQMF-UHFFFAOYSA-N	0	3	327.881	3.090	20	30		EGEDHN
C[C@@H](C(=O)N(C)[C@@H](C)CNCC#Cc1cccc(Cl)c1)C1CC1	ZINC001753687669	1440465907	/nfs/dbraw/zinc/46/59/07/1440465907.db2.gz	RKBUJBPQOUSWOY-LSDHHAIUSA-N	0	3	332.875	3.174	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)N(C)C(=O)CCc1ccsc1	ZINC001753694770	1440467324	/nfs/dbraw/zinc/46/73/24/1440467324.db2.gz	GCEDLDGJHKVJIA-ZDUSSCGKSA-N	0	3	347.509	3.251	20	30		EGEDHN
Cc1cc(F)cc(C(=O)N(C)[C@@H](C)CNCC#Cc2ccccc2)c1	ZINC001753715047	1440471704	/nfs/dbraw/zinc/47/17/04/1440471704.db2.gz	OOUWALZTDRBDMD-KRWDZBQOSA-N	0	3	338.426	3.236	20	30		EGEDHN
C[C@H](CNCC#Cc1ccccc1)N(C)C(=O)[C@@H](C)C1CCCC1	ZINC001753719689	1440472737	/nfs/dbraw/zinc/47/27/37/1440472737.db2.gz	LFFYQSFYFANYCH-MSOLQXFVSA-N	0	3	326.484	3.301	20	30		EGEDHN
CC(C)C[C@H](CNCC#Cc1ccccc1)NC(=O)CC1(C)CC1	ZINC001753736751	1440477920	/nfs/dbraw/zinc/47/79/20/1440477920.db2.gz	JPMLSOKZPGKKSP-LJQANCHMSA-N	0	3	326.484	3.349	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCCCN1C(=O)c1ccc2n[nH]cc2c1	ZINC001753783530	1440487735	/nfs/dbraw/zinc/48/77/35/1440487735.db2.gz	DVODBBLRABUKRP-INIZCTEOSA-N	0	3	346.862	3.290	20	30		EGEDHN
C[C@H]1CCCN(C(=O)C2=CCCC2)[C@H]1CNCC#Cc1ccccc1	ZINC001753804128	1440491536	/nfs/dbraw/zinc/49/15/36/1440491536.db2.gz	FBZRRPMNMMJOEX-RXVVDRJESA-N	0	3	336.479	3.365	20	30		EGEDHN
C=CCCC(=O)N1CCC(CCN(C)Cc2c(C)noc2C)CC1	ZINC001753818567	1440494806	/nfs/dbraw/zinc/49/48/06/1440494806.db2.gz	VGNHGETYECGEEG-UHFFFAOYSA-N	0	3	333.476	3.318	20	30		EGEDHN
CN(CCC1CCN(C(=O)C#CC(C)(C)C)CC1)Cc1cncs1	ZINC001753819812	1440495285	/nfs/dbraw/zinc/49/52/85/1440495285.db2.gz	FARGBKGZEKWUBB-UHFFFAOYSA-N	0	3	347.528	3.253	20	30		EGEDHN
Cc1cccc(CC(=O)NC[C@H](NCC#Cc2ccccc2)C(C)C)c1	ZINC001753837012	1440501456	/nfs/dbraw/zinc/50/14/56/1440501456.db2.gz	IWBXFRDUTJNLEC-QFIPXVFZSA-N	0	3	348.490	3.320	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1ccc2ncsc2c1)C(C)C	ZINC001753841617	1440502994	/nfs/dbraw/zinc/50/29/94/1440502994.db2.gz	BTOUYLXUYUWAOE-AWEZNQCLSA-N	0	3	337.876	3.393	20	30		EGEDHN
C=CC(C)(C)C(=O)N(C)CCN(C)Cc1ccc2ncccc2c1	ZINC001753859148	1440510401	/nfs/dbraw/zinc/51/04/01/1440510401.db2.gz	FCMJUNXCUSPRBB-UHFFFAOYSA-N	0	3	325.456	3.337	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CCC[C@@H]1CNCc1nc(C)cs1	ZINC001753883887	1440520866	/nfs/dbraw/zinc/52/08/66/1440520866.db2.gz	BIARMVPOURRKRN-HZPDHXFCSA-N	0	3	333.501	3.020	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H](C)CCNCc2ccccc2C#N)s1	ZINC001753941281	1440524305	/nfs/dbraw/zinc/52/43/05/1440524305.db2.gz	AEINHFMCDHHSSK-CYBMUJFWSA-N	0	3	327.453	3.226	20	30		EGEDHN
C=C(Cl)CNCC[C@@H](C)NC(=O)c1noc2c1CC(C)(C)CC2	ZINC001753985965	1440528464	/nfs/dbraw/zinc/52/84/64/1440528464.db2.gz	AYGJBUFOAGBWAF-GFCCVEGCSA-N	0	3	339.867	3.040	20	30		EGEDHN
C=CCC1(C(=O)N(CC)CCNCc2ccc(C#N)c(F)c2)CCC1	ZINC001754065499	1440537484	/nfs/dbraw/zinc/53/74/84/1440537484.db2.gz	HRQYCYGTIYEDQD-UHFFFAOYSA-N	0	3	343.446	3.382	20	30		EGEDHN
Cc1cc(Cl)ccc1CNC/C=C\CNC(=O)C#CC(C)(C)C	ZINC001754118717	1440542653	/nfs/dbraw/zinc/54/26/53/1440542653.db2.gz	CHQCDRNPYDMHIX-WAYWQWQTSA-N	0	3	332.875	3.460	20	30		EGEDHN
CCC1(C(=O)NC/C=C\CNCc2ccc(F)c(C#N)c2)CCCC1	ZINC001754190779	1440549048	/nfs/dbraw/zinc/54/90/48/1440549048.db2.gz	HNOKTFCJTRKMFS-WAYWQWQTSA-N	0	3	343.446	3.430	20	30		EGEDHN
C=CCN(C)C[C@H](C)NC(=O)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC001754308565	1440572177	/nfs/dbraw/zinc/57/21/77/1440572177.db2.gz	BUEOGXGORKWNKZ-IIZVFWCOSA-N	0	3	332.410	3.224	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H](C)CN(C)C/C=C/c2ccccc2)cc1	ZINC001754320457	1440577781	/nfs/dbraw/zinc/57/77/81/1440577781.db2.gz	WXAKBMBUOYJSHN-VEGGFIAOSA-N	0	3	332.447	3.431	20	30		EGEDHN
C=C(Br)CNCCCN(C)C(=O)[C@@H]1CCC(C)(C)C1	ZINC001754394494	1440594400	/nfs/dbraw/zinc/59/44/00/1440594400.db2.gz	BQAHDYSEQBVBIR-CYBMUJFWSA-N	0	3	331.298	3.159	20	30		EGEDHN
C=CCC1(C(=O)N(C)CCCN[C@@H](C)c2cnc(C)cn2)CCCC1	ZINC001754419333	1440597160	/nfs/dbraw/zinc/59/71/60/1440597160.db2.gz	RWMLJABLTZNZKQ-KRWDZBQOSA-N	0	3	344.503	3.421	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](NC(=O)C2CCC=CCC2)C2CC2)s1	ZINC001754459577	1440603028	/nfs/dbraw/zinc/60/30/28/1440603028.db2.gz	AGJJFSMSNZNGKW-GOSISDBHSA-N	0	3	343.496	3.351	20	30		EGEDHN
C=CCC[C@@H](C)N1CC[C@H]1CNC(=O)c1cnoc1-c1ccco1	ZINC001754487938	1440609104	/nfs/dbraw/zinc/60/91/04/1440609104.db2.gz	SXGFNJHNGIULAL-KGLIPLIRSA-N	0	3	329.400	3.093	20	30		EGEDHN
C=CCC[C@@H](C)N1CC[C@H]1CNC(=O)c1occc1Br	ZINC001754498193	1440613062	/nfs/dbraw/zinc/61/30/62/1440613062.db2.gz	UVYBJSHECMCYJS-NEPJUHHUSA-N	0	3	341.249	3.201	20	30		EGEDHN
C=CCCCCCN1CC[C@@H]1CNC(=O)[C@H]1OCCc2ccccc21	ZINC001754501935	1440614599	/nfs/dbraw/zinc/61/45/99/1440614599.db2.gz	NGQJLWCLXNONFA-QUCCMNQESA-N	0	3	342.483	3.237	20	30		EGEDHN
C#CCCCCC(=O)NCC1(NCc2ccc3ncccc3c2)CC1	ZINC001754512843	1440617848	/nfs/dbraw/zinc/61/78/48/1440617848.db2.gz	YNURNMCSEFBZTD-UHFFFAOYSA-N	0	3	335.451	3.167	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC([C@@H]2CCN(Cc3nocc3C)C2)CC1	ZINC001754535898	1440624264	/nfs/dbraw/zinc/62/42/64/1440624264.db2.gz	OMFMYNCMMSJONM-GOSISDBHSA-N	0	3	345.487	3.400	20	30		EGEDHN
C=CCOCCCC(=O)N1CCC2(C1)CCN(C/C=C\Cl)CC2	ZINC001754559618	1440633248	/nfs/dbraw/zinc/63/32/48/1440633248.db2.gz	QGLAKPOKCDTIPR-WTKPLQERSA-N	0	3	340.895	3.036	20	30		EGEDHN
C=CCC[C@@H](C)[N@@H+]1CC[C@@]2(CCN(C(=O)c3ccccc3[O-])C2)C1	ZINC001754561844	1440634110	/nfs/dbraw/zinc/63/41/10/1440634110.db2.gz	FDQKNLSMRAAUKO-OXQOHEQNSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=CCC[C@@H](C)[N@H+]1CC[C@@]2(CCN(C(=O)c3ccccc3[O-])C2)C1	ZINC001754561844	1440634111	/nfs/dbraw/zinc/63/41/11/1440634111.db2.gz	FDQKNLSMRAAUKO-OXQOHEQNSA-N	0	3	328.456	3.285	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1CC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001754563416	1440634471	/nfs/dbraw/zinc/63/44/71/1440634471.db2.gz	JRBOPXHHVXAPOL-DYESRHJHSA-N	0	3	339.483	3.419	20	30		EGEDHN
O=C([C@H]1CCC(F)(F)C1)N1CCC[C@H]1CNCC#Cc1ccccc1	ZINC001754611711	1440643857	/nfs/dbraw/zinc/64/38/57/1440643857.db2.gz	PMEWCVYSAGYOGL-ROUUACIJSA-N	0	3	346.421	3.054	20	30		EGEDHN
C=CCC1(C(=O)N2CCC[C@H]2CNCC#Cc2ccccc2)CCC1	ZINC001754616388	1440644594	/nfs/dbraw/zinc/64/45/94/1440644594.db2.gz	ALGSUWQAMIXPHA-FQEVSTJZSA-N	0	3	336.479	3.365	20	30		EGEDHN
C#CCCCCC(=O)NC1(C)CCN(Cc2ncccc2C)CC1	ZINC001754625385	1440646275	/nfs/dbraw/zinc/64/62/75/1440646275.db2.gz	UOTBLMSZIUMBTK-UHFFFAOYSA-N	0	3	327.472	3.054	20	30		EGEDHN
C#CCN(C(=O)[C@H](F)CC)C1CCN(Cc2ccc(C)cc2)CC1	ZINC001754639712	1440649021	/nfs/dbraw/zinc/64/90/21/1440649021.db2.gz	TZIYHGJOPMXSRS-LJQANCHMSA-N	0	3	330.447	3.169	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@](C)(CNCc2ccccc2C#N)C1	ZINC001754702969	1440668380	/nfs/dbraw/zinc/66/83/80/1440668380.db2.gz	ZDCWTMKMFPQYMZ-FQEVSTJZSA-N	0	3	325.456	3.099	20	30		EGEDHN
C#CCN1CCC(C)(CNC(=O)c2ccc(-c3ccccc3)o2)CC1	ZINC001754720268	1440672958	/nfs/dbraw/zinc/67/29/58/1440672958.db2.gz	JZWDHAOOAZYGHO-UHFFFAOYSA-N	0	3	336.435	3.412	20	30		EGEDHN
C#CCN1CCC(C)(CNC(=O)[C@H](c2ccccc2)C(C)C)CC1	ZINC001754720717	1440673107	/nfs/dbraw/zinc/67/31/07/1440673107.db2.gz	SHDRKBXWULILPQ-IBGZPJMESA-N	0	3	326.484	3.278	20	30		EGEDHN
C#CCN1CCC(C)(CNC(=O)C[C@@H](C)c2cccc(OC)c2)CC1	ZINC001754721971	1440673596	/nfs/dbraw/zinc/67/35/96/1440673596.db2.gz	HWWTUIKJXOTFJQ-QGZVFWFLSA-N	0	3	342.483	3.040	20	30		EGEDHN
C=CCN1CCC[C@@](C)(CNC(=O)[C@H](C)n2cnc3ccccc32)C1	ZINC001754731407	1440679348	/nfs/dbraw/zinc/67/93/48/1440679348.db2.gz	GFKCTLKABSBLPG-JXFKEZNVSA-N	0	3	340.471	3.002	20	30		EGEDHN
CC#CCN1CCC[C@](C)(CNC(=O)c2cc(C)c(CC)s2)C1	ZINC001754734386	1440681618	/nfs/dbraw/zinc/68/16/18/1440681618.db2.gz	UVYOFBUWYXSCKN-LJQANCHMSA-N	0	3	332.513	3.474	20	30		EGEDHN
C=CCN1CCC[C@](C)(CNC(=O)[C@H]2Cc3c2cccc3Cl)C1	ZINC001754735256	1440682000	/nfs/dbraw/zinc/68/20/00/1440682000.db2.gz	XJNRMJLDLOUOGU-QFBILLFUSA-N	0	3	332.875	3.384	20	30		EGEDHN
C=CCN1CCC[C@@](C)(CNC(=O)[C@H]2CCOc3c(F)cccc32)C1	ZINC001754735952	1440682444	/nfs/dbraw/zinc/68/24/44/1440682444.db2.gz	NYICERRYFDWPRE-JXFKEZNVSA-N	0	3	346.446	3.096	20	30		EGEDHN
C#CCNCCN(Cc1ccccc1)C(=O)c1ccc(C2CC2)nc1C	ZINC001754837415	1440697054	/nfs/dbraw/zinc/69/70/54/1440697054.db2.gz	KLXGZWUVWONMPP-UHFFFAOYSA-N	0	3	347.462	3.133	20	30		EGEDHN
C#CCNCCN(Cc1ccccc1)C(=O)C1(Cc2ccccc2)CC1	ZINC001754838802	1440697258	/nfs/dbraw/zinc/69/72/58/1440697258.db2.gz	PHGASUNTQOBOBX-UHFFFAOYSA-N	0	3	346.474	3.261	20	30		EGEDHN
C#CCC1(C(=O)N2C[C@H]3CN(C/C=C/Cl)C[C@H]3C2)CCCCC1	ZINC001754848077	1440699778	/nfs/dbraw/zinc/69/97/78/1440699778.db2.gz	QJHMMJPFCFRYIO-CHAYFFTQSA-N	0	3	334.891	3.103	20	30		EGEDHN
C=CCCN1CCC[C@@](CO)(NC(=O)c2cc(C(C)(C)C)oc2C)C1	ZINC001754858581	1440700618	/nfs/dbraw/zinc/70/06/18/1440700618.db2.gz	DNASKYPJKSSSFU-HXUWFJFHSA-N	0	3	348.487	3.018	20	30		EGEDHN
C=C(Br)CNCC[C@H]1CCN(C(=O)/C=C(/C)CC)C1	ZINC001754914881	1440708437	/nfs/dbraw/zinc/70/84/37/1440708437.db2.gz	NZRUGGPJHMKENO-UQTJOTSZSA-N	0	3	329.282	3.080	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@H](CCNCc2ncc(C)s2)C1	ZINC001754928407	1440710159	/nfs/dbraw/zinc/71/01/59/1440710159.db2.gz	PHNLQMZHDHKOPQ-HOTGVXAUSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=CCN(C)Cc1ccccc1CNC(=O)c1cc(C(C)(C)C)n[nH]1	ZINC001754946697	1440713627	/nfs/dbraw/zinc/71/36/27/1440713627.db2.gz	SNDGDYMKNSTGFX-UHFFFAOYSA-N	0	3	340.471	3.255	20	30		EGEDHN
CC#CCN[C@H](C)c1ccc(CNC(=O)[C@@H]2C[C@H]2c2ccncc2)cc1	ZINC001754947435	1440713699	/nfs/dbraw/zinc/71/36/99/1440713699.db2.gz	MBFRTJJJFIJRTG-TYCQWZJGSA-N	0	3	347.462	3.175	20	30		EGEDHN
C#CCN[C@@H](C)c1ccc(CNC(=O)CC[C@H]2CC(C)(C)CO2)cc1	ZINC001754948354	1440714062	/nfs/dbraw/zinc/71/40/62/1440714062.db2.gz	HTKBLUOEXSGRDW-LPHOPBHVSA-N	0	3	342.483	3.182	20	30		EGEDHN
C#CCN[C@H](C)c1ccc(CNC(=O)CCCc2cccnc2)cc1	ZINC001754948231	1440714068	/nfs/dbraw/zinc/71/40/68/1440714068.db2.gz	GUZJWLVLXPITRN-QGZVFWFLSA-N	0	3	335.451	3.005	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)C[C@H]3CC=CCC3)cccc2C1	ZINC001754975784	1440719859	/nfs/dbraw/zinc/71/98/59/1440719859.db2.gz	NOFJDUCLTJDNTC-SFHVURJKSA-N	0	3	336.479	3.431	20	30		EGEDHN
CC#CCNC1(CNC(=O)[C@H]2CCc3c2cccc3Cl)CCC1	ZINC001754983647	1440722026	/nfs/dbraw/zinc/72/20/26/1440722026.db2.gz	BCNSTEBAKUFUPB-INIZCTEOSA-N	0	3	330.859	3.022	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CCCN(Cc2ccc3nonc3c2)CC1	ZINC001755025297	1440728498	/nfs/dbraw/zinc/72/84/98/1440728498.db2.gz	RGRHCXCGRCSMBX-MRXNPFEDSA-N	0	3	342.443	3.050	20	30		EGEDHN
C=CC1(CC(=O)N[C@H]2CCCN(CC#CCOC)CC2)CCCCC1	ZINC001755028633	1440730430	/nfs/dbraw/zinc/73/04/30/1440730430.db2.gz	GSGRORBFEVDBAY-IBGZPJMESA-N	0	3	346.515	3.134	20	30		EGEDHN
C=CCC[C@H](C)N1Cc2ccccc2C[C@H]1CNC(=O)c1ccon1	ZINC001755073734	1440747598	/nfs/dbraw/zinc/74/75/98/1440747598.db2.gz	DQNSEPAJYFEFBP-YJBOKZPZSA-N	0	3	339.439	3.186	20	30		EGEDHN
C=CCOCCCC(=O)N1CCC[C@@]2(CCN(C/C=C/Cl)C2)C1	ZINC001755077083	1440749060	/nfs/dbraw/zinc/74/90/60/1440749060.db2.gz	NOYTZUGELRULQO-YXOJNZSOSA-N	0	3	340.895	3.036	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC[C@]2(CCN(Cc3ocnc3C)C2)C1	ZINC001755079479	1440750635	/nfs/dbraw/zinc/75/06/35/1440750635.db2.gz	LASITDINDDLKAE-FXAWDEMLSA-N	0	3	345.487	3.400	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2csc(Cl)c2)CCOCC1	ZINC001755098208	1440751804	/nfs/dbraw/zinc/75/18/04/1440751804.db2.gz	LFOJRCSHRKJKOY-UHFFFAOYSA-N	0	3	349.283	3.023	20	30		EGEDHN
C[C@H]1CN(C(=O)C23CCC(CC2)C3)C[C@H]1NCC#Cc1ccccc1	ZINC001755110174	1440754224	/nfs/dbraw/zinc/75/42/24/1440754224.db2.gz	JGQMQHQVRMJGRQ-ACIXJAQOSA-N	0	3	336.479	3.055	20	30		EGEDHN
C=Cc1ccc(C(=O)N2C[C@H](NCC#Cc3ccccc3)[C@@H](C)C2)cc1	ZINC001755116400	1440754968	/nfs/dbraw/zinc/75/49/68/1440754968.db2.gz	NFFHRYWYVVMGGP-AVRDEDQJSA-N	0	3	344.458	3.431	20	30		EGEDHN
C#CCCCC(=O)N1CCC(C)(NCc2csc(CCC)n2)CC1	ZINC001755128053	1440756602	/nfs/dbraw/zinc/75/66/02/1440756602.db2.gz	ZYMPEALJVLAOLF-UHFFFAOYSA-N	0	3	347.528	3.370	20	30		EGEDHN
Cc1cc(F)ccc1CN1CC[C@@H](NC(=O)[C@@H](C)C#N)C(C)(C)C1	ZINC001755139384	1440759521	/nfs/dbraw/zinc/75/95/21/1440759521.db2.gz	HUMSIFDEHKBOHL-WMLDXEAASA-N	0	3	331.435	3.011	20	30		EGEDHN
C=CCC[C@H](C)N1CC(N2CCN(C(=O)CC3(C)CCCC3)CC2)C1	ZINC001755145257	1440762670	/nfs/dbraw/zinc/76/26/70/1440762670.db2.gz	HWEUSMRGJKDULL-SFHVURJKSA-N	0	3	347.547	3.140	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@H]1CNC(=O)CCc1ccccn1	ZINC001755172057	1440769235	/nfs/dbraw/zinc/76/92/35/1440769235.db2.gz	JEOQXHRHKHRRTA-OAQYLSRUSA-N	0	3	349.478	3.306	20	30		EGEDHN
C=CCCCN1CCOC2(CCN(C(=O)C(C)(C)CC=C)CC2)C1	ZINC001755174606	1440770442	/nfs/dbraw/zinc/77/04/42/1440770442.db2.gz	VYPYMFYJJCPVIC-UHFFFAOYSA-N	0	3	334.504	3.248	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC(CN(CC)Cc2cnc(C)cn2)CC1	ZINC001755183965	1440772246	/nfs/dbraw/zinc/77/22/46/1440772246.db2.gz	UYVNWMOQACRXPW-UHFFFAOYSA-N	0	3	344.503	3.202	20	30		EGEDHN
C#CCCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccccc1CC	ZINC001755186651	1440773269	/nfs/dbraw/zinc/77/32/69/1440773269.db2.gz	DTGXKQRLLFVQKY-NHCUHLMSSA-N	0	3	332.447	3.258	20	30		EGEDHN
C=CCCOCC(=O)N1CCC[C@@H]1CN(C)[C@H](C)c1ccc(F)cc1	ZINC001755203462	1440781293	/nfs/dbraw/zinc/78/12/93/1440781293.db2.gz	WVOJASRFRPZECM-VQIMIIECSA-N	0	3	348.462	3.402	20	30		EGEDHN
C=C(Br)CNCC1CC(NC(=O)C2=CCCCCC2)C1	ZINC001755210383	1440783100	/nfs/dbraw/zinc/78/31/00/1440783100.db2.gz	NHIBEGCUVATORN-UHFFFAOYSA-N	0	3	341.293	3.270	20	30		EGEDHN
C[C@@H](NCC#Cc1ccccc1)[C@H](C)NC(=O)C(C)(C)C1CCC1	ZINC001755247135	1440790909	/nfs/dbraw/zinc/79/09/09/1440790909.db2.gz	ZAEVMSMUMMSXTJ-SJORKVTESA-N	0	3	326.484	3.347	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)[C@H](C)NCc2ccc(C#N)s2)CCC1	ZINC001755253076	1440792381	/nfs/dbraw/zinc/79/23/81/1440792381.db2.gz	OTGNLHZQFKNDOQ-KBPBESRZSA-N	0	3	331.485	3.349	20	30		EGEDHN
C[C@@H](C#N)C(=O)N(C)CC(C)(C)CN[C@@H](C)c1nc2ccccc2o1	ZINC001755279408	1440800113	/nfs/dbraw/zinc/80/01/13/1440800113.db2.gz	NONWRTVHIZWMPO-KBPBESRZSA-N	0	3	342.443	3.123	20	30		EGEDHN
Cc1nc(CNCC(C)(C)CN(C)C(=O)C#CC(C)(C)C)c(C)s1	ZINC001755280928	1440800482	/nfs/dbraw/zinc/80/04/82/1440800482.db2.gz	RONCWLWOXGXKGY-UHFFFAOYSA-N	0	3	349.544	3.384	20	30		EGEDHN
C=C(Br)CNCC(C)(C)CN(C)C(=O)C(C)(C)C1CC1	ZINC001755283923	1440801334	/nfs/dbraw/zinc/80/13/34/1440801334.db2.gz	AOGKPOBLPHGFEQ-UHFFFAOYSA-N	0	3	345.325	3.405	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H](C)N(C)[C@H]1CCc2ccc(F)cc21	ZINC001755296739	1440806629	/nfs/dbraw/zinc/80/66/29/1440806629.db2.gz	QKNOQGWDXGNYLX-BEFAXECRSA-N	0	3	330.447	3.443	20	30		EGEDHN
C[C@@H](CNC(=O)[C@H]1CCC(C)(C)C1)N(C)Cc1ccc(C#N)cc1	ZINC001755314306	1440814827	/nfs/dbraw/zinc/81/48/27/1440814827.db2.gz	FFVUGFOKNRTIRP-YJBOKZPZSA-N	0	3	327.472	3.321	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@@H](C)N(C)Cc1cccc2nsnc21	ZINC001755313897	1440814889	/nfs/dbraw/zinc/81/48/89/1440814889.db2.gz	AOABABLKTYXPQY-ACJLOTCBSA-N	0	3	346.500	3.230	20	30		EGEDHN
Cc1cccc(C(=O)NC[C@@H](C)N(C)Cc2ccc(C#N)cc2)c1C	ZINC001755324804	1440820954	/nfs/dbraw/zinc/82/09/54/1440820954.db2.gz	QGPOZGQOXDOXAK-MRXNPFEDSA-N	0	3	335.451	3.425	20	30		EGEDHN
C=C[C@@H](C(=O)NC[C@@H](C)N(C)Cc1cccc(C#N)c1)c1ccccc1	ZINC001755328481	1440823129	/nfs/dbraw/zinc/82/31/29/1440823129.db2.gz	QBJWMRUEPLANQE-DYESRHJHSA-N	0	3	347.462	3.465	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2CN(CCOC(C)C)CC2(C)C)CCCCC1	ZINC001755416811	1440849364	/nfs/dbraw/zinc/84/93/64/1440849364.db2.gz	XHBDBRDCMHQVBQ-GOSISDBHSA-N	0	3	348.531	3.212	20	30		EGEDHN
C#CCN1C[C@@H]2[C@@H](CNC(=O)[C@H](CC3CCCCC3)C(C)C)[C@@H]2C1	ZINC001755429629	1440850922	/nfs/dbraw/zinc/85/09/22/1440850922.db2.gz	JFCFSFLSULYXCH-WTGUMLROSA-N	0	3	330.516	3.156	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CC[C@@H](NC(=O)C3(C(F)F)CC3)C[C@@H]2C1	ZINC001755453044	1440854321	/nfs/dbraw/zinc/85/43/21/1440854321.db2.gz	MICGZVVFQQCHKV-YNEHKIRRSA-N	0	3	332.822	3.001	20	30		EGEDHN
C=C(Cl)CNC[C@H]1C[C@H](NC(=O)c2cccc3scnc32)C1	ZINC001755470497	1440858819	/nfs/dbraw/zinc/85/88/19/1440858819.db2.gz	ABRKQKWVGUERDO-HAQNSBGRSA-N	0	3	335.860	3.147	20	30		EGEDHN
C=C(Cl)CNCCC[C@@H](C)NC(=O)Cc1cc(F)c(F)cc1F	ZINC001755518057	1440864509	/nfs/dbraw/zinc/86/45/09/1440864509.db2.gz	HONXVQCRGDHYAM-LLVKDONJSA-N	0	3	348.796	3.273	20	30		EGEDHN
C=C(Cl)CNCCC[C@H](C)NC(=O)[C@H]1CCc2ccccc2C1	ZINC001755518164	1440864537	/nfs/dbraw/zinc/86/45/37/1440864537.db2.gz	JNMSTZFESMHPFW-YJBOKZPZSA-N	0	3	334.891	3.419	20	30		EGEDHN
C/C=C(/C)C(=O)N(C)[C@H](CNCC#Cc1ccc(Cl)cc1)C1CC1	ZINC001755559033	1440874148	/nfs/dbraw/zinc/87/41/48/1440874148.db2.gz	UJQWVQCJWBPWLN-ZRWCWMOWSA-N	0	3	344.886	3.484	20	30		EGEDHN
C=CC(C)(C)CC(=O)N(C)[C@@H](CNCc1cnc(C)s1)C1CC1	ZINC001755562964	1440874893	/nfs/dbraw/zinc/87/48/93/1440874893.db2.gz	ZNDNUCUDQUKQQU-INIZCTEOSA-N	0	3	335.517	3.380	20	30		EGEDHN
C[C@@H](CN(C)C(=O)C(C)(C)C1CC1)NCc1ccc(C#N)c(F)c1	ZINC001755601854	1440884304	/nfs/dbraw/zinc/88/43/04/1440884304.db2.gz	OCMVBBCDFUJPHI-ZDUSSCGKSA-N	0	3	331.435	3.070	20	30		EGEDHN
CC#CCN1CC[C@]2(NC(=O)[C@@H](CC)OC3CCCCC3)CCC[C@@H]12	ZINC001755699111	1440898927	/nfs/dbraw/zinc/89/89/27/1440898927.db2.gz	SMCXWWWKQSFFNV-SFHLNBCPSA-N	0	3	346.515	3.251	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@]3(NC(=O)CCC(F)F)CCC[C@H]23)cc1	ZINC001755700908	1440899872	/nfs/dbraw/zinc/89/98/72/1440899872.db2.gz	HNMRIDVMYOLOGR-LPHOPBHVSA-N	0	3	347.409	3.217	20	30		EGEDHN
C=CCN1CCC[C@H](NC(=O)CCCc2ccc(OC)cc2)[C@H]1C	ZINC001755723544	1440908558	/nfs/dbraw/zinc/90/85/58/1440908558.db2.gz	RJBUUEYOIIZFSZ-APWZRJJASA-N	0	3	330.472	3.173	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1CC[C@@H](CNCc2csc(C)n2)C1	ZINC001755725465	1440909188	/nfs/dbraw/zinc/90/91/88/1440909188.db2.gz	AIORXTSTCSWWDW-CVEARBPZSA-N	0	3	333.501	3.020	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CCCN(Cc2ccc3cc[nH]c3c2)[C@H]1C	ZINC001755731237	1440910314	/nfs/dbraw/zinc/91/03/14/1440910314.db2.gz	OGTAVKDEAMEUIW-QFBILLFUSA-N	0	3	337.467	3.441	20	30		EGEDHN
C=CCCC(=O)N(C)C[C@@H](O)CN(C)Cc1ccc(C(C)(C)C)cc1	ZINC001755800089	1440918096	/nfs/dbraw/zinc/91/80/96/1440918096.db2.gz	WGMMGJRPFHKLKM-IBGZPJMESA-N	0	3	346.515	3.201	20	30		EGEDHN
CO[C@H](CN(C)CCN(C(=O)C#CC(C)(C)C)C(C)C)C1CCC1	ZINC001755810925	1440920212	/nfs/dbraw/zinc/92/02/12/1440920212.db2.gz	QSTSYEGGPOKEPX-GOSISDBHSA-N	0	3	336.520	3.020	20	30		EGEDHN
C=C(C)CN(C)CCN(C(=O)c1cc(OC)cc(OC)c1)C(C)C	ZINC001755817294	1440924200	/nfs/dbraw/zinc/92/42/00/1440924200.db2.gz	HZDIACPYXYIAGD-UHFFFAOYSA-N	0	3	334.460	3.062	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](CNCc2cnoc2C)C(C)(C)C)CC1	ZINC001755830677	1440928542	/nfs/dbraw/zinc/92/85/42/1440928542.db2.gz	NIOCCWHFHCOGRW-KRWDZBQOSA-N	0	3	333.476	3.350	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H](CNCc1cnc(C)nc1)C(C)(C)C	ZINC001755831264	1440928711	/nfs/dbraw/zinc/92/87/11/1440928711.db2.gz	WIDPBKUJSVVGCF-WBVHZDCISA-N	0	3	332.492	3.008	20	30		EGEDHN
CC(C)(C)[C@H](CNCC#Cc1ccccc1)NC(=O)CC(C)(F)F	ZINC001755831645	1440928833	/nfs/dbraw/zinc/92/88/33/1440928833.db2.gz	WICDTUGHJFYFSJ-INIZCTEOSA-N	0	3	336.426	3.204	20	30		EGEDHN
C#CCN1CCC([C@H](C)NC(=O)[C@@H](C)c2cccc(Cl)c2)CC1	ZINC001755850681	1440934860	/nfs/dbraw/zinc/93/48/60/1440934860.db2.gz	MBGWVKANDSQKJG-GJZGRUSLSA-N	0	3	332.875	3.293	20	30		EGEDHN
C=CCC1(C(=O)N(C)C2CC(NCc3conc3CC)C2)CCCC1	ZINC001755866942	1440937916	/nfs/dbraw/zinc/93/79/16/1440937916.db2.gz	XATYHTCJCDJHOD-UHFFFAOYSA-N	0	3	345.487	3.453	20	30		EGEDHN
CC#CCN1CCC(C2(NC(=O)CCc3ccsc3)CC2)CC1	ZINC001755868628	1440938453	/nfs/dbraw/zinc/93/84/53/1440938453.db2.gz	BABUELNAYMKJCK-UHFFFAOYSA-N	0	3	330.497	3.065	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC1=CCN(CCc2scnc2C)CC1	ZINC001755893911	1440942380	/nfs/dbraw/zinc/94/23/80/1440942380.db2.gz	JXONDWGVBQUXCF-UHFFFAOYSA-N	0	3	347.528	3.345	20	30		EGEDHN
N#Cc1ccc(CNC2CCN(Cc3ccc(F)c(F)c3)CC2)o1	ZINC000174282071	231167050	/nfs/dbraw/zinc/16/70/50/231167050.db2.gz	HKXLIMKJDWCYIC-UHFFFAOYSA-N	0	3	331.366	3.184	20	30		EGEDHN
N#Cc1ccc(SCC(=O)N2CCC[C@@H]2CN2CCCCC2)cc1	ZINC000103085036	219253987	/nfs/dbraw/zinc/25/39/87/219253987.db2.gz	LCYJFHPOVCRDNX-QGZVFWFLSA-N	0	3	343.496	3.127	20	30		EGEDHN
CC[C@@H]1CN(CCC(=O)Nc2sc3c(c2C#N)CCC3)CCS1	ZINC000072861947	216320659	/nfs/dbraw/zinc/32/06/59/216320659.db2.gz	YRKCIOYCIZBLLK-GFCCVEGCSA-N	0	3	349.525	3.264	20	30		EGEDHN
Cc1nsc(N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)c1C#N	ZINC000368545548	242001773	/nfs/dbraw/zinc/00/17/73/242001773.db2.gz	NJAOLTMBJNBWOC-OKILXGFUSA-N	0	3	348.516	3.039	20	30		EGEDHN
CN(C)CCOc1ccc(NC(=O)c2ccc(C#N)cc2)cc1Cl	ZINC000078765551	217115635	/nfs/dbraw/zinc/11/56/35/217115635.db2.gz	DTVJRGXXEDKFHV-UHFFFAOYSA-N	0	3	343.814	3.404	20	30		EGEDHN
C[C@@H](NC(=O)N1CCC[C@@H]1CN1CCCCC1)c1ccc(C#N)cc1	ZINC000264280891	246286369	/nfs/dbraw/zinc/28/63/69/246286369.db2.gz	ROEVFXLLDHATJC-VQIMIIECSA-N	0	3	340.471	3.279	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](C)c2ccc(OC)cc2)CC1	ZINC000264319417	246347107	/nfs/dbraw/zinc/34/71/07/246347107.db2.gz	AGVNBZNCKOKTNB-HNNXBMFYSA-N	0	3	331.460	3.096	20	30		EGEDHN
CC(C)N1CCCN(C(=O)CCCCOc2cccc(C#N)c2)CC1	ZINC000264681137	246774327	/nfs/dbraw/zinc/77/43/27/246774327.db2.gz	ONOKUAFHVZROEL-UHFFFAOYSA-N	0	3	343.471	3.050	20	30		EGEDHN
CCN(C(=O)c1c[nH]c(C#N)c1)[C@H]1CCN([C@H](C)c2ccccc2)C1	ZINC000378476997	169126510	/nfs/dbraw/zinc/12/65/10/169126510.db2.gz	XFSCRNQWSYJQRR-BEFAXECRSA-N	0	3	336.439	3.184	20	30		EGEDHN
C[C@H]1CCN(C[C@H](O)c2ccc(C#N)cc2)CCN1Cc1ccccc1	ZINC000268616604	252071724	/nfs/dbraw/zinc/07/17/24/252071724.db2.gz	MNLBXTACDTYPTP-AVRDEDQJSA-N	0	3	349.478	3.188	20	30		EGEDHN
C[C@@H](N[C@@H](C)c1ccc(C#N)cc1)c1ccc(NS(C)(=O)=O)cc1	ZINC000268835415	252284532	/nfs/dbraw/zinc/28/45/32/252284532.db2.gz	XVUANIZXWBWZEB-UONOGXRCSA-N	0	3	343.452	3.342	20	30		EGEDHN
COc1cc(C#N)ccc1CN[C@@H]1CCO[C@H]1c1ccc(F)c(F)c1	ZINC000192131763	533497253	/nfs/dbraw/zinc/49/72/53/533497253.db2.gz	PWCWQWGTFPJVTJ-MJGOQNOKSA-N	0	3	344.361	3.465	20	30		EGEDHN
C[C@H](CNC(=O)Nc1cc(C#N)cn1C(C)(C)C)N1CCCC[C@@H]1C	ZINC000337863007	141068733	/nfs/dbraw/zinc/06/87/33/141068733.db2.gz	NMEJQYRYLIBVLU-LSDHHAIUSA-N	0	3	345.491	3.499	20	30		EGEDHN
N#Cc1csc(CNCCc2nc(-c3ccncc3)cs2)c1	ZINC000344540027	141170788	/nfs/dbraw/zinc/17/07/88/141170788.db2.gz	BOBSLDDDXDRPDN-UHFFFAOYSA-N	0	3	326.450	3.471	20	30		EGEDHN
CC[C@@H](C)N[C@@H](CNC(=O)Nc1cccc(C#N)c1)c1ccco1	ZINC000353353378	141293107	/nfs/dbraw/zinc/29/31/07/141293107.db2.gz	MUKZSDJWTUEXLS-CJNGLKHVSA-N	0	3	326.400	3.402	20	30		EGEDHN
CC(C)[C@@]1(C)C[C@@H]1C(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000185732427	144118261	/nfs/dbraw/zinc/11/82/61/144118261.db2.gz	LNHFIZAVXQNZMP-UYAOXDASSA-N	0	3	327.472	3.131	20	30		EGEDHN
COc1cc(C#N)ccc1CN(CCc1ccccc1)[C@@H]1CCOC1	ZINC000121180356	286191952	/nfs/dbraw/zinc/19/19/52/286191952.db2.gz	VMIVGUSRROWLRM-HXUWFJFHSA-N	0	3	336.435	3.400	20	30		EGEDHN
CC[C@@H](Cc1ccccc1)N[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000190619722	153152424	/nfs/dbraw/zinc/15/24/24/153152424.db2.gz	JPWGSWIUZPYGNI-SFTDATJTSA-N	0	3	347.462	3.270	20	30		EGEDHN
N#Cc1ccc(OCCCN2CCC[C@@](O)(C(F)(F)F)CC2)cc1	ZINC000326627592	154183794	/nfs/dbraw/zinc/18/37/94/154183794.db2.gz	PATANWDSAQCXTN-INIZCTEOSA-N	0	3	342.361	3.106	20	30		EGEDHN
C[C@H](CNC(=O)C(C)(C)Oc1ccc(C#N)cc1)N1CCCC[C@H]1C	ZINC000360073259	156906121	/nfs/dbraw/zinc/90/61/21/156906121.db2.gz	UXDAGOWYTGDPFP-HZPDHXFCSA-N	0	3	343.471	3.095	20	30		EGEDHN
CN(C)[C@@]1(CNc2cc(C#N)ccc2C(F)(F)F)CCSC1	ZINC000337209101	163163077	/nfs/dbraw/zinc/16/30/77/163163077.db2.gz	AINQCVMOUFJIQV-CQSZACIVSA-N	0	3	329.391	3.426	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N1CCC[C@H](CNC(=O)c2ccco2)C1	ZINC000338354160	163219873	/nfs/dbraw/zinc/21/98/73/163219873.db2.gz	MACMFABQXNMHII-DOTOQJQBSA-N	0	3	337.423	3.354	20	30		EGEDHN
CN(C)Cc1ccc(NC(=O)c2cnc(C(F)(F)F)c(C#N)c2)cc1	ZINC000338729486	163333315	/nfs/dbraw/zinc/33/33/15/163333315.db2.gz	PBXZTMGCJGWNBY-UHFFFAOYSA-N	0	3	348.328	3.286	20	30		EGEDHN
CN(C)[C@]1(CNc2ccc(C(F)(F)F)cc2C#N)CCSC1	ZINC000343925443	164067726	/nfs/dbraw/zinc/06/77/26/164067726.db2.gz	RBWGXHYOTMYPFX-AWEZNQCLSA-N	0	3	329.391	3.426	20	30		EGEDHN
CC(C)[C@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(C#N)cc1	ZINC000346129357	164344909	/nfs/dbraw/zinc/34/49/09/164344909.db2.gz	XUBWLCMKAAKUKF-FQEVSTJZSA-N	0	3	335.451	3.445	20	30		EGEDHN
C[C@H]1CC[C@H](N(CCO)Cc2ccc(Br)cc2C#N)C1	ZINC000351652868	165116480	/nfs/dbraw/zinc/11/64/80/165116480.db2.gz	TVJZBDYPSYLFNX-LRDDRELGSA-N	0	3	337.261	3.304	20	30		EGEDHN
COc1ccc(CN2CC[C@H](c3ccccc3)[C@H](CO)C2)cc1C#N	ZINC000352242277	165304173	/nfs/dbraw/zinc/30/41/73/165304173.db2.gz	PZDBKGBYWMYUMO-VQTJNVASSA-N	0	3	336.435	3.165	20	30		EGEDHN
CC[C@@H](C)N[C@H](CNC(=O)Cc1c(F)cccc1C#N)c1ccco1	ZINC000359540105	167185323	/nfs/dbraw/zinc/18/53/23/167185323.db2.gz	JCMSNSBUUBMQJK-CXAGYDPISA-N	0	3	343.402	3.078	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)c1cnn(-c2ccccc2)c1	ZINC000122200688	222035595	/nfs/dbraw/zinc/03/55/95/222035595.db2.gz	CUDDSRRFNODCQE-INIZCTEOSA-N	0	3	341.374	3.249	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)c1cnn(-c2ccccc2)c1	ZINC000122200886	222035974	/nfs/dbraw/zinc/03/59/74/222035974.db2.gz	CUDDSRRFNODCQE-MRXNPFEDSA-N	0	3	341.374	3.249	20	30		EGEDHN
N#Cc1cccc(COc2cccc(CN3CCC[C@H](O)CC3)c2)c1	ZINC000294079456	270042321	/nfs/dbraw/zinc/04/23/21/270042321.db2.gz	QYIAXKLEXJHXGI-FQEVSTJZSA-N	0	3	336.435	3.484	20	30		EGEDHN
CC(C)(C)[C@@H](CN1CCc2ccccc2C1)Nc1cncc(C#N)n1	ZINC000420604734	270048632	/nfs/dbraw/zinc/04/86/32/270048632.db2.gz	SWKOURJNFLIYTC-GOSISDBHSA-N	0	3	335.455	3.233	20	30		EGEDHN
CCc1cccc(OCCN2CC[C@H](Oc3ccc(C#N)cn3)C2)c1	ZINC000428802671	270050067	/nfs/dbraw/zinc/05/00/67/270050067.db2.gz	DKOZBLVUPNVWLU-IBGZPJMESA-N	0	3	337.423	3.048	20	30		EGEDHN
CCCN(C)[C@@H](CNc1nccc(C#N)n1)c1ccc(Cl)cc1	ZINC000450522122	270053012	/nfs/dbraw/zinc/05/30/12/270053012.db2.gz	WKOKDJAZABKRFC-INIZCTEOSA-N	0	3	329.835	3.497	20	30		EGEDHN
CCN(CC(=O)Nc1cc(Cl)ccc1C#N)[C@H]1CCOC(C)(C)C1	ZINC000289647757	266105641	/nfs/dbraw/zinc/10/56/41/266105641.db2.gz	DNKKYSPBQBTRDC-HNNXBMFYSA-N	0	3	349.862	3.430	20	30		EGEDHN
CCO[C@@H]1C[C@@H](NCC(=O)Nc2sccc2C#N)C12CCCCC2	ZINC000279247153	266293959	/nfs/dbraw/zinc/29/39/59/266293959.db2.gz	KTQOQQOKEWAEMJ-HUUCEWRRSA-N	0	3	347.484	3.276	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)c2cc(C#N)oc2C)N(C)C)cc1	ZINC000280628727	266442603	/nfs/dbraw/zinc/44/26/03/266442603.db2.gz	SSXORHNFHBBAPU-GOSISDBHSA-N	0	3	325.412	3.055	20	30		EGEDHN
C[C@@H]1CN(CCC(=O)Nc2ccccc2C#N)Cc2ccccc2O1	ZINC000292432016	267047645	/nfs/dbraw/zinc/04/76/45/267047645.db2.gz	NROHIFJBRGASFZ-OAHLLOKOSA-N	0	3	335.407	3.170	20	30		EGEDHN
CCN(CCN1CCCCCC1)[C@@H](C)C(=O)Nc1ccccc1C#N	ZINC000411735459	267064041	/nfs/dbraw/zinc/06/40/41/267064041.db2.gz	WKDUPQQLLOGZDD-KRWDZBQOSA-N	0	3	342.487	3.083	20	30		EGEDHN
CCN(CCN1CCCCCC1)C(=O)Nc1cnc(C#N)c(Cl)c1	ZINC000455760086	267064750	/nfs/dbraw/zinc/06/47/50/267064750.db2.gz	MESJCIHLFTYEEI-UHFFFAOYSA-N	0	3	349.866	3.336	20	30		EGEDHN
CC[C@H](NC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1)C(C)(C)C	ZINC000521554111	267217336	/nfs/dbraw/zinc/21/73/36/267217336.db2.gz	HPVFLGZTXZYSTH-SFHVURJKSA-N	0	3	344.503	3.456	20	30		EGEDHN
CN(C)[C@H](CNc1cncc(C#N)n1)c1cccc(C(F)(F)F)c1	ZINC000420612900	267288869	/nfs/dbraw/zinc/28/88/69/267288869.db2.gz	QDVWNQXLLHWZDY-CQSZACIVSA-N	0	3	335.333	3.082	20	30		EGEDHN
Cc1cc(CNC2(c3cccc(C#N)c3)CC2)ccc1-n1cncn1	ZINC000269602427	267326534	/nfs/dbraw/zinc/32/65/34/267326534.db2.gz	IRUMYPOVPHUJEY-UHFFFAOYSA-N	0	3	329.407	3.226	20	30		EGEDHN
Cc1cccc([C@@H](C)CNC(=O)C(C#N)Cc2ccc(C#N)cc2)c1	ZINC000470972901	268056496	/nfs/dbraw/zinc/05/64/96/268056496.db2.gz	BIDGUOVGYSUZJR-OXJNMPFZSA-N	0	3	331.419	3.469	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CCC(c3ccncc3)CC2)cc1	ZINC000281361868	268088554	/nfs/dbraw/zinc/08/85/54/268088554.db2.gz	YLCZJLSWWMIBRX-HXUWFJFHSA-N	0	3	344.418	3.042	20	30		EGEDHN
N#Cc1ccc(NC[C@@H]2C[C@@H](O)CN2Cc2ccccc2)cc1Cl	ZINC000301878218	268156678	/nfs/dbraw/zinc/15/66/78/268156678.db2.gz	ODCZFENQNBCERD-ZWKOTPCHSA-N	0	3	341.842	3.259	20	30		EGEDHN
N#Cc1cc(Br)cnc1N1CCN(C2CCCCC2)CC1	ZINC000450388804	268175706	/nfs/dbraw/zinc/17/57/06/268175706.db2.gz	JSYHZGMSFOUPRN-UHFFFAOYSA-N	0	3	349.276	3.170	20	30		EGEDHN
Cn1ccnc1[C@@H](NCCSCc1ccccc1C#N)C1CC1	ZINC000187762240	274897311	/nfs/dbraw/zinc/89/73/11/274897311.db2.gz	WLYGAZIHYLBWBM-KRWDZBQOSA-N	0	3	326.469	3.266	20	30		EGEDHN
N#Cc1sc(N2C[C@H]3CN(Cc4ccccc4)C[C@H]3C2)nc1Cl	ZINC000287774216	276155909	/nfs/dbraw/zinc/15/59/09/276155909.db2.gz	NXSKCASYWYGHMT-OKILXGFUSA-N	0	3	344.871	3.236	20	30		EGEDHN
COc1ccc(CNCc2cc(C)nc(N3CCCC3)c2)cc1C#N	ZINC000289788397	276394716	/nfs/dbraw/zinc/39/47/16/276394716.db2.gz	LDKLYBKHTMRFRZ-UHFFFAOYSA-N	0	3	336.439	3.160	20	30		EGEDHN
CCN(CCN1CCCCCC1)C(=O)[C@@H](C)Oc1ccccc1C#N	ZINC000346297124	279187307	/nfs/dbraw/zinc/18/73/07/279187307.db2.gz	NEBCQISOTGJDLX-QGZVFWFLSA-N	0	3	343.471	3.050	20	30		EGEDHN
Cc1cccc(NCCNCc2ccc(C#N)cc2C(F)(F)F)n1	ZINC000352810879	281244467	/nfs/dbraw/zinc/24/44/67/281244467.db2.gz	OZMZNCXUHHYUSC-UHFFFAOYSA-N	0	3	334.345	3.482	20	30		EGEDHN
CN(C)Cc1ccc(CNC(=O)c2ccc(Cl)c(C#N)c2)cc1	ZINC000537549332	314188233	/nfs/dbraw/zinc/18/82/33/314188233.db2.gz	WQDSSBPHBXTLPJ-UHFFFAOYSA-N	0	3	327.815	3.203	20	30		EGEDHN
CC[C@H]1CN(Cc2cccc(OCc3ccccc3C#N)c2)C[C@H]1O	ZINC000539897036	314349039	/nfs/dbraw/zinc/34/90/39/314349039.db2.gz	VAELLGYFNOZKAK-LAUBAEHRSA-N	0	3	336.435	3.340	20	30		EGEDHN
N#Cc1ccc2nc(N[C@@H]3CCN(Cc4ccccc4)C3)ccc2c1	ZINC000540079313	314361665	/nfs/dbraw/zinc/36/16/65/314361665.db2.gz	ZTXBMWVPKUHLJM-LJQANCHMSA-N	0	3	328.419	3.215	20	30		EGEDHN
CC(C)[C@@H](Cc1ccc(F)cc1)NCC(=O)Nc1ccc(C#N)cc1	ZINC000544438696	314695923	/nfs/dbraw/zinc/69/59/23/314695923.db2.gz	UAJVUIRIDHADEY-LJQANCHMSA-N	0	3	339.414	3.493	20	30		EGEDHN
CC(C)(C)N1CCCN(C(=O)C(C)(C)c2cc(F)cc(C#N)c2)CC1	ZINC000551981174	315184933	/nfs/dbraw/zinc/18/49/33/315184933.db2.gz	BOJQDUXCSDCJCL-UHFFFAOYSA-N	0	3	345.462	3.308	20	30		EGEDHN
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NCc1cc(C#N)ccc1F	ZINC000556516701	315439441	/nfs/dbraw/zinc/43/94/41/315439441.db2.gz	MGOLHOFRFPRXGI-KDOFPFPSSA-N	0	3	340.398	3.207	20	30		EGEDHN
COc1cccc([C@H](CNc2snc(Cl)c2C#N)N(C)C)c1	ZINC000051261748	454614880	/nfs/dbraw/zinc/61/48/80/454614880.db2.gz	FDBOOAZJKLSLMO-ZDUSSCGKSA-N	0	3	336.848	3.392	20	30		EGEDHN
N#Cc1ccc2c(c1)CCCC[C@@H]2NCCC(=O)Nc1ccccn1	ZINC000562315682	315817416	/nfs/dbraw/zinc/81/74/16/315817416.db2.gz	HWHNRBUVMAUVNA-SFHVURJKSA-N	0	3	334.423	3.339	20	30		EGEDHN
C[C@H](N[C@@H]1CCC[C@@H](N2CCCC2=O)C1)c1ccc(C#N)cc1F	ZINC000572497856	317348526	/nfs/dbraw/zinc/34/85/26/317348526.db2.gz	ACCMWXYHJCEJKI-NUEKZKHPSA-N	0	3	329.419	3.282	20	30		EGEDHN
CN(CCCc1cc(-c2ccccc2)n[nH]1)Cc1ccc(C#N)cn1	ZINC000572659788	317371213	/nfs/dbraw/zinc/37/12/13/317371213.db2.gz	QCWLQABCYHFBDO-UHFFFAOYSA-N	0	3	331.423	3.408	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2ccc(Cl)s2)CC1	ZINC000171552895	455077644	/nfs/dbraw/zinc/07/76/44/455077644.db2.gz	GJYAAGJZRLEZFE-UHFFFAOYSA-N	0	3	327.881	3.241	20	30		EGEDHN
CC[C@@H](NC[C@H](O)COc1ccc(C#N)cc1)c1ccc(F)cc1F	ZINC000179633923	323397510	/nfs/dbraw/zinc/39/75/10/323397510.db2.gz	TUJBRHARPPJGIV-HNAYVOBHSA-N	0	3	346.377	3.317	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CN[C@H]1CCCc2sccc21	ZINC000390722736	324283447	/nfs/dbraw/zinc/28/34/47/324283447.db2.gz	MCSFCPBGYNGJHO-HOCLYGCPSA-N	0	3	328.437	3.027	20	30		EGEDHN
N#Cc1cc(N[C@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)ncn1	ZINC000580688864	325283497	/nfs/dbraw/zinc/28/34/97/325283497.db2.gz	BLJPSJNPNXGFKY-AWEZNQCLSA-N	0	3	347.344	3.053	20	30		EGEDHN
Cc1ccc2c(c1)[C@H](NC[C@H](O)COc1ccc(C#N)cc1)CCC2	ZINC000580947920	325312678	/nfs/dbraw/zinc/31/26/78/325312678.db2.gz	SUQBAOYKJLFRQD-GHTZIAJQSA-N	0	3	336.435	3.274	20	30		EGEDHN
COC[C@@]1(CN[C@H]2CCc3ccc(C#N)cc32)OCCc2ccccc21	ZINC000581696488	325383298	/nfs/dbraw/zinc/38/32/98/325383298.db2.gz	MZPPMJRIZRILKK-FCHUYYIVSA-N	0	3	348.446	3.250	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Nc1ccc(C#N)cc1	ZINC000157767816	455229765	/nfs/dbraw/zinc/22/97/65/455229765.db2.gz	USQKUBGCJKMQDS-KXBFYZLASA-N	0	3	334.423	3.200	20	30		EGEDHN
C=CCN1CCC(NC(=O)C2(Cc3ccccc3Cl)CC2)CC1	ZINC000189728783	455235370	/nfs/dbraw/zinc/23/53/70/455235370.db2.gz	RXZRFDSELONGHQ-UHFFFAOYSA-N	0	3	332.875	3.429	20	30		EGEDHN
CCCCc1ccc([C@@H](C)NCCNC(=O)C2N=CC=CC2=O)cc1	ZINC000180865809	455258396	/nfs/dbraw/zinc/25/83/96/455258396.db2.gz	XRPSJQYKAHOJJI-MVZUJROASA-N	0	3	341.455	3.206	20	30		EGEDHN
C[C@](C#N)(NC(=O)CN[C@H](c1cccc(F)c1)C1CCCC1)C1CC1	ZINC000181000466	455274575	/nfs/dbraw/zinc/27/45/75/455274575.db2.gz	LADPLQXHAAUZQZ-VQTJNVASSA-N	0	3	343.446	3.455	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@H]2CCc3c[nH]nc3C2)cc1OC	ZINC000623446899	460554135	/nfs/dbraw/zinc/55/41/35/460554135.db2.gz	VXHWTWXMNLCCDP-AWEZNQCLSA-N	0	3	347.846	3.284	20	30		EGEDHN
C=CCNC(=O)[C@H](C)N[C@@H](C)[C@H](C)c1ccccc1C(F)(F)F	ZINC000159110889	455352787	/nfs/dbraw/zinc/35/27/87/455352787.db2.gz	WGDODHQVFIVZQT-AVGNSLFASA-N	0	3	328.378	3.478	20	30		EGEDHN
C[C@@H](NC(C)(C)CNC(=O)N1CCC[C@@](C)(C#N)C1)c1ccccc1	ZINC000612372307	460608854	/nfs/dbraw/zinc/60/88/54/460608854.db2.gz	OGPRVEYIWNWSEB-UZLBHIALSA-N	0	3	342.487	3.451	20	30		EGEDHN
C[C@H](NC(C)(C)CNC(=O)N1CCC[C@](C)(C#N)C1)c1ccccc1	ZINC000612372305	460609031	/nfs/dbraw/zinc/60/90/31/460609031.db2.gz	OGPRVEYIWNWSEB-OXJNMPFZSA-N	0	3	342.487	3.451	20	30		EGEDHN
COc1ccc([C@@H](NC(=O)C(C#N)CCc2ccccc2)C2CC2)cn1	ZINC000600811163	460612150	/nfs/dbraw/zinc/61/21/50/460612150.db2.gz	CDDPYGIKISYVRF-PXNSSMCTSA-N	0	3	349.434	3.430	20	30		EGEDHN
CC[C@@H](NC[C@H](O)COc1ccc(C#N)cc1)c1ccc(OC)cc1	ZINC000024590872	453738857	/nfs/dbraw/zinc/73/88/57/453738857.db2.gz	MDHVSUBUBBFZAD-FXAWDEMLSA-N	0	3	340.423	3.047	20	30		EGEDHN
C[C@H](CC1(C#N)CCOCC1)NC[C@@H](c1ccco1)N1CCCC1	ZINC000600848180	460620591	/nfs/dbraw/zinc/62/05/91/460620591.db2.gz	DLQSQVYOBAPOLL-SJORKVTESA-N	0	3	331.460	3.105	20	30		EGEDHN
Cc1cccc(OCCN(C)CCC(=O)Nc2ccc(C#N)cc2)c1	ZINC000026337255	453797061	/nfs/dbraw/zinc/79/70/61/453797061.db2.gz	WUSVXWLKXWEPLF-UHFFFAOYSA-N	0	3	337.423	3.206	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H](O)COCc1ccccc1Cl	ZINC000027208020	453813097	/nfs/dbraw/zinc/81/30/97/453813097.db2.gz	GTHWTVGLHQYOLR-GOSISDBHSA-N	0	3	344.842	3.221	20	30		EGEDHN
C[C@H](NCCN(C)C(=O)OC(C)(C)C)c1ccc(OCC#N)cc1	ZINC000181659621	455368429	/nfs/dbraw/zinc/36/84/29/455368429.db2.gz	JZWDFHLYHCAGOZ-AWEZNQCLSA-N	0	3	333.432	3.106	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cc(C3CC3)nn2-c2ccccc2)CC1	ZINC000066662243	453859968	/nfs/dbraw/zinc/85/99/68/453859968.db2.gz	CSVAUGPDYJFOJA-UHFFFAOYSA-N	0	3	348.450	3.033	20	30		EGEDHN
CN(C)CCN(CCCc1ccccc1)C(=O)c1ccc(C#N)cc1	ZINC000066946312	453888559	/nfs/dbraw/zinc/88/85/59/453888559.db2.gz	LTQZWQNQBNQBRE-UHFFFAOYSA-N	0	3	335.451	3.195	20	30		EGEDHN
C=CCOc1ccc(CNC[C@@H](O)c2ccc(F)cc2)cc1OC	ZINC000075734930	453922934	/nfs/dbraw/zinc/92/29/34/453922934.db2.gz	BPBYGVQXCYCRGF-QGZVFWFLSA-N	0	3	331.387	3.222	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(CCOc3ccccc3)CC2)cc1	ZINC000055172004	453967262	/nfs/dbraw/zinc/96/72/62/453967262.db2.gz	PABXNNJPPZUQGG-UHFFFAOYSA-N	0	3	335.451	3.145	20	30		EGEDHN
N#Cc1csc(C(=O)NC[C@@H]2CCCN(Cc3cccs3)C2)c1	ZINC000084183884	453975298	/nfs/dbraw/zinc/97/52/98/453975298.db2.gz	OYYUUKBMMDHXNT-ZDUSSCGKSA-N	0	3	345.493	3.323	20	30		EGEDHN
C#Cc1cccc(NC(=O)N(CCN(C)C)Cc2cccs2)c1	ZINC000084299212	453983234	/nfs/dbraw/zinc/98/32/34/453983234.db2.gz	GLWLHTCPUSDSKP-UHFFFAOYSA-N	0	3	327.453	3.325	20	30		EGEDHN
COc1cccc([C@@H](CNc2c(C#N)nnc3ccccc32)N(C)C)c1	ZINC000076323930	453988805	/nfs/dbraw/zinc/98/88/05/453988805.db2.gz	YKINCRAGVYSTKO-LJQANCHMSA-N	0	3	347.422	3.225	20	30		EGEDHN
CN(C)[C@H]1CCCN(C(=O)c2ccccc2-c2ccccc2C#N)C1	ZINC000068487074	454030625	/nfs/dbraw/zinc/03/06/25/454030625.db2.gz	ASSWVPSGTXTOMU-KRWDZBQOSA-N	0	3	333.435	3.391	20	30		EGEDHN
CC(C)(C)CCN1CCN(C(=O)CCc2ccc(C#N)cc2)CC1	ZINC000056043320	454034449	/nfs/dbraw/zinc/03/44/49/454034449.db2.gz	HWQTWLSGHZABLV-UHFFFAOYSA-N	0	3	327.472	3.071	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)CC1	ZINC000085638542	454035637	/nfs/dbraw/zinc/03/56/37/454035637.db2.gz	VPLXWNKMYUSOQA-UHFFFAOYSA-N	0	3	346.431	3.374	20	30		EGEDHN
COCCN(Cc1ccc(C#N)cc1)Cc1ccc(-n2cccn2)cc1	ZINC000077183521	454071348	/nfs/dbraw/zinc/07/13/48/454071348.db2.gz	KGBMKKSAOGQXCH-UHFFFAOYSA-N	0	3	346.434	3.393	20	30		EGEDHN
C[C@H](NC(=O)N1CCN(CCC(C)(C)C)CC1)c1ccc(C#N)cc1	ZINC000056881851	454087770	/nfs/dbraw/zinc/08/77/70/454087770.db2.gz	MQNOWDXVCBSIGJ-INIZCTEOSA-N	0	3	342.487	3.383	20	30		EGEDHN
Cc1cc(C(=O)C(C#N)c2cc(C)nc(C)n2)c(C)n1-c1ccccn1	ZINC000089599355	454165876	/nfs/dbraw/zinc/16/58/76/454165876.db2.gz	KETHMSVBMDAMBA-KRWDZBQOSA-N	0	3	345.406	3.386	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)C(=O)N[C@H]1C[C@H](C)N(C2CC2)C1	ZINC000130563678	454205865	/nfs/dbraw/zinc/20/58/65/454205865.db2.gz	ZEDPBLZKUDJYOA-RDJZCZTQSA-N	0	3	343.471	3.018	20	30		EGEDHN
C[C@@H](NC[C@H](O)c1ccc(C#N)cc1)c1cccc(N2CCCC2=O)c1	ZINC000095984702	454250319	/nfs/dbraw/zinc/25/03/19/454250319.db2.gz	YLWMDMVMKIGERO-QRWLVFNGSA-N	0	3	349.434	3.069	20	30		EGEDHN
CC1CCN(CCNC(=O)N[C@@H](CCC#N)c2ccccc2)CC1	ZINC000131975862	454303694	/nfs/dbraw/zinc/30/36/94/454303694.db2.gz	IEMBIZKAWUFBMK-SFHVURJKSA-N	0	3	328.460	3.063	20	30		EGEDHN
C[C@@H]1CN(CCC(=O)Nc2ccc(C#N)c(Cl)c2)C[C@@H](C)S1	ZINC000072768860	454338049	/nfs/dbraw/zinc/33/80/49/454338049.db2.gz	SCMSXTUUBPRRNY-VXGBXAGGSA-N	0	3	337.876	3.366	20	30		EGEDHN
C[C@@H](CO)SCC(=O)C(C#N)c1nc(-c2ccccc2)cs1	ZINC000079099163	454368102	/nfs/dbraw/zinc/36/81/02/454368102.db2.gz	PVAFUALCZPMCLA-AAEUAGOBSA-N	0	3	332.450	3.100	20	30		EGEDHN
CN(c1ccc(NC(=O)C2(C#N)CCCC2)cc1)C1CCN(C)CC1	ZINC000079147397	454375304	/nfs/dbraw/zinc/37/53/04/454375304.db2.gz	VCZLIODIVGTLJU-UHFFFAOYSA-N	0	3	340.471	3.239	20	30		EGEDHN
CN(C)[C@H](CNC(=O)c1cccc(SCC#N)c1)c1ccccc1	ZINC000079383867	454405749	/nfs/dbraw/zinc/40/57/49/454405749.db2.gz	UIEBKSZRJFFWNX-GOSISDBHSA-N	0	3	339.464	3.335	20	30		EGEDHN
C[C@@H]1CN(CC2CCN(c3c(F)cc(C#N)cc3F)CC2)C[C@@H](C)O1	ZINC000091478109	454440280	/nfs/dbraw/zinc/44/02/80/454440280.db2.gz	JPADWSTVOZAKCL-ZIAGYGMSSA-N	0	3	349.425	3.162	20	30		EGEDHN
COCCN(CCOc1cccc(F)c1)Cc1ccc(C#N)cc1	ZINC000063753809	454445315	/nfs/dbraw/zinc/44/53/15/454445315.db2.gz	CDGRPJKIPZXROD-UHFFFAOYSA-N	0	3	328.387	3.225	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCC[C@@H]2c2cccc(C)n2)CC1	ZINC000121879077	454488783	/nfs/dbraw/zinc/48/87/83/454488783.db2.gz	OZUXUCXULFABFG-LJQANCHMSA-N	0	3	342.487	3.277	20	30		EGEDHN
CCN(Cc1ccccc1N(C)C1CCN(C)CC1)C[C@@H](C)C#N	ZINC000091983482	454499763	/nfs/dbraw/zinc/49/97/63/454499763.db2.gz	UGYYASXDDLBQHO-KRWDZBQOSA-N	0	3	328.504	3.199	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(CNCc3ccc(C#N)cc3)cc2)C[C@H](C)O1	ZINC000048710000	454509305	/nfs/dbraw/zinc/50/93/05/454509305.db2.gz	YVYMFYUFTIMUJE-HDICACEKSA-N	0	3	349.478	3.457	20	30		EGEDHN
Cc1noc(C)c1CON=C(N)c1ccccc1CN1CCCCC1	ZINC000102653984	454515243	/nfs/dbraw/zinc/51/52/43/454515243.db2.gz	HGXVMBPSXBPUSQ-UHFFFAOYSA-N	0	3	342.443	3.114	20	30		EGEDHN
COc1ccccc1N(CCC#N)C(=O)[C@@H](C)N(C)CCC(C)C	ZINC000080071817	454528352	/nfs/dbraw/zinc/52/83/52/454528352.db2.gz	PORLYQQOXPWXFS-MRXNPFEDSA-N	0	3	331.460	3.308	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)[C@H](C)CCSCC)CC1	ZINC000074130070	454535282	/nfs/dbraw/zinc/53/52/82/454535282.db2.gz	COCIKTQJNOWPLV-OAHLLOKOSA-N	0	3	327.538	3.200	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H]2c3cccc(F)c3CC[C@@H]2C)CC1	ZINC000080121066	454537128	/nfs/dbraw/zinc/53/71/28/454537128.db2.gz	MRTTXBQPVKWCQC-LIRRHRJNSA-N	0	3	345.462	3.399	20	30		EGEDHN
C[C@@H]1CN(CC2CCN(Cc3ccc(F)cc3C#N)CC2)C[C@@H](C)O1	ZINC000103142422	454540141	/nfs/dbraw/zinc/54/01/41/454540141.db2.gz	APHSXHWQBNXDFV-HZPDHXFCSA-N	0	3	345.462	3.019	20	30		EGEDHN
N#CC(C(=O)Cc1ccc(Cl)c(Cl)c1)C(=O)Nc1ccccn1	ZINC000103717490	454564973	/nfs/dbraw/zinc/56/49/73/454564973.db2.gz	ZHRBSNRGGFHCBC-NSHDSACASA-N	0	3	348.189	3.278	20	30		EGEDHN
C[C@H](CNC(=O)N[C@H](C)c1ccc(C#N)cc1)N1CCC(C)CC1	ZINC000065478752	454573520	/nfs/dbraw/zinc/57/35/20/454573520.db2.gz	KRBGFNAVJUWHSB-HZPDHXFCSA-N	0	3	328.460	3.039	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN2CCC(OC[C@@H]3CCCO3)CC2)cc1	ZINC000092661694	454605030	/nfs/dbraw/zinc/60/50/30/454605030.db2.gz	SKOFNOISIRGTAG-UZLBHIALSA-N	0	3	344.455	3.137	20	30		EGEDHN
CN(CCC#N)C(=O)CCN[C@@H](c1ccccc1)c1ccc(F)cc1	ZINC000092804105	454636558	/nfs/dbraw/zinc/63/65/58/454636558.db2.gz	MLQCLXYMNRYGOQ-FQEVSTJZSA-N	0	3	339.414	3.267	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)c1ccccc1Cl	ZINC000065931276	454641313	/nfs/dbraw/zinc/64/13/13/454641313.db2.gz	BLKLNVXRLZEZES-UHFFFAOYSA-N	0	3	341.842	3.416	20	30		EGEDHN
COc1cccc([C@@H](C)N2CCN(CCCSCC#N)CC2)c1	ZINC000074990321	454670892	/nfs/dbraw/zinc/67/08/92/454670892.db2.gz	WHCYXRCYRHTJNO-MRXNPFEDSA-N	0	3	333.501	3.021	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Cc2cc(Cl)ccc2OC)CC1	ZINC000106038238	454675904	/nfs/dbraw/zinc/67/59/04/454675904.db2.gz	QBDSVMGAVYURTG-UHFFFAOYSA-N	0	3	336.863	3.048	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cc(OC)ccc2OCC)CC1	ZINC000106326135	454691276	/nfs/dbraw/zinc/69/12/76/454691276.db2.gz	UHXRBNQLAGQILN-UHFFFAOYSA-N	0	3	347.459	3.256	20	30		EGEDHN
COc1ccccc1[C@H](C)NC1CCN(c2ccc(C#N)cn2)CC1	ZINC000161690928	454714703	/nfs/dbraw/zinc/71/47/03/454714703.db2.gz	MJPBUHGRJBICKO-HNNXBMFYSA-N	0	3	336.439	3.281	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2cccc(CC#N)c2)CN1Cc1ccccc1	ZINC000176802667	454784704	/nfs/dbraw/zinc/78/47/04/454784704.db2.gz	FHWZVIGJSVUPEH-OXQOHEQNSA-N	0	3	333.435	3.145	20	30		EGEDHN
CCCN(CC(=O)N[C@](C)(C#N)C(C)C)[C@@H]1CCc2ccccc2C1	ZINC000138499683	454793655	/nfs/dbraw/zinc/79/36/55/454793655.db2.gz	QTSXGKHNBMEFGO-TZIWHRDSSA-N	0	3	341.499	3.310	20	30		EGEDHN
CCN(Cc1ccc(C(=O)NC2(C#N)CCSCC2)cc1)C1CC1	ZINC000162720370	454796227	/nfs/dbraw/zinc/79/62/27/454796227.db2.gz	MTRKAQTZNOJCRY-UHFFFAOYSA-N	0	3	343.496	3.190	20	30		EGEDHN
C=CCN(CC=C)C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000175641236	455475101	/nfs/dbraw/zinc/47/51/01/455475101.db2.gz	FHKQYQMABUWFGM-IEBWSBKVSA-N	0	3	327.472	3.423	20	30		EGEDHN
Cc1nc(CCN2CCCN(Cc3ccc(C#N)cc3)CC2)cs1	ZINC000163337866	454840412	/nfs/dbraw/zinc/84/04/12/454840412.db2.gz	DTVJCWPDKZZZIP-UHFFFAOYSA-N	0	3	340.496	3.074	20	30		EGEDHN
C=CC1CCN([C@H](C)C(=O)N[C@@H](C)c2cc(OC)ccc2OC)CC1	ZINC000111258563	454859114	/nfs/dbraw/zinc/85/91/14/454859114.db2.gz	XECMKAYFBDLKIZ-LSDHHAIUSA-N	0	3	346.471	3.168	20	30		EGEDHN
C=CCc1ccc(OC[C@H](O)CN2CCC(C=C)CC2)c(OC)c1	ZINC000111256306	454859255	/nfs/dbraw/zinc/85/92/55/454859255.db2.gz	FQADYVRDHRBVPC-GOSISDBHSA-N	0	3	331.456	3.061	20	30		EGEDHN
CCCCN(C)CCNC(=O)N(Cc1ccc(C#N)cc1)C(C)C	ZINC000112465190	454887909	/nfs/dbraw/zinc/88/79/09/454887909.db2.gz	QCNVIEBJBCPCKA-UHFFFAOYSA-N	0	3	330.476	3.210	20	30		EGEDHN
C=CCNC(=O)c1ccc(NC[C@H](c2ccco2)N(CC)CC)nc1	ZINC000112553997	454889991	/nfs/dbraw/zinc/88/99/91/454889991.db2.gz	OQOFRPMEYUEHFN-MRXNPFEDSA-N	0	3	342.443	3.085	20	30		EGEDHN
N#Cc1cc(NCC2(N3CCSCC3)CCCC2)ccc1[N+](=O)[O-]	ZINC000165677974	454902272	/nfs/dbraw/zinc/90/22/72/454902272.db2.gz	FUTAALSOJGEHHG-UHFFFAOYSA-N	0	3	346.456	3.240	20	30		EGEDHN
CC(=O)Oc1ccc(CN2CCCN(c3ccccc3C#N)CC2)cc1	ZINC000177778527	454903531	/nfs/dbraw/zinc/90/35/31/454903531.db2.gz	HRYKPMZKRZOVOM-UHFFFAOYSA-N	0	3	349.434	3.196	20	30		EGEDHN
C=CCCC[C@@H](C)N[C@@H](C(N)=O)c1cccc(Br)c1	ZINC000182343844	455493532	/nfs/dbraw/zinc/49/35/32/455493532.db2.gz	ZJTHRUOFZRWSRG-BXUZGUMPSA-N	0	3	325.250	3.310	20	30		EGEDHN
C[C@H](NCc1cccc(C#N)c1)c1ccc(N2CCOCC2)c(F)c1	ZINC000151374901	454976404	/nfs/dbraw/zinc/97/64/04/454976404.db2.gz	MBGWHFBROPPPNI-HNNXBMFYSA-N	0	3	339.414	3.385	20	30		EGEDHN
CCN1CCN([C@H](C)CNc2cc(C#N)ccc2C(F)(F)F)CC1	ZINC000127747775	454994082	/nfs/dbraw/zinc/99/40/82/454994082.db2.gz	HGAYEJFXIYWCPW-CYBMUJFWSA-N	0	3	340.393	3.015	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2[C@@H]3CCc4ccccc4[C@@H]32)CC1	ZINC000127943393	455011577	/nfs/dbraw/zinc/01/15/77/455011577.db2.gz	IFVMKPGFVGRNTR-HSALFYBXSA-N	0	3	339.483	3.055	20	30		EGEDHN
Cc1ccc2c(c1)[C@H]1CN(C)CC[C@@H]1N2C(=O)c1sccc1C#N	ZINC000128035066	455020590	/nfs/dbraw/zinc/02/05/90/455020590.db2.gz	BOPJRMOXSHRQJW-WBVHZDCISA-N	0	3	337.448	3.376	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCC2(c3ccccc3Cl)CC2)CC1	ZINC000179340777	455035079	/nfs/dbraw/zinc/03/50/79/455035079.db2.gz	VTAXUNWEEKPIQK-UHFFFAOYSA-N	0	3	347.890	3.321	20	30		EGEDHN
C[C@@H](NCC1(c2cccs2)CCCCC1)C(=O)N(C)CCC#N	ZINC000151841483	455038075	/nfs/dbraw/zinc/03/80/75/455038075.db2.gz	YJSILEIJHBSJNX-OAHLLOKOSA-N	0	3	333.501	3.300	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H]2c3ccccc3CC[C@@H]2C)CC1	ZINC000179357156	455038510	/nfs/dbraw/zinc/03/85/10/455038510.db2.gz	OSHUVDSRYPWCMJ-HNAYVOBHSA-N	0	3	327.472	3.260	20	30		EGEDHN
C#CCCCCNC(=O)N[C@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000152019390	455062690	/nfs/dbraw/zinc/06/26/90/455062690.db2.gz	KVWFBVAVZBZQBP-MJGOQNOKSA-N	0	3	327.472	3.142	20	30		EGEDHN
COc1ccc(F)cc1[C@@H](C)NCCC(=O)Nc1sccc1C#N	ZINC000179928193	455100727	/nfs/dbraw/zinc/10/07/27/455100727.db2.gz	BSFRLQAHOXRMMB-LLVKDONJSA-N	0	3	347.415	3.447	20	30		EGEDHN
CN(C(=O)c1cccc(CC#N)c1)C1CCN(Cc2ccccc2)CC1	ZINC000172005995	455108336	/nfs/dbraw/zinc/10/83/36/455108336.db2.gz	JPANJIBJEIFIPW-UHFFFAOYSA-N	0	3	347.462	3.489	20	30		EGEDHN
C=CCOc1cccc(CN2CCC(N3CCCCC3=O)CC2)c1	ZINC000180001735	455114008	/nfs/dbraw/zinc/11/40/08/455114008.db2.gz	QLGXGJUPCQIKDN-UHFFFAOYSA-N	0	3	328.456	3.228	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(OCC3CC3)cc2)CC1	ZINC000172228597	455136733	/nfs/dbraw/zinc/13/67/33/455136733.db2.gz	SVSLEMFIIJCYSB-UHFFFAOYSA-N	0	3	329.444	3.247	20	30		EGEDHN
CCCCN(CCOC)Cc1cn(C)nc1-c1ccc(C#N)cc1	ZINC000180137620	455138378	/nfs/dbraw/zinc/13/83/78/455138378.db2.gz	LGJNBUXVXLDZTL-UHFFFAOYSA-N	0	3	326.444	3.207	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)Nc2ccc(C#N)cc2)CN1Cc1ccccc1	ZINC000152580430	455139424	/nfs/dbraw/zinc/13/94/24/455139424.db2.gz	GBVSDPGEZMTFJE-KXBFYZLASA-N	0	3	334.423	3.343	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(C)n(C(CC)CC)n2)CC1	ZINC000180522637	455188577	/nfs/dbraw/zinc/18/85/77/455188577.db2.gz	XFOZSLUXKQSEEO-UHFFFAOYSA-N	0	3	332.492	3.323	20	30		EGEDHN
CN(C)[C@@H](CNc1ccc([N+](=O)[O-])c(C#N)c1)c1cccc(F)c1	ZINC000157544162	455205910	/nfs/dbraw/zinc/20/59/10/455205910.db2.gz	BYZRWPQLWDPNNI-KRWDZBQOSA-N	0	3	328.347	3.320	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2nc(C(F)(F)F)cs2)CC1	ZINC000264415446	455208349	/nfs/dbraw/zinc/20/83/49/455208349.db2.gz	UZKOYGAPWIMRHS-UHFFFAOYSA-N	0	3	348.394	3.324	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)N[C@H](CC)c1ccc2c(c1)OCCO2	ZINC000180642590	455215760	/nfs/dbraw/zinc/21/57/60/455215760.db2.gz	ZNYIEYFHSLQYQV-DOTOQJQBSA-N	0	3	344.455	3.088	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/[C@H]2CCC[C@@H](C(=O)N(C)C)C2)c([O-])c1	ZINC000265114291	455301077	/nfs/dbraw/zinc/30/10/77/455301077.db2.gz	FJSUMQXBEKHGPU-FSPHNOEXSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N(C)C[C@H]1CCCOC1	ZINC000245484600	455312565	/nfs/dbraw/zinc/31/25/65/455312565.db2.gz	HSHPSCAVBNHDIR-JKSUJKDBSA-N	0	3	336.501	3.010	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCc1ccc(CN2CCN(CC)CC2)cc1	ZINC000190572894	455346253	/nfs/dbraw/zinc/34/62/53/455346253.db2.gz	FWZYLIDKOFTOCV-OAQYLSRUSA-N	0	3	343.515	3.043	20	30		EGEDHN
CC[C@@H](N[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O)c1ccccc1	ZINC000190615874	455354167	/nfs/dbraw/zinc/35/41/67/455354167.db2.gz	GRICTZMHZMBZSX-WOJBJXKFSA-N	0	3	333.435	3.400	20	30		EGEDHN
Cc1ccccc1C[C@H](C)N[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000190626024	455355953	/nfs/dbraw/zinc/35/59/53/455355953.db2.gz	BJANWHQEERHHGU-LAUBAEHRSA-N	0	3	347.462	3.188	20	30		EGEDHN
Cc1ccc([C@H](C)N[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)cc1	ZINC000190631848	455356787	/nfs/dbraw/zinc/35/67/87/455356787.db2.gz	ZVTTXJGBVVZAOD-OXJNMPFZSA-N	0	3	333.435	3.318	20	30		EGEDHN
C=CCNC(=O)Nc1ccc(NC(=O)[C@@H](C)N2CCCCCC2)cc1	ZINC000175204840	455425922	/nfs/dbraw/zinc/42/59/22/455425922.db2.gz	LUFCGNGDHOXTJP-OAHLLOKOSA-N	0	3	344.459	3.197	20	30		EGEDHN
Cc1ccc(Cl)c(OC[C@H](O)CN(C)Cc2cccc(C#N)c2)c1	ZINC000182194130	455457683	/nfs/dbraw/zinc/45/76/83/455457683.db2.gz	UOWQALKHAWBULR-QGZVFWFLSA-N	0	3	344.842	3.392	20	30		EGEDHN
CN1CCC[C@@H](CNC(=O)N2CCC(C#N)CC2)[C@@H]1c1cccs1	ZINC000175519868	455457913	/nfs/dbraw/zinc/45/79/13/455457913.db2.gz	FKXGMIBIDKKUAP-DOTOQJQBSA-N	0	3	346.500	3.076	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC[C@H](Cc3ccccc3)[C@@H]2C)CC1	ZINC000266916846	455474269	/nfs/dbraw/zinc/47/42/69/455474269.db2.gz	BDXNUCVYERLMBX-PKOBYXMFSA-N	0	3	341.499	3.300	20	30		EGEDHN
CN(C[C@H]1CCN(Cc2ccccc2)C1)C(=O)C#Cc1ccccc1	ZINC000267091778	455499738	/nfs/dbraw/zinc/49/97/38/455499738.db2.gz	KKJVDBXTLNAUAC-OAQYLSRUSA-N	0	3	332.447	3.019	20	30		EGEDHN
C#CCCOc1ccc(CN[C@@H](C)[C@H](O)c2cccc(F)c2)cc1	ZINC000267147993	455507534	/nfs/dbraw/zinc/50/75/34/455507534.db2.gz	BLLVCCCEWHHINF-YWZLYKJASA-N	0	3	327.399	3.440	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N1CCC[C@@H](COC)C1	ZINC000246691430	455517498	/nfs/dbraw/zinc/51/74/98/455517498.db2.gz	HUFWVZWWGVMXDN-JKSUJKDBSA-N	0	3	336.501	3.010	20	30		EGEDHN
N#CCSc1cccc(C(=O)N2CCC[C@H]2CN2CCCCC2)c1	ZINC000176041432	455532045	/nfs/dbraw/zinc/53/20/45/455532045.db2.gz	UMKIVVNNFVUUNV-KRWDZBQOSA-N	0	3	343.496	3.393	20	30		EGEDHN
N#Cc1ccc(NC[C@@H](c2ccco2)N2CCCC2)cc1[N+](=O)[O-]	ZINC000267920736	455564941	/nfs/dbraw/zinc/56/49/41/455564941.db2.gz	IPQSQEPCGLTMNK-INIZCTEOSA-N	0	3	326.356	3.308	20	30		EGEDHN
CC1(C(=O)Nc2ccc(C#N)cn2)CCN(Cc2ccccc2)CC1	ZINC000192272701	455585544	/nfs/dbraw/zinc/58/55/44/455585544.db2.gz	NNZOUGZEDPGOPT-UHFFFAOYSA-N	0	3	334.423	3.194	20	30		EGEDHN
Cc1cc[n+](C(C(=O)c2ccccc2)C(=S)[N-]C2(C)CC2)cc1	ZINC000283890931	455608202	/nfs/dbraw/zinc/60/82/02/455608202.db2.gz	CYDVWEPPDTXHPJ-UHFFFAOYSA-O	0	3	325.457	3.363	20	30		EGEDHN
N#C[C@H]1CCC[C@@H](NCc2ccc(C(=O)N3CCCCC3)cc2)C1	ZINC000185801337	455623909	/nfs/dbraw/zinc/62/39/09/455623909.db2.gz	XBUAKFBUDBHUHO-PKOBYXMFSA-N	0	3	325.456	3.485	20	30		EGEDHN
CCN1CCN(c2ccc(CN[C@H]3CCC[C@H](C#N)C3)cc2F)CC1	ZINC000185817492	455627443	/nfs/dbraw/zinc/62/74/43/455627443.db2.gz	FIRRJMQXPVNOFG-WMZOPIPTSA-N	0	3	344.478	3.140	20	30		EGEDHN
C=C(C)[C@@H](NC(=O)N1CC[C@@H](N2CCCC2)C1)c1ccc(F)c(F)c1	ZINC000185827991	455630016	/nfs/dbraw/zinc/63/00/16/455630016.db2.gz	SJUWDUGLGPBJQO-CRAIPNDOSA-N	0	3	349.425	3.462	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N1CC[C@@H](N2CCCC2)C1)c1ccc(F)c(F)c1	ZINC000185827970	455630301	/nfs/dbraw/zinc/63/03/01/455630301.db2.gz	SJUWDUGLGPBJQO-QAPCUYQASA-N	0	3	349.425	3.462	20	30		EGEDHN
CCC[C@@H](C)C(=O)NCC/[NH+]=C/c1ccc(N(CC)CC)cc1[O-]	ZINC000292362755	455640946	/nfs/dbraw/zinc/64/09/46/455640946.db2.gz	RDWMMPIBUXXHIT-NPQOUYBPSA-N	0	3	333.476	3.210	20	30		EGEDHN
N#CCc1cccc(C(=O)NC2CCN(CCc3ccccc3)CC2)c1	ZINC000192605111	455650796	/nfs/dbraw/zinc/65/07/96/455650796.db2.gz	NMHIWGIHHXLLHO-UHFFFAOYSA-N	0	3	347.462	3.190	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CC(C)(C)[C@H]2c2ccncc2)CC1	ZINC000292486753	455676819	/nfs/dbraw/zinc/67/68/19/455676819.db2.gz	BEZASZZDSRXUIL-GOSISDBHSA-N	0	3	342.487	3.215	20	30		EGEDHN
CC[C@H](NCCC(=O)N(C)CCC#N)c1ccccc1OC(F)F	ZINC000271659872	455715076	/nfs/dbraw/zinc/71/50/76/455715076.db2.gz	GQEZVVNFVLGJRU-AWEZNQCLSA-N	0	3	339.386	3.091	20	30		EGEDHN
N#C[C@@H]1CCC[C@@H](NCC(=O)N2CCC(Cc3ccccc3)CC2)C1	ZINC000192924567	455719204	/nfs/dbraw/zinc/71/92/04/455719204.db2.gz	SJVAYNMEJTTXJI-WOJBJXKFSA-N	0	3	339.483	3.140	20	30		EGEDHN
CN1CCO[C@H]([C@H](N[C@H]2CCC[C@@H](C#N)C2)c2ccc(Cl)cc2)C1	ZINC000248747813	455728678	/nfs/dbraw/zinc/72/86/78/455728678.db2.gz	FPODCTBXHNWGEE-GRGSLBFTSA-N	0	3	347.890	3.384	20	30		EGEDHN
COc1ccc([C@H](NCC(=O)NC2(C#N)CCCCC2)C2CC2)cc1	ZINC000193349821	455754180	/nfs/dbraw/zinc/75/41/80/455754180.db2.gz	AQRLMIZKPGVWDG-LJQANCHMSA-N	0	3	341.455	3.079	20	30		EGEDHN
C#Cc1cccc(NC(=O)NC[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000193667704	455769987	/nfs/dbraw/zinc/76/99/87/455769987.db2.gz	KCLUSVYMXASSKD-LJQANCHMSA-N	0	3	333.435	3.312	20	30		EGEDHN
C#Cc1cccc(NC(=O)NC[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000193667692	455770656	/nfs/dbraw/zinc/77/06/56/455770656.db2.gz	KCLUSVYMXASSKD-IBGZPJMESA-N	0	3	333.435	3.312	20	30		EGEDHN
CC[C@@](C)(C#N)C(=O)Nc1ccc(CCN2CCSCC2)cc1	ZINC000285032830	455780858	/nfs/dbraw/zinc/78/08/58/455780858.db2.gz	BOMPKZZUNOUBRH-SFHVURJKSA-N	0	3	331.485	3.156	20	30		EGEDHN
CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Nc1ccc(C#N)cc1Cl	ZINC000269094423	455788783	/nfs/dbraw/zinc/78/87/83/455788783.db2.gz	DAHZHJDARWVEIG-KGLIPLIRSA-N	0	3	332.835	3.302	20	30		EGEDHN
CC[C@](C)(C#N)C(=O)Nc1cccc(N2CCN(CC3CC3)CC2)c1	ZINC000285120093	455792054	/nfs/dbraw/zinc/79/20/54/455792054.db2.gz	NKWXMVHIDLQOMS-HXUWFJFHSA-N	0	3	340.471	3.097	20	30		EGEDHN
N#C[C@]1(C(=O)NC2CCN(Cc3ccccc3)CC2)CC12CCCC2	ZINC000294232278	455808814	/nfs/dbraw/zinc/80/88/14/455808814.db2.gz	MHEQYIDCHFPSRY-NRFANRHFSA-N	0	3	337.467	3.241	20	30		EGEDHN
C=CCOCCN1CCC2(C[C@H]2N(Cc2ccsc2)C(C)=O)CC1	ZINC000294770243	455826818	/nfs/dbraw/zinc/82/68/18/455826818.db2.gz	ZDOAWVLEDVCJFD-GOSISDBHSA-N	0	3	348.512	3.154	20	30		EGEDHN
CC(C)CCOC1CCN(CCC(=O)Nc2ccc(C#N)cc2)CC1	ZINC000194339893	455829428	/nfs/dbraw/zinc/82/94/28/455829428.db2.gz	PADBDIUQXSIDJD-UHFFFAOYSA-N	0	3	343.471	3.414	20	30		EGEDHN
N#C[C@@]1(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)CC12CCCC2	ZINC000295062172	455837942	/nfs/dbraw/zinc/83/79/42/455837942.db2.gz	KTVXQAIRVIPFFV-GHTZIAJQSA-N	0	3	337.467	3.241	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N[C@H]2CCCC[C@H]2C)cc1	ZINC000278553747	455840614	/nfs/dbraw/zinc/84/06/14/455840614.db2.gz	HQOVUMHGFGFWRT-WWGRRREGSA-N	0	3	349.456	3.073	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H](COC)[C@@H]2CCCO2)cc1Cl	ZINC000278706539	455845860	/nfs/dbraw/zinc/84/58/60/455845860.db2.gz	RJSAKFRGIBNXCY-RDJZCZTQSA-N	0	3	325.836	3.188	20	30		EGEDHN
Cc1noc(C)c1C(=O)C(C(=S)[N-]C(C)(C)C)[n+]1ccc(C)cc1	ZINC000186963914	455857320	/nfs/dbraw/zinc/85/73/20/455857320.db2.gz	AYECGCKPXJFUFB-UHFFFAOYSA-O	0	3	346.476	3.214	20	30		EGEDHN
COc1ccc([C@H](C)N[C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)cc1	ZINC000272188334	455870833	/nfs/dbraw/zinc/87/08/33/455870833.db2.gz	JRVMIFUYOWZANR-MGPUTAFESA-N	0	3	349.434	3.413	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)C(C#N)Cc1ccc(C#N)cc1)c1cccnc1	ZINC000280048829	455881690	/nfs/dbraw/zinc/88/16/90/455881690.db2.gz	MBDDBMQIQKUKHH-WOJBJXKFSA-N	0	3	346.434	3.192	20	30		EGEDHN
Cc1ccccc1OC[C@H](O)CN(Cc1ccc(C#N)cc1)C1CC1	ZINC000194956977	455905838	/nfs/dbraw/zinc/90/58/38/455905838.db2.gz	MQIXSRJKMHKFCZ-HXUWFJFHSA-N	0	3	336.435	3.271	20	30		EGEDHN
N#Cc1ccc(C(F)(F)F)nc1NC[C@@H]1NCCc2ccccc21	ZINC000261725457	455936113	/nfs/dbraw/zinc/93/61/13/455936113.db2.gz	RBQOTFUJBXZLFC-AWEZNQCLSA-N	0	3	332.329	3.271	20	30		EGEDHN
CN(C)Cc1ccnc(NCc2cccn2Cc2ccccc2C#N)c1	ZINC000187891693	455966201	/nfs/dbraw/zinc/96/62/01/455966201.db2.gz	GUMBSSJUQQPQTB-UHFFFAOYSA-N	0	3	345.450	3.477	20	30		EGEDHN
CN(C(=O)C(C#N)Cc1ccc(C#N)cc1)[C@@H]1CCc2ccccc2C1	ZINC000280482819	455979599	/nfs/dbraw/zinc/97/95/99/455979599.db2.gz	PRRGSPBFXKEBSP-NHCUHLMSSA-N	0	3	343.430	3.256	20	30		EGEDHN
CCN(CC(=O)Nc1c(C#N)c(C)c(C)n1Cc1ccco1)C(C)C	ZINC000195527287	455979688	/nfs/dbraw/zinc/97/96/88/455979688.db2.gz	MTHZZXBLHZEEJW-UHFFFAOYSA-N	0	3	342.443	3.287	20	30		EGEDHN
CN(C(=O)C(C#N)Cc1ccc(C#N)cc1)[C@H]1CCc2ccccc2C1	ZINC000280482822	455980100	/nfs/dbraw/zinc/98/01/00/455980100.db2.gz	PRRGSPBFXKEBSP-RTWAWAEBSA-N	0	3	343.430	3.256	20	30		EGEDHN
CN(C(=O)[C@@H]1CCN(Cc2ccc(OCC#N)cc2)C1)c1ccccc1	ZINC000280497890	455984174	/nfs/dbraw/zinc/98/41/74/455984174.db2.gz	BBISPYCXWNFALA-GOSISDBHSA-N	0	3	349.434	3.074	20	30		EGEDHN
Cc1ccc(O[C@H](C)CNC(=O)C(C#N)Cc2ccc(C#N)cc2)cc1	ZINC000280540001	455994868	/nfs/dbraw/zinc/99/48/68/455994868.db2.gz	SXGCMKKXGRJDTL-APWZRJJASA-N	0	3	347.418	3.133	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)N[C@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000280561741	455999813	/nfs/dbraw/zinc/99/98/13/455999813.db2.gz	FVAISIGKNCMGRQ-PBHICJAKSA-N	0	3	337.423	3.243	20	30		EGEDHN
C=C(C)COc1cccc(NC(=O)N[C@@H](C)C2=CCN(C)CC2)c1	ZINC000272630967	456019482	/nfs/dbraw/zinc/01/94/82/456019482.db2.gz	AKXRBHRPQSLCBQ-HNNXBMFYSA-N	0	3	329.444	3.413	20	30		EGEDHN
CC[C@](C)(C#N)C(=O)Nc1cc(C)cc(N2CCN(C(C)C)CC2)c1	ZINC000286445025	456047813	/nfs/dbraw/zinc/04/78/13/456047813.db2.gz	IKXSDMLMVPKOMP-HXUWFJFHSA-N	0	3	342.487	3.404	20	30		EGEDHN
C#CCCCCNC(=O)N1CC[C@]2(CCN(Cc3ccccc3)C2)C1	ZINC000287181913	456063454	/nfs/dbraw/zinc/06/34/54/456063454.db2.gz	TYBWMRONFXMCKE-NRFANRHFSA-N	0	3	339.483	3.098	20	30		EGEDHN
C#CCOc1ccccc1NC(=O)N1CCN(C2CCC2)C[C@H](C)C1	ZINC000296912582	456065601	/nfs/dbraw/zinc/06/56/01/456065601.db2.gz	PALHBICVVMDVLI-INIZCTEOSA-N	0	3	341.455	3.037	20	30		EGEDHN
C[C@@H](CN(C)C)NC(=O)c1ccccc1Sc1ccccc1C#N	ZINC000287304737	456066697	/nfs/dbraw/zinc/06/66/97/456066697.db2.gz	VSUQBRGYMRYPBT-AWEZNQCLSA-N	0	3	339.464	3.389	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2ccc(CSC)cc2)CC1	ZINC000287461209	456070210	/nfs/dbraw/zinc/07/02/10/456070210.db2.gz	RPCPZTCFJHRBKR-UHFFFAOYSA-N	0	3	347.528	3.389	20	30		EGEDHN
C=CCS(=O)(=O)CCNC(Cc1ccccc1)Cc1ccccc1	ZINC000272903645	456107736	/nfs/dbraw/zinc/10/77/36/456107736.db2.gz	VNUKLSYYZJQEBR-UHFFFAOYSA-N	0	3	343.492	3.031	20	30		EGEDHN
C#CCC(C)(C)c1nc(-c2ccc3c(c2)C(SC)C(=O)N3)no1	ZINC000288888004	456108403	/nfs/dbraw/zinc/10/84/03/456108403.db2.gz	IGJOTSILPHCHTK-CYBMUJFWSA-N	0	3	327.409	3.394	20	30		EGEDHN
C=CCN1CCC(Nc2c(C(=O)OCC)cnc3ccccc32)CC1	ZINC000301412569	456110410	/nfs/dbraw/zinc/11/04/10/456110410.db2.gz	ZATIQLQYORDWAZ-UHFFFAOYSA-N	0	3	339.439	3.474	20	30		EGEDHN
Cc1nnc(N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c(C#N)c1C	ZINC000301438785	456116694	/nfs/dbraw/zinc/11/66/94/456116694.db2.gz	NTLUYDJQRXBMIT-GOSISDBHSA-N	0	3	335.455	3.066	20	30		EGEDHN
Cc1ncsc1CON=C(N)c1ccccc1CN1CCCCC1	ZINC000289450669	456125307	/nfs/dbraw/zinc/12/53/07/456125307.db2.gz	UVGOZKMHCVBDFZ-UHFFFAOYSA-N	0	3	344.484	3.275	20	30		EGEDHN
Cc1nn(C(C)C)cc1CN(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000289678510	456136214	/nfs/dbraw/zinc/13/62/14/456136214.db2.gz	DWDIRHYEQJPIGL-UHFFFAOYSA-N	0	3	339.487	3.208	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)Cc1ccccc1[N+](=O)[O-]	ZINC000289707441	456137559	/nfs/dbraw/zinc/13/75/59/456137559.db2.gz	GMYNJXJPJKRUAM-UHFFFAOYSA-N	0	3	338.411	3.030	20	30		EGEDHN
C=CCc1cc(CN[C@H](CO)Cc2ccc(C)cc2)cc(OC)c1O	ZINC000188988983	456191465	/nfs/dbraw/zinc/19/14/65/456191465.db2.gz	KDSZZBXQXFEEBI-IBGZPJMESA-N	0	3	341.451	3.131	20	30		EGEDHN
CC(C)(C#N)c1ccc(C(=O)NC[C@H]2CCCCN2C2CC2)cc1	ZINC000281461404	456241403	/nfs/dbraw/zinc/24/14/03/456241403.db2.gz	CYOOMASOYKOMOJ-GOSISDBHSA-N	0	3	325.456	3.234	20	30		EGEDHN
CC[C@H](CC#N)N[C@H]1CCCC[C@@H](N2C(=O)c3ccccc3C2=O)C1	ZINC000273869983	456245924	/nfs/dbraw/zinc/24/59/24/456245924.db2.gz	OGDWMOSOAMWFFJ-OWCLPIDISA-N	0	3	339.439	3.266	20	30		EGEDHN
C=C(C)CN1CCC(Nc2ncnc3c2cnn3C(C)(C)C)CC1	ZINC000301904682	456246859	/nfs/dbraw/zinc/24/68/59/456246859.db2.gz	YENUPJBDXNWKLB-UHFFFAOYSA-N	0	3	328.464	3.034	20	30		EGEDHN
CN(C)CCN(Cc1ccc(F)cc1)c1ncc(C#N)cc1Cl	ZINC000347659102	456286195	/nfs/dbraw/zinc/28/61/95/456286195.db2.gz	XPKTXOZMHXMKQZ-UHFFFAOYSA-N	0	3	332.810	3.314	20	30		EGEDHN
COc1cc(CN[C@H](C)C[C@@H](O)c2ccc(F)cc2)ccc1C#N	ZINC000281698597	456296028	/nfs/dbraw/zinc/29/60/28/456296028.db2.gz	NOCXVBWGBHYNHE-FZKQIMNGSA-N	0	3	328.387	3.308	20	30		EGEDHN
C=C[C@@H](CO)NCc1cc(Br)c(C)c(Br)c1	ZINC000336695494	456308268	/nfs/dbraw/zinc/30/82/68/456308268.db2.gz	LRMCGLVBUZYTHU-JTQLQIEISA-N	0	3	349.066	3.157	20	30		EGEDHN
CN(C[C@@H]1CCN(C)[C@@H]1c1cccnc1)c1nccc(C#N)c1Cl	ZINC000343011336	456355519	/nfs/dbraw/zinc/35/55/19/456355519.db2.gz	DYGBBEHZZYZJQE-DOTOQJQBSA-N	0	3	341.846	3.131	20	30		EGEDHN
CN1CCC(N(Cc2ccco2)C(=O)/C=C/c2ccc(C#N)cc2)CC1	ZINC000298136747	456373307	/nfs/dbraw/zinc/37/33/07/456373307.db2.gz	DIZLXWJFGFIAAU-CMDGGOBGSA-N	0	3	349.434	3.287	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000290668177	456401131	/nfs/dbraw/zinc/40/11/31/456401131.db2.gz	UXYWAGIQGNDICE-IBGZPJMESA-N	0	3	330.472	3.386	20	30		EGEDHN
C[C@H](c1ccncc1)N1CCC(Nc2c(C#N)cccc2C#N)CC1	ZINC000302900441	456431495	/nfs/dbraw/zinc/43/14/95/456431495.db2.gz	SOQWWYMOGNBMEI-OAHLLOKOSA-N	0	3	331.423	3.462	20	30		EGEDHN
C[C@@H](NC[C@H](O)COc1ccccc1Cl)c1ccc(C#N)cc1	ZINC000298401940	456446449	/nfs/dbraw/zinc/44/64/49/456446449.db2.gz	JWFSXMJFKPVMBA-CJNGLKHVSA-N	0	3	330.815	3.302	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)NC[C@@H](C)N1CCC[C@H](C)C1	ZINC000303474409	456461368	/nfs/dbraw/zinc/46/13/68/456461368.db2.gz	OKXCDMZKOOXBMA-DLBZAZTESA-N	0	3	345.487	3.171	20	30		EGEDHN
CCC(CC)(CCO)NCC(=O)N(CCC#N)c1cccc(C)c1C	ZINC000282467229	456524516	/nfs/dbraw/zinc/52/45/16/456524516.db2.gz	NKDVGNDVUWTLCO-UHFFFAOYSA-N	0	3	345.487	3.081	20	30		EGEDHN
CC[C@H](C)NC(=O)[C@@H]1C[C@H](C)N(CC2(C#N)CC2)[C@@H]2CCCC[C@H]12	ZINC000343328158	456534189	/nfs/dbraw/zinc/53/41/89/456534189.db2.gz	XEVPPCNSHQTWKZ-QXDIGNSFSA-N	0	3	331.504	3.474	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2coc3ccc(OC)cc23)CC1	ZINC000337769034	456534958	/nfs/dbraw/zinc/53/49/58/456534958.db2.gz	BNTLJJNQANFCJO-UHFFFAOYSA-N	0	3	328.412	3.212	20	30		EGEDHN
C[C@@H](NCc1cccc(C#N)c1)c1ccc(N2CCCNC2=O)cc1	ZINC000291129144	456539013	/nfs/dbraw/zinc/53/90/13/456539013.db2.gz	WDCHMTFECIZYNF-OAHLLOKOSA-N	0	3	334.423	3.329	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)cc1)c1ccc(N2CCCNC2=O)cc1	ZINC000291129197	456539899	/nfs/dbraw/zinc/53/98/99/456539899.db2.gz	WEGDOEULWMEJMG-OAHLLOKOSA-N	0	3	334.423	3.329	20	30		EGEDHN
CCOc1ccccc1CN1CCN(CCCSCC#N)[C@@H](C)C1	ZINC000282528581	456542098	/nfs/dbraw/zinc/54/20/98/456542098.db2.gz	YUJAKCXHVLAMOF-KRWDZBQOSA-N	0	3	347.528	3.238	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1	ZINC000337877285	456582051	/nfs/dbraw/zinc/58/20/51/456582051.db2.gz	RLNBDJNMVMKTPG-VQIMIIECSA-N	0	3	333.435	3.432	20	30		EGEDHN
Cn1cc(CNCCSCc2ccccc2C#N)c(C(F)F)n1	ZINC000291281825	456590877	/nfs/dbraw/zinc/59/08/77/456590877.db2.gz	UWCXRFZZJDMSML-UHFFFAOYSA-N	0	3	336.411	3.252	20	30		EGEDHN
CCc1ccc([C@@H]2CCCN([C@@H](C)C(=O)N(C)CCC#N)C2)cc1	ZINC000353257136	456591509	/nfs/dbraw/zinc/59/15/09/456591509.db2.gz	IEPLRSXUKSWBOF-QFBILLFUSA-N	0	3	327.472	3.189	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)Cc1ccc(C#N)cc1)c1c(C)noc1C	ZINC000348316219	456617218	/nfs/dbraw/zinc/61/72/18/456617218.db2.gz	DVXZZPGBNQPOBH-SJORKVTESA-N	0	3	336.395	3.113	20	30		EGEDHN
N#CCOc1ccc(CN[C@H]2CCO[C@@H]2c2ccc(F)c(F)c2)cc1	ZINC000277074020	456671649	/nfs/dbraw/zinc/67/16/49/456671649.db2.gz	PFAKGLFPYSDJKP-RBUKOAKNSA-N	0	3	344.361	3.487	20	30		EGEDHN
C=CCN1CCC(NC(=O)C2(CCOCc3ccccc3)CC2)CC1	ZINC000353462023	456700127	/nfs/dbraw/zinc/70/01/27/456700127.db2.gz	TYPYRRGRZOPXSN-UHFFFAOYSA-N	0	3	342.483	3.140	20	30		EGEDHN
C[C@H](NC(=O)N1CCN(C2CCC2)C[C@@H](C)C1)c1ccc(C#N)cc1	ZINC000291682674	456720208	/nfs/dbraw/zinc/72/02/08/456720208.db2.gz	RLGRAOAFSQHPQS-CVEARBPZSA-N	0	3	340.471	3.135	20	30		EGEDHN
O=C(CN[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2)N[C@@H]1CCOc2ccccc21	ZINC000328657594	456731272	/nfs/dbraw/zinc/73/12/72/456731272.db2.gz	PIYSSYURPXACJO-SFUIVIKGSA-N	0	3	342.439	3.014	20	30		EGEDHN
CC(C)(CNC(=O)C[C@@H](CC#N)c1ccccc1)N1CCCCC1	ZINC000353537012	456741437	/nfs/dbraw/zinc/74/14/37/456741437.db2.gz	QUNLQMJYGJLBBM-GOSISDBHSA-N	0	3	327.472	3.455	20	30		EGEDHN
CC[C@H](N[C@@H](C)C(=O)N[C@](C)(C#N)C(C)C)c1ccc(OC)cc1	ZINC000340897816	456747642	/nfs/dbraw/zinc/74/76/42/456747642.db2.gz	KDNJLZPOBQGTDX-UCLAIMLFSA-N	0	3	331.460	3.179	20	30		EGEDHN
C[C@@H]1CC(=O)N[C@H](C(=O)NCC2(N3CCSCC3)CCCC2)C1	ZINC000328789779	456761290	/nfs/dbraw/zinc/76/12/90/456761290.db2.gz	YKZWKGUOCFAJHZ-KBPBESRZSA-N	0	3	339.505	3.060	20	30		EGEDHN
CC[C@@H](CNC(=O)[C@H]1CCCC(=O)N1)N1CCc2ccccc2C1	ZINC000328834557	456771305	/nfs/dbraw/zinc/77/13/05/456771305.db2.gz	WUODZEUQSHCTES-DLBZAZTESA-N	0	3	329.444	3.289	20	30		EGEDHN
C[C@H]([NH+]=C([O-])N1CCC(c2cnc[nH]2)CC1)[C@@H]1COc2ccccc21	ZINC000328844671	456773680	/nfs/dbraw/zinc/77/36/80/456773680.db2.gz	PYZARFCVOWPJCW-BBRMVZONSA-N	0	3	340.427	3.068	20	30		EGEDHN
Cc1nc([C@@H]2CCCOC2)sc1C(=O)N[C@@H]1CCN(C)[C@@H](C)C1	ZINC000328852263	456776610	/nfs/dbraw/zinc/77/66/10/456776610.db2.gz	VNVIUKBRIMLXSL-IACUBPJLSA-N	0	3	337.489	3.133	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)NC[C@@H](C)N2CCCC[C@@H]2C)cc1	ZINC000344098290	456795861	/nfs/dbraw/zinc/79/58/61/456795861.db2.gz	JCOCNWXSMLNIMA-DLBZAZTESA-N	0	3	345.487	3.314	20	30		EGEDHN
CC(C)(C#N)CC(=O)Nc1ccc(CCN2CCSCC2)cc1	ZINC000344219978	456807212	/nfs/dbraw/zinc/80/72/12/456807212.db2.gz	GZEXMXMJNKRFNE-UHFFFAOYSA-N	0	3	331.485	3.156	20	30		EGEDHN
CN(CCC#N)c1ccc(CNCCOCC(F)(F)C(F)F)cc1	ZINC000277424721	456821088	/nfs/dbraw/zinc/82/10/88/456821088.db2.gz	BGTBJCVPWMQNBV-UHFFFAOYSA-N	0	3	347.356	3.043	20	30		EGEDHN
CNC(=O)[C@@H]1CCC[C@@H]1NCC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000329205550	456853701	/nfs/dbraw/zinc/85/37/01/456853701.db2.gz	XALLTOPBBAGBCA-AQLLNRKPSA-N	0	3	333.476	3.256	20	30		EGEDHN
O=C(Nc1c[nH]nc1[C@H]1CCCN(CC2(O)CCC2)C1)C1CCCC1	ZINC000329252217	456860801	/nfs/dbraw/zinc/86/08/01/456860801.db2.gz	BVVQWCRZSMJJTM-HNNXBMFYSA-N	0	3	346.475	3.282	20	30		EGEDHN
CC1CCC(N2CCN(C(=O)Nc3cccc4c3OCO4)CC2)CC1	ZINC000329258163	456861898	/nfs/dbraw/zinc/86/18/98/456861898.db2.gz	ACKUHOZIOREDIV-UHFFFAOYSA-N	0	3	345.443	3.157	20	30		EGEDHN
CC1(C)CN(C2(CNC(=O)Cc3cccnc3)CCCCC2)CCO1	ZINC000329254216	456861961	/nfs/dbraw/zinc/86/19/61/456861961.db2.gz	ZRIAVDRZJWHIEW-UHFFFAOYSA-N	0	3	345.487	3.394	20	30		EGEDHN
CC(C)(C)c1cc(NC(=O)CN2CC[C@H](N3CCCCC3)C2)on1	ZINC000329278617	456866080	/nfs/dbraw/zinc/86/60/80/456866080.db2.gz	JSDWJTBYJQLBOS-AWEZNQCLSA-N	0	3	334.464	3.120	20	30		EGEDHN
Cc1c2cc(F)ccc2oc1CNC(=O)N[C@H]1CCN(C2CC2)C1	ZINC000329319731	456871695	/nfs/dbraw/zinc/87/16/95/456871695.db2.gz	TXEBMHYRMCCHNC-ZDUSSCGKSA-N	0	3	331.391	3.121	20	30		EGEDHN
C[C@@H]1C[C@H](C(=O)NCC2(N3CCSCC3)CCCC2)CC(=O)N1	ZINC000329339719	456875264	/nfs/dbraw/zinc/87/52/64/456875264.db2.gz	NULPRYIDTIUVAU-KGLIPLIRSA-N	0	3	339.505	3.060	20	30		EGEDHN
Cc1nn(CC(C)C)c(C)c1CC(=O)N[C@@H](C)C1=CCN(C)CC1	ZINC000329352407	456877264	/nfs/dbraw/zinc/87/72/64/456877264.db2.gz	UNNQCMXYZXTIGY-AWEZNQCLSA-N	0	3	332.492	3.305	20	30		EGEDHN
O=C(Nc1ccn2ccnc2c1)N1CCN(CC2CCCCC2)CC1	ZINC000329443813	456891358	/nfs/dbraw/zinc/89/13/58/456891358.db2.gz	CALDWUSXRLZCKP-UHFFFAOYSA-N	0	3	341.459	3.078	20	30		EGEDHN
CCO[C@@H]1C[C@H](NC(=O)[C@H](C(C)C)N2CCCCC2)[C@]12CCCO2	ZINC000329516282	456903508	/nfs/dbraw/zinc/90/35/08/456903508.db2.gz	MRGWSNGAPPZJJF-MJQMVNBJSA-N	0	3	338.492	3.180	20	30		EGEDHN
C[C@H](C(=O)Nc1ccc2c(c1)OCO2)N1CCC2(CCOCC2)[C@H]1C	ZINC000329666874	456923947	/nfs/dbraw/zinc/92/39/47/456923947.db2.gz	LBYVXODMAWJPAV-ZIAGYGMSSA-N	0	3	346.427	3.283	20	30		EGEDHN
[O-]C(NC[C@@H]1CCC[C@H](C(F)(F)F)C1)=[NH+][C@H]1CCc2nc[nH]c2C1	ZINC000329689716	456928133	/nfs/dbraw/zinc/92/81/33/456928133.db2.gz	GJXQVISEFNHQDB-WOPDTQHZSA-N	0	3	344.381	3.139	20	30		EGEDHN
[O-]C(NC[C@@H]1CCC[C@H](C(F)(F)F)C1)=[NH+][C@H]1CCc2[nH]cnc2C1	ZINC000329689716	456928137	/nfs/dbraw/zinc/92/81/37/456928137.db2.gz	GJXQVISEFNHQDB-WOPDTQHZSA-N	0	3	344.381	3.139	20	30		EGEDHN
C[C@H]1C[C@@H](N(C)C(=O)Nc2csc(-c3ccccn3)n2)CCN1C	ZINC000329831370	456947449	/nfs/dbraw/zinc/94/74/49/456947449.db2.gz	KCBQIIIRAGLVJC-STQMWFEESA-N	0	3	345.472	3.165	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](C3CCOCC3)C2)c(OC(F)F)c1	ZINC000339131422	456955143	/nfs/dbraw/zinc/95/51/43/456955143.db2.gz	HZJIZLAZUSSVCA-OAHLLOKOSA-N	0	3	336.382	3.408	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2NCc1cnn(CC(F)(F)F)c1	ZINC000341845213	456968851	/nfs/dbraw/zinc/96/88/51/456968851.db2.gz	YYZPKDOWKFWGPJ-INIZCTEOSA-N	0	3	334.345	3.484	20	30		EGEDHN
Cc1nccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)n1	ZINC000330123067	456988252	/nfs/dbraw/zinc/98/82/52/456988252.db2.gz	KPGSKQQOWZOWFI-RHSMWYFYSA-N	0	3	339.443	3.164	20	30		EGEDHN
CCCN(C)[C@H](CNC(=O)c1ccc(C#N)[nH]1)c1ccc(Cl)cc1	ZINC000358842963	456999661	/nfs/dbraw/zinc/99/96/61/456999661.db2.gz	PONCYQPFVAGXBY-QGZVFWFLSA-N	0	3	344.846	3.353	20	30		EGEDHN
CN1CCC2(CC1)C[C@@H](NC(=O)C[C@H]1CCOC1)c1ccccc1O2	ZINC000330202145	457000808	/nfs/dbraw/zinc/00/08/08/457000808.db2.gz	YXMZDJNJEZVOMN-NVXWUHKLSA-N	0	3	344.455	3.358	20	30		EGEDHN
COc1ccc(CN(Cc2ccccc2)CC2(CO)CC2)cc1C#N	ZINC000341941543	457016289	/nfs/dbraw/zinc/01/62/89/457016289.db2.gz	CABJMUCJNCRHER-UHFFFAOYSA-N	0	3	336.435	3.342	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN1C[C@@H](C)N(CC)C[C@H]1C	ZINC000346220228	457024392	/nfs/dbraw/zinc/02/43/92/457024392.db2.gz	WGVOERXGGDQHOX-HZPDHXFCSA-N	0	3	347.528	3.318	20	30		EGEDHN
C=CCOc1cccc(CN(C)CC(C)(C)CN2CCOCC2)c1	ZINC000354108633	457068519	/nfs/dbraw/zinc/06/85/19/457068519.db2.gz	WJKKFIAIBBJOHX-UHFFFAOYSA-N	0	3	332.488	3.042	20	30		EGEDHN
N#C[C@@H]1CC[C@@H](NCc2cc(Br)c3c(c2)OCCO3)C1	ZINC000349831177	457069287	/nfs/dbraw/zinc/06/92/87/457069287.db2.gz	UYUDXJDPWIQJOM-ZYHUDNBSSA-N	0	3	337.217	3.002	20	30		EGEDHN
CC(C)(C)C(=O)NC[C@@H]1CCCN(Cc2ccc(CC#N)cc2)C1	ZINC000330864618	457096138	/nfs/dbraw/zinc/09/61/38/457096138.db2.gz	YJUCXCRSYBBTNH-SFHVURJKSA-N	0	3	327.472	3.127	20	30		EGEDHN
C=CCOc1cccnc1C(=O)NC[C@H](N[C@H](C)CC)c1ccco1	ZINC000359569471	457096826	/nfs/dbraw/zinc/09/68/26/457096826.db2.gz	YSDBLWIXXFWWCT-CABCVRRESA-N	0	3	343.427	3.099	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)[C@@H](C)N1CC[C@@H](c2ccccc2)[C@@H]1C	ZINC000331236425	457150704	/nfs/dbraw/zinc/15/07/04/457150704.db2.gz	KRRRTPQWPHEJAD-IXIUHKBRSA-N	0	3	327.472	3.307	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C(=O)NC[C@@H]1N(C)CCCC1(C)C	ZINC000331306541	457164143	/nfs/dbraw/zinc/16/41/43/457164143.db2.gz	FBGDSCANLWGPDB-KRWDZBQOSA-N	0	3	328.460	3.024	20	30		EGEDHN
C[C@H]1[C@@H](NC(=O)NCC#Cc2ccccc2)CCN1Cc1ccccc1	ZINC000350124224	457166103	/nfs/dbraw/zinc/16/61/03/457166103.db2.gz	XJCQYUKXKZYPNC-RXVVDRJESA-N	0	3	347.462	3.000	20	30		EGEDHN
N#Cc1ccc(C(=O)NC2CCN(CCc3ccccc3)CC2)s1	ZINC000362963212	457176457	/nfs/dbraw/zinc/17/64/57/457176457.db2.gz	JHSNMFJBONWRBO-UHFFFAOYSA-N	0	3	339.464	3.057	20	30		EGEDHN
C=CCNC(=O)Nc1ccc(NC(=O)[C@@H](CCC)NC(C)C)cc1	ZINC000350396159	457178704	/nfs/dbraw/zinc/17/87/04/457178704.db2.gz	CUDDCFBJYCKTEX-MRXNPFEDSA-N	0	3	332.448	3.099	20	30		EGEDHN
CC(C)[C@H](NCc1ccc(C#N)cc1OC(F)F)C1(CO)CCC1	ZINC000339730061	457236303	/nfs/dbraw/zinc/23/63/03/457236303.db2.gz	ZTVSGKIPIDZOOL-INIZCTEOSA-N	0	3	338.398	3.436	20	30		EGEDHN
Cc1ccc(C(=O)C(C#N)c2ccncn2)cc1NC(=O)c1ccco1	ZINC000354469628	457243700	/nfs/dbraw/zinc/24/37/00/457243700.db2.gz	RJHWLUVXYSKTMC-CQSZACIVSA-N	0	3	346.346	3.120	20	30		EGEDHN
COc1ccc2cc(C(=O)C(C#N)c3cc(C)nc(C)n3)c(C)nc2c1	ZINC000354939739	457330007	/nfs/dbraw/zinc/33/00/07/457330007.db2.gz	MIDVQSGVOZGYFI-QGZVFWFLSA-N	0	3	346.390	3.449	20	30		EGEDHN
CC(C)Cc1ccc([C@@H](CNC(=O)NCCCC#N)N(C)C)cc1	ZINC000355075721	457339363	/nfs/dbraw/zinc/33/93/63/457339363.db2.gz	FOXFFZCVEZKQGF-GOSISDBHSA-N	0	3	330.476	3.091	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc(F)c(C(C)=O)c2)CC1	ZINC000352190841	457345866	/nfs/dbraw/zinc/34/58/66/457345866.db2.gz	FFKUCKKUHJRPNH-UHFFFAOYSA-N	0	3	333.407	3.190	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N2CCC[C@@H](C)CC2)cc1	ZINC000332365970	457356759	/nfs/dbraw/zinc/35/67/59/457356759.db2.gz	YJVTVIAQQBLKRG-KGLIPLIRSA-N	0	3	349.456	3.026	20	30		EGEDHN
N#Cc1ccc(CN2CCN(CCCOCc3ccccc3)CC2)cc1	ZINC000347376155	457386615	/nfs/dbraw/zinc/38/66/15/457386615.db2.gz	CMUDNMUXNDXLGU-UHFFFAOYSA-N	0	3	349.478	3.283	20	30		EGEDHN
C[C@H](C#N)Oc1ccccc1NC(=O)N1CCCC12CCN(C)CC2	ZINC000378545767	457408883	/nfs/dbraw/zinc/40/88/83/457408883.db2.gz	CRZKGAUGMFJGRY-OAHLLOKOSA-N	0	3	342.443	3.070	20	30		EGEDHN
CC1CCN(C(=O)C2CCN(Cc3ccc(CC#N)cc3)CC2)CC1	ZINC000342666598	457441730	/nfs/dbraw/zinc/44/17/30/457441730.db2.gz	MPBZCNSETRNNPN-UHFFFAOYSA-N	0	3	339.483	3.223	20	30		EGEDHN
Cc1nsc(N2CC[C@@H](C)N(Cc3ccccc3)CC2)c1C#N	ZINC000342778127	457519266	/nfs/dbraw/zinc/51/92/66/457519266.db2.gz	CGNBPSOYQVADEG-CQSZACIVSA-N	0	3	326.469	3.424	20	30		EGEDHN
C[C@@]1(CNC(=O)c2ccc(CC#N)cc2)CCN(Cc2ccccc2)C1	ZINC000374252639	457545490	/nfs/dbraw/zinc/54/54/90/457545490.db2.gz	YSYRDNZHWZVOQB-QFIPXVFZSA-N	0	3	347.462	3.395	20	30		EGEDHN
CN1CCC[C@@]2(CCN(C(=O)C[C@@H](CC#N)c3ccccc3)C2)C1	ZINC000356243649	457550363	/nfs/dbraw/zinc/55/03/63/457550363.db2.gz	BZWQLTSJFPFHIN-UYAOXDASSA-N	0	3	325.456	3.018	20	30		EGEDHN
COC(=O)[C@H](CCNC1(c2cccc(C#N)c2)CC1)c1ccccc1	ZINC000425458914	457562904	/nfs/dbraw/zinc/56/29/04/457562904.db2.gz	NSIKEFSAOAXYSG-LJQANCHMSA-N	0	3	334.419	3.484	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)NC[C@@]1(C)CCN(Cc2ccccc2)C1	ZINC000374279528	457563534	/nfs/dbraw/zinc/56/35/34/457563534.db2.gz	KQYVRMHIFFVTGI-HXUWFJFHSA-N	0	3	337.423	3.102	20	30		EGEDHN
CCN(CCC#N)C(=O)CN1C[C@H](c2ccccc2)[C@H]2CCC[C@H]21	ZINC000352727102	457564394	/nfs/dbraw/zinc/56/43/94/457564394.db2.gz	SVUXJQZZXIEHCI-GUDVDZBRSA-N	0	3	325.456	3.017	20	30		EGEDHN
C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)N(C)[C@@H](C)c1cccc(C#N)c1	ZINC000425474608	457569866	/nfs/dbraw/zinc/56/98/66/457569866.db2.gz	LHBVPRQIXCQWPL-IKGGRYGDSA-N	0	3	342.487	3.381	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1c2ccccc2CC[C@H]1CN(C)C)OCC	ZINC000425599769	457608183	/nfs/dbraw/zinc/60/81/83/457608183.db2.gz	AEHJBAPPOMQOSB-HKUYNNGSSA-N	0	3	330.472	3.267	20	30		EGEDHN
Cc1ccccc1CN1CCC(NC(=O)C2(C#N)CCCC2)CC1	ZINC000364483953	457620846	/nfs/dbraw/zinc/62/08/46/457620846.db2.gz	QACDECZTASTRMR-UHFFFAOYSA-N	0	3	325.456	3.160	20	30		EGEDHN
Cc1nccnc1[C@H](C)N[C@H]1CCCN(c2ccc(C#N)cc2F)C1	ZINC000364735189	457683285	/nfs/dbraw/zinc/68/32/85/457683285.db2.gz	CZGCRGLRUSHCGD-HOCLYGCPSA-N	0	3	339.418	3.115	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2cc(N(C)C)nc3ccccc32)nc(C)n1	ZINC000357770844	457683373	/nfs/dbraw/zinc/68/33/73/457683373.db2.gz	RVOPEQJSLJBJJB-INIZCTEOSA-N	0	3	345.406	3.198	20	30		EGEDHN
CCN(c1ccc(C(=O)C(C#N)c2cc(C)nc(C)n2)cn1)C(C)C	ZINC000357790392	457690357	/nfs/dbraw/zinc/69/03/57/457690357.db2.gz	NDSCCIOFRYLAMD-INIZCTEOSA-N	0	3	337.427	3.213	20	30		EGEDHN
CC(C#N)C(=O)N1CCC[C@@H]1C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000357797140	457693928	/nfs/dbraw/zinc/69/39/28/457693928.db2.gz	LEXUJMPSUNSHRJ-TVQRCGJNSA-N	0	3	340.210	3.083	20	30		EGEDHN
CC(C#N)C(=O)NCc1cn(-c2ccccc2)nc1-c1ccccc1	ZINC000357824661	457702897	/nfs/dbraw/zinc/70/28/97/457702897.db2.gz	KYVCEGZMXSUWOD-OAHLLOKOSA-N	0	3	330.391	3.315	20	30		EGEDHN
CC(C#N)C(=O)N[C@H](Cn1cnc2ccccc21)c1ccc(F)cc1	ZINC000357830210	457703487	/nfs/dbraw/zinc/70/34/87/457703487.db2.gz	PLPUKYOQCJHAKY-SUMWQHHRSA-N	0	3	336.370	3.193	20	30		EGEDHN
Cc1ccccc1[C@H]([C@@H](C)NC(=O)c1ccc(C#N)s1)N(C)C	ZINC000357859135	457714817	/nfs/dbraw/zinc/71/48/17/457714817.db2.gz	HITSZPGJPWYOHB-DYVFJYSZSA-N	0	3	327.453	3.349	20	30		EGEDHN
C#Cc1ccc(CN2CCC(NC(=O)c3cc(C)oc3C)CC2)cc1	ZINC000375066283	457775783	/nfs/dbraw/zinc/77/57/83/457775783.db2.gz	UDFRPYGIZJYEDU-UHFFFAOYSA-N	0	3	336.435	3.272	20	30		EGEDHN
CN(Cc1nccn1C(F)F)C(=O)C(C#N)CCc1ccccc1	ZINC000433223974	457783887	/nfs/dbraw/zinc/78/38/87/457783887.db2.gz	VNFLANTZBZWJLG-AWEZNQCLSA-N	0	3	332.354	3.009	20	30		EGEDHN
C[C@@H](CNC(=O)C(C#N)CCc1ccccc1)N(C)c1ccccc1	ZINC000433225748	457784246	/nfs/dbraw/zinc/78/42/46/457784246.db2.gz	JWBWMUMBBJNKJQ-PKOBYXMFSA-N	0	3	335.451	3.400	20	30		EGEDHN
CCC[C@H]1CN(Cc2cc(C#N)n(C)c2)CCN1Cc1ccccc1	ZINC000361544387	457785310	/nfs/dbraw/zinc/78/53/10/457785310.db2.gz	UPOOJSSBRJNUPK-FQEVSTJZSA-N	0	3	336.483	3.383	20	30		EGEDHN
Cc1nc2ccc(C(=O)C(C#N)c3nc4ccccc4n3C)cc2n1C	ZINC000361656504	457813059	/nfs/dbraw/zinc/81/30/59/457813059.db2.gz	SRWFBOJBWWEOHQ-CQSZACIVSA-N	0	3	343.390	3.259	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)NCc1ccc(C)c(C)n1)C(C)C	ZINC000457759149	457818545	/nfs/dbraw/zinc/81/85/45/457818545.db2.gz	VVFFRWIVXICHHM-LJQANCHMSA-N	0	3	344.503	3.196	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CCC(CF)CC1)C(C)C	ZINC000457763631	457819979	/nfs/dbraw/zinc/81/99/79/457819979.db2.gz	ZMHGSDQSEIRLDZ-QGZVFWFLSA-N	0	3	325.472	3.076	20	30		EGEDHN
CN(Cc1cc(Cl)cn1C)C(=O)C(C#N)CCc1ccccc1	ZINC000433361413	457820101	/nfs/dbraw/zinc/82/01/01/457820101.db2.gz	HUTFHLHVXCJJBE-OAHLLOKOSA-N	0	3	329.831	3.409	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN2CC[C@@H]3CCC[C@H]32)cc1	ZINC000426455619	457832619	/nfs/dbraw/zinc/83/26/19/457832619.db2.gz	CMSYKFJNKVHOEL-QFBILLFUSA-N	0	3	341.455	3.206	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN2CC[C@H]3CCC[C@@H]32)cc1	ZINC000426455616	457833003	/nfs/dbraw/zinc/83/30/03/457833003.db2.gz	CMSYKFJNKVHOEL-APWZRJJASA-N	0	3	341.455	3.206	20	30		EGEDHN
CC(C)(C)OC(=O)CN[C@@]1(C)CCN(CCC2(C#N)CCCCC2)C1	ZINC000411668175	457945696	/nfs/dbraw/zinc/94/56/96/457945696.db2.gz	CSQUVJAWFWSQNH-IBGZPJMESA-N	0	3	349.519	3.246	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC2(CCN2CCCSCC#N)CC1	ZINC000367566276	457962851	/nfs/dbraw/zinc/96/28/51/457962851.db2.gz	PPAOAKJQQHGTMO-UHFFFAOYSA-N	0	3	339.505	3.109	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCc3cccc(Cl)c3C2)CC1	ZINC000458311444	458009266	/nfs/dbraw/zinc/00/92/66/458009266.db2.gz	AFVDLMNSSNLKNK-UHFFFAOYSA-N	0	3	347.890	3.448	20	30		EGEDHN
C=C(C)COc1cc(CN2CC[C@](CO)(C(C)C)C2)ccc1OC	ZINC000368219157	458020136	/nfs/dbraw/zinc/02/01/36/458020136.db2.gz	ACNXLEYKRGCCLR-FQEVSTJZSA-N	0	3	333.472	3.491	20	30		EGEDHN
C[C@H](c1ccccc1)N1CCC(NC(=O)N(C)CC(C)(C)C#N)CC1	ZINC000458404098	458038555	/nfs/dbraw/zinc/03/85/55/458038555.db2.gz	JDOPZHWGUMOYDX-MRXNPFEDSA-N	0	3	342.487	3.403	20	30		EGEDHN
Cc1cccc2c1OC[C@@H](NC(=O)C(C#N)CCc1ccccc1)C2	ZINC000427987119	458062694	/nfs/dbraw/zinc/06/26/94/458062694.db2.gz	JIHCAAWUYYVJMS-MOPGFXCFSA-N	0	3	334.419	3.187	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NC(=O)c1cccc(CN2CCCCC2)c1	ZINC000412376294	458185514	/nfs/dbraw/zinc/18/55/14/458185514.db2.gz	HXTAYTNQBHKITQ-MOPGFXCFSA-N	0	3	328.456	3.136	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1CNCc1ccc(OC)c(OC)c1Cl	ZINC000435733158	458192983	/nfs/dbraw/zinc/19/29/83/458192983.db2.gz	BAARDIJFNNKJTQ-BBRMVZONSA-N	0	3	325.836	3.428	20	30		EGEDHN
C=C(C)Cn1c(C)nnc1N(C)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000358800391	458225417	/nfs/dbraw/zinc/22/54/17/458225417.db2.gz	BFPFLFNZUMRLBI-LJQANCHMSA-N	0	3	339.487	3.263	20	30		EGEDHN
C=C(C)CCNC(=O)N1C[C@@H]2CCN(Cc3ccccc3)C[C@H]2C1	ZINC000459007387	458242773	/nfs/dbraw/zinc/24/27/73/458242773.db2.gz	SOZOPZLPZHQTRS-OALUTQOASA-N	0	3	327.472	3.116	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1CNc1ccnc2cc(OC)c(OC)cc21	ZINC000413261723	458296341	/nfs/dbraw/zinc/29/63/41/458296341.db2.gz	FDZOLUWTFIPANZ-DJJJIMSYSA-N	0	3	328.412	3.067	20	30		EGEDHN
CC[S@](=O)[C@@H]1CCC[C@@H](NC2CC(C#N)(c3ccccc3)C2)C1	ZINC000372461776	458303464	/nfs/dbraw/zinc/30/34/64/458303464.db2.gz	DUSQDIZEOHFUDQ-VCRHWXKKSA-N	0	3	330.497	3.280	20	30		EGEDHN
CCS(=O)(=O)c1cc(Cl)cc(CN[C@@H]2CCC[C@@H](C#N)C2)c1	ZINC000414206509	458315931	/nfs/dbraw/zinc/31/59/31/458315931.db2.gz	FPFJNLKKBQRJNP-IUODEOHRSA-N	0	3	340.876	3.306	20	30		EGEDHN
C[C@H]1C[C@@H](c2cccnc2)N(CCC(=O)Nc2sccc2C#N)C1	ZINC000376552629	458336136	/nfs/dbraw/zinc/33/61/36/458336136.db2.gz	KYAQCBSVRMQVEY-BBRMVZONSA-N	0	3	340.452	3.426	20	30		EGEDHN
C[C@H](NC(=O)N1CCCNCC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000417996244	458369921	/nfs/dbraw/zinc/36/99/21/458369921.db2.gz	QWCWGDGSHWVSTQ-INIZCTEOSA-N	0	3	348.450	3.291	20	30		EGEDHN
C=CCC(C)(C)CN[C@@H](C(N)=O)c1cccc(Br)c1	ZINC000419176911	458379669	/nfs/dbraw/zinc/37/96/69/458379669.db2.gz	COXQPUGYKIIEPU-CYBMUJFWSA-N	0	3	325.250	3.167	20	30		EGEDHN
C[C@H](C(=O)N(CCC#N)c1ccc(F)cc1)N1C[C@@H](C)[C@H](C)[C@H]1C	ZINC000419376528	458381596	/nfs/dbraw/zinc/38/15/96/458381596.db2.gz	TYPBAFCIJNEVFK-QKPAOTATSA-N	0	3	331.435	3.437	20	30		EGEDHN
C[C@H](NC(C)(C)CNC(=O)NCC1(C#N)CCC1)c1ccccc1	ZINC000419454652	458382682	/nfs/dbraw/zinc/38/26/82/458382682.db2.gz	UMTGPYPTZJZHGY-HNNXBMFYSA-N	0	3	328.460	3.109	20	30		EGEDHN
C[C@@H](CNC(=O)c1cccc(SCC#N)c1)N1CCCC[C@H]1C	ZINC000429954369	458384601	/nfs/dbraw/zinc/38/46/01/458384601.db2.gz	VHTLWQQUSUWJRO-CABCVRRESA-N	0	3	331.485	3.295	20	30		EGEDHN
COc1ccc(CNCC2(CC#N)CC2)cc1OCc1cccnc1	ZINC000430009337	458389806	/nfs/dbraw/zinc/38/98/06/458389806.db2.gz	YCFUBALZPMNEPJ-UHFFFAOYSA-N	0	3	337.423	3.453	20	30		EGEDHN
CN(C)CCN(Cc1cccc(Cl)c1)C(=O)NCC1(C#N)CCC1	ZINC000419652563	458391000	/nfs/dbraw/zinc/39/10/00/458391000.db2.gz	UUSVYGIOHGMABK-UHFFFAOYSA-N	0	3	348.878	3.107	20	30		EGEDHN
COc1ncccc1NC(=O)C(C#N)c1ncc(C(C)(C)C)s1	ZINC000419826645	458392073	/nfs/dbraw/zinc/39/20/73/458392073.db2.gz	ARPLRGHJRVBSHP-JTQLQIEISA-N	0	3	330.413	3.090	20	30		EGEDHN
CC(C)n1nccc1[C@H]1OCC[C@@H]1NCc1ccc(C#N)c(F)c1	ZINC000421360459	458411873	/nfs/dbraw/zinc/41/18/73/458411873.db2.gz	ZTWVVKOSNRBQIN-WMZOPIPTSA-N	0	3	328.391	3.095	20	30		EGEDHN
CC[C@@](CNCc1ccc(C#N)c(F)c1)(C(=O)OC)c1ccccc1	ZINC000421389753	458412530	/nfs/dbraw/zinc/41/25/30/458412530.db2.gz	YIGPVSWCBCRERO-FQEVSTJZSA-N	0	3	340.398	3.308	20	30		EGEDHN
CCOc1cc(CN(C)CCOCc2ccc(C#N)cc2)ccc1O	ZINC000459570439	458414655	/nfs/dbraw/zinc/41/46/55/458414655.db2.gz	PCJSIKDPMFZVMN-UHFFFAOYSA-N	0	3	340.423	3.311	20	30		EGEDHN
C[C@H](CN1CC[C@H](Oc2ccc(C#N)cn2)C1)c1ccc(F)cc1	ZINC000430183904	458416485	/nfs/dbraw/zinc/41/64/85/458416485.db2.gz	BRYBJLKBCLHQSW-KDOFPFPSSA-N	0	3	325.387	3.349	20	30		EGEDHN
COc1ccccc1NC(=O)C[C@@H](C)NCc1ccc(C#N)c(F)c1	ZINC000449735905	458430213	/nfs/dbraw/zinc/43/02/13/458430213.db2.gz	KOICAOYXZIUERU-CYBMUJFWSA-N	0	3	341.386	3.213	20	30		EGEDHN
C[C@@H]1C[C@@]1(C#N)C(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000450162822	458440914	/nfs/dbraw/zinc/44/09/14/458440914.db2.gz	RCASUWLYPFAPRD-BEFAXECRSA-N	0	3	327.428	3.040	20	30		EGEDHN
C[C@H](c1ccccc1)[C@H](O)CN(C)CCOCc1ccc(C#N)cc1	ZINC000451037419	458463979	/nfs/dbraw/zinc/46/39/79/458463979.db2.gz	OZTSLVGWLTVROH-DYESRHJHSA-N	0	3	338.451	3.171	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCN(CCc3ccc(Cl)cc3)C2)nc1	ZINC000451060547	458464107	/nfs/dbraw/zinc/46/41/07/458464107.db2.gz	XDUOHJUQYOJUMV-KRWDZBQOSA-N	0	3	327.815	3.302	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN[C@H]1CCc2c1cccc2O	ZINC000451177807	458468984	/nfs/dbraw/zinc/46/89/84/458468984.db2.gz	XMPXRIKAFXSDNH-LPHOPBHVSA-N	0	3	339.435	3.138	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC(=O)N[C@H](CC)c1ccc(Cl)cc1	ZINC000451669398	458484379	/nfs/dbraw/zinc/48/43/79/458484379.db2.gz	AQPLRDZMWWHAMS-ZACQAIPSSA-N	0	3	336.863	3.231	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC(=O)N[C@@H](CC(C)C)c1ccccc1	ZINC000451676679	458485125	/nfs/dbraw/zinc/48/51/25/458485125.db2.gz	FSGOLVSEDUYGOB-QYZOEREBSA-N	0	3	330.472	3.213	20	30		EGEDHN
CC(C)Cc1ccc([C@H](CNC(=O)[C@]2(C#N)C[C@@H]2C)N(C)C)cc1	ZINC000451773888	458487459	/nfs/dbraw/zinc/48/74/59/458487459.db2.gz	NMNPZLZOYOYOOB-QSFXBCCZSA-N	0	3	327.472	3.154	20	30		EGEDHN
C=CCN1CC[C@H](N2CCC(Cc3cccc(F)c3F)CC2)C1=O	ZINC000451955002	458491929	/nfs/dbraw/zinc/49/19/29/458491929.db2.gz	CELMADRCCDPMDZ-KRWDZBQOSA-N	0	3	334.410	3.006	20	30		EGEDHN
OCCC[C@@H]1CCN(CC#Cc2ccc(OC(F)(F)F)cc2)C1	ZINC000452124821	458495388	/nfs/dbraw/zinc/49/53/88/458495388.db2.gz	RRAREANDWFFMSS-OAHLLOKOSA-N	0	3	327.346	3.031	20	30		EGEDHN
CN1C[C@H](NC(=O)C[C@@H](CC#N)c2ccccc2)[C@H](c2ccccc2)C1	ZINC000373534844	458522448	/nfs/dbraw/zinc/52/24/48/458522448.db2.gz	KNAQOOVNPDLGMH-HKBOAZHASA-N	0	3	347.462	3.288	20	30		EGEDHN
C=CCC[C@H](C(=O)N1CCCN(CCCOC)CC1)c1ccccc1	ZINC000373535721	458522518	/nfs/dbraw/zinc/52/25/18/458522518.db2.gz	SVACPWMKJMKAMS-FQEVSTJZSA-N	0	3	344.499	3.307	20	30		EGEDHN
C[C@H](c1ccc(C#N)c(F)c1)N1C[C@H]2C[C@H](Cn3c(=O)cccc32)C1	ZINC000453290721	458523622	/nfs/dbraw/zinc/52/36/22/458523622.db2.gz	USSYYKAGSKZGQY-JKIFEVAISA-N	0	3	337.398	3.039	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1N[C@H]1CCCc2oc(C(=O)OCC)c(C)c21	ZINC000453362613	458525196	/nfs/dbraw/zinc/52/51/96/458525196.db2.gz	RAJLSQHDEWVIRB-ILXRZTDVSA-N	0	3	333.428	3.465	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1cccc(OCc2ccc(F)cc2)c1	ZINC000424099170	458557755	/nfs/dbraw/zinc/55/77/55/458557755.db2.gz	MBNZQBTUOFTYGW-SFHVURJKSA-N	0	3	341.386	3.364	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1cccc(OCc2ccc(F)cc2)c1	ZINC000424099169	458558098	/nfs/dbraw/zinc/55/80/98/458558098.db2.gz	MBNZQBTUOFTYGW-GOSISDBHSA-N	0	3	341.386	3.364	20	30		EGEDHN
C[C@H](CNc1c(C#N)cnc2ccccc21)N1CCc2ccccc2C1	ZINC000461455527	458560954	/nfs/dbraw/zinc/56/09/54/458560954.db2.gz	ZLUHJTSGRXIUGK-MRXNPFEDSA-N	0	3	342.446	3.387	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N1CCc2cc(-c3cccc(F)c3)ccc21	ZINC000424118974	458563557	/nfs/dbraw/zinc/56/35/57/458563557.db2.gz	FDJZZUCTGJTEBC-GOSISDBHSA-N	0	3	337.398	3.403	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC[C@@H]2CCCCC2(F)F)CC1	ZINC000454471412	458563616	/nfs/dbraw/zinc/56/36/16/458563616.db2.gz	YLGAEHMRSOTGRS-AWEZNQCLSA-N	0	3	329.435	3.152	20	30		EGEDHN
C[C@@H](CCNC(=O)[C@@H](N)CCCC#N)c1cccc(C(F)(F)F)c1	ZINC000424126669	458564955	/nfs/dbraw/zinc/56/49/55/458564955.db2.gz	TWUCKHUEHFNKCI-WFASDCNBSA-N	0	3	341.377	3.336	20	30		EGEDHN
CC(C)COc1ccc(C(C)(C)NC(=O)[C@@H](N)CCCC#N)cc1	ZINC000424136012	458567924	/nfs/dbraw/zinc/56/79/24/458567924.db2.gz	KFRDDOCMUCPOCK-KRWDZBQOSA-N	0	3	331.460	3.094	20	30		EGEDHN
CC(C)(CNC(=O)[C@H](N)CCCC#N)c1c(Cl)cccc1Cl	ZINC000424142448	458568460	/nfs/dbraw/zinc/56/84/60/458568460.db2.gz	PUKMTUUYHFDEKA-CYBMUJFWSA-N	0	3	342.270	3.408	20	30		EGEDHN
CC(C)c1nccn1Cc1cccc(NC(=O)[C@@H](N)CCCC#N)c1	ZINC000424141099	458568765	/nfs/dbraw/zinc/56/87/65/458568765.db2.gz	WTTHKRFGTJUQQA-KRWDZBQOSA-N	0	3	339.443	3.014	20	30		EGEDHN
Cn1c2ccccc2nc1-c1ccc(NC(=O)[C@@H](N)CCCC#N)cc1	ZINC000424145767	458570396	/nfs/dbraw/zinc/57/03/96/458570396.db2.gz	ZJDFBMANZAOFKG-INIZCTEOSA-N	0	3	347.422	3.200	20	30		EGEDHN
CCc1c(NC(=O)[C@H](N)CCCC#N)cnn1-c1cccc(Cl)c1	ZINC000424194481	458581130	/nfs/dbraw/zinc/58/11/30/458581130.db2.gz	XOEQYDWLIIHREL-CQSZACIVSA-N	0	3	345.834	3.048	20	30		EGEDHN
CN(C[C@H]1CCCN(C)C1)C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000455701600	458607278	/nfs/dbraw/zinc/60/72/78/458607278.db2.gz	JXWYTTBQQMAULC-AWEZNQCLSA-N	0	3	334.851	3.212	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CCC[C@H]1c1ccc[nH]1	ZINC000438762260	458613882	/nfs/dbraw/zinc/61/38/82/458613882.db2.gz	VLUDFZVYYLJVNO-HKUYNNGSSA-N	0	3	326.440	3.320	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccc(N3CCCCCC3)nc2)nc(C)n1	ZINC000546864135	458682929	/nfs/dbraw/zinc/68/29/29/458682929.db2.gz	XBWFYPBQBWYODM-QGZVFWFLSA-N	0	3	349.438	3.359	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC1CCN(CCOc2ccc(F)cc2)CC1	ZINC000424671843	458703169	/nfs/dbraw/zinc/70/31/69/458703169.db2.gz	AHVDKODEJDQWCX-UHFFFAOYSA-N	0	3	348.462	3.387	20	30		EGEDHN
C=C(C)CN(Cc1ccccc1)C(=O)N[C@@H]1C[C@H](C)N(C2CC2)C1	ZINC000472036201	458762788	/nfs/dbraw/zinc/76/27/88/458762788.db2.gz	BWMUJSOHZNGVQJ-FUHWJXTLSA-N	0	3	327.472	3.400	20	30		EGEDHN
C=CCOc1cccc(NC(=O)NC[C@H](C)N2CCC[C@@H](C)C2)c1	ZINC000510718473	458776559	/nfs/dbraw/zinc/77/65/59/458776559.db2.gz	OHHDEAXJRIBVFH-CVEARBPZSA-N	0	3	331.460	3.493	20	30		EGEDHN
CC(C)Cc1ccc([C@@H](CNC(=O)N(C)C[C@H](C)C#N)N(C)C)cc1	ZINC000513397574	458793685	/nfs/dbraw/zinc/79/36/85/458793685.db2.gz	WBBABMAJTMIEJG-VQIMIIECSA-N	0	3	344.503	3.289	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NC[C@H]1CCOC2(CCC2)C1	ZINC000515464484	458809770	/nfs/dbraw/zinc/80/97/70/458809770.db2.gz	KVROVZSJGHCZID-ROUUACIJSA-N	0	3	326.440	3.224	20	30		EGEDHN
N#CCC1(CNC[C@@H](O)COc2cc(Cl)ccc2Cl)CC1	ZINC000516645771	458820675	/nfs/dbraw/zinc/82/06/75/458820675.db2.gz	QFDGYEUAOXDHBE-GFCCVEGCSA-N	0	3	329.227	3.017	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@H](NCc1cccc(C#N)c1F)C1CC1	ZINC000495271226	458823521	/nfs/dbraw/zinc/82/35/21/458823521.db2.gz	QESHJEYGJWMPRE-HNNXBMFYSA-N	0	3	333.407	3.090	20	30		EGEDHN
C=CCn1c(SC[C@@H]2CCN(C)C2)nnc1-c1cccc(OC)c1	ZINC000473797035	458843843	/nfs/dbraw/zinc/84/38/43/458843843.db2.gz	GOWRRZCSONCFGZ-CQSZACIVSA-N	0	3	344.484	3.184	20	30		EGEDHN
C=CCn1c(CC2CCCCC2)nnc1N1CC[C@@H](N2CCCC2)C1	ZINC000548853888	458875531	/nfs/dbraw/zinc/87/55/31/458875531.db2.gz	NBZOKXGNUOOKGU-GOSISDBHSA-N	0	3	343.519	3.261	20	30		EGEDHN
C=CCOCCNC1(c2cccc(Br)c2)CCOCC1	ZINC000555405335	458905805	/nfs/dbraw/zinc/90/58/05/458905805.db2.gz	POBUWPLNEDDGPQ-UHFFFAOYSA-N	0	3	340.261	3.247	20	30		EGEDHN
CN(CC(C)(C)C#N)C(=O)NC[C@H](c1cccs1)N1CCCC1	ZINC000457454246	458962292	/nfs/dbraw/zinc/96/22/92/458962292.db2.gz	KWFFFMNOTRMBPL-CQSZACIVSA-N	0	3	334.489	3.076	20	30		EGEDHN
CC(C)(CC#N)CNC(=O)NC[C@H](c1cccs1)N1CCCC1	ZINC000457486120	458974143	/nfs/dbraw/zinc/97/41/43/458974143.db2.gz	HQKVFYTVIRUYMM-CQSZACIVSA-N	0	3	334.489	3.124	20	30		EGEDHN
CC[C@H]1CCCCN1CCNC(=O)c1ccc(C(C)(C)C#N)cc1	ZINC000476039712	458976805	/nfs/dbraw/zinc/97/68/05/458976805.db2.gz	GXMRAWZPUGIWLV-SFHVURJKSA-N	0	3	327.472	3.482	20	30		EGEDHN
C[C@H](CC(=O)NCCc1ccccc1)N[C@@H](C)c1ccc(C#N)cc1	ZINC000531951468	459006855	/nfs/dbraw/zinc/00/68/55/459006855.db2.gz	BYPFGBFYWQJCMP-SJORKVTESA-N	0	3	335.451	3.346	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CCC(NC(=O)C2(C#N)CC(C)C2)CC1	ZINC000532065025	459024796	/nfs/dbraw/zinc/02/47/96/459024796.db2.gz	QTABOKULJFGECD-NGEICVOHSA-N	0	3	325.456	3.268	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N(C)C[C@@H]1CCCN(CC)[C@H]1c1cnn(C)c1	ZINC000442805921	459041236	/nfs/dbraw/zinc/04/12/36/459041236.db2.gz	AXNLYULAXPCANG-ILZDJORESA-N	0	3	346.519	3.254	20	30		EGEDHN
Cc1ccccc1C(C)(C)NC[C@H](O)COc1ccc(CC#N)cc1	ZINC000590192644	459099383	/nfs/dbraw/zinc/09/93/83/459099383.db2.gz	LRLFCXLUQLYZDL-SFHVURJKSA-N	0	3	338.451	3.326	20	30		EGEDHN
N#Cc1cc(Br)cnc1N[C@@H]1CCCN2CCCC[C@H]12	ZINC000594601874	459106396	/nfs/dbraw/zinc/10/63/96/459106396.db2.gz	PFHICTBWPRPUPE-ZIAGYGMSSA-N	0	3	335.249	3.145	20	30		EGEDHN
Cc1cc(C#N)cnc1C(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000590294905	459109791	/nfs/dbraw/zinc/10/97/91/459109791.db2.gz	TVXZVLOWRINPED-LPHOPBHVSA-N	0	3	348.450	3.045	20	30		EGEDHN
C[C@@H]1C[C@@H]1N1CCN(C(=O)c2ccc(C#N)c(Cl)c2)C[C@@H](C)C1	ZINC000558023223	459126302	/nfs/dbraw/zinc/12/63/02/459126302.db2.gz	IMOGADHUMIAZCE-AHIWAGSCSA-N	0	3	331.847	3.014	20	30		EGEDHN
N#Cc1ccc(CCN[C@@H](C(=O)N2CCCCC2)c2ccccc2)cc1	ZINC000594710125	459136476	/nfs/dbraw/zinc/13/64/76/459136476.db2.gz	IKDLPNWYLMVFCG-OAQYLSRUSA-N	0	3	347.462	3.444	20	30		EGEDHN
Cc1[nH]c(C#N)cc1C(=O)N[C@H](CN1CCCCC1)c1ccccc1	ZINC000590629111	459166521	/nfs/dbraw/zinc/16/65/21/459166521.db2.gz	NMVBCPQOYMYRSR-LJQANCHMSA-N	0	3	336.439	3.152	20	30		EGEDHN
CC(C)(C)N1CC[C@@H](N[C@@H]2CCCCc3cc(C#N)ccc32)C1=O	ZINC000567856163	459179062	/nfs/dbraw/zinc/17/90/62/459179062.db2.gz	DBLWLIRWWJGSQN-QZTJIDSGSA-N	0	3	325.456	3.315	20	30		EGEDHN
C[C@](C#N)(NC(=O)[C@@H]1CCN(Cc2ccccc2)C1)C1CCCCC1	ZINC000578336779	459185167	/nfs/dbraw/zinc/18/51/67/459185167.db2.gz	PJRITSSNSOTFPY-WIYYLYMNSA-N	0	3	339.483	3.487	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@H](NCc1ccc(C#N)cn1)C1CCCC1	ZINC000496440656	459193908	/nfs/dbraw/zinc/19/39/08/459193908.db2.gz	CLWAMRFCFZXNBP-KRWDZBQOSA-N	0	3	344.459	3.126	20	30		EGEDHN
COc1cc([N+](=O)[O-])ccc1[C@H](C)NCCc1ccc(C#N)cc1	ZINC000595056209	459230110	/nfs/dbraw/zinc/23/01/10/459230110.db2.gz	DHGOCWJITWQICA-ZDUSSCGKSA-N	0	3	325.368	3.368	20	30		EGEDHN
C[C@@H](CCC#N)N1CCC(OCCCNC(=O)OC(C)(C)C)CC1	ZINC000496559179	459238303	/nfs/dbraw/zinc/23/83/03/459238303.db2.gz	OKIJUWGLLLTYMX-HNNXBMFYSA-N	0	3	339.480	3.074	20	30		EGEDHN
C[C@@H](NC(=O)N1CCC(CC#N)CC1)[C@H](c1ccccc1)N(C)C	ZINC000580483788	459260711	/nfs/dbraw/zinc/26/07/11/459260711.db2.gz	OAJIKZJKBXYWAG-CRAIPNDOSA-N	0	3	328.460	3.013	20	30		EGEDHN
C=CCCSCCNC(=O)NC[C@H](N)c1ccc(C(C)C)cc1	ZINC000595267633	459265194	/nfs/dbraw/zinc/26/51/94/459265194.db2.gz	NRXNVTQXKDBIIY-KRWDZBQOSA-N	0	3	335.517	3.418	20	30		EGEDHN
N#CCCNc1cccc(N2CCN(CCc3ccccc3)CC2)c1	ZINC000580948397	459266696	/nfs/dbraw/zinc/26/66/96/459266696.db2.gz	XPQXIYRBAHLBRO-UHFFFAOYSA-N	0	3	334.467	3.377	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)N1CCC[C@H](CC#N)C1)c1ccccc1	ZINC000595428288	459298427	/nfs/dbraw/zinc/29/84/27/459298427.db2.gz	XBSBNGZIBHUKPI-IEBWSBKVSA-N	0	3	342.487	3.405	20	30		EGEDHN
N#C[C@@H]1CC[C@H](N[C@H]2CCCN(c3ccc(OC(F)F)cc3)C2=O)C1	ZINC000582097038	459307077	/nfs/dbraw/zinc/30/70/77/459307077.db2.gz	SQUMQVROSPYTPR-WWGRRREGSA-N	0	3	349.381	3.065	20	30		EGEDHN
C=CCCCCCN(C)C(=O)[C@H]1CCCN(Cc2cccnc2)C1	ZINC000523538174	459311665	/nfs/dbraw/zinc/31/16/65/459311665.db2.gz	UXEPGOHADZGMGB-IBGZPJMESA-N	0	3	329.488	3.498	20	30		EGEDHN
C=CCC1(CNC(=O)N2C[C@@H](c3ccccc3)[C@H](N)C2)CCCC1	ZINC000568609278	459315626	/nfs/dbraw/zinc/31/56/26/459315626.db2.gz	KSNQVGHDCHIICP-ZWKOTPCHSA-N	0	3	327.472	3.259	20	30		EGEDHN
N#CCC[C@H](NC(=O)NCc1ccc2c(c1)CNC2)c1ccccc1	ZINC000591355251	459360475	/nfs/dbraw/zinc/36/04/75/459360475.db2.gz	IPMKMWHYGJMRGU-IBGZPJMESA-N	0	3	334.423	3.134	20	30		EGEDHN
COc1ccc(Cl)cc1NC(=O)CCN1CCC[C@H](CC#N)C1	ZINC000595612258	459366825	/nfs/dbraw/zinc/36/68/25/459366825.db2.gz	UMXHOXOLSFREAS-CYBMUJFWSA-N	0	3	335.835	3.303	20	30		EGEDHN
CC[C@H](CN1CCCC1)NC(=O)N[C@H]1CCCc2cc(C#N)ccc21	ZINC000591391205	459369201	/nfs/dbraw/zinc/36/92/01/459369201.db2.gz	QMMYBPIVYWSLQA-MJGOQNOKSA-N	0	3	340.471	3.109	20	30		EGEDHN
C=CCN(C(=O)NC[C@H](CC)N1CCc2ccccc2C1)C1CC1	ZINC000540059995	459379864	/nfs/dbraw/zinc/37/98/64/459379864.db2.gz	RPZUVBRTWQQQRN-SFHVURJKSA-N	0	3	327.472	3.183	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@H](N[C@@H]3CCc4c3cccc4F)C2=O)cc1	ZINC000540953410	459409647	/nfs/dbraw/zinc/40/96/47/459409647.db2.gz	BDFYAHSMYXUCSW-UXHICEINSA-N	0	3	349.409	3.470	20	30		EGEDHN
C=CCN(CC(=O)NC(=O)Nc1ccccc1)CC1CCCCC1	ZINC000484513908	459416924	/nfs/dbraw/zinc/41/69/24/459416924.db2.gz	LBMWQDAECUSMSZ-UHFFFAOYSA-N	0	3	329.444	3.403	20	30		EGEDHN
CC(C)(CC#N)CNC[C@@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000591770363	459432474	/nfs/dbraw/zinc/43/24/74/459432474.db2.gz	XPTNYAPPFZIVGW-LLVKDONJSA-N	0	3	331.243	3.263	20	30		EGEDHN
C=CCC1(NCc2nc3cc(C(=O)OC)ccc3c(=O)[nH]2)CCCC1	ZINC000595780253	459437620	/nfs/dbraw/zinc/43/76/20/459437620.db2.gz	NHUJRTWHLYTHTK-UHFFFAOYSA-N	0	3	341.411	3.101	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)C(=O)N[C@@H](C)CN1CCC(C)CC1	ZINC000595786001	459440080	/nfs/dbraw/zinc/44/00/80/459440080.db2.gz	OUNMFAZYAAFJNE-DLBZAZTESA-N	0	3	342.487	3.381	20	30		EGEDHN
C[C@@]1(NCC#Cc2ccc(OC(F)(F)F)cc2)CCO[C@@H]1C1CC1	ZINC000541384350	459451274	/nfs/dbraw/zinc/45/12/74/459451274.db2.gz	UILOMVBSXSDTGF-IAGOWNOFSA-N	0	3	339.357	3.484	20	30		EGEDHN
CCN(CCOc1ccccc1OC)Cc1ccc(OC)c(C#N)c1	ZINC000595883891	459473483	/nfs/dbraw/zinc/47/34/83/459473483.db2.gz	COHGCGRLGOZDLN-UHFFFAOYSA-N	0	3	340.423	3.476	20	30		EGEDHN
CCCN(C(=O)N[C@H]1CCCc2cc(C#N)ccc21)[C@H]1CCN(C)C1	ZINC000592034442	459515169	/nfs/dbraw/zinc/51/51/69/459515169.db2.gz	MIJAAQWKNLQPOW-HKUYNNGSSA-N	0	3	340.471	3.061	20	30		EGEDHN
N#CC[C@H]1CCCN(C(=O)NC[C@H](c2ccccc2)N2CCCC2)C1	ZINC000596089397	459515992	/nfs/dbraw/zinc/51/59/92/459515992.db2.gz	ZOYLKAJQAUBFIM-IEBWSBKVSA-N	0	3	340.471	3.159	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(C)n(CC(F)(F)F)c2C)CC1	ZINC000592069463	459519540	/nfs/dbraw/zinc/51/95/40/459519540.db2.gz	QRKILLKDLKCFET-UHFFFAOYSA-N	0	3	343.393	3.047	20	30		EGEDHN
C[C@@H](NC(C)(C)CNC(=O)c1ccc(C#N)s1)c1ccccc1	ZINC000487339124	459528869	/nfs/dbraw/zinc/52/88/69/459528869.db2.gz	XXXMPHIWCXNFSZ-CYBMUJFWSA-N	0	3	327.453	3.479	20	30		EGEDHN
C=CCCCCCN1CCCN(Cc2ccc(OC)cc2)C(=O)C1	ZINC000488001229	459536628	/nfs/dbraw/zinc/53/66/28/459536628.db2.gz	IPVVBGJMJXZKSJ-UHFFFAOYSA-N	0	3	330.472	3.476	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N1CC[C@@H](C(=O)NCc2ccccc2)C1	ZINC000592154777	459537398	/nfs/dbraw/zinc/53/73/98/459537398.db2.gz	JLZXXECIRAGKNB-OXQOHEQNSA-N	0	3	333.435	3.258	20	30		EGEDHN
CC1CCN([C@@H](CNC(=O)NCC2(C#N)CC2)c2ccccc2)CC1	ZINC000562388067	459551408	/nfs/dbraw/zinc/55/14/08/459551408.db2.gz	BGBFBRXBYLFIHH-SFHVURJKSA-N	0	3	340.471	3.063	20	30		EGEDHN
COc1ccc([C@H](CCC#N)NC[C@@H](CO)Cc2ccco2)cc1	ZINC000562499115	459572150	/nfs/dbraw/zinc/57/21/50/459572150.db2.gz	YUZISRUPVKFRRL-KXBFYZLASA-N	0	3	328.412	3.074	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H](CC(F)(F)F)c2ccccc2)CC1	ZINC000490594558	459580506	/nfs/dbraw/zinc/58/05/06/459580506.db2.gz	SMTACWHUDCTKKX-INIZCTEOSA-N	0	3	338.373	3.142	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC2CC(C)(c3ccccc3)C2)CC1	ZINC000542838584	459602223	/nfs/dbraw/zinc/60/22/23/459602223.db2.gz	LEOVGARGAROPLG-UHFFFAOYSA-N	0	3	341.499	3.446	20	30		EGEDHN
C#C[C@H](NC(=O)N[C@@H](C)C1=CCN(C)CC1)c1ccc(Cl)cc1F	ZINC000491220041	459606067	/nfs/dbraw/zinc/60/60/67/459606067.db2.gz	JSOFEGKNZALHBF-SJCJKPOMSA-N	0	3	349.837	3.103	20	30		EGEDHN
C#C[C@@H](NC[C@@H](C)c1ccc(S(C)(=O)=O)cc1)c1ccc(F)cc1	ZINC000491371555	459621153	/nfs/dbraw/zinc/62/11/53/459621153.db2.gz	FNEJUHTVXBVFTB-AUUYWEPGSA-N	0	3	345.439	3.297	20	30		EGEDHN
C=CCN(CCc1ccco1)C[C@@H](O)COc1ccc(C)cc1C	ZINC000491424977	459625976	/nfs/dbraw/zinc/62/59/76/459625976.db2.gz	YFKNJDHWEKJZRF-GOSISDBHSA-N	0	3	329.440	3.367	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN1CCC[C@H](c2ccncc2)C1	ZINC000562705644	459628101	/nfs/dbraw/zinc/62/81/01/459628101.db2.gz	ABDPDOZBOFREBF-INIZCTEOSA-N	0	3	340.452	3.223	20	30		EGEDHN
N#Cc1cc2c(nc1NCC1CCN(Cc3ccncc3)CC1)CCC2	ZINC000596442955	459637927	/nfs/dbraw/zinc/63/79/27/459637927.db2.gz	VOYVVSNKTWIBLR-UHFFFAOYSA-N	0	3	347.466	3.161	20	30		EGEDHN
C[C@@H]1C[C@H]1[C@H](NCC(=O)NC1(C#N)CCC1)c1ccc(Cl)cc1	ZINC000527385146	459639864	/nfs/dbraw/zinc/63/98/64/459639864.db2.gz	AJVVDQWFSMLVMB-SRCQZFHVSA-N	0	3	331.847	3.189	20	30		EGEDHN
C=CCN1CC[C@@H](N2CC[C@H](Cc3ccc(C(C)C)cc3)C2)C1=O	ZINC000499635572	459642941	/nfs/dbraw/zinc/64/29/41/459642941.db2.gz	YCFHQAGFCIFFDU-UYAOXDASSA-N	0	3	326.484	3.461	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H]2C[C@H](C)C[C@@H](c3ccccc3)C2)CC1	ZINC000491771759	459669997	/nfs/dbraw/zinc/66/99/97/459669997.db2.gz	PHWDLSLYCWRCHL-DUXKGJEZSA-N	0	3	338.495	3.420	20	30		EGEDHN
C#CCN1CCC(C(=O)NC23CCC(C(F)(F)F)(CC2)CC3)CC1	ZINC000491793140	459675589	/nfs/dbraw/zinc/67/55/89/459675589.db2.gz	JJAIJXJBPNVPSS-UHFFFAOYSA-N	0	3	342.405	3.103	20	30		EGEDHN
C[C@@H](CCNCCS(=O)(=O)c1ccc(C#N)cc1)CC(C)(C)C	ZINC000563012491	459696266	/nfs/dbraw/zinc/69/62/66/459696266.db2.gz	ZILBVAZGULLKQP-HNNXBMFYSA-N	0	3	336.501	3.384	20	30		EGEDHN
C=CCc1cc(CNCCc2nnc(C(C)C)s2)cc(OC)c1O	ZINC000492398576	459703405	/nfs/dbraw/zinc/70/34/05/459703405.db2.gz	MYXWJROKNQDXBK-UHFFFAOYSA-N	0	3	347.484	3.437	20	30		EGEDHN
CN(C)CCN(Cc1ccsc1)C(=O)/C=C/c1cccc(C#N)c1	ZINC000493151735	459735090	/nfs/dbraw/zinc/73/50/90/459735090.db2.gz	JUFGKVPQVKNOIY-VOTSOKGWSA-N	0	3	339.464	3.223	20	30		EGEDHN
CC(C)O[C@@H]1CCCN(Cc2cn(C)nc2-c2ccc(C#N)cc2)C1	ZINC000593054007	459757313	/nfs/dbraw/zinc/75/73/13/459757313.db2.gz	RBRSIWBBDOCLCI-LJQANCHMSA-N	0	3	338.455	3.348	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CCC(OC2CCC2)CC1	ZINC000563517197	459765926	/nfs/dbraw/zinc/76/59/26/459765926.db2.gz	GEJCCBSAJUIGJP-QGZVFWFLSA-N	0	3	326.440	3.319	20	30		EGEDHN
CCC(C#N)(CC)C(=O)NC[C@H]1CCCN(Cc2cccs2)C1	ZINC000528317963	459802991	/nfs/dbraw/zinc/80/29/91/459802991.db2.gz	UBAGZNZUVNHOBO-OAHLLOKOSA-N	0	3	333.501	3.406	20	30		EGEDHN
CC[C@@H]1c2ccsc2CCN1C[C@@H](O)COc1ccccc1C#N	ZINC000528353524	459803497	/nfs/dbraw/zinc/80/34/97/459803497.db2.gz	UDRJTZRWYCPXSF-NVXWUHKLSA-N	0	3	342.464	3.369	20	30		EGEDHN
CC(C)[C@H]1CN(Cc2ccccc2)CCN1Cc1ccc(C#N)cn1	ZINC000528608547	459811295	/nfs/dbraw/zinc/81/12/95/459811295.db2.gz	OJIFAJVDTOEYRA-OAQYLSRUSA-N	0	3	334.467	3.296	20	30		EGEDHN
Cc1cccc(CCN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)n1	ZINC000566156589	459816266	/nfs/dbraw/zinc/81/62/66/459816266.db2.gz	HGLZUEGVQXZVOX-UHFFFAOYSA-N	0	3	348.450	3.155	20	30		EGEDHN
C[C@H]1O[C@@H](C)[C@H](C)[C@H]1C(=O)C(C#N)c1nc(-c2ccncc2)cs1	ZINC000528932581	459818231	/nfs/dbraw/zinc/81/82/31/459818231.db2.gz	HSLVBRTYMJKGFM-KGBXLTSLSA-N	0	3	341.436	3.441	20	30		EGEDHN
C[C@H](CN1CCC(C)CC1)NC(=O)C[C@@H](CC#N)c1ccccc1	ZINC000598261303	459842146	/nfs/dbraw/zinc/84/21/46/459842146.db2.gz	QASOSMWSCGYSSW-IEBWSBKVSA-N	0	3	327.472	3.311	20	30		EGEDHN
COCc1ccc(NC(=O)[C@H]2CCCN2C2CCCC2)cc1C#N	ZINC000529816228	459850554	/nfs/dbraw/zinc/85/05/54/459850554.db2.gz	KHZDGSUGJSPKQG-GOSISDBHSA-N	0	3	327.428	3.050	20	30		EGEDHN
C[C@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccc2c(c1)OCC(=O)N2	ZINC000586793868	459875125	/nfs/dbraw/zinc/87/51/25/459875125.db2.gz	JMHZVYBSBFQYIC-YVEFUNNKSA-N	0	3	333.391	3.227	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CCc2nc(C3CC3)ncc2C1	ZINC000529925808	459880294	/nfs/dbraw/zinc/88/02/94/459880294.db2.gz	MTFOVJAUAKBHMK-KRWDZBQOSA-N	0	3	346.434	3.011	20	30		EGEDHN
N#Cc1ccc(CNC(=O)CN2CCC[C@H](c3ccccc3)CC2)cc1	ZINC000608977448	459897590	/nfs/dbraw/zinc/89/75/90/459897590.db2.gz	LACPZAWXLNQNEE-NRFANRHFSA-N	0	3	347.462	3.444	20	30		EGEDHN
CC[C@H](C#N)C(=O)N1CC[C@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000593500730	459907605	/nfs/dbraw/zinc/90/76/05/459907605.db2.gz	SHQRTTBKHQOCTL-UYAOXDASSA-N	0	3	325.456	3.051	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)CCCCCC#N	ZINC000588160347	459921505	/nfs/dbraw/zinc/92/15/05/459921505.db2.gz	GWLNNBSWHUHNSS-PKOBYXMFSA-N	0	3	327.472	3.487	20	30		EGEDHN
C[C@@H](CCC#N)CN1CCN(c2c(C#N)cnc3ccccc32)CC1	ZINC000602453208	459945578	/nfs/dbraw/zinc/94/55/78/459945578.db2.gz	GRNQVKATOLFLDC-INIZCTEOSA-N	0	3	333.439	3.168	20	30		EGEDHN
N#CCCCCCC(=O)NCC1(N2CCSCC2)CCCCC1	ZINC000588362261	459951624	/nfs/dbraw/zinc/95/16/24/459951624.db2.gz	LDTYWEDVECSZSL-UHFFFAOYSA-N	0	3	337.533	3.328	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN1CCC(Oc2ccc(F)cc2F)CC1	ZINC000598586710	459953659	/nfs/dbraw/zinc/95/36/59/459953659.db2.gz	WXQCPZNKRBRVCX-CQSZACIVSA-N	0	3	338.398	3.109	20	30		EGEDHN
CC(C)Oc1cc(CN(C[C@H](O)CC(C)(C)C#N)C2CC2)ccn1	ZINC000598596856	459957504	/nfs/dbraw/zinc/95/75/04/459957504.db2.gz	MNOWIFORCMAGTF-QGZVFWFLSA-N	0	3	331.460	3.134	20	30		EGEDHN
Cc1cc(Br)ccc1CN(C)C[C@@H](O)CC(C)(C)C#N	ZINC000598610260	459962751	/nfs/dbraw/zinc/96/27/51/459962751.db2.gz	MNRVIKVAVKLUKM-HNNXBMFYSA-N	0	3	339.277	3.490	20	30		EGEDHN
CCCN(C[C@@H](O)CC(C)(C)C#N)[C@H](C)C(=O)Nc1ccccc1C	ZINC000598612927	459963492	/nfs/dbraw/zinc/96/34/92/459963492.db2.gz	FROHFGRLBMSVBS-SJORKVTESA-N	0	3	345.487	3.335	20	30		EGEDHN
C[C@H](NC1CCN(Cc2cccc(C#N)c2)CC1)c1cc2n(n1)CCC2	ZINC000593724262	459964446	/nfs/dbraw/zinc/96/44/46/459964446.db2.gz	BTLVVSLRANZYMW-INIZCTEOSA-N	0	3	349.482	3.016	20	30		EGEDHN
C[C@@H]1CN(c2cccc(Cl)c2)CCN1C[C@H](O)CC(C)(C)C#N	ZINC000598618301	459965019	/nfs/dbraw/zinc/96/50/19/459965019.db2.gz	OOIVIDFYOHPPFP-RHSMWYFYSA-N	0	3	335.879	3.151	20	30		EGEDHN
C[C@@H](CC1(C#N)CCOCC1)NCc1ccc(Cn2cccn2)cc1	ZINC000602497825	459969730	/nfs/dbraw/zinc/96/97/30/459969730.db2.gz	ARTUYWNFDUWCNJ-KRWDZBQOSA-N	0	3	338.455	3.120	20	30		EGEDHN
CCOc1ccc(CCNCc2cccc(C#N)n2)cc1OCC	ZINC000602499703	459971527	/nfs/dbraw/zinc/97/15/27/459971527.db2.gz	SXCPZWOVMXLBSX-UHFFFAOYSA-N	0	3	325.412	3.083	20	30		EGEDHN
N#Cc1nc(C2CC2)oc1N1CCN(c2ccnc3ccccc32)CC1	ZINC000609560099	459982116	/nfs/dbraw/zinc/98/21/16/459982116.db2.gz	ULIWJLIREJVNRM-UHFFFAOYSA-N	0	3	345.406	3.298	20	30		EGEDHN
C[C@@H](CC1(C#N)CCOCC1)NCCc1nc(C(F)(F)F)cs1	ZINC000602556908	459995797	/nfs/dbraw/zinc/99/57/97/459995797.db2.gz	GURZHPDFJVVEQC-NSHDSACASA-N	0	3	347.406	3.393	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CNCc1cccnc1Oc1cccc(F)c1	ZINC000598713454	460003222	/nfs/dbraw/zinc/00/32/22/460003222.db2.gz	CDSZDHKQMMDSEV-MRXNPFEDSA-N	0	3	343.402	3.403	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CNCc1ccc(Oc2cccc(F)c2)nc1	ZINC000598718688	460004496	/nfs/dbraw/zinc/00/44/96/460004496.db2.gz	CKFSFNRLUARARU-MRXNPFEDSA-N	0	3	343.402	3.403	20	30		EGEDHN
COCCOCc1ccc(CN[C@@H]2CCc3cc(C#N)ccc32)cc1	ZINC000588926075	460006100	/nfs/dbraw/zinc/00/61/00/460006100.db2.gz	YSDSBHPZOHSQFS-OAQYLSRUSA-N	0	3	336.435	3.498	20	30		EGEDHN
CC(C)(C)[C@H]1CCCN(CC(=O)NCc2ccc(C#N)cc2)CC1	ZINC000609706170	460009251	/nfs/dbraw/zinc/00/92/51/460009251.db2.gz	SFFILPCIXIHMOE-SFHVURJKSA-N	0	3	327.472	3.323	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1CCN(C)C	ZINC000594010426	460054374	/nfs/dbraw/zinc/05/43/74/460054374.db2.gz	DYVHSLNEYWJAIQ-INIZCTEOSA-N	0	3	335.451	3.480	20	30		EGEDHN
CCCN(CCN1CCCC1)C(=O)[C@H](C)Cc1ccc(C#N)cc1	ZINC000594023276	460060411	/nfs/dbraw/zinc/06/04/11/460060411.db2.gz	PGFVKOZBEQTELN-QGZVFWFLSA-N	0	3	327.472	3.071	20	30		EGEDHN
CC(C)CN(C(=O)[C@@H](C)Cc1ccc(C#N)cc1)C1CCN(C)CC1	ZINC000594031382	460063889	/nfs/dbraw/zinc/06/38/89/460063889.db2.gz	ZOGHQLVWMXVHJU-KRWDZBQOSA-N	0	3	341.499	3.316	20	30		EGEDHN
CC[C@H](N[C@@H]1CCN(C(=O)C2CCCC2)C1)c1ccc(C#N)cc1	ZINC000618571415	460067065	/nfs/dbraw/zinc/06/70/65/460067065.db2.gz	MMMXKBBCPVVSDT-MOPGFXCFSA-N	0	3	325.456	3.390	20	30		EGEDHN
Cc1cccc(C)c1OC[C@@H](O)CN[C@@H]1CCc2ccc(C#N)cc21	ZINC000589338038	460076033	/nfs/dbraw/zinc/07/60/33/460076033.db2.gz	PYNXVRIEMCEFIH-AZUAARDMSA-N	0	3	336.435	3.192	20	30		EGEDHN
CN(C[C@H](O)COc1ccccc1C(F)(F)F)CC1(CC#N)CC1	ZINC000602783615	460122744	/nfs/dbraw/zinc/12/27/44/460122744.db2.gz	QWBWLUNHGZWUSR-ZDUSSCGKSA-N	0	3	342.361	3.071	20	30		EGEDHN
Cc1cc(C#N)ccc1CN(C)Cc1ccc(C(=O)NC2CC2)cc1	ZINC000614402774	460130067	/nfs/dbraw/zinc/13/00/67/460130067.db2.gz	HZIREPNWNZKGRR-UHFFFAOYSA-N	0	3	333.435	3.391	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCC(c2nnc3n2CCCC3)CC1	ZINC000614406759	460132704	/nfs/dbraw/zinc/13/27/04/460132704.db2.gz	QGRIHMKNUVABMN-UHFFFAOYSA-N	0	3	335.455	3.174	20	30		EGEDHN
C[C@H](CNC(=O)N[C@H]1CCc2cc(C#N)ccc21)N1CCCC[C@H]1C	ZINC000618797755	460179242	/nfs/dbraw/zinc/17/92/42/460179242.db2.gz	TXNYEMFMFHEZCI-CLCXKQKWSA-N	0	3	340.471	3.108	20	30		EGEDHN
CC(C)C[C@@H](CN1CCCC1)NC(=O)[C@@H](C)Cc1ccc(C#N)cc1	ZINC000594365498	460196506	/nfs/dbraw/zinc/19/65/06/460196506.db2.gz	PIRPNPSCOXELLU-PXNSSMCTSA-N	0	3	341.499	3.364	20	30		EGEDHN
N#CCCCC[C@H](N)C(=O)N1CC2(CCCC2)c2c1cccc2F	ZINC000594438528	460219700	/nfs/dbraw/zinc/21/97/00/460219700.db2.gz	OHTKMEFGEYJQON-HNNXBMFYSA-N	0	3	329.419	3.395	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(c3ccc(F)cc3F)C2)c(F)c1	ZINC000610946879	460264423	/nfs/dbraw/zinc/26/44/23/460264423.db2.gz	HZXBVGIUGSQVTD-OAHLLOKOSA-N	0	3	331.341	3.344	20	30		EGEDHN
COCc1cc(C#N)ccc1NC[C@H](c1cccc(OC)c1)N(C)C	ZINC000603271815	460274858	/nfs/dbraw/zinc/27/48/58/460274858.db2.gz	COOFJYGAZRXJEW-HXUWFJFHSA-N	0	3	339.439	3.428	20	30		EGEDHN
CC#CC[C@@H](CO)NCc1cccc(OCc2ccccc2C#N)c1	ZINC000603434093	460304522	/nfs/dbraw/zinc/30/45/22/460304522.db2.gz	ZRTNCLDTGSIYKN-FQEVSTJZSA-N	0	3	334.419	3.001	20	30		EGEDHN
N#Cc1ccc(CN(Cc2ccccc2-n2cncn2)C2CC2)cc1	ZINC000611254262	460318083	/nfs/dbraw/zinc/31/80/83/460318083.db2.gz	IGBIQNJTKUSXPL-UHFFFAOYSA-N	0	3	329.407	3.304	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2NCc1cccnc1-n1cccn1	ZINC000611390661	460352663	/nfs/dbraw/zinc/35/26/63/460352663.db2.gz	NCAUYXMNCGGZPB-LJQANCHMSA-N	0	3	329.407	3.306	20	30		EGEDHN
CCNC(=O)c1cccc(CN[C@H]2CCCc3cc(C#N)ccc32)c1	ZINC000611392560	460354137	/nfs/dbraw/zinc/35/41/37/460354137.db2.gz	WBDQRKWOKGWGRX-FQEVSTJZSA-N	0	3	333.435	3.475	20	30		EGEDHN
C[C@H](Cc1cccs1)N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000611559850	460398895	/nfs/dbraw/zinc/39/88/95/460398895.db2.gz	BEVNTGQKMLGXLO-KDOFPFPSSA-N	0	3	339.464	3.336	20	30		EGEDHN
C=C[C@@H](NCc1ccccc1-c1ccc(CN(C)C)cc1)C(=O)OC	ZINC000619700491	460418536	/nfs/dbraw/zinc/41/85/36/460418536.db2.gz	ZBZATYHKWLMMGQ-HXUWFJFHSA-N	0	3	338.451	3.232	20	30		EGEDHN
C=CCSCCNC(=O)N1CCCN(Cc2ccccc2C)CC1	ZINC000604488793	460433223	/nfs/dbraw/zinc/43/32/23/460433223.db2.gz	SIVJFVNAFRJZBF-UHFFFAOYSA-N	0	3	347.528	3.132	20	30		EGEDHN
N#CCc1ccccc1C(=O)NC[C@@H]1CCCN1Cc1ccccc1	ZINC000601179189	460742400	/nfs/dbraw/zinc/74/24/00/460742400.db2.gz	OIBLSRSSLGMUQD-IBGZPJMESA-N	0	3	333.435	3.147	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)c2ccccc2CC#N)CN1Cc1ccccc1	ZINC000601308911	460784088	/nfs/dbraw/zinc/78/40/88/460784088.db2.gz	GXAXSSBBMGCZSL-QFBILLFUSA-N	0	3	333.435	3.145	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)c1ccccc1CC#N	ZINC000601447107	460813705	/nfs/dbraw/zinc/81/37/05/460813705.db2.gz	HIZYMCMXAAHSED-OXQOHEQNSA-N	0	3	333.435	3.003	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2NCCn1ccc(C(F)(F)F)n1	ZINC000601962657	460963544	/nfs/dbraw/zinc/96/35/44/460963544.db2.gz	HLRRSZBXOIXLCW-OAHLLOKOSA-N	0	3	334.345	3.441	20	30		EGEDHN
CC#CC[C@@H](CO)NCC1=Cc2cc(Cl)cc(Cl)c2OC1	ZINC000641769652	461361853	/nfs/dbraw/zinc/36/18/53/461361853.db2.gz	XKSWGHNVOPWRLT-AWEZNQCLSA-N	0	3	326.223	3.133	20	30		EGEDHN
CC#CC[C@H](CO)NCc1ccc(OCc2ccccc2)c(OC)c1	ZINC000641768669	461362103	/nfs/dbraw/zinc/36/21/03/461362103.db2.gz	FTEWWIUZKFCOEX-LJQANCHMSA-N	0	3	339.435	3.138	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1CNCc1cc(OC)c(OC)cc1Cl	ZINC000631127761	461573355	/nfs/dbraw/zinc/57/33/55/461573355.db2.gz	VHUPBYZAGQCSRC-YVEFUNNKSA-N	0	3	325.836	3.428	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)N1CCNC2(CCCCC2)C1	ZINC000656364639	461718218	/nfs/dbraw/zinc/71/82/18/461718218.db2.gz	PBZIBTRMXKKACY-UHFFFAOYSA-N	0	3	344.455	3.008	20	30		EGEDHN
C=C(C)CN(Cc1ccccc1)Cc1ccc(S(=O)(=O)NC)cc1	ZINC000660445590	461783530	/nfs/dbraw/zinc/78/35/30/461783530.db2.gz	MAQWTCLUNOQTAH-UHFFFAOYSA-N	0	3	344.480	3.173	20	30		EGEDHN
C=CCCc1ccccc1NC(=O)NC1CCN([C@@H]2CCOC2)CC1	ZINC000667029014	461919220	/nfs/dbraw/zinc/91/92/20/461919220.db2.gz	NDWJARUQNBEHRU-GOSISDBHSA-N	0	3	343.471	3.180	20	30		EGEDHN
C=CCC1(NC(=O)NCC2CCN(c3ccncc3)CC2)CCCC1	ZINC000664576130	462113708	/nfs/dbraw/zinc/11/37/08/462113708.db2.gz	DPTMXKCHPXQCHO-UHFFFAOYSA-N	0	3	342.487	3.486	20	30		EGEDHN
C=CCN(C[C@@H](O)Cc1ccccc1C(F)(F)F)[C@H](C)COC	ZINC000661239688	462166385	/nfs/dbraw/zinc/16/63/85/462166385.db2.gz	INVLGIKEFBPEGZ-HIFRSBDPSA-N	0	3	331.378	3.132	20	30		EGEDHN
C=CCOCCCC(=O)N(C(C)C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000648566250	462180358	/nfs/dbraw/zinc/18/03/58/462180358.db2.gz	WXLYWAADBPJRBQ-FQEVSTJZSA-N	0	3	344.499	3.481	20	30		EGEDHN
C=CC[C@@H](CC)NC(=O)N1CC[C@@H](N(C)CCc2ccccc2)C1	ZINC000664809069	462196330	/nfs/dbraw/zinc/19/63/30/462196330.db2.gz	HMFYTKGOCYWPLJ-RTBURBONSA-N	0	3	329.488	3.300	20	30		EGEDHN
C=CC[C@H]1CCCN(CC(=O)NCc2ccc(COCC)cc2)C1	ZINC000661379726	462224575	/nfs/dbraw/zinc/22/45/75/462224575.db2.gz	HKAMSLQRZASHBQ-SFHVURJKSA-N	0	3	330.472	3.127	20	30		EGEDHN
C=CCN(C(=O)N[C@H](C)[C@@H](c1ccccc1C)N(C)C)[C@H](C)COC	ZINC000664870031	462224831	/nfs/dbraw/zinc/22/48/31/462224831.db2.gz	NXQFYYIBSRWNAN-LMMKCTJWSA-N	0	3	347.503	3.219	20	30		EGEDHN
C=CC(C)(C)CNC(=O)N1CC[C@H](N(C)CCc2ccccc2)C1	ZINC000665023228	462286128	/nfs/dbraw/zinc/28/61/28/462286128.db2.gz	LVIQEBCYIFSFNZ-SFHVURJKSA-N	0	3	329.488	3.157	20	30		EGEDHN
C=CCCNC(=O)N1CC[C@@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000661570545	462312654	/nfs/dbraw/zinc/31/26/54/462312654.db2.gz	HHBCORWXVLALBQ-FQEVSTJZSA-N	0	3	327.472	3.260	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cccc3c2cc[nH]c3=O)CC1	ZINC000640228627	462323583	/nfs/dbraw/zinc/32/35/83/462323583.db2.gz	CULBJPOABFUMLT-UHFFFAOYSA-N	0	3	340.427	3.102	20	30		EGEDHN
COC(=O)[C@@H](C)Oc1ccc(CN(C)Cc2ccc(C#N)cc2)cc1	ZINC000131202226	534231243	/nfs/dbraw/zinc/23/12/43/534231243.db2.gz	SPTVVRLBJTXSFJ-OAHLLOKOSA-N	0	3	338.407	3.131	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)[C@H](C)c2sc(C)nc2C)CC1	ZINC000171742059	526423557	/nfs/dbraw/zinc/42/35/57/526423557.db2.gz	FOYFBROBVOVFRV-CYBMUJFWSA-N	0	3	336.505	3.113	20	30		EGEDHN
C=CCN1CCC(N[C@H](C)c2nnn(-c3ccc(F)cc3)c2C)CC1	ZINC000177909628	526454301	/nfs/dbraw/zinc/45/43/01/526454301.db2.gz	KEELTKAFQRNEFC-CQSZACIVSA-N	0	3	343.450	3.016	20	30		EGEDHN
C#CCOc1ccc([C@@H](C)NC[C@H](O)c2cccc(OC)c2)cc1	ZINC000178083954	527115432	/nfs/dbraw/zinc/11/54/32/527115432.db2.gz	HKEZAIQKTBUNCG-QRWLVFNGSA-N	0	3	325.408	3.091	20	30		EGEDHN
CCOC[C@H]1CCN(CC#Cc2ccc(OC(F)(F)F)cc2)C1	ZINC000154270654	529030325	/nfs/dbraw/zinc/03/03/25/529030325.db2.gz	NJKIXSQSCOACQV-HNNXBMFYSA-N	0	3	327.346	3.295	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H]2C[C@H](OCC)C23CCCCC3)CC1	ZINC000078959146	546591516	/nfs/dbraw/zinc/59/15/16/546591516.db2.gz	HWINUEQVEXJQBV-MSOLQXFVSA-N	0	3	349.519	3.064	20	30		EGEDHN
COc1ccccc1NC(=O)[C@@H](C)N[C@@H]1CCC(=O)NC12CCC2	ZINC000328693315	547482131	/nfs/dbraw/zinc/48/21/31/547482131.db2.gz	JOFXZZZBIMIBMQ-IUODEOHRSA-N	0	3	331.416	3.303	20	30		EGEDHN
C[C@@H]1CC[C@@H](C)N1CC(=O)Nc1cccc([C@]2(C)NC(=O)NC2=O)c1	ZINC000329572622	547501875	/nfs/dbraw/zinc/50/18/75/547501875.db2.gz	NCITWYPTWRWCLS-FMTVUPSXSA-N	0	3	344.415	3.247	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)[C@]23CCC(=O)N2c2ccccc2S3)CCN1C	ZINC000329745509	547506872	/nfs/dbraw/zinc/50/68/72/547506872.db2.gz	YLCUJDHRZKCJNK-SNUQEOBHSA-N	0	3	345.468	3.055	20	30		EGEDHN
CN1CCCC(C)(C)[C@@H]1CNC(=O)c1cccc(SCC#N)c1	ZINC000344616889	547612349	/nfs/dbraw/zinc/61/23/49/547612349.db2.gz	NYURXFWHJRBGHH-INIZCTEOSA-N	0	3	331.485	3.152	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN2CC[C@@](CO)(c3ccccc3)C2)cc1	ZINC000365835899	547778745	/nfs/dbraw/zinc/77/87/45/547778745.db2.gz	GDYRPNHTSZENHO-LAUBAEHRSA-N	0	3	336.435	3.113	20	30		EGEDHN
CC1CCN(CCNC(=O)Nc2ccc(CC#N)cc2Cl)CC1	ZINC000455708314	547937987	/nfs/dbraw/zinc/93/79/87/547937987.db2.gz	SXFOASBDDFGBOT-UHFFFAOYSA-N	0	3	334.851	3.259	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)C(=O)N[C@@H](CC)CN1CCCC1	ZINC000675193333	548868857	/nfs/dbraw/zinc/86/88/57/548868857.db2.gz	BTLXTMHJYKWVNX-SFHVURJKSA-N	0	3	345.487	3.267	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2cnc(OC(C)C)c(Cl)c2)nc(C)n1	ZINC000678323897	549469049	/nfs/dbraw/zinc/46/90/49/549469049.db2.gz	VNKDWVLJVWXJPI-ZDUSSCGKSA-N	0	3	344.802	3.419	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)[C@@H]1Cc2ccc(F)cc21)C(C)C	ZINC000684441370	550330878	/nfs/dbraw/zinc/33/08/78/550330878.db2.gz	DWLRZWVXBSQIAP-RTBURBONSA-N	0	3	330.447	3.280	20	30		EGEDHN
CCC#C[C@@H](C)N1CC=C(CCN2C(=O)c3ccccc3C2=O)CC1	ZINC000684621442	550349891	/nfs/dbraw/zinc/34/98/91/550349891.db2.gz	PLUJIPNKERXTGV-MRXNPFEDSA-N	0	3	336.435	3.107	20	30		EGEDHN
C#Cc1ccc(C(=O)N(CC)[C@@H]2CCN([C@H](C)c3ccccc3)C2)nc1	ZINC000728861816	574779827	/nfs/dbraw/zinc/77/98/27/574779827.db2.gz	PSYHQWSGGGVCNE-YLJYHZDGSA-N	0	3	347.462	3.361	20	30		EGEDHN
C=C(C)CN1CCC(NC(=S)Nc2cc(OC)ccc2OC)CC1	ZINC000729942594	574897801	/nfs/dbraw/zinc/89/78/01/574897801.db2.gz	OPLFEPGUJKNNFZ-UHFFFAOYSA-N	0	3	349.500	3.031	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(F)c(Cl)c1)C(=O)C1CCSCC1	ZINC000733053647	575303728	/nfs/dbraw/zinc/30/37/28/575303728.db2.gz	PYQADKQDSMFBCN-NSHDSACASA-N	0	3	340.807	3.270	20	30		EGEDHN
N#CC(C(=O)CCc1cscn1)C(=O)Nc1ccccc1Cl	ZINC000733679069	575381321	/nfs/dbraw/zinc/38/13/21/575381321.db2.gz	SQUHSEAVSFWOFF-NSHDSACASA-N	0	3	333.800	3.077	20	30		EGEDHN
N#Cc1ccc(CC(=O)C(C#N)c2nc(-c3ccncc3)cs2)cc1	ZINC000734082127	575433435	/nfs/dbraw/zinc/43/34/35/575433435.db2.gz	XUOPXHJMPLNQLI-MRXNPFEDSA-N	0	3	344.399	3.496	20	30		EGEDHN
CC(C)[C@@H](C(=O)NCc1cccc(-c2ccc(C#N)s2)c1)N(C)C	ZINC000739749457	576503025	/nfs/dbraw/zinc/50/30/25/576503025.db2.gz	GIHNRYYMKMKLDE-SFHVURJKSA-N	0	3	341.480	3.489	20	30		EGEDHN
C#CCCN1CCC(NC(=O)C(C)(C)c2ccc(Cl)cc2)CC1	ZINC000740737281	576621768	/nfs/dbraw/zinc/62/17/68/576621768.db2.gz	JDBMYTRGPOTQTB-UHFFFAOYSA-N	0	3	332.875	3.222	20	30		EGEDHN
C[C@H](NCc1ccc(N(C)CCC#N)cc1)c1ccc2[nH]c(=O)[nH]c2c1	ZINC000740898052	576635155	/nfs/dbraw/zinc/63/51/55/576635155.db2.gz	MIRPODJLXASDKV-AWEZNQCLSA-N	0	3	349.438	3.469	20	30		EGEDHN
CC1(C)[C@@H]2CN(CC(=O)C(C#N)c3nc4ccccc4s3)C[C@@H]21	ZINC000741807253	576724242	/nfs/dbraw/zinc/72/42/42/576724242.db2.gz	YBHCPUVJUOVSDX-RWMBFGLXSA-N	0	3	325.437	3.060	20	30		EGEDHN
C=C(C)CN1CCC(NC(=S)N[C@H]2CCc3ccccc3C2)CC1	ZINC000742996215	576799108	/nfs/dbraw/zinc/79/91/08/576799108.db2.gz	AODNEXNKGZMSMY-IBGZPJMESA-N	0	3	343.540	3.049	20	30		EGEDHN
C#CCSCCNCc1cc(Cl)ccc1OC[C@H]1CCCO1	ZINC000743497092	576810460	/nfs/dbraw/zinc/81/04/60/576810460.db2.gz	GHZOWVPBFGYSOQ-MRXNPFEDSA-N	0	3	339.888	3.354	20	30		EGEDHN
CC(=CC(=O)C(C#N)C(=O)Nc1ccc2c(c1)OCCO2)C(C)(C)C	ZINC000744032641	576819269	/nfs/dbraw/zinc/81/92/69/576819269.db2.gz	UYGZZYFUPJFEGW-TZIYXEQSSA-N	0	3	342.395	3.098	20	30		EGEDHN
C#CCN(Cc1ccc(F)cc1)C(=O)N[C@H](C)CN1CCC[C@H](C)C1	ZINC000744857802	576835673	/nfs/dbraw/zinc/83/56/73/576835673.db2.gz	ZDGOYYLLWCBBLH-DLBZAZTESA-N	0	3	345.462	3.091	20	30		EGEDHN
N#Cc1ccc(C2=CC[N@H+](Cc3ccccc3-c3nnn[n-]3)CC2)cc1	ZINC000826384872	608460396	/nfs/dbraw/zinc/46/03/96/608460396.db2.gz	NAVFOWKIYPJSJL-UHFFFAOYSA-N	0	3	342.406	3.028	20	30		EGEDHN
N#Cc1ccc(C2=CC[N@@H+](Cc3ccccc3-c3nnn[n-]3)CC2)cc1	ZINC000826384872	608460397	/nfs/dbraw/zinc/46/03/97/608460397.db2.gz	NAVFOWKIYPJSJL-UHFFFAOYSA-N	0	3	342.406	3.028	20	30		EGEDHN
N#Cc1ccc(C2=CC[N@H+](Cc3ccccc3-c3nn[n-]n3)CC2)cc1	ZINC000826384872	608460399	/nfs/dbraw/zinc/46/03/99/608460399.db2.gz	NAVFOWKIYPJSJL-UHFFFAOYSA-N	0	3	342.406	3.028	20	30		EGEDHN
N#Cc1ccc(C2=CC[N@@H+](Cc3ccccc3-c3nn[n-]n3)CC2)cc1	ZINC000826384872	608460400	/nfs/dbraw/zinc/46/04/00/608460400.db2.gz	NAVFOWKIYPJSJL-UHFFFAOYSA-N	0	3	342.406	3.028	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)CCc1cc(F)ccc1F	ZINC000066506071	1292119673	/nfs/dbraw/zinc/11/96/73/1292119673.db2.gz	ZXDTUHDERSSOGI-OAHLLOKOSA-N	0	3	336.382	3.303	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@](C)(NCc2ccc(C#N)c(F)c2)C1	ZINC000827970745	1292412959	/nfs/dbraw/zinc/41/29/59/1292412959.db2.gz	JSSFNNWKQFTWEC-GOSISDBHSA-N	0	3	333.407	3.186	20	30		EGEDHN
Cc1cccc2c(CCC(=O)C(C#N)C(=O)NC3CCCC3)c[nH]c21	ZINC000076839170	1292445628	/nfs/dbraw/zinc/44/56/28/1292445628.db2.gz	ZYNTXCSRJLQFID-KRWDZBQOSA-N	0	3	337.423	3.177	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)CCc1cc(Cl)cs1	ZINC000077865636	1292488395	/nfs/dbraw/zinc/48/83/95/1292488395.db2.gz	CEOXPZVYLGSYPP-ZDUSSCGKSA-N	0	3	326.849	3.349	20	30		EGEDHN
N#CCOc1ccc(Cl)cc1CN1CCC[C@@H]1[C@@H]1CCC[C@@H]1O	ZINC000831154041	1292821589	/nfs/dbraw/zinc/82/15/89/1292821589.db2.gz	VESICWFOSNGTDX-BBWFWOEESA-N	0	3	334.847	3.368	20	30		EGEDHN
C#CCOc1ccc(Br)cc1CNC[C@@]1(C)CCCO1	ZINC000094797211	1292943746	/nfs/dbraw/zinc/94/37/46/1292943746.db2.gz	YFFUVHBLRCKRPF-MRXNPFEDSA-N	0	3	338.245	3.120	20	30		EGEDHN
C[C@@H](NC(=O)c1cc(C#N)ccc1F)[C@H](c1ccccc1)N(C)C	ZINC000832319941	1292988327	/nfs/dbraw/zinc/98/83/27/1292988327.db2.gz	NKCMXRLHVMAVRK-FZKQIMNGSA-N	0	3	325.387	3.119	20	30		EGEDHN
C=C(Br)CN[C@H]1CCN(C(=O)OC(C)(C)C)C1(C)C	ZINC000832645858	1293031816	/nfs/dbraw/zinc/03/18/16/1293031816.db2.gz	QVQCJBHDBKDUCV-NSHDSACASA-N	0	3	333.270	3.273	20	30		EGEDHN
N#CC(C(=O)COCC1CCCC1)C(=O)Nc1ccc(Cl)cc1	ZINC000835060904	1293196060	/nfs/dbraw/zinc/19/60/60/1293196060.db2.gz	OVAYCVRWOQAGEL-HNNXBMFYSA-N	0	3	334.803	3.194	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)C[C@H]1OCCc2ccccc21	ZINC000115902591	1293196299	/nfs/dbraw/zinc/19/62/99/1293196299.db2.gz	CURATDNICYEOMM-PKOBYXMFSA-N	0	3	342.439	3.096	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)CCCC(=O)C2CC2)cc1	ZINC000835062515	1293196747	/nfs/dbraw/zinc/19/67/47/1293196747.db2.gz	PICXGTHBHHWNPT-INIZCTEOSA-N	0	3	326.396	3.046	20	30		EGEDHN
CCC[C@@H](OC)C(=O)C(C#N)C(=O)Nc1c(CC)cccc1CC	ZINC000835062933	1293197095	/nfs/dbraw/zinc/19/70/95/1293197095.db2.gz	GRNGWMURQJNVOS-HZPDHXFCSA-N	0	3	330.428	3.274	20	30		EGEDHN
CC(=O)NC[C@H](CC(=O)C(C#N)c1nc2ccccc2o1)CC(C)C	ZINC000835077453	1293202720	/nfs/dbraw/zinc/20/27/20/1293202720.db2.gz	TVVKKQVDXNTVHC-GJZGRUSLSA-N	0	3	341.411	3.193	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)[C@@H]2CCCCO2)cc1	ZINC000121975762	1293398338	/nfs/dbraw/zinc/39/83/38/1293398338.db2.gz	JDGQECJMHKSRFS-IRXDYDNUSA-N	0	3	328.412	3.246	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)CCC(=O)c1cccs1	ZINC000122632090	1293419667	/nfs/dbraw/zinc/41/96/67/1293419667.db2.gz	LDXLCMFQXCAAOS-GFCCVEGCSA-N	0	3	337.404	3.474	20	30		EGEDHN
N#CC(C(=O)CCSc1ccc(F)cc1)C(=O)Nc1ccccn1	ZINC000125118419	1293496464	/nfs/dbraw/zinc/49/64/64/1293496464.db2.gz	ULVVLDPLNNMUGY-AWEZNQCLSA-N	0	3	343.383	3.050	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)COc1ccc(C)c(C)c1	ZINC000125588306	1293512025	/nfs/dbraw/zinc/51/20/25/1293512025.db2.gz	TUATWTGUZKIPCK-QGZVFWFLSA-N	0	3	330.428	3.088	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)c2cccs2)cc1Cl	ZINC000130279885	1293650361	/nfs/dbraw/zinc/65/03/61/1293650361.db2.gz	UVVCNZZDBYFNKD-JTQLQIEISA-N	0	3	334.784	3.371	20	30		EGEDHN
C=CCOc1ccc(CN2CCC[C@@H]2CC(=O)OCC)cc1OC	ZINC000130518888	1293660693	/nfs/dbraw/zinc/66/06/93/1293660693.db2.gz	CZTMPZLIBLMDRR-MRXNPFEDSA-N	0	3	333.428	3.178	20	30		EGEDHN
N#CC(C(=O)Cc1c(Cl)cccc1Cl)C(=O)Nc1ccccn1	ZINC000138989760	1293840027	/nfs/dbraw/zinc/84/00/27/1293840027.db2.gz	HESQHHXTSLATIM-NSHDSACASA-N	0	3	348.189	3.278	20	30		EGEDHN
CC[C@@H](C)OCC(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000152351231	1293965243	/nfs/dbraw/zinc/96/52/43/1293965243.db2.gz	RKLULJVBFVRTNC-KOLCDFICSA-N	0	3	343.210	3.456	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@H](C)Oc1ccc(SC)cc1	ZINC000158680253	1294211197	/nfs/dbraw/zinc/21/11/97/1294211197.db2.gz	ULRATGVGYUQHIC-BBRMVZONSA-N	0	3	348.468	3.191	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)[C@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1	ZINC000173984274	1294475520	/nfs/dbraw/zinc/47/55/20/1294475520.db2.gz	HUZSZXPRLFZXML-HZSPNIEDSA-N	0	3	339.222	3.330	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)C[C@@H](C)c1ccc(OC)cc1	ZINC000175096158	1294539346	/nfs/dbraw/zinc/53/93/46/1294539346.db2.gz	BKIXOJUGAGYYRX-RHSMWYFYSA-N	0	3	330.428	3.204	20	30		EGEDHN
CC[C@@H](CC#N)OC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1	ZINC000188093474	1295436568	/nfs/dbraw/zinc/43/65/68/1295436568.db2.gz	JYLPAGZXRXMXJW-SFHVURJKSA-N	0	3	329.444	3.066	20	30		EGEDHN
CCc1nc(CC(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)cs1	ZINC000193608979	1295890773	/nfs/dbraw/zinc/89/07/73/1295890773.db2.gz	LJNZWHSHTKFCOI-CYBMUJFWSA-N	0	3	347.827	3.249	20	30		EGEDHN
COc1ccc(OC)c(CC(=O)C(C#N)c2nc3ccccc3o2)c1	ZINC000193622072	1295893855	/nfs/dbraw/zinc/89/38/55/1295893855.db2.gz	GYERBFFCMAKVKB-CQSZACIVSA-N	0	3	336.347	3.264	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCCC[C@@H]1CNCc1cc(C#N)cs1	ZINC000224159709	1296134391	/nfs/dbraw/zinc/13/43/91/1296134391.db2.gz	DSXLXDCKJFFDBY-CQSZACIVSA-N	0	3	335.473	3.499	20	30		EGEDHN
C#CCOc1ccc(Br)cc1CNCC1(OC)CCC1	ZINC000227325430	1296141915	/nfs/dbraw/zinc/14/19/15/1296141915.db2.gz	DONLDOATACKJBH-UHFFFAOYSA-N	0	3	338.245	3.120	20	30		EGEDHN
C#CCOc1ccccc1CNC[C@H](c1c(F)cccc1F)N(C)C	ZINC000237020982	1296218457	/nfs/dbraw/zinc/21/84/57/1296218457.db2.gz	XRNLIUPFEKMWIT-GOSISDBHSA-N	0	3	344.405	3.369	20	30		EGEDHN
C#CCOc1ccccc1CNC[C@@H](C)Oc1ccccc1OC	ZINC000237159796	1296223136	/nfs/dbraw/zinc/22/31/36/1296223136.db2.gz	KEJXVMKCJLUUMM-MRXNPFEDSA-N	0	3	325.408	3.264	20	30		EGEDHN
C#CCOc1ccccc1CNC[C@@H](c1c(F)cccc1F)N(C)C	ZINC000237166686	1296225623	/nfs/dbraw/zinc/22/56/23/1296225623.db2.gz	XRNLIUPFEKMWIT-SFHVURJKSA-N	0	3	344.405	3.369	20	30		EGEDHN
CC1(C)CN(C[C@@H](O)c2ccc(C#N)cc2)CCN1Cc1ccccc1	ZINC000245950534	1296331799	/nfs/dbraw/zinc/33/17/99/1296331799.db2.gz	AXWDVTHDPXIBOX-OAQYLSRUSA-N	0	3	349.478	3.188	20	30		EGEDHN
C[C@@H](NC[C@H](O)c1c(F)cccc1F)c1ccc(OCC#N)cc1	ZINC000305787307	1297051577	/nfs/dbraw/zinc/05/15/77/1297051577.db2.gz	YPDSUIGVYQNRNQ-PXAZEXFGSA-N	0	3	332.350	3.251	20	30		EGEDHN
CCN(CCNC1CC(C#N)(c2ccccc2)C1)C(=O)OC(C)(C)C	ZINC000310849296	1297102174	/nfs/dbraw/zinc/10/21/74/1297102174.db2.gz	QHMSNLKJBZJLBW-UHFFFAOYSA-N	0	3	343.471	3.457	20	30		EGEDHN
COc1cc(C=NOCCN2CCCCC2)cc(Cl)c1OC	ZINC000588596060	1298090682	/nfs/dbraw/zinc/09/06/82/1298090682.db2.gz	LPIASNPJHHHCFD-UHFFFAOYSA-N	0	3	326.824	3.194	20	30		EGEDHN
C=CCOc1ccc(/C=C\C(=O)N(CCN(C)C)C(C)C)cc1OC	ZINC000749019466	1299128763	/nfs/dbraw/zinc/12/87/63/1299128763.db2.gz	TVLWEPPSBMCRFA-LUAWRHEFSA-N	0	3	346.471	3.072	20	30		EGEDHN
CC(=O)[C@](C#N)(CCN1CCC([C@H]2CCOC2)CC1)c1ccccc1	ZINC000878403154	1299976253	/nfs/dbraw/zinc/97/62/53/1299976253.db2.gz	VTPSOBHHXUSQHO-PZJWPPBQSA-N	0	3	340.467	3.176	20	30		EGEDHN
CC(=O)[C@](C#N)(CCN1CCC[C@@H]1[C@@H]1CCCO1)c1ccccc1	ZINC000878573378	1300085650	/nfs/dbraw/zinc/08/56/50/1300085650.db2.gz	SPMBWJJAWYRAPF-HSALFYBXSA-N	0	3	326.440	3.070	20	30		EGEDHN
CC(=O)[C@@](C#N)(CCN1CCC[C@@](CO)(C(C)C)C1)c1ccccc1	ZINC000878655264	1300129527	/nfs/dbraw/zinc/12/95/27/1300129527.db2.gz	KRAARICIJGKFSS-RTWAWAEBSA-N	0	3	342.483	3.158	20	30		EGEDHN
COc1cccc([C@@H]2CN(Cc3ccc(C#N)cc3Cl)CCN2)c1	ZINC000879523528	1300578775	/nfs/dbraw/zinc/57/87/75/1300578775.db2.gz	ZYDCHURIFMRLMB-IBGZPJMESA-N	0	3	341.842	3.367	20	30		EGEDHN
CC[C@@H]1CC[C@H](C(=O)C(C#N)C(=O)Nc2cccc3ccccc32)O1	ZINC000757307775	1300664579	/nfs/dbraw/zinc/66/45/79/1300664579.db2.gz	XZRWCCRFRHIKDH-UWWQBHOKSA-N	0	3	336.391	3.445	20	30		EGEDHN
Cc1nc(CN=Nc2cncc(Br)c2)c2ccccn12	ZINC000758129256	1300792524	/nfs/dbraw/zinc/79/25/24/1300792524.db2.gz	GNCZMGQIEXLBLM-UHFFFAOYSA-N	0	3	330.189	3.246	20	30		EGEDHN
C=CCCN(C(C)C)[C@H](C)C(=O)Nc1c(C)csc1C(=O)OC	ZINC000880219724	1300987466	/nfs/dbraw/zinc/98/74/66/1300987466.db2.gz	OCXGVBVJUZKYIG-CYBMUJFWSA-N	0	3	338.473	3.457	20	30		EGEDHN
N#CC(C(=O)c1ccc(C2SCCS2)cc1)c1ccncn1	ZINC000760358272	1301261484	/nfs/dbraw/zinc/26/14/84/1301261484.db2.gz	OROFPHJPNXAIIP-ZDUSSCGKSA-N	0	3	327.434	3.445	20	30		EGEDHN
C[C@@H]1C[C@@H](Nc2nccc(Oc3cccc(C#N)c3)n2)CN1C1CC1	ZINC000882073740	1301815887	/nfs/dbraw/zinc/81/58/87/1301815887.db2.gz	UGQMJUQASYRHEX-UKRRQHHQSA-N	0	3	335.411	3.178	20	30		EGEDHN
N#Cc1ccc(NC(=O)NC[C@H]2CCCCN2C2CC2)cc1Cl	ZINC000765663830	1302300111	/nfs/dbraw/zinc/30/01/11/1302300111.db2.gz	RKHHWCWALKVCSV-OAHLLOKOSA-N	0	3	332.835	3.350	20	30		EGEDHN
C=C(Cl)COc1ccc([C@@H](C)N[C@@H]2CC(=O)N(C(C)C)C2)cc1	ZINC000773008627	1303606367	/nfs/dbraw/zinc/60/63/67/1303606367.db2.gz	WNCYHUDSMHXHCF-GDBMZVCRSA-N	0	3	336.863	3.478	20	30		EGEDHN
CCN1CCCC[C@H]1C(=O)C(C#N)c1nc2cc(F)ccc2s1	ZINC000774072759	1303771188	/nfs/dbraw/zinc/77/11/88/1303771188.db2.gz	OTODIXXGSYKNNC-JSGCOSHPSA-N	0	3	331.416	3.486	20	30		EGEDHN
CCN(CC)C(=O)[C@H](Cc1ccccc1)N[C@H]1CCC[C@H](C#N)C1	ZINC000774110506	1303776144	/nfs/dbraw/zinc/77/61/44/1303776144.db2.gz	IAZDMCAMJVUKAO-FHWLQOOXSA-N	0	3	327.472	3.138	20	30		EGEDHN
CC(C)[C@H](NCC(=O)NCCC#N)c1cccc(C(F)(F)F)c1	ZINC000775332929	1303941454	/nfs/dbraw/zinc/94/14/54/1303941454.db2.gz	KVDIQTHYPAUARF-HNNXBMFYSA-N	0	3	327.350	3.022	20	30		EGEDHN
COc1ccc(OC)c([C@H](O)CN[C@H](CCC#N)c2ccccc2)c1	ZINC000775554230	1303983668	/nfs/dbraw/zinc/98/36/68/1303983668.db2.gz	VXWAZFNNQJNKRP-RTBURBONSA-N	0	3	340.423	3.372	20	30		EGEDHN
C=C(C)[C@H](NC[C@H]1CC(C(=O)OC)=C(C)O1)c1ccc(F)c(F)c1	ZINC000775725859	1304021671	/nfs/dbraw/zinc/02/16/71/1304021671.db2.gz	XIVZBBKEERRINH-DYVFJYSZSA-N	0	3	337.366	3.408	20	30		EGEDHN
CCOC(=O)N1CCC[C@H]([C@@H](C)NCc2ccc(F)cc2C#N)C1	ZINC000776819818	1304204780	/nfs/dbraw/zinc/20/47/80/1304204780.db2.gz	CYFUYVRRALIVGB-HIFRSBDPSA-N	0	3	333.407	3.044	20	30		EGEDHN
Cn1cc(CNCc2ccc(C#N)cc2)c(-c2ccc(C#N)cc2)n1	ZINC000778074388	1304391787	/nfs/dbraw/zinc/39/17/87/1304391787.db2.gz	LZQXEBIFIKYMFY-UHFFFAOYSA-N	0	3	327.391	3.120	20	30		EGEDHN
CCCN(C(=O)[C@H](C#N)CC)C1CCN(Cc2ccccc2)CC1	ZINC000889489136	1304500733	/nfs/dbraw/zinc/50/07/33/1304500733.db2.gz	XGBPTVYIFYCFNL-SFHVURJKSA-N	0	3	327.472	3.439	20	30		EGEDHN
C#CCNC(=O)CCN[C@@H](c1ccccc1)c1ccc(Cl)cc1	ZINC000779042880	1304521715	/nfs/dbraw/zinc/52/17/15/1304521715.db2.gz	CBYDFJYNWAIYMN-IBGZPJMESA-N	0	3	326.827	3.159	20	30		EGEDHN
N#CC(C(=O)COc1ccc(-c2ccccc2)cc1)C(=O)N1CCCC1	ZINC000780301339	1304673958	/nfs/dbraw/zinc/67/39/58/1304673958.db2.gz	KYVWKLGOAJYUFJ-IBGZPJMESA-N	0	3	348.402	3.064	20	30		EGEDHN
CC[C@H](C)c1ccc(NC(=O)C(C#N)C(=O)[C@@H]2[C@H]3CCCO[C@H]32)cc1	ZINC000780308727	1304674806	/nfs/dbraw/zinc/67/48/06/1304674806.db2.gz	DAHVPIGJUDMARY-LJNYTWTNSA-N	0	3	340.423	3.272	20	30		EGEDHN
C#CCCCCCC(=O)Nc1ccc(CN2CCN(CC)CC2)cc1	ZINC000780367674	1304682675	/nfs/dbraw/zinc/68/26/75/1304682675.db2.gz	BFVCNJMVMFAMAV-UHFFFAOYSA-N	0	3	341.499	3.346	20	30		EGEDHN
N#Cc1ccc(F)c(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)c1	ZINC000891454933	1305054666	/nfs/dbraw/zinc/05/46/66/1305054666.db2.gz	SVYZAYIQDWONHS-WDEREUQCSA-N	0	3	330.281	3.383	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(F)c(Cl)c1)C(=O)[C@H]1CCCCS1	ZINC000783353133	1305082954	/nfs/dbraw/zinc/08/29/54/1305082954.db2.gz	PLPIAORMCIEBFS-GXFFZTMASA-N	0	3	340.807	3.412	20	30		EGEDHN
C=C(C)CN1CCC(NC(=S)N[C@H](C)Cc2ccccc2)CC1	ZINC000786078525	1305506342	/nfs/dbraw/zinc/50/63/42/1305506342.db2.gz	LMVHIPJDOQFVNJ-MRXNPFEDSA-N	0	3	331.529	3.122	20	30		EGEDHN
C[C@H](C(=O)C(C#N)C(=O)NCc1cccc(Cl)c1)c1ccco1	ZINC000786536447	1305593027	/nfs/dbraw/zinc/59/30/27/1305593027.db2.gz	BTDFFSARSPHFLV-SMDDNHRTSA-N	0	3	330.771	3.062	20	30		EGEDHN
CCN1CCCC[C@H]1CNC(=O)C#Cc1ccc(C(F)(F)F)cc1	ZINC000790623327	1306364204	/nfs/dbraw/zinc/36/42/04/1306364204.db2.gz	PETRMHYOOCJOIX-INIZCTEOSA-N	0	3	338.373	3.048	20	30		EGEDHN
Cc1c(CNCc2ccc(O[C@H](C)C#N)cc2)cccc1[N+](=O)[O-]	ZINC000790995711	1308906502	/nfs/dbraw/zinc/90/65/02/1308906502.db2.gz	CCRSSIGHSMQCQH-CYBMUJFWSA-N	0	3	325.368	3.484	20	30		EGEDHN
COC1(CC(=O)C(C#N)C(=O)Nc2cccc3ccccc32)CCC1	ZINC000791772087	1309061054	/nfs/dbraw/zinc/06/10/54/1309061054.db2.gz	VYNAIYZEHGRYOQ-INIZCTEOSA-N	0	3	336.391	3.446	20	30		EGEDHN
C=C(C)C[N@H+](Cc1ccccc1)Cc1cc2c(cc1[O-])OC[C@H]2O	ZINC000794651233	1309563481	/nfs/dbraw/zinc/56/34/81/1309563481.db2.gz	SWFQRQAZOSPGBZ-LJQANCHMSA-N	0	3	325.408	3.396	20	30		EGEDHN
C=C(C)C[N@@H+](Cc1ccccc1)Cc1cc2c(cc1[O-])OC[C@H]2O	ZINC000794651233	1309563488	/nfs/dbraw/zinc/56/34/88/1309563488.db2.gz	SWFQRQAZOSPGBZ-LJQANCHMSA-N	0	3	325.408	3.396	20	30		EGEDHN
CN(C)Cc1ccc(-c2noc(-c3ccccc3OCC#N)n2)cc1	ZINC000794669839	1309567971	/nfs/dbraw/zinc/56/79/71/1309567971.db2.gz	WUCOHLNXMZMMQX-UHFFFAOYSA-N	0	3	334.379	3.368	20	30		EGEDHN
COc1ccc(C2=NO[C@@H](CN[C@@H](C)CC(C)(C)C#N)C2)cc1C	ZINC000895976765	1309624196	/nfs/dbraw/zinc/62/41/96/1309624196.db2.gz	JSTULYVMTBYIML-GOEBONIOSA-N	0	3	329.444	3.415	20	30		EGEDHN
CC(=O)N[C@@H](C(=O)C(C#N)c1ncc(C(C)(C)C)s1)C1CCCC1	ZINC000797567238	1310212018	/nfs/dbraw/zinc/21/20/18/1310212018.db2.gz	DZCVLGQRYWAGJF-DZGCQCFKSA-N	0	3	347.484	3.312	20	30		EGEDHN
C=CC[C@@H](CC)NC(=O)Nc1ccc(N2CCN(CC)CC2)cc1	ZINC000798496696	1310371484	/nfs/dbraw/zinc/37/14/84/1310371484.db2.gz	PLGWCOUSHVPHIN-MRXNPFEDSA-N	0	3	330.476	3.305	20	30		EGEDHN
C(=NOCCCCC1CCOCC1)c1ccc(N2CCOCC2)cc1	ZINC000799174426	1310498430	/nfs/dbraw/zinc/49/84/30/1310498430.db2.gz	GWEUOYRZYKNGQL-UHFFFAOYSA-N	0	3	346.471	3.471	20	30		EGEDHN
C=C(C)COc1cc(CNCc2ccc3nonc3c2)ccc1OC	ZINC000897993517	1310545310	/nfs/dbraw/zinc/54/53/10/1310545310.db2.gz	FFWTTZCMTPBKMO-UHFFFAOYSA-N	0	3	339.395	3.476	20	30		EGEDHN
Cc1nc2ccccn2c1CNCc1ccc(N(C)CCC#N)cc1	ZINC000898278489	1310659346	/nfs/dbraw/zinc/65/93/46/1310659346.db2.gz	IOUJKJFTHNIWFH-UHFFFAOYSA-N	0	3	333.439	3.282	20	30		EGEDHN
N#CC1(CCCCN2CCNC(=O)C[C@H]2c2ccccc2)CCC1	ZINC000929464226	1328604173	/nfs/dbraw/zinc/60/41/73/1328604173.db2.gz	LJMNXZRZODAXNE-SFHVURJKSA-N	0	3	325.456	3.414	20	30		EGEDHN
C[C@H](C#N)OCCN(Cc1ccccc1)C[C@H](O)c1ccsc1	ZINC000801927061	1316966736	/nfs/dbraw/zinc/96/67/36/1316966736.db2.gz	HXBRKCYSTZKDBF-QAPCUYQASA-N	0	3	330.453	3.212	20	30		EGEDHN
Cc1cc(C)nc(C(=O)C(C#N)C(=O)Nc2ccc(F)c(Cl)c2)c1	ZINC000802042801	1316975478	/nfs/dbraw/zinc/97/54/78/1316975478.db2.gz	XHCNJNCOQWXMFL-GFCCVEGCSA-N	0	3	345.761	3.452	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)[C@H]3CC[C@@H]4C[C@@H]4CC3)C2)s1	ZINC001019179563	1317089582	/nfs/dbraw/zinc/08/95/82/1317089582.db2.gz	YFLMLEZANSVXKF-FZKCQIBNSA-N	0	3	343.496	3.137	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](NCc2ccc(Cl)cc2OC)C1	ZINC001019238306	1317117609	/nfs/dbraw/zinc/11/76/09/1317117609.db2.gz	VYAKNRDKRQNOCY-HNNXBMFYSA-N	0	3	336.863	3.251	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)C[C@H]3CC=CCC3)C2)s1	ZINC001019244247	1317120934	/nfs/dbraw/zinc/12/09/34/1317120934.db2.gz	ZFJVTWHLYOTVKD-GJZGRUSLSA-N	0	3	329.469	3.057	20	30		EGEDHN
CC1(C)CCC[C@H]1C(=O)N1CC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001019255206	1317127855	/nfs/dbraw/zinc/12/78/55/1317127855.db2.gz	FGWPLTINLSXILX-IRXDYDNUSA-N	0	3	343.446	3.214	20	30		EGEDHN
CC1(C)CCC[C@H]1C(=O)N1CC[C@H](NCc2ccc(C#N)s2)C1	ZINC001019256182	1317129091	/nfs/dbraw/zinc/12/90/91/1317129091.db2.gz	QMUAXUKWDLVKMJ-BBRMVZONSA-N	0	3	331.485	3.137	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@H](NCc2ccc(C#N)s2)C1)c1ccsc1	ZINC001019371861	1317198862	/nfs/dbraw/zinc/19/88/62/1317198862.db2.gz	OGYGWWWPWNMNAP-OCCSQVGLSA-N	0	3	345.493	3.175	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)c3ccc(Cl)cc3)C2)s1	ZINC001019690278	1317335855	/nfs/dbraw/zinc/33/58/55/1317335855.db2.gz	PNRZGQXKLBCKBG-AWEZNQCLSA-N	0	3	345.855	3.277	20	30		EGEDHN
CCN(Cc1ccccc1C#N)CC1CCN(C(=O)CC2CC2)CC1	ZINC000957664663	1317535337	/nfs/dbraw/zinc/53/53/37/1317535337.db2.gz	HUQVGKCXCRKMJE-UHFFFAOYSA-N	0	3	339.483	3.419	20	30		EGEDHN
C#CCN(CC)C(=O)NC[C@H](c1ccc(Cl)cc1)N(C)CCC	ZINC000807411074	1317565651	/nfs/dbraw/zinc/56/56/51/1317565651.db2.gz	DTBYLPDXCFAMTO-QGZVFWFLSA-N	0	3	335.879	3.388	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cccc(C(F)F)c2F)C1	ZINC001020163505	1317570236	/nfs/dbraw/zinc/57/02/36/1317570236.db2.gz	SHVOJZXZMTZKCC-MGCOHNPYSA-N	0	3	332.753	3.366	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)c2sccc2Cl)C1	ZINC001020183198	1317578718	/nfs/dbraw/zinc/57/87/18/1317578718.db2.gz	AMMPHRBXWQIIOW-KYZUINATSA-N	0	3	349.681	3.161	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@H](NC(=O)[C@@H]3CCCC34CC4)C2)c1	ZINC001020290156	1317629403	/nfs/dbraw/zinc/62/94/03/1317629403.db2.gz	JRDRAXQVFUIQBB-ULQDDVLXSA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)[C@@H]2CCC[C@H]2CCC)C1	ZINC001020326352	1317644976	/nfs/dbraw/zinc/64/49/76/1317644976.db2.gz	NWWJDFILMLUFTK-KBUPBQIOSA-N	0	3	343.309	3.348	20	30		EGEDHN
CC1(C)CCC[C@H]1C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001020478159	1317713863	/nfs/dbraw/zinc/71/38/63/1317713863.db2.gz	BZPVBJTXAZUURD-ULQDDVLXSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Br)CN1CCN(c2ccnc3ccccc32)CC1	ZINC000809562283	1317831450	/nfs/dbraw/zinc/83/14/50/1317831450.db2.gz	DYOSWJKRUJOPRP-UHFFFAOYSA-N	0	3	332.245	3.265	20	30		EGEDHN
COCCCN(Cc1ccncc1)Cc1ccc(O[C@H](C)C#N)cc1	ZINC000809741230	1317885981	/nfs/dbraw/zinc/88/59/81/1317885981.db2.gz	QHJMPQCFDXUTPI-QGZVFWFLSA-N	0	3	339.439	3.411	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2)C1	ZINC001020720465	1317887222	/nfs/dbraw/zinc/88/72/22/1317887222.db2.gz	CYSWRASKQPTTCF-YHUYYLMFSA-N	0	3	339.266	3.433	20	30		EGEDHN
CCOc1cc(/C=C2\C(=O)c3ncnn3C2C)cc(Cl)c1OC	ZINC000905081470	1317921859	/nfs/dbraw/zinc/92/18/59/1317921859.db2.gz	QVEARNUNEXKZFM-BVBCSLMJSA-N	0	3	333.775	3.180	20	30		EGEDHN
C#CCOc1ccccc1CNC[C@@]1(C)OCCc2sccc21	ZINC000810169887	1317968100	/nfs/dbraw/zinc/96/81/00/1317968100.db2.gz	BDFSIUSUEXKTHL-LJQANCHMSA-N	0	3	327.449	3.338	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc(O[C@H](C)CC)cc2)C1	ZINC001020887240	1317985289	/nfs/dbraw/zinc/98/52/89/1317985289.db2.gz	KKNNWRCDBLVRCR-FVQBIDKESA-N	0	3	336.863	3.467	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)Cc3cccc(OCC#N)c3)nc21	ZINC000810591013	1318027666	/nfs/dbraw/zinc/02/76/66/1318027666.db2.gz	WCJCMBGYHDGPCF-MRXNPFEDSA-N	0	3	344.374	3.193	20	30		EGEDHN
C#Cc1ccccc1CC(=O)OCC1CCN(Cc2ccco2)CC1	ZINC000810639436	1318036932	/nfs/dbraw/zinc/03/69/32/1318036932.db2.gz	DRHWYZFEVKAGIT-UHFFFAOYSA-N	0	3	337.419	3.259	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C[C@@H]2CCCC[C@H]2C)C1	ZINC001021119048	1318102480	/nfs/dbraw/zinc/10/24/80/1318102480.db2.gz	QYDYWDKODGLSCC-FAAHXZRKSA-N	0	3	343.309	3.348	20	30		EGEDHN
CN(C)c1ncc(C=[NH+][N-]c2nc(Cl)c(Cl)cc2Cl)n1C	ZINC000811633042	1318214772	/nfs/dbraw/zinc/21/47/72/1318214772.db2.gz	IRTSPSRXJJYBBR-UHFFFAOYSA-N	0	3	347.637	3.287	20	30		EGEDHN
CN(C)c1ncc(C=NNCc2ccc(-c3ccccc3)cc2)n1C	ZINC000811643773	1318217988	/nfs/dbraw/zinc/21/79/88/1318217988.db2.gz	KIUTWGPJQVEAHZ-UHFFFAOYSA-N	0	3	333.439	3.277	20	30		EGEDHN
Cc1ccc(CNC[C@@H]2CCCCN2C(=O)[C@@H](C)C#N)c(Cl)c1	ZINC000959918069	1318265617	/nfs/dbraw/zinc/26/56/17/1318265617.db2.gz	AFINTAGZLTTWCQ-HOCLYGCPSA-N	0	3	333.863	3.279	20	30		EGEDHN
Cc1ccc(C(=O)/C=C/C(=O)N2CCCC3(CCN(C)CC3)C2)cc1	ZINC000907959827	1318285729	/nfs/dbraw/zinc/28/57/29/1318285729.db2.gz	MJBUXISCRYLLLZ-CMDGGOBGSA-N	0	3	340.467	3.068	20	30		EGEDHN
C#C[C@H](NC(=O)N[C@@H](CN1CCCCC1)c1ccccc1)C(C)C	ZINC000812045850	1318315680	/nfs/dbraw/zinc/31/56/80/1318315680.db2.gz	RSSAWZQFFPZMQS-OALUTQOASA-N	0	3	327.472	3.171	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC[C@@H]2CN(Cc3cccc(C#N)c3)CC[C@@H]21	ZINC001021552499	1318394173	/nfs/dbraw/zinc/39/41/73/1318394173.db2.gz	BLOXXIKHKYNIQP-QZKCSFHISA-N	0	3	337.467	3.337	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@@H](CCCN3C(=O)C=C3CCC3)C2)c1	ZINC001021559523	1318408581	/nfs/dbraw/zinc/40/85/81/1318408581.db2.gz	SBYLRRUCBGWSRP-LEWJYISDSA-N	0	3	349.478	3.481	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccnn1[C@H](C)CC	ZINC000960272460	1318437816	/nfs/dbraw/zinc/43/78/16/1318437816.db2.gz	XQCKBUUGOKHXDQ-LSBZLQRGSA-N	0	3	338.455	3.026	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cccc2c1O[C@@H](C)C2	ZINC000960286540	1318445058	/nfs/dbraw/zinc/44/50/58/1318445058.db2.gz	AUNIVPLVZKDZOU-VHKYSDTDSA-N	0	3	348.446	3.181	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc(F)ccc1OC	ZINC000960298082	1318448912	/nfs/dbraw/zinc/44/89/12/1318448912.db2.gz	ZSUOUMSFUJIEPC-IEBWSBKVSA-N	0	3	340.398	3.006	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@@H](C)c1cccs1	ZINC000960305342	1318453598	/nfs/dbraw/zinc/45/35/98/1318453598.db2.gz	DQUHLPMUSOSUBI-FDQGKXFDSA-N	0	3	326.465	3.409	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cccc(OC)c1F	ZINC000960314754	1318456652	/nfs/dbraw/zinc/45/66/52/1318456652.db2.gz	QLNNAXFHBCKQRG-VQIMIIECSA-N	0	3	340.398	3.006	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc2c(C)cccn2c1	ZINC000960322866	1318461698	/nfs/dbraw/zinc/46/16/98/1318461698.db2.gz	CXMAHZOCLGTNTM-TZIWHRDSSA-N	0	3	345.446	3.419	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cccc3ccc(C)nc32)C1	ZINC001021615068	1318463589	/nfs/dbraw/zinc/46/35/89/1318463589.db2.gz	UUPJWIXQSGWFMK-AZUAARDMSA-N	0	3	347.462	3.103	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1oc(CCC)nc1C	ZINC000960327168	1318463652	/nfs/dbraw/zinc/46/36/52/1318463652.db2.gz	OGPMZPJFNGZZHW-SJLPKXTDSA-N	0	3	339.439	3.107	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1c(C)nsc1C	ZINC000960331675	1318466193	/nfs/dbraw/zinc/46/61/93/1318466193.db2.gz	ATUPEBASCQVZBQ-SJLPKXTDSA-N	0	3	341.480	3.321	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(CC)s2)C1	ZINC001021622268	1318471509	/nfs/dbraw/zinc/47/15/09/1318471509.db2.gz	HUFWAVGQVUHFJE-WBVHZDCISA-N	0	3	330.497	3.260	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)CCc2ccc(C)cc2)C1	ZINC001021629545	1318483088	/nfs/dbraw/zinc/48/30/88/1318483088.db2.gz	HGRAHIPINVQUPU-SFTDATJTSA-N	0	3	338.495	3.264	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2nc3ccccc3cc2C)C1	ZINC001021635621	1318489872	/nfs/dbraw/zinc/48/98/72/1318489872.db2.gz	LFNRDAVIVFQUSU-ICSRJNTNSA-N	0	3	347.462	3.103	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(C)c(Cl)c2F)C1	ZINC001021637070	1318491673	/nfs/dbraw/zinc/49/16/73/1318491673.db2.gz	WYUVAQSTKPPDGZ-GDBMZVCRSA-N	0	3	348.849	3.347	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc3cc(C)ccc3[nH]2)C1	ZINC001021646886	1318504409	/nfs/dbraw/zinc/50/44/09/1318504409.db2.gz	SXWYOMHDTVCTNB-UZLBHIALSA-N	0	3	335.451	3.036	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(F)c(C)c2)C1	ZINC001021655388	1318516346	/nfs/dbraw/zinc/51/63/46/1318516346.db2.gz	OHNRUCBLFRQIMV-PKOBYXMFSA-N	0	3	328.431	3.084	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccn(C(C)C)c2C)C1	ZINC001021656265	1318517836	/nfs/dbraw/zinc/51/78/36/1318517836.db2.gz	SQKFARHNNYLPNB-QUCCMNQESA-N	0	3	341.499	3.327	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)Cc2c(C)cc(C)cc2C)C1	ZINC001021663798	1318525405	/nfs/dbraw/zinc/52/54/05/1318525405.db2.gz	DYKRLJHPWPEKAW-CTNGQTDRSA-N	0	3	338.495	3.100	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc3occc3s2)C1	ZINC001021667003	1318528630	/nfs/dbraw/zinc/52/86/30/1318528630.db2.gz	FECUGYOORVYEIG-KBPBESRZSA-N	0	3	328.437	3.054	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)C[C@H]1C=CCC1	ZINC000960401782	1318530451	/nfs/dbraw/zinc/53/04/51/1318530451.db2.gz	ZGECNQMAJFQIKN-FXAWDEMLSA-N	0	3	337.467	3.337	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cccc(OCC)c2)C1	ZINC001021679370	1318548713	/nfs/dbraw/zinc/54/87/13/1318548713.db2.gz	NQVBQJBAMYDXPV-ICSRJNTNSA-N	0	3	340.467	3.035	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc3c(c2)C=CCC3)C1	ZINC001021685275	1318559052	/nfs/dbraw/zinc/55/90/52/1318559052.db2.gz	PQUHLWCYUJMCEE-SFTDATJTSA-N	0	3	334.463	3.206	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc3cccnc3c2)C1	ZINC001021693879	1318568980	/nfs/dbraw/zinc/56/89/80/1318568980.db2.gz	RVURTYHTNBWJAA-TZIWHRDSSA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cccc(Cl)c2)C1	ZINC001021716097	1318596108	/nfs/dbraw/zinc/59/61/08/1318596108.db2.gz	BWZFPWSYMLTCBW-FUHWJXTLSA-N	0	3	330.859	3.290	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cccc(C(F)F)c2)C1	ZINC001021716677	1318597679	/nfs/dbraw/zinc/59/76/79/1318597679.db2.gz	FOYNNIUWYZRAAF-IRXDYDNUSA-N	0	3	332.394	3.184	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(F)cc2C)C1	ZINC001021718763	1318601149	/nfs/dbraw/zinc/60/11/49/1318601149.db2.gz	JNXSIAOWFMNGGE-LPHOPBHVSA-N	0	3	328.431	3.084	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)Cc2ccc(Cl)cc2)C1	ZINC001021725099	1318616478	/nfs/dbraw/zinc/61/64/78/1318616478.db2.gz	POQYBHZMQJSWPS-HKUYNNGSSA-N	0	3	344.886	3.219	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)Cc2ccc3ccccc3c2)C1	ZINC001021730716	1318631834	/nfs/dbraw/zinc/63/18/34/1318631834.db2.gz	PWTMFHVNSWXPQZ-FGZHOGPDSA-N	0	3	346.474	3.328	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)CCc2cccs2)C1	ZINC001021731209	1318633979	/nfs/dbraw/zinc/63/39/79/1318633979.db2.gz	TUYOZYLPURQAEV-SJLPKXTDSA-N	0	3	330.497	3.017	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(-c3ccccc3)[nH]2)C1	ZINC001021746411	1318663675	/nfs/dbraw/zinc/66/36/75/1318663675.db2.gz	LGOANPABEZEJOI-RXVVDRJESA-N	0	3	347.462	3.241	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)Nc1ccc2c(c1)NC(=O)CO2	ZINC000912068191	1318800776	/nfs/dbraw/zinc/80/07/76/1318800776.db2.gz	LPYINYGVOONOED-CQSZACIVSA-N	0	3	333.432	3.034	20	30		EGEDHN
Cc1cocc1C(=O)N1CCC[C@@H]1CN(C)Cc1ccc(C#N)cc1	ZINC000960793040	1318901954	/nfs/dbraw/zinc/90/19/54/1318901954.db2.gz	SZUGSXAYTMDWDA-GOSISDBHSA-N	0	3	337.423	3.196	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@@H](C)c2c(F)cccc2F)C1	ZINC001022434931	1318940015	/nfs/dbraw/zinc/94/00/15/1318940015.db2.gz	OKRMSEZUODIJPI-SDDRHHMPSA-N	0	3	328.790	3.058	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)C1CC2(CC2)C1	ZINC000960853824	1318997285	/nfs/dbraw/zinc/99/72/85/1318997285.db2.gz	UILFEOBQJAQBCC-LJQANCHMSA-N	0	3	337.467	3.171	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H]1CN(C)Cc1cccc(C#N)c1)C(C)(F)F	ZINC000960869627	1319013920	/nfs/dbraw/zinc/01/39/20/1319013920.db2.gz	OWFZGJMNCWSDMW-YOEHRIQHSA-N	0	3	349.425	3.272	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H]1CN(C)Cc1ccc(C#N)cc1)C(C)(F)F	ZINC000960870837	1319014432	/nfs/dbraw/zinc/01/44/32/1319014432.db2.gz	UEDTXCBJAUVWMF-PBHICJAKSA-N	0	3	349.425	3.272	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@@H]1CN(C)Cc1ccc(C#N)cc1	ZINC000960887128	1319025947	/nfs/dbraw/zinc/02/59/47/1319025947.db2.gz	SADGHVMSJPGKME-GUDVDZBRSA-N	0	3	325.456	3.027	20	30		EGEDHN
C[C@H]1CCC[C@@]1(C)C(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001022667275	1319057771	/nfs/dbraw/zinc/05/77/71/1319057771.db2.gz	XGFQJNNEQUEYSD-FVINJOMDSA-N	0	3	343.446	3.260	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)[C@H]1CC12CCC2	ZINC000960913775	1319060506	/nfs/dbraw/zinc/06/05/06/1319060506.db2.gz	SFQNVNROJJPQJR-RBUKOAKNSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@@H](NCc3cc(OC)ccc3Cl)C2)C1	ZINC001022675498	1319061392	/nfs/dbraw/zinc/06/13/92/1319061392.db2.gz	YCUAYNISYKKJAS-GASCZTMLSA-N	0	3	348.874	3.442	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)[C@@H]1C[C@H]1C1CC1	ZINC000960919297	1319065970	/nfs/dbraw/zinc/06/59/70/1319065970.db2.gz	PFWYEVPDHVPQNA-SLFFLAALSA-N	0	3	337.467	3.027	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ncoc2-c2cccs2)C1	ZINC001022861987	1319142598	/nfs/dbraw/zinc/14/25/98/1319142598.db2.gz	OFHZMIJNVXTQRX-PHIMTYICSA-N	0	3	337.832	3.006	20	30		EGEDHN
Cc1cc(C#N)cnc1C(=O)O[C@H]1CCCN(Cc2ccccc2)[C@H]1C	ZINC000816471804	1319161162	/nfs/dbraw/zinc/16/11/62/1319161162.db2.gz	NJPDWQHRAGAJBA-LPHOPBHVSA-N	0	3	349.434	3.472	20	30		EGEDHN
CCC(=O)N1CCC[C@H]([C@@H]2CCN(Cc3ccccc3C#N)C2)C1	ZINC000961065379	1319181546	/nfs/dbraw/zinc/18/15/46/1319181546.db2.gz	JOPAWXPREXICNC-RBUKOAKNSA-N	0	3	325.456	3.029	20	30		EGEDHN
C=C(C)C[N@@H+]1CC[C@@H]([C@H]2CCCN(C(=O)c3ccccc3[O-])C2)C1	ZINC000961099830	1319211544	/nfs/dbraw/zinc/21/15/44/1319211544.db2.gz	ZRIYCWZSMLRAMN-DLBZAZTESA-N	0	3	328.456	3.142	20	30		EGEDHN
C=C(C)C[N@H+]1CC[C@@H]([C@H]2CCCN(C(=O)c3ccccc3[O-])C2)C1	ZINC000961099830	1319211550	/nfs/dbraw/zinc/21/15/50/1319211550.db2.gz	ZRIYCWZSMLRAMN-DLBZAZTESA-N	0	3	328.456	3.142	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@@H](C)c2ccc(F)cc2F)C1	ZINC001023109910	1319264724	/nfs/dbraw/zinc/26/47/24/1319264724.db2.gz	KSKHEJOQPIJZTJ-WCFLWFBJSA-N	0	3	328.790	3.058	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)s1)c1ccc(N2CCNC2=O)cc1	ZINC000817589574	1319408510	/nfs/dbraw/zinc/40/85/10/1319408510.db2.gz	OMXJQDKENCYKRY-LBPRGKRZSA-N	0	3	326.425	3.000	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](C2CCN(C(=O)C(C)(F)F)CC2)C1	ZINC000961311353	1319471313	/nfs/dbraw/zinc/47/13/13/1319471313.db2.gz	HNHZFSTYGKBJSA-AWEZNQCLSA-N	0	3	334.838	3.345	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](C2CCN(C(=O)c3ccc[nH]3)CC2)C1	ZINC000961320496	1319477041	/nfs/dbraw/zinc/47/70/41/1319477041.db2.gz	DFVSWYGSMJYUKJ-INIZCTEOSA-N	0	3	335.879	3.331	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1ccc(-c2ccc(C)cc2)cc1F	ZINC000818602781	1319567374	/nfs/dbraw/zinc/56/73/74/1319567374.db2.gz	DUZADQIEYKATIA-UHFFFAOYSA-N	0	3	338.426	3.486	20	30		EGEDHN
C#CCN(C)CCCNC(=O)C[C@@H](Cc1ccccc1)c1ccccc1	ZINC000818609202	1319570124	/nfs/dbraw/zinc/57/01/24/1319570124.db2.gz	OEFJPVOVVMTGCN-JOCHJYFZSA-N	0	3	348.490	3.474	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](C2CCN(C(=O)[C@@H]3CC34CC4)CC2)C1	ZINC000961416159	1319571917	/nfs/dbraw/zinc/57/19/17/1319571917.db2.gz	RNAGAGOEGXZXDV-SJORKVTESA-N	0	3	336.907	3.490	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)[C@@H]2C[C@H]2c2ccccc2CC)C1	ZINC001023556729	1319667917	/nfs/dbraw/zinc/66/79/17/1319667917.db2.gz	OTGQXUSQFBZMKO-DZFGPLHGSA-N	0	3	338.495	3.204	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H](NC[C@H](C#N)CCC#N)CC12CCC2	ZINC000819326232	1319698520	/nfs/dbraw/zinc/69/85/20/1319698520.db2.gz	LUQXKCRLYYYSBH-HOTGVXAUSA-N	0	3	346.475	3.342	20	30		EGEDHN
Cc1cc(C)n([C@@H](C)CC(=O)C(C#N)C(=O)Nc2cccc(C)c2)n1	ZINC000916898424	1319721056	/nfs/dbraw/zinc/72/10/56/1319721056.db2.gz	CSRWFPYSFMLPHA-RDJZCZTQSA-N	0	3	338.411	3.107	20	30		EGEDHN
CCc1cccc(CC)c1NC(=O)C(C#N)C(=O)CC[C@@H]1CCCO1	ZINC000916910285	1319723868	/nfs/dbraw/zinc/72/38/68/1319723868.db2.gz	WLRITMSZELVNCX-IRXDYDNUSA-N	0	3	342.439	3.418	20	30		EGEDHN
C=CCNC(=O)C(C#N)C(=O)CCCOc1cccc2ccccc21	ZINC000916921680	1319725778	/nfs/dbraw/zinc/72/57/78/1319725778.db2.gz	WVDCMGGYWUMKRA-QGZVFWFLSA-N	0	3	336.391	3.010	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc(C)oc2C(F)(F)F)C1	ZINC001023623365	1319744672	/nfs/dbraw/zinc/74/46/72/1319744672.db2.gz	OTHXURNYFRAJID-CYBMUJFWSA-N	0	3	342.361	3.072	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)[C@@H]2C[C@H]2c2ccc(C)c(C)c2)C1	ZINC001023637542	1319759295	/nfs/dbraw/zinc/75/92/95/1319759295.db2.gz	OVKMCMOHTVIHGX-HLAWJBBLSA-N	0	3	338.495	3.258	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc3nc(C)ccc3c2)C1	ZINC001023656643	1319776798	/nfs/dbraw/zinc/77/67/98/1319776798.db2.gz	BKKWDLSJGCTVPM-QGZVFWFLSA-N	0	3	335.451	3.008	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cnn(C(CC)CC)c2C)C1	ZINC001023692637	1319812123	/nfs/dbraw/zinc/81/21/23/1319812123.db2.gz	FRMXXTYTAAZOSK-QGZVFWFLSA-N	0	3	344.503	3.018	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc(-c3cccs3)o2)C1	ZINC001023727549	1319864550	/nfs/dbraw/zinc/86/45/50/1319864550.db2.gz	MOGGAIUBFWFJTP-OAHLLOKOSA-N	0	3	342.464	3.473	20	30		EGEDHN
C=C1CC(C)(C(=O)NC2CC(CNCc3nc(C)sc3C)C2)C1	ZINC000962282713	1319899347	/nfs/dbraw/zinc/89/93/47/1319899347.db2.gz	OEDNIWGVLZSJQK-UHFFFAOYSA-N	0	3	333.501	3.101	20	30		EGEDHN
C#CCCCOc1cccnc1NCCCCN1C[C@@H](C)O[C@@H](C)C1	ZINC000820675610	1319933652	/nfs/dbraw/zinc/93/36/52/1319933652.db2.gz	JJPLXAQBCQZRNF-HDICACEKSA-N	0	3	345.487	3.175	20	30		EGEDHN
CO[C@@H](C)C(=O)C(C#N)C(=O)Nc1ccccc1Oc1ccccc1	ZINC000918488206	1319956637	/nfs/dbraw/zinc/95/66/37/1319956637.db2.gz	XBEIVLDOIPRRIW-ZFWWWQNUSA-N	0	3	338.363	3.161	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001023815500	1319961133	/nfs/dbraw/zinc/96/11/33/1319961133.db2.gz	UBSFJMLBANQNPC-HNNXBMFYSA-N	0	3	331.435	3.072	20	30		EGEDHN
CN(C)C[C@@H]1CCc2ccccc2N1C(=O)/C=C/c1ccccc1C#N	ZINC000821630882	1320023875	/nfs/dbraw/zinc/02/38/75/1320023875.db2.gz	OQEIZYHYXCCXOH-PKHIPVCBSA-N	0	3	345.446	3.481	20	30		EGEDHN
CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(CNCc2cc(C#N)ccc2F)C1	ZINC000823949699	1320217468	/nfs/dbraw/zinc/21/74/68/1320217468.db2.gz	QRWPJBNOVGINMA-DNVCBOLYSA-N	0	3	345.418	3.044	20	30		EGEDHN
COc1ccc(CN(C)C2CC(NC(=O)OC(C)(C)C)C2)cc1C#N	ZINC000824733391	1320280891	/nfs/dbraw/zinc/28/08/91/1320280891.db2.gz	QQVIKCPXZJJHPV-UHFFFAOYSA-N	0	3	345.443	3.054	20	30		EGEDHN
C=CCSc1nc2ccccc2n1CN1CCN(C)C[C@@H]1CC	ZINC000840094339	1321028215	/nfs/dbraw/zinc/02/82/15/1321028215.db2.gz	SAWQXBYIMLEGMI-HNNXBMFYSA-N	0	3	330.501	3.298	20	30		EGEDHN
N#CC1(COC(=O)C2CC(F)(F)C2)CCN(Cc2ccccc2)CC1	ZINC000847749691	1321900301	/nfs/dbraw/zinc/90/03/01/1321900301.db2.gz	YSEOKJXHUYKBQH-UHFFFAOYSA-N	0	3	348.393	3.381	20	30		EGEDHN
Cc1cc(C(=O)OCC2(C#N)CCN(Cc3ccccc3)CC2)ccn1	ZINC000847747442	1321900380	/nfs/dbraw/zinc/90/03/80/1321900380.db2.gz	IBYCUSHRFRQVRO-UHFFFAOYSA-N	0	3	349.434	3.353	20	30		EGEDHN
C#CCN1CCC(C(=O)NCCC23CC4CC(CC(C4)C2)C3)CC1	ZINC000918758240	1321992688	/nfs/dbraw/zinc/99/26/88/1321992688.db2.gz	DJBDZGWPAFCTEW-UHFFFAOYSA-N	0	3	328.500	3.054	20	30		EGEDHN
Cc1cccc(CNC(=O)C(C#N)C(=O)CC2(C#N)CCCCC2)c1	ZINC000850976791	1322318662	/nfs/dbraw/zinc/31/86/62/1322318662.db2.gz	IWKZUUJXIPJLMJ-KRWDZBQOSA-N	0	3	337.423	3.184	20	30		EGEDHN
C=C(C)CN1CCC(N(C(=O)C(F)(F)F)c2cccnc2)CC1	ZINC000931001402	1329025545	/nfs/dbraw/zinc/02/55/45/1329025545.db2.gz	XCGRBVVNAWWLNR-UHFFFAOYSA-N	0	3	327.350	3.017	20	30		EGEDHN
CC(C)[C@@H](O)C1(CNCc2cc(C#N)ccc2Br)CC1	ZINC000921969454	1322432011	/nfs/dbraw/zinc/43/20/11/1322432011.db2.gz	WOILZKMEMVXRGN-OAHLLOKOSA-N	0	3	337.261	3.207	20	30		EGEDHN
N#Cc1ccc(Br)c(CNCC[C@@H](O)C2CCCC2)c1	ZINC000922319910	1322500548	/nfs/dbraw/zinc/50/05/48/1322500548.db2.gz	KTBFYLIMAQLMFS-MRXNPFEDSA-N	0	3	337.261	3.352	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2csc(C)c2)C1	ZINC001103535270	1365618411	/nfs/dbraw/zinc/61/84/11/1365618411.db2.gz	GEUARDXYJKQNHF-BXUZGUMPSA-N	0	3	326.893	3.497	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)NC2CC(CNCc3ccccc3C#N)C2)CC1	ZINC000962558931	1323007394	/nfs/dbraw/zinc/00/73/94/1323007394.db2.gz	DLYZJHBMFVJKHE-QYSSCYCTSA-N	0	3	339.483	3.369	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CCC[C@@H](CNCc2ccccc2C#N)C1	ZINC001023929678	1323035240	/nfs/dbraw/zinc/03/52/40/1323035240.db2.gz	DPBXMGJQXBCMJF-HNNXBMFYSA-N	0	3	329.419	3.150	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H](CNCc2oc(C)nc2C)C1	ZINC001024089985	1323122713	/nfs/dbraw/zinc/12/27/13/1323122713.db2.gz	BAHHIRAUFVBUOW-INIZCTEOSA-N	0	3	333.476	3.222	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H](CNCc2ncc(C)s2)C1	ZINC001024090284	1323122905	/nfs/dbraw/zinc/12/29/05/1323122905.db2.gz	GVUUEJFXHFKEMN-HNNXBMFYSA-N	0	3	335.517	3.382	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H](CNCc2ccccc2C#N)C1)C(C)(F)F	ZINC001024162133	1323179869	/nfs/dbraw/zinc/17/98/69/1323179869.db2.gz	ROEVMLUNYZVFNX-LSDHHAIUSA-N	0	3	349.425	3.178	20	30		EGEDHN
CN(C(=O)c1ccco1)C1CCC(NCc2ccccc2C#N)CC1	ZINC000963004939	1323185737	/nfs/dbraw/zinc/18/57/37/1323185737.db2.gz	DBIKOGRBPLRQIZ-UHFFFAOYSA-N	0	3	337.423	3.324	20	30		EGEDHN
C[C@H](CC(C)(C)C#N)N[C@H](Cc1ccccc1)C(=O)N1CCCC1	ZINC000924882493	1323199067	/nfs/dbraw/zinc/19/90/67/1323199067.db2.gz	QDQGCBSREDAEHD-SJLPKXTDSA-N	0	3	327.472	3.138	20	30		EGEDHN
CC(=O)N1CCC[C@H]([C@@H]2CCCN2CC#Cc2cccc(Cl)c2)C1	ZINC000963209275	1323236622	/nfs/dbraw/zinc/23/66/22/1323236622.db2.gz	PMAKTKUUVCMQGB-ICSRJNTNSA-N	0	3	344.886	3.414	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)C2=COCCC2)C1	ZINC000963262035	1323277961	/nfs/dbraw/zinc/27/79/61/1323277961.db2.gz	DFCQHVDMFDNXNQ-NVXWUHKLSA-N	0	3	338.879	3.136	20	30		EGEDHN
C=CCCN1CCCC[C@@H]1CNC(=O)c1cnc([C@@H](C)OC)s1	ZINC001024439588	1323402394	/nfs/dbraw/zinc/40/23/94/1323402394.db2.gz	CWEOEHDBLUZDNV-ZIAGYGMSSA-N	0	3	337.489	3.011	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccc2nccc(C)c2c1	ZINC001024454394	1323413767	/nfs/dbraw/zinc/41/37/67/1323413767.db2.gz	FNWACDPKVYKAQT-SFHVURJKSA-N	0	3	335.451	3.151	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@H]1CCc2cc(OC)ccc21	ZINC001024472369	1323426676	/nfs/dbraw/zinc/42/66/76/1323426676.db2.gz	SBNGZBPOSFLJHV-PXNSSMCTSA-N	0	3	342.483	3.272	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccc2cc(C)cn2c1	ZINC001024475144	1323428190	/nfs/dbraw/zinc/42/81/90/1323428190.db2.gz	GEZGQRXXLNYEHU-IBGZPJMESA-N	0	3	325.456	3.408	20	30		EGEDHN
C=C(C)CCN1CCCC[C@@H]1CNC(=O)c1nc2cccnc2s1	ZINC001024482632	1323436064	/nfs/dbraw/zinc/43/60/64/1323436064.db2.gz	HUVLEIZYMHMMCE-CQSZACIVSA-N	0	3	344.484	3.242	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)[C@@H]1CC=CC[C@H]1C(F)(F)F	ZINC001024508529	1323456447	/nfs/dbraw/zinc/45/64/47/1323456447.db2.gz	LRHRLABXHMXPLQ-ARFHVFGLSA-N	0	3	342.405	3.125	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccc2[nH]nc(C)c2c1	ZINC001024548715	1323489778	/nfs/dbraw/zinc/48/97/78/1323489778.db2.gz	DXZXGSMRNBUNHN-MRXNPFEDSA-N	0	3	326.444	3.032	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cc2ccccc2[nH]c1=O	ZINC001024586977	1323521452	/nfs/dbraw/zinc/52/14/52/1323521452.db2.gz	XASBUGSUSWGJED-MRXNPFEDSA-N	0	3	339.439	3.101	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccc(F)c(COC)c1	ZINC001024635965	1323561714	/nfs/dbraw/zinc/56/17/14/1323561714.db2.gz	LVDJKRJDYCFZFY-QGZVFWFLSA-N	0	3	334.435	3.133	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@@H]1CCc2cccc(OC)c21	ZINC001024696326	1323612914	/nfs/dbraw/zinc/61/29/14/1323612914.db2.gz	GHEQGYVLHKEFER-ZWKOTPCHSA-N	0	3	342.483	3.272	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccncc1C(F)(F)F	ZINC001024738169	1323638279	/nfs/dbraw/zinc/63/82/79/1323638279.db2.gz	QSSSLGBXVPSNQP-CYBMUJFWSA-N	0	3	341.377	3.261	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCCCN2CC2=CCCCC2)nc1	ZINC001024763444	1323663735	/nfs/dbraw/zinc/66/37/35/1323663735.db2.gz	GMQPABAREDFBCY-IBGZPJMESA-N	0	3	337.467	3.148	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccc(OCC(C)C)cc1	ZINC001024791300	1323696014	/nfs/dbraw/zinc/69/60/14/1323696014.db2.gz	YKRONPOUVKWZIX-IBGZPJMESA-N	0	3	342.483	3.329	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@@H]1Cc2cc(C)c(C)cc2O1	ZINC001024809205	1323712656	/nfs/dbraw/zinc/71/26/56/1323712656.db2.gz	QYYAAIFEOXKFKA-ICSRJNTNSA-N	0	3	342.483	3.154	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccc(OCC2CC2)nc1	ZINC001024812310	1323715807	/nfs/dbraw/zinc/71/58/07/1323715807.db2.gz	NDNUKMWSNBKFLH-GOSISDBHSA-N	0	3	343.471	3.031	20	30		EGEDHN
C/C(=C\C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)s1)C1CC1	ZINC001024882391	1323764154	/nfs/dbraw/zinc/76/41/54/1323764154.db2.gz	GAJCLDBYINFSPU-HFQYIWAZSA-N	0	3	343.496	3.447	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)/C=C/C2CC2)c(F)c1	ZINC001024910483	1323777043	/nfs/dbraw/zinc/77/70/43/1323777043.db2.gz	QOAKQHYDRXCZGA-PDFOZTTASA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCCC[C@@H]1CNCc1c(C)noc1C	ZINC001025038135	1323840080	/nfs/dbraw/zinc/84/00/80/1323840080.db2.gz	SCQUYOQTBLSLHJ-MRXNPFEDSA-N	0	3	333.476	3.364	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCCC[C@@H]1CNCc1ccnc(OC)c1	ZINC001025037523	1323840676	/nfs/dbraw/zinc/84/06/76/1323840676.db2.gz	IHAKHBCAIMWFSB-QGZVFWFLSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCCC[C@@H]1CNCc1n[nH]c(C(C)C)n1	ZINC001025069400	1323871374	/nfs/dbraw/zinc/87/13/74/1323871374.db2.gz	JTCPJJLMKIZBNX-BEFAXECRSA-N	0	3	347.507	3.001	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)Cc1ccsc1	ZINC001025196640	1323978815	/nfs/dbraw/zinc/97/88/15/1323978815.db2.gz	XQRHJCVIMTYHRY-MSOLQXFVSA-N	0	3	330.497	3.159	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(CC)ccn1	ZINC001025232030	1324018588	/nfs/dbraw/zinc/01/85/88/1324018588.db2.gz	JZKLQNNDYHIPAV-RBUKOAKNSA-N	0	3	327.472	3.289	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(OC)ns1	ZINC001025234110	1324022238	/nfs/dbraw/zinc/02/22/38/1324022238.db2.gz	FOFFPQLLGYEEQB-LSDHHAIUSA-N	0	3	349.500	3.187	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cncc(CC)c1	ZINC001025252203	1324057513	/nfs/dbraw/zinc/05/75/13/1324057513.db2.gz	NNZJUUQOURJRFU-VQTJNVASSA-N	0	3	339.483	3.126	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(F)ccc1OC	ZINC001025254521	1324060989	/nfs/dbraw/zinc/06/09/89/1324060989.db2.gz	KDPNPEHEBBROSC-ROUUACIJSA-N	0	3	346.446	3.479	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(C2CC2)on1	ZINC001025254369	1324061128	/nfs/dbraw/zinc/06/11/28/1324061128.db2.gz	IFJRZMJVCZUMBE-ZWKOTPCHSA-N	0	3	341.455	3.034	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)CCc1ccccc1C	ZINC001025273178	1324088743	/nfs/dbraw/zinc/08/87/43/1324088743.db2.gz	OFXKATIXQDZXFV-RTWAWAEBSA-N	0	3	338.495	3.406	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc2cnccc2c1	ZINC001025286796	1324107787	/nfs/dbraw/zinc/10/77/87/1324107787.db2.gz	LETXSLGEJIWOBU-LEWJYISDSA-N	0	3	347.462	3.327	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cncnc1C(C)C	ZINC001025301223	1324134260	/nfs/dbraw/zinc/13/42/60/1324134260.db2.gz	IFIXNVNDWZZQTR-QZTJIDSGSA-N	0	3	342.487	3.245	20	30		EGEDHN
C[C@@H](NC(=O)C1CCC1)[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001025316141	1324150932	/nfs/dbraw/zinc/15/09/32/1324150932.db2.gz	ISDYMVFSNJPWLV-DNVCBOLYSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2sc(C3CC3)nc2C)C1	ZINC001025418926	1324250212	/nfs/dbraw/zinc/25/02/12/1324250212.db2.gz	GFRTZDHHTLVREP-XJKSGUPXSA-N	0	3	345.512	3.183	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc3c([nH]2)c(F)ccc3C)C1	ZINC001025465223	1324310579	/nfs/dbraw/zinc/31/05/79/1324310579.db2.gz	TXMODNKRSNAFAJ-LSDHHAIUSA-N	0	3	341.430	3.079	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc3c([nH]2)c(F)ccc3C)C1	ZINC001025465204	1324310672	/nfs/dbraw/zinc/31/06/72/1324310672.db2.gz	TXMODNKRSNAFAJ-CABCVRRESA-N	0	3	341.430	3.079	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2csc(C(F)(F)F)c2)C1	ZINC001025471726	1324316769	/nfs/dbraw/zinc/31/67/69/1324316769.db2.gz	IMPDQYFGNWGOAZ-NWDGAFQWSA-N	0	3	344.402	3.230	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2c(C)[nH]c3ccccc32)C1	ZINC001025480598	1324327457	/nfs/dbraw/zinc/32/74/57/1324327457.db2.gz	XZKDQWMGFVIBOO-DOTOQJQBSA-N	0	3	337.467	3.330	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cnc3ccccc3c2C)C1	ZINC001025489389	1324340061	/nfs/dbraw/zinc/34/00/61/1324340061.db2.gz	OZDRHLBZXKJONR-SJORKVTESA-N	0	3	335.451	3.007	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H](C)[C@H]2CCCN(Cc3cccnc3)C2)cc1	ZINC001025501322	1324349751	/nfs/dbraw/zinc/34/97/51/1324349751.db2.gz	CRINBKXJFKXKEN-UTKZUKDTSA-N	0	3	347.462	3.093	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2scnc2C(C)C)C1	ZINC001025555990	1324404664	/nfs/dbraw/zinc/40/46/64/1324404664.db2.gz	RMJQBTXCAQKHOL-CABCVRRESA-N	0	3	333.501	3.120	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2csc(C(C)C)n2)C1	ZINC001025556681	1324405878	/nfs/dbraw/zinc/40/58/78/1324405878.db2.gz	XPINEPLCOSVWFC-LSDHHAIUSA-N	0	3	333.501	3.120	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cnc(CC(C)(C)C)s2)C1	ZINC001025590785	1324435865	/nfs/dbraw/zinc/43/58/65/1324435865.db2.gz	RQTZYDKPEKNBLQ-HUUCEWRRSA-N	0	3	347.528	3.195	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cnc(CC(C)(C)C)s2)C1	ZINC001025590786	1324436212	/nfs/dbraw/zinc/43/62/12/1324436212.db2.gz	RQTZYDKPEKNBLQ-LSDHHAIUSA-N	0	3	347.528	3.195	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(CC(C)C)c[nH]2)C1	ZINC001025597244	1324446351	/nfs/dbraw/zinc/44/63/51/1324446351.db2.gz	OXRDIVUVTXJLLB-AEFFLSMTSA-N	0	3	329.488	3.067	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc3ccccc3n2)C1	ZINC001025606344	1324455596	/nfs/dbraw/zinc/45/55/96/1324455596.db2.gz	DQRNUGGQLMISHW-AEFFLSMTSA-N	0	3	335.451	3.088	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc3c(s2)CCC3)C1	ZINC001025615036	1324468321	/nfs/dbraw/zinc/46/83/21/1324468321.db2.gz	RYKJOGLEZGKCAL-GOEBONIOSA-N	0	3	330.497	3.090	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc3c(s2)CCCC3)C1	ZINC001025614605	1324468462	/nfs/dbraw/zinc/46/84/62/1324468462.db2.gz	MNJJEVWMDJLOIX-GDBMZVCRSA-N	0	3	330.497	3.090	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cccc3cnccc32)C1	ZINC001025617087	1324469872	/nfs/dbraw/zinc/46/98/72/1324469872.db2.gz	DMIUZZGWCONSQF-FUHWJXTLSA-N	0	3	335.451	3.088	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(C)c3c2CCC3)C1	ZINC001025629768	1324480947	/nfs/dbraw/zinc/48/09/47/1324480947.db2.gz	KJYIYAFXFDWSCN-ROUUACIJSA-N	0	3	338.495	3.337	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2oc3ccccc3c2CC)C1	ZINC001025633583	1324485725	/nfs/dbraw/zinc/48/57/25/1324485725.db2.gz	WNBQNTKTRVDBSB-JKSUJKDBSA-N	0	3	338.451	3.459	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2c[nH]c3ccc(F)cc23)C1	ZINC001025635607	1324487867	/nfs/dbraw/zinc/48/78/67/1324487867.db2.gz	SSFXXNAINQPNQM-GJZGRUSLSA-N	0	3	341.430	3.161	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(CC)c(CC)c2)C1	ZINC001025637547	1324489018	/nfs/dbraw/zinc/48/90/18/1324489018.db2.gz	WRUCOSIXRCCVHN-OXQOHEQNSA-N	0	3	326.484	3.275	20	30		EGEDHN
CC1(CC(=O)N2C[C@@H]3CC[C@H](NCc4ccccc4C#N)[C@H]3C2)CC1	ZINC001026317965	1324722002	/nfs/dbraw/zinc/72/20/02/1324722002.db2.gz	QWMCHKQRRVOLFM-FHWLQOOXSA-N	0	3	337.467	3.075	20	30		EGEDHN
CC(C)(C)C(=O)N1C[C@@H]2CC[C@H](NCc3cc(F)ccc3C#N)[C@@H]2C1	ZINC001026406145	1324778597	/nfs/dbraw/zinc/77/85/97/1324778597.db2.gz	VHEPFISXKMZSOV-QGTPRVQTSA-N	0	3	343.446	3.070	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)c2ccc(Cl)o2)C1	ZINC001026685753	1324975212	/nfs/dbraw/zinc/97/52/12/1324975212.db2.gz	NIHIASGWNLVUCY-ZDUSSCGKSA-N	0	3	343.814	3.057	20	30		EGEDHN
CC1(CC(=O)N2CC[C@@H](CNCc3ccccc3C#N)C2)CCCC1	ZINC001026825042	1325035969	/nfs/dbraw/zinc/03/59/69/1325035969.db2.gz	ZIXUFNURNLBKMT-KRWDZBQOSA-N	0	3	339.483	3.467	20	30		EGEDHN
CC(C)(CC(=O)N1CC[C@@H](CNCc2ccccc2C#N)C1)C1CC1	ZINC001026827474	1325036625	/nfs/dbraw/zinc/03/66/25/1325036625.db2.gz	DFQLXJGUNTUGSP-INIZCTEOSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)c2conc2C)C1	ZINC000963356806	1325151925	/nfs/dbraw/zinc/15/19/25/1325151925.db2.gz	GWRSCOCBURIBLI-GDBMZVCRSA-N	0	3	337.851	3.052	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)c2nccs2)C1	ZINC000963374678	1325180647	/nfs/dbraw/zinc/18/06/47/1325180647.db2.gz	RRJQUWHDQJVDOU-ZIAGYGMSSA-N	0	3	339.892	3.212	20	30		EGEDHN
Cc1occc1C(=O)NC1CC2(CC(NCc3ccccc3C#N)C2)C1	ZINC000963536984	1325300243	/nfs/dbraw/zinc/30/02/43/1325300243.db2.gz	KQDIFMMYDAFQFD-UHFFFAOYSA-N	0	3	349.434	3.291	20	30		EGEDHN
C=C(Br)CNC1CC2(C1)CC(NC(=O)C1=CCCC1)C2	ZINC000963686019	1325375845	/nfs/dbraw/zinc/37/58/45/1325375845.db2.gz	XGRCMWIQVZLDRG-UHFFFAOYSA-N	0	3	339.277	3.022	20	30		EGEDHN
COc1ccc(CN(C)[C@H]2CCCN(C(=O)CC(C)C)C2)cc1C#N	ZINC001027277166	1325394997	/nfs/dbraw/zinc/39/49/97/1325394997.db2.gz	XFVWXSSYQATKKX-SFHVURJKSA-N	0	3	343.471	3.036	20	30		EGEDHN
Cc1ccoc1C(=O)N1CCC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001027300399	1325441798	/nfs/dbraw/zinc/44/17/98/1325441798.db2.gz	RCMMIPJMSACOAG-SFHVURJKSA-N	0	3	337.423	3.196	20	30		EGEDHN
CCCOc1cccc(CN(C)[C@H]2CCCN(C(=O)[C@@H](C)C#N)C2)c1	ZINC001027335068	1325493837	/nfs/dbraw/zinc/49/38/37/1325493837.db2.gz	BKWOSMLKLXZQKC-WMZOPIPTSA-N	0	3	343.471	3.058	20	30		EGEDHN
CN(Cc1ccc(C#N)c(F)c1)[C@@H]1CCCN(C(=O)CC2CCC2)C1	ZINC001027348317	1325513793	/nfs/dbraw/zinc/51/37/93/1325513793.db2.gz	YOPVJZJIKUUAIT-GOSISDBHSA-N	0	3	343.446	3.310	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)c(F)c2)C1	ZINC001027365374	1325555808	/nfs/dbraw/zinc/55/58/08/1325555808.db2.gz	SDZVQFUGWOGWGK-MRXNPFEDSA-N	0	3	347.409	3.384	20	30		EGEDHN
Cc1ccc(CO[C@@H](C)C(=O)C(C#N)C(=O)Nc2ccccc2)cc1	ZINC000860468695	1329321168	/nfs/dbraw/zinc/32/11/68/1329321168.db2.gz	FMCUNCJORJESIS-YJBOKZPZSA-N	0	3	336.391	3.248	20	30		EGEDHN
CCC(C#N)(CC)C(=O)Nc1cccc2c1CCN(CC(C)(C)O)C2	ZINC000860759945	1329352529	/nfs/dbraw/zinc/35/25/29/1329352529.db2.gz	DHTPZKDYKICECI-UHFFFAOYSA-N	0	3	343.471	3.084	20	30		EGEDHN
CC(=O)N[C@@H](c1ccccc1F)[C@H](C)NCc1ccc(C#N)c(F)c1	ZINC000926549759	1327612624	/nfs/dbraw/zinc/61/26/24/1327612624.db2.gz	IIIPODXLNHLWQX-HXPMCKFVSA-N	0	3	343.377	3.192	20	30		EGEDHN
CN(Cc1cc2ccccc2o1)[C@@H]1CCCN(C(=O)C#CC2CC2)C1	ZINC001027405583	1327632242	/nfs/dbraw/zinc/63/22/42/1327632242.db2.gz	ISMBPZDPLYPWRP-GOSISDBHSA-N	0	3	336.435	3.269	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)[C@@H]1Cc3ccc(F)cc31)C2	ZINC000964690477	1327652902	/nfs/dbraw/zinc/65/29/02/1327652902.db2.gz	NYJBQBZFVAEDPY-IDWHDZOISA-N	0	3	348.849	3.235	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)CC(C)(C)c2ccc(F)cc2)C1	ZINC001027442571	1327682621	/nfs/dbraw/zinc/68/26/21/1327682621.db2.gz	YFRLGWNHXJKYAE-SFHVURJKSA-N	0	3	330.447	3.049	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)Cc1cccc(C)c1)C2	ZINC000964776914	1327691214	/nfs/dbraw/zinc/69/12/14/1327691214.db2.gz	PZYIKSVZWYNYJW-UHFFFAOYSA-N	0	3	332.875	3.307	20	30		EGEDHN
Cc1cocc1C(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001027528755	1327808813	/nfs/dbraw/zinc/80/88/13/1327808813.db2.gz	BXFLTNDZJIOMRX-GOSISDBHSA-N	0	3	337.423	3.196	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)C2(C)CC=CC2)C1	ZINC001027559196	1327870861	/nfs/dbraw/zinc/87/08/61/1327870861.db2.gz	PUKPPSJRIWRTHF-IBGZPJMESA-N	0	3	337.467	3.337	20	30		EGEDHN
Cc1c([C@@H](C)NCCNc2ccc(C#N)cn2)cnn1-c1ccccc1	ZINC000927165635	1327903444	/nfs/dbraw/zinc/90/34/44/1327903444.db2.gz	QGQGPBUDKPRKHE-OAHLLOKOSA-N	0	3	346.438	3.210	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)cc2)C1)C(C)(F)F	ZINC001027580577	1327917478	/nfs/dbraw/zinc/91/74/78/1327917478.db2.gz	XVCAQQUOEBIQAI-PBHICJAKSA-N	0	3	349.425	3.272	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1ccncc1Cl)C2	ZINC000965251134	1327955762	/nfs/dbraw/zinc/95/57/62/1327955762.db2.gz	YWAKCBGQXRJADI-UHFFFAOYSA-N	0	3	340.254	3.118	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)c(F)c2)C1	ZINC001027604879	1327961085	/nfs/dbraw/zinc/96/10/85/1327961085.db2.gz	UDAOKCYKFIKIPJ-QAPCUYQASA-N	0	3	345.462	3.412	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)[C@@H](c2ccc(F)cc2)C(C)C)C1	ZINC001027697023	1328106950	/nfs/dbraw/zinc/10/69/50/1328106950.db2.gz	QZTAFMYURDLLSA-RTBURBONSA-N	0	3	330.447	3.121	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1ccc(C)nc1C)C2	ZINC000965928603	1328113200	/nfs/dbraw/zinc/11/32/00/1328113200.db2.gz	FLWWDOJQGBAGCP-UHFFFAOYSA-N	0	3	333.863	3.082	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2cc(C(F)F)ccc2F)C1	ZINC000966164537	1328211822	/nfs/dbraw/zinc/21/18/22/1328211822.db2.gz	CAEUXDIMBQQGEA-LRDDRELGSA-N	0	3	338.373	3.227	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2cccc(C(F)F)c2F)C1	ZINC000966165368	1328212824	/nfs/dbraw/zinc/21/28/24/1328212824.db2.gz	FTPWNSWKJCLSMS-WFASDCNBSA-N	0	3	338.373	3.227	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1c(C)occ1C(F)(F)F	ZINC001028030953	1328494337	/nfs/dbraw/zinc/49/43/37/1328494337.db2.gz	NAEXIUREIATHGO-GFCCVEGCSA-N	0	3	330.350	3.377	20	30		EGEDHN
C[C@H](c1ccccc1)[C@@H]1CCCN1CC(=O)N[C@@](C)(C#N)C1CC1	ZINC000932279655	1329803156	/nfs/dbraw/zinc/80/31/56/1329803156.db2.gz	RVYFVQYCFHZUIO-BPAFIMBUSA-N	0	3	325.456	3.063	20	30		EGEDHN
C#Cc1ccc(NC(=O)N[C@H](CN(C)C)c2ccc(OC)cc2)cc1	ZINC000934926093	1330018021	/nfs/dbraw/zinc/01/80/21/1330018021.db2.gz	FVUABAKMUPRCIA-LJQANCHMSA-N	0	3	337.423	3.101	20	30		EGEDHN
C#Cc1ccc(NC(=O)N2CCCN(Cc3ccccc3)CC2)cc1	ZINC000934937658	1330018727	/nfs/dbraw/zinc/01/87/27/1330018727.db2.gz	NTRFWBLYSGHAPJ-UHFFFAOYSA-N	0	3	333.435	3.408	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cncc(-c3ccccc3)c2)[C@@H](C)C1	ZINC000942106240	1331832181	/nfs/dbraw/zinc/83/21/81/1331832181.db2.gz	MTOIDHIPNOMKOG-UWJYYQICSA-N	0	3	347.462	3.212	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)c3ccccc3n2)[C@@H](C)C1	ZINC000942181184	1331864500	/nfs/dbraw/zinc/86/45/00/1331864500.db2.gz	QRBNKHBUASGWJH-WMZOPIPTSA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2c(C)cccc2Cl)[C@H](C)C1	ZINC000942272827	1331893536	/nfs/dbraw/zinc/89/35/36/1331893536.db2.gz	RYGVEDWGQKKRMI-QAPCUYQASA-N	0	3	332.875	3.041	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(OC)c(C(C)C)c2)[C@@H](C)C1	ZINC000942301309	1331897970	/nfs/dbraw/zinc/89/79/70/1331897970.db2.gz	FEPOBMPHCVIHLG-QFBILLFUSA-N	0	3	342.483	3.282	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cn(CC)c3ccccc23)[C@H](C)C1	ZINC000942394627	1331923961	/nfs/dbraw/zinc/92/39/61/1331923961.db2.gz	SWBUQRVZQUHIPC-CRAIPNDOSA-N	0	3	325.456	3.287	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3ccccc3cc2F)[C@@H](C)C1	ZINC000942442913	1331934971	/nfs/dbraw/zinc/93/49/71/1331934971.db2.gz	BGYRZCHFXQNCJV-MGPUTAFESA-N	0	3	338.426	3.442	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2c(C)occ2C(F)(F)F)[C@@H](C)C1	ZINC000942518104	1331950587	/nfs/dbraw/zinc/95/05/87/1331950587.db2.gz	MEYCAFMJIKQNHH-GWCFXTLKSA-N	0	3	330.350	3.233	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C)c3cccnc23)[C@@H](C)C1	ZINC000942522986	1331954412	/nfs/dbraw/zinc/95/44/12/1331954412.db2.gz	JSRXWGICQKOHMQ-QFBILLFUSA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3ccc(F)cc3)CCC2)[C@H](C)C1	ZINC000942547045	1331968543	/nfs/dbraw/zinc/96/85/43/1331968543.db2.gz	FIAOBOYEVQVWEI-VQIMIIECSA-N	0	3	342.458	3.097	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3cccc(C)c3)CCC2)[C@H](C)C1	ZINC000942551387	1331969807	/nfs/dbraw/zinc/96/98/07/1331969807.db2.gz	SJRDESPWJQEILZ-UYAOXDASSA-N	0	3	338.495	3.267	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3cccc(C)c3)CCC2)[C@@H](C)C1	ZINC000942551385	1331970033	/nfs/dbraw/zinc/97/00/33/1331970033.db2.gz	SJRDESPWJQEILZ-ICSRJNTNSA-N	0	3	338.495	3.267	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3cncc(C)c3)C[C@@H]2C)cc1	ZINC000942552485	1331970481	/nfs/dbraw/zinc/97/04/81/1331970481.db2.gz	FWIJCWXDXCPESK-UWJYYQICSA-N	0	3	347.462	3.012	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3cccc(C#N)c3)C[C@H]2C)C1	ZINC000942603015	1332000741	/nfs/dbraw/zinc/00/07/41/1332000741.db2.gz	QUFQUAZPZINCLZ-APWZRJJASA-N	0	3	337.467	3.241	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(F)cc3cccnc32)[C@H](C)C1	ZINC000943210778	1332122614	/nfs/dbraw/zinc/12/26/14/1332122614.db2.gz	VWCFAQYBYNHAQV-DYVFJYSZSA-N	0	3	327.403	3.000	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2)[C@H](C)C1	ZINC000944282325	1332363159	/nfs/dbraw/zinc/36/31/59/1332363159.db2.gz	VLEMBZGINZOTDF-CZUORRHYSA-N	0	3	338.373	3.169	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(Cl)cc(Cl)c2)[C@H](C)C1	ZINC000944318375	1332372634	/nfs/dbraw/zinc/37/26/34/1332372634.db2.gz	PGXLZJCUKUTHNO-WBMJQRKESA-N	0	3	339.266	3.457	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2csc3c2CCCC3)[C@H](C)C1	ZINC000944698278	1332422565	/nfs/dbraw/zinc/42/25/65/1332422565.db2.gz	FAQHOTAUCRSNFW-RHSMWYFYSA-N	0	3	330.497	3.090	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(CCC)c(C)s2)[C@H](C)C1	ZINC000944789929	1332424201	/nfs/dbraw/zinc/42/42/01/1332424201.db2.gz	MNEGXPQVRSXZIS-PBHICJAKSA-N	0	3	332.513	3.473	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(F)c3occc32)[C@H](C)C1	ZINC000945030131	1332481516	/nfs/dbraw/zinc/48/15/16/1332481516.db2.gz	WMWVFCXTXKEGPJ-CXAGYDPISA-N	0	3	328.387	3.035	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2c3ccccc3oc2CC)[C@@H](C)C1	ZINC000945178710	1332525716	/nfs/dbraw/zinc/52/57/16/1332525716.db2.gz	GMYXQLZLUFLSHZ-DOTOQJQBSA-N	0	3	338.451	3.459	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(-c3ccccc3)[nH]2)[C@@H](C)C1	ZINC000945806547	1332678653	/nfs/dbraw/zinc/67/86/53/1332678653.db2.gz	DZZJEANXKZTRCT-FUHWJXTLSA-N	0	3	335.451	3.145	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C(C)(F)F)cc2)[C@@H](C)C1	ZINC000946310296	1332784098	/nfs/dbraw/zinc/78/40/98/1332784098.db2.gz	DURXIZRKHJXEHS-WMLDXEAASA-N	0	3	334.410	3.262	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3ncccc3CC)CC[C@@H]2C1	ZINC000946654012	1332871721	/nfs/dbraw/zinc/87/17/21/1332871721.db2.gz	SBKWTZGNISNGFB-CALCHBBNSA-N	0	3	347.890	3.181	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@@H](C)C2)cn1	ZINC000947053233	1332991618	/nfs/dbraw/zinc/99/16/18/1332991618.db2.gz	WSBIKWQQODCWNX-OXJNMPFZSA-N	0	3	348.450	3.045	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)C2CC(F)(F)C2)CCN1Cc1cccc(C#N)c1	ZINC000947169945	1333034138	/nfs/dbraw/zinc/03/41/38/1333034138.db2.gz	AQXLRSFDPORBDD-CXAGYDPISA-N	0	3	347.409	3.073	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)C2CC(C)(C)C2)CCN1Cc1cccc(C#N)c1	ZINC000947271492	1333072244	/nfs/dbraw/zinc/07/22/44/1333072244.db2.gz	JFWGJIYPMNBPSH-HNAYVOBHSA-N	0	3	339.483	3.464	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)C2CC(C)(C)C2)CCN1Cc1cccc(C#N)c1	ZINC000947271490	1333072837	/nfs/dbraw/zinc/07/28/37/1333072837.db2.gz	JFWGJIYPMNBPSH-BEFAXECRSA-N	0	3	339.483	3.464	20	30		EGEDHN
Cc1cnccc1C(=O)N[C@@H]1CCN(Cc2ccc(C#N)cc2)[C@H](C)C1	ZINC000947282266	1333076880	/nfs/dbraw/zinc/07/68/80/1333076880.db2.gz	NVXSGPGQHMBKFK-VQIMIIECSA-N	0	3	348.450	3.045	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2c(F)ccc3ccncc32)C[C@@H]1C	ZINC000947328346	1333091351	/nfs/dbraw/zinc/09/13/51/1333091351.db2.gz	QMSHOAYXIOBALX-ZFWWWQNUSA-N	0	3	327.403	3.143	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc(OCCC)c2)C[C@H]1C	ZINC000947365840	1333105272	/nfs/dbraw/zinc/10/52/72/1333105272.db2.gz	UYBDDVJXLMYZBG-AEFFLSMTSA-N	0	3	328.456	3.081	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)C2(C3CC3)CC2)CCN1Cc1cccc(C#N)c1	ZINC000947426229	1333123464	/nfs/dbraw/zinc/12/34/64/1333123464.db2.gz	OIWJMSCFNRCHKT-HNAYVOBHSA-N	0	3	337.467	3.218	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc(-c3cnco3)cc2)C[C@H]1C	ZINC000947450762	1333133089	/nfs/dbraw/zinc/13/30/89/1333133089.db2.gz	YNXFBCRWWCFHDZ-PBHICJAKSA-N	0	3	325.412	3.110	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)Cc2ccccc2)CCN1Cc1ccc(C#N)cc1	ZINC000947455609	1333135691	/nfs/dbraw/zinc/13/56/91/1333135691.db2.gz	UVKHQHWESHGKBO-UTKZUKDTSA-N	0	3	347.462	3.270	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2cccc(C(C)C)c2)C[C@H]1C	ZINC000947498766	1333147727	/nfs/dbraw/zinc/14/77/27/1333147727.db2.gz	YQVIVUKTGVYYQL-XLIONFOSSA-N	0	3	326.484	3.345	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(CCC(F)(F)F)[C@@H](C)C2)cc1	ZINC000947612110	1333192729	/nfs/dbraw/zinc/19/27/29/1333192729.db2.gz	UAAGOSDWWXMNGN-BBRMVZONSA-N	0	3	338.373	3.203	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)C(C)(C)C2CC2)CCN1Cc1ccc(C#N)cc1	ZINC000947635574	1333202844	/nfs/dbraw/zinc/20/28/44/1333202844.db2.gz	VWVRLHBNBZFYFX-DNVCBOLYSA-N	0	3	339.483	3.464	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(OC)c(C3CC3)c2)C[C@H]1C	ZINC000947868718	1333286054	/nfs/dbraw/zinc/28/60/54/1333286054.db2.gz	YEBKTRCMZBOMGX-CRAIPNDOSA-N	0	3	340.467	3.179	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc3nc(C)sc3c2)C[C@@H]1C	ZINC000947894456	1333295386	/nfs/dbraw/zinc/29/53/86/1333295386.db2.gz	AGSVTEMEDMHMQA-WFASDCNBSA-N	0	3	329.469	3.373	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(OCC(C)C)cc2)C[C@@H]1C	ZINC000948002318	1333338679	/nfs/dbraw/zinc/33/86/79/1333338679.db2.gz	OGORBKNUGYFXFG-HKUYNNGSSA-N	0	3	342.483	3.327	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3c(s2)CCCC3)C[C@@H]1C	ZINC000948001735	1333338944	/nfs/dbraw/zinc/33/89/44/1333338944.db2.gz	FAAXAILKVLAOPJ-GOEBONIOSA-N	0	3	330.497	3.233	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2c[nH]cc2-c2ccccc2)C[C@@H]1C	ZINC000948035140	1333348447	/nfs/dbraw/zinc/34/84/47/1333348447.db2.gz	CSCWSYABKOTCJJ-WMZOPIPTSA-N	0	3	335.451	3.288	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(OCC3CC3)cc2)C[C@H]1C	ZINC000948039464	1333349639	/nfs/dbraw/zinc/34/96/39/1333349639.db2.gz	HLVONKNRSYULFO-APWZRJJASA-N	0	3	340.467	3.081	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](NC(=O)c2ccccc2CN(C)C)C[C@@H]1C	ZINC000948070347	1333364612	/nfs/dbraw/zinc/36/46/12/1333364612.db2.gz	OOVORDGVTXTZNQ-RDJZCZTQSA-N	0	3	349.906	3.083	20	30		EGEDHN
CN(C(=O)C1=CCCC1)[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948295585	1333468922	/nfs/dbraw/zinc/46/89/22/1333468922.db2.gz	YFEMOFNDQIUBMO-HXUWFJFHSA-N	0	3	337.467	3.481	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)C2(c3cccc(Cl)c3)CC2)CC1	ZINC000948426067	1333520751	/nfs/dbraw/zinc/52/07/51/1333520751.db2.gz	UQPNXMMMIGHWEZ-GOSISDBHSA-N	0	3	344.886	3.318	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2c(C)occ2C(F)(F)F)CC1	ZINC000948621656	1333600443	/nfs/dbraw/zinc/60/04/43/1333600443.db2.gz	TYNDTYJVXKYHIC-CYBMUJFWSA-N	0	3	342.361	3.167	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@@H]2CCCN(Cc3ccccn3)CC2)cc1	ZINC000948665980	1333621777	/nfs/dbraw/zinc/62/17/77/1333621777.db2.gz	XHAOTFYHOWOOEZ-OAQYLSRUSA-N	0	3	347.462	3.190	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@H]2CCCN(Cc3oc(C)nc3C)CC2)C1	ZINC000948753752	1333663045	/nfs/dbraw/zinc/66/30/45/1333663045.db2.gz	PJNCQEBZNHRSGB-KRWDZBQOSA-N	0	3	345.487	3.461	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2cc(C(C)(C)C)oc2C)CC1	ZINC000948805379	1333688649	/nfs/dbraw/zinc/68/86/49/1333688649.db2.gz	ZKFUYGVUZDNLEO-MRXNPFEDSA-N	0	3	330.472	3.445	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)[C@@H]2C[C@H]2c2cccc(C)c2)CC1	ZINC000948848439	1333708721	/nfs/dbraw/zinc/70/87/21/1333708721.db2.gz	BRMNHQTWLFLZBC-QHAWAJNXSA-N	0	3	338.495	3.435	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)[C@H](C)c2cc(C)oc2C)CC1	ZINC000948860513	1333711594	/nfs/dbraw/zinc/71/15/94/1333711594.db2.gz	DZEVMVYIVKYKBH-AEFFLSMTSA-N	0	3	330.472	3.336	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@H]1CNC(=O)c1cscn1	ZINC000948899442	1333725405	/nfs/dbraw/zinc/72/54/05/1333725405.db2.gz	WYHZLWGLWWTPHF-GOSISDBHSA-N	0	3	341.480	3.439	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@H]1CNC(=O)c1cc(F)c[nH]1	ZINC000948939966	1333741787	/nfs/dbraw/zinc/74/17/87/1333741787.db2.gz	CBHIDNOVATUWAQ-GOSISDBHSA-N	0	3	327.403	3.059	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@@H]1CNC(=O)[C@H]1CC[C@@H](C)O1	ZINC000948960120	1333748777	/nfs/dbraw/zinc/74/87/77/1333748777.db2.gz	BOUGYSLZIAJGTI-LSTHTHJFSA-N	0	3	342.483	3.236	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccc(Cl)cc1C)CCO2	ZINC000949177260	1333789333	/nfs/dbraw/zinc/78/93/33/1333789333.db2.gz	MNOIDVSHLMVYCT-UHFFFAOYSA-N	0	3	348.874	3.141	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3ccc(C)c(F)c3)CC2)C1	ZINC000949408926	1333839919	/nfs/dbraw/zinc/83/99/19/1333839919.db2.gz	PBVBXCYARDMZNG-UHFFFAOYSA-N	0	3	346.446	3.017	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C3(C)CCCC3)CC2)C1	ZINC000949427751	1333845215	/nfs/dbraw/zinc/84/52/15/1333845215.db2.gz	XTINXBOXUAICTP-UHFFFAOYSA-N	0	3	334.504	3.226	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@]3(C)C=CCC3)CC2)C1	ZINC000949441411	1333847837	/nfs/dbraw/zinc/84/78/37/1333847837.db2.gz	SUVXYLYVHFQSCE-LJQANCHMSA-N	0	3	332.488	3.002	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3ccccc3CC)CC2)C1	ZINC000949451446	1333850802	/nfs/dbraw/zinc/85/08/02/1333850802.db2.gz	ZLNYCEUZNRPOED-UHFFFAOYSA-N	0	3	342.483	3.132	20	30		EGEDHN
C=C[C@H](C(=O)N1CCC2(CC1)CN(C(C)C)CCO2)c1ccccc1	ZINC000949529174	1333868096	/nfs/dbraw/zinc/86/80/96/1333868096.db2.gz	MFHPUKYXHJHECG-IBGZPJMESA-N	0	3	342.483	3.058	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2coc3ccc(OC)cc23)C1	ZINC000967308155	1335695379	/nfs/dbraw/zinc/69/53/79/1335695379.db2.gz	CKPCJUUXWYWTRD-KDOFPFPSSA-N	0	3	342.439	3.458	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2nc(Cl)sc2Cl)C1	ZINC000967720120	1335806402	/nfs/dbraw/zinc/80/64/02/1335806402.db2.gz	IQXXHJVLHUZZKN-VHSXEESVSA-N	0	3	348.299	3.466	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)Cc2cn(C)c3ccccc23)C1	ZINC000968104608	1335857637	/nfs/dbraw/zinc/85/76/37/1335857637.db2.gz	GMYSYPJJNRMGDK-QFBILLFUSA-N	0	3	339.483	3.124	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CN(Cc3ccccc3C)CC[C@@H]2C)c1	ZINC000968318399	1335889027	/nfs/dbraw/zinc/88/90/27/1335889027.db2.gz	UQLOYAPVLSIGKS-LAUBAEHRSA-N	0	3	347.462	3.012	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2ccc(OCC)c(C)c2)C1	ZINC000968375385	1335909183	/nfs/dbraw/zinc/90/91/83/1335909183.db2.gz	WECYKEXPEBSEMP-MAUKXSAKSA-N	0	3	330.472	3.410	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2oc(CC(C)C)nc2C)C1	ZINC000968401623	1335921165	/nfs/dbraw/zinc/92/11/65/1335921165.db2.gz	ZKFWHBOASUNLAE-GDBMZVCRSA-N	0	3	333.476	3.198	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2occc2Br)C1	ZINC000968426054	1335926131	/nfs/dbraw/zinc/92/61/31/1335926131.db2.gz	ANDDXZPSUKWWPB-DGCLKSJQSA-N	0	3	341.249	3.058	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2cccc3c2ccn3C)C1	ZINC000968423638	1335925967	/nfs/dbraw/zinc/92/59/67/1335925967.db2.gz	VCTSRWPYRWFKSY-QAPCUYQASA-N	0	3	325.456	3.195	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2c[nH]nc2-c2ccsc2)C1	ZINC000968480540	1335936624	/nfs/dbraw/zinc/93/66/24/1335936624.db2.gz	NTGMZQBQTZGHAF-BBRMVZONSA-N	0	3	344.484	3.155	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2[nH]c3ccc(C)cc3c2C)C1	ZINC000968488768	1335938994	/nfs/dbraw/zinc/93/89/94/1335938994.db2.gz	LSDXBAWPJOTHEM-HNAYVOBHSA-N	0	3	337.467	3.248	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2cc3cccnc3s2)C1	ZINC000968501699	1335944109	/nfs/dbraw/zinc/94/41/09/1335944109.db2.gz	ZEKYYHJRXLZFMY-DZGCQCFKSA-N	0	3	329.469	3.313	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)Cc2cccc(OCCC)c2)C1	ZINC000968517012	1335949888	/nfs/dbraw/zinc/94/98/88/1335949888.db2.gz	HLOYYJVXZAXOBV-XLIONFOSSA-N	0	3	344.499	3.421	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CN(Cc3ccccc3C)CC[C@H]2C)nc1	ZINC000968549914	1335960070	/nfs/dbraw/zinc/96/00/70/1335960070.db2.gz	ZZFSCMWJUKKOTC-DYESRHJHSA-N	0	3	347.462	3.012	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC000968579807	1335970459	/nfs/dbraw/zinc/97/04/59/1335970459.db2.gz	QKSCBSWUSYOBHP-BBRMVZONSA-N	0	3	338.373	3.169	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2ccc(Br)o2)C1	ZINC000968584210	1335972927	/nfs/dbraw/zinc/97/29/27/1335972927.db2.gz	VAOXIOQHZKCUED-NWDGAFQWSA-N	0	3	341.249	3.058	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2csc3c2CCCC3)C1	ZINC000968620750	1335986061	/nfs/dbraw/zinc/98/60/61/1335986061.db2.gz	YVTIYASUWSZIIT-YOEHRIQHSA-N	0	3	330.497	3.090	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)C2(c3ccc(Cl)cc3)CC2)C1	ZINC000968624809	1335988807	/nfs/dbraw/zinc/98/88/07/1335988807.db2.gz	ZOAWSSYTAPWPKM-CRAIPNDOSA-N	0	3	344.886	3.222	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)Cn2ccc3ccccc32)C1	ZINC000968664967	1336002312	/nfs/dbraw/zinc/00/23/12/1336002312.db2.gz	KULWWJPMFVWKDN-SJLPKXTDSA-N	0	3	325.456	3.044	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2c[nH]c3c2cccc3CC)C1	ZINC000968680979	1336009025	/nfs/dbraw/zinc/00/90/25/1336009025.db2.gz	FRIZDOGAONWNPU-DNVCBOLYSA-N	0	3	337.467	3.194	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)C2(c3ccc(C)cc3)CCC2)C1	ZINC000968691606	1336013081	/nfs/dbraw/zinc/01/30/81/1336013081.db2.gz	HSVHGDZDBJMEHU-AZUAARDMSA-N	0	3	338.495	3.267	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)C2(c3ccc(C)cc3)CCC2)C1	ZINC000968691609	1336013156	/nfs/dbraw/zinc/01/31/56/1336013156.db2.gz	HSVHGDZDBJMEHU-UYAOXDASSA-N	0	3	338.495	3.267	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2csc(CC(C)C)n2)C1	ZINC000968694844	1336014382	/nfs/dbraw/zinc/01/43/82/1336014382.db2.gz	BIWQUNSRHPPCRQ-HUUCEWRRSA-N	0	3	335.517	3.358	20	30		EGEDHN
N#Cc1cccc(CN2CCCCC[C@@H]2CNC(=O)C2CCC2)c1	ZINC000968727113	1336026534	/nfs/dbraw/zinc/02/65/34/1336026534.db2.gz	KSRQLDFDVFGBAW-LJQANCHMSA-N	0	3	325.456	3.219	20	30		EGEDHN
N#Cc1cccc(CN2CCCCC[C@@H]2CNC(=O)C2CC=CC2)c1	ZINC000968790433	1336051341	/nfs/dbraw/zinc/05/13/41/1336051341.db2.gz	FNEOGNNDJYEJJU-HXUWFJFHSA-N	0	3	337.467	3.385	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccc2cc(C)cn2c1	ZINC000968888619	1336080673	/nfs/dbraw/zinc/08/06/73/1336080673.db2.gz	WYXWMROCZPBOPZ-LJQANCHMSA-N	0	3	325.456	3.408	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cc2ccccc2c(=O)[nH]1	ZINC000968891448	1336082374	/nfs/dbraw/zinc/08/23/74/1336082374.db2.gz	YYNIZSBJPCKXKR-MRXNPFEDSA-N	0	3	339.439	3.101	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)[C@H]1CCN(C)c2ccccc21	ZINC000968893848	1336083304	/nfs/dbraw/zinc/08/33/04/1336083304.db2.gz	SAASIMWWERTFSX-HKUYNNGSSA-N	0	3	341.499	3.157	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)[C@H]1CCCc2ccccc21	ZINC000968917204	1336088318	/nfs/dbraw/zinc/08/83/18/1336088318.db2.gz	QEYGXMQNKFEYQD-FPOVZHCZSA-N	0	3	338.495	3.491	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cc2c(cn1)CCCC2	ZINC000968942496	1336098386	/nfs/dbraw/zinc/09/83/86/1336098386.db2.gz	WWZVYCIQVSMSGP-GOSISDBHSA-N	0	3	327.472	3.121	20	30		EGEDHN
C#CCCN1CCCCC[C@@H]1CNC(=O)c1scnc1C1CC1	ZINC000969062110	1336134483	/nfs/dbraw/zinc/13/44/83/1336134483.db2.gz	JAMIFXHXQWNUMS-OAHLLOKOSA-N	0	3	331.485	3.018	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cc(-n2cccc2)ccn1	ZINC000969103202	1336143947	/nfs/dbraw/zinc/14/39/47/1336143947.db2.gz	FSODDRMOURVCMD-SFHVURJKSA-N	0	3	338.455	3.033	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1ccc2ccn(C)c2c1	ZINC000969103256	1336144594	/nfs/dbraw/zinc/14/45/94/1336144594.db2.gz	KBECERTZHZYXSW-LJQANCHMSA-N	0	3	337.467	3.176	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccnc(OC(C)C)c1	ZINC000969111787	1336148322	/nfs/dbraw/zinc/14/83/22/1336148322.db2.gz	SOHADPONHNNQKU-KRWDZBQOSA-N	0	3	331.460	3.029	20	30		EGEDHN
C#CCCN1CCCCC[C@@H]1CNC(=O)c1cnc(C(C)(C)C)s1	ZINC000969158585	1336166368	/nfs/dbraw/zinc/16/63/68/1336166368.db2.gz	OZOUQCDFPXULQA-OAHLLOKOSA-N	0	3	347.528	3.438	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CC[C@@H](NCc3cc(C)ccc3F)C2)cc1	ZINC000969546416	1336221749	/nfs/dbraw/zinc/22/17/49/1336221749.db2.gz	YPYRUIHSRNOINA-LJQANCHMSA-N	0	3	336.410	3.120	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)c2cc(C(F)F)ccc2F)C1	ZINC000969676757	1336236362	/nfs/dbraw/zinc/23/63/62/1336236362.db2.gz	IGPKFOHLUUAMIF-NSHDSACASA-N	0	3	326.362	3.390	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H](C)C1CN(CC2=CCCCC2)C1	ZINC000969843072	1336253417	/nfs/dbraw/zinc/25/34/17/1336253417.db2.gz	VZVOZNPMJXQRBG-INIZCTEOSA-N	0	3	327.472	3.225	20	30		EGEDHN
C#CCCN1CC([C@H](C)NC(=O)c2ccccc2C(C)(C)CC)C1	ZINC000969922194	1336260654	/nfs/dbraw/zinc/26/06/54/1336260654.db2.gz	IKPDRQOWSFYYBI-INIZCTEOSA-N	0	3	326.484	3.448	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)c2ccccc2-c2ccncc2)C1	ZINC000969956952	1336266150	/nfs/dbraw/zinc/26/61/50/1336266150.db2.gz	BKHVPTHUPKWKTA-INIZCTEOSA-N	0	3	335.451	3.375	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H](C)C2CN([C@H](C)c3cccc(C)c3)C2)c1	ZINC000970400900	1336304097	/nfs/dbraw/zinc/30/40/97/1336304097.db2.gz	HSZKDIIDRUASOS-DLBZAZTESA-N	0	3	347.462	3.183	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)c2c[nH]nc2C2CCCCC2)C1	ZINC000970714268	1336334888	/nfs/dbraw/zinc/33/48/88/1336334888.db2.gz	OLZPUNVVUOHLPQ-AWEZNQCLSA-N	0	3	330.476	3.084	20	30		EGEDHN
CC1=CC[C@](C)(C(=O)N2CC[C@@H](NCc3ccc(C#N)s3)C2)CC1	ZINC000970773138	1336336969	/nfs/dbraw/zinc/33/69/69/1336336969.db2.gz	RDTCYZDDHLZPHP-BEFAXECRSA-N	0	3	343.496	3.447	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2ocnc2-c2ccccc2)CC1	ZINC001005489923	1336360049	/nfs/dbraw/zinc/36/00/49/1336360049.db2.gz	WHLQPQKROKVTSB-UHFFFAOYSA-N	0	3	325.412	3.064	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cn(C)c3ccc(F)cc23)CC1	ZINC001005512222	1336364724	/nfs/dbraw/zinc/36/47/24/1336364724.db2.gz	MCKUCKSVOLRGFO-UHFFFAOYSA-N	0	3	329.419	3.040	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2c(C)occ2C(F)(F)F)CC1	ZINC001005712303	1336396341	/nfs/dbraw/zinc/39/63/41/1336396341.db2.gz	CICXWPNFPSZLBD-UHFFFAOYSA-N	0	3	330.350	3.329	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2ccc(F)c3ccncc23)CC1	ZINC001005869630	1336413260	/nfs/dbraw/zinc/41/32/60/1336413260.db2.gz	BQGQMTWNVYJXOQ-UHFFFAOYSA-N	0	3	327.403	3.096	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2csc(-c3ccco3)n2)CC1	ZINC001005896626	1336418129	/nfs/dbraw/zinc/41/81/29/1336418129.db2.gz	MAMKFRPCKQKGHJ-UHFFFAOYSA-N	0	3	331.441	3.126	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2c(F)ccc(F)c2F)CC1	ZINC001005908602	1336420647	/nfs/dbraw/zinc/42/06/47/1336420647.db2.gz	XHSBPBIZIBMJMB-UHFFFAOYSA-N	0	3	326.362	3.216	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccc(C)nc2OCCC)CC1	ZINC001006216373	1336467987	/nfs/dbraw/zinc/46/79/87/1336467987.db2.gz	FUOIMCZMVVMXAP-UHFFFAOYSA-N	0	3	345.487	3.291	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cnn(CCCC)c2CC)CC1	ZINC001006264360	1336478646	/nfs/dbraw/zinc/47/86/46/1336478646.db2.gz	BMNKWTNUHLYSEH-UHFFFAOYSA-N	0	3	346.519	3.358	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C2CCN(Cc3ccc(C)cc3)CC2)nc1	ZINC001006304319	1336486953	/nfs/dbraw/zinc/48/69/53/1336486953.db2.gz	XVJNPAIIDGUAGM-UHFFFAOYSA-N	0	3	347.462	3.108	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cnn(C(C)(C)C)c2CC)CC1	ZINC001006416205	1336501585	/nfs/dbraw/zinc/50/15/85/1336501585.db2.gz	JSSWLPORMKYQAE-UHFFFAOYSA-N	0	3	346.519	3.313	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cscc2C(F)(F)F)CC1	ZINC001006492657	1336516525	/nfs/dbraw/zinc/51/65/25/1336516525.db2.gz	YPEBWDIINGUJPX-UHFFFAOYSA-N	0	3	332.391	3.489	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)C[C@@H]2C[C@H]2c2ccc(OC)cc2)C1	ZINC001007527193	1336664234	/nfs/dbraw/zinc/66/42/34/1336664234.db2.gz	LCAGLLRJMQJMKV-NSHGMRRFSA-N	0	3	342.483	3.346	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@H]2CCCN(CC[C@H](C)F)C2)cc1	ZINC001007668617	1336686303	/nfs/dbraw/zinc/68/63/03/1336686303.db2.gz	JKBRQBAFVXLFOG-RDJZCZTQSA-N	0	3	334.435	3.194	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2ccccc2OCC(C)C)C1	ZINC001008903491	1336941009	/nfs/dbraw/zinc/94/10/09/1336941009.db2.gz	YNIMYURINDXECW-QGZVFWFLSA-N	0	3	330.472	3.492	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2cnoc2-c2ccccc2)C1	ZINC001009045771	1336959819	/nfs/dbraw/zinc/95/98/19/1336959819.db2.gz	PAUCCCZDGGQGAU-MRXNPFEDSA-N	0	3	325.412	3.112	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN([C@@H](C)c3ccccc3C)C2)nc1	ZINC001009254386	1336991624	/nfs/dbraw/zinc/99/16/24/1336991624.db2.gz	QZHHLPMBSAMFRK-PKOBYXMFSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCN(Cc3ccc(C)cc3C)C2)cn1	ZINC001009278616	1336995636	/nfs/dbraw/zinc/99/56/36/1336995636.db2.gz	VCZAQIRLECZWTE-NRFANRHFSA-N	0	3	347.462	3.074	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(CCCc3ccsc3)C2)cc1	ZINC001015483001	1338155659	/nfs/dbraw/zinc/15/56/59/1338155659.db2.gz	TXLJNHBBECPARA-LJQANCHMSA-N	0	3	338.476	3.166	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN([C@H](CC)c3ccccc3)C2)cn1	ZINC001016016821	1338407907	/nfs/dbraw/zinc/40/79/07/1338407907.db2.gz	OCUIVGYPMQFMSC-WOJBJXKFSA-N	0	3	333.435	3.018	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(Cc3ccccc3C(C)C)C2)cn1	ZINC001016032991	1338417975	/nfs/dbraw/zinc/41/79/75/1338417975.db2.gz	HHTQTCRXXZFYHX-HXUWFJFHSA-N	0	3	347.462	3.191	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)[C@@H]2C[C@H]2c2sccc2C)CC1	ZINC001016620032	1338667492	/nfs/dbraw/zinc/66/74/92/1338667492.db2.gz	GBSDMNIOFYJNBJ-BRWVUGGUSA-N	0	3	342.508	3.154	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cc(C)c3ccccc3n2)CC1	ZINC001016687629	1338690385	/nfs/dbraw/zinc/69/03/85/1338690385.db2.gz	KVMFCVGUPPSCRY-HXUWFJFHSA-N	0	3	347.462	3.151	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)[C@@H](C)c2ccc(Cl)cc2)CC1	ZINC001016809057	1338733411	/nfs/dbraw/zinc/73/34/11/1338733411.db2.gz	UIAOJHYIPVNFIR-MAUKXSAKSA-N	0	3	344.886	3.438	20	30		EGEDHN
CC1(C(=O)N[C@H]2CC23CCN(Cc2cccc(C#N)c2)CC3)CC=CC1	ZINC001016811420	1338734552	/nfs/dbraw/zinc/73/45/52/1338734552.db2.gz	SJMYERQSMOLTCQ-IBGZPJMESA-N	0	3	349.478	3.385	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CC23CCN(CCC(F)(F)F)CC3)C1	ZINC001016818005	1338737124	/nfs/dbraw/zinc/73/71/24/1338737124.db2.gz	QWSLYHKGWPRRNY-CYBMUJFWSA-N	0	3	330.394	3.266	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@@H]3NC(=O)C3CC4(CC4)C3)CC2)c1	ZINC001016821692	1338738974	/nfs/dbraw/zinc/73/89/74/1338738974.db2.gz	UEQWNMZMTFZIPO-IBGZPJMESA-N	0	3	349.478	3.219	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)Cc2cccc3sccc32)CC1	ZINC001016855863	1338749047	/nfs/dbraw/zinc/74/90/47/1338749047.db2.gz	NCZSQLLUOWSXCD-SFHVURJKSA-N	0	3	338.476	3.048	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)Cc2c[nH]c3cccc(C)c23)CC1	ZINC001016929986	1338773113	/nfs/dbraw/zinc/77/31/13/1338773113.db2.gz	HGTTXQVIJPLVHO-IBGZPJMESA-N	0	3	349.478	3.013	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cccc(C(F)F)c2)CC1	ZINC001016941842	1338777837	/nfs/dbraw/zinc/77/78/37/1338777837.db2.gz	VANKRGNVLLKVST-INIZCTEOSA-N	0	3	332.394	3.232	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2cc(CCC)c(C)s2)CC1	ZINC001016965811	1338786914	/nfs/dbraw/zinc/78/69/14/1338786914.db2.gz	SPGFOHLOXODGDM-QGZVFWFLSA-N	0	3	330.497	3.227	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2sccc2C(C)C)CC1	ZINC001016982876	1338791677	/nfs/dbraw/zinc/79/16/77/1338791677.db2.gz	NCASEPSTDYFPIP-INIZCTEOSA-N	0	3	330.497	3.479	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)C2(c3ccc(C)cc3)CCC2)CC1	ZINC001016994799	1338797828	/nfs/dbraw/zinc/79/78/28/1338797828.db2.gz	VZSBVBVSUWIUGA-IBGZPJMESA-N	0	3	336.479	3.021	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H](CN(C)Cc2cccnc2)C1	ZINC001017177370	1338920814	/nfs/dbraw/zinc/92/08/14/1338920814.db2.gz	SFNMGXQMAUAQHO-SFHVURJKSA-N	0	3	329.488	3.354	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](CN(C)Cc2c(C)noc2C)C1	ZINC001017179585	1338923020	/nfs/dbraw/zinc/92/30/20/1338923020.db2.gz	LBUDHEDHELQMER-INIZCTEOSA-N	0	3	333.476	3.174	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H](CN(C)Cc2cccnc2)C1	ZINC001017197032	1338942269	/nfs/dbraw/zinc/94/22/69/1338942269.db2.gz	MNTQVMHHRNYGCN-AZUAARDMSA-N	0	3	329.488	3.354	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H](CN(C)Cc2cnoc2C)C1	ZINC001017202470	1338948384	/nfs/dbraw/zinc/94/83/84/1338948384.db2.gz	XSEXQTOSMYCNBD-LPHOPBHVSA-N	0	3	333.476	3.256	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1c(C)cccc1C	ZINC001017589516	1339373990	/nfs/dbraw/zinc/37/39/90/1339373990.db2.gz	CEORDMQLKVBRIJ-KDURUIRLSA-N	0	3	326.484	3.487	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)c1c(C)noc1C	ZINC001018061404	1339492757	/nfs/dbraw/zinc/49/27/57/1339492757.db2.gz	OBGRABRANWRHQK-RRQGHBQHSA-N	0	3	331.460	3.036	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1C[C@@]12CCc1ccccc12	ZINC001018122073	1339506051	/nfs/dbraw/zinc/50/60/51/1339506051.db2.gz	FEHYQVMWNRFEKU-GXKRZCMTSA-N	0	3	336.479	3.142	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)CCc1ccc(CC)cc1	ZINC001018258097	1339552669	/nfs/dbraw/zinc/55/26/69/1339552669.db2.gz	HPONVWZSNNVJTJ-BGYRXZFFSA-N	0	3	326.484	3.433	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1	ZINC001018318358	1339574672	/nfs/dbraw/zinc/57/46/72/1339574672.db2.gz	BCSAINBPSULNBF-ZSYWTGECSA-N	0	3	328.431	3.181	20	30		EGEDHN
Cc1cscc1C(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001018680160	1339700105	/nfs/dbraw/zinc/70/01/05/1339700105.db2.gz	WBWKNMKNMOSOLW-HNNXBMFYSA-N	0	3	343.427	3.072	20	30		EGEDHN
CC1=C(C)C[C@H](C(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)CC1	ZINC001018903184	1339747404	/nfs/dbraw/zinc/74/74/04/1339747404.db2.gz	VYQCDGWZBXUAFV-CVEARBPZSA-N	0	3	343.496	3.447	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1ccc(F)c(Cl)c1F	ZINC001028114867	1340436074	/nfs/dbraw/zinc/43/60/74/1340436074.db2.gz	RGNUAWHIWOSHAG-NSHDSACASA-N	0	3	328.790	3.389	20	30		EGEDHN
C#CCCN1CCC[C@@H]1CNC(=O)c1oc2ccccc2c1Cl	ZINC001028255289	1340514950	/nfs/dbraw/zinc/51/49/50/1340514950.db2.gz	KKKHIHKPNKUNAL-CYBMUJFWSA-N	0	3	330.815	3.304	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@@H]1CCN(Cc2ccccc2F)C1	ZINC001028592644	1340717389	/nfs/dbraw/zinc/71/73/89/1340717389.db2.gz	ABWZBOIHGIEJIF-INIZCTEOSA-N	0	3	341.430	3.065	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H](CNC(=O)C3CCC(F)CC3)C2)c1	ZINC001028779771	1340811240	/nfs/dbraw/zinc/81/12/40/1340811240.db2.gz	LVXIXFGGWOJOQS-LMDPOFIKSA-N	0	3	343.446	3.025	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](CNC(=O)C3CCC(F)CC3)C2)cc1	ZINC001028782536	1340815645	/nfs/dbraw/zinc/81/56/45/1340815645.db2.gz	RRBYSJSNMLLJAG-VIQWUECVSA-N	0	3	343.446	3.025	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)c2cc(Cl)ccc2Cl)C1	ZINC001028949956	1340891871	/nfs/dbraw/zinc/89/18/71/1340891871.db2.gz	UBKKXUYLEHMMKU-LBPRGKRZSA-N	0	3	325.239	3.068	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC([C@H](C)NCc2cc(C)no2)CC1	ZINC001029124423	1340935803	/nfs/dbraw/zinc/93/58/03/1340935803.db2.gz	GWSARLFBISVTKB-HNNXBMFYSA-N	0	3	333.476	3.302	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC([C@H](C)NCc2ccn(CC)n2)CC1	ZINC001029124841	1340935990	/nfs/dbraw/zinc/93/59/90/1340935990.db2.gz	CDTHFYFZNAJUCU-INIZCTEOSA-N	0	3	346.519	3.222	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)C1CCN(C(=O)C2(C)CCC2)CC1	ZINC001029127643	1340936731	/nfs/dbraw/zinc/93/67/31/1340936731.db2.gz	WQOAXRRTAWUTFD-MRXNPFEDSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC([C@@H](C)NCc2cc(C)n(C)n2)CC1	ZINC001029136918	1340940126	/nfs/dbraw/zinc/94/01/26/1340940126.db2.gz	NZILLBIXMXMUFF-OXQOHEQNSA-N	0	3	346.519	3.048	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC([C@@H](C)NCc2ocnc2C)CC1	ZINC001029139278	1340940437	/nfs/dbraw/zinc/94/04/37/1340940437.db2.gz	BUSCNBKKGXNWRS-AUUYWEPGSA-N	0	3	333.476	3.302	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC([C@H](C)NCc2cnc(C)o2)CC1	ZINC001029139746	1340940858	/nfs/dbraw/zinc/94/08/58/1340940858.db2.gz	IDSZEIRAVSTGFK-LIRRHRJNSA-N	0	3	333.476	3.302	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)C1CCN(C(=O)[C@H]2CC23CC3)CC1	ZINC001029151275	1340943556	/nfs/dbraw/zinc/94/35/56/1340943556.db2.gz	ZTPXMCVJSUHNFR-DNVCBOLYSA-N	0	3	337.467	3.075	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCN(C(=O)C[C@H]2C=CCC2)C1	ZINC001029642212	1341030843	/nfs/dbraw/zinc/03/08/43/1341030843.db2.gz	YGRAQUIZTZVSSV-HOTGVXAUSA-N	0	3	343.496	3.256	20	30		EGEDHN
C/C(=C\C(=O)N1CC[C@@H](CN(C)Cc2ccc(C#N)s2)C1)C1CC1	ZINC001029663041	1341037179	/nfs/dbraw/zinc/03/71/79/1341037179.db2.gz	DPYDSAGQQAXQMP-HNRFISLBSA-N	0	3	343.496	3.256	20	30		EGEDHN
CC(C(=O)N1CC[C@@H](CN(C)Cc2ccc(C#N)s2)C1)=C1CCC1	ZINC001029735867	1341059066	/nfs/dbraw/zinc/05/90/66/1341059066.db2.gz	XWVZPUFKLXPMTN-HNNXBMFYSA-N	0	3	343.496	3.400	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](CN(C)Cc2cncc(C)c2)C1	ZINC001029825375	1341086950	/nfs/dbraw/zinc/08/69/50/1341086950.db2.gz	CJDLKGSMXYBYFU-FXAWDEMLSA-N	0	3	329.488	3.273	20	30		EGEDHN
C=CCCN1CCC[C@@H](N(Cc2ccccc2)C(=O)c2ccon2)C1	ZINC001029916638	1341116855	/nfs/dbraw/zinc/11/68/55/1341116855.db2.gz	BGHNDGFNLBKVBL-GOSISDBHSA-N	0	3	339.439	3.358	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC(CN(C)Cc2cc(C)ns2)CC1	ZINC001029984146	1341143944	/nfs/dbraw/zinc/14/39/44/1341143944.db2.gz	AETQSBLNWJKNJU-UHFFFAOYSA-N	0	3	335.517	3.334	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC(CN(C)Cc2oc(CC)nc2C)CC1	ZINC001029985135	1341144715	/nfs/dbraw/zinc/14/47/15/1341144715.db2.gz	SYVROEBLDRJYAQ-UHFFFAOYSA-N	0	3	347.503	3.428	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC(CN(C)Cc3cc(C)no3)CC2)C1	ZINC001029993541	1341150088	/nfs/dbraw/zinc/15/00/88/1341150088.db2.gz	IIZNBTBLTHNAHO-UHFFFAOYSA-N	0	3	331.460	3.010	20	30		EGEDHN
C#Cc1ccc(C(=O)NCC2CN(CCCc3ccccc3C)C2)cc1	ZINC001031892244	1341417492	/nfs/dbraw/zinc/41/74/92/1341417492.db2.gz	SXJTZPBQYVMWRO-UHFFFAOYSA-N	0	3	346.474	3.271	20	30		EGEDHN
C#Cc1ccc(C(=O)NCC2CN(Cc3ccccc3CC)C2)cc1	ZINC001031892810	1341417858	/nfs/dbraw/zinc/41/78/58/1341417858.db2.gz	TWXJPHUYVJBRGQ-UHFFFAOYSA-N	0	3	332.447	3.092	20	30		EGEDHN
C#CCOc1ccc(C(=O)NCC2CN([C@@H](C)c3ccccc3)C2)cc1	ZINC001032030725	1341442622	/nfs/dbraw/zinc/44/26/22/1341442622.db2.gz	DVNGOZCVMNEXGI-KRWDZBQOSA-N	0	3	348.446	3.121	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1C[C@@H]2C[C@H]1CN2CCC(C)C	ZINC001032483894	1341521053	/nfs/dbraw/zinc/52/10/53/1341521053.db2.gz	LPTMMPDPLKZTBG-IRXDYDNUSA-N	0	3	328.456	3.196	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)CCc1ccc(OC)c(F)c1	ZINC001032516080	1341528629	/nfs/dbraw/zinc/52/86/29/1341528629.db2.gz	DVBWBWUTRFWKMM-IRXDYDNUSA-N	0	3	346.446	3.018	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H]1COc2ccc(Cl)cc21	ZINC001032521430	1341529794	/nfs/dbraw/zinc/52/97/94/1341529794.db2.gz	LBHCEZHVVNLQMY-ZOBUZTSGSA-N	0	3	346.858	3.067	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(N(CC)CC)cc1	ZINC001032750586	1341601972	/nfs/dbraw/zinc/60/19/72/1341601972.db2.gz	LTCNDGITNDBZBK-PMACEKPBSA-N	0	3	341.499	3.398	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C[C@@H](C)c1ccc(OC)cc1	ZINC001032794853	1341616251	/nfs/dbraw/zinc/61/62/51/1341616251.db2.gz	UVPGODHQAHKHQW-NEWSRXKRSA-N	0	3	342.483	3.440	20	30		EGEDHN
C=CCn1cccc1C(=O)N(C)[C@H]1CCN(CC2=CCCCC2)C1	ZINC001033146087	1341739843	/nfs/dbraw/zinc/73/98/43/1341739843.db2.gz	MLOGWRFKLRKKKW-SFHVURJKSA-N	0	3	327.472	3.321	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2ccccc2-c2ccncc2)C1	ZINC001033189600	1341748136	/nfs/dbraw/zinc/74/81/36/1341748136.db2.gz	BXNNMSNDRLGCIK-GOSISDBHSA-N	0	3	335.451	3.471	20	30		EGEDHN
C=CCCN1CC[C@H](N(C)C(=O)c2sc(C)nc2CC(C)C)C1	ZINC001033235029	1341756335	/nfs/dbraw/zinc/75/63/35/1341756335.db2.gz	JOXDTYKEGUTQMI-HNNXBMFYSA-N	0	3	335.517	3.372	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2ccc3nc(C)sc3c2)C1	ZINC001033560077	1341872482	/nfs/dbraw/zinc/87/24/82/1341872482.db2.gz	WOZUWQRBLZJASQ-HNNXBMFYSA-N	0	3	329.469	3.327	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)C[C@@H]2CCc3ccccc3C2)C1	ZINC001033611354	1341901899	/nfs/dbraw/zinc/90/18/99/1341901899.db2.gz	RNUUDYIYZYYUJI-XLIONFOSSA-N	0	3	326.484	3.290	20	30		EGEDHN
C#CCCN1CC[C@H](N(C)C(=O)c2cc(Cl)cc(Cl)c2)C1	ZINC001033612445	1341902479	/nfs/dbraw/zinc/90/24/79/1341902479.db2.gz	DWHJQVZURDKDDB-HNNXBMFYSA-N	0	3	325.239	3.163	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)C2CCc3ccccc3CC2)C1	ZINC001033877413	1342055302	/nfs/dbraw/zinc/05/53/02/1342055302.db2.gz	BUXGWJXCJZGMQL-OAQYLSRUSA-N	0	3	338.495	3.128	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cc(C)cc(OC)c2C)C1	ZINC001033883882	1342058172	/nfs/dbraw/zinc/05/81/72/1342058172.db2.gz	VDWQKFFUNUAXGL-QGZVFWFLSA-N	0	3	330.472	3.425	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@@H]2CCCc3cccnc32)C1	ZINC001033932062	1342095188	/nfs/dbraw/zinc/09/51/88/1342095188.db2.gz	GDMYYCOPCVWHSB-ZWKOTPCHSA-N	0	3	327.472	3.000	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@H]2CCc3ccccc3C2)C1	ZINC001033975342	1342124733	/nfs/dbraw/zinc/12/47/33/1342124733.db2.gz	MGDJCABEYXXXES-PMACEKPBSA-N	0	3	326.484	3.290	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@@H]2C[C@H]2c2ccc(OC)cc2)C1	ZINC001033984810	1342130338	/nfs/dbraw/zinc/13/03/38/1342130338.db2.gz	ZQOCRENGQXCWIQ-YSIASYRMSA-N	0	3	342.483	3.298	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2ccc(C(F)F)cc2F)C1	ZINC001034000548	1342139879	/nfs/dbraw/zinc/13/98/79/1342139879.db2.gz	QMJHFJMMGCQMQT-AWEZNQCLSA-N	0	3	338.373	3.323	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2[nH]c3ccc(C)cc3c2C)C1	ZINC001034004361	1342141685	/nfs/dbraw/zinc/14/16/85/1342141685.db2.gz	MDAVGEIWSPQTFU-KRWDZBQOSA-N	0	3	337.467	3.344	20	30		EGEDHN
C=CCCN1CC[C@@H](N(CC)C(=O)c2cc3cccnc3s2)C1	ZINC001034007679	1342144897	/nfs/dbraw/zinc/14/48/97/1342144897.db2.gz	REHRYLAZKQWJPY-OAHLLOKOSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccc3scnc3c2)C1	ZINC001034009347	1342146683	/nfs/dbraw/zinc/14/66/83/1342146683.db2.gz	JTEVZHNBYYLPJT-OAHLLOKOSA-N	0	3	329.469	3.409	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2cc(C)c(F)cc2Cl)C1	ZINC001034030725	1342169836	/nfs/dbraw/zinc/16/98/36/1342169836.db2.gz	YZQHWCYVXRWMEV-AWEZNQCLSA-N	0	3	336.838	3.347	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)[C@@H]2CCCCc3ccccc32)C1	ZINC001034047533	1342187200	/nfs/dbraw/zinc/18/72/00/1342187200.db2.gz	FJLADAIGMMGENJ-TZIWHRDSSA-N	0	3	338.495	3.443	20	30		EGEDHN
C=CCN1CC[C@@H](N(CC)C(=O)c2c[nH]c3c2cccc3CC)C1	ZINC001034049358	1342189305	/nfs/dbraw/zinc/18/93/05/1342189305.db2.gz	OTXMYUZZMANOAI-MRXNPFEDSA-N	0	3	325.456	3.453	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc(-n3cccn3)cc2)C1	ZINC001034247300	1342345191	/nfs/dbraw/zinc/34/51/91/1342345191.db2.gz	LXBQEJBNFSQLKF-GOSISDBHSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@H]2Cc3cc(Cl)ccc3O2)C1	ZINC001034296376	1342379933	/nfs/dbraw/zinc/37/99/33/1342379933.db2.gz	IXHPFMLVENEEGK-FUHWJXTLSA-N	0	3	348.874	3.190	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@@H]2CCc3cc(F)ccc32)C1	ZINC001034312644	1342393792	/nfs/dbraw/zinc/39/37/92/1342393792.db2.gz	RAJMNNBBMVFCGG-PKOBYXMFSA-N	0	3	330.447	3.402	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2ccc(C)c(Cl)c2F)C1	ZINC001034326565	1342401319	/nfs/dbraw/zinc/40/13/19/1342401319.db2.gz	KQBUTQVVGAOLQO-AWEZNQCLSA-N	0	3	336.838	3.395	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)Cc2c(C)[nH]c3ccccc32)C1	ZINC001034376229	1342445159	/nfs/dbraw/zinc/44/51/59/1342445159.db2.gz	SZZIJACWRPVHRA-INIZCTEOSA-N	0	3	325.456	3.176	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)c2cc(F)c3ncccc3c2)C1	ZINC001034446721	1342507832	/nfs/dbraw/zinc/50/78/32/1342507832.db2.gz	WOLMGZIJBLKSGX-INIZCTEOSA-N	0	3	327.403	3.144	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2ccccc2OCC(C)C)C1	ZINC001034446785	1342508328	/nfs/dbraw/zinc/50/83/28/1342508328.db2.gz	YRHGEKBTJCBDJY-GOSISDBHSA-N	0	3	342.483	3.329	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cccc(F)c2OCC)C1	ZINC001034467416	1342522615	/nfs/dbraw/zinc/52/26/15/1342522615.db2.gz	LYUMUJOPPWLNQC-OAHLLOKOSA-N	0	3	334.435	3.385	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc3ccn(C)c3c2)C1	ZINC001034471135	1342525602	/nfs/dbraw/zinc/52/56/02/1342525602.db2.gz	FBFHENUEYSKJRE-SFHVURJKSA-N	0	3	325.456	3.339	20	30		EGEDHN
C=CCCN1CCCC[C@@H](NC(=O)c2cc3cccnc3s2)C1	ZINC001034474252	1342529672	/nfs/dbraw/zinc/52/96/72/1342529672.db2.gz	QSTSUONTKDKXKY-OAHLLOKOSA-N	0	3	329.469	3.457	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cc(-n3cccc3)ccn2)C1	ZINC001034479135	1342536014	/nfs/dbraw/zinc/53/60/14/1342536014.db2.gz	SEJYPBAZRDQXRC-QGZVFWFLSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cccnc2OCC(C)C)C1	ZINC001034492415	1342547722	/nfs/dbraw/zinc/54/77/22/1342547722.db2.gz	CQNBVKPHCKVOAH-KRWDZBQOSA-N	0	3	345.487	3.277	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2c(F)ccc(OC)c2F)C1	ZINC001034497561	1342554611	/nfs/dbraw/zinc/55/46/11/1342554611.db2.gz	XNBHGXYXYWGAIB-ZDUSSCGKSA-N	0	3	338.398	3.134	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2csc3c2CC[C@@H](C)C3)C1	ZINC001034513179	1342571750	/nfs/dbraw/zinc/57/17/50/1342571750.db2.gz	VFZBFKZAUULENH-CVEARBPZSA-N	0	3	344.524	3.481	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)c2ccc(OC3CCC3)cc2)C1	ZINC001034531138	1342587376	/nfs/dbraw/zinc/58/73/76/1342587376.db2.gz	FGHLESCUOMAMIE-QGZVFWFLSA-N	0	3	328.456	3.388	20	30		EGEDHN
C=C(C)CCN1CCCC[C@@H](NC(=O)c2scnc2Cl)C1	ZINC001034538441	1342597083	/nfs/dbraw/zinc/59/70/83/1342597083.db2.gz	OVCIVJVDPXUKGG-GFCCVEGCSA-N	0	3	327.881	3.347	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@]2(C)OCCc3ccccc32)C1	ZINC001034552497	1342614870	/nfs/dbraw/zinc/61/48/70/1342614870.db2.gz	NGPBGAFYGSUYCQ-WIYYLYMNSA-N	0	3	342.483	3.021	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1CC[C@H](NC(=O)C2C=CC=CC=C2)CC1	ZINC001034656071	1342674726	/nfs/dbraw/zinc/67/47/26/1342674726.db2.gz	SFFFYBGPSQVSNQ-MEMLXQNLSA-N	0	3	347.462	3.374	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1CC[C@H](NC(=O)Cc2ccccc2)CC1	ZINC001034675334	1342686509	/nfs/dbraw/zinc/68/65/09/1342686509.db2.gz	ZWRWLAYYCSRITN-MEMLXQNLSA-N	0	3	347.462	3.318	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2cccc(N(C)C)c2)C12CCC2	ZINC001078794420	1357088690	/nfs/dbraw/zinc/08/86/90/1357088690.db2.gz	HOMFQFFHGHOAEN-SJORKVTESA-N	0	3	347.890	3.136	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccccc2OCC)C12CCC2	ZINC001078798433	1357090545	/nfs/dbraw/zinc/09/05/45/1357090545.db2.gz	QDCIPWJLAZNALV-IRXDYDNUSA-N	0	3	348.874	3.468	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)c(F)c1	ZINC001034903028	1342829453	/nfs/dbraw/zinc/82/94/53/1342829453.db2.gz	SEFUNNHADQCQOL-OAHLLOKOSA-N	0	3	333.382	3.041	20	30		EGEDHN
Cc1sccc1C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)s1	ZINC001034930581	1342840671	/nfs/dbraw/zinc/84/06/71/1342840671.db2.gz	WWCMIBZQZDQMQB-CYBMUJFWSA-N	0	3	345.493	3.384	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)cc1F)C(C)(C)C	ZINC001034973917	1342859246	/nfs/dbraw/zinc/85/92/46/1342859246.db2.gz	UVGVEXZRKPMTLC-RHSMWYFYSA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)c(F)c1)C(C)(C)C	ZINC001034974263	1342860306	/nfs/dbraw/zinc/86/03/06/1342860306.db2.gz	ZMBCAUDKVHLDHP-WMLDXEAASA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@@]1(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)cc2F)C=CCC1	ZINC001035017637	1342878133	/nfs/dbraw/zinc/87/81/33/1342878133.db2.gz	YRGJKVOQEDZCKP-YLJYHZDGSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H]1CNCc1c(C)noc1CC	ZINC001035037037	1342890536	/nfs/dbraw/zinc/89/05/36/1342890536.db2.gz	MYRVPJRIJQCBSM-BEFAXECRSA-N	0	3	333.476	3.228	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cccn2C(C)C)C12CCC2	ZINC001078816170	1357096383	/nfs/dbraw/zinc/09/63/83/1357096383.db2.gz	IRAPUKZWWCFFKV-JKSUJKDBSA-N	0	3	335.879	3.452	20	30		EGEDHN
CC(C)C(=O)N1CCC2(CCN(Cc3ccc(C#N)c(F)c3)C2)CC1	ZINC001035158097	1342974695	/nfs/dbraw/zinc/97/46/95/1342974695.db2.gz	GDNSHSJQMHQIIB-UHFFFAOYSA-N	0	3	343.446	3.168	20	30		EGEDHN
O=C(C1=CCCC1)N1CCC2(CCN(CC#Cc3ccccc3)C2)CC1	ZINC001035176347	1342992713	/nfs/dbraw/zinc/99/27/13/1342992713.db2.gz	YYOMONMHQFAELO-UHFFFAOYSA-N	0	3	348.490	3.463	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC2(CCN(Cc3cnc(C)o3)C2)CC1	ZINC001035226154	1343047614	/nfs/dbraw/zinc/04/76/14/1343047614.db2.gz	HNCZHACLGYQOKS-LJQANCHMSA-N	0	3	345.487	3.400	20	30		EGEDHN
CC[C@H](c1ccc(F)cc1)N1CC2(C1)CCN(C(=O)[C@H](C)C#N)CC2	ZINC001035667908	1343129078	/nfs/dbraw/zinc/12/90/78/1343129078.db2.gz	AWMHXFJPYBPYHI-CRAIPNDOSA-N	0	3	343.446	3.361	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cccc(Cl)c1C)CC2	ZINC001035714581	1343149046	/nfs/dbraw/zinc/14/90/46/1343149046.db2.gz	KAAIZCYDZMTMID-UHFFFAOYSA-N	0	3	330.859	3.210	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H]1CCC[C@@H]1C(F)F)CC2	ZINC001035721267	1343151970	/nfs/dbraw/zinc/15/19/70/1343151970.db2.gz	SUUCIASDMSKWOA-LSDHHAIUSA-N	0	3	326.431	3.168	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccc(-c3ccco3)o1)CC2	ZINC001035747459	1343166784	/nfs/dbraw/zinc/16/67/84/1343166784.db2.gz	NTAZROPTFDCNHZ-UHFFFAOYSA-N	0	3	338.407	3.101	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1nc(Cl)sc1C)CC2	ZINC001035748244	1343167821	/nfs/dbraw/zinc/16/78/21/1343167821.db2.gz	WZAKMPNCDACQTH-UHFFFAOYSA-N	0	3	339.892	3.219	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC2(CN(C[C@@H]3CC(C)(C)CO3)C2)CC1	ZINC001035767722	1343179410	/nfs/dbraw/zinc/17/94/10/1343179410.db2.gz	VNVXOIJAYRBTJJ-KRWDZBQOSA-N	0	3	348.531	3.328	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cc3cc(F)ccc3o1)CC2	ZINC001035807925	1343208236	/nfs/dbraw/zinc/20/82/36/1343208236.db2.gz	XFHAOCJQHMYBIL-UHFFFAOYSA-N	0	3	340.398	3.133	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)C[C@@H](C)c1ccccc1C)CC2	ZINC001035814293	1343212525	/nfs/dbraw/zinc/21/25/25/1343212525.db2.gz	ZTVKJWUEAMUDKJ-LJQANCHMSA-N	0	3	338.495	3.436	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H]1CCO[C@@H](CCC)C1)CC2	ZINC001035827960	1343217286	/nfs/dbraw/zinc/21/72/86/1343217286.db2.gz	DHHJIGXLVLPADH-MSOLQXFVSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc3c([nH]1)CCCC3)CC2	ZINC001035830913	1343219510	/nfs/dbraw/zinc/21/95/10/1343219510.db2.gz	BPYPSGWPLUJNDV-UHFFFAOYSA-N	0	3	327.472	3.008	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)CCc1ccccc1OC)CC2	ZINC001035847157	1343227650	/nfs/dbraw/zinc/22/76/50/1343227650.db2.gz	HMKDEEIVKPXCBY-UHFFFAOYSA-N	0	3	342.483	3.128	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)COc1ccc(C)cc1C)CC2	ZINC001035847800	1343228009	/nfs/dbraw/zinc/22/80/09/1343228009.db2.gz	HJXPQYSYAHWDKE-UHFFFAOYSA-N	0	3	342.483	3.183	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)CCc1ccccc1Cl)CC2	ZINC001035849116	1343228749	/nfs/dbraw/zinc/22/87/49/1343228749.db2.gz	UKNVGJDGPQTPSY-UHFFFAOYSA-N	0	3	344.886	3.220	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cn1ccc3ccccc31)CC2	ZINC001035855028	1343231891	/nfs/dbraw/zinc/23/18/91/1343231891.db2.gz	RPKMKFHCEPGRDU-UHFFFAOYSA-N	0	3	337.467	3.142	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccccc2)CC[C@@H]1NCc1ccccc1C#N	ZINC001035885941	1343248686	/nfs/dbraw/zinc/24/86/86/1343248686.db2.gz	CXNNCTVLBJWKOV-UZLBHIALSA-N	0	3	333.435	3.199	20	30		EGEDHN
C[C@H]1CN(C(=O)C2(C)CCC2)CC[C@@H]1NCc1ccccc1C#N	ZINC001036141225	1343325752	/nfs/dbraw/zinc/32/57/52/1343325752.db2.gz	GRQWVAAXBGBQRJ-YJBOKZPZSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3cc(C)no3)[C@@H](C)C2)CC1	ZINC001036172811	1343345354	/nfs/dbraw/zinc/34/53/54/1343345354.db2.gz	KNXYEXUMBOHQNV-KSSFIOAISA-N	0	3	331.460	3.056	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]([C@@H](C)NCc2nc(C)oc2C)C1	ZINC001036426039	1343479260	/nfs/dbraw/zinc/47/92/60/1343479260.db2.gz	CXSMYYYNPFSMAU-CZUORRHYSA-N	0	3	333.476	3.220	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@H]([C@@H](C)NCc3cc(C)no3)C2)CC1	ZINC001036429117	1343481968	/nfs/dbraw/zinc/48/19/68/1343481968.db2.gz	FFYCZTKKPAHLRG-AEFFLSMTSA-N	0	3	345.487	3.446	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H]([C@@H](C)NCc2nccs2)C1	ZINC001036430350	1343482690	/nfs/dbraw/zinc/48/26/90/1343482690.db2.gz	AGEJBZNNVJFRAJ-CABCVRRESA-N	0	3	335.517	3.462	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@@H](C)[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001036511347	1343526902	/nfs/dbraw/zinc/52/69/02/1343526902.db2.gz	SSHNUVDHBRROLT-KDOFPFPSSA-N	0	3	331.435	3.070	20	30		EGEDHN
Cc1occc1C(=O)N1CC[C@H]2[C@@H](CCN2CC#Cc2ccccc2)C1	ZINC001036639024	1343594423	/nfs/dbraw/zinc/59/44/23/1343594423.db2.gz	NKIMKXWQAAKHNP-FPOVZHCZSA-N	0	3	348.446	3.176	20	30		EGEDHN
CC(C)(C)CC(=O)N1CC[C@@H]2[C@H](CCN2CC#Cc2ccccc2)C1	ZINC001036639794	1343594855	/nfs/dbraw/zinc/59/48/55/1343594855.db2.gz	BANWNHGFGJOGBD-WOJBJXKFSA-N	0	3	338.495	3.397	20	30		EGEDHN
C/C=C(\C)C(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001036682366	1343624062	/nfs/dbraw/zinc/62/40/62/1343624062.db2.gz	CCGCMCOASFWAID-QQYDEBQUSA-N	0	3	329.469	3.009	20	30		EGEDHN
C/C=C(/C)C(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001036682365	1343624389	/nfs/dbraw/zinc/62/43/89/1343624389.db2.gz	CCGCMCOASFWAID-QJYREQKYSA-N	0	3	329.469	3.009	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@H]2[C@H](CCN2Cc2ccccc2C#N)C1	ZINC001036687123	1343629728	/nfs/dbraw/zinc/62/97/28/1343629728.db2.gz	XSIARGSBLQMTAT-MSOLQXFVSA-N	0	3	341.430	3.244	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2[C@H](CCN2Cc2cnc(C)s2)C1	ZINC001036789303	1343719923	/nfs/dbraw/zinc/71/99/23/1343719923.db2.gz	PEPCIQGOYWAENU-GDBMZVCRSA-N	0	3	333.501	3.087	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]2[C@H](CCN2Cc2conc2C)C1	ZINC001036793672	1343725646	/nfs/dbraw/zinc/72/56/46/1343725646.db2.gz	JLPHPNFSGIHNIU-NVXWUHKLSA-N	0	3	331.460	3.008	20	30		EGEDHN
CC(F)(F)CC(=O)N1CC[C@@H]2[C@@H](CCN2CC#Cc2ccccc2)C1	ZINC001036811358	1343746889	/nfs/dbraw/zinc/74/68/89/1343746889.db2.gz	PKXJWTSZSZYWGF-ZWKOTPCHSA-N	0	3	346.421	3.006	20	30		EGEDHN
CC(F)(F)CC(=O)N1CC[C@H]2[C@@H](CCN2CC#Cc2ccccc2)C1	ZINC001036811357	1343747038	/nfs/dbraw/zinc/74/70/38/1343747038.db2.gz	PKXJWTSZSZYWGF-ROUUACIJSA-N	0	3	346.421	3.006	20	30		EGEDHN
Cc1occc1C(=O)N[C@H]1CCC[C@@H]1CNCc1ccccc1C#N	ZINC001036940241	1343884197	/nfs/dbraw/zinc/88/41/97/1343884197.db2.gz	WPSDATGMZQMVDN-MJGOQNOKSA-N	0	3	337.423	3.148	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCC[C@@H]2CNCc2csc(C)n2)C1	ZINC001037071207	1343964811	/nfs/dbraw/zinc/96/48/11/1343964811.db2.gz	CQDBOBWVGIFRQE-GDBMZVCRSA-N	0	3	333.501	3.182	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCC[C@@H]2CNCc2cscn2)CC1	ZINC001037070998	1343964982	/nfs/dbraw/zinc/96/49/82/1343964982.db2.gz	ZSKDGSXJNCQWNC-WBVHZDCISA-N	0	3	333.501	3.264	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCC[C@@H]2CNCc2ncc(C)s2)C1	ZINC001037074737	1343968016	/nfs/dbraw/zinc/96/80/16/1343968016.db2.gz	FZESKNFTPNGECF-HUUCEWRRSA-N	0	3	333.501	3.182	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@@H]1CCCC[C@@H]1NC(=O)CC1CC1	ZINC001037148972	1344000004	/nfs/dbraw/zinc/00/00/04/1344000004.db2.gz	MDSYMDDYGAYKGU-LPHOPBHVSA-N	0	3	343.446	3.262	20	30		EGEDHN
CC(C)(F)C(=O)N[C@@H]1CCCC[C@H]1CNCc1ccccc1C#N	ZINC001037156069	1344006930	/nfs/dbraw/zinc/00/69/30/1344006930.db2.gz	LPSIELDXUUNGSK-DLBZAZTESA-N	0	3	331.435	3.071	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](NCc2nc(C)cs2)[C@@H](CC)C1	ZINC001037906791	1344171328	/nfs/dbraw/zinc/17/13/28/1344171328.db2.gz	SKYWATLUFUSHQE-GJZGRUSLSA-N	0	3	335.517	3.380	20	30		EGEDHN
C=CCOc1cccnc1C(=O)NC[C@@H]1CCN1CCC1CCCC1	ZINC001038905927	1344644171	/nfs/dbraw/zinc/64/41/71/1344644171.db2.gz	SSBNDPWPEVQCEW-KRWDZBQOSA-N	0	3	343.471	3.031	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C(F)=C2CCCC2)C[C@H]1c1cccc(F)c1	ZINC001079179297	1357202441	/nfs/dbraw/zinc/20/24/41/1357202441.db2.gz	SSMWIOHSAAPMQI-ZWKOTPCHSA-N	0	3	344.405	3.141	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)c3cc[nH]c3C)CC2)C1	ZINC001039124571	1344800274	/nfs/dbraw/zinc/80/02/74/1344800274.db2.gz	UALHKAMDQQSSDA-MRXNPFEDSA-N	0	3	335.879	3.250	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2sccc2C)C1	ZINC001039178337	1344873065	/nfs/dbraw/zinc/87/30/65/1344873065.db2.gz	OSKWNFICCLKDME-DLBZAZTESA-N	0	3	330.497	3.396	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc(C)oc2C)C1	ZINC001039191764	1344896464	/nfs/dbraw/zinc/89/64/64/1344896464.db2.gz	ALQKPZKGMLIFEM-IEBWSBKVSA-N	0	3	328.456	3.236	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccc3cc(C)cn3c2)C1	ZINC001039209143	1344921341	/nfs/dbraw/zinc/92/13/41/1344921341.db2.gz	GZQRURSSDMLKBD-GHTZIAJQSA-N	0	3	349.478	3.198	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)CCc2ccsc2)C1	ZINC001039213809	1344929370	/nfs/dbraw/zinc/92/93/70/1344929370.db2.gz	LZQJLWXFTYBXCH-QZTJIDSGSA-N	0	3	330.497	3.017	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)CCc2ccsc2)C1	ZINC001039214969	1344930554	/nfs/dbraw/zinc/93/05/54/1344930554.db2.gz	RFYACAKHLUPUFV-RTBURBONSA-N	0	3	344.524	3.407	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)Cc2ccccc2CC)C1	ZINC001039219726	1344936942	/nfs/dbraw/zinc/93/69/42/1344936942.db2.gz	UOYRKUNTMMTJIT-LEWJYISDSA-N	0	3	338.495	3.128	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc(C)sc2C)C1	ZINC001039219951	1344937399	/nfs/dbraw/zinc/93/73/99/1344937399.db2.gz	WNFAJAPJPJTQFW-FUHWJXTLSA-N	0	3	330.497	3.315	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2occc2CC)C1	ZINC001039227349	1344946247	/nfs/dbraw/zinc/94/62/47/1344946247.db2.gz	CWWCSWMGGTZMIC-ZWKOTPCHSA-N	0	3	328.456	3.182	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccc(C)c(C)n2)C1	ZINC001039228543	1344947900	/nfs/dbraw/zinc/94/79/00/1344947900.db2.gz	JDBCORUPHXERRC-AZUAARDMSA-N	0	3	339.483	3.038	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2occc2Cl)C1	ZINC001039233068	1344952378	/nfs/dbraw/zinc/95/23/78/1344952378.db2.gz	ZREKUNGRUJYQSF-ZBFHGGJFSA-N	0	3	334.847	3.273	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccc(F)cc2F)C1	ZINC001039238529	1344962382	/nfs/dbraw/zinc/96/23/82/1344962382.db2.gz	IVSFUVOGEQZZNH-HNAYVOBHSA-N	0	3	346.421	3.305	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(F)cc2Cl)C1	ZINC001039241296	1344966321	/nfs/dbraw/zinc/96/63/21/1344966321.db2.gz	YXMGMXUTDOFOKG-KSSFIOAISA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cnc(CC)s2)C1	ZINC001039241596	1344967400	/nfs/dbraw/zinc/96/74/00/1344967400.db2.gz	DMEUGNMBKIWKFT-HZPDHXFCSA-N	0	3	345.512	3.045	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cccc(F)c2F)C1	ZINC001039242114	1344967699	/nfs/dbraw/zinc/96/76/99/1344967699.db2.gz	AEMNMLWWAMWWJD-MAUKXSAKSA-N	0	3	346.421	3.305	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc[nH]c2C2CC2)C1	ZINC001039242788	1344969688	/nfs/dbraw/zinc/96/96/88/1344969688.db2.gz	FFNWZHQABJYNQH-IEBWSBKVSA-N	0	3	339.483	3.232	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(F)c(Cl)c2)C1	ZINC001039246550	1344976356	/nfs/dbraw/zinc/97/63/56/1344976356.db2.gz	SOWOLNYUUVCUHK-QAPCUYQASA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cccc(OC)c2)C1	ZINC001039248239	1344978009	/nfs/dbraw/zinc/97/80/09/1344978009.db2.gz	ACRAAXOSBITFGK-UYAOXDASSA-N	0	3	340.467	3.035	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(CC(C)C)c[nH]2)C1	ZINC001039247829	1344978174	/nfs/dbraw/zinc/97/81/74/1344978174.db2.gz	XYWXBFLYQWZAQR-QUCCMNQESA-N	0	3	341.499	3.163	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2c[nH]c3ccc(C)cc23)C1	ZINC001039249970	1344980484	/nfs/dbraw/zinc/98/04/84/1344980484.db2.gz	GSVRMHWEVOJHGM-DYESRHJHSA-N	0	3	349.478	3.426	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2nccc(C)c2c1	ZINC001039380965	1345036088	/nfs/dbraw/zinc/03/60/88/1345036088.db2.gz	NLMWMAJUZZQFFU-MOPGFXCFSA-N	0	3	347.462	3.245	20	30		EGEDHN
C=CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1sc(Cl)nc1C	ZINC001039381032	1345036235	/nfs/dbraw/zinc/03/62/35/1345036235.db2.gz	RLIOUYBGXUJRBR-OLZOCXBDSA-N	0	3	339.892	3.360	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(C2CC2)n(CC)n1	ZINC001039383886	1345038044	/nfs/dbraw/zinc/03/80/44/1345038044.db2.gz	AEIFXEQLGPHZGJ-SJORKVTESA-N	0	3	342.487	3.035	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(OC)c(F)c1	ZINC001039389269	1345040290	/nfs/dbraw/zinc/04/02/90/1345040290.db2.gz	KVSGWHSYKMFBLF-CVEARBPZSA-N	0	3	332.419	3.089	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccnc(CCC)c1	ZINC001039389877	1345040926	/nfs/dbraw/zinc/04/09/26/1345040926.db2.gz	NIJHNQLJFLGTNE-MOPGFXCFSA-N	0	3	327.472	3.289	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc(C)c(OC)c1	ZINC001039402375	1345048107	/nfs/dbraw/zinc/04/81/07/1345048107.db2.gz	URAXBWNLHJVLFX-MOPGFXCFSA-N	0	3	342.483	3.188	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1c(C)cc(C)nc1C	ZINC001039407977	1345052559	/nfs/dbraw/zinc/05/25/59/1345052559.db2.gz	QPKJDMZMBXYELA-MSOLQXFVSA-N	0	3	327.472	3.262	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccc2cccnc21	ZINC001039414738	1345056399	/nfs/dbraw/zinc/05/63/99/1345056399.db2.gz	IMRVCIZLDROETJ-MOPGFXCFSA-N	0	3	335.451	3.029	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H](C)c1cccnc1	ZINC001039447413	1345071852	/nfs/dbraw/zinc/07/18/52/1345071852.db2.gz	LMSIXMDTFMGADE-QRQLOZEOSA-N	0	3	327.472	3.217	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1c[nH]c2c1cccc2C	ZINC001039448112	1345073140	/nfs/dbraw/zinc/07/31/40/1345073140.db2.gz	WUBVOKLCLFPESP-MSOLQXFVSA-N	0	3	337.467	3.270	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc2c(cccc2C)o1	ZINC001039475303	1345089509	/nfs/dbraw/zinc/08/95/09/1345089509.db2.gz	NUNQVAUVYCFWKT-SJORKVTESA-N	0	3	336.435	3.443	20	30		EGEDHN
N#Cc1c[nH]c(C(=O)N2C[C@H]3CCC[C@@H](C2)N3CCC2CCCC2)c1	ZINC001039540450	1345135599	/nfs/dbraw/zinc/13/55/99/1345135599.db2.gz	COQYAQVGWPIINK-HDICACEKSA-N	0	3	340.471	3.146	20	30		EGEDHN
N#Cc1ccc(C(=O)N2C[C@H]3CCC[C@@H](C2)N3CCC2CCCC2)[nH]1	ZINC001039546335	1345139450	/nfs/dbraw/zinc/13/94/50/1345139450.db2.gz	XIUCVXJFVRGXQT-HDICACEKSA-N	0	3	340.471	3.146	20	30		EGEDHN
CCCC(=O)N1CC[C@]2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001040037422	1345303276	/nfs/dbraw/zinc/30/32/76/1345303276.db2.gz	XZNLLQFAFHIASX-HXUWFJFHSA-N	0	3	325.456	3.173	20	30		EGEDHN
CC(C)C(=O)N1CC[C@]2(C1)CCCN(Cc1cccc(C#N)c1)C2	ZINC001040079781	1345325850	/nfs/dbraw/zinc/32/58/50/1345325850.db2.gz	IBCQRYLEJSARRY-HXUWFJFHSA-N	0	3	325.456	3.029	20	30		EGEDHN
Cc1cc(F)ccc1CN1CCC[C@]2(CCN(C(=O)[C@H](C)C#N)C2)C1	ZINC001040128188	1345343279	/nfs/dbraw/zinc/34/32/79/1345343279.db2.gz	XLPAUYPCGPMMBP-UZLBHIALSA-N	0	3	343.446	3.108	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@]3(CCN(C(=O)/C=C/C4CC4)C3)C2)cc1	ZINC001040134437	1345345972	/nfs/dbraw/zinc/34/59/72/1345345972.db2.gz	POGLEYFZEXDJDQ-UVIRAJKCSA-N	0	3	349.478	3.339	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@]3(CCN(C(=O)C4=CCCC4)C3)C2)c1	ZINC001040158758	1345360343	/nfs/dbraw/zinc/36/03/43/1345360343.db2.gz	SFDARDKAPIEILZ-QFIPXVFZSA-N	0	3	349.478	3.483	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cn(C)c4ccccc34)C2)C1	ZINC001040281230	1345409737	/nfs/dbraw/zinc/40/97/37/1345409737.db2.gz	BDWCOHRGYRGDIG-QFIPXVFZSA-N	0	3	349.478	3.130	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)C3CCC4(CC4)CC3)C2)C1	ZINC001040293326	1345416951	/nfs/dbraw/zinc/41/69/51/1345416951.db2.gz	VEFYHPLQZBYZAD-OAQYLSRUSA-N	0	3	328.500	3.295	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3cnc4ccccc4c3C)C2)C1	ZINC001040299043	1345419968	/nfs/dbraw/zinc/41/99/68/1345419968.db2.gz	BLQXCXUQXZMQEB-QFIPXVFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)Cc3cc(C)cc(C)c3)C2)C1	ZINC001040368792	1345458631	/nfs/dbraw/zinc/45/86/31/1345458631.db2.gz	KGUURPKNFZWJIU-QFIPXVFZSA-N	0	3	338.495	3.184	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ccc4ncccc4c3)C2)C1	ZINC001040371356	1345459784	/nfs/dbraw/zinc/45/97/84/1345459784.db2.gz	IDTQRVSVIUBBCB-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@H](c3ccccc3)C(C)C)C2)C1	ZINC001040417410	1345486089	/nfs/dbraw/zinc/48/60/89/1345486089.db2.gz	FWPRNDDCYDRQRO-UNMCSNQZSA-N	0	3	338.495	3.374	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cccc(OCC)c3)C2)C1	ZINC001040423396	1345489512	/nfs/dbraw/zinc/48/95/12/1345489512.db2.gz	UDUWRYWCJKYXNE-NRFANRHFSA-N	0	3	340.467	3.037	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ccc4cc[nH]c4c3)C2)C1	ZINC001040424359	1345490686	/nfs/dbraw/zinc/49/06/86/1345490686.db2.gz	ZIPCKUIDEYYPIV-NRFANRHFSA-N	0	3	335.451	3.119	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3csc(Cl)c3)C2)C1	ZINC001040433063	1345496225	/nfs/dbraw/zinc/49/62/25/1345496225.db2.gz	RXFCDSBXCLVPEC-KRWDZBQOSA-N	0	3	336.888	3.353	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)C[C@@H](C)c3ccccc3C)C2)C1	ZINC001040433799	1345497300	/nfs/dbraw/zinc/49/73/00/1345497300.db2.gz	ZIMNYQQUJBXTOT-KNQAVFIVSA-N	0	3	338.495	3.436	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ccc4ccn(C)c4c3)C2)C1	ZINC001040478989	1345514075	/nfs/dbraw/zinc/51/40/75/1345514075.db2.gz	NKJKBCCXJFYMFB-JOCHJYFZSA-N	0	3	349.478	3.130	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)C(C)(C)c3ccc(F)cc3)C2)C1	ZINC001040498009	1345521105	/nfs/dbraw/zinc/52/11/05/1345521105.db2.gz	XJUHFYYLIGPESJ-OAQYLSRUSA-N	0	3	342.458	3.051	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)C3(c4ccccc4)CC3)C2)C1	ZINC001040518533	1345529795	/nfs/dbraw/zinc/52/97/95/1345529795.db2.gz	BEFVJCXEPKDPPQ-OAQYLSRUSA-N	0	3	336.479	3.056	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3cc(C)c(F)c(C)c3)C2)C1	ZINC001040535197	1345535365	/nfs/dbraw/zinc/53/53/65/1345535365.db2.gz	PJZGGMGNEPWIMH-HXUWFJFHSA-N	0	3	328.431	3.004	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@@H](C)c3cccc(Cl)c3)C2)C1	ZINC001040537527	1345536493	/nfs/dbraw/zinc/53/64/93/1345536493.db2.gz	ATMWSAFLUNBAPA-JXFKEZNVSA-N	0	3	344.886	3.391	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)C34CCC(CC3)CC4)C2)C1	ZINC001040541198	1345537891	/nfs/dbraw/zinc/53/78/91/1345537891.db2.gz	YXQAYAJFFLDJCU-VEDCXYSMSA-N	0	3	328.500	3.295	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001040660118	1345562347	/nfs/dbraw/zinc/56/23/47/1345562347.db2.gz	BRFILNOSIIYULL-YPEHOIGNSA-N	0	3	337.467	3.339	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC2(C1)CCN(Cc1c(C)noc1C)CC2	ZINC001040800144	1345579332	/nfs/dbraw/zinc/57/93/32/1345579332.db2.gz	FTHXKHNVYFGTQT-UHFFFAOYSA-N	0	3	345.487	3.318	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cc[nH]c3C3CCC3)C2)CC1	ZINC001040849068	1345588433	/nfs/dbraw/zinc/58/84/33/1345588433.db2.gz	OJMJGCRFGVZVIH-UHFFFAOYSA-N	0	3	339.483	3.234	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccsc3Cl)C2)CC1	ZINC001040874934	1345592150	/nfs/dbraw/zinc/59/21/50/1345592150.db2.gz	NCKNROARZKFGBP-UHFFFAOYSA-N	0	3	336.888	3.353	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cc4c(cccc4C)o3)C2)CC1	ZINC001040953297	1345609416	/nfs/dbraw/zinc/60/94/16/1345609416.db2.gz	NAALOOCAAGQZBD-UHFFFAOYSA-N	0	3	336.435	3.303	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)CCc3cc(C)sc3C)C2)CC1	ZINC001040953218	1345609440	/nfs/dbraw/zinc/60/94/40/1345609440.db2.gz	LDFCWPJWAXYGBN-UHFFFAOYSA-N	0	3	344.524	3.245	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@@]3(CCN(Cc4ccc(C#N)cc4)C3)C2)o1	ZINC001041044259	1345635042	/nfs/dbraw/zinc/63/50/42/1345635042.db2.gz	CJXOECWKKXOCRG-OAQYLSRUSA-N	0	3	349.434	3.198	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@]3(CCN(C(=O)CC4CCC4)C3)C2)c1	ZINC001041168479	1345664374	/nfs/dbraw/zinc/66/43/74/1345664374.db2.gz	CWWAUWORTOLPOF-NRFANRHFSA-N	0	3	337.467	3.173	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3ccc(CC(C)C)s3)C2)C1	ZINC001041364457	1345710551	/nfs/dbraw/zinc/71/05/51/1345710551.db2.gz	LZTXHCJDPJCRFX-IBGZPJMESA-N	0	3	330.497	3.118	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3cc4cc(Cl)ccc4o3)C2)C1	ZINC001041452866	1345731415	/nfs/dbraw/zinc/73/14/15/1345731415.db2.gz	XXUYONZVFJYJMH-IBGZPJMESA-N	0	3	342.826	3.257	20	30		EGEDHN
C=CCN1CC[C@@]2(CCN(C(=O)c3cc(-c4cccs4)on3)C2)C1	ZINC001041520389	1345752134	/nfs/dbraw/zinc/75/21/34/1345752134.db2.gz	QXKFIVVUHWRRGG-GOSISDBHSA-N	0	3	343.452	3.127	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)C3[C@H]4CCCCCC[C@H]34)C2)C1	ZINC001041708375	1345825371	/nfs/dbraw/zinc/82/53/71/1345825371.db2.gz	HQCNXCDZCVACHX-WFXMLNOXSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cc(C)c(F)cc3Cl)C2)C1	ZINC001041804767	1345856837	/nfs/dbraw/zinc/85/68/37/1345856837.db2.gz	DBUAOOWYAPLILN-IBGZPJMESA-N	0	3	348.849	3.349	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3c(C)csc3Cl)C2)C1	ZINC001041805744	1345857467	/nfs/dbraw/zinc/85/74/67/1345857467.db2.gz	PCVLUXQJYPKXNT-QGZVFWFLSA-N	0	3	336.888	3.271	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3cc(CC)c(CCC)s3)C2)C1	ZINC001041822214	1345863820	/nfs/dbraw/zinc/86/38/20/1345863820.db2.gz	PYWDWXUIOBKFBR-FQEVSTJZSA-N	0	3	344.524	3.434	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3cc4c(s3)CC[C@H](C)C4)C2)C1	ZINC001041825436	1345864903	/nfs/dbraw/zinc/86/49/03/1345864903.db2.gz	LERXTYYNVSDXPM-MGPUTAFESA-N	0	3	342.508	3.044	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccc(C)c4c3CCC4)C2)C1	ZINC001041847714	1345872681	/nfs/dbraw/zinc/87/26/81/1345872681.db2.gz	CHXDGIGZKGTCTO-JOCHJYFZSA-N	0	3	336.479	3.045	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@H]2CCN(Cc3cccc(C#N)c3)[C@H]2C1	ZINC001041948945	1345905851	/nfs/dbraw/zinc/90/58/51/1345905851.db2.gz	AHOFFFHBNHYHIU-UXHICEINSA-N	0	3	339.483	3.417	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)C3C4CC5CC(C4)CC3C5)C[C@@H]21	ZINC001042095858	1345943166	/nfs/dbraw/zinc/94/31/66/1345943166.db2.gz	RBXMJPNFQMAQLC-CQRDRXQVSA-N	0	3	340.511	3.005	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3nccc4ccsc43)C[C@@H]21	ZINC001042101713	1345944530	/nfs/dbraw/zinc/94/45/30/1345944530.db2.gz	XQIAYNTXZYMUNP-HIFRSBDPSA-N	0	3	327.453	3.019	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)Cc3ccc(C)c(Cl)c3)C[C@@H]21	ZINC001042114480	1345947497	/nfs/dbraw/zinc/94/74/97/1345947497.db2.gz	KTUTTZDWKKHLQS-MJGOQNOKSA-N	0	3	344.886	3.137	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(-c4ccco4)o3)C[C@@H]21	ZINC001042150444	1345957169	/nfs/dbraw/zinc/95/71/69/1345957169.db2.gz	VIBZZXKQRQUURR-CABCVRRESA-N	0	3	326.396	3.262	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cnc4ccccc4c3C)C[C@@H]21	ZINC001042155137	1345958125	/nfs/dbraw/zinc/95/81/25/1345958125.db2.gz	HWDFBONFHNVQEE-JXFKEZNVSA-N	0	3	335.451	3.266	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cc4ccc(C)cc4[nH]3)C[C@@H]21	ZINC001042168007	1345963725	/nfs/dbraw/zinc/96/37/25/1345963725.db2.gz	QPKJYEQFOCTXLY-JXFKEZNVSA-N	0	3	335.451	3.036	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3csc4ccccc34)C[C@@H]21	ZINC001042169704	1345965377	/nfs/dbraw/zinc/96/53/77/1345965377.db2.gz	LADRHUUEOZOUPW-QAPCUYQASA-N	0	3	338.476	3.461	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(F)c4ccncc34)C[C@H]21	ZINC001042197677	1345979735	/nfs/dbraw/zinc/97/97/35/1345979735.db2.gz	GFPBJTDCIALBDH-IFXJQAMLSA-N	0	3	339.414	3.096	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3csc(-c4ccco4)n3)C[C@H]21	ZINC001042206653	1345984783	/nfs/dbraw/zinc/98/47/83/1345984783.db2.gz	HVSQRHXVFUKYDQ-DZGCQCFKSA-N	0	3	343.452	3.126	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(Cl)c(OC)c3)C[C@H]21	ZINC001042257766	1346008544	/nfs/dbraw/zinc/00/85/44/1346008544.db2.gz	LSGGWEORRNUSTO-XJKSGUPXSA-N	0	3	334.847	3.071	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3cc(C(CC)CC)no3)C[C@@H]21	ZINC001042263007	1346010535	/nfs/dbraw/zinc/01/05/35/1346010535.db2.gz	RIKSPTBXZBAPSN-WMZOPIPTSA-N	0	3	343.471	3.138	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc4nc(C)ccc4c3)C[C@@H]21	ZINC001042278960	1346015714	/nfs/dbraw/zinc/01/57/14/1346015714.db2.gz	CIHXVUJDFDHYCZ-UZLBHIALSA-N	0	3	335.451	3.266	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3[nH]c4ccc(C)cc4c3C)C[C@@H]21	ZINC001042296605	1346020862	/nfs/dbraw/zinc/02/08/62/1346020862.db2.gz	CMIBUZKQNLHSMC-PXNSSMCTSA-N	0	3	349.478	3.344	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3coc4ccc(F)cc34)C[C@@H]21	ZINC001042326081	1346035270	/nfs/dbraw/zinc/03/52/70/1346035270.db2.gz	LIKKVHZZZUVKRD-GUYCJALGSA-N	0	3	328.387	3.294	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cccc(C(F)(F)F)c3)C[C@@H]21	ZINC001042326956	1346035699	/nfs/dbraw/zinc/03/56/99/1346035699.db2.gz	KUPNHQWPGNMBCD-CJNGLKHVSA-N	0	3	338.373	3.428	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccccc3C(F)(F)F)C[C@@H]21	ZINC001042327197	1346035898	/nfs/dbraw/zinc/03/58/98/1346035898.db2.gz	MCUTYNYQKWCMPM-BBRMVZONSA-N	0	3	338.373	3.428	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)C3(C4CCCCC4)CC3)C[C@H]21	ZINC001042336113	1346042250	/nfs/dbraw/zinc/04/22/50/1346042250.db2.gz	RZPITZDQCRGWTR-PKOBYXMFSA-N	0	3	328.500	3.293	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(Cl)ccc3OC)C[C@H]21	ZINC001042336800	1346042759	/nfs/dbraw/zinc/04/27/59/1346042759.db2.gz	AFSNZWOQCFAEEB-CZUORRHYSA-N	0	3	334.847	3.071	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(C)nc4ccccc43)C[C@H]21	ZINC001042338914	1346043456	/nfs/dbraw/zinc/04/34/56/1346043456.db2.gz	NYJRSFOTMMIMGD-OXJNMPFZSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C3(c4ccc(Cl)cc4)CC3)C[C@@H]21	ZINC001042340951	1346045821	/nfs/dbraw/zinc/04/58/21/1346045821.db2.gz	JOUARSBABQGTRN-QAPCUYQASA-N	0	3	344.886	3.480	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)CCc3ccccc3Cl)C[C@@H]21	ZINC001042341325	1346046057	/nfs/dbraw/zinc/04/60/57/1346046057.db2.gz	MTFHICMXDYEILO-MJGOQNOKSA-N	0	3	344.886	3.219	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3cc(CC)c(C)s3)C[C@@H]21	ZINC001042346163	1346048596	/nfs/dbraw/zinc/04/85/96/1346048596.db2.gz	PBVQCIQBAYQGSF-SJORKVTESA-N	0	3	330.497	3.179	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3cc(CC)c(C)s3)C[C@H]21	ZINC001042346161	1346048717	/nfs/dbraw/zinc/04/87/17/1346048717.db2.gz	PBVQCIQBAYQGSF-IAGOWNOFSA-N	0	3	330.497	3.179	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C3(c4cc(C)cc(C)c4)CC3)C[C@H]21	ZINC001042360138	1346054580	/nfs/dbraw/zinc/05/45/80/1346054580.db2.gz	NUUVQZIXMVCABX-AZUAARDMSA-N	0	3	338.495	3.444	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccccc3OCC3CC3)C[C@@H]21	ZINC001042367835	1346059247	/nfs/dbraw/zinc/05/92/47/1346059247.db2.gz	MBOISDIVMHMWEL-MJGOQNOKSA-N	0	3	340.467	3.198	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3cc4c(cccc4C)o3)C[C@H]21	ZINC001042373919	1346062224	/nfs/dbraw/zinc/06/22/24/1346062224.db2.gz	DZEMHWFFTSEELV-FUHWJXTLSA-N	0	3	336.435	3.301	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cscc3C(F)(F)F)C[C@H]21	ZINC001042383838	1346066400	/nfs/dbraw/zinc/06/64/00/1346066400.db2.gz	YOAWPYKAWGKRJI-BXUZGUMPSA-N	0	3	344.402	3.489	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N(C)C1CN(CC2CCCCCC2)C1	ZINC001044026270	1346236623	/nfs/dbraw/zinc/23/66/23/1346236623.db2.gz	XHVKPACEDSQXBF-PMACEKPBSA-N	0	3	348.531	3.471	20	30		EGEDHN
C[C@H]1C[C@@H]([NH2+]Cc2cccc(C#N)c2)CCN1C(=O)c1ccccc1[O-]	ZINC001044478697	1346344163	/nfs/dbraw/zinc/34/41/63/1346344163.db2.gz	OCDRZOUAZDTNHE-YJBOKZPZSA-N	0	3	349.434	3.047	20	30		EGEDHN
Cc1cccc(C(=O)N2CC[C@@H](NCc3ccccc3C#N)C[C@H]2C)n1	ZINC001044480471	1346344484	/nfs/dbraw/zinc/34/44/84/1346344484.db2.gz	BOBFMWSULHYNLW-VQIMIIECSA-N	0	3	348.450	3.045	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)c2cccs2)cc1F	ZINC001044907721	1346460526	/nfs/dbraw/zinc/46/05/26/1346460526.db2.gz	BBLIZUDDRRXAGR-HNNXBMFYSA-N	0	3	343.427	3.153	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)[C@H]2CCCC23CC3)s1	ZINC001045091263	1346493160	/nfs/dbraw/zinc/49/31/60/1346493160.db2.gz	SETCNLVJRDEWSM-WMLDXEAASA-N	0	3	343.496	3.281	20	30		EGEDHN
C[C@]1(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)s2)C[C@H]2C[C@H]2C1	ZINC001045135555	1346501363	/nfs/dbraw/zinc/50/13/63/1346501363.db2.gz	WYGBYSUFWQQECL-QCUYGVNKSA-N	0	3	343.496	3.137	20	30		EGEDHN
CC(C)C1(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)c(F)c2)CC1	ZINC001045191124	1346524900	/nfs/dbraw/zinc/52/49/00/1346524900.db2.gz	IVCXATOIDQTKRM-KRWDZBQOSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)c(F)c2)C1	ZINC001045190949	1346525082	/nfs/dbraw/zinc/52/50/82/1346525082.db2.gz	NSQIESHDOCBFSK-KRWDZBQOSA-N	0	3	341.430	3.134	20	30		EGEDHN
CC1(C)CC(C(=O)NC2(C)CCN(Cc3ccc(C#N)cc3)CC2)C1	ZINC001045429325	1346591127	/nfs/dbraw/zinc/59/11/27/1346591127.db2.gz	UUBZBQZJNIQJDG-UHFFFAOYSA-N	0	3	339.483	3.465	20	30		EGEDHN
Cc1cnccc1C(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045434512	1346593277	/nfs/dbraw/zinc/59/32/77/1346593277.db2.gz	WVVFYLQVJCLYBL-UHFFFAOYSA-N	0	3	348.450	3.046	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2cc(C3CCCCC3)n[nH]2)CC1	ZINC001045464403	1346600217	/nfs/dbraw/zinc/60/02/17/1346600217.db2.gz	QEVKNRYMKGDZOE-UHFFFAOYSA-N	0	3	342.487	3.065	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)[C@H]2CC[C@@H]2c2ccc(F)cc2)CC1	ZINC001045511586	1346613949	/nfs/dbraw/zinc/61/39/49/1346613949.db2.gz	SZRJAMCKDZKXPW-MSOLQXFVSA-N	0	3	330.447	3.476	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2nc(Cl)sc2Cl)CC1	ZINC001045519290	1346615665	/nfs/dbraw/zinc/61/56/65/1346615665.db2.gz	CTLSJPBSRSGOFZ-UHFFFAOYSA-N	0	3	334.272	3.220	20	30		EGEDHN
C[C@@H]1CC[C@H](C(=O)NC2(C)CCN(Cc3ccc(C#N)cc3)CC2)C1	ZINC001045579481	1346635090	/nfs/dbraw/zinc/63/50/90/1346635090.db2.gz	DPZBYSYCMBZJGZ-APWZRJJASA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2cccn2C2CCCC2)CC1	ZINC001045599076	1346640578	/nfs/dbraw/zinc/64/05/78/1346640578.db2.gz	LFELFQNFLABYLF-UHFFFAOYSA-N	0	3	327.472	3.211	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2ccc3nc(C)sc3c2)CC1	ZINC001045610297	1346646623	/nfs/dbraw/zinc/64/66/23/1346646623.db2.gz	KBXYAQBGVYIMQS-UHFFFAOYSA-N	0	3	329.469	3.375	20	30		EGEDHN
CC1(CC(=O)N2CC[C@H]3CC[C@@H](C2)N3Cc2ccc(C#N)cc2)CC1	ZINC001045814848	1346706080	/nfs/dbraw/zinc/70/60/80/1346706080.db2.gz	DYXZHZIWUXETIE-MOPGFXCFSA-N	0	3	337.467	3.314	20	30		EGEDHN
CC1(C(=O)N2CC[C@H]3CC[C@@H](C2)N3Cc2ccc(C#N)cc2)CCC1	ZINC001045828453	1346711019	/nfs/dbraw/zinc/71/10/19/1346711019.db2.gz	FWJUYEFPQFZZOB-MOPGFXCFSA-N	0	3	337.467	3.314	20	30		EGEDHN
CC(F)(F)CC(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1cccc(C#N)c1	ZINC001045842387	1346717375	/nfs/dbraw/zinc/71/73/75/1346717375.db2.gz	HGJRPNOHRPHGKQ-SJORKVTESA-N	0	3	347.409	3.169	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1cccc(C#N)c1	ZINC001045881786	1346731243	/nfs/dbraw/zinc/73/12/43/1346731243.db2.gz	INAJTAVFTCNWKF-MSOLQXFVSA-N	0	3	325.456	3.170	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1[nH]ccc1C1CC1)C2	ZINC001045945604	1346781224	/nfs/dbraw/zinc/78/12/24/1346781224.db2.gz	ZFHSATXCNJECTA-NRFANRHFSA-N	0	3	339.483	3.234	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc(C)c(F)cc1F)C2	ZINC001045946476	1346782118	/nfs/dbraw/zinc/78/21/18/1346782118.db2.gz	QRJUEISECHIYCA-FQEVSTJZSA-N	0	3	346.421	3.225	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc(C)cc(C)n1)C2	ZINC001045948814	1346783973	/nfs/dbraw/zinc/78/39/73/1346783973.db2.gz	RSSZNYYSHWZSLO-NRFANRHFSA-N	0	3	339.483	3.040	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@H]1CC[C@@H]3C[C@@H]3CC1)C2	ZINC001045954760	1346789969	/nfs/dbraw/zinc/78/99/69/1346789969.db2.gz	INZWEQFGBGUJGV-RCLSDMTESA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@H]1Cc3ccccc31)C2	ZINC001045962914	1346798258	/nfs/dbraw/zinc/79/82/58/1346798258.db2.gz	SCXVHERTMPDEEE-UNMCSNQZSA-N	0	3	336.479	3.054	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@H](C)c1cccc(C)c1)C2	ZINC001045969494	1346804632	/nfs/dbraw/zinc/80/46/32/1346804632.db2.gz	RNLPJVORXJVRJS-DENIHFKCSA-N	0	3	338.495	3.436	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cccc(F)c1Cl)C2	ZINC001045969329	1346804820	/nfs/dbraw/zinc/80/48/20/1346804820.db2.gz	OOZSMNMBHUVSEN-LJQANCHMSA-N	0	3	348.849	3.431	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H]1C[C@H]1C1CCC1)C2	ZINC001045973277	1346809533	/nfs/dbraw/zinc/80/95/33/1346809533.db2.gz	JXYYRILPBPRADG-QKNQBKEWSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1c[nH]cc1C1CC1)C2	ZINC001045977785	1346814277	/nfs/dbraw/zinc/81/42/77/1346814277.db2.gz	ITLBVNSUJIDNKU-NRFANRHFSA-N	0	3	339.483	3.234	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc(CC)c(CC)o1)C2	ZINC001045980421	1346817555	/nfs/dbraw/zinc/81/75/55/1346817555.db2.gz	YDCORKLWUAMPSI-NRFANRHFSA-N	0	3	342.483	3.356	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc(C(F)F)o1)C2	ZINC001045982276	1346821093	/nfs/dbraw/zinc/82/10/93/1346821093.db2.gz	SDBFKHOWARYXRA-SFHVURJKSA-N	0	3	336.382	3.169	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc(F)cc1F)C2	ZINC001045982969	1346822759	/nfs/dbraw/zinc/82/27/59/1346822759.db2.gz	HIFWPOUXDUDGHQ-HXUWFJFHSA-N	0	3	346.421	3.306	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)C1(c3ccccc3)CC1)C2	ZINC001045983153	1346823303	/nfs/dbraw/zinc/82/33/03/1346823303.db2.gz	JHXUKJWPKWYTQR-NRFANRHFSA-N	0	3	336.479	3.056	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@]1(C)CC=C(C)CC1)C2	ZINC001045985564	1346825783	/nfs/dbraw/zinc/82/57/83/1346825783.db2.gz	WXLMPWLZJMJGKQ-NHCUHLMSSA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cccn1C(C)C)C2	ZINC001045985393	1346825871	/nfs/dbraw/zinc/82/58/71/1346825871.db2.gz	UBYWPECXCPYNSS-HXUWFJFHSA-N	0	3	327.472	3.020	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cccn1C(C)C)C2	ZINC001045985300	1346826385	/nfs/dbraw/zinc/82/63/85/1346826385.db2.gz	QUUSFJWNKLHKAM-OAQYLSRUSA-N	0	3	341.499	3.411	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc(C)nc1C)C2	ZINC001045986219	1346827419	/nfs/dbraw/zinc/82/74/19/1346827419.db2.gz	KLSUVVNUOASELZ-NRFANRHFSA-N	0	3	339.483	3.040	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2cc(Cl)c(Cl)n2C)C1	ZINC001046359591	1346949349	/nfs/dbraw/zinc/94/93/49/1346949349.db2.gz	JZYIOFTWOSCKJC-HNNXBMFYSA-N	0	3	330.259	3.102	20	30		EGEDHN
C#CCCN1CC[C@@](C)(NC(=O)c2c(Cl)oc3ccccc32)C1	ZINC001046565408	1347019188	/nfs/dbraw/zinc/01/91/88/1347019188.db2.gz	LQUYWUGWYBFGET-GOSISDBHSA-N	0	3	330.815	3.304	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@]2(C)CCN([C@H](C)c3ccccc3)C2)nc1	ZINC001046782984	1347098291	/nfs/dbraw/zinc/09/82/91/1347098291.db2.gz	HVNKDBCOHGIBGA-IERDGZPVSA-N	0	3	333.435	3.018	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2cc(F)c(F)cc2Cl)C1	ZINC001046816316	1347116041	/nfs/dbraw/zinc/11/60/41/1347116041.db2.gz	GTSZSQIRVOEYHE-MRXNPFEDSA-N	0	3	328.790	3.389	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)[C@@H]2C[C@H]2c2cccc(F)c2F)C1	ZINC001046850974	1347129665	/nfs/dbraw/zinc/12/96/65/1347129665.db2.gz	YTQGJGWEYAENHZ-KHYOSLBOSA-N	0	3	334.410	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)C2CC(c3cccc(F)c3)C2)C1	ZINC001046872477	1347140862	/nfs/dbraw/zinc/14/08/62/1347140862.db2.gz	DMGBYPCWKTUCGQ-LBXVMSDZSA-N	0	3	330.447	3.476	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@@H](CNC(=O)C2CCCCCC2)C1	ZINC001046921917	1347154116	/nfs/dbraw/zinc/15/41/16/1347154116.db2.gz	QOHVDDIWMIPVCN-INIZCTEOSA-N	0	3	326.431	3.054	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2sccc2F)C1	ZINC001046937695	1347157494	/nfs/dbraw/zinc/15/74/94/1347157494.db2.gz	KNHZGFWALUDSIO-NSHDSACASA-N	0	3	332.391	3.150	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2occc2CC)C1	ZINC001046971452	1347172289	/nfs/dbraw/zinc/17/22/89/1347172289.db2.gz	PZQUPMJFLHNRHQ-AWEZNQCLSA-N	0	3	326.387	3.105	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@H](CNC(=O)[C@@H]2CCCC(C)(C)C2)C1	ZINC001046995858	1347178378	/nfs/dbraw/zinc/17/83/78/1347178378.db2.gz	LXPPGTYBEPCAMS-HZPDHXFCSA-N	0	3	340.458	3.300	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3cccc(F)c3)C2)CC1	ZINC001047220580	1347252858	/nfs/dbraw/zinc/25/28/58/1347252858.db2.gz	BXLVTBPUEDHOAG-GOSISDBHSA-N	0	3	328.431	3.023	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)C[C@@H]3C=CCCC3)C2)CC1	ZINC001047245605	1347271317	/nfs/dbraw/zinc/27/13/17/1347271317.db2.gz	ZSJGLAZPJANLPL-UYAOXDASSA-N	0	3	328.500	3.317	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)c3csc(C)n3)C2)CC1	ZINC001047249299	1347274173	/nfs/dbraw/zinc/27/41/73/1347274173.db2.gz	TWZMWVZNCSZQST-QGZVFWFLSA-N	0	3	345.512	3.039	20	30		EGEDHN
C=CCCN1C[C@H](O)[C@@H](N(C)C(=O)c2ccc(C(C)(C)CC)cc2)C1	ZINC001047422376	1347301099	/nfs/dbraw/zinc/30/10/99/1347301099.db2.gz	PKWALKFEPLJWRQ-OALUTQOASA-N	0	3	344.499	3.067	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)C2CCCC2)C1	ZINC001047674545	1347325603	/nfs/dbraw/zinc/32/56/03/1347325603.db2.gz	VRTBHEWNJKQPKD-HNAYVOBHSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@H]([C@@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001047680325	1347326887	/nfs/dbraw/zinc/32/68/87/1347326887.db2.gz	ATTHSZDMIJQZNF-ZBFHGGJFSA-N	0	3	331.435	3.070	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@H]([C@@H](C)NCc2ccccc2C#N)C1	ZINC001047723535	1347350739	/nfs/dbraw/zinc/35/07/39/1347350739.db2.gz	BHRGVIZBTRBDEF-BEFAXECRSA-N	0	3	327.472	3.321	20	30		EGEDHN
C[C@H](NCc1cc(F)ccc1C#N)[C@@H]1CCN(C(=O)C2(C)CCC2)C1	ZINC001047934710	1347415432	/nfs/dbraw/zinc/41/54/32/1347415432.db2.gz	CSRYJXILXBDEFE-GOEBONIOSA-N	0	3	343.446	3.214	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@@H]([C@@H](C)NCc2ccccc2C#N)C1	ZINC001047950466	1347421651	/nfs/dbraw/zinc/42/16/51/1347421651.db2.gz	LVAKXNQABBKTIJ-CRAIPNDOSA-N	0	3	327.472	3.321	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]([C@@H](C)NCc3ncc(C)s3)C2)C1	ZINC001047967809	1347427693	/nfs/dbraw/zinc/42/76/93/1347427693.db2.gz	YDQLWNXJKJBPMH-HUUCEWRRSA-N	0	3	333.501	3.134	20	30		EGEDHN
Cc1nc(O[C@@H]2CCCN(C(C)C)C2)c(C#N)cc1Br	ZINC001228797762	1375680573	/nfs/dbraw/zinc/68/05/73/1375680573.db2.gz	BCENBPVGNVOCJZ-CYBMUJFWSA-N	0	3	338.249	3.276	20	30		EGEDHN
C[C@@H]1CN(C(=O)C#CC2CC2)C[C@@H]1CNCc1c(F)cccc1Cl	ZINC001048246111	1347501399	/nfs/dbraw/zinc/50/13/99/1347501399.db2.gz	MDZBVHVOOXZBCR-HIFRSBDPSA-N	0	3	348.849	3.077	20	30		EGEDHN
CC(C(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1)=C1CCC1	ZINC001048246802	1347501759	/nfs/dbraw/zinc/50/17/59/1347501759.db2.gz	DDDMELLFYKNEBE-FOIQADDNSA-N	0	3	337.467	3.243	20	30		EGEDHN
C[C@H]1CN(C(=O)C2C=CC=CC=C2)C[C@H]1CNCc1ccccc1C#N	ZINC001048268711	1347506995	/nfs/dbraw/zinc/50/69/95/1347506995.db2.gz	ZPBDTFILGBWCNA-LAUBAEHRSA-N	0	3	347.462	3.041	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)[C@@H](CNCc2nc(C)sc2C)C1	ZINC001048339023	1347523151	/nfs/dbraw/zinc/52/31/51/1347523151.db2.gz	AIXQJLJTOVHORR-DOMZBBRYSA-N	0	3	335.517	3.156	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H](C)[C@@H](CNCc2nc(C)sc2C)C1	ZINC001048339026	1347523172	/nfs/dbraw/zinc/52/31/72/1347523172.db2.gz	AIXQJLJTOVHORR-WFASDCNBSA-N	0	3	335.517	3.156	20	30		EGEDHN
N#Cc1ccccc1CN1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)[C@@H]1CC13CC3)C2	ZINC001048569841	1347597875	/nfs/dbraw/zinc/59/78/75/1347597875.db2.gz	VUXKMACYEXYLAH-LDTOTXGLSA-N	0	3	349.478	3.218	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cccc(Cl)c3Cl)C[C@@H]2C1	ZINC001049186928	1347742626	/nfs/dbraw/zinc/74/26/26/1347742626.db2.gz	MJZFCIHTRFDKRC-BETUJISGSA-N	0	3	337.250	3.021	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc4c(cccc4F)s3)C[C@@H]2C1	ZINC001049206975	1347747699	/nfs/dbraw/zinc/74/76/99/1347747699.db2.gz	OESUMQAWCJAZAN-OKILXGFUSA-N	0	3	342.439	3.068	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1cccc(C#N)c1	ZINC001049344071	1347798571	/nfs/dbraw/zinc/79/85/71/1347798571.db2.gz	OGHLDBBNFYYTSK-IPELMVKDSA-N	0	3	325.456	3.170	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)C2CC=CC2)c1	ZINC001049397383	1347819970	/nfs/dbraw/zinc/81/99/70/1347819970.db2.gz	RUUNRXIUGPDLIF-WOJBJXKFSA-N	0	3	335.451	3.090	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N1CCC[C@H]2[C@H]1CCN2Cc1cccc(C#N)c1	ZINC001049414734	1347836715	/nfs/dbraw/zinc/83/67/15/1347836715.db2.gz	FXNCQHKDNPFOEL-CEXWTWQISA-N	0	3	337.467	3.170	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](CC)OC1CCCCC1	ZINC001049472686	1347866293	/nfs/dbraw/zinc/86/62/93/1347866293.db2.gz	GAHJBLCFNIFDMI-IPMKNSEASA-N	0	3	334.504	3.366	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(C(C)(C)C)cn1	ZINC001049488628	1347872598	/nfs/dbraw/zinc/87/25/98/1347872598.db2.gz	YYDHOAJHYZNQLZ-QZTJIDSGSA-N	0	3	327.472	3.244	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cccc([C@H]2CCOC2)c1	ZINC001049561481	1347909967	/nfs/dbraw/zinc/90/99/67/1347909967.db2.gz	LIIXAXACBZEGFW-XUVXKRRUSA-N	0	3	340.467	3.055	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(C)nn1C(CC)CC	ZINC001049561509	1347910574	/nfs/dbraw/zinc/91/05/74/1347910574.db2.gz	MEAGYJNGRZLZCF-ZWKOTPCHSA-N	0	3	344.503	3.418	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(C)n([C@@H](C)C2CC2)n1	ZINC001049565028	1347912528	/nfs/dbraw/zinc/91/25/28/1347912528.db2.gz	RNCCQIXRPAQMKD-ZYSHUDEJSA-N	0	3	342.487	3.027	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1c(C)cccc1Cl	ZINC001049566238	1347913254	/nfs/dbraw/zinc/91/32/54/1347913254.db2.gz	ASIUXKDYANSNFP-MSOLQXFVSA-N	0	3	332.875	3.442	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)COc1ccc(C(C)C)cc1	ZINC001049577347	1347918063	/nfs/dbraw/zinc/91/80/63/1347918063.db2.gz	PFNDDQPDPGZSOT-VQTJNVASSA-N	0	3	342.483	3.440	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C1(c2ccc(F)cc2)CCC1	ZINC001049629867	1347943406	/nfs/dbraw/zinc/94/34/06/1347943406.db2.gz	MSFFWDCSGYVEMV-RTBURBONSA-N	0	3	342.458	3.499	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1ccc(C)nc1C	ZINC001049633802	1347946068	/nfs/dbraw/zinc/94/60/68/1347946068.db2.gz	BEUWAYGAGMCWDT-OALUTQOASA-N	0	3	341.499	3.476	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cncc(OC(C)C)c1	ZINC001049635936	1347946293	/nfs/dbraw/zinc/94/62/93/1347946293.db2.gz	WWBUVLSTOPKOOL-RTBURBONSA-N	0	3	343.471	3.124	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049649108	1347954918	/nfs/dbraw/zinc/95/49/18/1347954918.db2.gz	ZECKDJAGKNLLCG-RTBURBONSA-N	0	3	337.467	3.336	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(F)c(F)c1F	ZINC001049676795	1347968192	/nfs/dbraw/zinc/96/81/92/1347968192.db2.gz	QPONQJKBPBJEMN-HUUCEWRRSA-N	0	3	338.373	3.359	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1ccc(F)cc1Cl	ZINC001049690058	1347973344	/nfs/dbraw/zinc/97/33/44/1347973344.db2.gz	NNKSGKFGRSZDJD-ZWKOTPCHSA-N	0	3	348.849	3.110	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]3[C@@H]2CCN3Cc2ncccc2C)C1	ZINC001049712365	1347986429	/nfs/dbraw/zinc/98/64/29/1347986429.db2.gz	QBVWPYSOCFWIMZ-OALUTQOASA-N	0	3	339.483	3.312	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1ccc(F)c(Cl)c1	ZINC001049747883	1347998488	/nfs/dbraw/zinc/99/84/88/1347998488.db2.gz	LGCRJJHGHOOKMO-ROUUACIJSA-N	0	3	348.849	3.110	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccn(C(CC)CC)n1	ZINC001049766430	1348009679	/nfs/dbraw/zinc/00/96/79/1348009679.db2.gz	KYKRAAAPXGSOPU-MOPGFXCFSA-N	0	3	344.503	3.499	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccn(C(CC)CC)n1	ZINC001049768511	1348011531	/nfs/dbraw/zinc/01/15/31/1348011531.db2.gz	WRBZNJVXXCZSHP-MSOLQXFVSA-N	0	3	330.476	3.109	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccc(OC)cc1	ZINC001049777111	1348016782	/nfs/dbraw/zinc/01/67/82/1348016782.db2.gz	OCUASNGGURAVMM-ZGXWSNOMSA-N	0	3	340.467	3.050	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1cccc(OC)c1	ZINC001049778632	1348017180	/nfs/dbraw/zinc/01/71/80/1348017180.db2.gz	XJRMHOKMEALBCA-YRPNKDGESA-N	0	3	340.467	3.050	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](C)c1cc(C)oc1C	ZINC001049791270	1348023861	/nfs/dbraw/zinc/02/38/61/1348023861.db2.gz	RMMUBQDSQKOGST-ZYSHUDEJSA-N	0	3	328.456	3.089	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc2scnc2c1	ZINC001049820360	1348037236	/nfs/dbraw/zinc/03/72/36/1348037236.db2.gz	KAWFIRLKMSEJOW-HZPDHXFCSA-N	0	3	327.453	3.161	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1oc(CCC)nc1C	ZINC001049849113	1348057660	/nfs/dbraw/zinc/05/76/60/1348057660.db2.gz	NTMQVSSDOYJBJH-HOTGVXAUSA-N	0	3	331.460	3.191	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc2c(s1)CCC2	ZINC001049874702	1348079690	/nfs/dbraw/zinc/07/96/90/1348079690.db2.gz	BBZJIYNIJDWTGM-HZPDHXFCSA-N	0	3	330.497	3.492	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1csc2c1CCCC2	ZINC001049880561	1348085601	/nfs/dbraw/zinc/08/56/01/1348085601.db2.gz	GQMWQRHKQAUZCE-SJORKVTESA-N	0	3	330.497	3.492	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(C)n(C(C)C)c1C	ZINC001049884190	1348089603	/nfs/dbraw/zinc/08/96/03/1348089603.db2.gz	AMNCFGVKKHIUGO-UXHICEINSA-N	0	3	341.499	3.388	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1c(Cl)cccc1OC	ZINC001049914842	1348109537	/nfs/dbraw/zinc/10/95/37/1348109537.db2.gz	RHLNPFZDJFXCRI-GJZGRUSLSA-N	0	3	334.847	3.214	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1c[nH]c2ccc(C)cc12	ZINC001049919143	1348111954	/nfs/dbraw/zinc/11/19/54/1348111954.db2.gz	ULNDHBUSYYZWLS-VQTJNVASSA-N	0	3	335.451	3.179	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1csc(CC(C)C)n1	ZINC001049927489	1348117867	/nfs/dbraw/zinc/11/78/67/1348117867.db2.gz	LCQROPINIXCZTQ-CVEARBPZSA-N	0	3	333.501	3.207	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cc(Cl)c(Cl)[nH]3)[C@@H]2C1	ZINC001050107575	1348185405	/nfs/dbraw/zinc/18/54/05/1348185405.db2.gz	NQOAESSCNKONNA-GXFFZTMASA-N	0	3	328.243	3.044	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)[C@H](C)c3ccc(CC)cc3)[C@@H]2C1	ZINC001050164549	1348201214	/nfs/dbraw/zinc/20/12/14/1348201214.db2.gz	IXEOWGUMFOMJTC-LSTHTHJFSA-N	0	3	326.484	3.461	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001050490150	1348278501	/nfs/dbraw/zinc/27/85/01/1348278501.db2.gz	IUKCCQHTMGFEPK-SFHVURJKSA-N	0	3	337.467	3.029	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3c(C)oc4ccccc43)C2)CC1	ZINC001050532853	1348285253	/nfs/dbraw/zinc/28/52/53/1348285253.db2.gz	ZXQFUIUPFFLLFV-UHFFFAOYSA-N	0	3	336.435	3.303	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)Cc3ccc(C)cc3Cl)C2)CC1	ZINC001050568341	1348291599	/nfs/dbraw/zinc/29/15/99/1348291599.db2.gz	SEHZEBXXIJMXHB-UHFFFAOYSA-N	0	3	344.886	3.139	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC2(C1)CCN(Cc1c(C)noc1CC)CC2	ZINC001050616465	1348303973	/nfs/dbraw/zinc/30/39/73/1348303973.db2.gz	APJXUUIMSQAJIN-UHFFFAOYSA-N	0	3	345.487	3.182	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC2(C1)CCN(CCC(F)(F)F)CC2	ZINC001050645494	1348314021	/nfs/dbraw/zinc/31/40/21/1348314021.db2.gz	OHLNCYXGSXSZCX-OAHLLOKOSA-N	0	3	332.410	3.466	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)C3C(C)(C)C3(C)C)cccc2C1	ZINC001051285391	1348418267	/nfs/dbraw/zinc/41/82/67/1348418267.db2.gz	JVVNNNDKBQILIJ-UHFFFAOYSA-N	0	3	338.495	3.366	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3cc(C)cs3)cccc2C1	ZINC001051288100	1348419439	/nfs/dbraw/zinc/41/94/39/1348419439.db2.gz	LAKACQKIWIALQI-UHFFFAOYSA-N	0	3	338.476	3.368	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3[nH]c(C)cc3C)cccc2C1	ZINC001051292784	1348421879	/nfs/dbraw/zinc/42/18/79/1348421879.db2.gz	KQPDFIHUYBPEEK-UHFFFAOYSA-N	0	3	337.467	3.496	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3csc(C)c3)cccc2C1	ZINC001051301890	1348425757	/nfs/dbraw/zinc/42/57/57/1348425757.db2.gz	NHJNBSVBYQSDMM-UHFFFAOYSA-N	0	3	338.476	3.368	20	30		EGEDHN
C=C(C)CCN1CCN([C@H]2CCN(C(=O)CC3(C)CCCC3)C2)CC1	ZINC001052024805	1348497358	/nfs/dbraw/zinc/49/73/58/1348497358.db2.gz	NPYUWCPNHYUXEX-IBGZPJMESA-N	0	3	347.547	3.142	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@H](NC(=O)C3(C4CC4)CC3)CC2)c1	ZINC001052470740	1348549024	/nfs/dbraw/zinc/54/90/24/1348549024.db2.gz	KEUVZMZOLQKSEA-IBGZPJMESA-N	0	3	337.467	3.219	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cccc3ccc(C)nc32)CC1	ZINC001052485029	1348553243	/nfs/dbraw/zinc/55/32/43/1348553243.db2.gz	YDAUFQPSTGYFCH-SFHVURJKSA-N	0	3	335.451	3.151	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cc(F)cc3ccoc32)CC1	ZINC001052510774	1348562759	/nfs/dbraw/zinc/56/27/59/1348562759.db2.gz	YABBODMXMIKWAE-INIZCTEOSA-N	0	3	328.387	3.180	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@H](NC(=O)[C@H]3CC34CCC4)CC2)c1	ZINC001052755247	1348664844	/nfs/dbraw/zinc/66/48/44/1348664844.db2.gz	SMXVLDJFIUEKNX-RTBURBONSA-N	0	3	337.467	3.219	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)C2(c3ccccc3F)CCC2)CC1	ZINC001052862245	1348706704	/nfs/dbraw/zinc/70/67/04/1348706704.db2.gz	KOZRLRLPALNAFF-QGZVFWFLSA-N	0	3	342.458	3.241	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cc(C)n(CC3CC3)c2C)CC1	ZINC001052874253	1348713741	/nfs/dbraw/zinc/71/37/41/1348713741.db2.gz	YMSSZPPYCYOKJO-IBGZPJMESA-N	0	3	341.499	3.123	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)C2(c3ccccc3)CCCC2)CC1	ZINC001052914728	1348746363	/nfs/dbraw/zinc/74/63/63/1348746363.db2.gz	VPFMNGNVAJWKMO-HXUWFJFHSA-N	0	3	338.495	3.492	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cc3ccccc3n2CC)CC1	ZINC001052956401	1348770213	/nfs/dbraw/zinc/77/02/13/1348770213.db2.gz	SLCIBZLXEJUSIY-GOSISDBHSA-N	0	3	337.467	3.269	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@]2(C)CCc3ccccc3C2)CC1	ZINC001052983338	1348787743	/nfs/dbraw/zinc/78/77/43/1348787743.db2.gz	JNHNPTOMSLLVKM-IFMALSPDSA-N	0	3	338.495	3.176	20	30		EGEDHN
CCC(=O)N1CCC[C@H]([C@H]2CCCN(Cc3ccccc3C#N)C2)C1	ZINC001052998362	1348795921	/nfs/dbraw/zinc/79/59/21/1348795921.db2.gz	YCZJABABOQQJAB-PMACEKPBSA-N	0	3	339.483	3.419	20	30		EGEDHN
CC(=O)N1CCCC[C@@H]1[C@@H]1CCCN(Cc2ccc(C#N)s2)C1	ZINC001053054958	1348861102	/nfs/dbraw/zinc/86/11/02/1348861102.db2.gz	TYWTZGUOQYHXES-CRAIPNDOSA-N	0	3	331.485	3.233	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)/C=C\c2ccco2)C1	ZINC001053060069	1348869318	/nfs/dbraw/zinc/86/93/18/1348869318.db2.gz	CRRYOAKHLPXIRD-ZNBINOAGSA-N	0	3	326.440	3.019	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)CC(F)(F)F)C1	ZINC001053069793	1348883556	/nfs/dbraw/zinc/88/35/56/1348883556.db2.gz	PZFPKSFKKBTSEV-CABCVRRESA-N	0	3	330.394	3.055	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(C)n2C)C1	ZINC001053070275	1348884852	/nfs/dbraw/zinc/88/48/52/1348884852.db2.gz	WJSOWVZRGUTVGM-MOPGFXCFSA-N	0	3	341.499	3.064	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(C)n2C)C1	ZINC001053070278	1348884912	/nfs/dbraw/zinc/88/49/12/1348884912.db2.gz	WJSOWVZRGUTVGM-RTBURBONSA-N	0	3	341.499	3.064	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)Cc2ccc(C)o2)C1	ZINC001053080835	1348902389	/nfs/dbraw/zinc/90/23/89/1348902389.db2.gz	SZLLXSYJCDIOFS-ICSRJNTNSA-N	0	3	342.483	3.247	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccoc2CC)C1	ZINC001053085356	1348907615	/nfs/dbraw/zinc/90/76/15/1348907615.db2.gz	FMNNIOKLNYLXNE-WMZOPIPTSA-N	0	3	328.456	3.182	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)Cc2cccc(C)c2)C1	ZINC001053093428	1348921716	/nfs/dbraw/zinc/92/17/16/1348921716.db2.gz	MRHQAGOWTMQPBZ-SFTDATJTSA-N	0	3	338.495	3.264	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccn(CC)c2C)C1	ZINC001053095917	1348926139	/nfs/dbraw/zinc/92/61/39/1348926139.db2.gz	MIZKKXWRVLBEAU-ICSRJNTNSA-N	0	3	341.499	3.156	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cc(C(C)C)no2)C1	ZINC001053102753	1348936447	/nfs/dbraw/zinc/93/64/47/1348936447.db2.gz	UWYBIOGHXHDVAB-SJLPKXTDSA-N	0	3	343.471	3.138	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cccc(OC)c2)C1	ZINC001053107026	1348945018	/nfs/dbraw/zinc/94/50/18/1348945018.db2.gz	YGIWOGGCPYUTEO-UYAOXDASSA-N	0	3	340.467	3.035	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc3cc(C)cn3c1)C2	ZINC001054142631	1349153420	/nfs/dbraw/zinc/15/34/20/1349153420.db2.gz	HGXIXUFAYAGQKT-JOCHJYFZSA-N	0	3	349.478	3.199	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc(F)ccc1CC)C2	ZINC001054160168	1349162264	/nfs/dbraw/zinc/16/22/64/1349162264.db2.gz	XODVZDDAGGVUJE-OAQYLSRUSA-N	0	3	342.458	3.340	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(-n3cccc3)cc1)C2	ZINC001054160561	1349162742	/nfs/dbraw/zinc/16/27/42/1349162742.db2.gz	ILYAZEFCLXTPCD-QFIPXVFZSA-N	0	3	347.462	3.039	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc(C)cc(Cl)c1)C2	ZINC001054165033	1349167532	/nfs/dbraw/zinc/16/75/32/1349167532.db2.gz	YFYLFNSXAYLWOY-LJQANCHMSA-N	0	3	330.859	3.210	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc3c(cc(C)cc3C)[nH]1)C2	ZINC001054172380	1349173661	/nfs/dbraw/zinc/17/36/61/1349173661.db2.gz	MUDALRYLUCQEPR-QFIPXVFZSA-N	0	3	349.478	3.346	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)N1CCC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001054176689	1349179092	/nfs/dbraw/zinc/17/90/92/1349179092.db2.gz	KUHZOSADVMSAMU-BSIFCXSSSA-N	0	3	337.467	3.029	20	30		EGEDHN
CC[C@H](F)C(=O)N1CCC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001054177687	1349179421	/nfs/dbraw/zinc/17/94/21/1349179421.db2.gz	QCEPTPBXXIKJLF-AZUAARDMSA-N	0	3	343.446	3.121	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(F)c(Cl)c1)C2	ZINC001054187195	1349190044	/nfs/dbraw/zinc/19/00/44/1349190044.db2.gz	MTITZJKQMDUKSX-SFHVURJKSA-N	0	3	334.822	3.040	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccccc1-n1cccc1)C2	ZINC001054188285	1349191488	/nfs/dbraw/zinc/19/14/88/1349191488.db2.gz	LGELHBXALJLCCD-JOCHJYFZSA-N	0	3	347.462	3.039	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H]1CCCC(F)(F)C1)C2	ZINC001054196617	1349199175	/nfs/dbraw/zinc/19/91/75/1349199175.db2.gz	KQUSKJYPEXUGKG-SJLPKXTDSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cccc(F)c1Cl)C2	ZINC001054204243	1349206001	/nfs/dbraw/zinc/20/60/01/1349206001.db2.gz	QHJWWLYKSNOKGL-IBGZPJMESA-N	0	3	348.849	3.431	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1oc(CC)cc1C)C2	ZINC001054228552	1349222951	/nfs/dbraw/zinc/22/29/51/1349222951.db2.gz	SRWOWTNYKWTITN-FQEVSTJZSA-N	0	3	328.456	3.102	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)C1CCC(C3CC3)CC1)C2	ZINC001054234998	1349227512	/nfs/dbraw/zinc/22/75/12/1349227512.db2.gz	NMSPRBQLNIIJSB-GRERDSQWSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1sc(C(C)C)nc1C)C2	ZINC001054239080	1349233508	/nfs/dbraw/zinc/23/35/08/1349233508.db2.gz	JAIVEFDMISBPHR-IBGZPJMESA-N	0	3	345.512	3.136	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H](C)c1ccc(F)c(F)c1)C2	ZINC001054243214	1349236948	/nfs/dbraw/zinc/23/69/48/1349236948.db2.gz	ZBTISSKPICVCLS-YWZLYKJASA-N	0	3	346.421	3.016	20	30		EGEDHN
C=CCN1Cc2ccc(CNC(=O)c3ccc4cncn4c3C)cc2C1	ZINC001054271594	1349270654	/nfs/dbraw/zinc/27/06/54/1349270654.db2.gz	RZANAIXADHSCKD-UHFFFAOYSA-N	0	3	346.434	3.074	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@H]3CCC[C@H]3OC)cc2C1	ZINC001054271313	1349270677	/nfs/dbraw/zinc/27/06/77/1349270677.db2.gz	KWDFMCBXDACMMB-RBUKOAKNSA-N	0	3	328.456	3.010	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3c[nH]nc3C(C)C)cc2C1	ZINC001054272313	1349271919	/nfs/dbraw/zinc/27/19/19/1349271919.db2.gz	MUCAKHFUJCGEMG-UHFFFAOYSA-N	0	3	338.455	3.355	20	30		EGEDHN
C#Cc1ccc(C(=O)NCc2ccc3c(c2)CN(CCC=C)C3)cc1	ZINC001054276577	1349276877	/nfs/dbraw/zinc/27/68/77/1349276877.db2.gz	JYFOFSRHXJSWIT-UHFFFAOYSA-N	0	3	330.431	3.490	20	30		EGEDHN
C#Cc1cncc(C(=O)NCc2ccc3c(c2)CN(CCC(=C)C)C3)c1	ZINC001054281751	1349282884	/nfs/dbraw/zinc/28/28/84/1349282884.db2.gz	ZOENWDNVSROPTP-UHFFFAOYSA-N	0	3	345.446	3.275	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@H]3CCO[C@@H](C)C3)cc2C1	ZINC001054286718	1349289160	/nfs/dbraw/zinc/28/91/60/1349289160.db2.gz	OHYHQOIDQAPENV-RDJZCZTQSA-N	0	3	328.456	3.010	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cccc4[nH]cnc43)cc2C1	ZINC001054287652	1349290136	/nfs/dbraw/zinc/29/01/36/1349290136.db2.gz	UZNGNTKZMWDRLT-UHFFFAOYSA-N	0	3	346.434	3.385	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](C)[C@H](NCc2cccc(Cl)n2)C1	ZINC001054970806	1349531560	/nfs/dbraw/zinc/53/15/60/1349531560.db2.gz	ITNYGPPTEOUGOG-DZGCQCFKSA-N	0	3	335.879	3.274	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C(C)=C1CCCC1)C[C@@H](C)O2	ZINC001071155219	1354479617	/nfs/dbraw/zinc/47/96/17/1354479617.db2.gz	XNWIVSDHLMUNJF-UZLBHIALSA-N	0	3	332.488	3.145	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1ccc(C)c(F)c1)C[C@@H](C)O2	ZINC001071185793	1354491627	/nfs/dbraw/zinc/49/16/27/1354491627.db2.gz	LYHRAZZELWPRNK-OXQOHEQNSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C1(C3CCC3)CCC1)C[C@@H](C)O2	ZINC001071196809	1354498476	/nfs/dbraw/zinc/49/84/76/1354498476.db2.gz	IQOQGJJYJZNZHB-YLJYHZDGSA-N	0	3	346.515	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)CC1CC(C)(C)C1)C[C@H](C)O2	ZINC001071201395	1354501815	/nfs/dbraw/zinc/50/18/15/1354501815.db2.gz	DMRDOVDZAMZYSD-JXFKEZNVSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H](C)O[C@]3(CCN(CC=C(C)C)C3)C2)CC1	ZINC001071202312	1354502795	/nfs/dbraw/zinc/50/27/95/1354502795.db2.gz	SXNRSGUOMGTJOD-NQIIRXRSSA-N	0	3	346.515	3.391	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1ccc(F)c(C)c1)C[C@H](C)O2	ZINC001071203715	1354503579	/nfs/dbraw/zinc/50/35/79/1354503579.db2.gz	GSFQFRPMWKZHRT-OXJNMPFZSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1cccc(Cl)c1)C[C@@H](C)O2	ZINC001071232698	1354516276	/nfs/dbraw/zinc/51/62/76/1354516276.db2.gz	AIQVYONTYHJGBD-DNVCBOLYSA-N	0	3	348.874	3.222	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1cc(C)cc(C)c1)C[C@H](C)O2	ZINC001071236637	1354520833	/nfs/dbraw/zinc/52/08/33/1354520833.db2.gz	XISGKCNAYHXFQZ-GHTZIAJQSA-N	0	3	342.483	3.185	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C1CCC(C)(C)CC1)C[C@@H](C)O2	ZINC001071246182	1354526282	/nfs/dbraw/zinc/52/62/82/1354526282.db2.gz	QCLYUHVYZUKMSK-UTKZUKDTSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ncn3cc(Cl)ccc23)CC[C@@H]1C	ZINC001071516791	1354738644	/nfs/dbraw/zinc/73/86/44/1354738644.db2.gz	BQKSHXBJMFBGFZ-DZGCQCFKSA-N	0	3	346.862	3.147	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCCC[C@@H](N[C@@H](C)c2n[nH]c(CC)n2)C1	ZINC001088359544	1359843069	/nfs/dbraw/zinc/84/30/69/1359843069.db2.gz	AWGLXQNATDFVHQ-LSDHHAIUSA-N	0	3	347.507	3.001	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2oc3c(cccc3F)c2C)CC[C@@H]1C	ZINC001071568346	1354767804	/nfs/dbraw/zinc/76/78/04/1354767804.db2.gz	MLIPIZZQFCYKHI-ZFWWWQNUSA-N	0	3	342.414	3.486	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N[C@@H]1CC[C@@H](C)N(CCCF)C1	ZINC001071619533	1354801893	/nfs/dbraw/zinc/80/18/93/1354801893.db2.gz	PXZGVQBKAZVNKK-HZPDHXFCSA-N	0	3	334.435	3.194	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2c(C)c(F)ccc2Cl)CC[C@@H]1C	ZINC001071624187	1354807522	/nfs/dbraw/zinc/80/75/22/1354807522.db2.gz	FMOSDIDPVXYZCG-JSGCOSHPSA-N	0	3	336.838	3.394	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2coc3cc(F)ccc23)CC[C@H]1C	ZINC001071631649	1354813672	/nfs/dbraw/zinc/81/36/72/1354813672.db2.gz	PQSIFXVLQHLMFJ-UKRRQHHQSA-N	0	3	328.387	3.178	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cnn(-c3ccccc3)c2)CC[C@@H]1C	ZINC001071662292	1354833670	/nfs/dbraw/zinc/83/36/70/1354833670.db2.gz	BSJREIMFJKJJOP-FUHWJXTLSA-N	0	3	338.455	3.031	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)Cc2cc3ccccc3s2)CC[C@H]1C	ZINC001071681154	1354848978	/nfs/dbraw/zinc/84/89/78/1354848978.db2.gz	ZAQRRQAHRMQHRI-WBVHZDCISA-N	0	3	340.492	3.436	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc3cc(Cl)ccc3[nH]2)CC[C@H]1C	ZINC001071728881	1354883942	/nfs/dbraw/zinc/88/39/42/1354883942.db2.gz	UYYNAKRCVGUPFE-CZUORRHYSA-N	0	3	343.858	3.427	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc3c(ccc(C)c3C)[nH]2)CC[C@@H]1C	ZINC001071739847	1354889757	/nfs/dbraw/zinc/88/97/57/1354889757.db2.gz	ZCJDXGZWZVZKNG-DOTOQJQBSA-N	0	3	337.467	3.391	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C(C)(C)c2c(C)noc2C)CC[C@H]1C	ZINC001071761501	1354908984	/nfs/dbraw/zinc/90/89/84/1354908984.db2.gz	YXJTXJWCXFOVAU-CZUORRHYSA-N	0	3	333.476	3.114	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccn(C(C)C)c2C)CC(C)(C)C1	ZINC001089470054	1360453276	/nfs/dbraw/zinc/45/32/76/1360453276.db2.gz	JRIHLANAKDOEOX-KRWDZBQOSA-N	0	3	329.488	3.231	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C2(c3cccc(F)c3)CC2)CC[C@H]1C	ZINC001071855489	1354983444	/nfs/dbraw/zinc/98/34/44/1354983444.db2.gz	QJUSSUQQLYIGSF-QAPCUYQASA-N	0	3	330.447	3.403	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)Cc2c[nH]c3c2cccc3C)CC[C@@H]1C	ZINC001071873315	1354998223	/nfs/dbraw/zinc/99/82/23/1354998223.db2.gz	UQVCEJUWWXUZOG-DOTOQJQBSA-N	0	3	325.456	3.174	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2csc(C(C)(C)C)n2)CC[C@H]1C	ZINC001071892731	1355009995	/nfs/dbraw/zinc/00/99/95/1355009995.db2.gz	HYWHMJFLXWXSJW-ZIAGYGMSSA-N	0	3	333.501	3.047	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ncoc2-c2cccs2)CC[C@@H]1C	ZINC001071908239	1355018712	/nfs/dbraw/zinc/01/87/12/1355018712.db2.gz	PWHXZJQKKVXBJT-KBPBESRZSA-N	0	3	343.452	3.009	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc3[nH]c(C)nc3c2)CC[C@@H]1C	ZINC001071938724	1355035485	/nfs/dbraw/zinc/03/54/85/1355035485.db2.gz	OUAHSVWIUMURGB-BBRMVZONSA-N	0	3	326.444	3.030	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cncc(C(F)(F)F)c2)CC[C@H]1C	ZINC001071957523	1355042846	/nfs/dbraw/zinc/04/28/46/1355042846.db2.gz	JSFYOUMVZJSABW-DOMZBBRYSA-N	0	3	341.377	3.259	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cnn(CCCC)c2C)CC[C@H]1C	ZINC001071976612	1355055814	/nfs/dbraw/zinc/05/58/14/1355055814.db2.gz	FQLCEUITVNITFM-NVXWUHKLSA-N	0	3	332.492	3.150	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cnn(C3CCCC3)c2C)CC[C@H]1C	ZINC001071977892	1355057319	/nfs/dbraw/zinc/05/73/19/1355057319.db2.gz	UKQAUBXRMAJESA-NVXWUHKLSA-N	0	3	344.503	3.465	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)Cc2c[nH]c3cccc(C)c23)CC[C@H]1C	ZINC001071997872	1355065729	/nfs/dbraw/zinc/06/57/29/1355065729.db2.gz	FSUCIZJFKFXWHV-NVXWUHKLSA-N	0	3	325.456	3.174	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cccc(C(F)(F)F)c2)CC[C@@H]1C	ZINC001072020154	1355082905	/nfs/dbraw/zinc/08/29/05/1355082905.db2.gz	UJBOOADNHISDIZ-XJKSGUPXSA-N	0	3	338.373	3.311	20	30		EGEDHN
C=C(Cl)CN1C[C@H](NC(=O)c2cccc(CN(C)C)c2)CC[C@@H]1C	ZINC001072095060	1355126807	/nfs/dbraw/zinc/12/68/07/1355126807.db2.gz	FWPDEMIJDBLSQS-MAUKXSAKSA-N	0	3	349.906	3.083	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](NC(=O)c2cccc(CN(C)C)c2)CC[C@H]1C	ZINC001072095061	1355126832	/nfs/dbraw/zinc/12/68/32/1355126832.db2.gz	FWPDEMIJDBLSQS-QAPCUYQASA-N	0	3	349.906	3.083	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccccc2CC(C)C)CC[C@@H]1C	ZINC001072106995	1355134912	/nfs/dbraw/zinc/13/49/12/1355134912.db2.gz	ZDIFXLTYZHHGFP-HKUYNNGSSA-N	0	3	326.484	3.491	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N[C@@H]2CC[C@@H](C)N(CC(=C)C)C2)cc1	ZINC001072106896	1355134919	/nfs/dbraw/zinc/13/49/19/1355134919.db2.gz	XNVQUJZWQULSAG-IEBWSBKVSA-N	0	3	342.483	3.339	20	30		EGEDHN
C#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)C2CCCC2)CC1	ZINC001072129563	1355145150	/nfs/dbraw/zinc/14/51/50/1355145150.db2.gz	MFVOGSJAZTYHCA-HXUWFJFHSA-N	0	3	339.483	3.088	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](C)[C@@H](CNCc2ocnc2C)C1	ZINC001072334731	1355244012	/nfs/dbraw/zinc/24/40/12/1355244012.db2.gz	GSPCVRVDAPOVMJ-HOCLYGCPSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](C)[C@@H](CNCc2ccn(C(C)C)n2)C1	ZINC001072337095	1355245422	/nfs/dbraw/zinc/24/54/22/1355245422.db2.gz	WJLALXODTCNXRB-IRXDYDNUSA-N	0	3	346.519	3.250	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC2(C1)CCN([C@@H](C)c1cccc(Cl)c1)C2	ZINC001072544286	1355326868	/nfs/dbraw/zinc/32/68/68/1355326868.db2.gz	HKUZYMXGXBKUDJ-KGLIPLIRSA-N	0	3	331.847	3.095	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC2(C1)CCN([C@H]1CCc3ccc(Cl)cc31)C2	ZINC001072551542	1355330393	/nfs/dbraw/zinc/33/03/93/1355330393.db2.gz	HGLSZVDXVHGZJJ-GUYCJALGSA-N	0	3	343.858	3.021	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@@H]3CCC[C@@H](C(F)(F)F)C3)C2)C1	ZINC001072884454	1355483761	/nfs/dbraw/zinc/48/37/61/1355483761.db2.gz	VFPMGAYPGQVRHB-ZIAGYGMSSA-N	0	3	330.394	3.075	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C[C@H]3C[C@H](C)CC(C)(C)C3)C2)C1	ZINC001073062896	1355575948	/nfs/dbraw/zinc/57/59/48/1355575948.db2.gz	XMPHZXRVSFJSRA-ZWKOTPCHSA-N	0	3	330.516	3.397	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)[C@H]2CC[C@H](C3CCC3)CC2)C1	ZINC001073642739	1355850435	/nfs/dbraw/zinc/85/04/35/1355850435.db2.gz	SOSAFBBLQFDVHZ-UFYCRDLUSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2cc(C)ccc2C2CC2)C1	ZINC001073709998	1355872829	/nfs/dbraw/zinc/87/28/29/1355872829.db2.gz	NUOBZFYBEUCJSD-SFHVURJKSA-N	0	3	342.483	3.269	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2ccc3sccc3c2)C1	ZINC001073841801	1355914675	/nfs/dbraw/zinc/91/46/75/1355914675.db2.gz	SVSQEQBAHMKPPE-KRWDZBQOSA-N	0	3	344.480	3.298	20	30		EGEDHN
C#CCCN1CCCO[C@@H](CNC(=O)C2CCC(C(C)(C)C)CC2)C1	ZINC001073877840	1355934746	/nfs/dbraw/zinc/93/47/46/1355934746.db2.gz	BZSNMHBJKPMONI-ACBHZAAOSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2cc(CC)c(C)s2)C1	ZINC001073880795	1355938046	/nfs/dbraw/zinc/93/80/46/1355938046.db2.gz	TUBICSQUMOUNGP-MRXNPFEDSA-N	0	3	336.501	3.016	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCCC[C@@H]1CN(C)Cc1cccc(Cl)c1	ZINC001073972870	1356004423	/nfs/dbraw/zinc/00/44/23/1356004423.db2.gz	IFYSXPQXWBGLNA-RHSMWYFYSA-N	0	3	333.863	3.313	20	30		EGEDHN
C=C[C@@H](C(=O)N1CC[C@H](NCc2ccccn2)[C@@H]1C)c1ccccc1	ZINC001075124732	1356318893	/nfs/dbraw/zinc/31/88/93/1356318893.db2.gz	IBQDHZYKWFGBQE-DBVUQKKJSA-N	0	3	335.451	3.130	20	30		EGEDHN
C[C@@H](CC(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)[C@@H]1C)C1CC1	ZINC001075133695	1356323751	/nfs/dbraw/zinc/32/37/51/1356323751.db2.gz	MDVVLVSZWCOHAO-NJSLBKSFSA-N	0	3	343.446	3.213	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccccc2)CC[C@@H]1CNCc1ccccc1C#N	ZINC001075205883	1356339276	/nfs/dbraw/zinc/33/92/76/1356339276.db2.gz	NUFWKQVYAVACKV-YLJYHZDGSA-N	0	3	347.462	3.446	20	30		EGEDHN
C[C@H]1CN(C(=O)c2ccccc2)CC[C@@H]1CNCc1ccccc1C#N	ZINC001075205880	1356339315	/nfs/dbraw/zinc/33/93/15/1356339315.db2.gz	NUFWKQVYAVACKV-FXAWDEMLSA-N	0	3	347.462	3.446	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](C2CCN(C(=O)CSC)CC2)CC1	ZINC001075444704	1356375211	/nfs/dbraw/zinc/37/52/11/1356375211.db2.gz	JAMCUGGMHXJJNP-HNNXBMFYSA-N	0	3	344.952	3.443	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cncc4sccc43)[C@@H]2C1	ZINC001076166644	1356511042	/nfs/dbraw/zinc/51/10/42/1356511042.db2.gz	DSUUTTRLIUGMMA-XJKSGUPXSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccc(C)c(OCC)c3)[C@@H]2C1	ZINC001076318420	1356548276	/nfs/dbraw/zinc/54/82/76/1356548276.db2.gz	SDGNPPPFQCFAME-ZWKOTPCHSA-N	0	3	328.456	3.116	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3ccc(OC(C)C)cc3)[C@@H]2C1	ZINC001076533128	1356608432	/nfs/dbraw/zinc/60/84/32/1356608432.db2.gz	MCCZWDWWNGSNEB-PKOBYXMFSA-N	0	3	328.456	3.196	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2ccsc2C)C[C@H]1C(F)(F)F	ZINC001099248668	1363713073	/nfs/dbraw/zinc/71/30/73/1363713073.db2.gz	IJDNNGHYROENQQ-CHWSQXEVSA-N	0	3	332.391	3.225	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)C2CCCC2)C12CCC2	ZINC001078529225	1356996716	/nfs/dbraw/zinc/99/67/16/1356996716.db2.gz	NRZZLXNUAVTSOB-UONOGXRCSA-N	0	3	341.293	3.102	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2C[C@@H](NCc3c(C)noc3C)C23CCC3)C1	ZINC001078720447	1357064802	/nfs/dbraw/zinc/06/48/02/1357064802.db2.gz	LCQDEPCEDKTABR-IAGOWNOFSA-N	0	3	343.471	3.165	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2ccc3c(c2)COC3)C12CCC2	ZINC001078745703	1357069867	/nfs/dbraw/zinc/06/98/67/1357069867.db2.gz	BHVHKTDCMSTIAK-SJORKVTESA-N	0	3	346.858	3.100	20	30		EGEDHN
CCCCCCCCOCC(=O)N1CC[C@@H](NCc2cccnc2)C1	ZINC001183288459	1387291275	/nfs/dbraw/zinc/29/12/75/1387291275.db2.gz	IZGRISWQLJGAQD-LJQANCHMSA-N	0	3	347.503	3.149	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2c(C)oc3ccccc32)[C@H](OC)C1	ZINC001081723358	1357862590	/nfs/dbraw/zinc/86/25/90/1357862590.db2.gz	AMPIOUGWHLGBGX-SJLPKXTDSA-N	0	3	342.439	3.136	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2cc(C)n(C(C)C)c2C)[C@H](OC)C1	ZINC001082362906	1358022990	/nfs/dbraw/zinc/02/29/90/1358022990.db2.gz	CEKRZEDUYHZRES-RTBURBONSA-N	0	3	347.503	3.081	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2ccc([C@H](C)CC)cc2)[C@H](OC)C1	ZINC001082386329	1358025225	/nfs/dbraw/zinc/02/52/25/1358025225.db2.gz	BVZWRDXQRCXEDD-ATZDWAIDSA-N	0	3	330.472	3.205	20	30		EGEDHN
C[C@@H]1CN(C(=O)C[C@H]2CC=CCC2)C[C@H]1NCc1ccc(C#N)s1	ZINC001082688256	1358073249	/nfs/dbraw/zinc/07/32/49/1358073249.db2.gz	OXPITPLDKZZHLH-RVKKMQEKSA-N	0	3	343.496	3.303	20	30		EGEDHN
CC(C)c1ccccc1CN1CC[C@@H]2CN(C(=O)C#CC3CC3)[C@@H]2C1	ZINC001084334319	1358195621	/nfs/dbraw/zinc/19/56/21/1358195621.db2.gz	ZRZAKEIDFRVUSM-TZIWHRDSSA-N	0	3	336.479	3.256	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)c3cc(F)cc4ccncc43)[C@@H]2C1	ZINC001084352998	1358198835	/nfs/dbraw/zinc/19/88/35/1358198835.db2.gz	WWRIYRRFYZXGRM-DNVCBOLYSA-N	0	3	339.414	3.096	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)c3cc(F)c4ccccc4c3)[C@@H]2C1	ZINC001084391583	1358206753	/nfs/dbraw/zinc/20/67/53/1358206753.db2.gz	HPYDBGLLXTUNFT-OXQOHEQNSA-N	0	3	336.410	3.149	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3cc(COC)cs3)[C@@H]2C1	ZINC001084490304	1358223682	/nfs/dbraw/zinc/22/36/82/1358223682.db2.gz	XZICCHMDVITDHQ-HZPDHXFCSA-N	0	3	334.485	3.007	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)Cn3c(C)cc4ccccc43)[C@@H]2C1	ZINC001084498140	1358225725	/nfs/dbraw/zinc/22/57/25/1358225725.db2.gz	LOXSMSSFUSLNRL-UYAOXDASSA-N	0	3	337.467	3.059	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)Cc3ccc(C4CCC4)cc3)[C@@H]2C1	ZINC001084552501	1358236543	/nfs/dbraw/zinc/23/65/43/1358236543.db2.gz	DWIRPQFTGMKURR-NHCUHLMSSA-N	0	3	336.479	3.053	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)c3ccc(O[C@H](C)CC)cc3)[C@@H]2C1	ZINC001084760590	1358303795	/nfs/dbraw/zinc/30/37/95/1358303795.db2.gz	QDIVNRFJBFLGPL-YVWKXTFCSA-N	0	3	340.467	3.034	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1C[C@H]2CCN(CC3=CCCCC3)C[C@H]21	ZINC001084798251	1358313790	/nfs/dbraw/zinc/31/37/90/1358313790.db2.gz	HJAZAFQURRQWIF-FGZHOGPDSA-N	0	3	348.490	3.244	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)[C@@H]3CCCCc4ccccc43)[C@@H]2C1	ZINC001084857913	1358331471	/nfs/dbraw/zinc/33/14/71/1358331471.db2.gz	ALQFOOWEHUGPQX-HMXCVIKNSA-N	0	3	336.479	3.053	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@H](C)c3c(F)cccc3F)C[C@@H]21	ZINC001084989839	1358360517	/nfs/dbraw/zinc/36/05/17/1358360517.db2.gz	DGPBPLLKPHHPBL-VBQJREDUSA-N	0	3	334.410	3.177	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@H](c3ccccc3)C(C)C)C[C@@H]21	ZINC001085043849	1358375689	/nfs/dbraw/zinc/37/56/89/1358375689.db2.gz	GXHJJWCJCVFSML-GIVPXCGWSA-N	0	3	338.495	3.372	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C[C@@H](C)c3ccccc3F)C[C@@H]21	ZINC001085058110	1358380957	/nfs/dbraw/zinc/38/09/57/1358380957.db2.gz	UMHQBSAKRXRGEX-HLIPFELVSA-N	0	3	342.458	3.265	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cc(F)ccc1F	ZINC001085225860	1358437938	/nfs/dbraw/zinc/43/79/38/1358437938.db2.gz	RLSDSHLPVWVRNH-HUUCEWRRSA-N	0	3	328.790	3.348	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccn2ccccc12	ZINC001085269503	1358448076	/nfs/dbraw/zinc/44/80/76/1358448076.db2.gz	CIGKBJZVNRCKQT-HZPDHXFCSA-N	0	3	331.847	3.322	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1c(C)onc1C1CC1	ZINC001085276388	1358449378	/nfs/dbraw/zinc/44/93/78/1358449378.db2.gz	DZBUNJHYLIWPLH-ZIAGYGMSSA-N	0	3	337.851	3.244	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)[C@]1(C)C=CCC1	ZINC001085301006	1358458406	/nfs/dbraw/zinc/45/84/06/1358458406.db2.gz	PMWNJCORPZCOAW-IIAWOOMASA-N	0	3	341.293	3.268	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H]1CC12CCC2	ZINC001085347140	1358474580	/nfs/dbraw/zinc/47/45/80/1358474580.db2.gz	DZVSKHVOJNMWKU-MGPQQGTHSA-N	0	3	341.293	3.102	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)C[C@@H]1OCc2ccccc21	ZINC001085408780	1358492714	/nfs/dbraw/zinc/49/27/14/1358492714.db2.gz	RTOIOKVJULGIKQ-KURKYZTESA-N	0	3	348.874	3.418	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@@H]1CCc2ccc(OC)cc21	ZINC001085644394	1358657401	/nfs/dbraw/zinc/65/74/01/1358657401.db2.gz	MVVAFMYGENZJAM-IEBWSBKVSA-N	0	3	342.483	3.224	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1c(F)cc(F)cc1F	ZINC001085795019	1358769913	/nfs/dbraw/zinc/76/99/13/1358769913.db2.gz	LANSCGPXWLMZJX-ZDUSSCGKSA-N	0	3	326.362	3.216	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N(C)C[C@H]1CCN1CCCC1CCC1	ZINC001085864514	1358830257	/nfs/dbraw/zinc/83/02/57/1358830257.db2.gz	BNMBYSVZSUAAAB-AABGKKOBSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc2c(c1)C[C@@H](C)O2	ZINC001085875392	1358839076	/nfs/dbraw/zinc/83/90/76/1358839076.db2.gz	ZKOYKZGWQSBJCF-CRAIPNDOSA-N	0	3	328.456	3.123	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccncc1C(F)(F)F	ZINC001085905662	1358865277	/nfs/dbraw/zinc/86/52/77/1358865277.db2.gz	MPHXHHWWQPIPBZ-ZDUSSCGKSA-N	0	3	341.377	3.213	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1cnc2ccc(F)cc2c1	ZINC001085908304	1358866609	/nfs/dbraw/zinc/86/66/09/1358866609.db2.gz	GATCSSRMOMNMJL-QGZVFWFLSA-N	0	3	327.403	3.096	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc2c(C)cccn2c1	ZINC001085925007	1358882520	/nfs/dbraw/zinc/88/25/20/1358882520.db2.gz	MCERNZXUBFSKIN-GOSISDBHSA-N	0	3	325.456	3.360	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc2ncsc2c1	ZINC001085958220	1358915839	/nfs/dbraw/zinc/91/58/39/1358915839.db2.gz	VVHYGBVHJTUUOA-HNNXBMFYSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1cccc(OCC(C)C)c1	ZINC001085964715	1358923271	/nfs/dbraw/zinc/92/32/71/1358923271.db2.gz	OZAYFFJPSXHTGF-SFHVURJKSA-N	0	3	330.472	3.444	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc(C)n(C(C)(C)C)n1	ZINC001085973937	1358928233	/nfs/dbraw/zinc/92/82/33/1358928233.db2.gz	KADVMPUKIJDZNJ-MRXNPFEDSA-N	0	3	332.492	3.059	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1c(Cl)cccc1OC	ZINC001085986015	1358938082	/nfs/dbraw/zinc/93/80/82/1358938082.db2.gz	SUPWHGQAQUVQAM-AWEZNQCLSA-N	0	3	336.863	3.461	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@@H]1Cc2c1cccc2Cl	ZINC001085995300	1358950451	/nfs/dbraw/zinc/95/04/51/1358950451.db2.gz	JHQYJQJGXXARTJ-WMLDXEAASA-N	0	3	332.875	3.479	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc3c(c2)C(C)(C)CO3)C1	ZINC001086146277	1359008580	/nfs/dbraw/zinc/00/85/80/1359008580.db2.gz	ZLAACQZBIXTGFF-OTVXOJSOSA-N	0	3	348.874	3.207	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2nc3ccccc3cc2C)C1	ZINC001086152884	1359009959	/nfs/dbraw/zinc/00/99/59/1359009959.db2.gz	ONMITAVTUDLAPS-FZNQNYSPSA-N	0	3	343.858	3.394	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)[C@H]2CCCC2(C)C)C1	ZINC001086171311	1359013554	/nfs/dbraw/zinc/01/35/54/1359013554.db2.gz	JHFORYLRUFXZFK-HZSPNIEDSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(OC3CCC3)cc2)C1	ZINC001086276363	1359050999	/nfs/dbraw/zinc/05/09/99/1359050999.db2.gz	NGSGGRRHBMOJLK-FZNQNYSPSA-N	0	3	348.874	3.468	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cccc(Cl)c2F)C1	ZINC001086465832	1359108280	/nfs/dbraw/zinc/10/82/80/1359108280.db2.gz	XOJPCAGTJIMGJH-XYPYZODXSA-N	0	3	331.218	3.330	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2coc3ccc(OC)cc23)C1	ZINC001086424548	1359093657	/nfs/dbraw/zinc/09/36/57/1359093657.db2.gz	FSMLXWAHPGOAKS-JOCQHMNTSA-N	0	3	348.830	3.292	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ncsc2C(C)C)C1	ZINC001086531176	1359134003	/nfs/dbraw/zinc/13/40/03/1359134003.db2.gz	LBVWRXGTOCKGNP-HAQNSBGRSA-N	0	3	327.881	3.117	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2C[C@H](NCc3cccc(Cl)n3)C2)CC1	ZINC001086466704	1359108272	/nfs/dbraw/zinc/10/82/72/1359108272.db2.gz	QBQUJMXWJHYMPT-CZIWCDLHSA-N	0	3	347.890	3.466	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2C[C@H](NCc3c(C)noc3CC)C2)CC1	ZINC001086467477	1359108393	/nfs/dbraw/zinc/10/83/93/1359108393.db2.gz	FYQFHVAMVTWLAP-JCNLHEQBSA-N	0	3	345.487	3.276	20	30		EGEDHN
C=C(C)CCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2cc(C)no2)C1	ZINC001086573866	1359152707	/nfs/dbraw/zinc/15/27/07/1359152707.db2.gz	PLRZARSRSPOHGU-ZWKOTPCHSA-N	0	3	339.439	3.147	20	30		EGEDHN
C=C(C)CN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2cc[nH]c2CC)C1	ZINC001086586455	1359156357	/nfs/dbraw/zinc/15/63/57/1359156357.db2.gz	VGMBUFPLBKTZLT-AZUAARDMSA-N	0	3	337.467	3.351	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccc3[nH]nc(C)c3c2)C1	ZINC001086754805	1359195390	/nfs/dbraw/zinc/19/53/90/1359195390.db2.gz	LPUOZERDARCGFS-DZGCQCFKSA-N	0	3	346.862	3.112	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cc(Cl)cn2CC)C1	ZINC001086877226	1359219126	/nfs/dbraw/zinc/21/91/26/1359219126.db2.gz	HPTNBBXVPVGIMC-GXTWGEPZSA-N	0	3	344.286	3.402	20	30		EGEDHN
CCC(=O)N1CC2(C[C@@H]1C)CCN(Cc1cccc(C#N)c1)CC2	ZINC001086893205	1359222460	/nfs/dbraw/zinc/22/24/60/1359222460.db2.gz	JNRQAWYVSUOUMR-INIZCTEOSA-N	0	3	325.456	3.171	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc4cc(C)cn4c3)C2)CC1	ZINC001086926761	1359252063	/nfs/dbraw/zinc/25/20/63/1359252063.db2.gz	JEQNPZSCFFPZOT-SFHVURJKSA-N	0	3	349.478	3.198	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@H]3CCC=CCCC3)C2)CC1	ZINC001086928610	1359253155	/nfs/dbraw/zinc/25/31/55/1359253155.db2.gz	JBSMLZGINHNCFY-OALUTQOASA-N	0	3	328.500	3.459	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3c[nH]c4ccccc34)C2)CC1	ZINC001086931912	1359255803	/nfs/dbraw/zinc/25/58/03/1359255803.db2.gz	VLVCGLFQXNRMBQ-MRXNPFEDSA-N	0	3	335.451	3.118	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc(C)c(F)c3F)C2)CC1	ZINC001086944200	1359265502	/nfs/dbraw/zinc/26/55/02/1359265502.db2.gz	RKJRQISUOKXJQJ-OAHLLOKOSA-N	0	3	346.421	3.223	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)Cc3ccccc3F)C2)CC1	ZINC001086955069	1359275629	/nfs/dbraw/zinc/27/56/29/1359275629.db2.gz	CBDNQHNGGAXHHY-KRWDZBQOSA-N	0	3	342.458	3.095	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cc(C)c(C)s3)C2)CC1	ZINC001086956393	1359277299	/nfs/dbraw/zinc/27/72/99/1359277299.db2.gz	MQJPMZPPPLCWIO-HNNXBMFYSA-N	0	3	330.497	3.315	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@H](C)c3ccccc3C)C2)CC1	ZINC001086956810	1359277689	/nfs/dbraw/zinc/27/76/89/1359277689.db2.gz	XYWFBVFNVBVBJE-RTBURBONSA-N	0	3	338.495	3.435	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc(Cl)cn3CC)C2)CC1	ZINC001086957576	1359278584	/nfs/dbraw/zinc/27/85/84/1359278584.db2.gz	QXJIXVHLDHEZIR-OAHLLOKOSA-N	0	3	347.890	3.111	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3c(C)nsc3C)C2)CC1	ZINC001086958664	1359279897	/nfs/dbraw/zinc/27/98/97/1359279897.db2.gz	XKVBQNNNBCWLEC-CQSZACIVSA-N	0	3	345.512	3.100	20	30		EGEDHN
C/C=C(\C)C(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC001087145216	1359305700	/nfs/dbraw/zinc/30/57/00/1359305700.db2.gz	MKMFQLHDVYEBST-LABOVOQKSA-N	0	3	343.446	3.380	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc(C(C)C)nc1	ZINC001087290494	1359369278	/nfs/dbraw/zinc/36/92/78/1359369278.db2.gz	CVRUVHYTPKXXAZ-NZSAHSFTSA-N	0	3	339.483	3.057	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)Cc3cc(C)ccc3C)C(C)(C)[C@H]21	ZINC001087301689	1359385148	/nfs/dbraw/zinc/38/51/48/1359385148.db2.gz	HCDUIDXCTOVLCJ-NRSPTQNISA-N	0	3	338.495	3.084	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc(Cl)c3F)C(C)(C)[C@H]21	ZINC001087304239	1359387657	/nfs/dbraw/zinc/38/76/57/1359387657.db2.gz	ZIFIVJGRQQCWKW-XYPHTWIQSA-N	0	3	348.849	3.331	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(C(C)C)cn3)C(C)(C)[C@H]21	ZINC001087305163	1359390652	/nfs/dbraw/zinc/39/06/52/1359390652.db2.gz	OCLKBXXIBUJIMG-QRQLOZEOSA-N	0	3	339.483	3.057	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(Cl)cs3)C(C)(C)[C@H]21	ZINC001087307091	1359393704	/nfs/dbraw/zinc/39/37/04/1359393704.db2.gz	TVYCYOJULNZHQE-YUELXQCFSA-N	0	3	336.888	3.254	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)Cc3ccsc3C)C(C)(C)[C@@H]21	ZINC001087307845	1359394663	/nfs/dbraw/zinc/39/46/63/1359394663.db2.gz	IEWOLNVAZMEBNL-BHIYHBOVSA-N	0	3	344.524	3.228	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc4sccc4[nH]3)C(C)(C)[C@@H]21	ZINC001087313302	1359402002	/nfs/dbraw/zinc/40/20/02/1359402002.db2.gz	SDGMJLRBWOXKFL-CSMYWGQOSA-N	0	3	341.480	3.081	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3oc(CC)cc3C)C(C)(C)[C@H]21	ZINC001087313429	1359402084	/nfs/dbraw/zinc/40/20/84/1359402084.db2.gz	UYRWALIYJHFMRH-QRQLOZEOSA-N	0	3	342.483	3.393	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc(CC(C)C)c[nH]3)C(C)(C)[C@H]21	ZINC001087314692	1359404174	/nfs/dbraw/zinc/40/41/74/1359404174.db2.gz	PHXUIPBSPHZASG-NEWSRXKRSA-N	0	3	341.499	3.065	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(CC)cc3)C(C)(C)[C@H]21	ZINC001087315714	1359405896	/nfs/dbraw/zinc/40/58/96/1359405896.db2.gz	HFDLEFVBOPATRK-AQNXPRMDSA-N	0	3	338.495	3.491	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc(C4CC4)cc3)C(C)(C)[C@H]21	ZINC001087317862	1359409259	/nfs/dbraw/zinc/40/92/59/1359409259.db2.gz	NZOXNWMOXFIRNY-AABGKKOBSA-N	0	3	336.479	3.416	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(C)c(CC)s3)C(C)(C)[C@@H]21	ZINC001087317809	1359409304	/nfs/dbraw/zinc/40/93/04/1359409304.db2.gz	NEKDKSDALUNABR-ZTFGCOKTSA-N	0	3	344.524	3.471	20	30		EGEDHN
O=C(C1CCC1)N1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1CC#Cc1ccccc1	ZINC001087325889	1359416481	/nfs/dbraw/zinc/41/64/81/1359416481.db2.gz	JRMATFBBIJCTKF-CBPXPLCBSA-N	0	3	348.490	3.007	20	30		EGEDHN
C=CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)c2ocnc2C)C1	ZINC001087424607	1359460270	/nfs/dbraw/zinc/46/02/70/1359460270.db2.gz	HQLVKKOZPPCJRK-QZTJIDSGSA-N	0	3	339.439	3.147	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)[C@]2(C)C=CCC2)C1	ZINC001087434271	1359463724	/nfs/dbraw/zinc/46/37/24/1359463724.db2.gz	FEOOSMORBMJQIE-KCZVDYSFSA-N	0	3	336.479	3.340	20	30		EGEDHN
Cc1cc(C(=O)NCC2(NCc3cccc(C#N)c3)CC2)sc1C	ZINC001323607702	1387405383	/nfs/dbraw/zinc/40/53/83/1387405383.db2.gz	PQVKTOZTYWHCBH-UHFFFAOYSA-N	0	3	339.464	3.289	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2c(F)cccc2Cl)[C@H]1CC	ZINC001087808050	1359657514	/nfs/dbraw/zinc/65/75/14/1359657514.db2.gz	UMQDHYGZVDTOQK-DLBZAZTESA-N	0	3	336.838	3.014	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2c[nH]c3c2cccc3CC)[C@H]1CC	ZINC001087840828	1359675322	/nfs/dbraw/zinc/67/53/22/1359675322.db2.gz	PNGMNDXLZQJWEA-ZWKOTPCHSA-N	0	3	325.456	3.499	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1C[C@H]2CCN(Cc3cccc(C(F)F)c3)C[C@H]2C1	ZINC001087912045	1359705132	/nfs/dbraw/zinc/70/51/32/1359705132.db2.gz	VMKVCBSDNTWHPM-XKQJLSEDSA-N	0	3	347.409	3.064	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3c(C)c(F)ccc3Cl)C[C@@H]2C1	ZINC001088019472	1359725856	/nfs/dbraw/zinc/72/58/56/1359725856.db2.gz	PSMFFHIWKPMCPZ-CABCVRRESA-N	0	3	348.849	3.205	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)C(C)(C)c3cccc(Cl)c3)C[C@@H]2C1	ZINC001088123268	1359763735	/nfs/dbraw/zinc/76/37/35/1359763735.db2.gz	KZXJOZMSRPLGJW-CVEARBPZSA-N	0	3	344.886	3.031	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3ccc4sccc4c3)C[C@@H]2C1	ZINC001088157393	1359775299	/nfs/dbraw/zinc/77/52/99/1359775299.db2.gz	MPPYSVSHOQCDSP-MSOLQXFVSA-N	0	3	338.476	3.319	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3ccc(C(C)(F)F)cc3)C[C@@H]2C1	ZINC001088225278	1359803734	/nfs/dbraw/zinc/80/37/34/1359803734.db2.gz	HZJGWZIJXSUITF-SJORKVTESA-N	0	3	346.421	3.216	20	30		EGEDHN
CC#CCN1CC[C@@H](OCC2CCN(C(=O)C(C)(CC)CC)CC2)C1	ZINC001088241138	1359812888	/nfs/dbraw/zinc/81/28/88/1359812888.db2.gz	QHHLQURVGQJKGK-LJQANCHMSA-N	0	3	348.531	3.166	20	30		EGEDHN
CC(C)(F)C(=O)N1CCCCC[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001088247057	1359816516	/nfs/dbraw/zinc/81/65/16/1359816516.db2.gz	IKQQLKJWLIUKMI-INIZCTEOSA-N	0	3	349.425	3.306	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](CNCc2csc(C)n2)[C@H](C)C1	ZINC001184232791	1387418001	/nfs/dbraw/zinc/41/80/01/1387418001.db2.gz	XRUSVSTZWDMNQQ-WBVHZDCISA-N	0	3	347.528	3.219	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1CCCCC[C@@H](NCCF)C1	ZINC001088337288	1359832125	/nfs/dbraw/zinc/83/21/25/1359832125.db2.gz	BJBIROMGVBJITK-MRXNPFEDSA-N	0	3	334.435	3.195	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCCC[C@@H](NCc2cccnc2OC)C1	ZINC001088360080	1359844055	/nfs/dbraw/zinc/84/40/55/1359844055.db2.gz	PUROYVTUMQRCCM-QGZVFWFLSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCCC[C@@H](NCc2cc(OC)ccn2)C1	ZINC001088360292	1359844065	/nfs/dbraw/zinc/84/40/65/1359844065.db2.gz	VKHGZZVUCYIPAR-MRXNPFEDSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCCCC[C@@H](NCc2cnoc2C)C1	ZINC001088374225	1359855529	/nfs/dbraw/zinc/85/55/29/1359855529.db2.gz	BKZLQJNCFIAHED-MJGOQNOKSA-N	0	3	333.476	3.446	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2ccc3c(c2)COC3)C1	ZINC001088397309	1359872572	/nfs/dbraw/zinc/87/25/72/1359872572.db2.gz	FLXJKNZMYMCWEA-GOSISDBHSA-N	0	3	348.874	3.444	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2cnn3ccccc23)C1	ZINC001088400505	1359874948	/nfs/dbraw/zinc/87/49/48/1359874948.db2.gz	QXMSCKYLOMFQSW-HNNXBMFYSA-N	0	3	346.862	3.061	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2c[nH]nc2C2CC2)C1	ZINC001088408277	1359879358	/nfs/dbraw/zinc/87/93/58/1359879358.db2.gz	RCAPDFLFTPZCHZ-AWEZNQCLSA-N	0	3	336.867	3.014	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)[C@H]2[C@H]3[C@@H]2[C@@H]2CC[C@H]3C2)C1	ZINC001088433276	1359901544	/nfs/dbraw/zinc/90/15/44/1359901544.db2.gz	RGEKDXVYRZLDCQ-UCIFAOBLSA-N	0	3	336.907	3.392	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)CN(C)c2ccccc2)C1	ZINC001088433350	1359902053	/nfs/dbraw/zinc/90/20/53/1359902053.db2.gz	UMSOLAIIGRZAQC-QGZVFWFLSA-N	0	3	349.906	3.236	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CCN(Cc3ccccc3CC)[C@@H]2C)c1	ZINC001088846354	1360079689	/nfs/dbraw/zinc/07/96/89/1360079689.db2.gz	JSIVGLSAQUGYCC-IERDGZPVSA-N	0	3	347.462	3.018	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)[C@@]2(C)CCc3ccccc3C2)[C@H]1C	ZINC001089089937	1360163119	/nfs/dbraw/zinc/16/31/19/1360163119.db2.gz	BDTVINNQQWXYJS-PBEJRMEISA-N	0	3	326.484	3.337	20	30		EGEDHN
CC(C)=CC(=O)N1CCCC[C@H]1CN(C)Cc1cccc(C#N)c1	ZINC001089108306	1360173555	/nfs/dbraw/zinc/17/35/55/1360173555.db2.gz	IUWIJUJZKSYWJA-IBGZPJMESA-N	0	3	325.456	3.337	20	30		EGEDHN
CC(C)C(=O)N1CCCC[C@H]1CN(C)Cc1ccc(OCC#N)cc1	ZINC001089122056	1360185262	/nfs/dbraw/zinc/18/52/62/1360185262.db2.gz	TYDGIHFDDLJMSV-SFHVURJKSA-N	0	3	343.471	3.058	20	30		EGEDHN
C[C@@H]1CN(C(=O)C#CC(C)(C)C)CC[C@H]1CNC/C(Cl)=C/Cl	ZINC001184369510	1387441700	/nfs/dbraw/zinc/44/17/00/1387441700.db2.gz	FZFUYLLLCQHPLM-SYCNKOGLSA-N	0	3	345.314	3.429	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCCN1C(=O)c1cc[nH]c1	ZINC001089180570	1360230884	/nfs/dbraw/zinc/23/08/84/1360230884.db2.gz	SKZNPOBAQHZHGU-IBGZPJMESA-N	0	3	336.439	3.013	20	30		EGEDHN
C#Cc1cncc(C(=O)N2CCCC[C@H]2CN(C)Cc2ccccc2)c1	ZINC001089224741	1360266757	/nfs/dbraw/zinc/26/67/57/1360266757.db2.gz	QXHIYXNSPHZWKV-NRFANRHFSA-N	0	3	347.462	3.190	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCCN1C(=O)[C@@H]1CC12CC2	ZINC001089234023	1360272916	/nfs/dbraw/zinc/27/29/16/1360272916.db2.gz	SOKSWARVVGIQGM-OALUTQOASA-N	0	3	337.467	3.171	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(COC)cs2)CC(C)(C)C1	ZINC001089430196	1360422270	/nfs/dbraw/zinc/42/22/70/1360422270.db2.gz	JONHALLCRWIFKL-MRXNPFEDSA-N	0	3	348.512	3.138	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(C)nc2C(C)C)CC(C)(C)C1	ZINC001089449439	1360437953	/nfs/dbraw/zinc/43/79/53/1360437953.db2.gz	IJTXUCUWGWNCMH-KRWDZBQOSA-N	0	3	341.499	3.367	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc3cc(F)ccc3o2)CC(C)(C)C1	ZINC001089503221	1360476676	/nfs/dbraw/zinc/47/66/76/1360476676.db2.gz	TWIXZXRRMOSRKT-INIZCTEOSA-N	0	3	342.414	3.426	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cccc3c2ccn3C)CC(C)(C)C1	ZINC001089517697	1360487369	/nfs/dbraw/zinc/48/73/69/1360487369.db2.gz	SYDDCODXYUZVMM-INIZCTEOSA-N	0	3	337.467	3.032	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@H](C)c2ccccc2F)CC(C)(C)C1	ZINC001089521070	1360488556	/nfs/dbraw/zinc/48/85/56/1360488556.db2.gz	DPVCFLQRSHKSLA-HZPDHXFCSA-N	0	3	330.447	3.169	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2coc(C3CCCC3)n2)CC(C)(C)C1	ZINC001089529091	1360491667	/nfs/dbraw/zinc/49/16/67/1360491667.db2.gz	QRDXSSUTRIDNPK-INIZCTEOSA-N	0	3	343.471	3.186	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@H](C)c2ccc(C)s2)CC(C)(C)C1	ZINC001089537528	1360496085	/nfs/dbraw/zinc/49/60/85/1360496085.db2.gz	NVWBIGDKQZXREG-CVEARBPZSA-N	0	3	332.513	3.400	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(C[C@H](F)CC)CC(C)(C)C2)cn1	ZINC001089544502	1360499872	/nfs/dbraw/zinc/49/98/72/1360499872.db2.gz	UHGDQHGTRIJVQP-AEFFLSMTSA-N	0	3	345.462	3.031	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2sc(CCC)nc2C)CC(C)(C)C1	ZINC001089559163	1360507594	/nfs/dbraw/zinc/50/75/94/1360507594.db2.gz	NJESGOJEEBELJY-HNNXBMFYSA-N	0	3	347.528	3.258	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cccc3cnccc32)CC(C)(C)C1	ZINC001089564347	1360510583	/nfs/dbraw/zinc/51/05/83/1360510583.db2.gz	YFTYQYCZBOCYCH-KRWDZBQOSA-N	0	3	335.451	3.088	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2c(C)nsc2C)CC(C)(C)C1	ZINC001089564715	1360511468	/nfs/dbraw/zinc/51/14/68/1360511468.db2.gz	AWPYZOHWNUWTSO-OAHLLOKOSA-N	0	3	333.501	3.004	20	30		EGEDHN
CC(C)=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(C#N)c[nH]1	ZINC001089623782	1360541587	/nfs/dbraw/zinc/54/15/87/1360541587.db2.gz	SLXXSNIORVTVSY-MRXNPFEDSA-N	0	3	328.460	3.073	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H]1OCC[C@H]1C(C)C	ZINC001089640245	1360553868	/nfs/dbraw/zinc/55/38/68/1360553868.db2.gz	DBBPWVYTSDFLIP-SQNIBIBYSA-N	0	3	336.520	3.230	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccnc(C2CC2)c1	ZINC001089666860	1360577526	/nfs/dbraw/zinc/57/75/26/1360577526.db2.gz	ZNYFKDSGFCGTKR-GOSISDBHSA-N	0	3	339.483	3.203	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc2[nH]ccc2n1	ZINC001089668666	1360578599	/nfs/dbraw/zinc/57/85/99/1360578599.db2.gz	ZYVIKZLENPRNNJ-OAHLLOKOSA-N	0	3	340.471	3.359	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(C)c(C)cn1	ZINC001089675755	1360584278	/nfs/dbraw/zinc/58/42/78/1360584278.db2.gz	PDPNGJMJWKWDQY-KRWDZBQOSA-N	0	3	329.488	3.495	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cccc(OCC)c1	ZINC001089706209	1360608870	/nfs/dbraw/zinc/60/88/70/1360608870.db2.gz	PIYVSIBELJYSJX-QGZVFWFLSA-N	0	3	330.472	3.492	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cnn(C)c1C1CC1	ZINC001089735563	1360640438	/nfs/dbraw/zinc/64/04/38/1360640438.db2.gz	DYVWCQAQCICIBT-INIZCTEOSA-N	0	3	344.503	3.094	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](CNCc2cc(C)no2)[C@H](C)C1	ZINC001184457952	1387465370	/nfs/dbraw/zinc/46/53/70/1387465370.db2.gz	CRDJUFWUBKHNNY-QAPCUYQASA-N	0	3	345.487	3.326	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc2n(c1)CCCC2	ZINC001089742812	1360646185	/nfs/dbraw/zinc/64/61/85/1360646185.db2.gz	QJFPUJDOPIXHKE-GOSISDBHSA-N	0	3	329.488	3.231	20	30		EGEDHN
N#Cc1ccccc1CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1CCC1	ZINC001089751524	1360649114	/nfs/dbraw/zinc/64/91/14/1360649114.db2.gz	UJKSDJHEDDJYQD-WOZUAGRISA-N	0	3	349.478	3.027	20	30		EGEDHN
N#Cc1ccccc1CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)C2CCC2)C1	ZINC001089751523	1360649240	/nfs/dbraw/zinc/64/92/40/1360649240.db2.gz	UJKSDJHEDDJYQD-TUFLPTIASA-N	0	3	349.478	3.027	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2oc(C)cc2C)CC2(CCOCC2)C1	ZINC001089930439	1360749659	/nfs/dbraw/zinc/74/96/59/1360749659.db2.gz	GXWRNQXCQHDENN-QGZVFWFLSA-N	0	3	346.471	3.073	20	30		EGEDHN
N#Cc1ccc(CNC2CC(CNC(=O)[C@@H]3CC=CCC3)C2)c(F)c1	ZINC001090922882	1360954772	/nfs/dbraw/zinc/95/47/72/1360954772.db2.gz	VKJBKWJYTNUOIP-UPTPFMHGSA-N	0	3	341.430	3.038	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@H]3CC[C@H](C4CCC4)CC3)C[C@]2(C)C1	ZINC001091754571	1361212524	/nfs/dbraw/zinc/21/25/24/1361212524.db2.gz	UKQAHEWRKVWHLI-VMBXEPDQSA-N	0	3	342.527	3.397	20	30		EGEDHN
CC1(C(=O)N2C[C@H]3CN(Cc4cccc(C#N)c4)C[C@@]3(C)C2)CC=CC1	ZINC001091978642	1361266070	/nfs/dbraw/zinc/26/60/70/1361266070.db2.gz	ZGVHZMMKQCOHEH-KNQAVFIVSA-N	0	3	349.478	3.195	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@H]3[C@@H]4CCCCCC[C@@H]43)C[C@]2(C)C1	ZINC001092045567	1361281159	/nfs/dbraw/zinc/28/11/59/1361281159.db2.gz	OJVASGWLBUHWLZ-AGRFSFNASA-N	0	3	328.500	3.006	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1CNC(=O)C1CCCC1	ZINC001092423869	1361377971	/nfs/dbraw/zinc/37/79/71/1361377971.db2.gz	GDKDKVXQXRGIDY-RDTXWAMCSA-N	0	3	343.446	3.072	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CNC(=O)C1CCCCC1	ZINC001092434244	1361381748	/nfs/dbraw/zinc/38/17/48/1361381748.db2.gz	LASZZJRKFFUZJT-GDBMZVCRSA-N	0	3	345.512	3.384	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@@H]2CN(Cc3ccc(C#N)s3)C[C@H]2C)o1	ZINC001092447744	1361385745	/nfs/dbraw/zinc/38/57/45/1361385745.db2.gz	LARLJAJUZROVEW-TZMCWYRMSA-N	0	3	343.452	3.019	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C2CCC=CCC2)CC1	ZINC001093383105	1361594569	/nfs/dbraw/zinc/59/45/69/1361594569.db2.gz	IAGLCPUXQNPJKD-FQEVSTJZSA-N	0	3	340.511	3.459	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001094084212	1361735363	/nfs/dbraw/zinc/73/53/63/1361735363.db2.gz	PGSQUBFNTMSOEK-GPMSIDNRSA-N	0	3	327.472	3.034	20	30		EGEDHN
O=C(NC[C@]12CCC[C@H]1N(CC#Cc1ccccc1)CC2)c1ccc[nH]1	ZINC001094360436	1361775739	/nfs/dbraw/zinc/77/57/39/1361775739.db2.gz	DBFNFOGUKSNETF-IFMALSPDSA-N	0	3	347.462	3.041	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3ccc(C)c4cccnc34)CCC[C@@H]12	ZINC001094472572	1361818492	/nfs/dbraw/zinc/81/84/92/1361818492.db2.gz	FIWLANBLGZCGOT-DENIHFKCSA-N	0	3	347.462	3.151	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3ccccc3C3(C)CC3)CCC[C@@H]12	ZINC001094510020	1361836388	/nfs/dbraw/zinc/83/63/88/1361836388.db2.gz	TUFNMYSFZVBBMV-DENIHFKCSA-N	0	3	336.479	3.346	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3csc(C(C)(C)C)n3)CCC[C@@H]12	ZINC001094535442	1361848959	/nfs/dbraw/zinc/84/89/59/1361848959.db2.gz	AICXXCPMEIQHNP-DNVCBOLYSA-N	0	3	345.512	3.048	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cc(Cl)ccc3C)CCC[C@@H]12	ZINC001094538267	1361850427	/nfs/dbraw/zinc/85/04/27/1361850427.db2.gz	VGZIDBDLOGYOTN-IEBWSBKVSA-N	0	3	330.859	3.256	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cc4cc(C)ccc4o3)CCC[C@@H]12	ZINC001094582631	1361870678	/nfs/dbraw/zinc/87/06/78/1361870678.db2.gz	SXHIRCYINIMMBN-TZIWHRDSSA-N	0	3	336.435	3.349	20	30		EGEDHN
CCCN(C)CC(=O)NCCCCCCNc1cccc(F)c1C#N	ZINC001094963759	1361964884	/nfs/dbraw/zinc/96/48/84/1361964884.db2.gz	MHMFZKBUBIXFCO-UHFFFAOYSA-N	0	3	348.466	3.128	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](NCc2ccc(OC)c(F)c2)C1	ZINC001184889779	1387555240	/nfs/dbraw/zinc/55/52/40/1387555240.db2.gz	AOHLYGNNTCELPA-QGZVFWFLSA-N	0	3	346.446	3.109	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](NCc2ccccc2N(C)C)C1	ZINC001184890371	1387555408	/nfs/dbraw/zinc/55/54/08/1387555408.db2.gz	MFRZGYQKDFAMKZ-LJQANCHMSA-N	0	3	341.499	3.027	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1coc3cc(C)c(C)cc13)C2	ZINC001095817018	1362243542	/nfs/dbraw/zinc/24/35/42/1362243542.db2.gz	OQOFNPNSOYCVSZ-MNEFBYGVSA-N	0	3	336.435	3.408	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1oc3ccccc3c1OC)C2	ZINC001095864391	1362259130	/nfs/dbraw/zinc/25/91/30/1362259130.db2.gz	KAEGNKWHYSSIFS-KBMXLJTQSA-N	0	3	340.423	3.353	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1scnc1Cl)C2	ZINC001096555747	1362576594	/nfs/dbraw/zinc/57/65/94/1362576594.db2.gz	OYMNFVSYKBNHDC-WOPDTQHZSA-N	0	3	325.865	3.098	20	30		EGEDHN
Cc1cccc([C@@H](C)N2[C@@H]3CC[C@H]2[C@H](NC(=O)c2ccc(C#N)[nH]2)C3)c1	ZINC001096971830	1362799140	/nfs/dbraw/zinc/79/91/40/1362799140.db2.gz	XHMFHCSSKAEIIZ-JRJVTICQSA-N	0	3	348.450	3.291	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1ccc3cccnc3c1)C2	ZINC001097309789	1362923523	/nfs/dbraw/zinc/92/35/23/1362923523.db2.gz	CETXKRGAIKRDOO-RLLQIKCJSA-N	0	3	335.451	3.075	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3CC[C@@H](C)F)cc1	ZINC001097358069	1362950344	/nfs/dbraw/zinc/95/03/44/1362950344.db2.gz	XIYAGSFNDMRSDY-OPNNQBFTSA-N	0	3	346.446	3.335	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(C)c3cccnc13)C2	ZINC001097560480	1363056617	/nfs/dbraw/zinc/05/66/17/1363056617.db2.gz	TXAPSRKJASTNDV-LZQZEXGQSA-N	0	3	335.451	3.454	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc(C)s1)C2	ZINC001098004981	1363195022	/nfs/dbraw/zinc/19/50/22/1363195022.db2.gz	FLBHHSKFQXCMGD-HHARLNAUSA-N	0	3	330.497	3.458	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1ccccc1OC(C)C)C2	ZINC001098034621	1363202749	/nfs/dbraw/zinc/20/27/49/1363202749.db2.gz	VFTGJKIQUURZDU-QRVBRYPASA-N	0	3	342.483	3.314	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@@H]1CCCc3ccccc31)C2	ZINC001098263520	1363278332	/nfs/dbraw/zinc/27/83/32/1363278332.db2.gz	YAMZOHWUDDFGDB-ZSXPUABSSA-N	0	3	336.479	3.241	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H]1C[C@H]1c1cccc(F)c1F)C2	ZINC001098436506	1363325435	/nfs/dbraw/zinc/32/54/35/1363325435.db2.gz	GRJAZVVUTCOMEX-KGKJWKRHSA-N	0	3	346.421	3.366	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C(C)=C1CCCC1)C[C@H](C)O2	ZINC001098583030	1363388283	/nfs/dbraw/zinc/38/82/83/1363388283.db2.gz	IITOWXOVAYAOOQ-INIZCTEOSA-N	0	3	332.488	3.145	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C(C)(C)C1CCC1)C[C@@H](C)O2	ZINC001098616611	1363400565	/nfs/dbraw/zinc/40/05/65/1363400565.db2.gz	OCIUXKUNMVJWIW-MRXNPFEDSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1occc1C(C)C)C[C@@H](C)O2	ZINC001098631385	1363406984	/nfs/dbraw/zinc/40/69/84/1363406984.db2.gz	WLHGKFJDTRLQRK-MRXNPFEDSA-N	0	3	346.471	3.285	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C13CCC(CC1)CC3)C[C@@H](C)O2	ZINC001098659018	1363422997	/nfs/dbraw/zinc/42/29/97/1363422997.db2.gz	IBPMKAXCQYEYAK-PGYGNJIDSA-N	0	3	346.515	3.225	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3CCC[C@]3(NC(=O)C[C@@H]3C=CCC3)C2)cc1	ZINC001098723059	1363449776	/nfs/dbraw/zinc/44/97/76/1363449776.db2.gz	DWSDVWHVUXYKTR-AGHHOFFYSA-N	0	3	349.478	3.385	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(C)c3ccccc3n2)C1	ZINC001098903742	1363513709	/nfs/dbraw/zinc/51/37/09/1363513709.db2.gz	DUYUOGPAYUIHNW-KKSFZXQISA-N	0	3	335.451	3.314	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(Cl)c(Cl)[nH]2)C1	ZINC001098963384	1363544434	/nfs/dbraw/zinc/54/44/34/1363544434.db2.gz	WCXNKRLUJXFUGU-BONVTDFDSA-N	0	3	328.243	3.092	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3CCC[C@]3(NC(=O)[C@H]3C[C@H]4C[C@H]4C3)C2)cc1	ZINC001098986318	1363557136	/nfs/dbraw/zinc/55/71/36/1363557136.db2.gz	MPFPFQSSPAOXOA-MOFJNDHNSA-N	0	3	349.478	3.075	20	30		EGEDHN
C#CCCCC(=O)NC[C@@H]1CCC(C)(C)CN1CCOCC1CCC1	ZINC001099042822	1363589370	/nfs/dbraw/zinc/58/93/70/1363589370.db2.gz	CFAGXMQSFKYVET-IBGZPJMESA-N	0	3	348.531	3.213	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)Cc2cccc(Cl)c2F)C1	ZINC001099048559	1363593770	/nfs/dbraw/zinc/59/37/70/1363593770.db2.gz	YPOVWSQVEJAUEU-KXBFYZLASA-N	0	3	348.849	3.016	20	30		EGEDHN
CC(C)(C)C#CC(=O)NC[C@H]1CCC(C)(C)CN1C[C@H]1CCCCO1	ZINC001099070322	1363606309	/nfs/dbraw/zinc/60/63/09/1363606309.db2.gz	VUUFLCQGTNUVMP-QZTJIDSGSA-N	0	3	348.531	3.212	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)C1(CCOCC)CCC1	ZINC001099074741	1363609822	/nfs/dbraw/zinc/60/98/22/1363609822.db2.gz	QHQRBWJSJHTKNU-QGZVFWFLSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NC[C@@H]1CCC(C)(C)CN1CCOCC	ZINC001099093345	1363618324	/nfs/dbraw/zinc/61/83/24/1363618324.db2.gz	OSLQSZKSHSGIFP-HNNXBMFYSA-N	0	3	344.927	3.408	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2nc(C3CC3)oc2C)C1	ZINC001099103800	1363623973	/nfs/dbraw/zinc/62/39/73/1363623973.db2.gz	YWVDDYZSXKCZQX-KXBFYZLASA-N	0	3	329.444	3.021	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H]2CCCc3sc(C)nc32)C1	ZINC001099118388	1363633883	/nfs/dbraw/zinc/63/38/83/1363633883.db2.gz	ZNXPHZWNQYXXDA-DOXZYTNZSA-N	0	3	345.512	3.028	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)Cc2c[nH]c3cccc(C)c23)C1	ZINC001099122622	1363636578	/nfs/dbraw/zinc/63/65/78/1363636578.db2.gz	CPERZLHMFWGFNT-AVRDEDQJSA-N	0	3	349.478	3.013	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)Cc1ccc(C)c(OC)c1	ZINC001099134850	1363646139	/nfs/dbraw/zinc/64/61/39/1363646139.db2.gz	DOFQZRYENYRJBP-SFHVURJKSA-N	0	3	344.499	3.339	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)Cc1sc(C)nc1C	ZINC001099145525	1363653937	/nfs/dbraw/zinc/65/39/37/1363653937.db2.gz	YFSSOQXUHZCAFZ-INIZCTEOSA-N	0	3	349.544	3.485	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)C/C=C(/C)C=C	ZINC001099182546	1363678550	/nfs/dbraw/zinc/67/85/50/1363678550.db2.gz	MDRSFGJLYARXPT-QGEBHBTGSA-N	0	3	334.504	3.318	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2cc(C)sc2C)C[C@H]1C(F)(F)F	ZINC001099274157	1363727173	/nfs/dbraw/zinc/72/71/73/1363727173.db2.gz	ACRGJIMJWVLHQX-CHWSQXEVSA-N	0	3	332.391	3.143	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2c(F)cc(C)cc2F)C[C@H]1C(F)(F)F	ZINC001099279044	1363729403	/nfs/dbraw/zinc/72/94/03/1363729403.db2.gz	SWKHFFJMISRLSR-ZWNOBZJWSA-N	0	3	348.315	3.052	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H]1CC12CCCC2	ZINC001099299721	1363738020	/nfs/dbraw/zinc/73/80/20/1363738020.db2.gz	VGNWIEQEXYEIJG-MSOLQXFVSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H](C)c1cccnc1	ZINC001099310511	1363743758	/nfs/dbraw/zinc/74/37/58/1363743758.db2.gz	OICGDSZGPPOZED-WMZOPIPTSA-N	0	3	329.488	3.368	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)[C@H](OC)C1CCCC1	ZINC001099323865	1363749992	/nfs/dbraw/zinc/74/99/92/1363749992.db2.gz	CAQMKSHRBQTEIS-ZWKOTPCHSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2ccc3cccnc3c2)C[C@H]1C(F)(F)F	ZINC001099323289	1363750278	/nfs/dbraw/zinc/75/02/78/1363750278.db2.gz	FINBUPZHQWLCPV-GDBMZVCRSA-N	0	3	349.356	3.013	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)COc1ccc(CC)cc1	ZINC001099328354	1363753223	/nfs/dbraw/zinc/75/32/23/1363753223.db2.gz	BQVWICKLJQVUQJ-SFHVURJKSA-N	0	3	344.499	3.421	20	30		EGEDHN
N#Cc1ccccc1CNC[C@]12CCC[C@H]1CN(C(=O)C1CCC1)C2	ZINC001099359206	1363771393	/nfs/dbraw/zinc/77/13/93/1363771393.db2.gz	JXYXZJFSERAMIX-FPOVZHCZSA-N	0	3	337.467	3.077	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NC[C@H]1CCC(C)(C)CN1Cc1ccccc1	ZINC001099365190	1363775359	/nfs/dbraw/zinc/77/53/59/1363775359.db2.gz	WYQYZXGTFRWXJJ-PKOBYXMFSA-N	0	3	344.499	3.385	20	30		EGEDHN
CCCCCCCCCC(=O)N[C@H]1CCN(CCCF)C[C@@H]1O	ZINC001100087224	1364013543	/nfs/dbraw/zinc/01/35/43/1364013543.db2.gz	IATSSOBAFQISOC-IRXDYDNUSA-N	0	3	330.488	3.038	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NCC1CC(NCc2cc(C)ccc2F)C1	ZINC001100166517	1364033110	/nfs/dbraw/zinc/03/31/10/1364033110.db2.gz	JCIRWYZQIBQRSB-HJOIGYKYSA-N	0	3	348.462	3.100	20	30		EGEDHN
C=CCCC(=O)NCC1CC(NCC#Cc2cccc(Cl)c2)C1	ZINC001100176730	1364036459	/nfs/dbraw/zinc/03/64/59/1364036459.db2.gz	BRUDLSHATNWWBG-UHFFFAOYSA-N	0	3	330.859	3.142	20	30		EGEDHN
O=C(NCC1CC(NCC#Cc2ccc(Cl)cc2)C1)C1CC=CC1	ZINC001100212961	1364045432	/nfs/dbraw/zinc/04/54/32/1364045432.db2.gz	FVFMPNJGZNJCSW-UHFFFAOYSA-N	0	3	342.870	3.142	20	30		EGEDHN
C=CCOCCCC(=O)NCC1CC(N[C@H](C)c2ccccc2F)C1	ZINC001100217677	1364046473	/nfs/dbraw/zinc/04/64/73/1364046473.db2.gz	YKDUMZQONCRFMM-KLAILNCOSA-N	0	3	348.462	3.354	20	30		EGEDHN
C/C=C(\C)C(=O)NCC1CC(NCC#Cc2ccccc2Cl)C1	ZINC001100231103	1364051929	/nfs/dbraw/zinc/05/19/29/1364051929.db2.gz	MTDWJVZAYSKCNG-LZWSPWQCSA-N	0	3	330.859	3.142	20	30		EGEDHN
C#CCCCC(=O)NCC1CC(N[C@H]2CCc3c2c(F)ccc3F)C1	ZINC001100283142	1364067285	/nfs/dbraw/zinc/06/72/85/1364067285.db2.gz	CGKXCBRPALIBSX-JRSKDTKFSA-N	0	3	346.421	3.240	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCC1CC(NCc2c(C)noc2C)C1	ZINC001100358602	1364090095	/nfs/dbraw/zinc/09/00/95/1364090095.db2.gz	XCQBEBCJAAKXFI-UHFFFAOYSA-N	0	3	331.460	3.044	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCC1CC(NCc2cnc(Cl)s2)C1	ZINC001100364863	1364093129	/nfs/dbraw/zinc/09/31/29/1364093129.db2.gz	XRNXUGOZHPFANR-UHFFFAOYSA-N	0	3	341.908	3.383	20	30		EGEDHN
CC(C)(CC(F)F)C(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100399353	1364102363	/nfs/dbraw/zinc/10/23/63/1364102363.db2.gz	YMZCMGNPKQCJPL-UHFFFAOYSA-N	0	3	348.437	3.204	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C2(C)CCC(F)(F)CC2)C1	ZINC001100458344	1364121245	/nfs/dbraw/zinc/12/12/45/1364121245.db2.gz	YJMLKDQNGIBSTI-UHFFFAOYSA-N	0	3	334.838	3.439	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NCC1CC(NCC=C(Cl)Cl)C1	ZINC001100540353	1364152611	/nfs/dbraw/zinc/15/26/11/1364152611.db2.gz	LAJUVGVYPYUDFP-ZUEPYMLJSA-N	0	3	349.302	3.019	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC1CC(NCc2oc(CC)nc2C)C1	ZINC001100567815	1364165798	/nfs/dbraw/zinc/16/57/98/1364165798.db2.gz	CRBBUHCONDMNRS-UHFFFAOYSA-N	0	3	333.476	3.132	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)CC(C)=C(C)C)C1	ZINC001100574743	1364169748	/nfs/dbraw/zinc/16/97/48/1364169748.db2.gz	CSVJPCWCQKJQJY-UHFFFAOYSA-N	0	3	329.282	3.126	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1	ZINC001100596156	1364180803	/nfs/dbraw/zinc/18/08/03/1364180803.db2.gz	MNERUPUOVIFMDO-NXVRBGIVSA-N	0	3	343.446	3.284	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100595795	1364181270	/nfs/dbraw/zinc/18/12/70/1364181270.db2.gz	GSKRLRWWQIMVGC-PPDQVPDSSA-N	0	3	342.458	3.264	20	30		EGEDHN
CC(C)CCCC(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100699460	1364224002	/nfs/dbraw/zinc/22/40/02/1364224002.db2.gz	QFSGILBXOQDBHL-UHFFFAOYSA-N	0	3	326.484	3.349	20	30		EGEDHN
CC(C)n1cccc1C(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100983533	1364356765	/nfs/dbraw/zinc/35/67/65/1364356765.db2.gz	JZLFFOVQXPMXMX-UHFFFAOYSA-N	0	3	349.478	3.219	20	30		EGEDHN
C=CCN1CC[C@H](Oc2ccnc(CNC(=O)CC[C@H](C)CC)c2)C1	ZINC001101097677	1364413571	/nfs/dbraw/zinc/41/35/71/1364413571.db2.gz	XXEHWEYOSHNOAL-APWZRJJASA-N	0	3	345.487	3.163	20	30		EGEDHN
CC(C)CCC(=O)N1C[C@H]2CN(Cc3ccc(C#N)cc3)C[C@@]2(C)C1	ZINC001101121347	1364419855	/nfs/dbraw/zinc/41/98/55/1364419855.db2.gz	CQBLFFYCNJYFSP-CTNGQTDRSA-N	0	3	339.483	3.275	20	30		EGEDHN
C#CCCCC(=O)N1C[C@H]2CN(Cc3ccccc3Cl)C[C@@]2(C)C1	ZINC001101216910	1364468297	/nfs/dbraw/zinc/46/82/97/1364468297.db2.gz	OFXJRSPUUGWXIO-XLIONFOSSA-N	0	3	344.886	3.424	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@H]2CN(Cc3cnccc3C)C[C@@]2(C)C1	ZINC001101333549	1364513116	/nfs/dbraw/zinc/51/31/16/1364513116.db2.gz	ZWQRQFQIWFTVCZ-DSKINZAPSA-N	0	3	341.499	3.273	20	30		EGEDHN
CCCCCC[C@@H](C)C(=O)N1C[C@H]2CN(CC#CCOC)C[C@@]2(C)C1	ZINC001101399973	1364545013	/nfs/dbraw/zinc/54/50/13/1364545013.db2.gz	AODJRNCHUXMJHN-SBHAEUEKSA-N	0	3	348.531	3.023	20	30		EGEDHN
C=CCC[C@H](C)N1CC2(C1)C[C@H](NC(=O)CCC(=C)C)c1nccn12	ZINC001101630328	1364662470	/nfs/dbraw/zinc/66/24/70/1364662470.db2.gz	DUENHBQPFRIZCI-IRXDYDNUSA-N	0	3	342.487	3.166	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1CC2(CN([C@@H](C)CCC=C)C2)n2ccnc21	ZINC001101641055	1364666374	/nfs/dbraw/zinc/66/63/74/1364666374.db2.gz	IINUMTNAGZRRAB-IRXDYDNUSA-N	0	3	342.487	3.166	20	30		EGEDHN
C=CCC[C@@H](C)N1CC2(C1)C[C@@H](NC(=O)C(C)(C)CC)c1nccn12	ZINC001101642940	1364667428	/nfs/dbraw/zinc/66/74/28/1364667428.db2.gz	QFMNPJBCQKEQIZ-HZPDHXFCSA-N	0	3	344.503	3.246	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1CNC(=O)C[C@@H]1C=CCC1	ZINC001101713875	1364700730	/nfs/dbraw/zinc/70/07/30/1364700730.db2.gz	ZRWKGDVJYJWTEL-HMXCVIKNSA-N	0	3	336.479	3.079	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1CNC(=O)C1(C)CCC1	ZINC001102233462	1364950979	/nfs/dbraw/zinc/95/09/79/1364950979.db2.gz	XOUGPHKBWCONAV-SJLPKXTDSA-N	0	3	342.458	3.052	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@H]1CN(Cc2ccccc2F)C[C@H]1C	ZINC001102252572	1364966789	/nfs/dbraw/zinc/96/67/89/1364966789.db2.gz	HJDPSXRGNAFTNA-SJLPKXTDSA-N	0	3	330.447	3.203	20	30		EGEDHN
COCC#CCN1C[C@@H](CNC(=O)C[C@H](C)CCC=C(C)C)[C@H](C)C1	ZINC001102392809	1365037734	/nfs/dbraw/zinc/03/77/34/1365037734.db2.gz	NLIPIVXWZLDQRE-VAMGGRTRSA-N	0	3	348.531	3.093	20	30		EGEDHN
C[C@H](C#N)C(=O)NCC[C@@H]1CN(Cc2ccc(Cl)s2)C[C@H]1C	ZINC001102784180	1365216816	/nfs/dbraw/zinc/21/68/16/1365216816.db2.gz	NYMITHHSYUHXFW-JHJVBQTASA-N	0	3	339.892	3.135	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CCNC(=O)C=C1CCC1	ZINC001102850235	1365251247	/nfs/dbraw/zinc/25/12/47/1365251247.db2.gz	JCGXVZRTUWAGLV-GDBMZVCRSA-N	0	3	343.496	3.304	20	30		EGEDHN
C=CCC[C@H](C)[NH2+]CC[C@@H]1CN(C(=O)c2ccccc2[O-])C[C@H]1C	ZINC001103900970	1365827895	/nfs/dbraw/zinc/82/78/95/1365827895.db2.gz	GFPDFEPDAMUMDW-IXDOHACOSA-N	0	3	330.472	3.435	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)[C@H](CCNCc2cc(OC)ccn2)C1	ZINC001104245445	1365967019	/nfs/dbraw/zinc/96/70/19/1365967019.db2.gz	INKPEANIXZGLOP-IAGOWNOFSA-N	0	3	345.487	3.021	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)COCC2CCCC2)C[C@H]1C	ZINC001104301110	1365978981	/nfs/dbraw/zinc/97/89/81/1365978981.db2.gz	WNVQMRQNLLTOEP-RHSMWYFYSA-N	0	3	342.911	3.020	20	30		EGEDHN
C=CCCC1(C(=O)N2C[C@@H](C)[C@H](CCNCc3cnoc3C)C2)CC1	ZINC001104631656	1366110563	/nfs/dbraw/zinc/11/05/63/1366110563.db2.gz	WCIQFZPETPBJLV-NVXWUHKLSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](C)[C@H](CCNCc3conc3CC)C2)C1	ZINC001104651626	1366118933	/nfs/dbraw/zinc/11/89/33/1366118933.db2.gz	BLWQDGDCRFPBQN-HZPDHXFCSA-N	0	3	345.487	3.168	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)C2Cc3ccccc3C2)C[C@H]1C	ZINC001104717548	1366142303	/nfs/dbraw/zinc/14/23/03/1366142303.db2.gz	GNRLPGSEKNKSEO-RDTXWAMCSA-N	0	3	346.902	3.228	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H](C)[C@H](CCNCc2cnc(C)o2)C1	ZINC001104731760	1366148980	/nfs/dbraw/zinc/14/89/80/1366148980.db2.gz	WCJKTUWVKHNDIY-GDBMZVCRSA-N	0	3	333.476	3.160	20	30		EGEDHN
C[C@@H]1CN(C(=O)C(C)(C)C)C[C@H]1CCNCc1ccc(C#N)cc1F	ZINC001104939826	1366232165	/nfs/dbraw/zinc/23/21/65/1366232165.db2.gz	IRURPHMGGRKZPG-RHSMWYFYSA-N	0	3	345.462	3.318	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cccc(OC)c2)C[C@H]1C	ZINC001104946930	1366236472	/nfs/dbraw/zinc/23/64/72/1366236472.db2.gz	GOUVZLKBJNEBDY-CZUORRHYSA-N	0	3	336.863	3.136	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](CNCc2csc(C)n2)[C@H](C)C1	ZINC001106180917	1366617687	/nfs/dbraw/zinc/61/76/87/1366617687.db2.gz	CXBNPSFRJKZITD-UKRRQHHQSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H](n2cc(CNCCCCCC)nn2)C1	ZINC001185908523	1387826081	/nfs/dbraw/zinc/82/60/81/1387826081.db2.gz	YGULCXWOZYMSNE-GOSISDBHSA-N	0	3	347.507	3.078	20	30		EGEDHN
CC(C)CC(=O)NC[C@]12CCC[C@H]1N(CC#Cc1ccccc1)CC2	ZINC001107263849	1366909534	/nfs/dbraw/zinc/90/95/34/1366909534.db2.gz	MDTNGNHHVWLEFB-IFMALSPDSA-N	0	3	338.495	3.445	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](N(C)Cc2ccc(OC)c(Cl)c2)C1	ZINC001189279612	1366976056	/nfs/dbraw/zinc/97/60/56/1366976056.db2.gz	LGPBKWXOZMFEEK-HNNXBMFYSA-N	0	3	336.863	3.348	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CC[C@H]1CCCC1(F)F	ZINC001109249663	1367025664	/nfs/dbraw/zinc/02/56/64/1367025664.db2.gz	INPDUZFSKTVCEO-NCOADZHNSA-N	0	3	338.442	3.193	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](N(C)Cc2cc(F)ccc2C)C1	ZINC001189744662	1367100365	/nfs/dbraw/zinc/10/03/65/1367100365.db2.gz	WWAMXGOBHQESRU-IBGZPJMESA-N	0	3	330.447	3.360	20	30		EGEDHN
CCCC[C@H](C)C(=O)N1CC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001189974263	1367143579	/nfs/dbraw/zinc/14/35/79/1367143579.db2.gz	VGRIJHNIEKVQFC-LPHOPBHVSA-N	0	3	327.472	3.417	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@@H](N(C)[C@@H](C)c2ccc(F)c(F)c2)C1	ZINC001190004162	1367149820	/nfs/dbraw/zinc/14/98/20/1367149820.db2.gz	NLUJMTJFWWJEOZ-GOEBONIOSA-N	0	3	334.410	3.218	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)c3ccc(OCCCC)cc3)[C@@H]2C1	ZINC001190133592	1367181001	/nfs/dbraw/zinc/18/10/01/1367181001.db2.gz	SLLIWYRWPYEDDG-PKOBYXMFSA-N	0	3	328.456	3.198	20	30		EGEDHN
CCC(C)(C)CC(=O)N1CC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001190361060	1367238866	/nfs/dbraw/zinc/23/88/66/1367238866.db2.gz	BFHASSLQTSZPDV-SFHVURJKSA-N	0	3	327.472	3.417	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CC[C@H](N(C)Cc2cccc(F)c2)C1)OCC	ZINC001190443143	1367267815	/nfs/dbraw/zinc/26/78/15/1367267815.db2.gz	FGYPMIKVQUEXFG-OALUTQOASA-N	0	3	348.462	3.230	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCc1scnc1C	ZINC001109683259	1367280546	/nfs/dbraw/zinc/28/05/46/1367280546.db2.gz	DQZWVOAFBSSLFW-PASDCYSWSA-N	0	3	347.528	3.318	20	30		EGEDHN
CC[C@H](CC(F)F)C(=O)N1CC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001190614191	1367308831	/nfs/dbraw/zinc/30/88/31/1367308831.db2.gz	WNQHHWQDRUNVQF-IAGOWNOFSA-N	0	3	349.425	3.272	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2ccccc2CC)C1	ZINC001108166308	1367320494	/nfs/dbraw/zinc/32/04/94/1367320494.db2.gz	ZDDZNUOYARXQEO-LAUBAEHRSA-N	0	3	344.499	3.424	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2ccc(C)cc2F)C1	ZINC001108241028	1367356066	/nfs/dbraw/zinc/35/60/66/1367356066.db2.gz	UHOXKUFAINGZOQ-OXQOHEQNSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](c1cccnc1)C(C)C)C2	ZINC001109885540	1367383015	/nfs/dbraw/zinc/38/30/15/1367383015.db2.gz	NGKLHRNLAWZYNL-XWSJACJDSA-N	0	3	327.472	3.119	20	30		EGEDHN
CCCCCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1conc1COC)C2	ZINC001109967908	1367433832	/nfs/dbraw/zinc/43/38/32/1367433832.db2.gz	RBTWCHFETNMLGO-HFTRVMKXSA-N	0	3	349.475	3.127	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2ccc(F)s2)C1	ZINC001108437984	1367457609	/nfs/dbraw/zinc/45/76/09/1367457609.db2.gz	RUKHQMNOXPULBP-GUYCJALGSA-N	0	3	340.464	3.063	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)COc1c(C)cc(C)cc1C)C2	ZINC001110067747	1367490402	/nfs/dbraw/zinc/49/04/02/1367490402.db2.gz	LDLGEHIWVXNJMF-QYZOEREBSA-N	0	3	342.483	3.288	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](CC=C)Cc1ccccc1)C2	ZINC001110132064	1367516603	/nfs/dbraw/zinc/51/66/03/1367516603.db2.gz	UAJJACMIBYKOIP-CGXNFDGLSA-N	0	3	336.479	3.166	20	30		EGEDHN
C#CCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3CC[C@@H](C)F)CCCCC1	ZINC001110178068	1367548335	/nfs/dbraw/zinc/54/83/35/1367548335.db2.gz	RBSJZUXKZCVCBF-BDXSIMOUSA-N	0	3	334.479	3.430	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccc(C)c(C)c1	ZINC001110181179	1367549706	/nfs/dbraw/zinc/54/97/06/1367549706.db2.gz	VOUDWZMJNQLTJG-AABGKKOBSA-N	0	3	342.483	3.118	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](N(C)C[C@H](OC)c2ccccc2)C1	ZINC001191859914	1367617023	/nfs/dbraw/zinc/61/70/23/1367617023.db2.gz	SVJUNGXXMLDFGR-UXHICEINSA-N	0	3	342.483	3.100	20	30		EGEDHN
Cc1ccccc1[C@@H](C)N1[C@@H]2CC[C@H]1[C@H](NC(=O)CSCC#N)C2	ZINC001110305040	1367626741	/nfs/dbraw/zinc/62/67/41/1367626741.db2.gz	AZAPPSMVCDFOEA-AHCXZYCDSA-N	0	3	343.496	3.034	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H](N(C)CCOc2cccc(F)c2)C1	ZINC001191911541	1367635695	/nfs/dbraw/zinc/63/56/95/1367635695.db2.gz	HFTWJFSAWLKPFD-FUHWJXTLSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001191913618	1367638829	/nfs/dbraw/zinc/63/88/29/1367638829.db2.gz	ZQXYBDARJYBSRD-QFBILLFUSA-N	0	3	325.456	3.193	20	30		EGEDHN
O=C(Nc1ccc(OC(F)F)cc1)N1CCC2SC(=O)C=C2C1	ZINC001192157268	1367703210	/nfs/dbraw/zinc/70/32/10/1367703210.db2.gz	RSJLOUGTUICSSV-GFCCVEGCSA-N	0	3	340.351	3.094	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@H](N(C)CCc3csc(C)n3)C2)CC1	ZINC001192207800	1367718110	/nfs/dbraw/zinc/71/81/10/1367718110.db2.gz	ZMSHRXNKYDHFMK-KRWDZBQOSA-N	0	3	347.528	3.273	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](N(C)CCOc3ccccc3F)C2)C1	ZINC001192255772	1367731136	/nfs/dbraw/zinc/73/11/36/1367731136.db2.gz	AQNJYUWPVXMWCO-MRXNPFEDSA-N	0	3	346.446	3.094	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](N(C)CCOc3ccc(F)cc3)C2)C1	ZINC001192257392	1367732880	/nfs/dbraw/zinc/73/28/80/1367732880.db2.gz	NSQOHZKBXKJENS-QGZVFWFLSA-N	0	3	346.446	3.094	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001192585964	1367824864	/nfs/dbraw/zinc/82/48/64/1367824864.db2.gz	GBLOWWSIGYSELY-SFHVURJKSA-N	0	3	325.456	3.193	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)C[C@H](C)C2CCCCC2)C1	ZINC001192800829	1367877252	/nfs/dbraw/zinc/87/72/52/1367877252.db2.gz	IYDXFDUTMYANLV-PKOBYXMFSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1nc(Cl)cs1)C2	ZINC001110942365	1368110402	/nfs/dbraw/zinc/11/04/02/1368110402.db2.gz	IYUXZYPLLHDZEZ-UTUOFQBUSA-N	0	3	325.865	3.098	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2cccc3ccccc32)C1	ZINC001193816594	1368121461	/nfs/dbraw/zinc/12/14/61/1368121461.db2.gz	SSUNZDSXEZOYGG-GOSISDBHSA-N	0	3	338.451	3.189	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)[C@@H](CC=C)c2ccccc2)C1	ZINC001194174363	1368199171	/nfs/dbraw/zinc/19/91/71/1368199171.db2.gz	RWPHVIFXGLEZSN-UXHICEINSA-N	0	3	342.483	3.082	20	30		EGEDHN
C=C[C@H](CC(=O)N1CC[C@H](N(C)CCOC(C)C)C1)c1ccccc1	ZINC001194199375	1368206766	/nfs/dbraw/zinc/20/67/66/1368206766.db2.gz	BTZHEOKAVBEWBP-QUCCMNQESA-N	0	3	344.499	3.304	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@@H](N(C)C[C@@H]3CCCCO3)C2)CCCCC1	ZINC001194367320	1368245501	/nfs/dbraw/zinc/24/55/01/1368245501.db2.gz	FAWUEXPWZSBRLK-MOPGFXCFSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)C2CCCCCCC2)C1	ZINC001194575904	1368290126	/nfs/dbraw/zinc/29/01/26/1368290126.db2.gz	DLNMTSALTDSMGR-RTBURBONSA-N	0	3	336.520	3.255	20	30		EGEDHN
C=CCC[C@@H](C)N1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cnc(CC)s1)C2	ZINC001111488543	1368320448	/nfs/dbraw/zinc/32/04/48/1368320448.db2.gz	MXHLZDDEFUGMQA-TUVASFSCSA-N	0	3	333.501	3.395	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C1(C(F)(F)F)CCCC1)C2	ZINC001111509977	1368323010	/nfs/dbraw/zinc/32/30/10/1368323010.db2.gz	BYRACLIFCRBMJF-MCIONIFRSA-N	0	3	330.394	3.407	20	30		EGEDHN
C#CCCN1CC[C@]2(C1)C[C@@H](NC(=O)CCCC)c1ccccc1O2	ZINC001111529093	1368326728	/nfs/dbraw/zinc/32/67/28/1368326728.db2.gz	DMPQMCHHDNTMAD-WIYYLYMNSA-N	0	3	340.467	3.284	20	30		EGEDHN
CC(C)CC(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(C#N)cc1)C2	ZINC001111571466	1368348123	/nfs/dbraw/zinc/34/81/23/1368348123.db2.gz	PLVMBOKXISAIQS-ICSRJNTNSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=CCCC(=O)N[C@]12CCC[C@H]1CN(Cc1sc(C)nc1C)C2	ZINC001111648885	1368411585	/nfs/dbraw/zinc/41/15/85/1368411585.db2.gz	SXPZKFKNUKNSHW-YJBOKZPZSA-N	0	3	333.501	3.197	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)C/C=C\Cc2ccccc2)C1	ZINC001111782330	1368459855	/nfs/dbraw/zinc/45/98/55/1368459855.db2.gz	DQMZIOSWCMSZOB-NKSQQLLXSA-N	0	3	336.479	3.169	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)C/C=C\c2ccccc2F)C1	ZINC001111788919	1368462831	/nfs/dbraw/zinc/46/28/31/1368462831.db2.gz	OXDQPWFTTNSSGE-WWPJIJLSSA-N	0	3	340.442	3.223	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cn(C3CCC3)nn2)CC1	ZINC001195873415	1368508004	/nfs/dbraw/zinc/50/80/04/1368508004.db2.gz	GBKXPPLAXAIJJL-UHFFFAOYSA-N	0	3	347.507	3.121	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)CC/C=C/c2ccccc2)C1	ZINC001111871029	1368517949	/nfs/dbraw/zinc/51/79/49/1368517949.db2.gz	XDJOLIOHRGEMPO-WLDAEOKKSA-N	0	3	336.479	3.474	20	30		EGEDHN
C=C(C)CCC(=O)N1CCCN(C[C@@H](O)[C@H](C)c2ccccc2)CC1	ZINC001196018484	1368537432	/nfs/dbraw/zinc/53/74/32/1368537432.db2.gz	WEESOXPURNUDQN-UYAOXDASSA-N	0	3	344.499	3.042	20	30		EGEDHN
C#CCC1(C(=O)N2CCCN(CC/C=C/CCC)CC2)CCOCC1	ZINC001196107213	1368549738	/nfs/dbraw/zinc/54/97/38/1368549738.db2.gz	KBTSMQKPAFOGQH-VOTSOKGWSA-N	0	3	346.515	3.087	20	30		EGEDHN
C#CCN1C[C@@H]2CCC[C@]2(NC(=O)C[C@@H](c2ccccc2)C(C)C)C1	ZINC001111935813	1368566923	/nfs/dbraw/zinc/56/69/23/1368566923.db2.gz	VHMGLQNIOLFPBY-VWPQPMDRSA-N	0	3	338.495	3.420	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cc3n(n2)CCCC3)CC1	ZINC001196242104	1368574453	/nfs/dbraw/zinc/57/44/53/1368574453.db2.gz	AXFQZTFWPDJCJN-UHFFFAOYSA-N	0	3	346.519	3.338	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)COc2c(C)cc(C)cc2C)C1	ZINC001111968567	1368578920	/nfs/dbraw/zinc/57/89/20/1368578920.db2.gz	QCQLUWNZZWNTKN-RXVVDRJESA-N	0	3	342.483	3.147	20	30		EGEDHN
C=C[C@@H](CC(=O)N[C@]12CCC[C@H]1CN(CC#CC)C2)c1ccccc1	ZINC001111999713	1368603506	/nfs/dbraw/zinc/60/35/06/1368603506.db2.gz	XNLBRDRBORINGW-VCOUNFBDSA-N	0	3	336.479	3.340	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2ccc3[nH]ccc3n2)CC1	ZINC001196492479	1368626861	/nfs/dbraw/zinc/62/68/61/1368626861.db2.gz	DSYTUAJUWNBGPW-UHFFFAOYSA-N	0	3	340.471	3.457	20	30		EGEDHN
C=CCC[C@@H](C)N1CCCN(C(=O)c2conc2C(F)(F)F)CC1	ZINC001196514991	1368630163	/nfs/dbraw/zinc/63/01/63/1368630163.db2.gz	CGFCPFXVURAXMG-GFCCVEGCSA-N	0	3	345.365	3.196	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@@H](C)CC2CCCC2)C1	ZINC001196590813	1368644950	/nfs/dbraw/zinc/64/49/50/1368644950.db2.gz	RHHXASZGLFWDSO-QXAKKESOSA-N	0	3	336.520	3.111	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cn(C(C)C)cn2)CC1	ZINC001196641957	1368654624	/nfs/dbraw/zinc/65/46/24/1368654624.db2.gz	VPGKNSIRGHREND-UHFFFAOYSA-N	0	3	332.492	3.358	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N1CCCN(CC/C=C\CCC)CC1	ZINC001196665649	1368658271	/nfs/dbraw/zinc/65/82/71/1368658271.db2.gz	GSPYHAJSULIYHX-GWQNQTGSSA-N	0	3	336.520	3.496	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)[C@@H]2C[C@H]2CC(C)(C)C)C[C@H]1C(F)(F)F	ZINC001112104677	1368660720	/nfs/dbraw/zinc/66/07/20/1368660720.db2.gz	YINKEYMZBCMCFH-GBJTYRQASA-N	0	3	344.421	3.061	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)C2(CC(C)C)CC2)C[C@H]1C(F)(F)F	ZINC001112112629	1368663080	/nfs/dbraw/zinc/66/30/80/1368663080.db2.gz	OWZUMGQUGIKGCW-ZIAGYGMSSA-N	0	3	332.410	3.368	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2occc2NC(=O)OC(C)(C)C)CC1	ZINC001325371836	1387953396	/nfs/dbraw/zinc/95/33/96/1387953396.db2.gz	BHPMDYXVWJTCFL-UHFFFAOYSA-N	0	3	349.431	3.007	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)C[C@@H](CC)C(C)C)C[C@H]1C(F)(F)F	ZINC001112196599	1368709386	/nfs/dbraw/zinc/70/93/86/1368709386.db2.gz	TVZJGSNQAJTJCY-RBSFLKMASA-N	0	3	332.410	3.061	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)C[C@H](C)C(C)(C)C)C[C@H]1C(F)(F)F	ZINC001112199558	1368710746	/nfs/dbraw/zinc/71/07/46/1368710746.db2.gz	YQHIMGDYACVTIX-BFHYXJOUSA-N	0	3	332.410	3.061	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H]2CCC[C@]2(CNCc2ccccc2C#N)C1	ZINC001112282333	1368747612	/nfs/dbraw/zinc/74/76/12/1368747612.db2.gz	VBEKDMJPINNBCN-FPOVZHCZSA-N	0	3	337.467	3.243	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cnn(CCC)c2C)CC1	ZINC001197559463	1368839323	/nfs/dbraw/zinc/83/93/23/1368839323.db2.gz	ACSVJSSOSDHTEG-UHFFFAOYSA-N	0	3	346.519	3.496	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cnn(CC3CC3)c2)CC1	ZINC001197698075	1368875813	/nfs/dbraw/zinc/87/58/13/1368875813.db2.gz	FEOCWSIMKMOBQH-UHFFFAOYSA-N	0	3	344.503	3.187	20	30		EGEDHN
C=CCC1(C(=O)N2CCCN(CC/C=C\CC)CC2)CCOCC1	ZINC001197995986	1368938331	/nfs/dbraw/zinc/93/83/31/1368938331.db2.gz	XFFLLXGBRZAPQA-WAYWQWQTSA-N	0	3	334.504	3.250	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N1CCCN(CCCc2ccccc2C)CC1	ZINC001198345007	1369013143	/nfs/dbraw/zinc/01/31/43/1369013143.db2.gz	YWISKVKCUCWGPV-IBGZPJMESA-N	0	3	344.499	3.053	20	30		EGEDHN
C=CCC1(C(=O)N2CCCN(C[C@@H](OC)C3CCC3)CC2)CCCC1	ZINC001198422616	1369028928	/nfs/dbraw/zinc/02/89/28/1369028928.db2.gz	DWUFZZRSBROCSB-LJQANCHMSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)c1ccncc1)c1ccccc1OC	ZINC001198493212	1369045492	/nfs/dbraw/zinc/04/54/92/1369045492.db2.gz	YRDBTMWLVCQZRM-GOSISDBHSA-N	0	3	339.439	3.117	20	30		EGEDHN
C=CCCCCCN[C@@H](CNC(=O)COCC)c1ccccc1OC	ZINC001198507022	1369047888	/nfs/dbraw/zinc/04/78/88/1369047888.db2.gz	ICBYSBUQUSECKQ-SFHVURJKSA-N	0	3	348.487	3.225	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)C[C@@H](OCC)C2=CCCC2)CC1	ZINC001112856467	1369049665	/nfs/dbraw/zinc/04/96/65/1369049665.db2.gz	MBLIKCGLJJKRKX-IEBWSBKVSA-N	0	3	334.504	3.391	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)c1ccsc1)c1ccccc1OC	ZINC001198522495	1369052170	/nfs/dbraw/zinc/05/21/70/1369052170.db2.gz	MEYAVZFSNAGHLY-MRXNPFEDSA-N	0	3	330.453	3.394	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)c1cccn1C)c1ccccc1OC	ZINC001198529471	1369053854	/nfs/dbraw/zinc/05/38/54/1369053854.db2.gz	FGJWOHUOMLMUAZ-QGZVFWFLSA-N	0	3	341.455	3.061	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)[C@@H](CC)OCC)c1ccccc1OC	ZINC001198584135	1369065836	/nfs/dbraw/zinc/06/58/36/1369065836.db2.gz	BGZQNAHDDVBYPO-ZWKOTPCHSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCC[C@@H](C)N[C@@H](CNC(=O)COCCC)c1ccccc1OC	ZINC001198584652	1369066735	/nfs/dbraw/zinc/06/67/35/1369066735.db2.gz	LRUHKGBVYFJKSU-AEFFLSMTSA-N	0	3	348.487	3.223	20	30		EGEDHN
COc1ccccc1[C@@H](CNC(=O)[C@@H](C)C#N)NCCCC(C)C	ZINC001198617322	1369074523	/nfs/dbraw/zinc/07/45/23/1369074523.db2.gz	NFYXWTRDCPCEOQ-DOTOQJQBSA-N	0	3	331.460	3.038	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)COCCCC)c1ccccc1OC	ZINC001198628610	1369076874	/nfs/dbraw/zinc/07/68/74/1369076874.db2.gz	UPIBUHHVTQKTER-SFHVURJKSA-N	0	3	348.487	3.225	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H](NCC[C@H](C)F)c1ccccc1OC	ZINC001198677915	1369088742	/nfs/dbraw/zinc/08/87/42/1369088742.db2.gz	VERHSZVPKMFHBA-FUHWJXTLSA-N	0	3	348.462	3.384	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)c1coc(C)n1)c1ccccc1OC	ZINC001198685657	1369090682	/nfs/dbraw/zinc/09/06/82/1369090682.db2.gz	CMQQHPBDBYDGGT-INIZCTEOSA-N	0	3	343.427	3.019	20	30		EGEDHN
C#CCCCC(=O)NC[C@@H](NCCCC=C)c1ccccc1OC	ZINC001198696325	1369093487	/nfs/dbraw/zinc/09/34/87/1369093487.db2.gz	WPXJQCABUIRNQJ-GOSISDBHSA-N	0	3	328.456	3.212	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)[C@H]2CCc3cc(OC)ccc32)CC1	ZINC001112929854	1369094365	/nfs/dbraw/zinc/09/43/65/1369094365.db2.gz	PXNHYOQDRPWZRY-UZLBHIALSA-N	0	3	342.483	3.224	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)C#CC(C)(C)C)c1ccccc1OC	ZINC001198724602	1369100500	/nfs/dbraw/zinc/10/05/00/1369100500.db2.gz	YSNJQCMUHUXNTI-SFHVURJKSA-N	0	3	342.483	3.458	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@H](NCCCOC)c1ccccc1OC	ZINC001198743338	1369103632	/nfs/dbraw/zinc/10/36/32/1369103632.db2.gz	XAHCLZWXOJMWJE-KRWDZBQOSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)c1cc[nH]c1)c1ccccc1OC	ZINC001198743371	1369103749	/nfs/dbraw/zinc/10/37/49/1369103749.db2.gz	XTAMUWZXSVPMHZ-KRWDZBQOSA-N	0	3	327.428	3.050	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@@H](C)C(F)(F)F)c1ccccc1OC	ZINC001198834781	1369125846	/nfs/dbraw/zinc/12/58/46/1369125846.db2.gz	NYGDAQNKVKXVFB-OCCSQVGLSA-N	0	3	344.377	3.217	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@H](NCCCF)c1ccccc1OC	ZINC001198836010	1369126876	/nfs/dbraw/zinc/12/68/76/1369126876.db2.gz	XEIFHBMRJFAFBJ-SFHVURJKSA-N	0	3	348.462	3.385	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)Cc2ccc3cccnc3c2)CC1	ZINC001113001292	1369130604	/nfs/dbraw/zinc/13/06/04/1369130604.db2.gz	QZFMWZRBYOXUIE-KRWDZBQOSA-N	0	3	337.467	3.276	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@H](NCC2CC2)c2ccccc2OC)C1	ZINC001198894161	1369141896	/nfs/dbraw/zinc/14/18/96/1369141896.db2.gz	FAZPXRLGPBGKAL-KRWDZBQOSA-N	0	3	328.456	3.208	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)[C@@H]1C[C@H]1CC)c1ccccc1OC	ZINC001198908905	1369146977	/nfs/dbraw/zinc/14/69/77/1369146977.db2.gz	QHQUCQGXPCOBTI-NXHRZFHOSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@H](CCC)CC(C)C)C1	ZINC001199252589	1369198499	/nfs/dbraw/zinc/19/84/99/1369198499.db2.gz	DPABAIQFYVUQBL-GUDVDZBRSA-N	0	3	338.536	3.357	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CCCC3CCCC3)C[C@H]2O)CCCC1	ZINC001199560320	1369237081	/nfs/dbraw/zinc/23/70/81/1369237081.db2.gz	QVBUTJMLZLURDC-RTBURBONSA-N	0	3	348.531	3.255	20	30		EGEDHN
C=CCCC(=O)N1CCCO[C@H](CNCc2ccccc2Cl)C1	ZINC001200083633	1369313416	/nfs/dbraw/zinc/31/34/16/1369313416.db2.gz	MKTLVOSWYKRSFL-MRXNPFEDSA-N	0	3	336.863	3.013	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC(NCc2nsc3ccccc32)CC1	ZINC001200448716	1369371014	/nfs/dbraw/zinc/37/10/14/1369371014.db2.gz	KFKZTLRMVWLAHS-UHFFFAOYSA-N	0	3	341.480	3.036	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)Cc2cc(F)c(F)cc2F)CC1	ZINC001113380406	1369379810	/nfs/dbraw/zinc/37/98/10/1369379810.db2.gz	MNHYONVTTMWBKG-CYBMUJFWSA-N	0	3	340.389	3.145	20	30		EGEDHN
CC#CCNC[C@H]1CN(C(=O)[C@@H](CC)CCCCCC)CCCO1	ZINC001201147370	1369486044	/nfs/dbraw/zinc/48/60/44/1369486044.db2.gz	LWBYSJHXERELFO-OALUTQOASA-N	0	3	336.520	3.213	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCCO[C@@H](CNCc2ccsc2)C1	ZINC001201525420	1369565233	/nfs/dbraw/zinc/56/52/33/1369565233.db2.gz	RQRPNZBPAHHXPU-INIZCTEOSA-N	0	3	336.501	3.058	20	30		EGEDHN
CC#CCNC[C@H]1CN(C(=O)[C@H](CC)CC2CCCCC2)CCCO1	ZINC001201547094	1369572425	/nfs/dbraw/zinc/57/24/25/1369572425.db2.gz	PPHIKFSIOHJSSX-UXHICEINSA-N	0	3	348.531	3.213	20	30		EGEDHN
CCCCCCCCCCN1C[C@](O)(C(F)(F)F)C[C@H]1CO	ZINC001201852796	1369634521	/nfs/dbraw/zinc/63/45/21/1369634521.db2.gz	LUTKRPUDYKILMX-GJZGRUSLSA-N	0	3	325.415	3.487	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)N1CCC(NCc2oc(CCC)nc2C)CC1	ZINC001202084422	1369683300	/nfs/dbraw/zinc/68/33/00/1369683300.db2.gz	CGZXFTLINBNNCZ-CABCVRRESA-N	0	3	347.503	3.474	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC(NCc2ccncc2Cl)CC1	ZINC001202108073	1369688831	/nfs/dbraw/zinc/68/88/31/1369688831.db2.gz	GKYUJNBUOJZMLI-CQSZACIVSA-N	0	3	335.879	3.418	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC(NCc2ccn(C(C)C)n2)CC1	ZINC001202122400	1369692028	/nfs/dbraw/zinc/69/20/28/1369692028.db2.gz	AENBCPZXAPFHJH-MRXNPFEDSA-N	0	3	332.492	3.147	20	30		EGEDHN
C=C(Br)CNC1CCN(C(=O)C2(CCCC)CC2)CC1	ZINC001202345875	1369744988	/nfs/dbraw/zinc/74/49/88/1369744988.db2.gz	HHRGVEBVTVIZSY-UHFFFAOYSA-N	0	3	343.309	3.446	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(NCc3ccccc3C#N)CC2)CCC1	ZINC001202365314	1369751735	/nfs/dbraw/zinc/75/17/35/1369751735.db2.gz	MSJCKKRQOXNAEE-UHFFFAOYSA-N	0	3	337.467	3.385	20	30		EGEDHN
CCCc1ccc(CN2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)C#CC(C)(C)C)cc1	ZINC001114255293	1369831344	/nfs/dbraw/zinc/83/13/44/1369831344.db2.gz	GGCJQULIMDNDAZ-KXTWHKPSSA-N	0	3	338.495	3.235	20	30		EGEDHN
CC[C@H](c1ccc(F)cc1)N1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)C#CC(C)(C)C	ZINC001114257499	1369833176	/nfs/dbraw/zinc/83/31/76/1369833176.db2.gz	ACCAKEWPTVEYIR-RMJJICAUSA-N	0	3	342.458	3.373	20	30		EGEDHN
O=C(C=C1CCC1)N[C@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202711625	1369860403	/nfs/dbraw/zinc/86/04/03/1369860403.db2.gz	BIOMPFKJNHMCQI-PMACEKPBSA-N	0	3	334.463	3.165	20	30		EGEDHN
O=C(N[C@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2)C1=CCCC1	ZINC001202755676	1369879792	/nfs/dbraw/zinc/87/97/92/1369879792.db2.gz	PCNGBEHNESYLTM-UXHICEINSA-N	0	3	334.463	3.165	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1C[C@@H](NCc2cccc(F)c2F)C12CCC2	ZINC001202868114	1369912995	/nfs/dbraw/zinc/91/29/95/1369912995.db2.gz	VSVZLNYJOYGIMR-IAGOWNOFSA-N	0	3	346.421	3.141	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@@H]1C[C@H](NCc2ccccc2F)C12CCC2	ZINC001202920785	1369927624	/nfs/dbraw/zinc/92/76/24/1369927624.db2.gz	PAUQRUCAKAMRIF-ZWKOTPCHSA-N	0	3	342.458	3.392	20	30		EGEDHN
CN(Cc1ccc(C(N)=O)cc1)Cc1cccc(OCCCC#N)c1	ZINC001325712806	1388033369	/nfs/dbraw/zinc/03/33/69/1388033369.db2.gz	DCBLRWFYBKUJQB-UHFFFAOYSA-N	0	3	337.423	3.100	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1C[C@@H](NCc2cnoc2C)C12CCC2	ZINC001202970735	1369942388	/nfs/dbraw/zinc/94/23/88/1369942388.db2.gz	ZBGJIVLNZWVVSV-CVEARBPZSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1[C@H]2CN(Cc3cc(F)ccc3C)C[C@H]21	ZINC001114722173	1370045796	/nfs/dbraw/zinc/04/57/96/1370045796.db2.gz	CLRCSFHRVLNFAH-WQANXHIZSA-N	0	3	330.447	3.283	20	30		EGEDHN
CC1(C(=O)N[C@H]2C[C@H](NCC#Cc3ccccc3)C23CCC3)CCC1	ZINC001203259004	1370046196	/nfs/dbraw/zinc/04/61/96/1370046196.db2.gz	UKEZSMXWBYSFLL-OALUTQOASA-N	0	3	336.479	3.245	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1C[C@@H](NCc2nc(C)c(C)s2)C12CCC2	ZINC001203274482	1370055155	/nfs/dbraw/zinc/05/51/55/1370055155.db2.gz	NWQDONFIGSAJGH-HUUCEWRRSA-N	0	3	347.528	3.489	20	30		EGEDHN
Cc1coc(C(=O)N[C@H]2C[C@@H](NCC#Cc3ccccc3)C23CCC3)c1	ZINC001203282246	1370061340	/nfs/dbraw/zinc/06/13/40/1370061340.db2.gz	WMIXVNZDDPHRTN-UXHICEINSA-N	0	3	348.446	3.270	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1C[C@@H](NCc2conc2C)C12CCC2	ZINC001203295266	1370067467	/nfs/dbraw/zinc/06/74/67/1370067467.db2.gz	JCXSVHRXQVRAKX-QZTJIDSGSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1[C@H]2CN(Cc3cc(F)ccc3C)C[C@H]21	ZINC001114791623	1370082907	/nfs/dbraw/zinc/08/29/07/1370082907.db2.gz	HSNAYNKCQVQZFE-XFKSJGNHSA-N	0	3	330.447	3.283	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1[C@H]2CN(CCc3ccc(F)c(F)c3)C[C@H]21	ZINC001114792294	1370083671	/nfs/dbraw/zinc/08/36/71/1370083671.db2.gz	QXJKEFKAZJHTGD-HCCHORAYSA-N	0	3	348.437	3.156	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1C[C@@H](NCc2c(C)noc2CC)C12CCC2	ZINC001203339719	1370088971	/nfs/dbraw/zinc/08/89/71/1370088971.db2.gz	JJGRVNPQWJIUCZ-QZTJIDSGSA-N	0	3	345.487	3.419	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1C[C@H](NCc2cc(OC)ns2)C12CCC2	ZINC001203340962	1370089909	/nfs/dbraw/zinc/08/99/09/1370089909.db2.gz	NGTBJAYZQKINAN-GJZGRUSLSA-N	0	3	349.500	3.025	20	30		EGEDHN
C=CCN1C(=O)CCC[C@@]12CCCN(Cc1ccccc1OC)C2	ZINC001203427494	1370121787	/nfs/dbraw/zinc/12/17/87/1370121787.db2.gz	IQBXOACMTMBRII-FQEVSTJZSA-N	0	3	328.456	3.228	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1C[C@H](NCc2conc2CC)C12CCC2	ZINC001203450850	1370130479	/nfs/dbraw/zinc/13/04/79/1370130479.db2.gz	FPXGLWIMAHPYAC-DLBZAZTESA-N	0	3	345.487	3.356	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1C[C@H](NCc2conc2CC)C12CCC2	ZINC001203450854	1370130622	/nfs/dbraw/zinc/13/06/22/1370130622.db2.gz	FPXGLWIMAHPYAC-IRXDYDNUSA-N	0	3	345.487	3.356	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CCC[N@@H+](Cc3ccccc3[O-])C2)CC1	ZINC001203547808	1370165379	/nfs/dbraw/zinc/16/53/79/1370165379.db2.gz	ZGMDSZZMHIZZAM-UHFFFAOYSA-N	0	3	344.455	3.393	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CCC[N@H+](Cc3ccccc3[O-])C2)CC1	ZINC001203547808	1370165380	/nfs/dbraw/zinc/16/53/80/1370165380.db2.gz	ZGMDSZZMHIZZAM-UHFFFAOYSA-N	0	3	344.455	3.393	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)C(C)(C)C(C)(F)F)C12CCC2	ZINC001203670582	1370210525	/nfs/dbraw/zinc/21/05/25/1370210525.db2.gz	PWWNIDOUNQCQIB-NWDGAFQWSA-N	0	3	334.838	3.437	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)COc2cccc(C)c2)C12CCC2	ZINC001203737551	1370241679	/nfs/dbraw/zinc/24/16/79/1370241679.db2.gz	HYIPUKKITGZDNX-IAGOWNOFSA-N	0	3	348.874	3.143	20	30		EGEDHN
CC(C)(C)OC(=O)NCC[C@@H]1CCCN1Cc1cccc(C#N)c1	ZINC001203762445	1370254735	/nfs/dbraw/zinc/25/47/35/1370254735.db2.gz	IORDQKZLGOKVKU-KRWDZBQOSA-N	0	3	329.444	3.437	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1ccc(OC)c(F)c1)CC2	ZINC001203792583	1370266867	/nfs/dbraw/zinc/26/68/67/1370266867.db2.gz	MAXAZFCKQCRQFR-FQEVSTJZSA-N	0	3	346.446	3.367	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)CCCCCOCC)C12CCC2	ZINC001203804430	1370271265	/nfs/dbraw/zinc/27/12/65/1370271265.db2.gz	SXQQUUOFPFKULQ-JKSUJKDBSA-N	0	3	342.911	3.353	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(NCc3cnc(C)o3)CC2)CCCC1	ZINC001204156813	1370393053	/nfs/dbraw/zinc/39/30/53/1370393053.db2.gz	GHKVDSADNWAQSW-UHFFFAOYSA-N	0	3	331.460	3.200	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2[C@H]3CN(Cc4ccc(C#N)cc4)C[C@H]32)CCCC1	ZINC001115365246	1370410695	/nfs/dbraw/zinc/41/06/95/1370410695.db2.gz	UEWYGYDPFFFZNW-PMOLBWCYSA-N	0	3	349.478	3.241	20	30		EGEDHN
C=CCOc1ccc(CN2CC[C@]3(C[C@@H](OCC4CC4)CO3)C2)cc1	ZINC001204300394	1370436514	/nfs/dbraw/zinc/43/65/14/1370436514.db2.gz	QKDVGSANCPQSAH-RTWAWAEBSA-N	0	3	343.467	3.411	20	30		EGEDHN
C=CCCC(=O)NCC1(NCc2c(C)noc2CC)CCCCC1	ZINC001115442776	1370455038	/nfs/dbraw/zinc/45/50/38/1370455038.db2.gz	QJKYRWJCYLPBTM-UHFFFAOYSA-N	0	3	333.476	3.420	20	30		EGEDHN
O=C(/C=C\C1CC1)NCC1(NCC#Cc2ccccc2)CCCCC1	ZINC001115464835	1370469716	/nfs/dbraw/zinc/46/97/16/1370469716.db2.gz	MZIIMAOAAJVKBY-YPKPFQOOSA-N	0	3	336.479	3.413	20	30		EGEDHN
C#CCCCC(=O)NCC1(NCc2oc(CC)nc2C)CCCCC1	ZINC001115506575	1370506255	/nfs/dbraw/zinc/50/62/55/1370506255.db2.gz	ITKQWEXDZASLHR-UHFFFAOYSA-N	0	3	345.487	3.258	20	30		EGEDHN
CC(C)C#CC(=O)NCC1(NCC=C(Cl)Cl)CCCCC1	ZINC001115522339	1370521528	/nfs/dbraw/zinc/52/15/28/1370521528.db2.gz	MQUMHTCRCHLXFE-UHFFFAOYSA-N	0	3	331.287	3.374	20	30		EGEDHN
Cc1noc(C)c1CNC1(CNC(=O)C#CC(C)(C)C)CCCCC1	ZINC001115528665	1370527839	/nfs/dbraw/zinc/52/78/39/1370527839.db2.gz	XJPADXCUUXTEHU-UHFFFAOYSA-N	0	3	345.487	3.250	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCC1(NCc2cnc(C)nc2)CCCCC1	ZINC001115555090	1370552894	/nfs/dbraw/zinc/55/28/94/1370552894.db2.gz	YCLWAHMZKRIKQL-UHFFFAOYSA-N	0	3	344.503	3.296	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)C2(COC)CCCC2)CCCCC1	ZINC001115564434	1370563665	/nfs/dbraw/zinc/56/36/65/1370563665.db2.gz	QQQAVHPBQTUTEX-UHFFFAOYSA-N	0	3	342.911	3.354	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cncc3[nH]ccc32)CCCCC1	ZINC001115615776	1370613409	/nfs/dbraw/zinc/61/34/09/1370613409.db2.gz	SLFUKYFOFQBVBB-UHFFFAOYSA-N	0	3	346.862	3.338	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2c(C)cncc2C)CCCCC1	ZINC001115627723	1370621198	/nfs/dbraw/zinc/62/11/98/1370621198.db2.gz	NXFXYKFCKSFRPO-UHFFFAOYSA-N	0	3	335.879	3.473	20	30		EGEDHN
C=CC(C)(C)C(=O)NCC1(NCc2cccc(OC)n2)CCCCC1	ZINC001115667005	1370648377	/nfs/dbraw/zinc/64/83/77/1370648377.db2.gz	KZDXFEMHKMNNJB-UHFFFAOYSA-N	0	3	345.487	3.211	20	30		EGEDHN
C#CCCCCCC(=O)NCC1(NCc2conc2C)CCCCC1	ZINC001115667866	1370648807	/nfs/dbraw/zinc/64/88/07/1370648807.db2.gz	PXDYQINKOFBZPO-UHFFFAOYSA-N	0	3	345.487	3.475	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCC1(NCc2conc2C)CCCCC1	ZINC001115679540	1370662023	/nfs/dbraw/zinc/66/20/23/1370662023.db2.gz	HRPSTCGCJNLGNA-GJZGRUSLSA-N	0	3	333.476	3.350	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCC1(NCc2cnc(C)nc2)CCCCC1	ZINC001115684703	1370667473	/nfs/dbraw/zinc/66/74/73/1370667473.db2.gz	FHSGBOFXMGOFBX-KRWDZBQOSA-N	0	3	344.503	3.296	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCC1(NCc2nccnc2C)CCCCC1	ZINC001115685169	1370668646	/nfs/dbraw/zinc/66/86/46/1370668646.db2.gz	WMTDBZRICNBOJP-INIZCTEOSA-N	0	3	344.503	3.296	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H]2CCC[C@H](OC)C2)CCCCC1	ZINC001115697500	1370678558	/nfs/dbraw/zinc/67/85/58/1370678558.db2.gz	FLZNURZNXAJWTN-HOTGVXAUSA-N	0	3	342.911	3.353	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C2=CCCC2)CC[C@H]1c1ccc(F)cc1	ZINC001205270153	1370701315	/nfs/dbraw/zinc/70/13/15/1370701315.db2.gz	NVCBSZILVKRJLO-VQTJNVASSA-N	0	3	340.442	3.233	20	30		EGEDHN
O=C(NCC1(NCC#Cc2ccccc2)CCCCC1)C1(CF)CC1	ZINC001115724230	1370704193	/nfs/dbraw/zinc/70/41/93/1370704193.db2.gz	STTWMGMJTFOHGX-UHFFFAOYSA-N	0	3	342.458	3.197	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2coc(C3CC3)n2)CCCCC1	ZINC001115763143	1370747400	/nfs/dbraw/zinc/74/74/00/1370747400.db2.gz	YAUBWMJMYLFHTA-UHFFFAOYSA-N	0	3	337.851	3.327	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@H]2CCC2(C)C)C[C@H]1c1cccc(F)c1	ZINC001205426453	1370751220	/nfs/dbraw/zinc/75/12/20/1370751220.db2.gz	IJGKDSZBKVWJPI-IPMKNSEASA-N	0	3	342.458	3.169	20	30		EGEDHN
CCOC[C@@H]1COCCC12CCN(Cc1ccc(F)c(C#N)c1)CC2	ZINC001205473055	1370766233	/nfs/dbraw/zinc/76/62/33/1370766233.db2.gz	NYZREMBAXXLYAD-GOSISDBHSA-N	0	3	346.446	3.353	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@@H](C)C(CC)CC)[C@@H]3COC[C@@H]32)CC1	ZINC001205502661	1370774523	/nfs/dbraw/zinc/77/45/23/1370774523.db2.gz	IQRCZTIHLPMEFI-YTQUADARSA-N	0	3	348.531	3.184	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H]2CCO[C@H](CC)C2)CCCCC1	ZINC001115809190	1370791982	/nfs/dbraw/zinc/79/19/82/1370791982.db2.gz	BLBSQEFJAGOJPD-HZPDHXFCSA-N	0	3	342.911	3.353	20	30		EGEDHN
CCCCCCCCC(=O)N1CC[C@@H](NCc2cnc(C)nc2)C1	ZINC001187341528	1388097525	/nfs/dbraw/zinc/09/75/25/1388097525.db2.gz	YXOUQKAJYYSYGS-GOSISDBHSA-N	0	3	332.492	3.226	20	30		EGEDHN
C[C@@H](CC(F)F)C(=O)N1CCC(CNCc2ccccc2C#N)CC1	ZINC001205714754	1370850086	/nfs/dbraw/zinc/85/00/86/1370850086.db2.gz	MISQYZCSPCUBDH-AWEZNQCLSA-N	0	3	349.425	3.178	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)N1CCC(CNCc2ncc(C)s2)CC1	ZINC001205954553	1370922142	/nfs/dbraw/zinc/92/21/42/1370922142.db2.gz	HMILXJKAGKAFHF-HIFRSBDPSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)N1CCC(CNCc2ccccc2C#N)CC1	ZINC001205956065	1370923197	/nfs/dbraw/zinc/92/31/97/1370923197.db2.gz	ZKJIXBVGWDWLBP-SJORKVTESA-N	0	3	339.483	3.345	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC(CNCc3ocnc3C)CC2)CC1	ZINC001206181839	1370983553	/nfs/dbraw/zinc/98/35/53/1370983553.db2.gz	VAUNCCKCTIXEPR-UHFFFAOYSA-N	0	3	331.460	3.058	20	30		EGEDHN
CCN(C(=O)c1csc(C#N)c1)[C@H]1CCN(Cc2ccccc2)C1	ZINC001117799203	1371088797	/nfs/dbraw/zinc/08/87/97/1371088797.db2.gz	RZQJFKJMPVLWDJ-KRWDZBQOSA-N	0	3	339.464	3.356	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)Nc1cccc(Br)c1	ZINC001187482394	1388115900	/nfs/dbraw/zinc/11/59/00/1388115900.db2.gz	UTFZXLKCFWOLCC-AWEZNQCLSA-N	0	3	338.249	3.221	20	30		EGEDHN
C=C[C@@](C)(O)CC(=O)N[C@@H]1CN(Cc2ccc(C(C)C)cc2)C[C@H]1C	ZINC001206915501	1371224080	/nfs/dbraw/zinc/22/40/80/1371224080.db2.gz	ARZLOOZKRZRNCL-OZOXKJRCSA-N	0	3	344.499	3.074	20	30		EGEDHN
O=C(CC1CC1)N1CCC[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207041521	1371275666	/nfs/dbraw/zinc/27/56/66/1371275666.db2.gz	MQAZEDZFALODGK-SFHVURJKSA-N	0	3	330.859	3.072	20	30		EGEDHN
O=C(c1ccco1)N1CCC[C@@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207082012	1371288105	/nfs/dbraw/zinc/28/81/05/1371288105.db2.gz	NSOBOPNGALBZPH-QGZVFWFLSA-N	0	3	342.826	3.179	20	30		EGEDHN
Cn1cc(CN2CCC3(C[C@@H](c4ccccc4)CO3)CC2)cc1C#N	ZINC001207104927	1371294859	/nfs/dbraw/zinc/29/48/59/1371294859.db2.gz	KVYHQGBHVNSDMK-LJQANCHMSA-N	0	3	335.451	3.435	20	30		EGEDHN
CN(Cc1cc(C#N)n(C)c1)[C@@]1(C)CCCN(C(=O)OC(C)(C)C)C1	ZINC001207111001	1371296868	/nfs/dbraw/zinc/29/68/68/1371296868.db2.gz	YRMCUZKOZCXHGJ-IBGZPJMESA-N	0	3	346.475	3.118	20	30		EGEDHN
C=CCN(CCN1CCC(OC(C)C)CC1)C(=O)OC(C)(C)C	ZINC001207206642	1371328883	/nfs/dbraw/zinc/32/88/83/1371328883.db2.gz	WZSJNWRHISYFKA-UHFFFAOYSA-N	0	3	326.481	3.299	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)CCOc2ccc(C)cc2C)C1	ZINC001207351587	1371368704	/nfs/dbraw/zinc/36/87/04/1371368704.db2.gz	XLHLGTLQYFSNLF-QZTJIDSGSA-N	0	3	330.472	3.085	20	30		EGEDHN
CCCCCC(=O)N1CCC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001207353392	1371369845	/nfs/dbraw/zinc/36/98/45/1371369845.db2.gz	SSPSVSDHRCRCEA-KRWDZBQOSA-N	0	3	331.435	3.358	20	30		EGEDHN
CC1(C)C[C@@H](CN2CCN(c3ccc(C#N)cc3F)CC2)CCO1	ZINC001207362747	1371374221	/nfs/dbraw/zinc/37/42/21/1371374221.db2.gz	JSONJSJHURQIJB-INIZCTEOSA-N	0	3	331.435	3.025	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H](C)c2cccnc2)CCCCC1	ZINC001120020339	1371458105	/nfs/dbraw/zinc/45/81/05/1371458105.db2.gz	AVCSNDLZHANHSB-OAHLLOKOSA-N	0	3	335.879	3.346	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H](N[C@@H]2CCc3c2c(F)ccc3F)C1	ZINC001207654698	1371465229	/nfs/dbraw/zinc/46/52/29/1371465229.db2.gz	TVZFTPSPFHONIJ-SUMWQHHRSA-N	0	3	334.410	3.499	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC2(CC(NCc3cc(C#N)ccc3F)C2)C1	ZINC001120043982	1371467288	/nfs/dbraw/zinc/46/72/88/1371467288.db2.gz	WLLGJKCRFZRZJP-UHFFFAOYSA-N	0	3	345.418	3.186	20	30		EGEDHN
O=C(CCC1CC1)N1CCC[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001207706705	1371480088	/nfs/dbraw/zinc/48/00/88/1371480088.db2.gz	ZATZAPAEDYSLLG-SFHVURJKSA-N	0	3	344.886	3.462	20	30		EGEDHN
C=CCOCCCC(=O)N1CCC[C@@H](N[C@H](C)c2ccccc2F)C1	ZINC001207741632	1371490610	/nfs/dbraw/zinc/49/06/10/1371490610.db2.gz	NXTWGXUNRSOGQR-IAGOWNOFSA-N	0	3	348.462	3.450	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC[C@@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207763998	1371497783	/nfs/dbraw/zinc/49/77/83/1371497783.db2.gz	JNLBXKUDIRWYMW-KPGDTVGWSA-N	0	3	330.859	3.238	20	30		EGEDHN
CC1CC(C(=O)N2CCC[C@@H](NCC#Cc3ccc(Cl)cc3)C2)C1	ZINC001207782524	1371502339	/nfs/dbraw/zinc/50/23/39/1371502339.db2.gz	IUCIPOVQRJCNEY-GXOAENINSA-N	0	3	344.886	3.318	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H](NCc2cccc(C(C)C)n2)C1	ZINC001207943814	1371544755	/nfs/dbraw/zinc/54/47/55/1371544755.db2.gz	FUDZMVJYDNDTEW-SFHVURJKSA-N	0	3	327.472	3.089	20	30		EGEDHN
Cc1coc(C)c1C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001207966778	1371553706	/nfs/dbraw/zinc/55/37/06/1371553706.db2.gz	ZWGIBYGPPPZZNT-IBGZPJMESA-N	0	3	336.435	3.142	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H]([C@@H]2CCCN2Cc2ccns2)C1	ZINC001120382762	1371555150	/nfs/dbraw/zinc/55/51/50/1371555150.db2.gz	RERHUTPECZVOFH-AEFFLSMTSA-N	0	3	345.512	3.150	20	30		EGEDHN
CC/C(C)=C/C(=O)N1CCC[C@H](NCc2cc(C#N)ccc2OC)C1	ZINC001208002650	1371564979	/nfs/dbraw/zinc/56/49/79/1371564979.db2.gz	XCWIDKNWEDPQGT-KAPURRDVSA-N	0	3	341.455	3.004	20	30		EGEDHN
CC(C)CC(=O)NC1CC2(CC(NCc3ccccc3C#N)C2)C1	ZINC001120540109	1371603023	/nfs/dbraw/zinc/60/30/23/1371603023.db2.gz	ONBANORSGACWLH-UHFFFAOYSA-N	0	3	325.456	3.121	20	30		EGEDHN
C=C(C)CCC(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC001120584519	1371624565	/nfs/dbraw/zinc/62/45/65/1371624565.db2.gz	LUVREIVUHDRWDE-UHFFFAOYSA-N	0	3	329.488	3.061	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC[C@@H](NCc2scnc2C)C1	ZINC001208195001	1371635056	/nfs/dbraw/zinc/63/50/56/1371635056.db2.gz	VYQGWRIGPMUCLJ-MRXNPFEDSA-N	0	3	333.501	3.301	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001208241115	1371675370	/nfs/dbraw/zinc/67/53/70/1371675370.db2.gz	TYEUOSYDKSAURK-QGZVFWFLSA-N	0	3	343.446	3.380	20	30		EGEDHN
CCCCC(=O)NC1CC2(CC(NCc3ccccc3C#N)C2)C1	ZINC001120639761	1371675263	/nfs/dbraw/zinc/67/52/63/1371675263.db2.gz	MKCUIRKWYCETSE-UHFFFAOYSA-N	0	3	325.456	3.265	20	30		EGEDHN
CC(C)CC1(C(=O)N2CCC[C@@H](NCC#Cc3ccccc3)C2)CC1	ZINC001208316084	1371714440	/nfs/dbraw/zinc/71/44/40/1371714440.db2.gz	NPQYNWZDUYQWBW-HXUWFJFHSA-N	0	3	338.495	3.445	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CN(Cc2ccc(OC)c(C)c2)C[C@H]1C	ZINC001208374762	1371742019	/nfs/dbraw/zinc/74/20/19/1371742019.db2.gz	WFINYTLBOMVPGO-IEBWSBKVSA-N	0	3	342.483	3.134	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CN(Cc2cccc(COC)c2)C[C@H]1C	ZINC001208387817	1371747913	/nfs/dbraw/zinc/74/79/13/1371747913.db2.gz	BRBMAEFFOMMTHZ-SQGPQFPESA-N	0	3	344.499	3.372	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1CN(CCOCc2ccccc2)C[C@H]1C	ZINC001208393197	1371752127	/nfs/dbraw/zinc/75/21/27/1371752127.db2.gz	KKYDETREXIFGTD-QWFCFKBJSA-N	0	3	344.499	3.242	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1)C1CCC1	ZINC001208400367	1371754059	/nfs/dbraw/zinc/75/40/59/1371754059.db2.gz	KJCHGQROZADCKR-UZLBHIALSA-N	0	3	342.458	3.194	20	30		EGEDHN
CCc1ccc(C(=O)N2CCC[C@@H](NCC#Cc3ccccc3)C2)o1	ZINC001208430723	1371764525	/nfs/dbraw/zinc/76/45/25/1371764525.db2.gz	QAGRCUBZWQLZAO-GOSISDBHSA-N	0	3	336.435	3.088	20	30		EGEDHN
O=C(N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1)C1(F)CCCC1	ZINC001208460834	1371776383	/nfs/dbraw/zinc/77/63/83/1371776383.db2.gz	YRSGUPYRDRUDEN-SFHVURJKSA-N	0	3	346.421	3.040	20	30		EGEDHN
C#CCCCC(=O)NC1CC2(CC(NC/C(Cl)=C/Cl)C2)C1	ZINC001121019739	1371836477	/nfs/dbraw/zinc/83/64/77/1371836477.db2.gz	GQRGGCFAASFNDF-BENRWUELSA-N	0	3	329.271	3.126	20	30		EGEDHN
C=CCOCc1nn(C)c2c1CN(CCCc1ccc(F)cc1)CC2	ZINC001208767332	1371889256	/nfs/dbraw/zinc/88/92/56/1371889256.db2.gz	MSLTVXPVFQXPSP-UHFFFAOYSA-N	0	3	343.446	3.253	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CN(CCOc2ccccc2)C[C@H]1C	ZINC001208933517	1371951780	/nfs/dbraw/zinc/95/17/80/1371951780.db2.gz	QHSPPTLAWLVZPB-SJLPKXTDSA-N	0	3	330.472	3.104	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@H](CC)Oc2ccccc2C)C1	ZINC001208996241	1371969963	/nfs/dbraw/zinc/96/99/63/1371969963.db2.gz	UFDIJBGBQNMZGJ-KURKYZTESA-N	0	3	330.472	3.165	20	30		EGEDHN
C=CCN(CCN(C)Cc1ccc(N2CCCC2)cc1)C(=O)OCC	ZINC001209022371	1371976907	/nfs/dbraw/zinc/97/69/07/1371976907.db2.gz	XFXRCNBPIWRZKO-UHFFFAOYSA-N	0	3	345.487	3.363	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CC2(CC(NCc3ccccc3C#N)C2)C1	ZINC001121522661	1371998645	/nfs/dbraw/zinc/99/86/45/1371998645.db2.gz	OOUAIFNFDPQCLJ-UHFFFAOYSA-N	0	3	337.467	3.287	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC1CC2(CC(NCc3ccn(CC)n3)C2)C1	ZINC001121528818	1372000210	/nfs/dbraw/zinc/00/02/10/1372000210.db2.gz	YQBBCOHCFVUFMN-UHFFFAOYSA-N	0	3	344.503	3.022	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@H](NCc2cc(F)ccc2OC)C1	ZINC001209112853	1372001338	/nfs/dbraw/zinc/00/13/38/1372001338.db2.gz	WMNKHZWJUYZVHJ-SFHVURJKSA-N	0	3	346.446	3.109	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001209147332	1372015152	/nfs/dbraw/zinc/01/51/52/1372015152.db2.gz	VXRGVQFTYHHCTN-MAUKXSAKSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC1CC2(CC(NCc3conc3C)C2)C1	ZINC001121609942	1372023117	/nfs/dbraw/zinc/02/31/17/1372023117.db2.gz	HNGAWCSOTUNIMG-AEGNVBMISA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC1CC2(CC(NCc3conc3CC)C2)C1	ZINC001121610206	1372024260	/nfs/dbraw/zinc/02/42/60/1372024260.db2.gz	JBNBFUXTBVGSJQ-YADNIXQGSA-N	0	3	345.487	3.356	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC1CC2(CC(NCc3nccn3CC)C2)C1	ZINC001121714189	1372056530	/nfs/dbraw/zinc/05/65/30/1372056530.db2.gz	YOGTUKMRUCFTAV-VYJHHOQDSA-N	0	3	344.503	3.022	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC1CC2(CC(NCc3cc(C)no3)C2)C1	ZINC001121841789	1372098432	/nfs/dbraw/zinc/09/84/32/1372098432.db2.gz	MWLFOPZWILGUBA-UHFFFAOYSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=CCCCCCCN1C[C@H](NC(=O)OC(C)(C)C)C[C@H](O)C1	ZINC001209430919	1372104639	/nfs/dbraw/zinc/10/46/39/1372104639.db2.gz	DRJCLWNSPCBHEQ-CVEARBPZSA-N	0	3	326.481	3.083	20	30		EGEDHN
C=CCCCCCCN1C[C@@H](O)C[C@H](NC(=O)OC(C)(C)C)C1	ZINC001209430921	1372104909	/nfs/dbraw/zinc/10/49/09/1372104909.db2.gz	DRJCLWNSPCBHEQ-HOTGVXAUSA-N	0	3	326.481	3.083	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@H](NCC#Cc3ccccc3)C2)CC1	ZINC001209484390	1372118659	/nfs/dbraw/zinc/11/86/59/1372118659.db2.gz	IEDUJZQRGXRFSN-NRFANRHFSA-N	0	3	336.479	3.365	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1cc(Br)c(C)cc1OC	ZINC001122042833	1372159682	/nfs/dbraw/zinc/15/96/82/1372159682.db2.gz	QQKRSQCQHMKBAK-LBPRGKRZSA-N	0	3	341.249	3.388	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)CCCc1ccccn1)C2	ZINC001122100830	1372174450	/nfs/dbraw/zinc/17/44/50/1372174450.db2.gz	BNIGVGRIYNJTNW-UHFFFAOYSA-N	0	3	347.890	3.174	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)CCc1ccccc1)C2	ZINC001122113298	1372177136	/nfs/dbraw/zinc/17/71/36/1372177136.db2.gz	LNVBWFOISUATIS-UHFFFAOYSA-N	0	3	332.875	3.389	20	30		EGEDHN
O=C([C@H]1CC12CC2)N1CCC[C@@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001209809572	1372205524	/nfs/dbraw/zinc/20/55/24/1372205524.db2.gz	XDXPGIRQCWMGMC-QZTJIDSGSA-N	0	3	342.870	3.072	20	30		EGEDHN
Cn1c(Cl)cnc1C(C#N)C(=O)CCCOc1ccc(F)cc1	ZINC001123232867	1372403147	/nfs/dbraw/zinc/40/31/47/1372403147.db2.gz	CYPGAYXZNKODQZ-CYBMUJFWSA-N	0	3	335.766	3.248	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)CCc2c[nH]c3ccccc23)C1	ZINC001210783247	1372426382	/nfs/dbraw/zinc/42/63/82/1372426382.db2.gz	QRQGTGHDDHSNOU-DNVCBOLYSA-N	0	3	325.456	3.113	20	30		EGEDHN
CC(C)(C)C(=O)N1CCC[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001210788296	1372426812	/nfs/dbraw/zinc/42/68/12/1372426812.db2.gz	APNUMMSGCZHXDW-INIZCTEOSA-N	0	3	332.875	3.318	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)[C@@H](CCC)c2ccccc2)C1	ZINC001210824637	1372433688	/nfs/dbraw/zinc/43/36/88/1372433688.db2.gz	PCWURQDITIULOX-YZGWKJHDSA-N	0	3	344.499	3.209	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)C/C=C/c2ccc(C)cc2)C1	ZINC001211506793	1372569884	/nfs/dbraw/zinc/56/98/84/1372569884.db2.gz	ZRUWNNBVPPKDEY-YHTLKTDXSA-N	0	3	342.483	3.037	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2occc2CC)C[C@H]1c1ccccc1	ZINC001211667095	1372600091	/nfs/dbraw/zinc/60/00/91/1372600091.db2.gz	WAZJQVLXRQZJOL-RBUKOAKNSA-N	0	3	336.435	3.063	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@@H](C)C2CCCC2)C[C@H]1c1ccccc1	ZINC001211705185	1372606212	/nfs/dbraw/zinc/60/62/12/1372606212.db2.gz	COVAXJRAZMGQTG-DZFGPLHGSA-N	0	3	338.495	3.420	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C[C@H](C)CC(C)C)C[C@H]1c1ccccc1	ZINC001211707360	1372606379	/nfs/dbraw/zinc/60/63/79/1372606379.db2.gz	OEZAQOUOQDVQPM-YZGWKJHDSA-N	0	3	326.484	3.276	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2[nH]ccc2C2CC2)[C@H](OC)C1	ZINC001212383424	1372698178	/nfs/dbraw/zinc/69/81/78/1372698178.db2.gz	SIUJXNUJPDZYDU-QZTJIDSGSA-N	0	3	347.503	3.292	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2ccncc2CC)[C@H](OC)C1	ZINC001212493917	1372715079	/nfs/dbraw/zinc/71/50/79/1372715079.db2.gz	KGYGHLKKEQHPMQ-RTBURBONSA-N	0	3	347.503	3.043	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1CN(CC/C=C/CCC)C[C@H]1OC	ZINC001213269212	1372871943	/nfs/dbraw/zinc/87/19/43/1372871943.db2.gz	FDJWAHRENCGMQK-FTXPIHLZSA-N	0	3	334.504	3.132	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1CN(CCCc2ccccc2)C[C@H]1OC	ZINC001213315132	1372882906	/nfs/dbraw/zinc/88/29/06/1372882906.db2.gz	ZSEHHKYKQMIREQ-MISYRCLQSA-N	0	3	344.499	3.037	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CN(CCCC2CCCC2)C[C@H]1OC	ZINC001213320071	1372883748	/nfs/dbraw/zinc/88/37/48/1372883748.db2.gz	LMDNQJWDMWSBFI-BHIYHBOVSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1CN(Cc2ccccc2CC)C[C@H]1OC	ZINC001213322209	1372884418	/nfs/dbraw/zinc/88/44/18/1372884418.db2.gz	DHBGNPZOMFLVDK-PWIZWCRZSA-N	0	3	344.499	3.167	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CN(CC/C=C\CCC)C[C@H]2OC)CC1	ZINC001213379678	1372895674	/nfs/dbraw/zinc/89/56/74/1372895674.db2.gz	BLTRCKVVYMDIEP-PWBPZBFBSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@@]23C[C@@H]2CCCC3)[C@H](OC)C1	ZINC001213403620	1372902071	/nfs/dbraw/zinc/90/20/71/1372902071.db2.gz	JFEFAFZGCXTSMI-XFKSJGNHSA-N	0	3	334.504	3.129	20	30		EGEDHN
CCN1CCN(Cc2ccc(Nc3ccc(N)c(C#N)c3)cc2)CC1	ZINC001213436934	1372906166	/nfs/dbraw/zinc/90/61/66/1372906166.db2.gz	FAICSBHAEPBFDK-UHFFFAOYSA-N	0	3	335.455	3.022	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)[C@H](CC)Cc2ccccc2)[C@H](OC)C1	ZINC001213506232	1372915789	/nfs/dbraw/zinc/91/57/89/1372915789.db2.gz	HAASEALBJBCNLU-VAMGGRTRSA-N	0	3	344.499	3.037	20	30		EGEDHN
C=C[C@@](C)(O)CC(=O)NCCN[C@H](C)c1ccc(Cl)c(Cl)c1	ZINC001126377430	1372961442	/nfs/dbraw/zinc/96/14/42/1372961442.db2.gz	AOCVJVPGWSWQCY-BDJLRTHQSA-N	0	3	345.270	3.087	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)[C@H](CCC)c2ccccc2)[C@H](OC)C1	ZINC001213817949	1372965641	/nfs/dbraw/zinc/96/56/41/1372965641.db2.gz	ISKGSHMBVVJGGM-VAMGGRTRSA-N	0	3	344.499	3.352	20	30		EGEDHN
C=CCC[C@H](C(=O)N[C@@H]1CN(CCCC)C[C@H]1OC)c1ccccc1	ZINC001214001745	1372993261	/nfs/dbraw/zinc/99/32/61/1372993261.db2.gz	GMGIBRNLKPUIQV-XUVXKRRUSA-N	0	3	344.499	3.352	20	30		EGEDHN
CC(C)=CC(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001214082694	1373006268	/nfs/dbraw/zinc/00/62/68/1373006268.db2.gz	FESFQVRJEOIIIT-CRAIPNDOSA-N	0	3	330.859	3.094	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H]2CN(Cc3ccc(COC)cc3)C[C@H]21	ZINC001188081113	1388237621	/nfs/dbraw/zinc/23/76/21/1388237621.db2.gz	XYUOAJCZSSSUIY-VQTJNVASSA-N	0	3	342.483	3.222	20	30		EGEDHN
CCC[C@@H](C)CC(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001214297099	1373039310	/nfs/dbraw/zinc/03/93/10/1373039310.db2.gz	PIILMAVQCSOCLR-SPYBWZPUSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001215585755	1373214166	/nfs/dbraw/zinc/21/41/66/1373214166.db2.gz	MTUSAHGKGUILRN-FXRXJOCMSA-N	0	3	344.886	3.174	20	30		EGEDHN
CSc1nn(-c2cccc(CN3CCCCC3)c2F)c(N)c1C#N	ZINC001215675960	1373229960	/nfs/dbraw/zinc/22/99/60/1373229960.db2.gz	YDMZGDGSXXOEHR-UHFFFAOYSA-N	0	3	345.447	3.173	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NCCNCc1ccc(OC)c(Cl)c1	ZINC001128189774	1373231979	/nfs/dbraw/zinc/23/19/79/1373231979.db2.gz	CLRSBLVRWXIXQM-UHFFFAOYSA-N	0	3	345.270	3.333	20	30		EGEDHN
C=C(C)CCC(=O)NCCNCc1ccc(Br)s1	ZINC001128417933	1373264551	/nfs/dbraw/zinc/26/45/51/1373264551.db2.gz	IHQMGIWONSZYMW-UHFFFAOYSA-N	0	3	331.279	3.073	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NCCNCc1ccc(C(C)C)nc1C)OCC	ZINC001128528307	1373283143	/nfs/dbraw/zinc/28/31/43/1373283143.db2.gz	LMIPPERUGUKIHB-LJQANCHMSA-N	0	3	347.503	3.091	20	30		EGEDHN
CCCCCCCCOCC(=O)NCCNCc1ccc(C#N)cc1	ZINC001129522607	1373394211	/nfs/dbraw/zinc/39/42/11/1373394211.db2.gz	GGOZREYSRWYXGJ-UHFFFAOYSA-N	0	3	345.487	3.141	20	30		EGEDHN
CC(C)(C(=O)NCCNCc1ccc(C#N)c(F)c1)C1CCCC1	ZINC001129624520	1373404041	/nfs/dbraw/zinc/40/40/41/1373404041.db2.gz	OIFCAKWKXHKIOJ-UHFFFAOYSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=C(C)CN1CC[C@H](Oc2cnccc2CNC(=O)/C(C)=C/CC)C1	ZINC001130315230	1373490617	/nfs/dbraw/zinc/49/06/17/1373490617.db2.gz	NTLNWRTUOHHWIS-SCFNNSENSA-N	0	3	343.471	3.083	20	30		EGEDHN
C=C(C)CCC(=O)NCc1ccncc1O[C@H]1CCN(CC(=C)C)C1	ZINC001130317355	1373491301	/nfs/dbraw/zinc/49/13/01/1373491301.db2.gz	RUOTVWTVLVBLCF-SFHVURJKSA-N	0	3	343.471	3.083	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)[C@H](C)C(CC)CC)C1	ZINC001130402112	1373521414	/nfs/dbraw/zinc/52/14/14/1373521414.db2.gz	WCBMUGXCMDBDTE-ZBFHGGJFSA-N	0	3	332.492	3.074	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)C[C@H](CC)C(C)(C)C)C1	ZINC001130442341	1373541403	/nfs/dbraw/zinc/54/14/03/1373541403.db2.gz	JDSANDYFVDEYNS-RDJZCZTQSA-N	0	3	346.519	3.464	20	30		EGEDHN
F[C@H]1CNCC[C@H]1Oc1ccccc1/C=N/N=C/c1ccccc1	ZINC001218248036	1373583306	/nfs/dbraw/zinc/58/33/06/1373583306.db2.gz	FBUBSDFWZJVCJM-RDPMAPOWSA-N	0	3	325.387	3.218	20	30		EGEDHN
CC(C)=CCCC1=CC(=O)c2c(O)ccc(O[C@H]3CN[C@H]3C)c2C1=O	ZINC001218391257	1373605251	/nfs/dbraw/zinc/60/52/51/1373605251.db2.gz	LLMORGNOFKWZEL-SJCJKPOMSA-N	0	3	341.407	3.183	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N1CCO[C@@H]2CN(CCCCCCC)C[C@@H]21	ZINC001218488538	1373624843	/nfs/dbraw/zinc/62/48/43/1373624843.db2.gz	NMXRJJUWCMKVSM-KWFFUSLTSA-N	0	3	334.504	3.391	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCO[C@@H]2CN(CCCC3CCCC3)C[C@@H]21	ZINC001218517084	1373627971	/nfs/dbraw/zinc/62/79/71/1373627971.db2.gz	IULOFSVOADHARJ-YSIASYRMSA-N	0	3	348.531	3.471	20	30		EGEDHN
CC(C)=C[C@H]1[C@@H](C(=O)NCCNCc2ccc(C#N)cc2)C1(C)C	ZINC001131088200	1373641419	/nfs/dbraw/zinc/64/14/19/1373641419.db2.gz	MCIVHBSUTDHFAK-ROUUACIJSA-N	0	3	325.456	3.002	20	30		EGEDHN
CC1(CC(=O)NCCNCc2ccc(F)c(C#N)c2)CCCCC1	ZINC001131140906	1373649969	/nfs/dbraw/zinc/64/99/69/1373649969.db2.gz	XTZWNPXRADHMGE-UHFFFAOYSA-N	0	3	331.435	3.264	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)C[C@@H](C)C3CCCCC3)[C@H]2C1	ZINC001218766052	1373652645	/nfs/dbraw/zinc/65/26/45/1373652645.db2.gz	HGXVAACMYJKHSI-YZGWKJHDSA-N	0	3	348.531	3.471	20	30		EGEDHN
N#Cc1ccc(-c2csc(NC(=O)[C@@H](N)CC3CCC3)n2)s1	ZINC001218787794	1373654960	/nfs/dbraw/zinc/65/49/60/1373654960.db2.gz	KRHAAVRYFXEJRU-NSHDSACASA-N	0	3	332.454	3.199	20	30		EGEDHN
N#Cc1c(F)ccc(NC(=O)[C@H](N)C23CC4CC(CC(C4)C2)C3)c1F	ZINC001218912641	1373666769	/nfs/dbraw/zinc/66/67/69/1373666769.db2.gz	DKVJJDWOFIUWEN-LHZRQFJVSA-N	0	3	345.393	3.319	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)[C@@H](C)CCC(C)(C)C)[C@H]2C1	ZINC001218976901	1373673664	/nfs/dbraw/zinc/67/36/64/1373673664.db2.gz	VVXKJELPJJJOPZ-OKZBNKHCSA-N	0	3	336.520	3.327	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)C[C@H](C)C3CC3)[C@H]2C1	ZINC001219053695	1373683181	/nfs/dbraw/zinc/68/31/81/1373683181.db2.gz	KDJBFLYRYBDTJR-YTQUADARSA-N	0	3	336.520	3.305	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C(CCC)CCC)C[C@H](C)O2	ZINC001131681650	1373760087	/nfs/dbraw/zinc/76/00/87/1373760087.db2.gz	GBGOBDWAILDBCL-PXNSSMCTSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@H](C)O[C@]3(CCN(CC(=C)C)C3)C2)CCC1	ZINC001131681902	1373760685	/nfs/dbraw/zinc/76/06/85/1373760685.db2.gz	JYOICJJMOQFOLX-PXNSSMCTSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=CCC[C@H](C(=O)N[C@@H]1CN(CCCCC)C[C@@H]1O)c1ccccc1	ZINC001221199247	1373768117	/nfs/dbraw/zinc/76/81/17/1373768117.db2.gz	RYUFRLNCAFOXHJ-ZCNNSNEGSA-N	0	3	344.499	3.088	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)[C@@H]2CCCC[C@@H]2C2CC2)cc1F	ZINC001131741956	1373780528	/nfs/dbraw/zinc/78/05/28/1373780528.db2.gz	NYOZREQSPRZLBA-QZTJIDSGSA-N	0	3	343.446	3.120	20	30		EGEDHN
C#CC[C@@H](CC(=O)N1CC[C@@H](NC/C=C\Cl)C1)c1ccccc1	ZINC001188438621	1388309116	/nfs/dbraw/zinc/30/91/16/1388309116.db2.gz	QDFURKZMIAIIOJ-HZUVFCDBSA-N	0	3	330.859	3.127	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC[C@@H](C)N(CCCOc2ccccc2)C1	ZINC001131894839	1375031866	/nfs/dbraw/zinc/03/18/66/1375031866.db2.gz	CBKDNALEONOVRZ-MSOLQXFVSA-N	0	3	330.472	3.391	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@H](C)N(Cc2ccccc2N(C)C)C1	ZINC001131898601	1375034597	/nfs/dbraw/zinc/03/45/97/1375034597.db2.gz	BKFQENYODXBQHP-FUHWJXTLSA-N	0	3	329.488	3.188	20	30		EGEDHN
C[NH+](C)[C@H]1CC[C@H](O/C(=N\[O-])c2ccccc2Br)CC1	ZINC001223884901	1375047098	/nfs/dbraw/zinc/04/70/98/1375047098.db2.gz	UMCMCRDYBFXVAJ-FVEYBBLRSA-N	0	3	341.249	3.474	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)C2(c3ccc(F)cc3)CCC2)CC1	ZINC001224003067	1375051708	/nfs/dbraw/zinc/05/17/08/1375051708.db2.gz	OTMGNJFFEFENIG-UHFFFAOYSA-N	0	3	342.458	3.099	20	30		EGEDHN
O=C(N[C@@H]1CCCC[C@H]1NCC#Cc1cccc(Cl)c1)C1CC1	ZINC001224395628	1375066403	/nfs/dbraw/zinc/06/64/03/1375066403.db2.gz	SZMGVEBYFCGXET-QZTJIDSGSA-N	0	3	330.859	3.119	20	30		EGEDHN
O=C(N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1)[C@H]1CC=CCC1	ZINC001224740782	1375073324	/nfs/dbraw/zinc/07/33/24/1375073324.db2.gz	QROQLTDUIRTRKP-PWRODBHTSA-N	0	3	336.479	3.411	20	30		EGEDHN
C#CCN1CCC(CNC(=O)CCCCCc2cccs2)CC1	ZINC001224883875	1375082674	/nfs/dbraw/zinc/08/26/74/1375082674.db2.gz	LNXHBKNVRBTXSD-UHFFFAOYSA-N	0	3	332.513	3.312	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CC[C@H](C)N(CCOc2ccccc2C)C1	ZINC001131996286	1375088919	/nfs/dbraw/zinc/08/89/19/1375088919.db2.gz	SGGANJQIUHCPIJ-OALUTQOASA-N	0	3	342.483	3.146	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CCCC[C@H]1NCc1cc(C)ccc1OC	ZINC001225307498	1375102724	/nfs/dbraw/zinc/10/27/24/1375102724.db2.gz	ILYAPWBALQRNDH-QZTJIDSGSA-N	0	3	330.472	3.487	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2csc(C)c2C)CC[C@H]1C	ZINC001132054414	1375119919	/nfs/dbraw/zinc/11/99/19/1375119919.db2.gz	OVNIXMVFMAHBTQ-CJNGLKHVSA-N	0	3	336.501	3.150	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H]1CC[C@H](C)N(CCOC(C)C)C1	ZINC001132076928	1375134702	/nfs/dbraw/zinc/13/47/02/1375134702.db2.gz	DWBJXEUGHFBPOH-DZGCQCFKSA-N	0	3	330.900	3.159	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCc2ccc(OCC)cc2)CC[C@H]1C	ZINC001132150548	1375171800	/nfs/dbraw/zinc/17/18/00/1375171800.db2.gz	RZPXEMRMHMCISN-AEFFLSMTSA-N	0	3	330.472	3.173	20	30		EGEDHN
CC(C)c1cccc(CN[C@@H]2CCCC[C@H]2NC(=O)C#CC2CC2)n1	ZINC001226112209	1375205523	/nfs/dbraw/zinc/20/55/23/1375205523.db2.gz	YSKUDENOBJFZEM-WOJBJXKFSA-N	0	3	339.483	3.135	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H]2CC[C@@H](C)N(CCOC3CCC3)C2)CC1	ZINC001132277115	1375260925	/nfs/dbraw/zinc/26/09/25/1375260925.db2.gz	BANVJMAETDPDFH-SJORKVTESA-N	0	3	334.504	3.271	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CCCC[C@H]1NCc1cccc(OCC)n1	ZINC001226533385	1375277293	/nfs/dbraw/zinc/27/72/93/1375277293.db2.gz	WEDLSFHYRIBHBR-QZTJIDSGSA-N	0	3	345.487	3.354	20	30		EGEDHN
C#CCCCCCC(=O)NCCNCc1cccc(C(F)(F)F)c1	ZINC001132407888	1375359008	/nfs/dbraw/zinc/35/90/08/1375359008.db2.gz	SCXQELXPIOFEPZ-UHFFFAOYSA-N	0	3	340.389	3.495	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)C[C@H](C)c1ccncc1	ZINC001227047705	1375382110	/nfs/dbraw/zinc/38/21/10/1375382110.db2.gz	LFVQLPALLZHXQR-IAOVAPTHSA-N	0	3	335.879	3.345	20	30		EGEDHN
C#CCCCC(=O)NC1CCN([C@H](C)c2cccc(OC)c2)CC1	ZINC001227108080	1375391151	/nfs/dbraw/zinc/39/11/51/1375391151.db2.gz	LIPBNNWAJWRJRM-MRXNPFEDSA-N	0	3	328.456	3.140	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)C(C)(C)c2ccccc2)CC[C@H]1C	ZINC001132467741	1375408917	/nfs/dbraw/zinc/40/89/17/1375408917.db2.gz	KHIFZZLECNTZRA-IEBWSBKVSA-N	0	3	344.499	3.136	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COc2ccc(C)c(C)c2)CC[C@@H]1C	ZINC001132499825	1375427449	/nfs/dbraw/zinc/42/74/49/1375427449.db2.gz	KTDUTOZAVKFJSN-ROUUACIJSA-N	0	3	330.472	3.227	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1CC[C@H](C)N(Cc2ccccc2C)C1	ZINC001132530328	1375444462	/nfs/dbraw/zinc/44/44/62/1375444462.db2.gz	WQZCJHNZSMSQIC-PKOBYXMFSA-N	0	3	330.472	3.057	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2(C(F)(F)F)CCCC2)CC[C@H]1C	ZINC001132543614	1375451287	/nfs/dbraw/zinc/45/12/87/1375451287.db2.gz	ZGWVGYNVRJVZQB-KGLIPLIRSA-N	0	3	330.394	3.102	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)C2(CC=C)CCCC2)CC[C@H]1C	ZINC001132547146	1375454628	/nfs/dbraw/zinc/45/46/28/1375454628.db2.gz	XRCNGVXDULIJFW-QZTJIDSGSA-N	0	3	334.504	3.295	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)CCC)CC1	ZINC001132555612	1375462628	/nfs/dbraw/zinc/46/26/28/1375462628.db2.gz	XHBKQULJBNPUJC-LJQANCHMSA-N	0	3	327.472	3.088	20	30		EGEDHN
CC#CCN1CC[C@H](CN(Cc2scnc2C)C(=O)C(C)(C)C)C1	ZINC001132562074	1375468762	/nfs/dbraw/zinc/46/87/62/1375468762.db2.gz	DQVOOPGPMMBEHG-INIZCTEOSA-N	0	3	347.528	3.171	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2N(Cc2nccs2)C(=O)CCCC)CC1	ZINC001132567093	1375470942	/nfs/dbraw/zinc/47/09/42/1375470942.db2.gz	UXYNTKVBSKQBGQ-MRXNPFEDSA-N	0	3	345.512	3.150	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCCNCc1ccc(Br)s1	ZINC001132671371	1375507015	/nfs/dbraw/zinc/50/70/15/1375507015.db2.gz	PMUFKQJBJNZSLO-NSHDSACASA-N	0	3	345.306	3.319	20	30		EGEDHN
Cc1nc(CNC[C@@H]2CN(C(=O)C#CC(C)(C)C)CC[C@H]2C)cs1	ZINC001132831313	1375588926	/nfs/dbraw/zinc/58/89/26/1375588926.db2.gz	MXVRHTISAFSODR-GDBMZVCRSA-N	0	3	347.528	3.075	20	30		EGEDHN
O=C(N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1)C1CC2(CC2)C1	ZINC001228539046	1375591138	/nfs/dbraw/zinc/59/11/38/1375591138.db2.gz	VVGSRNDVURBNOV-WOJBJXKFSA-N	0	3	336.479	3.245	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](C)[C@@H](CNCc2ccn(C(C)C)n2)C1	ZINC001132864698	1375607351	/nfs/dbraw/zinc/60/73/51/1375607351.db2.gz	AIZQFTLCDLLNFS-ROUUACIJSA-N	0	3	346.519	3.395	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NC1CCN(Cc2cccc(OC)c2)CC1	ZINC001228747464	1375660630	/nfs/dbraw/zinc/66/06/30/1375660630.db2.gz	BAAFOQKDNVFBBS-HZPDHXFCSA-N	0	3	330.472	3.234	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H](C)C(C)C	ZINC001228900492	1375709357	/nfs/dbraw/zinc/70/93/57/1375709357.db2.gz	FCQDDPHDHFOANJ-BFHYXJOUSA-N	0	3	331.298	3.204	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](C)[C@@H](CNCc2csc(C)n2)C1	ZINC001133059312	1375750005	/nfs/dbraw/zinc/75/00/05/1375750005.db2.gz	OHBSLNYRCKLUCT-RDJZCZTQSA-N	0	3	347.528	3.219	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC1CCN(CCOCc2ccccc2)CC1	ZINC001229370424	1375821312	/nfs/dbraw/zinc/82/13/12/1375821312.db2.gz	YDVGJZSOCFACMZ-UHFFFAOYSA-N	0	3	344.499	3.386	20	30		EGEDHN
CCCCCCCCC(=O)N[C@@H]1CCCC[C@H]1NCc1n[nH]c(C)n1	ZINC001229882714	1375910911	/nfs/dbraw/zinc/91/09/11/1375910911.db2.gz	DECTXCOGRAVLLO-IAGOWNOFSA-N	0	3	349.523	3.381	20	30		EGEDHN
Cc1c[nH]cc1C(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1	ZINC001230139041	1375950570	/nfs/dbraw/zinc/95/05/70/1375950570.db2.gz	XLMBBEFJJNOFFW-WOJBJXKFSA-N	0	3	335.451	3.005	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)CC1CCCC1	ZINC001133377663	1375958289	/nfs/dbraw/zinc/95/82/89/1375958289.db2.gz	XGWHSVFOFNDSCC-UHFFFAOYSA-N	0	3	332.875	3.472	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)[C@H](CCC)c2ccccc2)CC1	ZINC001230194015	1375963798	/nfs/dbraw/zinc/96/37/98/1375963798.db2.gz	HXLBEOFZZDJVIA-HXUWFJFHSA-N	0	3	344.499	3.354	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H]1C[C@@H]1C(C)C	ZINC001133407569	1375992564	/nfs/dbraw/zinc/99/25/64/1375992564.db2.gz	JHIBGJDUQVMXRM-QZTJIDSGSA-N	0	3	332.875	3.184	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NC1CCN([C@H](CC)c2ccc(F)cc2)CC1	ZINC001230415149	1376024550	/nfs/dbraw/zinc/02/45/50/1376024550.db2.gz	LLVJSBLVBFWXNM-HNAYVOBHSA-N	0	3	348.462	3.449	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1C1CCN(C(=O)CCC(F)F)CC1	ZINC001230581115	1376084801	/nfs/dbraw/zinc/08/48/01/1376084801.db2.gz	VOJNLEXAIUPWNP-CQSZACIVSA-N	0	3	334.838	3.487	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1C1CCN(C(=O)[C@H](CCC)OC)CC1	ZINC001230584732	1376086040	/nfs/dbraw/zinc/08/60/40/1376086040.db2.gz	TZNANADWBYCLDP-SJORKVTESA-N	0	3	342.911	3.257	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)c1scnc1C)Cc1cccnc1	ZINC001230692570	1376127267	/nfs/dbraw/zinc/12/72/67/1376127267.db2.gz	JNVBXRBMWCXPBG-UHFFFAOYSA-N	0	3	344.484	3.045	20	30		EGEDHN
C=C(C)CCC(=O)NCCCN(Cc1cccnc1)C[C@@H](CC)OC	ZINC001230771310	1376148073	/nfs/dbraw/zinc/14/80/73/1376148073.db2.gz	DIDIAWASCLXEBE-LJQANCHMSA-N	0	3	347.503	3.171	20	30		EGEDHN
C#CCCN(CCCNC(=O)[C@H]1CCC[C@@H](C)C1)Cc1cccnc1	ZINC001230829956	1376162841	/nfs/dbraw/zinc/16/28/41/1376162841.db2.gz	SJHNHENJMFFVSD-QUCCMNQESA-N	0	3	341.499	3.240	20	30		EGEDHN
C#CCCN(CCCNC(=O)[C@](C)(C=C)CC)Cc1cccnc1	ZINC001230838934	1376163752	/nfs/dbraw/zinc/16/37/52/1376163752.db2.gz	XAGJAGTTWIYJPX-HXUWFJFHSA-N	0	3	327.472	3.016	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)C(C)(C)C(F)F)Cc1cccnc1	ZINC001230840588	1376164990	/nfs/dbraw/zinc/16/49/90/1376164990.db2.gz	AVQIZRJOFXCBIL-UHFFFAOYSA-N	0	3	339.430	3.257	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)/C=C(/C)C1CC1	ZINC001133868252	1376243428	/nfs/dbraw/zinc/24/34/28/1376243428.db2.gz	WYOLAHLBQJTQKZ-JSQQBDPTSA-N	0	3	329.282	3.124	20	30		EGEDHN
C#Cc1cccc(CN2CCC(Oc3ccc(C(=O)OC)cc3)CC2)c1	ZINC001231659155	1376298401	/nfs/dbraw/zinc/29/84/01/1376298401.db2.gz	HVQLRNPCBJPAAA-UHFFFAOYSA-N	0	3	349.430	3.498	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)/C=C\C1CC1)NCc1cc(F)ccc1C#N	ZINC001134009870	1376311787	/nfs/dbraw/zinc/31/17/87/1376311787.db2.gz	YRHDJDGNPVBRSK-WNFXYAGKSA-N	0	3	329.419	3.036	20	30		EGEDHN
CC(C)=C(F)C(=O)N[C@H](C)C[C@@H](C)NCc1cc(F)ccc1C#N	ZINC001134080643	1376354718	/nfs/dbraw/zinc/35/47/18/1376354718.db2.gz	APXJCYZNENKBKB-CHWSQXEVSA-N	0	3	335.398	3.334	20	30		EGEDHN
N#Cc1ccccc1O[C@@H]1CCCN(Cc2cccc3c[nH]nc32)C1	ZINC001231973897	1376367247	/nfs/dbraw/zinc/36/72/47/1376367247.db2.gz	NOEMSNTYTZAZTE-GOSISDBHSA-N	0	3	332.407	3.478	20	30		EGEDHN
Cc1ccc(CC(=O)N[C@@H](C)C[C@H](C)NCc2ccccc2C#N)o1	ZINC001134156650	1376391206	/nfs/dbraw/zinc/39/12/06/1376391206.db2.gz	NPXDRTHFDWRHAR-GJZGRUSLSA-N	0	3	339.439	3.075	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1ccccc1C#N)NC(=O)c1ccoc1Cl	ZINC001134252715	1376436864	/nfs/dbraw/zinc/43/68/64/1376436864.db2.gz	UEBHWEDLLADEKO-QWHCGFSZSA-N	0	3	345.830	3.491	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc(Cl)c(F)c2)cc1F	ZINC001134263701	1376444252	/nfs/dbraw/zinc/44/42/52/1376444252.db2.gz	MRJGZMTYVODRIS-UHFFFAOYSA-N	0	3	349.768	3.009	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)c1sccc1F)NCc1ccccc1C#N	ZINC001134274391	1376449854	/nfs/dbraw/zinc/44/98/54/1376449854.db2.gz	OSQDJPSQTQDKQW-STQMWFEESA-N	0	3	345.443	3.446	20	30		EGEDHN
C=CCO[C@@H]1CO[C@@]2(C1)CCCN(Cc1c(C)cccc1OC)C2	ZINC001232622667	1376491078	/nfs/dbraw/zinc/49/10/78/1376491078.db2.gz	TUMLVYDOMZRQNT-FXAWDEMLSA-N	0	3	331.456	3.330	20	30		EGEDHN
CCC[C@@H](COC)N(CCC(=O)OCC)Cc1ccc(C#N)s1	ZINC001232847375	1376523700	/nfs/dbraw/zinc/52/37/00/1376523700.db2.gz	VSVZLCNUQFUAQL-AWEZNQCLSA-N	0	3	338.473	3.190	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@H](C)C[C@H](C)NCc1ccn(CC)n1	ZINC001134447414	1376542185	/nfs/dbraw/zinc/54/21/85/1376542185.db2.gz	HUOCNZNBTYDVHQ-QWHCGFSZSA-N	0	3	340.899	3.055	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)C1C=CC=CC=C1	ZINC001134476545	1376559585	/nfs/dbraw/zinc/55/95/85/1376559585.db2.gz	UAKDNVFDTYCKAM-KBPBESRZSA-N	0	3	339.277	3.066	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2nc(C)cs2)CCC1	ZINC001134587187	1376611116	/nfs/dbraw/zinc/61/11/16/1376611116.db2.gz	BERTYWSEEXXIRM-KBPBESRZSA-N	0	3	333.501	3.018	20	30		EGEDHN
Cc1ccc(CC(=O)N[C@H](C)C[C@@H](C)NCc2ccccc2C#N)cc1	ZINC001134903043	1376778249	/nfs/dbraw/zinc/77/82/49/1376778249.db2.gz	WYIADHYLQUOFGD-QZTJIDSGSA-N	0	3	349.478	3.482	20	30		EGEDHN
CC(C)C#CC(=O)N(C)C[C@H]1CCN1CCCCc1ccccc1	ZINC001234160554	1376780448	/nfs/dbraw/zinc/78/04/48/1376780448.db2.gz	IDSMAWPPPQLEQT-HXUWFJFHSA-N	0	3	326.484	3.201	20	30		EGEDHN
C=CCC[C@@H](C)N1CC[C@@H]1CN(C)C(=O)c1cc(C(F)(F)F)no1	ZINC001235632313	1376878493	/nfs/dbraw/zinc/87/84/93/1376878493.db2.gz	FXVVXPXGIFJYIM-VXGBXAGGSA-N	0	3	345.365	3.194	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H](C)C[C@@H](C)NCC(=C)Br	ZINC001135188586	1376961764	/nfs/dbraw/zinc/96/17/64/1376961764.db2.gz	MTEOGGSCFDQKAF-HUUCEWRRSA-N	0	3	343.309	3.352	20	30		EGEDHN
Cc1coc(C(=O)N[C@@H](C)C[C@@H](C)NCc2cc(F)ccc2C#N)c1	ZINC001135269826	1377013052	/nfs/dbraw/zinc/01/30/52/1377013052.db2.gz	HSXJSJQYBCBEQP-KGLIPLIRSA-N	0	3	343.402	3.286	20	30		EGEDHN
C=CCCCC(=O)N[C@H](C)C[C@@H](C)NCc1c(C)nn(C)c1Cl	ZINC001135353578	1377049086	/nfs/dbraw/zinc/04/90/86/1377049086.db2.gz	JMIJNUACMFBOPH-CHWSQXEVSA-N	0	3	340.899	3.111	20	30		EGEDHN
C=CCCCC(=O)N[C@@H](C)C[C@@H](C)NCc1nc2ccccc2n1C	ZINC001135358038	1377050730	/nfs/dbraw/zinc/05/07/30/1377050730.db2.gz	LRZBGGWTGIBSKD-CVEARBPZSA-N	0	3	342.487	3.303	20	30		EGEDHN
CCc1ccoc1C(=O)N[C@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001135387274	1377067305	/nfs/dbraw/zinc/06/73/05/1377067305.db2.gz	MRBFYKXBDSMHON-LSDHHAIUSA-N	0	3	339.439	3.400	20	30		EGEDHN
C=CC[N@H+](Cc1ccccc1)Cc1ccc(CC(=O)OC)cc1[O-]	ZINC001249207349	1377073193	/nfs/dbraw/zinc/07/31/93/1377073193.db2.gz	CQHKTRMGDNEYHG-UHFFFAOYSA-N	0	3	325.408	3.296	20	30		EGEDHN
C=CC[N@@H+](Cc1ccccc1)Cc1ccc(CC(=O)OC)cc1[O-]	ZINC001249207349	1377073197	/nfs/dbraw/zinc/07/31/97/1377073197.db2.gz	CQHKTRMGDNEYHG-UHFFFAOYSA-N	0	3	325.408	3.296	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)C(C)(C)C(F)F)NCc1ccccc1C#N	ZINC001135422173	1377087179	/nfs/dbraw/zinc/08/71/79/1377087179.db2.gz	FWSGRYKPUZSXMJ-CHWSQXEVSA-N	0	3	337.414	3.222	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)C1CC2(CC2)C1)NCc1cc(F)ccc1C#N	ZINC001135445988	1377100365	/nfs/dbraw/zinc/10/03/65/1377100365.db2.gz	IPIMZLATXPUAHP-ZIAGYGMSSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)C(C1CC1)C1CC1	ZINC001135902803	1377255508	/nfs/dbraw/zinc/25/55/08/1377255508.db2.gz	ZDWYPLZEHSGEBH-NWDGAFQWSA-N	0	3	343.309	3.204	20	30		EGEDHN
CC[C@H]1CCCC[C@@H]1C(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001136080310	1377333666	/nfs/dbraw/zinc/33/36/66/1377333666.db2.gz	DVXUHKQMMMNQJH-RDJZCZTQSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1ccc(OC)nc1)[C@H]2CC	ZINC001137033066	1377462394	/nfs/dbraw/zinc/46/23/94/1377462394.db2.gz	OBWCVCOWRGCIKS-PXNSSMCTSA-N	0	3	343.471	3.012	20	30		EGEDHN
C[C@H]1CN(Cc2ccc(OCC#N)cc2)CCC[C@@]1(O)C(F)(F)F	ZINC001137115314	1377481295	/nfs/dbraw/zinc/48/12/95/1377481295.db2.gz	IJCTXDXZQYNCDL-BBRMVZONSA-N	0	3	342.361	3.114	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1c(C)noc1C(C)C)C(C)C	ZINC001268212263	1377495729	/nfs/dbraw/zinc/49/57/29/1377495729.db2.gz	KCYDJSFPYRSGFZ-ZDUSSCGKSA-N	0	3	327.856	3.203	20	30		EGEDHN
C[C@@](CNCc1cc(C#N)ccc1F)(NC(=O)CC1CCC1)C1CC1	ZINC001269606591	1377559577	/nfs/dbraw/zinc/55/95/77/1377559577.db2.gz	PELDBYUUCKSJMT-FQEVSTJZSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=CCO[C@H]1CO[C@@]2(C1)CCCN(Cc1cccc(OCC)c1)C2	ZINC001138099343	1377676554	/nfs/dbraw/zinc/67/65/54/1377676554.db2.gz	RSLZDTMNRSFUFG-WOJBJXKFSA-N	0	3	331.456	3.411	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3cc(C)ccc3OC)C2)C1=O	ZINC001138484080	1377730746	/nfs/dbraw/zinc/73/07/46/1377730746.db2.gz	IFJUEHOELOGLOH-HXUWFJFHSA-N	0	3	328.456	3.004	20	30		EGEDHN
C#CCOc1ccc(CN2CCC[C@]3(C[C@@H](CCOC)CO3)C2)cc1	ZINC001138559715	1377742050	/nfs/dbraw/zinc/74/20/50/1377742050.db2.gz	QLZLQDCCBZRGDM-CTNGQTDRSA-N	0	3	343.467	3.106	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CCN(c3ccccc3OC)CC2)c1[O-]	ZINC001138625804	1377755580	/nfs/dbraw/zinc/75/55/80/1377755580.db2.gz	TWQSXBJXAXTUPX-UHFFFAOYSA-N	0	3	338.451	3.452	20	30		EGEDHN
C=CCc1cccc(CN2CCN(c3ccccc3OC)CC2)c1O	ZINC001138625804	1377755586	/nfs/dbraw/zinc/75/55/86/1377755586.db2.gz	TWQSXBJXAXTUPX-UHFFFAOYSA-N	0	3	338.451	3.452	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@@]3(C2)C(=O)Nc2ccccc23)c1[O-]	ZINC001138627384	1377756986	/nfs/dbraw/zinc/75/69/86/1377756986.db2.gz	FHCULZKFQKGQJP-NRFANRHFSA-N	0	3	334.419	3.217	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@@]3(C2)C(=O)Nc2ccccc23)c1[O-]	ZINC001138627384	1377756989	/nfs/dbraw/zinc/75/69/89/1377756989.db2.gz	FHCULZKFQKGQJP-NRFANRHFSA-N	0	3	334.419	3.217	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@H](Oc3cccc(OC)n3)C2)c1[O-]	ZINC001138631073	1377758306	/nfs/dbraw/zinc/75/83/06/1377758306.db2.gz	KDYQJTBDPZQDPR-KRWDZBQOSA-N	0	3	340.423	3.178	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@H](Oc3cccc(OC)n3)C2)c1[O-]	ZINC001138631073	1377758309	/nfs/dbraw/zinc/75/83/09/1377758309.db2.gz	KDYQJTBDPZQDPR-KRWDZBQOSA-N	0	3	340.423	3.178	20	30		EGEDHN
C=CCOC(=O)N[C@H]1CCCN(Cc2c[nH]c3cccc(C)c23)C1	ZINC001139198209	1377848974	/nfs/dbraw/zinc/84/89/74/1377848974.db2.gz	KWZHMEIBUYBENK-INIZCTEOSA-N	0	3	327.428	3.353	20	30		EGEDHN
CN(Cc1ccc(N2CCC(O)CC2)s1)Cc1cccc(C#N)c1	ZINC001139292922	1377863653	/nfs/dbraw/zinc/86/36/53/1377863653.db2.gz	CGQQTDNSISFNKR-UHFFFAOYSA-N	0	3	341.480	3.213	20	30		EGEDHN
N#Cc1ccc(Oc2ccc(CN3CCN(CC4CC4)CC3)cn2)cc1	ZINC001139425149	1377882202	/nfs/dbraw/zinc/88/22/02/1377882202.db2.gz	FAFZLUYAQMILJK-UHFFFAOYSA-N	0	3	348.450	3.273	20	30		EGEDHN
C[C@@H]1CCN(Cc2ccc(Oc3ccc(C#N)cc3)nc2)CC[C@@H]1O	ZINC001139424655	1377882261	/nfs/dbraw/zinc/88/22/61/1377882261.db2.gz	SVQRTZLBEHFJQO-BEFAXECRSA-N	0	3	337.423	3.338	20	30		EGEDHN
N#Cc1ccc(F)c(CN2CCC3(CC2)C(=O)N[C@@H]3c2ccccc2)c1	ZINC001139649170	1377926201	/nfs/dbraw/zinc/92/62/01/1377926201.db2.gz	QHRHRLOEUWLRJH-LJQANCHMSA-N	0	3	349.409	3.151	20	30		EGEDHN
Cc1ccnc(O[C@@H]2CCCN(Cc3c[nH]c4c3cccc4C#N)C2)n1	ZINC001139707532	1377938020	/nfs/dbraw/zinc/93/80/20/1377938020.db2.gz	IXPNCYNJIHZZCR-QGZVFWFLSA-N	0	3	347.422	3.181	20	30		EGEDHN
CC(C)C(=O)N(C)C1CCN(Cc2c[nH]c3c2cccc3C#N)CC1	ZINC001139707119	1377938192	/nfs/dbraw/zinc/93/81/92/1377938192.db2.gz	QQSDYGVRLRZXMV-UHFFFAOYSA-N	0	3	338.455	3.118	20	30		EGEDHN
C=CCN1C(=O)CCC[C@@]12CCCN(Cc1ccc(COC)s1)C2	ZINC001139826265	1377957934	/nfs/dbraw/zinc/95/79/34/1377957934.db2.gz	UMQBTNXTNBSSQI-IBGZPJMESA-N	0	3	348.512	3.428	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CCN(Cc3ccc(C)cn3)C2)C1	ZINC001139837672	1377959760	/nfs/dbraw/zinc/95/97/60/1377959760.db2.gz	MVXRIKIHROGEMQ-LJQANCHMSA-N	0	3	329.444	3.001	20	30		EGEDHN
N#Cc1cc(F)cc(CN2CCC3(CC2)C(=O)N[C@@H]3c2ccccc2)c1	ZINC001139875270	1377969665	/nfs/dbraw/zinc/96/96/65/1377969665.db2.gz	XWRQLKCRJKQIPG-LJQANCHMSA-N	0	3	349.409	3.151	20	30		EGEDHN
COC(=O)[C@H]1CN(Cc2cc(F)cc(C#N)c2)C[C@@H]1c1ccccc1	ZINC001139879800	1377970712	/nfs/dbraw/zinc/97/07/12/1377970712.db2.gz	UEXJCXIRFSCNNB-MOPGFXCFSA-N	0	3	338.382	3.086	20	30		EGEDHN
CN(Cc1c[nH]c2ccc(C#N)cc12)Cc1ccc2c(c1)OCCO2	ZINC001140110318	1378009881	/nfs/dbraw/zinc/00/98/81/1378009881.db2.gz	IPDLYHHJFIPOLT-UHFFFAOYSA-N	0	3	333.391	3.443	20	30		EGEDHN
C=C(C)CN1C[C@@]2(CC1=O)CCCCN2Cc1ccc2c(c1)CCO2	ZINC001273007851	1378084833	/nfs/dbraw/zinc/08/48/33/1378084833.db2.gz	GGJJYTBSRZNGSD-NRFANRHFSA-N	0	3	340.467	3.155	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC3(C2)CCN(CCCC(F)(F)F)C3)C1	ZINC001273133645	1378088751	/nfs/dbraw/zinc/08/87/51/1378088751.db2.gz	DCQKYKDUJLURPD-UHFFFAOYSA-N	0	3	330.394	3.220	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3nc(C)c(C)s3)CC2)C1=O	ZINC001273657313	1378109719	/nfs/dbraw/zinc/10/97/19/1378109719.db2.gz	NMBZKGPGWSLTMN-SFHVURJKSA-N	0	3	333.501	3.151	20	30		EGEDHN
C#CCN1CCC2(CCN(Cc3cccc(Cl)c3C)CC2)C1=O	ZINC001274413383	1378124362	/nfs/dbraw/zinc/12/43/62/1378124362.db2.gz	SHPAFVMDWCCPJW-UHFFFAOYSA-N	0	3	330.859	3.096	20	30		EGEDHN
C=CCN1CC[C@@]2(CCN(Cc3ccc(F)c(C)c3Cl)C2)C1=O	ZINC001274476902	1378126934	/nfs/dbraw/zinc/12/69/34/1378126934.db2.gz	LQQRDQCCCJZSNZ-GOSISDBHSA-N	0	3	336.838	3.398	20	30		EGEDHN
C=C(C)CN1CC[C@]2(CCN(Cc3ccc(C#N)c(Cl)c3)C2)C1=O	ZINC001274491852	1378128296	/nfs/dbraw/zinc/12/82/96/1378128296.db2.gz	BBELEBGANFNXDZ-IBGZPJMESA-N	0	3	343.858	3.212	20	30		EGEDHN
Cn1cnc2ccc(CN3CCC[C@H](Oc4ccc(C#N)cc4)C3)cc21	ZINC001140743069	1378128517	/nfs/dbraw/zinc/12/85/17/1378128517.db2.gz	WYOXYMRUUJMGSB-IBGZPJMESA-N	0	3	346.434	3.488	20	30		EGEDHN
CC(C)CN1CC[C@@]2(CCN(Cc3ccc(C#N)c(Cl)c3)C2)C1=O	ZINC001274492600	1378128560	/nfs/dbraw/zinc/12/85/60/1378128560.db2.gz	PVFALDZFXLPNPR-LJQANCHMSA-N	0	3	345.874	3.292	20	30		EGEDHN
CCN1CC[C@@]2(CCCN(Cc3cccc(C#N)c3Cl)C2)C1=O	ZINC001140813279	1378149017	/nfs/dbraw/zinc/14/90/17/1378149017.db2.gz	BVQBWDUYRWSUEJ-GOSISDBHSA-N	0	3	331.847	3.046	20	30		EGEDHN
Cc1occc1C(=O)N(C)CCCN(C)Cc1ccc(F)c(C#N)c1	ZINC001280787791	1378375569	/nfs/dbraw/zinc/37/55/69/1378375569.db2.gz	PXKTVTLAPHRIJP-UHFFFAOYSA-N	0	3	343.402	3.193	20	30		EGEDHN
N#Cc1cc(Br)ccc1CN1CCC2SC(=O)C=C2C1	ZINC001141810297	1378381318	/nfs/dbraw/zinc/38/13/18/1378381318.db2.gz	RSAQGBLLRIDMBN-CQSZACIVSA-N	0	3	349.253	3.095	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@H]1CCN(Cc1cccc(F)c1OC)C2	ZINC001143524361	1378608882	/nfs/dbraw/zinc/60/88/82/1378608882.db2.gz	QBVOGPYLDXRDIG-AZUAARDMSA-N	0	3	349.446	3.408	20	30		EGEDHN
C#Cc1ccc(CN2C[C@@H]3CCN(C(=O)c4cccc(F)c4)[C@@H]3C2)cc1	ZINC001144572386	1378747037	/nfs/dbraw/zinc/74/70/37/1378747037.db2.gz	XYCRRELABZCRQN-PZJWPPBQSA-N	0	3	348.421	3.154	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2ccn(C)n2)CCCCC1	ZINC001146502253	1378853060	/nfs/dbraw/zinc/85/30/60/1378853060.db2.gz	BUSKVEQLJYVWHT-SJORKVTESA-N	0	3	346.519	3.320	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C[C@H](C)NCc2nccn2CC)CCCC1	ZINC001146832709	1378932218	/nfs/dbraw/zinc/93/22/18/1378932218.db2.gz	XWCWAXJZOVMOMJ-DLBZAZTESA-N	0	3	346.519	3.412	20	30		EGEDHN
C[C@H](C(=O)NCCNCc1ccc(C#N)cc1)c1ccc(Cl)s1	ZINC001147161504	1378980070	/nfs/dbraw/zinc/98/00/70/1378980070.db2.gz	QWPRGNKMGPYZPL-LBPRGKRZSA-N	0	3	347.871	3.283	20	30		EGEDHN
CCC[C@H](C)C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001147251566	1378998053	/nfs/dbraw/zinc/99/80/53/1378998053.db2.gz	YURCNAQIHDDLCL-INIZCTEOSA-N	0	3	325.456	3.029	20	30		EGEDHN
C=C(C)CCC(=O)N1CC2(C1)CCN(CC[C@H]1CC1(Cl)Cl)C2	ZINC001147640258	1379055136	/nfs/dbraw/zinc/05/51/36/1379055136.db2.gz	SDVSQOUHNTZFEP-AWEZNQCLSA-N	0	3	345.314	3.461	20	30		EGEDHN
Cc1ccc([C@@H](C)C(=O)NCCNCc2ccc(C#N)c(F)c2)s1	ZINC001147779134	1379077210	/nfs/dbraw/zinc/07/72/10/1379077210.db2.gz	WSJYIKXYSHKEFA-CYBMUJFWSA-N	0	3	345.443	3.077	20	30		EGEDHN
CC1(C)CCC[C@@H](CC(=O)NCCNCc2ccc(C#N)cc2)C1	ZINC001147857255	1379090803	/nfs/dbraw/zinc/09/08/03/1379090803.db2.gz	LYMXCRDDGLGITM-SFHVURJKSA-N	0	3	327.472	3.371	20	30		EGEDHN
C#CCCCCCC(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001148060114	1379111196	/nfs/dbraw/zinc/11/11/96/1379111196.db2.gz	WDGAPZYGXPAIRN-UHFFFAOYSA-N	0	3	349.478	3.176	20	30		EGEDHN
N#Cc1cccc(C#N)c1NCC1CCN(Cc2ccncc2)CC1	ZINC001327729422	1388591414	/nfs/dbraw/zinc/59/14/14/1388591414.db2.gz	YTZGMYMXNLFRQC-UHFFFAOYSA-N	0	3	331.423	3.149	20	30		EGEDHN
CC[C@H](C)CCC(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001148484088	1379184526	/nfs/dbraw/zinc/18/45/26/1379184526.db2.gz	ACMOUNLTUVNSPH-KRWDZBQOSA-N	0	3	339.483	3.419	20	30		EGEDHN
CC[C@@H](C)[C@@H](C)C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001148500822	1379193910	/nfs/dbraw/zinc/19/39/10/1379193910.db2.gz	LRJJFVFZFAEODN-IAGOWNOFSA-N	0	3	339.483	3.275	20	30		EGEDHN
C=CCCC(=O)NC[C@H]1CN(Cc2cc(C)sc2C)CCCO1	ZINC001149339849	1379366765	/nfs/dbraw/zinc/36/67/65/1379366765.db2.gz	FNEWIURYRAZNAY-KRWDZBQOSA-N	0	3	336.501	3.038	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)C/C=C/c2ccccc2F)C1	ZINC001149881305	1379459386	/nfs/dbraw/zinc/45/93/86/1379459386.db2.gz	KMFHXYDSZMZRBU-MOTZXUDYSA-N	0	3	346.446	3.012	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H]1CN(CC2=CCCCC2)CCCO1	ZINC001150079047	1379491417	/nfs/dbraw/zinc/49/14/17/1379491417.db2.gz	PACJHKKAQYOQJW-GOSISDBHSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)CCCc2ccc(C)cc2)C1	ZINC001150201802	1379513804	/nfs/dbraw/zinc/51/38/04/1379513804.db2.gz	CDJREZOCFCMGCA-HXUWFJFHSA-N	0	3	344.499	3.101	20	30		EGEDHN
C=CCCC1(C(=O)NC[C@@H]2CN(CC3=CCCCC3)CCCO2)CC1	ZINC001150254232	1379523050	/nfs/dbraw/zinc/52/30/50/1379523050.db2.gz	LKIHEUYQUBNRSF-LJQANCHMSA-N	0	3	346.515	3.440	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)CCc2cc(C)cc(C)c2)C1	ZINC001150546557	1379565861	/nfs/dbraw/zinc/56/58/61/1379565861.db2.gz	GEMKLWVVSSBTKF-HXUWFJFHSA-N	0	3	344.499	3.019	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1nc(-c2ccccc2)oc1C(C)C	ZINC001327903428	1388620088	/nfs/dbraw/zinc/62/00/88/1388620088.db2.gz	AUMVMWUHPOXUAT-UHFFFAOYSA-N	0	3	339.439	3.150	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@@H](F)c2ccccc2)CC1	ZINC001151340290	1379701360	/nfs/dbraw/zinc/70/13/60/1379701360.db2.gz	QSORLSNPSZHXBM-SFHVURJKSA-N	0	3	348.462	3.261	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2ccc(CF)cc2)CC1	ZINC001151415366	1379716138	/nfs/dbraw/zinc/71/61/38/1379716138.db2.gz	PHRNQCBZSUECPD-UHFFFAOYSA-N	0	3	348.462	3.333	20	30		EGEDHN
C=CC[C@@H](C(=O)NCCNCc1ccc(F)cc1)c1ccccc1	ZINC001151838844	1379795118	/nfs/dbraw/zinc/79/51/18/1379795118.db2.gz	YMTZBAPKNGRIJN-LJQANCHMSA-N	0	3	326.415	3.391	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)C(=O)NCCNCc1ccsc1	ZINC001151906186	1379813690	/nfs/dbraw/zinc/81/36/90/1379813690.db2.gz	AKWMXZJYOCGEPF-SFHVURJKSA-N	0	3	328.481	3.389	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)C(=O)NCCNCc1ccc(F)cc1	ZINC001151923371	1379816121	/nfs/dbraw/zinc/81/61/21/1379816121.db2.gz	XRUVTLNABWHOCZ-IBGZPJMESA-N	0	3	340.442	3.467	20	30		EGEDHN
C=C[C@H](CC(=O)NCCNCc1ccc(F)cc1)c1ccccc1	ZINC001151941779	1379820357	/nfs/dbraw/zinc/82/03/57/1379820357.db2.gz	AJQCCSGRZNREOD-QGZVFWFLSA-N	0	3	326.415	3.391	20	30		EGEDHN
C=CCC1(C(=O)NCCNC[C@H](O)c2ccccc2F)CCCCC1	ZINC001151997095	1379834142	/nfs/dbraw/zinc/83/41/42/1379834142.db2.gz	BODHVWWWKQHENG-SFHVURJKSA-N	0	3	348.462	3.092	20	30		EGEDHN
CCN(Cc1cc(Cl)cc(Cl)c1)[C@H](C)CNC(=O)[C@@H](C)C#N	ZINC001152413222	1379929554	/nfs/dbraw/zinc/92/95/54/1379929554.db2.gz	KKBWKERVTMFANV-NWDGAFQWSA-N	0	3	342.270	3.480	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)[C@H]1[C@@H]2CCC[C@@H]21	ZINC001152681637	1379969285	/nfs/dbraw/zinc/96/92/85/1379969285.db2.gz	FBHODHYWEGISPV-WKCGWZECSA-N	0	3	343.446	3.070	20	30		EGEDHN
C#CCC1(C(=O)NC[C@@H](C)N(CC)Cc2ccc(F)cc2)CCC1	ZINC001153773115	1380126285	/nfs/dbraw/zinc/12/62/85/1380126285.db2.gz	KNQFXKCNTQNEOG-MRXNPFEDSA-N	0	3	330.447	3.346	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@H](C)CCc1ccc(F)cc1	ZINC001153773037	1380126333	/nfs/dbraw/zinc/12/63/33/1380126333.db2.gz	IKMGJUWGTABAQN-IAGOWNOFSA-N	0	3	332.463	3.244	20	30		EGEDHN
CC1(C)CCCC[C@H]1CC(=O)NCCNCc1ccc(C#N)s1	ZINC001153836651	1380140329	/nfs/dbraw/zinc/14/03/29/1380140329.db2.gz	DCEBIUZDYBVUIR-AWEZNQCLSA-N	0	3	333.501	3.432	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H](C)N(CC)Cc2cccc(F)c2)cc1	ZINC001154574417	1380308168	/nfs/dbraw/zinc/30/81/68/1380308168.db2.gz	RFVBHOMCQLBCME-MRXNPFEDSA-N	0	3	338.426	3.447	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)C1CC2(CCC2)C1	ZINC001154724797	1380340812	/nfs/dbraw/zinc/34/08/12/1380340812.db2.gz	MQSPBBQLELGFOT-MRXNPFEDSA-N	0	3	339.483	3.465	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)c1cc(C)co1	ZINC001154725012	1380340863	/nfs/dbraw/zinc/34/08/63/1380340863.db2.gz	XWJYMZNIMSYHNX-OAHLLOKOSA-N	0	3	325.412	3.100	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)CCCC1CC1	ZINC001154736783	1380342657	/nfs/dbraw/zinc/34/26/57/1380342657.db2.gz	QBHWBRJWRSXLLZ-MRXNPFEDSA-N	0	3	327.472	3.465	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H](C)N(CC)C[C@@H]1COc2ccccc2O1	ZINC001154958020	1380381229	/nfs/dbraw/zinc/38/12/29/1380381229.db2.gz	WOOHANTYPAELHW-IAGOWNOFSA-N	0	3	346.471	3.009	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)C1CCC(F)CC1	ZINC001155041052	1380397462	/nfs/dbraw/zinc/39/74/62/1380397462.db2.gz	NBNMGMSOPMSVBF-VNCLNFNDSA-N	0	3	345.462	3.413	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@H](C)N(CC)C[C@H](O)c2ccc(F)cc2)C1	ZINC001155126092	1380413642	/nfs/dbraw/zinc/41/36/42/1380413642.db2.gz	CMFZJQZSWTXVOR-QAPCUYQASA-N	0	3	348.462	3.042	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)C=C2CCCCC2)c1	ZINC001155336708	1380438551	/nfs/dbraw/zinc/43/85/51/1380438551.db2.gz	XDVQBTODPREGPS-UHFFFAOYSA-N	0	3	329.419	3.184	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@H](CC)Oc1ccccc1C	ZINC001155528647	1380464821	/nfs/dbraw/zinc/46/48/21/1380464821.db2.gz	PLMRBWPYSARRNK-MSOLQXFVSA-N	0	3	330.472	3.002	20	30		EGEDHN
C=CCCC(=O)NCCCNCc1ccccc1Br	ZINC001155593190	1380471121	/nfs/dbraw/zinc/47/11/21/1380471121.db2.gz	BFGJZMMYQZRKFJ-UHFFFAOYSA-N	0	3	325.250	3.011	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)c1ccnc2c1ccc1cccnc12	ZINC001155817686	1380494743	/nfs/dbraw/zinc/49/47/43/1380494743.db2.gz	LXQRAMGODLWTPN-INIZCTEOSA-N	0	3	346.434	3.163	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1cnc(CC(C)(C)C)s1	ZINC001156240755	1380547106	/nfs/dbraw/zinc/54/71/06/1380547106.db2.gz	NXVXKUAPBOOAJD-CQSZACIVSA-N	0	3	335.517	3.195	20	30		EGEDHN
C=C(Cl)CN(CC)[C@H](C)CNC(=O)[C@H]1CCCCN1CCCC	ZINC001156305499	1380554988	/nfs/dbraw/zinc/55/49/88/1380554988.db2.gz	BDENKUIQZWXXPB-IAGOWNOFSA-N	0	3	343.943	3.220	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)C[C@H](C)C1CC1	ZINC001157145857	1380785835	/nfs/dbraw/zinc/78/58/35/1380785835.db2.gz	KRJBAQCIMYQKSH-LSDHHAIUSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NC[C@@H](C)N(CC)Cc1cc2ccccc2o1	ZINC001157217975	1380814232	/nfs/dbraw/zinc/81/42/32/1380814232.db2.gz	ZFLJYQDRXPOBRN-HZPDHXFCSA-N	0	3	344.455	3.351	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)c1ccc(F)s1	ZINC001157247925	1380823242	/nfs/dbraw/zinc/82/32/42/1380823242.db2.gz	CNNHZSHCVOYNMM-CYBMUJFWSA-N	0	3	345.443	3.399	20	30		EGEDHN
CC(C)C#CC(=O)NCCCNCc1cc(Cl)ccc1Cl	ZINC001157639062	1380988602	/nfs/dbraw/zinc/98/86/02/1380988602.db2.gz	WXPPJWHLIYNKLP-UHFFFAOYSA-N	0	3	327.255	3.249	20	30		EGEDHN
C#CCCCC(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(OC)cc1	ZINC001157885408	1381060354	/nfs/dbraw/zinc/06/03/54/1381060354.db2.gz	UAHQAWQUTKQMKT-LJQANCHMSA-N	0	3	342.483	3.312	20	30		EGEDHN
CC(C)(C)C[C@@H]1C[C@H]1C(=O)NCCCNCc1ccccc1C#N	ZINC001158390311	1381228939	/nfs/dbraw/zinc/22/89/39/1381228939.db2.gz	WGCPOFVSHVIFHU-ZWKOTPCHSA-N	0	3	327.472	3.226	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H](CCC)c1ccccn1	ZINC001158396611	1381229150	/nfs/dbraw/zinc/22/91/50/1381229150.db2.gz	CXCUGGMZYOVJEI-MSOLQXFVSA-N	0	3	329.488	3.464	20	30		EGEDHN
Cc1cnc(N2C[C@@H](C)N(Cc3ccccc3)C[C@H]2C)c(/C=N/O)c1	ZINC001158522344	1381279397	/nfs/dbraw/zinc/27/93/97/1381279397.db2.gz	ZEBQGYXYZRWTKZ-HIAWKFHPSA-N	0	3	338.455	3.297	20	30		EGEDHN
Cc1cccc(C(=O)NCCCNCc2ccc(C#N)cc2F)c1F	ZINC001158565732	1381302396	/nfs/dbraw/zinc/30/23/96/1381302396.db2.gz	AGKSOZYUDNAXNA-UHFFFAOYSA-N	0	3	343.377	3.055	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)COc1ccsc1Cl	ZINC001158587819	1381308558	/nfs/dbraw/zinc/30/85/58/1381308558.db2.gz	LBJIXNGDAWEQFU-CYBMUJFWSA-N	0	3	342.892	3.279	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)C1(F)CCCCC1	ZINC001158704148	1381360606	/nfs/dbraw/zinc/36/06/06/1381360606.db2.gz	DTWFYVUWBCDTCR-QGZVFWFLSA-N	0	3	340.483	3.174	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cnn([C@@H](C)CC)c1C	ZINC001158732153	1381374293	/nfs/dbraw/zinc/37/42/93/1381374293.db2.gz	KZPJHXBRBUVVNX-DOTOQJQBSA-N	0	3	332.492	3.275	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)[C@H](C)C1CCCC1	ZINC001158744292	1381378764	/nfs/dbraw/zinc/37/87/64/1381378764.db2.gz	GSZXZYZXFPKDKA-IEBWSBKVSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)C[C@@H]1OCCc2ccsc21	ZINC001158764349	1381388463	/nfs/dbraw/zinc/38/84/63/1381388463.db2.gz	QNWJVWNVLUEWSZ-SJORKVTESA-N	0	3	348.512	3.251	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)C[C@H]1CCC2(CCC2)CO1	ZINC001158773343	1381393904	/nfs/dbraw/zinc/39/39/04/1381393904.db2.gz	GIAKTPWYZRDFIE-QZTJIDSGSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NCCCNCc1ccncc1Cl	ZINC001158857072	1381437714	/nfs/dbraw/zinc/43/77/14/1381437714.db2.gz	MOCYUNQKHGAGQQ-UHFFFAOYSA-N	0	3	330.259	3.110	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H](OCC)c1ccccc1	ZINC001158943318	1381476753	/nfs/dbraw/zinc/47/67/53/1381476753.db2.gz	VRPHHJDQOSWBCI-MOPGFXCFSA-N	0	3	330.472	3.263	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(F)cc1	ZINC001158966537	1381489255	/nfs/dbraw/zinc/48/92/55/1381489255.db2.gz	KETNXJCSEWCMOL-VQIMIIECSA-N	0	3	348.462	3.230	20	30		EGEDHN
C=Cc1ccc(C(=O)NCC[C@H](C)NCc2ccccc2C#N)cc1	ZINC001328413471	1388740458	/nfs/dbraw/zinc/74/04/58/1388740458.db2.gz	OGBDVAJCKXTZLI-INIZCTEOSA-N	0	3	333.435	3.499	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)CCc1ccc(F)cc1F	ZINC001328429760	1388744325	/nfs/dbraw/zinc/74/43/25/1388744325.db2.gz	WZYNXGRQIKDPQD-LBPRGKRZSA-N	0	3	330.806	3.134	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCC1=CCN(CCc2ccccc2Cl)CC1	ZINC001159595620	1381842109	/nfs/dbraw/zinc/84/21/09/1381842109.db2.gz	ZMRNQSUTWAKUEG-OAHLLOKOSA-N	0	3	345.874	3.181	20	30		EGEDHN
C#CCCCCC(=O)NCCC1=CCN(Cc2cccnc2C)CC1	ZINC001159880462	1381927227	/nfs/dbraw/zinc/92/72/27/1381927227.db2.gz	DWKVZHKEXHHBFC-UHFFFAOYSA-N	0	3	339.483	3.222	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)CO[C@@H]2CCCC[C@@H]2CC)CC1	ZINC001160107343	1381999377	/nfs/dbraw/zinc/99/93/77/1381999377.db2.gz	NMQUMBHPBBBIBI-VQTJNVASSA-N	0	3	346.515	3.134	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CCOc2cccc(C)c2C)CC1	ZINC001160285528	1382060629	/nfs/dbraw/zinc/06/06/29/1382060629.db2.gz	GHHGVSTXFDZAQH-UHFFFAOYSA-N	0	3	342.483	3.397	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CCOc2ccc(C)cc2C)CC1	ZINC001160285154	1382060837	/nfs/dbraw/zinc/06/08/37/1382060837.db2.gz	BZVKBBVGBJYPDQ-UHFFFAOYSA-N	0	3	342.483	3.397	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc(C)nn2C(CC)CC)CC1	ZINC001160580038	1382147743	/nfs/dbraw/zinc/14/77/43/1382147743.db2.gz	FHHBJXWWOBYKON-UHFFFAOYSA-N	0	3	344.503	3.491	20	30		EGEDHN
C=C[C@@H]1C[C@]1(N)C(=O)N1CCC(Cc2c(F)cccc2Cl)CC1	ZINC001160643034	1382159292	/nfs/dbraw/zinc/15/92/92/1382159292.db2.gz	VUNFBDODFTZHIO-FZKQIMNGSA-N	0	3	336.838	3.164	20	30		EGEDHN
C#CC1CCN(C(=O)C[C@@H](N)c2ccc(Cl)cc2Cl)CC1	ZINC001160911545	1382231004	/nfs/dbraw/zinc/23/10/04/1382231004.db2.gz	HDFTVMKLUFAGQQ-OAHLLOKOSA-N	0	3	325.239	3.255	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCC1=CCN(CCc2ccns2)CC1	ZINC001160940875	1382243453	/nfs/dbraw/zinc/24/34/53/1382243453.db2.gz	HFGXRTUVNIGGEJ-HZPDHXFCSA-N	0	3	347.528	3.282	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCC1=CCN(Cc2cccnc2C)CC1	ZINC001160942459	1382246252	/nfs/dbraw/zinc/24/62/52/1382246252.db2.gz	YYKHFMQISSMYMY-IAGOWNOFSA-N	0	3	341.499	3.487	20	30		EGEDHN
C=CCCCC(=O)NCCC1=CCN(Cc2cnccc2C)CC1	ZINC001161056858	1382285730	/nfs/dbraw/zinc/28/57/30/1382285730.db2.gz	RQWOJYHJWULHLZ-UHFFFAOYSA-N	0	3	327.472	3.385	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H](c2cccnc2)C(C)C)CC1	ZINC001161554339	1382438808	/nfs/dbraw/zinc/43/88/08/1382438808.db2.gz	OCJHTWWCRDBIDW-LJQANCHMSA-N	0	3	327.472	3.146	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)CCc2ccc(F)cc2F)CC1	ZINC001161623047	1382463097	/nfs/dbraw/zinc/46/30/97/1382463097.db2.gz	YWKGPBRBLZZLQD-UHFFFAOYSA-N	0	3	346.421	3.059	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc3c(C)cccn3c2)CC1	ZINC001161688031	1382480836	/nfs/dbraw/zinc/48/08/36/1382480836.db2.gz	DQUGEIBEUASDGF-UHFFFAOYSA-N	0	3	335.451	3.023	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H](F)CC2CCCCC2)CC1	ZINC001161723214	1382489764	/nfs/dbraw/zinc/48/97/64/1382489764.db2.gz	NHXVJUQIYWQVPE-IBGZPJMESA-N	0	3	334.479	3.457	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)COc2cc(C)cc(C)c2)CC1	ZINC001161856816	1382533113	/nfs/dbraw/zinc/53/31/13/1382533113.db2.gz	HPWVVSRHNLAGKJ-UHFFFAOYSA-N	0	3	328.456	3.007	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@H](C)c2cccc(F)c2)CC1	ZINC001161908575	1382547917	/nfs/dbraw/zinc/54/79/17/1382547917.db2.gz	OSHJNDCDPAFYTQ-MRXNPFEDSA-N	0	3	328.431	3.091	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@H](CC)c2ccc(F)cc2)CC1	ZINC001161963641	1382573720	/nfs/dbraw/zinc/57/37/20/1382573720.db2.gz	OWOHMHXJVNUCLO-HXUWFJFHSA-N	0	3	342.458	3.481	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@@H](C)CC2CCCC2)(COC)CC1	ZINC001162513389	1382778501	/nfs/dbraw/zinc/77/85/01/1382778501.db2.gz	LAOYGTIIRLSCBN-SFHVURJKSA-N	0	3	348.531	3.071	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CCC(C)=C(C)C1	ZINC001162816876	1382884424	/nfs/dbraw/zinc/88/44/24/1382884424.db2.gz	FUBHJNXSJZJKFC-OAQYLSRUSA-N	0	3	338.495	3.417	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H](C)C(CC)CC	ZINC001162851821	1382895489	/nfs/dbraw/zinc/89/54/89/1382895489.db2.gz	XKVHGAALYATCQH-GOSISDBHSA-N	0	3	328.500	3.353	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CCC[C@@H](C)C1	ZINC001162906303	1382911419	/nfs/dbraw/zinc/91/14/19/1382911419.db2.gz	JDOGZOCSKHNCGJ-UYAOXDASSA-N	0	3	326.484	3.107	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1ccc(C)cc1F	ZINC001162946567	1382923582	/nfs/dbraw/zinc/92/35/82/1382923582.db2.gz	LYBBYOXFGVEHTM-UHFFFAOYSA-N	0	3	338.426	3.042	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@H](C)c1ccccc1	ZINC001162987444	1382939007	/nfs/dbraw/zinc/93/90/07/1382939007.db2.gz	RYNBUHPFMXXXNL-HXUWFJFHSA-N	0	3	348.490	3.474	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H](C)c1ccccc1C	ZINC001163001447	1382943719	/nfs/dbraw/zinc/94/37/19/1382943719.db2.gz	DCARIAIJONGUMQ-HXUWFJFHSA-N	0	3	348.490	3.393	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C[C@@H]1CCCC[C@H]1C	ZINC001163007732	1382947134	/nfs/dbraw/zinc/94/71/34/1382947134.db2.gz	XZIUIIKJDIQLKI-CTNGQTDRSA-N	0	3	340.511	3.497	20	30		EGEDHN
CC(C)(C(=O)NCCCNCc1cc(C#N)ccc1F)C1CCC1	ZINC001163429849	1383050298	/nfs/dbraw/zinc/05/02/98/1383050298.db2.gz	CBFUWABSLBSZNW-UHFFFAOYSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=CCCC(=O)NCCC1(CNCc2oc(CCC)nc2C)CC1	ZINC001163766807	1383120101	/nfs/dbraw/zinc/12/01/01/1383120101.db2.gz	CUSPZDRMDXZRSC-UHFFFAOYSA-N	0	3	333.476	3.278	20	30		EGEDHN
C=CCCC(=O)NCCC1(CNCc2oc(C(C)C)nc2C)CC1	ZINC001163767678	1383120324	/nfs/dbraw/zinc/12/03/24/1383120324.db2.gz	UVRNVMJMLYBGEB-UHFFFAOYSA-N	0	3	333.476	3.449	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1c(C)cc(F)cc1C	ZINC001163778658	1383121175	/nfs/dbraw/zinc/12/11/75/1383121175.db2.gz	ZVIKUELFTMLIBS-UHFFFAOYSA-N	0	3	343.240	3.061	20	30		EGEDHN
Cc1ccc(CN2CC[C@H](Nc3c(C#N)nnc4ccccc43)C2)cc1	ZINC001163968886	1383140942	/nfs/dbraw/zinc/14/09/42/1383140942.db2.gz	WXHGVRJLXYBGBF-KRWDZBQOSA-N	0	3	343.434	3.496	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCCNCc1cc(OC)ccc1Cl	ZINC001164223466	1383168042	/nfs/dbraw/zinc/16/80/42/1383168042.db2.gz	SSCVJSNYKOHJAR-KBPBESRZSA-N	0	3	338.879	3.403	20	30		EGEDHN
CC(C)c1[nH]ccc1C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001164426700	1383185868	/nfs/dbraw/zinc/18/58/68/1383185868.db2.gz	SFOBJMZGRSCMCL-UHFFFAOYSA-N	0	3	342.418	3.059	20	30		EGEDHN
CC/C(C)=C\C(=O)NCCC1(CNCc2ccc(C#N)cc2F)CC1	ZINC001164446611	1383187574	/nfs/dbraw/zinc/18/75/74/1383187574.db2.gz	AGCSNXOIZQHAPL-GDNBJRDFSA-N	0	3	343.446	3.430	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc(C(C)C)nc2)CC1	ZINC001165492116	1383302293	/nfs/dbraw/zinc/30/22/93/1383302293.db2.gz	KLNQKDNDUZUECF-UHFFFAOYSA-N	0	3	335.879	3.447	20	30		EGEDHN
CC[C@H]1CCC[C@H]1C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001166035892	1383379982	/nfs/dbraw/zinc/37/99/82/1383379982.db2.gz	HLDGYQZTRAEKCJ-DOTOQJQBSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2c(C)noc2C2CC2)CC1	ZINC001166211141	1383402721	/nfs/dbraw/zinc/40/27/21/1383402721.db2.gz	HJNPKVYFQGPNOL-UHFFFAOYSA-N	0	3	337.851	3.103	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@H](C)CC(F)(F)F)CC1	ZINC001166341644	1383413095	/nfs/dbraw/zinc/41/30/95/1383413095.db2.gz	JHXJDKYUUWWKAJ-SNVBAGLBSA-N	0	3	326.790	3.204	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1cccc(F)c1Cl	ZINC001167306284	1383591498	/nfs/dbraw/zinc/59/14/98/1383591498.db2.gz	QBKXAIKSFVCVIF-UHFFFAOYSA-N	0	3	349.631	3.097	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCCNCc1ccn(C(CC)CC)n1	ZINC001167363419	1383610435	/nfs/dbraw/zinc/61/04/35/1383610435.db2.gz	XGZZTVJNAAZDPR-UHFFFAOYSA-N	0	3	334.508	3.442	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc3cccnc3c2)CC1	ZINC001167476887	1383646044	/nfs/dbraw/zinc/64/60/44/1383646044.db2.gz	UVSQQKVPGMIOKV-UHFFFAOYSA-N	0	3	343.858	3.477	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C2(c3ccccc3)CC2)CC1	ZINC001167988574	1383788876	/nfs/dbraw/zinc/78/88/76/1383788876.db2.gz	ZXCCADJIGNNSRN-UHFFFAOYSA-N	0	3	332.875	3.347	20	30		EGEDHN
Cc1cc([C@@H](C)C(=O)NCCCNCc2ccccc2C#N)c(C)o1	ZINC001168464247	1383913665	/nfs/dbraw/zinc/91/36/65/1383913665.db2.gz	JYZGVAZEASMKGH-OAHLLOKOSA-N	0	3	339.439	3.168	20	30		EGEDHN
C[C@H](CCCCNCc1cc(F)ccc1C#N)NC(=O)C(C)(C)F	ZINC001168759819	1383995236	/nfs/dbraw/zinc/99/52/36/1383995236.db2.gz	QOERXCWOZIGGLJ-CYBMUJFWSA-N	0	3	337.414	3.210	20	30		EGEDHN
N#CC1(c2ccccc2F)CCN([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1	ZINC001169055900	1384101459	/nfs/dbraw/zinc/10/14/59/1384101459.db2.gz	RACWMHWFFIJBLF-HUUCEWRRSA-N	0	3	331.391	3.128	20	30		EGEDHN
CCOC(=O)[C@@H]1[C@H](C)C[C@@H](C)N(Cc2ccc(C#N)cc2OC)[C@H]1C	ZINC001308154771	1384101647	/nfs/dbraw/zinc/10/16/47/1384101647.db2.gz	DAFXRISZKJHLII-BKEDOTJMSA-N	0	3	344.455	3.365	20	30		EGEDHN
Cn1cc(CNCc2cccn2C(F)F)c(-c2ccc(C#N)cc2)n1	ZINC001308683293	1384142306	/nfs/dbraw/zinc/14/23/06/1384142306.db2.gz	MOBCJCHRCFAUDS-UHFFFAOYSA-N	0	3	341.365	3.445	20	30		EGEDHN
Cc1cc(CN(C)C[C@@H]2CCN2C(=O)OC(C)(C)C)ccc1C#N	ZINC001308955244	1384162281	/nfs/dbraw/zinc/16/22/81/1384162281.db2.gz	QWEBKGRMHNRQEU-KRWDZBQOSA-N	0	3	329.444	3.308	20	30		EGEDHN
C=CCCC(=O)N[C@H](C)CCCCNCc1cc(F)ccc1C#N	ZINC001169704470	1384175353	/nfs/dbraw/zinc/17/53/53/1384175353.db2.gz	BOAGXPJGEZGUGY-OAHLLOKOSA-N	0	3	331.435	3.428	20	30		EGEDHN
C=CCCC(=O)N[C@@H](C)CCCCNCc1nccn1C(F)F	ZINC001169712657	1384176602	/nfs/dbraw/zinc/17/66/02/1384176602.db2.gz	GZQYORNEFFUVBE-ZDUSSCGKSA-N	0	3	328.407	3.009	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@@H]1C[C@]1(CC)C(C)C	ZINC001169729658	1384179344	/nfs/dbraw/zinc/17/93/44/1384179344.db2.gz	NRDISXMRQHQUCG-DZGCQCFKSA-N	0	3	331.298	3.063	20	30		EGEDHN
C[C@H](CCCCNCc1cc(F)ccc1C#N)NC(=O)C1CC=CC1	ZINC001169926695	1384199560	/nfs/dbraw/zinc/19/95/60/1384199560.db2.gz	AOIKSHPDCSVVAV-OAHLLOKOSA-N	0	3	343.446	3.428	20	30		EGEDHN
CC1(C)CC(=O)C=C(Nc2cccc3cc([C@H]4CNCCO4)cn32)C1	ZINC001169953091	1384203263	/nfs/dbraw/zinc/20/32/63/1384203263.db2.gz	MQFWLOAIKOJANM-GOSISDBHSA-N	0	3	339.439	3.285	20	30		EGEDHN
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@@H]1NCc1cc(C#N)ccn1	ZINC001170050747	1384225322	/nfs/dbraw/zinc/22/53/22/1384225322.db2.gz	CWCYGUWYORDFCD-JKIFEVAISA-N	0	3	344.459	3.077	20	30		EGEDHN
N#Cc1ccc(CCN2CCCC[C@H]2COC(=O)N2CCCC2)cc1	ZINC001170141842	1384246559	/nfs/dbraw/zinc/24/65/59/1384246559.db2.gz	WJOUMMGMWBGTGA-IBGZPJMESA-N	0	3	341.455	3.188	20	30		EGEDHN
CS[C@H](C)CC(=O)N[C@@H](C)CCCCNCc1ccccc1C#N	ZINC001170230195	1384271365	/nfs/dbraw/zinc/27/13/65/1384271365.db2.gz	ACTTXVDUXOGMSB-JKSUJKDBSA-N	0	3	347.528	3.464	20	30		EGEDHN
COc1ccc(C[C@H](C)N2[C@@H]3CC[C@H]2C[C@H](C#N)C3)c([N+](=O)[O-])c1	ZINC001170350870	1384298422	/nfs/dbraw/zinc/29/84/22/1384298422.db2.gz	CKSAFWQXOQJBJL-DARAHFNDSA-N	0	3	329.400	3.301	20	30		EGEDHN
Cc1nc(CNCCCC[C@@H](C)NC(=O)C#CC(C)C)c(C)s1	ZINC001170647629	1384356256	/nfs/dbraw/zinc/35/62/56/1384356256.db2.gz	HJYWZFPHNGYYTL-CQSZACIVSA-N	0	3	335.517	3.184	20	30		EGEDHN
CC(C)n1ccc(CNCCCC[C@@H](C)NC(=O)C#CC(C)(C)C)n1	ZINC001170694227	1384367253	/nfs/dbraw/zinc/36/72/53/1384367253.db2.gz	VPKKLRIXXSGLOP-QGZVFWFLSA-N	0	3	346.519	3.278	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@H](F)CCCCCC	ZINC001171153597	1384456503	/nfs/dbraw/zinc/45/65/03/1384456503.db2.gz	ULPIVPYGYSJYOX-CYBMUJFWSA-N	0	3	337.277	3.299	20	30		EGEDHN
N=C(Nc1ccc(Cn2cncn2)cc1)c1ccc2cc(O)ccc2c1	ZINC001171184633	1384463245	/nfs/dbraw/zinc/46/32/45/1384463245.db2.gz	OLZOGSUPKPINRS-UHFFFAOYSA-N	0	3	343.390	3.222	20	30		EGEDHN
C[C@@H](Cc1cccc(C#N)c1)N1CC(CN(C)C(=O)OC(C)(C)C)C1	ZINC001171208545	1384468968	/nfs/dbraw/zinc/46/89/68/1384468968.db2.gz	DEFMZXIGABHHKD-HNNXBMFYSA-N	0	3	343.471	3.288	20	30		EGEDHN
C[C@@H](Cc1cccc(C#N)c1)N1C[C@@H](C)[C@@H](NC(=O)OC(C)(C)C)C1	ZINC001171227801	1384474107	/nfs/dbraw/zinc/47/41/07/1384474107.db2.gz	AKECPYPEHBLMQO-VKJFTORMSA-N	0	3	343.471	3.334	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H](C)CCCCNCc1cc(C)no1	ZINC001171259954	1384481143	/nfs/dbraw/zinc/48/11/43/1384481143.db2.gz	BTBHYSSDOJEOEY-HNNXBMFYSA-N	0	3	344.459	3.049	20	30		EGEDHN
CCC[C@H](C)C(=O)NC[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001316628346	1384492654	/nfs/dbraw/zinc/49/26/54/1384492654.db2.gz	KTGNXKJNNPFBOB-QRTARXTBSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)C[C@H](C)c2c(C)noc2C)C1	ZINC001316633926	1384496267	/nfs/dbraw/zinc/49/62/67/1384496267.db2.gz	VWCOCPMHNFPFMN-LKTVYLICSA-N	0	3	339.867	3.022	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1cccc(CC)n1	ZINC001316878732	1384663204	/nfs/dbraw/zinc/66/32/04/1384663204.db2.gz	WFONRLYBAQXUTF-YOEHRIQHSA-N	0	3	335.879	3.369	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CCN(CCCc2ccccc2OC)C1	ZINC001316986823	1384742472	/nfs/dbraw/zinc/74/24/72/1384742472.db2.gz	RSJPEVXZRIRKHC-LJQANCHMSA-N	0	3	342.483	3.012	20	30		EGEDHN
COc1cccc(N2CCN([C@@H](C)Cc3ccc(C#N)cc3)CC2)c1	ZINC001172308251	1384765506	/nfs/dbraw/zinc/76/55/06/1384765506.db2.gz	JJVLVAKQSGLZJT-KRWDZBQOSA-N	0	3	335.451	3.320	20	30		EGEDHN
C[C@H](CCCC#N)N1CCO[C@@]2(CCCN(c3ccccc3)C2)C1	ZINC001172494656	1384803969	/nfs/dbraw/zinc/80/39/69/1384803969.db2.gz	IKQHBRYYZPNCGV-QUCCMNQESA-N	0	3	327.472	3.440	20	30		EGEDHN
C[C@H](CCCC#N)N1CCO[C@@H]2[C@@H](COCc3nccs3)CC[C@H]21	ZINC001172500240	1384806820	/nfs/dbraw/zinc/80/68/20/1384806820.db2.gz	YCEBHIDJVNEZSZ-YFHUEUNASA-N	0	3	349.500	3.221	20	30		EGEDHN
C[C@H](CCCC#N)N1CCC(c2cccc(S(C)(=O)=O)c2)CC1	ZINC001172510210	1384807576	/nfs/dbraw/zinc/80/75/76/1384807576.db2.gz	XJGUXHCCVMUUKY-OAHLLOKOSA-N	0	3	334.485	3.352	20	30		EGEDHN
COc1ccc(CN[C@@H]2CCN(C(=O)OC(C)(C)C)[C@H](C#N)C2)cc1	ZINC001172971273	1384892784	/nfs/dbraw/zinc/89/27/84/1384892784.db2.gz	NVSHVOGXSPEQFL-CVEARBPZSA-N	0	3	345.443	3.076	20	30		EGEDHN
C[C@@H]1CC[C@H](NCC#Cc2ccccc2)CN1C(=O)OC(C)(C)C	ZINC001173061765	1384904144	/nfs/dbraw/zinc/90/41/44/1384904144.db2.gz	GWPXPKUZCHSACI-AEFFLSMTSA-N	0	3	328.456	3.416	20	30		EGEDHN
C=CCOC1CCC(n2nc(C(F)(F)F)c3c2CNCC3)CC1	ZINC001173322699	1384958377	/nfs/dbraw/zinc/95/83/77/1384958377.db2.gz	JBMVIWPLEVGTLW-UHFFFAOYSA-N	0	3	329.366	3.234	20	30		EGEDHN
CCCCC(=O)N[C@H](C)[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001317202844	1384981122	/nfs/dbraw/zinc/98/11/22/1384981122.db2.gz	WJEJARDRXHWPHX-APWZRJJASA-N	0	3	327.472	3.465	20	30		EGEDHN
COC(=O)c1ccc(C[C@H](C)NC(=N)c2ccc3ccccc3n2)cc1	ZINC001173717073	1385008357	/nfs/dbraw/zinc/00/83/57/1385008357.db2.gz	LBXIKEGWAZTJSF-AWEZNQCLSA-N	0	3	347.418	3.358	20	30		EGEDHN
CCOC(=O)[C@@H]1CCCc2sc(Nc3ccncc3C)c(C#N)c21	ZINC001174537111	1385117567	/nfs/dbraw/zinc/11/75/67/1385117567.db2.gz	XDJDDGBOBMJUBK-GFCCVEGCSA-N	0	3	341.436	3.472	20	30		EGEDHN
C=CCCCC(=O)N[C@H](C)CCCCN[C@@H](C)c1nnc(CC)[nH]1	ZINC001174979379	1385177800	/nfs/dbraw/zinc/17/78/00/1385177800.db2.gz	YPTXJROQVJKPGX-CABCVRRESA-N	0	3	335.496	3.049	20	30		EGEDHN
C=CCCCC(=O)N[C@@H](C)CCCCN[C@@H](C)c1nnc(CC)[nH]1	ZINC001174979380	1385177842	/nfs/dbraw/zinc/17/78/42/1385177842.db2.gz	YPTXJROQVJKPGX-GJZGRUSLSA-N	0	3	335.496	3.049	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)Cc1ccc(Cl)cc1	ZINC001175026902	1385183683	/nfs/dbraw/zinc/18/36/83/1385183683.db2.gz	JDESCOOPVRWKKK-UHFFFAOYSA-N	0	3	341.842	3.050	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](C)CCCCNCc2cnns2)CC1	ZINC001175074446	1385190109	/nfs/dbraw/zinc/19/01/09/1385190109.db2.gz	RZGDRWMMNSOEAT-CQSZACIVSA-N	0	3	336.505	3.049	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H](C)CCCCNCc1nnc(C(C)C)[nH]1	ZINC001175468558	1385301097	/nfs/dbraw/zinc/30/10/97/1385301097.db2.gz	HGFQNPIENQWTGN-OAHLLOKOSA-N	0	3	349.523	3.295	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H](C)CCCCNCc1cc2n(n1)CCC2	ZINC001175468615	1385301241	/nfs/dbraw/zinc/30/12/41/1385301241.db2.gz	IFBTVROHGLTQPA-INIZCTEOSA-N	0	3	346.519	3.196	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCN(C/C=C\c1ccc(Cl)cc1)C1CC1	ZINC001317549371	1385305060	/nfs/dbraw/zinc/30/50/60/1385305060.db2.gz	RXMLJMCCEQOARV-PYLYLYNFSA-N	0	3	331.847	3.093	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CCCN(CCC[C@@H](C)O)C2)CCCCC1	ZINC001317955010	1385585326	/nfs/dbraw/zinc/58/53/26/1385585326.db2.gz	AWEYBETWMKVOMK-QZTJIDSGSA-N	0	3	336.520	3.255	20	30		EGEDHN
C=CC1(CC(=O)N[C@H]2CCN(CCOC3CCC3)C2)CCCCC1	ZINC001318283412	1385641537	/nfs/dbraw/zinc/64/15/37/1385641537.db2.gz	ADCXAYCMVJGQAB-KRWDZBQOSA-N	0	3	334.504	3.273	20	30		EGEDHN
C=C[C@@H](CC(=O)NCCCNCc1nc(C)cs1)c1ccccc1	ZINC001176762521	1385688044	/nfs/dbraw/zinc/68/80/44/1385688044.db2.gz	FCWKTVCNBCNVSZ-INIZCTEOSA-N	0	3	343.496	3.407	20	30		EGEDHN
C=CCCOCC(=O)N[C@H](C)CCCCNC/C(Cl)=C\Cl	ZINC001176801699	1385706166	/nfs/dbraw/zinc/70/61/66/1385706166.db2.gz	PRJZSTWQXBJOJV-PCRWRXJSSA-N	0	3	337.291	3.163	20	30		EGEDHN
CCc1ccsc1C(=O)NCCCNCc1ccccc1C#N	ZINC001176838711	1385720112	/nfs/dbraw/zinc/72/01/12/1385720112.db2.gz	DSEFMKLNVSPUQP-UHFFFAOYSA-N	0	3	327.453	3.092	20	30		EGEDHN
Cc1ccc2[nH]cc(C(=O)NCCCNCc3ccccc3C#N)c2c1	ZINC001177103516	1385813809	/nfs/dbraw/zinc/81/38/09/1385813809.db2.gz	KBHJOVCVRPTDID-UHFFFAOYSA-N	0	3	346.434	3.258	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2cc3ccccn3c2)CCCC1	ZINC001318656628	1385820607	/nfs/dbraw/zinc/82/06/07/1385820607.db2.gz	XGLJAFJCDZZRGF-UHFFFAOYSA-N	0	3	331.847	3.324	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)c2ccc(CF)cc2)c(F)c1	ZINC001177169261	1385842617	/nfs/dbraw/zinc/84/26/17/1385842617.db2.gz	HDYUSHQOIBPPBP-UHFFFAOYSA-N	0	3	343.377	3.077	20	30		EGEDHN
C=C(Br)CNC[C@](C)(NC(=O)CCC1CCC1)C1CC1	ZINC001318689661	1385842702	/nfs/dbraw/zinc/84/27/02/1385842702.db2.gz	MIJARJUXCKXVIU-INIZCTEOSA-N	0	3	343.309	3.350	20	30		EGEDHN
CC(=O)N(CCCNCc1ccc(C#N)cc1F)CC1CCCC1	ZINC001177174366	1385845315	/nfs/dbraw/zinc/84/53/15/1385845315.db2.gz	HXFSSVDUCXWNQZ-UHFFFAOYSA-N	0	3	331.435	3.216	20	30		EGEDHN
C#CCC1(C(=O)NCCCNCc2cc(C3CC3)no2)CCCCC1	ZINC001177223778	1385874062	/nfs/dbraw/zinc/87/40/62/1385874062.db2.gz	GDXJZRIQZRTTDA-UHFFFAOYSA-N	0	3	343.471	3.122	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)C[C@H](C)OC	ZINC001177241968	1385881537	/nfs/dbraw/zinc/88/15/37/1385881537.db2.gz	CAVYOLCHPHTQLD-HNNXBMFYSA-N	0	3	330.900	3.162	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)c1cc(C#N)c[nH]1	ZINC001177278897	1385895121	/nfs/dbraw/zinc/89/51/21/1385895121.db2.gz	MGQAOURGVAQIRN-UHFFFAOYSA-N	0	3	348.878	3.251	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)c1conc1C	ZINC001177402827	1385943964	/nfs/dbraw/zinc/94/39/64/1385943964.db2.gz	XHMPJXQTZCMCTD-UHFFFAOYSA-N	0	3	339.867	3.348	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@H]1CCO[C@H]1C	ZINC001177448655	1385959848	/nfs/dbraw/zinc/95/98/48/1385959848.db2.gz	QJLREXZNJKCHFG-RDJZCZTQSA-N	0	3	342.911	3.162	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)C[C@H](C)COC	ZINC001177455854	1385962596	/nfs/dbraw/zinc/96/25/96/1385962596.db2.gz	KSZALIDPIPDPLP-HNNXBMFYSA-N	0	3	344.927	3.410	20	30		EGEDHN
O=C(CCc1ccccc1)N1CCC[C@@H]1CNCC#Cc1ccccc1	ZINC001319125170	1385968536	/nfs/dbraw/zinc/96/85/36/1385968536.db2.gz	CNCLFWATHTVLGK-JOCHJYFZSA-N	0	3	346.474	3.252	20	30		EGEDHN
C=CCC1(C(=O)NCCCNCc2ccncc2Cl)CCCC1	ZINC001177552424	1385995397	/nfs/dbraw/zinc/99/53/97/1385995397.db2.gz	FICSBXWXZYQUPK-UHFFFAOYSA-N	0	3	335.879	3.467	20	30		EGEDHN
Cc1cccc(C(=O)N(C)[C@H](C)CNCc2ccc(F)c(C#N)c2)c1	ZINC001319416975	1386111850	/nfs/dbraw/zinc/11/18/50/1386111850.db2.gz	BXUOJNASAFPSHQ-OAHLLOKOSA-N	0	3	339.414	3.256	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCCCCCNCc1c(F)cccc1Cl	ZINC001178049368	1386115733	/nfs/dbraw/zinc/11/57/33/1386115733.db2.gz	AJKZRLBYJJRGLX-ZDUSSCGKSA-N	0	3	339.842	3.405	20	30		EGEDHN
N#Cc1c[nH]c(C(=O)NCCCCCCNC/C(Cl)=C\Cl)c1	ZINC001178134848	1386138335	/nfs/dbraw/zinc/13/83/35/1386138335.db2.gz	YSTDTFAMSWIXMJ-MDWZMJQESA-N	0	3	343.258	3.085	20	30		EGEDHN
CCC[C@@H](C)CC(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C	ZINC001178315736	1386187097	/nfs/dbraw/zinc/18/70/97/1386187097.db2.gz	MNAYIHIKXADYIP-HBFSDRIKSA-N	0	3	326.484	3.443	20	30		EGEDHN
CCC[C@H](C)C(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)[C@@H]1C	ZINC001178375698	1386199833	/nfs/dbraw/zinc/19/98/33/1386199833.db2.gz	NYPCGKVYBFEURN-DEYYWGMASA-N	0	3	331.435	3.213	20	30		EGEDHN
CC(C)C[C@H](CNCc1ccc(C#N)s1)NC(=O)c1cc(F)c[nH]1	ZINC001319617642	1386210842	/nfs/dbraw/zinc/21/08/42/1386210842.db2.gz	BWZLVISBVJDSOV-CYBMUJFWSA-N	0	3	348.447	3.021	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccc(Cl)cc2)CCN1C(=O)C=C1CCC1	ZINC001178451426	1386221839	/nfs/dbraw/zinc/22/18/39/1386221839.db2.gz	BHCVTHZRBKQPCH-KXBFYZLASA-N	0	3	342.870	3.381	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cc(-c2ccccc2)no1)C(C)C	ZINC001319921416	1386392836	/nfs/dbraw/zinc/39/28/36/1386392836.db2.gz	GNEPASCCGWFGMZ-MRXNPFEDSA-N	0	3	347.846	3.438	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCCCCCNCc1cc2n(n1)CCCC2	ZINC001179235541	1386429086	/nfs/dbraw/zinc/42/90/86/1386429086.db2.gz	TYVCIFZLLBRJBE-UHFFFAOYSA-N	0	3	346.519	3.198	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCCCCCNCc1ccn(CC)n1	ZINC001179306328	1386445358	/nfs/dbraw/zinc/44/53/58/1386445358.db2.gz	HDJIAEKLMJXEQP-IRXDYDNUSA-N	0	3	334.508	3.127	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCCCCCNCc1nccn1CC	ZINC001179307044	1386445879	/nfs/dbraw/zinc/44/58/79/1386445879.db2.gz	PMFTYZQFXUDZRR-IAGOWNOFSA-N	0	3	334.508	3.127	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](NCC=C(Cl)Cl)[C@@H]1C	ZINC001179313350	1386447294	/nfs/dbraw/zinc/44/72/94/1386447294.db2.gz	AUVKWRQQZUEESF-KBPBESRZSA-N	0	3	331.287	3.468	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCCCCCCN[C@H](C)c1nnc(CC)[nH]1	ZINC001179339503	1386455693	/nfs/dbraw/zinc/45/56/93/1386455693.db2.gz	FYXNRUKUVILKIX-CVEARBPZSA-N	0	3	349.523	3.297	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C)c1ccco1	ZINC001179530328	1386507665	/nfs/dbraw/zinc/50/76/65/1386507665.db2.gz	VTZWAFFWLBDQLG-AOIWGVFYSA-N	0	3	336.435	3.014	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@@H]1C	ZINC001179639947	1386538213	/nfs/dbraw/zinc/53/82/13/1386538213.db2.gz	WLNVLCYYHLYNPC-BXWFABGCSA-N	0	3	330.447	3.048	20	30		EGEDHN
CC(C)=CC(=O)N1C[C@@H](C)[C@](C)(CNCc2cc(F)ccc2C#N)C1	ZINC001180482205	1386810961	/nfs/dbraw/zinc/81/09/61/1386810961.db2.gz	JQRULTJCIYGZDJ-FOIQADDNSA-N	0	3	343.446	3.238	20	30		EGEDHN
C=CCC1(C(=O)NCCCCCCNCc2nccn2C)CCCC1	ZINC001180515410	1386820844	/nfs/dbraw/zinc/82/08/44/1386820844.db2.gz	PDXMWUPFLDLCJC-UHFFFAOYSA-N	0	3	346.519	3.323	20	30		EGEDHN
COc1ccc(C#N)cc1CNC[C@H](C)NC(=O)CCC1CCCC1	ZINC001321779137	1386982479	/nfs/dbraw/zinc/98/24/79/1386982479.db2.gz	MICMNBNKVWSPNP-HNNXBMFYSA-N	0	3	343.471	3.132	20	30		EGEDHN
C[C@@H]1CN(C(=O)C#CC(C)(C)C)C[C@@]1(C)CNC/C(Cl)=C/Cl	ZINC001181420052	1386991795	/nfs/dbraw/zinc/99/17/95/1386991795.db2.gz	ZRPNNDGLEABHCV-XMKAFAQYSA-N	0	3	345.314	3.429	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](NCc2cc(C(C)C)ccc2OC)C1	ZINC001181535222	1387011887	/nfs/dbraw/zinc/01/18/87/1387011887.db2.gz	OZULDNSEFCIYQN-GOSISDBHSA-N	0	3	330.472	3.475	20	30		EGEDHN
C[C@@H](CNCc1ccc(F)c(C#N)c1)NC(=O)c1cccc(Cl)c1	ZINC001322054713	1387040829	/nfs/dbraw/zinc/04/08/29/1387040829.db2.gz	SKUGMAURQBWFIK-LBPRGKRZSA-N	0	3	345.805	3.259	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@@H](C)[C@](C)(CNCc2ccn(CC)n2)C1	ZINC001182313302	1387145291	/nfs/dbraw/zinc/14/52/91/1387145291.db2.gz	AVSAOHMHKQOVQL-FUHIMQAGSA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H](C)[C@](C)(CNCc3cnc(C)o3)C2)CC1	ZINC001182500575	1387178355	/nfs/dbraw/zinc/17/83/55/1387178355.db2.gz	YTOKUWSXWGGNTB-FOIQADDNSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN1CCN(C(C)(C)C)CC1	ZINC001322762961	1387234945	/nfs/dbraw/zinc/23/49/45/1387234945.db2.gz	XQGAHDQGRQAHCZ-UHFFFAOYSA-N	0	3	347.528	3.319	20	30		EGEDHN
COC[C@H](C)Oc1ccc(CNCc2cccc(OCC#N)c2)cc1	ZINC001329543130	1389150221	/nfs/dbraw/zinc/15/02/21/1389150221.db2.gz	KCBZSJPNZXIMOB-INIZCTEOSA-N	0	3	340.423	3.292	20	30		EGEDHN
O[C@H](CNCC#Cc1ccc(C(F)(F)F)cc1)Cc1ccccc1	ZINC001336801675	1389172155	/nfs/dbraw/zinc/17/21/55/1389172155.db2.gz	ZJOBLECTYGJACZ-SFHVURJKSA-N	0	3	333.353	3.250	20	30		EGEDHN
C=CCN1CCC(Nc2nnc(-c3ccc(Cl)cc3)n2C)CC1	ZINC001337850678	1389459691	/nfs/dbraw/zinc/45/96/91/1389459691.db2.gz	CUUXAETVOHUDRR-UHFFFAOYSA-N	0	3	331.851	3.198	20	30		EGEDHN
C=C(Cl)CNC[C@@H](C1CC1)N(C)C(=O)c1cccc2nc(C)[nH]c21	ZINC001331347865	1389712453	/nfs/dbraw/zinc/71/24/53/1389712453.db2.gz	PGCYIQOJBQRBIU-INIZCTEOSA-N	0	3	346.862	3.064	20	30		EGEDHN
COc1ccc(CN[C@@H](C)CN(C)C(=O)C2(C)CCCC2)cc1C#N	ZINC001331520530	1389781430	/nfs/dbraw/zinc/78/14/30/1389781430.db2.gz	UAOMSNPOWVKSRT-HNNXBMFYSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=CCn1c(-c2ccsc2)nnc1N1CCN(C2CCCC2)CC1	ZINC001339406132	1390019480	/nfs/dbraw/zinc/01/94/80/1390019480.db2.gz	HHIKOPIYPJWGAK-UHFFFAOYSA-N	0	3	343.500	3.257	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccccc1OC[C@H]1CCCCO1	ZINC001341493938	1390494103	/nfs/dbraw/zinc/49/41/03/1390494103.db2.gz	VDNRUUUIDFCEOV-HZPDHXFCSA-N	0	3	332.444	3.257	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)NCc1ccc(C)cc1OCC(F)(F)F	ZINC001341496226	1390494240	/nfs/dbraw/zinc/49/42/40/1390494240.db2.gz	IUMQOXCQQBSNKA-AWEZNQCLSA-N	0	3	344.377	3.236	20	30		EGEDHN
C[C@@H](CNCc1ccccc1C#N)CNC(=O)c1coc2ccccc21	ZINC001698778780	1406445364	/nfs/dbraw/zinc/44/53/64/1406445364.db2.gz	KWRBXRPQVXKXNE-HNNXBMFYSA-N	0	3	347.418	3.460	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)[C@@H](C)OC1CCCCC1	ZINC001341886223	1390544661	/nfs/dbraw/zinc/54/46/61/1390544661.db2.gz	QHRLTKRHWZHYCQ-UKRRQHHQSA-N	0	3	344.411	3.080	20	30		EGEDHN
N#CC(C(=O)[C@H]1[C@H]2[C@@H]1[C@@H]1CC[C@H]2C1)c1nccn1Cc1ccccc1	ZINC001342164185	1390580439	/nfs/dbraw/zinc/58/04/39/1390580439.db2.gz	GHJFSKGYGFCHBC-WXJALIKYSA-N	0	3	331.419	3.400	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CCCN(C)C2)nnc1N1CC[C@@H](C)C[C@H]1C	ZINC001342246241	1390590836	/nfs/dbraw/zinc/59/08/36/1390590836.db2.gz	ABAJXOPZYYUQKP-ZACQAIPSSA-N	0	3	331.508	3.288	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)Nc1ccc2oc(=O)n(C)c2c1	ZINC001343234709	1390701290	/nfs/dbraw/zinc/70/12/90/1390701290.db2.gz	UIPAYIRIRYSGIA-AWEZNQCLSA-N	0	3	333.432	3.148	20	30		EGEDHN
CC(C)N1CCC[C@H]1C(=O)C(C#N)c1nc2cc(F)ccc2s1	ZINC001343273378	1390703948	/nfs/dbraw/zinc/70/39/48/1390703948.db2.gz	HIRFRORVMYSUTB-JSGCOSHPSA-N	0	3	331.416	3.484	20	30		EGEDHN
C=C(C)Cn1c([C@@H](C)SC)nnc1N1CCN(CC(C)C)CC1	ZINC001343668770	1390729887	/nfs/dbraw/zinc/72/98/87/1390729887.db2.gz	LJESLGWWHLCZNT-OAHLLOKOSA-N	0	3	337.537	3.056	20	30		EGEDHN
CC1(C(=O)OCC#Cc2ccccn2)CCN(Cc2ccccc2)CC1	ZINC001343686087	1390731065	/nfs/dbraw/zinc/73/10/65/1390731065.db2.gz	WQJJILPIDZCBPL-UHFFFAOYSA-N	0	3	348.446	3.279	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc(OC)cc1Br	ZINC001343855431	1390740269	/nfs/dbraw/zinc/74/02/69/1390740269.db2.gz	YFDZQUSKPFBZJP-LBPRGKRZSA-N	0	3	327.222	3.080	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CCCN(C)C2)nnc1N1CCCC[C@H](C)C1	ZINC001346670705	1390968543	/nfs/dbraw/zinc/96/85/43/1390968543.db2.gz	NGRFDCJSDQWVNL-IRXDYDNUSA-N	0	3	331.508	3.290	20	30		EGEDHN
N#CCOc1ccc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)cc1	ZINC001349499254	1391335734	/nfs/dbraw/zinc/33/57/34/1391335734.db2.gz	SWYGJGGEVABFDB-KBPBESRZSA-N	0	3	342.317	3.275	20	30		EGEDHN
CCn1c(CCCCC#N)nnc1N1CCN(CCC(C)(C)C)CC1	ZINC001352419302	1391795025	/nfs/dbraw/zinc/79/50/25/1391795025.db2.gz	FSMFUZDSLZXDBV-UHFFFAOYSA-N	0	3	346.523	3.093	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1ccn(C(F)F)n1	ZINC001479820736	1392411052	/nfs/dbraw/zinc/41/10/52/1392411052.db2.gz	CRIYCGKXBHMRCM-AAEUAGOBSA-N	0	3	346.809	3.004	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1cc(C2CC2)n[nH]1	ZINC001479829011	1392416006	/nfs/dbraw/zinc/41/60/06/1392416006.db2.gz	ICWDQBYTMRXOSG-LRDDRELGSA-N	0	3	336.867	3.012	20	30		EGEDHN
CCCc1occc1C(=O)NC[C@H](C)NCc1ccc(F)c(C#N)c1	ZINC001480573116	1392797160	/nfs/dbraw/zinc/79/71/60/1392797160.db2.gz	YSYWICGYMQBSIT-ZDUSSCGKSA-N	0	3	343.402	3.151	20	30		EGEDHN
C[C@@H](CNC(=O)C1(C(F)F)CCCC1)NCc1ccc(C#N)s1	ZINC001491560348	1394516723	/nfs/dbraw/zinc/51/67/23/1394516723.db2.gz	PKEHEVDGHFIQNE-NSHDSACASA-N	0	3	341.427	3.040	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cn(C(C)(C)C)nc1C)C(C)C	ZINC001698961364	1406714947	/nfs/dbraw/zinc/71/49/47/1406714947.db2.gz	LEIBWBPINQFSAW-HNNXBMFYSA-N	0	3	340.899	3.043	20	30		EGEDHN
C[C@@H](CNCc1ccccc1C#N)CNC(=O)C1(F)CCCCC1	ZINC001482155182	1394773661	/nfs/dbraw/zinc/77/36/61/1394773661.db2.gz	DEEOXGYBPOQHKU-HNNXBMFYSA-N	0	3	331.435	3.073	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)[C@H](C)CCC)CCCC1	ZINC001482213180	1394806911	/nfs/dbraw/zinc/80/69/11/1394806911.db2.gz	FQDKHIFMRBYYEM-GFCCVEGCSA-N	0	3	331.298	3.350	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)C[C@@H](C)c2ccncc2)CCCC1	ZINC001482221724	1394815280	/nfs/dbraw/zinc/81/52/80/1394815280.db2.gz	DMNSUQUQUNSVPH-CQSZACIVSA-N	0	3	335.879	3.346	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)COc1ccccc1Cl)C(C)C	ZINC001698977464	1406749405	/nfs/dbraw/zinc/74/94/05/1406749405.db2.gz	PYXSAIKYNVMZGN-CQSZACIVSA-N	0	3	345.270	3.202	20	30		EGEDHN
Cc1ccc(C(=O)N(C)C[C@H](C)NCc2ccc(C#N)s2)c(C)c1	ZINC001485951696	1396172925	/nfs/dbraw/zinc/17/29/25/1396172925.db2.gz	MUUTZOHYXGIYAQ-HNNXBMFYSA-N	0	3	341.480	3.487	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)C(C)(C)C(F)F)CCN1Cc1ccc(C#N)cc1	ZINC001502989854	1396238461	/nfs/dbraw/zinc/23/84/61/1396238461.db2.gz	QNYUYQTVJPKWLM-CJNGLKHVSA-N	0	3	349.425	3.319	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccc3c(c2)COC3)CCCC1	ZINC001495947002	1396573625	/nfs/dbraw/zinc/57/36/25/1396573625.db2.gz	CFBBRSDPBBDRHC-UHFFFAOYSA-N	0	3	334.847	3.102	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)CCc1cncc(C)c1	ZINC001689905687	1404199130	/nfs/dbraw/zinc/19/91/30/1404199130.db2.gz	OYPDMOKZTYNRQR-WMZOPIPTSA-N	0	3	349.906	3.434	20	30		EGEDHN
CCCC[C@H](C)C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2OC)C1	ZINC001690274148	1404440883	/nfs/dbraw/zinc/44/08/83/1404440883.db2.gz	HAYXRNTUCCHGPW-WBAXXEDZSA-N	0	3	343.471	3.130	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)Cc2c[nH]c3cccc(C)c23)C1	ZINC001691475913	1405292884	/nfs/dbraw/zinc/29/28/84/1405292884.db2.gz	LPJCDACHXHETTG-FZNQNYSPSA-N	0	3	345.874	3.256	20	30		EGEDHN
Cc1cocc1C(=O)NCC[C@@H]1CCN(Cc2ccccc2C#N)C1	ZINC001732053343	1428294963	/nfs/dbraw/zinc/29/49/63/1428294963.db2.gz	MVGDBRCOMRCWRA-MRXNPFEDSA-N	0	3	337.423	3.102	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2csnc2C)CCCC[C@@H]1C	ZINC001732262356	1428502589	/nfs/dbraw/zinc/50/25/89/1428502589.db2.gz	VHXAVVDCGQPSKV-MEDUHNTESA-N	0	3	341.908	3.472	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)NCc1ccc(CNCC#Cc2ccccc2)cc1	ZINC001732318129	1428528702	/nfs/dbraw/zinc/52/87/02/1428528702.db2.gz	UMWHMGZFTGRCAQ-DYESRHJHSA-N	0	3	332.447	3.100	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cccnc2C2CC2)CCCC1	ZINC001732393499	1428561841	/nfs/dbraw/zinc/56/18/41/1428561841.db2.gz	RSDLIFXVPCNKAZ-UHFFFAOYSA-N	0	3	333.863	3.344	20	30		EGEDHN
C[C@@H](CN(C)Cc1cccc(C(F)F)c1)NC(=O)c1cc(C#N)c[nH]1	ZINC001699441295	1412769594	/nfs/dbraw/zinc/76/95/94/1412769594.db2.gz	JFRNWJXEBQGMLO-LBPRGKRZSA-N	0	3	346.381	3.074	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cc(F)cc2cccnc21)C(C)C	ZINC001732568897	1428763005	/nfs/dbraw/zinc/76/30/05/1428763005.db2.gz	SRHVPFCXUHGAHA-INIZCTEOSA-N	0	3	349.837	3.470	20	30		EGEDHN
C[C@@H](C#N)C(=O)N(C)CCN(C)C1c2ccccc2-c2ccccc21	ZINC001732574888	1428773865	/nfs/dbraw/zinc/77/38/65/1428773865.db2.gz	CPTHYGRXXJXNQN-HNNXBMFYSA-N	0	3	333.435	3.306	20	30		EGEDHN
C[C@H](CN(C)C(=O)C1CC2(CCC2)C1)NCc1ccc(F)c(C#N)c1	ZINC001700764719	1414438136	/nfs/dbraw/zinc/43/81/36/1414438136.db2.gz	JFLLJRBXLRUWAA-CQSZACIVSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@H](CN(C)Cc1cccc(C#N)c1)NC(=O)c1ccoc1C1CC1	ZINC001733050866	1429188516	/nfs/dbraw/zinc/18/85/16/1429188516.db2.gz	UVUCKSZUIDWRNB-CQSZACIVSA-N	0	3	337.423	3.279	20	30		EGEDHN
Cc1ccccc1CC(=O)N[C@@H](C)CN(C)Cc1ccc(C#N)cc1	ZINC001733060830	1429208814	/nfs/dbraw/zinc/20/88/14/1429208814.db2.gz	BNIWFHGYTYHGLS-KRWDZBQOSA-N	0	3	335.451	3.046	20	30		EGEDHN
CCCC1(C(=O)N2CC[C@H](CN(C)Cc3ccc(C#N)s3)C2)CC1	ZINC001713755809	1418559662	/nfs/dbraw/zinc/55/96/62/1418559662.db2.gz	IDMVONXQZKNDRF-OAHLLOKOSA-N	0	3	345.512	3.480	20	30		EGEDHN
CCCCCCCN1CC[C@@H](NC(=O)c2cc(C(F)F)ncn2)C1	ZINC001713825610	1418626020	/nfs/dbraw/zinc/62/60/20/1418626020.db2.gz	NWQVGZDNHGGZLH-CYBMUJFWSA-N	0	3	340.418	3.189	20	30		EGEDHN
N#Cc1ccc(CN[C@@H](CNC(=O)CCC2CCC2)C2CC2)s1	ZINC001713864394	1418661548	/nfs/dbraw/zinc/66/15/48/1418661548.db2.gz	NDTXKLPOOYXPNS-KRWDZBQOSA-N	0	3	331.485	3.184	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)CCCC2CCCC2)C1	ZINC001713969157	1418748026	/nfs/dbraw/zinc/74/80/26/1418748026.db2.gz	ZSENADXJWOZVFO-SHTZXODSSA-N	0	3	343.309	3.492	20	30		EGEDHN
C[C@H](C(=O)NC1(CNCc2cc(C#N)ccc2F)CCCC1)C1CC1	ZINC001714131769	1418934896	/nfs/dbraw/zinc/93/48/96/1418934896.db2.gz	CEIWPIFFKSELNC-AWEZNQCLSA-N	0	3	343.446	3.262	20	30		EGEDHN
CC(C)CC(=O)N[C@@](C)(CNCc1ccc(C#N)cc1F)C1CC1	ZINC001714157464	1418968348	/nfs/dbraw/zinc/96/83/48/1418968348.db2.gz	SEJLITLYPNGJSU-IBGZPJMESA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cc(F)ccc2F)CCCC1	ZINC001714497630	1419222340	/nfs/dbraw/zinc/22/23/40/1419222340.db2.gz	VRJAOJUVWSXEKH-UHFFFAOYSA-N	0	3	328.790	3.350	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)[C@@H]2CC23CCC3)CCCC1	ZINC001714507705	1419234842	/nfs/dbraw/zinc/23/48/42/1419234842.db2.gz	LKACPDXUDRULIJ-ZDUSSCGKSA-N	0	3	341.293	3.104	20	30		EGEDHN
CCCN(CCNC(=O)[C@H](C)C(F)(F)F)Cc1ccc(C#N)cc1	ZINC001714655626	1419437378	/nfs/dbraw/zinc/43/73/78/1419437378.db2.gz	FIMKGQIAFHUBRA-ZDUSSCGKSA-N	0	3	341.377	3.085	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)C(C)(C)CC)CC1	ZINC001715187108	1419919750	/nfs/dbraw/zinc/91/97/50/1419919750.db2.gz	LMBGRDZMZLYPSE-JOCQHMNTSA-N	0	3	331.298	3.348	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cnc2c(F)cccc2c1)C(C)C	ZINC001715623265	1420269083	/nfs/dbraw/zinc/26/90/83/1420269083.db2.gz	MTCSWAMUVIFIKN-INIZCTEOSA-N	0	3	349.837	3.470	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)c3ccc4cc[nH]c4c3)CC2)cc1	ZINC001733258548	1429410644	/nfs/dbraw/zinc/41/06/44/1429410644.db2.gz	YMVXRSBELNJUTI-UHFFFAOYSA-N	0	3	344.418	3.092	20	30		EGEDHN
CCCc1occc1C(=O)N[C@H](C)CN(C)Cc1ccc(C#N)cc1	ZINC001716501957	1420729860	/nfs/dbraw/zinc/72/98/60/1420729860.db2.gz	YEGLWXCJYPPPML-OAHLLOKOSA-N	0	3	339.439	3.354	20	30		EGEDHN
CCC(CC)[C@H](C)C(=O)NCC1(NCc2cccc(C#N)c2)CC1	ZINC001716686967	1420840124	/nfs/dbraw/zinc/84/01/24/1420840124.db2.gz	MXSAOLTWSJCTPQ-HNNXBMFYSA-N	0	3	327.472	3.369	20	30		EGEDHN
CC(C)C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccccc1C#N	ZINC001716996154	1421065504	/nfs/dbraw/zinc/06/55/04/1421065504.db2.gz	JSNCRWTYRQEUPD-IDHPPYADSA-N	0	3	325.456	3.073	20	30		EGEDHN
CC(C)CC(=O)N[C@H]1CCN(Cc2ccc(OCC#N)cc2)[C@H](C)C1	ZINC001717325919	1421261282	/nfs/dbraw/zinc/26/12/82/1421261282.db2.gz	ITXGKHIMWQUCKH-AEFFLSMTSA-N	0	3	343.471	3.104	20	30		EGEDHN
CCCc1ccc(CN(C)[C@H](C)CNC(=O)c2cc(C#N)c[nH]2)cc1	ZINC001717468272	1421400311	/nfs/dbraw/zinc/40/03/11/1421400311.db2.gz	HFEOZXKSSAFHOC-OAHLLOKOSA-N	0	3	338.455	3.089	20	30		EGEDHN
C=C(Br)CNC[C@@H](NC(=O)C1(CC)CC1)C(C)(C)C	ZINC001717966414	1421737930	/nfs/dbraw/zinc/73/79/30/1421737930.db2.gz	IQVDSAYVBMWVTJ-GFCCVEGCSA-N	0	3	331.298	3.206	20	30		EGEDHN
C=C(Cl)Cn1c([C@H](C)CC)nnc1N1C[C@H](C)N(CC)C[C@H]1C	ZINC001722544629	1424212758	/nfs/dbraw/zinc/21/27/58/1424212758.db2.gz	UOPVZHDBACXHRX-VHDGCEQUSA-N	0	3	339.915	3.463	20	30		EGEDHN
CC(C)CC(=O)NC[C@@H]1CCCCCN1Cc1cccc(C#N)c1	ZINC001725240241	1425842007	/nfs/dbraw/zinc/84/20/07/1425842007.db2.gz	DQRRYZWEWCUHPG-IBGZPJMESA-N	0	3	327.472	3.465	20	30		EGEDHN
Cc1ccoc1C(=O)N(C)[C@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001725451514	1426117718	/nfs/dbraw/zinc/11/77/18/1426117718.db2.gz	PPKHLRSLGKVJAG-MRXNPFEDSA-N	0	3	343.452	3.162	20	30		EGEDHN
CCCC(C)(C)C(=O)N(C)C[C@H](C)NCc1ccc(F)c(C#N)c1	ZINC001725503037	1426184158	/nfs/dbraw/zinc/18/41/58/1426184158.db2.gz	MNLOQFAQHPJOLR-AWEZNQCLSA-N	0	3	333.451	3.460	20	30		EGEDHN
CCC(C)(C)C(=O)N(C)C1CC(NCc2cc(C#N)ccc2F)C1	ZINC001725782781	1426467445	/nfs/dbraw/zinc/46/74/45/1426467445.db2.gz	CNXNQEBPRMLTGB-UHFFFAOYSA-N	0	3	331.435	3.213	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN(CC/C=C/CCC)C2)cn1	ZINC001731355000	1427294784	/nfs/dbraw/zinc/29/47/84/1427294784.db2.gz	UXXKUOYJMZWQLZ-OVKVCFKUSA-N	0	3	325.456	3.004	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H](OC(C)C)c2ccccc2)C1	ZINC001731460716	1427436826	/nfs/dbraw/zinc/43/68/26/1427436826.db2.gz	JMXKQQHOXGAECQ-ULQDDVLXSA-N	0	3	336.863	3.142	20	30		EGEDHN
C[C@H](CNC(=O)C(C)(C)C1CCC1)NCc1ccc(F)c(C#N)c1	ZINC001731607231	1427652726	/nfs/dbraw/zinc/65/27/26/1427652726.db2.gz	DBMPMZHACMQGHI-CYBMUJFWSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)[C@@H](F)Cc1ccccc1	ZINC001734025643	1437813373	/nfs/dbraw/zinc/81/33/73/1437813373.db2.gz	SZNYPJHTVUMTMJ-INIZCTEOSA-N	0	3	340.870	3.394	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@H](C)N(C)Cc2ccc(C#N)cc2)cc1C	ZINC001734059003	1437851183	/nfs/dbraw/zinc/85/11/83/1437851183.db2.gz	LPGSXIOOKSGAAH-KRWDZBQOSA-N	0	3	335.451	3.425	20	30		EGEDHN
CCCC[C@H](CNCc1ccc(C#N)s1)NC(=O)c1ccn(C)c1	ZINC001734094193	1437878635	/nfs/dbraw/zinc/87/86/35/1437878635.db2.gz	GNDYLDZULBPFPU-OAHLLOKOSA-N	0	3	344.484	3.037	20	30		EGEDHN
CC(C)(C)C(=O)NC[C@H]1CCCCCN1Cc1cccc(C#N)c1	ZINC001734106243	1437892851	/nfs/dbraw/zinc/89/28/51/1437892851.db2.gz	NFKXYKISNJJTHK-GOSISDBHSA-N	0	3	327.472	3.465	20	30		EGEDHN
COc1ccc(CN[C@H](C)CN(C)C(=O)CCC2CCC2)cc1C#N	ZINC001734317862	1438046469	/nfs/dbraw/zinc/04/64/69/1438046469.db2.gz	DDQDSVLYZMTMNH-OAHLLOKOSA-N	0	3	343.471	3.084	20	30		EGEDHN
CC(C)(C)[C@@H](CNCc1ccc(C#N)s1)NC(=O)c1cscn1	ZINC001734555229	1438154492	/nfs/dbraw/zinc/15/44/92/1438154492.db2.gz	FNDKJSFSQNAJCR-CQSZACIVSA-N	0	3	348.497	3.011	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCCC[C@H]2[C@@H](C)NCC(=C)Cl)cc1	ZINC001752145258	1440145599	/nfs/dbraw/zinc/14/55/99/1440145599.db2.gz	UFHHFLXULZJSJW-QAPCUYQASA-N	0	3	330.859	3.393	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1cnc2[nH]ccc2c1	ZINC001752148406	1440146507	/nfs/dbraw/zinc/14/65/07/1440146507.db2.gz	YZTGZXLOQNBZAR-CJNGLKHVSA-N	0	3	346.862	3.240	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1cccc2nc[nH]c21	ZINC001752156529	1440147269	/nfs/dbraw/zinc/14/72/69/1440147269.db2.gz	HLECUACPRJDFHU-XJKSGUPXSA-N	0	3	346.862	3.288	20	30		EGEDHN
CCN(CC#Cc1ccccc1)CCCNC(=O)C12CCC(CC1)C2	ZINC001752188689	1440152127	/nfs/dbraw/zinc/15/21/27/1440152127.db2.gz	IWDBAYSTFFQPID-UHFFFAOYSA-N	0	3	338.495	3.447	20	30		EGEDHN
C=CCOCC(=O)N[C@H]1CC12CCN([C@H](C)c1ccccc1F)CC2	ZINC001752419018	1440175555	/nfs/dbraw/zinc/17/55/55/1440175555.db2.gz	BIUDDYQZOKTRPS-QAPCUYQASA-N	0	3	346.446	3.060	20	30		EGEDHN
C=CCN1CCC(N(CCC)C(=O)c2ccc3cccnc3n2)CC1	ZINC001752433142	1440179159	/nfs/dbraw/zinc/17/91/59/1440179159.db2.gz	BRPHZVQSYHIZKZ-UHFFFAOYSA-N	0	3	338.455	3.132	20	30		EGEDHN
C=CCN1CCC(N(CCC)C(=O)C[C@H](C)n2nc(C)cc2C)CC1	ZINC001752441296	1440181303	/nfs/dbraw/zinc/18/13/03/1440181303.db2.gz	DHHMMTPPXDYKJY-SFHVURJKSA-N	0	3	346.519	3.340	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)COc1cccc(C)c1	ZINC001752544974	1440195042	/nfs/dbraw/zinc/19/50/42/1440195042.db2.gz	JVDZHHKQNCKNSJ-QRVBRYPASA-N	0	3	342.483	3.404	20	30		EGEDHN
C[C@H]1CC(C(=O)N[C@H]2C[C@H](NCC#Cc3ccccc3)C2)C[C@H](C)C1	ZINC001752687183	1440199984	/nfs/dbraw/zinc/19/99/84/1440199984.db2.gz	ITNJVUVGDLGOQY-DEPWHIHDSA-N	0	3	338.495	3.347	20	30		EGEDHN
C[C@H](C#N)C(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1cccc(C(F)F)c1	ZINC001752689766	1440200348	/nfs/dbraw/zinc/20/03/48/1440200348.db2.gz	MMWJJTFAUQSXEF-FCLXEUQJSA-N	0	3	347.409	3.395	20	30		EGEDHN
CC(C)(C)C#CC(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1ccsc1	ZINC001752694802	1440200866	/nfs/dbraw/zinc/20/08/66/1440200866.db2.gz	ZVLCXKMJXXHLNC-ALOPSCKCSA-N	0	3	330.497	3.409	20	30		EGEDHN
CC[C@@H](C)CC(=O)N[C@H]1C[C@@H](NCC#Cc2ccccc2Cl)C1	ZINC001752723368	1440203862	/nfs/dbraw/zinc/20/38/62/1440203862.db2.gz	ODQGWSIQTWQKJX-OIISXLGYSA-N	0	3	332.875	3.365	20	30		EGEDHN
CCC[C@H](C(=O)N[C@H]1C[C@@H](NCC#Cc2ccccc2)C1)C(C)C	ZINC001752768917	1440205878	/nfs/dbraw/zinc/20/58/78/1440205878.db2.gz	LCFNAXBTRNLLKV-ZCNNSNEGSA-N	0	3	326.484	3.347	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@@H]1CCCN(Cc2c(C)noc2CC)C1	ZINC001752782822	1440209668	/nfs/dbraw/zinc/20/96/68/1440209668.db2.gz	BHAGYGIZKZYSCQ-INIZCTEOSA-N	0	3	347.503	3.476	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001752786008	1440211483	/nfs/dbraw/zinc/21/14/83/1440211483.db2.gz	IRPAPBQZNRXYJK-PXNSSMCTSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=C[C@@](C)(O)CC(=O)NC[C@H]1CCCCN1Cc1cccc(CC)c1	ZINC001752819425	1440219609	/nfs/dbraw/zinc/21/96/09/1440219609.db2.gz	VLNOEZBXAXNPAW-TZIWHRDSSA-N	0	3	344.499	3.047	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@@H]1CCCCN1C[C@@H](O)c1ccccc1	ZINC001752821214	1440220859	/nfs/dbraw/zinc/22/08/59/1440220859.db2.gz	LANOIPZFRIKVSI-RBUKOAKNSA-N	0	3	344.499	3.293	20	30		EGEDHN
CCC1(C(=O)N2CCCC[C@H]2CNCC#Cc2ccc(F)cc2)CC1	ZINC001752830002	1440225014	/nfs/dbraw/zinc/22/50/14/1440225014.db2.gz	LDHGYCVEQVTCPS-IBGZPJMESA-N	0	3	342.458	3.338	20	30		EGEDHN
C=CCC1(C(=O)NC2CCC(NCc3snnc3C)CC2)CCC1	ZINC001752854134	1440234408	/nfs/dbraw/zinc/23/44/08/1440234408.db2.gz	TXYMSWASPDTWRC-UHFFFAOYSA-N	0	3	348.516	3.110	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](CNCc2ccccc2C#N)C1	ZINC001752947503	1440251627	/nfs/dbraw/zinc/25/16/27/1440251627.db2.gz	GDFUIUGBWNAMLQ-GOSISDBHSA-N	0	3	337.467	3.080	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1CCC[C@@H](NCc2cnc(C)cn2)C1	ZINC001752968592	1440254573	/nfs/dbraw/zinc/25/45/73/1440254573.db2.gz	LWAFPNSNLJEPCS-QZTJIDSGSA-N	0	3	342.487	3.070	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H](N(C)Cc2ccc(C)c(F)c2)C1	ZINC001752989689	1440259261	/nfs/dbraw/zinc/25/92/61/1440259261.db2.gz	JLIUCPWQYYBLJW-SFHVURJKSA-N	0	3	330.447	3.360	20	30		EGEDHN
CC#CCN(C)[C@@H]1CCCN(C(=O)c2cnc(C(C)(C)C)s2)C1	ZINC001753000955	1440264664	/nfs/dbraw/zinc/26/46/64/1440264664.db2.gz	WPFOBRIUUOPVKY-CQSZACIVSA-N	0	3	333.501	3.000	20	30		EGEDHN
CN(CCNC(=O)CC#Cc1ccccc1)Cc1ccc2c(c1)CCC2	ZINC001753075677	1440291291	/nfs/dbraw/zinc/29/12/91/1440291291.db2.gz	GLBAFTWDNPMQMH-UHFFFAOYSA-N	0	3	346.474	3.165	20	30		EGEDHN
CCN(CCNC(=O)[C@@H]1CC[C@@H]2C[C@@H]2CC1)Cc1ccc(C#N)cc1	ZINC001753089620	1440298151	/nfs/dbraw/zinc/29/81/51/1440298151.db2.gz	XRKHTUNTZYZJCY-OWZKRDHZSA-N	0	3	339.483	3.323	20	30		EGEDHN
CC(C)(C)C#CC(=O)NC[C@@H]1CCCN1Cc1cccc2cccnc21	ZINC001753102413	1440304645	/nfs/dbraw/zinc/30/46/45/1440304645.db2.gz	JOGYXOAODCLRMH-IBGZPJMESA-N	0	3	349.478	3.365	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H]1CCN(Cc2c(C)noc2CC)C1	ZINC001753131104	1440316812	/nfs/dbraw/zinc/31/68/12/1440316812.db2.gz	MYBKFPDWFSELJK-HNNXBMFYSA-N	0	3	333.476	3.086	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@H]1CCN(Cc2ccc(C)c(F)c2)C1	ZINC001753132341	1440317164	/nfs/dbraw/zinc/31/71/64/1440317164.db2.gz	MXOGIAFUXQULBS-SFHVURJKSA-N	0	3	330.447	3.266	20	30		EGEDHN
Cc1cccc(CC(=O)NC[C@H]2CCN(Cc3cccc(C#N)c3)C2)c1	ZINC001753133103	1440317441	/nfs/dbraw/zinc/31/74/41/1440317441.db2.gz	GTFLFUKRSKUABG-OAQYLSRUSA-N	0	3	347.462	3.048	20	30		EGEDHN
C=C(C)CN(CCNC(=O)COc1c(C)cc(C)cc1C)C1CC1	ZINC001753163418	1440335514	/nfs/dbraw/zinc/33/55/14/1440335514.db2.gz	ZEFGYLNSDCAOPW-UHFFFAOYSA-N	0	3	330.472	3.147	20	30		EGEDHN
C=C1CCC(C(=O)N(C)CCNCc2ccc(OC)c(F)c2)CC1	ZINC001753228091	1440340763	/nfs/dbraw/zinc/34/07/63/1440340763.db2.gz	KCMJSVQVZBCPOA-UHFFFAOYSA-N	0	3	334.435	3.129	20	30		EGEDHN
CC[C@@H](Cc1ccccc1)C(=O)N(C)CCNCc1ccc(C#N)cc1	ZINC001753237207	1440341644	/nfs/dbraw/zinc/34/16/44/1440341644.db2.gz	VXYCOBKKRTUNEB-NRFANRHFSA-N	0	3	349.478	3.375	20	30		EGEDHN
CN(CCNCc1ccc(C#N)cc1)C(=O)C(C)(C)c1ccccc1	ZINC001753259323	1440343916	/nfs/dbraw/zinc/34/39/16/1440343916.db2.gz	UZDVSPUSUMXEFJ-UHFFFAOYSA-N	0	3	335.451	3.084	20	30		EGEDHN
C#CCCN[C@@H](CNC(=O)CCc1cccc(C)c1)c1ccccc1	ZINC001753299501	1440353615	/nfs/dbraw/zinc/35/36/15/1440353615.db2.gz	CSVSVLTTWBMBRV-NRFANRHFSA-N	0	3	334.463	3.398	20	30		EGEDHN
C=C(C)CN[C@@H](CNC(=O)Cc1ccc2n[nH]cc2c1)c1ccccc1	ZINC001753300539	1440353873	/nfs/dbraw/zinc/35/38/73/1440353873.db2.gz	VOCGYQAYRXAYRT-FQEVSTJZSA-N	0	3	348.450	3.129	20	30		EGEDHN
C=C(C)CN[C@H](CNC(=O)CCc1scnc1C)c1ccccc1	ZINC001753314449	1440358607	/nfs/dbraw/zinc/35/86/07/1440358607.db2.gz	ZZXAQVYRZLVRDT-QGZVFWFLSA-N	0	3	343.496	3.407	20	30		EGEDHN
C=CCOCC(=O)N(CCC)[C@@H]1CCN(Cc2ccccc2C)C1	ZINC001753315097	1440359060	/nfs/dbraw/zinc/35/90/60/1440359060.db2.gz	STEXEYFCTXQPCS-LJQANCHMSA-N	0	3	330.472	3.011	20	30		EGEDHN
C#CCCN1CC[C@H](N(CCC)C(=O)c2ccc3nc(C)ccc3c2)C1	ZINC001753320258	1440362993	/nfs/dbraw/zinc/36/29/93/1440362993.db2.gz	XPLMLIQJDYUISJ-FQEVSTJZSA-N	0	3	349.478	3.493	20	30		EGEDHN
CCC[C@H](C)C(=O)NCC[C@@H]1CCN(CC#Cc2ccc(F)cc2)C1	ZINC001753325061	1440365994	/nfs/dbraw/zinc/36/59/94/1440365994.db2.gz	OUHLOOSKLROCCV-PKOBYXMFSA-N	0	3	344.474	3.442	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@@H](CN(C)Cc2c(C)noc2C)C1	ZINC001753355298	1440379826	/nfs/dbraw/zinc/37/98/26/1440379826.db2.gz	PEDSNMDWXRDOJY-IRXDYDNUSA-N	0	3	333.476	3.174	20	30		EGEDHN
C[C@@H](c1ccc2c(c1)CCC2)N1CC(CNC(=O)C#CC(C)(C)C)C1	ZINC001753401924	1440391116	/nfs/dbraw/zinc/39/11/16/1440391116.db2.gz	WBGVFJPEDOZIKU-INIZCTEOSA-N	0	3	338.495	3.334	20	30		EGEDHN
C=CCCCN1C[C@@H]2C[C@H]1CN2C(=O)c1cccc(-c2cnco2)c1	ZINC001753426088	1440396854	/nfs/dbraw/zinc/39/68/54/1440396854.db2.gz	LMYWDCSNJQXRJU-ROUUACIJSA-N	0	3	337.423	3.207	20	30		EGEDHN
CC[C@@H](CNC(=O)c1sccc1C)NCc1ccc(C#N)s1	ZINC001753464897	1440412440	/nfs/dbraw/zinc/41/24/40/1440412440.db2.gz	UOVPYNKBUODFFD-LBPRGKRZSA-N	0	3	333.482	3.288	20	30		EGEDHN
CC[C@@H](CNC(=O)c1oc(C)cc1C)NCc1ccc(C#N)s1	ZINC001753470397	1440413866	/nfs/dbraw/zinc/41/38/66/1440413866.db2.gz	RUHGFVBNIDGUOQ-ZDUSSCGKSA-N	0	3	331.441	3.128	20	30		EGEDHN
CC[C@H](CNC(=O)C(C)=C1CCC1)NCc1cc(C#N)ccc1OC	ZINC001753471248	1440414024	/nfs/dbraw/zinc/41/40/24/1440414024.db2.gz	IPJPHCZBNOSSEH-GOSISDBHSA-N	0	3	341.455	3.052	20	30		EGEDHN
CC[C@@H](CNC(=O)C1CC2(CCC2)C1)NCC#Cc1ccc(F)cc1	ZINC001753483097	1440416996	/nfs/dbraw/zinc/41/69/96/1440416996.db2.gz	IDDBBPOREVVONT-IBGZPJMESA-N	0	3	342.458	3.242	20	30		EGEDHN
CC(C)(C)C#CC(=O)NC1(CNCc2ccccc2F)CCCC1	ZINC001753502622	1440423773	/nfs/dbraw/zinc/42/37/73/1440423773.db2.gz	JLYSOOPAUKRXHM-UHFFFAOYSA-N	0	3	330.447	3.394	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@]1(CNCc2conc2C)CCCC[C@H]1C	ZINC001753534071	1440431897	/nfs/dbraw/zinc/43/18/97/1440431897.db2.gz	PFUNSHZNTLZERK-DNVCBOLYSA-N	0	3	333.476	3.494	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)Cc2cncc(C)c2)CCCC[C@H]1C	ZINC001753534386	1440432045	/nfs/dbraw/zinc/43/20/45/1440432045.db2.gz	SOQVYIVGLJQUQR-BEFAXECRSA-N	0	3	349.906	3.340	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC[C@@H](CCNCc2ccc(C#N)cc2F)C1	ZINC001753544993	1440433959	/nfs/dbraw/zinc/43/39/59/1440433959.db2.gz	HPTRAQRAFFBQNH-NVQTYNKRSA-N	0	3	343.446	3.382	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCCN(C(=O)COc2ccsc2)C1	ZINC001753559671	1440436566	/nfs/dbraw/zinc/43/65/66/1440436566.db2.gz	UIZGNNIHCMUQOD-CQSZACIVSA-N	0	3	342.892	3.098	20	30		EGEDHN
CC#CCNCc1ccc(CNC(=O)CCc2cccc(C)c2)cc1	ZINC001753589616	1440442471	/nfs/dbraw/zinc/44/24/71/1440442471.db2.gz	HIECDRPRIRCHIV-UHFFFAOYSA-N	0	3	334.463	3.357	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCC1CCN([C@@H](C)c2cnccn2)CC1	ZINC001753597313	1440445169	/nfs/dbraw/zinc/44/51/69/1440445169.db2.gz	TVGVJQRFBGAMLG-JXFKEZNVSA-N	0	3	344.503	3.358	20	30		EGEDHN
CC(C)C(=O)NCc1ccc(CNCC#Cc2ccc(F)cc2)cc1	ZINC001753598121	1440445457	/nfs/dbraw/zinc/44/54/57/1440445457.db2.gz	OSERHGSLCKJNGK-UHFFFAOYSA-N	0	3	338.426	3.239	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1CCC[C@@H]1CNCC#Cc1ccc(F)cc1	ZINC001753600731	1440446372	/nfs/dbraw/zinc/44/63/72/1440446372.db2.gz	FKYANVKUHWDWPB-LJQANCHMSA-N	0	3	344.474	3.440	20	30		EGEDHN
Cc1oc(C)c(C(=O)NC[C@H](C)CNCc2ccccc2C#N)c1C	ZINC001753623398	1440450969	/nfs/dbraw/zinc/45/09/69/1440450969.db2.gz	BNEAOVOYKKTAQA-CYBMUJFWSA-N	0	3	339.439	3.232	20	30		EGEDHN
COc1cccc(CNC2(CNC(=O)[C@@H](C)C#N)CCCC2)c1Cl	ZINC001753661845	1440458995	/nfs/dbraw/zinc/45/89/95/1440458995.db2.gz	XSMYGHDTXVFVIE-ZDUSSCGKSA-N	0	3	349.862	3.027	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)N(C)C(=O)C1=CCCCCC1	ZINC001753684301	1440465148	/nfs/dbraw/zinc/46/51/48/1440465148.db2.gz	BWGAOJDDXUKIAG-CQSZACIVSA-N	0	3	331.485	3.447	20	30		EGEDHN
C#CCCCC(=O)N(C)[C@@H](C)CN[C@@H]1CCc2c1c(F)ccc2F	ZINC001753686077	1440465570	/nfs/dbraw/zinc/46/55/70/1440465570.db2.gz	SXFQGZWUILAPAW-SUMWQHHRSA-N	0	3	334.410	3.192	20	30		EGEDHN
COc1ccc(C(C)C)cc1CNC[C@@H](C)N(C)C(=O)C#CC(C)C	ZINC001753689369	1440466229	/nfs/dbraw/zinc/46/62/29/1440466229.db2.gz	JWUATMPDFXZKBX-QGZVFWFLSA-N	0	3	344.499	3.415	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@@H](C)CNCC#Cc2cccc(Cl)c2)C1	ZINC001753712985	1440471189	/nfs/dbraw/zinc/47/11/89/1440471189.db2.gz	WDQJEHUAJPONSN-INIZCTEOSA-N	0	3	344.886	3.484	20	30		EGEDHN
Cc1ccc(F)c(CNC[C@H](CC(C)C)NC(=O)C#CC2CC2)c1	ZINC001753734929	1440477425	/nfs/dbraw/zinc/47/74/25/1440477425.db2.gz	MDSYCUDRPFBPJJ-SFHVURJKSA-N	0	3	330.447	3.168	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H](C)[C@H]1CNCc1ccc(Cl)nc1	ZINC001753819605	1440495278	/nfs/dbraw/zinc/49/52/78/1440495278.db2.gz	VRJMDARYXREPAP-DOTOQJQBSA-N	0	3	347.890	3.255	20	30		EGEDHN
CC/C(C)=C\C(=O)NC[C@@H](NCc1cc(C#N)ccc1F)C(C)C	ZINC001753828510	1440499022	/nfs/dbraw/zinc/49/90/22/1440499022.db2.gz	HYCREDZJFMFVNI-DVNIYVAHSA-N	0	3	331.435	3.284	20	30		EGEDHN
C=C(Br)CN[C@H](CNC(=O)C12CCC(CC1)C2)C(C)C	ZINC001753832543	1440499996	/nfs/dbraw/zinc/49/99/96/1440499996.db2.gz	POJAOSXXDVJLSU-NPCAHTBFSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C(Br)CN[C@@H](CNC(=O)CC1CC(C)(C)C1)C(C)C	ZINC001753837367	1440501506	/nfs/dbraw/zinc/50/15/06/1440501506.db2.gz	LTWABTNDALHOJH-AWEZNQCLSA-N	0	3	345.325	3.452	20	30		EGEDHN
CC(C)[C@H](CNC(=O)C(C)(C)C1CC1)NCC#Cc1ccc(F)cc1	ZINC001753837498	1440501546	/nfs/dbraw/zinc/50/15/46/1440501546.db2.gz	NGRCDGPHKJEYFQ-IBGZPJMESA-N	0	3	344.474	3.344	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)Cn1cc(C)c2ccccc21)C(C)C	ZINC001753840136	1440502403	/nfs/dbraw/zinc/50/24/03/1440502403.db2.gz	WRUFLJBZZCYVEA-QGZVFWFLSA-N	0	3	347.890	3.433	20	30		EGEDHN
C=CCC1(C(=O)NC[C@H](NCc2ccnn2C)C(C)C)CCCCC1	ZINC001753845659	1440504322	/nfs/dbraw/zinc/50/43/22/1440504322.db2.gz	OKWYZQOPPVWMJH-SFHVURJKSA-N	0	3	346.519	3.177	20	30		EGEDHN
CN(CCN(C)[C@H]1CCc2c1cccc2Cl)C(=O)C#CC1CC1	ZINC001753852161	1440507412	/nfs/dbraw/zinc/50/74/12/1440507412.db2.gz	DIQBSZBYVPKUAZ-SFHVURJKSA-N	0	3	330.859	3.131	20	30		EGEDHN
C=C(Cl)CNCC[C@H](C)NC(=O)c1cnn(C(C)(C)C)c1CC	ZINC001754022556	1440532644	/nfs/dbraw/zinc/53/26/44/1440532644.db2.gz	DXJJKNSHBJIHFP-ZDUSSCGKSA-N	0	3	340.899	3.051	20	30		EGEDHN
CCN(CCNCc1ccc(F)c(C#N)c1)C(=O)[C@@H]1CC[C@H]2C[C@H]2C1	ZINC001754052624	1440535941	/nfs/dbraw/zinc/53/59/41/1440535941.db2.gz	BUKXPKFBVAXNFW-BBWFWOEESA-N	0	3	343.446	3.072	20	30		EGEDHN
CCN(CCNCc1ccc(F)c(C#N)c1)C(=O)C1(F)CCCCC1	ZINC001754079043	1440539144	/nfs/dbraw/zinc/53/91/44/1440539144.db2.gz	IEZXFLBRXJLCDZ-UHFFFAOYSA-N	0	3	349.425	3.308	20	30		EGEDHN
CCCC1(C(=O)NC/C=C/CNCc2ccc(C#N)c(F)c2)CCC1	ZINC001754159668	1440545840	/nfs/dbraw/zinc/54/58/40/1440545840.db2.gz	VLZHXVPAUYQWRS-ONEGZZNKSA-N	0	3	343.446	3.430	20	30		EGEDHN
C=C[C@H](C(=O)NC/C=C\CNCc1ccc(C)nc1C)c1ccccc1	ZINC001754210246	1440550982	/nfs/dbraw/zinc/55/09/82/1440550982.db2.gz	SXNRHUFLMINEBO-GEPASTNRSA-N	0	3	349.478	3.430	20	30		EGEDHN
C[C@H](CNCC#Cc1cccc(Cl)c1)NC(=O)c1ccc(F)cc1	ZINC001754217115	1440552103	/nfs/dbraw/zinc/55/21/03/1440552103.db2.gz	ZXSFDOMCIXSXND-CQSZACIVSA-N	0	3	344.817	3.239	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@H](C)CNCC#Cc1ccc(Cl)cc1	ZINC001754241631	1440555831	/nfs/dbraw/zinc/55/58/31/1440555831.db2.gz	OUEMYBFWXNKCTJ-BEFAXECRSA-N	0	3	332.875	3.388	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)CNCc2ccnc(OC)c2)CCCCC1	ZINC001754294830	1440566211	/nfs/dbraw/zinc/56/62/11/1440566211.db2.gz	BXXHXKSMXRRCLF-INIZCTEOSA-N	0	3	345.487	3.211	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H](C)CN(C)Cc1ccccc1N(C)C	ZINC001754319774	1440577347	/nfs/dbraw/zinc/57/73/47/1440577347.db2.gz	QQALPQADLMKIBQ-MRXNPFEDSA-N	0	3	331.504	3.291	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)c1cccc(F)c1F	ZINC001754324237	1440579659	/nfs/dbraw/zinc/57/96/59/1440579659.db2.gz	QVCRRMRSVHTYIW-CYBMUJFWSA-N	0	3	343.377	3.087	20	30		EGEDHN
C=CCOCCN(C)C[C@@H](C)NC(=O)c1cc2cc(C)c(C)cc2o1	ZINC001754330817	1440583593	/nfs/dbraw/zinc/58/35/93/1440583593.db2.gz	LCUPVCWDWLESJQ-MRXNPFEDSA-N	0	3	344.455	3.302	20	30		EGEDHN
C=C(Cl)CNCCCN(C)C(=O)c1cc(-c2cccs2)on1	ZINC001754387469	1440593946	/nfs/dbraw/zinc/59/39/46/1440593946.db2.gz	NKMOSRKEOKMJTO-UHFFFAOYSA-N	0	3	339.848	3.207	20	30		EGEDHN
C#CCCCCC(=O)NC[C@H]1CCN1C[C@@H]1CCCC(F)(F)C1	ZINC001754480843	1440607419	/nfs/dbraw/zinc/60/74/19/1440607419.db2.gz	MZNJJQJMAKMZDT-HZPDHXFCSA-N	0	3	326.431	3.196	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)C[C@@H]1CCc2ccccc2C1	ZINC001754499576	1440613405	/nfs/dbraw/zinc/61/34/05/1440613405.db2.gz	ATJBNXMEXSSUCL-YLJYHZDGSA-N	0	3	326.484	3.338	20	30		EGEDHN
C=CCC[C@H](C)N1CC[C@@H]1CNC(=O)c1cnn(C2CCCC2)c1C	ZINC001754500817	1440614308	/nfs/dbraw/zinc/61/43/08/1440614308.db2.gz	SDUBKVJIYMAEPM-MAUKXSAKSA-N	0	3	344.503	3.465	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC1(NCc2ccc(C#N)c(F)c2)CC1	ZINC001754524178	1440620433	/nfs/dbraw/zinc/62/04/33/1440620433.db2.gz	WIVLDKZURQWNEK-GOSISDBHSA-N	0	3	329.419	3.038	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)C#CC(C)(C)C)CC2)C1	ZINC001754534760	1440623641	/nfs/dbraw/zinc/62/36/41/1440623641.db2.gz	AXFPEJIEVZOEMH-KRWDZBQOSA-N	0	3	336.907	3.349	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)CCC(F)(F)F)C1	ZINC001754537837	1440625250	/nfs/dbraw/zinc/62/52/50/1440625250.db2.gz	DZNDVPRNILAXMQ-LSDHHAIUSA-N	0	3	330.394	3.055	20	30		EGEDHN
C#CCN1CCC2(CO[C@@H](CNC(=O)C[C@H](C)CC(C)(C)C)C2)CC1	ZINC001754631820	1440648083	/nfs/dbraw/zinc/64/80/83/1440648083.db2.gz	CINLONDDTBOTOZ-ZWKOTPCHSA-N	0	3	348.531	3.069	20	30		EGEDHN
C#CCN(C(=O)C1CC(F)(F)C1)C1CCN(Cc2ccccc2)CC1	ZINC001754636821	1440648583	/nfs/dbraw/zinc/64/85/83/1440648583.db2.gz	NOUSCCFLBLCNCN-UHFFFAOYSA-N	0	3	346.421	3.158	20	30		EGEDHN
C#CCN(C(=O)[C@@H]1CC[C@@H](F)C1)C1CCN(Cc2ccccc2)CC1	ZINC001754640181	1440648997	/nfs/dbraw/zinc/64/89/97/1440648997.db2.gz	JRKRDRVYBYWUOW-RTBURBONSA-N	0	3	342.458	3.251	20	30		EGEDHN
C#CCN(C(=O)c1ccc(C(C)C)cn1)C1CCN(CC(=C)C)CC1	ZINC001754640696	1440649078	/nfs/dbraw/zinc/64/90/78/1440649078.db2.gz	BLWRMTLFCKJRKZ-UHFFFAOYSA-N	0	3	339.483	3.321	20	30		EGEDHN
CC#CCNC[C@H](NC(=O)C#CC1CC1)c1ccc2ccccc2c1	ZINC001754643682	1440649552	/nfs/dbraw/zinc/64/95/52/1440649552.db2.gz	FMDCVCWPMWVKFM-NRFANRHFSA-N	0	3	330.431	3.023	20	30		EGEDHN
C#CCNC[C@H](NC(=O)CSCCC)c1ccc2ccccc2c1	ZINC001754644148	1440649710	/nfs/dbraw/zinc/64/97/10/1440649710.db2.gz	PBLVJGVBHMSJPW-IBGZPJMESA-N	0	3	340.492	3.363	20	30		EGEDHN
CCCc1ccc(CN2CC[C@](C)(NC(=O)C#CC(C)C)C2)cc1	ZINC001754669936	1440657490	/nfs/dbraw/zinc/65/74/90/1440657490.db2.gz	ISIAHYHTWHOHFS-NRFANRHFSA-N	0	3	326.484	3.379	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@](C)(CNCc2ocnc2C)C1	ZINC001754694486	1440666857	/nfs/dbraw/zinc/66/68/57/1440666857.db2.gz	CBTKRTUXZJBFKZ-LJQANCHMSA-N	0	3	331.460	3.080	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@](C)(CNCc2oc(CC)nc2C)C1	ZINC001754704372	1440668677	/nfs/dbraw/zinc/66/86/77/1440668677.db2.gz	GUFWCRSFHLFURB-WOJBJXKFSA-N	0	3	347.503	3.476	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@](C)(CNCc3ccn(C(C)C)n3)C2)C1	ZINC001754704766	1440668785	/nfs/dbraw/zinc/66/87/85/1440668785.db2.gz	OXCNKVIUPCJZGW-LJQANCHMSA-N	0	3	344.503	3.149	20	30		EGEDHN
C#CCN1CCC(C)(CNC(=O)[C@@H](C)CCc2ccccc2F)CC1	ZINC001754720126	1440672770	/nfs/dbraw/zinc/67/27/70/1440672770.db2.gz	HYQHRCGGSNZYAD-KRWDZBQOSA-N	0	3	344.474	3.246	20	30		EGEDHN
CC#CCN1CCC[C@@](C)(CNC(=O)c2ccc(F)c3occc32)C1	ZINC001754732873	1440680746	/nfs/dbraw/zinc/68/07/46/1440680746.db2.gz	DRAVURJBZZMBDF-FQEVSTJZSA-N	0	3	342.414	3.427	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)[C@@H](CNCc2ccn(C(C)C)n2)C1	ZINC001754816619	1440692405	/nfs/dbraw/zinc/69/24/05/1440692405.db2.gz	HHAGUOLXFPBPMU-SJORKVTESA-N	0	3	332.492	3.004	20	30		EGEDHN
CC#CCNCCN(Cc1ccccc1)C(=O)c1csc(Cl)n1	ZINC001754839517	1440697652	/nfs/dbraw/zinc/69/76/52/1440697652.db2.gz	TUUSSECNBIVEDM-UHFFFAOYSA-N	0	3	347.871	3.052	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)CCCCc1ccc(C)cc1	ZINC001754871576	1440705234	/nfs/dbraw/zinc/70/52/34/1440705234.db2.gz	KGWVPLDNRHJBNU-LEWJYISDSA-N	0	3	338.495	3.406	20	30		EGEDHN
C#CCN[C@@H](C)c1ccc(CNC(=O)[C@H]2Cc3ccc(F)cc32)cc1	ZINC001754948595	1440714314	/nfs/dbraw/zinc/71/43/14/1440714314.db2.gz	LDNNGAQQNUHHCT-XOBRGWDASA-N	0	3	336.410	3.066	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1CC[C@H](CN[C@@H](C)c2ncccn2)CC1	ZINC001754956482	1440716583	/nfs/dbraw/zinc/71/65/83/1440716583.db2.gz	SJBJSEIRFWZXSR-ULQDDVLXSA-N	0	3	344.503	3.405	20	30		EGEDHN
N#Cc1cc(CNC2(CNC(=O)[C@]34C[C@H]3CCC4)CCC2)ccc1F	ZINC001754988506	1440723586	/nfs/dbraw/zinc/72/35/86/1440723586.db2.gz	HLOQKCIEJQZOLM-OXQOHEQNSA-N	0	3	341.430	3.016	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](N3CCN(CCCC)CC3)C2)CCCC1	ZINC001755019372	1440726556	/nfs/dbraw/zinc/72/65/56/1440726556.db2.gz	KIYLDIBGGPFLNB-IBGZPJMESA-N	0	3	347.547	3.142	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CCCN(C[C@@H](O)c2ccccc2F)CC1	ZINC001755028802	1440730386	/nfs/dbraw/zinc/73/03/86/1440730386.db2.gz	PUYMLXBRVMYEIE-CRAIPNDOSA-N	0	3	348.462	3.042	20	30		EGEDHN
CN(CCCN(C)C(=O)[C@@H]1CC1(C)C)Cc1ccc(F)c(C#N)c1	ZINC001755036076	1440734424	/nfs/dbraw/zinc/73/44/24/1440734424.db2.gz	NISHNDUNSFOQMS-INIZCTEOSA-N	0	3	331.435	3.024	20	30		EGEDHN
CC#CCN(C)CCCN(C)C(=O)C1(c2cccc(C)c2)CCC1	ZINC001755040691	1440737044	/nfs/dbraw/zinc/73/70/44/1440737044.db2.gz	CSCGGJIFBUTIBV-UHFFFAOYSA-N	0	3	326.484	3.220	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)CCC(F)(F)F)C1	ZINC001755047827	1440742287	/nfs/dbraw/zinc/74/22/87/1440742287.db2.gz	RBVQGOSSBCKOGC-CABCVRRESA-N	0	3	330.394	3.055	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@]2(CCN(Cc3ccc(F)cc3)C2)C1	ZINC001755077904	1440749648	/nfs/dbraw/zinc/74/96/48/1440749648.db2.gz	FERPDZABCBIFEN-OAQYLSRUSA-N	0	3	342.458	3.444	20	30		EGEDHN
C[C@@H]1CN(C(=O)/C=C/C(C)(C)C)C[C@@H]1NCC#Cc1ccc(F)cc1	ZINC001755107803	1440753954	/nfs/dbraw/zinc/75/39/54/1440753954.db2.gz	UELBMRUYPADFFW-DUSJZKHYSA-N	0	3	342.458	3.216	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)[C@H](C)Cc2ccc(F)cc2)C(C)(C)C1	ZINC001755143715	1440762352	/nfs/dbraw/zinc/76/23/52/1440762352.db2.gz	NSVZGLSOMZZTIL-CRAIPNDOSA-N	0	3	332.463	3.407	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)CCc2cccc(Cl)c2)C[C@@H]1C	ZINC001755161898	1440765005	/nfs/dbraw/zinc/76/50/05/1440765005.db2.gz	NXAWUAIKLZSZBT-YJBOKZPZSA-N	0	3	332.875	3.265	20	30		EGEDHN
C=CCOCCCC(=O)N[C@@H]1CCN(Cc2cccc(F)c2)[C@H](C)C1	ZINC001755168513	1440767946	/nfs/dbraw/zinc/76/79/46/1440767946.db2.gz	CJLUXEVFAXRZGZ-VQIMIIECSA-N	0	3	348.462	3.278	20	30		EGEDHN
C=CCC[C@@H](C)N1CCc2ccccc2[C@@H]1CNC(=O)C#CC1CC1	ZINC001755172534	1440769733	/nfs/dbraw/zinc/76/97/33/1440769733.db2.gz	TXFSAUQUSVPXTQ-UTKZUKDTSA-N	0	3	336.479	3.470	20	30		EGEDHN
C=CCN(C)C[C@@H]1CCCN1C(=O)CCCOc1cccc(F)c1	ZINC001755201278	1440779984	/nfs/dbraw/zinc/77/99/84/1440779984.db2.gz	QCWPDUKPNOCDKB-KRWDZBQOSA-N	0	3	334.435	3.094	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCN1C(=O)[C@H](C)CCOc1ccccc1	ZINC001755203580	1440781400	/nfs/dbraw/zinc/78/14/00/1440781400.db2.gz	YXZIVPHQEZNHCE-QZTJIDSGSA-N	0	3	330.472	3.200	20	30		EGEDHN
C[C@@H](NCC#Cc1cccc(Cl)c1)[C@@H](C)NC(=O)C1CCCC1	ZINC001755225210	1440785766	/nfs/dbraw/zinc/78/57/66/1440785766.db2.gz	YYWARCHCAGGTOZ-HUUCEWRRSA-N	0	3	332.875	3.365	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)c(F)c1)[C@H](C)NC(=O)c1ccoc1Cl	ZINC001755235137	1440788048	/nfs/dbraw/zinc/78/80/48/1440788048.db2.gz	YTWMHMHSLJYGDK-MNOVXSKESA-N	0	3	349.793	3.240	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)C[C@H]1CC[C@@H](C2CC2)O1	ZINC001755282707	1440800979	/nfs/dbraw/zinc/80/09/79/1440800979.db2.gz	CEIJQAMUOQVGRM-CVEARBPZSA-N	0	3	342.911	3.161	20	30		EGEDHN
C=C1CCC(C(=O)N(C)CC(C)(C)CNCc2cnc(C)o2)CC1	ZINC001755286581	1440802178	/nfs/dbraw/zinc/80/21/78/1440802178.db2.gz	VJVIJPBTUQIEOF-UHFFFAOYSA-N	0	3	333.476	3.304	20	30		EGEDHN
C[C@H](CNC(=O)[C@@H]1CCC(C)(C)C1)N(C)Cc1ccc(C#N)cc1	ZINC001755314303	1440814803	/nfs/dbraw/zinc/81/48/03/1440814803.db2.gz	FFVUGFOKNRTIRP-CRAIPNDOSA-N	0	3	327.472	3.321	20	30		EGEDHN
C=CCOCCN(C)[C@@H](C)CNC(=O)c1cccc2ccsc21	ZINC001755325473	1440821480	/nfs/dbraw/zinc/82/14/80/1440821480.db2.gz	WJAHZNQBTOHKRT-AWEZNQCLSA-N	0	3	332.469	3.154	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)C[C@H](C)c2ccccc2OC)C(C)(C)C1	ZINC001755415975	1440848796	/nfs/dbraw/zinc/84/87/96/1440848796.db2.gz	MYHCXNLIHIDZGM-MAUKXSAKSA-N	0	3	330.472	3.201	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COc2ccc(CC)cc2)C(C)(C)C1	ZINC001755416897	1440849299	/nfs/dbraw/zinc/84/92/99/1440849299.db2.gz	VYTYBDXMMIAGCZ-SFHVURJKSA-N	0	3	330.472	3.031	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC[C@@H]1[C@H]2CN(Cc3cccc(C#N)c3)C[C@H]21	ZINC001755423211	1440850187	/nfs/dbraw/zinc/85/01/87/1440850187.db2.gz	PCJQOEWESHGWEQ-MZADTFQBSA-N	0	3	349.478	3.121	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@H]2CN(Cc3ncoc3C(C)C)C[C@H]2C1	ZINC001755449719	1440852953	/nfs/dbraw/zinc/85/29/53/1440852953.db2.gz	IXBPNTLZHMVEBN-GVDBMIGSSA-N	0	3	345.487	3.481	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CC[C@@H](NC(=O)C3(C(F)F)CC3)C[C@H]2C1	ZINC001755453042	1440854269	/nfs/dbraw/zinc/85/42/69/1440854269.db2.gz	MICGZVVFQQCHKV-RWMBFGLXSA-N	0	3	332.822	3.001	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H](C)CCCNCC#Cc1ccccc1Cl	ZINC001755497681	1440862293	/nfs/dbraw/zinc/86/22/93/1440862293.db2.gz	SLFPLJOBTNLTRV-KRWDZBQOSA-N	0	3	344.886	3.225	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H](C)CCCNCc2ccc(C#N)cc2F)C1	ZINC001755514565	1440864119	/nfs/dbraw/zinc/86/41/19/1440864119.db2.gz	KTGLHQURVITLDW-HNNXBMFYSA-N	0	3	343.446	3.428	20	30		EGEDHN
CN(CC#Cc1ccc(Cl)cc1)C1CCN(C(=O)CC2CC2)CC1	ZINC001755525546	1440865763	/nfs/dbraw/zinc/86/57/63/1440865763.db2.gz	JBIICWGATXYKOL-UHFFFAOYSA-N	0	3	344.886	3.414	20	30		EGEDHN
C=C(C)CCC(=O)N(C)C[C@@H](C)NCc1cnn(-c2ccccc2)c1	ZINC001755588488	1440880852	/nfs/dbraw/zinc/88/08/52/1440880852.db2.gz	AMEHQLGAGPUXOO-QGZVFWFLSA-N	0	3	340.471	3.165	20	30		EGEDHN
C=C(C)CCC(=O)N(C)C[C@H](C)NCC#Cc1ccc(Cl)cc1	ZINC001755589309	1440881124	/nfs/dbraw/zinc/88/11/24/1440881124.db2.gz	RGHZQSZADWLUQE-INIZCTEOSA-N	0	3	332.875	3.484	20	30		EGEDHN
C=CC(C)(C)C(=O)N(C)C[C@@H](C)NCc1cc(Cl)ccc1OC	ZINC001755600015	1440883776	/nfs/dbraw/zinc/88/37/76/1440883776.db2.gz	MJHYKGCWRPNXKY-CYBMUJFWSA-N	0	3	338.879	3.497	20	30		EGEDHN
CC#CCCCC(=O)N(C)C[C@H](C)NCc1cc(C)ccc1OC	ZINC001755602969	1440884520	/nfs/dbraw/zinc/88/45/20/1440884520.db2.gz	XXMPHZUAPRHOLY-KRWDZBQOSA-N	0	3	330.472	3.134	20	30		EGEDHN
CC#CCN[C@H]1C[C@@H](C)N(C(=O)Cc2ccc(CCCC)cc2)C1	ZINC001755682468	1440895331	/nfs/dbraw/zinc/89/53/31/1440895331.db2.gz	SLHQDLIMZBPNSD-XLIONFOSSA-N	0	3	326.484	3.174	20	30		EGEDHN
CC#CCN1CC[C@]2(NC(=O)CCCc3ccc(F)cc3)CCC[C@@H]12	ZINC001755699654	1440899130	/nfs/dbraw/zinc/89/91/30/1440899130.db2.gz	CHAFUENKRAAGCZ-TZIWHRDSSA-N	0	3	342.458	3.285	20	30		EGEDHN
C=CCN1CC[C@]2(NC(=O)COC[C@H](C)c3ccccc3)CCC[C@@H]12	ZINC001755704647	1440902042	/nfs/dbraw/zinc/90/20/42/1440902042.db2.gz	OIFDYRLXCPZSNY-FBBABVLZSA-N	0	3	342.483	3.106	20	30		EGEDHN
C=CCN1CC[C@]2(NC(=O)COC[C@H](C)c3ccccc3)CCC[C@H]12	ZINC001755704648	1440902124	/nfs/dbraw/zinc/90/21/24/1440902124.db2.gz	OIFDYRLXCPZSNY-HFSMHLIXSA-N	0	3	342.483	3.106	20	30		EGEDHN
C=CCN1CC[C@]2(NC(=O)[C@@H](C)Cc3ccc(C)cc3)CCC[C@H]12	ZINC001755704888	1440902230	/nfs/dbraw/zinc/90/22/30/1440902230.db2.gz	RMLOWZRIGXFMTQ-HFSMHLIXSA-N	0	3	326.484	3.473	20	30		EGEDHN
C=CCN1CC[C@]2(NC(=O)[C@H](OCC)c3ccccc3)CCC[C@H]12	ZINC001755705040	1440902292	/nfs/dbraw/zinc/90/22/92/1440902292.db2.gz	TZLDMFVAIDXAFJ-NLWGTHIKSA-N	0	3	328.456	3.063	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)CCc2cc(F)ccc2F)[C@@H]1C	ZINC001755722235	1440907890	/nfs/dbraw/zinc/90/78/90/1440907890.db2.gz	GVITVCYTMNZZGK-KBXCAEBGSA-N	0	3	336.426	3.443	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)CCc2cc(F)ccc2F)[C@@H]1C	ZINC001755722237	1440907913	/nfs/dbraw/zinc/90/79/13/1440907913.db2.gz	GVITVCYTMNZZGK-KSSFIOAISA-N	0	3	336.426	3.443	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CC[C@@H](CNCc2csc(C)n2)C1	ZINC001755725467	1440909236	/nfs/dbraw/zinc/90/92/36/1440909236.db2.gz	AIORXTSTCSWWDW-HZPDHXFCSA-N	0	3	333.501	3.020	20	30		EGEDHN
Cc1nc(C(C)C)oc1CNC[C@@H]1CC[C@@H](NC(=O)C#CC(C)C)C1	ZINC001755734844	1440910749	/nfs/dbraw/zinc/91/07/49/1440910749.db2.gz	XDRJOEKMUJGVGU-IAGOWNOFSA-N	0	3	345.487	3.140	20	30		EGEDHN
COc1ccc(C#N)cc1CNC[C@H](NC(=O)C=C(C)C)C(C)(C)C	ZINC001755816708	1440923998	/nfs/dbraw/zinc/92/39/98/1440923998.db2.gz	PNLRHGJZFGZCQO-SFHVURJKSA-N	0	3	343.471	3.154	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H](CNCc2cncs2)C(C)(C)C)cc1	ZINC001755831590	1440928925	/nfs/dbraw/zinc/92/89/25/1440928925.db2.gz	ZYTPTLRFZZSQHW-QGZVFWFLSA-N	0	3	341.480	3.059	20	30		EGEDHN
COCCN(CCNC(=O)C#CC(C)(C)C)[C@H](C)c1cccc(C)c1	ZINC001755838122	1440930887	/nfs/dbraw/zinc/93/08/87/1440930887.db2.gz	KQPYHPAJMMARQI-GOSISDBHSA-N	0	3	344.499	3.170	20	30		EGEDHN
C=CCCC(=O)N[C@H](C)C1CCN(Cc2c(C)noc2CC)CC1	ZINC001755842139	1440931904	/nfs/dbraw/zinc/93/19/04/1440931904.db2.gz	KFOKRVVDSCQETC-CQSZACIVSA-N	0	3	333.476	3.228	20	30		EGEDHN
CC(C)=CC(=O)N[C@@H](C)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001755845523	1440933114	/nfs/dbraw/zinc/93/31/14/1440933114.db2.gz	NNTBUYKBUSZLBI-INIZCTEOSA-N	0	3	325.456	3.241	20	30		EGEDHN
CN(C(=O)C1=CCCC1)C1CC(NCC#Cc2cccc(Cl)c2)C1	ZINC001755855608	1440935736	/nfs/dbraw/zinc/93/57/36/1440935736.db2.gz	WTJHAJODWPWJJV-UHFFFAOYSA-N	0	3	342.870	3.381	20	30		EGEDHN
C=C(Br)CNC1CC(N(C)C(=O)[C@@](C)(F)CCCC)C1	ZINC001755858419	1440936292	/nfs/dbraw/zinc/93/62/92/1440936292.db2.gz	BYOLIIQCHPCXSL-PIMMBPRGSA-N	0	3	349.288	3.392	20	30		EGEDHN
C=CCNCc1ccc(CNC(=O)Cc2ccc(F)cc2)c(F)c1	ZINC001755903060	1440944374	/nfs/dbraw/zinc/94/43/74/1440944374.db2.gz	YBZMKGJJCQIKBM-UHFFFAOYSA-N	0	3	330.378	3.099	20	30		EGEDHN
C[C@@H]([NH2+][C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccc(OCC#N)cc1	ZINC000824529976	946764898	/nfs/dbraw/zinc/76/48/98/946764898.db2.gz	INQXFAZMKOLQBJ-KGLIPLIRSA-N	0	3	348.410	3.181	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(c3ccc(Br)cc3)C2)o1	ZINC000174345300	231183821	/nfs/dbraw/zinc/18/38/21/231183821.db2.gz	ZHXUEGKKAFJBGL-CYBMUJFWSA-N	0	3	346.228	3.282	20	30		EGEDHN
CN1CCC(Nc2ccccc2NC(=O)C#Cc2ccccc2)CC1	ZINC000175106808	530050434	/nfs/dbraw/zinc/05/04/34/530050434.db2.gz	IAAQBRLYOOKAKX-UHFFFAOYSA-N	0	3	333.435	3.183	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1c2ccc(C)cc2[C@H]2CN(C)CC[C@@H]21	ZINC000069335608	215379802	/nfs/dbraw/zinc/37/98/02/215379802.db2.gz	QDZMAONZQTYNNO-SUMDDJOVSA-N	0	3	328.456	3.111	20	30		EGEDHN
CN(C)CCOc1ccc(CNc2cc(C#N)ccc2[N+](=O)[O-])cc1	ZINC000183710873	235204586	/nfs/dbraw/zinc/20/45/86/235204586.db2.gz	OSKIRCBAOWNCTO-UHFFFAOYSA-N	0	3	340.383	3.019	20	30		EGEDHN
CC(=O)Nc1cccc(OCCN[C@@H]2CCc3ccc(C#N)cc32)c1	ZINC000353272853	241786877	/nfs/dbraw/zinc/78/68/77/241786877.db2.gz	MBGUFRQTCVSCPJ-HXUWFJFHSA-N	0	3	335.407	3.173	20	30		EGEDHN
N#Cc1ccc(CN2CCC(C(=O)Nc3ccccc3O)CC2)cc1	ZINC000015041988	211792166	/nfs/dbraw/zinc/79/21/66/211792166.db2.gz	RHRPIPHVBYJPFR-UHFFFAOYSA-N	0	3	335.407	3.115	20	30		EGEDHN
CC[C@@H](NCc1cccc(CS(C)(=O)=O)c1)c1ccc(C#N)cc1	ZINC000278888183	269675560	/nfs/dbraw/zinc/67/55/60/269675560.db2.gz	YKGJDEIYMCPEOR-LJQANCHMSA-N	0	3	342.464	3.344	20	30		EGEDHN
Cc1ccccc1CN1CCCN(C[C@H](O)c2ccc(C#N)cc2)CC1	ZINC000378150310	169076794	/nfs/dbraw/zinc/07/67/94/169076794.db2.gz	OCRFTWHYZKFALZ-QFIPXVFZSA-N	0	3	349.478	3.108	20	30		EGEDHN
N#Cc1ccc([C@H](O)CNC2(c3ccc(F)cc3)CCOCC2)cc1	ZINC000268704960	252156346	/nfs/dbraw/zinc/15/63/46/252156346.db2.gz	WBDYENNPDVWMJL-LJQANCHMSA-N	0	3	340.398	3.026	20	30		EGEDHN
COc1ccc(CN2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)cc1C#N	ZINC000246793910	141034432	/nfs/dbraw/zinc/03/44/32/141034432.db2.gz	MLRRCRHILBKALL-QFBILLFUSA-N	0	3	325.456	3.016	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN(Cc1cccnc1)C1CC1	ZINC000174975560	144055281	/nfs/dbraw/zinc/05/52/81/144055281.db2.gz	XDNAXZMJEOZOMX-UHFFFAOYSA-N	0	3	326.425	3.008	20	30		EGEDHN
Cc1cc(NC(=O)C2CCN([C@@H](C)c3cccc(C#N)c3)CC2)no1	ZINC000187662570	144162507	/nfs/dbraw/zinc/16/25/07/144162507.db2.gz	UXCMHECRWXATEW-AWEZNQCLSA-N	0	3	338.411	3.266	20	30		EGEDHN
C[C@H](N[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O)c1cccs1	ZINC000190629046	153152464	/nfs/dbraw/zinc/15/24/64/153152464.db2.gz	ROZWMFOJAJWZQX-BBRMVZONSA-N	0	3	325.437	3.071	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)c1cccc2c1CCC2	ZINC000194340688	153332545	/nfs/dbraw/zinc/33/25/45/153332545.db2.gz	DVGSFEMYSPXGSQ-UHFFFAOYSA-N	0	3	347.462	3.251	20	30		EGEDHN
COc1cccc([C@@H](CNc2cccc(C#N)c2[N+](=O)[O-])N(C)C)c1	ZINC000336893998	154233173	/nfs/dbraw/zinc/23/31/73/154233173.db2.gz	VMPJAPGBMADYEW-QGZVFWFLSA-N	0	3	340.383	3.190	20	30		EGEDHN
C[C@@H]1CN(CCC2CCN(Cc3cc(C#N)cs3)CC2)C[C@@H](C)O1	ZINC000093844438	162031089	/nfs/dbraw/zinc/03/10/89/162031089.db2.gz	OMXDVKPLLJNVLF-HZPDHXFCSA-N	0	3	347.528	3.331	20	30		EGEDHN
CCCCN(C)CCNC(=O)c1cc(C2CC2)nc(SC)c1C#N	ZINC000112311377	162170447	/nfs/dbraw/zinc/17/04/47/162170447.db2.gz	WIXLVPBGLYFAJQ-UHFFFAOYSA-N	0	3	346.500	3.014	20	30		EGEDHN
C[C@@H](CNc1c(C#N)nnc2ccccc21)N(C)Cc1ccccc1	ZINC000354354477	166007816	/nfs/dbraw/zinc/00/78/16/166007816.db2.gz	PSLVSAAYUGLCGK-HNNXBMFYSA-N	0	3	331.423	3.434	20	30		EGEDHN
CSc1ccc([C@@H](CNc2ccc(C#N)c(C)n2)N(C)C)cc1	ZINC000338836231	163360533	/nfs/dbraw/zinc/36/05/33/163360533.db2.gz	JOEHZKSPOHRZHY-QGZVFWFLSA-N	0	3	326.469	3.120	20	30		EGEDHN
CN(CCCN(C)c1ccc(C#N)cc1[N+](=O)[O-])Cc1ccco1	ZINC000343817706	164042073	/nfs/dbraw/zinc/04/20/73/164042073.db2.gz	VQQVOVPXBBHBCJ-UHFFFAOYSA-N	0	3	328.372	3.018	20	30		EGEDHN
COc1cccc(N2C[C@H](N[C@H](C)c3ccc(C#N)cc3)CC2=O)c1	ZINC000344171378	164119613	/nfs/dbraw/zinc/11/96/13/164119613.db2.gz	OCFJPHLMACRRNF-RHSMWYFYSA-N	0	3	335.407	3.023	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)c2ccc(F)c(C#N)c2)N(C)C)cc1	ZINC000346294945	164364583	/nfs/dbraw/zinc/36/45/83/164364583.db2.gz	ZSLQEYRFUFQGHC-SFHVURJKSA-N	0	3	325.387	3.039	20	30		EGEDHN
CN(Cc1cccc(OCc2cccc(C#N)c2)c1)CC1(O)CCC1	ZINC000355371568	166177600	/nfs/dbraw/zinc/17/76/00/166177600.db2.gz	ULZYYDZWUIMVRW-UHFFFAOYSA-N	0	3	336.435	3.484	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@@H](NCc3cccc4cc[nH]c43)C2=O)cc1	ZINC000355771059	166302872	/nfs/dbraw/zinc/30/28/72/166302872.db2.gz	VZVBUTAADQKSHI-LJQANCHMSA-N	0	3	344.418	3.325	20	30		EGEDHN
CC(C)N1CCN(c2cccc(NCc3cc(C#N)n(C)c3)c2)CC1	ZINC000359670505	167206862	/nfs/dbraw/zinc/20/68/62/167206862.db2.gz	JGOSINKKHWCVRK-UHFFFAOYSA-N	0	3	337.471	3.039	20	30		EGEDHN
CN(C)C[C@H](NC(=O)CCc1ccc(C#N)cc1)c1ccc(F)cc1	ZINC000359820145	167241434	/nfs/dbraw/zinc/24/14/34/167241434.db2.gz	MKESIJAYWSSFMT-IBGZPJMESA-N	0	3	339.414	3.049	20	30		EGEDHN
Cc1ccc(CN(CCN(C)C)C(=O)[C@@H](C)c2cccc(C#N)c2)o1	ZINC000360329856	167304107	/nfs/dbraw/zinc/30/41/07/167304107.db2.gz	UXIKBBTXEPMAGH-INIZCTEOSA-N	0	3	339.439	3.154	20	30		EGEDHN
COCc1ccc(CN2CCCN(Cc3ccc(C#N)cc3)CC2)cc1	ZINC000122813773	222163887	/nfs/dbraw/zinc/16/38/87/222163887.db2.gz	HXLAFZXPXAHDMF-UHFFFAOYSA-N	0	3	349.478	3.413	20	30		EGEDHN
Cc1cccc(OCCN(C)C(=O)C(C#N)Cc2ccc(C#N)cc2)c1	ZINC000279750476	270039638	/nfs/dbraw/zinc/03/96/38/270039638.db2.gz	QGNALXPBJUKXKG-LJQANCHMSA-N	0	3	347.418	3.086	20	30		EGEDHN
CCC[C@@H]1CN(Cc2ccc(C#N)cc2Cl)CCN1CCOC	ZINC000439428481	270051833	/nfs/dbraw/zinc/05/18/33/270051833.db2.gz	GHXBLNMNNDHUSU-QGZVFWFLSA-N	0	3	335.879	3.144	20	30		EGEDHN
CCC[C@@]1(COC)CCCN1Cc1nnc(-c2cccc(C#N)c2)o1	ZINC000447398938	270052877	/nfs/dbraw/zinc/05/28/77/270052877.db2.gz	UCIDFBXLPVMBGE-IBGZPJMESA-N	0	3	340.427	3.389	20	30		EGEDHN
CCN1CCN(c2cccc(NC(=O)c3ccc(C#N)s3)c2)CC1	ZINC000471640608	270055140	/nfs/dbraw/zinc/05/51/40/270055140.db2.gz	AQEMXYKXZVOUHB-UHFFFAOYSA-N	0	3	340.452	3.014	20	30		EGEDHN
N#Cc1cnc2c(F)ccc(Cl)c2c1N1CCN(CC2CC2)CC1	ZINC000194099620	266091413	/nfs/dbraw/zinc/09/14/13/266091413.db2.gz	OFHYQLMRBVPTME-UHFFFAOYSA-N	0	3	344.821	3.431	20	30		EGEDHN
CCN(Cc1c[nH]c2ccccc12)C[C@H](O)COc1ccc(C#N)cc1	ZINC000190458240	266136973	/nfs/dbraw/zinc/13/69/73/266136973.db2.gz	SFJWHJDDVYXBLR-SFHVURJKSA-N	0	3	349.434	3.301	20	30		EGEDHN
CC(C)Oc1ccc([C@H](O)CNCc2ccc(C#N)cc2F)cc1	ZINC000269446637	266295630	/nfs/dbraw/zinc/29/56/30/266295630.db2.gz	UYACORHCGLZPOM-LJQANCHMSA-N	0	3	328.387	3.308	20	30		EGEDHN
COc1cc(CN[C@H](C)[C@H]2OCCc3sccc32)ccc1C#N	ZINC000291751047	266830917	/nfs/dbraw/zinc/83/09/17/266830917.db2.gz	QGPOTJJIFCITAX-KZULUSFZSA-N	0	3	328.437	3.420	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)Cc1ccc2c(c1)NC(=O)CO2	ZINC000507315301	267015646	/nfs/dbraw/zinc/01/56/46/267015646.db2.gz	CRMAFMZGKGCVNF-UHFFFAOYSA-N	0	3	335.407	3.301	20	30		EGEDHN
CCCN1CCC[C@H]1CNC(=O)C(C)(C)Cc1ccc(C#N)cc1	ZINC000456054657	267019502	/nfs/dbraw/zinc/01/95/02/267019502.db2.gz	LHQATHGNZQLWAY-SFHVURJKSA-N	0	3	327.472	3.118	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@H]1Nc1ccc([N+](=O)[O-])cc1C#N	ZINC000302183783	267056056	/nfs/dbraw/zinc/05/60/56/267056056.db2.gz	SDESLMVUSSKKPI-AUUYWEPGSA-N	0	3	336.395	3.399	20	30		EGEDHN
CCN(Cc1ccc(Cl)cc1)C[C@@H](O)COc1ccc(C#N)cc1	ZINC000519907854	267069987	/nfs/dbraw/zinc/06/99/87/267069987.db2.gz	KKCQONVPLOOKPX-GOSISDBHSA-N	0	3	344.842	3.473	20	30		EGEDHN
C[C@@H]1Oc2cc(F)ccc2[C@@H]1NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000360325034	267102319	/nfs/dbraw/zinc/10/23/19/267102319.db2.gz	MNFGBUXIYQGUTL-VRHCTWJESA-N	0	3	349.365	3.018	20	30		EGEDHN
C[C@H](NCCC(=O)Nc1sc2c(c1C#N)CCC2)c1ccccn1	ZINC000299075975	267181377	/nfs/dbraw/zinc/18/13/77/267181377.db2.gz	TXBAENALIZVHPO-LBPRGKRZSA-N	0	3	340.452	3.183	20	30		EGEDHN
CC[C@@H](NC[C@@H]1CN(Cc2ccccc2)CCO1)c1ccc(C#N)cc1	ZINC000447511408	267194593	/nfs/dbraw/zinc/19/45/93/267194593.db2.gz	UDCFUEUMABKKQK-FGZHOGPDSA-N	0	3	349.478	3.500	20	30		EGEDHN
CC[C@H](NC1CCC(Oc2ncccc2C#N)CC1)c1ccn(C)n1	ZINC000437086736	267220170	/nfs/dbraw/zinc/22/01/70/267220170.db2.gz	LPFVDCUAPQTFRD-JCYILVPMSA-N	0	3	339.443	3.118	20	30		EGEDHN
CC[C@H](N[C@H](C)C(=O)NCCc1ccccc1)c1ccc(C#N)cc1	ZINC000453408918	267222713	/nfs/dbraw/zinc/22/27/13/267222713.db2.gz	NYTVAFZMBOJMNW-UZLBHIALSA-N	0	3	335.451	3.346	20	30		EGEDHN
CN(C)CCOc1ccccc1CNc1c(C#N)cccc1[N+](=O)[O-]	ZINC000425232882	267281475	/nfs/dbraw/zinc/28/14/75/267281475.db2.gz	XPGNQRAEOIKWMS-UHFFFAOYSA-N	0	3	340.383	3.019	20	30		EGEDHN
CN(CC(=O)NCc1cccc(C#N)c1)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000459668031	267297959	/nfs/dbraw/zinc/29/79/59/267297959.db2.gz	BBVKVYQTUWOOHT-NHCUHLMSSA-N	0	3	347.462	3.443	20	30		EGEDHN
CN(CC(=O)NCc1ccc(C#N)cc1)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000459667450	267298072	/nfs/dbraw/zinc/29/80/72/267298072.db2.gz	ARJMGSLJTRIIJS-NHCUHLMSSA-N	0	3	347.462	3.443	20	30		EGEDHN
Cc1cc2cc(CNC(=O)C(C#N)Cc3ccc(C#N)cc3)ccc2[nH]1	ZINC000344052347	267368309	/nfs/dbraw/zinc/36/83/09/267368309.db2.gz	KKNVBESVYBDTHS-IBGZPJMESA-N	0	3	342.402	3.347	20	30		EGEDHN
Cc1ccc(NC(=O)c2ncc(C#N)cc2Cl)c(CN(C)C)c1	ZINC000428049119	268040454	/nfs/dbraw/zinc/04/04/54/268040454.db2.gz	QETKEXSVDZIWMN-UHFFFAOYSA-N	0	3	328.803	3.229	20	30		EGEDHN
Cc1ccc([C@@H](CNC(=O)NCc2ccc(C#N)s2)N(C)C)cc1	ZINC000420801167	268043774	/nfs/dbraw/zinc/04/37/74/268043774.db2.gz	QLJLKDGCZXRZAI-QGZVFWFLSA-N	0	3	342.468	3.030	20	30		EGEDHN
Cc1ccc([C@@H]2C[C@H](C)N(CC(=O)NCc3ccc(C#N)cc3)C2)cc1	ZINC000490067230	268045069	/nfs/dbraw/zinc/04/50/69/268045069.db2.gz	XIWAKODNURZHBW-LAUBAEHRSA-N	0	3	347.462	3.361	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)CCc2ccc(C#N)cc2)N(C)C)cc1	ZINC000499142600	268046063	/nfs/dbraw/zinc/04/60/63/268046063.db2.gz	GGOQGWNKJVQNFH-FQEVSTJZSA-N	0	3	335.451	3.218	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NC[C@@H]2CCCC(F)(F)C2)cc1	ZINC000282678258	268085118	/nfs/dbraw/zinc/08/51/18/268085118.db2.gz	OJIHNYZBYQBLSB-CVEARBPZSA-N	0	3	331.366	3.182	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NC[C@H]2CCCCC2(F)F)cc1	ZINC000295335597	268085702	/nfs/dbraw/zinc/08/57/02/268085702.db2.gz	FJXWMIFSVMIJKC-JKSUJKDBSA-N	0	3	331.366	3.182	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CC[C@@H](c3ccccc3F)C2)cc1	ZINC000280214650	268089642	/nfs/dbraw/zinc/08/96/42/268089642.db2.gz	AIIDTSBTZMMABR-QZTJIDSGSA-N	0	3	347.393	3.396	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@H]2C[C@H](c3ccccc3F)C2)cc1	ZINC000280744774	268092080	/nfs/dbraw/zinc/09/20/80/268092080.db2.gz	SMPUZLWGPPTGDW-KZNAEPCWSA-N	0	3	347.393	3.442	20	30		EGEDHN
Cc1noc(C)c1CNC1CCC(Oc2ncccc2C#N)CC1	ZINC000527074281	268096398	/nfs/dbraw/zinc/09/63/98/268096398.db2.gz	VFVRXWMHWYTRQY-UHFFFAOYSA-N	0	3	326.400	3.038	20	30		EGEDHN
N#Cc1ccc(N2CC[C@H](N[C@@H](c3ccccc3)C3CC3)C2=O)cc1	ZINC000269717429	268126567	/nfs/dbraw/zinc/12/65/67/268126567.db2.gz	WQJMPUQZSSUZBE-PMACEKPBSA-N	0	3	331.419	3.404	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN2CCC[C@@H]2c2cccc(F)c2)cc1	ZINC000298723014	268178269	/nfs/dbraw/zinc/17/82/69/268178269.db2.gz	PFBKBXWFIWPVCF-UYAOXDASSA-N	0	3	340.398	3.274	20	30		EGEDHN
N#Cc1ccc(CNCCOc2ccc(C(F)(F)F)cn2)cc1F	ZINC000421360660	268231915	/nfs/dbraw/zinc/23/19/15/268231915.db2.gz	FGTXTHGPKBFZHD-UHFFFAOYSA-N	0	3	339.292	3.280	20	30		EGEDHN
N#Cc1cccc(OCCCN(Cc2cccc(C(N)=O)c2)C2CC2)c1	ZINC000296941801	268272015	/nfs/dbraw/zinc/27/20/15/268272015.db2.gz	XLVHKSNPWVWMQH-UHFFFAOYSA-N	0	3	349.434	3.091	20	30		EGEDHN
N#Cc1cccc2c1CCN2C(=O)c1ccc(CN2CCCC2)cc1	ZINC000421651901	268295448	/nfs/dbraw/zinc/29/54/48/268295448.db2.gz	OAVMXQHLWGCMGY-UHFFFAOYSA-N	0	3	331.419	3.357	20	30		EGEDHN
N#Cc1ccsc1N1CC[C@H](N[C@H](c2ccccc2)C2CC2)C1=O	ZINC000298974642	268305660	/nfs/dbraw/zinc/30/56/60/268305660.db2.gz	PGAZLLNQEGXVNI-DLBZAZTESA-N	0	3	337.448	3.466	20	30		EGEDHN
N#Cc1cnc(N2CC[C@]3(CCN(Cc4ccccc4)C3)C2)c(F)c1	ZINC000413279414	268312857	/nfs/dbraw/zinc/31/28/57/268312857.db2.gz	IBXLDORXJLEHMS-FQEVSTJZSA-N	0	3	336.414	3.195	20	30		EGEDHN
N#Cc1cnn(-c2ccccc2)c1NC(=O)CN(C1CCC1)C1CCC1	ZINC000292546943	268317120	/nfs/dbraw/zinc/31/71/20/268317120.db2.gz	YHFRVSDWNMSWJD-UHFFFAOYSA-N	0	3	349.438	3.089	20	30		EGEDHN
CCC1(CC)[C@H](N[C@H](C)C(=O)Nc2ccccc2C#N)[C@H](C)[C@@H]1OC	ZINC000245596993	273602655	/nfs/dbraw/zinc/60/26/55/273602655.db2.gz	IWGZCTNEZVNCDP-JFTQMJAMSA-N	0	3	343.471	3.315	20	30		EGEDHN
CN(C)[C@@H](CNC(=O)Nc1ccc(F)cc1C#N)c1ccccc1	ZINC000119813215	273804514	/nfs/dbraw/zinc/80/45/14/273804514.db2.gz	DLOODJFMGFXKGM-KRWDZBQOSA-N	0	3	326.375	3.122	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H]1C[C@@H](C)N(C2CC2)C1	ZINC000127507258	276001425	/nfs/dbraw/zinc/00/14/25/276001425.db2.gz	UTBFBGSKIYPOPR-CRAIPNDOSA-N	0	3	340.471	3.105	20	30		EGEDHN
C[C@H](C(=O)N(Cc1ccc(C#N)cc1)C1CC1)N1CCCCCC1	ZINC000172098365	298000402	/nfs/dbraw/zinc/00/04/02/298000402.db2.gz	QRSYHOABIYZBNE-MRXNPFEDSA-N	0	3	325.456	3.314	20	30		EGEDHN
CC[C@H]1CCC[C@@H]1NC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000132122762	307654312	/nfs/dbraw/zinc/65/43/12/307654312.db2.gz	QXFPFOVMGVFAAI-OALUTQOASA-N	0	3	342.487	3.210	20	30		EGEDHN
N#Cc1ccc2c(c1)CCCC[C@@H]2N[C@H]1Cc2ccccc2NC1=O	ZINC000528002093	312995549	/nfs/dbraw/zinc/99/55/49/312995549.db2.gz	WJWDOTQRZOFDGJ-PMACEKPBSA-N	0	3	331.419	3.479	20	30		EGEDHN
CCC(CC)[C@@H](CN[C@H](C)c1ccc(C#N)c(F)c1)N1CCOCC1	ZINC000538510639	314250987	/nfs/dbraw/zinc/25/09/87/314250987.db2.gz	AFWRUBGJGVSOCB-FOIQADDNSA-N	0	3	347.478	3.485	20	30		EGEDHN
Cc1ccc(CN2CCCC2)cc1NC(=O)c1ncc(C#N)cc1C	ZINC000551885855	315174897	/nfs/dbraw/zinc/17/48/97/315174897.db2.gz	RWMQOYKBEFADKW-UHFFFAOYSA-N	0	3	334.423	3.418	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)c2cc(C#N)c[nH]2)N(CC)CC)cc1	ZINC000554227048	315304256	/nfs/dbraw/zinc/30/42/56/315304256.db2.gz	YIUYSYRPDMVUKF-IBGZPJMESA-N	0	3	338.455	3.262	20	30		EGEDHN
CC1(C)C[C@H](NC[C@H](O)COc2ccc(C#N)cc2)c2ccccc21	ZINC000564854043	316219133	/nfs/dbraw/zinc/21/91/33/316219133.db2.gz	KJSAYLRUFYNWSK-JXFKEZNVSA-N	0	3	336.435	3.310	20	30		EGEDHN
C[C@H]1OCC[C@@]1(O)CN(Cc1ccccc1)Cc1ccc(C#N)cc1	ZINC000565708603	316359624	/nfs/dbraw/zinc/35/96/24/316359624.db2.gz	LDTUUCFTVXBTNE-DYESRHJHSA-N	0	3	336.435	3.100	20	30		EGEDHN
Cc1oc2ccccc2c1CNC[C@H](O)COc1ccc(C#N)cc1	ZINC000569568976	316932963	/nfs/dbraw/zinc/93/29/63/316932963.db2.gz	NCKCUKBRSXTVLY-INIZCTEOSA-N	0	3	336.391	3.142	20	30		EGEDHN
CC(C)c1ccc(CCCNCc2cnc3c(C#N)cnn3c2)cc1	ZINC000571208941	317166485	/nfs/dbraw/zinc/16/64/85/317166485.db2.gz	FKLMHPASWAKVBB-UHFFFAOYSA-N	0	3	333.439	3.447	20	30		EGEDHN
N#Cc1ccccc1-c1ccc(CN[C@@H]2CCC(=O)N[C@@H]2C2CC2)cc1	ZINC000572003909	317277829	/nfs/dbraw/zinc/27/78/29/317277829.db2.gz	XRKAKZGVZNCVPA-IFMALSPDSA-N	0	3	345.446	3.372	20	30		EGEDHN
CN(C)C[C@H](CNC(=O)c1cc(C#N)cs1)c1ccc(Cl)cc1	ZINC000573748818	317524285	/nfs/dbraw/zinc/52/42/85/317524285.db2.gz	MOYWADIAYXHEOZ-AWEZNQCLSA-N	0	3	347.871	3.348	20	30		EGEDHN
C[C@@H](NCC(=O)Nc1ccc(C#N)cc1)c1cccc(N2CCCC2)c1	ZINC000181876607	323509719	/nfs/dbraw/zinc/50/97/19/323509719.db2.gz	MZXAQHSDTVSHGV-MRXNPFEDSA-N	0	3	348.450	3.448	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CCC[C@@H]1c1ccc[nH]1	ZINC000157684033	455220419	/nfs/dbraw/zinc/22/04/19/455220419.db2.gz	VLUDFZVYYLJVNO-IEBWSBKVSA-N	0	3	326.440	3.320	20	30		EGEDHN
N#CC1CCN(CC2CCN(C(=O)OCc3ccccc3)CC2)CC1	ZINC000189580554	455220878	/nfs/dbraw/zinc/22/08/78/455220878.db2.gz	CUOKKZJQPGAFTJ-UHFFFAOYSA-N	0	3	341.455	3.271	20	30		EGEDHN
C=CCN(C)CCN(CC)[C@H](C)C(=O)Nc1ccc(F)cc1Cl	ZINC000411637199	457935694	/nfs/dbraw/zinc/93/56/94/457935694.db2.gz	FQMIWTGNBVYGPZ-CYBMUJFWSA-N	0	3	341.858	3.246	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1N[C@H](C)C(=O)Nc1cccc(Cl)c1Cl	ZINC000451607737	458483406	/nfs/dbraw/zinc/48/34/06/458483406.db2.gz	QILBSRDBGCVAMO-XWIASGKRSA-N	0	3	329.227	3.254	20	30		EGEDHN
CCOc1ccc(C(F)(F)F)cc1NC(=O)[C@@H](N)CCCC#N	ZINC000424100377	458557972	/nfs/dbraw/zinc/55/79/72/458557972.db2.gz	KQFDHFJCGDCPIT-NSHDSACASA-N	0	3	329.322	3.064	20	30		EGEDHN
N#CCOc1ccc(CN2CCCN(Cc3ccccc3)CC2)cc1	ZINC000264587151	455242532	/nfs/dbraw/zinc/24/25/32/455242532.db2.gz	XOBAQMZIIPHIMV-UHFFFAOYSA-N	0	3	335.451	3.297	20	30		EGEDHN
Cc1cccc([C@H](NCC(=O)N(CCC#N)CCC#N)C(C)(C)C)c1	ZINC000180801230	455248242	/nfs/dbraw/zinc/24/82/42/455248242.db2.gz	DKYWWJOIYLEKJU-IBGZPJMESA-N	0	3	340.471	3.328	20	30		EGEDHN
N#Cc1cc(Br)cnc1N[C@@H]1CCN(C2CCCC2)C1	ZINC000560201413	459311371	/nfs/dbraw/zinc/31/13/71/459311371.db2.gz	BIYACRKEQIGBTP-CYBMUJFWSA-N	0	3	335.249	3.145	20	30		EGEDHN
C[C@H]1CCC[C@@](C#N)(NC(=O)c2ccc(CN3CCCC3)cc2)C1	ZINC000265383320	455316817	/nfs/dbraw/zinc/31/68/17/455316817.db2.gz	QXUHCVUWQDVVLG-OXJNMPFZSA-N	0	3	325.456	3.485	20	30		EGEDHN
CC(F)(F)c1ccc(CNC[C@@H](O)COc2ccccc2C#N)cc1	ZINC000600738024	460585480	/nfs/dbraw/zinc/58/54/80/460585480.db2.gz	GUONRXASDGVPDO-QGZVFWFLSA-N	0	3	346.377	3.199	20	30		EGEDHN
CC(C)[C@H](NC[C@@H](O)COc1ccc(C#N)cc1)c1ccc(F)cc1	ZINC000023678037	453715537	/nfs/dbraw/zinc/71/55/37/453715537.db2.gz	CZATWODAYBBWGI-QUCCMNQESA-N	0	3	342.414	3.424	20	30		EGEDHN
C[C@H](NC[C@H](O)COc1ccc(CC#N)cc1)c1ccc(Cl)cc1	ZINC000025867560	453788418	/nfs/dbraw/zinc/78/84/18/453788418.db2.gz	AMFBRMZMAJNPHG-KSSFIOAISA-N	0	3	344.842	3.497	20	30		EGEDHN
N#Cc1ccccc1NC(=O)CCN1CCC[C@H](C(F)(F)F)C1	ZINC000028852717	453824906	/nfs/dbraw/zinc/82/49/06/453824906.db2.gz	ZLHPBLFAXPJSHM-ZDUSSCGKSA-N	0	3	325.334	3.161	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccccc1-c1ccccc1C#N)N1CCCC1	ZINC000052641452	453841149	/nfs/dbraw/zinc/84/11/49/453841149.db2.gz	KMMGHHYYJZLVNG-INIZCTEOSA-N	0	3	333.435	3.439	20	30		EGEDHN
CCOc1ccc(C2(CNC[C@H](C#N)CCC#N)CCOCC2)cc1	ZINC000066484193	453848304	/nfs/dbraw/zinc/84/83/04/453848304.db2.gz	YBHILUWVYPXYSU-KRWDZBQOSA-N	0	3	341.455	3.167	20	30		EGEDHN
CCN(CC)Cc1cccc(NC(=O)COc2ccc(C#N)cc2)c1	ZINC000031531566	453848467	/nfs/dbraw/zinc/84/84/67/453848467.db2.gz	LWUVUJVHLHGZDR-UHFFFAOYSA-N	0	3	337.423	3.418	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)c2ccc(OC[C@@H]3CCCO3)cc2)n1	ZINC000041521741	453969818	/nfs/dbraw/zinc/96/98/18/453969818.db2.gz	PWJOAKGQNJKFJV-HOTGVXAUSA-N	0	3	342.420	3.499	20	30		EGEDHN
CN1CCC(N(Cc2ccccc2)C(=O)c2cc(C#N)cs2)CC1	ZINC000084258933	453981429	/nfs/dbraw/zinc/98/14/29/453981429.db2.gz	ZAPCADRJAAJSLC-UHFFFAOYSA-N	0	3	339.464	3.356	20	30		EGEDHN
CCO[C@@H]1CCCN(CCC(=O)Nc2ccc(C#N)c(Cl)c2)C1	ZINC000076406167	453998342	/nfs/dbraw/zinc/99/83/42/453998342.db2.gz	DOWGMYKOMPTKLA-OAHLLOKOSA-N	0	3	335.835	3.041	20	30		EGEDHN
COc1cc(NC2CCN(CCCSCC#N)CC2)cc(OC)c1	ZINC000085869263	454040574	/nfs/dbraw/zinc/04/05/74/454040574.db2.gz	WQOYQQNHOFMBFB-UHFFFAOYSA-N	0	3	349.500	3.227	20	30		EGEDHN
Cc1ccc(C(=O)C(C#N)c2nc3cc(Cl)ccc3s2)c(=O)[nH]1	ZINC000068723270	454047505	/nfs/dbraw/zinc/04/75/05/454047505.db2.gz	ZAZMOAAOWCBICX-NSHDSACASA-N	0	3	343.795	3.437	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@H]2C[C@@H]2c2c(F)cccc2Cl)CC1	ZINC000076994582	454057746	/nfs/dbraw/zinc/05/77/46/454057746.db2.gz	RBFDULUUTRPDCF-KBPBESRZSA-N	0	3	336.838	3.349	20	30		EGEDHN
C[C@@H](NC(=O)N1CCN(CCC(C)(C)C)CC1)c1ccc(C#N)cc1	ZINC000056881852	454087630	/nfs/dbraw/zinc/08/76/30/454087630.db2.gz	MQNOWDXVCBSIGJ-MRXNPFEDSA-N	0	3	342.487	3.383	20	30		EGEDHN
CCc1ccc([C@H](CNc2ncc([N+](=O)[O-])cc2C#N)N(C)C)cc1	ZINC000070791256	454176291	/nfs/dbraw/zinc/17/62/91/454176291.db2.gz	SVUSBZJYTKBSCS-KRWDZBQOSA-N	0	3	339.399	3.139	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)[C@@H]2C[C@@H](OCC)C23CCC3)CC1	ZINC000119567960	454205513	/nfs/dbraw/zinc/20/55/13/454205513.db2.gz	HUQARQCGKAWJMW-QZTJIDSGSA-N	0	3	349.519	3.016	20	30		EGEDHN
C=C(C)COc1cc(CNc2ccn(CCN(C)C)n2)ccc1OC	ZINC000119735158	454216632	/nfs/dbraw/zinc/21/66/32/454216632.db2.gz	UIMLFWFGECQPIF-UHFFFAOYSA-N	0	3	344.459	3.020	20	30		EGEDHN
CCOC(=O)N(C)C1CCN(Cc2ccc(O[C@@H](C)C#N)cc2)CC1	ZINC000130842721	454221321	/nfs/dbraw/zinc/22/13/21/454221321.db2.gz	PVOMHDPNERBBED-HNNXBMFYSA-N	0	3	345.443	3.030	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(CN3C[C@@H](C)O[C@H](C)C3)CC2)CCC1	ZINC000191045063	455432154	/nfs/dbraw/zinc/43/21/54/455432154.db2.gz	ZPKXPBKINMYMQW-IAGOWNOFSA-N	0	3	334.504	3.081	20	30		EGEDHN
N#Cc1ccccc1OCCN1CCC([C@@H](O)c2ccccc2)CC1	ZINC000060466999	454292427	/nfs/dbraw/zinc/29/24/27/454292427.db2.gz	YAMIQWOHGHRXBR-NRFANRHFSA-N	0	3	336.435	3.383	20	30		EGEDHN
Cc1ncc([C@@H](C)NC2CCN(c3ccc(C#N)cn3)CC2)s1	ZINC000090407462	454300463	/nfs/dbraw/zinc/30/04/63/454300463.db2.gz	UFBKQUVKNKOGSB-GFCCVEGCSA-N	0	3	327.457	3.038	20	30		EGEDHN
Cc1cc(C(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)sc1C	ZINC000047010364	454317099	/nfs/dbraw/zinc/31/70/99/454317099.db2.gz	ABNBNWULKRGBDA-UHFFFAOYSA-N	0	3	341.480	3.441	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)NCC#Cc1ccccc1)c1ccccc1	ZINC000061228603	454332972	/nfs/dbraw/zinc/33/29/72/454332972.db2.gz	UUZJJSXQPYEDJX-OAQYLSRUSA-N	0	3	349.478	3.420	20	30		EGEDHN
CCN1CC[C@H]2CC[C@@H](C1)N2Cc1c(C#N)c(C)nn1-c1ccccc1	ZINC000091071988	454376686	/nfs/dbraw/zinc/37/66/86/454376686.db2.gz	AFSJKKQYPREWPZ-MJGOQNOKSA-N	0	3	349.482	3.111	20	30		EGEDHN
C[C@@H](CNC(=O)c1cccc(SCC#N)c1)N1CCC[C@@H](C)C1	ZINC000079531748	454432160	/nfs/dbraw/zinc/43/21/60/454432160.db2.gz	BHXYEPLMFINCFW-CABCVRRESA-N	0	3	331.485	3.152	20	30		EGEDHN
N#Cc1ccc(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)[nH]1	ZINC000133700240	454456648	/nfs/dbraw/zinc/45/66/48/454456648.db2.gz	SGSGTKMVVPMFCE-UHFFFAOYSA-N	0	3	338.411	3.003	20	30		EGEDHN
C[C@@H]1CCc2c(C(=O)C(C#N)C(=O)Nc3ccccn3)csc2C1	ZINC000102387405	454502611	/nfs/dbraw/zinc/50/26/11/454502611.db2.gz	VCPROIRKSMYFKZ-YPMHNXCESA-N	0	3	339.420	3.229	20	30		EGEDHN
COCCOc1ccc([C@H](C)NCc2ccc(C#N)cc2)cc1OC	ZINC000048715316	454510868	/nfs/dbraw/zinc/51/08/68/454510868.db2.gz	QJOHEMZWMLFQEX-HNNXBMFYSA-N	0	3	340.423	3.443	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2CNCc2ccc(C#N)cc2)C[C@@H](C)O1	ZINC000048816792	454517990	/nfs/dbraw/zinc/51/79/90/454517990.db2.gz	BFUNZJBQBJZNFQ-QZTJIDSGSA-N	0	3	349.478	3.457	20	30		EGEDHN
COc1ccccc1N(CCC#N)C(=O)[C@H](C)N(C)CCC(C)C	ZINC000080071812	454528511	/nfs/dbraw/zinc/52/85/11/454528511.db2.gz	PORLYQQOXPWXFS-INIZCTEOSA-N	0	3	331.460	3.308	20	30		EGEDHN
C=CCSCCNC(=O)N[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000080104215	454533578	/nfs/dbraw/zinc/53/35/78/454533578.db2.gz	VOFHXMKRYDEZLE-WMZOPIPTSA-N	0	3	347.528	3.258	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)c1ccc(OC)cc1	ZINC000103504671	454561576	/nfs/dbraw/zinc/56/15/76/454561576.db2.gz	JVDYSTAZGCMTOT-OAHLLOKOSA-N	0	3	338.363	3.055	20	30		EGEDHN
Cc1ccc(Cl)c(OC[C@@H](O)CN(C)Cc2ccc(C#N)cc2)c1	ZINC000182194335	455458596	/nfs/dbraw/zinc/45/85/96/455458596.db2.gz	AEHSBCJSQDPWAQ-KRWDZBQOSA-N	0	3	344.842	3.392	20	30		EGEDHN
Cc1nn(-c2ccc(C#N)cc2)c(NC(=O)C(C)C(F)(F)F)c1C	ZINC000080421843	454577905	/nfs/dbraw/zinc/57/79/05/454577905.db2.gz	ZYKHWEMOMWMEQP-JTQLQIEISA-N	0	3	336.317	3.498	20	30		EGEDHN
CC(C)(CCC#N)CN1CCCN(C(=O)CCc2ccccc2)CC1	ZINC000092534889	454583340	/nfs/dbraw/zinc/58/33/40/454583340.db2.gz	YSYYGBCLYWFKEE-UHFFFAOYSA-N	0	3	341.499	3.483	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN2CCC(OC[C@@H]3CCCO3)CC2)cc1	ZINC000092661693	454604753	/nfs/dbraw/zinc/60/47/53/454604753.db2.gz	SKOFNOISIRGTAG-JXFKEZNVSA-N	0	3	344.455	3.137	20	30		EGEDHN
C#CCCOc1ccc(CN2CCC(OC[C@H]3CCCO3)CC2)cc1	ZINC000092662047	454605266	/nfs/dbraw/zinc/60/52/66/454605266.db2.gz	ZGCYSFDZBJBJOS-OAQYLSRUSA-N	0	3	343.467	3.249	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000135096600	454633202	/nfs/dbraw/zinc/63/32/02/454633202.db2.gz	YRHJHTDHCMZCJX-CTNGQTDRSA-N	0	3	344.499	3.151	20	30		EGEDHN
CNC(=O)c1ccc(CN(C)Cc2ccccc2C(C)(C)C#N)cc1	ZINC000135107526	454634875	/nfs/dbraw/zinc/63/48/75/454634875.db2.gz	CVIPPWIPOOBGSL-UHFFFAOYSA-N	0	3	335.451	3.479	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CCC[C@@H](N2CCCC2=O)C1	ZINC000135217202	454647122	/nfs/dbraw/zinc/64/71/22/454647122.db2.gz	OAWJNDJYUNPWEW-QGZVFWFLSA-N	0	3	325.456	3.075	20	30		EGEDHN
COc1ccc(CN2CC[C@@H]3[C@H](CCCN3C3CC3)C2)cc1C#N	ZINC000135217558	454648751	/nfs/dbraw/zinc/64/87/51/454648751.db2.gz	MLRRCRHILBKALL-VQIMIIECSA-N	0	3	325.456	3.016	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN2CCC[C@@H]2c2cccs2)cc1	ZINC000105674192	454651096	/nfs/dbraw/zinc/65/10/96/454651096.db2.gz	NSQNREJSIXMHHZ-NVXWUHKLSA-N	0	3	328.437	3.197	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cccc(OCC(C)C)c2)CC1	ZINC000106040124	454675656	/nfs/dbraw/zinc/67/56/56/454675656.db2.gz	ZIPMXAYQQQAPTL-UHFFFAOYSA-N	0	3	330.472	3.492	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(F)c(F)cc2Cl)CC1	ZINC000106039904	454675841	/nfs/dbraw/zinc/67/58/41/454675841.db2.gz	FYDWHNXYQCAAJV-UHFFFAOYSA-N	0	3	328.790	3.389	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCCc2ccccc2Cl)CC1	ZINC000106267394	454688865	/nfs/dbraw/zinc/68/88/65/454688865.db2.gz	ZQMGOWLSUZSIMT-UHFFFAOYSA-N	0	3	335.879	3.222	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CC[C@@H](c3ccccc3)C2)CC1	ZINC000106275746	454689439	/nfs/dbraw/zinc/68/94/39/454689439.db2.gz	OCHCLAOLYRWTJA-GOSISDBHSA-N	0	3	327.472	3.226	20	30		EGEDHN
CN(Cc1ccccc1)[C@H]1CCN(C(=O)C2(C#N)CCCCC2)C1	ZINC000081129265	454690428	/nfs/dbraw/zinc/69/04/28/454690428.db2.gz	KWAAYMQWWMUOMV-SFHVURJKSA-N	0	3	325.456	3.193	20	30		EGEDHN
C=CCc1cc(CN2CC[C@H](Oc3ccncc3)C2)cc(OC)c1O	ZINC000093865890	454740503	/nfs/dbraw/zinc/74/05/03/454740503.db2.gz	UWVSNAGOKJUTTQ-SFHVURJKSA-N	0	3	340.423	3.178	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cccc(OC(F)(F)F)c2)CC1	ZINC000152979870	454749645	/nfs/dbraw/zinc/74/96/45/454749645.db2.gz	XIOXZFIXHUNSJU-UHFFFAOYSA-N	0	3	342.361	3.356	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000136942713	454762202	/nfs/dbraw/zinc/76/22/02/454762202.db2.gz	YHHXCVFTEHNJIX-LJQANCHMSA-N	0	3	339.395	3.412	20	30		EGEDHN
CC[C@@H](NCc1cccc(C#N)c1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000153641159	454816432	/nfs/dbraw/zinc/81/64/32/454816432.db2.gz	YJFFXCASBYPJCS-YADHBBJMSA-N	0	3	349.478	3.327	20	30		EGEDHN
C=CC1CCN(CC(=O)N(C)Cc2ccc(OC(F)F)cc2)CC1	ZINC000111259798	454860584	/nfs/dbraw/zinc/86/05/84/454860584.db2.gz	DFPSAGIDKKLICU-UHFFFAOYSA-N	0	3	338.398	3.144	20	30		EGEDHN
CSc1cccc(N(C(=O)CSCC#N)C2CCN(C)CC2)c1	ZINC000112247680	454882919	/nfs/dbraw/zinc/88/29/19/454882919.db2.gz	MYWBIKCJCQEZMQ-UHFFFAOYSA-N	0	3	349.525	3.092	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H]2C[C@H]2c2ccc(F)cc2F)CC1	ZINC000112905833	454905405	/nfs/dbraw/zinc/90/54/05/454905405.db2.gz	HFUDPFBOIFDQKB-IRXDYDNUSA-N	0	3	334.410	3.225	20	30		EGEDHN
COc1ccc(CN2CCN(CC(C)C)CC2)cc1OCCCC#N	ZINC000170874307	454992256	/nfs/dbraw/zinc/99/22/56/454992256.db2.gz	LZZDZYFXUANLNX-UHFFFAOYSA-N	0	3	345.487	3.151	20	30		EGEDHN
CCO[C@H]1CCCN(Cc2ccc(OC)c(OCCCC#N)c2)C1	ZINC000155458117	455004098	/nfs/dbraw/zinc/00/40/98/455004098.db2.gz	LWGHZYKXMOBBNR-KRWDZBQOSA-N	0	3	332.444	3.379	20	30		EGEDHN
COc1ccc([C@H](NCC(=O)Nc2ccc(C#N)cc2)C(C)C)cc1	ZINC000171124630	455033511	/nfs/dbraw/zinc/03/35/11/455033511.db2.gz	CPHKTCDLHAHBPA-HXUWFJFHSA-N	0	3	337.423	3.492	20	30		EGEDHN
C[C@@H](NCC(=O)N[C@](C)(C#N)C1CC1)c1ccc2c(c1)CCCC2	ZINC000128214718	455035435	/nfs/dbraw/zinc/03/54/35/455035435.db2.gz	JYCJCNNXCHTENO-JLTOFOAXSA-N	0	3	325.456	3.024	20	30		EGEDHN
C[C@@H](CNC(=O)Nc1cc(C#N)cn1C(C)(C)C)N1CCC[C@@H](C)C1	ZINC000171146859	455036414	/nfs/dbraw/zinc/03/64/14/455036414.db2.gz	VVTVVHJWEGERMD-CABCVRRESA-N	0	3	345.491	3.357	20	30		EGEDHN
C#CCN1CCC(C(=O)NCCc2cccc(-c3ccccc3)c2)CC1	ZINC000155750126	455039737	/nfs/dbraw/zinc/03/97/37/455039737.db2.gz	VGWZEVSVABWHRY-UHFFFAOYSA-N	0	3	346.474	3.358	20	30		EGEDHN
CC(C)(CCC#N)C[NH+]1CCC(C(=O)Nc2ccccc2[O-])CC1	ZINC000179768420	455077134	/nfs/dbraw/zinc/07/71/34/455077134.db2.gz	UFIRSZJZYNZEAG-UHFFFAOYSA-N	0	3	329.444	3.373	20	30		EGEDHN
C=CCN1CCC(NC(=O)Cc2cc(Cl)ccc2Cl)CC1	ZINC000171717323	455088555	/nfs/dbraw/zinc/08/85/55/455088555.db2.gz	XEGDTHNJHZXDOD-UHFFFAOYSA-N	0	3	327.255	3.303	20	30		EGEDHN
C[C@@H]1C[C@@H]1[C@H](NCCC(=O)N(C)CCC#N)c1ccc(Cl)cc1	ZINC000180016336	455116571	/nfs/dbraw/zinc/11/65/71/455116571.db2.gz	CPGRNMVXDALQSD-RPVQJOFSSA-N	0	3	333.863	3.389	20	30		EGEDHN
Cn1cc(CNCCSC(F)(F)F)c(-c2ccc(C#N)cc2)n1	ZINC000180071986	455127097	/nfs/dbraw/zinc/12/70/97/455127097.db2.gz	JRMCANWAUOZYDO-UHFFFAOYSA-N	0	3	340.374	3.301	20	30		EGEDHN
Cc1ccccc1[C@H](NCC(=O)N[C@@](C)(C#N)C1CC1)C(C)(C)C	ZINC000180084500	455129334	/nfs/dbraw/zinc/12/93/34/455129334.db2.gz	ZPTCFQFTLRIMOM-ICSRJNTNSA-N	0	3	327.472	3.480	20	30		EGEDHN
C=CCCCN1CCN(CCCc2nc(-c3cccs3)no2)CC1	ZINC000172174293	455131658	/nfs/dbraw/zinc/13/16/58/455131658.db2.gz	DZJSMYLYUALVMX-UHFFFAOYSA-N	0	3	346.500	3.315	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](c2ccccc2C)C2CC2)CC1	ZINC000264851420	455292419	/nfs/dbraw/zinc/29/24/19/455292419.db2.gz	LRXNDPKXHVBUDA-LJQANCHMSA-N	0	3	327.472	3.396	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)N1CC[C@H](N2CCCCC2)C1	ZINC000264813943	455286481	/nfs/dbraw/zinc/28/64/81/455286481.db2.gz	GLYXHZUCLMYGNP-SFHVURJKSA-N	0	3	343.471	3.021	20	30		EGEDHN
C[C@H]1CCC[C@](C#N)(NC(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000265370303	455313675	/nfs/dbraw/zinc/31/36/75/455313675.db2.gz	OBOZPEGURBKJKX-UWJYYQICSA-N	0	3	339.483	3.487	20	30		EGEDHN
CCOC(=O)CCCCCN(CCOC)Cc1ccc(C#N)cc1	ZINC000265507334	455335660	/nfs/dbraw/zinc/33/56/60/455335660.db2.gz	ZAMYSCFHDUEICT-UHFFFAOYSA-N	0	3	332.444	3.130	20	30		EGEDHN
C[C@H](NCc1ccnc(N2CCCC2)c1)c1ccc(OCC#N)cc1	ZINC000181458764	455337105	/nfs/dbraw/zinc/33/71/05/455337105.db2.gz	HGVHSAMXOUNAFM-INIZCTEOSA-N	0	3	336.439	3.435	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCc2ccc(OCCC)cc2C)CC1	ZINC000190562591	455344509	/nfs/dbraw/zinc/34/45/09/455344509.db2.gz	WGTFAAKOAJBUPW-UHFFFAOYSA-N	0	3	345.487	3.233	20	30		EGEDHN
Cc1ccccc1C[C@@H](C)N[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000190626043	455355494	/nfs/dbraw/zinc/35/54/94/455355494.db2.gz	BJANWHQEERHHGU-UTKZUKDTSA-N	0	3	347.462	3.188	20	30		EGEDHN
C[C@@H](NCC(=O)N[C@](C)(C#N)C1CC1)c1cc2ccccc2s1	ZINC000184365981	455373528	/nfs/dbraw/zinc/37/35/28/455373528.db2.gz	ITLTWXNYQJJDQP-KZULUSFZSA-N	0	3	327.453	3.360	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@H]1CCCC[C@@H]1NCc1ccc(C#N)o1	ZINC000174564858	455403979	/nfs/dbraw/zinc/40/39/79/455403979.db2.gz	DKMBMXQZQCMMBS-BBRMVZONSA-N	0	3	333.432	3.324	20	30		EGEDHN
CN1CCC(C(=O)Nc2cccc(OCc3cccc(C#N)c3)c2)CC1	ZINC000174634963	455408010	/nfs/dbraw/zinc/40/80/10/455408010.db2.gz	USQUIUKTDGQLRE-UHFFFAOYSA-N	0	3	349.434	3.418	20	30		EGEDHN
COc1cc(NCCN[C@H](C)c2ccc(C#N)cc2)cc(OC)c1	ZINC000182056733	455425266	/nfs/dbraw/zinc/42/52/66/455425266.db2.gz	SQRYLAKMWVCULM-CQSZACIVSA-N	0	3	325.412	3.338	20	30		EGEDHN
COCCC1(CN[C@H](C)C(=O)Nc2cccc(C#N)c2)CCCCC1	ZINC000184718236	455436406	/nfs/dbraw/zinc/43/64/06/455436406.db2.gz	DBHQPDSZPVHNBL-MRXNPFEDSA-N	0	3	343.471	3.462	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC(C)(C)c2ccc(F)c(F)c2)CC1	ZINC000175513217	455456913	/nfs/dbraw/zinc/45/69/13/455456913.db2.gz	BEJFOVPKUYRNTC-UHFFFAOYSA-N	0	3	337.414	3.150	20	30		EGEDHN
C=CCN(Cc1ccccc1)C[C@@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000182207303	455460604	/nfs/dbraw/zinc/46/06/04/455460604.db2.gz	AYKLUDFPTXDOQC-QGZVFWFLSA-N	0	3	342.395	3.023	20	30		EGEDHN
C[C@@H](N[C@H](Cc1ccccc1)c1cccs1)C(=O)N(C)CCC#N	ZINC000184988696	455482956	/nfs/dbraw/zinc/48/29/56/455482956.db2.gz	ZRADGRSVSZADEM-NVXWUHKLSA-N	0	3	341.480	3.382	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H](CNC(=O)c1cccc(C#N)c1)C1CC1	ZINC000185324295	455540214	/nfs/dbraw/zinc/54/02/14/455540214.db2.gz	RRPMFFGGYJUDPA-FQEVSTJZSA-N	0	3	333.435	3.199	20	30		EGEDHN
C[C@@H]1CN(CCC2CCN(CC#Cc3ccccc3)CC2)C[C@@H](C)O1	ZINC000192061177	455551344	/nfs/dbraw/zinc/55/13/44/455551344.db2.gz	LVWBLERJXYIZHD-WOJBJXKFSA-N	0	3	340.511	3.249	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1CCN(C2CCC2)C[C@H](C)C1	ZINC000292231798	455602368	/nfs/dbraw/zinc/60/23/68/455602368.db2.gz	CKSFURTYGYRIQZ-INIZCTEOSA-N	0	3	328.456	3.198	20	30		EGEDHN
CCOc1cc(N2CCN(C)CC2)ccc1N[C@H]1CCC[C@H](C#N)C1	ZINC000185731058	455609212	/nfs/dbraw/zinc/60/92/12/455609212.db2.gz	QNWPVPAVIHETJT-IRXDYDNUSA-N	0	3	342.487	3.331	20	30		EGEDHN
N#CCC[C@@H](NC(=O)NC[C@H]1CCCCN1C1CC1)c1ccccc1	ZINC000277669308	455629601	/nfs/dbraw/zinc/62/96/01/455629601.db2.gz	ZUIJHPFMLXPZST-RTBURBONSA-N	0	3	340.471	3.348	20	30		EGEDHN
C=CCOc1ccc(CNC[C@@H]2COC3(CCCC3)O2)cc1OC	ZINC000271448787	455640585	/nfs/dbraw/zinc/64/05/85/455640585.db2.gz	RHHSCCJZEWPQHP-MRXNPFEDSA-N	0	3	333.428	3.035	20	30		EGEDHN
N#Cc1nnc2ccccc2c1NCC1CCN(c2ccncc2)CC1	ZINC000271453107	455642392	/nfs/dbraw/zinc/64/23/92/455642392.db2.gz	PZHCLRIYILASBB-UHFFFAOYSA-N	0	3	344.422	3.225	20	30		EGEDHN
C[C@H](NCC1(c2ccc(F)cc2F)CCCC1)C(=O)N(C)CCC#N	ZINC000186064195	455687787	/nfs/dbraw/zinc/68/77/87/455687787.db2.gz	SCAKPVDECANSDT-AWEZNQCLSA-N	0	3	349.425	3.127	20	30		EGEDHN
COc1ccc([C@H](OC)[C@H](C)NCc2ccc(OC)c(C#N)c2)cc1	ZINC000271589474	455694291	/nfs/dbraw/zinc/69/42/91/455694291.db2.gz	WPTDZDXZLHPKBH-VBKZILBWSA-N	0	3	340.423	3.441	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N1CCC(CC(=O)N2CCCC2)CC1	ZINC000186160506	455706027	/nfs/dbraw/zinc/70/60/27/455706027.db2.gz	RMVJVECKAKLNGY-MRXNPFEDSA-N	0	3	325.456	3.344	20	30		EGEDHN
CC[C@H](N[C@H](C)C(=O)N(CCC#N)c1ccc(F)cc1)[C@H]1CCCO1	ZINC000248605409	455722190	/nfs/dbraw/zinc/72/21/90/455722190.db2.gz	OYRHHNGWHKURHQ-FHLIZLRMSA-N	0	3	347.434	3.008	20	30		EGEDHN
CC(C)(C)[C@@H](NCCC(C#N)(c1ccccc1)c1ccccc1)C(N)=O	ZINC000193071084	455740051	/nfs/dbraw/zinc/74/00/51/455740051.db2.gz	YFFQMWVYGWJPPS-IBGZPJMESA-N	0	3	349.478	3.376	20	30		EGEDHN
C=C(C)COc1cccc(NC(=O)N2CC[C@]3(CCN(C)C3)C2)c1	ZINC000292868239	455763817	/nfs/dbraw/zinc/76/38/17/455763817.db2.gz	HJKYIGZGHGQPFA-IBGZPJMESA-N	0	3	329.444	3.201	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1CCC[C@H]1CCc1ccccc1	ZINC000249687515	455766792	/nfs/dbraw/zinc/76/67/92/455766792.db2.gz	RVPYCMYHOXCINR-MJGOQNOKSA-N	0	3	327.472	3.092	20	30		EGEDHN
COc1ccccc1[C@H](CC(C)C)NCCC(=O)N(C)CCC#N	ZINC000271811409	455769930	/nfs/dbraw/zinc/76/99/30/455769930.db2.gz	RTDIDINMCAWZQJ-KRWDZBQOSA-N	0	3	331.460	3.134	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCc3cccc(F)c3[C@H]2C)CC1	ZINC000606511486	460690254	/nfs/dbraw/zinc/69/02/54/460690254.db2.gz	XWQKTTLSDLUCIY-CQSZACIVSA-N	0	3	331.435	3.105	20	30		EGEDHN
COc1ccc2c(c1)OC[C@H](N[C@H](C)c1ccc(OCC#N)cc1)C2	ZINC000271899418	455797659	/nfs/dbraw/zinc/79/76/59/455797659.db2.gz	VFXOOHWRBHEVLX-RHSMWYFYSA-N	0	3	338.407	3.252	20	30		EGEDHN
C=CCOCCN1CCC(O)(c2ccccc2C(F)(F)F)CC1	ZINC000293944804	455801159	/nfs/dbraw/zinc/80/11/59/455801159.db2.gz	BJLABXRJNJJQRU-UHFFFAOYSA-N	0	3	329.362	3.191	20	30		EGEDHN
Cc1ccc([C@@H](CNC(=O)[C@]2(C#N)CC23CCCC3)N(C)C)cc1	ZINC000294652432	455822747	/nfs/dbraw/zinc/82/27/47/455822747.db2.gz	HQEKUKYYOFYTNI-YLJYHZDGSA-N	0	3	325.456	3.188	20	30		EGEDHN
C=CCOCCN1CCC(O)(c2cccc(OC(F)(F)F)c2)CC1	ZINC000294742345	455826833	/nfs/dbraw/zinc/82/68/33/455826833.db2.gz	XAENIJWEKQSAHM-UHFFFAOYSA-N	0	3	345.361	3.071	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1c2ccc(C)cc2[C@H]2CN(C)CC[C@H]21	ZINC000253384791	455837420	/nfs/dbraw/zinc/83/74/20/455837420.db2.gz	QDZMAONZQTYNNO-SZVBFZGTSA-N	0	3	328.456	3.111	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cscc2Br)CC1	ZINC000285404148	455838135	/nfs/dbraw/zinc/83/81/35/455838135.db2.gz	PBGLWZOGYLEQPI-UHFFFAOYSA-N	0	3	343.290	3.281	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN[C@@H](c1ccc(F)c(C)c1)C1CC1	ZINC000272125028	455852615	/nfs/dbraw/zinc/85/26/15/455852615.db2.gz	UTTRFIORDIOGHP-BFUOFWGJSA-N	0	3	331.435	3.183	20	30		EGEDHN
C=CCc1cc(CNC[C@]2(O)CCc3ccccc32)cc(OC)c1O	ZINC000269814547	455853530	/nfs/dbraw/zinc/85/35/30/455853530.db2.gz	NMKQJMONVQLPMI-OAQYLSRUSA-N	0	3	339.435	3.053	20	30		EGEDHN
C#CCN1CCC(C(=O)NC[C@@H]2C[C@@H](C(C)C)c3ccccc32)CC1	ZINC000279104602	455858058	/nfs/dbraw/zinc/85/80/58/455858058.db2.gz	DCYZRCVVRCXUAK-RXVVDRJESA-N	0	3	338.495	3.375	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N2CCCN(C3CCCC3)CC2)cc1	ZINC000295829280	455860443	/nfs/dbraw/zinc/86/04/43/455860443.db2.gz	MKAYGBNEIWQVGY-UHFFFAOYSA-N	0	3	340.467	3.179	20	30		EGEDHN
Cc1cccc(OC[C@@H](C)NC(=O)C(C#N)Cc2ccc(C#N)cc2)c1	ZINC000279291169	455862630	/nfs/dbraw/zinc/86/26/30/455862630.db2.gz	LCENJIJILCAXBC-APWZRJJASA-N	0	3	347.418	3.133	20	30		EGEDHN
C=CC[C@H](C)[C@H](C)N[C@H](C(N)=O)c1cccc(Br)c1	ZINC000279685498	455870676	/nfs/dbraw/zinc/87/06/76/455870676.db2.gz	PEPKTGCGWOCTLK-MJVIPROJSA-N	0	3	325.250	3.166	20	30		EGEDHN
N#Cc1ccc(CN(C[C@@H](O)COc2ccc(F)cc2)C2CC2)cc1	ZINC000194961397	455905163	/nfs/dbraw/zinc/90/51/63/455905163.db2.gz	WHQXBNNUAVHVFG-LJQANCHMSA-N	0	3	340.398	3.102	20	30		EGEDHN
N#CCc1ccc(C(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1	ZINC000270232686	455908115	/nfs/dbraw/zinc/90/81/15/455908115.db2.gz	OYWNYDHWMWJKNN-HXUWFJFHSA-N	0	3	333.435	3.320	20	30		EGEDHN
C=CCOc1cccc(NC(=O)N(C)[C@@H](C)C2CCN(C)CC2)c1	ZINC000272306812	455908337	/nfs/dbraw/zinc/90/83/37/455908337.db2.gz	FDOTZGXACOYEEK-HNNXBMFYSA-N	0	3	331.460	3.445	20	30		EGEDHN
COc1ccc(CN2CCC(C)(OC)CC2)cc1OCCCC#N	ZINC000272320515	455912778	/nfs/dbraw/zinc/91/27/78/455912778.db2.gz	AKVZVRKKDWSDEM-UHFFFAOYSA-N	0	3	332.444	3.379	20	30		EGEDHN
N#Cc1c(F)cccc1C(=O)NC[C@H](c1ccccc1)N1CCCC1	ZINC000187506082	455919060	/nfs/dbraw/zinc/91/90/60/455919060.db2.gz	OJGSZGGRQMDQEW-LJQANCHMSA-N	0	3	337.398	3.264	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)C1CCN(C2CC2)CC1	ZINC000195340757	455946696	/nfs/dbraw/zinc/94/66/96/455946696.db2.gz	XCWVMBCQFVKGTQ-UHFFFAOYSA-N	0	3	325.456	3.170	20	30		EGEDHN
N#CCCCOc1cccc(NC(=O)C2CCN(C3CC3)CC2)c1	ZINC000195365582	455952030	/nfs/dbraw/zinc/95/20/30/455952030.db2.gz	ZPSWNJGMNASFOJ-UHFFFAOYSA-N	0	3	327.428	3.182	20	30		EGEDHN
C[C@@H](OC[C@H](O)CN1CCC(C)(C#N)CC1)c1ccc(Cl)cc1	ZINC000272505101	455974500	/nfs/dbraw/zinc/97/45/00/455974500.db2.gz	FEKJGWJUMJHZOD-RHSMWYFYSA-N	0	3	336.863	3.404	20	30		EGEDHN
CN1CCN(CCCOc2cccc(C#N)c2)[C@@H](c2ccccc2)C1	ZINC000195577823	455986967	/nfs/dbraw/zinc/98/69/67/455986967.db2.gz	LWNJYMJCLBXFGR-OAQYLSRUSA-N	0	3	335.451	3.316	20	30		EGEDHN
Cc1ccnc(N2CC[C@@]3(CCN(Cc4ccccc4)C3)C2)c1C#N	ZINC000286197454	455998621	/nfs/dbraw/zinc/99/86/21/455998621.db2.gz	BMBJTEQIBHRZLL-OAQYLSRUSA-N	0	3	332.451	3.364	20	30		EGEDHN
CCCO[C@@H]1CCCN(C(=O)C(C#N)Cc2ccc(C#N)cc2)CC1	ZINC000280555309	455998736	/nfs/dbraw/zinc/99/87/36/455998736.db2.gz	UOINVWVQZSDYGR-RBUKOAKNSA-N	0	3	339.439	3.048	20	30		EGEDHN
CC(C)(C)c1nnc(CNC(=N)Nc2cc(F)ccc2F)s1	ZINC000262234444	456015410	/nfs/dbraw/zinc/01/54/10/456015410.db2.gz	AAWUTSWREMPCKW-UHFFFAOYSA-N	0	3	325.388	3.041	20	30		EGEDHN
C=CCC[C@H](NC(=O)Nc1ccnn1CCN(C)C)c1ccccc1	ZINC000296721720	456019372	/nfs/dbraw/zinc/01/93/72/456019372.db2.gz	BIXKMBIYZQZMCQ-KRWDZBQOSA-N	0	3	341.459	3.274	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1CNCc1cccc(OC)c1OC(F)F	ZINC000280724698	456039356	/nfs/dbraw/zinc/03/93/56/456039356.db2.gz	VGNPGTUSVLDGTA-DZGCQCFKSA-N	0	3	327.371	3.367	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H](CC)[C@@H](O)C(F)(F)F)cc1OC	ZINC000271018983	456099325	/nfs/dbraw/zinc/09/93/25/456099325.db2.gz	ULLNSSNTAIMLHF-SWLSCSKDSA-N	0	3	333.350	3.051	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H]2CC[C@@H](c3cccc(F)c3)C2)CC1	ZINC000281005020	456107252	/nfs/dbraw/zinc/10/72/52/456107252.db2.gz	WFFJKUXIVFACOM-VQIMIIECSA-N	0	3	345.462	3.411	20	30		EGEDHN
CC(C)(C)c1nccc(N2CCCN(Cc3ccc(C#N)cc3)CC2)n1	ZINC000301456174	456120638	/nfs/dbraw/zinc/12/06/38/456120638.db2.gz	WXODDVPHQXGKPM-UHFFFAOYSA-N	0	3	349.482	3.358	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cnn(C3CCCCC3)c2C)CC1	ZINC000272946288	456120727	/nfs/dbraw/zinc/12/07/27/456120727.db2.gz	LAXZHKJVSQRCSH-UHFFFAOYSA-N	0	3	344.503	3.467	20	30		EGEDHN
Cc1ncsc1CON=C(N)c1cccc(CN2CCCCC2)c1	ZINC000289448937	456125963	/nfs/dbraw/zinc/12/59/63/456125963.db2.gz	UPFGUMVVQSAHBY-UHFFFAOYSA-N	0	3	344.484	3.275	20	30		EGEDHN
CCN1CCN([C@H](C)CNc2ccc(C#N)c(C(F)(F)F)c2)CC1	ZINC000301507177	456133212	/nfs/dbraw/zinc/13/32/12/456133212.db2.gz	HHZHDUSNXYKXKZ-CYBMUJFWSA-N	0	3	340.393	3.015	20	30		EGEDHN
Cc1ccc2c(c1)[C@H]1CN(C)CC[C@H]1N2C(=O)c1ccc(C#N)c(C)n1	ZINC000281139252	456143141	/nfs/dbraw/zinc/14/31/41/456143141.db2.gz	WULFZCCJXOELLZ-YLJYHZDGSA-N	0	3	346.434	3.018	20	30		EGEDHN
C=CCN1CC[C@@H](N[C@H](C)c2ccc(OCC(F)(F)F)cc2)C1=O	ZINC000281219568	456169595	/nfs/dbraw/zinc/16/95/95/456169595.db2.gz	OJEJCDJFTZOKBG-IUODEOHRSA-N	0	3	342.361	3.065	20	30		EGEDHN
CN(C)[C@H](CNc1nccc(C#N)c1[N+](=O)[O-])c1ccc(Cl)cc1	ZINC000301658823	456177739	/nfs/dbraw/zinc/17/77/39/456177739.db2.gz	LZIZCLIPOSMZBQ-CQSZACIVSA-N	0	3	345.790	3.230	20	30		EGEDHN
C=CC[C@@H](CC)NC(=O)N(Cc1ccncc1)C[C@H]1CCCN1CC	ZINC000281342080	456207179	/nfs/dbraw/zinc/20/71/79/456207179.db2.gz	MADCDABPILEEIY-RTBURBONSA-N	0	3	344.503	3.432	20	30		EGEDHN
C[C@H](C#N)Oc1ccccc1NC(=O)N(C)[C@H](C)C1CCN(C)CC1	ZINC000273354597	456225640	/nfs/dbraw/zinc/22/56/40/456225640.db2.gz	BQSNPAOUKUQKMD-HUUCEWRRSA-N	0	3	344.459	3.171	20	30		EGEDHN
CCN(CC)S(=O)(=O)c1ccc([C@H](C)N[C@@H]2CC[C@H](C#N)C2)cc1	ZINC000274593875	456262510	/nfs/dbraw/zinc/26/25/10/456262510.db2.gz	FURHFENVGFQVOM-YQQAZPJKSA-N	0	3	349.500	3.060	20	30		EGEDHN
Cc1ccc([C@H](CCn2cncn2)NCc2cccc(C#N)c2)cc1	ZINC000275708615	456291912	/nfs/dbraw/zinc/29/19/12/456291912.db2.gz	MOSHTINBEYNHBV-FQEVSTJZSA-N	0	3	331.423	3.379	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)[C@@H]1CCCC(F)(F)C1	ZINC000281767128	456314310	/nfs/dbraw/zinc/31/43/10/456314310.db2.gz	CZYWYUXQNJESMU-QGZVFWFLSA-N	0	3	349.425	3.274	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)s1)[C@@H](c1ccccc1)N1CCOCC1	ZINC000342947664	456332080	/nfs/dbraw/zinc/33/20/80/456332080.db2.gz	SYXYSPVZRIWQGU-KXBFYZLASA-N	0	3	341.480	3.171	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)c1cnc2ccccc2n1	ZINC000347730377	456333926	/nfs/dbraw/zinc/33/39/26/456333926.db2.gz	YYQPSHRUKRFWNB-UHFFFAOYSA-N	0	3	331.423	3.070	20	30		EGEDHN
CCC[C@]1(C(=O)OCC)CCCN1CCCC1(C#N)CCOCC1	ZINC000337266992	456342624	/nfs/dbraw/zinc/34/26/24/456342624.db2.gz	ZRVSDSPCTMAUDA-LJQANCHMSA-N	0	3	336.476	3.285	20	30		EGEDHN
CC(C#N)C(=O)N1CCN(c2ccc(C(F)(F)F)cc2Cl)CC1	ZINC000343042300	456368125	/nfs/dbraw/zinc/36/81/25/456368125.db2.gz	MBZUWGMZBNDMGD-JTQLQIEISA-N	0	3	345.752	3.167	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1ccc(F)c(C#N)c1)C(C)C	ZINC000352861140	456370921	/nfs/dbraw/zinc/37/09/21/456370921.db2.gz	IXRFXMMAACNMLP-SFHVURJKSA-N	0	3	329.419	3.126	20	30		EGEDHN
NC(=NOCc1ccc(F)cn1)c1cccc(CN2CCCCC2)c1	ZINC000276098874	456387754	/nfs/dbraw/zinc/38/77/54/456387754.db2.gz	RXGMTUAKKZJRSQ-UHFFFAOYSA-N	0	3	342.418	3.044	20	30		EGEDHN
COc1ccccc1[C@@H](CNCc1ccc(C#N)cc1F)N(C)C	ZINC000343079470	456392043	/nfs/dbraw/zinc/39/20/43/456392043.db2.gz	PUCYEEAMKVSPMM-GOSISDBHSA-N	0	3	327.403	3.098	20	30		EGEDHN
Cc1oc([N-]C(=O)[C@H](C)[NH2+][C@@H]2CCCC23CCOCC3)c(C#N)c1C	ZINC000282064956	456405656	/nfs/dbraw/zinc/40/56/56/456405656.db2.gz	MURWDVCUSNBZCM-XJKSGUPXSA-N	0	3	345.443	3.034	20	30		EGEDHN
C=CCCc1ccccc1NC(=O)NC[C@@H](O)CN1CCC(C)CC1	ZINC000337608554	456420082	/nfs/dbraw/zinc/42/00/82/456420082.db2.gz	RVMCKSWJXJYWCP-GOSISDBHSA-N	0	3	345.487	3.020	20	30		EGEDHN
N#Cc1ccc(C(=O)NCCN2CCC3(CCCCC3)CC2)cc1	ZINC000337720669	456504374	/nfs/dbraw/zinc/50/43/74/456504374.db2.gz	JQPDWMYGTZDYEM-UHFFFAOYSA-N	0	3	325.456	3.334	20	30		EGEDHN
CN(C)Cc1ccc(-c2noc(-c3cc(C#N)cc(N(C)C)c3)n2)cc1	ZINC000340581353	456544365	/nfs/dbraw/zinc/54/43/65/456544365.db2.gz	XVHXWAHEHAWFIS-UHFFFAOYSA-N	0	3	347.422	3.403	20	30		EGEDHN
COc1cc([C@@H](C)N[C@H](C)c2cccc(C#N)c2)ccc1OCCO	ZINC000305756560	456555178	/nfs/dbraw/zinc/55/51/78/456555178.db2.gz	AIXUAMVDZCIOQO-HUUCEWRRSA-N	0	3	340.423	3.350	20	30		EGEDHN
C=CCOc1ccc(CN[C@H]2CC(=O)N3CCCC[C@@H]23)cc1Cl	ZINC000337847758	456569818	/nfs/dbraw/zinc/56/98/18/456569818.db2.gz	IISLVBWISSZNMI-HOTGVXAUSA-N	0	3	334.847	3.148	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@@H](NCc1ccccc1N1CCOCC1)CC2	ZINC000353241693	456581183	/nfs/dbraw/zinc/58/11/83/456581183.db2.gz	LWBNAENAQRQAJL-FQEVSTJZSA-N	0	3	333.435	3.172	20	30		EGEDHN
CO[C@H]1CCCC[C@H]1NCC(=O)N(CCC#N)c1ccc(C)c(C)c1	ZINC000276957118	456631318	/nfs/dbraw/zinc/63/13/18/456631318.db2.gz	LTFKLGIPRDHMHU-MOPGFXCFSA-N	0	3	343.471	3.097	20	30		EGEDHN
CCN(Cc1ccc(C(=O)NCc2cccc(C#N)c2)cc1)C1CC1	ZINC000337994594	456642940	/nfs/dbraw/zinc/64/29/40/456642940.db2.gz	LTVGQRDBSYWXHA-UHFFFAOYSA-N	0	3	333.435	3.473	20	30		EGEDHN
CC[C@@H](C)N[C@H](CNC(=O)Nc1ccc(C#N)cc1)c1ccco1	ZINC000353328395	456643041	/nfs/dbraw/zinc/64/30/41/456643041.db2.gz	HYAZPRDLHOLYOD-CZUORRHYSA-N	0	3	326.400	3.402	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N[C@@H](C)c1ccncc1F)C(C)C	ZINC000338080264	456659357	/nfs/dbraw/zinc/65/93/57/456659357.db2.gz	BFICYIGBWMFRMC-MAUKXSAKSA-N	0	3	348.466	3.280	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@H](NCc1cccc(CN3CCOCC3)c1)CC2	ZINC000353390865	456669848	/nfs/dbraw/zinc/66/98/48/456669848.db2.gz	VMEZDBINAXDUJM-JOCHJYFZSA-N	0	3	347.462	3.168	20	30		EGEDHN
CN(C)[C@]1(CNc2ccc(Br)cc2C#N)CCSC1	ZINC000340773618	456677584	/nfs/dbraw/zinc/67/75/84/456677584.db2.gz	IZSDFMGUFUOYPA-AWEZNQCLSA-N	0	3	340.290	3.170	20	30		EGEDHN
CN(C)[C@@]1(CNc2ccc(Br)cc2C#N)CCSC1	ZINC000340773621	456677743	/nfs/dbraw/zinc/67/77/43/456677743.db2.gz	IZSDFMGUFUOYPA-CQSZACIVSA-N	0	3	340.290	3.170	20	30		EGEDHN
CCc1ccccc1NC(=O)[C@H](C)N1CCC[C@@H]1[C@@H]1COCC[C@H]1O	ZINC000328691005	456737559	/nfs/dbraw/zinc/73/75/59/456737559.db2.gz	BVQMEYQVXJSPIL-IAAVTCLWSA-N	0	3	346.471	3.087	20	30		EGEDHN
Cc1ccc(NC(=O)[C@H](C)N2CCC[C@@H]2[C@@H]2COCC[C@H]2O)c(C)c1	ZINC000328694249	456738191	/nfs/dbraw/zinc/73/81/91/456738191.db2.gz	CVWDTDMZSONNBZ-RNIPGJKVSA-N	0	3	346.471	3.142	20	30		EGEDHN
CC(C)[C@H](C)NC(=O)C1CCN(C(=O)C2CCN(C3CC3)CC2)CC1	ZINC000328718011	456743807	/nfs/dbraw/zinc/74/38/07/456743807.db2.gz	FOSZMSIZNIXUDL-HNNXBMFYSA-N	0	3	349.519	3.100	20	30		EGEDHN
Cc1ccccc1CNC(=O)[C@H](C)N[C@H]1CCC(=O)NC12CCC2	ZINC000328718149	456744440	/nfs/dbraw/zinc/74/44/40/456744440.db2.gz	UWUILRYRTACQLD-HOCLYGCPSA-N	0	3	329.444	3.471	20	30		EGEDHN
Cc1nc([C@@H]2CCCOC2)sc1C(=O)N[C@@H]1CCN(C)[C@H](C)C1	ZINC000328852265	456776859	/nfs/dbraw/zinc/77/68/59/456776859.db2.gz	VNVIUKBRIMLXSL-MRVWCRGKSA-N	0	3	337.489	3.133	20	30		EGEDHN
C[C@H](C(=O)N(CCC#N)c1ccc(F)cc1)N1CC[C@@H](C2CC2)C1	ZINC000344038220	456790072	/nfs/dbraw/zinc/79/00/72/456790072.db2.gz	QXLMCESACQJLRH-GDBMZVCRSA-N	0	3	329.419	3.193	20	30		EGEDHN
C[C@H](N[C@@H]1CC(=O)N([C@@H]2C[C@@H]2c2ccccc2)C1)c1ccc(C#N)cc1	ZINC000344316529	456817120	/nfs/dbraw/zinc/81/71/20/456817120.db2.gz	DTXZLRIBECEQBI-LWILDLIXSA-N	0	3	345.446	3.366	20	30		EGEDHN
C[C@@H]1CC[C@H](C)N1CC(=O)N1CCC[C@H](C(=O)Nc2ccccc2)C1	ZINC000329070458	456827297	/nfs/dbraw/zinc/82/72/97/456827297.db2.gz	YNQMYWJLUVUTKR-BBWFWOEESA-N	0	3	343.471	3.386	20	30		EGEDHN
CC(=O)NCc1ccc(NC(=O)N2CCCC23CCN(C)CC3)cc1	ZINC000329072858	456828357	/nfs/dbraw/zinc/82/83/57/456828357.db2.gz	ONCUUUFTBGDTJH-UHFFFAOYSA-N	0	3	344.459	3.255	20	30		EGEDHN
C[C@H](C(=O)N1CC=C(c2ccc(C#N)cc2)CC1)N1CCCCCC1	ZINC000348750244	456840723	/nfs/dbraw/zinc/84/07/23/456840723.db2.gz	OVBIZKPCZYLASD-QGZVFWFLSA-N	0	3	337.467	3.438	20	30		EGEDHN
C[C@H]1CN(C(=O)c2cccc(SCC#N)c2)CCN(C2CCC2)C1	ZINC000344713316	456851266	/nfs/dbraw/zinc/85/12/66/456851266.db2.gz	CNYHLTXYHTVCCW-OAHLLOKOSA-N	0	3	343.496	3.249	20	30		EGEDHN
COc1cc(Cl)cc(C(=O)C(C#N)c2nnc3n2CCCCC3)c1	ZINC000344922788	456871454	/nfs/dbraw/zinc/87/14/54/456871454.db2.gz	TTXTZDWZMQIPQI-AWEZNQCLSA-N	0	3	344.802	3.157	20	30		EGEDHN
CC(C)c1cc(C(=O)N[C@@H]2CN(C)C[C@H]2c2ccccc2)cc(=O)[nH]1	ZINC000329392419	456884166	/nfs/dbraw/zinc/88/41/66/456884166.db2.gz	SCENGHLONACACM-FUHWJXTLSA-N	0	3	339.439	3.313	20	30		EGEDHN
CC[C@H](C)n1ncc(NC(=O)N2CC[C@@H]3CCN(C)C[C@@H]32)c1C1CC1	ZINC000329408476	456885705	/nfs/dbraw/zinc/88/57/05/456885705.db2.gz	CMDGSXQVRSAWMO-ZQIUZPCESA-N	0	3	345.491	3.303	20	30		EGEDHN
CCN(Cc1ccc(C(=O)N[C@@](C)(C#N)CSC)cc1)C1CC1	ZINC000345088097	456921637	/nfs/dbraw/zinc/92/16/37/456921637.db2.gz	CKCXYENAPCPGRT-SFHVURJKSA-N	0	3	331.485	3.046	20	30		EGEDHN
COc1cccc(CN(CCN(C)C)Cc2cc(C#N)cs2)c1	ZINC000349409613	456964499	/nfs/dbraw/zinc/96/44/99/456964499.db2.gz	RSXUXRUMCNKCTR-UHFFFAOYSA-N	0	3	329.469	3.192	20	30		EGEDHN
Cc1ccc(C[C@H](C)N(C)C([O-])=[NH+]C[C@@H]2CCc3nccn3C2)cc1	ZINC000329963378	456967084	/nfs/dbraw/zinc/96/70/84/456967084.db2.gz	SOPWAUVZBYXMLY-WMZOPIPTSA-N	0	3	340.471	3.231	20	30		EGEDHN
CC(C)c1noc2ncc(C(=O)NC[C@@]3(N(C)C)CCSC3)cc21	ZINC000330056557	456979873	/nfs/dbraw/zinc/97/98/73/456979873.db2.gz	WBPRNDHMKUKHIL-KRWDZBQOSA-N	0	3	348.472	3.088	20	30		EGEDHN
CC(=O)N[C@@H](C)C1CCN(Cc2cn(-c3ccncc3)nc2C)CC1	ZINC000330164817	456994217	/nfs/dbraw/zinc/99/42/17/456994217.db2.gz	WHWYBVOASWGXOH-AWEZNQCLSA-N	0	3	341.459	3.153	20	30		EGEDHN
CC(C)Cc1ccc(C(=O)C2CCN(C(=O)C(C)C#N)CC2)cc1	ZINC000345848609	457001923	/nfs/dbraw/zinc/00/19/23/457001923.db2.gz	PSZZDEDOUAFMOD-HNNXBMFYSA-N	0	3	326.440	3.466	20	30		EGEDHN
C=CCC[C@@H](NCC(=O)Nc1c(C)nn(C)c1C)c1ccccc1	ZINC000341922911	457003645	/nfs/dbraw/zinc/00/36/45/457003645.db2.gz	BLRUNXHUNQDHIE-QGZVFWFLSA-N	0	3	326.444	3.273	20	30		EGEDHN
COCCN(Cc1ccc(C)o1)C(=O)C(C#N)CCc1ccccc1	ZINC000339232564	457006336	/nfs/dbraw/zinc/00/63/36/457006336.db2.gz	OMPXYGWMESUSBS-GOSISDBHSA-N	0	3	340.423	3.336	20	30		EGEDHN
CC(C#N)C(=O)N(Cc1ccc2c(c1)OCO2)C1CCC(C)CC1	ZINC000345924209	457007252	/nfs/dbraw/zinc/00/72/52/457007252.db2.gz	LGABCKDYTATZOO-BBBYJDLNSA-N	0	3	328.412	3.482	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)N(CCC)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000346299863	457028823	/nfs/dbraw/zinc/02/88/23/457028823.db2.gz	KJGZWDSKTGDWCY-CTNGQTDRSA-N	0	3	344.499	3.217	20	30		EGEDHN
C[C@@H]1C[C@@H]1N1CCN(C(=O)c2cccc(SCC#N)c2)C[C@@H](C)C1	ZINC000346285318	457029261	/nfs/dbraw/zinc/02/92/61/457029261.db2.gz	YLSMIHLQOJFINB-DAYGRLMNSA-N	0	3	343.496	3.105	20	30		EGEDHN
CN(C)Cc1ccccc1C(=O)N1C[C@@H](c2ccccc2)[C@H](C#N)C1	ZINC000346396938	457040466	/nfs/dbraw/zinc/04/04/66/457040466.db2.gz	LNHRZNOPZSMDCV-QUCCMNQESA-N	0	3	333.435	3.128	20	30		EGEDHN
N#C[C@@H]1CC[C@@H](NCc2cnn(-c3ccc(Br)cc3)c2)C1	ZINC000349801542	457057027	/nfs/dbraw/zinc/05/70/27/457057027.db2.gz	LXZQWXJVGKIURT-IUODEOHRSA-N	0	3	345.244	3.417	20	30		EGEDHN
CN(C(=O)C(C#N)CCc1ccccc1)[C@@H](CCO)c1ccccc1	ZINC000339352575	457064273	/nfs/dbraw/zinc/06/42/73/457064273.db2.gz	NZSZAIQXTABCQV-UXHICEINSA-N	0	3	336.435	3.341	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccn(Cc3ccccc3)c2)nc(C)n1	ZINC000359489330	457088197	/nfs/dbraw/zinc/08/81/97/457088197.db2.gz	AQALBAZEFFCRBA-SFHVURJKSA-N	0	3	330.391	3.433	20	30		EGEDHN
COc1cc(C(=O)N[C@@H]2CCN(C)[C@@H](C)C2)ccc1OC(F)F	ZINC000330905321	457103119	/nfs/dbraw/zinc/10/31/19/457103119.db2.gz	MTUXZYMVJCYCTN-CMPLNLGQSA-N	0	3	328.359	3.084	20	30		EGEDHN
C=CC[C@@H](C)N[C@H]1CCS(=O)(=O)c2ccc(Br)cc21	ZINC000359648911	457103935	/nfs/dbraw/zinc/10/39/35/457103935.db2.gz	XAJAQOSZMDNOIA-MFKMUULPSA-N	0	3	344.274	3.222	20	30		EGEDHN
N#CC(C(=O)Nc1cccc2ccccc21)c1ccc([N+](=O)[O-])cn1	ZINC000359914659	457145101	/nfs/dbraw/zinc/14/51/01/457145101.db2.gz	BEPBPZYPTUKBBZ-OAHLLOKOSA-N	0	3	332.319	3.389	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN2CCCN(c3ccccc3)CC2)c1	ZINC000339588102	457157252	/nfs/dbraw/zinc/15/72/52/457157252.db2.gz	WBNQTMKACUQZBM-UHFFFAOYSA-N	0	3	348.450	3.099	20	30		EGEDHN
N#CCCN(CCC#N)C(=O)CN1CCC[C@@H]1CCC1CCCC1	ZINC000362950806	457171317	/nfs/dbraw/zinc/17/13/17/457171317.db2.gz	IACBWOBHPGABCU-GOSISDBHSA-N	0	3	330.476	3.077	20	30		EGEDHN
CN(CCC#N)C(=O)CCN1CCc2ccccc2[C@H]1c1ccccc1	ZINC000339609807	457172448	/nfs/dbraw/zinc/17/24/48/457172448.db2.gz	BFJJREGYAWVZBO-JOCHJYFZSA-N	0	3	347.462	3.396	20	30		EGEDHN
CCN(CCC#N)C(=O)CN(CCc1ccccc1F)C1CCCC1	ZINC000346945447	457192028	/nfs/dbraw/zinc/19/20/28/457192028.db2.gz	PCGJLALPVHGKPC-UHFFFAOYSA-N	0	3	345.462	3.375	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CCC[C@@H]1c1cccnc1	ZINC000347001477	457194784	/nfs/dbraw/zinc/19/47/84/457194784.db2.gz	AJWOOFSXMFRFJB-VQTJNVASSA-N	0	3	338.451	3.387	20	30		EGEDHN
CCN1CC[C@H]2CC[C@@H](C1)N2Cc1ccc(Br)cc1C#N	ZINC000347061070	457210337	/nfs/dbraw/zinc/21/03/37/457210337.db2.gz	WGODDPZCUZTPLA-SJORKVTESA-N	0	3	348.288	3.379	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)Cc2ccc(C#N)cc2)C1	ZINC000347074635	457216943	/nfs/dbraw/zinc/21/69/43/457216943.db2.gz	KKMXFWFCEVNEFU-UZLBHIALSA-N	0	3	333.435	3.052	20	30		EGEDHN
Cc1noc(C)c1COc1cccc(C(=O)C(C#N)c2ccncn2)c1	ZINC000354455855	457234120	/nfs/dbraw/zinc/23/41/20/457234120.db2.gz	BIOCIOMYUUWFOQ-INIZCTEOSA-N	0	3	348.362	3.151	20	30		EGEDHN
COc1ccc(-c2nc(C)c([C@H](C)NC(=O)C(C)C#N)s2)cc1	ZINC000347109582	457234718	/nfs/dbraw/zinc/23/47/18/457234718.db2.gz	PWVXKUDBZBKUMS-MNOVXSKESA-N	0	3	329.425	3.464	20	30		EGEDHN
CN(C)CCN(Cc1cccc(F)c1)c1ncc(C#N)cc1Cl	ZINC000347112592	457235935	/nfs/dbraw/zinc/23/59/35/457235935.db2.gz	ULUHBXLQDWJZPD-UHFFFAOYSA-N	0	3	332.810	3.314	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN1CCCN(Cc2ccccc2)C[C@H]1C	ZINC000354472802	457246591	/nfs/dbraw/zinc/24/65/91/457246591.db2.gz	YREXJLOTHYTRFG-LJQANCHMSA-N	0	3	343.515	3.007	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1CCC[C@@H]1Cc1ccc(C)cc1	ZINC000354556114	457288747	/nfs/dbraw/zinc/28/87/47/457288747.db2.gz	SEVXYEIVKPWKLL-IEBWSBKVSA-N	0	3	327.472	3.010	20	30		EGEDHN
C=C(C)[C@@H](NC(=O)N[C@@H]1CCN(C2CC2)C1)c1ccc(F)c(F)c1	ZINC000357066558	457306513	/nfs/dbraw/zinc/30/65/13/457306513.db2.gz	CJMOZUBSLPHMGI-CXAGYDPISA-N	0	3	335.398	3.118	20	30		EGEDHN
C=CCCCCCN(C)CC(=O)N1CCN(Cc2cccs2)CC1	ZINC000351912980	457323409	/nfs/dbraw/zinc/32/34/09/457323409.db2.gz	NSAMKSAVVZDHTP-UHFFFAOYSA-N	0	3	349.544	3.071	20	30		EGEDHN
CC[C@H](CC#N)N[C@H](C)CCCCN1C(=O)c2ccccc2C1=O	ZINC000351980612	457328811	/nfs/dbraw/zinc/32/88/11/457328811.db2.gz	GCAXNIUSEYXCKP-HUUCEWRRSA-N	0	3	327.428	3.123	20	30		EGEDHN
CCN1CCCN(C(=O)c2ccccc2-c2ccccc2C#N)CC1	ZINC000363448794	457333931	/nfs/dbraw/zinc/33/39/31/457333931.db2.gz	HGXURMFONBOSAP-UHFFFAOYSA-N	0	3	333.435	3.393	20	30		EGEDHN
N#CC[C@@H](CC(=O)NC[C@@H]1CCCCN1C1CC1)c1ccccc1	ZINC000357154680	457350151	/nfs/dbraw/zinc/35/01/51/457350151.db2.gz	WCNGRYNZDLATLT-HKUYNNGSSA-N	0	3	325.456	3.207	20	30		EGEDHN
CC(C)CN1CCO[C@@H](CN[C@H]2CCCCc3cc(C#N)ccc32)C1	ZINC000360838319	457376648	/nfs/dbraw/zinc/37/66/48/457376648.db2.gz	UBTQOPOLFYCMER-FPOVZHCZSA-N	0	3	341.499	3.272	20	30		EGEDHN
C=C[C@@H](CO)NCc1ccc(OC(F)(F)[C@H](F)C(F)(F)F)cc1	ZINC000352452348	457379231	/nfs/dbraw/zinc/37/92/31/457379231.db2.gz	FDVOQOYZSIDPFF-CMPLNLGQSA-N	0	3	343.267	3.195	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@@H](C)CN2CCC[C@H](C)C2)cc1OC	ZINC000347420946	457417034	/nfs/dbraw/zinc/41/70/34/457417034.db2.gz	XNJFBFGAONKYIH-HOTGVXAUSA-N	0	3	346.471	3.110	20	30		EGEDHN
C=CC[C@H](CO)CNCc1ccc(-c2ccccc2C(=O)OC)o1	ZINC000360907785	457426193	/nfs/dbraw/zinc/42/61/93/457426193.db2.gz	BDSXUUXWIVOIBH-AWEZNQCLSA-N	0	3	329.396	3.007	20	30		EGEDHN
N#CC(C(=O)c1cnn2ccccc12)c1ccc(C(F)(F)F)cn1	ZINC000342758735	457503704	/nfs/dbraw/zinc/50/37/04/457503704.db2.gz	WUMONCVZIGQEFO-LLVKDONJSA-N	0	3	330.269	3.238	20	30		EGEDHN
CCN(CC)Cc1ccc(C(=O)NCC(=O)c2ccc(C#N)cc2)cc1	ZINC000356219106	457543216	/nfs/dbraw/zinc/54/32/16/457543216.db2.gz	FYGKSDFEBXDKHU-UHFFFAOYSA-N	0	3	349.434	3.013	20	30		EGEDHN
CCc1ccc2occ(C(=O)C(C#N)C(=O)Nc3ccccn3)c2c1	ZINC000408516495	457575786	/nfs/dbraw/zinc/57/57/86/457575786.db2.gz	ZWIWBWHSBHZICS-CQSZACIVSA-N	0	3	333.347	3.351	20	30		EGEDHN
C=C(C)CN1C[C@@H](c2ccc(Br)cc2)[C@H](C(=O)OC)C1	ZINC000425510485	457580882	/nfs/dbraw/zinc/58/08/82/457580882.db2.gz	MLJDWUSXCPIJAS-LSDHHAIUSA-N	0	3	338.245	3.214	20	30		EGEDHN
COC(=O)c1ccccc1OCCN(C)[C@@H](C)c1cccc(C#N)c1	ZINC000425537658	457589955	/nfs/dbraw/zinc/58/99/55/457589955.db2.gz	QNXFJSLOZZURDP-HNNXBMFYSA-N	0	3	338.407	3.417	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H]2C[C@H](OCC)[C@H]2OC)cc1Cl	ZINC000361150476	457615088	/nfs/dbraw/zinc/61/50/88/457615088.db2.gz	ANKQSGUMMAQBAF-PVAVHDDUSA-N	0	3	325.836	3.187	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H]2C[C@H](OCC)[C@@H]2OC)cc1Cl	ZINC000361150474	457615208	/nfs/dbraw/zinc/61/52/08/457615208.db2.gz	ANKQSGUMMAQBAF-HYVNUMGLSA-N	0	3	325.836	3.187	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCS[C@@H](c3ccccc3)C2)CC1	ZINC000361154631	457617048	/nfs/dbraw/zinc/61/70/48/457617048.db2.gz	RJGJABDPWMKNHG-GOSISDBHSA-N	0	3	345.512	3.137	20	30		EGEDHN
CN(C)CCN(CCCc1ccccc1)C(=O)c1sccc1C#N	ZINC000357672903	457649916	/nfs/dbraw/zinc/64/99/16/457649916.db2.gz	IVZSWGMCNPTNCC-UHFFFAOYSA-N	0	3	341.480	3.256	20	30		EGEDHN
CN1CC[C@@H]2[C@@H](CCCN2C(=O)C(C)(C)Cc2ccc(C#N)cc2)C1	ZINC000410596358	457650367	/nfs/dbraw/zinc/65/03/67/457650367.db2.gz	ZCXPNGINICOURV-RBUKOAKNSA-N	0	3	339.483	3.070	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N1CCC[C@@H]1CSC)C(C)C	ZINC000426027012	457762269	/nfs/dbraw/zinc/76/22/69/457762269.db2.gz	FDVISKVLHYTYHE-SJORKVTESA-N	0	3	339.549	3.222	20	30		EGEDHN
Cc1ccccc1CN1CCC(NC(=O)NCC(C)(C)CC#N)CC1	ZINC000457628089	457770610	/nfs/dbraw/zinc/77/06/10/457770610.db2.gz	AJMGKZRJPQMVKP-UHFFFAOYSA-N	0	3	342.487	3.199	20	30		EGEDHN
COc1cccc2c1CCN(C(=O)C(C#N)CCc1ccccc1)C2	ZINC000433382239	457826901	/nfs/dbraw/zinc/82/69/01/457826901.db2.gz	NGIPDRIIYWZXLL-KRWDZBQOSA-N	0	3	334.419	3.352	20	30		EGEDHN
Cc1n[nH]cc1C1CCN(Cc2ccc(N(C)CCC#N)cc2)CC1	ZINC000375268198	457857313	/nfs/dbraw/zinc/85/73/13/457857313.db2.gz	SQUJXHWLJMNWKZ-UHFFFAOYSA-N	0	3	337.471	3.448	20	30		EGEDHN
COc1ccc(F)cc1[C@@H](C)NCCC(=O)Nc1ccccc1C#N	ZINC000411444666	457890361	/nfs/dbraw/zinc/89/03/61/457890361.db2.gz	FGKCQBKYYXSRJI-CYBMUJFWSA-N	0	3	341.386	3.385	20	30		EGEDHN
C[C@@H]1C[C@H](c2cccnc2)N(CCC(=O)Nc2ccccc2C#N)C1	ZINC000411524426	457910596	/nfs/dbraw/zinc/91/05/96/457910596.db2.gz	KUFPKBNGVBILBX-DNVCBOLYSA-N	0	3	334.423	3.365	20	30		EGEDHN
C=C(C)COc1cc(CN2CC[C@@H](c3nccn3C)C2)ccc1OC	ZINC000368137166	458014110	/nfs/dbraw/zinc/01/41/10/458014110.db2.gz	XXTCKWMZGHFQSK-QGZVFWFLSA-N	0	3	341.455	3.373	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC[C@H]2[C@H](c3ccccc3)C2(C)C)CC1	ZINC000458332331	458016159	/nfs/dbraw/zinc/01/61/59/458016159.db2.gz	JFDYMNWKQYNRGE-OALUTQOASA-N	0	3	341.499	3.376	20	30		EGEDHN
C=C(C)CCNC(=O)NCC1(N[C@@H](C)c2ccccc2)CCOCC1	ZINC000458372065	458028052	/nfs/dbraw/zinc/02/80/52/458028052.db2.gz	MBHUBOIPDMLIOQ-KRWDZBQOSA-N	0	3	345.487	3.152	20	30		EGEDHN
N#CC(C(=O)c1ccnn1CC(F)F)c1cc(C(F)(F)F)ccn1	ZINC000362127623	458033042	/nfs/dbraw/zinc/03/30/42/458033042.db2.gz	AZTHPYZXZZWMFF-SECBINFHSA-N	0	3	344.243	3.052	20	30		EGEDHN
N#CC(C(=O)c1cccc(NC(N)=O)c1)c1cc(C(F)(F)F)ccn1	ZINC000362193434	458042866	/nfs/dbraw/zinc/04/28/66/458042866.db2.gz	VQBXOSOADIJAKY-LBPRGKRZSA-N	0	3	348.284	3.081	20	30		EGEDHN
CN1CCC2(CCCN2C(=O)N[C@@H](CCC#N)c2ccccc2)CC1	ZINC000375837434	458089040	/nfs/dbraw/zinc/08/90/40/458089040.db2.gz	CDFGFEXAISHWRI-SFHVURJKSA-N	0	3	340.471	3.301	20	30		EGEDHN
C=CC[C@H](C)NC(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000358629280	458117075	/nfs/dbraw/zinc/11/70/75/458117075.db2.gz	TUSWVINDIQTRCP-YJBOKZPZSA-N	0	3	333.476	3.340	20	30		EGEDHN
Cc1ccc(C(=O)C(C#N)c2nc(-c3ccncc3)cs2)c(=O)[nH]1	ZINC000358656288	458131763	/nfs/dbraw/zinc/13/17/63/458131763.db2.gz	XTZAERPXYUDTNL-ZDUSSCGKSA-N	0	3	336.376	3.104	20	30		EGEDHN
N#Cc1csc(CNC[C@H]2CSCCN2Cc2ccccc2)c1	ZINC000428534966	458165279	/nfs/dbraw/zinc/16/52/79/458165279.db2.gz	KHUUEULRCLLDIG-KRWDZBQOSA-N	0	3	343.521	3.327	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN1CC[C@H](C)N(Cc2ccccc2)CC1	ZINC000362430415	458171984	/nfs/dbraw/zinc/17/19/84/458171984.db2.gz	NQHIIBSKEFBTEV-IBGZPJMESA-N	0	3	343.515	3.007	20	30		EGEDHN
CCCCOC1CCN(CCC(=O)Nc2ccccc2C#N)CC1	ZINC000362453401	458189864	/nfs/dbraw/zinc/18/98/64/458189864.db2.gz	XNISTIXQGLONEO-UHFFFAOYSA-N	0	3	329.444	3.168	20	30		EGEDHN
COc1ccccc1CCCN1CC[C@H](Oc2ccc(C#N)cn2)C1	ZINC000428797391	458214511	/nfs/dbraw/zinc/21/45/11/458214511.db2.gz	PVPVJVSZQNIXDU-SFHVURJKSA-N	0	3	337.423	3.048	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCN(CCSc3ccc(F)cc3)C2)nc1	ZINC000428824905	458217379	/nfs/dbraw/zinc/21/73/79/458217379.db2.gz	ZHNPDCSMQXXKJF-MRXNPFEDSA-N	0	3	343.427	3.338	20	30		EGEDHN
CC[C@@H]1CCCCN1CCNC(=O)[C@@H](C#N)CCc1ccccc1	ZINC000435928224	458226020	/nfs/dbraw/zinc/22/60/20/458226020.db2.gz	OVDURZDKTIMNEJ-RTBURBONSA-N	0	3	327.472	3.140	20	30		EGEDHN
C=CCOc1ccc(CN[C@]2(CCOC)CCOC2)cc1Cl	ZINC000447067393	458259423	/nfs/dbraw/zinc/25/94/23/458259423.db2.gz	NWJSSCNTPNIESJ-QGZVFWFLSA-N	0	3	325.836	3.190	20	30		EGEDHN
C[C@@H]1CN(CCC(=O)Nc2ccc(C#N)cc2)Cc2ccccc2O1	ZINC000429150876	458281911	/nfs/dbraw/zinc/28/19/11/458281911.db2.gz	PRHABXWWDWJUMH-OAHLLOKOSA-N	0	3	335.407	3.170	20	30		EGEDHN
C=CCC[C@H](O)CN1CCN(c2cccc3cnccc32)C[C@H]1C	ZINC000447380748	458289798	/nfs/dbraw/zinc/28/97/98/458289798.db2.gz	FXCKHPLZUPEDQB-AEFFLSMTSA-N	0	3	325.456	3.072	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NC(=O)N[C@@H]1C[C@@H](C)N(C2CC2)C1	ZINC000413388425	458299302	/nfs/dbraw/zinc/29/93/02/458299302.db2.gz	WZOSTKOQEOFTRN-KBAYOESNSA-N	0	3	327.472	3.098	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cn(C)nc1C1CCC1)C(C)C	ZINC000413445941	458301141	/nfs/dbraw/zinc/30/11/41/458301141.db2.gz	UBZLGSKDBMPHQU-GOSISDBHSA-N	0	3	344.503	3.116	20	30		EGEDHN
CN(C)CCN(CCCc1ccccc1)C(=O)NCC(C)(C)CC#N	ZINC000459258633	458305110	/nfs/dbraw/zinc/30/51/10/458305110.db2.gz	LYPNQPUPGNXQAA-UHFFFAOYSA-N	0	3	344.503	3.132	20	30		EGEDHN
C#Cc1cccc(NC(=O)N2CC[C@@H](N(C)Cc3ccccc3)C2)c1	ZINC000372645268	458310899	/nfs/dbraw/zinc/31/08/99/458310899.db2.gz	PBCRHWRIBOFKDC-HXUWFJFHSA-N	0	3	333.435	3.406	20	30		EGEDHN
C#Cc1cccc(NC(=O)N2CC[C@H](N(C)Cc3ccccc3)C2)c1	ZINC000372645265	458311069	/nfs/dbraw/zinc/31/10/69/458311069.db2.gz	PBCRHWRIBOFKDC-FQEVSTJZSA-N	0	3	333.435	3.406	20	30		EGEDHN
C=CCOc1cccc(CN2CCC[C@@H](N3CCCC3=O)CC2)c1	ZINC000414555483	458323681	/nfs/dbraw/zinc/32/36/81/458323681.db2.gz	UMZYFLGYXCSGRH-GOSISDBHSA-N	0	3	328.456	3.228	20	30		EGEDHN
CC[C@@](CNCc1ccc(C#N)s1)(C(=O)OC)c1ccccc1	ZINC000414595184	458324506	/nfs/dbraw/zinc/32/45/06/458324506.db2.gz	YXLXWSVZQFJLBR-SFHVURJKSA-N	0	3	328.437	3.230	20	30		EGEDHN
C=CCc1cc(CN2CCNC[C@@H]2c2ccccc2)cc(OC)c1O	ZINC000415132402	458327381	/nfs/dbraw/zinc/32/73/81/458327381.db2.gz	UDDFINIPDBSZTO-LJQANCHMSA-N	0	3	338.451	3.276	20	30		EGEDHN
N#CC1(CCCN2CCC(C#N)(c3ccccn3)CC2)CCOCC1	ZINC000376594368	458348414	/nfs/dbraw/zinc/34/84/14/458348414.db2.gz	DRBGUPYAWSUSKR-UHFFFAOYSA-N	0	3	338.455	3.039	20	30		EGEDHN
C=CC[C@@H](CC)NC(=O)Nc1ccc(OCCN(C)C)c(OC)c1	ZINC000417682408	458366382	/nfs/dbraw/zinc/36/63/82/458366382.db2.gz	LGYVVFGWEPOTCD-CQSZACIVSA-N	0	3	335.448	3.112	20	30		EGEDHN
COC(=O)c1cc(CN[C@H]2CCCc3cc(C#N)ccc32)n(C)c1C	ZINC000418140890	458372980	/nfs/dbraw/zinc/37/29/80/458372980.db2.gz	GDRJLCPEUIQTDY-IBGZPJMESA-N	0	3	337.423	3.159	20	30		EGEDHN
CCN1C[C@@H](C)N(CC#Cc2ccc(OC(F)(F)F)cc2)[C@H](C)C1	ZINC000459460508	458378501	/nfs/dbraw/zinc/37/85/01/458378501.db2.gz	INDXCWOEKVLAEU-HUUCEWRRSA-N	0	3	340.389	3.351	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)NCc1cc(C)nc(C)c1)C(C)C	ZINC000420855322	458402160	/nfs/dbraw/zinc/40/21/60/458402160.db2.gz	WGOZVGOUYVIKOB-LJQANCHMSA-N	0	3	344.503	3.196	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N=c1cc(C)n(C(C)C)[nH]1)C(C)C	ZINC000421181338	458409189	/nfs/dbraw/zinc/40/91/89/458409189.db2.gz	IITLMFHLZMOOIN-QGZVFWFLSA-N	0	3	347.507	3.014	20	30		EGEDHN
C=CCc1cc(CN(C)[C@@H](CO)c2ccccc2)cc(OC)c1O	ZINC000449459690	458424487	/nfs/dbraw/zinc/42/44/87/458424487.db2.gz	YLVIMFQQPUHSEY-SFHVURJKSA-N	0	3	327.424	3.295	20	30		EGEDHN
CC(C)(C)O[C@@H]1C[C@H](NCc2cc(C#N)cs2)[C@H]1n1cccn1	ZINC000449653323	458427897	/nfs/dbraw/zinc/42/78/97/458427897.db2.gz	BZHNQBZRVGJMQD-ARFHVFGLSA-N	0	3	330.457	3.103	20	30		EGEDHN
CN(CCOc1ccccc1C#N)[C@H](CO)c1ccc(Cl)cc1	ZINC000451321568	458472926	/nfs/dbraw/zinc/47/29/26/458472926.db2.gz	CTLBWACKCCHJRP-QGZVFWFLSA-N	0	3	330.815	3.256	20	30		EGEDHN
CCO[C@@H]1CCCC[C@H]1N[C@H](C)C(=O)N(C)C1(C#N)CCC(C)CC1	ZINC000452034714	458492443	/nfs/dbraw/zinc/49/24/43/458492443.db2.gz	LRUPVFQNMLAZLH-SYJBPTKTSA-N	0	3	349.519	3.243	20	30		EGEDHN
CCO[C@@H]1CCC[C@H]1N[C@H](C)C(=O)N(CCC#N)c1ccc(F)cc1	ZINC000452014785	458493494	/nfs/dbraw/zinc/49/34/94/458493494.db2.gz	HRRURRARLLZDPQ-ZTFGCOKTSA-N	0	3	347.434	3.008	20	30		EGEDHN
CC(C)C[C@@H](CN1CCCC1)NC(=O)[C@H](C)c1cccc(C#N)c1	ZINC000452345718	458499919	/nfs/dbraw/zinc/49/99/19/458499919.db2.gz	SBXQBIHUEXSMCH-APWZRJJASA-N	0	3	327.472	3.288	20	30		EGEDHN
C=C(C)Cn1c(C2CCC2)nnc1N1CCN([C@@H]2C[C@@H]2C)C[C@@H](C)C1	ZINC000453449740	458530632	/nfs/dbraw/zinc/53/06/32/458530632.db2.gz	FSTKULDOIPSUNO-SOLBZPMBSA-N	0	3	343.519	3.288	20	30		EGEDHN
C=C(C)Cn1c(C(C)C)nnc1N1CCN([C@@H]2C[C@H]2C)C[C@@H](C)C1	ZINC000453453119	458531803	/nfs/dbraw/zinc/53/18/03/458531803.db2.gz	NFUKVDIUUNLTJH-BRWVUGGUSA-N	0	3	331.508	3.144	20	30		EGEDHN
CC(C)[C@H]1CN(Cc2cc(C#N)ccc2Br)CCN1C	ZINC000493735208	458550777	/nfs/dbraw/zinc/55/07/77/458550777.db2.gz	HLKHWDHRUBXEJI-MRXNPFEDSA-N	0	3	336.277	3.093	20	30		EGEDHN
C[C@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)[C@H](N)CCCC#N	ZINC000424085926	458555751	/nfs/dbraw/zinc/55/57/51/458555751.db2.gz	CYEYABQQIOZIRY-BXUZGUMPSA-N	0	3	327.350	3.246	20	30		EGEDHN
CC[C@H](Cc1ccccc1)N(CC)CC(=O)N[C@@](C)(C#N)C(C)C	ZINC000469142578	458557440	/nfs/dbraw/zinc/55/74/40/458557440.db2.gz	ZQSOSEAPWXMAPW-QUCCMNQESA-N	0	3	329.488	3.384	20	30		EGEDHN
C=CC(C)(C)CNC(=O)NC[C@H]1CCCN(Cc2cccs2)C1	ZINC000454409783	458560718	/nfs/dbraw/zinc/56/07/18/458560718.db2.gz	DTZVWYHYAGTYOO-OAHLLOKOSA-N	0	3	335.517	3.472	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1ccccc1N1CCc2ccccc21	ZINC000424116227	458562300	/nfs/dbraw/zinc/56/23/00/458562300.db2.gz	XDFIKZAPDPIDBF-MRXNPFEDSA-N	0	3	334.423	3.340	20	30		EGEDHN
C[C@@H]1c2cc(Cl)cc(Cl)c2CCN1C(=O)[C@H](N)CCCC#N	ZINC000424130474	458566803	/nfs/dbraw/zinc/56/68/03/458566803.db2.gz	FJNQSBAGILWCPP-MEBBXXQBSA-N	0	3	340.254	3.460	20	30		EGEDHN
C[C@@H](CN1CCCCC1)NC(=O)C(C)(C)Cc1ccc(C#N)cc1	ZINC000454676355	458570643	/nfs/dbraw/zinc/57/06/43/458570643.db2.gz	DSIMTQQODVFBEH-INIZCTEOSA-N	0	3	327.472	3.118	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N1CCCC[C@@H]1CCCc1ccccc1	ZINC000424167642	458575276	/nfs/dbraw/zinc/57/52/76/458575276.db2.gz	FEKHTDUUBJQVMX-RTBURBONSA-N	0	3	327.472	3.412	20	30		EGEDHN
CC[C@@H](CSc1ccc(C)c(C)c1)NC(=O)[C@@H](N)CCCC#N	ZINC000424177427	458577794	/nfs/dbraw/zinc/57/77/94/458577794.db2.gz	UHCMIKZFMAECRE-RDJZCZTQSA-N	0	3	333.501	3.312	20	30		EGEDHN
CCN(CCN1CCCCCC1)C(=O)Nc1cccc(CC#N)c1	ZINC000455901007	458619363	/nfs/dbraw/zinc/61/93/63/458619363.db2.gz	DEOKXMIUNTUBQP-UHFFFAOYSA-N	0	3	328.460	3.482	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N1CCN(Cc2ccccc2)C[C@H](C)C1	ZINC000456321517	458637795	/nfs/dbraw/zinc/63/77/95/458637795.db2.gz	CUTGRXYYYOEKGY-RXVVDRJESA-N	0	3	344.499	3.196	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@@H](c3ccccc3)C2)CC1	ZINC000431976145	458655966	/nfs/dbraw/zinc/65/59/66/458655966.db2.gz	ALORPBSKCLFAON-GOSISDBHSA-N	0	3	327.472	3.226	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNc1ccc([N+](=O)[O-])c(N)c1F)C(C)C	ZINC000471248089	458688396	/nfs/dbraw/zinc/68/83/96/458688396.db2.gz	BUGPZLIAEWCDHG-HNNXBMFYSA-N	0	3	336.411	3.427	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Cc1cc(F)ccc1F)C(C)C	ZINC000463814443	458719853	/nfs/dbraw/zinc/71/98/53/458719853.db2.gz	MMFYXDQGIOKYGS-GOSISDBHSA-N	0	3	336.426	3.322	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)c2cccc(F)c2C#N)N(C)C)cc1	ZINC000494911581	458764610	/nfs/dbraw/zinc/76/46/10/458764610.db2.gz	TZBLQXHRTUNFHR-LJQANCHMSA-N	0	3	339.414	3.292	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cnn(C3CCCC3)c2CC)CC1	ZINC000530455520	458772242	/nfs/dbraw/zinc/77/22/42/458772242.db2.gz	ZLNLQIOICINPQL-UHFFFAOYSA-N	0	3	344.503	3.331	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1C[C@H](c2ccccc2)[C@H]2CCC[C@H]21	ZINC000511841540	458780687	/nfs/dbraw/zinc/78/06/87/458780687.db2.gz	HHJWBSUXFQBRON-VBSBHUPXSA-N	0	3	339.483	3.263	20	30		EGEDHN
C[C@@H]1[C@@H](Cc2ccccc2)CCN1CC(=O)Nc1cccc(C#N)c1	ZINC000472343267	458788072	/nfs/dbraw/zinc/78/80/72/458788072.db2.gz	JUXFIBDDFWMLDZ-VQIMIIECSA-N	0	3	333.435	3.450	20	30		EGEDHN
CN(C)CCN(CC1CCCCC1)C(=O)NCC(C)(C)CCC#N	ZINC000513118481	458790273	/nfs/dbraw/zinc/79/02/73/458790273.db2.gz	LJRISFKBNRSAIT-UHFFFAOYSA-N	0	3	336.524	3.470	20	30		EGEDHN
C=CCN(CCc1ccccc1)CCN1C(=O)c2ccccc2C1=O	ZINC000513884052	458795475	/nfs/dbraw/zinc/79/54/75/458795475.db2.gz	PIRKRFPNRCSUEO-UHFFFAOYSA-N	0	3	334.419	3.013	20	30		EGEDHN
C[C@@H]1CN(CCCNc2ccc(C#N)cc2C(F)(F)F)CCCO1	ZINC000432845564	458799047	/nfs/dbraw/zinc/79/90/47/458799047.db2.gz	FDNZAMLLZNBDLS-CYBMUJFWSA-N	0	3	341.377	3.490	20	30		EGEDHN
CCN(Cc1ccccc1)C(=O)[C@@H](C)N1CCC(CCC#N)CC1	ZINC000514670532	458800528	/nfs/dbraw/zinc/80/05/28/458800528.db2.gz	VZZZULRQFSHGOE-QGZVFWFLSA-N	0	3	327.472	3.439	20	30		EGEDHN
C[C@@H](C(=O)N(C)CCC#N)N1CCC[C@]2(CCCc3ccccc32)C1	ZINC000440314697	458802992	/nfs/dbraw/zinc/80/29/92/458802992.db2.gz	LAHCFVOLRHTKRS-LAUBAEHRSA-N	0	3	339.483	3.117	20	30		EGEDHN
C=C(C)Cn1c(CCCC)nnc1N1CC[C@@H](N2CCCCC2)C1	ZINC000515066487	458805212	/nfs/dbraw/zinc/80/52/12/458805212.db2.gz	QWFRKGLODIYENA-QGZVFWFLSA-N	0	3	331.508	3.261	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN1CCC[C@@H]1Cc1cccc(OC)c1	ZINC000515502702	458811171	/nfs/dbraw/zinc/81/11/71/458811171.db2.gz	JNZCRJDRZVSYSY-GOSISDBHSA-N	0	3	330.472	3.127	20	30		EGEDHN
C[C@H](S[C@H]1CCCN(Cc2ccccc2)C1)C(=O)N(C)CCC#N	ZINC000516062461	458814739	/nfs/dbraw/zinc/81/47/39/458814739.db2.gz	AKYCRDHFNZVHSA-WMZOPIPTSA-N	0	3	345.512	3.145	20	30		EGEDHN
COc1cc(CNCc2cccc(Cn3ccnc3)c2)ccc1C#N	ZINC000440829384	458858960	/nfs/dbraw/zinc/85/89/60/458858960.db2.gz	JBEBUEAJZIQWKG-UHFFFAOYSA-N	0	3	332.407	3.101	20	30		EGEDHN
N#CCN1CCN(CC(Cc2ccccc2)Cc2ccccc2)CC1	ZINC000551328361	458888132	/nfs/dbraw/zinc/88/81/32/458888132.db2.gz	NHGAFJGGLLARRL-UHFFFAOYSA-N	0	3	333.479	3.229	20	30		EGEDHN
N#C[C@@H]1CC[C@H](N2CCC[C@H](CNC(=O)OCc3ccccc3)C2)C1	ZINC000495592095	458892930	/nfs/dbraw/zinc/89/29/30/458892930.db2.gz	HTHDLXRXTJUFHS-QRVBRYPASA-N	0	3	341.455	3.317	20	30		EGEDHN
C=CC[C@H](CC)NC(=O)N(CCN(C)C)Cc1cccc(OC)c1	ZINC000466405919	458897994	/nfs/dbraw/zinc/89/79/94/458897994.db2.gz	QLPGFMDPNJOGAK-KRWDZBQOSA-N	0	3	333.476	3.123	20	30		EGEDHN
C=C(C)Cn1c(-c2ccc(C)o2)nnc1N1CCN(C)[C@H](C(C)C)C1	ZINC000555242766	458904227	/nfs/dbraw/zinc/90/42/27/458904227.db2.gz	YGAKWBFSLOABLN-INIZCTEOSA-N	0	3	343.475	3.199	20	30		EGEDHN
COc1ccc([C@H](CNC[C@@H](C#N)CCC#N)N2CCCCC2)cc1	ZINC000556483512	458966081	/nfs/dbraw/zinc/96/60/81/458966081.db2.gz	XTHBXCVZZGVOPI-XLIONFOSSA-N	0	3	340.471	3.255	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN(CCc1ccccc1)CC(C)C	ZINC000531842021	458987328	/nfs/dbraw/zinc/98/73/28/458987328.db2.gz	ZBNBAVFXEKBGLG-GOSISDBHSA-N	0	3	329.488	3.195	20	30		EGEDHN
Cc1ccc([C@H](C)CNCCS(=O)(=O)c2ccc(C#N)cc2)cc1	ZINC000577384903	459025468	/nfs/dbraw/zinc/02/54/68/459025468.db2.gz	AFQMWCGBGDSUII-MRXNPFEDSA-N	0	3	342.464	3.034	20	30		EGEDHN
CC(C)(C)OC(=O)N1C[C@@H]2CC[C@H](NC[C@H](C#N)CCC#N)C[C@H]2C1	ZINC000496040657	459046728	/nfs/dbraw/zinc/04/67/28/459046728.db2.gz	DLJCNFWLEOOTJL-QAETUUGQSA-N	0	3	346.475	3.055	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CCN(C(=O)Cc2cccc(C#N)c2)C1	ZINC000567131881	459052386	/nfs/dbraw/zinc/05/23/86/459052386.db2.gz	VRQIGJXXAKVBCS-GOSISDBHSA-N	0	3	347.462	3.081	20	30		EGEDHN
C[C@@H]1CC[C@@H](C)N1CC(=O)NCC#Cc1ccc(C(F)(F)F)cc1	ZINC000477636589	459052498	/nfs/dbraw/zinc/05/24/98/459052498.db2.gz	FUGBLUNTYZBWBL-ZIAGYGMSSA-N	0	3	338.373	3.046	20	30		EGEDHN
C=CCCCCCN(C)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000532573451	459111574	/nfs/dbraw/zinc/11/15/74/459111574.db2.gz	MTILFBAERRXHIO-KRWDZBQOSA-N	0	3	331.416	3.378	20	30		EGEDHN
C[C@@H](OC[C@H](O)CNCc1cccc(C#N)c1)c1ccc(Cl)cc1	ZINC000567678503	459143532	/nfs/dbraw/zinc/14/35/32/459143532.db2.gz	UXGXCBUSKHBKOH-AUUYWEPGSA-N	0	3	344.842	3.440	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H]2CCC[C@H]([S@](C)=O)C2)cc1OC	ZINC000594969488	459199314	/nfs/dbraw/zinc/19/93/14/459199314.db2.gz	ZTBZRXIVDHJEKJ-SYJLOODJSA-N	0	3	337.485	3.039	20	30		EGEDHN
C[C@H](NC(=O)N1CCC(CCC#N)CC1)[C@@H](c1ccccc1)N(C)C	ZINC000578502325	459210914	/nfs/dbraw/zinc/21/09/14/459210914.db2.gz	MGFVFMYUNRZZDC-LPHOPBHVSA-N	0	3	342.487	3.403	20	30		EGEDHN
C[C@@H](N[C@H]1CCCc2cc(C#N)ccc21)C(=O)NCCc1ccccc1	ZINC000590780374	459215459	/nfs/dbraw/zinc/21/54/59/459215459.db2.gz	DKDNJUPOHKNHEA-IERDGZPVSA-N	0	3	347.462	3.273	20	30		EGEDHN
C[C@H]1OCC[C@]1(O)CN(Cc1cc(C#N)cs1)Cc1ccccc1	ZINC000578579519	459223968	/nfs/dbraw/zinc/22/39/68/459223968.db2.gz	ABOBFJFSBKOXTB-BEFAXECRSA-N	0	3	342.464	3.162	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)c1cnc(C(C)(C)C)nc1	ZINC000581036413	459267578	/nfs/dbraw/zinc/26/75/78/459267578.db2.gz	IXLQURZSUKNONF-CYBMUJFWSA-N	0	3	333.395	3.151	20	30		EGEDHN
N#Cc1ccc(CCN2CCC[C@H](CNC(=O)c3ccccc3)C2)cc1	ZINC000595342389	459280104	/nfs/dbraw/zinc/28/01/04/459280104.db2.gz	MWKZZVZNHGXOGE-HXUWFJFHSA-N	0	3	347.462	3.243	20	30		EGEDHN
C[C@H](CCC#N)N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000496700137	459293252	/nfs/dbraw/zinc/29/32/52/459293252.db2.gz	JYANKIDXQCFVQY-SJLPKXTDSA-N	0	3	329.444	3.317	20	30		EGEDHN
CSc1ccc(OC[C@@H](O)CN[C@H](C)c2cccc(C#N)c2)cc1	ZINC000591023122	459295472	/nfs/dbraw/zinc/29/54/72/459295472.db2.gz	XOIDBZJDQKIHBZ-PBHICJAKSA-N	0	3	342.464	3.371	20	30		EGEDHN
N#CCc1ccnc(NC(=O)c2cccc(CN3CCCCC3)c2)c1	ZINC000591069191	459304445	/nfs/dbraw/zinc/30/44/45/459304445.db2.gz	STUXABSPDQPRIW-UHFFFAOYSA-N	0	3	334.423	3.386	20	30		EGEDHN
Cc1cc(CNC2(CC(=O)OC(C)(C)C)CCOCC2)ccc1C#N	ZINC000595552378	459344046	/nfs/dbraw/zinc/34/40/46/459344046.db2.gz	YUGYAHLLGIRGTJ-UHFFFAOYSA-N	0	3	344.455	3.237	20	30		EGEDHN
C=CCNC(=O)NC(=O)CN[C@H](c1cccc(Cl)c1)C1CCCC1	ZINC000537132139	459363589	/nfs/dbraw/zinc/36/35/89/459363589.db2.gz	QBEBUZOHYUMXRG-KRWDZBQOSA-N	0	3	349.862	3.173	20	30		EGEDHN
CN1CC=C(CNC(=O)c2ccc(C#Cc3ccccc3)cc2)CC1	ZINC000538339058	459370572	/nfs/dbraw/zinc/37/05/72/459370572.db2.gz	PLITXRLHJYYIKY-UHFFFAOYSA-N	0	3	330.431	3.078	20	30		EGEDHN
C=CC[C@H](CC)NC(=O)NC[C@@H](c1ccc(OC)cc1)N1CCCC1	ZINC000540699509	459383349	/nfs/dbraw/zinc/38/33/49/459383349.db2.gz	CBFXWUPLGIANSV-HKUYNNGSSA-N	0	3	345.487	3.486	20	30		EGEDHN
N#Cc1ccnc(N2CCN(CCCc3ccc(Cl)cc3)CC2)c1	ZINC000524907192	459403380	/nfs/dbraw/zinc/40/33/80/459403380.db2.gz	GVZFYOHRURJYDL-UHFFFAOYSA-N	0	3	340.858	3.361	20	30		EGEDHN
C=CCNC(=O)CN[C@H]1CCCC[C@H]1Oc1ccc(OCCC)cc1	ZINC000484634995	459423569	/nfs/dbraw/zinc/42/35/69/459423569.db2.gz	RTOFVCBANMIAKJ-RBUKOAKNSA-N	0	3	346.471	3.057	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1CCCCC1=Nn1cnnc1	ZINC000497080935	459430657	/nfs/dbraw/zinc/43/06/57/459430657.db2.gz	UXVSYSLNLDBBBR-DZGCQCFKSA-N	0	3	333.436	3.072	20	30		EGEDHN
Cc1ccc(OC[C@@H](O)CN[C@H]2CCc3cc(C#N)ccc32)c(C)c1	ZINC000591763951	459431084	/nfs/dbraw/zinc/43/10/84/459431084.db2.gz	SOGJLNFLTRKOOW-ICSRJNTNSA-N	0	3	336.435	3.192	20	30		EGEDHN
N#Cc1ccc2c(c1)CC[C@H]2NC[C@@H](O)COc1ccccc1Cl	ZINC000591764220	459431525	/nfs/dbraw/zinc/43/15/25/459431525.db2.gz	XSZCNFWQTGCNLY-CRAIPNDOSA-N	0	3	342.826	3.228	20	30		EGEDHN
CN1CCC[C@@H](NCCC(=O)Nc2cccc(C#N)c2)c2ccccc21	ZINC000569436741	459450770	/nfs/dbraw/zinc/45/07/70/459450770.db2.gz	MUXVTXIWYLBVEW-LJQANCHMSA-N	0	3	348.450	3.448	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)C[C@@H](O)COc1ccc(CC#N)cc1	ZINC000591853637	459455485	/nfs/dbraw/zinc/45/54/85/459455485.db2.gz	AYYVUQAPJKZPIZ-OXQOHEQNSA-N	0	3	349.434	3.057	20	30		EGEDHN
CC[C@H](CN1CCCC1)NC(=O)N(C)[C@@H](C)c1cccc(C#N)c1	ZINC000591869613	459459558	/nfs/dbraw/zinc/45/95/58/459459558.db2.gz	DRZXBZBMFJLNMO-MAUKXSAKSA-N	0	3	328.460	3.135	20	30		EGEDHN
CC[C@H](CN1CCCC1)NC(=O)N(C)[C@H](C)c1cccc(C#N)c1	ZINC000591869612	459460465	/nfs/dbraw/zinc/46/04/65/459460465.db2.gz	DRZXBZBMFJLNMO-CRAIPNDOSA-N	0	3	328.460	3.135	20	30		EGEDHN
N#Cc1ccc2c(c1)CCCC[C@@H]2NCc1ccc2c(c1)C(=O)NCC2	ZINC000569541958	459467020	/nfs/dbraw/zinc/46/70/20/459467020.db2.gz	PSRNMEZCCWVVDE-NRFANRHFSA-N	0	3	345.446	3.401	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)c2ccc(C#Cc3ccccc3)cc2)CCN1C	ZINC000525618157	459468527	/nfs/dbraw/zinc/46/85/27/459468527.db2.gz	LKKSKZNEQYUVMV-LAUBAEHRSA-N	0	3	332.447	3.299	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]1NCc1ccc(CC#N)cc1	ZINC000497267575	459508989	/nfs/dbraw/zinc/50/89/89/459508989.db2.gz	DKHGJRWANPPYHE-IAGOWNOFSA-N	0	3	329.444	3.288	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N(C)Cc1occc1C)C(C)C	ZINC000487855404	459534066	/nfs/dbraw/zinc/53/40/66/459534066.db2.gz	UZBMYRJSDOHFMI-QGZVFWFLSA-N	0	3	333.476	3.428	20	30		EGEDHN
Cc1cc(CNC[C@H](c2cccs2)N2CCOCC2)ccc1C#N	ZINC000487894938	459536070	/nfs/dbraw/zinc/53/60/70/459536070.db2.gz	HQGZTEXSGMLLJK-GOSISDBHSA-N	0	3	341.480	3.091	20	30		EGEDHN
COCCN(CC(=O)Nc1ccc(C#N)c(Cl)c1)[C@H]1CCC[C@H]1C	ZINC000487964050	459536318	/nfs/dbraw/zinc/53/63/18/459536318.db2.gz	OMAGSNDANRIKDX-DYVFJYSZSA-N	0	3	349.862	3.287	20	30		EGEDHN
C[C@@H](NCC1(c2ccccc2)CCCCC1)C(=O)NC1(C#N)CCC1	ZINC000526047816	459539110	/nfs/dbraw/zinc/53/91/10/459539110.db2.gz	HLLWXWSVXMYSPJ-QGZVFWFLSA-N	0	3	339.483	3.429	20	30		EGEDHN
N#CCC1CCN(C[C@H](O)COc2ccccc2C(F)(F)F)CC1	ZINC000542257170	459540004	/nfs/dbraw/zinc/54/00/04/459540004.db2.gz	IDBNNHZAAATXHL-AWEZNQCLSA-N	0	3	342.361	3.071	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)c1nc(C#N)c(Cl)s1	ZINC000596158536	459542816	/nfs/dbraw/zinc/54/28/16/459542816.db2.gz	YCRZMGCVPDFDLI-UHFFFAOYSA-N	0	3	345.859	3.108	20	30		EGEDHN
C=C(CN[C@@H](Cc1ccc(C(F)(F)F)cc1)C(N)=O)c1ccccc1	ZINC000488385426	459543719	/nfs/dbraw/zinc/54/37/19/459543719.db2.gz	PEOSRCUBRODTHK-KRWDZBQOSA-N	0	3	348.368	3.405	20	30		EGEDHN
COc1ccc(CN2CCN(C)[C@H](C(C)C)C2)cc1OCCCC#N	ZINC000488540713	459545597	/nfs/dbraw/zinc/54/55/97/459545597.db2.gz	HCCNOMWYJDIEPL-SFHVURJKSA-N	0	3	345.487	3.150	20	30		EGEDHN
CC[C@@H](CN[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O)c1ccccc1	ZINC000488556675	459545668	/nfs/dbraw/zinc/54/56/68/459545668.db2.gz	JVBAUUNUPMXIHJ-FPOVZHCZSA-N	0	3	347.462	3.443	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCN(CCOC3CCCCCC3)C2)nc1	ZINC000562362769	459546357	/nfs/dbraw/zinc/54/63/57/459546357.db2.gz	OTNYSBGCSNALDR-GOSISDBHSA-N	0	3	329.444	3.146	20	30		EGEDHN
Cc1cccc([C@H]2CCN(C[C@@H](O)COc3ccc(C#N)cc3)C2)c1	ZINC000542319771	459548136	/nfs/dbraw/zinc/54/81/36/459548136.db2.gz	KBUUOOOFCDOXKN-VQTJNVASSA-N	0	3	336.435	3.096	20	30		EGEDHN
N#Cc1ccc(C(=O)N2CCCN(CC3CCC3)CC2)cc1Cl	ZINC000583611067	459567403	/nfs/dbraw/zinc/56/74/03/459567403.db2.gz	FBYNMROSFCAMMU-UHFFFAOYSA-N	0	3	331.847	3.160	20	30		EGEDHN
C=CCN(CCc1ccco1)C(=O)NCC(C)(C)N1CCCCC1	ZINC000498105123	459567789	/nfs/dbraw/zinc/56/77/89/459567789.db2.gz	JFIXBOKYOYQIQU-UHFFFAOYSA-N	0	3	333.476	3.284	20	30		EGEDHN
C#CCNC(=O)C1CCN(c2cc(CCC)nc3ccccc32)CC1	ZINC000491100018	459598227	/nfs/dbraw/zinc/59/82/27/459598227.db2.gz	DYTYOOIKNYSNEI-UHFFFAOYSA-N	0	3	335.451	3.153	20	30		EGEDHN
C#C[C@@H](NC[C@H](C)c1ccc(S(C)(=O)=O)cc1)c1ccc(F)cc1	ZINC000491371556	459621307	/nfs/dbraw/zinc/62/13/07/459621307.db2.gz	FNEJUHTVXBVFTB-IFXJQAMLSA-N	0	3	345.439	3.297	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN1CCC[C@H](Cc2ccc(C)cc2)C1	ZINC000573276670	459652666	/nfs/dbraw/zinc/65/26/66/459652666.db2.gz	SRPUPVJCYVDQKT-HXUWFJFHSA-N	0	3	326.484	3.450	20	30		EGEDHN
CC1(C)CN(C(=O)C(C#N)Cc2ccc(C#N)cc2)[C@@H]1c1cccnc1	ZINC000592800983	459693439	/nfs/dbraw/zinc/69/34/39/459693439.db2.gz	DWDHNHDCURLZID-RBUKOAKNSA-N	0	3	344.418	3.245	20	30		EGEDHN
CCC1(c2ccccc2)CN(C(=O)C(C#N)Cc2ccc(C#N)cc2)C1	ZINC000563026348	459700033	/nfs/dbraw/zinc/70/00/33/459700033.db2.gz	MQCRKHYVVVQBCA-IBGZPJMESA-N	0	3	343.430	3.431	20	30		EGEDHN
C=CCN1CCC(NC(=O)/C=C\c2ccc(OCC)c(C)c2)CC1	ZINC000492592178	459711345	/nfs/dbraw/zinc/71/13/45/459711345.db2.gz	HYKCGOFVGRHGSE-CLFYSBASSA-N	0	3	328.456	3.174	20	30		EGEDHN
C=CCOc1ccc(CNCc2ccc3cn(C)nc3c2)cc1OC	ZINC000527762138	459727963	/nfs/dbraw/zinc/72/79/63/459727963.db2.gz	KDKMPTRVZCGWBQ-UHFFFAOYSA-N	0	3	337.423	3.437	20	30		EGEDHN
C=CCCC[C@H](C)NC(=O)N[C@@H](CN(C)C)c1ccc(OC)cc1	ZINC000501551524	459735899	/nfs/dbraw/zinc/73/58/99/459735899.db2.gz	GWNYEKZNQBITRG-YJBOKZPZSA-N	0	3	333.476	3.342	20	30		EGEDHN
COC[C@H](NCC(=O)Nc1ccccc1SC[C@@H](C)C#N)C(C)C	ZINC000544414209	459758109	/nfs/dbraw/zinc/75/81/09/459758109.db2.gz	CYRIRPUNMABGSR-HOCLYGCPSA-N	0	3	349.500	3.137	20	30		EGEDHN
CN(C)CCOc1ccc(NC(=O)CC2(C#N)CCCCC2)cc1	ZINC000596838641	459775701	/nfs/dbraw/zinc/77/57/01/459775701.db2.gz	RVQBMQOBHFGAGI-UHFFFAOYSA-N	0	3	329.444	3.430	20	30		EGEDHN
CC(C)Oc1ccc([C@H](CNC[C@@H](C#N)CCC#N)N(C)C)cc1	ZINC000564868898	459778125	/nfs/dbraw/zinc/77/81/25/459778125.db2.gz	KGKASTXYBYBPTR-APWZRJJASA-N	0	3	328.460	3.110	20	30		EGEDHN
C=CCOCCN1C[C@H]2CCC[C@@]2(c2nc(-c3ccccc3)no2)C1	ZINC000565552841	459785427	/nfs/dbraw/zinc/78/54/27/459785427.db2.gz	AQUKFQRCYVZINB-YLJYHZDGSA-N	0	3	339.439	3.293	20	30		EGEDHN
C[C@@H]1CCN(C[C@@H](O)COc2ccccc2C#N)[C@H](c2ccco2)C1	ZINC000528394353	459805378	/nfs/dbraw/zinc/80/53/78/459805378.db2.gz	JZTFIHDTGFYQOX-NXHRZFHOSA-N	0	3	340.423	3.364	20	30		EGEDHN
N#CC1(C[C@H](O)CN2CCC[C@@H](c3nc4ccc(F)cc4o3)C2)CC1	ZINC000528421500	459806913	/nfs/dbraw/zinc/80/69/13/459806913.db2.gz	QUQYLAANEBWDKB-HIFRSBDPSA-N	0	3	343.402	3.201	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)c1ccsc1Cl	ZINC000596973457	459807951	/nfs/dbraw/zinc/80/79/51/459807951.db2.gz	JMEYMWCOSCBUPM-UHFFFAOYSA-N	0	3	347.871	3.477	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1)C(=O)CC1(C#N)CCCCC1	ZINC000596973100	459808223	/nfs/dbraw/zinc/80/82/23/459808223.db2.gz	LXNMSSNITXWLJK-UHFFFAOYSA-N	0	3	327.472	3.441	20	30		EGEDHN
CCC(C#N)(CC)C(=O)N1CC[C@H](N(C)CCc2ccccc2)C1	ZINC000529520362	459830235	/nfs/dbraw/zinc/83/02/35/459830235.db2.gz	RZLQWUFCDDJFRE-SFHVURJKSA-N	0	3	327.472	3.092	20	30		EGEDHN
C[C@@H](CN1CCC(C)CC1)NC(=O)CSCc1ccc(C#N)cc1	ZINC000598265010	459843223	/nfs/dbraw/zinc/84/32/23/459843223.db2.gz	SAKVZKBTSIKXQC-INIZCTEOSA-N	0	3	345.512	3.028	20	30		EGEDHN
N#Cc1ccc(C2=CCN(C(=O)[C@H]3CCN3C3CCCC3)CC2)cc1	ZINC000602134204	459850891	/nfs/dbraw/zinc/85/08/91/459850891.db2.gz	UDGWVSFCDHDZQA-HXUWFJFHSA-N	0	3	335.451	3.191	20	30		EGEDHN
CCC(C#N)C(=O)N(C)[C@@H](C(=O)OC)c1cccc(Cl)c1Cl	ZINC000598428317	459897255	/nfs/dbraw/zinc/89/72/55/459897255.db2.gz	MVHKHSYESPTOAZ-TVQRCGJNSA-N	0	3	343.210	3.216	20	30		EGEDHN
C[C@H](C#N)CN(C)C(=O)c1ccccc1OCCN1CCCC[C@@H]1C	ZINC000609201099	459923401	/nfs/dbraw/zinc/92/34/01/459923401.db2.gz	MQKVDGADGBFIIM-SJORKVTESA-N	0	3	343.471	3.171	20	30		EGEDHN
C[C@H](CCC#N)CN1CCN(Cc2cn3cc(Cl)ccc3n2)CC1	ZINC000602449612	459943436	/nfs/dbraw/zinc/94/34/36/459943436.db2.gz	FEQGVVOSIDNHNH-OAHLLOKOSA-N	0	3	345.878	3.045	20	30		EGEDHN
C[C@H](CCC#N)CN(CCO)Cc1cc(Br)ccc1F	ZINC000602455787	459946797	/nfs/dbraw/zinc/94/67/97/459946797.db2.gz	YJDUBLOLRLKKJH-GFCCVEGCSA-N	0	3	343.240	3.322	20	30		EGEDHN
CN(Cc1cc(Br)cs1)C[C@H](O)CC(C)(C)C#N	ZINC000598585388	459953980	/nfs/dbraw/zinc/95/39/80/459953980.db2.gz	BZFIVMYOKZNLCA-LLVKDONJSA-N	0	3	331.279	3.243	20	30		EGEDHN
CC(C)(C)N(CC(=O)Nc1ccc(F)cc1)C[C@H](O)CC(C)(C)C#N	ZINC000598597522	459957988	/nfs/dbraw/zinc/95/79/88/459957988.db2.gz	GFMRRTXXBHVSHH-MRXNPFEDSA-N	0	3	349.450	3.165	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN1CCC[C@@H](c2nc3ccccc3o2)C1	ZINC000598594923	459958102	/nfs/dbraw/zinc/95/81/02/459958102.db2.gz	ODOHDYPUCIKODW-HUUCEWRRSA-N	0	3	327.428	3.308	20	30		EGEDHN
CCOc1ccc(C2=CCN(C[C@@H](O)CC(C)(C)C#N)CC2)cc1	ZINC000598601271	459958590	/nfs/dbraw/zinc/95/85/90/459958590.db2.gz	SAINPCIPXLDBLQ-SFHVURJKSA-N	0	3	328.456	3.475	20	30		EGEDHN
Cc1cc(Br)ccc1CN(C)C[C@H](O)CC(C)(C)C#N	ZINC000598610261	459963169	/nfs/dbraw/zinc/96/31/69/459963169.db2.gz	MNRVIKVAVKLUKM-OAHLLOKOSA-N	0	3	339.277	3.490	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN[C@@](C)(CO)c1cc(Cl)cc(Cl)c1	ZINC000598620189	459967451	/nfs/dbraw/zinc/96/74/51/459967451.db2.gz	JGOZEMTXWUKMEY-ZBFHGGJFSA-N	0	3	345.270	3.091	20	30		EGEDHN
Cc1ccccc1[C@H]([C@H](C)NC(=O)N1CCC(CC#N)CC1)N(C)C	ZINC000588722074	459976004	/nfs/dbraw/zinc/97/60/04/459976004.db2.gz	VOZPHFKTOXZWTE-LPHOPBHVSA-N	0	3	342.487	3.322	20	30		EGEDHN
CCN(CC)[C@H](CN[C@H](C)CC1(C#N)CCOCC1)c1ccco1	ZINC000602525941	459983247	/nfs/dbraw/zinc/98/32/47/459983247.db2.gz	UFCRTTDPGYBENB-IAGOWNOFSA-N	0	3	333.476	3.351	20	30		EGEDHN
COc1cc(CN[C@@H](C)CC2(C#N)CCOCC2)c2ccccc2n1	ZINC000602558308	459995316	/nfs/dbraw/zinc/99/53/16/459995316.db2.gz	OJOKBFQZLUCNSQ-HNNXBMFYSA-N	0	3	339.439	3.432	20	30		EGEDHN
COc1ncccc1NC(=O)C(C#N)c1nc2cc(F)ccc2s1	ZINC000609627400	459998890	/nfs/dbraw/zinc/99/88/90/459998890.db2.gz	LTAUCKAHSVEHSU-SNVBAGLBSA-N	0	3	342.355	3.085	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N[C@@H]1CCCc2c3cc(Cl)ccc3[nH]c21	ZINC000602565418	459999270	/nfs/dbraw/zinc/99/92/70/459999270.db2.gz	HTNUHTNZLRTAFV-GOEBONIOSA-N	0	3	344.846	3.336	20	30		EGEDHN
CCOc1c(Cl)cc(CNC[C@@H](O)CC(C)(C)C#N)cc1OC	ZINC000598701553	460000133	/nfs/dbraw/zinc/00/01/33/460000133.db2.gz	XDOMDUAMILTZDD-ZDUSSCGKSA-N	0	3	340.851	3.138	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CNCc1cccc(OCC(F)(F)F)c1	ZINC000598715008	460003455	/nfs/dbraw/zinc/00/34/55/460003455.db2.gz	LNHXBKOBKMXWJQ-ZDUSSCGKSA-N	0	3	330.350	3.018	20	30		EGEDHN
Cc1ccc(CNC[C@H](O)CC(C)(C)C#N)c(OCC(F)(F)F)c1	ZINC000598726647	460007809	/nfs/dbraw/zinc/00/78/09/460007809.db2.gz	UDVTVTXDMMHBCR-CQSZACIVSA-N	0	3	344.377	3.327	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CNCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1	ZINC000598724528	460007910	/nfs/dbraw/zinc/00/79/10/460007910.db2.gz	POGOPJRJWNFFSW-ZDUSSCGKSA-N	0	3	345.321	3.004	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CNCc1ccncc1OCc1ccccc1	ZINC000598728322	460008972	/nfs/dbraw/zinc/00/89/72/460008972.db2.gz	QLGIMEMWWPNJDD-SFHVURJKSA-N	0	3	339.439	3.051	20	30		EGEDHN
COc1nc(C)cc(C)c1CNC(=O)C(C#N)CCc1ccccc1	ZINC000597657630	460020092	/nfs/dbraw/zinc/02/00/92/460020092.db2.gz	RKVYXWFDMIONTN-QGZVFWFLSA-N	0	3	337.423	3.096	20	30		EGEDHN
C[C@H](CCC#N)CN1CCCN(c2nnc(C(F)(F)F)s2)CC1	ZINC000602629528	460033308	/nfs/dbraw/zinc/03/33/08/460033308.db2.gz	KYDCYMCBNUEHLL-LLVKDONJSA-N	0	3	347.410	3.009	20	30		EGEDHN
N#Cc1ccc(CN2CCC(NCc3noc4ccccc34)CC2)cc1	ZINC000575934683	460036449	/nfs/dbraw/zinc/03/64/49/460036449.db2.gz	UKSACCJJBUTOQO-UHFFFAOYSA-N	0	3	346.434	3.454	20	30		EGEDHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)[C@@H](C)Cc1ccc(C#N)cc1	ZINC000594002016	460050766	/nfs/dbraw/zinc/05/07/66/460050766.db2.gz	QZSYXLSBPRPFCU-ZWKOTPCHSA-N	0	3	349.478	3.374	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1CCN(C)C	ZINC000594010427	460054857	/nfs/dbraw/zinc/05/48/57/460054857.db2.gz	DYVHSLNEYWJAIQ-MRXNPFEDSA-N	0	3	335.451	3.480	20	30		EGEDHN
CCOC(=O)c1ccc(C#N)c(SCCN2C[C@@H](C)C[C@H](C)C2)n1	ZINC000576122515	460076118	/nfs/dbraw/zinc/07/61/18/460076118.db2.gz	DQCYQYJRXQAQOL-KBPBESRZSA-N	0	3	347.484	3.200	20	30		EGEDHN
CN(C)c1cncc(NC2CCN(Cc3ccc(C#N)cc3)CC2)c1	ZINC000602724388	460087319	/nfs/dbraw/zinc/08/73/19/460087319.db2.gz	KWCLWWPMXQHVSG-UHFFFAOYSA-N	0	3	335.455	3.096	20	30		EGEDHN
CC[C@@H](C#N)N(C)C(=O)c1ccccc1OCCN1CCCC[C@@H]1C	ZINC000594095064	460099148	/nfs/dbraw/zinc/09/91/48/460099148.db2.gz	SOOBDJMXBZQTIO-IRXDYDNUSA-N	0	3	343.471	3.314	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@@H](C)[C@@H](CO)SC)cc1OC	ZINC000598963223	460105536	/nfs/dbraw/zinc/10/55/36/460105536.db2.gz	AWEYSGVFPOBVBU-XHDPSFHLSA-N	0	3	345.892	3.115	20	30		EGEDHN
C=CCOc1ccc(CNCCC(=O)Nc2ccccn2)cc1Cl	ZINC000589646474	460120853	/nfs/dbraw/zinc/12/08/53/460120853.db2.gz	YRDGMWMOGCUJFW-UHFFFAOYSA-N	0	3	345.830	3.418	20	30		EGEDHN
CN1CCC(C(=O)Nc2ccc(Oc3cccc(C#N)c3)nc2)CC1	ZINC000610424022	460148496	/nfs/dbraw/zinc/14/84/96/460148496.db2.gz	SAXGVTQIZZZLKF-UHFFFAOYSA-N	0	3	336.395	3.026	20	30		EGEDHN
Cc1cc(CN[C@@H]2CCc3cc(C#N)ccc32)ccc1-n1cncn1	ZINC000618741577	460152045	/nfs/dbraw/zinc/15/20/45/460152045.db2.gz	GJINBKOAKRZAQW-LJQANCHMSA-N	0	3	329.407	3.225	20	30		EGEDHN
N#Cc1cnn2cc(CNCCCCc3ccc(Cl)s3)cnc12	ZINC000576516615	460158598	/nfs/dbraw/zinc/15/85/98/460158598.db2.gz	FGWMOVBGIFAONI-UHFFFAOYSA-N	0	3	345.859	3.428	20	30		EGEDHN
C[C@]1(NC(=O)c2ccc(F)c(C#N)c2)CCN(Cc2ccccc2)C1	ZINC000576522030	460160704	/nfs/dbraw/zinc/16/07/04/460160704.db2.gz	XXWGVAQKKVDWQN-FQEVSTJZSA-N	0	3	337.398	3.092	20	30		EGEDHN
COc1ccc(C2(NCc3cc(C#N)cs3)CCOCC2)cc1	ZINC000610488871	460164226	/nfs/dbraw/zinc/16/42/26/460164226.db2.gz	MWOFUPWHANTAQT-UHFFFAOYSA-N	0	3	328.437	3.424	20	30		EGEDHN
C[C@@H](CC(=O)NCCc1ccccc1)N[C@H]1CCc2cc(C#N)ccc21	ZINC000618801376	460181422	/nfs/dbraw/zinc/18/14/22/460181422.db2.gz	AMMLVTVOUXKQKA-KKSFZXQISA-N	0	3	347.462	3.273	20	30		EGEDHN
C[C@@H](N[C@H]1CCc2cc(C#N)ccc21)c1ccc(S(C)(=O)=O)cc1	ZINC000618807902	460184533	/nfs/dbraw/zinc/18/45/33/460184533.db2.gz	XXTLDDQCUPLHBC-YJYMSZOUSA-N	0	3	340.448	3.300	20	30		EGEDHN
CC[C@@H]1CCCCN1CCNC(=O)[C@H](C)Cc1ccc(C#N)cc1	ZINC000594297372	460184597	/nfs/dbraw/zinc/18/45/97/460184597.db2.gz	WSIXLYFBKUMQNW-VQIMIIECSA-N	0	3	327.472	3.118	20	30		EGEDHN
CC[C@@](C)(NCC(=O)NCc1ccc(C#N)cc1)c1ccc(F)cc1	ZINC000602924269	460187941	/nfs/dbraw/zinc/18/79/41/460187941.db2.gz	BVYUUGPDVLOLPU-HXUWFJFHSA-N	0	3	339.414	3.229	20	30		EGEDHN
CCOc1cccc([C@@H](C)NC[C@@H](O)COc2ccccc2C#N)c1	ZINC000599349032	460234501	/nfs/dbraw/zinc/23/45/01/460234501.db2.gz	JVHOFUDTUNROPO-CRAIPNDOSA-N	0	3	340.423	3.047	20	30		EGEDHN
C[C@H](NC[C@H](O)CC1(C#N)CCOCC1)c1cc2ccccc2o1	ZINC000599358131	460237396	/nfs/dbraw/zinc/23/73/96/460237396.db2.gz	FABQCHHOBCIJEA-GOEBONIOSA-N	0	3	328.412	3.155	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)Nc2ccnc(C#N)c2)CCN1Cc1ccccc1	ZINC000603132903	460249471	/nfs/dbraw/zinc/24/94/71/460249471.db2.gz	ZVMKHNXDTBUWJZ-MAUKXSAKSA-N	0	3	349.438	3.128	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N1CCC(C(N)=O)(c2ccccc2)CC1	ZINC000614963147	460253267	/nfs/dbraw/zinc/25/32/67/460253267.db2.gz	WZFGJCBABIHPHO-INIZCTEOSA-N	0	3	333.435	3.138	20	30		EGEDHN
CC(C)[C@H]1CN(Cc2ccccc2)CCN1CCCSCC#N	ZINC000599536657	460269960	/nfs/dbraw/zinc/26/99/60/460269960.db2.gz	NSWQOPMKIKCAEX-LJQANCHMSA-N	0	3	331.529	3.476	20	30		EGEDHN
CN(C)[C@H]1CCCN(C(=O)c2c(Cl)cc(C#N)cc2Cl)C1	ZINC000611093787	460288676	/nfs/dbraw/zinc/28/86/76/460288676.db2.gz	DZWAJKIGRKMELK-NSHDSACASA-N	0	3	326.227	3.031	20	30		EGEDHN
C[C@]1(c2ccccc2)C[C@H]1NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000619292039	460322902	/nfs/dbraw/zinc/32/29/02/460322902.db2.gz	PVNTXHLMEXSDSJ-FBBABVLZSA-N	0	3	329.403	3.087	20	30		EGEDHN
Cc1cc2ncn(C[C@@H](O)CN[C@H](C)c3cccc(C#N)c3)c2cc1C	ZINC000611386846	460350029	/nfs/dbraw/zinc/35/00/29/460350029.db2.gz	AXPJGJYCBHYIDK-APWZRJJASA-N	0	3	348.450	3.237	20	30		EGEDHN
N#Cc1cccc(OCCN2C[C@@H]3CN(c4ccccc4)C[C@H]3C2)c1	ZINC000603865314	460351348	/nfs/dbraw/zinc/35/13/48/460351348.db2.gz	WQBRXELOIBQVJH-RTBURBONSA-N	0	3	333.435	3.005	20	30		EGEDHN
COc1ccc(OCCN[C@H](C)c2cccc(C#N)c2)c([N+](=O)[O-])c1	ZINC000611387610	460351518	/nfs/dbraw/zinc/35/15/18/460351518.db2.gz	QMCRANRAQOJVBR-CYBMUJFWSA-N	0	3	341.367	3.205	20	30		EGEDHN
C[C@@H](N[C@H]1CCCc2cc(C#N)ccc21)C(=O)NCc1ccccc1	ZINC000611392465	460353379	/nfs/dbraw/zinc/35/33/79/460353379.db2.gz	RKQYUFLFHMWCKH-QRWLVFNGSA-N	0	3	333.435	3.230	20	30		EGEDHN
C[C@H](N[C@@H]1CCCc2cc(C#N)ccc21)C(=O)NCc1ccccc1	ZINC000611392464	460353503	/nfs/dbraw/zinc/35/35/03/460353503.db2.gz	RKQYUFLFHMWCKH-MGPUTAFESA-N	0	3	333.435	3.230	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2N[C@@H]1CCN(c2ccccc2F)C1=O	ZINC000611394139	460354174	/nfs/dbraw/zinc/35/41/74/460354174.db2.gz	LKYBNLPULNIGFC-RTBURBONSA-N	0	3	349.409	3.470	20	30		EGEDHN
CCC(C)(C)N(C)C(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000619591406	460393020	/nfs/dbraw/zinc/39/30/20/460393020.db2.gz	BKLHKMQWURYMQM-UHFFFAOYSA-N	0	3	330.476	3.162	20	30		EGEDHN
COc1cc(CN[C@H]2CCN(c3ccc(F)cc3F)C2)ccc1C#N	ZINC000619653849	460404936	/nfs/dbraw/zinc/40/49/36/460404936.db2.gz	GKUWRKGNJYYKEI-INIZCTEOSA-N	0	3	343.377	3.214	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N2CCC[C@@](C)(C#N)C2)C1	ZINC000612114446	460544607	/nfs/dbraw/zinc/54/46/07/460544607.db2.gz	GKRVLUAATNYQQD-POAQFYNOSA-N	0	3	340.471	3.157	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H]1CCN(C(=O)c2ccccc2CC#N)C1	ZINC000601255309	460766298	/nfs/dbraw/zinc/76/62/98/460766298.db2.gz	BINIUTPYPXZBAV-LJQANCHMSA-N	0	3	333.435	3.099	20	30		EGEDHN
C[C@@H]1CN(C)CC[C@@H]1N(C)C(=O)c1ccc(C#Cc2ccccc2)cc1	ZINC000607515872	460855737	/nfs/dbraw/zinc/85/57/37/460855737.db2.gz	ZLXJUAKRRRJAPM-GCJKJVERSA-N	0	3	346.474	3.499	20	30		EGEDHN
N#CCC[C@H](NC[C@@]1(O)CCN(Cc2ccccc2)C1)c1ccccc1	ZINC000601964626	460964227	/nfs/dbraw/zinc/96/42/27/460964227.db2.gz	JMZZYTMMHCEQML-VXKWHMMOSA-N	0	3	349.478	3.258	20	30		EGEDHN
C=CCN(C(=O)Nc1cc(CN)cc(C(F)(F)F)c1)[C@@H](C)COC	ZINC000659022357	461144630	/nfs/dbraw/zinc/14/46/30/461144630.db2.gz	OSYWQFPSBRXFMV-NSHDSACASA-N	0	3	345.365	3.219	20	30		EGEDHN
C=CCC[C@@H](CO)NCc1c(C)nn(-c2ccc(F)cc2F)c1C	ZINC000641759792	461356765	/nfs/dbraw/zinc/35/67/65/461356765.db2.gz	JCCMLYVZHKKIBD-HNNXBMFYSA-N	0	3	335.398	3.184	20	30		EGEDHN
CCCN1CC[C@@H](NC(=O)Nc2cccc(C#Cc3ccccn3)c2)C1	ZINC000666045849	461422163	/nfs/dbraw/zinc/42/21/63/461422163.db2.gz	UNDNSBRGAFEFHP-HXUWFJFHSA-N	0	3	348.450	3.087	20	30		EGEDHN
C=C[C@H]1CCCCN1C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000666150362	461475314	/nfs/dbraw/zinc/47/53/14/461475314.db2.gz	NVJXLHXDYPLLKB-IBGZPJMESA-N	0	3	342.487	3.044	20	30		EGEDHN
C=CCN(C(=O)CCN1CCN(c2ccccc2)CC1)c1ccccc1	ZINC000647741669	461824156	/nfs/dbraw/zinc/82/41/56/461824156.db2.gz	BACILZOJCHQCHF-UHFFFAOYSA-N	0	3	349.478	3.418	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCC[C@H]([C@@H]3CCCCO3)C2)CC1	ZINC000660597447	461872044	/nfs/dbraw/zinc/87/20/44/461872044.db2.gz	PKNQLVOKTVGGGY-HKUYNNGSSA-N	0	3	349.519	3.018	20	30		EGEDHN
C=CC[C@@H]1CCCN(C(=O)NCC2CCN(c3ccncc3)CC2)C1	ZINC000664578057	462112950	/nfs/dbraw/zinc/11/29/50/462112950.db2.gz	WDVHFVZAYGHYFH-GOSISDBHSA-N	0	3	342.487	3.296	20	30		EGEDHN
C=CCC1(NCc2ccc(S(=O)(=O)N3CCCC3)o2)CCCC1	ZINC000661847670	462436993	/nfs/dbraw/zinc/43/69/93/462436993.db2.gz	CJDLEXBGGWYZNP-UHFFFAOYSA-N	0	3	338.473	3.043	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN2CC[C@H](N3CCCCC3)C2)c1C	ZINC000264619665	534433773	/nfs/dbraw/zinc/43/37/73/534433773.db2.gz	RINPLVAYGKBZTJ-SFHVURJKSA-N	0	3	329.488	3.034	20	30		EGEDHN
CC#CCCCC(=O)N(C)CCC1CCN(c2ccncc2)CC1	ZINC000185982849	526287576	/nfs/dbraw/zinc/28/75/76/526287576.db2.gz	SWRWUCGWUUYDKN-UHFFFAOYSA-N	0	3	327.472	3.340	20	30		EGEDHN
C=CCN1CCC(NC(=O)CSc2nccc3ccccc32)CC1	ZINC000178114851	526423576	/nfs/dbraw/zinc/42/35/76/526423576.db2.gz	ADGASJXQKBMGGR-UHFFFAOYSA-N	0	3	341.480	3.094	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H]2CCSc3ccccc32)CC1	ZINC000171713457	526440235	/nfs/dbraw/zinc/44/02/35/526440235.db2.gz	ZEBURZDQCXYVJR-INIZCTEOSA-N	0	3	331.485	3.173	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2nnc(C(CC)CC)s2)CC1	ZINC000171739104	526442451	/nfs/dbraw/zinc/44/24/51/526442451.db2.gz	BFSRXWJTBOSZMN-UHFFFAOYSA-N	0	3	337.493	3.214	20	30		EGEDHN
C=CCN1CCC(N[C@@H](C)c2nnn(-c3ccc(F)cc3)c2C)CC1	ZINC000177909638	526452664	/nfs/dbraw/zinc/45/26/64/526452664.db2.gz	KEELTKAFQRNEFC-AWEZNQCLSA-N	0	3	343.450	3.016	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC[C@@H](C)Cc2cccs2)CC1	ZINC000176501185	526589806	/nfs/dbraw/zinc/58/98/06/526589806.db2.gz	HTLBEKKCSVBGAN-HNNXBMFYSA-N	0	3	335.517	3.266	20	30		EGEDHN
C=C(Cl)COc1ccc([C@H](C)N[C@@H](C)CN2CCCC2=O)cc1	ZINC000178498731	526891265	/nfs/dbraw/zinc/89/12/65/526891265.db2.gz	YEMPCDJQYAPBHK-GJZGRUSLSA-N	0	3	336.863	3.479	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@@H](C)C1CCOCC1	ZINC000179836135	527012790	/nfs/dbraw/zinc/01/27/90/527012790.db2.gz	HXMIDQFQRSGWKI-AWEZNQCLSA-N	0	3	334.485	3.308	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@@H](C)N[C@H](C)c1ccc(-n2cccn2)cc1	ZINC000174367838	527629297	/nfs/dbraw/zinc/62/92/97/527629297.db2.gz	MHIJOVGDAQVHRG-IAGOWNOFSA-N	0	3	338.455	3.112	20	30		EGEDHN
CC(C)[C@]1(C)C[C@H]1C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000185607673	535293423	/nfs/dbraw/zinc/29/34/23/535293423.db2.gz	KCGTXYXQFWAGPX-ICSRJNTNSA-N	0	3	327.472	3.131	20	30		EGEDHN
COc1ccc(C#N)cc1CN1CC[C@@H]2[C@@H](CCCN2C2CC2)C1	ZINC000246912616	536644148	/nfs/dbraw/zinc/64/41/48/536644148.db2.gz	RZBFHINETHNWIM-QFBILLFUSA-N	0	3	325.456	3.016	20	30		EGEDHN
COc1ccc(C#N)cc1CN1CC[C@H]2[C@@H](CCCN2C2CC2)C1	ZINC000246912600	536644747	/nfs/dbraw/zinc/64/47/47/536644747.db2.gz	RZBFHINETHNWIM-LPHOPBHVSA-N	0	3	325.456	3.016	20	30		EGEDHN
CCN1CCCC[C@@H]1CNC(=O)[C@@H]1CCCC[C@H]1C(=O)N1CCCC1	ZINC000329237630	547492918	/nfs/dbraw/zinc/49/29/18/547492918.db2.gz	KLFMIRUQWGTEHN-KZNAEPCWSA-N	0	3	349.519	3.246	20	30		EGEDHN
C[C@H](NC(=O)N[C@H]1CCN(C2CC2)C1)c1ccc2c(c1)CCC(=O)N2	ZINC000329284573	547493919	/nfs/dbraw/zinc/49/39/19/547493919.db2.gz	GDAQWAYXLOKJNI-WFASDCNBSA-N	0	3	342.443	3.022	20	30		EGEDHN
Cc1cc2c(o1)CC(C)(C)C[C@@H]2[NH+]=C([O-])N[C@@H]1CCc2nc[nH]c2C1	ZINC000329503133	547499496	/nfs/dbraw/zinc/49/94/96/547499496.db2.gz	ANHMHJSINJDSAS-WBMJQRKESA-N	0	3	342.443	3.386	20	30		EGEDHN
Cc1cc2c(o1)CC(C)(C)C[C@@H]2[NH+]=C([O-])N[C@@H]1CCc2[nH]cnc2C1	ZINC000329503133	547499500	/nfs/dbraw/zinc/49/95/00/547499500.db2.gz	ANHMHJSINJDSAS-WBMJQRKESA-N	0	3	342.443	3.386	20	30		EGEDHN
CN1CCCC(C)(C)[C@H]1CNC(=O)c1cccc(SCC#N)c1	ZINC000344616891	547612894	/nfs/dbraw/zinc/61/28/94/547612894.db2.gz	NYURXFWHJRBGHH-MRXNPFEDSA-N	0	3	331.485	3.152	20	30		EGEDHN
COCC#CCN[C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1	ZINC000671249009	548269398	/nfs/dbraw/zinc/26/93/98/548269398.db2.gz	RYASXINOFQCTKG-KRWDZBQOSA-N	0	3	341.373	3.413	20	30		EGEDHN
C=CCNC(=O)[C@H](C)N1CCC(CCc2ccc(OCC)cc2)CC1	ZINC000671310807	548277313	/nfs/dbraw/zinc/27/73/13/548277313.db2.gz	YFMLLMGSQFAIHY-KRWDZBQOSA-N	0	3	344.499	3.421	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1c(C)noc1C(F)F)C(C)C	ZINC000673669331	548593514	/nfs/dbraw/zinc/59/35/14/548593514.db2.gz	IWWKTFSLXZFDBN-CYBMUJFWSA-N	0	3	341.402	3.349	20	30		EGEDHN
CCC#C[C@@H](C)N[C@H](C)c1ccc(S(=O)(=O)N(CC)CC)cc1	ZINC000678728978	549549377	/nfs/dbraw/zinc/54/93/77/549549377.db2.gz	QWFMSDJROANIIB-HZPDHXFCSA-N	0	3	336.501	3.170	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN[C@@H](CN1CCCCC1)c1ccccc1	ZINC000679938208	549793236	/nfs/dbraw/zinc/79/32/36/549793236.db2.gz	MIPLBTWKWGXRKX-FQEVSTJZSA-N	0	3	341.499	3.004	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)[C@H]1Cc2ccc(F)cc21)C(C)C	ZINC000684441368	550330544	/nfs/dbraw/zinc/33/05/44/550330544.db2.gz	DWLRZWVXBSQIAP-RBUKOAKNSA-N	0	3	330.447	3.280	20	30		EGEDHN
C#Cc1cccc(NC(=S)NC[C@H](Cc2ccccc2)N(C)C)c1	ZINC000726441019	574555116	/nfs/dbraw/zinc/55/51/16/574555116.db2.gz	KDGUBFLPTFPJRP-IBGZPJMESA-N	0	3	337.492	3.127	20	30		EGEDHN
C=CCN1CCC(NC(=S)NC23CC4CC(CC(C4)C2)C3)CC1	ZINC000729942605	574897831	/nfs/dbraw/zinc/89/78/31/574897831.db2.gz	PCLHPSYUDPRVEE-UHFFFAOYSA-N	0	3	333.545	3.070	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC=C(c3ccc(C)cc3)CC2)CC1	ZINC000730125346	574922187	/nfs/dbraw/zinc/92/21/87/574922187.db2.gz	TZVIEAVDFWENHD-UHFFFAOYSA-N	0	3	339.483	3.444	20	30		EGEDHN
CN(C)CCOc1ccc(C=NNc2ccnc3ccccc32)cc1	ZINC000730148529	574925867	/nfs/dbraw/zinc/92/58/67/574925867.db2.gz	WQIXRTWFTOUZRD-UHFFFAOYSA-N	0	3	334.423	3.043	20	30		EGEDHN
C=CC1CCN(CC(=O)C(C#N)c2nc3ccccc3s2)CC1	ZINC000732206280	575244494	/nfs/dbraw/zinc/24/44/94/575244494.db2.gz	XGYJZYQQEBWMGW-AWEZNQCLSA-N	0	3	325.437	3.371	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)/C=C/c1cnc(C)s1)C(C)C	ZINC000733161805	575312396	/nfs/dbraw/zinc/31/23/96/575312396.db2.gz	QDBUNLCCFHGIAM-IJDCCNJMSA-N	0	3	333.501	3.280	20	30		EGEDHN
N#CCCn1cc(C[NH2+]Cc2ccccc2[O-])c(-c2ccccc2)n1	ZINC000733326889	575327944	/nfs/dbraw/zinc/32/79/44/575327944.db2.gz	AYHHFQLIFTUQCT-UHFFFAOYSA-N	0	3	332.407	3.459	20	30		EGEDHN
CC(C)n1ccc(C(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)n1	ZINC000733678559	575381340	/nfs/dbraw/zinc/38/13/40/575381340.db2.gz	DJCXYJFASNYPRA-CYBMUJFWSA-N	0	3	330.775	3.079	20	30		EGEDHN
C=CC[C@H](NC(=O)NC[C@@H](c1ccccc1)N(C)C)c1ccncc1	ZINC000734652857	575531999	/nfs/dbraw/zinc/53/19/99/575531999.db2.gz	UOHZNALVIVSNNS-OALUTQOASA-N	0	3	338.455	3.301	20	30		EGEDHN
C=CC[C@H](NC(=O)N1CCN(CCC(C)(C)C)CC1)c1ccncc1	ZINC000734678123	575540943	/nfs/dbraw/zinc/54/09/43/575540943.db2.gz	DJNXZCUKEPQFDY-SFHVURJKSA-N	0	3	344.503	3.462	20	30		EGEDHN
C=C(Cl)CNC(=O)c1ccccc1OCCN1CCCC[C@H]1C	ZINC000736239255	575920829	/nfs/dbraw/zinc/92/08/29/575920829.db2.gz	SPODSOAMYSTIEQ-OAHLLOKOSA-N	0	3	336.863	3.422	20	30		EGEDHN
C=CCCCCCN(C)C(=O)NC1CCN(C[C@@H]2CCCO2)CC1	ZINC000740480723	576586995	/nfs/dbraw/zinc/58/69/95/576586995.db2.gz	DUKQAPMDXIVGHI-SFHVURJKSA-N	0	3	337.508	3.018	20	30		EGEDHN
CC(C)OCCCN(C)CC(=O)C(C#N)c1nc2ccccc2s1	ZINC000740881487	576633373	/nfs/dbraw/zinc/63/33/73/576633373.db2.gz	WYAUHDQFUPJTJW-CQSZACIVSA-N	0	3	345.468	3.219	20	30		EGEDHN
CCN1CCC(=NNC(=S)Nc2ccc(OC(C)C)cc2)[C@@H](C)C1	ZINC000741463999	576688381	/nfs/dbraw/zinc/68/83/81/576688381.db2.gz	LSHYWNPPHYDPOW-AWEZNQCLSA-N	0	3	348.516	3.478	20	30		EGEDHN
C[C@H](C(=O)C(C#N)C(=O)N1CCCC1)c1ccccc1C(F)(F)F	ZINC000744023429	576819000	/nfs/dbraw/zinc/81/90/00/576819000.db2.gz	JDYBQRJTTXIROA-AAEUAGOBSA-N	0	3	338.329	3.140	20	30		EGEDHN
CC(C)CC(=O)NCCC(=O)C(C#N)c1nc2cc(F)ccc2s1	ZINC000744119443	576820796	/nfs/dbraw/zinc/82/07/96/576820796.db2.gz	RDPYZDBDNDIBJH-GFCCVEGCSA-N	0	3	347.415	3.164	20	30		EGEDHN
CC(C)CC(=O)NCCC(=O)C(C#N)c1nc2cc(F)ccc2s1	ZINC000744119450	576820832	/nfs/dbraw/zinc/82/08/32/576820832.db2.gz	RDPYZDBDNDIBJH-LBPRGKRZSA-N	0	3	347.415	3.164	20	30		EGEDHN
C=CCN(CCc1ccccc1)C(=O)NC[C@H](C)N1CCCCC1	ZINC000744855202	576835657	/nfs/dbraw/zinc/83/56/57/576835657.db2.gz	ZPPWPBGLGRRSKD-SFHVURJKSA-N	0	3	329.488	3.301	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000769297516	1303087589	/nfs/dbraw/zinc/08/75/89/1303087589.db2.gz	BAOJLPARDXDRRQ-KRWDZBQOSA-N	0	3	329.444	3.390	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@H](C)SCc1ccccc1	ZINC000049252954	1291625349	/nfs/dbraw/zinc/62/53/49/1291625349.db2.gz	NNIHSWOGCGFHOE-HOCLYGCPSA-N	0	3	332.469	3.324	20	30		EGEDHN
CCN1CCN(c2ccc(NC(=O)C#Cc3ccccc3)c(C)c2)CC1	ZINC000080495358	1292606966	/nfs/dbraw/zinc/60/69/66/1292606966.db2.gz	SBZXRCITJPEIMG-UHFFFAOYSA-N	0	3	347.462	3.127	20	30		EGEDHN
C#CC1CCN(CC(=O)N2CC=C(c3c[nH]c4ccccc43)CC2)CC1	ZINC000830338051	1292707919	/nfs/dbraw/zinc/70/79/19/1292707919.db2.gz	PLGHJDBHQLPFDQ-UHFFFAOYSA-N	0	3	347.462	3.129	20	30		EGEDHN
Cc1nc(C)c(C(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)s1	ZINC000100949168	1292966209	/nfs/dbraw/zinc/96/62/09/1292966209.db2.gz	ZRUBJGCOCRKYMB-GFCCVEGCSA-N	0	3	333.800	3.375	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@@H](C)CSc1ccccc1	ZINC000111944217	1293113281	/nfs/dbraw/zinc/11/32/81/1293113281.db2.gz	JIYIXBKWUQVGMY-HOCLYGCPSA-N	0	3	332.469	3.430	20	30		EGEDHN
Cn1c(C#N)ccc1C(=O)OC[C@H]1CCCCN1Cc1ccccc1	ZINC000835391606	1293281381	/nfs/dbraw/zinc/28/13/81/1293281381.db2.gz	JXYVTDLWWCNESK-GOSISDBHSA-N	0	3	337.423	3.108	20	30		EGEDHN
C=C(Br)CN[C@@](C)(CNC(=O)OC(C)(C)C)C(C)C	ZINC000121858147	1293393115	/nfs/dbraw/zinc/39/31/15/1293393115.db2.gz	KARZFTQDFLLKCE-AWEZNQCLSA-N	0	3	335.286	3.424	20	30		EGEDHN
C=CC(C)(C)CNC(=O)Nc1ccc(N2CCN(CC)CC2)cc1	ZINC000836227364	1293463322	/nfs/dbraw/zinc/46/33/22/1293463322.db2.gz	JMZQFICWUTVIHN-UHFFFAOYSA-N	0	3	330.476	3.162	20	30		EGEDHN
Cc1ccc(C(C)C)cc1O[C@@H](C)C(=O)C(C#N)C(=O)N1CCCC1	ZINC000124844442	1293487152	/nfs/dbraw/zinc/48/71/52/1293487152.db2.gz	KTCJBLMUPAWOGL-DOTOQJQBSA-N	0	3	342.439	3.217	20	30		EGEDHN
N#CC(C(=O)CCCc1cccs1)C(=O)NCc1ccccc1	ZINC000126685902	1293541891	/nfs/dbraw/zinc/54/18/91/1293541891.db2.gz	FXLVCGGNVYRRQA-MRXNPFEDSA-N	0	3	326.421	3.096	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)COc2ccc(C)c(C)c2)c1	ZINC000127494191	1293565776	/nfs/dbraw/zinc/56/57/76/1293565776.db2.gz	SNURNSCOCJEWFI-SFHVURJKSA-N	0	3	336.391	3.338	20	30		EGEDHN
N#CC(C(=O)CCCOc1ccc(F)cc1)C(=O)Nc1ccccc1	ZINC000128162410	1293584608	/nfs/dbraw/zinc/58/46/08/1293584608.db2.gz	WPQAGSCUPMFKGR-KRWDZBQOSA-N	0	3	340.354	3.332	20	30		EGEDHN
COc1ccc([C@@H](CCO)NCc2ccc(O[C@H](C)C#N)cc2)cc1	ZINC000128726269	1293602111	/nfs/dbraw/zinc/60/21/11/1293602111.db2.gz	KYASBIYSXVTIKZ-FOIQADDNSA-N	0	3	340.423	3.199	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)C[C@@H]2C=CCC2)cc1Cl	ZINC000130319942	1293652506	/nfs/dbraw/zinc/65/25/06/1293652506.db2.gz	NHQLPSHXQZEBHB-DGCLKSJQSA-N	0	3	332.787	3.352	20	30		EGEDHN
CCCCc1ccc(C(=O)CCC(=O)C(C#N)C(=O)NC(C)C)cc1	ZINC000131066799	1293678069	/nfs/dbraw/zinc/67/80/69/1293678069.db2.gz	JDQFDRJRVSVTTB-KRWDZBQOSA-N	0	3	342.439	3.226	20	30		EGEDHN
C#CCOc1ccccc1CNC[C@H](O)c1ccc(Cl)c(F)c1	ZINC000136147069	1293810006	/nfs/dbraw/zinc/81/00/06/1293810006.db2.gz	XMXCYJWATOAHPX-KRWDZBQOSA-N	0	3	333.790	3.314	20	30		EGEDHN
N#CC(C(=O)Nc1cccc2ccccc21)C(=O)c1cncc(F)c1	ZINC000151606215	1293932347	/nfs/dbraw/zinc/93/23/47/1293932347.db2.gz	JUILYQLJOLMACL-INIZCTEOSA-N	0	3	333.322	3.335	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@H](C)c1c(F)cccc1F	ZINC000153195931	1294002705	/nfs/dbraw/zinc/00/27/05/1294002705.db2.gz	CVGBHUNQOIWENK-CHWSQXEVSA-N	0	3	336.382	3.474	20	30		EGEDHN
C#CCOc1cc(F)ccc1NC(=O)N(CCN(C)C)C1CCCC1	ZINC000154833935	1294073286	/nfs/dbraw/zinc/07/32/86/1294073286.db2.gz	AMUSQMANILEQRA-UHFFFAOYSA-N	0	3	347.434	3.176	20	30		EGEDHN
C#CCOc1cc(F)ccc1NC(=O)c1ccc(CN(C)C)cc1	ZINC000155163065	1294086814	/nfs/dbraw/zinc/08/68/14/1294086814.db2.gz	DTBDSUBGZGJZFQ-UHFFFAOYSA-N	0	3	326.371	3.152	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)Cc1csc(C(C)(C)C)n1	ZINC000170672366	1294376105	/nfs/dbraw/zinc/37/61/05/1294376105.db2.gz	CILSTMZKEFGLSL-CQSZACIVSA-N	0	3	349.500	3.388	20	30		EGEDHN
N#CC(C(=O)CC[C@@H]1CCCCO1)C(=O)Nc1ccc(Cl)cc1	ZINC000171796840	1294417842	/nfs/dbraw/zinc/41/78/42/1294417842.db2.gz	IDABCXCZNOKXKF-LSDHHAIUSA-N	0	3	334.803	3.337	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)C(=O)NC1CC1)c1ccccc1C(F)(F)F	ZINC000173975009	1294475278	/nfs/dbraw/zinc/47/52/78/1294475278.db2.gz	TZFIPNALVIWGJP-GXFFZTMASA-N	0	3	338.329	3.186	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)CC[C@@H]2CCOC2)cc1	ZINC000176092205	1294591009	/nfs/dbraw/zinc/59/10/09/1294591009.db2.gz	HLMFXTHRWZAEFR-SJLPKXTDSA-N	0	3	342.439	3.493	20	30		EGEDHN
C=CCNC(=O)CN[C@H]1CCCc2cc(SC(F)F)ccc21	ZINC000180037739	1294854194	/nfs/dbraw/zinc/85/41/94/1294854194.db2.gz	YXWDPRZJPNGARE-AWEZNQCLSA-N	0	3	326.412	3.271	20	30		EGEDHN
C=CCC[C@@H](NCC(=O)Nc1ccccc1C(N)=O)c1ccccc1	ZINC000180049258	1294855815	/nfs/dbraw/zinc/85/58/15/1294855815.db2.gz	VKZREUUFBUTIRR-QGZVFWFLSA-N	0	3	337.423	3.021	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)CCOc1c(C)cccc1C	ZINC000193380512	1295859767	/nfs/dbraw/zinc/85/97/67/1295859767.db2.gz	MQAMOWBSEDMECA-MRXNPFEDSA-N	0	3	330.428	3.088	20	30		EGEDHN
C[C@H](Oc1ccccc1)C(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1	ZINC000193392399	1295862252	/nfs/dbraw/zinc/86/22/52/1295862252.db2.gz	JVRSDKKOIOVWCL-LRDDRELGSA-N	0	3	342.782	3.455	20	30		EGEDHN
N#CC(C(=O)C=Cc1ccc(Cl)s1)C(=O)Nc1ccccn1	ZINC000193529230	1295883959	/nfs/dbraw/zinc/88/39/59/1295883959.db2.gz	OGYKGNHZEJDNMQ-DUMNWFOQSA-N	0	3	331.784	3.157	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1)C(=O)c1cc(Br)cs1	ZINC000194588671	1295992895	/nfs/dbraw/zinc/99/28/95/1295992895.db2.gz	AYEPWZOZGUTQPB-LLVKDONJSA-N	0	3	349.209	3.472	20	30		EGEDHN
N#CC(C(=O)NC1CCCC1)C(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1	ZINC000245903244	1296329986	/nfs/dbraw/zinc/32/99/86/1296329986.db2.gz	GYXBYHPCCIZHOL-XHSDSOJGSA-N	0	3	330.815	3.211	20	30		EGEDHN
N#CC(C(=O)Nc1ccccn1)C(=O)[C@@H]1C[C@@]12CCCc1ccccc12	ZINC000246461941	1296354738	/nfs/dbraw/zinc/35/47/38/1296354738.db2.gz	ADWBJJKHNAJVAJ-HZUJVAHNSA-N	0	3	345.402	3.023	20	30		EGEDHN
N#CC(C(=O)NC1CCCCC1)C(=O)[C@H]1C[C@H]1c1c(F)cccc1F	ZINC000247010138	1296380709	/nfs/dbraw/zinc/38/07/09/1296380709.db2.gz	MHQAZSZFZMZVDR-RDBSUJKOSA-N	0	3	346.377	3.226	20	30		EGEDHN
Cc1ccc(CN(CCN(C)C)C(=O)/C=C\c2ccccc2C#N)o1	ZINC000255599710	1296552984	/nfs/dbraw/zinc/55/29/84/1296552984.db2.gz	WBNDBYPDCBYKJZ-LUAWRHEFSA-N	0	3	337.423	3.063	20	30		EGEDHN
C(=NOCCCOc1ccccc1)c1ccc(N2CCOCC2)cc1	ZINC000255864346	1296572781	/nfs/dbraw/zinc/57/27/81/1296572781.db2.gz	SWUMRJKWWZZHES-UHFFFAOYSA-N	0	3	340.423	3.343	20	30		EGEDHN
C[C@@H]1CC[C@@H](NCc2cc(C#N)cs2)CN1C(=O)OC(C)(C)C	ZINC000690964306	1298132228	/nfs/dbraw/zinc/13/22/28/1298132228.db2.gz	IUGKZFVHWLLZBR-TZMCWYRMSA-N	0	3	335.473	3.497	20	30		EGEDHN
C=C(Cl)C[C@@H](N)C(=O)N1CCC(OC2CCC(C)CC2)CC1	ZINC000876651570	1298898505	/nfs/dbraw/zinc/89/85/05/1298898505.db2.gz	GFDOOPVCOYDLAU-LDZOIKDWSA-N	0	3	328.884	3.043	20	30		EGEDHN
C=C(Cl)C[C@@H](N)C(=O)NCc1cn(C(F)F)c2ccccc12	ZINC000877061132	1299139822	/nfs/dbraw/zinc/13/98/22/1299139822.db2.gz	YKVZTVZOAIHWHX-GFCCVEGCSA-N	0	3	327.762	3.123	20	30		EGEDHN
Cc1nc2sc3c(c2c(N=NC2CN(C)C[C@H]2C)n1)CCCC3	ZINC000752157768	1299703582	/nfs/dbraw/zinc/70/35/82/1299703582.db2.gz	CHQFSILDTRFOCD-SNVBAGLBSA-N	0	3	329.473	3.228	20	30		EGEDHN
CO[C@@H]1C[C@H](N[C@H](C)C(=O)N(CCC#N)c2ccc(C)cc2)C1(C)C	ZINC000753159048	1299885747	/nfs/dbraw/zinc/88/57/47/1299885747.db2.gz	WUBDAANOQIZNCN-BPQIPLTHSA-N	0	3	343.471	3.033	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(OC(F)F)c(Cl)c2)CC1	ZINC000878750513	1300172839	/nfs/dbraw/zinc/17/28/39/1300172839.db2.gz	HFMDOMUHSATREE-UHFFFAOYSA-N	0	3	344.789	3.322	20	30		EGEDHN
C=C(C)[C@H](CC(=O)Nc1ccc(N2CCN(CC)CC2)cc1)OCC	ZINC000755423074	1300338004	/nfs/dbraw/zinc/33/80/04/1300338004.db2.gz	RKGNKFBCNDKPEU-IBGZPJMESA-N	0	3	345.487	3.138	20	30		EGEDHN
Cc1sc(NC(=O)C[NH2+][C@H](C)c2ccccc2[O-])c(C#N)c1C	ZINC000879648908	1300649603	/nfs/dbraw/zinc/64/96/03/1300649603.db2.gz	FRLYMEQJPRHFPA-LLVKDONJSA-N	0	3	329.425	3.232	20	30		EGEDHN
Cc1sc(NC(=O)CN[C@H](C)c2ccccc2O)c(C#N)c1C	ZINC000879648908	1300649609	/nfs/dbraw/zinc/64/96/09/1300649609.db2.gz	FRLYMEQJPRHFPA-LLVKDONJSA-N	0	3	329.425	3.232	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)c1cc(F)cc(Cl)c1	ZINC000757306665	1300664494	/nfs/dbraw/zinc/66/44/94/1300664494.db2.gz	SUHJXZMZILOPRQ-ZDUSSCGKSA-N	0	3	346.745	3.449	20	30		EGEDHN
C#CC[C@@H](NC(=O)[C@@H]1CCCN(Cc2cccnc2)C1)c1ccccc1	ZINC000757618880	1300695732	/nfs/dbraw/zinc/69/57/32/1300695732.db2.gz	ZZJNHKURPDCYAD-NHCUHLMSSA-N	0	3	347.462	3.174	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)c2cc(Cl)cs2)cc1	ZINC000759438644	1301092820	/nfs/dbraw/zinc/09/28/20/1301092820.db2.gz	UKOLJWFVQRPWJK-LBPRGKRZSA-N	0	3	334.784	3.371	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(C)c(N3CCCC3)c2)CC1	ZINC000881006965	1301389405	/nfs/dbraw/zinc/38/94/05/1301389405.db2.gz	GQXNLJUGMUXOGH-UHFFFAOYSA-N	0	3	342.487	3.367	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN2CC=C(c3c[nH]c4ncccc34)CC2)cc1	ZINC000763479820	1301911503	/nfs/dbraw/zinc/91/15/03/1301911503.db2.gz	UAPBOXMFWIGOMM-FQEVSTJZSA-N	0	3	344.418	3.257	20	30		EGEDHN
Cc1ccc(N(CCC#N)C(=O)[C@@H](C)N2CC[C@H](C3CC3)C2)cc1	ZINC000764482897	1302070299	/nfs/dbraw/zinc/07/02/99/1302070299.db2.gz	COUZGFDOPXDTQT-AEFFLSMTSA-N	0	3	325.456	3.362	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)[C@H]2C[C@]23CCOC3)cc1	ZINC000764762184	1302128982	/nfs/dbraw/zinc/12/89/82/1302128982.db2.gz	RKOXFHCSYRDBDR-HLIPFELVSA-N	0	3	340.423	3.103	20	30		EGEDHN
C=CC[C@@H](N[C@@H](C)c1ccc(NS(C)(=O)=O)cc1)c1ccncc1	ZINC000766019528	1302371555	/nfs/dbraw/zinc/37/15/55/1302371555.db2.gz	MGVPPCWXQMBKCX-KBXCAEBGSA-N	0	3	345.468	3.421	20	30		EGEDHN
C#CCCCN[C@@H](c1ccc(F)cc1)c1cccc(S(C)(=O)=O)c1	ZINC000766726771	1302506937	/nfs/dbraw/zinc/50/69/37/1302506937.db2.gz	AEKVARHNDWWIBR-IBGZPJMESA-N	0	3	345.439	3.322	20	30		EGEDHN
C=CCOc1cccc(CN2CCC(C(=O)NCC(C)C)CC2)c1	ZINC000768228796	1302860225	/nfs/dbraw/zinc/86/02/25/1302860225.db2.gz	JWNNZRFSOPMCNC-UHFFFAOYSA-N	0	3	330.472	3.236	20	30		EGEDHN
CN(C)c1ccncc1C=[NH+][N-]c1ccc(Br)c(F)c1	ZINC000769830289	1303182281	/nfs/dbraw/zinc/18/22/81/1303182281.db2.gz	XXKICKKJIJGKEO-UHFFFAOYSA-N	0	3	337.196	3.495	20	30		EGEDHN
C#C[C@H](C)N(C)C[C@@H](O)CO[C@@H](c1ccccc1)c1ccccc1C	ZINC000769976330	1303201559	/nfs/dbraw/zinc/20/15/59/1303201559.db2.gz	ZJHLITDHNDZIQV-DWLFOUALSA-N	0	3	337.463	3.415	20	30		EGEDHN
C=CC[C@H](CO)CNCc1c(C)nn(Cc2ccc(C)cc2)c1Cl	ZINC000774828551	1303864955	/nfs/dbraw/zinc/86/49/55/1303864955.db2.gz	UGTZKCQNILEFBA-KRWDZBQOSA-N	0	3	347.890	3.476	20	30		EGEDHN
Cc1ccc(CC(=O)C(C#N)C(=O)Nc2ccc(F)c(Cl)c2)o1	ZINC000775227356	1303927377	/nfs/dbraw/zinc/92/73/77/1303927377.db2.gz	OPJBWPSCJOMPIX-GFCCVEGCSA-N	0	3	334.734	3.271	20	30		EGEDHN
N#CCCNC(=O)CN[C@@H](Cc1ccccc1Cl)c1ccccc1	ZINC000775297399	1303935947	/nfs/dbraw/zinc/93/59/47/1303935947.db2.gz	RIVINPVWQVVDOV-SFHVURJKSA-N	0	3	341.842	3.243	20	30		EGEDHN
C#C[C@H](N[C@@H](CC)CSc1ccccc1[N+](=O)[O-])[C@H]1CCCO1	ZINC000775571755	1303986785	/nfs/dbraw/zinc/98/67/85/1303986785.db2.gz	KYOXFTZKFGFKJG-OFQRWUPVSA-N	0	3	334.441	3.236	20	30		EGEDHN
N#CCC[C@@H](NC[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1	ZINC000776606115	1304179528	/nfs/dbraw/zinc/17/95/28/1304179528.db2.gz	RQXGFQXHDOYVJZ-QZTJIDSGSA-N	0	3	325.368	3.263	20	30		EGEDHN
C#CCOc1ccccc1CN[C@@H]1CCN(c2ccc(F)cc2F)C1	ZINC000776701131	1304185628	/nfs/dbraw/zinc/18/56/28/1304185628.db2.gz	OVJCFIHFPCRADD-QGZVFWFLSA-N	0	3	342.389	3.345	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)Cc2ccccc2CC#N)CN1Cc1ccccc1	ZINC000777408998	1304291091	/nfs/dbraw/zinc/29/10/91/1304291091.db2.gz	FBBOQMHFJKRUOJ-LAUBAEHRSA-N	0	3	347.462	3.074	20	30		EGEDHN
CC[NH+](CC)Cc1cc(C(C)N=Nc2ccc(OC)cn2)ccc1[O-]	ZINC000780274876	1304669754	/nfs/dbraw/zinc/66/97/54/1304669754.db2.gz	JKSDHBOAGCYDKE-UHFFFAOYSA-N	0	3	342.443	3.474	20	30		EGEDHN
N#CC(C(=O)Nc1ccccn1)C(=O)[C@@H]1C[C@H]1c1ccc(Cl)s1	ZINC000786331307	1305557815	/nfs/dbraw/zinc/55/78/15/1305557815.db2.gz	ZUQAKMMGUFSHHU-GMTAPVOTSA-N	0	3	345.811	3.248	20	30		EGEDHN
Cc1ccc([C@@H](C)C(=O)C(C#N)C(=O)NCc2cccc(Cl)c2)o1	ZINC000786530200	1305590415	/nfs/dbraw/zinc/59/04/15/1305590415.db2.gz	GDJWEYZUWZPVKI-DOMZBBRYSA-N	0	3	344.798	3.370	20	30		EGEDHN
N#CC(C(=O)CC[C@H]1CCCCO1)C(=O)NCc1cccc(Cl)c1	ZINC000786546810	1305594946	/nfs/dbraw/zinc/59/49/46/1305594946.db2.gz	MBIIENRXGQHLNX-CVEARBPZSA-N	0	3	348.830	3.014	20	30		EGEDHN
N#CCCn1cc(CNCc2ccc(C#N)cc2)c(-c2ccncc2)n1	ZINC000788508186	1305958780	/nfs/dbraw/zinc/95/87/80/1305958780.db2.gz	USBOZRURKKNYGQ-UHFFFAOYSA-N	0	3	342.406	3.020	20	30		EGEDHN
CC(C)(CN1CC[C@@](O)(CC#N)C1)c1ccc(Br)cc1	ZINC000895109829	1309193623	/nfs/dbraw/zinc/19/36/23/1309193623.db2.gz	XAKRNYMCBSQMFY-INIZCTEOSA-N	0	3	337.261	3.077	20	30		EGEDHN
C#Cc1ccc(C(=O)Nc2ccc(N3CCN(CC)CC3)cc2)cc1	ZINC000895531980	1309387383	/nfs/dbraw/zinc/38/73/83/1309387383.db2.gz	LPTNQNPSIJPAIX-UHFFFAOYSA-N	0	3	333.435	3.062	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)Cc2c(C)cccc2Cl)C1	ZINC001022366235	1318907335	/nfs/dbraw/zinc/90/73/35/1318907335.db2.gz	FWDBSWJLYTVUOT-BETUJISGSA-N	0	3	327.255	3.180	20	30		EGEDHN
C[C@H](Cn1ccc2ccccc21)C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000796819146	1310093833	/nfs/dbraw/zinc/09/38/33/1310093833.db2.gz	QBNKUTMQVJABCE-ZBFHGGJFSA-N	0	3	346.390	3.020	20	30		EGEDHN
CCC(=O)N1CCCC[C@H]1C(=O)C(C#N)c1ncc(C(C)(C)C)s1	ZINC000797572862	1310213418	/nfs/dbraw/zinc/21/34/18/1310213418.db2.gz	JUFJRGOOCSGOMC-OLZOCXBDSA-N	0	3	347.484	3.408	20	30		EGEDHN
N#Cc1ccc(NCCNCc2csc(C(F)(F)F)c2)nc1	ZINC000897397423	1310320757	/nfs/dbraw/zinc/32/07/57/1310320757.db2.gz	XVOGMMKJAZYGPC-UHFFFAOYSA-N	0	3	326.347	3.235	20	30		EGEDHN
C[C@H](C(=O)C(C#N)c1ncc(C(C)(C)C)s1)N(C)CC(F)(F)F	ZINC000798864999	1310451548	/nfs/dbraw/zinc/45/15/48/1310451548.db2.gz	QAESETOVXHSRFO-NXEZZACHSA-N	0	3	347.406	3.499	20	30		EGEDHN
CCCC[N@H+](Cc1ccccc1[O-])[C@H](C)C(=O)N[C@](C)(C#N)C(C)C	ZINC000801597515	1310971146	/nfs/dbraw/zinc/97/11/46/1310971146.db2.gz	JAYWPIUINYRPHA-OXQOHEQNSA-N	0	3	345.487	3.437	20	30		EGEDHN
CCCC[N@@H+](Cc1ccccc1[O-])[C@H](C)C(=O)N[C@](C)(C#N)C(C)C	ZINC000801597515	1310971157	/nfs/dbraw/zinc/97/11/57/1310971157.db2.gz	JAYWPIUINYRPHA-OXQOHEQNSA-N	0	3	345.487	3.437	20	30		EGEDHN
C#CCN(C)CCCNC(=O)NC(c1ccccc1)c1ccccc1	ZINC000836487873	1320493936	/nfs/dbraw/zinc/49/39/36/1320493936.db2.gz	SECCEGJQIVLBLM-UHFFFAOYSA-N	0	3	335.451	3.030	20	30		EGEDHN
C[C@H](C#N)OCCN(CCCO)Cc1ccc(Cl)c(Cl)c1	ZINC000801920467	1316966157	/nfs/dbraw/zinc/96/61/57/1316966157.db2.gz	PYLSPCQQMZWYDE-GFCCVEGCSA-N	0	3	331.243	3.106	20	30		EGEDHN
C[C@H](C#N)OCCN(Cc1ccccc1)C[C@H](O)c1cccs1	ZINC000801926896	1316966551	/nfs/dbraw/zinc/96/65/51/1316966551.db2.gz	YGGDFUJIZVDTKU-WBVHZDCISA-N	0	3	330.453	3.212	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@@H]1C[C@H]1c1ccccc1CC	ZINC000802039871	1316975621	/nfs/dbraw/zinc/97/56/21/1316975621.db2.gz	ZTEUUCHBTZMOTH-KSZLIROESA-N	0	3	326.440	3.368	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CC[C@H](NCc2cc3ccccc3o2)C1	ZINC001018972761	1316991835	/nfs/dbraw/zinc/99/18/35/1316991835.db2.gz	NKLHLWBDUSLCEK-KRWDZBQOSA-N	0	3	349.434	3.425	20	30		EGEDHN
CC(C)(C(=O)N1CC[C@H](NCc2ccc(C#N)s2)C1)C1CCC1	ZINC001019197980	1317096362	/nfs/dbraw/zinc/09/63/62/1317096362.db2.gz	FRNURYWUWCOWQA-AWEZNQCLSA-N	0	3	331.485	3.137	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)C[C@@H]3CC=CCC3)C2)s1	ZINC001019244246	1317121386	/nfs/dbraw/zinc/12/13/86/1317121386.db2.gz	ZFJVTWHLYOTVKD-CABCVRRESA-N	0	3	329.469	3.057	20	30		EGEDHN
CC1(C(=O)N2CC[C@H](NCc3ccc(C#N)c(F)c3)C2)CCCCC1	ZINC001019324140	1317168981	/nfs/dbraw/zinc/16/89/81/1317168981.db2.gz	UCULFBIYBDHCPV-KRWDZBQOSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=CC(C)(C)CC(=O)N(C)C1CCN(CCc2ccccn2)CC1	ZINC000900466543	1317291287	/nfs/dbraw/zinc/29/12/87/1317291287.db2.gz	HFDQXKRWUUBCLV-UHFFFAOYSA-N	0	3	329.488	3.149	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)cc1C	ZINC001019729446	1317377828	/nfs/dbraw/zinc/37/78/28/1317377828.db2.gz	RDEDYLMYYOSCSD-INIZCTEOSA-N	0	3	339.464	3.241	20	30		EGEDHN
CCCNC(=O)OC[C@H]1CCCCN1Cc1ccc(C#N)cc1C	ZINC000805775127	1317423043	/nfs/dbraw/zinc/42/30/43/1317423043.db2.gz	CFBRMVRBQMIGST-GOSISDBHSA-N	0	3	329.444	3.357	20	30		EGEDHN
C=C[C@@H](C(=O)N1CC[C@H](NCc2cnccc2C)C1)c1ccccc1	ZINC001019805123	1317433238	/nfs/dbraw/zinc/43/32/38/1317433238.db2.gz	UBFFHLDPKOTVQJ-VQTJNVASSA-N	0	3	335.451	3.050	20	30		EGEDHN
C[C@@H](N[C@H]1C[C@H](NC(=O)c2ccc(C#N)[nH]2)C1)c1ccccc1Cl	ZINC001020079818	1317536760	/nfs/dbraw/zinc/53/67/60/1317536760.db2.gz	IQOIGLXJJTZWSG-MRVWCRGKSA-N	0	3	342.830	3.151	20	30		EGEDHN
CN(C)CCN(CCc1ccccc1)C(=O)NCC(C)(C)CCC#N	ZINC000807593743	1317573394	/nfs/dbraw/zinc/57/33/94/1317573394.db2.gz	YZLLWVJHJJDBHG-UHFFFAOYSA-N	0	3	344.503	3.132	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC(CN(CC)Cc2cnc(C)nc2)CC1	ZINC000957737405	1317601417	/nfs/dbraw/zinc/60/14/17/1317601417.db2.gz	FRUSEBPBEKZBQP-UHFFFAOYSA-N	0	3	344.503	3.058	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)Cc2c(C)cccc2Cl)C1	ZINC001020350833	1317656242	/nfs/dbraw/zinc/65/62/42/1317656242.db2.gz	FWDBSWJLYTVUOT-JOCQHMNTSA-N	0	3	327.255	3.180	20	30		EGEDHN
N#Cc1ccc(CNC[C@H](O)c2ccc(C(F)(F)F)cc2)s1	ZINC000808426158	1317675065	/nfs/dbraw/zinc/67/50/65/1317675065.db2.gz	LDFBKGCJYBXUFJ-AWEZNQCLSA-N	0	3	326.343	3.462	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@H](NC(=O)C3(C4CC4)CCC3)C2)c(F)c1	ZINC001020440606	1317697993	/nfs/dbraw/zinc/69/79/93/1317697993.db2.gz	KFSYJPVMGINVMG-QAQDUYKDSA-N	0	3	341.430	3.014	20	30		EGEDHN
C#C[C@H](C)NCc1ccc(OC)c(OCc2ccc([N+](=O)[O-])cc2)c1	ZINC000809683140	1317862085	/nfs/dbraw/zinc/86/20/85/1317862085.db2.gz	QYVQKOGXWRSUQF-AWEZNQCLSA-N	0	3	340.379	3.294	20	30		EGEDHN
C#C[C@@H](NCc1cc(OC)c(OCC(F)F)c(OC)c1)C(C)(C)C	ZINC000809781394	1317899989	/nfs/dbraw/zinc/89/99/89/1317899989.db2.gz	PODXOJUDCWUQFV-OAHLLOKOSA-N	0	3	341.398	3.485	20	30		EGEDHN
CCCCOc1cc(/C=C2\C(=O)c3ncnn3C2C)ccc1OC	ZINC000905081214	1317922049	/nfs/dbraw/zinc/92/20/49/1317922049.db2.gz	PYJHZKFEQOHTGN-OJLMPMFISA-N	0	3	327.384	3.307	20	30		EGEDHN
CC1/C(=C/c2cccc(C(=O)OC(C)(C)C)c2)C(=O)c2ncnn21	ZINC000905083806	1317922270	/nfs/dbraw/zinc/92/22/70/1317922270.db2.gz	FOTVPWMCQAPCRT-RLIURORJSA-N	0	3	325.368	3.074	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@@H](N[C@@H]1CCCN(Cc3ccccc3)C1=O)CC2	ZINC000810229020	1317981531	/nfs/dbraw/zinc/98/15/31/1317981531.db2.gz	QCUGDZGZNNBGFB-LEWJYISDSA-N	0	3	345.446	3.326	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H](C)c2cccc(Cl)c2)C1	ZINC001021074366	1318068914	/nfs/dbraw/zinc/06/89/14/1318068914.db2.gz	PWBCMFOOCCYNSO-CQDKDKBSSA-N	0	3	327.255	3.433	20	30		EGEDHN
Cc1ccoc1C(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1cccc(C#N)c1	ZINC001021194821	1318136139	/nfs/dbraw/zinc/13/61/39/1318136139.db2.gz	XGGHCFOEZWOJJI-YQQQUEKLSA-N	0	3	349.434	3.385	20	30		EGEDHN
C=C1CC(C)(C(=O)NC2C[C@H]3CC[C@@H](C2)N3Cc2cccnc2)C1	ZINC001021370593	1318216007	/nfs/dbraw/zinc/21/60/07/1318216007.db2.gz	IWCSMLOIOLVZOD-AYHJJNSGSA-N	0	3	325.456	3.050	20	30		EGEDHN
CC[C@@H](O)CNN=Cc1ccc(N(CC)Cc2ccccc2)cc1	ZINC000811656767	1318220016	/nfs/dbraw/zinc/22/00/16/1318220016.db2.gz	VTNOVOPWDHUPEN-HXUWFJFHSA-N	0	3	325.456	3.408	20	30		EGEDHN
CC1CC(C(=O)N2CCCC[C@H]2CNCc2ccc(C#N)c(F)c2)C1	ZINC000959947020	1318279875	/nfs/dbraw/zinc/27/98/75/1318279875.db2.gz	GUBKIBQCJMKAFR-UYJHFMRCSA-N	0	3	343.446	3.214	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCCC[C@H]1CNCc1cc(C#N)ccc1OC	ZINC000959957318	1318288453	/nfs/dbraw/zinc/28/84/53/1318288453.db2.gz	XZBBRSYKLQRSOI-FTTDQBRBSA-N	0	3	341.455	3.004	20	30		EGEDHN
C#C[C@@H](C)N(C)C(=O)NC[C@@H](c1ccccc1)N1CCC(C)CC1	ZINC000812010146	1318308983	/nfs/dbraw/zinc/30/89/83/1318308983.db2.gz	GESBDSSGISRFOC-MJGOQNOKSA-N	0	3	327.472	3.123	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@@H]2CN(Cc3ccc(C#N)cc3)CC[C@H]21	ZINC001021512116	1318336770	/nfs/dbraw/zinc/33/67/70/1318336770.db2.gz	UYIUKSNNMLHVON-WOJBJXKFSA-N	0	3	337.467	3.337	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)s1	ZINC000960099407	1318355672	/nfs/dbraw/zinc/35/56/72/1318355672.db2.gz	HEJVJXDQEOBUPV-XJKSGUPXSA-N	0	3	337.464	3.085	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC[C@@H]2CN(Cc3cccc(C#N)c3)CC[C@@H]21	ZINC001021552496	1318395597	/nfs/dbraw/zinc/39/55/97/1318395597.db2.gz	BLOXXIKHKYNIQP-BVYKZDMASA-N	0	3	337.467	3.337	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2nc(C(C)C)oc2C)C1	ZINC001021587330	1318430717	/nfs/dbraw/zinc/43/07/17/1318430717.db2.gz	JNIDGKRVPRMKMC-IRXDYDNUSA-N	0	3	343.471	3.056	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1c(F)cccc1OC	ZINC000960268752	1318435877	/nfs/dbraw/zinc/43/58/77/1318435877.db2.gz	VIFUWUFBHVGLJA-VQIMIIECSA-N	0	3	340.398	3.006	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cccc(Cl)c2C)C1	ZINC001021594921	1318439878	/nfs/dbraw/zinc/43/98/78/1318439878.db2.gz	RPLMZRABXYATFM-CRAIPNDOSA-N	0	3	330.859	3.208	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(C(C)C)nc2)C1	ZINC001021602779	1318446232	/nfs/dbraw/zinc/44/62/32/1318446232.db2.gz	JBIPFACEMPRBDN-ICSRJNTNSA-N	0	3	339.483	3.155	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1occ2c1CCC2	ZINC000960297036	1318449261	/nfs/dbraw/zinc/44/92/61/1318449261.db2.gz	SLYHALRQLLODPA-RTBURBONSA-N	0	3	336.435	3.330	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)C1(c2cccnc2)CC1	ZINC000960300819	1318450460	/nfs/dbraw/zinc/45/04/60/1318450460.db2.gz	RFGMXXZJASRNBF-WOJBJXKFSA-N	0	3	347.462	3.061	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc(C(C)C)no1	ZINC000960309583	1318454322	/nfs/dbraw/zinc/45/43/22/1318454322.db2.gz	BYROZTBVZVYJRB-IEBWSBKVSA-N	0	3	339.439	3.360	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(F)c(C)cc2F)C1	ZINC001021608482	1318454667	/nfs/dbraw/zinc/45/46/67/1318454667.db2.gz	QMEKLIDLTKLMCU-HNAYVOBHSA-N	0	3	346.421	3.223	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1sc(CC)nc1C	ZINC000960314293	1318457016	/nfs/dbraw/zinc/45/70/16/1318457016.db2.gz	OXISFWPEHFOOIO-NVXWUHKLSA-N	0	3	341.480	3.185	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc(F)cc(F)c1	ZINC000960333911	1318467438	/nfs/dbraw/zinc/46/74/38/1318467438.db2.gz	DHBIYHZUKCZHDL-QZTJIDSGSA-N	0	3	328.362	3.136	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)Cc2cccc(C(F)F)c2)C1	ZINC001021633337	1318487684	/nfs/dbraw/zinc/48/76/84/1318487684.db2.gz	QINHUPHJYOZPQT-ROUUACIJSA-N	0	3	346.421	3.113	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(C)c(Cl)c2F)C1	ZINC001021637072	1318491813	/nfs/dbraw/zinc/49/18/13/1318491813.db2.gz	WYUVAQSTKPPDGZ-HOCLYGCPSA-N	0	3	348.849	3.347	20	30		EGEDHN
CO[C@@](C)(C(=O)C(C#N)c1nc2ccccc2n1C(F)F)C1CC1	ZINC000813061188	1318492674	/nfs/dbraw/zinc/49/26/74/1318492674.db2.gz	UFMDADGPFUIPFA-APPDUMDISA-N	0	3	333.338	3.423	20	30		EGEDHN
COC[C@H](C)[C@H](C)C(=O)C(C#N)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000813059721	1318493436	/nfs/dbraw/zinc/49/34/36/1318493436.db2.gz	GTCLSLKCXPJZNW-JBLDHEPKSA-N	0	3	340.782	3.045	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(Cl)cc2C)C1	ZINC001021663704	1318525651	/nfs/dbraw/zinc/52/56/51/1318525651.db2.gz	DIGLFZLMRNJAEK-MAUKXSAKSA-N	0	3	330.859	3.208	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cccc(F)c2Cl)C1	ZINC001021678226	1318547432	/nfs/dbraw/zinc/54/74/32/1318547432.db2.gz	WRYMPDZEQPVTCJ-BBRMVZONSA-N	0	3	334.822	3.039	20	30		EGEDHN
C/C(=C/C(=O)N1CCC[C@H]1CN(C)Cc1cccc(C#N)c1)C1CC1	ZINC000960444905	1318567026	/nfs/dbraw/zinc/56/70/26/1318567026.db2.gz	NHXAJQLNRLPODI-VZEGMYIASA-N	0	3	337.467	3.337	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2[nH]c3ccc(C)cc3c2C)C1	ZINC001021703692	1318576741	/nfs/dbraw/zinc/57/67/41/1318576741.db2.gz	AYNKTJWWILUOPF-XLIONFOSSA-N	0	3	349.478	3.344	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc3sccc3[nH]2)C1	ZINC001021706306	1318578352	/nfs/dbraw/zinc/57/83/52/1318578352.db2.gz	KJSWWBFIUZQRQF-PBHICJAKSA-N	0	3	341.480	3.179	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(CC)c(CC)o2)C1	ZINC001021718338	1318599252	/nfs/dbraw/zinc/59/92/52/1318599252.db2.gz	WWWZWUCGDIIDDI-QZTJIDSGSA-N	0	3	342.483	3.354	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccccc2Cl)C1	ZINC001021720697	1318604501	/nfs/dbraw/zinc/60/45/01/1318604501.db2.gz	YQUQJOPZLAGTEU-MAUKXSAKSA-N	0	3	330.859	3.290	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc3ccccc3c2)C1	ZINC001021721315	1318605969	/nfs/dbraw/zinc/60/59/69/1318605969.db2.gz	DXKHCLLUXNZVEC-SFTDATJTSA-N	0	3	332.447	3.400	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc3[nH]ccc3s2)C1	ZINC001021723599	1318612427	/nfs/dbraw/zinc/61/24/27/1318612427.db2.gz	VMOPJOFSHCJTNI-GDBMZVCRSA-N	0	3	341.480	3.179	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc3ccccc3[nH]2)C1	ZINC001021729437	1318629348	/nfs/dbraw/zinc/62/93/48/1318629348.db2.gz	FCEDWYIQPWNGAR-XLIONFOSSA-N	0	3	335.451	3.118	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(C)c(F)c(C)c2)C1	ZINC001021734911	1318640946	/nfs/dbraw/zinc/64/09/46/1318640946.db2.gz	ATHFEIKJULCIJQ-AEFFLSMTSA-N	0	3	328.431	3.002	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2sccc2CC)C1	ZINC001021738591	1318645438	/nfs/dbraw/zinc/64/54/38/1318645438.db2.gz	APUNPNODPINDQY-DLBZAZTESA-N	0	3	330.497	3.260	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)NCCN1CCC[C@@H]1C	ZINC000814116929	1318678747	/nfs/dbraw/zinc/67/87/47/1318678747.db2.gz	JUKYVFZUPNSAAR-LBPRGKRZSA-N	0	3	327.453	3.296	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N[C@H]1C[C@@H](N[C@H](C)c2ccccc2F)C1	ZINC001022100911	1318795748	/nfs/dbraw/zinc/79/57/48/1318795748.db2.gz	ATJHXWUOASWGHU-LAVBSDLTSA-N	0	3	346.446	3.105	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N1CCc2cc(OCC)c(OCC)cc2C1	ZINC000912115616	1318820518	/nfs/dbraw/zinc/82/05/18/1318820518.db2.gz	GYYUCZHJQPKCKY-KRWDZBQOSA-N	0	3	346.471	3.052	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2oc3ccc(F)cc3c2C)C1	ZINC001022204869	1318840777	/nfs/dbraw/zinc/84/07/77/1318840777.db2.gz	SHPVULPQAQGVIE-BETUJISGSA-N	0	3	336.794	3.483	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc(Cl)cc1C(=O)N1CCCC1	ZINC000912301679	1318864508	/nfs/dbraw/zinc/86/45/08/1318864508.db2.gz	TVPXDJXZMYDGRQ-HNNXBMFYSA-N	0	3	349.862	3.198	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)[C@@H]2CCC=CCCC2)C1	ZINC001022271810	1318868437	/nfs/dbraw/zinc/86/84/37/1318868437.db2.gz	INRLVIAAAULCOP-KFWWJZLASA-N	0	3	341.293	3.268	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccccc2-c2ccncc2)C1	ZINC001022283764	1318873757	/nfs/dbraw/zinc/87/37/57/1318873757.db2.gz	MCLQWICPOHBWSG-IYBDPMFKSA-N	0	3	341.842	3.352	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)Nc1cnn(C[C@@H]2CCCO2)c1	ZINC000912483110	1318893332	/nfs/dbraw/zinc/89/33/32/1318893332.db2.gz	YKEQZIWXPVUDPW-IRXDYDNUSA-N	0	3	336.480	3.079	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]1CN(C)Cc1cccc(OC)c1	ZINC000960792793	1318898852	/nfs/dbraw/zinc/89/88/52/1318898852.db2.gz	WGXNEINYABVEJQ-KRWDZBQOSA-N	0	3	330.472	3.330	20	30		EGEDHN
COc1ccc(C(C)N=Nc2cnccn2)cc1CN1CCCCC1	ZINC000912962022	1318956581	/nfs/dbraw/zinc/95/65/81/1318956581.db2.gz	REPXAVOOIIXHHD-UHFFFAOYSA-N	0	3	339.443	3.307	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc(C)c(Cl)c2F)C1	ZINC001022485524	1318959044	/nfs/dbraw/zinc/95/90/44/1318959044.db2.gz	ZJBHZWHDRWCTSQ-PHIMTYICSA-N	0	3	331.218	3.390	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCC[C@H]1CN(C)Cc1ccc(C#N)cc1	ZINC000960904476	1319046147	/nfs/dbraw/zinc/04/61/47/1319046147.db2.gz	GSXNVPOQLWMTFY-LPHOPBHVSA-N	0	3	327.472	3.273	20	30		EGEDHN
N#CC(C(=O)C1CCC(OC[C@H]2CCCO2)CC1)c1ccccn1	ZINC000815907235	1319070984	/nfs/dbraw/zinc/07/09/84/1319070984.db2.gz	WHZMRKDOKCLYJA-BHUNQDJPSA-N	0	3	328.412	3.012	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc(C(F)F)cc2F)C1	ZINC001022889547	1319152214	/nfs/dbraw/zinc/15/22/14/1319152214.db2.gz	NSILXBWBBMOTHB-PHIMTYICSA-N	0	3	332.753	3.366	20	30		EGEDHN
CC(C)[C@@]1(C)C[C@@H]1C(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001022917165	1319170102	/nfs/dbraw/zinc/17/01/02/1319170102.db2.gz	QXLFELFJVALJMN-AXVVYFOYSA-N	0	3	343.446	3.116	20	30		EGEDHN
CCC(=O)N1CCC[C@H]([C@@H]2CCN(Cc3cc(C#N)ccc3F)C2)C1	ZINC000961070588	1319182882	/nfs/dbraw/zinc/18/28/82/1319182882.db2.gz	URXDSNANGAUWAW-DLBZAZTESA-N	0	3	343.446	3.168	20	30		EGEDHN
CCC(=O)N1CCC[C@@H]([C@H]2CCN(Cc3ccc(C#N)c(F)c3)C2)C1	ZINC000961074565	1319185965	/nfs/dbraw/zinc/18/59/65/1319185965.db2.gz	IYMSYWPETFPYMI-MSOLQXFVSA-N	0	3	343.446	3.168	20	30		EGEDHN
CCCC(=O)N1CCC[C@H]([C@H]2CCN(Cc3ccc(C#N)s3)C2)C1	ZINC000961102361	1319212439	/nfs/dbraw/zinc/21/24/39/1319212439.db2.gz	TZPBWLYZTUBKCY-HOTGVXAUSA-N	0	3	345.512	3.480	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H](CNC(=O)C3CCCCC3)C2)cc1	ZINC001023205295	1319340670	/nfs/dbraw/zinc/34/06/70/1319340670.db2.gz	RHYJNAMBJYHJQX-IBGZPJMESA-N	0	3	339.483	3.467	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]([C@@H]2CCN(Cc3ocnc3C)C2)C1	ZINC000961223221	1319350226	/nfs/dbraw/zinc/35/02/26/1319350226.db2.gz	AHPLVMKQAJRGAC-DLBZAZTESA-N	0	3	345.487	3.256	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)s1)c1ccc(N2CCNC2=O)cc1	ZINC000817589572	1319408831	/nfs/dbraw/zinc/40/88/31/1319408831.db2.gz	OMXJQDKENCYKRY-GFCCVEGCSA-N	0	3	326.425	3.000	20	30		EGEDHN
CC[C@@H]1CCCCN1Cc1cc(=O)n2c3ccccc3[nH]c2c1C#N	ZINC000915217612	1319446006	/nfs/dbraw/zinc/44/60/06/1319446006.db2.gz	WOQAFTMRTBHPNH-CVEARBPZSA-N	0	3	334.423	3.488	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)[C@@H]2CCCC[C@@H]2C(F)(F)F)C1	ZINC001023444878	1319543613	/nfs/dbraw/zinc/54/36/13/1319543613.db2.gz	ZBUYDDJUXJDHHT-XHSDSOJGSA-N	0	3	344.421	3.207	20	30		EGEDHN
C#CCN(C)CCCNC(=O)C1(Sc2ccccc2)CCCC1	ZINC000818599073	1319566147	/nfs/dbraw/zinc/56/61/47/1319566147.db2.gz	AATHRFVJNJCHEE-UHFFFAOYSA-N	0	3	330.497	3.163	20	30		EGEDHN
C#CCN(C)CCCNC(=O)C[C@H](Cc1ccccc1)c1ccccc1	ZINC000818609204	1319569917	/nfs/dbraw/zinc/56/99/17/1319569917.db2.gz	OEFJPVOVVMTGCN-QFIPXVFZSA-N	0	3	348.490	3.474	20	30		EGEDHN
Cc1cccc(C(=O)NC2CC(CNCc3ccccc3C#N)C2)c1	ZINC000961509353	1319624326	/nfs/dbraw/zinc/62/43/26/1319624326.db2.gz	NDRALHHDEOPDKM-UHFFFAOYSA-N	0	3	333.435	3.165	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc(C)c(Cl)cc2C)C1	ZINC001023524850	1319630761	/nfs/dbraw/zinc/63/07/61/1319630761.db2.gz	CKTHOXVWXAWKCB-MRXNPFEDSA-N	0	3	332.875	3.422	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCCN(Cc3cncc(C)c3)C2)cc1	ZINC001023527565	1319633765	/nfs/dbraw/zinc/63/37/65/1319633765.db2.gz	XOARQGYWAVRLPW-IBGZPJMESA-N	0	3	347.462	3.013	20	30		EGEDHN
C=CCN1CCC[C@@H](CNC(=O)c2nc(Cl)sc2Cl)C1	ZINC001023527938	1319633997	/nfs/dbraw/zinc/63/39/97/1319633997.db2.gz	CZARZBWCNQNFMH-VIFPVBQESA-N	0	3	334.272	3.078	20	30		EGEDHN
N#Cc1ccc(F)c(CNCC2CC(NC(=O)C[C@@H]3C=CCC3)C2)c1	ZINC000961533819	1319640464	/nfs/dbraw/zinc/64/04/64/1319640464.db2.gz	NMVVQTSCGWPERK-MXWWQKGMSA-N	0	3	341.430	3.038	20	30		EGEDHN
Cc1ccc(CNC[C@H](O)c2ccc(C#N)cc2)c(OCC2CC2)c1	ZINC000819145186	1319648439	/nfs/dbraw/zinc/64/84/39/1319648439.db2.gz	JXDUMKBHLJTZMP-FQEVSTJZSA-N	0	3	336.435	3.479	20	30		EGEDHN
C=CCn1c(Cc2ccccc2)nnc1SC[C@H]1CCCN1C	ZINC000916675058	1319695429	/nfs/dbraw/zinc/69/54/29/1319695429.db2.gz	XUEYWMMZNUGUGX-MRXNPFEDSA-N	0	3	328.485	3.241	20	30		EGEDHN
Cc1cc(N=NC2CCN(CCO)CC2)nc2ccc(Cl)cc12	ZINC000819803072	1319789286	/nfs/dbraw/zinc/78/92/86/1319789286.db2.gz	GTZQALXCOZKJSL-UHFFFAOYSA-N	0	3	332.835	3.053	20	30		EGEDHN
CC(C)(C)[C@@H]1C[C@H]1C(=O)NC1CC(CNCc2ccccc2C#N)C1	ZINC000962066728	1319814111	/nfs/dbraw/zinc/81/41/11/1319814111.db2.gz	KDENJHUMBJECIO-UNLQRWGISA-N	0	3	339.483	3.225	20	30		EGEDHN
CC1(C(=O)NC2CC(CNCc3cc(C#N)ccc3F)C2)CC=CC1	ZINC000962265485	1319891283	/nfs/dbraw/zinc/89/12/83/1319891283.db2.gz	SIBMPLSNJIRIES-UHFFFAOYSA-N	0	3	341.430	3.038	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cscc2C(F)(F)F)C1	ZINC001023788400	1319936080	/nfs/dbraw/zinc/93/60/80/1319936080.db2.gz	YEQRJQKJEWIQGL-GFCCVEGCSA-N	0	3	344.402	3.232	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N1CC[C@H](C)C[C@H]1c1ccc(C)o1	ZINC000838622795	1320796179	/nfs/dbraw/zinc/79/61/79/1320796179.db2.gz	NLUCKQKNDZQBPS-RDJZCZTQSA-N	0	3	331.460	3.026	20	30		EGEDHN
C#CCN(C)CCCNC(=S)Nc1cc(Cl)cc(Cl)c1	ZINC000840758796	1321142722	/nfs/dbraw/zinc/14/27/22/1321142722.db2.gz	RAAWXEVFFYDXIA-UHFFFAOYSA-N	0	3	330.284	3.235	20	30		EGEDHN
CC[C@H](NC[C@H](O)COc1ccccc1C#N)c1ccccc1OC	ZINC000859228620	1328951683	/nfs/dbraw/zinc/95/16/83/1328951683.db2.gz	UTWDBXUJAFCSDG-WMZOPIPTSA-N	0	3	340.423	3.047	20	30		EGEDHN
CCCCCCO[C@@H](C)C(=O)C(C#N)c1nnc2n1CCCCC2	ZINC000842292159	1321367861	/nfs/dbraw/zinc/36/78/61/1321367861.db2.gz	SCHMXXXPMPUTTO-GJZGRUSLSA-N	0	3	332.448	3.166	20	30		EGEDHN
CC[C@H](OC1CCCC1)C(=O)C(C#N)C(=O)Nc1cccc(OC)c1	ZINC000842288771	1321368343	/nfs/dbraw/zinc/36/83/43/1321368343.db2.gz	LLCLLNWRXMRBCI-SJORKVTESA-N	0	3	344.411	3.080	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H]2C[C@H](O)c2ccc(F)cc2)nc1	ZINC000846831690	1321814064	/nfs/dbraw/zinc/81/40/64/1321814064.db2.gz	KSEJURKZHRMBCS-MOPGFXCFSA-N	0	3	325.387	3.180	20	30		EGEDHN
CCCSCC(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847745639	1321899981	/nfs/dbraw/zinc/89/99/81/1321899981.db2.gz	KZIJPVIQOMCAFV-UHFFFAOYSA-N	0	3	346.496	3.479	20	30		EGEDHN
COC[C@@H](C)CC(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847748900	1321900427	/nfs/dbraw/zinc/90/04/27/1321900427.db2.gz	KEGSFXRLGAYIEC-KRWDZBQOSA-N	0	3	344.455	3.008	20	30		EGEDHN
Cc1c[nH]cc1C(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847745936	1321900785	/nfs/dbraw/zinc/90/07/85/1321900785.db2.gz	RXTXOFUYRNEQFR-UHFFFAOYSA-N	0	3	337.423	3.286	20	30		EGEDHN
CCO[C@@H](CC)C(=O)C(C#N)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000920111031	1322138116	/nfs/dbraw/zinc/13/81/16/1322138116.db2.gz	IERGFFCDGKGMOR-STQMWFEESA-N	0	3	343.210	3.456	20	30		EGEDHN
C#CCOc1ccc(CNCc2ccc(O[C@H]3CCOC3)cc2)cc1	ZINC000850315439	1322226916	/nfs/dbraw/zinc/22/69/16/1322226916.db2.gz	CDPHLHYYPPXEGZ-NRFANRHFSA-N	0	3	337.419	3.156	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@H]1CCCN(C(=O)CCC2CC2)C1	ZINC001023899525	1323012610	/nfs/dbraw/zinc/01/26/10/1323012610.db2.gz	QXWLLWTXHWYQIE-MRXNPFEDSA-N	0	3	343.446	3.216	20	30		EGEDHN
N#Cc1ccccc1CNCC1CC(NC(=O)c2ccc(F)s2)C1	ZINC000962871759	1323139906	/nfs/dbraw/zinc/13/99/06/1323139906.db2.gz	BWGWLRTUDXPQSW-UHFFFAOYSA-N	0	3	343.427	3.057	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@H](CNCc3oc(C)nc3C)C2)CC1	ZINC001024132594	1323156025	/nfs/dbraw/zinc/15/60/25/1323156025.db2.gz	BISFBMPUQXKURZ-QGZVFWFLSA-N	0	3	345.487	3.366	20	30		EGEDHN
CC(C)(C(=O)N1CCC[C@@H](CNCc2ccccc2C#N)C1)C(F)F	ZINC001024147909	1323173630	/nfs/dbraw/zinc/17/36/30/1323173630.db2.gz	OPOQTORVWUNRNE-AWEZNQCLSA-N	0	3	349.425	3.178	20	30		EGEDHN
C#CCCN(CCOC)Cc1c(-c2ccccc2)nc2ccccn21	ZINC000852752656	1323236026	/nfs/dbraw/zinc/23/60/26/1323236026.db2.gz	GPQSOHPNSCEDSB-UHFFFAOYSA-N	0	3	333.435	3.473	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1nsc2ccc(C)cc21	ZINC001024593295	1323526413	/nfs/dbraw/zinc/52/64/13/1323526413.db2.gz	JRHHOHIEWJKBCS-HNNXBMFYSA-N	0	3	341.480	3.212	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@@H]1CCCc2cccnc21	ZINC001024615464	1323543120	/nfs/dbraw/zinc/54/31/20/1323543120.db2.gz	SUEYFDHQYDSSGO-ZWKOTPCHSA-N	0	3	327.472	3.048	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CCCCN2CCOC2CCC2)CC1	ZINC001024634707	1323559835	/nfs/dbraw/zinc/55/98/35/1323559835.db2.gz	WEHXNLMMTHSWFB-GOSISDBHSA-N	0	3	334.504	3.273	20	30		EGEDHN
C=CCCN1CCCC[C@@H]1CNC(=O)c1cnc([C@H]2CCCO2)s1	ZINC001024695522	1323611871	/nfs/dbraw/zinc/61/18/71/1323611871.db2.gz	AIXIMSYJRXITTB-HUUCEWRRSA-N	0	3	349.500	3.155	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cc(C)cc2c[nH]nc21	ZINC001024706216	1323617174	/nfs/dbraw/zinc/61/71/74/1323617174.db2.gz	VYUXATNDPNOCDP-MRXNPFEDSA-N	0	3	326.444	3.032	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccc(-n2cccc2)nc1	ZINC001024715500	1323622715	/nfs/dbraw/zinc/62/27/15/1323622715.db2.gz	GMFYHWIRGJRQPH-SFHVURJKSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@@H]1CCCc2sc(C)nc21	ZINC001024756729	1323656840	/nfs/dbraw/zinc/65/68/40/1323656840.db2.gz	UVJLOIOFNNJWQD-JKSUJKDBSA-N	0	3	347.528	3.418	20	30		EGEDHN
C[C@H](C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)s1)C1CC1	ZINC001024913570	1323778078	/nfs/dbraw/zinc/77/80/78/1323778078.db2.gz	KXFPUJOIAAQYRQ-DZGCQCFKSA-N	0	3	331.485	3.137	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)s1	ZINC001024933149	1323791144	/nfs/dbraw/zinc/79/11/44/1323791144.db2.gz	SJNYTSLOOFGPDA-CJNGLKHVSA-N	0	3	331.485	3.137	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCCC[C@H]1CNCc1ccns1	ZINC001024975349	1323810339	/nfs/dbraw/zinc/81/03/39/1323810339.db2.gz	YQPAEUAXMFJBRV-ZDUSSCGKSA-N	0	3	341.908	3.393	20	30		EGEDHN
CC1(C(=O)N2CCCC[C@H]2CNCc2ccc(C#N)c(F)c2)CCC1	ZINC001025045259	1323849246	/nfs/dbraw/zinc/84/92/46/1323849246.db2.gz	VDFDHCXSCPQHAI-KRWDZBQOSA-N	0	3	343.446	3.358	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)[C@@H]2C[C@H]2C2CC2)s1	ZINC001025110986	1323900445	/nfs/dbraw/zinc/90/04/45/1323900445.db2.gz	YOOBAVKCQYIGTR-FHLIZLRMSA-N	0	3	343.496	3.137	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(C(C)C)n(C)n1	ZINC001025229420	1324015972	/nfs/dbraw/zinc/01/59/72/1324015972.db2.gz	JNTSBUOBSGCRNY-QZTJIDSGSA-N	0	3	344.503	3.189	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(F)ccc1F	ZINC001025239876	1324032883	/nfs/dbraw/zinc/03/28/83/1324032883.db2.gz	JSXQBFBZPJFYIK-MOPGFXCFSA-N	0	3	346.421	3.447	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cccc(CC)n1	ZINC001025241553	1324036259	/nfs/dbraw/zinc/03/62/59/1324036259.db2.gz	YIYHMRFSJHYXBF-RTBURBONSA-N	0	3	327.472	3.289	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc(CC)o1	ZINC001025243720	1324040013	/nfs/dbraw/zinc/04/00/13/1324040013.db2.gz	DXGMMAAPTQRLGQ-QZTJIDSGSA-N	0	3	328.456	3.324	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)COC1CCCCC1	ZINC001025245543	1324043616	/nfs/dbraw/zinc/04/36/16/1324043616.db2.gz	NYFRARDIISRLLQ-UXHICEINSA-N	0	3	346.515	3.205	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cccnc1C1CC1	ZINC001025247720	1324046793	/nfs/dbraw/zinc/04/67/93/1324046793.db2.gz	PKMJFAOJEZQISD-OALUTQOASA-N	0	3	337.467	3.051	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1nc2c(s1)CCC2	ZINC001025251611	1324055968	/nfs/dbraw/zinc/05/59/68/1324055968.db2.gz	JYQCTYXVZJFIFK-HZPDHXFCSA-N	0	3	345.512	3.277	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1c(C)cncc1C	ZINC001025252622	1324056632	/nfs/dbraw/zinc/05/66/32/1324056632.db2.gz	YTOKNUXBVHYANZ-OALUTQOASA-N	0	3	339.483	3.181	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(C)c(C)cn1	ZINC001025252473	1324056645	/nfs/dbraw/zinc/05/66/45/1324056645.db2.gz	OUYQDNNKWDXIRN-PMACEKPBSA-N	0	3	339.483	3.181	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)C1(C(F)F)CCC1	ZINC001025258537	1324067442	/nfs/dbraw/zinc/06/74/42/1324067442.db2.gz	HFHNXXOBYAQTOT-CVEARBPZSA-N	0	3	338.442	3.291	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)C1(c2cc(C)no2)CC1	ZINC001025259481	1324069372	/nfs/dbraw/zinc/06/93/72/1324069372.db2.gz	NWNVIQFOMYXMKL-DLBZAZTESA-N	0	3	343.471	3.046	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)Cc1cc(C)ccc1C	ZINC001025264083	1324074878	/nfs/dbraw/zinc/07/48/78/1324074878.db2.gz	VTPIPMXBJKMTTI-NHCUHLMSSA-N	0	3	338.495	3.325	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1occc1CC	ZINC001025266440	1324077628	/nfs/dbraw/zinc/07/76/28/1324077628.db2.gz	JSVLWGPXAZGXPQ-QZTJIDSGSA-N	0	3	328.456	3.324	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(C)[nH]c1C	ZINC001025273824	1324090911	/nfs/dbraw/zinc/09/09/11/1324090911.db2.gz	HHUCRAXGKKXVLM-RBUKOAKNSA-N	0	3	327.472	3.114	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc2cnccc2c1	ZINC001025286803	1324108567	/nfs/dbraw/zinc/10/85/67/1324108567.db2.gz	LETXSLGEJIWOBU-SFTDATJTSA-N	0	3	347.462	3.327	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1coc(CC2CC2)n1	ZINC001025288153	1324111431	/nfs/dbraw/zinc/11/14/31/1324111431.db2.gz	SKKQFFGHCOEMDX-QZTJIDSGSA-N	0	3	343.471	3.272	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc(C)cc1OC	ZINC001025292436	1324117131	/nfs/dbraw/zinc/11/71/31/1324117131.db2.gz	INZIFBJGHORHOF-OALUTQOASA-N	0	3	340.467	3.096	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc(Cl)cn1	ZINC001025292463	1324117425	/nfs/dbraw/zinc/11/74/25/1324117425.db2.gz	JCAWEXQLVGFPRD-DLBZAZTESA-N	0	3	333.863	3.380	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc(C)cc1OC	ZINC001025292435	1324117437	/nfs/dbraw/zinc/11/74/37/1324117437.db2.gz	INZIFBJGHORHOF-MOPGFXCFSA-N	0	3	340.467	3.096	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)C(C)(C)C(C)(F)F	ZINC001025293465	1324120745	/nfs/dbraw/zinc/12/07/45/1324120745.db2.gz	RVAHDLTXKPBLEU-LSDHHAIUSA-N	0	3	326.431	3.147	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cccn1C(C)C	ZINC001025297626	1324130350	/nfs/dbraw/zinc/13/03/50/1324130350.db2.gz	ZCRZXZWZLDGXOQ-ZWKOTPCHSA-N	0	3	327.472	3.161	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)CC(C1CC1)C1CC1	ZINC001025301551	1324135151	/nfs/dbraw/zinc/13/51/51/1324135151.db2.gz	LRIGGMATADOJAV-WOJBJXKFSA-N	0	3	328.500	3.291	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)CCc1ccc(C)s1	ZINC001025306909	1324140613	/nfs/dbraw/zinc/14/06/13/1324140613.db2.gz	KKMUHTQUKRUVOD-OALUTQOASA-N	0	3	344.524	3.468	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(C(F)F)ccc2F)C1	ZINC001025423420	1324256131	/nfs/dbraw/zinc/25/61/31/1324256131.db2.gz	RSRLALQQNPMVJS-JSGCOSHPSA-N	0	3	338.373	3.227	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccoc2C(F)(F)F)C1	ZINC001025432074	1324268541	/nfs/dbraw/zinc/26/85/41/1324268541.db2.gz	RTKILOLWWRMERQ-QWHCGFSZSA-N	0	3	342.361	3.152	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccccc2C(C)(C)C)C1	ZINC001025450748	1324293932	/nfs/dbraw/zinc/29/39/32/1324293932.db2.gz	MMPDNZGIVLJJOP-IRXDYDNUSA-N	0	3	326.484	3.448	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(C)c3ccccc3n2)C1	ZINC001025457752	1324299834	/nfs/dbraw/zinc/29/98/34/1324299834.db2.gz	FHAXZTOTRVYFQG-DLBZAZTESA-N	0	3	335.451	3.007	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2sc(C)nc2CC(C)C)C1	ZINC001025472215	1324317691	/nfs/dbraw/zinc/31/76/91/1324317691.db2.gz	OKNMXYFSIFRORZ-ZBFHGGJFSA-N	0	3	347.528	3.114	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc3c4c(cccc42)CC3)C1	ZINC001025480160	1324325760	/nfs/dbraw/zinc/32/57/60/1324325760.db2.gz	QOWJPFVVRCGYGG-LPHOPBHVSA-N	0	3	346.474	3.402	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2nc3ccccc3cc2C)C1	ZINC001025485977	1324334553	/nfs/dbraw/zinc/33/45/53/1324334553.db2.gz	QYMRVILLOCHHNE-AEFFLSMTSA-N	0	3	335.451	3.007	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H](C)[C@@H]2CCCN(C/C=C/Cl)C2)cc1	ZINC001025501654	1324350452	/nfs/dbraw/zinc/35/04/52/1324350452.db2.gz	IVUXWNGTWPFHES-NKURCQSBSA-N	0	3	330.859	3.251	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cncc3sccc32)C1	ZINC001025517915	1324361511	/nfs/dbraw/zinc/36/15/11/1324361511.db2.gz	CBCUBMYMQQWQNK-HUUCEWRRSA-N	0	3	341.480	3.150	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(F)c(Cl)c2F)C1	ZINC001025524134	1324370177	/nfs/dbraw/zinc/37/01/77/1324370177.db2.gz	SKKUXYIWRKFCSA-RYUDHWBXSA-N	0	3	340.801	3.082	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(C(F)F)c(F)c2)C1	ZINC001025527895	1324372502	/nfs/dbraw/zinc/37/25/02/1324372502.db2.gz	NIIPDCJSHBYMBT-TZMCWYRMSA-N	0	3	338.373	3.227	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(C(C)C)nc2CC)C1	ZINC001025530615	1324376479	/nfs/dbraw/zinc/37/64/79/1324376479.db2.gz	JUXFNESPHVHVMZ-IRXDYDNUSA-N	0	3	341.499	3.231	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc3cc(F)ccc3o2)C1	ZINC001025548877	1324397544	/nfs/dbraw/zinc/39/75/44/1324397544.db2.gz	KVXWUFCVKXXZBH-UONOGXRCSA-N	0	3	328.387	3.035	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(C(CC)CC)no2)C1	ZINC001025553806	1324401987	/nfs/dbraw/zinc/40/19/87/1324401987.db2.gz	AVMJNVHBARNVMQ-GDBMZVCRSA-N	0	3	331.460	3.042	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(C3CC3)s2)C1	ZINC001025593248	1324439987	/nfs/dbraw/zinc/43/99/87/1324439987.db2.gz	AGKHVKIWWLLERB-ZBFHGGJFSA-N	0	3	330.497	3.479	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(CC)c(CC)o2)C1	ZINC001025598879	1324447842	/nfs/dbraw/zinc/44/78/42/1324447842.db2.gz	CFEAZXAERUTKLU-WBVHZDCISA-N	0	3	330.472	3.258	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2occ3c2CCCC3)C1	ZINC001025602568	1324449895	/nfs/dbraw/zinc/44/98/95/1324449895.db2.gz	IMRQUISPBRAPKG-HZPDHXFCSA-N	0	3	328.456	3.012	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc3[nH]ccc3s2)C1	ZINC001025602635	1324450518	/nfs/dbraw/zinc/45/05/18/1324450518.db2.gz	JEISJYXCCWKEOE-KBPBESRZSA-N	0	3	329.469	3.083	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(F)c(F)cc2Cl)C1	ZINC001025609738	1324460414	/nfs/dbraw/zinc/46/04/14/1324460414.db2.gz	HOYASLIJIIEAFU-VXGBXAGGSA-N	0	3	340.801	3.082	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(C)nc3ccccc32)C1	ZINC001025613673	1324465024	/nfs/dbraw/zinc/46/50/24/1324465024.db2.gz	YZISIBVXGXTAPS-IAGOWNOFSA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc3c(s2)CCC3)C1	ZINC001025615035	1324467736	/nfs/dbraw/zinc/46/77/36/1324467736.db2.gz	RYKJOGLEZGKCAL-GDBMZVCRSA-N	0	3	330.497	3.090	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)C23CC(C(C)(C)C)(C2)C3)C1	ZINC001025632687	1324484909	/nfs/dbraw/zinc/48/49/09/1324484909.db2.gz	NEJPLVPYEAPITA-ZGDXVETISA-N	0	3	330.516	3.443	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cscc2C(F)(F)F)C1	ZINC001025636949	1324488385	/nfs/dbraw/zinc/48/83/85/1324488385.db2.gz	JGISMOIGRFWZCD-VXGBXAGGSA-N	0	3	344.402	3.230	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CC[C@@H]2CN(C(=O)c3ccccc3)C[C@@H]12	ZINC001026180372	1324647524	/nfs/dbraw/zinc/64/75/24/1324647524.db2.gz	JCADEYRSDFBSHH-NJDAHSKKSA-N	0	3	345.446	3.199	20	30		EGEDHN
Cc1occc1C(=O)N1C[C@@H]2CC[C@H](NCc3ccccc3C#N)[C@@H]2C1	ZINC001026193671	1324655992	/nfs/dbraw/zinc/65/59/92/1324655992.db2.gz	SZHHIWBKHQDYTH-SXLOBPIMSA-N	0	3	349.434	3.100	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H]2CC[C@@H](NCc3nc(C)sc3C)[C@@H]2C1	ZINC001026332484	1324732839	/nfs/dbraw/zinc/73/28/39/1324732839.db2.gz	NBVDWKXTRFZGGX-ARFHVFGLSA-N	0	3	347.528	3.299	20	30		EGEDHN
C=C1CCC(C(=O)NC2CCC(NCc3cnc(C)cn3)CC2)CC1	ZINC001026554192	1324890567	/nfs/dbraw/zinc/89/05/67/1324890567.db2.gz	NWABZOKMIVNYMO-UHFFFAOYSA-N	0	3	342.487	3.048	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)C2=CCCCCC2)C1	ZINC001026802834	1325027662	/nfs/dbraw/zinc/02/76/62/1325027662.db2.gz	AVHZBCCLCDTVTD-KRWDZBQOSA-N	0	3	337.467	3.387	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)CC(F)(F)F)C1	ZINC000963272032	1325051367	/nfs/dbraw/zinc/05/13/67/1325051367.db2.gz	RBYPXSGVLJZLPT-STQMWFEESA-N	0	3	338.801	3.394	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)c2cncs2)C1	ZINC000963273564	1325052965	/nfs/dbraw/zinc/05/29/65/1325052965.db2.gz	WSTNPZSAMIRGNC-KGLIPLIRSA-N	0	3	339.892	3.212	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)Cc2ccoc2)C1	ZINC000963290357	1325075739	/nfs/dbraw/zinc/07/57/39/1325075739.db2.gz	OSXACXXDLIBMQJ-SJORKVTESA-N	0	3	336.863	3.278	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)Cc2ccoc2)C1	ZINC000963290354	1325076445	/nfs/dbraw/zinc/07/64/45/1325076445.db2.gz	OSXACXXDLIBMQJ-DLBZAZTESA-N	0	3	336.863	3.278	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)c2cc(F)c[nH]2)C1	ZINC000963338548	1325129047	/nfs/dbraw/zinc/12/90/47/1325129047.db2.gz	WBPCERJUTRRHKR-XJKSGUPXSA-N	0	3	339.842	3.223	20	30		EGEDHN
CC1(C)CCC[C@@H]1C(=O)N1CC[C@@H](CNCc2ccccc2C#N)C1	ZINC001027003803	1325144111	/nfs/dbraw/zinc/14/41/11/1325144111.db2.gz	ZKJDLXISEYSNGM-QFBILLFUSA-N	0	3	339.483	3.323	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC1CC2(C1)CC(NC(=O)C1CCC1)C2	ZINC000963468623	1325268471	/nfs/dbraw/zinc/26/84/71/1325268471.db2.gz	VVOIHYBLMXPFFJ-UHFFFAOYSA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1ccccc1COC)C2	ZINC000964211763	1325488188	/nfs/dbraw/zinc/48/81/88/1325488188.db2.gz	HWDCQUKYGXJGRS-UHFFFAOYSA-N	0	3	348.874	3.216	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1cccc(COC)c1)C2	ZINC000964250452	1325491998	/nfs/dbraw/zinc/49/19/98/1325491998.db2.gz	RNYVCOLFDVUOCA-UHFFFAOYSA-N	0	3	348.874	3.216	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)c(F)c2)C1)C1CC1	ZINC001027352544	1325522286	/nfs/dbraw/zinc/52/22/86/1325522286.db2.gz	XCGKOVFUNPJDSE-KSSFIOAISA-N	0	3	343.446	3.166	20	30		EGEDHN
CC(=O)N1CC[C@H](NCc2ccc(OCC#N)cc2)c2ccccc21	ZINC000857075543	1325570143	/nfs/dbraw/zinc/57/01/43/1325570143.db2.gz	CSMBHXYDRDSSOA-IBGZPJMESA-N	0	3	335.407	3.176	20	30		EGEDHN
Cc1ccc(CO[C@@H](C)C(=O)C(C#N)C(=O)Nc2ccccc2)cc1	ZINC000860468692	1329321069	/nfs/dbraw/zinc/32/10/69/1329321069.db2.gz	FMCUNCJORJESIS-MAUKXSAKSA-N	0	3	336.391	3.248	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)C2CC(OC)C2)cc1	ZINC000860471156	1329321460	/nfs/dbraw/zinc/32/14/60/1329321460.db2.gz	ZHSPPXLNLPPXFM-BDVYOWHSSA-N	0	3	328.412	3.102	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)c2cc(Cl)sc2Cl)C1	ZINC001027443542	1327685521	/nfs/dbraw/zinc/68/55/21/1327685521.db2.gz	MWBBIBKMRCBJCN-JTQLQIEISA-N	0	3	331.268	3.225	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)c2cc3cc(Cl)ccc3o2)C1	ZINC001027482295	1327737157	/nfs/dbraw/zinc/73/71/57/1327737157.db2.gz	BEFSYTCFNGGPLD-HNNXBMFYSA-N	0	3	330.815	3.256	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)[C@@]2(C)C=CCC2)C1	ZINC001027531257	1327814622	/nfs/dbraw/zinc/81/46/22/1327814622.db2.gz	HLCOAAILQCDELV-CTNGQTDRSA-N	0	3	337.467	3.337	20	30		EGEDHN
CC(C)[C@H](F)C(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)c(F)c2)C1	ZINC001027535240	1327826104	/nfs/dbraw/zinc/82/61/04/1327826104.db2.gz	WOFVMLUEHPGKEL-AEFFLSMTSA-N	0	3	349.425	3.114	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)c2c(Cl)oc3ccccc32)C1	ZINC001027543043	1327846721	/nfs/dbraw/zinc/84/67/21/1327846721.db2.gz	YDWRJVLDIMCYTN-CYBMUJFWSA-N	0	3	330.815	3.256	20	30		EGEDHN
Cc1cc(Cl)cc([C@@H](C)[NH2+]CCNc2ccc(C#N)cn2)c1[O-]	ZINC000927167743	1327904618	/nfs/dbraw/zinc/90/46/18/1327904618.db2.gz	NHLBAIKJQUBHDD-GFCCVEGCSA-N	0	3	330.819	3.383	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)[C@@H](Cc2ccccc2)C(C)C)C1	ZINC001027571783	1327905456	/nfs/dbraw/zinc/90/54/56/1327905456.db2.gz	GURXNOAMUWWPOO-PMACEKPBSA-N	0	3	326.484	3.057	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001027605913	1327962779	/nfs/dbraw/zinc/96/27/79/1327962779.db2.gz	YYAVDWDEGNQMHF-APWZRJJASA-N	0	3	327.472	3.273	20	30		EGEDHN
COc1ccc(CN(C)[C@H]2CCCN(C(=O)C(C)(C)C)C2)cc1C#N	ZINC001027658480	1328044775	/nfs/dbraw/zinc/04/47/75/1328044775.db2.gz	KWCYJAKYHNCSLG-KRWDZBQOSA-N	0	3	343.471	3.036	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)CC23CC4CC(CC(C4)C2)C3)C1	ZINC001027662627	1328052630	/nfs/dbraw/zinc/05/26/30/1328052630.db2.gz	PQMDBHGVMHFBJV-TWJKGYNYSA-N	0	3	328.500	3.149	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)c2csc3c2CC[C@@H](C)C3)C1	ZINC001027669841	1328064985	/nfs/dbraw/zinc/06/49/85/1328064985.db2.gz	DJLRMRGAGDOGMY-HUUCEWRRSA-N	0	3	330.497	3.043	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)[C@@H](CC)c2ccc(Cl)cc2)C1	ZINC001027690551	1328095272	/nfs/dbraw/zinc/09/52/72/1328095272.db2.gz	OWRAIDTVXDIURE-ROUUACIJSA-N	0	3	332.875	3.390	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)[C@@H](C)n1c(C)ccc1C)C2	ZINC000965928735	1328113401	/nfs/dbraw/zinc/11/34/01/1328113401.db2.gz	KXYDJLZLQOIZOK-FIXVGMIGSA-N	0	3	349.906	3.435	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2coc(Br)c2)C1	ZINC000966522746	1328332762	/nfs/dbraw/zinc/33/27/62/1328332762.db2.gz	JEXRCEDYSCVARJ-DGCLKSJQSA-N	0	3	341.249	3.058	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)C2(c3cccc(Cl)c3)CC2)C1	ZINC000966567431	1328344105	/nfs/dbraw/zinc/34/41/05/1328344105.db2.gz	RZPKITLZNWGGIK-CRAIPNDOSA-N	0	3	344.886	3.222	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1coc2c1cccc2OC	ZINC001027884677	1328352582	/nfs/dbraw/zinc/35/25/82/1328352582.db2.gz	OGUHHADGPNMBOR-CQSZACIVSA-N	0	3	328.412	3.212	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CN(Cc2ccccc2)CC[C@@H]1C	ZINC000966691126	1328382258	/nfs/dbraw/zinc/38/22/58/1328382258.db2.gz	DJIAPNSHAAHVDY-HKUYNNGSSA-N	0	3	337.467	3.315	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CN(Cc2ccccc2)CC[C@H]1C	ZINC000966691136	1328382305	/nfs/dbraw/zinc/38/23/05/1328382305.db2.gz	DJIAPNSHAAHVDY-MJGOQNOKSA-N	0	3	337.467	3.315	20	30		EGEDHN
C=C(C)CCN1CCC[C@H]1CNC(=O)c1scnc1C(F)F	ZINC001028022511	1328484339	/nfs/dbraw/zinc/48/43/39/1328484339.db2.gz	KFCWTAIKXDYPGV-NSHDSACASA-N	0	3	329.416	3.241	20	30		EGEDHN
N#Cc1ccsc1NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000931848432	1329766125	/nfs/dbraw/zinc/76/61/25/1329766125.db2.gz	AGKSYZYQQLDGTB-HNNXBMFYSA-N	0	3	326.425	3.016	20	30		EGEDHN
CC(C)N1CCC[C@@H]1C(=O)N1CCC[C@H]1[C@H](C#N)c1ccccc1	ZINC000933858660	1329928700	/nfs/dbraw/zinc/92/87/00/1329928700.db2.gz	QRGUSBXKTZKSBZ-CEXWTWQISA-N	0	3	325.456	3.158	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C3CC3)[nH]c2C2CC2)[C@H](C)C1	ZINC000942172298	1331858943	/nfs/dbraw/zinc/85/89/43/1331858943.db2.gz	BYMMODSANSUFOJ-RDTXWAMCSA-N	0	3	339.483	3.233	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(F)cc3ccoc32)[C@H](C)C1	ZINC000942199781	1331875646	/nfs/dbraw/zinc/87/56/46/1331875646.db2.gz	HMUXMXSKNGOJCX-CXAGYDPISA-N	0	3	328.387	3.035	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2[nH]c3ccccc3c2Cl)[C@@H](C)C1	ZINC000942260255	1331891086	/nfs/dbraw/zinc/89/10/86/1331891086.db2.gz	XYHZMWLVNKTGDL-ZFWWWQNUSA-N	0	3	343.858	3.285	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(CCCC)cc2)[C@H](C)C1	ZINC000942270844	1331892023	/nfs/dbraw/zinc/89/20/23/1331892023.db2.gz	GHRHKJZKPZZMOC-NQIIRXRSSA-N	0	3	340.511	3.422	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2scnc2C2CCCC2)[C@H](C)C1	ZINC000942301221	1331898600	/nfs/dbraw/zinc/89/86/00/1331898600.db2.gz	CLLFJVMONAAFHA-GDBMZVCRSA-N	0	3	345.512	3.264	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3ccccc3cc2F)[C@@H](C)C1	ZINC000942442915	1331934524	/nfs/dbraw/zinc/93/45/24/1331934524.db2.gz	BGYRZCHFXQNCJV-YWZLYKJASA-N	0	3	338.426	3.442	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2cccc(C(F)F)c2)[C@@H](C)C1	ZINC000942467136	1331941379	/nfs/dbraw/zinc/94/13/79/1331941379.db2.gz	NYFSHHXCRUHGFM-WMLDXEAASA-N	0	3	334.410	3.017	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cnc3ccccc3c2C)[C@H](C)C1	ZINC000942523370	1331954182	/nfs/dbraw/zinc/95/41/82/1331954182.db2.gz	PIWGMIXFBNXLHC-BEFAXECRSA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C)c(Cl)c2F)[C@@H](C)C1	ZINC000942527801	1331958119	/nfs/dbraw/zinc/95/81/19/1331958119.db2.gz	RRYYEPVPHOPMLT-ZFWWWQNUSA-N	0	3	336.838	3.251	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2c(Cl)cncc2Cl)[C@H](C)C1	ZINC000942593994	1331994621	/nfs/dbraw/zinc/99/46/21/1331994621.db2.gz	BGVLUDCXYJYBBQ-MFKMUULPSA-N	0	3	328.243	3.015	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(F)c(Cl)cc2F)[C@@H](C)C1	ZINC000942585462	1331990685	/nfs/dbraw/zinc/99/06/85/1331990685.db2.gz	FUHBAMBMAXZIMZ-ZBEGNZNMSA-N	0	3	340.801	3.082	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(F)c(Cl)cc2F)[C@@H](C)C1	ZINC000942585461	1331990890	/nfs/dbraw/zinc/99/08/90/1331990890.db2.gz	FUHBAMBMAXZIMZ-MEDUHNTESA-N	0	3	340.801	3.082	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2c(F)ccc(F)c2Cl)[C@H](C)C1	ZINC000942959266	1332066983	/nfs/dbraw/zinc/06/69/83/1332066983.db2.gz	KPVUIMCWGLYNKB-RISCZKNCSA-N	0	3	340.801	3.082	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(C(C)(C)C)cc2)[C@@H](C)C1	ZINC000942959035	1332067125	/nfs/dbraw/zinc/06/71/25/1332067125.db2.gz	JELXYLJTCJSIFN-PXNSSMCTSA-N	0	3	340.511	3.377	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2csc(-c3ccoc3)n2)[C@@H](C)C1	ZINC000943688539	1332238674	/nfs/dbraw/zinc/23/86/74/1332238674.db2.gz	DZNQKVCQIFLWKH-GXTWGEPZSA-N	0	3	331.441	3.029	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(Cl)c(CCC)c2)[C@H](C)C1	ZINC000944082736	1332323433	/nfs/dbraw/zinc/32/34/33/1332323433.db2.gz	ZPVRXXRBUXQLRE-KDOFPFPSSA-N	0	3	332.875	3.366	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(Cl)c(Cl)c2)[C@@H](C)C1	ZINC000944306530	1332368830	/nfs/dbraw/zinc/36/88/30/1332368830.db2.gz	SGQNMLVSEPHFTB-LRDDRELGSA-N	0	3	339.266	3.457	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(F)c(F)cc2Cl)[C@@H](C)C1	ZINC000944617939	1332417377	/nfs/dbraw/zinc/41/73/77/1332417377.db2.gz	ABYLTUQQXYKRER-BONVTDFDSA-N	0	3	328.790	3.244	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)C2CC(F)(F)C2)CCN1Cc1ccc(C#N)cc1	ZINC000947171397	1333035918	/nfs/dbraw/zinc/03/59/18/1333035918.db2.gz	UVLAIRIRLZFQAI-CXAGYDPISA-N	0	3	347.409	3.073	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)C2CC(C)(C)C2)CCN1Cc1cccc(C#N)c1	ZINC000947271493	1333072271	/nfs/dbraw/zinc/07/22/71/1333072271.db2.gz	JFWGJIYPMNBPSH-KXBFYZLASA-N	0	3	339.483	3.464	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2c(F)ccc3ccncc32)C[C@H]1C	ZINC000947328344	1333091262	/nfs/dbraw/zinc/09/12/62/1333091262.db2.gz	QMSHOAYXIOBALX-HIFRSBDPSA-N	0	3	327.403	3.143	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2snc(Cl)c2Cl)C[C@H]1C	ZINC000947356519	1333101438	/nfs/dbraw/zinc/10/14/38/1333101438.db2.gz	MROKFYZNACOPMR-BDAKNGLRSA-N	0	3	334.272	3.219	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2oc3ccc(F)cc3c2C)C[C@H]1C	ZINC000947390789	1333112292	/nfs/dbraw/zinc/11/22/92/1333112292.db2.gz	ABFYTWJQVIOGCL-CZUORRHYSA-N	0	3	342.414	3.486	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)Cc2ccccc2)CCN1Cc1ccc(C#N)cc1	ZINC000947455607	1333135659	/nfs/dbraw/zinc/13/56/59/1333135659.db2.gz	UVKHQHWESHGKBO-DYESRHJHSA-N	0	3	347.462	3.270	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc(C)cc2Cl)C[C@H]1C	ZINC000947459677	1333136426	/nfs/dbraw/zinc/13/64/26/1333136426.db2.gz	OFJHEQVVZGUHGS-NVXWUHKLSA-N	0	3	332.875	3.183	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(-c3ccccc3)no2)C[C@@H]1C	ZINC000947487577	1333144776	/nfs/dbraw/zinc/14/47/76/1333144776.db2.gz	GDELUSOJIMIGBG-HOCLYGCPSA-N	0	3	325.412	3.110	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2c(C)cccc2Cl)C[C@@H]1C	ZINC000947496452	1333146739	/nfs/dbraw/zinc/14/67/39/1333146739.db2.gz	BCQJBVUYRMNFRG-HOTGVXAUSA-N	0	3	332.875	3.183	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2scnc2C2CCCC2)C[C@@H]1C	ZINC000947505996	1333149579	/nfs/dbraw/zinc/14/95/79/1333149579.db2.gz	ICACXLSBBPXWHL-GOEBONIOSA-N	0	3	345.512	3.407	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2sc(C)nc2CC(C)C)C[C@H]1C	ZINC000947506612	1333150240	/nfs/dbraw/zinc/15/02/40/1333150240.db2.gz	SFMQTRDNPIKUAQ-UKRRQHHQSA-N	0	3	335.517	3.419	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc3c4c(cccc42)CC3)C[C@@H]1C	ZINC000947520673	1333155996	/nfs/dbraw/zinc/15/59/96/1333155996.db2.gz	QTCUCKVBFDMNAE-YJBOKZPZSA-N	0	3	332.447	3.154	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cn(CC)c3ccccc23)C[C@H]1C	ZINC000947523719	1333157029	/nfs/dbraw/zinc/15/70/29/1333157029.db2.gz	HSJCRFUMQFNARG-SJORKVTESA-N	0	3	337.467	3.267	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc(C(F)F)cc2)C[C@@H]1C	ZINC000947540858	1333165218	/nfs/dbraw/zinc/16/52/18/1333165218.db2.gz	ZKTYUEBYSSCVEF-WMLDXEAASA-N	0	3	334.410	3.159	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(Cc3ncccc3C)[C@@H](C)C2)cc1	ZINC000947611142	1333191953	/nfs/dbraw/zinc/19/19/53/1333191953.db2.gz	HONOCXYKDBFOKZ-FXAWDEMLSA-N	0	3	347.462	3.154	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2nsc3ccc(C)cc32)C[C@H]1C	ZINC000947621792	1333196207	/nfs/dbraw/zinc/19/62/07/1333196207.db2.gz	WKIZICZGLDRBAV-ZIAGYGMSSA-N	0	3	329.469	3.373	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3cccc(C#N)c3)[C@H](C)C2)C1	ZINC000947702345	1333233121	/nfs/dbraw/zinc/23/31/21/1333233121.db2.gz	MVXGBBRCXOIMRV-APWZRJJASA-N	0	3	337.467	3.384	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(F)cc3cccnc32)C[C@@H]1C	ZINC000947767176	1333255192	/nfs/dbraw/zinc/25/51/92/1333255192.db2.gz	METCKJUPNJGIGL-BBRMVZONSA-N	0	3	327.403	3.143	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(F)c3ncccc3c2)C[C@H]1C	ZINC000947809404	1333267053	/nfs/dbraw/zinc/26/70/53/1333267053.db2.gz	BZCSFDYILBNGCD-CJNGLKHVSA-N	0	3	327.403	3.143	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2sc(CC3CC3)nc2C)C[C@@H]1C	ZINC000947861456	1333284507	/nfs/dbraw/zinc/28/45/07/1333284507.db2.gz	MSJCVRSIVKQTIE-BBRMVZONSA-N	0	3	345.512	3.010	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C(C)(C)c2ccc(CC)cc2)C[C@@H]1C	ZINC000947907275	1333301698	/nfs/dbraw/zinc/30/16/98/1333301698.db2.gz	FYZVWOGIBNYMHY-QFBILLFUSA-N	0	3	326.484	3.129	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnn(C(C)C)c2C2CC2)C[C@@H]1C	ZINC000947913074	1333305436	/nfs/dbraw/zinc/30/54/36/1333305436.db2.gz	VCERIDWANDFEKW-HOCLYGCPSA-N	0	3	330.476	3.110	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2cccc3ccccc32)C[C@H]1C	ZINC000947956898	1333319473	/nfs/dbraw/zinc/31/94/73/1333319473.db2.gz	GFXDZRIFJSLYMC-YLJYHZDGSA-N	0	3	334.463	3.375	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(Cl)c(Cl)c2)C[C@@H]1C	ZINC000947967448	1333325039	/nfs/dbraw/zinc/32/50/39/1333325039.db2.gz	PAJUCLSFBSOZRV-WCQYABFASA-N	0	3	325.239	3.209	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccccc2C(F)(F)F)C[C@@H]1C	ZINC000947962065	1333321685	/nfs/dbraw/zinc/32/16/85/1333321685.db2.gz	JEMWEUIWCANMPT-STQMWFEESA-N	0	3	326.362	3.474	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cccc3c2OCC3(C)C)C[C@@H]1C	ZINC000948104281	1333375130	/nfs/dbraw/zinc/37/51/30/1333375130.db2.gz	KZGCSBGHFAPSME-GJZGRUSLSA-N	0	3	328.456	3.125	20	30		EGEDHN
CN(C(=O)c1ccc[nH]1)[C@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948180841	1333411297	/nfs/dbraw/zinc/41/12/97/1333411297.db2.gz	FWVRMMGRQDYUQX-SFHVURJKSA-N	0	3	336.439	3.013	20	30		EGEDHN
CN(C(=O)[C@H]1CC1(F)F)[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948355455	1333490984	/nfs/dbraw/zinc/49/09/84/1333490984.db2.gz	ZMLKAGSKCOWKFT-IAGOWNOFSA-N	0	3	347.409	3.026	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2snc(Cl)c2Cl)CC1	ZINC000948408874	1333515125	/nfs/dbraw/zinc/51/51/25/1333515125.db2.gz	UKHUWXLANQVYOM-JTQLQIEISA-N	0	3	346.283	3.010	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2cc(C3CCCCC3)n[nH]2)CC1	ZINC000948441551	1333527297	/nfs/dbraw/zinc/52/72/97/1333527297.db2.gz	ARPMVELMRPVMIU-QGZVFWFLSA-N	0	3	342.487	3.017	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2cn(CC)c3ccccc23)CC1	ZINC000948602892	1333593142	/nfs/dbraw/zinc/59/31/42/1333593142.db2.gz	XPBPYQIKXWBSHJ-KRWDZBQOSA-N	0	3	337.467	3.221	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2cnc3ccccc3c2C)CC1	ZINC000948626136	1333601988	/nfs/dbraw/zinc/60/19/88/1333601988.db2.gz	ZIDSDMSRHPJZPT-QGZVFWFLSA-N	0	3	335.451	3.103	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)Cc2cc3ccccc3o2)CC1	ZINC000948658698	1333616868	/nfs/dbraw/zinc/61/68/68/1333616868.db2.gz	PZTXNYFMZMHJTP-SFHVURJKSA-N	0	3	338.451	3.312	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2c(C)cc(F)cc2C)CC1	ZINC000948673760	1333623381	/nfs/dbraw/zinc/62/33/81/1333623381.db2.gz	IBRVHWXNUCJOHM-GOSISDBHSA-N	0	3	330.447	3.392	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2ccc(Cl)cc2OC)CC1	ZINC000948721923	1333645912	/nfs/dbraw/zinc/64/59/12/1333645912.db2.gz	BBOOXYZBUQEMOZ-MRXNPFEDSA-N	0	3	348.874	3.298	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cc(F)c(F)c(F)c2)CC1	ZINC000948804872	1333688117	/nfs/dbraw/zinc/68/81/17/1333688117.db2.gz	SIBXRSNEYLGQJC-CQSZACIVSA-N	0	3	338.373	3.054	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)[C@@H]2C[C@H]2c2cccc(C)c2)CC1	ZINC000948848438	1333708761	/nfs/dbraw/zinc/70/87/61/1333708761.db2.gz	BRMNHQTWLFLZBC-PCCBWWKXSA-N	0	3	338.495	3.435	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2ccc(C(F)F)cc2F)CC1	ZINC000948873082	1333716784	/nfs/dbraw/zinc/71/67/84/1333716784.db2.gz	AZXUFOVQBVMUFM-CQSZACIVSA-N	0	3	338.373	3.323	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@@H]1CNC(=O)C1CC(OCC)C1	ZINC000948912584	1333730893	/nfs/dbraw/zinc/73/08/93/1333730893.db2.gz	HZVVBIRQBBQAQM-QLOJAFMTSA-N	0	3	342.483	3.093	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2c3ccccc3CCN2CCCC)cn1	ZINC000948978409	1333755337	/nfs/dbraw/zinc/75/53/37/1333755337.db2.gz	LVDBTKGVCOWIBF-NRFANRHFSA-N	0	3	347.462	3.192	20	30		EGEDHN
CC#CCN1CCC2(CC1)CN(C(=O)CC1(C)CCCCC1)CCO2	ZINC000949135317	1333783188	/nfs/dbraw/zinc/78/31/88/1333783188.db2.gz	KOQZFAIZJBUXDX-UHFFFAOYSA-N	0	3	346.515	3.064	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1[C@H](C=C(C)C)C1(C)C)CCO2	ZINC000949135072	1333783278	/nfs/dbraw/zinc/78/32/78/1333783278.db2.gz	CBRYMYPVBUUSOS-ZWKOTPCHSA-N	0	3	346.515	3.104	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCOC2(CCN(Cc3ccsc3)CC2)C1	ZINC000949154089	1333785490	/nfs/dbraw/zinc/78/54/90/1333785490.db2.gz	OMYBVDOXENSDQY-UHFFFAOYSA-N	0	3	348.512	3.154	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@@H]1CCCC(C)(C)C1)CCO2	ZINC000949227145	1333798717	/nfs/dbraw/zinc/79/87/17/1333798717.db2.gz	UECRLNNMWZCTJL-SFHVURJKSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@]1(C)CCC(C)=C(C)C1)CCO2	ZINC000949251230	1333804281	/nfs/dbraw/zinc/80/42/81/1333804281.db2.gz	ISETYTHTIIRYMQ-FQEVSTJZSA-N	0	3	346.515	3.392	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@H](C)C3CCC3)CC2)C1	ZINC000949395122	1333836709	/nfs/dbraw/zinc/83/67/09/1333836709.db2.gz	NPKRWPPFXXRGRX-QGZVFWFLSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@H]3CCC3(C)C)CC2)C1	ZINC000949445350	1333848953	/nfs/dbraw/zinc/84/89/53/1333848953.db2.gz	XMFWYQGMGYOALA-QGZVFWFLSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@@H]3CCCC[C@H]3C)CC2)C1	ZINC000949451202	1333850747	/nfs/dbraw/zinc/85/07/47/1333850747.db2.gz	SUAOSJIRNUSZEL-QZTJIDSGSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@H]3CCC(C)(C)C3)CC2)C1	ZINC000949466109	1333855581	/nfs/dbraw/zinc/85/55/81/1333855581.db2.gz	AFHKUZSBNDTPNF-KRWDZBQOSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@H]3C[C@@]3(CC)C(C)C)CC2)C1	ZINC000949504927	1333862591	/nfs/dbraw/zinc/86/25/91/1333862591.db2.gz	XABXBWBPRBEETO-NQIIRXRSSA-N	0	3	348.531	3.328	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3ccc(C)c(C)c3)CC2)C1	ZINC000949523243	1333867030	/nfs/dbraw/zinc/86/70/30/1333867030.db2.gz	JEPBDAZLDSKAGE-UHFFFAOYSA-N	0	3	342.483	3.187	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2cn(C)c3ccccc23)C1	ZINC000967272356	1335682035	/nfs/dbraw/zinc/68/20/35/1335682035.db2.gz	BBSYRLISYYKICY-YJBOKZPZSA-N	0	3	325.456	3.195	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2nc(Cl)sc2C)C1	ZINC000967313645	1335697737	/nfs/dbraw/zinc/69/77/37/1335697737.db2.gz	OKWVSXKFQVJPKO-JQWIXIFHSA-N	0	3	327.881	3.121	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](C)[C@H](NC(=O)c2nc3c(s2)CCC3)C1	ZINC000967376608	1335719558	/nfs/dbraw/zinc/71/95/58/1335719558.db2.gz	INNXYECXKMNHFW-UKRRQHHQSA-N	0	3	333.501	3.038	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)Cc2cn(C)c3ccccc23)C1	ZINC000968104604	1335857404	/nfs/dbraw/zinc/85/74/04/1335857404.db2.gz	GMYSYPJJNRMGDK-APWZRJJASA-N	0	3	339.483	3.124	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CN(CCOC3CCC3)CC[C@H]2C)CC1	ZINC000968193978	1335869532	/nfs/dbraw/zinc/86/95/32/1335869532.db2.gz	XGMWRDNQKHKEFF-VQIMIIECSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)Cc2c[nH]c3ccc(F)cc23)C1	ZINC000968354700	1335900498	/nfs/dbraw/zinc/90/04/98/1335900498.db2.gz	VMRMVBGNAPSPKU-IFXJQAMLSA-N	0	3	343.446	3.252	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](C)[C@H](NC(=O)c2sc(CC)nc2C)C1	ZINC000968406027	1335922380	/nfs/dbraw/zinc/92/23/80/1335922380.db2.gz	WDLLEONJTPSPDO-UKRRQHHQSA-N	0	3	335.517	3.420	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2cccc3ccsc32)C1	ZINC000968506377	1335946265	/nfs/dbraw/zinc/94/62/65/1335946265.db2.gz	SMXOOSQARVCZDV-YOEHRIQHSA-N	0	3	326.465	3.365	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)[C@@]2(c3ccccc3)C[C@H](F)C2)C1	ZINC000968598488	1335979297	/nfs/dbraw/zinc/97/92/97/1335979297.db2.gz	GNHPQKKLJHPOAV-XLBJILASSA-N	0	3	344.474	3.459	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2cc(F)c(F)cc2Cl)C1	ZINC000968609649	1335982279	/nfs/dbraw/zinc/98/22/79/1335982279.db2.gz	JZBHEAOWUKXHDV-MEDUHNTESA-N	0	3	340.801	3.082	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cc(C)n(C(C)C)c2C)C1	ZINC000968630693	1335990164	/nfs/dbraw/zinc/99/01/64/1335990164.db2.gz	APWIQJAHTANGTR-BEFAXECRSA-N	0	3	329.488	3.149	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2c[nH]c3ccc(C)cc23)C1	ZINC000968685584	1336010864	/nfs/dbraw/zinc/01/08/64/1336010864.db2.gz	VXQROFQVWVCLKK-BEFAXECRSA-N	0	3	325.456	3.493	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)C2(c3ccccc3C)CC2)C1	ZINC000968706758	1336018875	/nfs/dbraw/zinc/01/88/75/1336018875.db2.gz	UIPXBIMLKMUMTB-IEBWSBKVSA-N	0	3	326.484	3.429	20	30		EGEDHN
N#Cc1ccc(CN2CCCCC[C@@H]2CNC(=O)[C@@H]2CC2(F)F)cc1	ZINC000968853865	1336068415	/nfs/dbraw/zinc/06/84/15/1336068415.db2.gz	SICLHYXMRUAJGP-SJORKVTESA-N	0	3	347.409	3.074	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1cc(C)n(C(F)F)n1	ZINC000968876580	1336076135	/nfs/dbraw/zinc/07/61/35/1336076135.db2.gz	FSGYZXXEILOSKG-AWEZNQCLSA-N	0	3	340.418	3.137	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1c(C)ccnc1OCC	ZINC000968965403	1336104059	/nfs/dbraw/zinc/10/40/59/1336104059.db2.gz	ODKHSGBVMHOXOB-QGZVFWFLSA-N	0	3	345.487	3.339	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccc(-n2ccnc2)cc1	ZINC000968965697	1336104366	/nfs/dbraw/zinc/10/43/66/1336104366.db2.gz	VQZYYKYFDKNJMA-LJQANCHMSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1ncoc1[C@H]1CCCO1	ZINC000968972954	1336105941	/nfs/dbraw/zinc/10/59/41/1336105941.db2.gz	BJCDOYADOKBWLL-HZPDHXFCSA-N	0	3	347.459	3.077	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1cccc2ncccc21	ZINC000968973468	1336106494	/nfs/dbraw/zinc/10/64/94/1336106494.db2.gz	HIBDNHNEBAOQQU-KRWDZBQOSA-N	0	3	335.451	3.233	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)[C@@H]1C[C@H]1c1ccc(OC)cc1	ZINC000969064475	1336136213	/nfs/dbraw/zinc/13/62/13/1336136213.db2.gz	IAGXMANCGLQVFJ-YSIASYRMSA-N	0	3	342.483	3.346	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cccc(OC(C)C)n1	ZINC000969097154	1336141337	/nfs/dbraw/zinc/14/13/37/1336141337.db2.gz	IBKLOLXJAMWFKL-MRXNPFEDSA-N	0	3	331.460	3.029	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1noc2c1C[C@@H](C)CC2	ZINC000969097450	1336141690	/nfs/dbraw/zinc/14/16/90/1336141690.db2.gz	LPJWKYFYJXEPPR-JKSUJKDBSA-N	0	3	345.487	3.350	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1cccc2ccncc21	ZINC000969098108	1336141944	/nfs/dbraw/zinc/14/19/44/1336141944.db2.gz	WTPPYRMSMQNANY-SFHVURJKSA-N	0	3	335.451	3.233	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1cc(CC(C)C)c[nH]1	ZINC000969118145	1336149829	/nfs/dbraw/zinc/14/98/29/1336149829.db2.gz	GGNRLRGHZYAEHX-SFHVURJKSA-N	0	3	329.488	3.211	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1n[nH]c2c1CCCCC2	ZINC000969141783	1336159400	/nfs/dbraw/zinc/15/94/00/1336159400.db2.gz	LTFOIPFXYGCLEE-INIZCTEOSA-N	0	3	344.503	3.229	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1[nH]c2ccccc2c1OC	ZINC000969160529	1336167560	/nfs/dbraw/zinc/16/75/60/1336167560.db2.gz	GHZDTUPBPNBCSC-OAHLLOKOSA-N	0	3	341.455	3.337	20	30		EGEDHN
CC1(C)CC[C@@H](C(=O)N2CC[C@@H](NCc3ccc(F)c(C#N)c3)C2)C1	ZINC000969867719	1336255195	/nfs/dbraw/zinc/25/51/95/1336255195.db2.gz	SKJWFDAAKBKOHD-NVXWUHKLSA-N	0	3	343.446	3.214	20	30		EGEDHN
CN(C(=O)[C@@H]1CCC1(F)F)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001005561096	1336371719	/nfs/dbraw/zinc/37/17/19/1336371719.db2.gz	ZEKWIDATRQEZEM-KRWDZBQOSA-N	0	3	347.409	3.026	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cc(-c3ccccc3)no2)CC1	ZINC001005647228	1336387397	/nfs/dbraw/zinc/38/73/97/1336387397.db2.gz	CRSAXFUKXVTFQT-UHFFFAOYSA-N	0	3	325.412	3.064	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccc(F)c3ccncc23)CC1	ZINC001005871147	1336413791	/nfs/dbraw/zinc/41/37/91/1336413791.db2.gz	KWJNQAOEDMKGCG-UHFFFAOYSA-N	0	3	341.430	3.486	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccncc2C(F)(F)F)CC1	ZINC001006232345	1336473039	/nfs/dbraw/zinc/47/30/39/1336473039.db2.gz	LQYGOKBHSKJMEJ-UHFFFAOYSA-N	0	3	341.377	3.213	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cc(-c3ccc(C)o3)n[nH]2)CC1	ZINC001006400150	1336499293	/nfs/dbraw/zinc/49/92/93/1336499293.db2.gz	MYBVIXCQQPEEDV-UHFFFAOYSA-N	0	3	342.443	3.091	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CCCN(CCc2cccs2)C1	ZINC001007503490	1336659330	/nfs/dbraw/zinc/65/93/30/1336659330.db2.gz	RPASBOWCCRANQV-INIZCTEOSA-N	0	3	343.496	3.173	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@H]1CCCN(Cc2cccc(C)c2)C1	ZINC001009356638	1337010210	/nfs/dbraw/zinc/01/02/10/1337010210.db2.gz	ZDEGYTLSTJRCCZ-QFIPXVFZSA-N	0	3	346.474	3.300	20	30		EGEDHN
CC(C)c1ccccc1CN1CC[C@H](NC(=O)c2ccc(C#N)[nH]2)C1	ZINC001010653990	1337235842	/nfs/dbraw/zinc/23/58/42/1337235842.db2.gz	DXWWYDSNJFSGEF-KRWDZBQOSA-N	0	3	336.439	3.014	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)[C@H]2C3CCC(CC3)[C@@H]2C(F)(F)F)C1	ZINC001014462343	1337787512	/nfs/dbraw/zinc/78/75/12/1337787512.db2.gz	RFDCGDBRJHJJOX-XJCPWDRGSA-N	0	3	344.421	3.368	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N[C@@H]1CCN(Cc2cccc(C)c2)C1	ZINC001015816971	1338324708	/nfs/dbraw/zinc/32/47/08/1338324708.db2.gz	QZLISVSMIOVLRK-AABGKKOBSA-N	0	3	342.483	3.057	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2c(C)oc3ccccc32)CC1	ZINC001016637312	1338672446	/nfs/dbraw/zinc/67/24/46/1338672446.db2.gz	BFZOZXPMHOWHAH-GOSISDBHSA-N	0	3	336.435	3.349	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2cc(F)c3ccccc3c2)CC1	ZINC001016654505	1338680483	/nfs/dbraw/zinc/68/04/83/1338680483.db2.gz	NPBMMQWZOOSCDF-LJQANCHMSA-N	0	3	336.410	3.196	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cnc3ccccc3c2C)CC1	ZINC001016732834	1338705978	/nfs/dbraw/zinc/70/59/78/1338705978.db2.gz	DFWNYLDPCVDADS-FQEVSTJZSA-N	0	3	347.462	3.151	20	30		EGEDHN
Cc1cocc1C(=O)N[C@@H]1CC12CCN(Cc1cccc(C#N)c1)CC2	ZINC001016768074	1338717854	/nfs/dbraw/zinc/71/78/54/1338717854.db2.gz	WIJQPCWKNYYREV-LJQANCHMSA-N	0	3	349.434	3.244	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC23CCN(Cc2cncc(C)c2)CC3)C1	ZINC001016811158	1338734187	/nfs/dbraw/zinc/73/41/87/1338734187.db2.gz	ADKIEEXKSZJZAO-SFHVURJKSA-N	0	3	339.483	3.217	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)Cc2ccc(F)c(Cl)c2)CC1	ZINC001016847658	1338746188	/nfs/dbraw/zinc/74/61/88/1338746188.db2.gz	NGRLXDZCPJHEGH-KRWDZBQOSA-N	0	3	348.849	3.016	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)[C@H](C)c2ccc(Cl)s2)CC1	ZINC001016919044	1338769473	/nfs/dbraw/zinc/76/94/73/1338769473.db2.gz	JPEVQTFLZFBECR-OCCSQVGLSA-N	0	3	336.888	3.109	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(-c3ccccc3)[nH]2)CC1	ZINC001016998267	1338799077	/nfs/dbraw/zinc/79/90/77/1338799077.db2.gz	PIXUTJNCIMZZRO-FQEVSTJZSA-N	0	3	347.462	3.289	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCCN(C(=O)C2CCC2)C1	ZINC001017015606	1338808078	/nfs/dbraw/zinc/80/80/78/1338808078.db2.gz	ARWQXXZHJRJPSY-CQSZACIVSA-N	0	3	331.485	3.090	20	30		EGEDHN
C[C@@H](c1ccccc1F)N(C)C[C@H]1CCCN(C(=O)C#CC2CC2)C1	ZINC001017121069	1338878772	/nfs/dbraw/zinc/87/87/72/1338878772.db2.gz	PNDQXCSYPWRDNN-FUHWJXTLSA-N	0	3	342.458	3.471	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@H](C)c1c(C)n[nH]c1C	ZINC001017676793	1339388699	/nfs/dbraw/zinc/38/86/99/1339388699.db2.gz	PNUKKPQXWOQUQB-JCGIZDLHSA-N	0	3	344.503	3.162	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1c[nH]c2cccc(C)c12	ZINC001018186381	1339524864	/nfs/dbraw/zinc/52/48/64/1339524864.db2.gz	ZPUSTHVJALJYKL-HDICACEKSA-N	0	3	337.467	3.270	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1Cc2c1cccc2Cl	ZINC001018327349	1339578876	/nfs/dbraw/zinc/57/88/76/1339578876.db2.gz	ULVKABSRKMKOMC-VBQJREDUSA-N	0	3	330.859	3.231	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccccc1N(C)C	ZINC001018334408	1339581356	/nfs/dbraw/zinc/58/13/56/1339581356.db2.gz	JPTLWSBZCICHHK-CALCHBBNSA-N	0	3	327.472	3.008	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)C=C3CCCCC3)C2)cc1F	ZINC001018591380	1339674526	/nfs/dbraw/zinc/67/45/26/1339674526.db2.gz	OLJSOWCDIDWEKC-SFHVURJKSA-N	0	3	341.430	3.278	20	30		EGEDHN
CC1(CC(=O)N2CC[C@H](NCc3ccc(C#N)c(F)c3)C2)CCCC1	ZINC001018805894	1339730894	/nfs/dbraw/zinc/73/08/94/1339730894.db2.gz	USPUIXKXXNNVHB-KRWDZBQOSA-N	0	3	343.446	3.358	20	30		EGEDHN
CC[C@H](N[C@H]1CCN(C(=O)C#CC2CC2)C1)c1ccc(F)cc1F	ZINC001018818043	1339734155	/nfs/dbraw/zinc/73/41/55/1339734155.db2.gz	ADQPSARCEDWQRE-YJBOKZPZSA-N	0	3	332.394	3.020	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1c(F)ccc(F)c1Cl	ZINC001028156877	1340457382	/nfs/dbraw/zinc/45/73/82/1340457382.db2.gz	UZNLPLMYAIUVJN-LLVKDONJSA-N	0	3	328.790	3.389	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1cnc2ccc(F)cc2c1	ZINC001028240658	1340500831	/nfs/dbraw/zinc/50/08/31/1340500831.db2.gz	DABQSGMAMNDECM-QGZVFWFLSA-N	0	3	327.403	3.144	20	30		EGEDHN
C#CCCN1CCC[C@@H]1CNC(=O)c1ccc(Cl)cc1Cl	ZINC001028280132	1340533578	/nfs/dbraw/zinc/53/35/78/1340533578.db2.gz	GRJCKBMQCIUQBU-CYBMUJFWSA-N	0	3	325.239	3.211	20	30		EGEDHN
Cc1ccccc1C(=O)NC[C@@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC001028380671	1340608906	/nfs/dbraw/zinc/60/89/06/1340608906.db2.gz	PMHXPZLUMOBJCE-IBGZPJMESA-N	0	3	333.435	3.119	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H](CNC(=O)c3ccc(Cl)o3)C2)c1	ZINC001028408157	1340630105	/nfs/dbraw/zinc/63/01/05/1340630105.db2.gz	CQTJRZJCHRNLJP-OAHLLOKOSA-N	0	3	343.814	3.057	20	30		EGEDHN
Cc1csc(C(=O)NC[C@@H]2CCN(Cc3ccc(C#N)cc3)C2)c1	ZINC001028529030	1340689355	/nfs/dbraw/zinc/68/93/55/1340689355.db2.gz	UNIXNCNDABXTQF-KRWDZBQOSA-N	0	3	339.464	3.180	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)c2cc(C3CC3)oc2C2CC2)C1	ZINC001028702881	1340768005	/nfs/dbraw/zinc/76/80/05/1340768005.db2.gz	NOXKFWKPCODQFN-CQSZACIVSA-N	0	3	326.440	3.109	20	30		EGEDHN
CC1(C)CCC[C@H]1C(=O)NC[C@@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC001028747025	1340787190	/nfs/dbraw/zinc/78/71/90/1340787190.db2.gz	WARMIOSYQZIQGI-OALUTQOASA-N	0	3	339.483	3.323	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)c2c(Cl)oc3ccccc32)C1	ZINC001028757075	1340793020	/nfs/dbraw/zinc/79/30/20/1340793020.db2.gz	UNQRGMXRTYTRAY-ZDUSSCGKSA-N	0	3	330.815	3.161	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CCN(Cc3ccc(C#N)cc3)C2)CC1	ZINC001028780505	1340812925	/nfs/dbraw/zinc/81/29/25/1340812925.db2.gz	KBLDHSOEHXRKRX-LJQANCHMSA-N	0	3	337.467	3.243	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CCN(Cc3ncccc3C)C2)CC1	ZINC001028780678	1340812938	/nfs/dbraw/zinc/81/29/38/1340812938.db2.gz	LYDOTHLKOTZKMJ-KRWDZBQOSA-N	0	3	327.472	3.075	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)C1CCN(C(=O)CCC2CC2)CC1	ZINC001029070414	1340923008	/nfs/dbraw/zinc/92/30/08/1340923008.db2.gz	NFKCKGBJIFHFCC-INIZCTEOSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)C1CCN(C(=O)[C@H](C)C2CC2)CC1	ZINC001029076853	1340924544	/nfs/dbraw/zinc/92/45/44/1340924544.db2.gz	DJNWDSCDQXZLLC-HZPDHXFCSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC([C@@H](C)NCc2nccn2CC)CC1	ZINC001029123940	1340935790	/nfs/dbraw/zinc/93/57/90/1340935790.db2.gz	AYNNUHGCSMLAQQ-MRXNPFEDSA-N	0	3	346.519	3.222	20	30		EGEDHN
C[C@@H](NCc1cc(F)ccc1C#N)C1CCN(C(=O)[C@@H]2C[C@H]2C)CC1	ZINC001029127599	1340936757	/nfs/dbraw/zinc/93/67/57/1340936757.db2.gz	VMVGXCZWUIAZDB-PJIJBLCYSA-N	0	3	343.446	3.070	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CCC([C@H](C)NCc2ccccc2C#N)CC1	ZINC001029129672	1340937708	/nfs/dbraw/zinc/93/77/08/1340937708.db2.gz	YUJPAOLNBDBKBT-KBXCAEBGSA-N	0	3	331.435	3.023	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC([C@@H](C)NCc2cc(OC)no2)CC1	ZINC001029139566	1340940530	/nfs/dbraw/zinc/94/05/30/1340940530.db2.gz	GGYVYNFLKNVMIK-KUHUBIRLSA-N	0	3	349.475	3.002	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC([C@@H](C)NCc2cnc(C)o2)CC1	ZINC001029139745	1340940622	/nfs/dbraw/zinc/94/06/22/1340940622.db2.gz	IDSZEIRAVSTGFK-KUHUBIRLSA-N	0	3	333.476	3.302	20	30		EGEDHN
N#Cc1cc(C(=O)N2C[C@H]3CC[C@@H](C2)N3CCC2=CCCCC2)c[nH]1	ZINC001029278213	1340966473	/nfs/dbraw/zinc/96/64/73/1340966473.db2.gz	VTFDBFYIELSZLR-KDURUIRLSA-N	0	3	338.455	3.066	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CC[C@@H](C1)N2CCC[C@H]1CCOC1	ZINC001029420337	1340986244	/nfs/dbraw/zinc/98/62/44/1340986244.db2.gz	YGRUVRVTOFDTEF-OKZBNKHCSA-N	0	3	334.504	3.081	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCN(C(=O)CC2CCC2)C1	ZINC001029688101	1341043117	/nfs/dbraw/zinc/04/31/17/1341043117.db2.gz	QDVLMVUQFNGXLN-HNNXBMFYSA-N	0	3	331.485	3.090	20	30		EGEDHN
CC(C(=O)N1CC[C@H](CN(C)Cc2ccc(C#N)s2)C1)=C1CCC1	ZINC001029735868	1341058716	/nfs/dbraw/zinc/05/87/16/1341058716.db2.gz	XWVZPUFKLXPMTN-OAHLLOKOSA-N	0	3	343.496	3.400	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@H](CN(C)Cc2ncccc2C)C1	ZINC001029748471	1341062265	/nfs/dbraw/zinc/06/22/65/1341062265.db2.gz	DXMKAEIGNDDVPR-MRXNPFEDSA-N	0	3	349.906	3.449	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](CN(C)[C@H](C)c2cnc(C)cn2)C1	ZINC001029799752	1341076565	/nfs/dbraw/zinc/07/65/65/1341076565.db2.gz	CWMIWOFKUJFWEJ-IAGOWNOFSA-N	0	3	344.503	3.229	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N1CC[C@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001029834714	1341091617	/nfs/dbraw/zinc/09/16/17/1341091617.db2.gz	YDIFONLGKGJZGE-IIDMSEBBSA-N	0	3	345.512	3.336	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](CN(C)Cc3ccnc(Cl)c3)C2)C1	ZINC001029837181	1341092586	/nfs/dbraw/zinc/09/25/86/1341092586.db2.gz	YRXVJEXGSBAJLD-MRXNPFEDSA-N	0	3	347.890	3.372	20	30		EGEDHN
C=CCn1cccc1C(=O)N1C[C@@H]2C[C@H]1CN2CCC1=CCCCC1	ZINC001032447461	1341512597	/nfs/dbraw/zinc/51/25/97/1341512597.db2.gz	LSASMSFXJNLFSG-OALUTQOASA-N	0	3	339.483	3.463	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cn(C)c2ccc(F)cc12	ZINC001032449518	1341513360	/nfs/dbraw/zinc/51/33/60/1341513360.db2.gz	KIZGWAXAPFWKRT-HOTGVXAUSA-N	0	3	341.430	3.182	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H]3C[C@H]2CN3C[C@H](OC)C2CCCC2)CC1	ZINC001032605663	1341556056	/nfs/dbraw/zinc/55/60/56/1341556056.db2.gz	FMRGRULBLGSEMW-UFYCRDLUSA-N	0	3	346.515	3.223	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)COc1ccccc1C(C)C	ZINC001032771118	1341609754	/nfs/dbraw/zinc/60/97/54/1341609754.db2.gz	RGLNSKGIUJLJPD-ROUUACIJSA-N	0	3	342.483	3.440	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)CCc1cccc(F)c1F	ZINC001032818734	1341625555	/nfs/dbraw/zinc/62/55/55/1341625555.db2.gz	PDPRBEWRYKJCDV-HOTGVXAUSA-N	0	3	334.410	3.149	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)C2(c3ccc(F)cc3)CCC2)C1	ZINC001033315485	1341778566	/nfs/dbraw/zinc/77/85/66/1341778566.db2.gz	KGBGBHCREUPIBF-GOSISDBHSA-N	0	3	330.447	3.356	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N(C)[C@@H]1CCN(Cc2cccc(C)c2)C1	ZINC001033498127	1341847418	/nfs/dbraw/zinc/84/74/18/1341847418.db2.gz	TWCFJKDVSARADP-AABGKKOBSA-N	0	3	342.483	3.009	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)C(C)(C)c2cccc(OC)c2)C1	ZINC001033554194	1341869283	/nfs/dbraw/zinc/86/92/83/1341869283.db2.gz	BINQGXIQMLYCFJ-QGZVFWFLSA-N	0	3	330.472	3.082	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)[C@@H]2[C@@H](c3ccccc3)C2(C)C)C1	ZINC001033832281	1342033150	/nfs/dbraw/zinc/03/31/50/1342033150.db2.gz	IQHPTQFHLYDTMH-AQNXPRMDSA-N	0	3	338.495	3.372	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccc(N(C)C)cc2F)C1	ZINC001033855233	1342046436	/nfs/dbraw/zinc/04/64/36/1342046436.db2.gz	ILDHVZWTSFUEGA-MRXNPFEDSA-N	0	3	333.451	3.004	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2coc3cc(F)ccc23)C1	ZINC001033880648	1342057307	/nfs/dbraw/zinc/05/73/07/1342057307.db2.gz	YGHMNYBEJQPZLZ-HNNXBMFYSA-N	0	3	328.387	3.132	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cn(C)c3ccccc23)C1	ZINC001033891756	1342065157	/nfs/dbraw/zinc/06/51/57/1342065157.db2.gz	GLCDJCABQYUCAS-INIZCTEOSA-N	0	3	325.456	3.291	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@@H]2Cc3cc(Cl)ccc3O2)C1	ZINC001033894732	1342067723	/nfs/dbraw/zinc/06/77/23/1342067723.db2.gz	ZTBHJWQHVGOKHC-AEFFLSMTSA-N	0	3	348.874	3.142	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)[C@@H]2CCc3c2cccc3Cl)C1	ZINC001033902821	1342076285	/nfs/dbraw/zinc/07/62/85/1342076285.db2.gz	SBFMCHYHTHBKEG-MAUKXSAKSA-N	0	3	344.886	3.316	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](N(CC)C(=O)c2nc(Cl)cs2)C1	ZINC001033938132	1342100624	/nfs/dbraw/zinc/10/06/24/1342100624.db2.gz	SXZKFXGZAZZBTR-GFCCVEGCSA-N	0	3	327.881	3.299	20	30		EGEDHN
C=C1CCC(C(=O)N(CC)[C@@H]2CCN(C[C@@H]3CC(C)(C)CO3)C2)CC1	ZINC001033951499	1342109503	/nfs/dbraw/zinc/10/95/03/1342109503.db2.gz	WUXWKBVMMSUBMT-MOPGFXCFSA-N	0	3	348.531	3.471	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2cccn2C2CCCC2)C1	ZINC001034007396	1342144303	/nfs/dbraw/zinc/14/43/03/1342144303.db2.gz	ZXUXKKLZXKZCHU-SFHVURJKSA-N	0	3	327.472	3.163	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2cccn2C2CCCC2)C1	ZINC001034007395	1342144533	/nfs/dbraw/zinc/14/45/33/1342144533.db2.gz	ZXUXKKLZXKZCHU-GOSISDBHSA-N	0	3	327.472	3.163	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cccc(-c3cnco3)c2)C1	ZINC001034008227	1342145918	/nfs/dbraw/zinc/14/59/18/1342145918.db2.gz	UIYFMYPJMNMWFJ-SFHVURJKSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccnc(O[C@@H](C)CC)c2)C1	ZINC001034014173	1342150585	/nfs/dbraw/zinc/15/05/85/1342150585.db2.gz	YSKTVCDIKASUCG-FUHWJXTLSA-N	0	3	345.487	3.371	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2cccc(OCC(C)C)c2)C1	ZINC001034036697	1342176595	/nfs/dbraw/zinc/17/65/95/1342176595.db2.gz	VRQSLFPIJGDAEW-LJQANCHMSA-N	0	3	342.483	3.281	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2cc3ccccc3n2CC)C1	ZINC001034046061	1342186104	/nfs/dbraw/zinc/18/61/04/1342186104.db2.gz	PGDRSJXWXNAUQA-GOSISDBHSA-N	0	3	337.467	3.221	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2coc(C3CCCCC3)n2)C1	ZINC001034052227	1342194230	/nfs/dbraw/zinc/19/42/30/1342194230.db2.gz	GCGUYXCJRFPLFJ-KRWDZBQOSA-N	0	3	343.471	3.282	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@@H]2CCc3cc(OC)ccc32)C1	ZINC001034233420	1342336477	/nfs/dbraw/zinc/33/64/77/1342336477.db2.gz	DICQIIMPSZRSLC-FXAWDEMLSA-N	0	3	342.483	3.272	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cc(Cl)c(Cl)n2C)C1	ZINC001034238903	1342340621	/nfs/dbraw/zinc/34/06/21/1342340621.db2.gz	GVIHOAHQXSCEFZ-LBPRGKRZSA-N	0	3	344.286	3.492	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2oc3c(cccc3F)c2C)C1	ZINC001034245954	1342343887	/nfs/dbraw/zinc/34/38/87/1342343887.db2.gz	AVCWTWYDQASZDG-HNNXBMFYSA-N	0	3	342.414	3.488	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@H]2Cc3cc(Cl)ccc3O2)C1	ZINC001034296377	1342380015	/nfs/dbraw/zinc/38/00/15/1342380015.db2.gz	IXHPFMLVENEEGK-SJLPKXTDSA-N	0	3	348.874	3.190	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cc3cc(F)ccc3[nH]2)C1	ZINC001034335804	1342410313	/nfs/dbraw/zinc/41/03/13/1342410313.db2.gz	HPVBWYKSROZXLM-INIZCTEOSA-N	0	3	329.419	3.467	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)C[C@H]2CCOc3ccccc32)C1	ZINC001034347408	1342417044	/nfs/dbraw/zinc/41/70/44/1342417044.db2.gz	YQEWVXYYNWBULP-SJORKVTESA-N	0	3	328.456	3.100	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ncccc2OCCC)C1	ZINC001034381399	1342449976	/nfs/dbraw/zinc/44/99/76/1342449976.db2.gz	MHRGIBCKYNDCIS-MRXNPFEDSA-N	0	3	331.460	3.031	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCCN(CCc3ccns3)C2)C1	ZINC001034388612	1342457754	/nfs/dbraw/zinc/45/77/54/1342457754.db2.gz	HFTKHGDKBQVJHV-OAHLLOKOSA-N	0	3	333.501	3.013	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2F)C1	ZINC001034432783	1342494984	/nfs/dbraw/zinc/49/49/84/1342494984.db2.gz	KLWJLUHYBZXGEY-BPQIPLTHSA-N	0	3	330.447	3.476	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cnc(C)nc2C(C)C)C1	ZINC001034433607	1342496504	/nfs/dbraw/zinc/49/65/04/1342496504.db2.gz	GLWXCCCZWPDAPF-MRXNPFEDSA-N	0	3	330.476	3.069	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2cc(-c3ccccc3)ccn2)C1	ZINC001034457702	1342515489	/nfs/dbraw/zinc/51/54/89/1342515489.db2.gz	HGWMABBUTBJXHW-FQEVSTJZSA-N	0	3	347.462	3.356	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cccc3[nH]c(C)nc32)C1	ZINC001034476492	1342532658	/nfs/dbraw/zinc/53/26/58/1342532658.db2.gz	HPUHXMBRTBWMSZ-OAHLLOKOSA-N	0	3	326.444	3.032	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cnn(CCCC)c2C)C1	ZINC001034482980	1342540225	/nfs/dbraw/zinc/54/02/25/1342540225.db2.gz	IADUSUWDTWUBOI-KRWDZBQOSA-N	0	3	332.492	3.152	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)[C@@H]2CCCc3sc(C)nc32)C1	ZINC001034493877	1342550271	/nfs/dbraw/zinc/55/02/71/1342550271.db2.gz	VZMRUFRSHBCVQB-LSDHHAIUSA-N	0	3	333.501	3.028	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)c2ccc(N(C)C(C)C)cc2)C1	ZINC001034550903	1342613824	/nfs/dbraw/zinc/61/38/24/1342613824.db2.gz	AQQHGBZAGJZXQL-GOSISDBHSA-N	0	3	329.488	3.302	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)CC2CCCC2)CC1	ZINC001034585447	1342630481	/nfs/dbraw/zinc/63/04/81/1342630481.db2.gz	HNXILAAGXNSDQU-SHTZXODSSA-N	0	3	343.309	3.492	20	30		EGEDHN
C[C@H](C(=O)N[C@H]1CC[C@H](NCc2cc(F)ccc2C#N)CC1)C1CC1	ZINC001034616129	1342649982	/nfs/dbraw/zinc/64/99/82/1342649982.db2.gz	TZAWHWJLSSRBCZ-AGRHKRQWSA-N	0	3	343.446	3.260	20	30		EGEDHN
N#Cc1ccc(F)cc1CN[C@H]1CC[C@H](NC(=O)C2=CCCC2)CC1	ZINC001034625749	1342658060	/nfs/dbraw/zinc/65/80/60/1342658060.db2.gz	KTMZPAYZOAVCOS-WGSAOQKQSA-N	0	3	341.430	3.325	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1CC[C@H](NC(=O)[C@]23C[C@H]2CCC3)CC1	ZINC001034697383	1342697192	/nfs/dbraw/zinc/69/71/92/1342697192.db2.gz	FOIAHKNNPRTICU-ANTGDGSKSA-N	0	3	337.467	3.265	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1CC[C@H](NC(=O)[C@H]2C[C@H]3C[C@H]3C2)CC1	ZINC001034716215	1342711132	/nfs/dbraw/zinc/71/11/32/1342711132.db2.gz	XYTRICZXJNIQLV-AJRUKDSQSA-N	0	3	337.467	3.121	20	30		EGEDHN
CC1(C(=O)N[C@H]2CC[C@H](NCc3ccccc3C#N)CC2)CC=CC1	ZINC001034725597	1342719603	/nfs/dbraw/zinc/71/96/03/1342719603.db2.gz	MZMMWZBJGVTSFR-WGSAOQKQSA-N	0	3	337.467	3.432	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2ccccc2OCC)C12CCC2	ZINC001078798435	1357090599	/nfs/dbraw/zinc/09/05/99/1357090599.db2.gz	QDCIPWJLAZNALV-SJORKVTESA-N	0	3	348.874	3.468	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@@H]2CNCc2cc(C)ns2)CC1	ZINC001035036088	1342889392	/nfs/dbraw/zinc/88/93/92/1342889392.db2.gz	VJKTYDRMTZWPFX-MRXNPFEDSA-N	0	3	333.501	3.279	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@@H]2CNCc2c(C)noc2C)CC1	ZINC001035036227	1342889569	/nfs/dbraw/zinc/88/95/69/1342889569.db2.gz	ZJKVFXFQRJVZNG-QGZVFWFLSA-N	0	3	331.460	3.118	20	30		EGEDHN
C=C[C@@H](C(=O)N1CCC[C@@H]1CNCc1ncccc1C)c1ccccc1	ZINC001035131420	1342947560	/nfs/dbraw/zinc/94/75/60/1342947560.db2.gz	QLXNNVYCZMQGDR-WOJBJXKFSA-N	0	3	349.478	3.440	20	30		EGEDHN
CC(C)C(=O)N1CCC2(CCN(Cc3ccccc3C#N)C2)CC1	ZINC001035158068	1342974679	/nfs/dbraw/zinc/97/46/79/1342974679.db2.gz	FANOQDRNTKONKM-UHFFFAOYSA-N	0	3	325.456	3.029	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)COc1cc(C)ccc1F)CC2	ZINC001035704484	1343143748	/nfs/dbraw/zinc/14/37/48/1343143748.db2.gz	BXWPRZNYSZUMRL-UHFFFAOYSA-N	0	3	346.446	3.013	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccc3nccc(C)c3c1)CC2	ZINC001035713830	1343148568	/nfs/dbraw/zinc/14/85/68/1343148568.db2.gz	IVSDNIRREIMXIQ-UHFFFAOYSA-N	0	3	347.462	3.105	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc(C(F)F)nc1)CC2	ZINC001035722243	1343152931	/nfs/dbraw/zinc/15/29/31/1343152931.db2.gz	HYNQIAOOJRLEKY-UHFFFAOYSA-N	0	3	335.398	3.133	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC2(CN(C[C@H]3CC(C)(C)CO3)C2)CC1	ZINC001035767723	1343179755	/nfs/dbraw/zinc/17/97/55/1343179755.db2.gz	VNVXOIJAYRBTJJ-QGZVFWFLSA-N	0	3	348.531	3.328	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@H]1CC[C@@H](C(F)(F)F)C1)CC2	ZINC001035777279	1343188173	/nfs/dbraw/zinc/18/81/73/1343188173.db2.gz	KUKPVLPDGKMRBA-LSDHHAIUSA-N	0	3	344.421	3.466	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cc1cc(F)ccc1F)CC2	ZINC001035780268	1343190794	/nfs/dbraw/zinc/19/07/94/1343190794.db2.gz	DJWBGOKGVPYXPH-UHFFFAOYSA-N	0	3	334.410	3.008	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cc(C(CC)CC)no1)CC2	ZINC001035813733	1343212406	/nfs/dbraw/zinc/21/24/06/1343212406.db2.gz	JAIBXGRQHCPIDL-UHFFFAOYSA-N	0	3	343.471	3.140	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C[C@H]1CCO[C@H](C(C)C)C1)CC2	ZINC001035832290	1343219798	/nfs/dbraw/zinc/21/97/98/1343219798.db2.gz	FXSNCOIQIUUPDB-OALUTQOASA-N	0	3	348.531	3.328	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@@H](C)c1ccc(C)s1)CC2	ZINC001035838527	1343221128	/nfs/dbraw/zinc/22/11/28/1343221128.db2.gz	CKQBTICDMDLFTO-INIZCTEOSA-N	0	3	330.497	3.108	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc3ccccc3n1)CC2	ZINC001035841153	1343223707	/nfs/dbraw/zinc/22/37/07/1343223707.db2.gz	ZYHYHZUFMCLMAN-UHFFFAOYSA-N	0	3	335.451	3.349	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@@]1(C)CCC(C)=C(C)C1)CC2	ZINC001035861423	1343236822	/nfs/dbraw/zinc/23/68/22/1343236822.db2.gz	HPCXIGYHRKWFCS-FQEVSTJZSA-N	0	3	328.500	3.461	20	30		EGEDHN
C[C@@H]1CN(C(=O)C#CC2CC2)CC[C@H]1NCc1c(F)cccc1Cl	ZINC001036020239	1343308405	/nfs/dbraw/zinc/30/84/05/1343308405.db2.gz	CBJPMZJRCKAMGY-FZKQIMNGSA-N	0	3	348.849	3.219	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2(C)CCC2)CC[C@@H]1NCc1cc(F)ccc1C#N	ZINC001036139849	1343324211	/nfs/dbraw/zinc/32/42/11/1343324211.db2.gz	AWYMIEISUGIKNV-KDOFPFPSSA-N	0	3	343.446	3.214	20	30		EGEDHN
Cc1coc(C(=O)N2CC[C@H](NCc3ccccc3C#N)[C@H](C)C2)c1	ZINC001036148235	1343329773	/nfs/dbraw/zinc/32/97/73/1343329773.db2.gz	ZQHPVYZTTSCMBP-QAPCUYQASA-N	0	3	337.423	3.100	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](NCc3nc(C)cs3)[C@H](C)C2)C1	ZINC001036170216	1343343329	/nfs/dbraw/zinc/34/33/29/1343343329.db2.gz	QVNHUEKNVYXEGQ-UKRRQHHQSA-N	0	3	333.501	3.134	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]([C@H](C)NCc2cc(C)n(C)n2)C1	ZINC001036436160	1343486272	/nfs/dbraw/zinc/48/62/72/1343486272.db2.gz	BUDUPVKSTZQEOB-DLBZAZTESA-N	0	3	346.519	3.048	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCCN(C(=O)CC(C)(F)F)C1	ZINC001036437874	1343487318	/nfs/dbraw/zinc/48/73/18/1343487318.db2.gz	JJVJVQYVECNVON-WMLDXEAASA-N	0	3	349.425	3.320	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCCN(C(=O)CC(C)(F)F)C1	ZINC001036437875	1343487347	/nfs/dbraw/zinc/48/73/47/1343487347.db2.gz	JJVJVQYVECNVON-YOEHRIQHSA-N	0	3	349.425	3.320	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]([C@@H](C)NCc3cscn3)C2)C1	ZINC001036441766	1343489990	/nfs/dbraw/zinc/48/99/90/1343489990.db2.gz	CWORPFMKSDFZOT-HUUCEWRRSA-N	0	3	333.501	3.216	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]([C@@H](C)NCc3cc(C)no3)C2)C1	ZINC001036445165	1343491862	/nfs/dbraw/zinc/49/18/62/1343491862.db2.gz	MGUBOGBZNLHMQJ-HZPDHXFCSA-N	0	3	331.460	3.056	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCCN(C(=O)C2(CF)CC2)C1	ZINC001036450353	1343494624	/nfs/dbraw/zinc/49/46/24/1343494624.db2.gz	KSDDSUHRDLBISZ-YJBOKZPZSA-N	0	3	343.446	3.025	20	30		EGEDHN
C[C@H]1CCCN(C(=O)c2ccco2)[C@@H]1CNCc1ccc(C#N)s1	ZINC001036490276	1343513281	/nfs/dbraw/zinc/51/32/81/1343513281.db2.gz	FKBVQACSEYDUGD-XJKSGUPXSA-N	0	3	343.452	3.243	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)/C=C\C2CC2)[C@@H]1CNCc1ccc(C#N)s1	ZINC001036528052	1343536326	/nfs/dbraw/zinc/53/63/26/1343536326.db2.gz	NDTPVONOCBBLRL-MODSLVQBSA-N	0	3	343.496	3.303	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC[C@@H](C)[C@@H]2CNCc2ccccn2)cc1	ZINC001036567805	1343557475	/nfs/dbraw/zinc/55/74/75/1343557475.db2.gz	MZFWIWGITQXRGE-UTKZUKDTSA-N	0	3	347.462	3.093	20	30		EGEDHN
CCC(=O)N1CC[C@@H]2[C@H](CCN2CC#Cc2ccc(Cl)cc2)C1	ZINC001036609025	1343572984	/nfs/dbraw/zinc/57/29/84/1343572984.db2.gz	UGAOQPLHLQHFRG-SJLPKXTDSA-N	0	3	330.859	3.024	20	30		EGEDHN
CC(C)(C)CC(=O)N1CC[C@H]2[C@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001036640335	1343594794	/nfs/dbraw/zinc/59/47/94/1343594794.db2.gz	IPLKBTVJBRJTQD-PBHICJAKSA-N	0	3	345.512	3.479	20	30		EGEDHN
CC1(CC(=O)N2CC[C@H]3[C@@H](CCN3Cc3ccc(C#N)s3)C2)CC1	ZINC001036777050	1343706665	/nfs/dbraw/zinc/70/66/65/1343706665.db2.gz	UQIHZNIIJJNLES-YOEHRIQHSA-N	0	3	343.496	3.233	20	30		EGEDHN
Cc1cocc1C(=O)N1CC[C@@H]2[C@@H](CCN2CC#Cc2ccccc2)C1	ZINC001036787425	1343717717	/nfs/dbraw/zinc/71/77/17/1343717717.db2.gz	LAVSHQNCLSROHZ-PZJWPPBQSA-N	0	3	348.446	3.176	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2[C@@H](CCN2CC#Cc2ccccc2)C1	ZINC001036792009	1343722511	/nfs/dbraw/zinc/72/25/11/1343722511.db2.gz	IVEDLTUHRODLNT-VQTJNVASSA-N	0	3	336.479	3.173	20	30		EGEDHN
CC1(C(=O)N2CC[C@@H]3[C@H](CCN3Cc3ccccc3C#N)C2)CCC1	ZINC001036791974	1343722677	/nfs/dbraw/zinc/72/26/77/1343722677.db2.gz	IGEYAAKXIHIMFQ-RTBURBONSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]2[C@H](CCN2Cc2cnc(C)s2)C1	ZINC001036792464	1343723780	/nfs/dbraw/zinc/72/37/80/1343723780.db2.gz	PPKINKCEWWTPIX-NVXWUHKLSA-N	0	3	347.528	3.477	20	30		EGEDHN
CCC1(C(=O)N2CC[C@@H]3[C@@H](CCN3CC#Cc3ccccc3)C2)CC1	ZINC001036812341	1343748315	/nfs/dbraw/zinc/74/83/15/1343748315.db2.gz	GAGDKZSHMPZSMQ-VQTJNVASSA-N	0	3	336.479	3.151	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCC[C@H]1NC(=O)c1ccccc1	ZINC001036931225	1343874959	/nfs/dbraw/zinc/87/49/59/1343874959.db2.gz	QYPSEEXLNBEYAK-VQTJNVASSA-N	0	3	333.435	3.247	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCC[C@@H]2CNCc2nccn2CC)CC1	ZINC001037070503	1343963993	/nfs/dbraw/zinc/96/39/93/1343963993.db2.gz	SEHUFUOTFJJYNJ-MSOLQXFVSA-N	0	3	344.503	3.024	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCC[C@H]1NC(=O)C1CC=CC1	ZINC001037180330	1344023230	/nfs/dbraw/zinc/02/32/30/1344023230.db2.gz	FZHIPDWDLKTBPF-VQTJNVASSA-N	0	3	337.467	3.289	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCC[C@H]1NC(=O)C1=CCCC1	ZINC001037199152	1344036660	/nfs/dbraw/zinc/03/66/60/1344036660.db2.gz	WNKQOVMSVKDOKX-WOJBJXKFSA-N	0	3	337.467	3.433	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCC[C@@H]2CNCc2nccs2)C1	ZINC001037237117	1344060093	/nfs/dbraw/zinc/06/00/93/1344060093.db2.gz	UGQKXZFJNVIGJI-HUUCEWRRSA-N	0	3	333.501	3.264	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCC[C@@H]2CNCc2ccn(CC)n2)C1	ZINC001037243274	1344064631	/nfs/dbraw/zinc/06/46/31/1344064631.db2.gz	VHUOWNMCTHQWPG-SJLPKXTDSA-N	0	3	344.503	3.024	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCC[C@H]2CNCc2ccn(CC)n2)C1	ZINC001037243272	1344064692	/nfs/dbraw/zinc/06/46/92/1344064692.db2.gz	VHUOWNMCTHQWPG-FUHWJXTLSA-N	0	3	344.503	3.024	20	30		EGEDHN
CC[C@@H]1CN(C(=O)C#CC2CC2)CC[C@H]1NCc1c(F)cccc1F	ZINC001037839869	1344130419	/nfs/dbraw/zinc/13/04/19/1344130419.db2.gz	OMPXRJAYULBIEB-DNVCBOLYSA-N	0	3	346.421	3.095	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](NCc2nccs2)[C@@H](CC)C1	ZINC001037906066	1344170656	/nfs/dbraw/zinc/17/06/56/1344170656.db2.gz	QDSSUNOBEIIHDX-GJZGRUSLSA-N	0	3	335.517	3.462	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1cnc2c(F)cccc2c1	ZINC001038523279	1344465790	/nfs/dbraw/zinc/46/57/90/1344465790.db2.gz	NVCPGIZURCFRLU-MRXNPFEDSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1ccc(F)c2ccncc12	ZINC001038617589	1344506206	/nfs/dbraw/zinc/50/62/06/1344506206.db2.gz	WBDOYUGEXAIXMA-AWEZNQCLSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NC[C@H]1CCN1CCCC1CCCC1	ZINC001038809038	1344591757	/nfs/dbraw/zinc/59/17/57/1344591757.db2.gz	WGXFIWNFUPCXPA-QYZOEREBSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)[C@@H](C)SC)CC2)C1	ZINC001039109907	1344781496	/nfs/dbraw/zinc/78/14/96/1344781496.db2.gz	OWZBGWQCFQZYMY-UKRRQHHQSA-N	0	3	330.925	3.051	20	30		EGEDHN
C=C(C)C[N@@H+]1CC[C@H](C2CCN(C(=O)c3ccccc3[O-])CC2)C1	ZINC001039109313	1344781020	/nfs/dbraw/zinc/78/10/20/1344781020.db2.gz	KDANGLSUOODIHA-KRWDZBQOSA-N	0	3	328.456	3.142	20	30		EGEDHN
C=C(C)C[N@H+]1CC[C@H](C2CCN(C(=O)c3ccccc3[O-])CC2)C1	ZINC001039109313	1344781022	/nfs/dbraw/zinc/78/10/22/1344781022.db2.gz	KDANGLSUOODIHA-KRWDZBQOSA-N	0	3	328.456	3.142	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)c3c(C)ccn3C)CC2)C1	ZINC001039128606	1344806212	/nfs/dbraw/zinc/80/62/12/1344806212.db2.gz	ZIXMINAQALLEPU-QGZVFWFLSA-N	0	3	349.906	3.260	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc(C)c(F)cc2F)C1	ZINC001039210526	1344924109	/nfs/dbraw/zinc/92/41/09/1344924109.db2.gz	BGYJSFJLUILAAC-KXBFYZLASA-N	0	3	346.421	3.223	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)CCc2ccsc2)C1	ZINC001039213810	1344929067	/nfs/dbraw/zinc/92/90/67/1344929067.db2.gz	LZQJLWXFTYBXCH-ROUUACIJSA-N	0	3	330.497	3.017	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)Cc2cccc(Cl)c2)C1	ZINC001039229821	1344949316	/nfs/dbraw/zinc/94/93/16/1344949316.db2.gz	MUVCXQQQPDQVJK-IEBWSBKVSA-N	0	3	344.886	3.219	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc[nH]c2C2CCC2)C1	ZINC001039233576	1344953357	/nfs/dbraw/zinc/95/33/57/1344953357.db2.gz	LUGWBLKDMQRFMZ-IEBWSBKVSA-N	0	3	339.483	3.232	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc(C)ccc2F)C1	ZINC001039238798	1344962878	/nfs/dbraw/zinc/96/28/78/1344962878.db2.gz	PJYYKFPWACRPOC-VQIMIIECSA-N	0	3	328.431	3.084	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccncc2Cl)C1	ZINC001039240806	1344965794	/nfs/dbraw/zinc/96/57/94/1344965794.db2.gz	YYVQSACMLVDIKG-CRAIPNDOSA-N	0	3	345.874	3.075	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(C)nc2C)C1	ZINC001039242658	1344968776	/nfs/dbraw/zinc/96/87/76/1344968776.db2.gz	QIUJFABVVUFKRI-ICSRJNTNSA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccccc2Cl)C1	ZINC001039246997	1344976509	/nfs/dbraw/zinc/97/65/09/1344976509.db2.gz	SOAVLCQVGMOKBY-CRAIPNDOSA-N	0	3	330.859	3.290	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2coc3ccccc23)C1	ZINC001039253565	1344985145	/nfs/dbraw/zinc/98/51/45/1344985145.db2.gz	JYHXLHZGBLTNNI-VQIMIIECSA-N	0	3	336.435	3.383	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccc(F)cc2C)C1	ZINC001039256233	1344986033	/nfs/dbraw/zinc/98/60/33/1344986033.db2.gz	ISRIBBPWLNTUFU-FXAWDEMLSA-N	0	3	342.458	3.474	20	30		EGEDHN
Cc1ccccc1CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(C#N)c[nH]1	ZINC001039362459	1345028857	/nfs/dbraw/zinc/02/88/57/1345028857.db2.gz	NPHBAECGDFEEOM-MOPGFXCFSA-N	0	3	348.450	3.074	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(C(C)(C)C)cn1	ZINC001039375881	1345033630	/nfs/dbraw/zinc/03/36/30/1345033630.db2.gz	AZSLMRZOYRPJHB-MSOLQXFVSA-N	0	3	339.483	3.081	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C1C2CC3CC(C2)CC1C3	ZINC001039387044	1345039597	/nfs/dbraw/zinc/03/95/97/1345039597.db2.gz	PBTWQPIACDWYPN-FMRHEXRGSA-N	0	3	340.511	3.147	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C1(C(F)(F)F)CCC1	ZINC001039393653	1345042593	/nfs/dbraw/zinc/04/25/93/1345042593.db2.gz	FADJXXPGWHKMIQ-KGLIPLIRSA-N	0	3	330.394	3.360	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H](C)c1c(C)noc1C	ZINC001039395805	1345044507	/nfs/dbraw/zinc/04/45/07/1345044507.db2.gz	KWDSSTUZDJPYAZ-OLMNPRSZSA-N	0	3	345.487	3.426	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccc(-n2cccc2)c1	ZINC001039401803	1345047527	/nfs/dbraw/zinc/04/75/27/1345047527.db2.gz	SYXKCGRHJKGMNR-CTNGQTDRSA-N	0	3	347.462	3.180	20	30		EGEDHN
C=CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cnc(CC2CC2)s1	ZINC001039408737	1345052549	/nfs/dbraw/zinc/05/25/49/1345052549.db2.gz	BQQKULFMMGPXQK-CVEARBPZSA-N	0	3	345.512	3.351	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CCc2ccccc2C1	ZINC001039443027	1345069076	/nfs/dbraw/zinc/06/90/76/1345069076.db2.gz	FWFFFQWBXHKAPN-NJYVYQBISA-N	0	3	338.495	3.433	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(Cl)c(F)c1	ZINC001039442699	1345069092	/nfs/dbraw/zinc/06/90/92/1345069092.db2.gz	OROUEYLUFXBYPO-CABCVRRESA-N	0	3	334.822	3.181	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](CC)Cc1ccccc1	ZINC001039445886	1345070808	/nfs/dbraw/zinc/07/08/08/1345070808.db2.gz	KWRMZPQSSHJXOQ-HBMCJLEFSA-N	0	3	338.495	3.344	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](CC)c1c(C)noc1C	ZINC001039452436	1345075109	/nfs/dbraw/zinc/07/51/09/1345075109.db2.gz	WIGWVBXZHAFZLW-SQNIBIBYSA-N	0	3	345.487	3.426	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(-c2ccccc2)[nH]1	ZINC001039476880	1345091605	/nfs/dbraw/zinc/09/16/05/1345091605.db2.gz	UTZJAJNCIVHEDM-MOPGFXCFSA-N	0	3	347.462	3.384	20	30		EGEDHN
C#Cc1cncc(C(=O)N2C[C@H]3CCC[C@@H](C2)N3CC(CC)CC)c1	ZINC001039905700	1345242815	/nfs/dbraw/zinc/24/28/15/1345242815.db2.gz	REKJPZIEHXRWJP-BGYRXZFFSA-N	0	3	339.483	3.178	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@]3(CCN(C(=O)c4ccc[nH]4)C3)C2)c1	ZINC001040071571	1345322063	/nfs/dbraw/zinc/32/20/63/1345322063.db2.gz	XWGOTYZZXVTQNN-OAQYLSRUSA-N	0	3	348.450	3.015	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@]3(CCN(C(=O)C4CC=CC4)C3)C2)cc1	ZINC001040130338	1345344686	/nfs/dbraw/zinc/34/46/86/1345344686.db2.gz	PQCLIYANZUZBST-JOCHJYFZSA-N	0	3	349.478	3.339	20	30		EGEDHN
C/C=C(/C)C(=O)N1CC[C@@]2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001040149035	1345354265	/nfs/dbraw/zinc/35/42/65/1345354265.db2.gz	FJWPCVOEKRGWID-PQTHCYMGSA-N	0	3	337.467	3.339	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)Cc3cccc(CC)c3)C2)C1	ZINC001040268588	1345404708	/nfs/dbraw/zinc/40/47/08/1345404708.db2.gz	YZWWDZWFBQJETP-JOCHJYFZSA-N	0	3	338.495	3.129	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cc4ncccc4s3)C2)C1	ZINC001040324176	1345432426	/nfs/dbraw/zinc/43/24/26/1345432426.db2.gz	UFIBZKFJAMKAQG-IBGZPJMESA-N	0	3	341.480	3.410	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N1CC[C@@]2(C1)CCCN(Cc1cccc(C#N)c1)C2	ZINC001040335506	1345438718	/nfs/dbraw/zinc/43/87/18/1345438718.db2.gz	CTXLAFVGILUADC-LRQRDZAKSA-N	0	3	337.467	3.029	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@H](C)c3cccs3)C2)C1	ZINC001040390193	1345471669	/nfs/dbraw/zinc/47/16/69/1345471669.db2.gz	HMBGPQFMWCYYQW-VQIMIIECSA-N	0	3	330.497	3.189	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3ccc(C(C)C)cn3)C2)C1	ZINC001040394139	1345474265	/nfs/dbraw/zinc/47/42/65/1345474265.db2.gz	IHUMDBQBBHVSOZ-HXUWFJFHSA-N	0	3	327.472	3.319	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ccc4cc[nH]c4c3)C2)C1	ZINC001040424362	1345490353	/nfs/dbraw/zinc/49/03/53/1345490353.db2.gz	ZIPCKUIDEYYPIV-OAQYLSRUSA-N	0	3	335.451	3.119	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@]3(C)CC[C@H](C)C3(C)C)C2)C1	ZINC001040433158	1345496636	/nfs/dbraw/zinc/49/66/36/1345496636.db2.gz	TVWCNIIURKXROL-YYWHXJBOSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cc4sccc4[nH]3)C2)C1	ZINC001040477846	1345513280	/nfs/dbraw/zinc/51/32/80/1345513280.db2.gz	AFCPHHKABPORLJ-IBGZPJMESA-N	0	3	341.480	3.181	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)CCc3cc(C)cc(C)c3)C2)C1	ZINC001040485151	1345516232	/nfs/dbraw/zinc/51/62/32/1345516232.db2.gz	WXJCEKWDLYZZEM-QFIPXVFZSA-N	0	3	338.495	3.184	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@H](C)c3ccc(C)s3)C2)C1	ZINC001040491163	1345517516	/nfs/dbraw/zinc/51/75/16/1345517516.db2.gz	FSQDDPAJVQDFBH-XLIONFOSSA-N	0	3	344.524	3.498	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@@H](F)CC3CCCCC3)C2)C1	ZINC001040494239	1345519523	/nfs/dbraw/zinc/51/95/23/1345519523.db2.gz	UZCFDPVIDKLVBX-AZUAARDMSA-N	0	3	334.479	3.243	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cc(C)n(C(C)(C)C)n3)C2)C1	ZINC001040533766	1345535561	/nfs/dbraw/zinc/53/55/61/1345535561.db2.gz	FRPDUNBFSUZBTC-HXUWFJFHSA-N	0	3	344.503	3.061	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)C[C@@H](C)c3ccc(F)cc3)C2)C1	ZINC001040538585	1345536892	/nfs/dbraw/zinc/53/68/92/1345536892.db2.gz	KDXVVQWTKKYUNQ-UTKZUKDTSA-N	0	3	342.458	3.267	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@H](C)c3ccccc3C)C2)C1	ZINC001040539638	1345537034	/nfs/dbraw/zinc/53/70/34/1345537034.db2.gz	PXVWZAPMEMFADT-DENIHFKCSA-N	0	3	338.495	3.436	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3c(C)[nH]c4ccccc43)C2)CC1	ZINC001040765684	1345576640	/nfs/dbraw/zinc/57/66/40/1345576640.db2.gz	OVXRLFUNUTXTID-UHFFFAOYSA-N	0	3	335.451	3.038	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cc(Cl)ccc3F)C2)CC1	ZINC001040766001	1345576838	/nfs/dbraw/zinc/57/68/38/1345576838.db2.gz	XQIJHGMUBMMNMM-UHFFFAOYSA-N	0	3	334.822	3.040	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccc(C)cc3F)C2)CC1	ZINC001040865570	1345590304	/nfs/dbraw/zinc/59/03/04/1345590304.db2.gz	WHIYGPKVSIKLMY-UHFFFAOYSA-N	0	3	328.431	3.086	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cc4[nH]ccc4s3)C2)CC1	ZINC001040926965	1345602770	/nfs/dbraw/zinc/60/27/70/1345602770.db2.gz	PRGVLHGPKHLALV-UHFFFAOYSA-N	0	3	341.480	3.181	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@@H](C)c3cccc(F)c3)C2)CC1	ZINC001040945997	1345606107	/nfs/dbraw/zinc/60/61/07/1345606107.db2.gz	UWYMBPJHVUKZIM-KRWDZBQOSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)C[C@H](C)c3ccc(F)cc3)C2)CC1	ZINC001040946948	1345606715	/nfs/dbraw/zinc/60/67/15/1345606715.db2.gz	KPHDJLCFKFSAIS-KRWDZBQOSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)CC(C)(C)c3ccccc3)C2)CC1	ZINC001040947494	1345606723	/nfs/dbraw/zinc/60/67/23/1345606723.db2.gz	ZQFMVVAULASVRH-UHFFFAOYSA-N	0	3	338.495	3.302	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)C3CC(C(C)(C)C)C3)C2)CC1	ZINC001040951375	1345608085	/nfs/dbraw/zinc/60/80/85/1345608085.db2.gz	HPGILRACAYWMPC-UHFFFAOYSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)C34CC(C(C)(C)C)(C3)C4)C2)CC1	ZINC001040951949	1345608089	/nfs/dbraw/zinc/60/80/89/1345608089.db2.gz	LPDVZQDENZVHBE-UHFFFAOYSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@H]3C[C@H](C)C[C@H](C)C3)C2)CC1	ZINC001040954445	1345610291	/nfs/dbraw/zinc/61/02/91/1345610291.db2.gz	ZUDJMIJMGJXCRB-BWTSREIZSA-N	0	3	330.516	3.397	20	30		EGEDHN
Cc1ccoc1C(=O)N1CC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001041070563	1345643362	/nfs/dbraw/zinc/64/33/62/1345643362.db2.gz	XVBYWKFKHHFRDO-OAQYLSRUSA-N	0	3	349.434	3.198	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@]3(CCN(C(=O)C4=CCCC4)C3)C2)cc1	ZINC001041202288	1345677325	/nfs/dbraw/zinc/67/73/25/1345677325.db2.gz	ZJVNSIPMEBZVRW-OAQYLSRUSA-N	0	3	335.451	3.093	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@]2(CCN(Cc3oc(C)nc3C)C2)C1	ZINC001041535236	1345754733	/nfs/dbraw/zinc/75/47/33/1345754733.db2.gz	DWHDRTHKWFLODS-FQEVSTJZSA-N	0	3	345.487	3.318	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@]2(CCN(Cc3cnccc3C)C2)C1	ZINC001041545398	1345759499	/nfs/dbraw/zinc/75/94/99/1345759499.db2.gz	VNAYWMAZFAFOFL-HXUWFJFHSA-N	0	3	327.472	3.027	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)C(C)(C)c3cccc(F)c3)C2)C1	ZINC001041667027	1345816641	/nfs/dbraw/zinc/81/66/41/1345816641.db2.gz	CBADKAZMEVRFDI-OAQYLSRUSA-N	0	3	342.458	3.051	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)[C@@H](c3ccccc3)C(C)C)C2)C1	ZINC001041711789	1345826755	/nfs/dbraw/zinc/82/67/55/1345826755.db2.gz	ILCWIQXBSZITJD-IRLDBZIGSA-N	0	3	338.495	3.374	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)[C@@H](CC3CCCC3)C(C)C)C2)C1	ZINC001041720335	1345830190	/nfs/dbraw/zinc/83/01/90/1345830190.db2.gz	NJOIRKHGMYCBHY-FPOVZHCZSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3[nH]c4ccc(C)cc4c3C)C2)C1	ZINC001041766223	1345842782	/nfs/dbraw/zinc/84/27/82/1345842782.db2.gz	BWWSUAFGQHFUOM-QFIPXVFZSA-N	0	3	349.478	3.346	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cc(C(C)C)oc3C)C2)C1	ZINC001041770148	1345843641	/nfs/dbraw/zinc/84/36/41/1345843641.db2.gz	YMCAYQXBZQAVPU-FQEVSTJZSA-N	0	3	328.456	3.273	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3ccc(Cl)c(Cl)c3)C2)C1	ZINC001041800937	1345855326	/nfs/dbraw/zinc/85/53/26/1345855326.db2.gz	BTOFFLWSOZYTJV-QGZVFWFLSA-N	0	3	337.250	3.165	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3csc4c3CCCC4)C2)C1	ZINC001041818236	1345862244	/nfs/dbraw/zinc/86/22/44/1345862244.db2.gz	PLVJLDXNCNQRHY-FQEVSTJZSA-N	0	3	342.508	3.188	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3oc4ccccc4c3CC)C2)C1	ZINC001041851543	1345873142	/nfs/dbraw/zinc/87/31/42/1345873142.db2.gz	HOEMGENEMMAOAB-NRFANRHFSA-N	0	3	336.435	3.166	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CCN(C(=O)C4CCCC4)C[C@H]32)c1	ZINC001041885671	1345882603	/nfs/dbraw/zinc/88/26/03/1345882603.db2.gz	PLMJYHXFELAEIK-UYAOXDASSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc4nccc(C)c4c3)C[C@@H]21	ZINC001042077851	1345939177	/nfs/dbraw/zinc/93/91/77/1345939177.db2.gz	QKZBNECFPUIALU-JXFKEZNVSA-N	0	3	335.451	3.266	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cccc(OCCC)c3)C[C@H]21	ZINC001042080865	1345939608	/nfs/dbraw/zinc/93/96/08/1345939608.db2.gz	PEEGCDODNKSDRV-YLJYHZDGSA-N	0	3	340.467	3.035	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3nc(C(C)(C)C)cs3)C[C@H]21	ZINC001042103005	1345944910	/nfs/dbraw/zinc/94/49/10/1345944910.db2.gz	QTFUXSFQTJGEFG-LSDHHAIUSA-N	0	3	345.512	3.000	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(C)nn3C(CC)CC)C[C@H]21	ZINC001042120824	1345949875	/nfs/dbraw/zinc/94/98/75/1345949875.db2.gz	BEXSKHOVTCFWEJ-VQIMIIECSA-N	0	3	344.503	3.275	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3coc4cc(F)ccc34)C[C@@H]21	ZINC001042124251	1345950183	/nfs/dbraw/zinc/95/01/83/1345950183.db2.gz	DKLBLKBJETVHCT-DYVFJYSZSA-N	0	3	328.387	3.294	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(-n4cccc4)cc3)C[C@H]21	ZINC001042142008	1345954994	/nfs/dbraw/zinc/95/49/94/1345954994.db2.gz	JPEULEBSFHDFIE-YLJYHZDGSA-N	0	3	335.451	3.200	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]2CCN(CCc3ccns3)[C@@H]2C1	ZINC001042185573	1345972433	/nfs/dbraw/zinc/97/24/33/1345972433.db2.gz	VFDTTWVOAVAXEM-DOTOQJQBSA-N	0	3	347.528	3.211	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3ccc(C)nc3C)[C@@H]2C1	ZINC001042188172	1345974865	/nfs/dbraw/zinc/97/48/65/1345974865.db2.gz	QCYJZLDTJBFMQA-PKOBYXMFSA-N	0	3	341.499	3.333	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3scnc3C)[C@@H]2C1	ZINC001042187891	1345974903	/nfs/dbraw/zinc/97/49/03/1345974903.db2.gz	OVSDZOORVVDRHP-HUUCEWRRSA-N	0	3	333.501	3.087	20	30		EGEDHN
CC(F)(F)CC(=O)N1CC[C@@H]2CCN(Cc3cccc(C#N)c3)[C@H]2C1	ZINC001042221857	1345993334	/nfs/dbraw/zinc/99/33/34/1345993334.db2.gz	NMNQUTWNMPBTMN-IRXDYDNUSA-N	0	3	347.409	3.026	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3scnc3C3CC3)C[C@H]21	ZINC001042261892	1346009559	/nfs/dbraw/zinc/00/95/59/1346009559.db2.gz	AYHDKHYSOSXMJG-UKRRQHHQSA-N	0	3	331.485	3.133	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(OC)cc3Cl)C[C@@H]21	ZINC001042272079	1346014467	/nfs/dbraw/zinc/01/44/67/1346014467.db2.gz	LAIFVJNJEUBZIU-DYVFJYSZSA-N	0	3	334.847	3.071	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(-c4ccccc4)nc3)C[C@H]21	ZINC001042282508	1346016751	/nfs/dbraw/zinc/01/67/51/1346016751.db2.gz	DYYICXCRXMAYML-WIYYLYMNSA-N	0	3	347.462	3.471	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cnn(C4CCCCC4)c3)C[C@H]21	ZINC001042305072	1346025539	/nfs/dbraw/zinc/02/55/39/1346025539.db2.gz	WOXHFOXWINJVEX-QFBILLFUSA-N	0	3	342.487	3.111	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3ncoc3C(C)(C)C)C[C@H]21	ZINC001042307166	1346025912	/nfs/dbraw/zinc/02/59/12/1346025912.db2.gz	MKUGTSXLFLIVGE-HUUCEWRRSA-N	0	3	331.460	3.085	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3cccc(C#N)c3)[C@@H]2C1	ZINC001042324927	1346033760	/nfs/dbraw/zinc/03/37/60/1346033760.db2.gz	XSPFKQXIYBVLIV-QZTJIDSGSA-N	0	3	325.456	3.027	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)[C@@]3(c4ccccc4)C[C@H](F)C3)C[C@@H]21	ZINC001042326961	1346035581	/nfs/dbraw/zinc/03/55/81/1346035581.db2.gz	STPWQNNVTFZCRV-WBKMXMRLSA-N	0	3	342.458	3.165	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(N(CC)CC)cc3)C[C@H]21	ZINC001042327492	1346036752	/nfs/dbraw/zinc/03/67/52/1346036752.db2.gz	XSFMOMZVYVXNPX-YLJYHZDGSA-N	0	3	341.499	3.255	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(F)c(F)cc3Cl)C[C@@H]21	ZINC001042338940	1346043343	/nfs/dbraw/zinc/04/33/43/1346043343.db2.gz	OEJGEGWEWSTEHA-ZBEGNZNMSA-N	0	3	340.801	3.341	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)Cc3ccc4ccccc4c3)C[C@H]21	ZINC001042349299	1346050520	/nfs/dbraw/zinc/05/05/20/1346050520.db2.gz	PMAFGMYTFFMICD-RBBKRZOGSA-N	0	3	346.474	3.328	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cc4ccccc4n3CC)C[C@@H]21	ZINC001042367234	1346058743	/nfs/dbraw/zinc/05/87/43/1346058743.db2.gz	CURCQRMDNUUMSM-UWJYYQICSA-N	0	3	349.478	3.221	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)CC(C)(C)c3ccccc3)C[C@H]21	ZINC001042367844	1346059212	/nfs/dbraw/zinc/05/92/12/1346059212.db2.gz	MCNPHNIEUOCOFG-UYAOXDASSA-N	0	3	338.495	3.300	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C34CC(c5ccccc5)(C3)C4)C[C@@H]21	ZINC001042376049	1346063241	/nfs/dbraw/zinc/06/32/41/1346063241.db2.gz	NSKFPGUNJGJDLU-MCNZBGGYSA-N	0	3	336.479	3.217	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C(C)(C)c3ccccc3OC)C[C@H]21	ZINC001042385726	1346066788	/nfs/dbraw/zinc/06/67/88/1346066788.db2.gz	VPWPQWICNWDCTP-FUHWJXTLSA-N	0	3	342.483	3.082	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@@H](NCc3ccccc3C#N)C[C@@H]2C)o1	ZINC001044446393	1346335273	/nfs/dbraw/zinc/33/52/73/1346335273.db2.gz	KCGXVYQUEJHKHH-KBXCAEBGSA-N	0	3	337.423	3.243	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)C1CC(C)(C)C1	ZINC001044581048	1346374267	/nfs/dbraw/zinc/37/42/67/1346374267.db2.gz	HYRFIOUEHGJGPE-BEFAXECRSA-N	0	3	339.483	3.464	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3nccn3CC)C[C@@H]2C)CC1	ZINC001044729888	1346414596	/nfs/dbraw/zinc/41/45/96/1346414596.db2.gz	LFMCDUMTTCFPFA-WMZOPIPTSA-N	0	3	344.503	3.119	20	30		EGEDHN
Cc1ccc(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)s2)s1	ZINC001044902039	1346457806	/nfs/dbraw/zinc/45/78/06/1346457806.db2.gz	CJCOOLXHZVUIHT-ZDUSSCGKSA-N	0	3	345.493	3.384	20	30		EGEDHN
C[C@]1(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)c(F)c2)C=CCC1	ZINC001045155944	1346509279	/nfs/dbraw/zinc/50/92/79/1346509279.db2.gz	MDCNSENMPYYWIZ-PXNSSMCTSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]2CNCc2ccc(C#N)cc2F)C1	ZINC001045190397	1346524451	/nfs/dbraw/zinc/52/44/51/1346524451.db2.gz	ASHYZXLTFFEQPV-KRWDZBQOSA-N	0	3	341.430	3.134	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H]1CNCc1ccc(C#N)s1)c1ccco1	ZINC001045198250	1346528430	/nfs/dbraw/zinc/52/84/30/1346528430.db2.gz	KJVFGUUXUXVUTQ-KGLIPLIRSA-N	0	3	343.452	3.097	20	30		EGEDHN
CC1(NC(=O)C2CCCC2)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045343910	1346566691	/nfs/dbraw/zinc/56/66/91/1346566691.db2.gz	HOUNTHYGTNKPRJ-UHFFFAOYSA-N	0	3	325.456	3.219	20	30		EGEDHN
Cc1occc1C(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045359619	1346573308	/nfs/dbraw/zinc/57/33/08/1346573308.db2.gz	TTWVZGWQLDHTLR-UHFFFAOYSA-N	0	3	337.423	3.244	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)[C@@H]2CC[C@H]2c2ccc(F)cc2)CC1	ZINC001045511855	1346613795	/nfs/dbraw/zinc/61/37/95/1346613795.db2.gz	XLZKCJXMMXVNHJ-RBUKOAKNSA-N	0	3	342.458	3.313	20	30		EGEDHN
C#Cc1ccc(C(=O)NC2(C)CCN(CCC(F)(F)F)CC2)cc1	ZINC001045520883	1346616005	/nfs/dbraw/zinc/61/60/05/1346616005.db2.gz	ZVTQLODOCRWEAA-UHFFFAOYSA-N	0	3	338.373	3.205	20	30		EGEDHN
Cc1cocc1C(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045523458	1346616375	/nfs/dbraw/zinc/61/63/75/1346616375.db2.gz	KWFIPHRUVACEOQ-UHFFFAOYSA-N	0	3	337.423	3.244	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2ccc(OCC3CC3)cc2)CC1	ZINC001045640983	1346655889	/nfs/dbraw/zinc/65/58/89/1346655889.db2.gz	IFCWAXVKIBVQAW-UHFFFAOYSA-N	0	3	340.467	3.083	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2coc(C3CCCCC3)n2)CC1	ZINC001045650875	1346659954	/nfs/dbraw/zinc/65/99/54/1346659954.db2.gz	RLHYTQUDNGOGRM-UHFFFAOYSA-N	0	3	331.460	3.493	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2cccc3c2OCC3(C)C)CC1	ZINC001045658951	1346662076	/nfs/dbraw/zinc/66/20/76/1346662076.db2.gz	WGGQNACWNYYZFI-UHFFFAOYSA-N	0	3	328.456	3.127	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1ccc(C(F)F)cc1	ZINC001045733563	1346682536	/nfs/dbraw/zinc/68/25/36/1346682536.db2.gz	LXMGKDXQOLPDOI-XKQJLSEDSA-N	0	3	347.409	3.349	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1ccc(C#N)cc1	ZINC001045881928	1346731150	/nfs/dbraw/zinc/73/11/50/1346731150.db2.gz	PLGYBLQYARLVKO-MSOLQXFVSA-N	0	3	325.456	3.170	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc(C)cs1)C2	ZINC001045937172	1346773685	/nfs/dbraw/zinc/77/36/85/1346773685.db2.gz	VYDFEWYYVKWFBT-IBGZPJMESA-N	0	3	330.497	3.398	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@@]2(CCN(Cc3cccnc3)C2)C1	ZINC001045955374	1346790641	/nfs/dbraw/zinc/79/06/41/1346790641.db2.gz	DJPXWPIBHBVGEF-NRFANRHFSA-N	0	3	341.499	3.498	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)CCc1ccccc1C)C2	ZINC001045969668	1346804708	/nfs/dbraw/zinc/80/47/08/1346804708.db2.gz	WMABZXIQNFROSS-JOCHJYFZSA-N	0	3	338.495	3.265	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc(Cl)c(F)c1)C2	ZINC001045971711	1346807559	/nfs/dbraw/zinc/80/75/59/1346807559.db2.gz	WRGXBMNONWWJJK-IBGZPJMESA-N	0	3	348.849	3.431	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@H]1C[C@@H]1c1ccccc1)C2	ZINC001045972729	1346808408	/nfs/dbraw/zinc/80/84/08/1346808408.db2.gz	HMDHDLKXDOJWKT-RZUBCFFCSA-N	0	3	336.479	3.128	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)Cc1c[nH]c3ccccc13)C2	ZINC001045982627	1346821635	/nfs/dbraw/zinc/82/16/35/1346821635.db2.gz	YYBYKYMJCKQICR-JOCHJYFZSA-N	0	3	349.478	3.048	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@H](C)c1cccc(F)c1)C2	ZINC001045984715	1346825262	/nfs/dbraw/zinc/82/52/62/1346825262.db2.gz	HKGCBMMZFFZQFQ-DYESRHJHSA-N	0	3	342.458	3.267	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2cc(F)c3ncccc3c2)C1	ZINC001046705747	1347068601	/nfs/dbraw/zinc/06/86/01/1347068601.db2.gz	CJBOMXCBFXSACZ-IBGZPJMESA-N	0	3	327.403	3.144	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@]2(C)CCN(Cc3ccc(C)cc3C)C2)nc1	ZINC001046783765	1347098536	/nfs/dbraw/zinc/09/85/36/1347098536.db2.gz	SZFGHZOKJWOAFF-QFIPXVFZSA-N	0	3	347.462	3.074	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2ccc(Cl)o2)C1	ZINC001046917352	1347152479	/nfs/dbraw/zinc/15/24/79/1347152479.db2.gz	OQTMRURUMCZSJJ-LLVKDONJSA-N	0	3	332.778	3.196	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2ccsc2C)C1	ZINC001046936350	1347157461	/nfs/dbraw/zinc/15/74/61/1347157461.db2.gz	UPCSFHYCIUBMKY-ZDUSSCGKSA-N	0	3	328.428	3.320	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2conc2C(C)C)C1	ZINC001046942314	1347158624	/nfs/dbraw/zinc/15/86/24/1347158624.db2.gz	ILBOOACVSRNZOX-ZDUSSCGKSA-N	0	3	341.402	3.061	20	30		EGEDHN
CC(C)(C)C(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1ccc(F)cc1)C2	ZINC001047187117	1347234728	/nfs/dbraw/zinc/23/47/28/1347234728.db2.gz	ALSKMMHWAIMKER-UHOSZYNNSA-N	0	3	342.458	3.192	20	30		EGEDHN
CC(C)(C)C(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1ccc(F)cc1)C2	ZINC001047187118	1347234767	/nfs/dbraw/zinc/23/47/67/1347234767.db2.gz	ALSKMMHWAIMKER-WDSOQIARSA-N	0	3	342.458	3.192	20	30		EGEDHN
C=C(C)CN1CCC([C@H]2CCCN(C(=O)C(=O)C(C)(C)C)C2)CC1	ZINC001047231987	1347261207	/nfs/dbraw/zinc/26/12/07/1347261207.db2.gz	REHLMXLEOCPYJM-KRWDZBQOSA-N	0	3	334.504	3.128	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3ccoc3Cl)C2)CC1	ZINC001047234640	1347262434	/nfs/dbraw/zinc/26/24/34/1347262434.db2.gz	OCOZYPZZIIMMKT-HNNXBMFYSA-N	0	3	334.847	3.130	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3ccoc3Cl)C2)CC1	ZINC001047234641	1347262657	/nfs/dbraw/zinc/26/26/57/1347262657.db2.gz	OCOZYPZZIIMMKT-OAHLLOKOSA-N	0	3	334.847	3.130	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)C3CC(F)(F)C3)C2)CC1	ZINC001047234992	1347262896	/nfs/dbraw/zinc/26/28/96/1347262896.db2.gz	UXYVMQYXRHGXBI-MRXNPFEDSA-N	0	3	338.442	3.006	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)[C@@H](CC)SC)C2)CC1	ZINC001047238020	1347264642	/nfs/dbraw/zinc/26/46/42/1347264642.db2.gz	VXBIURZEEUVWJK-ZWKOTPCHSA-N	0	3	336.545	3.102	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@@H]3C[C@@H]4C=C[C@H]3CC4)C2)CC1	ZINC001047241931	1347268343	/nfs/dbraw/zinc/26/83/43/1347268343.db2.gz	QCYVVVXATFKYRG-GFOJFJKKSA-N	0	3	340.511	3.173	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)C[C@@H]3CC=CCC3)C2)CC1	ZINC001047251448	1347276070	/nfs/dbraw/zinc/27/60/70/1347276070.db2.gz	JOPGVDMTUUXXHJ-UYAOXDASSA-N	0	3	328.500	3.317	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)c3ccc(Cl)[nH]3)C2)CC1	ZINC001047254010	1347278088	/nfs/dbraw/zinc/27/80/88/1347278088.db2.gz	MBOSLYGJSKZKNR-INIZCTEOSA-N	0	3	347.890	3.256	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)[C@H]3CC34CCC4)C2)CC1	ZINC001047258373	1347281358	/nfs/dbraw/zinc/28/13/58/1347281358.db2.gz	BFWBVWQAUCIREV-RBUKOAKNSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)c3ccc(F)s3)C2)CC1	ZINC001047265348	1347286489	/nfs/dbraw/zinc/28/64/89/1347286489.db2.gz	GWDAKNLRGQONFB-INIZCTEOSA-N	0	3	348.487	3.475	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)CCc3ccc(C)o3)C2)CC1	ZINC001047266024	1347287071	/nfs/dbraw/zinc/28/70/71/1347287071.db2.gz	OCDYIZFPAQSDHF-LJQANCHMSA-N	0	3	342.483	3.104	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)c2cccs2)C1	ZINC001047692246	1347334161	/nfs/dbraw/zinc/33/41/61/1347334161.db2.gz	KKCRISFPOAYMMI-YOEHRIQHSA-N	0	3	339.464	3.260	20	30		EGEDHN
C[C@H](NCc1c(F)cccc1Cl)[C@@H]1CCN(C(=O)C#CC2CC2)C1	ZINC001047837342	1347385093	/nfs/dbraw/zinc/38/50/93/1347385093.db2.gz	WHARZKHUXXZODN-DZGCQCFKSA-N	0	3	348.849	3.219	20	30		EGEDHN
C[C@@H](NCc1c(F)cccc1Cl)[C@@H]1CCN(C(=O)C#CC2CC2)C1	ZINC001047837344	1347385173	/nfs/dbraw/zinc/38/51/73/1347385173.db2.gz	WHARZKHUXXZODN-UKRRQHHQSA-N	0	3	348.849	3.219	20	30		EGEDHN
Cc1coc(C(=O)N2CC[C@@H]([C@@H](C)NCc3ccccc3C#N)C2)c1	ZINC001047938580	1347417289	/nfs/dbraw/zinc/41/72/89/1347417289.db2.gz	YAQRFLYPVWVJBG-CRAIPNDOSA-N	0	3	337.423	3.100	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@H]([C@@H](C)NCc2ccccc2C#N)C1	ZINC001047950468	1347421843	/nfs/dbraw/zinc/42/18/43/1347421843.db2.gz	LVAKXNQABBKTIJ-QAPCUYQASA-N	0	3	327.472	3.321	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H]([C@@H](C)NCc3cscn3)C2)CC1	ZINC001047956889	1347423673	/nfs/dbraw/zinc/42/36/73/1347423673.db2.gz	ASXRGGOTPPOGJE-GDBMZVCRSA-N	0	3	333.501	3.216	20	30		EGEDHN
CC(C)C1(C(=O)N2CC[C@H]([C@@H](C)NCc3ccccc3C#N)C2)CC1	ZINC001047969276	1347428453	/nfs/dbraw/zinc/42/84/53/1347428453.db2.gz	GONYANYGTNWFSE-APWZRJJASA-N	0	3	339.483	3.321	20	30		EGEDHN
CCC(CC)C(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001048150604	1347482135	/nfs/dbraw/zinc/48/21/35/1347482135.db2.gz	DEPAAYIBDOTZIB-DNVCBOLYSA-N	0	3	327.472	3.179	20	30		EGEDHN
C/C(=C\C(=O)N1C[C@H](C)[C@@H](CNCc2ccccc2C#N)C1)C1CC1	ZINC001048166663	1347485002	/nfs/dbraw/zinc/48/50/02/1347485002.db2.gz	UQJXLACOOBYYMQ-AGHVPPMNSA-N	0	3	337.467	3.099	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@H](C)[C@@H](CNCc2nccs2)C1	ZINC001048264781	1347505736	/nfs/dbraw/zinc/50/57/36/1347505736.db2.gz	DAQBPYVDJSPWBN-AAEUAGOBSA-N	0	3	341.908	3.106	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H](C)[C@@H](CNCc3nccs3)C2)CC1	ZINC001048370339	1347533086	/nfs/dbraw/zinc/53/30/86/1347533086.db2.gz	ROOGLNAZDBKYAR-ZBFHGGJFSA-N	0	3	333.501	3.074	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CN(Cc3cccc(Cl)c3)C[C@H]2C1	ZINC001048979878	1347696173	/nfs/dbraw/zinc/69/61/73/1347696173.db2.gz	DLWQZJODNAMYAP-IYBDPMFKSA-N	0	3	332.875	3.442	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CN(Cc4cc(C)ccc4F)C[C@H]3C2)C1	ZINC001049044066	1347714432	/nfs/dbraw/zinc/71/44/32/1347714432.db2.gz	XGCHVZVVGXCKKM-HDICACEKSA-N	0	3	342.458	3.381	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc4cc(F)ccc4s3)C[C@@H]2C1	ZINC001049210424	1347748409	/nfs/dbraw/zinc/74/84/09/1347748409.db2.gz	ZIUYOINJEWAHAE-GASCZTMLSA-N	0	3	342.439	3.068	20	30		EGEDHN
C=C[C@@H](C(=O)N1C[C@H]2CN(C[C@H](F)CC)C[C@H]2C1)c1ccccc1	ZINC001049229811	1347752093	/nfs/dbraw/zinc/75/20/93/1347752093.db2.gz	RAFLZYITFMLTTA-FCGDIQPGSA-N	0	3	330.447	3.095	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)[C@@H]2CC=CCC2)c1	ZINC001049324537	1347791146	/nfs/dbraw/zinc/79/11/46/1347791146.db2.gz	ATQPWKRRQZAHTF-QHAWAJNXSA-N	0	3	349.478	3.480	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049344860	1347798997	/nfs/dbraw/zinc/79/89/97/1347798997.db2.gz	RDAMEYWQOHYKAP-SNRMKQJTSA-N	0	3	325.456	3.170	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@H]2CCCN3C(=O)C2CC=CC2)cc1	ZINC001049390698	1347816541	/nfs/dbraw/zinc/81/65/41/1347816541.db2.gz	BOZIEEIWFWMWGK-UXHICEINSA-N	0	3	335.451	3.090	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)COc1cccc(C(C)C)c1	ZINC001049490150	1347874136	/nfs/dbraw/zinc/87/41/36/1347874136.db2.gz	KIGUXWZVTWHMBO-PMACEKPBSA-N	0	3	342.483	3.440	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc2c(o1)CCCC2	ZINC001049514680	1347886854	/nfs/dbraw/zinc/88/68/54/1347886854.db2.gz	IPZQRBPLNVAPKP-IAGOWNOFSA-N	0	3	328.456	3.413	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(C2CCCCC2)n[nH]1	ZINC001049522830	1347890948	/nfs/dbraw/zinc/89/09/48/1347890948.db2.gz	JFSVBBMCQUOEIV-OALUTQOASA-N	0	3	342.487	3.322	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cncc(Cl)c1C	ZINC001049533930	1347895033	/nfs/dbraw/zinc/89/50/33/1347895033.db2.gz	XOYWFVXLBGDSKI-DLBZAZTESA-N	0	3	333.863	3.298	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccnc(-c2ccco2)c1	ZINC001049544700	1347900477	/nfs/dbraw/zinc/90/04/77/1347900477.db2.gz	OOTZKTOFLDXFQR-QZTJIDSGSA-N	0	3	337.423	3.207	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)C1CCc2ccccc2CC1	ZINC001049562298	1347910810	/nfs/dbraw/zinc/91/08/10/1347910810.db2.gz	VOLDZMGTBPOMBI-SFTDATJTSA-N	0	3	338.495	3.433	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1c(C)cccc1Cl	ZINC001049568700	1347914678	/nfs/dbraw/zinc/91/46/78/1347914678.db2.gz	WFLDRGFLJVMIQE-RTBURBONSA-N	0	3	344.886	3.280	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc2c(cn1)CCCC2	ZINC001049581719	1347920895	/nfs/dbraw/zinc/92/08/95/1347920895.db2.gz	HUBYXVAKWDYBBU-PMACEKPBSA-N	0	3	339.483	3.215	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc2c(c1)C(C)(C)CO2	ZINC001049587029	1347923703	/nfs/dbraw/zinc/92/37/03/1347923703.db2.gz	DMQFHYDQSFDYBR-ZWKOTPCHSA-N	0	3	340.467	3.222	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1cccc(C(F)F)c1	ZINC001049590621	1347926074	/nfs/dbraw/zinc/92/60/74/1347926074.db2.gz	BARGCDVATZDEGZ-ZWKOTPCHSA-N	0	3	346.421	3.255	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](C)c1c(F)cccc1F	ZINC001049595844	1347928717	/nfs/dbraw/zinc/92/87/17/1347928717.db2.gz	TYLXUNAVMCCPQM-KBRIMQKVSA-N	0	3	334.410	3.320	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1c(C)onc1C1CC1	ZINC001049599489	1347930243	/nfs/dbraw/zinc/93/02/43/1347930243.db2.gz	SCAGLPJZZACMHO-HZPDHXFCSA-N	0	3	329.444	3.115	20	30		EGEDHN
CC1(CC(=O)N2CCC[C@@H]3[C@@H]2CCN3Cc2ccc(C#N)cc2)CC1	ZINC001049602134	1347931465	/nfs/dbraw/zinc/93/14/65/1347931465.db2.gz	LCYSFTMHGWUWPR-MOPGFXCFSA-N	0	3	337.467	3.314	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1c(C)noc1C1CC1	ZINC001049602608	1347932436	/nfs/dbraw/zinc/93/24/36/1347932436.db2.gz	NPKDDNAIZNBDNH-HOTGVXAUSA-N	0	3	329.444	3.115	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccncc1OC(C)C	ZINC001049615833	1347936441	/nfs/dbraw/zinc/93/64/41/1347936441.db2.gz	ODAYGFAVDADRLT-ROUUACIJSA-N	0	3	343.471	3.124	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)CCc1cccc(Cl)c1	ZINC001049625058	1347940764	/nfs/dbraw/zinc/94/07/64/1347940764.db2.gz	GMIXNCRXWGAJIM-OALUTQOASA-N	0	3	344.886	3.361	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccccc1-n1cccc1	ZINC001049685861	1347971589	/nfs/dbraw/zinc/97/15/89/1347971589.db2.gz	BQCGVFJYIORPJT-NHCUHLMSSA-N	0	3	347.462	3.180	20	30		EGEDHN
CC1(C(=O)N2CCC[C@H]3[C@@H]2CCN3Cc2ccc(C#N)cc2)CC=CC1	ZINC001049690872	1347974051	/nfs/dbraw/zinc/97/40/51/1347974051.db2.gz	RTGSJYYJGFFKMJ-PMACEKPBSA-N	0	3	349.478	3.480	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C[C@H](C)c1cccc(F)c1	ZINC001049710850	1347985928	/nfs/dbraw/zinc/98/59/28/1347985928.db2.gz	YKXFCFWIMLMAGA-KFKAGJAMSA-N	0	3	328.431	3.018	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(C2CC2)nc1C	ZINC001049743040	1347996470	/nfs/dbraw/zinc/99/64/70/1347996470.db2.gz	YGCHJYVETDRRKF-MOPGFXCFSA-N	0	3	325.456	3.132	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(C2CC2)nc1C	ZINC001049743042	1347996495	/nfs/dbraw/zinc/99/64/95/1347996495.db2.gz	YGCHJYVETDRRKF-RBUKOAKNSA-N	0	3	325.456	3.132	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C1(Cc2ccc(F)cc2)CC1	ZINC001049772942	1348014515	/nfs/dbraw/zinc/01/45/15/1348014515.db2.gz	MFDHDRJRCOKDQD-RBUKOAKNSA-N	0	3	342.458	3.400	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1sc(CC)nc1C	ZINC001049777966	1348016717	/nfs/dbraw/zinc/01/67/17/1348016717.db2.gz	LLJHGSINXQHPAO-LSDHHAIUSA-N	0	3	333.501	3.269	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C[C@H]1CCc2ccccc21	ZINC001049800962	1348027119	/nfs/dbraw/zinc/02/71/19/1348027119.db2.gz	FVNAJCNRSXNWSW-HMXCVIKNSA-N	0	3	336.479	3.195	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cnc2ccc(F)cc2c1	ZINC001049825021	1348041422	/nfs/dbraw/zinc/04/14/22/1348041422.db2.gz	LPLLGLXNCPGRPK-MOPGFXCFSA-N	0	3	339.414	3.239	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc2c(c1)CCC=C2	ZINC001049846470	1348055654	/nfs/dbraw/zinc/05/56/54/1348055654.db2.gz	INECKVSJORFFLD-NHCUHLMSSA-N	0	3	334.463	3.348	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H]1Cc2ccc(Cl)cc21	ZINC001049869094	1348074477	/nfs/dbraw/zinc/07/44/77/1348074477.db2.gz	CEQIFLDTIPFQFI-KZNAEPCWSA-N	0	3	330.859	3.231	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C1CCC(C(F)F)CC1	ZINC001049869440	1348074534	/nfs/dbraw/zinc/07/45/34/1348074534.db2.gz	GXUODFVDQYKJMU-SSHXOBKSSA-N	0	3	326.431	3.309	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](C)c1ccc(F)cc1F	ZINC001049904181	1348103292	/nfs/dbraw/zinc/10/32/92/1348103292.db2.gz	NEOAECRJMKWWDI-NIKGAXFTSA-N	0	3	346.421	3.157	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](C)c1cccc(F)c1	ZINC001049905185	1348103511	/nfs/dbraw/zinc/10/35/11/1348103511.db2.gz	VWFRMKJXQSQFGC-AYOQOUSVSA-N	0	3	328.431	3.018	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C[C@@H](C)c1ccc(F)cc1	ZINC001049913349	1348108481	/nfs/dbraw/zinc/10/84/81/1348108481.db2.gz	WFQQUZXLLNDMKM-NSISKUIASA-N	0	3	342.458	3.408	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](C)Cc1ccccc1C	ZINC001049914457	1348109293	/nfs/dbraw/zinc/10/92/93/1348109293.db2.gz	DHOQQUXQWPUWSQ-MISYRCLQSA-N	0	3	326.484	3.425	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)CCc1cc(C)sc1C	ZINC001049922919	1348114709	/nfs/dbraw/zinc/11/47/09/1348114709.db2.gz	JBIIUINKXXYAMU-MOPGFXCFSA-N	0	3	344.524	3.386	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3CCCN(C(=O)C4=CCCC4)[C@@H]3C2)cc1	ZINC001050018836	1348156807	/nfs/dbraw/zinc/15/68/07/1348156807.db2.gz	UYNKHHHVOSAKKH-VQTJNVASSA-N	0	3	335.451	3.091	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)CCc3ccc(C)cc3C)[C@@H]2C1	ZINC001050106402	1348184927	/nfs/dbraw/zinc/18/49/27/1348184927.db2.gz	JBAHLUMMDFWTKJ-LEWJYISDSA-N	0	3	338.495	3.182	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cccc(-c4cnco4)c3)[C@@H]2C1	ZINC001050175301	1348202843	/nfs/dbraw/zinc/20/28/43/1348202843.db2.gz	OVBBTPPRBKUOFL-ZWKOTPCHSA-N	0	3	337.423	3.064	20	30		EGEDHN
CC(C)(C)CC(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001050433252	1348264832	/nfs/dbraw/zinc/26/48/32/1348264832.db2.gz	OZTIMFUCPXZVNW-UHFFFAOYSA-N	0	3	339.483	3.419	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc(Cl)cc3F)C2)CC1	ZINC001050585332	1348294090	/nfs/dbraw/zinc/29/40/90/1348294090.db2.gz	HRFHZLOBPUSFAW-UHFFFAOYSA-N	0	3	334.822	3.040	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@H]3CCC[C@H]3c3ccccc3)C2)CC1	ZINC001050587221	1348294490	/nfs/dbraw/zinc/29/44/90/1348294490.db2.gz	IANXBWCBBVFYDQ-PMACEKPBSA-N	0	3	336.479	3.128	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)[C@]45C[C@H]4CCC5)C3)CC2)c1	ZINC001050598680	1348297170	/nfs/dbraw/zinc/29/71/70/1348297170.db2.gz	PLGCLIOFOXPMBG-DENIHFKCSA-N	0	3	349.478	3.173	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@@H](C)Cc3ccccc3Cl)C2)CC1	ZINC001050684433	1348326189	/nfs/dbraw/zinc/32/61/89/1348326189.db2.gz	LHNOVWMIAWBYSK-INIZCTEOSA-N	0	3	344.886	3.076	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc(F)c4occc43)C2)CC1	ZINC001050761331	1348351005	/nfs/dbraw/zinc/35/10/05/1348351005.db2.gz	LFQRPYOPXSHFDH-UHFFFAOYSA-N	0	3	340.398	3.133	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)[C@H]3CCC[C@H](F)C3)cccc2C1	ZINC001051288232	1348419269	/nfs/dbraw/zinc/41/92/69/1348419269.db2.gz	NNIRWKXAHZIUSE-LPHOPBHVSA-N	0	3	342.458	3.213	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3ccsc3C)cccc2C1	ZINC001051287367	1348419447	/nfs/dbraw/zinc/41/94/47/1348419447.db2.gz	UQPIIINEOUXJHO-UHFFFAOYSA-N	0	3	338.476	3.368	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)[C@H]3CCCC34CC4)cccc2C1	ZINC001051293194	1348421934	/nfs/dbraw/zinc/42/19/34/1348421934.db2.gz	OQHYJQBVLKZVIP-HXUWFJFHSA-N	0	3	336.479	3.265	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)[C@@H]3CC[C@@H](F)C3)cccc2C1	ZINC001051298372	1348423935	/nfs/dbraw/zinc/42/39/35/1348423935.db2.gz	NYDUJYCIMWQRBD-CRAIPNDOSA-N	0	3	330.447	3.375	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3ccc(C)cc3)cccc2C1	ZINC001051305630	1348427169	/nfs/dbraw/zinc/42/71/69/1348427169.db2.gz	NZDOEHVMUZWPPM-UHFFFAOYSA-N	0	3	332.447	3.306	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3cc(CC)on3)cccc2C1	ZINC001051305559	1348427204	/nfs/dbraw/zinc/42/72/04/1348427204.db2.gz	JNIMQVJHAQMYFJ-UHFFFAOYSA-N	0	3	339.439	3.101	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)C3CCC=CCC3)cccc2C1	ZINC001051306658	1348428177	/nfs/dbraw/zinc/42/81/77/1348428177.db2.gz	KOLUTHXMBHRTJO-UHFFFAOYSA-N	0	3	336.479	3.431	20	30		EGEDHN
N#Cc1ccc(C[N@H+]2CCC[C@@H](NC(=O)c3ccccc3[O-])CC2)cc1	ZINC001052212458	1348512929	/nfs/dbraw/zinc/51/29/29/1348512929.db2.gz	SRMVUHOGOVARLF-GOSISDBHSA-N	0	3	349.434	3.048	20	30		EGEDHN
N#Cc1ccc(C[N@@H+]2CCC[C@@H](NC(=O)c3ccccc3[O-])CC2)cc1	ZINC001052212458	1348512931	/nfs/dbraw/zinc/51/29/31/1348512931.db2.gz	SRMVUHOGOVARLF-GOSISDBHSA-N	0	3	349.434	3.048	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H](NC(=O)C3(F)CCCC3)CC2)cc1	ZINC001052506687	1348561598	/nfs/dbraw/zinc/56/15/98/1348561598.db2.gz	JPLFNJMHLWFJEY-SFHVURJKSA-N	0	3	343.446	3.311	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H](NC(=O)[C@]34C[C@H]3CCC4)CC2)cc1	ZINC001052577128	1348584859	/nfs/dbraw/zinc/58/48/59/1348584859.db2.gz	YMCFEDLCYBGHNI-SFHLNBCPSA-N	0	3	337.467	3.219	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCN(CCc3csc(C)n3)CC2)C1	ZINC001052691897	1348635067	/nfs/dbraw/zinc/63/50/67/1348635067.db2.gz	YXISKHOUYLEQML-MRXNPFEDSA-N	0	3	347.528	3.321	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCN(Cc3c(C)onc3CC)CC2)C1	ZINC001052691416	1348635144	/nfs/dbraw/zinc/63/51/44/1348635144.db2.gz	UJRMOEWLJRIZIP-MRXNPFEDSA-N	0	3	345.487	3.372	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2ccc(O[C@@H](C)CC)cc2)CC1	ZINC001052848963	1348700797	/nfs/dbraw/zinc/70/07/97/1348700797.db2.gz	JEFHVQCLNHGBQL-WMZOPIPTSA-N	0	3	328.456	3.081	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)C(C)(C)c2ccc(CC)cc2)CC1	ZINC001052850628	1348701654	/nfs/dbraw/zinc/70/16/54/1348701654.db2.gz	RJPLXWKNJSXEMF-LJQANCHMSA-N	0	3	326.484	3.131	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2c(Cl)cccc2Cl)CC1	ZINC001052891282	1348728497	/nfs/dbraw/zinc/72/84/97/1348728497.db2.gz	ONGNXUXBQKTPGM-LBPRGKRZSA-N	0	3	325.239	3.211	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@H]2CCCCc3ccccc32)CC1	ZINC001052960285	1348772941	/nfs/dbraw/zinc/77/29/41/1348772941.db2.gz	QCEURFFJUCRRPB-FPOVZHCZSA-N	0	3	338.495	3.491	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2occc2C)C1	ZINC001053067556	1348880866	/nfs/dbraw/zinc/88/08/66/1348880866.db2.gz	RUAYUFKHDKKDMU-ROUUACIJSA-N	0	3	328.456	3.318	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cnc(C)s2)C1	ZINC001053070924	1348886847	/nfs/dbraw/zinc/88/68/47/1348886847.db2.gz	GQHBFLLLNGYIRM-DLBZAZTESA-N	0	3	345.512	3.182	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]([C@H]2CCCCN2C(=O)C(=O)C(C)(C)C)C1	ZINC001053077442	1348896933	/nfs/dbraw/zinc/89/69/33/1348896933.db2.gz	JTYLRGKGXRNOBT-IAGOWNOFSA-N	0	3	334.504	3.271	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2nc(C)sc2C)C1	ZINC001053088205	1348913573	/nfs/dbraw/zinc/91/35/73/1348913573.db2.gz	QWOQDUPJYCMFMO-IRXDYDNUSA-N	0	3	345.512	3.100	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cccc(F)c2F)C1	ZINC001053093893	1348922747	/nfs/dbraw/zinc/92/27/47/1348922747.db2.gz	ATJWWHZXMWKDCR-MAUKXSAKSA-N	0	3	346.421	3.305	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)CC(C)(F)F)C1	ZINC001053097592	1348928481	/nfs/dbraw/zinc/92/84/81/1348928481.db2.gz	HFPYZMCMACXEHB-CVEARBPZSA-N	0	3	326.431	3.148	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2sccc2OC)C1	ZINC001053103702	1348938508	/nfs/dbraw/zinc/93/85/08/1348938508.db2.gz	KWGWPXOCEFNYBR-HZPDHXFCSA-N	0	3	346.496	3.097	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@@H]2CC=CC[C@H]2C(F)(F)F)C1	ZINC001079962475	1357439802	/nfs/dbraw/zinc/43/98/02/1357439802.db2.gz	LZOCSNKESKVKST-KBUPBQIOSA-N	0	3	330.394	3.144	20	30		EGEDHN
C=C(C)CCN1Cc2ccccc2C[C@H]1CNC(=O)c1cc[nH]c1C	ZINC001054037108	1349133235	/nfs/dbraw/zinc/13/32/35/1349133235.db2.gz	XCNRVUZSFZZDPD-IBGZPJMESA-N	0	3	337.467	3.446	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccnc3ccccc31)C2	ZINC001054162222	1349165035	/nfs/dbraw/zinc/16/50/35/1349165035.db2.gz	ZUSGFGKGCYLKKL-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc[nH]c1C(C)C)C2	ZINC001054182052	1349183894	/nfs/dbraw/zinc/18/38/94/1349183894.db2.gz	DCMPEYWMZBJHBY-HXUWFJFHSA-N	0	3	327.472	3.090	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(C(C)C)cn1)C2	ZINC001054198013	1349200390	/nfs/dbraw/zinc/20/03/90/1349200390.db2.gz	NJPGFOXRCVQEID-NRFANRHFSA-N	0	3	339.483	3.156	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@H](c1ccccc1)C(C)C)C2	ZINC001054202854	1349204502	/nfs/dbraw/zinc/20/45/02/1349204502.db2.gz	BFAPMNCJQWASAA-RBBKRZOGSA-N	0	3	338.495	3.374	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H](C)Cc1cccs1)C2	ZINC001054204833	1349206042	/nfs/dbraw/zinc/20/60/42/1349206042.db2.gz	FDLHGQVMODKAFZ-PXNSSMCTSA-N	0	3	344.524	3.265	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(OCC)cc1)C2	ZINC001054235714	1349227592	/nfs/dbraw/zinc/22/75/92/1349227592.db2.gz	BBJASLQZGPAKPT-OAQYLSRUSA-N	0	3	340.467	3.037	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1csc3c1CCCC3)C2	ZINC001054237085	1349230262	/nfs/dbraw/zinc/23/02/62/1349230262.db2.gz	UKOOFMMKOJLARQ-FQEVSTJZSA-N	0	3	342.508	3.188	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)C13CC(C(C)(C)C)(C1)C3)C2	ZINC001054247248	1349241762	/nfs/dbraw/zinc/24/17/62/1349241762.db2.gz	RZGCEJUWYATXPI-QNGMFEMESA-N	0	3	328.500	3.151	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3cc(CC)n[nH]3)cc2C1	ZINC001054256184	1349251782	/nfs/dbraw/zinc/25/17/82/1349251782.db2.gz	QRQKVNTVDGSWOQ-UHFFFAOYSA-N	0	3	338.455	3.184	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@H]3C[C@@H]3OCC)cc2C1	ZINC001054257715	1349254050	/nfs/dbraw/zinc/25/40/50/1349254050.db2.gz	UFYUBFCBDWSUAZ-OALUTQOASA-N	0	3	328.456	3.010	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@@H]3CCC[C@H]3OC)cc2C1	ZINC001054271314	1349270750	/nfs/dbraw/zinc/27/07/50/1349270750.db2.gz	KWDFMCBXDACMMB-RTBURBONSA-N	0	3	328.456	3.010	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@@H]3CCO[C@H]3C3CC3)cc2C1	ZINC001054275239	1349275551	/nfs/dbraw/zinc/27/55/51/1349275551.db2.gz	KZNGIXSQWNNSGD-UXHICEINSA-N	0	3	340.467	3.010	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3cc(CC)on3)cc2C1	ZINC001054289918	1349293965	/nfs/dbraw/zinc/29/39/65/1349293965.db2.gz	UFQFMDMBEFOVNN-UHFFFAOYSA-N	0	3	339.439	3.449	20	30		EGEDHN
CC(C(=O)N1C[C@@H](C)[C@@H](NCc2ccc(C#N)c(F)c2)C1)=C1CCC1	ZINC001054637497	1349424792	/nfs/dbraw/zinc/42/47/92/1349424792.db2.gz	MXISEBLDEDUMGL-YJYMSZOUSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@@H](NCc2c(C)nsc2C)C1	ZINC001054970801	1349531109	/nfs/dbraw/zinc/53/11/09/1349531109.db2.gz	ISAABGRLPLQRCV-WBMJQRKESA-N	0	3	335.517	3.299	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@@H](NCc2cnn(C(C)(C)C)c2)C1	ZINC001054971844	1349532996	/nfs/dbraw/zinc/53/29/96/1349532996.db2.gz	VCUZRUAIXOFKDH-WBVHZDCISA-N	0	3	346.519	3.177	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CC3(CCC3)C2)C[C@H]1NCc1ccc(C#N)s1	ZINC001054992270	1349541851	/nfs/dbraw/zinc/54/18/51/1349541851.db2.gz	PDCNGDHEGYIPOQ-CXAGYDPISA-N	0	3	343.496	3.137	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2CC(C)(C)C2)C[C@H]1NCc1ccc(C#N)s1	ZINC001055001381	1349546086	/nfs/dbraw/zinc/54/60/86/1349546086.db2.gz	HEGZMQZIWKSRRX-CXAGYDPISA-N	0	3	345.512	3.383	20	30		EGEDHN
C#CCCN1C[C@@H](C)[C@H](NC(=O)c2c(Cl)oc3ccccc32)C1	ZINC001080306276	1357565842	/nfs/dbraw/zinc/56/58/42/1357565842.db2.gz	MCLXAIGYAYEYSN-TZMCWYRMSA-N	0	3	330.815	3.160	20	30		EGEDHN
C=C(Br)CNCCCN(CC1CCCC1)C(=O)CC	ZINC001177167160	1385841231	/nfs/dbraw/zinc/84/12/31/1385841231.db2.gz	MJNSTFOKPNOQRS-UHFFFAOYSA-N	0	3	331.298	3.304	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)[C@H]2CC[C@H](CC)CC2)C1	ZINC001070433707	1354347440	/nfs/dbraw/zinc/34/74/40/1354347440.db2.gz	BLCWJBBEOZENJJ-BRWVUGGUSA-N	0	3	344.503	3.218	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H](C)O[C@]2(CCN(Cc3ccccc3)C2)C1	ZINC001071197489	1354499036	/nfs/dbraw/zinc/49/90/36/1354499036.db2.gz	UBQJNIZUWNVDLO-UWJYYQICSA-N	0	3	342.483	3.091	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C(CC)(CC)CC)C[C@@H](C)O2	ZINC001071226049	1354513794	/nfs/dbraw/zinc/51/37/94/1354513794.db2.gz	UMHCYMQPJRMGTB-XLIONFOSSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1ccc(C)c(C)c1)C[C@@H](C)O2	ZINC001071236450	1354520926	/nfs/dbraw/zinc/52/09/26/1354520926.db2.gz	VEQJCZWNJVGGSS-NQIIRXRSSA-N	0	3	342.483	3.185	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2c(F)c(F)cc(F)c2F)CC[C@H]1C	ZINC001071526851	1354747250	/nfs/dbraw/zinc/74/72/50/1354747250.db2.gz	VGPHPBXGHVAWEQ-GHMZBOCLSA-N	0	3	344.352	3.402	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cncc(-c3ccccc3)c2)CC[C@H]1C	ZINC001071548687	1354760452	/nfs/dbraw/zinc/76/04/52/1354760452.db2.gz	KHZZKGBVLXPPNM-DYESRHJHSA-N	0	3	347.462	3.355	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cncc(-c3ccccc3)c2)CC[C@@H]1C	ZINC001071548690	1354760913	/nfs/dbraw/zinc/76/09/13/1354760913.db2.gz	KHZZKGBVLXPPNM-UWJYYQICSA-N	0	3	347.462	3.355	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc3cc(C)cn3c2)CC[C@H]1C	ZINC001071558193	1354763730	/nfs/dbraw/zinc/76/37/30/1354763730.db2.gz	ZKCHNMLFDGSFOG-SJLPKXTDSA-N	0	3	325.456	3.407	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@@H]2CC[C@H](C)N(CC(=C)C)C2)cc1	ZINC001071620084	1354803474	/nfs/dbraw/zinc/80/34/74/1354803474.db2.gz	ZRZZYSUNRIOATP-FUHWJXTLSA-N	0	3	328.456	3.410	20	30		EGEDHN
C=C(C)CCN1C[C@H](NC(=O)c2ocnc2C(F)(F)F)CC[C@H]1C	ZINC001071705318	1354864030	/nfs/dbraw/zinc/86/40/30/1354864030.db2.gz	NNMLGRREXQZLDL-VXGBXAGGSA-N	0	3	345.365	3.242	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2sccc2-n2cccc2)CC[C@@H]1C	ZINC001071724604	1354880999	/nfs/dbraw/zinc/88/09/99/1354880999.db2.gz	JRDTUZDWBSAPSI-HOTGVXAUSA-N	0	3	341.480	3.145	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc3cc(F)ccc3[nH]2)CC[C@H]1C	ZINC001071728229	1354884245	/nfs/dbraw/zinc/88/42/45/1354884245.db2.gz	JMNKDQPTWJJQIV-CZUORRHYSA-N	0	3	329.419	3.466	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CC[C@@H](C)N(Cc3ccccc3)C2)cc1	ZINC001071731851	1354886056	/nfs/dbraw/zinc/88/60/56/1354886056.db2.gz	LAXRTGLCSUSHLS-DYESRHJHSA-N	0	3	332.447	3.451	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)c2ccc(F)c3ccncc23)CC[C@H]1C	ZINC001071759388	1354907630	/nfs/dbraw/zinc/90/76/30/1354907630.db2.gz	HDPUMJILBYKQAR-KGLIPLIRSA-N	0	3	327.403	3.143	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc3ccccc3n2C)CC[C@H]1C	ZINC001071773122	1354920903	/nfs/dbraw/zinc/92/09/03/1354920903.db2.gz	WQKGLUBINPDEBP-WBVHZDCISA-N	0	3	325.456	3.337	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccsc2)CC(C)(C)C1	ZINC001089419382	1360413329	/nfs/dbraw/zinc/41/33/29/1360413329.db2.gz	FIBVVIWYGFRIMP-IXDOHACOSA-N	0	3	330.497	3.092	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@H]2CCCc3ccccc32)CC(C)(C)C1	ZINC001089419373	1360413453	/nfs/dbraw/zinc/41/34/53/1360413453.db2.gz	FEFGLVABMXEIBT-ICSRJNTNSA-N	0	3	338.495	3.347	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@H]2CC[C@H](C)N(CC=C(C)C)C2)cc1	ZINC001071868043	1354993621	/nfs/dbraw/zinc/99/36/21/1354993621.db2.gz	GSUSXOCAINORCH-HKUYNNGSSA-N	0	3	340.467	3.248	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2c[nH]c(=O)c3ccccc23)CC[C@H]1C	ZINC001071871440	1354996363	/nfs/dbraw/zinc/99/63/63/1354996363.db2.gz	ICCMJWOSUNULOP-CABCVRRESA-N	0	3	339.439	3.099	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2csc(C3CC3)n2)CC[C@@H]1C	ZINC001071879458	1355002363	/nfs/dbraw/zinc/00/23/63/1355002363.db2.gz	CZSYRUJHQUPOIW-ZFWWWQNUSA-N	0	3	333.501	3.108	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cccc3c2ccn3C)CC[C@H]1C	ZINC001071900583	1355014545	/nfs/dbraw/zinc/01/45/45/1355014545.db2.gz	KKQFEYOQGDXHCD-HZPDHXFCSA-N	0	3	325.456	3.337	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccccc2NC(=O)CC)CC[C@H]1C	ZINC001071908431	1355018638	/nfs/dbraw/zinc/01/86/38/1355018638.db2.gz	VQMNYTXLWKTIHS-CVEARBPZSA-N	0	3	343.471	3.194	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cccc(-n3ccnc3)c2)CC[C@H]1C	ZINC001071954425	1355039857	/nfs/dbraw/zinc/03/98/57/1355039857.db2.gz	OOHSGBXCVYYFSO-SJLPKXTDSA-N	0	3	338.455	3.031	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cnn(CCCC)c2CC)CC[C@H]1C	ZINC001071977295	1355056891	/nfs/dbraw/zinc/05/68/91/1355056891.db2.gz	OVORAARRRWGNSF-IAGOWNOFSA-N	0	3	346.519	3.404	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CC[C@H](C)N(Cc3cccc(C)c3)C2)cn1	ZINC001072002152	1355067376	/nfs/dbraw/zinc/06/73/76/1355067376.db2.gz	JEELGYCJBQYDEO-LAUBAEHRSA-N	0	3	347.462	3.154	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2(c3ccccc3C)CCC2)CC[C@H]1C	ZINC001072026526	1355087565	/nfs/dbraw/zinc/08/75/65/1355087565.db2.gz	KDHSTHZDQGJQRE-RTBURBONSA-N	0	3	338.495	3.409	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc(Cl)cc3c2OCC3)CC[C@H]1C	ZINC001072109912	1355136841	/nfs/dbraw/zinc/13/68/41/1355136841.db2.gz	PDTUYNIMUYIEKS-CJNGLKHVSA-N	0	3	348.874	3.434	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cscc2C(F)(F)F)CC[C@@H]1C	ZINC001072127181	1355143560	/nfs/dbraw/zinc/14/35/60/1355143560.db2.gz	PZMUSRIIYGPBDM-RYUDHWBXSA-N	0	3	344.402	3.373	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)Cc2c(C)oc3ccccc32)CC[C@H]1C	ZINC001072128624	1355144370	/nfs/dbraw/zinc/14/43/70/1355144370.db2.gz	CZHUPAHDDAGKCO-NVXWUHKLSA-N	0	3	338.451	3.276	20	30		EGEDHN
C[C@@H]1CCN(C(=O)C2(C)CC2)C[C@H]1CNCc1cc(F)ccc1C#N	ZINC001072288438	1355221840	/nfs/dbraw/zinc/22/18/40/1355221840.db2.gz	LKIKPAHGQAJJEY-RHSMWYFYSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](C)[C@@H](CNCc3ncc(C)s3)C2)C1	ZINC001072363371	1355258261	/nfs/dbraw/zinc/25/82/61/1355258261.db2.gz	DHSNRGAZCUVTGL-HOCLYGCPSA-N	0	3	347.528	3.382	20	30		EGEDHN
CCC1(C(=O)N2CC[C@@H](C)[C@H](CNCc3ccccc3C#N)C2)CC1	ZINC001072364208	1355258508	/nfs/dbraw/zinc/25/85/08/1355258508.db2.gz	QCTCQSBWLHQTMI-VQIMIIECSA-N	0	3	339.483	3.323	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC2(C1)CCN([C@@H](C)c1ccccc1Cl)C2	ZINC001072544221	1355327010	/nfs/dbraw/zinc/32/70/10/1355327010.db2.gz	FMEUBGHNWXKVNJ-KGLIPLIRSA-N	0	3	331.847	3.095	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC2(C1)CCN(C/C=C\c1ccc(Cl)cc1)C2	ZINC001072551494	1355330164	/nfs/dbraw/zinc/33/01/64/1355330164.db2.gz	GBPMFHRMIRMYPG-GWQWAINWSA-N	0	3	343.858	3.047	20	30		EGEDHN
CCc1ccc(C(=O)N2CC3(C2)CCN(Cc2ccc(C#N)cc2)C3)o1	ZINC001072861100	1355471405	/nfs/dbraw/zinc/47/14/05/1355471405.db2.gz	XBPVSEBWQDQJKY-UHFFFAOYSA-N	0	3	349.434	3.062	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H](C)c3ccc(Cl)cc3)C2)C1	ZINC001072941246	1355510445	/nfs/dbraw/zinc/51/04/45/1355510445.db2.gz	HLEDYWJRIJWTDW-OAHLLOKOSA-N	0	3	330.859	3.001	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC2(C1)CCN(CCOc1ccccc1)C2	ZINC001072951451	1355518409	/nfs/dbraw/zinc/51/84/09/1355518409.db2.gz	FNXCKMZMERVRKC-FQEVSTJZSA-N	0	3	342.483	3.202	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2cccc3ccsc32)C1	ZINC001073844759	1355915605	/nfs/dbraw/zinc/91/56/05/1355915605.db2.gz	ADTLQDWGGFGFKE-INIZCTEOSA-N	0	3	344.480	3.298	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2cccc(C3CCC3)c2)C1	ZINC001073853298	1355918312	/nfs/dbraw/zinc/91/83/12/1355918312.db2.gz	ANMSWMBMRXEBTH-HXUWFJFHSA-N	0	3	342.483	3.351	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2cccc(C(F)F)c2)C1	ZINC001073861783	1355923805	/nfs/dbraw/zinc/92/38/05/1355923805.db2.gz	IEZDBYLJIYNHIY-INIZCTEOSA-N	0	3	338.398	3.021	20	30		EGEDHN
C#CCCN1CCCO[C@H](CNC(=O)C2CCC(C(C)(C)C)CC2)C1	ZINC001073877841	1355934571	/nfs/dbraw/zinc/93/45/71/1355934571.db2.gz	BZSNMHBJKPMONI-CTWPCTMYSA-N	0	3	348.531	3.069	20	30		EGEDHN
COc1ccc(C(C)C)cc1CN[C@H]1CCN(C(=O)[C@@H](C)C#N)[C@H]1C	ZINC001074568121	1356209890	/nfs/dbraw/zinc/20/98/90/1356209890.db2.gz	KLGJXDRWYUXOBT-MPGHIAIKSA-N	0	3	343.471	3.057	20	30		EGEDHN
C[C@@H](N[C@H]1CCN(C(=O)C#CC2CC2)[C@H]1C)c1ccc(F)cc1F	ZINC001074643049	1356220527	/nfs/dbraw/zinc/22/05/27/1356220527.db2.gz	XGCRDJSYIUBNLW-VBHSOAQHSA-N	0	3	332.394	3.018	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N1CC[C@H](NCc2ccc(C#N)s2)[C@@H]1C	ZINC001074862934	1356270422	/nfs/dbraw/zinc/27/04/22/1356270422.db2.gz	ZZUXHGYSNMTRLA-IXKJSCDLSA-N	0	3	331.485	3.135	20	30		EGEDHN
C[C@H](CC(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)[C@@H]1C)C1CC1	ZINC001075133696	1356324013	/nfs/dbraw/zinc/32/40/13/1356324013.db2.gz	MDVVLVSZWCOHAO-TYILLQQXSA-N	0	3	343.446	3.213	20	30		EGEDHN
CCCCCCN(C)CC(=O)NC[C@H](C)Nc1cccc(F)c1C#N	ZINC001098008457	1363196049	/nfs/dbraw/zinc/19/60/49/1363196049.db2.gz	PZQJAFZVFGNSDF-HNNXBMFYSA-N	0	3	348.466	3.126	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@H](C)c3c(F)cccc3F)[C@@H]2C1	ZINC001076044293	1356472575	/nfs/dbraw/zinc/47/25/75/1356472575.db2.gz	WQDPWDPMOOQZSG-JKIFEVAISA-N	0	3	334.410	3.177	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cnc4ccccc4c3C)[C@@H]2C1	ZINC001076057860	1356477502	/nfs/dbraw/zinc/47/75/02/1356477502.db2.gz	GEEHDIUUDQSSGX-OXJNMPFZSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@@H](CC)Oc3cccc(C)c3)[C@@H]2C1	ZINC001076350796	1356556063	/nfs/dbraw/zinc/55/60/63/1356556063.db2.gz	KDBDUAZKKPWIFR-DFQSSKMNSA-N	0	3	342.483	3.261	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2ccc(N(CC)CC)cc2)C1	ZINC001080839916	1357750771	/nfs/dbraw/zinc/75/07/71/1357750771.db2.gz	GYVVFJWIRPJYDX-VQIMIIECSA-N	0	3	329.488	3.159	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@H](NC(=O)C2CCCC2)C12CCC2	ZINC001078529224	1356996531	/nfs/dbraw/zinc/99/65/31/1356996531.db2.gz	NRZZLXNUAVTSOB-KGLIPLIRSA-N	0	3	341.293	3.102	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@H](NCc3ccc(F)cn3)C23CCC3)C1	ZINC001078720640	1357065559	/nfs/dbraw/zinc/06/55/59/1357065559.db2.gz	OGTRWGBSILAHDF-IRXDYDNUSA-N	0	3	343.446	3.094	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2cc[nH]c2C2CCC2)C[C@H]1c1ccccc1	ZINC001081179990	1357848008	/nfs/dbraw/zinc/84/80/08/1357848008.db2.gz	VNLKEQDFTAGTKT-VQTJNVASSA-N	0	3	347.462	3.113	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2sccc2CC)C[C@H]1c1ccccc1	ZINC001081229894	1357851582	/nfs/dbraw/zinc/85/15/82/1357851582.db2.gz	FZOXXOLBTKYANX-ZWKOTPCHSA-N	0	3	338.476	3.142	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H](C=C)c2ccccc2)C[C@H]1c1ccccc1	ZINC001081229908	1357851594	/nfs/dbraw/zinc/85/15/94/1357851594.db2.gz	GWCXPCVCAUAMMI-BHIFYINESA-N	0	3	344.458	3.174	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2ccc(CCC)cc2)[C@H](OC)C1	ZINC001082079462	1357940111	/nfs/dbraw/zinc/94/01/11/1357940111.db2.gz	ZCDBXVHAQGGSJC-RTBURBONSA-N	0	3	330.472	3.034	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2cccc(C)c2Cl)[C@H](OC)C1	ZINC001082250893	1357993094	/nfs/dbraw/zinc/99/30/94/1357993094.db2.gz	GKVJVZZWMKYDBK-HZPDHXFCSA-N	0	3	336.863	3.044	20	30		EGEDHN
C[C@H](C#N)C(=O)N1C[C@@H](C)[C@H](NC2c3ccccc3-c3ccccc32)C1	ZINC001082451065	1358039375	/nfs/dbraw/zinc/03/93/75/1358039375.db2.gz	OZYGUKPGWRNLDQ-STXHMFSFSA-N	0	3	345.446	3.353	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001082722128	1358079992	/nfs/dbraw/zinc/07/99/92/1358079992.db2.gz	ZAYVWAVMDXSWGP-MZMPZRCHSA-N	0	3	331.485	3.159	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2ccccc2CC(C)(C)C)[C@@H](O)C1	ZINC001083553558	1358133980	/nfs/dbraw/zinc/13/39/80/1358133980.db2.gz	KIKBPRNPJMTAGR-MOPGFXCFSA-N	0	3	344.499	3.016	20	30		EGEDHN
C=CCn1cccc1C(=O)N1C[C@H]2CCN(CCc3ccccc3)C[C@H]21	ZINC001084408425	1358209041	/nfs/dbraw/zinc/20/90/41/1358209041.db2.gz	IFRIWCVYSJAXQI-TZIWHRDSSA-N	0	3	349.478	3.063	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)CCn3ccc4ccccc43)[C@@H]2C1	ZINC001084820235	1358320456	/nfs/dbraw/zinc/32/04/56/1358320456.db2.gz	MMNCWRVEMPTKIX-UYAOXDASSA-N	0	3	337.467	3.140	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)C[C@H](C)c3cccc(OC)c3)[C@@H]2C1	ZINC001084860967	1358333120	/nfs/dbraw/zinc/33/31/20/1358333120.db2.gz	OWFYUDDMQZVCCT-ILZDJORESA-N	0	3	342.483	3.298	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C[C@@H](C)c3cccc(F)c3)C[C@@H]21	ZINC001085028581	1358371487	/nfs/dbraw/zinc/37/14/87/1358371487.db2.gz	VAUBXKHPHFYTNH-HLIPFELVSA-N	0	3	342.458	3.265	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCCC[C@H]2NC(=O)CC2CCC2)c(F)c1	ZINC001085160328	1358416198	/nfs/dbraw/zinc/41/61/98/1358416198.db2.gz	BQELQHCZBYQADY-RTBURBONSA-N	0	3	343.446	3.405	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)C[C@H]1Cc2ccccc2O1	ZINC001085208758	1358434546	/nfs/dbraw/zinc/43/45/46/1358434546.db2.gz	HLVTXQJMCVCKBK-BRWVUGGUSA-N	0	3	348.874	3.150	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1c(F)cc(F)cc1F	ZINC001085316387	1358463786	/nfs/dbraw/zinc/46/37/86/1358463786.db2.gz	FTOLJHKPELONRE-ZIAGYGMSSA-N	0	3	346.780	3.487	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N[C@@H]1CCCC[C@H]1NCc1cc(C#N)ccc1F	ZINC001085337486	1358470850	/nfs/dbraw/zinc/47/08/50/1358470850.db2.gz	CMPKFGQMEBYLTL-YCEFEEMOSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccc2c(c1)CCN2C	ZINC001085384946	1358484683	/nfs/dbraw/zinc/48/46/83/1358484683.db2.gz	ADUHHVYUUHOEKJ-IAGOWNOFSA-N	0	3	347.890	3.062	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ncccc1Cl	ZINC001085400198	1358488873	/nfs/dbraw/zinc/48/88/73/1358488873.db2.gz	ATQBCKCMUYARBA-CHWSQXEVSA-N	0	3	328.243	3.118	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cn2c(cccc2C)n1	ZINC001085417047	1358494499	/nfs/dbraw/zinc/49/44/99/1358494499.db2.gz	DKFDNDZZEGUABM-HUUCEWRRSA-N	0	3	346.862	3.026	20	30		EGEDHN
CN(C[C@@H]1CCN1CCC1CCCCCC1)C(=O)c1ccc(C#N)[nH]1	ZINC001085553573	1358589419	/nfs/dbraw/zinc/58/94/19/1358589419.db2.gz	OZHPQYJFLFETAC-SFHVURJKSA-N	0	3	342.487	3.393	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc(-c2ccncc2)o1	ZINC001085640005	1358653551	/nfs/dbraw/zinc/65/35/51/1358653551.db2.gz	ZZBQXSANRYIQBR-KRWDZBQOSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@@H]1CCc2cc(C)ccc2O1	ZINC001085722977	1358711652	/nfs/dbraw/zinc/71/16/52/1358711652.db2.gz	KYGXNDWKPBFEQS-QUCCMNQESA-N	0	3	342.483	3.188	20	30		EGEDHN
C=C1CCC(C(=O)N(C)C[C@H]2CCN2C[C@@H](OC)C2CCCC2)CC1	ZINC001085801161	1358775847	/nfs/dbraw/zinc/77/58/47/1358775847.db2.gz	LDLIQVSPTIKFQP-WOJBJXKFSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@@H]1CCc2cccc(OC)c21	ZINC001085859563	1358826387	/nfs/dbraw/zinc/82/63/87/1358826387.db2.gz	DMXIQUILGIUINQ-QZTJIDSGSA-N	0	3	342.483	3.224	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@@H]1C[C@H]1c1ccccc1F	ZINC001085865586	1358831365	/nfs/dbraw/zinc/83/13/65/1358831365.db2.gz	IKCRCJWZCWKRAI-BPQIPLTHSA-N	0	3	330.447	3.428	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@@H]1C[C@H]1c1ccccc1F	ZINC001085865587	1358831392	/nfs/dbraw/zinc/83/13/92/1358831392.db2.gz	IKCRCJWZCWKRAI-RYQLBKOJSA-N	0	3	330.447	3.428	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cccnc1OCC(C)C	ZINC001085930044	1358886936	/nfs/dbraw/zinc/88/69/36/1358886936.db2.gz	MKBFRAFRKDMQCI-KRWDZBQOSA-N	0	3	345.487	3.229	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C[C@@H]2CCN2CCC2=CCCCC2)cn1	ZINC001085933318	1358888500	/nfs/dbraw/zinc/88/85/00/1358888500.db2.gz	WISPLJGTZFJBOX-FQEVSTJZSA-N	0	3	337.467	3.100	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@H]1Cc2cc(C)c(C)cc2O1	ZINC001085982918	1358935580	/nfs/dbraw/zinc/93/55/80/1358935580.db2.gz	UTROEGJLSQISIF-UYAOXDASSA-N	0	3	342.483	3.106	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@@H]2C[C@H]2c2sccc2C)C1	ZINC001086085087	1358991829	/nfs/dbraw/zinc/99/18/29/1358991829.db2.gz	RJKJAXDVPPESBB-LXTVHRRPSA-N	0	3	338.904	3.397	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cnc(-c3ccccc3)o2)C1	ZINC001086114210	1359000219	/nfs/dbraw/zinc/00/02/19/1359000219.db2.gz	MVJKPMMFROVDNI-OTVXOJSOSA-N	0	3	345.830	3.192	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@@H]2CCc3cc(F)ccc32)C1	ZINC001086149003	1359009127	/nfs/dbraw/zinc/00/91/27/1359009127.db2.gz	MFMSMDRJKYTSAL-ISTRZQFTSA-N	0	3	336.838	3.092	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@@H]2C[C@]2(C)c2ccccc2)C1	ZINC001086152981	1359010019	/nfs/dbraw/zinc/01/00/19/1359010019.db2.gz	SDGILEZNRYALJX-LKCYJCQHSA-N	0	3	332.875	3.201	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc(Cl)c(Cl)[nH]2)C1	ZINC001086162391	1359012254	/nfs/dbraw/zinc/01/22/54/1359012254.db2.gz	JTURMFAAYBNEHS-DTORHVGOSA-N	0	3	336.650	3.172	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)[C@@H]2C[C@H]2CC(C)C)C1	ZINC001086202576	1359025432	/nfs/dbraw/zinc/02/54/32/1359025432.db2.gz	FTKIOBUPVUWXSK-APIJFGDWSA-N	0	3	343.309	3.062	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@@H]2CCc3ccccc3C2)C1	ZINC001086210980	1359028294	/nfs/dbraw/zinc/02/82/94/1359028294.db2.gz	GYVWKHILHHVJMH-OLMNPRSZSA-N	0	3	332.875	3.028	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc(F)cc3cccnc32)C1	ZINC001086214854	1359029092	/nfs/dbraw/zinc/02/90/92/1359029092.db2.gz	PFUPUQJXQWGTTH-JNSHFYNHSA-N	0	3	347.821	3.224	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc3scnc3c2)C1	ZINC001086243856	1359039990	/nfs/dbraw/zinc/03/99/90/1359039990.db2.gz	GIWAAPLPJPKUFL-BJHJDKERSA-N	0	3	335.860	3.147	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ncsc2C(C)C)C1	ZINC001086251322	1359042426	/nfs/dbraw/zinc/04/24/26/1359042426.db2.gz	LBVWRXGTOCKGNP-TXEJJXNPSA-N	0	3	327.881	3.117	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc3c(c2)CCC=C3)C1	ZINC001086255121	1359043667	/nfs/dbraw/zinc/04/36/67/1359043667.db2.gz	KGWDUEAGADHPEV-UJKQEGAGSA-N	0	3	330.859	3.497	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2nc(C(C)(C)C)cs2)C1	ZINC001086393275	1359085406	/nfs/dbraw/zinc/08/54/06/1359085406.db2.gz	ZZMMPKCASLQNSH-HAQNSBGRSA-N	0	3	341.908	3.291	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2nsc3ccc(C)cc32)C1	ZINC001086446692	1359099517	/nfs/dbraw/zinc/09/95/17/1359099517.db2.gz	RRBGNDUQLRDXIP-JOCQHMNTSA-N	0	3	349.887	3.455	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@H]2CC[C@H](C(F)(F)F)C2)C1	ZINC001086459734	1359104431	/nfs/dbraw/zinc/10/44/31/1359104431.db2.gz	WGKKABZBUKYCCI-CYDGBPFRSA-N	0	3	338.801	3.202	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)NC[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001086468677	1359109575	/nfs/dbraw/zinc/10/95/75/1359109575.db2.gz	MARRXIDYIPVTLQ-JOCBIADPSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc3nc(C)sc3c2)C1	ZINC001086525402	1359131768	/nfs/dbraw/zinc/13/17/68/1359131768.db2.gz	RBMBZYNRPJMCPW-MQMHXKEQSA-N	0	3	349.887	3.455	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(N(C)CCC)cc2)C1	ZINC001086565998	1359149552	/nfs/dbraw/zinc/14/95/52/1359149552.db2.gz	QDNMOFRWLKLZKS-JCNLHEQBSA-N	0	3	349.906	3.383	20	30		EGEDHN
CC1(C)CC(C(=O)NC[C@H]2CC[C@@H](NCc3ccccc3C#N)C2)C1	ZINC001086688755	1359185697	/nfs/dbraw/zinc/18/56/97/1359185697.db2.gz	IWZVCBHNFYWXBA-HNAYVOBHSA-N	0	3	339.483	3.369	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cc(C(C)C)on2)C1	ZINC001086769263	1359197454	/nfs/dbraw/zinc/19/74/54/1359197454.db2.gz	ZGRSYHTVKFNLPW-QWHCGFSZSA-N	0	3	325.840	3.039	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cc4c(o3)CCCC4)C2)CC1	ZINC001086927046	1359252104	/nfs/dbraw/zinc/25/21/04/1359252104.db2.gz	QRYAMUMPPZKBKB-INIZCTEOSA-N	0	3	340.467	3.108	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)[C@H](C)c3ccco3)C2)CC1	ZINC001086942493	1359264007	/nfs/dbraw/zinc/26/40/07/1359264007.db2.gz	SUBBVXFDMXELAF-IAGOWNOFSA-N	0	3	328.456	3.109	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cccc4c3ccn4C)C2)CC1	ZINC001086947846	1359268949	/nfs/dbraw/zinc/26/89/49/1359268949.db2.gz	IQSGAIWLWNIHOC-KRWDZBQOSA-N	0	3	349.478	3.128	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H]3CC34CCCC4)C2)CC1	ZINC001086951574	1359271529	/nfs/dbraw/zinc/27/15/29/1359271529.db2.gz	JOMGEICHTBJQSW-ROUUACIJSA-N	0	3	328.500	3.293	20	30		EGEDHN
Cc1ccc(F)c(C(=O)NCC2(NCc3cccc(C#N)c3)CC2)c1	ZINC001323554294	1387386660	/nfs/dbraw/zinc/38/66/60/1387386660.db2.gz	FXOOSZDXGKTCBU-UHFFFAOYSA-N	0	3	337.398	3.058	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc(F)cc3C)C2)CC1	ZINC001086953575	1359273691	/nfs/dbraw/zinc/27/36/91/1359273691.db2.gz	MFSUTXQJCRGZOH-QGZVFWFLSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CC[C@@H](C)C[C@H]2CNCc2ccccn2)cc1	ZINC001087197204	1359318006	/nfs/dbraw/zinc/31/80/06/1359318006.db2.gz	CMAVCZUCYFZPKA-UTKZUKDTSA-N	0	3	347.462	3.093	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc(F)c3)C(C)(C)[C@@H]21	ZINC001087270193	1359342897	/nfs/dbraw/zinc/34/28/97/1359342897.db2.gz	WIRHQPJBVVVXKR-KZNAEPCWSA-N	0	3	328.431	3.068	20	30		EGEDHN
CC(C)C(=O)N[C@@H]1[C@@H]2CCCN(Cc3ccc(C#N)cc3)[C@@H]2C1(C)C	ZINC001087274230	1359347422	/nfs/dbraw/zinc/34/74/22/1359347422.db2.gz	MUAOOKGRHDOEHX-OTWHNJEPSA-N	0	3	339.483	3.319	20	30		EGEDHN
CC(C)C(=O)N[C@@H]1[C@H]2CCCN(Cc3cccc(C#N)c3)[C@H]2C1(C)C	ZINC001087273876	1359347960	/nfs/dbraw/zinc/34/79/60/1359347960.db2.gz	HKRWRLNUJULPLS-GUDVDZBRSA-N	0	3	339.483	3.319	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccsc3C)C(C)(C)[C@@H]21	ZINC001087286507	1359364743	/nfs/dbraw/zinc/36/47/43/1359364743.db2.gz	RVHCYMUGGRLRKY-BRWVUGGUSA-N	0	3	330.497	3.299	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc(F)c(C)cc3F)C(C)(C)[C@H]21	ZINC001087290476	1359369412	/nfs/dbraw/zinc/36/94/12/1359369412.db2.gz	CQDSHUQVBANAKJ-BVGQSLNGSA-N	0	3	346.421	3.125	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)Cc3ccccc3CC)C(C)(C)[C@@H]21	ZINC001087290646	1359370478	/nfs/dbraw/zinc/37/04/78/1359370478.db2.gz	GJJJQBISHWJUDI-HMXCVIKNSA-N	0	3	338.495	3.030	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc(C(C)C)on3)C(C)(C)[C@H]21	ZINC001087297449	1359379147	/nfs/dbraw/zinc/37/91/47/1359379147.db2.gz	OYECDQAXQCBIKK-JLSDUUJJSA-N	0	3	343.471	3.040	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc[nH]c3C3CC3)C(C)(C)[C@H]21	ZINC001087300539	1359383045	/nfs/dbraw/zinc/38/30/45/1359383045.db2.gz	MMKILZRXQGNIAO-NEWSRXKRSA-N	0	3	339.483	3.134	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccccc3CC)C(C)(C)[C@H]21	ZINC001087301570	1359384721	/nfs/dbraw/zinc/38/47/21/1359384721.db2.gz	FHPZJRLECOPPQT-AABGKKOBSA-N	0	3	338.495	3.491	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc4[nH]ccc43)C(C)(C)[C@@H]21	ZINC001087305205	1359390532	/nfs/dbraw/zinc/39/05/32/1359390532.db2.gz	ORRDIGRVYHSECI-MISYRCLQSA-N	0	3	349.478	3.410	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3csc(Cl)c3)C(C)(C)[C@H]21	ZINC001087306877	1359393868	/nfs/dbraw/zinc/39/38/68/1359393868.db2.gz	PXQFEMACTFLATR-SNPRPXQTSA-N	0	3	336.888	3.254	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(C(F)F)cc3)C(C)(C)[C@H]21	ZINC001087308696	1359395774	/nfs/dbraw/zinc/39/57/74/1359395774.db2.gz	UTFFKYCTJPRUOW-ZACQAIPSSA-N	0	3	346.421	3.476	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(C4CC4)s3)C(C)(C)[C@H]21	ZINC001087313204	1359401253	/nfs/dbraw/zinc/40/12/53/1359401253.db2.gz	QRDZZCJJZLMCKO-OLMNPRSZSA-N	0	3	342.508	3.478	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc4sccc4[nH]3)C(C)(C)[C@H]21	ZINC001087313304	1359401860	/nfs/dbraw/zinc/40/18/60/1359401860.db2.gz	SDGMJLRBWOXKFL-JLZZUVOBSA-N	0	3	341.480	3.081	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc2sccc2[nH]1	ZINC001087313305	1359401882	/nfs/dbraw/zinc/40/18/82/1359401882.db2.gz	SDGMJLRBWOXKFL-OAUYIBNBSA-N	0	3	341.480	3.081	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc4cnccc4c3)C(C)(C)[C@H]21	ZINC001087313658	1359402523	/nfs/dbraw/zinc/40/25/23/1359402523.db2.gz	YQFIHDJGJVEFOH-AABGKKOBSA-N	0	3	347.462	3.087	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc4c(c3)CCC=C4)C(C)(C)[C@@H]21	ZINC001087314588	1359404221	/nfs/dbraw/zinc/40/42/21/1359404221.db2.gz	NPXVUHPMPQBGBL-NJDAHSKKSA-N	0	3	348.490	3.498	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)Cc3sc(C)cc3C)C(C)(C)[C@H]21	ZINC001087315527	1359405821	/nfs/dbraw/zinc/40/58/21/1359405821.db2.gz	DHNWJUQUCBXJRR-MNEFBYGVSA-N	0	3	344.524	3.146	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc2ccccc2o1	ZINC001087315746	1359405989	/nfs/dbraw/zinc/40/59/89/1359405989.db2.gz	HPGSVXMSSNRKNQ-AYOQOUSVSA-N	0	3	336.435	3.285	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3nc(C)c(C)s3)C(C)(C)[C@@H]21	ZINC001087317598	1359409111	/nfs/dbraw/zinc/40/91/11/1359409111.db2.gz	KMGFIFBRCZUIMX-BZUAXINKSA-N	0	3	345.512	3.002	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)Cc3ccc(C)s3)C(C)(C)[C@H]21	ZINC001087318281	1359409562	/nfs/dbraw/zinc/40/95/62/1359409562.db2.gz	UVUNSLNTORDEFB-QRQLOZEOSA-N	0	3	344.524	3.228	20	30		EGEDHN
C=CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)c2cscn2)C1	ZINC001087423174	1359459697	/nfs/dbraw/zinc/45/96/97/1359459697.db2.gz	NBAVVOLWLNVWGF-IAGOWNOFSA-N	0	3	341.480	3.307	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)C2(C)CC(=C)C2)C1	ZINC001087436795	1359464382	/nfs/dbraw/zinc/46/43/82/1359464382.db2.gz	LADJZSNVWXDKEY-WOJBJXKFSA-N	0	3	336.479	3.340	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)c2ccccc2O)CCN1Cc1ccc(C#N)cc1	ZINC001087506668	1359503374	/nfs/dbraw/zinc/50/33/74/1359503374.db2.gz	HPBWYKLCFDEYCQ-RBUKOAKNSA-N	0	3	349.434	3.047	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2ccc(CCCC)cc2)[C@H]1CC	ZINC001087644692	1359568689	/nfs/dbraw/zinc/56/86/89/1359568689.db2.gz	KQVLHJKELKXLNC-VQTJNVASSA-N	0	3	326.484	3.174	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)[C@H]2C[C@H]3C[C@H]3C2)CCN1Cc1ccc(C#N)cc1	ZINC001087695195	1359595382	/nfs/dbraw/zinc/59/53/82/1359595382.db2.gz	QFBNZPNUKAHMPD-MFKWGIFDSA-N	0	3	337.467	3.073	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(CCc3csc(C)n3)[C@@H]2CC)C1	ZINC001087717571	1359608933	/nfs/dbraw/zinc/60/89/33/1359608933.db2.gz	IKFBMWFVRYEWON-DLBZAZTESA-N	0	3	347.528	3.319	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)C2(c3ccccc3F)CCC2)[C@H]1CC	ZINC001087793191	1359649342	/nfs/dbraw/zinc/64/93/42/1359649342.db2.gz	UOGOPGVFCDYPIQ-ZWKOTPCHSA-N	0	3	330.447	3.403	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2sccc2C(F)F)[C@H]1CC	ZINC001087814136	1359660610	/nfs/dbraw/zinc/66/06/10/1359660610.db2.gz	ZLYGPLLFKNKNMD-QWHCGFSZSA-N	0	3	326.412	3.292	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)Cc2coc3cc(C)ccc23)[C@H]1CC	ZINC001087820711	1359663850	/nfs/dbraw/zinc/66/38/50/1359663850.db2.gz	SJNPTFFNYSIMLX-ZWKOTPCHSA-N	0	3	326.440	3.439	20	30		EGEDHN
C/C(=C\C(=O)N1C[C@H]2CCN(Cc3ccc(C#N)cc3)C[C@H]2C1)C1CC1	ZINC001087898773	1359702196	/nfs/dbraw/zinc/70/21/96/1359702196.db2.gz	ZQEHYPYTAVRXES-RPGGZIJESA-N	0	3	349.478	3.195	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3occc3-c3ccccc3)C[C@@H]2C1	ZINC001088033721	1359729620	/nfs/dbraw/zinc/72/96/20/1359729620.db2.gz	XVIMTAULSLOTCM-MOPGFXCFSA-N	0	3	348.446	3.364	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)C(C3CCC3)C3CCC3)C[C@@H]2C1	ZINC001088083435	1359749433	/nfs/dbraw/zinc/74/94/33/1359749433.db2.gz	SRQVRSGEWFWLQZ-MOPGFXCFSA-N	0	3	328.500	3.006	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)[C@@H](CC3CCCC3)C(C)C)C[C@@H]2C1	ZINC001088128501	1359767296	/nfs/dbraw/zinc/76/72/96/1359767296.db2.gz	SLCDDTYYZAYSMG-AABGKKOBSA-N	0	3	330.516	3.252	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3cccc(C4CCC4)c3)C[C@@H]2C1	ZINC001088170435	1359779472	/nfs/dbraw/zinc/77/94/72/1359779472.db2.gz	RJNXEGPUPYRHDM-RTWAWAEBSA-N	0	3	336.479	3.371	20	30		EGEDHN
C=C(Br)CN[C@H]1CCCCCN(C(=O)CC2(C)CC2)C1	ZINC001088349159	1359835602	/nfs/dbraw/zinc/83/56/02/1359835602.db2.gz	MZIVFDGWYSBVTI-AWEZNQCLSA-N	0	3	343.309	3.446	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCCCC[C@H](NCc3ccccn3)C2)C1	ZINC001088378482	1359861863	/nfs/dbraw/zinc/86/18/63/1359861863.db2.gz	JDUKGWNOUROJRO-SFHVURJKSA-N	0	3	327.472	3.299	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)[C@@H]2C[C@H]2c2cccnc2)C1	ZINC001088387930	1359866916	/nfs/dbraw/zinc/86/69/16/1359866916.db2.gz	IKXVZALWJYUQDO-OKZBNKHCSA-N	0	3	347.890	3.298	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2cccc(N(C)C)c2)C1	ZINC001088418523	1359888898	/nfs/dbraw/zinc/88/88/98/1359888898.db2.gz	QZPIBTCJQMOGOD-KRWDZBQOSA-N	0	3	349.906	3.480	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2n[nH]c3ccccc32)C1	ZINC001088420709	1359890417	/nfs/dbraw/zinc/89/04/17/1359890417.db2.gz	WMHVYJCUVJEHKT-AWEZNQCLSA-N	0	3	346.862	3.290	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cn(C)c3ccc(F)cc23)[C@H]1C	ZINC001088627692	1359995662	/nfs/dbraw/zinc/99/56/62/1359995662.db2.gz	AMVLHHOUGGKSAA-DYVFJYSZSA-N	0	3	329.419	3.086	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)C[C@H]2CCOc3ccccc32)[C@H]1C	ZINC001088794259	1360047594	/nfs/dbraw/zinc/04/75/94/1360047594.db2.gz	UFSYFMARQNGEPY-NUJGCVRESA-N	0	3	328.456	3.098	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccc(F)c(Cl)c2F)[C@H]1C	ZINC001088837152	1360071907	/nfs/dbraw/zinc/07/19/07/1360071907.db2.gz	PYOWVCYNQIVQRI-MFKMUULPSA-N	0	3	328.790	3.387	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2cc3c(s2)CC[C@@H](C)C3)[C@H]1C	ZINC001089033340	1360143755	/nfs/dbraw/zinc/14/37/55/1360143755.db2.gz	MXWWDEJHYKKCDZ-FMKPAKJESA-N	0	3	330.497	3.089	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)C(C)(C)c2ccccc2OC)[C@H]1C	ZINC001089078104	1360161788	/nfs/dbraw/zinc/16/17/88/1360161788.db2.gz	OATMEFIQRZKYTJ-WBVHZDCISA-N	0	3	330.472	3.128	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCCC[C@H]1CN(C)Cc1cccc(C#N)c1	ZINC001089122872	1360185909	/nfs/dbraw/zinc/18/59/09/1360185909.db2.gz	FUXGIZHWODPTLG-APWZRJJASA-N	0	3	327.472	3.417	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCCN1C(=O)/C=C\C1CC1	ZINC001089145116	1360199796	/nfs/dbraw/zinc/19/97/96/1360199796.db2.gz	KOKXXKGPQZKZLT-PISNEZEASA-N	0	3	337.467	3.337	20	30		EGEDHN
Cc1ccc(F)cc1CN(C)C[C@@H]1CCCCN1C(=O)C#CC1CC1	ZINC001089175510	1360229024	/nfs/dbraw/zinc/22/90/24/1360229024.db2.gz	VTSAKPOQCXRWIX-FQEVSTJZSA-N	0	3	342.458	3.360	20	30		EGEDHN
C=C1CCC(C(=O)N2CCc3sc(CNCC4CC4)nc3C2)CC1	ZINC001089278926	1360298850	/nfs/dbraw/zinc/29/88/50/1360298850.db2.gz	WWMWFLMRGLVNPM-UHFFFAOYSA-N	0	3	345.512	3.274	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCc3sc(CNCC4CCC4)nc3C2)C1	ZINC001089280605	1360299373	/nfs/dbraw/zinc/29/93/73/1360299373.db2.gz	MGLJVXLERSFCTJ-UHFFFAOYSA-N	0	3	345.512	3.274	20	30		EGEDHN
C#CC1CCN(C(=O)[C@H]2CCCN(Cc3ccc(Cl)cc3)C2)CC1	ZINC001184400993	1387448609	/nfs/dbraw/zinc/44/86/09/1387448609.db2.gz	DWEZWBITVSCXIX-SFHVURJKSA-N	0	3	344.886	3.424	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2ccc3cnccc3c2)CC(C)(C)C1	ZINC001089438995	1360429158	/nfs/dbraw/zinc/42/91/58/1360429158.db2.gz	NUDSUOSLGKBHTG-FQEVSTJZSA-N	0	3	349.478	3.017	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@@H](c2ccccc2)C2CC2)CC(C)(C)C1	ZINC001089439816	1360429592	/nfs/dbraw/zinc/42/95/92/1360429592.db2.gz	UHQVTIIZMGICSO-UXHICEINSA-N	0	3	338.495	3.420	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cccc3ncccc32)CC(C)(C)C1	ZINC001089453782	1360440691	/nfs/dbraw/zinc/44/06/91/1360440691.db2.gz	PQJLZNJIWDJWNW-MRXNPFEDSA-N	0	3	335.451	3.088	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C(C)(C)c2cccs2)CC(C)(C)C1	ZINC001089459582	1360445828	/nfs/dbraw/zinc/44/58/28/1360445828.db2.gz	XPEQKDFLJJCDEW-OAHLLOKOSA-N	0	3	332.513	3.266	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc3ncccc3s2)CC(C)(C)C1	ZINC001089459360	1360445875	/nfs/dbraw/zinc/44/58/75/1360445875.db2.gz	URDIPKIROFGJDS-AWEZNQCLSA-N	0	3	341.480	3.150	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C(C2CCC2)C2CCC2)CC(C)(C)C1	ZINC001089472625	1360455995	/nfs/dbraw/zinc/45/59/95/1360455995.db2.gz	LFIQDLSMSMKWQW-GOSISDBHSA-N	0	3	330.516	3.443	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CCN(C/C=C\Cl)CC(C)(C)C2)c1	ZINC001089488531	1360468049	/nfs/dbraw/zinc/46/80/49/1360468049.db2.gz	VOGRRLGQKXPBBQ-WVRJYTFGSA-N	0	3	345.874	3.036	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(C)s2)CC(C)(C)C1	ZINC001089510951	1360482140	/nfs/dbraw/zinc/48/21/40/1360482140.db2.gz	IQTXNTMKTNBKAD-GVDBMIGSSA-N	0	3	344.524	3.400	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc([C@H](C)CC)no2)CC(C)(C)C1	ZINC001089512053	1360483332	/nfs/dbraw/zinc/48/33/32/1360483332.db2.gz	YQWOLYBACSCGRL-HUUCEWRRSA-N	0	3	331.460	3.042	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C[C@H]2CCc3ccccc32)CC(C)(C)C1	ZINC001089523765	1360489192	/nfs/dbraw/zinc/48/91/92/1360489192.db2.gz	HBNGJWIRNBHUQL-MOPGFXCFSA-N	0	3	338.495	3.347	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C(C)(C)c2ccc(F)cc2)CC(C)(C)C1	ZINC001089539027	1360496478	/nfs/dbraw/zinc/49/64/78/1360496478.db2.gz	IHVNJOGYWPPXRO-GOSISDBHSA-N	0	3	344.474	3.343	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccccc2OC(C)C)CC(C)(C)C1	ZINC001089540357	1360498314	/nfs/dbraw/zinc/49/83/14/1360498314.db2.gz	ULEPBRPFPSBWKL-QGZVFWFLSA-N	0	3	342.483	3.327	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(C[C@@H](F)CC)CC(C)(C)C2)cn1	ZINC001089544505	1360500253	/nfs/dbraw/zinc/50/02/53/1360500253.db2.gz	UHGDQHGTRIJVQP-WMZOPIPTSA-N	0	3	345.462	3.031	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3[nH]ccc3s2)CC(C)(C)C1	ZINC001089544955	1360500833	/nfs/dbraw/zinc/50/08/33/1360500833.db2.gz	DDPOXBHMNXDUEJ-CQSZACIVSA-N	0	3	343.496	3.473	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3[nH]ccc3s2)CC(C)(C)C1	ZINC001089544954	1360500897	/nfs/dbraw/zinc/50/08/97/1360500897.db2.gz	DDPOXBHMNXDUEJ-AWEZNQCLSA-N	0	3	343.496	3.473	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2coc3ccc(F)cc23)CC(C)(C)C1	ZINC001089549382	1360502679	/nfs/dbraw/zinc/50/26/79/1360502679.db2.gz	XNGDUCCFFGHJGR-HNNXBMFYSA-N	0	3	342.414	3.426	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(C3CC3)cn2)CC(C)(C)C1	ZINC001089551922	1360503384	/nfs/dbraw/zinc/50/33/84/1360503384.db2.gz	LJJXBDYKOANESO-GOSISDBHSA-N	0	3	339.483	3.203	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(OC)c(Cl)c2)CC(C)(C)C1	ZINC001089552306	1360503487	/nfs/dbraw/zinc/50/34/87/1360503487.db2.gz	AJSZATXXBGSFFZ-OAHLLOKOSA-N	0	3	348.874	3.202	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc(Cl)ccc2OC)CC(C)(C)C1	ZINC001089555869	1360505503	/nfs/dbraw/zinc/50/55/03/1360505503.db2.gz	NEKIPJITPFMQDT-OAHLLOKOSA-N	0	3	348.874	3.202	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2sccc2C2CC2)CC(C)(C)C1	ZINC001089556946	1360506644	/nfs/dbraw/zinc/50/66/44/1360506644.db2.gz	VLJCZKFVRLDNCB-HNNXBMFYSA-N	0	3	330.497	3.479	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@H](C)c2cccc(F)c2)CC(C)(C)C1	ZINC001089560257	1360508499	/nfs/dbraw/zinc/50/84/99/1360508499.db2.gz	AJAVUZVCYZVUJX-QAPCUYQASA-N	0	3	330.447	3.169	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1cnn2ccc(C)cc12	ZINC001089652691	1360566143	/nfs/dbraw/zinc/56/61/43/1360566143.db2.gz	JRXREWYWZHRCHI-INIZCTEOSA-N	0	3	340.471	3.049	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccnc(CCC)c1	ZINC001089653865	1360566994	/nfs/dbraw/zinc/56/69/94/1360566994.db2.gz	CVLAGFIEOBXYNN-LJQANCHMSA-N	0	3	341.499	3.278	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc2c[nH]ccc-2n1	ZINC001089657241	1360569296	/nfs/dbraw/zinc/56/92/96/1360569296.db2.gz	BNKQOVUOHZCPSO-MRXNPFEDSA-N	0	3	340.471	3.359	20	30		EGEDHN
C=CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1nc2c(s1)CCC2	ZINC001089669612	1360579161	/nfs/dbraw/zinc/57/91/61/1360579161.db2.gz	PIUOQQWQXALYLB-CQSZACIVSA-N	0	3	347.528	3.428	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1coc(C(F)F)c1	ZINC001089687298	1360593805	/nfs/dbraw/zinc/59/38/05/1360593805.db2.gz	HXOIRXQCYSXKCQ-AWEZNQCLSA-N	0	3	338.398	3.461	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ccn(C(C)C)n1	ZINC001089706361	1360609159	/nfs/dbraw/zinc/60/91/59/1360609159.db2.gz	RLZUFHYWJYSMQQ-INIZCTEOSA-N	0	3	332.492	3.261	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc([C@H](C)CC)no1	ZINC001089707781	1360611794	/nfs/dbraw/zinc/61/17/94/1360611794.db2.gz	SZRZVFGECXPLTF-HZPDHXFCSA-N	0	3	345.487	3.432	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H]1CCOc2ccccc21	ZINC001089710127	1360613949	/nfs/dbraw/zinc/61/39/49/1360613949.db2.gz	BOTLREVSHVXKTF-AEFFLSMTSA-N	0	3	342.483	3.346	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1occ2c1CCCC2	ZINC001089723724	1360627090	/nfs/dbraw/zinc/62/70/90/1360627090.db2.gz	OAXCBTWVQUWSCD-QGZVFWFLSA-N	0	3	342.483	3.402	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCC(C)(C)CN2CC=C(C)C)cn1	ZINC001089726120	1360629251	/nfs/dbraw/zinc/62/92/51/1360629251.db2.gz	NESOKCRFZLOILV-LJQANCHMSA-N	0	3	339.483	3.250	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1c(F)cccc1F	ZINC001089726583	1360630202	/nfs/dbraw/zinc/63/02/02/1360630202.db2.gz	OKQVRWXBGWHCFX-CQSZACIVSA-N	0	3	334.410	3.209	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc2ccccc2n1	ZINC001089727258	1360630979	/nfs/dbraw/zinc/63/09/79/1360630979.db2.gz	XBDBQWZZANRKPZ-SFHVURJKSA-N	0	3	349.478	3.479	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1ccc(C)o1	ZINC001089767642	1360657019	/nfs/dbraw/zinc/65/70/19/1360657019.db2.gz	XXSKNZSPKPSLLX-JONQDZQNSA-N	0	3	334.847	3.123	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1ccc(CC)o1	ZINC001089826675	1360682700	/nfs/dbraw/zinc/68/27/00/1360682700.db2.gz	JUFZTTWATXDKQX-SVGFKBNWSA-N	0	3	348.874	3.377	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccccc2F)CC2(CCOCC2)C1	ZINC001089918852	1360744407	/nfs/dbraw/zinc/74/44/07/1360744407.db2.gz	YOYDYKHBLNMWQJ-MRXNPFEDSA-N	0	3	346.446	3.003	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CC2CC(C)(C)C2)CC2(CCOCC2)C1	ZINC001089952609	1360761791	/nfs/dbraw/zinc/76/17/91/1360761791.db2.gz	KTEGIEVJDQQKDP-GOSISDBHSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)[C@H]2CCCC(C)(C)C2)CC2(CCOCC2)C1	ZINC001089969397	1360772645	/nfs/dbraw/zinc/77/26/45/1360772645.db2.gz	KPIGZKWTWRTOIW-ROUUACIJSA-N	0	3	348.531	3.376	20	30		EGEDHN
CCN(CC)CC(=O)N[C@H](C)CCCCNc1cccc(F)c1C#N	ZINC001090093669	1360821760	/nfs/dbraw/zinc/82/17/60/1360821760.db2.gz	OJOMBUFGXWKBJW-OAHLLOKOSA-N	0	3	348.466	3.126	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](CNCc2ccn(C(C)C)n2)[C@@H](C)C1	ZINC001184509955	1387478320	/nfs/dbraw/zinc/47/83/20/1387478320.db2.gz	BQZMCRPFWPONKW-ZWKOTPCHSA-N	0	3	346.519	3.395	20	30		EGEDHN
C=C(C)CN1CC[C@@H](NC(=O)c2cccc(C3CCCC3)c2)[C@@H](O)C1	ZINC001090722794	1360928696	/nfs/dbraw/zinc/92/86/96/1360928696.db2.gz	PYUBBBWWXCRFSB-UXHICEINSA-N	0	3	342.483	3.085	20	30		EGEDHN
N#Cc1ccc(F)c(CNC2CC(CNC(=O)C3CCCCC3)C2)c1	ZINC001090906092	1360950403	/nfs/dbraw/zinc/95/04/03/1360950403.db2.gz	WPDVLYVVOYXBMS-UHFFFAOYSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C1CCC(C(=O)NCC2CC(NCc3oc(C)nc3C)C2)CC1	ZINC001091215427	1361010123	/nfs/dbraw/zinc/01/01/23/1361010123.db2.gz	DAGSDURGUFXKMC-UHFFFAOYSA-N	0	3	331.460	3.022	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(C(F)F)cc2)C1	ZINC001091283285	1361031066	/nfs/dbraw/zinc/03/10/66/1361031066.db2.gz	BTQVCABPXJASSQ-UHFFFAOYSA-N	0	3	328.790	3.475	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc3ccn(C)c3c2)C1	ZINC001091312820	1361040276	/nfs/dbraw/zinc/04/02/76/1361040276.db2.gz	LQIOLPTULCOFMW-UHFFFAOYSA-N	0	3	331.847	3.029	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc3c(c2)CCC=C3)C1	ZINC001091327914	1361045668	/nfs/dbraw/zinc/04/56/68/1361045668.db2.gz	KGWDUEAGADHPEV-UHFFFAOYSA-N	0	3	330.859	3.497	20	30		EGEDHN
C/C(=C\C(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@@]2(C)C1)C1CC1	ZINC001091508269	1361130118	/nfs/dbraw/zinc/13/01/18/1361130118.db2.gz	UBPPGBLOTGKTHG-ZKIUVXPISA-N	0	3	349.478	3.195	20	30		EGEDHN
C/C(=C\C(=O)N1C[C@H]2CN(Cc3ccc(C#N)cc3)C[C@@]2(C)C1)C1CC1	ZINC001091509364	1361130937	/nfs/dbraw/zinc/13/09/37/1361130937.db2.gz	QROKUFATRJQONT-IFGDTPHKSA-N	0	3	349.478	3.195	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CN(CCC(F)(F)F)C[C@@]2(C)C1	ZINC001091910166	1361243229	/nfs/dbraw/zinc/24/32/29/1361243229.db2.gz	KOVDLDWBEBOYAS-CJNGLKHVSA-N	0	3	332.410	3.321	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc(C4CC4)s3)C[C@]2(C)C1	ZINC001092198811	1361320472	/nfs/dbraw/zinc/32/04/72/1361320472.db2.gz	ZDIRPBLKIGQPLU-BEFAXECRSA-N	0	3	328.481	3.043	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@@]2(C)CC=CCC2)CC1	ZINC001093369690	1361578442	/nfs/dbraw/zinc/57/84/42/1361578442.db2.gz	JIURKHGGUIJOAT-FPOVZHCZSA-N	0	3	340.511	3.459	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C2(C(C)C)CC2)CC1	ZINC001093378121	1361589135	/nfs/dbraw/zinc/58/91/35/1361589135.db2.gz	JWKYKUVJKNDBKW-SFHVURJKSA-N	0	3	328.500	3.149	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3ccc(Cl)c(C)c3)CCC[C@@H]12	ZINC001094501272	1361832660	/nfs/dbraw/zinc/83/26/60/1361832660.db2.gz	AMVGZOZIYSTBJO-IEBWSBKVSA-N	0	3	330.859	3.256	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3ccsc3C(F)F)CCC[C@@H]12	ZINC001094572765	1361865291	/nfs/dbraw/zinc/86/52/91/1361865291.db2.gz	XZYUUCGUFCIUQI-CXAGYDPISA-N	0	3	338.423	3.293	20	30		EGEDHN
O=C(C1CCCCC1)N1CCC[C@@H]1CNCC#Cc1ccc(F)cc1	ZINC001324102036	1387543049	/nfs/dbraw/zinc/54/30/49/1387543049.db2.gz	KMNJKJIMOXYPJJ-HXUWFJFHSA-N	0	3	342.458	3.338	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H]1C[C@H]1c1sccc1C)C2	ZINC001095408323	1362130980	/nfs/dbraw/zinc/13/09/80/1362130980.db2.gz	NWVBNLPTCYECGK-MTSZKFMLSA-N	0	3	330.497	3.458	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(F)c(C(F)F)c1)C2	ZINC001095426204	1362136561	/nfs/dbraw/zinc/13/65/61/1362136561.db2.gz	PKDBZBCTODXZHP-KCXAZCMYSA-N	0	3	336.357	3.122	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](C)c1c(F)cccc1F)C2	ZINC001095765452	1362223744	/nfs/dbraw/zinc/22/37/44/1362223744.db2.gz	DUABMLACDFFVFJ-RMHZUWNSSA-N	0	3	334.410	3.366	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3CCc2ccccc2)cc1	ZINC001095854291	1362256535	/nfs/dbraw/zinc/25/65/35/1362256535.db2.gz	VINMUEGFXQKABD-FSSWDIPSSA-N	0	3	344.458	3.246	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](C)c1ccc(Cl)cc1)C2	ZINC001095961414	1362310135	/nfs/dbraw/zinc/31/01/35/1362310135.db2.gz	HMPJXLJCVWWDRK-NBMRYCAZSA-N	0	3	330.859	3.188	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc(C(C)(C)C)oc1C)C2	ZINC001096076468	1362371346	/nfs/dbraw/zinc/37/13/46/1362371346.db2.gz	ZVPXRSVOFVBNGN-PVAVHDDUSA-N	0	3	328.456	3.244	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](CNCc2csc(C)n2)[C@H](C)C1	ZINC001184967824	1387575550	/nfs/dbraw/zinc/57/55/50/1387575550.db2.gz	MBJSWJRDWSOEDF-NVXWUHKLSA-N	0	3	347.528	3.219	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](CNCc2oc(C)nc2C)[C@@H](C)C1	ZINC001184967117	1387575894	/nfs/dbraw/zinc/57/58/94/1387575894.db2.gz	HTTSHKPXKIXTOY-MAUKXSAKSA-N	0	3	345.487	3.059	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1cccc3ccccc31)C2	ZINC001096406580	1362494173	/nfs/dbraw/zinc/49/41/73/1362494173.db2.gz	UDKPNAHBKFLWSV-GIVPXCGWSA-N	0	3	332.447	3.127	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(OC(C)C)cc1)C2	ZINC001096481409	1362530485	/nfs/dbraw/zinc/53/04/85/1362530485.db2.gz	YNJQKVVSJGOXME-NEWSRXKRSA-N	0	3	328.456	3.385	20	30		EGEDHN
CCC[C@H](C)C(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1	ZINC001324301767	1387588457	/nfs/dbraw/zinc/58/84/57/1387588457.db2.gz	PVVNMUTYOLDGLR-INIZCTEOSA-N	0	3	327.472	3.465	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](NCc2ccc(Cl)c(F)c2)C1	ZINC001185019302	1387590139	/nfs/dbraw/zinc/59/01/39/1387590139.db2.gz	FMMNEYJWFVKQRM-OAHLLOKOSA-N	0	3	336.838	3.363	20	30		EGEDHN
Cc1cc(C)cc(CN2[C@@H]3CC[C@H]2[C@H](NC(=O)c2c[nH]c(C#N)c2)C3)c1	ZINC001096972242	1362799010	/nfs/dbraw/zinc/79/90/10/1362799010.db2.gz	JIEAMAVIXUAIBI-AQNXPRMDSA-N	0	3	348.450	3.039	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](CNCc2oc(CC)nc2C)[C@H](C)C1	ZINC001185061764	1387604400	/nfs/dbraw/zinc/60/44/00/1387604400.db2.gz	PLBPKIKPSYSZOR-NVXWUHKLSA-N	0	3	347.503	3.476	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H]1COc3ccc(Cl)cc31)C2	ZINC001097544504	1363052708	/nfs/dbraw/zinc/05/27/08/1363052708.db2.gz	ALZROVVHGYGUGB-XBVQOTNRSA-N	0	3	346.858	3.114	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H]1CCc3c1cccc3Cl)C2	ZINC001097554639	1363054457	/nfs/dbraw/zinc/05/44/57/1363054457.db2.gz	OOQZGELZUAUBBQ-AZFSHXRASA-N	0	3	342.870	3.115	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc([C@H](C)CC)no1)C2	ZINC001097997422	1363192676	/nfs/dbraw/zinc/19/26/76/1363192676.db2.gz	BWYUMDHAQMPRPK-SRABZTEZSA-N	0	3	331.460	3.489	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1cccc3ccccc31)C2	ZINC001098264572	1363278790	/nfs/dbraw/zinc/27/87/90/1363278790.db2.gz	UDKPNAHBKFLWSV-NRSPTQNISA-N	0	3	332.447	3.127	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(N(CC)CC)cc1)C2	ZINC001098274919	1363281276	/nfs/dbraw/zinc/28/12/76/1363281276.db2.gz	FDCCJKLWRBJXTD-AQNXPRMDSA-N	0	3	341.499	3.444	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H]1CCC=CCCC1)C[C@@H](C)O2	ZINC001098606360	1363396524	/nfs/dbraw/zinc/39/65/24/1363396524.db2.gz	QOHSUBJMSLRZFL-RTBURBONSA-N	0	3	346.515	3.391	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H]1CC[C@@H]3C[C@@H]3CC1)C[C@H](C)O2	ZINC001098616367	1363400513	/nfs/dbraw/zinc/40/05/13/1363400513.db2.gz	JQLNRVTYZVOYGI-CADBVGFASA-N	0	3	346.515	3.081	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1CC[C@H](C)CC1)C[C@H](C)O2	ZINC001098654657	1363420102	/nfs/dbraw/zinc/42/01/02/1363420102.db2.gz	DRQVDYVDTHXIIZ-BZSNNMDCSA-N	0	3	334.504	3.081	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CCC[C@]3(NC(=O)C[C@@H]3C=CCC3)C2)c1	ZINC001098721076	1363449219	/nfs/dbraw/zinc/44/92/19/1363449219.db2.gz	ZVGJUDVOLVIKLM-AGHHOFFYSA-N	0	3	349.478	3.385	20	30		EGEDHN
CCCCCCCNCc1cn([C@@H]2CCN(C(=O)C(C)(C)C)C2)nn1	ZINC001098773538	1363463180	/nfs/dbraw/zinc/46/31/80/1363463180.db2.gz	DZCNGDHBIZGARJ-QGZVFWFLSA-N	0	3	349.523	3.158	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)C[C@H]1C=CCC1	ZINC001098890346	1363507197	/nfs/dbraw/zinc/50/71/97/1363507197.db2.gz	YDLGYJMONXWIBW-ZWKOTPCHSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1occc1C	ZINC001098895178	1363509007	/nfs/dbraw/zinc/50/90/07/1363509007.db2.gz	QWLWUAHWLDKJPY-MRXNPFEDSA-N	0	3	334.460	3.011	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc3c([nH]2)c(F)ccc3C)C1	ZINC001098912552	1363518230	/nfs/dbraw/zinc/51/82/30/1363518230.db2.gz	CHMUBVXEFAUJHC-XOBRGWDASA-N	0	3	341.430	3.386	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)Cc2cccc(C(C)C)c2)C1	ZINC001098920238	1363520801	/nfs/dbraw/zinc/52/08/01/1363520801.db2.gz	JBGVDAMDFBGPIZ-UNMCSNQZSA-N	0	3	338.495	3.347	20	30		EGEDHN
C#CCCCC(=O)NC[C@H]1CCC(C)(C)CN1CCOCC1CCC1	ZINC001099042823	1363589496	/nfs/dbraw/zinc/58/94/96/1363589496.db2.gz	CFAGXMQSFKYVET-LJQANCHMSA-N	0	3	348.531	3.213	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)C1(COC)CCCCC1	ZINC001099102446	1363623587	/nfs/dbraw/zinc/62/35/87/1363623587.db2.gz	MCFPLTKPENMKAJ-SFHVURJKSA-N	0	3	348.531	3.213	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(-c3ccccc3)[nH]2)C1	ZINC001099182668	1363678275	/nfs/dbraw/zinc/67/82/75/1363678275.db2.gz	NETJVNIZXKXURV-AVRDEDQJSA-N	0	3	347.462	3.289	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@@H]1CCC(C)(C)CN1CCn1cccn1	ZINC001099187991	1363679726	/nfs/dbraw/zinc/67/97/26/1363679726.db2.gz	AQBJJTNJTGIGPR-ROUUACIJSA-N	0	3	346.519	3.092	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(CC)c(CC)c2)C1	ZINC001099192112	1363684877	/nfs/dbraw/zinc/68/48/77/1363684877.db2.gz	PQUNRFSVZFASMW-UNMCSNQZSA-N	0	3	338.495	3.419	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)Cc1cc(F)ccc1F	ZINC001099199739	1363688688	/nfs/dbraw/zinc/68/86/88/1363688688.db2.gz	QECXLFLUTSTLMW-MRXNPFEDSA-N	0	3	336.426	3.300	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@@H]1CCC(C)(C)CN1CCn1cccn1	ZINC001099215654	1363696408	/nfs/dbraw/zinc/69/64/08/1363696408.db2.gz	YGZLGYTZGGMZSF-FXAWDEMLSA-N	0	3	346.519	3.092	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)Cc1ccncc1Cl	ZINC001099239127	1363708670	/nfs/dbraw/zinc/70/86/70/1363708670.db2.gz	AINULPSWXQCVAE-HNNXBMFYSA-N	0	3	335.879	3.070	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)CCCn1nc(C)cc1C	ZINC001099251140	1363713852	/nfs/dbraw/zinc/71/38/52/1363713852.db2.gz	GDXURLMXLDINIK-GOSISDBHSA-N	0	3	346.519	3.073	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H](CC)OC1CCCC1	ZINC001099251455	1363714013	/nfs/dbraw/zinc/71/40/13/1363714013.db2.gz	JZXIXOYPEVZJQU-IEBWSBKVSA-N	0	3	348.531	3.354	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2ccc3occc3c2)C[C@H]1C(F)(F)F	ZINC001099256626	1363716847	/nfs/dbraw/zinc/71/68/47/1363716847.db2.gz	HNQGXSJQDDPSCV-ZIAGYGMSSA-N	0	3	338.329	3.211	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2cc(F)ccc2C)C[C@H]1C(F)(F)F	ZINC001099288084	1363733979	/nfs/dbraw/zinc/73/39/79/1363733979.db2.gz	FITPSNNRXAEGHM-HUUCEWRRSA-N	0	3	344.352	3.303	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H]1CC12CCCC2	ZINC001099299722	1363737687	/nfs/dbraw/zinc/73/76/87/1363737687.db2.gz	VGNWIEQEXYEIJG-QZTJIDSGSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@H](C)Cc2cccs2)C[C@H]1C(F)(F)F	ZINC001099317283	1363746381	/nfs/dbraw/zinc/74/63/81/1363746381.db2.gz	XFQLKOOIXPYQKE-MRVWCRGKSA-N	0	3	346.418	3.092	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H](OC)C1CCCC1	ZINC001099323864	1363750176	/nfs/dbraw/zinc/75/01/76/1363750176.db2.gz	CAQMKSHRBQTEIS-ROUUACIJSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H](OC)C1CCCC1	ZINC001099323862	1363750253	/nfs/dbraw/zinc/75/02/53/1363750253.db2.gz	CAQMKSHRBQTEIS-MSOLQXFVSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)C[C@@H]1OCc2ccccc21	ZINC001099321527	1363750494	/nfs/dbraw/zinc/75/04/94/1363750494.db2.gz	YETOTNXQZALHHH-MJGOQNOKSA-N	0	3	342.483	3.441	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@@H](C)C2CCCC2)C[C@H]1C(F)(F)F	ZINC001099331132	1363754674	/nfs/dbraw/zinc/75/46/74/1363754674.db2.gz	BMDIUIWTFVUXNS-NWANDNLSSA-N	0	3	332.410	3.368	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2c(C)cc(C)cc2C)C[C@H]1C(F)(F)F	ZINC001099339729	1363759644	/nfs/dbraw/zinc/75/96/44/1363759644.db2.gz	FTNCQEKNXVLIDR-HUUCEWRRSA-N	0	3	340.389	3.390	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H](C)n1c(C)ccc1C	ZINC001099354278	1363768652	/nfs/dbraw/zinc/76/86/52/1363768652.db2.gz	QCRPVQQPBMTXAA-RBUKOAKNSA-N	0	3	343.515	3.296	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H](OC)c1ccc(F)cc1	ZINC001099357925	1363770567	/nfs/dbraw/zinc/77/05/67/1363770567.db2.gz	BTFSYXURNPAHLC-MSOLQXFVSA-N	0	3	348.462	3.306	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H](C)C1CCOCC1	ZINC001099379261	1363780926	/nfs/dbraw/zinc/78/09/26/1363780926.db2.gz	ILYQTJYMARWMCM-SJLPKXTDSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H]3CCC[C@]3(CNCc3nccs3)C2)C1	ZINC001099492876	1363818959	/nfs/dbraw/zinc/81/89/59/1363818959.db2.gz	CAVJUGGGMPGAAJ-KXBFYZLASA-N	0	3	345.512	3.218	20	30		EGEDHN
CC(C)(C)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2ccccc2C#N)C1	ZINC001099531048	1363835516	/nfs/dbraw/zinc/83/55/16/1363835516.db2.gz	PWASYEFUEVXUTA-RXVVDRJESA-N	0	3	339.483	3.323	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCC2CCCC2)CC2(CCOCC2)C1	ZINC001099559733	1363848557	/nfs/dbraw/zinc/84/85/57/1363848557.db2.gz	HBWZJPLAKDWPRZ-GOSISDBHSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C(C)(C)C(=C)C)CC2(CCOCC2)C1	ZINC001099586681	1363868085	/nfs/dbraw/zinc/86/80/85/1363868085.db2.gz	FNESBPAKPPUBBW-KRWDZBQOSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2CN(CC(=C)C)CC3(CCOCC3)C2)CCC1	ZINC001099589071	1363871278	/nfs/dbraw/zinc/87/12/78/1363871278.db2.gz	OYCQECOWRQWQDD-GOSISDBHSA-N	0	3	346.515	3.296	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@H]1CN(CC(=C)C)CC2(CCOCC2)C1	ZINC001099590844	1363872538	/nfs/dbraw/zinc/87/25/38/1363872538.db2.gz	MCHPEXHTYUCYKI-IEBWSBKVSA-N	0	3	334.504	3.152	20	30		EGEDHN
C#CCCN1CC[C@@H](NC(=O)CCCCCCCCCC)[C@@H](O)C1	ZINC001100082360	1364011345	/nfs/dbraw/zinc/01/13/45/1364011345.db2.gz	AQOWHNMRKCQLAF-MOPGFXCFSA-N	0	3	336.520	3.092	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](CNCc2cnc(C)o2)[C@H](C)C1	ZINC001185226505	1387656608	/nfs/dbraw/zinc/65/66/08/1387656608.db2.gz	PPLKTIDOJUUEBO-GDBMZVCRSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](CNCc2nccn2CC)[C@@H](C)C1	ZINC001185227182	1387656788	/nfs/dbraw/zinc/65/67/88/1387656788.db2.gz	VDQPSENVQXHVQG-IRXDYDNUSA-N	0	3	346.519	3.080	20	30		EGEDHN
C#CCCCC(=O)NCC1CC(NCc2ccc(C)cc2Cl)C1	ZINC001100283779	1364067077	/nfs/dbraw/zinc/06/70/77/1364067077.db2.gz	VYFULNSXICFDIC-UHFFFAOYSA-N	0	3	332.875	3.436	20	30		EGEDHN
CC(C)C#CC(=O)NCC1CC(N[C@H]2CCc3c2c(F)ccc3F)C1	ZINC001100309138	1364076188	/nfs/dbraw/zinc/07/61/88/1364076188.db2.gz	JEQORNVBPFICPB-JRSKDTKFSA-N	0	3	346.421	3.096	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCC1CC(NCc2cc(C)ns2)C1	ZINC001100359663	1364090825	/nfs/dbraw/zinc/09/08/25/1364090825.db2.gz	HXKXOSIVUANRPQ-UHFFFAOYSA-N	0	3	333.501	3.204	20	30		EGEDHN
CC[C@@H](CC(F)F)C(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100398003	1364102369	/nfs/dbraw/zinc/10/23/69/1364102369.db2.gz	QKEHJTXMSGDQNV-ADKAHSJRSA-N	0	3	348.437	3.204	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C/C=C/c2ccccc2F)C1	ZINC001100441487	1364116467	/nfs/dbraw/zinc/11/64/67/1364116467.db2.gz	SEKUXJLDGOMANT-GQCTYLIASA-N	0	3	336.838	3.466	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NCC1CC(NCc2ccccc2F)C1	ZINC001100540729	1364152519	/nfs/dbraw/zinc/15/25/19/1364152519.db2.gz	RSMNDIJEONOUIP-LAGYLCCXSA-N	0	3	348.462	3.039	20	30		EGEDHN
C=C1CCC(C(=O)NCC2CC(NCC#Cc3ccccc3)C2)CC1	ZINC001100639113	1364200067	/nfs/dbraw/zinc/20/00/67/1364200067.db2.gz	QYIUXYLWAOETDR-UHFFFAOYSA-N	0	3	336.479	3.269	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC1CC(NCc2ccncc2Cl)C1	ZINC001100711363	1364230724	/nfs/dbraw/zinc/23/07/24/1364230724.db2.gz	LQFMFVJYNSQPJD-UHFFFAOYSA-N	0	3	335.879	3.322	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C[C@H]2CCc3ccccc32)C1	ZINC001100773154	1364254987	/nfs/dbraw/zinc/25/49/87/1364254987.db2.gz	CSFNHHZDNFIAML-ARWYELJZSA-N	0	3	332.875	3.343	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C[C@@H]2CCc3ccccc32)C1	ZINC001100773155	1364255148	/nfs/dbraw/zinc/25/51/48/1364255148.db2.gz	CSFNHHZDNFIAML-WIHSUSGWSA-N	0	3	332.875	3.343	20	30		EGEDHN
C[C@H](CC(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1)C1CC1	ZINC001101042499	1364387294	/nfs/dbraw/zinc/38/72/94/1364387294.db2.gz	DOWLTAUZJIYXPD-MJJDPTRDSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H](C)Cc2ccc(F)cc2)C1	ZINC001101062547	1364397181	/nfs/dbraw/zinc/39/71/81/1364397181.db2.gz	WBPLSUSFHVWBTK-VWDMACCTSA-N	0	3	338.854	3.241	20	30		EGEDHN
C=C(C)CN1CC[C@H](Oc2ccnc(CNC(=O)[C@@H](C)CCC)c2)C1	ZINC001101092794	1364409451	/nfs/dbraw/zinc/40/94/51/1364409451.db2.gz	XTIWTAPOOWPLAF-LPHOPBHVSA-N	0	3	345.487	3.163	20	30		EGEDHN
CC/C=C(/C)C(=O)N1C[C@H]2CN(Cc3ccc(C#N)cc3)C[C@@]2(C)C1	ZINC001101152384	1364433964	/nfs/dbraw/zinc/43/39/64/1364433964.db2.gz	BPKMUBNKGJJXRD-SLBVHOAISA-N	0	3	337.467	3.195	20	30		EGEDHN
C=CCCCC(=O)N1C[C@H]2CN(Cc3cccnc3C)C[C@@]2(C)C1	ZINC001101346922	1364519845	/nfs/dbraw/zinc/51/98/45/1364519845.db2.gz	NITSVJNHCGXGBP-QUCCMNQESA-N	0	3	327.472	3.027	20	30		EGEDHN
C=CCC[C@H](C)N1CC2(C1)C[C@H](NC(=O)CCCCC)c1nccn12	ZINC001101609103	1364654045	/nfs/dbraw/zinc/65/40/45/1364654045.db2.gz	UBSSIYSRVLZNIX-IRXDYDNUSA-N	0	3	344.503	3.390	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CC2(CN(C[C@@H](C)CC)C2)n2ccnc21	ZINC001101635216	1364664047	/nfs/dbraw/zinc/66/40/47/1364664047.db2.gz	CVHDSLAKZRFNLZ-JKSUJKDBSA-N	0	3	344.503	3.103	20	30		EGEDHN
CC/C=C(/C)C(=O)NC[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1C	ZINC001101777802	1364722785	/nfs/dbraw/zinc/72/27/85/1364722785.db2.gz	OTYGTWHWMDAPBJ-DZLAQPFJSA-N	0	3	343.446	3.238	20	30		EGEDHN
CCC[C@H](C)C(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001101828945	1364742833	/nfs/dbraw/zinc/74/28/33/1364742833.db2.gz	OGFWLDBCWCZMLW-RRFJBIMHSA-N	0	3	333.501	3.240	20	30		EGEDHN
C#CCCCC(=O)NC[C@@H]1CN(Cc2cc(C)ccc2F)C[C@H]1C	ZINC001101920744	1364775593	/nfs/dbraw/zinc/77/55/93/1364775593.db2.gz	IMNNIUYVISMTKX-SJLPKXTDSA-N	0	3	330.447	3.122	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@@H]1CN(Cc2cnc(C)s2)C[C@H]1C	ZINC001102005002	1364808176	/nfs/dbraw/zinc/80/81/76/1364808176.db2.gz	OOKHNOMNGMYLNV-UKRRQHHQSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H]1CN(Cc2cccc(OCC)n2)C[C@H]1C	ZINC001102011834	1364811519	/nfs/dbraw/zinc/81/15/19/1364811519.db2.gz	SQNAGFHHSFZFRC-IAGOWNOFSA-N	0	3	345.487	3.021	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@@H]1CN(Cc2conc2CC)C[C@H]1C	ZINC001102260968	1364974007	/nfs/dbraw/zinc/97/40/07/1364974007.db2.gz	JTEKDCDSROWLRZ-BZUAXINKSA-N	0	3	333.476	3.023	20	30		EGEDHN
C=CCC[C@@H](C(=O)NC[C@@H]1CN(CCF)C[C@H]1C)c1ccccc1	ZINC001102621346	1365139989	/nfs/dbraw/zinc/13/99/89/1365139989.db2.gz	VXBFPMMGTLUNJS-BHIYHBOVSA-N	0	3	332.463	3.390	20	30		EGEDHN
C=CCC[C@@H](C)[N@@H+]1C[C@@H](C)[C@H](CCNC(=O)c2ccccc2[O-])C1	ZINC001102688997	1365171981	/nfs/dbraw/zinc/17/19/81/1365171981.db2.gz	UZYFDTHMTMEZEE-BRWVUGGUSA-N	0	3	330.472	3.435	20	30		EGEDHN
C=CCC[C@@H](C)[N@H+]1C[C@@H](C)[C@H](CCNC(=O)c2ccccc2[O-])C1	ZINC001102688997	1365171983	/nfs/dbraw/zinc/17/19/83/1365171983.db2.gz	UZYFDTHMTMEZEE-BRWVUGGUSA-N	0	3	330.472	3.435	20	30		EGEDHN
C/C=C(/C)C(=O)NCC[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1C	ZINC001102842010	1365247250	/nfs/dbraw/zinc/24/72/50/1365247250.db2.gz	PUXDFDKMFPKHTK-TUCWUAQRSA-N	0	3	343.446	3.238	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2ncccc2CC)C1	ZINC001103170148	1365419204	/nfs/dbraw/zinc/41/92/04/1365419204.db2.gz	WNDDDPOQEPRPJB-CZUORRHYSA-N	0	3	335.879	3.084	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)CC2CC(OCC)C2)C1	ZINC001103359361	1365517198	/nfs/dbraw/zinc/51/71/98/1365517198.db2.gz	WPEBKFQGSBWYQR-CRYBEJKASA-N	0	3	342.911	3.018	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)[C@@H](OC)C2CCCC2)C1	ZINC001103681636	1365724383	/nfs/dbraw/zinc/72/43/83/1365724383.db2.gz	OWEBZDVGLLFBDX-XYPHTWIQSA-N	0	3	342.911	3.018	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)[C@H](OC)C2CCCC2)C1	ZINC001103681635	1365724695	/nfs/dbraw/zinc/72/46/95/1365724695.db2.gz	OWEBZDVGLLFBDX-KBRIMQKVSA-N	0	3	342.911	3.018	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2nc(C)c(C)s2)C1	ZINC001103734816	1365755553	/nfs/dbraw/zinc/75/55/53/1365755553.db2.gz	WLAKECJGSCHSJL-QMTHXVAHSA-N	0	3	341.908	3.200	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)[C@@H](C)OCCCC)C[C@H]1C	ZINC001103964541	1365850950	/nfs/dbraw/zinc/85/09/50/1365850950.db2.gz	UDEMJJVMFZUPKX-FVQBIDKESA-N	0	3	330.900	3.018	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@H](CCNCc2oc(CCC)nc2C)C1	ZINC001103979147	1365857910	/nfs/dbraw/zinc/85/79/10/1365857910.db2.gz	BUFOUFBBPZPHHQ-NVXWUHKLSA-N	0	3	347.503	3.476	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CN(C(=O)C2CC(C)C2)C[C@H]1C	ZINC001104057355	1365893612	/nfs/dbraw/zinc/89/36/12/1365893612.db2.gz	SBMUOJIIZKAPMD-VYKPZMDHSA-N	0	3	343.309	3.015	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@H](CCNCc2oc(C)nc2C)C1	ZINC001104485941	1366045400	/nfs/dbraw/zinc/04/54/00/1366045400.db2.gz	UUIACCKYAPOXHW-RHSMWYFYSA-N	0	3	347.503	3.468	20	30		EGEDHN
CC#CCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2c(C)noc2C)C1	ZINC001104553009	1366072849	/nfs/dbraw/zinc/07/28/49/1366072849.db2.gz	RTTRUNZWAAZVAG-CRAIPNDOSA-N	0	3	345.487	3.059	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@H]1C[C@@](CNCCF)(c2ccccc2)C1	ZINC001105435231	1366466923	/nfs/dbraw/zinc/46/69/23/1366466923.db2.gz	FBIQYPJKEZXIHZ-XKGZKEIXSA-N	0	3	332.463	3.364	20	30		EGEDHN
CC(=O)N1CCCC[C@@H]1C1(CNCc2ccccc2C#N)CCC1	ZINC001105491845	1366491674	/nfs/dbraw/zinc/49/16/74/1366491674.db2.gz	NLXYCEBIRJBBRM-LJQANCHMSA-N	0	3	325.456	3.219	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](CNCc2cc(C3CC3)no2)[C@H](C)C1	ZINC001106612161	1366754800	/nfs/dbraw/zinc/75/48/00/1366754800.db2.gz	NTSWMUYAMFQWSQ-GDBMZVCRSA-N	0	3	331.460	3.092	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC[C@@H](n2cc(CNCCCCC)nn2)C1	ZINC001185955358	1387835424	/nfs/dbraw/zinc/83/54/24/1387835424.db2.gz	SCYKQXGUSSQTSN-GOSISDBHSA-N	0	3	347.507	3.078	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@]12CCC[C@H]1N(Cc1cnc(C)o1)CC2	ZINC001107420742	1366959508	/nfs/dbraw/zinc/95/95/08/1366959508.db2.gz	GBYXWOMGYFWFES-YLJYHZDGSA-N	0	3	345.487	3.446	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@]12CCC[C@H]1N(Cc1conc1C)CC2	ZINC001107422945	1366959979	/nfs/dbraw/zinc/95/99/79/1366959979.db2.gz	RUINCUBQSNHTPZ-IEBWSBKVSA-N	0	3	331.460	3.200	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](N(C)Cc2cccc(OCCC)c2)C1	ZINC001189319285	1366988948	/nfs/dbraw/zinc/98/89/48/1366988948.db2.gz	WCNOGLCDUZQXLX-SFHVURJKSA-N	0	3	330.472	3.474	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@]12CCC[C@H]1N(Cc1cc(C)no1)CC2	ZINC001107496532	1366996022	/nfs/dbraw/zinc/99/60/22/1366996022.db2.gz	CTPDSNALJBHBLF-YLJYHZDGSA-N	0	3	345.487	3.446	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccc2cc[nH]c2c1	ZINC001109208936	1367003707	/nfs/dbraw/zinc/00/37/07/1367003707.db2.gz	HBZQRFOOBBIKEQ-HOJAQTOUSA-N	0	3	335.451	3.193	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1cccc(OC)c1C	ZINC001109210039	1367005079	/nfs/dbraw/zinc/00/50/79/1367005079.db2.gz	ZXDQHKOLPMDTFD-QYZOEREBSA-N	0	3	340.467	3.029	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@]12CCC[C@H]1N(Cc1cnoc1C)CC2	ZINC001107515105	1367013762	/nfs/dbraw/zinc/01/37/62/1367013762.db2.gz	MBQSOXODJYEPER-YVWKXTFCSA-N	0	3	345.487	3.446	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@]12CCC[C@H]1N(Cc1cnoc1C)CC2	ZINC001107534119	1367025860	/nfs/dbraw/zinc/02/58/60/1367025860.db2.gz	YFOPYQBFMAJZGP-MISYRCLQSA-N	0	3	345.487	3.446	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2C[C@H]1CCCCO1	ZINC001109345729	1367073112	/nfs/dbraw/zinc/07/31/12/1367073112.db2.gz	TUMYYGNFRZBZCU-WCVJEAGWSA-N	0	3	340.895	3.056	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](N(C)Cc2cccc(OC(C)C)c2)C1	ZINC001189910111	1367129188	/nfs/dbraw/zinc/12/91/88/1367129188.db2.gz	LSFYNKKNHAHYOX-LJQANCHMSA-N	0	3	342.483	3.310	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)C=C2CCCCC2)C1	ZINC001107786437	1367145979	/nfs/dbraw/zinc/14/59/79/1367145979.db2.gz	XYKAELVBEDFREJ-YLJYHZDGSA-N	0	3	334.504	3.439	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc3ncccc3o1)C2	ZINC001109532991	1367183060	/nfs/dbraw/zinc/18/30/60/1367183060.db2.gz	BAZBQGRRDLGOHA-YCPHGPKFSA-N	0	3	325.412	3.129	20	30		EGEDHN
CCCCCCN(C)CC(=O)N[C@H](C)CNc1cccc(F)c1C#N	ZINC001107878418	1367189246	/nfs/dbraw/zinc/18/92/46/1367189246.db2.gz	WBSODSOENOJGOS-OAHLLOKOSA-N	0	3	348.466	3.126	20	30		EGEDHN
Cc1cc(C#N)c(F)cc1NC(=O)c1cnc(-c2ccccc2)nc1O	ZINC001190271364	1367214069	/nfs/dbraw/zinc/21/40/69/1367214069.db2.gz	VGWNMIYGMBHZKY-UHFFFAOYSA-N	0	3	348.337	3.421	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCc1ccc(C)cc1	ZINC001109601665	1367224765	/nfs/dbraw/zinc/22/47/65/1367224765.db2.gz	KDKCGYFOBWFCRH-QYZOEREBSA-N	0	3	326.484	3.471	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)C(C)(C)C(=C)Cl)C1	ZINC001107971061	1367225006	/nfs/dbraw/zinc/22/50/06/1367225006.db2.gz	NHYFUDJACUUAMT-RDTXWAMCSA-N	0	3	342.911	3.327	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C(C1CCC1)C1CCC1)C2	ZINC001109646192	1367261940	/nfs/dbraw/zinc/26/19/40/1367261940.db2.gz	MIOFYNUZVLXQJI-QYZOEREBSA-N	0	3	346.515	3.127	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)C2(C3CC3)CCC2)C1	ZINC001108101920	1367282530	/nfs/dbraw/zinc/28/25/30/1367282530.db2.gz	VPMGNJRYKLWBRZ-APWZRJJASA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2ccoc2C2CC2)C1	ZINC001108162066	1367316971	/nfs/dbraw/zinc/31/69/71/1367316971.db2.gz	OHKCMRRZFXDHGT-YWZLYKJASA-N	0	3	346.471	3.332	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)C2(CC=C)CCC2)C1	ZINC001108187982	1367331390	/nfs/dbraw/zinc/33/13/90/1367331390.db2.gz	PIGVXCUVBFOUIB-IEBWSBKVSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](CC)c1c(C)noc1C)C2	ZINC001109844790	1367354770	/nfs/dbraw/zinc/35/47/70/1367354770.db2.gz	IKTBIHYPCXBGHV-NCOADZHNSA-N	0	3	331.460	3.083	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2c[nH]cc2C2CC2)C1	ZINC001108313645	1367386991	/nfs/dbraw/zinc/38/69/91/1367386991.db2.gz	DWUJWIMDNSHYHG-QRWLVFNGSA-N	0	3	345.487	3.068	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2CC[C@H](N(C)CC=C(C)C)C2)cc1	ZINC001190974500	1367392224	/nfs/dbraw/zinc/39/22/24/1367392224.db2.gz	ZSZBUHXKDBMPIN-SFHVURJKSA-N	0	3	328.456	3.364	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCO[C@@H]1C1CCN(C(=O)CCCC)CC1	ZINC001186114848	1387873602	/nfs/dbraw/zinc/87/36/02/1387873602.db2.gz	QAGSWJGXCBJCNM-FUHWJXTLSA-N	0	3	342.911	3.305	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](N(C)CCOc2ccc(F)cc2)C1	ZINC001191694150	1367561405	/nfs/dbraw/zinc/56/14/05/1367561405.db2.gz	BDGVKPGTRSGTNA-KRWDZBQOSA-N	0	3	348.462	3.340	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](N(C)Cc2ccc(F)cc2)C1	ZINC001191726802	1367571975	/nfs/dbraw/zinc/57/19/75/1367571975.db2.gz	CKLNGIZEFXQDTJ-LJQANCHMSA-N	0	3	330.447	3.442	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@H](N(C)Cc2ccccc2N(C)C)C1	ZINC001191913310	1367636576	/nfs/dbraw/zinc/63/65/76/1367636576.db2.gz	WPNBGLCFQGBIMF-MJGOQNOKSA-N	0	3	343.515	3.388	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccc2ccccc2c1	ZINC001110402182	1367694460	/nfs/dbraw/zinc/69/44/60/1367694460.db2.gz	ZLVCTHIQAQBIPQ-DMSXTEQDSA-N	0	3	333.435	3.221	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](N(C)CCOCC3CCC3)C2)CC1	ZINC001192180452	1367708311	/nfs/dbraw/zinc/70/83/11/1367708311.db2.gz	IPTRBOLAWMHJDJ-IBGZPJMESA-N	0	3	334.504	3.082	20	30		EGEDHN
CC#CCN1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)[C@H](F)CC)C1	ZINC001186196510	1387895099	/nfs/dbraw/zinc/89/50/99/1387895099.db2.gz	KXAROSBGQWHRKD-BHIYHBOVSA-N	0	3	348.437	3.119	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](N(C)Cc3ccc(C#N)cc3)C2)CCC1	ZINC001192216967	1367720383	/nfs/dbraw/zinc/72/03/83/1367720383.db2.gz	APJPXPDYWVKHPN-LJQANCHMSA-N	0	3	337.467	3.337	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1cccc(C)c1	ZINC001109038598	1367734593	/nfs/dbraw/zinc/73/45/93/1367734593.db2.gz	ULZLRNJREPWTTG-RNQOJCNYSA-N	0	3	342.483	3.198	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1cccc(OC)c1C	ZINC001109055034	1367741098	/nfs/dbraw/zinc/74/10/98/1367741098.db2.gz	LQDGCJUBMZVILZ-SQNIBIBYSA-N	0	3	328.456	3.191	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCCc1ccccc1OC	ZINC001109054933	1367741832	/nfs/dbraw/zinc/74/18/32/1367741832.db2.gz	HDYGGBRRMQJPKA-QYZOEREBSA-N	0	3	342.483	3.316	20	30		EGEDHN
Cc1cc(C)c(CN2[C@@H]3CC[C@H]2[C@H](NC(=O)C#CC(C)C)C3)c(C)c1	ZINC001110533548	1367814421	/nfs/dbraw/zinc/81/44/21/1367814421.db2.gz	XHAXXHOTJBJCRY-NRSPTQNISA-N	0	3	338.495	3.493	20	30		EGEDHN
Cc1ccc(CCN2[C@@H]3CC[C@H]2[C@H](NC(=O)C#CC(C)(C)C)C3)cc1	ZINC001110543308	1367821542	/nfs/dbraw/zinc/82/15/42/1367821542.db2.gz	LRICASUUTKYPQS-AQNXPRMDSA-N	0	3	338.495	3.309	20	30		EGEDHN
CN1CCC(N(Cc2ccc(F)cc2)C(=O)c2ccc(C#N)o2)CC1	ZINC001192686235	1367850592	/nfs/dbraw/zinc/85/05/92/1367850592.db2.gz	WJPHXXYZOUBUDE-UHFFFAOYSA-N	0	3	341.386	3.027	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1cccc(N(C)C)c1	ZINC001110607198	1367870044	/nfs/dbraw/zinc/87/00/44/1367870044.db2.gz	ITCUEJALENZLIV-AQNXPRMDSA-N	0	3	341.499	3.330	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)[C@@H](C)c2ccc(CC)cc2)C1	ZINC001192875743	1367894028	/nfs/dbraw/zinc/89/40/28/1367894028.db2.gz	DXLKPPBNSAHGQL-FXAWDEMLSA-N	0	3	344.499	3.088	20	30		EGEDHN
CC(C)C[C@@H](C)C(=O)N1CC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001193099180	1367943266	/nfs/dbraw/zinc/94/32/66/1367943266.db2.gz	KJWSJVZYXACPPK-APWZRJJASA-N	0	3	327.472	3.273	20	30		EGEDHN
CCCCCCCCC(=O)N1CC[C@@H](N(C)CCn2cccn2)C1	ZINC001193642445	1368081541	/nfs/dbraw/zinc/08/15/41/1368081541.db2.gz	OJNLYFWGVVYQQA-GOSISDBHSA-N	0	3	334.508	3.166	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3C[C@H]2CC(C)(C)CO2)CC1	ZINC001110988138	1368135349	/nfs/dbraw/zinc/13/53/49/1368135349.db2.gz	QZXSNLJWPGJZJY-TVFCKZIOSA-N	0	3	346.515	3.269	20	30		EGEDHN
C=CCCCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ocnc1CC)C2	ZINC001111000546	1368140370	/nfs/dbraw/zinc/14/03/70/1368140370.db2.gz	MNBFPUHKNOCFHB-OIISXLGYSA-N	0	3	331.460	3.319	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCCCc1ccc(F)cc1)C2	ZINC001111064994	1368150558	/nfs/dbraw/zinc/15/05/58/1368150558.db2.gz	LAAZNZVGORZLHV-AQNXPRMDSA-N	0	3	342.458	3.283	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)COc1ccsc1Cl)C2	ZINC001111130806	1368162786	/nfs/dbraw/zinc/16/27/86/1368162786.db2.gz	JTHNWKXHSLJHGU-UPJWGTAASA-N	0	3	340.876	3.078	20	30		EGEDHN
C=CC[C@@H](C(=O)N1CC[C@@H](N(C)CCOC(C)C)C1)c1ccccc1	ZINC001194173805	1368197461	/nfs/dbraw/zinc/19/74/61/1368197461.db2.gz	FJWYRRJOSHCOAJ-WOJBJXKFSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=C[C@@H](C(=O)N1CC[C@@H](N(C)CCOCC(C)C)C1)c1ccccc1	ZINC001194183476	1368201918	/nfs/dbraw/zinc/20/19/18/1368201918.db2.gz	PXLXQNGLNKRDDP-WOJBJXKFSA-N	0	3	344.499	3.162	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)COC[C@@H](C)c1ccccc1)C2	ZINC001111334231	1368267231	/nfs/dbraw/zinc/26/72/31/1368267231.db2.gz	QJXCSTQVYMOUNP-AFYVEPGGSA-N	0	3	342.483	3.104	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCCOc1cccc(F)c1)C2	ZINC001111422556	1368304083	/nfs/dbraw/zinc/30/40/83/1368304083.db2.gz	QQKZHXYVCJOSNA-QRQLOZEOSA-N	0	3	346.446	3.282	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1cc(C)cc(C)c1	ZINC001111482249	1368319068	/nfs/dbraw/zinc/31/90/68/1368319068.db2.gz	AEYIBNUWEFACLQ-AQNXPRMDSA-N	0	3	342.483	3.118	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1(CC(C)C)CCC1)C[C@H](C)O2	ZINC001111545831	1368339261	/nfs/dbraw/zinc/33/92/61/1368339261.db2.gz	QGVQRQQSVABWHL-SFHVURJKSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=CCCC1(C(=O)N2C[C@@H](C)OC3(CCN(CC=C)CC3)C2)CC1	ZINC001111549601	1368341546	/nfs/dbraw/zinc/34/15/46/1368341546.db2.gz	SSIMPEHGUOSGJK-QGZVFWFLSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=CCOCCCC(=O)N1CCCN(Cc2cccc(C)c2)CC1	ZINC001195443258	1368437439	/nfs/dbraw/zinc/43/74/39/1368437439.db2.gz	BDYFXAASUSVOAD-UHFFFAOYSA-N	0	3	330.472	3.012	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@]12CCC[C@H]1CN(CCc1ccns1)C2	ZINC001111762916	1368450247	/nfs/dbraw/zinc/45/02/47/1368450247.db2.gz	VMDNEWNLWKEDSN-KXBFYZLASA-N	0	3	347.528	3.259	20	30		EGEDHN
CC(C)C#CC(=O)N1CCCN(C[C@H]2CCCC(F)(F)C2)CC1	ZINC001195775364	1368487960	/nfs/dbraw/zinc/48/79/60/1368487960.db2.gz	YAGAMGLARROLAK-INIZCTEOSA-N	0	3	326.431	3.006	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cc(C(C)C)n(C)n2)CC1	ZINC001195780540	1368488979	/nfs/dbraw/zinc/48/89/79/1368488979.db2.gz	FASHWLQZMGLMNZ-UHFFFAOYSA-N	0	3	346.519	3.438	20	30		EGEDHN
CC#CCN[C@@H]1CCN(C(=O)[C@@H]2C[C@H]2c2cccc3ccccc32)C1	ZINC001186436180	1387942866	/nfs/dbraw/zinc/94/28/66/1387942866.db2.gz	UQJDHRMJDZVIAD-JRGCBEDISA-N	0	3	332.447	3.157	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCCN(CCC[C@@H]2CCOC2)CC1	ZINC001195966548	1368524965	/nfs/dbraw/zinc/52/49/65/1368524965.db2.gz	KWEMKGDFOKXIBP-GOSISDBHSA-N	0	3	334.504	3.106	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2ccc(OCC)nc2)CC1	ZINC001196060069	1368541363	/nfs/dbraw/zinc/54/13/63/1368541363.db2.gz	HSPAMIHIFNQQBA-UHFFFAOYSA-N	0	3	345.487	3.375	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2c(C)[nH]nc2Cl)CC1	ZINC001196092433	1368546987	/nfs/dbraw/zinc/54/69/87/1368546987.db2.gz	BIHFZEIPVROVRY-UHFFFAOYSA-N	0	3	340.899	3.490	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@H](C)CC2CCCC2)C1	ZINC001196590812	1368644254	/nfs/dbraw/zinc/64/42/54/1368644254.db2.gz	RHHXASZGLFWDSO-BHIYHBOVSA-N	0	3	336.520	3.111	20	30		EGEDHN
C=CCCN1CCCN(C(=O)[C@H](C)OCc2cccc(C)c2)CC1	ZINC001196690802	1368664801	/nfs/dbraw/zinc/66/48/01/1368664801.db2.gz	XAMXVDIHJXSQPA-SFHVURJKSA-N	0	3	330.472	3.011	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCN(CCCOCc2ccccc2)CC1	ZINC001196731501	1368671442	/nfs/dbraw/zinc/67/14/42/1368671442.db2.gz	DUTFUMVFCNFJPC-UHFFFAOYSA-N	0	3	344.499	3.340	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)N1CCCN(CCc2ccc(OC)cc2)CC1	ZINC001196830164	1368692658	/nfs/dbraw/zinc/69/26/58/1368692658.db2.gz	ISRILFCQSLIJBB-ZWKOTPCHSA-N	0	3	344.499	3.230	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)[C@@H](CCC)C(C)C)C[C@H]1C(F)(F)F	ZINC001112173733	1368700873	/nfs/dbraw/zinc/70/08/73/1368700873.db2.gz	MUDJQZBAWKIAGL-RRFJBIMHSA-N	0	3	332.410	3.061	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)C(CC)(CC)CC)C[C@H]1C(F)(F)F	ZINC001112183664	1368704370	/nfs/dbraw/zinc/70/43/70/1368704370.db2.gz	UMCJSIHPQIJLDW-ZIAGYGMSSA-N	0	3	332.410	3.205	20	30		EGEDHN
C=CCCCC(=O)N1CCCN(CCc2ccc(OC)cc2)CC1	ZINC001197000203	1368729019	/nfs/dbraw/zinc/72/90/19/1368729019.db2.gz	LRJNMGYWKZUNST-UHFFFAOYSA-N	0	3	330.472	3.128	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)c1cc(C)c(OC(C)C)c(C)c1	ZINC001197247607	1368770564	/nfs/dbraw/zinc/77/05/64/1368770564.db2.gz	KHSZKDBRWRYEJA-SFHVURJKSA-N	0	3	330.472	3.471	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2ccoc2Br)CC1	ZINC001197691420	1368873541	/nfs/dbraw/zinc/87/35/41/1368873541.db2.gz	IAHKGCHSRPCYBD-UHFFFAOYSA-N	0	3	341.249	3.156	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2c3c(nn2C)CCC3)CC1	ZINC001197801910	1368901801	/nfs/dbraw/zinc/90/18/01/1368901801.db2.gz	HXSCAENAOXCBNO-UHFFFAOYSA-N	0	3	346.519	3.027	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2c(F)ccc(OC)c2F)CC1	ZINC001197893719	1368921084	/nfs/dbraw/zinc/92/10/84/1368921084.db2.gz	WPFCKWDZMUTPHA-UHFFFAOYSA-N	0	3	338.398	3.088	20	30		EGEDHN
CCCCCCCCCCC(=O)N[C@@H]1CN(CCCC)C[C@H]1O	ZINC001198075142	1368954777	/nfs/dbraw/zinc/95/47/77/1368954777.db2.gz	DYNNGKAQFPLADL-QZTJIDSGSA-N	0	3	326.525	3.479	20	30		EGEDHN
C#CCCN1CCCN(C(=O)[C@@H](C)CCCc2ccccc2)CC1	ZINC001198303743	1369002509	/nfs/dbraw/zinc/00/25/09/1369002509.db2.gz	IENLMCREVXGNEQ-IBGZPJMESA-N	0	3	326.484	3.203	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cnn(C)c2C2CC2)CC1	ZINC001198373203	1369018066	/nfs/dbraw/zinc/01/80/66/1369018066.db2.gz	OKOVSIZIPDKLGY-UHFFFAOYSA-N	0	3	346.519	3.416	20	30		EGEDHN
C#CC[C@H](CC(=O)N1CCCN(CCCF)CC1)c1ccccc1	ZINC001198394893	1369021744	/nfs/dbraw/zinc/02/17/44/1369021744.db2.gz	PJEBRNPHXRVWKW-LJQANCHMSA-N	0	3	330.447	3.078	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)C(C)(C)c2ccccc2)C1	ZINC001198466013	1369039080	/nfs/dbraw/zinc/03/90/80/1369039080.db2.gz	DTRHNYYAEWVJKN-RTBURBONSA-N	0	3	346.515	3.096	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)C(C)(F)F)c1ccccc1OC	ZINC001198483404	1369042333	/nfs/dbraw/zinc/04/23/33/1369042333.db2.gz	WKSFIKGUNCWUIR-AWEZNQCLSA-N	0	3	326.387	3.064	20	30		EGEDHN
COc1ccccc1[C@H](CNC(=O)[C@H](C)C#N)NCCCC1CCC1	ZINC001198617800	1369075066	/nfs/dbraw/zinc/07/50/66/1369075066.db2.gz	SPWYBCYBJXZURA-QAPCUYQASA-N	0	3	343.471	3.182	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)COCCCC)c1ccccc1OC	ZINC001198628350	1369076367	/nfs/dbraw/zinc/07/63/67/1369076367.db2.gz	SXBOUHRULSKDFR-GOSISDBHSA-N	0	3	348.487	3.225	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)c1ncccc1C)c1ccccc1OC	ZINC001198647378	1369081471	/nfs/dbraw/zinc/08/14/71/1369081471.db2.gz	MWVYWCQAGFMDET-KRWDZBQOSA-N	0	3	339.439	3.035	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)C1CC(F)(F)C1)c1ccccc1OC	ZINC001198656294	1369084278	/nfs/dbraw/zinc/08/42/78/1369084278.db2.gz	MMYGOVWUZXZHAZ-HNNXBMFYSA-N	0	3	338.398	3.064	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H](NCC(C)C)c1ccccc1OC	ZINC001198677001	1369088796	/nfs/dbraw/zinc/08/87/96/1369088796.db2.gz	GTXNTJINLCHYNS-GOSISDBHSA-N	0	3	330.472	3.292	20	30		EGEDHN
C#CCC1(C(=O)NC[C@H](NCCC=C)c2ccccc2OC)CCC1	ZINC001198752633	1369105738	/nfs/dbraw/zinc/10/57/38/1369105738.db2.gz	ROVZUXFXBQRBHQ-SFHVURJKSA-N	0	3	340.467	3.212	20	30		EGEDHN
CC#CCCCC(=O)NC[C@H](NCC[C@H](C)F)c1ccccc1OC	ZINC001198854869	1369129643	/nfs/dbraw/zinc/12/96/43/1369129643.db2.gz	ANHANKDLGBYLBW-WMZOPIPTSA-N	0	3	348.462	3.384	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)Cc2cc(C)c(Cl)cn2)CC1	ZINC001113008463	1369133249	/nfs/dbraw/zinc/13/32/49/1369133249.db2.gz	RAJPCNLOXPAVSD-OAHLLOKOSA-N	0	3	335.879	3.085	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@@H](C)c1ccco1)c1ccccc1OC	ZINC001198894994	1369142506	/nfs/dbraw/zinc/14/25/06/1369142506.db2.gz	NLPHWVISVKBEOJ-RDJZCZTQSA-N	0	3	342.439	3.415	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)C1(CF)CC1)c1ccccc1OC	ZINC001198902750	1369144586	/nfs/dbraw/zinc/14/45/86/1369144586.db2.gz	OFWGEDJYNNWXQU-MRXNPFEDSA-N	0	3	334.435	3.158	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)C1(C(C)C)CC1)c1ccccc1OC	ZINC001198903098	1369145172	/nfs/dbraw/zinc/14/51/72/1369145172.db2.gz	UTKVWJBQVNGRDX-KRWDZBQOSA-N	0	3	330.472	3.454	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)C2(CC)CCCCC2)C1	ZINC001198976699	1369163319	/nfs/dbraw/zinc/16/33/19/1369163319.db2.gz	WXJWOMSIQBBNQH-QZTJIDSGSA-N	0	3	338.536	3.479	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)c2n[nH]c(C3CC3)c2Cl)CC1	ZINC001113069137	1369178811	/nfs/dbraw/zinc/17/88/11/1369178811.db2.gz	QCACOLDBPRSGPO-GFCCVEGCSA-N	0	3	336.867	3.053	20	30		EGEDHN
C=CCCC(=O)N1CCC(NCc2nc3ccc(F)cc3o2)CC1	ZINC001199706746	1369258348	/nfs/dbraw/zinc/25/83/48/1369258348.db2.gz	OWYFQWYWQFTGKO-UHFFFAOYSA-N	0	3	331.391	3.014	20	30		EGEDHN
CCCCCCCN1CCN(C(=O)[C@H]2C[C@H](C)Cc3c[nH]nc32)CC1	ZINC001113257081	1369296300	/nfs/dbraw/zinc/29/63/00/1369296300.db2.gz	OZORZWDCJHEDMA-AEFFLSMTSA-N	0	3	346.519	3.190	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)CCOc2ccc(F)cc2)CC1	ZINC001113290104	1369322545	/nfs/dbraw/zinc/32/25/45/1369322545.db2.gz	WBAWTQHPLXZFBJ-MRXNPFEDSA-N	0	3	334.435	3.094	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC(NCc2cc(C3CC3)no2)CC1	ZINC001200748274	1369422791	/nfs/dbraw/zinc/42/27/91/1369422791.db2.gz	ZGINRSQLTBZORB-UHFFFAOYSA-N	0	3	343.471	3.401	20	30		EGEDHN
CCCCCCCN1CCN(C(=O)CCCn2ccnc2C)CC1	ZINC001113434395	1369424967	/nfs/dbraw/zinc/42/49/67/1369424967.db2.gz	FKJOMVCELOKAOZ-UHFFFAOYSA-N	0	3	334.508	3.086	20	30		EGEDHN
C=CCC1(C(=O)N2CCCO[C@@H](CNCc3ccsc3)C2)CCC1	ZINC001201358858	1369526536	/nfs/dbraw/zinc/52/65/36/1369526536.db2.gz	DCHLNUFYZAXSKL-KRWDZBQOSA-N	0	3	348.512	3.202	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)CCCOc2cccc(F)c2)CC1	ZINC001113649853	1369542165	/nfs/dbraw/zinc/54/21/65/1369542165.db2.gz	SRYPGHKCVAMFHD-QGZVFWFLSA-N	0	3	348.462	3.484	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)CC(F)(F)C(F)(F)F)CC1	ZINC001113743470	1369597556	/nfs/dbraw/zinc/59/75/56/1369597556.db2.gz	LHYWTTXFXNPDKK-NSHDSACASA-N	0	3	328.325	3.073	20	30		EGEDHN
C=CCOCc1ncn2c1CN(CCCc1ccccc1)CCC2	ZINC001201655092	1369598507	/nfs/dbraw/zinc/59/85/07/1369598507.db2.gz	MLAMJEGLASCTDV-UHFFFAOYSA-N	0	3	325.456	3.424	20	30		EGEDHN
C=CCOCc1nn(CC2CC2)c2c1CN(CCCSC)CC2	ZINC001201681133	1369604378	/nfs/dbraw/zinc/60/43/78/1369604378.db2.gz	RIIIJJGBCDBRPI-UHFFFAOYSA-N	0	3	335.517	3.107	20	30		EGEDHN
O=C(N[C@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2)C1CCCC1	ZINC001202290852	1369731559	/nfs/dbraw/zinc/73/15/59/1369731559.db2.gz	PQPSFPDWGIXUEM-PMACEKPBSA-N	0	3	336.479	3.245	20	30		EGEDHN
CCCC(=O)N[C@@H]1C[C@H](NCc2ccc(C#N)cc2F)C12CCC2	ZINC001202334309	1369741466	/nfs/dbraw/zinc/74/14/66/1369741466.db2.gz	BRAPAQKUMMZBNB-DLBZAZTESA-N	0	3	329.419	3.014	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)CCC(C)C)C12CCC2	ZINC001202447569	1369774522	/nfs/dbraw/zinc/77/45/22/1369774522.db2.gz	JKAWJOYIXBQXAX-KBPBESRZSA-N	0	3	343.309	3.348	20	30		EGEDHN
CCCCC(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C12CCC2	ZINC001202491750	1369789525	/nfs/dbraw/zinc/78/95/25/1369789525.db2.gz	WKDFGKBEAXCIKG-ROUUACIJSA-N	0	3	343.446	3.405	20	30		EGEDHN
CC(C)(C)CC(=O)N[C@@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202502501	1369792934	/nfs/dbraw/zinc/79/29/34/1369792934.db2.gz	UYRUZFUJRKKPSB-RTBURBONSA-N	0	3	338.495	3.491	20	30		EGEDHN
C/C(=C\C(=O)N[C@@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2)C1CC1	ZINC001202573444	1369809558	/nfs/dbraw/zinc/80/95/58/1369809558.db2.gz	LYNTWDJFXCPEJO-QMAUXMRRSA-N	0	3	348.490	3.411	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@@H](NC(=O)/C(C)=C\CC)C12CCC2	ZINC001202583608	1369814070	/nfs/dbraw/zinc/81/40/70/1369814070.db2.gz	ZFTGPTHVESHJGY-FLFDDASRSA-N	0	3	341.293	3.268	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@@H](NCc2cccc(Cl)n2)C12CCC2	ZINC001202592684	1369816732	/nfs/dbraw/zinc/81/67/32/1369816732.db2.gz	VTTKZTQGNXKIDN-HUUCEWRRSA-N	0	3	333.863	3.218	20	30		EGEDHN
O=C(CC1CCC1)N[C@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202696378	1369855505	/nfs/dbraw/zinc/85/55/05/1369855505.db2.gz	YZSCEFMMUHKGLV-PMACEKPBSA-N	0	3	336.479	3.245	20	30		EGEDHN
C/C=C(/C)C(=O)N[C@@H]1C[C@H](NCc2ccc(C#N)cc2F)C12CCC2	ZINC001202726757	1369868664	/nfs/dbraw/zinc/86/86/64/1369868664.db2.gz	USSCMZVXGUZHSZ-ZAYZHACPSA-N	0	3	341.430	3.181	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1C[C@H](NCc2oc(C)nc2C)C12CCC2	ZINC001202786642	1369891575	/nfs/dbraw/zinc/89/15/75/1369891575.db2.gz	VFQHHEVWLLOBKT-ROUUACIJSA-N	0	3	343.471	3.002	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@H](NC(=O)/C=C(\C)CC)C12CCC2	ZINC001202846324	1369906342	/nfs/dbraw/zinc/90/63/42/1369906342.db2.gz	JTOJZEQFLLXNRY-GELOPOQCSA-N	0	3	341.293	3.268	20	30		EGEDHN
CC/C(C)=C/C(=O)N[C@@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202887856	1369917746	/nfs/dbraw/zinc/91/77/46/1369917746.db2.gz	MMZLUJKQVMVDQK-PFMYXXNMSA-N	0	3	336.479	3.411	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H]1C[C@@H](NCc2ccccn2)C12CCC2	ZINC001202960706	1369937137	/nfs/dbraw/zinc/93/71/37/1369937137.db2.gz	QGQIXFFMLTZJOA-HZPDHXFCSA-N	0	3	347.890	3.377	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1C[C@@H](NCc2cnc(C)o2)C12CCC2	ZINC001202961315	1369937691	/nfs/dbraw/zinc/93/76/91/1369937691.db2.gz	WUXWRMQJVZNDLS-MSOLQXFVSA-N	0	3	343.471	3.268	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1C[C@H](NCc2ccccn2)C12CCC2	ZINC001202961401	1369937873	/nfs/dbraw/zinc/93/78/73/1369937873.db2.gz	XIWUAAHGAMDWRN-DLBZAZTESA-N	0	3	327.472	3.201	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1C[C@H](NCc2ncccc2C)C12CCC2	ZINC001202985264	1369945999	/nfs/dbraw/zinc/94/59/99/1369945999.db2.gz	CDBAWQZFTJSOOU-ROUUACIJSA-N	0	3	327.472	3.263	20	30		EGEDHN
O=C(CCC(F)F)N[C@@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001203193756	1370019766	/nfs/dbraw/zinc/01/97/66/1370019766.db2.gz	XIBNCTUKWXEGEV-IAGOWNOFSA-N	0	3	346.421	3.100	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1[C@H]2CN([C@@H]3CCc4c3c(F)ccc4F)C[C@H]21	ZINC001114683852	1370023495	/nfs/dbraw/zinc/02/34/95/1370023495.db2.gz	WDUZUNSXGUDVCM-RGFKIIKPSA-N	0	3	346.421	3.211	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1[nH]c(CC)nc1C)[C@@H]2CC	ZINC001203238085	1370035386	/nfs/dbraw/zinc/03/53/86/1370035386.db2.gz	IAAUELJTDCFSTQ-XLIONFOSSA-N	0	3	344.503	3.202	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1[C@H]2CN(CCOc3cccc(C)c3)C[C@H]21	ZINC001114896935	1370135732	/nfs/dbraw/zinc/13/57/32/1370135732.db2.gz	SQZDADTUJKHUBX-BWTSREIZSA-N	0	3	342.483	3.023	20	30		EGEDHN
CCOc1ccccc1CN1CCCN(c2ccc(C#N)cn2)CC1	ZINC001203544104	1370162753	/nfs/dbraw/zinc/16/27/53/1370162753.db2.gz	UQLQSFJIZOCNRX-UHFFFAOYSA-N	0	3	336.439	3.064	20	30		EGEDHN
CC(C)(C)C(=O)N[C@@H]1C[C@H](NCC#Cc2ccc(F)cc2)C12CCC2	ZINC001203629667	1370193384	/nfs/dbraw/zinc/19/33/84/1370193384.db2.gz	BKXMZSGSFKYWQW-ZWKOTPCHSA-N	0	3	342.458	3.240	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3O[C@H](COc4cccnc4)CC[C@H]32)c1	ZINC001203762782	1370254787	/nfs/dbraw/zinc/25/47/87/1370254787.db2.gz	WICWBUZXPSKQCY-PWRODBHTSA-N	0	3	349.434	3.154	20	30		EGEDHN
C#CCC1(C(=O)N2CCC(NCc3cnc(C)o3)CC2)CCCCC1	ZINC001204007938	1370345966	/nfs/dbraw/zinc/34/59/66/1370345966.db2.gz	NWOULFRWNNDMPQ-UHFFFAOYSA-N	0	3	343.471	3.037	20	30		EGEDHN
CN1CCN(Cc2cccc(Nc3c(F)ccc(F)c3C#N)c2)CC1	ZINC001204578189	1370521851	/nfs/dbraw/zinc/52/18/51/1370521851.db2.gz	AOLOLVULYFZCBU-UHFFFAOYSA-N	0	3	342.393	3.327	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H]2CN(Cc3ccc(OC)c(C)c3)C[C@H]21	ZINC001187240320	1388079001	/nfs/dbraw/zinc/07/90/01/1388079001.db2.gz	PPNIMEYLNJCQET-ZWKOTPCHSA-N	0	3	328.456	3.003	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CCc2cncc(C)c2)CCCCC1	ZINC001115623002	1370618234	/nfs/dbraw/zinc/61/82/34/1370618234.db2.gz	GYBXRZCTHPEXPV-UHFFFAOYSA-N	0	3	349.906	3.484	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCC1(NCc2cc(C)ncn2)CCCCC1	ZINC001115679889	1370663221	/nfs/dbraw/zinc/66/32/21/1370663221.db2.gz	RBINYYIJJJYIIR-NVXWUHKLSA-N	0	3	344.503	3.152	20	30		EGEDHN
CC#CCCCC(=O)NCC1(NCc2ccccn2)CCCCC1	ZINC001115681562	1370664402	/nfs/dbraw/zinc/66/44/02/1370664402.db2.gz	QNTCRDIYAREENZ-UHFFFAOYSA-N	0	3	327.472	3.184	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H]2CCC[C@H](OC)C2)CCCCC1	ZINC001115697498	1370678699	/nfs/dbraw/zinc/67/86/99/1370678699.db2.gz	FLZNURZNXAJWTN-CVEARBPZSA-N	0	3	342.911	3.353	20	30		EGEDHN
Cc1nc(C(C)C)oc1CNCC1CCN(C(=O)C#CC(C)C)CC1	ZINC001205211703	1370682013	/nfs/dbraw/zinc/68/20/13/1370682013.db2.gz	SSRRIXSTKZFRFJ-UHFFFAOYSA-N	0	3	345.487	3.094	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)C[C@H]2C[C@H]2C)CCCCC1	ZINC001115710288	1370689293	/nfs/dbraw/zinc/68/92/93/1370689293.db2.gz	HLHBXJBMGLVMBP-TZMCWYRMSA-N	0	3	343.309	3.350	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)CC(C)C)CC[C@H]1c1ccc(F)cc1	ZINC001205238266	1370690988	/nfs/dbraw/zinc/69/09/88/1370690988.db2.gz	GHDTYGDVQVMDGG-RBUKOAKNSA-N	0	3	330.447	3.169	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC1(NCc2cnc(C)nc2)CCCCC1	ZINC001115712216	1370691167	/nfs/dbraw/zinc/69/11/67/1370691167.db2.gz	AXUVZKUCDUPEJE-LJQANCHMSA-N	0	3	344.503	3.296	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)/C=C/C2CC2)CC[C@H]1c1ccc(F)cc1	ZINC001205262882	1370699599	/nfs/dbraw/zinc/69/95/99/1370699599.db2.gz	FJIWSNCOPFNXEE-CHUTXNTCSA-N	0	3	340.442	3.089	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)CCC(=C)C)CC[C@H]1c1ccc(F)cc1	ZINC001205282860	1370705614	/nfs/dbraw/zinc/70/56/14/1370705614.db2.gz	PJUAHJYJTVJRCN-RBUKOAKNSA-N	0	3	328.431	3.089	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H](C)CC(=C)C)CC[C@H]1c1ccc(F)cc1	ZINC001205307235	1370716006	/nfs/dbraw/zinc/71/60/06/1370716006.db2.gz	WLGIJLNSGDFIFP-LSTHTHJFSA-N	0	3	342.458	3.335	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)CCC2(C)CC2)C[C@H]1c1cccc(F)c1	ZINC001205445602	1370758301	/nfs/dbraw/zinc/75/83/01/1370758301.db2.gz	IILMVWQDWURCAC-RBUKOAKNSA-N	0	3	342.458	3.313	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@@H](C)CC(C)C)C[C@H]1c1cccc(F)c1	ZINC001205448905	1370758913	/nfs/dbraw/zinc/75/89/13/1370758913.db2.gz	KYFFDVUVRVTQNB-FFZOFVMBSA-N	0	3	344.474	3.415	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H](C)CC(C)C)C[C@H]1c1cccc(F)c1	ZINC001205448165	1370759265	/nfs/dbraw/zinc/75/92/65/1370759265.db2.gz	BFTZDEQLYVBPPD-AYOQOUSVSA-N	0	3	330.447	3.025	20	30		EGEDHN
C=CCN1C(=O)CC[C@@]12CCCN(Cc1ccc(F)c(C#N)c1)CC2	ZINC001205472741	1370766208	/nfs/dbraw/zinc/76/62/08/1370766208.db2.gz	HWCRSKNMUZSVRT-HXUWFJFHSA-N	0	3	341.430	3.230	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H]2CCO[C@@H](CC)C2)CCCCC1	ZINC001115809189	1370791859	/nfs/dbraw/zinc/79/18/59/1370791859.db2.gz	BLBSQEFJAGOJPD-HOTGVXAUSA-N	0	3	342.911	3.353	20	30		EGEDHN
Cc1nc(C(=O)N[C@H](CN2CCCCC2)c2ccccc2)ccc1C#N	ZINC001325968974	1388098806	/nfs/dbraw/zinc/09/88/06/1388098806.db2.gz	QOXQPFWMCZRGPT-HXUWFJFHSA-N	0	3	348.450	3.219	20	30		EGEDHN
N#CCOc1ccc(CN2CCC(n3cc(Cl)cn3)CC2)cc1	ZINC001116508915	1370926603	/nfs/dbraw/zinc/92/66/03/1370926603.db2.gz	GXRZNUSZVFIRPU-UHFFFAOYSA-N	0	3	330.819	3.276	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC(CNCc2nc(C)cs2)CC1	ZINC001205981054	1370928472	/nfs/dbraw/zinc/92/84/72/1370928472.db2.gz	JWOLNVZZMZBYTI-CQSZACIVSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC(CNCc2oc(CC)nc2C)CC1	ZINC001205989847	1370931568	/nfs/dbraw/zinc/93/15/68/1370931568.db2.gz	XRXKTHKPEUPRSZ-OAHLLOKOSA-N	0	3	347.503	3.476	20	30		EGEDHN
C=CCCCC(=O)N1CCC(CNCc2oc(CC)nc2C)CC1	ZINC001206106037	1370961233	/nfs/dbraw/zinc/96/12/33/1370961233.db2.gz	SZGKMQKEIGIRLP-UHFFFAOYSA-N	0	3	333.476	3.230	20	30		EGEDHN
CC(C)(C)OC(=O)NCc1ccccc1CN[C@H]1CC[C@@H](C#N)C1	ZINC001116910361	1370999600	/nfs/dbraw/zinc/99/96/00/1370999600.db2.gz	FTOQOPCJIJROHF-PBHICJAKSA-N	0	3	329.444	3.493	20	30		EGEDHN
C[C@@H](NCc1cccc(OCC#N)c1)c1ccccc1-n1ccnn1	ZINC001117113959	1371012190	/nfs/dbraw/zinc/01/21/90/1371012190.db2.gz	XPLRAOPMSISYAN-OAHLLOKOSA-N	0	3	333.395	3.020	20	30		EGEDHN
CC[C@H](c1ccc(F)cc1)N1C[C@@H](C)[C@H](NC(=O)C#CC(C)C)C1	ZINC001206947021	1371239543	/nfs/dbraw/zinc/23/95/43/1371239543.db2.gz	BJGFBZQDXHRMJG-ATZDWAIDSA-N	0	3	330.447	3.373	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1CN(Cc2ccc3ccccc3c2)C[C@H]1C	ZINC001206947403	1371239863	/nfs/dbraw/zinc/23/98/63/1371239863.db2.gz	SSGZGMXIGWUNJP-DYESRHJHSA-N	0	3	334.463	3.436	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)C[C@H](C)Cc2cccc(F)c2)C1	ZINC001206973795	1371253775	/nfs/dbraw/zinc/25/37/75/1371253775.db2.gz	WHLNPUQPGDEJMR-GPMSIDNRSA-N	0	3	332.463	3.407	20	30		EGEDHN
O=C(C1CCCCC1)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207091229	1371290347	/nfs/dbraw/zinc/29/03/47/1371290347.db2.gz	NJUSUAIDMQICOZ-HXUWFJFHSA-N	0	3	342.458	3.338	20	30		EGEDHN
C[C@@H]1CC[C@H](CNC(=O)OC(C)(C)C)CN1Cc1cc(C#N)n(C)c1	ZINC001207102574	1371294510	/nfs/dbraw/zinc/29/45/10/1371294510.db2.gz	BRPKNGWHTJFKIG-HUUCEWRRSA-N	0	3	346.475	3.022	20	30		EGEDHN
CCCCC(=O)N1CCC[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001207372135	1371378232	/nfs/dbraw/zinc/37/82/32/1371378232.db2.gz	BFUCTEKAFWIOEX-KRWDZBQOSA-N	0	3	332.875	3.462	20	30		EGEDHN
C/C(=C\C(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1)C1CC1	ZINC001207548878	1371432554	/nfs/dbraw/zinc/43/25/54/1371432554.db2.gz	BTEZABNCQGTEJV-VISDOYDDSA-N	0	3	340.442	3.114	20	30		EGEDHN
CCC[C@@H](C)CC(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001207644410	1371461878	/nfs/dbraw/zinc/46/18/78/1371461878.db2.gz	DRIQTIWESPLDFO-QUCCMNQESA-N	0	3	326.484	3.445	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001207654634	1371465373	/nfs/dbraw/zinc/46/53/73/1371465373.db2.gz	SQZZFTJDURLWTN-KRWDZBQOSA-N	0	3	330.859	3.238	20	30		EGEDHN
CC(C)(C)/C=C/C(=O)N1CCC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001207710838	1371481818	/nfs/dbraw/zinc/48/18/18/1371481818.db2.gz	SJYQWBLMGULWCP-IJDCCNJMSA-N	0	3	343.446	3.380	20	30		EGEDHN
Cc1cscc1C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001207754818	1371494934	/nfs/dbraw/zinc/49/49/34/1371494934.db2.gz	RTVKDBUYVAFXSJ-SFHVURJKSA-N	0	3	338.476	3.302	20	30		EGEDHN
O=C(C=C1CCC1)N1CCC[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001207776159	1371500649	/nfs/dbraw/zinc/50/06/49/1371500649.db2.gz	IHTSPQRZSIWCDM-SFHVURJKSA-N	0	3	342.870	3.382	20	30		EGEDHN
CCc1occc1C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001207959363	1371551559	/nfs/dbraw/zinc/55/15/59/1371551559.db2.gz	SQXNHUURKBQXSL-GOSISDBHSA-N	0	3	336.435	3.088	20	30		EGEDHN
CC1(C(=O)N2CCC[C@@H](NCC#Cc3ccccc3Cl)C2)CC1	ZINC001208101884	1371596073	/nfs/dbraw/zinc/59/60/73/1371596073.db2.gz	YTPDXXWRRZTGKY-MRXNPFEDSA-N	0	3	330.859	3.072	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC[C@H](NCc2ccc(C#N)s2)C1	ZINC001208194487	1371634702	/nfs/dbraw/zinc/63/47/02/1371634702.db2.gz	RJARYBWBJYKWIQ-INIZCTEOSA-N	0	3	343.496	3.469	20	30		EGEDHN
C=C(Br)CNC1CC2(C1)CC(NC(=O)CCC(C)C)C2	ZINC001120606170	1371642575	/nfs/dbraw/zinc/64/25/75/1371642575.db2.gz	JVQSLLVWFPGGGY-UHFFFAOYSA-N	0	3	343.309	3.348	20	30		EGEDHN
CC[C@@H](C)C(=O)NC1CC2(CC(NCc3ccccc3C#N)C2)C1	ZINC001120657927	1371687791	/nfs/dbraw/zinc/68/77/91/1371687791.db2.gz	KIJQGZUOSYPYEQ-YDAHYDFVSA-N	0	3	325.456	3.121	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN(CCOc2cccc(CC)c2)C[C@H]1C	ZINC001208318183	1371715171	/nfs/dbraw/zinc/71/51/71/1371715171.db2.gz	NTQJWCKQRSSQFY-VQIMIIECSA-N	0	3	344.499	3.277	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CN(CCOc2ccc(F)cc2)C[C@H]1C	ZINC001208391632	1371750402	/nfs/dbraw/zinc/75/04/02/1371750402.db2.gz	RFWXBIXRVSYXIC-GPMSIDNRSA-N	0	3	348.462	3.243	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN(CCOc2cc(C)ccc2C)C[C@H]1C	ZINC001208458358	1371774525	/nfs/dbraw/zinc/77/45/25/1371774525.db2.gz	FNRKVUKXEAERMO-RTBURBONSA-N	0	3	344.499	3.475	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1CN(CCOCc2ccccc2)C[C@H]1C	ZINC001208512039	1371794190	/nfs/dbraw/zinc/79/41/90/1371794190.db2.gz	SRHJCWSBTJNZMS-YFVAEKQCSA-N	0	3	344.499	3.242	20	30		EGEDHN
CC(C)(C)[C@@H]1C[C@H]1C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001208542131	1371808814	/nfs/dbraw/zinc/80/88/14/1371808814.db2.gz	MGJSMZWNNQOMIY-VAMGGRTRSA-N	0	3	338.495	3.301	20	30		EGEDHN
CC1(CC(=O)N2CCC[C@H](NCC#Cc3ccc(Cl)cc3)C2)CC1	ZINC001208587608	1371828628	/nfs/dbraw/zinc/82/86/28/1371828628.db2.gz	HOYNZHLISWEUMO-SFHVURJKSA-N	0	3	344.886	3.462	20	30		EGEDHN
C=C(C)CCC(=O)NC1CC2(CC(NCc3ccn(C(C)C)n3)C2)C1	ZINC001121183170	1371881809	/nfs/dbraw/zinc/88/18/09/1371881809.db2.gz	DRHVJRZMJPOEKD-UHFFFAOYSA-N	0	3	344.503	3.337	20	30		EGEDHN
O=C(c1occ2c1CCC2)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001208748753	1371883851	/nfs/dbraw/zinc/88/38/51/1371883851.db2.gz	LETIVCZIFLDYET-IBGZPJMESA-N	0	3	348.446	3.014	20	30		EGEDHN
O=C(N1CCC[C@@H](NCC#Cc2ccccc2)C1)C1(C2CC2)CCC1	ZINC001208770237	1371890307	/nfs/dbraw/zinc/89/03/07/1371890307.db2.gz	RCJQLAPRUHQXJJ-HXUWFJFHSA-N	0	3	336.479	3.199	20	30		EGEDHN
COC(=O)CCN(CCCc1ccc(C#N)cc1)Cc1ccco1	ZINC001208856139	1371920376	/nfs/dbraw/zinc/92/03/76/1371920376.db2.gz	AZHAWBKJXFXGBX-UHFFFAOYSA-N	0	3	326.396	3.149	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CN(CCCOc2ccccc2)C[C@H]1C	ZINC001208933241	1371952161	/nfs/dbraw/zinc/95/21/61/1371952161.db2.gz	NRSURQNWCXPWOW-IEBWSBKVSA-N	0	3	344.499	3.494	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC[C@H](NCc2ccc(C#N)s2)C1	ZINC001209146318	1372013798	/nfs/dbraw/zinc/01/37/98/1372013798.db2.gz	NKWUNQNOSPTKAM-GJZGRUSLSA-N	0	3	331.485	3.303	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@@H](NCc2ccc(C#N)s2)C1	ZINC001209146319	1372013829	/nfs/dbraw/zinc/01/38/29/1372013829.db2.gz	NKWUNQNOSPTKAM-HUUCEWRRSA-N	0	3	331.485	3.303	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC[C@@H](NCc2cc(CO)ccc2F)C1	ZINC001209183783	1372028899	/nfs/dbraw/zinc/02/88/99/1372028899.db2.gz	PVNIRQRHIGGAAC-CRAIPNDOSA-N	0	3	348.462	3.001	20	30		EGEDHN
C[C@H]1CC(CN2CCN(c3ccc(C#N)cc3F)CC2)C[C@H](C)O1	ZINC001209400102	1372092197	/nfs/dbraw/zinc/09/21/97/1372092197.db2.gz	XFZOKJTZLPYNOQ-GJZGRUSLSA-N	0	3	331.435	3.023	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC1CC2(CC(NCc3ocnc3C)C2)C1	ZINC001121841891	1372099269	/nfs/dbraw/zinc/09/92/69/1372099269.db2.gz	RVEWIHKDTRJKER-UHFFFAOYSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=CCCCCCCCCN1C[C@@H]2[C@H](C1)OCCN2c1ncccn1	ZINC001209442201	1372106853	/nfs/dbraw/zinc/10/68/53/1372106853.db2.gz	BOSQLNNLSRGBAV-MOPGFXCFSA-N	0	3	344.503	3.283	20	30		EGEDHN
C=CCCCCCCN1CCN(c2ncccc2C(=O)N(C)C)CC1	ZINC001209440082	1372107308	/nfs/dbraw/zinc/10/73/08/1372107308.db2.gz	AFTQWALRMXTORA-UHFFFAOYSA-N	0	3	344.503	3.042	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)CCCC(=O)OC(C)(C)C	ZINC001122023794	1372155073	/nfs/dbraw/zinc/15/50/73/1372155073.db2.gz	SSMSCQQECJXIIW-ZDUSSCGKSA-N	0	3	341.411	3.262	20	30		EGEDHN
CC(C)C[C@H](C)C(=O)N1CCC[C@H](NCc2ccc(C#N)s2)C1	ZINC001210358935	1372331838	/nfs/dbraw/zinc/33/18/38/1372331838.db2.gz	RGBZQHIETKICEK-GJZGRUSLSA-N	0	3	333.501	3.383	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)[C@H]1CCOC(C)(C)C1)c1ccccc1	ZINC001122898325	1372337968	/nfs/dbraw/zinc/33/79/68/1372337968.db2.gz	UTIKOSLXLHYXPZ-ULQDDVLXSA-N	0	3	342.439	3.168	20	30		EGEDHN
C#CCC1(C(=O)N2CCC[C@@H](NCc3cccnc3)C2)CCCCC1	ZINC001211360264	1372540065	/nfs/dbraw/zinc/54/00/65/1372540065.db2.gz	HSYLWHXOLLVFAY-LJQANCHMSA-N	0	3	339.483	3.136	20	30		EGEDHN
C=C(CN1CCCCC1)c1nc(-c2cc(Cl)cnc2OC)no1	ZINC001211436796	1372558862	/nfs/dbraw/zinc/55/88/62/1372558862.db2.gz	XWJKAUZBEFQCPW-UHFFFAOYSA-N	0	3	334.807	3.293	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](c2ccccc2)[C@H](NCc2ncccc2C)C1	ZINC001211551405	1372578649	/nfs/dbraw/zinc/57/86/49/1372578649.db2.gz	NCGFCUNOXDPHJO-PZJWPPBQSA-N	0	3	349.478	3.440	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](c2ccccc2)[C@H](NC/C=C/Cl)C1	ZINC001211586794	1372586636	/nfs/dbraw/zinc/58/66/36/1372586636.db2.gz	ZQZWHECFXOEKNJ-QGWFOHBRSA-N	0	3	330.859	3.127	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@@H]2C[C@@H]3C=C[C@H]2CC3)C[C@H]1c1ccccc1	ZINC001211604992	1372589059	/nfs/dbraw/zinc/58/90/59/1372589059.db2.gz	BIMYZKFREQOPOD-KMKNWIINSA-N	0	3	348.490	3.196	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2cscc2C)[C@H](OC)C1	ZINC001212081601	1372654287	/nfs/dbraw/zinc/65/42/87/1372654287.db2.gz	PJTPPEBEBUYFAE-IAGOWNOFSA-N	0	3	338.517	3.456	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2ccoc2Cl)[C@H](OC)C1	ZINC001212175300	1372667224	/nfs/dbraw/zinc/66/72/24/1372667224.db2.gz	MJRIJOXZUQRYJR-HUUCEWRRSA-N	0	3	342.867	3.332	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CN([C@@H](C)c2ccccc2)C[C@H]1OC	ZINC001212333019	1372688775	/nfs/dbraw/zinc/68/87/75/1372688775.db2.gz	TWILHRHLSYIEQE-CGTJXYLNSA-N	0	3	330.472	3.165	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1CN(Cc2c(C)cccc2C)C[C@H]1OC	ZINC001213320061	1372883519	/nfs/dbraw/zinc/88/35/19/1372883519.db2.gz	LJXUDSNEUQLXOQ-DFQSSKMNSA-N	0	3	344.499	3.221	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2ccccc2CC)[C@H](OC)C1	ZINC001213339807	1372888058	/nfs/dbraw/zinc/88/80/58/1372888058.db2.gz	BINZKHVFINBPLB-WOJBJXKFSA-N	0	3	344.499	3.424	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN(Cc2ccccc2C(C)C)C[C@H]1OC	ZINC001213357347	1372891728	/nfs/dbraw/zinc/89/17/28/1372891728.db2.gz	QFJTUZBQVKXYPL-WOJBJXKFSA-N	0	3	344.499	3.482	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2ccc(Cl)cc2C)[C@H](OC)C1	ZINC001213370500	1372894293	/nfs/dbraw/zinc/89/42/93/1372894293.db2.gz	HLSDNWQZDGAGSW-IAGOWNOFSA-N	0	3	336.863	3.044	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)[C@H](c2ccccc2)C(C)C)[C@H](OC)C1	ZINC001213493842	1372914304	/nfs/dbraw/zinc/91/43/04/1372914304.db2.gz	IXISLTAFYXMEFU-AQNXPRMDSA-N	0	3	344.499	3.208	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)C2(F)CCCCC2)[C@H](OC)C1	ZINC001213666936	1372942203	/nfs/dbraw/zinc/94/22/03/1372942203.db2.gz	NSXOFUSDMRXNLZ-IAGOWNOFSA-N	0	3	340.483	3.221	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)C(=O)N[C@@H]1CN(CCCC)C[C@H]1OC	ZINC001213895104	1372976438	/nfs/dbraw/zinc/97/64/38/1372976438.db2.gz	IJFPXCDABHVFGZ-XUVXKRRUSA-N	0	3	344.499	3.037	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2CN(CC/C=C/CC)C[C@H]2OC)CCCCC1	ZINC001213957482	1372986963	/nfs/dbraw/zinc/98/69/63/1372986963.db2.gz	GFXJIIUHZPYPGA-LXORQPIJSA-N	0	3	346.515	3.132	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H]2CN(CCOc3ccccc3C)C[C@H]21	ZINC001188080810	1388237081	/nfs/dbraw/zinc/23/70/81/1388237081.db2.gz	LPMQHVHXWBUAGN-RBUKOAKNSA-N	0	3	342.483	3.263	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H]2CN(Cc3cccc(N(C)C)c3)C[C@H]21	ZINC001188080713	1388237297	/nfs/dbraw/zinc/23/72/97/1388237297.db2.gz	ICJALLLVAYGTIC-AZUAARDMSA-N	0	3	341.499	3.142	20	30		EGEDHN
C[C@@H]1CN(C(=O)/C=C\C2CC2)C[C@H]1NCC#Cc1cccc(Cl)c1	ZINC001214397487	1373054410	/nfs/dbraw/zinc/05/44/10/1373054410.db2.gz	WEQMIDFKFOBVHI-GVLOPJHWSA-N	0	3	342.870	3.094	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@@H](C)[C@H](NCc2cc(F)cc(F)c2)C1	ZINC001214466519	1373065751	/nfs/dbraw/zinc/06/57/51/1373065751.db2.gz	PQQLZBOAUCUVHR-RDTXWAMCSA-N	0	3	334.410	3.095	20	30		EGEDHN
CC[C@@H](C)CCCCC(=O)NCCNCc1ccc(OC)c(C#N)c1	ZINC001128158254	1373225893	/nfs/dbraw/zinc/22/58/93/1373225893.db2.gz	DKSSSIHQOJFCGD-MRXNPFEDSA-N	0	3	345.487	3.379	20	30		EGEDHN
CCC(CC)CC(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001216086420	1373260838	/nfs/dbraw/zinc/26/08/38/1373260838.db2.gz	WIJPEJKQBNOMCZ-AUUYWEPGSA-N	0	3	345.462	3.460	20	30		EGEDHN
CCCCCCCCC(=O)N1C[C@@H](C)[C@H](NCc2cn(C)nc2C)C1	ZINC001216525745	1373314038	/nfs/dbraw/zinc/31/40/38/1373314038.db2.gz	AMLJVOZAVSBFMQ-VQIMIIECSA-N	0	3	348.535	3.416	20	30		EGEDHN
C=C[C@@H](CC(=O)N1C[C@@H](C)[C@H](NCc2ccccn2)C1)c1ccccc1	ZINC001216811289	1373345886	/nfs/dbraw/zinc/34/58/86/1373345886.db2.gz	DWKYMCAYHWRSHO-LVCYWYKZSA-N	0	3	349.478	3.378	20	30		EGEDHN
C#CCC1(C(=O)NCCN[C@H](C)c2ccc(F)c(Cl)c2)CCC1	ZINC001129142901	1373352553	/nfs/dbraw/zinc/35/25/53/1373352553.db2.gz	NNXCHYVJRYOVQV-CYBMUJFWSA-N	0	3	336.838	3.440	20	30		EGEDHN
CCCCCCCCOCC(=O)NCCNCc1ccc(F)cc1	ZINC001129522670	1373393951	/nfs/dbraw/zinc/39/39/51/1373393951.db2.gz	HZEUPHJFBFCTSY-UHFFFAOYSA-N	0	3	338.467	3.409	20	30		EGEDHN
CC[C@@H]1CCC[C@@]1(C)C(=O)NCCNCc1ccc(C#N)c(F)c1	ZINC001130259049	1373479847	/nfs/dbraw/zinc/47/98/47/1373479847.db2.gz	VCNBDWBDRAGIFO-VQIMIIECSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2OCCN(C(=O)c3csc(C)c3C)[C@H]2C1	ZINC001217975972	1373523182	/nfs/dbraw/zinc/52/31/82/1373523182.db2.gz	IIGDKEJPLTUHND-DOPJRALCSA-N	0	3	348.512	3.245	20	30		EGEDHN
C=CCOc1ccc(C(=O)c2ccccc2)c(O[C@@H]2CNC[C@@H]2F)c1	ZINC001217998546	1373530892	/nfs/dbraw/zinc/53/08/92/1373530892.db2.gz	UYIZCEMWWKINLO-PKOBYXMFSA-N	0	3	341.382	3.171	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)CCCC[C@H](C)CC)[C@H]2C1	ZINC001218003897	1373532725	/nfs/dbraw/zinc/53/27/25/1373532725.db2.gz	LXVXJYSENKQATM-CEXWTWQISA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)C[C@@H](CC)C(C)(C)C)C1	ZINC001130442337	1373541530	/nfs/dbraw/zinc/54/15/30/1373541530.db2.gz	JDSANDYFVDEYNS-DOTOQJQBSA-N	0	3	346.519	3.464	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)C3C=CC=CC=C3)[C@H]2C1	ZINC001218032579	1373543882	/nfs/dbraw/zinc/54/38/82/1373543882.db2.gz	SCDGGZBCZIBLIW-VQTJNVASSA-N	0	3	344.499	3.167	20	30		EGEDHN
O=C(/C=C/c1ccccc1O[C@H]1CC[C@@H]2NCCO[C@H]21)c1ccccc1	ZINC001218149783	1373569990	/nfs/dbraw/zinc/56/99/90/1373569990.db2.gz	RIZYALRMAHRPAZ-UHVDOKLPSA-N	0	3	349.430	3.481	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)CCCCCC(C)C)C[C@H]1c1cn(C)cn1	ZINC001130687554	1373579732	/nfs/dbraw/zinc/57/97/32/1373579732.db2.gz	FWBNJIJUMVITCI-PKOBYXMFSA-N	0	3	346.519	3.097	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@H](CC)CCCCC)C[C@H]1c1cn(C)cn1	ZINC001130731892	1373585370	/nfs/dbraw/zinc/58/53/70/1373585370.db2.gz	SICHBLHWKNRBKT-ZIFCJYIRSA-N	0	3	346.519	3.097	20	30		EGEDHN
C=CCN1C[C@@H](OC)C[C@H]1Cn1ccc(NC(=O)CCCCCC)n1	ZINC001130873694	1373600672	/nfs/dbraw/zinc/60/06/72/1373600672.db2.gz	ZHRUNKUVCSBCGE-IRXDYDNUSA-N	0	3	348.491	3.067	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2cc3ccccc3s2)c1	ZINC001130924546	1373609233	/nfs/dbraw/zinc/60/92/33/1373609233.db2.gz	SCUPHBGDDQIEDY-UHFFFAOYSA-N	0	3	335.432	3.293	20	30		EGEDHN
Cc1cc(Br)cc(C#N)c1O[C@H]1CNCCC1(F)F	ZINC001218452338	1373616218	/nfs/dbraw/zinc/61/62/18/1373616218.db2.gz	JCXQYBLHHHKZBS-NSHDSACASA-N	0	3	331.160	3.005	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCO[C@@H]2CN(CCC3=CCCCC3)C[C@@H]21	ZINC001218516874	1373628174	/nfs/dbraw/zinc/62/81/74/1373628174.db2.gz	GTHRDGKQTWOKPK-YZGWKJHDSA-N	0	3	346.515	3.391	20	30		EGEDHN
CCCCc1ccc(C(=O)NCCNCc2ccc(C#N)cc2)cc1	ZINC001131032277	1373628312	/nfs/dbraw/zinc/62/83/12/1373628312.db2.gz	ULNXWDDPFUBJTK-UHFFFAOYSA-N	0	3	335.451	3.420	20	30		EGEDHN
CC(C)=C[C@H]1[C@@H](C(=O)NCCNCc2ccc(C#N)c(F)c2)C1(C)C	ZINC001131089066	1373641642	/nfs/dbraw/zinc/64/16/42/1373641642.db2.gz	WGMACXJDMKBKIU-WMZOPIPTSA-N	0	3	343.446	3.142	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)C[C@@H](C)CCCCC)[C@H]2C1	ZINC001218737538	1373649022	/nfs/dbraw/zinc/64/90/22/1373649022.db2.gz	NFPXPXQGBDYWOK-GBESFXJTSA-N	0	3	336.520	3.471	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)C2CCCCCCC2)ccc1F	ZINC001131146022	1373653145	/nfs/dbraw/zinc/65/31/45/1373653145.db2.gz	VWFZUMJEFYFMGT-UHFFFAOYSA-N	0	3	331.435	3.264	20	30		EGEDHN
CCc1cc(NC(=O)C[C@@H]([NH3+])c2ccccc2[O-])cc(CC)c1C#N	ZINC001219114889	1373688447	/nfs/dbraw/zinc/68/84/47/1373688447.db2.gz	RYNCDKRHAFPVOO-GOSISDBHSA-N	0	3	337.423	3.417	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)C(C)(C)C2CCCC2)[C@@H](O)C1	ZINC001219816068	1373733253	/nfs/dbraw/zinc/73/32/53/1373733253.db2.gz	XHYJZSRIQDISAG-MSOLQXFVSA-N	0	3	338.536	3.335	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C1(CCC)CCC1)C[C@@H](C)O2	ZINC001131673459	1373755559	/nfs/dbraw/zinc/75/55/59/1373755559.db2.gz	MLPWBZRJZKJRLV-YLJYHZDGSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCCC1(C(=O)N2C[C@H](C)O[C@@]3(CCN(CC(=C)C)C3)C2)CC1	ZINC001131688821	1373763820	/nfs/dbraw/zinc/76/38/20/1373763820.db2.gz	RYSKWBYOMBIGSG-FXAWDEMLSA-N	0	3	332.488	3.001	20	30		EGEDHN
CCCCCCCN1CC[C@@H]2CN(C(=O)c3onc(C)c3C)[C@@H]2C1	ZINC001221636466	1373785750	/nfs/dbraw/zinc/78/57/50/1373785750.db2.gz	QBMZHUMOFRQWIH-IAGOWNOFSA-N	0	3	333.476	3.408	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@H]3CCN(CCCOC(C)C)C[C@H]32)CCCC1	ZINC001222151329	1373817866	/nfs/dbraw/zinc/81/78/66/1373817866.db2.gz	GYOTVBMSZAFGNK-RTBURBONSA-N	0	3	348.531	3.471	20	30		EGEDHN
Cc1cc2occ(C(=O)NCCNCc3ccc(C#N)cc3)c2cc1C	ZINC001131828298	1373826409	/nfs/dbraw/zinc/82/64/09/1373826409.db2.gz	KFPNSFQAFVCXBD-UHFFFAOYSA-N	0	3	347.418	3.441	20	30		EGEDHN
Cc1cc(C)cc(CN2C[C@H](NC(=O)CSCC#N)CC[C@H]2C)c1	ZINC001131831293	1373829073	/nfs/dbraw/zinc/82/90/73/1373829073.db2.gz	ZEOLYFPTHMBVTP-SJLPKXTDSA-N	0	3	345.512	3.029	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@@H](C)N(Cc2cccc(OC)c2C)C1	ZINC001131894915	1375031877	/nfs/dbraw/zinc/03/18/77/1375031877.db2.gz	DAAXRXDEDBSUNL-CRAIPNDOSA-N	0	3	330.472	3.439	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC[C@@H](C)N(Cc2cccc3c2CCOC3)C1	ZINC001131896547	1375032578	/nfs/dbraw/zinc/03/25/78/1375032578.db2.gz	TYAQMTQYQZVYBG-APWZRJJASA-N	0	3	342.483	3.195	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC[C@@H](C)N(Cc2ccc(COC)cc2)C1	ZINC001131899673	1375035994	/nfs/dbraw/zinc/03/59/94/1375035994.db2.gz	NWSHOPHXXKFGQF-APWZRJJASA-N	0	3	330.472	3.268	20	30		EGEDHN
C[NH+](C)C1CCC(O/C(=N\[O-])c2ccccc2Br)CC1	ZINC001223884902	1375047340	/nfs/dbraw/zinc/04/73/40/1375047340.db2.gz	UMCMCRDYBFXVAJ-ICFOKQHNSA-N	0	3	341.249	3.474	20	30		EGEDHN
C=CCOCC(=O)N[C@@H]1CC[C@@H](C)N(Cc2ccccc2C2CC2)C1	ZINC001131947460	1375063075	/nfs/dbraw/zinc/06/30/75/1375063075.db2.gz	UPAYTKWWBLVVQV-VQIMIIECSA-N	0	3	342.483	3.236	20	30		EGEDHN
C=CCOCC(=O)N[C@H]1CC[C@@H](C)N(Cc2ccccc2C2CC2)C1	ZINC001131947457	1375063475	/nfs/dbraw/zinc/06/34/75/1375063475.db2.gz	UPAYTKWWBLVVQV-APWZRJJASA-N	0	3	342.483	3.236	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)Cc2ccc(C3CCC3)cc2)cc1	ZINC001131952947	1375067698	/nfs/dbraw/zinc/06/76/98/1375067698.db2.gz	GDYOFIJDDNSMEZ-UHFFFAOYSA-N	0	3	347.462	3.274	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@@H](C)N(CCOc2ccccc2C)C1	ZINC001131996288	1375089205	/nfs/dbraw/zinc/08/92/05/1375089205.db2.gz	SGGANJQIUHCPIJ-RTBURBONSA-N	0	3	342.483	3.146	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CC[C@H](C)N(Cc2cccc(OC)c2C)C1	ZINC001132003208	1375094331	/nfs/dbraw/zinc/09/43/31/1375094331.db2.gz	REASBICIASXGFJ-LPHOPBHVSA-N	0	3	342.483	3.276	20	30		EGEDHN
CCc1ccccc1CN1C[C@H](NC(=O)C#CC(C)C)CC[C@@H]1C	ZINC001132016001	1375099523	/nfs/dbraw/zinc/09/95/23/1375099523.db2.gz	CMLWDOBCDKAIKW-FXAWDEMLSA-N	0	3	326.484	3.378	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)COc2ccccc2C(C)C)CC1	ZINC001225363680	1375106669	/nfs/dbraw/zinc/10/66/69/1375106669.db2.gz	HVWYRKGAZCDVTP-UHFFFAOYSA-N	0	3	342.483	3.040	20	30		EGEDHN
C[C@@H]1CC[C@H](NC(=O)C#CC(C)(C)C)CN1CC1CC(F)(F)C1	ZINC001132037424	1375111007	/nfs/dbraw/zinc/11/10/07/1375111007.db2.gz	BRNNMMUIDACCCW-HIFRSBDPSA-N	0	3	326.431	3.050	20	30		EGEDHN
C[C@@H]1CC[C@@H](NC(=O)C#CC2CC2)CN1CCCc1ccsc1	ZINC001132045151	1375114502	/nfs/dbraw/zinc/11/45/02/1375114502.db2.gz	AUEGXYAROJOZKP-CRAIPNDOSA-N	0	3	330.497	3.063	20	30		EGEDHN
C[C@H]1CC[C@@H](NC(=O)C#CC2CC2)CN1CCCc1cccc(F)c1	ZINC001132046701	1375116112	/nfs/dbraw/zinc/11/61/12/1375116112.db2.gz	QPGGDILOTWGESA-OXJNMPFZSA-N	0	3	342.458	3.141	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCOc2cccc(C)c2C)CC[C@@H]1C	ZINC001132094150	1375141929	/nfs/dbraw/zinc/14/19/29/1375141929.db2.gz	HUYZTARMJUHKHI-WMZOPIPTSA-N	0	3	330.472	3.227	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2CC[C@@H](C)N(CCOCCC(C)C)C2)CCC1	ZINC001132101782	1375148874	/nfs/dbraw/zinc/14/88/74/1375148874.db2.gz	OITSPYVPUCVRNB-RTBURBONSA-N	0	3	348.531	3.212	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCc2ccc(OC)c(F)c2)CC[C@@H]1C	ZINC001132168949	1375183966	/nfs/dbraw/zinc/18/39/66/1375183966.db2.gz	HQYOUIAMHDDWIP-RDJZCZTQSA-N	0	3	348.462	3.312	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2ocnc2C(F)(F)F)CC[C@@H]1C	ZINC001132195813	1375201859	/nfs/dbraw/zinc/20/18/59/1375201859.db2.gz	VWTRZNJAJFGWJX-RYUDHWBXSA-N	0	3	345.365	3.242	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2c(C)cc(F)cc2C)CC[C@H]1C	ZINC001132215559	1375215208	/nfs/dbraw/zinc/21/52/08/1375215208.db2.gz	ZSSKKGQGUPSBOY-AEFFLSMTSA-N	0	3	348.462	3.228	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1CC[C@H](C)N(Cc2ccc(CO)cc2)C1	ZINC001132256285	1375250505	/nfs/dbraw/zinc/25/05/05/1375250505.db2.gz	MBHPSYPPFMEVMC-LPHOPBHVSA-N	0	3	330.472	3.004	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CC[C@@H](C)N(CCOC3CCC3)C2)CCC1	ZINC001132283009	1375265852	/nfs/dbraw/zinc/26/58/52/1375265852.db2.gz	PTLMEYVFFYYLAP-IAGOWNOFSA-N	0	3	334.504	3.271	20	30		EGEDHN
C=CCOCCCC(=O)NC1CCN([C@H](C)c2ccc(F)cc2)CC1	ZINC001226777822	1375331759	/nfs/dbraw/zinc/33/17/59/1375331759.db2.gz	HJQPJMBJOAYOSY-MRXNPFEDSA-N	0	3	348.462	3.450	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2cccc(Cl)c2)CC[C@@H]1C	ZINC001132437498	1375382287	/nfs/dbraw/zinc/38/22/87/1375382287.db2.gz	VKQWIXYOJBTWLB-YOEHRIQHSA-N	0	3	336.863	3.125	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1CC[C@@H](C)N(Cc2cccc(CC)c2)C1	ZINC001132529287	1375443151	/nfs/dbraw/zinc/44/31/51/1375443151.db2.gz	LAKXOXXFFFMKIH-XLIONFOSSA-N	0	3	344.499	3.311	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2(CCc3ccccc3)CC2)CC[C@@H]1C	ZINC001132551538	1375457540	/nfs/dbraw/zinc/45/75/40/1375457540.db2.gz	JAABMSDOJVLVFM-AZUAARDMSA-N	0	3	338.495	3.392	20	30		EGEDHN
C#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)[C@@H](C)CCC)CC1	ZINC001132554201	1375459773	/nfs/dbraw/zinc/45/97/73/1375459773.db2.gz	DAGJZLMIKFKAFZ-ICSRJNTNSA-N	0	3	341.499	3.334	20	30		EGEDHN
C#CCN1CC[C@@H](CN(Cc2scnc2C)C(=O)CCCCC)C1	ZINC001132557696	1375464267	/nfs/dbraw/zinc/46/42/67/1375464267.db2.gz	CGQPXJVGPKAJHC-QGZVFWFLSA-N	0	3	347.528	3.316	20	30		EGEDHN
CC#CCN1CC[C@@H](CN(Cc2scnc2C)C(=O)/C(C)=C\C)C1	ZINC001132557624	1375464364	/nfs/dbraw/zinc/46/43/64/1375464364.db2.gz	ACHAWGUJWNSGSK-MISIWFIQSA-N	0	3	345.512	3.092	20	30		EGEDHN
CC#CCN1CC[C@H](CN(Cc2scnc2C)C(=O)[C@@H](C)CC)C1	ZINC001132559075	1375466177	/nfs/dbraw/zinc/46/61/77/1375466177.db2.gz	SNVMPAWEGQOCFY-RDJZCZTQSA-N	0	3	347.528	3.171	20	30		EGEDHN
C#CCN1CC[C@@H](CN(Cc2scnc2C)C(=O)CC(C)(C)C)C1	ZINC001132559549	1375467866	/nfs/dbraw/zinc/46/78/66/1375467866.db2.gz	XGEHPMIHCLOYGG-MRXNPFEDSA-N	0	3	347.528	3.171	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2N(Cc2ccsc2)C(=O)CCC)CC1	ZINC001132562299	1375468311	/nfs/dbraw/zinc/46/83/11/1375468311.db2.gz	HKQBIWSTYLZCPN-QGZVFWFLSA-N	0	3	330.497	3.365	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2N(Cc2ccsc2)C(=O)[C@H](F)CC)CC1	ZINC001132561897	1375468711	/nfs/dbraw/zinc/46/87/11/1375468711.db2.gz	BMOISVXBNJNTGU-SJORKVTESA-N	0	3	348.487	3.313	20	30		EGEDHN
CCCCC(=O)N1CC[C@@H](C)[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001132670620	1375507549	/nfs/dbraw/zinc/50/75/49/1375507549.db2.gz	VKILFRUPNHVGFC-CRAIPNDOSA-N	0	3	345.462	3.462	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@@H](C)[C@@H](CNCc2c(F)cccc2F)C1	ZINC001132810579	1375577206	/nfs/dbraw/zinc/57/72/06/1375577206.db2.gz	YGLCPJAGFZJQKZ-CVEARBPZSA-N	0	3	348.437	3.198	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](C)[C@H](CNCc2cscn2)C1	ZINC001132851582	1375601792	/nfs/dbraw/zinc/60/17/92/1375601792.db2.gz	WHVBIZKZASAZFR-DOTOQJQBSA-N	0	3	347.528	3.486	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](C)[C@H](CNCc3cc(C)no3)C2)CC1	ZINC001133104825	1375777306	/nfs/dbraw/zinc/77/73/06/1375777306.db2.gz	KUMAZNJORGZEGL-NVXWUHKLSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](C)[C@H](CNCc2nccn2CC)C1	ZINC001133142859	1375804454	/nfs/dbraw/zinc/80/44/54/1375804454.db2.gz	PSGIMDYFWKENGR-DLBZAZTESA-N	0	3	346.519	3.080	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2cc(C(C)(C)C)oc2C)CC1	ZINC001229364087	1375818277	/nfs/dbraw/zinc/81/82/77/1375818277.db2.gz	UDHYGNMLXHIINJ-UHFFFAOYSA-N	0	3	348.487	3.282	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)CCCCc2ccccc2)c1	ZINC001133208357	1375841313	/nfs/dbraw/zinc/84/13/13/1375841313.db2.gz	GKYLIQSPEMIOEI-UHFFFAOYSA-N	0	3	335.451	3.177	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)c2cccc(Cl)c2F)ccc1F	ZINC001133215861	1375848132	/nfs/dbraw/zinc/84/81/32/1375848132.db2.gz	SIMXRNQHXDQINH-UHFFFAOYSA-N	0	3	349.768	3.009	20	30		EGEDHN
Cc1cc(C(=O)NCCNCc2ccc(C#N)s2)ccc1Cl	ZINC001133248303	1375868057	/nfs/dbraw/zinc/86/80/57/1375868057.db2.gz	ABCXLUBQQMYOFZ-UHFFFAOYSA-N	0	3	333.844	3.101	20	30		EGEDHN
Cc1cc(Cl)ccc1C(=O)NCCNCc1ccc(C#N)s1	ZINC001133252118	1375870737	/nfs/dbraw/zinc/87/07/37/1375870737.db2.gz	MBYTWFOLPSECPG-UHFFFAOYSA-N	0	3	333.844	3.101	20	30		EGEDHN
N#CC1(c2ccc(O[C@H]3CC[C@H](N4CCOCC4)CC3)cc2)CC1	ZINC001229944310	1375922386	/nfs/dbraw/zinc/92/23/86/1375922386.db2.gz	MUTLBJBQEWSBNF-UAPYVXQJSA-N	0	3	326.440	3.264	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H](F)Cc1ccccc1	ZINC001230236455	1375975378	/nfs/dbraw/zinc/97/53/78/1375975378.db2.gz	PDZZYJXEXJJVAW-GVDBMIGSSA-N	0	3	338.854	3.337	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C(C)=C1CCC1	ZINC001133398428	1375982729	/nfs/dbraw/zinc/98/27/29/1375982729.db2.gz	VPVPJFSIUYTUJC-UHFFFAOYSA-N	0	3	330.859	3.392	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)/C=C\c1ccco1	ZINC001133516165	1376051327	/nfs/dbraw/zinc/05/13/27/1376051327.db2.gz	XAGTVFLGBWYLQT-FAVCKAPTSA-N	0	3	341.249	3.074	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)c1ccccc1)NCc1cc(F)ccc1C#N	ZINC001133526658	1376062994	/nfs/dbraw/zinc/06/29/94/1376062994.db2.gz	WZOAMQYDECNJSO-HUUCEWRRSA-N	0	3	339.414	3.384	20	30		EGEDHN
C=CCCC(=O)N1CCC([C@@H]2CCCN2Cc2snnc2C)CC1	ZINC001230538573	1376063366	/nfs/dbraw/zinc/06/33/66/1376063366.db2.gz	WMTNFMXIIOQXNF-INIZCTEOSA-N	0	3	348.516	3.016	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)c1cccc(F)c1)NCc1ccccc1C#N	ZINC001133576313	1376101555	/nfs/dbraw/zinc/10/15/55/1376101555.db2.gz	GEGULSCCIOWZIB-HUUCEWRRSA-N	0	3	339.414	3.384	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2ccccc2OC2CCC2)c1	ZINC001133612974	1376120822	/nfs/dbraw/zinc/12/08/22/1376120822.db2.gz	XRCKYCQCQULSQJ-UHFFFAOYSA-N	0	3	349.434	3.009	20	30		EGEDHN
C[C@H](CC(=O)NCCNCc1ccc(C#N)s1)c1cccc(F)c1	ZINC001133612069	1376121384	/nfs/dbraw/zinc/12/13/84/1376121384.db2.gz	JRACFAKEGWNPRE-CYBMUJFWSA-N	0	3	345.443	3.158	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)CCc1ccco1)NCc1ccccc1C#N	ZINC001133648744	1376135519	/nfs/dbraw/zinc/13/55/19/1376135519.db2.gz	GCXQCKXKMNXQIU-HOTGVXAUSA-N	0	3	339.439	3.157	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)C1CC(C)(C)C1)Cc1cccnc1	ZINC001230748600	1376139590	/nfs/dbraw/zinc/13/95/90/1376139590.db2.gz	SFQFHPMQFMQKMY-UHFFFAOYSA-N	0	3	329.488	3.402	20	30		EGEDHN
C#CCCN(CCCNC(=O)[C@]1(C)CC=CCC1)Cc1cccnc1	ZINC001230769409	1376145308	/nfs/dbraw/zinc/14/53/08/1376145308.db2.gz	PCXQBQONDSRMLR-OAQYLSRUSA-N	0	3	339.483	3.160	20	30		EGEDHN
C#CCCN(CCCNC(=O)[C@@H]1CCC(C)(C)C1)Cc1cccnc1	ZINC001230840575	1376165037	/nfs/dbraw/zinc/16/50/37/1376165037.db2.gz	ALLAGKDVZIMVCB-LJQANCHMSA-N	0	3	341.499	3.240	20	30		EGEDHN
C#CCCN(CCCNC(=O)[C@H](C)CC(C)(C)C)Cc1cccnc1	ZINC001230861244	1376169552	/nfs/dbraw/zinc/16/95/52/1376169552.db2.gz	FHDPNWZRPPSPPN-GOSISDBHSA-N	0	3	343.515	3.486	20	30		EGEDHN
C#CCCN(CCCNC(=O)c1cccc(C)c1C)Cc1cccnc1	ZINC001230912199	1376182436	/nfs/dbraw/zinc/18/24/36/1376182436.db2.gz	ZPLOJXHFNGHTEZ-UHFFFAOYSA-N	0	3	349.478	3.344	20	30		EGEDHN
CCSCCC(=O)N[C@@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001133806980	1376213188	/nfs/dbraw/zinc/21/31/88/1376213188.db2.gz	DWCUYOWVONVNRW-CABCVRRESA-N	0	3	333.501	3.074	20	30		EGEDHN
C/C(=C\C(=O)N[C@H](C)C[C@@H](C)NCc1ccccc1C#N)C1CC1	ZINC001133872553	1376245456	/nfs/dbraw/zinc/24/54/56/1376245456.db2.gz	WMIKNJCWDCCMBC-YYOKVSEPSA-N	0	3	325.456	3.287	20	30		EGEDHN
C=CCCC(=O)N[C@H](C)C[C@H](C)NCc1nc2ccc(F)cc2o1	ZINC001133887703	1376250799	/nfs/dbraw/zinc/25/07/99/1376250799.db2.gz	BFORZQDLGPRUGD-QWHCGFSZSA-N	0	3	333.407	3.306	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)CCC(F)(F)F)NCc1ccccc1C#N	ZINC001134003623	1376306651	/nfs/dbraw/zinc/30/66/51/1376306651.db2.gz	LCOGDQUECGKFRB-CHWSQXEVSA-N	0	3	341.377	3.274	20	30		EGEDHN
C=CCOCCCC(=O)N[C@H](C)C[C@@H](C)NC/C(Cl)=C\Cl	ZINC001134019120	1376316096	/nfs/dbraw/zinc/31/60/96/1376316096.db2.gz	RUKIKFMLSKRIPH-HUPKAIDTSA-N	0	3	337.291	3.161	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)CC1CCC1)NCc1cc(F)ccc1C#N	ZINC001134027132	1376317844	/nfs/dbraw/zinc/31/78/44/1376317844.db2.gz	ZCFQBXLYZJZEKM-ZIAGYGMSSA-N	0	3	331.435	3.260	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)CCC1CCC1	ZINC001134036087	1376323050	/nfs/dbraw/zinc/32/30/50/1376323050.db2.gz	ZMTVSLQMSYOPFU-OLZOCXBDSA-N	0	3	331.298	3.348	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)c1oc(C)cc1C	ZINC001134042112	1376327626	/nfs/dbraw/zinc/32/76/26/1376327626.db2.gz	KZZIMHZMIFAWJB-NEPJUHHUSA-N	0	3	343.265	3.292	20	30		EGEDHN
C=CCN1C(=O)CC[C@@]12CCCN(Cc1cnc(F)c(C)c1)CC2	ZINC001231928488	1376355304	/nfs/dbraw/zinc/35/53/04/1376355304.db2.gz	NSKREORKHADVJR-LJQANCHMSA-N	0	3	331.435	3.062	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CCN(Cc3cc(C)nc(C)c3)C2)C1	ZINC001231995080	1376375019	/nfs/dbraw/zinc/37/50/19/1376375019.db2.gz	GWIHOZWIKVBLGR-HXUWFJFHSA-N	0	3	343.471	3.309	20	30		EGEDHN
C#CCCCCC(=O)N[C@H](C)C[C@@H](C)NCc1ccncc1Cl	ZINC001134115571	1376375601	/nfs/dbraw/zinc/37/56/01/1376375601.db2.gz	UOJXAHVZQXJZBX-HUUCEWRRSA-N	0	3	335.879	3.302	20	30		EGEDHN
N#Cc1ccccc1O[C@H]1CCCN(Cc2cc3c[nH]ccc-3n2)C1	ZINC001232015445	1376384534	/nfs/dbraw/zinc/38/45/34/1376384534.db2.gz	IVJGFJRZMGGARB-SFHVURJKSA-N	0	3	332.407	3.478	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](O)[C@@H]2Cc2ccccc2)cc1Cl	ZINC001232114013	1376400731	/nfs/dbraw/zinc/40/07/31/1376400731.db2.gz	BDRUJKGYEQNKRO-RBUKOAKNSA-N	0	3	326.827	3.390	20	30		EGEDHN
C#CCCCC(=O)N[C@H](C)C[C@H](C)NCc1nsc2ccccc12	ZINC001134206496	1376418572	/nfs/dbraw/zinc/41/85/72/1376418572.db2.gz	VRCBLAPIUFENOR-LSDHHAIUSA-N	0	3	343.496	3.473	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)c1ccoc1Cl)NCc1ccccc1C#N	ZINC001134252716	1376436728	/nfs/dbraw/zinc/43/67/28/1376436728.db2.gz	UEBHWEDLLADEKO-STQMWFEESA-N	0	3	345.830	3.491	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)C2[C@H]3CCCCCC[C@H]23)cc1F	ZINC001134315472	1376471933	/nfs/dbraw/zinc/47/19/33/1376471933.db2.gz	ZOYKOQRLFXRHDN-IRXDYDNUSA-N	0	3	343.446	3.120	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)C#CC1CC1)NCc1c(F)cccc1Cl	ZINC001134321937	1376475368	/nfs/dbraw/zinc/47/53/68/1376475368.db2.gz	NCZCSLDYAABSPR-OLZOCXBDSA-N	0	3	336.838	3.265	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)C#CC1CC1)NCc1cc(F)ccc1Cl	ZINC001134329988	1376480565	/nfs/dbraw/zinc/48/05/65/1376480565.db2.gz	UDMFYGNUGWWROZ-OLZOCXBDSA-N	0	3	336.838	3.265	20	30		EGEDHN
CC(C)[C@H](C(=O)NCCNCc1ccc(C#N)cc1)c1ccccc1	ZINC001134416753	1376521923	/nfs/dbraw/zinc/52/19/23/1376521923.db2.gz	KYTAXYPNQJTKTF-FQEVSTJZSA-N	0	3	335.451	3.204	20	30		EGEDHN
CC1(C)N(Cc2ccc(C#N)s2)CC[C@]12c1ccccc1OC2=O	ZINC001232845404	1376524379	/nfs/dbraw/zinc/52/43/79/1376524379.db2.gz	VOOSKXNTIQAYIA-LJQANCHMSA-N	0	3	338.432	3.461	20	30		EGEDHN
COC(=O)[C@@H](c1ccccc1)[C@H]1CCCCN1Cc1cccc(C#N)n1	ZINC001232926438	1376538013	/nfs/dbraw/zinc/53/80/13/1376538013.db2.gz	PDSLBPSQKVVXRA-UXHICEINSA-N	0	3	349.434	3.265	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)C(C)(C)C(C)C	ZINC001134440312	1376538750	/nfs/dbraw/zinc/53/87/50/1376538750.db2.gz	UERWPCYNDBXPIA-OLZOCXBDSA-N	0	3	333.314	3.450	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@H](C)C[C@@H](C)NCc1cnc(C)o1	ZINC001134449786	1376544441	/nfs/dbraw/zinc/54/44/41/1376544441.db2.gz	WZDZQRAVCKMROG-GHMZBOCLSA-N	0	3	327.856	3.135	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H](C)C[C@H](C)NCc1ncc(Cl)n1C	ZINC001134454362	1376546380	/nfs/dbraw/zinc/54/63/80/1376546380.db2.gz	VXOPRCVIXOBHSV-STQMWFEESA-N	0	3	340.899	3.049	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H](C)C[C@@H](C)NCc1cc(F)ccc1C#N	ZINC001134470783	1376555865	/nfs/dbraw/zinc/55/58/65/1376555865.db2.gz	SFFVGNNEZDJKTJ-HUUCEWRRSA-N	0	3	331.435	3.427	20	30		EGEDHN
CN(C[C@@H]1CCN1CC/C=C/c1ccccc1)C(=O)c1ccc(C#N)[nH]1	ZINC001233692001	1376695539	/nfs/dbraw/zinc/69/55/39/1376695539.db2.gz	CYQPDDQGVJOIQU-SQUITACLSA-N	0	3	348.450	3.136	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)Cc1ccccc1	ZINC001134765496	1376708968	/nfs/dbraw/zinc/70/89/68/1376708968.db2.gz	ZJGRTUYDGBQQDU-ZIAGYGMSSA-N	0	3	339.277	3.011	20	30		EGEDHN
C[C@H]1CC[C@@](C)(C(=O)NCCNCc2ccc(C#N)s2)C1(C)C	ZINC001134786036	1376719456	/nfs/dbraw/zinc/71/94/56/1376719456.db2.gz	OMVJERHLZFZFQO-UGSOOPFHSA-N	0	3	333.501	3.288	20	30		EGEDHN
C[C@H]1CC[C@@](C)(C(=O)NCCNCc2ccc(C#N)cc2)C1(C)C	ZINC001134786199	1376719799	/nfs/dbraw/zinc/71/97/99/1376719799.db2.gz	WOJIAXQUBQWNPW-YWZLYKJASA-N	0	3	327.472	3.226	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)C1(F)CCCC1)NCc1ccccc1C#N	ZINC001134790754	1376724273	/nfs/dbraw/zinc/72/42/73/1376724273.db2.gz	HTAOEGIYUVNALD-CABCVRRESA-N	0	3	331.435	3.213	20	30		EGEDHN
C=CCCCCCN1CC[C@@H]1CN(C)C(=O)[C@@H]1CCCc2n[nH]cc21	ZINC001234322860	1376810284	/nfs/dbraw/zinc/81/02/84/1376810284.db2.gz	LWVMPLCINKHYKH-IAGOWNOFSA-N	0	3	344.503	3.109	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)CCOc1cc(C)cc(C)c1	ZINC001235035923	1376833905	/nfs/dbraw/zinc/83/39/05/1376833905.db2.gz	HQXWMAXLXZCUTN-GOSISDBHSA-N	0	3	330.472	3.181	20	30		EGEDHN
CC(C)(C(=O)NCCNCc1cccc(C#N)c1)C1CCCCC1	ZINC001135004364	1376838835	/nfs/dbraw/zinc/83/88/35/1376838835.db2.gz	IJOBRYJUCRXITQ-UHFFFAOYSA-N	0	3	327.472	3.371	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)C1(CCF)CC1)NCc1cc(F)ccc1C#N	ZINC001135065979	1376877823	/nfs/dbraw/zinc/87/78/23/1376877823.db2.gz	MUXHSULVCWSRMI-ZIAGYGMSSA-N	0	3	349.425	3.210	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1cc(Cl)ccc1OC	ZINC001753017963	1440269018	/nfs/dbraw/zinc/26/90/18/1440269018.db2.gz	CUDWFFDPWVLBHZ-NSHDSACASA-N	0	3	331.243	3.199	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N[C@H](C)C[C@H](C)NCC(=C)Br	ZINC001135243315	1376997451	/nfs/dbraw/zinc/99/74/51/1376997451.db2.gz	JRPQFAGUIBFLJO-AKXMXHFNSA-N	0	3	329.282	3.290	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2ccn(CC)n2)CCC1	ZINC001135395201	1377071592	/nfs/dbraw/zinc/07/15/92/1377071592.db2.gz	ORIWUHANAYLYOJ-CVEARBPZSA-N	0	3	332.492	3.022	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)c1occc1Cl	ZINC001135399036	1377073777	/nfs/dbraw/zinc/07/37/77/1377073777.db2.gz	PEEUZUSNDKAAFL-ZJUUUORDSA-N	0	3	349.656	3.328	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)C1(C)CC=CC1	ZINC001135410771	1377080268	/nfs/dbraw/zinc/08/02/68/1377080268.db2.gz	GDBQPYINBKRLQT-CHWSQXEVSA-N	0	3	329.282	3.124	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](C)C[C@@H](C)NCc2oc(C)nc2C)CC1	ZINC001135416190	1377083165	/nfs/dbraw/zinc/08/31/65/1377083165.db2.gz	RGMBUFSNWIYTJK-KGLIPLIRSA-N	0	3	333.476	3.411	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H](C)C[C@H](C)NCc2nccn2C(F)F)C1	ZINC001135420711	1377086145	/nfs/dbraw/zinc/08/61/45/1377086145.db2.gz	YPDAFJLKHKVTQF-QWHCGFSZSA-N	0	3	340.418	3.007	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H](C)C[C@H](C)NCc2cc(C3CC3)no2)C1	ZINC001135426289	1377089564	/nfs/dbraw/zinc/08/95/64/1377089564.db2.gz	BVHKVBORNNCFRV-KBPBESRZSA-N	0	3	331.460	3.281	20	30		EGEDHN
CC[C@H](CNC(=O)c1cc(C#N)ccc1C)N1CCc2ccccc2C1	ZINC001136200892	1377363503	/nfs/dbraw/zinc/36/35/03/1377363503.db2.gz	OBKFNPRKEJFHEP-HXUWFJFHSA-N	0	3	347.462	3.433	20	30		EGEDHN
COC(=O)CCc1c(C)[nH]c(CN2[C@@H]3CC[C@H]2C[C@H](C#N)C3)c1C	ZINC001136919308	1377440013	/nfs/dbraw/zinc/44/00/13/1377440013.db2.gz	DCXDOQAOXBRCJT-PHZGNYQRSA-N	0	3	329.444	3.004	20	30		EGEDHN
C#CCCCC(=O)N1CCC([C@@H](C)NC/C(Cl)=C\Cl)CC1	ZINC001753274765	1440346025	/nfs/dbraw/zinc/34/60/25/1440346025.db2.gz	IWWFDFXRNDABMS-WDGDVPDHSA-N	0	3	331.287	3.326	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2C[C@H]3[C@@H](CN3C(=O)OC(C)(C)C)C2)c1[O-]	ZINC001138629528	1377756601	/nfs/dbraw/zinc/75/66/01/1377756601.db2.gz	BVZWGOYYABVCLU-SJORKVTESA-N	0	3	344.455	3.172	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2C[C@H]3[C@@H](CN3C(=O)OC(C)(C)C)C2)c1[O-]	ZINC001138629528	1377756603	/nfs/dbraw/zinc/75/66/03/1377756603.db2.gz	BVZWGOYYABVCLU-SJORKVTESA-N	0	3	344.455	3.172	20	30		EGEDHN
O=C1C=C2CN(Cc3cscc3Br)CCC2S1	ZINC001139347838	1377872595	/nfs/dbraw/zinc/87/25/95/1377872595.db2.gz	RJVRCVRRODECQC-LLVKDONJSA-N	0	3	330.272	3.285	20	30		EGEDHN
CCN1CCN(Cc2ccc(Oc3ccc(C#N)cc3)nc2)C[C@H]1C	ZINC001139428494	1377883467	/nfs/dbraw/zinc/88/34/67/1377883467.db2.gz	DUVWOGOWFGRSSX-MRXNPFEDSA-N	0	3	336.439	3.272	20	30		EGEDHN
CC(C)CC(=O)NC1CCN(Cc2c[nH]c3c2cccc3C#N)CC1	ZINC001139703036	1377937374	/nfs/dbraw/zinc/93/73/74/1377937374.db2.gz	HGBWAKPBFKXNDZ-UHFFFAOYSA-N	0	3	338.455	3.166	20	30		EGEDHN
Cc1ccc(CN2CCC3(CC2)C(=O)N[C@H]3c2ccccc2)cc1C#N	ZINC001139724473	1377941244	/nfs/dbraw/zinc/94/12/44/1377941244.db2.gz	SRNRJUNWVGNWRD-FQEVSTJZSA-N	0	3	345.446	3.320	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3ccc(O)cc3Cl)C2)C1=O	ZINC001140082205	1378003462	/nfs/dbraw/zinc/00/34/62/1378003462.db2.gz	NQCFUVUUOYYIOO-GOSISDBHSA-N	0	3	334.847	3.046	20	30		EGEDHN
N#Cc1ccc2[nH]cc(CN3CCC[C@@](O)(C(F)(F)F)CC3)c2c1	ZINC001140110675	1378009573	/nfs/dbraw/zinc/00/95/73/1378009573.db2.gz	PRXRWODIDRLGDI-INIZCTEOSA-N	0	3	337.345	3.319	20	30		EGEDHN
O=C1C=C2CN(Cc3cnc(-c4ccccc4F)nc3)CCC2S1	ZINC001140400776	1378057379	/nfs/dbraw/zinc/05/73/79/1378057379.db2.gz	DKYMQXAMHDTFQU-MRXNPFEDSA-N	0	3	341.411	3.057	20	30		EGEDHN
C=CCNC(=O)[C@H]1CC12CCN(Cc1ccc(OC(C)C)cc1)CC2	ZINC001273007856	1378084934	/nfs/dbraw/zinc/08/49/34/1378084934.db2.gz	GHLBRJWUMHIJBP-LJQANCHMSA-N	0	3	342.483	3.378	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3ccc4c(c3)CCO4)CC2)C1=O	ZINC001273008274	1378085000	/nfs/dbraw/zinc/08/50/00/1378085000.db2.gz	IUPMESGPLNCRMF-NRFANRHFSA-N	0	3	340.467	3.012	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3cc(C#N)ccc3Cl)C2)C1=O	ZINC001140598786	1378094532	/nfs/dbraw/zinc/09/45/32/1378094532.db2.gz	DNBGTEQLQPNWAP-LJQANCHMSA-N	0	3	343.858	3.212	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@]3(CCN(C4CCCC4)C3=O)C2)c(F)c1	ZINC001273304037	1378096107	/nfs/dbraw/zinc/09/61/07/1378096107.db2.gz	QZBXVQIKSUUPLD-HXUWFJFHSA-N	0	3	341.430	3.064	20	30		EGEDHN
N#Cc1ccc(N2CCN(Cc3cccc4ccncc43)CC2)cc1	ZINC001140643676	1378104479	/nfs/dbraw/zinc/10/44/79/1378104479.db2.gz	HUXOUMLMSVURKK-UHFFFAOYSA-N	0	3	328.419	3.429	20	30		EGEDHN
C#CCN1CCC2(CCN(Cc3ccc(Cl)c(C)c3F)CC2)C1=O	ZINC001274473689	1378127412	/nfs/dbraw/zinc/12/74/12/1378127412.db2.gz	WMEUOMPFMWFFFN-UHFFFAOYSA-N	0	3	348.849	3.235	20	30		EGEDHN
C=CCN1C(=O)CC[C@@]12CCCN(Cc1cccc(OC)c1F)CC2	ZINC001141221259	1378274216	/nfs/dbraw/zinc/27/42/16/1378274216.db2.gz	ZXWCEGZGIZLHGF-HXUWFJFHSA-N	0	3	346.446	3.367	20	30		EGEDHN
COC(=O)[C@@H]1CCN(Cc2ccc(Oc3ccc(C#N)cc3)cc2)C1	ZINC001141289132	1378292416	/nfs/dbraw/zinc/29/24/16/1378292416.db2.gz	BHVFEVWYMHUSBN-QGZVFWFLSA-N	0	3	336.391	3.345	20	30		EGEDHN
COc1cc(C(F)(F)F)ccc1CN1CCC2SC(=O)C=C2C1	ZINC001141604531	1378349464	/nfs/dbraw/zinc/34/94/64/1378349464.db2.gz	GSPLRASEOYMDAC-AWEZNQCLSA-N	0	3	343.370	3.488	20	30		EGEDHN
CCCCCCN1CCN(Cc2ccc(C#N)c(SC)n2)CC1	ZINC001141939170	1378396129	/nfs/dbraw/zinc/39/61/29/1378396129.db2.gz	MHJXBSDIXAUUGJ-UHFFFAOYSA-N	0	3	332.517	3.373	20	30		EGEDHN
N#Cc1ccc2c(CN3CCCc4cc(O)c(O)cc4C3)c[nH]c2c1	ZINC001142925966	1378509919	/nfs/dbraw/zinc/50/99/19/1378509919.db2.gz	GRLOLZQQOHTSGZ-UHFFFAOYSA-N	0	3	333.391	3.399	20	30		EGEDHN
N#Cc1ccc(F)c(CN2CC[C@H](N3CCCCC3)[C@@H](F)C2)c1F	ZINC001143178903	1378554845	/nfs/dbraw/zinc/55/48/45/1378554845.db2.gz	PYKSLQFVIYNLPM-IRXDYDNUSA-N	0	3	337.389	3.235	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C[C@H](C)NCc2cnns2)CCCC1	ZINC001146822347	1378928754	/nfs/dbraw/zinc/92/87/54/1378928754.db2.gz	QJHDRLMRIGCQIS-UONOGXRCSA-N	0	3	336.505	3.048	20	30		EGEDHN
CN(C(=O)C1CC(C)(C)C1)[C@@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001283500930	1378989180	/nfs/dbraw/zinc/98/91/80/1378989180.db2.gz	AIXANKWVOFPZLH-KRWDZBQOSA-N	0	3	345.512	3.383	20	30		EGEDHN
CCC1(C(=O)N(C)C[C@@H](C)NCc2ccc(F)c(C#N)c2)CCC1	ZINC001283654668	1379086256	/nfs/dbraw/zinc/08/62/56/1379086256.db2.gz	VWGKFCVHDRVCFQ-CQSZACIVSA-N	0	3	331.435	3.214	20	30		EGEDHN
CC#CCCCC(=O)N1CC2(C1)CCN(C/C=C\c1ccccc1)C2	ZINC001148104533	1379119134	/nfs/dbraw/zinc/11/91/34/1379119134.db2.gz	OEQFEMLGLJXQEU-XFXZXTDPSA-N	0	3	336.479	3.428	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)N1CC2(C1)CCN(Cc1sc(C)nc1C)C2	ZINC001148137975	1379122970	/nfs/dbraw/zinc/12/29/70/1379122970.db2.gz	KHUUJEFOZXEIHF-KGLIPLIRSA-N	0	3	347.528	3.252	20	30		EGEDHN
C=CCCCC(=O)N1CC2(C1)CCN(CCOc1ccc(F)cc1)C2	ZINC001148181611	1379129724	/nfs/dbraw/zinc/12/97/24/1379129724.db2.gz	QPMWPNVBBWIOSS-UHFFFAOYSA-N	0	3	346.446	3.095	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C[C@H](CC)c3ccc(C)cc3)C2)C1	ZINC001148292774	1379146753	/nfs/dbraw/zinc/14/67/53/1379146753.db2.gz	SQGQEEUMZQMHLQ-IBGZPJMESA-N	0	3	338.495	3.436	20	30		EGEDHN
CCC[C@@H](CC)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001148507915	1379196989	/nfs/dbraw/zinc/19/69/89/1379196989.db2.gz	UQRSGGAWZBZZKQ-LJQANCHMSA-N	0	3	339.483	3.419	20	30		EGEDHN
CCCCCCCCCCC(=O)NCCNCC(=O)N(CC)CC	ZINC001148763938	1379264124	/nfs/dbraw/zinc/26/41/24/1379264124.db2.gz	KVHHMPJDVCHJNK-UHFFFAOYSA-N	0	3	341.540	3.091	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)C2(C3CCCCC3)CC2)cc1	ZINC001149134856	1379330499	/nfs/dbraw/zinc/33/04/99/1379330499.db2.gz	NJVWQQPRGBZYHN-UHFFFAOYSA-N	0	3	325.456	3.125	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2ccsc2C(F)F)c1	ZINC001149397320	1379375285	/nfs/dbraw/zinc/37/52/85/1379375285.db2.gz	XJMFRRZTUFPICJ-UHFFFAOYSA-N	0	3	335.379	3.077	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H]1CN(Cc2ccc(C)cc2C)CCCO1	ZINC001149796738	1379447543	/nfs/dbraw/zinc/44/75/43/1379447543.db2.gz	NITLRDCHUKFHID-HXUWFJFHSA-N	0	3	344.499	3.367	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@H]1CN([C@@H](C)c2ccccc2)CCCO1	ZINC001149797033	1379449048	/nfs/dbraw/zinc/44/90/48/1379449048.db2.gz	QFEHBVWKZYYBNH-HKUYNNGSSA-N	0	3	330.472	3.311	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2sccc2C2CC2)s1	ZINC001150034130	1379487033	/nfs/dbraw/zinc/48/70/33/1379487033.db2.gz	FMHPHPGVHXOGIF-UHFFFAOYSA-N	0	3	331.466	3.078	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@H]1CN(Cc2cc(C)ccc2C)CCCO1	ZINC001150084755	1379492035	/nfs/dbraw/zinc/49/20/35/1379492035.db2.gz	GUHGKLDRVNWKME-IBGZPJMESA-N	0	3	344.499	3.223	20	30		EGEDHN
C=CCCCC(=O)NC[C@H]1CN(Cc2cccc(C)c2)CCCO1	ZINC001150211627	1379516238	/nfs/dbraw/zinc/51/62/38/1379516238.db2.gz	KCJXVDGKXZOZKZ-IBGZPJMESA-N	0	3	330.472	3.058	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)[C@@]2(C)CCC(C)=C(C)C2)C1	ZINC001150818375	1379618526	/nfs/dbraw/zinc/61/85/26/1379618526.db2.gz	QBUBQVAXWCEYRF-ICSRJNTNSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)[C@]2(C)CCC(C)=C(C)C2)C1	ZINC001150818377	1379618728	/nfs/dbraw/zinc/61/87/28/1379618728.db2.gz	QBUBQVAXWCEYRF-UYAOXDASSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)C[C@@H]2CCC[C@H]2C)CC1	ZINC001151131928	1379665212	/nfs/dbraw/zinc/66/52/12/1379665212.db2.gz	JUDLDTROLQBIDM-MSOLQXFVSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@@H]2[C@H](C=C(C)C)C2(C)C)CC1	ZINC001151209028	1379677501	/nfs/dbraw/zinc/67/75/01/1379677501.db2.gz	DAZSDXDKSCHLCE-ROUUACIJSA-N	0	3	348.531	3.398	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@@H]2C[C@H]2C(C)(C)C)CC1	ZINC001151209362	1379677517	/nfs/dbraw/zinc/67/75/17/1379677517.db2.gz	IRIDYZDHOYLNFC-IAGOWNOFSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@H](C)c2ccsc2)CC1	ZINC001151302253	1379697124	/nfs/dbraw/zinc/69/71/24/1379697124.db2.gz	FEQAPGCONBCVBI-OAHLLOKOSA-N	0	3	336.501	3.025	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@@H]2C[C@]2(C)C(C)C)CC1	ZINC001151374877	1379706740	/nfs/dbraw/zinc/70/67/40/1379706740.db2.gz	PIEZGDBOGAJWQO-PKOBYXMFSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@@H]2C[C@@H]2C2CCCC2)CC1	ZINC001151374515	1379706880	/nfs/dbraw/zinc/70/68/80/1379706880.db2.gz	JFIRKCBIDQHMCL-RTBURBONSA-N	0	3	348.531	3.376	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)c1ccc(C)o1	ZINC001151721056	1379768325	/nfs/dbraw/zinc/76/83/25/1379768325.db2.gz	NCAWFLAXYXOMOJ-CQSZACIVSA-N	0	3	325.412	3.100	20	30		EGEDHN
C=CC[C@H](C(=O)NCCNCc1ccc(F)cc1)c1ccccc1	ZINC001151838843	1379795136	/nfs/dbraw/zinc/79/51/36/1379795136.db2.gz	YMTZBAPKNGRIJN-IBGZPJMESA-N	0	3	326.415	3.391	20	30		EGEDHN
CCCCCCCC[C@@H](C)C(=O)NCCNCc1cn(C)nc1C	ZINC001151848506	1379799184	/nfs/dbraw/zinc/79/91/84/1379799184.db2.gz	NNMIDNKYEKSXBY-MRXNPFEDSA-N	0	3	336.524	3.321	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)CC(C)(C)C	ZINC001151937938	1379819240	/nfs/dbraw/zinc/81/92/40/1379819240.db2.gz	QSQNGKJOAVCRKO-CQSZACIVSA-N	0	3	333.451	3.460	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)CCC1CC1	ZINC001152488766	1379941519	/nfs/dbraw/zinc/94/15/19/1379941519.db2.gz	LDFQMMUMXKPROU-CQSZACIVSA-N	0	3	331.435	3.214	20	30		EGEDHN
CC(C)c1ccc(C(=O)NCCNCc2ccc(C#N)cc2)s1	ZINC001152776787	1379980594	/nfs/dbraw/zinc/98/05/94/1379980594.db2.gz	BFNXZGHQCGOBEW-UHFFFAOYSA-N	0	3	327.453	3.263	20	30		EGEDHN
CC1=C(C)C[C@](C)(C(=O)NCCNCc2ccc(C#N)s2)CC1	ZINC001152937737	1379996506	/nfs/dbraw/zinc/99/65/06/1379996506.db2.gz	YUDYLCTXYXTTBU-GOSISDBHSA-N	0	3	331.485	3.352	20	30		EGEDHN
CC1=C(C)C[C@@](C)(C(=O)NCCNCc2ccc(C#N)s2)CC1	ZINC001152937739	1379996598	/nfs/dbraw/zinc/99/65/98/1379996598.db2.gz	YUDYLCTXYXTTBU-SFHVURJKSA-N	0	3	331.485	3.352	20	30		EGEDHN
CCc1occc1C(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)cc1	ZINC001153046994	1380013530	/nfs/dbraw/zinc/01/35/30/1380013530.db2.gz	PKUFJHYSRVSJDB-OAHLLOKOSA-N	0	3	339.439	3.354	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NCCN[C@@H](C)c1ccc(Cl)c(Cl)c1	ZINC001153148525	1380027784	/nfs/dbraw/zinc/02/77/84/1380027784.db2.gz	FTPVTYBDYMRPJL-NWDGAFQWSA-N	0	3	345.270	3.351	20	30		EGEDHN
C=CCC1(C(=O)NCCNCc2cn(C(C)C)nc2C)CCCC1	ZINC001153814059	1380134942	/nfs/dbraw/zinc/13/49/42/1380134942.db2.gz	OPEGAQCBUKXEOU-UHFFFAOYSA-N	0	3	332.492	3.115	20	30		EGEDHN
CCN(CC#CCOC)[C@H](C)CNC(=O)[C@H]1CC[C@H](C2CCC2)CC1	ZINC001153879503	1380148410	/nfs/dbraw/zinc/14/84/10/1380148410.db2.gz	HRAIQUAGYQNCLS-MISYRCLQSA-N	0	3	348.531	3.069	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)C2(CCc3ccccc3)CC2)cc1	ZINC001153959341	1380162754	/nfs/dbraw/zinc/16/27/54/1380162754.db2.gz	HEAYHZNTZRTKFE-UHFFFAOYSA-N	0	3	347.462	3.177	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@@H](C)N(CC)CCc1ccns1	ZINC001154609335	1380315832	/nfs/dbraw/zinc/31/58/32/1380315832.db2.gz	DOWYGYYEXNHIDN-MRXNPFEDSA-N	0	3	335.517	3.096	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)[C@H](F)C(C)C	ZINC001154705248	1380336224	/nfs/dbraw/zinc/33/62/24/1380336224.db2.gz	HYFMLFSOQRCJJK-CXAGYDPISA-N	0	3	337.414	3.018	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@H](C)N(CC)Cc1ccc(C)nc1C	ZINC001154719969	1380339385	/nfs/dbraw/zinc/33/93/85/1380339385.db2.gz	QUOLUMUHWJZFEN-QGZVFWFLSA-N	0	3	329.488	3.219	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@@H](C)N(CC)Cc1ccnc(N(C)C)c1	ZINC001154742581	1380343908	/nfs/dbraw/zinc/34/39/08/1380343908.db2.gz	IQTYHUYVFSKABJ-DLBZAZTESA-N	0	3	346.519	3.077	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)C1(C)CC=CC1	ZINC001155011069	1380390892	/nfs/dbraw/zinc/39/08/92/1380390892.db2.gz	FZPDPPSBOSLXIZ-MRXNPFEDSA-N	0	3	325.456	3.241	20	30		EGEDHN
C[C@@H](N)c1nc2ccccc2n1-c1ccc(C2(C#N)CCOCC2)cn1	ZINC001155257281	1380429847	/nfs/dbraw/zinc/42/98/47/1380429847.db2.gz	FAEBSQXCDSRWEU-CQSZACIVSA-N	0	3	347.422	3.012	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@@H](C)N(CC)Cc1ccnc(N(C)C)c1	ZINC001155490148	1380459797	/nfs/dbraw/zinc/45/97/97/1380459797.db2.gz	WKTYOXHQUWUHFR-MRXNPFEDSA-N	0	3	346.519	3.077	20	30		EGEDHN
N#Cc1cnc2cc[nH]c(NC(=N)c3ccc(C(F)(F)F)cc3)c1-2	ZINC001155851555	1380499167	/nfs/dbraw/zinc/49/91/67/1380499167.db2.gz	SYNHNSVVRFFZDO-UHFFFAOYSA-N	0	3	329.285	3.490	20	30		EGEDHN
C#CCN(CC)[C@H](C)CNC(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1	ZINC001155910293	1380505014	/nfs/dbraw/zinc/50/50/14/1380505014.db2.gz	GKWAPYPPGYXKFV-TYCQWZJGSA-N	0	3	334.463	3.403	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H](C)N(CC)C/C=C/c2ccccc2)cn1	ZINC001156460440	1380578820	/nfs/dbraw/zinc/57/88/20/1380578820.db2.gz	JTHLSXHSECUOSE-ZPHJMFTNSA-N	0	3	347.462	3.217	20	30		EGEDHN
Cc1cc(Cl)nc(-n2cncc2CNCc2ccccc2)c1C#N	ZINC001156482012	1380581888	/nfs/dbraw/zinc/58/18/88/1380581888.db2.gz	CHYYREBGCJOSDF-UHFFFAOYSA-N	0	3	337.814	3.391	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1oc2ccccc2c1CC	ZINC001157196181	1380806067	/nfs/dbraw/zinc/80/60/67/1380806067.db2.gz	IMVCQQFEEKFUGJ-OAHLLOKOSA-N	0	3	326.440	3.459	20	30		EGEDHN
C=CCCOCC(=O)NC[C@@H](C)N(CC)Cc1cc(F)ccc1C	ZINC001157203387	1380809273	/nfs/dbraw/zinc/80/92/73/1380809273.db2.gz	LAKVDXFJCYSDOZ-MRXNPFEDSA-N	0	3	336.451	3.053	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2oc(C)nc2C)CCCCC1	ZINC001755350095	1440827604	/nfs/dbraw/zinc/82/76/04/1440827604.db2.gz	ZIEFSYXIMVAGHD-UHFFFAOYSA-N	0	3	325.840	3.066	20	30		EGEDHN
N#Cc1ccc(C(F)(F)N2CCN[C@H](c3ccccc3)C2)nc1Cl	ZINC001157760987	1381024432	/nfs/dbraw/zinc/02/44/32/1381024432.db2.gz	YOHOBCPSJBGZML-AWEZNQCLSA-N	0	3	348.784	3.302	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1ccc([C@H]2C[C@H]2C)o1	ZINC001157912797	1381068353	/nfs/dbraw/zinc/06/83/53/1381068353.db2.gz	YLGSJNRNWQLFPK-PWSUYJOCSA-N	0	3	341.249	3.021	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)C[C@@H]1C[C@H]1c1ccccc1	ZINC001158221489	1381164180	/nfs/dbraw/zinc/16/41/80/1381164180.db2.gz	RTZQTPFESGONMS-SFTDATJTSA-N	0	3	347.462	3.348	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc2ncccc2s1	ZINC001158340943	1381207389	/nfs/dbraw/zinc/20/73/89/1381207389.db2.gz	DSVPIWVTSAKYQI-CQSZACIVSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCCC[C@@H]1CN(C)CCOCC(F)F	ZINC001158378054	1381225048	/nfs/dbraw/zinc/22/50/48/1381225048.db2.gz	VMBAFEYGBFTTBU-JKSUJKDBSA-N	0	3	346.462	3.183	20	30		EGEDHN
CCCc1cc(C#N)c(N2CCCc3ccc(CN)nc32)nc1Cl	ZINC001158652298	1381337454	/nfs/dbraw/zinc/33/74/54/1381337454.db2.gz	NTVBNNMTKVHWFF-UHFFFAOYSA-N	0	3	341.846	3.497	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H](C)OCc1ccc(F)cc1	ZINC001158806978	1381408690	/nfs/dbraw/zinc/40/86/90/1381408690.db2.gz	VIWAZPFQUMGCGR-VQIMIIECSA-N	0	3	348.462	3.230	20	30		EGEDHN
Cc1cccc(C)c1CC(=O)NCCCNCc1ccccc1C#N	ZINC001159021151	1381514384	/nfs/dbraw/zinc/51/43/84/1381514384.db2.gz	NWRZFTZYETXBNY-UHFFFAOYSA-N	0	3	335.451	3.014	20	30		EGEDHN
C=CCCC(=O)NCCC1=CCN(Cc2cccc(COC)c2)CC1	ZINC001159539068	1381821880	/nfs/dbraw/zinc/82/18/80/1381821880.db2.gz	ZVAAJKOWVUOKDH-UHFFFAOYSA-N	0	3	342.483	3.438	20	30		EGEDHN
C[C@H](N)c1ncc(-c2ccccc2)n1-c1ncnc2ccc(C#N)cc21	ZINC001159592331	1381838669	/nfs/dbraw/zinc/83/86/69/1381838669.db2.gz	QMICMCSMNGUXBS-ZDUSSCGKSA-N	0	3	340.390	3.374	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccn(C3CCCCC3)n2)CC1	ZINC001160125825	1382006055	/nfs/dbraw/zinc/00/60/55/1382006055.db2.gz	PDPAFWDHNSEFTP-UHFFFAOYSA-N	0	3	342.487	3.326	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc(C)c(OC)c(C)c2)CC1	ZINC001160202790	1382032553	/nfs/dbraw/zinc/03/25/53/1382032553.db2.gz	VHTJFJYUDBQMPQ-UHFFFAOYSA-N	0	3	340.467	3.087	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CCc2cccc(OC)c2F)CC1	ZINC001160302524	1382067938	/nfs/dbraw/zinc/06/79/38/1382067938.db2.gz	ULHHTAGTVZEKGU-UHFFFAOYSA-N	0	3	346.446	3.091	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccnn2C(CC)CC)CC1	ZINC001160360125	1382082668	/nfs/dbraw/zinc/08/26/68/1382082668.db2.gz	JJEIQNWJSPRMHB-UHFFFAOYSA-N	0	3	330.476	3.182	20	30		EGEDHN
N#Cc1c(Cl)c2ccc(F)cc2nc1Nc1ccc(CN)nc1	ZINC001160404940	1382095446	/nfs/dbraw/zinc/09/54/46/1382095446.db2.gz	DTQZDZFLOGOZHM-UHFFFAOYSA-N	0	3	327.750	3.496	20	30		EGEDHN
Cc1cc(C(=O)NCCCNCc2ccccc2C#N)c(F)cc1F	ZINC001160717757	1382177342	/nfs/dbraw/zinc/17/73/42/1382177342.db2.gz	XQYYDFKTYHOXRE-UHFFFAOYSA-N	0	3	343.377	3.055	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCC1=CCN(Cc2ncccc2C)CC1	ZINC001160941790	1382245233	/nfs/dbraw/zinc/24/52/33/1382245233.db2.gz	PZHGHAZISSVGBE-AEFFLSMTSA-N	0	3	341.499	3.487	20	30		EGEDHN
C#CC[C@H](N)C(=O)N(C)[C@@H](C)[C@@H](Oc1ccccc1)c1ccccc1	ZINC001160998955	1382267190	/nfs/dbraw/zinc/26/71/90/1382267190.db2.gz	VQRRPWJVIGTDIL-FFZOFVMBSA-N	0	3	336.435	3.004	20	30		EGEDHN
CC(C)(C)OC(=O)C(C#N)c1nccnc1N[C@@H]1CCC(C)(C)C1	ZINC001161035221	1382277973	/nfs/dbraw/zinc/27/79/73/1382277973.db2.gz	GYCXYWPERVLCEK-CHWSQXEVSA-N	0	3	330.432	3.416	20	30		EGEDHN
Cc1ccc(CC#N)c(NC2CCN(Cc3ccc(O)cc3)CC2)n1	ZINC001161136590	1382314936	/nfs/dbraw/zinc/31/49/36/1382314936.db2.gz	HLGWXIHZALDKGW-UHFFFAOYSA-N	0	3	336.439	3.238	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)Cc2ccc(Cl)c(F)c2)CC1	ZINC001161321361	1382370676	/nfs/dbraw/zinc/37/06/76/1382370676.db2.gz	XNBSRMZOUUNITI-UHFFFAOYSA-N	0	3	336.838	3.346	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H]2C[C@H]2c2ccc(C)s2)CC1	ZINC001161428361	1382407739	/nfs/dbraw/zinc/40/77/39/1382407739.db2.gz	ZCGYBHIQGQWQPT-IAGOWNOFSA-N	0	3	330.497	3.484	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CCn2ccc3ccccc32)CC1	ZINC001161844977	1382527488	/nfs/dbraw/zinc/52/74/88/1382527488.db2.gz	VQRJTQVAWKUTTQ-UHFFFAOYSA-N	0	3	337.467	3.356	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H](C)Cc2ccc(OC)cc2)CC1	ZINC001161919231	1382551757	/nfs/dbraw/zinc/55/17/57/1382551757.db2.gz	MIGNNVZKFWIHBI-KRWDZBQOSA-N	0	3	342.483	3.198	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H](OC(C)C)c2ccccc2)CC1	ZINC001162026798	1382607051	/nfs/dbraw/zinc/60/70/51/1382607051.db2.gz	LRTQKCSBYGXRKE-FQEVSTJZSA-N	0	3	342.483	3.477	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCC1(COC)CCN(C[C@@H](F)CC)CC1	ZINC001162428551	1382756348	/nfs/dbraw/zinc/75/63/48/1382756348.db2.gz	JCIRBNXFLGBYNF-SJORKVTESA-N	0	3	342.499	3.182	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)CCC(F)(F)F	ZINC001162751557	1382858986	/nfs/dbraw/zinc/85/89/86/1382858986.db2.gz	UGBSKNCLOUAVNI-UHFFFAOYSA-N	0	3	340.389	3.013	20	30		EGEDHN
C[C@@H](N)c1nc2ccccc2n1-c1ccc(C(F)(F)F)c(C#N)n1	ZINC001162758794	1382861320	/nfs/dbraw/zinc/86/13/20/1382861320.db2.gz	MSMMZKGTOUXCDO-SECBINFHSA-N	0	3	331.301	3.331	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@]1(C)CCC[C@H]1C	ZINC001162918964	1382917002	/nfs/dbraw/zinc/91/70/02/1382917002.db2.gz	JLFRXDSXRCEHHI-KNQAVFIVSA-N	0	3	340.511	3.497	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CC[C@H](C)C1	ZINC001162952494	1382925518	/nfs/dbraw/zinc/92/55/18/1382925518.db2.gz	RBBRAOOJRJOPAN-ICSRJNTNSA-N	0	3	326.484	3.107	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H](C)c1cccc(C)c1	ZINC001162952236	1382925845	/nfs/dbraw/zinc/92/58/45/1382925845.db2.gz	INIVQJVSOLKGPK-HXUWFJFHSA-N	0	3	348.490	3.393	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@H]1C[C@]1(C)CC	ZINC001162971162	1382932663	/nfs/dbraw/zinc/93/26/63/1382932663.db2.gz	ZIROAZUOUUTCSK-CTNGQTDRSA-N	0	3	326.484	3.107	20	30		EGEDHN
C=C(C)CCC(=O)NCc1ccc(CN2CCN(C(C)C)CC2)cc1	ZINC001163024247	1382950579	/nfs/dbraw/zinc/95/05/79/1382950579.db2.gz	GMKMVOFYOUDEKY-UHFFFAOYSA-N	0	3	343.515	3.185	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)c2ccsc2)CC1	ZINC001163338291	1383025910	/nfs/dbraw/zinc/02/59/10/1383025910.db2.gz	TXNWWMLCPWERQW-UHFFFAOYSA-N	0	3	343.290	3.146	20	30		EGEDHN
N#Cc1ccccc1CNCC1(CCNC(=O)C[C@@H]2C=CCC2)CC1	ZINC001163369305	1383034106	/nfs/dbraw/zinc/03/41/06/1383034106.db2.gz	JHMSMHKFRGYQBS-QGZVFWFLSA-N	0	3	337.467	3.291	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)CCCCC)CC1	ZINC001163423312	1383049077	/nfs/dbraw/zinc/04/90/77/1383049077.db2.gz	NDGHYJPICSHLNX-UHFFFAOYSA-N	0	3	331.298	3.351	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCCNCc1cc(-c2ccccc2)no1	ZINC001164234386	1383169635	/nfs/dbraw/zinc/16/96/35/1383169635.db2.gz	WTZPYSCQDSTYQR-HZPDHXFCSA-N	0	3	341.455	3.396	20	30		EGEDHN
CC[C@H](C)CC(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001164284915	1383174419	/nfs/dbraw/zinc/17/44/19/1383174419.db2.gz	IYYVXRRHKMBAET-INIZCTEOSA-N	0	3	327.472	3.371	20	30		EGEDHN
CC1(C)CC(CC(=O)NCCCNCc2cc(C#N)ccc2F)C1	ZINC001164483623	1383191442	/nfs/dbraw/zinc/19/14/42/1383191442.db2.gz	QSUVBMFGZLTPGL-UHFFFAOYSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCC1(CNCc2oc(C)nc2C)CC1	ZINC001164648892	1383213358	/nfs/dbraw/zinc/21/33/58/1383213358.db2.gz	QFUBVUREVHYYHT-UHFFFAOYSA-N	0	3	345.487	3.436	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NCCC1(CNCc2cnc(C)o2)CC1	ZINC001164693357	1383218617	/nfs/dbraw/zinc/21/86/17/1383218617.db2.gz	SWOJSHRVNPKQAT-UHFFFAOYSA-N	0	3	339.867	3.138	20	30		EGEDHN
C[C@@H]1CCN(Cc2ccccc2)C[C@H]1N(C)c1nccc(C#N)c1F	ZINC001165184580	1383243511	/nfs/dbraw/zinc/24/35/11/1383243511.db2.gz	XDYCHIXFCNCNCF-CRAIPNDOSA-N	0	3	338.430	3.439	20	30		EGEDHN
C[C@@H]1CCN(Cc2ccccc2)C[C@H]1N(C)c1ncc(C#N)cc1F	ZINC001165184867	1383243707	/nfs/dbraw/zinc/24/37/07/1383243707.db2.gz	ZNKFXMYGGCKMGD-DNVCBOLYSA-N	0	3	338.430	3.439	20	30		EGEDHN
Cc1cnc(N2C[C@@H](C)N(Cc3ccccc3)C[C@H]2C)c(C=NO)c1	ZINC001165203591	1383248514	/nfs/dbraw/zinc/24/85/14/1383248514.db2.gz	ZEBQGYXYZRWTKZ-IAGOWNOFSA-N	0	3	338.455	3.297	20	30		EGEDHN
Cc1cnc(N2C[C@H](C)N(Cc3ccccc3)C[C@@H]2C)c(C=NO)c1	ZINC001165203592	1383249089	/nfs/dbraw/zinc/24/90/89/1383249089.db2.gz	ZEBQGYXYZRWTKZ-IRXDYDNUSA-N	0	3	338.455	3.297	20	30		EGEDHN
C=C1CCC(C(=O)NCCCNCc2cc(O)ccc2Cl)CC1	ZINC001165907076	1383362728	/nfs/dbraw/zinc/36/27/28/1383362728.db2.gz	RYSOVJVYMLJLNJ-UHFFFAOYSA-N	0	3	336.863	3.388	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCCNCc2cccc(OC)c2Cl)C1	ZINC001166245773	1383406675	/nfs/dbraw/zinc/40/66/75/1383406675.db2.gz	PNRFOYJCTNOBSI-UHFFFAOYSA-N	0	3	336.863	3.301	20	30		EGEDHN
C#CCCCCCC(=O)NCCC1(CNCc2c(C)noc2C)CC1	ZINC001166579153	1383440633	/nfs/dbraw/zinc/44/06/33/1383440633.db2.gz	DHOHOOWJYAVVND-UHFFFAOYSA-N	0	3	345.487	3.251	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCC1(CNCc2c(C)noc2C)CC1	ZINC001166693187	1383461560	/nfs/dbraw/zinc/46/15/60/1383461560.db2.gz	GWSBICKGPSBWDN-KGLIPLIRSA-N	0	3	333.476	3.126	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCCC1(CN[C@H](C)c2cnccn2)CC1	ZINC001166755887	1383472411	/nfs/dbraw/zinc/47/24/11/1383472411.db2.gz	PCUDFCVETHMYIL-JKSUJKDBSA-N	0	3	330.476	3.016	20	30		EGEDHN
C=CCC1(C(=O)NCCC2(CNCc3ccns3)CC2)CCC1	ZINC001167035742	1383525322	/nfs/dbraw/zinc/52/53/22/1383525322.db2.gz	ONSMISWIRJQQNS-UHFFFAOYSA-N	0	3	333.501	3.266	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1cc(F)ccc1Cl	ZINC001167269540	1383580658	/nfs/dbraw/zinc/58/06/58/1383580658.db2.gz	KMUBNRKYHNGCRJ-UHFFFAOYSA-N	0	3	345.805	3.260	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)CO[C@@H]2CCC[C@@H](C)C2)CC1	ZINC001167362622	1383610313	/nfs/dbraw/zinc/61/03/13/1383610313.db2.gz	OLABNEHNELKTEO-GDBMZVCRSA-N	0	3	342.911	3.210	20	30		EGEDHN
CC(C)[C@H](C)C(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001167366920	1383611797	/nfs/dbraw/zinc/61/17/97/1383611797.db2.gz	VOVTXUNROQBSKQ-INIZCTEOSA-N	0	3	327.472	3.226	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C[C@H](C)c2cccnc2)CC1	ZINC001167381202	1383616638	/nfs/dbraw/zinc/61/66/38/1383616638.db2.gz	JBDPAXAYNDSINL-AWEZNQCLSA-N	0	3	335.879	3.204	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@@H]2CCc3ccccc3O2)CC1	ZINC001167486792	1383648466	/nfs/dbraw/zinc/64/84/66/1383648466.db2.gz	RCUBPYROFMECQE-KRWDZBQOSA-N	0	3	348.874	3.009	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1cc(Cl)cs1	ZINC001167659210	1383701562	/nfs/dbraw/zinc/70/15/62/1383701562.db2.gz	IXPKEXPAXYWMPG-UHFFFAOYSA-N	0	3	337.670	3.020	20	30		EGEDHN
C[C@H](C(=O)NCCCNCc1ccccc1C#N)c1ccccc1F	ZINC001168700144	1383971947	/nfs/dbraw/zinc/97/19/47/1383971947.db2.gz	FVVQEFZNEJZBJA-HNNXBMFYSA-N	0	3	339.414	3.097	20	30		EGEDHN
C[C@H](NCCC(=O)Nc1ccc(C#N)c(Cl)c1)c1cccnc1	ZINC001168786091	1384004051	/nfs/dbraw/zinc/00/40/51/1384004051.db2.gz	WUXAZZHBSBEUEQ-LBPRGKRZSA-N	0	3	328.803	3.286	20	30		EGEDHN
CCC1(CC)[C@H](NCc2cccc(C(=O)OC)c2C#N)[C@H](C)[C@@H]1OC	ZINC001307745417	1384023667	/nfs/dbraw/zinc/02/36/67/1384023667.db2.gz	PHMYJHBNSUKXEC-VHSSKADRSA-N	0	3	344.455	3.274	20	30		EGEDHN
CSCCC(=O)N[C@H](C)CCCCNCc1ccccc1C#N	ZINC001169046183	1384100179	/nfs/dbraw/zinc/10/01/79/1384100179.db2.gz	WWTNKNNIHBXXPZ-OAHLLOKOSA-N	0	3	333.501	3.076	20	30		EGEDHN
C[C@H](N)c1ccn(-c2c(C#N)cnc3cc(Br)ccc32)n1	ZINC001169232233	1384125313	/nfs/dbraw/zinc/12/53/13/1384125313.db2.gz	BGSFXUFOVLOGKT-VIFPVBQESA-N	0	3	342.200	3.074	20	30		EGEDHN
C[C@H](CCCCNCc1c(F)cccc1Cl)NC(=O)[C@@H](C)C#N	ZINC001169833110	1384190201	/nfs/dbraw/zinc/19/02/01/1384190201.db2.gz	TUACUYXPUZDOOZ-QWHCGFSZSA-N	0	3	339.842	3.403	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)[C@H]1[C@@H]2CCC[C@@H]21	ZINC001170029686	1384221013	/nfs/dbraw/zinc/22/10/13/1384221013.db2.gz	HDZGZVHSPBHFTP-XCLNPWKQSA-N	0	3	339.483	3.369	20	30		EGEDHN
Cc1cc(NC(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)ncc1C#N	ZINC001311069910	1384255509	/nfs/dbraw/zinc/25/55/09/1384255509.db2.gz	BYVDDMPABOYTCT-CRAIPNDOSA-N	0	3	349.438	3.046	20	30		EGEDHN
C#CCCCCC(=O)N[C@H](C)CCCCNCc1ccn(C(C)C)n1	ZINC001170282984	1384281706	/nfs/dbraw/zinc/28/17/06/1384281706.db2.gz	QDGUCXDZHUIIJQ-GOSISDBHSA-N	0	3	346.519	3.422	20	30		EGEDHN
C#CCCCC(=O)N[C@@H](C)CCCCNCc1nc(C)c(C)s1	ZINC001170425407	1384315999	/nfs/dbraw/zinc/31/59/99/1384315999.db2.gz	NMXDTNZWPRVGJH-AWEZNQCLSA-N	0	3	335.517	3.328	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H](C)CCCCNCc1c(F)cccc1F	ZINC001170649025	1384356859	/nfs/dbraw/zinc/35/68/59/1384356859.db2.gz	RGABRTWUFVIPCX-OAHLLOKOSA-N	0	3	336.426	3.389	20	30		EGEDHN
C[C@H](N)c1ncc(-c2ccccc2)n1-c1cc(C#N)nc(C2CC2)n1	ZINC001170680912	1384364451	/nfs/dbraw/zinc/36/44/51/1384364451.db2.gz	HPBBHTJVHQNSNB-LBPRGKRZSA-N	0	3	330.395	3.098	20	30		EGEDHN
N#Cc1cccc([C@@H](O)CN2CC[C@@]3(C2)CCc2ccccc2O3)c1	ZINC001170733047	1384374947	/nfs/dbraw/zinc/37/49/47/1384374947.db2.gz	PTCDSUPGTBRXTM-PZJWPPBQSA-N	0	3	334.419	3.061	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)CC(C)(C)CC)C1	ZINC001316616188	1384483126	/nfs/dbraw/zinc/48/31/26/1384483126.db2.gz	LJZKAHYTILTGNM-BETUJISGSA-N	0	3	331.298	3.206	20	30		EGEDHN
Cc1ccc([C@@H](C)C(=O)NCCCNCc2ccccc2C#N)s1	ZINC001171124550	1384450104	/nfs/dbraw/zinc/45/01/04/1384450104.db2.gz	FMSOOKAFNYTPGU-OAHLLOKOSA-N	0	3	341.480	3.328	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1CC[C@](O)(C(F)(F)F)[C@H](C)C1	ZINC001171208838	1384469007	/nfs/dbraw/zinc/46/90/07/1384469007.db2.gz	FRTCZKDKTGJJMN-XJKCOSOUSA-N	0	3	326.362	3.124	20	30		EGEDHN
C[C@@H](Cc1cccc(C#N)c1)N1C[C@@H]2C[C@]2(NC(=O)OC(C)(C)C)C1	ZINC001171210497	1384469488	/nfs/dbraw/zinc/46/94/88/1384469488.db2.gz	UJNVEHQAVLCQIY-VHFSOBRXSA-N	0	3	341.455	3.088	20	30		EGEDHN
Cc1ccnc(O[C@@H]2CCCN([C@H](C)Cc3cccc(C#N)c3)C2)n1	ZINC001171231328	1384474983	/nfs/dbraw/zinc/47/49/83/1384474983.db2.gz	IKRUEURDQKJATO-VQIMIIECSA-N	0	3	336.439	3.131	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H](C)CCCCNCc1cnc(C)o1	ZINC001171260199	1384480794	/nfs/dbraw/zinc/48/07/94/1384480794.db2.gz	FMKWAJNYTGSRHG-OAHLLOKOSA-N	0	3	344.459	3.049	20	30		EGEDHN
C[C@H](C(=O)NCCCNCc1cc(C#N)ccc1F)c1ccccc1	ZINC001171422783	1384520222	/nfs/dbraw/zinc/52/02/22/1384520222.db2.gz	IEVOSZRXQOIOJC-HNNXBMFYSA-N	0	3	339.414	3.097	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1cccc(C(F)F)c1	ZINC001171720587	1384611815	/nfs/dbraw/zinc/61/18/15/1384611815.db2.gz	IEVSYKBILLXCRB-UHFFFAOYSA-N	0	3	343.377	3.406	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)c2cccc(Cl)c2)c1	ZINC001171844532	1384659533	/nfs/dbraw/zinc/65/95/33/1384659533.db2.gz	NMFOJZPAYCQWDN-UHFFFAOYSA-N	0	3	345.805	3.260	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1cc(CCC)on1	ZINC001316879224	1384664927	/nfs/dbraw/zinc/66/49/27/1384664927.db2.gz	JVUAFFLHWMTBGB-BBRMVZONSA-N	0	3	339.867	3.352	20	30		EGEDHN
COc1ccc(CN2CCN([C@@H](C)Cc3ccc(C#N)cc3)CC2)cc1	ZINC001172307707	1384765074	/nfs/dbraw/zinc/76/50/74/1384765074.db2.gz	QGPPRECMXUOXKO-SFHVURJKSA-N	0	3	349.478	3.316	20	30		EGEDHN
N#C[C@H]1CCN([C@H]2CC[C@H]3CN(C(=O)c4ccccc4)CC[C@H]3C2)C1	ZINC001172531515	1384809359	/nfs/dbraw/zinc/80/93/59/1384809359.db2.gz	MQJHTIVDZGDQSB-GTAWCEEGSA-N	0	3	337.467	3.163	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C#N)C1	ZINC001172977709	1384894343	/nfs/dbraw/zinc/89/43/43/1384894343.db2.gz	DXPKNRWECXOJPM-SJORKVTESA-N	0	3	329.444	3.410	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1cnc2ccc(F)cc2c1	ZINC001317411720	1385122830	/nfs/dbraw/zinc/12/28/30/1385122830.db2.gz	VJACMIUTXWOWKU-LBPRGKRZSA-N	0	3	335.810	3.224	20	30		EGEDHN
C[C@H](CCNC(=O)c1cc2ccccc2[nH]1)NCc1ccccc1C#N	ZINC001317414293	1385124666	/nfs/dbraw/zinc/12/46/66/1385124666.db2.gz	PVKXBTNDKQHKRR-OAHLLOKOSA-N	0	3	346.434	3.338	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H](C)CCCCNCc1cc(OC)no1	ZINC001174673497	1385132463	/nfs/dbraw/zinc/13/24/63/1385132463.db2.gz	XTENDVHHKNWDAE-CQSZACIVSA-N	0	3	337.464	3.050	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@H](C)CCCCNCc1cc(C)n(C)n1	ZINC001174850401	1385160220	/nfs/dbraw/zinc/16/02/20/1385160220.db2.gz	XZUPOSHTEOABMR-JKSUJKDBSA-N	0	3	334.508	3.095	20	30		EGEDHN
CCN(CCNC(=O)[C@@H](C)C#N)CCc1cccc(Cl)c1Cl	ZINC001317477867	1385174475	/nfs/dbraw/zinc/17/44/75/1385174475.db2.gz	RNCNMNWBWIQTDD-LBPRGKRZSA-N	0	3	342.270	3.134	20	30		EGEDHN
CCN(CCNC(=O)c1ccoc1C1CC1)Cc1cccc(C#N)c1	ZINC001317484228	1385181086	/nfs/dbraw/zinc/18/10/86/1385181086.db2.gz	PGNSGJAGSLKLII-UHFFFAOYSA-N	0	3	337.423	3.281	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H](C)CCCCNCc2cc(C)n(C)n2)CC1	ZINC001175081425	1385191505	/nfs/dbraw/zinc/19/15/05/1385191505.db2.gz	GHPZLUSPHSWZLN-MRXNPFEDSA-N	0	3	346.519	3.240	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@H](C)CCCCNCc1nnc(C(C)C)[nH]1	ZINC001175082495	1385191854	/nfs/dbraw/zinc/19/18/54/1385191854.db2.gz	ORFOJBPEPDJKBA-BEFAXECRSA-N	0	3	349.523	3.295	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)CCCCNCc2ccn(CC)n2)CCC1	ZINC001175096694	1385194067	/nfs/dbraw/zinc/19/40/67/1385194067.db2.gz	ADOABZHMDDMIDX-KRWDZBQOSA-N	0	3	346.519	3.414	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1ccc(F)cc1Cl	ZINC001175156275	1385206640	/nfs/dbraw/zinc/20/66/40/1385206640.db2.gz	FWKDWONDXHFPGW-UHFFFAOYSA-N	0	3	349.631	3.097	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N[C@H](C)CCCCNC/C(Cl)=C\Cl	ZINC001175365323	1385267013	/nfs/dbraw/zinc/26/70/13/1385267013.db2.gz	JHWIRCDJKBCARP-UJJYMJCGSA-N	0	3	349.302	3.161	20	30		EGEDHN
Cc1cc(C(=O)NCCCNCc2cc(C#N)ccc2F)sc1C	ZINC001175600038	1385345655	/nfs/dbraw/zinc/34/56/55/1385345655.db2.gz	ONQCJQQCCOMVET-UHFFFAOYSA-N	0	3	345.443	3.285	20	30		EGEDHN
CCN1CCN(c2ccc(-n3ccc4c3cc(C#N)cc4N)cc2)CC1	ZINC001175781368	1385403082	/nfs/dbraw/zinc/40/30/82/1385403082.db2.gz	GMTAWAZZCVAIMK-UHFFFAOYSA-N	0	3	345.450	3.226	20	30		EGEDHN
CCCCC(=O)NCC[C@@H]1CCN(Cc2ccc(F)c(C#N)c2)C1	ZINC001317773321	1385465194	/nfs/dbraw/zinc/46/51/94/1385465194.db2.gz	BBENVHOFENZXMA-OAHLLOKOSA-N	0	3	331.435	3.216	20	30		EGEDHN
C=C[C@H](C(=O)NCCCNCc1c(C)noc1CC)c1ccccc1	ZINC001176785833	1385696836	/nfs/dbraw/zinc/69/68/36/1385696836.db2.gz	OZRNIDQYPNQHTF-KRWDZBQOSA-N	0	3	341.455	3.111	20	30		EGEDHN
C=C[C@@H](C(=O)NCCCNCc1nc(C)c(C)s1)c1ccccc1	ZINC001176779017	1385693252	/nfs/dbraw/zinc/69/32/52/1385693252.db2.gz	SQBOBZVXUMPLAW-QGZVFWFLSA-N	0	3	343.496	3.326	20	30		EGEDHN
C=C[C@H](C(=O)NCCCNCc1cnc(Cl)s1)c1ccccc1	ZINC001176779330	1385693729	/nfs/dbraw/zinc/69/37/29/1385693729.db2.gz	ZXBMZAJBQHZNBB-HNNXBMFYSA-N	0	3	349.887	3.362	20	30		EGEDHN
CC[C@@H](CNC(=O)C1C(C)(C)C1(C)C)NCc1ccc(C#N)s1	ZINC001318512086	1385730751	/nfs/dbraw/zinc/73/07/51/1385730751.db2.gz	MYQIJPAXVVGVIG-LBPRGKRZSA-N	0	3	333.501	3.286	20	30		EGEDHN
C=CCN1CCC(NC(=O)C(F)(F)c2ccc(Cl)cc2)CC1	ZINC001318568318	1385760534	/nfs/dbraw/zinc/76/05/34/1385760534.db2.gz	YUAHAMGFWWIOAA-UHFFFAOYSA-N	0	3	328.790	3.198	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1cccc(COC)c1)C1CC1	ZINC001318708134	1385845047	/nfs/dbraw/zinc/84/50/47/1385845047.db2.gz	UGERZSMSWPMAHG-GOSISDBHSA-N	0	3	336.863	3.074	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)C[C@@H]1CCCO1	ZINC001177232176	1385876788	/nfs/dbraw/zinc/87/67/88/1385876788.db2.gz	KEOOQRKTTBSIBG-KRWDZBQOSA-N	0	3	342.911	3.307	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)C[C@@H](C)OC	ZINC001177241969	1385881037	/nfs/dbraw/zinc/88/10/37/1385881037.db2.gz	CAVYOLCHPHTQLD-OAHLLOKOSA-N	0	3	330.900	3.162	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NCCCNCc1cc(Cl)ccc1Cl	ZINC001177273137	1385892107	/nfs/dbraw/zinc/89/21/07/1385892107.db2.gz	IJQRBOZHHSEXKU-LBPRGKRZSA-N	0	3	345.270	3.180	20	30		EGEDHN
CS[C@@H](C)CC(=O)N[C@H]1CC[C@H](NCc2ccccc2C#N)CC1	ZINC001318947773	1385892548	/nfs/dbraw/zinc/89/25/48/1385892548.db2.gz	LZHMUXOVRMEROP-WBAXXEDZSA-N	0	3	345.512	3.217	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@H]1CCCCO1	ZINC001177281076	1385895525	/nfs/dbraw/zinc/89/55/25/1385895525.db2.gz	HSRLYEIFMKNKGS-QGZVFWFLSA-N	0	3	342.911	3.307	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1coc2ccccc12	ZINC001177427842	1385952119	/nfs/dbraw/zinc/95/21/19/1385952119.db2.gz	VIULZVPPVBAACS-UHFFFAOYSA-N	0	3	337.217	3.051	20	30		EGEDHN
Cc1cc(F)cc(C(=O)NC[C@H](C)CNCc2ccccc2C#N)c1	ZINC001319243094	1386021989	/nfs/dbraw/zinc/02/19/89/1386021989.db2.gz	TZSGPGKORFIARA-OAHLLOKOSA-N	0	3	339.414	3.162	20	30		EGEDHN
CC(C)(F)C(=O)NCCCCCCNCc1cc(F)ccc1C#N	ZINC001177742440	1386031737	/nfs/dbraw/zinc/03/17/37/1386031737.db2.gz	HXKFTYKCNHHWSV-UHFFFAOYSA-N	0	3	337.414	3.212	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCCCCCN[C@@H](C)c1c(F)cccc1F	ZINC001178059827	1386119422	/nfs/dbraw/zinc/11/94/22/1386119422.db2.gz	RDOVUXNORSCXLO-KGLIPLIRSA-N	0	3	337.414	3.452	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CC[C@H](NCC#Cc2ccccc2Cl)[C@@H]1C	ZINC001178140246	1386139830	/nfs/dbraw/zinc/13/98/30/1386139830.db2.gz	ZJMBTWIZZIEZKN-VKJFTORMSA-N	0	3	332.875	3.317	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)NCCCCCCNCc1ccccc1C#N	ZINC001178222326	1386162857	/nfs/dbraw/zinc/16/28/57/1386162857.db2.gz	KVTZYJHWFJNJRW-SFHVURJKSA-N	0	3	327.472	3.371	20	30		EGEDHN
C/C(=C\C(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@@H]1C)C1CC1	ZINC001178233776	1386167534	/nfs/dbraw/zinc/16/75/34/1386167534.db2.gz	ALXGVSLPAKNRHT-VVUBBHAESA-N	0	3	340.442	3.113	20	30		EGEDHN
C#CCCCC(=O)NCCCCCCNCc1nc(C)sc1C	ZINC001178327952	1386190002	/nfs/dbraw/zinc/19/00/02/1386190002.db2.gz	TTWJPDBDRAGRHH-UHFFFAOYSA-N	0	3	335.517	3.330	20	30		EGEDHN
CC(C)C#CC(=O)NCCCCCCNCc1nc2ccccc2o1	ZINC001178423835	1386213176	/nfs/dbraw/zinc/21/31/76/1386213176.db2.gz	ZCUNFRGTOWEDSI-UHFFFAOYSA-N	0	3	341.455	3.253	20	30		EGEDHN
Cc1cnc(CNCCCCCCNC(=O)C#CC(C)(C)C)s1	ZINC001178442392	1386219025	/nfs/dbraw/zinc/21/90/25/1386219025.db2.gz	OWARONTYMRLGKJ-UHFFFAOYSA-N	0	3	335.517	3.267	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](NCC#Cc2ccc(Cl)cc2)[C@@H]1C	ZINC001178600371	1386260018	/nfs/dbraw/zinc/26/00/18/1386260018.db2.gz	SYMGTMZLAXHEGN-LPHOPBHVSA-N	0	3	342.870	3.074	20	30		EGEDHN
N#Cc1ccccc1CNCCCCCCNC(=O)c1ccns1	ZINC001178607355	1386261928	/nfs/dbraw/zinc/26/19/28/1386261928.db2.gz	PUNFAIZZAMRZEW-UHFFFAOYSA-N	0	3	342.468	3.095	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](NCc2cnn(C(C)(C)C)c2)[C@@H]1C	ZINC001178805673	1386311385	/nfs/dbraw/zinc/31/13/85/1386311385.db2.gz	JOUBUHZEBFQVEW-RDJZCZTQSA-N	0	3	332.492	3.073	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)[C@H]1CCCC12CC2	ZINC001178985478	1386367601	/nfs/dbraw/zinc/36/76/01/1386367601.db2.gz	KVLYLJJGJNQEJE-SXLOBPIMSA-N	0	3	336.479	3.197	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCCCCCNCc1cn(C(C)(C)C)nn1	ZINC001179235178	1386428046	/nfs/dbraw/zinc/42/80/46/1386428046.db2.gz	ITPSKTIEDBLXKP-UHFFFAOYSA-N	0	3	349.523	3.012	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCCCCCNCc1ncc(Cl)n1C	ZINC001179235117	1386428209	/nfs/dbraw/zinc/42/82/09/1386428209.db2.gz	GKKZFMWEZAIFRO-UHFFFAOYSA-N	0	3	340.899	3.052	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCCCCCCNCc1cc(C)n(C)n1	ZINC001179339923	1386456639	/nfs/dbraw/zinc/45/66/39/1386456639.db2.gz	PHLQUFXOOGPWLR-KRWDZBQOSA-N	0	3	334.508	3.097	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCCCCCCNCc1ccn(CC)n1	ZINC001179340125	1386456678	/nfs/dbraw/zinc/45/66/78/1386456678.db2.gz	TYKXUNQMZSLNBO-QGZVFWFLSA-N	0	3	334.508	3.272	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](NCc2cc(F)cc(F)c2)[C@@H]1C	ZINC001179359619	1386462588	/nfs/dbraw/zinc/46/25/88/1386462588.db2.gz	ASXXGVWHIXLQOH-KSSFIOAISA-N	0	3	334.410	3.237	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@H](NCc2cccc(OCC)n2)[C@@H]1C	ZINC001179384564	1386469798	/nfs/dbraw/zinc/46/97/98/1386469798.db2.gz	QFWCIVLDHYQRKF-JZXOWHBKSA-N	0	3	345.487	3.162	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)c1cc[nH]c1C1CC1	ZINC001179421392	1386480051	/nfs/dbraw/zinc/48/00/51/1386480051.db2.gz	WCDCUAOSJYMCAC-JXFKEZNVSA-N	0	3	347.462	3.136	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCCCCCNCc1cc2n(n1)CCC2	ZINC001179482678	1386494909	/nfs/dbraw/zinc/49/49/09/1386494909.db2.gz	ZOEORLVHAUIYSI-HXUWFJFHSA-N	0	3	346.519	3.198	20	30		EGEDHN
CC#CC(=O)N(c1ccccc1N)C1CCN(Cc2ccccc2)CC1	ZINC001179755169	1386573207	/nfs/dbraw/zinc/57/32/07/1386573207.db2.gz	YGJXREOJNOGNJZ-UHFFFAOYSA-N	0	3	347.462	3.290	20	30		EGEDHN
C[C@H](C#N)C(=O)N(Cc1ccccc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC001179895351	1386621000	/nfs/dbraw/zinc/62/10/00/1386621000.db2.gz	MPZXPABPBUUBAQ-NQIIRXRSSA-N	0	3	347.462	3.449	20	30		EGEDHN
C[C@@H](CC(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C)n1cccc1	ZINC001179958800	1386649044	/nfs/dbraw/zinc/64/90/44/1386649044.db2.gz	NOGXHSUHXUEPIB-ZJOUEHCJSA-N	0	3	349.478	3.070	20	30		EGEDHN
C[C@@H](CC(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@@H]1C)C1CC1	ZINC001180230458	1386739726	/nfs/dbraw/zinc/73/97/26/1386739726.db2.gz	CTIZQERWSHOHFM-FTRWYGJKSA-N	0	3	342.458	3.192	20	30		EGEDHN
C[C@@H]1CN(C(=O)C=C2CCC2)C[C@@]1(C)CNCc1ccccc1C#N	ZINC001181104043	1386936180	/nfs/dbraw/zinc/93/61/80/1386936180.db2.gz	MDSVAFGWEGCRLX-IIBYNOLFSA-N	0	3	337.467	3.243	20	30		EGEDHN
CCCC1(C(=O)N[C@H](C)CNCc2cc(C#N)ccc2OC)CCC1	ZINC001321618856	1386942250	/nfs/dbraw/zinc/94/22/50/1386942250.db2.gz	ZQNKHVFPYNPVPV-OAHLLOKOSA-N	0	3	343.471	3.132	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)[C@](C)(CNCc2ncc(C)s2)C1	ZINC001181630798	1387027505	/nfs/dbraw/zinc/02/75/05/1387027505.db2.gz	YTXWPEGKABNFOE-RDTXWAMCSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=CCOCCCC(=O)N1CC[C@@H](NCc2ccc(Cl)s2)C1	ZINC001181832449	1387062472	/nfs/dbraw/zinc/06/24/72/1387062472.db2.gz	HTLYWIZLRXDABY-CYBMUJFWSA-N	0	3	342.892	3.075	20	30		EGEDHN
C=CCOCCCC(=O)N1CC[C@@H](N[C@@H](C)c2ccccc2F)C1	ZINC001181831411	1387062648	/nfs/dbraw/zinc/06/26/48/1387062648.db2.gz	BCSRIGNFMMSJFU-JKSUJKDBSA-N	0	3	334.435	3.060	20	30		EGEDHN
C=C(C)C(=O)OCCNC(=O)[C@@H](c1ccccc1)N(CC)CCCC	ZINC001182231769	1387127338	/nfs/dbraw/zinc/12/73/38/1387127338.db2.gz	AMQIKUCNZMJHFI-GOSISDBHSA-N	0	3	346.471	3.085	20	30		EGEDHN
C=CCCC1(C(=O)N2C[C@@H](C)[C@](C)(CNCc3cnc(C)o3)C2)CC1	ZINC001182516501	1387181086	/nfs/dbraw/zinc/18/10/86/1387181086.db2.gz	HDXKSVKQINZVIF-DNVCBOLYSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H](C)[C@](C)(CNCc2ccn(CC)n2)C1	ZINC001182524368	1387182090	/nfs/dbraw/zinc/18/20/90/1387182090.db2.gz	FJNBOUFUGLUQBT-NSISKUIASA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)COc1cccc(C)c1	ZINC001329357746	1389073524	/nfs/dbraw/zinc/07/35/24/1389073524.db2.gz	BKGWESIOUJMPDP-UHFFFAOYSA-N	0	3	338.879	3.201	20	30		EGEDHN
CC(C)(F)C(=O)NCc1ccc(CNCc2cccc(C#N)c2)cc1	ZINC001698715344	1406358546	/nfs/dbraw/zinc/35/85/46/1406358546.db2.gz	VDTKXSOZDPPZGZ-UHFFFAOYSA-N	0	3	339.414	3.212	20	30		EGEDHN
N#Cc1ccc(C(=O)NC[C@@H]2CCCN2Cc2ccccc2)c(F)c1	ZINC001336964981	1389221845	/nfs/dbraw/zinc/22/18/45/1389221845.db2.gz	KYQAGSBMGWWVML-KRWDZBQOSA-N	0	3	337.398	3.092	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)c2ccc(C#N)cc2F)CN1Cc1ccccc1	ZINC001338902847	1389813421	/nfs/dbraw/zinc/81/34/21/1389813421.db2.gz	QAKBFLAJVOBILS-YOEHRIQHSA-N	0	3	337.398	3.090	20	30		EGEDHN
C=CCn1c([C@H](C)OC(C)(C)C)nnc1N1C[C@H](C)N(CC)C[C@H]1C	ZINC001338994553	1389853787	/nfs/dbraw/zinc/85/37/87/1389853787.db2.gz	FRILHZQEBHSBRX-XHSDSOJGSA-N	0	3	349.523	3.259	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N[C@@H](C)c1noc(-c2ccc(Cl)cc2)n1	ZINC001340123976	1390231541	/nfs/dbraw/zinc/23/15/41/1390231541.db2.gz	WRURBEBVSJYRKY-SMDDNHRTSA-N	0	3	348.834	3.251	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)NCCc1nc(-c2ccccc2)c(C)s1	ZINC001340232642	1390255278	/nfs/dbraw/zinc/25/52/78/1390255278.db2.gz	GVQAOUXUCFZZDG-MRXNPFEDSA-N	0	3	343.496	3.461	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc(C(=O)N2CCC(C)CC2)cc1	ZINC001340619580	1390329824	/nfs/dbraw/zinc/32/98/24/1390329824.db2.gz	AMDKJOXKDADFNS-SFHVURJKSA-N	0	3	343.471	3.181	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N(Cc1ccccc1)CC1CCOCC1	ZINC001340701963	1390348316	/nfs/dbraw/zinc/34/83/16/1390348316.db2.gz	RKNWDOFEKZZPHP-IBGZPJMESA-N	0	3	330.472	3.125	20	30		EGEDHN
C[C@H](NC(=O)[C@@H](N)CCCC#N)c1cc(Cl)cc(Cl)c1F	ZINC001341162337	1390450465	/nfs/dbraw/zinc/45/04/65/1390450465.db2.gz	PHWBRTBSIMYUQB-UFBFGSQYSA-N	0	3	332.206	3.331	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccccc1Sc1nccn1C	ZINC001341399509	1390482329	/nfs/dbraw/zinc/48/23/29/1390482329.db2.gz	SKRKKJJDEAHTMK-ZDUSSCGKSA-N	0	3	330.457	3.193	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc(C(=O)NC(C)(C)CC)cc1	ZINC001341477239	1390491610	/nfs/dbraw/zinc/49/16/10/1390491610.db2.gz	CEESLTAVFSPPFS-INIZCTEOSA-N	0	3	331.460	3.227	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)Nc1ccc2c(c1)CC(=O)N2C	ZINC001341928222	1390550818	/nfs/dbraw/zinc/55/08/18/1390550818.db2.gz	HVQBSXZDBGKYLW-MRXNPFEDSA-N	0	3	331.460	3.222	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N1CCC(Cc2nc(CC)cs2)CC1	ZINC001342075872	1390568053	/nfs/dbraw/zinc/56/80/53/1390568053.db2.gz	FOIJPDQMEBLMKR-MRXNPFEDSA-N	0	3	335.517	3.170	20	30		EGEDHN
CCCc1c(C(=O)C(C#N)c2nccn2C)cnn1-c1ccccc1C	ZINC001343705420	1390732165	/nfs/dbraw/zinc/73/21/65/1390732165.db2.gz	RDIFXZDKDUPIOB-OAHLLOKOSA-N	0	3	347.422	3.357	20	30		EGEDHN
Cn1c(Cl)cnc1C(C#N)C(=O)C[C@@H]1CCc2ccccc2C1	ZINC001344321777	1390781815	/nfs/dbraw/zinc/78/18/15/1390781815.db2.gz	BFJCGPHDNYSGEE-DOMZBBRYSA-N	0	3	327.815	3.445	20	30		EGEDHN
C[C@@H](NC1(CNC(=O)[C@@H](C)C#N)CCCC1)c1cc(F)ccc1F	ZINC001698795537	1406463877	/nfs/dbraw/zinc/46/38/77/1406463877.db2.gz	FSNYVALRIGAYLR-QWHCGFSZSA-N	0	3	335.398	3.204	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)c1cc(C(C)C)nc2onc(C)c21	ZINC001346095780	1390906925	/nfs/dbraw/zinc/90/69/25/1390906925.db2.gz	IZJHIMCVDCZDGR-CYBMUJFWSA-N	0	3	337.383	3.361	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cccc(F)c2F)CCCC1	ZINC001698801384	1406477331	/nfs/dbraw/zinc/47/73/31/1406477331.db2.gz	OYOTXLPMSXTSAG-UHFFFAOYSA-N	0	3	328.790	3.350	20	30		EGEDHN
Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@@H]1N2C(=O)c1csc(C#N)c1	ZINC001348324267	1391206328	/nfs/dbraw/zinc/20/63/28/1391206328.db2.gz	FPFWMQPVDKQGPK-WMZOPIPTSA-N	0	3	337.448	3.376	20	30		EGEDHN
CC(C)O[C@@H](C(=O)C(C#N)c1ncc(Cl)n1C)c1ccccc1	ZINC001349703285	1391356046	/nfs/dbraw/zinc/35/60/46/1391356046.db2.gz	WGKXCWPHENJXMO-XJKSGUPXSA-N	0	3	331.803	3.416	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N(C)CCCc1cc(-c2ccccc2)n[nH]1	ZINC001353193219	1391956114	/nfs/dbraw/zinc/95/61/14/1391956114.db2.gz	TXIOWFXKWTWTSN-GOSISDBHSA-N	0	3	340.471	3.151	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)N[C@H](C)c1ccc2c(c1)CC(=O)N2	ZINC001353193216	1391956468	/nfs/dbraw/zinc/95/64/68/1391956468.db2.gz	TWNWGWYASSYDPF-RHSMWYFYSA-N	0	3	345.487	3.436	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)C(C)(CC)CC)C1	ZINC001479344424	1392220962	/nfs/dbraw/zinc/22/09/62/1392220962.db2.gz	KASSOQVCTJYQFQ-BETUJISGSA-N	0	3	331.298	3.206	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1cc(C2CC2)n[nH]1	ZINC001479829010	1392415965	/nfs/dbraw/zinc/41/59/65/1392415965.db2.gz	ICWDQBYTMRXOSG-BLLLJJGKSA-N	0	3	336.867	3.012	20	30		EGEDHN
CCC[C@H](C(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)C1)C(C)C	ZINC001480117907	1392593016	/nfs/dbraw/zinc/59/30/16/1392593016.db2.gz	LXCUZCIFZNSJMZ-ROUUACIJSA-N	0	3	345.462	3.460	20	30		EGEDHN
CCc1ccc(C(=O)NC[C@@H](C)NCc2ccc(F)c(C#N)c2)s1	ZINC001480497850	1392770376	/nfs/dbraw/zinc/77/03/76/1392770376.db2.gz	YQJSDQHADZCXPH-GFCCVEGCSA-N	0	3	345.443	3.229	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1c[nH]nc1C1CCCCC1	ZINC001480804625	1392944807	/nfs/dbraw/zinc/94/48/07/1392944807.db2.gz	ZJWVZRQTSYCDMD-ZDUSSCGKSA-N	0	3	338.883	3.308	20	30		EGEDHN
CC(C)c1ccc([C@@H](C)N(C)CCNC(=O)c2cc(C#N)c[nH]2)cc1	ZINC001480852999	1392983586	/nfs/dbraw/zinc/98/35/86/1392983586.db2.gz	QPEMUPYDBKLEGA-OAHLLOKOSA-N	0	3	338.455	3.433	20	30		EGEDHN
CC[C@H](CNC(=O)c1cccc(F)c1F)NCc1ccc(C#N)s1	ZINC001481845496	1394555859	/nfs/dbraw/zinc/55/58/59/1394555859.db2.gz	HSHSNZFOLSTZAY-LLVKDONJSA-N	0	3	349.406	3.196	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2oncc2C)CCCC[C@@H]1C	ZINC001481959848	1394620102	/nfs/dbraw/zinc/62/01/02/1394620102.db2.gz	CTNZZUNBNUUVOE-BLLLJJGKSA-N	0	3	325.840	3.004	20	30		EGEDHN
C=C(Br)CN[C@@H](CNC(=O)CCC1CCC1)C(C)C	ZINC001698962186	1406716712	/nfs/dbraw/zinc/71/67/12/1406716712.db2.gz	WWLGMTGXHPFLPQ-AWEZNQCLSA-N	0	3	331.298	3.206	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)c2ccccc2)CCCC1	ZINC001482208962	1394802154	/nfs/dbraw/zinc/80/21/54/1394802154.db2.gz	VSTDQZGYOGCSQR-UHFFFAOYSA-N	0	3	337.261	3.227	20	30		EGEDHN
C=C(Cl)CNC[C@H](CC(C)C)NC(=O)c1ccc(N(C)C)cc1	ZINC001482396510	1394958151	/nfs/dbraw/zinc/95/81/51/1394958151.db2.gz	MEDKAKUZAXIAMO-INIZCTEOSA-N	0	3	337.895	3.239	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1sc(CC)nc1C)C(C)C	ZINC001698971731	1406736628	/nfs/dbraw/zinc/73/66/28/1406736628.db2.gz	AZRDAYCKYVXETD-GFCCVEGCSA-N	0	3	329.897	3.110	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cnc2ccc(F)cc2c1)C(C)C	ZINC001698978487	1406751183	/nfs/dbraw/zinc/75/11/83/1406751183.db2.gz	UAMGCAKYKDLRAP-KRWDZBQOSA-N	0	3	349.837	3.470	20	30		EGEDHN
Cc1cc(C)cc(C(=O)N[C@@H](C)CN(C)Cc2cccc(C#N)c2)c1	ZINC001498443161	1396996728	/nfs/dbraw/zinc/99/67/28/1396996728.db2.gz	JMAZQJVFEHWLNC-KRWDZBQOSA-N	0	3	335.451	3.425	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1sc(C)nc1C	ZINC001689912096	1404205730	/nfs/dbraw/zinc/20/57/30/1404205730.db2.gz	QCMLJQQAKBELCU-BXUZGUMPSA-N	0	3	341.908	3.485	20	30		EGEDHN
CCCC1(C(=O)N[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)CCC1	ZINC001690286171	1404448007	/nfs/dbraw/zinc/44/80/07/1404448007.db2.gz	KWMICVJXFOGVEN-QAQDUYKDSA-N	0	3	343.446	3.405	20	30		EGEDHN
C[C@H](CCNC(=O)C1CCC(F)(F)CC1)NCc1ccccc1C#N	ZINC001690865780	1404784716	/nfs/dbraw/zinc/78/47/16/1404784716.db2.gz	YGERSRURBYWGQL-CQSZACIVSA-N	0	3	349.425	3.368	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC[C@H]1C[C@H](NCc2cc(Cl)ccc2Cl)C1	ZINC001691770893	1405482132	/nfs/dbraw/zinc/48/21/32/1405482132.db2.gz	MYYSXPAPGBVDLY-MJVIPROJSA-N	0	3	340.254	3.137	20	30		EGEDHN
CC[C@@H](CNC(=O)Cc1ccsc1C)NCc1ccc(C#N)s1	ZINC001732223721	1428472484	/nfs/dbraw/zinc/47/24/84/1428472484.db2.gz	PZMDRAYFEDHCLC-AWEZNQCLSA-N	0	3	347.509	3.217	20	30		EGEDHN
N#Cc1ccc(C[NH2+]CC2(NC(=O)c3ccccc3[O-])CCCC2)cc1	ZINC001732225831	1428474259	/nfs/dbraw/zinc/47/42/59/1428474259.db2.gz	BRUOBADVCVYMGB-UHFFFAOYSA-N	0	3	349.434	3.096	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2ccc3c(c2)CCO3)CCCC1	ZINC001732236488	1428482559	/nfs/dbraw/zinc/48/25/59/1428482559.db2.gz	RJUWZNXSDSZMRZ-UHFFFAOYSA-N	0	3	334.847	3.006	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)CCc2ccncc2)CCCC[C@H]1C	ZINC001732261171	1428501296	/nfs/dbraw/zinc/50/12/96/1428501296.db2.gz	XGXHZCUPQGXLDB-DNVCBOLYSA-N	0	3	349.906	3.421	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2c(C)cc(C)nc2C)CCCC1	ZINC001732394027	1428562290	/nfs/dbraw/zinc/56/22/90/1428562290.db2.gz	MPNURFOGPSTQCK-UHFFFAOYSA-N	0	3	335.879	3.392	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)c1ccc(Cl)cc1	ZINC001699471854	1412854250	/nfs/dbraw/zinc/85/42/50/1412854250.db2.gz	PINZPBWPJJOELR-CQSZACIVSA-N	0	3	341.842	3.462	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)c1ccc(CNC(=O)CN(C)C2CCC2)cc1	ZINC001700094410	1413508521	/nfs/dbraw/zinc/50/85/21/1413508521.db2.gz	JQMSOAYRNMOKRI-HNNXBMFYSA-N	0	3	349.906	3.190	20	30		EGEDHN
CC(C)SCC(=O)N[C@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC001700172072	1413578013	/nfs/dbraw/zinc/57/80/13/1413578013.db2.gz	CGRPPNCHKCDMEU-SFHVURJKSA-N	0	3	345.512	3.171	20	30		EGEDHN
CCCC[C@H](CNCc1ccc(C#N)s1)NC(=O)c1ccncc1	ZINC001700518060	1414172126	/nfs/dbraw/zinc/17/21/26/1414172126.db2.gz	WQYPIFGFHHNVJY-OAHLLOKOSA-N	0	3	342.468	3.093	20	30		EGEDHN
Cc1cocc1C(=O)N[C@H](CNCc1ccc(C#N)s1)C(C)(C)C	ZINC001700992791	1414637713	/nfs/dbraw/zinc/63/77/13/1414637713.db2.gz	APQPWBPKJQQBBT-MRXNPFEDSA-N	0	3	345.468	3.456	20	30		EGEDHN
C=C(Cl)CNC1CC(N(C)C(=O)CCn2ccc3ccccc32)C1	ZINC001701026866	1414688937	/nfs/dbraw/zinc/68/89/37/1414688937.db2.gz	KCKHFBRCLSJPDA-UHFFFAOYSA-N	0	3	345.874	3.363	20	30		EGEDHN
Cc1cc(C)c(C(=O)N[C@@H](C)CNCc2ccc(C#N)s2)c(C)c1	ZINC001733022845	1429142045	/nfs/dbraw/zinc/14/20/45/1429142045.db2.gz	CLMPPYKPQYVFAQ-HNNXBMFYSA-N	0	3	341.480	3.453	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1cc(Cl)no1	ZINC001713002279	1417556282	/nfs/dbraw/zinc/55/62/82/1417556282.db2.gz	JFJRCUPEMICOND-QWRGUYRKSA-N	0	3	332.231	3.053	20	30		EGEDHN
CC(C)(C(=O)NC[C@@H]1CCCN(Cc2cccc(C#N)c2)C1)C(F)F	ZINC001713218817	1417798593	/nfs/dbraw/zinc/79/85/93/1417798593.db2.gz	CWERQTWCADJJFQ-INIZCTEOSA-N	0	3	349.425	3.178	20	30		EGEDHN
C[C@@H](NC(=O)C(C)(C)F)[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001713272426	1417887402	/nfs/dbraw/zinc/88/74/02/1417887402.db2.gz	VOTLFVCWIBPEHN-PBHICJAKSA-N	0	3	331.435	3.023	20	30		EGEDHN
CC1(CCC(=O)N2CC[C@H](CNCc3ccccc3C#N)C2)CC1	ZINC001713359972	1417975226	/nfs/dbraw/zinc/97/52/26/1417975226.db2.gz	YQDCIVCPNXHUCM-MRXNPFEDSA-N	0	3	325.456	3.077	20	30		EGEDHN
CCN(CCNC(=O)[C@@H](F)c1ccccc1)Cc1cccc(C#N)c1	ZINC001713493462	1418195938	/nfs/dbraw/zinc/19/59/38/1418195938.db2.gz	KQQSSCKIAQZUMO-IBGZPJMESA-N	0	3	339.414	3.207	20	30		EGEDHN
CCC(CC)CC(=O)NC[C@@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC001713539568	1418297313	/nfs/dbraw/zinc/29/73/13/1418297313.db2.gz	ICBKRFHSAWZIMJ-IBGZPJMESA-N	0	3	327.472	3.323	20	30		EGEDHN
CC(C)SCC(=O)NCC[C@H]1CCN(Cc2ccccc2C#N)C1	ZINC001713725002	1418503525	/nfs/dbraw/zinc/50/35/25/1418503525.db2.gz	OWZJGIQMJPCSTD-INIZCTEOSA-N	0	3	345.512	3.028	20	30		EGEDHN
CC1(CCC(=O)N[C@H](CNCc2ccc(C#N)cc2F)C2CC2)CC1	ZINC001733187798	1429289506	/nfs/dbraw/zinc/28/95/06/1429289506.db2.gz	QWIILOGJBIDPNB-GOSISDBHSA-N	0	3	343.446	3.262	20	30		EGEDHN
Cc1csc(C(=O)NC[C@H](C)CNCc2ccccc2C#N)c1	ZINC001714389288	1419138050	/nfs/dbraw/zinc/13/80/50/1419138050.db2.gz	UYTOGTIZSNQEFS-CQSZACIVSA-N	0	3	327.453	3.084	20	30		EGEDHN
C[C@@H](CNCc1ccccc1C#N)CNC(=O)C[C@H](C)c1ccco1	ZINC001714443585	1419175479	/nfs/dbraw/zinc/17/54/79/1419175479.db2.gz	DHMFJYBXADNBAJ-HOTGVXAUSA-N	0	3	339.439	3.187	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)Cc1ccc(C)cc1Cl	ZINC001714476486	1419200145	/nfs/dbraw/zinc/20/01/45/1419200145.db2.gz	JLOBWRWVEAWMRE-CYBMUJFWSA-N	0	3	329.271	3.428	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccnc(C3CC3)c2)CCCC1	ZINC001714497681	1419222080	/nfs/dbraw/zinc/22/20/80/1419222080.db2.gz	QULWMLPKORAXDU-UHFFFAOYSA-N	0	3	333.863	3.344	20	30		EGEDHN
CCc1ccsc1C(=O)NCC[C@H](C)NCc1ccccc1C#N	ZINC001714500650	1419226597	/nfs/dbraw/zinc/22/65/97/1419226597.db2.gz	POWGYMSDJWCVDE-AWEZNQCLSA-N	0	3	341.480	3.480	20	30		EGEDHN
CCN(CCNC(=O)c1cc2ccccn2c1)Cc1ccc(C#N)cc1	ZINC001714593052	1419341766	/nfs/dbraw/zinc/34/17/66/1419341766.db2.gz	DMTFWECGYYYCSR-UHFFFAOYSA-N	0	3	346.434	3.063	20	30		EGEDHN
C[C@H](C#N)C(=O)NCC1(NCc2cc(Cl)ccc2F)CCCC1	ZINC001715294942	1420002386	/nfs/dbraw/zinc/00/23/86/1420002386.db2.gz	IJOCCCOFHRJWJK-GFCCVEGCSA-N	0	3	337.826	3.157	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2c(C)noc2C(F)F)CCCC1	ZINC001715304590	1420013174	/nfs/dbraw/zinc/01/31/74/1420013174.db2.gz	SJYDBCODVZXVFD-UHFFFAOYSA-N	0	3	347.793	3.305	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)NC(=O)c1cc2occc2s1	ZINC001715950511	1420417924	/nfs/dbraw/zinc/41/79/24/1420417924.db2.gz	VFZKLMVELXTQLE-SNVBAGLBSA-N	0	3	345.449	3.336	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccc(OCC#N)cc1)NC(=O)CC1CCCC1	ZINC001716017116	1420471604	/nfs/dbraw/zinc/47/16/04/1420471604.db2.gz	PIYQKXFKSLGGHM-INIZCTEOSA-N	0	3	343.471	3.106	20	30		EGEDHN
C[C@@H](CN(C)Cc1cccc(C#N)c1)NC(=O)c1c[nH]c2ccccc21	ZINC001716486699	1420705513	/nfs/dbraw/zinc/70/55/13/1420705513.db2.gz	XDWUSBQGSZSDST-HNNXBMFYSA-N	0	3	346.434	3.290	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCc1ccc2c(c1)CN(CCC1CCCC1)C2	ZINC001717269117	1421224576	/nfs/dbraw/zinc/22/45/76/1421224576.db2.gz	ARXJFXADKVJCLW-HNNXBMFYSA-N	0	3	325.456	3.358	20	30		EGEDHN
CC1CC(C(=O)N2CCC[C@@H]2CNCC#Cc2cccc(Cl)c2)C1	ZINC001733338287	1429522721	/nfs/dbraw/zinc/52/27/21/1429522721.db2.gz	MGKOJTLGWSDFOF-GXOAENINSA-N	0	3	344.886	3.318	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC1(C)CCN([C@@H]2CCc3c2cccc3Cl)CC1	ZINC001723999069	1424621569	/nfs/dbraw/zinc/62/15/69/1424621569.db2.gz	XJTLYVOXCVSBGV-SUMWQHHRSA-N	0	3	345.874	3.458	20	30		EGEDHN
CN(C(=O)CC(C)(C)C)[C@H](CNCc1cc(C#N)ccc1F)C1CC1	ZINC001725447537	1426111873	/nfs/dbraw/zinc/11/18/73/1426111873.db2.gz	AGLWJTCHZKPXTL-GOSISDBHSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC(C)(C)CC(=O)N[C@H]1CC[C@@H](CNCc2ccccc2C#N)C1	ZINC001725622774	1426288331	/nfs/dbraw/zinc/28/83/31/1426288331.db2.gz	IHTGIPSGCHLDQJ-QAPCUYQASA-N	0	3	327.472	3.369	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1c[nH]nc1C1CC1	ZINC001731296145	1427238630	/nfs/dbraw/zinc/23/86/30/1427238630.db2.gz	WTSASOFZEOUPMM-IUODEOHRSA-N	0	3	336.867	3.012	20	30		EGEDHN
CC(C)CCC(=O)NC[C@H](NCc1ccc(C#N)cc1F)C1CC1	ZINC001731397811	1427355354	/nfs/dbraw/zinc/35/53/54/1427355354.db2.gz	YAUVDLYIADYCGU-SFHVURJKSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)C(C)(C)c1ccccc1OC	ZINC001731741347	1427829635	/nfs/dbraw/zinc/82/96/35/1427829635.db2.gz	QKCRFZGWVQABJJ-CQSZACIVSA-N	0	3	338.879	3.210	20	30		EGEDHN
CCN(CCNC(=O)C1CCCCCC1)Cc1ccc(C#N)cc1	ZINC001731799116	1427959345	/nfs/dbraw/zinc/95/93/45/1427959345.db2.gz	AUMXFSAGMCWXBW-UHFFFAOYSA-N	0	3	327.472	3.467	20	30		EGEDHN
CCN(CCNC(=O)c1cc(C#N)c[nH]1)Cc1ccc(Cl)cc1C	ZINC001731801270	1427965095	/nfs/dbraw/zinc/96/50/95/1427965095.db2.gz	VKXFWWPVSZXDEO-UHFFFAOYSA-N	0	3	344.846	3.100	20	30		EGEDHN
CCc1[nH]ccc1C(=O)N1CCCC[C@H]1CNCC#Cc1ccccc1	ZINC001733921346	1437735426	/nfs/dbraw/zinc/73/54/26/1437735426.db2.gz	FQDSNOXUVOCJSN-IBGZPJMESA-N	0	3	349.478	3.213	20	30		EGEDHN
C=CCC[C@H](C)N1CC[C@H](NC(=O)c2ccc(P(C)(C)=O)cc2)C1	ZINC001752411635	1440174513	/nfs/dbraw/zinc/17/45/13/1440174513.db2.gz	SKTKPCAPYVIRIC-RDJZCZTQSA-N	0	3	348.427	3.093	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CC23CCN(Cc2ccccn2)CC3)CCC1	ZINC001752426300	1440177258	/nfs/dbraw/zinc/17/72/58/1440177258.db2.gz	VVWXODPKACOMKH-GOSISDBHSA-N	0	3	339.483	3.299	20	30		EGEDHN
N#Cc1ccc(CN[C@H](CNC(=O)c2sccc2F)C2CC2)s1	ZINC001752458974	1440183442	/nfs/dbraw/zinc/18/34/42/1440183442.db2.gz	OYUQAJXNQQNCQY-CQSZACIVSA-N	0	3	349.456	3.119	20	30		EGEDHN
CCCC(C)(C)C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2OC)C1	ZINC001752660623	1440198344	/nfs/dbraw/zinc/19/83/44/1440198344.db2.gz	IXSZFKCPEVUCDZ-QAQDUYKDSA-N	0	3	343.471	3.130	20	30		EGEDHN
C[C@@H]1CC[C@H](C(=O)N[C@H]2C[C@H](NCC#Cc3cccc(Cl)c3)C2)C1	ZINC001752670490	1440198933	/nfs/dbraw/zinc/19/89/33/1440198933.db2.gz	YKFDAZIQCBMJSW-IWKCEXAMSA-N	0	3	344.886	3.365	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H](C)CCOc2ccccc2)C1	ZINC001752692420	1440200825	/nfs/dbraw/zinc/20/08/25/1440200825.db2.gz	UIOSXFHWHROXJW-BPUTZDHNSA-N	0	3	336.863	3.081	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1C[C@@H](NCc2c(C)nsc2C)C1	ZINC001752732158	1440204242	/nfs/dbraw/zinc/20/42/42/1440204242.db2.gz	YPLNTSYLGVXTCK-IYBDPMFKSA-N	0	3	333.501	3.265	20	30		EGEDHN
CC[C@@H]1CCC[C@]1(C)C(=O)N[C@H]1C[C@@H](NCC#Cc2ccccc2)C1	ZINC001752738553	1440204508	/nfs/dbraw/zinc/20/45/08/1440204508.db2.gz	ZEJCRSOFUSZSHI-JBPLPALLSA-N	0	3	338.495	3.491	20	30		EGEDHN
CC(C)(C(=O)N[C@H]1C[C@@H](NCC#Cc2ccc(F)cc2)C1)C1CCC1	ZINC001752750958	1440204936	/nfs/dbraw/zinc/20/49/36/1440204936.db2.gz	LMNYUOCJFBADIH-KDURUIRLSA-N	0	3	342.458	3.240	20	30		EGEDHN
C#CCCCCC(=O)N1CCC[C@@H](CNCc2csc(CC)n2)C1	ZINC001752796424	1440214469	/nfs/dbraw/zinc/21/44/69/1440214469.db2.gz	MIEOQSOPFOPWTG-INIZCTEOSA-N	0	3	347.528	3.227	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)[C@@]1(C)CCCc2ccccc21	ZINC001752823478	1440222229	/nfs/dbraw/zinc/22/22/29/1440222229.db2.gz	CMBDDJXSGINQBB-KNQAVFIVSA-N	0	3	338.495	3.275	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@](C)(OC)c1ccccc1	ZINC001752823928	1440222461	/nfs/dbraw/zinc/22/24/61/1440222461.db2.gz	MUKXBZLLTITGDK-UYAOXDASSA-N	0	3	330.472	3.095	20	30		EGEDHN
CCCC1(C(=O)N2CCCC[C@@H]2[C@H]2CCCN2CC#CCOC)CC1	ZINC001752833024	1440226164	/nfs/dbraw/zinc/22/61/64/1440226164.db2.gz	AJMOQSSEAQMING-RTBURBONSA-N	0	3	346.515	3.062	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)C2(C(F)F)CCCC2)C1	ZINC001752840934	1440230429	/nfs/dbraw/zinc/23/04/29/1440230429.db2.gz	NGIWOJNHFOEXOJ-GJZGRUSLSA-N	0	3	326.431	3.052	20	30		EGEDHN
Cc1cc(C(=O)NC[C@@H](C)NCc2ccc(C#N)s2)ccc1Cl	ZINC001752897817	1440242213	/nfs/dbraw/zinc/24/22/13/1440242213.db2.gz	IQADOFNNDRXOQF-GFCCVEGCSA-N	0	3	347.871	3.490	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](CNCc2ccccc2C#N)C1	ZINC001752942005	1440250986	/nfs/dbraw/zinc/25/09/86/1440250986.db2.gz	VDTGKPLTTTWXPG-KRWDZBQOSA-N	0	3	337.467	3.265	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1CCC[C@@H](NCc2nccn2C(F)F)C1	ZINC001752971312	1440255050	/nfs/dbraw/zinc/25/50/50/1440255050.db2.gz	LBXBVPRFZGHKAC-KGLIPLIRSA-N	0	3	340.418	3.152	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)C2(CCF)CC2)C1	ZINC001752994132	1440261136	/nfs/dbraw/zinc/26/11/36/1440261136.db2.gz	VORMUYWUHZCSFQ-GOSISDBHSA-N	0	3	343.446	3.121	20	30		EGEDHN
CC#CCN(C)[C@H]1CCCN(C(=O)c2cnc(C(C)(C)C)s2)C1	ZINC001753000954	1440264584	/nfs/dbraw/zinc/26/45/84/1440264584.db2.gz	WPFOBRIUUOPVKY-AWEZNQCLSA-N	0	3	333.501	3.000	20	30		EGEDHN
CC(C)(C)C(=O)NCCC[C@@H]1CCCN1Cc1ccccc1C#N	ZINC001753038099	1440275393	/nfs/dbraw/zinc/27/53/93/1440275393.db2.gz	OZQVUJAIPFQIFY-GOSISDBHSA-N	0	3	327.472	3.465	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCN(C)[C@@H]1CCc2c1cc(Cl)cc2Cl	ZINC001753043524	1440277166	/nfs/dbraw/zinc/27/71/66/1440277166.db2.gz	DDTLVGJTQXYQIR-ZUZCIYMTSA-N	0	3	340.254	3.188	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NCCN(C)Cc1cc(C)cc(C)c1	ZINC001753072461	1440289274	/nfs/dbraw/zinc/28/92/74/1440289274.db2.gz	TUEHLRWZZQACFV-UHFFFAOYSA-N	0	3	334.463	3.075	20	30		EGEDHN
C=CCC1(C(=O)NCCN(C)Cc2ccc(C)c(C)c2)CCOCC1	ZINC001753072508	1440289287	/nfs/dbraw/zinc/28/92/87/1440289287.db2.gz	VFILXMJNSGWEBV-UHFFFAOYSA-N	0	3	344.499	3.224	20	30		EGEDHN
CC#CCCCC(=O)NCCN(CC)Cc1ccc2cc[nH]c2c1	ZINC001753090026	1440298464	/nfs/dbraw/zinc/29/84/64/1440298464.db2.gz	PLSYRFAMHBTSBJ-UHFFFAOYSA-N	0	3	325.456	3.300	20	30		EGEDHN
CC[C@@H]1CCCC[C@H]1C(=O)N(C)CCNCc1ccc(C#N)cc1	ZINC001753248670	1440342815	/nfs/dbraw/zinc/34/28/15/1440342815.db2.gz	VLZOLNTWLHLCRR-RTBURBONSA-N	0	3	327.472	3.323	20	30		EGEDHN
CC(C)N(CCCNC(=O)[C@@H](C)C#N)Cc1ccc(Cl)cc1F	ZINC001753284581	1440348404	/nfs/dbraw/zinc/34/84/04/1440348404.db2.gz	DCPGOGRLWONJEM-ZDUSSCGKSA-N	0	3	339.842	3.355	20	30		EGEDHN
C=C(C)CN[C@@H](CNC(=O)C[C@H]1CC(C)(C)CO1)c1ccccc1	ZINC001753300489	1440353885	/nfs/dbraw/zinc/35/38/85/1440353885.db2.gz	UJXRXURJHQGKFF-ROUUACIJSA-N	0	3	330.472	3.215	20	30		EGEDHN
C=C(C)CN[C@H](CNC(=O)C[C@@H]1CC(C)(C)CO1)c1ccccc1	ZINC001753300488	1440353955	/nfs/dbraw/zinc/35/39/55/1440353955.db2.gz	UJXRXURJHQGKFF-QZTJIDSGSA-N	0	3	330.472	3.215	20	30		EGEDHN
C#CCCN[C@H](CNC(=O)c1ccc2ncsc2c1)c1ccccc1	ZINC001753302741	1440354543	/nfs/dbraw/zinc/35/45/43/1440354543.db2.gz	IYARNJMUYYCQOQ-GOSISDBHSA-N	0	3	349.459	3.380	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CCC)C(=O)C[C@H]2CCC(C)(C)CO2)C1	ZINC001753318195	1440361104	/nfs/dbraw/zinc/36/11/04/1440361104.db2.gz	FHSGDOYNLAIYFS-ZWKOTPCHSA-N	0	3	336.520	3.471	20	30		EGEDHN
CCC(CC)C(=O)NCC[C@H]1CCN(CC#Cc2ccccc2)C1	ZINC001753322706	1440364650	/nfs/dbraw/zinc/36/46/50/1440364650.db2.gz	PHLRWGMFKJZJMX-IBGZPJMESA-N	0	3	326.484	3.303	20	30		EGEDHN
CC[C@H](C)CC(=O)NCC[C@@H]1CCN(CC#Cc2ccc(F)cc2)C1	ZINC001753326371	1440366807	/nfs/dbraw/zinc/36/68/07/1440366807.db2.gz	JSUHJWDZHWLMKD-PKOBYXMFSA-N	0	3	344.474	3.442	20	30		EGEDHN
C=CCC1(C(=O)NCC2CN(CCCc3ccsc3)C2)CCC1	ZINC001753408876	1440392727	/nfs/dbraw/zinc/39/27/27/1440392727.db2.gz	CSAANYPUZHWJNZ-UHFFFAOYSA-N	0	3	332.513	3.475	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N(C)[C@@H]1CCN(Cc2cccc(N(C)C)c2)C1	ZINC001753441666	1440401890	/nfs/dbraw/zinc/40/18/90/1440401890.db2.gz	NNXXWGJCPZIYLE-FXAWDEMLSA-N	0	3	343.515	3.388	20	30		EGEDHN
C=CC(C)(C)C(=O)N(C)[C@H]1CCN(Cc2cccc3c2CCOC3)C1	ZINC001753443551	1440402775	/nfs/dbraw/zinc/40/27/75/1440402775.db2.gz	YPEDBQGMTXHRPB-SFHVURJKSA-N	0	3	342.483	3.004	20	30		EGEDHN
C#CCCCC(=O)N(CC)[C@H]1CCN(Cc2ccc3ncccc3c2)C1	ZINC001753454658	1440407619	/nfs/dbraw/zinc/40/76/19/1440407619.db2.gz	AHNFPVFDZAUSSD-FQEVSTJZSA-N	0	3	349.478	3.461	20	30		EGEDHN
C=CCOCCN1CC[C@@H](N(CC)C(=O)c2csc(Cl)c2)C1	ZINC001753458745	1440409593	/nfs/dbraw/zinc/40/95/93/1440409593.db2.gz	JYJISLFJPXNDQB-CQSZACIVSA-N	0	3	342.892	3.141	20	30		EGEDHN
CC[C@H](CNC(=O)[C@@H](C)C(C)(C)C)NCC#Cc1ccc(F)cc1	ZINC001753478790	1440415974	/nfs/dbraw/zinc/41/59/74/1440415974.db2.gz	MNKUMXXUHUTJPN-CRAIPNDOSA-N	0	3	332.463	3.344	20	30		EGEDHN
CC[C@@H](CNC(=O)c1c[nH]cc1C1CC1)NCc1ccc(C#N)s1	ZINC001753492987	1440420329	/nfs/dbraw/zinc/42/03/29/1440420329.db2.gz	VQDYYNPTJQNYOO-ZDUSSCGKSA-N	0	3	342.468	3.123	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)C1Cc2ccccc2C1)C1CC1	ZINC001753524669	1440429423	/nfs/dbraw/zinc/42/94/23/1440429423.db2.gz	JDGXKJYUMOLLCJ-LJQANCHMSA-N	0	3	332.875	3.028	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2ccc(OC)o2)CCCC[C@@H]1C	ZINC001753536247	1440432758	/nfs/dbraw/zinc/43/27/58/1440432758.db2.gz	RMEZCVMFPAJZLR-SJCJKPOMSA-N	0	3	340.851	3.309	20	30		EGEDHN
CC1(C(=O)N2CCC[C@H](CCNCc3ccccc3C#N)C2)CCC1	ZINC001753552801	1440435432	/nfs/dbraw/zinc/43/54/32/1440435432.db2.gz	HNAHBIXFVOHJKW-QGZVFWFLSA-N	0	3	339.483	3.467	20	30		EGEDHN
O=C(CCCF)NCc1ccc(CNCC#Cc2ccccc2)cc1	ZINC001753589721	1440442382	/nfs/dbraw/zinc/44/23/82/1440442382.db2.gz	KRCAWSQPITYMGN-UHFFFAOYSA-N	0	3	338.426	3.194	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@H](C)CNCc1cc(O)ccc1Cl	ZINC001753634750	1440453014	/nfs/dbraw/zinc/45/30/14/1440453014.db2.gz	SWOLDVHWRDMZSV-CYBMUJFWSA-N	0	3	338.879	3.490	20	30		EGEDHN
CCc1ccc(C(=O)NC[C@H](C)CNCc2ccccc2C#N)cc1	ZINC001753640819	1440454374	/nfs/dbraw/zinc/45/43/74/1440454374.db2.gz	MLYNCZRVLWFKPG-MRXNPFEDSA-N	0	3	335.451	3.276	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N(C)[C@@H](C)CNCc1cccc(NC(C)=O)c1	ZINC001753708035	1440469933	/nfs/dbraw/zinc/46/99/33/1440469933.db2.gz	XLKOQBOHTIUPBQ-HNNXBMFYSA-N	0	3	345.487	3.184	20	30		EGEDHN
CC(C)C[C@H](CNCc1ccc(F)c(C#N)c1)NC(=O)C1(C)CC1	ZINC001753735155	1440477440	/nfs/dbraw/zinc/47/74/40/1440477440.db2.gz	QEYKXFNFMDBMBM-MRXNPFEDSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCCCN1C(=O)c1cnc(C2CC2)o1	ZINC001753778962	1440487017	/nfs/dbraw/zinc/48/70/17/1440487017.db2.gz	BXRBSPDSZFUTRJ-CQSZACIVSA-N	0	3	337.851	3.279	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)C[C@H](C)c1c(C)n[nH]c1C)C(C)C	ZINC001753834158	1440500410	/nfs/dbraw/zinc/50/04/10/1440500410.db2.gz	IVFNUGVVBXTSTA-XHDPSFHLSA-N	0	3	340.899	3.003	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1scnc1C1CC1)C(C)C	ZINC001753839745	1440502206	/nfs/dbraw/zinc/50/22/06/1440502206.db2.gz	OLRKPWORFOZLTI-GFCCVEGCSA-N	0	3	327.881	3.117	20	30		EGEDHN
C=CC(C)(C)C(=O)N(C)CCN(C)CCOc1c(C)cccc1C	ZINC001753859241	1440510746	/nfs/dbraw/zinc/51/07/46/1440510746.db2.gz	IRBXMDQVMBRVOU-UHFFFAOYSA-N	0	3	332.488	3.285	20	30		EGEDHN
CC#CCCCC(=O)N(C)CCN(C)[C@@H](C)c1cccc(OC)c1	ZINC001753861272	1440511568	/nfs/dbraw/zinc/51/15/68/1440511568.db2.gz	ZPFYNHVVDQJXRW-KRWDZBQOSA-N	0	3	330.472	3.340	20	30		EGEDHN
C[C@H](CCNCc1cc(C#N)ccc1F)NC(=O)[C@@H]1CC=CCC1	ZINC001753944179	1440524756	/nfs/dbraw/zinc/52/47/56/1440524756.db2.gz	IDJQWNCKFLHYGB-GDBMZVCRSA-N	0	3	329.419	3.038	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)CCNCc2cc(C)no2)CCCCC1	ZINC001754024908	1440532891	/nfs/dbraw/zinc/53/28/91/1440532891.db2.gz	ZWHXVBJEXKNXIM-OAHLLOKOSA-N	0	3	333.476	3.494	20	30		EGEDHN
CCN(CCNCc1cccc(C#N)c1)C(=O)CCc1ccccc1C	ZINC001754069489	1440537995	/nfs/dbraw/zinc/53/79/95/1440537995.db2.gz	XNQRDKYQFYIFCF-UHFFFAOYSA-N	0	3	349.478	3.438	20	30		EGEDHN
CCN(CCNCc1ccc(C#N)cc1)C(=O)c1cc(C)cc(C)c1	ZINC001754078426	1440538985	/nfs/dbraw/zinc/53/89/85/1440538985.db2.gz	FXEIUDOGHXFSGX-UHFFFAOYSA-N	0	3	335.451	3.427	20	30		EGEDHN
CCCC(C)(C)C(=O)NC/C=C\CNCc1ccc(F)c(C#N)c1	ZINC001754165297	1440546459	/nfs/dbraw/zinc/54/64/59/1440546459.db2.gz	XQZNGQIPGKUBBP-WAYWQWQTSA-N	0	3	331.435	3.286	20	30		EGEDHN
C=CCCC(=O)N[C@H](C)CNCc1csc(Br)c1	ZINC001754219429	1440552349	/nfs/dbraw/zinc/55/23/49/1440552349.db2.gz	MHLZNPBUAYDUSY-SNVBAGLBSA-N	0	3	331.279	3.071	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccccc1)NC(=O)c1cc2ccncc2s1	ZINC001754269807	1440561226	/nfs/dbraw/zinc/56/12/26/1440561226.db2.gz	BAYKJRKAUSQSLV-HNNXBMFYSA-N	0	3	349.459	3.056	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccc(Cl)cc1)NC(=O)[C@@H]1CC12CCCC2	ZINC001754289780	1440564800	/nfs/dbraw/zinc/56/48/00/1440564800.db2.gz	UWJRCLFKCUCZQG-YJBOKZPZSA-N	0	3	344.886	3.366	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](C)CN(C)CCOc2ccc(F)cc2)CC1	ZINC001754322555	1440578744	/nfs/dbraw/zinc/57/87/44/1440578744.db2.gz	FYZFJLCNINCKMQ-INIZCTEOSA-N	0	3	348.462	3.387	20	30		EGEDHN
CN(CCCNCc1ccccc1C#N)C(=O)CCc1ccsc1	ZINC001754375519	1440593022	/nfs/dbraw/zinc/59/30/22/1440593022.db2.gz	FZQMVLVKJXJICO-UHFFFAOYSA-N	0	3	341.480	3.191	20	30		EGEDHN
O=C(N[C@@H](CNCC#Cc1ccc(F)cc1)C1CC1)c1ccsc1	ZINC001754433902	1440597558	/nfs/dbraw/zinc/59/75/58/1440597558.db2.gz	CVARCXOCINAOLB-SFHVURJKSA-N	0	3	342.439	3.037	20	30		EGEDHN
C[C@@H](C(=O)N[C@@H](CNCC#Cc1cccc(Cl)c1)C1CC1)C1CC1	ZINC001754437217	1440598294	/nfs/dbraw/zinc/59/82/94/1440598294.db2.gz	IKHQEACJYFPJCX-KUHUBIRLSA-N	0	3	344.886	3.222	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H](CNCc1cccc(Cl)c1F)C1CC1	ZINC001754439127	1440598804	/nfs/dbraw/zinc/59/88/04/1440598804.db2.gz	KWTSLIQFIHAXCD-INIZCTEOSA-N	0	3	336.838	3.123	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](NC(=O)C[C@@H]2C[C@H]2C2CC2)C2CC2)s1	ZINC001754446431	1440600065	/nfs/dbraw/zinc/60/00/65/1440600065.db2.gz	ILNRDRQKKHOOAI-JCGIZDLHSA-N	0	3	343.496	3.040	20	30		EGEDHN
CCC(CC)CC(=O)N[C@H](CNCC#Cc1ccccc1)C1CC1	ZINC001754455784	1440602201	/nfs/dbraw/zinc/60/22/01/1440602201.db2.gz	TXSKQUVAWFZQMD-HXUWFJFHSA-N	0	3	326.484	3.349	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NC[C@@H]1CCN1[C@@H](C)c1ccccc1C	ZINC001754501891	1440614616	/nfs/dbraw/zinc/61/46/16/1440614616.db2.gz	ZXOPCAQNQQTGBO-RXVVDRJESA-N	0	3	346.474	3.471	20	30		EGEDHN
C=CCCCN1CC[C@H]1CNC(=O)[C@]1(C)CCc2ccccc2C1	ZINC001754505031	1440616092	/nfs/dbraw/zinc/61/60/92/1440616092.db2.gz	PCIQBUGGMNFBGW-PZJWPPBQSA-N	0	3	326.484	3.338	20	30		EGEDHN
C#Cc1ccc(C(=O)NCC2(N[C@@H](C)c3ccc(F)cc3)CC2)cc1	ZINC001754521450	1440619835	/nfs/dbraw/zinc/61/98/35/1440619835.db2.gz	GUWSPZJVCQLTBP-HNNXBMFYSA-N	0	3	336.410	3.420	20	30		EGEDHN
N#Cc1cccc(CNC2(CNC(=O)c3ccc4cc[nH]c4c3)CC2)c1	ZINC001754526696	1440621210	/nfs/dbraw/zinc/62/12/10/1440621210.db2.gz	XQPJIMJWOMXZPF-UHFFFAOYSA-N	0	3	344.418	3.092	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC(N(C/C=C/Cl)CCOC)CC1	ZINC001754559002	1440633023	/nfs/dbraw/zinc/63/30/23/1440633023.db2.gz	JXQWHUHRKLWLPP-RUJXFNLJSA-N	0	3	342.911	3.281	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@H]1CNCC#Cc1cccc(Cl)c1	ZINC001754605958	1440643245	/nfs/dbraw/zinc/64/32/45/1440643245.db2.gz	XUZFDDWKPRJEDL-SFHVURJKSA-N	0	3	332.875	3.318	20	30		EGEDHN
C#CCN(C(=O)[C@@H]1CC[C@@H](C)C1)C1CCN(CCOCC(C)C)CC1	ZINC001754640966	1440649198	/nfs/dbraw/zinc/64/91/98/1440649198.db2.gz	KURHNNMDVKFACE-RTBURBONSA-N	0	3	348.531	3.021	20	30		EGEDHN
C#CCN(C(=O)C[C@H](C)c1ccco1)C1CCN(CC(=C)C)CC1	ZINC001754641801	1440649217	/nfs/dbraw/zinc/64/92/17/1440649217.db2.gz	AJLXLPCTDVSIGN-KRWDZBQOSA-N	0	3	328.456	3.276	20	30		EGEDHN
CC#CCNC[C@@H](NC(=O)C#CC1CC1)c1ccc2ccccc2c1	ZINC001754643683	1440649542	/nfs/dbraw/zinc/64/95/42/1440649542.db2.gz	FMDCVCWPMWVKFM-OAQYLSRUSA-N	0	3	330.431	3.023	20	30		EGEDHN
C=CCCCCCN1CC[C@@](C)(NC(=O)c2cc(OC)ns2)C1	ZINC001754673522	1440658843	/nfs/dbraw/zinc/65/88/43/1440658843.db2.gz	BPJXVGFDGHUEOD-QGZVFWFLSA-N	0	3	337.489	3.092	20	30		EGEDHN
CCCSCC(=O)N1CC[C@@](C)(CNCc2ccccc2C#N)C1	ZINC001754691168	1440666105	/nfs/dbraw/zinc/66/61/05/1440666105.db2.gz	ZVEAQAQSVNVTKR-IBGZPJMESA-N	0	3	345.512	3.030	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCC1(C)CCN(Cc2cccc(Cl)c2)CC1	ZINC001754715803	1440671398	/nfs/dbraw/zinc/67/13/98/1440671398.db2.gz	DTILIUNOYCRIJY-AWEZNQCLSA-N	0	3	333.863	3.218	20	30		EGEDHN
CC#CCN1CCC[C@@](C)(CNC(=O)[C@H](C)OC2CCCCCC2)C1	ZINC001754729931	1440678505	/nfs/dbraw/zinc/67/85/05/1440678505.db2.gz	ABIDDAZFEQZBLF-RXVVDRJESA-N	0	3	348.531	3.356	20	30		EGEDHN
CC#CCN1CCC[C@](C)(CNC(=O)c2ccc(C)c3c2CCC3)C1	ZINC001754735013	1440681754	/nfs/dbraw/zinc/68/17/54/1440681754.db2.gz	RMYBUMMYFANSCZ-JOCHJYFZSA-N	0	3	338.495	3.339	20	30		EGEDHN
CC#CCN1CCC[C@](C)(CNC(=O)Cc2cccc(C(F)F)c2)C1	ZINC001754735887	1440682441	/nfs/dbraw/zinc/68/24/41/1440682441.db2.gz	MVARQNDBMSZEDD-HXUWFJFHSA-N	0	3	348.437	3.408	20	30		EGEDHN
C=CCN[C@@H](CNC(=O)[C@@H](C)n1cccc1)c1ccccc1CC	ZINC001754786306	1440687957	/nfs/dbraw/zinc/68/79/57/1440687957.db2.gz	WUNGICVTRZBIDF-APWZRJJASA-N	0	3	325.456	3.245	20	30		EGEDHN
C#CCC1(C(=O)NC[C@H]2C[C@H]3CC[C@@H](C2)N3CCF)CCCCC1	ZINC001754833289	1440696170	/nfs/dbraw/zinc/69/61/70/1440696170.db2.gz	SDOWWURNLXMVGW-BCDXTJNWSA-N	0	3	334.479	3.289	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@]1(CO)CCCN(Cc2cccc(C)c2)C1	ZINC001754857297	1440700499	/nfs/dbraw/zinc/70/04/99/1440700499.db2.gz	DIFNYDWBZRWOCU-NQIIRXRSSA-N	0	3	344.499	3.040	20	30		EGEDHN
C=CCOCCCC(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1ccsc1	ZINC001754864729	1440702391	/nfs/dbraw/zinc/70/23/91/1440702391.db2.gz	YGMFJKMKOZGSDL-QZTJIDSGSA-N	0	3	348.512	3.296	20	30		EGEDHN
C#CCN[C@@H](C)c1ccc(CNC(=O)[C@@H]2CCCc3cccnc32)cc1	ZINC001754948823	1440714258	/nfs/dbraw/zinc/71/42/58/1440714258.db2.gz	PYDVUMORBPHINP-OXJNMPFZSA-N	0	3	347.462	3.102	20	30		EGEDHN
C#CCN[C@H](C)c1ccc(CNC(=O)c2cccc3cc[nH]c32)cc1	ZINC001754949203	1440714529	/nfs/dbraw/zinc/71/45/29/1440714529.db2.gz	XVIFZFSKJGJBOI-OAHLLOKOSA-N	0	3	331.419	3.382	20	30		EGEDHN
CC#CCN[C@H](C)c1ccc(CNC(=O)CCCc2ccccn2)cc1	ZINC001754949255	1440714621	/nfs/dbraw/zinc/71/46/21/1440714621.db2.gz	ZAHNBVWKYRFLJK-GOSISDBHSA-N	0	3	349.478	3.395	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC[C@H](CNCc2coc(C3CC3)n2)CC1	ZINC001754949906	1440714710	/nfs/dbraw/zinc/71/47/10/1440714710.db2.gz	UNKJKAOZRKKMCV-KOMQPUFPSA-N	0	3	331.460	3.283	20	30		EGEDHN
C#CCCN(C)Cc1ccccc1CNC(=O)C(C)(C)C(F)(F)F	ZINC001754955290	1440716225	/nfs/dbraw/zinc/71/62/25/1440716225.db2.gz	ZNSQBOPECYIBFW-UHFFFAOYSA-N	0	3	340.389	3.346	20	30		EGEDHN
C#CCCCCCC(=O)N1CC2(C1)CCN(Cc1ccccn1)CC2	ZINC001754960291	1440717407	/nfs/dbraw/zinc/71/74/07/1440717407.db2.gz	DRXHMWGOWZLCRQ-UHFFFAOYSA-N	0	3	339.483	3.090	20	30		EGEDHN
CC#CCCCC(=O)N[C@H]1CCCN(Cc2scnc2C)CC1	ZINC001755028546	1440730116	/nfs/dbraw/zinc/73/01/16/1440730116.db2.gz	NNRQVQRSJUYMNX-INIZCTEOSA-N	0	3	333.501	3.116	20	30		EGEDHN
CCC(=CC(=O)N1C[C@H](NCc2ccc(C#N)c(F)c2)[C@@H](C)C1)CC	ZINC001755108127	1440753929	/nfs/dbraw/zinc/75/39/29/1440753929.db2.gz	ZUUCSBHWXYSORA-LIRRHRJNSA-N	0	3	343.446	3.380	20	30		EGEDHN
CC(C)=C(C)CC(=O)N1C[C@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001755113592	1440754533	/nfs/dbraw/zinc/75/45/33/1440754533.db2.gz	JVJHMBAGKSESRN-HNAYVOBHSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](C)[C@@H](NCc3ncccc3C)C2)CCC1	ZINC001755117099	1440755165	/nfs/dbraw/zinc/75/51/65/1440755165.db2.gz	ZVJVVAQYCHIUQI-AEFFLSMTSA-N	0	3	327.472	3.073	20	30		EGEDHN
C#CCC1(C(=O)N[C@H]2CCN(CC#CC)CC2(C)C)CCCCC1	ZINC001755142668	1440761453	/nfs/dbraw/zinc/76/14/53/1440761453.db2.gz	CWUXRGFKNKLZHM-SFHVURJKSA-N	0	3	328.500	3.200	20	30		EGEDHN
COc1cccc(CN2CC[C@H](NC(=O)C#CC(C)(C)C)C[C@H]2C)c1	ZINC001755159465	1440764401	/nfs/dbraw/zinc/76/44/01/1440764401.db2.gz	HFPVJRNQUQLTNY-AEFFLSMTSA-N	0	3	342.483	3.214	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)CCOc2cccc(C)c2C)C[C@H]1C	ZINC001755162715	1440765531	/nfs/dbraw/zinc/76/55/31/1440765531.db2.gz	YMYNXPRGXLJQJS-IEBWSBKVSA-N	0	3	342.483	3.065	20	30		EGEDHN
C=CCC1(C(=O)N2CCC3(CC2)CN(CCC(C)C)CCO3)CCC1	ZINC001755174596	1440770439	/nfs/dbraw/zinc/77/04/39/1440770439.db2.gz	VKYFWIIKJNVAGD-UHFFFAOYSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2Cc3ccccc3[C@H]2NC[C@@H](C)OC)CC1	ZINC001755186887	1440773357	/nfs/dbraw/zinc/77/33/57/1440773357.db2.gz	KXLNQBVOBNQZDO-CDHQVMDDSA-N	0	3	342.483	3.140	20	30		EGEDHN
COc1cc(CN(C)C[C@@H]2CCCN2C(=O)C#CC(C)C)ccc1C	ZINC001755193138	1440775581	/nfs/dbraw/zinc/77/55/81/1440775581.db2.gz	SJFDDOMJRBIGIL-IBGZPJMESA-N	0	3	342.483	3.086	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCN1C(=O)c1ccccc1C(F)(F)F	ZINC001755200274	1440779273	/nfs/dbraw/zinc/77/92/73/1440779273.db2.gz	FJWLLIZQVBDRQN-CYBMUJFWSA-N	0	3	326.362	3.428	20	30		EGEDHN
C=CCCOCC(=O)N1CCC[C@@H]1CN(C)[C@@H](C)c1ccc(F)cc1	ZINC001755203461	1440781386	/nfs/dbraw/zinc/78/13/86/1440781386.db2.gz	WVOJASRFRPZECM-QFBILLFUSA-N	0	3	348.462	3.402	20	30		EGEDHN
C[C@@H](NC(=O)CCc1ccsc1)[C@H](C)NCc1ccc(C#N)s1	ZINC001755237574	1440788721	/nfs/dbraw/zinc/78/87/21/1440788721.db2.gz	NPEHHCXVWAOIBQ-QWHCGFSZSA-N	0	3	347.509	3.297	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)[C@H](C)NCc2cccc(OC)n2)CCCC1	ZINC001755267095	1440796597	/nfs/dbraw/zinc/79/65/97/1440796597.db2.gz	BLAUOSAMISWIAY-HOTGVXAUSA-N	0	3	345.487	3.210	20	30		EGEDHN
CC(C)[C@H](CCN(C)C(=O)[C@@H]1C[C@H]1C)NCc1cc(F)ccc1C#N	ZINC001755341386	1440825431	/nfs/dbraw/zinc/82/54/31/1440825431.db2.gz	GUJDOXSFTPVEGY-ZMYBRWDISA-N	0	3	345.462	3.316	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H](C)C1CN(CCc2scnc2C)C1	ZINC001755376762	1440838356	/nfs/dbraw/zinc/83/83/56/1440838356.db2.gz	JLDKZQXTYARAMH-CYBMUJFWSA-N	0	3	335.517	3.033	20	30		EGEDHN
C=C[C@H](C(=O)N[C@H](C)C1CN(CC2CC(F)(F)C2)C1)c1ccccc1	ZINC001755390996	1440842055	/nfs/dbraw/zinc/84/20/55/1440842055.db2.gz	DGUQIABCGQDUTL-KDOFPFPSSA-N	0	3	348.437	3.438	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CC[C@H](NC(=O)C3(C(F)F)CC3)C[C@@H]2C1	ZINC001755453043	1440854377	/nfs/dbraw/zinc/85/43/77/1440854377.db2.gz	MICGZVVFQQCHKV-XQQFMLRXSA-N	0	3	332.822	3.001	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC2(C1)CCCN(CCOCC(C)C)C2	ZINC001755456719	1440855925	/nfs/dbraw/zinc/85/59/25/1440855925.db2.gz	CQVQSFGDVFAHDS-UHFFFAOYSA-N	0	3	336.520	3.186	20	30		EGEDHN
CN(CC#Cc1ccccc1)C1CCN(C(=O)[C@@H]2CC[C@@H](F)C2)CC1	ZINC001755532584	1440867961	/nfs/dbraw/zinc/86/79/61/1440867961.db2.gz	SIILJLBUWIVURW-RTBURBONSA-N	0	3	342.458	3.099	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(N(C)Cc3cnoc3C)CC2)CCC1	ZINC001755533593	1440868432	/nfs/dbraw/zinc/86/84/32/1440868432.db2.gz	XSMVONHJWMEXEH-UHFFFAOYSA-N	0	3	331.460	3.152	20	30		EGEDHN
CN(C(=O)[C@@H]1CC1(C)C)[C@H](CNCC#Cc1ccc(F)cc1)C1CC1	ZINC001755558861	1440873945	/nfs/dbraw/zinc/87/39/45/1440873945.db2.gz	QNAYJEQNNYEFSY-RBUKOAKNSA-N	0	3	342.458	3.050	20	30		EGEDHN
C/C=C(/C)C(=O)N(C)[C@@H](CNCC#Cc1ccc(Cl)cc1)C1CC1	ZINC001755559030	1440874173	/nfs/dbraw/zinc/87/41/73/1440874173.db2.gz	UJQWVQCJWBPWLN-BXPWKZNBSA-N	0	3	344.886	3.484	20	30		EGEDHN
C=CC(C)(C)C(=O)N(C)[C@@H](CNCC#Cc1ccc(F)cc1)C1CC1	ZINC001755563638	1440875147	/nfs/dbraw/zinc/87/51/47/1440875147.db2.gz	CJYIPHPVXOIGHJ-IBGZPJMESA-N	0	3	342.458	3.216	20	30		EGEDHN
Cc1cc(C(=O)N(C)C[C@H](C)NCc2ccc(C#N)s2)ccc1F	ZINC001755603274	1440884644	/nfs/dbraw/zinc/88/46/44/1440884644.db2.gz	XYDYMLHGMMOTOX-ZDUSSCGKSA-N	0	3	345.443	3.318	20	30		EGEDHN
C#CCC1(C(=O)N(C)C[C@@H](C)NCc2cnc(C)s2)CCCCC1	ZINC001755619436	1440890052	/nfs/dbraw/zinc/89/00/52/1440890052.db2.gz	WLOUJQKORFSPDV-OAHLLOKOSA-N	0	3	347.528	3.362	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@H](CO)NCc1ccc2ccccc2c1	ZINC001755637552	1440890769	/nfs/dbraw/zinc/89/07/69/1440890769.db2.gz	BOVAHSBVNJHGME-TZIWHRDSSA-N	0	3	340.467	3.009	20	30		EGEDHN
CCC(CC)CC(=O)N1CC[C@@H](NCC#Cc2ccccc2)[C@H]1C	ZINC001755662710	1440893022	/nfs/dbraw/zinc/89/30/22/1440893022.db2.gz	BLQWBVPUYZJXGO-YLJYHZDGSA-N	0	3	326.484	3.443	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H](NCc2ccc(C#N)s2)C[C@@H]1C	ZINC001755675588	1440894399	/nfs/dbraw/zinc/89/43/99/1440894399.db2.gz	KRGBAPPWQAHPNZ-HOCLYGCPSA-N	0	3	343.496	3.467	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CCCN(CCOc2ccc(OC)cc2)[C@@H]1C	ZINC001755713786	1440904456	/nfs/dbraw/zinc/90/44/56/1440904456.db2.gz	DCTNCXOSFPLNOA-VQIMIIECSA-N	0	3	346.471	3.009	20	30		EGEDHN
CCCCC(=O)N1C[C@H](NCc2ccc(C#N)c(F)c2)C(C)(C)C1	ZINC001755750895	1440913298	/nfs/dbraw/zinc/91/32/98/1440913298.db2.gz	CUUPUKNCBGHWOL-KRWDZBQOSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@H](NCc2ccc(F)c(C#N)c2)C(C)(C)C1	ZINC001755756204	1440914128	/nfs/dbraw/zinc/91/41/28/1440914128.db2.gz	AMKMPSJRCBEFHO-SFHVURJKSA-N	0	3	343.446	3.380	20	30		EGEDHN
C#CCCN(C)CCN(C(=O)c1ccnc(-c2ccco2)c1)C(C)C	ZINC001755812560	1440921189	/nfs/dbraw/zinc/92/11/89/1440921189.db2.gz	AINQYQXODMSVMY-UHFFFAOYSA-N	0	3	339.439	3.147	20	30		EGEDHN
CC(C)(C)[C@@H](CNCC#Cc1ccccc1)NC(=O)C1(CCF)CC1	ZINC001755828655	1440928049	/nfs/dbraw/zinc/92/80/49/1440928049.db2.gz	MTQPYNJLQISSQR-GOSISDBHSA-N	0	3	344.474	3.298	20	30		EGEDHN
C#CCN1CCC([C@H](C)NC(=O)CC(C)(C)c2ccc(F)cc2)CC1	ZINC001755848958	1440934409	/nfs/dbraw/zinc/93/44/09/1440934409.db2.gz	SDZHMUWDPWVWSA-INIZCTEOSA-N	0	3	344.474	3.343	20	30		EGEDHN
C=C(Br)CNC1CC(N(C)C(=O)C(C)(C)CCC)C1	ZINC001755860985	1440936761	/nfs/dbraw/zinc/93/67/61/1440936761.db2.gz	CNJARYQLQCOYAF-UHFFFAOYSA-N	0	3	331.298	3.300	20	30		EGEDHN
CN1CCN(CC2(C)CCN(c3c(Cl)cccc3C#N)CC2)CC1	ZINC000368203457	168324536	/nfs/dbraw/zinc/32/45/36/168324536.db2.gz	UUWSBILYLWOJDQ-UHFFFAOYSA-N	0	3	346.906	3.066	20	30		EGEDHN
Cc1nccn1CCCN(C)Cc1cc(C#N)ccc1Br	ZINC000191814997	239315355	/nfs/dbraw/zinc/31/53/55/239315355.db2.gz	KWJBLHZGUMAFMM-UHFFFAOYSA-N	0	3	347.260	3.348	20	30		EGEDHN
C[C@@H](N[C@H](CN1CCOCC1)c1ccccc1)c1ccc(C#N)cc1	ZINC000181421323	296159297	/nfs/dbraw/zinc/15/92/97/296159297.db2.gz	KVNRIJWPCOMZLG-DYESRHJHSA-N	0	3	335.451	3.282	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N(CC)C[C@@H]1CCN(Cc2ccccc2)C1	ZINC000266527812	248346388	/nfs/dbraw/zinc/34/63/88/248346388.db2.gz	JSPVQQFPUMBYFQ-AZUAARDMSA-N	0	3	344.499	3.338	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC[C@H]2c2ccc(Cl)cc2)CC1	ZINC000266563315	248362208	/nfs/dbraw/zinc/36/22/08/248362208.db2.gz	URQQWDIDYYNPKF-KRWDZBQOSA-N	0	3	333.863	3.447	20	30		EGEDHN
Cc1csc(CNC2CCC(Oc3ccc(C#N)cn3)CC2)n1	ZINC000092854185	218177018	/nfs/dbraw/zinc/17/70/18/218177018.db2.gz	FNEMCMAACBDLJO-UHFFFAOYSA-N	0	3	328.441	3.198	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)c1cc(C#N)cs1	ZINC000267709144	251274573	/nfs/dbraw/zinc/27/45/73/251274573.db2.gz	HUQLERQWVVAIMX-WMLDXEAASA-N	0	3	339.464	3.260	20	30		EGEDHN
COC(=O)[C@@](C)(CN[C@H](C)c1ccc(C#N)cc1)c1ccc(F)cc1	ZINC000447030134	269707408	/nfs/dbraw/zinc/70/74/08/269707408.db2.gz	TZAOJIBUISTFSL-VLIAUNLRSA-N	0	3	340.398	3.479	20	30		EGEDHN
COC1CCN(CCNc2ccc(C#N)cc2C(F)(F)F)CC1	ZINC000301564805	269722820	/nfs/dbraw/zinc/72/28/20/269722820.db2.gz	WAXUZLFACHOAMJ-UHFFFAOYSA-N	0	3	327.350	3.100	20	30		EGEDHN
C[C@@H](NCc1cccc(CN2CCOCC2)c1)c1ccc(C#N)cc1	ZINC000181530467	533453484	/nfs/dbraw/zinc/45/34/84/533453484.db2.gz	JGOJDJBTGCUCHN-QGZVFWFLSA-N	0	3	335.451	3.241	20	30		EGEDHN
COc1ccc(CNC[C@H](c2ccco2)N2CCCCC2)cc1C#N	ZINC000174240412	533670962	/nfs/dbraw/zinc/67/09/62/533670962.db2.gz	XUEOELKTBLSRGR-GOSISDBHSA-N	0	3	339.439	3.477	20	30		EGEDHN
COc1ccc(CNC[C@@H](c2ccc(C)o2)N2CCCC2)cc1C#N	ZINC000174332102	533664881	/nfs/dbraw/zinc/66/48/81/533664881.db2.gz	NRHRNQNGQGICNC-SFHVURJKSA-N	0	3	339.439	3.395	20	30		EGEDHN
C[C@H](c1ccc(C#N)cc1)N1CCC[C@@H](CNC(=O)c2ccco2)C1	ZINC000338375415	141111498	/nfs/dbraw/zinc/11/14/98/141111498.db2.gz	FONINRKNPSUGRO-WBVHZDCISA-N	0	3	337.423	3.354	20	30		EGEDHN
Cn1cc(CNC[C@H]2Cc3ccccc3O2)c(-c2ccc(C#N)cc2)n1	ZINC000350627377	141257027	/nfs/dbraw/zinc/25/70/27/141257027.db2.gz	RCVQTJBBKXJLFM-LJQANCHMSA-N	0	3	344.418	3.052	20	30		EGEDHN
CCOc1c(CNCCc2cccc(C#N)c2)c(C)nn1CC(C)C	ZINC000341489042	155320388	/nfs/dbraw/zinc/32/03/88/155320388.db2.gz	QHTCVGZDBGYOJL-UHFFFAOYSA-N	0	3	340.471	3.450	20	30		EGEDHN
Cn1cc(CN[C@H]2CCN(C)[C@@H]2c2ccc(Cl)c(F)c2)cc1C#N	ZINC000191484755	153199538	/nfs/dbraw/zinc/19/95/38/153199538.db2.gz	KMZMHCLXSFZJQK-ZWKOTPCHSA-N	0	3	346.837	3.224	20	30		EGEDHN
CS[C@H]1CN(c2cc(C#N)ccc2C(F)(F)F)C[C@H]1N(C)C	ZINC000345351304	156065575	/nfs/dbraw/zinc/06/55/75/156065575.db2.gz	ROLFHAHJGOIHRY-KGLIPLIRSA-N	0	3	329.391	3.059	20	30		EGEDHN
CSc1ccc([C@H](CNc2nccc(C#N)c2Cl)N(C)C)cc1	ZINC000338835928	163360513	/nfs/dbraw/zinc/36/05/13/163360513.db2.gz	WNKZZOCTCZWZAK-HNNXBMFYSA-N	0	3	346.887	3.465	20	30		EGEDHN
CO[C@]1(C)C[C@@H](N[C@H](C)C(=O)Nc2ccc(C#N)c(Cl)c2)C1(C)C	ZINC000340821068	163672739	/nfs/dbraw/zinc/67/27/39/163672739.db2.gz	LQKFBXKGRNNGPF-PZDGAKPMSA-N	0	3	349.862	3.332	20	30		EGEDHN
CCc1nnc(N(C)CCCN(C)Cc2ccco2)c(C#N)c1CC	ZINC000343857163	164052064	/nfs/dbraw/zinc/05/20/64/164052064.db2.gz	MJMVNZYIHFQKQY-UHFFFAOYSA-N	0	3	341.459	3.024	20	30		EGEDHN
CCN(CC(=O)Nc1sc(C)c(C)c1C#N)[C@H]1CCOC(C)(C)C1	ZINC000351939604	165158923	/nfs/dbraw/zinc/15/89/23/165158923.db2.gz	VPDILRJXEZHTHT-AWEZNQCLSA-N	0	3	349.500	3.455	20	30		EGEDHN
C[C@H](CN1CCC[C@@H](C)C1)NC(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000352283031	165325069	/nfs/dbraw/zinc/32/50/69/165325069.db2.gz	ZPGMAIHBCXUBKE-CHWSQXEVSA-N	0	3	334.851	3.454	20	30		EGEDHN
C[C@@H](NCc1ccc(C[S@@](C)=O)cc1)c1ccc(C#N)c(F)c1	ZINC000353813672	165895971	/nfs/dbraw/zinc/89/59/71/165895971.db2.gz	YXIUSDSGXAAHFE-JCQPUDPBSA-N	0	3	330.428	3.427	20	30		EGEDHN
COc1ccc(CN2CCC[C@]2(CO)Cc2ccccc2)cc1C#N	ZINC000355349679	166171649	/nfs/dbraw/zinc/17/16/49/166171649.db2.gz	IYNRIZISIBXUGL-OAQYLSRUSA-N	0	3	336.435	3.136	20	30		EGEDHN
N#Cc1cccc(CNC(=O)CN[C@H](c2ccccc2)C2CCC2)c1	ZINC000355396665	166184258	/nfs/dbraw/zinc/18/42/58/166184258.db2.gz	WUBXUJOQUFBKKA-OAQYLSRUSA-N	0	3	333.435	3.305	20	30		EGEDHN
COc1ccc(C#N)cc1CN1CCC[C@]1(CO)Cc1ccccc1	ZINC000355778725	166306564	/nfs/dbraw/zinc/30/65/64/166306564.db2.gz	YKIDHSJWPGUNRW-OAQYLSRUSA-N	0	3	336.435	3.136	20	30		EGEDHN
C[C@H](C(=O)N[C@H]1CCN(C)[C@H]1c1ccccc1)c1cccc(C#N)c1	ZINC000360393831	167318964	/nfs/dbraw/zinc/31/89/64/167318964.db2.gz	LEAGCQFXCRLMBT-YSSFQJQWSA-N	0	3	333.435	3.223	20	30		EGEDHN
Cc1cc(C#N)cc(NC[C@H]2CCCN(Cc3cccs3)C2)n1	ZINC000367662078	168256893	/nfs/dbraw/zinc/25/68/93/168256893.db2.gz	AVUBDUUGQZAPPE-OAHLLOKOSA-N	0	3	326.469	3.069	20	30		EGEDHN
C[C@H](N[C@@H]1CCCN(c2ccc(C#N)cc2F)C1)c1cncs1	ZINC000160150253	225347537	/nfs/dbraw/zinc/34/75/37/225347537.db2.gz	WIYLRHYATNKFAS-GXTWGEPZSA-N	0	3	330.432	3.473	20	30		EGEDHN
N#Cc1cc(NC2CCN(C3CC3)CC2)nc2ccc([N+](=O)[O-])cc12	ZINC000301364856	269954611	/nfs/dbraw/zinc/95/46/11/269954611.db2.gz	RTUYDOVAMGDQRG-UHFFFAOYSA-N	0	3	337.383	3.053	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN2CCC[C@H]2/C=C\c2ccccc2)cc1	ZINC000505899773	269966804	/nfs/dbraw/zinc/96/68/04/269966804.db2.gz	AJULLHVYMLBXQT-RCPLKNEXSA-N	0	3	348.446	3.476	20	30		EGEDHN
COc1cc(C#N)ccc1CN1CCC(CO)(c2ccccc2)CC1	ZINC000293322388	270042103	/nfs/dbraw/zinc/04/21/03/270042103.db2.gz	MBCIADIQXMUGTJ-UHFFFAOYSA-N	0	3	336.435	3.093	20	30		EGEDHN
CSc1ccc([C@@H](CNCc2cc(C#N)n(C)c2)N(C)C)cc1	ZINC000293399642	270042284	/nfs/dbraw/zinc/04/22/84/270042284.db2.gz	LMLWEKVYHPUCNS-GOSISDBHSA-N	0	3	328.485	3.011	20	30		EGEDHN
COc1ccc(CN2CCC(CO)(c3ccccc3)CC2)cc1C#N	ZINC000293161905	270042328	/nfs/dbraw/zinc/04/23/28/270042328.db2.gz	CKUYLBKUXMUPTN-UHFFFAOYSA-N	0	3	336.435	3.093	20	30		EGEDHN
CSCC1CCC(NC(=O)C(C#N)Cc2ccc(C#N)cc2)CC1	ZINC000295464515	270042620	/nfs/dbraw/zinc/04/26/20/270042620.db2.gz	MCXOGGSYXBMAMG-LXPRWKDFSA-N	0	3	341.480	3.279	20	30		EGEDHN
CCc1nc(C)c(CN2CCCN(Cc3ccc(C#N)cc3)CC2)o1	ZINC000428469439	270050352	/nfs/dbraw/zinc/05/03/52/270050352.db2.gz	UPMZJTYWGXPGJH-UHFFFAOYSA-N	0	3	338.455	3.125	20	30		EGEDHN
N#Cc1ccc(OCCN(CCc2ccccc2)[C@H]2CCOC2)cc1	ZINC000437529924	270051486	/nfs/dbraw/zinc/05/14/86/270051486.db2.gz	VQRAEEZQADMWNG-FQEVSTJZSA-N	0	3	336.435	3.271	20	30		EGEDHN
CCN1CCN(Cc2cccc(OCc3cccc(C#N)c3)c2)CC1	ZINC000505331631	270058838	/nfs/dbraw/zinc/05/88/38/270058838.db2.gz	ROODLLSKRMXVLN-UHFFFAOYSA-N	0	3	335.451	3.275	20	30		EGEDHN
CC[C@@H](C)[C@H](CNCc1cn(C)nc1-c1ccc(C#N)cc1)OC	ZINC000294915652	266367145	/nfs/dbraw/zinc/36/71/45/266367145.db2.gz	YHYWDEBZADFEOG-KDOFPFPSSA-N	0	3	326.444	3.109	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@H](N[C@H]1CCc2ccc(C#N)cc21)C1CC1	ZINC000496604207	266863272	/nfs/dbraw/zinc/86/32/72/266863272.db2.gz	LSTNFFCTARYKGF-ZWKOTPCHSA-N	0	3	341.455	3.438	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)C1=CCN(C)CC1	ZINC000272858391	266930576	/nfs/dbraw/zinc/93/05/76/266930576.db2.gz	HZOLPQBSVNTUNC-MRXNPFEDSA-N	0	3	340.471	3.129	20	30		EGEDHN
CCCCN1CCCC[C@H]1CNC(=O)CSc1ccc(C#N)cc1	ZINC000486091472	267006644	/nfs/dbraw/zinc/00/66/44/267006644.db2.gz	BKMDTBQVTUBYHP-KRWDZBQOSA-N	0	3	345.512	3.421	20	30		EGEDHN
CCCN(CCc1cccs1)CC(=O)NCc1ccc(C#N)cc1	ZINC000464587313	267012872	/nfs/dbraw/zinc/01/28/72/267012872.db2.gz	NJFHMITWPUCJPL-UHFFFAOYSA-N	0	3	341.480	3.191	20	30		EGEDHN
Cc1ccnc(N(C)CCC2CCN(c3ccncc3)CC2)c1C#N	ZINC000273289466	267013820	/nfs/dbraw/zinc/01/38/20/267013820.db2.gz	FIBNFDBBMHPHFS-UHFFFAOYSA-N	0	3	335.455	3.400	20	30		EGEDHN
C[C@@H]1CC[C@@H](CC(=O)N(CCN(C)C)Cc2cccc(C#N)c2)C1	ZINC000177689016	267026078	/nfs/dbraw/zinc/02/60/78/267026078.db2.gz	SFLLSMIIKRSRMV-IAGOWNOFSA-N	0	3	327.472	3.275	20	30		EGEDHN
CCN(CC)CCSc1cc(C#N)c2cc([N+](=O)[O-])ccc2n1	ZINC000443430555	267058882	/nfs/dbraw/zinc/05/88/82/267058882.db2.gz	UJGQLODZDWDGLF-UHFFFAOYSA-N	0	3	330.413	3.449	20	30		EGEDHN
C[C@@H]1CN(c2ccccc2CN(C)Cc2ccc(C#N)cc2)CCO1	ZINC000297763349	267063196	/nfs/dbraw/zinc/06/31/96/267063196.db2.gz	LSWGKFLMZYAGSK-QGZVFWFLSA-N	0	3	335.451	3.415	20	30		EGEDHN
CCN(Cc1ccc(Cl)cc1)C[C@H](O)COc1ccc(C#N)cc1	ZINC000519907855	267070124	/nfs/dbraw/zinc/07/01/24/267070124.db2.gz	KKCQONVPLOOKPX-SFHVURJKSA-N	0	3	344.842	3.473	20	30		EGEDHN
C[C@@]1(NCc2ccc(C#N)cc2Br)CCO[C@H]1C1CC1	ZINC000273097790	267117661	/nfs/dbraw/zinc/11/76/61/267117661.db2.gz	UXXRPFIPVLUTDV-JKSUJKDBSA-N	0	3	335.245	3.368	20	30		EGEDHN
C[C@H](NC(=O)NCc1ccc(C#N)cc1)[C@@H](c1ccccc1)N(C)C	ZINC000287294054	267174325	/nfs/dbraw/zinc/17/43/25/267174325.db2.gz	ZUJOHVPZDGSWLZ-KXBFYZLASA-N	0	3	336.439	3.049	20	30		EGEDHN
CC[C@@H](NCCNC(=O)c1ccc(C)c(F)c1)c1ccc(C#N)cc1	ZINC000447528722	267193477	/nfs/dbraw/zinc/19/34/77/267193477.db2.gz	JXLWIDKGBXSJAK-LJQANCHMSA-N	0	3	339.414	3.477	20	30		EGEDHN
CC[C@@H](N[C@@H]1CCN(c2ccc(C#N)cc2)C1=O)c1cccs1	ZINC000411512381	267196697	/nfs/dbraw/zinc/19/66/97/267196697.db2.gz	LOTQORNLXZUJSR-HZPDHXFCSA-N	0	3	325.437	3.466	20	30		EGEDHN
C[C@H]1CCN(CCC(=O)Nc2sc3c(c2C#N)CCC3)CCS1	ZINC000298529915	267216976	/nfs/dbraw/zinc/21/69/76/267216976.db2.gz	MCMAYOWXAIYOKQ-LBPRGKRZSA-N	0	3	349.525	3.264	20	30		EGEDHN
CC[C@H]1CCCN(C(C)(C)CNC(=O)c2ncc(C#N)cc2Cl)C1	ZINC000428048606	267227104	/nfs/dbraw/zinc/22/71/04/267227104.db2.gz	NLQLHHQNEKALDF-ZDUSSCGKSA-N	0	3	348.878	3.237	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@@H]1Nc1ccc([N+](=O)[O-])cc1C#N	ZINC000302183788	267234072	/nfs/dbraw/zinc/23/40/72/267234072.db2.gz	SDESLMVUSSKKPI-LIRRHRJNSA-N	0	3	336.395	3.399	20	30		EGEDHN
C[C@H]1CN(Cc2cn(C)nc2-c2ccc(C#N)cc2)CCC1(F)F	ZINC000289836479	267234369	/nfs/dbraw/zinc/23/43/69/267234369.db2.gz	OXHLQLYMIAJABV-ZDUSSCGKSA-N	0	3	330.382	3.436	20	30		EGEDHN
CN(C)[C@@H](CC(=O)NCc1ccc(C#N)c(F)c1)c1ccccc1	ZINC000416242579	267286830	/nfs/dbraw/zinc/28/68/30/267286830.db2.gz	GJOVJDZVONYMKA-SFHVURJKSA-N	0	3	325.387	3.007	20	30		EGEDHN
COC(=O)[C@](C)(CN[C@@H](C)c1ccc(C#N)cc1)c1ccc(F)cc1	ZINC000447030133	267393744	/nfs/dbraw/zinc/39/37/44/267393744.db2.gz	TZAOJIBUISTFSL-VBKZILBWSA-N	0	3	340.398	3.479	20	30		EGEDHN
CO[C@H]1C[C@@H](NCc2cc(C#N)ccc2Br)C12CCC2	ZINC000459768660	267548221	/nfs/dbraw/zinc/54/82/21/267548221.db2.gz	QNLKIOKIIAUUKX-CABCVRRESA-N	0	3	335.245	3.368	20	30		EGEDHN
C[C@@H](CN1CCCCC1)NC(=O)N[C@H]1CCCc2cc(C#N)ccc21	ZINC000416684972	267692615	/nfs/dbraw/zinc/69/26/15/267692615.db2.gz	MCIGDBUDRFZGSR-KXBFYZLASA-N	0	3	340.471	3.109	20	30		EGEDHN
Cc1[nH]c(C#N)cc1C(=O)N(CCN1CCCCCC1)C1CCC1	ZINC000452018976	267917799	/nfs/dbraw/zinc/91/77/99/267917799.db2.gz	DNHQORSFSIPQGX-UHFFFAOYSA-N	0	3	328.460	3.066	20	30		EGEDHN
N#Cc1ccc(CN2CCC(Nc3ccc4c(c3)OCCO4)CC2)cc1	ZINC000182839465	268065348	/nfs/dbraw/zinc/06/53/48/268065348.db2.gz	JNAKYKVVXJMIDM-UHFFFAOYSA-N	0	3	349.434	3.406	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)c(Br)c1	ZINC000295878186	268076293	/nfs/dbraw/zinc/07/62/93/268076293.db2.gz	FZMPFUMLQHKHHL-BMFZPTHFSA-N	0	3	347.256	3.368	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@H]2CCCc3sccc32)cc1	ZINC000280175234	268086961	/nfs/dbraw/zinc/08/69/61/268086961.db2.gz	XVXOITQAPHGZBZ-RDJZCZTQSA-N	0	3	335.432	3.496	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CC[C@H](Cc3ccccc3)C2)cc1	ZINC000280516201	268089811	/nfs/dbraw/zinc/08/98/11/268089811.db2.gz	RPRQFOMJWFGDRZ-NHCUHLMSSA-N	0	3	343.430	3.332	20	30		EGEDHN
Cc1nsc(N2CCN(Cc3ccccc3)C[C@@H](C)C2)c1C#N	ZINC000450809173	268102653	/nfs/dbraw/zinc/10/26/53/268102653.db2.gz	JVXMNRKKOYCKKM-CQSZACIVSA-N	0	3	326.469	3.282	20	30		EGEDHN
N#Cc1ccc(OC2CCN(C[C@@H](O)c3ccccc3)CC2)c(F)c1	ZINC000285579668	268166854	/nfs/dbraw/zinc/16/68/54/268166854.db2.gz	VATWKNWHEYBROF-LJQANCHMSA-N	0	3	340.398	3.274	20	30		EGEDHN
N#Cc1ccc(OC2CCN(CCc3cccnc3)CC2)c(F)c1	ZINC000285651194	268167029	/nfs/dbraw/zinc/16/70/29/268167029.db2.gz	ZYNBEWDPISMBDE-UHFFFAOYSA-N	0	3	325.387	3.178	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)/C=C\c2ccccc2)c(F)c1	ZINC000493718533	268232406	/nfs/dbraw/zinc/23/24/06/268232406.db2.gz	GHHOIIPTVRMIDP-NTMALXAHSA-N	0	3	337.398	3.007	20	30		EGEDHN
N#Cc1ccc(CNCCOc2ncccc2C(F)(F)F)cc1F	ZINC000421346266	268232508	/nfs/dbraw/zinc/23/25/08/268232508.db2.gz	YVOACKLDFVIKNF-UHFFFAOYSA-N	0	3	339.292	3.280	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CN1CCC[C@H]1c1ccsc1	ZINC000528350218	268296131	/nfs/dbraw/zinc/29/61/31/268296131.db2.gz	LSKKFLOWSKMREV-IRXDYDNUSA-N	0	3	328.437	3.197	20	30		EGEDHN
N#Cc1cnc(N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)c(Cl)c1	ZINC000425270620	268312950	/nfs/dbraw/zinc/31/29/50/268312950.db2.gz	ANTONCCNERKNST-FUHWJXTLSA-N	0	3	338.842	3.317	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)[C@H]2CCCc3nc(C)sc32)CC1	ZINC000171907779	275427298	/nfs/dbraw/zinc/42/72/98/275427298.db2.gz	PLYOLFOWTYKZGP-INIZCTEOSA-N	0	3	348.516	3.121	20	30		EGEDHN
COc1ccccc1[C@@H](CN[C@H]1CCc2ccc(C#N)cc21)N(C)C	ZINC000353381320	277471160	/nfs/dbraw/zinc/47/11/60/277471160.db2.gz	FDDXOGBWFWUKLF-VQTJNVASSA-N	0	3	335.451	3.447	20	30		EGEDHN
C[C@@H](CNC(=O)CSc1ccc(C#N)cc1)N1CCCC[C@H]1C	ZINC000343206215	278270001	/nfs/dbraw/zinc/27/00/01/278270001.db2.gz	MLSFSLSBFFQIAN-CABCVRRESA-N	0	3	331.485	3.029	20	30		EGEDHN
COc1cc(OC)cc(OCCN[C@@H](C)c2ccc(C#N)cc2)c1	ZINC000130935089	307636356	/nfs/dbraw/zinc/63/63/56/307636356.db2.gz	FXJRWYGSPJBJOO-AWEZNQCLSA-N	0	3	326.396	3.305	20	30		EGEDHN
CSCC[C@@H](C)N(C)[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000248708275	308009595	/nfs/dbraw/zinc/00/95/95/308009595.db2.gz	BJJGGWUDWUGOJF-PBHICJAKSA-N	0	3	331.485	3.127	20	30		EGEDHN
C[C@@H](CCc1ccccc1)CN1CCN(c2ccc(C#N)cn2)CC1	ZINC000539409409	314312077	/nfs/dbraw/zinc/31/20/77/314312077.db2.gz	WMIVYXQYRRPAEP-SFHVURJKSA-N	0	3	334.467	3.344	20	30		EGEDHN
CN(C)C[C@H](CNC(=O)c1sccc1C#N)c1ccc(Cl)cc1	ZINC000552027714	315189927	/nfs/dbraw/zinc/18/99/27/315189927.db2.gz	XIKPTIBAIHRGOW-AWEZNQCLSA-N	0	3	347.871	3.348	20	30		EGEDHN
CC1CCN([C@H](CNc2cncc(C#N)n2)c2cccs2)CC1	ZINC000562926694	315922329	/nfs/dbraw/zinc/92/23/29/315922329.db2.gz	ZWYVCASJDXZBAF-OAHLLOKOSA-N	0	3	327.457	3.295	20	30		EGEDHN
Cc1cc(CNC[C@H](O)COc2ccc(C#N)cc2)ccc1Cl	ZINC000564792356	316206778	/nfs/dbraw/zinc/20/67/78/316206778.db2.gz	JEJPUUICMJRLPO-INIZCTEOSA-N	0	3	330.815	3.050	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CN[C@@H]2C[C@H]2c2cccc(Cl)c2)cc1	ZINC000564863434	316221061	/nfs/dbraw/zinc/22/10/61/316221061.db2.gz	GYPHMCWQCWQKGW-YTQUADARSA-N	0	3	342.826	3.097	20	30		EGEDHN
CN(Cc1cnc2c(C#N)cnn2c1)[C@H]1CCC[C@H]1c1ccccc1	ZINC000565775159	316368460	/nfs/dbraw/zinc/36/84/60/316368460.db2.gz	IJYSKCPZCOBBNJ-OALUTQOASA-N	0	3	331.423	3.369	20	30		EGEDHN
N#Cc1cnn2cc(CNCC3(c4cccc(Cl)c4)CC3)cnc12	ZINC000565951009	316393242	/nfs/dbraw/zinc/39/32/42/316393242.db2.gz	KOGYBPQOLMPYGM-UHFFFAOYSA-N	0	3	337.814	3.076	20	30		EGEDHN
C[C@H](Nc1ccc(C(F)(F)F)c(C#N)n1)[C@@H](c1ccccc1)N(C)C	ZINC000569233763	316885772	/nfs/dbraw/zinc/88/57/72/316885772.db2.gz	AVYBGKHFWBYUMJ-SJCJKPOMSA-N	0	3	348.372	3.497	20	30		EGEDHN
CC1(c2ccccc2)CCN(Cc2cnc3c(C#N)cnn3c2)CC1	ZINC000572405452	317333998	/nfs/dbraw/zinc/33/39/98/317333998.db2.gz	KGMCXEVCFVQMFZ-UHFFFAOYSA-N	0	3	331.423	3.155	20	30		EGEDHN
COc1cc([C@H](C)NCCCCC#N)ccc1S(=O)(=O)C(F)F	ZINC000178646207	454965921	/nfs/dbraw/zinc/96/59/21/454965921.db2.gz	LTAJUZKEVXHHHZ-NSHDSACASA-N	0	3	346.399	3.036	20	30		EGEDHN
N#Cc1cccc(CNC[C@@H](O)Cc2ccc(C(F)(F)F)cc2)c1	ZINC000572992466	317422761	/nfs/dbraw/zinc/42/27/61/317422761.db2.gz	MZRHQOHMSLBJHT-KRWDZBQOSA-N	0	3	334.341	3.270	20	30		EGEDHN
C[C@@H](N[C@H]1CCCN(C)c2ccccc21)C(=O)Nc1cccc(C#N)c1	ZINC000573177313	317446586	/nfs/dbraw/zinc/44/65/86/317446586.db2.gz	QQHUTRYDUGQWCZ-BEFAXECRSA-N	0	3	348.450	3.446	20	30		EGEDHN
N#Cc1ccc(CNCCc2ccn(-c3ccc(F)cc3)n2)s1	ZINC000176978343	323335421	/nfs/dbraw/zinc/33/54/21/323335421.db2.gz	YXQUZYJHBARJGZ-UHFFFAOYSA-N	0	3	326.400	3.277	20	30		EGEDHN
C[C@H](NCCOc1cccc(C#N)c1)c1cccc(N2CCCC2=O)c1	ZINC000181446352	323483620	/nfs/dbraw/zinc/48/36/20/323483620.db2.gz	RBYINVWCRSGNNO-INIZCTEOSA-N	0	3	349.434	3.415	20	30		EGEDHN
C[C@@H](CNCc1cc(C#N)n(C)c1)Oc1ccc(Br)cc1	ZINC000276961198	456632365	/nfs/dbraw/zinc/63/23/65/456632365.db2.gz	MGDIXANNYJORAR-LBPRGKRZSA-N	0	3	348.244	3.216	20	30		EGEDHN
CCO[C@H]1C[C@@H](N(C)Cc2cnc3c(C#N)cnn3c2)C1(CC)CC	ZINC000580952099	325313294	/nfs/dbraw/zinc/31/32/94/325313294.db2.gz	HKFIJXVMFUGYSE-SJORKVTESA-N	0	3	341.459	3.017	20	30		EGEDHN
C[C@@H](NCCC(=O)N(C)CCC#N)c1ccccc1C(F)(F)F	ZINC000341990629	457045204	/nfs/dbraw/zinc/04/52/04/457045204.db2.gz	DITPTMDOAAHVEJ-GFCCVEGCSA-N	0	3	327.350	3.118	20	30		EGEDHN
N#C[C@H](c1ccc(Br)cc1)N1CCN(CC2CCC2)CC1	ZINC000354875830	457326866	/nfs/dbraw/zinc/32/68/66/457326866.db2.gz	LCBQCOYEFXDPOE-QGZVFWFLSA-N	0	3	348.288	3.431	20	30		EGEDHN
CC(C)C(=O)NCCN(C)Cc1ccc(-c2ccccc2C#N)cc1	ZINC000157702993	455223142	/nfs/dbraw/zinc/22/31/42/455223142.db2.gz	WBDAJJAZDUDWOY-UHFFFAOYSA-N	0	3	335.451	3.429	20	30		EGEDHN
C=CCN1CCC(NC(=O)CCc2ccc(OC)c(Cl)c2)CC1	ZINC000264492664	455223454	/nfs/dbraw/zinc/22/34/54/455223454.db2.gz	OJSVKTRVVGVVLL-UHFFFAOYSA-N	0	3	336.863	3.048	20	30		EGEDHN
N#CCCCOc1cccc(CN[C@H]2CCN(CC(F)(F)F)C2)c1	ZINC000237852337	455226065	/nfs/dbraw/zinc/22/60/65/455226065.db2.gz	PRQLIIFAOLYKMP-HNNXBMFYSA-N	0	3	341.377	3.095	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Nc1ccc(C#N)cc1	ZINC000157767678	455229964	/nfs/dbraw/zinc/22/99/64/455229964.db2.gz	USQKUBGCJKMQDS-BEFAXECRSA-N	0	3	334.423	3.200	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1cc(F)ccc1SCC(F)F	ZINC000424120368	458563353	/nfs/dbraw/zinc/56/33/53/458563353.db2.gz	GWFATXYPVGRXSH-SNVBAGLBSA-N	0	3	331.363	3.143	20	30		EGEDHN
N#CCOc1ccc(CN2CCN(CCc3cccs3)CC2)cc1	ZINC000264591984	455243843	/nfs/dbraw/zinc/24/38/43/455243843.db2.gz	ZBCHHQIBPNLGDL-UHFFFAOYSA-N	0	3	341.480	3.011	20	30		EGEDHN
C[C@@H]1CCC[C@@](C#N)(NC(=O)c2ccc(CN3CCCC3)cc2)C1	ZINC000265383323	455316776	/nfs/dbraw/zinc/31/67/76/455316776.db2.gz	QXUHCVUWQDVVLG-OXQOHEQNSA-N	0	3	325.456	3.485	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@H](CO)C/C=C/C)cc1OC	ZINC000623495118	460580784	/nfs/dbraw/zinc/58/07/84/460580784.db2.gz	RDCOBMYQDHNKRG-YVZNUBBCSA-N	0	3	325.836	3.330	20	30		EGEDHN
Cc1c(CNC[C@H](O)COc2ccccc2C#N)oc2ccccc12	ZINC000600729710	460582135	/nfs/dbraw/zinc/58/21/35/460582135.db2.gz	ZYQYUFVUYSPWAI-INIZCTEOSA-N	0	3	336.391	3.142	20	30		EGEDHN
C=CCOc1ccc(CN2CCC(CC(=O)OCC)CC2)cc1OC	ZINC000159079343	455350175	/nfs/dbraw/zinc/35/01/75/455350175.db2.gz	LFISATXIIFZIPW-UHFFFAOYSA-N	0	3	347.455	3.425	20	30		EGEDHN
Cc1ccc2c(c1)[C@H](N[C@H]1CCN(Cc3ccc(C#N)cc3)C1=O)CC2	ZINC000190633838	455357496	/nfs/dbraw/zinc/35/74/96/455357496.db2.gz	TUEWZKLQMYDEAC-RTWAWAEBSA-N	0	3	345.446	3.245	20	30		EGEDHN
CCOc1ccc(CN(C)CCC(=O)Nc2cccc(C#N)c2)cc1	ZINC000026223115	453794920	/nfs/dbraw/zinc/79/49/20/453794920.db2.gz	YSDMATQHPMGKKA-UHFFFAOYSA-N	0	3	337.423	3.418	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)c1ccc(C#N)c(C)n1)c1ccsc1	ZINC000031983572	453859917	/nfs/dbraw/zinc/85/99/17/453859917.db2.gz	BVOCYAWNHOXDTP-KRWDZBQOSA-N	0	3	342.468	3.136	20	30		EGEDHN
CN(C)CCN(CCCc1ccccc1)C(=O)c1cccc(C#N)c1	ZINC000066946339	453888393	/nfs/dbraw/zinc/88/83/93/453888393.db2.gz	LGXQUIPGBYFKGP-UHFFFAOYSA-N	0	3	335.451	3.195	20	30		EGEDHN
C=CCC[C@H](O)CN1CCN(c2ccc(C(F)(F)F)cc2)CC1	ZINC000034912040	453921328	/nfs/dbraw/zinc/92/13/28/453921328.db2.gz	WIKVRRYQXCYOLK-INIZCTEOSA-N	0	3	328.378	3.155	20	30		EGEDHN
N#Cc1c(F)cccc1NCc1ccccc1CN1CCC(O)CC1	ZINC000076064233	453956095	/nfs/dbraw/zinc/95/60/95/453956095.db2.gz	SODNVZFSQMRHLE-UHFFFAOYSA-N	0	3	339.414	3.266	20	30		EGEDHN
N#CC(C(=O)c1cccc(-n2cccc2)c1)c1nnc2n1CCCCC2	ZINC000041509038	453969919	/nfs/dbraw/zinc/96/99/19/453969919.db2.gz	JOAZXUHKOFZTEL-QGZVFWFLSA-N	0	3	345.406	3.285	20	30		EGEDHN
N#CC(C(=O)c1cccc(-n2cccc2)c1)c1nnc2n1CCCCC2	ZINC000041509041	453970272	/nfs/dbraw/zinc/97/02/72/453970272.db2.gz	JOAZXUHKOFZTEL-KRWDZBQOSA-N	0	3	345.406	3.285	20	30		EGEDHN
CN(C)CCN(Cc1cccs1)C(=O)c1cccc(CC#N)c1	ZINC000084249840	453979810	/nfs/dbraw/zinc/97/98/10/453979810.db2.gz	JDBRRDDRXKVIGI-UHFFFAOYSA-N	0	3	327.453	3.018	20	30		EGEDHN
CC(C)C1CCC(N2CCN(C(=O)NCCCCC#N)CC2)CC1	ZINC000084637698	454002790	/nfs/dbraw/zinc/00/27/90/454002790.db2.gz	SNXSVQYMQSEGSG-UHFFFAOYSA-N	0	3	334.508	3.222	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N(C)[C@@H](C)c1cccnc1)C(C)C	ZINC000068583893	454039720	/nfs/dbraw/zinc/03/97/20/454039720.db2.gz	HCKAVNZJPISEMP-HKUYNNGSSA-N	0	3	344.503	3.483	20	30		EGEDHN
CCOc1ccc(CN(C)CCOc2ccc(C#N)cc2OC)cc1	ZINC000077247179	454081502	/nfs/dbraw/zinc/08/15/02/454081502.db2.gz	YNGRUEVVLSABGS-UHFFFAOYSA-N	0	3	340.423	3.476	20	30		EGEDHN
N#CC(C(=O)c1ccc(-c2cnco2)cc1)c1nnc2n1CCCCC2	ZINC000069345950	454096610	/nfs/dbraw/zinc/09/66/10/454096610.db2.gz	VOWPIKFWYQNGJT-HNNXBMFYSA-N	0	3	347.378	3.150	20	30		EGEDHN
N#CC(C(=O)c1cccc(-n2cccn2)c1)c1cnc2ccccc2n1	ZINC000190902141	455401276	/nfs/dbraw/zinc/40/12/76/455401276.db2.gz	NKYLNXIQIRDLDL-INIZCTEOSA-N	0	3	339.358	3.306	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCCc2ccc(CC)cc2)CC1	ZINC000077663083	454137379	/nfs/dbraw/zinc/13/73/79/454137379.db2.gz	OCWAVYRJCBYCFG-UHFFFAOYSA-N	0	3	329.488	3.131	20	30		EGEDHN
N#CC1CCN(CCC(=O)Nc2ccc(Br)cc2)CC1	ZINC000057875519	454153926	/nfs/dbraw/zinc/15/39/26/454153926.db2.gz	LCWFQYWROOFMBO-UHFFFAOYSA-N	0	3	336.233	3.013	20	30		EGEDHN
N#Cc1cc(C(F)(F)F)ccc1NC1CCN([C@H]2CCOC2)CC1	ZINC000089603170	454167184	/nfs/dbraw/zinc/16/71/84/454167184.db2.gz	QGKJSRBIJBAPGL-HNNXBMFYSA-N	0	3	339.361	3.242	20	30		EGEDHN
N#Cc1csc(CNc2cccc(CN3CCC(CO)CC3)c2)c1	ZINC000119692272	454213525	/nfs/dbraw/zinc/21/35/25/454213525.db2.gz	UBOSCHLOWKNGHY-UHFFFAOYSA-N	0	3	341.480	3.436	20	30		EGEDHN
C[C@H](CN1CCOCC1)N(CCC(C)(C)C#N)Cc1ccccc1	ZINC000131546700	454263378	/nfs/dbraw/zinc/26/33/78/454263378.db2.gz	ZYEKUCMPDSFFSX-GOSISDBHSA-N	0	3	329.488	3.149	20	30		EGEDHN
C=C(C)COc1cc(CN[C@H](CO)Cc2ccccc2)ccc1OC	ZINC000131545648	454264213	/nfs/dbraw/zinc/26/42/13/454264213.db2.gz	PAGCSAYDITUKFD-IBGZPJMESA-N	0	3	341.451	3.343	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)NC1CCN(CC(=C)C)CC1	ZINC000078645628	454290923	/nfs/dbraw/zinc/29/09/23/454290923.db2.gz	NKRCKVXZWRZKFX-UHFFFAOYSA-N	0	3	343.471	3.091	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1ccc(F)cc1[N+](=O)[O-])C(C)C	ZINC000131903332	454296599	/nfs/dbraw/zinc/29/65/99/454296599.db2.gz	ZIWQCWSLROWDDF-QGZVFWFLSA-N	0	3	349.406	3.162	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccc(C(F)(F)F)nc2C)nc(C)n1	ZINC000078736651	454309152	/nfs/dbraw/zinc/30/91/52/454309152.db2.gz	SHTKZRHCBBUMJX-GFCCVEGCSA-N	0	3	334.301	3.306	20	30		EGEDHN
N#CCc1cccc(C(=O)N[C@H](CN2CCCC2)c2ccccc2)c1	ZINC000078820384	454324981	/nfs/dbraw/zinc/32/49/81/454324981.db2.gz	VNWCJUCXEAPEJO-HXUWFJFHSA-N	0	3	333.435	3.320	20	30		EGEDHN
Cc1oc(NC(=O)[C@H](C)N[C@H]2CC(C)(C)OC2(C)C)c(C#N)c1C	ZINC000132530179	454346261	/nfs/dbraw/zinc/34/62/61/454346261.db2.gz	GKCQPUFLSJIVSM-FZMZJTMJSA-N	0	3	333.432	3.031	20	30		EGEDHN
N#CC(C(=O)c1cc(Br)cc([N+](=O)[O-])c1)c1ccccn1	ZINC000132627813	454353881	/nfs/dbraw/zinc/35/38/81/454353881.db2.gz	XSIMASVAKYCXFQ-LBPRGKRZSA-N	0	3	346.140	3.242	20	30		EGEDHN
Cc1ccc(C(=O)NC2CCN(Cc3ccccc3)CC2)cc1C#N	ZINC000096617918	454374929	/nfs/dbraw/zinc/37/49/29/454374929.db2.gz	QVHGWSZURJMVAW-UHFFFAOYSA-N	0	3	333.435	3.261	20	30		EGEDHN
COc1cc(C#N)ccc1CN1CC[C@@H]2[C@H](CCCN2C2CC2)C1	ZINC000121525442	454447355	/nfs/dbraw/zinc/44/73/55/454447355.db2.gz	YCQIXDUQMXRODH-VQIMIIECSA-N	0	3	325.456	3.016	20	30		EGEDHN
COc1ccc(C#N)cc1NC(=O)c1ccc(CN2CCCC2)cc1	ZINC000064456192	454482936	/nfs/dbraw/zinc/48/29/36/454482936.db2.gz	WZQWVEDZCWAGPL-UHFFFAOYSA-N	0	3	335.407	3.415	20	30		EGEDHN
Cc1ccc([C@@H]2CCCN2C[C@H](O)COc2ccc(C#N)cc2)cc1	ZINC000073987129	454514074	/nfs/dbraw/zinc/51/40/74/454514074.db2.gz	GCOUNBSLWDMUIC-FPOVZHCZSA-N	0	3	336.435	3.444	20	30		EGEDHN
COc1ccc([C@@H](NCC(=O)N[C@@](C)(C#N)C(C)C)C(C)C)cc1	ZINC000102693297	454516343	/nfs/dbraw/zinc/51/63/43/454516343.db2.gz	OEFBKMBTNHYQIF-OALUTQOASA-N	0	3	331.460	3.036	20	30		EGEDHN
C=CCc1cc(CN2CCC[C@@H](c3ncc[nH]3)C2)cc(OC)c1O	ZINC000092072146	454516434	/nfs/dbraw/zinc/51/64/34/454516434.db2.gz	AUXXNAOMDPNMFN-MRXNPFEDSA-N	0	3	327.428	3.232	20	30		EGEDHN
COc1ccc([C@H](NCC(=O)N[C@](C)(C#N)C(C)C)C(C)C)cc1	ZINC000102693303	454516399	/nfs/dbraw/zinc/51/63/99/454516399.db2.gz	OEFBKMBTNHYQIF-RTBURBONSA-N	0	3	331.460	3.036	20	30		EGEDHN
N#Cc1ccc(N2CCC(NCc3cnc(C4CC4)s3)CC2)nc1	ZINC000134275398	454522152	/nfs/dbraw/zinc/52/21/52/454522152.db2.gz	LUUATYWHUZUMRA-UHFFFAOYSA-N	0	3	339.468	3.046	20	30		EGEDHN
Cc1cccc(CN(CCN(C)C)C(=O)Nc2cccc(C#N)c2)c1	ZINC000103175529	454542559	/nfs/dbraw/zinc/54/25/59/454542559.db2.gz	XYZPMPMUPIIXJD-UHFFFAOYSA-N	0	3	336.439	3.462	20	30		EGEDHN
CCN(Cc1cn(CCC#N)nc1-c1ccccc1)C[C@H]1CCCO1	ZINC000092406929	454562872	/nfs/dbraw/zinc/56/28/72/454562872.db2.gz	RUGZWBMCIYLAIP-LJQANCHMSA-N	0	3	338.455	3.465	20	30		EGEDHN
C#CCCCCNC(=O)N(C)CCC1CCN(c2ccncc2)CC1	ZINC000092502078	454576392	/nfs/dbraw/zinc/57/63/92/454576392.db2.gz	YZLIXGXRYQOSAM-UHFFFAOYSA-N	0	3	342.487	3.133	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN(C)CCc1ccc(F)cc1	ZINC000065612082	454604253	/nfs/dbraw/zinc/60/42/53/454604253.db2.gz	AHNJBMYGYMBSKR-HXUWFJFHSA-N	0	3	343.442	3.468	20	30		EGEDHN
CN(C)CCN(C(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1)c1ccccc1	ZINC000080905622	454645127	/nfs/dbraw/zinc/64/51/27/454645127.db2.gz	VMGDIIYBMQEFBV-VQTJNVASSA-N	0	3	333.435	3.257	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)CN1CCC[C@@H]1CCc1ccccc1	ZINC000052105970	454654637	/nfs/dbraw/zinc/65/46/37/454654637.db2.gz	WBNGMIYFYUUQTI-UYAOXDASSA-N	0	3	327.472	3.138	20	30		EGEDHN
C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCCCN1CCCSCC#N	ZINC000074989992	454671907	/nfs/dbraw/zinc/67/19/07/454671907.db2.gz	RMIJXGGILBYUDF-GJZGRUSLSA-N	0	3	341.521	3.401	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)/C=C(\C)c2ccccc2OC)CC1	ZINC000106034601	454674548	/nfs/dbraw/zinc/67/45/48/454674548.db2.gz	QRZJBHGSQMDWII-DTQAZKPQSA-N	0	3	328.456	3.255	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Cn2c(C)cc3ccccc32)CC1	ZINC000106038751	454675798	/nfs/dbraw/zinc/67/57/98/454675798.db2.gz	FJRHTNZCEIBJCV-UHFFFAOYSA-N	0	3	325.456	3.106	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@H](C)NCC(C)(C)c1ccc(OC)cc1	ZINC000123956581	454690767	/nfs/dbraw/zinc/69/07/67/454690767.db2.gz	HAWBKPDBXPKYCV-INIZCTEOSA-N	0	3	332.488	3.376	20	30		EGEDHN
COC(=O)C(C)(C)[C@@H]1CCCN(CCCOc2cccc(C#N)c2)C1	ZINC000093298193	454700611	/nfs/dbraw/zinc/70/06/11/454700611.db2.gz	JBLKSKCNJOZMGD-QGZVFWFLSA-N	0	3	344.455	3.238	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cccc(Cl)c2[N+](=O)[O-])CC1	ZINC000176285940	454722706	/nfs/dbraw/zinc/72/27/06/454722706.db2.gz	CJKFVGRHWJLGIT-UHFFFAOYSA-N	0	3	337.807	3.019	20	30		EGEDHN
COCCOc1ccc(Cl)cc1C(=O)C(C#N)c1ccccn1	ZINC000176526905	454756542	/nfs/dbraw/zinc/75/65/42/454756542.db2.gz	ROEPUEXFFXXXRV-AWEZNQCLSA-N	0	3	330.771	3.250	20	30		EGEDHN
C[C@@H](C#N)CSc1ccccc1NC(=O)NC[C@H]1CCCN(C)C1	ZINC000108528538	454801863	/nfs/dbraw/zinc/80/18/63/454801863.db2.gz	KPJAWWGLSFXISM-LSDHHAIUSA-N	0	3	346.500	3.402	20	30		EGEDHN
C[C@H](c1ccc(-n2cncn2)cc1)N(C)Cc1ccc(F)c(C#N)c1	ZINC000160565838	455475013	/nfs/dbraw/zinc/47/50/13/455475013.db2.gz	HDMSCVJCVSWSKJ-CQSZACIVSA-N	0	3	335.386	3.471	20	30		EGEDHN
Cc1nc(CNC2CCC(Oc3ccc(C#N)cn3)CC2)cs1	ZINC000125405844	454819812	/nfs/dbraw/zinc/81/98/12/454819812.db2.gz	VOOMFDHRFZLAMU-UHFFFAOYSA-N	0	3	328.441	3.198	20	30		EGEDHN
CN(C)[C@@H]1Cc2ccccc2N(C(=O)CCc2ccc(C#N)cc2)C1	ZINC000109113085	454822050	/nfs/dbraw/zinc/82/20/50/454822050.db2.gz	NXWIFCSTWYZTMV-LJQANCHMSA-N	0	3	333.435	3.010	20	30		EGEDHN
COCCOC[C@H]1CCN(CC#Cc2ccc(C(F)(F)F)cc2)C1	ZINC000177350942	454855190	/nfs/dbraw/zinc/85/51/90/454855190.db2.gz	JFSDTTWTOWGZPL-INIZCTEOSA-N	0	3	341.373	3.042	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN2CCC[C@H]2CN2CCCCC2)c1C	ZINC000177595295	454881885	/nfs/dbraw/zinc/88/18/85/454881885.db2.gz	IFCIUIVTBBKURB-IBGZPJMESA-N	0	3	343.515	3.424	20	30		EGEDHN
C#CCCCCNCc1cc(OC)c(OC)cc1Br	ZINC000150734054	454884344	/nfs/dbraw/zinc/88/43/44/454884344.db2.gz	AUXNELFABXLICJ-UHFFFAOYSA-N	0	3	326.234	3.359	20	30		EGEDHN
CN(C(=O)c1cccc(Nc2ccc(C#N)cc2)c1)C1CCN(C)CC1	ZINC000154617006	454912609	/nfs/dbraw/zinc/91/26/09/454912609.db2.gz	XBPJPAAFYMGEOI-UHFFFAOYSA-N	0	3	348.450	3.468	20	30		EGEDHN
C#CCCCCNC(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000160710195	455490277	/nfs/dbraw/zinc/49/02/77/455490277.db2.gz	WXRMDRMCIAXHBQ-IBGZPJMESA-N	0	3	327.472	3.096	20	30		EGEDHN
C[C@@H]1CCC[C@H](C(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)C1	ZINC000151146072	454944032	/nfs/dbraw/zinc/94/40/32/454944032.db2.gz	LGEBIHWJPQFUDY-APWZRJJASA-N	0	3	327.472	3.275	20	30		EGEDHN
C#CCOc1ccc(CNCc2ccc(OC)c(OCC)c2)cc1	ZINC000114505365	454958740	/nfs/dbraw/zinc/95/87/40/454958740.db2.gz	RBZOUXXJFDLYTJ-UHFFFAOYSA-N	0	3	325.408	3.396	20	30		EGEDHN
C[C@@H](NCc1cccc(C#N)c1)c1ccc(N2CCOCC2)c(F)c1	ZINC000151374976	454976029	/nfs/dbraw/zinc/97/60/29/454976029.db2.gz	MBGWHFBROPPPNI-OAHLLOKOSA-N	0	3	339.414	3.385	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@H](C)N1CC[C@H](c2ccc(OC)cc2)C1	ZINC000155230875	454977548	/nfs/dbraw/zinc/97/75/48/454977548.db2.gz	GFMSGKGWUCTHBI-WMZOPIPTSA-N	0	3	328.456	3.074	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN[C@H](C)c1ccc(C#N)cc1	ZINC000127771278	454996503	/nfs/dbraw/zinc/99/65/03/454996503.db2.gz	FWEIGAOIQJXLEQ-OXQOHEQNSA-N	0	3	336.435	3.377	20	30		EGEDHN
N#Cc1cccc(OCCCN2CCN(CCc3ccccc3)CC2)c1	ZINC000155421729	455000403	/nfs/dbraw/zinc/00/04/03/455000403.db2.gz	OPICXEVUTSMCQN-UHFFFAOYSA-N	0	3	349.478	3.187	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)CN[C@@H](C)c1ccc2c(c1)CCCC2	ZINC000128209428	455035102	/nfs/dbraw/zinc/03/51/02/455035102.db2.gz	JFIVHRNYLIRIHE-YWZLYKJASA-N	0	3	327.472	3.270	20	30		EGEDHN
COCCN(CCCc1ccccc1)C[C@@H](O)c1ccc(C#N)cc1	ZINC000155781599	455045232	/nfs/dbraw/zinc/04/52/32/455045232.db2.gz	CWLMJPRGELBURQ-OAQYLSRUSA-N	0	3	338.451	3.173	20	30		EGEDHN
COc1ccc(CN(Cc2ccccc2)[C@H](CO)C2CC2)cc1C#N	ZINC000155896727	455059022	/nfs/dbraw/zinc/05/90/22/455059022.db2.gz	ISWNVAOWOBVFHV-HXUWFJFHSA-N	0	3	336.435	3.340	20	30		EGEDHN
COc1ccc(C#N)cc1CN(Cc1ccccc1)[C@H](CO)C1CC1	ZINC000156039637	455075682	/nfs/dbraw/zinc/07/56/82/455075682.db2.gz	QKGCOVYJNKHRNF-HXUWFJFHSA-N	0	3	336.435	3.340	20	30		EGEDHN
CC(C)(O)CN1CCN(Cc2ccc(-c3ccccc3C#N)cc2)CC1	ZINC000171671217	455085155	/nfs/dbraw/zinc/08/51/55/455085155.db2.gz	QVJSENGPDRUXSE-UHFFFAOYSA-N	0	3	349.478	3.114	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2nc3c(s2)CCCCC3)CC1	ZINC000171680116	455085866	/nfs/dbraw/zinc/08/58/66/455085866.db2.gz	NRSBDSCTJPLBSG-UHFFFAOYSA-N	0	3	334.489	3.184	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cnc(-c3ccsc3)s2)CC1	ZINC000171804659	455095155	/nfs/dbraw/zinc/09/51/55/455095155.db2.gz	ZBRXLLYEUWSBSP-UHFFFAOYSA-N	0	3	333.482	3.252	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cccc(C(=O)CC)c2)CC1	ZINC000152309951	455100447	/nfs/dbraw/zinc/10/04/47/455100447.db2.gz	OALYPOCAPJQQMM-UHFFFAOYSA-N	0	3	329.444	3.441	20	30		EGEDHN
C#CCCCCC(=O)N1CCCN(CCCc2ccccc2)CC1	ZINC000179959184	455105500	/nfs/dbraw/zinc/10/55/00/455105500.db2.gz	BLWFKXXOILBRMU-UHFFFAOYSA-N	0	3	326.484	3.347	20	30		EGEDHN
C[C@H](N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O)c1cccs1	ZINC000179963815	455107257	/nfs/dbraw/zinc/10/72/57/455107257.db2.gz	OBZVVLQSVQTGIZ-XJKSGUPXSA-N	0	3	325.437	3.466	20	30		EGEDHN
COc1cccc2c1OC[C@H](NCc1ccc(O[C@H](C)C#N)cc1)C2	ZINC000237360401	455177574	/nfs/dbraw/zinc/17/75/74/455177574.db2.gz	VAULZXJJZCUXGM-RHSMWYFYSA-N	0	3	338.407	3.079	20	30		EGEDHN
C=CCCN[C@H](c1ccc(OC)cc1)c1cccc(S(C)(=O)=O)c1	ZINC000172945947	455212778	/nfs/dbraw/zinc/21/27/78/455212778.db2.gz	FWQAFMQMXGTZLR-LJQANCHMSA-N	0	3	345.464	3.354	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(CCc2ccc(F)cc2)C2CC2)CC1	ZINC000265331518	455307501	/nfs/dbraw/zinc/30/75/01/455307501.db2.gz	POWAMDRSQPMOGH-UHFFFAOYSA-N	0	3	345.462	3.193	20	30		EGEDHN
N#Cc1c(NC2CCN(CCc3ccccc3)CC2)nc2ccccn12	ZINC000181391486	455328034	/nfs/dbraw/zinc/32/80/34/455328034.db2.gz	UIGRUMOMPNNDFN-UHFFFAOYSA-N	0	3	345.450	3.325	20	30		EGEDHN
CC[C@H](CNC(=O)c1ccccc1CC#N)N1CCc2ccccc2C1	ZINC000600994686	460669092	/nfs/dbraw/zinc/66/90/92/460669092.db2.gz	FUKJTYWYVCOBME-HXUWFJFHSA-N	0	3	347.462	3.319	20	30		EGEDHN
COc1cccc2c1OC[C@@H](N[C@H](C)c1ccc(OCC#N)cc1)C2	ZINC000181679801	455371949	/nfs/dbraw/zinc/37/19/49/455371949.db2.gz	NLKNSXWPDGBODQ-PBHICJAKSA-N	0	3	338.407	3.252	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(Oc3ccccc3)ccn2)CC1	ZINC000174296007	455377648	/nfs/dbraw/zinc/37/76/48/455377648.db2.gz	DSCNGKFULHFVHO-UHFFFAOYSA-N	0	3	337.423	3.254	20	30		EGEDHN
CCN(CCC#N)C(=O)CN[C@H](c1ccc(Cl)cc1)[C@@H]1C[C@H]1C	ZINC000245926553	455400450	/nfs/dbraw/zinc/40/04/50/455400450.db2.gz	RNQNXTNPDTZERQ-MZMPZRCHSA-N	0	3	333.863	3.389	20	30		EGEDHN
C[C@H](CNC(=O)N[C@H](CCC#N)c1ccccc1)N1CCC[C@@H](C)C1	ZINC000245922606	455400463	/nfs/dbraw/zinc/40/04/63/455400463.db2.gz	GUIOGTZJHXKBHU-ZHALLVOQSA-N	0	3	342.487	3.451	20	30		EGEDHN
COCCOc1cccc(C(=O)C(C#N)c2cnc3ccccc3n2)c1	ZINC000190964840	455415846	/nfs/dbraw/zinc/41/58/46/455415846.db2.gz	QLOPEVGGTMJPNH-INIZCTEOSA-N	0	3	347.374	3.145	20	30		EGEDHN
COc1ccc(CN[C@@H]2CCCC[C@H]2OC)cc1OCCCC#N	ZINC000266128484	455423862	/nfs/dbraw/zinc/42/38/62/455423862.db2.gz	CJDPZHKWPSLWPC-IAGOWNOFSA-N	0	3	332.444	3.425	20	30		EGEDHN
C=CCN(CCCc1nc(-c2ccc(C)c(F)c2)no1)CCOC	ZINC000191127726	455448690	/nfs/dbraw/zinc/44/86/90/455448690.db2.gz	VQUMQSYKUFAWPR-UHFFFAOYSA-N	0	3	333.407	3.251	20	30		EGEDHN
Cn1cc(CN[C@H]2CCCN(c3ccccc3Cl)C2)cc1C#N	ZINC000191187330	455460682	/nfs/dbraw/zinc/46/06/82/455460682.db2.gz	MHGMUCMWWMHOSM-HNNXBMFYSA-N	0	3	328.847	3.309	20	30		EGEDHN
CCCCNC(=O)[C@H]1CC[C@@H](C)N(Cc2ccc(F)c(C#N)c2)C1	ZINC000161004296	455523504	/nfs/dbraw/zinc/52/35/04/455523504.db2.gz	ZNRCLZVYFJTLDK-ZBFHGGJFSA-N	0	3	331.435	3.214	20	30		EGEDHN
CN(Cc1ccccc1)[C@H](CNC(=O)Cc1ccc(C#N)cc1)C1CC1	ZINC000185321332	455539080	/nfs/dbraw/zinc/53/90/80/455539080.db2.gz	XTJHMEAVHULEIR-OAQYLSRUSA-N	0	3	347.462	3.128	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)Cc2ccc(C#N)cc2)CCN1Cc1ccccc1	ZINC000176105259	455540097	/nfs/dbraw/zinc/54/00/97/455540097.db2.gz	HSWWEPMERFFFIR-UTKZUKDTSA-N	0	3	347.462	3.270	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H](CNC(=O)C1(C#N)CCCC1)C1CC1	ZINC000185322592	455540115	/nfs/dbraw/zinc/54/01/15/455540115.db2.gz	CLGAQNWEKMOSRO-SFHVURJKSA-N	0	3	325.456	3.097	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)c1cccc(C#N)c1	ZINC000267348424	455543376	/nfs/dbraw/zinc/54/33/76/455543376.db2.gz	CMXQBIZZYFMVEI-JXFKEZNVSA-N	0	3	333.435	3.199	20	30		EGEDHN
CSc1cc(C(=O)N(CCN(C)C)Cc2cccc(C#N)c2)co1	ZINC000601019093	460677634	/nfs/dbraw/zinc/67/76/34/460677634.db2.gz	APTOMEZDKWDYEV-UHFFFAOYSA-N	0	3	343.452	3.077	20	30		EGEDHN
CCCCNC(=O)C1(NCc2ccc(C#N)c(F)c2)CCCCC1	ZINC000192115983	455558886	/nfs/dbraw/zinc/55/88/86/455558886.db2.gz	QPIASVKLKVNAFG-UHFFFAOYSA-N	0	3	331.435	3.406	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H](C)C2(c3ccccc3)CCCC2)CC1	ZINC000185470524	455562332	/nfs/dbraw/zinc/56/23/32/455562332.db2.gz	OPJWJKVLQIAGRT-SFHVURJKSA-N	0	3	338.495	3.348	20	30		EGEDHN
C[C@@H](CC#N)Sc1ccccc1NC(=O)N1CCN2CCC[C@H]2C1	ZINC000247228077	455575489	/nfs/dbraw/zinc/57/54/89/455575489.db2.gz	CLWQIVRTJYFRRB-GJZGRUSLSA-N	0	3	344.484	3.393	20	30		EGEDHN
Cc1ccc(CN[C@H]2CCN(Cc3ccc(C#N)cc3)C2=O)c(C)c1	ZINC000192244731	455580821	/nfs/dbraw/zinc/58/08/21/455580821.db2.gz	GZWKOFJSJBKFIF-FQEVSTJZSA-N	0	3	333.435	3.066	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CN(Cc3ccccc3)CCCO2)s1	ZINC000192355030	455595921	/nfs/dbraw/zinc/59/59/21/455595921.db2.gz	TYKRHEKYWIRVAQ-QGZVFWFLSA-N	0	3	341.480	3.000	20	30		EGEDHN
C=CC[C@@H]1N(Cc2nn3c(nc(C)cc3=O)s2)CCCC1(C)C	ZINC000277655473	455626025	/nfs/dbraw/zinc/62/60/25/455626025.db2.gz	DFXDOOLHTXFLSH-ZDUSSCGKSA-N	0	3	332.473	3.026	20	30		EGEDHN
N#Cc1ccccc1OCCN1CCC[C@H]1C[C@H](O)c1ccco1	ZINC000268236084	455626464	/nfs/dbraw/zinc/62/64/64/455626464.db2.gz	FUPFIJWXTGQWJD-IRXDYDNUSA-N	0	3	326.396	3.118	20	30		EGEDHN
CSCC[C@H](C)N(C)[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000192678092	455667038	/nfs/dbraw/zinc/66/70/38/455667038.db2.gz	BJJGGWUDWUGOJF-WMLDXEAASA-N	0	3	331.485	3.127	20	30		EGEDHN
CC[C@](C)(NCCC(C#N)(c1ccccc1)c1ccccc1)C(N)=O	ZINC000193073632	455740297	/nfs/dbraw/zinc/74/02/97/455740297.db2.gz	YDNNVJZUXKSBNU-FQEVSTJZSA-N	0	3	335.451	3.130	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N1CC[C@]2(CCN(C)C2)C1)c1ccc(F)c(F)c1	ZINC000292732844	455743787	/nfs/dbraw/zinc/74/37/87/455743787.db2.gz	SQBNKQCCULTRFS-HKUYNNGSSA-N	0	3	349.425	3.319	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CCC(C2(C)OCCO2)CC1	ZINC000268986526	455754552	/nfs/dbraw/zinc/75/45/52/455754552.db2.gz	QPUBRBVWXGXVKJ-UHFFFAOYSA-N	0	3	328.456	3.463	20	30		EGEDHN
C[C@@H](NC[C@@H]1CN(Cc2ccccc2)CCO1)c1cccc(C#N)c1	ZINC000271785793	455759316	/nfs/dbraw/zinc/75/93/16/455759316.db2.gz	GZPPLVKJQIEDHW-DYESRHJHSA-N	0	3	335.451	3.110	20	30		EGEDHN
CC[C@@H](NCc1ccccc1Cn1cncn1)c1ccc(C#N)cc1	ZINC000278224950	455790833	/nfs/dbraw/zinc/79/08/33/455790833.db2.gz	JKBLWVXYHAVLDZ-HXUWFJFHSA-N	0	3	331.423	3.439	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2coc(-c3ccccc3Cl)n2)CC1	ZINC000271862461	455791549	/nfs/dbraw/zinc/79/15/49/455791549.db2.gz	LUUJBAQEXQESAR-UHFFFAOYSA-N	0	3	345.830	3.375	20	30		EGEDHN
C#CC[C@H](NCc1ccc(O[C@@H](C)C(=O)OC)cc1)c1ccccc1	ZINC000271867214	455793620	/nfs/dbraw/zinc/79/36/20/455793620.db2.gz	WQCXUHHHWZVABG-JXFKEZNVSA-N	0	3	337.419	3.481	20	30		EGEDHN
C[C@@H](NCc1cccc(N2CCOCC2)c1)c1ccc(C#N)c(F)c1	ZINC000293665130	455793924	/nfs/dbraw/zinc/79/39/24/455793924.db2.gz	IZZSWGQZQNEJCY-OAHLLOKOSA-N	0	3	339.414	3.385	20	30		EGEDHN
C=C[C@@H](CC(=O)N1CCN(C2CCOCC2)C[C@H]1C)c1ccccc1	ZINC000278302688	455811220	/nfs/dbraw/zinc/81/12/20/455811220.db2.gz	CHKQMNHUNZIUHV-MSOLQXFVSA-N	0	3	342.483	3.058	20	30		EGEDHN
CC[C@@H](N[C@@H]1CCCN(CC(F)(F)F)C1=O)c1ccc(C#N)cc1	ZINC000278358547	455828606	/nfs/dbraw/zinc/82/86/06/455828606.db2.gz	BFDYRWXAQVWQTP-HUUCEWRRSA-N	0	3	339.361	3.152	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2CN[C@@H]2CCC[C@@H](C#N)C2)C[C@H](C)O1	ZINC000253354792	455833893	/nfs/dbraw/zinc/83/38/93/455833893.db2.gz	MOQMQPGIXYAQMU-BMQTXXJKSA-N	0	3	341.499	3.468	20	30		EGEDHN
CCC[C@]1(NCC(=O)N(CCC#N)c2cc(C)cc(C)c2)CCOC1	ZINC000285493861	455856892	/nfs/dbraw/zinc/85/68/92/455856892.db2.gz	IWKACNAHBILKKZ-FQEVSTJZSA-N	0	3	343.471	3.099	20	30		EGEDHN
C[C@]1(O)CCCN(Cc2cn(CCC#N)nc2-c2ccccc2)CC1	ZINC000279590661	455867967	/nfs/dbraw/zinc/86/79/67/455867967.db2.gz	CNEHCRAQENXKJT-FQEVSTJZSA-N	0	3	338.455	3.201	20	30		EGEDHN
C[C@](C#N)(NC(=O)CN1C[C@H](c2ccccc2)[C@@H]2CCC[C@@H]21)C1CC1	ZINC000285556032	455869319	/nfs/dbraw/zinc/86/93/19/455869319.db2.gz	VASZZBPICGREMP-YOUFYPILSA-N	0	3	337.467	3.063	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NC[C@@H](c1cccs1)N1CCCC1)OCC	ZINC000270136921	455886385	/nfs/dbraw/zinc/88/63/85/455886385.db2.gz	QPBWTQKUZJCLCE-JKSUJKDBSA-N	0	3	336.501	3.373	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NC[C@H](c1ccccc1)N1CCCC1)OCC	ZINC000270155461	455889452	/nfs/dbraw/zinc/88/94/52/455889452.db2.gz	XGBYDRZOTGRDAM-RTBURBONSA-N	0	3	330.472	3.311	20	30		EGEDHN
C=CCN(CCc1ccco1)C(=O)NC1CCN(CC(=C)C)CC1	ZINC000272356630	455924712	/nfs/dbraw/zinc/92/47/12/455924712.db2.gz	PNFVYXMLALGLAO-UHFFFAOYSA-N	0	3	331.460	3.060	20	30		EGEDHN
COc1ccc(CN(C)CCCN(C)Cc2ccco2)cc1C#N	ZINC000285834949	455925795	/nfs/dbraw/zinc/92/57/95/455925795.db2.gz	XBUCANSPIDNIHN-UHFFFAOYSA-N	0	3	327.428	3.114	20	30		EGEDHN
C[C@@H](c1ccc(OCC#N)cc1)N1CCC[C@H](CC(C)(C)C(N)=O)C1	ZINC000296393572	455925830	/nfs/dbraw/zinc/92/58/30/455925830.db2.gz	KEXPFFOWHGAHJT-JKSUJKDBSA-N	0	3	343.471	3.264	20	30		EGEDHN
CCN(C[C@@H]1CCN(Cc2ccccc2)C1)C(=O)[C@@](C)(C#N)CC	ZINC000285900094	455937532	/nfs/dbraw/zinc/93/75/32/455937532.db2.gz	BIDODMOCXIUOGH-UYAOXDASSA-N	0	3	327.472	3.297	20	30		EGEDHN
C[C@@H](CNC(=O)C(C#N)Cc1ccc(C#N)cc1)Cc1cccs1	ZINC000280528529	455990100	/nfs/dbraw/zinc/99/01/00/455990100.db2.gz	SFYSCESPQRLLBR-PBHICJAKSA-N	0	3	337.448	3.297	20	30		EGEDHN
CC(C)(C#N)CC(=O)N1CC[C@@]2(CCN(Cc3ccccc3)C2)C1	ZINC000286182597	455995769	/nfs/dbraw/zinc/99/57/69/455995769.db2.gz	JVKQEUWJHHCFEC-HXUWFJFHSA-N	0	3	325.456	3.051	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cc(OC)c(C)cc2C)CC1	ZINC000280596452	456008369	/nfs/dbraw/zinc/00/83/69/456008369.db2.gz	WGZWGIZJAWGXQP-UHFFFAOYSA-N	0	3	331.460	3.474	20	30		EGEDHN
COC[C@@]1(C)CCN(CC#Cc2ccc(OC(F)(F)F)cc2)C1	ZINC000296723516	456020038	/nfs/dbraw/zinc/02/00/38/456020038.db2.gz	NOTKDBYCKHLIQW-INIZCTEOSA-N	0	3	327.346	3.295	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1CNCc1cc2c(cc1OC(F)F)OCO2	ZINC000280678517	456028939	/nfs/dbraw/zinc/02/89/39/456028939.db2.gz	QLBVZPXQDBJQRY-BZNIZROVSA-N	0	3	341.354	3.088	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)C(C)(C)c1c(C)noc1C)C(C)C	ZINC000280688614	456032007	/nfs/dbraw/zinc/03/20/07/456032007.db2.gz	ZHXMINTUEWUMDN-QGZVFWFLSA-N	0	3	347.503	3.384	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC(CCN2C[C@@H](C)O[C@H](C)C2)CC1	ZINC000188491501	456072707	/nfs/dbraw/zinc/07/27/07/456072707.db2.gz	GMVQHFSYUZUJGG-MBOZVWFJSA-N	0	3	336.520	3.327	20	30		EGEDHN
C=CCCCCNC(=O)c1cnn(CCN(C)C)c1-c1ccccc1	ZINC000287998112	456084107	/nfs/dbraw/zinc/08/41/07/456084107.db2.gz	VFOOKUFKGQVYSS-UHFFFAOYSA-N	0	3	340.471	3.198	20	30		EGEDHN
C[C@H]1[C@H](NC(=O)c2ccc(CC#N)cc2)CCN1Cc1ccccc1	ZINC000288024684	456084845	/nfs/dbraw/zinc/08/48/45/456084845.db2.gz	CIDRITMMZUOTHU-OXJNMPFZSA-N	0	3	333.435	3.145	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H](C)[C@@H](O)c2ccccc2)cc1OC	ZINC000288528577	456098353	/nfs/dbraw/zinc/09/83/53/456098353.db2.gz	KATJLRKYIPFRAX-MGPUTAFESA-N	0	3	327.424	3.472	20	30		EGEDHN
CCN(CC)c1ccc(CNC(=N)Nc2cc(F)ccc2F)cn1	ZINC000288775516	456106058	/nfs/dbraw/zinc/10/60/58/456106058.db2.gz	VLSRDQNVTQBNDG-UHFFFAOYSA-N	0	3	333.386	3.133	20	30		EGEDHN
C=CCN(CCc1ccccc1)C(=O)N[C@@H](C)C1=CCN(C)CC1	ZINC000272900587	456106371	/nfs/dbraw/zinc/10/63/71/456106371.db2.gz	IPVMJMREMWBQNA-KRWDZBQOSA-N	0	3	327.472	3.077	20	30		EGEDHN
CC(C)[C@](C)(NCCC(C#N)(c1ccccc1)c1ccccc1)C(N)=O	ZINC000289473613	456127397	/nfs/dbraw/zinc/12/73/97/456127397.db2.gz	ZFFYIPIXMBXKRA-NRFANRHFSA-N	0	3	349.478	3.376	20	30		EGEDHN
CCN1CCCC[C@H]1CNc1cc(C#N)c2cc([N+](=O)[O-])ccc2n1	ZINC000301546310	456143542	/nfs/dbraw/zinc/14/35/42/456143542.db2.gz	PBPRTXHCWWFIAZ-HNNXBMFYSA-N	0	3	339.399	3.301	20	30		EGEDHN
C=CCOc1ccc(CN2CCC(C3(C)OCCO3)CC2)cc1OC	ZINC000271194341	456164281	/nfs/dbraw/zinc/16/42/81/456164281.db2.gz	QTPKFWVODMGTNA-UHFFFAOYSA-N	0	3	347.455	3.235	20	30		EGEDHN
C=CCC[C@@H](C(=O)NC1CCN(CCCOC)CC1)c1ccccc1	ZINC000189009490	456198880	/nfs/dbraw/zinc/19/88/80/456198880.db2.gz	MQLNYEMXUXCJTA-HXUWFJFHSA-N	0	3	344.499	3.354	20	30		EGEDHN
CC1CCN([C@@H](CNC(=O)NCCCC#N)c2cccs2)CC1	ZINC000273279542	456221098	/nfs/dbraw/zinc/22/10/98/456221098.db2.gz	DAOXLTSGOGYUGU-HNNXBMFYSA-N	0	3	334.489	3.124	20	30		EGEDHN
CN(CCC(=O)Nc1ccc(C#N)cc1)C[C@H]1OCCc2ccccc21	ZINC000263783916	456221513	/nfs/dbraw/zinc/22/15/13/456221513.db2.gz	ZFGYJQMFVSCFRH-HXUWFJFHSA-N	0	3	349.434	3.133	20	30		EGEDHN
COc1cc(CN[C@@H](C)c2cccc(C#N)c2)cc(OC)c1OC	ZINC000237168809	456241864	/nfs/dbraw/zinc/24/18/64/456241864.db2.gz	ZKZZDBFRIRXJGB-ZDUSSCGKSA-N	0	3	326.396	3.435	20	30		EGEDHN
CSC1c2cc(-c3noc(C4(C#N)CCC4)n3)ccc2NC1=O	ZINC000273848796	456245737	/nfs/dbraw/zinc/24/57/37/456245737.db2.gz	LHGSEZNNTSXOMT-LBPRGKRZSA-N	0	3	326.381	3.038	20	30		EGEDHN
C=C(C)[C@H](Cc1nc(-c2ccccc2OCCN(C)C)no1)OCC	ZINC000273873503	456247477	/nfs/dbraw/zinc/24/74/77/456247477.db2.gz	NGFKOCPXLVYDFR-KRWDZBQOSA-N	0	3	345.443	3.201	20	30		EGEDHN
CC(C)(C)[C@@](C)(C#N)NC(=O)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000274387975	456257735	/nfs/dbraw/zinc/25/77/35/456257735.db2.gz	ZVLDYPPHQXTQIW-FXAWDEMLSA-N	0	3	327.472	3.343	20	30		EGEDHN
C[C@H](CC#N)Sc1ccccc1NC(=O)CN[C@@H](C)[C@H]1CCOC1	ZINC000274614495	456262001	/nfs/dbraw/zinc/26/20/01/456262001.db2.gz	PNXSBMVFNGMXFD-ILXRZTDVSA-N	0	3	347.484	3.034	20	30		EGEDHN
CN1CCC(Nc2ccccc2NC(=O)c2cccc(C#N)c2)CC1	ZINC000263928079	456266652	/nfs/dbraw/zinc/26/66/52/456266652.db2.gz	RBDKCPFSLZEFGK-UHFFFAOYSA-N	0	3	334.423	3.317	20	30		EGEDHN
N#Cc1ccccc1N1CCCN(CC[C@H](O)c2ccccc2)CC1	ZINC000290408714	456319236	/nfs/dbraw/zinc/31/92/36/456319236.db2.gz	UBMMOJGELUAZME-NRFANRHFSA-N	0	3	335.451	3.194	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1F)c1ccc(C#N)cc1[N+](=O)[O-]	ZINC000347731067	456335455	/nfs/dbraw/zinc/33/54/55/456335455.db2.gz	CDCMZFGWBPYMKP-UHFFFAOYSA-N	0	3	342.374	3.174	20	30		EGEDHN
CCN(CCOc1ccccc1C#N)C[C@@H]1COc2ccccc2O1	ZINC000342996995	456344434	/nfs/dbraw/zinc/34/44/34/456344434.db2.gz	WRKYLSCRBAEKDB-QGZVFWFLSA-N	0	3	338.407	3.099	20	30		EGEDHN
CO/N=C/c1ccc(C(=O)Nc2ccccc2CCN(C)C)cc1	ZINC000275953262	456357132	/nfs/dbraw/zinc/35/71/32/456357132.db2.gz	ZFFMCTFNMTVCIJ-XSFVSMFZSA-N	0	3	325.412	3.023	20	30		EGEDHN
C[C@](C#N)(NC(=O)CN[C@@H](Cc1ccccc1)c1ccccc1)C1CC1	ZINC000302589962	456362872	/nfs/dbraw/zinc/36/28/72/456362872.db2.gz	JGWHDLGUJMWNCS-RBBKRZOGSA-N	0	3	347.462	3.368	20	30		EGEDHN
Cc1cc(CN(C)C)cc(NC(=O)c2c(F)cc(C#N)cc2F)c1	ZINC000340333988	456396835	/nfs/dbraw/zinc/39/68/35/456396835.db2.gz	FJAYARJRYSCODO-UHFFFAOYSA-N	0	3	329.350	3.459	20	30		EGEDHN
C=CCCc1ccccc1NC(=O)NC[C@H](O)CN1CCC(C)CC1	ZINC000337608555	456420702	/nfs/dbraw/zinc/42/07/02/456420702.db2.gz	RVMCKSWJXJYWCP-SFHVURJKSA-N	0	3	345.487	3.020	20	30		EGEDHN
COc1cc(CN(C)[C@H](C)c2ccc(-n3cncn3)cc2)ccc1C#N	ZINC000282347909	456485594	/nfs/dbraw/zinc/48/55/94/456485594.db2.gz	PDTXXCSQLCWGDZ-OAHLLOKOSA-N	0	3	347.422	3.341	20	30		EGEDHN
C[C@H](NC(=O)C(C#N)Cc1ccc(C#N)cc1)c1ccc(F)cc1F	ZINC000348009353	456436511	/nfs/dbraw/zinc/43/65/11/456436511.db2.gz	YSXSOAOURXBANA-WFASDCNBSA-N	0	3	339.345	3.396	20	30		EGEDHN
COc1cccc(CN(CCN(C)C)c2nccc(C#N)c2Cl)c1	ZINC000343225295	456464806	/nfs/dbraw/zinc/46/48/06/456464806.db2.gz	IJWFSXLEUZMAQQ-UHFFFAOYSA-N	0	3	344.846	3.183	20	30		EGEDHN
CN1CC=C(CNC(=O)Nc2cccc(C#Cc3ccccc3)c2)CC1	ZINC000343302555	456518318	/nfs/dbraw/zinc/51/83/18/456518318.db2.gz	NBIGYFDEHFHIIZ-UHFFFAOYSA-N	0	3	345.446	3.470	20	30		EGEDHN
COCC[C@H](N[C@H](C)C(=O)N(CCC#N)c1ccccc1)C(C)(C)C	ZINC000337857502	456573063	/nfs/dbraw/zinc/57/30/63/456573063.db2.gz	LZDWYQPYATYMEW-AEFFLSMTSA-N	0	3	345.487	3.363	20	30		EGEDHN
COc1cccc2c1CC[C@H]2NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000348344163	456636605	/nfs/dbraw/zinc/63/66/05/456636605.db2.gz	QHPIOBBBSZVVJB-QFBILLFUSA-N	0	3	345.402	3.053	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@@H](NCc1ccc(CN3CCCC3=O)cc1)CC2	ZINC000353381066	456662116	/nfs/dbraw/zinc/66/21/16/456662116.db2.gz	DHMGDEQPSJMYPJ-NRFANRHFSA-N	0	3	345.446	3.458	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CCN(C(=O)C2(C#N)CCCC2)C1	ZINC000324188935	456662303	/nfs/dbraw/zinc/66/23/03/456662303.db2.gz	UHBZNIZGUMDSOP-KRWDZBQOSA-N	0	3	325.456	3.051	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@H](NCc1ccccc1CN1CCOCC1)CC2	ZINC000353413881	456686568	/nfs/dbraw/zinc/68/65/68/456686568.db2.gz	RFWNEABXLZIVGW-JOCHJYFZSA-N	0	3	347.462	3.168	20	30		EGEDHN
C#CCOc1ccc(CN[C@H]2CCN(C(=O)Nc3ccccc3)C2)cc1	ZINC000283073622	456704681	/nfs/dbraw/zinc/70/46/81/456704681.db2.gz	UZOQYEDKAWGADN-IBGZPJMESA-N	0	3	349.434	3.095	20	30		EGEDHN
C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NCc1ccccc1C#N	ZINC000277251978	456745801	/nfs/dbraw/zinc/74/58/01/456745801.db2.gz	AEOHEJRQBVRWAK-YOEHRIQHSA-N	0	3	329.444	3.293	20	30		EGEDHN
N#Cc1ccc(NC(=O)N[C@H]2CCN(Cc3ccccc3)C2)cc1F	ZINC000353542886	456746735	/nfs/dbraw/zinc/74/67/35/456746735.db2.gz	WLOWUIHMSXQTPF-KRWDZBQOSA-N	0	3	338.386	3.093	20	30		EGEDHN
C=CCSCCNC(=O)NC[C@H](CC)N1CCc2ccccc2C1	ZINC000338304604	456762048	/nfs/dbraw/zinc/76/20/48/456762048.db2.gz	PGMGTMNHEABHMV-SFHVURJKSA-N	0	3	347.528	3.042	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cnn(C)c2C2CC2)C1	ZINC000328894503	456786033	/nfs/dbraw/zinc/78/60/33/456786033.db2.gz	UWOFFSKXAPOAOA-RHSMWYFYSA-N	0	3	338.455	3.438	20	30		EGEDHN
C[C@H](NC(=O)C(C#N)CCc1ccccc1)c1c(F)cncc1F	ZINC000344148087	456800528	/nfs/dbraw/zinc/80/05/28/456800528.db2.gz	FEYZGDTZYMBIET-JSGCOSHPSA-N	0	3	329.350	3.310	20	30		EGEDHN
CN(C)Cc1ccc(CNC(=O)c2cc(C#N)ccc2Cl)cc1	ZINC000348649196	456800791	/nfs/dbraw/zinc/80/07/91/456800791.db2.gz	AHHLZWOTDOTIID-UHFFFAOYSA-N	0	3	327.815	3.203	20	30		EGEDHN
Cc1ncoc1C(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1	ZINC000328974828	456804955	/nfs/dbraw/zinc/80/49/55/456804955.db2.gz	BDTDYHAHEQSOCA-UHFFFAOYSA-N	0	3	328.416	3.150	20	30		EGEDHN
COc1ccc([C@H](C)N[C@@H](C)C(=O)NC2(C#N)CCCCC2)cc1	ZINC000341231296	456824327	/nfs/dbraw/zinc/82/43/27/456824327.db2.gz	VMALJYQMKOWNJP-GJZGRUSLSA-N	0	3	329.444	3.077	20	30		EGEDHN
C=C(CNC(=O)N1CCN(C2CCC2)C[C@H](C)C1)c1ccccc1	ZINC000292049529	456840488	/nfs/dbraw/zinc/84/04/88/456840488.db2.gz	NMDAVJCFGSXTRU-INIZCTEOSA-N	0	3	327.472	3.216	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)NCC#Cc2ccccc2)CN1Cc1ccccc1	ZINC000341318480	456844762	/nfs/dbraw/zinc/84/47/62/456844762.db2.gz	FWZRXDJLQALJMA-WIYYLYMNSA-N	0	3	347.462	3.000	20	30		EGEDHN
C[C@H]1CCN(CC(=O)NCc2ccc3c(c2)OCO3)CC12CCC2	ZINC000329161710	456845195	/nfs/dbraw/zinc/84/51/95/456845195.db2.gz	ZEAWXLWCLXJWBY-AWEZNQCLSA-N	0	3	330.428	3.384	20	30		EGEDHN
CC1(C)CN(C2(CNC(=O)C[C@@H]3CCCO3)CCCCC2)CCO1	ZINC000329378712	456881106	/nfs/dbraw/zinc/88/11/06/456881106.db2.gz	MREMKRPNSGRVMK-INIZCTEOSA-N	0	3	338.492	3.326	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccc(N3CCC(C)CC3)nc2)nc(C)n1	ZINC000329524537	456904135	/nfs/dbraw/zinc/90/41/35/456904135.db2.gz	QMFTZIRPIRGMHX-QGZVFWFLSA-N	0	3	349.438	3.215	20	30		EGEDHN
CCSc1ccc([C@H](C)N[C@H](C)C(=O)NC2(C#N)CCC2)cc1	ZINC000345110332	456929406	/nfs/dbraw/zinc/92/94/06/456929406.db2.gz	IDLUOCHURMEEKD-UONOGXRCSA-N	0	3	331.485	3.400	20	30		EGEDHN
CCc1nccn1[C@@H]1CCCN(C([O-])=[NH+]C[C@H]2CCCCS2)C1	ZINC000329765343	456937459	/nfs/dbraw/zinc/93/74/59/456937459.db2.gz	WWQWXQXYPMRMFQ-HUUCEWRRSA-N	0	3	336.505	3.282	20	30		EGEDHN
CC1(C)CN(CCC(=O)Nc2cccc(C#N)c2)[C@@H]1[C@H]1CCCO1	ZINC000329791278	456941091	/nfs/dbraw/zinc/94/10/91/456941091.db2.gz	UKKDZUXHRKHUJE-SJLPKXTDSA-N	0	3	327.428	3.426	20	30		EGEDHN
CN1C[C@H](NC(=O)c2cc(=O)[nH]c(C3CC3)c2)[C@@H](c2ccccc2)C1	ZINC000329959659	456967347	/nfs/dbraw/zinc/96/73/47/456967347.db2.gz	NJBYWJOWAYCHRW-AEFFLSMTSA-N	0	3	337.423	3.067	20	30		EGEDHN
C=C[C@H](CC(=O)Nc1ccnc(OCCN(C)C)c1)c1ccccc1	ZINC000345300000	456973485	/nfs/dbraw/zinc/97/34/85/456973485.db2.gz	KWLIBSYAYHZSTH-MRXNPFEDSA-N	0	3	339.439	3.320	20	30		EGEDHN
C=CC[C@@H](CO)CN[C@H]1CCCOc2c(Br)cccc21	ZINC000341891581	456989115	/nfs/dbraw/zinc/98/91/15/456989115.db2.gz	VGJUGVGJAPNXMG-DOMZBBRYSA-N	0	3	340.261	3.437	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1C(=O)NC[C@@H]1CCCN(Cc2cccs2)C1	ZINC000345749161	456991142	/nfs/dbraw/zinc/99/11/42/456991142.db2.gz	AADCHIGHVDEHGN-JQHSSLGASA-N	0	3	348.512	3.058	20	30		EGEDHN
CN1CCC(NC(=O)c2cnn(C(C)(C)C)c2C(F)(F)F)CC1	ZINC000330538301	457054845	/nfs/dbraw/zinc/05/48/45/457054845.db2.gz	UFVRGSIORIMDIC-UHFFFAOYSA-N	0	3	332.370	3.056	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2cccc(C(=O)OC(C)(C)C)c2)CCN1C	ZINC000330596585	457059515	/nfs/dbraw/zinc/05/95/15/457059515.db2.gz	DAODZXKNOPIWJQ-CJNGLKHVSA-N	0	3	332.444	3.429	20	30		EGEDHN
CC1(C(=O)N2CCC(F)(C#N)CC2)CCN(Cc2ccccc2)CC1	ZINC000359363467	457076324	/nfs/dbraw/zinc/07/63/24/457076324.db2.gz	QNSANBJBODDZFL-UHFFFAOYSA-N	0	3	343.446	3.143	20	30		EGEDHN
CC[C@H](C)N[C@H](CNC(=O)c1cccc(CC#N)c1)c1ccco1	ZINC000359553392	457095399	/nfs/dbraw/zinc/09/53/99/457095399.db2.gz	HOCPCABFWCTGKF-WMLDXEAASA-N	0	3	325.412	3.205	20	30		EGEDHN
CN(CCN1CCCC1)c1c(C#N)cnc2c(F)c(F)c(F)cc21	ZINC000342083362	457098344	/nfs/dbraw/zinc/09/83/44/457098344.db2.gz	ZLYBGXXBRUAIRE-UHFFFAOYSA-N	0	3	334.345	3.056	20	30		EGEDHN
CNC(=O)c1cccc(NC(=O)N(C)[C@H](C)C2CCN(C)CC2)c1C	ZINC000330870491	457098365	/nfs/dbraw/zinc/09/83/65/457098365.db2.gz	BNHNRYAMGDXQKH-CQSZACIVSA-N	0	3	346.475	3.137	20	30		EGEDHN
CCN(Cc1ccc(C(=O)Nc2n[nH]c(C3CC3)c2C#N)cc1)C1CC1	ZINC000359714249	457125004	/nfs/dbraw/zinc/12/50/04/457125004.db2.gz	GXNAPXYXIFVOGL-UHFFFAOYSA-N	0	3	349.438	3.395	20	30		EGEDHN
COc1cc(CNCC2(CC#N)CC2)cc(OC)c1OCC(F)F	ZINC000342172757	457149358	/nfs/dbraw/zinc/14/93/58/457149358.db2.gz	UHUDWTWHPZWEMR-UHFFFAOYSA-N	0	3	340.370	3.131	20	30		EGEDHN
CC(C)Cc1ccc([C@H](CNC(=O)c2ccc(C#N)[nH]2)N(C)C)cc1	ZINC000359929638	457153924	/nfs/dbraw/zinc/15/39/24/457153924.db2.gz	KKIDDFYAXQCNHE-IBGZPJMESA-N	0	3	338.455	3.118	20	30		EGEDHN
C=C(CN[C@@H](C)c1ccc(NS(C)(=O)=O)cc1)c1ccccc1	ZINC000346778067	457164874	/nfs/dbraw/zinc/16/48/74/457164874.db2.gz	LTWLALLSARMZHX-HNNXBMFYSA-N	0	3	330.453	3.422	20	30		EGEDHN
CC(C#N)C(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1	ZINC000356891061	457200397	/nfs/dbraw/zinc/20/03/97/457200397.db2.gz	HBUKGDBRKXKRHA-XHDPSFHLSA-N	0	3	340.345	3.449	20	30		EGEDHN
CC(C#N)C(=O)N[C@@H](c1cccc(C(F)(F)F)c1)C1CCOCC1	ZINC000356891059	457200450	/nfs/dbraw/zinc/20/04/50/457200450.db2.gz	HBUKGDBRKXKRHA-IAQYHMDHSA-N	0	3	340.345	3.449	20	30		EGEDHN
C[C@H](C(=O)N(C)CCC#N)N1CCC[C@H](c2ccc(F)cc2)CC1	ZINC000351198685	457239268	/nfs/dbraw/zinc/23/92/68/457239268.db2.gz	GRPUCSBTXLONES-CVEARBPZSA-N	0	3	331.435	3.156	20	30		EGEDHN
N#CC(C(=O)c1ccc(NC(=O)c2cccs2)cc1)c1ccncn1	ZINC000354469619	457243390	/nfs/dbraw/zinc/24/33/90/457243390.db2.gz	RJHQPFVWNUABCP-AWEZNQCLSA-N	0	3	348.387	3.280	20	30		EGEDHN
N#CC(C(=O)c1ccc(C(=O)Nc2ccccc2)cc1)c1ccncn1	ZINC000354479618	457249495	/nfs/dbraw/zinc/24/94/95/457249495.db2.gz	WHVNLELQMUMQTL-KRWDZBQOSA-N	0	3	342.358	3.219	20	30		EGEDHN
C=C(C)[C@@H](NC(=O)N[C@H]1CCN(C2CC2)C1)c1ccc(F)c(F)c1	ZINC000357066562	457306450	/nfs/dbraw/zinc/30/64/50/457306450.db2.gz	CJMOZUBSLPHMGI-SUMWQHHRSA-N	0	3	335.398	3.118	20	30		EGEDHN
C=C(C)COc1cc(CN2CC[C@H](C(=O)OC)[C@H]2C)ccc1OC	ZINC000347258336	457316719	/nfs/dbraw/zinc/31/67/19/457316719.db2.gz	BIEGDUSBUSJXJR-ZBFHGGJFSA-N	0	3	333.428	3.034	20	30		EGEDHN
C=CCN(CCc1c(C)nc2sccn2c1=O)Cc1cccs1	ZINC000352096374	457337549	/nfs/dbraw/zinc/33/75/49/457337549.db2.gz	FEIJUNBZTCCURM-UHFFFAOYSA-N	0	3	345.493	3.357	20	30		EGEDHN
N#CC(C(=O)c1ccc2nc(C(F)(F)F)cn2c1)c1ccccn1	ZINC000352308811	457354703	/nfs/dbraw/zinc/35/47/03/457354703.db2.gz	LRUAJQQJDCOQSJ-NSHDSACASA-N	0	3	330.269	3.238	20	30		EGEDHN
Cc1ccccc1[C@@H]([C@H](C)NC(=O)N1CCC(F)(C#N)CC1)N(C)C	ZINC000357280606	457418127	/nfs/dbraw/zinc/41/81/27/457418127.db2.gz	HVCBOJSYFOOGIX-DOTOQJQBSA-N	0	3	346.450	3.024	20	30		EGEDHN
C[C@H](NC(=O)NCCN(C)C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000363721989	457429899	/nfs/dbraw/zinc/42/98/99/457429899.db2.gz	WOTXFZHFBYKEGD-HNNXBMFYSA-N	0	3	336.439	3.147	20	30		EGEDHN
Cc1cc(NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)c(C#N)cn1	ZINC000425271516	457477981	/nfs/dbraw/zinc/47/79/81/457477981.db2.gz	VDOSOXXOPBMTDZ-HXUWFJFHSA-N	0	3	338.455	3.186	20	30		EGEDHN
COC[C@H]1CCCCN([C@@H](C)C(=O)N(C)C2(C#N)CCC(C)CC2)C1	ZINC000342740482	457490964	/nfs/dbraw/zinc/49/09/64/457490964.db2.gz	KSMOERKKMDEZIH-NRGCRIOASA-N	0	3	349.519	3.054	20	30		EGEDHN
COCCOCc1ccc(CN[C@H]2CCc3ccc(C#N)cc32)cc1	ZINC000361005845	457505520	/nfs/dbraw/zinc/50/55/20/457505520.db2.gz	XQHPENJLOBZKNL-NRFANRHFSA-N	0	3	336.435	3.498	20	30		EGEDHN
CC(C#N)C(=O)N(Cc1nnc(-c2ccc(Cl)cc2)o1)C1CC1	ZINC000347562566	457509429	/nfs/dbraw/zinc/50/94/29/457509429.db2.gz	MSOBFISXVCGOAV-SNVBAGLBSA-N	0	3	330.775	3.041	20	30		EGEDHN
C[C@@H]1[C@@H](c2ccccc2)CCN1CC(=O)NCc1ccc(C#N)cc1	ZINC000374202097	457521534	/nfs/dbraw/zinc/52/15/34/457521534.db2.gz	ZBWGRXVSJIHRCP-UZLBHIALSA-N	0	3	333.435	3.052	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](O)COCc2ccc(Cl)cc2)cc1F	ZINC000404160473	457539093	/nfs/dbraw/zinc/53/90/93/457539093.db2.gz	QFTRFMXDJAFSNP-QGZVFWFLSA-N	0	3	348.805	3.018	20	30		EGEDHN
COCC1(C#N)CCN(Cc2ccc(C)cc2-c2cnn(C)c2)CC1	ZINC000342823810	457544086	/nfs/dbraw/zinc/54/40/86/457544086.db2.gz	XHXQEGTVXSRNHW-UHFFFAOYSA-N	0	3	338.455	3.148	20	30		EGEDHN
C[C@]1(CNC(=O)c2ccc(CC#N)cc2)CCN(Cc2ccccc2)C1	ZINC000374252638	457545375	/nfs/dbraw/zinc/54/53/75/457545375.db2.gz	YSYRDNZHWZVOQB-JOCHJYFZSA-N	0	3	347.462	3.395	20	30		EGEDHN
C=CCOc1cccc(CN2CCC[C@H]2C[C@@H](O)c2cnn(C)c2)c1	ZINC000374254939	457547180	/nfs/dbraw/zinc/54/71/80/457547180.db2.gz	HCQHHYSADJINSQ-AZUAARDMSA-N	0	3	341.455	3.073	20	30		EGEDHN
N#Cc1ccccc1OCCN1CCC(CCCn2ccnc2)CC1	ZINC000361058344	457552982	/nfs/dbraw/zinc/55/29/82/457552982.db2.gz	BWKDFJOJQXFSCS-UHFFFAOYSA-N	0	3	338.455	3.326	20	30		EGEDHN
C[C@@H](CNC(=O)N(C)[C@@H](C)c1cccc(C#N)c1)N1CCC(C)CC1	ZINC000425471302	457568096	/nfs/dbraw/zinc/56/80/96/457568096.db2.gz	HVZJCWGIWSEKME-IRXDYDNUSA-N	0	3	342.487	3.381	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN(Cc1cccnc1)C(C)C	ZINC000357615584	457622970	/nfs/dbraw/zinc/62/29/70/457622970.db2.gz	CPDSSALPKLMCAG-FQEVSTJZSA-N	0	3	340.467	3.460	20	30		EGEDHN
FC(F)(F)Oc1ccc(C#CCN[C@H]2CCO[C@H]2C2CC2)cc1	ZINC000364779146	457691864	/nfs/dbraw/zinc/69/18/64/457691864.db2.gz	FQIAGRHFVULNOH-HOTGVXAUSA-N	0	3	325.330	3.094	20	30		EGEDHN
Cc1ccccc1[C@@H]([C@H](C)NC(=O)c1ccc(CC#N)cc1)N(C)C	ZINC000357875072	457720556	/nfs/dbraw/zinc/72/05/56/457720556.db2.gz	RNQKIFNJKNBMMI-OXJNMPFZSA-N	0	3	335.451	3.482	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CCC[C@@H]1CSC)C(C)C	ZINC000426027010	457762703	/nfs/dbraw/zinc/76/27/03/457762703.db2.gz	FDVISKVLHYTYHE-IAGOWNOFSA-N	0	3	339.549	3.222	20	30		EGEDHN
C[C@H](CNc1ccc(C(F)(F)F)c(C#N)n1)N(C)Cc1ccccc1	ZINC000443509855	457772241	/nfs/dbraw/zinc/77/22/41/457772241.db2.gz	KQRFOHQYFIBVQU-CYBMUJFWSA-N	0	3	348.372	3.326	20	30		EGEDHN
N#C[C@@H](c1cccc(Cl)c1)N1CCN(CCC2CCOCC2)CC1	ZINC000433194287	457775114	/nfs/dbraw/zinc/77/51/14/457775114.db2.gz	VOZCNGFKJVSCSB-IBGZPJMESA-N	0	3	347.890	3.339	20	30		EGEDHN
C=C[C@@H]1CCCCN1C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C	ZINC000426243183	457795091	/nfs/dbraw/zinc/79/50/91/457795091.db2.gz	ZOTBTZMURWRYSG-QRQLOZEOSA-N	0	3	327.472	3.257	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCCOc1ccc(F)c(F)c1	ZINC000433342597	457815243	/nfs/dbraw/zinc/81/52/43/457815243.db2.gz	LRQYZFPYDCKIBL-HNNXBMFYSA-N	0	3	344.361	3.232	20	30		EGEDHN
CN(C)[C@H](CC(=O)N(CCC#N)Cc1ccco1)c1ccccc1	ZINC000433343826	457815399	/nfs/dbraw/zinc/81/53/99/457815399.db2.gz	PKHSYUAQBCWRJE-GOSISDBHSA-N	0	3	325.412	3.215	20	30		EGEDHN
CC(C)(C#N)c1ccc(C(=O)C(C#N)c2nnc3n2CCCCC3)cc1	ZINC000361676408	457817268	/nfs/dbraw/zinc/81/72/68/457817268.db2.gz	XRHXICVQSJDKAF-MRXNPFEDSA-N	0	3	347.422	3.296	20	30		EGEDHN
CN(CC(C)(C)C#N)C(=O)N[C@H](CN1CCCC1)c1ccccc1	ZINC000457765261	457821135	/nfs/dbraw/zinc/82/11/35/457821135.db2.gz	XKRFMCUJCKCWGN-QGZVFWFLSA-N	0	3	328.460	3.015	20	30		EGEDHN
N#Cc1ccc(OCCN[C@@H](Cc2ccccn2)c2cccnc2)cc1	ZINC000358211912	457863177	/nfs/dbraw/zinc/86/31/77/457863177.db2.gz	ZXYIAKYLYMESPZ-NRFANRHFSA-N	0	3	344.418	3.301	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1noc2c1C[C@H](C)CC2)C(C)C	ZINC000433791367	457886982	/nfs/dbraw/zinc/88/69/82/457886982.db2.gz	CMSHGIJBEHTRDL-NVXWUHKLSA-N	0	3	345.487	3.228	20	30		EGEDHN
C=CCN(C)CCN(CC)Cc1nnc(-c2cccc(Cl)c2)o1	ZINC000411644127	457938438	/nfs/dbraw/zinc/93/84/38/457938438.db2.gz	QJBHBTCMXWFJSX-UHFFFAOYSA-N	0	3	334.851	3.330	20	30		EGEDHN
C=CCn1cccc1C(=O)Nc1ccc(OCCN(C)C)c(C)c1	ZINC000458223437	457976705	/nfs/dbraw/zinc/97/67/05/457976705.db2.gz	WHOWSCNAODKNMH-UHFFFAOYSA-N	0	3	327.428	3.175	20	30		EGEDHN
CCC(C)(C)N(C)CC(=O)Nc1c(C#N)c(C)c(C)n1CCCOC	ZINC000358423960	457995059	/nfs/dbraw/zinc/99/50/59/457995059.db2.gz	HMFKBEYXZORGCD-UHFFFAOYSA-N	0	3	348.491	3.072	20	30		EGEDHN
C=CCCCNC(=O)N1C[C@H]2CCN(Cc3ccccc3)C[C@H]2C1	ZINC000367906944	457995826	/nfs/dbraw/zinc/99/58/26/457995826.db2.gz	LZWNMQSLHOJNEE-MOPGFXCFSA-N	0	3	327.472	3.116	20	30		EGEDHN
C=C[C@H]1CCCCN1C(=O)c1ccc(CN2CCC(CO)CC2)cc1	ZINC000428033033	458069507	/nfs/dbraw/zinc/06/95/07/458069507.db2.gz	AIWBNDOHDFLDGU-FQEVSTJZSA-N	0	3	342.483	3.072	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)N(C)CC(C)(C)C#N)CCN1Cc1ccccc1	ZINC000458498068	458071450	/nfs/dbraw/zinc/07/14/50/458071450.db2.gz	OHIYPTPCOHJCSW-WMZOPIPTSA-N	0	3	342.487	3.231	20	30		EGEDHN
C[C@@H]1CCN(Cc2cn(CCC#N)nc2-c2ccncc2)CCS1	ZINC000434988462	458076567	/nfs/dbraw/zinc/07/65/67/458076567.db2.gz	SIUWOVXLBDYSMY-OAHLLOKOSA-N	0	3	341.484	3.186	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)NCC(C)(C)CC#N	ZINC000458520923	458079344	/nfs/dbraw/zinc/07/93/44/458079344.db2.gz	WYEXZYADAZVMER-AEFFLSMTSA-N	0	3	342.487	3.136	20	30		EGEDHN
C=C(C)CNC(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1	ZINC000428108240	458081386	/nfs/dbraw/zinc/08/13/86/458081386.db2.gz	QPRCZPMVKZVLKU-MRXNPFEDSA-N	0	3	326.362	3.133	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H](CNC(=O)NCC(C)(C)CC#N)C1CC1	ZINC000458683530	458134428	/nfs/dbraw/zinc/13/44/28/458134428.db2.gz	TVIYEHLEVZVJBQ-SFHVURJKSA-N	0	3	342.487	3.136	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1)C(=O)NCC(C)(C)CCC#N	ZINC000358681931	458148879	/nfs/dbraw/zinc/14/88/79/458148879.db2.gz	IKMBMGJJWRVRPA-UHFFFAOYSA-N	0	3	330.476	3.090	20	30		EGEDHN
C#CCOc1ccc([C@@H](C)NCc2cccc(-n3cncn3)c2)cc1	ZINC000372046377	458173031	/nfs/dbraw/zinc/17/30/31/458173031.db2.gz	NXLIPSNTRNZHAG-MRXNPFEDSA-N	0	3	332.407	3.130	20	30		EGEDHN
C[C@@H]1CCN(C)CCN1C(=O)N[C@@H](CCCC#N)c1ccccc1	ZINC000458809051	458179324	/nfs/dbraw/zinc/17/93/24/458179324.db2.gz	ZUIDYDDTSUFROT-AEFFLSMTSA-N	0	3	328.460	3.157	20	30		EGEDHN
C=CCC(C)(C)CNC(=O)N(CCN(C)C)Cc1cccc(OC)c1	ZINC000458814412	458182260	/nfs/dbraw/zinc/18/22/60/458182260.db2.gz	UOPPZQFXPALFAI-UHFFFAOYSA-N	0	3	347.503	3.371	20	30		EGEDHN
Cc1cc(C#N)ccc1Oc1ccc(C(=O)NC[C@@H](C)N(C)C)cc1	ZINC000362466467	458198741	/nfs/dbraw/zinc/19/87/41/458198741.db2.gz	RFHAKNCSGBXGBW-OAHLLOKOSA-N	0	3	337.423	3.339	20	30		EGEDHN
Cc1cc(N(CCC#N)C(=O)CSCCN(C)C)ccc1Cl	ZINC000446572732	458199034	/nfs/dbraw/zinc/19/90/34/458199034.db2.gz	RODNXESMPRMOAC-UHFFFAOYSA-N	0	3	339.892	3.190	20	30		EGEDHN
CN(Cc1ccccc1)C1(CNC(=O)NCC(C)(C)CC#N)CCC1	ZINC000458978374	458234049	/nfs/dbraw/zinc/23/40/49/458234049.db2.gz	QGHUGPWJBVUVBR-UHFFFAOYSA-N	0	3	342.487	3.280	20	30		EGEDHN
COC(=O)[C@@](C)(CNCc1ccc(C#N)c(C)c1)c1ccc(F)cc1	ZINC000447061309	458260150	/nfs/dbraw/zinc/26/01/50/458260150.db2.gz	RREJGACMSHHDQK-FQEVSTJZSA-N	0	3	340.398	3.226	20	30		EGEDHN
C[C@H]1CN(CCC(=O)Nc2cccc(C#N)c2)Cc2ccccc2O1	ZINC000429147783	458282118	/nfs/dbraw/zinc/28/21/18/458282118.db2.gz	BKPGWLONRSOKLR-HNNXBMFYSA-N	0	3	335.407	3.170	20	30		EGEDHN
COc1ccc2c(c1)OC[C@H](NCc1ccc(O[C@@H](C)C#N)cc1)C2	ZINC000372428406	458302595	/nfs/dbraw/zinc/30/25/95/458302595.db2.gz	OGJGJBAVSXMZLX-WMLDXEAASA-N	0	3	338.407	3.079	20	30		EGEDHN
C=CCN(C)CCN(CC)CC(=O)Nc1ccc(Cl)cc1Cl	ZINC000429725471	458364215	/nfs/dbraw/zinc/36/42/15/458364215.db2.gz	SAATWHCGZKXRKS-UHFFFAOYSA-N	0	3	344.286	3.372	20	30		EGEDHN
CC(C)c1ccc([C@@H](N)CNC(=O)NCc2ccc(C#N)cc2)cc1	ZINC000417716120	458367668	/nfs/dbraw/zinc/36/76/68/458367668.db2.gz	FKVGZUXGXHWFRN-IBGZPJMESA-N	0	3	336.439	3.181	20	30		EGEDHN
C[C@@H](CCCCN1C(=O)c2ccccc2C1=O)NCC1(C#N)CCC1	ZINC000418137117	458371299	/nfs/dbraw/zinc/37/12/99/458371299.db2.gz	DDBBLPJMOABGLN-HNNXBMFYSA-N	0	3	339.439	3.125	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H]2CCN(CC(F)F)C2)cc1Cl	ZINC000418139882	458373086	/nfs/dbraw/zinc/37/30/86/458373086.db2.gz	UXAFCXMEIVFWSZ-CYBMUJFWSA-N	0	3	330.806	3.334	20	30		EGEDHN
CC(C)N1CCCN(C(=O)N[C@H]2CCCc3cc(C#N)ccc32)CC1	ZINC000419652796	458391021	/nfs/dbraw/zinc/39/10/21/458391021.db2.gz	VQMBEOOMSKMUCK-IBGZPJMESA-N	0	3	340.471	3.061	20	30		EGEDHN
CN(C[C@@H]1CCCN1C)c1c(C#N)cnc2ccc(OC(F)F)cc21	ZINC000420631962	458399666	/nfs/dbraw/zinc/39/96/66/458399666.db2.gz	HETPIXVLBLBISH-ZDUSSCGKSA-N	0	3	346.381	3.238	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)CN1CC[C@H](c2ccccc2)C1(C)C	ZINC000421010937	458405887	/nfs/dbraw/zinc/40/58/87/458405887.db2.gz	CZUISYHBARMOPJ-XLIONFOSSA-N	0	3	327.472	3.309	20	30		EGEDHN
CC(C)(C)O[C@@H]1C[C@@H](NCc2ccc(C#N)c(F)c2)[C@H]1n1cccn1	ZINC000421374199	458412806	/nfs/dbraw/zinc/41/28/06/458412806.db2.gz	BHROPADFSHXWMR-KZNAEPCWSA-N	0	3	342.418	3.181	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Cc1ccc2c(c1)NCC2)C(C)C	ZINC000449091954	458420685	/nfs/dbraw/zinc/42/06/85/458420685.db2.gz	RXZMMSZTVDKTCM-HXUWFJFHSA-N	0	3	341.499	3.012	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCc1cnn(-c2ccc(C(F)(F)F)cc2)c1	ZINC000449516615	458425993	/nfs/dbraw/zinc/42/59/93/458425993.db2.gz	BINZQXGUZSWCIS-CVEARBPZSA-N	0	3	337.345	3.324	20	30		EGEDHN
CN(CCN1CCC[C@]2(CCCCO2)[C@H]1C#N)Cc1ccccc1	ZINC000450883148	458459812	/nfs/dbraw/zinc/45/98/12/458459812.db2.gz	PCPLCGVHJFWMNE-WOJBJXKFSA-N	0	3	327.472	3.046	20	30		EGEDHN
C[C@@H](N[C@H](c1ccc(F)c(Cl)c1)C1CC1)C(=O)N(C)CCC#N	ZINC000451351135	458475281	/nfs/dbraw/zinc/47/52/81/458475281.db2.gz	FBHSFNWAXIAGMA-BZNIZROVSA-N	0	3	337.826	3.280	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2[C@H]3CCO[C@@H]3C23CCC3)c(OC(F)F)c1	ZINC000451506679	458479869	/nfs/dbraw/zinc/47/98/69/458479869.db2.gz	UZRLXFGCAUHZRX-BMFZPTHFSA-N	0	3	334.366	3.207	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@H](C)NC1(Cc2ccccc2)CCOCC1	ZINC000451938107	458491453	/nfs/dbraw/zinc/49/14/53/458491453.db2.gz	IDIHDRLBDOTWQD-SFHVURJKSA-N	0	3	344.499	3.181	20	30		EGEDHN
COc1ccc(C#N)cc1CN1CCN(C2CCC(C)CC2)CC1	ZINC000437862056	458504309	/nfs/dbraw/zinc/50/43/09/458504309.db2.gz	DEZMBMKFIGKPLB-UHFFFAOYSA-N	0	3	327.472	3.263	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1C(=O)NCC1(N(C)Cc2ccccc2)CCC1	ZINC000452728124	458508118	/nfs/dbraw/zinc/50/81/18/458508118.db2.gz	HXTALENSOVRGDE-RTBURBONSA-N	0	3	342.483	3.139	20	30		EGEDHN
CC(C)C[C@@H](CN1CCCC1)NC(=O)[C@@H](C#N)CCc1ccccc1	ZINC000452774251	458509720	/nfs/dbraw/zinc/50/97/20/458509720.db2.gz	MRFXKBQZETUZSJ-UXHICEINSA-N	0	3	341.499	3.386	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)Nc2cccc(C#Cc3ccccn3)c2)CCN1C	ZINC000438071198	458528157	/nfs/dbraw/zinc/52/81/57/458528157.db2.gz	HQDRJYOGTTYGRJ-OXJNMPFZSA-N	0	3	348.450	3.086	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1cccc(COC2CCCCC2)c1	ZINC000424102191	458558750	/nfs/dbraw/zinc/55/87/50/458558750.db2.gz	AOVGZRUTIBPEQN-GOSISDBHSA-N	0	3	329.444	3.496	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC[C@H]2CSc3ccccc32)CC1	ZINC000454460370	458562445	/nfs/dbraw/zinc/56/24/45/458562445.db2.gz	IIVWEWMKOONNNK-HNNXBMFYSA-N	0	3	345.512	3.216	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCC[C@H]2CCc3ccccc32)CC1	ZINC000454555529	458565978	/nfs/dbraw/zinc/56/59/78/458565978.db2.gz	YEZJYNYZLNFFGI-QGZVFWFLSA-N	0	3	327.472	3.056	20	30		EGEDHN
CC(C)n1nc(-c2ccccc2)cc1NC(=O)[C@@H](N)CCCC#N	ZINC000424136618	458568043	/nfs/dbraw/zinc/56/80/43/458568043.db2.gz	NWXADPAWDYEIKZ-HNNXBMFYSA-N	0	3	325.416	3.091	20	30		EGEDHN
CC[C@H](Cc1ccc(Cl)cc1Cl)NC(=O)[C@H](N)CCCC#N	ZINC000424145281	458569963	/nfs/dbraw/zinc/56/99/63/458569963.db2.gz	UPVJMAHLVBSTRC-UKRRQHHQSA-N	0	3	342.270	3.452	20	30		EGEDHN
C[C@H](CNC(=O)C(C)(C)Cc1ccc(C#N)cc1)N1CCC[C@@H](C)C1	ZINC000454726591	458573360	/nfs/dbraw/zinc/57/33/60/458573360.db2.gz	BPYCJTOXBXRUGW-IAGOWNOFSA-N	0	3	341.499	3.364	20	30		EGEDHN
CC(C)N1CCCN(C(=O)C(C)(C)Cc2ccc(C#N)cc2)CC1	ZINC000455389678	458596671	/nfs/dbraw/zinc/59/66/71/458596671.db2.gz	LDICFHAJMOOYAY-UHFFFAOYSA-N	0	3	327.472	3.070	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cc(C)cnc2OC(C)C)CC1	ZINC000455699063	458606653	/nfs/dbraw/zinc/60/66/53/458606653.db2.gz	LRUPECNKHCGMDI-UHFFFAOYSA-N	0	3	346.475	3.339	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)CCN1C	ZINC000438627414	458607542	/nfs/dbraw/zinc/60/75/42/458607542.db2.gz	AQCHEKDEEVADPY-MFKMUULPSA-N	0	3	340.349	3.181	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CCC[C@H]1c1ccc[nH]1	ZINC000438762261	458613856	/nfs/dbraw/zinc/61/38/56/458613856.db2.gz	VLUDFZVYYLJVNO-MJGOQNOKSA-N	0	3	326.440	3.320	20	30		EGEDHN
C[C@H]1CCN(CC(=O)NCc2ccc(C#N)cc2)CC12CCCCC2	ZINC000462453937	458622674	/nfs/dbraw/zinc/62/26/74/458622674.db2.gz	HMBUZQVPHHVPFO-KRWDZBQOSA-N	0	3	339.483	3.467	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CCN(C(=O)c2ccc(CC#N)cc2)C1	ZINC000456317614	458637770	/nfs/dbraw/zinc/63/77/70/458637770.db2.gz	AYKADXJBLBDPJJ-GOSISDBHSA-N	0	3	347.462	3.347	20	30		EGEDHN
C=CCC(C)(C)CNC(=O)NCCCN1CCc2ccccc2C1	ZINC000432095791	458678722	/nfs/dbraw/zinc/67/87/22/458678722.db2.gz	CNCBKJKFMKKCRI-UHFFFAOYSA-N	0	3	329.488	3.336	20	30		EGEDHN
C=CCC1(C(=O)N2CCN(CC3CCCCC3)CC2)CCOCC1	ZINC000424616805	458682797	/nfs/dbraw/zinc/68/27/97/458682797.db2.gz	NDGQQQNTTMHQOZ-UHFFFAOYSA-N	0	3	334.504	3.084	20	30		EGEDHN
C[C@@H]1C[C@H](CNC(=O)OC(C)(C)C)CN1Cc1cc(C#N)cs1	ZINC000494470102	458683430	/nfs/dbraw/zinc/68/34/30/458683430.db2.gz	MNWHMOQXVSVMOJ-TZMCWYRMSA-N	0	3	335.473	3.355	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)NC[C@H](C)N1CCCC[C@H]1C	ZINC000463503759	458706579	/nfs/dbraw/zinc/70/65/79/458706579.db2.gz	YJUFTMGKWCAYPQ-CVEARBPZSA-N	0	3	346.471	3.253	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)Cc2ccccc2SC)CC1	ZINC000471840278	458739878	/nfs/dbraw/zinc/73/98/78/458739878.db2.gz	SEMSBZWHCSROMC-UHFFFAOYSA-N	0	3	333.501	3.200	20	30		EGEDHN
C=CCN(C/C=C\c1ccncc1)[C@@H](C)c1cccc(-n2cnnn2)c1	ZINC000494929676	458767981	/nfs/dbraw/zinc/76/79/81/458767981.db2.gz	JNESQHAROLIHTK-OSJSJHBBSA-N	0	3	346.438	3.320	20	30		EGEDHN
C=C[C@H](C)NC(=O)N1CC[C@@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000464751906	458768077	/nfs/dbraw/zinc/76/80/77/458768077.db2.gz	MZSXEUFMYFKYMG-PXNSSMCTSA-N	0	3	327.472	3.259	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1C(=O)N[C@@H](C)[C@@H](c1ccccc1C)N(C)C	ZINC000510516023	458775281	/nfs/dbraw/zinc/77/52/81/458775281.db2.gz	ZCIBSDDKBRADEP-WZGPROSRSA-N	0	3	330.472	3.084	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1C[C@H](c2ccccc2)[C@H]2CCC[C@@H]21	ZINC000511841537	458780512	/nfs/dbraw/zinc/78/05/12/458780512.db2.gz	HHJWBSUXFQBRON-AFYVEPGGSA-N	0	3	339.483	3.263	20	30		EGEDHN
C=C(C)CN(CCc1ccc([N+](=O)[O-])cc1)Cc1ccc(CO)o1	ZINC000512438686	458784643	/nfs/dbraw/zinc/78/46/43/458784643.db2.gz	IIKAMNWSEDIMHB-UHFFFAOYSA-N	0	3	330.384	3.301	20	30		EGEDHN
CN(C(=O)OC(C)(C)C)[C@H]1CCN(Cc2ccc(CC#N)cc2)C1	ZINC000495032220	458785743	/nfs/dbraw/zinc/78/57/43/458785743.db2.gz	QNAMWPANWODINP-KRWDZBQOSA-N	0	3	329.444	3.194	20	30		EGEDHN
C[C@H]1[C@@H](Cc2ccccc2)CCN1CC(=O)NCc1cccc(C#N)c1	ZINC000472353108	458791039	/nfs/dbraw/zinc/79/10/39/458791039.db2.gz	VWWCSFISEXWIKD-LAUBAEHRSA-N	0	3	347.462	3.128	20	30		EGEDHN
C[C@H]1C[C@@H](c2ccccc2)N(CC(=O)NCc2cccc(C#N)c2)C1	ZINC000513271452	458793510	/nfs/dbraw/zinc/79/35/10/458793510.db2.gz	KRDRCXYGEWUQGN-JXFKEZNVSA-N	0	3	333.435	3.258	20	30		EGEDHN
CC#CCN(C)C[C@H](O)CO[C@H](c1ccccc1)c1ccccc1C	ZINC000516096886	458814053	/nfs/dbraw/zinc/81/40/53/458814053.db2.gz	LZRKMYOSIWZCEA-RBBKRZOGSA-N	0	3	337.463	3.417	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cc2ccccn2c1)C(C)C	ZINC000530824622	458831196	/nfs/dbraw/zinc/83/11/96/458831196.db2.gz	WATAINBXCKIAGV-IBGZPJMESA-N	0	3	325.456	3.368	20	30		EGEDHN
CC[C@@H](Cc1ccc(C)cc1)N(CC)CC(=O)N(CC)CCC#N	ZINC000441322610	458919002	/nfs/dbraw/zinc/91/90/02/458919002.db2.gz	KDCFYDYIOQYVCD-IBGZPJMESA-N	0	3	329.488	3.400	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CCC[C@H]1c1ccccn1	ZINC000531440554	458919588	/nfs/dbraw/zinc/91/95/88/458919588.db2.gz	NBKYRVKDOTVUNN-ICSRJNTNSA-N	0	3	338.451	3.387	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](C)c2ccccc2OC(C)C)CC1	ZINC000519292774	458933353	/nfs/dbraw/zinc/93/33/53/458933353.db2.gz	GSFKHUWLEOTRDZ-MRXNPFEDSA-N	0	3	345.487	3.484	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)cn1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000495777041	458949399	/nfs/dbraw/zinc/94/93/99/458949399.db2.gz	YHDSFINPWAJCIT-GDBMZVCRSA-N	0	3	344.459	3.078	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)CN(C[C@@H]1CCCO1)C1CCC(C)CC1	ZINC000441469132	458950358	/nfs/dbraw/zinc/95/03/58/458950358.db2.gz	XCPJCVPNYNYDOP-BZWMRVRASA-N	0	3	349.519	3.101	20	30		EGEDHN
C[C@@H]1C[C@@H](Nc2c(C#N)cnc3c(F)ccc(Cl)c32)CN1C1CC1	ZINC000566652544	458976393	/nfs/dbraw/zinc/97/63/93/458976393.db2.gz	QWFNBUCCYUYICK-ZYHUDNBSSA-N	0	3	344.821	3.358	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCc3c(F)cc(F)cc3[C@H]2C)CC1	ZINC000467956292	458993122	/nfs/dbraw/zinc/99/31/22/458993122.db2.gz	BNZUHQFPCGNEFX-CYBMUJFWSA-N	0	3	349.425	3.244	20	30		EGEDHN
C=CC1CCN(C(=O)NC[C@@H](c2ccc(CC)cc2)N(C)C)CC1	ZINC000476623876	459011161	/nfs/dbraw/zinc/01/11/61/459011161.db2.gz	IDXLDEZBXAHYDJ-IBGZPJMESA-N	0	3	329.488	3.459	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1CCC[C@H]1NCC1(C#N)CC1	ZINC000495957353	459018467	/nfs/dbraw/zinc/01/84/67/459018467.db2.gz	NHXGMAIEAVDBLJ-ARFHVFGLSA-N	0	3	333.476	3.448	20	30		EGEDHN
C=CCN(CCc1ccccc1)C(=O)N[C@@H](C)CN1CCCCC1	ZINC000520130482	459033216	/nfs/dbraw/zinc/03/32/16/459033216.db2.gz	HGHGAGLUPXRVET-SFHVURJKSA-N	0	3	329.488	3.301	20	30		EGEDHN
C=C(C)Cn1c(CC)nnc1N(C)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000577688906	459072752	/nfs/dbraw/zinc/07/27/52/459072752.db2.gz	RYGOYXFOAJTWRQ-GOSISDBHSA-N	0	3	339.487	3.127	20	30		EGEDHN
CSC1c2cc(-c3noc(-c4ccc(C#N)cn4)n3)ccc2NC1=O	ZINC000577798287	459096680	/nfs/dbraw/zinc/09/66/80/459096680.db2.gz	IDQKQIKIVMFUCK-CQSZACIVSA-N	0	3	349.375	3.026	20	30		EGEDHN
COc1ccc2c(c1)CCCN(CCC(=O)Nc1ccc(C#N)cc1)C2	ZINC000532538286	459107617	/nfs/dbraw/zinc/10/76/17/459107617.db2.gz	QLVMUABUVWNALE-UHFFFAOYSA-N	0	3	349.434	3.344	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCc1cnc(NC(=O)OC(C)(C)C)s1	ZINC000496250938	459123920	/nfs/dbraw/zinc/12/39/20/459123920.db2.gz	BUTJBPLKCLSTDP-OLZOCXBDSA-N	0	3	339.461	3.313	20	30		EGEDHN
C=CCCSCCNCc1cn2ccc(Br)cc2n1	ZINC000594960169	459193856	/nfs/dbraw/zinc/19/38/56/459193856.db2.gz	LUWOIBVGECTXPX-UHFFFAOYSA-N	0	3	340.290	3.496	20	30		EGEDHN
CCO[C@@H]1C[C@H](NCC(=O)Nc2oc(C)c(C)c2C#N)C12CCCC2	ZINC000590739516	459200756	/nfs/dbraw/zinc/20/07/56/459200756.db2.gz	SBYJVPIOYHJOIO-JKSUJKDBSA-N	0	3	345.443	3.034	20	30		EGEDHN
N#Cc1ccc2c(c1)CC[C@H]2NC(=O)[C@H]1CCCCN1C1CCCC1	ZINC000590748493	459203985	/nfs/dbraw/zinc/20/39/85/459203985.db2.gz	BPDCELXOJITIJL-WOJBJXKFSA-N	0	3	337.467	3.459	20	30		EGEDHN
CCCN(Cc1cnc2c(C#N)cnn2c1)[C@H]1C[C@@H](OCC)C1(C)C	ZINC000578508029	459212405	/nfs/dbraw/zinc/21/24/05/459212405.db2.gz	KVUUZLKKTOQWNX-DLBZAZTESA-N	0	3	341.459	3.017	20	30		EGEDHN
CC(C#N)C(=O)N1CCC([C@@H]2N(C(=O)OC(C)(C)C)CC2(C)C)CC1	ZINC000496507129	459220574	/nfs/dbraw/zinc/22/05/74/459220574.db2.gz	ILAVVJVWNNPGSD-HIFRSBDPSA-N	0	3	349.475	3.030	20	30		EGEDHN
CC[C@@H](N[C@H]1CC(=O)N(c2ccc(OC)cc2)C1)c1ccc(C#N)cc1	ZINC000595077338	459238628	/nfs/dbraw/zinc/23/86/28/459238628.db2.gz	HBKCQAZYCZVPAE-FXAWDEMLSA-N	0	3	349.434	3.413	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc(C)c(C(C)=O)c2)CC1	ZINC000580092408	459255869	/nfs/dbraw/zinc/25/58/69/459255869.db2.gz	GHXYOTZIQRYWEY-UHFFFAOYSA-N	0	3	329.444	3.360	20	30		EGEDHN
CC(C)N1CC[C@H](N(C)C(=O)c2c(Cl)cc(C#N)cc2Cl)C1	ZINC000590889471	459260203	/nfs/dbraw/zinc/26/02/03/459260203.db2.gz	WYGMJSUSQUAVBH-LBPRGKRZSA-N	0	3	340.254	3.420	20	30		EGEDHN
N#CCCN(C(=O)C1CN(C2CCCCC2)C1)c1ccc(F)cc1	ZINC000590905293	459264298	/nfs/dbraw/zinc/26/42/98/459264298.db2.gz	FHOWFYYTACMZQO-UHFFFAOYSA-N	0	3	329.419	3.337	20	30		EGEDHN
C=CCCCCN1C[C@@H](c2cnn(C)c2)[C@H](NC(=O)OC(C)(C)C)C1	ZINC000496634677	459267679	/nfs/dbraw/zinc/26/76/79/459267679.db2.gz	XJLBAFJLFIHCAX-DLBZAZTESA-N	0	3	348.491	3.069	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)[C@]2(C#N)CC23CCCC3)CN1Cc1ccccc1	ZINC000581648030	459276280	/nfs/dbraw/zinc/27/62/80/459276280.db2.gz	PPHSBQBRSUVFFE-PLMTUMEDSA-N	0	3	337.467	3.240	20	30		EGEDHN
CC(C)N1CCN([C@@H]2CCN([C@@H](C#N)c3ccc(Cl)cc3)C2)CC1	ZINC000595341721	459280012	/nfs/dbraw/zinc/28/00/12/459280012.db2.gz	YMFZHZMOTMAYRH-MOPGFXCFSA-N	0	3	346.906	3.005	20	30		EGEDHN
Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@@H]2NCC2(CC#N)CC2)cc1	ZINC000581980374	459285562	/nfs/dbraw/zinc/28/55/62/459285562.db2.gz	SYTXNUHVLUCIPB-ROUUACIJSA-N	0	3	346.496	3.363	20	30		EGEDHN
CSc1ccc(OC[C@H](O)CN[C@H](C)c2cccc(C#N)c2)cc1	ZINC000591023125	459295523	/nfs/dbraw/zinc/29/55/23/459295523.db2.gz	XOIDBZJDQKIHBZ-RHSMWYFYSA-N	0	3	342.464	3.371	20	30		EGEDHN
C[C@H](CN1CCC(C)CC1)NC(=O)N[C@H](C)c1ccc(C#N)cc1	ZINC000595460958	459309340	/nfs/dbraw/zinc/30/93/40/459309340.db2.gz	IPDLDNOTOLRPID-HZPDHXFCSA-N	0	3	328.460	3.039	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H](N[C@@H]2CCc3ccc(C#N)cc32)C1	ZINC000496776781	459320117	/nfs/dbraw/zinc/32/01/17/459320117.db2.gz	KNFVSBILSVAZMB-DOTOQJQBSA-N	0	3	327.428	3.145	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NC[C@@H](c1ccc(CC)cc1)N(C)C)OCC	ZINC000534416881	459325544	/nfs/dbraw/zinc/32/55/44/459325544.db2.gz	WTJJRAZLRBPYIP-OALUTQOASA-N	0	3	332.488	3.339	20	30		EGEDHN
C[C@H](C(=O)NC1(C#N)CCC1)N1CCC[C@@](C)(c2ccccc2)CC1	ZINC000560470432	459353121	/nfs/dbraw/zinc/35/31/21/459353121.db2.gz	WDDCQMMVFHKFTL-YLJYHZDGSA-N	0	3	339.483	3.381	20	30		EGEDHN
C[C@H](c1ccccc1)[C@H](CO)NC(=O)C(C#N)CCc1ccccc1	ZINC000591320256	459354057	/nfs/dbraw/zinc/35/40/57/459354057.db2.gz	YJSMRISYTGRTMQ-AHRSYUTCSA-N	0	3	336.435	3.040	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1CCC[C@@H]1c1c(C)cccc1C	ZINC000595600056	459360228	/nfs/dbraw/zinc/36/02/28/459360228.db2.gz	FZTFUBRXLPZCDA-CRAIPNDOSA-N	0	3	327.472	3.449	20	30		EGEDHN
N#CC[C@H]1CCCN(C(=O)NCCN2CCC3(CCCCC3)CC2)C1	ZINC000595605537	459362414	/nfs/dbraw/zinc/36/24/14/459362414.db2.gz	BQXFRARXBUAMDV-GOSISDBHSA-N	0	3	346.519	3.368	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCCC[C@H]1[C@@H]1CCCC1=Nn1cnnc1	ZINC000496985176	459395370	/nfs/dbraw/zinc/39/53/70/459395370.db2.gz	LCANVMBOCBWNJP-HIFRSBDPSA-N	0	3	333.436	3.072	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)C(=O)N[C@@H]1CCN(C(C)(C)C)C1	ZINC000595704359	459406079	/nfs/dbraw/zinc/40/60/79/459406079.db2.gz	PXKAVNLCHBSDEB-RHSMWYFYSA-N	0	3	328.460	3.133	20	30		EGEDHN
CN1C[C@@H]2CCCN(C(=O)c3c(Cl)cc(C#N)cc3Cl)[C@@H]2C1	ZINC000591803521	459439770	/nfs/dbraw/zinc/43/97/70/459439770.db2.gz	LDFAPNGOYVPXKB-SMDDNHRTSA-N	0	3	338.238	3.031	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H]1CCN(c2ncc3c(c2C#N)CCC3)C1	ZINC000591820759	459447590	/nfs/dbraw/zinc/44/75/90/459447590.db2.gz	RDVFAEZDJWGJSU-GOSISDBHSA-N	0	3	332.451	3.153	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N(C)C[C@@H](O)COc1ccc(CC#N)cc1	ZINC000591853632	459455218	/nfs/dbraw/zinc/45/52/18/459455218.db2.gz	AYYVUQAPJKZPIZ-OXJNMPFZSA-N	0	3	349.434	3.057	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H]2CN(Cc3cc(C#N)cs3)C[C@H]2C1	ZINC000497162895	459466864	/nfs/dbraw/zinc/46/68/64/459466864.db2.gz	CKQGJFYSZBVIKG-CABCVRRESA-N	0	3	347.484	3.309	20	30		EGEDHN
Cc1cccn2c1nc(-c1ccccc1)c2NC(=O)[C@H](N)CCCC#N	ZINC000595971801	459489833	/nfs/dbraw/zinc/48/98/33/459489833.db2.gz	UZVIOAVWFQFENN-MRXNPFEDSA-N	0	3	347.422	3.269	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(F)cc2OC(F)F)CC1	ZINC000487286406	459528770	/nfs/dbraw/zinc/52/87/70/459528770.db2.gz	YMFAGXHMDNUPLT-UHFFFAOYSA-N	0	3	342.361	3.197	20	30		EGEDHN
Cc1ccc(C)c(OC[C@H](O)CN(C)Cc2ccc(C#N)cc2)c1C	ZINC000497586129	459544164	/nfs/dbraw/zinc/54/41/64/459544164.db2.gz	WQUMXUZMAVQRTR-HXUWFJFHSA-N	0	3	338.451	3.355	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CC[C@H]1NC(=O)c1ccc(C#N)s1	ZINC000488482239	459544320	/nfs/dbraw/zinc/54/43/20/459544320.db2.gz	FUZVKKMXQGJFGF-WMLDXEAASA-N	0	3	339.464	3.260	20	30		EGEDHN
N#CCC1(CNCCC(=O)Nc2ccc(Br)cc2)CC1	ZINC000570274081	459554734	/nfs/dbraw/zinc/55/47/34/459554734.db2.gz	YIGMMTQLOIOKDY-UHFFFAOYSA-N	0	3	336.233	3.061	20	30		EGEDHN
C=CCn1cccc1C(=O)Nc1cccc(N2CCN(CC)CC2)c1	ZINC000488889614	459555929	/nfs/dbraw/zinc/55/59/29/459555929.db2.gz	KKTYRULVJQXKPP-UHFFFAOYSA-N	0	3	338.455	3.068	20	30		EGEDHN
C=CCn1cccc1C(=O)N(CCN(C)C)Cc1ccc(F)cc1F	ZINC000489045594	459560403	/nfs/dbraw/zinc/56/04/03/459560403.db2.gz	ADLWJRIVFKBFQT-UHFFFAOYSA-N	0	3	347.409	3.156	20	30		EGEDHN
C[C@@H](NC(C)(C)CNC(=O)N1CCC[C@@H](CC#N)C1)c1ccccc1	ZINC000596305427	459589840	/nfs/dbraw/zinc/58/98/40/459589840.db2.gz	UQVDRQHSCWJTOK-SJORKVTESA-N	0	3	342.487	3.451	20	30		EGEDHN
C[C@@H](NCC1(c2cccs2)CCCCC1)C(=O)NC1(C#N)CCC1	ZINC000527293955	459623022	/nfs/dbraw/zinc/62/30/22/459623022.db2.gz	XVLPEFCGFXMPKG-OAHLLOKOSA-N	0	3	345.512	3.491	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(CCC)Cc2ccccc2F)CC1	ZINC000592526107	459625920	/nfs/dbraw/zinc/62/59/20/459625920.db2.gz	HFINVDDQQKWGPD-UHFFFAOYSA-N	0	3	333.451	3.398	20	30		EGEDHN
N#CC1(NC(=O)CN[C@H](Cc2ccccc2)c2ccccc2)CCC1	ZINC000527384884	459639567	/nfs/dbraw/zinc/63/95/67/459639567.db2.gz	RVRAYMHMWSMYQR-LJQANCHMSA-N	0	3	333.435	3.122	20	30		EGEDHN
N#CC1(NC(=O)CN(CCc2ccc(Cl)cc2)CC2CC2)CCC1	ZINC000527385143	459639822	/nfs/dbraw/zinc/63/98/22/459639822.db2.gz	AEKOPTHELBWASI-UHFFFAOYSA-N	0	3	345.874	3.157	20	30		EGEDHN
C#CCNC(=O)C1CCN([C@@H](C)c2ccc(C(F)(F)F)cc2)CC1	ZINC000491637714	459644586	/nfs/dbraw/zinc/64/45/86/459644586.db2.gz	USPFDJBGTUGNMU-ZDUSSCGKSA-N	0	3	338.373	3.228	20	30		EGEDHN
CN(CCc1ccccc1)[C@@H]1CCN(C(=O)Nc2cccc(C#N)c2)C1	ZINC000596471534	459648085	/nfs/dbraw/zinc/64/80/85/459648085.db2.gz	WVKAFQAXKTWXCI-HXUWFJFHSA-N	0	3	348.450	3.339	20	30		EGEDHN
C#CCN(C)CCCN[C@@H](c1cc2ccccc2o1)c1cccnc1	ZINC000491751954	459666302	/nfs/dbraw/zinc/66/63/02/459666302.db2.gz	VGPNTKYRIAFADQ-OAQYLSRUSA-N	0	3	333.435	3.462	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CN[C@H]2CCCc3ccc(F)cc32)cc1	ZINC000573479940	459683128	/nfs/dbraw/zinc/68/31/28/459683128.db2.gz	ADNKEPLIVFVJKE-PXNSSMCTSA-N	0	3	340.398	3.104	20	30		EGEDHN
C=C[C@H]1CCCCN1CCC(=O)Nc1sc2c(c1C#N)CCC2	ZINC000584225055	459684267	/nfs/dbraw/zinc/68/42/67/459684267.db2.gz	WEVUYQCVAYRZMU-ZDUSSCGKSA-N	0	3	329.469	3.478	20	30		EGEDHN
C[C@H](NC(=O)N1CCC[C@H](CC#N)C1)[C@@H](c1ccccc1)N(C)C	ZINC000596596990	459691455	/nfs/dbraw/zinc/69/14/55/459691455.db2.gz	HWWXIOGUVAPEDZ-JZXOWHBKSA-N	0	3	328.460	3.013	20	30		EGEDHN
C[C@H](C#N)N(Cc1cccc(C(F)(F)F)c1)C(=O)/C=C\CN(C)C	ZINC000493094425	459733674	/nfs/dbraw/zinc/73/36/74/459733674.db2.gz	LURPRHOSUXWUDF-DMTLFAOVSA-N	0	3	339.361	3.064	20	30		EGEDHN
Cc1ccc(NC(=O)N2CCC[C@H](CC#N)C2)c(OCCN(C)C)c1	ZINC000596748142	459751026	/nfs/dbraw/zinc/75/10/26/459751026.db2.gz	CKXZBQBEVJYHND-MRXNPFEDSA-N	0	3	344.459	3.093	20	30		EGEDHN
CCCN1CC[C@H](NC(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)C1	ZINC000596778008	459760595	/nfs/dbraw/zinc/76/05/95/459760595.db2.gz	UWSDDKSCQPQYEB-ZDUSSCGKSA-N	0	3	340.349	3.183	20	30		EGEDHN
CC(C)Oc1ccc(C#N)cc1NC(=O)N(C)CCN1CCCCC1	ZINC000593149066	459789638	/nfs/dbraw/zinc/78/96/38/459789638.db2.gz	FCUBTTZBKXAMDA-UHFFFAOYSA-N	0	3	344.459	3.295	20	30		EGEDHN
C=CCCO[C@@H](C)c1nc(-c2ccc(OCCN(C)C)cc2)no1	ZINC000544972105	459794195	/nfs/dbraw/zinc/79/41/95/459794195.db2.gz	GWXQQKSGLCLDGC-AWEZNQCLSA-N	0	3	331.416	3.331	20	30		EGEDHN
CCC(C#N)(CC)C(=O)NC[C@@H]1CCCN(Cc2cccs2)C1	ZINC000528317956	459803013	/nfs/dbraw/zinc/80/30/13/459803013.db2.gz	UBAGZNZUVNHOBO-HNNXBMFYSA-N	0	3	333.501	3.406	20	30		EGEDHN
Cc1c2ccccc2oc1[C@H](NC[C@H](O)CN(C)CCC#N)C(C)C	ZINC000584834297	459810611	/nfs/dbraw/zinc/81/06/11/459810611.db2.gz	ICBCESWMQNKSPZ-QFBILLFUSA-N	0	3	343.471	3.234	20	30		EGEDHN
COCCc1ccc(OC[C@H](C)NCc2ccc(C#N)cc2F)cc1	ZINC000597055162	459826378	/nfs/dbraw/zinc/82/63/78/459826378.db2.gz	BIAPMFGAASWEMH-HNNXBMFYSA-N	0	3	342.414	3.443	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CCOC(C2CC2)(C2CC2)C1	ZINC000598364534	459880035	/nfs/dbraw/zinc/88/00/35/459880035.db2.gz	OQEXVNNLAJAMOF-KRWDZBQOSA-N	0	3	338.451	3.177	20	30		EGEDHN
COc1ccc(CN(C)CC2=CCSC2)cc1OCCCC#N	ZINC000597241947	459892681	/nfs/dbraw/zinc/89/26/81/459892681.db2.gz	BITXARBNQJEHJX-UHFFFAOYSA-N	0	3	332.469	3.483	20	30		EGEDHN
N#Cc1ccccc1NC(=O)CCN1CCC[C@@H]1c1ccc(O)cc1	ZINC000609144471	459911556	/nfs/dbraw/zinc/91/15/56/459911556.db2.gz	VHAQOTOOQNMZKX-LJQANCHMSA-N	0	3	335.407	3.430	20	30		EGEDHN
N#Cc1cccc(CN2CCC(N=c3[nH]c4ccccc4o3)CC2)c1	ZINC000593515973	459912492	/nfs/dbraw/zinc/91/24/92/459912492.db2.gz	VHVYRUTZABUOML-UHFFFAOYSA-N	0	3	332.407	3.198	20	30		EGEDHN
C[C@@H](CN1CCC[C@H](C)C1)NC(=O)c1cc2ccccc2n1CC#N	ZINC000609166886	459917392	/nfs/dbraw/zinc/91/73/92/459917392.db2.gz	NVMHOSLIMAAAIM-HOTGVXAUSA-N	0	3	338.455	3.015	20	30		EGEDHN
CNc1ccc(C#N)cc1NC(=O)C(C[C@H]1CCCO1)C(F)(F)F	ZINC000593678971	459947945	/nfs/dbraw/zinc/94/79/45/459947945.db2.gz	SUSSBTHUJUUTKJ-VXGBXAGGSA-N	0	3	341.333	3.286	20	30		EGEDHN
COc1ccc(CN(C)C[C@@H](O)CC(C)(C)C#N)cc1OC(F)F	ZINC000598585366	459954309	/nfs/dbraw/zinc/95/43/09/459954309.db2.gz	BIHXZPCYACIMQQ-ZDUSSCGKSA-N	0	3	342.386	3.029	20	30		EGEDHN
Cc1ncc([C@@H](C)NC2CCN(Cc3cccc(C#N)c3)CC2)c(C)n1	ZINC000593723749	459963683	/nfs/dbraw/zinc/96/36/83/459963683.db2.gz	YGXNQWQOJUUCRO-MRXNPFEDSA-N	0	3	349.482	3.280	20	30		EGEDHN
C[C@@H](CC1(C#N)CCOCC1)NC[C@@H](c1ccco1)N1CCCCC1	ZINC000602500311	459971421	/nfs/dbraw/zinc/97/14/21/459971421.db2.gz	YUVPDDCBVILHMO-ROUUACIJSA-N	0	3	345.487	3.495	20	30		EGEDHN
CC[C@H](C)N[C@H](CNC(=O)N1CCC[C@@](C)(C#N)C1)c1ccco1	ZINC000588724792	459975153	/nfs/dbraw/zinc/97/51/53/459975153.db2.gz	YTJTVUXQEOWTNU-DAYGRLMNSA-N	0	3	332.448	3.044	20	30		EGEDHN
COc1cc2c(cc1CN[C@@H](C)CC1(C#N)CCOCC1)O[C@@H](C)C2	ZINC000602512284	459975957	/nfs/dbraw/zinc/97/59/57/459975957.db2.gz	SHPQFHOXUGCJOU-GJZGRUSLSA-N	0	3	344.455	3.207	20	30		EGEDHN
CC[C@@H](NCc1cccc(C#N)n1)[C@@H](c1ccc(C)cc1)n1cncn1	ZINC000602576138	460004866	/nfs/dbraw/zinc/00/48/66/460004866.db2.gz	MQAMBAHFEDHGBH-WOJBJXKFSA-N	0	3	346.438	3.011	20	30		EGEDHN
N#Cc1cccc(CN[C@@H](Cc2ccccc2)[C@H](O)C(F)(F)F)c1	ZINC000609707816	460008997	/nfs/dbraw/zinc/00/89/97/460008997.db2.gz	YYZNPLXLPGQNEX-IRXDYDNUSA-N	0	3	334.341	3.182	20	30		EGEDHN
C=CCCN(C)Cc1cc(I)cc([N+](=O)[O-])c1	ZINC000589261669	460064924	/nfs/dbraw/zinc/06/49/24/460064924.db2.gz	IQSMJMXBCPSWIT-UHFFFAOYSA-N	0	3	346.168	3.207	20	30		EGEDHN
CC[C@@H](N[C@@H]1CCN(C(=O)C2CCCC2)C1)c1ccc(C#N)cc1	ZINC000618571418	460067442	/nfs/dbraw/zinc/06/74/42/460067442.db2.gz	MMMXKBBCPVVSDT-RTBURBONSA-N	0	3	325.456	3.390	20	30		EGEDHN
CCO[C@@H]1C[C@H](N[C@@H]2CCCc3cc(C#N)ccc32)[C@]12CCCO2	ZINC000602694190	460069182	/nfs/dbraw/zinc/06/91/82/460069182.db2.gz	HAVZQHVTPLMTLK-IYWMVGAKSA-N	0	3	326.440	3.252	20	30		EGEDHN
N#Cc1cccc(CNC[C@H]2CCN(c3ccccc3Cl)C2)n1	ZINC000602707898	460075628	/nfs/dbraw/zinc/07/56/28/460075628.db2.gz	VXDYSANAZCCSQN-CQSZACIVSA-N	0	3	326.831	3.223	20	30		EGEDHN
CN(C)Cc1c2ccccc2oc1C(=O)N1CCC[C@H](CC#N)C1	ZINC000597911721	460107144	/nfs/dbraw/zinc/10/71/44/460107144.db2.gz	BKHHVWJVTZFCND-CQSZACIVSA-N	0	3	325.412	3.260	20	30		EGEDHN
Cc1ccc2c(c1)CN(C(=O)C(C#N)Cc1ccc(C#N)cc1)CC2	ZINC000597965022	460127654	/nfs/dbraw/zinc/12/76/54/460127654.db2.gz	IPVSYDWTHJRTBW-LJQANCHMSA-N	0	3	329.403	3.134	20	30		EGEDHN
CC[C@H]1CCCCN1CCNC(=O)N[C@H](C)c1cccc(C#N)c1	ZINC000610351354	460131295	/nfs/dbraw/zinc/13/12/95/460131295.db2.gz	NVOMZXASWYBLMH-QAPCUYQASA-N	0	3	328.460	3.183	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2N[C@H]1CC(=O)N(c2ccccc2F)C1	ZINC000589729660	460133470	/nfs/dbraw/zinc/13/34/70/460133470.db2.gz	LUXNAYRIUZUILF-QFBILLFUSA-N	0	3	349.409	3.470	20	30		EGEDHN
C[C@H](C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1)C1CCCC1	ZINC000610520155	460174412	/nfs/dbraw/zinc/17/44/12/460174412.db2.gz	ONSTYMAGXGBWDI-INIZCTEOSA-N	0	3	327.472	3.275	20	30		EGEDHN
CCC(C)(C)N1CCN(C(=O)[C@@H](C)Cc2ccc(C#N)cc2)CC1	ZINC000594389140	460203595	/nfs/dbraw/zinc/20/35/95/460203595.db2.gz	FTMPSISFVOBKKK-INIZCTEOSA-N	0	3	327.472	3.070	20	30		EGEDHN
CCO[C@H]1C[C@@H](NCC(=O)NC2(C#N)CCCCC2)C12CCCCC2	ZINC000618902418	460216083	/nfs/dbraw/zinc/21/60/83/460216083.db2.gz	AGWOIYUPPZASBR-SJORKVTESA-N	0	3	347.503	3.047	20	30		EGEDHN
C[C@H](NC(=O)[C@H](N)CCCCC#N)c1ccc(Br)cc1	ZINC000594431935	460217684	/nfs/dbraw/zinc/21/76/84/460217684.db2.gz	STCJXSQOWWXXRC-SMDDNHRTSA-N	0	3	338.249	3.038	20	30		EGEDHN
CCN(C[C@H](O)COc1ccccc1C#N)[C@H](C)c1cccc(O)c1	ZINC000599308090	460223155	/nfs/dbraw/zinc/22/31/55/460223155.db2.gz	RGSFFZVSTGSQQT-BEFAXECRSA-N	0	3	340.423	3.087	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CNC1(c2ccc(F)cc2)CCC1	ZINC000599330838	460230352	/nfs/dbraw/zinc/23/03/52/460230352.db2.gz	LRLOWHMQPHZTDL-SFHVURJKSA-N	0	3	340.398	3.106	20	30		EGEDHN
CC[C@@](C)(N)c1cn(Cc2ccc(-c3ccccc3C#N)cc2)nn1	ZINC000603192334	460262415	/nfs/dbraw/zinc/26/24/15/460262415.db2.gz	YDWURGQIYUSDKJ-HXUWFJFHSA-N	0	3	331.423	3.449	20	30		EGEDHN
CC[C@@H]1CN(C(=O)C(C)C)CC[C@@H]1NCc1ccc(C#N)cc1F	ZINC000610947063	460264505	/nfs/dbraw/zinc/26/45/05/460264505.db2.gz	BUIJQRNLRSYJGY-QAPCUYQASA-N	0	3	331.435	3.070	20	30		EGEDHN
C[C@H]1CN(CCc2ccc(C#N)cc2)CC[C@H]1C(=O)OC(C)(C)C	ZINC000599585125	460279831	/nfs/dbraw/zinc/27/98/31/460279831.db2.gz	XGVAYAPXCXYHLA-MAUKXSAKSA-N	0	3	328.456	3.400	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(Cc3n[nH]c4ccccc43)CC2)cc1	ZINC000611253347	460318468	/nfs/dbraw/zinc/31/84/68/460318468.db2.gz	KXAIVODHDGOZIS-UHFFFAOYSA-N	0	3	345.450	3.142	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(Cc3[nH]nc4ccccc43)CC2)cc1	ZINC000611253347	460318471	/nfs/dbraw/zinc/31/84/71/460318471.db2.gz	KXAIVODHDGOZIS-UHFFFAOYSA-N	0	3	345.450	3.142	20	30		EGEDHN
CCC(C#N)(CC)C(=O)NC[C@@H](C1CC1)N(C)Cc1ccccc1	ZINC000599776602	460332096	/nfs/dbraw/zinc/33/20/96/460332096.db2.gz	DEGWJUPGMSMCRK-SFHVURJKSA-N	0	3	327.472	3.343	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCc2ccc(C#N)c(Cl)c2)cc1	ZINC000619764706	460437047	/nfs/dbraw/zinc/43/70/47/460437047.db2.gz	FSADJEDQRHIJQL-KRWDZBQOSA-N	0	3	348.793	3.082	20	30		EGEDHN
N#CCc1ccc(CN2CCC(CC(=O)NC3CCCC3)CC2)cc1	ZINC000612064786	460524805	/nfs/dbraw/zinc/52/48/05/460524805.db2.gz	VXNWOAHTXLRHED-UHFFFAOYSA-N	0	3	339.483	3.414	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC[C@H]2CCc3ccccc3C2)CC1	ZINC000605017473	460525310	/nfs/dbraw/zinc/52/53/10/460525310.db2.gz	VOFWTSATCLVUBG-KRWDZBQOSA-N	0	3	341.499	3.131	20	30		EGEDHN
CN(C(=O)[C@@H]1CN(C(C)(C)C)C[C@H]1C(F)(F)F)[C@@H]1CCC[C@H]1C#N	ZINC000601823157	460911122	/nfs/dbraw/zinc/91/11/22/460911122.db2.gz	XZGLMEPALCLDOS-REWJHTLYSA-N	0	3	345.409	3.046	20	30		EGEDHN
C[C@H](NCCn1ccc(C(F)(F)F)n1)c1ccc(C#N)c(F)c1	ZINC000601965117	460963698	/nfs/dbraw/zinc/96/36/98/460963698.db2.gz	VAEWSRBNBDDBMZ-JTQLQIEISA-N	0	3	326.297	3.263	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1SCc1ccns1	ZINC000641434191	461247297	/nfs/dbraw/zinc/24/72/97/461247297.db2.gz	RWTMLTAQMWKACI-UHFFFAOYSA-N	0	3	349.529	3.241	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2c(F)ccc3ccncc32)CC1	ZINC000668370435	461259535	/nfs/dbraw/zinc/25/95/35/461259535.db2.gz	XKDLMKNOSQOUKF-UHFFFAOYSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@](C)(CC)c2ccc(F)cc2)CC1	ZINC000636740405	461268535	/nfs/dbraw/zinc/26/85/35/461268535.db2.gz	PZALYBFUHJXVSS-IBGZPJMESA-N	0	3	333.451	3.401	20	30		EGEDHN
C=CCCn1cc(CNCCCc2c[nH]c3ccc(F)cc23)nn1	ZINC000657458423	462136070	/nfs/dbraw/zinc/13/60/70/462136070.db2.gz	CMAAXHGZPHLHSE-UHFFFAOYSA-N	0	3	327.407	3.197	20	30		EGEDHN
C=CCN(CCC(=O)N[C@@H]1CCCc2ccccc21)[C@H](C)COC	ZINC000661245405	462168377	/nfs/dbraw/zinc/16/83/77/462168377.db2.gz	ZZZFNFMSTYWNBN-VQIMIIECSA-N	0	3	330.472	3.093	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N(C(C)C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000648564704	462178222	/nfs/dbraw/zinc/17/82/22/462178222.db2.gz	IHEZPADIXJNBSV-ZCNNSNEGSA-N	0	3	342.483	3.089	20	30		EGEDHN
C=CCN(C(=O)N[C@H](C)[C@@H](c1ccccc1C)N(C)C)[C@@H](C)COC	ZINC000664870032	462224974	/nfs/dbraw/zinc/22/49/74/462224974.db2.gz	NXQFYYIBSRWNAN-SCTDSRPQSA-N	0	3	347.503	3.219	20	30		EGEDHN
C=CCN(CC(=O)NCc1ccc(OC(F)F)cc1)C(C)(C)C	ZINC000661754758	462398010	/nfs/dbraw/zinc/39/80/10/462398010.db2.gz	DFJDWGWHGWKKAB-UHFFFAOYSA-N	0	3	326.387	3.191	20	30		EGEDHN
C=CCN1CCC(NC(=O)CCCCOc2cccc(C)c2)CC1	ZINC000171714651	526421028	/nfs/dbraw/zinc/42/10/28/526421028.db2.gz	AFDXXDUEEKTJLB-UHFFFAOYSA-N	0	3	330.472	3.311	20	30		EGEDHN
C=CCN1CCC(NC(=O)CCc2ncc(-c3ccccc3)o2)CC1	ZINC000171721305	526422429	/nfs/dbraw/zinc/42/24/29/526422429.db2.gz	RLCNXXGZSHHLBQ-UHFFFAOYSA-N	0	3	339.439	3.041	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H]2CCSc3c(F)cccc32)CC1	ZINC000171713714	526438032	/nfs/dbraw/zinc/43/80/32/526438032.db2.gz	DOWMIEWHTJAWNL-MRXNPFEDSA-N	0	3	349.475	3.312	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H]2CCOc3c(Cl)cccc32)CC1	ZINC000171723166	526440253	/nfs/dbraw/zinc/44/02/53/526440253.db2.gz	IEFMALMSCHLWAI-INIZCTEOSA-N	0	3	349.862	3.113	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(N3CCCC3)c(F)c2)CC1	ZINC000171736579	526441368	/nfs/dbraw/zinc/44/13/68/526441368.db2.gz	DWRSLLZINXIBFW-UHFFFAOYSA-N	0	3	346.450	3.198	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(SC(F)F)cc2)CC1	ZINC000171720892	526447548	/nfs/dbraw/zinc/44/75/48/526447548.db2.gz	TXAFXSDLSPUXHP-UHFFFAOYSA-N	0	3	326.412	3.382	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@H](NCc1cc(C#N)ccc1F)C1CC1	ZINC000185201584	526467537	/nfs/dbraw/zinc/46/75/37/526467537.db2.gz	HOEBLEVSNGOBRG-MRXNPFEDSA-N	0	3	333.407	3.090	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)cc1	ZINC000673341141	548549994	/nfs/dbraw/zinc/54/99/94/548549994.db2.gz	GLYTXPYINRSJRF-IBGZPJMESA-N	0	3	342.414	3.423	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2C[C@@H](C(F)(F)F)CC[C@@H]2C)CC1	ZINC000679490748	549719766	/nfs/dbraw/zinc/71/97/66/549719766.db2.gz	UZYTWMFNLCRDOZ-STQMWFEESA-N	0	3	333.398	3.009	20	30		EGEDHN
C#CCN1CCC(C(=O)NCC2(c3cccc(C)c3)CCCC2)CC1	ZINC000726927865	574610415	/nfs/dbraw/zinc/61/04/15/574610415.db2.gz	VMWZYCAKMZHZQF-UHFFFAOYSA-N	0	3	338.495	3.268	20	30		EGEDHN
CC(C)(C)OC(=O)C1CCN(CCCOc2ccc(C#N)cc2)CC1	ZINC000727437097	574667231	/nfs/dbraw/zinc/66/72/31/574667231.db2.gz	DHGHVKTVVGRPPN-UHFFFAOYSA-N	0	3	344.455	3.381	20	30		EGEDHN
C[C@H](NC(=O)C(C)(C)C)C(=O)C(C#N)c1nc2cc(F)ccc2s1	ZINC000730416491	574984379	/nfs/dbraw/zinc/98/43/79/574984379.db2.gz	DPWOQGGRVJNXMY-GXSJLCMTSA-N	0	3	347.415	3.162	20	30		EGEDHN
Cc1ncc(C=CC(=O)C(C#N)C(=O)Nc2ccccc2Cl)s1	ZINC000732900485	575295167	/nfs/dbraw/zinc/29/51/67/575295167.db2.gz	PCKSPSLDJFWGQF-NNNHXZLVSA-N	0	3	345.811	3.466	20	30		EGEDHN
C#CCOc1ccc(CNC[C@@](O)(c2ccccc2)C(F)(F)F)cc1	ZINC000733326797	575328010	/nfs/dbraw/zinc/32/80/10/575328010.db2.gz	BMPTZKXRZBDLPP-GOSISDBHSA-N	0	3	349.352	3.238	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/Cc2ccc(C(=O)OC)o2)c([O-])c1	ZINC000734094416	575438974	/nfs/dbraw/zinc/43/89/74/575438974.db2.gz	NVOYXZVHOZVAEJ-YBFXNURJSA-N	0	3	330.384	3.237	20	30		EGEDHN
CCN(CC)c1ccc(/C=N/Cc2ccc(C(=O)OC)o2)c(O)c1	ZINC000734094416	575438977	/nfs/dbraw/zinc/43/89/77/575438977.db2.gz	NVOYXZVHOZVAEJ-YBFXNURJSA-N	0	3	330.384	3.237	20	30		EGEDHN
CCOCCC[N@@H+]1CC[C@H](/N=C/c2ccc(OCC)cc2[O-])[C@H](C)C1	ZINC000734366171	575474702	/nfs/dbraw/zinc/47/47/02/575474702.db2.gz	HAYACCHDYICEGX-KZALBKFESA-N	0	3	348.487	3.347	20	30		EGEDHN
CCOCCC[N@H+]1CC[C@H](/N=C/c2ccc(OCC)cc2[O-])[C@H](C)C1	ZINC000734366171	575474705	/nfs/dbraw/zinc/47/47/05/575474705.db2.gz	HAYACCHDYICEGX-KZALBKFESA-N	0	3	348.487	3.347	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)CCOCC(F)(F)F)nc21	ZINC000735789881	575713668	/nfs/dbraw/zinc/71/36/68/575713668.db2.gz	SWZHOLHZXNDTMW-JTQLQIEISA-N	0	3	325.290	3.017	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)Cc3ccc4c(c3)OCCO4)nc21	ZINC000735788889	575713719	/nfs/dbraw/zinc/71/37/19/575713719.db2.gz	IDZWHCHHYURXKK-CQSZACIVSA-N	0	3	347.374	3.062	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)c2cc3occc3s2)c1	ZINC000737316750	576203727	/nfs/dbraw/zinc/20/37/27/576203727.db2.gz	MYJXMTDMIGBVIQ-GFCCVEGCSA-N	0	3	340.360	3.464	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)c1cc2occc2s1	ZINC000737323630	576205607	/nfs/dbraw/zinc/20/56/07/576205607.db2.gz	WCJDJDODGSNSAA-SNVBAGLBSA-N	0	3	340.360	3.464	20	30		EGEDHN
C#CCCN1CCC(NC(=O)[C@H]2C[C@@H]2c2cccc(Cl)c2)CC1	ZINC000740736026	576621416	/nfs/dbraw/zinc/62/14/16/576621416.db2.gz	ASRNKIOIYBWFAA-MSOLQXFVSA-N	0	3	330.859	3.047	20	30		EGEDHN
C#CCCN1CCC(NC(=O)[C@@H](c2ccccc2)[C@H](C)CC)CC1	ZINC000740737737	576621960	/nfs/dbraw/zinc/62/19/60/576621960.db2.gz	UWDOUGDRVQBSFK-YLJYHZDGSA-N	0	3	326.484	3.420	20	30		EGEDHN
COc1ccc(CNCc2ccc(C(=O)N3CCCC3)cc2)cc1C#N	ZINC000742366458	576773790	/nfs/dbraw/zinc/77/37/90/576773790.db2.gz	GDZMWKNZRVKXML-UHFFFAOYSA-N	0	3	349.434	3.093	20	30		EGEDHN
C#CCOc1cc(F)ccc1NC(=O)NC[C@@H](C)N1CCCC[C@H]1C	ZINC000743194182	576802986	/nfs/dbraw/zinc/80/29/86/576802986.db2.gz	GNQAQECKZJRLNA-HUUCEWRRSA-N	0	3	347.434	3.222	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)[C@H](C)c1ccco1	ZINC000744031441	576819244	/nfs/dbraw/zinc/81/92/44/576819244.db2.gz	XIHWAECJOIZJBW-CHWSQXEVSA-N	0	3	326.352	3.129	20	30		EGEDHN
N#Cc1c2[nH]c3ccccc3n2c(=O)cc1CN1CCC[C@H]2CCC[C@H]21	ZINC000744408631	576827586	/nfs/dbraw/zinc/82/75/86/576827586.db2.gz	AWLQJXDNHLBDLB-QGPMSJSTSA-N	0	3	346.434	3.488	20	30		EGEDHN
Cc1ccc(C(=O)CCC(=O)C(C#N)C(=O)NC2CCCCC2)s1	ZINC000050681775	1291654859	/nfs/dbraw/zinc/65/48/59/1291654859.db2.gz	BOQFCKGINNQUKQ-AWEZNQCLSA-N	0	3	346.452	3.177	20	30		EGEDHN
C[C@H](Cc1cccc(F)c1)C(=O)C(C#N)C(=O)NC1CCCCC1	ZINC000069285170	1292238756	/nfs/dbraw/zinc/23/87/56/1292238756.db2.gz	RGBYMEXZHPLRRP-CXAGYDPISA-N	0	3	330.403	3.162	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@H](C)CCc1ccccc1F	ZINC000076819043	1292444121	/nfs/dbraw/zinc/44/41/21/1292444121.db2.gz	SZPMWPZZURGMNS-ZBFHGGJFSA-N	0	3	332.419	3.410	20	30		EGEDHN
CCCc1ccc2nccc(N3CCC(C#N)(C(=O)OC)CC3)c2c1	ZINC000828976168	1292523901	/nfs/dbraw/zinc/52/39/01/1292523901.db2.gz	WCLUXIBPFYBUNW-UHFFFAOYSA-N	0	3	337.423	3.470	20	30		EGEDHN
C#CC[C@@H](C)OC(=O)C1CCN(c2cc(Cl)ccc2Cl)C1=O	ZINC000083784183	1292690144	/nfs/dbraw/zinc/69/01/44/1292690144.db2.gz	SYYQJGYXPOBEMM-ZYHUDNBSSA-N	0	3	340.206	3.301	20	30		EGEDHN
N#CCOc1ccc(Cl)cc1CN1CCC[C@@H]1[C@@H]1CCC[C@H]1O	ZINC000831154046	1292820946	/nfs/dbraw/zinc/82/09/46/1292820946.db2.gz	VESICWFOSNGTDX-GVDBMIGSSA-N	0	3	334.847	3.368	20	30		EGEDHN
C#CCOc1ccc(Br)cc1CNC[C@]1(C)CCCO1	ZINC000094797212	1292943659	/nfs/dbraw/zinc/94/36/59/1292943659.db2.gz	YFFUVHBLRCKRPF-INIZCTEOSA-N	0	3	338.245	3.120	20	30		EGEDHN
C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)C(C#N)C(=O)NC1CC1	ZINC000107409276	1293066182	/nfs/dbraw/zinc/06/61/82/1293066182.db2.gz	WBFLJTFCQXCPEH-RNCFNFMXSA-N	0	3	339.222	3.159	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)[C@@H](C)c1ccccc1F	ZINC000109038804	1293086121	/nfs/dbraw/zinc/08/61/21/1293086121.db2.gz	OUBNIDOCHZPDJT-GXTWGEPZSA-N	0	3	340.354	3.285	20	30		EGEDHN
CC[C@@H](C#N)Oc1cccc(CNCc2c[nH]nc2-c2cccnc2)c1	ZINC000113961092	1293160181	/nfs/dbraw/zinc/16/01/81/1293160181.db2.gz	SCGRVLPJXQRQFL-SFHVURJKSA-N	0	3	347.422	3.442	20	30		EGEDHN
C=C(Br)CNC(=O)c1oc2ccccc2c1CN(C)C	ZINC000114176459	1293162325	/nfs/dbraw/zinc/16/23/25/1293162325.db2.gz	YMLQOEBTPRRPFN-UHFFFAOYSA-N	0	3	337.217	3.133	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1N[C@H](C)c1cc(Br)ncc1F	ZINC000834891536	1293165419	/nfs/dbraw/zinc/16/54/19/1293165419.db2.gz	IZFHQOWZSIFDJP-WQAKAFBOSA-N	0	3	329.213	3.367	20	30		EGEDHN
CC[C@H](CC(F)(F)F)C(=O)C(C#N)C(=O)Nc1ccc(OC)cc1	ZINC000835066190	1293197453	/nfs/dbraw/zinc/19/74/53/1293197453.db2.gz	WMPQLTVTHJIUDW-ZWNOBZJWSA-N	0	3	342.317	3.321	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)[C@@H](C)OCC2CC2)cc1	ZINC000120260120	1293313331	/nfs/dbraw/zinc/31/33/31/1293313331.db2.gz	VVRRZGTUNGKWTM-KDOFPFPSSA-N	0	3	342.439	3.492	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)[C@H]2CCCCO2)cc1	ZINC000121976410	1293398385	/nfs/dbraw/zinc/39/83/85/1293398385.db2.gz	JDGQECJMHKSRFS-IAGOWNOFSA-N	0	3	328.412	3.246	20	30		EGEDHN
C#CCOc1ccccc1CNc1cccc(CN2CCN(C)CC2)c1	ZINC000123988839	1293462878	/nfs/dbraw/zinc/46/28/78/1293462878.db2.gz	QWYCQMJNRADPID-UHFFFAOYSA-N	0	3	349.478	3.058	20	30		EGEDHN
CCCSCC(=O)C(C#N)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000125586054	1293511684	/nfs/dbraw/zinc/51/16/84/1293511684.db2.gz	ACIRNRKPKOBUEX-SNVBAGLBSA-N	0	3	328.796	3.270	20	30		EGEDHN
COCCCC(=O)C(C#N)C(=O)Nc1ccc(SC(F)F)cc1	ZINC000126609298	1293540005	/nfs/dbraw/zinc/54/00/05/1293540005.db2.gz	HEEULBJBOCSWDT-GFCCVEGCSA-N	0	3	342.367	3.075	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)[C@H](C)Oc2cccc(F)c2)c1	ZINC000127751953	1293572095	/nfs/dbraw/zinc/57/20/95/1293572095.db2.gz	JNZGNUXHIGEUFA-SUMWQHHRSA-N	0	3	340.354	3.249	20	30		EGEDHN
Cc1noc(C)c1CC(=O)C(C#N)C(=O)Nc1cccc2ccccc21	ZINC000128786038	1293604699	/nfs/dbraw/zinc/60/46/99/1293604699.db2.gz	PWSKADJVBHDLLW-QGZVFWFLSA-N	0	3	347.374	3.335	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)c2ccoc2C)cc1Cl	ZINC000130318760	1293652362	/nfs/dbraw/zinc/65/23/62/1293652362.db2.gz	BFKYCPGHJBKLNT-GFCCVEGCSA-N	0	3	332.743	3.211	20	30		EGEDHN
C#CCOc1ccccc1CNC[C@@H](O)c1ccc(Cl)c(F)c1	ZINC000136147102	1293809988	/nfs/dbraw/zinc/80/99/88/1293809988.db2.gz	XMXCYJWATOAHPX-QGZVFWFLSA-N	0	3	333.790	3.314	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)c2cccc(OC(C)C)n2)c1	ZINC000167800458	1294366457	/nfs/dbraw/zinc/36/64/57/1294366457.db2.gz	LHXNBKCWSBEEPD-HNNXBMFYSA-N	0	3	337.379	3.138	20	30		EGEDHN
C#CCN1CCC(C(=O)NCCc2ccc(-c3ccccc3)cc2)CC1	ZINC000168306272	1294366707	/nfs/dbraw/zinc/36/67/07/1294366707.db2.gz	ZZJVXCAMAGDCDE-UHFFFAOYSA-N	0	3	346.474	3.358	20	30		EGEDHN
C#CCCCNC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1	ZINC000173402571	1294461073	/nfs/dbraw/zinc/46/10/73/1294461073.db2.gz	GBRCHTIAORVMTG-MRXNPFEDSA-N	0	3	333.501	3.234	20	30		EGEDHN
CCN(CC)C(=O)C1(NCc2ccc(OC)c(C#N)c2)CCCCC1	ZINC000174343784	1294495249	/nfs/dbraw/zinc/49/52/49/1294495249.db2.gz	UTKSLFAWHXGMHC-UHFFFAOYSA-N	0	3	343.471	3.228	20	30		EGEDHN
C[C@@H](NCc1ccc([S@](C)=O)cc1)c1ccc(OCC#N)cc1	ZINC000175992524	1294584333	/nfs/dbraw/zinc/58/43/33/1294584333.db2.gz	JVQYHRGKSRQUSI-FATZIPQQSA-N	0	3	328.437	3.177	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)COc1cccc2ccccc21	ZINC000193377180	1295858070	/nfs/dbraw/zinc/85/80/70/1295858070.db2.gz	YDHRQMOKRGGTCE-KRWDZBQOSA-N	0	3	338.407	3.234	20	30		EGEDHN
C[C@@H](Oc1ccccc1)C(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1	ZINC000193392411	1295862903	/nfs/dbraw/zinc/86/29/03/1295862903.db2.gz	JVRSDKKOIOVWCL-WBMJQRKESA-N	0	3	342.782	3.455	20	30		EGEDHN
N#CC(C(=O)NC1CC1)C(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl	ZINC000245897424	1296329857	/nfs/dbraw/zinc/32/98/57/1296329857.db2.gz	FCKKEHDVOBSJED-XQQFMLRXSA-N	0	3	337.206	3.084	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl	ZINC000245904556	1296329952	/nfs/dbraw/zinc/32/99/52/1296329952.db2.gz	HECABHIFSKPFOL-YNEHKIRRSA-N	0	3	339.222	3.330	20	30		EGEDHN
C[C@@H](NC[C@@H](O)COc1ccccc1C#N)c1ccc(Cl)s1	ZINC000315440777	1297136644	/nfs/dbraw/zinc/13/66/44/1297136644.db2.gz	ZBZNEWKTOWLFQX-DGCLKSJQSA-N	0	3	336.844	3.364	20	30		EGEDHN
C[C@@H]1CC[C@H](NCc2cc(C#N)cs2)CN1C(=O)OC(C)(C)C	ZINC000690964304	1298132352	/nfs/dbraw/zinc/13/23/52/1298132352.db2.gz	IUGKZFVHWLLZBR-OCCSQVGLSA-N	0	3	335.473	3.497	20	30		EGEDHN
C=C(Br)CN[C@@H]1CC[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000724068132	1298347241	/nfs/dbraw/zinc/34/72/41/1298347241.db2.gz	JYLRBFIOIVXHMT-NWDGAFQWSA-N	0	3	333.270	3.178	20	30		EGEDHN
Cc1ccc(N(CCC#N)C(=O)CN2CCC[C@H]2C2CC2)cc1C	ZINC000747530278	1298794995	/nfs/dbraw/zinc/79/49/95/1298794995.db2.gz	UTPLYEHLAYRAGV-IBGZPJMESA-N	0	3	325.456	3.425	20	30		EGEDHN
Cc1ccc(N(CCC#N)C(=O)CN2CCC[C@@H]2C2CC2)cc1C	ZINC000747530279	1298795520	/nfs/dbraw/zinc/79/55/20/1298795520.db2.gz	UTPLYEHLAYRAGV-LJQANCHMSA-N	0	3	325.456	3.425	20	30		EGEDHN
C=C(Cl)C[C@H](N)C(=O)N(C)CCCc1cc(-c2ccccc2)no1	ZINC000876629923	1298881237	/nfs/dbraw/zinc/88/12/37/1298881237.db2.gz	PGCTULXDTMUUQS-INIZCTEOSA-N	0	3	347.846	3.203	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)s1)c1ccc(N2CCOCC2)cc1	ZINC000749110752	1299143341	/nfs/dbraw/zinc/14/33/41/1299143341.db2.gz	QGCYUVFOULOJGX-AWEZNQCLSA-N	0	3	327.453	3.307	20	30		EGEDHN
C[C@@]1(Cc2ccc(F)c(F)c2)CCCN1C(=O)[C@@H](N)CCCCC#N	ZINC000877224732	1299214456	/nfs/dbraw/zinc/21/44/56/1299214456.db2.gz	NCZCRLGUKJVPRV-HKUYNNGSSA-N	0	3	349.425	3.300	20	30		EGEDHN
CC[C@H](O)[C@H]1CCCCN1CC[C@](C#N)(C(C)=O)c1ccccc1	ZINC000878119810	1299759911	/nfs/dbraw/zinc/75/99/11/1299759911.db2.gz	FMHKIRZVEGMGHJ-AABGKKOBSA-N	0	3	328.456	3.052	20	30		EGEDHN
C#CCOc1ccc(CN[C@H](C)c2ccc([S@](C)=O)cc2)cc1	ZINC000756033354	1300429496	/nfs/dbraw/zinc/42/94/96/1300429496.db2.gz	LJEXJJJRTREEEL-CMJOXMDJSA-N	0	3	327.449	3.287	20	30		EGEDHN
C#CC[C@H](NC(=O)NC[C@H](Cc1ccccc1)N(C)C)c1ccccc1	ZINC000757605423	1300692820	/nfs/dbraw/zinc/69/28/20/1300692820.db2.gz	KXFNETXCGFXVAL-SFTDATJTSA-N	0	3	349.478	3.223	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)C[C@H](OCC)C(C)C	ZINC000761038191	1301386928	/nfs/dbraw/zinc/38/69/28/1301386928.db2.gz	ROOVNDYMAIVVBX-KDOFPFPSSA-N	0	3	346.427	3.184	20	30		EGEDHN
CCCCCCCC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1CO	ZINC000762111400	1301616266	/nfs/dbraw/zinc/61/62/66/1301616266.db2.gz	KFJLTHXRNABONI-VQTJNVASSA-N	0	3	346.515	3.346	20	30		EGEDHN
Cc1nc(C#N)cc(NC[C@H](c2ccc(OC(C)C)cc2)N(C)C)n1	ZINC000882373324	1301936077	/nfs/dbraw/zinc/93/60/77/1301936077.db2.gz	RHKOOEYTGBSGMN-GOSISDBHSA-N	0	3	339.443	3.159	20	30		EGEDHN
C#CCN(C(=O)NC[C@H](c1cccs1)N1CCC(C)CC1)C1CC1	ZINC000764671699	1302116501	/nfs/dbraw/zinc/11/65/01/1302116501.db2.gz	LAWRIHQCBGHMJB-QGZVFWFLSA-N	0	3	345.512	3.328	20	30		EGEDHN
CC(C)(C)n1cc(C#N)cc1NC(=O)NC[C@H]1CCCCN1C1CC1	ZINC000766237285	1302413918	/nfs/dbraw/zinc/41/39/18/1302413918.db2.gz	YGEMORKIBYLMSF-MRXNPFEDSA-N	0	3	343.475	3.253	20	30		EGEDHN
CC(C)(C)CN(Cc1ccccc1)C(=O)C1CC2(C1)CNC[C@H]2C#N	ZINC000884125292	1302745450	/nfs/dbraw/zinc/74/54/50/1302745450.db2.gz	VGTMFMDDTMYNSL-IDYZSHNDSA-N	0	3	339.483	3.201	20	30		EGEDHN
C#CCOc1ccccc1NC(=O)N1CCN(CCC(C)(C)C)CC1	ZINC000776095967	1304096229	/nfs/dbraw/zinc/09/62/29/1304096229.db2.gz	QDHRDOTVGGQMFR-UHFFFAOYSA-N	0	3	343.471	3.284	20	30		EGEDHN
CCOC(=O)N1CCC[C@@H]([C@@H](C)NCc2ccc(F)cc2C#N)C1	ZINC000776819820	1304205064	/nfs/dbraw/zinc/20/50/64/1304205064.db2.gz	CYFUYVRRALIVGB-UKRRQHHQSA-N	0	3	333.407	3.044	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CNCCc1cn2ccccc2n1	ZINC000778155816	1304405457	/nfs/dbraw/zinc/40/54/57/1304405457.db2.gz	HSORRCCUCRKWMK-UHFFFAOYSA-N	0	3	339.826	3.332	20	30		EGEDHN
COc1ccc(CN[C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)c(C)c1	ZINC000778551619	1304464799	/nfs/dbraw/zinc/46/47/99/1304464799.db2.gz	YYPWOHVDRRNPMP-HXUWFJFHSA-N	0	3	349.434	3.161	20	30		EGEDHN
N#CCCNC(=O)CNC1(c2ccc(C(F)(F)F)cc2)CCCC1	ZINC000780320942	1304677061	/nfs/dbraw/zinc/67/70/61/1304677061.db2.gz	NQCFOCMTAGBLCI-UHFFFAOYSA-N	0	3	339.361	3.094	20	30		EGEDHN
CC(C)(C)OC(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1	ZINC000781973141	1304897196	/nfs/dbraw/zinc/89/71/96/1304897196.db2.gz	APCBDUBMUZDABT-UHFFFAOYSA-N	0	3	329.444	3.437	20	30		EGEDHN
CC(=O)N(CC(=O)C(C#N)c1nc(C(C)C)cs1)c1ccccc1	ZINC000892803934	1305558701	/nfs/dbraw/zinc/55/87/01/1305558701.db2.gz	XCTJCWGISWTIGF-OAHLLOKOSA-N	0	3	341.436	3.496	20	30		EGEDHN
C[C@@H]1CC[C@H](CCC(=O)C(C#N)C(=O)NCc2cccc(Cl)c2)O1	ZINC000786541855	1305594222	/nfs/dbraw/zinc/59/42/22/1305594222.db2.gz	WYLXVORVQRSCEM-DAXOMENPSA-N	0	3	348.830	3.013	20	30		EGEDHN
C[C@@H](N[C@@H](C)c1cccc(C#N)c1)c1ccc(N2CCNC2=O)cc1	ZINC000786835876	1305639650	/nfs/dbraw/zinc/63/96/50/1305639650.db2.gz	JZMAVICQNDWXBF-CABCVRRESA-N	0	3	334.423	3.500	20	30		EGEDHN
N#Cc1cccc(OCCCOC(=O)[C@@H]2CCCN2C2CCCC2)c1	ZINC000786877637	1305644671	/nfs/dbraw/zinc/64/46/71/1305644671.db2.gz	DUZNKPUHUKAOPF-IBGZPJMESA-N	0	3	342.439	3.277	20	30		EGEDHN
Cn1nc2c(c1C(=O)C(C#N)c1cc(C(F)(F)F)ccn1)CCCC2	ZINC000893061883	1305685338	/nfs/dbraw/zinc/68/53/38/1305685338.db2.gz	LGOXUKOSUPMERL-GFCCVEGCSA-N	0	3	348.328	3.203	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)Cc1cc(F)c(F)cc1F	ZINC000793126260	1309300273	/nfs/dbraw/zinc/30/02/73/1309300273.db2.gz	VIRPQQOLCORZJX-LBPRGKRZSA-N	0	3	340.345	3.052	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@H]1CCc2cc(C)ccc2O1	ZINC000796634384	1310052961	/nfs/dbraw/zinc/05/29/61/1310052961.db2.gz	YOEDGGIRSGOPAS-FUHWJXTLSA-N	0	3	342.439	3.094	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)c1ccoc1CC	ZINC000797548615	1310209826	/nfs/dbraw/zinc/20/98/26/1310209826.db2.gz	JKDQAVSZAWQOIT-CYBMUJFWSA-N	0	3	326.352	3.202	20	30		EGEDHN
C[C@@H](NC(=O)C1CCCC1)C(=O)C(C#N)c1ncc(C(C)(C)C)s1	ZINC000797568647	1310212889	/nfs/dbraw/zinc/21/28/89/1310212889.db2.gz	KNVALGFPGDKIHT-YPMHNXCESA-N	0	3	347.484	3.312	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc(Cl)ccc2Cl)C1	ZINC001023717977	1319852574	/nfs/dbraw/zinc/85/25/74/1319852574.db2.gz	NGZWFFTVAAKXLW-CYBMUJFWSA-N	0	3	339.266	3.459	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)C23CC4CC(CC(C4)C2)C3)C1	ZINC001023717500	1319852927	/nfs/dbraw/zinc/85/29/27/1319852927.db2.gz	GXBVXZKTALMQFR-PDRSHUBSSA-N	0	3	328.500	3.054	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N(C)Cc1c(CC)oc2ccccc21	ZINC000836486598	1320493507	/nfs/dbraw/zinc/49/35/07/1320493507.db2.gz	HCAQDYIDOQRZBH-UHFFFAOYSA-N	0	3	341.455	3.092	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)Cc2ccc(Cl)s2)cc1	ZINC000802042010	1316975511	/nfs/dbraw/zinc/97/55/11/1316975511.db2.gz	LCLDWVBTIMXGDX-ZDUSSCGKSA-N	0	3	348.811	3.300	20	30		EGEDHN
C#C[C@H](CCC)NC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F	ZINC000803191249	1317090610	/nfs/dbraw/zinc/09/06/10/1317090610.db2.gz	WKILNIZRVOSUFC-IAGOWNOFSA-N	0	3	334.410	3.062	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@H](NCc3ccc(C#N)c(F)c3)C2)cs1	ZINC001019515003	1317281158	/nfs/dbraw/zinc/28/11/58/1317281158.db2.gz	HURHQXKCEVAZHE-INIZCTEOSA-N	0	3	343.427	3.072	20	30		EGEDHN
C=C1CCC(C(=O)Nc2cccc(CN3CCC(O)CC3)c2)CC1	ZINC000900959367	1317363701	/nfs/dbraw/zinc/36/37/01/1317363701.db2.gz	XEIIZQBMMITZJC-UHFFFAOYSA-N	0	3	328.456	3.328	20	30		EGEDHN
CC(=O)N1CCC2(CCN(CC#Cc3ccc(Cl)cc3)CC2)CC1	ZINC000957475941	1317386759	/nfs/dbraw/zinc/38/67/59/1317386759.db2.gz	FWKPNRAIOZIYRQ-UHFFFAOYSA-N	0	3	344.886	3.416	20	30		EGEDHN
C=C[C@@H](C(=O)N1CC[C@H](NCc2cncc(C)c2)C1)c1ccccc1	ZINC001019805121	1317432808	/nfs/dbraw/zinc/43/28/08/1317432808.db2.gz	UBBBMPSMUOKQTG-VQTJNVASSA-N	0	3	335.451	3.050	20	30		EGEDHN
Cc1ccccc1C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001019949513	1317473263	/nfs/dbraw/zinc/47/32/63/1317473263.db2.gz	RLTMWFJOCJGIDU-QAQDUYKDSA-N	0	3	337.398	3.056	20	30		EGEDHN
C#CCOc1ccccc1NC(=O)N(CCC)CCN1CCCCC1	ZINC000806438750	1317490334	/nfs/dbraw/zinc/49/03/34/1317490334.db2.gz	NVXQBHCOTHGLMQ-UHFFFAOYSA-N	0	3	343.471	3.428	20	30		EGEDHN
C#C[C@@H](NC(=O)[C@@H]1CCCN(Cc2cccc(F)c2)C1)C(C)(C)C	ZINC000807882070	1317598550	/nfs/dbraw/zinc/59/85/50/1317598550.db2.gz	ICEYWTWNDFXDLV-SJLPKXTDSA-N	0	3	330.447	3.202	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@H](C)c2c(F)cccc2F)C1	ZINC001020396317	1317677969	/nfs/dbraw/zinc/67/79/69/1317677969.db2.gz	OKRMSEZUODIJPI-IJLUTSLNSA-N	0	3	328.790	3.058	20	30		EGEDHN
COc1ccc(CN[C@H]2CCc3c2ccc(OC)c3F)cc1C#N	ZINC000808708998	1317719574	/nfs/dbraw/zinc/71/95/74/1317719574.db2.gz	SLWXYSIZGYSHLU-INIZCTEOSA-N	0	3	326.371	3.492	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)c2cncc(C(F)(F)F)c2)c1	ZINC000808979707	1317755870	/nfs/dbraw/zinc/75/58/70/1317755870.db2.gz	LCFAJHPVOVLQHE-CQSZACIVSA-N	0	3	347.296	3.370	20	30		EGEDHN
C#Cc1ccc(CN2CCC(NC(=O)NC3CCCCC3)CC2)cc1	ZINC000809551903	1317830253	/nfs/dbraw/zinc/83/02/53/1317830253.db2.gz	DMUKJBWIICHLHR-UHFFFAOYSA-N	0	3	339.483	3.264	20	30		EGEDHN
C#C[C@H](CC)NCc1sc(N2CCOCC2)nc1-c1ccccc1	ZINC000809686466	1317862678	/nfs/dbraw/zinc/86/26/78/1317862678.db2.gz	UXXKLMPYENTLGZ-MRXNPFEDSA-N	0	3	341.480	3.148	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(C(F)(F)F)cc(Cl)n2)CC1	ZINC000810356278	1318003155	/nfs/dbraw/zinc/00/31/55/1318003155.db2.gz	IWBWNUNUVPDXGX-UHFFFAOYSA-N	0	3	347.768	3.134	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N(CCCc1ccccc1)CCN(C)C	ZINC000810433765	1318008090	/nfs/dbraw/zinc/00/80/90/1318008090.db2.gz	FWJYOFKWFBLZRT-UHFFFAOYSA-N	0	3	348.490	3.233	20	30		EGEDHN
COCC1(C(=O)C(C#N)c2nc3cc(F)ccc3s2)CCOCC1	ZINC000810576064	1318025871	/nfs/dbraw/zinc/02/58/71/1318025871.db2.gz	NYGWURNJUDDZJB-LBPRGKRZSA-N	0	3	348.399	3.055	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2c2cc(F)ccc2F)C1	ZINC001021069881	1318066913	/nfs/dbraw/zinc/06/69/13/1318066913.db2.gz	NRGNPJKVOCTPSC-PWNZVWSESA-N	0	3	340.801	3.058	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H](C)c2ccc(F)cc2F)C1	ZINC001021071382	1318067012	/nfs/dbraw/zinc/06/70/12/1318067012.db2.gz	KSKHEJOQPIJZTJ-DRZSPHRISA-N	0	3	328.790	3.058	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H]2C[C@H]2c2cccc(F)c2F)C1	ZINC001021072061	1318068565	/nfs/dbraw/zinc/06/85/65/1318068565.db2.gz	WMYMKAYLPMMHKB-AUZPSNTRSA-N	0	3	340.801	3.058	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)[C@]2(C)CC=C(C)CC2)C1	ZINC001021080933	1318071538	/nfs/dbraw/zinc/07/15/38/1318071538.db2.gz	SPUKYMLMAZHGRK-IIAWOOMASA-N	0	3	341.293	3.268	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccsc2C#N)C1	ZINC000906382696	1318089812	/nfs/dbraw/zinc/08/98/12/1318089812.db2.gz	RJVIBGVTTQNCRU-HIFRSBDPSA-N	0	3	325.437	3.185	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@]2(C)CCc3ccccc3C2)C1	ZINC001021157162	1318115606	/nfs/dbraw/zinc/11/56/06/1318115606.db2.gz	XQWGCSIAMMLXBR-ZHALLVOQSA-N	0	3	332.875	3.171	20	30		EGEDHN
C=C1CC(C)(C(=O)NC2C[C@H]3CC[C@@H](C2)N3Cc2ccccn2)C1	ZINC001021373118	1318216825	/nfs/dbraw/zinc/21/68/25/1318216825.db2.gz	DQQXSKGWTGZLLA-AYHJJNSGSA-N	0	3	325.456	3.050	20	30		EGEDHN
Cc1ccc(C(=O)N2CCCC[C@H]2CNCc2ccc(C#N)s2)o1	ZINC000959863755	1318237928	/nfs/dbraw/zinc/23/79/28/1318237928.db2.gz	PYODMPGWNXITGN-AWEZNQCLSA-N	0	3	343.452	3.306	20	30		EGEDHN
CC(C)(F)C(=O)N1CCC[C@@H]2CN(Cc3cccc(C#N)c3)CC[C@H]21	ZINC001021494393	1318296890	/nfs/dbraw/zinc/29/68/90/1318296890.db2.gz	AXHMFTFZQBMHAQ-QZTJIDSGSA-N	0	3	343.446	3.119	20	30		EGEDHN
Cc1cc[nH]c1C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)s1	ZINC000959986687	1318300204	/nfs/dbraw/zinc/30/02/04/1318300204.db2.gz	VSBQFFUEEYTMLO-AWEZNQCLSA-N	0	3	342.468	3.041	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@@H]2CN(Cc3ccc(C#N)cc3)CC[C@@H]21	ZINC001021512113	1318334115	/nfs/dbraw/zinc/33/41/15/1318334115.db2.gz	UYIUKSNNMLHVON-UXHICEINSA-N	0	3	337.467	3.337	20	30		EGEDHN
C#C[C@H](NC(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C)C(C)C	ZINC000812380303	1318379455	/nfs/dbraw/zinc/37/94/55/1318379455.db2.gz	BUKQDIYXLNEKBZ-RBUKOAKNSA-N	0	3	345.487	3.034	20	30		EGEDHN
CCN1CCN(c2ccc(N=Cc3c(O)cccc3OC)cc2)CC1	ZINC000812396209	1318382296	/nfs/dbraw/zinc/38/22/96/1318382296.db2.gz	MUXCVYBYSNRBJL-UHFFFAOYSA-N	0	3	339.439	3.293	20	30		EGEDHN
C=CCCC(=O)[C@H]1CCCN1C(=O)C[C@H](c1ccccc1)N(C)C	ZINC000908658705	1318383967	/nfs/dbraw/zinc/38/39/67/1318383967.db2.gz	FKJPETGJGZYTOV-QZTJIDSGSA-N	0	3	328.456	3.206	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC000960151739	1318385236	/nfs/dbraw/zinc/38/52/36/1318385236.db2.gz	CLXVBDRRMDQXTC-QAPCUYQASA-N	0	3	345.462	3.460	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)[C@@H]2CC23CCC3)s1	ZINC000960153936	1318388614	/nfs/dbraw/zinc/38/86/14/1318388614.db2.gz	KRPNUQJQSXFISL-YOEHRIQHSA-N	0	3	343.496	3.281	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@@H]2CN(C/C=C/c3ccccc3)CC[C@@H]21	ZINC001021586072	1318429029	/nfs/dbraw/zinc/42/90/29/1318429029.db2.gz	YSOXKXRRMKIOKU-DTPOIJJJSA-N	0	3	348.490	3.426	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2csc(C)c2C)C1	ZINC001021598457	1318443380	/nfs/dbraw/zinc/44/33/80/1318443380.db2.gz	VCTKJPXHZMJEQT-WMZOPIPTSA-N	0	3	330.497	3.315	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cnc2ccsc2c1	ZINC000960293072	1318448223	/nfs/dbraw/zinc/44/82/23/1318448223.db2.gz	NICGTUPUBXOVBN-IEBWSBKVSA-N	0	3	349.459	3.468	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc3c(o2)CCCC3)C1	ZINC001021603484	1318448483	/nfs/dbraw/zinc/44/84/83/1318448483.db2.gz	PTKUXCUNILVWET-QZTJIDSGSA-N	0	3	340.467	3.108	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc2ncccc2s1	ZINC000960296309	1318449201	/nfs/dbraw/zinc/44/92/01/1318449201.db2.gz	MZVDTXOCKQEUAK-VQIMIIECSA-N	0	3	349.459	3.468	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1csc(Cl)n1	ZINC000960318459	1318459100	/nfs/dbraw/zinc/45/91/00/1318459100.db2.gz	NMNPQCZKINMMFS-UKRRQHHQSA-N	0	3	347.871	3.358	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc(CCC)on1	ZINC000960319126	1318459960	/nfs/dbraw/zinc/45/99/60/1318459960.db2.gz	YOMCDAZFFVCVNU-IEBWSBKVSA-N	0	3	339.439	3.189	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cccc3ccc(C)nc32)C1	ZINC001021615074	1318462856	/nfs/dbraw/zinc/46/28/56/1318462856.db2.gz	UUPJWIXQSGWFMK-UYAOXDASSA-N	0	3	347.462	3.103	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)Cc2ccc(C)c(Cl)c2)C1	ZINC001021614694	1318462914	/nfs/dbraw/zinc/46/29/14/1318462914.db2.gz	QZHSFCRORNNOJX-MJGOQNOKSA-N	0	3	344.886	3.137	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc(COC)cc1	ZINC000960334600	1318467620	/nfs/dbraw/zinc/46/76/20/1318467620.db2.gz	JQGZDSFXCKFEDH-WOJBJXKFSA-N	0	3	336.435	3.004	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2c(C)oc(C)c2C)C1	ZINC001021625850	1318477394	/nfs/dbraw/zinc/47/73/94/1318477394.db2.gz	AZOANHOTWCKDPF-ZWKOTPCHSA-N	0	3	328.456	3.155	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cccc(-n3cccc3)c2)C1	ZINC001021627072	1318478403	/nfs/dbraw/zinc/47/84/03/1318478403.db2.gz	LBPBQUSMIVNPEI-PZJWPPBQSA-N	0	3	347.462	3.037	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(Cl)ccc2F)C1	ZINC001021627956	1318480072	/nfs/dbraw/zinc/48/00/72/1318480072.db2.gz	RAEFTNKZIHBARH-GUYCJALGSA-N	0	3	334.822	3.039	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc3c(cc(C)cc3C)[nH]2)C1	ZINC001021638672	1318495089	/nfs/dbraw/zinc/49/50/89/1318495089.db2.gz	GDDCNIZJGBGDQA-LAUBAEHRSA-N	0	3	349.478	3.344	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc3ccc(C)cc3[nH]2)C1	ZINC001021642058	1318499563	/nfs/dbraw/zinc/49/95/63/1318499563.db2.gz	NUYJDTKJIOJWGD-WIYYLYMNSA-N	0	3	349.478	3.426	20	30		EGEDHN
Cc1ccc(C(=O)N2CCC[C@@H]2CN(C)Cc2cccc(C#N)c2)o1	ZINC000960399934	1318528602	/nfs/dbraw/zinc/52/86/02/1318528602.db2.gz	LFIGXMLDXCXGRY-GOSISDBHSA-N	0	3	337.423	3.196	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(F)ccc2Cl)C1	ZINC001021674601	1318539995	/nfs/dbraw/zinc/53/99/95/1318539995.db2.gz	BVEGITCNIHXWPA-DYVFJYSZSA-N	0	3	334.822	3.039	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(C)cc2F)C1	ZINC001021676670	1318543765	/nfs/dbraw/zinc/54/37/65/1318543765.db2.gz	MBFXHOLBOWGDHR-VQIMIIECSA-N	0	3	328.431	3.084	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cccc(F)c2Cl)C1	ZINC001021677344	1318545363	/nfs/dbraw/zinc/54/53/63/1318545363.db2.gz	QAKKNEIVOTUPCT-WMLDXEAASA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(F)cc(Cl)c2)C1	ZINC001021677151	1318545784	/nfs/dbraw/zinc/54/57/84/1318545784.db2.gz	ORPWBDSKCCNGIO-RDTXWAMCSA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(C)ccc2F)C1	ZINC001021679526	1318549403	/nfs/dbraw/zinc/54/94/03/1318549403.db2.gz	OVBZOEJVLDIFQN-VQIMIIECSA-N	0	3	328.431	3.084	20	30		EGEDHN
C/C(=C/C(=O)N1CCC[C@@H]1CN(C)Cc1cccc(C#N)c1)C1CC1	ZINC000960444901	1318567270	/nfs/dbraw/zinc/56/72/70/1318567270.db2.gz	NHXAJQLNRLPODI-TUOAVLBBSA-N	0	3	337.467	3.337	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC[C@H]1CN(C)Cc1ccc(OCC#N)cc1	ZINC000960455039	1318577320	/nfs/dbraw/zinc/57/73/20/1318577320.db2.gz	ZSKHOHVHKZBXBD-AEFFLSMTSA-N	0	3	343.471	3.058	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)CCc2cc(C)cc(C)c2)C1	ZINC001021708544	1318583949	/nfs/dbraw/zinc/58/39/49/1318583949.db2.gz	FIXDZINOESYPAU-RTWAWAEBSA-N	0	3	338.495	3.182	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cccc3ccsc32)C1	ZINC001021708330	1318584599	/nfs/dbraw/zinc/58/45/99/1318584599.db2.gz	CRSMMLAKGDVOFU-FUHWJXTLSA-N	0	3	338.476	3.461	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(CC(C)C)c[nH]2)C1	ZINC001021718469	1318599140	/nfs/dbraw/zinc/59/91/40/1318599140.db2.gz	YAKWSTHBVOQLMT-ICSRJNTNSA-N	0	3	341.499	3.163	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc3c(c2)CCCC3)C1	ZINC001021726896	1318620375	/nfs/dbraw/zinc/62/03/75/1318620375.db2.gz	HNLXAGMAKFZVCN-SFTDATJTSA-N	0	3	336.479	3.125	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2csc3c2CCCC3)C1	ZINC001021729512	1318630092	/nfs/dbraw/zinc/63/00/92/1318630092.db2.gz	FPERKNNZOIGNIX-YJBOKZPZSA-N	0	3	342.508	3.187	20	30		EGEDHN
CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1CNCc1cc(C#N)cs1	ZINC000813788513	1318631576	/nfs/dbraw/zinc/63/15/76/1318631576.db2.gz	OASTWNQEPLHVLX-STQMWFEESA-N	0	3	339.436	3.057	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(C)c(C)s2)C1	ZINC001021730681	1318632956	/nfs/dbraw/zinc/63/29/56/1318632956.db2.gz	PNEMBFVBUZBQLH-IAGOWNOFSA-N	0	3	330.497	3.315	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)CCc2ccc(C)s2)C1	ZINC001021751702	1318665538	/nfs/dbraw/zinc/66/55/38/1318665538.db2.gz	LCJBRZHFMMAZIV-HKUYNNGSSA-N	0	3	344.524	3.325	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)C1(C(F)F)CC1	ZINC000960644001	1318763667	/nfs/dbraw/zinc/76/36/67/1318763667.db2.gz	UHXDDNNMRLDYKB-INIZCTEOSA-N	0	3	347.409	3.026	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)[C@@H]1CCC1(F)F	ZINC000960692114	1318796344	/nfs/dbraw/zinc/79/63/44/1318796344.db2.gz	HYOZREJHIQKSNA-SJORKVTESA-N	0	3	347.409	3.026	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)C1(C2CC2)CC1	ZINC000960698540	1318799275	/nfs/dbraw/zinc/79/92/75/1318799275.db2.gz	FFXWCDFEFSGJRP-LJQANCHMSA-N	0	3	337.467	3.171	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)C1(F)CCCC1	ZINC000960713602	1318819574	/nfs/dbraw/zinc/81/95/74/1318819574.db2.gz	LOSXUEAQNFXVLH-GOSISDBHSA-N	0	3	343.446	3.263	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)C2(C)CCCCCC2)C1	ZINC001022214255	1318848589	/nfs/dbraw/zinc/84/85/89/1318848589.db2.gz	XLAIWXDLRHORNM-OKILXGFUSA-N	0	3	343.309	3.492	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc(Cl)cc1C(=O)NCC1CC1	ZINC000912300554	1318863707	/nfs/dbraw/zinc/86/37/07/1318863707.db2.gz	JNPNNCDFUVSJFJ-HNNXBMFYSA-N	0	3	349.862	3.102	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]1CN(C)C[C@@H]1CC(C)(C)CO1	ZINC000960789422	1318891478	/nfs/dbraw/zinc/89/14/78/1318891478.db2.gz	WNTZGASKGOAXSK-SJORKVTESA-N	0	3	336.520	3.327	20	30		EGEDHN
Cc1cocc1C(=O)N1CCC[C@@H]1CN(C)Cc1cccc(C#N)c1	ZINC000960810471	1318927216	/nfs/dbraw/zinc/92/72/16/1318927216.db2.gz	OARAVONLCMVYDZ-GOSISDBHSA-N	0	3	337.423	3.196	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@H]2CCc3c2cccc3Cl)C1	ZINC001022440373	1318942175	/nfs/dbraw/zinc/94/21/75/1318942175.db2.gz	OEGXTVREOPRCRY-ZOWXZIJZSA-N	0	3	339.266	3.359	20	30		EGEDHN
C=C(C)CN1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)c1cc2cc(Cl)ccc2o1	ZINC000960890804	1319029486	/nfs/dbraw/zinc/02/94/86/1319029486.db2.gz	IGJPQRPWNXWRIR-HALDLXJZSA-N	0	3	330.815	3.322	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)Cc2c(C)[nH]c3ccccc32)C1	ZINC001022631545	1319030226	/nfs/dbraw/zinc/03/02/26/1319030226.db2.gz	HOKGXFNTNAVGMJ-OKILXGFUSA-N	0	3	331.847	3.008	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CCC[C@H]1CN(C)Cc1cccc(C#N)c1	ZINC000960904500	1319047135	/nfs/dbraw/zinc/04/71/35/1319047135.db2.gz	HBQWUMSPJUDKKY-APWZRJJASA-N	0	3	327.472	3.273	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)c2cc(Cl)cs2)C1	ZINC001022803955	1319117353	/nfs/dbraw/zinc/11/73/53/1319117353.db2.gz	NGJLHICZBJLDGX-AOOOYVTPSA-N	0	3	349.681	3.161	20	30		EGEDHN
C[C@H]1[C@@H](OC(=O)c2cccc(C#N)n2)CCCN1Cc1ccccc1	ZINC000816468531	1319160995	/nfs/dbraw/zinc/16/09/95/1319160995.db2.gz	ITERPRQEJPFPIM-KXBFYZLASA-N	0	3	335.407	3.163	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2csc3c2CC[C@H](C)C3)C1	ZINC001023051778	1319239775	/nfs/dbraw/zinc/23/97/75/1319239775.db2.gz	KGJAWANZBJQJBT-WCFLWFBJSA-N	0	3	338.904	3.476	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]([C@@H]2CCN(Cc3conc3C)C2)C1	ZINC000961223248	1319350755	/nfs/dbraw/zinc/35/07/55/1319350755.db2.gz	AJLJNSGYPNJHQM-DLBZAZTESA-N	0	3	345.487	3.256	20	30		EGEDHN
CC(=O)N1CCC([C@H]2CCCN(Cc3ccc(C#N)cc3F)C2)CC1	ZINC000961308827	1319467580	/nfs/dbraw/zinc/46/75/80/1319467580.db2.gz	TYDUMZULBYMCJT-SFHVURJKSA-N	0	3	343.446	3.168	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@H]1CCCN(CCC(F)(F)F)C1	ZINC001023416357	1319520442	/nfs/dbraw/zinc/52/04/42/1319520442.db2.gz	XXBQHQVMTYSMDR-CQSZACIVSA-N	0	3	343.393	3.068	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc(CC(C)C)s2)C1	ZINC001023415174	1319521176	/nfs/dbraw/zinc/52/11/76/1319521176.db2.gz	JIMDTSBGZLCBBH-MRXNPFEDSA-N	0	3	332.513	3.412	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCC([C@@H]2CCCN(CCF)C2)CC1	ZINC000961372266	1319526942	/nfs/dbraw/zinc/52/69/42/1319526942.db2.gz	AOHCZFCRRQFEHK-GOSISDBHSA-N	0	3	347.478	3.208	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC([C@@H]3CCCN(CCF)C3)CC2)cc1	ZINC000961394514	1319550956	/nfs/dbraw/zinc/55/09/56/1319550956.db2.gz	RZUHFFGFTUBAOB-HXUWFJFHSA-N	0	3	342.458	3.202	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2coc3cc(F)ccc23)C1	ZINC001023454473	1319558149	/nfs/dbraw/zinc/55/81/49/1319558149.db2.gz	WWENXBPVMSWTFM-CQSZACIVSA-N	0	3	328.387	3.037	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc3ccccc3s2)C1	ZINC001023470033	1319567700	/nfs/dbraw/zinc/56/77/00/1319567700.db2.gz	QXUJQUHFNJWVKS-OAHLLOKOSA-N	0	3	326.465	3.366	20	30		EGEDHN
C#CCN(C)CCCNC(=O)C1(c2ccc(Cl)cc2)CCCC1	ZINC000818611919	1319569388	/nfs/dbraw/zinc/56/93/88/1319569388.db2.gz	IKVSVUMTYLIREX-UHFFFAOYSA-N	0	3	332.875	3.223	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCCN(Cc3cnccc3C)C2)cc1	ZINC001023527452	1319634498	/nfs/dbraw/zinc/63/44/98/1319634498.db2.gz	VBUHHBYKSQDZEB-LJQANCHMSA-N	0	3	347.462	3.013	20	30		EGEDHN
CC1(C(=O)N[C@@H]2[C@H]3CN(Cc4ccc(C#N)cc4)C[C@H]32)CCCCC1	ZINC000961674034	1319689602	/nfs/dbraw/zinc/68/96/02/1319689602.db2.gz	IDHBODWXZZYVOG-BWTSREIZSA-N	0	3	337.467	3.075	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H](CNC(=O)C3CC4(CC4)C3)C2)cc1	ZINC001023579452	1319696884	/nfs/dbraw/zinc/69/68/84/1319696884.db2.gz	GMVDUZFUPNWXFB-GOSISDBHSA-N	0	3	337.467	3.077	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)NC[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001023580551	1319702597	/nfs/dbraw/zinc/70/25/97/1319702597.db2.gz	PBCVBGMOWDQURM-VAMGGRTRSA-N	0	3	339.483	3.323	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cccc3ccsc32)C1	ZINC001023685931	1319801969	/nfs/dbraw/zinc/80/19/69/1319801969.db2.gz	MZFKDJXATMQNRC-OAHLLOKOSA-N	0	3	326.465	3.366	20	30		EGEDHN
C=CCN1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@H]1c1cccc2ccccc21	ZINC000962074573	1319817844	/nfs/dbraw/zinc/81/78/44/1319817844.db2.gz	MEUXBGBFWJJDLF-QGLKVJOYSA-N	0	3	332.447	3.176	20	30		EGEDHN
N#Cc1ccc(NC(=O)NC[C@@H]2CCCCN2C2CC2)c(Cl)c1	ZINC000930433801	1328853509	/nfs/dbraw/zinc/85/35/09/1328853509.db2.gz	CMWIUTIRRFBWBY-AWEZNQCLSA-N	0	3	332.835	3.350	20	30		EGEDHN
Cc1oc(-c2ccccc2)nc1C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000917508902	1319825140	/nfs/dbraw/zinc/82/51/40/1319825140.db2.gz	HWXQRDRNVXSDHA-AWEZNQCLSA-N	0	3	346.346	3.006	20	30		EGEDHN
C#CCN1CCC[C@@H](CNC(=O)c2coc3ccc(Cl)cc23)C1	ZINC001023725940	1319864250	/nfs/dbraw/zinc/86/42/50/1319864250.db2.gz	UIENUXXSEMILLZ-ZDUSSCGKSA-N	0	3	330.815	3.161	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cccc(OCC(C)C)c2)C1	ZINC001023738556	1319883701	/nfs/dbraw/zinc/88/37/01/1319883701.db2.gz	CKDFOIRFJWVRJV-SFHVURJKSA-N	0	3	342.483	3.187	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc(COC(C)C)cc2)C1	ZINC001023740318	1319885763	/nfs/dbraw/zinc/88/57/63/1319885763.db2.gz	DXCWYIYUQMKJNK-IBGZPJMESA-N	0	3	342.483	3.077	20	30		EGEDHN
C#C[C@@H](NC(=O)N[C@H](CN(C)C)c1ccc(F)cc1)c1ccccc1	ZINC000820591768	1319917463	/nfs/dbraw/zinc/91/74/63/1319917463.db2.gz	WVOMAYAXAYOOMK-RTBURBONSA-N	0	3	339.414	3.102	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2coc(C3CCCCC3)n2)C1	ZINC001023769736	1319917746	/nfs/dbraw/zinc/91/77/46/1319917746.db2.gz	DQIRORVNPPLTRM-INIZCTEOSA-N	0	3	343.471	3.187	20	30		EGEDHN
C#C[C@H](CCC)NC(=O)N(Cc1ccccc1)C1CCN(C)CC1	ZINC000820647088	1319928038	/nfs/dbraw/zinc/92/80/38/1319928038.db2.gz	NKOMZZUDJQTCQH-GOSISDBHSA-N	0	3	327.472	3.094	20	30		EGEDHN
C#C[C@H](NC(=O)N(CCN(C)C)C(C)C)c1ccc(Cl)cc1F	ZINC000820743923	1319943853	/nfs/dbraw/zinc/94/38/53/1319943853.db2.gz	ANXPYMFWLLVDLQ-INIZCTEOSA-N	0	3	339.842	3.135	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H]2[C@H]3CN(Cc4ccc(C#N)cc4)C[C@H]32)cc1C	ZINC000962454027	1319968024	/nfs/dbraw/zinc/96/80/24/1319968024.db2.gz	APSIPYACBWPZEN-AERCQKQUSA-N	0	3	345.446	3.035	20	30		EGEDHN
CN(C(=O)C#Cc1cccs1)C1CCN(Cc2ccccc2)CC1	ZINC000825909637	1320370103	/nfs/dbraw/zinc/37/01/03/1320370103.db2.gz	DGDNITDDEPCZEZ-UHFFFAOYSA-N	0	3	338.476	3.223	20	30		EGEDHN
O=C(C#CC1CC1)N(CCN1CCCC1)Cc1ccc(Cl)cc1	ZINC000837401322	1320611077	/nfs/dbraw/zinc/61/10/77/1320611077.db2.gz	FRDHGPRQQQZKGW-UHFFFAOYSA-N	0	3	330.859	3.178	20	30		EGEDHN
CN(CCOC(=O)CSc1ccc(C#N)cc1)Cc1ccccc1	ZINC000837502285	1320630460	/nfs/dbraw/zinc/63/04/60/1320630460.db2.gz	IZSGRGSYOOBPTQ-UHFFFAOYSA-N	0	3	340.448	3.326	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N1CCCCC[C@@H]1c1ccc(C)o1	ZINC000838622806	1320796238	/nfs/dbraw/zinc/79/62/38/1320796238.db2.gz	OIMORNCMMVYCID-QGZVFWFLSA-N	0	3	331.460	3.170	20	30		EGEDHN
COC(=O)[C@@]1(C(F)(F)F)CCN(CCC2(C#N)CCCCC2)C1	ZINC000839601136	1320943607	/nfs/dbraw/zinc/94/36/07/1320943607.db2.gz	NESRNWSMGMJARK-OAHLLOKOSA-N	0	3	332.366	3.278	20	30		EGEDHN
C#CCOc1ccc(CNCc2cn(C)nc2-c2ccc(C)o2)cc1	ZINC000842708685	1321422209	/nfs/dbraw/zinc/42/22/09/1321422209.db2.gz	OAZALXOFSVTUQU-UHFFFAOYSA-N	0	3	335.407	3.290	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C(C)C)[C@@H]2CCN(Cc3ccccc3)C2)nc1	ZINC000843695468	1321536663	/nfs/dbraw/zinc/53/66/63/1321536663.db2.gz	BFPFBXLYTRWOMN-HXUWFJFHSA-N	0	3	347.462	3.188	20	30		EGEDHN
N#CCOc1cccc(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)c1	ZINC000844339039	1321591710	/nfs/dbraw/zinc/59/17/10/1321591710.db2.gz	WILGKTKQFIGZGV-ZIAGYGMSSA-N	0	3	342.317	3.275	20	30		EGEDHN
C#CCOc1cccc(NC(=O)C(C[C@@H]2CCCO2)C(F)(F)F)c1	ZINC000844380189	1321596249	/nfs/dbraw/zinc/59/62/49/1321596249.db2.gz	YPBCIJGJTLCMTQ-LSDHHAIUSA-N	0	3	341.329	3.385	20	30		EGEDHN
C[C@H](COCC(=O)C(C#N)C(=O)Nc1ccccc1)c1ccccc1	ZINC000845442145	1321708307	/nfs/dbraw/zinc/70/83/07/1321708307.db2.gz	KKGKWWMJXNDULH-CRAIPNDOSA-N	0	3	336.391	3.154	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)O[C@@H](c1ccccc1F)C(C)[N+](=O)[O-]	ZINC000845880050	1321750062	/nfs/dbraw/zinc/75/00/62/1321750062.db2.gz	KJHGLYJLJDRXRS-BJOHPYRUSA-N	0	3	332.287	3.162	20	30		EGEDHN
C#CCCCCCC(=O)N1CCN(c2ccnc3ccccc32)CC1	ZINC000846652587	1321798832	/nfs/dbraw/zinc/79/88/32/1321798832.db2.gz	QSZLFZXCJYYMMC-UHFFFAOYSA-N	0	3	335.451	3.467	20	30		EGEDHN
COC[C@H](C)CC(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847748902	1321900868	/nfs/dbraw/zinc/90/08/68/1321900868.db2.gz	KEGSFXRLGAYIEC-QGZVFWFLSA-N	0	3	344.455	3.008	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccccc2OCC#N)C1	ZINC000919821289	1322109106	/nfs/dbraw/zinc/10/91/06/1322109106.db2.gz	AFLABAQHJACVKV-AEFFLSMTSA-N	0	3	349.434	3.154	20	30		EGEDHN
COc1ccc(CNCc2ccc(O[C@H]3CCOC3)cc2)cc1C#N	ZINC000850221783	1322208365	/nfs/dbraw/zinc/20/83/65/1322208365.db2.gz	NPRPFZYCMSCLHG-IBGZPJMESA-N	0	3	338.407	3.024	20	30		EGEDHN
Cc1ncc(CCNCc2cc(C#N)ccc2Br)s1	ZINC000921913369	1322422542	/nfs/dbraw/zinc/42/25/42/1322422542.db2.gz	HVMUPANARZWZDA-UHFFFAOYSA-N	0	3	336.258	3.418	20	30		EGEDHN
CCC(CC)(CO)CNCc1cc(C#N)ccc1Br	ZINC000921926728	1322424404	/nfs/dbraw/zinc/42/44/04/1322424404.db2.gz	CVIHSSFUFOISIM-UHFFFAOYSA-N	0	3	325.250	3.209	20	30		EGEDHN
C#CCCN1CC[C@@H](C(F)(F)F)[C@H](CNC(=O)OC(C)(C)C)C1	ZINC000859606239	1329032801	/nfs/dbraw/zinc/03/28/01/1329032801.db2.gz	LZTNNHOELZWDQO-CHWSQXEVSA-N	0	3	334.382	3.035	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H](CNCc2ncc(C)s2)C1	ZINC001024090285	1323122935	/nfs/dbraw/zinc/12/29/35/1323122935.db2.gz	GVUUEJFXHFKEMN-OAHLLOKOSA-N	0	3	335.517	3.382	20	30		EGEDHN
CO[C@@H]1CC[C@@H](N2CCN([C@@H](C#N)c3cccc(Cl)c3)CC2)C1	ZINC000851998401	1323129498	/nfs/dbraw/zinc/12/94/98/1323129498.db2.gz	HKIDNAJGKZFDKX-KURKYZTESA-N	0	3	333.863	3.090	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H](CNCc3nc(C)cs3)C2)C1	ZINC001024146286	1323171872	/nfs/dbraw/zinc/17/18/72/1323171872.db2.gz	ROPMGSRZHFVDHU-OAHLLOKOSA-N	0	3	333.501	3.136	20	30		EGEDHN
CN(Cc1ccc(F)c(C#N)c1)CC(C)(C)NC(=O)OC(C)(C)C	ZINC000852307968	1323176804	/nfs/dbraw/zinc/17/68/04/1323176804.db2.gz	PIUBCWAXXUWOHN-UHFFFAOYSA-N	0	3	335.423	3.432	20	30		EGEDHN
C=CCN(C[C@@H](O)c1ccc(F)c(Br)c1)[C@@H](C)COC	ZINC000852356297	1323181959	/nfs/dbraw/zinc/18/19/59/1323181959.db2.gz	AGKJNSUEPMCDEH-XHDPSFHLSA-N	0	3	346.240	3.145	20	30		EGEDHN
C=CCN(C[C@H](O)c1ccccc1Br)[C@@H](C)COC	ZINC000852356449	1323182260	/nfs/dbraw/zinc/18/22/60/1323182260.db2.gz	FFJPAMOSERAZCU-WFASDCNBSA-N	0	3	328.250	3.005	20	30		EGEDHN
CCCCCCCCCNC(=O)NC1CCN([C@@H]2CCOC2)CC1	ZINC000852637377	1323220577	/nfs/dbraw/zinc/22/05/77/1323220577.db2.gz	WGORACDAWJGHAL-GOSISDBHSA-N	0	3	339.524	3.290	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)c2ccncc2)C1	ZINC000963242985	1323250072	/nfs/dbraw/zinc/25/00/72/1323250072.db2.gz	HIPWRKSWWMBLML-DLBZAZTESA-N	0	3	333.863	3.151	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cn(C(C)(C)C)nc1C	ZINC001024436183	1323395804	/nfs/dbraw/zinc/39/58/04/1323395804.db2.gz	ABKLMQBAZDZVEA-MRXNPFEDSA-N	0	3	332.492	3.107	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1cscc1C(F)F	ZINC001024442601	1323403523	/nfs/dbraw/zinc/40/35/23/1323403523.db2.gz	SHXWZODNZLPSJR-LBPRGKRZSA-N	0	3	326.412	3.293	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1coc2c1cccc2OC	ZINC001024441121	1323404231	/nfs/dbraw/zinc/40/42/31/1323404231.db2.gz	YMKQLJJUTJCSDB-HNNXBMFYSA-N	0	3	340.423	3.049	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccc(F)c(C(F)F)c1	ZINC001024441225	1323404553	/nfs/dbraw/zinc/40/45/53/1323404553.db2.gz	BDFAIAKBSNCBDV-AWEZNQCLSA-N	0	3	338.373	3.371	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@@H]1CCCN1c1ccccc1	ZINC001024471714	1323427095	/nfs/dbraw/zinc/42/70/95/1323427095.db2.gz	KMJHJBNMIJLCHP-UXHICEINSA-N	0	3	341.499	3.202	20	30		EGEDHN
C=C(C)CCN1CCCC[C@H]1CNC(=O)c1cn2cc(C)nc2s1	ZINC001024479861	1323433265	/nfs/dbraw/zinc/43/32/65/1323433265.db2.gz	RWVZLHKAKZQYOT-HNNXBMFYSA-N	0	3	346.500	3.255	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@@H]1CCN(C)c2ccccc21	ZINC001024484006	1323437959	/nfs/dbraw/zinc/43/79/59/1323437959.db2.gz	IFQWHEYFBTZSKJ-PKOBYXMFSA-N	0	3	341.499	3.157	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccnn1-c1ccccc1	ZINC001024509120	1323457832	/nfs/dbraw/zinc/45/78/32/1323457832.db2.gz	RFSGLJVYUJYJRM-SFHVURJKSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1[nH]nc2ccc(C)cc21	ZINC001024526463	1323473016	/nfs/dbraw/zinc/47/30/16/1323473016.db2.gz	AAOTYCBEEXTIHI-OAHLLOKOSA-N	0	3	326.444	3.032	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@H]1CCOc2c(F)cccc21	ZINC001024546242	1323487053	/nfs/dbraw/zinc/48/70/53/1323487053.db2.gz	WBKADODFINDBMV-RDJZCZTQSA-N	0	3	346.446	3.239	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@H]1CCc2ccc(F)cc2O1	ZINC001024554396	1323495790	/nfs/dbraw/zinc/49/57/90/1323495790.db2.gz	LSCXSYAYXMXQSC-QZTJIDSGSA-N	0	3	346.446	3.066	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1csc(-c2ccco2)n1	ZINC001024624336	1323552062	/nfs/dbraw/zinc/55/20/62/1323552062.db2.gz	PSTOUVGTELPCLS-CQSZACIVSA-N	0	3	343.452	3.011	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@H]1CCOc2ccccc21	ZINC001024712381	1323619286	/nfs/dbraw/zinc/61/92/86/1323619286.db2.gz	WINMZLVIQZARNS-WMZOPIPTSA-N	0	3	328.456	3.100	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccnc(C(F)(F)F)c1	ZINC001024744077	1323642898	/nfs/dbraw/zinc/64/28/98/1323642898.db2.gz	XGATZWPHKKUKDI-CQSZACIVSA-N	0	3	341.377	3.261	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccc(C(F)(F)F)cc1	ZINC001024774329	1323674573	/nfs/dbraw/zinc/67/45/73/1323674573.db2.gz	QQOZTMANJYHDSS-MRXNPFEDSA-N	0	3	338.373	3.313	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1cc(C)c(F)cc1Cl	ZINC001024781574	1323685512	/nfs/dbraw/zinc/68/55/12/1323685512.db2.gz	YIXVUBDUIOMAHE-AWEZNQCLSA-N	0	3	336.838	3.395	20	30		EGEDHN
Cc1ccc(CNC[C@H]2CCCCN2C(=O)[C@H](C)C#N)c(Cl)c1	ZINC001024901817	1323772057	/nfs/dbraw/zinc/77/20/57/1323772057.db2.gz	AFINTAGZLTTWCQ-GDBMZVCRSA-N	0	3	333.863	3.279	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)/C=C\C2CC2)s1	ZINC001024910325	1323776920	/nfs/dbraw/zinc/77/69/20/1323776920.db2.gz	MLXQXAHWLRSXLI-WUKHSURWSA-N	0	3	329.469	3.057	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001024918745	1323783022	/nfs/dbraw/zinc/78/30/22/1323783022.db2.gz	OCYPAMJCNMECPI-MFWALYKBSA-N	0	3	329.419	3.134	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)[C@]23C[C@H]2CCC3)s1	ZINC001025024516	1323830810	/nfs/dbraw/zinc/83/08/10/1323830810.db2.gz	NIHBGZCMYXQODJ-ZRGWGRIASA-N	0	3	343.496	3.281	20	30		EGEDHN
CC1(C(=O)N2CCCC[C@H]2CNCc2ccc(C#N)s2)CCC1	ZINC001025045282	1323848885	/nfs/dbraw/zinc/84/88/85/1323848885.db2.gz	WADKZXMPDVCGHH-AWEZNQCLSA-N	0	3	331.485	3.281	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCCC[C@@H]1CNCc1cncc(F)c1	ZINC001025069358	1323870596	/nfs/dbraw/zinc/87/05/96/1323870596.db2.gz	IVDHHIQJIJCDHN-IEBWSBKVSA-N	0	3	333.451	3.294	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)c(F)c1	ZINC001025101484	1323895329	/nfs/dbraw/zinc/89/53/29/1323895329.db2.gz	CLXVBDRRMDQXTC-CRAIPNDOSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(Cl)c[nH]1	ZINC001025198628	1323981827	/nfs/dbraw/zinc/98/18/27/1323981827.db2.gz	QPTLOQKXCZLZKL-IRXDYDNUSA-N	0	3	333.863	3.151	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc(Cl)o1	ZINC001025199573	1323982602	/nfs/dbraw/zinc/98/26/02/1323982602.db2.gz	XNSZPHBYTPRZNH-LSDHHAIUSA-N	0	3	334.847	3.415	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)CCc1ccco1	ZINC001025200616	1323985552	/nfs/dbraw/zinc/98/55/52/1323985552.db2.gz	FNZUXTMJFNSJKP-RBUKOAKNSA-N	0	3	328.456	3.081	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)CCc1ccoc1	ZINC001025217474	1324010055	/nfs/dbraw/zinc/01/00/55/1324010055.db2.gz	DCAJGNBYDAKGCK-RTBURBONSA-N	0	3	328.456	3.081	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1c(F)cncc1F	ZINC001025238584	1324029337	/nfs/dbraw/zinc/02/93/37/1324029337.db2.gz	SSOBPCCXEMZPDO-CVEARBPZSA-N	0	3	335.398	3.005	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc2occc2[nH]1	ZINC001025238627	1324029821	/nfs/dbraw/zinc/02/98/21/1324029821.db2.gz	UFMBTVLVTQNPIA-ZWKOTPCHSA-N	0	3	339.439	3.243	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)CC1CC(F)(F)C1	ZINC001025243190	1324038592	/nfs/dbraw/zinc/03/85/92/1324038592.db2.gz	AOUDWOVAGUCYIT-SJORKVTESA-N	0	3	338.442	3.291	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1[nH]c(C)cc1C	ZINC001025244049	1324040286	/nfs/dbraw/zinc/04/02/86/1324040286.db2.gz	GKZGPTKXFDPAGT-ROUUACIJSA-N	0	3	327.472	3.114	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ncc(F)cc1F	ZINC001025246346	1324046093	/nfs/dbraw/zinc/04/60/93/1324046093.db2.gz	WCXGHJNYIAIBLB-JKSUJKDBSA-N	0	3	335.398	3.005	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc(C)c(OC)c1	ZINC001025250031	1324050544	/nfs/dbraw/zinc/05/05/44/1324050544.db2.gz	GNUQDCKFHBATCO-OALUTQOASA-N	0	3	340.467	3.096	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc(C)c(OC)c1	ZINC001025250030	1324050950	/nfs/dbraw/zinc/05/09/50/1324050950.db2.gz	GNUQDCKFHBATCO-MOPGFXCFSA-N	0	3	340.467	3.096	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)C1(C2CC2)CCC1	ZINC001025254154	1324059823	/nfs/dbraw/zinc/05/98/23/1324059823.db2.gz	DZTHJDKMHFENPP-OALUTQOASA-N	0	3	328.500	3.436	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)CCc1cccc(C)c1	ZINC001025254920	1324061217	/nfs/dbraw/zinc/06/12/17/1324061217.db2.gz	NFDKFZMAJLUWQM-NHCUHLMSSA-N	0	3	338.495	3.406	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(C(C)C)on1	ZINC001025255475	1324063252	/nfs/dbraw/zinc/06/32/52/1324063252.db2.gz	QTDCKNIFKNAADG-DLBZAZTESA-N	0	3	331.460	3.443	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc(F)c(C)c1	ZINC001025261895	1324073048	/nfs/dbraw/zinc/07/30/48/1324073048.db2.gz	YZLHMNPRDNZCTE-RBUKOAKNSA-N	0	3	328.431	3.226	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(C)cc(F)c1	ZINC001025272144	1324087480	/nfs/dbraw/zinc/08/74/80/1324087480.db2.gz	KJMXJEGEMFGIDD-RBUKOAKNSA-N	0	3	328.431	3.226	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(C)ccc1F	ZINC001025274372	1324091528	/nfs/dbraw/zinc/09/15/28/1324091528.db2.gz	XLCYSUUDOHYRLS-RTBURBONSA-N	0	3	328.431	3.226	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)Cc1ccsc1C	ZINC001025279071	1324100466	/nfs/dbraw/zinc/10/04/66/1324100466.db2.gz	YHGAPNRXCOEVTG-RBUKOAKNSA-N	0	3	344.524	3.468	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(CCC)on1	ZINC001025283880	1324104150	/nfs/dbraw/zinc/10/41/50/1324104150.db2.gz	BZMXMOLJGBPCKZ-RBUKOAKNSA-N	0	3	343.471	3.110	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1coc(CC2CC2)n1	ZINC001025288155	1324110618	/nfs/dbraw/zinc/11/06/18/1324110618.db2.gz	SKKQFFGHCOEMDX-ZWKOTPCHSA-N	0	3	343.471	3.272	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ncccc1Cl	ZINC001025293592	1324120072	/nfs/dbraw/zinc/12/00/72/1324120072.db2.gz	SAWGEMMZSFCYOQ-IRXDYDNUSA-N	0	3	345.874	3.217	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cccc2cnccc21	ZINC001025296392	1324127702	/nfs/dbraw/zinc/12/77/02/1324127702.db2.gz	SVNUIGXVNCCZIE-RTWAWAEBSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)Cc1sc(C)cc1C	ZINC001025297049	1324129239	/nfs/dbraw/zinc/12/92/39/1324129239.db2.gz	NTZJFRAXBCAYJF-QZTJIDSGSA-N	0	3	344.524	3.386	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)C12CCC(CC1)CC2	ZINC001025302916	1324136338	/nfs/dbraw/zinc/13/63/38/1324136338.db2.gz	YWXXBXCNOXAGBC-XTBIFASLSA-N	0	3	328.500	3.436	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1c(C)nsc1C	ZINC001025302129	1324136411	/nfs/dbraw/zinc/13/64/11/1324136411.db2.gz	RYFWNGHCRDGJCW-CVEARBPZSA-N	0	3	333.501	3.405	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ncccc1OCC	ZINC001025303506	1324137603	/nfs/dbraw/zinc/13/76/03/1324137603.db2.gz	HZMAZOQERJKAAW-DLBZAZTESA-N	0	3	343.471	3.125	20	30		EGEDHN
C#CCCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc(F)s1	ZINC001025303558	1324137883	/nfs/dbraw/zinc/13/78/83/1324137883.db2.gz	IJRIYTJBSVRFCT-CABCVRRESA-N	0	3	334.460	3.370	20	30		EGEDHN
C[C@H](NC(=O)C1CC=CC1)[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001025373683	1324212953	/nfs/dbraw/zinc/21/29/53/1324212953.db2.gz	UZISGORCJYTIGA-OXJNMPFZSA-N	0	3	337.467	3.241	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC001025426552	1324261042	/nfs/dbraw/zinc/26/10/42/1324261042.db2.gz	XDVBKJCEQKZBNM-JSGCOSHPSA-N	0	3	338.373	3.227	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2nsc3ccccc32)C1	ZINC001025429092	1324264339	/nfs/dbraw/zinc/26/43/39/1324264339.db2.gz	RMYBTPHPJCMKNK-LSDHHAIUSA-N	0	3	341.480	3.150	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cccc(OCCC)c2)C1	ZINC001025430488	1324265914	/nfs/dbraw/zinc/26/59/14/1324265914.db2.gz	FKDPJENHLJCQID-HKUYNNGSSA-N	0	3	342.483	3.329	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cncc(-c3ccccc3)c2)C1	ZINC001025432960	1324272246	/nfs/dbraw/zinc/27/22/46/1324272246.db2.gz	KVVDATNTAJKVDH-PKOBYXMFSA-N	0	3	347.462	3.212	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccnn2C(CC)CC)C1	ZINC001025443909	1324286760	/nfs/dbraw/zinc/28/67/60/1324286760.db2.gz	VKUYQIMUCAVQPI-IAGOWNOFSA-N	0	3	344.503	3.098	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccccc2C(C)(C)C)C1	ZINC001025450747	1324293562	/nfs/dbraw/zinc/29/35/62/1324293562.db2.gz	MMPDNZGIVLJJOP-IAGOWNOFSA-N	0	3	326.484	3.448	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2[nH]c3ccccc3c2Cl)C1	ZINC001025469490	1324314897	/nfs/dbraw/zinc/31/48/97/1324314897.db2.gz	PVHLSRGHCFFZQQ-ZIAGYGMSSA-N	0	3	343.858	3.285	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(C(C)C)cn2)C1	ZINC001025531291	1324377071	/nfs/dbraw/zinc/37/70/71/1324377071.db2.gz	OZTPXBKJOPBWRT-FUHWJXTLSA-N	0	3	327.472	3.059	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)C2CCC(F)(F)CC2)C1	ZINC001025537669	1324383930	/nfs/dbraw/zinc/38/39/30/1324383930.db2.gz	BAFKCCDHWNETHR-HOCLYGCPSA-N	0	3	326.431	3.052	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(F)ccc2Cl)C1	ZINC001025540613	1324389255	/nfs/dbraw/zinc/38/92/55/1324389255.db2.gz	XYEBLNUYRHLRIM-ZIAGYGMSSA-N	0	3	336.838	3.333	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(C(C)(C)C)oc2C)C1	ZINC001025545599	1324392798	/nfs/dbraw/zinc/39/27/98/1324392798.db2.gz	KINKIYAXYCVGQI-ZBFHGGJFSA-N	0	3	330.472	3.349	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc3cc(F)ccc3o2)C1	ZINC001025548878	1324397790	/nfs/dbraw/zinc/39/77/90/1324397790.db2.gz	KVXWUFCVKXXZBH-ZIAGYGMSSA-N	0	3	328.387	3.035	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cccc(-c3ccoc3)c2)C1	ZINC001025590891	1324436742	/nfs/dbraw/zinc/43/67/42/1324436742.db2.gz	UKZUMOKFCYFDEW-APWZRJJASA-N	0	3	336.435	3.410	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccccc2OC(C)C)C1	ZINC001025600966	1324448524	/nfs/dbraw/zinc/44/85/24/1324448524.db2.gz	PLMKWFOEMNYCJV-QZTJIDSGSA-N	0	3	342.483	3.327	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccccc2C(F)(F)F)C1	ZINC001025601532	1324448763	/nfs/dbraw/zinc/44/87/63/1324448763.db2.gz	BYFJPNOUQADWSO-KGLIPLIRSA-N	0	3	338.373	3.169	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccccc2C(F)(F)F)C1	ZINC001025601534	1324448916	/nfs/dbraw/zinc/44/89/16/1324448916.db2.gz	BYFJPNOUQADWSO-UONOGXRCSA-N	0	3	338.373	3.169	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)C23CC4CC(CC(C4)C2)C3)C1	ZINC001025610068	1324460964	/nfs/dbraw/zinc/46/09/64/1324460964.db2.gz	RBGIBWAIBISLRQ-GPABEBMESA-N	0	3	342.527	3.443	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc3c(c2)CCCC3)C1	ZINC001025611653	1324464252	/nfs/dbraw/zinc/46/42/52/1324464252.db2.gz	NQJVHACSDSDHAO-UWJYYQICSA-N	0	3	338.495	3.419	20	30		EGEDHN
N#Cc1ccccc1CNC1CCC(NC(=O)C2C=CC=CC=C2)CC1	ZINC001026502167	1324852260	/nfs/dbraw/zinc/85/22/60/1324852260.db2.gz	SFFFYBGPSQVSNQ-UHFFFAOYSA-N	0	3	347.462	3.374	20	30		EGEDHN
N#Cc1ccccc1CNC1CCC(NC(=O)[C@H]2C[C@H]3C[C@H]3C2)CC1	ZINC001026546544	1324884599	/nfs/dbraw/zinc/88/45/99/1324884599.db2.gz	XYTRICZXJNIQLV-KMDXPDORSA-N	0	3	337.467	3.121	20	30		EGEDHN
N#Cc1ccccc1CNC1CCC(NC(=O)[C@@H]2CC23CCC3)CC1	ZINC001026569554	1324902982	/nfs/dbraw/zinc/90/29/82/1324902982.db2.gz	ZQDCUVVFVNJBSO-ACBHZAAOSA-N	0	3	337.467	3.265	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@@H](CNCc3ccccc3C#N)C2)c(C)o1	ZINC001026677248	1324968628	/nfs/dbraw/zinc/96/86/28/1324968628.db2.gz	VWNACNMPPQPXQQ-INIZCTEOSA-N	0	3	337.423	3.020	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1CC[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001026864554	1325053256	/nfs/dbraw/zinc/05/32/56/1325053256.db2.gz	JSWQEMOVKZLCMN-HNNXBMFYSA-N	0	3	345.462	3.318	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCN(C(=O)C2(C3CC3)CCC2)C1	ZINC001026976462	1325119267	/nfs/dbraw/zinc/11/92/67/1325119267.db2.gz	YQXFPMQXPIHNKO-MRXNPFEDSA-N	0	3	337.467	3.077	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)C2(C3CC3)CCC2)C1	ZINC001026976461	1325119406	/nfs/dbraw/zinc/11/94/06/1325119406.db2.gz	YQXFPMQXPIHNKO-INIZCTEOSA-N	0	3	337.467	3.077	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](CNCc2cc(C3CC3)no2)C1	ZINC001026988628	1325127357	/nfs/dbraw/zinc/12/73/57/1325127357.db2.gz	LMCVKEQQBJLMRZ-CQSZACIVSA-N	0	3	331.460	3.092	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001027038786	1325173338	/nfs/dbraw/zinc/17/33/38/1325173338.db2.gz	QUMZNCBLYVBDCS-YWZLYKJASA-N	0	3	343.446	3.238	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H](CNCc2ccn(C(C)C)n2)C1	ZINC001027041162	1325176120	/nfs/dbraw/zinc/17/61/20/1325176120.db2.gz	QJXDYCWHFBPIPM-VQIMIIECSA-N	0	3	332.492	3.004	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)N2CC[C@H](CNCc3ccccc3C#N)C2)CC1	ZINC001027180479	1325278234	/nfs/dbraw/zinc/27/82/34/1325278234.db2.gz	UZGIEWHYDAXXGM-KZNAEPCWSA-N	0	3	339.483	3.323	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)C2CCC=CCC2)C1	ZINC001027222445	1325317981	/nfs/dbraw/zinc/31/79/81/1325317981.db2.gz	GKZDEKFNXZWAMI-KRWDZBQOSA-N	0	3	337.467	3.243	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)C2CCC(NCc3cnc(C)o3)CC2)C1	ZINC000963891407	1325423664	/nfs/dbraw/zinc/42/36/64/1325423664.db2.gz	TUCYWORSXFYPJT-UHFFFAOYSA-N	0	3	331.460	3.199	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)C2CCC(NCc3ocnc3C)CC2)C1	ZINC000963891354	1325424029	/nfs/dbraw/zinc/42/40/29/1325424029.db2.gz	SAZBCSIFDJIUMG-UHFFFAOYSA-N	0	3	331.460	3.199	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC[C@H](N(C)Cc2ccc(OC)c(C#N)c2)C1	ZINC001027305176	1325449129	/nfs/dbraw/zinc/44/91/29/1325449129.db2.gz	JARPQSXDJHVVBC-QAPCUYQASA-N	0	3	343.471	3.036	20	30		EGEDHN
CN(Cc1ccc(F)c(C#N)c1)[C@H]1CCCN(C(=O)/C=C\C2CC2)C1	ZINC001027340916	1325500086	/nfs/dbraw/zinc/50/00/86/1325500086.db2.gz	GTWMTUZCKIHCHM-CNRGFGOASA-N	0	3	341.430	3.086	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)/C=C\c2ccc[nH]2)C1	ZINC001027382322	1325582119	/nfs/dbraw/zinc/58/21/19/1325582119.db2.gz	QQPDRKQUOOCKQJ-PISNEZEASA-N	0	3	348.450	3.023	20	30		EGEDHN
CC[C@H](C)c1ccc(NC(=O)C(C#N)C(=O)C2CC(OC)C2)cc1	ZINC000860472221	1329321377	/nfs/dbraw/zinc/32/13/77/1329321377.db2.gz	FRKZEXBCKBVIRE-JEWKTJRQSA-N	0	3	328.412	3.272	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)C(=O)NCc1ccc(F)cc1F)c1ccco1	ZINC000860692855	1329345035	/nfs/dbraw/zinc/34/50/35/1329345035.db2.gz	XFQMXVPONXTJOX-FZMZJTMJSA-N	0	3	346.333	3.077	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)Cc2ccc(CCCC)cc2)C1	ZINC001027482653	1327736133	/nfs/dbraw/zinc/73/61/33/1327736133.db2.gz	FJWYIBBMVCALQD-FQEVSTJZSA-N	0	3	326.484	3.128	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](N(C)Cc2ccc3c(c2)COC3)C1	ZINC001027522271	1327795890	/nfs/dbraw/zinc/79/58/90/1327795890.db2.gz	VNLPGILNELYNLS-IBGZPJMESA-N	0	3	342.483	3.352	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H](N(C)CCc2ccns2)C1	ZINC001027559541	1327874048	/nfs/dbraw/zinc/87/40/48/1327874048.db2.gz	AMLZOGJRFGBBCC-YJBOKZPZSA-N	0	3	335.517	3.211	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1ccc3c(c1)CCO3)C2	ZINC000965248438	1327953783	/nfs/dbraw/zinc/95/37/83/1327953783.db2.gz	DDZMKBUVYFYPJA-UHFFFAOYSA-N	0	3	346.858	3.005	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)c2csc3c2CC[C@H](C)C3)C1	ZINC001027669842	1328065269	/nfs/dbraw/zinc/06/52/69/1328065269.db2.gz	DJLRMRGAGDOGMY-LSDHHAIUSA-N	0	3	330.497	3.043	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2coc3ccc(CC)cc23)C1	ZINC000966129800	1328200248	/nfs/dbraw/zinc/20/02/48/1328200248.db2.gz	FVMQFLRKOVUFAP-DNVCBOLYSA-N	0	3	338.451	3.459	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2cncc(-c3ccccc3)c2)C1	ZINC000966563464	1328341437	/nfs/dbraw/zinc/34/14/37/1328341437.db2.gz	LKWUEPRUSULSNE-UWJYYQICSA-N	0	3	347.462	3.212	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](C)[C@@H](NC(=O)c2cn3cc(C)nc3s2)C1	ZINC000966718361	1328391839	/nfs/dbraw/zinc/39/18/39/1328391839.db2.gz	CIVMKXXCHBSILV-HIFRSBDPSA-N	0	3	346.500	3.111	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)[C@H]2CC[C@H](C3CCC3)CC2)C1	ZINC000966874180	1328446705	/nfs/dbraw/zinc/44/67/05/1328446705.db2.gz	DCDPUDSICWAODH-FRYIKTPZSA-N	0	3	330.516	3.443	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)Cc2ccc(C)c(Cl)c2)C1	ZINC000966907884	1328468084	/nfs/dbraw/zinc/46/80/84/1328468084.db2.gz	HPVSDLBSYBRKIQ-MAUKXSAKSA-N	0	3	332.875	3.041	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)Cc2cccc3cnccc32)C1	ZINC000966907860	1328468659	/nfs/dbraw/zinc/46/86/59/1328468659.db2.gz	HHLGPFWEAMBEQV-OXJNMPFZSA-N	0	3	337.467	3.180	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1ccc(F)cc1F	ZINC001028042935	1328505691	/nfs/dbraw/zinc/50/56/91/1328505691.db2.gz	BWVTZIVYOPZCEY-HYVNUMGLSA-N	0	3	334.410	3.225	20	30		EGEDHN
Cc1cc(C)nc(CN2CCCN(Cc3ccc(C#N)cc3)CC2)c1	ZINC000929111971	1328508020	/nfs/dbraw/zinc/50/80/20/1328508020.db2.gz	UFSKLJZBCHILIM-UHFFFAOYSA-N	0	3	334.467	3.278	20	30		EGEDHN
C=CCN1CCC(NC(=O)/C=C\c2ccccc2C(F)(F)F)CC1	ZINC000865193217	1329675578	/nfs/dbraw/zinc/67/55/78/1329675578.db2.gz	HWUSAIYGMKWVLM-FPLPWBNLSA-N	0	3	338.373	3.485	20	30		EGEDHN
C=CCN1CCC(NC(=O)C[C@@H](C)Cc2cccc(OC)c2)CC1	ZINC000932141444	1329788260	/nfs/dbraw/zinc/78/82/60/1329788260.db2.gz	ZTQHAHALLIZRPX-INIZCTEOSA-N	0	3	330.472	3.031	20	30		EGEDHN
CC(C)(C)OC(=O)NCC[C@H]1CCN(Cc2ccc(C#N)s2)C1	ZINC000932699609	1329835166	/nfs/dbraw/zinc/83/51/66/1329835166.db2.gz	KWXHZWPLPLNWFQ-ZDUSSCGKSA-N	0	3	335.473	3.356	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](C)[C@H](NCc3c(C)nsc3C)C2)C1	ZINC000939102649	1330376510	/nfs/dbraw/zinc/37/65/10/1330376510.db2.gz	JISIGERJRYDWTR-MLGOLLRUSA-N	0	3	333.501	3.053	20	30		EGEDHN
CC1(C)CN(Cc2cccc(C#N)c2)CC[C@H]1NC(=O)CC1CCC1	ZINC000940635794	1331134405	/nfs/dbraw/zinc/13/44/05/1331134405.db2.gz	VDJDAPMNXBVCFJ-LJQANCHMSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@@H]1CN(Cc2cccc(C#N)c2)CC[C@@H]1NC(=O)C1C=CC=CC=C1	ZINC000942090889	1331824861	/nfs/dbraw/zinc/82/48/61/1331824861.db2.gz	FJVHUUIMQHGYNZ-UTKZUKDTSA-N	0	3	347.462	3.183	20	30		EGEDHN
C[C@H]1CN(Cc2cccc(C#N)c2)CC[C@H]1NC(=O)C1C=CC=CC=C1	ZINC000942090888	1331825078	/nfs/dbraw/zinc/82/50/78/1331825078.db2.gz	FJVHUUIMQHGYNZ-LAUBAEHRSA-N	0	3	347.462	3.183	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2coc3ccc(C)cc23)[C@H](C)C1	ZINC000942093250	1331826423	/nfs/dbraw/zinc/82/64/23/1331826423.db2.gz	ZCWPQWHTWHQVFF-APWZRJJASA-N	0	3	338.451	3.134	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cncc(-c3ccccc3)c2)[C@@H](C)C1	ZINC000942105709	1331832172	/nfs/dbraw/zinc/83/21/72/1331832172.db2.gz	IVYUXCKBMXOCCS-OXJNMPFZSA-N	0	3	335.451	3.375	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cncc(-c3ccccc3)c2)[C@@H](C)C1	ZINC000942105707	1331832466	/nfs/dbraw/zinc/83/24/66/1331832466.db2.gz	IVYUXCKBMXOCCS-JXFKEZNVSA-N	0	3	335.451	3.375	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccccc2-c2ccncc2)[C@@H](C)C1	ZINC000942176393	1331862014	/nfs/dbraw/zinc/86/20/14/1331862014.db2.gz	OXPWFYLVWGZFKZ-LAUBAEHRSA-N	0	3	347.462	3.212	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2occc2-c2ccccc2)[C@@H](C)C1	ZINC000942392701	1331922232	/nfs/dbraw/zinc/92/22/32/1331922232.db2.gz	KAQLKMGWQQDUEG-LPHOPBHVSA-N	0	3	336.435	3.410	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3cccc(C)c3)CCC2)[C@H](C)C1	ZINC000942551386	1331970059	/nfs/dbraw/zinc/97/00/59/1331970059.db2.gz	SJRDESPWJQEILZ-QUCCMNQESA-N	0	3	338.495	3.267	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc(F)c3ccncc23)[C@H](C)C1	ZINC000942574895	1331983507	/nfs/dbraw/zinc/98/35/07/1331983507.db2.gz	OGJYPLHXSCUEBD-ACJLOTCBSA-N	0	3	327.403	3.000	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3ccc(OC)cc3)C[C@H]2C)C1	ZINC000942603220	1332001303	/nfs/dbraw/zinc/00/13/03/1332001303.db2.gz	UFZYRSDRYJLKDJ-VQIMIIECSA-N	0	3	342.483	3.378	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(C)oc2C(F)(F)F)[C@@H](C)C1	ZINC000943209073	1332121887	/nfs/dbraw/zinc/12/18/87/1332121887.db2.gz	ODSKNWOVOSRGOR-GWCFXTLKSA-N	0	3	330.350	3.233	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnc(-c3ccoc3)s2)[C@@H](C)C1	ZINC000943333266	1332151384	/nfs/dbraw/zinc/15/13/84/1332151384.db2.gz	HTYOZWSVEWOBRU-JSGCOSHPSA-N	0	3	331.441	3.029	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(-c3ccccc3)ccn2)[C@H](C)C1	ZINC000943765386	1332258431	/nfs/dbraw/zinc/25/84/31/1332258431.db2.gz	CKEMZEHJEWXOPO-XLIONFOSSA-N	0	3	347.462	3.212	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3ccccc3F)CCC2)[C@@H](C)C1	ZINC000944099224	1332326007	/nfs/dbraw/zinc/32/60/07/1332326007.db2.gz	QHTYPKLJMHABJP-LPHOPBHVSA-N	0	3	342.458	3.097	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnc(-c3ccco3)s2)[C@@H](C)C1	ZINC000944243245	1332353109	/nfs/dbraw/zinc/35/31/09/1332353109.db2.gz	ZUELCZWQPBHLHT-STQMWFEESA-N	0	3	331.441	3.029	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccccc2CC(C)C)[C@@H](C)C1	ZINC000945365125	1332567352	/nfs/dbraw/zinc/56/73/52/1332567352.db2.gz	ILOSGMARIZNNRM-PXNSSMCTSA-N	0	3	326.484	3.349	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@@H]3CCC[C@@H]4C[C@@H]43)CC[C@@H]2C1	ZINC000946652604	1332871170	/nfs/dbraw/zinc/87/11/70/1332871170.db2.gz	YATDDFFIGJCHMK-SFFUCWETSA-N	0	3	336.907	3.346	20	30		EGEDHN
Cc1cncc(C(=O)N[C@@H]2CCN(Cc3cccc(C#N)c3)[C@@H](C)C2)c1	ZINC000947161390	1333029107	/nfs/dbraw/zinc/02/91/07/1333029107.db2.gz	FFNMNHOANYGTTH-OXJNMPFZSA-N	0	3	348.450	3.045	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C3CCCCC3)n[nH]2)C[C@@H]1C	ZINC000947403858	1333116943	/nfs/dbraw/zinc/11/69/43/1333116943.db2.gz	HVCQXZPDPSZIQH-RDJZCZTQSA-N	0	3	342.487	3.063	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2coc3cc(F)ccc23)C[C@H]1C	ZINC000947473915	1333142177	/nfs/dbraw/zinc/14/21/77/1333142177.db2.gz	PLTIRPLHTUPVAW-HIFRSBDPSA-N	0	3	328.387	3.178	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cn(CC)c3ccccc23)C[C@@H]1C	ZINC000947524195	1333157923	/nfs/dbraw/zinc/15/79/23/1333157923.db2.gz	PIGXRFOWSAJDKQ-JKSUJKDBSA-N	0	3	325.456	3.430	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnc3c(F)cccc3c2)C[C@@H]1C	ZINC000947547470	1333167680	/nfs/dbraw/zinc/16/76/80/1333167680.db2.gz	RNOKRTRSRIAXEQ-XJKSGUPXSA-N	0	3	327.403	3.143	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3c(cc(C)cc3C)[nH]2)C[C@@H]1C	ZINC000947586071	1333183006	/nfs/dbraw/zinc/18/30/06/1333183006.db2.gz	VAQFGHMYLDQXDZ-IRXDYDNUSA-N	0	3	337.467	3.391	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3cccc(OC)c3o2)C[C@@H]1C	ZINC000947668576	1333216479	/nfs/dbraw/zinc/21/64/79/1333216479.db2.gz	YDCCGOSISJIPKO-GOEBONIOSA-N	0	3	340.423	3.047	20	30		EGEDHN
Cc1ncccc1C(=O)N[C@@H]1CCN(Cc2ccc(C#N)cc2)[C@H](C)C1	ZINC000947670622	1333217453	/nfs/dbraw/zinc/21/74/53/1333217453.db2.gz	GVFFLIPCMXMIBW-DNVCBOLYSA-N	0	3	348.450	3.045	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccccc2-n2cccc2)C[C@@H]1C	ZINC000947686447	1333223459	/nfs/dbraw/zinc/22/34/59/1333223459.db2.gz	YHZIEBYPQQQSOP-ZWKOTPCHSA-N	0	3	335.451	3.083	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(CCc3csc(C)n3)[C@@H](C)C2)C1	ZINC000947702742	1333232785	/nfs/dbraw/zinc/23/27/85/1333232785.db2.gz	RUNQKZIBOBPMDZ-GOEBONIOSA-N	0	3	347.528	3.319	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)oc2C(F)(F)F)C[C@H]1C	ZINC000947757805	1333252799	/nfs/dbraw/zinc/25/27/99/1333252799.db2.gz	FTSQNINLUMXYTN-YPMHNXCESA-N	0	3	342.361	3.213	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccccc2OC(C)C)C[C@@H]1C	ZINC000947801881	1333265638	/nfs/dbraw/zinc/26/56/38/1333265638.db2.gz	QFPFSHZTFOHSIH-HKUYNNGSSA-N	0	3	342.483	3.009	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc3nc(C)ccc3c2)C[C@H]1C	ZINC000947845204	1333276894	/nfs/dbraw/zinc/27/68/94/1333276894.db2.gz	GOLPHQCIGKOKTI-VQIMIIECSA-N	0	3	335.451	3.149	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(-c3ccccc3)nc2)C[C@H]1C	ZINC000947849968	1333279237	/nfs/dbraw/zinc/27/92/37/1333279237.db2.gz	WIBFJKPVDPZRQO-YLJYHZDGSA-N	0	3	347.462	3.355	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnn(CCCC)c2CC)C[C@@H]1C	ZINC000947908216	1333302269	/nfs/dbraw/zinc/30/22/69/1333302269.db2.gz	QCTARMSTLOASEP-HOTGVXAUSA-N	0	3	332.492	3.014	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C(C)(C)c2ccc(C)cc2)C[C@@H]1C	ZINC000947944525	1333314204	/nfs/dbraw/zinc/31/42/04/1333314204.db2.gz	WRFIRYPMIRMZJQ-HKUYNNGSSA-N	0	3	326.484	3.265	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(F)c(F)c(F)c2F)C[C@H]1C	ZINC000947957718	1333320227	/nfs/dbraw/zinc/32/02/27/1333320227.db2.gz	MXNACGFODVLDHS-NXEZZACHSA-N	0	3	330.325	3.012	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](NC(=O)c2cccc(CN(C)C)c2)C[C@H]1C	ZINC000948057684	1333358782	/nfs/dbraw/zinc/35/87/82/1333358782.db2.gz	XSUUSPKRQIOMKX-CRAIPNDOSA-N	0	3	349.906	3.083	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccccc2OCC2CC2)C[C@@H]1C	ZINC000948067793	1333362695	/nfs/dbraw/zinc/36/26/95/1333362695.db2.gz	YZRMUSLBSXTPKF-FUHWJXTLSA-N	0	3	340.467	3.081	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2coc(C3CCCCC3)n2)C[C@H]1C	ZINC000948072666	1333365405	/nfs/dbraw/zinc/36/54/05/1333365405.db2.gz	AWLHZWNTGQDJIZ-GDBMZVCRSA-N	0	3	331.460	3.491	20	30		EGEDHN
CN(C(=O)c1ccoc1)[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948185083	1333413909	/nfs/dbraw/zinc/41/39/09/1333413909.db2.gz	RAVXBWRMJZJRHL-LJQANCHMSA-N	0	3	337.423	3.278	20	30		EGEDHN
CN(C(=O)C1(C)CC1)[C@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948397033	1333508528	/nfs/dbraw/zinc/50/85/28/1333508528.db2.gz	ILXIKWPPBCDFQR-SFHVURJKSA-N	0	3	325.456	3.171	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2ccc3nc(C)oc3c2)CC1	ZINC000948456936	1333532939	/nfs/dbraw/zinc/53/29/39/1333532939.db2.gz	PFDMUGSHTSZOPY-QGZVFWFLSA-N	0	3	339.439	3.086	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)[C@@H]2CC=CC[C@H]2C(F)(F)F)CC1	ZINC000948554311	1333573211	/nfs/dbraw/zinc/57/32/11/1333573211.db2.gz	ULXWUUURTXZYNZ-BZUAXINKSA-N	0	3	342.405	3.077	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N(C)[C@@H]1CCCN(CC#CC)CC1	ZINC000948562041	1333577527	/nfs/dbraw/zinc/57/75/27/1333577527.db2.gz	PLOUVUDGFZNKNF-GOSISDBHSA-N	0	3	340.467	3.201	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2coc3ccc(OC)cc23)CC1	ZINC000948605799	1333593541	/nfs/dbraw/zinc/59/35/41/1333593541.db2.gz	UYEHVMDIFJYRAK-HNNXBMFYSA-N	0	3	340.423	3.001	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2ccc3cc(C)ccc3n2)CC1	ZINC000948606061	1333593947	/nfs/dbraw/zinc/59/39/47/1333593947.db2.gz	YYJUQUAVSYRTBS-IBGZPJMESA-N	0	3	349.478	3.493	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N(C)[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948687963	1333630682	/nfs/dbraw/zinc/63/06/82/1333630682.db2.gz	GEBRAOHBVCAPHL-IPELMVKDSA-N	0	3	325.456	3.027	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2cc(F)c(Cl)cc2F)CC1	ZINC000948729428	1333650311	/nfs/dbraw/zinc/65/03/11/1333650311.db2.gz	JMBLEFZMVWKEAA-GFCCVEGCSA-N	0	3	340.801	3.178	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cccc(F)c2Cl)CC1	ZINC000948808374	1333689995	/nfs/dbraw/zinc/68/99/95/1333689995.db2.gz	FYFCMUOSQJLFOG-AWEZNQCLSA-N	0	3	336.838	3.429	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2csc(C(C)(C)C)n2)CC1	ZINC000948857063	1333710625	/nfs/dbraw/zinc/71/06/25/1333710625.db2.gz	TXKUAXPDYAULKE-AWEZNQCLSA-N	0	3	333.501	3.000	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2csc(C(C)(C)C)n2)CC1	ZINC000948856747	1333710826	/nfs/dbraw/zinc/71/08/26/1333710826.db2.gz	MDUIGGAMVQJRAN-HNNXBMFYSA-N	0	3	347.528	3.390	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)[C@@]2(c3ccccc3)CC2(C)C)CC1	ZINC000948876712	1333716341	/nfs/dbraw/zinc/71/63/41/1333716341.db2.gz	BNDAOUYWPZLBKH-KNQAVFIVSA-N	0	3	338.495	3.300	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H]1CCCC[C@H]1C1CC1)CCO2	ZINC000949141448	1333783805	/nfs/dbraw/zinc/78/38/05/1333783805.db2.gz	CBSGGKWBQCOMAQ-RBUKOAKNSA-N	0	3	346.515	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@H]3CCC(C)=C(C)C3)CC2)C1	ZINC000949370318	1333832470	/nfs/dbraw/zinc/83/24/70/1333832470.db2.gz	PGEYXKPBGTXTNM-IBGZPJMESA-N	0	3	346.515	3.392	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3cccc(F)c3C)CC2)C1	ZINC000949373020	1333833241	/nfs/dbraw/zinc/83/32/41/1333833241.db2.gz	JJJNGOMJSIFUEV-UHFFFAOYSA-N	0	3	346.446	3.017	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C(C)(C)C(C)C)CC2)C1	ZINC000949375709	1333833406	/nfs/dbraw/zinc/83/34/06/1333833406.db2.gz	JEHSYADMZKXUNY-UHFFFAOYSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC2(CC1)CN(CC(C)C)CCO2	ZINC000949376200	1333833497	/nfs/dbraw/zinc/83/34/97/1333833497.db2.gz	WRSIIULPSVJXDG-UHFFFAOYSA-N	0	3	342.911	3.115	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@@H](C)C3CCC3)CC2)C1	ZINC000949395121	1333836186	/nfs/dbraw/zinc/83/61/86/1333836186.db2.gz	NPKRWPPFXXRGRX-KRWDZBQOSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@@]3(C)CCC[C@H]3CC)CC2)C1	ZINC000949398645	1333837116	/nfs/dbraw/zinc/83/71/16/1333837116.db2.gz	NCOGKMDWVUUFGB-QUCCMNQESA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@H]3CCC[C@@H]3CCC)CC2)C1	ZINC000949402267	1333838200	/nfs/dbraw/zinc/83/82/00/1333838200.db2.gz	XAGBQBCRAUMBLL-OALUTQOASA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@@H]3CC[C@@H]4C[C@@H]4C3)CC2)C1	ZINC000949402019	1333838459	/nfs/dbraw/zinc/83/84/59/1333838459.db2.gz	SWVHANZXYQIGEI-GUDVDZBRSA-N	0	3	346.515	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@@]3(C)CCC[C@@H]3C)CC2)C1	ZINC000949463126	1333854000	/nfs/dbraw/zinc/85/40/00/1333854000.db2.gz	KGEMQOPQRREAKF-HKUYNNGSSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3cccc(Cl)c3)CC2)C1	ZINC000949518453	1333866166	/nfs/dbraw/zinc/86/61/66/1333866166.db2.gz	WDZVPJZZXWOZCI-UHFFFAOYSA-N	0	3	348.874	3.223	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)C(C)(CC)CC)CC2)C1	ZINC000949529547	1333868211	/nfs/dbraw/zinc/86/82/11/1333868211.db2.gz	ZFPWOPIXVIOUMR-UHFFFAOYSA-N	0	3	336.520	3.472	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2cc(C)cc(OC)c2C)C1	ZINC000967258284	1335679705	/nfs/dbraw/zinc/67/97/05/1335679705.db2.gz	OVVDQUZBSKUCSP-YJBOKZPZSA-N	0	3	330.472	3.328	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2cnn3cccc(Cl)c23)C1	ZINC000967287685	1335690203	/nfs/dbraw/zinc/69/02/03/1335690203.db2.gz	IKGZKEZWZSKCLM-CZUORRHYSA-N	0	3	346.862	3.004	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccc3cc(C)ccc3n2)C1	ZINC000967293643	1335692546	/nfs/dbraw/zinc/69/25/46/1335692546.db2.gz	WICYNOXWLHSJQG-OXQOHEQNSA-N	0	3	335.451	3.007	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2oc3ccccc3c2OC)C1	ZINC000967726508	1335808132	/nfs/dbraw/zinc/80/81/32/1335808132.db2.gz	VYURUSISCKSYNB-ZBFHGGJFSA-N	0	3	342.439	3.458	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2c(Cl)cncc2Cl)C1	ZINC000968211450	1335873173	/nfs/dbraw/zinc/87/31/73/1335873173.db2.gz	KZJQRSXGNFERAL-SMDDNHRTSA-N	0	3	342.270	3.405	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2scnc2C(C)(C)C)C1	ZINC000968400214	1335920037	/nfs/dbraw/zinc/92/00/37/1335920037.db2.gz	NPBAHBSJOOZSTN-KBPBESRZSA-N	0	3	335.517	3.457	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2csc(-c3ccoc3)n2)C1	ZINC000968430849	1335927709	/nfs/dbraw/zinc/92/77/09/1335927709.db2.gz	GHNMEPZAYDSXTN-UKRRQHHQSA-N	0	3	345.468	3.419	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2sc(CC3CC3)nc2C)C1	ZINC000968477796	1335936165	/nfs/dbraw/zinc/93/61/65/1335936165.db2.gz	WMPARBARKUXICD-XJKSGUPXSA-N	0	3	347.528	3.420	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)C(C)(C)c2cccc(OC)c2)C1	ZINC000968501043	1335943649	/nfs/dbraw/zinc/94/36/49/1335943649.db2.gz	ODUKJAKAPZSAKO-APWZRJJASA-N	0	3	344.499	3.376	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CN(Cc3ccccc3C)CC[C@@H]2C)nc1	ZINC000968549917	1335960105	/nfs/dbraw/zinc/96/01/05/1335960105.db2.gz	ZZFSCMWJUKKOTC-UWJYYQICSA-N	0	3	347.462	3.012	20	30		EGEDHN
C=C(C)CCN1CC[C@H](C)[C@@H](NC(=O)c2cnc(C3CC3)s2)C1	ZINC000968565604	1335961236	/nfs/dbraw/zinc/96/12/36/1335961236.db2.gz	HRCUMPRRIXBSNS-ZFWWWQNUSA-N	0	3	333.501	3.427	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(OCC)c(OC)c2)C1	ZINC000968635119	1335991221	/nfs/dbraw/zinc/99/12/21/1335991221.db2.gz	FUBXQYCZQDPFIA-WBVHZDCISA-N	0	3	346.471	3.110	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)C2(c3cc(C)cc(C)c3)CC2)C1	ZINC000968652178	1335997171	/nfs/dbraw/zinc/99/71/71/1335997171.db2.gz	PZOTZFPSHYBEPE-AZUAARDMSA-N	0	3	338.495	3.185	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2c[nH]c3c2cccc3CC)C1	ZINC000968680980	1336008528	/nfs/dbraw/zinc/00/85/28/1336008528.db2.gz	FRIZDOGAONWNPU-HNAYVOBHSA-N	0	3	337.467	3.194	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H](NCc2ccc(Cl)nc2)C1	ZINC000968795283	1336054019	/nfs/dbraw/zinc/05/40/19/1336054019.db2.gz	KQNIZTKFENVPHN-CYBMUJFWSA-N	0	3	342.270	3.204	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1c(F)cccc1OC	ZINC000968869455	1336072929	/nfs/dbraw/zinc/07/29/29/1336072929.db2.gz	QSKAMYLJXIAFIQ-HNNXBMFYSA-N	0	3	334.435	3.385	20	30		EGEDHN
C#CCCN1CCCCC[C@H]1CNC(=O)c1cc2ccncc2s1	ZINC000968888622	1336080391	/nfs/dbraw/zinc/08/03/91/1336080391.db2.gz	XAGRUSOWGUMCQH-INIZCTEOSA-N	0	3	341.480	3.294	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1c2c[nH]nc2ccc1C	ZINC000968925753	1336091938	/nfs/dbraw/zinc/09/19/38/1336091938.db2.gz	MBDIZQIQMFNUFW-HNNXBMFYSA-N	0	3	326.444	3.032	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccn(-c2ccccc2)n1	ZINC000968925799	1336092331	/nfs/dbraw/zinc/09/23/31/1336092331.db2.gz	NHGWVDYEWVKMOW-GOSISDBHSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1cc(COC)cs1	ZINC000968936894	1336096146	/nfs/dbraw/zinc/09/61/46/1336096146.db2.gz	UKEBRXGGVIRJFC-MRXNPFEDSA-N	0	3	336.501	3.445	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)[C@H]1CCCCC1(F)F	ZINC000968967820	1336104518	/nfs/dbraw/zinc/10/45/18/1336104518.db2.gz	BKFWHPZYYWRLEJ-JKSUJKDBSA-N	0	3	326.431	3.196	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1cc(F)ccc1OC	ZINC000968974077	1336106552	/nfs/dbraw/zinc/10/65/52/1336106552.db2.gz	NSXCJODHCVNCRL-MRXNPFEDSA-N	0	3	334.435	3.385	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)NC[C@@H]1CCCCCN1Cc1ccc(C#N)cc1	ZINC000968987498	1336110155	/nfs/dbraw/zinc/11/01/55/1336110155.db2.gz	AZBYYDIQFGVLHX-SNRMKQJTSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccc2c(c1)[C@@H](C)CO2	ZINC000968998302	1336115155	/nfs/dbraw/zinc/11/51/55/1336115155.db2.gz	RMIICYHALIUOFM-DOTOQJQBSA-N	0	3	328.456	3.343	20	30		EGEDHN
C#CCN1CCCCC[C@H]1CNC(=O)c1ccccc1-n1cccc1	ZINC000969008279	1336116929	/nfs/dbraw/zinc/11/69/29/1336116929.db2.gz	PBUBVOOZAWIUBM-SFHVURJKSA-N	0	3	335.451	3.085	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cccnc1C(F)(F)F	ZINC000969046433	1336126337	/nfs/dbraw/zinc/12/63/37/1336126337.db2.gz	KRRQNQRZROWBOB-ZDUSSCGKSA-N	0	3	341.377	3.261	20	30		EGEDHN
C#CCCN1CCCCC[C@@H]1CNC(=O)c1sc(CC)nc1C	ZINC000969065627	1336136311	/nfs/dbraw/zinc/13/63/11/1336136311.db2.gz	VKSKPKGJQNZOGT-OAHLLOKOSA-N	0	3	333.501	3.012	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)[C@@H]2CCCO[C@H]2c2ccccc2)CC1	ZINC001005518417	1336365806	/nfs/dbraw/zinc/36/58/06/1336365806.db2.gz	JPLXDZOWMIEDFZ-UXHICEINSA-N	0	3	342.483	3.263	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cnn(C(CC)CC)c2C)CC1	ZINC001006274726	1336479901	/nfs/dbraw/zinc/47/99/01/1336479901.db2.gz	KEXWRVHCLPCVLD-UHFFFAOYSA-N	0	3	332.492	3.275	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)Cn2c(C)cc3ccccc32)C1	ZINC001007848833	1336717196	/nfs/dbraw/zinc/71/71/96/1336717196.db2.gz	KOEPKOAJLSZAIX-GOSISDBHSA-N	0	3	325.456	3.106	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2c(F)ccc(F)c2Cl)C1	ZINC001008620160	1336895039	/nfs/dbraw/zinc/89/50/39/1336895039.db2.gz	GSIRWGCQMLGERB-NSHDSACASA-N	0	3	328.790	3.389	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N[C@H]1CCCN(Cc2ccccc2C)C1	ZINC001008845715	1336932964	/nfs/dbraw/zinc/93/29/64/1336932964.db2.gz	LLGFRECGDVRVOX-UFYCRDLUSA-N	0	3	342.483	3.057	20	30		EGEDHN
C=C(C)CCN1CCC[C@H](NC(=O)c2occc2Br)C1	ZINC001008888680	1336937898	/nfs/dbraw/zinc/93/78/98/1336937898.db2.gz	RPFAZEXIWAJJNN-LBPRGKRZSA-N	0	3	341.249	3.203	20	30		EGEDHN
C#CCCN1CCC[C@@H](NC(=O)C(C)(C)c2ccccc2Cl)C1	ZINC001009262358	1336992755	/nfs/dbraw/zinc/99/27/55/1336992755.db2.gz	FRDQVOMECAKHDL-OAHLLOKOSA-N	0	3	332.875	3.222	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CCN(CCCc2ccsc2)C1	ZINC001014732536	1337890646	/nfs/dbraw/zinc/89/06/46/1337890646.db2.gz	VGUSAHZYPMLDHO-KRWDZBQOSA-N	0	3	343.496	3.173	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN([C@H]3CCc4ccccc43)C2)cc1	ZINC001015482392	1338155608	/nfs/dbraw/zinc/15/56/08/1338155608.db2.gz	NUIHIYWLSWRBOA-FPOVZHCZSA-N	0	3	330.431	3.160	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CCN(Cc3ccccc3C(C)C)C2)c1	ZINC001015679208	1338254928	/nfs/dbraw/zinc/25/49/28/1338254928.db2.gz	VQLXOOOYNSSLAS-HXUWFJFHSA-N	0	3	347.462	3.191	20	30		EGEDHN
C[C@H](C(=O)N[C@@H]1CC12CCN(Cc1cccc(C#N)c1)CC2)C1CC1	ZINC001016566095	1338649649	/nfs/dbraw/zinc/64/96/49/1338649649.db2.gz	RTTJUZFSTOQACF-HNAYVOBHSA-N	0	3	337.467	3.075	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2csc3cc(C)ccc32)CC1	ZINC001016644432	1338674991	/nfs/dbraw/zinc/67/49/91/1338674991.db2.gz	DRXYECYTTAXHJV-SFHVURJKSA-N	0	3	338.476	3.427	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CC12CCN(C[C@@H](F)CC)CC2	ZINC001016660686	1338681476	/nfs/dbraw/zinc/68/14/76/1338681476.db2.gz	ALCXIEMKHDUSSN-DOTOQJQBSA-N	0	3	333.451	3.007	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1CC12CCN(C[C@H](F)CC)CC2	ZINC001016660691	1338681873	/nfs/dbraw/zinc/68/18/73/1338681873.db2.gz	ALCXIEMKHDUSSN-WBVHZDCISA-N	0	3	333.451	3.007	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cccc3ccc(C)nc32)CC1	ZINC001016680794	1338688311	/nfs/dbraw/zinc/68/83/11/1338688311.db2.gz	COEJIGXNPQNNLF-IBGZPJMESA-N	0	3	347.462	3.151	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2cc3cscc3s2)CC1	ZINC001016731263	1338705232	/nfs/dbraw/zinc/70/52/32/1338705232.db2.gz	OGMWZUGBWLSSNV-OAHLLOKOSA-N	0	3	330.478	3.180	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CC23CCN(C/C=C/Cl)CC3)cc1	ZINC001016761755	1338715674	/nfs/dbraw/zinc/71/56/74/1338715674.db2.gz	PBAUNRVXZCJJBL-DFIVBLOKSA-N	0	3	328.843	3.005	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CC23CCN(C/C=C\Cl)CC3)cc1	ZINC001016761758	1338715762	/nfs/dbraw/zinc/71/57/62/1338715762.db2.gz	PBAUNRVXZCJJBL-TYIWRNDTSA-N	0	3	328.843	3.005	20	30		EGEDHN
CC1(C(=O)N[C@@H]2CC23CCN(Cc2cccc(C#N)c2)CC3)CCC1	ZINC001016776108	1338721818	/nfs/dbraw/zinc/72/18/18/1338721818.db2.gz	KHBDCAKEHBFXFB-GOSISDBHSA-N	0	3	337.467	3.219	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC23CCN(Cc2cnc(C)s2)CC3)C1	ZINC001016811852	1338734778	/nfs/dbraw/zinc/73/47/78/1338734778.db2.gz	GORMVUIXHVJWSE-INIZCTEOSA-N	0	3	345.512	3.279	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2coc3ccc(F)cc32)CC1	ZINC001016947212	1338780978	/nfs/dbraw/zinc/78/09/78/1338780978.db2.gz	LOKVKFDQOAGQFZ-SFHVURJKSA-N	0	3	340.398	3.180	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccsc2C(F)F)CC1	ZINC001016951694	1338781934	/nfs/dbraw/zinc/78/19/34/1338781934.db2.gz	SBPTWAGUZIUZFX-ZDUSSCGKSA-N	0	3	338.423	3.293	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2cc3c(cccc3F)s2)CC1	ZINC001016964044	1338786377	/nfs/dbraw/zinc/78/63/77/1338786377.db2.gz	WAQORZBLXLBFIY-QGZVFWFLSA-N	0	3	342.439	3.258	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cnc(C(C)(C)C)s2)CC1	ZINC001016984023	1338792376	/nfs/dbraw/zinc/79/23/76/1338792376.db2.gz	BBPCQGNRSKBXGD-OAHLLOKOSA-N	0	3	345.512	3.048	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)C(C)(C)c2ccccc2C)CC1	ZINC001016994216	1338797348	/nfs/dbraw/zinc/79/73/48/1338797348.db2.gz	LAYPUIOZZHHHNT-IBGZPJMESA-N	0	3	338.495	3.267	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H](CN(C)Cc2ccccn2)C1	ZINC001017177334	1338920707	/nfs/dbraw/zinc/92/07/07/1338920707.db2.gz	RECKOLYHXPMJBK-QGZVFWFLSA-N	0	3	329.488	3.354	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCCN(C(=O)C2(C)CCC2)C1	ZINC001017187242	1338933583	/nfs/dbraw/zinc/93/35/83/1338933583.db2.gz	ULZLWIIJYCJGCV-OAHLLOKOSA-N	0	3	345.512	3.480	20	30		EGEDHN
CC1CCC(CN2C[C@H]3CC[C@@H](C2)N3C(=O)c2cc(C#N)c[nH]2)CC1	ZINC001017453711	1339349687	/nfs/dbraw/zinc/34/96/87/1339349687.db2.gz	DKWKDXHBROWGLP-SAJCDORXSA-N	0	3	340.471	3.001	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)Oc1ccccc1F	ZINC001017576943	1339370631	/nfs/dbraw/zinc/37/06/31/1339370631.db2.gz	GLQBDTSWJXBHEZ-ZACQAIPSSA-N	0	3	346.446	3.234	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@H]1CCC[C@H](OC)C1	ZINC001017605711	1339376356	/nfs/dbraw/zinc/37/63/56/1339376356.db2.gz	JHUSJYYSGLVJPP-OKYOBFRVSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cc(C)n(CC)c1C	ZINC001017711608	1339398739	/nfs/dbraw/zinc/39/87/39/1339398739.db2.gz	WKEFRYDHRGWAFK-HDICACEKSA-N	0	3	329.488	3.380	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cccc(COC)c1	ZINC001017712702	1339398758	/nfs/dbraw/zinc/39/87/58/1339398758.db2.gz	ADVXOBNKYASXTM-KDURUIRLSA-N	0	3	328.456	3.088	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)CCc1ccc(C)cc1C	ZINC001017781931	1339419272	/nfs/dbraw/zinc/41/92/72/1339419272.db2.gz	NNBIEDMQZQCEAG-BGYRXZFFSA-N	0	3	326.484	3.487	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CC[C@@H](C(F)(F)F)C1	ZINC001017854962	1339430809	/nfs/dbraw/zinc/43/08/09/1339430809.db2.gz	FFBXFCIFUTVKLC-TUVASFSCSA-N	0	3	330.394	3.216	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc(OCC=C)cc1	ZINC001018316485	1339573985	/nfs/dbraw/zinc/57/39/85/1339573985.db2.gz	ITJDISUFLCMVRU-KDURUIRLSA-N	0	3	340.467	3.045	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H]1CNC(=O)c1cnc([C@@H]2CCCO2)s1	ZINC001028187441	1340474976	/nfs/dbraw/zinc/47/49/76/1340474976.db2.gz	JZSFXHAQRQMPBT-CABCVRRESA-N	0	3	349.500	3.155	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCCN2Cc2ccc(C)cc2C)cn1	ZINC001028270366	1340523782	/nfs/dbraw/zinc/52/37/82/1340523782.db2.gz	ILWOWNBJQSWFNT-NRFANRHFSA-N	0	3	347.462	3.074	20	30		EGEDHN
C#CCCN1CCC[C@@H]1CNC(=O)c1ccc(-c2cccs2)o1	ZINC001028293375	1340543731	/nfs/dbraw/zinc/54/37/31/1340543731.db2.gz	JFLIMRLUGNIBJV-CQSZACIVSA-N	0	3	328.437	3.226	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H](CNC(=O)c3ccoc3C3CC3)C2)c1	ZINC001028761902	1340798047	/nfs/dbraw/zinc/79/80/47/1340798047.db2.gz	BNKSXYLLDMBQJV-KRWDZBQOSA-N	0	3	349.434	3.281	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H](CNC(=O)c3cc[nH]c3C3CC3)C2)c1	ZINC001028765414	1340798379	/nfs/dbraw/zinc/79/83/79/1340798379.db2.gz	XLSYDUUMFPOFEI-KRWDZBQOSA-N	0	3	348.450	3.016	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)c2cccc(Cl)c2Cl)C1	ZINC001028950140	1340892028	/nfs/dbraw/zinc/89/20/28/1340892028.db2.gz	XSIZZDVBKOAHBM-GFCCVEGCSA-N	0	3	325.239	3.068	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)c2cc(CC)c(CCC)s2)C1	ZINC001028978958	1340899819	/nfs/dbraw/zinc/89/98/19/1340899819.db2.gz	LXPQPHSREJXQRZ-OAHLLOKOSA-N	0	3	332.513	3.338	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)C1CCN(C(=O)c2ccco2)CC1	ZINC001029040439	1340915068	/nfs/dbraw/zinc/91/50/68/1340915068.db2.gz	SHCSYNHPDCBANZ-HNNXBMFYSA-N	0	3	337.423	3.182	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)C1CCN(C(=O)C2CC=CC2)CC1	ZINC001029072234	1340923174	/nfs/dbraw/zinc/92/31/74/1340923174.db2.gz	HUAWQOGHORXPAU-MRXNPFEDSA-N	0	3	337.467	3.241	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)C1CCN(C(=O)/C=C\C2CC2)CC1	ZINC001029074302	1340923583	/nfs/dbraw/zinc/92/35/83/1340923583.db2.gz	LZNBWKZYLJVZIZ-QWGSZXSUSA-N	0	3	337.467	3.241	20	30		EGEDHN
C[C@H](NCc1cc(F)ccc1C#N)C1CCN(C(=O)[C@@H]2C[C@H]2C)CC1	ZINC001029127598	1340936828	/nfs/dbraw/zinc/93/68/28/1340936828.db2.gz	VMVGXCZWUIAZDB-BIENJYKASA-N	0	3	343.446	3.070	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC([C@H](C)NCc2nccn2CC)CC1	ZINC001029136743	1340939784	/nfs/dbraw/zinc/93/97/84/1340939784.db2.gz	KYMXWSPWHYWSTN-JXFKEZNVSA-N	0	3	346.519	3.222	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC([C@H](C)NCc2cc(C)n(C)n2)CC1	ZINC001029136917	1340940089	/nfs/dbraw/zinc/94/00/89/1340940089.db2.gz	NZILLBIXMXMUFF-OXJNMPFZSA-N	0	3	346.519	3.048	20	30		EGEDHN
C[C@H](C#N)C(=O)N1C[C@H]2CC[C@@H](C1)N2CCc1ccc2ccccc2c1	ZINC001029244605	1340960731	/nfs/dbraw/zinc/96/07/31/1340960731.db2.gz	JNZOWPRFOHJFCU-HBGVWJBISA-N	0	3	347.462	3.217	20	30		EGEDHN
O=C(C#CC1CC1)N1C[C@H]2CC[C@@H](C1)N2Cc1cccc2ccccc21	ZINC001029302505	1340969230	/nfs/dbraw/zinc/96/92/30/1340969230.db2.gz	IZTJLSZLOFWZAD-OYRHEFFESA-N	0	3	344.458	3.428	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CC[C@@H](C1)N2C[C@H](O)C1CCCCC1	ZINC001029419577	1340985980	/nfs/dbraw/zinc/98/59/80/1340985980.db2.gz	GJGKBUHGCNIYGM-OTWHNJEPSA-N	0	3	348.531	3.205	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CC[C@@H](C1)N2C[C@H](OC)C1CCC1	ZINC001029456437	1340994276	/nfs/dbraw/zinc/99/42/76/1340994276.db2.gz	CKGGXMSNDDFTKH-DMUMMCEESA-N	0	3	334.504	3.079	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](CN(C)[C@@H](C)c3cnccn3)C2)CC1	ZINC001029825355	1341087010	/nfs/dbraw/zinc/08/70/10/1341087010.db2.gz	CENDPFMZWMAVKG-DLBZAZTESA-N	0	3	342.487	3.064	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H](CN(C)Cc2c(C)noc2C)C1	ZINC001029825795	1341087356	/nfs/dbraw/zinc/08/73/56/1341087356.db2.gz	IHMGSPJNWQTHET-APWZRJJASA-N	0	3	333.476	3.174	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](CN(C)Cc3oc(C)nc3C)C2)CC1	ZINC001029826895	1341087986	/nfs/dbraw/zinc/08/79/86/1341087986.db2.gz	WXISOBVQDSPBMJ-QGZVFWFLSA-N	0	3	345.487	3.318	20	30		EGEDHN
CC(C)C1(C(=O)N2CC[C@@H](CN(C)Cc3ccc(C#N)s3)C2)CC1	ZINC001029832741	1341090445	/nfs/dbraw/zinc/09/04/45/1341090445.db2.gz	VDTNDPXEONSMTD-HNNXBMFYSA-N	0	3	345.512	3.336	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1F)CC1CCN(C(=O)C(C)(C)F)CC1	ZINC001029925113	1341121528	/nfs/dbraw/zinc/12/15/28/1341121528.db2.gz	DJYOZZPNXJRZSC-UHFFFAOYSA-N	0	3	349.425	3.116	20	30		EGEDHN
CC(C)C(=O)N1CCC(CN(C)Cc2cc(C#N)ccc2F)CC1	ZINC001029937533	1341128678	/nfs/dbraw/zinc/12/86/78/1341128678.db2.gz	QVNIZQMJXFMLTQ-UHFFFAOYSA-N	0	3	331.435	3.024	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC(CN(C)Cc2cn(C)nc2C)CC1	ZINC001029989987	1341147612	/nfs/dbraw/zinc/14/76/12/1341147612.db2.gz	FHPDWUSFYBMZIB-HXUWFJFHSA-N	0	3	346.519	3.001	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC(CN(C)Cc2cc(C)no2)CC1	ZINC001029989792	1341147665	/nfs/dbraw/zinc/14/76/65/1341147665.db2.gz	BWIDDQKQDUXTTD-IBGZPJMESA-N	0	3	333.476	3.256	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](C)[C@@H](CNCc2csc(CC)n2)C1	ZINC001072336883	1355245199	/nfs/dbraw/zinc/24/51/99/1355245199.db2.gz	VCUNPUPFUHAYLB-GJZGRUSLSA-N	0	3	349.544	3.492	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1ccc(CC(C)C)cc1	ZINC001032506315	1341525860	/nfs/dbraw/zinc/52/58/60/1341525860.db2.gz	CWKKMIWWCUMQEY-PMACEKPBSA-N	0	3	326.484	3.289	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)COc1ccsc1Cl	ZINC001032677854	1341579882	/nfs/dbraw/zinc/57/98/82/1341579882.db2.gz	VFSNQEDOQLXDEL-STQMWFEESA-N	0	3	340.876	3.032	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)CCc1ccc(F)cc1F	ZINC001032709917	1341587000	/nfs/dbraw/zinc/58/70/00/1341587000.db2.gz	NOSWBJNNFKCOTP-IRXDYDNUSA-N	0	3	334.410	3.149	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(O[C@@H](C)CC)cc1	ZINC001032717897	1341590231	/nfs/dbraw/zinc/59/02/31/1341590231.db2.gz	YKSFOMQUUKOTFF-SZMVWBNQSA-N	0	3	328.456	3.339	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cnn([C@@H](C)CC)c1C	ZINC001032723612	1341592126	/nfs/dbraw/zinc/59/21/26/1341592126.db2.gz	NGBFQTBQMHSTNS-XIRDDKMYSA-N	0	3	330.476	3.027	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)CC12CC3CC(CC(C3)C1)C2	ZINC001032750176	1341601671	/nfs/dbraw/zinc/60/16/71/1341601671.db2.gz	OKDATVBYVLWVSG-VQIYKNCMSA-N	0	3	328.500	3.454	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C1CCC(C(F)F)CC1	ZINC001032758738	1341604154	/nfs/dbraw/zinc/60/41/54/1341604154.db2.gz	FYQXOYBCALKYCT-CKUJCDMFSA-N	0	3	326.431	3.309	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H]1Cc2ccc(Cl)cc21	ZINC001032760076	1341605142	/nfs/dbraw/zinc/60/51/42/1341605142.db2.gz	MJGGHAIQSODOHG-BQFCYCMXSA-N	0	3	330.859	3.231	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(COC(C)C)cc1	ZINC001032775848	1341611230	/nfs/dbraw/zinc/61/12/30/1341611230.db2.gz	HTUUCTMOUTVSGT-OALUTQOASA-N	0	3	328.456	3.086	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)C2CCc3ccccc3CC2)C1	ZINC001033214415	1341754050	/nfs/dbraw/zinc/75/40/50/1341754050.db2.gz	NFLUDHVVKQAIIU-HXUWFJFHSA-N	0	3	326.484	3.290	20	30		EGEDHN
C#CCCN1CC[C@@H](N(C)C(=O)c2ccc3c4c(cccc42)CC3)C1	ZINC001033252327	1341758368	/nfs/dbraw/zinc/75/83/68/1341758368.db2.gz	DOAWFRNTRBOSMH-GOSISDBHSA-N	0	3	332.447	3.108	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@H]2CCN(CCc3ccc(OC)cc3)C2)C1	ZINC001033393873	1341810826	/nfs/dbraw/zinc/81/08/26/1341810826.db2.gz	MCLVPHIZTCWWCD-SFHVURJKSA-N	0	3	342.483	3.127	20	30		EGEDHN
C#CCCN1CC[C@H](N(C)C(=O)c2ccc(O[C@@H](C)CC)cc2)C1	ZINC001033566916	1341876703	/nfs/dbraw/zinc/87/67/03/1341876703.db2.gz	MAIAKZCBNLCMOA-WMZOPIPTSA-N	0	3	328.456	3.034	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2ccc(N(CC)CC)cc2)C1	ZINC001033615213	1341903386	/nfs/dbraw/zinc/90/33/86/1341903386.db2.gz	ZTMCUBLXADBHRA-IBGZPJMESA-N	0	3	329.488	3.255	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)Cc2ccc3c(c2)CCCC3)C1	ZINC001033655723	1341932287	/nfs/dbraw/zinc/93/22/87/1341932287.db2.gz	HKCGTRSKVSYZTB-FQEVSTJZSA-N	0	3	326.484	3.217	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccc(C)c(NC(C)=O)c2)C1	ZINC001033851663	1342044957	/nfs/dbraw/zinc/04/49/57/1342044957.db2.gz	RMZHNKAGYPIYGL-SFHVURJKSA-N	0	3	343.471	3.066	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccnc(-c3ccco3)c2)C1	ZINC001033873578	1342052681	/nfs/dbraw/zinc/05/26/81/1342052681.db2.gz	YKEDLWHKGCTRCQ-KRWDZBQOSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccc(-c3cnco3)cc2)C1	ZINC001033877560	1342055553	/nfs/dbraw/zinc/05/55/53/1342055553.db2.gz	CNSYKCKQWQUBFG-SFHVURJKSA-N	0	3	339.439	3.454	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2ccc(OC)c(C(C)C)c2)C1	ZINC001033885601	1342058983	/nfs/dbraw/zinc/05/89/83/1342058983.db2.gz	VCFAXFOLVIALJL-GOSISDBHSA-N	0	3	342.483	3.378	20	30		EGEDHN
C#Cc1cncc(C(=O)N(CC)[C@@H]2CCN(Cc3cccc(C)c3)C2)c1	ZINC001033947762	1342107279	/nfs/dbraw/zinc/10/72/79/1342107279.db2.gz	VVXYQOLIPUGZGU-OAQYLSRUSA-N	0	3	347.462	3.108	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccc(N3CC=CC3)cc2)C1	ZINC001033959519	1342113780	/nfs/dbraw/zinc/11/37/80/1342113780.db2.gz	VESXVBMDNGMSIZ-FQEVSTJZSA-N	0	3	339.483	3.175	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@@H]2CCOc3ccccc32)C1	ZINC001033992755	1342135872	/nfs/dbraw/zinc/13/58/72/1342135872.db2.gz	XDWMOHRWFNTJQT-FUHWJXTLSA-N	0	3	328.456	3.052	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cnc3ccc(F)cc3c2)C1	ZINC001034007499	1342144406	/nfs/dbraw/zinc/14/44/06/1342144406.db2.gz	NVUQAADKRABZMG-GOSISDBHSA-N	0	3	341.430	3.486	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cnn([C@@H](C)CC)c2C)C1	ZINC001034017268	1342154718	/nfs/dbraw/zinc/15/47/18/1342154718.db2.gz	QSYAZTBVAYVJIT-RDJZCZTQSA-N	0	3	332.492	3.275	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2csc3c2CC[C@@H](C)C3)C1	ZINC001034032628	1342171994	/nfs/dbraw/zinc/17/19/94/1342171994.db2.gz	UKSCTMUSTQELGU-CVEARBPZSA-N	0	3	344.524	3.433	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2ccsc2C(F)F)C1	ZINC001034035870	1342174528	/nfs/dbraw/zinc/17/45/28/1342174528.db2.gz	MSYZSPXKWUUKDK-LBPRGKRZSA-N	0	3	326.412	3.245	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)c2cc(F)cc3ccncc32)C1	ZINC001034212178	1342321586	/nfs/dbraw/zinc/32/15/86/1342321586.db2.gz	GRGWTHVTHPRPPA-INIZCTEOSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)c2c(F)ccc3ccncc32)C1	ZINC001034218858	1342324630	/nfs/dbraw/zinc/32/46/30/1342324630.db2.gz	JJEUYJHBMSSNLG-OAHLLOKOSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cnn(C(C)(C)C)c2C)C1	ZINC001034228429	1342332789	/nfs/dbraw/zinc/33/27/89/1342332789.db2.gz	FHWJYZCZFCQEFM-INIZCTEOSA-N	0	3	332.492	3.107	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2oc3ccc(F)cc3c2C)C1	ZINC001034246915	1342344942	/nfs/dbraw/zinc/34/49/42/1342344942.db2.gz	HXKIEYULVVRGFI-MRXNPFEDSA-N	0	3	342.414	3.488	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@H]2CCCCN(CC(=C)C)C2)cc1	ZINC001034275679	1342367001	/nfs/dbraw/zinc/36/70/01/1342367001.db2.gz	IDUJGWKJUFDULD-SFHVURJKSA-N	0	3	328.456	3.412	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cc(C(C)C)nn2CC)C1	ZINC001034287083	1342374259	/nfs/dbraw/zinc/37/42/59/1342374259.db2.gz	NCEHRRNAHIGPII-INIZCTEOSA-N	0	3	332.492	3.187	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cc(F)c(F)cc2F)C1	ZINC001034371008	1342440667	/nfs/dbraw/zinc/44/06/67/1342440667.db2.gz	DLNJRCSGHKFNPH-LBPRGKRZSA-N	0	3	326.362	3.264	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2noc3c2CCCCC3)C1	ZINC001034425157	1342487308	/nfs/dbraw/zinc/48/73/08/1342487308.db2.gz	ZYBUQFUWOAYKGP-OAHLLOKOSA-N	0	3	331.460	3.104	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@@H]2CCc3cccc(OC)c32)C1	ZINC001034432011	1342494458	/nfs/dbraw/zinc/49/44/58/1342494458.db2.gz	MZYCNAOGVRBWLL-QZTJIDSGSA-N	0	3	342.483	3.272	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)[C@]2(C)CCCc3ccccc32)C1	ZINC001034441548	1342503301	/nfs/dbraw/zinc/50/33/01/1342503301.db2.gz	GYDSEDLCISPYOF-GHTZIAJQSA-N	0	3	326.484	3.437	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2csc(C(C)(C)C)n2)C1	ZINC001034447100	1342508211	/nfs/dbraw/zinc/50/82/11/1342508211.db2.gz	CVMDGKKPTAMRAQ-AWEZNQCLSA-N	0	3	333.501	3.048	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2c[nH]nc2-c2ccsc2)C1	ZINC001034466909	1342521745	/nfs/dbraw/zinc/52/17/45/1342521745.db2.gz	HUNVRCNOZIVQDK-HNNXBMFYSA-N	0	3	344.484	3.299	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)C2(c3ccccc3F)CCC2)C1	ZINC001034481486	1342539128	/nfs/dbraw/zinc/53/91/28/1342539128.db2.gz	BRFHKHLVVUEGOD-INIZCTEOSA-N	0	3	330.447	3.404	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@@]2(c3ccccc3)CCCO2)C1	ZINC001034501704	1342559746	/nfs/dbraw/zinc/55/97/46/1342559746.db2.gz	ZJIFKRATIJCVHV-CTNGQTDRSA-N	0	3	342.483	3.239	20	30		EGEDHN
Cc1cocc1C(=O)N[C@H]1CC[C@H](NCc2ccccc2C#N)CC1	ZINC001034708589	1342704140	/nfs/dbraw/zinc/70/41/40/1342704140.db2.gz	KUQUDPXJBQMOCZ-IYARVYRRSA-N	0	3	337.423	3.291	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1CC[C@H](NC(=O)[C@@H]2CC[C@H](F)C2)CC1	ZINC001034719067	1342713880	/nfs/dbraw/zinc/71/38/80/1342713880.db2.gz	PUANBKLBJWUOIS-ZWQIFLOQSA-N	0	3	343.446	3.213	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccccc2OCC)C12CCC2	ZINC001078798431	1357090667	/nfs/dbraw/zinc/09/06/67/1357090667.db2.gz	QDCIPWJLAZNALV-DLBZAZTESA-N	0	3	348.874	3.468	20	30		EGEDHN
CC1(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)s2)CCCC1	ZINC001035005694	1342872028	/nfs/dbraw/zinc/87/20/28/1342872028.db2.gz	CBVWPPHPXCYRNI-CQSZACIVSA-N	0	3	331.485	3.281	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]1CNCc1cc(CO)ccc1F	ZINC001035010547	1342874021	/nfs/dbraw/zinc/87/40/21/1342874021.db2.gz	COBNMSQUTGAEAJ-QGZVFWFLSA-N	0	3	348.462	3.001	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@@H]2CNCc2cnc(C)s2)CC1	ZINC001035035278	1342888985	/nfs/dbraw/zinc/88/89/85/1342888985.db2.gz	HYSWVOCDBLUINV-MRXNPFEDSA-N	0	3	333.501	3.279	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)c(F)c1	ZINC001035036032	1342889738	/nfs/dbraw/zinc/88/97/38/1342889738.db2.gz	UQXOYMOPHCGVNQ-XLIONFOSSA-N	0	3	343.446	3.380	20	30		EGEDHN
CC(C)C1(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)s2)CC1	ZINC001035042343	1342894699	/nfs/dbraw/zinc/89/46/99/1342894699.db2.gz	BGAZVVWHVZDKDA-CQSZACIVSA-N	0	3	331.485	3.137	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]2CNCc2cn(C(C)C)nc2C)C1	ZINC001035044933	1342896717	/nfs/dbraw/zinc/89/67/17/1342896717.db2.gz	RKZYPLQKKJIYOY-GOSISDBHSA-N	0	3	344.503	3.209	20	30		EGEDHN
C=C[C@@H](C(=O)N1CCC[C@@H]1CNCc1cncs1)c1ccccc1	ZINC001035130844	1342946964	/nfs/dbraw/zinc/94/69/64/1342946964.db2.gz	FFOVKPGGGUOWCA-SJLPKXTDSA-N	0	3	341.480	3.194	20	30		EGEDHN
CCCC(=O)N1CCC2(CCN(CC#Cc3ccc(F)cc3)C2)CC1	ZINC001035148552	1342960809	/nfs/dbraw/zinc/96/08/09/1342960809.db2.gz	LZFRIMHGBGCKTF-UHFFFAOYSA-N	0	3	342.458	3.292	20	30		EGEDHN
N#Cc1ccccc1CN1CCC2(C1)CCN(C(=O)C1CC=CC1)CC2	ZINC001035171319	1342987378	/nfs/dbraw/zinc/98/73/78/1342987378.db2.gz	MHVFXDGVGDKQSQ-UHFFFAOYSA-N	0	3	349.478	3.339	20	30		EGEDHN
CC1(C(=O)N2CCC3(CCN(Cc4ccc(C#N)s4)C3)CC2)CC1	ZINC001035191690	1343006097	/nfs/dbraw/zinc/00/60/97/1343006097.db2.gz	OBYLZLNMAGYXHF-UHFFFAOYSA-N	0	3	343.496	3.234	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC2(CCN(Cc3cc(C)no3)C2)CC1	ZINC001035223326	1343044624	/nfs/dbraw/zinc/04/46/24/1343044624.db2.gz	OKOQAAGCCXBPRB-IBGZPJMESA-N	0	3	345.487	3.400	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC2(CCN(Cc3cnoc3C)C2)CC1	ZINC001035225512	1343046641	/nfs/dbraw/zinc/04/66/41/1343046641.db2.gz	DCDBNYRENJNMEH-IBGZPJMESA-N	0	3	345.487	3.400	20	30		EGEDHN
N#Cc1ccccc1CN1CCC2(C1)CCN(C(=O)[C@H]1CC13CC3)CC2	ZINC001035232268	1343053417	/nfs/dbraw/zinc/05/34/17/1343053417.db2.gz	ASKJZZIYGVIESJ-LJQANCHMSA-N	0	3	349.478	3.173	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@H](CC)OC1CCCCC1)CC2	ZINC001035706962	1343144460	/nfs/dbraw/zinc/14/44/60/1343144460.db2.gz	QMIPDUHZOBCCKK-IBGZPJMESA-N	0	3	346.515	3.062	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C(C)(C)[C@H]1CCCCO1)CC2	ZINC001035710430	1343145820	/nfs/dbraw/zinc/14/58/20/1343145820.db2.gz	XPZUSFKBJGPJLJ-QGZVFWFLSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc(C)cc(OC)c1C)CC2	ZINC001035745444	1343165479	/nfs/dbraw/zinc/16/54/79/1343165479.db2.gz	WSNWAWZDVYRPLT-UHFFFAOYSA-N	0	3	342.483	3.426	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H]1CCO[C@H](CCC)C1)CC2	ZINC001035827961	1343217231	/nfs/dbraw/zinc/21/72/31/1343217231.db2.gz	DHHJIGXLVLPADH-QZTJIDSGSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)Cc1c[nH]c3ccccc13)CC2	ZINC001035843701	1343225345	/nfs/dbraw/zinc/22/53/45/1343225345.db2.gz	YWNJXRXRTNMVEZ-UHFFFAOYSA-N	0	3	337.467	3.211	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cc3c(s1)CCCC3)CC2	ZINC001035846920	1343227520	/nfs/dbraw/zinc/22/75/20/1343227520.db2.gz	BNNJRJPCLQKNSD-UHFFFAOYSA-N	0	3	342.508	3.188	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cc3c(cccc3C)o1)CC2	ZINC001035858128	1343234425	/nfs/dbraw/zinc/23/44/25/1343234425.db2.gz	DAHTXHPWLZGULS-UHFFFAOYSA-N	0	3	336.435	3.303	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](NCc2ccn(C(C)C)n2)[C@@H](C)C1	ZINC001036133283	1343320959	/nfs/dbraw/zinc/32/09/59/1343320959.db2.gz	AGHPAKKMEMETOX-WMZOPIPTSA-N	0	3	346.519	3.393	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](NCc2cc(C3CC3)no2)[C@H](C)C1	ZINC001036144552	1343327032	/nfs/dbraw/zinc/32/70/32/1343327032.db2.gz	SWQQFDISHUORCP-CZUORRHYSA-N	0	3	331.460	3.091	20	30		EGEDHN
C[C@H]1CN(C(=O)C2CC3(CC3)C2)CC[C@@H]1NCc1ccccc1C#N	ZINC001036186292	1343351933	/nfs/dbraw/zinc/35/19/33/1343351933.db2.gz	MHTMSBLIYCAIOT-KXBFYZLASA-N	0	3	337.467	3.075	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCCN(C(=O)CC2CC2)C1	ZINC001036346981	1343433952	/nfs/dbraw/zinc/43/39/52/1343433952.db2.gz	YVKLLCRVFVTTJX-KXBFYZLASA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCCN(C(=O)C2(C)CCC2)C1	ZINC001036428003	1343481011	/nfs/dbraw/zinc/48/10/11/1343481011.db2.gz	OSTCJJNAJHSJFQ-VQIMIIECSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H]([C@H](C)NCc2cc(OC)no2)C1	ZINC001036435661	1343485541	/nfs/dbraw/zinc/48/55/41/1343485541.db2.gz	AWMWPIHOCMWCPI-GJZGRUSLSA-N	0	3	349.475	3.002	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001036632213	1343589424	/nfs/dbraw/zinc/58/94/24/1343589424.db2.gz	KAOKAGJXOYFOSY-WMLDXEAASA-N	0	3	329.469	3.009	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@@H]2[C@@H](CCN2CC#Cc2ccc(F)cc2)C1	ZINC001036632899	1343590354	/nfs/dbraw/zinc/59/03/54/1343590354.db2.gz	UHSBOEDZJOFKIZ-AZUAARDMSA-N	0	3	340.442	3.066	20	30		EGEDHN
CC(C)C(=O)N1CC[C@@H]2[C@H](CCN2CC#Cc2cccc(Cl)c2)C1	ZINC001036648964	1343599157	/nfs/dbraw/zinc/59/91/57/1343599157.db2.gz	PWAJUXZXFHORPB-IEBWSBKVSA-N	0	3	344.886	3.270	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CN(C(=O)/C=C\C4CC4)CC[C@H]32)s1	ZINC001036677560	1343618277	/nfs/dbraw/zinc/61/82/77/1343618277.db2.gz	DJXCGCGVMGMLCI-OXJRKKKRSA-N	0	3	341.480	3.009	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3CN(C(=O)C=C4CCC4)CC[C@H]32)s1	ZINC001036689136	1343632293	/nfs/dbraw/zinc/63/22/93/1343632293.db2.gz	CZDVHTLXZDHBOH-MAUKXSAKSA-N	0	3	341.480	3.153	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@@H]2[C@H](CCN2Cc2cccc(Cl)c2)C1	ZINC001036713812	1343646894	/nfs/dbraw/zinc/64/68/94/1343646894.db2.gz	OSOBBSKZWLXASW-IEBWSBKVSA-N	0	3	342.870	3.176	20	30		EGEDHN
CC1(C(=O)N2CC[C@@H]3[C@@H](CCN3Cc3ccc(C#N)s3)C2)CCC1	ZINC001036792661	1343723452	/nfs/dbraw/zinc/72/34/52/1343723452.db2.gz	SHQIKMRQKFUYQX-WMLDXEAASA-N	0	3	343.496	3.233	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccccc2C#N)C1	ZINC001036875492	1343813039	/nfs/dbraw/zinc/81/30/39/1343813039.db2.gz	BJZBVYCVAZSSIF-QZTJIDSGSA-N	0	3	325.456	3.027	20	30		EGEDHN
CC1(C(=O)N[C@H]2CCC[C@@H]2CNCc2cc(F)ccc2C#N)CCC1	ZINC001037056249	1343953604	/nfs/dbraw/zinc/95/36/04/1343953604.db2.gz	DETMBTFNVVHXCQ-QAPCUYQASA-N	0	3	343.446	3.262	20	30		EGEDHN
Cc1coc(C(=O)N[C@@H]2CCC[C@@H]2CNCc2ccccc2C#N)c1	ZINC001037061020	1343956795	/nfs/dbraw/zinc/95/67/95/1343956795.db2.gz	WVPKRJSJUGXIGV-QZTJIDSGSA-N	0	3	337.423	3.148	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCC[C@@H]2CNCc2ccccc2C#N)C1	ZINC001037074819	1343968065	/nfs/dbraw/zinc/96/80/65/1343968065.db2.gz	HGDYLJYZTZIJPG-MOPGFXCFSA-N	0	3	337.467	3.289	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCC[C@H]1NC(=O)c1ccco1	ZINC001037145523	1343995039	/nfs/dbraw/zinc/99/50/39/1343995039.db2.gz	CQZBWUZUMQRYGL-QZTJIDSGSA-N	0	3	337.423	3.230	20	30		EGEDHN
CC[C@H]1CN(C(=O)C2(C)CC2)CC[C@@H]1NCc1cc(F)ccc1C#N	ZINC001037854947	1344140891	/nfs/dbraw/zinc/14/08/91/1344140891.db2.gz	SEDHBDDMRLZPIM-KSSFIOAISA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1cc(Cl)c(Cl)n1C	ZINC001038321797	1344379809	/nfs/dbraw/zinc/37/98/09/1344379809.db2.gz	OHZFRXXRJGOAQB-LLVKDONJSA-N	0	3	330.259	3.102	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1cc(C)n(C(CC)CC)n1	ZINC001038436021	1344427957	/nfs/dbraw/zinc/42/79/57/1344427957.db2.gz	OZODOLDWTQIPFS-QGZVFWFLSA-N	0	3	332.492	3.323	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCN2C[C@@H]2CCCC(F)(F)C2)cc1	ZINC001038582673	1344493482	/nfs/dbraw/zinc/49/34/82/1344493482.db2.gz	QNDGEHCFMXYTPW-AEFFLSMTSA-N	0	3	346.421	3.298	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CCN2C[C@@H](OC)C2CCCC2)CC1	ZINC001038667862	1344531855	/nfs/dbraw/zinc/53/18/55/1344531855.db2.gz	QBWHJXJTOKBTER-RTBURBONSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1cc(F)cc2cccnc21	ZINC001038766723	1344574366	/nfs/dbraw/zinc/57/43/66/1344574366.db2.gz	GJEOAPDRYPVHCB-INIZCTEOSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=CCCN1CC[C@H]1CNC(=O)[C@@H]1CCCO[C@H]1c1ccc(C)cc1	ZINC001038789586	1344585512	/nfs/dbraw/zinc/58/55/12/1344585512.db2.gz	JHKFHBHLIOAZRV-ZCNNSNEGSA-N	0	3	342.483	3.229	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC([C@@H]2CCN(CC=C(Cl)Cl)C2)CC1	ZINC001039127670	1344804721	/nfs/dbraw/zinc/80/47/21/1344804721.db2.gz	SDPMUDWMIDHKAO-GXTWGEPZSA-N	0	3	344.286	3.026	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cccc(F)c2C)C1	ZINC001039211759	1344926938	/nfs/dbraw/zinc/92/69/38/1344926938.db2.gz	VBHQEJREDMSDRB-APWZRJJASA-N	0	3	328.431	3.084	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2c[nH]c3ccccc23)C1	ZINC001039217447	1344934268	/nfs/dbraw/zinc/93/42/68/1344934268.db2.gz	HBSQBFYGUQNWOP-UZLBHIALSA-N	0	3	335.451	3.118	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cccc(Cl)c2F)C1	ZINC001039225509	1344943426	/nfs/dbraw/zinc/94/34/26/1344943426.db2.gz	PSSWHFZENWHRGP-WMLDXEAASA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc(Cl)cs2)C1	ZINC001039233279	1344953484	/nfs/dbraw/zinc/95/34/84/1344953484.db2.gz	AGJYRSMSCBOIFG-ZFWWWQNUSA-N	0	3	336.888	3.351	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cccc3cc[nH]c32)C1	ZINC001039236415	1344958447	/nfs/dbraw/zinc/95/84/47/1344958447.db2.gz	BTHLDGKXXSLKPQ-PKOBYXMFSA-N	0	3	335.451	3.118	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)CCc2ccccc2F)C1	ZINC001039240490	1344965511	/nfs/dbraw/zinc/96/55/11/1344965511.db2.gz	UWQBAQASGHUNGA-ICSRJNTNSA-N	0	3	342.458	3.095	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc(F)cc(F)c2)C1	ZINC001039240918	1344966382	/nfs/dbraw/zinc/96/63/82/1344966382.db2.gz	WIRCUBLXMIHDPE-DNVCBOLYSA-N	0	3	346.421	3.305	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(F)cc(F)c2)C1	ZINC001039240916	1344966589	/nfs/dbraw/zinc/96/65/89/1344966589.db2.gz	WIRCUBLXMIHDPE-BEFAXECRSA-N	0	3	346.421	3.305	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(C)nc2C)C1	ZINC001039242661	1344968719	/nfs/dbraw/zinc/96/87/19/1344968719.db2.gz	QIUJFABVVUFKRI-QUCCMNQESA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cccc3cnccc32)C1	ZINC001039243350	1344970549	/nfs/dbraw/zinc/97/05/49/1344970549.db2.gz	UPZQSHCAZKPJOV-RXVVDRJESA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)C2CC3(CCC3)C2)C1	ZINC001039244718	1344972949	/nfs/dbraw/zinc/97/29/49/1344972949.db2.gz	MCIVUBAGTOSYKT-HKUYNNGSSA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2occ3c2CCCC3)C1	ZINC001039247376	1344977244	/nfs/dbraw/zinc/97/72/44/1344977244.db2.gz	VXRJGUKMRMSBIC-VQIMIIECSA-N	0	3	340.467	3.108	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2sc(C)nc2C)C1	ZINC001039250523	1344981311	/nfs/dbraw/zinc/98/13/11/1344981311.db2.gz	OQHUGLGDPYVRMU-SJORKVTESA-N	0	3	345.512	3.100	20	30		EGEDHN
N#Cc1ccccc1CNC1C[C@H]2CCC[C@@H](C1)N2C(=O)c1ccco1	ZINC001039264324	1344989064	/nfs/dbraw/zinc/98/90/64/1344989064.db2.gz	YYDIJHIZUGVDOG-YQQQUEKLSA-N	0	3	349.434	3.467	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ocnc1-c1ccccc1	ZINC001039384409	1345038727	/nfs/dbraw/zinc/03/87/27/1345038727.db2.gz	UBZLVHBIOKHZFC-MSOLQXFVSA-N	0	3	349.434	3.044	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@H](C)c1ccncc1	ZINC001039393960	1345043479	/nfs/dbraw/zinc/04/34/79/1345043479.db2.gz	QXVKAGMDDMLAEP-UHOSZYNNSA-N	0	3	327.472	3.217	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccnc2ccccc21	ZINC001039401090	1345047492	/nfs/dbraw/zinc/04/74/92/1345047492.db2.gz	JEOCEYWRQYXIQP-SJORKVTESA-N	0	3	335.451	3.490	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc2c(cc(C)cc2C)[nH]1	ZINC001039413651	1345055562	/nfs/dbraw/zinc/05/55/62/1345055562.db2.gz	WNAKCQHWSMPUAP-MSOLQXFVSA-N	0	3	349.478	3.487	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H]1CCOc2ccccc21	ZINC001039415966	1345056563	/nfs/dbraw/zinc/05/65/63/1345056563.db2.gz	CZLVBARWEDFDPO-KSZLIROESA-N	0	3	340.467	3.194	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc2ccsc2[nH]1	ZINC001039415546	1345056933	/nfs/dbraw/zinc/05/69/33/1345056933.db2.gz	XUBMNKSWWDZJSP-CABCVRRESA-N	0	3	329.469	3.484	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C12CCC(CC1)C2(C)C	ZINC001039448412	1345073389	/nfs/dbraw/zinc/07/33/89/1345073389.db2.gz	NQASOGVSBSGESW-IOBOIYPZSA-N	0	3	328.500	3.291	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1[C@@H]2c3ccccc3C[C@H]12	ZINC001039450325	1345074294	/nfs/dbraw/zinc/07/42/94/1345074294.db2.gz	VEQOVIBLKAICDZ-KZEVZHLLSA-N	0	3	336.479	3.214	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccc(OCCC)c1	ZINC001039459502	1345078435	/nfs/dbraw/zinc/07/84/35/1345078435.db2.gz	YDMLPRIDHMUIOE-MOPGFXCFSA-N	0	3	342.483	3.269	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H]1CCC2(CCC2)CO1	ZINC001039462642	1345081218	/nfs/dbraw/zinc/08/12/18/1345081218.db2.gz	XYEZLBPVHWTKME-QYZOEREBSA-N	0	3	346.515	3.367	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)COc1ccccc1C	ZINC001039465748	1345083790	/nfs/dbraw/zinc/08/37/90/1345083790.db2.gz	YNCLALQRDGLVMH-MSOLQXFVSA-N	0	3	328.456	3.015	20	30		EGEDHN
C=CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1scnc1Cl	ZINC001039472107	1345087673	/nfs/dbraw/zinc/08/76/73/1345087673.db2.gz	CARXVQUJSBTPSC-NEPJUHHUSA-N	0	3	325.865	3.052	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)CCc1cccc(F)c1F	ZINC001039478565	1345092571	/nfs/dbraw/zinc/09/25/71/1345092571.db2.gz	MVOBDCYAADUGPB-CVEARBPZSA-N	0	3	334.410	3.149	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CCC[C@@H](C1)N2C[C@H]1C[C@]12CCOC2	ZINC001039823051	1345199786	/nfs/dbraw/zinc/19/97/86/1345199786.db2.gz	NRLMABZFJZXCIX-WIRSXHRWSA-N	0	3	346.515	3.081	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC[C@H]1CCOC1	ZINC001039896629	1345238900	/nfs/dbraw/zinc/23/89/00/1345238900.db2.gz	NSLOSXDBPGHCPA-PNYFIKQUSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N1C[C@H]2CCC[C@@H](C1)N2CCC1CCCC1	ZINC001039923268	1345246227	/nfs/dbraw/zinc/24/62/27/1345246227.db2.gz	QGMRXZGEJZTZFY-WCIQWLHISA-N	0	3	346.515	3.223	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3sccc3Cl)C2)C1	ZINC001040224158	1345384079	/nfs/dbraw/zinc/38/40/79/1345384079.db2.gz	UQOZWPUTXCYSGC-KRWDZBQOSA-N	0	3	336.888	3.353	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3c(C)c(F)ccc3Cl)C2)C1	ZINC001040271448	1345405290	/nfs/dbraw/zinc/40/52/90/1345405290.db2.gz	RNINGIXAQWHDQN-LJQANCHMSA-N	0	3	348.849	3.349	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cc(C)sc3C)C2)C1	ZINC001040282473	1345410513	/nfs/dbraw/zinc/41/05/13/1345410513.db2.gz	IWJMJAHULJCOHI-IBGZPJMESA-N	0	3	330.497	3.316	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3ccc(C)c4cccnc34)C2)C1	ZINC001040299863	1345419940	/nfs/dbraw/zinc/41/99/40/1345419940.db2.gz	GWBUDYRKJWLLMY-QFIPXVFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cc4ccsc4[nH]3)C2)C1	ZINC001040319846	1345430289	/nfs/dbraw/zinc/43/02/89/1345430289.db2.gz	LELMZKBHCUGISR-IBGZPJMESA-N	0	3	341.480	3.181	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)C(C3CCC3)C3CCC3)C2)C1	ZINC001040357130	1345452304	/nfs/dbraw/zinc/45/23/04/1345452304.db2.gz	NOVUITRNXYJABG-OAQYLSRUSA-N	0	3	328.500	3.151	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3c(F)ccc(C)c3F)C2)C1	ZINC001040372001	1345460526	/nfs/dbraw/zinc/46/05/26/1345460526.db2.gz	NSUCLKQWYAQVSV-LJQANCHMSA-N	0	3	334.410	3.387	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3ccc(C)c(Cl)c3)C2)C1	ZINC001040374086	1345461194	/nfs/dbraw/zinc/46/11/94/1345461194.db2.gz	YQDOFYIEBKWCAP-IBGZPJMESA-N	0	3	330.859	3.210	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@]3(C2)CCCN(Cc2cccnc2)C3)C1	ZINC001040380817	1345466290	/nfs/dbraw/zinc/46/62/90/1345466290.db2.gz	VADIMGQOTLCKKG-OAQYLSRUSA-N	0	3	339.483	3.252	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cnc4ccccc4c3)C2)C1	ZINC001040421077	1345488139	/nfs/dbraw/zinc/48/81/39/1345488139.db2.gz	DSCGEYNPOZSJID-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
Fc1c(F)c(C(F)(F)F)c(F)c(F)c1O[C@H]1CCNC[C@@H]1F	ZINC001218064611	1373551379	/nfs/dbraw/zinc/55/13/79/1373551379.db2.gz	NPDGKSYDJDCJKS-WHFBIAKZSA-N	0	3	335.194	3.341	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@@]2(C1)CCCN(Cc1cccc(C#N)c1)C2	ZINC001040501566	1345521905	/nfs/dbraw/zinc/52/19/05/1345521905.db2.gz	CLHIUEQADPQETB-NRFANRHFSA-N	0	3	339.483	3.419	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)C3CCC(C(F)F)CC3)C2)C1	ZINC001040513020	1345527636	/nfs/dbraw/zinc/52/76/36/1345527636.db2.gz	KIANMRXRPIXSTL-RJYAGPCLSA-N	0	3	338.442	3.006	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cc4ccccc4o3)C2)C1	ZINC001040519571	1345530271	/nfs/dbraw/zinc/53/02/71/1345530271.db2.gz	MTKBCVWFUSWLAW-OAQYLSRUSA-N	0	3	336.435	3.384	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ccc4c(c3)CCC4)C2)C1	ZINC001040524962	1345533341	/nfs/dbraw/zinc/53/33/41/1345533341.db2.gz	OTNDISVUYLBOPN-QFIPXVFZSA-N	0	3	336.479	3.127	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cc(Cl)cn3CC)C2)C1	ZINC001040535188	1345535725	/nfs/dbraw/zinc/53/57/25/1345535725.db2.gz	PFUPSWHRFHMLRD-LJQANCHMSA-N	0	3	347.890	3.113	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cncc4ccccc43)C2)C1	ZINC001040543258	1345538577	/nfs/dbraw/zinc/53/85/77/1345538577.db2.gz	NBYQGLMZXFHPCD-NRFANRHFSA-N	0	3	335.451	3.349	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cncc4ccccc43)C2)C1	ZINC001040543919	1345539091	/nfs/dbraw/zinc/53/90/91/1345539091.db2.gz	RNTGJXXMXCWIIA-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3csc(C)c3C)C2)CC1	ZINC001040714668	1345569264	/nfs/dbraw/zinc/56/92/64/1345569264.db2.gz	KMDJAXGFAYDACK-UHFFFAOYSA-N	0	3	330.497	3.316	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)Cc3ccc(C)c(Cl)c3)C2)CC1	ZINC001040746058	1345573635	/nfs/dbraw/zinc/57/36/35/1345573635.db2.gz	UUFIUGXDUDQLDN-UHFFFAOYSA-N	0	3	344.886	3.139	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccc(Cl)cc3C)C2)CC1	ZINC001040831035	1345583858	/nfs/dbraw/zinc/58/38/58/1345583858.db2.gz	RLFSZBBAEDFIRM-UHFFFAOYSA-N	0	3	330.859	3.210	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccc4c(c3)C=CCC4)C2)CC1	ZINC001040876510	1345593361	/nfs/dbraw/zinc/59/33/61/1345593361.db2.gz	IPJJMUWRBSSIKA-UHFFFAOYSA-N	0	3	334.463	3.207	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cccc4cnccc43)C2)CC1	ZINC001040939061	1345605171	/nfs/dbraw/zinc/60/51/71/1345605171.db2.gz	MDWZVLTVGAXELR-UHFFFAOYSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)C3CC(c4ccccc4)C3)C2)CC1	ZINC001040954018	1345609582	/nfs/dbraw/zinc/60/95/82/1345609582.db2.gz	MIELDRGVGDDBDG-UHFFFAOYSA-N	0	3	336.479	3.128	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001041088949	1345650271	/nfs/dbraw/zinc/65/02/71/1345650271.db2.gz	SOXUONNPANTXOW-OXQOHEQNSA-N	0	3	325.456	3.029	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N1CC[C@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001041219014	1345681093	/nfs/dbraw/zinc/68/10/93/1345681093.db2.gz	LFMHTQBSDIAJIV-RXVVDRJESA-N	0	3	337.467	3.029	20	30		EGEDHN
CC(C(=O)N1CC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1)=C1CCC1	ZINC001041275050	1345691564	/nfs/dbraw/zinc/69/15/64/1345691564.db2.gz	CCVVUMZXKXTISQ-QFIPXVFZSA-N	0	3	349.478	3.483	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccc(CCC)s3)C2)C1	ZINC001041327901	1345703363	/nfs/dbraw/zinc/70/33/63/1345703363.db2.gz	QMDQURVDJPPINZ-IBGZPJMESA-N	0	3	330.497	3.262	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3cc(Cl)sc3Cl)C2)C1	ZINC001041356619	1345708865	/nfs/dbraw/zinc/70/88/65/1345708865.db2.gz	ZXGMPODBIBFCDR-HNNXBMFYSA-N	0	3	343.279	3.226	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cccc4c(C)c(C)[nH]c43)C2)C1	ZINC001041412370	1345722557	/nfs/dbraw/zinc/72/25/57/1345722557.db2.gz	LADNBZUIKWHPEY-QFIPXVFZSA-N	0	3	349.478	3.346	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)CCc3ccc4[nH]ccc4c3)C2)C1	ZINC001041478161	1345740188	/nfs/dbraw/zinc/74/01/88/1345740188.db2.gz	FODARISIPFKNKW-QFIPXVFZSA-N	0	3	349.478	3.048	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)CCc3ccc(C)cc3C)C2)C1	ZINC001041515616	1345749941	/nfs/dbraw/zinc/74/99/41/1345749941.db2.gz	SMUVVPULCNFZJK-QFIPXVFZSA-N	0	3	338.495	3.184	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cc4cc(C)ccc4[nH]3)C2)C1	ZINC001041528898	1345753090	/nfs/dbraw/zinc/75/30/90/1345753090.db2.gz	ZQEVUHKSLNASPG-OAQYLSRUSA-N	0	3	335.451	3.038	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@]2(CCN(Cc3oc(C)nc3C)C2)C1	ZINC001041638086	1345805372	/nfs/dbraw/zinc/80/53/72/1345805372.db2.gz	HTSLPKMDBYXLPC-UXHICEINSA-N	0	3	345.487	3.318	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3ccc(C)c4ccccc34)C2)C1	ZINC001041712447	1345827474	/nfs/dbraw/zinc/82/74/74/1345827474.db2.gz	NSJXHAJGAQRVEQ-QFIPXVFZSA-N	0	3	332.447	3.319	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@]3(CCN(C(=O)[C@@H]4CC45CCC5)C3)C2)c1	ZINC001041715995	1345828929	/nfs/dbraw/zinc/82/89/29/1345828929.db2.gz	YPUMXMMZEOMFEV-FPOVZHCZSA-N	0	3	349.478	3.173	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)[C@H](CC3CCCC3)C(C)C)C2)C1	ZINC001041720334	1345830231	/nfs/dbraw/zinc/83/02/31/1345830231.db2.gz	NJOIRKHGMYCBHY-CTNGQTDRSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)C[C@@H](C)c3ccccc3C)C2)C1	ZINC001041724042	1345832435	/nfs/dbraw/zinc/83/24/35/1345832435.db2.gz	MQJYTOSVXJXZRY-KNQAVFIVSA-N	0	3	338.495	3.436	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3cc4cc(C)ccc4s3)C2)C1	ZINC001041770155	1345843834	/nfs/dbraw/zinc/84/38/34/1345843834.db2.gz	YRRFWLBZHNTLBW-HXUWFJFHSA-N	0	3	338.476	3.381	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)C(C)(C)c3ccc(C)cc3)C2)C1	ZINC001041793343	1345852070	/nfs/dbraw/zinc/85/20/70/1345852070.db2.gz	JTMWZBADJDPDNO-JOCHJYFZSA-N	0	3	338.495	3.220	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3sccc3C3CC3)C2)C1	ZINC001041816114	1345861133	/nfs/dbraw/zinc/86/11/33/1345861133.db2.gz	LCDWCGQLAGDQMS-LJQANCHMSA-N	0	3	328.481	3.187	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccc(C)c4c3CCC4)C2)C1	ZINC001041847715	1345872636	/nfs/dbraw/zinc/87/26/36/1345872636.db2.gz	CHXDGIGZKGTCTO-QFIPXVFZSA-N	0	3	336.479	3.045	20	30		EGEDHN
CC(C)(C)CC(=O)N1CC[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@H]2C1	ZINC001041926796	1345899876	/nfs/dbraw/zinc/89/98/76/1345899876.db2.gz	FENHKJRAYYUJJF-OALUTQOASA-N	0	3	339.483	3.417	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(C)c(OC)c(C)c3)C[C@H]21	ZINC001042066311	1345934557	/nfs/dbraw/zinc/93/45/57/1345934557.db2.gz	DBPKTUYTJXUIQL-SJLPKXTDSA-N	0	3	328.456	3.034	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3nccc4ccsc43)C[C@@H]21	ZINC001042101715	1345944546	/nfs/dbraw/zinc/94/45/46/1345944546.db2.gz	XQIAYNTXZYMUNP-ZFWWWQNUSA-N	0	3	327.453	3.019	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CCN(C(=O)C4(C5CC5)CC4)C[C@@H]32)c1	ZINC001042107512	1345945894	/nfs/dbraw/zinc/94/58/94/1345945894.db2.gz	RKXJGNVQESPXLQ-QUCCMNQESA-N	0	3	349.478	3.171	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C3(C)CCC(F)(F)CC3)C[C@H]21	ZINC001042116297	1345948465	/nfs/dbraw/zinc/94/84/65/1345948465.db2.gz	BHDPWCXHYRNICR-HZPDHXFCSA-N	0	3	338.442	3.148	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cc(F)cc4ccoc43)C[C@H]21	ZINC001042122189	1345949502	/nfs/dbraw/zinc/94/95/02/1345949502.db2.gz	NAZZLFRAIZYIOC-KBXCAEBGSA-N	0	3	340.398	3.132	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3csc(C(F)(F)F)c3)C[C@@H]21	ZINC001042132657	1345952556	/nfs/dbraw/zinc/95/25/56/1345952556.db2.gz	HEYXBRFUNPXNSZ-AAEUAGOBSA-N	0	3	344.402	3.489	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(-c4ccccc4)on3)C[C@@H]21	ZINC001042141711	1345954453	/nfs/dbraw/zinc/95/44/53/1345954453.db2.gz	IMUCSXYFASLICF-QAPCUYQASA-N	0	3	337.423	3.064	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)c3ccc4c5c(cccc53)CC4)C[C@@H]21	ZINC001042146320	1345956727	/nfs/dbraw/zinc/95/67/27/1345956727.db2.gz	NOXDVWBUXFOPMS-IERDGZPVSA-N	0	3	344.458	3.108	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CCN(C(=O)[C@H]4C[C@H]5C[C@H]5C4)C[C@H]32)cc1	ZINC001042197050	1345979969	/nfs/dbraw/zinc/97/99/69/1345979969.db2.gz	WSYMWPLMGLNIJP-CRSSMBPESA-N	0	3	349.478	3.027	20	30		EGEDHN
CCC1(C(=O)N2CC[C@@H]3CCN(Cc4cccc(C#N)c4)[C@H]3C2)CC1	ZINC001042220768	1345991854	/nfs/dbraw/zinc/99/18/54/1345991854.db2.gz	FKUCUERGETZJMP-OALUTQOASA-N	0	3	337.467	3.171	20	30		EGEDHN
C#CCN1CC[C@H]2CCN(C(=O)c3ccc(C)c4ccccc34)C[C@@H]21	ZINC001042246189	1346004069	/nfs/dbraw/zinc/00/40/69/1346004069.db2.gz	CGJFRPWBHGCNMO-UWJYYQICSA-N	0	3	332.447	3.318	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C(C)(C)c3ccccc3F)C[C@@H]21	ZINC001042268547	1346012824	/nfs/dbraw/zinc/01/28/24/1346012824.db2.gz	DFRZDBQGBMCNRD-YJBOKZPZSA-N	0	3	330.447	3.212	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@H]3CC[C@H](C(C)C)CC3)C[C@H]21	ZINC001042288071	1346017852	/nfs/dbraw/zinc/01/78/52/1346017852.db2.gz	ALEPRYQFFMDSEU-UAFMIMERSA-N	0	3	330.516	3.395	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)C(C)(C)Cc3ccccc3)C[C@@H]21	ZINC001042303490	1346025071	/nfs/dbraw/zinc/02/50/71/1346025071.db2.gz	HQJXWRDGQJCRQX-PMACEKPBSA-N	0	3	338.495	3.201	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C34CC5CC(CC(C5)C3)C4)C[C@H]21	ZINC001042327947	1346036946	/nfs/dbraw/zinc/03/69/46/1346036946.db2.gz	QJJYWFKOHNAWNT-PHMMFBKASA-N	0	3	340.511	3.149	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)Cc3c(F)cccc3Cl)C[C@@H]21	ZINC001042331196	1346038473	/nfs/dbraw/zinc/03/84/73/1346038473.db2.gz	NYQPIRQYXRZFDW-DYVFJYSZSA-N	0	3	336.838	3.130	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)COc3ccccc3C(C)C)C[C@@H]21	ZINC001042342007	1346045961	/nfs/dbraw/zinc/04/59/61/1346045961.db2.gz	SFGBNWGKLMWLGK-HKUYNNGSSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(OCC4CC4)cc3)C[C@H]21	ZINC001042354797	1346053216	/nfs/dbraw/zinc/05/32/16/1346053216.db2.gz	GWLYUMTVQCCUJE-YLJYHZDGSA-N	0	3	340.467	3.198	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C(C)(C)c3ccc(OC)cc3)C[C@@H]21	ZINC001042362038	1346055712	/nfs/dbraw/zinc/05/57/12/1346055712.db2.gz	GXYXDAPYFDGMPE-APWZRJJASA-N	0	3	342.483	3.082	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc4ccccc4n3CC)C[C@H]21	ZINC001042367388	1346058596	/nfs/dbraw/zinc/05/85/96/1346058596.db2.gz	GTGMQQUXFOWAOY-OXJNMPFZSA-N	0	3	337.467	3.384	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C34CC(c5ccccc5)(C3)C4)C[C@H]21	ZINC001042376335	1346064122	/nfs/dbraw/zinc/06/41/22/1346064122.db2.gz	QHXGXKAZWWVXML-ZEABBNLPSA-N	0	3	348.490	3.054	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C3(C(F)(F)F)CCCC3)C[C@@H]21	ZINC001042379280	1346064913	/nfs/dbraw/zinc/06/49/13/1346064913.db2.gz	JFOQBUGIHGRRTE-KGLIPLIRSA-N	0	3	330.394	3.218	20	30		EGEDHN
Cc1ccoc1C(=O)N1CC[C@H](NCc2ccccc2C#N)C[C@H]1C	ZINC001044468674	1346341787	/nfs/dbraw/zinc/34/17/87/1346341787.db2.gz	SAKMPWZUWLDUJJ-QAPCUYQASA-N	0	3	337.423	3.243	20	30		EGEDHN
Cc1ccoc1C(=O)N1CC[C@H](NCc2ccccc2C#N)C[C@@H]1C	ZINC001044468675	1346341846	/nfs/dbraw/zinc/34/18/46/1346341846.db2.gz	SAKMPWZUWLDUJJ-YJBOKZPZSA-N	0	3	337.423	3.243	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)CC(C)(C)C	ZINC001044469610	1346341855	/nfs/dbraw/zinc/34/18/55/1346341855.db2.gz	YDKRQYOBCLRJDO-QAPCUYQASA-N	0	3	327.472	3.464	20	30		EGEDHN
C[C@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)CCC1CC1	ZINC001044510317	1346352751	/nfs/dbraw/zinc/35/27/51/1346352751.db2.gz	PNOGHWDCCJDVDN-HNAYVOBHSA-N	0	3	325.456	3.218	20	30		EGEDHN
Cc1cncc(C(=O)N2CC[C@H](NCc3ccccc3C#N)C[C@H]2C)c1	ZINC001044522776	1346355707	/nfs/dbraw/zinc/35/57/07/1346355707.db2.gz	KRQUNTPHIUNISJ-UZLBHIALSA-N	0	3	348.450	3.045	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)C1CC2(CC2)C1	ZINC001044738867	1346417426	/nfs/dbraw/zinc/41/74/26/1346417426.db2.gz	GYOHEIDMPFWXRD-DNVCBOLYSA-N	0	3	337.467	3.218	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)c2ccc(Cl)o2)s1	ZINC001044927599	1346465324	/nfs/dbraw/zinc/46/53/24/1346465324.db2.gz	LBDMKHRRMZHZKE-NSHDSACASA-N	0	3	349.843	3.261	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC[C@H]1CNCc1cncc(C)c1	ZINC001045054178	1346487596	/nfs/dbraw/zinc/48/75/96/1346487596.db2.gz	XFNLJXQFMUTIAE-INIZCTEOSA-N	0	3	335.879	3.249	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCC[C@H]1CNCc1ccccc1F	ZINC001045070778	1346489691	/nfs/dbraw/zinc/48/96/91/1346489691.db2.gz	UVDPZKRAQWUTAU-KRWDZBQOSA-N	0	3	341.430	3.208	20	30		EGEDHN
CC1(C)CC[C@H]1C(=O)N1CCC[C@H]1CNCc1ccc(C#N)cc1F	ZINC001045161065	1346510527	/nfs/dbraw/zinc/51/05/27/1346510527.db2.gz	YNGKOWOJFGXEIG-IRXDYDNUSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=CCn1cccc1C(=O)NC1(C)CCN(CCC(F)(F)F)CC1	ZINC001045462144	1346599875	/nfs/dbraw/zinc/59/98/75/1346599875.db2.gz	YGPXQTLEBCSNBW-UHFFFAOYSA-N	0	3	343.393	3.211	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)NC2(C)CCN(Cc3ccc(C#N)cc3)CC2)C1	ZINC001045579482	1346635334	/nfs/dbraw/zinc/63/53/34/1346635334.db2.gz	DPZBYSYCMBZJGZ-LPHOPBHVSA-N	0	3	339.483	3.465	20	30		EGEDHN
Cc1cc(C(=O)NC2(C)CCN(Cc3ccc(C#N)cc3)CC2)ccn1	ZINC001045592872	1346639386	/nfs/dbraw/zinc/63/93/86/1346639386.db2.gz	DLZQVTRACLLCSK-UHFFFAOYSA-N	0	3	348.450	3.046	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2ccc(N(C)C(C)C)cc2)CC1	ZINC001045651177	1346660300	/nfs/dbraw/zinc/66/03/00/1346660300.db2.gz	ADNRETKVNOZLRF-UHFFFAOYSA-N	0	3	329.488	3.302	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CC[C@@H](C1)N2CCc1csc(C)n1	ZINC001045827014	1346709878	/nfs/dbraw/zinc/70/98/78/1346709878.db2.gz	GISULUNNEKBZDA-SJORKVTESA-N	0	3	347.528	3.272	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H]2CC[C@@H](C1)N2CCc1ccns1	ZINC001045840767	1346716456	/nfs/dbraw/zinc/71/64/56/1346716456.db2.gz	NSZKNPCOIGFXTK-GJYPPUQNSA-N	0	3	347.528	3.353	20	30		EGEDHN
CC1(C(=O)N2CC[C@H]3CC[C@@H](C2)N3Cc2cccc(C#N)c2)CC=CC1	ZINC001045841043	1346716814	/nfs/dbraw/zinc/71/68/14/1346716814.db2.gz	FSTGIPHHNYANKL-UXHICEINSA-N	0	3	349.478	3.480	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)/C=C/c1ccco1)C2	ZINC001045909184	1346746504	/nfs/dbraw/zinc/74/65/04/1346746504.db2.gz	KHKLIPCBIXCVKG-IBDYFIJFSA-N	0	3	326.440	3.021	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cccc(F)c1C)C2	ZINC001045940158	1346775566	/nfs/dbraw/zinc/77/55/66/1346775566.db2.gz	RGHXPRVIGUBUQS-NRFANRHFSA-N	0	3	342.458	3.476	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cccc(C)c1F)C2	ZINC001045940123	1346775578	/nfs/dbraw/zinc/77/55/78/1346775578.db2.gz	QXJMAUVROPRHLB-FQEVSTJZSA-N	0	3	328.431	3.086	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cccc(F)c1C)C2	ZINC001045940052	1346775737	/nfs/dbraw/zinc/77/57/37/1346775737.db2.gz	OUDTVCXUTHGPIC-HXUWFJFHSA-N	0	3	328.431	3.086	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)Cc1cccc(CC)c1)C2	ZINC001045948813	1346784387	/nfs/dbraw/zinc/78/43/87/1346784387.db2.gz	RSHQUBXNMXFBJM-QFIPXVFZSA-N	0	3	338.495	3.129	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc(C)c(F)c1)C2	ZINC001045951359	1346786965	/nfs/dbraw/zinc/78/69/65/1346786965.db2.gz	XWAJGLBBKOMPMD-NRFANRHFSA-N	0	3	342.458	3.476	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc(C)c(CC)o1)C2	ZINC001045979971	1346817700	/nfs/dbraw/zinc/81/77/00/1346817700.db2.gz	NOFPVYXFFQCNPJ-OAQYLSRUSA-N	0	3	342.483	3.492	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc(F)cc1C)C2	ZINC001045981128	1346819206	/nfs/dbraw/zinc/81/92/06/1346819206.db2.gz	POFQHHYQZCQSCP-NRFANRHFSA-N	0	3	342.458	3.476	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc(F)cc1C)C2	ZINC001045981161	1346819749	/nfs/dbraw/zinc/81/97/49/1346819749.db2.gz	QFDQBVVDXCJJCL-FQEVSTJZSA-N	0	3	328.431	3.086	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc(Cl)cn1CC)C2	ZINC001045985281	1346826015	/nfs/dbraw/zinc/82/60/15/1346826015.db2.gz	QJEOTIZSRPDXJI-IBGZPJMESA-N	0	3	347.890	3.113	20	30		EGEDHN
C#CCCN1CC[C@](C)(NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)s2)C1	ZINC001046569487	1347022191	/nfs/dbraw/zinc/02/21/91/1347022191.db2.gz	ZHYQPTZPMHALDN-XNJGSVPQSA-N	0	3	336.888	3.109	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@@H](CNC(=O)[C@H]2CCCC3(CC3)C2)C1	ZINC001046939164	1347157977	/nfs/dbraw/zinc/15/79/77/1347157977.db2.gz	KJKCRAZTGKFYJM-HOTGVXAUSA-N	0	3	338.442	3.054	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2cc3ncccc3o2)C1	ZINC001046956786	1347165102	/nfs/dbraw/zinc/16/51/02/1347165102.db2.gz	GDKJYRMJFIMSMO-CYBMUJFWSA-N	0	3	349.381	3.091	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2ccc(CF)cc2)C1	ZINC001046993441	1347176702	/nfs/dbraw/zinc/17/67/02/1347176702.db2.gz	FDUFQQUBJGQYJP-MRXNPFEDSA-N	0	3	340.389	3.419	20	30		EGEDHN
CCC(=O)N1CCC[C@H](C2CCN(CC#Cc3ccccc3)CC2)C1	ZINC001047217483	1347248471	/nfs/dbraw/zinc/24/84/71/1347248471.db2.gz	WFAJAFSXTHCGMW-NRFANRHFSA-N	0	3	338.495	3.399	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)/C=C\c3ccco3)C2)CC1	ZINC001047219048	1347250174	/nfs/dbraw/zinc/25/01/74/1347250174.db2.gz	IYFXMLTXPKLCMM-OLHLWXQYSA-N	0	3	340.467	3.267	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)[C@H]3CC=CCC3)C2)CC1	ZINC001047220971	1347252369	/nfs/dbraw/zinc/25/23/69/1347252369.db2.gz	AANNUBATRJIKKM-PMACEKPBSA-N	0	3	328.500	3.317	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)c3ccc(CC)o3)C2)CC1	ZINC001047245906	1347270851	/nfs/dbraw/zinc/27/08/51/1347270851.db2.gz	GDHJEKJWVVYCPO-GOSISDBHSA-N	0	3	342.483	3.430	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)c3cc(C)co3)C2)CC1	ZINC001047249062	1347274283	/nfs/dbraw/zinc/27/42/83/1347274283.db2.gz	RFDYUDCIPHZNLF-SFHVURJKSA-N	0	3	328.456	3.176	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3cc[nH]c3C(C)C)C2)CC1	ZINC001047250038	1347274784	/nfs/dbraw/zinc/27/47/84/1347274784.db2.gz	ZRZLWLUEXAQTCN-GOSISDBHSA-N	0	3	341.499	3.336	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)c3ccc(Cl)[nH]3)C2)CC1	ZINC001047254012	1347278061	/nfs/dbraw/zinc/27/80/61/1347278061.db2.gz	MBOSLYGJSKZKNR-MRXNPFEDSA-N	0	3	347.890	3.256	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)Cc3occc3C)C2)CC1	ZINC001047254163	1347278100	/nfs/dbraw/zinc/27/81/00/1347278100.db2.gz	ODEDXWLYDUZXLH-LJQANCHMSA-N	0	3	342.483	3.104	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3cc4ccccc4[nH]3)C2)CC1	ZINC001047264735	1347286038	/nfs/dbraw/zinc/28/60/38/1347286038.db2.gz	NGCSIWMZIIDQHF-IBGZPJMESA-N	0	3	349.478	3.365	20	30		EGEDHN
Cc1ccoc1C(=O)N1CC[C@@H]([C@H](C)NCc2ccccc2C#N)C1	ZINC001047726584	1347352301	/nfs/dbraw/zinc/35/23/01/1347352301.db2.gz	SUCWSVDSXBGEDZ-MAUKXSAKSA-N	0	3	337.423	3.100	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]([C@H](C)NCc2nc3ccccc3o2)C1	ZINC001047933264	1347414765	/nfs/dbraw/zinc/41/47/65/1347414765.db2.gz	WWKVAXGYKPGSTD-LSDHHAIUSA-N	0	3	341.455	3.367	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]([C@H](C)NCc3ccccc3C#N)C2)C1	ZINC001047966210	1347427248	/nfs/dbraw/zinc/42/72/48/1347427248.db2.gz	QQRMCFVXNULWAH-QFBILLFUSA-N	0	3	337.467	3.241	20	30		EGEDHN
C[C@H]1CN(C(=O)C2(F)CCCC2)C[C@H]1CNCc1ccccc1C#N	ZINC001048295915	1347511704	/nfs/dbraw/zinc/51/17/04/1347511704.db2.gz	RPKUYAUVHXAFKW-MAUKXSAKSA-N	0	3	343.446	3.025	20	30		EGEDHN
CCC1(C(=O)N2C[C@@H](CNCc3ccccc3C#N)[C@H](C)C2)CCC1	ZINC001048342071	1347524076	/nfs/dbraw/zinc/52/40/76/1347524076.db2.gz	GGVFAEYFMDYROR-VQIMIIECSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)[C@@H](CNCc2c(F)cccc2F)C1	ZINC001048344767	1347524941	/nfs/dbraw/zinc/52/49/41/1347524941.db2.gz	RMPQBIIBOVWHPQ-KGLIPLIRSA-N	0	3	336.426	3.361	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2Cc1ccc(C#N)s1	ZINC001048499625	1347569268	/nfs/dbraw/zinc/56/92/68/1347569268.db2.gz	RXBDQMZYHZKHLG-VPKNTQAGSA-N	0	3	343.496	3.135	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)C2=CCCC2)CC1	ZINC001048625898	1347623953	/nfs/dbraw/zinc/62/39/53/1347623953.db2.gz	SENPJNSTFFHVGU-UHFFFAOYSA-N	0	3	325.456	3.171	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CN(Cc3ccc(F)cc3)C[C@H]2C1	ZINC001048975429	1347695297	/nfs/dbraw/zinc/69/52/97/1347695297.db2.gz	XUFYLRCXCZKWMZ-CALCHBBNSA-N	0	3	330.447	3.318	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@@H](CC)CC3CCCCC3)C[C@@H]2C1	ZINC001049098120	1347725343	/nfs/dbraw/zinc/72/53/43/1347725343.db2.gz	IGBYIUSKUXTDNK-SLFFLAALSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3ccc(C(C)C)c(Cl)c3)C[C@@H]2C1	ZINC001049245003	1347757547	/nfs/dbraw/zinc/75/75/47/1347757547.db2.gz	DMSJZWOGSDYTIY-IYBDPMFKSA-N	0	3	330.859	3.100	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)c2ccccc2)c1	ZINC001049295239	1347776699	/nfs/dbraw/zinc/77/66/99/1347776699.db2.gz	DGTXBEPIOYKGHY-LEWJYISDSA-N	0	3	345.446	3.437	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)c2ccccc2)cc1	ZINC001049299820	1347779209	/nfs/dbraw/zinc/77/92/09/1347779209.db2.gz	UGDCBNILUDIIDJ-NHCUHLMSSA-N	0	3	345.446	3.437	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)C[C@@H]2C=CCC2)cc1	ZINC001049316219	1347788019	/nfs/dbraw/zinc/78/80/19/1347788019.db2.gz	UQQAIFVMSOBJHE-DUXKGJEZSA-N	0	3	349.478	3.480	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1sccc1C	ZINC001049476887	1347867750	/nfs/dbraw/zinc/86/77/50/1347867750.db2.gz	ZKGHYEWMJANFMN-VQHPVUNQSA-N	0	3	330.497	3.411	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc2ccccc2nc1C	ZINC001049514193	1347886054	/nfs/dbraw/zinc/88/60/54/1347886054.db2.gz	YHBOWDBOLUQYHY-VQTJNVASSA-N	0	3	335.451	3.408	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(-c2ccncc2)o1	ZINC001049517287	1347887811	/nfs/dbraw/zinc/88/78/11/1347887811.db2.gz	IHYRLUPDJYUGHK-QZTJIDSGSA-N	0	3	349.434	3.044	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)CC(C)(C)c1ccc(F)cc1	ZINC001049522588	1347890711	/nfs/dbraw/zinc/89/07/11/1347890711.db2.gz	RGWXQOYQGDVUIB-OALUTQOASA-N	0	3	342.458	3.192	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cncc(Cl)c1C	ZINC001049533932	1347894982	/nfs/dbraw/zinc/89/49/82/1347894982.db2.gz	XOYWFVXLBGDSKI-IRXDYDNUSA-N	0	3	333.863	3.298	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc2c(c1)C(C)(C)CO2	ZINC001049587026	1347923984	/nfs/dbraw/zinc/92/39/84/1347923984.db2.gz	DMQFHYDQSFDYBR-MSOLQXFVSA-N	0	3	340.467	3.222	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cncc(OC(C)C)c1	ZINC001049635935	1347946678	/nfs/dbraw/zinc/94/66/78/1347946678.db2.gz	WWBUVLSTOPKOOL-RBUKOAKNSA-N	0	3	343.471	3.124	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1cccnc1C	ZINC001049637207	1347946892	/nfs/dbraw/zinc/94/68/92/1347946892.db2.gz	WOKIOGFTXPKOSI-QZTJIDSGSA-N	0	3	327.472	3.168	20	30		EGEDHN
C[C@]1(C(=O)N2CCC[C@@H]3[C@@H]2CCN3Cc2ccc(C#N)cc2)C=CCC1	ZINC001049644407	1347951848	/nfs/dbraw/zinc/95/18/48/1347951848.db2.gz	JDFVJDDLUVNUDJ-URVUXULASA-N	0	3	349.478	3.480	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]3[C@@H]2CCN3CCC(F)(F)F)C1	ZINC001049704698	1347982435	/nfs/dbraw/zinc/98/24/35/1347982435.db2.gz	ZJDQDNQQWGRZMI-KGLIPLIRSA-N	0	3	330.394	3.360	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](C)Cc1cccs1	ZINC001049761452	1348006223	/nfs/dbraw/zinc/00/62/23/1348006223.db2.gz	KIBSBBISLCPBIZ-CGTJXYLNSA-N	0	3	330.497	3.015	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccn(C(CC)CC)n1	ZINC001049766432	1348010164	/nfs/dbraw/zinc/01/01/64/1348010164.db2.gz	KYKRAAAPXGSOPU-RBUKOAKNSA-N	0	3	344.503	3.499	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1scnc1C(C)(C)C	ZINC001049772393	1348013879	/nfs/dbraw/zinc/01/38/79/1348013879.db2.gz	GTPYEYTZTQPZQD-GJZGRUSLSA-N	0	3	345.512	3.143	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccccc1C	ZINC001049783256	1348019853	/nfs/dbraw/zinc/01/98/53/1348019853.db2.gz	UNVXJQUMBPKSNO-WOZUAGRISA-N	0	3	336.479	3.187	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)COc1ccsc1Cl	ZINC001049784048	1348020521	/nfs/dbraw/zinc/02/05/21/1348020521.db2.gz	WSPDQJIUQDWELJ-OLZOCXBDSA-N	0	3	340.876	3.032	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1csc(Cl)n1	ZINC001049823440	1348039971	/nfs/dbraw/zinc/03/99/71/1348039971.db2.gz	BMDJVSVCFZYWKB-CHWSQXEVSA-N	0	3	325.865	3.052	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1nc(C2CC2)oc1C	ZINC001049829376	1348044173	/nfs/dbraw/zinc/04/41/73/1348044173.db2.gz	SSDMXEGHBIJRMD-HOTGVXAUSA-N	0	3	329.444	3.115	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccnc(O[C@@H](C)CC)c1	ZINC001049843215	1348053985	/nfs/dbraw/zinc/05/39/85/1348053985.db2.gz	OEEKGHTWQHUTBV-RYQLBKOJSA-N	0	3	343.471	3.124	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1cccc2ccccc21	ZINC001049852970	1348059748	/nfs/dbraw/zinc/05/97/48/1348059748.db2.gz	BQHPVGUDTVQLBY-SFTDATJTSA-N	0	3	332.447	3.081	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc2nc(C)ccc2o1	ZINC001049854662	1348061704	/nfs/dbraw/zinc/06/17/04/1348061704.db2.gz	OZIKHVNPOMGAGO-DLBZAZTESA-N	0	3	339.439	3.391	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(N(CC)CC)cc1	ZINC001049863748	1348070005	/nfs/dbraw/zinc/07/00/05/1348070005.db2.gz	NQFJVOSTRVSHMD-WOJBJXKFSA-N	0	3	341.499	3.398	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1ncccc1OC(C)C	ZINC001049870386	1348076046	/nfs/dbraw/zinc/07/60/46/1348076046.db2.gz	MWXWVLXUOPDUMV-SJORKVTESA-N	0	3	343.471	3.124	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(OC(C)C)cc1	ZINC001049871540	1348077338	/nfs/dbraw/zinc/07/73/38/1348077338.db2.gz	MFZMNUSGKSKGQD-RBUKOAKNSA-N	0	3	328.456	3.339	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(OC)c(Cl)c1	ZINC001049888746	1348093001	/nfs/dbraw/zinc/09/30/01/1348093001.db2.gz	KBEBRIVXRDRPHI-JKSUJKDBSA-N	0	3	334.847	3.214	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)CC(C)(C)c1ccccc1	ZINC001049915984	1348110278	/nfs/dbraw/zinc/11/02/78/1348110278.db2.gz	DJDXMPRBEZEBBX-WOJBJXKFSA-N	0	3	338.495	3.443	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)CC(C)(C)c1ccccc1	ZINC001049915977	1348110447	/nfs/dbraw/zinc/11/04/47/1348110447.db2.gz	DJDXMPRBEZEBBX-UXHICEINSA-N	0	3	338.495	3.443	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N1CCC[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001050020821	1348157739	/nfs/dbraw/zinc/15/77/39/1348157739.db2.gz	LSNUOYUVGKWAPN-IPMKNSEASA-N	0	3	337.467	3.027	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3cc(C(C)(C)C)on3)[C@@H]2C1	ZINC001050092254	1348180343	/nfs/dbraw/zinc/18/03/43/1348180343.db2.gz	OTYYZSRGFDSINV-GOEBONIOSA-N	0	3	331.460	3.085	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3nc(Cl)sc3C)[C@@H]2C1	ZINC001050091672	1348180399	/nfs/dbraw/zinc/18/03/99/1348180399.db2.gz	ALSKGERCGRJPDX-QWHCGFSZSA-N	0	3	339.892	3.217	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)[C@@H](CC)Oc3cccc(C)c3)[C@@H]2C1	ZINC001050164064	1348201498	/nfs/dbraw/zinc/20/14/98/1348201498.db2.gz	ZPIFBUHNMBUWSD-DFQSSKMNSA-N	0	3	342.483	3.261	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)[C@H](C)c3ccc(F)c(F)c3)[C@@H]2C1	ZINC001050205199	1348210822	/nfs/dbraw/zinc/21/08/22/1348210822.db2.gz	CDYMGDBOYMDKKD-SIXWZSSISA-N	0	3	346.421	3.014	20	30		EGEDHN
Cc1ccoc1C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001050431966	1348264404	/nfs/dbraw/zinc/26/44/04/1348264404.db2.gz	JHQYQUFKZJDPEN-UHFFFAOYSA-N	0	3	349.434	3.198	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H](CC)OC3CCCCC3)C2)CC1	ZINC001050518088	1348282480	/nfs/dbraw/zinc/28/24/80/1348282480.db2.gz	RTCGQVFTMBTCME-LJQANCHMSA-N	0	3	346.515	3.062	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)Cc3cccc(C4CC4)c3)C2)CC1	ZINC001050601896	1348297813	/nfs/dbraw/zinc/29/78/13/1348297813.db2.gz	IDGSVRWJUMPTAT-UHFFFAOYSA-N	0	3	336.479	3.054	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H](C)c3ccc(Cl)cc3)C2)CC1	ZINC001050643972	1348313357	/nfs/dbraw/zinc/31/33/57/1348313357.db2.gz	ZBOPJJNUHYHURI-MRXNPFEDSA-N	0	3	344.886	3.391	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1scnc1C)CC2	ZINC001050645628	1348313824	/nfs/dbraw/zinc/31/38/24/1348313824.db2.gz	RWKCWPNYYNORFL-GOSISDBHSA-N	0	3	347.528	3.478	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3[nH]ccc3-c3ccccc3)C2)CC1	ZINC001050726990	1348339346	/nfs/dbraw/zinc/33/93/46/1348339346.db2.gz	YYTVQAIMJWFLKW-UHFFFAOYSA-N	0	3	347.462	3.243	20	30		EGEDHN
CC(C)=CCN1CCc2c(CNC(=O)c3ccc(C#N)[nH]3)cccc2C1	ZINC001051285428	1348418416	/nfs/dbraw/zinc/41/84/16/1348418416.db2.gz	LAQBTLLOKZWIGM-UHFFFAOYSA-N	0	3	348.450	3.141	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)[C@]34C[C@H]3CCCC4)cccc2C1	ZINC001051299819	1348424873	/nfs/dbraw/zinc/42/48/73/1348424873.db2.gz	PSIFVSWTLZSMSG-DENIHFKCSA-N	0	3	336.479	3.265	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3ccc(C)nc3C)cccc2C1	ZINC001051306900	1348428558	/nfs/dbraw/zinc/42/85/58/1348428558.db2.gz	WJEQBQNKTOZMME-UHFFFAOYSA-N	0	3	347.462	3.010	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2[nH]c3ccccc3c2Cl)CC1	ZINC001052526163	1348566138	/nfs/dbraw/zinc/56/61/38/1348566138.db2.gz	XIDANZZFBWJUJF-CYBMUJFWSA-N	0	3	329.831	3.039	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN(Cc3ncccc3C)CC2)cc1	ZINC001052610111	1348596255	/nfs/dbraw/zinc/59/62/55/1348596255.db2.gz	AFXOKCUKUWPIJK-HXUWFJFHSA-N	0	3	347.462	3.156	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN(Cc3cccnc3C)CC2)cc1	ZINC001052614061	1348597026	/nfs/dbraw/zinc/59/70/26/1348597026.db2.gz	KCQKRKODYUWPPO-OAQYLSRUSA-N	0	3	347.462	3.156	20	30		EGEDHN
Cc1coc(C(=O)N[C@@H]2CCCN(Cc3ccc(C#N)cc3)CC2)c1	ZINC001052640999	1348607948	/nfs/dbraw/zinc/60/79/48/1348607948.db2.gz	MIDVWMKWJXVVNL-GOSISDBHSA-N	0	3	337.423	3.244	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCCN(Cc3cncc(C)c3)CC2)C1	ZINC001052690536	1348634439	/nfs/dbraw/zinc/63/44/39/1348634439.db2.gz	NJKIBMPBCUSYFH-SFHVURJKSA-N	0	3	327.472	3.217	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCN(Cc3c(C)noc3CC)CC2)C1	ZINC001052692915	1348635947	/nfs/dbraw/zinc/63/59/47/1348635947.db2.gz	NCTASGWHENHRLQ-MRXNPFEDSA-N	0	3	345.487	3.372	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCCN(Cc3c(C)noc3CC)CC2)C1	ZINC001052692914	1348636079	/nfs/dbraw/zinc/63/60/79/1348636079.db2.gz	NCTASGWHENHRLQ-INIZCTEOSA-N	0	3	345.487	3.372	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cc(C(C)(C)C)oc2C)CC1	ZINC001052752669	1348662980	/nfs/dbraw/zinc/66/29/80/1348662980.db2.gz	VYFCRHAFDAMKPC-INIZCTEOSA-N	0	3	330.472	3.493	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@H](C)c2ccc(CC)cc2)CC1	ZINC001052793489	1348681180	/nfs/dbraw/zinc/68/11/80/1348681180.db2.gz	DXKMXGFXAFOGGV-XLIONFOSSA-N	0	3	326.484	3.347	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)C(C)(C)c2ccccc2Cl)CC1	ZINC001052875088	1348714002	/nfs/dbraw/zinc/71/40/02/1348714002.db2.gz	LNVNOBOPZQHVJR-HNNXBMFYSA-N	0	3	332.875	3.222	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cc(C)c(F)cc2Cl)CC1	ZINC001052900120	1348734532	/nfs/dbraw/zinc/73/45/32/1348734532.db2.gz	DYHGZVJMHPPMLD-AWEZNQCLSA-N	0	3	336.838	3.395	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)C2CCC(C(F)F)CC2)CC1	ZINC001052904509	1348738047	/nfs/dbraw/zinc/73/80/47/1348738047.db2.gz	SMPKVYLKEIFLHH-GPANFISMSA-N	0	3	326.431	3.052	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)C2(c3ccc(C)cc3)CCC2)CC1	ZINC001052965580	1348777047	/nfs/dbraw/zinc/77/70/47/1348777047.db2.gz	PLPQHYSDOJIWDN-FQEVSTJZSA-N	0	3	338.495	3.411	20	30		EGEDHN
CCC(=O)N1CCC[C@H]([C@H]2CCCN(CC#Cc3ccccc3)C2)C1	ZINC001052996520	1348793255	/nfs/dbraw/zinc/79/32/55/1348793255.db2.gz	JQCCIGJXYWWYJV-SFTDATJTSA-N	0	3	338.495	3.399	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2c(C)noc2C)C1	ZINC001053067902	1348881750	/nfs/dbraw/zinc/88/17/50/1348881750.db2.gz	SLBLEZFENBGKEZ-ZWKOTPCHSA-N	0	3	343.471	3.021	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)/C=C\c2ccc[nH]2)C1	ZINC001053080104	1348901103	/nfs/dbraw/zinc/90/11/03/1348901103.db2.gz	AKLVUHXTWKQIML-GHCKNRNOSA-N	0	3	339.483	3.144	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2sccc2F)C1	ZINC001053080178	1348901637	/nfs/dbraw/zinc/90/16/37/1348901637.db2.gz	BCDQXEIHAZXSKO-HOCLYGCPSA-N	0	3	334.460	3.227	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)C2C=CC=CC=C2)C1	ZINC001053085130	1348906386	/nfs/dbraw/zinc/90/63/86/1348906386.db2.gz	CCROATSZKKZKFA-RTWAWAEBSA-N	0	3	338.495	3.401	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cc(C)nc(C)c2)C1	ZINC001053087200	1348910799	/nfs/dbraw/zinc/91/07/99/1348910799.db2.gz	RJMKQEXIUJUFHL-ICSRJNTNSA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2occ3c2CCC3)C1	ZINC001053093063	1348920802	/nfs/dbraw/zinc/92/08/02/1348920802.db2.gz	UVWJAQOMFBPPEA-VQIMIIECSA-N	0	3	340.467	3.108	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)Cc2ccsc2C)C1	ZINC001053100729	1348934189	/nfs/dbraw/zinc/93/41/89/1348934189.db2.gz	IVSVSXGQLALWRM-MOPGFXCFSA-N	0	3	344.524	3.325	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ncccc2Cl)C1	ZINC001053103942	1348938539	/nfs/dbraw/zinc/93/85/39/1348938539.db2.gz	MARMGOHBEIXESN-DOTOQJQBSA-N	0	3	345.874	3.075	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2Cc3ccccc3CN2CCC)cc1	ZINC001054049554	1349138403	/nfs/dbraw/zinc/13/84/03/1349138403.db2.gz	BINDCTQLHPKWQG-NRFANRHFSA-N	0	3	332.447	3.235	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001054074286	1349146125	/nfs/dbraw/zinc/14/61/25/1349146125.db2.gz	JHJQYBNKGONHEC-OAQYLSRUSA-N	0	3	337.467	3.339	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc(C)c(F)cc1F)C2	ZINC001054150322	1349155890	/nfs/dbraw/zinc/15/58/90/1349155890.db2.gz	YBCMSKHJPOJUJP-HXUWFJFHSA-N	0	3	346.421	3.225	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H]1CCCCC1(F)F)C2	ZINC001054170445	1349172185	/nfs/dbraw/zinc/17/21/85/1349172185.db2.gz	PGFDAICRRTZGMP-WMZOPIPTSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(C)c(Cl)c1F)C2	ZINC001054171901	1349172896	/nfs/dbraw/zinc/17/28/96/1349172896.db2.gz	ZULSKGBRFJWATL-LJQANCHMSA-N	0	3	348.849	3.349	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC[C@@]3(CCN(C/C=C/Cl)C3)C2)cc1	ZINC001054174024	1349175482	/nfs/dbraw/zinc/17/54/82/1349175482.db2.gz	JKIFWRWTJBBANA-FZBXERKRSA-N	0	3	342.870	3.349	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@]2(CCN(Cc3ocnc3C)C2)C1	ZINC001054174906	1349176475	/nfs/dbraw/zinc/17/64/75/1349176475.db2.gz	CPCIMMZYISFCLT-HXUWFJFHSA-N	0	3	345.487	3.400	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cccc(Cl)c1F)C2	ZINC001054186456	1349188889	/nfs/dbraw/zinc/18/88/89/1349188889.db2.gz	SRYVFKWHDUSMHX-GOSISDBHSA-N	0	3	334.822	3.040	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@H]1CCCC(F)(F)C1)C2	ZINC001054196616	1349199354	/nfs/dbraw/zinc/19/93/54/1349199354.db2.gz	KQUSKJYPEXUGKG-FUHWJXTLSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(Cl)c(F)c1)C2	ZINC001054204032	1349205033	/nfs/dbraw/zinc/20/50/33/1349205033.db2.gz	ZGYXVXLMXQAJSG-SFHVURJKSA-N	0	3	334.822	3.040	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc(C)ccc1F)C2	ZINC001054204670	1349205810	/nfs/dbraw/zinc/20/58/10/1349205810.db2.gz	ADXTUVXNHBRREW-FQEVSTJZSA-N	0	3	328.431	3.086	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@]3(C2)CCCN(C(=O)[C@H]2CC24CC4)C3)c1	ZINC001054204390	1349206324	/nfs/dbraw/zinc/20/63/24/1349206324.db2.gz	UNHCIIJQRYNHKZ-TZIWHRDSSA-N	0	3	349.478	3.173	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1scnc1C(C)C)C2	ZINC001054210152	1349211338	/nfs/dbraw/zinc/21/13/38/1349211338.db2.gz	GUWMRDOYJKYJKF-IBGZPJMESA-N	0	3	345.512	3.218	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc(C)c(CC)o1)C2	ZINC001054226969	1349220489	/nfs/dbraw/zinc/22/04/89/1349220489.db2.gz	GLPIGYVWWKOPJJ-FQEVSTJZSA-N	0	3	328.456	3.102	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)Cc1ccc(Cl)cc1)C2	ZINC001054234265	1349226663	/nfs/dbraw/zinc/22/66/63/1349226663.db2.gz	BDYSUTWCAMDPID-FQEVSTJZSA-N	0	3	344.886	3.220	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)C[C@H](C)c1ccc(F)cc1)C2	ZINC001054243818	1349238048	/nfs/dbraw/zinc/23/80/48/1349238048.db2.gz	OPXVOEYJLOVWAH-LAUBAEHRSA-N	0	3	342.458	3.267	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3ccnc(F)c3)cc2C1	ZINC001054258741	1349255343	/nfs/dbraw/zinc/25/53/43/1349255343.db2.gz	ZYLQDYKHDGSQBO-UHFFFAOYSA-N	0	3	339.414	3.433	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cccn3CC=C)cc2C1	ZINC001054267742	1349265890	/nfs/dbraw/zinc/26/58/90/1349265890.db2.gz	FWMFQCRGQBFJSP-UHFFFAOYSA-N	0	3	335.451	3.496	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@@H]3CCO[C@H]3C(C)C)cc2C1	ZINC001054268773	1349266332	/nfs/dbraw/zinc/26/63/32/1349266332.db2.gz	XGJNDZVAGMLKSD-UXHICEINSA-N	0	3	342.483	3.256	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@@H]3CO[C@H](C)C3)cc2C1	ZINC001054271265	1349270326	/nfs/dbraw/zinc/27/03/26/1349270326.db2.gz	KBHVAHVVLWHIJE-BEFAXECRSA-N	0	3	328.456	3.010	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@H]3CCC[C@@H]3OC)cc2C1	ZINC001054271604	1349270673	/nfs/dbraw/zinc/27/06/73/1349270673.db2.gz	SISGOPZZJKCJQO-PMACEKPBSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3ccc4nonc4c3)cc2C1	ZINC001054279297	1349280134	/nfs/dbraw/zinc/28/01/34/1349280134.db2.gz	ZGTZONHVNVBUMV-UHFFFAOYSA-N	0	3	348.406	3.045	20	30		EGEDHN
C#Cc1cncc(C(=O)NCc2ccc3c(c2)CN(CC2CCC2)C3)c1	ZINC001054281074	1349282175	/nfs/dbraw/zinc/28/21/75/1349282175.db2.gz	AOLMAKIUWFRQPX-UHFFFAOYSA-N	0	3	345.446	3.109	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@@H]3C[C@]34CCOC4)cc2C1	ZINC001054288962	1349293275	/nfs/dbraw/zinc/29/32/75/1349293275.db2.gz	PLRCDPOWRIRHJK-FPOVZHCZSA-N	0	3	340.467	3.011	20	30		EGEDHN
C#Cc1ccc(C(=O)NCc2ccc3c(c2)CN(CCC(=C)C)C3)cn1	ZINC001054290189	1349294159	/nfs/dbraw/zinc/29/41/59/1349294159.db2.gz	CQGYIOLAALIIDW-UHFFFAOYSA-N	0	3	345.446	3.275	20	30		EGEDHN
C=CCN1Cc2ccc(CNC(=O)c3ccccc3CN(C)C)cc2C1	ZINC001054292637	1349298217	/nfs/dbraw/zinc/29/82/17/1349298217.db2.gz	PRGYMGPIAKVSAX-UHFFFAOYSA-N	0	3	349.478	3.180	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC(C)(C)C2CC2)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054642184	1349426265	/nfs/dbraw/zinc/42/62/65/1349426265.db2.gz	JQVNNHSKCYAJQN-DYVFJYSZSA-N	0	3	345.512	3.383	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@H](C)[C@H](NCc2cnc(C)s2)C1	ZINC001054677198	1349434415	/nfs/dbraw/zinc/43/44/15/1349434415.db2.gz	DWHKPHJSDOPEGT-IINYFYTJSA-N	0	3	341.908	3.167	20	30		EGEDHN
C[C@H]1CN(C(=O)C2(C)CCCC2)C[C@@H]1NCc1ccc(C#N)c(F)c1	ZINC001054942825	1349522936	/nfs/dbraw/zinc/52/29/36/1349522936.db2.gz	AVLHZBKMFFCSLW-KSSFIOAISA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](C)[C@H](NCc2cn(C(C)C)nc2C)C1	ZINC001054971375	1349531779	/nfs/dbraw/zinc/53/17/79/1349531779.db2.gz	POXKRBWOXUWGQN-MAUKXSAKSA-N	0	3	346.519	3.311	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)[C@@H](NCc2ccccc2OC2CC2)C1	ZINC001054976889	1349534827	/nfs/dbraw/zinc/53/48/27/1349534827.db2.gz	QLMDZJJFTYAUHC-QAPCUYQASA-N	0	3	342.483	3.377	20	30		EGEDHN
CCC1(C(=O)N2C[C@@H](C)[C@@H](NCc3ccc(C#N)c(F)c3)C2)CCC1	ZINC001054987222	1349539638	/nfs/dbraw/zinc/53/96/38/1349539638.db2.gz	VCBKIZUDXXWYNF-KDOFPFPSSA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@H]1CN(C(=O)C2CC3(CCC3)C2)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054992272	1349541957	/nfs/dbraw/zinc/54/19/57/1349541957.db2.gz	PDCNGDHEGYIPOQ-GUYCJALGSA-N	0	3	343.496	3.137	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1occc1C(C)C	ZINC001164491917	1383192500	/nfs/dbraw/zinc/19/25/00/1383192500.db2.gz	PTMBTPBSKBAEOI-UHFFFAOYSA-N	0	3	329.238	3.021	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2ncc(Cl)cc2Cl)C1	ZINC001080667698	1357719885	/nfs/dbraw/zinc/71/98/85/1357719885.db2.gz	RNFWTGBDPQAZGC-ZWNOBZJWSA-N	0	3	328.243	3.015	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)[C@@H]2CCC=CCCC2)C1	ZINC001070413262	1354340922	/nfs/dbraw/zinc/34/09/22/1354340922.db2.gz	YFLNIIUFVKLPCV-SJORKVTESA-N	0	3	342.487	3.138	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1cccc(F)c1C)C[C@H](C)O2	ZINC001071171419	1354486892	/nfs/dbraw/zinc/48/68/92/1354486892.db2.gz	MWYHBUGOMIPQRA-YWZLYKJASA-N	0	3	346.446	3.016	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)CC1CC(C)(C)C1)C[C@@H](C)O2	ZINC001071201398	1354501627	/nfs/dbraw/zinc/50/16/27/1354501627.db2.gz	DMRDOVDZAMZYSD-UZLBHIALSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1cccc(C)c1C)C[C@@H](C)O2	ZINC001071238522	1354522144	/nfs/dbraw/zinc/52/21/44/1354522144.db2.gz	NSERWCUIYWKKAF-UTKZUKDTSA-N	0	3	342.483	3.185	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1ccc(CF)cc1)C[C@@H](C)O2	ZINC001071245838	1354525747	/nfs/dbraw/zinc/52/57/47/1354525747.db2.gz	KERRGWCDXZBWQR-OXQOHEQNSA-N	0	3	346.446	3.038	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)Cc2coc3cc(F)ccc23)CC[C@@H]1C	ZINC001071498014	1354728245	/nfs/dbraw/zinc/72/82/45/1354728245.db2.gz	PVHYYQTXZSJUJX-YOEHRIQHSA-N	0	3	342.414	3.107	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cn(C(C)(C)C)nc2C)CC[C@@H]1C	ZINC001071501728	1354730802	/nfs/dbraw/zinc/73/08/02/1354730802.db2.gz	UCGFIIUXEMJEDD-GOEBONIOSA-N	0	3	332.492	3.105	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cccc(C(F)F)c2F)CC[C@@H]1C	ZINC001071513646	1354737242	/nfs/dbraw/zinc/73/72/42/1354737242.db2.gz	GYOMJMAQVWJIKF-STQMWFEESA-N	0	3	338.373	3.369	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(OC)c(OC)c2C)CC[C@H]1C	ZINC001071597419	1354785402	/nfs/dbraw/zinc/78/54/02/1354785402.db2.gz	JALJKWMEWGRUJX-GDBMZVCRSA-N	0	3	346.471	3.171	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc(C)c3ccccc3n2)CC[C@H]1C	ZINC001071612620	1354796911	/nfs/dbraw/zinc/79/69/11/1354796911.db2.gz	LBPBCBVRIIDKKX-IAGOWNOFSA-N	0	3	335.451	3.149	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@H]2CC[C@H](C)N(CCCF)C2)cc1	ZINC001071619273	1354802431	/nfs/dbraw/zinc/80/24/31/1354802431.db2.gz	MEOOJIQQXMVCCJ-RDJZCZTQSA-N	0	3	334.435	3.194	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc(C)n(C(CC)CC)n2)CC[C@H]1C	ZINC001071627278	1354811940	/nfs/dbraw/zinc/81/19/40/1354811940.db2.gz	BROHIWVUMKCARL-WBVHZDCISA-N	0	3	344.503	3.159	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc(F)cc3ccoc32)CC[C@@H]1C	ZINC001071628685	1354812474	/nfs/dbraw/zinc/81/24/74/1354812474.db2.gz	SBKHWNVBNKNHNS-XJKSGUPXSA-N	0	3	328.387	3.178	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cn2c(C)cc3ccccc32)CC[C@H]1C	ZINC001071660311	1354833048	/nfs/dbraw/zinc/83/30/48/1354833048.db2.gz	UAWCKOREXIBJHE-APWZRJJASA-N	0	3	339.483	3.495	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccncc2OC(C)C)CC[C@H]1C	ZINC001071701863	1354862186	/nfs/dbraw/zinc/86/21/86/1354862186.db2.gz	PLUUSCJIEYVNGY-CVEARBPZSA-N	0	3	331.460	3.028	20	30		EGEDHN
C=C(C)CCN1C[C@H](NC(=O)c2nc(Cl)cs2)CC[C@@H]1C	ZINC001071769416	1354915375	/nfs/dbraw/zinc/91/53/75/1354915375.db2.gz	QNABGZJWZZJRPZ-NWDGAFQWSA-N	0	3	327.881	3.345	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc(F)c(Cl)cc2F)CC[C@@H]1C	ZINC001071779844	1354928969	/nfs/dbraw/zinc/92/89/69/1354928969.db2.gz	PPFBXFVGHRLFTJ-NWDGAFQWSA-N	0	3	340.801	3.224	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)Cc2csc(C(C)(C)C)n2)CC[C@H]1C	ZINC001071899673	1355013375	/nfs/dbraw/zinc/01/33/75/1355013375.db2.gz	BXMZBXLPPVYGGF-ZIAGYGMSSA-N	0	3	335.517	3.138	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(-c3ccccc3)nc2)CC[C@@H]1C	ZINC001071928196	1355028508	/nfs/dbraw/zinc/02/85/08/1355028508.db2.gz	ZGODELGKRFUEAE-PXNSSMCTSA-N	0	3	347.462	3.355	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2cc3cccnc3s2)CC[C@H]1C	ZINC001071957209	1355041952	/nfs/dbraw/zinc/04/19/52/1355041952.db2.gz	FHXCYVLURHQZOU-UKRRQHHQSA-N	0	3	329.469	3.455	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cncc(C(F)(F)F)c2)CC[C@@H]1C	ZINC001071957526	1355043374	/nfs/dbraw/zinc/04/33/74/1355043374.db2.gz	JSFYOUMVZJSABW-WFASDCNBSA-N	0	3	341.377	3.259	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@@H](NCc3ccc(Cl)s3)C2)CCC1	ZINC001183185192	1387273544	/nfs/dbraw/zinc/27/35/44/1387273544.db2.gz	BZYGDHJDFKOMRD-CYBMUJFWSA-N	0	3	336.888	3.286	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CC[C@@H](C)N(Cc3cccc(C)c3)C2)cn1	ZINC001072002151	1355067069	/nfs/dbraw/zinc/06/70/69/1355067069.db2.gz	JEELGYCJBQYDEO-DYESRHJHSA-N	0	3	347.462	3.154	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(CC(C)C)cc2)CC[C@H]1C	ZINC001072064211	1355109241	/nfs/dbraw/zinc/10/92/41/1355109241.db2.gz	XROISAWBTGOFDL-XLIONFOSSA-N	0	3	326.484	3.491	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)Cc2ccc(OC(C)C)cc2)CC[C@H]1C	ZINC001072088473	1355121630	/nfs/dbraw/zinc/12/16/30/1355121630.db2.gz	MARCKPYWUOGFJU-SJLPKXTDSA-N	0	3	330.472	3.171	20	30		EGEDHN
C#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)c2ccccc2)CC1	ZINC001072127334	1355143447	/nfs/dbraw/zinc/14/34/47/1355143447.db2.gz	RFABIOHRFACBFA-OAQYLSRUSA-N	0	3	347.462	3.212	20	30		EGEDHN
C[C@@H]1CCN(C(=O)CC2CC2)C[C@@H]1CNCc1cc(F)ccc1C#N	ZINC001072160861	1355159502	/nfs/dbraw/zinc/15/95/02/1355159502.db2.gz	WNDDROQHPJDMIL-KDOFPFPSSA-N	0	3	343.446	3.072	20	30		EGEDHN
C/C=C(/C)C(=O)N1CC[C@H](C)[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001072240891	1355201023	/nfs/dbraw/zinc/20/10/23/1355201023.db2.gz	ONVNKNYKAJGGKP-VPFQJLQBSA-N	0	3	343.446	3.238	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@H](C)[C@H](CNCc2ccccc2C#N)C1	ZINC001072252254	1355209243	/nfs/dbraw/zinc/20/92/43/1355209243.db2.gz	RTYGPSLJLXTKDK-MAUKXSAKSA-N	0	3	343.446	3.396	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](C)[C@H](CNCc2cc(C)no2)C1	ZINC001072335328	1355244561	/nfs/dbraw/zinc/24/45/61/1355244561.db2.gz	NGNXMNSHHJNOGG-GDBMZVCRSA-N	0	3	333.476	3.160	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CN(C(=O)CC4=CCCCC4)C3)C2)cc1	ZINC001072550229	1355330598	/nfs/dbraw/zinc/33/05/98/1355330598.db2.gz	RAPWBKHFUZYMGH-UHFFFAOYSA-N	0	3	349.478	3.483	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3oc4ccc(F)cc4c3C)C2)C1	ZINC001072815368	1355449338	/nfs/dbraw/zinc/44/93/38/1355449338.db2.gz	WETGWKOWJIGLSP-UHFFFAOYSA-N	0	3	328.387	3.214	20	30		EGEDHN
CC(C)C1(C(=O)N2CC3(C2)CCN(Cc2cccc(C#N)c2)C3)CC1	ZINC001072968403	1355529070	/nfs/dbraw/zinc/52/90/70/1355529070.db2.gz	JJLHRVQTEWBFHF-UHFFFAOYSA-N	0	3	337.467	3.029	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C[C@@H](C)c3ccc(CC)cc3)C2)C1	ZINC001072976129	1355531929	/nfs/dbraw/zinc/53/19/29/1355531929.db2.gz	RJOAMEXBJYQXCZ-GOSISDBHSA-N	0	3	338.495	3.300	20	30		EGEDHN
CC[C@]1(C)C[C@@H]1C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001073091451	1355589779	/nfs/dbraw/zinc/58/97/79/1355589779.db2.gz	KEXSKLQLHSWKQN-UYAOXDASSA-N	0	3	337.467	3.029	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H](CC)Cc3ccccc3C)C2)C1	ZINC001073125578	1355610471	/nfs/dbraw/zinc/61/04/71/1355610471.db2.gz	BNGHXHATJFHDNS-IBGZPJMESA-N	0	3	338.495	3.121	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2ccc(Cl)c(C)c2)C1	ZINC001073753087	1355888698	/nfs/dbraw/zinc/88/86/98/1355888698.db2.gz	NKJADMNYSAALEP-MRXNPFEDSA-N	0	3	336.863	3.045	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2cc(CC)c(C)s2)C1	ZINC001073880794	1355937524	/nfs/dbraw/zinc/93/75/24/1355937524.db2.gz	TUBICSQUMOUNGP-INIZCTEOSA-N	0	3	336.501	3.016	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCCN1C(=O)c1cccnc1	ZINC001073930782	1355965405	/nfs/dbraw/zinc/96/54/05/1355965405.db2.gz	PJRVXRDHQWEATD-HXUWFJFHSA-N	0	3	348.450	3.080	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCCC[C@@H]1CN(C)Cc1cc2ccccc2o1	ZINC001073972837	1356005034	/nfs/dbraw/zinc/00/50/34/1356005034.db2.gz	GXXDBUBFKGGXQG-NVXWUHKLSA-N	0	3	339.439	3.405	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC[C@H](NCc2ccc(Cl)cc2Cl)[C@@H]1C	ZINC001074561527	1356209489	/nfs/dbraw/zinc/20/94/89/1356209489.db2.gz	CNIAQSYEHIGRBW-ZETOZRRWSA-N	0	3	340.254	3.232	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@H](CNCc2ccccc2C#N)[C@@H](C)C1	ZINC001075209770	1356344194	/nfs/dbraw/zinc/34/41/94/1356344194.db2.gz	QMPYPOXLBHPDFR-FUHWJXTLSA-N	0	3	325.456	3.099	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cccc4ccc(C)nc43)[C@@H]2C1	ZINC001075927341	1356446296	/nfs/dbraw/zinc/44/62/96/1356446296.db2.gz	UTSQCEOVGSPKSM-PKOBYXMFSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)[C@H](C)Cc3ccccc3Cl)[C@@H]2C1	ZINC001076309531	1356544383	/nfs/dbraw/zinc/54/43/83/1356544383.db2.gz	WFHCWPHSOOSQLP-UWWQBHOKSA-N	0	3	332.875	3.237	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@H](CC)Oc3cccc(C)c3)[C@@H]2C1	ZINC001076350797	1356556013	/nfs/dbraw/zinc/55/60/13/1356556013.db2.gz	KDBDUAZKKPWIFR-SXLOBPIMSA-N	0	3	342.483	3.261	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cc(F)c(F)cc3Cl)[C@@H]2C1	ZINC001076525555	1356603713	/nfs/dbraw/zinc/60/37/13/1356603713.db2.gz	ODIALYQCDVWCCV-MEDUHNTESA-N	0	3	340.801	3.341	20	30		EGEDHN
C=CCCN1C[C@@H]2CCN(C(=O)c3sc(CCC)nc3C)[C@@H]2C1	ZINC001076566811	1356619509	/nfs/dbraw/zinc/61/95/09/1356619509.db2.gz	VJFRVKZQDXZBFN-LSDHHAIUSA-N	0	3	333.501	3.126	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)C[C@@H]2CCc3ccccc3C2)C1	ZINC001080844531	1357751055	/nfs/dbraw/zinc/75/10/55/1357751055.db2.gz	GWEMQHWQXHSTBC-MBOZVWFJSA-N	0	3	326.484	3.194	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C=C2CCC2)C12CCC2	ZINC001078593894	1357027091	/nfs/dbraw/zinc/02/70/91/1357027091.db2.gz	KMZKGUVRMDYAOT-KBPBESRZSA-N	0	3	339.277	3.022	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2cnn(C3CCCCC3)c2)C1	ZINC001080733309	1357729917	/nfs/dbraw/zinc/72/99/17/1357729917.db2.gz	MFXVXGFXBQCOMA-CRAIPNDOSA-N	0	3	330.476	3.015	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cncc(Cl)c2)C12CCC2	ZINC001078746168	1357070477	/nfs/dbraw/zinc/07/04/77/1357070477.db2.gz	ILBUEINAHNFPPH-KBPBESRZSA-N	0	3	340.254	3.118	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2csc3c2CC[C@@H](C)C3)C1	ZINC001080887798	1357759126	/nfs/dbraw/zinc/75/91/26/1357759126.db2.gz	PRQBBQSGILVDDA-CKEIUWERSA-N	0	3	332.513	3.499	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)CCc2cccc(C)c2)C[C@H]1c1ccccc1	ZINC001081153905	1357845538	/nfs/dbraw/zinc/84/55/38/1357845538.db2.gz	KMLMTKFOQLBMFC-FCHUYYIVSA-N	0	3	346.474	3.145	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2coc3ccc(Cl)cc23)[C@H](OC)C1	ZINC001082348150	1358020592	/nfs/dbraw/zinc/02/05/92/1358020592.db2.gz	MJSSMBULEKCKTH-NVXWUHKLSA-N	0	3	348.830	3.091	20	30		EGEDHN
CC[C@H](C)N[C@H](CNC(=O)c1ccc(C#N)cc1F)c1ccco1	ZINC001183433583	1387308220	/nfs/dbraw/zinc/30/82/20/1387308220.db2.gz	URHXQICRRXMNKB-BLLLJJGKSA-N	0	3	329.375	3.150	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2C(C)(C)C)C[C@H]1NCc1ccc(C#N)s1	ZINC001082638091	1358068373	/nfs/dbraw/zinc/06/83/73/1358068373.db2.gz	VICDNXFPSVFLDM-BASLNEPJSA-N	0	3	345.512	3.238	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)[C@@H](C)c3ccc(C)s3)[C@H]2C1	ZINC001083247609	1358125732	/nfs/dbraw/zinc/12/57/32/1358125732.db2.gz	XOCQAELGPOTTRH-YESZJQIVSA-N	0	3	348.512	3.038	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)c3cc(C)c(C)cc3Cl)[C@@H]2C1	ZINC001084574677	1358241750	/nfs/dbraw/zinc/24/17/50/1358241750.db2.gz	HXSBCKUPULEABG-CRAIPNDOSA-N	0	3	330.859	3.126	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3ccc(C(F)F)cc3F)[C@@H]2C1	ZINC001084740994	1358297384	/nfs/dbraw/zinc/29/73/84/1358297384.db2.gz	JIGMBJRMACPPPZ-CZUORRHYSA-N	0	3	338.373	3.486	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)CCc3ccc(Cl)s3)[C@@H]2C1	ZINC001084828090	1358323213	/nfs/dbraw/zinc/32/32/13/1358323213.db2.gz	LZJULWAXHVYMOE-UKRRQHHQSA-N	0	3	338.904	3.443	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)C[C@H](C)c3ccc(F)cc3)[C@@H]2C1	ZINC001084846682	1358327205	/nfs/dbraw/zinc/32/72/05/1358327205.db2.gz	UZQZCPLXLQUIRD-KVSKMBFKSA-N	0	3	330.447	3.428	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H]2CCN(Cc3cncc(C)c3)[C@H]2C1	ZINC001085024109	1358371018	/nfs/dbraw/zinc/37/10/18/1358371018.db2.gz	VHXRQZDLMADCKF-DYXWJJEUSA-N	0	3	341.499	3.415	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@H](C)Cc3ccc(F)cc3)C[C@@H]21	ZINC001085105353	1358393630	/nfs/dbraw/zinc/39/36/30/1358393630.db2.gz	YXWHFLBRNJQGCF-WDYCEAGBSA-N	0	3	330.447	3.113	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccsc1	ZINC001085127326	1358403528	/nfs/dbraw/zinc/40/35/28/1358403528.db2.gz	XSKWUVYSUVZCME-CHWSQXEVSA-N	0	3	343.290	3.287	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccnn1[C@@H](C)CC	ZINC001085214840	1358435824	/nfs/dbraw/zinc/43/58/24/1358435824.db2.gz	SYUIMEHDHCGIBW-RRFJBIMHSA-N	0	3	338.883	3.237	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cnc2ccccc2n1	ZINC001085226321	1358437953	/nfs/dbraw/zinc/43/79/53/1358437953.db2.gz	PZMHRCPIJHTZHJ-GDBMZVCRSA-N	0	3	344.846	3.013	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cc(F)c(F)c(F)c1	ZINC001085341461	1358471539	/nfs/dbraw/zinc/47/15/39/1358471539.db2.gz	VLJRSYOAHJCYNP-ZIAGYGMSSA-N	0	3	346.780	3.487	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccc(OC)c(C)c1	ZINC001085363867	1358479529	/nfs/dbraw/zinc/47/95/29/1358479529.db2.gz	ANBDQJSWJZFOGB-HZPDHXFCSA-N	0	3	336.863	3.387	20	30		EGEDHN
C=CCOc1ccc(C(=O)N(C)C[C@@H]2CCN2CCC(=C)C)cc1	ZINC001085678978	1358683112	/nfs/dbraw/zinc/68/31/12/1358683112.db2.gz	XDFUQWIXSYSDTD-SFHVURJKSA-N	0	3	328.456	3.364	20	30		EGEDHN
C=C1CCC(C(=O)N(C)C[C@H]2CCN2C[C@H](OC)C2CCC2)CC1	ZINC001085801614	1358777571	/nfs/dbraw/zinc/77/75/71/1358777571.db2.gz	XRJDICGZCSRPPK-MOPGFXCFSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc(F)c(COC)c1	ZINC001085806031	1358782758	/nfs/dbraw/zinc/78/27/58/1358782758.db2.gz	WTSOLSARVNXKPP-QGZVFWFLSA-N	0	3	334.435	3.085	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1c[nH]nc1-c1ccsc1	ZINC001085897234	1358856993	/nfs/dbraw/zinc/85/69/93/1358856993.db2.gz	ZBBGPBXIAQGAPT-HNNXBMFYSA-N	0	3	344.484	3.251	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cccc(-c2cnco2)c1	ZINC001085904163	1358861818	/nfs/dbraw/zinc/86/18/18/1358861818.db2.gz	YIQYEIMKQPDFPG-GOSISDBHSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc2ncsc2c1	ZINC001085958221	1358916012	/nfs/dbraw/zinc/91/60/12/1358916012.db2.gz	VVHYGBVHJTUUOA-OAHLLOKOSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1ccc(OCC(C)C)cc1	ZINC001085959495	1358916932	/nfs/dbraw/zinc/91/69/32/1358916932.db2.gz	DDKXOOLCBYWJAM-SFHVURJKSA-N	0	3	330.472	3.444	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc(OCC)c(OC)c1	ZINC001085966093	1358922582	/nfs/dbraw/zinc/92/25/82/1358922582.db2.gz	ANWWUVFLEICPBE-QGZVFWFLSA-N	0	3	346.471	3.206	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc(N(CC)CC)nc1	ZINC001085996081	1358951456	/nfs/dbraw/zinc/95/14/56/1358951456.db2.gz	CXKWJSBATWPHCD-SFHVURJKSA-N	0	3	344.503	3.040	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)[C@@H]2CCC[C@H](C)C2)C1	ZINC001086182896	1359019045	/nfs/dbraw/zinc/01/90/45/1359019045.db2.gz	MSTFKFBRQCYLDE-SPWCGHHHSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2C[C@@H](NCc3cccc(Cl)n3)C2)CC1	ZINC001086187341	1359020543	/nfs/dbraw/zinc/02/05/43/1359020543.db2.gz	QBQUJMXWJHYMPT-KDYLLFBJSA-N	0	3	347.890	3.466	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2c(C)cccc2Cl)C1	ZINC001086187752	1359020819	/nfs/dbraw/zinc/02/08/19/1359020819.db2.gz	OBBMFCSKDFNBHL-BETUJISGSA-N	0	3	327.255	3.499	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cnn([C@@H](C)CC)c2C)C1	ZINC001086250296	1359042130	/nfs/dbraw/zinc/04/21/30/1359042130.db2.gz	MIZUSOMJFLTBEJ-AEGPPILISA-N	0	3	338.883	3.013	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@@H]2CCCc3ccccc32)C1	ZINC001086400291	1359087260	/nfs/dbraw/zinc/08/72/60/1359087260.db2.gz	AYDHOFUFMAWNTA-QGPMSJSTSA-N	0	3	332.875	3.343	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2nccc3ccccc32)C1	ZINC001086461368	1359104753	/nfs/dbraw/zinc/10/47/53/1359104753.db2.gz	MVMRWBXLRVMRQL-CTYIDZIISA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc3cc(OC)ccc3[nH]2)C1	ZINC001086465175	1359107474	/nfs/dbraw/zinc/10/74/74/1359107474.db2.gz	UNOMACBWESPMNU-MQMHXKEQSA-N	0	3	347.846	3.027	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(N(CC)CC)cc2)C1	ZINC001086540961	1359138189	/nfs/dbraw/zinc/13/81/89/1359138189.db2.gz	HNSJMUSNPHLXMF-JCNLHEQBSA-N	0	3	349.906	3.383	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2coc3ccc(F)cc23)C1	ZINC001086542030	1359138704	/nfs/dbraw/zinc/13/87/04/1359138704.db2.gz	JJEFLQXWYWLNKG-AULYBMBSSA-N	0	3	336.794	3.422	20	30		EGEDHN
C=CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2conc2CC)C1	ZINC001086608590	1359163695	/nfs/dbraw/zinc/16/36/95/1359163695.db2.gz	PRSBVLGZVYWTBB-QFBILLFUSA-N	0	3	339.439	3.011	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccc3c(c2)C[C@@H](C)O3)C1	ZINC001086829684	1359209598	/nfs/dbraw/zinc/20/95/98/1359209598.db2.gz	LBYMMQMBJAANHU-JKIFEVAISA-N	0	3	348.874	3.251	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2nc(C)c(C)s2)C1	ZINC001086879669	1359219476	/nfs/dbraw/zinc/21/94/76/1359219476.db2.gz	URWMZPZIIHZEMN-QWHCGFSZSA-N	0	3	327.881	3.001	20	30		EGEDHN
C[C@@H](C(=O)NCC1(NCc2cccc(C#N)c2)CC1)c1cccs1	ZINC001323542685	1387384627	/nfs/dbraw/zinc/38/46/27/1387384627.db2.gz	RFNUMTAQWCRHSF-CQSZACIVSA-N	0	3	339.464	3.162	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)C[C@@H]3C=CCCC3)C2)CC1	ZINC001086929040	1359253552	/nfs/dbraw/zinc/25/35/52/1359253552.db2.gz	VDLPLKCZJHQZPQ-RTBURBONSA-N	0	3	328.500	3.459	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc(CC)o3)C2)CC1	ZINC001086929263	1359253676	/nfs/dbraw/zinc/25/36/76/1359253676.db2.gz	BMDNZAKEQTVMAY-MRXNPFEDSA-N	0	3	328.456	3.182	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3occ4c3CCC4)C2)CC1	ZINC001086934761	1359258235	/nfs/dbraw/zinc/25/82/35/1359258235.db2.gz	ZJTTXNPSHKMGFH-MRXNPFEDSA-N	0	3	340.467	3.108	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cc[nH]c3C3CCC3)C2)CC1	ZINC001086942746	1359264217	/nfs/dbraw/zinc/26/42/17/1359264217.db2.gz	ZYILWQRWTMKVSI-INIZCTEOSA-N	0	3	339.483	3.232	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccccc3Cl)C2)CC1	ZINC001086953335	1359273504	/nfs/dbraw/zinc/27/35/04/1359273504.db2.gz	FVGVDODMNCAYSZ-OAHLLOKOSA-N	0	3	330.859	3.290	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)C[C@@H](C)n3cccc3)C2)CC1	ZINC001086953475	1359273769	/nfs/dbraw/zinc/27/37/69/1359273769.db2.gz	JLBULUQOGDWWFY-RTBURBONSA-N	0	3	341.499	3.166	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc(F)cc3F)C2)CC1	ZINC001086955031	1359275482	/nfs/dbraw/zinc/27/54/82/1359275482.db2.gz	BCAQZUVQJUVAON-HNNXBMFYSA-N	0	3	346.421	3.305	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)Cc3ccc(Cl)cc3)C2)CC1	ZINC001086955755	1359276528	/nfs/dbraw/zinc/27/65/28/1359276528.db2.gz	VPPKZPNQZCECGN-INIZCTEOSA-N	0	3	344.886	3.219	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@H]3CC4CCC3CC4)C2)CC1	ZINC001086958512	1359279204	/nfs/dbraw/zinc/27/92/04/1359279204.db2.gz	SXSCZABIBVLYPZ-UGXKVIGPSA-N	0	3	328.500	3.149	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc(F)s3)C2)CC1	ZINC001086958567	1359279854	/nfs/dbraw/zinc/27/98/54/1359279854.db2.gz	UYXDPSBQAHFDQH-AWEZNQCLSA-N	0	3	334.460	3.227	20	30		EGEDHN
CC[C@H](C)C(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC001087123562	1359297281	/nfs/dbraw/zinc/29/72/81/1359297281.db2.gz	RFMUHGWDLSPJHR-VKJFTORMSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC[C@H](C)C(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccc(C#N)cc1F	ZINC001087123664	1359297289	/nfs/dbraw/zinc/29/72/89/1359297289.db2.gz	UYYCHCQDTFLXRM-VKJFTORMSA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@@H]1CCN(C(=O)C#CC2CC2)[C@H](CNCc2cc(F)cc(F)c2)C1	ZINC001087163993	1359311463	/nfs/dbraw/zinc/31/14/63/1359311463.db2.gz	BASLBZKWMRDIOZ-KUHUBIRLSA-N	0	3	346.421	3.095	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(F)ccc3F)C(C)(C)[C@@H]21	ZINC001087289762	1359368927	/nfs/dbraw/zinc/36/89/27/1359368927.db2.gz	RQBLFEJFRIDIJL-ZTFGCOKTSA-N	0	3	346.421	3.207	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cscc3Cl)C(C)(C)[C@@H]21	ZINC001087291466	1359371018	/nfs/dbraw/zinc/37/10/18/1359371018.db2.gz	VFCQRQGVRUIMTB-KCPJHIHWSA-N	0	3	336.888	3.254	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc2ccc(C)cc2[nH]1	ZINC001087296621	1359377979	/nfs/dbraw/zinc/37/79/79/1359377979.db2.gz	CLJJRFFEPSJHQK-LSTHTHJFSA-N	0	3	349.478	3.328	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc2[nH]ccc2c1	ZINC001087300092	1359382564	/nfs/dbraw/zinc/38/25/64/1359382564.db2.gz	GSJYRNRSRDJBRI-NZSAHSFTSA-N	0	3	335.451	3.020	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3occc3Cl)C(C)(C)[C@H]21	ZINC001087303321	1359385572	/nfs/dbraw/zinc/38/55/72/1359385572.db2.gz	JWFQVJXCHIZVML-KCXAZCMYSA-N	0	3	334.847	3.175	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3cccc4cc[nH]c43)C(C)(C)[C@H]21	ZINC001087304396	1359388296	/nfs/dbraw/zinc/38/82/96/1359388296.db2.gz	BLKCJOLKJGXJMP-HOJAQTOUSA-N	0	3	349.478	3.410	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccccc3Cl)C(C)(C)[C@H]21	ZINC001087314424	1359403273	/nfs/dbraw/zinc/40/32/73/1359403273.db2.gz	KVVJVCQGSKHNDF-OIISXLGYSA-N	0	3	330.859	3.192	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)[C@H]1CC[C@H](CC)CC1	ZINC001087314592	1359404230	/nfs/dbraw/zinc/40/42/30/1359404230.db2.gz	NRQDVVUNOGKIFI-IEWDOMPSSA-N	0	3	330.516	3.441	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)Cc3ccccc3Cl)C(C)(C)[C@@H]21	ZINC001087315773	1359406152	/nfs/dbraw/zinc/40/61/52/1359406152.db2.gz	HWSKDDPVXSPKFV-ATZDWAIDSA-N	0	3	344.886	3.121	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc(F)cc(F)c3)C(C)(C)[C@H]21	ZINC001087316048	1359406459	/nfs/dbraw/zinc/40/64/59/1359406459.db2.gz	MAQKIDYYJGQFJA-SQNIBIBYSA-N	0	3	346.421	3.207	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1nc(C)c(C)s1	ZINC001087317600	1359409143	/nfs/dbraw/zinc/40/91/43/1359409143.db2.gz	KMGFIFBRCZUIMX-OWCLPIDISA-N	0	3	345.512	3.002	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)C34CC(C(C)(C)C)(C3)C4)C(C)(C)[C@H]21	ZINC001087318746	1359410610	/nfs/dbraw/zinc/41/06/10/1359410610.db2.gz	CBQHIWQFIQRGIM-CTHIEXCLSA-N	0	3	342.527	3.441	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3c[nH]c4ccc(C)cc34)C(C)(C)[C@@H]21	ZINC001087319842	1359412411	/nfs/dbraw/zinc/41/24/11/1359412411.db2.gz	VGXAOEVZQGVJPC-CDHQVMDDSA-N	0	3	349.478	3.328	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)[C@@H]2CC2(C)C)CCN1Cc1ccc(C#N)cc1	ZINC001087545535	1359525925	/nfs/dbraw/zinc/52/59/25/1359525925.db2.gz	OWSADWYARNWSAP-OKZBNKHCSA-N	0	3	325.456	3.073	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cnn(C(C)(C)C)c2C)[C@H]1CC	ZINC001087592902	1359547063	/nfs/dbraw/zinc/54/70/63/1359547063.db2.gz	DIZLZZDHRIVHLH-DLBZAZTESA-N	0	3	332.492	3.105	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)[C@@H]2CC=CC[C@H]2C(F)(F)F)[C@H]1CC	ZINC001087624753	1359560968	/nfs/dbraw/zinc/56/09/68/1359560968.db2.gz	XDNKETAUOYTQJA-APIJFGDWSA-N	0	3	330.394	3.286	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc(-c3cnco3)cc2)[C@H]1CC	ZINC001087626299	1359562225	/nfs/dbraw/zinc/56/22/25/1359562225.db2.gz	TWOVGUFPUIODIB-DLBZAZTESA-N	0	3	325.412	3.110	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](NC(=O)c2n[nH]c3ccc(C)cc32)[C@H]1CC	ZINC001087639843	1359566277	/nfs/dbraw/zinc/56/62/77/1359566277.db2.gz	VHHYTGWXPXBLSZ-JKSUJKDBSA-N	0	3	346.862	3.207	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2n[nH]c(C3CC3)c2Cl)[C@H]1CC	ZINC001087640948	1359566956	/nfs/dbraw/zinc/56/69/56/1359566956.db2.gz	HFHVCQSPMIAVLY-QWHCGFSZSA-N	0	3	336.867	3.099	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2ccc(-c3ccco3)o2)[C@H]1CC	ZINC001087652815	1359572330	/nfs/dbraw/zinc/57/23/30/1359572330.db2.gz	NWXSCTZJFFJVRK-LSDHHAIUSA-N	0	3	326.396	3.146	20	30		EGEDHN
C=CCCN1CC[C@H](NC(=O)c2scnc2C(F)F)[C@H]1CC	ZINC001087654332	1359574738	/nfs/dbraw/zinc/57/47/38/1359574738.db2.gz	WXJYOTPMCUXQOU-WDEREUQCSA-N	0	3	329.416	3.240	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc(F)c(Cl)c2F)[C@H]1CC	ZINC001087713089	1359604755	/nfs/dbraw/zinc/60/47/55/1359604755.db2.gz	RINDZYQLUVQUDU-QWHCGFSZSA-N	0	3	328.790	3.387	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(CCc3ccns3)[C@@H]2CC)C1	ZINC001087718259	1359609852	/nfs/dbraw/zinc/60/98/52/1359609852.db2.gz	DOUSKPFRRKQRIO-JKSUJKDBSA-N	0	3	333.501	3.011	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2cc(C)oc2C(F)(F)F)[C@H]1CC	ZINC001087743870	1359624778	/nfs/dbraw/zinc/62/47/78/1359624778.db2.gz	PARANQUZNZGIEQ-UONOGXRCSA-N	0	3	342.361	3.213	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)[C@@H]2C[C@H]2C2CC2)CCN1Cc1ccc(C#N)cc1	ZINC001087756379	1359629871	/nfs/dbraw/zinc/62/98/71/1359629871.db2.gz	NWTJUSHCENZXEU-ZGXWSNOMSA-N	0	3	337.467	3.073	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)CC(C3CCC3)C3CCC3)C[C@@H]2C1	ZINC001088109324	1359759163	/nfs/dbraw/zinc/75/91/63/1359759163.db2.gz	YALOBSMOIGMGFI-MOPGFXCFSA-N	0	3	328.500	3.006	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3ccc(-c4ccccc4)o3)C[C@@H]2C1	ZINC001088116357	1359760748	/nfs/dbraw/zinc/76/07/48/1359760748.db2.gz	UWUQQFNQSZUOSZ-MOPGFXCFSA-N	0	3	348.446	3.364	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)CC34CC5CC(CC(C5)C3)C4)C[C@@H]2C1	ZINC001088180697	1359783997	/nfs/dbraw/zinc/78/39/97/1359783997.db2.gz	WHKNYGRSVGLLRC-CHAHAOGTSA-N	0	3	340.511	3.006	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3oc4ccccc4c3C)C[C@@H]2C1	ZINC001088191843	1359789427	/nfs/dbraw/zinc/78/94/27/1359789427.db2.gz	VSABYPODQGRGCS-SJORKVTESA-N	0	3	336.435	3.158	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)CC(C)(C)c3ccccc3)C[C@@H]2C1	ZINC001088212183	1359797869	/nfs/dbraw/zinc/79/78/69/1359797869.db2.gz	UOCFHQPOTDAKKR-MOPGFXCFSA-N	0	3	338.495	3.158	20	30		EGEDHN
C=CCN1CC[C@H](OCC2CCN(C(=O)CC3=CCCCC3)CC2)C1	ZINC001088230668	1359808858	/nfs/dbraw/zinc/80/88/58/1359808858.db2.gz	WPFCRJQOLXNQAP-FQEVSTJZSA-N	0	3	346.515	3.392	20	30		EGEDHN
C=CCN1CC[C@@H](OCC2CCN(C(=O)C3CCCCCC3)CC2)C1	ZINC001088230741	1359808866	/nfs/dbraw/zinc/80/88/66/1359808866.db2.gz	YIFSXZAYOBXLMK-HXUWFJFHSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)CCc2cncc(C)c2)C1	ZINC001088345818	1359833032	/nfs/dbraw/zinc/83/30/32/1359833032.db2.gz	YSESEHFNFOXGAD-SFHVURJKSA-N	0	3	349.906	3.436	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)CCc2ccccn2)C1	ZINC001088359157	1359842114	/nfs/dbraw/zinc/84/21/14/1359842114.db2.gz	SMBYDNOHUDCNLA-KRWDZBQOSA-N	0	3	335.879	3.128	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)CC2CC(OCC)C2)C1	ZINC001088367328	1359851568	/nfs/dbraw/zinc/85/15/68/1359851568.db2.gz	HOAMGEWXOGSREJ-CGZBRXJRSA-N	0	3	342.911	3.305	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCCCC[C@@H](NCc2cnc(C)nc2)C1	ZINC001088374496	1359856148	/nfs/dbraw/zinc/85/61/48/1359856148.db2.gz	IRFDHDLTPSIFGE-UYAOXDASSA-N	0	3	344.503	3.248	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCCCC[C@H](NCc3cnc(C)nc3)C2)C1	ZINC001088378186	1359861834	/nfs/dbraw/zinc/86/18/34/1359861834.db2.gz	BJUCHOXXCXNUCV-SFHVURJKSA-N	0	3	342.487	3.002	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2ccc3cccnn32)C1	ZINC001088395058	1359870979	/nfs/dbraw/zinc/87/09/79/1359870979.db2.gz	WKIHZEVUUBGSTA-OAHLLOKOSA-N	0	3	346.862	3.061	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cc(C)nn2C(CC)CC)[C@H]1C	ZINC001088688978	1360013275	/nfs/dbraw/zinc/01/32/75/1360013275.db2.gz	BZNSERVOZRNEJA-WBVHZDCISA-N	0	3	332.492	3.321	20	30		EGEDHN
CC/C(C)=C/C(=O)N1CC[C@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001184328046	1387430916	/nfs/dbraw/zinc/43/09/16/1387430916.db2.gz	KXQITFOKKPYVTF-KMXARQBDSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCN(CCc3scnc3C)[C@@H]2C)CC1	ZINC001088838313	1360072424	/nfs/dbraw/zinc/07/24/24/1360072424.db2.gz	CILUOHFPUTXLEI-WBVHZDCISA-N	0	3	347.528	3.319	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccnc(O[C@@H](C)CC)c2)[C@H]1C	ZINC001088967478	1360119009	/nfs/dbraw/zinc/11/90/09/1360119009.db2.gz	JUPVFNZPFDZRGJ-UXLLHSPISA-N	0	3	331.460	3.028	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCCN1C(=O)C(C)(F)F	ZINC001089101619	1360167932	/nfs/dbraw/zinc/16/79/32/1360167932.db2.gz	CGDMKCVTGQSXAV-INIZCTEOSA-N	0	3	335.398	3.026	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CCCC[C@H]1CN(C)Cc1ccc(C#N)cc1	ZINC001089210665	1360256579	/nfs/dbraw/zinc/25/65/79/1360256579.db2.gz	ZUBNWYLRRBJKHF-ZWKOTPCHSA-N	0	3	331.435	3.119	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccccc2OCC=C)CC(C)(C)C1	ZINC001089424408	1360418140	/nfs/dbraw/zinc/41/81/40/1360418140.db2.gz	UITSWLAEPBCMQJ-KRWDZBQOSA-N	0	3	340.467	3.105	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cccc(Cl)c2F)CC(C)(C)C1	ZINC001089476852	1360459744	/nfs/dbraw/zinc/45/97/44/1360459744.db2.gz	RTWJIRZTQLXZCB-CYBMUJFWSA-N	0	3	336.838	3.333	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc([C@@H](C)CC)no2)CC(C)(C)C1	ZINC001089509400	1360480635	/nfs/dbraw/zinc/48/06/35/1360480635.db2.gz	BOXOQVUPUKUAPE-HOTGVXAUSA-N	0	3	345.487	3.432	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@H](C)c2cc(C)oc2C)CC(C)(C)C1	ZINC001089519938	1360487880	/nfs/dbraw/zinc/48/78/80/1360487880.db2.gz	PODDWKYXRKRFBD-WBVHZDCISA-N	0	3	330.472	3.240	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc3ccn(C)c3c2)CC(C)(C)C1	ZINC001089535855	1360495313	/nfs/dbraw/zinc/49/53/13/1360495313.db2.gz	VPNGXEZHERIUFT-SFHVURJKSA-N	0	3	337.467	3.032	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ncsc2C(C)C)CC(C)(C)C1	ZINC001089541330	1360497880	/nfs/dbraw/zinc/49/78/80/1360497880.db2.gz	IRPFBZKISLUZJT-CQSZACIVSA-N	0	3	333.501	3.120	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(C[C@@H](F)CC)CC(C)(C)C2)nc1	ZINC001089544003	1360499292	/nfs/dbraw/zinc/49/92/92/1360499292.db2.gz	LALOBDYBIIJSSG-IRXDYDNUSA-N	0	3	345.462	3.031	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(C[C@@H](F)CC)CC(C)(C)C2)cn1	ZINC001089544503	1360499986	/nfs/dbraw/zinc/49/99/86/1360499986.db2.gz	UHGDQHGTRIJVQP-FUHWJXTLSA-N	0	3	345.462	3.031	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C2CCC(C(F)F)CC2)CC(C)(C)C1	ZINC001089548093	1360502329	/nfs/dbraw/zinc/50/23/29/1360502329.db2.gz	GSEXJGCUHNRDGC-UYSNPLJNSA-N	0	3	340.458	3.298	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc(C3CCCC3)no2)CC(C)(C)C1	ZINC001089554674	1360505995	/nfs/dbraw/zinc/50/59/95/1360505995.db2.gz	YFMMQMWDRLGEKA-MRXNPFEDSA-N	0	3	343.471	3.186	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@@H](C)c2cccc(F)c2)CC(C)(C)C1	ZINC001089560259	1360508442	/nfs/dbraw/zinc/50/84/42/1360508442.db2.gz	AJAVUZVCYZVUJX-YJBOKZPZSA-N	0	3	330.447	3.169	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H]1CCCc2c[nH]nc21	ZINC001089641628	1360554764	/nfs/dbraw/zinc/55/47/64/1360554764.db2.gz	PIXWROWMMNOUET-IAGOWNOFSA-N	0	3	344.503	3.013	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1ccncc1	ZINC001089642922	1360556371	/nfs/dbraw/zinc/55/63/71/1360556371.db2.gz	PZXDWVOLGQGCAF-CEXWTWQISA-N	0	3	341.499	3.368	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(C)nc(C)c1	ZINC001089648659	1360562012	/nfs/dbraw/zinc/56/20/12/1360562012.db2.gz	OUQZIGAFPWXJPU-GOSISDBHSA-N	0	3	329.488	3.495	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1c(C)[nH]nc1Cl	ZINC001089649491	1360562722	/nfs/dbraw/zinc/56/27/22/1360562722.db2.gz	KFTZMAGPHAHKII-ZDUSSCGKSA-N	0	3	338.883	3.168	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cnc2[nH]ccc2c1	ZINC001089653039	1360566066	/nfs/dbraw/zinc/56/60/66/1360566066.db2.gz	NLMXZNFBGLOHCG-KRWDZBQOSA-N	0	3	340.471	3.311	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cnc2n1CCCC2	ZINC001089686165	1360591683	/nfs/dbraw/zinc/59/16/83/1360591683.db2.gz	NRJDAVNWQLWLNR-INIZCTEOSA-N	0	3	344.503	3.016	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1occc1CN(C)C	ZINC001089687076	1360592765	/nfs/dbraw/zinc/59/27/65/1360592765.db2.gz	DWLFVHWNHPWCSD-QGZVFWFLSA-N	0	3	347.503	3.138	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc2[nH]ccc2c1	ZINC001089687239	1360593717	/nfs/dbraw/zinc/59/37/17/1360593717.db2.gz	GBHXUJSOTQMCBV-SFHVURJKSA-N	0	3	337.467	3.412	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)C1Cc2ccccc2C1	ZINC001089699389	1360602841	/nfs/dbraw/zinc/60/28/41/1360602841.db2.gz	LEOZCOYAVXONIQ-LJQANCHMSA-N	0	3	326.484	3.194	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc2ccccn2c1	ZINC001089705487	1360608164	/nfs/dbraw/zinc/60/81/64/1360608164.db2.gz	GFCXIQPYUCYRCU-GOSISDBHSA-N	0	3	325.456	3.346	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(OC)c(C)c1	ZINC001089709804	1360613773	/nfs/dbraw/zinc/61/37/73/1360613773.db2.gz	YUZKPAWWIZHAJR-KRWDZBQOSA-N	0	3	330.472	3.410	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1c[nH]nc1C1CC1	ZINC001089717499	1360619052	/nfs/dbraw/zinc/61/90/52/1360619052.db2.gz	AWDZMVNUZWTOKA-OAHLLOKOSA-N	0	3	330.476	3.084	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc2c([nH]1)CCC2	ZINC001089722302	1360624780	/nfs/dbraw/zinc/62/47/80/1360624780.db2.gz	VZPOCTFRVHFXDI-MRXNPFEDSA-N	0	3	329.488	3.300	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc2c(s1)CCC2	ZINC001089730132	1360633294	/nfs/dbraw/zinc/63/32/94/1360633294.db2.gz	WRSBINSIQMYWGG-INIZCTEOSA-N	0	3	344.524	3.481	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1CCCCC1	ZINC001089761005	1360653250	/nfs/dbraw/zinc/65/32/50/1360653250.db2.gz	QHBCOGLQACUDSN-MLHJIOFPSA-N	0	3	336.907	3.488	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C(F)=C(C)C	ZINC001089789841	1360664525	/nfs/dbraw/zinc/66/45/25/1360664525.db2.gz	OSWXMPYAHKPYAY-XGUBFFRZSA-N	0	3	326.843	3.171	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)c2oc(C)cc2C)C1	ZINC001089791399	1360664756	/nfs/dbraw/zinc/66/47/56/1360664756.db2.gz	GKSURTLSMHHAPI-QAETUUGQSA-N	0	3	348.874	3.431	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)Cc1ccc(C)o1	ZINC001089797107	1360667838	/nfs/dbraw/zinc/66/78/38/1360667838.db2.gz	JVWUGLIFBRGSFG-HPBDAGMYSA-N	0	3	348.874	3.052	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)c2cc[nH]c2CC)C1	ZINC001089809731	1360672989	/nfs/dbraw/zinc/67/29/89/1360672989.db2.gz	TUAYVPCHBWVDHQ-MBGYTDRXSA-N	0	3	347.890	3.112	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1(C)CCCC1	ZINC001089848690	1360696064	/nfs/dbraw/zinc/69/60/64/1360696064.db2.gz	YLZOHAUGZXBAPX-NXOAAHMSSA-N	0	3	336.907	3.488	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](CNCc2ccccc2C#N)[C@@H](C)C1	ZINC001184496394	1387471832	/nfs/dbraw/zinc/47/18/32/1387471832.db2.gz	CBNYMHUZSDNGIT-HKUYNNGSSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C=C2CCCCC2)CC2(CCOCC2)C1	ZINC001089926705	1360748958	/nfs/dbraw/zinc/74/89/58/1360748958.db2.gz	MFFOZNVQAUUVMF-LJQANCHMSA-N	0	3	346.515	3.440	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)C(C)=C2CCCC2)CC2(CCOCC2)C1	ZINC001089936008	1360752455	/nfs/dbraw/zinc/75/24/55/1360752455.db2.gz	IMVPHAYNHUODSE-GOSISDBHSA-N	0	3	332.488	3.050	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NCC1CC(NCC(=C)Cl)C1	ZINC001091104106	1360993000	/nfs/dbraw/zinc/99/30/00/1360993000.db2.gz	QIXPZQQYOJEZJN-UHFFFAOYSA-N	0	3	334.847	3.102	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc(F)cc3ccoc32)C1	ZINC001091108080	1360993216	/nfs/dbraw/zinc/99/32/16/1360993216.db2.gz	SFOPURSYHFFMCE-UHFFFAOYSA-N	0	3	336.794	3.422	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(C3CC3)nc2C)C1	ZINC001091239284	1361017671	/nfs/dbraw/zinc/01/76/71/1361017671.db2.gz	RJFWQVWOXKCJNC-UHFFFAOYSA-N	0	3	333.863	3.118	20	30		EGEDHN
C[C@@]12CN(Cc3ccc(C#N)cc3)C[C@@H]1CN(C(=O)c1ccccc1)C2	ZINC001091443787	1361099356	/nfs/dbraw/zinc/09/93/56/1361099356.db2.gz	SDVZHCXQNBSIDY-IRLDBZIGSA-N	0	3	345.446	3.152	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)C3(CC)CCC(F)(F)CC3)C[C@]2(C)C1	ZINC001091794833	1361222355	/nfs/dbraw/zinc/22/23/55/1361222355.db2.gz	FHVSKXTVTNHVSO-WBVHZDCISA-N	0	3	338.442	3.006	20	30		EGEDHN
CCC1(C(=O)N2C[C@H]3CN(Cc4cccc(C#N)c4)C[C@@]3(C)C2)CC1	ZINC001091982760	1361266759	/nfs/dbraw/zinc/26/67/59/1361266759.db2.gz	QENWTSMDYGHBBK-QUCCMNQESA-N	0	3	337.467	3.029	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)CC34CC5CC(CC(C5)C3)C4)C[C@]2(C)C1	ZINC001092224870	1361330895	/nfs/dbraw/zinc/33/08/95/1361330895.db2.gz	PBUQWCBACJTYQB-PUMJYOEESA-N	0	3	340.511	3.006	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)/C=C(/C)C2CC2)CC1	ZINC001093359849	1361571982	/nfs/dbraw/zinc/57/19/82/1361571982.db2.gz	VOKXYEKWXBJTLP-FZWACIFYSA-N	0	3	326.484	3.069	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)c2ccoc2Cl)CC1	ZINC001093367295	1361576782	/nfs/dbraw/zinc/57/67/82/1361576782.db2.gz	MSBUGEIZSDEVFB-INIZCTEOSA-N	0	3	346.858	3.273	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@]2(C)CC=CCC2)CC1	ZINC001093369691	1361578646	/nfs/dbraw/zinc/57/86/46/1361578646.db2.gz	JIURKHGGUIJOAT-PZJWPPBQSA-N	0	3	340.511	3.459	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC([C@@H]2N(C/C=C/Cl)CC23CCC3)CC1	ZINC001093370236	1361579171	/nfs/dbraw/zinc/57/91/71/1361579171.db2.gz	QPUCMNASRNVXCS-RITBQAEESA-N	0	3	346.902	3.245	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@H]2CCCC23CC3)CC1	ZINC001093372506	1361581648	/nfs/dbraw/zinc/58/16/48/1361581648.db2.gz	DYVLHGHZRBQIJO-MOPGFXCFSA-N	0	3	340.511	3.293	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@]23CCC[C@H]2N(C[C@H](F)CC)CC3)cc1	ZINC001094486348	1361824706	/nfs/dbraw/zinc/82/47/06/1361824706.db2.gz	BBBSYZFUAGOWQK-SFHLNBCPSA-N	0	3	342.458	3.390	20	30		EGEDHN
Cc1ccc(CN2CC[C@H](NC(=O)Nc3ccc(C#N)cc3)C2)cc1	ZINC001184774638	1387535325	/nfs/dbraw/zinc/53/53/25/1387535325.db2.gz	QZIMEYZYKQKRGI-IBGZPJMESA-N	0	3	334.423	3.263	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cccc(C(F)F)c3)CCC[C@@H]12	ZINC001094563248	1361861742	/nfs/dbraw/zinc/86/17/42/1361861742.db2.gz	MDZSFEGXAXCDBW-VQIMIIECSA-N	0	3	332.394	3.232	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3c(F)cccc3Cl)CCC[C@@H]12	ZINC001094565295	1361862411	/nfs/dbraw/zinc/86/24/11/1361862411.db2.gz	STPSZMVRCDSGMU-CRAIPNDOSA-N	0	3	334.822	3.087	20	30		EGEDHN
Cc1ccc(CN2[C@@H]3CC[C@H]2[C@@H](NC(=O)c2ccc(C#N)[nH]2)C3)cc1C	ZINC001095327744	1362103301	/nfs/dbraw/zinc/10/33/01/1362103301.db2.gz	DOWDJORKDCBOCA-HOJAQTOUSA-N	0	3	348.450	3.039	20	30		EGEDHN
Cc1cc(C)cc(CN2[C@@H]3CC[C@H]2[C@@H](NC(=O)c2c[nH]c(C#N)c2)C3)c1	ZINC001095329377	1362103704	/nfs/dbraw/zinc/10/37/04/1362103704.db2.gz	JIEAMAVIXUAIBI-AABGKKOBSA-N	0	3	348.450	3.039	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1c(C)c(F)ccc1Cl)C2	ZINC001095648000	1362195801	/nfs/dbraw/zinc/19/58/01/1362195801.db2.gz	BJLGGVHFNFRRFU-KCXAZCMYSA-N	0	3	334.822	3.146	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(O[C@@H](C)CC)cc1)C2	ZINC001096296186	1362456815	/nfs/dbraw/zinc/45/68/15/1362456815.db2.gz	ZCLMPEFKVLHLFW-RKOGWWSCSA-N	0	3	340.467	3.222	20	30		EGEDHN
Cc1ccc(C)c(CN2[C@@H]3CC[C@H]2[C@H](NC(=O)c2c[nH]c(C#N)c2)C3)c1	ZINC001096972406	1362799896	/nfs/dbraw/zinc/79/98/96/1362799896.db2.gz	NHEKTWLNXVCEEH-AQNXPRMDSA-N	0	3	348.450	3.039	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cccc(C(F)F)c1F)C2	ZINC001097088094	1362837773	/nfs/dbraw/zinc/83/77/73/1362837773.db2.gz	FTSJSXGMHGSBFK-DFBGVHRSSA-N	0	3	336.357	3.122	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3CC(=C)C)cc1	ZINC001097357066	1362949848	/nfs/dbraw/zinc/94/98/48/1362949848.db2.gz	IKHAUPSFGJWOSR-QRQLOZEOSA-N	0	3	326.440	3.163	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H]1CCO[C@H]1c1ccccc1)C2	ZINC001098017047	1363197810	/nfs/dbraw/zinc/19/78/10/1363197810.db2.gz	QRIRBRWYDXZTOP-UEDWAMCQSA-N	0	3	340.467	3.062	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(OC)c(C3CC3)c1)C2	ZINC001098121603	1363226833	/nfs/dbraw/zinc/22/68/33/1363226833.db2.gz	JWZORRXSLLCPEP-QRQLOZEOSA-N	0	3	340.467	3.484	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C1(c3ccccc3C)CCC1)C2	ZINC001098290461	1363286343	/nfs/dbraw/zinc/28/63/43/1363286343.db2.gz	IFSSYOCQUDNRPJ-RLLQIKCJSA-N	0	3	336.479	3.162	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(OC)c(OCC)c1)C2	ZINC001098343471	1363304107	/nfs/dbraw/zinc/30/41/07/1363304107.db2.gz	CKJAHHMVRNLQRK-ZACQAIPSSA-N	0	3	344.455	3.005	20	30		EGEDHN
C=C(C)CN1CCC2(CC1)CN(C(=O)C(C)C)Cc1ccccc1O2	ZINC001098537105	1363358778	/nfs/dbraw/zinc/35/87/78/1363358778.db2.gz	GVRIILHHLPNISW-UHFFFAOYSA-N	0	3	342.483	3.474	20	30		EGEDHN
C=C(C)CN1CCC2(CC1)CN(C(=O)C1CC1)Cc1ccccc1O2	ZINC001098537949	1363359365	/nfs/dbraw/zinc/35/93/65/1363359365.db2.gz	XUAPRKCKRGELPX-UHFFFAOYSA-N	0	3	340.467	3.228	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H]1CCCC3(CC3)C1)C[C@@H](C)O2	ZINC001098600349	1363394204	/nfs/dbraw/zinc/39/42/04/1363394204.db2.gz	ZFJQARHLOBKVGQ-QZTJIDSGSA-N	0	3	346.515	3.225	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1CCC3(CC3)CC1)C[C@H](C)O2	ZINC001098614698	1363399693	/nfs/dbraw/zinc/39/96/93/1363399693.db2.gz	WZDXKOZNZYZBIB-KRWDZBQOSA-N	0	3	346.515	3.225	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H]1C[C@@H]3CCCC[C@H]13)C[C@H](C)O2	ZINC001098617180	1363400727	/nfs/dbraw/zinc/40/07/27/1363400727.db2.gz	WEYCRXNNUQATTP-CADBVGFASA-N	0	3	346.515	3.081	20	30		EGEDHN
C=CCCC(=O)NC[C@H]1CCC(C)(C)CN1CCc1cnn(CC)c1	ZINC001098966070	1363545114	/nfs/dbraw/zinc/54/51/14/1363545114.db2.gz	GMHRVPONWDCMOA-GOSISDBHSA-N	0	3	346.519	3.019	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(F)c3ccncc23)C1	ZINC001098991147	1363560083	/nfs/dbraw/zinc/56/00/83/1363560083.db2.gz	QDTVTTSPBDJEKP-XOBRGWDASA-N	0	3	339.414	3.144	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(F)c(Cl)cc2F)C1	ZINC001099006838	1363568712	/nfs/dbraw/zinc/56/87/12/1363568712.db2.gz	PHCULDBUBUAMSA-GTNSWQLSSA-N	0	3	340.801	3.389	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cccc(-c3cnco3)c2)C1	ZINC001099101399	1363622233	/nfs/dbraw/zinc/62/22/33/1363622233.db2.gz	WXWOTSISLBWGMX-PXNSSMCTSA-N	0	3	337.423	3.112	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)COCc1ccc(C)cc1	ZINC001099101804	1363623016	/nfs/dbraw/zinc/62/30/16/1363623016.db2.gz	DTAYSGBRIYEQKE-LJQANCHMSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)CCCC1CCOCC1	ZINC001099103460	1363624254	/nfs/dbraw/zinc/62/42/54/1363624254.db2.gz	ZVFIKDCHIVUXOY-SFHVURJKSA-N	0	3	336.520	3.376	20	30		EGEDHN
C#CCCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(C3CC3)s2)C1	ZINC001099119246	1363633939	/nfs/dbraw/zinc/63/39/39/1363633939.db2.gz	LBLSSNFUQMWJEM-KXBFYZLASA-N	0	3	328.481	3.233	20	30		EGEDHN
C=C(Cl)CN1CC(C)(C)CC[C@H]1CNC(=O)C(C)(C)N(C)CC	ZINC001099130347	1363642726	/nfs/dbraw/zinc/64/27/26/1363642726.db2.gz	KGALHHQHCNEFOB-HNNXBMFYSA-N	0	3	343.943	3.076	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)Cc1noc2ccccc12	ZINC001099135860	1363647418	/nfs/dbraw/zinc/64/74/18/1363647418.db2.gz	QZGTVNANNMRGCJ-OAHLLOKOSA-N	0	3	341.455	3.163	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(C3CCCC3)no2)C1	ZINC001099168695	1363667387	/nfs/dbraw/zinc/66/73/87/1363667387.db2.gz	FTADFHXSZVRSAX-JXFKEZNVSA-N	0	3	343.471	3.493	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(C(C)(F)F)cc2)C1	ZINC001099190740	1363683127	/nfs/dbraw/zinc/68/31/27/1363683127.db2.gz	PGWUGUVVFNGTJG-PXNSSMCTSA-N	0	3	346.421	3.406	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)C1(c2cc(C)no2)CC1	ZINC001099193436	1363684571	/nfs/dbraw/zinc/68/45/71/1363684571.db2.gz	BTGBYEGSNNKTIB-INIZCTEOSA-N	0	3	345.487	3.198	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)C(C)(C)C(F)F	ZINC001099228789	1363701570	/nfs/dbraw/zinc/70/15/70/1363701570.db2.gz	AHLCLHQSFWWSBZ-CQSZACIVSA-N	0	3	346.462	3.087	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2ccnc3ccccc32)C[C@H]1C(F)(F)F	ZINC001099277562	1363728556	/nfs/dbraw/zinc/72/85/56/1363728556.db2.gz	YYXCSTDZRAKCMO-GDBMZVCRSA-N	0	3	349.356	3.013	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)CC2CC(C)(C)C2)C[C@H]1C(F)(F)F	ZINC001099295485	1363736654	/nfs/dbraw/zinc/73/66/54/1363736654.db2.gz	BKBVPTWNSHULAE-ZIAGYGMSSA-N	0	3	332.410	3.368	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@H]1CC12CCCC2	ZINC001099299724	1363737938	/nfs/dbraw/zinc/73/79/38/1363737938.db2.gz	VGNWIEQEXYEIJG-ZWKOTPCHSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@@H](C)CC2CCCC2)C[C@H]1C(F)(F)F	ZINC001099317197	1363746212	/nfs/dbraw/zinc/74/62/12/1363746212.db2.gz	VEDHKJZZFCLVFT-NWANDNLSSA-N	0	3	332.410	3.368	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@H](C)C2CCCC2)C[C@H]1C(F)(F)F	ZINC001099331130	1363754485	/nfs/dbraw/zinc/75/44/85/1363754485.db2.gz	BMDIUIWTFVUXNS-BPLDGKMQSA-N	0	3	332.410	3.368	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2ccc(Cl)cc2)C[C@H]1C(F)(F)F	ZINC001099335112	1363756985	/nfs/dbraw/zinc/75/69/85/1363756985.db2.gz	JCXZLUQSMSNPPL-CHWSQXEVSA-N	0	3	332.753	3.119	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2cnc(C(C)C)s2)C[C@H]1C(F)(F)F	ZINC001099351754	1363767320	/nfs/dbraw/zinc/76/73/20/1363767320.db2.gz	XPHHZVHLXGQSOL-GHMZBOCLSA-N	0	3	347.406	3.045	20	30		EGEDHN
C=CCC1(C(=O)NC[C@H]2CCC(C)(C)CN2CCOC)CCCC1	ZINC001099378176	1363780210	/nfs/dbraw/zinc/78/02/10/1363780210.db2.gz	ARPKLFJYKVEPJF-QGZVFWFLSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)CCCC1CC1	ZINC001099513346	1363828392	/nfs/dbraw/zinc/82/83/92/1363828392.db2.gz	OIIKJGANARKLFF-FJIDUMEYSA-N	0	3	336.907	3.488	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)[C@H](CC)CCCC)CC2(CCOCC2)C1	ZINC001099566523	1363852756	/nfs/dbraw/zinc/85/27/56/1363852756.db2.gz	QVTICPDCHWNHKM-MSOLQXFVSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1CN(CC(=C)C)CC2(CCOCC2)C1	ZINC001099588891	1363870474	/nfs/dbraw/zinc/87/04/74/1363870474.db2.gz	LKCLOSPDMXJDGO-ROUUACIJSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](CNCc2nccs2)[C@@H](C)C1	ZINC001185226999	1387656811	/nfs/dbraw/zinc/65/68/11/1387656811.db2.gz	ULXVEQKCVLOOTJ-GJZGRUSLSA-N	0	3	335.517	3.320	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](CNCc2oc(C)nc2C)[C@H](C)C1	ZINC001185227241	1387656954	/nfs/dbraw/zinc/65/69/54/1387656954.db2.gz	WBDUZFRARYRQQA-RHSMWYFYSA-N	0	3	347.503	3.468	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCC1CC(NCc2c(C)noc2CC)C1	ZINC001100367735	1364094210	/nfs/dbraw/zinc/09/42/10/1364094210.db2.gz	WDFQQRSLFRJKSL-UHFFFAOYSA-N	0	3	333.476	3.132	20	30		EGEDHN
C=CCn1cccc1C(=O)NCC1CC(NCC=C(Cl)Cl)C1	ZINC001100409050	1364104529	/nfs/dbraw/zinc/10/45/29/1364104529.db2.gz	RMROKHDGQNUWFA-UHFFFAOYSA-N	0	3	342.270	3.091	20	30		EGEDHN
C#CCCCCCC(=O)NCC1CC(NCc2cccc(Cl)n2)C1	ZINC001100570340	1364167674	/nfs/dbraw/zinc/16/76/74/1364167674.db2.gz	ONOQXJBZKIERGD-UHFFFAOYSA-N	0	3	347.890	3.303	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1	ZINC001100644961	1364202661	/nfs/dbraw/zinc/20/26/61/1364202661.db2.gz	OHBPSXAFLNRPOZ-MKJPBZQASA-N	0	3	343.446	3.284	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC2CC(NCc3cc(C#N)ccc3F)C2)C1	ZINC001100661466	1364207953	/nfs/dbraw/zinc/20/79/53/1364207953.db2.gz	WBOHHEGCKWKXMM-UHFFFAOYSA-N	0	3	341.430	3.038	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)[C@@H](C)CC(C)C)C1	ZINC001100795742	1364264838	/nfs/dbraw/zinc/26/48/38/1364264838.db2.gz	GYVLWWSSHBBDJH-XGNXJENSSA-N	0	3	331.298	3.062	20	30		EGEDHN
CC(C)C[C@H](C)C(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1	ZINC001100795940	1364265518	/nfs/dbraw/zinc/26/55/18/1364265518.db2.gz	MZJSIWCZUWFOBF-NXVRBGIVSA-N	0	3	345.462	3.364	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)Cc2ccccc2Cl)C1	ZINC001100950912	1364344280	/nfs/dbraw/zinc/34/42/80/1364344280.db2.gz	GIWLBKDACYMGOO-UHFFFAOYSA-N	0	3	327.255	3.119	20	30		EGEDHN
C=CCC1(C(=O)NCC2CC(NCc3ccns3)C2)CCCC1	ZINC001101080166	1364403716	/nfs/dbraw/zinc/40/37/16/1364403716.db2.gz	BNOKITVATGZFLC-UHFFFAOYSA-N	0	3	333.501	3.264	20	30		EGEDHN
C=C(C)CN1CC[C@H](Oc2ccnc(CNC(=O)/C=C(\C)CC)c2)C1	ZINC001101093661	1364410419	/nfs/dbraw/zinc/41/04/19/1364410419.db2.gz	GXPYWFKBEYJAIX-XLCPLWEUSA-N	0	3	343.471	3.083	20	30		EGEDHN
CC/C=C(\C)C(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@@]2(C)C1	ZINC001101152930	1364434478	/nfs/dbraw/zinc/43/44/78/1364434478.db2.gz	UMGANICFZWPTEM-LOOKSEQCSA-N	0	3	337.467	3.195	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@@]2(C)C1	ZINC001101203437	1364461258	/nfs/dbraw/zinc/46/12/58/1364461258.db2.gz	WFNITLMEDTUZAK-IRLDBZIGSA-N	0	3	349.478	3.032	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@H]2CN(Cc3ccsc3)C[C@@]2(C)C1	ZINC001101203128	1364461680	/nfs/dbraw/zinc/46/16/80/1364461680.db2.gz	IAONVKHWNNDGOW-MJGOQNOKSA-N	0	3	330.497	3.222	20	30		EGEDHN
Cc1ccc(F)cc1CN1C[C@@H]2CN(C(=O)C#CC(C)C)C[C@]2(C)C1	ZINC001101229954	1364476005	/nfs/dbraw/zinc/47/60/05/1364476005.db2.gz	PLDLWMHOAKPKCC-NQIIRXRSSA-N	0	3	342.458	3.074	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@H]2CN(Cc3cccnc3C)C[C@@]2(C)C1	ZINC001101251612	1364486303	/nfs/dbraw/zinc/48/63/03/1364486303.db2.gz	BBZBKAYBHMBCDK-NQIIRXRSSA-N	0	3	341.499	3.273	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)CCCc3cc(C)ccc3C)C[C@]2(C)C1	ZINC001101470192	1364574359	/nfs/dbraw/zinc/57/43/59/1364574359.db2.gz	DMPNHTVSOIPXHW-IRLDBZIGSA-N	0	3	338.495	3.040	20	30		EGEDHN
C=CCCC(=O)N1CCC(C(C)(C)CNCc2cc(C)on2)CC1	ZINC001101519421	1364595661	/nfs/dbraw/zinc/59/56/61/1364595661.db2.gz	FKJWRYOQWFNEFB-UHFFFAOYSA-N	0	3	333.476	3.304	20	30		EGEDHN
C=CCC[C@H](C)N1CC2(C1)C[C@H](NC(=O)/C(C)=C\CC)c1nccn12	ZINC001101613835	1364656149	/nfs/dbraw/zinc/65/61/49/1364656149.db2.gz	JBBFDVSDCOIHDH-LYXSOASSSA-N	0	3	342.487	3.166	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@@H]1CN(Cc2oc(CC)nc2C)C[C@H]1C	ZINC001102006452	1364809443	/nfs/dbraw/zinc/80/94/43/1364809443.db2.gz	CMIXHYPJGXDWQF-GDBMZVCRSA-N	0	3	347.503	3.332	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H]1CN(Cc2oc(C)nc2C)C[C@H]1C	ZINC001102219297	1364940302	/nfs/dbraw/zinc/94/03/02/1364940302.db2.gz	BKTJLGSHWPDYRB-CZUORRHYSA-N	0	3	333.476	3.078	20	30		EGEDHN
CCC(C)(C)C(=O)NC[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1C	ZINC001102298973	1364989671	/nfs/dbraw/zinc/98/96/71/1364989671.db2.gz	GJXIHVGCCAMBPB-RHSMWYFYSA-N	0	3	345.462	3.318	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@@H]1CN([C@H](C)c2cnc(C)cn2)C[C@H]1C	ZINC001102409962	1365042694	/nfs/dbraw/zinc/04/26/94/1365042694.db2.gz	CYSSHHQMLUCPBN-DJIMGWMZSA-N	0	3	344.503	3.132	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@@H]1CN([C@@H](C)c2cnc(C)cn2)C[C@H]1C	ZINC001102409963	1365042917	/nfs/dbraw/zinc/04/29/17/1365042917.db2.gz	CYSSHHQMLUCPBN-HYVNUMGLSA-N	0	3	344.503	3.132	20	30		EGEDHN
C=C[C@H](C(=O)NC[C@@H]1CN(Cc2cccnc2)C[C@H]1C)c1ccccc1	ZINC001102593297	1365129164	/nfs/dbraw/zinc/12/91/64/1365129164.db2.gz	OOJVOPOQEOELOK-UIFIKXQLSA-N	0	3	349.478	3.236	20	30		EGEDHN
CC(C)=CC(=O)NCC[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1C	ZINC001102647834	1365153831	/nfs/dbraw/zinc/15/38/31/1365153831.db2.gz	DHSQKRNXMUERLH-SJLPKXTDSA-N	0	3	325.456	3.099	20	30		EGEDHN
C=CCCC(=O)NCC[C@@H]1CN(Cc2ccc(C#N)cc2F)C[C@H]1C	ZINC001102760086	1365205683	/nfs/dbraw/zinc/20/56/83/1365205683.db2.gz	DNEMIXBPBMXIMT-NVXWUHKLSA-N	0	3	343.446	3.238	20	30		EGEDHN
C=CCCC(=O)NCC[C@@H]1CN(Cc2cccc(OCC)n2)C[C@H]1C	ZINC001102760173	1365205857	/nfs/dbraw/zinc/20/58/57/1365205857.db2.gz	IBJFRVNUACGQKH-IAGOWNOFSA-N	0	3	345.487	3.021	20	30		EGEDHN
C=CCn1cccc1C(=O)NCC[C@@H]1CN(CC(=C)Cl)C[C@H]1C	ZINC001103088549	1365374748	/nfs/dbraw/zinc/37/47/48/1365374748.db2.gz	HNXFCYYOAJUJSM-GDBMZVCRSA-N	0	3	335.879	3.114	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)c2csc(C#N)c2)CN1Cc1ccccc1	ZINC001324709082	1387746749	/nfs/dbraw/zinc/74/67/49/1387746749.db2.gz	WDIOMLGIQRFLRW-BBRMVZONSA-N	0	3	325.437	3.013	20	30		EGEDHN
C=CCCCC(=O)NCC[C@@H]1CN(Cc2ccc(F)cn2)C[C@H]1C	ZINC001103382631	1365527235	/nfs/dbraw/zinc/52/72/35/1365527235.db2.gz	PCIZHXBPOXEHDF-HZPDHXFCSA-N	0	3	333.451	3.151	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC[C@@H]1CN(Cc2cncs2)C[C@H]1C	ZINC001103402005	1365538343	/nfs/dbraw/zinc/53/83/43/1365538343.db2.gz	XDCMSYWUXDOINW-RKVPGOIHSA-N	0	3	335.517	3.320	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)[C@@H](C)c2cccnc2)C1	ZINC001103652247	1365703334	/nfs/dbraw/zinc/70/33/34/1365703334.db2.gz	WCRGQFJRENLOFZ-UKPHBRMFSA-N	0	3	335.879	3.012	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CN(C(=O)CC(C)C)C[C@H]1C	ZINC001103831277	1365804192	/nfs/dbraw/zinc/80/41/92/1365804192.db2.gz	PKABBFZJFGEEFK-TZMCWYRMSA-N	0	3	331.298	3.015	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@H](CCNCc2c(C)noc2CC)C1	ZINC001103977966	1365856970	/nfs/dbraw/zinc/85/69/70/1365856970.db2.gz	OJMNZXJTBOYJOA-GDBMZVCRSA-N	0	3	333.476	3.086	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)[C@H](CCNCc2c(C)onc2CC)C1	ZINC001104492140	1366046867	/nfs/dbraw/zinc/04/68/67/1366046867.db2.gz	QPKUOKQPTWXFAG-GDBMZVCRSA-N	0	3	347.503	3.332	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H](C)[C@H](CCNCc2nccn2CC)C1	ZINC001104563867	1366078936	/nfs/dbraw/zinc/07/89/36/1366078936.db2.gz	XPPSGTAXDYSLTD-KZNAEPCWSA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2nc(Cl)cs2)C[C@H]1C	ZINC001104584185	1366086192	/nfs/dbraw/zinc/08/61/92/1366086192.db2.gz	WWIFSJVMERLEDB-MWLCHTKSSA-N	0	3	348.299	3.237	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2nc(C)cs2)C1	ZINC001104607123	1366099385	/nfs/dbraw/zinc/09/93/85/1366099385.db2.gz	KWEIQMAFHVWWFJ-GDBMZVCRSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)Cc2ccc(F)cc2)C[C@H]1C	ZINC001104968419	1366246923	/nfs/dbraw/zinc/24/69/23/1366246923.db2.gz	BOBADIURLKXCMX-CZUORRHYSA-N	0	3	338.854	3.195	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2cc(F)cc(F)c2)C[C@H]1C	ZINC001104983750	1366257289	/nfs/dbraw/zinc/25/72/89/1366257289.db2.gz	XNVMUCCDAQCIOK-DGCLKSJQSA-N	0	3	342.817	3.405	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C[C@H](C)C(C)C)CC1	ZINC001105388926	1366435693	/nfs/dbraw/zinc/43/56/93/1366435693.db2.gz	FIPNEKHFFHQHIR-FXAWDEMLSA-N	0	3	330.516	3.395	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)CCC(C)(F)F)CC1	ZINC001105394233	1366443729	/nfs/dbraw/zinc/44/37/29/1366443729.db2.gz	RDCRFHQIWVJLLW-KRWDZBQOSA-N	0	3	338.442	3.148	20	30		EGEDHN
CC(C)[C@@H](C)CC(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001105930246	1366599702	/nfs/dbraw/zinc/59/97/02/1366599702.db2.gz	PCOIVDWJTDVZQC-SQGPQFPESA-N	0	3	341.499	3.425	20	30		EGEDHN
CC(C)(F)C(=O)NC[C@]12CCC[C@H]1N(Cc1ccc(C#N)s1)CC2	ZINC001107258511	1366906806	/nfs/dbraw/zinc/90/68/06/1366906806.db2.gz	ONYBJUNESFSXSZ-CRAIPNDOSA-N	0	3	349.475	3.229	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC[C@]12CCC[C@H]1N(C/C=C/Cl)CC2	ZINC001107318625	1366925552	/nfs/dbraw/zinc/92/55/52/1366925552.db2.gz	SFIFLZHNLUCGFA-ZBNIVXFGSA-N	0	3	340.895	3.081	20	30		EGEDHN
C=CCOCC(=O)N1CC[C@H](N(C)Cc2cc3ccccc3s2)C1	ZINC001189381005	1367007785	/nfs/dbraw/zinc/00/77/85/1367007785.db2.gz	UQWYZUHIJGEFJB-INIZCTEOSA-N	0	3	344.480	3.137	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@H](C)Cc1cccc(F)c1)C2	ZINC001109288238	1367039916	/nfs/dbraw/zinc/03/99/16/1367039916.db2.gz	SCLHAIJRGJNKKH-XCLNPWKQSA-N	0	3	342.458	3.139	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1oc(CC3CC3)nc1C)C2	ZINC001109292968	1367043185	/nfs/dbraw/zinc/04/31/85/1367043185.db2.gz	OSURJRMREKXOBZ-IKGGRYGDSA-N	0	3	343.471	3.237	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@]12CCC[C@H]1N(Cc1cc(C)no1)CC2	ZINC001107561267	1367045037	/nfs/dbraw/zinc/04/50/37/1367045037.db2.gz	HHVPESXKCGEMAT-YLJYHZDGSA-N	0	3	345.487	3.446	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2ccc(C)s2)C1	ZINC001107698342	1367107534	/nfs/dbraw/zinc/10/75/34/1367107534.db2.gz	OOYWPMIOIBJNBD-RDTXWAMCSA-N	0	3	336.501	3.232	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1sc3nccn3c1C)C2	ZINC001109414079	1367111002	/nfs/dbraw/zinc/11/10/02/1367111002.db2.gz	XEDNVFYGPKFJKI-ILXRZTDVSA-N	0	3	344.484	3.006	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2cccc(F)c2)C1	ZINC001107706190	1367112403	/nfs/dbraw/zinc/11/24/03/1367112403.db2.gz	IHRKEIYLAGGOEG-KXBFYZLASA-N	0	3	334.435	3.001	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2cc(C)oc2C)C1	ZINC001107731892	1367120414	/nfs/dbraw/zinc/12/04/14/1367120414.db2.gz	UKRSEAGMXVHABS-KUHUBIRLSA-N	0	3	334.460	3.072	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](N(C)CCOc2ccc(Cl)cc2)C1	ZINC001189925942	1367132515	/nfs/dbraw/zinc/13/25/15/1367132515.db2.gz	IKXSLQUCMVQNRE-QGZVFWFLSA-N	0	3	348.874	3.055	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)CC2=CCCCC2)C1	ZINC001107813106	1367156916	/nfs/dbraw/zinc/15/69/16/1367156916.db2.gz	NOXTXUCCGXNGLM-YLJYHZDGSA-N	0	3	334.504	3.439	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCc1ccccc1OCC)C2	ZINC001109493592	1367158130	/nfs/dbraw/zinc/15/81/30/1367158130.db2.gz	GJHCPOPVJDOLBC-QYZOEREBSA-N	0	3	342.483	3.316	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2C[C@H]1CC(C)(C)CO1	ZINC001109597238	1367221625	/nfs/dbraw/zinc/22/16/25/1367221625.db2.gz	FEROCKQTNGTGPY-NCOADZHNSA-N	0	3	334.504	3.125	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NC[C@@]1(C)CN(CC2CCCC2)CCO1	ZINC001107970999	1367224082	/nfs/dbraw/zinc/22/40/82/1367224082.db2.gz	LNRWORATSCKFHE-SFHVURJKSA-N	0	3	342.911	3.162	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](N(C)Cc2cccc(OC)c2)C1	ZINC001190355284	1367238338	/nfs/dbraw/zinc/23/83/38/1367238338.db2.gz	XWCCMGDRHVROJQ-LJQANCHMSA-N	0	3	342.483	3.496	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CC[C@@H](N(C)Cc2ccc(F)cc2)C1)OCC	ZINC001190445542	1367267141	/nfs/dbraw/zinc/26/71/41/1367267141.db2.gz	YLJZCQFWDICDBQ-MOPGFXCFSA-N	0	3	348.462	3.230	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCN(C(=O)C(C)(C)CC(F)F)C1	ZINC001190605476	1367306583	/nfs/dbraw/zinc/30/65/83/1367306583.db2.gz	XDGQMAPLKRTMCM-MRXNPFEDSA-N	0	3	349.425	3.272	20	30		EGEDHN
CC[C@H](CC(F)F)C(=O)N1CC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001190614397	1367308694	/nfs/dbraw/zinc/30/86/94/1367308694.db2.gz	YHCZUIVNNQNJIH-IAGOWNOFSA-N	0	3	349.425	3.272	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@@]1(C)CN(CC2CC(C)(C)C2)CCO1	ZINC001108147681	1367309214	/nfs/dbraw/zinc/30/92/14/1367309214.db2.gz	BZDWOJLZGPGVTL-UZLBHIALSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2cc[nH]c2C2CC2)C1	ZINC001108164092	1367318154	/nfs/dbraw/zinc/31/81/54/1367318154.db2.gz	UBPXUMKFMXZYRM-QRWLVFNGSA-N	0	3	345.487	3.068	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@]1(C)CN(CC2CCCCC2)CCO1	ZINC001108189840	1367332151	/nfs/dbraw/zinc/33/21/51/1367332151.db2.gz	MINHACLBYCYWPC-WOJBJXKFSA-N	0	3	336.520	3.376	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](CC)Cc1cccc(C)c1)C2	ZINC001109806547	1367333384	/nfs/dbraw/zinc/33/33/84/1367333384.db2.gz	HJGLFLZCMZHZRV-CGXNFDGLSA-N	0	3	338.495	3.309	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCO[C@H]1C1CCN(C(=O)CCCC)CC1	ZINC001186114847	1387873553	/nfs/dbraw/zinc/87/35/53/1387873553.db2.gz	QAGSWJGXCBJCNM-AEFFLSMTSA-N	0	3	342.911	3.305	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@H](CC)C(C)(C)C)C2	ZINC001109970078	1367435574	/nfs/dbraw/zinc/43/55/74/1367435574.db2.gz	MZLXXVHIKISYPC-MHORFTMASA-N	0	3	336.520	3.373	20	30		EGEDHN
C#CCC1(C(=O)NC[C@]2(C)CN(C[C@H](C)CC)CCO2)CCCCC1	ZINC001108429702	1367452653	/nfs/dbraw/zinc/45/26/53/1367452653.db2.gz	MODQUJMCNZXNDT-UYAOXDASSA-N	0	3	348.531	3.213	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(OCCCC)cc1)C2	ZINC001110094671	1367500507	/nfs/dbraw/zinc/50/05/07/1367500507.db2.gz	OPUBYBRUXKCMNB-HOJAQTOUSA-N	0	3	340.467	3.224	20	30		EGEDHN
C#CCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3C[C@@H](CC)OC)CCCCC1	ZINC001110177726	1367547010	/nfs/dbraw/zinc/54/70/10/1367547010.db2.gz	FGPZGUIXPKEUGB-YRXWBPOGSA-N	0	3	346.515	3.107	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@H](N(C)CCOCc2ccccc2)C1	ZINC001191890552	1367626921	/nfs/dbraw/zinc/62/69/21/1367626921.db2.gz	RPUQHYQVBZBHEI-QUCCMNQESA-N	0	3	344.499	3.338	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001191912032	1367634965	/nfs/dbraw/zinc/63/49/65/1367634965.db2.gz	MFINNAQITWCBTB-LPHOPBHVSA-N	0	3	325.456	3.193	20	30		EGEDHN
CC#CCN1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)/C(C)=C\C)C1	ZINC001186180748	1387891495	/nfs/dbraw/zinc/89/14/95/1387891495.db2.gz	QDGXBKUMBAYYRF-GIVRCXRQSA-N	0	3	342.458	3.337	20	30		EGEDHN
C[C@@H](C#N)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccc2ccccc2c1	ZINC001110402183	1367694816	/nfs/dbraw/zinc/69/48/16/1367694816.db2.gz	ZLVCTHIQAQBIPQ-PSAKCFHXSA-N	0	3	333.435	3.221	20	30		EGEDHN
C=CCCCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1coc(CC)n1)C2	ZINC001110463061	1367752520	/nfs/dbraw/zinc/75/25/20/1367752520.db2.gz	PPIGUMLMOMHKIO-INMHGKMJSA-N	0	3	331.460	3.319	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccc(CF)cc1	ZINC001110493402	1367780883	/nfs/dbraw/zinc/78/08/83/1367780883.db2.gz	PJQAQNBDSRGXEK-QRVBRYPASA-N	0	3	328.431	3.181	20	30		EGEDHN
CCc1ccccc1CCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C#CC(C)C)C2	ZINC001110534114	1367813935	/nfs/dbraw/zinc/81/39/35/1367813935.db2.gz	QGPMCFUAXSHXOX-NJYVYQBISA-N	0	3	338.495	3.172	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](N(C)Cc2cccc(COC)c2)C1	ZINC001192586791	1367826144	/nfs/dbraw/zinc/82/61/44/1367826144.db2.gz	WABWCZMPNAWVCL-LJQANCHMSA-N	0	3	344.499	3.468	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)[C@]2(C)CC[C@H](C)C2(C)C)C1	ZINC001192679997	1367848272	/nfs/dbraw/zinc/84/82/72/1367848272.db2.gz	KMRPGBMLQHYCHQ-ZWOKBUDYSA-N	0	3	336.520	3.184	20	30		EGEDHN
CCCCCCC[C@H](C)NC(=O)NCCN1CCN(C(C)C)CC1	ZINC001192950325	1367911196	/nfs/dbraw/zinc/91/11/96/1367911196.db2.gz	FIJSECGFLFQFHF-SFHVURJKSA-N	0	3	340.556	3.061	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)COCCCCCCCC)C2	ZINC001110672275	1367911261	/nfs/dbraw/zinc/91/12/61/1367911261.db2.gz	MYBSWAOGGNJBEG-QRVBRYPASA-N	0	3	334.504	3.108	20	30		EGEDHN
CCC[C@@H](CC)C(=O)N1CC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001193109441	1367947083	/nfs/dbraw/zinc/94/70/83/1367947083.db2.gz	IFRQHQMXQAVUHJ-RTBURBONSA-N	0	3	327.472	3.417	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@H]2CCC(C)=C(C)C2)C1	ZINC001193159129	1367957161	/nfs/dbraw/zinc/95/71/61/1367957161.db2.gz	WYQDKZSGTDIGFP-IPMKNSEASA-N	0	3	334.504	3.031	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1CN(CCC2CCCCCC2)C[C@H]1O	ZINC001193241584	1367975717	/nfs/dbraw/zinc/97/57/17/1367975717.db2.gz	TZWBPMMDFFQKKX-WOJBJXKFSA-N	0	3	348.531	3.277	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccc(CO)cc1	ZINC001110933754	1368103712	/nfs/dbraw/zinc/10/37/12/1368103712.db2.gz	PYMWFUKYAPKSJQ-XLNTUCKNSA-N	0	3	342.483	3.003	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](C)Cc1ccccc1Cl)C2	ZINC001111081408	1368154980	/nfs/dbraw/zinc/15/49/80/1368154980.db2.gz	UHCWURRAHLNVFH-WLWJZTKJSA-N	0	3	344.886	3.263	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1cccc(CC)c1	ZINC001111482911	1368318730	/nfs/dbraw/zinc/31/87/30/1368318730.db2.gz	XMKWXEPUAUGGAI-AQNXPRMDSA-N	0	3	342.483	3.063	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](C)Cc1cccc(Cl)c1)C2	ZINC001111516167	1368323378	/nfs/dbraw/zinc/32/33/78/1368323378.db2.gz	FJQIXYPZSRRGPL-PIKADFDJSA-N	0	3	344.886	3.263	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)C[C@H](NC(=O)CSC)c1ccccc1O2	ZINC001111529906	1368330260	/nfs/dbraw/zinc/33/02/60/1368330260.db2.gz	RMRRCZCNTAYVOP-LPHOPBHVSA-N	0	3	346.496	3.010	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)CCCC(C)(C)C)C[C@@H](C)O2	ZINC001111540861	1368336338	/nfs/dbraw/zinc/33/63/38/1368336338.db2.gz	TVKPKSRFNJQNJE-QGZVFWFLSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1(CCCC)CC1)C[C@@H](C)O2	ZINC001111549471	1368341443	/nfs/dbraw/zinc/34/14/43/1368341443.db2.gz	RFKFQYMQTDFNOI-QGZVFWFLSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CCCN(Cc2c(C)cccc2C)CC1	ZINC001195174972	1368393473	/nfs/dbraw/zinc/39/34/73/1368393473.db2.gz	WHYVCTDRPDEECZ-LJQANCHMSA-N	0	3	344.499	3.319	20	30		EGEDHN
C=CCCC(=O)N1CCCN(CCCOCCc2ccccc2)CC1	ZINC001195182261	1368395848	/nfs/dbraw/zinc/39/58/48/1368395848.db2.gz	LCLCCMSYSJGTKG-UHFFFAOYSA-N	0	3	344.499	3.136	20	30		EGEDHN
C#CCCCC(=O)N[C@]12CCC[C@H]1CN(C/C=C\c1ccccc1)C2	ZINC001111730103	1368431976	/nfs/dbraw/zinc/43/19/76/1368431976.db2.gz	VVMBLSCLSLDSTK-ZOENHEEKSA-N	0	3	336.479	3.474	20	30		EGEDHN
CC(C)C#CC(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(CF)cc1)C2	ZINC001111735614	1368435333	/nfs/dbraw/zinc/43/53/33/1368435333.db2.gz	IPVAIPBVNZQXJG-FPOVZHCZSA-N	0	3	342.458	3.286	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)C/C=C/c2ccc(F)cc2)C1	ZINC001111788467	1368462673	/nfs/dbraw/zinc/46/26/73/1368462673.db2.gz	CXTHBTFNDBUTPZ-SJMRULAFSA-N	0	3	340.442	3.223	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCCN(C[C@H](OCC)C2CC2)CC1	ZINC001195958018	1368522447	/nfs/dbraw/zinc/52/24/47/1368522447.db2.gz	LLQRQQACKOEDEG-INIZCTEOSA-N	0	3	342.911	3.115	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H](CC)Cc2ccccc2)C1	ZINC001111886849	1368530515	/nfs/dbraw/zinc/53/05/15/1368530515.db2.gz	WJYPEAFVYJUILO-ZJOUEHCJSA-N	0	3	326.484	3.412	20	30		EGEDHN
C#CCC1(C(=O)N2CCCN(CCc3ccc(C)cc3)CC2)CCC1	ZINC001196138040	1368556748	/nfs/dbraw/zinc/55/67/48/1368556748.db2.gz	HOLCYRIPEAMVCO-UHFFFAOYSA-N	0	3	338.495	3.265	20	30		EGEDHN
CC(C)(C)CCC(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001186457789	1387948171	/nfs/dbraw/zinc/94/81/71/1387948171.db2.gz	ATAMFIPMZNNEGK-MRXNPFEDSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=CCCOCC(=O)N[C@]12CCC[C@H]1CN(Cc1csc(C)c1)C2	ZINC001112016335	1368619689	/nfs/dbraw/zinc/61/96/89/1368619689.db2.gz	MBOLNPHEHSDKLN-HKUYNNGSSA-N	0	3	348.512	3.120	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CN(CCC2CCCCCC2)C[C@H]1O	ZINC001196475212	1368623270	/nfs/dbraw/zinc/62/32/70/1368623270.db2.gz	QHEGXIHXQXXHBF-QZTJIDSGSA-N	0	3	336.520	3.111	20	30		EGEDHN
C#CCN1C[C@@H]2CCC[C@]2(NC(=O)CCC(C)(C)c2ccccc2)C1	ZINC001112021568	1368623507	/nfs/dbraw/zinc/62/35/07/1368623507.db2.gz	VBQKBOJAXGQOKU-UGKGYDQZSA-N	0	3	338.495	3.348	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)C/C=C\c2ccc(C)cc2)C1	ZINC001112030653	1368627195	/nfs/dbraw/zinc/62/71/95/1368627195.db2.gz	ZUAHFBBLFDGVHS-RNCACEEWSA-N	0	3	336.479	3.392	20	30		EGEDHN
C=CCC[C@H](C)N1CCCN(C(=O)c2conc2C(F)(F)F)CC1	ZINC001196514992	1368630116	/nfs/dbraw/zinc/63/01/16/1368630116.db2.gz	CGFCPFXVURAXMG-LBPRGKRZSA-N	0	3	345.365	3.196	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)[C@H](C)C(CC)CC)C[C@H]1C(F)(F)F	ZINC001112124649	1368670621	/nfs/dbraw/zinc/67/06/21/1368670621.db2.gz	QUROFURHEPAHFI-BPLDGKMQSA-N	0	3	332.410	3.061	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)C2(C)C(C)(C)C2(C)C)C[C@H]1C(F)(F)F	ZINC001112220001	1368729025	/nfs/dbraw/zinc/72/90/25/1368729025.db2.gz	IMNDJTJWHJCCQJ-CHWSQXEVSA-N	0	3	344.421	3.061	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@H](CC)CC(C)C)C1	ZINC001197583670	1368844273	/nfs/dbraw/zinc/84/42/73/1368844273.db2.gz	RKJPWKKARSKHBS-KZNAEPCWSA-N	0	3	326.525	3.190	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cccnc2N(C)C)CC1	ZINC001198092431	1368958744	/nfs/dbraw/zinc/95/87/44/1368958744.db2.gz	MKFAZAHZNUPPDS-UHFFFAOYSA-N	0	3	344.503	3.042	20	30		EGEDHN
CCCCCCCCCC(=O)N[C@@H]1CN(CC[C@@H](C)F)C[C@H]1O	ZINC001198096448	1368959302	/nfs/dbraw/zinc/95/93/02/1368959302.db2.gz	LRZCISFVWGOEME-BRWVUGGUSA-N	0	3	330.488	3.037	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cncnc2C(C)C)CC1	ZINC001198122042	1368963805	/nfs/dbraw/zinc/96/38/05/1368963805.db2.gz	WQBACXYXOJMXLR-UHFFFAOYSA-N	0	3	344.503	3.494	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)c2cc(C)ccc2C)C1	ZINC001198125903	1368963862	/nfs/dbraw/zinc/96/38/62/1368963862.db2.gz	CDAMVISMDCLQKV-RTBURBONSA-N	0	3	332.488	3.049	20	30		EGEDHN
C=CC[C@H](C(=O)N1CCCN(CCC[C@H](C)O)CC1)c1ccccc1	ZINC001198196290	1368977781	/nfs/dbraw/zinc/97/77/81/1368977781.db2.gz	AJFMQRFJDXAYBX-ICSRJNTNSA-N	0	3	344.499	3.042	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)Cc1cccs1)c1ccccc1OC	ZINC001198491252	1369044068	/nfs/dbraw/zinc/04/40/68/1369044068.db2.gz	GWWTWWHSTWFUKK-KRWDZBQOSA-N	0	3	344.480	3.322	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)c1ccccn1)c1ccccc1OC	ZINC001198492815	1369045222	/nfs/dbraw/zinc/04/52/22/1369045222.db2.gz	WFVBCAMRFKNANA-GOSISDBHSA-N	0	3	339.439	3.117	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)C[C@@H]1C=CCC1)c1ccccc1OC	ZINC001198522327	1369051624	/nfs/dbraw/zinc/05/16/24/1369051624.db2.gz	JTKCTUYNXKWOKC-AEFFLSMTSA-N	0	3	328.456	3.375	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)c1ccoc1)c1ccccc1OC	ZINC001198529770	1369054413	/nfs/dbraw/zinc/05/44/13/1369054413.db2.gz	KJSRAJKABJLMBM-KRWDZBQOSA-N	0	3	328.412	3.315	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)c1cncs1)c1ccccc1OC	ZINC001198576658	1369064626	/nfs/dbraw/zinc/06/46/26/1369064626.db2.gz	DVHOCZCSBGYFKK-HNNXBMFYSA-N	0	3	345.468	3.179	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)[C@@H](C)C1CC1)c1ccccc1OC	ZINC001198647373	1369081565	/nfs/dbraw/zinc/08/15/65/1369081565.db2.gz	MTGVPTDIDLITSM-MAUKXSAKSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)c1ccn(C)c1)c1ccccc1OC	ZINC001198655352	1369083904	/nfs/dbraw/zinc/08/39/04/1369083904.db2.gz	CNRXIWFCJIZRPK-SFHVURJKSA-N	0	3	341.455	3.061	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)C1CC(F)(F)C1)c1ccccc1OC	ZINC001198656295	1369084371	/nfs/dbraw/zinc/08/43/71/1369084371.db2.gz	MMYGOVWUZXZHAZ-OAHLLOKOSA-N	0	3	338.398	3.064	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)[C@@H](CC)SC)c1ccccc1OC	ZINC001198669001	1369086917	/nfs/dbraw/zinc/08/69/17/1369086917.db2.gz	WNWQIUCDJBVEKV-NVXWUHKLSA-N	0	3	336.501	3.160	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)[C@H]1CC1(C)C)c1ccccc1OC	ZINC001198669304	1369087192	/nfs/dbraw/zinc/08/71/92/1369087192.db2.gz	YYFZWEBPZWNFBB-IAGOWNOFSA-N	0	3	330.472	3.454	20	30		EGEDHN
C#CCCCCC(=O)NC[C@H](NCC1CCC1)c1ccccc1OC	ZINC001198677676	1369089131	/nfs/dbraw/zinc/08/91/31/1369089131.db2.gz	QMJFKZCLUSUVRG-IBGZPJMESA-N	0	3	342.483	3.436	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@@H](NCC1CC1)c1ccccc1OC	ZINC001198856490	1369131010	/nfs/dbraw/zinc/13/10/10/1369131010.db2.gz	IMKPOMRXTVCFJH-CRAIPNDOSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@@H](NCCCF)c1ccccc1OC	ZINC001198857501	1369131629	/nfs/dbraw/zinc/13/16/29/1369131629.db2.gz	QMICKAYOXIMFPM-DOTOQJQBSA-N	0	3	336.451	3.404	20	30		EGEDHN
C=CCSc1ncccc1C(=O)NCCc1cnc2cc[nH]cc1-2	ZINC001199740752	1369265364	/nfs/dbraw/zinc/26/53/64/1369265364.db2.gz	XXTVWZKUEFBHMB-UHFFFAOYSA-N	0	3	338.436	3.209	20	30		EGEDHN
C=CCSc1ncccc1C(=O)NCCc1c[nH]c2ccncc12	ZINC001199740752	1369265366	/nfs/dbraw/zinc/26/53/66/1369265366.db2.gz	XXTVWZKUEFBHMB-UHFFFAOYSA-N	0	3	338.436	3.209	20	30		EGEDHN
CCC[C@H](C)C(=O)N1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001199883547	1369284082	/nfs/dbraw/zinc/28/40/82/1369284082.db2.gz	KSQAVMIBYSLDEL-AWEZNQCLSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCCO[C@@H](CNCc2ccccc2F)C1	ZINC001200598528	1369398289	/nfs/dbraw/zinc/39/82/89/1369398289.db2.gz	QLLABAAMZLNOFP-KRWDZBQOSA-N	0	3	348.462	3.135	20	30		EGEDHN
C=C(Br)CNC1CCN(C(=O)C2(CC(C)C)CC2)CC1	ZINC001200985716	1369462142	/nfs/dbraw/zinc/46/21/42/1369462142.db2.gz	LMVMANXHYWKBBV-UHFFFAOYSA-N	0	3	343.309	3.302	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)Cc2c(C)nn(C(C)C)c2C)CC1	ZINC001113519847	1369475145	/nfs/dbraw/zinc/47/51/45/1369475145.db2.gz	ACRHXNYOWYDJGS-INIZCTEOSA-N	0	3	346.519	3.122	20	30		EGEDHN
C#CCNC[C@H]1CN(C(=O)[C@H](CCC)CC2CCCCC2)CCCO1	ZINC001201548749	1369573187	/nfs/dbraw/zinc/57/31/87/1369573187.db2.gz	ZDLKKJJVPQKNMB-UXHICEINSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)N1CCC(NCc2ccn(C(C)C)n2)CC1	ZINC001202085567	1369685018	/nfs/dbraw/zinc/68/50/18/1369685018.db2.gz	VYUHIHGQWKVJBK-HOTGVXAUSA-N	0	3	332.492	3.003	20	30		EGEDHN
N#Cc1ccccc1CNC1CCN(C(=O)CCCC2CC2)CC1	ZINC001202085554	1369685206	/nfs/dbraw/zinc/68/52/06/1369685206.db2.gz	VSQAIXASOUFOGN-UHFFFAOYSA-N	0	3	325.456	3.219	20	30		EGEDHN
CC/C=C(\C)C(=O)N[C@@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202582111	1369812859	/nfs/dbraw/zinc/81/28/59/1369812859.db2.gz	LMOFMMNCTCAJSM-UVQNPWMRSA-N	0	3	336.479	3.411	20	30		EGEDHN
C=CCCOCCCCC(=O)N[C@@H]1[C@H]2CN(Cc3ccsc3)C[C@H]21	ZINC001114273300	1369843268	/nfs/dbraw/zinc/84/32/68/1369843268.db2.gz	KIBVIIRGVYUHKM-DZFIZOCASA-N	0	3	348.512	3.058	20	30		EGEDHN
O=C(C=C1CCC1)N[C@@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202711627	1369860485	/nfs/dbraw/zinc/86/04/85/1369860485.db2.gz	BIOMPFKJNHMCQI-VQTJNVASSA-N	0	3	334.463	3.165	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1[C@H]2CN(Cc3ccc(F)cc3C)C[C@H]21	ZINC001114340173	1369900682	/nfs/dbraw/zinc/90/06/82/1369900682.db2.gz	BOCRVOPRVUYIOE-DZFIZOCASA-N	0	3	330.447	3.283	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1[C@H]2CN(Cc3ccc(OC)c(C)c3)C[C@H]21	ZINC001114341416	1369900893	/nfs/dbraw/zinc/90/08/93/1369900893.db2.gz	XNBZLSJXPQYIGN-YRWFTTLQSA-N	0	3	342.483	3.152	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1[C@H]2CN([C@H](C)c3cccc(OC)c3)C[C@H]21	ZINC001114341271	1369901175	/nfs/dbraw/zinc/90/11/75/1369901175.db2.gz	VTDSWYHMMWRNCH-QKUWSGOFSA-N	0	3	342.483	3.405	20	30		EGEDHN
O=C(C#CC1CC1)N[C@@H]1C[C@@H](NCc2sccc2Cl)C12CCC2	ZINC001202888767	1369917956	/nfs/dbraw/zinc/91/79/56/1369917956.db2.gz	UBOWLDBHRAZODN-HZPDHXFCSA-N	0	3	348.899	3.332	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1C[C@H](NCc2ccccn2)C12CCC2	ZINC001202961407	1369937845	/nfs/dbraw/zinc/93/78/45/1369937845.db2.gz	XIWUAAHGAMDWRN-IRXDYDNUSA-N	0	3	327.472	3.201	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202988349	1369947482	/nfs/dbraw/zinc/94/74/82/1369947482.db2.gz	SABRDDMJLUKARK-WOJBJXKFSA-N	0	3	336.479	3.411	20	30		EGEDHN
C=C(Br)CNC1CCN(C(=O)[C@@H](C)[C@@H](C)CC)CC1	ZINC001203092034	1369980102	/nfs/dbraw/zinc/98/01/02/1369980102.db2.gz	IMQCGQPDTBXEIC-AAEUAGOBSA-N	0	3	331.298	3.158	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1C[C@@H](NCc2c(C)noc2C)C12CCC2	ZINC001203256294	1370043794	/nfs/dbraw/zinc/04/37/94/1370043794.db2.gz	HIICSALXSBGROO-IAGOWNOFSA-N	0	3	345.487	3.411	20	30		EGEDHN
O=C(N[C@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2)[C@H]1C[C@H]2C[C@H]2C1	ZINC001203290948	1370064577	/nfs/dbraw/zinc/06/45/77/1370064577.db2.gz	ZIZOJESDIPITQZ-IFLJBQAJSA-N	0	3	348.490	3.101	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1[C@H]2CN(CCOC3CCCCCC3)C[C@H]21	ZINC001114759244	1370065626	/nfs/dbraw/zinc/06/56/26/1370065626.db2.gz	FMHYYEGHZXQBAD-RUYXUALKSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1C[C@H](NCc2c(C)noc2C)C12CCC2	ZINC001203338955	1370089059	/nfs/dbraw/zinc/08/90/59/1370089059.db2.gz	DQXABRJOVBJDAB-IRXDYDNUSA-N	0	3	331.460	3.165	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001203341891	1370090717	/nfs/dbraw/zinc/09/07/17/1370090717.db2.gz	UNJLCFXFKJBTEX-UXHICEINSA-N	0	3	336.479	3.411	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H]2C[C@@H](NCc3cncs3)C23CCC3)CC1	ZINC001203375610	1370104973	/nfs/dbraw/zinc/10/49/73/1370104973.db2.gz	RKACOEMMLJBPIU-CVEARBPZSA-N	0	3	345.512	3.407	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)CC(F)(F)C(F)F)C12CCC2	ZINC001203418481	1370117855	/nfs/dbraw/zinc/11/78/55/1370117855.db2.gz	HQEULMTXWFIWNA-UWVGGRQHSA-N	0	3	342.764	3.046	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)C2(C(C)(F)F)CC2)C12CCC2	ZINC001203419134	1370118012	/nfs/dbraw/zinc/11/80/12/1370118012.db2.gz	KMHZDYSIGCBOKL-RYUDHWBXSA-N	0	3	332.822	3.191	20	30		EGEDHN
C=CCO[C@H]1CO[C@]2(C1)CCCN(Cc1ccccc1OCC)C2	ZINC001203542254	1370162150	/nfs/dbraw/zinc/16/21/50/1370162150.db2.gz	JUWDQASZRBAIJL-QUCCMNQESA-N	0	3	331.456	3.411	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CC2)C(=O)Nc2c3cccc2F)cc1	ZINC001203903224	1370307998	/nfs/dbraw/zinc/30/79/98/1370307998.db2.gz	AVOMHFAUUCZHIU-UHFFFAOYSA-N	0	3	335.382	3.183	20	30		EGEDHN
C[C@H](CC(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21)C(C)(C)C	ZINC001115172887	1370325959	/nfs/dbraw/zinc/32/59/59/1370325959.db2.gz	YGGJOBQFELCDHF-QKUWSGOFSA-N	0	3	339.483	3.177	20	30		EGEDHN
C[C@H]1C[C@H]1C(=O)NCC1(NCc2ccc(C#N)cc2F)CCCCC1	ZINC001115389183	1370426247	/nfs/dbraw/zinc/42/62/47/1370426247.db2.gz	KGGIVIAYRCTVQC-WMLDXEAASA-N	0	3	343.446	3.262	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1ccccc1C#N)[C@H]2CC	ZINC001204367355	1370455738	/nfs/dbraw/zinc/45/57/38/1370455738.db2.gz	IDOBKMNQRBZGHM-FPOVZHCZSA-N	0	3	337.467	3.480	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC([C@H]2CCN(Cc3ccccc3C#N)C2)C1	ZINC001204368793	1370456182	/nfs/dbraw/zinc/45/61/82/1370456182.db2.gz	YNUDGLANYPZCTL-KRWDZBQOSA-N	0	3	341.455	3.247	20	30		EGEDHN
C[C@@H](C(=O)NCC1(NCC#Cc2ccccc2)CCCCC1)C1CC1	ZINC001115466605	1370472202	/nfs/dbraw/zinc/47/22/02/1370472202.db2.gz	TVRMPGIJCOJJMR-GOSISDBHSA-N	0	3	338.495	3.493	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CC[C@H]2CN(Cc3ccc(C)cc3)C[C@H]21	ZINC001187218033	1388074210	/nfs/dbraw/zinc/07/42/10/1388074210.db2.gz	XSCYQTDSIMJFSF-YZGWKJHDSA-N	0	3	342.483	3.009	20	30		EGEDHN
Cc1nn(-c2ccccc2)c(C)c1CN1CCC2SC(=O)C=C2C1	ZINC001204446957	1370479179	/nfs/dbraw/zinc/47/91/79/1370479179.db2.gz	YJAYMEXJNFVUES-GOSISDBHSA-N	0	3	339.464	3.263	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2coc(CC)n2)CCCCC1	ZINC001115495788	1370498743	/nfs/dbraw/zinc/49/87/43/1370498743.db2.gz	HEAWUCAKDCICDC-UHFFFAOYSA-N	0	3	325.840	3.012	20	30		EGEDHN
CCc1nocc1CNC1(CNC(=O)C#CC(C)(C)C)CCCCC1	ZINC001115528736	1370527763	/nfs/dbraw/zinc/52/77/63/1370527763.db2.gz	ZOSSZUXEZAVHDT-UHFFFAOYSA-N	0	3	345.487	3.195	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H]2CN(CCc3ccc(F)c(F)c3)C[C@H]21	ZINC001187233399	1388078749	/nfs/dbraw/zinc/07/87/49/1388078749.db2.gz	RHYQNWAWGOHPQX-MAUKXSAKSA-N	0	3	334.410	3.006	20	30		EGEDHN
C#CCC1(C(=O)NCC2(NCc3conc3C)CCCCC2)CCC1	ZINC001115567568	1370568040	/nfs/dbraw/zinc/56/80/40/1370568040.db2.gz	LWRITNPPNALVQU-UHFFFAOYSA-N	0	3	343.471	3.085	20	30		EGEDHN
CC(=O)c1ccc(Nc2ccc(CN3CCN(C)CC3)cc2)c(C#N)c1	ZINC001204758590	1370568735	/nfs/dbraw/zinc/56/87/35/1370568735.db2.gz	GEUGDGKSMGLMDI-UHFFFAOYSA-N	0	3	348.450	3.252	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)COCC2CCCC2)CCCCC1	ZINC001115575984	1370578838	/nfs/dbraw/zinc/57/88/38/1370578838.db2.gz	PPAZFSJYQIKHTK-UHFFFAOYSA-N	0	3	342.911	3.354	20	30		EGEDHN
Cc1nc(CNCC2CCN(C(=O)C#CC(C)(C)C)CC2)c(C)s1	ZINC001205236410	1370690517	/nfs/dbraw/zinc/69/05/17/1370690517.db2.gz	SIWUYULFOCUNJP-UHFFFAOYSA-N	0	3	347.528	3.138	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CC[C@H]2CCCOC2)CCCCC1	ZINC001115796704	1370779285	/nfs/dbraw/zinc/77/92/85/1370779285.db2.gz	NOGFFMNLVAYCBN-MRXNPFEDSA-N	0	3	342.911	3.354	20	30		EGEDHN
C[C@H](CC(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1)C(C)(C)C	ZINC001187413078	1388103722	/nfs/dbraw/zinc/10/37/22/1388103722.db2.gz	JUDIXTCYEUHSSJ-RHSMWYFYSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC(CNC/C(Cl)=C\Cl)CC2)C1	ZINC001206213583	1370995231	/nfs/dbraw/zinc/99/52/31/1370995231.db2.gz	XUHVWUODFYPXDI-NTEUORMPSA-N	0	3	331.287	3.490	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC(CNCc2oc(C)nc2C)CC1	ZINC001206428331	1371052280	/nfs/dbraw/zinc/05/22/80/1371052280.db2.gz	YFQLRBNLRDKNQR-UHFFFAOYSA-N	0	3	333.476	3.222	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CN(CCOc2cccc(Cl)c2)C[C@H]1C	ZINC001206537020	1371086203	/nfs/dbraw/zinc/08/62/03/1371086203.db2.gz	HZNSNAGTNDANRG-RHSMWYFYSA-N	0	3	336.863	3.122	20	30		EGEDHN
C=CCOC(=O)N1CCCC2(CCN(Cc3cc(C)ccn3)CC2)C1	ZINC001206847177	1371188839	/nfs/dbraw/zinc/18/88/39/1371188839.db2.gz	IMIWILZREIDWBC-UHFFFAOYSA-N	0	3	343.471	3.391	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CCN(Cc3scnc3C)C2)C1	ZINC001206863912	1371194292	/nfs/dbraw/zinc/19/42/92/1371194292.db2.gz	YBYZZICKIZDVSZ-KRWDZBQOSA-N	0	3	335.473	3.062	20	30		EGEDHN
Cc1cc(C)cc(CN2C[C@@H](C)[C@H](NC(=O)C#CC(C)(C)C)C2)c1	ZINC001206949674	1371240886	/nfs/dbraw/zinc/24/08/86/1371240886.db2.gz	LXHOICCFRIYKNT-IEBWSBKVSA-N	0	3	326.484	3.289	20	30		EGEDHN
Cn1cc(CN2CCc3ncnc(-c4ccsc4)c3CC2)cc1C#N	ZINC001207104217	1371294966	/nfs/dbraw/zinc/29/49/66/1371294966.db2.gz	OHMBAYWEKKWUKC-UHFFFAOYSA-N	0	3	349.463	3.016	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1CN(CCc2scnc2C)C[C@H]1C	ZINC001207107599	1371295945	/nfs/dbraw/zinc/29/59/45/1371295945.db2.gz	NEIJNQBNOHQTAL-RHSMWYFYSA-N	0	3	347.528	3.199	20	30		EGEDHN
N#Cc1ccc(OC2CCN(Cc3cc[nH]c(=O)c3)CC2)cc1Cl	ZINC001207123396	1371301117	/nfs/dbraw/zinc/30/11/17/1371301117.db2.gz	LFKCLZVMRFVQHC-UHFFFAOYSA-N	0	3	343.814	3.356	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN(Cc2cccc(COC)c2)C[C@H]1C	ZINC001207189964	1371324411	/nfs/dbraw/zinc/32/44/11/1371324411.db2.gz	AQTDIQCULJGOBX-VQIMIIECSA-N	0	3	330.472	3.126	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1ccc(COC2CCCC2)cc1	ZINC001119750343	1371399202	/nfs/dbraw/zinc/39/92/02/1371399202.db2.gz	HZEKOLZNSORLMH-UHFFFAOYSA-N	0	3	343.471	3.222	20	30		EGEDHN
C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)[C@H]1CCCN(C)C1	ZINC001119776010	1371404013	/nfs/dbraw/zinc/40/40/13/1371404013.db2.gz	FNAWMQNNDKULAY-GJZGRUSLSA-N	0	3	346.500	3.496	20	30		EGEDHN
C/C(=C/C(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1)C1CC1	ZINC001207548876	1371432095	/nfs/dbraw/zinc/43/20/95/1371432095.db2.gz	BTEZABNCQGTEJV-HZMYXVCSSA-N	0	3	340.442	3.114	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)[C@H]2CC[C@H](C3CCC3)CC2)C1	ZINC001207596417	1371447060	/nfs/dbraw/zinc/44/70/60/1371447060.db2.gz	HNCFZGNBCYOXHW-VBSBHUPXSA-N	0	3	348.531	3.232	20	30		EGEDHN
C=CCOCC(=O)N1CCC[C@@H](N[C@H](C)c2ccccc2Cl)C1	ZINC001207679701	1371473198	/nfs/dbraw/zinc/47/31/98/1371473198.db2.gz	CKSMGGVLNBVFFB-HUUCEWRRSA-N	0	3	336.863	3.184	20	30		EGEDHN
O=C(/C=C/C1CC1)N1CCC[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001207742620	1371490601	/nfs/dbraw/zinc/49/06/01/1371490601.db2.gz	VZIOJUQKVXMJQP-DXRVJIQQSA-N	0	3	342.870	3.238	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CC[C@@H]2CC[C@@H](C)O2)CCCCC1	ZINC001120176317	1371500338	/nfs/dbraw/zinc/50/03/38/1371500338.db2.gz	KHYHUDQTHSRFOC-CVEARBPZSA-N	0	3	342.911	3.495	20	30		EGEDHN
C=CCCOCC(=O)NCC1(NCc2ccccc2F)CCCCC1	ZINC001120233893	1371510293	/nfs/dbraw/zinc/51/02/93/1371510293.db2.gz	PTQDGRRUSPWUGK-UHFFFAOYSA-N	0	3	348.462	3.327	20	30		EGEDHN
C#CCCCCC(=O)N1CCC[C@@H](NCc2cc(F)cc(F)c2)C1	ZINC001207860357	1371522202	/nfs/dbraw/zinc/52/22/02/1371522202.db2.gz	KNWPNPIGPQNIBV-GOSISDBHSA-N	0	3	334.410	3.239	20	30		EGEDHN
C=CCCCCCCCCCN1CCC[C@H]1C(=O)NCC(=O)OC	ZINC001207900084	1371532123	/nfs/dbraw/zinc/53/21/23/1371532123.db2.gz	SRFJYTDGEMWIMN-KRWDZBQOSA-N	0	3	338.492	3.047	20	30		EGEDHN
CC[C@H](C)CC(=O)N1CCC[C@H](NCc2cc(C#N)ccc2OC)C1	ZINC001207915533	1371538227	/nfs/dbraw/zinc/53/82/27/1371538227.db2.gz	XUZUKAMWPKYXBN-YJBOKZPZSA-N	0	3	343.471	3.084	20	30		EGEDHN
CC/C(C)=C\C(=O)N1CCC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001208001820	1371563893	/nfs/dbraw/zinc/56/38/93/1371563893.db2.gz	JOZRLABEVFFPGQ-DZXKJOIRSA-N	0	3	329.419	3.134	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CCC[C@@H](NCc2cc(F)cc(F)c2)C1	ZINC001208011073	1371567429	/nfs/dbraw/zinc/56/74/29/1371567429.db2.gz	UUMKUOSPCKLCDP-QGZVFWFLSA-N	0	3	334.410	3.095	20	30		EGEDHN
C=C(C)[C@@H]1CC=C(CN2CC[C@H](Oc3nccc(OC)n3)C2)CC1	ZINC001208178462	1371618967	/nfs/dbraw/zinc/61/89/67/1371618967.db2.gz	FOSSLZRNBFOQKI-SJORKVTESA-N	0	3	329.444	3.241	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H]2CN(Cc3cc(C)sc3C)C[C@H]21	ZINC001187714938	1388148777	/nfs/dbraw/zinc/14/87/77/1388148777.db2.gz	WCIUPSFTGKSDEL-FUHWJXTLSA-N	0	3	330.497	3.201	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC[C@@H](NCc2cccc(NC(C)=O)c2)C1	ZINC001208252926	1371682786	/nfs/dbraw/zinc/68/27/86/1371682786.db2.gz	PZUOJTIKLDGIEB-LJQANCHMSA-N	0	3	343.471	3.082	20	30		EGEDHN
C=C(C)CCC(=O)NC1CC2(CC(NCc3nc(C)cs3)C2)C1	ZINC001121179938	1371880265	/nfs/dbraw/zinc/88/02/65/1371880265.db2.gz	HNZTXUOPKJJZPJ-UHFFFAOYSA-N	0	3	333.501	3.325	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCCN(CCCc2ccc(C#N)cc2)CC1	ZINC001208855488	1371920242	/nfs/dbraw/zinc/92/02/42/1371920242.db2.gz	DHZAFZULHLNBNM-UHFFFAOYSA-N	0	3	343.471	3.434	20	30		EGEDHN
C[C@@H]1CN(CCc2ccc(C#N)cc2)CCN(C(=O)OC(C)(C)C)C1	ZINC001208920449	1371945019	/nfs/dbraw/zinc/94/50/19/1371945019.db2.gz	IRUZYWDGCSEGNM-MRXNPFEDSA-N	0	3	343.471	3.290	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(F)cc2)CCN1CCc1ccc(C#N)cc1	ZINC001208920750	1371945171	/nfs/dbraw/zinc/94/51/71/1371945171.db2.gz	OLJYLYNXFZUUTH-QGZVFWFLSA-N	0	3	337.442	3.446	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)[C@H](c2ccccc2)C(C)C)C1	ZINC001208944855	1371957481	/nfs/dbraw/zinc/95/74/81/1371957481.db2.gz	OZEBLZXMURWGHM-RLLQIKCJSA-N	0	3	344.499	3.065	20	30		EGEDHN
C=C(Br)CNC1CC2(C1)CC(NC(=O)CC1(C)CC1)C2	ZINC001121430541	1371972011	/nfs/dbraw/zinc/97/20/11/1371972011.db2.gz	DSLKYPIMANZJGY-UHFFFAOYSA-N	0	3	341.293	3.102	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC[C@H](NCc2ccccc2F)C1	ZINC001209005529	1371972541	/nfs/dbraw/zinc/97/25/41/1371972541.db2.gz	WVBFIEMMGOGSET-SFHVURJKSA-N	0	3	330.447	3.490	20	30		EGEDHN
C=CCN(CCN1CCC(OC)(c2ccccc2)CC1)C(=O)OCC	ZINC001209020051	1371976036	/nfs/dbraw/zinc/97/60/36/1371976036.db2.gz	BDBDFDVHJLNKID-UHFFFAOYSA-N	0	3	346.471	3.269	20	30		EGEDHN
C=CCN(CCN1CC[C@H](c2cccc(OC)c2)C1)C(=O)OCC	ZINC001209025071	1371977281	/nfs/dbraw/zinc/97/72/81/1371977281.db2.gz	ZSPZKIPHPFOXFK-KRWDZBQOSA-N	0	3	332.444	3.129	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001209049997	1371983390	/nfs/dbraw/zinc/98/33/90/1371983390.db2.gz	BHTRHWYRXXCRMC-CFIBSBMNSA-N	0	3	340.442	3.280	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N1CCC[C@H](NCc2ccc(C#N)s2)C1	ZINC001209102260	1371998539	/nfs/dbraw/zinc/99/85/39/1371998539.db2.gz	VOZVUSITVMWGET-XXUROBRHSA-N	0	3	329.469	3.223	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NC1CC2(CC(NCc3ncc(C)s3)C2)C1	ZINC001121609374	1372023493	/nfs/dbraw/zinc/02/34/93/1372023493.db2.gz	CNFRMGWBWPJSEE-UHOAPKMXSA-N	0	3	347.528	3.427	20	30		EGEDHN
CCc1ccc(CN2C[C@@H]3CCN(C(=O)C#CC(C)(C)C)[C@@H]3C2)cc1	ZINC001187858122	1388178780	/nfs/dbraw/zinc/17/87/80/1388178780.db2.gz	XQWZEJYUPUISCP-VQTJNVASSA-N	0	3	338.495	3.331	20	30		EGEDHN
C=CCCCCCN1CCO[C@@]2(CCCN(c3cccnc3)C2)C1	ZINC001209423337	1372103267	/nfs/dbraw/zinc/10/32/67/1372103267.db2.gz	SPDITSMNCQDYGK-FQEVSTJZSA-N	0	3	329.488	3.499	20	30		EGEDHN
C=CCCCCCCN1CCO[C@@H]2[C@H](COc3ncccn3)CC[C@@H]21	ZINC001209436898	1372106436	/nfs/dbraw/zinc/10/64/36/1372106436.db2.gz	ZFHANEIBNWDBQR-GBESFXJTSA-N	0	3	345.487	3.471	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N[C@@H](Cc1ccc(C)cc1)c1ccccn1	ZINC001121923696	1372123744	/nfs/dbraw/zinc/12/37/44/1372123744.db2.gz	RDEPPBIHPWMOMU-ICSRJNTNSA-N	0	3	337.467	3.474	20	30		EGEDHN
COc1cc(CN2CCC3SC(=O)C=C3C2)c(F)cc1Cl	ZINC001209666337	1372165579	/nfs/dbraw/zinc/16/55/79/1372165579.db2.gz	TUCIVCPKRXUYMN-CQSZACIVSA-N	0	3	327.808	3.262	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N1CCC(OCc2ccc(F)cc2)CC1	ZINC001122041570	1372159833	/nfs/dbraw/zinc/15/98/33/1372159833.db2.gz	RCDXOJNHPBVLMR-SFHVURJKSA-N	0	3	334.435	3.017	20	30		EGEDHN
O=C([C@@H]1C[C@H]1c1ccco1)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001209737523	1372180424	/nfs/dbraw/zinc/18/04/24/1372180424.db2.gz	UPPXQVIZWKMXRS-XUVXKRRUSA-N	0	3	348.446	3.015	20	30		EGEDHN
CN1C(=O)CCC[C@@H]1C(=O)C(C#N)c1nc2cc(Cl)ccc2s1	ZINC001122474089	1372254807	/nfs/dbraw/zinc/25/48/07/1372254807.db2.gz	HMKVRNQCOWSWIB-ZYHUDNBSSA-N	0	3	347.827	3.137	20	30		EGEDHN
C=CCCCN1C[C@@H](C)[C@H](NC(=O)c2cnc(-c3ccco3)s2)C1	ZINC001210468608	1372361020	/nfs/dbraw/zinc/36/10/20/1372361020.db2.gz	IUUUIUPVQOBMNK-ZIAGYGMSSA-N	0	3	345.468	3.419	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCc1ccc(OC)c(Cl)c1	ZINC001123232925	1372403180	/nfs/dbraw/zinc/40/31/80/1372403180.db2.gz	DWRANCHDTMAZHE-CYBMUJFWSA-N	0	3	331.803	3.374	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCCC(=O)c1ccc(OC)cc1	ZINC001123236915	1372403579	/nfs/dbraw/zinc/40/35/79/1372403579.db2.gz	IWGDGFBCDBAVJZ-INIZCTEOSA-N	0	3	339.395	3.141	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@H](CC)c2ccc(OC)cc2)C1	ZINC001211241945	1372509893	/nfs/dbraw/zinc/50/98/93/1372509893.db2.gz	SIAZIICMNIBIHK-ATZDWAIDSA-N	0	3	330.472	3.201	20	30		EGEDHN
C[C@H](CC(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1)C1CC1	ZINC001211276322	1372519268	/nfs/dbraw/zinc/51/92/68/1372519268.db2.gz	FKCZMPGJIUFPFM-UZLBHIALSA-N	0	3	342.458	3.194	20	30		EGEDHN
C=C(CN1CCCCC1)c1nc(-c2cccnc2OC(F)F)no1	ZINC001211436128	1372558931	/nfs/dbraw/zinc/55/89/31/1372558931.db2.gz	BSNHDFBYOVBQGO-UHFFFAOYSA-N	0	3	336.342	3.232	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CCOC3CCC3)C[C@H]2C)CCCC1	ZINC001211492565	1372568052	/nfs/dbraw/zinc/56/80/52/1372568052.db2.gz	FGSRWZRDNICFEY-SJLPKXTDSA-N	0	3	334.504	3.129	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2ccccc2F)C[C@H]1c1ccccc1	ZINC001211518805	1372571644	/nfs/dbraw/zinc/57/16/44/1372571644.db2.gz	ADTIGBSFBHVUIW-AZUAARDMSA-N	0	3	336.410	3.047	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2ccc(F)cc2)C[C@H]1c1ccccc1	ZINC001211517281	1372571993	/nfs/dbraw/zinc/57/19/93/1372571993.db2.gz	SUGWXVUXTLXARO-VQTJNVASSA-N	0	3	336.410	3.047	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C=C2CCCCC2)C[C@H]1c1ccccc1	ZINC001211545911	1372577420	/nfs/dbraw/zinc/57/74/20/1372577420.db2.gz	MWMIWVFOTVNIPO-LEWJYISDSA-N	0	3	336.479	3.484	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C[C@@H](C)CCC)C[C@H]1c1ccccc1	ZINC001211555735	1372580044	/nfs/dbraw/zinc/58/00/44/1372580044.db2.gz	ZIJVTQKIYQSANI-YSIASYRMSA-N	0	3	326.484	3.420	20	30		EGEDHN
CC[C@H](F)CN[C@@H]1CN(C(=O)C#CC(C)(C)C)C[C@H]1c1ccccc1	ZINC001211596218	1372587689	/nfs/dbraw/zinc/58/76/89/1372587689.db2.gz	BDHFTENNGYAQMI-GBESFXJTSA-N	0	3	344.474	3.368	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)Cc2ccc(C)cc2)C[C@H]1c1ccccc1	ZINC001211631897	1372592994	/nfs/dbraw/zinc/59/29/94/1372592994.db2.gz	VBFHYBWOVDXGDY-FCHUYYIVSA-N	0	3	346.474	3.145	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2ccoc2C2CC2)C[C@H]1c1ccccc1	ZINC001211659595	1372598212	/nfs/dbraw/zinc/59/82/12/1372598212.db2.gz	NXATUUMBXVTNSO-VQTJNVASSA-N	0	3	348.446	3.378	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H](CCC)C(C)C)C[C@H]1c1ccccc1	ZINC001211684346	1372602556	/nfs/dbraw/zinc/60/25/56/1372602556.db2.gz	SVDBLZLXNRLGNA-HSALFYBXSA-N	0	3	326.484	3.276	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@H](C)c2ccccc2)C[C@H]1c1ccccc1	ZINC001211711916	1372606539	/nfs/dbraw/zinc/60/65/39/1372606539.db2.gz	ZDXSOVPFKJXHCV-BVYCBKJFSA-N	0	3	346.474	3.398	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2ccc(F)s2)C[C@H]1c1ccccc1	ZINC001211734037	1372609576	/nfs/dbraw/zinc/60/95/76/1372609576.db2.gz	JPEJDBCSYYNOPI-JKSUJKDBSA-N	0	3	342.439	3.108	20	30		EGEDHN
CCCCCCCC[C@H](C)C(=O)N1CC[C@@H](NCc2cnn(C)c2)C1	ZINC001188015536	1388213825	/nfs/dbraw/zinc/21/38/25/1388213825.db2.gz	GVCVNJRZFYKRJM-PKOBYXMFSA-N	0	3	348.535	3.497	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2ccoc2Cl)[C@H](OC)C1	ZINC001212175461	1372667130	/nfs/dbraw/zinc/66/71/30/1372667130.db2.gz	QEAHMQFIORFPQL-HUUCEWRRSA-N	0	3	340.851	3.108	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H](NC(=O)c2sc(C)cc2C)[C@H](OC)C1	ZINC001212332997	1372688827	/nfs/dbraw/zinc/68/88/27/1372688827.db2.gz	SGUVTUDZPGZXIG-FVQBIDKESA-N	0	3	336.501	3.149	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NCCNCc1ccc(Cl)c(Cl)c1	ZINC001124488764	1372706158	/nfs/dbraw/zinc/70/61/58/1372706158.db2.gz	UFGBFQTXOZRUPA-LBPRGKRZSA-N	0	3	345.270	3.180	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@H]2CCCC23CC3)[C@H](OC)C1	ZINC001212454645	1372709159	/nfs/dbraw/zinc/70/91/59/1372709159.db2.gz	AJOPMUDAEBPVHA-KZNAEPCWSA-N	0	3	336.520	3.353	20	30		EGEDHN
C=CCOCCCC(=O)NCCN[C@@H](C)c1ccc(F)c(Cl)c1	ZINC001125260361	1372764852	/nfs/dbraw/zinc/76/48/52/1372764852.db2.gz	MNRVGFNTVHMVHF-ZDUSSCGKSA-N	0	3	342.842	3.229	20	30		EGEDHN
C[C@H]1[C@@H](NC(=O)c2csc(C#N)c2)CCN1Cc1ccccc1	ZINC001326517292	1388226675	/nfs/dbraw/zinc/22/66/75/1388226675.db2.gz	USJWQEVAGRZDLS-GUYCJALGSA-N	0	3	325.437	3.013	20	30		EGEDHN
CCCN1CCc2c(N)sc(Nc3ccc(N)c(C#N)c3)c2C1	ZINC001213433861	1372906338	/nfs/dbraw/zinc/90/63/38/1372906338.db2.gz	OTALLMJGDKNQSU-UHFFFAOYSA-N	0	3	327.457	3.296	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CN([C@@H]2CCc3ccccc32)C[C@H]1OC	ZINC001213497797	1372914875	/nfs/dbraw/zinc/91/48/75/1372914875.db2.gz	HEXURRNPESPZKZ-GUDVDZBRSA-N	0	3	342.483	3.092	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2c[nH]cc2C2CC2)[C@H](OC)C1	ZINC001213646211	1372940173	/nfs/dbraw/zinc/94/01/73/1372940173.db2.gz	KIPQLRPTTRZNIR-RTBURBONSA-N	0	3	347.503	3.292	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H](NC(=O)c2ccc(C3CC3)s2)[C@H](OC)C1	ZINC001213717492	1372950053	/nfs/dbraw/zinc/95/00/53/1372950053.db2.gz	SLIBFYDDLNQRLZ-FVQBIDKESA-N	0	3	348.512	3.409	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@@H](C)c2ccccc2)[C@H](OC)C1	ZINC001213730105	1372953077	/nfs/dbraw/zinc/95/30/77/1372953077.db2.gz	DVSVGHIWQLPYII-DFQSSKMNSA-N	0	3	344.499	3.352	20	30		EGEDHN
CCC(CC)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001214164029	1373018404	/nfs/dbraw/zinc/01/84/04/1373018404.db2.gz	IDVYIMAYRZTPAT-DNVCBOLYSA-N	0	3	330.447	3.050	20	30		EGEDHN
CCC[C@H](C)CC(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001214297097	1373039104	/nfs/dbraw/zinc/03/91/04/1373039104.db2.gz	PIILMAVQCSOCLR-QMTMVMCOSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@H](N[C@@H]2CCc3c2c(F)ccc3F)C1	ZINC001214304525	1373040563	/nfs/dbraw/zinc/04/05/63/1373040563.db2.gz	XQRIRVRJDAZDNK-CSMYWGQOSA-N	0	3	334.410	3.355	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2C(C)(C)C2(C)C)C[C@H]1NCC#Cc1ccccc1	ZINC001214397500	1373054234	/nfs/dbraw/zinc/05/42/34/1373054234.db2.gz	WMHFGCYACWJULW-SJLPKXTDSA-N	0	3	338.495	3.157	20	30		EGEDHN
C[C@H](C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2Cl)C1)C1CC1	ZINC001214401108	1373055560	/nfs/dbraw/zinc/05/55/60/1373055560.db2.gz	RQBJTPRGIVMGPQ-ZRGWGRIASA-N	0	3	344.886	3.174	20	30		EGEDHN
CC1CC(C(=O)N2C[C@@H](C)[C@H](NCC#Cc3ccc(Cl)cc3)C2)C1	ZINC001214424739	1373058754	/nfs/dbraw/zinc/05/87/54/1373058754.db2.gz	FBHQSHDDTKESTM-ZSVMCUKPSA-N	0	3	344.886	3.174	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@H]2CC2(C)C)C[C@H]1NCC#Cc1ccccc1Cl	ZINC001214445421	1373062611	/nfs/dbraw/zinc/06/26/11/1373062611.db2.gz	BUXBZLJJVDONDE-QGPMSJSTSA-N	0	3	344.886	3.174	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@@H](C)[C@H](N[C@@H](C)c2ccccc2Cl)C1	ZINC001214580463	1373084183	/nfs/dbraw/zinc/08/41/83/1373084183.db2.gz	YTHNFMAMWHVCEJ-RVKKMQEKSA-N	0	3	332.875	3.497	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@@H](C)[C@H](NCc2ccccc2OC(C)C)C1	ZINC001214582322	1373084878	/nfs/dbraw/zinc/08/48/78/1373084878.db2.gz	ORSNYJXLGMNTMV-IEBWSBKVSA-N	0	3	342.483	3.070	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)[C@H](NCc2cc(C)ccc2OC)C1	ZINC001214745160	1373114132	/nfs/dbraw/zinc/11/41/32/1373114132.db2.gz	GDHOWMXCCKEROR-SJLPKXTDSA-N	0	3	330.472	3.296	20	30		EGEDHN
C=C(C)CNCc1ccncc1O[C@H]1CCN(C(=O)/C=C(/C)CC)C1	ZINC001127883860	1373195135	/nfs/dbraw/zinc/19/51/35/1373195135.db2.gz	VEVZWADICSUJDC-FJJYYWMZSA-N	0	3	343.471	3.083	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2(C)CCC2)C[C@H]1NCC#Cc1ccc(Cl)cc1	ZINC001215325054	1373197777	/nfs/dbraw/zinc/19/77/77/1373197777.db2.gz	YSSNLUHGOUCTPO-CRAIPNDOSA-N	0	3	344.886	3.318	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCCC2CC2)C[C@H]1NCC#Cc1ccc(F)cc1	ZINC001215367254	1373203761	/nfs/dbraw/zinc/20/37/61/1373203761.db2.gz	IRRIKZGGTIZULY-OXQOHEQNSA-N	0	3	342.458	3.194	20	30		EGEDHN
CCCc1ccc(C(=O)NCCNCc2ccc(C#N)c(F)c2)s1	ZINC001128327450	1373251923	/nfs/dbraw/zinc/25/19/23/1373251923.db2.gz	IXTQFWNTEXSEIO-UHFFFAOYSA-N	0	3	345.443	3.231	20	30		EGEDHN
CCC[C@@H](CC)C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001216104897	1373263936	/nfs/dbraw/zinc/26/39/36/1373263936.db2.gz	NUCATIJRDWEXSP-IDHHARJASA-N	0	3	345.462	3.460	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)CCCc3ccccc3Cl)[C@@H]2C1	ZINC001188174500	1388257768	/nfs/dbraw/zinc/25/77/68/1388257768.db2.gz	WEZDOKIHSTWCFY-FUHWJXTLSA-N	0	3	332.875	3.381	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)c3ccccc3F)[C@H]2C1	ZINC001217196703	1373403597	/nfs/dbraw/zinc/40/35/97/1373403597.db2.gz	WFQADOZCGMTMCD-RBUKOAKNSA-N	0	3	346.446	3.097	20	30		EGEDHN
C=CCCC(=O)N1CCO[C@@H]2CN(CCC3CCCCCC3)C[C@@H]21	ZINC001217504122	1373456009	/nfs/dbraw/zinc/45/60/09/1373456009.db2.gz	SXJBNGFDANFGLB-RBUKOAKNSA-N	0	3	334.504	3.225	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)[C@@H]2CC[C@@H](c3ccccc3)C2)cc1	ZINC001130180734	1373471548	/nfs/dbraw/zinc/47/15/48/1373471548.db2.gz	WCSOBKNNPFHTMQ-NHCUHLMSSA-N	0	3	347.462	3.348	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NCCNCc1cc(F)ccc1C	ZINC001130374132	1373508934	/nfs/dbraw/zinc/50/89/34/1373508934.db2.gz	IRDRAHKFCBMUJT-UHFFFAOYSA-N	0	3	342.414	3.219	20	30		EGEDHN
O=C(/C=C\c1ccccc1)c1ccc(O[C@H]2CC[C@@H]3NCCO[C@H]32)cc1	ZINC001218149334	1373570094	/nfs/dbraw/zinc/57/00/94/1373570094.db2.gz	IRVPCPKTKWWDIM-ORQHADLZSA-N	0	3	349.430	3.481	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)C[C@@H]3C[C@H]3C3CC3)[C@H]2C1	ZINC001218324689	1373596439	/nfs/dbraw/zinc/59/64/39/1373596439.db2.gz	CPPRBUAWYPTZKP-LWYYNNOASA-N	0	3	346.515	3.081	20	30		EGEDHN
C#CCCCCCC(=O)N1CCO[C@@H]2CN(CCCCCC=C)C[C@@H]21	ZINC001218454477	1373616726	/nfs/dbraw/zinc/61/67/26/1373616726.db2.gz	GHIVNHKOKIITEJ-VQTJNVASSA-N	0	3	346.515	3.228	20	30		EGEDHN
Cc1nc(O[C@@H]2CNCc3ccccc32)c(C#N)cc1Br	ZINC001218489037	1373624737	/nfs/dbraw/zinc/62/47/37/1373624737.db2.gz	SSYJAPYEPMCJNQ-OAHLLOKOSA-N	0	3	344.212	3.248	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCO[C@@H]2CN(CCCCCCC)C[C@@H]21	ZINC001218517110	1373628134	/nfs/dbraw/zinc/62/81/34/1373628134.db2.gz	JFGAPEKTCDEXHK-GBESFXJTSA-N	0	3	336.520	3.471	20	30		EGEDHN
CC(C)=C[C@H]1[C@H](C(=O)NCCNCc2ccc(C#N)c(F)c2)C1(C)C	ZINC001131089064	1373641838	/nfs/dbraw/zinc/64/18/38/1373641838.db2.gz	WGMACXJDMKBKIU-FUHWJXTLSA-N	0	3	343.446	3.142	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)C[C@H](C)CC(C)(C)C)[C@H]2C1	ZINC001218683645	1373643697	/nfs/dbraw/zinc/64/36/97/1373643697.db2.gz	YPZMMAXKCWNJJY-OKZBNKHCSA-N	0	3	336.520	3.327	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)CC3(C=C)CCCCC3)[C@H]2C1	ZINC001218776661	1373653907	/nfs/dbraw/zinc/65/39/07/1373653907.db2.gz	WIDJOPGRTXGJCA-RBUKOAKNSA-N	0	3	346.515	3.391	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)c3cc(C(C)C)oc3C)[C@H]2C1	ZINC001218881081	1373663368	/nfs/dbraw/zinc/66/33/68/1373663368.db2.gz	QATJAGZLHYVNKQ-PKOBYXMFSA-N	0	3	346.471	3.203	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)C[C@@H](C)C3CC3)[C@H]2C1	ZINC001219053403	1373683252	/nfs/dbraw/zinc/68/32/52/1373683252.db2.gz	BZFKUFCYVGFUQG-NZSAHSFTSA-N	0	3	334.504	3.081	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@H]2CCC=CCCC2)[C@@H](O)C1	ZINC001219863806	1373737005	/nfs/dbraw/zinc/73/70/05/1373737005.db2.gz	AUADUDYLTYSXOH-OTWHNJEPSA-N	0	3	336.520	3.255	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](C)O[C@@]3(CCN(CC=C(C)C)C3)C2)CCC1	ZINC001131681628	1373760369	/nfs/dbraw/zinc/76/03/69/1373760369.db2.gz	FRXXCDCCPDBQSD-WIYYLYMNSA-N	0	3	346.515	3.391	20	30		EGEDHN
C#CCCN1CC[C@]2(C1)CN(C(=O)C(C)(C)CCCCC)C[C@@H](C)O2	ZINC001131701400	1373771624	/nfs/dbraw/zinc/77/16/24/1373771624.db2.gz	TZBZBJLKBPSZCY-NQIIRXRSSA-N	0	3	348.531	3.308	20	30		EGEDHN
C=CCCC(=O)N1C[C@H]2CCN(CCOC3CCCCCC3)C[C@H]21	ZINC001221430644	1373773109	/nfs/dbraw/zinc/77/31/09/1373773109.db2.gz	KWVIJWRRGKNKJG-IEBWSBKVSA-N	0	3	334.504	3.225	20	30		EGEDHN
CC(C)=CC(=O)N[C@H]1CC[C@H](C)N(Cc2ccc(OCC#N)cc2)C1	ZINC001131771645	1373796003	/nfs/dbraw/zinc/79/60/03/1373796003.db2.gz	JWAVALAWFFATID-WMZOPIPTSA-N	0	3	341.455	3.024	20	30		EGEDHN
C#CCCCCC(=O)NCC1CCN(Cc2c(C)onc2CC)CC1	ZINC001222872087	1373905110	/nfs/dbraw/zinc/90/51/10/1373905110.db2.gz	JAZWWOWLMBIHGD-UHFFFAOYSA-N	0	3	345.487	3.067	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC[C@H](C)N(Cc2cccc(COC)c2)C1	ZINC001131899537	1375035312	/nfs/dbraw/zinc/03/53/12/1375035312.db2.gz	NMLJBHVLZPFDJU-LPHOPBHVSA-N	0	3	330.472	3.268	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)CC[C@@H](C)c2ccccc2)CC1	ZINC001224745566	1375073513	/nfs/dbraw/zinc/07/35/13/1375073513.db2.gz	BSELMWHGLJHWSR-GOSISDBHSA-N	0	3	326.484	3.422	20	30		EGEDHN
CCCCC(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccc(F)cc1	ZINC001224871844	1375081375	/nfs/dbraw/zinc/08/13/75/1375081375.db2.gz	YGPCGFHJACPQSR-RTBURBONSA-N	0	3	330.447	3.384	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)CCc2ccc(Cl)cc2)cc1	ZINC001131986428	1375081594	/nfs/dbraw/zinc/08/15/94/1375081594.db2.gz	SCDSXBVKUVHREK-UHFFFAOYSA-N	0	3	341.842	3.050	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)CSC(C)C	ZINC001224881968	1375082164	/nfs/dbraw/zinc/08/21/64/1375082164.db2.gz	RVGSGOBKSJRIAZ-CHWSQXEVSA-N	0	3	349.338	3.054	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CC[C@H](C)N(Cc2ccc3c(c2)CCC3)C1	ZINC001131995000	1375087764	/nfs/dbraw/zinc/08/77/64/1375087764.db2.gz	FLEBUHUXSASDED-UWJYYQICSA-N	0	3	338.495	3.448	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CC[C@@H](C)N(CCCOc2ccccc2)C1	ZINC001131995365	1375088055	/nfs/dbraw/zinc/08/80/55/1375088055.db2.gz	JRDOROXVOPXXLP-MOPGFXCFSA-N	0	3	342.483	3.228	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@H](C)N(Cc2cccc(OC)c2C)C1	ZINC001132003209	1375094318	/nfs/dbraw/zinc/09/43/18/1375094318.db2.gz	REASBICIASXGFJ-QFBILLFUSA-N	0	3	342.483	3.276	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CC[C@@H](C)N(CCOCC2CCC2)C1	ZINC001132060532	1375126282	/nfs/dbraw/zinc/12/62/82/1375126282.db2.gz	HAHDUAZQZWSXRP-SJLPKXTDSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCOc2ccc(C)c(C)c2)CC[C@H]1C	ZINC001132097606	1375146331	/nfs/dbraw/zinc/14/63/31/1375146331.db2.gz	MBYSOIWJFGOPJK-MSOLQXFVSA-N	0	3	330.472	3.227	20	30		EGEDHN
O=C(C#CC1CC1)N[C@@H]1CCCC[C@H]1NCc1cccc(Cl)c1F	ZINC001226111335	1375204478	/nfs/dbraw/zinc/20/44/78/1375204478.db2.gz	FYNAMOVEXODZBY-IAGOWNOFSA-N	0	3	348.849	3.410	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1CC[C@@H](C)N(CCOCC2CCC2)C1	ZINC001132241580	1375238011	/nfs/dbraw/zinc/23/80/11/1375238011.db2.gz	VZPFQLASSVVVNU-UYAOXDASSA-N	0	3	348.531	3.356	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)Cc2cc(C)cc(C)c2)CC[C@@H]1C	ZINC001132262610	1375253567	/nfs/dbraw/zinc/25/35/67/1375253567.db2.gz	ZWQNPZGKQXAVPS-AZUAARDMSA-N	0	3	344.499	3.018	20	30		EGEDHN
C#CCCCCC(=O)NC1CCN(Cc2ccc(C)c(OC)c2)CC1	ZINC001226952099	1375369879	/nfs/dbraw/zinc/36/98/79/1375369879.db2.gz	RKYDRQSFKKMOCK-UHFFFAOYSA-N	0	3	342.483	3.278	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COc2ccc(CC)cc2)CC[C@@H]1C	ZINC001132462387	1375405531	/nfs/dbraw/zinc/40/55/31/1375405531.db2.gz	ZKHFDJPYYXCOKJ-FUHWJXTLSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2c(C)cc(C)cc2C)CC[C@@H]1C	ZINC001132464887	1375406928	/nfs/dbraw/zinc/40/69/28/1375406928.db2.gz	ZFSKSLXFDUVQQU-OALUTQOASA-N	0	3	344.499	3.397	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COc2ccc(C)c(C)c2)CC[C@H]1C	ZINC001132499824	1375427308	/nfs/dbraw/zinc/42/73/08/1375427308.db2.gz	KTDUTOZAVKFJSN-QZTJIDSGSA-N	0	3	330.472	3.227	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CC(F)(F)C(F)(F)F)CC[C@@H]1C	ZINC001132541124	1375448831	/nfs/dbraw/zinc/44/88/31/1375448831.db2.gz	ADPBVSXSHBDQCY-WDEREUQCSA-N	0	3	328.325	3.119	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)C(C)(C)F)CC1	ZINC001132551602	1375457770	/nfs/dbraw/zinc/45/77/70/1375457770.db2.gz	KKHTZQWSCDZTGA-GOSISDBHSA-N	0	3	345.462	3.036	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)CCCC)CC1	ZINC001132552330	1375458664	/nfs/dbraw/zinc/45/86/64/1375458664.db2.gz	STTJFVBSVLPSNR-HXUWFJFHSA-N	0	3	341.499	3.478	20	30		EGEDHN
C#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)C(C)(C)CC)CC1	ZINC001132554757	1375461208	/nfs/dbraw/zinc/46/12/08/1375461208.db2.gz	LPIVUVOFPVRJAK-IBGZPJMESA-N	0	3	341.499	3.334	20	30		EGEDHN
C#CCN1CC[C@@H](CN(Cc2scnc2C)C(=O)CCC(C)C)C1	ZINC001132558388	1375465862	/nfs/dbraw/zinc/46/58/62/1375465862.db2.gz	MERWHKIHHJEPCT-QGZVFWFLSA-N	0	3	347.528	3.171	20	30		EGEDHN
CC#CCN1CC[C@H](CN(Cc2scnc2C)C(=O)CCCC)C1	ZINC001132559238	1375466460	/nfs/dbraw/zinc/46/64/60/1375466460.db2.gz	VFLRLPJVNDBQBQ-KRWDZBQOSA-N	0	3	347.528	3.316	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCNCc1cc(C(C)C)ccc1OC	ZINC001132573501	1375471806	/nfs/dbraw/zinc/47/18/06/1375471806.db2.gz	OMFWMBLDWUWUCB-HOTGVXAUSA-N	0	3	332.488	3.483	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CCCC[C@H]1NCc1c(C)noc1CC	ZINC001227972544	1375496011	/nfs/dbraw/zinc/49/60/11/1375496011.db2.gz	BLYDDHCKYQCUAW-HZPDHXFCSA-N	0	3	333.476	3.275	20	30		EGEDHN
CC(C)=C(C)CC(=O)N1CC[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001188808152	1388382025	/nfs/dbraw/zinc/38/20/25/1388382025.db2.gz	XMZGRGWFFOQKJA-VQTJNVASSA-N	0	3	337.467	3.337	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2cc3ccccc3s2)CC1	ZINC001228175928	1375524593	/nfs/dbraw/zinc/52/45/93/1375524593.db2.gz	MDUMCHSVJXNUSK-UHFFFAOYSA-N	0	3	344.480	3.298	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](C)[C@@H](CNCc2csc(CC)n2)C1	ZINC001132789571	1375566039	/nfs/dbraw/zinc/56/60/39/1375566039.db2.gz	LSTARPHHVFSFAW-HOTGVXAUSA-N	0	3	347.528	3.083	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](C)[C@@H](CNCc2nccn2CC)C1	ZINC001132846554	1375598361	/nfs/dbraw/zinc/59/83/61/1375598361.db2.gz	JTCYZLWKRBHBKR-SJORKVTESA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC1CCN(C[C@H](O)c2ccc(F)cc2)CC1	ZINC001228596564	1375610160	/nfs/dbraw/zinc/61/01/60/1375610160.db2.gz	JEFPKMKGMPBASX-SFHVURJKSA-N	0	3	348.462	3.042	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CCN(CC[C@H]2CC2(Cl)Cl)CC1	ZINC001228631980	1375622621	/nfs/dbraw/zinc/62/26/21/1375622621.db2.gz	ZBHSAGHGGMJNAZ-LBPRGKRZSA-N	0	3	333.303	3.363	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NC1CCN(CCOc2ccccc2)CC1	ZINC001228750437	1375663397	/nfs/dbraw/zinc/66/33/97/1375663397.db2.gz	YRUFMDNMKSUQDK-IAGOWNOFSA-N	0	3	330.472	3.104	20	30		EGEDHN
C[C@H]1CCN(C(=O)CCC(F)F)C[C@H]1CNCc1ccccc1C#N	ZINC001132986282	1375694738	/nfs/dbraw/zinc/69/47/38/1375694738.db2.gz	DZQXFXMYLUDPMR-WMLDXEAASA-N	0	3	349.425	3.178	20	30		EGEDHN
C=CCCCC(=O)NC1CCN(CCOCc2ccccc2)CC1	ZINC001228928173	1375719070	/nfs/dbraw/zinc/71/90/70/1375719070.db2.gz	XHSBTQZKDMCIGA-UHFFFAOYSA-N	0	3	330.472	3.140	20	30		EGEDHN
CCC(C)(C)C(=O)NC1CCN(Cc2ccc(OCC#N)cc2)CC1	ZINC001228935754	1375722229	/nfs/dbraw/zinc/72/22/29/1375722229.db2.gz	ZFZWNMJQWJAVFH-UHFFFAOYSA-N	0	3	343.471	3.106	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H]2CN(CCOCCC(C)C)C[C@H]21	ZINC001188908750	1388406126	/nfs/dbraw/zinc/40/61/26/1388406126.db2.gz	HNVNHYAXEFLGJD-CEXWTWQISA-N	0	3	336.520	3.184	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@H]2CN(CCOCCC(C)C)C[C@H]21	ZINC001188908751	1388406136	/nfs/dbraw/zinc/40/61/36/1388406136.db2.gz	HNVNHYAXEFLGJD-GBESFXJTSA-N	0	3	336.520	3.184	20	30		EGEDHN
Cc1ccc(CCCC(=O)NCCNCc2ccc(C#N)s2)cc1	ZINC001133257580	1375873331	/nfs/dbraw/zinc/87/33/31/1375873331.db2.gz	JPCLQBPRJXUSLN-UHFFFAOYSA-N	0	3	341.480	3.157	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@H]2CN(Cc3ccc(OC)cc3)C[C@H]21	ZINC001188908448	1388406608	/nfs/dbraw/zinc/40/66/08/1388406608.db2.gz	DGTSJSOLUVZBKC-IMFGXOCKSA-N	0	3	342.483	3.330	20	30		EGEDHN
N#CC1(c2ccc(O[C@H]3CC[C@@H](N4CCOCC4)CC3)cc2)CC1	ZINC001229943628	1375921651	/nfs/dbraw/zinc/92/16/51/1375921651.db2.gz	MUTLBJBQEWSBNF-IZAXUBKRSA-N	0	3	326.440	3.264	20	30		EGEDHN
C#CCCCCC(=O)N(CCNCC#C)Cc1cccc(Cl)c1	ZINC001133392909	1375978632	/nfs/dbraw/zinc/97/86/32/1375978632.db2.gz	SMZOYGYUQWIHQV-UHFFFAOYSA-N	0	3	330.859	3.085	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H](F)C(C)C	ZINC001133403760	1375987822	/nfs/dbraw/zinc/98/78/22/1375987822.db2.gz	HJBSWDOTVDUURB-KRWDZBQOSA-N	0	3	338.854	3.276	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)C1(CC)CC1	ZINC001133405578	1375989998	/nfs/dbraw/zinc/98/99/98/1375989998.db2.gz	GDBUVBNHIYWPEX-UHFFFAOYSA-N	0	3	332.875	3.472	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H]1C[C@H]1C1CC1	ZINC001133410616	1375994389	/nfs/dbraw/zinc/99/43/89/1375994389.db2.gz	RDSSPMMJVBGFJE-RBUKOAKNSA-N	0	3	344.886	3.328	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NC1CCN(Cc2ccc(C(C)C)cc2)CC1	ZINC001230407062	1376020872	/nfs/dbraw/zinc/02/08/72/1376020872.db2.gz	IJRGVAMRTZJDSJ-QGZVFWFLSA-N	0	3	344.499	3.482	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NC1CCN(Cc2ccc(C(C)C)cc2)CC1	ZINC001230407061	1376021364	/nfs/dbraw/zinc/02/13/64/1376021364.db2.gz	IJRGVAMRTZJDSJ-KRWDZBQOSA-N	0	3	344.499	3.482	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1C1CCN(C(=O)CCCCOC)CC1	ZINC001230522176	1376052990	/nfs/dbraw/zinc/05/29/90/1376052990.db2.gz	IQRUSKBUCFKXBE-KRWDZBQOSA-N	0	3	342.911	3.259	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)c1ccccc1	ZINC001133524624	1376058185	/nfs/dbraw/zinc/05/81/85/1376058185.db2.gz	HUBJJVXIQUNTHY-QWHCGFSZSA-N	0	3	325.250	3.082	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)c1ccccc1F)NCc1ccccc1C#N	ZINC001133525700	1376060600	/nfs/dbraw/zinc/06/06/00/1376060600.db2.gz	OXCOTEOVRPCBJG-HUUCEWRRSA-N	0	3	339.414	3.384	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)c1ccccc1F)NCc1ccccc1C#N	ZINC001133525699	1376060866	/nfs/dbraw/zinc/06/08/66/1376060866.db2.gz	OXCOTEOVRPCBJG-GJZGRUSLSA-N	0	3	339.414	3.384	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)c1ccccc1)NCc1cc(F)ccc1C#N	ZINC001133526656	1376061980	/nfs/dbraw/zinc/06/19/80/1376061980.db2.gz	WZOAMQYDECNJSO-CABCVRRESA-N	0	3	339.414	3.384	20	30		EGEDHN
C[C@H](CC(=O)NCCNCc1ccc(C#N)cc1)c1cccc(F)c1	ZINC001133612465	1376121576	/nfs/dbraw/zinc/12/15/76/1376121576.db2.gz	POPMUCHGMPTMTC-OAHLLOKOSA-N	0	3	339.414	3.097	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H](C)C[C@@H](C)NCc2ccccc2C#N)c(C)o1	ZINC001133641556	1376132918	/nfs/dbraw/zinc/13/29/18/1376132918.db2.gz	UJBKJAASPIUBFT-KGLIPLIRSA-N	0	3	339.439	3.455	20	30		EGEDHN
C#CCCN(CCCNC(=O)C(C)(C)C(C)C)Cc1cccnc1	ZINC001230769393	1376145778	/nfs/dbraw/zinc/14/57/78/1376145778.db2.gz	OKGKXPWNIQXJGX-UHFFFAOYSA-N	0	3	329.488	3.095	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCCN(CCCOC)Cc1cccnc1	ZINC001230838915	1376163990	/nfs/dbraw/zinc/16/39/90/1376163990.db2.gz	WQMNCPANZQNWKZ-HXUWFJFHSA-N	0	3	347.503	3.029	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)[C@@H]1CC[C@H](C)C1)Cc1cccnc1	ZINC001230861261	1376169195	/nfs/dbraw/zinc/16/91/95/1376169195.db2.gz	FRYKBSMUIKBDGB-PKOBYXMFSA-N	0	3	329.488	3.402	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)[C@@H]1C[C@]1(C)CC)Cc1cccnc1	ZINC001230881953	1376175933	/nfs/dbraw/zinc/17/59/33/1376175933.db2.gz	KVFGIRJULXQAIT-ICSRJNTNSA-N	0	3	329.488	3.402	20	30		EGEDHN
C[C@H](C[C@H](C)[NH2+]Cc1ccc(C#N)s1)NC(=O)c1ccccc1[O-]	ZINC001133723114	1376176100	/nfs/dbraw/zinc/17/61/00/1376176100.db2.gz	RFHGIXSOOVQLFC-QWHCGFSZSA-N	0	3	343.452	3.012	20	30		EGEDHN
C#CCCN(CCCNC(=O)[C@@H](C)[C@@H](C)CC)Cc1cccnc1	ZINC001230883561	1376177848	/nfs/dbraw/zinc/17/78/48/1376177848.db2.gz	XKGZXWGIPAGHCV-ROUUACIJSA-N	0	3	329.488	3.095	20	30		EGEDHN
C#CCCN(CCCNC(=O)[C@H](C)[C@@H](C)CC)Cc1cccnc1	ZINC001230883564	1376177855	/nfs/dbraw/zinc/17/78/55/1376177855.db2.gz	XKGZXWGIPAGHCV-ZWKOTPCHSA-N	0	3	329.488	3.095	20	30		EGEDHN
CC(=O)N(C)[C@@H]1CCN(Cc2ccccc2C#Cc2ccccc2)C1	ZINC001231579057	1376270329	/nfs/dbraw/zinc/27/03/29/1376270329.db2.gz	YIYNSUPWEBPLDJ-JOCHJYFZSA-N	0	3	332.447	3.139	20	30		EGEDHN
C=CCOc1cccc(CN2CC[C@]3(C[C@@H](OCC4CC4)CO3)C2)c1	ZINC001231623493	1376285396	/nfs/dbraw/zinc/28/53/96/1376285396.db2.gz	GXEJNJABYBENEC-RTWAWAEBSA-N	0	3	343.467	3.411	20	30		EGEDHN
C#Cc1cccc(CN2CCC3(CN(C(=O)OC(C)(C)C)C3)C2)c1	ZINC001231657423	1376296293	/nfs/dbraw/zinc/29/62/93/1376296293.db2.gz	KNHNKTDMXXGLEN-UHFFFAOYSA-N	0	3	326.440	3.111	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)c1cscc1C	ZINC001134035888	1376323166	/nfs/dbraw/zinc/32/31/66/1376323166.db2.gz	WJTHBFRNMBNKEW-RYUDHWBXSA-N	0	3	345.306	3.452	20	30		EGEDHN
C=CCOCc1ncn2c1CN(Cc1c(C)cc(C)cc1O)CCC2	ZINC001231844576	1376324884	/nfs/dbraw/zinc/32/48/84/1376324884.db2.gz	MQWSEYWOKVREAL-UHFFFAOYSA-N	0	3	341.455	3.314	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H](C)C[C@@H](C)NCc1nc2ccccc2o1	ZINC001134115213	1376375383	/nfs/dbraw/zinc/37/53/83/1376375383.db2.gz	QLQKXIQBFOKVDR-CVEARBPZSA-N	0	3	341.455	3.394	20	30		EGEDHN
C#CCCCCC(=O)N[C@H](C)C[C@@H](C)NCc1cc(C2CC2)no1	ZINC001134119316	1376378542	/nfs/dbraw/zinc/37/85/42/1376378542.db2.gz	PFQODQIXGVESHP-HUUCEWRRSA-N	0	3	331.460	3.119	20	30		EGEDHN
N#Cc1cccc(O[C@@H]2CCCN(Cc3cc4c[nH]ccc-4n3)C2)c1	ZINC001232015180	1376383848	/nfs/dbraw/zinc/38/38/48/1376383848.db2.gz	CGJCTQDNPNHYJI-LJQANCHMSA-N	0	3	332.407	3.478	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)c1sccc1F)NCc1ccccc1C#N	ZINC001134274385	1376450069	/nfs/dbraw/zinc/45/00/69/1376450069.db2.gz	OSQDJPSQTQDKQW-CHWSQXEVSA-N	0	3	345.443	3.446	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H](C)C[C@H](C)NCc1nsc2ccccc21	ZINC001134316667	1376471784	/nfs/dbraw/zinc/47/17/84/1376471784.db2.gz	ALLUWEQVPZVBDB-GJZGRUSLSA-N	0	3	343.496	3.329	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H](C)C[C@H](C)NCc1cc(O)ccc1Cl	ZINC001134317650	1376472407	/nfs/dbraw/zinc/47/24/07/1376472407.db2.gz	MDNKDSNJOYYEOG-KBPBESRZSA-N	0	3	336.863	3.078	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H](C)C[C@H](C)NCc1cc(O)ccc1Cl	ZINC001134317652	1376472464	/nfs/dbraw/zinc/47/24/64/1376472464.db2.gz	MDNKDSNJOYYEOG-UONOGXRCSA-N	0	3	336.863	3.078	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1cc(F)ccc1Cl)NC(=O)C#CC1CC1	ZINC001134329989	1376480697	/nfs/dbraw/zinc/48/06/97/1376480697.db2.gz	UDMFYGNUGWWROZ-QWHCGFSZSA-N	0	3	336.838	3.265	20	30		EGEDHN
CC(C)[C@@H](C(=O)NCCNCc1ccc(C#N)s1)c1ccccc1	ZINC001134417225	1376521889	/nfs/dbraw/zinc/52/18/89/1376521889.db2.gz	RPWMPNLDUMRQQA-GOSISDBHSA-N	0	3	341.480	3.265	20	30		EGEDHN
Cc1cccc([C@@H](C)C(=O)NCCNCc2ccc(F)c(C#N)c2)c1	ZINC001134468888	1376553669	/nfs/dbraw/zinc/55/36/69/1376553669.db2.gz	RMNGTFCQALNMBL-OAHLLOKOSA-N	0	3	339.414	3.015	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1C[C@@H]2CCN(C(=O)OC(C)(C)C)[C@@H]2C1	ZINC001233080518	1376566843	/nfs/dbraw/zinc/56/68/43/1376566843.db2.gz	ZHSIPHDSJQBLGD-ZWKOTPCHSA-N	0	3	341.455	3.308	20	30		EGEDHN
C=CCO[C@H]1CO[C@@]2(C1)CCCN(Cc1ccc(C#N)cc1C)C2	ZINC001233081199	1376567268	/nfs/dbraw/zinc/56/72/68/1376567268.db2.gz	SIAFSAXBTOHHGN-WOJBJXKFSA-N	0	3	326.440	3.193	20	30		EGEDHN
Cc1noc([C@@H]2CC[C@@H]3[C@@H](CCN3Cc3ccc(C#N)cc3C)O2)n1	ZINC001233081898	1376568160	/nfs/dbraw/zinc/56/81/60/1376568160.db2.gz	TVXJHEKDSKSDEZ-KURKYZTESA-N	0	3	338.411	3.053	20	30		EGEDHN
CC(C)C#CC(=O)N(C)C[C@@H]1CCN1CCCc1ccc(Cl)cc1	ZINC001234170280	1376782664	/nfs/dbraw/zinc/78/26/64/1376782664.db2.gz	IQFBUONAPYTDLJ-IBGZPJMESA-N	0	3	346.902	3.465	20	30		EGEDHN
C[C@@H](C(=O)NCCNCc1ccc(F)c(C#N)c1)[C@H](C)C(C)(C)C	ZINC001135178333	1376952100	/nfs/dbraw/zinc/95/21/00/1376952100.db2.gz	TWFWRZWGTLQCNF-KGLIPLIRSA-N	0	3	333.451	3.221	20	30		EGEDHN
C[C@H](C(=O)NCCNCc1ccc(F)c(C#N)c1)[C@H](C)C(C)(C)C	ZINC001135178332	1376952592	/nfs/dbraw/zinc/95/25/92/1376952592.db2.gz	TWFWRZWGTLQCNF-KBPBESRZSA-N	0	3	333.451	3.221	20	30		EGEDHN
C=CC1(CC(=O)NCCNC[C@H](O)c2ccccc2F)CCCCC1	ZINC001135197121	1376968149	/nfs/dbraw/zinc/96/81/49/1376968149.db2.gz	YLTYPYHKKFPTAG-SFHVURJKSA-N	0	3	348.462	3.092	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)C1CC2(CCC2)C1	ZINC001135225200	1376986369	/nfs/dbraw/zinc/98/63/69/1376986369.db2.gz	OHHBEZRPSXUQMB-CHWSQXEVSA-N	0	3	343.309	3.348	20	30		EGEDHN
COc1ccc(-c2cccc3cc([C@H]4CNCCO4)cn32)cc1C#N	ZINC001244710438	1377039764	/nfs/dbraw/zinc/03/97/64/1377039764.db2.gz	ZCLZBGOZKFDGGZ-HXUWFJFHSA-N	0	3	333.391	3.147	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H](C)C[C@H](C)NCc2oc(C)nc2C)CC1	ZINC001135384129	1377066749	/nfs/dbraw/zinc/06/67/49/1377066749.db2.gz	ZLTLLCYFBVYTEG-UONOGXRCSA-N	0	3	333.476	3.411	20	30		EGEDHN
CCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2cc(F)ccc2C#N)CC1	ZINC001135391077	1377069906	/nfs/dbraw/zinc/06/99/06/1377069906.db2.gz	QKJFDOQVYKKVHM-ZIAGYGMSSA-N	0	3	331.435	3.260	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)C1(C)CC=CC1)NCc1ccccc1C#N	ZINC001135412703	1377080993	/nfs/dbraw/zinc/08/09/93/1377080993.db2.gz	UTMHAPMHARPQPO-CVEARBPZSA-N	0	3	325.456	3.287	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H](C)C[C@H](C)NCc2ccccc2C#N)C1	ZINC001135426676	1377089984	/nfs/dbraw/zinc/08/99/84/1377089984.db2.gz	GNGCAAWSHICWFU-JKSUJKDBSA-N	0	3	325.456	3.287	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](C)C[C@@H](C)NCc2ccccc2C#N)c(C)[nH]1	ZINC001135561552	1377145409	/nfs/dbraw/zinc/14/54/09/1377145409.db2.gz	SMULNLWBYXFEQA-ZIAGYGMSSA-N	0	3	338.455	3.190	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H](C)C[C@@H](C)NCc2ccccc2C#N)c(C)[nH]1	ZINC001135561550	1377145506	/nfs/dbraw/zinc/14/55/06/1377145506.db2.gz	SMULNLWBYXFEQA-KGLIPLIRSA-N	0	3	338.455	3.190	20	30		EGEDHN
C=CCOC(=O)N[C@H]1CCCN(Cc2c[nH]c3cc(C)ccc23)C1	ZINC001136976671	1377448783	/nfs/dbraw/zinc/44/87/83/1377448783.db2.gz	KMGQDCDVCMMPNS-INIZCTEOSA-N	0	3	327.428	3.353	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)CC(F)(F)F)CCCC[C@H]1C	ZINC001267868490	1377475902	/nfs/dbraw/zinc/47/59/02/1377475902.db2.gz	MKEAZDZDZKOXFV-MFKMUULPSA-N	0	3	326.790	3.346	20	30		EGEDHN
Cc1cccc(O[C@@H]2CCCN(Cc3ccc(OCC#N)cc3)C2)n1	ZINC001137122493	1377482198	/nfs/dbraw/zinc/48/21/98/1377482198.db2.gz	DEYVZBJGTDPISV-LJQANCHMSA-N	0	3	337.423	3.336	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1n[nH]c3ccccc31)CC2	ZINC001137347349	1377527316	/nfs/dbraw/zinc/52/73/16/1377527316.db2.gz	ILNUMXNJOUVLJK-FQEVSTJZSA-N	0	3	338.455	3.096	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cc(OC)ccc1F)CC2	ZINC001137993235	1377660663	/nfs/dbraw/zinc/66/06/63/1377660663.db2.gz	HAAMITLIRXORJS-FQEVSTJZSA-N	0	3	346.446	3.367	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cc(O)cc(O)c1)[C@H]2CC	ZINC001138325901	1377702820	/nfs/dbraw/zinc/70/28/20/1377702820.db2.gz	YSEPRZSIXNBIAN-ICSRJNTNSA-N	0	3	344.455	3.019	20	30		EGEDHN
C#CCOc1ccc(CN(C)C[C@@H]2Cc3ccccc3O2)cc1OC	ZINC001138346983	1377707802	/nfs/dbraw/zinc/70/78/02/1377707802.db2.gz	BSVIXTVGFSQWCY-SFHVURJKSA-N	0	3	337.419	3.143	20	30		EGEDHN
C#CCOc1ccc(CN2CCC[C@H](c3nc(CC)no3)C2)cc1	ZINC001138557389	1377742280	/nfs/dbraw/zinc/74/22/80/1377742280.db2.gz	JLARRTREWHIIFR-INIZCTEOSA-N	0	3	325.412	3.024	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCCN(c3ccc(F)cn3)CC2)c1[O-]	ZINC001138625548	1377756144	/nfs/dbraw/zinc/75/61/44/1377756144.db2.gz	OEZSADQZIBWVBU-UHFFFAOYSA-N	0	3	341.430	3.367	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCCN(c3ccc(F)cn3)CC2)c1[O-]	ZINC001138625548	1377756145	/nfs/dbraw/zinc/75/61/45/1377756145.db2.gz	OEZSADQZIBWVBU-UHFFFAOYSA-N	0	3	341.430	3.367	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@H]1CCN(Cc1cnn(CCC)c1C)C2	ZINC001138636557	1377758712	/nfs/dbraw/zinc/75/87/12/1377758712.db2.gz	UULCPKJHTXMGOJ-PMACEKPBSA-N	0	3	347.503	3.175	20	30		EGEDHN
C=CCN(CC=C)CCN1CCN(Cc2csc(C(C)C)n2)CC1	ZINC001138888020	1377799369	/nfs/dbraw/zinc/79/93/69/1377799369.db2.gz	IOIJEVSMAAYGFU-UHFFFAOYSA-N	0	3	348.560	3.058	20	30		EGEDHN
C=CCOC(=O)N[C@H]1CCCN(Cc2cccc3c2ccn3C)C1	ZINC001139161928	1377841945	/nfs/dbraw/zinc/84/19/45/1377841945.db2.gz	BBQRLAQAMPSENP-INIZCTEOSA-N	0	3	327.428	3.055	20	30		EGEDHN
CC(C)N(CCCO)Cc1ccc(Oc2ccc(C#N)cc2)nc1	ZINC001139425729	1377882218	/nfs/dbraw/zinc/88/22/18/1377882218.db2.gz	VJCHIMOUSVBTAB-UHFFFAOYSA-N	0	3	325.412	3.338	20	30		EGEDHN
Cc1ccc(CN2CC[C@@]3(C2)CCCN(c2ncccn2)C3)cc1C#N	ZINC001139723578	1377941662	/nfs/dbraw/zinc/94/16/62/1377941662.db2.gz	BQGORIRDLAPGOV-OAQYLSRUSA-N	0	3	347.466	3.149	20	30		EGEDHN
C=CCn1cc(CN(C)CC2CCN(C(=O)OC(C)(C)C)CC2)cn1	ZINC001139768792	1377948340	/nfs/dbraw/zinc/94/83/40/1377948340.db2.gz	UVVVOKSXJIUBRT-UHFFFAOYSA-N	0	3	348.491	3.148	20	30		EGEDHN
N#Cc1ccc2[nH]cc(CN3C[C@@H]4C(=O)c5ccccc5[C@@H]4C3)c2c1	ZINC001140111109	1378011048	/nfs/dbraw/zinc/01/10/48/1378011048.db2.gz	YGBKFJVFJVTMMF-OALUTQOASA-N	0	3	327.387	3.451	20	30		EGEDHN
N#Cc1ccccc1O[C@@H]1CCCN(Cc2ccc3n[nH]cc3c2)C1	ZINC001140388440	1378055762	/nfs/dbraw/zinc/05/57/62/1378055762.db2.gz	UBBLILYIRIQQDJ-GOSISDBHSA-N	0	3	332.407	3.478	20	30		EGEDHN
C=CCN1C(=O)CC[C@@H]2[C@H]1CCN2Cc1cccc(OC(F)F)c1	ZINC001272667964	1378077733	/nfs/dbraw/zinc/07/77/33/1378077733.db2.gz	DSYMSNAYCSLQGP-HZPDHXFCSA-N	0	3	336.382	3.039	20	30		EGEDHN
N#Cc1ccc(Cl)c(CN2C[C@@H]3C(=O)Nc4ccccc4[C@H]3C2)c1	ZINC001140600827	1378095197	/nfs/dbraw/zinc/09/51/97/1378095197.db2.gz	WQZOQIMKMMWIKO-CVEARBPZSA-N	0	3	337.810	3.379	20	30		EGEDHN
C=CCN1C(=O)CC[C@@H]2[C@H]1CCN2Cc1[nH]c2ccc(F)cc2c1C	ZINC001273326522	1378098094	/nfs/dbraw/zinc/09/80/94/1378098094.db2.gz	FFBKMHXDDPZSPP-RTBURBONSA-N	0	3	341.430	3.367	20	30		EGEDHN
C=CCOC(=O)N[C@H]1CCCN(Cc2cccc3ccncc32)C1	ZINC001140646259	1378104118	/nfs/dbraw/zinc/10/41/18/1378104118.db2.gz	WNWOBGQQKRCSIR-KRWDZBQOSA-N	0	3	325.412	3.111	20	30		EGEDHN
C[C@@H](Cc1ccccc1)C(=O)NCC1(NCc2cccc(C#N)c2)CC1	ZINC001277253202	1378213336	/nfs/dbraw/zinc/21/33/36/1378213336.db2.gz	YURRRWBMVZBGJF-KRWDZBQOSA-N	0	3	347.462	3.175	20	30		EGEDHN
CC1(C)CN(Cc2ccc(C#N)cc2)CC[C@H]1NC(=O)CCC1CC1	ZINC001281543135	1378443627	/nfs/dbraw/zinc/44/36/27/1378443627.db2.gz	YLIXWTPQNCUBRL-LJQANCHMSA-N	0	3	339.483	3.465	20	30		EGEDHN
CCc1noc(C2CCN(Cc3c[nH]c4cc(C#N)ccc34)CC2)n1	ZINC001142922704	1378509984	/nfs/dbraw/zinc/50/99/84/1378509984.db2.gz	RBNFCXWXODDPLQ-UHFFFAOYSA-N	0	3	335.411	3.365	20	30		EGEDHN
C=CCO[C@H]1CO[C@@]2(C1)CCCN(Cc1cc(C)cc(OC)c1)C2	ZINC001143157650	1378550244	/nfs/dbraw/zinc/55/02/44/1378550244.db2.gz	PHIRPNBNZXUFLD-WOJBJXKFSA-N	0	3	331.456	3.330	20	30		EGEDHN
C#Cc1ccc(CN(CC)C[C@@H]2CN(Cc3ccccc3)CCO2)cc1	ZINC001144581672	1378747918	/nfs/dbraw/zinc/74/79/18/1378747918.db2.gz	XRSUBBWCZZENIO-HSZRJFAPSA-N	0	3	348.490	3.391	20	30		EGEDHN
CCC[C@H](C)CC(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001147174678	1378981940	/nfs/dbraw/zinc/98/19/40/1378981940.db2.gz	RUJPZCOGYNYXED-KRWDZBQOSA-N	0	3	339.483	3.419	20	30		EGEDHN
CCC[C@@H](C)CC(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001147174679	1378982383	/nfs/dbraw/zinc/98/23/83/1378982383.db2.gz	RUJPZCOGYNYXED-QGZVFWFLSA-N	0	3	339.483	3.419	20	30		EGEDHN
C=CCCC(=O)N1CC2(C1)CCN(CCO[C@H]1CCCC[C@@H]1C)C2	ZINC001147186826	1378984110	/nfs/dbraw/zinc/98/41/10/1378984110.db2.gz	CVMRDADNIKFUMD-ROUUACIJSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCCC(=O)N1CC2(C1)CCN([C@@H]1CCc3c1cccc3F)C2	ZINC001147188381	1378984330	/nfs/dbraw/zinc/98/43/30/1378984330.db2.gz	YDTWEQVWZAQOHC-GOSISDBHSA-N	0	3	328.431	3.314	20	30		EGEDHN
CC(C)C#CC(=O)N1CC2(C1)CCN(CCc1ccccc1Cl)C2	ZINC001147514062	1379036014	/nfs/dbraw/zinc/03/60/14/1379036014.db2.gz	ATAQVTLFGXNLRL-UHFFFAOYSA-N	0	3	344.886	3.076	20	30		EGEDHN
C#CCCCCCC(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001148052274	1379109905	/nfs/dbraw/zinc/10/99/05/1379109905.db2.gz	BZTQSRWQPKPVGC-UHFFFAOYSA-N	0	3	349.478	3.176	20	30		EGEDHN
CC(C)=C(C)CC(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001148065579	1379112057	/nfs/dbraw/zinc/11/20/57/1379112057.db2.gz	ZADYXBOZZSYXTN-UHFFFAOYSA-N	0	3	337.467	3.339	20	30		EGEDHN
Cc1cc(C(=O)NCCNCc2cccc(C#N)c2)c(Cl)cc1F	ZINC001149240360	1379353642	/nfs/dbraw/zinc/35/36/42/1379353642.db2.gz	ZQJCLHZXEFMIBV-UHFFFAOYSA-N	0	3	345.805	3.179	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2sccc2C(F)F)c1	ZINC001149377500	1379372951	/nfs/dbraw/zinc/37/29/51/1379372951.db2.gz	NXAIIANWMZLZLC-UHFFFAOYSA-N	0	3	335.379	3.077	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2sccc2C(F)F)cc1	ZINC001149377508	1379373216	/nfs/dbraw/zinc/37/32/16/1379373216.db2.gz	OCLXUBAQGAXWPO-UHFFFAOYSA-N	0	3	335.379	3.077	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)C2CCC(C3CC3)CC2)cc1F	ZINC001149490449	1379390027	/nfs/dbraw/zinc/39/00/27/1379390027.db2.gz	QFTZLUFJXONGNG-UHFFFAOYSA-N	0	3	343.446	3.120	20	30		EGEDHN
C#CCCCC(=O)NC[C@@H]1CN([C@H](C)c2cccc(C)c2)CCCO1	ZINC001149646473	1379419267	/nfs/dbraw/zinc/41/92/67/1379419267.db2.gz	NIFBUCACYOMUHJ-UYAOXDASSA-N	0	3	342.483	3.067	20	30		EGEDHN
C[C@H](c1ccccc1)N1CCCO[C@@H](CNC(=O)C#CC(C)(C)C)C1	ZINC001149686657	1379428155	/nfs/dbraw/zinc/42/81/55/1379428155.db2.gz	FYDTUXPECPXQAV-MJGOQNOKSA-N	0	3	342.483	3.004	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2cc(F)c(F)cc2Cl)c1	ZINC001149735275	1379438025	/nfs/dbraw/zinc/43/80/25/1379438025.db2.gz	PIOWWBPOTLWACB-UHFFFAOYSA-N	0	3	349.768	3.009	20	30		EGEDHN
C#CCCN1CCCO[C@@H](CNC(=O)[C@@H](CCC)CC2CCCC2)C1	ZINC001150404576	1379549606	/nfs/dbraw/zinc/54/96/06/1379549606.db2.gz	ZMUQDVNIQPOHDW-PMACEKPBSA-N	0	3	348.531	3.213	20	30		EGEDHN
C#CCCN1CCCO[C@@H](CNC(=O)[C@@H](CC2CCCC2)C(C)C)C1	ZINC001150404306	1379549776	/nfs/dbraw/zinc/54/97/76/1379549776.db2.gz	XVGPCBVQOJRIEO-PMACEKPBSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)[C@@H](C)CC2CCCCC2)C1	ZINC001150417561	1379551553	/nfs/dbraw/zinc/55/15/53/1379551553.db2.gz	NUCVWNPKSJGCPX-HKUYNNGSSA-N	0	3	336.520	3.376	20	30		EGEDHN
C#CCCN1CCCO[C@H](CNC(=O)C[C@@H](C)CCCCCC)C1	ZINC001150579541	1379572213	/nfs/dbraw/zinc/57/22/13/1379572213.db2.gz	NJQMYIIFKBWTPG-RBUKOAKNSA-N	0	3	336.520	3.213	20	30		EGEDHN
C#CCCCCCC(=O)NC1(CCOC)CCN(CC(=C)C)CC1	ZINC001151248995	1379687458	/nfs/dbraw/zinc/68/74/58/1379687458.db2.gz	WIIRAURIPXUMSR-UHFFFAOYSA-N	0	3	334.504	3.134	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@H]2CCC[C@H](C)C2)CC1	ZINC001151281266	1379691918	/nfs/dbraw/zinc/69/19/18/1379691918.db2.gz	IFPNCWQLPWWCKU-ROUUACIJSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)Cc2cc(C)cc(C)c2)CC1	ZINC001151288008	1379693797	/nfs/dbraw/zinc/69/37/97/1379693797.db2.gz	ICTCJZKYGXRNEA-UHFFFAOYSA-N	0	3	344.499	3.019	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@H]2CCC(C)(C)C2)CC1	ZINC001151302293	1379697015	/nfs/dbraw/zinc/69/70/15/1379697015.db2.gz	GSSMTOWTDWOZQT-KRWDZBQOSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)C[C@H](C)n2cccc2)CC1	ZINC001151399291	1379711041	/nfs/dbraw/zinc/71/10/41/1379711041.db2.gz	YPHBWEFGPVSGIG-SFHVURJKSA-N	0	3	347.503	3.003	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2cc(C(C)C)oc2C)CC1	ZINC001151393045	1379711054	/nfs/dbraw/zinc/71/10/54/1379711054.db2.gz	ZTLCDHWXBBMGLF-UHFFFAOYSA-N	0	3	348.487	3.498	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2ccc(Cl)s2)CC1	ZINC001151406625	1379712309	/nfs/dbraw/zinc/71/23/09/1379712309.db2.gz	SPLUQWIMTUZTEY-UHFFFAOYSA-N	0	3	342.892	3.188	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2ccc(C(F)F)o2)CC1	ZINC001151405684	1379712476	/nfs/dbraw/zinc/71/24/76/1379712476.db2.gz	CLMHDQMAFYPUTR-UHFFFAOYSA-N	0	3	342.386	3.004	20	30		EGEDHN
C=CC[C@@H](C(=O)NCCNCc1scnc1C)c1ccccc1	ZINC001151837988	1379793366	/nfs/dbraw/zinc/79/33/66/1379793366.db2.gz	FCCASVQYPFQISM-MRXNPFEDSA-N	0	3	329.469	3.017	20	30		EGEDHN
C=CC[C@@H](C(=O)NCCNCc1ccc(Cl)nc1)c1ccccc1	ZINC001151838394	1379793775	/nfs/dbraw/zinc/79/37/75/1379793775.db2.gz	RVMFDJVWYFNYAH-QGZVFWFLSA-N	0	3	343.858	3.301	20	30		EGEDHN
C=C[C@@H](CC(=O)NCCNCc1ccc(Cl)nc1)c1ccccc1	ZINC001151942405	1379821509	/nfs/dbraw/zinc/82/15/09/1379821509.db2.gz	HZGVHSJCSWIKKQ-INIZCTEOSA-N	0	3	343.858	3.301	20	30		EGEDHN
C[C@H](CC(=O)NCCNCc1ccc(C#N)cc1)c1ccc(F)cc1	ZINC001152115630	1379864935	/nfs/dbraw/zinc/86/49/35/1379864935.db2.gz	PQVWXFIGBPMYOL-OAHLLOKOSA-N	0	3	339.414	3.097	20	30		EGEDHN
CC/C=C(\C)C(=O)NC[C@@H](C)N(CC)Cc1ccc(OC)c(C#N)c1	ZINC001152189658	1379881005	/nfs/dbraw/zinc/88/10/05/1379881005.db2.gz	UTZSDDLHTKKLQH-WPBGYSLVSA-N	0	3	343.471	3.250	20	30		EGEDHN
CCC[C@@H](C)C(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)c(F)c1	ZINC001152459992	1379937168	/nfs/dbraw/zinc/93/71/68/1379937168.db2.gz	MLIQMROSNORVGI-HUUCEWRRSA-N	0	3	333.451	3.460	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)C1=CCCC1	ZINC001152713256	1379974134	/nfs/dbraw/zinc/97/41/34/1379974134.db2.gz	UCSYIEXHEGQBAG-CQSZACIVSA-N	0	3	329.419	3.134	20	30		EGEDHN
CCN(Cc1ccc(OC)c(C#N)c1)[C@H](C)CNC(=O)C1=CCCC1	ZINC001152734509	1379977346	/nfs/dbraw/zinc/97/73/46/1379977346.db2.gz	VKTUVZLTFMHYRA-OAHLLOKOSA-N	0	3	341.455	3.004	20	30		EGEDHN
CC(C)(C)[C@H](CNCc1ccc(C#N)s1)NC(=O)Cc1ccoc1	ZINC001284577508	1379981326	/nfs/dbraw/zinc/98/13/26/1379981326.db2.gz	RHOFQBBFUBZJSU-INIZCTEOSA-N	0	3	345.468	3.076	20	30		EGEDHN
Cc1cc(CCC(=O)NCCNCc2ccc(C#N)cc2)c(C)s1	ZINC001152885941	1379990249	/nfs/dbraw/zinc/99/02/49/1379990249.db2.gz	ZFOYYDQLQOHQAX-UHFFFAOYSA-N	0	3	341.480	3.075	20	30		EGEDHN
CC(C)Cc1ccccc1C(=O)NCCNCc1ccc(C#N)s1	ZINC001152941346	1379997022	/nfs/dbraw/zinc/99/70/22/1379997022.db2.gz	CKGGGHXGAGHGTD-UHFFFAOYSA-N	0	3	341.480	3.338	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)C2CC(c3ccccc3)C2)s1	ZINC001153365984	1380065634	/nfs/dbraw/zinc/06/56/34/1380065634.db2.gz	HNIISXCWRHZWDL-UHFFFAOYSA-N	0	3	339.464	3.019	20	30		EGEDHN
C#CCC1(C(=O)NC[C@@H](C)N(CC)Cc2cccc(F)c2)CCC1	ZINC001153776631	1380127145	/nfs/dbraw/zinc/12/71/45/1380127145.db2.gz	NQVRASQTRDYAKZ-MRXNPFEDSA-N	0	3	330.447	3.346	20	30		EGEDHN
C=CCC1(C(=O)NCCNCc2ccc(OC)c(F)c2)CCCC1	ZINC001153814154	1380134749	/nfs/dbraw/zinc/13/47/49/1380134749.db2.gz	STVZMVABJKADPE-UHFFFAOYSA-N	0	3	334.435	3.177	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1cc2cc(Cl)ccc2[nH]1	ZINC001154552961	1380304676	/nfs/dbraw/zinc/30/46/76/1380304676.db2.gz	DRNLSNLRVBVEKQ-CYBMUJFWSA-N	0	3	331.847	3.285	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H](C)N(CC)C[C@@H](OC)c1ccccc1	ZINC001154605339	1380315211	/nfs/dbraw/zinc/31/52/11/1380315211.db2.gz	FXESSSNNUJEZPG-SJLPKXTDSA-N	0	3	332.488	3.413	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@@H](C)N(CC)CCc1csc(C)n1	ZINC001154743339	1380344403	/nfs/dbraw/zinc/34/44/03/1380344403.db2.gz	ZFAKYAREBASCIU-HUUCEWRRSA-N	0	3	337.533	3.423	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@@H](C)N(CC)C/C=C\c2ccccc2)c1	ZINC001155148702	1380416388	/nfs/dbraw/zinc/41/63/88/1380416388.db2.gz	AIEAQWFGTISAMA-ZVBPTUHVSA-N	0	3	347.462	3.217	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1ccccc1O[C@@H](C)CC	ZINC001155513953	1380463026	/nfs/dbraw/zinc/46/30/26/1380463026.db2.gz	FMRGTDBNDFJADE-SJORKVTESA-N	0	3	330.472	3.327	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)[C@H](C)C(C)C	ZINC001155581319	1380470520	/nfs/dbraw/zinc/47/05/20/1380470520.db2.gz	PVJMXYSCIROOJX-HUUCEWRRSA-N	0	3	333.451	3.316	20	30		EGEDHN
CC[C@@H](CC1CCCC1)C(=O)NC[C@@H](C)N(CC)CC#CCOC	ZINC001155606839	1380472970	/nfs/dbraw/zinc/47/29/70/1380472970.db2.gz	AVTXAYBPLGKFCX-MJGOQNOKSA-N	0	3	336.520	3.069	20	30		EGEDHN
C=CCOCCCC(=O)NCCCNCc1cc(Cl)ccc1F	ZINC001156160555	1380533754	/nfs/dbraw/zinc/53/37/54/1380533754.db2.gz	UOVWZMBVVZFIJO-UHFFFAOYSA-N	0	3	342.842	3.058	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)Cc1ccccc1C	ZINC001156819946	1380649464	/nfs/dbraw/zinc/64/94/64/1380649464.db2.gz	SHCWLEGMQZENHZ-GOSISDBHSA-N	0	3	349.478	3.436	20	30		EGEDHN
C#CCCCCC(=O)NCCCNCc1nc(C(C)(C)C)cs1	ZINC001156827974	1380663701	/nfs/dbraw/zinc/66/37/01/1380663701.db2.gz	QFGOLKFGYPFFHL-UHFFFAOYSA-N	0	3	335.517	3.230	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)C2=CCCCCC2)c(F)c1	ZINC001157048922	1380760885	/nfs/dbraw/zinc/76/08/85/1380760885.db2.gz	QRAQRCZGXVQTQC-UHFFFAOYSA-N	0	3	329.419	3.184	20	30		EGEDHN
CSCCC(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(C#N)cc1	ZINC001157498733	1380947125	/nfs/dbraw/zinc/94/71/25/1380947125.db2.gz	GXSSJSNRMIHQLI-GOSISDBHSA-N	0	3	345.512	3.124	20	30		EGEDHN
C=C(Cl)CNCC1(O)CCN(C(=O)C2(CC)CCCCC2)CC1	ZINC001328218098	1388690914	/nfs/dbraw/zinc/69/09/14/1388690914.db2.gz	WCXNQKPMPUTONK-UHFFFAOYSA-N	0	3	342.911	3.043	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)CC(C)(C)C)CCN1Cc1ccc(C#N)cc1	ZINC001328224742	1388692620	/nfs/dbraw/zinc/69/26/20/1388692620.db2.gz	ULSDASVYVDUCLB-CRAIPNDOSA-N	0	3	327.472	3.464	20	30		EGEDHN
N#Cc1cc(C(F)(F)N2CCN[C@H](c3ccccc3)C2)cc(Cl)n1	ZINC001157759360	1381024206	/nfs/dbraw/zinc/02/42/06/1381024206.db2.gz	OFGGRALBOBAAET-HNNXBMFYSA-N	0	3	348.784	3.302	20	30		EGEDHN
C#CCCCCC(=O)N1CCCC[C@@H]1CN(C)C[C@@H]1CCCCO1	ZINC001157856855	1381052405	/nfs/dbraw/zinc/05/24/05/1381052405.db2.gz	PNNWRXVZFZTAHR-MOPGFXCFSA-N	0	3	334.504	3.062	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCCC[C@@H]1CN(C)CCOCC1CC1	ZINC001157995003	1381096342	/nfs/dbraw/zinc/09/63/42/1381096342.db2.gz	ZRCYMQWYJXKGPX-HXUWFJFHSA-N	0	3	348.531	3.494	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)[C@H]1CCCC2(CC2)C1	ZINC001158002379	1381098962	/nfs/dbraw/zinc/09/89/62/1381098962.db2.gz	DHMFVGNBJBACLN-INIZCTEOSA-N	0	3	325.456	3.125	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)Cc1ccc(OC)cc1C	ZINC001158011663	1381102110	/nfs/dbraw/zinc/10/21/10/1381102110.db2.gz	KBZZVFMQMVLQBM-GOSISDBHSA-N	0	3	330.472	3.045	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccn(C2CCCC2)n1	ZINC001158024310	1381106195	/nfs/dbraw/zinc/10/61/95/1381106195.db2.gz	MGZGSENTLIBJGD-QGZVFWFLSA-N	0	3	330.476	3.111	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cnn(C(C)(C)C)c1C	ZINC001158036094	1381109228	/nfs/dbraw/zinc/10/92/28/1381109228.db2.gz	ZKYYZJAVIUSOCD-MRXNPFEDSA-N	0	3	332.492	3.059	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cnc(CC2CC2)s1	ZINC001158276759	1381182552	/nfs/dbraw/zinc/18/25/52/1381182552.db2.gz	GQCIJPJCBVYEST-OAHLLOKOSA-N	0	3	333.501	3.208	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc2ccccc2n1C	ZINC001158405299	1381233396	/nfs/dbraw/zinc/23/33/96/1381233396.db2.gz	QBZJNQXMSRSFLV-QGZVFWFLSA-N	0	3	325.456	3.291	20	30		EGEDHN
Cc1nc(Cl)nc(N(C2CCCC2)C2CCN(C)CC2)c1C#N	ZINC001158488155	1381264934	/nfs/dbraw/zinc/26/49/34/1381264934.db2.gz	KMXCESSQJSZCGB-UHFFFAOYSA-N	0	3	333.867	3.153	20	30		EGEDHN
Cc1scc(C(=O)NCCCNCc2ccccc2C#N)c1C	ZINC001158798911	1381404350	/nfs/dbraw/zinc/40/43/50/1381404350.db2.gz	VSPZYZADMLEMRC-UHFFFAOYSA-N	0	3	327.453	3.146	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H]1Cc2ccc(Cl)cc21	ZINC001158811953	1381412087	/nfs/dbraw/zinc/41/20/87/1381412087.db2.gz	VOHXBVKCADKNOK-AEFFLSMTSA-N	0	3	332.875	3.479	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)COc1ccc(CC)cc1	ZINC001158825032	1381418364	/nfs/dbraw/zinc/41/83/64/1381418364.db2.gz	JEPHZDPGWCIVRH-GOSISDBHSA-N	0	3	330.472	3.127	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H](C)COc1ccccc1	ZINC001158866538	1381441370	/nfs/dbraw/zinc/44/13/70/1381441370.db2.gz	QJWDGUOCHVGVBX-QZTJIDSGSA-N	0	3	330.472	3.200	20	30		EGEDHN
Cc1cc(C)c(C(=O)NCCCNCc2ccc(C#N)cc2F)s1	ZINC001158945115	1381478209	/nfs/dbraw/zinc/47/82/09/1381478209.db2.gz	GSZAMNWGRZXGGW-UHFFFAOYSA-N	0	3	345.443	3.285	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)CCc1cccc(F)c1F	ZINC001158971333	1381491688	/nfs/dbraw/zinc/49/16/88/1381491688.db2.gz	QJBMRHMLZVBLKD-MRXNPFEDSA-N	0	3	336.426	3.396	20	30		EGEDHN
N#Cc1c2c(sc1N=C1CCN(c3ccccc3)CC1)CNCC2	ZINC001159159428	1381682438	/nfs/dbraw/zinc/68/24/38/1381682438.db2.gz	HTJFSZAGBNGELA-UHFFFAOYSA-N	0	3	336.464	3.472	20	30		EGEDHN
C=CCCC(=O)NCCC1=CCN(Cc2ccc(C)nc2C)CC1	ZINC001159538562	1381821938	/nfs/dbraw/zinc/82/19/38/1381821938.db2.gz	BLQHOPSSHCVJQF-UHFFFAOYSA-N	0	3	327.472	3.303	20	30		EGEDHN
C=CCOCC(=O)NCCC1=CCN(C/C=C/c2ccccc2)CC1	ZINC001159600928	1381843803	/nfs/dbraw/zinc/84/38/03/1381843803.db2.gz	JGKKPTUPQIEJNY-RMKNXTFCSA-N	0	3	340.467	3.041	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@H](CC)OC2CCCCC2)CC1	ZINC001160131296	1382008368	/nfs/dbraw/zinc/00/83/68/1382008368.db2.gz	KIQVQXKIEQFCMB-FQEVSTJZSA-N	0	3	346.515	3.276	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C[C@@H](OCC)C2=CCCC2)CC1	ZINC001160131520	1382008897	/nfs/dbraw/zinc/00/88/97/1382008897.db2.gz	PNLRYRNPDLNPIL-LJQANCHMSA-N	0	3	332.488	3.216	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cscc2C(F)F)CC1	ZINC001160162513	1382021045	/nfs/dbraw/zinc/02/10/45/1382021045.db2.gz	DJQPXUKIPNCGFK-UHFFFAOYSA-N	0	3	338.423	3.461	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2c(F)ccc3ccncc32)CC1	ZINC001160190124	1382029177	/nfs/dbraw/zinc/02/91/77/1382029177.db2.gz	RYQOQPIENJFRBP-UHFFFAOYSA-N	0	3	339.414	3.312	20	30		EGEDHN
N#CCN(Cc1ccccc1)C(=O)[C@H]1CCC[C@H](c2ccccc2)N1	ZINC001160670020	1382166148	/nfs/dbraw/zinc/16/61/48/1382166148.db2.gz	PWZMBQOXNVTWEA-WOJBJXKFSA-N	0	3	333.435	3.422	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CCCOc2ccccc2C)CC1	ZINC001160828384	1382210974	/nfs/dbraw/zinc/21/09/74/1382210974.db2.gz	IVPXHSSPCYLYBV-UHFFFAOYSA-N	0	3	342.483	3.478	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCC1=CCN(CCOCC2CC2)CC1	ZINC001160941210	1382244578	/nfs/dbraw/zinc/24/45/78/1382244578.db2.gz	LNZMXNNYYISTNA-DLBZAZTESA-N	0	3	334.504	3.010	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)[C@@H]1C[C@H]1c1ccsc1	ZINC001160946103	1382246802	/nfs/dbraw/zinc/24/68/02/1382246802.db2.gz	VOHPSKZNMYVZQA-ZWKOTPCHSA-N	0	3	339.464	3.019	20	30		EGEDHN
C=CCN1CCC[C@H]1CNc1nc(Cl)nc2cccc(OC)c21	ZINC001160954205	1382250218	/nfs/dbraw/zinc/25/02/18/1382250218.db2.gz	QXGQITAHOJGFGO-LBPRGKRZSA-N	0	3	332.835	3.354	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCCC1=CCN(CCOCC2CC2)CC1	ZINC001160967425	1382254316	/nfs/dbraw/zinc/25/43/16/1382254316.db2.gz	IQVNWDVGYMHNOZ-QGZVFWFLSA-N	0	3	334.504	3.154	20	30		EGEDHN
N#Cc1cc(Cl)cnc1NCC1CCN(Cc2ccccn2)CC1	ZINC001161246303	1382353626	/nfs/dbraw/zinc/35/36/26/1382353626.db2.gz	OULDIELQYRESAO-UHFFFAOYSA-N	0	3	341.846	3.326	20	30		EGEDHN
C=CCN(C(=O)[C@]1(N)CCc2cc(F)ccc2C1)C1CCCCC1	ZINC001161247752	1382354092	/nfs/dbraw/zinc/35/40/92/1382354092.db2.gz	JEKRHMYOLOZHKV-FQEVSTJZSA-N	0	3	330.447	3.359	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H]2CCc3cccc(OC)c32)CC1	ZINC001161427697	1382406806	/nfs/dbraw/zinc/40/68/06/1382406806.db2.gz	NQCHBOYIILLUNS-SFHVURJKSA-N	0	3	340.467	3.049	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H]2C[C@H]2c2ccccc2F)CC1	ZINC001161427375	1382406944	/nfs/dbraw/zinc/40/69/44/1382406944.db2.gz	JWDTVMNPEGSEJG-ZWKOTPCHSA-N	0	3	328.431	3.254	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@H]2C[C@@]23CCc2ccccc23)CC1	ZINC001161617809	1382461019	/nfs/dbraw/zinc/46/10/19/1382461019.db2.gz	UDXPDSYOZZBHIN-FYYLOGMGSA-N	0	3	348.490	3.052	20	30		EGEDHN
CN1CCN(CCCNc2ccc(C3(C#N)CCCCC3)cc2)CC1	ZINC001161708228	1382486482	/nfs/dbraw/zinc/48/64/82/1382486482.db2.gz	DEXYMUOCMNBZQO-UHFFFAOYSA-N	0	3	340.515	3.461	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc(OC(C)C)cc2)CC1	ZINC001161818552	1382519704	/nfs/dbraw/zinc/51/97/04/1382519704.db2.gz	ZIZYXDCPKMQYKT-UHFFFAOYSA-N	0	3	340.467	3.249	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H](C)Cc2cccc(F)c2)CC1	ZINC001161983308	1382587524	/nfs/dbraw/zinc/58/75/24/1382587524.db2.gz	ZVUQIIRAKYDTAU-INIZCTEOSA-N	0	3	330.447	3.329	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C(C)(C)c2ccccc2C)CC1	ZINC001162007917	1382598823	/nfs/dbraw/zinc/59/88/23/1382598823.db2.gz	WFEFTODTZILESC-UHFFFAOYSA-N	0	3	338.495	3.434	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCC1(COC)CCN(C[C@H](F)CC)CC1	ZINC001162288123	1382722587	/nfs/dbraw/zinc/72/25/87/1382722587.db2.gz	INDHSWKQSQTPQX-MRXNPFEDSA-N	0	3	342.499	3.182	20	30		EGEDHN
C[C@H](N)c1nc2ccccc2n1-c1cc(Cl)nc2[nH]cc(C#N)c21	ZINC001162761972	1382861939	/nfs/dbraw/zinc/86/19/39/1382861939.db2.gz	AIVQUVQUOCOQOJ-VIFPVBQESA-N	0	3	336.786	3.447	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C1(CC(C)C)CC1	ZINC001162827425	1382888306	/nfs/dbraw/zinc/88/83/06/1382888306.db2.gz	XOJNSZJXSZBGEE-UHFFFAOYSA-N	0	3	340.511	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1C[C@@H]2CCCC[C@H]12	ZINC001162871781	1382900616	/nfs/dbraw/zinc/90/06/16/1382900616.db2.gz	YQOJKLXPUPIVHJ-PCCBWWKXSA-N	0	3	338.495	3.107	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@](C)(CC)CCC	ZINC001162964619	1382930073	/nfs/dbraw/zinc/93/00/73/1382930073.db2.gz	ZTYOPGKZZCOKNI-NRFANRHFSA-N	0	3	328.500	3.497	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CC12CCCC2	ZINC001162977131	1382934157	/nfs/dbraw/zinc/93/41/57/1382934157.db2.gz	GOAJEUNWTMCYLS-HXUWFJFHSA-N	0	3	338.495	3.251	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C(C)(C)CC(C)C	ZINC001162977189	1382935053	/nfs/dbraw/zinc/93/50/53/1382935053.db2.gz	JMXGRCIMIPTVCM-UHFFFAOYSA-N	0	3	328.500	3.353	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C[C@@H](C)C(C)(C)C	ZINC001162992592	1382940276	/nfs/dbraw/zinc/94/02/76/1382940276.db2.gz	SWJBJLBLVMWPJU-GOSISDBHSA-N	0	3	328.500	3.353	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C[C@H]1CCCC[C@H]1C	ZINC001163007738	1382947372	/nfs/dbraw/zinc/94/73/72/1382947372.db2.gz	XZIUIIKJDIQLKI-TZIWHRDSSA-N	0	3	340.511	3.497	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)NCCC1(CNCC#Cc2ccccc2Cl)CC1	ZINC001163238532	1383002530	/nfs/dbraw/zinc/00/25/30/1383002530.db2.gz	YYSMZMQIPUQGJI-RDJZCZTQSA-N	0	3	344.886	3.224	20	30		EGEDHN
Cc1ccc(C(=O)NCCC2(CNCc3ccccc3C#N)CC2)o1	ZINC001163299488	1383015850	/nfs/dbraw/zinc/01/58/50/1383015850.db2.gz	TWQBHZLRTVFUGB-UHFFFAOYSA-N	0	3	337.423	3.150	20	30		EGEDHN
Cc1ccc(F)cc1C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001163514489	1383070791	/nfs/dbraw/zinc/07/07/91/1383070791.db2.gz	DNUMPQOSCGNACE-UHFFFAOYSA-N	0	3	343.377	3.055	20	30		EGEDHN
N#Cc1ccc(F)c(CNCC2(CCNC(=O)/C=C\C3CC3)CC2)c1	ZINC001163939884	1383137772	/nfs/dbraw/zinc/13/77/72/1383137772.db2.gz	GSYMZJSPVNYRMZ-XQRVVYSFSA-N	0	3	341.430	3.040	20	30		EGEDHN
CC1(C)CCC[C@H]1C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001164171239	1383162677	/nfs/dbraw/zinc/16/26/77/1383162677.db2.gz	JZKHAIMXFZQJCP-INIZCTEOSA-N	0	3	331.435	3.120	20	30		EGEDHN
C#CCCCCC(=O)NCCC1(CNCc2c(C)noc2CC)CC1	ZINC001164178626	1383163383	/nfs/dbraw/zinc/16/33/83/1383163383.db2.gz	BOEZVIVPOPPOBU-UHFFFAOYSA-N	0	3	345.487	3.115	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NCCC1(CNCc2cc(C)no2)CC1	ZINC001164691893	1383218241	/nfs/dbraw/zinc/21/82/41/1383218241.db2.gz	DEWGPUHIQINKEY-UHFFFAOYSA-N	0	3	339.867	3.138	20	30		EGEDHN
C=C(C)CCC(=O)NCCC1(CNCc2cc(C#N)ccc2F)CC1	ZINC001165258756	1383259368	/nfs/dbraw/zinc/25/93/68/1383259368.db2.gz	ONBIALJHFLIETM-UHFFFAOYSA-N	0	3	343.446	3.430	20	30		EGEDHN
CCCc1ccc(C(=O)NCCCNCc2ccccc2C#N)cc1	ZINC001165490647	1383302541	/nfs/dbraw/zinc/30/25/41/1383302541.db2.gz	OXRDABHPKQVHHU-UHFFFAOYSA-N	0	3	335.451	3.420	20	30		EGEDHN
N#Cc1ccccc1CNCC1(CCNC(=O)Cc2ccccc2)CC1	ZINC001165782154	1383344264	/nfs/dbraw/zinc/34/42/64/1383344264.db2.gz	MSMHQKCSAWWXRY-UHFFFAOYSA-N	0	3	347.462	3.177	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCC1(CNCc2ccncc2Cl)CC1	ZINC001166574909	1383440281	/nfs/dbraw/zinc/44/02/81/1383440281.db2.gz	ZOXXLCFHCPFJSR-UHFFFAOYSA-N	0	3	335.879	3.323	20	30		EGEDHN
C=CCC1(C(=O)NCCC2(CNCc3conc3CC)CC2)CCC1	ZINC001167035249	1383524348	/nfs/dbraw/zinc/52/43/48/1383524348.db2.gz	DBLLUAMJEMJRMD-UHFFFAOYSA-N	0	3	345.487	3.360	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCC2(CNCc3cccc(Cl)n3)CC2)C1	ZINC001167130641	1383547757	/nfs/dbraw/zinc/54/77/57/1383547757.db2.gz	RJTTZIHHYSBXRZ-UHFFFAOYSA-N	0	3	347.890	3.467	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)C1[C@@H]2CCCCCC[C@@H]12	ZINC001167296348	1383588503	/nfs/dbraw/zinc/58/85/03/1383588503.db2.gz	NWAWDQNHUBIIDY-RTBURBONSA-N	0	3	339.483	3.371	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@H]2CCc3ccccc3C2)CC1	ZINC001167328773	1383599556	/nfs/dbraw/zinc/59/95/56/1383599556.db2.gz	TWGCIHAKLWNUMW-SFHVURJKSA-N	0	3	346.902	3.420	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)[C@H](C)C(C)C)CC1	ZINC001167374193	1383614300	/nfs/dbraw/zinc/61/43/00/1383614300.db2.gz	TXRQNYHZKOAXMD-CYBMUJFWSA-N	0	3	331.298	3.063	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2oc(C3CC3)nc2C)CC1	ZINC001167416913	1383627876	/nfs/dbraw/zinc/62/78/76/1383627876.db2.gz	JFBZZNBIHOLZPC-UHFFFAOYSA-N	0	3	337.851	3.103	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@H](c2cccnc2)C(C)C)CC1	ZINC001167535096	1383659363	/nfs/dbraw/zinc/65/93/63/1383659363.db2.gz	JONMQCCXGNWLBH-KRWDZBQOSA-N	0	3	349.906	3.450	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@H](C)CC1CCCC1	ZINC001167557272	1383667422	/nfs/dbraw/zinc/66/74/22/1383667422.db2.gz	PIIDARMEFTYSID-GFCCVEGCSA-N	0	3	331.298	3.207	20	30		EGEDHN
CC1(C)C2CCC1(C(=O)NCCCNCc1ccccc1C#N)CC2	ZINC001167858581	1383760356	/nfs/dbraw/zinc/76/03/56/1383760356.db2.gz	LOTLIEKGKGSTPJ-UHFFFAOYSA-N	0	3	339.483	3.371	20	30		EGEDHN
C[C@H](Cc1ccc(Cl)cc1)N1CCN(c2cc(C#N)ccn2)CC1	ZINC001168187551	1383839225	/nfs/dbraw/zinc/83/92/25/1383839225.db2.gz	GYUSSNPBQBRVRO-OAHLLOKOSA-N	0	3	340.858	3.360	20	30		EGEDHN
CC(C)=CC(=O)N[C@H](C)CCCCNCc1cc(F)ccc1C#N	ZINC001168950615	1384068459	/nfs/dbraw/zinc/06/84/59/1384068459.db2.gz	FHJUOXJRRCQJOC-OAHLLOKOSA-N	0	3	331.435	3.428	20	30		EGEDHN
CNC(=O)N[C@H]1CCCN(Cc2ccc(-c3ccccc3C#N)cc2)C1	ZINC001308077424	1384087823	/nfs/dbraw/zinc/08/78/23/1384087823.db2.gz	XVPHJTVTNOXKGW-IBGZPJMESA-N	0	3	348.450	3.119	20	30		EGEDHN
CS[C@@H](C)C(=O)N[C@@H](C)CCCCNCc1ccccc1C#N	ZINC001169343980	1384138623	/nfs/dbraw/zinc/13/86/23/1384138623.db2.gz	VNVZNPPAAQMIOO-GJZGRUSLSA-N	0	3	333.501	3.074	20	30		EGEDHN
C=CCOc1ccccc1[C@H](C)N[C@H]1CC[C@H](C(=O)OCC)OC1	ZINC001169347740	1384138820	/nfs/dbraw/zinc/13/88/20/1384138820.db2.gz	KPFXTJFKOJSDRW-RLFYNMQTSA-N	0	3	333.428	3.013	20	30		EGEDHN
C[C@@H]1CCN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(CC#N)cc1	ZINC001169527867	1384156465	/nfs/dbraw/zinc/15/64/65/1384156465.db2.gz	QZZCZSDHCJPUER-UTKZUKDTSA-N	0	3	347.462	3.393	20	30		EGEDHN
CC(C)(CC(F)(F)F)C(=O)NCCCNCc1ccccc1C#N	ZINC001170289152	1384282798	/nfs/dbraw/zinc/28/27/98/1384282798.db2.gz	FJSJCGBYBMQQPG-UHFFFAOYSA-N	0	3	341.377	3.133	20	30		EGEDHN
Cc1nc(CNCCCC[C@H](C)NC(=O)C#CC(C)C)sc1C	ZINC001170639936	1384355524	/nfs/dbraw/zinc/35/55/24/1384355524.db2.gz	XLOLIGWHSLSBQT-AWEZNQCLSA-N	0	3	335.517	3.184	20	30		EGEDHN
CC(C)C[C@@H](C)CC(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001170828416	1384393410	/nfs/dbraw/zinc/39/34/10/1384393410.db2.gz	BKPQAVLZYRWWMH-OAHLLOKOSA-N	0	3	333.451	3.366	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H](C)CCCCNCc1nnc(C(C)C)[nH]1	ZINC001171007097	1384428364	/nfs/dbraw/zinc/42/83/64/1384428364.db2.gz	FIAWDKYBQLAXJF-HNNXBMFYSA-N	0	3	349.523	3.295	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H](C)CCCCNCc1ncc(Cl)n1C	ZINC001171044450	1384435796	/nfs/dbraw/zinc/43/57/96/1384435796.db2.gz	YOEYQOACKIOUGB-CQSZACIVSA-N	0	3	340.899	3.194	20	30		EGEDHN
CC[C@H](C)[C@H]([NH2+][C@H]1CCc2cc(Cl)c(Cl)cc2C1)C(=O)N[O-]	ZINC001171150402	1384454910	/nfs/dbraw/zinc/45/49/10/1384454910.db2.gz	RJOSJDHFYOAEDP-FMSQNYNMSA-N	0	3	345.270	3.360	20	30		EGEDHN
COc1ccc(N2CCN([C@@H](C)Cc3cccc(C#N)c3)CC2)cc1	ZINC001171203297	1384467924	/nfs/dbraw/zinc/46/79/24/1384467924.db2.gz	LCUXASKHFHYRFV-KRWDZBQOSA-N	0	3	335.451	3.320	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1CCN(CCc2ccccc2)CC1	ZINC001171221222	1384471815	/nfs/dbraw/zinc/47/18/15/1384471815.db2.gz	JFOQFMQHQFNEKX-LJQANCHMSA-N	0	3	333.479	3.350	20	30		EGEDHN
C[C@@H](Cc1cccc(C#N)c1)N1CC[C@@H](N(C)C(=O)OC(C)(C)C)C1	ZINC001171224716	1384473304	/nfs/dbraw/zinc/47/33/04/1384473304.db2.gz	UUOAOPBLKPJRIB-MAUKXSAKSA-N	0	3	343.471	3.430	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1CC[C@H](N2Cc3ccccc3C2=O)C1	ZINC001171230281	1384475081	/nfs/dbraw/zinc/47/50/81/1384475081.db2.gz	CAISKCUVZOPJIJ-UZLBHIALSA-N	0	3	345.446	3.220	20	30		EGEDHN
Cc1cncnc1OC1CCN([C@@H](C)Cc2cccc(C#N)c2)CC1	ZINC001171233067	1384476091	/nfs/dbraw/zinc/47/60/91/1384476091.db2.gz	ZAVKUBXVAMLNOX-INIZCTEOSA-N	0	3	336.439	3.131	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1ccc(C(C)C)cc1	ZINC001171875372	1384668015	/nfs/dbraw/zinc/66/80/15/1384668015.db2.gz	LIVPSGPMHOOLOU-UHFFFAOYSA-N	0	3	339.277	3.428	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)NCc1cc(OCC2CCC2)ncn1	ZINC001172300159	1384762959	/nfs/dbraw/zinc/76/29/59/1384762959.db2.gz	RQZHIASDSCUIPD-HNNXBMFYSA-N	0	3	336.439	3.248	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)N1CCC[C@H](NC(=O)OC(C)(C)C)C1	ZINC001172307165	1384765090	/nfs/dbraw/zinc/76/50/90/1384765090.db2.gz	CLYWUYBOMLFVQE-QAPCUYQASA-N	0	3	343.471	3.478	20	30		EGEDHN
C[C@H](CCCC#N)N1CCO[C@@H]2C[C@H](COc3ccccn3)C[C@H]21	ZINC001172500431	1384806521	/nfs/dbraw/zinc/80/65/21/1384806521.db2.gz	ZKZGSWAKVFLBHR-BRSBDYLESA-N	0	3	329.444	3.022	20	30		EGEDHN
C[C@@H](N[C@@H]1CCN(C(=O)OC(C)(C)C)[C@H](C#N)C1)c1cccc(O)c1	ZINC001172972204	1384892759	/nfs/dbraw/zinc/89/27/59/1384892759.db2.gz	XLVGUGVMOUXOSG-BMFZPTHFSA-N	0	3	345.443	3.334	20	30		EGEDHN
CC[C@H](CC#N)NC1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1	ZINC001173009571	1384897704	/nfs/dbraw/zinc/89/77/04/1384897704.db2.gz	XNUPDLCUFGXYDO-LLVKDONJSA-N	0	3	338.358	3.124	20	30		EGEDHN
CO[C@H](CN1CCN(C2CCC(C)(C#N)CC2)CC1)c1ccccc1	ZINC001173599110	1384985265	/nfs/dbraw/zinc/98/52/65/1384985265.db2.gz	ZNEADUMLYNMMCE-NYLDSWQDSA-N	0	3	341.499	3.464	20	30		EGEDHN
CCC[C@H](OC)C(=O)N[C@@H](C)CCCCNCc1ccccc1C#N	ZINC001174649888	1385129980	/nfs/dbraw/zinc/12/99/80/1385129980.db2.gz	KWNCOVDWWKILDR-LPHOPBHVSA-N	0	3	345.487	3.138	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H](C)CCCCNCc1ccn(C(C)C)n1	ZINC001174683630	1385134165	/nfs/dbraw/zinc/13/41/65/1385134165.db2.gz	UNDQTUPTWYYGIZ-MRXNPFEDSA-N	0	3	334.508	3.441	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H](C)CCCCNCc1nc(C)cs1	ZINC001174797660	1385150213	/nfs/dbraw/zinc/15/02/13/1385150213.db2.gz	BIVZWHXWKLHXPZ-HNNXBMFYSA-N	0	3	335.517	3.410	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H](C)CCCCNCc1nccn1CC	ZINC001174848714	1385159500	/nfs/dbraw/zinc/15/95/00/1385159500.db2.gz	GQRXCYCDBGDNBU-DLBZAZTESA-N	0	3	334.508	3.270	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H](C)CCCCNCc1nnc(C(C)C)[nH]1	ZINC001174850092	1385160158	/nfs/dbraw/zinc/16/01/58/1385160158.db2.gz	SYCDHPRGQLMIMN-CVEARBPZSA-N	0	3	349.523	3.295	20	30		EGEDHN
CCCC1(C(=O)NCCN(CC)Cc2ccc(C#N)cc2)CCC1	ZINC001317485346	1385182734	/nfs/dbraw/zinc/18/27/34/1385182734.db2.gz	SYGOYRXDSQHOMJ-UHFFFAOYSA-N	0	3	327.472	3.467	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](C)CCCCN[C@@H](C)c2nnc(C)[nH]2)CC1	ZINC001175073824	1385189880	/nfs/dbraw/zinc/18/98/80/1385189880.db2.gz	ITYPANTVUOHFCL-GJZGRUSLSA-N	0	3	347.507	3.185	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](C)CCCCNCc2cc(C)n(C)n2)CC1	ZINC001175074791	1385190941	/nfs/dbraw/zinc/19/09/41/1385190941.db2.gz	ZUVLOUQBQLLUGI-INIZCTEOSA-N	0	3	346.519	3.240	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H](C)CCCCNCc2cc(OC)no2)CC1	ZINC001175081969	1385191432	/nfs/dbraw/zinc/19/14/32/1385191432.db2.gz	LNNXOWXVBTXETF-HNNXBMFYSA-N	0	3	349.475	3.194	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@H](C)CCCCNCc1cc(C)n(C)n1	ZINC001175081938	1385191510	/nfs/dbraw/zinc/19/15/10/1385191510.db2.gz	LBBPZPBNVONLEW-DNVCBOLYSA-N	0	3	334.508	3.095	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)C1(c2ccc(Cl)cc2)CC1	ZINC001175415594	1385280578	/nfs/dbraw/zinc/28/05/78/1385280578.db2.gz	MSRMGACDHGSZRM-UHFFFAOYSA-N	0	3	327.255	3.220	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)[C@H](C)CCc1cccc(F)c1	ZINC001176628717	1385643428	/nfs/dbraw/zinc/64/34/28/1385643428.db2.gz	XEKMEHZAJLAKEN-CYBMUJFWSA-N	0	3	326.843	3.243	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1cccc(COC)c1)C1CC1	ZINC001318708135	1385845297	/nfs/dbraw/zinc/84/52/97/1385845297.db2.gz	UGERZSMSWPMAHG-SFHVURJKSA-N	0	3	336.863	3.074	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)c1ccccn1	ZINC001177187745	1385851551	/nfs/dbraw/zinc/85/15/51/1385851551.db2.gz	QWKPZTIMPGIMFL-UHFFFAOYSA-N	0	3	335.879	3.446	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NCCCNCc1cccc(Cl)c1Cl	ZINC001177273719	1385893031	/nfs/dbraw/zinc/89/30/31/1385893031.db2.gz	XFFRQXRYIKPZRR-LBPRGKRZSA-N	0	3	345.270	3.180	20	30		EGEDHN
C=CCc1ccc(OC[C@H](O)CN2CC(C)(C)C2(C)C)c(OC)c1	ZINC001318972053	1385903190	/nfs/dbraw/zinc/90/31/90/1385903190.db2.gz	YXPSFLYVRAADDX-MRXNPFEDSA-N	0	3	333.472	3.284	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)C1(CF)CC1	ZINC001177413591	1385947791	/nfs/dbraw/zinc/94/77/91/1385947791.db2.gz	WSOIPCOYNAJPCY-UHFFFAOYSA-N	0	3	330.875	3.487	20	30		EGEDHN
CC1(C)C(C)(C)C1(C)C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001177540280	1385989813	/nfs/dbraw/zinc/98/98/13/1385989813.db2.gz	OSOJKRPXBAQJKL-UHFFFAOYSA-N	0	3	345.462	3.366	20	30		EGEDHN
N#Cc1ccc(F)cc1CNCCCCCCNC(=O)c1ccco1	ZINC001177771718	1386040428	/nfs/dbraw/zinc/04/04/28/1386040428.db2.gz	WQIUZDNHSVBVGP-UHFFFAOYSA-N	0	3	343.402	3.370	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)C3=CCCC3)CCCC2)c(F)c1	ZINC001319351889	1386074704	/nfs/dbraw/zinc/07/47/04/1386074704.db2.gz	QASUXZSRQVVXPC-UHFFFAOYSA-N	0	3	341.430	3.326	20	30		EGEDHN
N#CC(Cc1cccs1)C(=O)Nc1cn2c(cccc2Cl)n1	ZINC001177909828	1386080701	/nfs/dbraw/zinc/08/07/01/1386080701.db2.gz	ZOVQGRZZYQMNGQ-JTQLQIEISA-N	0	3	330.800	3.370	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2sc(C)nc2C)CCCC1	ZINC001319387223	1386097577	/nfs/dbraw/zinc/09/75/77/1386097577.db2.gz	XWLZIIUOKSNEFD-UHFFFAOYSA-N	0	3	327.881	3.145	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCCCCCN[C@H](C)c1c(F)cccc1F	ZINC001178059829	1386119230	/nfs/dbraw/zinc/11/92/30/1386119230.db2.gz	RDOVUXNORSCXLO-ZIAGYGMSSA-N	0	3	337.414	3.452	20	30		EGEDHN
C=C(C)CCC(=O)NCCCCCCNCc1ncc(Cl)n1C	ZINC001178596367	1386258534	/nfs/dbraw/zinc/25/85/34/1386258534.db2.gz	LKWXQZNFBLXGMR-UHFFFAOYSA-N	0	3	340.899	3.196	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@H](N[C@@H](C)c2ccc(F)cc2F)[C@@H]1C	ZINC001178637696	1386266241	/nfs/dbraw/zinc/26/62/41/1386266241.db2.gz	QIYURFAVAHNKGG-DEYYWGMASA-N	0	3	334.410	3.264	20	30		EGEDHN
Cc1cccc(Cl)c1CN[C@H]1CCN(C(=O)C#CC(C)C)[C@H]1C	ZINC001178653692	1386269986	/nfs/dbraw/zinc/26/99/86/1386269986.db2.gz	ZHBFFNAPRYZYJQ-YJBOKZPZSA-N	0	3	332.875	3.387	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccc(F)cc2)CCN1C(=O)C1(F)CCCC1	ZINC001179022242	1386378990	/nfs/dbraw/zinc/37/89/90/1386378990.db2.gz	LBGPREMJNUWIBY-YJBOKZPZSA-N	0	3	346.421	3.039	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCCCCCNCc2ocnc2C)cc1	ZINC001179203560	1386423840	/nfs/dbraw/zinc/42/38/40/1386423840.db2.gz	HVFDQIOYUJFVSY-UHFFFAOYSA-N	0	3	339.439	3.044	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCCCCCNCc1ccn(CC)n1	ZINC001179306326	1386444934	/nfs/dbraw/zinc/44/49/34/1386444934.db2.gz	HDJIAEKLMJXEQP-DLBZAZTESA-N	0	3	334.508	3.127	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](NCc2scnc2C)[C@@H]1C	ZINC001179313379	1386448360	/nfs/dbraw/zinc/44/83/60/1386448360.db2.gz	BZLXYLSZIWVJFY-HOTGVXAUSA-N	0	3	333.501	3.114	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCCCCCCNCc1cc2n(n1)CCC2	ZINC001179339953	1386456117	/nfs/dbraw/zinc/45/61/17/1386456117.db2.gz	QEHIKWLIZLFTKX-QGZVFWFLSA-N	0	3	346.519	3.198	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](NCc2cccc(OCC)n2)[C@@H]1C	ZINC001179364171	1386464357	/nfs/dbraw/zinc/46/43/57/1386464357.db2.gz	GNSVLEOSUXLQJV-BQFCYCMXSA-N	0	3	345.487	3.162	20	30		EGEDHN
CCc1ccccc1C(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C	ZINC001179435188	1386483025	/nfs/dbraw/zinc/48/30/25/1386483025.db2.gz	MZADMMPREHKCOR-AVRDEDQJSA-N	0	3	346.474	3.493	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)C1(F)CCCCC1	ZINC001179848338	1386606855	/nfs/dbraw/zinc/60/68/55/1386606855.db2.gz	BRTWYMFCCBVOMJ-HKUYNNGSSA-N	0	3	342.458	3.290	20	30		EGEDHN
CCCCCCCCC(=O)N1CC[C@H](NCc2cnn(C)c2)[C@@H]1C	ZINC001179994503	1386663321	/nfs/dbraw/zinc/66/33/21/1386663321.db2.gz	QNUWPGQLSCWEJO-WMZOPIPTSA-N	0	3	334.508	3.250	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2CC2)C[C@@]1(C)CNCc1cc(F)ccc1C#N	ZINC001180370513	1386777763	/nfs/dbraw/zinc/77/77/63/1386777763.db2.gz	YVEZFNOZGOTLKU-JLTOFOAXSA-N	0	3	343.446	3.072	20	30		EGEDHN
CS[C@@H]1CC[C@@H](N(C)[C@H]2CCCN(c3ccc(C#N)cc3)C2=O)C1	ZINC001321021877	1386785929	/nfs/dbraw/zinc/78/59/29/1386785929.db2.gz	MXVDGFGZNAIETM-KURKYZTESA-N	0	3	343.496	3.270	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2nc(C)cs2)C1	ZINC001181173252	1386952394	/nfs/dbraw/zinc/95/23/94/1386952394.db2.gz	FEPYQVKGJMUXQX-DNVCBOLYSA-N	0	3	347.528	3.219	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](C)[C@](C)(CNCc2cc(C)no2)C1	ZINC001181594496	1387022412	/nfs/dbraw/zinc/02/24/12/1387022412.db2.gz	QCNTUDSCBSVXCB-AUUYWEPGSA-N	0	3	333.476	3.160	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)NC(=O)[C@@H](C)c1ccccc1	ZINC001322042566	1387037713	/nfs/dbraw/zinc/03/77/13/1387037713.db2.gz	VDCJPWALNAECJS-KBPBESRZSA-N	0	3	327.453	3.018	20	30		EGEDHN
C#CCCCCCCCCC(=O)N(CCOC)C1CCN(C)CC1	ZINC001182186282	1387118870	/nfs/dbraw/zinc/11/88/70/1387118870.db2.gz	DZDQWGALONDHOH-UHFFFAOYSA-N	0	3	336.520	3.310	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H](C)[C@](C)(CNCc2ocnc2C)C1	ZINC001182525197	1387182099	/nfs/dbraw/zinc/18/20/99/1387182099.db2.gz	ZREJRJXVQHMKMZ-MDASCCDHSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](C)[C@](C)(CNCc3nccs3)C2)CCC1	ZINC001182524843	1387182141	/nfs/dbraw/zinc/18/21/41/1387182141.db2.gz	MVLPCDPVFSQRLD-CRAIPNDOSA-N	0	3	347.528	3.464	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC(C)(F)F)C[C@@]1(C)CNCc1ccccc1C#N	ZINC001182539290	1387183910	/nfs/dbraw/zinc/18/39/10/1387183910.db2.gz	OJXAEUBNXPIEKO-RDTXWAMCSA-N	0	3	349.425	3.178	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)[C@H]1CCc2c3ccccc3[nH]c2C1	ZINC001182720853	1387214156	/nfs/dbraw/zinc/21/41/56/1387214156.db2.gz	ZZFLIBKFYYHTED-HOTGVXAUSA-N	0	3	337.467	3.039	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H](C)[C@](C)(CN[C@@H](C)c2cnccn2)C1	ZINC001182750072	1387218662	/nfs/dbraw/zinc/21/86/62/1387218662.db2.gz	JBPLDWGDGKJDJD-GQIGUUNPSA-N	0	3	344.503	3.214	20	30		EGEDHN
C[C@@H](CN(C)C(=O)c1cccc(F)c1)NCc1ccc(F)c(C#N)c1	ZINC001331375182	1389724525	/nfs/dbraw/zinc/72/45/25/1389724525.db2.gz	HHPVAAYAPVNEJL-ZDUSSCGKSA-N	0	3	343.377	3.087	20	30		EGEDHN
C=CCn1c(C(F)F)nnc1N1CCN(C2CCC(C)CC2)CC1	ZINC001339828625	1390162754	/nfs/dbraw/zinc/16/27/54/1390162754.db2.gz	DYIVZGYKRSQEKS-UHFFFAOYSA-N	0	3	339.434	3.102	20	30		EGEDHN
N#CC[C@@H](O)CN[C@H](CC1CC1)c1cc(F)cc(Br)c1	ZINC001332937909	1390220030	/nfs/dbraw/zinc/22/00/30/1390220030.db2.gz	PQQFQXGODWVXOM-HUUCEWRRSA-N	0	3	341.224	3.294	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(F)c1	ZINC001340173410	1390241913	/nfs/dbraw/zinc/24/19/13/1390241913.db2.gz	ROEOPZNFQJSIHA-CPUCHLNUSA-N	0	3	349.450	3.061	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc2[nH]c([C@H]3CCCO3)nc2c1	ZINC001340185251	1390245321	/nfs/dbraw/zinc/24/53/21/1390245321.db2.gz	SFDIITRAKYANJG-XJKSGUPXSA-N	0	3	328.416	3.037	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccc2[nH]c([C@@H]3CCCO3)nc2c1	ZINC001340185245	1390245388	/nfs/dbraw/zinc/24/53/88/1390245388.db2.gz	SFDIITRAKYANJG-CJNGLKHVSA-N	0	3	328.416	3.037	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccccc1OC[C@@H]1CCCCO1	ZINC001341493939	1390494152	/nfs/dbraw/zinc/49/41/52/1390494152.db2.gz	VDNRUUUIDFCEOV-JKSUJKDBSA-N	0	3	332.444	3.257	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccccc1OC[C@@H]1CCCCO1	ZINC001341493937	1390494209	/nfs/dbraw/zinc/49/42/09/1390494209.db2.gz	VDNRUUUIDFCEOV-HOTGVXAUSA-N	0	3	332.444	3.257	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N[C@@H](C)c1nc(-c2ccc(CC)cc2)no1	ZINC001341513751	1390496549	/nfs/dbraw/zinc/49/65/49/1390496549.db2.gz	CZJOVQFDIRFIIC-XJKSGUPXSA-N	0	3	342.443	3.160	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N[C@@H](c1cccc(F)c1)c1ccccn1	ZINC001341859011	1390538937	/nfs/dbraw/zinc/53/89/37/1390538937.db2.gz	VPUAQDWETMTOLS-AEFFLSMTSA-N	0	3	327.403	3.110	20	30		EGEDHN
CC(C)[C@@H]1C[C@@H](C(=O)C(C#N)C(=O)Nc2ccccc2Cl)CCO1	ZINC001341948490	1390553269	/nfs/dbraw/zinc/55/32/69/1390553269.db2.gz	VENMFYYCVAJYBW-XEZPLFJOSA-N	0	3	348.830	3.439	20	30		EGEDHN
C[C@@H](Sc1ccc(F)cc1)C(=O)C(C#N)C(=O)NC1CCCC1	ZINC001342011897	1390561661	/nfs/dbraw/zinc/56/16/61/1390561661.db2.gz	XWPKJLYYLHIJGQ-IAQYHMDHSA-N	0	3	334.416	3.074	20	30		EGEDHN
Cn1ccnc1C(C#N)C(=O)[C@@H]1C[C@H]1c1ccc(OC(F)(F)F)cc1	ZINC001342267580	1390593082	/nfs/dbraw/zinc/59/30/82/1390593082.db2.gz	BXBDZLMIPPCUFR-BFHYXJOUSA-N	0	3	349.312	3.299	20	30		EGEDHN
CCn1c([C@H](C)CCC#N)nnc1N1CCN(C2CCCCC2)CC1	ZINC001342938955	1390675358	/nfs/dbraw/zinc/67/53/58/1390675358.db2.gz	DDFMWOJGRNUOBL-MRXNPFEDSA-N	0	3	344.507	3.160	20	30		EGEDHN
CCOC(=O)c1csc(C(C#N)C(=O)c2ccc(OC)c(C)c2)n1	ZINC001343125890	1390693137	/nfs/dbraw/zinc/69/31/37/1390693137.db2.gz	IHOIXJLYINOGGH-GFCCVEGCSA-N	0	3	344.392	3.127	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)NCCc1ccc(N2CCCCC2)cc1	ZINC001343393524	1390711020	/nfs/dbraw/zinc/71/10/20/1390711020.db2.gz	SIQJCBHBBPOHSU-IBGZPJMESA-N	0	3	329.488	3.019	20	30		EGEDHN
C=C(C)Cn1c(CCCCC#N)nnc1N1CCN(C(C)(C)C)CC1	ZINC001343583868	1390724365	/nfs/dbraw/zinc/72/43/65/1390724365.db2.gz	VNGNLTNUPIQSOK-UHFFFAOYSA-N	0	3	344.507	3.011	20	30		EGEDHN
C=C(C)Cn1c([C@H](CC)OCC)nnc1N1C[C@H](C)N(CC)C[C@@H]1C	ZINC001343690934	1390731368	/nfs/dbraw/zinc/73/13/68/1390731368.db2.gz	FMDMVVPKJYXWRC-ULQDDVLXSA-N	0	3	349.523	3.261	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CCCN(C)C2)nnc1N1CCC(CC)CC1	ZINC001343786938	1390736986	/nfs/dbraw/zinc/73/69/86/1390736986.db2.gz	IOVGCHDAKGPFCQ-KRWDZBQOSA-N	0	3	331.508	3.290	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)c1cc(-c2ccc(C)c(C)c2)[nH]n1	ZINC001345647321	1390871751	/nfs/dbraw/zinc/87/17/51/1390871751.db2.gz	WGQFHZFXSOINLQ-HNNXBMFYSA-N	0	3	333.395	3.400	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)c1cn(CC(C)C)nc1C(F)F	ZINC001346096163	1390907334	/nfs/dbraw/zinc/90/73/34/1390907334.db2.gz	NOCJVWHXCBBTIZ-NSHDSACASA-N	0	3	335.358	3.183	20	30		EGEDHN
C#CC1CCN(C(=O)N[C@H](CN2CCCCC2)c2ccccc2)CC1	ZINC001349067182	1391300069	/nfs/dbraw/zinc/30/00/69/1391300069.db2.gz	AXOIFUXLEJSWME-HXUWFJFHSA-N	0	3	339.483	3.268	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N1CCO[C@H](c2c(F)cccc2Cl)C1	ZINC001354145788	1392122939	/nfs/dbraw/zinc/12/29/39/1392122939.db2.gz	QTZQTWIYMLXQQI-CABCVRRESA-N	0	3	340.826	3.063	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)N1CC(C)(C)[C@@H]1c1nccn1C	ZINC001354355498	1392139903	/nfs/dbraw/zinc/13/99/03/1392139903.db2.gz	AEKWNAJXRYSZIM-HOTGVXAUSA-N	0	3	334.508	3.408	20	30		EGEDHN
Cc1cscc1C(=O)NCC[C@H](C)NCc1cc(C#N)ccc1F	ZINC001480759198	1392917354	/nfs/dbraw/zinc/91/73/54/1392917354.db2.gz	RVXXUZWGNXYXIL-ZDUSSCGKSA-N	0	3	345.443	3.366	20	30		EGEDHN
CCN(CCNC(=O)c1c(C)cccc1C)Cc1cccc(C#N)c1	ZINC001481001692	1393081220	/nfs/dbraw/zinc/08/12/20/1393081220.db2.gz	VIOLZPJTQTXXBZ-UHFFFAOYSA-N	0	3	335.451	3.427	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2scnc2C)CCCC[C@H]1C	ZINC001481955725	1394617109	/nfs/dbraw/zinc/61/71/09/1394617109.db2.gz	UXOGYVOWRNEXSL-BZNIZROVSA-N	0	3	341.908	3.472	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)[C@@H](C)c1cccs1	ZINC001482141476	1394766951	/nfs/dbraw/zinc/76/69/51/1394766951.db2.gz	DFCPZFRKCHHIQY-CABCVRRESA-N	0	3	341.480	3.265	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccc(OCC)cc2)CCCC1	ZINC001482237623	1394833932	/nfs/dbraw/zinc/83/39/32/1394833932.db2.gz	NQHSWNURZYIRFA-UHFFFAOYSA-N	0	3	336.863	3.470	20	30		EGEDHN
Cc1occc1C(=O)NC[C@H](NCc1cc(C#N)ccc1F)C(C)C	ZINC001482515385	1395066151	/nfs/dbraw/zinc/06/61/51/1395066151.db2.gz	ROZZXFICKYHYQN-SFHVURJKSA-N	0	3	343.402	3.143	20	30		EGEDHN
CSC[C@H](C)C(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001483962012	1395164595	/nfs/dbraw/zinc/16/45/95/1395164595.db2.gz	FNPXVRWZKBCKHZ-HNNXBMFYSA-N	0	3	345.512	3.028	20	30		EGEDHN
Cc1cc(C)c(C(=O)NC[C@@H](C)N(C)Cc2ccc(C#N)cc2)s1	ZINC001485307126	1395784416	/nfs/dbraw/zinc/78/44/16/1395784416.db2.gz	QYRZKJXUXSJGRJ-CQSZACIVSA-N	0	3	341.480	3.487	20	30		EGEDHN
C[C@H](CNC(=O)c1c[nH]c2ccccc21)N(C)Cc1cccc(C#N)c1	ZINC001485326890	1395803155	/nfs/dbraw/zinc/80/31/55/1395803155.db2.gz	PVOBKRXGLYULAT-OAHLLOKOSA-N	0	3	346.434	3.290	20	30		EGEDHN
Cc1ccc(F)c(C(=O)N(C)C[C@@H](C)NCc2ccc(C#N)s2)c1	ZINC001485928801	1396169600	/nfs/dbraw/zinc/16/96/00/1396169600.db2.gz	ZMGSJRBTEPQVCJ-CYBMUJFWSA-N	0	3	345.443	3.318	20	30		EGEDHN
CCN(CCNC(=O)c1cccc(F)c1F)Cc1cccc(C#N)c1	ZINC001493010636	1396331841	/nfs/dbraw/zinc/33/18/41/1396331841.db2.gz	JHQUMSRRMVOOHQ-UHFFFAOYSA-N	0	3	343.377	3.088	20	30		EGEDHN
C=CCCCCCN1CCC[C@H](NC(=O)c2cccnc2OC)C1	ZINC001690045132	1404278543	/nfs/dbraw/zinc/27/85/43/1404278543.db2.gz	LDMAPQNCUFKDKH-INIZCTEOSA-N	0	3	331.460	3.031	20	30		EGEDHN
C[C@H](CNC(=O)c1cc2ccsc2[nH]1)NCc1ccc(C#N)s1	ZINC001690607652	1404650237	/nfs/dbraw/zinc/65/02/37/1404650237.db2.gz	BAUPAOWFXBHEFQ-SNVBAGLBSA-N	0	3	344.465	3.071	20	30		EGEDHN
CC(C)c1occc1C(=O)NC[C@H](C)NCc1ccc(C#N)s1	ZINC001690651686	1404683199	/nfs/dbraw/zinc/68/31/99/1404683199.db2.gz	DSILSPJPWZUJCD-LBPRGKRZSA-N	0	3	331.441	3.244	20	30		EGEDHN
C[C@@H](C(=O)NC[C@H](C)N(C)Cc1cccc(C#N)c1)c1ccccc1	ZINC001725186937	1425720855	/nfs/dbraw/zinc/72/08/55/1425720855.db2.gz	FIRJCMAQUZPJBT-DLBZAZTESA-N	0	3	335.451	3.298	20	30		EGEDHN
CC[C@H](CNC(=O)c1cc(C)oc1C)NCc1ccc(C#N)s1	ZINC001732190843	1428442705	/nfs/dbraw/zinc/44/27/05/1428442705.db2.gz	CCKWONUNERGPJQ-CYBMUJFWSA-N	0	3	331.441	3.128	20	30		EGEDHN
C[C@H](C#N)C(=O)NCc1ccc(CNCc2cccc(Cl)c2)cc1	ZINC001732315896	1428527302	/nfs/dbraw/zinc/52/73/02/1428527302.db2.gz	WEABFFHHMHBNAC-CQSZACIVSA-N	0	3	341.842	3.406	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)CCc1ccccc1	ZINC001732369041	1428551639	/nfs/dbraw/zinc/55/16/39/1428551639.db2.gz	GNGUFPDXAFTBMZ-QGZVFWFLSA-N	0	3	335.451	3.033	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CCc2cccs2)CCCC1	ZINC001732399213	1428565541	/nfs/dbraw/zinc/56/55/41/1428565541.db2.gz	YJMAYTDOWQXEJA-UHFFFAOYSA-N	0	3	326.893	3.452	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)N(C)C(=O)c1cc(F)ccc1F	ZINC001732424564	1428575550	/nfs/dbraw/zinc/57/55/50/1428575550.db2.gz	FKARMPOZPQLEBO-NSHDSACASA-N	0	3	349.406	3.148	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H](C)CN(C)Cc2ccc(C#N)cc2)oc1C	ZINC001699446566	1412781233	/nfs/dbraw/zinc/78/12/33/1412781233.db2.gz	WTPVKWAVKOYGHF-AWEZNQCLSA-N	0	3	325.412	3.018	20	30		EGEDHN
C[C@@H](CN(C)Cc1cccc(C#N)c1)NC(=O)[C@@H](C)c1ccccc1	ZINC001699468534	1412842498	/nfs/dbraw/zinc/84/24/98/1412842498.db2.gz	WHVADFACBDMAGW-IRXDYDNUSA-N	0	3	335.451	3.298	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)CC(C1CC1)C1CC1	ZINC001699474701	1412865218	/nfs/dbraw/zinc/86/52/18/1412865218.db2.gz	UCYHGNBPEZGTSJ-OAHLLOKOSA-N	0	3	339.483	3.321	20	30		EGEDHN
CCCC(C)(C)C(=O)NCC1(NCc2ccc(F)c(C#N)c2)CC1	ZINC001699661509	1413045191	/nfs/dbraw/zinc/04/51/91/1413045191.db2.gz	PCZSRNJVEMRWDE-UHFFFAOYSA-N	0	3	331.435	3.262	20	30		EGEDHN
C=C(Cl)CN(CC1CC1)C1CCN(C(=O)c2cccc(C)n2)CC1	ZINC001699683995	1413079683	/nfs/dbraw/zinc/07/96/83/1413079683.db2.gz	FXIOLGFARUHTOS-UHFFFAOYSA-N	0	3	347.890	3.459	20	30		EGEDHN
CC1(CNC(=O)C2CCC2)CCN(Cc2cccc(C#N)c2)CC1	ZINC001699861125	1413294735	/nfs/dbraw/zinc/29/47/35/1413294735.db2.gz	USECTAQDOXISTR-UHFFFAOYSA-N	0	3	325.456	3.077	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)CC2(C)CC2)CCN1Cc1ccc(C#N)cc1	ZINC001700315030	1413772681	/nfs/dbraw/zinc/77/26/81/1413772681.db2.gz	BRZIZDWLPJLEKL-CRAIPNDOSA-N	0	3	325.456	3.218	20	30		EGEDHN
CN(CC(C)(C)CNCc1ccccc1C#N)C(=O)[C@H]1CC1(C)C	ZINC001700441760	1414013831	/nfs/dbraw/zinc/01/38/31/1414013831.db2.gz	WKKDNQVRNLPWSS-QGZVFWFLSA-N	0	3	327.472	3.179	20	30		EGEDHN
Cc1scc(C(=O)NC[C@@H](C)N(C)Cc2cccc(C#N)c2)c1C	ZINC001700459725	1414055728	/nfs/dbraw/zinc/05/57/28/1414055728.db2.gz	IHVPGZPQCOCVHX-CYBMUJFWSA-N	0	3	341.480	3.487	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1ccc(-c2c[nH]cn2)cc1)C(C)C	ZINC001732574292	1428773362	/nfs/dbraw/zinc/77/33/62/1428773362.db2.gz	MXKIUAWGOXVZNP-INIZCTEOSA-N	0	3	346.862	3.173	20	30		EGEDHN
C[C@H](CNC(=O)c1ccc(F)cc1F)N(C)Cc1cccc(C#N)c1	ZINC001700484632	1414127683	/nfs/dbraw/zinc/12/76/83/1414127683.db2.gz	PUMXAOUTWANWDU-CYBMUJFWSA-N	0	3	343.377	3.087	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](C)CNCc2ccc(C#N)s2)cc(C)c1F	ZINC001732985875	1429113211	/nfs/dbraw/zinc/11/32/11/1429113211.db2.gz	WKLHSERYIJDHRT-CYBMUJFWSA-N	0	3	345.443	3.284	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)C[C@@H](CC)C(C)C)C1	ZINC001707077446	1417188044	/nfs/dbraw/zinc/18/80/44/1417188044.db2.gz	NGXZLYKVGFPZRS-KFWWJZLASA-N	0	3	345.325	3.452	20	30		EGEDHN
C[C@@H]1CCN(C(=O)CCCF)[C@H](CNCc2ccc(C#N)cc2F)C1	ZINC001707162895	1417226155	/nfs/dbraw/zinc/22/61/55/1417226155.db2.gz	GOMODCRCLRRUQP-PBHICJAKSA-N	0	3	349.425	3.164	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)Cc1ccc(F)cc1	ZINC001707439634	1417343767	/nfs/dbraw/zinc/34/37/67/1417343767.db2.gz	TYSXMDOUURFLEJ-WMLDXEAASA-N	0	3	338.854	3.480	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1ccc2cc[nH]c2n1	ZINC001712998400	1417550303	/nfs/dbraw/zinc/55/03/03/1417550303.db2.gz	GTQODNVVUSIZOV-XJKSGUPXSA-N	0	3	346.862	3.288	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)CCc1cc(C)on1	ZINC001713001282	1417554414	/nfs/dbraw/zinc/55/44/14/1417554414.db2.gz	YSELTONDXPTMJJ-GOEBONIOSA-N	0	3	339.867	3.027	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H](CNC(=O)C2CCCCC2)C2CC2)c1	ZINC001713102969	1417658615	/nfs/dbraw/zinc/65/86/15/1417658615.db2.gz	KWBMMVHUHTYQFH-LJQANCHMSA-N	0	3	343.446	3.262	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccc(OCC#N)cc1)NC(=O)C1CCCCC1	ZINC001733065608	1429219019	/nfs/dbraw/zinc/21/90/19/1429219019.db2.gz	XLYPDOHLHHPFEO-INIZCTEOSA-N	0	3	343.471	3.106	20	30		EGEDHN
C[C@@H](NC(=O)C(C)(C)F)[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001713272427	1417887978	/nfs/dbraw/zinc/88/79/78/1417887978.db2.gz	VOTLFVCWIBPEHN-RHSMWYFYSA-N	0	3	331.435	3.023	20	30		EGEDHN
CCN(CCNC(=O)c1ccc(F)cc1C)Cc1ccc(C#N)cc1	ZINC001713495632	1418202255	/nfs/dbraw/zinc/20/22/55/1418202255.db2.gz	QKFZXJJHBLONLZ-UHFFFAOYSA-N	0	3	339.414	3.258	20	30		EGEDHN
CCC(CC)C(=O)NCC[C@@H]1CCN(Cc2ccccc2C#N)C1	ZINC001713725179	1418504362	/nfs/dbraw/zinc/50/43/62/1418504362.db2.gz	QKAMPKRFWZOJQE-MRXNPFEDSA-N	0	3	327.472	3.323	20	30		EGEDHN
CCC(CC)C(=O)NCC[C@H]1CCN(Cc2ccccc2C#N)C1	ZINC001713725178	1418504927	/nfs/dbraw/zinc/50/49/27/1418504927.db2.gz	QKAMPKRFWZOJQE-INIZCTEOSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=CCCCCCN1CC[C@H](NC(=O)c2cc3cnccc3o2)C1	ZINC001713953506	1418736792	/nfs/dbraw/zinc/73/67/92/1418736792.db2.gz	CKZPFAMFYMDZAV-INIZCTEOSA-N	0	3	327.428	3.378	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2cnccc2C)CCCC[C@@H]1C	ZINC001714180823	1418988926	/nfs/dbraw/zinc/98/89/26/1418988926.db2.gz	UBQWJQKDQPSRFD-KSSFIOAISA-N	0	3	335.879	3.411	20	30		EGEDHN
Cc1cc(CNCc2ccc(CNC(=O)[C@@H](C)C#N)cc2)cs1	ZINC001714317819	1419096849	/nfs/dbraw/zinc/09/68/49/1419096849.db2.gz	NLWRKGKODVIGOQ-ZDUSSCGKSA-N	0	3	327.453	3.122	20	30		EGEDHN
C[C@H](CNCc1cc(Cl)sc1Cl)CNC(=O)[C@@H](C)C#N	ZINC001714377261	1419132340	/nfs/dbraw/zinc/13/23/40/1419132340.db2.gz	KSAUAYAHOWBYDH-BDAKNGLRSA-N	0	3	334.272	3.056	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)CC(C)(C)C1CC1	ZINC001714467354	1419195502	/nfs/dbraw/zinc/19/55/02/1419195502.db2.gz	YGCIZZRBFKJMHG-GFCCVEGCSA-N	0	3	331.298	3.206	20	30		EGEDHN
CCc1ccc(C(=O)NCCN(CC)Cc2cccc(C#N)c2)cc1	ZINC001714596405	1419348947	/nfs/dbraw/zinc/34/89/47/1419348947.db2.gz	IEVLWPWLOHTBOR-UHFFFAOYSA-N	0	3	335.451	3.373	20	30		EGEDHN
CCCN(CCNC(=O)c1ccoc1Cl)Cc1ccc(C#N)cc1	ZINC001714654150	1419434956	/nfs/dbraw/zinc/43/49/56/1419434956.db2.gz	WCWGCSNHPNNDGI-UHFFFAOYSA-N	0	3	345.830	3.447	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1CCCN(CCc2cccs2)C1	ZINC001714922076	1419674713	/nfs/dbraw/zinc/67/47/13/1419674713.db2.gz	HDUOAVGROPYCLG-QGZVFWFLSA-N	0	3	332.513	3.455	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cc(C(C)(C)C)on1)C(C)C	ZINC001715497178	1420179027	/nfs/dbraw/zinc/17/90/27/1420179027.db2.gz	OOHDVUGMZRHZIS-CYBMUJFWSA-N	0	3	327.856	3.069	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)CCc1ccsc1	ZINC001716024025	1420480403	/nfs/dbraw/zinc/48/04/03/1420480403.db2.gz	QYSCACRYPNQPHX-HNNXBMFYSA-N	0	3	341.480	3.189	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)NC(=O)CC(C1CC1)C1CC1	ZINC001716425019	1420652168	/nfs/dbraw/zinc/65/21/68/1420652168.db2.gz	BVFATZHBITZGDM-GFCCVEGCSA-N	0	3	331.485	3.040	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)NC(=O)c1cc2ccccc2[nH]1	ZINC001716463031	1420676216	/nfs/dbraw/zinc/67/62/16/1420676216.db2.gz	DLCLDVYUDYEWFX-LBPRGKRZSA-N	0	3	338.436	3.009	20	30		EGEDHN
Cc1cc(C)c(C(=O)NCC2(NCc3ccc(C#N)cc3)CC2)s1	ZINC001716683673	1420837553	/nfs/dbraw/zinc/83/75/53/1420837553.db2.gz	LVSPORXITKKCMT-UHFFFAOYSA-N	0	3	339.464	3.289	20	30		EGEDHN
CC1(C)CC[C@H](C(=O)NCC2(NCc3ccc(C#N)cc3)CC2)C1	ZINC001716693381	1420846516	/nfs/dbraw/zinc/84/65/16/1420846516.db2.gz	UAVGMADLUKKBDN-KRWDZBQOSA-N	0	3	325.456	3.123	20	30		EGEDHN
C=C(Cl)CN(CC1CC1)C1CCN(C(=O)Cc2ccoc2)CC1	ZINC001733276871	1429441861	/nfs/dbraw/zinc/44/18/61/1429441861.db2.gz	CPVZDAPPHWPXJA-UHFFFAOYSA-N	0	3	336.863	3.278	20	30		EGEDHN
CC(C)SCC(=O)N1CC[C@H](NCc2ccccc2C#N)C[C@H]1C	ZINC001716757105	1420906589	/nfs/dbraw/zinc/90/65/89/1420906589.db2.gz	HSVRZDITTAKVED-QAPCUYQASA-N	0	3	345.512	3.169	20	30		EGEDHN
CC(C)[C@H](F)C(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1	ZINC001733359926	1429542661	/nfs/dbraw/zinc/54/26/61/1429542661.db2.gz	NAXXXISZGFRJPC-KRWDZBQOSA-N	0	3	331.435	3.023	20	30		EGEDHN
CC(C)(C)C(=O)NCC1(C)CCN(Cc2cccc(C#N)c2)CC1	ZINC001733452708	1429666000	/nfs/dbraw/zinc/66/60/00/1429666000.db2.gz	VRVZUJPPPCKSPY-UHFFFAOYSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C(Cl)Cn1c([C@H](C)CC)nnc1N1C[C@H](C)N(CC)C[C@@H]1C	ZINC001722544627	1424212838	/nfs/dbraw/zinc/21/28/38/1424212838.db2.gz	UOPVZHDBACXHRX-SNPRPXQTSA-N	0	3	339.915	3.463	20	30		EGEDHN
C[C@H](CNC(=O)c1ccc(CF)cc1)N(C)Cc1cccc(C#N)c1	ZINC001725202413	1425758834	/nfs/dbraw/zinc/75/88/34/1425758834.db2.gz	OLQGRYLRGMRCGR-OAHLLOKOSA-N	0	3	339.414	3.278	20	30		EGEDHN
CCC[C@@H](C)CC(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001731442081	1427421198	/nfs/dbraw/zinc/42/11/98/1427421198.db2.gz	KSZSVUKPIWDRNB-KBRIMQKVSA-N	0	3	331.435	3.260	20	30		EGEDHN
C[C@H](CCNC(=O)c1cc(F)ccc1F)NCc1ccccc1C#N	ZINC001731728848	1427803854	/nfs/dbraw/zinc/80/38/54/1427803854.db2.gz	HXYGFFDHISFFDB-CYBMUJFWSA-N	0	3	343.377	3.135	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)C(C)(C)c1cccc(OC)c1	ZINC001731738155	1427821500	/nfs/dbraw/zinc/82/15/00/1427821500.db2.gz	NWKPRHUYZYCYIA-CQSZACIVSA-N	0	3	338.879	3.210	20	30		EGEDHN
CCN(CCNC(=O)c1ccc(CF)cc1)Cc1ccc(C#N)cc1	ZINC001731815939	1428010289	/nfs/dbraw/zinc/01/02/89/1428010289.db2.gz	GVKDCAFOQVMNEQ-UHFFFAOYSA-N	0	3	339.414	3.280	20	30		EGEDHN
CCCN(CCNC(=O)c1ccc(Cl)o1)Cc1cccc(C#N)c1	ZINC001731865777	1428112690	/nfs/dbraw/zinc/11/26/90/1428112690.db2.gz	YNUYNSHSGBKQIG-UHFFFAOYSA-N	0	3	345.830	3.447	20	30		EGEDHN
C[C@@H](C(=O)NCC1(NCc2ccc(C#N)s2)CCC1)C1CCC1	ZINC001733719267	1429939328	/nfs/dbraw/zinc/93/93/28/1429939328.db2.gz	XYTGEHOHJOYPBM-CYBMUJFWSA-N	0	3	331.485	3.184	20	30		EGEDHN
Cc1ccsc1C(=O)NC[C@H](C)N(C)Cc1cccc(C#N)c1	ZINC001734025744	1437813656	/nfs/dbraw/zinc/81/36/56/1437813656.db2.gz	GEBOMBMLYNYYDC-AWEZNQCLSA-N	0	3	327.453	3.179	20	30		EGEDHN
Cc1scc(C(=O)NC[C@@H](C)N(C)Cc2ccc(C#N)cc2)c1C	ZINC001734038466	1437827018	/nfs/dbraw/zinc/82/70/18/1437827018.db2.gz	OYTTWRXUMHLGTP-CYBMUJFWSA-N	0	3	341.480	3.487	20	30		EGEDHN
C=C(Cl)Cn1c(C(C)C)nnc1N1CCN(C2CCCC2)CC1	ZINC001749250015	1440096177	/nfs/dbraw/zinc/09/61/77/1440096177.db2.gz	WEFSWWIBSPOCJO-UHFFFAOYSA-N	0	3	337.899	3.219	20	30		EGEDHN
C[C@H](CC(=O)NCCCN(C)Cc1ccc(F)c(C#N)c1)C1CC1	ZINC001752123676	1440142917	/nfs/dbraw/zinc/14/29/17/1440142917.db2.gz	CZUJWXKBHZEKPX-CQSZACIVSA-N	0	3	331.435	3.072	20	30		EGEDHN
C=CCC1(C(=O)NCCCN(C)Cc2cnccc2C)CCCC1	ZINC001752126935	1440143248	/nfs/dbraw/zinc/14/32/48/1440143248.db2.gz	GALVSNSUHUXSBB-UHFFFAOYSA-N	0	3	329.488	3.465	20	30		EGEDHN
C#CCCCC(=O)N1CCCC[C@@H]1[C@@H](C)NCC=C(Cl)Cl	ZINC001752144194	1440145402	/nfs/dbraw/zinc/14/54/02/1440145402.db2.gz	CFTJLDKTUPEVFP-ZIAGYGMSSA-N	0	3	331.287	3.468	20	30		EGEDHN
C=CCCCC(=O)N1CCCC[C@@H]1[C@H](C)NCc1cccc(OC)n1	ZINC001752157831	1440147755	/nfs/dbraw/zinc/14/77/55/1440147755.db2.gz	LOJPZHACISDLGY-FUHWJXTLSA-N	0	3	345.487	3.306	20	30		EGEDHN
CC#CCN(CCCNC(=O)c1scnc1C1CCCC1)C1CC1	ZINC001752265830	1440162424	/nfs/dbraw/zinc/16/24/24/1440162424.db2.gz	FYKCYKLVLNLMIC-UHFFFAOYSA-N	0	3	345.512	3.408	20	30		EGEDHN
CC(C)(C)C(=O)NCCCN(Cc1ccc(C#N)c(F)c1)C1CC1	ZINC001752285481	1440165517	/nfs/dbraw/zinc/16/55/17/1440165517.db2.gz	XFFXXXXCNSOIID-UHFFFAOYSA-N	0	3	331.435	3.214	20	30		EGEDHN
CN(C(=O)C1(C(F)F)CC1)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001752301810	1440167780	/nfs/dbraw/zinc/16/77/80/1440167780.db2.gz	SVMWXJHQPZUXNQ-UHFFFAOYSA-N	0	3	347.409	3.026	20	30		EGEDHN
C=CCCCCCN1CCC[C@H](NC(=O)c2conc2C2CC2)C1	ZINC001752330241	1440171185	/nfs/dbraw/zinc/17/11/85/1440171185.db2.gz	QNBYEBWUNRMEJF-INIZCTEOSA-N	0	3	331.460	3.493	20	30		EGEDHN
C=CCC[C@@H](C)N1CC[C@@H](NC(=O)c2ccc(P(C)(C)=O)cc2)C1	ZINC001752411633	1440174363	/nfs/dbraw/zinc/17/43/63/1440174363.db2.gz	SKTKPCAPYVIRIC-NVXWUHKLSA-N	0	3	348.427	3.093	20	30		EGEDHN
CC(C)CC(=O)NC[C@H](NCC#Cc1cccc(Cl)c1)C1CC1	ZINC001752445942	1440181963	/nfs/dbraw/zinc/18/19/63/1440181963.db2.gz	SZASKCPFBNUYQZ-SFHVURJKSA-N	0	3	332.875	3.222	20	30		EGEDHN
C=C/C(C)=C/CC(=O)NC[C@H](NCc1ccc(C#N)cc1F)C1CC1	ZINC001752478958	1440185162	/nfs/dbraw/zinc/18/51/62/1440185162.db2.gz	CTARTDMCLSYLJR-DKQDWMEJSA-N	0	3	341.430	3.204	20	30		EGEDHN
C=CCCCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@]1(C)CCCOC1	ZINC001752542885	1440194701	/nfs/dbraw/zinc/19/47/01/1440194701.db2.gz	GMPVRXUAPMBMHI-WSTZPKSXSA-N	0	3	334.504	3.225	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@H](NC(=O)CCCC3CC3)C2)c(F)c1	ZINC001752655668	1440198200	/nfs/dbraw/zinc/19/82/00/1440198200.db2.gz	VVWNCKNKQYIBDC-QAQDUYKDSA-N	0	3	329.419	3.014	20	30		EGEDHN
C#CCC1(C(=O)N[C@H]2C[C@H](NCc3oc(C)nc3C)C2)CCCCC1	ZINC001752692775	1440200779	/nfs/dbraw/zinc/20/07/79/1440200779.db2.gz	ZGLZKZWODWOHSB-QAQDUYKDSA-N	0	3	343.471	3.002	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1conc1CC	ZINC001752697998	1440201315	/nfs/dbraw/zinc/20/13/15/1440201315.db2.gz	YKUXRORKPHKEMO-MIGBEJBISA-N	0	3	345.487	3.451	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@@H](NCc3ccns3)C2)CCCCC1	ZINC001752774967	1440206622	/nfs/dbraw/zinc/20/66/22/1440206622.db2.gz	CCSDGKBTAWGPTH-GASCZTMLSA-N	0	3	333.501	3.407	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H]1CCCN(Cc2c(C)nsc2C)C1	ZINC001752785517	1440211122	/nfs/dbraw/zinc/21/11/22/1440211122.db2.gz	WUOOTLXZBFPJIS-HNNXBMFYSA-N	0	3	335.517	3.300	20	30		EGEDHN
C=CCCOCC(=O)NC[C@H]1CCCN([C@H](C)c2cccc(F)c2)C1	ZINC001752789991	1440213224	/nfs/dbraw/zinc/21/32/24/1440213224.db2.gz	PENJGHOSHCXWTE-IAGOWNOFSA-N	0	3	348.462	3.308	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)Cc2c(C)oc3ccccc32)C1	ZINC001752792187	1440213976	/nfs/dbraw/zinc/21/39/76/1440213976.db2.gz	IUFIETJNZJSZDT-QGZVFWFLSA-N	0	3	338.451	3.135	20	30		EGEDHN
CC[C@H](CC(C)C)C(=O)NC[C@H](C)NCc1ccc(F)c(C#N)c1	ZINC001752909958	1440245088	/nfs/dbraw/zinc/24/50/88/1440245088.db2.gz	ABZWMPRWHSDIJN-GOEBONIOSA-N	0	3	333.451	3.364	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H](C)NCc2ccc(OC)nc2)CCCCC1	ZINC001752920779	1440248481	/nfs/dbraw/zinc/24/84/81/1440248481.db2.gz	GMRBIXHAZNGWNF-MRXNPFEDSA-N	0	3	345.487	3.211	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1CC[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001752937033	1440250495	/nfs/dbraw/zinc/25/04/95/1440250495.db2.gz	YBVILWKXGTYOQJ-HUUCEWRRSA-N	0	3	331.435	3.072	20	30		EGEDHN
CC#CCN(C)[C@@H]1CCCN(C(=O)c2ccc(C(F)(F)F)s2)C1	ZINC001752999716	1440263838	/nfs/dbraw/zinc/26/38/38/1440263838.db2.gz	GSFOVTIPKVDAFO-GFCCVEGCSA-N	0	3	344.402	3.327	20	30		EGEDHN
Cc1c(F)cccc1C(=O)NCC[C@@H](C)NCc1ccccc1C#N	ZINC001753007035	1440266093	/nfs/dbraw/zinc/26/60/93/1440266093.db2.gz	YMYWOOFLDKEVSJ-CQSZACIVSA-N	0	3	339.414	3.304	20	30		EGEDHN
Cc1cc(C)cc(CN(C)CCNC(=O)CC#Cc2ccccc2)c1	ZINC001753075909	1440291303	/nfs/dbraw/zinc/29/13/03/1440291303.db2.gz	NNFXFMQBGVDHKJ-UHFFFAOYSA-N	0	3	334.463	3.293	20	30		EGEDHN
CCN(CCNC(=O)c1cccc(C)c1F)Cc1ccc(C#N)cc1	ZINC001753082424	1440294508	/nfs/dbraw/zinc/29/45/08/1440294508.db2.gz	JVWXWTHKUNPEMN-UHFFFAOYSA-N	0	3	339.414	3.258	20	30		EGEDHN
CCN(CCNC(=O)c1cccc2[nH]ccc21)Cc1ccc(C#N)cc1	ZINC001753090726	1440299121	/nfs/dbraw/zinc/29/91/21/1440299121.db2.gz	ZWUFYUBODHDNEG-UHFFFAOYSA-N	0	3	346.434	3.291	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NC[C@@H]1CCN(Cc2ccccc2F)C1)OCC	ZINC001753129553	1440315999	/nfs/dbraw/zinc/31/59/99/1440315999.db2.gz	OLHCHLSNYBNPHQ-LPHOPBHVSA-N	0	3	348.462	3.135	20	30		EGEDHN
CCCN(CCNC(=O)C[C@H]1C=CCC1)Cc1ccc(F)c(C#N)c1	ZINC001753141839	1440321536	/nfs/dbraw/zinc/32/15/36/1440321536.db2.gz	GTGPXFMFKWGFIM-INIZCTEOSA-N	0	3	343.446	3.382	20	30		EGEDHN
CN(CCNCc1ccc(C#N)cc1)C(=O)c1cc(Cl)ccc1F	ZINC001753209908	1440339088	/nfs/dbraw/zinc/33/90/88/1440339088.db2.gz	JVBQZRMGWRBGPJ-UHFFFAOYSA-N	0	3	345.805	3.213	20	30		EGEDHN
CN(CCNCc1ccc(C#N)cc1)C(=O)CC(C)(C)C(F)(F)F	ZINC001753256623	1440343681	/nfs/dbraw/zinc/34/36/81/1440343681.db2.gz	OHQJTQFOTJFJLH-UHFFFAOYSA-N	0	3	341.377	3.085	20	30		EGEDHN
C=CCC1(C(=O)N(C)CCNCc2ccc(C#N)s2)CCCC1	ZINC001753267560	1440345091	/nfs/dbraw/zinc/34/50/91/1440345091.db2.gz	GRJSBIZLMYKGEN-UHFFFAOYSA-N	0	3	331.485	3.304	20	30		EGEDHN
C#CCCN[C@H](CNC(=O)c1ncsc1C1CC1)c1ccccc1	ZINC001753302089	1440354454	/nfs/dbraw/zinc/35/44/54/1440354454.db2.gz	UGTWIAFDRSIFDW-MRXNPFEDSA-N	0	3	339.464	3.105	20	30		EGEDHN
C=C(C)CN[C@H](CNC(=O)c1cccc2[nH]cnc21)c1ccccc1	ZINC001753311243	1440356541	/nfs/dbraw/zinc/35/65/41/1440356541.db2.gz	KEMPJDATKUYHGB-GOSISDBHSA-N	0	3	334.423	3.200	20	30		EGEDHN
C#CCCN[C@@H](CNC(=O)c1coc(C2CCC2)n1)c1ccccc1	ZINC001753311535	1440356745	/nfs/dbraw/zinc/35/67/45/1440356745.db2.gz	NWPKPQLODZRVIR-KRWDZBQOSA-N	0	3	337.423	3.026	20	30		EGEDHN
C=CCOCCN1CC[C@@H](N(CCC)C(=O)[C@@H]2C[C@@H]3CCCC[C@H]23)C1	ZINC001753318427	1440361366	/nfs/dbraw/zinc/36/13/66/1440361366.db2.gz	JBZKOVZCMLJTEJ-ZGXWSNOMSA-N	0	3	348.531	3.328	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CCC)C(=O)Cc2cc(C)ccc2F)C1	ZINC001753319648	1440362426	/nfs/dbraw/zinc/36/24/26/1440362426.db2.gz	JUEGPJYAYHXXNV-GOSISDBHSA-N	0	3	330.447	3.013	20	30		EGEDHN
CC#CCN1CC[C@@H](N(CCC)C(=O)c2cc(CCCCC)[nH]n2)C1	ZINC001753320096	1440362738	/nfs/dbraw/zinc/36/27/38/1440362738.db2.gz	SZLRFXNSJLWQPV-GOSISDBHSA-N	0	3	344.503	3.092	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001753348944	1440376883	/nfs/dbraw/zinc/37/68/83/1440376883.db2.gz	GHOIJLWKMQRFOR-OAHLLOKOSA-N	0	3	331.485	3.256	20	30		EGEDHN
C#CCCCCC(=O)N(C)[C@@H]1CCN(CCOc2ccccc2C)C1	ZINC001753434651	1440399539	/nfs/dbraw/zinc/39/95/39/1440399539.db2.gz	GHWRWJLKFRNGIZ-LJQANCHMSA-N	0	3	342.483	3.100	20	30		EGEDHN
C#CCCN1CC[C@H](N(C)C(=O)CCCCCc2cccs2)C1	ZINC001753446970	1440404354	/nfs/dbraw/zinc/40/43/54/1440404354.db2.gz	QDROWLSZTIAYPQ-KRWDZBQOSA-N	0	3	332.513	3.407	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)CCOc2ccc(C)c(C)c2)C1	ZINC001753457351	1440408722	/nfs/dbraw/zinc/40/87/22/1440408722.db2.gz	OJGPABPAIUNOPD-LJQANCHMSA-N	0	3	342.483	3.018	20	30		EGEDHN
C=C(C)CCC(=O)N(CC)[C@H]1CCN(C[C@H](O)c2ccc(F)cc2)C1	ZINC001753457127	1440408778	/nfs/dbraw/zinc/40/87/78/1440408778.db2.gz	KEZHYERXWUZRIG-OALUTQOASA-N	0	3	348.462	3.138	20	30		EGEDHN
CC[C@H](CNC(=O)c1c[nH]c(C#N)c1)N[C@@H](C)c1ccccc1Cl	ZINC001753473814	1440414664	/nfs/dbraw/zinc/41/46/64/1440414664.db2.gz	VRNYDVZRSWZSHU-GXTWGEPZSA-N	0	3	344.846	3.399	20	30		EGEDHN
CC[C@H](CNC(=O)c1c[nH]cc1C1CC1)NCc1ccc(C#N)s1	ZINC001753492986	1440420261	/nfs/dbraw/zinc/42/02/61/1440420261.db2.gz	VQDYYNPTJQNYOO-CYBMUJFWSA-N	0	3	342.468	3.123	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1cc(F)c(F)cc1F)C1CC1	ZINC001753524126	1440429197	/nfs/dbraw/zinc/42/91/97/1440429197.db2.gz	XLANZHHREKOCCH-INIZCTEOSA-N	0	3	346.780	3.345	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@H](CCNCc2nccnc2C)C1	ZINC001753549389	1440434743	/nfs/dbraw/zinc/43/47/43/1440434743.db2.gz	VUPWMDPIHDYTRM-QGZVFWFLSA-N	0	3	344.503	3.106	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCCN(C(=O)c2cc(C3CC3)no2)C1	ZINC001753556981	1440436171	/nfs/dbraw/zinc/43/61/71/1440436171.db2.gz	CDKFLHJBXIOIBQ-ZDUSSCGKSA-N	0	3	337.851	3.136	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCCN(C(=O)Cc2ccccc2F)C1	ZINC001753561699	1440437072	/nfs/dbraw/zinc/43/70/72/1440437072.db2.gz	YMURPNNZISSCTH-HNNXBMFYSA-N	0	3	338.854	3.339	20	30		EGEDHN
CC#CCNCc1ccc(CNC(=O)Cc2ccc(C)c(C)c2)cc1	ZINC001753592719	1440443359	/nfs/dbraw/zinc/44/33/59/1440443359.db2.gz	ZGXBYXJRQUJLKZ-UHFFFAOYSA-N	0	3	334.463	3.275	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H](C)CNCc1cc(-c2cccs2)on1	ZINC001753626565	1440451413	/nfs/dbraw/zinc/45/14/13/1440451413.db2.gz	QQEQTYXGWQPNGG-ZDUSSCGKSA-N	0	3	347.484	3.457	20	30		EGEDHN
CC(=O)NCC1(NCC#Cc2ccc(C(F)(F)F)cc2)CCCC1	ZINC001753660026	1440458278	/nfs/dbraw/zinc/45/82/78/1440458278.db2.gz	NKNPGVIIFOEGAV-UHFFFAOYSA-N	0	3	338.373	3.095	20	30		EGEDHN
C=CC(C)(C)C(=O)NCC1(NCc2ccccc2[N+](=O)[O-])CCCC1	ZINC001753666967	1440460475	/nfs/dbraw/zinc/46/04/75/1440460475.db2.gz	PHWVDERTTWODCC-UHFFFAOYSA-N	0	3	345.443	3.326	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC2(CN(CCOCC(C)C)C2)CC1	ZINC001753674947	1440463058	/nfs/dbraw/zinc/46/30/58/1440463058.db2.gz	MHOBAGIRLXUSHN-IBGZPJMESA-N	0	3	336.520	3.186	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N(C)[C@H](C)CNCc1ccc(C#N)c(F)c1	ZINC001753694124	1440467142	/nfs/dbraw/zinc/46/71/42/1440467142.db2.gz	WQBZZQQBJUQQBD-CQSZACIVSA-N	0	3	333.451	3.316	20	30		EGEDHN
C=CC(C)(C)C(=O)N(C)[C@H](C)CNCC#Cc1cccc(Cl)c1	ZINC001753707093	1440469795	/nfs/dbraw/zinc/46/97/95/1440469795.db2.gz	VMFIKLJOSZRCBE-OAHLLOKOSA-N	0	3	332.875	3.340	20	30		EGEDHN
Cc1cccc(C(=O)N[C@H](CNCC#Cc2ccccc2)CC(C)C)n1	ZINC001753734126	1440477112	/nfs/dbraw/zinc/47/71/12/1440477112.db2.gz	VNOQYGOTLHGQDO-FQEVSTJZSA-N	0	3	349.478	3.176	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](CNCc1cnn(C)c1)C1CCCCC1	ZINC001753747403	1440481445	/nfs/dbraw/zinc/48/14/45/1440481445.db2.gz	PRUWWRHFZJEYRQ-SFHVURJKSA-N	0	3	346.519	3.177	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](NCc2ccn(C(C)C)n2)[C@@H](C)C1	ZINC001753755391	1440483092	/nfs/dbraw/zinc/48/30/92/1440483092.db2.gz	QJDLODJHJQMSLD-WMZOPIPTSA-N	0	3	346.519	3.393	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCCCN1C(=O)c1cc(C)n(C)c1C	ZINC001753787277	1440488277	/nfs/dbraw/zinc/48/82/77/1440488277.db2.gz	CJXKYWRXFRKTNX-INIZCTEOSA-N	0	3	337.895	3.369	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H]([C@@H](C)NCc2nc(C)sc2C)C1	ZINC001753794039	1440489391	/nfs/dbraw/zinc/48/93/91/1440489391.db2.gz	JPPAQVZOAUMXJK-RHSMWYFYSA-N	0	3	347.528	3.280	20	30		EGEDHN
CC(C)[C@H](CNC(=O)[C@H](C)C1CCC1)NCc1ccc(C#N)cc1F	ZINC001753832714	1440500228	/nfs/dbraw/zinc/50/02/28/1440500228.db2.gz	SLRAHVHFEMMNQM-KUHUBIRLSA-N	0	3	345.462	3.364	20	30		EGEDHN
C=C(C)CCC(=O)N(C)CCN(C)Cc1cccc2c1CCOC2	ZINC001753854404	1440508235	/nfs/dbraw/zinc/50/82/35/1440508235.db2.gz	JKNCBXLNOSVSTK-UHFFFAOYSA-N	0	3	330.472	3.006	20	30		EGEDHN
C[C@H](CCNCc1ccccc1C#N)NC(=O)[C@@]12C[C@@H]1CCCC2	ZINC001753998231	1440529838	/nfs/dbraw/zinc/52/98/38/1440529838.db2.gz	OXFONMZWEKLALP-BPAFIMBUSA-N	0	3	325.456	3.123	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H](C)CCNCc2cc(C#N)ccc2F)cc1	ZINC001754016245	1440531935	/nfs/dbraw/zinc/53/19/35/1440531935.db2.gz	JSGIWNYUBDWHMJ-HNNXBMFYSA-N	0	3	339.414	3.304	20	30		EGEDHN
C=C(Cl)CNCC[C@H](C)NC(=O)[C@@H](C)Cc1cccc(F)c1	ZINC001754026874	1440533212	/nfs/dbraw/zinc/53/32/12/1440533212.db2.gz	NYXSEACAYYAQGB-JSGCOSHPSA-N	0	3	326.843	3.241	20	30		EGEDHN
CCN(CCNCc1cccc(C#N)c1)C(=O)[C@@]1(C)CCC[C@@H]1C	ZINC001754066098	1440537456	/nfs/dbraw/zinc/53/74/56/1440537456.db2.gz	YBMMRZOEZOINEX-JXFKEZNVSA-N	0	3	327.472	3.323	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)NC(=O)CCCc1ccsc1	ZINC001754230480	1440553914	/nfs/dbraw/zinc/55/39/14/1440553914.db2.gz	WFPRLRTXAGNDQB-CYBMUJFWSA-N	0	3	347.509	3.298	20	30		EGEDHN
CC#CCCCC(=O)N[C@H](C)CNCc1cc(Cl)ccc1OC	ZINC001754239863	1440555548	/nfs/dbraw/zinc/55/55/48/1440555548.db2.gz	VMSHXDYWTMLHPF-CQSZACIVSA-N	0	3	336.863	3.137	20	30		EGEDHN
Cc1cc(Cl)ccc1C(=O)N[C@H](C)CNCc1ccc(C#N)s1	ZINC001754241627	1440555878	/nfs/dbraw/zinc/55/58/78/1440555878.db2.gz	ORQUAHKWHBWQOJ-GFCCVEGCSA-N	0	3	347.871	3.490	20	30		EGEDHN
Cc1cc(C)c(C(=O)N[C@@H](C)CNCc2ccc(C#N)s2)s1	ZINC001754268865	1440561119	/nfs/dbraw/zinc/56/11/19/1440561119.db2.gz	NXVARQWLVYIWMB-NSHDSACASA-N	0	3	333.482	3.206	20	30		EGEDHN
C=C(Br)CNCCCN(C)C(=O)[C@H]1CCCC1(C)C	ZINC001754389879	1440594089	/nfs/dbraw/zinc/59/40/89/1440594089.db2.gz	ANYPUPWKJUPSSS-CYBMUJFWSA-N	0	3	331.298	3.159	20	30		EGEDHN
CC(C)(C)/C=C\C(=O)N[C@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001754434348	1440597755	/nfs/dbraw/zinc/59/77/55/1440597755.db2.gz	ACBTWUQOOXSNPI-CNZFZVQHSA-N	0	3	343.446	3.284	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H](CNCc1cccc(Cl)c1F)C1CC1	ZINC001754439128	1440598691	/nfs/dbraw/zinc/59/86/91/1440598691.db2.gz	KWTSLIQFIHAXCD-MRXNPFEDSA-N	0	3	336.838	3.123	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC(N(CCOC)C[C@H](F)CC)CC1	ZINC001754559767	1440633283	/nfs/dbraw/zinc/63/32/83/1440633283.db2.gz	QLVHNHWSZQFSNP-MRXNPFEDSA-N	0	3	342.499	3.276	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](NCc2nc(C)c(C)s2)C[C@H]1C	ZINC001754597710	1440641760	/nfs/dbraw/zinc/64/17/60/1440641760.db2.gz	FGOSTVPDSJNLPY-PBHICJAKSA-N	0	3	347.528	3.423	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC[C@H]1CNCc1ccc(C#N)cc1F	ZINC001754610685	1440643698	/nfs/dbraw/zinc/64/36/98/1440643698.db2.gz	KDJDSHXKUJMYRP-KRWDZBQOSA-N	0	3	329.419	3.134	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC[C@H]1CNCc1ccnc(Cl)c1	ZINC001754615684	1440644482	/nfs/dbraw/zinc/64/44/82/1440644482.db2.gz	YBWMAPWLNKJDJI-HOCLYGCPSA-N	0	3	335.879	3.418	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC1(C)CCN(Cc2cccnc2C)CC1	ZINC001754626432	1440646580	/nfs/dbraw/zinc/64/65/80/1440646580.db2.gz	CEYBYVVEPCKFQJ-UHFFFAOYSA-N	0	3	329.488	3.463	20	30		EGEDHN
C#CCCCC(=O)N[C@]1(C)CCN(CCOc2cccc(Cl)c2)C1	ZINC001754672330	1440658308	/nfs/dbraw/zinc/65/83/08/1440658308.db2.gz	GJCAXCYIPBTSTE-LJQANCHMSA-N	0	3	348.874	3.103	20	30		EGEDHN
C=CCCC(=O)NCC1(NCc2ccc(Cl)s2)CCOCC1	ZINC001754734099	1440681311	/nfs/dbraw/zinc/68/13/11/1440681311.db2.gz	MNRBPQQWALGRFN-UHFFFAOYSA-N	0	3	342.892	3.123	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NC[C@@H](NCC=C)c1ccccc1CC	ZINC001754788826	1440688312	/nfs/dbraw/zinc/68/83/12/1440688312.db2.gz	HEUSGMGQTCKUKE-JOCHJYFZSA-N	0	3	346.474	3.406	20	30		EGEDHN
C#CCNCCN(Cc1ccccc1)C(=O)c1cccc2c1CCC2	ZINC001754839083	1440697509	/nfs/dbraw/zinc/69/75/09/1440697509.db2.gz	BWYKIQIHZKGSKO-UHFFFAOYSA-N	0	3	332.447	3.041	20	30		EGEDHN
CC#CCNCCN(Cc1ccccc1)C(=O)[C@H](C)c1ccccc1	ZINC001754839565	1440697650	/nfs/dbraw/zinc/69/76/50/1440697650.db2.gz	VRIMVVOSUCQVGE-LJQANCHMSA-N	0	3	334.463	3.432	20	30		EGEDHN
C=CCCCC(=O)N1C[C@H]2CN(Cc3oc(C(C)C)nc3C)C[C@H]2C1	ZINC001754844998	1440698971	/nfs/dbraw/zinc/69/89/71/1440698971.db2.gz	DWCPYGFKJDMMFF-CALCHBBNSA-N	0	3	345.487	3.353	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1ccc(F)cc1	ZINC001754865239	1440702729	/nfs/dbraw/zinc/70/27/29/1440702729.db2.gz	IRYPGGKJLFUBEQ-RTBURBONSA-N	0	3	328.431	3.195	20	30		EGEDHN
C=C(Br)CNCC[C@H]1CCN(C(=O)/C(C)=C/CC)C1	ZINC001754905094	1440707481	/nfs/dbraw/zinc/70/74/81/1440707481.db2.gz	ATDVXPRZDLZDGS-CLUXPMKYSA-N	0	3	329.282	3.080	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](CCNCc3oc(C)nc3C)C2)CCC1	ZINC001754930697	1440710489	/nfs/dbraw/zinc/71/04/89/1440710489.db2.gz	NNXJSGZFCSNXHQ-QGZVFWFLSA-N	0	3	345.487	3.366	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCc1ccccc1CN(C)[C@H](C)COC	ZINC001754946468	1440713408	/nfs/dbraw/zinc/71/34/08/1440713408.db2.gz	JLWIPMCNVWHGIR-MRXNPFEDSA-N	0	3	332.488	3.372	20	30		EGEDHN
C#CCCCCC(=O)N1CCC(CC)(NCc2cscn2)CC1	ZINC001755068411	1440745859	/nfs/dbraw/zinc/74/58/59/1440745859.db2.gz	CXNFJCJCCWTAOR-UHFFFAOYSA-N	0	3	333.501	3.198	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1CCN(Cc2cccc(F)c2)[C@H](C)C1	ZINC001755168742	1440768099	/nfs/dbraw/zinc/76/80/99/1440768099.db2.gz	GOEPTFCUWBEHAL-APWZRJJASA-N	0	3	330.447	3.488	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C3(CCCC)CC3)CC2)C1	ZINC001755173980	1440770088	/nfs/dbraw/zinc/77/00/88/1440770088.db2.gz	FDIYUINFZLXQSP-UHFFFAOYSA-N	0	3	334.504	3.226	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)CN(C)c1ccccc1	ZINC001755187954	1440773597	/nfs/dbraw/zinc/77/35/97/1440773597.db2.gz	UTWAVTLCZZDRIT-IFMALSPDSA-N	0	3	349.478	3.071	20	30		EGEDHN
C=C(Cl)CNCC1CC(NC(=O)C[C@H]2CCc3ccccc3C2)C1	ZINC001755221376	1440784675	/nfs/dbraw/zinc/78/46/75/1440784675.db2.gz	WBGUVKBVQMFSJN-LYGPFTKASA-N	0	3	346.902	3.419	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H](C)[C@@H](C)NCc1cnn(C(C)(C)C)c1	ZINC001755248010	1440791197	/nfs/dbraw/zinc/79/11/97/1440791197.db2.gz	FSHHGJAHBCKERK-HUUCEWRRSA-N	0	3	334.508	3.223	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)[C@H](C)NCc2cccc(OC)n2)CCCC1	ZINC001755267097	1440796494	/nfs/dbraw/zinc/79/64/94/1440796494.db2.gz	BLAUOSAMISWIAY-JKSUJKDBSA-N	0	3	345.487	3.210	20	30		EGEDHN
C=C(Br)CNCC(C)(C)CN(C)C(=O)[C@@H](C)CCC	ZINC001755279036	1440800000	/nfs/dbraw/zinc/80/00/00/1440800000.db2.gz	AXIJIGGTWQVOIP-LBPRGKRZSA-N	0	3	333.314	3.405	20	30		EGEDHN
C[C@H](CNC(=O)C#CC1CC1)N(C)Cc1ccccc1C(F)(F)F	ZINC001755300233	1440808265	/nfs/dbraw/zinc/80/82/65/1440808265.db2.gz	MLRVHOYTLKBTPA-CYBMUJFWSA-N	0	3	338.373	3.055	20	30		EGEDHN
C=CCOCCN(C)[C@@H](C)CNC(=O)c1cccc(C(C)(C)C)c1	ZINC001755321611	1440818954	/nfs/dbraw/zinc/81/89/54/1440818954.db2.gz	QIIOUBSMAQRBLB-INIZCTEOSA-N	0	3	332.488	3.237	20	30		EGEDHN
C=CC(C)(C)C(=O)N(C)CC[C@@H](NCc1cc2n(n1)CCC2)C(C)C	ZINC001755341163	1440825339	/nfs/dbraw/zinc/82/53/39/1440825339.db2.gz	CCRVOJZSTJYQOY-GOSISDBHSA-N	0	3	346.519	3.004	20	30		EGEDHN
C=C(Cl)CNCCCOC1CCN(C(=O)/C=C(/C)C2CC2)CC1	ZINC001755344326	1440826202	/nfs/dbraw/zinc/82/62/02/1440826202.db2.gz	UOWZUTHWUABQDT-OWBHPGMISA-N	0	3	340.895	3.083	20	30		EGEDHN
CCCC[C@H](CNCc1ccc(Cl)nc1)NC(=O)C#CC(C)C	ZINC001755357599	1440830357	/nfs/dbraw/zinc/83/03/57/1440830357.db2.gz	JICGIUMLFVWVIG-MRXNPFEDSA-N	0	3	335.879	3.159	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CC[C@H](NC(=O)C3(C(F)F)CCC3)C[C@H]2C1	ZINC001755453891	1440854659	/nfs/dbraw/zinc/85/46/59/1440854659.db2.gz	UHFLTJIZSUONPB-IHRRRGAJSA-N	0	3	346.849	3.391	20	30		EGEDHN
C=C(Cl)CNC[C@H]1C[C@H](NC(=O)C[C@@H]2CCO[C@@H](C(C)C)C2)C1	ZINC001755481120	1440860102	/nfs/dbraw/zinc/86/01/02/1440860102.db2.gz	DQNUVXIKNQZJEG-QBPKDAKJSA-N	0	3	342.911	3.065	20	30		EGEDHN
C=C(Cl)CNC[C@H]1C[C@H](NC(=O)c2c(F)cccc2Cl)C1	ZINC001755482473	1440860346	/nfs/dbraw/zinc/86/03/46/1440860346.db2.gz	XXPZLDGAZFGALJ-XYPYZODXSA-N	0	3	331.218	3.330	20	30		EGEDHN
C[C@H](CCCNCc1ccccc1C#N)NC(=O)c1ccoc1Cl	ZINC001755495187	1440861978	/nfs/dbraw/zinc/86/19/78/1440861978.db2.gz	CDGCIBNOQZJJGC-CYBMUJFWSA-N	0	3	345.830	3.493	20	30		EGEDHN
C=C(Cl)CNCCC[C@@H](C)NC(=O)c1ccc(F)c(F)c1F	ZINC001755510682	1440863610	/nfs/dbraw/zinc/86/36/10/1440863610.db2.gz	DLUBACMTVWXUBP-SNVBAGLBSA-N	0	3	334.769	3.345	20	30		EGEDHN
CN(CC#Cc1ccccc1)C1CCN(C(=O)[C@H]2CC[C@H](F)C2)CC1	ZINC001755532582	1440867956	/nfs/dbraw/zinc/86/79/56/1440867956.db2.gz	SIILJLBUWIVURW-OALUTQOASA-N	0	3	342.458	3.099	20	30		EGEDHN
C#Cc1cncc(C(=O)N(C)C[C@H](C)N[C@@H](C)c2ccccc2F)c1	ZINC001755604338	1440884948	/nfs/dbraw/zinc/88/49/48/1440884948.db2.gz	UJQPDFFEHLCGOW-GJZGRUSLSA-N	0	3	339.414	3.013	20	30		EGEDHN
C=C1CCC(C(=O)N(C)C[C@@H](C)NCc2ccc(C#N)c(F)c2)CC1	ZINC001755604998	1440885066	/nfs/dbraw/zinc/88/50/66/1440885066.db2.gz	GFIHGBAMHNMGMY-OAHLLOKOSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=CC1(CC(=O)N(C)C[C@@H](C)NCc2cnc(C)nc2)CCCCC1	ZINC001755609216	1440886573	/nfs/dbraw/zinc/88/65/73/1440886573.db2.gz	SHWDBTBNAIMFCS-MRXNPFEDSA-N	0	3	344.503	3.248	20	30		EGEDHN
C=CCC1(C(=O)NC[C@H](CO)N[C@H](C)c2ccccc2C)CCCC1	ZINC001755649427	1440891136	/nfs/dbraw/zinc/89/11/36/1440891136.db2.gz	UVNFRBLJKHMLEP-QZTJIDSGSA-N	0	3	344.499	3.259	20	30		EGEDHN
C#CCCCCC(=O)N[C@]12CCC[C@@H]1N(Cc1cnccc1C)CC2	ZINC001755697904	1440898531	/nfs/dbraw/zinc/89/85/31/1440898531.db2.gz	CUSZTKZVVVJPIX-FPOVZHCZSA-N	0	3	339.483	3.197	20	30		EGEDHN
CC#CCN1CC[C@]2(NC(=O)[C@H](CC)OC3CCCCC3)CCC[C@H]12	ZINC001755699109	1440898963	/nfs/dbraw/zinc/89/89/63/1440898963.db2.gz	SMCXWWWKQSFFNV-IRFCIJBXSA-N	0	3	346.515	3.251	20	30		EGEDHN
C#CCN1CC[C@@]2(NC(=O)CCCc3sccc3C)CCC[C@@H]12	ZINC001755704065	1440901657	/nfs/dbraw/zinc/90/16/57/1440901657.db2.gz	HFKLEESNRXHRNX-MJGOQNOKSA-N	0	3	330.497	3.126	20	30		EGEDHN
C=CCOCCN1CCC[C@H](NC(=O)c2coc3ccccc32)[C@H]1C	ZINC001755723461	1440908415	/nfs/dbraw/zinc/90/84/15/1440908415.db2.gz	PLPVJUQHRVTIKF-QAPCUYQASA-N	0	3	342.439	3.218	20	30		EGEDHN
C=CCN1CCC[C@@H](NC(=O)CCCc2ccc(OC)cc2)[C@H]1C	ZINC001755723550	1440908682	/nfs/dbraw/zinc/90/86/82/1440908682.db2.gz	RJBUUEYOIIZFSZ-VQIMIIECSA-N	0	3	330.472	3.173	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1CC[C@H](CNCc2csc(C)n2)C1	ZINC001755725466	1440909340	/nfs/dbraw/zinc/90/93/40/1440909340.db2.gz	AIORXTSTCSWWDW-HOTGVXAUSA-N	0	3	333.501	3.020	20	30		EGEDHN
Cc1cccc(C(=O)N2C[C@@H](NCC#Cc3ccccc3)C(C)(C)C2)c1	ZINC001755751354	1440913278	/nfs/dbraw/zinc/91/32/78/1440913278.db2.gz	NFPBIPFVEJMTRZ-OAQYLSRUSA-N	0	3	346.474	3.487	20	30		EGEDHN
CC(C)(C)[C@@H](CNCc1ccc(C#N)s1)NC(=O)[C@@H]1CC12CC2	ZINC001755833698	1440929363	/nfs/dbraw/zinc/92/93/63/1440929363.db2.gz	ODKVOIFNCGHPQJ-LSDHHAIUSA-N	0	3	331.485	3.040	20	30		EGEDHN
CC#CCN1CCC([C@@H](C)NC(=O)[C@@H](C)Oc2ccc(C)cc2)CC1	ZINC001755846351	1440933504	/nfs/dbraw/zinc/93/35/04/1440933504.db2.gz	WFTRNQULOTZOOQ-QZTJIDSGSA-N	0	3	342.483	3.002	20	30		EGEDHN
C=C(C)[C@H](CO)[NH2+][C@H](C)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1	ZINC000823873140	946495777	/nfs/dbraw/zinc/49/57/77/946495777.db2.gz	JIGIHJMBBPDJIG-KUHUBIRLSA-N	0	3	349.438	3.121	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C	ZINC000265970595	247982215	/nfs/dbraw/zinc/98/22/15/247982215.db2.gz	KRJVWRCGWRTBON-LLLHUVSDSA-N	0	3	348.512	3.054	20	30		EGEDHN
C=C(C)COc1cc(CNC[C@H](O)c2ccc(C)o2)ccc1OC	ZINC000266032574	248048194	/nfs/dbraw/zinc/04/81/94/248048194.db2.gz	SJZKALAIBLECKA-INIZCTEOSA-N	0	3	331.412	3.375	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)o1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000266195114	248164569	/nfs/dbraw/zinc/16/45/69/248164569.db2.gz	JMCINUNKDZCRJL-KBPBESRZSA-N	0	3	333.432	3.276	20	30		EGEDHN
C=CCN(CC=C)C(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000267417876	251039835	/nfs/dbraw/zinc/03/98/35/251039835.db2.gz	PLHKYCNKFGWIIV-IEBWSBKVSA-N	0	3	327.472	3.281	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1	ZINC000338120995	141096828	/nfs/dbraw/zinc/09/68/28/141096828.db2.gz	OCQWWEWCYMFBRQ-INIZCTEOSA-N	0	3	348.450	3.217	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1	ZINC000338137850	141100704	/nfs/dbraw/zinc/10/07/04/141100704.db2.gz	UCISUJMXYVQXDR-HNAYVOBHSA-N	0	3	333.435	3.260	20	30		EGEDHN
CN(C)CCN(C(=O)c1cccc(Nc2ccc(C#N)cc2)c1)C1CC1	ZINC000356271573	141333148	/nfs/dbraw/zinc/33/31/48/141333148.db2.gz	CJJKSYNVJYPLLQ-UHFFFAOYSA-N	0	3	348.450	3.468	20	30		EGEDHN
Cc1nc(C(=O)NC2CCN([C@@H](C)c3ccccc3)CC2)ccc1C#N	ZINC000172247546	144018818	/nfs/dbraw/zinc/01/88/18/144018818.db2.gz	UUFGJLHUKKWBPF-INIZCTEOSA-N	0	3	348.450	3.217	20	30		EGEDHN
N#Cc1cccc(F)c1CC(=O)N1C[C@@H]2CCCN2Cc2ccccc21	ZINC000341380929	155258888	/nfs/dbraw/zinc/25/88/88/155258888.db2.gz	OXHWAGCHGAJRRU-KRWDZBQOSA-N	0	3	349.409	3.251	20	30		EGEDHN
COc1cc(CN(CCN(C)C)Cc2ccc(C#N)cc2)ccc1C	ZINC000348924186	156289118	/nfs/dbraw/zinc/28/91/18/156289118.db2.gz	VLYKOLZVXFTBFG-UHFFFAOYSA-N	0	3	337.467	3.439	20	30		EGEDHN
Cc1nc(C)c(CN(CCN(C)C)Cc2ccc(C#N)cc2)s1	ZINC000348937910	156294979	/nfs/dbraw/zinc/29/49/79/156294979.db2.gz	WYRCAMRYDGQQAE-UHFFFAOYSA-N	0	3	328.485	3.195	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCCN(c3ccc(C#N)cc3F)C2)s1	ZINC000378004154	157451583	/nfs/dbraw/zinc/45/15/83/157451583.db2.gz	MYIALCQHQHNDBF-CQSZACIVSA-N	0	3	340.427	3.389	20	30		EGEDHN
CCOC(=O)CC(C)(C)N(C)Cc1ccc(C#N)cc1OC(F)F	ZINC000343896116	164060849	/nfs/dbraw/zinc/06/08/49/164060849.db2.gz	IVURDRUQWBTJBN-UHFFFAOYSA-N	0	3	340.370	3.323	20	30		EGEDHN
CNC(=O)[C@@H](Cc1c[nH]c2ccccc12)N[C@@H](C)c1cccc(C#N)c1	ZINC000344144094	164113700	/nfs/dbraw/zinc/11/37/00/164113700.db2.gz	SSMWNRXTKNYURA-VBKZILBWSA-N	0	3	346.434	3.047	20	30		EGEDHN
CCC(CC)(CC(=O)OC)NCc1ccc(C#N)cc1OC(F)F	ZINC000350656322	165062626	/nfs/dbraw/zinc/06/26/26/165062626.db2.gz	IYMGOFVVNDYZQU-UHFFFAOYSA-N	0	3	340.370	3.371	20	30		EGEDHN
CC1CCC(N2CCN(C(=O)Nc3ccc(C#N)c(F)c3)CC2)CC1	ZINC000353539500	165795723	/nfs/dbraw/zinc/79/57/23/165795723.db2.gz	LXNMDSOSLURWLH-UHFFFAOYSA-N	0	3	344.434	3.426	20	30		EGEDHN
N#Cc1csc(CNc2cccc(CN3CCC(O)CC3)c2)c1	ZINC000355399418	166185098	/nfs/dbraw/zinc/18/50/98/166185098.db2.gz	LUOIQZQKRKIVJW-UHFFFAOYSA-N	0	3	327.453	3.189	20	30		EGEDHN
CN(C)Cc1ccc(-c2noc(COc3ccccc3C#N)n2)cc1	ZINC000355592935	166253711	/nfs/dbraw/zinc/25/37/11/166253711.db2.gz	CQFJVJZEMKAOTM-UHFFFAOYSA-N	0	3	334.379	3.249	20	30		EGEDHN
CN(C)C[C@H](NC(=O)c1ccc(F)c(C#N)c1)c1ccc(Cl)cc1	ZINC000355853005	166328400	/nfs/dbraw/zinc/32/84/00/166328400.db2.gz	DNUUUJLYYALTHA-KRWDZBQOSA-N	0	3	345.805	3.383	20	30		EGEDHN
COC(=O)c1ccc(CN(Cc2ccc(C#N)cc2)CC(C)C)[nH]1	ZINC000359245490	167105953	/nfs/dbraw/zinc/10/59/53/167105953.db2.gz	ZOLVJBXHTWSMPW-UHFFFAOYSA-N	0	3	325.412	3.331	20	30		EGEDHN
CC[C@@H](C)N[C@@H](CNC(=O)c1c(F)cc(C#N)cc1F)c1ccco1	ZINC000359564632	167195366	/nfs/dbraw/zinc/19/53/66/167195366.db2.gz	UEOZAKUBMIUERR-ABAIWWIYSA-N	0	3	347.365	3.289	20	30		EGEDHN
Cc1ccc([C@@H](Cn2ccnc2)NCc2cc(C#N)n(C)c2)c(C)c1	ZINC000359691312	167210807	/nfs/dbraw/zinc/21/08/07/167210807.db2.gz	YSLMKMMZSOICTI-HXUWFJFHSA-N	0	3	333.439	3.241	20	30		EGEDHN
COCCSc1ccc([C@@H](C)NCc2cc(C#N)n(C)c2)cc1	ZINC000359739684	167218704	/nfs/dbraw/zinc/21/87/04/167218704.db2.gz	MKUMNIBJCQHDNB-CQSZACIVSA-N	0	3	329.469	3.486	20	30		EGEDHN
CC1CCC(N2CCN(CCOc3ccccc3C#N)CC2)CC1	ZINC000360257315	167283990	/nfs/dbraw/zinc/28/39/90/167283990.db2.gz	PNDQAOPBGZDMQV-UHFFFAOYSA-N	0	3	327.472	3.133	20	30		EGEDHN
C[C@@H](C(=O)N1CC=C(c2ccc(C#N)cc2)CC1)N1[C@H](C)CC[C@H]1C	ZINC000367229006	168196532	/nfs/dbraw/zinc/19/65/32/168196532.db2.gz	NOXXCUCPKWNNGJ-ZACQAIPSSA-N	0	3	337.467	3.435	20	30		EGEDHN
CCOc1ncccc1CNC1CCN(c2ccc(C#N)cc2)CC1	ZINC000367611606	168249175	/nfs/dbraw/zinc/24/91/75/168249175.db2.gz	CIDMHXHYXOLZMV-UHFFFAOYSA-N	0	3	336.439	3.111	20	30		EGEDHN
COC[C@H](NC1CCN(c2ccc(C#N)cc2)CC1)c1ccco1	ZINC000367638824	168253567	/nfs/dbraw/zinc/25/35/67/168253567.db2.gz	QWXXTAJQTFJADS-SFHVURJKSA-N	0	3	325.412	3.097	20	30		EGEDHN
Cc1ncsc1CN1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC000122837134	222169022	/nfs/dbraw/zinc/16/90/22/222169022.db2.gz	OPQLKSIGWFLVGL-UHFFFAOYSA-N	0	3	326.469	3.031	20	30		EGEDHN
N#Cc1ccc(CNCCOc2ncccc2C(F)(F)F)s1	ZINC000122859593	222172687	/nfs/dbraw/zinc/17/26/87/222172687.db2.gz	FTWSSXSKOPEBOS-UHFFFAOYSA-N	0	3	327.331	3.202	20	30		EGEDHN
Cc1cccc(C(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)c1F	ZINC000122871721	222174582	/nfs/dbraw/zinc/17/45/82/222174582.db2.gz	GFSTUAGRENDQJS-UHFFFAOYSA-N	0	3	339.414	3.210	20	30		EGEDHN
COCc1ccc(NC(=O)[C@@H](C(C)C)N2CCCCC2)cc1C#N	ZINC000529814833	269757554	/nfs/dbraw/zinc/75/75/54/269757554.db2.gz	AKRZVSJYIKOSGS-GOSISDBHSA-N	0	3	329.444	3.154	20	30		EGEDHN
C[C@H]1C[C@H](Nc2nc3ccccn3c2C#N)CN1Cc1ccccc1	ZINC000302147721	269895536	/nfs/dbraw/zinc/89/55/36/269895536.db2.gz	GXKZOYVCEXYOFV-RDJZCZTQSA-N	0	3	331.423	3.281	20	30		EGEDHN
Cc1cc(CN[C@@H]2C[C@H](OC(C)(C)C)[C@@H]2n2cccn2)ccc1C#N	ZINC000449657465	269913629	/nfs/dbraw/zinc/91/36/29/269913629.db2.gz	PEMQQFNSJNKBDT-CEXWTWQISA-N	0	3	338.455	3.350	20	30		EGEDHN
Cc1cccc(O[C@@H](C)CNC(=O)C(C#N)Cc2ccc(C#N)cc2)c1	ZINC000280441122	270039672	/nfs/dbraw/zinc/03/96/72/270039672.db2.gz	NAYWMJBLJBZSAJ-LPHOPBHVSA-N	0	3	347.418	3.133	20	30		EGEDHN
CC(C)(C)OC1CCN(C(=O)C(C#N)Cc2ccc(C#N)cc2)CC1	ZINC000280160766	270040013	/nfs/dbraw/zinc/04/00/13/270040013.db2.gz	RZGMBIACOACRKA-QGZVFWFLSA-N	0	3	339.439	3.047	20	30		EGEDHN
N#Cc1ccc(OC2CCN(CCc3cncs3)CC2)c(F)c1	ZINC000411727905	270046790	/nfs/dbraw/zinc/04/67/90/270046790.db2.gz	QRZHSLCITDIRGW-UHFFFAOYSA-N	0	3	331.416	3.240	20	30		EGEDHN
CSc1ccc(OC[C@@H](O)CN[C@@H](C)c2ccc(C#N)cc2)cc1	ZINC000411456688	270046856	/nfs/dbraw/zinc/04/68/56/270046856.db2.gz	VBWDBEGJGGWNOT-YOEHRIQHSA-N	0	3	342.464	3.371	20	30		EGEDHN
N#Cc1cccc(COc2cccc(CN[C@H](CO)CC(F)F)c2)c1	ZINC000428645503	270050251	/nfs/dbraw/zinc/05/02/51/270050251.db2.gz	CPCAOKBKTTYFAV-KRWDZBQOSA-N	0	3	346.377	3.243	20	30		EGEDHN
CCOC(=O)N1CCC([C@H](C)NCc2ccc(C#N)cc2F)CC1	ZINC000189362260	266257786	/nfs/dbraw/zinc/25/77/86/266257786.db2.gz	RZWHMOFIGKFUEU-ZDUSSCGKSA-N	0	3	333.407	3.044	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H](CCNCc2ccc(C#N)cc2F)C1	ZINC000269428662	266292715	/nfs/dbraw/zinc/29/27/15/266292715.db2.gz	OOSONPVRHWUFON-CQSZACIVSA-N	0	3	347.434	3.434	20	30		EGEDHN
CCO[C@@H]1C[C@@H](NCC(=O)Nc2cc(Cl)ccc2C#N)C12CCC2	ZINC000296328576	266294771	/nfs/dbraw/zinc/29/47/71/266294771.db2.gz	QOXCDCXGBJZZLF-HZPDHXFCSA-N	0	3	347.846	3.087	20	30		EGEDHN
CCO[C@@H]1C[C@H](N[C@@H](C)C(=O)Nc2oc(C)c(C)c2C#N)C12CCC2	ZINC000296038518	266297699	/nfs/dbraw/zinc/29/76/99/266297699.db2.gz	FCYGJOKIRJHINY-VBNZEHGJSA-N	0	3	345.443	3.032	20	30		EGEDHN
CC[C@@H]1CN(CCC(=O)Nc2ccc(C#N)c(Cl)c2)CCCO1	ZINC000281284796	266380184	/nfs/dbraw/zinc/38/01/84/266380184.db2.gz	GONPIZGTSYGLJW-OAHLLOKOSA-N	0	3	335.835	3.041	20	30		EGEDHN
C[C@@H]1CN(CCC2CCN(c3ccc(F)cc3C#N)CC2)C[C@H](C)O1	ZINC000301511621	267047079	/nfs/dbraw/zinc/04/70/79/267047079.db2.gz	ATKSRUFCNSPHBD-IYBDPMFKSA-N	0	3	345.462	3.413	20	30		EGEDHN
CCN(CCOc1ccc(C#N)cc1)Cc1ccc(OC)cc1OC	ZINC000521820667	267066530	/nfs/dbraw/zinc/06/65/30/267066530.db2.gz	PUWRPBHWLBMFOA-UHFFFAOYSA-N	0	3	340.423	3.476	20	30		EGEDHN
CCS(=O)(=O)Nc1ccc([C@H](C)NCc2ccc(C#N)s2)cc1	ZINC000421885384	267178100	/nfs/dbraw/zinc/17/81/00/267178100.db2.gz	RKVRLVJBPITJFH-LBPRGKRZSA-N	0	3	349.481	3.232	20	30		EGEDHN
C[C@H](NC1(c2cccc(C#N)c2)CC1)c1cccc(-n2ccnn2)c1	ZINC000287729754	267179170	/nfs/dbraw/zinc/17/91/70/267179170.db2.gz	PBIDGHPJWJNBBE-HNNXBMFYSA-N	0	3	329.407	3.479	20	30		EGEDHN
C[C@H](NC[C@@H]1CN(Cc2ccccc2)CCO1)c1ccc(C#N)cc1	ZINC000271703244	267183982	/nfs/dbraw/zinc/18/39/82/267183982.db2.gz	UJRKOKYPYPHCKE-LAUBAEHRSA-N	0	3	335.451	3.110	20	30		EGEDHN
C[C@H](NCCOc1ccccc1C#N)[C@@H]1OCCc2sccc21	ZINC000292373069	267184026	/nfs/dbraw/zinc/18/40/26/267184026.db2.gz	IZYRXNNRUWKXNR-UGSOOPFHSA-N	0	3	328.437	3.291	20	30		EGEDHN
C[C@H](NCc1cccc(N2CCOCC2)c1)c1ccc(C#N)c(F)c1	ZINC000293665129	267185164	/nfs/dbraw/zinc/18/51/64/267185164.db2.gz	IZZSWGQZQNEJCY-HNNXBMFYSA-N	0	3	339.414	3.385	20	30		EGEDHN
CC[C@@H](N[C@H]1CCN(c2ccc(C#N)cc2)C1=O)c1cccs1	ZINC000411512378	267198052	/nfs/dbraw/zinc/19/80/52/267198052.db2.gz	LOTQORNLXZUJSR-CVEARBPZSA-N	0	3	325.437	3.466	20	30		EGEDHN
C[C@H]1CN(CCC2CCN(c3ccc(C#N)cc3)CC2)C[C@H](C)O1	ZINC000301558128	267229886	/nfs/dbraw/zinc/22/98/86/267229886.db2.gz	NYPJMACGHRKQTK-IRXDYDNUSA-N	0	3	327.472	3.274	20	30		EGEDHN
CCO[C@H]1C[C@@H](NC2(c3cccc(C#N)c3)CC2)C12CCOCC2	ZINC000274514022	267248922	/nfs/dbraw/zinc/24/89/22/267248922.db2.gz	XAXWEZACKDNRJO-MSOLQXFVSA-N	0	3	326.440	3.111	20	30		EGEDHN
CN(C)CCOc1cccc(NC(=O)/C=C\c2ccc(C#N)cc2)c1	ZINC000491168979	267280388	/nfs/dbraw/zinc/28/03/88/267280388.db2.gz	VLALSSWTKDJSNL-KHPPLWFESA-N	0	3	335.407	3.151	20	30		EGEDHN
CN(C)[C@@H](CNc1cncc(C#N)n1)c1cccc(C(F)(F)F)c1	ZINC000420612899	267285629	/nfs/dbraw/zinc/28/56/29/267285629.db2.gz	QDVWNQXLLHWZDY-AWEZNQCLSA-N	0	3	335.333	3.082	20	30		EGEDHN
Cc1ccc(C#N)cc1NC(=O)N1CCN(C2CCC2)C[C@@H](C)C1	ZINC000292623970	267384490	/nfs/dbraw/zinc/38/44/90/267384490.db2.gz	NCPKALAUVUZOKG-CQSZACIVSA-N	0	3	326.444	3.205	20	30		EGEDHN
Cc1[nH]c(C#N)cc1C(=O)NC1CCN([C@H](C)c2ccccc2)CC1	ZINC000449874381	267923480	/nfs/dbraw/zinc/92/34/80/267923480.db2.gz	BJTBHIBKECYWKS-OAHLLOKOSA-N	0	3	336.439	3.150	20	30		EGEDHN
Cc1ccc(C2(CN[C@H](C(N)=O)c3ccc(C#N)cc3)CCC2)cc1C	ZINC000432499052	268034093	/nfs/dbraw/zinc/03/40/93/268034093.db2.gz	DMQQLKYTSTZHSY-FQEVSTJZSA-N	0	3	347.462	3.413	20	30		EGEDHN
N#Cc1ccc(CNC[C@@]2(Cc3ccc(F)cc3)CCC[C@@H]2O)o1	ZINC000277423347	268074409	/nfs/dbraw/zinc/07/44/09/268074409.db2.gz	GVLMGXXZAPWHRS-OALUTQOASA-N	0	3	328.387	3.154	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCCCOC2CCCCC2)cc1	ZINC000280577996	268085673	/nfs/dbraw/zinc/08/56/73/268085673.db2.gz	DAWDPAGUSRPQQH-SFHVURJKSA-N	0	3	339.439	3.096	20	30		EGEDHN
N#Cc1cccc(OCCN(CCCO)Cc2cccc(Cl)c2)c1	ZINC000441080852	268285215	/nfs/dbraw/zinc/28/52/15/268285215.db2.gz	SBMYJDSRZKGVBF-UHFFFAOYSA-N	0	3	344.842	3.475	20	30		EGEDHN
CO[C@@H](CN1CCCN(c2ccccc2C#N)CC1)c1ccccc1	ZINC000338547465	274059208	/nfs/dbraw/zinc/05/92/08/274059208.db2.gz	ONQIWXBLRAIZOL-NRFANRHFSA-N	0	3	335.451	3.458	20	30		EGEDHN
CS[C@H]1CN(c2c(C#N)cnc3ccc(Cl)cc32)C[C@@H]1N(C)C	ZINC000340741008	274186343	/nfs/dbraw/zinc/18/63/43/274186343.db2.gz	IUYMREPJXQYIEV-HOTGVXAUSA-N	0	3	346.887	3.242	20	30		EGEDHN
N#Cc1cnc2c(F)cc(F)cc2c1N1CC[C@@H](N2CCCCC2)C1	ZINC000352325696	274929996	/nfs/dbraw/zinc/92/99/96/274929996.db2.gz	VSLYGSMRAFTBGN-OAHLLOKOSA-N	0	3	342.393	3.449	20	30		EGEDHN
C[C@H](N[C@@H](CN1CCN(C)CC1)c1ccccc1)c1cccc(C#N)c1	ZINC000539497749	314317242	/nfs/dbraw/zinc/31/72/42/314317242.db2.gz	VFHKMBKZDNXDGN-AVRDEDQJSA-N	0	3	348.494	3.198	20	30		EGEDHN
CC[C@H]1CN(Cc2cccc(OCc3ccccc3C#N)c2)C[C@@H]1O	ZINC000539897039	314349170	/nfs/dbraw/zinc/34/91/70/314349170.db2.gz	VAELLGYFNOZKAK-UWJYYQICSA-N	0	3	336.435	3.340	20	30		EGEDHN
N#Cc1cnn2cc(CNCCCSc3ccc(F)cc3)cnc12	ZINC000550156587	315118228	/nfs/dbraw/zinc/11/82/28/315118228.db2.gz	CVECMPCLKAZFEQ-UHFFFAOYSA-N	0	3	341.415	3.012	20	30		EGEDHN
Cc1nsc(N2CCN(c3ccnc4ccccc43)CC2)c1C#N	ZINC000555139512	315368552	/nfs/dbraw/zinc/36/85/52/315368552.db2.gz	QFOIAWHZMLJGKG-UHFFFAOYSA-N	0	3	335.436	3.198	20	30		EGEDHN
CN(C[C@H]1CCCN1C)C(=O)c1cccc(Nc2ccc(C#N)cc2)c1	ZINC000564816712	316210904	/nfs/dbraw/zinc/21/09/04/316210904.db2.gz	NQLSITCXUVTDTG-HXUWFJFHSA-N	0	3	348.450	3.468	20	30		EGEDHN
COc1ccc(C#N)cc1NC(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000565434745	316324637	/nfs/dbraw/zinc/32/46/37/316324637.db2.gz	XAABFYLOXQQNKU-KRWDZBQOSA-N	0	3	335.407	3.027	20	30		EGEDHN
CCCN(CCN1CCCCCC1)C(=O)Cc1c(F)cccc1C#N	ZINC000571087173	317148606	/nfs/dbraw/zinc/14/86/06/317148606.db2.gz	UMUVOSMPXKFFJN-UHFFFAOYSA-N	0	3	345.462	3.354	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@H]1Nc1c(C#N)nnc2ccccc21	ZINC000389877176	324280976	/nfs/dbraw/zinc/28/09/76/324280976.db2.gz	VJHLABKIDQQKTD-MGPUTAFESA-N	0	3	343.434	3.434	20	30		EGEDHN
CN(Cc1ccc(-c2ccccc2C#N)cc1)[C@@H]1CCC(=O)N(C)C1	ZINC000579369376	325100964	/nfs/dbraw/zinc/10/09/64/325100964.db2.gz	AOEQQRRMAMCIAK-LJQANCHMSA-N	0	3	333.435	3.278	20	30		EGEDHN
N#C[C@H]1CC[C@@H](NCc2cc(Br)c3c(c2)OCCO3)C1	ZINC000349831163	457069107	/nfs/dbraw/zinc/06/91/07/457069107.db2.gz	UYUDXJDPWIQJOM-CMPLNLGQSA-N	0	3	337.217	3.002	20	30		EGEDHN
N#Cc1ccc(NC(=O)N2CC[C@@H](N3CCCCC3)C2)cc1Cl	ZINC000264501150	455225720	/nfs/dbraw/zinc/22/57/20/455225720.db2.gz	RFIKCAQUHOTBTE-OAHLLOKOSA-N	0	3	332.835	3.304	20	30		EGEDHN
C[C@H](CN1CCCCC1)NC(=O)CCCCOc1cccc(C#N)c1	ZINC000264754691	455276210	/nfs/dbraw/zinc/27/62/10/455276210.db2.gz	MSINTZHJXPWNNU-QGZVFWFLSA-N	0	3	343.471	3.098	20	30		EGEDHN
C[C@@H](N[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccc(OCC#N)cc1	ZINC000183317623	455277007	/nfs/dbraw/zinc/27/70/07/455277007.db2.gz	XTVQICWMAHDDGL-ZBFHGGJFSA-N	0	3	345.443	3.249	20	30		EGEDHN
N=C(N)NN=Cc1ccc(OCc2ccc(Cl)c(Cl)c2)cc1	ZINC000002954962	452736848	/nfs/dbraw/zinc/73/68/48/452736848.db2.gz	RFUDSPIIZKGMIK-UHFFFAOYSA-N	0	3	337.210	3.389	20	30		EGEDHN
C[C@@]1(C#N)CCCN(C(=O)c2ccc(CN3CCCCC3)cc2)C1	ZINC000612243485	460575416	/nfs/dbraw/zinc/57/54/16/460575416.db2.gz	UTKGGEJVNYQITB-FQEVSTJZSA-N	0	3	325.456	3.438	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@@H]2C[C@H](O)C2(C)C)cc1OC	ZINC000623496762	460580349	/nfs/dbraw/zinc/58/03/49/460580349.db2.gz	JLXOAFWJMGRSGE-CABCVRRESA-N	0	3	325.836	3.162	20	30		EGEDHN
CN(C(=O)CN1CCC[C@@H]1Cc1ccccc1)C1(C#N)CCCCC1	ZINC000025358816	453767413	/nfs/dbraw/zinc/76/74/13/453767413.db2.gz	INMKKERLUATNBZ-LJQANCHMSA-N	0	3	339.483	3.378	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN(C)Cc1cccc(C#N)c1	ZINC000027207941	453812976	/nfs/dbraw/zinc/81/29/76/453812976.db2.gz	KTQZLIWIWLABIJ-HXUWFJFHSA-N	0	3	336.435	3.158	20	30		EGEDHN
N#Cc1ccccc1NC(=O)CCN1CCC[C@@H](C(F)(F)F)C1	ZINC000028852715	453824912	/nfs/dbraw/zinc/82/49/12/453824912.db2.gz	ZLHPBLFAXPJSHM-CYBMUJFWSA-N	0	3	325.334	3.161	20	30		EGEDHN
COc1ccccc1NC(=O)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC000029903693	453832513	/nfs/dbraw/zinc/83/25/13/453832513.db2.gz	PJNAYPVHYADFJE-UHFFFAOYSA-N	0	3	349.434	3.418	20	30		EGEDHN
CN(C)[C@H](CNC(=O)/C=C/c1ccc(OCC#N)cc1)c1ccccc1	ZINC000031436739	453847483	/nfs/dbraw/zinc/84/74/83/453847483.db2.gz	VHYHVSJNHJQKHG-XEDBTPMOSA-N	0	3	349.434	3.021	20	30		EGEDHN
CC[C@@H](CNC(=O)c1ccc(C#N)cc1)N1CCc2ccccc2C1	ZINC000032445885	453873290	/nfs/dbraw/zinc/87/32/90/453873290.db2.gz	DMGDSGRHSWIIFP-FQEVSTJZSA-N	0	3	333.435	3.125	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)c1ccc(C#N)c(C)n1)c1ccccc1	ZINC000075723167	453922531	/nfs/dbraw/zinc/92/25/31/453922531.db2.gz	ONPQGCYCTOQIMB-LJQANCHMSA-N	0	3	336.439	3.075	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@](C)(NCc1cc(C#N)cs1)C1CC1	ZINC000083456036	453949234	/nfs/dbraw/zinc/94/92/34/453949234.db2.gz	CTHFSUUIJPGMEO-KRWDZBQOSA-N	0	3	335.473	3.403	20	30		EGEDHN
CCS[C@@H]1CC[C@@H](N(C)CC(=O)N(C)C2(C#N)CCCCC2)C1	ZINC000076069636	453957788	/nfs/dbraw/zinc/95/77/88/453957788.db2.gz	YHDUICLCCGPIGX-HZPDHXFCSA-N	0	3	337.533	3.277	20	30		EGEDHN
C[C@@H](CNC(=O)N[C@@H](C)c1ccc(C#N)cc1)N1CCC(C)CC1	ZINC000067706529	453959425	/nfs/dbraw/zinc/95/94/25/453959425.db2.gz	KRBGFNAVJUWHSB-HOTGVXAUSA-N	0	3	328.460	3.039	20	30		EGEDHN
N#CCSCCCN(Cc1ccccc1)C[C@H](O)c1ccco1	ZINC000084134760	453972439	/nfs/dbraw/zinc/97/24/39/453972439.db2.gz	DDMKUWDQSIZEFN-KRWDZBQOSA-N	0	3	330.453	3.462	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)c2cc(C#N)cs2)N(C)C)cc1	ZINC000084179720	453975123	/nfs/dbraw/zinc/97/51/23/453975123.db2.gz	FLBVNDFSCMKMSF-INIZCTEOSA-N	0	3	327.453	3.215	20	30		EGEDHN
CCN(Cc1cc(=O)n2ccccc2n1)[C@@H](C)c1ccc(C#N)cc1	ZINC000042741782	454022944	/nfs/dbraw/zinc/02/29/44/454022944.db2.gz	XWXRWWDQMYFCEB-HNNXBMFYSA-N	0	3	332.407	3.149	20	30		EGEDHN
C[C@@H]1CCCC[C@@H]1NC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000043045883	454037784	/nfs/dbraw/zinc/03/77/84/454037784.db2.gz	XHHISRMLLGNMGO-APWZRJJASA-N	0	3	342.487	3.210	20	30		EGEDHN
N#Cc1cccc(NC(=O)NC2CCN(Cc3ccccc3)CC2)c1	ZINC000043330052	454056255	/nfs/dbraw/zinc/05/62/55/454056255.db2.gz	XZLOMBZKPBWZJT-UHFFFAOYSA-N	0	3	334.423	3.344	20	30		EGEDHN
COc1ccc(C(=O)C(C#N)c2cnc3ccccc3n2)cc1OC	ZINC000190926532	455407681	/nfs/dbraw/zinc/40/76/81/455407681.db2.gz	ATVBIKPNQBSRAY-CYBMUJFWSA-N	0	3	333.347	3.137	20	30		EGEDHN
COc1ccc(CN(C)CCOc2ccc(C#N)cc2OC)cc1C	ZINC000077281159	454085179	/nfs/dbraw/zinc/08/51/79/454085179.db2.gz	RHNUWMTZYPYWIU-UHFFFAOYSA-N	0	3	340.423	3.395	20	30		EGEDHN
COCCOc1ccc(C([O-])=C(C#N)c2cnc3ccccc3n2)cc1	ZINC000190889377	455398228	/nfs/dbraw/zinc/39/82/28/455398228.db2.gz	DDFYPHNDMOENEM-MRXNPFEDSA-N	0	3	347.374	3.145	20	30		EGEDHN
COCCOc1ccc(C(=O)C(C#N)c2cnc3ccccc3n2)cc1	ZINC000190889377	455398233	/nfs/dbraw/zinc/39/82/33/455398233.db2.gz	DDFYPHNDMOENEM-MRXNPFEDSA-N	0	3	347.374	3.145	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cccc(N(C)C(C)C)c2)CC1	ZINC000069371979	454100218	/nfs/dbraw/zinc/10/02/18/454100218.db2.gz	GBABZQMNOKSDDU-UHFFFAOYSA-N	0	3	330.476	3.303	20	30		EGEDHN
CN(C)Cc1cccc(CNC(=O)Nc2ccc(F)c(C#N)c2)c1	ZINC000077500297	454113665	/nfs/dbraw/zinc/11/36/65/454113665.db2.gz	DYVDCCJBTXHVAP-UHFFFAOYSA-N	0	3	326.375	3.081	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc(C(C)=O)c(C)c2)CC1	ZINC000089452991	454151449	/nfs/dbraw/zinc/15/14/49/454151449.db2.gz	MVAHZHYGKFSNKW-UHFFFAOYSA-N	0	3	329.444	3.360	20	30		EGEDHN
C#CCN1CCC(C(=O)NCc2cc(C)cc3c(C)c(C)[nH]c32)CC1	ZINC000058330143	454187530	/nfs/dbraw/zinc/18/75/30/454187530.db2.gz	FPROWLCCXPFIAG-UHFFFAOYSA-N	0	3	337.467	3.055	20	30		EGEDHN
Cc1nc(COc2ccc(CN(C)Cc3cccc(C#N)c3)cc2)no1	ZINC000130782411	454217527	/nfs/dbraw/zinc/21/75/27/454217527.db2.gz	AGFWNCXKIAUDTR-UHFFFAOYSA-N	0	3	348.406	3.461	20	30		EGEDHN
C#CCCCCC(=O)Nc1ccc(CCN2CCSCC2)cc1	ZINC000119759099	454218221	/nfs/dbraw/zinc/21/82/21/454218221.db2.gz	YNMZBMPPHUGHMA-UHFFFAOYSA-N	0	3	330.497	3.410	20	30		EGEDHN
C=CCc1ccc(OC[C@H](O)CN(C)Cc2cccs2)c(OC)c1	ZINC000046344157	454242871	/nfs/dbraw/zinc/24/28/71/454242871.db2.gz	HJNGQLGNQDQRSV-MRXNPFEDSA-N	0	3	347.480	3.357	20	30		EGEDHN
CC[C@H](c1ccccc1)[C@H]1CCCN1CC(=O)N[C@@](C)(C#N)C1CC1	ZINC000120092585	454257351	/nfs/dbraw/zinc/25/73/51/454257351.db2.gz	DECMFDLUVBZDCK-SBHAEUEKSA-N	0	3	339.483	3.453	20	30		EGEDHN
CCN(CC)C(=O)C[C@H](C)NCC#Cc1ccc(C(F)(F)F)cc1	ZINC000090180553	454290709	/nfs/dbraw/zinc/29/07/09/454290709.db2.gz	OWRPEXVTYLFIOH-AWEZNQCLSA-N	0	3	340.389	3.294	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)NCCC(C)(C)C	ZINC000047063476	454326267	/nfs/dbraw/zinc/32/62/67/454326267.db2.gz	MFLXVGQGKYIEAR-UHFFFAOYSA-N	0	3	330.476	3.068	20	30		EGEDHN
C#CCOc1ccc([C@@H](C)NCc2c(CC)nn(C)c2CC)cc1	ZINC000090846432	454345361	/nfs/dbraw/zinc/34/53/61/454345361.db2.gz	JTOLKBKCFQVKBV-OAHLLOKOSA-N	0	3	325.456	3.408	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CN(Cc2ccc(F)cc2)C2CC2)cc1	ZINC000061740878	454355054	/nfs/dbraw/zinc/35/50/54/454355054.db2.gz	CWFSLRLPPYVDMY-IBGZPJMESA-N	0	3	340.398	3.102	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)Nc2nnc(-c3ccccc3)s2)n1	ZINC000121705951	454467231	/nfs/dbraw/zinc/46/72/31/454467231.db2.gz	JVYSEUZCZKMJTL-LLVKDONJSA-N	0	3	341.421	3.216	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CCCN(CCCc2ccccc2)CC1	ZINC000101531513	454472814	/nfs/dbraw/zinc/47/28/14/454472814.db2.gz	ZJHWXMYJMPBBGV-IBGZPJMESA-N	0	3	344.499	3.135	20	30		EGEDHN
CN(Cc1cn(CCC#N)nc1-c1ccccc1)C[C@@H]1CCC[C@@H]1O	ZINC000091898833	454487540	/nfs/dbraw/zinc/48/75/40/454487540.db2.gz	XXTUKINBFPHLIS-HKUYNNGSSA-N	0	3	338.455	3.057	20	30		EGEDHN
CCCN(CC(=O)N(CC)C[C@H](C)C#N)[C@@H]1CCc2ccccc2C1	ZINC000064632755	454496479	/nfs/dbraw/zinc/49/64/79/454496479.db2.gz	FGJRGJPXVDVZHT-YLJYHZDGSA-N	0	3	341.499	3.264	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2CNCc2cccc(C#N)c2)C[C@H](C)O1	ZINC000048816755	454517899	/nfs/dbraw/zinc/51/78/99/454517899.db2.gz	QSLBYWONKSGKLV-HDICACEKSA-N	0	3	349.478	3.457	20	30		EGEDHN
Cc1ccccc1CCC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000103380320	454552169	/nfs/dbraw/zinc/55/21/69/454552169.db2.gz	PAXXUEINEMTEPI-UHFFFAOYSA-N	0	3	349.478	3.390	20	30		EGEDHN
C#CCNC(=O)[C@@H](C)N[C@@H](Cc1ccccc1)c1sccc1C	ZINC000122767155	454566916	/nfs/dbraw/zinc/56/69/16/454566916.db2.gz	KKGZHEBELTULGO-WBVHZDCISA-N	0	3	326.465	3.068	20	30		EGEDHN
Cc1nn(-c2ccc(C#N)cc2)c(NC(=O)C(C)C(F)(F)F)c1C	ZINC000080421840	454578480	/nfs/dbraw/zinc/57/84/80/454578480.db2.gz	ZYKHWEMOMWMEQP-SNVBAGLBSA-N	0	3	336.317	3.498	20	30		EGEDHN
CC(C)N1CCN(c2ccc(C(=O)Nc3ccc(C#N)cc3)cc2)CC1	ZINC000065727799	454615288	/nfs/dbraw/zinc/61/52/88/454615288.db2.gz	NSJBIQISPZWTGI-UHFFFAOYSA-N	0	3	348.450	3.341	20	30		EGEDHN
CC(C)C(=O)NC[C@@H]1CCCN(Cc2ccccc2C(C)(C)C#N)C1	ZINC000135174965	454642610	/nfs/dbraw/zinc/64/26/10/454642610.db2.gz	MZGIPGUAVDPOKV-KRWDZBQOSA-N	0	3	341.499	3.472	20	30		EGEDHN
C[C@@H](NC(=O)N1CCC[C@H]1CN1CCCCC1)c1cccc(C#N)c1	ZINC000074917438	454658705	/nfs/dbraw/zinc/65/87/05/454658705.db2.gz	BSVPMBKSPYUBFI-APWZRJJASA-N	0	3	340.471	3.279	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2sccc2OC(F)F)CC1	ZINC000106035063	454674654	/nfs/dbraw/zinc/67/46/54/454674654.db2.gz	RYVXSVCXZJXOQU-UHFFFAOYSA-N	0	3	330.400	3.120	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)COc2ccc3ccccc3c2)CC1	ZINC000106040061	454675605	/nfs/dbraw/zinc/67/56/05/454675605.db2.gz	DTIGYHTZQWNZIJ-UHFFFAOYSA-N	0	3	338.451	3.375	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](C)Cc2ccccc2F)CC1	ZINC000106265599	454689013	/nfs/dbraw/zinc/68/90/13/454689013.db2.gz	RDEBIVUZXPZUMP-OAHLLOKOSA-N	0	3	333.451	3.096	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cc(F)c(F)cc2F)CC1	ZINC000106326155	454691302	/nfs/dbraw/zinc/69/13/02/454691302.db2.gz	AFZGYMNOTKFHSS-UHFFFAOYSA-N	0	3	327.350	3.266	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC23CC4CC(CC(C4)C2)C3)CC1	ZINC000106327402	454691479	/nfs/dbraw/zinc/69/14/79/454691479.db2.gz	DFTRLHJQBGGJLT-UHFFFAOYSA-N	0	3	331.504	3.295	20	30		EGEDHN
C=CCOc1cccc(CN2CCC[C@H](CNC(=O)C(C)C)C2)c1	ZINC000124127854	454701183	/nfs/dbraw/zinc/70/11/83/454701183.db2.gz	BTNMTSOVCPMXRN-GOSISDBHSA-N	0	3	330.472	3.236	20	30		EGEDHN
CC[C@@]1(NCC(=O)Nc2ccccc2SC[C@H](C)C#N)CCOC1	ZINC000616866131	460649097	/nfs/dbraw/zinc/64/90/97/460649097.db2.gz	QGBCZNPWCACOBG-RDTXWAMCSA-N	0	3	347.484	3.036	20	30		EGEDHN
C=C(C)COc1cc(CN[C@@H](CO)Cc2ccccc2)ccc1OC	ZINC000152719545	454717241	/nfs/dbraw/zinc/71/72/41/454717241.db2.gz	PAGCSAYDITUKFD-LJQANCHMSA-N	0	3	341.451	3.343	20	30		EGEDHN
C[C@@H](NC(=O)N(CCN(C)C)C1CCCC1)c1ccc(C#N)cc1	ZINC000152794609	454727024	/nfs/dbraw/zinc/72/70/24/454727024.db2.gz	NBRVUNILTMRPCA-OAHLLOKOSA-N	0	3	328.460	3.135	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H]2C[C@@H](OCC)C23CCCC3)CC1	ZINC000176500287	454752417	/nfs/dbraw/zinc/75/24/17/454752417.db2.gz	LKYANDLSVSJKMA-ZWKOTPCHSA-N	0	3	349.519	3.064	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1CCS[C@@H]2CCCC[C@@H]21	ZINC000177184634	454833696	/nfs/dbraw/zinc/83/36/96/454833696.db2.gz	CKAKUFMGANSKRU-MAUKXSAKSA-N	0	3	332.469	3.306	20	30		EGEDHN
C=C(C)CN(CC)[C@@H](C)C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000125951116	454858497	/nfs/dbraw/zinc/85/84/97/454858497.db2.gz	AOCMJICWUXDIAH-SFHVURJKSA-N	0	3	343.515	3.054	20	30		EGEDHN
CN(C(=O)c1ccc(C#N)cc1)C1CCN(Cc2ccccc2)CC1	ZINC000113093227	454913443	/nfs/dbraw/zinc/91/34/43/454913443.db2.gz	WIHIXRZHCXGPML-UHFFFAOYSA-N	0	3	333.435	3.295	20	30		EGEDHN
N#Cc1c(Br)cccc1N1CC[C@@H](N2CCCCC2)C1	ZINC000168537601	454926817	/nfs/dbraw/zinc/92/68/17/454926817.db2.gz	MIZAMSSWQPXKLT-CYBMUJFWSA-N	0	3	334.261	3.385	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(OC)cc2OC(C)C)CC1	ZINC000191547227	455495972	/nfs/dbraw/zinc/49/59/72/455495972.db2.gz	TZAXVBPLRCMNCR-UHFFFAOYSA-N	0	3	346.471	3.253	20	30		EGEDHN
C=C(C)CN(CC)CC(=O)Nc1cccc(CN2CCSCC2)c1	ZINC000114712432	454971395	/nfs/dbraw/zinc/97/13/95/454971395.db2.gz	WLXBSOGXOOOCBJ-UHFFFAOYSA-N	0	3	347.528	3.072	20	30		EGEDHN
COc1cc(Br)c(CNCCCCC#N)c(OC)c1	ZINC000178856532	454985565	/nfs/dbraw/zinc/98/55/65/454985565.db2.gz	MMXUWLCMPQWKMD-UHFFFAOYSA-N	0	3	327.222	3.250	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)c2c(F)cc(C#N)cc2F)N(C)C)cc1	ZINC000128542587	455065747	/nfs/dbraw/zinc/06/57/47/455065747.db2.gz	NCJDOXAFLLHAHX-KRWDZBQOSA-N	0	3	343.377	3.178	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(c3nccc4occc43)CC2)cc1	ZINC000156736376	455147382	/nfs/dbraw/zinc/14/73/82/455147382.db2.gz	JXWBFDYDFXONPN-UHFFFAOYSA-N	0	3	332.407	3.412	20	30		EGEDHN
C=C(C)CN(C)C(=O)NC[C@H](c1cccc(OC)c1)N(CC)CC	ZINC000180405422	455164815	/nfs/dbraw/zinc/16/48/15/455164815.db2.gz	GDIVTLLULMVRNL-GOSISDBHSA-N	0	3	333.476	3.296	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC=C(CNCc2ccc(C#N)cc2)CC1	ZINC000189478629	455203380	/nfs/dbraw/zinc/20/33/80/455203380.db2.gz	RXGSHWUJMTWXMD-UHFFFAOYSA-N	0	3	327.428	3.215	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)CC1	ZINC000264393133	455204799	/nfs/dbraw/zinc/20/47/99/455204799.db2.gz	NKYUZUTWMQYTPG-UHFFFAOYSA-N	0	3	332.404	3.065	20	30		EGEDHN
N#Cc1cc(NC[C@H](c2ccco2)N2CCCC2)ccc1[N+](=O)[O-]	ZINC000157535892	455205007	/nfs/dbraw/zinc/20/50/07/455205007.db2.gz	BOBRPDCEEAUQHB-MRXNPFEDSA-N	0	3	326.356	3.308	20	30		EGEDHN
C=CCN1CCC(NC(=O)C2(c3ccc(OC)cc3)CCCC2)CC1	ZINC000264449562	455215400	/nfs/dbraw/zinc/21/54/00/455215400.db2.gz	CONXEBUOLMSWGU-UHFFFAOYSA-N	0	3	342.483	3.274	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2ccc(Cl)c(C)c2)CC1	ZINC000183344814	455279587	/nfs/dbraw/zinc/27/95/87/455279587.db2.gz	QOGCMEWMHJSMOX-UHFFFAOYSA-N	0	3	335.879	3.488	20	30		EGEDHN
COc1cccc(/C=N/C2CCN([C@@H](C)c3ccncc3)CC2)c1O	ZINC000158274330	455286953	/nfs/dbraw/zinc/28/69/53/455286953.db2.gz	RLCIZVMRSFNBPK-WXUSHSQQSA-N	0	3	339.439	3.440	20	30		EGEDHN
COCCN(CCc1nc2ccccc2n1C)Cc1ccc(C#N)cc1	ZINC000265549684	455341666	/nfs/dbraw/zinc/34/16/66/455341666.db2.gz	YIUCCIPIZQDFKB-UHFFFAOYSA-N	0	3	348.450	3.136	20	30		EGEDHN
CC(C)(CCC#N)CNCCS(=O)(=O)c1ccc(Cl)cc1	ZINC000174312734	455378297	/nfs/dbraw/zinc/37/82/97/455378297.db2.gz	HOUGSYCBYNTIKN-UHFFFAOYSA-N	0	3	328.865	3.033	20	30		EGEDHN
C=CCN(Cc1ccccc1)C[C@H](O)COc1ccccc1[N+](=O)[O-]	ZINC000182207283	455460766	/nfs/dbraw/zinc/46/07/66/455460766.db2.gz	AYKLUDFPTXDOQC-KRWDZBQOSA-N	0	3	342.395	3.023	20	30		EGEDHN
CCOc1cccc2cc([C@@H](C)NCCC(=O)N(C)CCC#N)oc21	ZINC000182659161	455561770	/nfs/dbraw/zinc/56/17/70/455561770.db2.gz	GXCWBWXJJQMYCZ-CQSZACIVSA-N	0	3	343.427	3.244	20	30		EGEDHN
CN(CC#Cc1ccc(OC(F)(F)F)cc1)C[C@H]1CCC[C@H]1O	ZINC000247191813	455571418	/nfs/dbraw/zinc/57/14/18/455571418.db2.gz	YINARAFSTUNFJK-GDBMZVCRSA-N	0	3	327.346	3.030	20	30		EGEDHN
C[C@H](NCC(=O)N(CCC#N)c1ccccc1)[C@@H]1COc2ccccc21	ZINC000185600944	455583450	/nfs/dbraw/zinc/58/34/50/455583450.db2.gz	SOJZITFZHARKGB-LPHOPBHVSA-N	0	3	349.434	3.088	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1sccc1CN(C)C)C(C)C	ZINC000268202406	455617834	/nfs/dbraw/zinc/61/78/34/455617834.db2.gz	YYRUVQXIABWAAW-KRWDZBQOSA-N	0	3	349.544	3.238	20	30		EGEDHN
Cc1cc(C#N)ccc1CN(C)Cc1ccccc1N1CCOCC1	ZINC000186163085	455708120	/nfs/dbraw/zinc/70/81/20/455708120.db2.gz	MLPOGQCGAQBDGN-UHFFFAOYSA-N	0	3	335.451	3.335	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC[C@H](c3ccc(CC)cc3)C2)CC1	ZINC000292604695	455710097	/nfs/dbraw/zinc/71/00/97/455710097.db2.gz	HOXKOLDXDFEUON-IBGZPJMESA-N	0	3	341.499	3.398	20	30		EGEDHN
Cc1ccc[n+](C(C(=O)c2ccccc2)C(=S)[N-]C2(C)CC2)c1	ZINC000284594169	455711322	/nfs/dbraw/zinc/71/13/22/455711322.db2.gz	YEPIXKRTUUVOAF-UHFFFAOYSA-O	0	3	325.457	3.363	20	30		EGEDHN
N#C[C@@H]1CCC[C@H](N[C@H]2CCN(c3ccc(F)c(Cl)c3)C2=O)C1	ZINC000248927119	455739333	/nfs/dbraw/zinc/73/93/33/455739333.db2.gz	XIFJLEHDFIBMFW-WQGACYEGSA-N	0	3	335.810	3.256	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)c2cccc(F)c2C#N)CN1Cc1ccccc1	ZINC000186316971	455741711	/nfs/dbraw/zinc/74/17/11/455741711.db2.gz	HJVKAVDJWLEMCJ-HOCLYGCPSA-N	0	3	337.398	3.090	20	30		EGEDHN
N#C[C@H]1CCC[C@@H](N[C@@H]2CCCN(Cc3ccc(F)cc3F)C2=O)C1	ZINC000193343601	455753711	/nfs/dbraw/zinc/75/37/11/455753711.db2.gz	KPYVOGGMXRAVQD-FDQGKXFDSA-N	0	3	347.409	3.128	20	30		EGEDHN
C[C@@H]1CCNC(=O)[C@H]1NCCC(C#N)(c1ccccc1)c1ccccc1	ZINC000193662665	455769411	/nfs/dbraw/zinc/76/94/11/455769411.db2.gz	LAVVTYMFQHXOAL-XLIONFOSSA-N	0	3	347.462	3.001	20	30		EGEDHN
COc1cc(C)c(CN(C)CCOc2ccccc2C#N)cc1OC	ZINC000193737871	455774144	/nfs/dbraw/zinc/77/41/44/455774144.db2.gz	NXJBONOXKJGQPL-UHFFFAOYSA-N	0	3	340.423	3.395	20	30		EGEDHN
CN(c1ccc(NC(=O)CC(C)(C)C#N)cc1)C1CCN(C)CC1	ZINC000278224567	455790926	/nfs/dbraw/zinc/79/09/26/455790926.db2.gz	IWHAVCGARIYXJX-UHFFFAOYSA-N	0	3	328.460	3.095	20	30		EGEDHN
Cc1c(C(=O)C(C#N)c2nc3ccccc3n2C)cnn1C(C)(C)C	ZINC000194085258	455800537	/nfs/dbraw/zinc/80/05/37/455800537.db2.gz	NJGVIAVVWLEODP-CYBMUJFWSA-N	0	3	335.411	3.323	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Cc2cccc(OC/C=C/C)c2)CC1	ZINC000294729272	455824582	/nfs/dbraw/zinc/82/45/82/455824582.db2.gz	VRVGEKDHVHUTSO-SNAWJCMRSA-N	0	3	342.483	3.341	20	30		EGEDHN
CN(C)[C@H](CNc1nccc(C#N)n1)c1cccc(C(F)(F)F)c1	ZINC000294844830	455829357	/nfs/dbraw/zinc/82/93/57/455829357.db2.gz	BTMBQRWEWHYAMU-CQSZACIVSA-N	0	3	335.333	3.082	20	30		EGEDHN
CC(C)CCOC1CCN(CCC(=O)Nc2cccc(C#N)c2)CC1	ZINC000194339929	455830075	/nfs/dbraw/zinc/83/00/75/455830075.db2.gz	AVJPQXSHINQTHH-UHFFFAOYSA-N	0	3	343.471	3.414	20	30		EGEDHN
CS(=O)(=O)CC1CCC(N[C@H](CCC#N)c2ccccc2)CC1	ZINC000294836171	455830258	/nfs/dbraw/zinc/83/02/58/455830258.db2.gz	RLQOSCNJSOISDN-VMWRSERWSA-N	0	3	334.485	3.224	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2CN[C@@H]2CCC[C@@H](C#N)C2)C[C@@H](C)O1	ZINC000253354793	455834257	/nfs/dbraw/zinc/83/42/57/455834257.db2.gz	MOQMQPGIXYAQMU-NEYJZJCJSA-N	0	3	341.499	3.468	20	30		EGEDHN
C=C1CCN(C(=O)[C@@H]2CN(Cc3ccccc3)CCC2(F)F)CC1	ZINC000285408113	455838270	/nfs/dbraw/zinc/83/82/70/455838270.db2.gz	PFIYQGRQRAQZDV-KRWDZBQOSA-N	0	3	334.410	3.322	20	30		EGEDHN
C=CCOc1ccc(CNC[C@H](O)Cc2cccc(F)c2)cc1OC	ZINC000295113514	455838516	/nfs/dbraw/zinc/83/85/16/455838516.db2.gz	LYUZFVQQNQNNIM-GOSISDBHSA-N	0	3	345.414	3.092	20	30		EGEDHN
COc1ccc(CN2CC[C@H](O)CC(C)(C)C2)cc1OCCCC#N	ZINC000295209712	455841828	/nfs/dbraw/zinc/84/18/28/455841828.db2.gz	LJMCVKYMLVVIRP-KRWDZBQOSA-N	0	3	346.471	3.361	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N2CCCCCCC2)cc1	ZINC000278651076	455843195	/nfs/dbraw/zinc/84/31/95/455843195.db2.gz	PUGZFGCUTFFZIK-AWEZNQCLSA-N	0	3	349.456	3.170	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2c(C)cc(C)cc2Br)CC1	ZINC000269364199	455844082	/nfs/dbraw/zinc/84/40/82/455844082.db2.gz	LQOWUAPJKPHEQN-UHFFFAOYSA-N	0	3	349.272	3.350	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCc3c(C)cc(C)cc3C2)CC1	ZINC000186870101	455845959	/nfs/dbraw/zinc/84/59/59/455845959.db2.gz	OGTSRFIBEWHFQL-UHFFFAOYSA-N	0	3	341.499	3.412	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN[C@H](CC)c1ccc(OC)c(OC)c1	ZINC000285452979	455849199	/nfs/dbraw/zinc/84/91/99/455849199.db2.gz	MIPUVLOPTMCPGY-MRXNPFEDSA-N	0	3	334.460	3.169	20	30		EGEDHN
CC[C@H](NCCNC(=O)c1ccc(OC)cc1)c1ccc(C#N)cc1	ZINC000278900838	455852345	/nfs/dbraw/zinc/85/23/45/455852345.db2.gz	ZJBWQZKQDMJIOC-IBGZPJMESA-N	0	3	337.423	3.038	20	30		EGEDHN
C=CCc1ccc(OC[C@H](O)CN2CCCC3(CC3)C2)c(OC)c1	ZINC000186961814	455857180	/nfs/dbraw/zinc/85/71/80/455857180.db2.gz	SVFNQOQDXXHCOV-QGZVFWFLSA-N	0	3	331.456	3.039	20	30		EGEDHN
CC(C)(CNC(=O)C(C#N)Cc1ccc(C#N)cc1)c1ccccc1F	ZINC000279364997	455863482	/nfs/dbraw/zinc/86/34/82/455863482.db2.gz	RIFWEINVTIOHEK-QGZVFWFLSA-N	0	3	349.409	3.474	20	30		EGEDHN
C[C@](C#N)(NC(=O)CN1C[C@H](c2ccccc2)[C@H]2CCC[C@@H]21)C1CC1	ZINC000285556028	455868848	/nfs/dbraw/zinc/86/88/48/455868848.db2.gz	VASZZBPICGREMP-WERVVEIQSA-N	0	3	337.467	3.063	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)CCc1ccccc1N)C(C)C	ZINC000279815211	455873767	/nfs/dbraw/zinc/87/37/67/455873767.db2.gz	LLVVAXKCNUEEON-LJQANCHMSA-N	0	3	329.488	3.016	20	30		EGEDHN
C[C@@H](NCCOc1ccc(C#N)cc1)c1ccc(Br)cn1	ZINC000280018583	455880091	/nfs/dbraw/zinc/88/00/91/455880091.db2.gz	HFYOMKRJWPVWSU-GFCCVEGCSA-N	0	3	346.228	3.445	20	30		EGEDHN
C[C@H](NC(=O)c1ccccc1OCC#N)[C@@H](c1ccccc1)N(C)C	ZINC000187214291	455882658	/nfs/dbraw/zinc/88/26/58/455882658.db2.gz	FSSVGZZDJXBHMS-KXBFYZLASA-N	0	3	337.423	3.010	20	30		EGEDHN
C[C@H](NC(=O)c1ccccc1OCC#N)[C@H](c1ccccc1)N(C)C	ZINC000187214329	455882678	/nfs/dbraw/zinc/88/26/78/455882678.db2.gz	FSSVGZZDJXBHMS-HNAYVOBHSA-N	0	3	337.423	3.010	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N(Cc1ccccc1)C1CCN(C)CC1)OCC	ZINC000270149263	455888682	/nfs/dbraw/zinc/88/86/82/455888682.db2.gz	HKBDSNCJQRHTGB-HXUWFJFHSA-N	0	3	344.499	3.481	20	30		EGEDHN
CCOC[C@@H](N[C@H](C)C(=O)N(CCC#N)c1ccc(C)cc1)C(C)C	ZINC000285703629	455900891	/nfs/dbraw/zinc/90/08/91/455900891.db2.gz	CVQDZCPOEACMHE-IEBWSBKVSA-N	0	3	345.487	3.281	20	30		EGEDHN
CN(Cc1ccccc1)[C@H](CNC(=O)c1cccc(CC#N)c1)C1CC1	ZINC000187460677	455912902	/nfs/dbraw/zinc/91/29/02/455912902.db2.gz	SDEDDWUIIPTNDL-OAQYLSRUSA-N	0	3	347.462	3.393	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)c2ccc(CC#N)cc2)CN1Cc1ccccc1	ZINC000270382680	455943196	/nfs/dbraw/zinc/94/31/96/455943196.db2.gz	QCQNQCAIZNGZGV-JXFKEZNVSA-N	0	3	333.435	3.145	20	30		EGEDHN
C[C@@H](CCc1ccco1)N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000272534762	455985835	/nfs/dbraw/zinc/98/58/35/455985835.db2.gz	JUJHXBIRBCDNOC-KXBFYZLASA-N	0	3	337.423	3.258	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1CNCc1cc(OC)ccc1OC(F)F	ZINC000280666813	456026592	/nfs/dbraw/zinc/02/65/92/456026592.db2.gz	PLXMWLXKLOMIBQ-WBMJQRKESA-N	0	3	327.371	3.367	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)NCC2CCCCC2)cc1	ZINC000286972224	456058269	/nfs/dbraw/zinc/05/82/69/456058269.db2.gz	BKYGGDCUSBZJRO-ZDUSSCGKSA-N	0	3	349.456	3.074	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N2CCCC(C)(C)C2)cc1	ZINC000286998358	456058638	/nfs/dbraw/zinc/05/86/38/456058638.db2.gz	CXZSGRBKQGOTDH-ZDUSSCGKSA-N	0	3	349.456	3.026	20	30		EGEDHN
N#Cc1cccc(COc2cccc(CN3CCC(CO)CC3)c2)c1	ZINC000271050358	456112298	/nfs/dbraw/zinc/11/22/98/456112298.db2.gz	VRKBCRWAPKSMIS-UHFFFAOYSA-N	0	3	336.435	3.342	20	30		EGEDHN
CCN1CCN([C@H](C)CNc2ccc(C#N)cc2C(F)(F)F)CC1	ZINC000301508891	456132611	/nfs/dbraw/zinc/13/26/11/456132611.db2.gz	HTNCRAHJRWBPNX-CYBMUJFWSA-N	0	3	340.393	3.015	20	30		EGEDHN
C[C@@H]1CN(C(=O)N[C@H](CCC#N)c2ccccc2)CCN(C2CC2)C1	ZINC000297176530	456141408	/nfs/dbraw/zinc/14/14/08/456141408.db2.gz	FJAVXGKTZXCYGG-QFBILLFUSA-N	0	3	340.471	3.157	20	30		EGEDHN
Cc1ncsc1CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000271208018	456173393	/nfs/dbraw/zinc/17/33/93/456173393.db2.gz	ZGTPFQKSDHBPIF-UHFFFAOYSA-N	0	3	340.452	3.174	20	30		EGEDHN
CN(C)[C@@H](CNc1nccc(C#N)c1[N+](=O)[O-])c1ccc(Cl)cc1	ZINC000301658821	456177210	/nfs/dbraw/zinc/17/72/10/456177210.db2.gz	LZIZCLIPOSMZBQ-AWEZNQCLSA-N	0	3	345.790	3.230	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CCCN1c1cc(C#N)nc(C2CC2)n1	ZINC000601121426	460718338	/nfs/dbraw/zinc/71/83/38/460718338.db2.gz	OMYAUAMAVLJVGA-INIZCTEOSA-N	0	3	347.466	3.326	20	30		EGEDHN
C=CCC[C@H](CCC)NCCS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000273386432	456227639	/nfs/dbraw/zinc/22/76/39/456227639.db2.gz	CWENXLZJCAOTME-AWEZNQCLSA-N	0	3	340.445	3.093	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)c1csc(Cl)c1	ZINC000189105754	456228215	/nfs/dbraw/zinc/22/82/15/456228215.db2.gz	CZTYKCIZHHBMEI-UHFFFAOYSA-N	0	3	347.871	3.477	20	30		EGEDHN
C=CCc1cc(C(=O)Nc2ccccc2CNC)cc(OC)c1OC	ZINC000237166795	456241784	/nfs/dbraw/zinc/24/17/84/456241784.db2.gz	BQFZPHQECFJVDK-UHFFFAOYSA-N	0	3	340.423	3.404	20	30		EGEDHN
C=CCCO[C@@H](C)c1nc(-c2cccc(OCCN(C)C)c2)no1	ZINC000273747258	456245259	/nfs/dbraw/zinc/24/52/59/456245259.db2.gz	BVXZERJSZUZCEV-AWEZNQCLSA-N	0	3	331.416	3.331	20	30		EGEDHN
CCOC(=O)N1CCC(N[C@H](CCC#N)c2ccc(OC)cc2)CC1	ZINC000274221807	456252312	/nfs/dbraw/zinc/25/23/12/456252312.db2.gz	QMEDZEVHXZXCPT-GOSISDBHSA-N	0	3	345.443	3.251	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(CC#N)cc1	ZINC000274190718	456252890	/nfs/dbraw/zinc/25/28/90/456252890.db2.gz	MDDUVJXIRITEDN-UZLBHIALSA-N	0	3	333.435	3.003	20	30		EGEDHN
C=CCc1cc(C(=O)N[C@@H]2CCCN(C(C)C)C2)cc(OC)c1OC	ZINC000274412329	456257401	/nfs/dbraw/zinc/25/74/01/456257401.db2.gz	CDTHCVHYFKSKBW-QGZVFWFLSA-N	0	3	346.471	3.035	20	30		EGEDHN
N#CC1(CNC(=O)NCCN2CCC3(CCCCC3)CC2)CCC1	ZINC000333922818	456274597	/nfs/dbraw/zinc/27/45/97/456274597.db2.gz	RUHMAZZLUORWBT-UHFFFAOYSA-N	0	3	332.492	3.026	20	30		EGEDHN
CN1CCC(N(Cc2ccco2)Cc2ccc(C#N)cc2F)CC1	ZINC000290350805	456301822	/nfs/dbraw/zinc/30/18/22/456301822.db2.gz	GBUWXZYMUBWZTI-UHFFFAOYSA-N	0	3	327.403	3.387	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN1[C@H](C)CN(CC)C[C@@H]1C	ZINC000347690182	456307772	/nfs/dbraw/zinc/30/77/72/456307772.db2.gz	MSPAUKWUYPHBDO-IYBDPMFKSA-N	0	3	347.528	3.318	20	30		EGEDHN
CC(C)c1csc(CNC(=O)C(C#N)Cc2ccc(C#N)cc2)n1	ZINC000281760770	456312235	/nfs/dbraw/zinc/31/22/35/456312235.db2.gz	YVIDPSZEFHQVKA-HNNXBMFYSA-N	0	3	338.436	3.137	20	30		EGEDHN
N#CC1(CCCN2CCN(c3ccc(F)cc3)CC2)CCOCC1	ZINC000337142718	456330405	/nfs/dbraw/zinc/33/04/05/456330405.db2.gz	XMSQHNBJAMCIAU-UHFFFAOYSA-N	0	3	331.435	3.048	20	30		EGEDHN
C[C@H](C#N)CSc1ccccc1NC(=O)CN[C@@H]1CSC[C@H]1C	ZINC000352817791	456332879	/nfs/dbraw/zinc/33/28/79/456332879.db2.gz	RSIMHWHDXNBWQD-UMVBOHGHSA-N	0	3	349.525	3.218	20	30		EGEDHN
CCC[C@H](NCCCC1(C#N)CCOCC1)c1nnc2ccccn21	ZINC000337205857	456338376	/nfs/dbraw/zinc/33/83/76/456338376.db2.gz	LJFRHPYEQXJWHQ-INIZCTEOSA-N	0	3	341.459	3.261	20	30		EGEDHN
N#CCCN(Cc1ccncc1)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000298092987	456363156	/nfs/dbraw/zinc/36/31/56/456363156.db2.gz	IHNMLXZUXLHEGC-NRFANRHFSA-N	0	3	334.467	3.462	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000290623136	456386553	/nfs/dbraw/zinc/38/65/53/456386553.db2.gz	SGQFZVAMLLMVOW-LPHOPBHVSA-N	0	3	348.487	3.174	20	30		EGEDHN
C[C@@H](O)C[C@H]1CCCCCN1Cc1nnc(-c2cccc(C#N)c2)o1	ZINC000352885297	456390721	/nfs/dbraw/zinc/39/07/21/456390721.db2.gz	DBEWLFLORHIIHA-RHSMWYFYSA-N	0	3	340.427	3.124	20	30		EGEDHN
CC(C)Cc1ccc([C@H](CNC(=O)NCCCCC#N)N(C)C)cc1	ZINC000352898144	456398882	/nfs/dbraw/zinc/39/88/82/456398882.db2.gz	FDFZWWCLYCBZQD-IBGZPJMESA-N	0	3	344.503	3.481	20	30		EGEDHN
C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)NC[C@@H](C)N(C)C1CC1	ZINC000352897571	456399039	/nfs/dbraw/zinc/39/90/39/456399039.db2.gz	BQIJUXRGFTUTTR-MRXNPFEDSA-N	0	3	347.507	3.034	20	30		EGEDHN
C=CCOCCCN(C)[C@@H]1c2cc(Cl)cc(Cl)c2C[C@@H]1O	ZINC000347962012	456431700	/nfs/dbraw/zinc/43/17/00/456431700.db2.gz	HMSSUGZDQUJAOG-JKSUJKDBSA-N	0	3	330.255	3.476	20	30		EGEDHN
C#CC(C)(C)N(C)CCC(=O)Nc1c(C)nn(-c2ccccc2)c1C	ZINC000298494927	456473184	/nfs/dbraw/zinc/47/31/84/456473184.db2.gz	JTTBJFMQDMDGPF-UHFFFAOYSA-N	0	3	338.455	3.161	20	30		EGEDHN
CC(C)(C#N)c1ccc(NC(=O)NCCN2CCCCCC2)cc1	ZINC000298528497	456482258	/nfs/dbraw/zinc/48/22/58/456482258.db2.gz	YPJKOKNPSRGVEG-UHFFFAOYSA-N	0	3	328.460	3.485	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@@H](C)[C@H]1CCCOC1	ZINC000348142351	456512109	/nfs/dbraw/zinc/51/21/09/456512109.db2.gz	NEOFIMLHLQFTNT-GJZGRUSLSA-N	0	3	334.485	3.308	20	30		EGEDHN
C=CCOCCCN1CCC(c2nc(C(=O)OCC)cs2)CC1	ZINC000348172852	456514828	/nfs/dbraw/zinc/51/48/28/456514828.db2.gz	ZRFNIABYDZJCLX-UHFFFAOYSA-N	0	3	338.473	3.092	20	30		EGEDHN
Cc1ccc(CNC(=O)C2CCN([C@@H](C)CCC#N)CC2)cc1F	ZINC000276601310	456526491	/nfs/dbraw/zinc/52/64/91/456526491.db2.gz	RCQVCVHOPZQSPD-HNNXBMFYSA-N	0	3	331.435	3.155	20	30		EGEDHN
CCOc1ccccc1CN1CCN(CCCSCC#N)[C@H](C)C1	ZINC000282528584	456541933	/nfs/dbraw/zinc/54/19/33/456541933.db2.gz	YUJAKCXHVLAMOF-QGZVFWFLSA-N	0	3	347.528	3.238	20	30		EGEDHN
COc1cc(CNCc2cn(C)nc2-c2ccccc2)ccc1C#N	ZINC000353251396	456586750	/nfs/dbraw/zinc/58/67/50/456586750.db2.gz	QNSBSRBFKMTJRX-UHFFFAOYSA-N	0	3	332.407	3.257	20	30		EGEDHN
CN(Cc1cc(C#N)n(C)c1)[C@@H]1CCO[C@@H](c2ccc(F)cc2)C1	ZINC000276809923	456587311	/nfs/dbraw/zinc/58/73/11/456587311.db2.gz	XQCMMBIXFGHGHZ-IEBWSBKVSA-N	0	3	327.403	3.388	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N[C@H]1CCN(Cc2ccccc2)CC1(C)C	ZINC000282673410	456589608	/nfs/dbraw/zinc/58/96/08/456589608.db2.gz	HFMDMTWXCTXDQY-MJGOQNOKSA-N	0	3	344.499	3.385	20	30		EGEDHN
COc1cc(NCCN[C@H]2CCc3ccc(C#N)cc32)cc(OC)c1	ZINC000353274338	456603548	/nfs/dbraw/zinc/60/35/48/456603548.db2.gz	OSHYTRLZXBUZQZ-FQEVSTJZSA-N	0	3	337.423	3.264	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)N[C@@H]1CCN(C)[C@H](C)C1	ZINC000340694464	456632788	/nfs/dbraw/zinc/63/27/88/456632788.db2.gz	FEQMINCQOYHEHC-BXUZGUMPSA-N	0	3	327.453	3.294	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@@H](C)Cc2cncc3ccccc32)CC1	ZINC000353318325	456634394	/nfs/dbraw/zinc/63/43/94/456634394.db2.gz	ZMADISGRMRKPOJ-INIZCTEOSA-N	0	3	337.467	3.180	20	30		EGEDHN
COc1cccc2c1CC[C@@H]2NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000348344158	456636436	/nfs/dbraw/zinc/63/64/36/456636436.db2.gz	QHPIOBBBSZVVJB-APWZRJJASA-N	0	3	345.402	3.053	20	30		EGEDHN
C[C@@H](CN1CCOCC1)N(Cc1ccccc1)Cc1ccc(C#N)cc1	ZINC000353328540	456642567	/nfs/dbraw/zinc/64/25/67/456642567.db2.gz	MCRBWQHJBCXSOX-IBGZPJMESA-N	0	3	349.478	3.281	20	30		EGEDHN
CN(C)C[C@@H](NC(=O)Cc1ccc(C#N)cc1)c1ccc(Cl)cc1	ZINC000282971636	456679489	/nfs/dbraw/zinc/67/94/89/456679489.db2.gz	OWZDGMAANBFFEL-GOSISDBHSA-N	0	3	341.842	3.173	20	30		EGEDHN
CC(C)[C@H](C(=O)NCc1cccc(N2CCC2=O)c1)N1CCCCC1	ZINC000328621004	456720474	/nfs/dbraw/zinc/72/04/74/456720474.db2.gz	XGRQNPYOYZKZHR-LJQANCHMSA-N	0	3	343.471	3.390	20	30		EGEDHN
CN(CCC(=O)Nc1ccc(C#N)c(Cl)c1)CCc1ccccn1	ZINC000299550546	456725055	/nfs/dbraw/zinc/72/50/55/456725055.db2.gz	GCAHPRILRHNLRE-UHFFFAOYSA-N	0	3	342.830	3.110	20	30		EGEDHN
CN(C)Cc1ccc(CNC(=O)Nc2ccc(C#N)c(F)c2)cc1	ZINC000353512698	456726852	/nfs/dbraw/zinc/72/68/52/456726852.db2.gz	QTPWFAVNKSMKCV-UHFFFAOYSA-N	0	3	326.375	3.081	20	30		EGEDHN
O=C(NCC#Cc1cccc(F)c1)c1ccc(CN2CCCC2)cc1	ZINC000338241783	456728472	/nfs/dbraw/zinc/72/84/72/456728472.db2.gz	VPHMLQOIFXNKPU-UHFFFAOYSA-N	0	3	336.410	3.203	20	30		EGEDHN
C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NCc1ccccc1C#N	ZINC000277251974	456745834	/nfs/dbraw/zinc/74/58/34/456745834.db2.gz	AEOHEJRQBVRWAK-WMLDXEAASA-N	0	3	329.444	3.293	20	30		EGEDHN
CCc1nc(C)c(CNC2CCN(Cc3ccc(C#N)cc3)CC2)o1	ZINC000291765985	456749830	/nfs/dbraw/zinc/74/98/30/456749830.db2.gz	NEQDLCYXCWZYMX-UHFFFAOYSA-N	0	3	338.455	3.171	20	30		EGEDHN
Cc1nsc(C)c1C(=O)NCC1(N2CCCCC2)CCOCC1	ZINC000328811061	456766060	/nfs/dbraw/zinc/76/60/60/456766060.db2.gz	FAURKUGZRAWRNG-UHFFFAOYSA-N	0	3	337.489	3.100	20	30		EGEDHN
C=CCOCCCN1C[C@@H](O)C[C@H]1c1ccccc1C(F)(F)F	ZINC000343690389	456767715	/nfs/dbraw/zinc/76/77/15/456767715.db2.gz	QSOVEWHKPIHNQH-BBRMVZONSA-N	0	3	329.362	3.406	20	30		EGEDHN
C#CCN1CCC(C(=O)NCc2ccccc2OCCC(C)C)CC1	ZINC000299706346	456769123	/nfs/dbraw/zinc/76/91/23/456769123.db2.gz	XLDHRWMYGUGCDK-UHFFFAOYSA-N	0	3	342.483	3.073	20	30		EGEDHN
COc1cc(C#N)ccc1OCCNC(C)(C)c1ccc(C)nc1	ZINC000353569809	456769924	/nfs/dbraw/zinc/76/99/24/456769924.db2.gz	MIHCEVDBIFLXKI-UHFFFAOYSA-N	0	3	325.412	3.174	20	30		EGEDHN
CN1CCC(Oc2ccc(CNC(=O)N[C@H]3C=CCCC3)cc2)CC1	ZINC000328873665	456781111	/nfs/dbraw/zinc/78/11/11/456781111.db2.gz	JDWPGONUTHJBEO-KRWDZBQOSA-N	0	3	343.471	3.272	20	30		EGEDHN
CCN1CCC[C@H](NC(=O)[C@@H]2CCCO[C@H]2c2ccnn2C(C)C)C1	ZINC000328920830	456791200	/nfs/dbraw/zinc/79/12/00/456791200.db2.gz	BZDKBWRWFGVBRM-LZLYRXPVSA-N	0	3	348.491	3.373	20	30		EGEDHN
CCN1CCC[C@@H]1CNC(=O)[C@@H]1CCCO[C@H]1c1ccnn1C(C)C	ZINC000328932176	456795598	/nfs/dbraw/zinc/79/55/98/456795598.db2.gz	DGELSUDGFGDDFY-JFIYKMOQSA-N	0	3	348.491	3.373	20	30		EGEDHN
CC(C)n1nccc1[C@H]1OCC[C@@H]1NC(=O)C1CCN(C2CC2)CC1	ZINC000328948245	456798694	/nfs/dbraw/zinc/79/86/94/456798694.db2.gz	BRFNLAUNLGKPBT-WMZOPIPTSA-N	0	3	346.475	3.125	20	30		EGEDHN
C=C(C)CN1CCC(Nc2ncnc3c2cnn3-c2ccccc2)CC1	ZINC000301168890	456811716	/nfs/dbraw/zinc/81/17/16/456811716.db2.gz	IVOCVKXBXHZDAQ-UHFFFAOYSA-N	0	3	348.454	3.268	20	30		EGEDHN
C=CCSCCNC(=O)N[C@@H]1CCN([C@@H](C)c2ccccc2)C1	ZINC000338466505	456829502	/nfs/dbraw/zinc/82/95/02/456829502.db2.gz	SZIBXMXVSJRRDH-DOTOQJQBSA-N	0	3	333.501	3.040	20	30		EGEDHN
CCN1CCO[C@H](CN[C@@H]2CCC[C@H](C#N)C2)[C@H]1c1ccccc1	ZINC000344900743	456870021	/nfs/dbraw/zinc/87/00/21/456870021.db2.gz	YVKPIZMJKYKVQM-MTFMMBMASA-N	0	3	327.472	3.120	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN(C)[C@H]1CCO[C@@H](c2ccc(F)cc2)C1	ZINC000348822305	456871215	/nfs/dbraw/zinc/87/12/15/456871215.db2.gz	NRTLGQPFQCCFDP-RBUKOAKNSA-N	0	3	348.462	3.402	20	30		EGEDHN
Cc1c(C(=O)C(C#N)c2nnc3n2CCCCC3)ccn1C(C)C	ZINC000344922712	456872010	/nfs/dbraw/zinc/87/20/10/456872010.db2.gz	SOJNMMCQXUSDPO-OAHLLOKOSA-N	0	3	325.416	3.185	20	30		EGEDHN
C=CCOc1cccc(CN(CCNC(C)=O)C2CCSCC2)c1	ZINC000339003127	456895343	/nfs/dbraw/zinc/89/53/43/456895343.db2.gz	WLMJJQDKFAYRBG-UHFFFAOYSA-N	0	3	348.512	3.085	20	30		EGEDHN
O=C(CC1CCCCC1)NCC(=O)N1CCN(C2CCCC2)CC1	ZINC000329489209	456898835	/nfs/dbraw/zinc/89/88/35/456898835.db2.gz	URTPYEWPLQNYQG-UHFFFAOYSA-N	0	3	335.492	3.000	20	30		EGEDHN
CCO[C@@H]1C[C@H](NC(=O)[C@H](C(C)C)N2CCCCC2)[C@@]12CCCO2	ZINC000329516284	456903242	/nfs/dbraw/zinc/90/32/42/456903242.db2.gz	MRGWSNGAPPZJJF-ZMMAXQRCSA-N	0	3	338.492	3.180	20	30		EGEDHN
CC(C)Oc1ccc([C@@H](C)N[C@@H](C)C(=O)NC2(C#N)CCC2)cc1	ZINC000345040033	456906727	/nfs/dbraw/zinc/90/67/27/456906727.db2.gz	ZDDWLUPCHSTHAY-CABCVRRESA-N	0	3	329.444	3.075	20	30		EGEDHN
N#Cc1ccc([C@H](N[C@H]2CC=C(c3ccc(F)cc3)CC2)C(N)=O)cc1	ZINC000349221932	456916363	/nfs/dbraw/zinc/91/63/63/456916363.db2.gz	FKJFHLIPORPOIP-PMACEKPBSA-N	0	3	349.409	3.449	20	30		EGEDHN
C=CCN(CC=C)[C@H](CN1C(=O)N[C@H](c2cccs2)C1=O)C(C)C	ZINC000349230955	456917702	/nfs/dbraw/zinc/91/77/02/456917702.db2.gz	AJRWBICAEMTNCE-GDBMZVCRSA-N	0	3	347.484	3.040	20	30		EGEDHN
C=CCN(CC=C)[C@H](CN1C(=O)N[C@@H](c2cccs2)C1=O)C(C)C	ZINC000349230958	456917987	/nfs/dbraw/zinc/91/79/87/456917987.db2.gz	AJRWBICAEMTNCE-ZBFHGGJFSA-N	0	3	347.484	3.040	20	30		EGEDHN
CCCc1ncc(C(=O)NCC2(N3CCCC3)CCOCC2)s1	ZINC000329636259	456919439	/nfs/dbraw/zinc/91/94/39/456919439.db2.gz	YAZXXWKSGACACE-UHFFFAOYSA-N	0	3	337.489	3.045	20	30		EGEDHN
CCN(Cc1ccc(C(=O)N[C@](C)(C#N)CSC)cc1)C1CC1	ZINC000345088096	456921571	/nfs/dbraw/zinc/92/15/71/456921571.db2.gz	CKCXYENAPCPGRT-GOSISDBHSA-N	0	3	331.485	3.046	20	30		EGEDHN
Cc1ccc2oc(SCC(=O)NC3CCN(C4CC4)CC3)nc2n1	ZINC000329661908	456923322	/nfs/dbraw/zinc/92/33/22/456923322.db2.gz	PERUQACZEWACFY-UHFFFAOYSA-N	0	3	346.456	3.207	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)[C@H]2CCCCN2C(=O)c2cccs2)CCN1C	ZINC000329703760	456930202	/nfs/dbraw/zinc/93/02/02/456930202.db2.gz	ILLZJKCXIHKIJP-RBSFLKMASA-N	0	3	349.500	3.182	20	30		EGEDHN
CN1CCC2(CCCN2C(=O)Nc2cccc(-c3cc[nH]n3)c2)CC1	ZINC000329807434	456943483	/nfs/dbraw/zinc/94/34/83/456943483.db2.gz	OQXWWAQRHSTVAL-UHFFFAOYSA-N	0	3	339.443	3.182	20	30		EGEDHN
CCN1CCC(NC(=O)CN2C[C@@H]3CCC(=O)c4cccc2c43)CC1	ZINC000329821315	456945400	/nfs/dbraw/zinc/94/54/00/456945400.db2.gz	PRIANCQUUNMESI-AWEZNQCLSA-N	0	3	341.455	3.008	20	30		EGEDHN
C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)COc1cccc2c1OC(C)(C)C2	ZINC000329852679	456951225	/nfs/dbraw/zinc/95/12/25/456951225.db2.gz	UZCUOQXDNHREPJ-CJNGLKHVSA-N	0	3	344.455	3.218	20	30		EGEDHN
Cn1cc(-c2ncc(CN[C@H](CCCC#N)c3ccccc3)cn2)cn1	ZINC000353902351	456958143	/nfs/dbraw/zinc/95/81/43/456958143.db2.gz	STFBAQYJWDKWKH-LJQANCHMSA-N	0	3	346.438	3.402	20	30		EGEDHN
C[C@@H]1CCCN(C(C)(C)CNC(=O)c2coc(C3CCOCC3)n2)C1	ZINC000329920031	456961147	/nfs/dbraw/zinc/96/11/47/456961147.db2.gz	DQVTUFMMNSAOLG-CQSZACIVSA-N	0	3	349.475	3.384	20	30		EGEDHN
O=C(CCN1CCSC[C@H]1CCO)N[C@@H]1CCCc2ccccc21	ZINC000329954892	456966306	/nfs/dbraw/zinc/96/63/06/456966306.db2.gz	OAUKOHWTFBQTTC-SJLPKXTDSA-N	0	3	348.512	3.210	20	30		EGEDHN
O=C(NC1CCC(C(=O)NC2CCN(C3CC3)CC2)CC1)C1CC1	ZINC000329957130	456966411	/nfs/dbraw/zinc/96/64/11/456966411.db2.gz	LQYIOXATIPFQDW-UHFFFAOYSA-N	0	3	333.476	3.495	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NC[C@H]1CCCCN1Cc1ccccc1	ZINC000345691230	456987849	/nfs/dbraw/zinc/98/78/49/456987849.db2.gz	MEFHAHAZUFVHKD-AABGKKOBSA-N	0	3	342.483	3.139	20	30		EGEDHN
CC(C)(C)[C@H](CN1CCc2ccccc2C1)NC(=O)NCCCC#N	ZINC000345729670	456990086	/nfs/dbraw/zinc/99/00/86/456990086.db2.gz	OQHQKQHDUMHRFJ-SFHVURJKSA-N	0	3	342.487	3.062	20	30		EGEDHN
CC(C)C[C@H]1OCCC[C@H]1NCC(=O)Nc1ccc2c(c1)OCO2	ZINC000330148681	456992125	/nfs/dbraw/zinc/99/21/25/456992125.db2.gz	MGWBONNZTHXKMK-GDBMZVCRSA-N	0	3	334.416	3.187	20	30		EGEDHN
C[C@H]1C[C@@H]1N1CCN(C(=O)c2ccc(C3(C#N)CC3)cc2)C[C@@H](C)C1	ZINC000346221307	457024478	/nfs/dbraw/zinc/02/44/78/457024478.db2.gz	VPDZGZVXQRJGCD-BXWFABGCSA-N	0	3	337.467	3.044	20	30		EGEDHN
C=CC1CCN([C@@H]2CCCN(Cc3ccc(F)cc3F)C2=O)CC1	ZINC000346232226	457026349	/nfs/dbraw/zinc/02/63/49/457026349.db2.gz	APFPVSQOIYRRIS-GOSISDBHSA-N	0	3	334.410	3.354	20	30		EGEDHN
CCCN(CC(=O)N(CC)C[C@@H](C)C#N)[C@H]1CCc2ccccc21	ZINC000346569572	457051721	/nfs/dbraw/zinc/05/17/21/457051721.db2.gz	BOEJPSWONHZULE-LPHOPBHVSA-N	0	3	327.472	3.394	20	30		EGEDHN
C=C(C)Cn1c(-c2ccc(C)o2)nnc1N1C[C@H](C)N(CC)C[C@@H]1C	ZINC000359109423	457056951	/nfs/dbraw/zinc/05/69/51/457056951.db2.gz	OOQDZBCFWRWPOL-GJZGRUSLSA-N	0	3	343.475	3.342	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCC2(OC)CCC(C)CC2)CC1	ZINC000331026456	457122298	/nfs/dbraw/zinc/12/22/98/457122298.db2.gz	PHFMKYINHIJFKX-UHFFFAOYSA-N	0	3	337.508	3.126	20	30		EGEDHN
CC(C)(C)[C@@H](C#N)NC(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1	ZINC000331222954	457148476	/nfs/dbraw/zinc/14/84/76/457148476.db2.gz	YYPKVNUVXLICLU-DOTOQJQBSA-N	0	3	331.435	3.092	20	30		EGEDHN
CC(C#N)C(=O)N1CCSC[C@H]1c1cccc(C(F)(F)F)c1	ZINC000354248454	457153506	/nfs/dbraw/zinc/15/35/06/457153506.db2.gz	TVEPLRKZDYACKT-MFKMUULPSA-N	0	3	328.359	3.482	20	30		EGEDHN
CC(C#N)C(=O)N[C@H](c1cccc(C(F)(F)F)c1)C1CCOCC1	ZINC000356891058	457200918	/nfs/dbraw/zinc/20/09/18/457200918.db2.gz	HBUKGDBRKXKRHA-ABAIWWIYSA-N	0	3	340.345	3.449	20	30		EGEDHN
COc1cc([C@@H](C)NC(=O)C(C)C#N)ccc1OCc1ccncc1	ZINC000347077761	457218886	/nfs/dbraw/zinc/21/88/86/457218886.db2.gz	UZHAOOPMXTXTHU-ZIAGYGMSSA-N	0	3	339.395	3.006	20	30		EGEDHN
CC(C#N)C(=O)NC[C@H](c1ccccc1)N1CCc2sccc2C1	ZINC000347084738	457222291	/nfs/dbraw/zinc/22/22/91/457222291.db2.gz	ZLPFWSIGTZVJPQ-WMLDXEAASA-N	0	3	339.464	3.123	20	30		EGEDHN
N#CC(C(=O)c1ccc(Br)c(Cl)c1)c1ccncn1	ZINC000354476347	457247422	/nfs/dbraw/zinc/24/74/22/457247422.db2.gz	ZGPFBJBTVQDVBH-SECBINFHSA-N	0	3	336.576	3.383	20	30		EGEDHN
C=C(C)CN(Cc1ccc(CO)o1)C(=O)[C@H]1CCCN1C1CCCC1	ZINC000342391110	457275718	/nfs/dbraw/zinc/27/57/18/457275718.db2.gz	FRONGEGZIOOZDY-LJQANCHMSA-N	0	3	346.471	3.084	20	30		EGEDHN
C[C@H](O)C[C@H]1CCCCCN1C(=O)C(C#N)CCc1ccccc1	ZINC000331995167	457286383	/nfs/dbraw/zinc/28/63/83/457286383.db2.gz	NDCAWCHOOQTHRU-YTQUADARSA-N	0	3	328.456	3.301	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N(C)[C@H](C)C2(C)CC2)cc1	ZINC000351689700	457314628	/nfs/dbraw/zinc/31/46/28/457314628.db2.gz	CJFRARQRYNZXTD-QWHCGFSZSA-N	0	3	349.456	3.025	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1ccc(CC)nc1C)C(C)C	ZINC000354720103	457316325	/nfs/dbraw/zinc/31/63/25/457316325.db2.gz	XKHWKCPOHXXKGT-LJQANCHMSA-N	0	3	329.488	3.381	20	30		EGEDHN
C=C(C)CCN1CCc2cc(OC)c(OC)cc2[C@@H]1CC(=O)OC	ZINC000351855930	457321180	/nfs/dbraw/zinc/32/11/80/457321180.db2.gz	QPGIONGANZZLPY-INIZCTEOSA-N	0	3	333.428	3.132	20	30		EGEDHN
C=C(C)COc1cc(CN2CCN(CC3CC3)CC2)ccc1OC	ZINC000351883231	457321575	/nfs/dbraw/zinc/32/15/75/457321575.db2.gz	UIYTXKFIXGLALI-UHFFFAOYSA-N	0	3	330.472	3.178	20	30		EGEDHN
CC(C)(C)N1C[C@H](C(F)(F)F)[C@H](C(=O)NCC(C)(C)CCC#N)C1	ZINC000354974965	457332125	/nfs/dbraw/zinc/33/21/25/457332125.db2.gz	KGINJZPZRKTSGG-OLZOCXBDSA-N	0	3	347.425	3.341	20	30		EGEDHN
C=CCNC(=O)NC(=O)[C@H](C)N[C@@H](c1ccc(Cl)cc1)C(C)C	ZINC000357196765	457370297	/nfs/dbraw/zinc/37/02/97/457370297.db2.gz	DPUCNILSBUQHBG-SWLSCSKDSA-N	0	3	337.851	3.027	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)NC[C@H]1CCCN(Cc2ccccc2)C1	ZINC000373862634	457374221	/nfs/dbraw/zinc/37/42/21/457374221.db2.gz	KGLPIJFPJIJIPH-QGZVFWFLSA-N	0	3	337.423	3.102	20	30		EGEDHN
C=CCOc1ccc(C(=O)N(CCN(C)C)Cc2ccc(C)o2)cc1	ZINC000355811434	457420184	/nfs/dbraw/zinc/42/01/84/457420184.db2.gz	MVDCSSPEGSAODH-UHFFFAOYSA-N	0	3	342.439	3.357	20	30		EGEDHN
N#CC1(F)CCN(C(=O)c2ccc(CN3CCCCC3)cc2)CC1	ZINC000355962515	457434990	/nfs/dbraw/zinc/43/49/90/457434990.db2.gz	GWEUXTYJDQOVQZ-UHFFFAOYSA-N	0	3	329.419	3.140	20	30		EGEDHN
CN(CCOc1ccc(C#N)cc1)CCc1ccccc1[N+](=O)[O-]	ZINC000352570586	457473378	/nfs/dbraw/zinc/47/33/78/457473378.db2.gz	JGAVAPMUHOEIHW-UHFFFAOYSA-N	0	3	325.368	3.020	20	30		EGEDHN
CCC[C@@H](C)NC(=O)[C@H]1CCCN(Cc2ccc(CC#N)cc2)C1	ZINC000342721295	457478561	/nfs/dbraw/zinc/47/85/61/457478561.db2.gz	ZFQPMSYEXYQACH-APWZRJJASA-N	0	3	327.472	3.269	20	30		EGEDHN
C=CCSCCNC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@H]1C	ZINC000357372652	457478656	/nfs/dbraw/zinc/47/86/56/457478656.db2.gz	KOSUDTGPFABREQ-AEFFLSMTSA-N	0	3	347.528	3.115	20	30		EGEDHN
C=CCN(CCC(=O)Nc1ccc(OC)cc1)CCc1ccco1	ZINC000352699911	457541318	/nfs/dbraw/zinc/54/13/18/457541318.db2.gz	GPKJAWZFCPCEKC-UHFFFAOYSA-N	0	3	328.412	3.348	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC(CCN3C[C@@H](C)O[C@@H](C)C3)CC2)CC1	ZINC000356310501	457567459	/nfs/dbraw/zinc/56/74/59/457567459.db2.gz	UJCHIWIATPQREV-HDICACEKSA-N	0	3	348.531	3.471	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)C[C@H](O)COc1ccccc1F	ZINC000425544348	457592856	/nfs/dbraw/zinc/59/28/56/457592856.db2.gz	SKPAZSUIIRPBIC-PBHICJAKSA-N	0	3	328.387	3.130	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@@H](C)N1CC2(CCC2)[C@H]1C1CCOCC1	ZINC000425555620	457597215	/nfs/dbraw/zinc/59/72/15/457597215.db2.gz	QYNYXQZHUUVNEO-SJLPKXTDSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N1CC[C@@H]([C@H]2CCOC2)C1	ZINC000374407419	457616278	/nfs/dbraw/zinc/61/62/78/457616278.db2.gz	VSPAHJOEIIZXPP-BBWFWOEESA-N	0	3	348.512	3.010	20	30		EGEDHN
C=CC[C@H](CC)NC(=O)c1ccc(N2CCN(C(C)C)CC2)cc1	ZINC000410125056	457629726	/nfs/dbraw/zinc/62/97/26/457629726.db2.gz	YFWYVSNHCLMFPT-SFHVURJKSA-N	0	3	329.488	3.302	20	30		EGEDHN
CC(C#N)C(=O)N1CCCC[C@H]1c1nc(-c2cccc(F)c2)c[nH]1	ZINC000357802471	457695004	/nfs/dbraw/zinc/69/50/04/457695004.db2.gz	KMEYZSPYCFSMRV-WBMJQRKESA-N	0	3	326.375	3.429	20	30		EGEDHN
CC(C#N)C(=O)N1CCCC[C@@H]1c1nc(-c2cccc(F)c2)c[nH]1	ZINC000357802470	457695624	/nfs/dbraw/zinc/69/56/24/457695624.db2.gz	KMEYZSPYCFSMRV-MLGOLLRUSA-N	0	3	326.375	3.429	20	30		EGEDHN
N#Cc1ccc(OCCN2CC[C@@H](n3ncc4ccccc43)C2)cc1	ZINC000374748217	457699691	/nfs/dbraw/zinc/69/96/91/457699691.db2.gz	ACEZZOQIZMMRJI-GOSISDBHSA-N	0	3	332.407	3.234	20	30		EGEDHN
CC(C#N)C(=O)N[C@H](Cn1cnc2ccccc21)c1ccc(F)cc1	ZINC000357830207	457703362	/nfs/dbraw/zinc/70/33/62/457703362.db2.gz	PLPUKYOQCJHAKY-CXAGYDPISA-N	0	3	336.370	3.193	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H](C)[C@@H](c1ccccc1C)N(C)C	ZINC000357852650	457712603	/nfs/dbraw/zinc/71/26/03/457712603.db2.gz	BPLXNMSDMYEBTN-LPHOPBHVSA-N	0	3	325.456	3.404	20	30		EGEDHN
Cc1ccccc1[C@@H]([C@H](C)NC(=O)c1cc(C#N)cs1)N(C)C	ZINC000357877197	457721032	/nfs/dbraw/zinc/72/10/32/457721032.db2.gz	UJENXHIACOMJEJ-SUMWQHHRSA-N	0	3	327.453	3.349	20	30		EGEDHN
CN(C)[C@@H](CNC(=O)[C@H](C#N)CCc1ccccc1)c1ccccc1	ZINC000433112515	457759889	/nfs/dbraw/zinc/75/98/89/457759889.db2.gz	BEGUTRPFTUJCGX-PMACEKPBSA-N	0	3	335.451	3.178	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CCC[C@H](NCc2ccccc2)C1)OCC	ZINC000371120969	457796827	/nfs/dbraw/zinc/79/68/27/457796827.db2.gz	YUWFYQMKDFCGKW-OALUTQOASA-N	0	3	330.472	3.139	20	30		EGEDHN
Cc1cc(CN[C@@H](Cc2ccccc2)[C@H](O)C(F)F)ccc1C#N	ZINC000443997518	457837894	/nfs/dbraw/zinc/83/78/94/457837894.db2.gz	MGBOAPTVEIRVKL-ROUUACIJSA-N	0	3	330.378	3.194	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)N(C)CC(C)(C)C#N)C1	ZINC000457944062	457877381	/nfs/dbraw/zinc/87/73/81/457877381.db2.gz	YOSNYGZQRVZBLB-NVXWUHKLSA-N	0	3	328.460	3.013	20	30		EGEDHN
N#CC(=C([O-])c1ccnn1-c1ccccc1)c1cnc2ccccc2n1	ZINC000361842386	457901148	/nfs/dbraw/zinc/90/11/48/457901148.db2.gz	KZLWRCHSIFUZEU-HNNXBMFYSA-N	0	3	339.358	3.306	20	30		EGEDHN
N#CC(C(=O)c1ccnn1-c1ccccc1)c1cnc2ccccc2n1	ZINC000361842386	457901155	/nfs/dbraw/zinc/90/11/55/457901155.db2.gz	KZLWRCHSIFUZEU-HNNXBMFYSA-N	0	3	339.358	3.306	20	30		EGEDHN
CC(C)(N[C@H]1CCN(c2ccc(C#N)cc2)C1=O)c1cccs1	ZINC000411538096	457914274	/nfs/dbraw/zinc/91/42/74/457914274.db2.gz	WDUFZKNFMPJBIX-HNNXBMFYSA-N	0	3	325.437	3.250	20	30		EGEDHN
C=CC[C@@H](CC)NC(=O)N(C)C[C@@H]1CCN(C)[C@H]1c1cccnc1	ZINC000366999469	457919374	/nfs/dbraw/zinc/91/93/74/457919374.db2.gz	WGRKQENWPFQIGF-KSZLIROESA-N	0	3	330.476	3.071	20	30		EGEDHN
Cc1cc(CN(C)CCC(=O)Nc2cccc(C#N)c2)ccc1F	ZINC000444738871	457960399	/nfs/dbraw/zinc/96/03/99/457960399.db2.gz	TWALEZGDKRFPNP-UHFFFAOYSA-N	0	3	325.387	3.466	20	30		EGEDHN
Cc1cc(NC(=O)[C@@]2(C#N)CC23CCCC3)ccc1OCCN(C)C	ZINC000458206876	457968649	/nfs/dbraw/zinc/96/86/49/457968649.db2.gz	ILICROPQUHULTP-FQEVSTJZSA-N	0	3	341.455	3.348	20	30		EGEDHN
C=CCN1CC[C@H](N2CCC(c3c[nH]c4cc(F)ccc43)CC2)C1=O	ZINC000375598677	457983937	/nfs/dbraw/zinc/98/39/37/457983937.db2.gz	QLWIJDIUJGQDOO-IBGZPJMESA-N	0	3	341.430	3.273	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)[C@@H](C)Cc2cccc(F)c2)CC1	ZINC000458348290	458019926	/nfs/dbraw/zinc/01/99/26/458019926.db2.gz	YSARXIJDOZSFFY-HNNXBMFYSA-N	0	3	333.451	3.049	20	30		EGEDHN
N#CC(C(=O)c1ccc2oc(=O)[nH]c2c1)c1cc(C(F)(F)F)ccn1	ZINC000362127999	458032609	/nfs/dbraw/zinc/03/26/09/458032609.db2.gz	CKNMBGMTPJHVGL-JTQLQIEISA-N	0	3	347.252	3.437	20	30		EGEDHN
N#CC(C(=O)c1ccc2c(c1)OCO2)c1cc(C(F)(F)F)ccn1	ZINC000362129740	458032798	/nfs/dbraw/zinc/03/27/98/458032798.db2.gz	NZKWUMGAGZAGMP-LLVKDONJSA-N	0	3	334.253	3.319	20	30		EGEDHN
C[C@@H](CN(C)C(=O)C(C#N)CCc1ccccc1)C(=O)OC(C)(C)C	ZINC000458390385	458033216	/nfs/dbraw/zinc/03/32/16/458033216.db2.gz	MWUMBCBEACLOQW-RDJZCZTQSA-N	0	3	344.455	3.195	20	30		EGEDHN
Cc1cccc2c1OC[C@H](NC(=O)C(C#N)CCc1ccccc1)C2	ZINC000427987123	458061808	/nfs/dbraw/zinc/06/18/08/458061808.db2.gz	JIHCAAWUYYVJMS-RTBURBONSA-N	0	3	334.419	3.187	20	30		EGEDHN
Cc1ccc([C@H](C)[NH2+]C2CCN(c3ccc(C#N)cn3)CC2)c([O-])c1	ZINC000371875781	458105743	/nfs/dbraw/zinc/10/57/43/458105743.db2.gz	GFMITVRDFOBXEU-HNNXBMFYSA-N	0	3	336.439	3.287	20	30		EGEDHN
CC(C)[C@H](CC(F)(F)F)NCC(=O)N(C)C1(C#N)CCCCC1	ZINC000445887467	458111298	/nfs/dbraw/zinc/11/12/98/458111298.db2.gz	QMFPYQVFMTWGDP-ZDUSSCGKSA-N	0	3	333.398	3.238	20	30		EGEDHN
C[C@H](NC(=O)[C@@H]1C[C@H]1c1cccc(C#N)c1)[C@@H](c1ccccc1)N(C)C	ZINC000412249362	458143204	/nfs/dbraw/zinc/14/32/04/458143204.db2.gz	CDTPJYUZGNGWOX-KQLYMOGASA-N	0	3	347.462	3.469	20	30		EGEDHN
CN(CCN1CCCN(Cc2ccc(C#N)cc2)CC1)c1ccccc1	ZINC000358716510	458166667	/nfs/dbraw/zinc/16/66/67/458166667.db2.gz	POMVZPAFXXQHBY-UHFFFAOYSA-N	0	3	348.494	3.202	20	30		EGEDHN
CN(C(=O)c1cn(CCCC#N)c2ccccc12)C1CCN(C)CC1	ZINC000435778014	458203486	/nfs/dbraw/zinc/20/34/86/458203486.db2.gz	QLIRABHEOLTUNC-UHFFFAOYSA-N	0	3	338.455	3.111	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCN(CCSCc3ccccc3)C2)nc1	ZINC000428785384	458212452	/nfs/dbraw/zinc/21/24/52/458212452.db2.gz	LXBVFMMCBMOGFR-GOSISDBHSA-N	0	3	339.464	3.340	20	30		EGEDHN
C[C@@H](C(=O)Nc1cc(C#N)ccc1NC1CC1)N1[C@H](C)CC[C@H]1C	ZINC000413766886	458306312	/nfs/dbraw/zinc/30/63/12/458306312.db2.gz	LZIIRWKFWCSWHS-MCIONIFRSA-N	0	3	326.444	3.332	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)NC(=O)N1CCCN(C(C)C)CC1	ZINC000413828433	458308045	/nfs/dbraw/zinc/30/80/45/458308045.db2.gz	UVHQUDJGTIIXMR-IBGZPJMESA-N	0	3	329.488	3.300	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NC(=O)N(C)[C@H]1CCN(C(C)C)C1	ZINC000413843211	458310550	/nfs/dbraw/zinc/31/05/50/458310550.db2.gz	ZKDFAOCHQBWOTQ-MOPGFXCFSA-N	0	3	329.488	3.298	20	30		EGEDHN
CC1(C)CN(C2(CNCc3ccc(C#N)o3)CCCCC2)CCO1	ZINC000369671530	458312395	/nfs/dbraw/zinc/31/23/95/458312395.db2.gz	HFWZQLKUDXIKOR-UHFFFAOYSA-N	0	3	331.460	3.055	20	30		EGEDHN
CC[C@@H](NCC(=O)N[C@H]1CCOc2ccccc21)c1ccc(C#N)cc1	ZINC000376573173	458341591	/nfs/dbraw/zinc/34/15/91/458341591.db2.gz	VCZYNJVRHYJBKC-MOPGFXCFSA-N	0	3	349.434	3.239	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)=C([O-])c1cccc(C[NH+](C)C)c1	ZINC000436699029	458362049	/nfs/dbraw/zinc/36/20/49/458362049.db2.gz	SEVPGWVEMRYQCV-INIZCTEOSA-N	0	3	332.407	3.125	20	30		EGEDHN
N#Cc1ccc(Br)c(CNC2(C3CC3)CCOCC2)c1	ZINC000376715190	458374187	/nfs/dbraw/zinc/37/41/87/458374187.db2.gz	IPXJPEWEKWZFEP-UHFFFAOYSA-N	0	3	335.245	3.370	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)NC[C@@H]1NCCc2ccccc21	ZINC000418628248	458375835	/nfs/dbraw/zinc/37/58/35/458375835.db2.gz	CBUUDCFIZNNPQK-SFHVURJKSA-N	0	3	341.480	3.333	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCCN1CCN(C)C[C@H]1c1ccccc1	ZINC000429864212	458378459	/nfs/dbraw/zinc/37/84/59/458378459.db2.gz	VOJBLZSLDLTILA-IBGZPJMESA-N	0	3	343.515	3.084	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)NCC2(C#N)CCC2)CCN1Cc1ccccc1	ZINC000419496457	458384612	/nfs/dbraw/zinc/38/46/12/458384612.db2.gz	LYUCMNZFAVUVFL-SJLPKXTDSA-N	0	3	340.471	3.033	20	30		EGEDHN
CC(C)N1CCCN(C(=O)N[C@@H]2CCCc3cc(C#N)ccc32)CC1	ZINC000419652797	458391121	/nfs/dbraw/zinc/39/11/21/458391121.db2.gz	VQMBEOOMSKMUCK-LJQANCHMSA-N	0	3	340.471	3.061	20	30		EGEDHN
CC(C)(CCC#N)CNC(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000376827497	458398970	/nfs/dbraw/zinc/39/89/70/458398970.db2.gz	XZKWJBMFEMDEAC-UHFFFAOYSA-N	0	3	342.487	3.280	20	30		EGEDHN
C=C(C)[C@@H](NC(=O)N(C)C[C@@H]1CCCN1C)c1ccc(F)c(F)c1	ZINC000420826386	458402467	/nfs/dbraw/zinc/40/24/67/458402467.db2.gz	AHRPCBGGZNNECF-WMLDXEAASA-N	0	3	337.414	3.318	20	30		EGEDHN
COc1ccc([C@H](CN(C)C)NCc2ccc(C#N)c(F)c2)cc1	ZINC000421352624	458412092	/nfs/dbraw/zinc/41/20/92/458412092.db2.gz	DKPNKSYMNIHQAT-IBGZPJMESA-N	0	3	327.403	3.098	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C[C@@H]2CSc3ccccc3O2)CC1	ZINC000449845874	458433536	/nfs/dbraw/zinc/43/35/36/458433536.db2.gz	SVHZJORRVHBZCZ-MRXNPFEDSA-N	0	3	346.496	3.087	20	30		EGEDHN
C=CCN1CC[C@@H](N(C)c2ccnc3ccc(OC(C)C)cc32)C1=O	ZINC000450501835	458450038	/nfs/dbraw/zinc/45/00/38/458450038.db2.gz	QXCSFWCVEMXFGF-LJQANCHMSA-N	0	3	339.439	3.245	20	30		EGEDHN
CCCCO[C@@H]1C[C@H](N[C@H](C)C(=O)N[C@@](C)(C#N)C(C)C)C1(C)C	ZINC000450964109	458460967	/nfs/dbraw/zinc/46/09/67/458460967.db2.gz	BRPDEEJXWDJELB-OLMMMNRUSA-N	0	3	337.508	3.003	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1CNC(=O)c1ccc(CN(CC)C2CC2)cc1	ZINC000437519980	458461154	/nfs/dbraw/zinc/46/11/54/458461154.db2.gz	WYCIBUOPDBKRNY-ICSRJNTNSA-N	0	3	342.483	3.382	20	30		EGEDHN
CCCCO[C@@H]1C[C@H](N[C@@H](C)C(=O)N[C@@](C)(C#N)C(C)C)C1(C)C	ZINC000450964108	458461292	/nfs/dbraw/zinc/46/12/92/458461292.db2.gz	BRPDEEJXWDJELB-GGXPGOJBSA-N	0	3	337.508	3.003	20	30		EGEDHN
CCCCO[C@@H]1C[C@H](N[C@H](C)C(=O)N[C@](C)(C#N)C(C)C)C1(C)C	ZINC000450964111	458461556	/nfs/dbraw/zinc/46/15/56/458461556.db2.gz	BRPDEEJXWDJELB-YYAJDYIMSA-N	0	3	337.508	3.003	20	30		EGEDHN
C[C@H]1CN(Cc2cc(C#N)ccc2Br)CCN(C2CC2)C1	ZINC000451094679	458464728	/nfs/dbraw/zinc/46/47/28/458464728.db2.gz	QGJBORNBSVABJN-ZDUSSCGKSA-N	0	3	348.288	3.237	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@@H]1C[C@H](OC)C12CCC2	ZINC000459745822	458466340	/nfs/dbraw/zinc/46/63/40/458466340.db2.gz	FIKGGUIZYKKJFT-SJORKVTESA-N	0	3	346.496	3.450	20	30		EGEDHN
C[C@H]1CN(C(=O)C[C@@H](CC#N)c2ccccc2)CCN(C2CC2)C1	ZINC000452167214	458496990	/nfs/dbraw/zinc/49/69/90/458496990.db2.gz	BOSGLJRBWOMQPP-SJLPKXTDSA-N	0	3	325.456	3.017	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCC[C@@H]2CCc3ccccc32)cc1	ZINC000452314846	458498792	/nfs/dbraw/zinc/49/87/92/458498792.db2.gz	LOKOFPRLBDLRHY-VQTJNVASSA-N	0	3	343.430	3.477	20	30		EGEDHN
CC(C)[C@@]1(CO)CCN(CC#Cc2ccc(C(F)(F)F)cc2)C1	ZINC000377656003	458508696	/nfs/dbraw/zinc/50/86/96/458508696.db2.gz	UWMFIAOSFQZMAK-KRWDZBQOSA-N	0	3	325.374	3.397	20	30		EGEDHN
CC(C#N)C(=O)N1CCC[C@@H](Nc2cccc(Br)c2)C1	ZINC000468575912	458528099	/nfs/dbraw/zinc/52/80/99/458528099.db2.gz	OQMLSIMFPDDLNO-SMDDNHRTSA-N	0	3	336.233	3.012	20	30		EGEDHN
COc1ccc([C@H]2CCCCCN2C(=O)[C@@H](N)CCCC#N)cc1	ZINC000424062543	458548767	/nfs/dbraw/zinc/54/87/67/458548767.db2.gz	LCESAGPZCFWPAT-ZWKOTPCHSA-N	0	3	329.444	3.160	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1ccccc1COCc1ccccc1	ZINC000424083188	458554557	/nfs/dbraw/zinc/55/45/57/458554557.db2.gz	COSNWPBHIJOISG-SFHVURJKSA-N	0	3	337.423	3.363	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1ccccc1COCc1ccccc1	ZINC000424083181	458554795	/nfs/dbraw/zinc/55/47/95/458554795.db2.gz	COSNWPBHIJOISG-GOSISDBHSA-N	0	3	337.423	3.363	20	30		EGEDHN
CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)[C@@H](N)CCCC#N	ZINC000424097090	458557249	/nfs/dbraw/zinc/55/72/49/458557249.db2.gz	DRXZNYOCTLDPFM-AWEZNQCLSA-N	0	3	328.243	3.363	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N[C@H](c1ccccc1)c1ccc(F)cc1	ZINC000424104529	458558802	/nfs/dbraw/zinc/55/88/02/458558802.db2.gz	UPNRNJNPYNQBBR-QZTJIDSGSA-N	0	3	325.387	3.052	20	30		EGEDHN
CC(C)C[C@@H](CN1CCCC1)NC(=O)N[C@@H](C)c1ccc(C#N)cc1	ZINC000454349785	458558835	/nfs/dbraw/zinc/55/88/35/458558835.db2.gz	PKGQXKKUKZXJSN-LPHOPBHVSA-N	0	3	342.487	3.429	20	30		EGEDHN
Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)[C@@H](N)CCCC#N	ZINC000424106651	458559578	/nfs/dbraw/zinc/55/95/78/458559578.db2.gz	SQGYGSCEHPURCX-DOMZBBRYSA-N	0	3	342.468	3.317	20	30		EGEDHN
CC(C)(CNC(=O)[C@H](N)CCCC#N)c1ccc(Cl)c(Cl)c1	ZINC000424115251	458562249	/nfs/dbraw/zinc/56/22/49/458562249.db2.gz	UQGMALKQPVEOGD-CQSZACIVSA-N	0	3	342.270	3.408	20	30		EGEDHN
Cc1ccsc1[C@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCC#N	ZINC000424123781	458564211	/nfs/dbraw/zinc/56/42/11/458564211.db2.gz	LINRDMXCZRKQLS-IRXDYDNUSA-N	0	3	341.480	3.478	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)NC1(c2c(Cl)cccc2Cl)CC1	ZINC000424127171	458565917	/nfs/dbraw/zinc/56/59/17/458565917.db2.gz	AVGJOHVKWSHLOA-GFCCVEGCSA-N	0	3	326.227	3.120	20	30		EGEDHN
CCCN(C(=O)[C@H](N)CCCC#N)[C@H]1C[C@@H](OCC)C12CCCCC2	ZINC000424134203	458566469	/nfs/dbraw/zinc/56/64/69/458566469.db2.gz	YBWRLDYFOVYFEP-FGTMMUONSA-N	0	3	349.519	3.374	20	30		EGEDHN
C[C@@H]1c2c(Cl)cc(Cl)cc2CCN1C(=O)[C@H](N)CCCC#N	ZINC000424153271	458573037	/nfs/dbraw/zinc/57/30/37/458573037.db2.gz	MVTRPBYMNNJAHN-QMTHXVAHSA-N	0	3	340.254	3.460	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)NCCCC#N)N(CC)CC)cc1	ZINC000431463923	458577078	/nfs/dbraw/zinc/57/70/78/458577078.db2.gz	JQRJCRDKOPUOOP-SFHVURJKSA-N	0	3	330.476	3.235	20	30		EGEDHN
N#CCc1ccc(NC(=O)N2CC[C@@H](N3CCCCC3)C2)c(Cl)c1	ZINC000455694998	458606923	/nfs/dbraw/zinc/60/69/23/458606923.db2.gz	ANHPAVVNRXEOHW-OAHLLOKOSA-N	0	3	346.862	3.498	20	30		EGEDHN
N#CCc1cccc(NC(=O)N2CCN(C3CCCCC3)CC2)c1	ZINC000455911265	458620138	/nfs/dbraw/zinc/62/01/38/458620138.db2.gz	VRFWRHPJYNLABC-UHFFFAOYSA-N	0	3	326.444	3.235	20	30		EGEDHN
CC[C@@H](Cc1ccc(C)cc1)N(C)CC(=O)N(CC)C[C@@H](C)C#N	ZINC000470368391	458632851	/nfs/dbraw/zinc/63/28/51/458632851.db2.gz	BIOSZBBZCYEICP-HKUYNNGSSA-N	0	3	329.488	3.256	20	30		EGEDHN
C[C@H]1CCCC[C@H]1C(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000424610752	458679834	/nfs/dbraw/zinc/67/98/34/458679834.db2.gz	CCCFRUZCGOBMHP-QFBILLFUSA-N	0	3	327.472	3.275	20	30		EGEDHN
C[C@@H]1C[C@@H](CNC(=O)OC(C)(C)C)CN1Cc1cc(C#N)cs1	ZINC000494470101	458683262	/nfs/dbraw/zinc/68/32/62/458683262.db2.gz	MNWHMOQXVSVMOJ-OCCSQVGLSA-N	0	3	335.473	3.355	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCc1ccc(OCCN2CCCC2)cc1	ZINC000424656923	458697534	/nfs/dbraw/zinc/69/75/34/458697534.db2.gz	BIGNROKQNSVRKB-UHFFFAOYSA-N	0	3	330.472	3.380	20	30		EGEDHN
C=C[C@@H](C)NC(=O)N1CC[C@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000464751910	458768675	/nfs/dbraw/zinc/76/86/75/458768675.db2.gz	MZSXEUFMYFKYMG-YLJYHZDGSA-N	0	3	327.472	3.259	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1C[C@H](c2ccccc2)[C@@H]2CCC[C@@H]21	ZINC000511841539	458780824	/nfs/dbraw/zinc/78/08/24/458780824.db2.gz	HHJWBSUXFQBRON-MDNKFWRPSA-N	0	3	339.483	3.263	20	30		EGEDHN
C[C@H](NC(=O)OC(C)(C)C)[C@@H]1CCN(Cc2ccc(CC#N)cc2)C1	ZINC000495033177	458785670	/nfs/dbraw/zinc/78/56/70/458785670.db2.gz	UTMIUTVWLIOZGR-MAUKXSAKSA-N	0	3	343.471	3.488	20	30		EGEDHN
C[C@@H]1CN(CCCNc2ccc(C(F)(F)F)c(C#N)c2)CCCO1	ZINC000432846228	458799363	/nfs/dbraw/zinc/79/93/63/458799363.db2.gz	IUCCJOCLMXHGSL-CYBMUJFWSA-N	0	3	341.377	3.490	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1N[C@@H](C)C(=O)N[C@H](C)c1ccc2ccccc2c1	ZINC000517217292	458826253	/nfs/dbraw/zinc/82/62/53/458826253.db2.gz	JDIGASDWCHFFIA-ITKAJJHTSA-N	0	3	338.451	3.339	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1N[C@H](C)C(=O)N[C@H](C)c1ccc2ccccc2c1	ZINC000517217291	458826418	/nfs/dbraw/zinc/82/64/18/458826418.db2.gz	JDIGASDWCHFFIA-IONDEXAJSA-N	0	3	338.451	3.339	20	30		EGEDHN
CC(C)(Cc1ccc(C#N)cc1)C(=O)NCCN1CCCC1(C)C	ZINC000457058944	458851449	/nfs/dbraw/zinc/85/14/49/458851449.db2.gz	QLBBENKIVRRXGC-UHFFFAOYSA-N	0	3	327.472	3.118	20	30		EGEDHN
CN(C)[C@H](CNC(=O)c1ccc(C(C)(C)C#N)cc1)Cc1ccccc1	ZINC000474392801	458882208	/nfs/dbraw/zinc/88/22/08/458882208.db2.gz	CVXBBXMYTNXCAG-FQEVSTJZSA-N	0	3	349.478	3.390	20	30		EGEDHN
CCOC(=O)[C@H](C)[C@H](C)NCC#Cc1ccc(OC(F)(F)F)cc1	ZINC000554816097	458901418	/nfs/dbraw/zinc/90/14/18/458901418.db2.gz	DTRRMWCONIRLMU-OLZOCXBDSA-N	0	3	343.345	3.114	20	30		EGEDHN
C=C(C)Cn1c(CC)nnc1N1CCN(CC2CCCCC2)CC1	ZINC000555263377	458904913	/nfs/dbraw/zinc/90/49/13/458904913.db2.gz	ADCLOCJYRDMCCY-UHFFFAOYSA-N	0	3	331.508	3.119	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@H](CCNC[C@@H](C#N)CCC#N)C1	ZINC000495645692	458907642	/nfs/dbraw/zinc/90/76/42/458907642.db2.gz	UNCYRSJDSATVLX-HZPDHXFCSA-N	0	3	334.464	3.057	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN(Cc1cccc(C)c1)CC(C)C	ZINC000531588091	458941428	/nfs/dbraw/zinc/94/14/28/458941428.db2.gz	BYAWWPMSUQYZRL-SFHVURJKSA-N	0	3	329.488	3.461	20	30		EGEDHN
C[C@@]1(Cc2ccccc2)CCCN1CC(=O)NCc1ccc(C#N)cc1	ZINC000467235587	458961350	/nfs/dbraw/zinc/96/13/50/458961350.db2.gz	APMXLFAKQVAPTH-QFIPXVFZSA-N	0	3	347.462	3.272	20	30		EGEDHN
C[C@H]1C[C@H](Nc2c(C#N)cnc3c(F)ccc(Cl)c32)CN1C1CC1	ZINC000566652542	458975826	/nfs/dbraw/zinc/97/58/26/458975826.db2.gz	QWFNBUCCYUYICK-JQWIXIFHSA-N	0	3	344.821	3.358	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)C1(C#N)CC(C)C1)c1cccc(OC)c1	ZINC000531808572	458982206	/nfs/dbraw/zinc/98/22/06/458982206.db2.gz	VAPLGEAUZXLULX-RVSXGSNBSA-N	0	3	343.471	3.134	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CC(C)(C)[C@@H]1[C@@H]1CCCO1	ZINC000577307206	459013543	/nfs/dbraw/zinc/01/35/43/459013543.db2.gz	KDHQFZYFVCQOGP-HOJAQTOUSA-N	0	3	345.483	3.044	20	30		EGEDHN
C[C@@H](CCC#N)N1CCC(CNC(=O)OCc2ccccc2)CC1	ZINC000495982631	459026817	/nfs/dbraw/zinc/02/68/17/459026817.db2.gz	OUPFLSMSQXSEDK-INIZCTEOSA-N	0	3	329.444	3.317	20	30		EGEDHN
C[C@@H]1CN(C(=O)C(C#N)Cc2ccc(C#N)cc2)[C@H]1c1ccccc1	ZINC000577517799	459046083	/nfs/dbraw/zinc/04/60/83/459046083.db2.gz	RVFYGZJGXZVEQO-CDHQVMDDSA-N	0	3	329.403	3.460	20	30		EGEDHN
Cc1csc(NC(=O)NC[C@@H](Cc2ccccc2)N(C)C)c1C#N	ZINC000520424060	459059419	/nfs/dbraw/zinc/05/94/19/459059419.db2.gz	XVHVUSKPLBKYPI-OAHLLOKOSA-N	0	3	342.468	3.223	20	30		EGEDHN
N#CCCCN1CCC([C@@H]2C[C@H]2NC(=O)OCc2ccccc2)CC1	ZINC000496128007	459077558	/nfs/dbraw/zinc/07/75/58/459077558.db2.gz	JOLVZKFLTUHYOD-RBUKOAKNSA-N	0	3	341.455	3.317	20	30		EGEDHN
CO[C@H](C)c1nc(CN2CCCN([C@H]3CC[C@@H](C#N)C3)CC2)cs1	ZINC000590161291	459095170	/nfs/dbraw/zinc/09/51/70/459095170.db2.gz	SODBCHSYFCAKOQ-INMHGKMJSA-N	0	3	348.516	3.050	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CC[C@H](c2cccnc2)C1	ZINC000578010078	459132348	/nfs/dbraw/zinc/13/23/48/459132348.db2.gz	VVQWAXBQTKPCIK-VQTJNVASSA-N	0	3	338.451	3.039	20	30		EGEDHN
CC(C#N)C(=O)N1CCCC[C@H]1[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000496295973	459140092	/nfs/dbraw/zinc/14/00/92/459140092.db2.gz	QNDDPCGBOQHYGN-PMPSAXMXSA-N	0	3	349.475	3.174	20	30		EGEDHN
Cc1ccc2oc(CNC[C@@H](O)COc3ccc(C#N)cc3)cc2c1	ZINC000594733626	459144297	/nfs/dbraw/zinc/14/42/97/459144297.db2.gz	ZYLLBUDZFRVACB-QGZVFWFLSA-N	0	3	336.391	3.142	20	30		EGEDHN
C=CCN1CCC(NC(=O)C(C)(C)Cc2ccccc2OC)CC1	ZINC000496470859	459204693	/nfs/dbraw/zinc/20/46/93/459204693.db2.gz	PTIQWWFOYMHUDH-UHFFFAOYSA-N	0	3	330.472	3.031	20	30		EGEDHN
CN1CC[C@@H]2CN(C(=O)c3cccc(Oc4ccc(C#N)cc4)c3)C[C@@H]21	ZINC000590776524	459213248	/nfs/dbraw/zinc/21/32/48/459213248.db2.gz	OISRFIQJPGZHPR-XLIONFOSSA-N	0	3	347.418	3.127	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NC(=O)N1CC[C@@H](N2CCCC2)C1	ZINC000579086349	459242869	/nfs/dbraw/zinc/24/28/69/459242869.db2.gz	TWJLBMBKMNFDAL-RTBURBONSA-N	0	3	327.472	3.054	20	30		EGEDHN
C=CCCCCN1CC[C@H](OC)C[C@H]1CNC(=O)OC(C)(C)C	ZINC000496676020	459281893	/nfs/dbraw/zinc/28/18/93/459281893.db2.gz	BAYZXTHDRSTWBQ-HOTGVXAUSA-N	0	3	326.481	3.347	20	30		EGEDHN
CN(CCC(=O)Nc1ccccc1C#N)Cc1cc(C(C)(C)C)[nH]n1	ZINC000559974428	459289074	/nfs/dbraw/zinc/28/90/74/459289074.db2.gz	RLIJWYKLCDVOIQ-UHFFFAOYSA-N	0	3	339.443	3.039	20	30		EGEDHN
C[C@@H]1OC(C)(C)N(C(=O)OC(C)(C)C)[C@@H]1CN[C@H]1CC[C@H](C#N)C1	ZINC000496716515	459297555	/nfs/dbraw/zinc/29/75/55/459297555.db2.gz	MZXNIHKAXGYQSV-ZQDZILKHSA-N	0	3	337.464	3.029	20	30		EGEDHN
N#Cc1ccc(CCN2CCC(O)(Cc3ccc(F)cc3)CC2)cc1	ZINC000595442574	459303265	/nfs/dbraw/zinc/30/32/65/459303265.db2.gz	UYUVASRMPZJRNJ-UHFFFAOYSA-N	0	3	338.426	3.309	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CNCc1ccnc(SC)c1	ZINC000568618970	459317075	/nfs/dbraw/zinc/31/70/75/459317075.db2.gz	ZPDUWCDAACFNDU-KRWDZBQOSA-N	0	3	344.480	3.062	20	30		EGEDHN
C[C@@H](c1cccc(N2CCOC2=O)c1)N(C)Cc1cc(C#N)n(C)c1	ZINC000496832157	459339987	/nfs/dbraw/zinc/33/99/87/459339987.db2.gz	HDYHHDRJNFXNEA-AWEZNQCLSA-N	0	3	338.411	3.046	20	30		EGEDHN
N#CC(C(=O)c1cncnc1C1CC1)c1ccc(C(F)(F)F)cn1	ZINC000582342926	459349924	/nfs/dbraw/zinc/34/99/24/459349924.db2.gz	WSSGYIOKOTZNDJ-NSHDSACASA-N	0	3	332.285	3.258	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2c3c(ccc2Cl)OCC3)CC1	ZINC000568827024	459350804	/nfs/dbraw/zinc/35/08/04/459350804.db2.gz	XGHCURXSJCNDLQ-UHFFFAOYSA-N	0	3	349.862	3.437	20	30		EGEDHN
C[C@H]1[C@@H](Cc2ccccc2)CCN1Cc1cnc2c(C#N)cnn2c1	ZINC000582360836	459353046	/nfs/dbraw/zinc/35/30/46/459353046.db2.gz	UESYWFOCKXYBIX-MAUKXSAKSA-N	0	3	331.423	3.054	20	30		EGEDHN
CN(C)[C@H](CC(=O)N[C@@H]1CCc2cc(C#N)ccc21)c1ccccc1	ZINC000591320376	459354280	/nfs/dbraw/zinc/35/42/80/459354280.db2.gz	HGBMUOODHPBTBZ-WOJBJXKFSA-N	0	3	333.435	3.355	20	30		EGEDHN
C=CC[C@@H](CO)CN[C@@H](C)c1ccc(OC)cc1Br	ZINC000538406349	459371282	/nfs/dbraw/zinc/37/12/82/459371282.db2.gz	AWOFLPQSMWJGCI-NWDGAFQWSA-N	0	3	328.250	3.293	20	30		EGEDHN
C=CCCC[C@H](C)NC(=O)NCC1(N(C)C)Cc2ccccc2C1	ZINC000540488087	459382411	/nfs/dbraw/zinc/38/24/11/459382411.db2.gz	RGQIDGLIFKQHBA-INIZCTEOSA-N	0	3	329.488	3.130	20	30		EGEDHN
CN(CC(=O)NC1(C#N)CCC1)[C@@H]1CCCC[C@@H]1c1ccccc1	ZINC000560725216	459391078	/nfs/dbraw/zinc/39/10/78/459391078.db2.gz	XHLCYLLTGGEVJY-QZTJIDSGSA-N	0	3	325.456	3.207	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)[C@H](C)N1CCC(Cc2ccccc2)CC1	ZINC000484286574	459410985	/nfs/dbraw/zinc/41/09/85/459410985.db2.gz	BFPOVFAIJLUPEX-ROUUACIJSA-N	0	3	341.499	3.338	20	30		EGEDHN
N#Cc1ccccc1OCCN1CC[C@]2(C1)CCc1ccccc1O2	ZINC000569208858	459413756	/nfs/dbraw/zinc/41/37/56/459413756.db2.gz	KVVQEIPOMLTLFA-NRFANRHFSA-N	0	3	334.419	3.407	20	30		EGEDHN
CC(C)(C)c1ccc(OC[C@@H](O)CN2CCC(CC#N)CC2)cc1	ZINC000541020808	459419117	/nfs/dbraw/zinc/41/91/17/459419117.db2.gz	QHYNQKHHGCSTFX-SFHVURJKSA-N	0	3	330.472	3.349	20	30		EGEDHN
C=CCC1(NCC(=O)Nc2cc(C(=O)OC)ccc2C)CCCC1	ZINC000595780219	459436968	/nfs/dbraw/zinc/43/69/68/459436968.db2.gz	LAHWFUOBZRHBCM-UHFFFAOYSA-N	0	3	330.428	3.199	20	30		EGEDHN
CN1CCN(c2ccc3cc(C#N)ccc3n2)C[C@H]1Cc1ccccc1	ZINC000561426344	459451350	/nfs/dbraw/zinc/45/13/50/459451350.db2.gz	VHFQTXJWZVASOC-HXUWFJFHSA-N	0	3	342.446	3.470	20	30		EGEDHN
N#CCC[C@H](NC(=O)NC[C@@H]1NCCc2ccccc21)c1ccccc1	ZINC000582954101	459457258	/nfs/dbraw/zinc/45/72/58/459457258.db2.gz	SJDPAMNLAOLHTR-PMACEKPBSA-N	0	3	348.450	3.218	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2ccc(C#Cc3ccccc3)cc2)CCN1C	ZINC000525618156	459468443	/nfs/dbraw/zinc/46/84/43/459468443.db2.gz	LKKSKZNEQYUVMV-DYESRHJHSA-N	0	3	332.447	3.299	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CCC(F)(F)[C@@H](C)C1	ZINC000562046955	459505756	/nfs/dbraw/zinc/50/57/56/459505756.db2.gz	RRHWRGBVXJEECS-HOCLYGCPSA-N	0	3	325.399	3.132	20	30		EGEDHN
N#CCC1CCN(Cc2cccc(C(=O)N3CCCCC3)c2)CC1	ZINC000541954352	459513547	/nfs/dbraw/zinc/51/35/47/459513547.db2.gz	LCDWDNUNAFHEPC-UHFFFAOYSA-N	0	3	325.456	3.438	20	30		EGEDHN
N#Cc1[n-]c(=NCC2CC[NH+](Cc3ccccc3)CC2)sc1Cl	ZINC000596093026	459517062	/nfs/dbraw/zinc/51/70/62/459517062.db2.gz	ZISVABKZNXNCDV-UHFFFAOYSA-N	0	3	346.887	3.414	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)NC[C@H](c1ccc(CC)cc1)N(CC)CC	ZINC000562187527	459517166	/nfs/dbraw/zinc/51/71/66/459517166.db2.gz	ZAOOOCSMIKQDLM-QUCCMNQESA-N	0	3	332.488	3.075	20	30		EGEDHN
C=CCn1c(C2CCCC2)nnc1N1CCN([C@@H]2C[C@@H]2C)C[C@H](C)C1	ZINC000569901407	459527314	/nfs/dbraw/zinc/52/73/14/459527314.db2.gz	LXFXJPGFPIRDNJ-XYJFISCASA-N	0	3	343.519	3.288	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CCC[C@@H](CC#N)C1)C(C)C	ZINC000596139351	459534421	/nfs/dbraw/zinc/53/44/21/459534421.db2.gz	ROESGNOMLXLMTP-ZWKOTPCHSA-N	0	3	332.492	3.020	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1F)c1nc(C#N)c(Cl)s1	ZINC000596158167	459542461	/nfs/dbraw/zinc/54/24/61/459542461.db2.gz	RXNRAUYBWOCVNQ-UHFFFAOYSA-N	0	3	338.839	3.375	20	30		EGEDHN
Cc1cccc([C@@H]2CCN(C[C@@H](O)COc3ccc(C#N)cc3)C2)c1	ZINC000542319772	459547934	/nfs/dbraw/zinc/54/79/34/459547934.db2.gz	KBUUOOOFCDOXKN-WOJBJXKFSA-N	0	3	336.435	3.096	20	30		EGEDHN
C=C[C@@H]1CCCCN1C(=O)Nc1cccc(N2CCN(CC)CC2)c1	ZINC000488649442	459547981	/nfs/dbraw/zinc/54/79/81/459547981.db2.gz	WVCBESVBGVVWMV-GOSISDBHSA-N	0	3	342.487	3.401	20	30		EGEDHN
C[C@@H](Nc1nc(C#N)c(Cl)s1)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000596185940	459552213	/nfs/dbraw/zinc/55/22/13/459552213.db2.gz	HLRWLTDIFOPOAQ-TZMCWYRMSA-N	0	3	346.887	3.413	20	30		EGEDHN
N#CCc1ccc(OC[C@@H](O)CNCc2cc3ccccc3o2)cc1	ZINC000583824717	459603195	/nfs/dbraw/zinc/60/31/95/459603195.db2.gz	HJBSCELRGHDAEO-KRWDZBQOSA-N	0	3	336.391	3.028	20	30		EGEDHN
C#CCNC(=O)C1CCN(Cc2ccc(SC(C)C)cc2)CC1	ZINC000491201903	459604297	/nfs/dbraw/zinc/60/42/97/459604297.db2.gz	KVGMTOIQSJWLAN-UHFFFAOYSA-N	0	3	330.497	3.149	20	30		EGEDHN
CC[C@@H]1CN([C@@H](C)C(=O)NC2(C#N)CCC2)CC[C@H]1c1ccccc1	ZINC000527298026	459624436	/nfs/dbraw/zinc/62/44/36/459624436.db2.gz	LDSHHSMQXDRBFE-YQVWRLOYSA-N	0	3	339.483	3.453	20	30		EGEDHN
C#CCCN1CCC(NC(=O)/C=C\c2cccc3ccccc23)CC1	ZINC000491923357	459685078	/nfs/dbraw/zinc/68/50/78/459685078.db2.gz	DCKQWWPSVXWUJI-QXMHVHEDSA-N	0	3	332.447	3.457	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2NC[C@H](O)COCc1cccs1	ZINC000562998010	459689710	/nfs/dbraw/zinc/68/97/10/459689710.db2.gz	YPULXONXUPFAAI-QFBILLFUSA-N	0	3	342.464	3.164	20	30		EGEDHN
CCC1(c2ccccc2)CN(C(=O)C(C#N)Cc2ccc(C#N)cc2)C1	ZINC000563026349	459699726	/nfs/dbraw/zinc/69/97/26/459699726.db2.gz	MQCRKHYVVVQBCA-LJQANCHMSA-N	0	3	343.430	3.431	20	30		EGEDHN
C[C@H]1CN(C(=O)C(C#N)CCc2ccccc2)CC2(CCCC2)O1	ZINC000592904949	459717965	/nfs/dbraw/zinc/71/79/65/459717965.db2.gz	UNVJHMFXEWFNPQ-WMZOPIPTSA-N	0	3	326.440	3.319	20	30		EGEDHN
CN(C)[C@H](CNC(=O)CC1(C#N)CCCCC1)Cc1ccccc1	ZINC000596674592	459723675	/nfs/dbraw/zinc/72/36/75/459723675.db2.gz	JLXJAQXCCQMKJS-SFHVURJKSA-N	0	3	327.472	3.140	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CC[C@H](Oc2ccccc2)C1	ZINC000584471532	459748440	/nfs/dbraw/zinc/74/84/40/459748440.db2.gz	KJPMFQMVMSLFKB-QUCCMNQESA-N	0	3	334.419	3.439	20	30		EGEDHN
CN1CCN(CCCOc2cccc(C#N)c2)[C@@H](Cc2ccccc2)C1	ZINC000593090401	459769967	/nfs/dbraw/zinc/76/99/67/459769967.db2.gz	WQGDHDDIQBFWEP-NRFANRHFSA-N	0	3	349.478	3.186	20	30		EGEDHN
N#CCC1(CNC[C@@H](O)COc2ccc(-c3ccccc3)cc2)CC1	ZINC000564864423	459778302	/nfs/dbraw/zinc/77/83/02/459778302.db2.gz	NZJBIOPVANNOMF-LJQANCHMSA-N	0	3	336.435	3.377	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1N[C@@H](C)c1ccc(S(=O)(=O)C2CCCC2)cc1	ZINC000584702684	459785510	/nfs/dbraw/zinc/78/55/10/459785510.db2.gz	WAZCHUBVGNMJCZ-KYNGSXCRSA-N	0	3	349.496	3.397	20	30		EGEDHN
N#C[C@@H]1CCC[C@@H](N[C@H]2CCN(c3ccc(Cl)cc3F)C2=O)C1	ZINC000527992664	459790284	/nfs/dbraw/zinc/79/02/84/459790284.db2.gz	ZGVIBWXMBMNCGZ-KYOSRNDESA-N	0	3	335.810	3.256	20	30		EGEDHN
N#C[C@@H]1CCC[C@@H](N[C@@H]2CCN(c3ccc(Cl)cc3F)C2=O)C1	ZINC000527992674	459790628	/nfs/dbraw/zinc/79/06/28/459790628.db2.gz	ZGVIBWXMBMNCGZ-UXIGCNINSA-N	0	3	335.810	3.256	20	30		EGEDHN
Cc1c(C)n(Cc2ccco2)c(NC(=O)CN(C)C(C)(C)C)c1C#N	ZINC000584836791	459812232	/nfs/dbraw/zinc/81/22/32/459812232.db2.gz	SPKFQSPFJJGEJU-UHFFFAOYSA-N	0	3	342.443	3.287	20	30		EGEDHN
C[C@@H](NCC(=O)NCc1ccc(C#N)cc1)c1ccc2c(c1)CCCC2	ZINC000545504687	459836150	/nfs/dbraw/zinc/83/61/50/459836150.db2.gz	BVFFXLRBEAAKAH-MRXNPFEDSA-N	0	3	347.462	3.404	20	30		EGEDHN
CCC(C#N)C(=O)N(C)[C@H](C(=O)OC)c1cccc(Cl)c1Cl	ZINC000598428316	459897013	/nfs/dbraw/zinc/89/70/13/459897013.db2.gz	MVHKHSYESPTOAZ-RNCFNFMXSA-N	0	3	343.210	3.216	20	30		EGEDHN
C[C@@H](CNC(=O)c1cc2ccccc2n1CC#N)N1CCCC[C@H]1C	ZINC000609163429	459916765	/nfs/dbraw/zinc/91/67/65/459916765.db2.gz	LEVDFVHBAAMFRJ-CVEARBPZSA-N	0	3	338.455	3.158	20	30		EGEDHN
C[C@@H](CNC(=O)c1cc2ccccc2n1CC#N)N1CCC[C@@H](C)C1	ZINC000609163462	459916859	/nfs/dbraw/zinc/91/68/59/459916859.db2.gz	MHDJDQYDKCRCEK-CVEARBPZSA-N	0	3	338.455	3.015	20	30		EGEDHN
CC(C)(CNC(=O)CCCCCC#N)N1CCc2ccccc2C1	ZINC000588149570	459918893	/nfs/dbraw/zinc/91/88/93/459918893.db2.gz	BAUFKHASAWFCIQ-UHFFFAOYSA-N	0	3	327.472	3.414	20	30		EGEDHN
COCCN(Cc1ccc(F)c(Cl)c1)C[C@H](O)CC(C)(C)C#N	ZINC000598619556	459965253	/nfs/dbraw/zinc/96/52/53/459965253.db2.gz	DYLKDIKVZYMDLD-CQSZACIVSA-N	0	3	342.842	3.228	20	30		EGEDHN
C[C@H]1C[C@@H](NC2CCN(Cc3cccc(C#N)c3)CC2)c2nccn21	ZINC000593724688	459965509	/nfs/dbraw/zinc/96/55/09/459965509.db2.gz	GOSAKHWOQCROMA-HNAYVOBHSA-N	0	3	335.455	3.015	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN1CC2(CCOCC2)[C@@H]1c1ccccc1	ZINC000598623194	459966284	/nfs/dbraw/zinc/96/62/84/459966284.db2.gz	VMMYLELXCMVNMU-ROUUACIJSA-N	0	3	328.456	3.141	20	30		EGEDHN
CCOC(=O)c1ccc(CNCCSCc2ccccc2C#N)[nH]1	ZINC000602509093	459974715	/nfs/dbraw/zinc/97/47/15/459974715.db2.gz	BHYHAJASKHHTFX-UHFFFAOYSA-N	0	3	343.452	3.086	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CNCc1cc(F)c(C(F)(F)F)cc1F	ZINC000598728323	460008579	/nfs/dbraw/zinc/00/85/79/460008579.db2.gz	QLZJBKHCEPQFPK-JTQLQIEISA-N	0	3	336.304	3.374	20	30		EGEDHN
CC(C)(C)CCOc1cnccc1CNC[C@H](O)CC(C)(C)C#N	ZINC000598727215	460008796	/nfs/dbraw/zinc/00/87/96/460008796.db2.gz	DXTPKROPAQGFGW-MRXNPFEDSA-N	0	3	333.476	3.287	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CC[C@](CO)(Cc2ccc(F)cc2)C1	ZINC000588984936	460015768	/nfs/dbraw/zinc/01/57/68/460015768.db2.gz	UZQVCGCINKOCQY-NRFANRHFSA-N	0	3	338.426	3.433	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)C(=O)NC[C@H](C)N1CCCC[C@H]1C	ZINC000593963471	460031026	/nfs/dbraw/zinc/03/10/26/460031026.db2.gz	NNUYBVGOPSBSBZ-ZACQAIPSSA-N	0	3	327.472	3.116	20	30		EGEDHN
C[C@H](CCC#N)CN(CCO)Cc1ccc(Br)s1	ZINC000602628395	460031798	/nfs/dbraw/zinc/03/17/98/460031798.db2.gz	AQRIGSSQSSWNAU-LLVKDONJSA-N	0	3	331.279	3.245	20	30		EGEDHN
C[C@H](CCC#N)CNc1ccc(C(=O)N(C)[C@H]2CCCN(C)C2)cc1	ZINC000602656487	460047435	/nfs/dbraw/zinc/04/74/35/460047435.db2.gz	YSDCPWIKFMNOII-APWZRJJASA-N	0	3	342.487	3.205	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)Cc1ccc2nccnc2c1	ZINC000602659189	460048217	/nfs/dbraw/zinc/04/82/17/460048217.db2.gz	JOVMJUBRCLVGCV-UHFFFAOYSA-N	0	3	345.450	3.065	20	30		EGEDHN
CCN(Cc1cccc(C(=O)OC)c1C#N)[C@@H]1CCOC(C)(C)C1	ZINC000589274642	460066842	/nfs/dbraw/zinc/06/68/42/460066842.db2.gz	DTDFDEZSEUVMEI-OAHLLOKOSA-N	0	3	330.428	3.124	20	30		EGEDHN
COc1cccc([C@H](CN[C@H](C)CC2(C#N)CCOCC2)OC)c1	ZINC000602720664	460084189	/nfs/dbraw/zinc/08/41/89/460084189.db2.gz	KPGRONPGVMOBEV-QAPCUYQASA-N	0	3	332.444	3.071	20	30		EGEDHN
CC(C)(C)n1cc(C#N)cc1NC(=O)N[C@H]1CCCN2CCCC[C@@H]12	ZINC000594095692	460099272	/nfs/dbraw/zinc/09/92/72/460099272.db2.gz	BYUCIJLIEHHYFB-HOTGVXAUSA-N	0	3	343.475	3.253	20	30		EGEDHN
C=CCOc1c(Cl)cc(CNC[C@@](C)(O)CSC)cc1OC	ZINC000598965974	460107634	/nfs/dbraw/zinc/10/76/34/460107634.db2.gz	QHJCFGQLXCYDPA-MRXNPFEDSA-N	0	3	345.892	3.117	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H](C)OCc2ccccc2C)CC1	ZINC000625323143	460128103	/nfs/dbraw/zinc/12/81/03/460128103.db2.gz	OYANCAUYGYGDDZ-QGZVFWFLSA-N	0	3	330.472	3.057	20	30		EGEDHN
C[C@@H](CNC(=O)N[C@@H](C)c1cccc(C#N)c1)N1CCCC[C@H]1C	ZINC000610347630	460128730	/nfs/dbraw/zinc/12/87/30/460128730.db2.gz	XFGNRGZMXVDKKH-PMPSAXMXSA-N	0	3	328.460	3.181	20	30		EGEDHN
COc1ccc([C@@H](CN2CCCC2)NC(=O)CCCCCC#N)cc1	ZINC000589844225	460150009	/nfs/dbraw/zinc/15/00/09/460150009.db2.gz	PSPCWAFOYQVBLO-LJQANCHMSA-N	0	3	343.471	3.422	20	30		EGEDHN
COc1ccc(C2(NCc3ccc(C#N)s3)CCOCC2)cc1	ZINC000610512281	460172232	/nfs/dbraw/zinc/17/22/32/460172232.db2.gz	OSLZWGUZHSIHBM-UHFFFAOYSA-N	0	3	328.437	3.424	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]([C@H]2CCCO2)C2(CO)CCC2)c(Cl)c1	ZINC000602889873	460173209	/nfs/dbraw/zinc/17/32/09/460173209.db2.gz	FLOUXZVXFRUKCX-SJORKVTESA-N	0	3	334.847	3.011	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)C(=O)N1CCC[C@H]1CN1CCCCC1	ZINC000594277808	460178348	/nfs/dbraw/zinc/17/83/48/460178348.db2.gz	NPBJEPKQNGCEFM-PXNSSMCTSA-N	0	3	339.483	3.214	20	30		EGEDHN
CC[C@@H]1CCCCN1CCNC(=O)N[C@@H]1CCc2cc(C#N)ccc21	ZINC000618816224	460186744	/nfs/dbraw/zinc/18/67/44/460186744.db2.gz	KDVPRIHWNSFCSC-IEBWSBKVSA-N	0	3	340.471	3.109	20	30		EGEDHN
CN(C[C@H](O)COc1cc(Cl)cc(Cl)c1)[C@@H]1CC[C@H](C#N)C1	ZINC000602924594	460187813	/nfs/dbraw/zinc/18/78/13/460187813.db2.gz	GHICDIALGHSVFR-GLQYFDAESA-N	0	3	343.254	3.357	20	30		EGEDHN
CCN(C[C@@H](O)COc1ccccc1C#N)[C@H](C)c1ccc(C#N)cc1	ZINC000599270437	460212088	/nfs/dbraw/zinc/21/20/88/460212088.db2.gz	JPBLBXLWFGLXHE-OXQOHEQNSA-N	0	3	349.434	3.253	20	30		EGEDHN
CC[C@H](C)[C@H](NC(=O)[C@@H](N)CCCCC#N)c1nc2ccccc2[nH]1	ZINC000594441171	460221063	/nfs/dbraw/zinc/22/10/63/460221063.db2.gz	OCMWIAYVZIRUBR-ZQIUZPCESA-N	0	3	341.459	3.178	20	30		EGEDHN
Cc1cc(C)cc(-c2nnc(NC(=O)[C@@H](N)CCCCC#N)s2)c1	ZINC000594443490	460222815	/nfs/dbraw/zinc/22/28/15/460222815.db2.gz	IJFBRYJIBXXWPB-AWEZNQCLSA-N	0	3	343.456	3.172	20	30		EGEDHN
C[C@@H](NC(=O)N(CCN(C)C)C1CCCC1)c1cccc(C#N)c1	ZINC000610720788	460224840	/nfs/dbraw/zinc/22/48/40/460224840.db2.gz	ZCOHHIZFTOKJJP-OAHLLOKOSA-N	0	3	328.460	3.135	20	30		EGEDHN
Cc1ccc(CN2CC[C@H](CN(C)c3ncc(C#N)cc3F)C2)s1	ZINC000603403745	460298668	/nfs/dbraw/zinc/29/86/68/460298668.db2.gz	XYZXUPPFKXEYDT-CQSZACIVSA-N	0	3	344.459	3.421	20	30		EGEDHN
COc1cc(C#N)ccc1CN1C[C@@H]2CN(c3ccccc3)C[C@H]2C1	ZINC000611235481	460313755	/nfs/dbraw/zinc/31/37/55/460313755.db2.gz	GXQDBZFKCFTFFN-RTBURBONSA-N	0	3	333.435	3.135	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Nc1cccc(C#N)c1)C(C)C	ZINC000603645321	460331008	/nfs/dbraw/zinc/33/10/08/460331008.db2.gz	KBZIEEVWVQSDPI-GOSISDBHSA-N	0	3	326.444	3.378	20	30		EGEDHN
C[C@@H](NC[C@@H](O)COc1ccc(Cl)cc1)c1cccc(C#N)c1	ZINC000611387280	460351259	/nfs/dbraw/zinc/35/12/59/460351259.db2.gz	JFPMNWMHSMTUJN-CXAGYDPISA-N	0	3	330.815	3.302	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2N[C@@H]1CCN(Cc2ccccc2)C1=O	ZINC000611393761	460353866	/nfs/dbraw/zinc/35/38/66/460353866.db2.gz	VULDIWFSBIULTL-NHCUHLMSSA-N	0	3	345.446	3.326	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)NC[C@H]1Cc2ccccc21)C(C)C	ZINC000615681538	460372767	/nfs/dbraw/zinc/37/27/67/460372767.db2.gz	ALCPQEOOAHMQST-QUCCMNQESA-N	0	3	341.499	3.324	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(Cc3cccc4n[nH]cc43)CC2)cc1	ZINC000600105420	460383475	/nfs/dbraw/zinc/38/34/75/460383475.db2.gz	QCXDRTRKIFAQIF-UHFFFAOYSA-N	0	3	345.450	3.142	20	30		EGEDHN
COC(=O)COc1ccc(CNCc2ccc(C#N)c(Cl)c2)cc1	ZINC000619847276	460455090	/nfs/dbraw/zinc/45/50/90/460455090.db2.gz	MDMCQAJMJGJCMN-UHFFFAOYSA-N	0	3	344.798	3.053	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@@H]2CCCC[C@H]2O)cc1OC	ZINC000623418240	460537863	/nfs/dbraw/zinc/53/78/63/460537863.db2.gz	ILMKVMIZKBCVAV-HUUCEWRRSA-N	0	3	325.836	3.307	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)N1CCC[C@@](C)(C#N)C1)c1ccsc1	ZINC000612100111	460540962	/nfs/dbraw/zinc/54/09/62/460540962.db2.gz	ZDQRUDISBCRQNJ-AEFFLSMTSA-N	0	3	348.516	3.466	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CC[C@@H](c2ccco2)C1)C(C)C	ZINC000601255779	460766766	/nfs/dbraw/zinc/76/67/66/460766766.db2.gz	RKYZVLHOGOSIBY-QZTJIDSGSA-N	0	3	345.487	3.477	20	30		EGEDHN
C[C@@H](NCc1ccnc(N2CCSCC2)c1)c1ccc(C#N)cc1	ZINC000601302791	460781664	/nfs/dbraw/zinc/78/16/64/460781664.db2.gz	VUAWSGKAIYZDIT-OAHLLOKOSA-N	0	3	338.480	3.357	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2ccccc2CC#N)CN1Cc1ccccc1	ZINC000601308909	460783692	/nfs/dbraw/zinc/78/36/92/460783692.db2.gz	GXAXSSBBMGCZSL-APWZRJJASA-N	0	3	333.435	3.145	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CCN(C(=O)c2ccccc2CC#N)C1	ZINC000601617463	460848035	/nfs/dbraw/zinc/84/80/35/460848035.db2.gz	REYWIWNQYCORDA-GOSISDBHSA-N	0	3	347.462	3.347	20	30		EGEDHN
C[C@@H](NCCn1ccc(C(F)(F)F)n1)c1ccc(C#N)c(F)c1	ZINC000601965118	460964091	/nfs/dbraw/zinc/96/40/91/460964091.db2.gz	VAEWSRBNBDDBMZ-SNVBAGLBSA-N	0	3	326.297	3.263	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN1CCC[C@H](C(=O)c2ccc(F)cc2)C1	ZINC000621258659	460964700	/nfs/dbraw/zinc/96/47/00/460964700.db2.gz	UREYTFWIHNTFRI-DOTOQJQBSA-N	0	3	332.419	3.021	20	30		EGEDHN
C[C@@H](C[C@@H]1CCCC(=O)N1)NCC#Cc1ccc(C(F)(F)F)cc1	ZINC000638897348	461643447	/nfs/dbraw/zinc/64/34/47/461643447.db2.gz	GVEABNGEYRTQAU-BBRMVZONSA-N	0	3	338.373	3.094	20	30		EGEDHN
C=C(C)CN1CCC(Nc2cc(OC)ncc2Br)CC1	ZINC000663567902	461707191	/nfs/dbraw/zinc/70/71/91/461707191.db2.gz	LTVZUZYHPZTFQJ-UHFFFAOYSA-N	0	3	340.265	3.305	20	30		EGEDHN
C=C(C)CN1CCC(Nc2nnc(-c3ccc(OC)cc3)o2)CC1	ZINC000656471386	461757766	/nfs/dbraw/zinc/75/77/66/461757766.db2.gz	XXALFCYWZSEUFG-UHFFFAOYSA-N	0	3	328.416	3.198	20	30		EGEDHN
C=CCCC(C)(C)NC(=O)NCC1CCN(c2ccncc2)CC1	ZINC000664577646	462113659	/nfs/dbraw/zinc/11/36/59/462113659.db2.gz	TUAOUCPFFJLMKS-UHFFFAOYSA-N	0	3	330.476	3.342	20	30		EGEDHN
C=CCC(C)(C)CNC(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000661232989	462162703	/nfs/dbraw/zinc/16/27/03/462162703.db2.gz	SGGCHQXFDHTVOU-UHFFFAOYSA-N	0	3	344.503	3.195	20	30		EGEDHN
C=CCN(C[C@H](O)COc1cccc2ccccc21)[C@@H](C)COC	ZINC000661248175	462169746	/nfs/dbraw/zinc/16/97/46/462169746.db2.gz	SVZZDSYKKPJAIC-WMZOPIPTSA-N	0	3	329.440	3.102	20	30		EGEDHN
C=CC[C@@H]1CCCN(CC(=O)NCCc2nc3ccccc3s2)C1	ZINC000661380837	462224503	/nfs/dbraw/zinc/22/45/03/462224503.db2.gz	QLBOCSZAONAISX-OAHLLOKOSA-N	0	3	343.496	3.243	20	30		EGEDHN
C=CCN(CCc1ccco1)C(=O)N[C@H]1CCCN2CCCC[C@H]12	ZINC000654731988	462359678	/nfs/dbraw/zinc/35/96/78/462359678.db2.gz	QIVJFMKVYUGFFZ-ZWKOTPCHSA-N	0	3	331.460	3.037	20	30		EGEDHN
Cc1oc(NC(=O)[C@@H](C)N[C@@H]2CC(C)(C)OC2(C)C)c(C#N)c1C	ZINC000132529571	534548708	/nfs/dbraw/zinc/54/87/08/534548708.db2.gz	GKCQPUFLSJIVSM-BXUZGUMPSA-N	0	3	333.432	3.031	20	30		EGEDHN
C=CCN1CCC(NC(=O)CSCc2ccc(Cl)cc2)CC1	ZINC000171727285	526422455	/nfs/dbraw/zinc/42/24/55/526422455.db2.gz	XCMOSMIMCKCCSY-UHFFFAOYSA-N	0	3	338.904	3.340	20	30		EGEDHN
C=CCN1CCC(NC(=O)C[C@@H](CC)c2ccc(OC)cc2)CC1	ZINC000178541217	526424507	/nfs/dbraw/zinc/42/45/07/526424507.db2.gz	KIKNJZFPOCNEII-MRXNPFEDSA-N	0	3	330.472	3.346	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(CC)[C@@H](C)Cc2ccsc2)CC1	ZINC000187040620	526425211	/nfs/dbraw/zinc/42/52/11/526425211.db2.gz	MZYPSBSRLGTNSG-HNNXBMFYSA-N	0	3	335.517	3.361	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCC2(c3ccccc3)CCC2)CC1	ZINC000171706319	526432494	/nfs/dbraw/zinc/43/24/94/526432494.db2.gz	YEOVADUQLWJBNW-UHFFFAOYSA-N	0	3	327.472	3.058	20	30		EGEDHN
C=CCN1CCC(N[C@H](C)c2ncc(Br)cc2F)CC1	ZINC000187178036	526454480	/nfs/dbraw/zinc/45/44/80/526454480.db2.gz	YEFIAYBLLIIZRS-LLVKDONJSA-N	0	3	342.256	3.284	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc3c(c2)CCCO3)CC1	ZINC000171587978	526595358	/nfs/dbraw/zinc/59/53/58/526595358.db2.gz	TXGBXNSFOHBNHR-UHFFFAOYSA-N	0	3	329.444	3.174	20	30		EGEDHN
C=C(C)[C@H](N[C@@H](C)C1CCS(=O)(=O)CC1)c1ccc(F)c(F)c1	ZINC000187567773	526821957	/nfs/dbraw/zinc/82/19/57/526821957.db2.gz	JEXGJCWQKKEHED-SJCJKPOMSA-N	0	3	343.439	3.385	20	30		EGEDHN
C=CCNC(=O)[C@@H](C)N1CCC(CCc2ccc(OCC)cc2)CC1	ZINC000671310808	548277208	/nfs/dbraw/zinc/27/72/08/548277208.db2.gz	YFMLLMGSQFAIHY-QGZVFWFLSA-N	0	3	344.499	3.421	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@H](C)N1CC[C@@H](N(C)Cc2ccccc2)C1	ZINC000674252207	548712673	/nfs/dbraw/zinc/71/26/73/548712673.db2.gz	XTKCQXJYSYRUNX-AZUAARDMSA-N	0	3	343.515	3.006	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNCc1nn(C)c2ccccc12)C(C)C	ZINC000674711222	548786354	/nfs/dbraw/zinc/78/63/54/548786354.db2.gz	WBAHDTROQVZCAL-HXUWFJFHSA-N	0	3	326.488	3.362	20	30		EGEDHN
CCC(=O)N[C@@H](C)C(=O)C(C#N)c1nc(-c2ccc(C)cc2)cs1	ZINC000729069956	574810628	/nfs/dbraw/zinc/81/06/28/574810628.db2.gz	JKRDZPOFOIAWFU-GXTWGEPZSA-N	0	3	341.436	3.210	20	30		EGEDHN
C#CCCN1CCC(NC(=O)C(C)(C)Oc2ccc(Cl)cc2)CC1	ZINC000740737795	574812048	/nfs/dbraw/zinc/81/20/48/574812048.db2.gz	XFVJDPXNFOBTMR-UHFFFAOYSA-N	0	3	348.874	3.101	20	30		EGEDHN
Cc1ccc(N=NC2CCN(CCc3ccc(F)cc3)CC2)nn1	ZINC000729937910	574897655	/nfs/dbraw/zinc/89/76/55/574897655.db2.gz	KZKXKNCNTASTQC-UHFFFAOYSA-N	0	3	327.407	3.031	20	30		EGEDHN
C#Cc1cccc(NC(=S)N2C[C@H](N(C)C)Cc3ccccc32)c1	ZINC000731489894	575076595	/nfs/dbraw/zinc/07/65/95/575076595.db2.gz	HWAOZEICPSYLET-GOSISDBHSA-N	0	3	335.476	3.358	20	30		EGEDHN
N#CC(C(=O)CC[C@@H]1CCCCO1)C(=O)Nc1ccccc1Cl	ZINC000732494446	575272338	/nfs/dbraw/zinc/27/23/38/575272338.db2.gz	HGPNCCLGBRLWPH-STQMWFEESA-N	0	3	334.803	3.337	20	30		EGEDHN
C=CC[C@H](NC(=O)NC[C@H](C)N1CCC[C@@H](C)C1)c1ccncc1	ZINC000734658561	575532706	/nfs/dbraw/zinc/53/27/06/575532706.db2.gz	JJNWOMABWVLMHW-RYRKJORJSA-N	0	3	330.476	3.118	20	30		EGEDHN
C=CC[C@H](NC(=O)N1CCCN(C(C)(C)C)CC1)c1ccncc1	ZINC000734678804	575540962	/nfs/dbraw/zinc/54/09/62/575540962.db2.gz	IOVCOUJWNHDKHD-KRWDZBQOSA-N	0	3	330.476	3.215	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN[C@@H](C)c2ccc3[nH]c(=O)[nH]c3c2)cc1	ZINC000740897823	576635165	/nfs/dbraw/zinc/63/51/65/576635165.db2.gz	GALFSIZMFNTMGX-OLZOCXBDSA-N	0	3	336.395	3.410	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccccc1SCC#N)N1CCC(C)CC1	ZINC000742401836	576780021	/nfs/dbraw/zinc/78/00/21/576780021.db2.gz	VODHHAQPLPXOJH-HNNXBMFYSA-N	0	3	331.485	3.152	20	30		EGEDHN
C#CCOc1cc(F)ccc1NC(=O)NC[C@@H](C)N1CCC[C@@H](C)C1	ZINC000743195588	576803010	/nfs/dbraw/zinc/80/30/10/576803010.db2.gz	YJZGJLCWCNGYAN-HUUCEWRRSA-N	0	3	347.434	3.080	20	30		EGEDHN
C#CCSCCNCc1cc(Cl)ccc1OC[C@@H]1CCCO1	ZINC000743497091	576810448	/nfs/dbraw/zinc/81/04/48/576810448.db2.gz	GHZOWVPBFGYSOQ-INIZCTEOSA-N	0	3	339.888	3.354	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N[C@H]1CC[C@H](SC)C1)C(C)C	ZINC000745537861	576849518	/nfs/dbraw/zinc/84/95/18/576849518.db2.gz	WEKFNVRLLDXPFN-YESZJQIVSA-N	0	3	339.549	3.268	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)CCc1ccc(Cl)s1	ZINC000049253798	1291624971	/nfs/dbraw/zinc/62/49/71/1291624971.db2.gz	HCUQSLVPPFWWDX-GFCCVEGCSA-N	0	3	326.849	3.349	20	30		EGEDHN
Cc1ccc(OCCC(=O)C(C#N)C(=O)NC2CCCCC2)c(C)c1	ZINC000050683898	1291655528	/nfs/dbraw/zinc/65/55/28/1291655528.db2.gz	TUPXPZZIMZNJPD-KRWDZBQOSA-N	0	3	342.439	3.230	20	30		EGEDHN
N#CC(C(=O)CCc1cc(F)ccc1F)C(=O)NC1CCCCC1	ZINC000066507677	1292119690	/nfs/dbraw/zinc/11/96/90/1292119690.db2.gz	XQNJHCGSQGRNCP-HNNXBMFYSA-N	0	3	334.366	3.055	20	30		EGEDHN
C=CCSc1nc2ccccc2n1CN1CCC2(CC1)OCCO2	ZINC000075581680	1292399078	/nfs/dbraw/zinc/39/90/78/1292399078.db2.gz	JQXAIJIAAUVYOZ-UHFFFAOYSA-N	0	3	345.468	3.111	20	30		EGEDHN
C#CC[C@H](NC[C@@H]1CN(C2CCCCC2)C(=O)O1)c1ccccc1	ZINC000828154980	1292437147	/nfs/dbraw/zinc/43/71/47/1292437147.db2.gz	IASBCSJWSHYAIU-MOPGFXCFSA-N	0	3	326.440	3.494	20	30		EGEDHN
Cc1cc(CN[C@H](C)c2ccc(N3CCNC3=O)cc2)ccc1C#N	ZINC000829750794	1292613480	/nfs/dbraw/zinc/61/34/80/1292613480.db2.gz	DMVAAINNEOGOEU-OAHLLOKOSA-N	0	3	334.423	3.247	20	30		EGEDHN
COc1cc(Cl)c(C)cc1NC(=O)C(C#N)C(=O)[C@H](C)SC	ZINC000103330095	1293002667	/nfs/dbraw/zinc/00/26/67/1293002667.db2.gz	PXOVDBUITBSDCY-VHSXEESVSA-N	0	3	340.832	3.056	20	30		EGEDHN
C[C@@H](CSc1ccccc1)C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000111945983	1293113448	/nfs/dbraw/zinc/11/34/48/1293113448.db2.gz	OMXAMSFTDCIQAW-ZFWWWQNUSA-N	0	3	339.420	3.157	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1[NH2+][C@@H](C)c1cc(Br)cc(C)c1[O-]	ZINC000834890236	1293165273	/nfs/dbraw/zinc/16/52/73/1293165273.db2.gz	ZHTOXKGVVKLRJY-GDLCADMTSA-N	0	3	326.234	3.457	20	30		EGEDHN
C=CCC[C@@H](CO)[NH2+][C@H](C)c1cc(Br)cc(C)c1[O-]	ZINC000834903963	1293171246	/nfs/dbraw/zinc/17/12/46/1293171246.db2.gz	LTTIWAWRELEHIV-YPMHNXCESA-N	0	3	328.250	3.441	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)C(C#N)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000119627512	1293280571	/nfs/dbraw/zinc/28/05/71/1293280571.db2.gz	AJRHPXKPWFCGPW-ZYHUDNBSSA-N	0	3	338.766	3.108	20	30		EGEDHN
N#CC(C(=O)Cn1ccc2ccc(Cl)cc21)C(=O)NC1CCCC1	ZINC000121455930	1293372397	/nfs/dbraw/zinc/37/23/97/1293372397.db2.gz	BUZNAZQJADAJFI-HNNXBMFYSA-N	0	3	343.814	3.062	20	30		EGEDHN
CCc1ccccc1OCC(=O)C(C#N)C(=O)Nc1cccc(C)c1	ZINC000127665012	1293570373	/nfs/dbraw/zinc/57/03/73/1293570373.db2.gz	AIXHEMHDXDWJPV-QGZVFWFLSA-N	0	3	336.391	3.284	20	30		EGEDHN
Cc1noc(C)c1CC(=O)C(C#N)C(=O)Nc1cccc2ccccc21	ZINC000128786241	1293604654	/nfs/dbraw/zinc/60/46/54/1293604654.db2.gz	PWSKADJVBHDLLW-KRWDZBQOSA-N	0	3	347.374	3.335	20	30		EGEDHN
Cc1nn(C(F)F)c(C)c1CC(=O)C(C#N)c1nc2ccccc2o1	ZINC000143235330	1293862537	/nfs/dbraw/zinc/86/25/37/1293862537.db2.gz	NDKOEHYVEADHSE-GFCCVEGCSA-N	0	3	344.321	3.455	20	30		EGEDHN
C#CCOc1ccc(CNc2ccc(N3CCN(C)CC3)cc2)cc1	ZINC000158145862	1294196886	/nfs/dbraw/zinc/19/68/86/1294196886.db2.gz	PPNIXBKXOMHAKQ-UHFFFAOYSA-N	0	3	335.451	3.063	20	30		EGEDHN
Cc1noc(C)c1[C@H](C)C(=O)C(C#N)C(=O)Nc1cccc(C)c1	ZINC000159762649	1294246245	/nfs/dbraw/zinc/24/62/45/1294246245.db2.gz	DPBNESZZRZHDOB-XHDPSFHLSA-N	0	3	325.368	3.051	20	30		EGEDHN
C#CCOc1ccc([C@H](C)N[C@H](C)C(=O)NCc2ccccc2)cc1	ZINC000161190278	1294286504	/nfs/dbraw/zinc/28/65/04/1294286504.db2.gz	MHFIYMKOBRYKAD-DLBZAZTESA-N	0	3	336.435	3.054	20	30		EGEDHN
C[C@H](OC1CCCCCC1)C(=O)C(C#N)C(=O)NCc1ccccc1	ZINC000162392920	1294314947	/nfs/dbraw/zinc/31/49/47/1294314947.db2.gz	AVNJWXRFOJIYJM-YJBOKZPZSA-N	0	3	342.439	3.140	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)C(=O)Nc1ccccn1)c1ccccc1F	ZINC000170673421	1294376647	/nfs/dbraw/zinc/37/66/47/1294376647.db2.gz	KGWCNTQRUOTMBJ-JSGCOSHPSA-N	0	3	325.343	3.062	20	30		EGEDHN
C[C@H](CC(=O)C(C#N)C(=O)NC1CC1)c1ccccc1C(F)(F)F	ZINC000173975038	1294475289	/nfs/dbraw/zinc/47/52/89/1294475289.db2.gz	TZFIPNALVIWGJP-MFKMUULPSA-N	0	3	338.329	3.186	20	30		EGEDHN
C=CCOCCCC(=O)C(C#N)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000173979762	1294475603	/nfs/dbraw/zinc/47/56/03/1294475603.db2.gz	DHPMVMGFFARBCI-LBPRGKRZSA-N	0	3	338.766	3.109	20	30		EGEDHN
Cc1nc(CCCC(=O)C(C#N)C(=O)Nc2cccc(C)c2)cs1	ZINC000175104359	1294540496	/nfs/dbraw/zinc/54/04/96/1294540496.db2.gz	MWZYQDOJMHHHCE-MRXNPFEDSA-N	0	3	341.436	3.430	20	30		EGEDHN
COc1ccc(CN(C)[C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1C#N	ZINC000179225837	1294780090	/nfs/dbraw/zinc/78/00/90/1294780090.db2.gz	XKFHTBLLSLPVHZ-INIZCTEOSA-N	0	3	345.443	3.008	20	30		EGEDHN
N#CC(C(=O)CCc1ccco1)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000193475381	1295874470	/nfs/dbraw/zinc/87/44/70/1295874470.db2.gz	JZOJOPMVGYTVEZ-GFCCVEGCSA-N	0	3	334.734	3.352	20	30		EGEDHN
C#CCOc1ccc(CNc2ccc(N3CCN(C)CC3)cc2C)cc1	ZINC000237041610	1296217215	/nfs/dbraw/zinc/21/72/15/1296217215.db2.gz	XEKWYEHVYAWMGB-UHFFFAOYSA-N	0	3	349.478	3.371	20	30		EGEDHN
N#CC(C(=O)NC1CCCC1)C(=O)[C@H]1C[C@@]12CCCc1ccccc12	ZINC000246661512	1296365592	/nfs/dbraw/zinc/36/55/92/1296365592.db2.gz	XRUQTPWASHTFLC-YRISNDGFSA-N	0	3	336.435	3.048	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)Nc2cc(CC#N)ccn2)C1	ZINC000871721044	1296499736	/nfs/dbraw/zinc/49/97/36/1296499736.db2.gz	IXKOUBOMPZSSSP-CRAIPNDOSA-N	0	3	349.438	3.105	20	30		EGEDHN
C[C@H]([NH2+]C1CCN(c2ccc(C#N)cn2)CC1)c1cccc([O-])c1F	ZINC000872032704	1296681653	/nfs/dbraw/zinc/68/16/53/1296681653.db2.gz	YGMJGTFJXRFIEO-ZDUSSCGKSA-N	0	3	340.402	3.118	20	30		EGEDHN
C#CCOc1ccccc1CNC[C@H](NC(=O)OC(C)(C)C)C1CC1	ZINC000310637194	1297098045	/nfs/dbraw/zinc/09/80/45/1297098045.db2.gz	FFZYMWKYXFBQFW-KRWDZBQOSA-N	0	3	344.455	3.092	20	30		EGEDHN
C[C@H](C(=O)C(C#N)C(=O)NC1CC1)c1ccc(Cl)c(Cl)c1	ZINC000747107684	1298728258	/nfs/dbraw/zinc/72/82/58/1298728258.db2.gz	AJGYKPMXVKTGSY-GZMMTYOYSA-N	0	3	325.195	3.084	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)C#Cc1ccccc1)c1ccsc1	ZINC000747208369	1298742844	/nfs/dbraw/zinc/74/28/44/1298742844.db2.gz	YDQTZVYTQKIVJV-GOSISDBHSA-N	0	3	326.465	3.299	20	30		EGEDHN
Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@@H]1N2C(=O)c1ccc(C#N)s1	ZINC000749315241	1299192239	/nfs/dbraw/zinc/19/22/39/1299192239.db2.gz	COWNTHUYMZLENM-RDJZCZTQSA-N	0	3	337.448	3.376	20	30		EGEDHN
C=CCCCCNCc1cc(C2CN(C(=O)OC(C)(C)C)C2)no1	ZINC000877401141	1299277814	/nfs/dbraw/zinc/27/78/14/1299277814.db2.gz	YVKCXXJUAYEANV-UHFFFAOYSA-N	0	3	335.448	3.455	20	30		EGEDHN
CCCN(CC(=O)N(C)C1(C#N)CCCCC1)Cc1ccccc1O	ZINC000750875763	1299467646	/nfs/dbraw/zinc/46/76/46/1299467646.db2.gz	XBQKCXQYHXQBAC-UHFFFAOYSA-N	0	3	343.471	3.289	20	30		EGEDHN
CC(=O)[C@](C#N)(CCN1CCC[C@H]1[C@@H]1CCCO1)c1ccccc1	ZINC000878573379	1300086386	/nfs/dbraw/zinc/08/63/86/1300086386.db2.gz	SPMBWJJAWYRAPF-SLFFLAALSA-N	0	3	326.440	3.070	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]/Cc2cccc(N(C)C)n2)c([O-])c1	ZINC000754685631	1300190731	/nfs/dbraw/zinc/19/07/31/1300190731.db2.gz	HGNCSBWOUOKWEN-DEDYPNTBSA-N	0	3	326.444	3.319	20	30		EGEDHN
CN(C1CCCC1)C(C)(C)C(=O)OCc1ccc(OCC#N)cc1	ZINC000754871202	1300235785	/nfs/dbraw/zinc/23/57/85/1300235785.db2.gz	JHJNBGOVGWUPLT-UHFFFAOYSA-N	0	3	330.428	3.285	20	30		EGEDHN
C#CCOc1ccc(CN[C@@H](C)c2ccc([S@@](C)=O)cc2)cc1	ZINC000756033359	1300429874	/nfs/dbraw/zinc/42/98/74/1300429874.db2.gz	LJEXJJJRTREEEL-NPMXOYFQSA-N	0	3	327.449	3.287	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)OC(C)(C)C)CN1CCc1ccc(C#N)cc1	ZINC000879221633	1300434320	/nfs/dbraw/zinc/43/43/20/1300434320.db2.gz	CWQJBMCSBUXHJZ-PBHICJAKSA-N	0	3	329.444	3.088	20	30		EGEDHN
N#Cc1cccn(CNC2(c3ccc(Cl)cc3)CCCC2)c1=O	ZINC000758214563	1300817706	/nfs/dbraw/zinc/81/77/06/1300817706.db2.gz	IBRQLNMZCPKPOB-UHFFFAOYSA-N	0	3	327.815	3.390	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN[C@H]2CCOc3c(Cl)cccc32)cc1	ZINC000763235224	1301854320	/nfs/dbraw/zinc/85/43/20/1301854320.db2.gz	JMSDTQDKFHFWBN-IRXDYDNUSA-N	0	3	328.799	3.358	20	30		EGEDHN
Cc1ccc(N(CCC#N)C(=O)[C@@H](C)N2CC[C@@H](C3CC3)C2)cc1	ZINC000764482900	1302071110	/nfs/dbraw/zinc/07/11/10/1302071110.db2.gz	COUZGFDOPXDTQT-SJLPKXTDSA-N	0	3	325.456	3.362	20	30		EGEDHN
C#Cc1cccc(NC(=S)N2CCN(C3CCCCC3)CC2)c1	ZINC000764500771	1302076601	/nfs/dbraw/zinc/07/66/01/1302076601.db2.gz	RPCVHYTZFDPPEH-UHFFFAOYSA-N	0	3	327.497	3.315	20	30		EGEDHN
C=CC[C@@H](N[C@H](C)c1cccc(NS(C)(=O)=O)c1)c1ccncc1	ZINC000766017385	1302370081	/nfs/dbraw/zinc/37/00/81/1302370081.db2.gz	AYDLMCAQTXYUAS-RDTXWAMCSA-N	0	3	345.468	3.421	20	30		EGEDHN
CCCCOc1ccc(NC(=O)C2CC3(C2)CNC[C@H]3C#N)c(C)c1	ZINC000884097124	1302733230	/nfs/dbraw/zinc/73/32/30/1302733230.db2.gz	UZXXVZQUCHSFFM-LFDOHDQPSA-N	0	3	341.455	3.252	20	30		EGEDHN
C#C[C@@H](CC)OC(=O)C1CCN(c2cc(Cl)ccc2Cl)C1=O	ZINC000768059820	1302813774	/nfs/dbraw/zinc/81/37/74/1302813774.db2.gz	AHXWENYTZCBLEO-NWDGAFQWSA-N	0	3	340.206	3.301	20	30		EGEDHN
Cc1cccc(C)c1[C@H]1CCCN1C(=O)C1CC2(C1)CNC[C@H]2C#N	ZINC000884398031	1302839701	/nfs/dbraw/zinc/83/97/01/1302839701.db2.gz	UMHPAWRRXWITCJ-BKVYSMKUSA-N	0	3	337.467	3.106	20	30		EGEDHN
C#CCCOc1ccc(CN2CCC(C(=O)NCC(C)C)CC2)cc1	ZINC000768228805	1302859733	/nfs/dbraw/zinc/85/97/33/1302859733.db2.gz	KBBMRVACJYNVDB-UHFFFAOYSA-N	0	3	342.483	3.073	20	30		EGEDHN
N#CCC[C@H](NC[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1	ZINC000775553383	1303983638	/nfs/dbraw/zinc/98/36/38/1303983638.db2.gz	NQLHVEQMHWDZMU-ZWKOTPCHSA-N	0	3	325.368	3.263	20	30		EGEDHN
C[C@H](N[C@H]1CCN(C2CCCCC2)C1=O)c1ccc(OCC#N)cc1	ZINC000776168320	1304106017	/nfs/dbraw/zinc/10/60/17/1304106017.db2.gz	IOQRXLQUZBQFSF-KXBFYZLASA-N	0	3	341.455	3.173	20	30		EGEDHN
C#Cc1cccc(NC(=S)N[C@H](C)CN(C)Cc2ccccc2)c1	ZINC000776203676	1304112203	/nfs/dbraw/zinc/11/22/03/1304112203.db2.gz	RKDMUXXEODYAGR-MRXNPFEDSA-N	0	3	337.492	3.475	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CNCCCOC1CCOCC1	ZINC000778173298	1304410204	/nfs/dbraw/zinc/41/02/04/1304410204.db2.gz	RUFHGBLEEZWUFA-UHFFFAOYSA-N	0	3	337.847	3.027	20	30		EGEDHN
COc1ccc(C(C)=NNCCOC(C)C)cc1CN1CCCC1	ZINC000778554370	1304464692	/nfs/dbraw/zinc/46/46/92/1304464692.db2.gz	OZZRJGGINSGUCP-UHFFFAOYSA-N	0	3	333.476	3.030	20	30		EGEDHN
CC[NH+](CC)Cc1cc(C(C)N=Nc2cccc(OC)n2)ccc1[O-]	ZINC000779819745	1304610566	/nfs/dbraw/zinc/61/05/66/1304610566.db2.gz	VHPWIJRMDYPQQI-UHFFFAOYSA-N	0	3	342.443	3.474	20	30		EGEDHN
CC(C)(C)OC(=O)CCNN=Cc1ccc(N2CCCCC2)cc1	ZINC000783865415	1305154709	/nfs/dbraw/zinc/15/47/09/1305154709.db2.gz	AZYDIQDKNUWMQU-UHFFFAOYSA-N	0	3	331.460	3.332	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(Cl)cc1)C(=O)[C@H]1CCOC2(CCC2)C1	ZINC000892493780	1305405789	/nfs/dbraw/zinc/40/57/89/1305405789.db2.gz	RWWRDHQROPDMJE-WFASDCNBSA-N	0	3	346.814	3.337	20	30		EGEDHN
N#CC(C(=O)CCC(F)(F)F)C(=O)NCc1cccc(Cl)c1	ZINC000786538787	1305593145	/nfs/dbraw/zinc/59/31/45/1305593145.db2.gz	OMSDXDRECAFHJU-NSHDSACASA-N	0	3	332.709	3.008	20	30		EGEDHN
CCO[C@H](CC(=O)C(C#N)C(=O)N[C@@H](CC)c1ccccc1)C(C)C	ZINC000787036591	1305680452	/nfs/dbraw/zinc/68/04/52/1305680452.db2.gz	PAPHBDDZPJBRHL-JENIJYKNSA-N	0	3	344.455	3.414	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)C1CCSCC1)c1ccccc1	ZINC000787045120	1305683430	/nfs/dbraw/zinc/68/34/30/1305683430.db2.gz	HXGPSQMVARQEPO-HOTGVXAUSA-N	0	3	330.453	3.106	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@H]1CCCCC[C@@H]1NCc1ccc(C#N)cn1	ZINC000788259239	1305909931	/nfs/dbraw/zinc/90/99/31/1305909931.db2.gz	MBPPUWIIPCGJKR-DLBZAZTESA-N	0	3	344.459	3.269	20	30		EGEDHN
COC1(CC(=O)C(C#N)C(=O)Nc2ccc(F)c(Cl)c2)CCC1	ZINC000791770254	1309060291	/nfs/dbraw/zinc/06/02/91/1309060291.db2.gz	AXEJYAZGMUOWLW-NSHDSACASA-N	0	3	338.766	3.086	20	30		EGEDHN
C[C@@H](CC(C)(C)C#N)NC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000895980435	1309626747	/nfs/dbraw/zinc/62/67/47/1309626747.db2.gz	SWWGLSFZOADBFG-XJKSGUPXSA-N	0	3	327.428	3.032	20	30		EGEDHN
C=CCNC(=S)NC[C@@H](c1ccc(Cl)cc1)N(C)CCC	ZINC000795090125	1309664558	/nfs/dbraw/zinc/66/45/58/1309664558.db2.gz	FNQBPWZSEHCNQO-HNNXBMFYSA-N	0	3	325.909	3.373	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)CCCOC(C)(C)C	ZINC000795311294	1309722396	/nfs/dbraw/zinc/72/23/96/1309722396.db2.gz	JHIYHDLIYXOWLY-UHFFFAOYSA-N	0	3	345.487	3.044	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)CCCOC(C)(C)C	ZINC000795791203	1309836153	/nfs/dbraw/zinc/83/61/53/1309836153.db2.gz	ZVGLKQUTBNRSQK-UHFFFAOYSA-N	0	3	345.487	3.044	20	30		EGEDHN
C#CCCOc1ccc(CNCc2ccc(C[S@@](C)=O)cc2)cc1	ZINC000796526442	1310021382	/nfs/dbraw/zinc/02/13/82/1310021382.db2.gz	MZDRKZXUWTTXHE-XMMPIXPASA-N	0	3	341.476	3.257	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1Cl)C(=O)[C@H]1CCC(F)(F)C1	ZINC000796632372	1310050329	/nfs/dbraw/zinc/05/03/29/1310050329.db2.gz	KRWPCIDVYWKSPV-VHSXEESVSA-N	0	3	326.730	3.423	20	30		EGEDHN
C=C(Br)CN[C@@H](C)Cc1ccc(OC)c(OC)c1C	ZINC000796741077	1310076709	/nfs/dbraw/zinc/07/67/09/1310076709.db2.gz	ARGZPHVTEUCIPF-NSHDSACASA-N	0	3	328.250	3.441	20	30		EGEDHN
C[C@@H](CNC(=O)OC(C)(C)C)C(=O)C(C#N)c1nc2ccccc2o1	ZINC000796819775	1310092697	/nfs/dbraw/zinc/09/26/97/1310092697.db2.gz	SJRIKRYBSAENLD-RYUDHWBXSA-N	0	3	343.383	3.165	20	30		EGEDHN
C[C@@H](Cn1ccc2ccccc21)C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000796819141	1310093180	/nfs/dbraw/zinc/09/31/80/1310093180.db2.gz	QBNKUTMQVJABCE-HOCLYGCPSA-N	0	3	346.390	3.020	20	30		EGEDHN
CC(C)(C)OC(=O)NCC[C@@H]1CCN(Cc2cc(C#N)cs2)C1	ZINC000896985107	1310120227	/nfs/dbraw/zinc/12/02/27/1310120227.db2.gz	QXWOBAJCRDYLLL-CYBMUJFWSA-N	0	3	335.473	3.356	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)CCCC2CCOCC2)c1	ZINC000798817545	1310446234	/nfs/dbraw/zinc/44/62/34/1310446234.db2.gz	ZUJWGQYEJSQMBN-QGZVFWFLSA-N	0	3	328.412	3.239	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H]2CCN([C@@H](C)c3ccccc3)C2)cc1C#N	ZINC000799319837	1310523900	/nfs/dbraw/zinc/52/39/00/1310523900.db2.gz	RQOVOBDHLLCVIP-JXFKEZNVSA-N	0	3	333.435	3.432	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)[C@H]2CCCC(F)(F)C2)c1	ZINC000800385090	1310747339	/nfs/dbraw/zinc/74/73/39/1310747339.db2.gz	RLIYIHXURMIGDV-FZMZJTMJSA-N	0	3	336.338	3.168	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2sccc2C(F)F)C1	ZINC001023727917	1319867322	/nfs/dbraw/zinc/86/73/22/1319867322.db2.gz	WVLMFKZXLPSYGM-LBPRGKRZSA-N	0	3	326.412	3.151	20	30		EGEDHN
COc1cc(CN(CCO[C@@H](C)C#N)C2CC2)ccc1OC(F)F	ZINC000801910564	1316963915	/nfs/dbraw/zinc/96/39/15/1316963915.db2.gz	UTYLAFFMFMBKDH-LBPRGKRZSA-N	0	3	340.370	3.190	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)Cc2ccc(Cl)s2)c1	ZINC000802040723	1316976253	/nfs/dbraw/zinc/97/62/53/1316976253.db2.gz	QUCIFZXPOVBSCP-ZDUSSCGKSA-N	0	3	348.811	3.300	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)C[C@H]3C=CCCC3)C2)s1	ZINC001019029129	1317011882	/nfs/dbraw/zinc/01/18/82/1317011882.db2.gz	NDLYUSUZYZFCMD-GJZGRUSLSA-N	0	3	329.469	3.057	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CC[C@H](N[C@H](C)c3ccccc3F)C2)cc1	ZINC001019224718	1317112206	/nfs/dbraw/zinc/11/22/06/1317112206.db2.gz	FBGGHEZSURWMBX-QAPCUYQASA-N	0	3	336.410	3.372	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3cc(C)ccc3OC)C2)CC1	ZINC001019327559	1317171095	/nfs/dbraw/zinc/17/10/95/1317171095.db2.gz	JMHRWVZYJNRGQA-IBGZPJMESA-N	0	3	342.483	3.441	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3ccc(F)c(F)c3)C2)CC1	ZINC001019331224	1317171579	/nfs/dbraw/zinc/17/15/79/1317171579.db2.gz	OATRWNCKTBGBLT-INIZCTEOSA-N	0	3	334.410	3.402	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3c(C)nsc3C)C2)CC1	ZINC001019330811	1317172252	/nfs/dbraw/zinc/17/22/52/1317172252.db2.gz	ABETXYFXPADQSY-INIZCTEOSA-N	0	3	333.501	3.197	20	30		EGEDHN
CCc1nsc(N2CCCN(CCCCC3(C#N)CCC3)CC2)n1	ZINC000929757383	1328690794	/nfs/dbraw/zinc/69/07/94/1328690794.db2.gz	GVXHSLIWFNOKGU-UHFFFAOYSA-N	0	3	347.532	3.477	20	30		EGEDHN
CC(C)n1cccc1C(=O)N1CC[C@H](NCc2ccc(C#N)s2)C1	ZINC001019781942	1317417314	/nfs/dbraw/zinc/41/73/14/1317417314.db2.gz	YSQNRRLSLGLTNB-AWEZNQCLSA-N	0	3	342.468	3.006	20	30		EGEDHN
C[C@H](Cc1cncc2ccccc21)C(=O)C(C#N)C(=O)NC1CCCC1	ZINC000805858526	1317431638	/nfs/dbraw/zinc/43/16/38/1317431638.db2.gz	RQRQCUKLBUKSNK-AUUYWEPGSA-N	0	3	349.434	3.181	20	30		EGEDHN
C=CCN(CC(=O)[O-])C[C@@]1(C(C)(C)C)CC[N@H+](Cc2ccccc2)C1	ZINC000901585650	1317449318	/nfs/dbraw/zinc/44/93/18/1317449318.db2.gz	GWDWUDODRGUDBH-NRFANRHFSA-N	0	3	344.499	3.497	20	30		EGEDHN
C=CCN(CC(=O)[O-])C[C@@]1(C(C)(C)C)CC[N@@H+](Cc2ccccc2)C1	ZINC000901585650	1317449322	/nfs/dbraw/zinc/44/93/22/1317449322.db2.gz	GWDWUDODRGUDBH-NRFANRHFSA-N	0	3	344.499	3.497	20	30		EGEDHN
C=CC[N@H+](CC(=O)[O-])C[C@@]1(C(C)(C)C)CCN(Cc2ccccc2)C1	ZINC000901585650	1317449328	/nfs/dbraw/zinc/44/93/28/1317449328.db2.gz	GWDWUDODRGUDBH-NRFANRHFSA-N	0	3	344.499	3.497	20	30		EGEDHN
C=CC[N@@H+](CC(=O)[O-])C[C@@]1(C(C)(C)C)CCN(Cc2ccccc2)C1	ZINC000901585650	1317449332	/nfs/dbraw/zinc/44/93/32/1317449332.db2.gz	GWDWUDODRGUDBH-NRFANRHFSA-N	0	3	344.499	3.497	20	30		EGEDHN
CC1(C)CC(CC(=O)N[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)C1	ZINC001020503601	1317731911	/nfs/dbraw/zinc/73/19/11/1317731911.db2.gz	LQRSICSDYIEIGZ-QAQDUYKDSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)c2occc2C(C)C)C1	ZINC001020504690	1317732892	/nfs/dbraw/zinc/73/28/92/1317732892.db2.gz	RWVJRSKJFKHPMU-HAQNSBGRSA-N	0	3	341.249	3.162	20	30		EGEDHN
C[C@@H]1CCC[C@@H](C(=O)N[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)C1	ZINC001020524767	1317744493	/nfs/dbraw/zinc/74/44/93/1317744493.db2.gz	ZWHVWUDSXXDKIT-MOIQIXESSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@H](NCc3c(C)nsc3C)C2)CC1	ZINC001020550127	1317761372	/nfs/dbraw/zinc/76/13/72/1317761372.db2.gz	IORRPIMEYZJUDN-WKILWMFISA-N	0	3	333.501	3.243	20	30		EGEDHN
CC[C@H]1CCC[C@@H]1C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001020554166	1317767569	/nfs/dbraw/zinc/76/75/69/1317767569.db2.gz	LWIBKEWZPXYWBJ-DKIMLUQUSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)Cc2c[nH]c3cc(C)ccc23)C1	ZINC001020737477	1317899661	/nfs/dbraw/zinc/89/96/61/1317899661.db2.gz	POUYWIHHXUCXIB-SHTZXODSSA-N	0	3	331.847	3.008	20	30		EGEDHN
CCOc1cc(/C=C2\C(=O)c3ncnn3C2C)ccc1OC(F)F	ZINC000905080258	1317921090	/nfs/dbraw/zinc/92/10/90/1317921090.db2.gz	JPAWUCKWTHSLJJ-NJQKBMNKSA-N	0	3	335.310	3.119	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2sc(CC3CC3)nc2C)C1	ZINC001020824855	1317949066	/nfs/dbraw/zinc/94/90/66/1317949066.db2.gz	HVPWJMNPXYUDIA-JOCQHMNTSA-N	0	3	339.892	3.007	20	30		EGEDHN
N#Cc1cccc(C(=O)OC[C@H]2CCCCN2Cc2ccccc2)n1	ZINC000810835068	1318061881	/nfs/dbraw/zinc/06/18/81/1318061881.db2.gz	SZYJMASHEBDBFY-GOSISDBHSA-N	0	3	335.407	3.165	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc3ccccc3n2CC)C1	ZINC001021090211	1318079161	/nfs/dbraw/zinc/07/91/61/1318079161.db2.gz	FTAJUZUAKGTALP-SHTZXODSSA-N	0	3	331.847	3.264	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)[C@@H]2CCCC(C)(C)C2)C1	ZINC001021107469	1318090734	/nfs/dbraw/zinc/09/07/34/1318090734.db2.gz	JBQKGOJWNHMXQJ-MGPQQGTHSA-N	0	3	343.309	3.348	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2ccsc2C#N)CN1Cc1ccccc1	ZINC000906971162	1318170117	/nfs/dbraw/zinc/17/01/17/1318170117.db2.gz	HESAXRWXZUWCIP-HIFRSBDPSA-N	0	3	325.437	3.013	20	30		EGEDHN
CCN1CCN(c2cccc(NC(=O)c3ccsc3C#N)c2)CC1	ZINC000907453534	1318228096	/nfs/dbraw/zinc/22/80/96/1318228096.db2.gz	YJSKCAYVYNIGKU-UHFFFAOYSA-N	0	3	340.452	3.014	20	30		EGEDHN
COc1ccc(C#N)cc1CNC[C@@H]1CCCCN1C(=O)C=C(C)C	ZINC000959857460	1318230661	/nfs/dbraw/zinc/23/06/61/1318230661.db2.gz	VLNNISQCUAUGAH-SFHVURJKSA-N	0	3	341.455	3.004	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)cc1F	ZINC000959970922	1318295563	/nfs/dbraw/zinc/29/55/63/1318295563.db2.gz	IKFASMJMCQJFKT-IRXDYDNUSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C[C@@H]2CCC[C@H](C)C2)OC)CC1	ZINC000812032957	1318313080	/nfs/dbraw/zinc/31/30/80/1318313080.db2.gz	VGUNKANRDWZQIH-DLBZAZTESA-N	0	3	337.508	3.426	20	30		EGEDHN
C#C[C@H](NC(=O)N[C@H](CN1CCCCC1)c1ccccc1)C(C)C	ZINC000812045851	1318315207	/nfs/dbraw/zinc/31/52/07/1318315207.db2.gz	RSSAWZQFFPZMQS-RBUKOAKNSA-N	0	3	327.472	3.171	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@H]2CN(Cc3cccc(C#N)c3)CC[C@H]21	ZINC001021528581	1318364222	/nfs/dbraw/zinc/36/42/22/1318364222.db2.gz	YXSUHATZEKXIGQ-RBUKOAKNSA-N	0	3	325.456	3.027	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)C(=O)N1CCN(C)C2(CCCCC2)C1	ZINC000908575633	1318369112	/nfs/dbraw/zinc/36/91/12/1318369112.db2.gz	QZOAGVNVZQZRGN-QGZVFWFLSA-N	0	3	339.483	3.214	20	30		EGEDHN
C#C[C@H](CCC)NC(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000812380517	1318379673	/nfs/dbraw/zinc/37/96/73/1318379673.db2.gz	GBAFZJGCBYWMQY-MJGOQNOKSA-N	0	3	345.487	3.178	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC[C@@H]2CN(Cc3ccc(C#N)cc3)CC[C@H]21	ZINC001021554643	1318400248	/nfs/dbraw/zinc/40/02/48/1318400248.db2.gz	ODIYTTWHZZIBHA-VHMBZRNASA-N	0	3	337.467	3.337	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@H](CCCN3C(=O)C=C3CCC3)C2)c1	ZINC001021559526	1318408215	/nfs/dbraw/zinc/40/82/15/1318408215.db2.gz	SBYLRRUCBGWSRP-RTWAWAEBSA-N	0	3	349.478	3.481	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@@H]2CN(C/C=C\c3ccccc3)CC[C@H]21	ZINC001021586075	1318429166	/nfs/dbraw/zinc/42/91/66/1318429166.db2.gz	YSOXKXRRMKIOKU-YSXZVRBFSA-N	0	3	348.490	3.426	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(CCC)s2)C1	ZINC001021595514	1318440151	/nfs/dbraw/zinc/44/01/51/1318440151.db2.gz	ZHHUCJPZFUTJMA-NVXWUHKLSA-N	0	3	330.497	3.260	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)Cc1cccc(F)c1F	ZINC000960312988	1318455616	/nfs/dbraw/zinc/45/56/16/1318455616.db2.gz	PFEMFFXYGYCJDQ-YLJYHZDGSA-N	0	3	342.389	3.065	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc2c([nH]1)CCCC2	ZINC000960318029	1318458855	/nfs/dbraw/zinc/45/88/55/1318458855.db2.gz	FJKLXQNAZOHQSY-TZIWHRDSSA-N	0	3	349.478	3.455	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)Cc2ccccc2CC)C1	ZINC001021612595	1318459053	/nfs/dbraw/zinc/45/90/53/1318459053.db2.gz	CQAXHFFGARHQQD-RTWAWAEBSA-N	0	3	338.495	3.128	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cnc(C2CC2)s1	ZINC000960327178	1318463747	/nfs/dbraw/zinc/46/37/47/1318463747.db2.gz	OMQNTUYXPDUFFU-NVXWUHKLSA-N	0	3	339.464	3.192	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)Cc1ccc2c(c1)CCC2	ZINC000960335492	1318469170	/nfs/dbraw/zinc/46/91/70/1318469170.db2.gz	VJWBFJVYVUMHBZ-FYYLOGMGSA-N	0	3	346.474	3.276	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)CCc2ccc(F)cc2)C1	ZINC001021621503	1318469908	/nfs/dbraw/zinc/46/99/08/1318469908.db2.gz	BNLPONLBCGGSHF-UYAOXDASSA-N	0	3	342.458	3.095	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cccc(C(C)C)n2)C1	ZINC001021621784	1318471935	/nfs/dbraw/zinc/47/19/35/1318471935.db2.gz	DGIQYLFRUMVEER-FXAWDEMLSA-N	0	3	339.483	3.155	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(Cl)cc2F)C1	ZINC001021626165	1318477001	/nfs/dbraw/zinc/47/70/01/1318477001.db2.gz	DENBBYOCPMWZBT-RDTXWAMCSA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(-n3cccc3)cc2)C1	ZINC001021626735	1318478786	/nfs/dbraw/zinc/47/87/86/1318478786.db2.gz	HSHNNSQIHLFCAW-PZJWPPBQSA-N	0	3	347.462	3.037	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)CCc2cccc(C)c2)C1	ZINC001021641673	1318500074	/nfs/dbraw/zinc/50/00/74/1318500074.db2.gz	KBTNBODHJNCUKD-SFTDATJTSA-N	0	3	338.495	3.264	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cccc(Cl)c2F)C1	ZINC001021658129	1318520699	/nfs/dbraw/zinc/52/06/99/1318520699.db2.gz	KIFKZFJBNCCGIT-WMLDXEAASA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)Cc2cc(C)cc(C)c2)C1	ZINC001021666046	1318527652	/nfs/dbraw/zinc/52/76/52/1318527652.db2.gz	OBOVWMTWPVFBRB-RTWAWAEBSA-N	0	3	338.495	3.182	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cccc3cc[nH]c32)C1	ZINC001021672354	1318536076	/nfs/dbraw/zinc/53/60/76/1318536076.db2.gz	BBBUKPKQTDCMBL-MJGOQNOKSA-N	0	3	335.451	3.118	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(C)cc2Cl)C1	ZINC001021673887	1318538119	/nfs/dbraw/zinc/53/81/19/1318538119.db2.gz	NDCSKTCPJIFGSK-MAUKXSAKSA-N	0	3	330.859	3.208	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(F)cc(Cl)c2)C1	ZINC001021677149	1318546146	/nfs/dbraw/zinc/54/61/46/1318546146.db2.gz	ORPWBDSKCCNGIO-KSSFIOAISA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2occ3c2CCCC3)C1	ZINC001021723461	1318612032	/nfs/dbraw/zinc/61/20/32/1318612032.db2.gz	UVXBWQXDRXOAAH-LPHOPBHVSA-N	0	3	340.467	3.108	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(C)nc3ccccc32)C1	ZINC001021724833	1318616164	/nfs/dbraw/zinc/61/61/64/1318616164.db2.gz	ONVJHIBFQMRLOC-UWJYYQICSA-N	0	3	347.462	3.103	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(OC(C)C)cc2)C1	ZINC001021726799	1318620655	/nfs/dbraw/zinc/62/06/55/1318620655.db2.gz	GIGJEXHXPHYDHF-QUCCMNQESA-N	0	3	340.467	3.034	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc3c(s2)CCCC3)C1	ZINC001021729500	1318631198	/nfs/dbraw/zinc/63/11/98/1318631198.db2.gz	ZYPBTPDRUYTRHZ-IAGOWNOFSA-N	0	3	342.508	3.187	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(C)c(F)c(C)c2)C1	ZINC001021734917	1318640450	/nfs/dbraw/zinc/64/04/50/1318640450.db2.gz	ATHFEIKJULCIJQ-FUHWJXTLSA-N	0	3	328.431	3.002	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(Cl)cn2CC)C1	ZINC001021738846	1318646327	/nfs/dbraw/zinc/64/63/27/1318646327.db2.gz	CKPOJYZSRLMSHF-RDJZCZTQSA-N	0	3	347.890	3.111	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc3cccc(C)c3o2)C1	ZINC001021740881	1318651205	/nfs/dbraw/zinc/65/12/05/1318651205.db2.gz	WZVFFPYPEFXGSN-ROUUACIJSA-N	0	3	336.435	3.301	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2coc3ccccc23)C1	ZINC001021749670	1318665711	/nfs/dbraw/zinc/66/57/11/1318665711.db2.gz	GVWZNZLKHKKSJR-QFBILLFUSA-N	0	3	336.435	3.383	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@@H](NC(=O)CC3CCCCC3)C2)c(F)c1	ZINC001021811503	1318693974	/nfs/dbraw/zinc/69/39/74/1318693974.db2.gz	XAFIINIKYHAEBC-HDICACEKSA-N	0	3	343.446	3.405	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC[C@H]1CN(C)C[C@H]1CCCCO1	ZINC000960645557	1318765062	/nfs/dbraw/zinc/76/50/62/1318765062.db2.gz	ACWCXXWBOKHATA-JKSUJKDBSA-N	0	3	342.911	3.257	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc3ccccc3nc2C)C1	ZINC001022156587	1318824505	/nfs/dbraw/zinc/82/45/05/1318824505.db2.gz	IEBPIZRMZVUCJA-GASCZTMLSA-N	0	3	329.831	3.146	20	30		EGEDHN
FC(F)(F)[C@H]1C=C(NNc2cncc(Br)c2)CCO1	ZINC000814886937	1318839929	/nfs/dbraw/zinc/83/99/29/1318839929.db2.gz	KQDGUJDZZYORRT-SNVBAGLBSA-N	0	3	338.127	3.353	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2oc3c(cccc3F)c2C)C1	ZINC001022204445	1318840498	/nfs/dbraw/zinc/84/04/98/1318840498.db2.gz	MLIDIZQQNALYFK-TXEJJXNPSA-N	0	3	336.794	3.483	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@@H]2CC=CC[C@H]2C(F)(F)F)C1	ZINC001022286569	1318877707	/nfs/dbraw/zinc/87/77/07/1318877707.db2.gz	SFARGXGTZZFWQQ-YVECIDJPSA-N	0	3	336.785	3.120	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H]1CN(C)C[C@H]1CC(C)(C)CO1	ZINC000960789418	1318892650	/nfs/dbraw/zinc/89/26/50/1318892650.db2.gz	WNTZGASKGOAXSK-DLBZAZTESA-N	0	3	336.520	3.327	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)CC(C)(F)F	ZINC000960845513	1318983090	/nfs/dbraw/zinc/98/30/90/1318983090.db2.gz	TUZIHEHCJGZVHT-INIZCTEOSA-N	0	3	335.398	3.026	20	30		EGEDHN
CC1(c2cccc(Br)c2)CCN(C[C@H](O)CC#N)CC1	ZINC000930159797	1328800978	/nfs/dbraw/zinc/80/09/78/1328800978.db2.gz	ILRLWWRZMZLZAH-OAHLLOKOSA-N	0	3	337.261	3.077	20	30		EGEDHN
C[C@H]1CC[C@H](CC(=O)N[C@H]2C[C@@H](NCc3cc(C#N)ccc3F)C2)C1	ZINC001022563178	1318992980	/nfs/dbraw/zinc/99/29/80/1318992980.db2.gz	FQXYWGZZLSOJTI-DFEHZGFQSA-N	0	3	343.446	3.260	20	30		EGEDHN
CCc1ccc(C#CC(=O)N(CC(C)C)C2CCN(C)CC2)cc1	ZINC000815597491	1319024913	/nfs/dbraw/zinc/02/49/13/1319024913.db2.gz	WZDHGBYRRGSIPW-UHFFFAOYSA-N	0	3	326.484	3.179	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@@H](NCc3cccc(Cl)n3)C2)CC1	ZINC001022647867	1319038633	/nfs/dbraw/zinc/03/86/33/1319038633.db2.gz	FLKMXCZPVNQYGV-IYBDPMFKSA-N	0	3	333.863	3.218	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)[C@H]1CC12CCC2	ZINC000960916432	1319061905	/nfs/dbraw/zinc/06/19/05/1319061905.db2.gz	XNZCABKAZOAKJB-RTBURBONSA-N	0	3	337.467	3.171	20	30		EGEDHN
CCCC(=O)N1CCC[C@@H]([C@@H]2CCN(Cc3ccccc3C#N)C2)C1	ZINC000961100713	1319210336	/nfs/dbraw/zinc/21/03/36/1319210336.db2.gz	RAEGVIUYIMMFLD-WOJBJXKFSA-N	0	3	339.483	3.419	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)c2cccc(Cl)c2)C1	ZINC001023010714	1319217251	/nfs/dbraw/zinc/21/72/51/1319217251.db2.gz	DVLAGSVYJCXCGO-BETUJISGSA-N	0	3	343.652	3.099	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)C[C@H]2CCCc3ccccc32)C1	ZINC001023002409	1319211640	/nfs/dbraw/zinc/21/16/40/1319211640.db2.gz	DNCCMXVJKOGDFS-ZACQAIPSSA-N	0	3	332.875	3.486	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)c2ccccc2Cl)C1	ZINC001023006990	1319213933	/nfs/dbraw/zinc/21/39/33/1319213933.db2.gz	YIXCIQVKEYQMQA-PHIMTYICSA-N	0	3	343.652	3.099	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)N1CCC[C@H](C#N)C1)c1ccsc1	ZINC000914066257	1319223408	/nfs/dbraw/zinc/22/34/08/1319223408.db2.gz	RLQXLMHSFOAXQQ-ZBFHGGJFSA-N	0	3	334.489	3.076	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@@]2(c3ccccc3)C[C@H](F)C2)C1	ZINC001023033572	1319228772	/nfs/dbraw/zinc/22/87/72/1319228772.db2.gz	KPNITQZFOVTQDI-AUENWKNYSA-N	0	3	336.838	3.046	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)C23CCC(CC2)CC3)C1	ZINC001023117366	1319268004	/nfs/dbraw/zinc/26/80/04/1319268004.db2.gz	SELYSHPKNVIJGY-MHXRYWECSA-N	0	3	341.293	3.102	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2sc(C(C)(C)C)nc2C)C1	ZINC001023168000	1319302245	/nfs/dbraw/zinc/30/22/45/1319302245.db2.gz	GZJGDGJXXMLFDZ-TXEJJXNPSA-N	0	3	341.908	3.352	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)C2CC(c3ccc(F)cc3)C2)C1	ZINC001023169306	1319304851	/nfs/dbraw/zinc/30/48/51/1319304851.db2.gz	OLEOHOUHUSMDDL-KZNFOHLHSA-N	0	3	336.838	3.309	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@@H]2CCCN(Cc3cccc(C#N)c3)C2)o1	ZINC001023218382	1319352625	/nfs/dbraw/zinc/35/26/25/1319352625.db2.gz	VVHOSVNVMUBDGX-SFHVURJKSA-N	0	3	337.423	3.102	20	30		EGEDHN
C=CCn1c(Cc2ccccc2)nnc1SCCN1CCCC1	ZINC000915117925	1319425599	/nfs/dbraw/zinc/42/55/99/1319425599.db2.gz	JOFSGVLNXQEZTO-UHFFFAOYSA-N	0	3	328.485	3.243	20	30		EGEDHN
N#Cc1ccc(C(=O)NC[C@H]2CCCN(C/C=C\c3ccccc3)C2)[nH]1	ZINC001023318392	1319442614	/nfs/dbraw/zinc/44/26/14/1319442614.db2.gz	IFXNRUKDGABRRR-MPYGFJLXSA-N	0	3	348.450	3.042	20	30		EGEDHN
CCCCCCCCCC(=O)N1CCC[C@H](n2cc(CN)nn2)C1	ZINC000818011348	1319490284	/nfs/dbraw/zinc/49/02/84/1319490284.db2.gz	YLNHSEQMXAKAFS-KRWDZBQOSA-N	0	3	335.496	3.041	20	30		EGEDHN
C#CCN1CCC[C@H](CNC(=O)c2cc(Cl)sc2Cl)C1	ZINC001023416317	1319520119	/nfs/dbraw/zinc/52/01/19/1319520119.db2.gz	XBRMAZYOFFBRCK-SNVBAGLBSA-N	0	3	331.268	3.130	20	30		EGEDHN
C#CCN(C)CCCNC(=O)C1(c2cccc(F)c2)CCCCC1	ZINC000818593087	1319565580	/nfs/dbraw/zinc/56/55/80/1319565580.db2.gz	LPVGMVXOKMJEEM-UHFFFAOYSA-N	0	3	330.447	3.099	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1cccc(-c2c(F)cccc2F)c1	ZINC000818593387	1319565856	/nfs/dbraw/zinc/56/58/56/1319565856.db2.gz	XIJWXRMLSABRFX-UHFFFAOYSA-N	0	3	342.389	3.317	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1cc2c3ccccc3n(C)c2s1	ZINC000818599516	1319566750	/nfs/dbraw/zinc/56/67/50/1319566750.db2.gz	VDZQWQTWXJIUPD-UHFFFAOYSA-N	0	3	339.464	3.078	20	30		EGEDHN
C#CCN1CCC[C@@H](CNC(=O)c2ccc3c4c(cccc42)CC3)C1	ZINC001023474526	1319573098	/nfs/dbraw/zinc/57/30/98/1319573098.db2.gz	AIVJRETUCFVTOF-INIZCTEOSA-N	0	3	332.447	3.013	20	30		EGEDHN
C=CCc1cc(CNC[C@@H](O)c2ccccc2F)cc(OC)c1OC	ZINC000818989803	1319609208	/nfs/dbraw/zinc/60/92/08/1319609208.db2.gz	UEYOUUFDPHTJER-GOSISDBHSA-N	0	3	345.414	3.395	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H](CNC(=O)[C@]34C[C@H]3CCC4)C2)cc1	ZINC001023504048	1319612060	/nfs/dbraw/zinc/61/20/60/1319612060.db2.gz	YPHGSCVYGDYEIZ-QKNQBKEWSA-N	0	3	337.467	3.077	20	30		EGEDHN
C=CCN1CCC[C@H](CNC(=O)c2nsc3ccc(C)cc32)C1	ZINC001023531563	1319635243	/nfs/dbraw/zinc/63/52/43/1319635243.db2.gz	ZFSDZWOWJZALMF-CQSZACIVSA-N	0	3	329.469	3.233	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CCCN(Cc3cnccc3C)C2)CC1	ZINC001023572798	1319690700	/nfs/dbraw/zinc/69/07/00/1319690700.db2.gz	NQIPRSBEYJKVPZ-GOSISDBHSA-N	0	3	341.499	3.465	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2[C@H]3CN(Cc4csc(C)c4)C[C@H]32)CC1	ZINC000961689086	1319700577	/nfs/dbraw/zinc/70/05/77/1319700577.db2.gz	QZNFTRJJQJLZFK-PIIMJCKOSA-N	0	3	330.497	3.349	20	30		EGEDHN
N#CC(C(=O)COC1CCCC1)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000916940186	1319726407	/nfs/dbraw/zinc/72/64/07/1319726407.db2.gz	VOXVMOMFXVIKRH-LBPRGKRZSA-N	0	3	338.766	3.086	20	30		EGEDHN
N#Cc1ccccc1CNCC1CC(NC(=O)c2ccoc2Cl)C1	ZINC000961772696	1319730664	/nfs/dbraw/zinc/73/06/64/1319730664.db2.gz	RPZULNLAHLVBQN-UHFFFAOYSA-N	0	3	343.814	3.103	20	30		EGEDHN
C=CCOc1ccc(-c2nnc(SC[C@H]3CCCN3C)o2)cc1	ZINC000917307511	1319784909	/nfs/dbraw/zinc/78/49/09/1319784909.db2.gz	ITTLLFMKALVJNR-CQSZACIVSA-N	0	3	331.441	3.488	20	30		EGEDHN
N#Cc1ccccc1CNCC1CC(NC(=O)C[C@@H]2C=CCCC2)C1	ZINC000961982717	1319790286	/nfs/dbraw/zinc/79/02/86/1319790286.db2.gz	QIYJSJLFMBZMIZ-ZRZPHAQCSA-N	0	3	337.467	3.289	20	30		EGEDHN
CCc1ccc(C(=O)NC2CC(CNCc3ccccc3C#N)C2)o1	ZINC000962000913	1319798645	/nfs/dbraw/zinc/79/86/45/1319798645.db2.gz	KFOIUXJXWRHENQ-UHFFFAOYSA-N	0	3	337.423	3.012	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cccc(C(F)(F)F)c2)C1	ZINC001023718604	1319854306	/nfs/dbraw/zinc/85/43/06/1319854306.db2.gz	ZDGXCXRXBMDZOH-AWEZNQCLSA-N	0	3	338.373	3.171	20	30		EGEDHN
C#CCN1CCC[C@@H](CNC(=O)c2cc3cc(F)ccc3s2)C1	ZINC001023741593	1319886987	/nfs/dbraw/zinc/88/69/87/1319886987.db2.gz	YCLWRWOEZVLIRF-ZDUSSCGKSA-N	0	3	330.428	3.115	20	30		EGEDHN
CC1(C)CC[C@H](C(=O)NC2CC(CNCc3ccccc3C#N)C2)C1	ZINC000962279832	1319897790	/nfs/dbraw/zinc/89/77/90/1319897790.db2.gz	UHWOHKOLIZJCKN-WUJZJPHMSA-N	0	3	339.483	3.369	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)[C@H]2CCCCc3ccccc32)C1	ZINC001023764341	1319910907	/nfs/dbraw/zinc/91/09/07/1319910907.db2.gz	BAVAHLBLYDFSPJ-RXVVDRJESA-N	0	3	338.495	3.348	20	30		EGEDHN
C#C[C@@H](NC(=O)N(CCN(C)C)Cc1ccsc1)c1ccccc1	ZINC000820584425	1319916842	/nfs/dbraw/zinc/91/68/42/1319916842.db2.gz	PANKXVCZVNMTAE-GOSISDBHSA-N	0	3	341.480	3.196	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc(CC)c(CC)c2)C1	ZINC001023779745	1319928679	/nfs/dbraw/zinc/92/86/79/1319928679.db2.gz	LCLDDAZNTYFYFQ-QGZVFWFLSA-N	0	3	326.484	3.277	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCN(C(=O)C2CCCC2)C1	ZINC001023797689	1319942632	/nfs/dbraw/zinc/94/26/32/1319942632.db2.gz	XSSSSUBIPBVMOC-INIZCTEOSA-N	0	3	325.456	3.077	20	30		EGEDHN
C#C[C@H](NC(=O)Nc1ccc(CCN2CCSCC2)cc1)C(C)C	ZINC000821547977	1320020165	/nfs/dbraw/zinc/02/01/65/1320020165.db2.gz	VSMNVOIDPSGXDW-SFHVURJKSA-N	0	3	345.512	3.057	20	30		EGEDHN
C/C(=C/C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1)c1ccco1	ZINC000822475876	1320086158	/nfs/dbraw/zinc/08/61/58/1320086158.db2.gz	PPBQNWWKJRKYLL-SSZFMOIBSA-N	0	3	337.423	3.145	20	30		EGEDHN
C[C@H](CCCCCN1C(=O)c2ccccc2C1=O)NCC1(C#N)CC1	ZINC000824326817	1320248343	/nfs/dbraw/zinc/24/83/43/1320248343.db2.gz	KMELQXIAEJWREO-OAHLLOKOSA-N	0	3	339.439	3.125	20	30		EGEDHN
CC(C)C#CC(=O)N(CCN1CCCC1)Cc1ccc(Cl)cc1	ZINC000826753761	1320401581	/nfs/dbraw/zinc/40/15/81/1320401581.db2.gz	IPDGSIKNVHNYNY-UHFFFAOYSA-N	0	3	332.875	3.424	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N(C1CC1)[C@@H]1CCCc2ccccc21	ZINC000838622776	1320796206	/nfs/dbraw/zinc/79/62/06/1320796206.db2.gz	MFASJMVOVNPXFV-HXUWFJFHSA-N	0	3	339.483	3.193	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1ccccc1Cc1ccccc1	ZINC000838624442	1320796262	/nfs/dbraw/zinc/79/62/62/1320796262.db2.gz	YWRBUDBZDHQXPW-UHFFFAOYSA-N	0	3	335.451	3.354	20	30		EGEDHN
CN(CC(C)(C)C#N)C(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000840749565	1321140478	/nfs/dbraw/zinc/14/04/78/1321140478.db2.gz	LHNSJFVIYATXTA-UHFFFAOYSA-N	0	3	344.528	3.007	20	30		EGEDHN
N#CC(C(=O)NC1CCCCC1)C(=O)[C@@H]1CCSc2ccccc21	ZINC000842289504	1321367925	/nfs/dbraw/zinc/36/79/25/1321367925.db2.gz	RIGNXFBPOZWNJU-CVEARBPZSA-N	0	3	342.464	3.424	20	30		EGEDHN
CC[C@@H](OC1CCCC1)C(=O)C(C#N)C(=O)Nc1cccc(OC)c1	ZINC000842288767	1321368444	/nfs/dbraw/zinc/36/84/44/1321368444.db2.gz	LLCLLNWRXMRBCI-IAGOWNOFSA-N	0	3	344.411	3.080	20	30		EGEDHN
CCn1ccc(CC(=O)C(C#N)c2nc3cc(F)ccc3s2)n1	ZINC000845463140	1321709931	/nfs/dbraw/zinc/70/99/31/1321709931.db2.gz	SLYJLRXPLVLPSQ-LBPRGKRZSA-N	0	3	328.372	3.071	20	30		EGEDHN
C=CC[C@H](NC(=O)N1CCN(C(C)(C)CC)CC1)c1ccncc1	ZINC000847318470	1321862283	/nfs/dbraw/zinc/86/22/83/1321862283.db2.gz	JUTCPQBZTQPYET-KRWDZBQOSA-N	0	3	330.476	3.215	20	30		EGEDHN
C[C@]1(C(=O)OCC2(C#N)CCN(Cc3ccccc3)CC2)CC1(F)F	ZINC000847746782	1321900311	/nfs/dbraw/zinc/90/03/11/1321900311.db2.gz	QPPXHOVZUCCYFQ-QGZVFWFLSA-N	0	3	348.393	3.381	20	30		EGEDHN
COCCCCC(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847748771	1321900337	/nfs/dbraw/zinc/90/03/37/1321900337.db2.gz	HYZBSTUORFPTFU-UHFFFAOYSA-N	0	3	344.455	3.152	20	30		EGEDHN
N#CCCCC(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847747200	1321900577	/nfs/dbraw/zinc/90/05/77/1321900577.db2.gz	YWIFVEJWXMWQQL-UHFFFAOYSA-N	0	3	325.412	3.029	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NCC[C@@H]1CN(CC(=C)Cl)C[C@H]1C	ZINC001103274834	1365466665	/nfs/dbraw/zinc/46/66/65/1365466665.db2.gz	WXGFASGRYCFJCF-QGPMSJSTSA-N	0	3	342.911	3.042	20	30		EGEDHN
CN(CC(=O)C(C#N)c1nc2ccccc2s1)Cc1cscn1	ZINC000920416076	1322174714	/nfs/dbraw/zinc/17/47/14/1322174714.db2.gz	RDYLCGRTRJHAAP-GFCCVEGCSA-N	0	3	342.449	3.061	20	30		EGEDHN
C[C@@H](Cc1ccc(F)cc1)C(=O)C(C#N)C(=O)NC1CCCCC1	ZINC000921131064	1322260374	/nfs/dbraw/zinc/26/03/74/1322260374.db2.gz	GMNNZOSTYUTMPA-SUMWQHHRSA-N	0	3	330.403	3.162	20	30		EGEDHN
N#CC(C(=O)[C@@H]1CC(=O)N[C@@H]2CCCC[C@@H]21)c1ccc2ccccc2n1	ZINC000850740911	1322281260	/nfs/dbraw/zinc/28/12/60/1322281260.db2.gz	ATKHFZRWHGHGOP-XLMAVXFVSA-N	0	3	347.418	3.106	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)CC2(C#N)CCCCC2)c1	ZINC000850757694	1322284125	/nfs/dbraw/zinc/28/41/25/1322284125.db2.gz	OZNFLBZJLKWABX-MRXNPFEDSA-N	0	3	339.395	3.207	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@@H]1CCCN(C(=O)C2=CCCC2)C1	ZINC001023932356	1323038614	/nfs/dbraw/zinc/03/86/14/1323038614.db2.gz	RRSIFGYZLVQQEH-HNNXBMFYSA-N	0	3	341.430	3.136	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@H](CNCc2c(F)cccc2Cl)C1	ZINC001023978669	1323062009	/nfs/dbraw/zinc/06/20/09/1323062009.db2.gz	BCQDZBBCRCGUKY-OAHLLOKOSA-N	0	3	348.849	3.221	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H](CNCc2ccccc2C#N)C1)C1CCC1	ZINC001024037280	1323089656	/nfs/dbraw/zinc/08/96/56/1323089656.db2.gz	ZQIIPLOWCHKJPZ-IRXDYDNUSA-N	0	3	339.483	3.323	20	30		EGEDHN
C#CCOCCN1CCC(O)(c2ccc(-c3ccccc3)cc2)CC1	ZINC000851994768	1323127479	/nfs/dbraw/zinc/12/74/79/1323127479.db2.gz	JXWLPOJZNCMLQU-UHFFFAOYSA-N	0	3	335.447	3.287	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1cc(-c2cccnc2)ccc1C	ZINC000931210419	1329071606	/nfs/dbraw/zinc/07/16/06/1329071606.db2.gz	FIFWRYIUVTUCRK-UHFFFAOYSA-N	0	3	336.439	3.134	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H](CNCc2nc(C)cs2)C1	ZINC001024135099	1323160869	/nfs/dbraw/zinc/16/08/69/1323160869.db2.gz	IUNYGRILVPKISH-YJBOKZPZSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H](CNCc2ccn(C(C)C)n2)C1	ZINC001024138109	1323163085	/nfs/dbraw/zinc/16/30/85/1323163085.db2.gz	ZRCSUCYTQAHANM-YLJYHZDGSA-N	0	3	346.519	3.395	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H](CNCc3ccn(C(C)C)n3)C2)C1	ZINC001024145872	1323171555	/nfs/dbraw/zinc/17/15/55/1323171555.db2.gz	JHFWNQSCKCVHQF-QGZVFWFLSA-N	0	3	344.503	3.149	20	30		EGEDHN
CN(CC(=O)C(C#N)c1nc2ccccc2s1)C[C@@H]1CC1(C)C	ZINC000852771141	1323239867	/nfs/dbraw/zinc/23/98/67/1323239867.db2.gz	CGDAWHKDXZTJKI-STQMWFEESA-N	0	3	327.453	3.450	20	30		EGEDHN
C=CCCN1CCCC[C@H]1CNC(=O)c1sc(C2CC2)nc1C	ZINC001024434745	1323393687	/nfs/dbraw/zinc/39/36/87/1323393687.db2.gz	GTRNAPSFOMFNRE-HNNXBMFYSA-N	0	3	333.501	3.489	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cn(-c2ccccc2)cn1	ZINC001024452329	1323409416	/nfs/dbraw/zinc/40/94/16/1323409416.db2.gz	JBCKOUQHIPTRTN-GOSISDBHSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=CCCN1CCCC[C@@H]1CNC(=O)c1conc1C1CCCC1	ZINC001024478970	1323431245	/nfs/dbraw/zinc/43/12/45/1323431245.db2.gz	WTQQPIKTZWGJGJ-MRXNPFEDSA-N	0	3	331.460	3.493	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccc2nc(C)oc2c1	ZINC001024492417	1323442828	/nfs/dbraw/zinc/44/28/28/1323442828.db2.gz	MEUXVEPWTCMLAL-MRXNPFEDSA-N	0	3	327.428	3.297	20	30		EGEDHN
C=CCCN1CCCC[C@H]1CNC(=O)c1c(C)noc1C(F)F	ZINC001024499976	1323448003	/nfs/dbraw/zinc/44/80/03/1323448003.db2.gz	SGLBRVNSZMKDOU-LBPRGKRZSA-N	0	3	327.375	3.081	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1nc2ccccc2cc1C	ZINC001024563304	1323505207	/nfs/dbraw/zinc/50/52/07/1323505207.db2.gz	XUJXYLFZGNJZFZ-SFHVURJKSA-N	0	3	335.451	3.151	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cnc(C)nc1C(C)C	ZINC001024689261	1323604204	/nfs/dbraw/zinc/60/42/04/1323604204.db2.gz	CGUQAFPYNNBVPE-INIZCTEOSA-N	0	3	330.476	3.069	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cnc(C(C)C)nc1C	ZINC001024693311	1323608518	/nfs/dbraw/zinc/60/85/18/1323608518.db2.gz	XLQAFVTYIKLOQS-INIZCTEOSA-N	0	3	330.476	3.069	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)NC[C@H]1CCCCN1CC=C(C)C	ZINC001024700790	1323615332	/nfs/dbraw/zinc/61/53/32/1323615332.db2.gz	GHATVTLXVVMFOW-QYZOEREBSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cccc(-n2ccnc2)c1	ZINC001024737286	1323636841	/nfs/dbraw/zinc/63/68/41/1323636841.db2.gz	HUKIDJOYDWNYBS-LJQANCHMSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cccc(NC(C)=O)c1C	ZINC001024756386	1323657040	/nfs/dbraw/zinc/65/70/40/1323657040.db2.gz	QVBSNHXPBBPYNZ-QGZVFWFLSA-N	0	3	343.471	3.114	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCCCN2CC2=CCCCC2)nc1	ZINC001024763445	1323663556	/nfs/dbraw/zinc/66/35/56/1323663556.db2.gz	GMQPABAREDFBCY-LJQANCHMSA-N	0	3	337.467	3.148	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccc(CC(C)C)cc1	ZINC001024793749	1323699779	/nfs/dbraw/zinc/69/97/79/1323699779.db2.gz	ASWYSTYZGQXIHE-HXUWFJFHSA-N	0	3	326.484	3.493	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCCC[C@@H]1CNCc1sccc1Cl	ZINC001024902178	1323772713	/nfs/dbraw/zinc/77/27/13/1323772713.db2.gz	KCZRRODHMJWOMD-VXGBXAGGSA-N	0	3	325.865	3.032	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@@H]1CNCc1cccc(Cl)n1	ZINC001025040431	1323841512	/nfs/dbraw/zinc/84/15/12/1323841512.db2.gz	CMTXCQNBUQRAOU-OAHLLOKOSA-N	0	3	335.879	3.418	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001025040591	1323843063	/nfs/dbraw/zinc/84/30/63/1323843063.db2.gz	HFJAFXLQZXRBCT-QGZVFWFLSA-N	0	3	343.446	3.380	20	30		EGEDHN
Cc1cocc1C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)s1	ZINC001025045648	1323850174	/nfs/dbraw/zinc/85/01/74/1323850174.db2.gz	AHLGKCQUOFSZJW-CQSZACIVSA-N	0	3	343.452	3.306	20	30		EGEDHN
CC(C)[C@H](F)C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)c(F)c1	ZINC001025049137	1323854247	/nfs/dbraw/zinc/85/42/47/1323854247.db2.gz	SGZCQVZCVBSXKE-AEFFLSMTSA-N	0	3	349.425	3.162	20	30		EGEDHN
CCC1(C(=O)N2CCCC[C@H]2CNCc2ccc(C#N)s2)CC1	ZINC001025071803	1323874276	/nfs/dbraw/zinc/87/42/76/1323874276.db2.gz	MKMAVQXAYMSCQZ-AWEZNQCLSA-N	0	3	331.485	3.281	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCCC[C@@H]2CNCc2c(C)onc2CC)C1	ZINC001025074077	1323875167	/nfs/dbraw/zinc/87/51/67/1323875167.db2.gz	CNCKKNKQDAMSOJ-MRXNPFEDSA-N	0	3	345.487	3.372	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)c(F)c1	ZINC001025091482	1323888628	/nfs/dbraw/zinc/88/86/28/1323888628.db2.gz	JAFRHMYBDLFDBU-KBAYOESNSA-N	0	3	343.446	3.214	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@H]2[C@@H]2CCCCN2C(=O)C2CC2)c1	ZINC001025183146	1323950704	/nfs/dbraw/zinc/95/07/04/1323950704.db2.gz	JEFNBYPVCCFTKW-PMACEKPBSA-N	0	3	337.467	3.314	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1conc1C(C)C	ZINC001025236104	1324025452	/nfs/dbraw/zinc/02/54/52/1324025452.db2.gz	DGAWWRNUDBHAHW-SJORKVTESA-N	0	3	331.460	3.443	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ncccc1CC	ZINC001025244699	1324041311	/nfs/dbraw/zinc/04/13/11/1324041311.db2.gz	JSFPTPWCUALVFV-ROUUACIJSA-N	0	3	327.472	3.289	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccncc1CC	ZINC001025244416	1324042198	/nfs/dbraw/zinc/04/21/98/1324042198.db2.gz	JLOCCAUGDGGJBN-UXHICEINSA-N	0	3	339.483	3.126	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1c[nH]c2ccccc12	ZINC001025248404	1324048835	/nfs/dbraw/zinc/04/88/35/1324048835.db2.gz	ZLCJXSDGYHWRQO-UXHICEINSA-N	0	3	335.451	3.260	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc(C)c(F)c1	ZINC001025250689	1324053250	/nfs/dbraw/zinc/05/32/50/1324053250.db2.gz	MPZOSVNNVRMEOT-MOPGFXCFSA-N	0	3	328.431	3.226	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc(C)c(C)n1	ZINC001025252717	1324058937	/nfs/dbraw/zinc/05/89/37/1324058937.db2.gz	QIGJIGAIMBIZSI-PMACEKPBSA-N	0	3	339.483	3.181	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(C(C)C)on1	ZINC001025255477	1324063115	/nfs/dbraw/zinc/06/31/15/1324063115.db2.gz	QTDCKNIFKNAADG-IRXDYDNUSA-N	0	3	331.460	3.443	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(C)ccc1F	ZINC001025274371	1324091385	/nfs/dbraw/zinc/09/13/85/1324091385.db2.gz	XLCYSUUDOHYRLS-RBUKOAKNSA-N	0	3	328.431	3.226	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(C2CC2)no1	ZINC001025275166	1324094042	/nfs/dbraw/zinc/09/40/42/1324094042.db2.gz	TWYFRXNPDYTDRS-DLBZAZTESA-N	0	3	329.444	3.197	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)C(C1CC1)C1CC1	ZINC001025287524	1324109681	/nfs/dbraw/zinc/10/96/81/1324109681.db2.gz	ONOKEVUPPUQJEG-MOPGFXCFSA-N	0	3	328.500	3.291	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccccc1OC	ZINC001025291573	1324116359	/nfs/dbraw/zinc/11/63/59/1324116359.db2.gz	AXJHIYAFAFPOTF-RTBURBONSA-N	0	3	340.467	3.178	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc(F)cc1C	ZINC001025292994	1324119632	/nfs/dbraw/zinc/11/96/32/1324119632.db2.gz	OOZDMUMIQPBWNE-MOPGFXCFSA-N	0	3	328.431	3.226	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)C(C)(C)C(C)(F)F	ZINC001025293463	1324120878	/nfs/dbraw/zinc/12/08/78/1324120878.db2.gz	RVAHDLTXKPBLEU-GJZGRUSLSA-N	0	3	326.431	3.147	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)CCc1ccccc1F	ZINC001025294476	1324123833	/nfs/dbraw/zinc/12/38/33/1324123833.db2.gz	KIYBROSOCOPWHQ-WOJBJXKFSA-N	0	3	342.458	3.237	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)C1(c2ccccc2)CC1	ZINC001025295455	1324125476	/nfs/dbraw/zinc/12/54/76/1324125476.db2.gz	FZUQDJFPQCIXQO-WOJBJXKFSA-N	0	3	336.479	3.197	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc(F)cc1F	ZINC001025295846	1324126824	/nfs/dbraw/zinc/12/68/24/1324126824.db2.gz	HOCYCWLNNYAQPL-ZWKOTPCHSA-N	0	3	332.394	3.057	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cncnc1C(C)C	ZINC001025301228	1324133751	/nfs/dbraw/zinc/13/37/51/1324133751.db2.gz	IFIXNVNDWZZQTR-ZWKOTPCHSA-N	0	3	342.487	3.245	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cccc3scnc32)C1	ZINC001025419613	1324252292	/nfs/dbraw/zinc/25/22/92/1324252292.db2.gz	NIYXFGXIHWNYBL-CABCVRRESA-N	0	3	341.480	3.150	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(C(C)C)nc2)C1	ZINC001025443767	1324284262	/nfs/dbraw/zinc/28/42/62/1324284262.db2.gz	UHXDXEGKMQHHMG-SJLPKXTDSA-N	0	3	327.472	3.059	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)[C@H]2CC[C@H](C3CCC3)CC2)C1	ZINC001025446202	1324287597	/nfs/dbraw/zinc/28/75/97/1324287597.db2.gz	YOZKXIXGHQCHAM-VBSBHUPXSA-N	0	3	330.516	3.443	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cccc3ccc(C)nc32)C1	ZINC001025458071	1324299056	/nfs/dbraw/zinc/29/90/56/1324299056.db2.gz	YBKQZEZIVQUFPR-HKUYNNGSSA-N	0	3	349.478	3.397	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2scnc2C2CCCC2)C1	ZINC001025474094	1324319098	/nfs/dbraw/zinc/31/90/98/1324319098.db2.gz	IPXOKRKGLBNCIG-GOEBONIOSA-N	0	3	345.512	3.264	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc3c4c(cccc42)CC3)C1	ZINC001025480161	1324326195	/nfs/dbraw/zinc/32/61/95/1324326195.db2.gz	QOWJPFVVRCGYGG-QFBILLFUSA-N	0	3	346.474	3.402	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H](C)[C@@H]2CCCN(Cc3cccnc3)C2)cc1	ZINC001025501321	1324350630	/nfs/dbraw/zinc/35/06/30/1324350630.db2.gz	CRINBKXJFKXKEN-LAUBAEHRSA-N	0	3	347.462	3.093	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2nccc3ccccc32)C1	ZINC001025518808	1324362270	/nfs/dbraw/zinc/36/22/70/1324362270.db2.gz	IHJSVEOGNBMZDT-WMZOPIPTSA-N	0	3	335.451	3.088	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2nccc3ccccc32)C1	ZINC001025518807	1324362568	/nfs/dbraw/zinc/36/25/68/1324362568.db2.gz	IHJSVEOGNBMZDT-SJLPKXTDSA-N	0	3	335.451	3.088	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(F)c(Cl)cc2F)C1	ZINC001025520094	1324364623	/nfs/dbraw/zinc/36/46/23/1324364623.db2.gz	ASRGFOIVRIPLRI-NWDGAFQWSA-N	0	3	340.801	3.082	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(C(C)(C)C)oc2C)C1	ZINC001025545598	1324393094	/nfs/dbraw/zinc/39/30/94/1324393094.db2.gz	KINKIYAXYCVGQI-HOCLYGCPSA-N	0	3	330.472	3.349	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(OCC)c(C)c2)C1	ZINC001025549217	1324397376	/nfs/dbraw/zinc/39/73/76/1324397376.db2.gz	MLTBUXIRPFNUFZ-MJGOQNOKSA-N	0	3	342.483	3.247	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc3cc(F)ccc3o2)C1	ZINC001025548876	1324398554	/nfs/dbraw/zinc/39/85/54/1324398554.db2.gz	KVXWUFCVKXXZBH-KGLIPLIRSA-N	0	3	328.387	3.035	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc3c(C)cccn3c2)C1	ZINC001025595427	1324443658	/nfs/dbraw/zinc/44/36/58/1324443658.db2.gz	OCFMLHWOHSRSBM-ROUUACIJSA-N	0	3	337.467	3.101	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2c(F)cccc2Cl)C1	ZINC001025603191	1324450868	/nfs/dbraw/zinc/45/08/68/1324450868.db2.gz	RLNPFXVUZHPBDX-KBPBESRZSA-N	0	3	336.838	3.333	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC001025605774	1324454190	/nfs/dbraw/zinc/45/41/90/1324454190.db2.gz	CFSGORHNLDXNBQ-AEFFLSMTSA-N	0	3	326.484	3.448	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2coc3ccc(F)cc23)C1	ZINC001025607899	1324458982	/nfs/dbraw/zinc/45/89/82/1324458982.db2.gz	JEUNHGBEEYXIEW-GJZGRUSLSA-N	0	3	342.414	3.426	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)C23CC4CC(CC(C4)C2)C3)C1	ZINC001025610067	1324461382	/nfs/dbraw/zinc/46/13/82/1324461382.db2.gz	RBGIBWAIBISLRQ-AXMIXWAOSA-N	0	3	342.527	3.443	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2sccc2C2CC2)C1	ZINC001025611685	1324464800	/nfs/dbraw/zinc/46/48/00/1324464800.db2.gz	OBBOJZRGXOTLRK-ZBFHGGJFSA-N	0	3	330.497	3.479	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc3c(s2)CCCCC3)C1	ZINC001025613749	1324465568	/nfs/dbraw/zinc/46/55/68/1324465568.db2.gz	ZWUORDQKGNIUJO-NVXWUHKLSA-N	0	3	344.524	3.481	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(CCC)c(C)s2)C1	ZINC001025614182	1324466694	/nfs/dbraw/zinc/46/66/94/1324466694.db2.gz	HRNXCZJTCWMDOP-WMLDXEAASA-N	0	3	332.513	3.473	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(Cl)ccc2OC)C1	ZINC001025614980	1324467868	/nfs/dbraw/zinc/46/78/68/1324467868.db2.gz	QTTOPLJVPMOYCO-GJZGRUSLSA-N	0	3	348.874	3.202	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc3cccc(F)c3o2)C1	ZINC001025627976	1324479364	/nfs/dbraw/zinc/47/93/64/1324479364.db2.gz	MDJXATVKCRVIIO-HOCLYGCPSA-N	0	3	342.414	3.426	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H]3CC[C@@H](NCc4nocc4C)[C@@H]3C2)CC1	ZINC001026348674	1324744160	/nfs/dbraw/zinc/74/41/60/1324744160.db2.gz	PQCDQCCIAVOVAZ-RCCFBDPRSA-N	0	3	343.471	3.056	20	30		EGEDHN
CCC1(C(=O)N2C[C@@H]3CC[C@@H](NCc4ccccc4C#N)[C@H]3C2)CC1	ZINC001026353507	1324747066	/nfs/dbraw/zinc/74/70/66/1324747066.db2.gz	GJCKIJYHEAJNJK-GBESFXJTSA-N	0	3	337.467	3.075	20	30		EGEDHN
N#Cc1ccccc1CNC1CCC(NC(=O)[C@H]2CC=CCC2)CC1	ZINC001026451850	1324816112	/nfs/dbraw/zinc/81/61/12/1324816112.db2.gz	IWFLGTDCQBZAKZ-DZIBYMRMSA-N	0	3	337.467	3.432	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)C=C2CCC2)CC1	ZINC001026473905	1324832048	/nfs/dbraw/zinc/83/20/48/1324832048.db2.gz	CUHOFDQQQSSOLU-UHFFFAOYSA-N	0	3	327.266	3.022	20	30		EGEDHN
Cc1cocc1C(=O)NC1CCC(NCc2ccccc2C#N)CC1	ZINC001026542355	1324879823	/nfs/dbraw/zinc/87/98/23/1324879823.db2.gz	KUQUDPXJBQMOCZ-UHFFFAOYSA-N	0	3	337.423	3.291	20	30		EGEDHN
C=C1CC(C)(C(=O)NC2CCC(NCc3oc(C)nc3C)CC2)C1	ZINC001026555831	1324892780	/nfs/dbraw/zinc/89/27/80/1324892780.db2.gz	OCQTXYPWHXLFDU-UHFFFAOYSA-N	0	3	331.460	3.165	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)c2ocnc2C)C1	ZINC000963283934	1325066658	/nfs/dbraw/zinc/06/66/58/1325066658.db2.gz	YDHJPNBWUTVQAF-HUUCEWRRSA-N	0	3	337.851	3.052	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)c2ccns2)C1	ZINC000963311209	1325096140	/nfs/dbraw/zinc/09/61/40/1325096140.db2.gz	QLQLOCCTDHUQRZ-ZIAGYGMSSA-N	0	3	339.892	3.212	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCN(C(=O)C[C@H]2CC=CCC2)C1	ZINC001026999314	1325137122	/nfs/dbraw/zinc/13/71/22/1325137122.db2.gz	SPANAYIIGQQQKZ-ZWKOTPCHSA-N	0	3	337.467	3.243	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H](CNCc2ccn(C(C)C)n2)C1	ZINC001027041159	1325175635	/nfs/dbraw/zinc/17/56/35/1325175635.db2.gz	QJXDYCWHFBPIPM-APWZRJJASA-N	0	3	332.492	3.004	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@H](CNCc2cc(C3CC3)no2)C1	ZINC001027041106	1325175705	/nfs/dbraw/zinc/17/57/05/1325175705.db2.gz	PGBAYVCQEZXOOM-LIRRHRJNSA-N	0	3	331.460	3.092	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@H](CNCc2ccccc2C#N)C1)c1ccccc1	ZINC001027179139	1325277426	/nfs/dbraw/zinc/27/74/26/1325277426.db2.gz	RBXSYIJLAODAJV-QZTJIDSGSA-N	0	3	347.462	3.300	20	30		EGEDHN
Cc1ccc(C)c(C(=O)N2CC[C@@H](CNCc3ccccc3C#N)C2)c1	ZINC001027189092	1325290594	/nfs/dbraw/zinc/29/05/94/1325290594.db2.gz	LAJVZHKAKQYLSW-SFHVURJKSA-N	0	3	347.462	3.427	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)c2ccccc2)C1	ZINC001027277829	1325396089	/nfs/dbraw/zinc/39/60/89/1325396089.db2.gz	MWQXTZVGAGLRAX-HXUWFJFHSA-N	0	3	333.435	3.295	20	30		EGEDHN
Cc1occc1C(=O)N1CCC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001027289797	1325423442	/nfs/dbraw/zinc/42/34/42/1325423442.db2.gz	JRWFPBSMVRLKQF-GOSISDBHSA-N	0	3	337.423	3.196	20	30		EGEDHN
C[N@H+](Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)c2ccccc2[O-])C1	ZINC001027308786	1325457674	/nfs/dbraw/zinc/45/76/74/1325457674.db2.gz	RXGZYWBTRZHZSZ-GOSISDBHSA-N	0	3	349.434	3.000	20	30		EGEDHN
C[N@@H+](Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)c2ccccc2[O-])C1	ZINC001027308786	1325457681	/nfs/dbraw/zinc/45/76/81/1325457681.db2.gz	RXGZYWBTRZHZSZ-GOSISDBHSA-N	0	3	349.434	3.000	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@@H](N(C)Cc2ccc(Cl)c(F)c2)C1	ZINC001027336839	1325494604	/nfs/dbraw/zinc/49/46/04/1325494604.db2.gz	UTJJBJDPMMAKCV-TZMCWYRMSA-N	0	3	337.826	3.062	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CCC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001027365053	1325555627	/nfs/dbraw/zinc/55/56/27/1325555627.db2.gz	MRRGSLAFYAXRAW-QGZVFWFLSA-N	0	3	329.419	3.244	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)/C=C/c2ccc[nH]2)C1	ZINC001027382319	1325580669	/nfs/dbraw/zinc/58/06/69/1325580669.db2.gz	QQPDRKQUOOCKQJ-CFGKVWFZSA-N	0	3	348.450	3.023	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)[C@@H]2CCC2(F)F)C1	ZINC001027458456	1327701313	/nfs/dbraw/zinc/70/13/13/1327701313.db2.gz	JNBWVBPPMRUMIH-IRXDYDNUSA-N	0	3	347.409	3.026	20	30		EGEDHN
C=C(Cl)CN(C)[C@@H]1CCCN(C(=O)c2[nH]nc3ccc(C)cc32)C1	ZINC001027477720	1327732382	/nfs/dbraw/zinc/73/23/82/1327732382.db2.gz	KWRGUKLJGLBACJ-CQSZACIVSA-N	0	3	346.862	3.160	20	30		EGEDHN
C[C@@H](NC[C@H]1CCCN1CC(F)(F)F)c1ccc(C#N)cc1F	ZINC000926919440	1327776704	/nfs/dbraw/zinc/77/67/04/1327776704.db2.gz	DBJXTNCHRCJKLV-DGCLKSJQSA-N	0	3	329.341	3.375	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@@H](N(C)Cc3cccc(C#N)c3)C2)CC1	ZINC001027562431	1327883430	/nfs/dbraw/zinc/88/34/30/1327883430.db2.gz	PFDRZQKTYULHJC-GOSISDBHSA-N	0	3	325.456	3.171	20	30		EGEDHN
C[C@H](NCCNc1ccc(C#N)cn1)c1ccccc1OC(F)F	ZINC000927163131	1327900766	/nfs/dbraw/zinc/90/07/66/1327900766.db2.gz	DFIKRLHPXGFDAX-LBPRGKRZSA-N	0	3	332.354	3.317	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001027585577	1327922821	/nfs/dbraw/zinc/92/28/21/1327922821.db2.gz	LGBDAYKGHJYEIU-CEXWTWQISA-N	0	3	325.456	3.027	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001027605916	1327962899	/nfs/dbraw/zinc/96/28/99/1327962899.db2.gz	YYAVDWDEGNQMHF-VQIMIIECSA-N	0	3	327.472	3.273	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)[C@@H]2C[C@H]2C2CC2)C1	ZINC001027608763	1327970312	/nfs/dbraw/zinc/97/03/12/1327970312.db2.gz	LHUOKZVSUSLDSL-SLFFLAALSA-N	0	3	337.467	3.027	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)c2coc3ccc(Cl)cc23)C1	ZINC001027664489	1328055268	/nfs/dbraw/zinc/05/52/68/1328055268.db2.gz	CEIPJLCCMKNHKK-AWEZNQCLSA-N	0	3	330.815	3.256	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1ccc(COC)cc1)C2	ZINC000965907465	1328095909	/nfs/dbraw/zinc/09/59/09/1328095909.db2.gz	IOVONFCWYUAYNT-UHFFFAOYSA-N	0	3	348.874	3.216	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2cc3ccccc3nc2C)C1	ZINC000966494442	1328324154	/nfs/dbraw/zinc/32/41/54/1328324154.db2.gz	XFEWLCHVNXLWNF-MGPUTAFESA-N	0	3	335.451	3.007	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H]1CNC(=O)c1sc(Cl)nc1C	ZINC001027906281	1328378875	/nfs/dbraw/zinc/37/88/75/1328378875.db2.gz	NDBYEVWKKAPFRV-GFCCVEGCSA-N	0	3	327.881	3.265	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@H]1CCCN1Cc1cccc(C)c1	ZINC001027931852	1328409509	/nfs/dbraw/zinc/40/95/09/1328409509.db2.gz	MDQZILXCCUEHAJ-LJQANCHMSA-N	0	3	337.467	3.377	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)Cc2ccc(C)c(Cl)c2)C1	ZINC000966907883	1328468563	/nfs/dbraw/zinc/46/85/63/1328468563.db2.gz	HPVSDLBSYBRKIQ-CRAIPNDOSA-N	0	3	332.875	3.041	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)CCC4CC4)C3)CC2)c1	ZINC001050465146	1348272550	/nfs/dbraw/zinc/27/25/50/1348272550.db2.gz	RKCDBMRJQXDZDM-UHFFFAOYSA-N	0	3	337.467	3.173	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC2(C1)CCN(CCc1csc(C)n1)CC2	ZINC001050617921	1348304202	/nfs/dbraw/zinc/30/42/02/1348304202.db2.gz	OOVQYBMNCDCVKV-UHFFFAOYSA-N	0	3	347.528	3.131	20	30		EGEDHN
C#CC[C@H](CCOC)NCc1cc(OC)c(Br)cc1F	ZINC000865645842	1329724479	/nfs/dbraw/zinc/72/44/79/1329724479.db2.gz	BAZQUKVZZVPGAU-GFCCVEGCSA-N	0	3	344.224	3.115	20	30		EGEDHN
C[C@H](NC(=O)Nc1sccc1C#N)[C@@H](c1ccccc1)N(C)C	ZINC000931836784	1329765291	/nfs/dbraw/zinc/76/52/91/1329765291.db2.gz	AOXQSNQDMDGSLT-WFASDCNBSA-N	0	3	328.441	3.433	20	30		EGEDHN
C[Si](C)(CCN1CCC[C@H](C#N)C1)CCN1CCC[C@H](C#N)C1	ZINC000932150333	1329789256	/nfs/dbraw/zinc/78/92/56/1329789256.db2.gz	BNGLUHCYPOWKCD-QZTJIDSGSA-N	0	3	332.568	3.166	20	30		EGEDHN
Cc1ccc(C#N)cc1C(=O)Nc1ccc(CN2CCC(O)CC2)cc1	ZINC000935140915	1330030961	/nfs/dbraw/zinc/03/09/61/1330030961.db2.gz	ZGPJYSFSDQRUFP-UHFFFAOYSA-N	0	3	349.434	3.076	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(CC(C)C)s2)[C@@H](C)C1	ZINC000942138279	1331844026	/nfs/dbraw/zinc/84/40/26/1331844026.db2.gz	WMBZIBBXFUSBHY-DOTOQJQBSA-N	0	3	332.513	3.410	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(C)CCC(F)(F)CC2)[C@H](C)C1	ZINC000942192214	1331872582	/nfs/dbraw/zinc/87/25/82/1331872582.db2.gz	MMUFLNODIPGFRE-CABCVRRESA-N	0	3	326.431	3.052	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3ccccc3s2)[C@@H](C)C1	ZINC000942315199	1331901646	/nfs/dbraw/zinc/90/16/46/1331901646.db2.gz	SPTOENFJAXXKLW-HOCLYGCPSA-N	0	3	326.465	3.365	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(CC(C)C)cc2)[C@@H](C)C1	ZINC000942346078	1331908974	/nfs/dbraw/zinc/90/89/74/1331908974.db2.gz	XANJXAALBLXWQL-RXVVDRJESA-N	0	3	340.511	3.278	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cn(CC)c3ccccc23)[C@H](C)C1	ZINC000942390748	1331920917	/nfs/dbraw/zinc/92/09/17/1331920917.db2.gz	BSFVURSDNHZUOK-APWZRJJASA-N	0	3	337.467	3.125	20	30		EGEDHN
Cc1cocc1C(=O)N[C@@H]1CCN(Cc2ccc(C#N)cc2)C[C@H]1C	ZINC000942558311	1331973202	/nfs/dbraw/zinc/97/32/02/1331973202.db2.gz	VHOMWBQUMMNJNQ-AUUYWEPGSA-N	0	3	337.423	3.100	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3cncc(C)c3)C[C@H]2C)C1	ZINC000942601897	1331998084	/nfs/dbraw/zinc/99/80/84/1331998084.db2.gz	AINURTMNLJNTDV-SJLPKXTDSA-N	0	3	327.472	3.073	20	30		EGEDHN
C[C@@H]1CN(Cc2cccc(C#N)c2)CC[C@H]1NC(=O)C1(C)CC=CC1	ZINC000942602294	1331999407	/nfs/dbraw/zinc/99/94/07/1331999407.db2.gz	HBIZDPIENIOQJL-VQIMIIECSA-N	0	3	337.467	3.241	20	30		EGEDHN
C[C@H]1CN(Cc2ccc(C#N)cc2)CC[C@H]1NC(=O)C1(C)CC=CC1	ZINC000942603171	1332001144	/nfs/dbraw/zinc/00/11/44/1332001144.db2.gz	TUOVJUXGNJCVIX-QFBILLFUSA-N	0	3	337.467	3.241	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3sc(C)nc3C)C[C@H]2C)C1	ZINC000942603343	1332001253	/nfs/dbraw/zinc/00/12/53/1332001253.db2.gz	VXNLSWBDCBVIBF-CZUORRHYSA-N	0	3	347.528	3.443	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(F)c3ccccc23)[C@@H](C)C1	ZINC000942938721	1332062948	/nfs/dbraw/zinc/06/29/48/1332062948.db2.gz	MHVWAFWILKFNRN-MGPUTAFESA-N	0	3	338.426	3.442	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2ccc(C(C)(C)C)cc2)[C@H](C)C1	ZINC000942959038	1332067037	/nfs/dbraw/zinc/06/70/37/1332067037.db2.gz	JELXYLJTCJSIFN-YLJYHZDGSA-N	0	3	340.511	3.377	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C(C)(C)c2cccc(Cl)c2)[C@H](C)C1	ZINC000943209587	1332121822	/nfs/dbraw/zinc/12/18/22/1332121822.db2.gz	RDHJZGFXZJCNMT-CRAIPNDOSA-N	0	3	346.902	3.468	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc(-c3ccccc3)nc2)[C@H](C)C1	ZINC000943756625	1332255476	/nfs/dbraw/zinc/25/54/76/1332255476.db2.gz	SMXLAUMIMXAQJN-APWZRJJASA-N	0	3	335.451	3.375	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2[nH]ccc2-c2ccccc2)[C@H](C)C1	ZINC000944135239	1332333149	/nfs/dbraw/zinc/33/31/49/1332333149.db2.gz	JHXSBCVKOPRKBS-APWZRJJASA-N	0	3	335.451	3.145	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@H](C)C1	ZINC000944303110	1332367324	/nfs/dbraw/zinc/36/73/24/1332367324.db2.gz	AWOUACGNAOYJPN-CZUORRHYSA-N	0	3	338.373	3.169	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C2(c3ccc(C)cc3)CCC2)[C@@H](C)C1	ZINC000945365620	1332568407	/nfs/dbraw/zinc/56/84/07/1332568407.db2.gz	LHJVIVNDJVIUKI-AZUAARDMSA-N	0	3	338.495	3.267	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C(C)(F)F)cc2)[C@H](C)C1	ZINC000946310289	1332783955	/nfs/dbraw/zinc/78/39/55/1332783955.db2.gz	DURXIZRKHJXEHS-PBHICJAKSA-N	0	3	334.410	3.262	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@H]3CCCC34CC4)CC[C@@H]2C1	ZINC000946642835	1332869557	/nfs/dbraw/zinc/86/95/57/1332869557.db2.gz	REPNNRHRKZXKOH-IXDOHACOSA-N	0	3	336.907	3.490	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CN(Cc3nc(C)oc3C)C[C@H]2CC1	ZINC000946707115	1332881635	/nfs/dbraw/zinc/88/16/35/1332881635.db2.gz	GQJHXEABIZVPBV-CALCHBBNSA-N	0	3	345.487	3.174	20	30		EGEDHN
N#Cc1ccccc1CN1C[C@@H]2CCN(C(=O)[C@@H]3CC34CC4)CC[C@@H]2C1	ZINC000946797762	1332901422	/nfs/dbraw/zinc/90/14/22/1332901422.db2.gz	JIHLZWSEQRFQSS-ZCNNSNEGSA-N	0	3	349.478	3.029	20	30		EGEDHN
Cc1cccc(C(=O)N[C@H]2CCN(Cc3cccc(C#N)c3)[C@H](C)C2)n1	ZINC000947075315	1333003218	/nfs/dbraw/zinc/00/32/18/1333003218.db2.gz	PEDLXXOKXCZHMR-APWZRJJASA-N	0	3	348.450	3.045	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(F)cc3ccncc32)C[C@@H]1C	ZINC000947318227	1333086781	/nfs/dbraw/zinc/08/67/81/1333086781.db2.gz	FVSBVSDILJVYIK-BBRMVZONSA-N	0	3	327.403	3.143	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc3nccc(C)c3c2)C[C@H]1C	ZINC000947346865	1333098121	/nfs/dbraw/zinc/09/81/21/1333098121.db2.gz	BNMBDYIQEQCQMH-SJLPKXTDSA-N	0	3	335.451	3.149	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cn(C)c3ccc(F)cc23)C[C@H]1C	ZINC000947399576	1333115424	/nfs/dbraw/zinc/11/54/24/1333115424.db2.gz	HGZPRVAYUGVGDA-HIFRSBDPSA-N	0	3	329.419	3.086	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3c([nH]2)c(F)ccc3C)C[C@H]1C	ZINC000947467367	1333139814	/nfs/dbraw/zinc/13/98/14/1333139814.db2.gz	AITLPWPJSMQLHN-HUUCEWRRSA-N	0	3	341.430	3.221	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2sccc2-n2cccc2)C[C@@H]1C	ZINC000947599352	1333188536	/nfs/dbraw/zinc/18/85/36/1333188536.db2.gz	UBPNCVKSFQPKJZ-JKSUJKDBSA-N	0	3	341.480	3.145	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)C(C)(C)C2CC2)CCN1Cc1cccc(C#N)c1	ZINC000947632746	1333201569	/nfs/dbraw/zinc/20/15/69/1333201569.db2.gz	FOSQVMFJIKIARS-KXBFYZLASA-N	0	3	339.483	3.464	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)C2(C)CC=CC2)CCN1Cc1ccc(C#N)cc1	ZINC000947693114	1333227054	/nfs/dbraw/zinc/22/70/54/1333227054.db2.gz	HDLKYVQZZVDIOJ-APWZRJJASA-N	0	3	337.467	3.384	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2c(F)ccc(F)c2Cl)C[C@@H]1C	ZINC000947741192	1333246960	/nfs/dbraw/zinc/24/69/60/1333246960.db2.gz	JCBYMKXWPRSOGU-NWDGAFQWSA-N	0	3	340.801	3.224	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnc(-c3ccoc3)s2)C[C@@H]1C	ZINC000947778364	1333258469	/nfs/dbraw/zinc/25/84/69/1333258469.db2.gz	BROKSPPMGHTXPR-GXTWGEPZSA-N	0	3	331.441	3.172	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(OC)c(C3CC3)c2)C[C@@H]1C	ZINC000947868721	1333285975	/nfs/dbraw/zinc/28/59/75/1333285975.db2.gz	YEBKTRCMZBOMGX-YJBOKZPZSA-N	0	3	340.467	3.179	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2c[nH]nc2C2CCCCC2)C[C@@H]1C	ZINC000947917152	1333306921	/nfs/dbraw/zinc/30/69/21/1333306921.db2.gz	VMXUTVIXQNOELJ-GOEBONIOSA-N	0	3	330.476	3.226	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cnc(-c3ccco3)s2)C[C@@H]1C	ZINC000947944124	1333314513	/nfs/dbraw/zinc/31/45/13/1333314513.db2.gz	RBVKIUNGUIOCMH-UONOGXRCSA-N	0	3	343.452	3.009	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)C[C@@H]1C	ZINC000947961781	1333321977	/nfs/dbraw/zinc/32/19/77/1333321977.db2.gz	FMKVQQIWZLGCMF-XJKSGUPXSA-N	0	3	338.373	3.311	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(F)c(F)cc2Cl)C[C@H]1C	ZINC000947999006	1333337016	/nfs/dbraw/zinc/33/70/16/1333337016.db2.gz	RZYBESCCUOWXPT-MNOVXSKESA-N	0	3	328.790	3.387	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3ccc(Cl)cc3)CC2)C[C@H]1C	ZINC000948001632	1333337844	/nfs/dbraw/zinc/33/78/44/1333337844.db2.gz	CNMLKZFZDHDRAM-QAPCUYQASA-N	0	3	344.886	3.364	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(OCC(C)C)cc2)C[C@H]1C	ZINC000948002320	1333338594	/nfs/dbraw/zinc/33/85/94/1333338594.db2.gz	OGORBKNUGYFXFG-MJGOQNOKSA-N	0	3	342.483	3.327	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(OC(C)C)cc2)C[C@@H]1C	ZINC000948003071	1333339748	/nfs/dbraw/zinc/33/97/48/1333339748.db2.gz	XULDSQGJTXUHCB-FUHWJXTLSA-N	0	3	328.456	3.080	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cccc(OCC(C)C)c2)C[C@@H]1C	ZINC000948016418	1333342956	/nfs/dbraw/zinc/34/29/56/1333342956.db2.gz	OITUVUWIQRWYTE-WMZOPIPTSA-N	0	3	330.472	3.490	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccccc2OCC2CC2)C[C@H]1C	ZINC000948061480	1333359763	/nfs/dbraw/zinc/35/97/63/1333359763.db2.gz	VBVGBKGRQJBASN-NVXWUHKLSA-N	0	3	328.456	3.244	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccccc2OCC2CC2)C[C@H]1C	ZINC000948067794	1333362765	/nfs/dbraw/zinc/36/27/65/1333362765.db2.gz	YZRMUSLBSXTPKF-SJLPKXTDSA-N	0	3	340.467	3.081	20	30		EGEDHN
COc1ccc(CN2CCC[C@H](N(C)C(=O)C(C)C)CC2)cc1C#N	ZINC000948205267	1333422771	/nfs/dbraw/zinc/42/27/71/1333422771.db2.gz	FNVHNVOYNRPUAJ-SFHVURJKSA-N	0	3	343.471	3.036	20	30		EGEDHN
CN(C(=O)[C@@H]1CC1(F)F)[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948355457	1333490996	/nfs/dbraw/zinc/49/09/96/1333490996.db2.gz	ZMLKAGSKCOWKFT-SJORKVTESA-N	0	3	347.409	3.026	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cc(C)c(OC)c(C)c2)CC1	ZINC000948397355	1333509027	/nfs/dbraw/zinc/50/90/27/1333509027.db2.gz	QFXPKHMOOCJZFC-LJQANCHMSA-N	0	3	342.483	3.262	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cccc(OCCC)c2)CC1	ZINC000948416890	1333517520	/nfs/dbraw/zinc/51/75/20/1333517520.db2.gz	RTFFALUKXHWWIC-IBGZPJMESA-N	0	3	342.483	3.425	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2nc(C(C)(C)C)cs2)CC1	ZINC000948456025	1333532732	/nfs/dbraw/zinc/53/27/32/1333532732.db2.gz	HWFUNYAVNCBJBE-AWEZNQCLSA-N	0	3	333.501	3.000	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cc(F)c(C)cc2F)CC1	ZINC000948456974	1333533034	/nfs/dbraw/zinc/53/30/34/1333533034.db2.gz	QATHDGRYFCRPCV-OAHLLOKOSA-N	0	3	334.410	3.223	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)Cc2cc3ccccc3o2)CC1	ZINC000948658697	1333616724	/nfs/dbraw/zinc/61/67/24/1333616724.db2.gz	PZTXNYFMZMHJTP-GOSISDBHSA-N	0	3	338.451	3.312	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)[C@@H]2CCc3ccccc3C2)CC1	ZINC000948813162	1333694425	/nfs/dbraw/zinc/69/44/25/1333694425.db2.gz	VQCHMOGLWYIZGY-RTWAWAEBSA-N	0	3	338.495	3.128	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cccc(OCC)c2)CC1	ZINC000948816575	1333695186	/nfs/dbraw/zinc/69/51/86/1333695186.db2.gz	JRTSQSJQMQNLAY-SFHVURJKSA-N	0	3	328.456	3.035	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)[C@]2(c3ccccc3)CC2(C)C)CC1	ZINC000948876711	1333716605	/nfs/dbraw/zinc/71/66/05/1333716605.db2.gz	BNDAOUYWPZLBKH-DENIHFKCSA-N	0	3	338.495	3.300	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@@H]1CNC(=O)[C@@H]1CCCOC1	ZINC000948899234	1333724474	/nfs/dbraw/zinc/72/44/74/1333724474.db2.gz	RMYNIDAFJUFSDX-QUCCMNQESA-N	0	3	342.483	3.095	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@H]1CNC(=O)c1cc2c([nH]1)CCC2	ZINC000948978360	1333755191	/nfs/dbraw/zinc/75/51/91/1333755191.db2.gz	KQIFVQCUJUZATA-OAQYLSRUSA-N	0	3	349.478	3.409	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)c3cccc(F)c3)CC2)C1	ZINC000949285661	1333815237	/nfs/dbraw/zinc/81/52/37/1333815237.db2.gz	QRKMZSKKINJIJB-UHFFFAOYSA-N	0	3	346.446	3.099	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@@H]3C[C@H]3CC(C)(C)C)CC2)C1	ZINC000949370121	1333832201	/nfs/dbraw/zinc/83/22/01/1333832201.db2.gz	KPSONDLTTKIDLX-ZWKOTPCHSA-N	0	3	348.531	3.328	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@@]3(C)CCC[C@H]3C)CC2)C1	ZINC000949463179	1333854374	/nfs/dbraw/zinc/85/43/74/1333854374.db2.gz	KXQXQZULMVIZSY-QUCCMNQESA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C3(CC)CCCC3)CC2)C1	ZINC000949504035	1333862159	/nfs/dbraw/zinc/86/21/59/1333862159.db2.gz	MYEUEZGVKWXSKQ-UHFFFAOYSA-N	0	3	334.504	3.226	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@H]3CCCC[C@@H]3CC)CC2)C1	ZINC000949504789	1333862541	/nfs/dbraw/zinc/86/25/41/1333862541.db2.gz	UTQPYTSQOVCIRJ-OALUTQOASA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)C[C@@H]3CCCC[C@H]3C)CC2)C1	ZINC000949533697	1333869983	/nfs/dbraw/zinc/86/99/83/1333869983.db2.gz	DRWIQZWABVWWDV-MOPGFXCFSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@H]3CCCCC3(C)C)CC2)C1	ZINC000949534491	1333870310	/nfs/dbraw/zinc/87/03/10/1333870310.db2.gz	ZVRQHQLPLNXHRF-GOSISDBHSA-N	0	3	348.531	3.472	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)Cc2ccc(CC(C)C)cc2)C1	ZINC000967274681	1335684099	/nfs/dbraw/zinc/68/40/99/1335684099.db2.gz	RQYIJDJBQRCOIV-NQIIRXRSSA-N	0	3	340.511	3.278	20	30		EGEDHN
C=C(C)CCN1CC[C@H](C)[C@H](NC(=O)c2conc2C(F)(F)F)C1	ZINC000967397579	1335726214	/nfs/dbraw/zinc/72/62/14/1335726214.db2.gz	QAKHFNBYXOMITP-WCQYABFASA-N	0	3	345.365	3.100	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2noc3c2CC(C)(C)CC3)C1	ZINC000967424558	1335734531	/nfs/dbraw/zinc/73/45/31/1335734531.db2.gz	SDIVQQYDGLZQFE-ZBFHGGJFSA-N	0	3	345.487	3.206	20	30		EGEDHN
C=C(C)CCN1CC[C@H](C)[C@@H](NC(=O)c2ocnc2C(F)(F)F)C1	ZINC000967435887	1335738352	/nfs/dbraw/zinc/73/83/52/1335738352.db2.gz	OSSXDTXEKMSCBN-RYUDHWBXSA-N	0	3	345.365	3.100	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)C2(c3cccc(C)c3)CCC2)C1	ZINC000967660735	1335803069	/nfs/dbraw/zinc/80/30/69/1335803069.db2.gz	XLFKMNWWXBBBOR-QUCCMNQESA-N	0	3	338.495	3.267	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccc(C(C)C)nc2CC)C1	ZINC000968334834	1335892769	/nfs/dbraw/zinc/89/27/69/1335892769.db2.gz	KZFYNFFFHCWIIR-OXQOHEQNSA-N	0	3	341.499	3.231	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)C(C)(C)c2cccc(Cl)c2)C1	ZINC000968364057	1335903808	/nfs/dbraw/zinc/90/38/08/1335903808.db2.gz	DLBPZHOAZSGPDH-CRAIPNDOSA-N	0	3	346.902	3.468	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2cnc(-c3ccoc3)s2)C1	ZINC000968400154	1335920533	/nfs/dbraw/zinc/92/05/33/1335920533.db2.gz	MVYACYWCPJCNAI-DZGCQCFKSA-N	0	3	345.468	3.419	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2cc3c(C)cccn3c2)C1	ZINC000968539934	1335956835	/nfs/dbraw/zinc/95/68/35/1335956835.db2.gz	RCBXEVAKYXZABU-MAUKXSAKSA-N	0	3	325.456	3.264	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2cc(F)c(F)cc2Cl)C1	ZINC000968609647	1335982091	/nfs/dbraw/zinc/98/20/91/1335982091.db2.gz	JZBHEAOWUKXHDV-BDJLRTHQSA-N	0	3	340.801	3.082	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2cccc(OCC(C)C)c2)C1	ZINC000968628328	1335989080	/nfs/dbraw/zinc/98/90/80/1335989080.db2.gz	WNMHPXJYVGJCGO-FXAWDEMLSA-N	0	3	342.483	3.185	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H](NCc2ccc(C)nc2C)C1	ZINC000968795041	1336054161	/nfs/dbraw/zinc/05/41/61/1336054161.db2.gz	CXJXEHGDROJTAF-MRXNPFEDSA-N	0	3	335.879	3.168	20	30		EGEDHN
C#CCCN1CCCCC[C@@H]1CNC(=O)c1sc(C2CC2)nc1C	ZINC000968855908	1336069687	/nfs/dbraw/zinc/06/96/87/1336069687.db2.gz	BUEINEYADVBVLG-MRXNPFEDSA-N	0	3	345.512	3.327	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)[C@@H]1CCc2cc(OC)ccc21	ZINC000968884753	1336079908	/nfs/dbraw/zinc/07/99/08/1336079908.db2.gz	BGQDTTZXRFHVCZ-YLJYHZDGSA-N	0	3	342.483	3.272	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1nc(Cl)sc1C	ZINC000968944200	1336099623	/nfs/dbraw/zinc/09/96/23/1336099623.db2.gz	HNVXSXXGEHKFJO-GFCCVEGCSA-N	0	3	327.881	3.265	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1cc(C)n(CC)c1C	ZINC000968936915	1336096720	/nfs/dbraw/zinc/09/67/20/1336096720.db2.gz	VAAHSTKDGVSYBK-GOSISDBHSA-N	0	3	329.488	3.123	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cc(-c2ccccc2)n[nH]1	ZINC000968941627	1336098092	/nfs/dbraw/zinc/09/80/92/1336098092.db2.gz	POPVGULLCDFKDE-QGZVFWFLSA-N	0	3	338.455	3.237	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccc2c(c1)[C@@H](C)CO2	ZINC000968998304	1336114829	/nfs/dbraw/zinc/11/48/29/1336114829.db2.gz	RMIICYHALIUOFM-RDJZCZTQSA-N	0	3	328.456	3.343	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)[C@H]1CCCC(F)(F)C1	ZINC000969025817	1336121923	/nfs/dbraw/zinc/12/19/23/1336121923.db2.gz	WDYLJRCDWKRBOY-HOTGVXAUSA-N	0	3	326.431	3.196	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)NC[C@H]1CCCCCN1Cc1ccc(C#N)cc1	ZINC000969039412	1336122882	/nfs/dbraw/zinc/12/28/82/1336122882.db2.gz	KPDQNGGIEBVLOG-VAMGGRTRSA-N	0	3	339.483	3.465	20	30		EGEDHN
N#Cc1ccc(CN2CCCCC[C@H]2CNC(=O)[C@H]2CC23CC3)cc1	ZINC000969049839	1336128094	/nfs/dbraw/zinc/12/80/94/1336128094.db2.gz	OOFANORVUXODAB-RBUKOAKNSA-N	0	3	337.467	3.219	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1ccc(OC)c(C)c1	ZINC000969072673	1336138353	/nfs/dbraw/zinc/13/83/53/1336138353.db2.gz	OYIAXULYYYUWSG-SFHVURJKSA-N	0	3	328.456	3.001	20	30		EGEDHN
C#CCCN1CCCCC[C@H]1CNC(=O)c1cc(C2CCCC2)no1	ZINC000969147707	1336162728	/nfs/dbraw/zinc/16/27/28/1336162728.db2.gz	JRTUHICIQJBHNL-KRWDZBQOSA-N	0	3	343.471	3.330	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)[C@@H]1C[C@H]1c1ccc(F)cc1	ZINC000969164076	1336168543	/nfs/dbraw/zinc/16/85/43/1336168543.db2.gz	JPLALDLMZHUPLH-GBESFXJTSA-N	0	3	330.447	3.476	20	30		EGEDHN
CC1(C)CC(CC(=O)N2CC[C@@H](NCc3ccc(C#N)c(F)c3)C2)C1	ZINC000969688197	1336237022	/nfs/dbraw/zinc/23/70/22/1336237022.db2.gz	YRUVJUMODUSNOJ-QGZVFWFLSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@H](NCc2ccccc2N(C)C)C1	ZINC000969829995	1336251904	/nfs/dbraw/zinc/25/19/04/1336251904.db2.gz	BQMWQBBUXCCXMK-XLIONFOSSA-N	0	3	329.488	3.045	20	30		EGEDHN
C=Cc1ccc(C(=O)N2CC[C@@H](NCc3ccc(C#N)s3)C2)cc1	ZINC000970050839	1336273772	/nfs/dbraw/zinc/27/37/72/1336273772.db2.gz	ZZJHTVSCFWIPAP-MRXNPFEDSA-N	0	3	337.448	3.267	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H](C)C2CN(Cc3ccc(C)cc3)C2)cc1	ZINC000970251044	1336291075	/nfs/dbraw/zinc/29/10/75/1336291075.db2.gz	BVTLFRVLMRKGFF-QGZVFWFLSA-N	0	3	332.447	3.227	20	30		EGEDHN
C=C(C)CN1CC([C@@H](C)NC(=O)c2ccc(C(F)F)c(F)c2)C1	ZINC000970421803	1336307351	/nfs/dbraw/zinc/30/73/51/1336307351.db2.gz	ZQJZTRIAXWTTJJ-LLVKDONJSA-N	0	3	326.362	3.390	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(C(=O)c3ccccc3Cl)C2)s1	ZINC000970549145	1336320144	/nfs/dbraw/zinc/32/01/44/1336320144.db2.gz	QCZOFQIUFFNXCM-GFCCVEGCSA-N	0	3	345.855	3.277	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2ncoc2-c2ccccc2)CC1	ZINC001005474953	1336358154	/nfs/dbraw/zinc/35/81/54/1336358154.db2.gz	FJCBVUJXUKTBKI-UHFFFAOYSA-N	0	3	325.412	3.064	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccc3ncsc3c2)CC1	ZINC001006370333	1336496713	/nfs/dbraw/zinc/49/67/13/1336496713.db2.gz	OWCUMBPTYZOPIR-UHFFFAOYSA-N	0	3	329.469	3.409	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCN(Cc3ccccc3C)C2)cc1	ZINC001008150319	1336780574	/nfs/dbraw/zinc/78/05/74/1336780574.db2.gz	TZALLGJPJBVGAH-NRFANRHFSA-N	0	3	332.447	3.371	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2cc(C)oc2C(F)(F)F)C1	ZINC001008704468	1336914532	/nfs/dbraw/zinc/91/45/32/1336914532.db2.gz	KNIZRFIUFMJSOA-GFCCVEGCSA-N	0	3	330.350	3.377	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2ccccc2OCC(C)C)C1	ZINC001008903489	1336941069	/nfs/dbraw/zinc/94/10/69/1336941069.db2.gz	YNIMYURINDXECW-KRWDZBQOSA-N	0	3	330.472	3.492	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2cnc3ccc(F)cc3c2)C1	ZINC001009087234	1336966643	/nfs/dbraw/zinc/96/66/43/1336966643.db2.gz	CBQUDJXJXPWQSN-KRWDZBQOSA-N	0	3	327.403	3.144	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@H]1CCCN(CCc2ccccc2)C1	ZINC001009355301	1337009818	/nfs/dbraw/zinc/00/98/18/1337009818.db2.gz	VZSWHHWPIJNXES-QFIPXVFZSA-N	0	3	346.474	3.034	20	30		EGEDHN
C=C(C)CCN1CC[C@H](NC(=O)c2oc3ccccc3c2OC)C1	ZINC001015495507	1338158822	/nfs/dbraw/zinc/15/88/22/1338158822.db2.gz	LLAJQPWUVBQATP-AWEZNQCLSA-N	0	3	328.412	3.212	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)[C@@H]2C[C@H]2c2cccc3ccccc32)C1	ZINC001015866663	1338339467	/nfs/dbraw/zinc/33/94/67/1338339467.db2.gz	BJPLIZMQWKWRPY-DZFGPLHGSA-N	0	3	332.447	3.157	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN([C@H](CC)c3ccccc3)C2)nc1	ZINC001016028467	1338414867	/nfs/dbraw/zinc/41/48/67/1338414867.db2.gz	YOQPUGQPGDUBIU-UYAOXDASSA-N	0	3	333.435	3.018	20	30		EGEDHN
Cc1ccoc1C(=O)N[C@H]1CC12CCN(Cc1cccc(C#N)c1)CC2	ZINC001016505106	1338629705	/nfs/dbraw/zinc/62/97/05/1338629705.db2.gz	LMNPCAABVRQTHC-SFHVURJKSA-N	0	3	349.434	3.244	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccc3nccc(C)c3c2)CC1	ZINC001016637196	1338672047	/nfs/dbraw/zinc/67/20/47/1338672047.db2.gz	AFVHRSVOKGEYOD-FQEVSTJZSA-N	0	3	347.462	3.151	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CC12CCN(C/C=C\Cl)CC2	ZINC001016658716	1338681642	/nfs/dbraw/zinc/68/16/42/1338681642.db2.gz	JRFBMNPIIZXNGM-LWAXHKBTSA-N	0	3	333.863	3.011	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2cc3sccc3s2)CC1	ZINC001016684881	1338689381	/nfs/dbraw/zinc/68/93/81/1338689381.db2.gz	JHMIYPDHJXJJDS-HNNXBMFYSA-N	0	3	330.478	3.180	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cc3occc3s2)CC1	ZINC001016821599	1338738890	/nfs/dbraw/zinc/73/88/90/1338738890.db2.gz	AKNVLTYAQWWAPH-MRXNPFEDSA-N	0	3	328.437	3.102	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2[nH]c3ccc(C)cc3c2C)CC1	ZINC001016906504	1338765128	/nfs/dbraw/zinc/76/51/28/1338765128.db2.gz	LAFDUQMNJIWJHD-LJQANCHMSA-N	0	3	349.478	3.392	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(O[C@@H](C)CC)cc2)CC1	ZINC001016912420	1338767686	/nfs/dbraw/zinc/76/76/86/1338767686.db2.gz	BLIGFFDNLOEISQ-LPHOPBHVSA-N	0	3	340.467	3.081	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)C[C@H]2CCCc3ccccc32)CC1	ZINC001016940636	1338777474	/nfs/dbraw/zinc/77/74/74/1338777474.db2.gz	SRGRPHRBJWXNCK-UYAOXDASSA-N	0	3	336.479	3.101	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC[C@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001017055491	1338838856	/nfs/dbraw/zinc/83/88/56/1338838856.db2.gz	JWPXGGCXLYTYMI-LSDHHAIUSA-N	0	3	333.501	3.336	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](CN(C)Cc2cncc(F)c2)C1	ZINC001017181206	1338924501	/nfs/dbraw/zinc/92/45/01/1338924501.db2.gz	YNIHERRVJWPFEP-HNNXBMFYSA-N	0	3	333.451	3.103	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H](CN(C)Cc3cncc(C)c3)C2)C1	ZINC001017203266	1338949650	/nfs/dbraw/zinc/94/96/50/1338949650.db2.gz	DVWPWILEOSSMBE-SFHVURJKSA-N	0	3	341.499	3.417	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H](CN(C)Cc3cnoc3C)C2)C1	ZINC001017208577	1338954794	/nfs/dbraw/zinc/95/47/94/1338954794.db2.gz	TUBAZSFTVFWLKE-MRXNPFEDSA-N	0	3	331.460	3.010	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H](CN(C)Cc3ocnc3C)C2)C1	ZINC001017209095	1338955672	/nfs/dbraw/zinc/95/56/72/1338955672.db2.gz	YBMBPUWBGPDHJA-INIZCTEOSA-N	0	3	331.460	3.010	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1cc(C)ccc1OC	ZINC001017713806	1339398894	/nfs/dbraw/zinc/39/88/94/1339398894.db2.gz	SJEPWABSAJFNIY-KDURUIRLSA-N	0	3	342.483	3.188	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CO[C@@H]1CCC[C@H](C)C1	ZINC001018014547	1339481532	/nfs/dbraw/zinc/48/15/32/1339481532.db2.gz	LQUDVTXAROHLLY-INDMIFKZSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)c1cccc(OC)c1	ZINC001018315499	1339573332	/nfs/dbraw/zinc/57/33/32/1339573332.db2.gz	ZMOMXXBHCUVPGF-QRQLOZEOSA-N	0	3	342.483	3.440	20	30		EGEDHN
Cc1cccc(C(=O)N2CC[C@H](NCc3ccc(F)c(C#N)c3)C2)c1	ZINC001018456905	1339627193	/nfs/dbraw/zinc/62/71/93/1339627193.db2.gz	PHGICZBIPDGTFK-SFHVURJKSA-N	0	3	337.398	3.010	20	30		EGEDHN
Cc1csc(C(=O)N2CC[C@H](NCc3ccc(C#N)c(F)c3)C2)c1	ZINC001018818146	1339733852	/nfs/dbraw/zinc/73/38/52/1339733852.db2.gz	BBWSZNFBIDHSOV-HNNXBMFYSA-N	0	3	343.427	3.072	20	30		EGEDHN
C[C@]1(C(=O)N2CC[C@H](NCc3ccc(C#N)c(F)c3)C2)CC=CCC1	ZINC001018904806	1339747605	/nfs/dbraw/zinc/74/76/05/1339747605.db2.gz	FMYHKMMTBHBPDQ-PXNSSMCTSA-N	0	3	341.430	3.134	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCCN2Cc2cccc(CC)c2)cn1	ZINC001028271226	1340524606	/nfs/dbraw/zinc/52/46/06/1340524606.db2.gz	CDQRCWGRNSAAQF-OAQYLSRUSA-N	0	3	347.462	3.020	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCCN2[C@H](C)c2ccccc2)nc1	ZINC001028271322	1340525055	/nfs/dbraw/zinc/52/50/55/1340525055.db2.gz	FBHPNDVVYASYSS-APWZRJJASA-N	0	3	333.435	3.018	20	30		EGEDHN
C#CCCN1CCC[C@H]1CNC(=O)c1cc(CC)c(CCC)s1	ZINC001028310918	1340557847	/nfs/dbraw/zinc/55/78/47/1340557847.db2.gz	BSQNEDFUPFGOEG-INIZCTEOSA-N	0	3	332.513	3.481	20	30		EGEDHN
C=CCCN1CCC[C@@H]1CNC(=O)c1sc(Cl)nc1Cl	ZINC001028320626	1340562835	/nfs/dbraw/zinc/56/28/35/1340562835.db2.gz	SUUQAGHUWGVMKB-SECBINFHSA-N	0	3	334.272	3.220	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)C1CC(c2ccc(F)cc2)C1	ZINC001028349280	1340588293	/nfs/dbraw/zinc/58/82/93/1340588293.db2.gz	KYPFTHISPTVCGO-FAFZWHIHSA-N	0	3	330.447	3.476	20	30		EGEDHN
Cc1coc(C)c1C(=O)NC[C@H]1CCN(Cc2ccc(C#N)cc2)C1	ZINC001028516246	1340681979	/nfs/dbraw/zinc/68/19/79/1340681979.db2.gz	RVHGBEUTOCTUDE-GOSISDBHSA-N	0	3	337.423	3.020	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)c2cc3cc(Cl)ccc3o2)C1	ZINC001028668687	1340748644	/nfs/dbraw/zinc/74/86/44/1340748644.db2.gz	IUVIGNCTIGYDOF-CYBMUJFWSA-N	0	3	330.815	3.161	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H](CNC(=O)c3cc[nH]c3C3CC3)C2)c1	ZINC001028765415	1340798867	/nfs/dbraw/zinc/79/88/67/1340798867.db2.gz	XLSYDUUMFPOFEI-QGZVFWFLSA-N	0	3	348.450	3.016	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)c2c(Cl)cccc2Cl)C1	ZINC001028951319	1340892530	/nfs/dbraw/zinc/89/25/30/1340892530.db2.gz	YEEICVROXNHDAM-GFCCVEGCSA-N	0	3	325.239	3.068	20	30		EGEDHN
Cc1cccc(C(=O)NC[C@H]2CCN(Cc3ccc(C#N)cc3)C2)c1C	ZINC001028964851	1340894849	/nfs/dbraw/zinc/89/48/49/1340894849.db2.gz	SEVHOEBCQVWIFB-HXUWFJFHSA-N	0	3	347.462	3.427	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC([C@H](C)NCc2cc(C)n(C)n2)CC1	ZINC001029136916	1340940108	/nfs/dbraw/zinc/94/01/08/1340940108.db2.gz	NZILLBIXMXMUFF-JXFKEZNVSA-N	0	3	346.519	3.048	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC([C@H](C)NCc2ocnc2C)CC1	ZINC001029139282	1340940538	/nfs/dbraw/zinc/94/05/38/1340940538.db2.gz	BUSCNBKKGXNWRS-LIRRHRJNSA-N	0	3	333.476	3.302	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC([C@H](C)NCc3cnc(C)o3)CC2)C1	ZINC001029142701	1340941779	/nfs/dbraw/zinc/94/17/79/1340941779.db2.gz	VKVBCSOUFXRUGT-AWEZNQCLSA-N	0	3	331.460	3.056	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CC[C@@H](C1)N2C[C@@H](OC)C1CCCC1	ZINC001029419417	1340986154	/nfs/dbraw/zinc/98/61/54/1340986154.db2.gz	BADLMKNZCUREQC-CEXWTWQISA-N	0	3	348.531	3.469	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(-n3ccnc3)cc2)CC[C@@H]1C	ZINC001071712508	1354871230	/nfs/dbraw/zinc/87/12/30/1354871230.db2.gz	PGOIKRMYSCARBP-FUHWJXTLSA-N	0	3	338.455	3.031	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](CN(C)Cc2cccc(Cl)n2)C1	ZINC001029801838	1341077680	/nfs/dbraw/zinc/07/76/80/1341077680.db2.gz	SAFZRHDWYHUJAU-CQSZACIVSA-N	0	3	335.879	3.228	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H](CN(C)Cc2cnc(C)s2)C1	ZINC001029826759	1341088160	/nfs/dbraw/zinc/08/81/60/1341088160.db2.gz	VIWHURQQGQUSCW-CRAIPNDOSA-N	0	3	335.517	3.334	20	30		EGEDHN
C#CCCN1CCC[C@@H](N(Cc2ccccc2)C(=O)C2CC=CC2)C1	ZINC001029917085	1341117297	/nfs/dbraw/zinc/11/72/97/1341117297.db2.gz	HYWAWSIHSSAHCZ-OAQYLSRUSA-N	0	3	336.479	3.469	20	30		EGEDHN
CCN1CCC[C@H](N(Cc2ccccc2)C(=O)c2c[nH]c(C#N)c2)C1	ZINC001029920128	1341119898	/nfs/dbraw/zinc/11/98/98/1341119898.db2.gz	OQSRMHXDZYFPOI-IBGZPJMESA-N	0	3	336.439	3.013	20	30		EGEDHN
C#CCCN1CCC[C@H](N(Cc2ccccc2)C(=O)[C@H]2CC23CC3)C1	ZINC001029920855	1341120221	/nfs/dbraw/zinc/12/02/21/1341120221.db2.gz	AIRPNMYYTVLIDW-VQTJNVASSA-N	0	3	336.479	3.303	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N1CCC(CN(C)Cc2cc(C#N)ccc2F)CC1	ZINC001029931224	1341125224	/nfs/dbraw/zinc/12/52/24/1341125224.db2.gz	NOSNEKNFIQGHCZ-KSSFIOAISA-N	0	3	343.446	3.024	20	30		EGEDHN
C=CCn1cccc1C(=O)NCC1CN([C@H](C)c2cccc(C)c2)C1	ZINC001031733771	1341395057	/nfs/dbraw/zinc/39/50/57/1341395057.db2.gz	NHGGOMGJEUBMFE-QGZVFWFLSA-N	0	3	337.467	3.405	20	30		EGEDHN
C=C1CCC(C(=O)NCC2CN(CCc3ccc(OC)cc3)C2)CC1	ZINC001031950164	1341429518	/nfs/dbraw/zinc/42/95/18/1341429518.db2.gz	UTNNPOOQNFNKKS-UHFFFAOYSA-N	0	3	342.483	3.032	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H](C)c1c(F)cccc1F	ZINC001032520844	1341529626	/nfs/dbraw/zinc/52/96/26/1341529626.db2.gz	ICSKTTPXCBYPOP-ILXRZTDVSA-N	0	3	334.410	3.320	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H]1CCc2c1cccc2Cl	ZINC001032523684	1341531083	/nfs/dbraw/zinc/53/10/83/1341531083.db2.gz	FYCGPYMTTUQOFF-ZQIUZPCESA-N	0	3	330.859	3.231	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1cc(F)c(C)cc1F	ZINC001032537618	1341534770	/nfs/dbraw/zinc/53/47/70/1341534770.db2.gz	DFFCNFNXPIZQRH-HOTGVXAUSA-N	0	3	334.410	3.067	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C[C@H]1CCOc2ccccc21	ZINC001032559143	1341539996	/nfs/dbraw/zinc/53/99/96/1341539996.db2.gz	VARMSSUGTDMHCT-SQNIBIBYSA-N	0	3	340.467	3.194	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H]1C[C@H]1c1ccc(C)s1	ZINC001032672400	1341577701	/nfs/dbraw/zinc/57/77/01/1341577701.db2.gz	XBJVVDMMTIALOX-MWDXBVQZSA-N	0	3	330.497	3.411	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cnn(C(C)C)c1C1CC1	ZINC001032722283	1341591567	/nfs/dbraw/zinc/59/15/67/1341591567.db2.gz	RPMYHLXCQQTJON-IRXDYDNUSA-N	0	3	342.487	3.206	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1C[C@@H]2C[C@H]1CN2CCC1CCCC1	ZINC001032754032	1341603724	/nfs/dbraw/zinc/60/37/24/1341603724.db2.gz	ULVBFUAYLNLXLG-SFTDATJTSA-N	0	3	336.479	3.076	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1ccc2c(c1)CCCC2	ZINC001032774233	1341610633	/nfs/dbraw/zinc/61/06/33/1341610633.db2.gz	ACXLLEUCLQHMEQ-SFTDATJTSA-N	0	3	338.495	3.359	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cc(Cl)cc2c1OCC2	ZINC001032807697	1341620820	/nfs/dbraw/zinc/62/08/20/1341620820.db2.gz	UJUZCERFNARMPJ-HOTGVXAUSA-N	0	3	346.858	3.140	20	30		EGEDHN
C=C1CCC(C(=O)N(C)[C@H]2CCN(CCOc3ccccc3)C2)CC1	ZINC001033394923	1341811382	/nfs/dbraw/zinc/81/13/82/1341811382.db2.gz	GKQOGDBXHYRGLC-IBGZPJMESA-N	0	3	342.483	3.345	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)[C@@H]2C[C@H]2c2c(F)cccc2F)C1	ZINC001033406326	1341816822	/nfs/dbraw/zinc/81/68/22/1341816822.db2.gz	VMMCSUNUCGLWKY-RRFJBIMHSA-N	0	3	334.410	3.177	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2cc(F)c3ncccc3c2)C1	ZINC001033505342	1341850486	/nfs/dbraw/zinc/85/04/86/1341850486.db2.gz	NVNBHKKNWZPCQW-MRXNPFEDSA-N	0	3	327.403	3.096	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2cccc(-c3cnco3)c2)C1	ZINC001033552344	1341868441	/nfs/dbraw/zinc/86/84/41/1341868441.db2.gz	VUOXRFCIHXDOIW-QGZVFWFLSA-N	0	3	325.412	3.064	20	30		EGEDHN
C#CCCN1CC[C@@H](N(C)C(=O)c2csc3c2CC[C@H](C)C3)C1	ZINC001033634518	1341916589	/nfs/dbraw/zinc/91/65/89/1341916589.db2.gz	QNBSRHNSRCKBJY-LSDHHAIUSA-N	0	3	330.497	3.043	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)[C@]2(C)CCc3ccccc3C2)C1	ZINC001033713802	1341972448	/nfs/dbraw/zinc/97/24/48/1341972448.db2.gz	IOFRADLYAQUPJT-PZJWPPBQSA-N	0	3	326.484	3.290	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cc(C)c(OC)c(C)c2)C1	ZINC001033841798	1342037529	/nfs/dbraw/zinc/03/75/29/1342037529.db2.gz	ACOPNWCDFDKBHO-SFHVURJKSA-N	0	3	330.472	3.425	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cc(C)cc(OC)c2C)C1	ZINC001033883881	1342057776	/nfs/dbraw/zinc/05/77/76/1342057776.db2.gz	VDWQKFFUNUAXGL-KRWDZBQOSA-N	0	3	330.472	3.425	20	30		EGEDHN
C#Cc1ccc(C(=O)N(CC)[C@H]2CCN(Cc3ccccc3)C2)cc1	ZINC001033923960	1342090140	/nfs/dbraw/zinc/09/01/40/1342090140.db2.gz	WAJDTYSYINTVJS-NRFANRHFSA-N	0	3	332.447	3.405	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2ccc(C(F)F)c(F)c2)C1	ZINC001033951742	1342109522	/nfs/dbraw/zinc/10/95/22/1342109522.db2.gz	KNRULQLGCHMKJT-CQSZACIVSA-N	0	3	338.373	3.323	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccc3ccn(C)c3c2)C1	ZINC001034006191	1342143903	/nfs/dbraw/zinc/14/39/03/1342143903.db2.gz	YDMHVXANTGBVPQ-SFHVURJKSA-N	0	3	325.456	3.291	20	30		EGEDHN
C=CCN1CC[C@H](N(CC)C(=O)c2c[nH]c3c2cccc3CC)C1	ZINC001034049357	1342189682	/nfs/dbraw/zinc/18/96/82/1342189682.db2.gz	OTXMYUZZMANOAI-INIZCTEOSA-N	0	3	325.456	3.453	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccc(N(C)CC)cc2)C1	ZINC001034057237	1342197747	/nfs/dbraw/zinc/19/77/47/1342197747.db2.gz	SRNBWENMPQRXIO-LJQANCHMSA-N	0	3	329.488	3.255	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc3nc(C)oc3c2)C1	ZINC001034253776	1342348816	/nfs/dbraw/zinc/34/88/16/1342348816.db2.gz	NFMFYYSGMFAGLA-MRXNPFEDSA-N	0	3	327.428	3.297	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccnn2-c2ccccc2)C1	ZINC001034273476	1342365190	/nfs/dbraw/zinc/36/51/90/1342365190.db2.gz	ICSWRCSAUXQLGL-QGZVFWFLSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)C2([C@@H]3CCCCO3)CCC2)C1	ZINC001034305539	1342388004	/nfs/dbraw/zinc/38/80/04/1342388004.db2.gz	ABFLCZUVLHBRSM-ROUUACIJSA-N	0	3	334.504	3.273	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2c(C)occ2C(F)(F)F)C1	ZINC001034313972	1342394196	/nfs/dbraw/zinc/39/41/96/1342394196.db2.gz	FYUUVGXIVZQRQE-CYBMUJFWSA-N	0	3	342.361	3.214	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cnn(CC3CCCC3)c2)C1	ZINC001034462090	1342518298	/nfs/dbraw/zinc/51/82/98/1342518298.db2.gz	IVMQDIRPHDZYRJ-IBGZPJMESA-N	0	3	344.503	3.234	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc3scnc3c2)C1	ZINC001034468431	1342523228	/nfs/dbraw/zinc/52/32/28/1342523228.db2.gz	IMMPYIVFLHWQGW-OAHLLOKOSA-N	0	3	329.469	3.457	20	30		EGEDHN
CC(C)(C)C(=O)N[C@H]1CCCCN(Cc2ccc(OCC#N)cc2)C1	ZINC001034496856	1342553391	/nfs/dbraw/zinc/55/33/91/1342553391.db2.gz	XZDSMAMCHRZLQY-KRWDZBQOSA-N	0	3	343.471	3.106	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cc(F)c(F)c(F)c2F)C1	ZINC001034498003	1342554550	/nfs/dbraw/zinc/55/45/50/1342554550.db2.gz	IPBZGGXQYVSBNH-LLVKDONJSA-N	0	3	344.352	3.403	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)c2ccc(COC(C)C)cc2)C1	ZINC001034519339	1342577871	/nfs/dbraw/zinc/57/78/71/1342577871.db2.gz	HYONYDLMQGZTKJ-IBGZPJMESA-N	0	3	330.472	3.382	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc(N(CC)CC)nc2)C1	ZINC001034546719	1342609653	/nfs/dbraw/zinc/60/96/53/1342609653.db2.gz	DTJLMNAGJSXHRW-GOSISDBHSA-N	0	3	344.503	3.088	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)c2cccs2)CC1	ZINC001034582354	1342628895	/nfs/dbraw/zinc/62/88/95/1342628895.db2.gz	PVHSLEQYROTTQG-HAQNSBGRSA-N	0	3	343.290	3.287	20	30		EGEDHN
N#Cc1ccc(F)cc1CN[C@H]1CC[C@H](NC(=O)c2ccoc2)CC1	ZINC001034593255	1342638118	/nfs/dbraw/zinc/63/81/18/1342638118.db2.gz	JWJSIOAGNLGRAG-IYARVYRRSA-N	0	3	341.386	3.121	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CC[C@H](NCc3cnc(C)cn3)CC2)CC1	ZINC001034729094	1342723871	/nfs/dbraw/zinc/72/38/71/1342723871.db2.gz	NWABZOKMIVNYMO-IYARVYRRSA-N	0	3	342.487	3.048	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)c(F)c1)C(C)(C)C	ZINC001034974262	1342860839	/nfs/dbraw/zinc/86/08/39/1342860839.db2.gz	ZMBCAUDKVHLDHP-RHSMWYFYSA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@]1(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)c(F)c2)C=CCC1	ZINC001035017236	1342878334	/nfs/dbraw/zinc/87/83/34/1342878334.db2.gz	MDCNSENMPYYWIZ-XLIONFOSSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]2CNCc2cnn(C(C)(C)C)c2)C1	ZINC001035044267	1342896666	/nfs/dbraw/zinc/89/66/66/1342896666.db2.gz	DGRLFFYSILUJQR-QGZVFWFLSA-N	0	3	344.503	3.075	20	30		EGEDHN
C=C[C@@H](C(=O)N1CCC[C@@H]1CNCc1ccns1)c1ccccc1	ZINC001035130723	1342947194	/nfs/dbraw/zinc/94/71/94/1342947194.db2.gz	AOJWHCXHBFDKIK-SJLPKXTDSA-N	0	3	341.480	3.194	20	30		EGEDHN
CC(F)(F)C(=O)N1CCC2(CCN(CC#Cc3ccccc3)C2)CC1	ZINC001035149566	1342962606	/nfs/dbraw/zinc/96/26/06/1342962606.db2.gz	HDNVSQYAPCLLIH-UHFFFAOYSA-N	0	3	346.421	3.008	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC2(CCN(Cc3c(C)noc3C)C2)CC1	ZINC001035210951	1343029608	/nfs/dbraw/zinc/02/96/08/1343029608.db2.gz	GSNGOYFALPRZOF-UHFFFAOYSA-N	0	3	345.487	3.318	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@H]1CCC[C@H]1C(F)F)CC2	ZINC001035721260	1343151878	/nfs/dbraw/zinc/15/18/78/1343151878.db2.gz	SUUCIASDMSKWOA-CABCVRRESA-N	0	3	326.431	3.168	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@H](c1ccccc1)C1CC1)CC2	ZINC001035748764	1343167726	/nfs/dbraw/zinc/16/77/26/1343167726.db2.gz	GXXOXOWYNCPYHA-HXUWFJFHSA-N	0	3	336.479	3.128	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@@H](CC)Cc1ccccc1)CC2	ZINC001035807012	1343207796	/nfs/dbraw/zinc/20/77/96/1343207796.db2.gz	HURRBICUVFIVPT-FQEVSTJZSA-N	0	3	338.495	3.203	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@H](CC)c1c(C)noc1C)CC2	ZINC001035820051	1343214484	/nfs/dbraw/zinc/21/44/84/1343214484.db2.gz	RVYUXVXWBQQEFI-QGZVFWFLSA-N	0	3	345.487	3.286	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)CCc1ccc(F)cc1F)CC2	ZINC001035826605	1343216641	/nfs/dbraw/zinc/21/66/41/1343216641.db2.gz	REEIQTIDEYSXCL-UHFFFAOYSA-N	0	3	348.437	3.398	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cnc(C3CC3)s1)CC2	ZINC001035839888	1343222431	/nfs/dbraw/zinc/22/24/31/1343222431.db2.gz	GFTFIUVIBHCCSG-UHFFFAOYSA-N	0	3	331.485	3.135	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cc(C)c(CC)s1)CC2	ZINC001035847372	1343228073	/nfs/dbraw/zinc/22/80/73/1343228073.db2.gz	LBACDKQMONJBDS-UHFFFAOYSA-N	0	3	330.497	3.180	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc3c(s1)CCC3)CC2	ZINC001035848741	1343228404	/nfs/dbraw/zinc/22/84/04/1343228404.db2.gz	YVJTUWZJLANGPJ-UHFFFAOYSA-N	0	3	330.497	3.351	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cc3ccccc3n1CC)CC2	ZINC001035858974	1343235223	/nfs/dbraw/zinc/23/52/23/1343235223.db2.gz	PPZYRRKIXIFSPY-UHFFFAOYSA-N	0	3	349.478	3.223	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccc(CC)c(CC)c1)CC2	ZINC001035864896	1343239368	/nfs/dbraw/zinc/23/93/68/1343239368.db2.gz	KWRFHYBANSVBLM-UHFFFAOYSA-N	0	3	338.495	3.373	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2cccs2)CC[C@@H]1NCc1ccccc1C#N	ZINC001035901581	1343259473	/nfs/dbraw/zinc/25/94/73/1343259473.db2.gz	KBAZOXFCINUMPA-PBHICJAKSA-N	0	3	339.464	3.260	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC(C)(C)C)CC[C@@H]1NCc1ccccc1C#N	ZINC001035907905	1343264033	/nfs/dbraw/zinc/26/40/33/1343264033.db2.gz	FIGUCNOHVLQEKM-QAPCUYQASA-N	0	3	327.472	3.321	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2=CCCC2)CC[C@@H]1NCc1cc(F)ccc1C#N	ZINC001035994799	1343305780	/nfs/dbraw/zinc/30/57/80/1343305780.db2.gz	ZDZLKQZTNXFENQ-KUHUBIRLSA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](NCc2ccccc2C#N)[C@@H](C)C1	ZINC001036136702	1343322664	/nfs/dbraw/zinc/32/26/64/1343322664.db2.gz	KEMBWILCIOAMDP-QFBILLFUSA-N	0	3	339.483	3.487	20	30		EGEDHN
Cc1cocc1C(=O)N1CC[C@@H](NCc2ccccc2C#N)[C@H](C)C1	ZINC001036139787	1343324247	/nfs/dbraw/zinc/32/42/47/1343324247.db2.gz	AOEKPTOKIYCKAQ-AUUYWEPGSA-N	0	3	337.423	3.100	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](NCc3nc(C)sc3C)[C@@H](C)C2)C1	ZINC001036171831	1343344884	/nfs/dbraw/zinc/34/48/84/1343344884.db2.gz	ZRDMFWNAQCYISP-XJKSGUPXSA-N	0	3	347.528	3.443	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCCN(C(=O)CCC2CC2)C1	ZINC001036372361	1343449264	/nfs/dbraw/zinc/44/92/64/1343449264.db2.gz	WXNBTUUVMJFRIT-JXFKEZNVSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]([C@@H](C)NCc3cc(C)no3)C2)C1	ZINC001036445163	1343491623	/nfs/dbraw/zinc/49/16/23/1343491623.db2.gz	MGUBOGBZNLHMQJ-CVEARBPZSA-N	0	3	331.460	3.056	20	30		EGEDHN
C[C@H](NCc1cc(F)ccc1C#N)[C@H]1CCCN(C(=O)C(C)(C)C)C1	ZINC001036464627	1343500330	/nfs/dbraw/zinc/50/03/30/1343500330.db2.gz	KQHXYOGWOAIPHO-HOCLYGCPSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@H]2[C@@H](CCN2Cc2ccc(F)c(C#N)c2)C1	ZINC001036628200	1343585572	/nfs/dbraw/zinc/58/55/72/1343585572.db2.gz	XQVVAEROHCHJQR-LPHOPBHVSA-N	0	3	343.446	3.166	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@H]2[C@@H](CCN2Cc2ccc(F)c(C#N)c2)C1	ZINC001036628228	1343585603	/nfs/dbraw/zinc/58/56/03/1343585603.db2.gz	YCDXAJLCQIGEKS-LPHOPBHVSA-N	0	3	341.430	3.086	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccc(F)c(C#N)c2)C1	ZINC001036628229	1343585606	/nfs/dbraw/zinc/58/56/06/1343585606.db2.gz	YCDXAJLCQIGEKS-QFBILLFUSA-N	0	3	341.430	3.086	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccccc2C#N)C1	ZINC001036687126	1343629232	/nfs/dbraw/zinc/62/92/32/1343629232.db2.gz	XSIARGSBLQMTAT-ZWKOTPCHSA-N	0	3	341.430	3.244	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@H]2[C@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001036687244	1343630296	/nfs/dbraw/zinc/63/02/96/1343630296.db2.gz	ZOPBZDUNYKWLPE-CJNGLKHVSA-N	0	3	347.459	3.306	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H]2[C@H](CCN2C/C=C/Cl)C1	ZINC001036726492	1343657945	/nfs/dbraw/zinc/65/79/45/1343657945.db2.gz	NDKCUBKEOBVACS-HMJDLUCASA-N	0	3	331.287	3.440	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H]2CCC[C@@H]2CNCc2ccccc2C#N)o1	ZINC001036938535	1343882311	/nfs/dbraw/zinc/88/23/11/1343882311.db2.gz	WTJGMBLUCVHIKU-MSOLQXFVSA-N	0	3	337.423	3.148	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCC[C@H]1NC(=O)c1ccncc1	ZINC001037162804	1344010953	/nfs/dbraw/zinc/01/09/53/1344010953.db2.gz	OHNAVAZJMLCSEC-WOJBJXKFSA-N	0	3	348.450	3.032	20	30		EGEDHN
CC(C)C(=O)N[C@H]1CCCC[C@@H]1CNCc1cc(F)ccc1C#N	ZINC001037188771	1344028099	/nfs/dbraw/zinc/02/80/99/1344028099.db2.gz	RLDGCTCQOTZQHD-QAPCUYQASA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1ccnc(-c2ccco2)c1	ZINC001038383047	1344403885	/nfs/dbraw/zinc/40/38/85/1344403885.db2.gz	XUZFBKANVQJCGX-MRXNPFEDSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@H]2CCN2CC2CC(C)C2)cc1	ZINC001038429168	1344424560	/nfs/dbraw/zinc/42/45/60/1344424560.db2.gz	WSDZRJJCPPNIHC-LEOMRAHMSA-N	0	3	328.456	3.102	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1cc(C)n(C(CC)CC)n1	ZINC001038436020	1344427293	/nfs/dbraw/zinc/42/72/93/1344427293.db2.gz	OZODOLDWTQIPFS-KRWDZBQOSA-N	0	3	332.492	3.323	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCN2CCCc2ccc(C)cc2)cc1	ZINC001038588408	1344496213	/nfs/dbraw/zinc/49/62/13/1344496213.db2.gz	IGPNLXFRMWDNBE-QFIPXVFZSA-N	0	3	346.474	3.413	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1cnn(C(CC)CC)c1C	ZINC001038904244	1344642830	/nfs/dbraw/zinc/64/28/30/1344642830.db2.gz	UJZTWBRYMYGCRJ-KRWDZBQOSA-N	0	3	332.492	3.323	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@]2(C)CC=CCC2)C[C@H]1c1cccc(F)c1	ZINC001079185471	1357202966	/nfs/dbraw/zinc/20/29/66/1357202966.db2.gz	RNAVYMOAHDSPJO-QKNQBKEWSA-N	0	3	340.442	3.089	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)Cc3ccoc3)CC2)C1	ZINC001039129231	1344807454	/nfs/dbraw/zinc/80/74/54/1344807454.db2.gz	IPBFGQCWZQEEFA-QGZVFWFLSA-N	0	3	336.863	3.135	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)C3(CF)CCC3)CC2)C1	ZINC001039162953	1344848993	/nfs/dbraw/zinc/84/89/93/1344848993.db2.gz	ASQWOZYLAZTDEA-INIZCTEOSA-N	0	3	342.886	3.439	20	30		EGEDHN
CC(=O)N1CCCC[C@H]1[C@@H]1CCN(CC#Cc2ccc(Cl)cc2)C1	ZINC001039174694	1344866329	/nfs/dbraw/zinc/86/63/29/1344866329.db2.gz	BMYRYTUWNINSOZ-QUCCMNQESA-N	0	3	344.886	3.414	20	30		EGEDHN
C=CCC[N@H+]1CC[C@H]([C@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001039194184	1344900506	/nfs/dbraw/zinc/90/05/06/1344900506.db2.gz	VMGYTQBNYZYGHM-FUHWJXTLSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=CCC[N@@H+]1CC[C@H]([C@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001039194184	1344900510	/nfs/dbraw/zinc/90/05/10/1344900510.db2.gz	VMGYTQBNYZYGHM-FUHWJXTLSA-N	0	3	328.456	3.285	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccsc2C)C1	ZINC001039199684	1344909147	/nfs/dbraw/zinc/90/91/47/1344909147.db2.gz	BYGPILMVBYTGJM-WMZOPIPTSA-N	0	3	330.497	3.396	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)Cc2c(C)cccc2C)C1	ZINC001039210006	1344923699	/nfs/dbraw/zinc/92/36/99/1344923699.db2.gz	MEJCDUPYXCQTKC-PZJWPPBQSA-N	0	3	338.495	3.182	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(F)c(F)c2)C1	ZINC001039215009	1344930619	/nfs/dbraw/zinc/93/06/19/1344930619.db2.gz	ROWMWZDZBHUKAK-APWZRJJASA-N	0	3	346.421	3.305	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cccc3cccnc32)C1	ZINC001039217250	1344933884	/nfs/dbraw/zinc/93/38/84/1344933884.db2.gz	GOHZKFNXWVVPDC-UYAOXDASSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc3ccccc3n2C)C1	ZINC001039224528	1344941720	/nfs/dbraw/zinc/94/17/20/1344941720.db2.gz	HDMADCNZCLKHKO-ICSRJNTNSA-N	0	3	349.478	3.128	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc[nH]c2C2CCC2)C1	ZINC001039233578	1344953390	/nfs/dbraw/zinc/95/33/90/1344953390.db2.gz	LUGWBLKDMQRFMZ-PKOBYXMFSA-N	0	3	339.483	3.232	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)Cc2ccccc2F)C1	ZINC001039241331	1344966561	/nfs/dbraw/zinc/96/65/61/1344966561.db2.gz	ZMWIIUQAGPZWSI-ICSRJNTNSA-N	0	3	342.458	3.095	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cccc(F)c2F)C1	ZINC001039242116	1344967559	/nfs/dbraw/zinc/96/75/59/1344967559.db2.gz	AEMNMLWWAMWWJD-QAPCUYQASA-N	0	3	346.421	3.305	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccc3ccccc3n2)C1	ZINC001039242618	1344969184	/nfs/dbraw/zinc/96/91/84/1344969184.db2.gz	BYOAVOVMKUUZEL-WIYYLYMNSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)Cc2ccc(Cl)cc2)C1	ZINC001039250044	1344980696	/nfs/dbraw/zinc/98/06/96/1344980696.db2.gz	MLLMTZRPCKKYLX-IEBWSBKVSA-N	0	3	344.886	3.219	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(C#N)[nH]1	ZINC001039358258	1345027662	/nfs/dbraw/zinc/02/76/62/1345027662.db2.gz	SBHNILAQVMSLJC-LZQZEXGQSA-N	0	3	348.450	3.326	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccnc(C2CC2)c1	ZINC001039401652	1345047640	/nfs/dbraw/zinc/04/76/40/1345047640.db2.gz	NZPRQPUEXRPQOP-MSOLQXFVSA-N	0	3	325.456	3.214	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccc(C(F)F)c1	ZINC001039460928	1345079770	/nfs/dbraw/zinc/07/97/70/1345079770.db2.gz	NDXMMLLBWDKCAF-SJORKVTESA-N	0	3	332.394	3.326	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1csc2c1CCCC2	ZINC001039467681	1345085227	/nfs/dbraw/zinc/08/52/27/1345085227.db2.gz	XDWIOTICUKGUMZ-CVEARBPZSA-N	0	3	342.508	3.329	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)CCc1ccccc1OC	ZINC001039467539	1345085385	/nfs/dbraw/zinc/08/53/85/1345085385.db2.gz	PUSBTDUMIPEJHC-MOPGFXCFSA-N	0	3	342.483	3.269	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C12CC(C(F)(F)F)(C1)C2	ZINC001039474693	1345089400	/nfs/dbraw/zinc/08/94/00/1345089400.db2.gz	VGCUNWISCMTBEJ-VBJONLRCSA-N	0	3	342.405	3.360	20	30		EGEDHN
N#Cc1ccc(C(=O)N2C[C@H]3CCC[C@@H](C2)N3CCCC2CCC2)[nH]1	ZINC001039548856	1345140305	/nfs/dbraw/zinc/14/03/05/1345140305.db2.gz	QMEFGCHOFCAGNC-HDICACEKSA-N	0	3	340.471	3.146	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC[C@H]1CCCO1	ZINC001039822047	1345200028	/nfs/dbraw/zinc/20/00/28/1345200028.db2.gz	ATPDFKQQVCTFLO-FGTMMUONSA-N	0	3	334.504	3.223	20	30		EGEDHN
Cc1ccc(CN2CCC[C@@]3(CCN(C(=O)[C@H](C)C#N)C3)C2)cc1F	ZINC001040127418	1345342821	/nfs/dbraw/zinc/34/28/21/1345342821.db2.gz	SHFAWGVVBNYDAJ-OXQOHEQNSA-N	0	3	343.446	3.108	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3ccc(C(C)C)nc3)C2)C1	ZINC001040242161	1345392315	/nfs/dbraw/zinc/39/23/15/1345392315.db2.gz	WSMVSOYROATJPR-HXUWFJFHSA-N	0	3	327.472	3.319	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3cccc4c(C)c(C)[nH]c43)C2)C1	ZINC001040261394	1345400454	/nfs/dbraw/zinc/40/04/54/1345400454.db2.gz	NVLAPSDMIDBLGN-QFIPXVFZSA-N	0	3	349.478	3.346	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cccc(C(C)C)n3)C2)C1	ZINC001040283725	1345411358	/nfs/dbraw/zinc/41/13/58/1345411358.db2.gz	PVXKRZUBFYCXBO-NRFANRHFSA-N	0	3	339.483	3.156	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@H]3CCCCC3(F)F)C2)C1	ZINC001040313968	1345425860	/nfs/dbraw/zinc/42/58/60/1345425860.db2.gz	PXHQMJKENLCVCL-SJLPKXTDSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CC[C@]3(C2)CCCN(C[C@@H](F)CC)C3)cc1	ZINC001040323372	1345432254	/nfs/dbraw/zinc/43/22/54/1345432254.db2.gz	QMMPRGJBDOPNEQ-PZJWPPBQSA-N	0	3	342.458	3.344	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@]2(C1)CCCN(Cc1ccccn1)C2	ZINC001040323731	1345432331	/nfs/dbraw/zinc/43/23/31/1345432331.db2.gz	SPTHXBCQUGOQAG-OAQYLSRUSA-N	0	3	341.499	3.498	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@]2(C1)CCCN(Cc1ccccn1)C2	ZINC001040327130	1345433350	/nfs/dbraw/zinc/43/33/50/1345433350.db2.gz	DMNGGGOUXSSSLJ-FQEVSTJZSA-N	0	3	327.472	3.108	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3ccccc3-n3cccc3)C2)C1	ZINC001040371695	1345460473	/nfs/dbraw/zinc/46/04/73/1345460473.db2.gz	LUQDBPHVUVYEOU-JOCHJYFZSA-N	0	3	347.462	3.039	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3c(C)cccc3Cl)C2)C1	ZINC001040372080	1345460517	/nfs/dbraw/zinc/46/05/17/1345460517.db2.gz	OIWBRRCOCUTXSN-LJQANCHMSA-N	0	3	330.859	3.210	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@@H](C)c3ccsc3)C2)C1	ZINC001040392861	1345473830	/nfs/dbraw/zinc/47/38/30/1345473830.db2.gz	XHHFDCIFROOACP-QFBILLFUSA-N	0	3	330.497	3.189	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cnc4ccccc4c3)C2)C1	ZINC001040421078	1345488362	/nfs/dbraw/zinc/48/83/62/1345488362.db2.gz	DSCGEYNPOZSJID-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ccsc3Cl)C2)C1	ZINC001040433503	1345496389	/nfs/dbraw/zinc/49/63/89/1345496389.db2.gz	WJRLPYTYLLIUMC-KRWDZBQOSA-N	0	3	336.888	3.353	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cnc(C(C)C)nc3C)C2)C1	ZINC001040435170	1345497895	/nfs/dbraw/zinc/49/78/95/1345497895.db2.gz	OEZRBSMIKGIAEU-FQEVSTJZSA-N	0	3	342.487	3.023	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3ccc4c(c3)C=CCC4)C2)C1	ZINC001040436172	1345499249	/nfs/dbraw/zinc/49/92/49/1345499249.db2.gz	SITFKYQROSAHHF-QFIPXVFZSA-N	0	3	334.463	3.207	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@H](C)c3ccc(CC)cc3)C2)C1	ZINC001040451140	1345507440	/nfs/dbraw/zinc/50/74/40/1345507440.db2.gz	BELWUKDDTNKLRV-XMSQKQJNSA-N	0	3	338.495	3.300	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cccc(F)c3OCC)C2)C1	ZINC001040469799	1345511042	/nfs/dbraw/zinc/51/10/42/1345511042.db2.gz	DXRGYPFTJBWBTL-FQEVSTJZSA-N	0	3	346.446	3.339	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3ccc4sccc4c3)C2)C1	ZINC001040480096	1345513976	/nfs/dbraw/zinc/51/39/76/1345513976.db2.gz	RRNIOVKQVHHXNH-HXUWFJFHSA-N	0	3	338.476	3.463	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@@H](C)c3ccc(C)s3)C2)C1	ZINC001040491162	1345517427	/nfs/dbraw/zinc/51/74/27/1345517427.db2.gz	FSQDDPAJVQDFBH-PXNSSMCTSA-N	0	3	344.524	3.498	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cc(C)c(CC)o3)C2)C1	ZINC001040492839	1345519209	/nfs/dbraw/zinc/51/92/09/1345519209.db2.gz	VTKQWJWOMCUZDD-FQEVSTJZSA-N	0	3	328.456	3.102	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cc(C4CCCC4)no3)C2)C1	ZINC001040530456	1345535067	/nfs/dbraw/zinc/53/50/67/1345535067.db2.gz	ZFEQVOGUAVBXEB-HXUWFJFHSA-N	0	3	343.471	3.446	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@@H](C)n3c(C)ccc3C)C2)C1	ZINC001040543330	1345538797	/nfs/dbraw/zinc/53/87/97/1345538797.db2.gz	OXJICGLPNOFEOW-CTNGQTDRSA-N	0	3	341.499	3.004	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@H](CC)c3ccc(F)cc3)C2)C1	ZINC001040546832	1345541313	/nfs/dbraw/zinc/54/13/13/1345541313.db2.gz	HBEAYSBAJMUYBR-CTNGQTDRSA-N	0	3	342.458	3.267	20	30		EGEDHN
CC(C)(F)C(=O)N1CCC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001040575056	1345547967	/nfs/dbraw/zinc/54/79/67/1345547967.db2.gz	DFVJLAZZBQGANA-UHFFFAOYSA-N	0	3	343.446	3.121	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC2(C1)CCN(Cc1cnoc1C)CC2	ZINC001040798418	1345578934	/nfs/dbraw/zinc/57/89/34/1345578934.db2.gz	NYHJWDDBCXSGBO-UHFFFAOYSA-N	0	3	345.487	3.400	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccccc3C3(C)CC3)C2)CC1	ZINC001040845405	1345587067	/nfs/dbraw/zinc/58/70/67/1345587067.db2.gz	IFKMRFRCVMZJJJ-UHFFFAOYSA-N	0	3	336.479	3.299	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cc4occc4s3)C2)CC1	ZINC001040846484	1345587701	/nfs/dbraw/zinc/58/77/01/1345587701.db2.gz	CBWCMYKQDJLLIN-UHFFFAOYSA-N	0	3	342.464	3.446	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccc(Cl)c(F)c3)C2)CC1	ZINC001040861211	1345588960	/nfs/dbraw/zinc/58/89/60/1345588960.db2.gz	IFEZSSIJLATXRH-UHFFFAOYSA-N	0	3	348.849	3.431	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)Cc3ccc(Cl)cc3)C2)CC1	ZINC001040929181	1345602935	/nfs/dbraw/zinc/60/29/35/1345602935.db2.gz	HWAMFJMHCUHKFH-UHFFFAOYSA-N	0	3	344.886	3.220	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccccc3CC(C)C)C2)CC1	ZINC001040952016	1345608828	/nfs/dbraw/zinc/60/88/28/1345608828.db2.gz	MOROTCWUCSUPNP-UHFFFAOYSA-N	0	3	338.495	3.446	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)[C@H]3CC[C@H](C4CCC4)CC3)C2)C1	ZINC001041370977	1345711634	/nfs/dbraw/zinc/71/16/34/1345711634.db2.gz	IKIBASMAJJQEDN-SFHLNBCPSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3c(C)[nH]c4ccccc43)C2)C1	ZINC001041455309	1345732903	/nfs/dbraw/zinc/73/29/03/1345732903.db2.gz	QPHLTDVIGYTTBW-OAQYLSRUSA-N	0	3	335.451	3.038	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cc(C)ccc3C3CC3)C2)C1	ZINC001041507468	1345746532	/nfs/dbraw/zinc/74/65/32/1345746532.db2.gz	XGUMDPHFPZYUGW-QFIPXVFZSA-N	0	3	336.479	3.434	20	30		EGEDHN
CC1(C(=O)N2CC[C@]3(CCN(Cc4cccc(C#N)c4)C3)C2)CCC1	ZINC001041555632	1345765197	/nfs/dbraw/zinc/76/51/97/1345765197.db2.gz	GSRSMDJXRRXZKP-NRFANRHFSA-N	0	3	337.467	3.173	20	30		EGEDHN
Cc1cocc1C(=O)N1CC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001041559945	1345769508	/nfs/dbraw/zinc/76/95/08/1345769508.db2.gz	OFEKIUMWUKRMAK-OAQYLSRUSA-N	0	3	349.434	3.198	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@]3(CCN(Cc4cnc(C)s4)C3)C2)C1	ZINC001041652595	1345811402	/nfs/dbraw/zinc/81/14/02/1345811402.db2.gz	KYJFGGSSNDSGQP-LJQANCHMSA-N	0	3	345.512	3.232	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)[C@@H](Cc3ccccc3)C(C)C)C2)C1	ZINC001041670918	1345817780	/nfs/dbraw/zinc/81/77/80/1345817780.db2.gz	KCTJNNILOAOYEG-UNMCSNQZSA-N	0	3	338.495	3.059	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CC[C@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001041720943	1345831462	/nfs/dbraw/zinc/83/14/62/1345831462.db2.gz	YMDFRTRMQRILOA-UWJYYQICSA-N	0	3	339.483	3.275	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3cc4cc(C)ccc4s3)C2)C1	ZINC001041770154	1345844060	/nfs/dbraw/zinc/84/40/60/1345844060.db2.gz	YRRFWLBZHNTLBW-FQEVSTJZSA-N	0	3	338.476	3.381	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccc4c(c3)CCCC4)C2)C1	ZINC001041815353	1345860472	/nfs/dbraw/zinc/86/04/72/1345860472.db2.gz	AAECXPYVFFJALL-JOCHJYFZSA-N	0	3	336.479	3.127	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)C3(c4ccccc4)CCCC3)C2)C1	ZINC001041817625	1345862276	/nfs/dbraw/zinc/86/22/76/1345862276.db2.gz	KFCKKUHQBIVYRX-OAQYLSRUSA-N	0	3	336.479	3.056	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3cc4c(s3)CC[C@@H](C)C4)C2)C1	ZINC001041825437	1345865180	/nfs/dbraw/zinc/86/51/80/1345865180.db2.gz	LERXTYYNVSDXPM-QRWLVFNGSA-N	0	3	342.508	3.044	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cc(C)c(F)c(C)c3)C2)C1	ZINC001041834458	1345866958	/nfs/dbraw/zinc/86/69/58/1345866958.db2.gz	DCSOOPJUHNVHSJ-FQEVSTJZSA-N	0	3	328.431	3.004	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)[C@H](C)c3ccc(F)cc3F)C2)C1	ZINC001041838766	1345868255	/nfs/dbraw/zinc/86/82/55/1345868255.db2.gz	BPALEKNAAUHDIX-QRWLVFNGSA-N	0	3	346.421	3.016	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)[C@@H](C)c3cccc(Cl)c3)C2)C1	ZINC001041841645	1345869634	/nfs/dbraw/zinc/86/96/34/1345869634.db2.gz	QUPMXXTZHBVPAI-HNAYVOBHSA-N	0	3	330.859	3.001	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3CCN(C(=O)C4=CCCC4)C[C@H]32)c1	ZINC001042010918	1345924254	/nfs/dbraw/zinc/92/42/54/1345924254.db2.gz	RWDJMXHTRZCONZ-UYAOXDASSA-N	0	3	335.451	3.091	20	30		EGEDHN
CC(C(=O)N1CC[C@H]2CCN(Cc3cccc(C#N)c3)[C@H]2C1)=C1CCC1	ZINC001042054066	1345932240	/nfs/dbraw/zinc/93/22/40/1345932240.db2.gz	GKSSBFQMYAPJIX-RTWAWAEBSA-N	0	3	349.478	3.481	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3nc(C(C)C)oc3C)C[C@H]21	ZINC001042059892	1345932872	/nfs/dbraw/zinc/93/28/72/1345932872.db2.gz	FSUWSQWJCCNBKY-HZPDHXFCSA-N	0	3	331.460	3.219	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3nsc4ccccc43)C[C@@H]21	ZINC001042078749	1345939063	/nfs/dbraw/zinc/93/90/63/1345939063.db2.gz	YDGBFLUOVUOTQU-HIFRSBDPSA-N	0	3	327.453	3.019	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3ccc(CCC)s3)C[C@H]21	ZINC001042080478	1345939484	/nfs/dbraw/zinc/93/94/84/1345939484.db2.gz	LXJYUVDENXFQHI-DOTOQJQBSA-N	0	3	330.497	3.260	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3cc4c(o3)CCCC4)C[C@@H]21	ZINC001042090293	1345941044	/nfs/dbraw/zinc/94/10/44/1345941044.db2.gz	JGULZILWAFFNII-RDJZCZTQSA-N	0	3	328.456	3.271	20	30		EGEDHN
C#CCN1CC[C@H]2CCN(C(=O)CC(C)(C)c3ccc(F)cc3)C[C@H]21	ZINC001042095507	1345942693	/nfs/dbraw/zinc/94/26/93/1345942693.db2.gz	NCABRUGSVJYWFG-QFBILLFUSA-N	0	3	342.458	3.049	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3CCN(C(=O)C4(C5CC5)CC4)C[C@@H]32)cc1	ZINC001042106390	1345945730	/nfs/dbraw/zinc/94/57/30/1345945730.db2.gz	BWPQBYMMVYBUKT-ICSRJNTNSA-N	0	3	349.478	3.171	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccnc(-c4ccco4)c3)C[C@H]21	ZINC001042108873	1345946087	/nfs/dbraw/zinc/94/60/87/1345946087.db2.gz	GEYZUNTWKDUEMF-CRAIPNDOSA-N	0	3	337.423	3.064	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3c(F)cc(C)cc3F)C[C@H]21	ZINC001042146063	1345956895	/nfs/dbraw/zinc/95/68/95/1345956895.db2.gz	KVMFLCLSKQTUQR-WMLDXEAASA-N	0	3	334.410	3.386	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3cncc(C)c3)[C@H]2C1	ZINC001042182038	1345970450	/nfs/dbraw/zinc/97/04/50/1345970450.db2.gz	BNGGXNYRAQTKGQ-OALUTQOASA-N	0	3	341.499	3.415	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3ccc(F)c(F)c3F)C[C@H]21	ZINC001042207751	1345986398	/nfs/dbraw/zinc/98/63/98/1345986398.db2.gz	SYFGWZBGPWZSKO-IUODEOHRSA-N	0	3	338.373	3.216	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc(Cl)c(C)c3)C[C@H]21	ZINC001042214971	1345989107	/nfs/dbraw/zinc/98/91/07/1345989107.db2.gz	WSDCNBZBKROQHH-MAUKXSAKSA-N	0	3	330.859	3.208	20	30		EGEDHN
CC(F)(F)CC(=O)N1CC[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@H]2C1	ZINC001042218387	1345990866	/nfs/dbraw/zinc/99/08/66/1345990866.db2.gz	JDBLKLXZKSHIMC-IRXDYDNUSA-N	0	3	347.409	3.026	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]3CCN(Cc4cccnc4C)[C@H]3C2)C1	ZINC001042224817	1345995054	/nfs/dbraw/zinc/99/50/54/1345995054.db2.gz	RLIFAOCRFUHDMT-HKUYNNGSSA-N	0	3	339.483	3.169	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C(C)(C)c3ccccc3F)C[C@H]21	ZINC001042268538	1346013402	/nfs/dbraw/zinc/01/34/02/1346013402.db2.gz	DFRZDBQGBMCNRD-CRAIPNDOSA-N	0	3	330.447	3.212	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccccc3OCC(C)C)C[C@@H]21	ZINC001042271759	1346014224	/nfs/dbraw/zinc/01/42/24/1346014224.db2.gz	FWZRLZIXYBCLAJ-MJGOQNOKSA-N	0	3	342.483	3.444	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3oc(CCC)nc3C)C[C@@H]21	ZINC001042314999	1346029833	/nfs/dbraw/zinc/02/98/33/1346029833.db2.gz	YFCYYKPFGDBRPQ-CVEARBPZSA-N	0	3	331.460	3.048	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3cc4nc(C)ccc4o3)C[C@@H]21	ZINC001042324539	1346033402	/nfs/dbraw/zinc/03/34/02/1346033402.db2.gz	WESVGJYTSYYOTR-RDJZCZTQSA-N	0	3	339.439	3.249	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc4ncsc4c3)C[C@H]21	ZINC001042338864	1346043366	/nfs/dbraw/zinc/04/33/66/1346043366.db2.gz	NBQQIGAXPIFTRF-XJKSGUPXSA-N	0	3	327.453	3.019	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3ccc(C(C)C)s3)C[C@H]21	ZINC001042369825	1346060314	/nfs/dbraw/zinc/06/03/14/1346060314.db2.gz	AYGJSKQPLZSWDR-HZPDHXFCSA-N	0	3	330.497	3.431	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3c[nH]c4ccc(C)cc34)C[C@@H]21	ZINC001042371051	1346060590	/nfs/dbraw/zinc/06/05/90/1346060590.db2.gz	KOIVSDRZRJBGMI-JXFKEZNVSA-N	0	3	335.451	3.036	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(N(C)C(C)C)cc3)C[C@H]21	ZINC001042379270	1346064775	/nfs/dbraw/zinc/06/47/75/1346064775.db2.gz	IWKCMXWVVQYGRV-YLJYHZDGSA-N	0	3	341.499	3.254	20	30		EGEDHN
C[C@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)C1CCCC1	ZINC001044413173	1346321446	/nfs/dbraw/zinc/32/14/46/1346321446.db2.gz	NNRFRAZSXFZPIU-HNAYVOBHSA-N	0	3	325.456	3.218	20	30		EGEDHN
C[C@@H]1C[C@@H]([NH2+]Cc2cccc(C#N)c2)CCN1C(=O)c1ccccc1[O-]	ZINC001044478694	1346344106	/nfs/dbraw/zinc/34/41/06/1346344106.db2.gz	OCDRZOUAZDTNHE-QAPCUYQASA-N	0	3	349.434	3.047	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)CCC1CC1	ZINC001044510313	1346352743	/nfs/dbraw/zinc/35/27/43/1346352743.db2.gz	PNOGHWDCCJDVDN-BEFAXECRSA-N	0	3	325.456	3.218	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2cc(F)ccc2C#N)CCN1C(=O)C1CC=CC1	ZINC001044524213	1346356263	/nfs/dbraw/zinc/35/62/63/1346356263.db2.gz	SUQXQXUDCWLLCO-AUUYWEPGSA-N	0	3	341.430	3.133	20	30		EGEDHN
C[C@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)CC1CCC1	ZINC001044533947	1346360662	/nfs/dbraw/zinc/36/06/62/1346360662.db2.gz	YBHLNAPECHOFKI-HNAYVOBHSA-N	0	3	325.456	3.218	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@H](NCc3ccccc3C#N)C[C@@H]2C)co1	ZINC001044570739	1346371619	/nfs/dbraw/zinc/37/16/19/1346371619.db2.gz	HZCVFGHAHRJRMW-LIRRHRJNSA-N	0	3	337.423	3.243	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)C1(F)CCCC1	ZINC001044655035	1346394922	/nfs/dbraw/zinc/39/49/22/1346394922.db2.gz	WFWLNCJQZCKHHX-CRAIPNDOSA-N	0	3	343.446	3.310	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3cnc(C)cn3)C[C@H]2C)CC1	ZINC001044728607	1346413651	/nfs/dbraw/zinc/41/36/51/1346413651.db2.gz	APCSXTQEKHMWLB-SJLPKXTDSA-N	0	3	342.487	3.001	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3nccnc3C)C[C@@H]2C)CC1	ZINC001044730248	1346414371	/nfs/dbraw/zinc/41/43/71/1346414371.db2.gz	OJPGIBSNVBRNDY-MAUKXSAKSA-N	0	3	342.487	3.001	20	30		EGEDHN
C[C@@H](NC[C@@H]1CCCN1C(=O)C#CC1CC1)c1ccccc1Cl	ZINC001045028220	1346482918	/nfs/dbraw/zinc/48/29/18/1346482918.db2.gz	DCJOECVDBFCFKQ-ZBFHGGJFSA-N	0	3	330.859	3.395	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H]1CNCc1ccc(C#N)cc1F	ZINC001045186102	1346522449	/nfs/dbraw/zinc/52/24/49/1346522449.db2.gz	YHKQQUBRWGPQIX-PXNSSMCTSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]2CNCc2ccc(F)c(F)c2)C1	ZINC001045190503	1346524545	/nfs/dbraw/zinc/52/45/45/1346524545.db2.gz	GBFNZATWROTELZ-HNNXBMFYSA-N	0	3	334.410	3.402	20	30		EGEDHN
C[C@@H](CC(=O)N1CCC[C@H]1CNCc1ccc(C#N)s1)C1CC1	ZINC001045326050	1346561157	/nfs/dbraw/zinc/56/11/57/1346561157.db2.gz	PGTAPKJDHBEWNS-ZFWWWQNUSA-N	0	3	331.485	3.137	20	30		EGEDHN
CC1(NC(=O)c2ccccc2)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045348772	1346568856	/nfs/dbraw/zinc/56/88/56/1346568856.db2.gz	AUMGOCGPLXQASR-UHFFFAOYSA-N	0	3	333.435	3.343	20	30		EGEDHN
Cc1cccc(C(=O)NC2(C)CCN(Cc3ccc(C#N)cc3)CC2)n1	ZINC001045369082	1346576682	/nfs/dbraw/zinc/57/66/82/1346576682.db2.gz	LHAJGHVULLESHL-UHFFFAOYSA-N	0	3	348.450	3.046	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)[C@@H]2CCC[C@@H](C(F)(F)F)C2)CC1	ZINC001045482528	1346605396	/nfs/dbraw/zinc/60/53/96/1346605396.db2.gz	NHAMIQBHZCGUOI-HUUCEWRRSA-N	0	3	344.421	3.349	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2ccc(F)c(Cl)c2F)CC1	ZINC001045542187	1346623574	/nfs/dbraw/zinc/62/35/74/1346623574.db2.gz	GYOBZQCJHNYBBA-UHFFFAOYSA-N	0	3	328.790	3.389	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2ccc(N(CC)CC)cc2)CC1	ZINC001045628249	1346652123	/nfs/dbraw/zinc/65/21/23/1346652123.db2.gz	ZLKALFJVSHSOIU-UHFFFAOYSA-N	0	3	341.499	3.140	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)[C@@H]2C[C@@H]2c2cc(F)ccc2F)CC1	ZINC001045644500	1346656827	/nfs/dbraw/zinc/65/68/27/1346656827.db2.gz	KKBMOQHIRKYOAH-NVXWUHKLSA-N	0	3	346.421	3.062	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1cccc(C#N)c1	ZINC001045827368	1346710303	/nfs/dbraw/zinc/71/03/03/1346710303.db2.gz	LXWYIRLNHMMCER-MOPGFXCFSA-N	0	3	337.467	3.336	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1csc(C)c1C)C2	ZINC001045940491	1346776212	/nfs/dbraw/zinc/77/62/12/1346776212.db2.gz	ZTENEBRKLVXRJW-IBGZPJMESA-N	0	3	330.497	3.316	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc(C)nc(C)c1)C2	ZINC001045941948	1346778051	/nfs/dbraw/zinc/77/80/51/1346778051.db2.gz	PIVFDVGLLGBALX-NRFANRHFSA-N	0	3	339.483	3.040	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@H]1CCCC3(CC3)C1)C2	ZINC001045942598	1346778267	/nfs/dbraw/zinc/77/82/67/1346778267.db2.gz	VTUFHPXAZGEIHR-RXVVDRJESA-N	0	3	328.500	3.295	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc(C(C)C)nc1)C2	ZINC001045943635	1346779216	/nfs/dbraw/zinc/77/92/16/1346779216.db2.gz	KRXRBHXLROGKGP-OAQYLSRUSA-N	0	3	339.483	3.156	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cn(C)c3ccccc13)C2	ZINC001045950683	1346785279	/nfs/dbraw/zinc/78/52/79/1346785279.db2.gz	JCDYNKWLPRQNNE-JOCHJYFZSA-N	0	3	349.478	3.130	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C3CC3)cc2)C[C@H]1NC(=O)c1ccc(C#N)[nH]1	ZINC001079589350	1357318351	/nfs/dbraw/zinc/31/83/51/1357318351.db2.gz	FNPYAKCWMAODRP-JLTOFOAXSA-N	0	3	348.450	3.014	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc([C@@H](C)CC)no1)C2	ZINC001045972446	1346808251	/nfs/dbraw/zinc/80/82/51/1346808251.db2.gz	AXWGKBZFNUTFQX-JXFKEZNVSA-N	0	3	343.471	3.140	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@H](C)c1cccc(F)c1)C2	ZINC001045984717	1346825098	/nfs/dbraw/zinc/82/50/98/1346825098.db2.gz	HKGCBMMZFFZQFQ-UTKZUKDTSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@]1(C)CC=C(C)CC1)C2	ZINC001045985565	1346826003	/nfs/dbraw/zinc/82/60/03/1346826003.db2.gz	WXLMPWLZJMJGKQ-RTWAWAEBSA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H](C)c1ccccc1C)C2	ZINC001045985655	1346826731	/nfs/dbraw/zinc/82/67/31/1346826731.db2.gz	ZCTIDYZEXFISJX-SIKLNZKXSA-N	0	3	338.495	3.436	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)CC(C1CC1)C1CC1)C2	ZINC001045985920	1346826898	/nfs/dbraw/zinc/82/68/98/1346826898.db2.gz	FIAVJKSZCGPSRJ-OAQYLSRUSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@H]1[C@H]3[C@@H]1[C@@H]1CC[C@H]3C1)C2	ZINC001045987565	1346829047	/nfs/dbraw/zinc/82/90/47/1346829047.db2.gz	VLHLAYCLKLGFSR-AUTRXYTDSA-N	0	3	340.511	3.006	20	30		EGEDHN
C#CCCN1CC[C@@](C)(NC(=O)c2ccc(OC)c(C(C)C)c2)C1	ZINC001046452334	1346979336	/nfs/dbraw/zinc/97/93/36/1346979336.db2.gz	VOZOUBFLVCHHCI-HXUWFJFHSA-N	0	3	328.456	3.036	20	30		EGEDHN
C#CCCN1CC[C@](C)(NC(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2)C1	ZINC001046695732	1347065679	/nfs/dbraw/zinc/06/56/79/1347065679.db2.gz	QKTCJIVHEWTPIY-SCTDSRPQSA-N	0	3	330.859	3.047	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2ccnc(O[C@H](C)CC)c2)C1	ZINC001046760911	1347088741	/nfs/dbraw/zinc/08/87/41/1347088741.db2.gz	UJWYJPSFDLLTST-DNVCBOLYSA-N	0	3	331.460	3.029	20	30		EGEDHN
C#CCCN1CC[C@](C)(NC(=O)c2cccc(Cl)c2Cl)C1	ZINC001046791840	1347105046	/nfs/dbraw/zinc/10/50/46/1347105046.db2.gz	NGJZRKYBYNSHMR-INIZCTEOSA-N	0	3	325.239	3.211	20	30		EGEDHN
C#CCCN1CC[C@@](C)(NC(=O)c2cc3c(s2)CCCCC3)C1	ZINC001046817314	1347116618	/nfs/dbraw/zinc/11/66/18/1347116618.db2.gz	WMSZEWFUVCBTLY-LJQANCHMSA-N	0	3	330.497	3.235	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2nccc3occc32)C1	ZINC001046957725	1347164975	/nfs/dbraw/zinc/16/49/75/1347164975.db2.gz	ISWOKARJKYBSJN-ZDUSSCGKSA-N	0	3	349.381	3.091	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2nc(Cl)cs2)C1	ZINC001046966490	1347169606	/nfs/dbraw/zinc/16/96/06/1347169606.db2.gz	IZNWQXCXUUMYEV-SNVBAGLBSA-N	0	3	349.834	3.060	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2nc(Cl)cs2)C1	ZINC001046966489	1347169599	/nfs/dbraw/zinc/16/95/99/1347169599.db2.gz	IZNWQXCXUUMYEV-JTQLQIEISA-N	0	3	349.834	3.060	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2cccc3cc[nH]c32)C1	ZINC001046975988	1347173381	/nfs/dbraw/zinc/17/33/81/1347173381.db2.gz	ZWNLGWPHRKZVIM-OAHLLOKOSA-N	0	3	347.409	3.431	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@H](CNC(=O)[C@H]2CCCC(C)(C)C2)C1	ZINC001046995859	1347178367	/nfs/dbraw/zinc/17/83/67/1347178367.db2.gz	LXPPGTYBEPCAMS-JKSUJKDBSA-N	0	3	340.458	3.300	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(C/C=C\Cl)C2	ZINC001047084251	1347204228	/nfs/dbraw/zinc/20/42/28/1347204228.db2.gz	JBCHSYDKIOMWKA-UHAAEXCHSA-N	0	3	333.863	3.009	20	30		EGEDHN
O=C(N[C@@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1ccccc1)C2)C1(C2CC2)CC1	ZINC001047090470	1347205340	/nfs/dbraw/zinc/20/53/40/1347205340.db2.gz	BRKLNDFWVJLRFK-TYPHKJRUSA-N	0	3	348.490	3.197	20	30		EGEDHN
CCC(=O)N1CCC[C@@H](C2CCN(CC#Cc3ccccc3)CC2)C1	ZINC001047217487	1347248575	/nfs/dbraw/zinc/24/85/75/1347248575.db2.gz	WFAJAFSXTHCGMW-OAQYLSRUSA-N	0	3	338.495	3.399	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3ccccc3F)C2)CC1	ZINC001047219992	1347251643	/nfs/dbraw/zinc/25/16/43/1347251643.db2.gz	RXNGOSFOCAWWOO-KRWDZBQOSA-N	0	3	328.431	3.023	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)[C@H]3[C@@H]4CCCC[C@@H]43)C2)CC1	ZINC001047232881	1347261353	/nfs/dbraw/zinc/26/13/53/1347261353.db2.gz	QGSYFAJUZHDDSW-CGXNFDGLSA-N	0	3	342.527	3.397	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)[C@H]3CCC3(C)C)C2)CC1	ZINC001047247101	1347272229	/nfs/dbraw/zinc/27/22/29/1347272229.db2.gz	AYXUCGGYUJDRQH-RTBURBONSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)[C@H]3C[C@H]4C[C@H]4C3)C2)CC1	ZINC001047247567	1347273172	/nfs/dbraw/zinc/27/31/72/1347273172.db2.gz	GZIAAEDSXPOPIV-VNTMZGSJSA-N	0	3	328.500	3.006	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)C3(C4CC4)CCC3)C2)CC1	ZINC001047247838	1347273187	/nfs/dbraw/zinc/27/31/87/1347273187.db2.gz	MWNWAWGGDITBMW-SFHVURJKSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)C[C@@H]3C[C@H]3C3CC3)C2)CC1	ZINC001047249528	1347274355	/nfs/dbraw/zinc/27/43/55/1347274355.db2.gz	AFDPXNPVKAMDGM-HKBOAZHASA-N	0	3	342.527	3.397	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)C3(C)CC(F)(F)C3)C2)CC1	ZINC001047265448	1347286552	/nfs/dbraw/zinc/28/65/52/1347286552.db2.gz	ZTLBFPVLEMURDQ-MRXNPFEDSA-N	0	3	338.442	3.006	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)C2CCCC2)C1	ZINC001047674546	1347325687	/nfs/dbraw/zinc/32/56/87/1347325687.db2.gz	VRTBHEWNJKQPKD-KXBFYZLASA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)CC(C)(C)C)C1	ZINC001047717631	1347347790	/nfs/dbraw/zinc/34/77/90/1347347790.db2.gz	XWNAPJRBTZDETP-QAPCUYQASA-N	0	3	327.472	3.321	20	30		EGEDHN
Cc1ccoc1C(=O)N1CC[C@H]([C@@H](C)NCc2ccccc2C#N)C1	ZINC001047726587	1347352342	/nfs/dbraw/zinc/35/23/42/1347352342.db2.gz	SUCWSVDSXBGEDZ-QAPCUYQASA-N	0	3	337.423	3.100	20	30		EGEDHN
C/C(=C\C(=O)N1CC[C@H]([C@@H](C)NCc2ccccc2C#N)C1)C1CC1	ZINC001047736164	1347356020	/nfs/dbraw/zinc/35/60/20/1347356020.db2.gz	OBDAIVJAPIXUON-HWIYTKFHSA-N	0	3	337.467	3.241	20	30		EGEDHN
C[C@H](NCc1cc(F)ccc1C#N)[C@@H]1CCN(C(=O)CCC2CC2)C1	ZINC001047766980	1347364765	/nfs/dbraw/zinc/36/47/65/1347364765.db2.gz	XZVIZVJVLGFOLD-WMLDXEAASA-N	0	3	343.446	3.214	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)CC2CCC2)C1	ZINC001047772773	1347366776	/nfs/dbraw/zinc/36/67/76/1347366776.db2.gz	JDCXGFPJHMSKOM-KXBFYZLASA-N	0	3	325.456	3.075	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@H]([C@@H](C)NCc3ccccc3C#N)C2)co1	ZINC001047815194	1347380368	/nfs/dbraw/zinc/38/03/68/1347380368.db2.gz	OBFBBULVSBCXSG-QAPCUYQASA-N	0	3	337.423	3.100	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H]([C@@H](C)NCc2cscn2)C1	ZINC001047855871	1347390463	/nfs/dbraw/zinc/39/04/63/1347390463.db2.gz	ONNWTFWBPVEXIE-DGCLKSJQSA-N	0	3	341.908	3.248	20	30		EGEDHN
C[C@@H](NCc1cc(F)ccc1C#N)[C@@H]1CCN(C(=O)CC2(C)CC2)C1	ZINC001047908019	1347405397	/nfs/dbraw/zinc/40/53/97/1347405397.db2.gz	HPHVIYRRAQZJJF-GDBMZVCRSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]([C@H](C)NCc2ccccc2C#N)C1	ZINC001047927600	1347412856	/nfs/dbraw/zinc/41/28/56/1347412856.db2.gz	JMPLQXDGHDJZNJ-QFBILLFUSA-N	0	3	339.483	3.487	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]([C@@H](C)NCc2nc3ccccc3o2)C1	ZINC001047933263	1347414688	/nfs/dbraw/zinc/41/46/88/1347414688.db2.gz	WWKVAXGYKPGSTD-HUUCEWRRSA-N	0	3	341.455	3.367	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]([C@H](C)NCc2csc(CC)n2)C1	ZINC001047932345	1347414791	/nfs/dbraw/zinc/41/47/91/1347414791.db2.gz	PCECDKCBNCJMLU-KBPBESRZSA-N	0	3	335.517	3.244	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CCCC2)C[C@H]1CNCc1cc(F)ccc1C#N	ZINC001048098483	1347465586	/nfs/dbraw/zinc/46/55/86/1347465586.db2.gz	XJSULAJOULNAHM-RDTXWAMCSA-N	0	3	343.446	3.072	20	30		EGEDHN
C[C@@H]1CN(C(=O)/C=C/c2ccco2)C[C@H]1CNCc1ccccc1C#N	ZINC001048108958	1347469241	/nfs/dbraw/zinc/46/92/41/1347469241.db2.gz	QAPQCRXAMDJCND-UHMOSQCASA-N	0	3	349.434	3.049	20	30		EGEDHN
CCC(CC)C(=O)N1C[C@H](C)[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001048153598	1347482855	/nfs/dbraw/zinc/48/28/55/1347482855.db2.gz	VTEQUMYZWOKCNE-KSSFIOAISA-N	0	3	345.462	3.318	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@@H](CNCc2csc(C)n2)C1	ZINC001048337708	1347522343	/nfs/dbraw/zinc/52/23/43/1347522343.db2.gz	FJGZWUVYQQFPTE-HIFRSBDPSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](CNCc2nc(C)sc2C)[C@H](C)C1	ZINC001048339024	1347523248	/nfs/dbraw/zinc/52/32/48/1347523248.db2.gz	AIXQJLJTOVHORR-IUODEOHRSA-N	0	3	335.517	3.156	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](CNCc3cc(C4CC4)no3)[C@H](C)C2)C1	ZINC001048375048	1347535071	/nfs/dbraw/zinc/53/50/71/1347535071.db2.gz	TYIHATHKFLHJHM-GDBMZVCRSA-N	0	3	343.471	3.092	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](C)[C@@H](CNCc3cc(C4CC4)no3)C2)C1	ZINC001048375051	1347535114	/nfs/dbraw/zinc/53/51/14/1347535114.db2.gz	TYIHATHKFLHJHM-ZBFHGGJFSA-N	0	3	343.471	3.092	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CN(C(=O)[C@@]45C[C@@H]4CCCC5)C[C@@H]3C2)c1	ZINC001049046164	1347715352	/nfs/dbraw/zinc/71/53/52/1347715352.db2.gz	JUOSDNWTLXEJJG-IIZPIQPGSA-N	0	3	349.478	3.029	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1cccc(C#N)c1	ZINC001049294577	1347776137	/nfs/dbraw/zinc/77/61/37/1347776137.db2.gz	AQVVUDFKQPJMPE-OALUTQOASA-N	0	3	325.456	3.170	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)[C@H]2CC=CCC2)c1	ZINC001049324535	1347791094	/nfs/dbraw/zinc/79/10/94/1347791094.db2.gz	ATQPWKRRQZAHTF-PCCBWWKXSA-N	0	3	349.478	3.480	20	30		EGEDHN
C/C(=C/C(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1ccc(C#N)cc1)C1CC1	ZINC001049351610	1347801389	/nfs/dbraw/zinc/80/13/89/1347801389.db2.gz	LYDRVKAVUCWMCG-VTBNQREVSA-N	0	3	349.478	3.480	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1ccc(C(F)F)cc1	ZINC001049373200	1347810146	/nfs/dbraw/zinc/81/01/46/1347810146.db2.gz	QUVIZUPRKSRVDZ-KBRIMQKVSA-N	0	3	347.409	3.349	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)C=C2CCC2)cc1	ZINC001049410330	1347832921	/nfs/dbraw/zinc/83/29/21/1347832921.db2.gz	AVBWFOVIIGGDTQ-VQTJNVASSA-N	0	3	335.451	3.234	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@@H]2[C@H]1CCN2Cc1cc2ccccc2o1	ZINC001049466178	1347861898	/nfs/dbraw/zinc/86/18/98/1347861898.db2.gz	BQPFKCOTDBJLDY-WOJBJXKFSA-N	0	3	348.446	3.412	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1c(C)noc1CCC	ZINC001049469217	1347864796	/nfs/dbraw/zinc/86/47/96/1347864796.db2.gz	AKMULBIXDRZHRU-CVEARBPZSA-N	0	3	331.460	3.191	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(C)c(OC)c(C)c1	ZINC001049491681	1347874613	/nfs/dbraw/zinc/87/46/13/1347874613.db2.gz	PHOPVBULIBAMGR-ROUUACIJSA-N	0	3	328.456	3.177	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ncoc1-c1ccccc1	ZINC001049507701	1347883679	/nfs/dbraw/zinc/88/36/79/1347883679.db2.gz	LGEVVTWIEIDEAI-DLBZAZTESA-N	0	3	337.423	3.207	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc2c(o1)CCCC2	ZINC001049514681	1347887126	/nfs/dbraw/zinc/88/71/26/1347887126.db2.gz	IPZQRBPLNVAPKP-IRXDYDNUSA-N	0	3	328.456	3.413	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1conc1C1CCCC1	ZINC001049517656	1347888079	/nfs/dbraw/zinc/88/80/79/1347888079.db2.gz	LPIZRCWUAFFXBB-QZTJIDSGSA-N	0	3	341.455	3.034	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@@H]2CCCN3C(=O)C2(C3CC3)CC2)c1	ZINC001049541330	1347898525	/nfs/dbraw/zinc/89/85/25/1347898525.db2.gz	OIENYBZWABQQRZ-PMACEKPBSA-N	0	3	349.478	3.314	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H]1CCc2cc(F)ccc21	ZINC001049596646	1347928866	/nfs/dbraw/zinc/92/88/66/1347928866.db2.gz	VKJWPBLNPJXING-CEXWTWQISA-N	0	3	328.431	3.107	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](C)c1c(F)cccc1F	ZINC001049595846	1347928981	/nfs/dbraw/zinc/92/89/81/1347928981.db2.gz	TYLXUNAVMCCPQM-XOKHGSTOSA-N	0	3	334.410	3.320	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1cc(F)c(C)cc1F	ZINC001049612300	1347935721	/nfs/dbraw/zinc/93/57/21/1347935721.db2.gz	LZNWPJUCPGXKDP-ROUUACIJSA-N	0	3	334.410	3.067	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]2[C@H]1CCN2Cc1cccc(OC)c1	ZINC001049646616	1347953267	/nfs/dbraw/zinc/95/32/67/1347953267.db2.gz	QGOZMQSBRGOTBF-RBUKOAKNSA-N	0	3	342.483	3.473	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](CC)Cc1ccccc1	ZINC001049763977	1348008733	/nfs/dbraw/zinc/00/87/33/1348008733.db2.gz	STEFJRGJGBARQQ-NJDAHSKKSA-N	0	3	338.495	3.344	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccn(C(CC)CC)n1	ZINC001049768514	1348010968	/nfs/dbraw/zinc/01/09/68/1348010968.db2.gz	WRBZNJVXXCZSHP-ZWKOTPCHSA-N	0	3	330.476	3.109	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccc(OC)cc1	ZINC001049777109	1348016348	/nfs/dbraw/zinc/01/63/48/1348016348.db2.gz	OCUASNGGURAVMM-YRPNKDGESA-N	0	3	340.467	3.050	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1sc(CC)nc1C	ZINC001049777963	1348016432	/nfs/dbraw/zinc/01/64/32/1348016432.db2.gz	LLJHGSINXQHPAO-CABCVRRESA-N	0	3	333.501	3.269	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(OC)cc1Cl	ZINC001049793856	1348024416	/nfs/dbraw/zinc/02/44/16/1348024416.db2.gz	QYIMGPDTVIFFAD-SJORKVTESA-N	0	3	334.847	3.214	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ncoc1-c1cccs1	ZINC001049793504	1348024491	/nfs/dbraw/zinc/02/44/91/1348024491.db2.gz	OMCDHNBHNBLKGP-ZIAGYGMSSA-N	0	3	343.452	3.268	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cccc(OC)c1F	ZINC001049800081	1348026686	/nfs/dbraw/zinc/02/66/86/1348026686.db2.gz	AGWJOQQOKPMOGA-JKSUJKDBSA-N	0	3	332.419	3.089	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cccc(F)c1OCC	ZINC001049814907	1348033971	/nfs/dbraw/zinc/03/39/71/1348033971.db2.gz	PGGVGDRHACWPBO-IRXDYDNUSA-N	0	3	332.419	3.089	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)C(C)(C)CC1CCOCC1	ZINC001049816790	1348035448	/nfs/dbraw/zinc/03/54/48/1348035448.db2.gz	KANWHSZLBPQHPO-MSOLQXFVSA-N	0	3	334.504	3.081	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](C)c1cccc(F)c1	ZINC001049905186	1348103577	/nfs/dbraw/zinc/10/35/77/1348103577.db2.gz	VWFRMKJXQSQFGC-KFKAGJAMSA-N	0	3	328.431	3.018	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C[C@H](C)c1ccc(F)cc1	ZINC001049907224	1348104875	/nfs/dbraw/zinc/10/48/75/1348104875.db2.gz	BOKZPZSXZOZXLQ-KFKAGJAMSA-N	0	3	328.431	3.018	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](C)Cc1ccc(F)cc1	ZINC001049926302	1348116886	/nfs/dbraw/zinc/11/68/86/1348116886.db2.gz	NGZIXSFKVXKQMR-KFKAGJAMSA-N	0	3	330.447	3.256	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cccc2c1OCC2(C)C	ZINC001049933617	1348120864	/nfs/dbraw/zinc/12/08/64/1348120864.db2.gz	MDYHJVCALVHVJR-ZWKOTPCHSA-N	0	3	340.467	3.222	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(C)n(C(C)C)n1	ZINC001049934850	1348121520	/nfs/dbraw/zinc/12/15/20/1348121520.db2.gz	WFJYCYNAOYFKPJ-QZTJIDSGSA-N	0	3	330.476	3.027	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1c[nH]c2ccc(F)cc12	ZINC001049937287	1348122788	/nfs/dbraw/zinc/12/27/88/1348122788.db2.gz	RKDYPKDZRSDYCL-RBUKOAKNSA-N	0	3	339.414	3.009	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CCCN(C(=O)CCC4CC4)[C@@H]3C2)c1	ZINC001050001917	1348149304	/nfs/dbraw/zinc/14/93/04/1348149304.db2.gz	IBLWZESRWFJJPO-VQTJNVASSA-N	0	3	337.467	3.171	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)[C@@H]3C[C@H]3c3sccc3C)[C@@H]2C1	ZINC001050047960	1348165351	/nfs/dbraw/zinc/16/53/51/1348165351.db2.gz	WBGQBGGUJBMJAU-BSDSXHPESA-N	0	3	342.508	3.106	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cnc4ccsc4c3)[C@@H]2C1	ZINC001050110313	1348186035	/nfs/dbraw/zinc/18/60/35/1348186035.db2.gz	LVDPAXJYDJCASR-XJKSGUPXSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)[C@@H]3C[C@H]3c3ccccc3F)[C@@H]2C1	ZINC001050160823	1348200233	/nfs/dbraw/zinc/20/02/33/1348200233.db2.gz	VFPYELNTUCNDOQ-ITQYTPKQSA-N	0	3	328.431	3.038	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3ncoc3-c3cccs3)[C@@H]2C1	ZINC001050165352	1348201967	/nfs/dbraw/zinc/20/19/67/1348201967.db2.gz	ALRYIMRMCIGFSQ-UONOGXRCSA-N	0	3	343.452	3.126	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3csc4c3CCCC4)[C@@H]2C1	ZINC001050197095	1348208420	/nfs/dbraw/zinc/20/84/20/1348208420.db2.gz	GAEYAFCOWOECLH-WMLDXEAASA-N	0	3	330.497	3.349	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@H]1CC[C@H](NC(=O)CC2CC2)CC1	ZINC001050281057	1348226086	/nfs/dbraw/zinc/22/60/86/1348226086.db2.gz	CGPCAHJRHIZMNI-RHDGDCLCSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CC[C@H](CNCc3cc(C)on3)CC2)CC1	ZINC001050362126	1348238256	/nfs/dbraw/zinc/23/82/56/1348238256.db2.gz	ILYDKWWOOWFGNE-SAABIXHNSA-N	0	3	345.487	3.494	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC2(C1)CCN([C@@H](C)c1ccccc1Cl)CC2	ZINC001050460293	1348271190	/nfs/dbraw/zinc/27/11/90/1348271190.db2.gz	UROCCFKFCKCLBS-GJZGRUSLSA-N	0	3	345.874	3.485	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)C=C4CCC4)C3)CC2)c1	ZINC001050485342	1348277622	/nfs/dbraw/zinc/27/76/22/1348277622.db2.gz	VXDCZVUDWWDNES-UHFFFAOYSA-N	0	3	335.451	3.093	20	30		EGEDHN
O=C(C#CC1CC1)N1CC2(C1)CCN(Cc1cccc(Cl)c1)CC2	ZINC001050515991	1348282270	/nfs/dbraw/zinc/28/22/70/1348282270.db2.gz	XJPWYMQYTFGQIX-UHFFFAOYSA-N	0	3	342.870	3.178	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cc4ccccc4s3)C2)CC1	ZINC001050583164	1348293453	/nfs/dbraw/zinc/29/34/53/1348293453.db2.gz	CUAOJCINFGOSNX-UHFFFAOYSA-N	0	3	338.476	3.463	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H]3[C@H](C=C(C)C)C3(C)C)C2)CC1	ZINC001050584358	1348293909	/nfs/dbraw/zinc/29/39/09/1348293909.db2.gz	CRHJVPCDHIKJPL-ROUUACIJSA-N	0	3	328.500	3.173	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3sc4ccccc4c3C)C2)CC1	ZINC001050585889	1348294127	/nfs/dbraw/zinc/29/41/27/1348294127.db2.gz	XXJGYOKWQAGEQZ-UHFFFAOYSA-N	0	3	338.476	3.381	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc4cc(C)ccc4n3)C2)CC1	ZINC001050587107	1348294484	/nfs/dbraw/zinc/29/44/84/1348294484.db2.gz	XLGBUEPEPITPOR-UHFFFAOYSA-N	0	3	347.462	3.105	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)CCc3ccc(C)c(Cl)c3)C2)CC1	ZINC001050607606	1348299750	/nfs/dbraw/zinc/29/97/50/1348299750.db2.gz	MIHUXLWNIBITGP-UHFFFAOYSA-N	0	3	344.886	3.139	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccccc3-n3cccc3)C2)CC1	ZINC001050643464	1348313024	/nfs/dbraw/zinc/31/30/24/1348313024.db2.gz	CPFNGHTYGJKPHS-UHFFFAOYSA-N	0	3	347.462	3.039	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1cnccc1C)CC2	ZINC001050645577	1348313700	/nfs/dbraw/zinc/31/37/00/1348313700.db2.gz	RFAKNMJNUCPWKR-HXUWFJFHSA-N	0	3	341.499	3.417	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1c(C)noc1C)CC2	ZINC001050645630	1348313818	/nfs/dbraw/zinc/31/38/18/1348313818.db2.gz	RXMYFDKLYTXDPG-IBGZPJMESA-N	0	3	345.487	3.318	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C3[C@H]4CCCCCC[C@H]34)C2)CC1	ZINC001050678244	1348324103	/nfs/dbraw/zinc/32/41/03/1348324103.db2.gz	KSHGMWKVNAHYSV-ROUUACIJSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H](C)c3ccc(C)s3)C2)CC1	ZINC001050726409	1348338837	/nfs/dbraw/zinc/33/88/37/1348338837.db2.gz	BIAOLSOYHGHHPM-MRXNPFEDSA-N	0	3	330.497	3.108	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3oc4ccccc4c3Cl)C2)CC1	ZINC001050728648	1348339538	/nfs/dbraw/zinc/33/95/38/1348339538.db2.gz	TZBVVYOANKJMGE-UHFFFAOYSA-N	0	3	342.826	3.257	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3c(C)coc3C)cccc2C1	ZINC001051287981	1348419555	/nfs/dbraw/zinc/41/95/55/1348419555.db2.gz	INHPJPXMUZPUJQ-UHFFFAOYSA-N	0	3	336.435	3.208	20	30		EGEDHN
C=CCN1CCc2c(CNC(=O)c3c(C)cc(C)nc3C)cccc2C1	ZINC001051295704	1348423023	/nfs/dbraw/zinc/42/30/23/1348423023.db2.gz	IVRIEDAWXCGMSR-UHFFFAOYSA-N	0	3	349.478	3.481	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@@H](C)c2c(F)cccc2F)CC1	ZINC001052562303	1348580136	/nfs/dbraw/zinc/58/01/36/1348580136.db2.gz	OOSFWDPCNQVEDQ-LSDHHAIUSA-N	0	3	334.410	3.062	20	30		EGEDHN
CC1(C(=O)N[C@H]2CCCN(Cc3ccc(C#N)cc3)CC2)CCC1	ZINC001052626735	1348600044	/nfs/dbraw/zinc/60/00/44/1348600044.db2.gz	HYGYYJKLIPHUNU-SFHVURJKSA-N	0	3	325.456	3.219	20	30		EGEDHN
Cc1ncccc1C(=O)N[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC001052669042	1348622493	/nfs/dbraw/zinc/62/24/93/1348622493.db2.gz	UWYRZIMSLLOQED-LJQANCHMSA-N	0	3	348.450	3.046	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCN(Cc3ccc(C#N)cc3)CC2)C1	ZINC001052691913	1348635026	/nfs/dbraw/zinc/63/50/26/1348635026.db2.gz	ZEXHNSHTNVLSEX-LJQANCHMSA-N	0	3	337.467	3.385	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N[C@H]1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC001052697017	1348638782	/nfs/dbraw/zinc/63/87/82/1348638782.db2.gz	XNEBESCVQAAUAV-HSALFYBXSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@@H](C)c2ccc(F)c(F)c2)CC1	ZINC001052947150	1348763879	/nfs/dbraw/zinc/76/38/79/1348763879.db2.gz	JRFKJYKZWDEFIX-GOEBONIOSA-N	0	3	334.410	3.062	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@@H](C)c2ccc(F)cc2F)CC1	ZINC001052948192	1348765057	/nfs/dbraw/zinc/76/50/57/1348765057.db2.gz	YSHSBXUSHJJCQY-HOCLYGCPSA-N	0	3	334.410	3.062	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@@]2(C)CCc3ccccc3C2)CC1	ZINC001052983341	1348787609	/nfs/dbraw/zinc/78/76/09/1348787609.db2.gz	JNHNPTOMSLLVKM-UNMCSNQZSA-N	0	3	338.495	3.176	20	30		EGEDHN
C=CC[N@H+]1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001053067565	1348881056	/nfs/dbraw/zinc/88/10/56/1348881056.db2.gz	RWTOOQRGSNIMOD-WMZOPIPTSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=CC[N@@H+]1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001053067565	1348881061	/nfs/dbraw/zinc/88/10/61/1348881061.db2.gz	RWTOOQRGSNIMOD-WMZOPIPTSA-N	0	3	328.456	3.285	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cccc(C)n2)C1	ZINC001053072021	1348888725	/nfs/dbraw/zinc/88/87/25/1348888725.db2.gz	OSTXXTKFALUWKB-ICSRJNTNSA-N	0	3	339.483	3.120	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cccc(C)c2F)C1	ZINC001053086796	1348909691	/nfs/dbraw/zinc/90/96/91/1348909691.db2.gz	OVBMCQZRWZHKTH-IEBWSBKVSA-N	0	3	342.458	3.474	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cc3occc3[nH]2)C1	ZINC001053088171	1348912830	/nfs/dbraw/zinc/91/28/30/1348912830.db2.gz	ZJYVIZYWAIJJKY-YJBOKZPZSA-N	0	3	339.439	3.101	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)Cc2ccc(C)cc2)C1	ZINC001053091124	1348917318	/nfs/dbraw/zinc/91/73/18/1348917318.db2.gz	LCDYWRCAMPZLJC-RTWAWAEBSA-N	0	3	338.495	3.264	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)CC2CC(F)(F)C2)C1	ZINC001053093155	1348920824	/nfs/dbraw/zinc/92/08/24/1348920824.db2.gz	WEVZUHSQWKHFFV-IRXDYDNUSA-N	0	3	338.442	3.148	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cc(C(C)C)on2)C1	ZINC001053094597	1348924663	/nfs/dbraw/zinc/92/46/63/1348924663.db2.gz	WVLOHWTXHQXDJU-WMZOPIPTSA-N	0	3	343.471	3.138	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccoc2C2CC2)C1	ZINC001053095203	1348925089	/nfs/dbraw/zinc/92/50/89/1348925089.db2.gz	IHYUARXPCXBWMO-HKUYNNGSSA-N	0	3	340.467	3.497	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cc[nH]c2C2CC2)C1	ZINC001053096059	1348926157	/nfs/dbraw/zinc/92/61/57/1348926157.db2.gz	ONRASGNVUCAXCR-MJGOQNOKSA-N	0	3	339.483	3.232	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)Cc2ccc(C)s2)C1	ZINC001053103859	1348938263	/nfs/dbraw/zinc/93/82/63/1348938263.db2.gz	AMTGAIYRDIEAMK-IEBWSBKVSA-N	0	3	344.524	3.325	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(F)s2)C1	ZINC001053106109	1348944602	/nfs/dbraw/zinc/94/46/02/1348944602.db2.gz	SFRXFVUAFODMPP-CABCVRRESA-N	0	3	334.460	3.227	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1csc3ccccc13)C2	ZINC001054172246	1349172802	/nfs/dbraw/zinc/17/28/02/1349172802.db2.gz	JTJVWUJJYXNFQO-HXUWFJFHSA-N	0	3	338.476	3.463	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC[C@]3(CCN(C[C@@H](F)CC)C3)C2)cc1	ZINC001054174370	1349175325	/nfs/dbraw/zinc/17/53/25/1349175325.db2.gz	NRUYTEUJSDQQCB-PZJWPPBQSA-N	0	3	342.458	3.344	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)C[C@@H]1CCCC1(F)F)C2	ZINC001054184680	1349187876	/nfs/dbraw/zinc/18/78/76/1349187876.db2.gz	JTQZREHQFDTYJW-FUHWJXTLSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1nccc3ccccc31)C2	ZINC001054185756	1349188218	/nfs/dbraw/zinc/18/82/18/1349188218.db2.gz	IIZNYABLTPICJY-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccccc1C1(C)CC1)C2	ZINC001054197314	1349199659	/nfs/dbraw/zinc/19/96/59/1349199659.db2.gz	VRXITKMYURTKKC-JOCHJYFZSA-N	0	3	336.479	3.299	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(C)cc1F)C2	ZINC001054203693	1349205444	/nfs/dbraw/zinc/20/54/44/1349205444.db2.gz	JVJIBRBPLWSGQZ-FQEVSTJZSA-N	0	3	328.431	3.086	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)C(C)(C)Cc1ccccc1)C2	ZINC001054224462	1349219875	/nfs/dbraw/zinc/21/98/75/1349219875.db2.gz	CZWRFXVBPJWFOM-QFIPXVFZSA-N	0	3	338.495	3.203	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H](C)c1ccccc1C)C2	ZINC001054243506	1349238127	/nfs/dbraw/zinc/23/81/27/1349238127.db2.gz	JBRRQAHMGGPIDJ-SIKLNZKXSA-N	0	3	338.495	3.436	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)CC(C)(C)c1ccccc1)C2	ZINC001054245647	1349239225	/nfs/dbraw/zinc/23/92/25/1349239225.db2.gz	XLHQYBBCHAUWGA-QFIPXVFZSA-N	0	3	338.495	3.302	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1coc3ccccc13)C2	ZINC001054248218	1349244062	/nfs/dbraw/zinc/24/40/62/1349244062.db2.gz	ODWRUFYLPVACMO-OAQYLSRUSA-N	0	3	336.435	3.384	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3scnc3C)cc2C1	ZINC001054256522	1349253154	/nfs/dbraw/zinc/25/31/54/1349253154.db2.gz	CTQNAQWOIIAAAK-UHFFFAOYSA-N	0	3	327.453	3.273	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@@H]3C[C@@H]3OCC)cc2C1	ZINC001054257714	1349253616	/nfs/dbraw/zinc/25/36/16/1349253616.db2.gz	UFYUBFCBDWSUAZ-MOPGFXCFSA-N	0	3	328.456	3.010	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3nccn3CC)cc2C1	ZINC001054262645	1349260502	/nfs/dbraw/zinc/26/05/02/1349260502.db2.gz	MDCDISHEZJFNRQ-UHFFFAOYSA-N	0	3	338.455	3.115	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@H]3CCCOCC3)cc2C1	ZINC001054263066	1349260664	/nfs/dbraw/zinc/26/06/64/1349260664.db2.gz	DKTMLKNMDIGPNO-SFHVURJKSA-N	0	3	342.483	3.401	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3ccns3)cc2C1	ZINC001054268206	1349265748	/nfs/dbraw/zinc/26/57/48/1349265748.db2.gz	HRGJPWAKAOABSG-UHFFFAOYSA-N	0	3	327.453	3.355	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3ocnc3CC)cc2C1	ZINC001054281627	1349283411	/nfs/dbraw/zinc/28/34/11/1349283411.db2.gz	TVCRGQRAZPQOHX-UHFFFAOYSA-N	0	3	339.439	3.449	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cn(CC)nc3C)cc2C1	ZINC001054284057	1349285491	/nfs/dbraw/zinc/28/54/91/1349285491.db2.gz	BWZMLHOEYOTNPM-UHFFFAOYSA-N	0	3	338.455	3.033	20	30		EGEDHN
Cc1ccsc1C(=O)N1C[C@H](NCc2ccc(C#N)s2)[C@@H](C)C1	ZINC001054341416	1349321758	/nfs/dbraw/zinc/32/17/58/1349321758.db2.gz	ZQJMNGMEJWLYLH-WFASDCNBSA-N	0	3	345.493	3.240	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@@H](C)[C@@H](NCc2scnc2C)C1	ZINC001054679613	1349434790	/nfs/dbraw/zinc/43/47/90/1349434790.db2.gz	KIRFATAISUXZML-MFKMUULPSA-N	0	3	341.908	3.167	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@H](NCc2scnc2C)[C@@H](C)C1	ZINC001054679610	1349434966	/nfs/dbraw/zinc/43/49/66/1349434966.db2.gz	KIRFATAISUXZML-GWCFXTLKSA-N	0	3	341.908	3.167	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](NCc2cnn(C(C)(C)C)c2)[C@@H](C)C1	ZINC001054971843	1349532666	/nfs/dbraw/zinc/53/26/66/1349532666.db2.gz	VCUZRUAIXOFKDH-RDJZCZTQSA-N	0	3	346.519	3.177	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CN(Cc3ccc(OC)cc3)C[C@H]2C)CC1	ZINC001080391533	1357601737	/nfs/dbraw/zinc/60/17/37/1357601737.db2.gz	MVVTWFKNECCJNG-OXQOHEQNSA-N	0	3	342.483	3.378	20	30		EGEDHN
C#CCCN1C[C@@H](C)[C@H](NC(=O)[C@@H]2C[C@H]2c2cccc3ccccc32)C1	ZINC001080637769	1357712225	/nfs/dbraw/zinc/71/22/25/1357712225.db2.gz	ZLEDTFICUOXOPB-IDZYALCFSA-N	0	3	346.474	3.403	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2ccc(-c3ccccc3)nc2)C1	ZINC001080664456	1357719080	/nfs/dbraw/zinc/71/90/80/1357719080.db2.gz	ZFRAIVQVSIBBCJ-OXQOHEQNSA-N	0	3	335.451	3.375	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)[C@@H]2C[C@H]2CC(C)(C)C)C1	ZINC001070411628	1354340968	/nfs/dbraw/zinc/34/09/68/1354340968.db2.gz	UIUJXSNVQZHRDT-YQQAZPJKSA-N	0	3	344.503	3.074	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)[C@@H]2CCCCC2(C)C)C1	ZINC001070435643	1354348361	/nfs/dbraw/zinc/34/83/61/1354348361.db2.gz	MSWGXXSKHJRTQT-RDJZCZTQSA-N	0	3	344.503	3.218	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)[C@@H]2CCCC(C)(C)C2)C1	ZINC001070435353	1354348394	/nfs/dbraw/zinc/34/83/94/1354348394.db2.gz	DOHJGHCBQUPDHG-HZPDHXFCSA-N	0	3	344.503	3.218	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1sc(C)cc1C)C[C@@H](C)O2	ZINC001071174088	1354487771	/nfs/dbraw/zinc/48/77/71/1354487771.db2.gz	SOOGKBMSACYHNX-DNVCBOLYSA-N	0	3	348.512	3.246	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C1(C)CCCCC1)C[C@H](C)O2	ZINC001071206532	1354504570	/nfs/dbraw/zinc/50/45/70/1354504570.db2.gz	LQHGDNKPXNRFKG-FXAWDEMLSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H](C)O[C@]3(CCN(CC=C(C)C)C3)C2)C1	ZINC001071211568	1354507752	/nfs/dbraw/zinc/50/77/52/1354507752.db2.gz	KEDISUAVWXOSBM-PXNSSMCTSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1ccc(C)cc1C)C[C@@H](C)O2	ZINC001071236292	1354520903	/nfs/dbraw/zinc/52/09/03/1354520903.db2.gz	SOIXBNUCRAQBSI-WIYYLYMNSA-N	0	3	342.483	3.185	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cn(-c3ccccc3)cn2)CC[C@@H]1C	ZINC001071527547	1354746965	/nfs/dbraw/zinc/74/69/65/1354746965.db2.gz	FSBLVJFYINAYLF-DLBZAZTESA-N	0	3	338.455	3.031	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cccc(OCCC)c2)CC[C@@H]1C	ZINC001071544422	1354758029	/nfs/dbraw/zinc/75/80/29/1354758029.db2.gz	YPTFFKMRZAVSKL-WMZOPIPTSA-N	0	3	328.456	3.081	20	30		EGEDHN
C=C(C)CCN1C[C@H](NC(=O)c2cn3cc(C)nc3s2)CC[C@@H]1C	ZINC001071568498	1354768757	/nfs/dbraw/zinc/76/87/57/1354768757.db2.gz	OEEJRYUUVSYLLA-LSDHHAIUSA-N	0	3	346.500	3.253	20	30		EGEDHN
C=C(C)CCN1C[C@H](NC(=O)c2sc3nccn3c2C)CC[C@@H]1C	ZINC001071574285	1354772220	/nfs/dbraw/zinc/77/22/20/1354772220.db2.gz	MXSGONOCYQUWDI-DZGCQCFKSA-N	0	3	346.500	3.253	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccccc2-c2ccncc2)CC[C@@H]1C	ZINC001071607643	1354793063	/nfs/dbraw/zinc/79/30/63/1354793063.db2.gz	RAGQVDNYXIPSMH-HKUYNNGSSA-N	0	3	347.462	3.355	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cccc3c(C)c(C)[nH]c32)CC[C@H]1C	ZINC001071612612	1354796715	/nfs/dbraw/zinc/79/67/15/1354796715.db2.gz	KZFPBNODPWJYPC-RHSMWYFYSA-N	0	3	337.467	3.391	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2ncc(Cl)s2)CC[C@H]1C	ZINC001071683431	1354849815	/nfs/dbraw/zinc/84/98/15/1354849815.db2.gz	ZSRGDLILZQJVIT-NEPJUHHUSA-N	0	3	327.881	3.345	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2c[nH]nc2-c2ccccc2)CC[C@H]1C	ZINC001071716666	1354874299	/nfs/dbraw/zinc/87/42/99/1354874299.db2.gz	YVJUUCDIFRQKPT-WBVHZDCISA-N	0	3	338.455	3.236	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)Cc2csc(C(C)(C)C)n2)CC[C@@H]1C	ZINC001071899671	1355014006	/nfs/dbraw/zinc/01/40/06/1355014006.db2.gz	BXMZBXLPPVYGGF-UONOGXRCSA-N	0	3	335.517	3.138	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2cc3cccnc3s2)CC[C@H]1C	ZINC001071957208	1355042533	/nfs/dbraw/zinc/04/25/33/1355042533.db2.gz	FHXCYVLURHQZOU-HIFRSBDPSA-N	0	3	329.469	3.455	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc(C)n(CC3CC3)c2C)CC[C@H]1C	ZINC001072002723	1355068287	/nfs/dbraw/zinc/06/82/87/1355068287.db2.gz	NYHNXJZDZYUTJW-BEFAXECRSA-N	0	3	341.499	3.121	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2ccc(Br)o2)CC[C@@H]1C	ZINC001072019201	1355082154	/nfs/dbraw/zinc/08/21/54/1355082154.db2.gz	DZSGCWRISGBTDC-RYUDHWBXSA-N	0	3	341.249	3.201	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc(OC)c(C)c(OC)c2)CC[C@@H]1C	ZINC001072050501	1355104172	/nfs/dbraw/zinc/10/41/72/1355104172.db2.gz	YNSKBYYBUGDZOR-WMLDXEAASA-N	0	3	346.471	3.171	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2ccc3c(c2)CCC3)CC[C@H]1C	ZINC001072070649	1355111388	/nfs/dbraw/zinc/11/13/88/1355111388.db2.gz	RJTPWAXWQLWCPO-OXQOHEQNSA-N	0	3	326.484	3.263	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc(-c3ccc(C)o3)n[nH]2)CC[C@@H]1C	ZINC001072072299	1355113082	/nfs/dbraw/zinc/11/30/82/1355113082.db2.gz	IODAHXXDQBVEGX-DZGCQCFKSA-N	0	3	342.443	3.137	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2nsc3ccccc32)CC[C@H]1C	ZINC001072092259	1355124326	/nfs/dbraw/zinc/12/43/26/1355124326.db2.gz	OSZDOZBGELHMIC-CABCVRRESA-N	0	3	343.496	3.384	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(N(C)C(C)C)cc2)CC[C@@H]1C	ZINC001072116230	1355140905	/nfs/dbraw/zinc/14/09/05/1355140905.db2.gz	JYJKYJSUAGDMHP-PKOBYXMFSA-N	0	3	341.499	3.137	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](C)[C@H](CNCc3csc(C)n3)C2)C1	ZINC001072364126	1355258445	/nfs/dbraw/zinc/25/84/45/1355258445.db2.gz	OYONRSYDYDJQPN-GOEBONIOSA-N	0	3	347.528	3.382	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3ccc(C(C)C)nc3CC)C2)C1	ZINC001072989044	1355536277	/nfs/dbraw/zinc/53/62/77/1355536277.db2.gz	BKWVUOPCXAEVSC-UHFFFAOYSA-N	0	3	327.472	3.101	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3cc(Cl)ccc3Cl)C2)C1	ZINC001073147652	1355626015	/nfs/dbraw/zinc/62/60/15/1355626015.db2.gz	HQAVREFSLSYVQM-UHFFFAOYSA-N	0	3	325.239	3.327	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3cccc(OCC(C)C)c3)C2)C1	ZINC001073413095	1355766132	/nfs/dbraw/zinc/76/61/32/1355766132.db2.gz	PKHJZHOYDPYYGH-UHFFFAOYSA-N	0	3	328.456	3.055	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2sccc2C2CC2)C1	ZINC001073877975	1355934777	/nfs/dbraw/zinc/93/47/77/1355934777.db2.gz	FEDBUQQLJPIICP-HNNXBMFYSA-N	0	3	334.485	3.022	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2cc3cccc(C)c3o2)C1	ZINC001073902000	1355945903	/nfs/dbraw/zinc/94/59/03/1355945903.db2.gz	NPWNTBNEDPACKE-KRWDZBQOSA-N	0	3	342.439	3.138	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)N1CCCC[C@@H]1CN(C)Cc1cccc(C#N)c1	ZINC001074045375	1356050819	/nfs/dbraw/zinc/05/08/19/1356050819.db2.gz	LGWMDCAOZSMLDI-ATZDWAIDSA-N	0	3	325.456	3.027	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCCN1C(=O)[C@H]1CC12CC2	ZINC001074071587	1356066448	/nfs/dbraw/zinc/06/64/48/1356066448.db2.gz	GGLLXOIJGQXHNU-RTBURBONSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=C[C@H](C(=O)N1CC[C@H](NCc2ccns2)[C@@H]1C)c1ccccc1	ZINC001075124943	1356319570	/nfs/dbraw/zinc/31/95/70/1356319570.db2.gz	ODKWUJUKRNPHFN-WBAXXEDZSA-N	0	3	341.480	3.192	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@@H](CNCc2cc(F)ccc2C#N)[C@@H](C)C1	ZINC001075209999	1356344162	/nfs/dbraw/zinc/34/41/62/1356344162.db2.gz	UIICGPZNXPBBDZ-RDJZCZTQSA-N	0	3	343.446	3.238	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@@H]3Cc4ccc(Cl)cc43)[C@@H]2C1	ZINC001076515179	1356599913	/nfs/dbraw/zinc/59/99/13/1356599913.db2.gz	WHOKKNCOARTHAV-BMGDILEWSA-N	0	3	330.859	3.089	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)c3cccc(OCC(C)C)c3)[C@@H]2C1	ZINC001076549912	1356615579	/nfs/dbraw/zinc/61/55/79/1356615579.db2.gz	GOBRIXXIYUPODU-PKOBYXMFSA-N	0	3	328.456	3.054	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cccc(-n3cccc3)c2)C1	ZINC001098927535	1363524345	/nfs/dbraw/zinc/52/43/45/1363524345.db2.gz	RAOHCSDUHCZAQQ-UGKGYDQZSA-N	0	3	347.462	3.085	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)Cc2cccc(C)c2Cl)C1	ZINC001098940624	1363530440	/nfs/dbraw/zinc/53/04/40/1363530440.db2.gz	AQLOWPJIQOVACL-LPHOPBHVSA-N	0	3	332.875	3.348	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)C[C@@H](C)c1ccncc1	ZINC001099125915	1363638939	/nfs/dbraw/zinc/63/89/39/1363638939.db2.gz	MPPAQLIAQNKESQ-AEFFLSMTSA-N	0	3	329.488	3.368	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@H](C)c2ccsc2)C[C@H]1C(F)(F)F	ZINC001099306319	1363741088	/nfs/dbraw/zinc/74/10/88/1363741088.db2.gz	XHXWWXRSMOIDNY-RAIGVLPGSA-N	0	3	332.391	3.017	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCCO[C@H](CNCc2ccsc2)C1	ZINC001078460280	1356977471	/nfs/dbraw/zinc/97/74/71/1356977471.db2.gz	PFVNKAXLUTVAFF-SJLPKXTDSA-N	0	3	336.501	3.058	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@@H](NC(=O)CC3CC3)C23CCC3)c1	ZINC001078530888	1356998055	/nfs/dbraw/zinc/99/80/55/1356998055.db2.gz	DETQBMDSBXZDOK-ZWKOTPCHSA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2cc(C(C)C)on2)C12CCC2	ZINC001078688984	1357054375	/nfs/dbraw/zinc/05/43/75/1357054375.db2.gz	ZDINQHQYQDDSEI-HUUCEWRRSA-N	0	3	337.851	3.181	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@H](NCc3conc3C)C23CCC3)CC1	ZINC001078716655	1357063125	/nfs/dbraw/zinc/06/31/25/1357063125.db2.gz	WGPVOSIBAAXOLO-ROUUACIJSA-N	0	3	343.471	3.246	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2oc(C3CC3)nc2C)C12CCC2	ZINC001078744396	1357068976	/nfs/dbraw/zinc/06/89/76/1357068976.db2.gz	TUJZFYQTXMAXLL-KGLIPLIRSA-N	0	3	349.862	3.244	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc3c(c2)COC3)C12CCC2	ZINC001078745702	1357069630	/nfs/dbraw/zinc/06/96/30/1357069630.db2.gz	BHVHKTDCMSTIAK-IRXDYDNUSA-N	0	3	346.858	3.100	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C(C)(C)C2CCCC2)C[C@H]1c1ccccc1	ZINC001081127032	1357842874	/nfs/dbraw/zinc/84/28/74/1357842874.db2.gz	RHMHNELXGHGEMG-VQTJNVASSA-N	0	3	338.495	3.420	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H]2CCCCC2(F)F)C[C@H]1c1ccccc1	ZINC001081151540	1357845524	/nfs/dbraw/zinc/84/55/24/1357845524.db2.gz	MOEJUPUTBZRDRB-OKZBNKHCSA-N	0	3	346.421	3.029	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H]2C[C@H]2c2ccccc2)C[C@H]1c1ccccc1	ZINC001081215193	1357849826	/nfs/dbraw/zinc/84/98/26/1357849826.db2.gz	GFZRNZZPYBHGBW-LNRXMEIDSA-N	0	3	344.458	3.008	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H](C)c2ccccc2C)C[C@H]1c1ccccc1	ZINC001081230240	1357852067	/nfs/dbraw/zinc/85/20/67/1357852067.db2.gz	VOVQOVLCHBORNA-BVYCBKJFSA-N	0	3	346.474	3.316	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@H]2CC23CCCC3)C[C@H]1NCc1ccc(C#N)s1	ZINC001082842260	1358097150	/nfs/dbraw/zinc/09/71/50/1358097150.db2.gz	DEZLXRYOXOZYSI-KBRIMQKVSA-N	0	3	343.496	3.137	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3cc(-c4ccccc4)no3)[C@@H]2C1	ZINC001084478723	1358223228	/nfs/dbraw/zinc/22/32/28/1358223228.db2.gz	GPJLOWBKULNUEF-SJLPKXTDSA-N	0	3	337.423	3.064	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CCN(CCc3ccccc3)C[C@H]21	ZINC001084635049	1358263286	/nfs/dbraw/zinc/26/32/86/1358263286.db2.gz	NZIZXWXFMAFKAJ-SFHLNBCPSA-N	0	3	326.484	3.364	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)c3ccc(Cl)cc3Cl)[C@@H]2C1	ZINC001084791966	1358311503	/nfs/dbraw/zinc/31/15/03/1358311503.db2.gz	FFSWNRHWWRQCKL-MLGOLLRUSA-N	0	3	337.250	3.163	20	30		EGEDHN
C/C(=C\C(=O)N1CC[C@H]2CCN(Cc3cccc(C#N)c3)[C@H]2C1)C1CC1	ZINC001084897187	1358343463	/nfs/dbraw/zinc/34/34/63/1358343463.db2.gz	ROCRZYOECKKANA-ODOLEDHDSA-N	0	3	349.478	3.337	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@H]2CCN(Cc3ccc(C#N)cc3)[C@H]2C1)C1CC1	ZINC001084913394	1358345892	/nfs/dbraw/zinc/34/58/92/1358345892.db2.gz	MLSVROAFSFNDBR-YSGRDPCXSA-N	0	3	337.467	3.027	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CCN(C(=O)[C@H]4[C@@H]5CCC[C@@H]54)C[C@@H]32)cc1	ZINC001084913806	1358346684	/nfs/dbraw/zinc/34/66/84/1358346684.db2.gz	AKKLWAAIHFTYPU-MJCUULBUSA-N	0	3	349.478	3.027	20	30		EGEDHN
CC1CC(C(=O)N2CC[C@H]3CCN(Cc4cccc(C#N)c4)[C@H]3C2)C1	ZINC001084917680	1358348508	/nfs/dbraw/zinc/34/85/08/1358348508.db2.gz	GQOOHKKIKJNNLS-TXQCFWEHSA-N	0	3	337.467	3.027	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C3[C@H]4CCCCCC[C@H]34)C[C@@H]21	ZINC001085042245	1358374826	/nfs/dbraw/zinc/37/48/26/1358374826.db2.gz	VCWOZUBOKCKHOH-XWSJACJDSA-N	0	3	328.500	3.149	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3c3cccc(C)c3)C[C@@H]21	ZINC001085055249	1358380167	/nfs/dbraw/zinc/38/01/67/1358380167.db2.gz	YTNZOLQKFUPHEG-PMXSJFBMSA-N	0	3	336.479	3.045	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@]3(c4ccccc4)CC3(C)C)C[C@@H]21	ZINC001085061327	1358380659	/nfs/dbraw/zinc/38/06/59/1358380659.db2.gz	AJLSCWMIAJSLKD-LZNRXBQRSA-N	0	3	338.495	3.463	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)CC1CCCC1	ZINC001085122181	1358400584	/nfs/dbraw/zinc/40/05/84/1358400584.db2.gz	QASQUWWQXJZXNY-HUUCEWRRSA-N	0	3	343.309	3.492	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCCC[C@H]2NC(=O)C=C2CCC2)c(F)c1	ZINC001085166448	1358420887	/nfs/dbraw/zinc/42/08/87/1358420887.db2.gz	ARJRTNXKXRXQSP-RTBURBONSA-N	0	3	341.430	3.325	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cccnc1C(F)F	ZINC001085268057	1358447316	/nfs/dbraw/zinc/44/73/16/1358447316.db2.gz	GBBDFNOLEBLMND-CHWSQXEVSA-N	0	3	343.805	3.402	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)[C@H]1COc2ccccc2C1	ZINC001085266276	1358447703	/nfs/dbraw/zinc/44/77/03/1358447703.db2.gz	RAMQHTNAKGEITR-BRWVUGGUSA-N	0	3	348.874	3.007	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)Cc1sc(C)nc1C	ZINC001085278647	1358450214	/nfs/dbraw/zinc/45/02/14/1358450214.db2.gz	RYLIAYGHTBPWEV-ZIAGYGMSSA-N	0	3	341.908	3.072	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1scnc1C1CC1	ZINC001085357070	1358477021	/nfs/dbraw/zinc/47/70/21/1358477021.db2.gz	BZZXPYBTSLLKDD-CHWSQXEVSA-N	0	3	339.892	3.404	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1c(F)c(F)cc(F)c1F	ZINC001085610331	1358630992	/nfs/dbraw/zinc/63/09/92/1358630992.db2.gz	PKRLMWWQZYCUIF-NSHDSACASA-N	0	3	344.352	3.356	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1ccnc(-c2ccco2)c1	ZINC001085662359	1358666529	/nfs/dbraw/zinc/66/65/29/1358666529.db2.gz	XNOFOQXQTIQFMV-MRXNPFEDSA-N	0	3	325.412	3.064	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc(C)nc1C1CC1	ZINC001085747667	1358729625	/nfs/dbraw/zinc/72/96/25/1358729625.db2.gz	MJPXZRLSOVOFBB-QGZVFWFLSA-N	0	3	327.472	3.380	20	30		EGEDHN
C=C1CCC(C(=O)N(C)C[C@H]2CCN2CC[C@@H]2CCCCO2)CC1	ZINC001085800796	1358776241	/nfs/dbraw/zinc/77/62/41/1358776241.db2.gz	BWEQVXOBAAYPJU-MOPGFXCFSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cnccc1C(F)(F)F	ZINC001085844276	1358812812	/nfs/dbraw/zinc/81/28/12/1358812812.db2.gz	ISWZYFCZXOAEBP-CYBMUJFWSA-N	0	3	341.377	3.213	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc(Br)co1	ZINC001085856746	1358823526	/nfs/dbraw/zinc/82/35/26/1358823526.db2.gz	HMFZPGRMHQHCBB-CYBMUJFWSA-N	0	3	341.249	3.155	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@@H]1C[C@H]1c1ccc(OC)cc1	ZINC001085865701	1358831818	/nfs/dbraw/zinc/83/18/18/1358831818.db2.gz	LCBPSJUKWFLVHS-YZGWKJHDSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc2scnc2c1	ZINC001085903348	1358861911	/nfs/dbraw/zinc/86/19/11/1358861911.db2.gz	CEKUGRCZJYKEFA-OAHLLOKOSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1ccc(N(CC)CC)cc1	ZINC001085943956	1358903039	/nfs/dbraw/zinc/90/30/39/1358903039.db2.gz	VZUHAUIBFXMSEB-IBGZPJMESA-N	0	3	329.488	3.255	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc(-c2ccc(C)o2)n[nH]1	ZINC001085969472	1358924769	/nfs/dbraw/zinc/92/47/69/1358924769.db2.gz	BWJAAYYMVXCAFN-HNNXBMFYSA-N	0	3	342.443	3.091	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc(N(C)CC)cc1	ZINC001085998973	1358954984	/nfs/dbraw/zinc/95/49/84/1358954984.db2.gz	VKWYMCMDHJBSRP-LJQANCHMSA-N	0	3	329.488	3.255	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)C2CCCCCC2)C1	ZINC001086041597	1358976732	/nfs/dbraw/zinc/97/67/32/1358976732.db2.gz	XBUBJMWPOFBHLE-OTVXOJSOSA-N	0	3	343.309	3.350	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2nccc3ccsc32)C1	ZINC001086112418	1359000000	/nfs/dbraw/zinc/00/00/00/1359000000.db2.gz	IOLCNKFILBHWFL-BJHJDKERSA-N	0	3	335.860	3.147	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2nccc3ccccc32)C1	ZINC001086180942	1359017711	/nfs/dbraw/zinc/01/77/11/1359017711.db2.gz	MVMRWBXLRVMRQL-OTVXOJSOSA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2C[C@@H](N[C@H](C)c3cnc(C)cn3)C2)CC1	ZINC001086187797	1359020795	/nfs/dbraw/zinc/02/07/95/1359020795.db2.gz	PQSVPNFGYXKLLH-NUJGCVRESA-N	0	3	342.487	3.077	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@@H]2C[C@]23CCc2ccccc23)C1	ZINC001086240532	1359037504	/nfs/dbraw/zinc/03/75/04/1359037504.db2.gz	XLZJUZYHOYWJPA-HUOQQOJOSA-N	0	3	344.886	3.127	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cccc3cccnc32)C1	ZINC001086419778	1359091653	/nfs/dbraw/zinc/09/16/53/1359091653.db2.gz	LFXRIOVTABUOFF-CTYIDZIISA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cnc3ccccc3c2)C1	ZINC001086490928	1359117497	/nfs/dbraw/zinc/11/74/97/1359117497.db2.gz	IMGOIJUWRFDONO-SAZUREKKSA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@@H]2C[C@H]2c2ccccc2F)C1	ZINC001086501794	1359121701	/nfs/dbraw/zinc/12/17/01/1359121701.db2.gz	SXLLBLVIRPLGIR-DARAHFNDSA-N	0	3	336.838	3.166	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cccc(C(F)F)c2)C1	ZINC001086538662	1359136084	/nfs/dbraw/zinc/13/60/84/1359136084.db2.gz	PZPYUCAPWQFDOW-YEORSEQZSA-N	0	3	328.790	3.475	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cccc3c2OCC3(C)C)C1	ZINC001086566781	1359149629	/nfs/dbraw/zinc/14/96/29/1359149629.db2.gz	FKJQDLJUTLETCU-HDJSIYSDSA-N	0	3	348.874	3.207	20	30		EGEDHN
C=C(C)CN1C[C@@H](c2ccccc2)[C@H](NC(=O)C2C=CC=CC=C2)C1	ZINC001086589983	1359157428	/nfs/dbraw/zinc/15/74/28/1359157428.db2.gz	FGUDACVDMFMGHT-LEWJYISDSA-N	0	3	334.463	3.445	20	30		EGEDHN
C=C(C)CN1C[C@@H](c2ccccc2)[C@H](NC(=O)Cc2cnccc2C)C1	ZINC001086593175	1359158089	/nfs/dbraw/zinc/15/80/89/1359158089.db2.gz	GVCAVDQYENDICI-LEWJYISDSA-N	0	3	349.478	3.093	20	30		EGEDHN
C=C(C)CN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2[nH]c(C)cc2C)C1	ZINC001086595284	1359158900	/nfs/dbraw/zinc/15/89/00/1359158900.db2.gz	UVDRXVGQZDNIJG-RBUKOAKNSA-N	0	3	337.467	3.405	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)C[C@@H]2CC=CCC2)C1	ZINC001086603830	1359161368	/nfs/dbraw/zinc/16/13/68/1359161368.db2.gz	XDLOQSQFGSPKLS-HLAWJBBLSA-N	0	3	336.479	3.340	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccc3cc(C)cn3c2)C1	ZINC001086714094	1359190383	/nfs/dbraw/zinc/19/03/83/1359190383.db2.gz	LFUZXSMSKOHREW-DOTOQJQBSA-N	0	3	345.874	3.488	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cc3cnccc3o2)C1	ZINC001086745447	1359194211	/nfs/dbraw/zinc/19/42/11/1359194211.db2.gz	UZZYRGCTMHKAQK-GXTWGEPZSA-N	0	3	333.819	3.068	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cnc3ccccc3c2)C1	ZINC001086814857	1359207143	/nfs/dbraw/zinc/20/71/43/1359207143.db2.gz	PWGXLUYJAPXAFF-WMLDXEAASA-N	0	3	343.858	3.475	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc4occc4[nH]3)C2)CC1	ZINC001086926005	1359251351	/nfs/dbraw/zinc/25/13/51/1359251351.db2.gz	NCMAORHDYVRULM-OAHLLOKOSA-N	0	3	339.439	3.101	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3nc(C)sc3C)C2)CC1	ZINC001086929001	1359253655	/nfs/dbraw/zinc/25/36/55/1359253655.db2.gz	UOOPSWRXMYNYRZ-AWEZNQCLSA-N	0	3	345.512	3.100	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc[nH]c3CCC)C2)CC1	ZINC001086938419	1359261240	/nfs/dbraw/zinc/26/12/40/1359261240.db2.gz	PSUAEHUHAJTDON-QGZVFWFLSA-N	0	3	341.499	3.307	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H]3C[C@H]3c3ccco3)C2)CC1	ZINC001086945109	1359265644	/nfs/dbraw/zinc/26/56/44/1359265644.db2.gz	RJAJWALALMRKNC-KZNAEPCWSA-N	0	3	340.467	3.109	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)CCc3cccs3)C2)CC1	ZINC001086956903	1359277485	/nfs/dbraw/zinc/27/74/85/1359277485.db2.gz	ZVRGADOPUUDEDT-QGZVFWFLSA-N	0	3	344.524	3.407	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)CC(C3CC3)C3CC3)C2)CC1	ZINC001086958096	1359278883	/nfs/dbraw/zinc/27/88/83/1359278883.db2.gz	DJQFXUFHOQNIBK-MRXNPFEDSA-N	0	3	328.500	3.149	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cccc4c3CCC4)C2)CC1	ZINC001086958246	1359279478	/nfs/dbraw/zinc/27/94/78/1359279478.db2.gz	JUIZOZRPVVVHHV-QGZVFWFLSA-N	0	3	336.479	3.125	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3c(C)nsc3C)C2)CC1	ZINC001086958663	1359279865	/nfs/dbraw/zinc/27/98/65/1359279865.db2.gz	XKVBQNNNBCWLEC-AWEZNQCLSA-N	0	3	345.512	3.100	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)Cc3c(C)cccc3C)C(C)(C)[C@@H]21	ZINC001087287347	1359365798	/nfs/dbraw/zinc/36/57/98/1359365798.db2.gz	GFIGRQBCWYRXRB-DUXKGJEZSA-N	0	3	338.495	3.084	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc(Cl)c3F)C(C)(C)[C@@H]21	ZINC001087304237	1359387600	/nfs/dbraw/zinc/38/76/00/1359387600.db2.gz	ZIFIVJGRQQCWKW-KBRIMQKVSA-N	0	3	348.849	3.331	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc4[nH]ccc43)C(C)(C)[C@H]21	ZINC001087305799	1359391527	/nfs/dbraw/zinc/39/15/27/1359391527.db2.gz	YUBGTEZNHKLBMS-QRQLOZEOSA-N	0	3	335.451	3.020	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc4ccncc4c3)C(C)(C)[C@@H]21	ZINC001087312149	1359399892	/nfs/dbraw/zinc/39/98/92/1359399892.db2.gz	ZTUAEUOTCMVQRT-VAMGGRTRSA-N	0	3	347.462	3.087	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(F)cc3Cl)C(C)(C)[C@@H]21	ZINC001087315913	1359405706	/nfs/dbraw/zinc/40/57/06/1359405706.db2.gz	KFZQSHWPOYXVBN-DJIMGWMZSA-N	0	3	348.849	3.331	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc(C)c(F)c(C)c1	ZINC001087318180	1359409896	/nfs/dbraw/zinc/40/98/96/1359409896.db2.gz	SKIDMDOVGWLWDI-NZSAHSFTSA-N	0	3	342.458	3.295	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)Cc3ccccc3C)C(C)(C)[C@H]21	ZINC001087317938	1359410167	/nfs/dbraw/zinc/41/01/67/1359410167.db2.gz	OYGKZNGIZGSVFM-GIVPXCGWSA-N	0	3	338.495	3.166	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc(F)s1	ZINC001087319636	1359412426	/nfs/dbraw/zinc/41/24/26/1359412426.db2.gz	RBJDVJUTEQVZDN-UHOFOFEASA-N	0	3	334.460	3.129	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)C[C@H]2C=CCC2)CCN1Cc1cccc(C#N)c1	ZINC001087496856	1359496779	/nfs/dbraw/zinc/49/67/79/1359496779.db2.gz	OKAKWOSPJOFIHC-FFZOFVMBSA-N	0	3	337.467	3.384	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cn(CC)c3ccccc23)[C@H]1CC	ZINC001087649512	1359571700	/nfs/dbraw/zinc/57/17/00/1359571700.db2.gz	QNXUFADVIZXINO-RBUKOAKNSA-N	0	3	337.467	3.267	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ncsc2C(F)(F)F)[C@H]1CC	ZINC001087656492	1359574864	/nfs/dbraw/zinc/57/48/64/1359574864.db2.gz	HYNCLDJVKKUEQQ-WDEREUQCSA-N	0	3	347.406	3.321	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2sc(CCC)nc2C)[C@H]1CC	ZINC001087826728	1359666841	/nfs/dbraw/zinc/66/68/41/1359666841.db2.gz	DIEKAZHRGZZOOA-LSDHHAIUSA-N	0	3	333.501	3.010	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(OC(C)C)cc2)[C@H]1CC	ZINC001087838223	1359672481	/nfs/dbraw/zinc/67/24/81/1359672481.db2.gz	XPSHUXAVMCXTHX-VQTJNVASSA-N	0	3	342.483	3.009	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3cc(C4CC4)oc3C3CC3)C[C@@H]2C1	ZINC001088047983	1359734816	/nfs/dbraw/zinc/73/48/16/1359734816.db2.gz	FELZRNZUBCSDLC-SJORKVTESA-N	0	3	338.451	3.062	20	30		EGEDHN
COCCN(CCC(=O)OC(C)(C)C)Cc1ccc(C#N)c(C)c1	ZINC001184229705	1387416937	/nfs/dbraw/zinc/41/69/37/1387416937.db2.gz	WFWBKHRSBNTJSW-UHFFFAOYSA-N	0	3	332.444	3.047	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3cc(C(C)(C)C)oc3C)C[C@@H]2C1	ZINC001088122470	1359764273	/nfs/dbraw/zinc/76/42/73/1359764273.db2.gz	CPLQPZRGAHBNBP-SJORKVTESA-N	0	3	342.483	3.303	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)[C@H](C)c3ccc(CC)cc3)C[C@@H]2C1	ZINC001088140925	1359770742	/nfs/dbraw/zinc/77/07/42/1359770742.db2.gz	LTEOFWQJDFMJFZ-UIFIKXQLSA-N	0	3	338.495	3.156	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)C[C@@H]2CC(C)(C)CO2)C1	ZINC001088346616	1359833730	/nfs/dbraw/zinc/83/37/30/1359833730.db2.gz	UKJVKYJGAAGKPP-JKSUJKDBSA-N	0	3	342.911	3.305	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)CCc2ccccn2)C1	ZINC001088359158	1359842020	/nfs/dbraw/zinc/84/20/20/1359842020.db2.gz	SMBYDNOHUDCNLA-QGZVFWFLSA-N	0	3	335.879	3.128	20	30		EGEDHN
C=C(Br)CN[C@H]1CCCCCN(C(=O)[C@@H](F)CC)C1	ZINC001088360604	1359844339	/nfs/dbraw/zinc/84/43/39/1359844339.db2.gz	CGORYIAMVITDKU-STQMWFEESA-N	0	3	335.261	3.004	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N1CCCCC[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001088363238	1359846194	/nfs/dbraw/zinc/84/61/94/1359846194.db2.gz	KVVFRKDFWMBEKW-WBAXXEDZSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C1CCC(C(=O)N2CCCCC[C@@H](NCc3ccnn3C)C2)CC1	ZINC001088374139	1359855633	/nfs/dbraw/zinc/85/56/33/1359855633.db2.gz	ZDFHNLPPFCZBEI-GOSISDBHSA-N	0	3	344.503	3.027	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCCCC[C@H](NCc2cnc(C)nc2)C1	ZINC001088374494	1359855969	/nfs/dbraw/zinc/85/59/69/1359855969.db2.gz	IRFDHDLTPSIFGE-ICSRJNTNSA-N	0	3	344.503	3.248	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)CCc2cc(C)on2)C1	ZINC001088381087	1359864019	/nfs/dbraw/zinc/86/40/19/1359864019.db2.gz	WRIBWLSNMRYWAJ-INIZCTEOSA-N	0	3	339.867	3.029	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](CNCc2nc(C)sc2C)[C@H](C)C1	ZINC001184311206	1387426862	/nfs/dbraw/zinc/42/68/62/1387426862.db2.gz	GMYPYKFMFWLPGB-PBHICJAKSA-N	0	3	347.528	3.138	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2oc3ccc(F)cc3c2C)[C@H]1C	ZINC001088622944	1359995279	/nfs/dbraw/zinc/99/52/79/1359995279.db2.gz	YKXWVJFEMSBORV-CJNGLKHVSA-N	0	3	328.387	3.096	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(C[C@@H](OC)c3ccccc3)[C@@H]2C)C1	ZINC001088844383	1360078377	/nfs/dbraw/zinc/07/83/77/1360078377.db2.gz	OPTHNBUPDMRSFR-NZSAHSFTSA-N	0	3	342.483	3.309	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3ccc(C)cc3C)[C@@H]2C)cn1	ZINC001088991080	1360126421	/nfs/dbraw/zinc/12/64/21/1360126421.db2.gz	GXWGYJNSWZHLIZ-UTKZUKDTSA-N	0	3	347.462	3.073	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cc(Cl)cc3c2OCC3)[C@H]1C	ZINC001089065436	1360154385	/nfs/dbraw/zinc/15/43/85/1360154385.db2.gz	IKFURLIBKMETRU-WBMJQRKESA-N	0	3	334.847	3.044	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)Cc2cccc(OC(C)C)c2)[C@H]1C	ZINC001089070804	1360159616	/nfs/dbraw/zinc/15/96/16/1360159616.db2.gz	YXPYNOYYACIVHE-APWZRJJASA-N	0	3	330.472	3.171	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCCN1C(=O)c1cccnc1	ZINC001089102579	1360168107	/nfs/dbraw/zinc/16/81/07/1360168107.db2.gz	CGTNPFAKNNSBER-FQEVSTJZSA-N	0	3	348.450	3.080	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCCC[C@H]1CN(C)Cc1ccc(Cl)cc1	ZINC001089139677	1360197155	/nfs/dbraw/zinc/19/71/55/1360197155.db2.gz	JGFIKEGPEGDWKW-YOEHRIQHSA-N	0	3	333.863	3.313	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCCC[C@H]1CN(C)Cc1ccc(CF)cc1	ZINC001089139871	1360197242	/nfs/dbraw/zinc/19/72/42/1360197242.db2.gz	QDLHYKHIRIUVPR-YJBOKZPZSA-N	0	3	331.435	3.129	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCCN1C(=O)[C@H]1CC1(C)C	ZINC001089160668	1360216499	/nfs/dbraw/zinc/21/64/99/1360216499.db2.gz	LIDQTTLTECYWAX-RBUKOAKNSA-N	0	3	339.483	3.417	20	30		EGEDHN
CN(Cc1ccccc1)C[C@@H]1CCCCN1C(=O)c1c[nH]c(C#N)c1	ZINC001089161336	1360217696	/nfs/dbraw/zinc/21/76/96/1360217696.db2.gz	BYZQJBAJMIQAED-IBGZPJMESA-N	0	3	336.439	3.013	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCCN1C(=O)[C@H]1CC1(F)F	ZINC001089173159	1360226830	/nfs/dbraw/zinc/22/68/30/1360226830.db2.gz	ADKBPNXPLPRPHC-DLBZAZTESA-N	0	3	347.409	3.026	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCCN1C(=O)CC(C)(F)F	ZINC001089222676	1360264861	/nfs/dbraw/zinc/26/48/61/1360264861.db2.gz	PICOKWOCQIVNNA-KRWDZBQOSA-N	0	3	349.425	3.416	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ncc(Cl)s2)CC(C)(C)C1	ZINC001089441991	1360432019	/nfs/dbraw/zinc/43/20/19/1360432019.db2.gz	MHKBTXQLVSMXDN-GFCCVEGCSA-N	0	3	339.892	3.040	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)N[C@@H]1CCN(CC#Cc2ccccc2)CC(C)(C)C1	ZINC001089462298	1360448114	/nfs/dbraw/zinc/44/81/14/1360448114.db2.gz	RKRGJYHBZPHPSC-MISYRCLQSA-N	0	3	338.495	3.301	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2c(F)ccc(C)c2F)CC(C)(C)C1	ZINC001089484488	1360465124	/nfs/dbraw/zinc/46/51/24/1360465124.db2.gz	XTGODBCRDORNGZ-CQSZACIVSA-N	0	3	334.410	3.127	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3cnoc3C)CC(C)(C)C2)C1	ZINC001089485120	1360465646	/nfs/dbraw/zinc/46/56/46/1360465646.db2.gz	HKOCIQBODUILNI-KRWDZBQOSA-N	0	3	345.487	3.446	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc([C@@H](C)CC)no2)CC(C)(C)C1	ZINC001089512055	1360483217	/nfs/dbraw/zinc/48/32/17/1360483217.db2.gz	YQWOLYBACSCGRL-LSDHHAIUSA-N	0	3	331.460	3.042	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cnn([C@H](C)CC)c2C)CC(C)(C)C1	ZINC001089536647	1360495273	/nfs/dbraw/zinc/49/52/73/1360495273.db2.gz	FBSDWDJYGNGWDL-NVXWUHKLSA-N	0	3	344.503	3.016	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc(CC(C)C)c[nH]2)CC(C)(C)C1	ZINC001089540726	1360498173	/nfs/dbraw/zinc/49/81/73/1360498173.db2.gz	WXKANFWJMFIOPI-QGZVFWFLSA-N	0	3	329.488	3.067	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)c(CC)o2)CC(C)(C)C1	ZINC001089542847	1360498521	/nfs/dbraw/zinc/49/85/21/1360498521.db2.gz	YOBXAAWNSUBBEW-INIZCTEOSA-N	0	3	330.472	3.394	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc3ccccc3n2)CC(C)(C)C1	ZINC001089545265	1360500646	/nfs/dbraw/zinc/50/06/46/1360500646.db2.gz	IXIUMWWEDMEGMX-KRWDZBQOSA-N	0	3	335.451	3.088	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc3c(c2)CCCC3)CC(C)(C)C1	ZINC001089551240	1360502608	/nfs/dbraw/zinc/50/26/08/1360502608.db2.gz	FBPJUZHUSXXNOS-FQEVSTJZSA-N	0	3	338.495	3.419	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(OC(C)C)cc2)CC(C)(C)C1	ZINC001089553106	1360504375	/nfs/dbraw/zinc/50/43/75/1360504375.db2.gz	SZCFXKWNBPBPQK-SFHVURJKSA-N	0	3	342.483	3.327	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@H]2Cc3ccc(Cl)cc32)CC(C)(C)C1	ZINC001089553583	1360505255	/nfs/dbraw/zinc/50/52/55/1360505255.db2.gz	WQBZRZJEPYKRRV-WMZOPIPTSA-N	0	3	344.886	3.220	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cnc2ccccn12	ZINC001089660006	1360571144	/nfs/dbraw/zinc/57/11/44/1360571144.db2.gz	CTRMOXNIZHSFIL-MRXNPFEDSA-N	0	3	340.471	3.131	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccoc1C1CC1	ZINC001089688175	1360594044	/nfs/dbraw/zinc/59/40/44/1360594044.db2.gz	RCJOAXQNTSCFOF-MRXNPFEDSA-N	0	3	328.456	3.401	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H]1CCOc2ccccc21	ZINC001089710129	1360614256	/nfs/dbraw/zinc/61/42/56/1360614256.db2.gz	BOTLREVSHVXKTF-SJLPKXTDSA-N	0	3	342.483	3.346	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cnn(C(F)F)c1	ZINC001089716411	1360617453	/nfs/dbraw/zinc/61/74/53/1360617453.db2.gz	IRGMFFLXYMYOKM-CQSZACIVSA-N	0	3	340.418	3.075	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc2c([nH]1)CCCC2	ZINC001089720482	1360622877	/nfs/dbraw/zinc/62/28/77/1360622877.db2.gz	YILQCLCTLJDFHC-INIZCTEOSA-N	0	3	329.488	3.300	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCC(C)(C)CN2CC=C(C)C)nc1	ZINC001089723396	1360626464	/nfs/dbraw/zinc/62/64/64/1360626464.db2.gz	JJKGHIVAIONUPC-GOSISDBHSA-N	0	3	339.483	3.250	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(OC)cc1	ZINC001089726309	1360628984	/nfs/dbraw/zinc/62/89/84/1360628984.db2.gz	KXMZWOXAFQUQPY-KRWDZBQOSA-N	0	3	330.472	3.492	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(OC)c(OC)c1	ZINC001089729375	1360632989	/nfs/dbraw/zinc/63/29/89/1360632989.db2.gz	MLGBAFPHBCREBB-INIZCTEOSA-N	0	3	346.471	3.110	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1c(C)nsc1C	ZINC001089734853	1360639482	/nfs/dbraw/zinc/63/94/82/1360639482.db2.gz	ZEUXTJMDEULRFV-HNNXBMFYSA-N	0	3	333.501	3.004	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1(C)CC(=C)C1	ZINC001089865591	1360708299	/nfs/dbraw/zinc/70/82/99/1360708299.db2.gz	QWURTJKHLVTWDP-YVSFHVDLSA-N	0	3	334.891	3.264	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CC2=CCCCC2)CC2(CCOCC2)C1	ZINC001089930803	1360749855	/nfs/dbraw/zinc/74/98/55/1360749855.db2.gz	MHQIYFFXVCHZNT-IBGZPJMESA-N	0	3	346.515	3.440	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)[C@@H]2CCCC3(CC3)C2)CC2(CCOCC2)C1	ZINC001089939490	1360755029	/nfs/dbraw/zinc/75/50/29/1360755029.db2.gz	SRNHDYADXVBIAM-MSOLQXFVSA-N	0	3	346.515	3.130	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C[C@@H]2C=CCCC2)CC2(CCOCC2)C1	ZINC001089944334	1360757615	/nfs/dbraw/zinc/75/76/15/1360757615.db2.gz	BRFKWRZCOIXZNR-MOPGFXCFSA-N	0	3	346.515	3.296	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)[C@@H]2C[C@H]2CC(C)C)CC2(CCOCC2)C1	ZINC001089957080	1360765507	/nfs/dbraw/zinc/76/55/07/1360765507.db2.gz	HLGGMWUCKXAQPR-CEXWTWQISA-N	0	3	348.531	3.232	20	30		EGEDHN
CC[C@H](C)CC(=O)N1CC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001323848545	1387474941	/nfs/dbraw/zinc/47/49/41/1387474941.db2.gz	SQCKMCRSQTYEEB-LAUBAEHRSA-N	0	3	339.483	3.419	20	30		EGEDHN
N#Cc1ccc(CNC2CC(CNC(=O)c3cccs3)C2)c(F)c1	ZINC001090909819	1360952076	/nfs/dbraw/zinc/95/20/76/1360952076.db2.gz	KINGSCNSVNONRN-UHFFFAOYSA-N	0	3	343.427	3.057	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ocnc2-c2ccccc2)C1	ZINC001091061494	1360988111	/nfs/dbraw/zinc/98/81/11/1360988111.db2.gz	AQUGVKHQZGJXIM-UHFFFAOYSA-N	0	3	345.830	3.192	20	30		EGEDHN
Cc1ccc(C(=O)N2C[C@H]3CN(Cc4cccc(C#N)c4)C[C@@]3(C)C2)o1	ZINC001091457989	1361105010	/nfs/dbraw/zinc/10/50/10/1361105010.db2.gz	FEQMSXBUDNPKIR-NQIIRXRSSA-N	0	3	349.434	3.054	20	30		EGEDHN
C[C@H](c1ccccc1F)N1C[C@@H]2CN(C(=O)C#CC3CC3)C[C@]2(C)C1	ZINC001091656094	1361170635	/nfs/dbraw/zinc/17/06/35/1361170635.db2.gz	TVARVQLNKYFDBR-CEQIKUNHSA-N	0	3	340.442	3.080	20	30		EGEDHN
CC1(CC(=O)N2C[C@H]3CN(Cc4ccc(C#N)cc4)C[C@@]3(C)C2)CC1	ZINC001091863873	1361237846	/nfs/dbraw/zinc/23/78/46/1361237846.db2.gz	QKMVTNQJLRTTBA-NQIIRXRSSA-N	0	3	337.467	3.029	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)CCc3ccc(C)cc3C)C[C@]2(C)C1	ZINC001091892814	1361241608	/nfs/dbraw/zinc/24/16/08/1361241608.db2.gz	FZIBCNLEMZDSDP-IRLDBZIGSA-N	0	3	338.495	3.040	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@@H](C)CC3CCCCC3)C[C@]2(C)C1	ZINC001092065730	1361286629	/nfs/dbraw/zinc/28/66/29/1361286629.db2.gz	SJPUFRAFXZZQPE-DSKINZAPSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)c2ccsc2)CC1	ZINC001093352374	1361565760	/nfs/dbraw/zinc/56/57/60/1361565760.db2.gz	YZGOOZHULOHCDD-KRWDZBQOSA-N	0	3	328.481	3.088	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC([C@H]2N(C/C=C\Cl)CC23CCC3)CC1	ZINC001093370237	1361579041	/nfs/dbraw/zinc/57/90/41/1361579041.db2.gz	QPUCMNASRNVXCS-UOTZSCPISA-N	0	3	346.902	3.245	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001094026059	1361726507	/nfs/dbraw/zinc/72/65/07/1361726507.db2.gz	QZJOQBLOHWUESP-XNFNUYLZSA-N	0	3	339.483	3.179	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3ccc(F)c(Cl)c3)CCC[C@@H]12	ZINC001094500143	1361831984	/nfs/dbraw/zinc/83/19/84/1361831984.db2.gz	COQXLVILYLKDKY-SJLPKXTDSA-N	0	3	334.822	3.087	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cc4occc4s3)CCC[C@@H]12	ZINC001094508567	1361836144	/nfs/dbraw/zinc/83/61/44/1361836144.db2.gz	BYUMGQXIEVUAJA-SJLPKXTDSA-N	0	3	328.437	3.102	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3ccc(Cl)c(F)c3)CCC[C@@H]12	ZINC001094522813	1361842563	/nfs/dbraw/zinc/84/25/63/1361842563.db2.gz	GTIBHXGHGVPSED-SJLPKXTDSA-N	0	3	334.822	3.087	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3ccc(C)c(OCC)c3)CCC[C@@H]12	ZINC001094529181	1361846278	/nfs/dbraw/zinc/84/62/78/1361846278.db2.gz	KKYBHYVYXCPEQY-TZIWHRDSSA-N	0	3	340.467	3.001	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cc(CC)c(C)s3)CCC[C@@H]12	ZINC001094573799	1361866469	/nfs/dbraw/zinc/86/64/69/1361866469.db2.gz	KXBDNBVCQDQHMJ-IEBWSBKVSA-N	0	3	330.497	3.227	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(-c3ccncc3)o1)C2	ZINC001095530322	1362162420	/nfs/dbraw/zinc/16/24/20/1362162420.db2.gz	GERYVDVZFQSQCN-IKGGRYGDSA-N	0	3	337.423	3.253	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1cncc3ccccc31)C2	ZINC001095561961	1362170402	/nfs/dbraw/zinc/17/04/02/1362170402.db2.gz	ITHHVZIATIHEQT-HOJAQTOUSA-N	0	3	335.451	3.075	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1coc3ccc(OC)cc13)C2	ZINC001095737842	1362217841	/nfs/dbraw/zinc/21/78/41/1362217841.db2.gz	JVVQHGKRRKXMCN-BVGQSLNGSA-N	0	3	340.423	3.353	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc3ccccc3cc1F)C2	ZINC001095744292	1362219156	/nfs/dbraw/zinc/21/91/56/1362219156.db2.gz	SUUICCIVKXYHBH-UXPWSPDFSA-N	0	3	336.410	3.337	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H]1CCc3c1cccc3Cl)C2	ZINC001095770414	1362224374	/nfs/dbraw/zinc/22/43/74/1362224374.db2.gz	OOQZGELZUAUBBQ-JXIYXGQPSA-N	0	3	342.870	3.115	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C1(c3ccccc3C)CCC1)C2	ZINC001096440431	1362512914	/nfs/dbraw/zinc/51/29/14/1362512914.db2.gz	IFSSYOCQUDNRPJ-HOJAQTOUSA-N	0	3	336.479	3.162	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H]1CCCCc3ccccc31)C2	ZINC001096621915	1362601306	/nfs/dbraw/zinc/60/13/06/1362601306.db2.gz	GXKLHOPTSGJPOF-HZEGPAAWSA-N	0	3	336.479	3.241	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(-c3ccccc3)[nH]1)C2	ZINC001096651342	1362616679	/nfs/dbraw/zinc/61/66/79/1362616679.db2.gz	KNEKLUVKDCQIGC-UXPWSPDFSA-N	0	3	333.435	3.040	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](NCc2ccccc2OC2CC2)C1	ZINC001185034877	1387593355	/nfs/dbraw/zinc/59/33/55/1387593355.db2.gz	FOGVXANEMYGQLQ-GOSISDBHSA-N	0	3	340.467	3.112	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CC1=CCCCC1	ZINC001097096142	1362841483	/nfs/dbraw/zinc/84/14/83/1362841483.db2.gz	KPHBMASGUKEBGC-UEDWAMCQSA-N	0	3	344.499	3.190	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1c(F)ccc3ccncc31)C2	ZINC001097110669	1362845699	/nfs/dbraw/zinc/84/56/99/1362845699.db2.gz	OAYKXCMVBRFPMO-OLMNPRSZSA-N	0	3	339.414	3.285	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@H](CNCc3ocnc3C)[C@H](C)C2)CC1	ZINC001185094490	1387617385	/nfs/dbraw/zinc/61/73/85/1387617385.db2.gz	JHLRCMXJOLVKBR-NVXWUHKLSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](CNCc3cc(C)no3)[C@H](C)C2)CCC1	ZINC001185095465	1387617519	/nfs/dbraw/zinc/61/75/19/1387617519.db2.gz	PVBLIIRQUQVJFS-NVXWUHKLSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](CNCc3nccs3)[C@H](C)C2)CCC1	ZINC001185095813	1387617677	/nfs/dbraw/zinc/61/76/77/1387617677.db2.gz	TXKOVORUJASVHA-CVEARBPZSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](CNCc3ocnc3C)[C@@H](C)C2)CCC1	ZINC001185095613	1387617739	/nfs/dbraw/zinc/61/77/39/1387617739.db2.gz	QZASOGZGSCRFES-DOTOQJQBSA-N	0	3	345.487	3.304	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)CC13CC4CC(CC(C4)C1)C3)C2	ZINC001098271331	1363281537	/nfs/dbraw/zinc/28/15/37/1363281537.db2.gz	YELJQQYFRVJHIS-SZLOWUCZSA-N	0	3	340.511	3.338	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(OC(C)C)cc1)C2	ZINC001098325614	1363299360	/nfs/dbraw/zinc/29/93/60/1363299360.db2.gz	YNJQKVVSJGOXME-QRQLOZEOSA-N	0	3	328.456	3.385	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3CC(=C)C)cc1	ZINC001098473715	1363336696	/nfs/dbraw/zinc/33/66/96/1363336696.db2.gz	UOTWOBLZVFJSMM-RLLQIKCJSA-N	0	3	340.467	3.092	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1cccc(Cl)c1)C[C@@H](C)O2	ZINC001098654689	1363419881	/nfs/dbraw/zinc/41/98/81/1363419881.db2.gz	FKXZCHYTPLDMJG-OAHLLOKOSA-N	0	3	348.874	3.222	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1c(C)cccc1F)C[C@H](C)O2	ZINC001098668074	1363427629	/nfs/dbraw/zinc/42/76/29/1363427629.db2.gz	FHTAVGMVWGPJOS-INIZCTEOSA-N	0	3	346.446	3.016	20	30		EGEDHN
C[C@H](C(=O)N[C@]12CCC[C@H]1CN(Cc1cccc(C#N)c1)C2)C1CC1	ZINC001098775912	1363464572	/nfs/dbraw/zinc/46/45/72/1363464572.db2.gz	GXCRDVHTYYXTGM-ZRCAFCQKSA-N	0	3	337.467	3.075	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccccc1	ZINC001098849284	1363491107	/nfs/dbraw/zinc/49/11/07/1363491107.db2.gz	KSVJMNRXVZHIIM-SFHVURJKSA-N	0	3	330.472	3.110	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cccc(C)c1	ZINC001098869513	1363499221	/nfs/dbraw/zinc/49/92/21/1363499221.db2.gz	XAGYQOLFNCFLAI-IBGZPJMESA-N	0	3	344.499	3.418	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccnn2C(CC)CC)C1	ZINC001098873625	1363500768	/nfs/dbraw/zinc/50/07/68/1363500768.db2.gz	SASJBNIWGBPFRN-KXBFYZLASA-N	0	3	330.476	3.015	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)CCC1CCC1	ZINC001099012669	1363573779	/nfs/dbraw/zinc/57/37/79/1363573779.db2.gz	MIUOZMSFGLDVKF-GOSISDBHSA-N	0	3	336.520	3.376	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3CCC[C@]3(NC(=O)C3CC4(CC4)C3)C2)cc1	ZINC001099022217	1363579505	/nfs/dbraw/zinc/57/95/05/1363579505.db2.gz	DICYOGKIZLZMPD-UGKGYDQZSA-N	0	3	349.478	3.219	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccnc(O[C@@H](C)CC)c2)C1	ZINC001099112327	1363629521	/nfs/dbraw/zinc/62/95/21/1363629521.db2.gz	KZZQQTIEPBOPTA-KNBMTAEXSA-N	0	3	343.471	3.029	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H](CC(C)C)n1ccnc1	ZINC001099117088	1363633164	/nfs/dbraw/zinc/63/31/64/1363633164.db2.gz	ZKNFVTPVZKUSBR-ZWKOTPCHSA-N	0	3	346.519	3.263	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc3c(c2)CCC=C3)C1	ZINC001099120685	1363634618	/nfs/dbraw/zinc/63/46/18/1363634618.db2.gz	GADBJVUQKMNZQQ-UNMCSNQZSA-N	0	3	334.463	3.254	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)C[C@H]1CCC(C)(C)CO1	ZINC001099144404	1363653216	/nfs/dbraw/zinc/65/32/16/1363653216.db2.gz	HCYOGHLGZGQKOX-DLBZAZTESA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(C)nc3ccccc32)C1	ZINC001099149138	1363656449	/nfs/dbraw/zinc/65/64/49/1363656449.db2.gz	STTMDIAKNGNOSX-KKSFZXQISA-N	0	3	335.451	3.314	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H](OCC)C1CCCC1	ZINC001099159351	1363662451	/nfs/dbraw/zinc/66/24/51/1363662451.db2.gz	QYMAEPDBBPUFQW-MOPGFXCFSA-N	0	3	348.531	3.212	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(F)c3occc32)C1	ZINC001099168921	1363667711	/nfs/dbraw/zinc/66/77/11/1363667711.db2.gz	NCGMUVFXPACTPY-DJJJIMSYSA-N	0	3	328.387	3.342	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@H]1CCC(C)(C)CN1CCOCC	ZINC001099171187	1363668955	/nfs/dbraw/zinc/66/89/55/1363668955.db2.gz	OHHKJVYZFQZYJM-GOSISDBHSA-N	0	3	336.520	3.213	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)C(C)(C)C1CC1	ZINC001099189012	1363681513	/nfs/dbraw/zinc/68/15/13/1363681513.db2.gz	NLZIPTIJKCLFNX-KRWDZBQOSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)C2C(C)(C)C2(C)C)C[C@H]1C(F)(F)F	ZINC001099232339	1363704654	/nfs/dbraw/zinc/70/46/54/1363704654.db2.gz	FUFQBSRNBVUYGT-VXGBXAGGSA-N	0	3	332.410	3.224	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2nccc3ccccc32)C[C@H]1C(F)(F)F	ZINC001099300285	1363738373	/nfs/dbraw/zinc/73/83/73/1363738373.db2.gz	XNGMJJGDEMBIAS-HUUCEWRRSA-N	0	3	349.356	3.013	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)Cc1cccc(COC)c1	ZINC001099305201	1363740363	/nfs/dbraw/zinc/74/03/63/1363740363.db2.gz	WFINGGILQLYFEG-LJQANCHMSA-N	0	3	344.499	3.168	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)CC[C@@H]1CC(C)(C)CO1	ZINC001099321057	1363748977	/nfs/dbraw/zinc/74/89/77/1363748977.db2.gz	PKRLVNBNYQRUDG-DLBZAZTESA-N	0	3	336.520	3.375	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H](C)Oc1ccccc1	ZINC001099324024	1363749972	/nfs/dbraw/zinc/74/99/72/1363749972.db2.gz	FFMGGKWPOIDGIU-ZWKOTPCHSA-N	0	3	342.483	3.084	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2ccccc2Cl)C[C@H]1C(F)(F)F	ZINC001099334787	1363757177	/nfs/dbraw/zinc/75/71/77/1363757177.db2.gz	CBNHGBNNZUWBBW-DGCLKSJQSA-N	0	3	332.753	3.119	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)Cc2ccccc2C)C[C@H]1C(F)(F)F	ZINC001099338633	1363758629	/nfs/dbraw/zinc/75/86/29/1363758629.db2.gz	IKZIZOUOWNIFLG-HZPDHXFCSA-N	0	3	340.389	3.093	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NC[C@@H]1CCC(C)(C)CN1Cc1ccccc1	ZINC001099365187	1363775106	/nfs/dbraw/zinc/77/51/06/1363775106.db2.gz	WYQYZXGTFRWXJJ-HKUYNNGSSA-N	0	3	344.499	3.385	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H]3CCC[C@]3(CNCc3cscn3)C2)C1	ZINC001099493987	1363819740	/nfs/dbraw/zinc/81/97/40/1363819740.db2.gz	RWMYTXALLXNNRD-KXBFYZLASA-N	0	3	345.512	3.218	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)CCCC#CC)C1	ZINC001099513497	1363828594	/nfs/dbraw/zinc/82/85/94/1363828594.db2.gz	PXRMZHVCWCHXLC-XSLAGTTESA-N	0	3	334.891	3.101	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C[C@@H](C)CCC)CC2(CCOCC2)C1	ZINC001099572309	1363856738	/nfs/dbraw/zinc/85/67/38/1363856738.db2.gz	VCRPIVNTNDKZDK-ROUUACIJSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C2(CCC)CC2)CC2(CCOCC2)C1	ZINC001099590493	1363872470	/nfs/dbraw/zinc/87/24/70/1363872470.db2.gz	CAEAZMKSKCVVNF-KRWDZBQOSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CC(CC)CC)CC2(CCOCC2)C1	ZINC001099595306	1363877938	/nfs/dbraw/zinc/87/79/38/1363877938.db2.gz	YFHVBLWMSYGNGB-SFHVURJKSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CC[C@@H](C)CC)CC2(CCOCC2)C1	ZINC001099595174	1363878576	/nfs/dbraw/zinc/87/85/76/1363878576.db2.gz	UXENTWFOAAMFHO-ZWKOTPCHSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CCN(Cc2ccc(C(C)C)cc2)C[C@H]1O	ZINC001099855155	1363965590	/nfs/dbraw/zinc/96/55/90/1363965590.db2.gz	CZAXKXUYJKXFAF-WOJBJXKFSA-N	0	3	344.499	3.218	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)CC(C)(C)C2CCCCC2)[C@H](O)C1	ZINC001100074806	1364009538	/nfs/dbraw/zinc/00/95/38/1364009538.db2.gz	SWDFTSZSJGVLSO-ZWKOTPCHSA-N	0	3	336.520	3.111	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2CCN(CC=C(C)C)C[C@@H]2O)CCCCC1	ZINC001100121518	1364021522	/nfs/dbraw/zinc/02/15/22/1364021522.db2.gz	BRYRPRTULGIADY-ROUUACIJSA-N	0	3	334.504	3.031	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2CCN(CC3=CCCCC3)C[C@@H]2O)CCCC1	ZINC001100145528	1364025661	/nfs/dbraw/zinc/02/56/61/1364025661.db2.gz	MGYKCDRYCVPJEL-OALUTQOASA-N	0	3	346.515	3.175	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H](C)CCCC)C[C@H]1c1ccc(OC)cc1	ZINC001100158855	1364031540	/nfs/dbraw/zinc/03/15/40/1364031540.db2.gz	NSZGGWMHRFKKOF-LSTHTHJFSA-N	0	3	342.483	3.039	20	30		EGEDHN
CCC[C@H](C)C(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100195038	1364041680	/nfs/dbraw/zinc/04/16/80/1364041680.db2.gz	ATBNBUQENBQADM-DMKPSLHHSA-N	0	3	330.447	3.098	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)C(C)=C2CCCC2)C1	ZINC001100229722	1364051230	/nfs/dbraw/zinc/05/12/30/1364051230.db2.gz	WKOHAUFDLQUMGG-UHFFFAOYSA-N	0	3	341.293	3.270	20	30		EGEDHN
C/C=C(/C)C(=O)NCC1CC(NCC#Cc2ccccc2Cl)C1	ZINC001100231102	1364051977	/nfs/dbraw/zinc/05/19/77/1364051977.db2.gz	MTDWJVZAYSKCNG-BNNQUZSASA-N	0	3	330.859	3.142	20	30		EGEDHN
O=C(NCC1CC(NCC#Cc2ccccc2)C1)c1ccoc1Cl	ZINC001100279208	1364066051	/nfs/dbraw/zinc/06/60/51/1364066051.db2.gz	IGJUPIWIRDYNIG-UHFFFAOYSA-N	0	3	342.826	3.083	20	30		EGEDHN
C#CCCCC(=O)NCC1CC(NCc2cccc(OC)c2Cl)C1	ZINC001100284670	1364067855	/nfs/dbraw/zinc/06/78/55/1364067855.db2.gz	ZUHHIRXKWROPJL-UHFFFAOYSA-N	0	3	348.874	3.137	20	30		EGEDHN
CC(C)C[C@H](C)OC(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC001185253180	1387660163	/nfs/dbraw/zinc/66/01/63/1387660163.db2.gz	XHIRPGHISZERFW-INIZCTEOSA-N	0	3	331.460	3.493	20	30		EGEDHN
C#Cc1ccc(C(=O)NCC2CC(NCC=C(Cl)Cl)C2)cc1	ZINC001100556927	1364160883	/nfs/dbraw/zinc/16/08/83/1364160883.db2.gz	PQBTXGSLAYTGLE-UHFFFAOYSA-N	0	3	337.250	3.085	20	30		EGEDHN
C=C/C(C)=C\CC(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1	ZINC001100583323	1364174138	/nfs/dbraw/zinc/17/41/38/1364174138.db2.gz	QKFXKWOFMVECHA-CPSFFCFKSA-N	0	3	341.430	3.204	20	30		EGEDHN
CCC1(C(=O)NCC2CC(NCC#Cc3ccc(F)cc3)C2)CCC1	ZINC001100591938	1364178397	/nfs/dbraw/zinc/17/83/97/1364178397.db2.gz	XITCCPOWTBLUTG-UHFFFAOYSA-N	0	3	342.458	3.242	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCC1CC(NCc2c(C)noc2CC)C1	ZINC001100596965	1364181581	/nfs/dbraw/zinc/18/15/81/1364181581.db2.gz	LCFYSTVFFVNQTP-FHERZECASA-N	0	3	333.476	3.132	20	30		EGEDHN
O=C(NCC1CC(NCC#Cc2ccccc2)C1)c1ccoc1C1CC1	ZINC001100612008	1364188319	/nfs/dbraw/zinc/18/83/19/1364188319.db2.gz	FHAGYKSMJKDIIB-UHFFFAOYSA-N	0	3	348.446	3.307	20	30		EGEDHN
C=CCCCC(=O)NCC1CC(NCc2oc(C(C)C)nc2C)C1	ZINC001100623342	1364194238	/nfs/dbraw/zinc/19/42/38/1364194238.db2.gz	JMXOELRNTHROPU-UHFFFAOYSA-N	0	3	333.476	3.447	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC2CC(NCc3c(C)nsc3C)C2)C1	ZINC001100661444	1364208207	/nfs/dbraw/zinc/20/82/07/1364208207.db2.gz	VBNVSSVZRIRXFB-UHFFFAOYSA-N	0	3	333.501	3.101	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)[C@H](CC)CCC)C1	ZINC001100798190	1364266479	/nfs/dbraw/zinc/26/64/79/1364266479.db2.gz	UMXAJZNLVQITCJ-ROKHWSDSSA-N	0	3	331.298	3.206	20	30		EGEDHN
C=C(C)CN1CC[C@H](Oc2ccnc(CNC(=O)/C=C(/C)CC)c2)C1	ZINC001101093658	1364410246	/nfs/dbraw/zinc/41/02/46/1364410246.db2.gz	GXPYWFKBEYJAIX-LZOLKVDOSA-N	0	3	343.471	3.083	20	30		EGEDHN
C=CCN1CC[C@H](Oc2ccnc(CNC(=O)C(C)(C)CCC)c2)C1	ZINC001101096956	1364412298	/nfs/dbraw/zinc/41/22/98/1364412298.db2.gz	GLZMMVPAOBITTR-SFHVURJKSA-N	0	3	345.487	3.163	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@H]2CN(C/C=C/c3ccccc3)C[C@@]2(C)C1	ZINC001101229249	1364475915	/nfs/dbraw/zinc/47/59/15/1364475915.db2.gz	QRVJKACZIDTHDJ-YKKVUUMLSA-N	0	3	336.479	3.140	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@H]2CN(CCC(F)(F)F)C[C@@]2(C)C1	ZINC001101336749	1364515491	/nfs/dbraw/zinc/51/54/91/1364515491.db2.gz	OMOXJPWXFKVFNU-FMKPAKJESA-N	0	3	332.410	3.321	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@H]2CN(Cc3cnc(C)s3)C[C@@]2(C)C1	ZINC001101337898	1364516207	/nfs/dbraw/zinc/51/62/07/1364516207.db2.gz	PMTPNBIDVHFKEQ-FCEWJHQRSA-N	0	3	347.528	3.334	20	30		EGEDHN
C=CCCCC(=O)N1C[C@H]2CN(Cc3ncccc3C)C[C@@]2(C)C1	ZINC001101347098	1364520662	/nfs/dbraw/zinc/52/06/62/1364520662.db2.gz	WIEWEZYWEQJQBE-XLIONFOSSA-N	0	3	327.472	3.027	20	30		EGEDHN
C=CCC[C@H](C)N1CC2(C1)C[C@@H](NC(=O)/C(C)=C/CC)c1nccn12	ZINC001101613836	1364655950	/nfs/dbraw/zinc/65/59/50/1364655950.db2.gz	JBBFDVSDCOIHDH-UFWNIKGBSA-N	0	3	342.487	3.166	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC2(CN(C[C@H](C)CC(C)C)C2)n2ccnc21	ZINC001101615202	1364656452	/nfs/dbraw/zinc/65/64/52/1364656452.db2.gz	CDHVEUIQNOHTBI-IAGOWNOFSA-N	0	3	344.503	3.103	20	30		EGEDHN
C=CCC[C@@H](C)N1CC2(C1)C[C@H](NC(=O)C(F)=C(C)C)c1nccn12	ZINC001101622859	1364660121	/nfs/dbraw/zinc/66/01/21/1364660121.db2.gz	RQOPBQOJOOUOPL-CABCVRRESA-N	0	3	346.450	3.073	20	30		EGEDHN
CC(C)C(=O)NC[C@@H]1CN(CC#Cc2cccc(Cl)c2)C[C@H]1C	ZINC001101732347	1364706684	/nfs/dbraw/zinc/70/66/84/1364706684.db2.gz	ZYKBNMGCXIREQP-NVXWUHKLSA-N	0	3	332.875	3.032	20	30		EGEDHN
CCC[C@H](C)C(=O)NC[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1C	ZINC001101829226	1364743051	/nfs/dbraw/zinc/74/30/51/1364743051.db2.gz	TWHOEMHAEQHOCO-HDMKZQKVSA-N	0	3	345.462	3.318	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@@H]1CN(Cc2conc2CC)C[C@H]1C	ZINC001102262947	1364975720	/nfs/dbraw/zinc/97/57/20/1364975720.db2.gz	QEQPVVMUADVGEN-BZUAXINKSA-N	0	3	333.476	3.023	20	30		EGEDHN
CCCCC1(C(=O)N2CC[C@@H](NCc3ccc(F)c(C#N)c3)C2)CC1	ZINC001185424735	1387712657	/nfs/dbraw/zinc/71/26/57/1387712657.db2.gz	YNOPJLAEHOOYEC-QGZVFWFLSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@@H]1CN(Cc2oc(C)nc2C)C[C@H]1C	ZINC001102326176	1365002502	/nfs/dbraw/zinc/00/25/02/1365002502.db2.gz	LHFJGYUXWLSHAO-VVFCZOMOSA-N	0	3	333.476	3.078	20	30		EGEDHN
C[C@H](CC(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C)C1CC1	ZINC001102604452	1365133845	/nfs/dbraw/zinc/13/38/45/1365133845.db2.gz	WLLKQMNHCPEBMT-IIAWOOMASA-N	0	3	345.512	3.240	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCC[C@@H]1CN(Cc2ccc(Cl)s2)C[C@H]1C	ZINC001102784181	1365216410	/nfs/dbraw/zinc/21/64/10/1365216410.db2.gz	NYMITHHSYUHXFW-YNEHKIRRSA-N	0	3	339.892	3.135	20	30		EGEDHN
C/C=C(/C)C(=O)NCC[C@@H]1CN(Cc2cc(C#N)ccc2F)C[C@H]1C	ZINC001102841590	1365246916	/nfs/dbraw/zinc/24/69/16/1365246916.db2.gz	KIXJZSKSXDIGQQ-TUCWUAQRSA-N	0	3	343.446	3.238	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)C2(CCOC)CCC2)C1	ZINC001103677284	1365723099	/nfs/dbraw/zinc/72/30/99/1365723099.db2.gz	UUQUKAHXTHCORB-GDBMZVCRSA-N	0	3	342.911	3.020	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@H](CCNCc2oc(CC)nc2C)C1	ZINC001103977779	1365857174	/nfs/dbraw/zinc/85/71/74/1365857174.db2.gz	FTEIQOVFRKGUEK-GDBMZVCRSA-N	0	3	333.476	3.086	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@H](CCNCc2ccc(C#N)cc2F)C1	ZINC001103978013	1365857192	/nfs/dbraw/zinc/85/71/92/1365857192.db2.gz	QFRXIIUYYYULLY-CRAIPNDOSA-N	0	3	343.446	3.238	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CN(C(=O)/C=C(/C)CC)C[C@H]1C	ZINC001104159871	1365930809	/nfs/dbraw/zinc/93/08/09/1365930809.db2.gz	DIPLGSIZKHOTEZ-MKGJVGOLSA-N	0	3	343.309	3.326	20	30		EGEDHN
Cc1cnc(CNCC[C@@H]2CN(C(=O)C#CC(C)(C)C)C[C@H]2C)s1	ZINC001104174917	1365937215	/nfs/dbraw/zinc/93/72/15/1365937215.db2.gz	JUTVIEAMALMKHA-GDBMZVCRSA-N	0	3	347.528	3.075	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)C(C)(C)C(F)(F)F)C[C@H]1C	ZINC001104932645	1366229513	/nfs/dbraw/zinc/22/95/13/1366229513.db2.gz	FMLFNVIOCCBQMG-ZYHUDNBSSA-N	0	3	340.817	3.402	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)C2(CCOC)CCC2)C[C@H]1C	ZINC001104952491	1366239613	/nfs/dbraw/zinc/23/96/13/1366239613.db2.gz	YZGOREYAYZGWIM-GDBMZVCRSA-N	0	3	342.911	3.020	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)Cc2ccc(C)s2)C[C@H]1C	ZINC001105060488	1366300298	/nfs/dbraw/zinc/30/02/98/1366300298.db2.gz	FPDDWAPVKBPEHO-IUODEOHRSA-N	0	3	340.920	3.426	20	30		EGEDHN
CCCCCCCNCc1cn(C2CN(C(=O)CC(C)(C)C)C2)nn1	ZINC001105159632	1366350046	/nfs/dbraw/zinc/35/00/46/1366350046.db2.gz	STZAFXTYQQAZIK-UHFFFAOYSA-N	0	3	349.523	3.158	20	30		EGEDHN
CCCCCCCNCc1cn(C2CN(C(=O)C[C@H](C)CC)C2)nn1	ZINC001105227546	1366378220	/nfs/dbraw/zinc/37/82/20/1366378220.db2.gz	OJBPRNOSLGEVML-MRXNPFEDSA-N	0	3	349.523	3.158	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C(CC=C)CC=C)CC1	ZINC001105392352	1366441485	/nfs/dbraw/zinc/44/14/85/1366441485.db2.gz	YNMOEVOEMPJWQM-HXUWFJFHSA-N	0	3	340.511	3.481	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)[C@@H](C)CC(=C)C)CC1	ZINC001105394040	1366442714	/nfs/dbraw/zinc/44/27/14/1366442714.db2.gz	NFUWPIINAIFISH-PKOBYXMFSA-N	0	3	328.500	3.315	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C2(CCC)CC2)CC1	ZINC001105396510	1366445482	/nfs/dbraw/zinc/44/54/82/1366445482.db2.gz	NTSKEPOCYKCTIX-GOSISDBHSA-N	0	3	328.500	3.293	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](CNCc2nc3ccccc3o2)[C@H](C)C1	ZINC001106189992	1366619572	/nfs/dbraw/zinc/61/95/72/1366619572.db2.gz	NOYDGAHBPOVCKO-HZPDHXFCSA-N	0	3	341.455	3.368	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](N(C)CCOc2c(C)cccc2C)C1	ZINC001189317719	1366987812	/nfs/dbraw/zinc/98/78/12/1366987812.db2.gz	BYZLUDOGSYQKHK-GOSISDBHSA-N	0	3	330.472	3.181	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@]12CCC[C@H]1N(Cc1conc1C)CC2	ZINC001107515595	1367013659	/nfs/dbraw/zinc/01/36/59/1367013659.db2.gz	ZFDKLVKOXGLNAK-ILZDJORESA-N	0	3	345.487	3.446	20	30		EGEDHN
C=CCCCC(=O)NC[C@]12CCC[C@H]1N(Cc1cc(C)ncn1)CC2	ZINC001107524177	1367017681	/nfs/dbraw/zinc/01/76/81/1367017681.db2.gz	LNKYQQHIJXIFOK-UYAOXDASSA-N	0	3	342.487	3.002	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCOCc1ccccc1	ZINC001109353079	1367083877	/nfs/dbraw/zinc/08/38/77/1367083877.db2.gz	IDDGSTFFAHTMEL-AABGKKOBSA-N	0	3	342.483	3.281	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)[C@H](C)CCC(C)(C)C)[C@@H]2C1	ZINC001189810829	1367112722	/nfs/dbraw/zinc/11/27/22/1367112722.db2.gz	JDUNLPKWBJYFNZ-FGTMMUONSA-N	0	3	336.520	3.184	20	30		EGEDHN
Cc1ccc(F)cc1CN(C)[C@@H]1CCN(C(=O)C#CC(C)(C)C)C1	ZINC001190075727	1367166210	/nfs/dbraw/zinc/16/62/10/1367166210.db2.gz	DGGISOXEHSMVAG-GOSISDBHSA-N	0	3	330.447	3.216	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2C[C@H]1CC(C)(C)CO1	ZINC001109604271	1367227568	/nfs/dbraw/zinc/22/75/68/1367227568.db2.gz	AZZGSJVSSSKPNG-YRXWBPOGSA-N	0	3	346.515	3.107	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccc(CO)cc1	ZINC001109635757	1367255111	/nfs/dbraw/zinc/25/51/11/1367255111.db2.gz	PYMWFUKYAPKSJQ-XCLNPWKQSA-N	0	3	342.483	3.003	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](N(C)Cc2ccc(C)c(OC)c2)C1	ZINC001190428306	1367262838	/nfs/dbraw/zinc/26/28/38/1367262838.db2.gz	GJWRISLZKFRAAP-SFHVURJKSA-N	0	3	330.472	3.393	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](N(C)CCOc2ccccc2C)C1	ZINC001190434823	1367263805	/nfs/dbraw/zinc/26/38/05/1367263805.db2.gz	BBYPLQGHWNFIPK-SFHVURJKSA-N	0	3	330.472	3.263	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@H](N(C)C/C=C\c3ccccc3)C2)CCC1	ZINC001190595738	1367303067	/nfs/dbraw/zinc/30/30/67/1367303067.db2.gz	RYNCIDLTMRSJMT-QRGKHIHXSA-N	0	3	336.479	3.426	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@H](N(C)Cc3csc(C)c3)C2)CCC1	ZINC001190603210	1367304808	/nfs/dbraw/zinc/30/48/08/1367304808.db2.gz	ABIRJFRYPMYFTK-KRWDZBQOSA-N	0	3	330.497	3.283	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2ccc(F)c(C)c2)C1	ZINC001108172532	1367322478	/nfs/dbraw/zinc/32/24/78/1367322478.db2.gz	FAFYAOZBTIINBT-OXJNMPFZSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@@]1(C)CN(CC2CCCCC2)CCO1	ZINC001108189838	1367332852	/nfs/dbraw/zinc/33/28/52/1367332852.db2.gz	MINHACLBYCYWPC-UXHICEINSA-N	0	3	336.520	3.376	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCN(C(=O)CCC(C)(F)F)C1	ZINC001190980121	1367393638	/nfs/dbraw/zinc/39/36/38/1367393638.db2.gz	AEXAOLXBFGQLSM-MRXNPFEDSA-N	0	3	335.398	3.026	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)CCc2ccccc2)C1	ZINC001108363110	1367412853	/nfs/dbraw/zinc/41/28/53/1367412853.db2.gz	WHNVNGDJTKCWBH-NQIIRXRSSA-N	0	3	344.499	3.181	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2ccc(C)c(C)c2)C1	ZINC001108378164	1367424774	/nfs/dbraw/zinc/42/47/74/1367424774.db2.gz	CCQIIFSFCYFRGM-WIYYLYMNSA-N	0	3	344.499	3.479	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CC[C@@H]1CCc3ccccc31)C2	ZINC001110139313	1367521418	/nfs/dbraw/zinc/52/14/18/1367521418.db2.gz	NQGIONSSEOAVFG-YHELAOLJSA-N	0	3	336.479	3.241	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N1CC[C@@H](N(C)Cc2ccc(F)cc2)C1	ZINC001191577859	1367533442	/nfs/dbraw/zinc/53/34/42/1367533442.db2.gz	XFLKKSPBPVMFPA-UYAOXDASSA-N	0	3	348.462	3.087	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](CCC)CC(C)C)C2	ZINC001110176147	1367547411	/nfs/dbraw/zinc/54/74/11/1367547411.db2.gz	LELYTOOZSJZGOI-RDGPPVDQSA-N	0	3	336.520	3.373	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1cc(C)ccc1C	ZINC001110183134	1367552165	/nfs/dbraw/zinc/55/21/65/1367552165.db2.gz	KYXZBBUPPIORQM-LMCOJAPRSA-N	0	3	342.483	3.116	20	30		EGEDHN
CC(C)=C(C)CC(=O)N1CC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001191764807	1367581422	/nfs/dbraw/zinc/58/14/22/1367581422.db2.gz	XABIXMKLABZHPC-IBGZPJMESA-N	0	3	325.456	3.337	20	30		EGEDHN
CC#CCN1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)C=C(C)C)C1	ZINC001186166387	1387887595	/nfs/dbraw/zinc/88/75/95/1387887595.db2.gz	SPBQSEPKJODLAJ-UYAOXDASSA-N	0	3	342.458	3.337	20	30		EGEDHN
Cc1cccc([C@@H](C)N2[C@@H]3CC[C@H]2[C@H](NC(=O)CSCC#N)C3)c1	ZINC001110302339	1367623897	/nfs/dbraw/zinc/62/38/97/1367623897.db2.gz	YPUYZJUXGDVGDL-DDBAPUKQSA-N	0	3	343.496	3.034	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@H](N(C)Cc2cccc(COC)c2)C1	ZINC001191911804	1367634747	/nfs/dbraw/zinc/63/47/47/1367634747.db2.gz	JTOGZWOKBNXCOO-PXNSSMCTSA-N	0	3	344.499	3.468	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@@H](N(C)Cc2ccc(COC)cc2)C1	ZINC001191913011	1367637573	/nfs/dbraw/zinc/63/75/73/1367637573.db2.gz	VFPNGKTYSXVXJA-FXAWDEMLSA-N	0	3	344.499	3.468	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H](N(C)CCOc2ccccc2F)C1	ZINC001192160233	1367704495	/nfs/dbraw/zinc/70/44/95/1367704495.db2.gz	CBPHTVPMNVNSIL-OXJNMPFZSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@H](N(C)Cc3ccc(C#N)cc3)C2)CC1	ZINC001192179892	1367708685	/nfs/dbraw/zinc/70/86/85/1367708685.db2.gz	BPMPXLFWDWTNPD-IBGZPJMESA-N	0	3	337.467	3.337	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](N(C)CCc3scnc3C)C2)CCC1	ZINC001192225677	1367723645	/nfs/dbraw/zinc/72/36/45/1367723645.db2.gz	AJCBBPIBGAIOKX-INIZCTEOSA-N	0	3	347.528	3.273	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](N(C)CCOCC3CCC3)C2)CCC1	ZINC001192227843	1367725089	/nfs/dbraw/zinc/72/50/89/1367725089.db2.gz	VMKZNOAGUCNYFW-GOSISDBHSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](N(C)CCOc3ccc(F)cc3)C2)C1	ZINC001192257391	1367732201	/nfs/dbraw/zinc/73/22/01/1367732201.db2.gz	NSQOHZKBXKJENS-KRWDZBQOSA-N	0	3	346.446	3.094	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](N(C)CCOc2cccc(F)c2)C1	ZINC001192579353	1367824484	/nfs/dbraw/zinc/82/44/84/1367824484.db2.gz	ZLBAAOCCEJCJEB-QGZVFWFLSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](N(C)CCc2csc(C)n2)C1	ZINC001192586350	1367826879	/nfs/dbraw/zinc/82/68/79/1367826879.db2.gz	MXFFJBUQWSRFBR-INIZCTEOSA-N	0	3	335.517	3.129	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@H]2CCCC3(CC3)C2)C1	ZINC001192952959	1367911157	/nfs/dbraw/zinc/91/11/57/1367911157.db2.gz	CNSWUGOLXAIXNP-RCCFBDPRSA-N	0	3	336.520	3.089	20	30		EGEDHN
CCCCCCCCOCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCCF	ZINC001110672285	1367911840	/nfs/dbraw/zinc/91/18/40/1367911840.db2.gz	NVKALHJGTXTQLK-KURKYZTESA-N	0	3	342.499	3.445	20	30		EGEDHN
CC[C@@H](C)CCC(=O)N1CC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001193018123	1367924678	/nfs/dbraw/zinc/92/46/78/1367924678.db2.gz	RFWGZRPDIAJLHK-VQIMIIECSA-N	0	3	327.472	3.417	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)[C@H]2CC[C@H](C(C)C)CC2)C1	ZINC001193037592	1367928637	/nfs/dbraw/zinc/92/86/37/1367928637.db2.gz	FRHDNXWZUPIYDC-GUDVDZBRSA-N	0	3	336.520	3.184	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H]1CCC=CCCC1)C2	ZINC001110705744	1367939693	/nfs/dbraw/zinc/93/96/93/1367939693.db2.gz	GNQZFJRCWICBIO-MKXGPGLRSA-N	0	3	332.488	3.047	20	30		EGEDHN
CCC[C@@H](CC)C(=O)N1CC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001193109438	1367946898	/nfs/dbraw/zinc/94/68/98/1367946898.db2.gz	IFRQHQMXQAVUHJ-MOPGFXCFSA-N	0	3	327.472	3.417	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)CC1(C)CCCCC1)C2	ZINC001110796538	1367995454	/nfs/dbraw/zinc/99/54/54/1367995454.db2.gz	QYIGAXNHZVYDKW-KURKYZTESA-N	0	3	334.504	3.271	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCc1scnc1C	ZINC001110933809	1368104224	/nfs/dbraw/zinc/10/42/24/1368104224.db2.gz	RMGPXFVEDFHJJC-VQHPVUNQSA-N	0	3	347.528	3.318	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)CC1CCCCCC1)C2	ZINC001111067300	1368151779	/nfs/dbraw/zinc/15/17/79/1368151779.db2.gz	GOSOUUJZKAEGAM-QRVBRYPASA-N	0	3	334.504	3.271	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCCc1cc(C)sc1C)C2	ZINC001111476061	1368316450	/nfs/dbraw/zinc/31/64/50/1368316450.db2.gz	QDPNPXZRVIIAEO-QRVBRYPASA-N	0	3	344.524	3.432	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@](C)(CC)CCC)C[C@H](C)O2	ZINC001111551201	1368342911	/nfs/dbraw/zinc/34/29/11/1368342911.db2.gz	UGVVNRIGMYXUPX-HKUYNNGSSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H](CCC)C(C)C)C[C@@H](C)O2	ZINC001111551170	1368343030	/nfs/dbraw/zinc/34/30/30/1368343030.db2.gz	SSCGNIYLSDFZJQ-QZTJIDSGSA-N	0	3	336.520	3.327	20	30		EGEDHN
C=CCOCC(=O)N[C@]12CCC[C@H]1CN([C@@H](C)c1ccccc1F)C2	ZINC001111662141	1368414828	/nfs/dbraw/zinc/41/48/28/1368414828.db2.gz	IRFMAAVYXQQLAL-FTRWYGJKSA-N	0	3	346.446	3.060	20	30		EGEDHN
C#CCCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1cncc(C)c1)C2	ZINC001111711186	1368427187	/nfs/dbraw/zinc/42/71/87/1368427187.db2.gz	GKQMRTIEKNSQRA-FPOVZHCZSA-N	0	3	339.483	3.054	20	30		EGEDHN
Cc1cc(C#N)cc(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)c1	ZINC001195428860	1368435494	/nfs/dbraw/zinc/43/54/94/1368435494.db2.gz	DAECIUWVJDYYJW-FQEVSTJZSA-N	0	3	333.435	3.434	20	30		EGEDHN
C=CCOCCCC(=O)N1CCCN(Cc2cc(C)ccc2C)CC1	ZINC001195435295	1368435968	/nfs/dbraw/zinc/43/59/68/1368435968.db2.gz	WXXSLXQVJJFPFA-UHFFFAOYSA-N	0	3	344.499	3.321	20	30		EGEDHN
C=C(C)CCC(=O)N[C@]12CCC[C@H]1CN(Cc1cccc(C#N)c1)C2	ZINC001111762677	1368450276	/nfs/dbraw/zinc/45/02/76/1368450276.db2.gz	ITVNZZYQFIDLPD-FPOVZHCZSA-N	0	3	337.467	3.385	20	30		EGEDHN
C#CCCCCC(=O)N1CCCN(CCCc2ccsc2)CC1	ZINC001195555331	1368453629	/nfs/dbraw/zinc/45/36/29/1368453629.db2.gz	AFANUJBOCIPPHX-UHFFFAOYSA-N	0	3	332.513	3.409	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@]12CCC[C@H]1CN(Cc1cccnc1C)C2	ZINC001111851964	1368506078	/nfs/dbraw/zinc/50/60/78/1368506078.db2.gz	WQVRYBQXDJVBLJ-CUWPLCDZSA-N	0	3	341.499	3.463	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCCN(C[C@H]2CC(C)(C)CO2)CC1	ZINC001195966643	1368524438	/nfs/dbraw/zinc/52/44/38/1368524438.db2.gz	PJBWVBIRAMTAAF-GOSISDBHSA-N	0	3	334.504	3.104	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CCCN(Cc2cccc(C)c2)CC1)OCC	ZINC001196018053	1368537259	/nfs/dbraw/zinc/53/72/59/1368537259.db2.gz	IAYIXBWUNLYVHI-HXUWFJFHSA-N	0	3	344.499	3.401	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)c2cc[nH]c2C2CCC2)C1	ZINC001196162367	1368559665	/nfs/dbraw/zinc/55/96/65/1368559665.db2.gz	WVXNVGYESUNYKO-QZTJIDSGSA-N	0	3	347.503	3.028	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2ccc(-c3cc[nH]n3)s2)CC1	ZINC001196222983	1368571126	/nfs/dbraw/zinc/57/11/26/1368571126.db2.gz	HVRCUIRVEGKQPW-UHFFFAOYSA-N	0	3	344.484	3.252	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CN([C@@H](C)c2cc(C)ccc2C)C[C@H]1O	ZINC001196481600	1368625417	/nfs/dbraw/zinc/62/54/17/1368625417.db2.gz	DALMWNJPCLYKCO-QXAKKESOSA-N	0	3	344.499	3.128	20	30		EGEDHN
CC#CCCCC(=O)N1CCCN(CCCOc2ccccc2)CC1	ZINC001196838161	1368695317	/nfs/dbraw/zinc/69/53/17/1368695317.db2.gz	BQOCAZQAJSNZRR-UHFFFAOYSA-N	0	3	342.483	3.183	20	30		EGEDHN
CC#CCCCC(=O)N1CCCN(CCCc2cccc(F)c2)CC1	ZINC001196846690	1368697571	/nfs/dbraw/zinc/69/75/71/1368697571.db2.gz	INXXKWRLDRFNPI-UHFFFAOYSA-N	0	3	344.474	3.486	20	30		EGEDHN
C=CCCCC(=O)N1CCCN(CCCOc2ccccc2)CC1	ZINC001197000612	1368728435	/nfs/dbraw/zinc/72/84/35/1368728435.db2.gz	VYXMWBKKFPYUMU-UHFFFAOYSA-N	0	3	330.472	3.346	20	30		EGEDHN
C=CCC1(C(=O)N2CCCN(CCC[C@@H]3CCOC3)CC2)CCC1	ZINC001197077609	1368742259	/nfs/dbraw/zinc/74/22/59/1368742259.db2.gz	VWZZVTTZERWYSP-GOSISDBHSA-N	0	3	334.504	3.084	20	30		EGEDHN
C=CCC[C@@H](C)N1CCCN(C(=O)c2ocnc2C(F)F)CC1	ZINC001197165174	1368757837	/nfs/dbraw/zinc/75/78/37/1368757837.db2.gz	AKUYMUFZGXCGTR-GFCCVEGCSA-N	0	3	327.375	3.115	20	30		EGEDHN
N#Cc1cccc(NC(=S)N2CCN(CC3CCCC3)CC2)c1	ZINC001197696233	1368875715	/nfs/dbraw/zinc/87/57/15/1368875715.db2.gz	SJMDAPLKWTWYIL-UHFFFAOYSA-N	0	3	328.485	3.063	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cc(Cl)no2)CC1	ZINC001197898440	1368922064	/nfs/dbraw/zinc/92/20/64/1368922064.db2.gz	BNXBIQHTHACJOY-UHFFFAOYSA-N	0	3	327.856	3.446	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2c(C)onc2CC)CC1	ZINC001198085391	1368956447	/nfs/dbraw/zinc/95/64/47/1368956447.db2.gz	BTGMXZNZDGDUSH-UHFFFAOYSA-N	0	3	333.476	3.440	20	30		EGEDHN
CCCCCCCCC(=O)N[C@@H]1CN(CCCC2CCC2)C[C@H]1O	ZINC001198087617	1368957240	/nfs/dbraw/zinc/95/72/40/1368957240.db2.gz	GSPOKTKYIZEACW-RTBURBONSA-N	0	3	338.536	3.479	20	30		EGEDHN
C=CCCOCC(=O)N1CCCN([C@H](C)c2ccccc2C)CC1	ZINC001198324061	1369009467	/nfs/dbraw/zinc/00/94/67/1369009467.db2.gz	KSNWPUATIPJBRZ-GOSISDBHSA-N	0	3	330.472	3.183	20	30		EGEDHN
C=CCCOCC(=O)N1CCCN(Cc2ccccc2C2CC2)CC1	ZINC001198331340	1369010408	/nfs/dbraw/zinc/01/04/08/1369010408.db2.gz	WCZAFMKDDQJXDI-UHFFFAOYSA-N	0	3	342.483	3.191	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N1CCCN([C@H]2CCCc3ccccc32)CC1	ZINC001198345066	1369013287	/nfs/dbraw/zinc/01/32/87/1369013287.db2.gz	ZOFASQJWOYXYIK-PXNSSMCTSA-N	0	3	342.483	3.189	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)C(C)(F)F)c1ccccc1OC	ZINC001198483405	1369042161	/nfs/dbraw/zinc/04/21/61/1369042161.db2.gz	WKSFIKGUNCWUIR-CQSZACIVSA-N	0	3	326.387	3.064	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)c1ccc(F)cc1)c1ccccc1OC	ZINC001198492819	1369045035	/nfs/dbraw/zinc/04/50/35/1369045035.db2.gz	WMWDCXMTHRBYAG-GOSISDBHSA-N	0	3	342.414	3.471	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)[C@H](CC)OCC)c1ccccc1OC	ZINC001198585006	1369067458	/nfs/dbraw/zinc/06/74/58/1369067458.db2.gz	PEGPJRFTOKKJMR-MSOLQXFVSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)c1cnccc1C)c1ccccc1OC	ZINC001198638002	1369078857	/nfs/dbraw/zinc/07/88/57/1369078857.db2.gz	UBEMNUKSDSWLSQ-GOSISDBHSA-N	0	3	339.439	3.035	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)CO[C@H](C)CC)c1ccccc1OC	ZINC001198669046	1369087249	/nfs/dbraw/zinc/08/72/49/1369087249.db2.gz	XAHARBWLQHNKAK-SJLPKXTDSA-N	0	3	348.487	3.223	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H](NCC1CCC1)c1ccccc1OC	ZINC001198677678	1369089115	/nfs/dbraw/zinc/08/91/15/1369089115.db2.gz	QMJFKZCLUSUVRG-LJQANCHMSA-N	0	3	342.483	3.436	20	30		EGEDHN
CC/C=C/CCN[C@H](CNC(=O)C#CC(C)C)c1ccccc1OC	ZINC001198713072	1369097270	/nfs/dbraw/zinc/09/72/70/1369097270.db2.gz	LNZNOVNEHFNJOI-OVKVCFKUSA-N	0	3	342.483	3.458	20	30		EGEDHN
C=CCCOCCCCC(=O)NC[C@@H](NCC)c1ccccc1OC	ZINC001198723829	1369100008	/nfs/dbraw/zinc/10/00/08/1369100008.db2.gz	LCNARWNTNBAMCO-GOSISDBHSA-N	0	3	348.487	3.225	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)[C@H](CCC)OC)c1ccccc1OC	ZINC001198827020	1369122976	/nfs/dbraw/zinc/12/29/76/1369122976.db2.gz	PBLGAGXHBJIKPW-MJGOQNOKSA-N	0	3	348.487	3.223	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H](NCCC)c2ccccc2OC)cc1	ZINC001198825240	1369123046	/nfs/dbraw/zinc/12/30/46/1369123046.db2.gz	AHCCTVTWJFTUEV-LJQANCHMSA-N	0	3	336.435	3.147	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)C1CC2(CC2)C1)c1ccccc1OC	ZINC001198902882	1369144982	/nfs/dbraw/zinc/14/49/82/1369144982.db2.gz	QZZYIACWLDQXDX-QGZVFWFLSA-N	0	3	328.456	3.208	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)Cc1ccco1)c1ccccc1OC	ZINC001198941688	1369153732	/nfs/dbraw/zinc/15/37/32/1369153732.db2.gz	ZBAVSOOSCZDFLW-GOSISDBHSA-N	0	3	342.439	3.244	20	30		EGEDHN
CCC[C@H](CC)C(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001186630446	1387990050	/nfs/dbraw/zinc/99/00/50/1387990050.db2.gz	JJYUJRPMAQIFFZ-DOTOQJQBSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=C(Br)CNC1CCN(C(=O)C[C@@H](C)C(C)C)CC1	ZINC001199733372	1369263738	/nfs/dbraw/zinc/26/37/38/1369263738.db2.gz	KURDYBKOQBORME-GFCCVEGCSA-N	0	3	331.298	3.158	20	30		EGEDHN
C=CCCC(=O)N1CCC(NCc2nc(-c3ccco3)oc2C)CC1	ZINC001199733121	1369263881	/nfs/dbraw/zinc/26/38/81/1369263881.db2.gz	FVLJBEKZSZCFNF-UHFFFAOYSA-N	0	3	343.427	3.290	20	30		EGEDHN
CC(C)(C)/C=C\C(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001199848448	1369280628	/nfs/dbraw/zinc/28/06/28/1369280628.db2.gz	ZEXIGIMZGHLEAG-FLIBITNWSA-N	0	3	325.456	3.241	20	30		EGEDHN
CCCC[C@@H](C)C(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001200382112	1369358031	/nfs/dbraw/zinc/35/80/31/1369358031.db2.gz	UZCFVIGLNYKRTB-MRXNPFEDSA-N	0	3	327.472	3.465	20	30		EGEDHN
CCCCCCCN1CCN(C(=O)c2cccc(CN(C)C)c2)CC1	ZINC001113674807	1369559716	/nfs/dbraw/zinc/55/97/16/1369559716.db2.gz	MIXZBHNYCFDONH-UHFFFAOYSA-N	0	3	345.531	3.476	20	30		EGEDHN
C=C[C@@H](COC)NCc1ccc(-n2ccc(C(F)(F)F)n2)cc1	ZINC001325620305	1388013964	/nfs/dbraw/zinc/01/39/64/1388013964.db2.gz	VBWXBSYZYHZXRH-ZDUSSCGKSA-N	0	3	325.334	3.182	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)N1CCC(NCc2nc3ccccc3o2)CC1	ZINC001202092065	1369685894	/nfs/dbraw/zinc/68/58/94/1369685894.db2.gz	GZXCVHKZIOGKNT-LSDHHAIUSA-N	0	3	341.455	3.367	20	30		EGEDHN
C=CCOCC(=O)N[C@@H]1[C@H]2CN([C@H](CC)c3ccc(Cl)cc3)C[C@H]21	ZINC001114047672	1369701503	/nfs/dbraw/zinc/70/15/03/1369701503.db2.gz	KWTIPIBEZVUFSW-NTDBWNAOSA-N	0	3	348.874	3.040	20	30		EGEDHN
CC(C)CCC(=O)N[C@@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202448535	1369775517	/nfs/dbraw/zinc/77/55/17/1369775517.db2.gz	RICCTUCDSMQMEF-VQTJNVASSA-N	0	3	338.495	3.491	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)C(CC)CC)C12CCC2	ZINC001202520713	1369798044	/nfs/dbraw/zinc/79/80/44/1369798044.db2.gz	KLDOSEOENJSWSZ-UONOGXRCSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@H](NCc2ccc(F)cc2F)C12CCC2	ZINC001202591141	1369815667	/nfs/dbraw/zinc/81/56/67/1369815667.db2.gz	NRDAUMUYVDLBAI-IRXDYDNUSA-N	0	3	334.410	3.448	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@H](NCC#Cc2ccc(F)cc2)C12CCC2	ZINC001202591598	1369815920	/nfs/dbraw/zinc/81/59/20/1369815920.db2.gz	PFZZFNYKPFCQOK-RBUKOAKNSA-N	0	3	340.442	3.160	20	30		EGEDHN
C=C(Br)CNC1CCN(C(=O)CCCC(C)C)CC1	ZINC001202604939	1369819777	/nfs/dbraw/zinc/81/97/77/1369819777.db2.gz	NESWURDHSMAAIY-UHFFFAOYSA-N	0	3	331.298	3.302	20	30		EGEDHN
CC(C)=C(F)C(=O)N[C@@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202736463	1369873464	/nfs/dbraw/zinc/87/34/64/1369873464.db2.gz	QGUAOFMGZWCZSR-QZTJIDSGSA-N	0	3	340.442	3.319	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H]2C[C@@H](NCC#Cc3ccccc3)C23CCC3)co1	ZINC001202785869	1369891547	/nfs/dbraw/zinc/89/15/47/1369891547.db2.gz	RNIUCVYVHNQPHT-WOJBJXKFSA-N	0	3	348.446	3.270	20	30		EGEDHN
C[C@H](c1ccccc1)N(Cc1cccc(C#N)c1)C[C@H]1CCC(=O)N1	ZINC001202897979	1369921458	/nfs/dbraw/zinc/92/14/58/1369921458.db2.gz	FXDLUURHSBYQPZ-OXQOHEQNSA-N	0	3	333.435	3.400	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1C[C@@H](NCc2conc2CC)C12CCC2	ZINC001202959351	1369936686	/nfs/dbraw/zinc/93/66/86/1369936686.db2.gz	CLLANLUNPWUMKT-IAGOWNOFSA-N	0	3	345.487	3.356	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1C[C@@H](NCc2ccns2)C12CCC2	ZINC001202959449	1369936733	/nfs/dbraw/zinc/93/67/33/1369936733.db2.gz	DZAHDVSOUFKNKF-SJORKVTESA-N	0	3	345.512	3.429	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCCN(Cc3cccc4nonc43)C2)cc1	ZINC001203143124	1369998433	/nfs/dbraw/zinc/99/84/33/1369998433.db2.gz	QUEZSHORMMOCKO-QGZVFWFLSA-N	0	3	334.379	3.138	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1[C@H]2CN([C@H](C)c3cccc(OC)c3)C[C@H]21	ZINC001114672762	1370018910	/nfs/dbraw/zinc/01/89/10/1370018910.db2.gz	UTPJVFIQWYPHLI-OAOYMFHYSA-N	0	3	342.483	3.405	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1C[C@@H](NCc2cnoc2C)C12CCC2	ZINC001203259540	1370045713	/nfs/dbraw/zinc/04/57/13/1370045713.db2.gz	XJCOWOUQEFEYGY-CVEARBPZSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1[C@H]2CN(CCCCC(F)(F)F)C[C@H]21	ZINC001114722407	1370045993	/nfs/dbraw/zinc/04/59/93/1370045993.db2.gz	HEHXIWOZYSSVGO-BYNSBNAKSA-N	0	3	332.410	3.368	20	30		EGEDHN
CCCC(CCC)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001114747783	1370059549	/nfs/dbraw/zinc/05/95/49/1370059549.db2.gz	HBGWZURHEKQYFS-PMOLBWCYSA-N	0	3	339.483	3.321	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@@H](NCc3conc3C)C23CCC3)CCC1	ZINC001203366948	1370100361	/nfs/dbraw/zinc/10/03/61/1370100361.db2.gz	PYYRHAYCYZFPNT-SJORKVTESA-N	0	3	343.471	3.246	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1C[C@@H](NCc2conc2CC)C12CCC2	ZINC001203450856	1370130721	/nfs/dbraw/zinc/13/07/21/1370130721.db2.gz	FPXGLWIMAHPYAC-SJORKVTESA-N	0	3	345.487	3.356	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)CCCn2cccc2)C12CCC2	ZINC001203770213	1370258222	/nfs/dbraw/zinc/25/82/22/1370258222.db2.gz	FGBJBOSOABMRRT-HZPDHXFCSA-N	0	3	335.879	3.038	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)CCc2ccc(C)o2)C12CCC2	ZINC001203779887	1370260903	/nfs/dbraw/zinc/26/09/03/1370260903.db2.gz	CGZFUDZFVDQFJR-HZPDHXFCSA-N	0	3	336.863	3.290	20	30		EGEDHN
Cc1ccc2nc(C3CCN(Cc4ccc(C#N)cc4)CC3)nn2c1	ZINC001203901703	1370306539	/nfs/dbraw/zinc/30/65/39/1370306539.db2.gz	QRBBYGKJTRJRCX-UHFFFAOYSA-N	0	3	331.423	3.289	20	30		EGEDHN
CCCCCCCCC(=O)N[C@@H]1[C@H]2CN(CCOCC(C)C)C[C@H]21	ZINC001115163596	1370322411	/nfs/dbraw/zinc/32/24/11/1370322411.db2.gz	ISISZPROOSOZPX-RUYXUALKSA-N	0	3	338.536	3.456	20	30		EGEDHN
C=CCOc1ccc(CN2CC[C@@H](Oc3cc(OC)ccn3)C2)cc1	ZINC001204302599	1370437670	/nfs/dbraw/zinc/43/76/70/1370437670.db2.gz	OKNXKEVNCSAJBK-LJQANCHMSA-N	0	3	340.423	3.308	20	30		EGEDHN
C=CCCC(=O)NCC1(NCc2cccc(OCC)n2)CCCCC1	ZINC001115442812	1370454891	/nfs/dbraw/zinc/45/48/91/1370454891.db2.gz	SCQKWPKZXOPIEV-UHFFFAOYSA-N	0	3	345.487	3.355	20	30		EGEDHN
CC(C)C1CCC(N2CCN(Cc3cccc(C#N)n3)CC2)CC1	ZINC001204591936	1370525105	/nfs/dbraw/zinc/52/51/05/1370525105.db2.gz	KFSXULIMCTVWOH-UHFFFAOYSA-N	0	3	326.488	3.286	20	30		EGEDHN
COc1cc(C#N)cc(Nc2ccc(CN3CCN(C)CC3)cc2)c1	ZINC001204758675	1370569182	/nfs/dbraw/zinc/56/91/82/1370569182.db2.gz	IRKDTQCXWXPASN-UHFFFAOYSA-N	0	3	336.439	3.058	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC1(NCc2cc(C)ncn2)CCCCC1	ZINC001115661561	1370645573	/nfs/dbraw/zinc/64/55/73/1370645573.db2.gz	FHDWOXCBDDTRBF-UHFFFAOYSA-N	0	3	344.503	3.296	20	30		EGEDHN
C=CC(C)(C)C(=O)N(Cc1ccccc1)[C@@H]1CN(CCCC)C[C@H]1O	ZINC001205164342	1370666917	/nfs/dbraw/zinc/66/69/17/1370666917.db2.gz	XCIXTPAHYBQVHX-RTBURBONSA-N	0	3	344.499	3.073	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N(Cc1ccccc1)[C@@H]1CN(C(C)C)C[C@H]1O	ZINC001205175004	1370670179	/nfs/dbraw/zinc/67/01/79/1370670179.db2.gz	GMJBYAZENPPMBP-MISYRCLQSA-N	0	3	344.499	3.071	20	30		EGEDHN
C=CCCCC(=O)NCC1(NCc2cccnc2OC)CCCCC1	ZINC001115701374	1370682213	/nfs/dbraw/zinc/68/22/13/1370682213.db2.gz	KNHCVNLJFBJQCS-UHFFFAOYSA-N	0	3	345.487	3.355	20	30		EGEDHN
CC(C)(C)c1ccc(-c2noc([C@@H]3CCNC[C@H]3F)n2)c(C#N)c1	ZINC001205218770	1370685134	/nfs/dbraw/zinc/68/51/34/1370685134.db2.gz	ITQHNVAPJGLXPW-HUUCEWRRSA-N	0	3	328.391	3.321	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC2(NCc3ccc(F)cn3)CCCCC2)C1	ZINC001115723364	1370702913	/nfs/dbraw/zinc/70/29/13/1370702913.db2.gz	MXZPWGUHFSGVCK-UHFFFAOYSA-N	0	3	345.462	3.486	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CC(F)(F)C(F)F)CCCCC1	ZINC001115730960	1370713701	/nfs/dbraw/zinc/71/37/01/1370713701.db2.gz	WATVSTARTMDUNL-UHFFFAOYSA-N	0	3	344.780	3.438	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)CCC2(C)CC2)CC[C@H]1c1ccc(F)cc1	ZINC001205318691	1370720216	/nfs/dbraw/zinc/72/02/16/1370720216.db2.gz	NOLMJDAXVLBIPA-RBUKOAKNSA-N	0	3	342.458	3.313	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC(CNCc2cc(F)ccc2C#N)CC1	ZINC001205404765	1370745719	/nfs/dbraw/zinc/74/57/19/1370745719.db2.gz	MQOSWMBFEQUFAW-UHFFFAOYSA-N	0	3	343.446	3.382	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@H](C)C(C)(C)C)C[C@H]1c1cccc(F)c1	ZINC001205417230	1370748386	/nfs/dbraw/zinc/74/83/86/1370748386.db2.gz	VTCIWJPOBBIEHO-ZYSHUDEJSA-N	0	3	344.474	3.415	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@H](CC)CCCC)[C@@H]3COC[C@@H]32)CC1	ZINC001205474271	1370765658	/nfs/dbraw/zinc/76/56/58/1370765658.db2.gz	QTPCXZPEDLEESV-CEXWTWQISA-N	0	3	348.531	3.328	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cnn(C(F)F)c2)CCCCC1	ZINC001115791800	1370773790	/nfs/dbraw/zinc/77/37/90/1370773790.db2.gz	CUMRKUYSHJQMAJ-UHFFFAOYSA-N	0	3	346.809	3.053	20	30		EGEDHN
CCCCCCCCCC(=O)N1CC[C@@H](NCc2ccnn2C)C1	ZINC001187367680	1388099829	/nfs/dbraw/zinc/09/98/29/1388099829.db2.gz	SJGDNGDQKYGLBO-QGZVFWFLSA-N	0	3	334.508	3.251	20	30		EGEDHN
C=CCCCC(=O)N1CCC(CNCc2nc(C)c(C)s2)CC1	ZINC001206105835	1370960994	/nfs/dbraw/zinc/96/09/94/1370960994.db2.gz	RVAWFVHLWIRUSS-UHFFFAOYSA-N	0	3	335.517	3.444	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCN(Cc3ccc(N4CCCC4)cc3)C2)nc1	ZINC001117723124	1371069564	/nfs/dbraw/zinc/06/95/64/1371069564.db2.gz	RIJPBRUPXLWVBX-FQEVSTJZSA-N	0	3	348.450	3.207	20	30		EGEDHN
CN1CCN(CCCO[C@@H](C#C[Si](C)(C)C)c2ccccc2)CC1	ZINC001206589447	1371102230	/nfs/dbraw/zinc/10/22/30/1371102230.db2.gz	FMENHBIDTSGVOT-FQEVSTJZSA-N	0	3	344.575	3.263	20	30		EGEDHN
C[C@@H](C#N)C(=O)N[C@@H]1CN(Cc2ccc(C(C)(C)C)cc2)C[C@H]1C	ZINC001206641320	1371115934	/nfs/dbraw/zinc/11/59/34/1371115934.db2.gz	RBWDYMXBYJMXIV-HDMKZQKVSA-N	0	3	327.472	3.080	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CCN(Cc3cc(C)ccn3)C2)C1	ZINC001206846776	1371188302	/nfs/dbraw/zinc/18/83/02/1371188302.db2.gz	BKUGHLWEUXYHGB-IBGZPJMESA-N	0	3	329.444	3.001	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C(C)(C)C)cc2)C[C@H]1NC(=O)C#CC1CC1	ZINC001206948604	1371241133	/nfs/dbraw/zinc/24/11/33/1371241133.db2.gz	SSQBLBICVAXXNT-OXQOHEQNSA-N	0	3	338.495	3.334	20	30		EGEDHN
COc1cc(CN(C)C)ccc1NC(=O)C1(c2cccc(C#N)c2)CC1	ZINC001118973857	1371257430	/nfs/dbraw/zinc/25/74/30/1371257430.db2.gz	RZBRQMDWEQLCAB-UHFFFAOYSA-N	0	3	349.434	3.299	20	30		EGEDHN
O=C(CC1CC1)N1CCC[C@@H](NCC#Cc2ccccc2Cl)C1	ZINC001207041949	1371275579	/nfs/dbraw/zinc/27/55/79/1371275579.db2.gz	QLDSQLWLLCQJGZ-QGZVFWFLSA-N	0	3	330.859	3.072	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CN(Cc2ccc(OC)cc2)C[C@H]1C	ZINC001207158724	1371315130	/nfs/dbraw/zinc/31/51/30/1371315130.db2.gz	ZOOWVNSXFQFCHP-CRAIPNDOSA-N	0	3	330.472	3.234	20	30		EGEDHN
N#Cc1ccc(N2CCN(C[C@H]3CCOc4ccccc43)CC2)cc1	ZINC001207175287	1371321955	/nfs/dbraw/zinc/32/19/55/1371321955.db2.gz	SQJUVCODAKUQSM-GOSISDBHSA-N	0	3	333.435	3.247	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN(CCOc2ccc(C)cc2)C[C@H]1C	ZINC001207189956	1371324032	/nfs/dbraw/zinc/32/40/32/1371324032.db2.gz	AEFQUAMKOFDZEG-IEBWSBKVSA-N	0	3	330.472	3.167	20	30		EGEDHN
O=C(c1ccoc1)N1CCC[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001207276858	1371347151	/nfs/dbraw/zinc/34/71/51/1371347151.db2.gz	MEWGVZVTKCMFFI-KRWDZBQOSA-N	0	3	342.826	3.179	20	30		EGEDHN
O=C(c1ccoc1)N1CCC[C@@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207277600	1371347673	/nfs/dbraw/zinc/34/76/73/1371347673.db2.gz	UINSANXFBPHQGD-GOSISDBHSA-N	0	3	342.826	3.179	20	30		EGEDHN
CC/C=C(/C)C(=O)N1CCC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001207565111	1371436742	/nfs/dbraw/zinc/43/67/42/1371436742.db2.gz	GIDYCUPUGYZWDL-UOJXKXAVSA-N	0	3	329.419	3.134	20	30		EGEDHN
CC(C)[C@H](C)CC(=O)N1CCC[C@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001207646364	1371462798	/nfs/dbraw/zinc/46/27/98/1371462798.db2.gz	SPCUWORJOITGTL-QAPCUYQASA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)C[C@@H](C)[C@@H]2CCCO2)CCCCC1	ZINC001120062465	1371474756	/nfs/dbraw/zinc/47/47/56/1371474756.db2.gz	NWKCEVFUEOCSCG-ZBFHGGJFSA-N	0	3	342.911	3.353	20	30		EGEDHN
CC(C)(C)/C=C/C(=O)N1CCC[C@H](NCc2ccc(C#N)s2)C1	ZINC001207710957	1371482455	/nfs/dbraw/zinc/48/24/55/1371482455.db2.gz	VELVERJPVFTAQK-VFNNOXKTSA-N	0	3	331.485	3.303	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207718467	1371485502	/nfs/dbraw/zinc/48/55/02/1371485502.db2.gz	QMBHKCZTZVTNMM-VQIMIIECSA-N	0	3	330.447	3.194	20	30		EGEDHN
CCCCCCCN1C[C@@H](C)[C@H](NC(=O)c2snnc2CC)C1	ZINC001207888181	1371530240	/nfs/dbraw/zinc/53/02/40/1371530240.db2.gz	JNYJJWXNCUZUAN-UKRRQHHQSA-N	0	3	338.521	3.121	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC[C@@H]([C@@H]2CCCN2Cc2cncs2)C1	ZINC001120382550	1371555178	/nfs/dbraw/zinc/55/51/78/1371555178.db2.gz	PTCHSDUFWGXROG-AEFFLSMTSA-N	0	3	345.512	3.006	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC[C@@H](N[C@@H](C)c2ccc(F)cc2F)C1	ZINC001207991973	1371561764	/nfs/dbraw/zinc/56/17/64/1371561764.db2.gz	CCWCYBJGEBIFLB-GOEBONIOSA-N	0	3	334.410	3.266	20	30		EGEDHN
CC1(C(=O)N2CCC[C@H](NCC#Cc3cccc(Cl)c3)C2)CC1	ZINC001208101839	1371595797	/nfs/dbraw/zinc/59/57/97/1371595797.db2.gz	XPAURCRJAPNGPQ-KRWDZBQOSA-N	0	3	330.859	3.072	20	30		EGEDHN
C=CCC[C@@H](C)[NH2+]C1CC2(CC(NC(=O)c3ccccc3[O-])C2)C1	ZINC001120644797	1371680832	/nfs/dbraw/zinc/68/08/32/1371680832.db2.gz	CEQLJGMFWPKTBI-NUVKBMONSA-N	0	3	328.456	3.378	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(F)c3cccnc23)CC1	ZINC001120689968	1371712587	/nfs/dbraw/zinc/71/25/87/1371712587.db2.gz	CLYPSXVPYLLXIG-UHFFFAOYSA-N	0	3	327.403	3.144	20	30		EGEDHN
CC(C)CC1(C(=O)N2CCC[C@H](NCC#Cc3ccccc3)C2)CC1	ZINC001208316082	1371714300	/nfs/dbraw/zinc/71/43/00/1371714300.db2.gz	NPQYNWZDUYQWBW-FQEVSTJZSA-N	0	3	338.495	3.445	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CN(CCOC2CCCCCC2)C[C@H]1C	ZINC001208374624	1371741508	/nfs/dbraw/zinc/74/15/08/1371741508.db2.gz	PYTYAYCTYTVGGM-UYAOXDASSA-N	0	3	348.531	3.356	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1CN(Cc2cccc(COC)c2)C[C@H]1C	ZINC001208393014	1371750240	/nfs/dbraw/zinc/75/02/40/1371750240.db2.gz	ILSUFCLCMRKCBY-MBOZVWFJSA-N	0	3	344.499	3.372	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1CN(CCOc2ccc(F)cc2)C[C@H]1C	ZINC001208395984	1371752712	/nfs/dbraw/zinc/75/27/12/1371752712.db2.gz	LZYDVBHYWWQCAH-JTDSTZFVSA-N	0	3	348.462	3.243	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1CN(CCc2ccccc2F)C[C@H]1C	ZINC001208512099	1371794767	/nfs/dbraw/zinc/79/47/67/1371794767.db2.gz	WHWMETRIMPITIC-ZTNFWEORSA-N	0	3	332.463	3.407	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)C[C@H](OCC)C(=C)C)C2	ZINC001121189375	1371884100	/nfs/dbraw/zinc/88/41/00/1371884100.db2.gz	MXNCHNTWAJXWJG-HVEGKCCWSA-N	0	3	340.895	3.127	20	30		EGEDHN
N#Cc1cccc(CCCN2CCN(c3cccc(C#N)c3)CC2)c1	ZINC001208850595	1371917075	/nfs/dbraw/zinc/91/70/75/1371917075.db2.gz	FJKILRUKXWIDMH-UHFFFAOYSA-N	0	3	330.435	3.185	20	30		EGEDHN
CC(C)CC(=O)N1CCCN(CCCc2cccc(C#N)c2)CC1	ZINC001208850828	1371918280	/nfs/dbraw/zinc/91/82/80/1371918280.db2.gz	KJOXLAXUVSTHEJ-UHFFFAOYSA-N	0	3	327.472	3.071	20	30		EGEDHN
N#Cc1ccc(CCCN2CCN(c3nc4ccccc4o3)CC2)cc1	ZINC001208858866	1371920762	/nfs/dbraw/zinc/92/07/62/1371920762.db2.gz	PYDPTMCUMFQVOT-UHFFFAOYSA-N	0	3	346.434	3.454	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@]12C[C@H]1CN(CCCc1ccc(C#N)cc1)C2	ZINC001208856981	1371921370	/nfs/dbraw/zinc/92/13/70/1371921370.db2.gz	VUFXIBOFVJYKKE-PXNSSMCTSA-N	0	3	341.455	3.090	20	30		EGEDHN
N#Cc1ccc(CCCN2CCN3CCc4ccccc4[C@H]3C2)cc1	ZINC001208863692	1371923621	/nfs/dbraw/zinc/92/36/21/1371923621.db2.gz	BQQRHIZOPOOBKB-JOCHJYFZSA-N	0	3	331.463	3.406	20	30		EGEDHN
N#Cc1ccc(CCCN2CCCN(C(=O)c3ccccc3)CC2)cc1	ZINC001208864932	1371924350	/nfs/dbraw/zinc/92/43/50/1371924350.db2.gz	ZRTKELTZWLIERF-UHFFFAOYSA-N	0	3	347.462	3.339	20	30		EGEDHN
O=C(CCCF)N1CCC[C@@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001209085396	1371992745	/nfs/dbraw/zinc/99/27/45/1371992745.db2.gz	CCOXNZRHWPIKNN-QGZVFWFLSA-N	0	3	336.838	3.022	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@H](NCc2ccnc(Cl)c2)C1	ZINC001209110883	1372000482	/nfs/dbraw/zinc/00/04/82/1372000482.db2.gz	HRBYSBARKJUDBZ-INIZCTEOSA-N	0	3	333.863	3.009	20	30		EGEDHN
C#CCCCCCC(=O)NC1CC2(CC(NCc3cnoc3C)C2)C1	ZINC001121534581	1372002682	/nfs/dbraw/zinc/00/26/82/1372002682.db2.gz	NOMDGFYHVQKRKM-UHFFFAOYSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC1CC2(CC(NCc3cnc(C)o3)C2)C1	ZINC001121616344	1372026391	/nfs/dbraw/zinc/02/63/91/1372026391.db2.gz	IBCAZZXKGORZPH-DKWICNMVSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001209192542	1372032958	/nfs/dbraw/zinc/03/29/58/1372032958.db2.gz	ARUSNSGYHVFEGP-CRAIPNDOSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=CCCCCN1CCOCC12CCN(C(=O)OC(C)(C)C)CC2	ZINC001209200477	1372034933	/nfs/dbraw/zinc/03/49/33/1372034933.db2.gz	INMHAVUJAFFYJA-UHFFFAOYSA-N	0	3	338.492	3.445	20	30		EGEDHN
N#Cc1ccnc(N2CCN(CCCCCc3ccccc3)CC2)c1	ZINC001209230455	1372043963	/nfs/dbraw/zinc/04/39/63/1372043963.db2.gz	XWTBJDISADPBCM-UHFFFAOYSA-N	0	3	334.467	3.488	20	30		EGEDHN
C#CCN(C)CCCNC(=O)C1(c2ccc(C(C)(C)C)cc2)CC1	ZINC001326385732	1388174406	/nfs/dbraw/zinc/17/44/06/1388174406.db2.gz	YSUWQDFBRQGUOX-UHFFFAOYSA-N	0	3	326.484	3.087	20	30		EGEDHN
C=CCO[C@@H]1CO[C@@]2(C1)CCCN(CCc1ccc(F)c(F)c1)C2	ZINC001209243499	1372048331	/nfs/dbraw/zinc/04/83/31/1372048331.db2.gz	HRZBKTWGXWWFIL-QFBILLFUSA-N	0	3	337.410	3.333	20	30		EGEDHN
C=CCC1(C(=O)NC2CC3(CC(NCc4cnoc4C)C3)C2)CCC1	ZINC001121713033	1372055399	/nfs/dbraw/zinc/05/53/99/1372055399.db2.gz	AMVPLSOHLRYBQI-UHFFFAOYSA-N	0	3	343.471	3.246	20	30		EGEDHN
C=CCC1(C(=O)NC2CC3(CC(NCc4cc(C)no4)C3)C2)CCC1	ZINC001121714084	1372057095	/nfs/dbraw/zinc/05/70/95/1372057095.db2.gz	UYYQTGHZLPJITK-UHFFFAOYSA-N	0	3	343.471	3.246	20	30		EGEDHN
C=CC1(CC(=O)N[C@@H]2CN(CCOC(C)C)C[C@H]2C)CCCCC1	ZINC001209405931	1372095512	/nfs/dbraw/zinc/09/55/12/1372095512.db2.gz	GNDLKHDIDRLIGH-QZTJIDSGSA-N	0	3	336.520	3.375	20	30		EGEDHN
CC1(C(=O)N2CCC[C@@H](NCC#Cc3ccc(F)cc3)C2)CC=CC1	ZINC001209432613	1372104536	/nfs/dbraw/zinc/10/45/36/1372104536.db2.gz	LWGWBBUJQDBQPN-LJQANCHMSA-N	0	3	340.442	3.114	20	30		EGEDHN
C=C(Br)CNC1CC2(C1)CC(NC(=O)[C@@H](C)C(C)C)C2	ZINC001121860193	1372105901	/nfs/dbraw/zinc/10/59/01/1372105901.db2.gz	KUFAGDSNGFRHLY-BAYAOMGESA-N	0	3	343.309	3.204	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@@H](NCC#Cc3ccc(Cl)cc3)C2)CC1	ZINC001209473587	1372116079	/nfs/dbraw/zinc/11/60/79/1372116079.db2.gz	AEEDIIKKSGCLEZ-GOSISDBHSA-N	0	3	344.886	3.462	20	30		EGEDHN
C=CCC1(C(=O)N2CCC[C@@H](NCc3ncccc3C)C2)CCC1	ZINC001209503331	1372122574	/nfs/dbraw/zinc/12/25/74/1372122574.db2.gz	IYQMYGMAJDOWNA-QGZVFWFLSA-N	0	3	327.472	3.217	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)N1CCC[C@H]1c1cn(C)nc1C	ZINC001121925546	1372124521	/nfs/dbraw/zinc/12/45/21/1372124521.db2.gz	AKWJSENCMLJSNG-MSOLQXFVSA-N	0	3	334.508	3.470	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N1CCc2c(Br)cccc2C1	ZINC001121944441	1372129829	/nfs/dbraw/zinc/12/98/29/1372129829.db2.gz	PCDAIXLOSAXDHO-OAHLLOKOSA-N	0	3	337.261	3.017	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CC[C@H]2CN(CCCCC(F)(F)F)C[C@H]21	ZINC001187848626	1388176820	/nfs/dbraw/zinc/17/68/20/1388176820.db2.gz	CHKGGVQTYPZWAB-LSDHHAIUSA-N	0	3	344.421	3.301	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N1CCC(N2c3ccccc3C[C@H]2C)CC1	ZINC001122127821	1372181612	/nfs/dbraw/zinc/18/16/12/1372181612.db2.gz	FOTXUTOEKVSDNE-VQIMIIECSA-N	0	3	341.499	3.112	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@@H](NCc2ccnc(Cl)c2)C1	ZINC001209866316	1372217785	/nfs/dbraw/zinc/21/77/85/1372217785.db2.gz	RIBPIQJZQBVXHE-OAHLLOKOSA-N	0	3	335.879	3.418	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1)c1ccccc1	ZINC001210698695	1372409288	/nfs/dbraw/zinc/40/92/88/1372409288.db2.gz	QZAYVUVBBBPNNS-SIKLNZKXSA-N	0	3	346.474	3.422	20	30		EGEDHN
C=CCCCN1C[C@@H](C)[C@H](NC(=O)c2cnc(C(C)(C)C)s2)C1	ZINC001211374865	1372544081	/nfs/dbraw/zinc/54/40/81/1372544081.db2.gz	QUUHMHURAQXONK-ZIAGYGMSSA-N	0	3	335.517	3.457	20	30		EGEDHN
CCCC(=O)N1C[C@@H](c2ccccc2)[C@H](NCC#Cc2ccccc2)C1	ZINC001211515624	1372571366	/nfs/dbraw/zinc/57/13/66/1372571366.db2.gz	YZTJRFUTZSQLGN-FCHUYYIVSA-N	0	3	346.474	3.422	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2cccc(C)c2)C[C@H]1c1ccccc1	ZINC001211524412	1372572880	/nfs/dbraw/zinc/57/28/80/1372572880.db2.gz	JLHARLZZMGTQFY-LEWJYISDSA-N	0	3	332.447	3.216	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C(C)(C)CC(F)F)C[C@H]1c1ccccc1	ZINC001211615966	1372590943	/nfs/dbraw/zinc/59/09/43/1372590943.db2.gz	OWLMZBGPMJIPJS-DLBZAZTESA-N	0	3	348.437	3.275	20	30		EGEDHN
CCCCCCCC[C@@H](C)C(=O)N1CC[C@@H](NCc2n[nH]c(C)n2)C1	ZINC001188016286	1388215110	/nfs/dbraw/zinc/21/51/10/1388215110.db2.gz	XBXCJAUTIDBXHT-NVXWUHKLSA-N	0	3	349.523	3.190	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)C(CC=C)CC=C)[C@H](OC)C1	ZINC001212321276	1372685801	/nfs/dbraw/zinc/68/58/01/1372685801.db2.gz	ZRSOPSCMVUHOAR-RTBURBONSA-N	0	3	334.504	3.317	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CN(Cc2c(C)cccc2C)C[C@H]1OC	ZINC001212325528	1372686986	/nfs/dbraw/zinc/68/69/86/1372686986.db2.gz	ZTEPATPYRJHGOT-RTBURBONSA-N	0	3	344.499	3.221	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2cc(C)nc(C)c2)[C@H](OC)C1	ZINC001212329886	1372688863	/nfs/dbraw/zinc/68/88/63/1372688863.db2.gz	HJWXKXXZXVEPHW-RTBURBONSA-N	0	3	347.503	3.098	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@H](CC)CC(F)F)[C@H](OC)C1	ZINC001212401499	1372700426	/nfs/dbraw/zinc/70/04/26/1372700426.db2.gz	SNGAPHJQNYTHGT-BZUAXINKSA-N	0	3	346.462	3.230	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NCCN[C@H](C)c1ccc(F)c(Cl)c1	ZINC001124496160	1372706986	/nfs/dbraw/zinc/70/69/86/1372706986.db2.gz	XCCUCZOSPNPYSY-CHWSQXEVSA-N	0	3	342.842	3.227	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)C2CC3(CCC3)C2)[C@H](OC)C1	ZINC001213294613	1372878002	/nfs/dbraw/zinc/87/80/02/1372878002.db2.gz	AFGVVOSJZHQABS-QZTJIDSGSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1CN(Cc2cc(C)ccc2C)C[C@H]1OC	ZINC001213320572	1372883348	/nfs/dbraw/zinc/88/33/48/1372883348.db2.gz	ZYBGHCHMROBNDB-MISYRCLQSA-N	0	3	344.499	3.221	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@@H]2CCC(C)(C)C2)[C@H](OC)C1	ZINC001213404084	1372902177	/nfs/dbraw/zinc/90/21/77/1372902177.db2.gz	YNDUNALQKBYQIM-KZNAEPCWSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2ccc(CC)c(CC)c2)[C@H](OC)C1	ZINC001214004966	1372993010	/nfs/dbraw/zinc/99/30/10/1372993010.db2.gz	BJHRZNIZABSMJR-WOJBJXKFSA-N	0	3	344.499	3.207	20	30		EGEDHN
C[C@@H]1CN(C(=O)C=C2CCCCC2)C[C@H]1NCC#Cc1ccccc1	ZINC001214241540	1373028703	/nfs/dbraw/zinc/02/87/03/1373028703.db2.gz	QIGUVLPFNRUQJW-WIYYLYMNSA-N	0	3	336.479	3.365	20	30		EGEDHN
C=CCOCCCC(=O)N1C[C@@H](C)[C@H](NCc2cc(C)ccc2F)C1	ZINC001214402961	1373055413	/nfs/dbraw/zinc/05/54/13/1373055413.db2.gz	JKQWHLPNSUXUNO-VQIMIIECSA-N	0	3	348.462	3.053	20	30		EGEDHN
CC(C)=C(F)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001214427403	1373058822	/nfs/dbraw/zinc/05/88/22/1373058822.db2.gz	WSPFHZSPBMIHSM-RHSMWYFYSA-N	0	3	348.849	3.391	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2=CCCC2)C[C@H]1NCC#Cc1cccc(Cl)c1	ZINC001214430976	1373059755	/nfs/dbraw/zinc/05/97/55/1373059755.db2.gz	GTIMZQGHJNXJNO-DNVCBOLYSA-N	0	3	342.870	3.238	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](C)[C@H](NCc2ccc(Cl)cc2F)C1	ZINC001214528956	1373074758	/nfs/dbraw/zinc/07/47/58/1373074758.db2.gz	FSLZLVWEDXCSMH-CXAGYDPISA-N	0	3	336.838	3.219	20	30		EGEDHN
C=C(C)CNCc1ccncc1O[C@H]1CCN(C(=O)CC(C)(C)C)C1	ZINC001127873379	1373193200	/nfs/dbraw/zinc/19/32/00/1373193200.db2.gz	KIIGEGKXWPXWRF-KRWDZBQOSA-N	0	3	345.487	3.163	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCCNCc1ccccc1OC(C)C	ZINC001128081217	1373215543	/nfs/dbraw/zinc/21/55/43/1373215543.db2.gz	HFDMHCUVTHAGFW-UHFFFAOYSA-N	0	3	330.472	3.448	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@H]2CC23CCCC3)C[C@H]1NCC#Cc1ccccc1	ZINC001216212670	1373281166	/nfs/dbraw/zinc/28/11/66/1373281166.db2.gz	CIHHYTYQUMZMRE-MISYRCLQSA-N	0	3	336.479	3.055	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NCCN[C@@H](C)c1ccc(F)c(F)c1)OCC	ZINC001128539813	1373285782	/nfs/dbraw/zinc/28/57/82/1373285782.db2.gz	LAXBGPILXZOXHF-GUYCJALGSA-N	0	3	340.414	3.103	20	30		EGEDHN
CC(C)c1ccccc1C(=O)NCCNCc1ccc(C#N)c(F)c1	ZINC001128864868	1373318024	/nfs/dbraw/zinc/31/80/24/1373318024.db2.gz	MMEVPMHNRMMHSG-UHFFFAOYSA-N	0	3	339.414	3.340	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)c3ccc(F)cc3)[C@H]2C1	ZINC001217185422	1373401030	/nfs/dbraw/zinc/40/10/30/1373401030.db2.gz	COZZLZYBFZUFDY-RBUKOAKNSA-N	0	3	346.446	3.097	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)c3ccccc3C)[C@H]2C1	ZINC001217200520	1373404577	/nfs/dbraw/zinc/40/45/77/1373404577.db2.gz	IUEOFEQDEXUPPO-VQTJNVASSA-N	0	3	344.499	3.491	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)c3ccsc3C)[C@H]2C1	ZINC001217826040	1373504542	/nfs/dbraw/zinc/50/45/42/1373504542.db2.gz	KDVFBDCVSJBKKA-ZWKOTPCHSA-N	0	3	348.512	3.328	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NCCNCc1csc(C)c1	ZINC001130374415	1373509125	/nfs/dbraw/zinc/50/91/25/1373509125.db2.gz	QHWNPOPUJFAYAA-UHFFFAOYSA-N	0	3	330.453	3.141	20	30		EGEDHN
Cc1[nH]c2c(cccc2C(=O)NCCNCc2ccc(C#N)cc2)c1C	ZINC001130384443	1373512582	/nfs/dbraw/zinc/51/25/82/1373512582.db2.gz	INCHOUQKWQFKHO-UHFFFAOYSA-N	0	3	346.434	3.176	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)c3cccc(Cl)c3C)[C@H]2C1	ZINC001217953717	1373518524	/nfs/dbraw/zinc/51/85/24/1373518524.db2.gz	HDILGDJLMLTNHJ-ZWKOTPCHSA-N	0	3	348.874	3.140	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)CCCCC(C)C)C1	ZINC001130433521	1373537750	/nfs/dbraw/zinc/53/77/50/1373537750.db2.gz	BBPHNCDSYYGQHE-INIZCTEOSA-N	0	3	332.492	3.218	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)C[C@@H](CC)C(C)(C)C)C1	ZINC001130442339	1373541465	/nfs/dbraw/zinc/54/14/65/1373541465.db2.gz	JDSANDYFVDEYNS-NVXWUHKLSA-N	0	3	346.519	3.464	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)C[C@H](C)CC(C)C)C1	ZINC001130442183	1373541777	/nfs/dbraw/zinc/54/17/77/1373541777.db2.gz	HVVJNNICUGOQSZ-CVEARBPZSA-N	0	3	332.492	3.074	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)C2(C)C(C)(C)C2(C)C)C1	ZINC001130457249	1373545481	/nfs/dbraw/zinc/54/54/81/1373545481.db2.gz	SSCVPLWVWHEWKT-AWEZNQCLSA-N	0	3	344.503	3.074	20	30		EGEDHN
O=C(/C=C/c1ccccc1)c1ccccc1O[C@H]1CC[C@@H]2NCCO[C@H]21	ZINC001218150892	1373570784	/nfs/dbraw/zinc/57/07/84/1373570784.db2.gz	ZYGZZKJNPQLXTK-UHVDOKLPSA-N	0	3	349.430	3.481	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@H](C)CCCCCC)C[C@H]1c1cn(C)cn1	ZINC001130698757	1373581949	/nfs/dbraw/zinc/58/19/49/1373581949.db2.gz	SCQMUUPDJZVFCJ-ZIFCJYIRSA-N	0	3	346.519	3.097	20	30		EGEDHN
C=CCN1C[C@H](OC)C[C@H]1Cn1ccc(NC(=O)CCCCCC)n1	ZINC001130881019	1373602095	/nfs/dbraw/zinc/60/20/95/1373602095.db2.gz	ZHRUNKUVCSBCGE-DLBZAZTESA-N	0	3	348.491	3.067	20	30		EGEDHN
Cc1noc2nc(O[C@H](C)c3ccccc3C#N)c3c(c12)CCNC3	ZINC001218409111	1373609475	/nfs/dbraw/zinc/60/94/75/1373609475.db2.gz	PWERGHNXRANVBC-GFCCVEGCSA-N	0	3	334.379	3.189	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)C[C@H]3CC=CCC3)[C@H]2C1	ZINC001218428925	1373611853	/nfs/dbraw/zinc/61/18/53/1373611853.db2.gz	ITPQGCGHSQSSQK-SLFFLAALSA-N	0	3	346.515	3.391	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCO[C@@H]2CN(CCC3CCCCC3)C[C@@H]21	ZINC001218516480	1373627854	/nfs/dbraw/zinc/62/78/54/1373627854.db2.gz	BUYSRSRIHRWDNR-YSIASYRMSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCO[C@@H]2CN(CC3CC4(CCC4)C3)C[C@@H]21	ZINC001218524522	1373629616	/nfs/dbraw/zinc/62/96/16/1373629616.db2.gz	YHWUQFLTCGZQLD-YTQUADARSA-N	0	3	346.515	3.081	20	30		EGEDHN
C=CCCCC(=O)N1CCO[C@@H]2CN([C@H](C)c3ccccc3C)C[C@@H]21	ZINC001218565933	1373633952	/nfs/dbraw/zinc/63/39/52/1373633952.db2.gz	BGEIDIVUUJWFPF-YZGWKJHDSA-N	0	3	342.483	3.324	20	30		EGEDHN
CC(C)=C[C@H]1[C@H](C(=O)NCCNCc2ccc(F)c(C#N)c2)C1(C)C	ZINC001131087236	1373639376	/nfs/dbraw/zinc/63/93/76/1373639376.db2.gz	BFNCBMXZWKGBJJ-FUHWJXTLSA-N	0	3	343.446	3.142	20	30		EGEDHN
CC(C)=C[C@H]1[C@@H](C(=O)NCCNCc2ccc(F)c(C#N)c2)C1(C)C	ZINC001131087238	1373639436	/nfs/dbraw/zinc/63/94/36/1373639436.db2.gz	BFNCBMXZWKGBJJ-WMZOPIPTSA-N	0	3	343.446	3.142	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)[C@H](C)CC3CCCC3)[C@H]2C1	ZINC001218715751	1373646934	/nfs/dbraw/zinc/64/69/34/1373646934.db2.gz	KXZUVEDNWXDVTC-NZSAHSFTSA-N	0	3	334.504	3.081	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2cc3ccccc3cc2F)c1	ZINC001131199170	1373660665	/nfs/dbraw/zinc/66/06/65/1373660665.db2.gz	YVPMMEHQYBOMOV-UHFFFAOYSA-N	0	3	347.393	3.370	20	30		EGEDHN
Cc1cccc(CC(=O)NCCNCc2ccc(C#N)s2)c1Cl	ZINC001131262685	1373671670	/nfs/dbraw/zinc/67/16/70/1373671670.db2.gz	GQDRVBYHCVZOIY-UHFFFAOYSA-N	0	3	347.871	3.030	20	30		EGEDHN
C=C[C@H](C(=O)N1CCO[C@@H]2CN(CCCCC)C[C@@H]21)c1ccccc1	ZINC001219043574	1373682705	/nfs/dbraw/zinc/68/27/05/1373682705.db2.gz	DFHIIZMIKYCOFN-SLFFLAALSA-N	0	3	342.483	3.058	20	30		EGEDHN
C=C[C@@H]1C[C@]1(N)C(=O)Nc1ccc2c(c1)N(Cc1ccccc1)CC2	ZINC001219518841	1373713440	/nfs/dbraw/zinc/71/34/40/1373713440.db2.gz	ZXRZMQOXITZPNF-DYESRHJHSA-N	0	3	333.435	3.091	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@H]2CCCC3(CC3)C2)[C@@H](O)C1	ZINC001219626096	1373720491	/nfs/dbraw/zinc/72/04/91/1373720491.db2.gz	CNSWUGOLXAIXNP-KSZLIROESA-N	0	3	336.520	3.089	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@@H](NCc3cccnc3C)C2)CCCCC1	ZINC001188266456	1388279140	/nfs/dbraw/zinc/27/91/40/1388279140.db2.gz	WIWBZPDDVONFMB-LJQANCHMSA-N	0	3	339.483	3.054	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)CN(C(=O)C(C)(C)CCCCC)C[C@@H](C)O2	ZINC001131701402	1373771637	/nfs/dbraw/zinc/77/16/37/1373771637.db2.gz	TZBZBJLKBPSZCY-WIYYLYMNSA-N	0	3	348.531	3.308	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](C)O[C@@]3(CCN(CC(=C)C)C3)C2)CCCC1	ZINC001131703571	1373772756	/nfs/dbraw/zinc/77/27/56/1373772756.db2.gz	DQTHHRUJVDWREV-WIYYLYMNSA-N	0	3	346.515	3.391	20	30		EGEDHN
CCCCCCCN1CC[C@@H]2CN(C(=O)C3(F)CCOCC3)[C@@H]2C1	ZINC001221603639	1373783289	/nfs/dbraw/zinc/78/32/89/1373783289.db2.gz	UPKNJXXXNOWOJF-IAGOWNOFSA-N	0	3	340.483	3.008	20	30		EGEDHN
Cc1ccc(CN2C[C@H](NC(=O)CSCC#N)CC[C@@H]2C)cc1C	ZINC001131829310	1373827195	/nfs/dbraw/zinc/82/71/95/1373827195.db2.gz	DLOGKYWZSKHZFI-FUHWJXTLSA-N	0	3	345.512	3.029	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)CCC3CCCCCC3)[C@@H]2C1	ZINC001188568321	1388332201	/nfs/dbraw/zinc/33/22/01/1388332201.db2.gz	KPFPMIQBIGVDDB-VQTJNVASSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@@H](C)N(CCOc2ccc(OC)cc2)C1	ZINC001131895252	1375032018	/nfs/dbraw/zinc/03/20/18/1375032018.db2.gz	HNGAZIAOLQFORX-IAGOWNOFSA-N	0	3	346.471	3.009	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC[C@@H](C)N(CCOc2cccc(C)c2)C1	ZINC001131896903	1375033075	/nfs/dbraw/zinc/03/30/75/1375033075.db2.gz	WZTUNCDNVMGZTF-MSOLQXFVSA-N	0	3	330.472	3.309	20	30		EGEDHN
C=CCOCC(=O)N[C@@H]1CC[C@H](C)N(Cc2ccc(CCC)cc2)C1	ZINC001131946045	1375061914	/nfs/dbraw/zinc/06/19/14/1375061914.db2.gz	GAIYYRGDWPZWGX-FXAWDEMLSA-N	0	3	344.499	3.311	20	30		EGEDHN
C=CCOCC(=O)N[C@H]1CC[C@H](C)N(Cc2ccc(CCC)cc2)C1	ZINC001131946046	1375062337	/nfs/dbraw/zinc/06/23/37/1375062337.db2.gz	GAIYYRGDWPZWGX-PXNSSMCTSA-N	0	3	344.499	3.311	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@@H](C)N(CCCOc2ccccc2)C1	ZINC001131995368	1375087882	/nfs/dbraw/zinc/08/78/82/1375087882.db2.gz	JRDOROXVOPXXLP-RTBURBONSA-N	0	3	342.483	3.228	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CC[C@H](C)N(CCOc2cccc(C)c2)C1	ZINC001131995118	1375088209	/nfs/dbraw/zinc/08/82/09/1375088209.db2.gz	GZEDGRHREBMADV-OALUTQOASA-N	0	3	342.483	3.146	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@H](C)N(Cc2cccc(N(C)C)c2)C1	ZINC001132002653	1375094069	/nfs/dbraw/zinc/09/40/69/1375094069.db2.gz	MBVWERWXJIVCDE-PKOBYXMFSA-N	0	3	341.499	3.025	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)C[C@H](CC)c2ccccc2)CC1	ZINC001225148953	1375095230	/nfs/dbraw/zinc/09/52/30/1375095230.db2.gz	CRWBEAXBXDGZPG-IBGZPJMESA-N	0	3	326.484	3.422	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)C[C@H]2CCCc3ccccc32)CC1	ZINC001225228742	1375098615	/nfs/dbraw/zinc/09/86/15/1375098615.db2.gz	YANZTKGELJUYNT-HXUWFJFHSA-N	0	3	338.495	3.348	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H]1CC[C@@H](C)N(Cc2ccc3ncccc3c2)C1	ZINC001132016475	1375099856	/nfs/dbraw/zinc/09/98/56/1375099856.db2.gz	HHBKOCRZPAJQJS-XLIONFOSSA-N	0	3	349.478	3.363	20	30		EGEDHN
C[C@H]1CC[C@H](NC(=O)C#CC2CC2)CN1Cc1ccc2cc[nH]c2c1	ZINC001132034409	1375109559	/nfs/dbraw/zinc/10/95/59/1375109559.db2.gz	QVGNDFAAEXFMDE-KXBFYZLASA-N	0	3	335.451	3.050	20	30		EGEDHN
Cc1ncsc1CCN1C[C@H](NC(=O)C#CC(C)(C)C)CC[C@H]1C	ZINC001132037507	1375110700	/nfs/dbraw/zinc/11/07/00/1375110700.db2.gz	DBNXOVVWPUJXKA-GDBMZVCRSA-N	0	3	347.528	3.013	20	30		EGEDHN
C[C@H]1CC[C@@H](NC(=O)C#CC2CC2)CN1Cc1ccc2ncccc2c1	ZINC001132047296	1375115821	/nfs/dbraw/zinc/11/58/21/1375115821.db2.gz	WFEKIHUOVXDWHF-OXJNMPFZSA-N	0	3	347.462	3.117	20	30		EGEDHN
C#CCC1(C(=O)N[C@H]2CC[C@@H](C)N(CCOCCC(C)C)C2)CCC1	ZINC001132101779	1375148383	/nfs/dbraw/zinc/14/83/83/1375148383.db2.gz	OITSPYVPUCVRNB-MOPGFXCFSA-N	0	3	348.531	3.212	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COC/C=C/c2ccccc2)CC[C@@H]1C	ZINC001132124053	1375158966	/nfs/dbraw/zinc/15/89/66/1375158966.db2.gz	LYKUCYRVWBJZBY-JYIRHVFTSA-N	0	3	342.483	3.262	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCc2ccc3[nH]ccc3c2)CC[C@@H]1C	ZINC001132177586	1375189938	/nfs/dbraw/zinc/18/99/38/1375189938.db2.gz	BXWTWEYDSBNLIW-YJBOKZPZSA-N	0	3	325.456	3.256	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@@H](C)OCc3cccc(C)c3)[C@@H]2C1	ZINC001188697702	1388362452	/nfs/dbraw/zinc/36/24/52/1388362452.db2.gz	AONPQMOCESQTDA-YZGWKJHDSA-N	0	3	342.483	3.009	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)CC(C)(C)CC(F)F)CC[C@@H]1C	ZINC001132190696	1375197258	/nfs/dbraw/zinc/19/72/58/1375197258.db2.gz	MPDQGICMRXIOKF-LSDHHAIUSA-N	0	3	346.462	3.230	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)/C=C(\C)CC	ZINC001226059611	1375197581	/nfs/dbraw/zinc/19/75/81/1375197581.db2.gz	YQBZRTGWBYXDFC-LLVNNSLESA-N	0	3	329.282	3.268	20	30		EGEDHN
CC[C@H](c1ccc(F)cc1)N1CCC(NC(=O)CSCC#N)CC1	ZINC001226152187	1375212566	/nfs/dbraw/zinc/21/25/66/1375212566.db2.gz	DCGFWUSPWTYLMH-QGZVFWFLSA-N	0	3	349.475	3.114	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CC[C@@H](C)N(CCc2cnn(CC)c2)C1	ZINC001132217899	1375215580	/nfs/dbraw/zinc/21/55/80/1375215580.db2.gz	IQMQLNJPTVBMJN-SJLPKXTDSA-N	0	3	346.519	3.017	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CC[C@H](C)N(CCOc2ccccc2)C1	ZINC001132249543	1375246529	/nfs/dbraw/zinc/24/65/29/1375246529.db2.gz	QCMSRTQRHBTBLZ-ZWKOTPCHSA-N	0	3	330.472	3.391	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCCc2ccc(OC)cc2)CC[C@H]1C	ZINC001132265590	1375255097	/nfs/dbraw/zinc/25/50/97/1375255097.db2.gz	PGRIKOZKFFPFBO-SJLPKXTDSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)Cc2cc(C)ccc2C)CC[C@H]1C	ZINC001132266259	1375255235	/nfs/dbraw/zinc/25/52/35/1375255235.db2.gz	WFGOABQUAUNDPW-UYAOXDASSA-N	0	3	344.499	3.018	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC1CCN([C@@H](C)c2cccc(F)c2)CC1	ZINC001226446468	1375260488	/nfs/dbraw/zinc/26/04/88/1375260488.db2.gz	BTROFIUSPFURAL-HOTGVXAUSA-N	0	3	348.462	3.449	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2ccc(C=C)cc2)CC[C@H]1C	ZINC001132310611	1375288279	/nfs/dbraw/zinc/28/82/79/1375288279.db2.gz	LYNRRZWGQSXDQC-VQIMIIECSA-N	0	3	328.456	3.115	20	30		EGEDHN
C[C@H](C#N)C(=O)NC1CCN([C@@H]2CCc3c2cccc3Cl)CC1	ZINC001226626242	1375295305	/nfs/dbraw/zinc/29/53/05/1375295305.db2.gz	WJDILYSGXJUFKO-SJKOYZFVSA-N	0	3	331.847	3.068	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC1CCN([C@@H]2CCc3c2cccc3Cl)CC1	ZINC001226626244	1375295925	/nfs/dbraw/zinc/29/59/25/1375295925.db2.gz	WJDILYSGXJUFKO-YVEFUNNKSA-N	0	3	331.847	3.068	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC1CCN(CCCc2ccccc2Cl)CC1	ZINC001226641408	1375298629	/nfs/dbraw/zinc/29/86/29/1375298629.db2.gz	ZZFBILFFTTWLGJ-AWEZNQCLSA-N	0	3	333.863	3.013	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)C1(COC)CCCCC1	ZINC001226656203	1375300296	/nfs/dbraw/zinc/30/02/96/1375300296.db2.gz	DSWPSZJTYCAKCW-HZPDHXFCSA-N	0	3	342.911	3.353	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CC[C@@H](C)N(CCn2nc(C)cc2C)C1	ZINC001132332535	1375312534	/nfs/dbraw/zinc/31/25/34/1375312534.db2.gz	VJNQRAIILDPHDN-SJLPKXTDSA-N	0	3	346.519	3.071	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C(C)(C)CC2CCOCC2)CC[C@@H]1C	ZINC001132397307	1375353052	/nfs/dbraw/zinc/35/30/52/1375353052.db2.gz	RAOGIMVUHBSSJU-WMZOPIPTSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2c[nH]c(C)cc2=O)CC[C@@H]1C	ZINC001132403372	1375355860	/nfs/dbraw/zinc/35/58/60/1375355860.db2.gz	VZHXFYBWYNDALX-IRXDYDNUSA-N	0	3	345.487	3.012	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C(C)(C)Cc2ccccc2)CC[C@@H]1C	ZINC001132409654	1375358729	/nfs/dbraw/zinc/35/87/29/1375358729.db2.gz	CKIBLMFSBWFPRU-HKUYNNGSSA-N	0	3	326.484	3.248	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2cc(C)cc(C)c2)CC[C@@H]1C	ZINC001132444597	1375388226	/nfs/dbraw/zinc/38/82/26/1375388226.db2.gz	CGXPGSACZYSHDG-PKOBYXMFSA-N	0	3	330.472	3.089	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCc2c[nH]c3ccccc23)CC[C@H]1C	ZINC001132463913	1375406130	/nfs/dbraw/zinc/40/61/30/1375406130.db2.gz	JZDNHKVGFVICEL-WBVHZDCISA-N	0	3	325.456	3.256	20	30		EGEDHN
C[C@H]1CCCC[C@H]1OCCN1CCC(NC(=O)C#CC(C)(C)C)CC1	ZINC001227243829	1375411175	/nfs/dbraw/zinc/41/11/75/1375411175.db2.gz	CUGYALDQKAFJJR-PKOBYXMFSA-N	0	3	348.531	3.212	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCOc2cccc(C)c2)CC[C@H]1C	ZINC001132500504	1375427207	/nfs/dbraw/zinc/42/72/07/1375427207.db2.gz	PCJNTTROUBLEKK-QZTJIDSGSA-N	0	3	330.472	3.309	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCNCc1cnc(-c2ccccc2)s1	ZINC001132576696	1375473594	/nfs/dbraw/zinc/47/35/94/1375473594.db2.gz	NRYZTUZYUIURCH-CABCVRRESA-N	0	3	343.496	3.474	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)C/C=C\c2cccc(F)c2)CC1	ZINC001227849379	1375481800	/nfs/dbraw/zinc/48/18/00/1375481800.db2.gz	PXOXXAPWHRXSDJ-XQRVVYSFSA-N	0	3	346.446	3.012	20	30		EGEDHN
CCCCC(=O)N1CC[C@H](C)[C@H](CNCc2ccccc2C#N)C1	ZINC001132669937	1375506414	/nfs/dbraw/zinc/50/64/14/1375506414.db2.gz	LBIULKZQNHYMGG-QFBILLFUSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCCNCc1csc(Br)c1	ZINC001132671149	1375506874	/nfs/dbraw/zinc/50/68/74/1375506874.db2.gz	JXZIZGJRQQWJCG-NSHDSACASA-N	0	3	345.306	3.319	20	30		EGEDHN
Cc1ncccc1C(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1	ZINC001228247024	1375532862	/nfs/dbraw/zinc/53/28/62/1375532862.db2.gz	DGZHMYRXNVLCRP-NHCUHLMSSA-N	0	3	347.462	3.072	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](C)[C@H](CNCc2ocnc2C)C1	ZINC001132846883	1375598665	/nfs/dbraw/zinc/59/86/65/1375598665.db2.gz	NVRPHJRQBJGPDP-GDBMZVCRSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NC1CCN(Cc2ccc(COC)cc2)CC1	ZINC001228748929	1375661527	/nfs/dbraw/zinc/66/15/27/1375661527.db2.gz	OMTXUABMOMSMCS-DLBZAZTESA-N	0	3	344.499	3.372	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC1CCN(CCc2scnc2C)CC1	ZINC001228809238	1375683396	/nfs/dbraw/zinc/68/33/96/1375683396.db2.gz	GKWRKGCCBZBESR-HNNXBMFYSA-N	0	3	335.517	3.177	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC1CCN(C[C@@H](O)c2ccc(F)cc2)CC1	ZINC001228810357	1375685211	/nfs/dbraw/zinc/68/52/11/1375685211.db2.gz	TXNCMUUAZYYDIA-DNVCBOLYSA-N	0	3	348.462	3.042	20	30		EGEDHN
CCN1CC[C@H](Oc2cc3ncc(C#N)c(Cl)c3cc2OC)C1	ZINC001229107060	1375765909	/nfs/dbraw/zinc/76/59/09/1375765909.db2.gz	VGWDIFLOIDZHID-LBPRGKRZSA-N	0	3	331.803	3.241	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](C)[C@H](CNCc3nccs3)C2)CCC1	ZINC001133104422	1375776831	/nfs/dbraw/zinc/77/68/31/1375776831.db2.gz	DBMSTPYQLOCXHO-HZPDHXFCSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=CCCCC(=O)NCCNCc1ccc(Br)c(F)c1	ZINC001133145037	1375804859	/nfs/dbraw/zinc/80/48/59/1375804859.db2.gz	MUTCBLQTKPIJAS-UHFFFAOYSA-N	0	3	343.240	3.150	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2ccc(C(F)F)cc2)CC1	ZINC001229625880	1375868741	/nfs/dbraw/zinc/86/87/41/1375868741.db2.gz	OCCMOXLMOAUDLB-UHFFFAOYSA-N	0	3	338.398	3.021	20	30		EGEDHN
Cc1ccc(CCCC(=O)NCCNCc2ccc(C#N)cc2)cc1	ZINC001133257630	1375873521	/nfs/dbraw/zinc/87/35/21/1375873521.db2.gz	KZLNMLDVYVVXEK-UHFFFAOYSA-N	0	3	335.451	3.095	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@H]2CN(CCOc3ccccc3)C[C@H]21	ZINC001188908948	1388407503	/nfs/dbraw/zinc/40/75/03/1388407503.db2.gz	LSAHITKUHYKVQF-CMKODMSKSA-N	0	3	342.483	3.200	20	30		EGEDHN
Cc1cccc(Cl)c1C(=O)NCCNCc1ccc(C#N)cc1	ZINC001133314904	1375918188	/nfs/dbraw/zinc/91/81/88/1375918188.db2.gz	PQENVJSJXAKBAP-UHFFFAOYSA-N	0	3	327.815	3.040	20	30		EGEDHN
C=C1CCC(C(=O)NCCNCc2ccc(C(C)C)nc2C)CC1	ZINC001133362611	1375945702	/nfs/dbraw/zinc/94/57/02/1375945702.db2.gz	NFANZVYAEDYQOP-UHFFFAOYSA-N	0	3	329.488	3.466	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1[nH]c(C)cc1C	ZINC001133399600	1375984127	/nfs/dbraw/zinc/98/41/27/1375984127.db2.gz	TUUGXYWXNWPVBY-UHFFFAOYSA-N	0	3	343.858	3.150	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H]1CCC1(C)C	ZINC001133401601	1375985142	/nfs/dbraw/zinc/98/51/42/1375985142.db2.gz	IQLYGYFKEDUNDF-KRWDZBQOSA-N	0	3	332.875	3.328	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H](C)C(F)(F)F	ZINC001133403756	1375988849	/nfs/dbraw/zinc/98/88/49/1375988849.db2.gz	HHUADDZYSVROHE-GFCCVEGCSA-N	0	3	346.780	3.090	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)CC(C)(F)F	ZINC001133407626	1375992363	/nfs/dbraw/zinc/99/23/63/1375992363.db2.gz	KXHMGNZXRYKNQP-UHFFFAOYSA-N	0	3	342.817	3.327	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CCCC[C@H]2NCc2cnn(C)c2)CCCC1	ZINC001230386397	1376012836	/nfs/dbraw/zinc/01/28/36/1376012836.db2.gz	SMTLGWVVEPJXCQ-QZTJIDSGSA-N	0	3	344.503	3.074	20	30		EGEDHN
C=CCC1(C(=O)NC2CCN(CCOCC3CC3)CC2)CCCC1	ZINC001230475440	1376034156	/nfs/dbraw/zinc/03/41/56/1376034156.db2.gz	KJGSSGMKIZBIMH-UHFFFAOYSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1C1CCN(C(=O)[C@H](CC)OCC)CC1	ZINC001230522174	1376052661	/nfs/dbraw/zinc/05/26/61/1376052661.db2.gz	INIBCXASILMJID-IRXDYDNUSA-N	0	3	342.911	3.257	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1ccccc1C#N)NC(=O)Cc1cccs1	ZINC001133521503	1376055773	/nfs/dbraw/zinc/05/57/73/1376055773.db2.gz	SLFXIIKHIAKQJA-LSDHHAIUSA-N	0	3	341.480	3.235	20	30		EGEDHN
C#CCCCC(=O)N1CCC([C@@H]2CCCN2Cc2nccs2)CC1	ZINC001230558209	1376079559	/nfs/dbraw/zinc/07/95/59/1376079559.db2.gz	WWDLTCMOXMIJLO-KRWDZBQOSA-N	0	3	345.512	3.150	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)c1sccc1C	ZINC001133560492	1376089456	/nfs/dbraw/zinc/08/94/56/1376089456.db2.gz	VMNQDTOVFQADQM-NWDGAFQWSA-N	0	3	345.306	3.452	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)CCc1ccco1)NCc1ccccc1C#N	ZINC001133648743	1376135575	/nfs/dbraw/zinc/13/55/75/1376135575.db2.gz	GCXQCKXKMNXQIU-CVEARBPZSA-N	0	3	339.439	3.157	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCCN(Cc1cccnc1)C[C@H](C)OC	ZINC001230812128	1376155522	/nfs/dbraw/zinc/15/55/22/1376155522.db2.gz	WNHAZMBDTZEIDP-KRWDZBQOSA-N	0	3	347.503	3.027	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)[C@@H]1C[C@@H]1C(C)C)Cc1cccnc1	ZINC001230882059	1376176219	/nfs/dbraw/zinc/17/62/19/1376176219.db2.gz	MGJNQPGQNRBAFU-RTBURBONSA-N	0	3	329.488	3.258	20	30		EGEDHN
C#CCCN(CCCNC(=O)c1ccc(C)c(C)c1)Cc1cccnc1	ZINC001230911147	1376181653	/nfs/dbraw/zinc/18/16/53/1376181653.db2.gz	ACOXEUJZKMSLOK-UHFFFAOYSA-N	0	3	349.478	3.344	20	30		EGEDHN
C=CCCC(=O)N(C)C[C@H]1CCN1CCCOCCc1ccccc1	ZINC001231123900	1376208349	/nfs/dbraw/zinc/20/83/49/1376208349.db2.gz	XLKBDMHGASKLJG-HXUWFJFHSA-N	0	3	344.499	3.135	20	30		EGEDHN
CCSCCC(=O)N[C@@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001133806981	1376213034	/nfs/dbraw/zinc/21/30/34/1376213034.db2.gz	DWCUYOWVONVNRW-GJZGRUSLSA-N	0	3	333.501	3.074	20	30		EGEDHN
C/C(=C/C(=O)N[C@H](C)C[C@H](C)NCc1ccccc1C#N)C1CC1	ZINC001133872550	1376245348	/nfs/dbraw/zinc/24/53/48/1376245348.db2.gz	WMIKNJCWDCCMBC-HGXPIFGLSA-N	0	3	325.456	3.287	20	30		EGEDHN
C#Cc1cccc(CN2CC[C@@H]3[C@@H](CN3C(=O)OC(C)(C)C)C2)c1	ZINC001231658431	1376298544	/nfs/dbraw/zinc/29/85/44/1376298544.db2.gz	WKEMPGRKPQHHMO-QZTJIDSGSA-N	0	3	326.440	3.109	20	30		EGEDHN
CN(CCC#N)c1ccc(CN2CC[C@]3(C2)CC(F)(F)CO3)cc1	ZINC001231820193	1376319816	/nfs/dbraw/zinc/31/98/16/1376319816.db2.gz	BITLDQURNYAJJC-QGZVFWFLSA-N	0	3	335.398	3.037	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H](C)C[C@H](C)NCc1ccn(C(C)C)n1	ZINC001134118960	1376377774	/nfs/dbraw/zinc/37/77/74/1376377774.db2.gz	JRPKJSJFLTUTPP-IRXDYDNUSA-N	0	3	332.492	3.031	20	30		EGEDHN
Cc1ccc(C(=O)NCCNCc2ccc(C#N)s2)c(Cl)c1	ZINC001134165585	1376396967	/nfs/dbraw/zinc/39/69/67/1376396967.db2.gz	UBPWKOBRDCIARI-UHFFFAOYSA-N	0	3	333.844	3.101	20	30		EGEDHN
C#CCCCC(=O)N[C@@H](C)C[C@@H](C)NCc1nsc2ccccc12	ZINC001134206493	1376418406	/nfs/dbraw/zinc/41/84/06/1376418406.db2.gz	VRCBLAPIUFENOR-CABCVRRESA-N	0	3	343.496	3.473	20	30		EGEDHN
Cc1coc(C)c1C(=O)N[C@@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001134256543	1376439918	/nfs/dbraw/zinc/43/99/18/1376439918.db2.gz	LQOFHYLBKAABLB-CABCVRRESA-N	0	3	339.439	3.455	20	30		EGEDHN
C=CCCCCC[NH2+][C@@H](C)C[C@H](C)NC(=O)c1cccc2n[n-]nc21	ZINC001134410632	1376515641	/nfs/dbraw/zinc/51/56/41/1376515641.db2.gz	ZDCCGEAOUBVPAI-GJZGRUSLSA-N	0	3	343.475	3.191	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H](C)C[C@@H](C)NCc1oc(C)nc1C	ZINC001134447564	1376542348	/nfs/dbraw/zinc/54/23/48/1376542348.db2.gz	JCXRZFVPNNBDGZ-MNOVXSKESA-N	0	3	341.883	3.443	20	30		EGEDHN
C=CCO[C@@H]1CO[C@@]2(C1)CCCN(Cc1ccc3ncoc3c1)C2	ZINC001232940788	1376543437	/nfs/dbraw/zinc/54/34/37/1376543437.db2.gz	GPWZGQIBZJIVDX-QFBILLFUSA-N	0	3	328.412	3.154	20	30		EGEDHN
COc1cccc(OC2CCN(Cc3ccc(C#N)cc3C)CC2)n1	ZINC001233083278	1376567709	/nfs/dbraw/zinc/56/77/09/1376567709.db2.gz	DKUVQLCVVSQJQN-UHFFFAOYSA-N	0	3	337.423	3.314	20	30		EGEDHN
C[C@H](CC1CCCCC1)C(=O)NCCNCc1ccc(C#N)s1	ZINC001134678307	1376651112	/nfs/dbraw/zinc/65/11/12/1376651112.db2.gz	VLYHJFPMWFRDQE-CQSZACIVSA-N	0	3	333.501	3.432	20	30		EGEDHN
CN(C[C@@H]1CCN1CC/C=C\c1ccccc1)C(=O)c1ccc(C#N)[nH]1	ZINC001233692002	1376695601	/nfs/dbraw/zinc/69/56/01/1376695601.db2.gz	CYQPDDQGVJOIQU-STISFXCESA-N	0	3	348.450	3.136	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)CCC(C)(F)F	ZINC001134761635	1376706296	/nfs/dbraw/zinc/70/62/96/1376706296.db2.gz	QWNWMPQTWGJGMG-QWRGUYRKSA-N	0	3	341.240	3.203	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)Cc1ccccc1	ZINC001134765494	1376708892	/nfs/dbraw/zinc/70/88/92/1376708892.db2.gz	ZJGRTUYDGBQQDU-KGLIPLIRSA-N	0	3	339.277	3.011	20	30		EGEDHN
Cc1ccccc1CCCN1CC[C@H]1CN(C)C(=O)C#CC(C)C	ZINC001234170003	1376782760	/nfs/dbraw/zinc/78/27/60/1376782760.db2.gz	HDCJKAVHHUDFSR-FQEVSTJZSA-N	0	3	326.484	3.120	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)C1(C)CCCC1	ZINC001135114491	1376907711	/nfs/dbraw/zinc/90/77/11/1376907711.db2.gz	ARWFZJHBELOSSA-QWHCGFSZSA-N	0	3	331.298	3.348	20	30		EGEDHN
Cc1cocc1C(=O)N[C@H](C)C[C@H](C)NCc1cc(F)ccc1C#N	ZINC001135202788	1376973215	/nfs/dbraw/zinc/97/32/15/1376973215.db2.gz	IIWYOUANDAMSEY-UONOGXRCSA-N	0	3	343.402	3.286	20	30		EGEDHN
C=CCCCC(=O)N[C@@H](C)C[C@H](C)NCc1c(C)nn(C)c1Cl	ZINC001135353581	1377048991	/nfs/dbraw/zinc/04/89/91/1377048991.db2.gz	JMIJNUACMFBOPH-STQMWFEESA-N	0	3	340.899	3.111	20	30		EGEDHN
C=CCCCC(=O)N[C@H](C)C[C@H](C)NCc1c(C)nn(C)c1Cl	ZINC001135353580	1377049269	/nfs/dbraw/zinc/04/92/69/1377049269.db2.gz	JMIJNUACMFBOPH-QWHCGFSZSA-N	0	3	340.899	3.111	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2ccn(CC)n2)CC1	ZINC001135381989	1377065464	/nfs/dbraw/zinc/06/54/64/1377065464.db2.gz	CABHVRGRXDQQLX-HZPDHXFCSA-N	0	3	332.492	3.022	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)C1CC2(CC2)C1)NCc1cc(F)ccc1C#N	ZINC001135445985	1377100497	/nfs/dbraw/zinc/10/04/97/1377100497.db2.gz	IPIMZLATXPUAHP-KBPBESRZSA-N	0	3	343.446	3.260	20	30		EGEDHN
Cc1ccoc1CC(=O)N[C@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001135447351	1377100904	/nfs/dbraw/zinc/10/09/04/1377100904.db2.gz	VKMUAHXWDVYCPG-HZPDHXFCSA-N	0	3	339.439	3.075	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)C1(CF)CCC1)NCc1cc(F)ccc1C#N	ZINC001135501467	1377121035	/nfs/dbraw/zinc/12/10/35/1377121035.db2.gz	POWCGEDIIFWKRT-ZIAGYGMSSA-N	0	3	349.425	3.210	20	30		EGEDHN
CCCCCC[C@@H](C)C(=O)NCCNCc1ccc(OC)c(C#N)c1	ZINC001135547508	1377138405	/nfs/dbraw/zinc/13/84/05/1377138405.db2.gz	KTMMDJHZGJFBJI-MRXNPFEDSA-N	0	3	345.487	3.379	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CC[C@H](N(C)Cc2csc(C)c2)C1	ZINC001189241573	1388493492	/nfs/dbraw/zinc/49/34/92/1388493492.db2.gz	AMNWWACSCBFPPR-RDJZCZTQSA-N	0	3	336.501	3.070	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3c[nH]c4cccc(F)c34)C2)C1=O	ZINC001136981531	1377449233	/nfs/dbraw/zinc/44/92/33/1377449233.db2.gz	RYUIBCOVXYEPEM-HXUWFJFHSA-N	0	3	341.430	3.308	20	30		EGEDHN
C#CCN(Cc1ccc(-n2ccnn2)cc1)[C@@H]1CCc2ccccc21	ZINC001137366738	1377533556	/nfs/dbraw/zinc/53/35/56/1377533556.db2.gz	NOHGACOGENRLDF-OAQYLSRUSA-N	0	3	328.419	3.390	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@]2(C1)CN(C1CCCC1)CCO2	ZINC001268985071	1377535347	/nfs/dbraw/zinc/53/53/47/1377535347.db2.gz	FVGIGYPICNLJPA-HXUWFJFHSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCOC(=O)N1CCCC2(CCN(Cc3ccnc(C)c3)CC2)C1	ZINC001137407549	1377542852	/nfs/dbraw/zinc/54/28/52/1377542852.db2.gz	UEUHXKFRZDLKHQ-UHFFFAOYSA-N	0	3	343.471	3.391	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CCN(Cc3ccc(F)nc3)CC2)CC1	ZINC001137735588	1377607513	/nfs/dbraw/zinc/60/75/13/1377607513.db2.gz	ZEBIDLAQCDXIKI-UHFFFAOYSA-N	0	3	347.434	3.221	20	30		EGEDHN
C=CCO[C@H]1CO[C@]2(C1)CCCN(Cc1cccc(OCC)c1)C2	ZINC001138099341	1377676549	/nfs/dbraw/zinc/67/65/49/1377676549.db2.gz	RSLZDTMNRSFUFG-UXHICEINSA-N	0	3	331.456	3.411	20	30		EGEDHN
O=C1NC2(CO1)CCN(Cc1ccc(C#Cc3ccccc3)cc1)CC2	ZINC001138336340	1377704746	/nfs/dbraw/zinc/70/47/46/1377704746.db2.gz	PUYNPLSUYYJAPI-UHFFFAOYSA-N	0	3	346.430	3.161	20	30		EGEDHN
C#CCOc1ccc(CN2CCC(c3ccccn3)CC2)cc1OC	ZINC001138346217	1377706543	/nfs/dbraw/zinc/70/65/43/1377706543.db2.gz	YRBQXNAWVRWVDX-UHFFFAOYSA-N	0	3	336.435	3.482	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCCN(Cc3ccc4nonc4c3)C2)cc1	ZINC001139223761	1377856002	/nfs/dbraw/zinc/85/60/02/1377856002.db2.gz	YXIGFKWMVNTUHO-KRWDZBQOSA-N	0	3	334.379	3.138	20	30		EGEDHN
C=CCCN(Cc1ccccc1)Cc1ccc(N2CCOCC2)nc1	ZINC001139434188	1377884053	/nfs/dbraw/zinc/88/40/53/1377884053.db2.gz	UXMGRLFLSBOYRO-UHFFFAOYSA-N	0	3	337.467	3.497	20	30		EGEDHN
CN(CCC#N)Cc1ccccc1N1CCN(Cc2ccccc2)CC1	ZINC001139515717	1377895415	/nfs/dbraw/zinc/89/54/15/1377895415.db2.gz	WBWPDLHNHBGJPS-UHFFFAOYSA-N	0	3	348.494	3.354	20	30		EGEDHN
CCOC(=O)C[C@@H]1CCCN(Cc2c[nH]c3c2cccc3C#N)C1	ZINC001139701395	1377937795	/nfs/dbraw/zinc/93/77/95/1377937795.db2.gz	HADVVYQFXHHWBS-AWEZNQCLSA-N	0	3	325.412	3.205	20	30		EGEDHN
Cc1ccc(CN2CC[C@]3(C[C@@H](OCC4CC4)CO3)C2)cc1C#N	ZINC001139724320	1377941585	/nfs/dbraw/zinc/94/15/85/1377941585.db2.gz	ODPYWUUGIGVBTD-UXHICEINSA-N	0	3	326.440	3.027	20	30		EGEDHN
CC[C@@H](C)N1CCC2(CCN(Cc3ccc(C#N)cc3F)CC2)C1=O	ZINC001273303660	1378095661	/nfs/dbraw/zinc/09/56/61/1378095661.db2.gz	NLASQTXOOMHGAD-OAHLLOKOSA-N	0	3	343.446	3.310	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@@H]3C[C@@]32C(=O)N(CC)C(C)C)c1[O-]	ZINC001277463580	1378224184	/nfs/dbraw/zinc/22/41/84/1378224184.db2.gz	MESGTRBQDXCWMT-NQIIRXRSSA-N	0	3	342.483	3.342	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@@H]3C[C@@]32C(=O)N(CC)C(C)C)c1[O-]	ZINC001277463580	1378224188	/nfs/dbraw/zinc/22/41/88/1378224188.db2.gz	MESGTRBQDXCWMT-NQIIRXRSSA-N	0	3	342.483	3.342	20	30		EGEDHN
COc1ccc(C(F)(F)F)cc1CN1CCC2SC(=O)C=C2C1	ZINC001141201185	1378266981	/nfs/dbraw/zinc/26/69/81/1378266981.db2.gz	BCFJMUXDTWFBFM-AWEZNQCLSA-N	0	3	343.370	3.488	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cccc(OC)c1F)CC2	ZINC001141221257	1378273189	/nfs/dbraw/zinc/27/31/89/1378273189.db2.gz	ZXWCEGZGIZLHGF-FQEVSTJZSA-N	0	3	346.446	3.367	20	30		EGEDHN
N#Cc1ccc(Br)cc1CN1CCC2SC(=O)C=C2C1	ZINC001141896997	1378391277	/nfs/dbraw/zinc/39/12/77/1378391277.db2.gz	DQCHZSYMCJXYID-CQSZACIVSA-N	0	3	349.253	3.095	20	30		EGEDHN
CN(CCN(C)C(=O)OC(C)(C)C)Cc1c[nH]c2cc(C#N)ccc12	ZINC001142912048	1378508094	/nfs/dbraw/zinc/50/80/94/1378508094.db2.gz	SJZYCZHIFKXCAA-UHFFFAOYSA-N	0	3	342.443	3.338	20	30		EGEDHN
COc1ccc(O[C@@H]2CCN(Cc3c[nH]c4cc(C#N)ccc34)C2)nc1	ZINC001142930553	1378511644	/nfs/dbraw/zinc/51/16/44/1378511644.db2.gz	KOKBTPOXHPZLLF-QGZVFWFLSA-N	0	3	348.406	3.096	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1ccc(OC)cn1)[C@H]2CC	ZINC001144428164	1378730506	/nfs/dbraw/zinc/73/05/06/1378730506.db2.gz	UZSJHHBZJBHJCB-ICSRJNTNSA-N	0	3	343.471	3.012	20	30		EGEDHN
CCn1cccc1C(=O)N[C@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001146350759	1378824988	/nfs/dbraw/zinc/82/49/88/1378824988.db2.gz	SSYBSXTZFVPSIZ-HZPDHXFCSA-N	0	3	338.455	3.066	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2cnns2)CCCC1	ZINC001146822346	1378928553	/nfs/dbraw/zinc/92/85/53/1378928553.db2.gz	QJHDRLMRIGCQIS-KGLIPLIRSA-N	0	3	336.505	3.048	20	30		EGEDHN
C=CCCC(=O)N1CC2(C1)CCN(CCOc1ccc(Cl)cc1)C2	ZINC001147188322	1378984299	/nfs/dbraw/zinc/98/42/99/1378984299.db2.gz	WVXUAOLDNVWWGH-UHFFFAOYSA-N	0	3	348.874	3.219	20	30		EGEDHN
C#CCCCC(=O)N1CC2(C1)CCN([C@@H](C)c1ccccc1F)C2	ZINC001147462055	1379025457	/nfs/dbraw/zinc/02/54/57/1379025457.db2.gz	MPULWOJSZDREMT-INIZCTEOSA-N	0	3	328.431	3.225	20	30		EGEDHN
CC[C@H](CC(=O)NCCNCc1ccc(F)c(C#N)c1)C(C)(C)C	ZINC001147466765	1379026194	/nfs/dbraw/zinc/02/61/94/1379026194.db2.gz	VSNCXMOUIBBCRR-MRXNPFEDSA-N	0	3	333.451	3.366	20	30		EGEDHN
CC(C)C#CC(=O)N1CC2(C1)CCN(Cc1ccc(C(F)F)cc1)C2	ZINC001147514851	1379036252	/nfs/dbraw/zinc/03/62/52/1379036252.db2.gz	XYQCAUFCCOXNQL-UHFFFAOYSA-N	0	3	346.421	3.318	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CC2(C1)CCN(C/C=C/c1ccccc1)C2	ZINC001147540911	1379039953	/nfs/dbraw/zinc/03/99/53/1379039953.db2.gz	AQBWWWCHPKAIQK-JXMROGBWSA-N	0	3	336.479	3.284	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)CCCc3ccccc3Cl)C2)C1	ZINC001147676567	1379059236	/nfs/dbraw/zinc/05/92/36/1379059236.db2.gz	QICSEHHPKSVICM-UHFFFAOYSA-N	0	3	332.875	3.383	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001148146218	1379124551	/nfs/dbraw/zinc/12/45/51/1379124551.db2.gz	AOQUVMPOXSCRRI-KRWDZBQOSA-N	0	3	337.467	3.195	20	30		EGEDHN
C=CCC1(C(=O)N2CC3(C2)CCN(Cc2ccc(C#N)cc2)C3)CCC1	ZINC001148226771	1379136898	/nfs/dbraw/zinc/13/68/98/1379136898.db2.gz	RRXCZDZAICZVNB-UHFFFAOYSA-N	0	3	349.478	3.339	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)CCCCCc3cccs3)C2)C1	ZINC001148458393	1379175921	/nfs/dbraw/zinc/17/59/21/1379175921.db2.gz	POEINWLYTJQFGE-UHFFFAOYSA-N	0	3	344.524	3.409	20	30		EGEDHN
CC[C@H]1CC[C@H](C(=O)NCCNCc2ccc(F)c(C#N)c2)CC1	ZINC001148500932	1379192864	/nfs/dbraw/zinc/19/28/64/1379192864.db2.gz	ATCHDQTVJKSJCH-KOMQPUFPSA-N	0	3	331.435	3.120	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)C2CCC(C3CC3)CC2)s1	ZINC001149497577	1379391558	/nfs/dbraw/zinc/39/15/58/1379391558.db2.gz	QGKFJPJMSSHEFX-UHFFFAOYSA-N	0	3	331.485	3.042	20	30		EGEDHN
C=CCCCC(=O)NC[C@H]1CN(Cc2cccc(CC)c2)CCCO1	ZINC001150225786	1379518243	/nfs/dbraw/zinc/51/82/43/1379518243.db2.gz	VBMRAOCLPXVUAA-FQEVSTJZSA-N	0	3	344.499	3.312	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2csc3c2CCCC3)cc1	ZINC001150301549	1379530934	/nfs/dbraw/zinc/53/09/34/1379530934.db2.gz	PKOBKQCRPRQKCG-UHFFFAOYSA-N	0	3	339.464	3.018	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)C[C@@H]2CCCC(C)(C)C2)C1	ZINC001150590113	1379575260	/nfs/dbraw/zinc/57/52/60/1379575260.db2.gz	YVJIFFANIUGDCY-ZWKOTPCHSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)c1c2ccccc2nc2c1CCCC2	ZINC001150705537	1379598816	/nfs/dbraw/zinc/59/88/16/1379598816.db2.gz	YLWLOOSUZNJQRW-INIZCTEOSA-N	0	3	349.478	3.494	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)CCc2ccc(Cl)s2)cc1	ZINC001150990744	1379644359	/nfs/dbraw/zinc/64/43/59/1379644359.db2.gz	NRGOYEYTAAWELT-UHFFFAOYSA-N	0	3	347.871	3.112	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@@H]2CCCC[C@H]2C)CC1	ZINC001151281337	1379691686	/nfs/dbraw/zinc/69/16/86/1379691686.db2.gz	JGRLDTMDCBITFD-QZTJIDSGSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@@H](C)c2ccsc2)CC1	ZINC001151302252	1379697138	/nfs/dbraw/zinc/69/71/38/1379697138.db2.gz	FEQAPGCONBCVBI-HNNXBMFYSA-N	0	3	336.501	3.025	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@@H](C)Cc2ccco2)CC1	ZINC001151356701	1379704215	/nfs/dbraw/zinc/70/42/15/1379704215.db2.gz	BAICDADRWMFETG-KRWDZBQOSA-N	0	3	348.487	3.022	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2csc(C)c2)CC1	ZINC001151357380	1379704753	/nfs/dbraw/zinc/70/47/53/1379704753.db2.gz	ZEPRIBUYYYPTFU-UHFFFAOYSA-N	0	3	336.501	3.234	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@H]2C[C@]2(C)C(C)C)CC1	ZINC001151374875	1379707106	/nfs/dbraw/zinc/70/71/06/1379707106.db2.gz	PIEZGDBOGAJWQO-IEBWSBKVSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2cc(CC(C)C)c[nH]2)CC1	ZINC001151399220	1379711149	/nfs/dbraw/zinc/71/11/49/1379711149.db2.gz	UMPQTBOBVAAYTA-UHFFFAOYSA-N	0	3	347.503	3.000	20	30		EGEDHN
C=CC[C@@H](C(=O)NCCNCc1ccnc(Cl)c1)c1ccccc1	ZINC001151838094	1379793486	/nfs/dbraw/zinc/79/34/86/1379793486.db2.gz	JCODIJPTTGTBPF-QGZVFWFLSA-N	0	3	343.858	3.301	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)C(=O)NCCNCc1scnc1C	ZINC001151922496	1379815729	/nfs/dbraw/zinc/81/57/29/1379815729.db2.gz	AGYXVXXGXCOBTN-QGZVFWFLSA-N	0	3	343.496	3.092	20	30		EGEDHN
C=C[C@H](CC(=O)NCCNCc1ccnc(Cl)c1)c1ccccc1	ZINC001151943368	1379822650	/nfs/dbraw/zinc/82/26/50/1379822650.db2.gz	XXFSCUFFVOEFTQ-MRXNPFEDSA-N	0	3	343.858	3.301	20	30		EGEDHN
CCCCO[C@@H](C)C(=O)NC[C@@H](C)N(CC)Cc1cccc(C#N)c1	ZINC001152325688	1379909283	/nfs/dbraw/zinc/90/92/83/1379909283.db2.gz	ABVVPNZPTAQPGQ-SJORKVTESA-N	0	3	345.487	3.090	20	30		EGEDHN
C=CCOCCCC(=O)NC[C@@H](C)N(CC)Cc1ccc(C)nc1C	ZINC001152584952	1379954098	/nfs/dbraw/zinc/95/40/98/1379954098.db2.gz	HDDYPJLLRDMDPY-QGZVFWFLSA-N	0	3	347.503	3.008	20	30		EGEDHN
CC[C@H](C(=O)NCCNCc1ccc(C#N)cc1)c1ccc(F)cc1	ZINC001152797181	1379982000	/nfs/dbraw/zinc/98/20/00/1379982000.db2.gz	VSJLXRBUFZRRKF-IBGZPJMESA-N	0	3	339.414	3.097	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)cc1	ZINC001152867255	1379988249	/nfs/dbraw/zinc/98/82/49/1379988249.db2.gz	LVWLUQLTRPVXHB-QGZVFWFLSA-N	0	3	325.456	3.078	20	30		EGEDHN
C[C@H]1CCCC[C@H]1CC(=O)NCCNCc1ccc(C#N)c(F)c1	ZINC001153251418	1380044549	/nfs/dbraw/zinc/04/45/49/1380044549.db2.gz	BHCPDEPLVBKREA-HOCLYGCPSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H](C)N(CC)C[C@H]1COc2ccccc2O1	ZINC001153625951	1380106515	/nfs/dbraw/zinc/10/65/15/1380106515.db2.gz	QTICWORAZMGFRV-SJORKVTESA-N	0	3	346.471	3.009	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H](C)N(CC)C[C@H](O)c1ccccc1F	ZINC001153635711	1380108513	/nfs/dbraw/zinc/10/85/13/1380108513.db2.gz	AIMOYWYMTCNSBK-QAPCUYQASA-N	0	3	336.451	3.042	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@@H](C)CCc1ccc(F)cc1	ZINC001153773035	1380126336	/nfs/dbraw/zinc/12/63/36/1380126336.db2.gz	IKMGJUWGTABAQN-DLBZAZTESA-N	0	3	332.463	3.244	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)c(F)c1	ZINC001154620654	1380319450	/nfs/dbraw/zinc/31/94/50/1380319450.db2.gz	PAPALUJFAPKRHG-CQSZACIVSA-N	0	3	331.435	3.236	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)c1cocc1C	ZINC001154660993	1380326528	/nfs/dbraw/zinc/32/65/28/1380326528.db2.gz	JEAQNBABDFSMPT-CQSZACIVSA-N	0	3	343.402	3.239	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)[C@]1(C)C=CCC1	ZINC001154681924	1380330430	/nfs/dbraw/zinc/33/04/30/1380330430.db2.gz	CUSXPHIHFWBNMV-FOIQADDNSA-N	0	3	343.446	3.380	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)C1(C)CC=CC1	ZINC001155005036	1380389189	/nfs/dbraw/zinc/38/91/89/1380389189.db2.gz	FPQQADPVCQTLKO-MRXNPFEDSA-N	0	3	325.456	3.241	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@H](C)c1ccc(Cl)s1	ZINC001156248382	1380548359	/nfs/dbraw/zinc/54/83/59/1380548359.db2.gz	RNVHBEAHHCRNSV-CHWSQXEVSA-N	0	3	326.893	3.355	20	30		EGEDHN
CN(CCN(C)C(=O)c1cc2cc(C#N)ccc2[nH]1)Cc1ccccc1	ZINC001156457743	1380578687	/nfs/dbraw/zinc/57/86/87/1380578687.db2.gz	VXYPYMGJEFJWIR-UHFFFAOYSA-N	0	3	346.434	3.244	20	30		EGEDHN
C#CCCCCC(=O)NCCCNCc1cnc(-c2ccccc2)o1	ZINC001156827915	1380663226	/nfs/dbraw/zinc/66/32/26/1380663226.db2.gz	NGMFAQZORLITLL-UHFFFAOYSA-N	0	3	339.439	3.131	20	30		EGEDHN
C=CCOCC(=O)N1CCCC[C@@H]1CN(C)[C@H](C)c1ccc(F)cc1	ZINC001157687373	1381001755	/nfs/dbraw/zinc/00/17/55/1381001755.db2.gz	ZOWASQPGPIVREN-VQIMIIECSA-N	0	3	348.462	3.402	20	30		EGEDHN
Cc1nc(N2CCN[C@H](c3ccccc3)C2)c(C#N)c(C)c1Cl	ZINC001157758429	1381024873	/nfs/dbraw/zinc/02/48/73/1381024873.db2.gz	AHVAUWNPFIVAAF-INIZCTEOSA-N	0	3	326.831	3.374	20	30		EGEDHN
CC(C)C#CC(=O)N1CCCC[C@@H]1CN(C)CCc1ccccc1F	ZINC001157939709	1381076427	/nfs/dbraw/zinc/07/64/27/1381076427.db2.gz	KDDFSTVKNCKMNP-LJQANCHMSA-N	0	3	344.474	3.341	20	30		EGEDHN
CC#CCCCC(=O)N1CCCC[C@@H]1CN(C)CCc1ccns1	ZINC001158357578	1381215937	/nfs/dbraw/zinc/21/59/37/1381215937.db2.gz	JVBXQUBIQUWACY-QGZVFWFLSA-N	0	3	347.528	3.192	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)[C@H]1CCC(C)(C)C1	ZINC001158456811	1381250379	/nfs/dbraw/zinc/25/03/79/1381250379.db2.gz	CDTQEFNGVXWHFJ-ZWKOTPCHSA-N	0	3	336.520	3.328	20	30		EGEDHN
C[C@H]1CCC[C@@H]1CC(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001158619078	1381324460	/nfs/dbraw/zinc/32/44/60/1381324460.db2.gz	SIDOAPILYWFHAC-GOEBONIOSA-N	0	3	331.435	3.120	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1CCCC[C@@H]1CN(C)CC=C(C)C	ZINC001158794331	1381403053	/nfs/dbraw/zinc/40/30/53/1381403053.db2.gz	OINKGZNZZUBXCJ-OAQYLSRUSA-N	0	3	338.495	3.490	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H](C)c1cccc(OC)c1	ZINC001158914976	1381462871	/nfs/dbraw/zinc/46/28/71/1381462871.db2.gz	XKZQHWUAKGINSY-SJLPKXTDSA-N	0	3	330.472	3.298	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cccc2c1OCC2(C)C	ZINC001158966691	1381490926	/nfs/dbraw/zinc/49/09/26/1381490926.db2.gz	RIOSJFJNNBUMCD-MRXNPFEDSA-N	0	3	342.483	3.469	20	30		EGEDHN
Cc1ccc(C(=O)NCCC2=CCN(Cc3ccc(C#N)cc3)CC2)o1	ZINC001159156760	1381678803	/nfs/dbraw/zinc/67/88/03/1381678803.db2.gz	VKUAZNBGODQEIB-UHFFFAOYSA-N	0	3	349.434	3.412	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)NCCC1=CCN(Cc2ccc(C#N)cc2)CC1	ZINC001159827843	1381912598	/nfs/dbraw/zinc/91/25/98/1381912598.db2.gz	NUIUCGCASJKJGF-LJQANCHMSA-N	0	3	337.467	3.243	20	30		EGEDHN
C=C[C@@](C)(O)CC(=O)NCCC1=CCN(Cc2csc(C)c2)CC1	ZINC001159979282	1381956981	/nfs/dbraw/zinc/95/69/81/1381956981.db2.gz	LEMPBIHVXFYKOO-LJQANCHMSA-N	0	3	348.512	3.022	20	30		EGEDHN
CC(C)C#CC(=O)NCCC1=CCN(CCc2ccccc2F)CC1	ZINC001160054530	1381983130	/nfs/dbraw/zinc/98/31/30/1381983130.db2.gz	BJKJXZZPZSVJMM-UHFFFAOYSA-N	0	3	342.458	3.166	20	30		EGEDHN
C[Si](C)(C)C#Cc1ccnc(-n2nc(-c3ccncc3)cc2CN)c1	ZINC001160339948	1382077478	/nfs/dbraw/zinc/07/74/78/1382077478.db2.gz	YFXAEKXUZDBLOP-UHFFFAOYSA-N	0	3	347.498	3.017	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)COC/C=C/c2ccccc2)CC1	ZINC001160492667	1382121924	/nfs/dbraw/zinc/12/19/24/1382121924.db2.gz	YEDAWQOQIYMNGO-RMKNXTFCSA-N	0	3	340.467	3.041	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc(-n3cccc3)cc2)CC1	ZINC001160628046	1382155762	/nfs/dbraw/zinc/15/57/62/1382155762.db2.gz	HQTLZVAKHMEQBZ-UHFFFAOYSA-N	0	3	335.451	3.415	20	30		EGEDHN
N#Cc1ccc(CN2CC=C(CCNC(=O)CCC(F)F)CC2)cc1	ZINC001160682582	1382169860	/nfs/dbraw/zinc/16/98/60/1382169860.db2.gz	GGVMNNSGTCIXGH-UHFFFAOYSA-N	0	3	347.409	3.242	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2nc3ccccc3cc2C)CC1	ZINC001160714598	1382177230	/nfs/dbraw/zinc/17/72/30/1382177230.db2.gz	PGWAMXOFXWHKII-UHFFFAOYSA-N	0	3	335.451	3.481	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc3ccsc3[nH]2)CC1	ZINC001160828734	1382210880	/nfs/dbraw/zinc/21/08/80/1382210880.db2.gz	URLKDJUARAWIDO-UHFFFAOYSA-N	0	3	327.453	3.005	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cn(C)nc2C2CCCC2)CC1	ZINC001161181046	1382328811	/nfs/dbraw/zinc/32/88/11/1382328811.db2.gz	KLXQURABIKIFAH-UHFFFAOYSA-N	0	3	342.487	3.016	20	30		EGEDHN
COc1cccc(CN2CC[C@H](Nc3ccc(Cl)c(C#N)n3)C2)c1	ZINC001161188137	1382333348	/nfs/dbraw/zinc/33/33/48/1382333348.db2.gz	QDCSKEKKYNSVCY-AWEZNQCLSA-N	0	3	342.830	3.302	20	30		EGEDHN
COc1cccc(CN2CC[C@H](Nc3nc(C)ccc3CC#N)C2)c1	ZINC001161193079	1382336739	/nfs/dbraw/zinc/33/67/39/1382336739.db2.gz	QCDQKMZQXBZMJO-SFHVURJKSA-N	0	3	336.439	3.151	20	30		EGEDHN
C=C(Cl)CN1CC=C(CCNC(=O)c2cccc3nc[nH]c32)CC1	ZINC001161530445	1382431138	/nfs/dbraw/zinc/43/11/38/1382431138.db2.gz	AAMAMOHVWUMSNW-UHFFFAOYSA-N	0	3	344.846	3.067	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)Cc2cccc(OCCC)c2)CC1	ZINC001161668872	1382475708	/nfs/dbraw/zinc/47/57/08/1382475708.db2.gz	IVKWRHWQVCCQRP-UHFFFAOYSA-N	0	3	342.483	3.342	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)COC[C@@H](C)c2ccccc2)CC1	ZINC001161796489	1382508316	/nfs/dbraw/zinc/50/83/16/1382508316.db2.gz	KJPQQKHJXMRMAR-GOSISDBHSA-N	0	3	342.483	3.131	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc3c(c2)CCCC3)CC1	ZINC001161817915	1382518950	/nfs/dbraw/zinc/51/89/50/1382518950.db2.gz	HNXQALJADIDECG-UHFFFAOYSA-N	0	3	336.479	3.341	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CCCOc2ccc(C)cc2)CC1	ZINC001161818386	1382519856	/nfs/dbraw/zinc/51/98/56/1382519856.db2.gz	VOXLJXFAVWKZTF-UHFFFAOYSA-N	0	3	342.483	3.478	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H]2C[C@@H]2c2cc(F)ccc2F)CC1	ZINC001161904169	1382545276	/nfs/dbraw/zinc/54/52/76/1382545276.db2.gz	HTJHGONLXBGQOI-AEFFLSMTSA-N	0	3	346.421	3.393	20	30		EGEDHN
Cc1cc(C(=O)NCCCNCc2ccc(C#N)cc2F)c(C)s1	ZINC001161978460	1382585651	/nfs/dbraw/zinc/58/56/51/1382585651.db2.gz	RGEWBJNYEBHOHF-UHFFFAOYSA-N	0	3	345.443	3.285	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H](C)Cc2cccc(F)c2)CC1	ZINC001161982946	1382586925	/nfs/dbraw/zinc/58/69/25/1382586925.db2.gz	OMOSGBJOSFWBOV-KRWDZBQOSA-N	0	3	342.458	3.166	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1ccnc2ccccc21	ZINC001162012097	1382600679	/nfs/dbraw/zinc/60/06/79/1382600679.db2.gz	DAFDBIHKNVHFMV-UHFFFAOYSA-N	0	3	344.418	3.016	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)C1CCCCCCC1	ZINC001162257695	1382701188	/nfs/dbraw/zinc/70/11/88/1382701188.db2.gz	RLXDXXQJHLNUBW-UHFFFAOYSA-N	0	3	331.298	3.351	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)c1cccs1	ZINC001162682096	1382832144	/nfs/dbraw/zinc/83/21/44/1382832144.db2.gz	QDPSEDJKEQUSSN-UHFFFAOYSA-N	0	3	326.465	3.046	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)/C=C/C(C)(C)C	ZINC001162747014	1382856679	/nfs/dbraw/zinc/85/66/79/1382856679.db2.gz	LIFDQUUFLAFQOC-WYMLVPIESA-N	0	3	326.484	3.273	20	30		EGEDHN
CC(C)(C)C#CC(=O)N(CCNC/C=C\Cl)CCc1ccccc1	ZINC001162807037	1382879215	/nfs/dbraw/zinc/87/92/15/1382879215.db2.gz	SDCRCZFOZGMAKQ-QPEQYQDCSA-N	0	3	346.902	3.449	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N(CCNCCF)CCc1ccccc1	ZINC001162822369	1382886168	/nfs/dbraw/zinc/88/61/68/1382886168.db2.gz	MZYFFNIEBISPDY-UHFFFAOYSA-N	0	3	340.870	3.396	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C[C@H]1CC[C@H](C)C1	ZINC001162892108	1382906676	/nfs/dbraw/zinc/90/66/76/1382906676.db2.gz	HYCFFTAFQOMHHW-ICSRJNTNSA-N	0	3	326.484	3.107	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CCCC[C@H]1C	ZINC001162905869	1382911138	/nfs/dbraw/zinc/91/11/38/1382911138.db2.gz	AGDWYMOBMMGXEP-QUCCMNQESA-N	0	3	326.484	3.107	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@@]1(C)CCC[C@H]1C	ZINC001162918649	1382915983	/nfs/dbraw/zinc/91/59/83/1382915983.db2.gz	FWAQKQSTKJRDRG-NQIIRXRSSA-N	0	3	326.484	3.107	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1ccc2cc[nH]c2c1	ZINC001162946233	1382923525	/nfs/dbraw/zinc/92/35/25/1382923525.db2.gz	CFJRDDNRADGEIT-UHFFFAOYSA-N	0	3	345.446	3.076	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)c2ccccc2)CC1	ZINC001163196769	1382990075	/nfs/dbraw/zinc/99/00/75/1382990075.db2.gz	UWFDAZDMVUGXHM-UHFFFAOYSA-N	0	3	337.261	3.085	20	30		EGEDHN
N#Cc1c[nH]c2nc(Cl)cc(N[C@H]3CNCc4ccsc43)c12	ZINC001163221915	1382996703	/nfs/dbraw/zinc/99/67/03/1382996703.db2.gz	ZKBBPPXAHBMZSK-NSHDSACASA-N	0	3	329.816	3.406	20	30		EGEDHN
N#Cc1ccccc1CNCC1(CCNC(=O)[C@@H]2CC=CCC2)CC1	ZINC001163389300	1383039741	/nfs/dbraw/zinc/03/97/41/1383039741.db2.gz	QFCNRGCVYCRKJZ-QGZVFWFLSA-N	0	3	337.467	3.291	20	30		EGEDHN
Cc1ccc(F)cc1C(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001163514786	1383070403	/nfs/dbraw/zinc/07/04/03/1383070403.db2.gz	NBSMCTOVMHWNNE-UHFFFAOYSA-N	0	3	343.377	3.055	20	30		EGEDHN
C/C=C(/C)C(=O)NCCC1(CNCc2ccc(C#N)cc2F)CC1	ZINC001163991733	1383143659	/nfs/dbraw/zinc/14/36/59/1383143659.db2.gz	FJFHUPVFLGRWIR-BNNQUZSASA-N	0	3	329.419	3.040	20	30		EGEDHN
C#CCCCCC(=O)NCCC1(CNCc2nc(C)c(C)s2)CC1	ZINC001164166073	1383161780	/nfs/dbraw/zinc/16/17/80/1383161780.db2.gz	LXXAKUSLJCPJQM-UHFFFAOYSA-N	0	3	347.528	3.330	20	30		EGEDHN
CC(C)c1ccoc1C(=O)NCCCNCc1ccccc1C#N	ZINC001164491262	1383192755	/nfs/dbraw/zinc/19/27/55/1383192755.db2.gz	DDURGUZDKHLNRZ-UHFFFAOYSA-N	0	3	325.412	3.184	20	30		EGEDHN
N#Cc1cnc(Cl)cc1C(F)(F)N1CCN[C@@H](c2ccccc2)C1	ZINC001165195514	1383244672	/nfs/dbraw/zinc/24/46/72/1383244672.db2.gz	CLRZJIQXBQDAAH-OAHLLOKOSA-N	0	3	348.784	3.302	20	30		EGEDHN
C[C@H]1CCCC[C@H]1C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001165410517	1383289665	/nfs/dbraw/zinc/28/96/65/1383289665.db2.gz	QBSBFIOKNGNVLY-WMLDXEAASA-N	0	3	331.435	3.120	20	30		EGEDHN
C#CCC1(C(=O)NCCC2(CNCC=C(Cl)Cl)CC2)CCC1	ZINC001165430204	1383295160	/nfs/dbraw/zinc/29/51/60/1383295160.db2.gz	WUBMBUHQRAXYKO-UHFFFAOYSA-N	0	3	343.298	3.375	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@H]2CCC[C@H]2C(F)F)CC1	ZINC001165465083	1383298988	/nfs/dbraw/zinc/29/89/88/1383298988.db2.gz	SKPDWQMTAKHQEP-OLZOCXBDSA-N	0	3	334.838	3.296	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NCCC1(CNCC(=C)Cl)CC1	ZINC001165805585	1383347462	/nfs/dbraw/zinc/34/74/62/1383347462.db2.gz	RFXSFHLKIBDFPC-UHFFFAOYSA-N	0	3	348.874	3.494	20	30		EGEDHN
C=CCC1(C(=O)NCCCNCc2cc(C#N)ccc2F)CCC1	ZINC001165997710	1383375158	/nfs/dbraw/zinc/37/51/58/1383375158.db2.gz	ADSYRSRHRZBERU-UHFFFAOYSA-N	0	3	329.419	3.040	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCC1(CNCc2conc2CC)CC1	ZINC001166545346	1383436612	/nfs/dbraw/zinc/43/66/12/1383436612.db2.gz	LPSZUDYYVSUQSE-UHFFFAOYSA-N	0	3	333.476	3.215	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCC1(CNCc2cc(C3CC3)no2)CC1	ZINC001166704506	1383464449	/nfs/dbraw/zinc/46/44/49/1383464449.db2.gz	RCXHRWMZEQUUBW-CABCVRRESA-N	0	3	345.487	3.386	20	30		EGEDHN
CC#CCCCC(=O)NCCC1(CNCc2c(C)noc2CC)CC1	ZINC001166709908	1383464645	/nfs/dbraw/zinc/46/46/45/1383464645.db2.gz	IYHDQLBCKZPLCI-UHFFFAOYSA-N	0	3	345.487	3.115	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCCC1(CN[C@@H](C)c2cnc(C)cn2)CC1	ZINC001166755605	1383472471	/nfs/dbraw/zinc/47/24/71/1383472471.db2.gz	MFZOHSCIKPQBSH-WBVHZDCISA-N	0	3	344.503	3.324	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCC1(CNCc2ccc(F)cn2)CC1	ZINC001167025477	1383521859	/nfs/dbraw/zinc/52/18/59/1383521859.db2.gz	IAHWPLLBTSVXHA-SFHVURJKSA-N	0	3	333.451	3.199	20	30		EGEDHN
C=C1CCC(C(=O)NCCC2(CN[C@@H](C)c3cnccn3)CC2)CC1	ZINC001167026546	1383522448	/nfs/dbraw/zinc/52/24/48/1383522448.db2.gz	ZILLNFWDPKBFTJ-INIZCTEOSA-N	0	3	342.487	3.160	20	30		EGEDHN
C=C1CCC(C(=O)NCCC2(CN[C@H](C)c3cnccn3)CC2)CC1	ZINC001167026547	1383522653	/nfs/dbraw/zinc/52/26/53/1383522653.db2.gz	ZILLNFWDPKBFTJ-MRXNPFEDSA-N	0	3	342.487	3.160	20	30		EGEDHN
C=CCC1(C(=O)NCCC2(CNCc3cc(C)no3)CC2)CCC1	ZINC001167035706	1383524922	/nfs/dbraw/zinc/52/49/22/1383524922.db2.gz	MWUMYMUBTIFZHT-UHFFFAOYSA-N	0	3	331.460	3.106	20	30		EGEDHN
CCC1(C(=O)NCCC2(CNCc3cc(C#N)ccc3F)CC2)CC1	ZINC001167055761	1383529596	/nfs/dbraw/zinc/52/95/96/1383529596.db2.gz	AGSHHTNNTOBEKW-UHFFFAOYSA-N	0	3	343.446	3.264	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)C2(C)CC(=C)C2)CC1	ZINC001167130732	1383547588	/nfs/dbraw/zinc/54/75/88/1383547588.db2.gz	WRMIZKAHXPVLQQ-UHFFFAOYSA-N	0	3	341.293	3.127	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C[C@@H](C)c2cccnc2)CC1	ZINC001167381204	1383616590	/nfs/dbraw/zinc/61/65/90/1383616590.db2.gz	JBDPAXAYNDSINL-CQSZACIVSA-N	0	3	335.879	3.204	20	30		EGEDHN
C=CCc1cc(C)cnc1NCc1ccc(N2CCN(C)CC2)cc1	ZINC001167426214	1383631201	/nfs/dbraw/zinc/63/12/01/1383631201.db2.gz	BWDYCYLHWHCZDH-UHFFFAOYSA-N	0	3	336.483	3.482	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2sc(CC)nc2C)CC1	ZINC001167444244	1383635462	/nfs/dbraw/zinc/63/54/62/1383635462.db2.gz	WTOFEMKKSCETBC-UHFFFAOYSA-N	0	3	341.908	3.256	20	30		EGEDHN
C[C@H](Cc1cccs1)C(=O)NCCCNCc1ccccc1C#N	ZINC001167467478	1383641205	/nfs/dbraw/zinc/64/12/05/1383641205.db2.gz	HHMACNKBVQHGQB-OAHLLOKOSA-N	0	3	341.480	3.094	20	30		EGEDHN
C[C@@H](CC(C)(C)C)C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001167665051	1383705184	/nfs/dbraw/zinc/70/51/84/1383705184.db2.gz	XFPSOEQRIFLASG-AWEZNQCLSA-N	0	3	333.451	3.366	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cn(C(C)C)nc2C)CC1	ZINC001167719491	1383721488	/nfs/dbraw/zinc/72/14/88/1383721488.db2.gz	IYVAFYGZUNZCSD-UHFFFAOYSA-N	0	3	338.883	3.015	20	30		EGEDHN
C=CC1(CC(=O)NCCCN[C@@H](C)c2cnc(C)cn2)CCCCC1	ZINC001168182609	1383836471	/nfs/dbraw/zinc/83/64/71/1383836471.db2.gz	HQDNWIRGHUTEDU-KRWDZBQOSA-N	0	3	344.503	3.469	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)Cc2ccc(C)s2)CC1	ZINC001168312885	1383870691	/nfs/dbraw/zinc/87/06/91/1383870691.db2.gz	QQESPFUQCLSVKO-UHFFFAOYSA-N	0	3	326.893	3.228	20	30		EGEDHN
C/C(=N\[S@](=O)C(C)(C)C)c1ccc(-n2ccc([C@H](C)N)n2)cc1	ZINC001169236624	1384125737	/nfs/dbraw/zinc/12/57/37/1384125737.db2.gz	FMCYIAXZBUNYCP-VNXVNHDASA-N	0	3	332.473	3.163	20	30		EGEDHN
C=CCOc1ccccc1[C@H](C)N[C@H]1CC[C@@H](C(=O)OCC)OC1	ZINC001169347739	1384138995	/nfs/dbraw/zinc/13/89/95/1384138995.db2.gz	KPFXTJFKOJSDRW-MPGHIAIKSA-N	0	3	333.428	3.013	20	30		EGEDHN
CN(C)/C=N/c1ccc(N[C@@H]2CCc3ccccc3[C@@H]2O)cc1C#N	ZINC001169627464	1384166711	/nfs/dbraw/zinc/16/67/11/1384166711.db2.gz	IHKDZXIVEPHMLG-QBDXXSMVSA-N	0	3	334.423	3.240	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@@H]1CCCC[C@H]1CC	ZINC001169720869	1384178241	/nfs/dbraw/zinc/17/82/41/1384178241.db2.gz	WJUGNVSKCURBSJ-ZIAGYGMSSA-N	0	3	331.298	3.207	20	30		EGEDHN
CC[C@@H]1CCCC[C@H]1C(=O)NCCCNCc1ccccc1C#N	ZINC001169729620	1384179368	/nfs/dbraw/zinc/17/93/68/1384179368.db2.gz	NMTGVXKUHNGUBZ-VQIMIIECSA-N	0	3	327.472	3.371	20	30		EGEDHN
CC[C@@]1(C(C)C)C[C@H]1C(=O)NCCCNCc1ccccc1C#N	ZINC001169730408	1384179918	/nfs/dbraw/zinc/17/99/18/1384179918.db2.gz	SUKDXRQDDTZHHP-ICSRJNTNSA-N	0	3	327.472	3.226	20	30		EGEDHN
C[C@H](CCCCNC/C(Cl)=C/Cl)NC(=O)c1ccc(C#N)[nH]1	ZINC001170202044	1384262571	/nfs/dbraw/zinc/26/25/71/1384262571.db2.gz	QYLBEMIPLYIKME-HQQGHWSLSA-N	0	3	343.258	3.084	20	30		EGEDHN
CC[C@H](C)OCC(=O)N[C@@H](C)CCCCNCc1ccccc1C#N	ZINC001170233566	1384272594	/nfs/dbraw/zinc/27/25/94/1384272594.db2.gz	SNHHQXVVQGUZJS-IRXDYDNUSA-N	0	3	345.487	3.138	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H](C)CCCCNCc1ccn(C(C)C)n1	ZINC001170282986	1384281823	/nfs/dbraw/zinc/28/18/23/1384281823.db2.gz	QDGUCXDZHUIIJQ-SFHVURJKSA-N	0	3	346.519	3.422	20	30		EGEDHN
COc1ccc(C[C@@H](C)N2[C@@H]3CC[C@H]2C[C@H](C#N)C3)c([N+](=O)[O-])c1	ZINC001170350877	1384298065	/nfs/dbraw/zinc/29/80/65/1384298065.db2.gz	CKSAFWQXOQJBJL-XOUADPBQSA-N	0	3	329.400	3.301	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H](C)CCCCNCc1cnns1	ZINC001170964248	1384419814	/nfs/dbraw/zinc/41/98/14/1384419814.db2.gz	ZGWMFZFDDLNMHQ-AWEZNQCLSA-N	0	3	336.505	3.071	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H](C)CCCCNCc1nnc(C(C)C)[nH]1	ZINC001171043977	1384435878	/nfs/dbraw/zinc/43/58/78/1384435878.db2.gz	SPXGBNRYIBFDMB-HNNXBMFYSA-N	0	3	335.496	3.049	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1CC[C@@H](F)[C@](O)(C(F)(F)F)CC1	ZINC001171210750	1384469392	/nfs/dbraw/zinc/46/93/92/1384469392.db2.gz	WEEQGHVPRRDTAS-WQVCFCJDSA-N	0	3	344.352	3.217	20	30		EGEDHN
C[C@@H](Cc1cccc(C#N)c1)N1CCN2CCc3ccccc3[C@H]2C1	ZINC001171227838	1384474212	/nfs/dbraw/zinc/47/42/12/1384474212.db2.gz	AYPMZWNCKTYRMF-HTAPYJJXSA-N	0	3	331.463	3.404	20	30		EGEDHN
C[C@H](Cc1cccc(C#N)c1)N1CC[C@H](N2CCCCC2)[C@@H](F)C1	ZINC001171234665	1384475888	/nfs/dbraw/zinc/47/58/88/1384475888.db2.gz	XPRZAYDYMDJBKF-UXPWSPDFSA-N	0	3	329.463	3.388	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)CC[C@H](C)CC)C1	ZINC001316621382	1384486984	/nfs/dbraw/zinc/48/69/84/1384486984.db2.gz	DVHWKMKYZCATCH-BNOWGMLFSA-N	0	3	331.298	3.206	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)C[C@H]2CCc3ccccc32)C1	ZINC001316621205	1384487187	/nfs/dbraw/zinc/48/71/87/1384487187.db2.gz	CSFNHHZDNFIAML-OIISXLGYSA-N	0	3	332.875	3.343	20	30		EGEDHN
N#Cc1cccc(N2CCN([C@@H]3CCc4c(F)cccc4C3)CC2)c1	ZINC001171443090	1384524952	/nfs/dbraw/zinc/52/49/52/1384524952.db2.gz	WKPDCUJMGJJMOY-LJQANCHMSA-N	0	3	335.426	3.377	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1cnn(C(C)C)c1	ZINC001316878611	1384663333	/nfs/dbraw/zinc/66/33/33/1384663333.db2.gz	HXOKIHWKLYJUCN-GDBMZVCRSA-N	0	3	338.883	3.189	20	30		EGEDHN
CN1[C@@H]2CCC[C@H]1C[C@@H](NC1=C(Cl)C(=O)c3ccccc3C1=O)C2	ZINC001172106863	1384728483	/nfs/dbraw/zinc/72/84/83/1384728483.db2.gz	QLZMEVJSIMKUKS-CLLJXQQHSA-N	0	3	344.842	3.121	20	30		EGEDHN
C[C@@H](CCCC#N)N1CCC(c2cccc(S(C)(=O)=O)c2)CC1	ZINC001172510209	1384807546	/nfs/dbraw/zinc/80/75/46/1384807546.db2.gz	XJGUXHCCVMUUKY-HNNXBMFYSA-N	0	3	334.485	3.352	20	30		EGEDHN
C[C@H]([NH2+][C@H]1CCN(C(=O)OC(C)(C)C)[C@H](C#N)C1)c1ccccc1[O-]	ZINC001172976746	1384894720	/nfs/dbraw/zinc/89/47/20/1384894720.db2.gz	TWRMYAMGFQLNCE-KKUMJFAQSA-N	0	3	345.443	3.334	20	30		EGEDHN
CCCCCCCCC[C@H](CCC)N1CC(N2CCNC(=O)C2)C1	ZINC001173285118	1384952452	/nfs/dbraw/zinc/95/24/52/1384952452.db2.gz	NQXXOLIBHJLXJP-SFHVURJKSA-N	0	3	337.552	3.412	20	30		EGEDHN
Cc1cnccc1Nc1ccc(CC#N)cc1I	ZINC001174538318	1385117603	/nfs/dbraw/zinc/11/76/03/1385117603.db2.gz	FDXOYNNKYFMPHY-UHFFFAOYSA-N	0	3	349.175	3.226	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H](C)CCCCNCc2cnc(C)o2)cc1	ZINC001174641345	1385129020	/nfs/dbraw/zinc/12/90/20/1385129020.db2.gz	APFXRQUEMDDWFB-HNNXBMFYSA-N	0	3	339.439	3.043	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1sccc1C(F)F	ZINC001174886248	1385165402	/nfs/dbraw/zinc/16/54/02/1385165402.db2.gz	UQCAFRUIEJAYEG-UHFFFAOYSA-N	0	3	349.406	3.467	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H](C)CCCCNCc1nccn1CC	ZINC001175083135	1385191955	/nfs/dbraw/zinc/19/19/55/1385191955.db2.gz	WFEMVYYVWAVKLT-LPHOPBHVSA-N	0	3	334.508	3.270	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N[C@@H](C)CCCCNC/C(Cl)=C/Cl	ZINC001176802031	1385706127	/nfs/dbraw/zinc/70/61/27/1385706127.db2.gz	WPTTYWSHDLOFKP-UDVMBWJESA-N	0	3	337.291	3.161	20	30		EGEDHN
C=CCCC(=O)N(CCCNCc1ocnc1C)CC1CCCC1	ZINC001177245825	1385882847	/nfs/dbraw/zinc/88/28/47/1385882847.db2.gz	KTSNGQKNOJGIJS-UHFFFAOYSA-N	0	3	333.476	3.448	20	30		EGEDHN
CC(C)(C)C1CC(C(=O)NCCCNCc2cc(C#N)ccc2F)C1	ZINC001177251281	1385884755	/nfs/dbraw/zinc/88/47/55/1385884755.db2.gz	GMUNBNKGMNNNIW-UHFFFAOYSA-N	0	3	345.462	3.366	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@H]1CC[C@H](NCc2nc(C(C)(C)C)cs2)CC1	ZINC001318948140	1385892586	/nfs/dbraw/zinc/89/25/86/1385892586.db2.gz	OEAGNZSPRXYBFT-MGPQQGTHSA-N	0	3	348.516	3.117	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)c1ccn(C)c1	ZINC001177282807	1385897607	/nfs/dbraw/zinc/89/76/07/1385897607.db2.gz	ZBHVBWFFOLNIOQ-UHFFFAOYSA-N	0	3	337.895	3.390	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@@H](OC)C1CC1	ZINC001177304909	1385904557	/nfs/dbraw/zinc/90/45/57/1385904557.db2.gz	OLQUTCOEGNMZSU-KRWDZBQOSA-N	0	3	342.911	3.162	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1CCC[C@@H]1CNCc1cc(C#N)ccc1OC	ZINC001319057518	1385948753	/nfs/dbraw/zinc/94/87/53/1385948753.db2.gz	KEQCUAOKBMJSDJ-CRAIPNDOSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)C1(C(F)(F)F)CCCCC1	ZINC001177455370	1385961460	/nfs/dbraw/zinc/96/14/60/1385961460.db2.gz	YHBUECPCUODUIP-UHFFFAOYSA-N	0	3	326.790	3.348	20	30		EGEDHN
C=CCC[C@H](C(=O)NCCCNCc1conc1C)c1ccccc1	ZINC001177552885	1385994770	/nfs/dbraw/zinc/99/47/70/1385994770.db2.gz	QSDPFYFYPXKSQV-IBGZPJMESA-N	0	3	341.455	3.329	20	30		EGEDHN
Cc1ccccc1C(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C	ZINC001178042103	1386113879	/nfs/dbraw/zinc/11/38/79/1386113879.db2.gz	RXFNRTLZXMXARG-RXVVDRJESA-N	0	3	332.447	3.239	20	30		EGEDHN
CCCCCC(=O)N1CC[C@H](NCc2cc(C#N)ccc2OC)[C@@H]1C	ZINC001178116084	1386133784	/nfs/dbraw/zinc/13/37/84/1386133784.db2.gz	GXQJWRANYJCVNM-YJBOKZPZSA-N	0	3	343.471	3.226	20	30		EGEDHN
CC[C@@H](C)CC(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)[C@@H]1C	ZINC001178567207	1386250888	/nfs/dbraw/zinc/25/08/88/1386250888.db2.gz	NEYPFBVKACZOIC-GLJUWKHASA-N	0	3	331.435	3.213	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCCCCCNCc1cc2n(n1)CCC2	ZINC001178580239	1386254740	/nfs/dbraw/zinc/25/47/40/1386254740.db2.gz	RSDRZERMBLGULV-UHFFFAOYSA-N	0	3	346.519	3.198	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCCCCCN[C@@H](C)c1nnc(C)[nH]1	ZINC001178580316	1386254815	/nfs/dbraw/zinc/25/48/15/1386254815.db2.gz	WOGAAHJYQVFZDT-AWEZNQCLSA-N	0	3	335.496	3.043	20	30		EGEDHN
C#CCCCNC(=O)C1CN(C(c2ccccc2)c2ccccc2)C1	ZINC001178591046	1386257133	/nfs/dbraw/zinc/25/71/33/1386257133.db2.gz	NCXSOIYHRLYEDX-UHFFFAOYSA-N	0	3	332.447	3.237	20	30		EGEDHN
COc1ccc(C)cc1CN[C@H]1CCN(C(=O)C#CC(C)(C)C)[C@H]1C	ZINC001178675422	1386275025	/nfs/dbraw/zinc/27/50/25/1386275025.db2.gz	PCNAQKCGUOGMKZ-WMZOPIPTSA-N	0	3	342.483	3.132	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](NCc2cnn(C(C)(C)C)c2)[C@@H]1C	ZINC001178795376	1386307533	/nfs/dbraw/zinc/30/75/33/1386307533.db2.gz	OAEOJDSICVXQBY-RDJZCZTQSA-N	0	3	346.519	3.319	20	30		EGEDHN
C[C@@](CNCC#Cc1ccc(F)cc1)(NC(=O)[C@H]1CC1(C)C)C1CC1	ZINC001698642395	1406290346	/nfs/dbraw/zinc/29/03/46/1406290346.db2.gz	NCFMRUBQWGKLKN-NQIIRXRSSA-N	0	3	342.458	3.098	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCCCCCNCc1nnc(C(C)C)[nH]1	ZINC001179306622	1386445166	/nfs/dbraw/zinc/44/51/66/1386445166.db2.gz	JKIAOBBYXUNXCQ-JKSUJKDBSA-N	0	3	349.523	3.153	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCCCCCNCc1nnc(C(C)C)[nH]1	ZINC001179306620	1386445261	/nfs/dbraw/zinc/44/52/61/1386445261.db2.gz	JKIAOBBYXUNXCQ-HOTGVXAUSA-N	0	3	349.523	3.153	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCCCCCNCc1cn(C(C)C)nn1	ZINC001179306751	1386445842	/nfs/dbraw/zinc/44/58/42/1386445842.db2.gz	LLTOSCPCHWCNJU-DLBZAZTESA-N	0	3	349.523	3.083	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](NCc2cc(C)ns2)[C@@H]1C	ZINC001179313575	1386448309	/nfs/dbraw/zinc/44/83/09/1386448309.db2.gz	GHUFXDLZQAPLNK-RDJZCZTQSA-N	0	3	333.501	3.114	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](NCc2ccc(Cl)nc2)[C@@H]1C	ZINC001179313778	1386448491	/nfs/dbraw/zinc/44/84/91/1386448491.db2.gz	KPQXLEVVROIPSM-RDJZCZTQSA-N	0	3	347.890	3.398	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](NCc2cccc(Cl)n2)[C@@H]1C	ZINC001179360262	1386462532	/nfs/dbraw/zinc/46/25/32/1386462532.db2.gz	QPUDHMOVAGDAEU-HOCLYGCPSA-N	0	3	333.863	3.008	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](NCc2c(C)nsc2C)[C@@H]1C	ZINC001179381315	1386468149	/nfs/dbraw/zinc/46/81/49/1386468149.db2.gz	YMDYXAGNIKVDHN-JDFRZJQESA-N	0	3	335.517	3.441	20	30		EGEDHN
N#Cc1ccccc1CNCCCCCCNC(=O)[C@H]1CC[C@@H](F)C1	ZINC001179388043	1386470794	/nfs/dbraw/zinc/47/07/94/1386470794.db2.gz	LJOLUIOHSWXMLX-QFBILLFUSA-N	0	3	345.462	3.463	20	30		EGEDHN
CC(C#N)C(=O)N1CCN=C1CN(Cc1ccccc1)c1ccccc1	ZINC001179901385	1386622671	/nfs/dbraw/zinc/62/26/71/1386622671.db2.gz	LQUMXAYLJQWAFC-QGZVFWFLSA-N	0	3	346.434	3.094	20	30		EGEDHN
C=CCCOCC(=O)N1CC[C@H](NCc2ccccc2Cl)[C@@H]1C	ZINC001180260208	1386749183	/nfs/dbraw/zinc/74/91/83/1386749183.db2.gz	BDTRSARCLOWHCY-YOEHRIQHSA-N	0	3	336.863	3.012	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)Cn1ccc2ccc(Cl)cc21	ZINC001180974555	1386912003	/nfs/dbraw/zinc/91/20/03/1386912003.db2.gz	RFOBWMYIMSTLES-INIZCTEOSA-N	0	3	331.847	3.061	20	30		EGEDHN
C[C@H](CNCc1ccc(F)c(C#N)c1)NC(=O)C1=CCCCCC1	ZINC001321501515	1386918346	/nfs/dbraw/zinc/91/83/46/1386918346.db2.gz	QCAAREKUOZDQNP-CQSZACIVSA-N	0	3	329.419	3.182	20	30		EGEDHN
N#Cc1ccccc1CC(=O)NC[C@H](c1ccccc1)N1CCCC1	ZINC001181804437	1387057498	/nfs/dbraw/zinc/05/74/98/1387057498.db2.gz	OJGDTXDUUTYMLF-HXUWFJFHSA-N	0	3	333.435	3.054	20	30		EGEDHN
N#Cc1ccccc1CC(=O)NC[C@@H](c1ccccc1)N1CCCC1	ZINC001181804436	1387057654	/nfs/dbraw/zinc/05/76/54/1387057654.db2.gz	OJGDTXDUUTYMLF-FQEVSTJZSA-N	0	3	333.435	3.054	20	30		EGEDHN
C=CCOCCCC(=O)N1CC[C@@H](N[C@H](C)c2ccccc2F)C1	ZINC001181831409	1387062660	/nfs/dbraw/zinc/06/26/60/1387062660.db2.gz	BCSRIGNFMMSJFU-HZPDHXFCSA-N	0	3	334.435	3.060	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@@H](C)[C@](C)(CNCc2cc(C)no2)C1	ZINC001182305781	1387143594	/nfs/dbraw/zinc/14/35/94/1387143594.db2.gz	OURBVWLURNPPJF-SIXWZSSISA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@@H](C)[C@](C)(CNCc2ocnc2C)C1	ZINC001182313321	1387145270	/nfs/dbraw/zinc/14/52/70/1387145270.db2.gz	BRBJAKCASNOZQK-SIXWZSSISA-N	0	3	333.476	3.160	20	30		EGEDHN
N#Cc1cccc(CCC(=O)N2CCN(CC3CCCCC3)CC2)c1	ZINC001182336608	1387151636	/nfs/dbraw/zinc/15/16/36/1387151636.db2.gz	HMKOTVPUSZNJAB-UHFFFAOYSA-N	0	3	339.483	3.215	20	30		EGEDHN
C[C@H](NC(=O)c1ccc(C#N)cc1F)[C@@H](c1ccccc1)N(C)C	ZINC001336444825	1389101092	/nfs/dbraw/zinc/10/10/92/1389101092.db2.gz	RXYUMSPXONPGNL-UGSOOPFHSA-N	0	3	325.387	3.119	20	30		EGEDHN
C[C@@H](CNC(=O)C1C(C)(C)C1(C)C)N(C)Cc1ccc(C#N)cc1	ZINC001329414467	1389103201	/nfs/dbraw/zinc/10/32/01/1389103201.db2.gz	ZRDKLEZVNZOBKN-AWEZNQCLSA-N	0	3	327.472	3.177	20	30		EGEDHN
C[C@H](N[C@H]1CCC[C@H](C#N)C1)C(=O)Nc1cccc(N2CCCC2)c1	ZINC001331567094	1389804897	/nfs/dbraw/zinc/80/48/97/1389804897.db2.gz	UUZGWCUGJUUFBF-ULQDDVLXSA-N	0	3	340.471	3.286	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N1CCO[C@@H](c2ccc(F)c(Cl)c2)C1	ZINC001339899130	1390184928	/nfs/dbraw/zinc/18/49/28/1390184928.db2.gz	NSDVMMYPXXBIHX-HZPDHXFCSA-N	0	3	340.826	3.063	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N1CCC(Nc2ccccc2Cl)CC1	ZINC001340198066	1390247594	/nfs/dbraw/zinc/24/75/94/1390247594.db2.gz	AFZIYCFFHMUNIU-MRXNPFEDSA-N	0	3	335.879	3.427	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N1CCC[C@H](c2nc3c(s2)CCCC3)C1	ZINC001341029209	1390428240	/nfs/dbraw/zinc/42/82/40/1390428240.db2.gz	DZXAKQQSPUONFW-LSDHHAIUSA-N	0	3	347.528	3.412	20	30		EGEDHN
C[C@@H](NC(=O)[C@H](N)CCCC#N)c1cc(Cl)cc(Cl)c1F	ZINC001341162335	1390450489	/nfs/dbraw/zinc/45/04/89/1390450489.db2.gz	PHWBRTBSIMYUQB-PRHODGIISA-N	0	3	332.206	3.331	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N1CC[C@@H](CC(C)C)C1	ZINC001342020797	1390562722	/nfs/dbraw/zinc/56/27/22/1390562722.db2.gz	QKRWIWNDDKGSNW-IRXDYDNUSA-N	0	3	331.508	3.146	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N1CCCC(C)(C)CC1	ZINC001342026604	1390563108	/nfs/dbraw/zinc/56/31/08/1390563108.db2.gz	OTKYDAYXYRZSNA-INIZCTEOSA-N	0	3	331.508	3.290	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CCCN(C)C2)nnc1N1CCC(C)(C)CC1	ZINC001343006810	1390683330	/nfs/dbraw/zinc/68/33/30/1390683330.db2.gz	GMPGPHLFIIYMAA-INIZCTEOSA-N	0	3	331.508	3.290	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N(C)Cc1ccc(F)cc1Br	ZINC001343647397	1390728738	/nfs/dbraw/zinc/72/87/38/1390728738.db2.gz	IQDAOGMZKMBVED-AWEZNQCLSA-N	0	3	343.240	3.230	20	30		EGEDHN
C=C(C)Cn1c([C@H](C)SC)nnc1N1CCN(CC(C)C)CC1	ZINC001343668767	1390729874	/nfs/dbraw/zinc/72/98/74/1390729874.db2.gz	LJESLGWWHLCZNT-HNNXBMFYSA-N	0	3	337.537	3.056	20	30		EGEDHN
CC(C)Cn1cccc(C(=O)C(C#N)c2nc(C3CC3)cs2)c1=O	ZINC001343757174	1390735367	/nfs/dbraw/zinc/73/53/67/1390735367.db2.gz	XLHRLPNPDGJMGV-AWEZNQCLSA-N	0	3	341.436	3.328	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(Cc3cccn3C3CC3)CC2)cc1	ZINC001347781307	1391123810	/nfs/dbraw/zinc/12/38/10/1391123810.db2.gz	AQKFYUUFINCDJR-UHFFFAOYSA-N	0	3	334.467	3.403	20	30		EGEDHN
Cc1ccc2c(c1)[C@H]1CN(C)CC[C@@H]1N2C(=O)c1csc(C#N)c1	ZINC001348324266	1391206121	/nfs/dbraw/zinc/20/61/21/1391206121.db2.gz	FPFWMQPVDKQGPK-AEFFLSMTSA-N	0	3	337.448	3.376	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)[C@](C)(F)CCCC)C1	ZINC001479377418	1392228600	/nfs/dbraw/zinc/22/86/00/1392228600.db2.gz	MXNOVJLXSAOWDU-UMVBOHGHSA-N	0	3	349.288	3.298	20	30		EGEDHN
C=C(Br)CN[C@@H](C)[C@H]1CCCCN1C(=O)C1=CCCC1	ZINC001479819419	1392410416	/nfs/dbraw/zinc/41/04/16/1392410416.db2.gz	BKAMSELSKIVITF-DZGCQCFKSA-N	0	3	341.293	3.365	20	30		EGEDHN
CCCCCCCN1CCC[C@@H](NC(=O)c2cc(OC)ccn2)C1	ZINC001479907488	1392474390	/nfs/dbraw/zinc/47/43/90/1392474390.db2.gz	AWTAJRSIFKZYHZ-MRXNPFEDSA-N	0	3	333.476	3.255	20	30		EGEDHN
N#Cc1ccc(CN[C@H](CNC(=O)c2cccs2)C2CC2)c(F)c1	ZINC001479999989	1392529990	/nfs/dbraw/zinc/52/99/90/1392529990.db2.gz	NZUJUXGPKFBHDO-MRXNPFEDSA-N	0	3	343.427	3.057	20	30		EGEDHN
Cc1cc(C)c(C(=O)NC[C@H](C)NCc2ccc(C#N)s2)c(C)c1	ZINC001480586325	1392806519	/nfs/dbraw/zinc/80/65/19/1392806519.db2.gz	VXWIVVYYHAWNQQ-HNNXBMFYSA-N	0	3	341.480	3.453	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccc2c(c1)CCC2)NCc1ccc(C#N)s1	ZINC001480588345	1392807521	/nfs/dbraw/zinc/80/75/21/1392807521.db2.gz	OBXKJJRTCGUHDK-ZDUSSCGKSA-N	0	3	339.464	3.017	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](CCNC(=O)C3(F)CCCC3)C2)s1	ZINC001481437657	1394291750	/nfs/dbraw/zinc/29/17/50/1394291750.db2.gz	WZYXZZNMVLXOEV-CQSZACIVSA-N	0	3	349.475	3.230	20	30		EGEDHN
CC[C@H](CNC(=O)c1ccc(Cl)o1)NCc1ccc(C#N)s1	ZINC001481789373	1394530504	/nfs/dbraw/zinc/53/05/04/1394530504.db2.gz	YBLVELQWNZVQCD-SNVBAGLBSA-N	0	3	337.832	3.164	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2coc(C)n2)CCCC[C@@H]1C	ZINC001481957592	1394619501	/nfs/dbraw/zinc/61/95/01/1394619501.db2.gz	QQUQCJJODFGBCH-ZBEGNZNMSA-N	0	3	325.840	3.004	20	30		EGEDHN
CCC(=O)N[C@@H](CNCc1ccc(C#N)cc1F)C1CCCCC1	ZINC001482402000	1394963870	/nfs/dbraw/zinc/96/38/70/1394963870.db2.gz	HXFMXCXOODJRJJ-SFHVURJKSA-N	0	3	331.435	3.262	20	30		EGEDHN
Cc1ccc(F)c(C(=O)NC[C@H](C)N(C)Cc2ccc(C#N)cc2)c1	ZINC001485357289	1395830186	/nfs/dbraw/zinc/83/01/86/1395830186.db2.gz	NBTOKWHYKBMTQW-HNNXBMFYSA-N	0	3	339.414	3.256	20	30		EGEDHN
Cc1csc(C(=O)NCC[C@H](C)NCc2cc(C#N)ccc2F)c1	ZINC001503188846	1396246431	/nfs/dbraw/zinc/24/64/31/1396246431.db2.gz	DKJOPLLSPRDAKW-ZDUSSCGKSA-N	0	3	345.443	3.366	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)CCc2ccccn2)CC1	ZINC001505398628	1396286574	/nfs/dbraw/zinc/28/65/74/1396286574.db2.gz	PECYTEFHGMKUQQ-UHFFFAOYSA-N	0	3	349.906	3.327	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cn(C)c2ccccc12)C(C)C	ZINC001496577357	1396717470	/nfs/dbraw/zinc/71/74/70/1396717470.db2.gz	DERCDFWOWGGQML-INIZCTEOSA-N	0	3	333.863	3.275	20	30		EGEDHN
CC(F)(F)CC(=O)N[C@@H]1CC12CCN(Cc1cccc(C#N)c1)CC2	ZINC001690126635	1404319951	/nfs/dbraw/zinc/31/99/51/1404319951.db2.gz	SIAUDBPNPMDHGC-MRXNPFEDSA-N	0	3	347.409	3.074	20	30		EGEDHN
O=C([C@@H]1CC12CCC2)N1CCCC[C@@H]1CNCC#Cc1ccccc1	ZINC001690480045	1404599805	/nfs/dbraw/zinc/59/98/05/1404599805.db2.gz	FHDDHQFVNAVLIS-UXHICEINSA-N	0	3	336.479	3.199	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@H](c2cccnc2)C(C)C)C1	ZINC001691749286	1405468596	/nfs/dbraw/zinc/46/85/96/1405468596.db2.gz	RNGMAJRBUXFSOZ-UAGQMJEPSA-N	0	3	335.879	3.058	20	30		EGEDHN
CC(C)CCC(=O)N1C[C@H]2CCN(Cc3ccc(C#N)cc3)C[C@H]2C1	ZINC001692248512	1405872430	/nfs/dbraw/zinc/87/24/30/1405872430.db2.gz	SAOBEZJMBQEWHW-UXHICEINSA-N	0	3	339.483	3.275	20	30		EGEDHN
CCC1(C(=O)NCC[C@H]2CCN(Cc3ccccc3C#N)C2)CC1	ZINC001732052045	1428292605	/nfs/dbraw/zinc/29/26/05/1428292605.db2.gz	CIUXAHQYTINLMZ-INIZCTEOSA-N	0	3	325.456	3.077	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](N(CCC)C(=O)CN(C)CC(C)(C)C)C1	ZINC001732070198	1428317886	/nfs/dbraw/zinc/31/78/86/1428317886.db2.gz	CNTKEBQJZBBTGO-INIZCTEOSA-N	0	3	343.943	3.030	20	30		EGEDHN
N#Cc1ccc(F)c(CNCC2(NC(=O)c3ccoc3)CCCC2)c1	ZINC001732225488	1428473927	/nfs/dbraw/zinc/47/39/27/1428473927.db2.gz	PAMFYLPJRKTCRB-UHFFFAOYSA-N	0	3	341.386	3.123	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2nc(Cl)cs2)CCCC1	ZINC001732233761	1428480276	/nfs/dbraw/zinc/48/02/76/1428480276.db2.gz	ZKZNEFCHESIXHT-UHFFFAOYSA-N	0	3	334.272	3.181	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1cc(-c2ccco2)on1)C1CC1	ZINC001732245905	1428489914	/nfs/dbraw/zinc/48/99/14/1428489914.db2.gz	UJCVUSMMGJIWQB-KRWDZBQOSA-N	0	3	349.818	3.175	20	30		EGEDHN
C[C@@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)CC(C)(C)C1CC1	ZINC001732414991	1428572170	/nfs/dbraw/zinc/57/21/70/1428572170.db2.gz	CHLAUCVGDLHJKX-AWEZNQCLSA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)N(C)C(=O)c1cc(F)ccc1F	ZINC001732424563	1428575640	/nfs/dbraw/zinc/57/56/40/1428575640.db2.gz	FKARMPOZPQLEBO-LLVKDONJSA-N	0	3	349.406	3.148	20	30		EGEDHN
Cc1cccc(C(=O)N[C@H](C)CN(C)Cc2ccc(C#N)cc2)c1F	ZINC001699441953	1412770776	/nfs/dbraw/zinc/77/07/76/1412770776.db2.gz	NCBXTACYHDWFPO-OAHLLOKOSA-N	0	3	339.414	3.256	20	30		EGEDHN
CCc1ccc(C(=O)N[C@H](C)CN(C)Cc2cccc(C#N)c2)s1	ZINC001699457487	1412804222	/nfs/dbraw/zinc/80/42/22/1412804222.db2.gz	NUVUUNVJINBAGV-CQSZACIVSA-N	0	3	341.480	3.432	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)CC(C1CC1)C1CC1	ZINC001699474700	1412864634	/nfs/dbraw/zinc/86/46/34/1412864634.db2.gz	UCYHGNBPEZGTSJ-HNNXBMFYSA-N	0	3	339.483	3.321	20	30		EGEDHN
Cc1cc(C)c(C(=O)N[C@@H](CNCc2ccc(C#N)s2)C2CC2)o1	ZINC001699586726	1412944082	/nfs/dbraw/zinc/94/40/82/1412944082.db2.gz	XHHSWFOQJVTVAB-INIZCTEOSA-N	0	3	343.452	3.128	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)c3cc4ccccc4[nH]3)CC2)cc1	ZINC001699672497	1413063368	/nfs/dbraw/zinc/06/33/68/1413063368.db2.gz	ZXOFVHMWTVKDPJ-UHFFFAOYSA-N	0	3	344.418	3.092	20	30		EGEDHN
CCC(C)(C)C(=O)N[C@H]1CCN(Cc2cccc(C#N)c2)[C@@H](C)C1	ZINC001700317233	1413778123	/nfs/dbraw/zinc/77/81/23/1413778123.db2.gz	FJBKQUHAWFJWKU-YJBOKZPZSA-N	0	3	327.472	3.464	20	30		EGEDHN
C[C@H](CNC(=O)c1cc(C#N)c[nH]1)N(C)[C@H](C)c1cccc(Cl)c1	ZINC001700454447	1414041729	/nfs/dbraw/zinc/04/17/29/1414041729.db2.gz	HBHCTZAEYRDZRX-CHWSQXEVSA-N	0	3	344.846	3.351	20	30		EGEDHN
CC(C)(C)[C@H](CNCc1cc(C#N)ccc1F)NC(=O)CCCF	ZINC001700993512	1414639380	/nfs/dbraw/zinc/63/93/80/1414639380.db2.gz	IMQCCQZWWCJDLZ-INIZCTEOSA-N	0	3	337.414	3.068	20	30		EGEDHN
CCC(=O)NCc1ccc(CNCc2ccc(C#N)cc2)cc1F	ZINC001701063899	1414721754	/nfs/dbraw/zinc/72/17/54/1414721754.db2.gz	AOXYDSATTZPDGV-UHFFFAOYSA-N	0	3	325.387	3.013	20	30		EGEDHN
CC(F)(F)CCC(=O)N[C@H]1CCC[C@H]1CNCc1ccccc1C#N	ZINC001732617249	1428880087	/nfs/dbraw/zinc/88/00/87/1428880087.db2.gz	CXRIWVNIKFYNDG-IRXDYDNUSA-N	0	3	349.425	3.368	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1ccccc1OC	ZINC001707439029	1417342821	/nfs/dbraw/zinc/34/28/21/1417342821.db2.gz	CCEHTLXDFLRMFU-GDBMZVCRSA-N	0	3	336.863	3.421	20	30		EGEDHN
CC(C)(C)CC(=O)NC[C@@H](NCc1ccc(C#N)cc1F)C1CC1	ZINC001713105052	1417664084	/nfs/dbraw/zinc/66/40/84/1417664084.db2.gz	KFULVSDRAPDERC-QGZVFWFLSA-N	0	3	331.435	3.118	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@H](CNC(=O)CCCC3CC3)C2)c1	ZINC001713217808	1417796971	/nfs/dbraw/zinc/79/69/71/1417796971.db2.gz	JCAXEHDSCWVQSY-HXUWFJFHSA-N	0	3	339.483	3.467	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(OCC#N)cc1)NC(=O)C1CCCCC1	ZINC001733065610	1429218780	/nfs/dbraw/zinc/21/87/80/1429218780.db2.gz	XLYPDOHLHHPFEO-MRXNPFEDSA-N	0	3	343.471	3.106	20	30		EGEDHN
CCCN(CCNC(=O)CC1CC(F)(F)C1)Cc1ccc(C#N)cc1	ZINC001713547597	1418321100	/nfs/dbraw/zinc/32/11/00/1418321100.db2.gz	CUMQLFVGMZMHFI-UHFFFAOYSA-N	0	3	349.425	3.322	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](CCNC(=O)C3CC4(CC4)C3)C2)s1	ZINC001713736903	1418532784	/nfs/dbraw/zinc/53/27/84/1418532784.db2.gz	UNRICXDMLFVNHP-CQSZACIVSA-N	0	3	343.496	3.138	20	30		EGEDHN
CCc1ccccc1CC(=O)NC[C@@H](C)NCc1ccc(C#N)s1	ZINC001714246947	1419033597	/nfs/dbraw/zinc/03/35/97/1419033597.db2.gz	NAQJSUDONXUXSA-CQSZACIVSA-N	0	3	341.480	3.019	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@H](C)CNCc2ccccc2C#N)c(F)c1	ZINC001714428064	1419161553	/nfs/dbraw/zinc/16/15/53/1419161553.db2.gz	CIUQXZMCWQTUQU-OAHLLOKOSA-N	0	3	339.414	3.162	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1ccc(Cl)c(OC)c1	ZINC001714490936	1419214360	/nfs/dbraw/zinc/21/43/60/1419214360.db2.gz	QDXAPNYRHBEYAB-LLVKDONJSA-N	0	3	331.243	3.199	20	30		EGEDHN
N#Cc1ccc(CNCC2(NC(=O)CC3CC3)CCCC2)c(F)c1	ZINC001715082605	1419819509	/nfs/dbraw/zinc/81/95/09/1419819509.db2.gz	FQVLFPJPLVBQQD-UHFFFAOYSA-N	0	3	329.419	3.016	20	30		EGEDHN
C[C@H]1CCCC[C@]1(CNCc1ccc(C#N)cc1F)NC(=O)C1CC1	ZINC001715133730	1419882910	/nfs/dbraw/zinc/88/29/10/1419882910.db2.gz	WZKUWZOXUIYJPG-VBKZILBWSA-N	0	3	343.446	3.262	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCC1CCN([C@@H](C)c2ccc(F)c(F)c2)CC1	ZINC001715200115	1419931914	/nfs/dbraw/zinc/93/19/14/1419931914.db2.gz	IQNPVMUZTRCSML-KGLIPLIRSA-N	0	3	349.425	3.404	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)N(C)C(=O)[C@@H]1CC[C@@H](C)CC1	ZINC001715374791	1420070785	/nfs/dbraw/zinc/07/07/85/1420070785.db2.gz	ZGJHYJILWBIGKE-KKUMJFAQSA-N	0	3	333.501	3.383	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)[C@H]3CCCC(F)(F)C3)CC2)cc1	ZINC001733255887	1429406183	/nfs/dbraw/zinc/40/61/83/1429406183.db2.gz	UGTQFORQGCIUAD-INIZCTEOSA-N	0	3	347.409	3.122	20	30		EGEDHN
C[C@H](CN(C)Cc1cccc(C#N)c1)NC(=O)CC(C)(C)C1CC1	ZINC001716020087	1420474893	/nfs/dbraw/zinc/47/48/93/1420474893.db2.gz	BRKZQUNHZJYQGT-OAHLLOKOSA-N	0	3	327.472	3.321	20	30		EGEDHN
C[C@@H](CN(C)Cc1cccc(C#N)c1)NC(=O)c1cccnc1C1CC1	ZINC001716032547	1420491880	/nfs/dbraw/zinc/49/18/80/1420491880.db2.gz	RRZCEZWAGSBCIJ-HNNXBMFYSA-N	0	3	348.450	3.081	20	30		EGEDHN
Cc1ccsc1C(=O)NCC1(NCc2ccc(F)c(C#N)c2)CC1	ZINC001716674289	1420830949	/nfs/dbraw/zinc/83/09/49/1420830949.db2.gz	UQENHTURFXFSET-UHFFFAOYSA-N	0	3	343.427	3.120	20	30		EGEDHN
CC1(CC(=O)NCC2(C)CCN(Cc3cccc(C#N)c3)CC2)CC1	ZINC001716886527	1421010246	/nfs/dbraw/zinc/01/02/46/1421010246.db2.gz	KMYSMCNLERJIAF-UHFFFAOYSA-N	0	3	339.483	3.467	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCc1ccc2c(c1)CN(CCc1ccccc1)C2	ZINC001717269730	1421225758	/nfs/dbraw/zinc/22/57/58/1421225758.db2.gz	XRJWDPCKHOTQBO-INIZCTEOSA-N	0	3	333.435	3.021	20	30		EGEDHN
C=C(Cl)CN1CCCCC[C@@H]1CNC(=O)CN(C)CC(C)(C)C	ZINC001717539582	1421479218	/nfs/dbraw/zinc/47/92/18/1421479218.db2.gz	YLIHMESCWINYQC-MRXNPFEDSA-N	0	3	343.943	3.078	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2ccc(F)c(C#N)c2)CN1C(=O)CCC1(C)CC1	ZINC001717825134	1421640036	/nfs/dbraw/zinc/64/00/36/1421640036.db2.gz	BEUGHVNQODPQDL-RHSMWYFYSA-N	0	3	343.446	3.357	20	30		EGEDHN
N#Cc1cccc(CNC2(CNC(=O)c3ccoc3C3CC3)CC2)c1	ZINC001723551311	1424460066	/nfs/dbraw/zinc/46/00/66/1424460066.db2.gz	CDWVMXIDWPTWAU-UHFFFAOYSA-N	0	3	335.407	3.081	20	30		EGEDHN
C=C(Cl)CN(CC1CC1)C1CCN(C(=O)[C@@H](F)C(C)C)CC1	ZINC001723648994	1424514005	/nfs/dbraw/zinc/51/40/05/1424514005.db2.gz	BZVGRGZOALXSPT-INIZCTEOSA-N	0	3	330.875	3.436	20	30		EGEDHN
Cc1ccc(CCN2Cc3ccc(CNC(=O)[C@@H](C)C#N)cc3C2)cc1	ZINC001724920951	1425304681	/nfs/dbraw/zinc/30/46/81/1425304681.db2.gz	AMNITELPPDNTBI-KRWDZBQOSA-N	0	3	347.462	3.329	20	30		EGEDHN
Cc1cccc(C(=O)NC[C@@H](C)N(C)Cc2cccc(C#N)c2)c1C	ZINC001725194399	1425744379	/nfs/dbraw/zinc/74/43/79/1425744379.db2.gz	IZSDZNNTINWJLA-MRXNPFEDSA-N	0	3	335.451	3.425	20	30		EGEDHN
C[C@H](CN(C)C(=O)c1ccc(Cl)o1)NCc1ccc(C#N)s1	ZINC001725473400	1426146080	/nfs/dbraw/zinc/14/60/80/1426146080.db2.gz	FEQYJMIXJBUHQA-SNVBAGLBSA-N	0	3	337.832	3.116	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](CNCc2ccc(C#N)s2)C(C)(C)C)co1	ZINC001725740385	1426415699	/nfs/dbraw/zinc/41/56/99/1426415699.db2.gz	RTLHMCKBDSNGRY-MRXNPFEDSA-N	0	3	345.468	3.456	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1c[nH]nc1C1CC1	ZINC001731296146	1427238559	/nfs/dbraw/zinc/23/85/59/1427238559.db2.gz	WTSASOFZEOUPMM-SWLSCSKDSA-N	0	3	336.867	3.012	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@H](OC(C)C)c2ccccc2)C1	ZINC001731460715	1427436721	/nfs/dbraw/zinc/43/67/21/1427436721.db2.gz	JMXKQQHOXGAECQ-BRWVUGGUSA-N	0	3	336.863	3.142	20	30		EGEDHN
Cc1cccnc1C(=O)N1CCCC[C@H]1CNCC#Cc1ccccc1	ZINC001731545502	1427562100	/nfs/dbraw/zinc/56/21/00/1427562100.db2.gz	QSUVXDHYTVUXHX-FQEVSTJZSA-N	0	3	347.462	3.026	20	30		EGEDHN
C[C@H](C(=O)NCC1(NCc2ccc(C#N)s2)CCC1)C1CCC1	ZINC001733719268	1429939440	/nfs/dbraw/zinc/93/94/40/1429939440.db2.gz	XYTGEHOHJOYPBM-ZDUSSCGKSA-N	0	3	331.485	3.184	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccc(F)c(F)c1)N(C)Cc1ccc(C#N)cc1	ZINC001734040685	1437828957	/nfs/dbraw/zinc/82/89/57/1437828957.db2.gz	LWORDDKOFJXVHC-ZDUSSCGKSA-N	0	3	343.377	3.087	20	30		EGEDHN
C[C@@H](CC(=O)NCCCN(C)Cc1ccc(F)c(C#N)c1)C1CC1	ZINC001752123675	1440142874	/nfs/dbraw/zinc/14/28/74/1440142874.db2.gz	CZUJWXKBHZEKPX-AWEZNQCLSA-N	0	3	331.435	3.072	20	30		EGEDHN
Cc1cc[nH]c1C(=O)N1CCCC[C@@H]1[C@H](C)NCC#Cc1ccccc1	ZINC001752144187	1440145354	/nfs/dbraw/zinc/14/53/54/1440145354.db2.gz	CFTCUFXOIXSZNV-AZUAARDMSA-N	0	3	349.478	3.348	20	30		EGEDHN
CCN(CC#Cc1ccccc1)CCCNC(=O)[C@@]12C[C@@H]1CCCC2	ZINC001752209941	1440154837	/nfs/dbraw/zinc/15/48/37/1440154837.db2.gz	GSZASRSFYKCYJY-UNMCSNQZSA-N	0	3	338.495	3.447	20	30		EGEDHN
C#CCN(CCCNC(=O)Cc1ccc(C(C)(C)C)cc1)C1CC1	ZINC001752277737	1440163990	/nfs/dbraw/zinc/16/39/90/1440163990.db2.gz	CBXGKSSXTOTNHF-UHFFFAOYSA-N	0	3	326.484	3.131	20	30		EGEDHN
C=CCC[C@H](C)N1CC[C@@H](NC(=O)c2ccc(P(C)(C)=O)cc2)C1	ZINC001752411623	1440174338	/nfs/dbraw/zinc/17/43/38/1440174338.db2.gz	SKTKPCAPYVIRIC-DOTOQJQBSA-N	0	3	348.427	3.093	20	30		EGEDHN
COCC#CCN1CCC2(C[C@H]2NC(=O)[C@@H](C)CCC(C)(C)C)CC1	ZINC001752434779	1440179842	/nfs/dbraw/zinc/17/98/42/1440179842.db2.gz	IUSCKIAZGVVWJA-ZWKOTPCHSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=C(C)CN1CCC(N(CCC)C(=O)c2ccnc(N(C)C)c2)CC1	ZINC001752439481	1440181008	/nfs/dbraw/zinc/18/10/08/1440181008.db2.gz	IFVNYGLQBWJWKC-UHFFFAOYSA-N	0	3	344.503	3.040	20	30		EGEDHN
C#CCCCC(=O)NC[C@H](NCc1ccc(F)cc1Cl)C1CC1	ZINC001752459410	1440183647	/nfs/dbraw/zinc/18/36/47/1440183647.db2.gz	QHSHGBDEWLSTON-KRWDZBQOSA-N	0	3	336.838	3.267	20	30		EGEDHN
Cc1coc(C)c1C(=O)NC[C@H](NCc1ccc(C#N)s1)C1CC1	ZINC001752460667	1440183762	/nfs/dbraw/zinc/18/37/62/1440183762.db2.gz	VQHRRKZOFGQOIQ-INIZCTEOSA-N	0	3	343.452	3.128	20	30		EGEDHN
CC1(C(=O)NC[C@H](NCc2cc(C#N)ccc2F)C2CC2)CCCC1	ZINC001752474695	1440185102	/nfs/dbraw/zinc/18/51/02/1440185102.db2.gz	ZVPXLVJVTBKOJW-SFHVURJKSA-N	0	3	343.446	3.262	20	30		EGEDHN
CC(C)(C)C(=O)NC[C@H](NCC#Cc1ccccc1Cl)C1CC1	ZINC001752491909	1440186918	/nfs/dbraw/zinc/18/69/18/1440186918.db2.gz	XLADBNRHDUTYPG-KRWDZBQOSA-N	0	3	332.875	3.222	20	30		EGEDHN
Cc1ncc(CN(C)C[C@H]2CCCN(C(=O)C#CC(C)(C)C)C2)s1	ZINC001752506885	1440189380	/nfs/dbraw/zinc/18/93/80/1440189380.db2.gz	YALVGSTWOYDQLG-MRXNPFEDSA-N	0	3	347.528	3.171	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1Cc2ccccc2O1	ZINC001752538042	1440194331	/nfs/dbraw/zinc/19/43/31/1440194331.db2.gz	BOWHQUFBZOQTGN-PHXBYCTMSA-N	0	3	340.467	3.020	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H](CC)c2ccc(OC)cc2)C1	ZINC001752687626	1440200135	/nfs/dbraw/zinc/20/01/35/1440200135.db2.gz	WROOMCQVCCXNID-ZOBUZTSGSA-N	0	3	336.863	3.178	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1C[C@@H](NCc2cccc(F)c2Cl)C1	ZINC001752751910	1440204957	/nfs/dbraw/zinc/20/49/57/1440204957.db2.gz	SFHTXTIEIXRLRL-GASCZTMLSA-N	0	3	336.838	3.410	20	30		EGEDHN
C[C@H](C(=O)NC[C@H]1CCCN(Cc2cccc(C#N)c2)C1)C1CCC1	ZINC001752781937	1440209055	/nfs/dbraw/zinc/20/90/55/1440209055.db2.gz	BBHLCLNJNDLSHV-QFBILLFUSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=CCOCCN1CCCC[C@H]1CNC(=O)c1c(C)cc(C)cc1C	ZINC001752824975	1440223361	/nfs/dbraw/zinc/22/33/61/1440223361.db2.gz	IVQBQTCKXIPEGK-IBGZPJMESA-N	0	3	344.499	3.399	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)[C@@H](OC(C)C)c1ccccc1	ZINC001752826277	1440223779	/nfs/dbraw/zinc/22/37/79/1440223779.db2.gz	ZCEALFDYYNXIST-PMACEKPBSA-N	0	3	342.483	3.147	20	30		EGEDHN
C=CCCOCC(=O)NC[C@@H]1CCCCN1Cc1ccc(C)cc1C	ZINC001752826208	1440223788	/nfs/dbraw/zinc/22/37/88/1440223788.db2.gz	VYDHHSVOYXCIAL-FQEVSTJZSA-N	0	3	344.499	3.367	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H]1CCCCN1Cc1ccccc1N(C)C	ZINC001752828227	1440224743	/nfs/dbraw/zinc/22/47/43/1440224743.db2.gz	SLDOKYIJCBKPCI-SFHVURJKSA-N	0	3	343.515	3.436	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)Cc2cccc(C(F)F)c2)C1	ZINC001752836431	1440228087	/nfs/dbraw/zinc/22/80/87/1440228087.db2.gz	NDZPUQSFNXPXMP-MAUKXSAKSA-N	0	3	348.437	3.407	20	30		EGEDHN
C=C(C)CCC(=O)NC1CCC(N[C@H](C)c2cnc(C)cn2)CC1	ZINC001752850240	1440233439	/nfs/dbraw/zinc/23/34/39/1440233439.db2.gz	PKDSNJVTPAUOTI-KLAILNCOSA-N	0	3	330.476	3.219	20	30		EGEDHN
C=CC1(CC(=O)NC[C@H](C)NCc2ccnc(OC)c2)CCCCC1	ZINC001752904424	1440243658	/nfs/dbraw/zinc/24/36/58/1440243658.db2.gz	JGYSNEOCOCKDDD-INIZCTEOSA-N	0	3	345.487	3.211	20	30		EGEDHN
CC(C)(C)/C=C/C(=O)N1CC[C@H](CNCc2ccccc2C#N)C1	ZINC001752934529	1440250204	/nfs/dbraw/zinc/25/02/04/1440250204.db2.gz	HYEQJDMCWGZQNR-XAVKZTDYSA-N	0	3	325.456	3.099	20	30		EGEDHN
C=C(Cl)CNCCc1ccc(CNC(=O)c2ccoc2C)cc1	ZINC001752981764	1440257167	/nfs/dbraw/zinc/25/71/67/1440257167.db2.gz	PVSJFWWAPHPMOL-UHFFFAOYSA-N	0	3	332.831	3.403	20	30		EGEDHN
C/C(=C/C(=O)NCC[C@@H](C)NCc1cc(C#N)ccc1F)C1CC1	ZINC001753002538	1440265026	/nfs/dbraw/zinc/26/50/26/1440265026.db2.gz	HXEVSQRQTDGJPV-RNQWEJQRSA-N	0	3	329.419	3.038	20	30		EGEDHN
C[C@H](NCCN(C)C(=O)c1c[nH]c(C#N)c1)c1ccc(F)c(Cl)c1	ZINC001753181640	1440336899	/nfs/dbraw/zinc/33/68/99/1440336899.db2.gz	QEGRZYOVFDZOSC-NSHDSACASA-N	0	3	348.809	3.102	20	30		EGEDHN
CN(CCNCc1ccc(C#N)cc1)C(=O)CCCc1ccccc1	ZINC001753226950	1440340694	/nfs/dbraw/zinc/34/06/94/1440340694.db2.gz	OPICBXTVIWVNMP-UHFFFAOYSA-N	0	3	335.451	3.129	20	30		EGEDHN
Cc1cc(C)cc(CCC(=O)N(C)CCNCc2cccc(C#N)c2)c1	ZINC001753250152	1440342964	/nfs/dbraw/zinc/34/29/64/1440342964.db2.gz	XDSPFCQHSJBHPB-UHFFFAOYSA-N	0	3	349.478	3.356	20	30		EGEDHN
C=CCN[C@@H](CNC(=O)c1cnc(C)n1C)c1ccc(C(C)C)cc1	ZINC001753294597	1440351774	/nfs/dbraw/zinc/35/17/74/1440351774.db2.gz	QVBWVQOPJRXEAZ-SFHVURJKSA-N	0	3	340.471	3.099	20	30		EGEDHN
C=C(C)CN[C@@H](CNC(=O)c1cc(Cl)cn1C)c1ccccc1	ZINC001753299981	1440353703	/nfs/dbraw/zinc/35/37/03/1440353703.db2.gz	LJPPWJWNPSYCMY-INIZCTEOSA-N	0	3	331.847	3.315	20	30		EGEDHN
C=CCN[C@@H](CNC(=O)[C@H]1CCc2cc(F)ccc21)c1ccccc1	ZINC001753300415	1440353782	/nfs/dbraw/zinc/35/37/82/1440353782.db2.gz	RZUAHVHAFWXERA-PMACEKPBSA-N	0	3	338.426	3.489	20	30		EGEDHN
C#CCCN[C@@H](CNC(=O)c1ccc(Cl)cc1)c1ccccc1	ZINC001753302900	1440354735	/nfs/dbraw/zinc/35/47/35/1440354735.db2.gz	LZCLSOFNOIWBSJ-SFHVURJKSA-N	0	3	326.827	3.424	20	30		EGEDHN
C#CCCN[C@H](CNC(=O)c1ccc(Cl)cc1)c1ccccc1	ZINC001753302899	1440354746	/nfs/dbraw/zinc/35/47/46/1440354746.db2.gz	LZCLSOFNOIWBSJ-GOSISDBHSA-N	0	3	326.827	3.424	20	30		EGEDHN
C=CCCCC(=O)N1C[C@H]2CC[C@@H](C1)N2C[C@@H](OC)C1CCCC1	ZINC001753311013	1440356519	/nfs/dbraw/zinc/35/65/19/1440356519.db2.gz	ZOBZNKUZZUQJDM-CEXWTWQISA-N	0	3	334.504	3.223	20	30		EGEDHN
C=CCOCCN1CC[C@H](N(CCC)C(=O)[C@@H]2C[C@@H]3CCCC[C@H]23)C1	ZINC001753318426	1440361320	/nfs/dbraw/zinc/36/13/20/1440361320.db2.gz	JBZKOVZCMLJTEJ-LWYYNNOASA-N	0	3	348.531	3.328	20	30		EGEDHN
C#CCCN1CC[C@H](N(CCC)C(=O)[C@@H](C)Oc2ccc(C)cc2)C1	ZINC001753323880	1440365417	/nfs/dbraw/zinc/36/54/17/1440365417.db2.gz	SGGCPKLUZDGBGO-MOPGFXCFSA-N	0	3	342.483	3.099	20	30		EGEDHN
C#CCCN1CC[C@H](N(CCC)C(=O)c2ccc3ncsc3c2)C1	ZINC001753324186	1440365552	/nfs/dbraw/zinc/36/55/52/1440365552.db2.gz	ZENDJARJCFUBJA-INIZCTEOSA-N	0	3	341.480	3.246	20	30		EGEDHN
C[C@@H](C(=O)NCC[C@@H]1CCN(Cc2ccc(F)c(C#N)c2)C1)C1CC1	ZINC001753325078	1440366091	/nfs/dbraw/zinc/36/60/91/1440366091.db2.gz	PBDCDOWTQYHGPZ-HUUCEWRRSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=CCCN1CC[C@H](N(CCC)C(=O)c2ocnc2C(F)F)C1	ZINC001753325781	1440366468	/nfs/dbraw/zinc/36/64/68/1440366468.db2.gz	DJUREWJEVFAIDO-LBPRGKRZSA-N	0	3	327.375	3.115	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](CN(C)Cc2cnc(C)s2)C1	ZINC001753356675	1440380505	/nfs/dbraw/zinc/38/05/05/1440380505.db2.gz	UPZHTDZQXPZLGL-OAHLLOKOSA-N	0	3	335.517	3.334	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](N(Cc2ccccc2)C(=O)COCC)C1	ZINC001753361742	1440383107	/nfs/dbraw/zinc/38/31/07/1440383107.db2.gz	NRAWCDYONMZJCI-LJQANCHMSA-N	0	3	330.472	3.092	20	30		EGEDHN
C#CCCCCC(=O)N1CCC(CN(C)Cc2oc(C)nc2C)CC1	ZINC001753362220	1440383411	/nfs/dbraw/zinc/38/34/11/1440383411.db2.gz	GCKYXGLDNJHEBM-UHFFFAOYSA-N	0	3	345.487	3.155	20	30		EGEDHN
C=C(C)CN1CCC[C@H](N(Cc2ccccc2)C(=O)CC(C)(C)O)C1	ZINC001753362418	1440383456	/nfs/dbraw/zinc/38/34/56/1440383456.db2.gz	YIOYDKSHRMBXTH-IBGZPJMESA-N	0	3	344.499	3.217	20	30		EGEDHN
CCCCCCCN1CC(NC(=O)c2c(C)n[nH]c2C(F)(F)F)C1	ZINC001753382634	1440387836	/nfs/dbraw/zinc/38/78/36/1440387836.db2.gz	GAZJVCDLFPBYSW-UHFFFAOYSA-N	0	3	346.397	3.121	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H]2C[C@H]1CN2C(=O)c1cccc(OCC)c1	ZINC001753425444	1440396556	/nfs/dbraw/zinc/39/65/56/1440396556.db2.gz	WFYDYOJSHXYELU-SZMVWBNQSA-N	0	3	328.456	3.339	20	30		EGEDHN
CCCCCCCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H]1CC12CCOCC2	ZINC001753427554	1440397302	/nfs/dbraw/zinc/39/73/02/1440397302.db2.gz	LEOWFTJUOYNLFR-BZSNNMDCSA-N	0	3	334.504	3.059	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)CCc2ccc(C)cc2C)C1	ZINC001753462361	1440411465	/nfs/dbraw/zinc/41/14/65/1440411465.db2.gz	TXOXUNXGQHGBOQ-HXUWFJFHSA-N	0	3	326.484	3.182	20	30		EGEDHN
Cc1nsc(C)c1CNC[C@@](C)(NC(=O)C#CC(C)(C)C)C1CC1	ZINC001753518409	1440427989	/nfs/dbraw/zinc/42/79/89/1440427989.db2.gz	HPOASFDFDXJBLV-LJQANCHMSA-N	0	3	347.528	3.184	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)CCc1csc(C)n1)C1CC1	ZINC001753524548	1440429291	/nfs/dbraw/zinc/42/92/91/1440429291.db2.gz	GRFWNRDYSOGNFI-INIZCTEOSA-N	0	3	341.908	3.011	20	30		EGEDHN
CC[C@@H](F)C(=O)NCc1ccc(CNCc2ccc(C#N)s2)cc1	ZINC001753590006	1440442529	/nfs/dbraw/zinc/44/25/29/1440442529.db2.gz	WPEXCQPKLUULLT-QGZVFWFLSA-N	0	3	345.443	3.274	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@H](C)CNCc1cc(-c2cccs2)on1	ZINC001753626564	1440451368	/nfs/dbraw/zinc/45/13/68/1440451368.db2.gz	QQEQTYXGWQPNGG-CYBMUJFWSA-N	0	3	347.484	3.457	20	30		EGEDHN
C#CCCCC(=O)NCC1(NCc2ccc(F)cc2F)CCCC1	ZINC001753662001	1440458952	/nfs/dbraw/zinc/45/89/52/1440458952.db2.gz	BYZPDHMVADYRTH-UHFFFAOYSA-N	0	3	334.410	3.287	20	30		EGEDHN
CC#CCCCC(=O)NCC1(NCc2cnc(C)s2)CCCC1	ZINC001753667526	1440460753	/nfs/dbraw/zinc/46/07/53/1440460753.db2.gz	ZNLXDZJDKQHGSM-UHFFFAOYSA-N	0	3	333.501	3.164	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccccc1Cl)N(C)C(=O)c1ccco1	ZINC001753677821	1440463718	/nfs/dbraw/zinc/46/37/18/1440463718.db2.gz	RYRXYCLWRUGCSA-AWEZNQCLSA-N	0	3	330.815	3.035	20	30		EGEDHN
Cc1sccc1C(=O)N(C)[C@@H](C)CNCc1ccc(C#N)c(F)c1	ZINC001753690553	1440466461	/nfs/dbraw/zinc/46/64/61/1440466461.db2.gz	UNPBPYTZCDEGIY-LBPRGKRZSA-N	0	3	345.443	3.318	20	30		EGEDHN
C[C@H](CNCC#Cc1ccccc1)N(C)C(=O)[C@H](C)C1CCCC1	ZINC001753719690	1440472730	/nfs/dbraw/zinc/47/27/30/1440472730.db2.gz	LFFYQSFYFANYCH-QZTJIDSGSA-N	0	3	326.484	3.301	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@H](CNCc1ccc(F)cc1F)C1CCCCC1	ZINC001753744677	1440480483	/nfs/dbraw/zinc/48/04/83/1440480483.db2.gz	MITMYFCROCCVOQ-FZKQIMNGSA-N	0	3	349.425	3.279	20	30		EGEDHN
CCC(=O)N1CCC[C@H](C)[C@@H]1CNCC#Cc1cccc(Cl)c1	ZINC001753800733	1440490828	/nfs/dbraw/zinc/49/08/28/1440490828.db2.gz	DDOZQWFFWOHYAX-YJBOKZPZSA-N	0	3	332.875	3.318	20	30		EGEDHN
CC#CCCCC(=O)NC[C@H](NCc1cccc(Cl)n1)C(C)C	ZINC001753837025	1440501460	/nfs/dbraw/zinc/50/14/60/1440501460.db2.gz	JDNUWWKKBRAFMY-INIZCTEOSA-N	0	3	335.879	3.159	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)[C@@H](C)Oc1cccc(C)c1)C(C)C	ZINC001753843588	1440503620	/nfs/dbraw/zinc/50/36/20/1440503620.db2.gz	SCDOAVTXCLKEMZ-WBVHZDCISA-N	0	3	338.879	3.245	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1CCC[C@H]1CNCc1ncc(C)s1	ZINC001753895378	1440522733	/nfs/dbraw/zinc/52/27/33/1440522733.db2.gz	MXDPLRUXVKQDQU-GJZGRUSLSA-N	0	3	335.517	3.428	20	30		EGEDHN
C=C(Cl)CNCC[C@H](C)NC(=O)[C@H](CC)c1c(C)noc1C	ZINC001754006556	1440530923	/nfs/dbraw/zinc/53/09/23/1440530923.db2.gz	TVCPERWPAXTWRH-SMDDNHRTSA-N	0	3	327.856	3.022	20	30		EGEDHN
C#Cc1cncc(C(=O)N(CC)CCN[C@H](C)c2ccccc2F)c1	ZINC001754065901	1440537489	/nfs/dbraw/zinc/53/74/89/1440537489.db2.gz	AIYRLQUYMZLIHN-OAHLLOKOSA-N	0	3	339.414	3.015	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC/C=C/CNCc1cccc2c1CCOC2	ZINC001754166599	1440546476	/nfs/dbraw/zinc/54/64/76/1440546476.db2.gz	PDZMVMUMIKFVST-IRUYWQDXSA-N	0	3	342.483	3.124	20	30		EGEDHN
C=Cc1ccc(C(=O)NC/C=C/CNCc2ccc(C#N)cc2)cc1	ZINC001754171605	1440547071	/nfs/dbraw/zinc/54/70/71/1440547071.db2.gz	INVWXGDOISXRBJ-ONEGZZNKSA-N	0	3	331.419	3.277	20	30		EGEDHN
C=Cc1ccc(C(=O)NC/C=C\CNCc2ccc(C#N)cc2)cc1	ZINC001754171604	1440547109	/nfs/dbraw/zinc/54/71/09/1440547109.db2.gz	INVWXGDOISXRBJ-ARJAWSKDSA-N	0	3	331.419	3.277	20	30		EGEDHN
C[C@H](CNCC#Cc1cccc(Cl)c1)NC(=O)C12CCC(CC1)C2	ZINC001754232209	1440554248	/nfs/dbraw/zinc/55/42/48/1440554248.db2.gz	ZKHRJOJSLXAFJW-XRTORIHISA-N	0	3	344.886	3.366	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@H](C)CNCc1cc(F)c(OC)c(F)c1	ZINC001754241865	1440555937	/nfs/dbraw/zinc/55/59/37/1440555937.db2.gz	XTPYMEDOSFLMDP-XIKOKIGWSA-N	0	3	340.414	3.170	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H](C)CN(C)Cc2cccc(C#N)c2)cc1C	ZINC001754342670	1440588662	/nfs/dbraw/zinc/58/86/62/1440588662.db2.gz	IPJSPMIYMMMMOL-QGZVFWFLSA-N	0	3	335.451	3.425	20	30		EGEDHN
C=C1CCC(C(=O)N(C)CCCNCc2ccn(C(C)C)n2)CC1	ZINC001754393523	1440594337	/nfs/dbraw/zinc/59/43/37/1440594337.db2.gz	CNDWRIUJXBYDDG-UHFFFAOYSA-N	0	3	332.492	3.149	20	30		EGEDHN
CN(CCCNCc1ccccc1C#N)C(=O)[C@@H]1CCC(C)(C)C1	ZINC001754394556	1440594490	/nfs/dbraw/zinc/59/44/90/1440594490.db2.gz	DBAFOGHMEJGJPG-MRXNPFEDSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)CCCNCc2oc(CCC)nc2C)C1	ZINC001754399372	1440594941	/nfs/dbraw/zinc/59/49/41/1440594941.db2.gz	KKIHWSSRIJKSAP-UHFFFAOYSA-N	0	3	333.476	3.230	20	30		EGEDHN
O=C(N[C@H](CNCC#Cc1ccc(F)cc1)C1CC1)c1ccsc1	ZINC001754433901	1440597591	/nfs/dbraw/zinc/59/75/91/1440597591.db2.gz	CVARCXOCINAOLB-GOSISDBHSA-N	0	3	342.439	3.037	20	30		EGEDHN
O=C(CC1CCC1)N[C@H](CNCC#Cc1ccccc1Cl)C1CC1	ZINC001754436592	1440598199	/nfs/dbraw/zinc/59/81/99/1440598199.db2.gz	BNIVRPCSSPZNOI-LJQANCHMSA-N	0	3	344.886	3.366	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N[C@H](CNCC#Cc1ccccc1Cl)C1CC1	ZINC001754452124	1440601382	/nfs/dbraw/zinc/60/13/82/1440601382.db2.gz	XLABRZMLLQOAGF-LSBZLQRGSA-N	0	3	344.886	3.222	20	30		EGEDHN
CCCCCCCN1CC[C@H]1CNC(=O)c1cnn2ccc(C)cc12	ZINC001754485715	1440608491	/nfs/dbraw/zinc/60/84/91/1440608491.db2.gz	ALXLGRMFBGZPOE-KRWDZBQOSA-N	0	3	342.487	3.417	20	30		EGEDHN
C=CCCCCCN1CC[C@@H]1CNC(=O)c1cccc2c1CCOC2	ZINC001754489077	1440609572	/nfs/dbraw/zinc/60/95/72/1440609572.db2.gz	PWYZXECWEBFQRH-GOSISDBHSA-N	0	3	342.483	3.310	20	30		EGEDHN
CC(C)[C@]1(C)C[C@@H]1C(=O)NCC1(NCc2ccc(F)c(C#N)c2)CC1	ZINC001754530567	1440622369	/nfs/dbraw/zinc/62/23/69/1440622369.db2.gz	WNDDRIFMXXVHNB-APWZRJJASA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN(CC1CC1)C1CCN(C(=O)c2ncccc2C)CC1	ZINC001754548313	1440628666	/nfs/dbraw/zinc/62/86/66/1440628666.db2.gz	MFRIPCLPTHFUSE-UHFFFAOYSA-N	0	3	347.890	3.459	20	30		EGEDHN
O=C(CC#Cc1ccccc1)N1C[C@H]2CCC[C@@H](C1)N2CCC1CC1	ZINC001754554846	1440631015	/nfs/dbraw/zinc/63/10/15/1440631015.db2.gz	RAKFEPJVDMSXFM-OYRHEFFESA-N	0	3	336.479	3.294	20	30		EGEDHN
C=CCCC(=O)N1CC[C@]2(CCN(CCc3c(F)cccc3F)C2)C1	ZINC001754563980	1440634752	/nfs/dbraw/zinc/63/47/52/1440634752.db2.gz	SNIDIOPCLVPVFA-FQEVSTJZSA-N	0	3	348.437	3.398	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)CCCc3ccccc3Cl)C2)C1	ZINC001754564548	1440635011	/nfs/dbraw/zinc/63/50/11/1440635011.db2.gz	GMAUELGFIJIDQL-FQEVSTJZSA-N	0	3	344.886	3.220	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](NC/C(Cl)=C\Cl)C[C@H]1C	ZINC001754598196	1440641899	/nfs/dbraw/zinc/64/18/99/1440641899.db2.gz	HVQXIWIEWLVZFC-RFHWTAPTSA-N	0	3	331.287	3.468	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@H]1CNCc1cc(F)cc(F)c1	ZINC001754615096	1440644292	/nfs/dbraw/zinc/64/42/92/1440644292.db2.gz	BAHSFRTZLXYTOB-SFHVURJKSA-N	0	3	334.410	3.239	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N1CCC[C@H]1CNCC#Cc1ccc(F)cc1	ZINC001754615715	1440644431	/nfs/dbraw/zinc/64/44/31/1440644431.db2.gz	YZRRDWFYHFPDKK-GPGPQOAVSA-N	0	3	340.442	3.280	20	30		EGEDHN
CC/C=C(\C)C(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1	ZINC001754623393	1440645745	/nfs/dbraw/zinc/64/57/45/1440645745.db2.gz	COHYFDUWARODAB-OMCISZLKSA-N	0	3	325.456	3.385	20	30		EGEDHN
C#CCN(C(=O)C[C@@H](C)c1ccco1)C1CCN(CC(=C)C)CC1	ZINC001754641802	1440649332	/nfs/dbraw/zinc/64/93/32/1440649332.db2.gz	AJLXLPCTDVSIGN-QGZVFWFLSA-N	0	3	328.456	3.276	20	30		EGEDHN
C=CCOCC(=O)N[C@@]1(C)CCN(Cc2ccc(CC(C)C)cc2)C1	ZINC001754668344	1440657264	/nfs/dbraw/zinc/65/72/64/1440657264.db2.gz	JNPWHAMULNMJHD-NRFANRHFSA-N	0	3	344.499	3.168	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@](C)(CNCc2ccccc2C#N)C1	ZINC001754686452	1440665039	/nfs/dbraw/zinc/66/50/39/1440665039.db2.gz	DTIVNOCMGDTJDS-HXUWFJFHSA-N	0	3	327.472	3.323	20	30		EGEDHN
C#CCN1CCC(C)(CNC(=O)c2cc(C(C)(C)C)oc2C)CC1	ZINC001754720224	1440672913	/nfs/dbraw/zinc/67/29/13/1440672913.db2.gz	JZHFOYZFIFONGY-UHFFFAOYSA-N	0	3	330.472	3.351	20	30		EGEDHN
C=C(C)CN[C@@H](CNC(=O)c1ccns1)c1ccccc1CC	ZINC001754785660	1440687696	/nfs/dbraw/zinc/68/76/96/1440687696.db2.gz	OXTHSLZCWAHQSV-INIZCTEOSA-N	0	3	329.469	3.342	20	30		EGEDHN
C#CCCN[C@H](CNC(=O)c1cccnc1C)c1ccccc1CC	ZINC001754785889	1440687797	/nfs/dbraw/zinc/68/77/97/1440687797.db2.gz	RJAXVNVUYZFMDT-HXUWFJFHSA-N	0	3	335.451	3.036	20	30		EGEDHN
C=C(C)CN[C@@H](CNC(=O)[C@@H]1CCCOCC1)c1ccccc1CC	ZINC001754786300	1440687982	/nfs/dbraw/zinc/68/79/82/1440687982.db2.gz	WTJITXQFKQZRMU-QUCCMNQESA-N	0	3	344.499	3.389	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@@H](C)[C@@H](CNCc2nc(C)sc2C)C1	ZINC001754809930	1440691790	/nfs/dbraw/zinc/69/17/90/1440691790.db2.gz	AGQWGKRIZDYULE-PBHICJAKSA-N	0	3	347.528	3.138	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@H](C)[C@@H](CNCc2ccccc2C#N)C1	ZINC001754815468	1440692235	/nfs/dbraw/zinc/69/22/35/1440692235.db2.gz	RWOQVZGAVVXJCB-LPHOPBHVSA-N	0	3	339.483	3.345	20	30		EGEDHN
C=CCCC(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2Cc1cc(C)ns1	ZINC001754829907	1440694493	/nfs/dbraw/zinc/69/44/93/1440694493.db2.gz	XZJAJPQHCJRSLX-MUJYYYPQSA-N	0	3	333.501	3.277	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2Cc1conc1C	ZINC001754831574	1440695479	/nfs/dbraw/zinc/69/54/79/1440695479.db2.gz	GWVYTMQRXKJAIH-DKKFBQAASA-N	0	3	345.487	3.445	20	30		EGEDHN
CC#CCNCCN(Cc1ccccc1)C(=O)[C@@H]1C[C@H]1CC(C)C	ZINC001754836998	1440697105	/nfs/dbraw/zinc/69/71/05/1440697105.db2.gz	CHJXMXJFSLDJPR-WOJBJXKFSA-N	0	3	326.484	3.310	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)C2(C)CC=CC2)CC1	ZINC001754839596	1440697612	/nfs/dbraw/zinc/69/76/12/1440697612.db2.gz	XBRDQENISGXBNP-UHFFFAOYSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)C2(C)CCC2)CC1	ZINC001754839612	1440697632	/nfs/dbraw/zinc/69/76/32/1440697632.db2.gz	XMUCXFHRBNFKOP-UHFFFAOYSA-N	0	3	327.472	3.251	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@H]2[C@@H]1CCN2CCc1ccns1	ZINC001754869547	1440704660	/nfs/dbraw/zinc/70/46/60/1440704660.db2.gz	YWOOBHNMPVNXIH-IRXDYDNUSA-N	0	3	333.501	3.107	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)CCCCc1ccc(C)cc1	ZINC001754871579	1440705299	/nfs/dbraw/zinc/70/52/99/1440705299.db2.gz	KGWVPLDNRHJBNU-SFTDATJTSA-N	0	3	338.495	3.406	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](CCN[C@@H](C)c2cnc(C)cn2)C1	ZINC001754917408	1440708965	/nfs/dbraw/zinc/70/89/65/1440708965.db2.gz	OVRMVHNFKLATSO-IRXDYDNUSA-N	0	3	330.476	3.031	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCN(C(=O)[C@H](CC)OC2CCCC2)C1	ZINC001754934075	1440711007	/nfs/dbraw/zinc/71/10/07/1440711007.db2.gz	IPHBJBDJMBWGCD-WBVHZDCISA-N	0	3	342.911	3.305	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCN(C(=O)Cc2ccc3c(c2)CCC3)C1	ZINC001754940991	1440711746	/nfs/dbraw/zinc/71/17/46/1440711746.db2.gz	BFJPGYGFCGMITG-MRXNPFEDSA-N	0	3	346.902	3.299	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCN(C(=O)CC2CCC(OC)CC2)C1	ZINC001754944206	1440712262	/nfs/dbraw/zinc/71/22/62/1440712262.db2.gz	VNOWUXRUTQQZCJ-CGZBRXJRSA-N	0	3	342.911	3.162	20	30		EGEDHN
C#CCN[C@H](C)c1ccc(CNC(=O)c2scnc2C2CC2)cc1	ZINC001754949056	1440714483	/nfs/dbraw/zinc/71/44/83/1440714483.db2.gz	VNAOKHRMPGWBRY-CYBMUJFWSA-N	0	3	339.464	3.234	20	30		EGEDHN
C#CCN[C@@H](C)c1ccc(CNC(=O)c2scnc2C2CC2)cc1	ZINC001754949057	1440714487	/nfs/dbraw/zinc/71/44/87/1440714487.db2.gz	VNAOKHRMPGWBRY-ZDUSSCGKSA-N	0	3	339.464	3.234	20	30		EGEDHN
CC#CCN[C@@H](C)c1ccc(CNC(=O)Cc2ccccc2F)cc1	ZINC001754951380	1440715059	/nfs/dbraw/zinc/71/50/59/1440715059.db2.gz	RSHJZGGGCHIBMW-INIZCTEOSA-N	0	3	338.426	3.359	20	30		EGEDHN
C#CCCN(C)Cc1ccccc1CNC(=O)c1cc2n(c1)CCCC2	ZINC001754954879	1440716035	/nfs/dbraw/zinc/71/60/35/1440716035.db2.gz	UZRONXCKAGBAFS-UHFFFAOYSA-N	0	3	349.478	3.210	20	30		EGEDHN
C=C1CC(C)(C(=O)NCc2cccc3c2CCN([C@H](C)COC)C3)C1	ZINC001754975972	1440720090	/nfs/dbraw/zinc/72/00/90/1440720090.db2.gz	XPXDFWSVRRRALP-MRXNPFEDSA-N	0	3	342.483	3.052	20	30		EGEDHN
CCC(C)(C)C(=O)NCC1(NCc2ccc(F)c(C#N)c2)CCC1	ZINC001754985682	1440722726	/nfs/dbraw/zinc/72/27/26/1440722726.db2.gz	AHWPLOAQQICJJV-UHFFFAOYSA-N	0	3	331.435	3.262	20	30		EGEDHN
C/C(=C\C(=O)N[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1)C1CC1	ZINC001755022083	1440727073	/nfs/dbraw/zinc/72/70/73/1440727073.db2.gz	YNZOVSRGEMXNON-ZRNYNZGJSA-N	0	3	337.467	3.385	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)CCc2ccc(Cl)s2)CC1	ZINC001755034747	1440733529	/nfs/dbraw/zinc/73/35/29/1440733529.db2.gz	YGKBYCOVEUFNHF-CQSZACIVSA-N	0	3	338.904	3.328	20	30		EGEDHN
CC#CCN(C)CCCN(C)C(=O)CCc1ccc([C@H]2C[C@@H]2C)o1	ZINC001755040156	1440736719	/nfs/dbraw/zinc/73/67/19/1440736719.db2.gz	LAJKPOZSBQGFPH-WMZOPIPTSA-N	0	3	330.472	3.139	20	30		EGEDHN
CC#CCN(C)CCCN(C)C(=O)c1ccc(Cl)c(Cl)c1	ZINC001755043904	1440739060	/nfs/dbraw/zinc/73/90/60/1440739060.db2.gz	HYWUHMKPXQPJRI-UHFFFAOYSA-N	0	3	327.255	3.411	20	30		EGEDHN
COc1ccc(CN(C)CCCN(C)C(=O)[C@@H](C)C(C)C)cc1C#N	ZINC001755045850	1440740750	/nfs/dbraw/zinc/74/07/50/1440740750.db2.gz	KVQNIEQWCXXOPU-INIZCTEOSA-N	0	3	345.487	3.139	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@H](OC)C3CCC3)cc2C1	ZINC001755102029	1440753104	/nfs/dbraw/zinc/75/31/04/1440753104.db2.gz	FUWYKPSSVQTUEB-LJQANCHMSA-N	0	3	328.456	3.010	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@H](C)[C@H](NCc2cnn(C(C)(C)C)c2)C1	ZINC001755115872	1440755055	/nfs/dbraw/zinc/75/50/55/1440755055.db2.gz	DNKRPCGKTADQBP-DOTOQJQBSA-N	0	3	346.519	3.177	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CCN(Cc2sc(C)nc2C)CC1(C)C	ZINC001755137443	1440758902	/nfs/dbraw/zinc/75/89/02/1440758902.db2.gz	SSKBGJYLJNXHSW-INIZCTEOSA-N	0	3	335.517	3.443	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)[C@H](C)OCc2cccc(C)c2)C(C)(C)C1	ZINC001755142016	1440761184	/nfs/dbraw/zinc/76/11/84/1440761184.db2.gz	RTNSINNLIDPGFO-PKOBYXMFSA-N	0	3	344.499	3.303	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)COc2cccc(C(C)C)c2)C[C@@H]1C	ZINC001755161114	1440764837	/nfs/dbraw/zinc/76/48/37/1440764837.db2.gz	UTSJHUYDVUUACG-PKOBYXMFSA-N	0	3	342.483	3.181	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1CCN(Cc2ccc(C#N)cc2)[C@@H](C)C1	ZINC001755161764	1440764973	/nfs/dbraw/zinc/76/49/73/1440764973.db2.gz	ZLHILROHXNYYIG-LPHOPBHVSA-N	0	3	325.456	3.384	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@@H]1CNC(=O)CCc1ccccn1	ZINC001755172056	1440769444	/nfs/dbraw/zinc/76/94/44/1440769444.db2.gz	JEOQXHRHKHRRTA-NRFANRHFSA-N	0	3	349.478	3.306	20	30		EGEDHN
CC/C(C)=C\C(=O)N1CCC[C@H]1CN(C)Cc1ccc(C#N)cc1	ZINC001755192407	1440775355	/nfs/dbraw/zinc/77/53/55/1440775355.db2.gz	FCLMVOLFUWLYJJ-UIRWJGRMSA-N	0	3	325.456	3.337	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC[C@H]2CN(C)CCOCCCC)cc1	ZINC001755196104	1440777002	/nfs/dbraw/zinc/77/70/02/1440777002.db2.gz	FMXAMIFSJAOEIR-FQEVSTJZSA-N	0	3	342.483	3.021	20	30		EGEDHN
C=CCC1(C(=O)NC2CC(CNCc3cnoc3C)C2)CCCC1	ZINC001755223784	1440785341	/nfs/dbraw/zinc/78/53/41/1440785341.db2.gz	OBAXENURAZXFID-UHFFFAOYSA-N	0	3	331.460	3.104	20	30		EGEDHN
C[C@@H](NCC#Cc1ccc(Cl)cc1)[C@H](C)NC(=O)c1ccoc1	ZINC001755225637	1440785771	/nfs/dbraw/zinc/78/57/71/1440785771.db2.gz	DURAHGTYRUFMBE-KGLIPLIRSA-N	0	3	330.815	3.081	20	30		EGEDHN
CC(C)C(=O)N[C@H](C)[C@@H](C)NCC#Cc1ccc(C(F)(F)F)cc1	ZINC001755226879	1440786121	/nfs/dbraw/zinc/78/61/21/1440786121.db2.gz	QRXPHOMXTTZZRY-ZIAGYGMSSA-N	0	3	340.389	3.196	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H](C)[C@H](C)NCC(=O)Nc1cccc(C)c1C	ZINC001755235436	1440788130	/nfs/dbraw/zinc/78/81/30/1440788130.db2.gz	CIQGWOXDHHWPRM-DLBZAZTESA-N	0	3	345.487	3.081	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H](C)[C@@H](C)NCC(=O)Nc1cccc(C)c1C	ZINC001755235439	1440788162	/nfs/dbraw/zinc/78/81/62/1440788162.db2.gz	CIQGWOXDHHWPRM-SJORKVTESA-N	0	3	345.487	3.081	20	30		EGEDHN
C[C@@H](NC(=O)C(C)(C)C1CCC1)[C@H](C)NCC#Cc1ccccc1	ZINC001755247132	1440790840	/nfs/dbraw/zinc/79/08/40/1440790840.db2.gz	ZAEVMSMUMMSXTJ-DLBZAZTESA-N	0	3	326.484	3.347	20	30		EGEDHN
C=CCCOCC(=O)N(C)C1CCC(NC/C(Cl)=C\Cl)CC1	ZINC001755278623	1440799923	/nfs/dbraw/zinc/79/99/23/1440799923.db2.gz	KVCPXRHVDQIHLE-JLHYYAGUSA-N	0	3	349.302	3.257	20	30		EGEDHN
C=C(Br)CNCC(C)(C)CN(C)C(=O)[C@@H]1CC12CCC2	ZINC001755285067	1440801828	/nfs/dbraw/zinc/80/18/28/1440801828.db2.gz	DPGLGHURPKMFMU-ZDUSSCGKSA-N	0	3	343.309	3.159	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccoc1Cl)N(C)Cc1cccc(C#N)c1	ZINC001755297114	1440806970	/nfs/dbraw/zinc/80/69/70/1440806970.db2.gz	UBJIEUYHZQDNLE-LBPRGKRZSA-N	0	3	331.803	3.055	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@H](C)N(C)Cc2cccc(COC)c2)C1	ZINC001755315455	1440815452	/nfs/dbraw/zinc/81/54/52/1440815452.db2.gz	QBZIYKICOLCWQN-INIZCTEOSA-N	0	3	330.472	3.126	20	30		EGEDHN
C=C[C@H](C(=O)NC[C@@H](C)N(C)Cc1cccc(C#N)c1)c1ccccc1	ZINC001755328483	1440823260	/nfs/dbraw/zinc/82/32/60/1440823260.db2.gz	QBJWMRUEPLANQE-UTKZUKDTSA-N	0	3	347.462	3.465	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)[C@@H](OC)[C@H](C)CC)CCCCC1	ZINC001755352580	1440828308	/nfs/dbraw/zinc/82/83/08/1440828308.db2.gz	GKFJVTMGUSGYEH-HIFRSBDPSA-N	0	3	330.900	3.209	20	30		EGEDHN
Cc1ncccc1CN1CCCCC[C@H]1CNC(=O)C#CC(C)(C)C	ZINC001755363672	1440833151	/nfs/dbraw/zinc/83/31/51/1440833151.db2.gz	MUDNLFRZZYYBGU-IBGZPJMESA-N	0	3	341.499	3.300	20	30		EGEDHN
C/C=C(\C)C(=O)NC[C@@H]1CCCCCN1Cc1ccc(C#N)cc1	ZINC001755364931	1440833853	/nfs/dbraw/zinc/83/38/53/1440833853.db2.gz	MOSCDXYWJLCMJP-SLWVEJNMSA-N	0	3	325.456	3.385	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@]2(CCN(C(=O)c3cc(C)c(C)o3)C2)C1	ZINC001755400126	1440842778	/nfs/dbraw/zinc/84/27/78/1440842778.db2.gz	CGQJFYLQXJPZHD-UZLBHIALSA-N	0	3	346.471	3.168	20	30		EGEDHN
Cc1cc(CN2C[C@H](NC(=O)C#CC(C)C)C(C)(C)C2)c(C)s1	ZINC001755408658	1440845413	/nfs/dbraw/zinc/84/54/13/1440845413.db2.gz	SYILGNDPRUKFHT-KRWDZBQOSA-N	0	3	332.513	3.351	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)[C@@H](C)c2cccc(C)c2)C(C)(C)C1	ZINC001755411414	1440846442	/nfs/dbraw/zinc/84/64/42/1440846442.db2.gz	KQORRAWZZOFENB-HKUYNNGSSA-N	0	3	344.499	3.128	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@@H]1[C@H]2CN(Cc3cccc(F)c3)C[C@H]21	ZINC001755430822	1440851134	/nfs/dbraw/zinc/85/11/34/1440851134.db2.gz	GROBHJRWDDNBMV-FTEYMNFISA-N	0	3	330.447	3.222	20	30		EGEDHN
C=CCCCCC[N@@H+]1C[C@@H]2[C@@H](CNC(=O)c3ccccc3[O-])[C@@H]2C1	ZINC001755432661	1440851362	/nfs/dbraw/zinc/85/13/62/1440851362.db2.gz	LGMJBRXMEKVSAU-NNZMDNLPSA-N	0	3	328.456	3.046	20	30		EGEDHN
C=CCCCCC[N@H+]1C[C@@H]2[C@@H](CNC(=O)c3ccccc3[O-])[C@@H]2C1	ZINC001755432661	1440851363	/nfs/dbraw/zinc/85/13/63/1440851363.db2.gz	LGMJBRXMEKVSAU-NNZMDNLPSA-N	0	3	328.456	3.046	20	30		EGEDHN
C=C(Cl)CNC[C@H]1C[C@H](NC(=O)c2ncc(Cl)cc2Cl)C1	ZINC001755480115	1440860061	/nfs/dbraw/zinc/86/00/61/1440860061.db2.gz	LFECHANRUDHPOF-HOMQSWHASA-N	0	3	348.661	3.239	20	30		EGEDHN
Cc1cccc(C(=O)N(C)C[C@@H](C)NCc2ccc(C#N)s2)c1	ZINC001755575822	1440878062	/nfs/dbraw/zinc/87/80/62/1440878062.db2.gz	LYEXLAUJQHOZQF-CQSZACIVSA-N	0	3	327.453	3.179	20	30		EGEDHN
C[C@H](CN(C)C(=O)c1ccc(F)c(F)c1)NCc1ccc(C#N)s1	ZINC001755590419	1440881503	/nfs/dbraw/zinc/88/15/03/1440881503.db2.gz	NMKBHAUGWDBBSS-LLVKDONJSA-N	0	3	349.406	3.148	20	30		EGEDHN
C[C@@H](CN(C)C(=O)[C@@H]1C[C@H]1C(C)(C)C)NCc1ccc(C#N)c(F)c1	ZINC001755594401	1440882228	/nfs/dbraw/zinc/88/22/28/1440882228.db2.gz	BCPDCIRVODFIPZ-IAOVAPTHSA-N	0	3	345.462	3.316	20	30		EGEDHN
C[C@@H](CN(C)C(=O)c1ccnc(C2CC2)c1)NCC#Cc1ccccc1	ZINC001755597527	1440883167	/nfs/dbraw/zinc/88/31/67/1440883167.db2.gz	MMXGMARRCMYPID-KRWDZBQOSA-N	0	3	347.462	3.061	20	30		EGEDHN
Cc1cc(C(=O)N(C)C[C@H](C)NCC#Cc2ccccc2)ccc1F	ZINC001755603251	1440884664	/nfs/dbraw/zinc/88/46/64/1440884664.db2.gz	XPDDAFVFSRGTAZ-KRWDZBQOSA-N	0	3	338.426	3.236	20	30		EGEDHN
C=CCC(C)(C)C(=O)N(C)C[C@@H](C)NCc1ccc(C#N)c(F)c1	ZINC001755606820	1440885912	/nfs/dbraw/zinc/88/59/12/1440885912.db2.gz	MOSXWFVJSFNTTO-CQSZACIVSA-N	0	3	331.435	3.236	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](NCc2ccc(F)c(F)c2)[C@H]1C	ZINC001755650731	1440891273	/nfs/dbraw/zinc/89/12/73/1440891273.db2.gz	QPGXYFFUIHJBET-KDOFPFPSSA-N	0	3	334.410	3.237	20	30		EGEDHN
CC(C)n1cccc1C(=O)N1CC[C@@H](NCC#Cc2ccccc2)[C@H]1C	ZINC001755666374	1440893490	/nfs/dbraw/zinc/89/34/90/1440893490.db2.gz	CGWRRQRUCRDKRX-UYAOXDASSA-N	0	3	349.478	3.313	20	30		EGEDHN
C=CCN1CC[C@]2(NC(=O)[C@H](C)Cc3ccc(C)cc3)CCC[C@@H]12	ZINC001755704890	1440902152	/nfs/dbraw/zinc/90/21/52/1440902152.db2.gz	RMLOWZRIGXFMTQ-YFVAEKQCSA-N	0	3	326.484	3.473	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H]3CCC[C@H](NCc4ccon4)[C@@H]3C2)CCC1	ZINC001755709916	1440903419	/nfs/dbraw/zinc/90/34/19/1440903419.db2.gz	XBPITDMURSEGKI-JQHSSLGASA-N	0	3	343.471	3.138	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1CC[C@@H](CNCc2nc(C)sc2C)C1	ZINC001755742883	1440911949	/nfs/dbraw/zinc/91/19/49/1440911949.db2.gz	GEBAHWLNYZWZJE-CABCVRRESA-N	0	3	335.517	3.347	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@@H](NCc2cncc(C)c2)C(C)(C)C1	ZINC001755772579	1440916961	/nfs/dbraw/zinc/91/69/61/1440916961.db2.gz	DOTYCNYXVTVURO-SJLPKXTDSA-N	0	3	329.488	3.319	20	30		EGEDHN
C#CCCN(C)CCN(C(=O)Cc1coc2cc(F)ccc12)C(C)C	ZINC001755810992	1440920487	/nfs/dbraw/zinc/92/04/87/1440920487.db2.gz	UFVSHEHIGUXOEI-UHFFFAOYSA-N	0	3	344.430	3.307	20	30		EGEDHN
C#CCCN(C)CCN(C(=O)c1cc(F)c(Cl)cc1F)C(C)C	ZINC001755812793	1440921237	/nfs/dbraw/zinc/92/12/37/1440921237.db2.gz	WGSNQRBFTKFCJT-UHFFFAOYSA-N	0	3	342.817	3.424	20	30		EGEDHN
C#CCCN(C)CCN(C(=O)[C@@H]1C[C@@H]1c1cc(F)ccc1F)C(C)C	ZINC001755815458	1440923227	/nfs/dbraw/zinc/92/32/27/1440923227.db2.gz	LJDHNLOVYMYXIM-SJLPKXTDSA-N	0	3	348.437	3.260	20	30		EGEDHN
C#CCCN(C)CCN(C(=O)CCc1c[nH]c2ccccc12)C(C)C	ZINC001755817319	1440924118	/nfs/dbraw/zinc/92/41/18/1440924118.db2.gz	JMAZROJQCXIPEZ-UHFFFAOYSA-N	0	3	339.483	3.293	20	30		EGEDHN
C=C(C)CN(C)CCN(C(=O)C[C@H]1OCCc2ccccc21)C(C)C	ZINC001755817275	1440924133	/nfs/dbraw/zinc/92/41/33/1440924133.db2.gz	GVUFIMMZRHGECG-HXUWFJFHSA-N	0	3	344.499	3.435	20	30		EGEDHN
CC(C)(C)[C@H](CNCc1cc(C#N)ccc1F)NC(=O)C1=CCCC1	ZINC001755820946	1440925714	/nfs/dbraw/zinc/92/57/14/1440925714.db2.gz	VXMZXRSAIBCJPI-SFHVURJKSA-N	0	3	343.446	3.428	20	30		EGEDHN
C=CCOCC(=O)N[C@@H](CNCc1ccccc1Cl)C(C)(C)C	ZINC001755821935	1440925994	/nfs/dbraw/zinc/92/59/94/1440925994.db2.gz	QYEJTKHNHMJQCR-INIZCTEOSA-N	0	3	338.879	3.163	20	30		EGEDHN
CC(C)(C)[C@@H](CNCC#Cc1ccccc1)NC(=O)[C@H]1C[C@@H]1C(F)F	ZINC001755823976	1440926695	/nfs/dbraw/zinc/92/66/95/1440926695.db2.gz	QKBJRSXZZSHWSB-YESZJQIVSA-N	0	3	348.437	3.060	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@H](CNCc1cncc(F)c1)C(C)(C)C	ZINC001755831330	1440928760	/nfs/dbraw/zinc/92/87/60/1440928760.db2.gz	XHWGNMPTGVNGHJ-RHSMWYFYSA-N	0	3	335.467	3.444	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@H](C)C1CCN(Cc2cn(C)nc2C)CC1	ZINC001755845135	1440932893	/nfs/dbraw/zinc/93/28/93/1440932893.db2.gz	XRKNRXLSAJHULC-QRWLVFNGSA-N	0	3	346.519	3.048	20	30		EGEDHN
CC(C)CC(=O)N(C)C1CC(NCC#Cc2ccccc2Cl)C1	ZINC001755849686	1440934580	/nfs/dbraw/zinc/93/45/80/1440934580.db2.gz	VKDFFZPFCJAZIV-UHFFFAOYSA-N	0	3	332.875	3.317	20	30		EGEDHN
C=CC(C)(C)C(=O)N(C)C1CC(NCc2cccc(C(C)C)n2)C1	ZINC001755860006	1440936553	/nfs/dbraw/zinc/93/65/53/1440936553.db2.gz	OSSLRNVCBVIYQC-UHFFFAOYSA-N	0	3	329.488	3.496	20	30		EGEDHN
CC(F)(F)C(=O)NC1(C2CCN(Cc3ccc(C#N)cc3)CC2)CC1	ZINC001755867427	1440938130	/nfs/dbraw/zinc/93/81/30/1440938130.db2.gz	LZTVCHQBFWSVCI-UHFFFAOYSA-N	0	3	347.409	3.074	20	30		EGEDHN
C=CCOCCN1CC=C(CNC(=O)[C@@H]2CCC=CCCC2)CC1	ZINC001755888777	1440940781	/nfs/dbraw/zinc/94/07/81/1440940781.db2.gz	LQLXPIVJTXGBIP-LJQANCHMSA-N	0	3	332.488	3.074	20	30		EGEDHN
C=C(Cl)Cn1c(CC(C)C)nnc1N1CCN(C(C)(C)C)CC1	ZINC001760376056	1441368000	/nfs/dbraw/zinc/36/80/00/1441368000.db2.gz	CMSMMRKFUZFWQA-UHFFFAOYSA-N	0	3	339.915	3.150	20	30		EGEDHN
CN1CCC(Oc2ccnc(N(CCC#N)C3CCCC3)c2)CC1	ZINC001165016601	721836045	/nfs/dbraw/zinc/83/60/45/721836045.db2.gz	DAYIWQJZEGNZSM-UHFFFAOYSA-N	0	3	328.460	3.217	20	30		EGEDHN
C[C@H]([NH2+][C@@H](C)c1cccc(-c2nnn[n-]2)c1)c1ccc(OCC#N)cc1	ZINC000824529975	946766326	/nfs/dbraw/zinc/76/63/26/946766326.db2.gz	INQXFAZMKOLQBJ-KBPBESRZSA-N	0	3	348.410	3.181	20	30		EGEDHN
N#Cc1cccc(C(=O)N2C[C@H]3CCN(Cc4ccccc4)C[C@H]3C2)c1	ZINC000368130566	168314781	/nfs/dbraw/zinc/31/47/81/168314781.db2.gz	CXNIYPJEVHPZNT-RTWAWAEBSA-N	0	3	345.446	3.152	20	30		EGEDHN
CCN(C(=O)c1cc(C#N)c[nH]1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1	ZINC000368537012	168370191	/nfs/dbraw/zinc/37/01/91/168370191.db2.gz	CSERRSTYGJWPDX-MAUKXSAKSA-N	0	3	336.439	3.184	20	30		EGEDHN
CN(C(=O)Cc1ccc(C#N)cc1)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000173700470	231009124	/nfs/dbraw/zinc/00/91/24/231009124.db2.gz	DPPQYTADKMSSNB-NRFANRHFSA-N	0	3	347.462	3.224	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(c3ccc(Br)cc3)C2)o1	ZINC000174345289	231184373	/nfs/dbraw/zinc/18/43/73/231184373.db2.gz	ZHXUEGKKAFJBGL-ZDUSSCGKSA-N	0	3	346.228	3.282	20	30		EGEDHN
C[C@H]1C[C@@H](N(C)C(=O)c2c[nH]c(C#N)c2)CCN1Cc1ccccc1	ZINC000181306438	234149298	/nfs/dbraw/zinc/14/92/98/234149298.db2.gz	GHKIYDQAHJLRRS-KXBFYZLASA-N	0	3	336.439	3.011	20	30		EGEDHN
Cc1ccc([C@@H](CN[C@H](C)c2cccc(C#N)c2)N2CCOCC2)o1	ZINC000181424002	234182307	/nfs/dbraw/zinc/18/23/07/234182307.db2.gz	RABIMJPLMSACHA-VQIMIIECSA-N	0	3	339.439	3.184	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNc1nc2sccn2c1[N+](=O)[O-])C(C)C	ZINC000023030508	212343312	/nfs/dbraw/zinc/34/33/12/212343312.db2.gz	NQTJATSPNZTXFD-ZDUSSCGKSA-N	0	3	349.460	3.415	20	30		EGEDHN
C#CCCOc1ccc(CNCc2ccnc(N3CCCC3)c2)cc1	ZINC000264946493	247072410	/nfs/dbraw/zinc/07/24/10/247072410.db2.gz	IRHYPEOTLLHFSL-UHFFFAOYSA-N	0	3	335.451	3.374	20	30		EGEDHN
C[C@@H]1[C@H](NC(=O)CCc2ccc(C#N)cc2)CCN1Cc1ccccc1	ZINC000377106462	168984515	/nfs/dbraw/zinc/98/45/15/168984515.db2.gz	SIOHFYPJBHICPW-DYESRHJHSA-N	0	3	347.462	3.270	20	30		EGEDHN
CC[C@H](N[C@@H]1CCN(c2sccc2C#N)C1=O)c1ccccc1	ZINC000267685182	251253156	/nfs/dbraw/zinc/25/31/56/251253156.db2.gz	MXVLRNMZQCYUEW-JKSUJKDBSA-N	0	3	325.437	3.466	20	30		EGEDHN
COC(=O)[C@@](C)(CN[C@H](C)c1cccc(C#N)c1)c1ccc(F)cc1	ZINC000447017702	269707707	/nfs/dbraw/zinc/70/77/07/269707707.db2.gz	PLJJOHYIINFUCK-VLIAUNLRSA-N	0	3	340.398	3.479	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CCCN1C[C@@H](O)c1ccc(C#N)cc1	ZINC000268676148	252128436	/nfs/dbraw/zinc/12/84/36/252128436.db2.gz	LJDQAGVWDYWBOB-PGRDOPGGSA-N	0	3	349.478	3.188	20	30		EGEDHN
C[C@H](Cn1cc(Br)cn1)N[C@H](C)c1ccc(C#N)cc1	ZINC000154332177	224239081	/nfs/dbraw/zinc/23/90/81/224239081.db2.gz	IYXDCRCDXNIXON-VXGBXAGGSA-N	0	3	333.233	3.257	20	30		EGEDHN
C[C@@H](NCc1cccc(CN2CCOCC2)c1)c1cccc(C#N)c1	ZINC000181530592	533452801	/nfs/dbraw/zinc/45/28/01/533452801.db2.gz	WZDZPWRIDFESDO-QGZVFWFLSA-N	0	3	335.451	3.241	20	30		EGEDHN
C[C@@H]1C[C@@H](N(C)C(=O)c2ccc(C#N)[nH]2)CCN1Cc1ccccc1	ZINC000153532148	533588897	/nfs/dbraw/zinc/58/88/97/533588897.db2.gz	IALCATHTUBGMSH-QAPCUYQASA-N	0	3	336.439	3.011	20	30		EGEDHN
COc1ccc(CNCCSCc2ccccc2C#N)cc1C#N	ZINC000174248005	533663868	/nfs/dbraw/zinc/66/38/68/533663868.db2.gz	ZGMDGLCBHSQVFV-UHFFFAOYSA-N	0	3	337.448	3.462	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)NC[C@H](c1ccccc1)N1CCCC1	ZINC000338089853	141091966	/nfs/dbraw/zinc/09/19/66/141091966.db2.gz	SGBWNGGRRVNFDJ-HXUWFJFHSA-N	0	3	333.435	3.434	20	30		EGEDHN
N#Cc1c(F)cccc1C(=O)NC1CCN(Cc2ccccc2)CC1	ZINC000186423623	144133168	/nfs/dbraw/zinc/13/31/68/144133168.db2.gz	MHRLRBMNZZHXDI-UHFFFAOYSA-N	0	3	337.398	3.092	20	30		EGEDHN
CN1CCC(Oc2ccc(CNCc3cc(C#N)cs3)cc2)CC1	ZINC000341282749	155228650	/nfs/dbraw/zinc/22/86/50/155228650.db2.gz	XYUSCFZMTNVXFY-UHFFFAOYSA-N	0	3	341.480	3.383	20	30		EGEDHN
CC[C@H](N[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O)c1cccs1	ZINC000190603725	153150258	/nfs/dbraw/zinc/15/02/58/153150258.db2.gz	MKAHUPVECVACBF-DLBZAZTESA-N	0	3	339.464	3.462	20	30		EGEDHN
Cn1cc(CN2CCC(CN3CCc4ccccc43)CC2)cc1C#N	ZINC000191269109	153185288	/nfs/dbraw/zinc/18/52/88/153185288.db2.gz	JJTPZJJUUXBNAQ-UHFFFAOYSA-N	0	3	334.467	3.171	20	30		EGEDHN
CN(C)CCN(Cc1ncc(Cl)s1)Cc1ccc(C#N)cc1	ZINC000348905607	156283872	/nfs/dbraw/zinc/28/38/72/156283872.db2.gz	RSUPEOADEVVTDO-UHFFFAOYSA-N	0	3	334.876	3.232	20	30		EGEDHN
C[C@H]1CC[C@@H](N(CCO)Cc2ccc(Br)cc2C#N)C1	ZINC000351652867	165116621	/nfs/dbraw/zinc/11/66/21/165116621.db2.gz	TVJZBDYPSYLFNX-BLLLJJGKSA-N	0	3	337.261	3.304	20	30		EGEDHN
N#Cc1ccc(OC[C@H]2CN(Cc3ccccc3)CCCO2)c(F)c1	ZINC000351902791	165143958	/nfs/dbraw/zinc/14/39/58/165143958.db2.gz	KLBXFLIZPIYJQX-GOSISDBHSA-N	0	3	340.398	3.367	20	30		EGEDHN
COc1cc(C#N)ccc1CN1CCC[C@@]1(CO)Cc1ccccc1	ZINC000355671770	166280434	/nfs/dbraw/zinc/28/04/34/166280434.db2.gz	NPRIAHGOLOWVOC-NRFANRHFSA-N	0	3	336.435	3.136	20	30		EGEDHN
N#Cc1ccc(Br)c(CN2CC[C@@H]([C@@H]3CCOC3)C2)c1	ZINC000365192978	168032918	/nfs/dbraw/zinc/03/29/18/168032918.db2.gz	YTEVJGPJBRIWOZ-ZIAGYGMSSA-N	0	3	335.245	3.179	20	30		EGEDHN
C=CCC(CC=C)C(=O)Nc1ccc(CN2CCC(O)CC2)cc1	ZINC000677838345	549340645	/nfs/dbraw/zinc/34/06/45/549340645.db2.gz	DYDXNJAGTBTTCW-UHFFFAOYSA-N	0	3	328.456	3.350	20	30		EGEDHN
COCCN1CCC(Nc2ccc(C(F)(F)F)cc2C#N)CC1	ZINC000122776765	222156301	/nfs/dbraw/zinc/15/63/01/222156301.db2.gz	MCQJDCKGZNSYII-UHFFFAOYSA-N	0	3	327.350	3.100	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N(CC)C[C@H]1CCOC1	ZINC000677885897	549351552	/nfs/dbraw/zinc/35/15/52/549351552.db2.gz	MLSXKQUMNPLUMQ-JKSUJKDBSA-N	0	3	336.501	3.010	20	30		EGEDHN
C[C@@H](N[C@@H]1[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]21)c1ccc(C#N)cc1F	ZINC000497247115	269845310	/nfs/dbraw/zinc/84/53/10/269845310.db2.gz	ZBDXUMWXPDBQNG-LCSDZXHASA-N	0	3	345.418	3.213	20	30		EGEDHN
N#Cc1ccccc1NC(=O)CCN[C@@H]1CCCc2c(O)cccc21	ZINC000411616889	270046536	/nfs/dbraw/zinc/04/65/36/270046536.db2.gz	FVMRHWLBUNTHCI-GOSISDBHSA-N	0	3	335.407	3.260	20	30		EGEDHN
N#Cc1cccc(CN[C@@H](c2ccccc2)C2(CO)CCOCC2)c1	ZINC000412010241	270046565	/nfs/dbraw/zinc/04/65/65/270046565.db2.gz	PXZGGJVDEGYLLD-FQEVSTJZSA-N	0	3	336.435	3.178	20	30		EGEDHN
N#Cc1ccc(F)c(CN2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)c1	ZINC000425502914	270049274	/nfs/dbraw/zinc/04/92/74/270049274.db2.gz	REUJFGLNACAJBX-GHTZIAJQSA-N	0	3	335.426	3.404	20	30		EGEDHN
CSc1ccc([C@H](CNc2cc(C)ncc2C#N)N(C)C)cc1	ZINC000425265408	270049309	/nfs/dbraw/zinc/04/93/09/270049309.db2.gz	DHXSVPJMEVTLNJ-SFHVURJKSA-N	0	3	326.469	3.120	20	30		EGEDHN
Cc1ccc([C@H]2C[C@@H](C)N(CC(=O)NCc3ccc(C#N)cc3)C2)cc1	ZINC000490067231	270056395	/nfs/dbraw/zinc/05/63/95/270056395.db2.gz	XIWAKODNURZHBW-UTKZUKDTSA-N	0	3	347.462	3.361	20	30		EGEDHN
N#Cc1ccc(OC2CCC(NCc3ccncc3Cl)CC2)nc1	ZINC000527688082	270059399	/nfs/dbraw/zinc/05/93/99/270059399.db2.gz	NIZSETXOOKVBAS-UHFFFAOYSA-N	0	3	342.830	3.481	20	30		EGEDHN
CCN1CCCN(c2c(C#N)cnc3ccc(OC(F)F)cc32)CC1	ZINC000267191211	266281573	/nfs/dbraw/zinc/28/15/73/266281573.db2.gz	HKQVUSNNNKMLDV-UHFFFAOYSA-N	0	3	346.381	3.240	20	30		EGEDHN
CCO[C@@H]1C[C@H](NCC(=O)Nc2sccc2C#N)C12CCCCC2	ZINC000279247154	266298240	/nfs/dbraw/zinc/29/82/40/266298240.db2.gz	KTQOQQOKEWAEMJ-LSDHHAIUSA-N	0	3	347.484	3.276	20	30		EGEDHN
CN(C)C[C@@H](NC(=O)c1cc(C#N)cs1)c1ccc(Cl)cc1	ZINC000282803879	266503225	/nfs/dbraw/zinc/50/32/25/266503225.db2.gz	HIAYTNSADGZUDA-CQSZACIVSA-N	0	3	333.844	3.306	20	30		EGEDHN
COc1cc(C)c([C@H](C)NC[C@@H](O)c2ccc(C#N)cc2)cc1OC	ZINC000271817016	266805964	/nfs/dbraw/zinc/80/59/64/266805964.db2.gz	VDGYMPQPZHFIHV-KBXCAEBGSA-N	0	3	340.423	3.268	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@H]1Nc1ccc(C#N)cc1[N+](=O)[O-]	ZINC000302187487	267055195	/nfs/dbraw/zinc/05/51/95/267055195.db2.gz	WHQAGMZWDFAGJE-RDTXWAMCSA-N	0	3	336.395	3.399	20	30		EGEDHN
CCN(CCN1CCCCCC1)C(=O)[C@H](C)c1cccc(C#N)c1	ZINC000462460090	267064604	/nfs/dbraw/zinc/06/46/04/267064604.db2.gz	QRCUERJTVYLHQH-QGZVFWFLSA-N	0	3	327.472	3.386	20	30		EGEDHN
C[C@@H]1[C@H](NC(=O)NCc2cccc(C#N)c2)CCN1Cc1ccccc1	ZINC000287142301	267110327	/nfs/dbraw/zinc/11/03/27/267110327.db2.gz	PVUHYYQCEIPGEW-OXQOHEQNSA-N	0	3	348.450	3.020	20	30		EGEDHN
CCOC(=O)C(C)(C)C1CCN(Cc2ccc(C#N)cc2OC)CC1	ZINC000510140960	267111749	/nfs/dbraw/zinc/11/17/49/267111749.db2.gz	WKLXRZVULNYXPQ-UHFFFAOYSA-N	0	3	344.455	3.368	20	30		EGEDHN
C[C@H](CNC(=O)Nc1ccc(Oc2ccc(C#N)cc2)cc1)N(C)C	ZINC000299330740	267159991	/nfs/dbraw/zinc/15/99/91/267159991.db2.gz	QXYZMNKPSOGPBZ-CQSZACIVSA-N	0	3	338.411	3.422	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)C1CN(C2CCCCC2)C1	ZINC000457478311	267165408	/nfs/dbraw/zinc/16/54/08/267165408.db2.gz	MJUKDQOEDFPQBI-UHFFFAOYSA-N	0	3	327.428	3.160	20	30		EGEDHN
C[C@H](NCC(=O)NCc1ccc(C#N)cc1)C(C)(C)c1ccccc1	ZINC000271824044	267181176	/nfs/dbraw/zinc/18/11/76/267181176.db2.gz	QNWIIIBJFLABEM-INIZCTEOSA-N	0	3	335.451	3.130	20	30		EGEDHN
C[C@H](NCc1cccc(OCCN(C)C)c1)c1ccc(C#N)c(F)c1	ZINC000271975686	267185266	/nfs/dbraw/zinc/18/52/66/267185266.db2.gz	XQPUHESQCNXUME-HNNXBMFYSA-N	0	3	341.430	3.489	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@@H]1Nc1ccc(C#N)cc1[N+](=O)[O-]	ZINC000302187486	267234288	/nfs/dbraw/zinc/23/42/88/267234288.db2.gz	WHQAGMZWDFAGJE-KSSFIOAISA-N	0	3	336.395	3.399	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@H]1Nc1nc2ccccn2c1C#N	ZINC000302175219	267234333	/nfs/dbraw/zinc/23/43/33/267234333.db2.gz	NYTUHYAIWTWTCQ-DOTOQJQBSA-N	0	3	331.423	3.138	20	30		EGEDHN
CN(C)Cc1ccc(C(=O)N[C@@H]2CCCc3cc(C#N)ccc32)cc1	ZINC000416101477	267284713	/nfs/dbraw/zinc/28/47/13/267284713.db2.gz	NFCNHUPZKZUMCI-HXUWFJFHSA-N	0	3	333.435	3.427	20	30		EGEDHN
COC(=O)N1CCC([C@H](C)N[C@@H](C)c2ccc(C#N)cc2F)CC1	ZINC000492554206	267376562	/nfs/dbraw/zinc/37/65/62/267376562.db2.gz	YWJGHPNQLDTDQD-STQMWFEESA-N	0	3	333.407	3.215	20	30		EGEDHN
Cc1ccc(C#N)cc1NC(=O)N[C@H](CN(C)C)c1ccc(F)cc1	ZINC000286884241	267388270	/nfs/dbraw/zinc/38/82/70/267388270.db2.gz	DEAQTUAGYKNKRR-GOSISDBHSA-N	0	3	340.402	3.430	20	30		EGEDHN
Cc1cc(NC(=O)[C@H](C#N)Cc2ccc(C#N)cc2)ccc1CN(C)C	ZINC000458260843	268010683	/nfs/dbraw/zinc/01/06/83/268010683.db2.gz	IOIQOCVIQVWCPF-IBGZPJMESA-N	0	3	346.434	3.249	20	30		EGEDHN
Cc1ccc([C@H]2CCCN2C[C@@H](O)COc2ccc(C#N)cc2)cc1	ZINC000484588631	268045900	/nfs/dbraw/zinc/04/59/00/268045900.db2.gz	GCOUNBSLWDMUIC-TZIWHRDSSA-N	0	3	336.435	3.444	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CC[C@@H](c3ccc(F)cc3)C2)cc1	ZINC000280199800	268090116	/nfs/dbraw/zinc/09/01/16/268090116.db2.gz	UPEIODBMKLQGRI-RTBURBONSA-N	0	3	347.393	3.396	20	30		EGEDHN
N#Cc1ccc(N2CC[C@@H](N[C@@H](c3ccccc3)C3CC3)C2=O)cc1	ZINC000269718556	268123754	/nfs/dbraw/zinc/12/37/54/268123754.db2.gz	WQJMPUQZSSUZBE-UXHICEINSA-N	0	3	331.419	3.404	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCN(C[C@@H]3CCC4(CCCCC4)O3)C2)nc1	ZINC000330223041	268185324	/nfs/dbraw/zinc/18/53/24/268185324.db2.gz	ACHPVOMBYUYZGV-ROUUACIJSA-N	0	3	341.455	3.288	20	30		EGEDHN
N#Cc1ccsc1N1CC[C@@H](N[C@H](c2ccccc2)C2CC2)C1=O	ZINC000298974653	268303730	/nfs/dbraw/zinc/30/37/30/268303730.db2.gz	PGAZLLNQEGXVNI-IAGOWNOFSA-N	0	3	337.448	3.466	20	30		EGEDHN
N#Cc1ccccc1Oc1ccc(NC(=O)N2CCCNCC2)cc1	ZINC000415014306	268305460	/nfs/dbraw/zinc/30/54/60/268305460.db2.gz	WNYHMTNZDGXGCT-UHFFFAOYSA-N	0	3	336.395	3.178	20	30		EGEDHN
CCN1CCN(c2cccc(Nc3snc(C)c3C#N)c2)CC1	ZINC000514885460	269656776	/nfs/dbraw/zinc/65/67/76/269656776.db2.gz	XTJBNJPDOVTOIF-UHFFFAOYSA-N	0	3	327.457	3.209	20	30		EGEDHN
Cc1ccc(C#N)cc1NC(=O)NC[C@@H](Cc1ccccc1)N(C)C	ZINC000069615106	274736281	/nfs/dbraw/zinc/73/62/81/274736281.db2.gz	WMSKAUZRQPXNPO-GOSISDBHSA-N	0	3	336.439	3.161	20	30		EGEDHN
COc1ccccc1[C@H](CN[C@H]1CCc2ccc(C#N)cc21)N(C)C	ZINC000353381318	278062119	/nfs/dbraw/zinc/06/21/19/278062119.db2.gz	FDDXOGBWFWUKLF-PMACEKPBSA-N	0	3	335.451	3.447	20	30		EGEDHN
CN(C)CCN(C)C(=O)Nc1cccc(Oc2ccc(C#N)cc2)c1	ZINC000078569337	307419854	/nfs/dbraw/zinc/41/98/54/307419854.db2.gz	WAXLUQOKHXBBNC-UHFFFAOYSA-N	0	3	338.411	3.376	20	30		EGEDHN
CN(C)CCNC(=O)c1ccc(Oc2ccccc2C#N)c(Cl)c1	ZINC000090067598	307457653	/nfs/dbraw/zinc/45/76/53/307457653.db2.gz	NBMMPCXOSFVGFW-UHFFFAOYSA-N	0	3	343.814	3.295	20	30		EGEDHN
CCC1(CC)[C@H](N[C@H](C)C(=O)Nc2oc(C)c(C)c2C#N)C[C@@H]1OC	ZINC000248837890	308012806	/nfs/dbraw/zinc/01/28/06/308012806.db2.gz	OLLNPMLZXLWQKI-WQVCFCJDSA-N	0	3	347.459	3.278	20	30		EGEDHN
Cc1ccccc1[C@H](NCC(=O)NCc1cccc(C#N)c1)C(C)C	ZINC000537059431	314159175	/nfs/dbraw/zinc/15/91/75/314159175.db2.gz	IFEJPLRYKHJUDP-OAQYLSRUSA-N	0	3	335.451	3.470	20	30		EGEDHN
CN(C)[C@@H](CNC(=O)c1ccc(Cl)c(C#N)c1)c1ccccc1	ZINC000537583058	314191105	/nfs/dbraw/zinc/19/11/05/314191105.db2.gz	CENAQVSETSGIAV-KRWDZBQOSA-N	0	3	327.815	3.244	20	30		EGEDHN
C[C@@H](N[C@@H](CN1CCN(C)CC1)c1ccccc1)c1cccc(C#N)c1	ZINC000539497750	314317389	/nfs/dbraw/zinc/31/73/89/314317389.db2.gz	VFHKMBKZDNXDGN-GCJKJVERSA-N	0	3	348.494	3.198	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)c2cc(C#N)c[nH]2)N(CC)CC)cc1	ZINC000554227049	315304206	/nfs/dbraw/zinc/30/42/06/315304206.db2.gz	YIUYSYRPDMVUKF-LJQANCHMSA-N	0	3	338.455	3.262	20	30		EGEDHN
Cc1csc(NC(=O)N[C@@H](CN(C)C)c2ccc(F)cc2)c1C#N	ZINC000563355657	316004443	/nfs/dbraw/zinc/00/44/43/316004443.db2.gz	MLPHIMSTJVLTEY-HNNXBMFYSA-N	0	3	346.431	3.492	20	30		EGEDHN
N#Cc1ccc(OC[C@@H](O)CN[C@@H]2CCc3sc(Cl)cc32)cc1	ZINC000564651116	316181894	/nfs/dbraw/zinc/18/18/94/316181894.db2.gz	KFEIMZXOGGXDBA-SWLSCSKDSA-N	0	3	348.855	3.290	20	30		EGEDHN
CSc1ccc([C@@H](CNC(=O)NCCCCC#N)N(C)C)cc1	ZINC000297670971	456273383	/nfs/dbraw/zinc/27/33/83/456273383.db2.gz	NVABOBARXQSXBB-MRXNPFEDSA-N	0	3	334.489	3.004	20	30		EGEDHN
CC[C@H](NCCS(=O)(=O)c1ccc(C#N)cc1)c1ccc(C)cc1	ZINC000176880712	323334212	/nfs/dbraw/zinc/33/42/12/323334212.db2.gz	PNRBAXLWANCYMJ-IBGZPJMESA-N	0	3	342.464	3.381	20	30		EGEDHN
C[C@@H](N[C@H]1CCN(C(=O)CCc2ccccc2)C1)c1ccc(C#N)cc1	ZINC000181890126	323510237	/nfs/dbraw/zinc/51/02/37/323510237.db2.gz	BCDFSCFBFHPKPH-UTKZUKDTSA-N	0	3	347.462	3.443	20	30		EGEDHN
N#Cc1ccc(CN[C@@]2(Cc3ccc(Cl)cc3)CCOC2)nc1	ZINC000577505014	324819529	/nfs/dbraw/zinc/81/95/29/324819529.db2.gz	BBBGDYSMYBPOGS-GOSISDBHSA-N	0	3	327.815	3.098	20	30		EGEDHN
C[C@@H](CCC#N)N(C)C[C@H](O)COc1ccccc1C(F)(F)F	ZINC000351269697	457249205	/nfs/dbraw/zinc/24/92/05/457249205.db2.gz	MPWIUEZHHLOUKX-STQMWFEESA-N	0	3	330.350	3.069	20	30		EGEDHN
CC(C)[C@@H](NC(=O)[C@H](N)CCCC#N)c1ccc(Cl)cc1F	ZINC000424169774	458576498	/nfs/dbraw/zinc/57/64/98/458576498.db2.gz	KFAHMRGXGRJJKT-HUUCEWRRSA-N	0	3	325.815	3.314	20	30		EGEDHN
N#CCOc1ccc(CN2CCCN(c3ccccc3C#N)CC2)cc1	ZINC000264568778	455239359	/nfs/dbraw/zinc/23/93/59/455239359.db2.gz	QSRKQTBTWHLKBJ-UHFFFAOYSA-N	0	3	346.434	3.173	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)[C@H](CC)Cc2ccccc2)CC1	ZINC000173196795	455246683	/nfs/dbraw/zinc/24/66/83/455246683.db2.gz	CWWLGFBZRYSAEX-LJQANCHMSA-N	0	3	329.488	3.300	20	30		EGEDHN
C[C@@H](CCCC(F)(F)F)NCCS(=O)(=O)c1ccc(C#N)cc1	ZINC000591764061	459431805	/nfs/dbraw/zinc/43/18/05/459431805.db2.gz	AIPKNQHOGBYDRW-LBPRGKRZSA-N	0	3	348.390	3.043	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN(Cc1ccccc1)CC1CCOCC1	ZINC000264715929	455268447	/nfs/dbraw/zinc/26/84/47/455268447.db2.gz	MBTJBQLTCONXTE-UHFFFAOYSA-N	0	3	342.483	3.116	20	30		EGEDHN
CC[C@@H]1CN(CCC(=O)Nc2ccc(C#N)c(Cl)c2)CCS1	ZINC000173925767	455342028	/nfs/dbraw/zinc/34/20/28/455342028.db2.gz	OLRVEVGKBKZQIU-CQSZACIVSA-N	0	3	337.876	3.368	20	30		EGEDHN
CN(C)C(=O)[C@H]1CCCN1Cc1ccc(-c2ccccc2C#N)cc1	ZINC000012747638	453396595	/nfs/dbraw/zinc/39/65/95/453396595.db2.gz	CWKUYGCFKRZUNM-HXUWFJFHSA-N	0	3	333.435	3.278	20	30		EGEDHN
CC(C)[C@H](CNC(=O)c1cccc(C#N)c1)N1CCc2ccccc2C1	ZINC000025534799	453777279	/nfs/dbraw/zinc/77/72/79/453777279.db2.gz	NVKCOAZMVPAKLV-NRFANRHFSA-N	0	3	347.462	3.371	20	30		EGEDHN
C[C@H](CNc1ccc(C#N)cc1[N+](=O)[O-])N1CCc2ccccc2C1	ZINC000026729894	453804941	/nfs/dbraw/zinc/80/49/41/453804941.db2.gz	HKVFQWMZVJIVJZ-CQSZACIVSA-N	0	3	336.395	3.325	20	30		EGEDHN
N#Cc1ccc(N2CCN(Cc3cccc4ccccc43)CC2)nc1	ZINC000028742402	453824575	/nfs/dbraw/zinc/82/45/75/453824575.db2.gz	RYVSVEZLLFBDIL-UHFFFAOYSA-N	0	3	328.419	3.429	20	30		EGEDHN
C[C@@H](C1CC1)N(CC(=O)N[C@@](C)(C#N)C1CC1)Cc1ccccc1	ZINC000029842508	453832081	/nfs/dbraw/zinc/83/20/81/453832081.db2.gz	FQVAZZISMSYGFQ-YWZLYKJASA-N	0	3	325.456	3.096	20	30		EGEDHN
CCOc1ccc(C2(CNC[C@@H](C#N)CCC#N)CCOCC2)cc1	ZINC000066484194	453848375	/nfs/dbraw/zinc/84/83/75/453848375.db2.gz	YBHILUWVYPXYSU-QGZVFWFLSA-N	0	3	341.455	3.167	20	30		EGEDHN
C[C@@H](CN(C)[C@@H]1CCN(c2ccc(C#N)cc2)C1=O)c1ccccc1	ZINC000066853871	453881033	/nfs/dbraw/zinc/88/10/33/453881033.db2.gz	GFBNKTSKCLWZDV-OXJNMPFZSA-N	0	3	333.435	3.399	20	30		EGEDHN
CCCCOc1ccc(CNCc2cc(C#N)n(C)c2)cc1OC	ZINC000190764068	455379175	/nfs/dbraw/zinc/37/91/75/455379175.db2.gz	FCMRNVVXVKIHDH-UHFFFAOYSA-N	0	3	327.428	3.374	20	30		EGEDHN
N#Cc1cccc(CNCc2c[nH]nc2-c2ccc3c(c2)OCCO3)c1	ZINC000066971968	453891666	/nfs/dbraw/zinc/89/16/66/453891666.db2.gz	DLLPDUMNDUFDHZ-UHFFFAOYSA-N	0	3	346.390	3.009	20	30		EGEDHN
N#CCc1ccc(NC(=O)NCCCN2CCc3ccccc3C2)cc1	ZINC000076084225	453960599	/nfs/dbraw/zinc/96/05/99/453960599.db2.gz	HZLOFQDRZKTQFM-UHFFFAOYSA-N	0	3	348.450	3.323	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2csc(Br)c2)nc(C)n1	ZINC000041560387	453972141	/nfs/dbraw/zinc/97/21/41/453972141.db2.gz	JMCAECKGTLNWDT-JTQLQIEISA-N	0	3	336.214	3.408	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN2CC=C(c3ccc(O)cc3)CC2)c1	ZINC000041895995	453983687	/nfs/dbraw/zinc/98/36/87/453983687.db2.gz	LMZARFNYWDMNKQ-UHFFFAOYSA-N	0	3	347.418	3.382	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CCCN1C(=O)c1ccc(C#N)cc1	ZINC000076389095	453995557	/nfs/dbraw/zinc/99/55/57/453995557.db2.gz	RPRGZKUZYDGFLN-QGZVFWFLSA-N	0	3	333.435	3.295	20	30		EGEDHN
CN(c1ccccc1CN1CCC[C@@](C)(C#N)C1)C1CCN(C)CC1	ZINC000612406469	460622334	/nfs/dbraw/zinc/62/23/34/460622334.db2.gz	MUVWQMBEUUADRO-NRFANRHFSA-N	0	3	340.515	3.343	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccc(F)c(Br)c2)nc(C)n1	ZINC000076822001	454040836	/nfs/dbraw/zinc/04/08/36/454040836.db2.gz	RNWOHHNJVASQSK-LLVKDONJSA-N	0	3	348.175	3.485	20	30		EGEDHN
CC(C)CCOCCN1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC000056282715	454048872	/nfs/dbraw/zinc/04/88/72/454048872.db2.gz	DACJYPKCRMUHKW-UHFFFAOYSA-N	0	3	329.488	3.129	20	30		EGEDHN
CC(C)N(CCN1C(=O)c2ccccc2C1=O)Cc1ccc(C#N)cc1	ZINC000069071309	454077449	/nfs/dbraw/zinc/07/74/49/454077449.db2.gz	NUALJZPDSMMGAH-UHFFFAOYSA-N	0	3	347.418	3.065	20	30		EGEDHN
C=CCSCCNC(=O)N(CC)[C@H]1CCN(Cc2ccccc2)C1	ZINC000159797688	455405297	/nfs/dbraw/zinc/40/52/97/455405297.db2.gz	HSEOIRDKBNVMQI-SFHVURJKSA-N	0	3	347.528	3.212	20	30		EGEDHN
Cc1nnc(NCC2(N3CCSCC3)CCCCC2)c(C#N)c1C	ZINC000069798396	454145749	/nfs/dbraw/zinc/14/57/49/454145749.db2.gz	FQJUIWUBSQNSER-UHFFFAOYSA-N	0	3	345.516	3.129	20	30		EGEDHN
C[C@@H]1CC[C@@H](C)N1CC(=O)NCC#Cc1cccc(C(F)(F)F)c1	ZINC000120214598	454272348	/nfs/dbraw/zinc/27/23/48/454272348.db2.gz	SDTPSVIOMQZGJY-ZIAGYGMSSA-N	0	3	338.373	3.046	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H](CC)C(C)(C)c2ccccc2)CC1	ZINC000120346207	454289280	/nfs/dbraw/zinc/28/92/80/454289280.db2.gz	YPNWZXVZQCCWET-LJQANCHMSA-N	0	3	326.484	3.204	20	30		EGEDHN
CCCCCCCN1CCCN(Cc2nc([C@H](C)OC)no2)CC1	ZINC000246147139	455435839	/nfs/dbraw/zinc/43/58/39/455435839.db2.gz	HEGXJQJUPDXQCB-INIZCTEOSA-N	0	3	338.496	3.255	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)C[C@H](O)COc1ccccc1F	ZINC000061001808	454324343	/nfs/dbraw/zinc/32/43/43/454324343.db2.gz	JZKJYHNDWXFFNM-SFHVURJKSA-N	0	3	342.414	3.349	20	30		EGEDHN
N#Cc1cccc(C(=O)NC[C@H]2CCCN(Cc3ccccc3)C2)c1	ZINC000062231421	454371648	/nfs/dbraw/zinc/37/16/48/454371648.db2.gz	ALWJHGOFHVFCSX-LJQANCHMSA-N	0	3	333.435	3.200	20	30		EGEDHN
C[C@H](c1ccc(F)cc1)N(C)C[C@H](O)COc1ccc(CC#N)cc1	ZINC000073022551	454384153	/nfs/dbraw/zinc/38/41/53/454384153.db2.gz	SOEWMZBSQXOARZ-BEFAXECRSA-N	0	3	342.414	3.324	20	30		EGEDHN
N#Cc1cccc(CNC(=O)NC[C@@H](c2ccccc2)N2CCCC2)c1	ZINC000047948914	454423795	/nfs/dbraw/zinc/42/37/95/454423795.db2.gz	ZZXQFXFPOIUCHB-FQEVSTJZSA-N	0	3	348.450	3.195	20	30		EGEDHN
C[C@H]1CN(CC2CCN(c3ccc(C#N)cc3F)CC2)C[C@H](C)O1	ZINC000091478804	454439858	/nfs/dbraw/zinc/43/98/58/454439858.db2.gz	XUIDBMGYFZMOIC-GJZGRUSLSA-N	0	3	331.435	3.023	20	30		EGEDHN
C[C@@H]1CN(CC2CCN(c3ccc(F)cc3C#N)CC2)C[C@H](C)O1	ZINC000091478914	454440272	/nfs/dbraw/zinc/44/02/72/454440272.db2.gz	DGHVYJPCGKEYAA-GASCZTMLSA-N	0	3	331.435	3.023	20	30		EGEDHN
CC(C)C[C@H](C)NC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000133612960	454445836	/nfs/dbraw/zinc/44/58/36/454445836.db2.gz	GDVBYMIRNRATEB-INIZCTEOSA-N	0	3	330.476	3.066	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H](O)COCc1ccccc1Cl	ZINC000073649447	454463253	/nfs/dbraw/zinc/46/32/53/454463253.db2.gz	YIDVSXLEBYOQGH-SFHVURJKSA-N	0	3	344.842	3.221	20	30		EGEDHN
Cc1noc([C@H]2CCCN(Cc3ccc(O[C@@H](C)C#N)cc3)C2)n1	ZINC000091832559	454477793	/nfs/dbraw/zinc/47/77/93/454477793.db2.gz	JHYUNCCUFRMUPR-BBRMVZONSA-N	0	3	326.400	3.049	20	30		EGEDHN
C[C@H](CNC(=O)N[C@H](CCC#N)c1ccccc1)N1CCC(C)CC1	ZINC000133883059	454478832	/nfs/dbraw/zinc/47/88/32/454478832.db2.gz	NWXLYURQQGCRDC-IEBWSBKVSA-N	0	3	342.487	3.451	20	30		EGEDHN
COc1cc([C@@H](C)NCc2ccc(C#N)cc2)cc(OC)c1OC	ZINC000048367557	454480861	/nfs/dbraw/zinc/48/08/61/454480861.db2.gz	KMKJIBMGJOQRLX-CYBMUJFWSA-N	0	3	326.396	3.435	20	30		EGEDHN
N#CCCCOc1cccc(CN2CCS[C@@H]3COCC[C@@H]32)c1	ZINC000091855946	454481930	/nfs/dbraw/zinc/48/19/30/454481930.db2.gz	OEFOBKUGOKIYIL-ZWKOTPCHSA-N	0	3	332.469	3.075	20	30		EGEDHN
CCC[C@H]1CN(CC#Cc2ccc(Cl)cc2)CCN1CCOC	ZINC000121858995	454485608	/nfs/dbraw/zinc/48/56/08/454485608.db2.gz	HTNXPOLUIPXLFJ-IBGZPJMESA-N	0	3	334.891	3.124	20	30		EGEDHN
C=CCc1cc(CN2CC[C@H](C)[C@@H](n3ccnc3)C2)cc(OC)c1O	ZINC000091960231	454496399	/nfs/dbraw/zinc/49/63/99/454496399.db2.gz	ZOORBVLCWJIVIH-YJBOKZPZSA-N	0	3	341.455	3.409	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)[C@@H](C)CCSCC)CC1	ZINC000074130072	454535320	/nfs/dbraw/zinc/53/53/20/454535320.db2.gz	COCIKTQJNOWPLV-HNNXBMFYSA-N	0	3	327.538	3.200	20	30		EGEDHN
N#CC(C(=O)COc1ccc(F)cc1)C(=O)Nc1ccccc1Cl	ZINC000103504490	454561682	/nfs/dbraw/zinc/56/16/82/454561682.db2.gz	PRYGVDCWVGOCLN-CYBMUJFWSA-N	0	3	346.745	3.205	20	30		EGEDHN
C=CCNC(=O)c1ccc(NC(=O)[C@H](C(C)C)N2CCCCC2)cc1	ZINC000104287792	454581424	/nfs/dbraw/zinc/58/14/24/454581424.db2.gz	BTRQXNWVEZICAV-SFHVURJKSA-N	0	3	343.471	3.051	20	30		EGEDHN
CN(C(=O)c1cccc(CC#N)c1)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000074445838	454582081	/nfs/dbraw/zinc/58/20/81/454582081.db2.gz	SGRURXZXZKQXDV-NRFANRHFSA-N	0	3	347.462	3.489	20	30		EGEDHN
N#CC(C(=O)CCc1c[nH]c2ccccc12)C(=O)NC1CCCCC1	ZINC000050678893	454594463	/nfs/dbraw/zinc/59/44/63/454594463.db2.gz	HZXFXMSXYCDQIE-KRWDZBQOSA-N	0	3	337.423	3.258	20	30		EGEDHN
C#CCCOc1ccc(CN2CCC[C@@H](CNC(=O)C(C)C)C2)cc1	ZINC000092706343	454614193	/nfs/dbraw/zinc/61/41/93/454614193.db2.gz	MJGUALOKMJUYNW-IBGZPJMESA-N	0	3	342.483	3.073	20	30		EGEDHN
N#CCc1ccc(OC[C@@H](O)CN(Cc2cccs2)C2CC2)cc1	ZINC000051407816	454622914	/nfs/dbraw/zinc/62/29/14/454622914.db2.gz	DPMYLMZPEJNJEC-KRWDZBQOSA-N	0	3	342.464	3.218	20	30		EGEDHN
Cc1ccsc1C(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000065931218	454641288	/nfs/dbraw/zinc/64/12/88/454641288.db2.gz	XBNOBSLKTDJPMF-UHFFFAOYSA-N	0	3	327.453	3.132	20	30		EGEDHN
CN(CCCCc1ccccc1)CC(=O)NC1(C#N)CCCCC1	ZINC000052037126	454650342	/nfs/dbraw/zinc/65/03/42/454650342.db2.gz	BMVLOVGZHMSTPO-UHFFFAOYSA-N	0	3	327.472	3.284	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC000106037973	454675869	/nfs/dbraw/zinc/67/58/69/454675869.db2.gz	MNFMYUBJFFSBLB-UHFFFAOYSA-N	0	3	326.362	3.476	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C)CCOc2ccccc2C)CC1	ZINC000106276022	454689782	/nfs/dbraw/zinc/68/97/82/454689782.db2.gz	ANGWSNNHQZEDER-UHFFFAOYSA-N	0	3	345.487	3.056	20	30		EGEDHN
COC[C@H]1CCCN(Cc2cn(CCC#N)nc2-c2ccccc2)C1	ZINC000093337445	454704705	/nfs/dbraw/zinc/70/47/05/454704705.db2.gz	LBKOWNCHKUNMDO-KRWDZBQOSA-N	0	3	338.455	3.322	20	30		EGEDHN
N#CC(CCN1CCC(C(N)=O)CC1)(c1ccccc1)c1ccccc1	ZINC000176155145	454705464	/nfs/dbraw/zinc/70/54/64/454705464.db2.gz	DHUXUHWYMJNHAM-UHFFFAOYSA-N	0	3	347.462	3.084	20	30		EGEDHN
CC(C)(CCC#N)CN(CCO)Cc1cnn(Cc2ccccc2)c1	ZINC000093359135	454708308	/nfs/dbraw/zinc/70/83/08/454708308.db2.gz	PLCZFWNQASUORI-UHFFFAOYSA-N	0	3	340.471	3.056	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C[C@H](C)c2ccc(OC)cc2)CC1	ZINC000176285792	454722792	/nfs/dbraw/zinc/72/27/92/454722792.db2.gz	NIIBCZYMQZNENH-INIZCTEOSA-N	0	3	330.472	3.346	20	30		EGEDHN
COc1ccc(CNC[C@@H](c2ccco2)N2CCCC2)cc1C#N	ZINC000124928165	454783239	/nfs/dbraw/zinc/78/32/39/454783239.db2.gz	HGTOGTMRRQCUMU-KRWDZBQOSA-N	0	3	325.412	3.087	20	30		EGEDHN
CC(C)n1cnnc1[C@@H]1CCCN(Cc2ccc(OCC#N)cc2)C1	ZINC000266931668	455477485	/nfs/dbraw/zinc/47/74/85/455477485.db2.gz	OSMDWNNUFCBLRL-QGZVFWFLSA-N	0	3	339.443	3.141	20	30		EGEDHN
Cc1cccc([C@H]2CCCN2CCC(=O)Nc2ccccc2C#N)n1	ZINC000140301322	454818352	/nfs/dbraw/zinc/81/83/52/454818352.db2.gz	QLRBOUNYAZLDAC-LJQANCHMSA-N	0	3	334.423	3.427	20	30		EGEDHN
CN(CCCNC(=O)c1ccc(C#N)c(Cl)c1)Cc1ccccc1	ZINC000153848977	454840069	/nfs/dbraw/zinc/84/00/69/454840069.db2.gz	LVMMRXBYMSUWCG-UHFFFAOYSA-N	0	3	341.842	3.464	20	30		EGEDHN
CCN(CCc1nc2ccccc2c(=O)[nH]1)[C@@H](C)c1ccc(C#N)cc1	ZINC000125745641	454843816	/nfs/dbraw/zinc/84/38/16/454843816.db2.gz	UAAMXCAVJHUECZ-HNNXBMFYSA-N	0	3	346.434	3.420	20	30		EGEDHN
C=CC1CCN(C(=O)[C@@H]2CCCN(Cc3cccc(F)c3)C2)CC1	ZINC000110969594	454854692	/nfs/dbraw/zinc/85/46/92/454854692.db2.gz	JAGYGWRUYQTJIO-GOSISDBHSA-N	0	3	330.447	3.462	20	30		EGEDHN
Cc1ccc(Cl)cc1C(=O)C(C#N)c1nnc2n1CCCCC2	ZINC000126305995	454884435	/nfs/dbraw/zinc/88/44/35/454884435.db2.gz	XCXJXJPGYKDOOT-AWEZNQCLSA-N	0	3	328.803	3.456	20	30		EGEDHN
Cc1ccccc1[C@@H](C(C)C)N(C)CC(=O)N(CCC#N)CCC#N	ZINC000112357891	454885513	/nfs/dbraw/zinc/88/55/13/454885513.db2.gz	ZGLCOHOQXYZEDD-HXUWFJFHSA-N	0	3	340.471	3.280	20	30		EGEDHN
C[C@H](NCC1(Sc2ccccc2)CCCC1)C(=O)N(C)CCC#N	ZINC000112546441	454890282	/nfs/dbraw/zinc/89/02/82/454890282.db2.gz	ZXPAODNEQXVNLT-INIZCTEOSA-N	0	3	345.512	3.442	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1ccccc1[N+](=O)[O-])C(C)C	ZINC000112919961	454906129	/nfs/dbraw/zinc/90/61/29/454906129.db2.gz	XJVCNRCYHOQLKE-KRWDZBQOSA-N	0	3	331.416	3.023	20	30		EGEDHN
N#CCC[C@@H](NC(=O)N1CCN(C2CCCC2)CC1)c1ccccc1	ZINC000160668358	455486235	/nfs/dbraw/zinc/48/62/35/455486235.db2.gz	RPZBEVOESKPIDQ-LJQANCHMSA-N	0	3	340.471	3.301	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H]2CCC[C@H](SCC)C2)CC1	ZINC000175742331	455490392	/nfs/dbraw/zinc/49/03/92/455490392.db2.gz	AOBPSFADCKIULG-CVEARBPZSA-N	0	3	325.522	3.000	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@H](NCc1ccc(C#N)cc1F)C1CC1	ZINC000178791757	454977630	/nfs/dbraw/zinc/97/76/30/454977630.db2.gz	UZAUTHXPSODPQQ-MRXNPFEDSA-N	0	3	333.407	3.090	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cccc(-c3ccccn3)c2C)CC1	ZINC000178860242	454985247	/nfs/dbraw/zinc/98/52/47/454985247.db2.gz	AAQGPGOQCKCBQQ-UHFFFAOYSA-N	0	3	335.451	3.437	20	30		EGEDHN
CCO[C@@H]1CCCN(Cc2cn(CCC#N)nc2-c2ccccc2)C1	ZINC000155485564	455007410	/nfs/dbraw/zinc/00/74/10/455007410.db2.gz	SFUQQCFZVJEDOF-LJQANCHMSA-N	0	3	338.455	3.465	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@H](C)CN1CCCCC1	ZINC000171039076	455019237	/nfs/dbraw/zinc/01/92/37/455019237.db2.gz	AKWMGARLLVNQCL-QGZVFWFLSA-N	0	3	342.487	3.353	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@@H](OC(C)(C)C)c2ccccc2)CC1	ZINC000179248211	455024550	/nfs/dbraw/zinc/02/45/50/455024550.db2.gz	HINRMAUQKPCVBD-SFHVURJKSA-N	0	3	330.472	3.309	20	30		EGEDHN
N#CCN(C(=O)[C@H]1CCCN(Cc2cccc(F)c2)C1)C1CCCC1	ZINC000128236872	455038021	/nfs/dbraw/zinc/03/80/21/455038021.db2.gz	JHMGOYCMCPJPIK-KRWDZBQOSA-N	0	3	343.446	3.332	20	30		EGEDHN
CCN(CC(=O)Nc1ccc2c(c1)OCCO2)CC(C)(C)CCC#N	ZINC000179605298	455061566	/nfs/dbraw/zinc/06/15/66/455061566.db2.gz	ANRBLXSUMQRQBD-UHFFFAOYSA-N	0	3	345.443	3.048	20	30		EGEDHN
C=CC[C@@H](C)NC(=O)NC[C@H](c1cccc(OC)c1)N(CC)CC	ZINC000116938362	455075587	/nfs/dbraw/zinc/07/55/87/455075587.db2.gz	DSYKKUHLPOXCBR-CRAIPNDOSA-N	0	3	333.476	3.342	20	30		EGEDHN
CCC1(CC)[C@H](N[C@@H](C)C(=O)Nc2ccccc2C#N)[C@@H](C)[C@@H]1OC	ZINC000179794410	455080177	/nfs/dbraw/zinc/08/01/77/455080177.db2.gz	IWGZCTNEZVNCDP-NONVJHHQSA-N	0	3	343.471	3.315	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2c[nH]nc2-c2ccc(Cl)cc2)CC1	ZINC000171721245	455088633	/nfs/dbraw/zinc/08/86/33/455088633.db2.gz	ZANYBXCLVCTOKQ-UHFFFAOYSA-N	0	3	344.846	3.110	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)CCc2ccc(OC)cc2)CC1	ZINC000117876938	455094646	/nfs/dbraw/zinc/09/46/46/455094646.db2.gz	YURYBEFUQNRHEY-UHFFFAOYSA-N	0	3	330.472	3.128	20	30		EGEDHN
C[C@@H](C#N)CSc1ccccc1NC(=O)N1CCN2CCC[C@@H]2C1	ZINC000171894973	455101000	/nfs/dbraw/zinc/10/10/00/455101000.db2.gz	ZEVWGLBGKJECMR-LSDHHAIUSA-N	0	3	344.484	3.250	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@H](C)Oc2ccc(F)cc2Cl)CC1	ZINC000171976377	455105338	/nfs/dbraw/zinc/10/53/38/455105338.db2.gz	VYURFFNXAUQFEV-LBPRGKRZSA-N	0	3	340.826	3.013	20	30		EGEDHN
COc1ccc([C@H](CO)N(C)CCCOc2cccc(C#N)c2)cc1	ZINC000156385466	455112059	/nfs/dbraw/zinc/11/20/59/455112059.db2.gz	YDNXQUIAKYUUNG-FQEVSTJZSA-N	0	3	340.423	3.001	20	30		EGEDHN
CC[C@H](NCC(=O)N(CC)C[C@@H](C)C#N)C(C)(C)c1ccccc1	ZINC000180008293	455114882	/nfs/dbraw/zinc/11/48/82/455114882.db2.gz	BIEOAUYTNJTDPB-WMZOPIPTSA-N	0	3	329.488	3.341	20	30		EGEDHN
C=C(C)COc1cc(CN[C@@H]2Cc3ccccc3[C@H]2O)ccc1OC	ZINC000172068078	455117124	/nfs/dbraw/zinc/11/71/24/455117124.db2.gz	YVOSOWCUXXQGLR-WIYYLYMNSA-N	0	3	339.435	3.398	20	30		EGEDHN
COCc1cccc(CNCc2cn(C)nc2-c2ccc(C#N)cc2)c1	ZINC000180053328	455123482	/nfs/dbraw/zinc/12/34/82/455123482.db2.gz	KSRKWYZWYZPBDI-UHFFFAOYSA-N	0	3	346.434	3.395	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCSC[C@H]2c2ccccc2)CC1	ZINC000172151046	455128932	/nfs/dbraw/zinc/12/89/32/455128932.db2.gz	OYHJOTVVAQZVGX-SFHVURJKSA-N	0	3	345.512	3.137	20	30		EGEDHN
CO[C@H](CNCc1cn(C)nc1-c1ccc(C#N)cc1)c1ccccc1	ZINC000180104291	455132944	/nfs/dbraw/zinc/13/29/44/455132944.db2.gz	KTKQREMGUWMUIP-HXUWFJFHSA-N	0	3	346.434	3.436	20	30		EGEDHN
C[C@H]1C[C@H](N(C)C(=O)NCCCCC#N)CCN1Cc1ccccc1	ZINC000172582845	455162908	/nfs/dbraw/zinc/16/29/08/455162908.db2.gz	WARYDSSVAAGEGZ-PKOBYXMFSA-N	0	3	342.487	3.375	20	30		EGEDHN
C=C(C)CN(C)C(=O)[C@@]1(C(F)(F)F)CCN(Cc2ccccc2)C1	ZINC000180434624	455169144	/nfs/dbraw/zinc/16/91/44/455169144.db2.gz	SGWGEOCOFLGVAY-QGZVFWFLSA-N	0	3	340.389	3.476	20	30		EGEDHN
N#CCSCCCN1CCC[C@H](n2ccc(C(F)(F)F)n2)C1	ZINC000182839734	455175691	/nfs/dbraw/zinc/17/56/91/455175691.db2.gz	RTBBCPCPIXCAIO-LBPRGKRZSA-N	0	3	332.395	3.186	20	30		EGEDHN
C[C@@H](c1ccc(-n2cncn2)cc1)N(C)Cc1ccc(OCC#N)cc1	ZINC000264089151	455190248	/nfs/dbraw/zinc/19/02/48/455190248.db2.gz	FQOKMJFBXXXDAI-INIZCTEOSA-N	0	3	347.422	3.363	20	30		EGEDHN
Cc1nccn1-c1ccc(CNCc2ccc(O[C@H](C)C#N)cc2)cn1	ZINC000237599980	455197486	/nfs/dbraw/zinc/19/74/86/455197486.db2.gz	RRBAXACWYHCALW-OAHLLOKOSA-N	0	3	347.422	3.156	20	30		EGEDHN
CCS[C@@H]1CCCC[C@H]1NCC(=O)N(C)C1(C#N)CCCCC1	ZINC000189506136	455209514	/nfs/dbraw/zinc/20/95/14/455209514.db2.gz	OWNFGUJKJGQTND-HZPDHXFCSA-N	0	3	337.533	3.325	20	30		EGEDHN
C=CCOCCCC(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1	ZINC000172918463	455209690	/nfs/dbraw/zinc/20/96/90/455209690.db2.gz	ILEOTYJONBSMPU-IBGZPJMESA-N	0	3	330.472	3.231	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC[C@H](C)c2ccc(F)cc2)CC1	ZINC000264429686	455211317	/nfs/dbraw/zinc/21/13/17/455211317.db2.gz	ZINQEKRJSADSQH-HNNXBMFYSA-N	0	3	333.451	3.269	20	30		EGEDHN
C=C(C)CS(=O)(=O)NCc1ccccc1CN1CCCC[C@H]1C	ZINC000189532677	455215483	/nfs/dbraw/zinc/21/54/83/455215483.db2.gz	WMRQJQINYAKULZ-MRXNPFEDSA-N	0	3	336.501	3.057	20	30		EGEDHN
N#Cc1cccc(OC2CCN(C[C@@H](O)C3CCCCC3)CC2)c1	ZINC000190517655	455336689	/nfs/dbraw/zinc/33/66/89/455336689.db2.gz	SRPZDMKFLDCHBF-HXUWFJFHSA-N	0	3	328.456	3.343	20	30		EGEDHN
COc1cccc2c1OC[C@H](N[C@H](C)c1ccc(OCC#N)cc1)C2	ZINC000181679771	455370851	/nfs/dbraw/zinc/37/08/51/455370851.db2.gz	NLKNSXWPDGBODQ-RHSMWYFYSA-N	0	3	338.407	3.252	20	30		EGEDHN
C[C@H](C#N)Oc1ccccc1NC(=O)NC[C@@H](C)N1CCC(C)CC1	ZINC000184356586	455373010	/nfs/dbraw/zinc/37/30/10/455373010.db2.gz	LPYFXVJBZKFORK-HZPDHXFCSA-N	0	3	344.459	3.219	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@@H](CCNCc2ccc(C#N)o2)C1	ZINC000174372223	455383683	/nfs/dbraw/zinc/38/36/83/455383683.db2.gz	OJEOVUCMVHWJOP-AWEZNQCLSA-N	0	3	333.432	3.278	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cc(CCc3ccccc3)ccn2)CC1	ZINC000175222947	455427802	/nfs/dbraw/zinc/42/78/02/455427802.db2.gz	VCYMJUPRNWNCPE-UHFFFAOYSA-N	0	3	347.462	3.151	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CC2(CCN(C)CC2)Oc2ccccc21	ZINC000175227968	455428792	/nfs/dbraw/zinc/42/87/92/455428792.db2.gz	JXLAJHOBGDEZGI-QGZVFWFLSA-N	0	3	328.456	3.447	20	30		EGEDHN
C=C(C)[C@H](NC(=O)NC[C@@H](C)N(C)C1CC1)c1ccc(F)c(F)c1	ZINC000184705988	455432413	/nfs/dbraw/zinc/43/24/13/455432413.db2.gz	DDZRZPUCWTVDLY-PXAZEXFGSA-N	0	3	337.414	3.364	20	30		EGEDHN
C=CCOCCCC(=O)N1c2ccc(C)cc2[C@@H]2CN(C)CC[C@H]21	ZINC000266660796	455432933	/nfs/dbraw/zinc/43/29/33/455432933.db2.gz	LSBMJZFVGQDXIY-PKOBYXMFSA-N	0	3	328.456	3.112	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC[C@@H](c3ccccc3)[C@@H]2C)CC1	ZINC000175439454	455448944	/nfs/dbraw/zinc/44/89/44/455448944.db2.gz	VTGCREMQYDCTSF-QFBILLFUSA-N	0	3	327.472	3.224	20	30		EGEDHN
Cc1ccc(Cl)c(OC[C@@H](O)CN(C)Cc2cccc(C#N)c2)c1	ZINC000182194148	455457851	/nfs/dbraw/zinc/45/78/51/455457851.db2.gz	UOWQALKHAWBULR-KRWDZBQOSA-N	0	3	344.842	3.392	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@]2(C)Cc2ccccc2)CC1	ZINC000184868714	455464075	/nfs/dbraw/zinc/46/40/75/455464075.db2.gz	FOEXWWGZUXIXGB-OAQYLSRUSA-N	0	3	341.499	3.444	20	30		EGEDHN
CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000160490170	455465877	/nfs/dbraw/zinc/46/58/77/455465877.db2.gz	KZKAHRVRTLOIHC-QYZOEREBSA-N	0	3	340.471	3.300	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H](CC)Oc2ccccc2F)CC1	ZINC000175588330	455467331	/nfs/dbraw/zinc/46/73/31/455467331.db2.gz	GRGBDBFZCTWVCC-QGZVFWFLSA-N	0	3	334.435	3.140	20	30		EGEDHN
C=CCCCC(=O)Nc1ccc(C(=O)N(C)[C@@H]2CCCN(C)C2)cc1	ZINC000175834185	455503990	/nfs/dbraw/zinc/50/39/90/455503990.db2.gz	VLKILBZTGCFIMC-GOSISDBHSA-N	0	3	343.471	3.148	20	30		EGEDHN
CC[C@@]1(CO)CCCN1Cc1ccc(OC)c(OCCCC#N)c1	ZINC000191957305	455534809	/nfs/dbraw/zinc/53/48/09/455534809.db2.gz	JTTNETCBSVDVPS-IBGZPJMESA-N	0	3	332.444	3.115	20	30		EGEDHN
CN(Cc1ccccc1)[C@H](CNC(=O)c1cc(C#N)cs1)C1CC1	ZINC000185341189	455544046	/nfs/dbraw/zinc/54/40/46/455544046.db2.gz	LURFHZLQEHIEPR-QGZVFWFLSA-N	0	3	339.464	3.260	20	30		EGEDHN
N#CCc1ccccc1C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000601020512	460677363	/nfs/dbraw/zinc/67/73/63/460677363.db2.gz	RRMZVKOKSVHWIB-IBGZPJMESA-N	0	3	347.462	3.395	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@@H](C)N1CC[C@@H](c2ccccc2OC)C1	ZINC000606452645	460678103	/nfs/dbraw/zinc/67/81/03/460678103.db2.gz	FWTDHGUIRGYHJR-IAGOWNOFSA-N	0	3	330.472	3.298	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@H](C2CCCC2)C(F)(F)F)CC1	ZINC000185500317	455568417	/nfs/dbraw/zinc/56/84/17/455568417.db2.gz	AZZLSQCTPFRGOT-CQSZACIVSA-N	0	3	333.398	3.057	20	30		EGEDHN
Cc1ccc(CN[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)cc1C	ZINC000192242835	455580176	/nfs/dbraw/zinc/58/01/76/455580176.db2.gz	YLMQLDLLISYTAT-HXUWFJFHSA-N	0	3	333.435	3.066	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)c1ccoc1Cl	ZINC000192276203	455586265	/nfs/dbraw/zinc/58/62/65/455586265.db2.gz	VKAVWEWRNVPJHM-UHFFFAOYSA-N	0	3	331.803	3.009	20	30		EGEDHN
C#CCCCC(=O)N(CCN(C)C)Cc1cccc(C(F)(F)F)c1	ZINC000192310037	455590130	/nfs/dbraw/zinc/59/01/30/455590130.db2.gz	ADRUOZQKMVMARA-UHFFFAOYSA-N	0	3	340.389	3.399	20	30		EGEDHN
Cn1nccc1C1=C[C@H]2CC[C@@H](C1)N2CCCOc1cccc(C#N)c1	ZINC000283808802	455597445	/nfs/dbraw/zinc/59/74/45/455597445.db2.gz	WYLHFBYCQVEZRX-MOPGFXCFSA-N	0	3	348.450	3.381	20	30		EGEDHN
CCN1CCN(Cc2ccc(N[C@@H]3CCC[C@@H](C#N)C3)cc2)CC1	ZINC000185726462	455607810	/nfs/dbraw/zinc/60/78/10/455607810.db2.gz	AZYBRJQHFXAQOQ-UYAOXDASSA-N	0	3	326.488	3.318	20	30		EGEDHN
Cc1cccnc1CN1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000271398328	455622870	/nfs/dbraw/zinc/62/28/70/455622870.db2.gz	STGAWVIWZVHYCX-UHFFFAOYSA-N	0	3	334.423	3.112	20	30		EGEDHN
C[C@H](N[C@@H]1CCC[C@H](C#N)C1)c1cc(F)ccc1N1CCN(C)CC1	ZINC000185821903	455628742	/nfs/dbraw/zinc/62/87/42/455628742.db2.gz	KKODVTATIYYGEC-XYJFISCASA-N	0	3	344.478	3.310	20	30		EGEDHN
C=CCC[C@H](NC(=O)N1CC[C@]2(CCN(C)C2)C1)c1ccccc1	ZINC000292509007	455682605	/nfs/dbraw/zinc/68/26/05/455682605.db2.gz	HLZVEHFEAXKEGR-ICSRJNTNSA-N	0	3	327.472	3.431	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2CN[C@@H]2CCC[C@H](C#N)C2)C[C@H](C)O1	ZINC000192754298	455686201	/nfs/dbraw/zinc/68/62/01/455686201.db2.gz	MOQMQPGIXYAQMU-TWFHAPMSSA-N	0	3	341.499	3.468	20	30		EGEDHN
C[C@@H](NCC1(c2ccc(F)cc2F)CCCC1)C(=O)N(C)CCC#N	ZINC000186064215	455687571	/nfs/dbraw/zinc/68/75/71/455687571.db2.gz	SCAKPVDECANSDT-CQSZACIVSA-N	0	3	349.425	3.127	20	30		EGEDHN
CCN(C(=O)C1CCN(C2CC2)CC1)c1ccc(C#N)c(Cl)c1	ZINC000192775322	455689978	/nfs/dbraw/zinc/68/99/78/455689978.db2.gz	ZGUNPMKNNRBNNQ-UHFFFAOYSA-N	0	3	331.847	3.439	20	30		EGEDHN
C[C@H](NCc1ccc(OCC#N)cc1)[C@@H]1OCCc2sccc21	ZINC000292562160	455697579	/nfs/dbraw/zinc/69/75/79/455697579.db2.gz	ZIDYNVQASALXQR-UGSOOPFHSA-N	0	3	328.437	3.443	20	30		EGEDHN
CCN(CC)[C@@H](CNc1nccc(C#N)c1[N+](=O)[O-])c1ccsc1	ZINC000268491644	455697688	/nfs/dbraw/zinc/69/76/88/455697688.db2.gz	NUMSFWFEJSXRLR-AWEZNQCLSA-N	0	3	345.428	3.418	20	30		EGEDHN
CC(C)(C)C1CCC(C#N)(NC(=O)C2CCN(C3CC3)CC2)CC1	ZINC000192841951	455704970	/nfs/dbraw/zinc/70/49/70/455704970.db2.gz	MYEVCCUXHKHCSK-UHFFFAOYSA-N	0	3	331.504	3.476	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC(CCN2C[C@@H](C)O[C@@H](C)C2)CC1	ZINC000248643183	455724392	/nfs/dbraw/zinc/72/43/92/455724392.db2.gz	YTCQFXHLXZYVJG-KURKYZTESA-N	0	3	336.520	3.327	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(CN[C@@H]3CCC[C@@H](C#N)C3)cc2)C[C@@H](C)O1	ZINC000248801454	455731839	/nfs/dbraw/zinc/73/18/39/455731839.db2.gz	JSNWOHOTYCJEJL-DEPWHIHDSA-N	0	3	341.499	3.468	20	30		EGEDHN
COC(=O)[C@@H]1CCN(Cc2cccc(OCCCC#N)c2)C[C@@H]1C	ZINC000248873508	455735988	/nfs/dbraw/zinc/73/59/88/455735988.db2.gz	BSEDVFSKDMNKTD-MAUKXSAKSA-N	0	3	330.428	3.000	20	30		EGEDHN
COC(=O)[C@H]1CC12CCN(Cc1ccccc1C(C)(C)C#N)CC2	ZINC000268945985	455740449	/nfs/dbraw/zinc/74/04/49/455740449.db2.gz	CRINNHQRSHENKX-QGZVFWFLSA-N	0	3	326.440	3.263	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N(CC)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000186335872	455746022	/nfs/dbraw/zinc/74/60/22/455746022.db2.gz	MGJPHMKQOMZBCJ-IEBWSBKVSA-N	0	3	330.472	3.091	20	30		EGEDHN
N#Cc1ccccc1CSCCNCc1cnn(CC(F)F)c1	ZINC000293006551	455769639	/nfs/dbraw/zinc/76/96/39/455769639.db2.gz	OEGUCFRZUQZHFG-UHFFFAOYSA-N	0	3	336.411	3.043	20	30		EGEDHN
CC[C@H](c1ccccc1)[C@H]1CCCN1CC(=O)N[C@](C)(C#N)C1CC1	ZINC000250201595	455785612	/nfs/dbraw/zinc/78/56/12/455785612.db2.gz	DECMFDLUVBZDCK-SFHLNBCPSA-N	0	3	339.483	3.453	20	30		EGEDHN
CCO[C@@H]1C[C@](CO)(NCc2cccc(OCCCC#N)c2)C1(C)C	ZINC000186582658	455798577	/nfs/dbraw/zinc/79/85/77/455798577.db2.gz	KCZGJFBGFPKSSZ-UYAOXDASSA-N	0	3	346.471	3.025	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CN(Cc2ccccc2)CCCO1	ZINC000278702170	455845885	/nfs/dbraw/zinc/84/58/85/455845885.db2.gz	TVTVCNZTADIGMY-JOCHJYFZSA-N	0	3	349.478	3.281	20	30		EGEDHN
C=CCCOCCNCc1ccc(C(=O)OCc2ccccc2)[nH]1	ZINC000295415436	455849093	/nfs/dbraw/zinc/84/90/93/455849093.db2.gz	NLQQFDZXQUFTNY-UHFFFAOYSA-N	0	3	328.412	3.054	20	30		EGEDHN
C=CCN1CCC(NC(=O)C[C@@H](C)c2c[nH]c3ccccc32)CC1	ZINC000279067579	455857309	/nfs/dbraw/zinc/85/73/09/455857309.db2.gz	QPYKLQYFXADRHK-OAHLLOKOSA-N	0	3	325.456	3.428	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NC1CCN(Cc2ccccc2C)CC1)OCC	ZINC000270015726	455857704	/nfs/dbraw/zinc/85/77/04/455857704.db2.gz	HDOMODVHSKSNDI-FQEVSTJZSA-N	0	3	344.499	3.447	20	30		EGEDHN
Cc1oc(NC(=O)[C@H](C)N[C@H]2C[C@H](OC(C)C)C2(C)C)c(C#N)c1C	ZINC000296047518	455867792	/nfs/dbraw/zinc/86/77/92/455867792.db2.gz	FNRGNTKENVESRF-RCBQFDQVSA-N	0	3	347.459	3.277	20	30		EGEDHN
C[C@](C#N)(NC(=O)CN1C[C@H](c2ccccc2)[C@H]2CCC[C@H]21)C1CC1	ZINC000285556019	455868764	/nfs/dbraw/zinc/86/87/64/455868764.db2.gz	VASZZBPICGREMP-ANTGDGSKSA-N	0	3	337.467	3.063	20	30		EGEDHN
CN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(C(C)(C)C#N)cc2)C1	ZINC000280084715	455887471	/nfs/dbraw/zinc/88/74/71/455887471.db2.gz	YJELIIUTXBYLLX-WMZOPIPTSA-N	0	3	325.456	3.044	20	30		EGEDHN
C[C@@H](NCCn1cc(Br)cn1)c1ccc(C#N)c(F)c1	ZINC000285646374	455888133	/nfs/dbraw/zinc/88/81/33/455888133.db2.gz	LHZYFKFEHKWQDJ-SNVBAGLBSA-N	0	3	337.196	3.007	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@]1(CCC)CCOC1	ZINC000285666533	455893454	/nfs/dbraw/zinc/89/34/54/455893454.db2.gz	TXZDLMDGVLUZJV-GOSISDBHSA-N	0	3	334.485	3.452	20	30		EGEDHN
CCN(Cc1ccc(CN(C)C)cc1)C(=O)c1ccc(CC#N)cc1	ZINC000270256765	455913740	/nfs/dbraw/zinc/91/37/40/455913740.db2.gz	CJPBCMOWDRRYRL-UHFFFAOYSA-N	0	3	335.451	3.477	20	30		EGEDHN
CCOc1cc(C#N)cc(Cl)c1OC(=O)C1CCN(C2CC2)CC1	ZINC000195306827	455942573	/nfs/dbraw/zinc/94/25/73/455942573.db2.gz	JKJMHBMUNBHNIS-UHFFFAOYSA-N	0	3	348.830	3.390	20	30		EGEDHN
C=CCC[C@H](NCCCNC(=O)c1cccc(O)c1)c1ccco1	ZINC000285987235	455954426	/nfs/dbraw/zinc/95/44/26/455954426.db2.gz	HYLYJLPNXJERGU-KRWDZBQOSA-N	0	3	328.412	3.402	20	30		EGEDHN
C=CCC[C@H](O)CN(CCc1ccccn1)Cc1ccc(OC)cc1	ZINC000280361230	455955104	/nfs/dbraw/zinc/95/51/04/455955104.db2.gz	JSTWJSOUPJIDCO-FQEVSTJZSA-N	0	3	340.467	3.462	20	30		EGEDHN
C#CCOc1ccc(CN[C@H](C)c2ccc(C(=O)N(C)C)cc2)cc1	ZINC000296508100	455958508	/nfs/dbraw/zinc/95/85/08/455958508.db2.gz	PIURYTZUCQBUHO-MRXNPFEDSA-N	0	3	336.435	3.251	20	30		EGEDHN
CC(C)(CNC(=O)C(C#N)Cc1ccc(C#N)cc1)c1cccc(F)c1	ZINC000280397021	455963697	/nfs/dbraw/zinc/96/36/97/455963697.db2.gz	KQJCMGAWDPXZPE-QGZVFWFLSA-N	0	3	349.409	3.474	20	30		EGEDHN
C=CCOc1ccc(CN2CCNC[C@H]2c2ccncc2)cc1Cl	ZINC000261930102	455973115	/nfs/dbraw/zinc/97/31/15/455973115.db2.gz	CQLXJSYSIHYFKL-SFHVURJKSA-N	0	3	343.858	3.446	20	30		EGEDHN
CCS[C@H]1CCC[C@@H]1NCC(=O)N(CCC#N)c1ccccc1	ZINC000286205522	455999458	/nfs/dbraw/zinc/99/94/58/455999458.db2.gz	QHNZXVIQVZLGJQ-IRXDYDNUSA-N	0	3	331.485	3.197	20	30		EGEDHN
C=CCC[C@H](O)CN[C@H](CO)c1ccc(Cl)cc1C(F)(F)F	ZINC000280732913	456041298	/nfs/dbraw/zinc/04/12/98/456041298.db2.gz	LKDIKKULYFNPAS-SMDDNHRTSA-N	0	3	337.769	3.309	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N[C@@H]2CCCC2(C)C)cc1	ZINC000287382975	456068310	/nfs/dbraw/zinc/06/83/10/456068310.db2.gz	RRZRLMCTDNENFR-SWLSCSKDSA-N	0	3	349.456	3.073	20	30		EGEDHN
C[C@@H]1[C@@H](NC(=O)C2(C#N)CCCCC2)CCN1Cc1ccccc1	ZINC000288246293	456091005	/nfs/dbraw/zinc/09/10/05/456091005.db2.gz	OPLZSUMYMLMEIP-AEFFLSMTSA-N	0	3	325.456	3.240	20	30		EGEDHN
C=CCS(=O)(=O)CCN[C@H](c1ccc(F)cc1)C1CCCC1	ZINC000272871268	456095934	/nfs/dbraw/zinc/09/59/34/456095934.db2.gz	OQAJSRBWQKZJDJ-KRWDZBQOSA-N	0	3	325.449	3.247	20	30		EGEDHN
COc1ccsc1CN1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC000271038493	456106623	/nfs/dbraw/zinc/10/66/23/456106623.db2.gz	KZNNKMWDFQEFTH-UHFFFAOYSA-N	0	3	341.480	3.336	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cc(Cl)c(Cl)cc2F)CC1	ZINC000281098644	456132093	/nfs/dbraw/zinc/13/20/93/456132093.db2.gz	PVWHCUNZKDUVLR-UHFFFAOYSA-N	0	3	329.202	3.416	20	30		EGEDHN
C[C@@H](N[C@@H]1[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]21)c1ccc(C#N)c(F)c1	ZINC000297323102	456185819	/nfs/dbraw/zinc/18/58/19/456185819.db2.gz	NNLXOIGGICWKBX-LCSDZXHASA-N	0	3	345.418	3.213	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000297333087	456187853	/nfs/dbraw/zinc/18/78/53/456187853.db2.gz	AJFAKWCDOZJPOY-UHFFFAOYSA-N	0	3	330.472	3.032	20	30		EGEDHN
N#CC1(C(=O)N2CCCN(CCCc3ccccc3)CC2)CCCC1	ZINC000263794537	456225900	/nfs/dbraw/zinc/22/59/00/456225900.db2.gz	KSSOUKIDDTVRTE-UHFFFAOYSA-N	0	3	339.483	3.237	20	30		EGEDHN
Cc1ccc([C@H](C)[NH2+][C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)c([O-])c1	ZINC000273475496	456233426	/nfs/dbraw/zinc/23/34/26/456233426.db2.gz	SSWURHJMYXCYTA-HNAYVOBHSA-N	0	3	349.434	3.419	20	30		EGEDHN
COc1cc(CNC[C@@](C)(O)c2ccccc2Cl)ccc1C#N	ZINC000281460533	456241058	/nfs/dbraw/zinc/24/10/58/456241058.db2.gz	AWFYGGGNGUSCHB-GOSISDBHSA-N	0	3	330.815	3.218	20	30		EGEDHN
Cc1ccnc(OC2CCN(CCCC3(C#N)CCOCC3)CC2)c1	ZINC000281471691	456243249	/nfs/dbraw/zinc/24/32/49/456243249.db2.gz	VYZQPUWFVWIXMZ-UHFFFAOYSA-N	0	3	343.471	3.334	20	30		EGEDHN
C=C(C)COc1cc(CNCc2cccc(CO)c2)ccc1OC	ZINC000237240111	456252006	/nfs/dbraw/zinc/25/20/06/456252006.db2.gz	HAPIVVDXDYJMIW-UHFFFAOYSA-N	0	3	327.424	3.432	20	30		EGEDHN
Cc1ccncc1CCCN1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC000347686582	456305142	/nfs/dbraw/zinc/30/51/42/456305142.db2.gz	SXNBQUPVFIOJOG-UHFFFAOYSA-N	0	3	348.494	3.402	20	30		EGEDHN
CN(C)[C@H](CNc1cc(C#N)ccc1[N+](=O)[O-])c1ccc(F)cc1	ZINC000302233848	456324865	/nfs/dbraw/zinc/32/48/65/456324865.db2.gz	ZQSQZZCBCFZBDA-QGZVFWFLSA-N	0	3	328.347	3.320	20	30		EGEDHN
C=CC[C@@H](CC)NC(=O)CCCN1CCN(c2ccccc2)CC1	ZINC000337088003	456325872	/nfs/dbraw/zinc/32/58/72/456325872.db2.gz	GSQLVSLOSSZRHO-GOSISDBHSA-N	0	3	329.488	3.060	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCCc2ccc3[nH]ccc3c2)CC1	ZINC000281870668	456344872	/nfs/dbraw/zinc/34/48/72/456344872.db2.gz	OTIRFGLCFYBHIG-UHFFFAOYSA-N	0	3	340.471	3.050	20	30		EGEDHN
C=C(C)COc1cc(CN(C)CCCn2ccnc2)ccc1OC	ZINC000290647558	456394331	/nfs/dbraw/zinc/39/43/31/456394331.db2.gz	YZEAUDKGLRTFJS-UHFFFAOYSA-N	0	3	329.444	3.369	20	30		EGEDHN
C=CCN1CC[C@H](N2CCCCC[C@@H]2C[C@@H](O)c2cccs2)C1=O	ZINC000282134142	456422334	/nfs/dbraw/zinc/42/23/34/456422334.db2.gz	YYRMEZUIXKOFGO-IXDOHACOSA-N	0	3	348.512	3.203	20	30		EGEDHN
C=C[C@@H](CC(=O)N(CCCOC)C1CCN(C)CC1)c1ccccc1	ZINC000290821021	456437251	/nfs/dbraw/zinc/43/72/51/456437251.db2.gz	BTEIWBJUVZOJAJ-SFHVURJKSA-N	0	3	344.499	3.306	20	30		EGEDHN
C=CCNC(=O)c1ccc(NC[C@@H](c2ccc(C)cc2)N(C)C)nc1	ZINC000353000362	456440164	/nfs/dbraw/zinc/44/01/64/456440164.db2.gz	MVLYFMUOBBOCDP-SFHVURJKSA-N	0	3	338.455	3.021	20	30		EGEDHN
N#Cc1ncn(CCNCc2ccc(-c3ccc(Cl)cc3)cc2)n1	ZINC000353040401	456455541	/nfs/dbraw/zinc/45/55/41/456455541.db2.gz	UGUVVFYHDPZAJN-UHFFFAOYSA-N	0	3	337.814	3.260	20	30		EGEDHN
CN(Cc1ccc(F)c(F)c1)C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000348092327	456472007	/nfs/dbraw/zinc/47/20/07/456472007.db2.gz	XEMPULPRHBAPPD-MRXNPFEDSA-N	0	3	339.345	3.177	20	30		EGEDHN
C[C@H](C(=O)N(C)CCC#N)N1CCC(C)(c2ccc(Cl)cc2)CC1	ZINC000348192858	456527846	/nfs/dbraw/zinc/52/78/46/456527846.db2.gz	JXDJRRABJCOQLA-OAHLLOKOSA-N	0	3	347.890	3.454	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN[C@H](C)c1ccc2n[nH]cc2c1	ZINC000353221677	456570633	/nfs/dbraw/zinc/57/06/33/456570633.db2.gz	ZIABGLYNBSGWDU-CYBMUJFWSA-N	0	3	336.395	3.173	20	30		EGEDHN
CCc1nc(C#N)cc(N[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)n1	ZINC000308170299	456572099	/nfs/dbraw/zinc/57/20/99/456572099.db2.gz	QEUJBZVRTUBYQO-DOTOQJQBSA-N	0	3	335.455	3.376	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H]2CCO[C@H]2c2nccn2C)cc1Cl	ZINC000343386616	456580621	/nfs/dbraw/zinc/58/06/21/456580621.db2.gz	GUZJGQOWIDONFF-NVXWUHKLSA-N	0	3	347.846	3.258	20	30		EGEDHN
C[C@H](N[C@H]1CCN(C(=O)Cc2ccccc2)C1)c1ccc(C#N)cc1	ZINC000340628678	456583328	/nfs/dbraw/zinc/58/33/28/456583328.db2.gz	ZEGSQFKBRZAINI-JXFKEZNVSA-N	0	3	333.435	3.052	20	30		EGEDHN
CN(Cc1cc(C#N)n(C)c1)[C@H]1CCO[C@H](c2ccc(F)cc2)C1	ZINC000276809918	456587669	/nfs/dbraw/zinc/58/76/69/456587669.db2.gz	XQCMMBIXFGHGHZ-HKUYNNGSSA-N	0	3	327.403	3.388	20	30		EGEDHN
CC[C@H](c1ccccc1)N(CC)CC(=O)N(CCC#N)CCC#N	ZINC000299402747	456682238	/nfs/dbraw/zinc/68/22/38/456682238.db2.gz	MQVXFTQCBPXEEP-GOSISDBHSA-N	0	3	326.444	3.116	20	30		EGEDHN
CC(C)(C)CN(CCC#N)C[C@@H]1CCN(C(=O)c2ccccc2)C1	ZINC000283137203	456719977	/nfs/dbraw/zinc/71/99/77/456719977.db2.gz	NSXQNRSUVHYJBC-KRWDZBQOSA-N	0	3	327.472	3.410	20	30		EGEDHN
Cc1cn2c(n1)[C@H](CNC(=O)[C@H]1CCCN1C1CCCC1)CCC2	ZINC000328662988	456731894	/nfs/dbraw/zinc/73/18/94/456731894.db2.gz	XSCHFVKRRLNNHS-DOTOQJQBSA-N	0	3	330.476	3.432	20	30		EGEDHN
CC(C)[C@@H](NC(=O)C1CCN(C2CC2)CC1)c1nnc2ccccn21	ZINC000328768115	456756894	/nfs/dbraw/zinc/75/68/94/456756894.db2.gz	QDXAXDSWBDMHDE-QGZVFWFLSA-N	0	3	341.459	3.257	20	30		EGEDHN
CC(C)(C)C(=O)NC[C@@H]1CCCN(C(=O)C2CCN(C3CC3)CC2)C1	ZINC000328769558	456757187	/nfs/dbraw/zinc/75/71/87/456757187.db2.gz	QTUCAHIQVFWJJA-HNNXBMFYSA-N	0	3	349.519	3.102	20	30		EGEDHN
O=C(CCC(=O)N1CCC[C@@H]1CN1CCCCC1)NC1CCCC1	ZINC000328796697	456762688	/nfs/dbraw/zinc/76/26/88/456762688.db2.gz	UZZOATQRFDZEKH-QGZVFWFLSA-N	0	3	335.492	3.143	20	30		EGEDHN
O=C(CN1CCC[C@H]1C1CCC1)NC(=O)Nc1ccc2c(c1)OCO2	ZINC000328911633	456789549	/nfs/dbraw/zinc/78/95/49/456789549.db2.gz	GNWFMKIQMJZURA-AWEZNQCLSA-N	0	3	345.399	3.182	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN1C[C@@H](C)C[C@@H]1c1cccc(OC)c1	ZINC000344023691	456790045	/nfs/dbraw/zinc/79/00/45/456790045.db2.gz	BDNWJPSLBWSEDW-QFBILLFUSA-N	0	3	328.456	3.279	20	30		EGEDHN
CN(C)Cc1ccccc1CNC(=O)c1cc(C#N)ccc1Cl	ZINC000348690107	456817492	/nfs/dbraw/zinc/81/74/92/456817492.db2.gz	XAWVTBVEASVOKB-UHFFFAOYSA-N	0	3	327.815	3.203	20	30		EGEDHN
C=CC[C@@H](CO)CNCc1c(C)nn(Cc2ccc(C)cc2)c1C	ZINC000341258881	456827544	/nfs/dbraw/zinc/82/75/44/456827544.db2.gz	LMWBKCUXBAPJHM-LJQANCHMSA-N	0	3	327.472	3.131	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2cnc3c(F)ccc(F)c3c2)nc(C)n1	ZINC000344727764	456852621	/nfs/dbraw/zinc/85/26/21/456852621.db2.gz	MBHOBGXLDRMXJB-ZDUSSCGKSA-N	0	3	338.317	3.410	20	30		EGEDHN
CC(C)C[C@H](C(=O)N[C@@H](C)C1=CCN(C)CC1)N1CCCCC1=O	ZINC000329259855	456863501	/nfs/dbraw/zinc/86/35/01/456863501.db2.gz	AIHJMHAAZLHEDS-DOTOQJQBSA-N	0	3	335.492	3.021	20	30		EGEDHN
C=CCOc1ccc(CN(CCNC(C)=O)C2CCSCC2)cc1	ZINC000339002408	456895637	/nfs/dbraw/zinc/89/56/37/456895637.db2.gz	SIPXVLSFYOKFDA-UHFFFAOYSA-N	0	3	348.512	3.085	20	30		EGEDHN
O=C(CN1CCC[C@H](c2n[nH]c(C3CCCCC3)n2)C1)NCC1CC1	ZINC000329491979	456899081	/nfs/dbraw/zinc/89/90/81/456899081.db2.gz	VVJDOCRXZACZKG-INIZCTEOSA-N	0	3	345.491	3.398	20	30		EGEDHN
COc1cc(CN[C@@H]2CCCc3cc(C#N)ccc32)cc(OC)c1O	ZINC000341693730	456902700	/nfs/dbraw/zinc/90/27/00/456902700.db2.gz	LULKQUMDKZINKE-QGZVFWFLSA-N	0	3	338.407	3.448	20	30		EGEDHN
CC(C)Oc1ccc([C@H](C)N[C@H](C)C(=O)NC2(C#N)CCC2)cc1	ZINC000345040038	456906421	/nfs/dbraw/zinc/90/64/21/456906421.db2.gz	ZDDWLUPCHSTHAY-LSDHHAIUSA-N	0	3	329.444	3.075	20	30		EGEDHN
CN(C(=O)C1CCC(NC(=O)C2CCCC2)CC1)[C@H]1CCCN(C)C1	ZINC000329741190	456934576	/nfs/dbraw/zinc/93/45/76/456934576.db2.gz	VUQGHCZFYHNBEZ-ABHNRTSZSA-N	0	3	349.519	3.245	20	30		EGEDHN
COC1(CCN2CCN([C@H](C#N)c3cccc(Cl)c3)CC2)CCC1	ZINC000339141936	456960938	/nfs/dbraw/zinc/96/09/38/456960938.db2.gz	VGYSCJKNMXMQBB-GOSISDBHSA-N	0	3	347.890	3.481	20	30		EGEDHN
C[C@H]1[C@H](NC(=O)Nc2cccc(C#Cc3ccccn3)c2)CCCN1C	ZINC000345306729	456974050	/nfs/dbraw/zinc/97/40/50/456974050.db2.gz	YUCPLFPXZYDIHW-OXJNMPFZSA-N	0	3	348.450	3.086	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@H](Nc2ncc([N+](=O)[O-])cc2C#N)C1	ZINC000341925350	457004777	/nfs/dbraw/zinc/00/47/77/457004777.db2.gz	HSYWLPUYYRMQEE-BBRMVZONSA-N	0	3	337.383	3.109	20	30		EGEDHN
O=C(Nc1ccccc1)[C@@H]1CCCN(C(=O)[C@H]2CCCN2C2CC2)C1	ZINC000330220270	457006213	/nfs/dbraw/zinc/00/62/13/457006213.db2.gz	QBURSQNRYPWEAR-CRAIPNDOSA-N	0	3	341.455	3.140	20	30		EGEDHN
C=CCCC1(C(=O)NC2CCN([C@@H](C)c3ccncc3)CC2)CC1	ZINC000356513436	457030642	/nfs/dbraw/zinc/03/06/42/457030642.db2.gz	KGAKFTFMEABSPL-INIZCTEOSA-N	0	3	327.472	3.470	20	30		EGEDHN
C=C[C@@](C)(O)CC(=O)NC[C@@H](c1ccc(Cl)cc1)N(C)CCC	ZINC000358925618	457037715	/nfs/dbraw/zinc/03/77/15/457037715.db2.gz	DUDCNYZDNJZMBP-FUHWJXTLSA-N	0	3	338.879	3.166	20	30		EGEDHN
CCN(Cc1cnc2ccc(C#N)cn12)[C@H](COC)Cc1ccccc1	ZINC000354062317	457038222	/nfs/dbraw/zinc/03/82/22/457038222.db2.gz	YPUGVZWSTSUOKQ-IBGZPJMESA-N	0	3	348.450	3.286	20	30		EGEDHN
COc1cc(OC)cc(Oc2cccc(CNC(=O)C(C)C#N)c2)c1	ZINC000359093009	457051967	/nfs/dbraw/zinc/05/19/67/457051967.db2.gz	BECNEXYXUSAIAY-CYBMUJFWSA-N	0	3	340.379	3.272	20	30		EGEDHN
CN(CCN(C)C1CC1)C(=O)c1cccc(Nc2ccc(C#N)cc2)c1	ZINC000354091677	457056604	/nfs/dbraw/zinc/05/66/04/457056604.db2.gz	JLVHZODNVCKENY-UHFFFAOYSA-N	0	3	348.450	3.468	20	30		EGEDHN
CCS[C@@H]1CCCC[C@@H]1N[C@H](C)C(=O)N[C@@](C)(C#N)C(C)C	ZINC000346601675	457071031	/nfs/dbraw/zinc/07/10/31/457071031.db2.gz	HNXSBLRMVFVCJA-DLTWYDFYSA-N	0	3	325.522	3.083	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N(C)[C@H]1CCN(Cc2ccccc2)C1)OCC	ZINC000339452041	457124576	/nfs/dbraw/zinc/12/45/76/457124576.db2.gz	UEHRFQCFCQGSDI-RBUKOAKNSA-N	0	3	330.472	3.091	20	30		EGEDHN
C[C@H]1C[C@@H](c2cccnc2)N(CCC(=O)Nc2ccc(C#N)cc2)C1	ZINC000359867969	457136642	/nfs/dbraw/zinc/13/66/42/457136642.db2.gz	HDIVNIRRQIYZCU-KXBFYZLASA-N	0	3	334.423	3.365	20	30		EGEDHN
C[C@@H](CC1CCOCC1)CN1CCN(Cc2ccc(C#N)cc2)CC1	ZINC000350011591	457142277	/nfs/dbraw/zinc/14/22/77/457142277.db2.gz	MCHXQABCXJOKPQ-SFHVURJKSA-N	0	3	341.499	3.129	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCN1C	ZINC000331228317	457150399	/nfs/dbraw/zinc/15/03/99/457150399.db2.gz	GIKWNQXQXGPSLV-BXKDBHETSA-N	0	3	345.321	3.401	20	30		EGEDHN
CC(C)Cc1ccc([C@@H](CNC(=O)c2ccc(C#N)[nH]2)N(C)C)cc1	ZINC000359929639	457154355	/nfs/dbraw/zinc/15/43/55/457154355.db2.gz	KKIDDFYAXQCNHE-LJQANCHMSA-N	0	3	338.455	3.118	20	30		EGEDHN
Cc1cc(CN2CCC(C(=O)N3CCC[C@@H](C)C3)CC2)ccc1C#N	ZINC000362924164	457157918	/nfs/dbraw/zinc/15/79/18/457157918.db2.gz	NNGOKMFBHJCEEL-MRXNPFEDSA-N	0	3	339.483	3.337	20	30		EGEDHN
Cc1cc(Cl)c(NC(=O)NCC2(O)CCN(C)CC2)cc1Cl	ZINC000331307122	457164656	/nfs/dbraw/zinc/16/46/56/457164656.db2.gz	XEZWWFPMZRQPTC-UHFFFAOYSA-N	0	3	346.258	3.084	20	30		EGEDHN
Cn1c2ccccc2nc1C(C)(C)NCCCC1(C#N)CCOCC1	ZINC000331439538	457185841	/nfs/dbraw/zinc/18/58/41/457185841.db2.gz	RIVJYBNIARLWBW-UHFFFAOYSA-N	0	3	340.471	3.499	20	30		EGEDHN
CN(C)CCN(Cc1cccc(Cl)c1)C(=O)c1ccc(C#N)s1	ZINC000362992016	457187520	/nfs/dbraw/zinc/18/75/20/457187520.db2.gz	FQNJNJYSTJKMEM-UHFFFAOYSA-N	0	3	347.871	3.477	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)NC[C@@H]1CCCSC1)C(C)C	ZINC000350745430	457204243	/nfs/dbraw/zinc/20/42/43/457204243.db2.gz	BNXRJKUICNTKQX-DLBZAZTESA-N	0	3	339.549	3.127	20	30		EGEDHN
C[C@@H](C(=O)N(CCC#N)c1ccccc1)N1CC[C@H](CC2CC2)C1	ZINC000339681344	457210683	/nfs/dbraw/zinc/21/06/83/457210683.db2.gz	HERNQSOYXUTWPP-FUHWJXTLSA-N	0	3	325.456	3.444	20	30		EGEDHN
CC(C#N)C(=O)NCC1(c2cccc(C(F)(F)F)c2)CCOCC1	ZINC000347082169	457221353	/nfs/dbraw/zinc/22/13/53/457221353.db2.gz	YELTYNUPQNQTAU-GFCCVEGCSA-N	0	3	340.345	3.029	20	30		EGEDHN
CC(C#N)C(=O)NC[C@@H](C)Sc1ccc(Br)cc1	ZINC000347102740	457229546	/nfs/dbraw/zinc/22/95/46/457229546.db2.gz	HZPZJJBKUOWYBZ-VHSXEESVSA-N	0	3	327.247	3.206	20	30		EGEDHN
C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)CN1[C@H](C)CC[C@H]1C	ZINC000342455165	457312839	/nfs/dbraw/zinc/31/28/39/457312839.db2.gz	CXYLTLODRRDEMH-IAGOWNOFSA-N	0	3	332.492	3.242	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN2CC[C@@H](C)[C@H]2CC)cc1	ZINC000360477751	457313748	/nfs/dbraw/zinc/31/37/48/457313748.db2.gz	LOMZJOYWGJFZIK-VQIMIIECSA-N	0	3	343.471	3.452	20	30		EGEDHN
CN(C)Cc1cccc(C(=O)Nc2cc(C#N)ccc2NC2CC2)c1	ZINC000355393923	457370629	/nfs/dbraw/zinc/37/06/29/457370629.db2.gz	QALMUSGVERWWGN-UHFFFAOYSA-N	0	3	334.423	3.446	20	30		EGEDHN
N#CC[C@H](CC(=O)N1CC[C@H](N2CCCCC2)C1)c1ccccc1	ZINC000355806678	457420350	/nfs/dbraw/zinc/42/03/50/457420350.db2.gz	CFACSLRMYULFKI-MOPGFXCFSA-N	0	3	325.456	3.161	20	30		EGEDHN
CN(C)CCN(Cc1cccc(F)c1)c1nccc(C#N)c1Cl	ZINC000342637871	457420580	/nfs/dbraw/zinc/42/05/80/457420580.db2.gz	RBWVOWOAMASVFA-UHFFFAOYSA-N	0	3	332.810	3.314	20	30		EGEDHN
CSCC[C@@H](N[C@@H]1CCCCc2cc(C#N)ccc21)C(=O)N(C)C	ZINC000352505185	457423271	/nfs/dbraw/zinc/42/32/71/457423271.db2.gz	YSRJKQSCQHLBPR-QZTJIDSGSA-N	0	3	345.512	3.125	20	30		EGEDHN
CC[C@@H](C(=O)N(Cc1cccc(C(F)(F)F)c1)[C@H](C)C#N)N(C)C	ZINC000425091059	457435753	/nfs/dbraw/zinc/43/57/53/457435753.db2.gz	WJSHEZPQMBCDFW-DOMZBBRYSA-N	0	3	341.377	3.286	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)c1nccc(C#N)c1Cl	ZINC000342670316	457443063	/nfs/dbraw/zinc/44/30/63/457443063.db2.gz	FLXSLUCUSOEMQZ-UHFFFAOYSA-N	0	3	339.830	3.047	20	30		EGEDHN
Cc1nsc(N2CC[C@H](C)N(Cc3ccccc3)CC2)c1C#N	ZINC000342778125	457519878	/nfs/dbraw/zinc/51/98/78/457519878.db2.gz	CGNBPSOYQVADEG-AWEZNQCLSA-N	0	3	326.469	3.424	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NC[C@@]1(C)CCN(Cc2ccccc2)C1)OCC	ZINC000374254045	457545155	/nfs/dbraw/zinc/54/51/55/457545155.db2.gz	CIHPUJXKCOCJBB-PZJWPPBQSA-N	0	3	344.499	3.386	20	30		EGEDHN
CCN1CCCC[C@@H]1CNC(=O)N(C)[C@@H](C)c1cccc(C#N)c1	ZINC000425449057	457557822	/nfs/dbraw/zinc/55/78/22/457557822.db2.gz	WHYNZWHWUQOFMG-MAUKXSAKSA-N	0	3	328.460	3.135	20	30		EGEDHN
C=C(C)COc1cc(CNC2(CC(=O)OC)CCC2)ccc1OC	ZINC000347641754	457570675	/nfs/dbraw/zinc/57/06/75/457570675.db2.gz	BJBIBOQAJCIEEH-UHFFFAOYSA-N	0	3	333.428	3.226	20	30		EGEDHN
CC(C)[C@@H]1CN(C)CCN1CC#Cc1ccc(OC(F)(F)F)cc1	ZINC000425484125	457572969	/nfs/dbraw/zinc/57/29/69/457572969.db2.gz	SDCYFWPRFRMHCO-KRWDZBQOSA-N	0	3	340.389	3.209	20	30		EGEDHN
CC1CCC(N2CCN(c3ccc(C#N)c([N+](=O)[O-])c3)CC2)CC1	ZINC000357533092	457583782	/nfs/dbraw/zinc/58/37/82/457583782.db2.gz	PMACTHIEVIUYDR-UHFFFAOYSA-N	0	3	328.416	3.167	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N1CC[C@@H]([C@@H]2CCOC2)C1	ZINC000374407420	457616050	/nfs/dbraw/zinc/61/60/50/457616050.db2.gz	VSPAHJOEIIZXPP-GVDBMIGSSA-N	0	3	348.512	3.010	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N1CC[C@H]([C@H]2CCOC2)C1	ZINC000374407421	457616320	/nfs/dbraw/zinc/61/63/20/457616320.db2.gz	VSPAHJOEIIZXPP-ULQDDVLXSA-N	0	3	348.512	3.010	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCS[C@H](c3ccccc3)C2)CC1	ZINC000361154634	457617712	/nfs/dbraw/zinc/61/77/12/457617712.db2.gz	RJGJABDPWMKNHG-SFHVURJKSA-N	0	3	345.512	3.137	20	30		EGEDHN
CN1C[C@@H](NC(=O)c2ccc(C3(C#N)CC3)cc2)[C@@H](c2ccccc2)C1	ZINC000370344615	457625260	/nfs/dbraw/zinc/62/52/60/457625260.db2.gz	YTSYVTRXZAKMRG-WOJBJXKFSA-N	0	3	345.446	3.069	20	30		EGEDHN
CN1CC[C@H]2[C@H](CCCN2C(=O)C(C)(C)Cc2ccc(C#N)cc2)C1	ZINC000410596353	457650652	/nfs/dbraw/zinc/65/06/52/457650652.db2.gz	ZCXPNGINICOURV-MOPGFXCFSA-N	0	3	339.483	3.070	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2cccc(OC(F)(F)F)c2)nc(C)n1	ZINC000357814894	457700216	/nfs/dbraw/zinc/70/02/16/457700216.db2.gz	USUMFTKHBBBODY-ZDUSSCGKSA-N	0	3	335.285	3.482	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Nc1cnn(C(F)F)c1)C(C)C	ZINC000357834038	457705088	/nfs/dbraw/zinc/70/50/88/457705088.db2.gz	YGAIPOQCTJKQEZ-AWEZNQCLSA-N	0	3	341.406	3.098	20	30		EGEDHN
N#C[C@H](c1cccc(Cl)c1)N1CCN(CCC2CCOCC2)CC1	ZINC000433194288	457774333	/nfs/dbraw/zinc/77/43/33/457774333.db2.gz	VOZCNGFKJVSCSB-LJQANCHMSA-N	0	3	347.890	3.339	20	30		EGEDHN
C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)Nc1ccc(C#N)cc1Cl	ZINC000426134024	457776675	/nfs/dbraw/zinc/77/66/75/457776675.db2.gz	QDQNMYDIJFDQHH-OLZOCXBDSA-N	0	3	334.851	3.454	20	30		EGEDHN
C[C@@H](CNC(=O)C(C#N)CCc1ccccc1)N(C)c1ccccc1	ZINC000433225745	457783567	/nfs/dbraw/zinc/78/35/67/457783567.db2.gz	JWBWMUMBBJNKJQ-HKUYNNGSSA-N	0	3	335.451	3.400	20	30		EGEDHN
CN1CCN(C(=O)C(C#N)CCc2ccccc2)[C@@H](c2ccccc2)C1	ZINC000433231282	457785219	/nfs/dbraw/zinc/78/52/19/457785219.db2.gz	XPUIGLUFEVAETQ-NHCUHLMSSA-N	0	3	347.462	3.274	20	30		EGEDHN
COc1ccc(CN2CC[C@H](C)C[C@@H]2[C@@H](C)O)cc1OCCCC#N	ZINC000443783629	457810201	/nfs/dbraw/zinc/81/02/01/457810201.db2.gz	DIDYYXXVQSAYTP-LZLYRXPVSA-N	0	3	346.471	3.359	20	30		EGEDHN
Cc1noc(C)c1[C@@H](C)CNC(=O)C(C#N)CCc1ccccc1	ZINC000433378976	457825129	/nfs/dbraw/zinc/82/51/29/457825129.db2.gz	WRHGBXIKCVTTFB-SUMWQHHRSA-N	0	3	325.412	3.284	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N[C@H](CCO)C1CCCCC1	ZINC000433382358	457826878	/nfs/dbraw/zinc/82/68/78/457826878.db2.gz	CVOURNQTVZJOGL-RBUKOAKNSA-N	0	3	328.456	3.206	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H]2CN(Cc3cccc(C#N)c3)CC[C@@H]21	ZINC000366536857	457843178	/nfs/dbraw/zinc/84/31/78/457843178.db2.gz	ZNNDISRFMHLJPN-MSOLQXFVSA-N	0	3	341.455	3.390	20	30		EGEDHN
CO[C@H](C)c1nc(CN2CCCN([C@@H](C)CCC#N)CC2)cs1	ZINC000411334718	457859268	/nfs/dbraw/zinc/85/92/68/457859268.db2.gz	PMZLRGKSDRDEGI-LSDHHAIUSA-N	0	3	336.505	3.050	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)NCC(C)(C)CC#N)C1	ZINC000457945090	457877568	/nfs/dbraw/zinc/87/75/68/457877568.db2.gz	ZSRMPWLVTLGLHZ-DOTOQJQBSA-N	0	3	328.460	3.061	20	30		EGEDHN
C[C@@H](NC[C@@H](C)S(C)(=O)=O)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000411503212	457903993	/nfs/dbraw/zinc/90/39/93/457903993.db2.gz	KCRJVXCIZRNSNE-HUUCEWRRSA-N	0	3	342.464	3.309	20	30		EGEDHN
C[C@H]1C[C@H](c2cccnc2)N(CCC(=O)Nc2ccccc2C#N)C1	ZINC000411524428	457911007	/nfs/dbraw/zinc/91/10/07/457911007.db2.gz	KUFPKBNGVBILBX-HNAYVOBHSA-N	0	3	334.423	3.365	20	30		EGEDHN
CC1(C)CCCN(C(=O)[C@@H]2CCCN(Cc3ccccc3)C2)[C@H]1C#N	ZINC000434032355	457934926	/nfs/dbraw/zinc/93/49/26/457934926.db2.gz	REKGMKQLZWJYLV-MOPGFXCFSA-N	0	3	339.483	3.439	20	30		EGEDHN
CC(C)OC[C@@H](CO)N(C)Cc1ccc(-c2ccccc2C#N)cc1	ZINC000411634501	457935865	/nfs/dbraw/zinc/93/58/65/457935865.db2.gz	LHAJLSXXSUNXDT-HXUWFJFHSA-N	0	3	338.451	3.443	20	30		EGEDHN
CC(C)(CC#N)CNC(=O)NC[C@H]1CCCN(Cc2cccs2)C1	ZINC000458117280	457937145	/nfs/dbraw/zinc/93/71/45/457937145.db2.gz	XRIAUWUTQVVPIA-OAHLLOKOSA-N	0	3	348.516	3.199	20	30		EGEDHN
C=CCN(C)CCN(CC)[C@H](C)C(=O)Nc1cc(Cl)ccc1F	ZINC000411647366	457938452	/nfs/dbraw/zinc/93/84/52/457938452.db2.gz	XUZNSVPAZJSKHQ-CYBMUJFWSA-N	0	3	341.858	3.246	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CC[C@H](CC(F)(F)F)C1	ZINC000444696271	457943869	/nfs/dbraw/zinc/94/38/69/457943869.db2.gz	VNTSEUDVUCZRDH-ZBFHGGJFSA-N	0	3	343.389	3.429	20	30		EGEDHN
C=CCN(Cc1cccc(C#N)c1)C(=O)[C@H](C)N1[C@H](C)CC[C@@H]1C	ZINC000411713001	457959448	/nfs/dbraw/zinc/95/94/48/457959448.db2.gz	VNAPTGZHXRDQNZ-BBWFWOEESA-N	0	3	325.456	3.334	20	30		EGEDHN
C=CC[C@@H]1N(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CCCC1(C)C	ZINC000444778547	457974587	/nfs/dbraw/zinc/97/45/87/457974587.db2.gz	JDBYBXSDDLWAMV-INIZCTEOSA-N	0	3	331.416	3.260	20	30		EGEDHN
CC#CCN(C)CCC(=O)N[C@@H](c1cccs1)c1ccccc1	ZINC000411775266	457975603	/nfs/dbraw/zinc/97/56/03/457975603.db2.gz	XMFVSOHTPHNVAZ-LJQANCHMSA-N	0	3	326.465	3.299	20	30		EGEDHN
CN(C)CCOc1ccc(NC(=O)c2ccc(CC#N)cc2)cc1F	ZINC000458277691	457998770	/nfs/dbraw/zinc/99/87/70/457998770.db2.gz	FGWISSXFMJEKPB-UHFFFAOYSA-N	0	3	341.386	3.084	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2[C@H](C)[C@@H](CC(F)(F)F)C[C@@H]2C)CC1	ZINC000458331032	458015010	/nfs/dbraw/zinc/01/50/10/458015010.db2.gz	HNDNOPSGPAWRSQ-BFHYXJOUSA-N	0	3	347.425	3.398	20	30		EGEDHN
CC1CCC(N2CCN(C(=O)Nc3ccc(F)cc3C#N)CC2)CC1	ZINC000435152516	458098472	/nfs/dbraw/zinc/09/84/72/458098472.db2.gz	ATPUESOWXJTTMJ-UHFFFAOYSA-N	0	3	344.434	3.426	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)Cc1ccc(F)c(F)c1)C(C)C	ZINC000446115121	458150126	/nfs/dbraw/zinc/15/01/26/458150126.db2.gz	ZEAHSDVHRIXOEN-SFHVURJKSA-N	0	3	336.426	3.322	20	30		EGEDHN
CSc1ccc([C@@H](CNC(=O)NCC2(CC#N)CC2)N(C)C)cc1	ZINC000458737848	458152736	/nfs/dbraw/zinc/15/27/36/458152736.db2.gz	PQLYJNSOXYPHND-MRXNPFEDSA-N	0	3	346.500	3.004	20	30		EGEDHN
CN(CCC#N)c1ccc(CNC[C@@H]2OCCc3ccccc32)cc1	ZINC000369291792	458158557	/nfs/dbraw/zinc/15/85/57/458158557.db2.gz	CEMGNKOLBAZSHD-NRFANRHFSA-N	0	3	335.451	3.440	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@@H]1CNc1cc(C)nc2ccc([N+](=O)[O-])cc21	ZINC000435596043	458168892	/nfs/dbraw/zinc/16/88/92/458168892.db2.gz	GBRMUEWQOJHBST-FZKQIMNGSA-N	0	3	327.384	3.266	20	30		EGEDHN
C[C@@H]1CCN(C)CCN1C(=O)N[C@H](CCCC#N)c1ccccc1	ZINC000458809055	458179855	/nfs/dbraw/zinc/17/98/55/458179855.db2.gz	ZUIDYDDTSUFROT-SJLPKXTDSA-N	0	3	328.460	3.157	20	30		EGEDHN
C=CCC(C)(C)CNC(=O)N[C@H](CN(C)C)c1ccc(OC)cc1	ZINC000458807839	458180192	/nfs/dbraw/zinc/18/01/92/458180192.db2.gz	GTAXLMKTZMGKIX-QGZVFWFLSA-N	0	3	333.476	3.199	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCN(CCCOc3ccc(F)cc3)C2)nc1	ZINC000428771530	458208728	/nfs/dbraw/zinc/20/87/28/458208728.db2.gz	IPVUJDHSDDXKBX-GOSISDBHSA-N	0	3	341.386	3.015	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNc1cc(N2CCCC2)ncn1)C(C)C	ZINC000358803243	458226891	/nfs/dbraw/zinc/22/68/91/458226891.db2.gz	GXGCLQWQVVRLPJ-KRWDZBQOSA-N	0	3	329.492	3.187	20	30		EGEDHN
CCN(CCC#N)C(=O)CN1C[C@H](c2ccccc2)[C@@H]2CCCC[C@H]21	ZINC000362585074	458284953	/nfs/dbraw/zinc/28/49/53/458284953.db2.gz	BLBVSRNCYPHOIC-XUVXKRRUSA-N	0	3	339.483	3.407	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)NC(=O)NC1CCN(C2CC2)CC1	ZINC000413078798	458292455	/nfs/dbraw/zinc/29/24/55/458292455.db2.gz	WHPNSSJVORZENT-SFHVURJKSA-N	0	3	327.472	3.100	20	30		EGEDHN
C[C@@H]1CN(c2cc(C(F)(F)F)cnc2C#N)CCN(C2CCC2)C1	ZINC000413305557	458297083	/nfs/dbraw/zinc/29/70/83/458297083.db2.gz	RYTQOFDSAIFRPV-LBPRGKRZSA-N	0	3	338.377	3.283	20	30		EGEDHN
C[C@@H]1C[C@H]1N1CCN(c2cc(C(F)(F)F)cnc2C#N)C[C@@H](C)C1	ZINC000413294696	458297195	/nfs/dbraw/zinc/29/71/95/458297195.db2.gz	BOZNDMNJVPXWCC-YWPYICTPSA-N	0	3	338.377	3.139	20	30		EGEDHN
CN(C(=O)NCC(C)(C)CC#N)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000459263076	458306475	/nfs/dbraw/zinc/30/64/75/458306475.db2.gz	WRVSOBOYHRYPLJ-GOSISDBHSA-N	0	3	342.487	3.232	20	30		EGEDHN
Cc1cc(C#N)ccc1C(=O)Nc1ccc(OCCN(C)C)cc1F	ZINC000413899377	458312166	/nfs/dbraw/zinc/31/21/66/458312166.db2.gz	INBCCVUGWUXNGI-UHFFFAOYSA-N	0	3	341.386	3.199	20	30		EGEDHN
CC(C)(C)c1ccc([C@H](C#N)NC(=O)C23CCCN2CCC3)cc1	ZINC000415378363	458331953	/nfs/dbraw/zinc/33/19/53/458331953.db2.gz	NGTBFOMSAYPAIP-KRWDZBQOSA-N	0	3	325.456	3.293	20	30		EGEDHN
C[C@@H](C(=O)N[C@H]1CCCc2cc(C#N)ccc21)N1[C@H](C)CC[C@@H]1C	ZINC000416343341	458342474	/nfs/dbraw/zinc/34/24/74/458342474.db2.gz	RLALXVTWBDGDPQ-YGTYGHESSA-N	0	3	325.456	3.313	20	30		EGEDHN
C=CCN(C)CCN(CC)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000429725328	458364618	/nfs/dbraw/zinc/36/46/18/458364618.db2.gz	YPNGOZFHJHDTQR-UHFFFAOYSA-N	0	3	344.415	3.190	20	30		EGEDHN
Cn1c2ccc(CN[C@@H]3CCCc4cc(C#N)ccc43)cc2oc1=O	ZINC000418136754	458371336	/nfs/dbraw/zinc/37/13/36/458371336.db2.gz	ATCNTYLWRHSYBZ-QGZVFWFLSA-N	0	3	333.391	3.170	20	30		EGEDHN
N#CC1(CNC2CCN(C(=O)c3ccccc3Cl)CC2)CCC1	ZINC000418135939	458371777	/nfs/dbraw/zinc/37/17/77/458371777.db2.gz	BLMAYQWYHGAFFV-UHFFFAOYSA-N	0	3	331.847	3.228	20	30		EGEDHN
C[C@@H](NC(=O)NC[C@H]1N(C)CCCC1(C)C)c1ccc(C#N)cc1	ZINC000447977873	458373657	/nfs/dbraw/zinc/37/36/57/458373657.db2.gz	PTJKXLCIDVOPLW-RHSMWYFYSA-N	0	3	328.460	3.039	20	30		EGEDHN
C=CCN(CCc1ccccc1)C(=O)NCc1ccc2c(c1)CNC2	ZINC000418548104	458375222	/nfs/dbraw/zinc/37/52/22/458375222.db2.gz	CJNJJAMFKQAHMU-UHFFFAOYSA-N	0	3	335.451	3.230	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)N[C@@H]1CCN2CCCC[C@@H]12	ZINC000429871930	458379033	/nfs/dbraw/zinc/37/90/33/458379033.db2.gz	WKIYUYAAEBRVTC-CVEARBPZSA-N	0	3	339.464	3.438	20	30		EGEDHN
C=CCC(C)(C)CN[C@@H](Cc1ccc(C(F)(F)F)cc1)C(N)=O	ZINC000419189345	458379598	/nfs/dbraw/zinc/37/95/98/458379598.db2.gz	UEDNIKCVMKYZTB-AWEZNQCLSA-N	0	3	328.378	3.294	20	30		EGEDHN
C[C@H](C(=O)N(CCC#N)c1ccc(F)cc1)N1C[C@@H](C)[C@H](C)[C@@H]1C	ZINC000419376525	458381872	/nfs/dbraw/zinc/38/18/72/458381872.db2.gz	TYPBAFCIJNEVFK-FXUDXRNXSA-N	0	3	331.435	3.437	20	30		EGEDHN
CC(C)N1CC[C@H](N(C)C(=O)N[C@@H]2CCCc3cc(C#N)ccc32)C1	ZINC000419606491	458386836	/nfs/dbraw/zinc/38/68/36/458386836.db2.gz	FYLKOLXAGXEBRF-PKOBYXMFSA-N	0	3	340.471	3.060	20	30		EGEDHN
OCC[C@H]1CCCN(CC#Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000421017306	458405274	/nfs/dbraw/zinc/40/52/74/458405274.db2.gz	NEZXAZJTZLKFEW-INIZCTEOSA-N	0	3	341.373	3.421	20	30		EGEDHN
CC1(C)[C@@H](c2ccccc2)CCN1CC(=O)NCc1cccc(C#N)c1	ZINC000421009648	458406394	/nfs/dbraw/zinc/40/63/94/458406394.db2.gz	CBTONUNVUIXWFX-HXUWFJFHSA-N	0	3	347.462	3.443	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCN(CCc3cccc(Cl)c3)C2)nc1	ZINC000459567044	458412901	/nfs/dbraw/zinc/41/29/01/458412901.db2.gz	ZSOHSKFWUPTQPQ-QGZVFWFLSA-N	0	3	327.815	3.302	20	30		EGEDHN
CC(C)C[C@@H]([NH2+]C1CCC(C)(C#N)CC1)c1nc(-c2nc[n-]n2)no1	ZINC000449202167	458421722	/nfs/dbraw/zinc/42/17/22/458421722.db2.gz	IBXKJEAPZLFQJV-UIORMTCPSA-N	0	3	343.435	3.004	20	30		EGEDHN
CN(C)CCN(CC1CCCCC1)C(=O)NCc1ccc(C#N)s1	ZINC000422221558	458426460	/nfs/dbraw/zinc/42/64/60/458426460.db2.gz	ZNEGSZUVRJSYTC-UHFFFAOYSA-N	0	3	348.516	3.273	20	30		EGEDHN
C=CCOc1ccc(CN2CC[C@@H]3C[C@@H](O)CC[C@@H]3C2)cc1OC	ZINC000449555457	458427503	/nfs/dbraw/zinc/42/75/03/458427503.db2.gz	QHUYOXXGLYWERY-KURKYZTESA-N	0	3	331.456	3.243	20	30		EGEDHN
CC(C)(C)O[C@@H]1C[C@H](NCc2ccc(C#N)s2)[C@H]1n1cccn1	ZINC000449657167	458428484	/nfs/dbraw/zinc/42/84/84/458428484.db2.gz	NWYNTCBXMIFRNG-ARFHVFGLSA-N	0	3	330.457	3.103	20	30		EGEDHN
C=CCOc1cccnc1C(=O)NC[C@@H](N)c1ccc(C(C)C)cc1	ZINC000422797982	458429138	/nfs/dbraw/zinc/42/91/38/458429138.db2.gz	PHFRCIAHFJDLGS-QGZVFWFLSA-N	0	3	339.439	3.200	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1S[C@@H]1CC[C@H](C#N)C1	ZINC000450743784	458456271	/nfs/dbraw/zinc/45/62/71/458456271.db2.gz	JEOUCXGUDXXXAZ-JKSUJKDBSA-N	0	3	345.516	3.277	20	30		EGEDHN
C[C@@H]1C[C@@H](c2ccccc2)[C@H](C)N1CC(=O)NCc1cccc(C#N)c1	ZINC000451194553	458469102	/nfs/dbraw/zinc/46/91/02/458469102.db2.gz	ZDVOYACNACSATA-LLGFUMIMSA-N	0	3	347.462	3.441	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC(=O)N(CC)[C@H](C)c1ccc(F)cc1	ZINC000451676025	458485405	/nfs/dbraw/zinc/48/54/05/458485405.db2.gz	RLRUGKOZEGYKDU-OLMNPRSZSA-N	0	3	334.435	3.058	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1C(=O)NC[C@H]1CCCN(C)[C@H]1c1cccs1	ZINC000377465392	458501174	/nfs/dbraw/zinc/50/11/74/458501174.db2.gz	QTCMXEXHOSKAOV-JOCBIADPSA-N	0	3	348.512	3.228	20	30		EGEDHN
C=C(C)Cn1c(C2CCC2)nnc1N1CCN([C@@H]2C[C@H]2C)C[C@H](C)C1	ZINC000453449738	458530692	/nfs/dbraw/zinc/53/06/92/458530692.db2.gz	FSTKULDOIPSUNO-LZLYRXPVSA-N	0	3	343.519	3.288	20	30		EGEDHN
C=CCn1c(-c2ccccc2)nnc1N1CCCN(C(C)C)CC1	ZINC000453456233	458531598	/nfs/dbraw/zinc/53/15/98/458531598.db2.gz	YKUGIPGAQDHEJF-UHFFFAOYSA-N	0	3	325.460	3.052	20	30		EGEDHN
C=C(C)Cn1c([C@@H]2CCCCO2)nnc1N1CCN([C@H](C)CC)CC1	ZINC000453464893	458533291	/nfs/dbraw/zinc/53/32/91/458533291.db2.gz	MEPLQYHDXBGCDJ-SJORKVTESA-N	0	3	347.507	3.016	20	30		EGEDHN
CCOc1cccc2cc([C@@H](C)NC(=O)[C@@H](N)CCCC#N)oc21	ZINC000424063842	458548841	/nfs/dbraw/zinc/54/88/41/458548841.db2.gz	JGAMQANIZOXDPG-OCCSQVGLSA-N	0	3	329.400	3.030	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NC(=O)NC[C@H](c1ccccc1)N(CC)CC	ZINC000454199723	458554704	/nfs/dbraw/zinc/55/47/04/458554704.db2.gz	VVJDGXGMIBRCNY-QRVBRYPASA-N	0	3	345.487	3.102	20	30		EGEDHN
Cc1nc(-c2ccc([C@H](C)NC(=O)[C@H](N)CCCC#N)cc2)cs1	ZINC000424088066	458555681	/nfs/dbraw/zinc/55/56/81/458555681.db2.gz	IVQQRWYCTOUKDA-BLLLJJGKSA-N	0	3	342.468	3.317	20	30		EGEDHN
CC(C)Cc1ccc([C@@H](NC(=O)[C@@H](N)CCCC#N)C2CC2)cc1	ZINC000424109738	458560998	/nfs/dbraw/zinc/56/09/98/458560998.db2.gz	BDQPDOVJSMCJGG-RBUKOAKNSA-N	0	3	327.472	3.474	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N[C@H](c1ccccc1)c1cccc(F)c1	ZINC000424126134	458565816	/nfs/dbraw/zinc/56/58/16/458565816.db2.gz	SHYYKWJUYINBIU-QZTJIDSGSA-N	0	3	325.387	3.052	20	30		EGEDHN
C=CC(C)(C)CNC(=O)N[C@@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000454623956	458568915	/nfs/dbraw/zinc/56/89/15/458568915.db2.gz	SABGNAGUASYLMQ-FUHWJXTLSA-N	0	3	329.488	3.408	20	30		EGEDHN
Cc1cccc(Oc2ccccc2CNC(=O)[C@H](N)CCCC#N)c1	ZINC000424141838	458569562	/nfs/dbraw/zinc/56/95/62/458569562.db2.gz	PDPNKNYVHLTYGS-GOSISDBHSA-N	0	3	337.423	3.425	20	30		EGEDHN
C[C@H](NCCNC(=O)CCCc1ccccc1)c1ccc(C#N)cc1	ZINC000424146495	458569999	/nfs/dbraw/zinc/56/99/99/458569999.db2.gz	WLMBFRBPXHCHEK-KRWDZBQOSA-N	0	3	335.451	3.348	20	30		EGEDHN
C=C(C)CCNC(=O)Nc1ccc(CCN2CCSCC2)cc1	ZINC000454645646	458570690	/nfs/dbraw/zinc/57/06/90/458570690.db2.gz	IUDSCIOAJKXRNN-UHFFFAOYSA-N	0	3	333.501	3.366	20	30		EGEDHN
C[C@@H]1CC=C(C(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)CC1	ZINC000454816711	458575969	/nfs/dbraw/zinc/57/59/69/458575969.db2.gz	YTUFSLCIKITDHA-MRXNPFEDSA-N	0	3	325.456	3.195	20	30		EGEDHN
C[C@@H]1[C@H](NC(=O)N[C@H](CCCC#N)c2ccccc2)CCCN1C	ZINC000431457563	458576007	/nfs/dbraw/zinc/57/60/07/458576007.db2.gz	JKNDZBTZSFAAAJ-KBAYOESNSA-N	0	3	328.460	3.203	20	30		EGEDHN
COc1cc(Oc2ccccc2)ccc1NC(=O)[C@@H](N)CCCC#N	ZINC000424174014	458577332	/nfs/dbraw/zinc/57/73/32/458577332.db2.gz	NVWBUWIIOITMDU-INIZCTEOSA-N	0	3	339.395	3.447	20	30		EGEDHN
C=CCC[C@H](NC[C@@]1(N2CCOCC2)CCSC1)c1ccco1	ZINC000373700958	458577408	/nfs/dbraw/zinc/57/74/08/458577408.db2.gz	PFBMMKCEXQLPAF-WMZOPIPTSA-N	0	3	336.501	3.084	20	30		EGEDHN
C[C@H](CNC(=O)[C@H](C)c1cccc(C#N)c1)N(C)Cc1ccccc1	ZINC000462055984	458590160	/nfs/dbraw/zinc/59/01/60/458590160.db2.gz	JNFHBRHIQSVNQL-IAGOWNOFSA-N	0	3	335.451	3.298	20	30		EGEDHN
C=CCC1(CNC(=O)N2CCN(C3CCOCC3)C[C@H]2C)CCCC1	ZINC000455481607	458601056	/nfs/dbraw/zinc/60/10/56/458601056.db2.gz	RWTQOWVNLRHUSL-QGZVFWFLSA-N	0	3	349.519	3.018	20	30		EGEDHN
C=C(CC)CNC(=O)N1CCCN(CCCc2ccccc2)CC1	ZINC000455527059	458602231	/nfs/dbraw/zinc/60/22/31/458602231.db2.gz	UKTWIYSUYUSDJS-UHFFFAOYSA-N	0	3	329.488	3.303	20	30		EGEDHN
N#CCc1ccc(NC(=O)N2CCC(N3CC=CC3)CC2)c(Cl)c1	ZINC000455701075	458607779	/nfs/dbraw/zinc/60/77/79/458607779.db2.gz	JFLXMADPEXEODT-UHFFFAOYSA-N	0	3	344.846	3.274	20	30		EGEDHN
C=CCn1cc(CN[C@H]2CCCC[C@H]2c2ccc(OC)c(F)c2)nn1	ZINC000424297274	458608059	/nfs/dbraw/zinc/60/80/59/458608059.db2.gz	QBFWLIKLHBTNAV-WMZOPIPTSA-N	0	3	344.434	3.428	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cc(C(C)(C)C)nn1C)C(C)C	ZINC000494018255	458616285	/nfs/dbraw/zinc/61/62/85/458616285.db2.gz	ZLHBLQQECCVZKV-QGZVFWFLSA-N	0	3	346.519	3.146	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)Nc2ccc(OC(C)(C)C)c(C#N)c2)CCN1C	ZINC000455806693	458617068	/nfs/dbraw/zinc/61/70/68/458617068.db2.gz	YUAXCPXUWGBTBT-XJKSGUPXSA-N	0	3	344.459	3.340	20	30		EGEDHN
C[C@@H](NC(=O)[C@@H](C)c1cccc(C#N)c1)[C@@H](c1ccccc1)N(C)C	ZINC000462494970	458626636	/nfs/dbraw/zinc/62/66/36/458626636.db2.gz	BWQDBLAZVMXEBD-YRNRMSPPSA-N	0	3	335.451	3.469	20	30		EGEDHN
Cc1ccc([N+](=O)[O-])c(N(CCN(C)C)Cc2ccc(C#N)cc2)c1	ZINC000470505650	458636573	/nfs/dbraw/zinc/63/65/73/458636573.db2.gz	DGHUMAPWKXFUCB-UHFFFAOYSA-N	0	3	338.411	3.343	20	30		EGEDHN
C=CCOCCCN1CCN(c2ccc(C(F)(F)F)cc2)CC1	ZINC000470762928	458649761	/nfs/dbraw/zinc/64/97/61/458649761.db2.gz	AMRRZZXFKHKORT-UHFFFAOYSA-N	0	3	328.378	3.420	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Nc1cccc([N+](=O)[O-])c1)C(C)C	ZINC000503439905	458708410	/nfs/dbraw/zinc/70/84/10/458708410.db2.gz	STQFCKLFRCQSHE-QGZVFWFLSA-N	0	3	346.431	3.415	20	30		EGEDHN
C[C@H](C(=O)N1C[C@@H](N(C)C)Cc2ccccc21)c1cccc(C#N)c1	ZINC000463778634	458718760	/nfs/dbraw/zinc/71/87/60/458718760.db2.gz	ZGNBUMFRVYVZEF-KXBFYZLASA-N	0	3	333.435	3.181	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1ccc(OC)cc1F)C(C)C	ZINC000503981352	458734759	/nfs/dbraw/zinc/73/47/59/458734759.db2.gz	RSEOBLPYXBTJEJ-GOSISDBHSA-N	0	3	334.435	3.263	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N(C)C[C@@H]1CCCN(CC)[C@H]1c1cnn(C)c1	ZINC000424803690	458736735	/nfs/dbraw/zinc/73/67/35/458736735.db2.gz	YSKALCCBXKGWOM-FUHWJXTLSA-N	0	3	346.519	3.254	20	30		EGEDHN
C=CCn1c(-c2ccccc2C)nnc1N1CCN(C)[C@@H](C(C)C)C1	ZINC000508493176	458759796	/nfs/dbraw/zinc/75/97/96/458759796.db2.gz	LACKMDWBMOZMHL-GOSISDBHSA-N	0	3	339.487	3.216	20	30		EGEDHN
C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCN(Cc2cc(C#N)cs2)C1	ZINC000495068372	458793730	/nfs/dbraw/zinc/79/37/30/458793730.db2.gz	RMQJFBOSGJNVFE-JSGCOSHPSA-N	0	3	335.473	3.355	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)NCC#Cc2ccccc2)C1	ZINC000516578016	458819338	/nfs/dbraw/zinc/81/93/38/458819338.db2.gz	FTHFSPBPFIJFHF-WIYYLYMNSA-N	0	3	347.462	3.173	20	30		EGEDHN
C[C@H](NC[C@H](C#N)CCC#N)[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000495269182	458823547	/nfs/dbraw/zinc/82/35/47/458823547.db2.gz	CKCFLNUNGTXUKC-JYJNAYRXSA-N	0	3	334.464	3.055	20	30		EGEDHN
C=CCCCCNC(=O)NC[C@@H](c1cccc(OC)c1)N1CCCC1	ZINC000473892374	458848551	/nfs/dbraw/zinc/84/85/51/458848551.db2.gz	FGYKXXVYFVMZHC-IBGZPJMESA-N	0	3	345.487	3.488	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](C(C)(C)C)C(F)(F)F)CC1	ZINC000548512317	458872548	/nfs/dbraw/zinc/87/25/48/458872548.db2.gz	HBRWSYWGEOOWCR-CYBMUJFWSA-N	0	3	335.414	3.303	20	30		EGEDHN
C[C@H](c1ccccc1F)N1CCC[C@H](N[C@H]2CC[C@@H](C#N)C2)C1=O	ZINC000551242624	458887768	/nfs/dbraw/zinc/88/77/68/458887768.db2.gz	UPSFQHQFFUBQCQ-BSXFFOKHSA-N	0	3	329.419	3.160	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CCC(C2CCOCC2)CC1	ZINC000519160903	458921139	/nfs/dbraw/zinc/92/11/39/458921139.db2.gz	YBHBPEKBUZCJRY-HXUWFJFHSA-N	0	3	340.467	3.424	20	30		EGEDHN
CN(CC(C)(C)C#N)C(=O)NC[C@@H](c1ccccc1)N1CCCC1	ZINC000457372683	458933961	/nfs/dbraw/zinc/93/39/61/458933961.db2.gz	JANOTQVMEUQQFW-KRWDZBQOSA-N	0	3	328.460	3.015	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN2C[C@H](C)C[C@H]2CC)cc1	ZINC000466929090	458937113	/nfs/dbraw/zinc/93/71/13/458937113.db2.gz	NHYZLXRPTZSVPD-IAGOWNOFSA-N	0	3	343.471	3.452	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN(C)CCc1cccs1	ZINC000441514605	458955813	/nfs/dbraw/zinc/95/58/13/458955813.db2.gz	KCAFPGUFULAATO-KRWDZBQOSA-N	0	3	331.481	3.391	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1ccc(N(C)C)cc1)C(C)C	ZINC000441869283	458979911	/nfs/dbraw/zinc/97/99/11/458979911.db2.gz	JOFXFRBGPPXSQB-IBGZPJMESA-N	0	3	329.488	3.181	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)N[C@H](C)CN1CCCCCC1	ZINC000476394761	458999985	/nfs/dbraw/zinc/99/99/85/458999985.db2.gz	VEJNSKSGEREWQP-MRXNPFEDSA-N	0	3	346.471	3.254	20	30		EGEDHN
N#Cc1cccc(CNC(=O)CN(CC2CCCCC2)C2CC2)c1	ZINC000520169110	459035942	/nfs/dbraw/zinc/03/59/42/459035942.db2.gz	WKEWTDUPEMMCBI-UHFFFAOYSA-N	0	3	325.456	3.219	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)[C@H]1COc2ccccc2C1)C(C)C	ZINC000496029665	459043205	/nfs/dbraw/zinc/04/32/05/459043205.db2.gz	RQEPOAJZLHDIMO-MOPGFXCFSA-N	0	3	342.483	3.053	20	30		EGEDHN
COc1cc(CNCC2(NC(=O)OC(C)(C)C)CCC2)ccc1C#N	ZINC000496149640	459087533	/nfs/dbraw/zinc/08/75/33/459087533.db2.gz	HLKSNKYUDLUMBH-UHFFFAOYSA-N	0	3	345.443	3.104	20	30		EGEDHN
Cc1cc(C#N)cnc1C(=O)N[C@@H](CN1CCCCC1)c1ccccc1	ZINC000590211956	459101254	/nfs/dbraw/zinc/10/12/54/459101254.db2.gz	CGDDFBAXTNRXRN-IBGZPJMESA-N	0	3	348.450	3.219	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CCSCC[C@@H]1C)C(C)C	ZINC000478763356	459107381	/nfs/dbraw/zinc/10/73/81/459107381.db2.gz	QEQXYDOFYWNKSO-DLBZAZTESA-N	0	3	339.549	3.222	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccc(C#N)c(Cl)c2)CCN(C2CCC2)C1	ZINC000557835365	459111895	/nfs/dbraw/zinc/11/18/95/459111895.db2.gz	AYVZDZSYNNBWAJ-ZDUSSCGKSA-N	0	3	331.847	3.158	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CN1C(=O)N2CCC[C@]2(CCC)C1=O)C(C)C	ZINC000479008051	459117887	/nfs/dbraw/zinc/11/78/87/459117887.db2.gz	VOVIBINRKHJPCV-FXAWDEMLSA-N	0	3	347.503	3.282	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@H]1CCC[C@H](CNC[C@@H](C#N)CCC#N)C1	ZINC000496329129	459152425	/nfs/dbraw/zinc/15/24/25/459152425.db2.gz	SIRBSLRTRXCHSF-ARFHVFGLSA-N	0	3	334.464	3.103	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN(C(=O)C(C)(C)C)C1	ZINC000590603374	459159706	/nfs/dbraw/zinc/15/97/06/459159706.db2.gz	SYNNEJTYFPGZEP-GOSISDBHSA-N	0	3	327.472	3.275	20	30		EGEDHN
C=C(C)Cn1c(C2CCCC2)nnc1N1C[C@H](C)N(CC)C[C@H]1C	ZINC000558626335	459183983	/nfs/dbraw/zinc/18/39/83/459183983.db2.gz	XGYANKYKAAZYEG-JKSUJKDBSA-N	0	3	331.508	3.431	20	30		EGEDHN
CC(C)(c1ccccc1)C1(NCc2cnc3c(C#N)cnn3c2)CC1	ZINC000567887460	459184126	/nfs/dbraw/zinc/18/41/26/459184126.db2.gz	LLDLGEUSAHCLNV-UHFFFAOYSA-N	0	3	331.423	3.201	20	30		EGEDHN
Cc1c(Cl)cnc(NC[C@@H]2CCN(Cc3ccccc3)C2)c1C#N	ZINC000480510536	459201920	/nfs/dbraw/zinc/20/19/20/459201920.db2.gz	QMZWJKOYMONSFZ-INIZCTEOSA-N	0	3	340.858	3.271	20	30		EGEDHN
COCCOc1ccc(CN2CCC(CCC#N)CC2)cc1OC	ZINC000522001960	459202812	/nfs/dbraw/zinc/20/28/12/459202812.db2.gz	ORKOIMHGZFMPKI-UHFFFAOYSA-N	0	3	332.444	3.236	20	30		EGEDHN
C=C(C)Cn1c(CC(C)(C)C)nnc1N1CCN(C)[C@@H](C(C)C)C1	ZINC000559010654	459230117	/nfs/dbraw/zinc/23/01/17/459230117.db2.gz	JGQBJTZSODWWQW-MRXNPFEDSA-N	0	3	333.524	3.219	20	30		EGEDHN
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@@H]1NCc1ccc(C#N)cn1	ZINC000496584080	459249059	/nfs/dbraw/zinc/24/90/59/459249059.db2.gz	ODONXGDPLFNVND-JKIFEVAISA-N	0	3	344.459	3.077	20	30		EGEDHN
Cc1ccc(CN2CC[C@@H](CN(C)C(=O)C3(C#N)CC(C)C3)C2)s1	ZINC000579722083	459251065	/nfs/dbraw/zinc/25/10/65/459251065.db2.gz	DXRLSGHWVVLWDM-RCDNUKIMSA-N	0	3	345.512	3.277	20	30		EGEDHN
C[C@H](CN(C)Cc1ccccc1)NC(=O)c1ccc(Cl)c(C#N)c1	ZINC000568324947	459267992	/nfs/dbraw/zinc/26/79/92/459267992.db2.gz	FCPMCJMWVFFUGC-CQSZACIVSA-N	0	3	341.842	3.462	20	30		EGEDHN
CC(C)N1CCN([C@H]2CCN([C@@H](C#N)c3ccc(Cl)cc3)C2)CC1	ZINC000595341722	459279721	/nfs/dbraw/zinc/27/97/21/459279721.db2.gz	YMFZHZMOTMAYRH-OALUTQOASA-N	0	3	346.906	3.005	20	30		EGEDHN
N#Cc1ccc(CCN[C@H](CN2CCCC2=O)c2ccccc2)cc1	ZINC000595412458	459292808	/nfs/dbraw/zinc/29/28/08/459292808.db2.gz	ZXABMVPWSMPMCU-HXUWFJFHSA-N	0	3	333.435	3.054	20	30		EGEDHN
N#CC[C@@H]1CCCN(C(=O)N[C@@H](CN2CCCC2)c2ccccc2)C1	ZINC000595438759	459301474	/nfs/dbraw/zinc/30/14/74/459301474.db2.gz	ARBUMBRVVWOVAV-HKUYNNGSSA-N	0	3	340.471	3.159	20	30		EGEDHN
C=CCc1ccc(OC[C@@H](O)CN2CC3(C2)CCCCC3)c(OC)c1	ZINC000582092005	459305349	/nfs/dbraw/zinc/30/53/49/459305349.db2.gz	VGIWVDQYRWQUET-SFHVURJKSA-N	0	3	345.483	3.430	20	30		EGEDHN
N#Cc1ccc(CCN2CCC[C@@H](Oc3ncccc3F)C2)cc1	ZINC000595460700	459309313	/nfs/dbraw/zinc/30/93/13/459309313.db2.gz	GCKCXIPDNVLYNH-QGZVFWFLSA-N	0	3	325.387	3.178	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@@H]1CCCNCc1ccc(C#N)o1	ZINC000496747677	459309567	/nfs/dbraw/zinc/30/95/67/459309567.db2.gz	GAUMJKDOQSCMFJ-AWEZNQCLSA-N	0	3	333.432	3.421	20	30		EGEDHN
CN(C)[C@@H](CC(=O)N[C@H]1CCc2cc(C#N)ccc21)c1ccccc1	ZINC000591320373	459353870	/nfs/dbraw/zinc/35/38/70/459353870.db2.gz	HGBMUOODHPBTBZ-PMACEKPBSA-N	0	3	333.435	3.355	20	30		EGEDHN
CC(C)c1ccc([C@H](N)CNC(=O)N2CCC[C@](C)(C#N)C2)cc1	ZINC000591359231	459361495	/nfs/dbraw/zinc/36/14/95/459361495.db2.gz	GROIYVQYPKTFRE-IEBWSBKVSA-N	0	3	328.460	3.145	20	30		EGEDHN
CC(C)c1ccc([C@H](N)CNC(=O)N2CCC[C@@](C)(C#N)C2)cc1	ZINC000591359232	459361745	/nfs/dbraw/zinc/36/17/45/459361745.db2.gz	GROIYVQYPKTFRE-MJGOQNOKSA-N	0	3	328.460	3.145	20	30		EGEDHN
N#CC[C@@H]1CCCN(C[C@@H](O)COc2ccc(Cl)c(Cl)c2)C1	ZINC000595610240	459365393	/nfs/dbraw/zinc/36/53/93/459365393.db2.gz	ULCMEEVVDVIOAN-QWHCGFSZSA-N	0	3	343.254	3.359	20	30		EGEDHN
CC#CCCNC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000483419126	459367765	/nfs/dbraw/zinc/36/77/65/459367765.db2.gz	HGBJPICPJMWPET-IEBWSBKVSA-N	0	3	327.472	3.094	20	30		EGEDHN
C=CCN(CCc1nc2sc3c(c2c(N)n1)CCCC3)C1CC1	ZINC000537855114	459367815	/nfs/dbraw/zinc/36/78/15/459367815.db2.gz	QIBGWSIBGPNMFM-UHFFFAOYSA-N	0	3	328.485	3.345	20	30		EGEDHN
CC#CCCNC(=O)N1CC[C@@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000483423527	459367805	/nfs/dbraw/zinc/36/78/05/459367805.db2.gz	ZLLAUEITAAOREW-NRFANRHFSA-N	0	3	339.483	3.098	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@H](N[C@H]1CCN(C(=O)Nc3ccccc3)C1)CC2	ZINC000582479426	459371441	/nfs/dbraw/zinc/37/14/41/459371441.db2.gz	WNPHQKRLSHDISB-AZUAARDMSA-N	0	3	346.434	3.442	20	30		EGEDHN
N#CC[C@@H]1CCCN(C[C@H](O)Cc2ccccc2C(F)(F)F)C1	ZINC000595619561	459372205	/nfs/dbraw/zinc/37/22/05/459372205.db2.gz	DFEICHDIULRBDI-DZGCQCFKSA-N	0	3	326.362	3.234	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H]2CN(Cc3ccc(C#N)s3)C[C@@H]2C1	ZINC000496941296	459379360	/nfs/dbraw/zinc/37/93/60/459379360.db2.gz	UVPFQJZKXPOQFX-UONOGXRCSA-N	0	3	347.484	3.309	20	30		EGEDHN
CC(C)[C@H]1CCCN([C@H]2CCN(c3ccc(C#N)cc3)C2=O)CC1	ZINC000569025958	459384450	/nfs/dbraw/zinc/38/44/50/459384450.db2.gz	YGAHPUHNLHACEV-HKUYNNGSSA-N	0	3	325.456	3.422	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N[C@@H](CN(C)C)c1ccc(Cl)cc1)OCC	ZINC000569090620	459393583	/nfs/dbraw/zinc/39/35/83/459393583.db2.gz	HQTURXGSZXBYJC-DLBZAZTESA-N	0	3	338.879	3.430	20	30		EGEDHN
N#Cc1ccc([C@H](NC[C@@H]2CCC[C@@H]2c2ccccc2)C(N)=O)cc1	ZINC000569094570	459394864	/nfs/dbraw/zinc/39/48/64/459394864.db2.gz	WBZOAHHWKQFDCE-ZCNNSNEGSA-N	0	3	333.435	3.258	20	30		EGEDHN
CN(CCC#N)C[C@@H](O)CN[C@H]1CCc2ccc(-c3ccccc3)cc21	ZINC000591761373	459430225	/nfs/dbraw/zinc/43/02/25/459430225.db2.gz	FMHFTQDDGSMYBC-UNMCSNQZSA-N	0	3	349.478	3.137	20	30		EGEDHN
CC(C)(CC#N)CNC[C@H](O)COc1ccc(Cl)c(Cl)c1	ZINC000591770364	459432766	/nfs/dbraw/zinc/43/27/66/459432766.db2.gz	XPTNYAPPFZIVGW-NSHDSACASA-N	0	3	331.243	3.263	20	30		EGEDHN
CCCN(CCN1CCCCC1)C(=O)[C@H](C#N)CCc1ccccc1	ZINC000561262928	459436781	/nfs/dbraw/zinc/43/67/81/459436781.db2.gz	ZCXPZDGCKFVJOW-FQEVSTJZSA-N	0	3	341.499	3.483	20	30		EGEDHN
N#CCCCCCC(=O)N1C[C@@H]2CCN(Cc3ccccc3)[C@@H]2C1	ZINC000591799207	459438631	/nfs/dbraw/zinc/43/86/31/459438631.db2.gz	CYIPQJMSDMDXQA-RBUKOAKNSA-N	0	3	325.456	3.193	20	30		EGEDHN
N#C[C@H]1CC[C@@H](N2CCC(CNC(=O)OCc3ccccc3)CC2)C1	ZINC000497101121	459439270	/nfs/dbraw/zinc/43/92/70/459439270.db2.gz	TZADVBRXBMZPTI-RBUKOAKNSA-N	0	3	341.455	3.317	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN[C@@H](Cc1ccccc1OC)C(C)C	ZINC000541628728	459475609	/nfs/dbraw/zinc/47/56/09/459475609.db2.gz	RYFBKFXDAGPVPX-SFHVURJKSA-N	0	3	332.488	3.277	20	30		EGEDHN
COc1ccccc1N(CCC#N)C(=O)[C@@H](C)N(C)C[C@@H]1CC1(C)C	ZINC000595912916	459484788	/nfs/dbraw/zinc/48/47/88/459484788.db2.gz	PHPZENMFPHYSIL-CVEARBPZSA-N	0	3	343.471	3.308	20	30		EGEDHN
C[C@@H](Cc1ccsc1)N[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000541882247	459506113	/nfs/dbraw/zinc/50/61/13/459506113.db2.gz	TXZRJXHLMMEPMA-KBXCAEBGSA-N	0	3	339.464	3.336	20	30		EGEDHN
CCCN(C(=O)N[C@@H](CCC#N)c1ccccc1)[C@H]1CCN(C)C1	ZINC000591992391	459507885	/nfs/dbraw/zinc/50/78/85/459507885.db2.gz	LGGSXOKCNVNADQ-ROUUACIJSA-N	0	3	328.460	3.157	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)N1CCC(CC#N)CC1)c1ccsc1	ZINC000541914999	459510422	/nfs/dbraw/zinc/51/04/22/459510422.db2.gz	UVFMJXRMYPQYQA-QGZVFWFLSA-N	0	3	348.516	3.466	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(-c3cccc(F)c3)no2)CC1	ZINC000592075772	459520531	/nfs/dbraw/zinc/52/05/31/459520531.db2.gz	ONDBZHRAIKTBAC-UHFFFAOYSA-N	0	3	343.402	3.251	20	30		EGEDHN
C=C(C)CN1CCC(Nc2cnn(C(C)(C)C)c(=O)c2Cl)CC1	ZINC000592109064	459525538	/nfs/dbraw/zinc/52/55/38/459525538.db2.gz	MIVSMUOAUKZTJK-UHFFFAOYSA-N	0	3	338.883	3.104	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CCSC[C@@H](C)C1)C(C)C	ZINC000487371934	459529755	/nfs/dbraw/zinc/52/97/55/459529755.db2.gz	GCRQFLGVKYHJMB-DLBZAZTESA-N	0	3	339.549	3.080	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)NCC1CC(F)(F)C1)C(C)C	ZINC000487814261	459534334	/nfs/dbraw/zinc/53/43/34/459534334.db2.gz	ATHCSGCHLHJUCD-OAHLLOKOSA-N	0	3	329.435	3.030	20	30		EGEDHN
COCCN(CC(=O)Nc1cc(Cl)ccc1C#N)[C@@H]1CCC[C@H]1C	ZINC000487948758	459535621	/nfs/dbraw/zinc/53/56/21/459535621.db2.gz	ARCBTPVSLPNYNA-CXAGYDPISA-N	0	3	349.862	3.287	20	30		EGEDHN
C[C@H](c1ccc(C#N)cc1)N1CC[C@H](C(=O)NCc2ccccc2)C1	ZINC000592153984	459538334	/nfs/dbraw/zinc/53/83/34/459538334.db2.gz	FJJPGBJAXGLDND-UZLBHIALSA-N	0	3	333.435	3.258	20	30		EGEDHN
Cn1ncc(C#N)c1N1CCN(Cc2ccccc2)C2(CCCCC2)C1	ZINC000596154839	459539557	/nfs/dbraw/zinc/53/95/57/459539557.db2.gz	DKBXOYHPUPFRHB-UHFFFAOYSA-N	0	3	349.482	3.317	20	30		EGEDHN
CC(C)(C)[C@H]1CCN([C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)C1	ZINC000542320827	459547545	/nfs/dbraw/zinc/54/75/45/459547545.db2.gz	WVCMEKUQUQMFIX-FUHWJXTLSA-N	0	3	325.456	3.422	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2cccc(F)c2C#N)C1	ZINC000488699575	459548122	/nfs/dbraw/zinc/54/81/22/459548122.db2.gz	DDLDIIKPIFHYOB-HOCLYGCPSA-N	0	3	337.398	3.263	20	30		EGEDHN
CCc1nc(C#N)cc(N2CCN(Cc3ccccc3)[C@H](CC)C2)n1	ZINC000596191800	459556578	/nfs/dbraw/zinc/55/65/78/459556578.db2.gz	GJOANTFXPGIYRX-GOSISDBHSA-N	0	3	335.455	3.011	20	30		EGEDHN
C=C[C@@H]1CCCCN1C[C@@H](O)COc1cccc(C(F)(F)F)c1	ZINC000489481119	459565424	/nfs/dbraw/zinc/56/54/24/459565424.db2.gz	OGTOUUCRILPWOA-HUUCEWRRSA-N	0	3	329.362	3.486	20	30		EGEDHN
C=C[C@@H]1CCCCN1C[C@@H](O)COc1ccc(Br)cc1	ZINC000489487471	459565732	/nfs/dbraw/zinc/56/57/32/459565732.db2.gz	VNHNOYWDCWSTRY-HUUCEWRRSA-N	0	3	340.261	3.229	20	30		EGEDHN
C[C@H](NCC#Cc1ccc(OC(F)(F)F)cc1)[C@@H]1CCCOC1	ZINC000542578721	459572308	/nfs/dbraw/zinc/57/23/08/459572308.db2.gz	VSBUKPDXXYCJTM-DZGCQCFKSA-N	0	3	327.346	3.341	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1C[C@@H](c2ccc(C)cc2)C[C@H]1C	ZINC000490041021	459575756	/nfs/dbraw/zinc/57/57/56/459575756.db2.gz	YKPHOAUGARKRDV-LMMKCTJWSA-N	0	3	327.472	3.181	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1)C(=O)/C=C/c1ccc(C#N)cc1	ZINC000490919985	459589750	/nfs/dbraw/zinc/58/97/50/459589750.db2.gz	USBNXQUUCUTSKX-OUKQBFOZSA-N	0	3	333.435	3.162	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@]2(c3ccc(Cl)cc3)C[C@H]2C)CC1	ZINC000491047516	459595781	/nfs/dbraw/zinc/59/57/81/459595781.db2.gz	UXYGZRHQYZDBLT-KUHUBIRLSA-N	0	3	330.859	3.037	20	30		EGEDHN
COc1cccc(CN(Cc2cnc3c(C#N)cnn3c2)CC(C)C)c1	ZINC000592497834	459614410	/nfs/dbraw/zinc/61/44/10/459614410.db2.gz	AMPYRCRTCWYPQM-UHFFFAOYSA-N	0	3	349.438	3.268	20	30		EGEDHN
CCN(Cc1cnc2c(C#N)cnn2c1)[C@H](C)Cc1ccc(OC)cc1	ZINC000592496646	459614517	/nfs/dbraw/zinc/61/45/17/459614517.db2.gz	CHWRISQDIPUQMA-OAHLLOKOSA-N	0	3	349.438	3.063	20	30		EGEDHN
C#C[C@H](C)N(C)CCC(=O)N[C@@H](c1cccs1)c1ccccc1	ZINC000491339679	459618137	/nfs/dbraw/zinc/61/81/37/459618137.db2.gz	RPLKITCQTLKNOE-HNAYVOBHSA-N	0	3	326.465	3.297	20	30		EGEDHN
C=CCCC[C@H](C)N[C@H](Cc1ccc(C(F)(F)F)cc1)C(N)=O	ZINC000543138726	459627494	/nfs/dbraw/zinc/62/74/94/459627494.db2.gz	LTSNOHUCMXYCGN-SWLSCSKDSA-N	0	3	328.378	3.436	20	30		EGEDHN
CC(C)Cc1ccc([C@H](NCC(=O)NC2(C#N)CCC2)C2CC2)cc1	ZINC000527377922	459638444	/nfs/dbraw/zinc/63/84/44/459638444.db2.gz	HCWMUWUHLPRDJR-FQEVSTJZSA-N	0	3	339.483	3.488	20	30		EGEDHN
C=CCN1CC[C@@H](NC(C)(C)c2ccc(OCC(C)C)cc2)C1=O	ZINC000499607663	459642309	/nfs/dbraw/zinc/64/23/09/459642309.db2.gz	SBBZGQCTXCCOGF-GOSISDBHSA-N	0	3	330.472	3.333	20	30		EGEDHN
C#C[C@@H](CC)NC(=O)Nc1cc(Cl)ccc1OC1CCN(C)CC1	ZINC000491642107	459646097	/nfs/dbraw/zinc/64/60/97/459646097.db2.gz	VOJPXUYHAMDJJW-AWEZNQCLSA-N	0	3	349.862	3.346	20	30		EGEDHN
C=CCN1CC[C@@H](N2CCC(C)(c3cccc(Cl)c3)CC2)C1=O	ZINC000499790407	459652657	/nfs/dbraw/zinc/65/26/57/459652657.db2.gz	CBEQSEWKNJXPAE-QGZVFWFLSA-N	0	3	332.875	3.480	20	30		EGEDHN
C#C[C@@H](CC)NCc1cn(Cc2ccccc2)nc1-c1cccnc1	ZINC000491711106	459659116	/nfs/dbraw/zinc/65/91/16/459659116.db2.gz	SZGVMOHONBQOJU-FQEVSTJZSA-N	0	3	330.435	3.495	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN[C@@H](C)c1cnn(C(C)C)c1	ZINC000543502919	459664047	/nfs/dbraw/zinc/66/40/47/459664047.db2.gz	APUNXGFRPKMEHS-LPHOPBHVSA-N	0	3	343.471	3.283	20	30		EGEDHN
C#C[C@H](NC(=O)Nc1ccccc1CCN(C)C)c1ccc(F)cc1	ZINC000491780676	459672153	/nfs/dbraw/zinc/67/21/53/459672153.db2.gz	MCKKZSZGGBTRMV-SFHVURJKSA-N	0	3	339.414	3.426	20	30		EGEDHN
C#CCCN1CCC(NC(=O)/C=C\c2cccc(OC(C)C)c2)CC1	ZINC000491911220	459684470	/nfs/dbraw/zinc/68/44/70/459684470.db2.gz	GINLTLFGHLYGOI-KTKRTIGZSA-N	0	3	340.467	3.091	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)N2CCC(CC#N)CC2)C1	ZINC000543776827	459698358	/nfs/dbraw/zinc/69/83/58/459698358.db2.gz	XEUCVNUROQCZFD-LPHOPBHVSA-N	0	3	340.471	3.157	20	30		EGEDHN
CC[C@H](C)N1CCN([C@H](C#N)c2ccc(Br)cc2)CC1	ZINC000501028748	459707364	/nfs/dbraw/zinc/70/73/64/459707364.db2.gz	JRTGPUCLPQCDFD-XJKSGUPXSA-N	0	3	336.277	3.430	20	30		EGEDHN
N#CC1(CNC2CCN(Cc3ccccc3Br)CC2)CC1	ZINC000584446956	459738445	/nfs/dbraw/zinc/73/84/45/459738445.db2.gz	VIHBANHALOPBEL-UHFFFAOYSA-N	0	3	348.288	3.307	20	30		EGEDHN
N#CCN(C(=O)C(C[C@H]1CCCO1)C(F)(F)F)c1ccccc1	ZINC000593039974	459750929	/nfs/dbraw/zinc/75/09/29/459750929.db2.gz	VZFUNZZCOCXARE-ZIAGYGMSSA-N	0	3	326.318	3.291	20	30		EGEDHN
C=CCN1CC[C@H](NCC2(c3c(F)cccc3F)CCCC2)C1=O	ZINC000493600424	459755056	/nfs/dbraw/zinc/75/50/56/459755056.db2.gz	CILQPQIRTNIRQX-INIZCTEOSA-N	0	3	334.410	3.153	20	30		EGEDHN
COC[C@@H](NCC(=O)Nc1ccccc1SC[C@@H](C)C#N)C(C)C	ZINC000544414208	459758024	/nfs/dbraw/zinc/75/80/24/459758024.db2.gz	CYRIRPUNMABGSR-GOEBONIOSA-N	0	3	349.500	3.137	20	30		EGEDHN
C[C@@H]1CCC[C@](C#N)(NC(=O)[C@@H]2CCN(Cc3ccccc3)C2)C1	ZINC000565186302	459782498	/nfs/dbraw/zinc/78/24/98/459782498.db2.gz	UPWTYVFSKALABR-POAQFYNOSA-N	0	3	325.456	3.097	20	30		EGEDHN
N#Cc1ccsc1C(=O)N1CCN(c2ccnc3ccccc32)CC1	ZINC000574144127	459784023	/nfs/dbraw/zinc/78/40/23/459784023.db2.gz	RGCFVHYILNFZAX-UHFFFAOYSA-N	0	3	348.431	3.130	20	30		EGEDHN
C[C@H](CCc1ccccc1)CN1CCN(c2cnccc2C#N)CC1	ZINC000584816274	459806859	/nfs/dbraw/zinc/80/68/59/459806859.db2.gz	CZDFHUWSZVHPMX-GOSISDBHSA-N	0	3	334.467	3.344	20	30		EGEDHN
Cc1c2ccccc2oc1[C@@H](NC[C@@H](O)CN(C)CCC#N)C(C)C	ZINC000584834295	459811172	/nfs/dbraw/zinc/81/11/72/459811172.db2.gz	ICBCESWMQNKSPZ-APWZRJJASA-N	0	3	343.471	3.234	20	30		EGEDHN
CCC(C#N)(CC)C(=O)N1CCC(CCN2C[C@H](C)O[C@@H](C)C2)CC1	ZINC000528799170	459814260	/nfs/dbraw/zinc/81/42/60/459814260.db2.gz	PJNDBBFQCHTQEY-IRXDYDNUSA-N	0	3	349.519	3.054	20	30		EGEDHN
COCCc1ccc(OC[C@@H](C)NCc2ccc(C#N)cc2F)cc1	ZINC000597055163	459827169	/nfs/dbraw/zinc/82/71/69/459827169.db2.gz	BIAPMFGAASWEMH-OAHLLOKOSA-N	0	3	342.414	3.443	20	30		EGEDHN
CCC(C#N)C(=O)N(C)[C@H](C(=O)OC)c1cccc(Cl)c1Cl	ZINC000598428318	459896981	/nfs/dbraw/zinc/89/69/81/459896981.db2.gz	MVHKHSYESPTOAZ-ZANVPECISA-N	0	3	343.210	3.216	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)CCCCCC#N	ZINC000588160346	459922146	/nfs/dbraw/zinc/92/21/46/459922146.db2.gz	GWLNNBSWHUHNSS-MJGOQNOKSA-N	0	3	327.472	3.487	20	30		EGEDHN
CCN1CCN(c2cccc(NC(=O)CCCCCC#N)c2)CC1	ZINC000588164354	459923047	/nfs/dbraw/zinc/92/30/47/459923047.db2.gz	HCUHTZTWGFZWHD-UHFFFAOYSA-N	0	3	328.460	3.241	20	30		EGEDHN
COC1CCN(C2(CNc3ncc(C#N)cc3Cl)CCCC2)CC1	ZINC000609350762	459948418	/nfs/dbraw/zinc/94/84/18/459948418.db2.gz	QHTMTPOAWGADIU-UHFFFAOYSA-N	0	3	348.878	3.442	20	30		EGEDHN
C[C@@H](NC[C@H](O)CC(C)(C)C#N)c1nc2ccccc2n1C(F)F	ZINC000598605601	459960566	/nfs/dbraw/zinc/96/05/66/459960566.db2.gz	BXKKKFDEOXEZOD-VXGBXAGGSA-N	0	3	336.386	3.383	20	30		EGEDHN
C[C@@H](NC1CCN(Cc2cccc(C#N)c2)CC1)c1cncs1	ZINC000593719341	459962045	/nfs/dbraw/zinc/96/20/45/459962045.db2.gz	CANNGRCEAJSGEG-CQSZACIVSA-N	0	3	326.469	3.330	20	30		EGEDHN
CC(C)[C@H](NC[C@H]1CNc2c(C#N)cnn2C1)c1ccc(F)cc1F	ZINC000575399357	459968983	/nfs/dbraw/zinc/96/89/83/459968983.db2.gz	QHSDJFDITIDUHY-SJCJKPOMSA-N	0	3	345.397	3.062	20	30		EGEDHN
CC(C)(C(=O)N1CCc2c(CC#N)cccc2C1)[C@@H](N)c1ccccc1	ZINC000602574102	460004988	/nfs/dbraw/zinc/00/49/88/460004988.db2.gz	RLBJGPXSFZXYKU-FQEVSTJZSA-N	0	3	347.462	3.364	20	30		EGEDHN
CCOc1cccc(CNC[C@@H](O)CC(C)(C)C#N)c1OC(F)F	ZINC000598724227	460008014	/nfs/dbraw/zinc/00/80/14/460008014.db2.gz	JPTOKKJJVBXSJS-ZDUSSCGKSA-N	0	3	342.386	3.077	20	30		EGEDHN
Cc1cc(CNC[C@@H](O)CC(C)(C)C#N)ccc1Br	ZINC000598727465	460008490	/nfs/dbraw/zinc/00/84/90/460008490.db2.gz	IFLDDLIOSDIZJC-ZDUSSCGKSA-N	0	3	325.250	3.148	20	30		EGEDHN
Cc1ccc([C@@H](CN[C@@H](C)CC2(C#N)CCOCC2)N2CCCC2)o1	ZINC000602585032	460010943	/nfs/dbraw/zinc/01/09/43/460010943.db2.gz	BNDJBLCMJXZWOT-FUHWJXTLSA-N	0	3	345.487	3.414	20	30		EGEDHN
COc1ccc2c(c1)[C@@H](N[C@@H](C)CC1(C#N)CCOCC1)CCO2	ZINC000602613345	460022762	/nfs/dbraw/zinc/02/27/62/460022762.db2.gz	YDLBXQZPZQGKCG-YOEHRIQHSA-N	0	3	330.428	3.207	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CC(Cc3ccsc3)C2)cc1	ZINC000598779420	460031297	/nfs/dbraw/zinc/03/12/97/460031297.db2.gz	VJJOUGZAKAIFBF-GOSISDBHSA-N	0	3	335.432	3.003	20	30		EGEDHN
CC(C)CN(C(=O)[C@H](C)Cc1ccc(C#N)cc1)C1CCN(C)CC1	ZINC000594031383	460063663	/nfs/dbraw/zinc/06/36/63/460063663.db2.gz	ZOGHQLVWMXVHJU-QGZVFWFLSA-N	0	3	341.499	3.316	20	30		EGEDHN
CCO[C@@H]1C[C@H](N[C@H]2CCCc3cc(C#N)ccc32)[C@]12CCCO2	ZINC000602694193	460069386	/nfs/dbraw/zinc/06/93/86/460069386.db2.gz	HAVZQHVTPLMTLK-VNTMZGSJSA-N	0	3	326.440	3.252	20	30		EGEDHN
Cc1cc(C)c(C#N)c(NC(=O)C(C[C@H]2CCCO2)C(F)(F)F)n1	ZINC000598858120	460071562	/nfs/dbraw/zinc/07/15/62/460071562.db2.gz	WXIGKUQBDKQMTM-DGCLKSJQSA-N	0	3	341.333	3.256	20	30		EGEDHN
CN1CCC(n2ncc3cc(-c4ccc(F)cc4C#N)cnc32)CC1	ZINC000598929923	460092926	/nfs/dbraw/zinc/09/29/26/460092926.db2.gz	OCAUQCWSRBYGKS-UHFFFAOYSA-N	0	3	335.386	3.376	20	30		EGEDHN
CC1(C(=O)N2CCC[C@@H](CC#N)C2)CCN(Cc2ccccc2)CC1	ZINC000597905938	460103532	/nfs/dbraw/zinc/10/35/32/460103532.db2.gz	INPFKWHGSGLKRT-IBGZPJMESA-N	0	3	339.483	3.441	20	30		EGEDHN
N#CC[C@@H]1CCCN(C(=O)[C@H]2CCCN(Cc3cccc(F)c3)C2)C1	ZINC000597911392	460105831	/nfs/dbraw/zinc/10/58/31/460105831.db2.gz	LGCAPJXEEDRZNU-WMZOPIPTSA-N	0	3	343.446	3.190	20	30		EGEDHN
N#Cc1ccc(CN(C(=O)Nc2ccc3c(c2)CNC3)C2CC2)cc1	ZINC000576329288	460117443	/nfs/dbraw/zinc/11/74/43/460117443.db2.gz	SFKMYLSSEYZDTH-UHFFFAOYSA-N	0	3	332.407	3.358	20	30		EGEDHN
N#CCC1(CN2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)CC1	ZINC000602791616	460128225	/nfs/dbraw/zinc/12/82/25/460128225.db2.gz	QBJJMHXMELNPCG-UHFFFAOYSA-N	0	3	332.835	3.079	20	30		EGEDHN
C[C@@H](NC(=O)NCc1cccc(CN(C)C)c1)c1cccc(C#N)c1	ZINC000610347723	460128806	/nfs/dbraw/zinc/12/88/06/460128806.db2.gz	KZOGTIQKEIABPO-OAHLLOKOSA-N	0	3	336.439	3.180	20	30		EGEDHN
CC[C@@H]1CCCCN1CCNC(=O)N[C@H](C)c1cccc(C#N)c1	ZINC000610351352	460131064	/nfs/dbraw/zinc/13/10/64/460131064.db2.gz	NVOMZXASWYBLMH-CRAIPNDOSA-N	0	3	328.460	3.183	20	30		EGEDHN
C[C@H](NC(=O)NC[C@H](c1ccccc1)N(C)C)c1cccc(C#N)c1	ZINC000610356021	460132266	/nfs/dbraw/zinc/13/22/66/460132266.db2.gz	HLSBBTVEULCVIK-HNAYVOBHSA-N	0	3	336.439	3.221	20	30		EGEDHN
C[C@H](NC(=O)N1CCN(C2CCC2)C[C@@H](C)C1)c1cccc(C#N)c1	ZINC000589893149	460156611	/nfs/dbraw/zinc/15/66/11/460156611.db2.gz	LJHQUNVWAOZYIQ-CVEARBPZSA-N	0	3	340.471	3.135	20	30		EGEDHN
CCC(C)(C)N1CCN(C(=O)N[C@H](C)c2cccc(C#N)c2)CC1	ZINC000594227379	460161085	/nfs/dbraw/zinc/16/10/85/460161085.db2.gz	NGXDFJBSZJGPSH-OAHLLOKOSA-N	0	3	328.460	3.135	20	30		EGEDHN
CCC(C)(C)N1CCN(C(=O)N[C@@H]2CCc3cc(C#N)ccc32)CC1	ZINC000594240934	460168080	/nfs/dbraw/zinc/16/80/80/460168080.db2.gz	KEMKNECJGNNROF-GOSISDBHSA-N	0	3	340.471	3.061	20	30		EGEDHN
C[C@H](C(=O)N(CCN(C)C)Cc1cccc(C#N)c1)C1CCCC1	ZINC000610520786	460174497	/nfs/dbraw/zinc/17/44/97/460174497.db2.gz	WXRNIIVBBZRCQS-INIZCTEOSA-N	0	3	327.472	3.275	20	30		EGEDHN
CN(CCc1ccccc1)[C@H]1CCN(C(=O)c2ccc(CC#N)cc2)C1	ZINC000598195627	460200441	/nfs/dbraw/zinc/20/04/41/460200441.db2.gz	PWFFOTFFADYFKF-NRFANRHFSA-N	0	3	347.462	3.142	20	30		EGEDHN
Cc1ccccc1CN(C[C@@H](O)COc1ccccc1C#N)C1CC1	ZINC000599272990	460213178	/nfs/dbraw/zinc/21/31/78/460213178.db2.gz	UUAKXQORLJUIQT-HXUWFJFHSA-N	0	3	336.435	3.271	20	30		EGEDHN
N#CCCCC[C@@H](N)C(=O)Nc1cc(F)ccc1OCC(F)(F)F	ZINC000594426009	460216370	/nfs/dbraw/zinc/21/63/70/460216370.db2.gz	BZCXASNTZBVIHQ-LLVKDONJSA-N	0	3	347.312	3.117	20	30		EGEDHN
C[C@H](NC(=O)[C@H](N)CCCCC#N)c1nc(-c2ccccc2)cs1	ZINC000594434792	460218482	/nfs/dbraw/zinc/21/84/82/460218482.db2.gz	TVAMQNMLIBIWOH-DZGCQCFKSA-N	0	3	342.468	3.399	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1)C(=O)Nc1cc(F)cc(C#N)c1	ZINC000603074612	460236284	/nfs/dbraw/zinc/23/62/84/460236284.db2.gz	CVWKTGITPIXKKC-UHFFFAOYSA-N	0	3	340.402	3.293	20	30		EGEDHN
C[C@@H]1CN(CCOc2ccc(C#N)cc2)CC[C@@H]1C(=O)OC(C)(C)C	ZINC000599597329	460284978	/nfs/dbraw/zinc/28/49/78/460284978.db2.gz	SJKHIOIZHGQUHW-QAPCUYQASA-N	0	3	344.455	3.237	20	30		EGEDHN
COc1ccc(CN(C)C)cc1NC(=O)CCc1ccc(C#N)cc1	ZINC000603589817	460325007	/nfs/dbraw/zinc/32/50/07/460325007.db2.gz	FBMHFJBPVWSVGV-UHFFFAOYSA-N	0	3	337.423	3.200	20	30		EGEDHN
C[C@@H](NC[C@@H](O)COc1cccc2[nH]ccc21)c1cccc(C#N)c1	ZINC000611388488	460351396	/nfs/dbraw/zinc/35/13/96/460351396.db2.gz	PFOWVNJZMNZGMN-RHSMWYFYSA-N	0	3	335.407	3.130	20	30		EGEDHN
C=C(CNCc1ccc(O[C@@H](C)C(=O)OC)cc1)c1ccccc1	ZINC000611437731	460365806	/nfs/dbraw/zinc/36/58/06/460365806.db2.gz	YBSOXDLZVMIOLB-INIZCTEOSA-N	0	3	325.408	3.430	20	30		EGEDHN
Cc1cccc(C)c1OC[C@H](O)CN[C@H](C)c1ccc(C#N)c(F)c1	ZINC000611465529	460370697	/nfs/dbraw/zinc/37/06/97/460370697.db2.gz	LIEMZMWROJTPTL-CRAIPNDOSA-N	0	3	342.414	3.405	20	30		EGEDHN
COc1ccc([C@@H](NC2CCN(CC#N)CC2)c2ccccc2)cc1	ZINC000611519340	460386020	/nfs/dbraw/zinc/38/60/20/460386020.db2.gz	WPBTYHAUDCPHAU-NRFANRHFSA-N	0	3	335.451	3.362	20	30		EGEDHN
C[C@@H](NC(=O)c1c(Cl)cc(C#N)cc1Cl)C1=CCN(C)CC1	ZINC000611583097	460409616	/nfs/dbraw/zinc/40/96/16/460409616.db2.gz	RDNWCZSPLQAOED-SNVBAGLBSA-N	0	3	338.238	3.245	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)Cc1cnc2ccccc2n1	ZINC000600162438	460413770	/nfs/dbraw/zinc/41/37/70/460413770.db2.gz	YHLUWFNZMDFYCW-UHFFFAOYSA-N	0	3	345.450	3.065	20	30		EGEDHN
N#Cc1ccc(CN[C@H](CO)C2CCCCC2)c(Br)c1	ZINC000611684729	460429053	/nfs/dbraw/zinc/42/90/53/460429053.db2.gz	PZZTTWNJPOLMQZ-MRXNPFEDSA-N	0	3	337.261	3.352	20	30		EGEDHN
C[C@@H](CC(=O)N1CCCCCC1)NCc1ccc(C#N)c(Cl)c1	ZINC000619755629	460431857	/nfs/dbraw/zinc/43/18/57/460431857.db2.gz	NWLXDLYKVUFPEX-AWEZNQCLSA-N	0	3	333.863	3.482	20	30		EGEDHN
C=CCOc1c(Cl)cc(CNCCn2ccnc2C)cc1OC	ZINC000623387142	460522182	/nfs/dbraw/zinc/52/21/82/460522182.db2.gz	LWPXWPBAGDMINE-UHFFFAOYSA-N	0	3	335.835	3.208	20	30		EGEDHN
CC[C@H](CC#N)NC(=O)c1ccccc1OCCN1CCCC[C@H]1C	ZINC000613037135	460809427	/nfs/dbraw/zinc/80/94/27/460809427.db2.gz	HXTHMDAPXDOVJJ-IAGOWNOFSA-N	0	3	343.471	3.362	20	30		EGEDHN
C[C@H](c1ccccc1)[C@@H](CO)NCc1ccc(C#N)cc1OC(F)F	ZINC000613389291	460932298	/nfs/dbraw/zinc/93/22/98/460932298.db2.gz	HWBJRYHNKYNSEE-CXAGYDPISA-N	0	3	346.377	3.414	20	30		EGEDHN
C=CC[C@H]1CCCN(C(=O)[C@H]2CCCN(Cc3cccnc3)C2)C1	ZINC000617785275	460976881	/nfs/dbraw/zinc/97/68/81/460976881.db2.gz	IGCSLAQHZYMWGX-HKUYNNGSSA-N	0	3	327.472	3.108	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CC(C)(c3ccccc3)C2)CC1	ZINC000621456382	461043744	/nfs/dbraw/zinc/04/37/44/461043744.db2.gz	FXQCTBBLFYAXND-UHFFFAOYSA-N	0	3	327.472	3.010	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2C[C@]2(C)c2ccccc2)CC1	ZINC000608426152	461059615	/nfs/dbraw/zinc/05/96/15/461059615.db2.gz	DSRAHQQOKQRVSP-UYAOXDASSA-N	0	3	327.472	3.056	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN(C)C[C@@H](O)C2CC2)cc1OC	ZINC000628279380	461070285	/nfs/dbraw/zinc/07/02/85/461070285.db2.gz	HUSWDDTUJKVAEK-OAHLLOKOSA-N	0	3	325.836	3.116	20	30		EGEDHN
C=CCN(Cc1ccccc1F)C(=O)N[C@H]1CCN(C(C)(C)C)C1	ZINC000665557360	461126835	/nfs/dbraw/zinc/12/68/35/461126835.db2.gz	SHFICHMWKQBLDQ-INIZCTEOSA-N	0	3	333.451	3.396	20	30		EGEDHN
C=CC[C@H]1CCCN(C(=O)Nc2cccc(OCCN(C)C)c2)C1	ZINC000665601888	461154802	/nfs/dbraw/zinc/15/48/02/461154802.db2.gz	HEJTXTZVHGHWBR-INIZCTEOSA-N	0	3	331.460	3.447	20	30		EGEDHN
C=CCN(CCc1ccco1)C(=O)N[C@@H](C)CN1CCC(C)CC1	ZINC000666756145	461790558	/nfs/dbraw/zinc/79/05/58/461790558.db2.gz	HCVPGVAWMOBBDY-KRWDZBQOSA-N	0	3	333.476	3.140	20	30		EGEDHN
C=CCC1(NC(=O)Nc2ccn(C3CCN(C)CC3)n2)CCCC1	ZINC000666925887	461871060	/nfs/dbraw/zinc/87/10/60/461871060.db2.gz	HDQNDLNRRVAVIS-UHFFFAOYSA-N	0	3	331.464	3.160	20	30		EGEDHN
C=CCCn1cc(CNCC2(c3cccc(OC)c3)CCCC2)nn1	ZINC000657355217	462067695	/nfs/dbraw/zinc/06/76/95/462067695.db2.gz	GLOBQLJEDIRMQA-UHFFFAOYSA-N	0	3	340.471	3.464	20	30		EGEDHN
C=CCN(CCC(=O)Nc1cc(Cl)ccc1OC)[C@H](C)COC	ZINC000661244540	462168625	/nfs/dbraw/zinc/16/86/25/462168625.db2.gz	URKGTQXUXJWLGL-CYBMUJFWSA-N	0	3	340.851	3.200	20	30		EGEDHN
C=CCOCCN1CCC(c2c(OC)cc(OC)cc2OC)CC1	ZINC000645076390	462171958	/nfs/dbraw/zinc/17/19/58/462171958.db2.gz	PKVQHSCSBULROD-UHFFFAOYSA-N	0	3	335.444	3.094	20	30		EGEDHN
C=CCCOCC(=O)N(C(C)C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000648565572	462179044	/nfs/dbraw/zinc/17/90/44/462179044.db2.gz	FSJFEKGICRIVOT-IBGZPJMESA-N	0	3	330.472	3.091	20	30		EGEDHN
C=CC[C@H](CC)NC(=O)N1CC[C@@H](N(C)CCc2ccccc2)C1	ZINC000664809068	462196349	/nfs/dbraw/zinc/19/63/49/462196349.db2.gz	HMFYTKGOCYWPLJ-RBUKOAKNSA-N	0	3	329.488	3.300	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)N[C@H]2CCCN3CCCC[C@@H]23)cc1	ZINC000654561295	462285904	/nfs/dbraw/zinc/28/59/04/462285904.db2.gz	HMFMFJCEEARVCQ-OALUTQOASA-N	0	3	343.471	3.068	20	30		EGEDHN
Cc1sc(NC(=O)CN[C@H]2CC(C)(C)OC2(C)C)c(C#N)c1C	ZINC000132443714	534611935	/nfs/dbraw/zinc/61/19/35/534611935.db2.gz	COCFBJKXXUQRDJ-ZDUSSCGKSA-N	0	3	335.473	3.111	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(C)CCCCc2ccccc2)CC1	ZINC000171741679	526423530	/nfs/dbraw/zinc/42/35/30/526423530.db2.gz	BFMPMSZIXKSHOB-UHFFFAOYSA-N	0	3	329.488	3.301	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(Cc2ccc(C#N)cc2)C(C)C)CC1	ZINC000171738676	526424919	/nfs/dbraw/zinc/42/49/19/526424919.db2.gz	ZAFOPKIXTGORFI-UHFFFAOYSA-N	0	3	340.471	3.129	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@@H]2c2ccccc2C)CC1	ZINC000171740398	526426432	/nfs/dbraw/zinc/42/64/32/526426432.db2.gz	UUOPBLAUOICVID-LJQANCHMSA-N	0	3	327.472	3.492	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cc(OC)ccc2OC(C)C)CC1	ZINC000171642417	526441208	/nfs/dbraw/zinc/44/12/08/526441208.db2.gz	CEKUVVQBJMEJLR-UHFFFAOYSA-N	0	3	347.459	3.254	20	30		EGEDHN
C=CCOc1ccc(CNC(C)(C)CCS(C)(=O)=O)cc1Cl	ZINC000174641295	526884305	/nfs/dbraw/zinc/88/43/05/526884305.db2.gz	WTQWPCLGBIZBGF-UHFFFAOYSA-N	0	3	345.892	3.208	20	30		EGEDHN
C=CCC[C@@H](NC(=O)N[C@@H]1CCN(CC2CC2)C1)c1ccccc1	ZINC000158689904	546930440	/nfs/dbraw/zinc/93/04/40/546930440.db2.gz	IFOJLSJXYWKGOL-RTBURBONSA-N	0	3	327.472	3.477	20	30		EGEDHN
C[C@H](C(=O)NC1(C#N)CCCCC1)N1CC[C@@H](Cc2ccccc2)C1	ZINC000246617303	547282311	/nfs/dbraw/zinc/28/23/11/547282311.db2.gz	GYRQUKWXVNCRQS-MJGOQNOKSA-N	0	3	339.483	3.282	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2C[C@@H](C)C[C@@H]2c2ccccc2)CC1	ZINC000287580777	547400441	/nfs/dbraw/zinc/40/04/41/547400441.db2.gz	XLPIDKVMSRDCSH-QFBILLFUSA-N	0	3	327.472	3.430	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2C[C@H](C)C[C@H]2c2ccccc2)CC1	ZINC000287580768	547400452	/nfs/dbraw/zinc/40/04/52/547400452.db2.gz	XLPIDKVMSRDCSH-APWZRJJASA-N	0	3	327.472	3.430	20	30		EGEDHN
CN(C(=O)c1ccc(C#Cc2ccccc2)cc1)C1CCN(C)CC1	ZINC000684357221	550318809	/nfs/dbraw/zinc/31/88/09/550318809.db2.gz	DDUPONQPBLYPEY-UHFFFAOYSA-N	0	3	332.447	3.253	20	30		EGEDHN
C#Cc1cccc(NC(=S)N(CCN(C)C)Cc2ccccc2)c1	ZINC000726448675	574554198	/nfs/dbraw/zinc/55/41/98/574554198.db2.gz	RFLBMBKYOPSYNK-UHFFFAOYSA-N	0	3	337.492	3.429	20	30		EGEDHN
C#Cc1cccc(NC(=S)N[C@H]2CCN(Cc3ccccc3)C2)c1	ZINC000726440712	574555070	/nfs/dbraw/zinc/55/50/70/574555070.db2.gz	GKYFNOPXRIHNOM-IBGZPJMESA-N	0	3	335.476	3.229	20	30		EGEDHN
CCC(=O)N[C@H](C)C(=O)C(C#N)c1nc2cc(Cl)ccc2s1	ZINC000729069496	574810580	/nfs/dbraw/zinc/81/05/80/574810580.db2.gz	FXMYRUALHRRHJK-PSASIEDQSA-N	0	3	335.816	3.041	20	30		EGEDHN
C=CCCOC(=O)C1CCN(c2cc(Cl)ccc2Cl)C1=O	ZINC000729074382	574811011	/nfs/dbraw/zinc/81/10/11/574811011.db2.gz	WUSCLAHIWOQMJK-LLVKDONJSA-N	0	3	328.195	3.466	20	30		EGEDHN
CC(=NNCCCc1ccccc1)c1ccc(N2CCOCC2)cc1	ZINC000729145680	574818455	/nfs/dbraw/zinc/81/84/55/574818455.db2.gz	ACRHZYGZMNSLKA-UHFFFAOYSA-N	0	3	337.467	3.470	20	30		EGEDHN
C=C(C)CN1CCC(NC(=S)Nc2ccc(C(C)=O)cc2)CC1	ZINC000729942337	574897820	/nfs/dbraw/zinc/89/78/20/574897820.db2.gz	KKQFMXKYSZKHNA-UHFFFAOYSA-N	0	3	331.485	3.216	20	30		EGEDHN
C#CCOc1cccc(OC(=O)c2ccc(CN(CC)CC)o2)c1	ZINC000730501233	574994514	/nfs/dbraw/zinc/99/45/14/574994514.db2.gz	GRZVELMWFNHCQK-UHFFFAOYSA-N	0	3	327.380	3.353	20	30		EGEDHN
CC1CCN(CCCNC=C2C(=O)CC3(CCCCC3)CC2=O)CC1	ZINC000730999238	575043033	/nfs/dbraw/zinc/04/30/33/575043033.db2.gz	QRDSQXVUHHJCGW-UHFFFAOYSA-N	0	3	346.515	3.464	20	30		EGEDHN
C[C@@H]1CCC[C@@H](OCC(=O)C(C#N)c2nc3ccccc3n2C)C1	ZINC000733053101	575303740	/nfs/dbraw/zinc/30/37/40/575303740.db2.gz	JEBLJTJZNOMMNI-KFWWJZLASA-N	0	3	325.412	3.345	20	30		EGEDHN
C[C@@H]1CCCC[C@H]1OCC(=O)C(C#N)c1nc2ccccc2n1C	ZINC000733676627	575380757	/nfs/dbraw/zinc/38/07/57/575380757.db2.gz	CWIWIJCURPATNM-QWQRMKEZSA-N	0	3	325.412	3.345	20	30		EGEDHN
C[C@@H]1CCCC[C@H]1OCC(=O)C(C#N)c1nc2ccccc2n1C	ZINC000733676623	575380791	/nfs/dbraw/zinc/38/07/91/575380791.db2.gz	CWIWIJCURPATNM-HBUWYVDXSA-N	0	3	325.412	3.345	20	30		EGEDHN
Cc1nc(CCC(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)cs1	ZINC000733679058	575381139	/nfs/dbraw/zinc/38/11/39/575381139.db2.gz	SKTUHTBPJPQSHD-CQSZACIVSA-N	0	3	347.827	3.385	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]\Cc2ccc(C(=O)OC)o2)c([O-])c1	ZINC000734094415	575438955	/nfs/dbraw/zinc/43/89/55/575438955.db2.gz	NVOYXZVHOZVAEJ-ODLFYWEKSA-N	0	3	330.384	3.237	20	30		EGEDHN
CCN(CC)c1ccc(/C=N\Cc2ccc(C(=O)OC)o2)c(O)c1	ZINC000734094415	575438958	/nfs/dbraw/zinc/43/89/58/575438958.db2.gz	NVOYXZVHOZVAEJ-ODLFYWEKSA-N	0	3	330.384	3.237	20	30		EGEDHN
N#CC(C(=O)CCc1cc(Cl)cs1)C(=O)NCc1ccccc1	ZINC000737316358	576203640	/nfs/dbraw/zinc/20/36/40/576203640.db2.gz	JKDQZUCMWQESKB-HNNXBMFYSA-N	0	3	346.839	3.359	20	30		EGEDHN
C=C(C)CNC(=S)N(C)[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000737458546	576232833	/nfs/dbraw/zinc/23/28/33/576232833.db2.gz	WPBFQXCUCZPDAS-SJLPKXTDSA-N	0	3	331.529	3.422	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2ccc(Oc3cccnc3)cc2)CC1	ZINC000740737288	576621765	/nfs/dbraw/zinc/62/17/65/576621765.db2.gz	JNDQKBZHJFQTHQ-UHFFFAOYSA-N	0	3	349.434	3.091	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)C[C@H]3c4ccccc4NC3=O)nc21	ZINC000741122413	576656596	/nfs/dbraw/zinc/65/65/96/576656596.db2.gz	QMUGCVYXVSCGBF-UONOGXRCSA-N	0	3	344.374	3.174	20	30		EGEDHN
COc1ccc(CNC[C@H](O)c2c(F)cccc2Cl)cc1C#N	ZINC000742372485	576775133	/nfs/dbraw/zinc/77/51/33/576775133.db2.gz	NMWBLTNWAYAJTQ-HNNXBMFYSA-N	0	3	334.778	3.183	20	30		EGEDHN
CCC[NH+]1CCC(/N=C\c2cc(Br)ccc2[O-])CC1	ZINC000743334218	576805925	/nfs/dbraw/zinc/80/59/25/576805925.db2.gz	RISSWPPDLXAWJX-BOPFTXTBSA-N	0	3	325.250	3.448	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2ccc3c(c2)-c2ccccc2C3)CC1	ZINC000743488702	576810234	/nfs/dbraw/zinc/81/02/34/576810234.db2.gz	QHRFZMJMQIHTJX-UHFFFAOYSA-N	0	3	344.458	3.475	20	30		EGEDHN
C[C@@H](C(=O)C(C#N)C(=O)N1CCCC1)c1ccccc1C(F)(F)F	ZINC000744023433	576819055	/nfs/dbraw/zinc/81/90/55/576819055.db2.gz	JDYBQRJTTXIROA-DGCLKSJQSA-N	0	3	338.329	3.140	20	30		EGEDHN
C[C@@H]1CC[C@H](CCC(=O)C(C#N)C(=O)Nc2ccccc2Cl)O1	ZINC000744027691	576819142	/nfs/dbraw/zinc/81/91/42/576819142.db2.gz	BIZJKXBKDRLXMK-JHJVBQTASA-N	0	3	334.803	3.335	20	30		EGEDHN
C=CCNC(=O)C(C#N)C(=O)[C@H]1C[C@H]1c1cc(Cl)cc(Cl)c1	ZINC000744031117	576819168	/nfs/dbraw/zinc/81/91/68/576819168.db2.gz	QTEPABNQFLVSGD-MELADBBJSA-N	0	3	337.206	3.108	20	30		EGEDHN
C=CCNC(=O)C(C#N)C(=O)C[C@@H](C)c1ccccc1C(F)(F)F	ZINC000744030854	576819220	/nfs/dbraw/zinc/81/92/20/576819220.db2.gz	NEFMSPMTFWVWJQ-DGCLKSJQSA-N	0	3	338.329	3.210	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)c2ccc(N3CCCC3=O)cc2)n1	ZINC000041521790	1291418376	/nfs/dbraw/zinc/41/83/76/1291418376.db2.gz	LSWZLKWTNBGZBI-AWEZNQCLSA-N	0	3	325.393	3.068	20	30		EGEDHN
CC(C)(C)OC(=O)NCCCC(=O)C(C#N)c1nc2ccccc2o1	ZINC000066516848	1292119715	/nfs/dbraw/zinc/11/97/15/1292119715.db2.gz	PQZWVICORXKBFX-GFCCVEGCSA-N	0	3	343.383	3.309	20	30		EGEDHN
COc1ccc(CNCc2ccc(N(C)CCC#N)cc2)cc1F	ZINC000075734641	1292408479	/nfs/dbraw/zinc/40/84/79/1292408479.db2.gz	OFUFAIZNMRWZDW-UHFFFAOYSA-N	0	3	327.403	3.474	20	30		EGEDHN
COC(=O)N[C@@H](CC(C)C)C(=O)C(C#N)c1nc(C(C)C)cs1	ZINC000080459864	1292604911	/nfs/dbraw/zinc/60/49/11/1292604911.db2.gz	RDIXCUWLZNKPDB-RYUDHWBXSA-N	0	3	337.445	3.213	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl	ZINC000107409394	1293066123	/nfs/dbraw/zinc/06/61/23/1293066123.db2.gz	HECABHIFSKPFOL-JHJVBQTASA-N	0	3	339.222	3.330	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)CCCC(=O)C(C)(C)C)c1	ZINC000835062819	1293196388	/nfs/dbraw/zinc/19/63/88/1293196388.db2.gz	FNINUHQASVRGRS-HNNXBMFYSA-N	0	3	328.412	3.428	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)C[C@@H]1CCc2ccccc21	ZINC000115904692	1293196405	/nfs/dbraw/zinc/19/64/05/1293196405.db2.gz	XVRFKPAWWMHLDP-DOTOQJQBSA-N	0	3	348.402	3.463	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)c1cccc(CC)n1	ZINC000835063468	1293197106	/nfs/dbraw/zinc/19/71/06/1293197106.db2.gz	YYRYMQCHCQKYSK-CQSZACIVSA-N	0	3	337.379	3.004	20	30		EGEDHN
CC[C@H](CC(F)(F)F)C(=O)C(C#N)C(=O)Nc1ccc(OC)cc1	ZINC000835066188	1293197974	/nfs/dbraw/zinc/19/79/74/1293197974.db2.gz	WMPQLTVTHJIUDW-MFKMUULPSA-N	0	3	342.317	3.321	20	30		EGEDHN
CCCCCCCN1CCN(CCNC(=O)c2ccccc2F)CC1	ZINC000119037966	1293251005	/nfs/dbraw/zinc/25/10/05/1293251005.db2.gz	ZVQPIXVVWDWBBL-UHFFFAOYSA-N	0	3	349.494	3.144	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)CCCC(=O)C1CC1)c1ccccc1	ZINC000835342206	1293268408	/nfs/dbraw/zinc/26/84/08/1293268408.db2.gz	ZPLKKEIURIYAGE-IRXDYDNUSA-N	0	3	340.423	3.112	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)COCC1CCCC1)c1ccccc1	ZINC000835340983	1293268598	/nfs/dbraw/zinc/26/85/98/1293268598.db2.gz	QUZPYNFYYVHQIJ-ROUUACIJSA-N	0	3	342.439	3.170	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)[C@@H](C)Cc1ccc(C(F)(F)F)cc1	ZINC000121771150	1293388339	/nfs/dbraw/zinc/38/83/39/1293388339.db2.gz	MJBMAOPWIPHVFL-FZMZJTMJSA-N	0	3	340.345	3.117	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)[C@H](C)Cc1cccc(C(F)(F)F)c1	ZINC000121770818	1293388981	/nfs/dbraw/zinc/38/89/81/1293388981.db2.gz	GJQUWUCPJDGMQE-RISCZKNCSA-N	0	3	340.345	3.117	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)c2cc(F)cc(F)c2)cc1	ZINC000128397000	1293592564	/nfs/dbraw/zinc/59/25/64/1293592564.db2.gz	VBSYSSZRNHIRCU-INIZCTEOSA-N	0	3	328.318	3.488	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H](O)c1ccccc1Br	ZINC000152764632	1293984497	/nfs/dbraw/zinc/98/44/97/1293984497.db2.gz	QFXSCFQGVNVOQU-KRWDZBQOSA-N	0	3	345.240	3.486	20	30		EGEDHN
C[C@@H](C(=O)C(C#N)C(=O)NCc1ccccc1)c1c(F)cccc1F	ZINC000153272674	1294006202	/nfs/dbraw/zinc/00/62/02/1294006202.db2.gz	LXGNJLWSQKXDGM-TZMCWYRMSA-N	0	3	342.345	3.094	20	30		EGEDHN
C[C@@H](C(=O)C(C#N)C(=O)Nc1ccccc1)c1c(F)cccc1F	ZINC000153292734	1294007470	/nfs/dbraw/zinc/00/74/70/1294007470.db2.gz	CVOCIMDYRQRNNC-DGCLKSJQSA-N	0	3	328.318	3.416	20	30		EGEDHN
C[C@@H](Cc1ccccc1Cl)C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000155196859	1294088287	/nfs/dbraw/zinc/08/82/87/1294088287.db2.gz	DZOSORIYZSYKSE-GXTWGEPZSA-N	0	3	341.798	3.261	20	30		EGEDHN
COc1ccc(CNC(=O)C(C#N)C(=O)CCCC2CCCC2)cc1	ZINC000173996128	1294476008	/nfs/dbraw/zinc/47/60/08/1294476008.db2.gz	ZOPBCJIJAUQSLN-GOSISDBHSA-N	0	3	342.439	3.381	20	30		EGEDHN
C[C@H](CCc1ccccc1F)C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000174013105	1294477073	/nfs/dbraw/zinc/47/70/73/1294477073.db2.gz	WNBVNZCAEMKHCR-HIFRSBDPSA-N	0	3	339.370	3.137	20	30		EGEDHN
Cc1nc(CCCC(=O)C(C#N)C(=O)Nc2cccc(C)c2)cs1	ZINC000175104343	1294540162	/nfs/dbraw/zinc/54/01/62/1294540162.db2.gz	MWZYQDOJMHHHCE-INIZCTEOSA-N	0	3	341.436	3.430	20	30		EGEDHN
C=C(C)CN(C)Cc1cc(=O)oc2cc(NC(=O)OCC)ccc12	ZINC000181247299	1294951588	/nfs/dbraw/zinc/95/15/88/1294951588.db2.gz	NTGOKDBBAYQLBA-UHFFFAOYSA-N	0	3	330.384	3.369	20	30		EGEDHN
CC(C)N1CCN(c2ccc(C(=O)O[C@@H](C)C(C)(C)C#N)cc2)CC1	ZINC000183719966	1295139407	/nfs/dbraw/zinc/13/94/07/1295139407.db2.gz	UHXSKCUWHOBGSL-INIZCTEOSA-N	0	3	343.471	3.312	20	30		EGEDHN
N#CC(C(=O)CCCOC1CCOCC1)c1ccc2ccccc2n1	ZINC000870123348	1295676938	/nfs/dbraw/zinc/67/69/38/1295676938.db2.gz	QJMLJNKZYFSBDA-QGZVFWFLSA-N	0	3	338.407	3.387	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@H](C)Oc1cccc(Cl)c1	ZINC000193371845	1295858139	/nfs/dbraw/zinc/85/81/39/1295858139.db2.gz	LEHLFHXPVWGRSK-SWLSCSKDSA-N	0	3	336.819	3.123	20	30		EGEDHN
CCO[C@@H]1C[C@@H]1C(=O)C(C#N)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000193482090	1295874756	/nfs/dbraw/zinc/87/47/56/1295874756.db2.gz	XGSSOMZOYOMXGV-YNEHKIRRSA-N	0	3	341.194	3.066	20	30		EGEDHN
COCCOc1ccc(CNCc2ccc(O[C@H](C)C#N)cc2)cc1	ZINC000237151628	1296223024	/nfs/dbraw/zinc/22/30/24/1296223024.db2.gz	FLOVMISWEGBDNG-MRXNPFEDSA-N	0	3	340.423	3.292	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1	ZINC000246096232	1296337114	/nfs/dbraw/zinc/33/71/14/1296337114.db2.gz	IXLROHCVDNBFLZ-QJPTWQEYSA-N	0	3	339.222	3.330	20	30		EGEDHN
N#CC(C(=O)NC1CCCCC1)C(=O)[C@@H]1C[C@@H]1c1cccc(F)c1F	ZINC000246540082	1296359726	/nfs/dbraw/zinc/35/97/26/1296359726.db2.gz	JSODCMFJYWDXSJ-KFWWJZLASA-N	0	3	346.377	3.226	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@@H]1C[C@]12CCCc1ccccc12	ZINC000246680285	1296366798	/nfs/dbraw/zinc/36/67/98/1296366798.db2.gz	ZHNUZNRKIBPNLV-MMOPVJDHSA-N	0	3	338.451	3.296	20	30		EGEDHN
CCO[C@@H]1C[C@@H]1C(=O)C(C#N)C(=O)Nc1ccc([C@H](C)CC)cc1	ZINC000249739235	1296451522	/nfs/dbraw/zinc/45/15/22/1296451522.db2.gz	XCYIDFPMOYQIIR-ISWURRPUSA-N	0	3	328.412	3.272	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](C#N)CCC#N)C(C)(C)C1	ZINC000872223226	1296826930	/nfs/dbraw/zinc/82/69/30/1296826930.db2.gz	ONOISKSUGNKFOF-CABCVRRESA-N	0	3	334.464	3.055	20	30		EGEDHN
C#CCCOc1ccc(CNC[C@@H](O)c2c(F)cccc2F)cc1	ZINC000304309300	1296915944	/nfs/dbraw/zinc/91/59/44/1296915944.db2.gz	QQOOATXQFBMXCR-GOSISDBHSA-N	0	3	331.362	3.190	20	30		EGEDHN
C#CCOc1ccccc1CNCC(C)(C)NC(=O)OC(C)(C)C	ZINC000382735632	1297562991	/nfs/dbraw/zinc/56/29/91/1297562991.db2.gz	JOLQHOFQBZWTKD-UHFFFAOYSA-N	0	3	332.444	3.092	20	30		EGEDHN
C#CCOc1ccc(Br)cc1CNC[C@@H](CCC)OC	ZINC000393521782	1297669950	/nfs/dbraw/zinc/66/99/50/1297669950.db2.gz	PFVOFDVMNJKCHF-OAHLLOKOSA-N	0	3	340.261	3.366	20	30		EGEDHN
C#CCCCNC(=O)N(CCC)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000745902690	1298498364	/nfs/dbraw/zinc/49/83/64/1298498364.db2.gz	UVLXFLYRUCPRSG-FQEVSTJZSA-N	0	3	341.499	3.486	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1)C(=O)C1CC(OCc2ccccc2)C1	ZINC000747108087	1298728463	/nfs/dbraw/zinc/72/84/63/1298728463.db2.gz	LQCSBLVHNBTHDL-KVZIAJEVSA-N	0	3	348.402	3.329	20	30		EGEDHN
CC(C)c1cc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)nn1C	ZINC000747108756	1298728808	/nfs/dbraw/zinc/72/88/08/1298728808.db2.gz	RLZDQCYJDRSHMW-NSHDSACASA-N	0	3	344.802	3.158	20	30		EGEDHN
Cc1noc(C)c1N(C)CC(=O)C(C#N)c1nc2ccccc2s1	ZINC000749845584	1299285478	/nfs/dbraw/zinc/28/54/78/1299285478.db2.gz	GZDZVJUXQCFAMD-LBPRGKRZSA-N	0	3	340.408	3.214	20	30		EGEDHN
CN(CCCN(C)c1nc(Cl)c(C#N)s1)Cc1ccncc1	ZINC000882520776	1302001611	/nfs/dbraw/zinc/00/16/11/1302001611.db2.gz	GVWZINRZFLFUOQ-UHFFFAOYSA-N	0	3	335.864	3.021	20	30		EGEDHN
CC[C@@H](NCc1ccc(N2CCNC2=O)cc1)c1ccc(C#N)cc1	ZINC000883287436	1302365882	/nfs/dbraw/zinc/36/58/82/1302365882.db2.gz	VGDHSKABBUAMPR-LJQANCHMSA-N	0	3	334.423	3.329	20	30		EGEDHN
CCN(CC)Cc1ccc(C(=O)Oc2ccc(C#N)c(OC)c2)o1	ZINC000767158526	1302595767	/nfs/dbraw/zinc/59/57/67/1302595767.db2.gz	CGPDVKGKKHWZSF-UHFFFAOYSA-N	0	3	328.368	3.221	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN(Cc2ccc(C(N)=O)cc2)C2CC2)cc1	ZINC000768440368	1302903142	/nfs/dbraw/zinc/90/31/42/1302903142.db2.gz	QPZPDKVNKGTKJL-OAHLLOKOSA-N	0	3	349.434	3.241	20	30		EGEDHN
CCN1CCN(c2ccc(NCc3cc(C#N)cs3)cc2)CC1	ZINC000770485707	1303274969	/nfs/dbraw/zinc/27/49/69/1303274969.db2.gz	PVAAKSMJYSEFST-UHFFFAOYSA-N	0	3	326.469	3.374	20	30		EGEDHN
C[C@@H](N[C@@H](C)C(=O)NC1(C#N)CCCCC1)c1ccc(N(C)C)cc1	ZINC000774484670	1303816478	/nfs/dbraw/zinc/81/64/78/1303816478.db2.gz	PLONEHHHXBYHOE-CVEARBPZSA-N	0	3	342.487	3.134	20	30		EGEDHN
C#CC[C@@H](NC[C@H](O)COc1ccc(OCC)cc1)c1ccccc1	ZINC000775397735	1303956347	/nfs/dbraw/zinc/95/63/47/1303956347.db2.gz	ATRZHHRZUJMIRU-GHTZIAJQSA-N	0	3	339.435	3.179	20	30		EGEDHN
C[C@H](NCC(=O)N(C)C1(C#N)CCCCC1)c1ccc(N(C)C)cc1	ZINC000775836090	1304047723	/nfs/dbraw/zinc/04/77/23/1304047723.db2.gz	YVMHEPOGZDWBPK-INIZCTEOSA-N	0	3	342.487	3.088	20	30		EGEDHN
CC(C)N1CCN(c2ccc(C(=O)OCCC(C)(C)C#N)cc2)CC1	ZINC000776382548	1304145387	/nfs/dbraw/zinc/14/53/87/1304145387.db2.gz	FTRPGPRMPYURHR-UHFFFAOYSA-N	0	3	343.471	3.314	20	30		EGEDHN
CN(C)[C@@H](CNC(=O)Nc1nc(Cl)c(C#N)s1)c1ccccc1	ZINC000888406926	1304150737	/nfs/dbraw/zinc/15/07/37/1304150737.db2.gz	MTWVHYKTCIZPRJ-NSHDSACASA-N	0	3	349.847	3.093	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)Cc2ccccc2CC#N)C1	ZINC000776842250	1304209372	/nfs/dbraw/zinc/20/93/72/1304209372.db2.gz	UEOQVNHTUQKNNM-LAUBAEHRSA-N	0	3	347.462	3.247	20	30		EGEDHN
N#CCc1ccccc1CC(=O)N1CCN(CC2CCCCC2)CC1	ZINC000776859772	1304212134	/nfs/dbraw/zinc/21/21/34/1304212134.db2.gz	IYOLMJFDVTUWNU-UHFFFAOYSA-N	0	3	339.483	3.020	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CN[C@@H]1CCC[C@@H](C(=O)N(C)C)C1	ZINC000778168269	1304408969	/nfs/dbraw/zinc/40/89/69/1304408969.db2.gz	AMMGJZUTQOFRAO-HUUCEWRRSA-N	0	3	348.874	3.089	20	30		EGEDHN
C#CCNC(=O)CCN[C@H](c1ccccc1)c1ccc(Cl)cc1	ZINC000779042881	1304521787	/nfs/dbraw/zinc/52/17/87/1304521787.db2.gz	CBYDFJYNWAIYMN-LJQANCHMSA-N	0	3	326.827	3.159	20	30		EGEDHN
CC1(C)CCN(CCNC(=O)c2c(Cl)cc(C#N)cc2Cl)C1	ZINC000890075685	1304672792	/nfs/dbraw/zinc/67/27/92/1304672792.db2.gz	JHPLPKASXHXWOM-UHFFFAOYSA-N	0	3	340.254	3.327	20	30		EGEDHN
N#CCC1CCN(C[C@@H](O)COc2cc(Cl)ccc2Cl)CC1	ZINC000782087105	1304913673	/nfs/dbraw/zinc/91/36/73/1304913673.db2.gz	BIBURDYVNFENBM-CQSZACIVSA-N	0	3	343.254	3.359	20	30		EGEDHN
N#CC(C(=O)CCCc1ccsc1)C(=O)NCc1ccccc1	ZINC000783349261	1305082533	/nfs/dbraw/zinc/08/25/33/1305082533.db2.gz	DVXFCDSCLXVZNC-INIZCTEOSA-N	0	3	326.421	3.096	20	30		EGEDHN
CCCCSCC(=O)C(C#N)C(=O)N[C@H](CC)c1ccccc1	ZINC000787044576	1305682850	/nfs/dbraw/zinc/68/28/50/1305682850.db2.gz	GHHPVKBRMQVMPF-JKSUJKDBSA-N	0	3	332.469	3.496	20	30		EGEDHN
C[C@@H]1CCSCCN1CC(=O)C(C#N)c1nc2ccccc2s1	ZINC000794570490	1309547884	/nfs/dbraw/zinc/54/78/84/1309547884.db2.gz	KBCVPNZPESVOEA-CHWSQXEVSA-N	0	3	345.493	3.300	20	30		EGEDHN
C=C(C)CN1CCC(NC(=S)NCCCCC(F)(F)F)CC1	ZINC000794977620	1309639191	/nfs/dbraw/zinc/63/91/91/1309639191.db2.gz	CQKVLNGCZZKSEV-UHFFFAOYSA-N	0	3	337.455	3.224	20	30		EGEDHN
N#CC(C(=O)CCc1cncnc1)c1nc2ccccc2n1C(F)F	ZINC000796757332	1310081171	/nfs/dbraw/zinc/08/11/71/1310081171.db2.gz	WHOUJSGMIBKCMI-LBPRGKRZSA-N	0	3	341.321	3.030	20	30		EGEDHN
N#CCC1(CNCc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)CC1	ZINC000797468800	1310194607	/nfs/dbraw/zinc/19/46/07/1310194607.db2.gz	OUQZOLWMEUXQJV-UHFFFAOYSA-N	0	3	328.416	3.369	20	30		EGEDHN
Cc1ccc(C(=O)NCCCN2CCc3ccccc3C2)cc1C#N	ZINC000799307521	1310521891	/nfs/dbraw/zinc/52/18/91/1310521891.db2.gz	OVNDBVVEOMWVBS-UHFFFAOYSA-N	0	3	333.435	3.045	20	30		EGEDHN
C#Cc1cccc(CNC(=O)[C@@H](NC(C)C)c2ccc(OC)cc2)c1	ZINC000897932682	1310521926	/nfs/dbraw/zinc/52/19/26/1310521926.db2.gz	LYUHVRCWDFEXMZ-FQEVSTJZSA-N	0	3	336.435	3.032	20	30		EGEDHN
CC[C@@H](C)N[C@H](CNC(=O)c1cc(C#N)ccc1C)c1ccco1	ZINC000899078622	1310927186	/nfs/dbraw/zinc/92/71/86/1310927186.db2.gz	IQDPKIZTVFIFBF-RHSMWYFYSA-N	0	3	325.412	3.319	20	30		EGEDHN
CN(Cc1ccccc1)c1ccc(NC(=O)[C@H](N)CCCC#N)cc1	ZINC000827454367	1320454368	/nfs/dbraw/zinc/45/43/68/1320454368.db2.gz	JZBXZWGIKOOEKJ-LJQANCHMSA-N	0	3	336.439	3.283	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N1CCC[C@@H]1c1ccccc1Cl	ZINC000836487267	1320494075	/nfs/dbraw/zinc/49/40/75/1320494075.db2.gz	CGYILMLWPBMRMC-QGZVFWFLSA-N	0	3	333.863	3.142	20	30		EGEDHN
CC1(C)CCC[C@@H]1C(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001019255408	1317127912	/nfs/dbraw/zinc/12/79/12/1317127912.db2.gz	GWDIFRCNPFGRKA-DLBZAZTESA-N	0	3	343.446	3.214	20	30		EGEDHN
CC1(C)CC[C@@H](C(=O)N2CC[C@H](NCc3ccc(C#N)c(F)c3)C2)C1	ZINC001019347629	1317183803	/nfs/dbraw/zinc/18/38/03/1317183803.db2.gz	LUSLSTVUADBPAC-WBVHZDCISA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(C)CCN1CC(N(CC)C(=O)c2ccc(CN(CC)CC)o2)C1	ZINC000957445042	1317368333	/nfs/dbraw/zinc/36/83/33/1317368333.db2.gz	FXQUPFSTSPXISW-UHFFFAOYSA-N	0	3	347.503	3.234	20	30		EGEDHN
CCc1ccsc1C(=O)N1CC[C@H](NCc2ccc(C#N)s2)C1	ZINC001019809487	1317436999	/nfs/dbraw/zinc/43/69/99/1317436999.db2.gz	FCFUKQIWRSHKSB-ZDUSSCGKSA-N	0	3	345.493	3.248	20	30		EGEDHN
CCCN(CCN1CCCCC1)C(=O)NCc1cc(C#N)ccc1F	ZINC000806876706	1317533093	/nfs/dbraw/zinc/53/30/93/1317533093.db2.gz	ZXRCZSHMWUROAL-UHFFFAOYSA-N	0	3	346.450	3.105	20	30		EGEDHN
C#CCN(Cc1ccccc1)C(=O)N[C@H](C)CN(C)Cc1ccccc1	ZINC000807075470	1317548411	/nfs/dbraw/zinc/54/84/11/1317548411.db2.gz	ZTPAZSMXSCJNFZ-LJQANCHMSA-N	0	3	349.478	3.352	20	30		EGEDHN
C#Cc1cncc(C(=O)N(CC)[C@@H]2CCN([C@@H](C)c3ccccc3)C2)c1	ZINC000807071655	1317548814	/nfs/dbraw/zinc/54/88/14/1317548814.db2.gz	QRXXQBXAGBPAIQ-LAUBAEHRSA-N	0	3	347.462	3.361	20	30		EGEDHN
C#CCOc1ccc(C(=O)NC[C@@H](N[C@H](C)CC)c2ccco2)cc1	ZINC000807680094	1317577070	/nfs/dbraw/zinc/57/70/70/1317577070.db2.gz	LRRZDYYIXNJDNL-CRAIPNDOSA-N	0	3	340.423	3.151	20	30		EGEDHN
C#C[C@@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)C(C)(C)C	ZINC000808316677	1317660869	/nfs/dbraw/zinc/66/08/69/1317660869.db2.gz	VZZMTMWMOMTNBE-QZTJIDSGSA-N	0	3	327.472	3.171	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H](C)c2c(F)cccc2F)C1	ZINC001020396318	1317678591	/nfs/dbraw/zinc/67/85/91/1317678591.db2.gz	OKRMSEZUODIJPI-SRVKXCTJSA-N	0	3	328.790	3.058	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H]2CCc3ccc(Cl)cc32)CC1	ZINC000858236241	1328718392	/nfs/dbraw/zinc/71/83/92/1328718392.db2.gz	FSZMDAPHXZBKMF-QGZVFWFLSA-N	0	3	333.863	3.277	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccccc2-n2cccc2)C1	ZINC001020540922	1317754416	/nfs/dbraw/zinc/75/44/16/1317754416.db2.gz	SXGXCJZRIOWWJM-SHTZXODSSA-N	0	3	329.831	3.080	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@H](NCc3ccncc3Cl)C2)CC1	ZINC001020544491	1317758188	/nfs/dbraw/zinc/75/81/88/1317758188.db2.gz	RUNSSQYHRKDOAJ-WKILWMFISA-N	0	3	333.863	3.218	20	30		EGEDHN
CC[C@H](C)Oc1cc(/C=C2\C(=O)c3ncnn3C2C)ccc1OC	ZINC000905082768	1317921725	/nfs/dbraw/zinc/92/17/25/1317921725.db2.gz	WXPZVIHBTNHJJP-UARQWIGASA-N	0	3	327.384	3.305	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@]2(c3ccccc3)CC2(C)C)C1	ZINC001020801645	1317935098	/nfs/dbraw/zinc/93/50/98/1317935098.db2.gz	IYKGJTGHGJUHBH-BXWFABGCSA-N	0	3	332.875	3.344	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cc(-c3ccccc3)ccn2)C1	ZINC001020815530	1317945424	/nfs/dbraw/zinc/94/54/24/1317945424.db2.gz	BXKVPASDAMEXMO-QAQDUYKDSA-N	0	3	341.842	3.352	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1CCCN(Cc2ccccc2C)CC1	ZINC000810110160	1317953145	/nfs/dbraw/zinc/95/31/45/1317953145.db2.gz	QEXXBGHCBABXLU-UHFFFAOYSA-N	0	3	346.474	3.253	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)[C@H]2CC[C@H](CC)CC2)C1	ZINC001020953295	1318011748	/nfs/dbraw/zinc/01/17/48/1318011748.db2.gz	BHCBZBYEGXMSLG-KTSLABGISA-N	0	3	343.309	3.348	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)C2(c3ccccc3C)CCC2)C1	ZINC001020988090	1318032081	/nfs/dbraw/zinc/03/20/81/1318032081.db2.gz	ZNRPXVIUTBIPNK-WKILWMFISA-N	0	3	332.875	3.406	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)c1ccsc1C#N)c1ccsc1	ZINC000906127661	1318044695	/nfs/dbraw/zinc/04/46/95/1318044695.db2.gz	DWKSJGNREFRRIR-CQSZACIVSA-N	0	3	333.482	3.494	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2csc3c2CC[C@@H](C)C3)C1	ZINC001021012342	1318044697	/nfs/dbraw/zinc/04/46/97/1318044697.db2.gz	KGJAWANZBJQJBT-RAIGVLPGSA-N	0	3	338.904	3.476	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)CC(F)(F)F)s1	ZINC000959904927	1318260046	/nfs/dbraw/zinc/26/00/46/1318260046.db2.gz	NTGNIRIYCHHMPV-NSHDSACASA-N	0	3	345.390	3.043	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)[C@H]2[C@@H]3CCC[C@@H]32)s1	ZINC000959945613	1318279315	/nfs/dbraw/zinc/27/93/15/1318279315.db2.gz	YRHOWOMINHYZQK-VIBAHUMZSA-N	0	3	343.496	3.137	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)cc1F	ZINC000959958443	1318290197	/nfs/dbraw/zinc/29/01/97/1318290197.db2.gz	QKWLZGPIHXDGCE-INIZCTEOSA-N	0	3	347.409	3.431	20	30		EGEDHN
C[C@H]1[C@@H](NC(=O)c2ccsc2C#N)CCN1Cc1ccccc1	ZINC000908230724	1318315945	/nfs/dbraw/zinc/31/59/45/1318315945.db2.gz	SXXMNKCXNHUOQF-BBRMVZONSA-N	0	3	325.437	3.013	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@@H](CCCN3C(=O)C3CC=CC3)C2)c1	ZINC001021548811	1318388083	/nfs/dbraw/zinc/38/80/83/1318388083.db2.gz	SBPCFMYGRRVBCG-SFTDATJTSA-N	0	3	349.478	3.337	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cccc(OCCC)c2)C1	ZINC001021590764	1318436437	/nfs/dbraw/zinc/43/64/37/1318436437.db2.gz	DVQYKUDXSLCASY-UYAOXDASSA-N	0	3	340.467	3.035	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc(CC)ccn1	ZINC000960270174	1318436427	/nfs/dbraw/zinc/43/64/27/1318436427.db2.gz	DRBRVMKQOGEAPZ-UYAOXDASSA-N	0	3	335.451	3.206	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cccc(C)c2F)C1	ZINC001021590956	1318436530	/nfs/dbraw/zinc/43/65/30/1318436530.db2.gz	FYNDIVRDCGNIJW-FUHWJXTLSA-N	0	3	328.431	3.084	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc2cnccc2o1	ZINC000960280820	1318442113	/nfs/dbraw/zinc/44/21/13/1318442113.db2.gz	OHMQMZVSVDTDIE-YLJYHZDGSA-N	0	3	347.418	3.389	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc(OC)c(C)c1	ZINC000960316007	1318458121	/nfs/dbraw/zinc/45/81/21/1318458121.db2.gz	BDAGRZNQXPDTJX-UYAOXDASSA-N	0	3	336.435	3.175	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)CCc2ccc(F)cc2)C1	ZINC001021621500	1318470453	/nfs/dbraw/zinc/47/04/53/1318470453.db2.gz	BNLPONLBCGGSHF-AZUAARDMSA-N	0	3	342.458	3.095	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1c2ccc(C)cc2[C@H]2CN(C)CC[C@H]21	ZINC000812845767	1318470635	/nfs/dbraw/zinc/47/06/35/1318470635.db2.gz	MQUGMCIRSNBQRY-IFMALSPDSA-N	0	3	344.458	3.353	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(C)sc2C)C1	ZINC001021628019	1318480011	/nfs/dbraw/zinc/48/00/11/1318480011.db2.gz	RWCMPKVHFYQUHK-FUHWJXTLSA-N	0	3	330.497	3.315	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)CCc2ccc3[nH]ccc3c2)C1	ZINC001021636382	1318491291	/nfs/dbraw/zinc/49/12/91/1318491291.db2.gz	PYAIBZHOFPZIAN-TZIWHRDSSA-N	0	3	349.478	3.047	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cnc3ccccc3c2C)C1	ZINC001021637221	1318493045	/nfs/dbraw/zinc/49/30/45/1318493045.db2.gz	ZHBJDLUKKXYXTM-UWJYYQICSA-N	0	3	347.462	3.103	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)CCc2ccc(C)cc2C)C1	ZINC001021641922	1318499877	/nfs/dbraw/zinc/49/98/77/1318499877.db2.gz	MVWICPJKNQZWEE-LEWJYISDSA-N	0	3	338.495	3.182	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2coc(C(F)F)c2)C1	ZINC001021660078	1318524459	/nfs/dbraw/zinc/52/44/59/1318524459.db2.gz	YDFSSWXCZVJEJJ-UKRRQHHQSA-N	0	3	336.382	3.167	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(C)c(Cl)c2)C1	ZINC001021666519	1318529285	/nfs/dbraw/zinc/52/92/85/1318529285.db2.gz	UWRMYERZTHLIDF-WMZOPIPTSA-N	0	3	330.859	3.208	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)c1ccsc1	ZINC000960412935	1318536947	/nfs/dbraw/zinc/53/69/47/1318536947.db2.gz	ZBEQKMKYIRZXFT-SFHVURJKSA-N	0	3	339.464	3.356	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(F)cc(Cl)c2)C1	ZINC001021677144	1318546411	/nfs/dbraw/zinc/54/64/11/1318546411.db2.gz	ORPWBDSKCCNGIO-KBXCAEBGSA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(Cl)c(F)c2)C1	ZINC001021678359	1318547896	/nfs/dbraw/zinc/54/78/96/1318547896.db2.gz	XHWLQPACKHECHT-QAPCUYQASA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2csc(C(C)(C)C)n2)C1	ZINC001021689743	1318565005	/nfs/dbraw/zinc/56/50/05/1318565005.db2.gz	ZRWFLEFIZJTYHC-GOEBONIOSA-N	0	3	345.512	3.000	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)[C@H]2CC[C@H](C(C)C)CC2)C1	ZINC001021701938	1318573861	/nfs/dbraw/zinc/57/38/61/1318573861.db2.gz	DMAKPQAIAJYKOB-LWYYNNOASA-N	0	3	330.516	3.395	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cccc3ccncc32)C1	ZINC001021705452	1318576412	/nfs/dbraw/zinc/57/64/12/1318576412.db2.gz	DDSOVPQYTBIOSU-RXVVDRJESA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc3ccn(C)c3c2)C1	ZINC001021710913	1318585913	/nfs/dbraw/zinc/58/59/13/1318585913.db2.gz	RACULBLXHIMAIU-WOJBJXKFSA-N	0	3	349.478	3.128	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cccc(Cl)c2)C1	ZINC001021716099	1318596302	/nfs/dbraw/zinc/59/63/02/1318596302.db2.gz	BWZFPWSYMLTCBW-SJLPKXTDSA-N	0	3	330.859	3.290	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)Cc2cc(C)ccc2F)C1	ZINC001021720914	1318606311	/nfs/dbraw/zinc/60/63/11/1318606311.db2.gz	ZUVMEBKYERWKMI-PXNSSMCTSA-N	0	3	342.458	3.013	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2csc3c2CCCC3)C1	ZINC001021729508	1318629375	/nfs/dbraw/zinc/62/93/75/1318629375.db2.gz	FPERKNNZOIGNIX-MAUKXSAKSA-N	0	3	342.508	3.187	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc3ccccc3[nH]2)C1	ZINC001021729434	1318630406	/nfs/dbraw/zinc/63/04/06/1318630406.db2.gz	FCEDWYIQPWNGAR-FXAWDEMLSA-N	0	3	335.451	3.118	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc3c(c2)CCC3)C1	ZINC001021733891	1318638413	/nfs/dbraw/zinc/63/84/13/1318638413.db2.gz	SOXIRIZQJKZYTH-LEWJYISDSA-N	0	3	336.479	3.125	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc3c(c2)CCC3)C1	ZINC001021733894	1318638927	/nfs/dbraw/zinc/63/89/27/1318638927.db2.gz	SOXIRIZQJKZYTH-SFTDATJTSA-N	0	3	336.479	3.125	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cnc(C(C)C)s2)C1	ZINC001021746335	1318663005	/nfs/dbraw/zinc/66/30/05/1318663005.db2.gz	KRQAGCDQZQRWBA-JKSUJKDBSA-N	0	3	345.512	3.216	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@@H](NC(=O)CC3CCCC3)C2)c1	ZINC001021790914	1318684853	/nfs/dbraw/zinc/68/48/53/1318684853.db2.gz	STCORNCBEVLIHP-CALCHBBNSA-N	0	3	329.419	3.014	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)[C@H]1CC1(C)C	ZINC000960564896	1318697967	/nfs/dbraw/zinc/69/79/67/1318697967.db2.gz	QZPKGTGMZIPNSB-ZWKOTPCHSA-N	0	3	325.456	3.027	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC[C@@H]1CN(C)C[C@H]1CCCCO1	ZINC000960645555	1318764397	/nfs/dbraw/zinc/76/43/97/1318764397.db2.gz	ACWCXXWBOKHATA-HZPDHXFCSA-N	0	3	342.911	3.257	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2coc3c2cccc3OC)C1	ZINC001022087293	1318793563	/nfs/dbraw/zinc/79/35/63/1318793563.db2.gz	LGWRTMQQCIRDGW-TXEJJXNPSA-N	0	3	334.803	3.044	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N(C)Cc1ccc(Br)cc1	ZINC000912013314	1318793739	/nfs/dbraw/zinc/79/37/39/1318793739.db2.gz	RISNWDFEAJBOLK-CQSZACIVSA-N	0	3	325.250	3.091	20	30		EGEDHN
C[C@H]1CCC[C@@H]1CC(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001022121271	1318801286	/nfs/dbraw/zinc/80/12/86/1318801286.db2.gz	BLEWJTKJDVNSMS-UNQWWWNPSA-N	0	3	343.446	3.260	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)Cc1ccccc1	ZINC000960703043	1318805109	/nfs/dbraw/zinc/80/51/09/1318805109.db2.gz	MNBMKJRGTZCDTD-NRFANRHFSA-N	0	3	347.462	3.224	20	30		EGEDHN
C#CCNC(=O)CCN1CC=C(c2ccc(Cl)c(Cl)c2)CC1	ZINC000815086271	1318885980	/nfs/dbraw/zinc/88/59/80/1318885980.db2.gz	JHLQWSZVDWBEGJ-UHFFFAOYSA-N	0	3	337.250	3.222	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@H]2CN(C)C[C@H]2CC(C)(C)CO2)CC1	ZINC000960835267	1318964421	/nfs/dbraw/zinc/96/44/21/1318964421.db2.gz	XPGZZCNQNGGEJP-RBUKOAKNSA-N	0	3	348.531	3.471	20	30		EGEDHN
CC1(C)CCC[C@H]1C(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001022556729	1318987281	/nfs/dbraw/zinc/98/72/81/1318987281.db2.gz	BZPVBJTXAZUURD-BBWFWOEESA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)[C@@H](C)c2ccc(Cl)cc2)C1	ZINC001022642280	1319033696	/nfs/dbraw/zinc/03/36/96/1319033696.db2.gz	PALMLAUEUBSDBI-TUKIKUTGSA-N	0	3	327.255	3.433	20	30		EGEDHN
CC[C@@H]1CCC[C@H]1C(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001022661183	1319049532	/nfs/dbraw/zinc/04/95/32/1319049532.db2.gz	KTTKABXABKQFDC-NRSFXHEJSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccsc2C(F)(F)F)C1	ZINC001023022396	1319225927	/nfs/dbraw/zinc/22/59/27/1319225927.db2.gz	OCMBNJDKXRVNHP-DTORHVGOSA-N	0	3	338.782	3.370	20	30		EGEDHN
CC(C)Oc1cccc([C@H](O)CNCc2ccc(C#N)c(F)c2)c1	ZINC000817407218	1319350391	/nfs/dbraw/zinc/35/03/91/1319350391.db2.gz	FTOWRVUOUFTQSY-LJQANCHMSA-N	0	3	328.387	3.308	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@H](CNC(=O)c3ccsc3)C2)c1	ZINC001023219919	1319355997	/nfs/dbraw/zinc/35/59/97/1319355997.db2.gz	UMFSEURNYDLNEP-QGZVFWFLSA-N	0	3	339.464	3.262	20	30		EGEDHN
Cc1occc1C(=O)NC[C@H]1CCCN(Cc2ccc(C#N)cc2)C1	ZINC001023223621	1319361029	/nfs/dbraw/zinc/36/10/29/1319361029.db2.gz	RJCHPVXPISTDMN-GOSISDBHSA-N	0	3	337.423	3.102	20	30		EGEDHN
C=CCc1cc(CN[C@H](C)c2cnccc2N)cc(OC)c1OC	ZINC000817908913	1319457968	/nfs/dbraw/zinc/45/79/68/1319457968.db2.gz	JGFINJDCGBPSAW-CYBMUJFWSA-N	0	3	327.428	3.091	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc(CCCC)cc2)C1	ZINC001023476454	1319577625	/nfs/dbraw/zinc/57/76/25/1319577625.db2.gz	MEPAWRNBRONVMT-LJQANCHMSA-N	0	3	326.484	3.494	20	30		EGEDHN
CCOc1cc(Cl)ccc1CNC[C@H](O)c1ccc(C#N)cc1	ZINC000819186094	1319661933	/nfs/dbraw/zinc/66/19/33/1319661933.db2.gz	OWCDDSQRDRYZIK-KRWDZBQOSA-N	0	3	330.815	3.434	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)COc1ccccc1C(C)C	ZINC000916875200	1319718896	/nfs/dbraw/zinc/71/88/96/1319718896.db2.gz	VSWUDZITYDNZFY-MRXNPFEDSA-N	0	3	330.428	3.204	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)[C@H](C)Oc2ccccc2F)c1	ZINC000916897779	1319721895	/nfs/dbraw/zinc/72/18/95/1319721895.db2.gz	SUYLLOYMGLVMLQ-DZGCQCFKSA-N	0	3	340.354	3.249	20	30		EGEDHN
N#CC(C(=O)CSc1ccncc1)C(=O)Nc1ccccc1Cl	ZINC000916904544	1319722913	/nfs/dbraw/zinc/72/29/13/1319722913.db2.gz	AQMDXMXWBQVRJF-LBPRGKRZSA-N	0	3	345.811	3.175	20	30		EGEDHN
N#CC(C(=O)COCc1ccccc1)C(=O)Nc1ccccc1Cl	ZINC000916912125	1319725092	/nfs/dbraw/zinc/72/50/92/1319725092.db2.gz	ZBCUGPYSZVJLOH-AWEZNQCLSA-N	0	3	342.782	3.204	20	30		EGEDHN
C[C@]1(C(=O)NC2CC(CNCc3ccccc3C#N)C2)CC=CCC1	ZINC000961874490	1319756597	/nfs/dbraw/zinc/75/65/97/1319756597.db2.gz	CWQVONMKEFLSAX-IOYBJCICSA-N	0	3	337.467	3.289	20	30		EGEDHN
CCC(CC)Nc1ccncc1NC(=O)c1ccc(C=NOC)cc1	ZINC000820139751	1319841625	/nfs/dbraw/zinc/84/16/25/1319841625.db2.gz	OPKHJCORNUACCA-UHFFFAOYSA-N	0	3	340.427	3.337	20	30		EGEDHN
CO[C@H](C)C(=O)C(C#N)C(=O)Nc1ccccc1Oc1ccccc1	ZINC000918488205	1319957213	/nfs/dbraw/zinc/95/72/13/1319957213.db2.gz	XBEIVLDOIPRRIW-UKRRQHHQSA-N	0	3	338.363	3.161	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCN(C(=O)C[C@@H]2C=CCC2)C1	ZINC001023831491	1319975824	/nfs/dbraw/zinc/97/58/24/1319975824.db2.gz	MWXPJIIHANPXFH-MSOLQXFVSA-N	0	3	337.467	3.243	20	30		EGEDHN
CN(C)CCN(CC1CCCCC1)C(=O)c1cc(C#N)ccc1F	ZINC000823248410	1320165372	/nfs/dbraw/zinc/16/53/72/1320165372.db2.gz	MAPPTFSKNGLPBJ-UHFFFAOYSA-N	0	3	331.435	3.281	20	30		EGEDHN
CN(C)C[C@@H]1CCc2ccccc2N1C(=O)Cc1ccccc1CC#N	ZINC000823897151	1320215133	/nfs/dbraw/zinc/21/51/33/1320215133.db2.gz	DDDHWCUTWIUGMS-FQEVSTJZSA-N	0	3	347.462	3.205	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CCCN(CCCc2ccccc2)CC1	ZINC000837388482	1320608753	/nfs/dbraw/zinc/60/87/53/1320608753.db2.gz	OVWRUABPYFQXJR-UHFFFAOYSA-N	0	3	326.484	3.203	20	30		EGEDHN
COC(=O)[C@]1(C(F)(F)F)CCN(CCC2(C#N)CCCCC2)C1	ZINC000839601135	1320943388	/nfs/dbraw/zinc/94/33/88/1320943388.db2.gz	NESRNWSMGMJARK-HNNXBMFYSA-N	0	3	332.366	3.278	20	30		EGEDHN
CN(CC(=O)C(C#N)c1nc(C2CC2)cs1)C(=O)OC(C)(C)C	ZINC000842941794	1321451822	/nfs/dbraw/zinc/45/18/22/1321451822.db2.gz	KQYNAYHMEBVNFI-NSHDSACASA-N	0	3	335.429	3.064	20	30		EGEDHN
CC(C)(C)OC(=O)C[C@H]1CCCCN1C[C@H](O)c1ccc(C#N)cc1	ZINC000844427441	1321606029	/nfs/dbraw/zinc/60/60/29/1321606029.db2.gz	XWHWIJYQACQWBE-MSOLQXFVSA-N	0	3	344.455	3.178	20	30		EGEDHN
CC(C)(C)N1CC[C@H]1COC(=O)C(C)(C)c1cc(F)cc(C#N)c1	ZINC000845729478	1321737569	/nfs/dbraw/zinc/73/75/69/1321737569.db2.gz	OMKPGBVZCFMWES-INIZCTEOSA-N	0	3	332.419	3.391	20	30		EGEDHN
CN(CCC#N)c1ccc(CN[C@@H]2CCc3ccccc3NC2=O)cc1	ZINC000848560336	1321976310	/nfs/dbraw/zinc/97/63/10/1321976310.db2.gz	CPNHGPJJAMYSHG-HXUWFJFHSA-N	0	3	348.450	3.080	20	30		EGEDHN
C#CCOc1ccc([C@H](C)NCc2ccccc2CC(=O)OC)cc1	ZINC000848574433	1321979049	/nfs/dbraw/zinc/97/90/49/1321979049.db2.gz	RYKCJHOZMZVDNI-INIZCTEOSA-N	0	3	337.419	3.265	20	30		EGEDHN
N#CC[C@@H](O)CNC1(c2ccc(Br)cc2)CCCCC1	ZINC000930925367	1329009380	/nfs/dbraw/zinc/00/93/80/1329009380.db2.gz	YNDJWBIYQUGCGE-OAHLLOKOSA-N	0	3	337.261	3.473	20	30		EGEDHN
COc1ccc(CNCc2ccc(O[C@@H]3CCOC3)cc2)cc1C#N	ZINC000850221787	1322208787	/nfs/dbraw/zinc/20/87/87/1322208787.db2.gz	NPRPFZYCMSCLHG-LJQANCHMSA-N	0	3	338.407	3.024	20	30		EGEDHN
C[C@H](O)CC(C)(C)CNCc1cc(C#N)ccc1Br	ZINC000921777871	1322397734	/nfs/dbraw/zinc/39/77/34/1322397734.db2.gz	ZAZZZVUCDSPOSD-NSHDSACASA-N	0	3	325.250	3.207	20	30		EGEDHN
CCOC(=O)c1c[nH]nc1[C@H]1CCN([C@@H](C)c2ccc(C#N)cc2)C1	ZINC000931010897	1329027345	/nfs/dbraw/zinc/02/73/45/1329027345.db2.gz	REPCKCOTIRQSAR-BBRMVZONSA-N	0	3	338.411	3.009	20	30		EGEDHN
CC(C)(O)C(C)(C)CNCc1cc(C#N)ccc1Br	ZINC000922166478	1322469617	/nfs/dbraw/zinc/46/96/17/1322469617.db2.gz	FOILVPRYNIUXPA-UHFFFAOYSA-N	0	3	325.250	3.207	20	30		EGEDHN
C#CCN(C(=O)NC[C@H](c1ccc(SC)cc1)N(C)C)C(C)C	ZINC000922640768	1322577774	/nfs/dbraw/zinc/57/77/74/1322577774.db2.gz	ZCNSPFWEQJHHKD-QGZVFWFLSA-N	0	3	333.501	3.064	20	30		EGEDHN
CC[C@@H](SC)C(=O)N1CCC[C@@H](CNCc2ccccc2C#N)C1	ZINC001023937732	1323042857	/nfs/dbraw/zinc/04/28/57/1323042857.db2.gz	OMGNJVMDASYJFV-MAUKXSAKSA-N	0	3	345.512	3.028	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCN(C(=O)C2(C3CC3)CC2)C1	ZINC001024031296	1323083604	/nfs/dbraw/zinc/08/36/04/1323083604.db2.gz	QBIPEXGLAMOHQS-INIZCTEOSA-N	0	3	337.467	3.077	20	30		EGEDHN
CC1(CC(=O)N2CCC[C@@H](CNCc3cc(F)ccc3C#N)C2)CC1	ZINC001024064838	1323107143	/nfs/dbraw/zinc/10/71/43/1323107143.db2.gz	CSWPGQJNYRVLQU-HNNXBMFYSA-N	0	3	343.446	3.216	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](CNCc2oc(CCC)nc2C)C1	ZINC001024095090	1323126314	/nfs/dbraw/zinc/12/63/14/1323126314.db2.gz	PZIYXDZSKJYYEE-INIZCTEOSA-N	0	3	347.503	3.476	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](CNCc2oc(CCC)nc2C)C1	ZINC001024095092	1323126465	/nfs/dbraw/zinc/12/64/65/1323126465.db2.gz	PZIYXDZSKJYYEE-MRXNPFEDSA-N	0	3	347.503	3.476	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](CNCc2ccccc2C#N)C1	ZINC001024095038	1323126574	/nfs/dbraw/zinc/12/65/74/1323126574.db2.gz	PCGUZOYGAMZREJ-MRXNPFEDSA-N	0	3	325.456	3.099	20	30		EGEDHN
C#CCN(Cc1ccccc1)C[C@H]1CCCN(C(=O)C(C)(C)C)C1	ZINC000852044968	1323136253	/nfs/dbraw/zinc/13/62/53/1323136253.db2.gz	JCQSJPNXXXFEFK-LJQANCHMSA-N	0	3	326.484	3.407	20	30		EGEDHN
C#C[C@@](C)(CC)NCC(=O)NCCc1cccc(Cl)c1Cl	ZINC000852102644	1323147977	/nfs/dbraw/zinc/14/79/77/1323147977.db2.gz	MQCQFBGUZJGRMY-INIZCTEOSA-N	0	3	327.255	3.044	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H](CNCc3nc(C)cs3)C2)C1	ZINC001024146285	1323171957	/nfs/dbraw/zinc/17/19/57/1323171957.db2.gz	ROPMGSRZHFVDHU-HNNXBMFYSA-N	0	3	333.501	3.136	20	30		EGEDHN
CCCCCCCCCNC(=O)NC1CCN([C@H]2CCOC2)CC1	ZINC000852637378	1323220541	/nfs/dbraw/zinc/22/05/41/1323220541.db2.gz	WGORACDAWJGHAL-SFHVURJKSA-N	0	3	339.524	3.290	20	30		EGEDHN
CCC(=O)N1CCC[C@@H]([C@H]2CCCN2Cc2ccc(F)c(C#N)c2)C1	ZINC000963213980	1323238897	/nfs/dbraw/zinc/23/88/97/1323238897.db2.gz	CQEHKRZTLGMGGR-VQIMIIECSA-N	0	3	343.446	3.310	20	30		EGEDHN
CCC(=O)N1CCC[C@@H]([C@H]2CCCN2Cc2cc(C#N)ccc2F)C1	ZINC000963213467	1323239859	/nfs/dbraw/zinc/23/98/59/1323239859.db2.gz	AALRSMZBDUJWSJ-VQIMIIECSA-N	0	3	343.446	3.310	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)Cc2cscn2)cc1	ZINC000853099633	1323281348	/nfs/dbraw/zinc/28/13/48/1323281348.db2.gz	UHQWVMQOPQXCOP-MRXNPFEDSA-N	0	3	341.436	3.376	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccc(C)c(NC(C)=O)c1	ZINC001024454444	1323413081	/nfs/dbraw/zinc/41/30/81/1323413081.db2.gz	FWTLJCDJCSGCCX-SFHVURJKSA-N	0	3	343.471	3.114	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@@H]1CCc2cc(OC)ccc21	ZINC001024472368	1323426843	/nfs/dbraw/zinc/42/68/43/1323426843.db2.gz	SBNGZBPOSFLJHV-FXAWDEMLSA-N	0	3	342.483	3.272	20	30		EGEDHN
C=CCN1CCCC[C@@H]1CNC(=O)c1cn(CC)c2ccccc12	ZINC001024542550	1323486273	/nfs/dbraw/zinc/48/62/73/1323486273.db2.gz	XWPJUONXGAQLDR-MRXNPFEDSA-N	0	3	325.456	3.432	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@@H]1COc2cc(C)c(C)cc21	ZINC001024576263	1323512806	/nfs/dbraw/zinc/51/28/06/1323512806.db2.gz	QHGOPPRCOOOFOI-IEBWSBKVSA-N	0	3	342.483	3.326	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccc(C(F)(F)F)cn1	ZINC001024586200	1323521423	/nfs/dbraw/zinc/52/14/23/1323521423.db2.gz	LENDMYUFRYPZDH-AWEZNQCLSA-N	0	3	341.377	3.261	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@H]1CCCc2cccnc21	ZINC001024615462	1323542230	/nfs/dbraw/zinc/54/22/30/1323542230.db2.gz	SUEYFDHQYDSSGO-ROUUACIJSA-N	0	3	327.472	3.048	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ncoc1-c1cccs1	ZINC001024716927	1323622903	/nfs/dbraw/zinc/62/29/03/1323622903.db2.gz	OMBHGOPATREMCA-AWEZNQCLSA-N	0	3	343.452	3.011	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)C[C@@H]2C=CCC2)s1	ZINC001024862674	1323754604	/nfs/dbraw/zinc/75/46/04/1323754604.db2.gz	VVVOQMHIWIXAAG-HZPDHXFCSA-N	0	3	343.496	3.447	20	30		EGEDHN
CC(C)Oc1ccccc1CNC[C@H]1CCCCN1C(=O)[C@@H](C)C#N	ZINC001024901950	1323772635	/nfs/dbraw/zinc/77/26/35/1323772635.db2.gz	DZXIPLZPSJCKHZ-FUHWJXTLSA-N	0	3	343.471	3.104	20	30		EGEDHN
C[C@@H](C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)cc1F)C1CC1	ZINC001024915513	1323779553	/nfs/dbraw/zinc/77/95/53/1323779553.db2.gz	ZMGPPUFTBHQUNV-RDTXWAMCSA-N	0	3	343.446	3.214	20	30		EGEDHN
CC1(CC(=O)N2CCCC[C@@H]2CNCc2ccc(C#N)s2)CC1	ZINC001025021488	1323830204	/nfs/dbraw/zinc/83/02/04/1323830204.db2.gz	PWPAXJKTLLFIPR-CQSZACIVSA-N	0	3	331.485	3.281	20	30		EGEDHN
CCC(=O)N1CCCC[C@H]1[C@@H]1CCCN1Cc1ccc(C#N)s1	ZINC001025186462	1323960086	/nfs/dbraw/zinc/96/00/86/1323960086.db2.gz	XDHXPZBFWQDHFD-IRXDYDNUSA-N	0	3	331.485	3.375	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(C(C)C)n(C)n1	ZINC001025229421	1324015107	/nfs/dbraw/zinc/01/51/07/1324015107.db2.gz	JNTSBUOBSGCRNY-ROUUACIJSA-N	0	3	344.503	3.189	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc[nH]c1CC	ZINC001025230181	1324017411	/nfs/dbraw/zinc/01/74/11/1324017411.db2.gz	VIWPCLHZKRSONK-OALUTQOASA-N	0	3	327.472	3.060	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1scnc1CC	ZINC001025238483	1324029642	/nfs/dbraw/zinc/02/96/42/1324029642.db2.gz	RVSVDUQPRGNFON-CVEARBPZSA-N	0	3	333.501	3.351	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc(C(F)F)nc1	ZINC001025238661	1324029990	/nfs/dbraw/zinc/02/99/90/1324029990.db2.gz	ULFHKSXSODCXFO-IAGOWNOFSA-N	0	3	347.409	3.112	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)CCc1ccc(F)cc1	ZINC001025248360	1324048720	/nfs/dbraw/zinc/04/87/20/1324048720.db2.gz	YWKZDXCIHYGYFA-UXHICEINSA-N	0	3	342.458	3.237	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1c(C)oc(C)c1C	ZINC001025250410	1324051759	/nfs/dbraw/zinc/05/17/59/1324051759.db2.gz	JXZLILJTBYRWDE-ROUUACIJSA-N	0	3	328.456	3.297	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)Cc1cccc(Cl)c1	ZINC001025263239	1324073161	/nfs/dbraw/zinc/07/31/61/1324073161.db2.gz	JROYBMYCNOISMW-MOPGFXCFSA-N	0	3	344.886	3.361	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccncc1Cl	ZINC001025270972	1324086132	/nfs/dbraw/zinc/08/61/32/1324086132.db2.gz	FOMNDGPJUANPCK-SJORKVTESA-N	0	3	333.863	3.380	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1csc2cncn21	ZINC001025273271	1324088534	/nfs/dbraw/zinc/08/85/34/1324088534.db2.gz	CFKUFZIRCJRRBE-LSDHHAIUSA-N	0	3	344.484	3.041	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)C1(C(C)(F)F)CC1	ZINC001025273544	1324089485	/nfs/dbraw/zinc/08/94/85/1324089485.db2.gz	QBICDDQHBAZIKN-HOTGVXAUSA-N	0	3	338.442	3.291	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(C)[nH]c1C	ZINC001025273822	1324090504	/nfs/dbraw/zinc/09/05/04/1324090504.db2.gz	HHUCRAXGKKXVLM-MOPGFXCFSA-N	0	3	327.472	3.114	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(C)[nH]c1C	ZINC001025273825	1324090600	/nfs/dbraw/zinc/09/06/00/1324090600.db2.gz	HHUCRAXGKKXVLM-RTBURBONSA-N	0	3	327.472	3.114	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc(C)cc1F	ZINC001025274301	1324091373	/nfs/dbraw/zinc/09/13/73/1324091373.db2.gz	WLJRETMWNNMXCI-MOPGFXCFSA-N	0	3	328.431	3.226	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cccc(OCC)c1	ZINC001025274396	1324092299	/nfs/dbraw/zinc/09/22/99/1324092299.db2.gz	XQFJNJHICMTKNL-WOJBJXKFSA-N	0	3	340.467	3.178	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccn(C(C)C)n1	ZINC001025275683	1324096526	/nfs/dbraw/zinc/09/65/26/1324096526.db2.gz	YJBDJOHYXAHXSP-MSOLQXFVSA-N	0	3	330.476	3.109	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cccc(OC)c1F	ZINC001025283329	1324104421	/nfs/dbraw/zinc/10/44/21/1324104421.db2.gz	FPFLIDLENFDUPJ-IRXDYDNUSA-N	0	3	346.446	3.479	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc2ccccc2n1	ZINC001025292656	1324118317	/nfs/dbraw/zinc/11/83/17/1324118317.db2.gz	LCXWYURYMYLLDD-RTWAWAEBSA-N	0	3	347.462	3.327	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1c(C)noc1CC	ZINC001025297576	1324130915	/nfs/dbraw/zinc/13/09/15/1324130915.db2.gz	YSEDWQKFGLZDON-JKSUJKDBSA-N	0	3	331.460	3.191	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cccc2c1CCC2	ZINC001025301634	1324134942	/nfs/dbraw/zinc/13/49/42/1324134942.db2.gz	NJKKLEGLAUQLAK-RTWAWAEBSA-N	0	3	336.479	3.268	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1c(C)nsc1C	ZINC001025302131	1324136355	/nfs/dbraw/zinc/13/63/55/1324136355.db2.gz	RYFWNGHCRDGJCW-HZPDHXFCSA-N	0	3	333.501	3.405	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)C12CCC(CC1)CC2	ZINC001025302915	1324136427	/nfs/dbraw/zinc/13/64/27/1324136427.db2.gz	YWXXBXCNOXAGBC-LSNYBQGISA-N	0	3	328.500	3.436	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)CCc1ccc(C)s1	ZINC001025306908	1324139677	/nfs/dbraw/zinc/13/96/77/1324139677.db2.gz	KKMUHTQUKRUVOD-MOPGFXCFSA-N	0	3	344.524	3.468	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc(CF)cc1	ZINC001025305730	1324140570	/nfs/dbraw/zinc/14/05/70/1324140570.db2.gz	ZNRHAKTYCGMNEJ-RBUKOAKNSA-N	0	3	328.431	3.248	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2coc3ccc(CC)cc23)C1	ZINC001025418959	1324249932	/nfs/dbraw/zinc/24/99/32/1324249932.db2.gz	GWISYLHUTADWAE-DOTOQJQBSA-N	0	3	338.451	3.459	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(C(C)(C)C)cn2)C1	ZINC001025420312	1324254648	/nfs/dbraw/zinc/25/46/48/1324254648.db2.gz	AHGCFAUWZWKFBO-SJORKVTESA-N	0	3	341.499	3.233	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2conc2C2CCCC2)C1	ZINC001025437767	1324276670	/nfs/dbraw/zinc/27/66/70/1324276670.db2.gz	AKXORYNDEDIQPE-DOTOQJQBSA-N	0	3	343.471	3.186	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2coc3cc(F)ccc23)C1	ZINC001025461875	1324307203	/nfs/dbraw/zinc/30/72/03/1324307203.db2.gz	XNEPPOPJVVRXPS-ZIAGYGMSSA-N	0	3	328.387	3.035	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc3cscc3s2)C1	ZINC001025484271	1324331045	/nfs/dbraw/zinc/33/10/45/1324331045.db2.gz	BNCUWMVWTJZRSZ-CHWSQXEVSA-N	0	3	332.494	3.426	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2c(C)cc(F)cc2C)C1	ZINC001025505549	1324353091	/nfs/dbraw/zinc/35/30/91/1324353091.db2.gz	IAJFGGAHKNWQOI-SJORKVTESA-N	0	3	330.447	3.296	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(Cl)cc2OC)C1	ZINC001025520105	1324364373	/nfs/dbraw/zinc/36/43/73/1324364373.db2.gz	RNAFJGZWDHUDOA-CABCVRRESA-N	0	3	348.874	3.202	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccn(C(CC)CC)n2)C1	ZINC001025545710	1324393880	/nfs/dbraw/zinc/39/38/80/1324393880.db2.gz	LBBOVIVEHSDSNC-IAGOWNOFSA-N	0	3	344.503	3.098	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2coc(C3CCCC3)n2)C1	ZINC001025582436	1324423559	/nfs/dbraw/zinc/42/35/59/1324423559.db2.gz	UCICHHRCYCVTEW-DOTOQJQBSA-N	0	3	343.471	3.186	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cnn(C(CC)CC)c2C)C1	ZINC001025590625	1324436098	/nfs/dbraw/zinc/43/60/98/1324436098.db2.gz	PDPACGSMALCAEL-RDJZCZTQSA-N	0	3	344.503	3.016	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(C)c(F)cc2Cl)C1	ZINC001025603253	1324452669	/nfs/dbraw/zinc/45/26/69/1324452669.db2.gz	SQMTWXNPBSDDAV-UONOGXRCSA-N	0	3	336.838	3.251	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2csc3c2CCCC3)C1	ZINC001025612375	1324464817	/nfs/dbraw/zinc/46/48/17/1324464817.db2.gz	STPOCIPCHXMOLJ-HUUCEWRRSA-N	0	3	330.497	3.090	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc3cccc(F)c3o2)C1	ZINC001025627975	1324479312	/nfs/dbraw/zinc/47/93/12/1324479312.db2.gz	MDJXATVKCRVIIO-GOEBONIOSA-N	0	3	342.414	3.426	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cnc(C(C)(C)C)s2)C1	ZINC001025630243	1324481890	/nfs/dbraw/zinc/48/18/90/1324481890.db2.gz	RRKXJXIUFAFDAT-CABCVRRESA-N	0	3	347.528	3.294	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)C23CC(C(C)(C)C)(C2)C3)C1	ZINC001025632686	1324484476	/nfs/dbraw/zinc/48/44/76/1324484476.db2.gz	NEJPLVPYEAPITA-UUBYJMPYSA-N	0	3	330.516	3.443	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cnc(C(C)C)s2)C1	ZINC001025637354	1324489751	/nfs/dbraw/zinc/48/97/51/1324489751.db2.gz	SGIGZHJDJQPCBH-LSDHHAIUSA-N	0	3	333.501	3.120	20	30		EGEDHN
C=C1CN(C(=O)Nc2cc(Cl)ccc2OC2CCN(C)CC2)C1	ZINC000931698995	1329166633	/nfs/dbraw/zinc/16/66/33/1329166633.db2.gz	WRAVBCDNLHMDGI-UHFFFAOYSA-N	0	3	335.835	3.217	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CC[C@@H]2CN(C(=O)CCC3CC3)C[C@H]12	ZINC001026222153	1324670940	/nfs/dbraw/zinc/67/09/40/1324670940.db2.gz	ZGVGCGKRCNRTIZ-HSALFYBXSA-N	0	3	337.467	3.075	20	30		EGEDHN
CC1(CC(=O)N2C[C@@H]3CC[C@H](NCc4ccccc4C#N)[C@@H]3C2)CC1	ZINC001026317970	1324721984	/nfs/dbraw/zinc/72/19/84/1324721984.db2.gz	QWMCHKQRRVOLFM-OTWHNJEPSA-N	0	3	337.467	3.075	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H]2CC[C@H](NCc3cscn3)[C@@H]2C1	ZINC001026331889	1324731839	/nfs/dbraw/zinc/73/18/39/1324731839.db2.gz	ZKVPLZNXAJHPOA-IMJJTQAJSA-N	0	3	333.501	3.072	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)C2(C3CC3)CC2)CC1	ZINC001026511262	1324857190	/nfs/dbraw/zinc/85/71/90/1324857190.db2.gz	CWRRDPNSVXNBLR-UHFFFAOYSA-N	0	3	341.293	3.102	20	30		EGEDHN
C=C1CCC(C(=O)NC2CCC(N[C@H](C)c3cnccn3)CC2)CC1	ZINC001026553974	1324889960	/nfs/dbraw/zinc/88/99/60/1324889960.db2.gz	AFXJUJPRRYEFKU-FAEJEUNOSA-N	0	3	342.487	3.301	20	30		EGEDHN
C=C(Br)CNC1CCC(NC(=O)[C@@H]2C[C@H]2CCC)CC1	ZINC001026556429	1324893598	/nfs/dbraw/zinc/89/35/98/1324893598.db2.gz	PEURVJDRMXIEEJ-XSCHDIRWSA-N	0	3	343.309	3.348	20	30		EGEDHN
Cc1cscc1C(=O)N1CC[C@@H](CNCc2ccccc2C#N)C1	ZINC001026759477	1325006818	/nfs/dbraw/zinc/00/68/18/1325006818.db2.gz	IRTRPNORCWFMHK-HNNXBMFYSA-N	0	3	339.464	3.180	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@@H](CNCc2ccccc2C#N)C1)C(C)(C)C	ZINC001026919929	1325082965	/nfs/dbraw/zinc/08/29/65/1325082965.db2.gz	QQCXUHWQTOTVEP-CVEARBPZSA-N	0	3	327.472	3.179	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)c2ccns2)C1	ZINC000963311206	1325096270	/nfs/dbraw/zinc/09/62/70/1325096270.db2.gz	QLQLOCCTDHUQRZ-KBPBESRZSA-N	0	3	339.892	3.212	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](CNCc2oc(CC)nc2C)C1	ZINC001026989129	1325127842	/nfs/dbraw/zinc/12/78/42/1325127842.db2.gz	XULBXOPGTZAMED-HNNXBMFYSA-N	0	3	333.476	3.086	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)c2cc(F)c[nH]2)C1	ZINC000963338547	1325128272	/nfs/dbraw/zinc/12/82/72/1325128272.db2.gz	WBPCERJUTRRHKR-CZUORRHYSA-N	0	3	339.842	3.223	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](CNCc3nc(C)sc3C)C2)CC1	ZINC001027040504	1325175362	/nfs/dbraw/zinc/17/53/62/1325175362.db2.gz	DJZBIOQAUKHEIY-MRXNPFEDSA-N	0	3	347.528	3.444	20	30		EGEDHN
CC(C)C1(C(=O)N2CC[C@@H](CNCc3cc(F)ccc3C#N)C2)CC1	ZINC001027051010	1325189033	/nfs/dbraw/zinc/18/90/33/1325189033.db2.gz	PAPVZLWEATUSJE-HNNXBMFYSA-N	0	3	343.446	3.072	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC1CC2(C1)CC(NC(=O)CC1CC1)C2	ZINC000963484321	1325276852	/nfs/dbraw/zinc/27/68/52/1325276852.db2.gz	JPWXQCJZGHYCJV-UHFFFAOYSA-N	0	3	341.430	3.014	20	30		EGEDHN
C#C[C@](C)(CC)NC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F	ZINC000854704442	1325297549	/nfs/dbraw/zinc/29/75/49/1325297549.db2.gz	SDPRWPAZPAPEAR-SJLPKXTDSA-N	0	3	334.410	3.062	20	30		EGEDHN
C=C[C@H](C(=O)N1CC[C@H](CNCc2nccs2)C1)c1ccccc1	ZINC001027231332	1325326879	/nfs/dbraw/zinc/32/68/79/1325326879.db2.gz	QRSJDZQMNDNRDP-WBVHZDCISA-N	0	3	341.480	3.051	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)[C@H]1CCC[C@@H](F)C1)C2	ZINC000963790263	1325401523	/nfs/dbraw/zinc/40/15/23/1325401523.db2.gz	ICUSKYJWIWILPW-HWOPYCMZSA-N	0	3	328.859	3.284	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)c2cccs2)C1	ZINC001027280745	1325404921	/nfs/dbraw/zinc/40/49/21/1325404921.db2.gz	BPFDCGGCKACDAQ-QGZVFWFLSA-N	0	3	339.464	3.356	20	30		EGEDHN
Cc1ccc(C(=O)N2CCC[C@H](N(C)Cc3ccc(C#N)cc3)C2)o1	ZINC001027286180	1325415305	/nfs/dbraw/zinc/41/53/05/1325415305.db2.gz	ONQKLLCUWJVNPX-SFHVURJKSA-N	0	3	337.423	3.196	20	30		EGEDHN
C/C(=C\C(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)cc2)C1)C1CC1	ZINC001027313212	1325463241	/nfs/dbraw/zinc/46/32/41/1325463241.db2.gz	AUNLRKUXMANLRD-GRFAERAESA-N	0	3	337.467	3.337	20	30		EGEDHN
Cc1nc(C(C)C)ccc1CN(C)[C@H]1CCCN(C(=O)[C@H](C)C#N)C1	ZINC001027336218	1325494996	/nfs/dbraw/zinc/49/49/96/1325494996.db2.gz	NZHFOBTXDAHRGJ-QAPCUYQASA-N	0	3	342.487	3.096	20	30		EGEDHN
CN(Cc1ccc(C#N)c(F)c1)[C@@H]1CCCN(C(=O)/C=C/C2CC2)C1	ZINC001027340129	1325499906	/nfs/dbraw/zinc/49/99/06/1325499906.db2.gz	APOXSIDMEQZAQF-PDFOZTTASA-N	0	3	341.430	3.086	20	30		EGEDHN
N#Cc1ccccc1CNC1CC2(C1)CC(NC(=O)[C@H]1C[C@H]3C[C@H]3C1)C2	ZINC000964634340	1327611458	/nfs/dbraw/zinc/61/14/58/1327611458.db2.gz	QDBHIJRTSUVXLF-TUJQPDQISA-N	0	3	349.478	3.121	20	30		EGEDHN
CN(Cc1ccc(Cl)c(F)c1)[C@@H]1CCCN(C(=O)C#CC2CC2)C1	ZINC001027405244	1327629907	/nfs/dbraw/zinc/62/99/07/1327629907.db2.gz	FXZFOXHGDKELHC-MRXNPFEDSA-N	0	3	348.849	3.315	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)[C@]23C[C@H]2CCC3)C1	ZINC001027497163	1327760754	/nfs/dbraw/zinc/76/07/54/1327760754.db2.gz	GDYKMONPQLKILI-SFHLNBCPSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](N(C)Cc2ccc(C)nc2C)C1	ZINC001027521883	1327794634	/nfs/dbraw/zinc/79/46/34/1327794634.db2.gz	NJQHOFJCWDTWAD-GOSISDBHSA-N	0	3	329.488	3.333	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)[C@]2(C)C=CCC2)C1	ZINC001027532345	1327815950	/nfs/dbraw/zinc/81/59/50/1327815950.db2.gz	YRSKQOIFVQLZEH-PZJWPPBQSA-N	0	3	337.467	3.337	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)[C@H]2CCC2(C)C)C1	ZINC001027534657	1327826612	/nfs/dbraw/zinc/82/66/12/1327826612.db2.gz	BFKDULXKPGTXGC-RTBURBONSA-N	0	3	339.483	3.417	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)CC(C)(F)F)C1	ZINC001027562904	1327882895	/nfs/dbraw/zinc/88/28/95/1327882895.db2.gz	YOFZNUFGNDDBBG-INIZCTEOSA-N	0	3	335.398	3.026	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)CC(C)(F)F)C1	ZINC001027562855	1327883200	/nfs/dbraw/zinc/88/32/00/1327883200.db2.gz	XIYUUDRAMVTILP-INIZCTEOSA-N	0	3	335.398	3.026	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)c(F)c2)C1	ZINC001027585948	1327923651	/nfs/dbraw/zinc/92/36/51/1327923651.db2.gz	SWNFFACXMQXEJZ-BPQIPLTHSA-N	0	3	343.446	3.166	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)[C@@H](C)Cc2ccccc2Cl)C1	ZINC001027598787	1327949441	/nfs/dbraw/zinc/94/94/41/1327949441.db2.gz	USGJSWFZVVOJGZ-RDJZCZTQSA-N	0	3	332.875	3.075	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1oc(C3CC3)nc1C)C2	ZINC000965381974	1327988364	/nfs/dbraw/zinc/98/83/64/1327988364.db2.gz	YFXNJYYANYOCPY-UHFFFAOYSA-N	0	3	349.862	3.244	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)Cc1ccc(OC)cc1)C2	ZINC000965882016	1328074431	/nfs/dbraw/zinc/07/44/31/1328074431.db2.gz	FITPLRRHKHJMMK-UHFFFAOYSA-N	0	3	348.874	3.007	20	30		EGEDHN
C[C@@H](CC(=O)N1CCC[C@H](N(C)Cc2ccc(C#N)cc2)C1)C1CC1	ZINC001027696866	1328105860	/nfs/dbraw/zinc/10/58/60/1328105860.db2.gz	RGYWFVIMSZGPFJ-JXFKEZNVSA-N	0	3	339.483	3.417	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)[C@@H](c2ccc(F)cc2)C(C)C)C1	ZINC001027697022	1328106121	/nfs/dbraw/zinc/10/61/21/1328106121.db2.gz	QZTAFMYURDLLSA-RBUKOAKNSA-N	0	3	330.447	3.121	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2coc3ccc(CC)cc23)C1	ZINC000966129803	1328199640	/nfs/dbraw/zinc/19/96/40/1328199640.db2.gz	FVMQFLRKOVUFAP-HNAYVOBHSA-N	0	3	338.451	3.459	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)[C@@H]1CC[C@H](c2ccccc2)O1	ZINC001027887061	1328354931	/nfs/dbraw/zinc/35/49/31/1328354931.db2.gz	HDPGKICHGZDTAO-OTWHNJEPSA-N	0	3	328.456	3.063	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)c1c(C)nn(C(C)(C)C)c1C	ZINC001027916404	1328392152	/nfs/dbraw/zinc/39/21/52/1328392152.db2.gz	LCBZPUDUCGQBBR-MRXNPFEDSA-N	0	3	332.492	3.025	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2cnc(-c3ccccc3)o2)C1	ZINC000966884708	1328452069	/nfs/dbraw/zinc/45/20/69/1328452069.db2.gz	PYHDNUXVBRZVAG-WBVHZDCISA-N	0	3	339.439	3.358	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2ccccc2C(C)(C)C)C1	ZINC000966892684	1328458784	/nfs/dbraw/zinc/45/87/84/1328458784.db2.gz	PSFBLOLUOPRDRT-QFBILLFUSA-N	0	3	326.484	3.448	20	30		EGEDHN
C[C@@H](Cc1cccnc1)NCc1ccc(C#N)cc1Br	ZINC000934233853	1329957347	/nfs/dbraw/zinc/95/73/47/1329957347.db2.gz	LDWSPASMPNXLNK-LBPRGKRZSA-N	0	3	330.229	3.437	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N(C[C@H](O)CC(C)(C)C)C1CCN(C)CC1	ZINC000935816746	1330087921	/nfs/dbraw/zinc/08/79/21/1330087921.db2.gz	GILQBUVYZGZSGX-SJLPKXTDSA-N	0	3	338.536	3.309	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccccc2CC(C)(C)C)[C@H](C)C1	ZINC000942163538	1331856236	/nfs/dbraw/zinc/85/62/36/1331856236.db2.gz	MRHOJYFZQPRJFY-VQIMIIECSA-N	0	3	326.484	3.349	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2sc(C)nc2CC(C)C)[C@H](C)C1	ZINC000942312887	1331900544	/nfs/dbraw/zinc/90/05/44/1331900544.db2.gz	CRKXCIRUZSHBMT-GDBMZVCRSA-N	0	3	347.528	3.114	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2coc3ccc(OC)cc32)[C@@H](C)C1	ZINC000942431103	1331933139	/nfs/dbraw/zinc/93/31/39/1331933139.db2.gz	KYRXMCMIXKICRS-GUYCJALGSA-N	0	3	328.412	3.068	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3cnccc3C)C[C@@H]2C)cc1	ZINC000942553944	1331970422	/nfs/dbraw/zinc/97/04/22/1331970422.db2.gz	WFHAPUVYUZOGEB-UWJYYQICSA-N	0	3	347.462	3.012	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3ncccc3C)C[C@@H]2C)cc1	ZINC000942552731	1331970634	/nfs/dbraw/zinc/97/06/34/1331970634.db2.gz	IKBCSJANHCECDX-PXNSSMCTSA-N	0	3	347.462	3.012	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3ccsc3)C[C@H]2C)cc1	ZINC000942553062	1331970890	/nfs/dbraw/zinc/97/08/90/1331970890.db2.gz	MBMZUDBDCFKHKN-BEFAXECRSA-N	0	3	338.476	3.370	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3cc(Cl)ccc3[nH]2)[C@@H](C)C1	ZINC000942556290	1331971250	/nfs/dbraw/zinc/97/12/50/1331971250.db2.gz	YRTDXTFVIOYYIM-XJKSGUPXSA-N	0	3	343.858	3.285	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)cc2)CC[C@@H]1NC(=O)C1(C)CCC1	ZINC000942560596	1331975439	/nfs/dbraw/zinc/97/54/39/1331975439.db2.gz	SMVJBZYZLCSQDE-QAPCUYQASA-N	0	3	325.456	3.075	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3cncc(C)c3)C[C@@H]2C)C1	ZINC000942601896	1331998498	/nfs/dbraw/zinc/99/84/98/1331998498.db2.gz	AINURTMNLJNTDV-FUHWJXTLSA-N	0	3	327.472	3.073	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)C(C)(C)c2ccccc2Cl)[C@@H](C)C1	ZINC000944213815	1332346639	/nfs/dbraw/zinc/34/66/39/1332346639.db2.gz	GLOUXZRKUFEIOD-MAUKXSAKSA-N	0	3	346.902	3.468	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)[C@@H](C)C1	ZINC000944303111	1332367177	/nfs/dbraw/zinc/36/71/77/1332367177.db2.gz	AWOUACGNAOYJPN-XJKSGUPXSA-N	0	3	338.373	3.169	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(Cl)c(Cl)c2)[C@H](C)C1	ZINC000944305994	1332368559	/nfs/dbraw/zinc/36/85/59/1332368559.db2.gz	QFKSUUMMATUPHC-ABAIWWIYSA-N	0	3	325.239	3.067	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)Cc3ccc(C)o3)CC[C@@H]2C1	ZINC000946561060	1332855359	/nfs/dbraw/zinc/85/53/59/1332855359.db2.gz	NSUQQSSGISDRRB-IYBDPMFKSA-N	0	3	336.863	3.053	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3cc(CC)ccn3)CC[C@@H]2C1	ZINC000946605049	1332861328	/nfs/dbraw/zinc/86/13/28/1332861328.db2.gz	GPPDKVXPHIQYRE-CALCHBBNSA-N	0	3	347.890	3.181	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)Cc3ccccc3)CC[C@@H]2C1	ZINC000946649334	1332870741	/nfs/dbraw/zinc/87/07/41/1332870741.db2.gz	VQHJTSCFIWNFRS-HDICACEKSA-N	0	3	332.875	3.152	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3ccc(C)c(C)n3)CC[C@@H]2C1	ZINC000946678248	1332876205	/nfs/dbraw/zinc/87/62/05/1332876205.db2.gz	WAUJDLHYFSFWGU-CALCHBBNSA-N	0	3	347.890	3.235	20	30		EGEDHN
Cc1ccoc1C(=O)N[C@@H]1CCN(Cc2cccc(C#N)c2)[C@H](C)C1	ZINC000947057323	1332994020	/nfs/dbraw/zinc/99/40/20/1332994020.db2.gz	QNMJBVYPAXNOIO-CRAIPNDOSA-N	0	3	337.423	3.243	20	30		EGEDHN
Cc1ccncc1C(=O)N[C@H]1CCN(Cc2cccc(C#N)c2)[C@@H](C)C1	ZINC000947157977	1333028195	/nfs/dbraw/zinc/02/81/95/1333028195.db2.gz	STDZKRXHTPOUDN-LPHOPBHVSA-N	0	3	348.450	3.045	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2coc3c2cccc3OC)C[C@@H]1C	ZINC000947314041	1333085331	/nfs/dbraw/zinc/08/53/31/1333085331.db2.gz	DLGGPVYWRJLVCQ-KBPBESRZSA-N	0	3	328.412	3.210	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2c(F)c(F)cc(F)c2F)C[C@H]1C	ZINC000947327504	1333090041	/nfs/dbraw/zinc/09/00/41/1333090041.db2.gz	DQSYZYZVRYYTSE-ZJUUUORDSA-N	0	3	330.325	3.012	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cncc(-c3ccccc3)c2)C[C@H]1C	ZINC000947371537	1333107015	/nfs/dbraw/zinc/10/70/15/1333107015.db2.gz	ZUJQBTWFLBRPND-UTKZUKDTSA-N	0	3	347.462	3.355	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)Cc2ccccc2)CCN1Cc1cccc(C#N)c1	ZINC000947454312	1333134911	/nfs/dbraw/zinc/13/49/11/1333134911.db2.gz	JLMDFQIUZLWNBH-LAUBAEHRSA-N	0	3	347.462	3.270	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)n(C(CC)CC)n2)C[C@H]1C	ZINC000947471661	1333141427	/nfs/dbraw/zinc/14/14/27/1333141427.db2.gz	DUTWRSXAOHECQQ-WBVHZDCISA-N	0	3	344.503	3.159	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2ccc(CC(C)C)cc2)C[C@@H]1C	ZINC000947520658	1333156005	/nfs/dbraw/zinc/15/60/05/1333156005.db2.gz	QPHZFPHRZYJOAN-FXAWDEMLSA-N	0	3	326.484	3.030	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3c(o2)c(F)ccc3C)C[C@H]1C	ZINC000947560533	1333172251	/nfs/dbraw/zinc/17/22/51/1333172251.db2.gz	SCCVTZKHSQVHLU-CABCVRRESA-N	0	3	342.414	3.486	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3cccc(F)c3)CCC2)C[C@H]1C	ZINC000947599646	1333189055	/nfs/dbraw/zinc/18/90/55/1333189055.db2.gz	XDCFMDOJAXHZAO-APWZRJJASA-N	0	3	342.458	3.240	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3cccnc3C)[C@H](C)C2)cc1	ZINC000947611687	1333191855	/nfs/dbraw/zinc/19/18/55/1333191855.db2.gz	OVLVPZMBLRBQFL-IERDGZPVSA-N	0	3	347.462	3.154	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccc(F)c3ccncc23)C[C@@H]1C	ZINC000947647275	1333207765	/nfs/dbraw/zinc/20/77/65/1333207765.db2.gz	BINPANBVUXFHCJ-UONOGXRCSA-N	0	3	327.403	3.143	20	30		EGEDHN
Cc1ncccc1C(=O)N[C@H]1CCN(Cc2ccc(C#N)cc2)[C@@H](C)C1	ZINC000947670624	1333217410	/nfs/dbraw/zinc/21/74/10/1333217410.db2.gz	GVFFLIPCMXMIBW-KXBFYZLASA-N	0	3	348.450	3.045	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2c(C)cc(C)cc2C)C[C@H]1C	ZINC000947689943	1333225495	/nfs/dbraw/zinc/22/54/95/1333225495.db2.gz	OJOHOZLVGBTBED-RTBURBONSA-N	0	3	326.484	3.147	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)C2CC3(CC3)C2)CCN1Cc1cccc(C#N)c1	ZINC000947702289	1333231743	/nfs/dbraw/zinc/23/17/43/1333231743.db2.gz	LYRHFUGEOOZABY-BEFAXECRSA-N	0	3	337.467	3.218	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc(C)oc2C(F)(F)F)C[C@@H]1C	ZINC000947758286	1333253610	/nfs/dbraw/zinc/25/36/10/1333253610.db2.gz	LDQIJKUJXOMCCX-CMPLNLGQSA-N	0	3	330.350	3.376	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(-c3ccccc3)nc2)C[C@@H]1C	ZINC000947849966	1333279580	/nfs/dbraw/zinc/27/95/80/1333279580.db2.gz	WIBFJKPVDPZRQO-PXNSSMCTSA-N	0	3	347.462	3.355	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccn2C2CCCC2)C[C@H]1C	ZINC000947857706	1333283104	/nfs/dbraw/zinc/28/31/04/1333283104.db2.gz	QGZMSPMGEPPFEC-SJORKVTESA-N	0	3	327.472	3.209	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cccc(C(F)(F)F)c2)C[C@@H]1C	ZINC000947963261	1333322667	/nfs/dbraw/zinc/32/26/67/1333322667.db2.gz	SJJPGMHEEOIQHN-WFASDCNBSA-N	0	3	326.362	3.474	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C(F)(F)F)cc2)C[C@H]1C	ZINC000947963063	1333322895	/nfs/dbraw/zinc/32/28/95/1333322895.db2.gz	QVKPYDUAIZDBGV-CJNGLKHVSA-N	0	3	338.373	3.311	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2coc3cc(C)ccc23)C[C@@H]1C	ZINC000948002095	1333338475	/nfs/dbraw/zinc/33/84/75/1333338475.db2.gz	KMQJQAGULAUYEN-FUHWJXTLSA-N	0	3	338.451	3.276	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2sc(C(C)C)nc2C)C[C@H]1C	ZINC000948029357	1333346386	/nfs/dbraw/zinc/34/63/86/1333346386.db2.gz	AFHMDUIBIIMYKQ-HIFRSBDPSA-N	0	3	333.501	3.181	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2coc(C3CCCCC3)n2)C[C@H]1C	ZINC000948072881	1333365900	/nfs/dbraw/zinc/36/59/00/1333365900.db2.gz	FYCAZSDCTYZZAW-WBVHZDCISA-N	0	3	343.471	3.328	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(N(C)C(C)C)cc2)C[C@H]1C	ZINC000948087368	1333371650	/nfs/dbraw/zinc/37/16/50/1333371650.db2.gz	ZQRDUOZBWYJOFC-MJGOQNOKSA-N	0	3	341.499	3.137	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cscc2C(F)(F)F)C[C@H]1C	ZINC000948105216	1333375731	/nfs/dbraw/zinc/37/57/31/1333375731.db2.gz	SFHPAYBVAKWZJU-VXGBXAGGSA-N	0	3	344.402	3.373	20	30		EGEDHN
CN(C(=O)c1ccncc1)[C@H]1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC000948146094	1333393192	/nfs/dbraw/zinc/39/31/92/1333393192.db2.gz	PDHVDQIDPUUDKE-FQEVSTJZSA-N	0	3	348.450	3.080	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2ccc3nccc(C)c3c2)CC1	ZINC000948407558	1333513338	/nfs/dbraw/zinc/51/33/38/1333513338.db2.gz	DWXKQRKZGJCOGT-GOSISDBHSA-N	0	3	335.451	3.103	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)Cc2cccc3cnccc32)CC1	ZINC000948546917	1333567178	/nfs/dbraw/zinc/56/71/78/1333567178.db2.gz	LRTADOUXFGVZII-HXUWFJFHSA-N	0	3	349.478	3.114	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)[C@H]2CCCc3ccccc32)CC1	ZINC000948547251	1333568397	/nfs/dbraw/zinc/56/83/97/1333568397.db2.gz	VEEZIKRKFMCGKC-FPOVZHCZSA-N	0	3	338.495	3.443	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)C2(C)CCC(F)(F)CC2)CC1	ZINC000948560849	1333576680	/nfs/dbraw/zinc/57/66/80/1333576680.db2.gz	GMLXHECHKMCGPG-HNNXBMFYSA-N	0	3	326.431	3.148	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2coc3cc(F)ccc23)CC1	ZINC000948571111	1333581936	/nfs/dbraw/zinc/58/19/36/1333581936.db2.gz	ZNOSGQOUHDUUCJ-OAHLLOKOSA-N	0	3	328.387	3.132	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cc(F)ccc2CC)CC1	ZINC000948587134	1333586186	/nfs/dbraw/zinc/58/61/86/1333586186.db2.gz	QZUGNYOWKKLQQO-GOSISDBHSA-N	0	3	330.447	3.338	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](N(C)C(=O)c2ccc3cncn3c2)CC1	ZINC000948621959	1333600735	/nfs/dbraw/zinc/60/07/35/1333600735.db2.gz	YUEOHYXTKJACHR-MRXNPFEDSA-N	0	3	346.862	3.013	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2nc3ccccc3cc2C)CC1	ZINC000948628092	1333602807	/nfs/dbraw/zinc/60/28/07/1333602807.db2.gz	GIWMDANHHIAWJL-LJQANCHMSA-N	0	3	349.478	3.493	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2cc3cc(Cl)ccc3[nH]2)CC1	ZINC000948666078	1333622061	/nfs/dbraw/zinc/62/20/61/1333622061.db2.gz	ZYVSHQXMXCAJGL-MRXNPFEDSA-N	0	3	343.858	3.381	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)Cc2cc(C)cc(C)c2)CC1	ZINC000948743525	1333655339	/nfs/dbraw/zinc/65/53/39/1333655339.db2.gz	WPQUEIHFIUWRGG-HXUWFJFHSA-N	0	3	326.484	3.182	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cccc(OCC)c2)CC1	ZINC000948816574	1333695031	/nfs/dbraw/zinc/69/50/31/1333695031.db2.gz	JRTSQSJQMQNLAY-GOSISDBHSA-N	0	3	328.456	3.035	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2ccccc2OCC(C)C)CC1	ZINC000948864986	1333714727	/nfs/dbraw/zinc/71/47/27/1333714727.db2.gz	LGESGIWJIPRKQZ-SFHVURJKSA-N	0	3	342.483	3.281	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@@H]1CNC(=O)[C@H]1C[C@@H]1C(F)F	ZINC000948916203	1333733163	/nfs/dbraw/zinc/73/31/63/1333733163.db2.gz	PZEADXPSGIVKHQ-ULQDDVLXSA-N	0	3	334.410	3.179	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@H]1CNC(=O)[C@@H]1CCC1(F)F	ZINC000948933057	1333738582	/nfs/dbraw/zinc/73/85/82/1333738582.db2.gz	TYDZAYWWVSYRES-DLBZAZTESA-N	0	3	334.410	3.323	20	30		EGEDHN
C=CCN1CCc2ccccc2[C@H]1CNC(=O)c1n[nH]c2ccccc21	ZINC000948982497	1333757504	/nfs/dbraw/zinc/75/75/04/1333757504.db2.gz	MTGDQBCZACXSNV-LJQANCHMSA-N	0	3	346.434	3.078	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H](CC)CC1CCCC1)CCO2	ZINC000949205473	1333796242	/nfs/dbraw/zinc/79/62/42/1333796242.db2.gz	URVAHWTZWIRMQS-IBGZPJMESA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H](C)c1ccc(C)s1)CCO2	ZINC000949226842	1333798695	/nfs/dbraw/zinc/79/86/95/1333798695.db2.gz	OGPWRIDSOXIQPG-MRXNPFEDSA-N	0	3	348.512	3.039	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCC2(CC1)CN(CCCC)CCO2	ZINC000949375483	1333833763	/nfs/dbraw/zinc/83/37/63/1333833763.db2.gz	GMRUXKRFGYAQTA-UHFFFAOYSA-N	0	3	342.911	3.259	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@@H]3C[C@@H]4CCCC[C@H]34)CC2)C1	ZINC000949419812	1333843406	/nfs/dbraw/zinc/84/34/06/1333843406.db2.gz	UGQYCWAZVQSLMM-GBESFXJTSA-N	0	3	346.515	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@@H]3C[C@@]3(C)C(C)C)CC2)C1	ZINC000949501532	1333860918	/nfs/dbraw/zinc/86/09/18/1333860918.db2.gz	WYGIKJFZZJCPJM-ICSRJNTNSA-N	0	3	348.531	3.328	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@@H]3CCCC[C@H]3CC)CC2)C1	ZINC000949504794	1333862645	/nfs/dbraw/zinc/86/26/45/1333862645.db2.gz	UTQPYTSQOVCIRJ-RTBURBONSA-N	0	3	348.531	3.472	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(OC)c(C(C)C)c2)C1	ZINC000967264996	1335681300	/nfs/dbraw/zinc/68/13/00/1335681300.db2.gz	RRXJWWWHWTYJBZ-APWZRJJASA-N	0	3	342.483	3.282	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2cc(-c3ccccc3)on2)C1	ZINC000967289045	1335691035	/nfs/dbraw/zinc/69/10/35/1335691035.db2.gz	QVMQXCPLBOVDHZ-MAUKXSAKSA-N	0	3	339.439	3.358	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2coc3ccc(OC)cc23)C1	ZINC000967308158	1335695827	/nfs/dbraw/zinc/69/58/27/1335695827.db2.gz	CKPCJUUXWYWTRD-RDTXWAMCSA-N	0	3	342.439	3.458	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)Cc2cccc(C(F)F)c2)C1	ZINC000967333211	1335703659	/nfs/dbraw/zinc/70/36/59/1335703659.db2.gz	GWOLQJHJHSJMGY-PBHICJAKSA-N	0	3	334.410	3.017	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2cc3cc(C)ccc3[nH]2)C1	ZINC000967661383	1335802812	/nfs/dbraw/zinc/80/28/12/1335802812.db2.gz	YNPJMZAEVQQGNV-BEFAXECRSA-N	0	3	325.456	3.493	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2c(F)ccc(F)c2F)C1	ZINC000968105158	1335857711	/nfs/dbraw/zinc/85/77/11/1335857711.db2.gz	IJCIKTYJBOWDGT-SMDDNHRTSA-N	0	3	326.362	3.120	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)Cc2c(C)cc(C)cc2C)C1	ZINC000968170974	1335865545	/nfs/dbraw/zinc/86/55/45/1335865545.db2.gz	ANGSTTGSLLWLTP-JXFKEZNVSA-N	0	3	326.484	3.004	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)Cc2cccc(Cl)c2F)C1	ZINC000968354152	1335899528	/nfs/dbraw/zinc/89/95/28/1335899528.db2.gz	NQPCNAWPUXCPLX-CZUORRHYSA-N	0	3	338.854	3.424	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)C(C)(C)c2cccc(Cl)c2)C1	ZINC000968364059	1335903948	/nfs/dbraw/zinc/90/39/48/1335903948.db2.gz	DLBPZHOAZSGPDH-QAPCUYQASA-N	0	3	346.902	3.468	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2cc3cccnc3s2)C1	ZINC000968501701	1335944131	/nfs/dbraw/zinc/94/41/31/1335944131.db2.gz	ZEKYYHJRXLZFMY-UKRRQHHQSA-N	0	3	329.469	3.313	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccoc2Br)C1	ZINC000968503892	1335944464	/nfs/dbraw/zinc/94/44/64/1335944464.db2.gz	CAFBUHNQPXDRHH-DGCLKSJQSA-N	0	3	341.249	3.058	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)C23CC(C(F)(F)F)(C2)C3)C1	ZINC000968681410	1336008496	/nfs/dbraw/zinc/00/84/96/1336008496.db2.gz	JCKFQNXSOWOYES-KCNJBTMXSA-N	0	3	330.394	3.122	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2c[nH]c3ccc(C)cc23)C1	ZINC000968685586	1336010923	/nfs/dbraw/zinc/01/09/23/1336010923.db2.gz	VXQROFQVWVCLKK-HNAYVOBHSA-N	0	3	325.456	3.493	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)C(C)(C)c2ccccc2C)C1	ZINC000968698706	1336016496	/nfs/dbraw/zinc/01/64/96/1336016496.db2.gz	QTNSDIANVWYGFS-MJGOQNOKSA-N	0	3	326.484	3.123	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)[C@H]1CCc2cc(OC)ccc21	ZINC000968884751	1336079825	/nfs/dbraw/zinc/07/98/25/1336079825.db2.gz	BGQDTTZXRFHVCZ-PXNSSMCTSA-N	0	3	342.483	3.272	20	30		EGEDHN
C#CCCN1CCCCC[C@H]1CNC(=O)c1cc2c(o1)CCCC2	ZINC000968890930	1336082364	/nfs/dbraw/zinc/08/23/64/1336082364.db2.gz	PFLQNOHWVAHKCY-KRWDZBQOSA-N	0	3	328.456	3.156	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CC[C@@H](N[C@@H](C)c2ccccc2F)C1	ZINC000968919855	1336088701	/nfs/dbraw/zinc/08/87/01/1336088701.db2.gz	AJUWGLNXEVGKPA-JKSUJKDBSA-N	0	3	341.430	3.379	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1cccc2cccnc21	ZINC000968938749	1336096916	/nfs/dbraw/zinc/09/69/16/1336096916.db2.gz	QUYJFSSRZVTAHY-SFHVURJKSA-N	0	3	335.451	3.233	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)[C@@H]1CCOc2c(F)cccc21	ZINC000968942215	1336098471	/nfs/dbraw/zinc/09/84/71/1336098471.db2.gz	VEPOMCNXROEVAT-NVXWUHKLSA-N	0	3	346.446	3.239	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)NC[C@@H]1CCCCCN1Cc1cccc(C#N)c1	ZINC000968987580	1336110986	/nfs/dbraw/zinc/11/09/86/1336110986.db2.gz	DTZXNMCINVKYNM-SNRMKQJTSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1ccc(OC)cc1C	ZINC000969008796	1336117233	/nfs/dbraw/zinc/11/72/33/1336117233.db2.gz	XNHJLWNRHSWNIX-QGZVFWFLSA-N	0	3	328.456	3.001	20	30		EGEDHN
N#Cc1cccc(CN2CCCCC[C@H]2CNC(=O)[C@H]2CC23CC3)c1	ZINC000969044489	1336125611	/nfs/dbraw/zinc/12/56/11/1336125611.db2.gz	RAJAAVYVSLRENK-RBUKOAKNSA-N	0	3	337.467	3.219	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cccc(N2CC=CC2)c1	ZINC000969053922	1336130051	/nfs/dbraw/zinc/13/00/51/1336130051.db2.gz	OEZPVSAMWLCDND-HXUWFJFHSA-N	0	3	339.483	3.223	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccn(C(CC)CC)n1	ZINC000969057032	1336131309	/nfs/dbraw/zinc/13/13/09/1336131309.db2.gz	QKGYUNHBPKCBAT-KRWDZBQOSA-N	0	3	332.492	3.405	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1)C(C)(C)C	ZINC000969094443	1336140773	/nfs/dbraw/zinc/14/07/73/1336140773.db2.gz	ACPHQKFEVHOAQY-CZUORRHYSA-N	0	3	331.435	3.070	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cccc2[nH]c(C)nc21	ZINC000969101199	1336143772	/nfs/dbraw/zinc/14/37/72/1336143772.db2.gz	UGUNERPFXFIGPX-OAHLLOKOSA-N	0	3	326.444	3.032	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccnc(O[C@H](C)CC)c1	ZINC000969105974	1336145934	/nfs/dbraw/zinc/14/59/34/1336145934.db2.gz	QFTVXHQLMGSSIJ-AEFFLSMTSA-N	0	3	345.487	3.419	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cnn(CCCC)c1CC	ZINC000969109176	1336147513	/nfs/dbraw/zinc/14/75/13/1336147513.db2.gz	WHXQOOIOIWHMGM-KRWDZBQOSA-N	0	3	346.519	3.406	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccc(OCC2CC2)nc1	ZINC000969156325	1336166161	/nfs/dbraw/zinc/16/61/61/1336166161.db2.gz	PNSMFHRROWWWIQ-SFHVURJKSA-N	0	3	343.471	3.031	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccc(N(CC)CC)nc1	ZINC000969160892	1336167161	/nfs/dbraw/zinc/16/71/61/1336167161.db2.gz	MWLKLEQDWZDKKS-GOSISDBHSA-N	0	3	344.503	3.088	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1c[nH]c2ccc(F)cc12	ZINC000969168130	1336170409	/nfs/dbraw/zinc/17/04/09/1336170409.db2.gz	XDZQWXCGVZOLCZ-INIZCTEOSA-N	0	3	341.430	3.305	20	30		EGEDHN
C[C@@H](NC(=O)c1c[nH]c(C#N)c1)C1CN(Cc2ccccc2C2CC2)C1	ZINC000969525748	1336220245	/nfs/dbraw/zinc/22/02/45/1336220245.db2.gz	FCGVSBKNEHUGHO-CQSZACIVSA-N	0	3	348.450	3.014	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccc3cc(C)cn3c2)CC1	ZINC001005482325	1336359105	/nfs/dbraw/zinc/35/91/05/1336359105.db2.gz	OICSRQDGFNYGEI-UHFFFAOYSA-N	0	3	325.456	3.360	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2ccc(-c3ccncc3)o2)CC1	ZINC001005496241	1336361670	/nfs/dbraw/zinc/36/16/70/1336361670.db2.gz	HBWOIIJGTZFTST-UHFFFAOYSA-N	0	3	325.412	3.064	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2csc(C(F)(F)F)c2)CC1	ZINC001005660899	1336388636	/nfs/dbraw/zinc/38/86/36/1336388636.db2.gz	NKRSKDMXMOBLTI-UHFFFAOYSA-N	0	3	332.391	3.489	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2c[nH]nc2-c2ccccc2)CC1	ZINC001005789346	1336401489	/nfs/dbraw/zinc/40/14/89/1336401489.db2.gz	MOWQERXXZGYUDQ-UHFFFAOYSA-N	0	3	338.455	3.189	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cc(C)oc2C(F)(F)F)CC1	ZINC001006068538	1336446276	/nfs/dbraw/zinc/44/62/76/1336446276.db2.gz	PGSXZERMYUWWQF-UHFFFAOYSA-N	0	3	330.350	3.329	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cnc(-c3ccco3)s2)CC1	ZINC001006322366	1336488879	/nfs/dbraw/zinc/48/88/79/1336488879.db2.gz	HXYUTIKTGCFEKJ-UHFFFAOYSA-N	0	3	331.441	3.126	20	30		EGEDHN
CN(C(=O)C(C)(C)C)C1CCN(Cc2ccc(OCC#N)cc2)CC1	ZINC001006327775	1336489817	/nfs/dbraw/zinc/48/98/17/1336489817.db2.gz	WXKIKHBZCKUPNE-UHFFFAOYSA-N	0	3	343.471	3.058	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2ccc(N(CC)CC)cc2)CC1	ZINC001006338091	1336491365	/nfs/dbraw/zinc/49/13/65/1336491365.db2.gz	OVUPUZYIARHTCG-UHFFFAOYSA-N	0	3	329.488	3.255	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)Cc2coc3cc(C)ccc23)CC1	ZINC001006369544	1336496729	/nfs/dbraw/zinc/49/67/29/1336496729.db2.gz	JPHOQKJPUULFHP-UHFFFAOYSA-N	0	3	326.440	3.393	20	30		EGEDHN
C#CCCN1CCC[C@H](NC(=O)c2ccc(OC)c(C(C)C)c2)C1	ZINC001007816173	1336706255	/nfs/dbraw/zinc/70/62/55/1336706255.db2.gz	UFXRLEGHDZDBSX-KRWDZBQOSA-N	0	3	328.456	3.036	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCN(Cc3cccc(C)c3)C2)cc1	ZINC001008147289	1336779909	/nfs/dbraw/zinc/77/99/09/1336779909.db2.gz	JQRRHYOALBUREB-NRFANRHFSA-N	0	3	332.447	3.371	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H](NC(=O)c2c(C)noc2C(F)(F)F)C1	ZINC001008698268	1336913396	/nfs/dbraw/zinc/91/33/96/1336913396.db2.gz	RMABTXCAXCXCRE-GFCCVEGCSA-N	0	3	345.365	3.162	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2cnn(CCCC)c2CC)C1	ZINC001009141195	1336975861	/nfs/dbraw/zinc/97/58/61/1336975861.db2.gz	XVESNUZLJUIYSG-INIZCTEOSA-N	0	3	332.492	3.016	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN([C@H](C)c3ccccc3)C2)cn1	ZINC001009276358	1336995475	/nfs/dbraw/zinc/99/54/75/1336995475.db2.gz	OIBVIEOQSDNYHS-OXQOHEQNSA-N	0	3	333.435	3.018	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCN([C@@H](C)c3ccccc3)C2)cn1	ZINC001009276354	1336996071	/nfs/dbraw/zinc/99/60/71/1336996071.db2.gz	OIBVIEOQSDNYHS-JXFKEZNVSA-N	0	3	333.435	3.018	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2cc(F)c(F)cc2Cl)C1	ZINC001009405751	1337018843	/nfs/dbraw/zinc/01/88/43/1337018843.db2.gz	YZRGXIKXMKRKPL-LLVKDONJSA-N	0	3	328.790	3.389	20	30		EGEDHN
C=C(C)CCN1CCC[C@H](NC(=O)c2ccc(P(C)(C)=O)cc2)C1	ZINC001009611940	1337047171	/nfs/dbraw/zinc/04/71/71/1337047171.db2.gz	OTIOYLKXTJKAMH-KRWDZBQOSA-N	0	3	348.427	3.095	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2cccc3c2OCC3(C)C)C1	ZINC001009762526	1337070142	/nfs/dbraw/zinc/07/01/42/1337070142.db2.gz	PKSYDTKIEXJADN-OAHLLOKOSA-N	0	3	328.456	3.127	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CCN(Cc2ccc(C)c(C)c2)C1	ZINC001014731845	1337890987	/nfs/dbraw/zinc/89/09/87/1337890987.db2.gz	NPLTWOQEQUKHAO-LJQANCHMSA-N	0	3	337.467	3.295	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCN(Cc3ccccc3N(C)C)C2)CC1	ZINC001015659623	1338238784	/nfs/dbraw/zinc/23/87/84/1338238784.db2.gz	FUVCFOMFPVUNHV-IBGZPJMESA-N	0	3	341.499	3.190	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3cccc4cccnc43)C2)C1	ZINC001015673977	1338250723	/nfs/dbraw/zinc/25/07/23/1338250723.db2.gz	SHMHNUQKJYZLPF-GOSISDBHSA-N	0	3	335.451	3.282	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@@H]3NC(=O)C3=CCCC3)CC2)c1	ZINC001016568919	1338651188	/nfs/dbraw/zinc/65/11/88/1338651188.db2.gz	AGXVXQBXHPPHTB-IBGZPJMESA-N	0	3	335.451	3.139	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cccc3c(C)c(C)[nH]c32)CC1	ZINC001016690319	1338692054	/nfs/dbraw/zinc/69/20/54/1338692054.db2.gz	IUYCQGKJYAMUMD-IBGZPJMESA-N	0	3	349.478	3.392	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(C)nc2C(C)C)CC1	ZINC001016753648	1338712667	/nfs/dbraw/zinc/71/26/67/1338712667.db2.gz	IXGBQSMWUFOFLJ-SFHVURJKSA-N	0	3	339.483	3.121	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)Cc2c(C)cc(C)cc2C)CC1	ZINC001016805899	1338732260	/nfs/dbraw/zinc/73/22/60/1338732260.db2.gz	DCWXHWGHLAJROV-HXUWFJFHSA-N	0	3	338.495	3.148	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2ccc(C)c(C)c2Cl)CC1	ZINC001016924713	1338771475	/nfs/dbraw/zinc/77/14/75/1338771475.db2.gz	XGHVBEIDWICABJ-MRXNPFEDSA-N	0	3	330.859	3.174	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)Cc2ccc3ccccc3c2)CC1	ZINC001016965392	1338786442	/nfs/dbraw/zinc/78/64/42/1338786442.db2.gz	PQYWDXPFLOMOPY-OAQYLSRUSA-N	0	3	346.474	3.376	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)[C@@H](C)c2ccc(F)cc2F)CC1	ZINC001016984797	1338792351	/nfs/dbraw/zinc/79/23/51/1338792351.db2.gz	GPMLMVVVENKWFD-KBXCAEBGSA-N	0	3	346.421	3.062	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2c[nH]c3c2cccc3CC)CC1	ZINC001016985668	1338793021	/nfs/dbraw/zinc/79/30/21/1338793021.db2.gz	MHAFJVGASJYAPH-IBGZPJMESA-N	0	3	349.478	3.338	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)C23CC(c4ccccc4)(C2)C3)CC1	ZINC001016988966	1338794900	/nfs/dbraw/zinc/79/49/00/1338794900.db2.gz	KAFJTGYMSNJZBA-YUVSOPLDSA-N	0	3	348.490	3.102	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)C2(c3cccc(C)c3)CC2)CC1	ZINC001016989575	1338795096	/nfs/dbraw/zinc/79/50/96/1338795096.db2.gz	ZFFYBRJOIPKEHB-LJQANCHMSA-N	0	3	336.479	3.021	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H](CN(C)Cc2ccc(C#N)s2)C1)C1CC1	ZINC001017087639	1338856051	/nfs/dbraw/zinc/85/60/51/1338856051.db2.gz	NOCNUZWRSKCPQM-LSDHHAIUSA-N	0	3	345.512	3.336	20	30		EGEDHN
CC1CC(C(=O)N2CCC[C@@H](CN(C)Cc3ccc(C#N)s3)C2)C1	ZINC001017096606	1338864715	/nfs/dbraw/zinc/86/47/15/1338864715.db2.gz	IZTMTZDKAZKTLZ-PCKAHOCUSA-N	0	3	345.512	3.336	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCCN(C(=O)C2(C)CCC2)C1	ZINC001017187240	1338933058	/nfs/dbraw/zinc/93/30/58/1338933058.db2.gz	ULZLWIIJYCJGCV-HNNXBMFYSA-N	0	3	345.512	3.480	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H](CN(C)Cc3cccnc3)C2)C1	ZINC001017205975	1338951901	/nfs/dbraw/zinc/95/19/01/1338951901.db2.gz	GLMLYHVHFPUSGS-SFHVURJKSA-N	0	3	327.472	3.108	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H](CN(C)[C@@H](C)c3cnccn3)C2)C1	ZINC001017208665	1338955123	/nfs/dbraw/zinc/95/51/23/1338955123.db2.gz	UBNOKMVXQGBNEO-DLBZAZTESA-N	0	3	342.487	3.064	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@H](C)c1c(C)noc1C	ZINC001017670445	1339388390	/nfs/dbraw/zinc/38/83/90/1339388390.db2.gz	DFTVYTSECTUMPK-JCGIZDLHSA-N	0	3	345.487	3.426	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc2cnccc2c1	ZINC001017729399	1339406317	/nfs/dbraw/zinc/40/63/17/1339406317.db2.gz	CQVYEMHGMFJVGD-BGYRXZFFSA-N	0	3	335.451	3.029	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1c(C)cc(C)cc1C	ZINC001017887180	1339440469	/nfs/dbraw/zinc/44/04/69/1339440469.db2.gz	VXNUBZSPIVADSK-KDURUIRLSA-N	0	3	326.484	3.406	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccc(Cl)c1F	ZINC001017993987	1339477456	/nfs/dbraw/zinc/47/74/56/1339477456.db2.gz	WXCJKBRWJGYZRX-GASCZTMLSA-N	0	3	336.838	3.273	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H](C)c1cccnc1	ZINC001018020724	1339482925	/nfs/dbraw/zinc/48/29/25/1339482925.db2.gz	ATXNQMLBEJYWMT-QRQLOZEOSA-N	0	3	327.472	3.217	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C1(c2cccc(F)c2)CC1	ZINC001018023687	1339484380	/nfs/dbraw/zinc/48/43/80/1339484380.db2.gz	NTFBLUGPZAISBJ-KDURUIRLSA-N	0	3	342.458	3.499	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cccc2c1ccn2C	ZINC001018069136	1339495113	/nfs/dbraw/zinc/49/51/13/1339495113.db2.gz	AGPKCVOTJLVAOV-CALCHBBNSA-N	0	3	337.467	3.433	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)COc1ccc(CC)cc1	ZINC001018233365	1339542353	/nfs/dbraw/zinc/54/23/53/1339542353.db2.gz	JKKSLNMFCBJYBC-KDURUIRLSA-N	0	3	342.483	3.269	20	30		EGEDHN
C[C@@H](N[C@H]1CCN(C(=O)C#CC2CC2)C1)c1ccc(F)c(Cl)c1	ZINC001018819209	1339734768	/nfs/dbraw/zinc/73/47/68/1339734768.db2.gz	QADNLVRAUHSMSZ-DOMZBBRYSA-N	0	3	334.822	3.144	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@H](NCc2ccc(C)nc2C)C1	ZINC001018909791	1339750966	/nfs/dbraw/zinc/75/09/66/1339750966.db2.gz	CXJXEHGDROJTAF-INIZCTEOSA-N	0	3	335.879	3.168	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1cnn(C2CCCCC2)c1	ZINC001028247508	1340508014	/nfs/dbraw/zinc/50/80/14/1340508014.db2.gz	QHUZDWUDTPATKI-SFHVURJKSA-N	0	3	330.476	3.159	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCCN2Cc2cccc(CC)c2)nc1	ZINC001028269569	1340523598	/nfs/dbraw/zinc/52/35/98/1340523598.db2.gz	QSRDTKSFZMNIGF-HXUWFJFHSA-N	0	3	347.462	3.020	20	30		EGEDHN
Cc1cc(C(=O)NC[C@@H]2CCN(Cc3ccc(C#N)cc3)C2)c(C)o1	ZINC001028403009	1340624547	/nfs/dbraw/zinc/62/45/47/1340624547.db2.gz	IYOBXVHKWSBCFC-SFHVURJKSA-N	0	3	337.423	3.020	20	30		EGEDHN
CC1(C)CCC[C@@H]1C(=O)NC[C@@H]1CCN(Cc2ccc(C#N)cc2)C1	ZINC001028745582	1340786095	/nfs/dbraw/zinc/78/60/95/1340786095.db2.gz	DUULDXAGYHEBLI-RBUKOAKNSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CCN(Cc3ccc(C)nc3C)C2)CC1	ZINC001028780324	1340811469	/nfs/dbraw/zinc/81/14/69/1340811469.db2.gz	HEDCRYJDDLMUNG-GOSISDBHSA-N	0	3	341.499	3.383	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)C1CCN(C(=O)c2ccco2)CC1	ZINC001029040440	1340915115	/nfs/dbraw/zinc/91/51/15/1340915115.db2.gz	SHCSYNHPDCBANZ-OAHLLOKOSA-N	0	3	337.423	3.182	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC([C@H](C)NCc2cc(F)ccc2C#N)CC1	ZINC001029054070	1340919922	/nfs/dbraw/zinc/91/99/22/1340919922.db2.gz	OWWQRTPOOCNZJC-CABCVRRESA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)C1CCN(C(=O)C2=CCCC2)CC1	ZINC001029082126	1340926731	/nfs/dbraw/zinc/92/67/31/1340926731.db2.gz	ZNCMAEOQURUTLO-MRXNPFEDSA-N	0	3	337.467	3.385	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC([C@@H](C)NCc2ccn(C(C)C)n2)CC1	ZINC001029125646	1340936162	/nfs/dbraw/zinc/93/61/62/1340936162.db2.gz	FUDZZWVRGJIRRW-MRXNPFEDSA-N	0	3	346.519	3.393	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1C[C@H]2CC[C@@H](C1)N2[C@@H]1CCc2ccc(Cl)cc21	ZINC001029244779	1340960602	/nfs/dbraw/zinc/96/06/02/1340960602.db2.gz	LPPQPAPCONZVEH-BWUSGFMJSA-N	0	3	343.858	3.162	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H](CN(C)Cc2cncc(F)c2)C1	ZINC001029825510	1341086945	/nfs/dbraw/zinc/08/69/45/1341086945.db2.gz	FMLRQMWFFGFYJR-DNVCBOLYSA-N	0	3	333.451	3.103	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](CN(C)Cc2c(C)noc2C)C1	ZINC001029825797	1341087206	/nfs/dbraw/zinc/08/72/06/1341087206.db2.gz	IHMGSPJNWQTHET-QFBILLFUSA-N	0	3	333.476	3.174	20	30		EGEDHN
C=C[C@H](C(=O)N1CC[C@H](CN(C)Cc2ccccn2)C1)c1ccccc1	ZINC001029907955	1341112306	/nfs/dbraw/zinc/11/23/06/1341112306.db2.gz	WJQIXZDPLIFHFJ-NQIIRXRSSA-N	0	3	349.478	3.332	20	30		EGEDHN
C#CCCN1CCC[C@H](N(Cc2ccccc2)C(=O)c2ccccn2)C1	ZINC001029919082	1341118836	/nfs/dbraw/zinc/11/88/36/1341118836.db2.gz	OIIWLTPUMAWFGR-FQEVSTJZSA-N	0	3	347.462	3.212	20	30		EGEDHN
C#Cc1ccc(C(=O)N(Cc2ccccc2)[C@H]2CCCN(CC)C2)cn1	ZINC001029920977	1341120392	/nfs/dbraw/zinc/12/03/92/1341120392.db2.gz	OESUSYVBXFGQRD-NRFANRHFSA-N	0	3	347.462	3.190	20	30		EGEDHN
CN(Cc1cc(C#N)ccc1F)CC1CCN(C(=O)CC2CC2)CC1	ZINC001029925338	1341122266	/nfs/dbraw/zinc/12/22/66/1341122266.db2.gz	PDHWCUHUMTXLPN-UHFFFAOYSA-N	0	3	343.446	3.168	20	30		EGEDHN
CC(C)CC(=O)N1CCC(CN(C)Cc2ccc(C#N)s2)CC1	ZINC001029928706	1341123866	/nfs/dbraw/zinc/12/38/66/1341123866.db2.gz	UGINXONHEYVIDP-UHFFFAOYSA-N	0	3	333.501	3.336	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC(CN(C)Cc2cncc(F)c2)CC1	ZINC001029983351	1341143729	/nfs/dbraw/zinc/14/37/29/1341143729.db2.gz	DHTBXIRVIXAXKK-UHFFFAOYSA-N	0	3	333.451	3.103	20	30		EGEDHN
C=CCn1cccc1C(=O)NCC1CN(Cc2cc(C)ccc2C)C1	ZINC001031731222	1341394440	/nfs/dbraw/zinc/39/44/40/1341394440.db2.gz	PCAWZJHFJPTRIN-UHFFFAOYSA-N	0	3	337.467	3.153	20	30		EGEDHN
C#Cc1ccc(C(=O)NCC2CN(Cc3cc(C)cc(C)c3)C2)cc1	ZINC001031892108	1341417581	/nfs/dbraw/zinc/41/75/81/1341417581.db2.gz	MWPFBHGMFKXFSI-UHFFFAOYSA-N	0	3	332.447	3.147	20	30		EGEDHN
C#Cc1ccc(C(=O)NCC2CN(CC[C@@H]3CCCC3(F)F)C2)cc1	ZINC001031892040	1341417589	/nfs/dbraw/zinc/41/75/89/1341417589.db2.gz	JXFGZSZCBZHUSL-SFHVURJKSA-N	0	3	346.421	3.155	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cccc(OCCC)c1	ZINC001032431116	1341511162	/nfs/dbraw/zinc/51/11/62/1341511162.db2.gz	SMXRWLLQGMXKKF-ROUUACIJSA-N	0	3	328.456	3.340	20	30		EGEDHN
C=CCn1cccc1C(=O)N1C[C@@H]2C[C@H]1CN2CC1CCC(C)CC1	ZINC001032447394	1341512853	/nfs/dbraw/zinc/51/28/53/1341512853.db2.gz	KSTGKDIPXKJEKE-BTRQGYIVSA-N	0	3	341.499	3.399	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1ccc(F)c(Cl)c1	ZINC001032646425	1341569347	/nfs/dbraw/zinc/56/93/47/1341569347.db2.gz	ODVRTIVFTVEUCG-GJZGRUSLSA-N	0	3	336.838	3.273	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H]1CCCc2sc(C)nc21	ZINC001032728481	1341593620	/nfs/dbraw/zinc/59/36/20/1341593620.db2.gz	ZUODQVWMORZPSR-HRCADAONSA-N	0	3	345.512	3.123	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(N(CC)CC)cc1	ZINC001032750822	1341602604	/nfs/dbraw/zinc/60/26/04/1341602604.db2.gz	YZYQTFWKJCATTC-OALUTQOASA-N	0	3	327.472	3.008	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N2C[C@@H]3C[C@H]2CN3CCC(=C)C)cc1	ZINC001032805793	1341620170	/nfs/dbraw/zinc/62/01/70/1341620170.db2.gz	ASDLUVTZHFSLNT-OALUTQOASA-N	0	3	340.467	3.045	20	30		EGEDHN
C=C(C)CCN1CC[C@H](N(C)C(=O)c2ccc(-c3cc[nH]n3)s2)C1	ZINC001033165164	1341742455	/nfs/dbraw/zinc/74/24/55/1341742455.db2.gz	IVBANJSPOGEMGE-AWEZNQCLSA-N	0	3	344.484	3.251	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2cnc3c(F)cccc3c2)C1	ZINC001033268640	1341764145	/nfs/dbraw/zinc/76/41/45/1341764145.db2.gz	DDFRZVXVBJLGCS-MRXNPFEDSA-N	0	3	327.403	3.096	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccccc2CC)C1	ZINC001033372536	1341800843	/nfs/dbraw/zinc/80/08/43/1341800843.db2.gz	GCGZQHMSBIALQH-YZGWKJHDSA-N	0	3	326.484	3.461	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)[C@@H]2CCN(C[C@H](OC)c3ccccc3)C2)C1	ZINC001033400061	1341814074	/nfs/dbraw/zinc/81/40/74/1341814074.db2.gz	SMPHEWOCQMMOSK-MOPGFXCFSA-N	0	3	342.483	3.263	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2ccccc2OC2CCC2)C1	ZINC001033404942	1341816571	/nfs/dbraw/zinc/81/65/71/1341816571.db2.gz	IXHKUNUNMUTCST-INIZCTEOSA-N	0	3	328.456	3.340	20	30		EGEDHN
C#CCCN1CC[C@H](N(C)C(=O)c2ccc(Cl)c3occc32)C1	ZINC001033575095	1341880640	/nfs/dbraw/zinc/88/06/40/1341880640.db2.gz	GUQLBTUAVDOOOL-ZDUSSCGKSA-N	0	3	330.815	3.256	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2ccc(N(C)CCC)cc2)C1	ZINC001033712839	1341971908	/nfs/dbraw/zinc/97/19/08/1341971908.db2.gz	KVMUHBUFHAGOCR-LJQANCHMSA-N	0	3	329.488	3.255	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)[C@@]2(C)CCc3ccccc3C2)C1	ZINC001033713800	1341972658	/nfs/dbraw/zinc/97/26/58/1341972658.db2.gz	IOFRADLYAQUPJT-FPOVZHCZSA-N	0	3	326.484	3.290	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)[C@@H]2[C@@H](c3ccccc3)C2(C)C)C1	ZINC001033832282	1342033499	/nfs/dbraw/zinc/03/34/99/1342033499.db2.gz	IQHPTQFHLYDTMH-ZCNNSNEGSA-N	0	3	338.495	3.372	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2cc(C3CCCCC3)n[nH]2)C1	ZINC001033855853	1342046285	/nfs/dbraw/zinc/04/62/85/1342046285.db2.gz	KOJZBIJZOZHJPM-QGZVFWFLSA-N	0	3	342.487	3.017	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2cc3c(cc(C)cc3C)[nH]2)C1	ZINC001033915343	1342084693	/nfs/dbraw/zinc/08/46/93/1342084693.db2.gz	CCIAFLKCVLAHGT-QGZVFWFLSA-N	0	3	337.467	3.344	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2ccc(F)c(Cl)c2F)C1	ZINC001033942337	1342103788	/nfs/dbraw/zinc/10/37/88/1342103788.db2.gz	ZHFSLJXEJLGGLZ-GFCCVEGCSA-N	0	3	340.801	3.178	20	30		EGEDHN
C=C1CCC(C(=O)N(CC)[C@H]2CCN(C[C@@H]3CC(C)(C)CO3)C2)CC1	ZINC001033951501	1342109377	/nfs/dbraw/zinc/10/93/77/1342109377.db2.gz	WUXWKBVMMSUBMT-OALUTQOASA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cnn(CCCC)c2C)C1	ZINC001034016206	1342153338	/nfs/dbraw/zinc/15/33/38/1342153338.db2.gz	LCYIWZIYKQQFPO-KRWDZBQOSA-N	0	3	332.492	3.104	20	30		EGEDHN
C#Cc1ccc(C(=O)N(CC)[C@H]2CCN(Cc3ccccc3C)C2)nc1	ZINC001034023174	1342161587	/nfs/dbraw/zinc/16/15/87/1342161587.db2.gz	OGBHDZWSGBTZAT-FQEVSTJZSA-N	0	3	347.462	3.108	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2ccc(C(F)(F)F)cc2)C1	ZINC001034030128	1342169327	/nfs/dbraw/zinc/16/93/27/1342169327.db2.gz	REEADPCCRJANGB-MRXNPFEDSA-N	0	3	338.373	3.265	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2ccsc2C(F)F)C1	ZINC001034035866	1342175467	/nfs/dbraw/zinc/17/54/67/1342175467.db2.gz	MSYZSPXKWUUKDK-GFCCVEGCSA-N	0	3	326.412	3.245	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2ccc(F)c3occc32)C1	ZINC001034046839	1342186602	/nfs/dbraw/zinc/18/66/02/1342186602.db2.gz	ALNSKQXTHCPXSO-AWEZNQCLSA-N	0	3	328.387	3.132	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2ccc(N(C)C(C)C)cc2)C1	ZINC001034055379	1342195948	/nfs/dbraw/zinc/19/59/48/1342195948.db2.gz	TXTNLASZLJFVRO-FQEVSTJZSA-N	0	3	341.499	3.091	20	30		EGEDHN
C=C(Cl)CN1CCCC[C@@H](NC(=O)c2n[nH]c3ccc(C)cc32)C1	ZINC001034285975	1342373582	/nfs/dbraw/zinc/37/35/82/1342373582.db2.gz	HXVVCBPVGDOAQW-CQSZACIVSA-N	0	3	346.862	3.208	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc(-n3ccnc3)cc2)C1	ZINC001034328033	1342402387	/nfs/dbraw/zinc/40/23/87/1342402387.db2.gz	PHQCPRVLHNMTOY-GOSISDBHSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@@H]2COc3cc(C)c(C)cc32)C1	ZINC001034330099	1342405235	/nfs/dbraw/zinc/40/52/35/1342405235.db2.gz	KRFKXVPABHSMOW-PKOBYXMFSA-N	0	3	342.483	3.326	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CCCCN(Cc3ccc(C)cc3)C2)c1	ZINC001034390563	1342460654	/nfs/dbraw/zinc/46/06/54/1342460654.db2.gz	BKLFABQSIWCWTD-OAQYLSRUSA-N	0	3	347.462	3.156	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cc(Br)co2)C1	ZINC001034432641	1342493940	/nfs/dbraw/zinc/49/39/40/1342493940.db2.gz	XILLBALTKGSJNC-ZDUSSCGKSA-N	0	3	341.249	3.203	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@@H]2CCCCN(CC=C(C)C)C2)cc1	ZINC001034431656	1342493056	/nfs/dbraw/zinc/49/30/56/1342493056.db2.gz	LKIPNNODVJHTHG-LJQANCHMSA-N	0	3	340.467	3.249	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cc(-c3ccc(C)o3)n[nH]2)C1	ZINC001034528022	1342584246	/nfs/dbraw/zinc/58/42/46/1342584246.db2.gz	ILLBFSAXZBDTMH-OAHLLOKOSA-N	0	3	342.443	3.139	20	30		EGEDHN
Cc1cncc(C(=O)N[C@H]2CC[C@H](NCc3ccccc3C#N)CC2)c1	ZINC001034613797	1342648691	/nfs/dbraw/zinc/64/86/91/1342648691.db2.gz	AZVRKHKDSKBVQV-MXVIHJGJSA-N	0	3	348.450	3.093	20	30		EGEDHN
N#Cc1ccc(F)cc1CN[C@H]1CC[C@H](NC(=O)[C@@H]2CC23CC3)CC1	ZINC001034744745	1342732684	/nfs/dbraw/zinc/73/26/84/1342732684.db2.gz	OILMYMDLGKGMCJ-BZSNNMDCSA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cccc(OC)c2)C12CCC2	ZINC001078793652	1357087669	/nfs/dbraw/zinc/08/76/69/1357087669.db2.gz	ZNVCXKIBMOLLMW-HOTGVXAUSA-N	0	3	334.847	3.078	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)/C=C\c2ccco2)s1	ZINC001034845082	1342797392	/nfs/dbraw/zinc/79/73/92/1342797392.db2.gz	FITKAHNSQBOGCX-BMWLXYDHSA-N	0	3	341.436	3.007	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)[C@H]2CC=CCC2)s1	ZINC001034858186	1342808141	/nfs/dbraw/zinc/80/81/41/1342808141.db2.gz	FBHATFKDLIAFIG-LSDHHAIUSA-N	0	3	329.469	3.057	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2ccc(F)cc2F)C12CCC2	ZINC001078799361	1357090583	/nfs/dbraw/zinc/09/05/83/1357090583.db2.gz	ZYDQIZDRFHMCAC-CABCVRRESA-N	0	3	340.801	3.348	20	30		EGEDHN
N#Cc1c[nH]c(C(=O)N2CCC[C@@H]2CNCc2cc3ccccc3o2)c1	ZINC001034895840	1342825999	/nfs/dbraw/zinc/82/59/99/1342825999.db2.gz	SBQAEDSNIVKSQA-MRXNPFEDSA-N	0	3	348.406	3.027	20	30		EGEDHN
C[C@@H](NC[C@H]1CCCN1C(=O)C#CC1CC1)c1cc(F)ccc1F	ZINC001034930157	1342840746	/nfs/dbraw/zinc/84/07/46/1342840746.db2.gz	KMEXHDBHTMJWAY-CZUORRHYSA-N	0	3	332.394	3.020	20	30		EGEDHN
CC1(C)CC[C@H]1C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)c(F)c1	ZINC001035022807	1342882254	/nfs/dbraw/zinc/88/22/54/1342882254.db2.gz	SLCFFPXAMYWNPQ-SJORKVTESA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H]1CNCc1ccnc(Cl)c1	ZINC001035034896	1342888523	/nfs/dbraw/zinc/88/85/23/1342888523.db2.gz	ASOKKTQNDBYNCI-QAPCUYQASA-N	0	3	335.879	3.418	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)s2)CC1	ZINC001035035306	1342889093	/nfs/dbraw/zinc/88/90/93/1342889093.db2.gz	IVHXIXLOFIFWHM-MRXNPFEDSA-N	0	3	343.496	3.447	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2ccc(C)nc2C)C12CCC2	ZINC001078819165	1357099639	/nfs/dbraw/zinc/09/96/39/1357099639.db2.gz	JIZOUDGVGLHGCE-CVEARBPZSA-N	0	3	333.863	3.082	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC2(CCN(CC#Cc3ccccc3)C2)CC1	ZINC001035173046	1342989370	/nfs/dbraw/zinc/98/93/70/1342989370.db2.gz	SYSLBWHVWDKKFQ-QBROUFQSSA-N	0	3	336.479	3.319	20	30		EGEDHN
N#Cc1ccccc1CN1CCC2(C1)CCN(C(=O)C1=CCCC1)CC2	ZINC001035175503	1342992324	/nfs/dbraw/zinc/99/23/24/1342992324.db2.gz	NURMIIPGMIHPPB-UHFFFAOYSA-N	0	3	349.478	3.483	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cccc3c1O[C@H](C)C3)CC2	ZINC001035753622	1343171670	/nfs/dbraw/zinc/17/16/70/1343171670.db2.gz	USLDVVMWHABHDU-MRXNPFEDSA-N	0	3	340.467	3.124	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@@H]1CC[C@H](C(F)(F)F)C1)CC2	ZINC001035777276	1343188369	/nfs/dbraw/zinc/18/83/69/1343188369.db2.gz	KUKPVLPDGKMRBA-CABCVRRESA-N	0	3	344.421	3.466	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc(F)c(F)c1F)CC2	ZINC001035778350	1343189043	/nfs/dbraw/zinc/18/90/43/1343189043.db2.gz	ARZLXNFMPBTYPJ-UHFFFAOYSA-N	0	3	338.373	3.218	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1nccc3ccccc31)CC2	ZINC001035779221	1343190115	/nfs/dbraw/zinc/19/01/15/1343190115.db2.gz	WLQLMOYTXMTKHR-UHFFFAOYSA-N	0	3	335.451	3.349	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccc3sccc3c1)CC2	ZINC001035825933	1343216015	/nfs/dbraw/zinc/21/60/15/1343216015.db2.gz	IDCJGEQTLXDPJN-UHFFFAOYSA-N	0	3	338.476	3.463	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccc(C3CC3)s1)CC2	ZINC001035836899	1343220443	/nfs/dbraw/zinc/22/04/43/1343220443.db2.gz	PIIHBIYINGPLMW-UHFFFAOYSA-N	0	3	328.481	3.187	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)Cc1cccc3ccccc31)CC2	ZINC001035842776	1343224931	/nfs/dbraw/zinc/22/49/31/1343224931.db2.gz	NMYZANWICSRVFN-UHFFFAOYSA-N	0	3	346.474	3.330	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@H](C)Oc1cccc(C)c1)CC2	ZINC001035846996	1343227602	/nfs/dbraw/zinc/22/76/02/1343227602.db2.gz	DMIHLHFWRAIVQK-SFHVURJKSA-N	0	3	342.483	3.263	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)COc1cc(C)cc(C)c1)CC2	ZINC001035849465	1343228717	/nfs/dbraw/zinc/22/87/17/1343228717.db2.gz	BASWHAYTPKMILN-UHFFFAOYSA-N	0	3	342.483	3.183	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](NCc2nc(C)sc2C)[C@H](C)C1	ZINC001036142797	1343326214	/nfs/dbraw/zinc/32/62/14/1343326214.db2.gz	LNSPPEPQVZVTST-DOMZBBRYSA-N	0	3	335.517	3.299	20	30		EGEDHN
CCCC(=O)N1CCC[C@@H]([C@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001036337030	1343422022	/nfs/dbraw/zinc/42/20/22/1343422022.db2.gz	WYTFPSXBLOPBDO-GOEBONIOSA-N	0	3	331.435	3.214	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCCN(C(=O)CC2CCC2)C1	ZINC001036389397	1343459661	/nfs/dbraw/zinc/45/96/61/1343459661.db2.gz	RCLLYPPNWZUZDD-UZLBHIALSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCCN(C(=O)CC2CCC2)C1	ZINC001036389392	1343459669	/nfs/dbraw/zinc/45/96/69/1343459669.db2.gz	RCLLYPPNWZUZDD-JXFKEZNVSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@H]([C@@H](C)NCc3cnc(C)o3)C2)CC1	ZINC001036431738	1343483557	/nfs/dbraw/zinc/48/35/57/1343483557.db2.gz	VLFTWMRUNGFQOX-QAPCUYQASA-N	0	3	345.487	3.446	20	30		EGEDHN
CCCC(=O)N1CCC[C@H](C)[C@H]1CNCc1ccc(C#N)cc1F	ZINC001036492074	1343514982	/nfs/dbraw/zinc/51/49/82/1343514982.db2.gz	BMAIQOSVJLITIY-KBXCAEBGSA-N	0	3	331.435	3.214	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@@H](C)[C@H]1CNCc1cc(C#N)ccc1F	ZINC001036503302	1343521673	/nfs/dbraw/zinc/52/16/73/1343521673.db2.gz	MWLQTSFPLRUFLL-DNVCBOLYSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@@H](C)[C@H]2CNCc2cnoc2C)CC1	ZINC001036574588	1343561275	/nfs/dbraw/zinc/56/12/75/1343561275.db2.gz	NXLGPRQCYKPHFN-DNVCBOLYSA-N	0	3	345.487	3.446	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3CN(C(=O)C4CCCC4)CC[C@@H]32)s1	ZINC001036621442	1343580422	/nfs/dbraw/zinc/58/04/22/1343580422.db2.gz	UPQRLACVDVMXHS-YJBOKZPZSA-N	0	3	343.496	3.233	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@H]2[C@@H](CCN2Cc2ccc(Cl)cc2)C1	ZINC001036713151	1343645448	/nfs/dbraw/zinc/64/54/48/1343645448.db2.gz	DIIBEFAZXQHMBT-HKUYNNGSSA-N	0	3	342.870	3.176	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2[C@@H](CCN2Cc2cncs2)C1	ZINC001036794333	1343726519	/nfs/dbraw/zinc/72/65/19/1343726519.db2.gz	SSUNSDYTJTXDFE-HOCLYGCPSA-N	0	3	333.501	3.168	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@@H]2CN(C(=O)[C@H]3C[C@H]4C[C@H]4C3)CC[C@H]21	ZINC001036798408	1343732404	/nfs/dbraw/zinc/73/24/04/1343732404.db2.gz	KPWWSCPKPWFRNN-CRSSMBPESA-N	0	3	349.478	3.027	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@H]2[C@H](CCN2CC#Cc2ccccc2)C1	ZINC001036804040	1343738781	/nfs/dbraw/zinc/73/87/81/1343738781.db2.gz	DAFJXDOUIQLNIU-UXHICEINSA-N	0	3	338.495	3.397	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@@H]2CN(C(=O)C3CC4(CC4)C3)CC[C@H]21	ZINC001036818974	1343757984	/nfs/dbraw/zinc/75/79/84/1343757984.db2.gz	LMXIDOAISRZKQU-UYAOXDASSA-N	0	3	349.478	3.171	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@H]1CCC[C@@H]1NC(=O)C1CCCC1	ZINC001036921775	1343865696	/nfs/dbraw/zinc/86/56/96/1343865696.db2.gz	HWUXAKGRERFQRX-APWZRJJASA-N	0	3	343.446	3.262	20	30		EGEDHN
Cc1occc1C(=O)N[C@@H]1CCC[C@H]1CNCc1ccccc1C#N	ZINC001036940242	1343883886	/nfs/dbraw/zinc/88/38/86/1343883886.db2.gz	WPSDATGMZQMVDN-PKOBYXMFSA-N	0	3	337.423	3.148	20	30		EGEDHN
CC(C(=O)N[C@@H]1CCC[C@H]1CNCc1ccccc1C#N)=C1CCC1	ZINC001037005981	1343925139	/nfs/dbraw/zinc/92/51/39/1343925139.db2.gz	KWVLBVFZYGOJOE-VQTJNVASSA-N	0	3	337.467	3.433	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCC[C@H]2CNCc2nc(C)sc2C)C1	ZINC001037075534	1343968663	/nfs/dbraw/zinc/96/86/63/1343968663.db2.gz	QWUBXYWUWWUZCF-JKSUJKDBSA-N	0	3	347.528	3.491	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCC[C@H]1NC(=O)c1cccnc1	ZINC001037157380	1344007897	/nfs/dbraw/zinc/00/78/97/1344007897.db2.gz	UXEQPPMTDYTUHZ-UYAOXDASSA-N	0	3	348.450	3.032	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCCC[C@@H]2CNCc2ocnc2C)C1	ZINC001037242936	1344064143	/nfs/dbraw/zinc/06/41/43/1344064143.db2.gz	SXIAGNTVPTTXFQ-CVEARBPZSA-N	0	3	331.460	3.104	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NC[C@@H]1CCN1CCC1CCCCC1	ZINC001038267689	1344348779	/nfs/dbraw/zinc/34/87/79/1344348779.db2.gz	YPVVAMYFRWETEO-OTWHNJEPSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1cn(C)c2ccc(F)cc12	ZINC001038353935	1344394699	/nfs/dbraw/zinc/39/46/99/1344394699.db2.gz	XLYAPPYZLVYBAH-HNNXBMFYSA-N	0	3	329.419	3.088	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1ccccc1OC1CCC1	ZINC001038676465	1344538091	/nfs/dbraw/zinc/53/80/91/1344538091.db2.gz	KNAVXEOIQPKGHJ-INIZCTEOSA-N	0	3	328.456	3.388	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)[C@@H]1C[C@H]1c1c(F)cccc1F	ZINC001038682884	1344541063	/nfs/dbraw/zinc/54/10/63/1344541063.db2.gz	XWMHWSGKVDXAEM-RRFJBIMHSA-N	0	3	334.410	3.225	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1cnn(CCCC)c1CC	ZINC001038898752	1344639172	/nfs/dbraw/zinc/63/91/72/1344639172.db2.gz	CONPWCGLHZNTDU-MRXNPFEDSA-N	0	3	332.492	3.016	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)CC2CCCC2)CC[C@H]1c1ccc(F)cc1	ZINC001079148485	1357196637	/nfs/dbraw/zinc/19/66/37/1357196637.db2.gz	WBVFUVYWSZZZIX-VQTJNVASSA-N	0	3	342.458	3.313	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C2C(C)(C)C2(C)C)C[C@H]1c1cccc(F)c1	ZINC001079177771	1357201640	/nfs/dbraw/zinc/20/16/40/1357201640.db2.gz	IIKCPFMNHBGGJJ-DLBZAZTESA-N	0	3	342.458	3.025	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)C1CC(c2cccc(F)c2)C1	ZINC001039083501	1344759498	/nfs/dbraw/zinc/75/94/98/1344759498.db2.gz	YJMGMGKGGSRSII-TVPLGVNVSA-N	0	3	330.447	3.476	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)c3ccn(C)c3C)CC2)C1	ZINC001039157000	1344842148	/nfs/dbraw/zinc/84/21/48/1344842148.db2.gz	AUERWSQZWXNAET-QGZVFWFLSA-N	0	3	349.906	3.260	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2nc(C(C)C)oc2C)C1	ZINC001039200766	1344910548	/nfs/dbraw/zinc/91/05/48/1344910548.db2.gz	REPQTPSWAUUBNQ-SJORKVTESA-N	0	3	343.471	3.056	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2oc(C)cc2C)C1	ZINC001039203561	1344914669	/nfs/dbraw/zinc/91/46/69/1344914669.db2.gz	QKYYEVMIOAVTNB-MSOLQXFVSA-N	0	3	328.456	3.236	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc3c(o2)CCCC3)C1	ZINC001039209741	1344922723	/nfs/dbraw/zinc/92/27/23/1344922723.db2.gz	LDXMKPKFBRUDKG-ZWKOTPCHSA-N	0	3	340.467	3.108	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccn(C(C)C)c2C)C1	ZINC001039225452	1344943464	/nfs/dbraw/zinc/94/34/64/1344943464.db2.gz	OHNLKGZHTBDLOM-ICSRJNTNSA-N	0	3	341.499	3.327	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cnc3ccccc3c2)C1	ZINC001039238262	1344961208	/nfs/dbraw/zinc/96/12/08/1344961208.db2.gz	NAYZFGPEOHPLRX-GHTZIAJQSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc(F)cc(Cl)c2)C1	ZINC001039240553	1344965267	/nfs/dbraw/zinc/96/52/67/1344965267.db2.gz	XZARZRBZHPMSTR-RDTXWAMCSA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)C2CCC=CCC2)C1	ZINC001039241681	1344967145	/nfs/dbraw/zinc/96/71/45/1344967145.db2.gz	GNJAFLGTGWFONA-WOJBJXKFSA-N	0	3	328.500	3.459	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccccc2OC)C1	ZINC001039244315	1344971744	/nfs/dbraw/zinc/97/17/44/1344971744.db2.gz	IDCQCJRDTGOFQV-HKUYNNGSSA-N	0	3	340.467	3.035	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2sc(C)nc2C)C1	ZINC001039250521	1344981235	/nfs/dbraw/zinc/98/12/35/1344981235.db2.gz	OQHUGLGDPYVRMU-IAGOWNOFSA-N	0	3	345.512	3.100	20	30		EGEDHN
N#Cc1ccccc1CNC1C[C@H]2CCC[C@@H](C1)N2C(=O)c1cc[nH]c1	ZINC001039276684	1344993315	/nfs/dbraw/zinc/99/33/15/1344993315.db2.gz	SVTZWIZPEDOGLX-IHWFROFDSA-N	0	3	348.450	3.202	20	30		EGEDHN
Cc1ccccc1CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1c[nH]c(C#N)c1	ZINC001039366194	1345030428	/nfs/dbraw/zinc/03/04/28/1345030428.db2.gz	UAVXEPKXVYITQX-UXHICEINSA-N	0	3	348.450	3.074	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccnn1[C@H](C)CC	ZINC001039381935	1345036756	/nfs/dbraw/zinc/03/67/56/1345036756.db2.gz	NXLJBKJWJOSNFM-ZACQAIPSSA-N	0	3	330.476	3.109	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(C(C)C)nc1	ZINC001039386708	1345038972	/nfs/dbraw/zinc/03/89/72/1345038972.db2.gz	ZYOYHCGMMQUACW-MSOLQXFVSA-N	0	3	327.472	3.460	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1cc(C)c(Cl)cn1	ZINC001039392805	1345041958	/nfs/dbraw/zinc/04/19/58/1345041958.db2.gz	GALYRLAMIYZYSY-SJORKVTESA-N	0	3	347.890	3.227	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(C)n(CC)c1C	ZINC001039401091	1345047731	/nfs/dbraw/zinc/04/77/31/1345047731.db2.gz	JGNGKMGAYPHLQH-MSOLQXFVSA-N	0	3	329.488	3.380	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(-c2ccccc2)on1	ZINC001039402589	1345048292	/nfs/dbraw/zinc/04/82/92/1345048292.db2.gz	FCYMDRJTBSXLPZ-MSOLQXFVSA-N	0	3	349.434	3.044	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc2c(cn1)CCCC2	ZINC001039403030	1345048735	/nfs/dbraw/zinc/04/87/35/1345048735.db2.gz	FMTPVUPYSMTDFA-MOPGFXCFSA-N	0	3	339.483	3.215	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@H]1CCC2(CCC2)CO1	ZINC001039462641	1345081347	/nfs/dbraw/zinc/08/13/47/1345081347.db2.gz	XYEZLBPVHWTKME-CEXWTWQISA-N	0	3	346.515	3.367	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(COC)cc1	ZINC001039468549	1345086200	/nfs/dbraw/zinc/08/62/00/1345086200.db2.gz	SONYIMUASYRMGK-MOPGFXCFSA-N	0	3	328.456	3.088	20	30		EGEDHN
C[C@H](C#N)C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC1CCC(C)(C)CC1	ZINC001039529998	1345131952	/nfs/dbraw/zinc/13/19/52/1345131952.db2.gz	FTRZCGCZGVJKNG-NXHRZFHOSA-N	0	3	331.504	3.428	20	30		EGEDHN
O=C(C#CC1CC1)N1C[C@H]2CCC[C@@H](C1)N2CCC1CCCCC1	ZINC001039579099	1345145491	/nfs/dbraw/zinc/14/54/91/1345145491.db2.gz	IOMBNCOJQXANPO-BGYRXZFFSA-N	0	3	328.500	3.436	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@]3(CCN(C(=O)C4CCC4)C3)C2)cc1	ZINC001040035462	1345300750	/nfs/dbraw/zinc/30/07/50/1345300750.db2.gz	NJSOOANBXOTCHS-OAQYLSRUSA-N	0	3	337.467	3.173	20	30		EGEDHN
C=C(C)CC[N@@H+]1CCC[C@]2(CCN(C(=O)c3ccccc3[O-])C2)C1	ZINC001040083578	1345328592	/nfs/dbraw/zinc/32/85/92/1345328592.db2.gz	NXOZDJKXVSHMPE-FQEVSTJZSA-N	0	3	328.456	3.287	20	30		EGEDHN
C=C(C)CC[N@H+]1CCC[C@]2(CCN(C(=O)c3ccccc3[O-])C2)C1	ZINC001040083578	1345328595	/nfs/dbraw/zinc/32/85/95/1345328595.db2.gz	NXOZDJKXVSHMPE-FQEVSTJZSA-N	0	3	328.456	3.287	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3conc3C3CCCC3)C2)C1	ZINC001040236712	1345389141	/nfs/dbraw/zinc/38/91/41/1345389141.db2.gz	OTCVKINYUFNPCS-FQEVSTJZSA-N	0	3	343.471	3.446	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3c(C)noc3C(C)C)C2)C1	ZINC001040252182	1345395911	/nfs/dbraw/zinc/39/59/11/1345395911.db2.gz	DOXCKQCGYIJKON-LJQANCHMSA-N	0	3	331.460	3.221	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3cc(C)c4ccccc4n3)C2)C1	ZINC001040263098	1345401174	/nfs/dbraw/zinc/40/11/74/1345401174.db2.gz	XXMDBCDIGHJOLH-JOCHJYFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cc(C)n([C@H](C)CC)n3)C2)C1	ZINC001040271052	1345405879	/nfs/dbraw/zinc/40/58/79/1345405879.db2.gz	QEBNFFMSIARFHX-OXQOHEQNSA-N	0	3	344.503	3.277	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cc(C(C)(C)C)on3)C2)C1	ZINC001040292746	1345416959	/nfs/dbraw/zinc/41/69/59/1345416959.db2.gz	XOLYLPDGHAAVRO-IBGZPJMESA-N	0	3	331.460	3.086	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)CCc3cccc(C)c3)C2)C1	ZINC001040314161	1345426341	/nfs/dbraw/zinc/42/63/41/1345426341.db2.gz	AFKYQDORCLXPMK-JOCHJYFZSA-N	0	3	338.495	3.265	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cc4ccccc4n3C)C2)C1	ZINC001040355364	1345450282	/nfs/dbraw/zinc/45/02/82/1345450282.db2.gz	AXNCYRMGKDTRPN-QFIPXVFZSA-N	0	3	349.478	3.130	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3ccccc3-n3cccc3)C2)C1	ZINC001040371696	1345460367	/nfs/dbraw/zinc/46/03/67/1345460367.db2.gz	LUQDBPHVUVYEOU-QFIPXVFZSA-N	0	3	347.462	3.039	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3sc(C)cc3OC)C2)C1	ZINC001040433027	1345495591	/nfs/dbraw/zinc/49/55/91/1345495591.db2.gz	RGMOLBBFNKHVON-SFHVURJKSA-N	0	3	334.485	3.179	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)C3CC(C(C)(C)C)C3)C2)C1	ZINC001040546504	1345540980	/nfs/dbraw/zinc/54/09/80/1345540980.db2.gz	FACHPIRJBKKMPS-WIXQSORDSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)C3(C(F)(F)F)CCCC3)C2)C1	ZINC001040551222	1345543568	/nfs/dbraw/zinc/54/35/68/1345543568.db2.gz	KPMJAJWHRWRIQT-MRXNPFEDSA-N	0	3	342.405	3.057	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cc4ccccc4nc3C)C2)CC1	ZINC001040720248	1345569960	/nfs/dbraw/zinc/56/99/60/1345569960.db2.gz	BTOJQHIHBBPKFX-UHFFFAOYSA-N	0	3	347.462	3.105	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3ccccc3OC(C)C)C2)CC1	ZINC001040917714	1345599530	/nfs/dbraw/zinc/59/95/30/1345599530.db2.gz	VPWMMMDPTFSIRH-UHFFFAOYSA-N	0	3	340.467	3.035	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cc(CC(C)C)c[nH]3)C2)CC1	ZINC001040916396	1345599613	/nfs/dbraw/zinc/59/96/13/1345599613.db2.gz	BXPTZOYUBJLBHY-UHFFFAOYSA-N	0	3	341.499	3.165	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cc(CC)c(CC)o3)C2)CC1	ZINC001040916381	1345599865	/nfs/dbraw/zinc/59/98/65/1345599865.db2.gz	BMQCDQJXAUWBOR-UHFFFAOYSA-N	0	3	342.483	3.356	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)Cc3c[nH]c4ccccc34)C2)CC1	ZINC001040922570	1345600970	/nfs/dbraw/zinc/60/09/70/1345600970.db2.gz	AFDOBWKFTFJEJK-UHFFFAOYSA-N	0	3	349.478	3.048	20	30		EGEDHN
CC[C@H](C)C(=O)N1CC[C@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001041086760	1345648875	/nfs/dbraw/zinc/64/88/75/1345648875.db2.gz	IWNJJHGBCNKVCF-JXFKEZNVSA-N	0	3	325.456	3.029	20	30		EGEDHN
Cc1cc(Cl)ccc1CN1CC[C@@]2(CCN(C(=O)[C@H](C)C#N)C2)C1	ZINC001041146293	1345660581	/nfs/dbraw/zinc/66/05/81/1345660581.db2.gz	MBQXGIVLCOBRJZ-DNVCBOLYSA-N	0	3	345.874	3.233	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N1CC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001041220563	1345680967	/nfs/dbraw/zinc/68/09/67/1345680967.db2.gz	XKLBCGYLRWNUHG-GHTZIAJQSA-N	0	3	337.467	3.029	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@]3(CCN(Cc4cccc(C#N)c4)C3)C2)co1	ZINC001041236305	1345682837	/nfs/dbraw/zinc/68/28/37/1345682837.db2.gz	QQJVTWFERBRQFW-NRFANRHFSA-N	0	3	349.434	3.198	20	30		EGEDHN
C[C@H](c1ccccc1F)N1CC[C@]2(CCN(C(=O)C#CC3CC3)C2)C1	ZINC001041265574	1345689850	/nfs/dbraw/zinc/68/98/50/1345689850.db2.gz	JTHVKBFINYLVBC-IERDGZPVSA-N	0	3	340.442	3.225	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cscc3C(F)F)C2)C1	ZINC001041290303	1345695393	/nfs/dbraw/zinc/69/53/93/1345695393.db2.gz	NIDGNAYOSUSWRX-QGZVFWFLSA-N	0	3	338.423	3.247	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)C[C@@H]3C[C@H]3c3ccccc3)C2)C1	ZINC001041291650	1345695466	/nfs/dbraw/zinc/69/54/66/1345695466.db2.gz	VAEZQBFHRPYKIY-JAXLGGSGSA-N	0	3	336.479	3.128	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@]2(CCN(Cc3ccccn3)C2)C1	ZINC001041322356	1345702021	/nfs/dbraw/zinc/70/20/21/1345702021.db2.gz	PDIGRCDTOWJFPN-IBGZPJMESA-N	0	3	347.890	3.285	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3coc4c3cccc4C)C2)C1	ZINC001041363712	1345709753	/nfs/dbraw/zinc/70/97/53/1345709753.db2.gz	VIQTWVSAMSPQLB-OAQYLSRUSA-N	0	3	336.435	3.303	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cc(F)cc4ccoc43)C2)C1	ZINC001041420695	1345724505	/nfs/dbraw/zinc/72/45/05/1345724505.db2.gz	BLSHPWCONGASNT-FQEVSTJZSA-N	0	3	340.398	3.133	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)Cc3ccc(C4CCC4)cc3)C2)C1	ZINC001041518850	1345750789	/nfs/dbraw/zinc/75/07/89/1345750789.db2.gz	OHUPFZHOOCEHSK-JOCHJYFZSA-N	0	3	336.479	3.054	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)c3cc(C)c(Cl)cc3C)C2)C1	ZINC001041536513	1345755835	/nfs/dbraw/zinc/75/58/35/1345755835.db2.gz	OLZTZSBCBCXFMK-LJQANCHMSA-N	0	3	330.859	3.128	20	30		EGEDHN
Cc1coc(C(=O)N2CC[C@]3(CCN(Cc4ccc(C#N)cc4)C3)C2)c1	ZINC001041581664	1345780819	/nfs/dbraw/zinc/78/08/19/1345780819.db2.gz	LBTQFHKKRSQBKF-NRFANRHFSA-N	0	3	349.434	3.198	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)[C@H]3[C@@H]4CCCCCC[C@@H]43)C2)C1	ZINC001041708377	1345825165	/nfs/dbraw/zinc/82/51/65/1345825165.db2.gz	HQCNXCDZCVACHX-XODKDNOYSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)[C@H](C)c3ccc(Cl)s3)C2)C1	ZINC001041779895	1345847069	/nfs/dbraw/zinc/84/70/69/1345847069.db2.gz	SCWUUSFJFOIEGW-DYVFJYSZSA-N	0	3	336.888	3.063	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)[C@@H](F)CC3CCCCC3)C2)C1	ZINC001041788408	1345850277	/nfs/dbraw/zinc/85/02/77/1345850277.db2.gz	DCYFHATUUUUJTN-AZUAARDMSA-N	0	3	334.479	3.243	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)CCc3ccc(CC)cc3)C2)C1	ZINC001041822185	1345863788	/nfs/dbraw/zinc/86/37/88/1345863788.db2.gz	PEBXNJXDSSTOOW-JOCHJYFZSA-N	0	3	338.495	3.129	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)C[C@@H](C)c3ccc(F)cc3)C2)C1	ZINC001041842509	1345870299	/nfs/dbraw/zinc/87/02/99/1345870299.db2.gz	HROJUQSNMBYDSX-UTKZUKDTSA-N	0	3	342.458	3.267	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)C(C)(C)c3ccccc3C)C2)C1	ZINC001041858906	1345875363	/nfs/dbraw/zinc/87/53/63/1345875363.db2.gz	CQVRCWRJKIVIEU-JOCHJYFZSA-N	0	3	338.495	3.220	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CCN(C(=O)CC4CCC4)C[C@@H]32)cc1	ZINC001041998255	1345917747	/nfs/dbraw/zinc/91/77/47/1345917747.db2.gz	XFHFKUHRUNQFSX-UXHICEINSA-N	0	3	337.467	3.171	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)CC(C)(C)c3ccc(F)cc3)C[C@H]21	ZINC001042095508	1345942735	/nfs/dbraw/zinc/94/27/35/1345942735.db2.gz	NCABRUGSVJYWFG-VQIMIIECSA-N	0	3	342.458	3.049	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccnc(-c4ccco4)c3)C[C@@H]21	ZINC001042108876	1345946059	/nfs/dbraw/zinc/94/60/59/1345946059.db2.gz	GEYZUNTWKDUEMF-YJBOKZPZSA-N	0	3	337.423	3.064	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cccc4c(C)c(C)[nH]c43)C[C@H]21	ZINC001042114906	1345947884	/nfs/dbraw/zinc/94/78/84/1345947884.db2.gz	PSVMRWYCCSJKFW-YLJYHZDGSA-N	0	3	349.478	3.344	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cccc4c(C)c(C)[nH]c43)C[C@@H]21	ZINC001042114904	1345947998	/nfs/dbraw/zinc/94/79/98/1345947998.db2.gz	PSVMRWYCCSJKFW-PXNSSMCTSA-N	0	3	349.478	3.344	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C3CCc4ccccc4CC3)C[C@H]21	ZINC001042125307	1345950659	/nfs/dbraw/zinc/95/06/59/1345950659.db2.gz	RKWCKJJPMAKKTH-PZJWPPBQSA-N	0	3	338.495	3.290	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)Cn3c(C)cc4ccccc43)C[C@@H]21	ZINC001042140761	1345954139	/nfs/dbraw/zinc/95/41/39/1345954139.db2.gz	ANZUCTBUDNIJQL-XLIONFOSSA-N	0	3	337.467	3.059	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cnc4c(F)cccc4c3)C[C@@H]21	ZINC001042153504	1345957761	/nfs/dbraw/zinc/95/77/61/1345957761.db2.gz	SUGOZBVMSGQWKZ-KSSFIOAISA-N	0	3	339.414	3.096	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3c(C)occ3C(F)(F)F)C[C@@H]21	ZINC001042156643	1345958808	/nfs/dbraw/zinc/95/88/08/1345958808.db2.gz	JTSGCKNRGCKCHB-JSGCOSHPSA-N	0	3	342.361	3.329	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cc(C)cc(Cl)c3)C[C@@H]21	ZINC001042156455	1345958983	/nfs/dbraw/zinc/95/89/83/1345958983.db2.gz	JCSNOTGGWAQSMF-QAPCUYQASA-N	0	3	330.859	3.208	20	30		EGEDHN
CC1(CC(=O)N2CC[C@@H]3CCN(Cc4cccc(C#N)c4)[C@H]3C2)CC1	ZINC001042157119	1345959233	/nfs/dbraw/zinc/95/92/33/1345959233.db2.gz	ZMWNIRDVNTWQFE-OALUTQOASA-N	0	3	337.467	3.171	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C3(c4cccc(F)c4)CCC3)C[C@H]21	ZINC001042177556	1345968265	/nfs/dbraw/zinc/96/82/65/1345968265.db2.gz	WVORELYKXNEYIE-VQIMIIECSA-N	0	3	342.458	3.356	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CCN(Cc3cccc(OC)c3)[C@@H]2C1	ZINC001042184464	1345972131	/nfs/dbraw/zinc/97/21/31/1345972131.db2.gz	WSTGLFBCVFNBSH-IEBWSBKVSA-N	0	3	342.483	3.330	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccccc3-n3cccc3)C[C@@H]21	ZINC001042212313	1345987872	/nfs/dbraw/zinc/98/78/72/1345987872.db2.gz	BFQLWOGMEWINNW-NQIIRXRSSA-N	0	3	347.462	3.037	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3c(Cl)cncc3Cl)C[C@H]21	ZINC001042215952	1345988783	/nfs/dbraw/zinc/98/87/83/1345988783.db2.gz	JUWYFADQEDFEGU-SMDDNHRTSA-N	0	3	340.254	3.111	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3c(Cl)cncc3Cl)C[C@H]21	ZINC001042215949	1345989121	/nfs/dbraw/zinc/98/91/21/1345989121.db2.gz	JUWYFADQEDFEGU-BXUZGUMPSA-N	0	3	340.254	3.111	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C(C)(C)c3cccc(F)c3)C[C@@H]21	ZINC001042229680	1345997249	/nfs/dbraw/zinc/99/72/49/1345997249.db2.gz	HABLBEQSMYEWFW-YJBOKZPZSA-N	0	3	330.447	3.212	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc(-c4ccccc4)ccn3)C[C@@H]21	ZINC001042288525	1346018328	/nfs/dbraw/zinc/01/83/28/1346018328.db2.gz	UAMWMWBCVYZNAM-NQIIRXRSSA-N	0	3	347.462	3.471	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3cc4cccnc4s3)C[C@H]21	ZINC001042299905	1346023722	/nfs/dbraw/zinc/02/37/22/1346023722.db2.gz	SBLQLHTZKVVOBN-GOEBONIOSA-N	0	3	341.480	3.409	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cnn(C4CCCC4)c3C)C[C@H]21	ZINC001042306331	1346026274	/nfs/dbraw/zinc/02/62/74/1346026274.db2.gz	FZMHSNMYQKLKIS-QFBILLFUSA-N	0	3	342.487	3.029	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C34CC5CC(CC(C5)C3)C4)C[C@@H]21	ZINC001042325599	1346034610	/nfs/dbraw/zinc/03/46/10/1346034610.db2.gz	DQDBEJYYPSJWBE-YWPYOKSTSA-N	0	3	328.500	3.312	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3cc4cc(C)ccc4o3)C[C@H]21	ZINC001042369166	1346059841	/nfs/dbraw/zinc/05/98/41/1346059841.db2.gz	UPJOPDSGWXPJBL-SJLPKXTDSA-N	0	3	336.435	3.301	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc(CC)c(CC)c3)C[C@H]21	ZINC001042378946	1346064903	/nfs/dbraw/zinc/06/49/03/1346064903.db2.gz	CHLUVEPMOLSMMZ-TZIWHRDSSA-N	0	3	338.495	3.371	20	30		EGEDHN
C[C@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)[C@H]1C[C@H]2C[C@H]2C1	ZINC001044711764	1346408126	/nfs/dbraw/zinc/40/81/26/1346408126.db2.gz	JVLJGLUUTNATII-IGGMLHCZSA-N	0	3	337.467	3.073	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)CCC2CCC2)c(F)c1	ZINC001044980769	1346473500	/nfs/dbraw/zinc/47/35/00/1346473500.db2.gz	BEZPBUXITNQIRW-SFHVURJKSA-N	0	3	343.446	3.358	20	30		EGEDHN
N#Cc1ccc(C(=O)N2CCC[C@H]2CNCc2cc3ccccc3o2)[nH]1	ZINC001045000757	1346478648	/nfs/dbraw/zinc/47/86/48/1346478648.db2.gz	XEPZFFOBMRVYLL-INIZCTEOSA-N	0	3	348.406	3.027	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@H]2CNCc2c(C)onc2CC)CC1	ZINC001045182399	1346517581	/nfs/dbraw/zinc/51/75/81/1346517581.db2.gz	RRDBUMGMEXDKKR-KRWDZBQOSA-N	0	3	345.487	3.372	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H]1CNCc1ccc(C#N)s1	ZINC001045186103	1346522598	/nfs/dbraw/zinc/52/25/98/1346522598.db2.gz	YHQMASFUSMVIMO-KBXCAEBGSA-N	0	3	331.485	3.303	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N1CCC[C@H]1CNCc1ccc(C#N)s1	ZINC001045189646	1346523548	/nfs/dbraw/zinc/52/35/48/1346523548.db2.gz	DWCCPMWMAMOYOF-JKIFEVAISA-N	0	3	331.485	3.137	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N1CCC[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC001045190286	1346524482	/nfs/dbraw/zinc/52/44/82/1346524482.db2.gz	ZLCGXZKNGYZRLO-BPQIPLTHSA-N	0	3	343.446	3.214	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)C2(F)CCCCC2)s1	ZINC001045264162	1346542989	/nfs/dbraw/zinc/54/29/89/1346542989.db2.gz	KRWLVNYUTHPEAO-AWEZNQCLSA-N	0	3	349.475	3.373	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)C2C3CC4CC(C3)CC2C4)CC1	ZINC001045461958	1346599577	/nfs/dbraw/zinc/59/95/77/1346599577.db2.gz	SCRKJFTWARMKDB-UHFFFAOYSA-N	0	3	328.500	3.053	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2ccc(OC(C)C)cc2)CC1	ZINC001045635156	1346654588	/nfs/dbraw/zinc/65/45/88/1346654588.db2.gz	TXXJGHKDQJSRBQ-UHFFFAOYSA-N	0	3	328.456	3.081	20	30		EGEDHN
Cc1cc[nH]c1C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1cccc(C#N)c1	ZINC001045767984	1346692945	/nfs/dbraw/zinc/69/29/45/1346692945.db2.gz	OWHFCSVQTWKNRT-MOPGFXCFSA-N	0	3	348.450	3.074	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1CC[C@H]2CC[C@@H](C1)N2CC=C	ZINC001045805704	1346703649	/nfs/dbraw/zinc/70/36/49/1346703649.db2.gz	HGIWDRHYSCOCEP-SJORKVTESA-N	0	3	326.440	3.116	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]3CC[C@@H](C2)N3Cc2cccnc2C)C1	ZINC001045845230	1346719404	/nfs/dbraw/zinc/71/94/04/1346719404.db2.gz	XKHORAHOEMZVHP-MOPGFXCFSA-N	0	3	339.483	3.312	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H]1CCC(F)(F)C1)C2	ZINC001045944254	1346779994	/nfs/dbraw/zinc/77/99/94/1346779994.db2.gz	IVBYIJZTVBKSAR-SJLPKXTDSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc(Cl)cn1C)C2	ZINC001045950648	1346785618	/nfs/dbraw/zinc/78/56/18/1346785618.db2.gz	IFPWPKWXNOJJIC-LJQANCHMSA-N	0	3	347.890	3.020	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)CCc1ccc(C)cc1)C2	ZINC001045951151	1346785873	/nfs/dbraw/zinc/78/58/73/1346785873.db2.gz	VMVFWLMPWHAKIN-JOCHJYFZSA-N	0	3	338.495	3.265	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@H]1CC[C@@H](C)N(CCOCC(C)C)C1	ZINC001132079380	1375135963	/nfs/dbraw/zinc/13/59/63/1375135963.db2.gz	XOXXPAWITKKVRN-ZBFHGGJFSA-N	0	3	344.927	3.407	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H](C)c1ccco1)C2	ZINC001045965418	1346800415	/nfs/dbraw/zinc/80/04/15/1346800415.db2.gz	HAXFOJYFOZHIMN-FXAWDEMLSA-N	0	3	328.456	3.111	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@H](C)C(C)(F)F)C2	ZINC001045967646	1346801851	/nfs/dbraw/zinc/80/18/51/1346801851.db2.gz	ZCDKYEGCEFCAHH-YJBOKZPZSA-N	0	3	326.431	3.006	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)Cc1sc(C)cc1C)C2	ZINC001045981010	1346818893	/nfs/dbraw/zinc/81/88/93/1346818893.db2.gz	ANGCAPSPXAZXEY-HXUWFJFHSA-N	0	3	344.524	3.245	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc3ccccc3[nH]1)C2	ZINC001045983080	1346822428	/nfs/dbraw/zinc/82/24/28/1346822428.db2.gz	ITGQOQWLZFNEPD-OAQYLSRUSA-N	0	3	335.451	3.119	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccoc1C(C)C)C2	ZINC001045985720	1346826757	/nfs/dbraw/zinc/82/67/57/1346826757.db2.gz	AQXAILLYCOWMLA-HXUWFJFHSA-N	0	3	328.456	3.354	20	30		EGEDHN
C=CCN1CC[C@H](N2CCN(C(=O)CCC3CCCCCC3)CC2)C1	ZINC001046043335	1346831968	/nfs/dbraw/zinc/83/19/68/1346831968.db2.gz	CDODXCUHWNFJHL-FQEVSTJZSA-N	0	3	347.547	3.142	20	30		EGEDHN
C[C@]1(NC(=O)c2ccc(C#N)[nH]2)CCN(Cc2ccc(C3CC3)cc2)C1	ZINC001046247822	1346908615	/nfs/dbraw/zinc/90/86/15/1346908615.db2.gz	JRINKXUCROERTE-NRFANRHFSA-N	0	3	348.450	3.158	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@]1(C)CCN(Cc2ccc(C)cc2)C1	ZINC001046373537	1346953449	/nfs/dbraw/zinc/95/34/49/1346953449.db2.gz	DHSMBQOAPGTTNL-OAQYLSRUSA-N	0	3	337.467	3.377	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@]1(C)CCN(Cc2cccc(C)c2)C1	ZINC001046374149	1346953749	/nfs/dbraw/zinc/95/37/49/1346953749.db2.gz	LYHBVZDWFCXIOJ-NRFANRHFSA-N	0	3	337.467	3.377	20	30		EGEDHN
C#CCCN1CC[C@](C)(NC(=O)c2oc3c(cccc3F)c2C)C1	ZINC001046377429	1346955202	/nfs/dbraw/zinc/95/52/02/1346955202.db2.gz	LETMROFVTBSHIB-IBGZPJMESA-N	0	3	328.387	3.098	20	30		EGEDHN
C=CCCN1CC[C@](C)(NC(=O)c2cnc(-c3ccoc3)s2)C1	ZINC001046679323	1347060834	/nfs/dbraw/zinc/06/08/34/1347060834.db2.gz	MSQLWSVQVFQGHP-KRWDZBQOSA-N	0	3	331.441	3.173	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2ccc3nc(C)sc3c2)C1	ZINC001046749233	1347082094	/nfs/dbraw/zinc/08/20/94/1347082094.db2.gz	JKFJXMFXJOZQNP-SFHVURJKSA-N	0	3	329.469	3.375	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2ccc(N(CC)CC)cc2)C1	ZINC001046796086	1347107361	/nfs/dbraw/zinc/10/73/61/1347107361.db2.gz	ANGUWVPYCRBTLJ-HXUWFJFHSA-N	0	3	329.488	3.303	20	30		EGEDHN
C#CCCN1CC[C@@](C)(NC(=O)c2ccc(-c3cccs3)o2)C1	ZINC001046809949	1347112543	/nfs/dbraw/zinc/11/25/43/1347112543.db2.gz	HONMZOWMAQPSEG-GOSISDBHSA-N	0	3	328.437	3.226	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2cc(Cl)cc3c2OCC3)C1	ZINC001046859899	1347133661	/nfs/dbraw/zinc/13/36/61/1347133661.db2.gz	YQDOOSNCPBTVHY-SFHVURJKSA-N	0	3	334.847	3.045	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)C2CC(c3ccc(F)cc3)C2)C1	ZINC001046872861	1347140642	/nfs/dbraw/zinc/14/06/42/1347140642.db2.gz	LQVYJBUGARDUCL-UHYCVJNDSA-N	0	3	330.447	3.476	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2cc3ccccn3c2)C1	ZINC001046979661	1347175094	/nfs/dbraw/zinc/17/50/94/1347175094.db2.gz	CZESQAROSFXVPT-INIZCTEOSA-N	0	3	347.409	3.202	20	30		EGEDHN
O=C(N[C@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1ccc(Cl)cc1)C2)C1CC1	ZINC001047007637	1347183795	/nfs/dbraw/zinc/18/37/95/1347183795.db2.gz	NJWXSQDZYUFYAI-SNRMKQJTSA-N	0	3	342.870	3.071	20	30		EGEDHN
CC(C)C(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1cccc(Cl)c1)C2	ZINC001047029463	1347192050	/nfs/dbraw/zinc/19/20/50/1347192050.db2.gz	ZKMQPWOSGMRPNC-UHOSZYNNSA-N	0	3	344.886	3.317	20	30		EGEDHN
Cc1coc(C(=O)N[C@H]2C[C@H]3C[C@@H](C2)N(CC#Cc2ccccc2)C3)c1	ZINC001047129204	1347214863	/nfs/dbraw/zinc/21/48/63/1347214863.db2.gz	QSAMPQVZRVIYBT-UFYCRDLUSA-N	0	3	348.446	3.222	20	30		EGEDHN
CCC(=O)N1CCC[C@@H](C2CCN(Cc3ccc(C#N)s3)CC2)C1	ZINC001047217968	1347249244	/nfs/dbraw/zinc/24/92/44/1347249244.db2.gz	YDDJRVZDGOFZTK-MRXNPFEDSA-N	0	3	345.512	3.480	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)c3ccoc3CC)C2)CC1	ZINC001047236581	1347264440	/nfs/dbraw/zinc/26/44/40/1347264440.db2.gz	IWVZYIHDTXHREV-QGZVFWFLSA-N	0	3	328.456	3.039	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)C(C)(C)C(=C)Cl)C2)CC1	ZINC001047239766	1347265781	/nfs/dbraw/zinc/26/57/81/1347265781.db2.gz	UMHCSWFUBFBLKQ-QGZVFWFLSA-N	0	3	336.907	3.349	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)c3cc(C)sn3)C2)CC1	ZINC001047241027	1347267020	/nfs/dbraw/zinc/26/70/20/1347267020.db2.gz	MKZUPDPANQMBSB-QGZVFWFLSA-N	0	3	345.512	3.039	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)[C@H]3CCC3(C)C)C2)CC1	ZINC001047247100	1347272609	/nfs/dbraw/zinc/27/26/09/1347272609.db2.gz	AYXUCGGYUJDRQH-RBUKOAKNSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@]3(C)C[C@H]4C[C@H]4C3)C2)CC1	ZINC001047249566	1347274347	/nfs/dbraw/zinc/27/43/47/1347274347.db2.gz	BDFMRBOIAHTPFX-HUUJSLGLSA-N	0	3	328.500	3.006	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)C3CCC(F)CC3)C2)CC1	ZINC001047253610	1347277924	/nfs/dbraw/zinc/27/79/24/1347277924.db2.gz	DIJZSHNEIPFVDE-XBMUEBEBSA-N	0	3	334.479	3.099	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3ccc(CF)cc3)C2)CC1	ZINC001047266284	1347287326	/nfs/dbraw/zinc/28/73/26/1347287326.db2.gz	UYNLENZPOMMCJP-FQEVSTJZSA-N	0	3	342.458	3.354	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)C2(F)CCCC2)C1	ZINC001047887411	1347399557	/nfs/dbraw/zinc/39/95/57/1347399557.db2.gz	NNZQROJOCQMPFH-QAPCUYQASA-N	0	3	343.446	3.167	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]([C@@H](C)NCc2cc(C3CC3)no2)C1	ZINC001047933850	1347415184	/nfs/dbraw/zinc/41/51/84/1347415184.db2.gz	ZPVZSYFLEIGLJP-HIFRSBDPSA-N	0	3	331.460	3.091	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@H]([C@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001047960509	1347424641	/nfs/dbraw/zinc/42/46/41/1347424641.db2.gz	WZZMXPNXFLMBGD-HOCLYGCPSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]([C@H](C)NCc3nc(C)sc3C)C2)C1	ZINC001047965305	1347426817	/nfs/dbraw/zinc/42/68/17/1347426817.db2.gz	LXQGPWUSKRUFRJ-BBRMVZONSA-N	0	3	347.528	3.443	20	30		EGEDHN
CCC(CC)C(=O)N1C[C@@H](C)[C@@H](CNCc2ccccc2C#N)C1	ZINC001048150603	1347482106	/nfs/dbraw/zinc/48/21/06/1347482106.db2.gz	DEPAAYIBDOTZIB-BEFAXECRSA-N	0	3	327.472	3.179	20	30		EGEDHN
C[C@H]1CN(C(=O)CCC2CC2)C[C@H]1CNCc1cc(F)ccc1C#N	ZINC001048181411	1347487543	/nfs/dbraw/zinc/48/75/43/1347487543.db2.gz	DZUAGGBCIYOZNK-KBXCAEBGSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H](C)[C@@H](CNCc2csc(CC)n2)C1	ZINC001048340357	1347523240	/nfs/dbraw/zinc/52/32/40/1347523240.db2.gz	RGRSIUVVGVZTLZ-KBPBESRZSA-N	0	3	335.517	3.102	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H](C)[C@H](CNCc3cc(C4CC4)no3)C2)C1	ZINC001048375049	1347535000	/nfs/dbraw/zinc/53/50/00/1347535000.db2.gz	TYIHATHKFLHJHM-GOEBONIOSA-N	0	3	343.471	3.092	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@H]1CC[C@H](CNC(=O)C2CC2)CC1	ZINC001048593501	1347611044	/nfs/dbraw/zinc/61/10/44/1347611044.db2.gz	VDCCSNZJQYKSPJ-SHTZXODSSA-N	0	3	343.446	3.120	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CN(C(=O)C[C@H]4C=CCCC4)C[C@@H]3C2)c1	ZINC001048886716	1347676078	/nfs/dbraw/zinc/67/60/78/1347676078.db2.gz	NWOFUDVFAZLMKZ-DZFGPLHGSA-N	0	3	349.478	3.195	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1C[C@H]2CN(C[C@@H](F)CC)C[C@H]2C1	ZINC001048899235	1347680219	/nfs/dbraw/zinc/68/02/19/1347680219.db2.gz	LUQGMYZYCRWTON-BBWFWOEESA-N	0	3	346.446	3.003	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H]3CN(Cc4ccccc4F)C[C@H]3C2)CC1	ZINC001049025963	1347709257	/nfs/dbraw/zinc/70/92/57/1347709257.db2.gz	IUKNZUARKFZIAE-KDURUIRLSA-N	0	3	342.458	3.462	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1cccc(C#N)c1)C1CC1	ZINC001049404420	1347827335	/nfs/dbraw/zinc/82/73/35/1347827335.db2.gz	RKVHUHVHRXBWJF-YSSFQJQWSA-N	0	3	337.467	3.170	20	30		EGEDHN
Cc1[nH]ccc1C(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1cccc(C#N)c1	ZINC001049405693	1347828094	/nfs/dbraw/zinc/82/80/94/1347828094.db2.gz	ISJHDXFRGJKWDY-PMACEKPBSA-N	0	3	348.450	3.074	20	30		EGEDHN
Cc1cc(F)ccc1CN1CC[C@H]2[C@H]1CCCN2C(=O)C#CC1CC1	ZINC001049468474	1347863827	/nfs/dbraw/zinc/86/38/27/1347863827.db2.gz	VMLCEKYSOYBBSY-UXHICEINSA-N	0	3	340.442	3.113	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1c(C)noc1CCC	ZINC001049469219	1347864239	/nfs/dbraw/zinc/86/42/39/1347864239.db2.gz	AKMULBIXDRZHRU-HZPDHXFCSA-N	0	3	331.460	3.191	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1csc([C@H](C)OC)n1	ZINC001049472286	1347865042	/nfs/dbraw/zinc/86/50/42/1347865042.db2.gz	AVZDDNRCIMHKKB-CWRNSKLLSA-N	0	3	349.500	3.106	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccoc1C(F)(F)F	ZINC001049496998	1347878143	/nfs/dbraw/zinc/87/81/43/1347878143.db2.gz	FXFFLEPFIPRMIE-KBPBESRZSA-N	0	3	340.345	3.001	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1oc(C(F)F)cc1C	ZINC001049535738	1347896722	/nfs/dbraw/zinc/89/67/22/1347896722.db2.gz	JLKQXFIQLCMQRH-UONOGXRCSA-N	0	3	336.382	3.228	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1nccc2ccsc21	ZINC001049535819	1347896877	/nfs/dbraw/zinc/89/68/77/1347896877.db2.gz	KDEOTMRNGORJGF-CABCVRRESA-N	0	3	327.453	3.161	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@@H]2CCCN3C(=O)C2(C3CC3)CC2)cc1	ZINC001049541684	1347898817	/nfs/dbraw/zinc/89/88/17/1347898817.db2.gz	ONRHXXHHFKXETA-PMACEKPBSA-N	0	3	349.478	3.314	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cccc2c(C)c(C)[nH]c21	ZINC001049551779	1347904237	/nfs/dbraw/zinc/90/42/37/1347904237.db2.gz	IUQQDKBKITYIGX-PMACEKPBSA-N	0	3	349.478	3.487	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)COc1ccc(C(C)C)cc1	ZINC001049577345	1347918218	/nfs/dbraw/zinc/91/82/18/1347918218.db2.gz	PFNDDQPDPGZSOT-PMACEKPBSA-N	0	3	342.483	3.440	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(OC)cc1F	ZINC001049578213	1347918442	/nfs/dbraw/zinc/91/84/42/1347918442.db2.gz	UYHFUDRHBAGXJL-ROUUACIJSA-N	0	3	332.419	3.089	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1ccc(CC(C)C)cc1	ZINC001049583527	1347922130	/nfs/dbraw/zinc/92/21/30/1347922130.db2.gz	WMDDVGPCCOEMQV-RTWAWAEBSA-N	0	3	338.495	3.126	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1ccc(C(F)F)cc1	ZINC001049591161	1347925995	/nfs/dbraw/zinc/92/59/95/1347925995.db2.gz	DSCKWKSMPKPGHM-MSOLQXFVSA-N	0	3	346.421	3.255	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1c(C)onc1C1CC1	ZINC001049599488	1347930746	/nfs/dbraw/zinc/93/07/46/1347930746.db2.gz	SCAGLPJZZACMHO-HOTGVXAUSA-N	0	3	329.444	3.115	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H]1COc2cc(C)c(C)cc21	ZINC001049611250	1347935717	/nfs/dbraw/zinc/93/57/17/1347935717.db2.gz	FXPDWWUVKZEMAD-CEXWTWQISA-N	0	3	340.467	3.031	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(C)nc1C1CC1	ZINC001049627159	1347941471	/nfs/dbraw/zinc/94/14/71/1347941471.db2.gz	PXMVQGWUARNTED-QZTJIDSGSA-N	0	3	325.456	3.132	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H](c1ccncc1)C(C)C	ZINC001049673821	1347966838	/nfs/dbraw/zinc/96/68/38/1347966838.db2.gz	ZZDZRRKRDZZLJP-QRVBRYPASA-N	0	3	327.472	3.073	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ncccc1OCCC	ZINC001049688767	1347972351	/nfs/dbraw/zinc/97/23/51/1347972351.db2.gz	WXFDOOKEPSRKAZ-IAGOWNOFSA-N	0	3	343.471	3.125	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1ncccc1OCCC	ZINC001049688775	1347972555	/nfs/dbraw/zinc/97/25/55/1347972555.db2.gz	WXFDOOKEPSRKAZ-SJORKVTESA-N	0	3	343.471	3.125	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)CCc1cc(Cl)cs1	ZINC001049756425	1348003583	/nfs/dbraw/zinc/00/35/83/1348003583.db2.gz	VFSHBZIORJHTGY-HZPDHXFCSA-N	0	3	336.888	3.033	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(Cl)c(OC)c1	ZINC001049762684	1348008210	/nfs/dbraw/zinc/00/82/10/1348008210.db2.gz	RKSJKKZLLSRHRI-JKSUJKDBSA-N	0	3	334.847	3.214	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cccc(F)c1OCC	ZINC001049814908	1348033859	/nfs/dbraw/zinc/03/38/59/1348033859.db2.gz	PGGVGDRHACWPBO-SJORKVTESA-N	0	3	332.419	3.089	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1nc(C2CC2)oc1C	ZINC001049829384	1348043962	/nfs/dbraw/zinc/04/39/62/1348043962.db2.gz	SSDMXEGHBIJRMD-JKSUJKDBSA-N	0	3	329.444	3.115	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cnn(C2CCCC2)c1C	ZINC001049837476	1348050274	/nfs/dbraw/zinc/05/02/74/1348050274.db2.gz	PRYGOWGNCRJFNH-OALUTQOASA-N	0	3	342.487	3.172	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C12CC3CC(CC(C3)C1)C2	ZINC001049856671	1348064092	/nfs/dbraw/zinc/06/40/92/1348064092.db2.gz	GRNIFOUBEFCEKW-GELQRLDPSA-N	0	3	328.500	3.454	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)CCn1ccc2ccccc21	ZINC001049880666	1348086330	/nfs/dbraw/zinc/08/63/30/1348086330.db2.gz	DCZIAYPZRTVASH-LEWJYISDSA-N	0	3	349.478	3.120	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C[C@H](C)c1ccc(F)cc1	ZINC001049907225	1348104759	/nfs/dbraw/zinc/10/47/59/1348104759.db2.gz	BOKZPZSXZOZXLQ-ZYSHUDEJSA-N	0	3	328.431	3.018	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](C)Cc1ccc(C)cc1	ZINC001049914109	1348109168	/nfs/dbraw/zinc/10/91/68/1348109168.db2.gz	MSRYHCDGIMKBHS-YZGWKJHDSA-N	0	3	326.484	3.425	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H]1Cc2c1cccc2Cl	ZINC001049924108	1348115953	/nfs/dbraw/zinc/11/59/53/1348115953.db2.gz	PRZNHNSDDXTBIS-RYQLBKOJSA-N	0	3	330.859	3.231	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@]1(C)CCc2ccccc2C1	ZINC001049937848	1348123348	/nfs/dbraw/zinc/12/33/48/1348123348.db2.gz	WCVZRPYENHVGNG-TUNNFDKTSA-N	0	3	338.495	3.433	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@H]2CN(Cc3ccc(C4CC4)cc3)C[C@H]21	ZINC001050046327	1348164544	/nfs/dbraw/zinc/16/45/44/1348164544.db2.gz	WKSHGPPUXBOWLZ-FCHUYYIVSA-N	0	3	348.490	3.400	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cc(C)c(OC)c(C)c3)[C@@H]2C1	ZINC001050054451	1348166910	/nfs/dbraw/zinc/16/69/10/1348166910.db2.gz	QUGZJHDENUATCU-FUHWJXTLSA-N	0	3	328.456	3.034	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)[C@H](C)Cc3ccccc3F)[C@@H]2C1	ZINC001050138221	1348193946	/nfs/dbraw/zinc/19/39/46/1348193946.db2.gz	UDZDGSASALAHFM-HHXXYDBFSA-N	0	3	330.447	3.113	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)Cc3ccc(F)c(Cl)c3)[C@@H]2C1	ZINC001050149190	1348196761	/nfs/dbraw/zinc/19/67/61/1348196761.db2.gz	DGHLOQMEGOKMHA-WMLDXEAASA-N	0	3	336.838	3.130	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CC[C@H](CNCc3nocc3C)CC2)CC1	ZINC001050362313	1348238524	/nfs/dbraw/zinc/23/85/24/1348238524.db2.gz	KUXTXBLRHLTYES-SAABIXHNSA-N	0	3	345.487	3.494	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)Cc3ccc(C)c(Cl)c3)C2)CC1	ZINC001050560762	1348289452	/nfs/dbraw/zinc/28/94/52/1348289452.db2.gz	GQDIGPDISRRXRS-UHFFFAOYSA-N	0	3	344.886	3.139	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@@H]3CCC[C@@H]3c3ccccc3)C2)CC1	ZINC001050587232	1348294631	/nfs/dbraw/zinc/29/46/31/1348294631.db2.gz	IANXBWCBBVFYDQ-WOJBJXKFSA-N	0	3	336.479	3.128	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC3(C2)CCN(Cc2scnc2C)CC3)C1	ZINC001050657668	1348319402	/nfs/dbraw/zinc/31/94/02/1348319402.db2.gz	TUQGBFZWLALEHS-UHFFFAOYSA-N	0	3	345.512	3.232	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)C[C@H]3C[C@H](C)CC(C)(C)C3)C2)CC1	ZINC001050700191	1348330915	/nfs/dbraw/zinc/33/09/15/1348330915.db2.gz	BKJWKVVXSQUCQO-ZWKOTPCHSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)C(C)(C)c3ccccc3Cl)C2)CC1	ZINC001050733085	1348341139	/nfs/dbraw/zinc/34/11/39/1348341139.db2.gz	UHCWMCVXDONSJT-UHFFFAOYSA-N	0	3	344.886	3.175	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3c(Cl)cccc3Cl)C2)CC1	ZINC001050737762	1348343289	/nfs/dbraw/zinc/34/32/89/1348343289.db2.gz	JVJMDNOGRMIIPE-UHFFFAOYSA-N	0	3	337.250	3.165	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc4ccccc4c3)C2)CC1	ZINC001050739967	1348343852	/nfs/dbraw/zinc/34/38/52/1348343852.db2.gz	VOSUHHBJAWSKCP-UHFFFAOYSA-N	0	3	332.447	3.401	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cc(C)nc4ccccc43)C2)CC1	ZINC001050745328	1348346396	/nfs/dbraw/zinc/34/63/96/1348346396.db2.gz	LQNWMYYQDPYVMZ-UHFFFAOYSA-N	0	3	347.462	3.105	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)[C@@H](CC)c3ccc(Cl)cc3)C2)CC1	ZINC001050762191	1348351467	/nfs/dbraw/zinc/35/14/67/1348351467.db2.gz	BXYUQYOJMRRYNF-SFHVURJKSA-N	0	3	344.886	3.391	20	30		EGEDHN
C=C(C)C[N@@H+]1CCc2c(CNC(=O)c3ccccc3[O-])cccc2C1	ZINC001051278713	1348414826	/nfs/dbraw/zinc/41/48/26/1348414826.db2.gz	AWOWYFZWYBHWIB-UHFFFAOYSA-N	0	3	336.435	3.256	20	30		EGEDHN
C=C(C)C[N@H+]1CCc2c(CNC(=O)c3ccccc3[O-])cccc2C1	ZINC001051278713	1348414829	/nfs/dbraw/zinc/41/48/29/1348414829.db2.gz	AWOWYFZWYBHWIB-UHFFFAOYSA-N	0	3	336.435	3.256	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3cc[nH]c3CC)cccc2C1	ZINC001051286048	1348418910	/nfs/dbraw/zinc/41/89/10/1348418910.db2.gz	DGWVKJRVUUVLNY-UHFFFAOYSA-N	0	3	337.467	3.441	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)[C@H]3C[C@@H]3C(F)F)cccc2C1	ZINC001051287993	1348419659	/nfs/dbraw/zinc/41/96/59/1348419659.db2.gz	ISZJEYUZOTWSBC-IRXDYDNUSA-N	0	3	334.410	3.138	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3ccns3)cccc2C1	ZINC001051290310	1348420616	/nfs/dbraw/zinc/42/06/16/1348420616.db2.gz	SRIRBHUABFWKDO-UHFFFAOYSA-N	0	3	327.453	3.007	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)[C@@H]3CC[C@H]4C[C@H]4C3)cccc2C1	ZINC001051293569	1348422467	/nfs/dbraw/zinc/42/24/67/1348422467.db2.gz	WUVMIMJOMDMZTM-QKLQHJQFSA-N	0	3	336.479	3.120	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3conc3CC)cccc2C1	ZINC001051299398	1348424258	/nfs/dbraw/zinc/42/42/58/1348424258.db2.gz	IYYXTQJPAXFCJH-UHFFFAOYSA-N	0	3	339.439	3.101	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@@H]2CCCO[C@H]2c2ccccc2)C1	ZINC001079877006	1357411253	/nfs/dbraw/zinc/41/12/53/1357411253.db2.gz	HCIPUDZWSDRWTP-AFYVEPGGSA-N	0	3	342.483	3.167	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@@H]2C[C@H]2c2sccc2C)CC1	ZINC001052376519	1348534802	/nfs/dbraw/zinc/53/48/02/1348534802.db2.gz	HGNCCSOOGYHUHE-GVDBMIGSSA-N	0	3	330.497	3.154	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2cc(Cl)sc2Cl)CC1	ZINC001052444936	1348543008	/nfs/dbraw/zinc/54/30/08/1348543008.db2.gz	JNYKWWXVSMRRIX-JTQLQIEISA-N	0	3	331.268	3.272	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)C2C3CC4CC(C3)CC2C4)CC1	ZINC001052447859	1348544493	/nfs/dbraw/zinc/54/44/93/1348544493.db2.gz	NVFPOJTYUIATLP-BIKXEMDZSA-N	0	3	328.500	3.053	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@@H]2CCCC[C@H]2C(F)(F)F)CC1	ZINC001052455135	1348546317	/nfs/dbraw/zinc/54/63/17/1348546317.db2.gz	PAKYGLYBBOWYRN-BZUAXINKSA-N	0	3	344.421	3.349	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cc(C)c3ccccc3n2)CC1	ZINC001052496984	1348558517	/nfs/dbraw/zinc/55/85/17/1348558517.db2.gz	NDICYNLHYNHRRU-QGZVFWFLSA-N	0	3	335.451	3.151	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cc(C)nn2C(CC)CC)CC1	ZINC001052506319	1348561366	/nfs/dbraw/zinc/56/13/66/1348561366.db2.gz	ACGQPKFZBRNQIO-QGZVFWFLSA-N	0	3	344.503	3.160	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2scnc2C2CCCC2)CC1	ZINC001052532392	1348568272	/nfs/dbraw/zinc/56/82/72/1348568272.db2.gz	FDWJDPDZDAZUFE-HNNXBMFYSA-N	0	3	331.485	3.018	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)Cc2ccc(CC(C)C)cc2)CC1	ZINC001052539035	1348571145	/nfs/dbraw/zinc/57/11/45/1348571145.db2.gz	CRMDGSVYJHTJOD-NRFANRHFSA-N	0	3	340.511	3.422	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc(-c3ccco3)o2)CC1	ZINC001052548751	1348575420	/nfs/dbraw/zinc/57/54/20/1348575420.db2.gz	DGPIXZWYWLYJDF-HNNXBMFYSA-N	0	3	326.396	3.147	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@H]2CCc3c2cccc3Cl)CC1	ZINC001052565934	1348580771	/nfs/dbraw/zinc/58/07/71/1348580771.db2.gz	IJVONEVASZYFLD-QAPCUYQASA-N	0	3	344.886	3.364	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cc(C(C)(C)C)oc2C)CC1	ZINC001052752670	1348662657	/nfs/dbraw/zinc/66/26/57/1348662657.db2.gz	VYFCRHAFDAMKPC-MRXNPFEDSA-N	0	3	330.472	3.493	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)C(C)(C)c2cccc(Cl)c2)CC1	ZINC001052752503	1348663078	/nfs/dbraw/zinc/66/30/78/1348663078.db2.gz	UHJLAWKMYQRWIV-KRWDZBQOSA-N	0	3	332.875	3.222	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@@H]2CCCN(C/C=C\Cl)CC2)cc1	ZINC001052772660	1348673157	/nfs/dbraw/zinc/67/31/57/1348673157.db2.gz	BRYLINZWOJAALH-IAQFLPNQSA-N	0	3	346.858	3.035	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@@H](C)c2ccc(CC)cc2)CC1	ZINC001052793487	1348681395	/nfs/dbraw/zinc/68/13/95/1348681395.db2.gz	DXKMXGFXAFOGGV-PXNSSMCTSA-N	0	3	326.484	3.347	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@@]2(c3ccccc3)CC2(C)C)CC1	ZINC001052818575	1348688992	/nfs/dbraw/zinc/68/89/92/1348688992.db2.gz	UHYFMYDPLZVELV-KNQAVFIVSA-N	0	3	338.495	3.348	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2c[nH]nc2C2CCCCC2)CC1	ZINC001052855151	1348703203	/nfs/dbraw/zinc/70/32/03/1348703203.db2.gz	KPGHEYIEMGULKO-QGZVFWFLSA-N	0	3	342.487	3.065	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC001052888032	1348725392	/nfs/dbraw/zinc/72/53/92/1348725392.db2.gz	GQENYFHTCDBNRV-MRXNPFEDSA-N	0	3	338.373	3.313	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2ccc(Cl)cc2Cl)CC1	ZINC001052890198	1348726049	/nfs/dbraw/zinc/72/60/49/1348726049.db2.gz	XKINHPQIZQCUOA-ZDUSSCGKSA-N	0	3	325.239	3.211	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)C[C@H]2CCc3ccccc3C2)CC1	ZINC001052893851	1348731115	/nfs/dbraw/zinc/73/11/15/1348731115.db2.gz	FIEWDUAVKKIPIG-RXVVDRJESA-N	0	3	338.495	3.176	20	30		EGEDHN
CCC(=O)N1CCC[C@@H]([C@H]2CCCN(Cc3ccc(C#N)s3)C2)C1	ZINC001052996496	1348792987	/nfs/dbraw/zinc/79/29/87/1348792987.db2.gz	JIJNFUAMFMZPMM-JKSUJKDBSA-N	0	3	345.512	3.480	20	30		EGEDHN
CC(=O)N1CCC[C@@H]([C@H]2CCCN(Cc3ccc(C#N)c(F)c3)C2)C1	ZINC001052998336	1348795217	/nfs/dbraw/zinc/79/52/17/1348795217.db2.gz	XTJLVMBAACFAMF-RBUKOAKNSA-N	0	3	343.446	3.168	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ncccc2C)C1	ZINC001053076366	1348894222	/nfs/dbraw/zinc/89/42/22/1348894222.db2.gz	NLYICEIAYMQFIU-RBUKOAKNSA-N	0	3	339.483	3.120	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ncccc2C)C1	ZINC001053076365	1348894893	/nfs/dbraw/zinc/89/48/93/1348894893.db2.gz	NLYICEIAYMQFIU-OALUTQOASA-N	0	3	339.483	3.120	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccoc2Cl)C1	ZINC001053082111	1348903495	/nfs/dbraw/zinc/90/34/95/1348903495.db2.gz	ZBLFRROOXBYLHQ-HOCLYGCPSA-N	0	3	334.847	3.273	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(C)cc(F)c2)C1	ZINC001053098035	1348929002	/nfs/dbraw/zinc/92/90/02/1348929002.db2.gz	JHQVFYBUWQLLRC-XLIONFOSSA-N	0	3	342.458	3.474	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc(F)c(C)cc1F)C2	ZINC001054148431	1349154907	/nfs/dbraw/zinc/15/49/07/1349154907.db2.gz	NYFVPEBIUAOMLP-FQEVSTJZSA-N	0	3	346.421	3.225	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@H]1CCC=CCCC1)C2	ZINC001054152640	1349156489	/nfs/dbraw/zinc/15/64/89/1349156489.db2.gz	FVOUIPUYDCSROK-PZJWPPBQSA-N	0	3	328.500	3.461	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)C1(c3ccccc3)CCC1)C2	ZINC001054161273	1349163698	/nfs/dbraw/zinc/16/36/98/1349163698.db2.gz	ANCXOJFKFGEDSO-NRFANRHFSA-N	0	3	336.479	3.056	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@]2(CCN(Cc3oc(C)nc3C)C2)C1	ZINC001054175903	1349178147	/nfs/dbraw/zinc/17/81/47/1349178147.db2.gz	YAKACMGSOUDVRC-HXUWFJFHSA-N	0	3	345.487	3.318	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@]2(CCN(Cc3cncc(C)c3)C2)C1	ZINC001054177812	1349179679	/nfs/dbraw/zinc/17/96/79/1349179679.db2.gz	RRKWYZUEJHSHQX-OAQYLSRUSA-N	0	3	341.499	3.417	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@]3(C2)CCCN(C(=O)[C@H]2CC24CC4)C3)c1	ZINC001054204387	1349206161	/nfs/dbraw/zinc/20/61/61/1349206161.db2.gz	UNHCIIJQRYNHKZ-CTNGQTDRSA-N	0	3	349.478	3.173	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1scnc1C(C)(C)C)C2	ZINC001054210834	1349211734	/nfs/dbraw/zinc/21/17/34/1349211734.db2.gz	WNLDUCHQKPOJEB-IBGZPJMESA-N	0	3	345.512	3.002	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc3ccccc3n1CC)C2	ZINC001054245585	1349239591	/nfs/dbraw/zinc/23/95/91/1349239591.db2.gz	VZVZSNMRPISLPK-QFIPXVFZSA-N	0	3	349.478	3.223	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1c(C)cccc1F)C2	ZINC001054247687	1349243427	/nfs/dbraw/zinc/24/34/27/1349243427.db2.gz	ATYVMXCBZBWEGD-FQEVSTJZSA-N	0	3	328.431	3.086	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1c(C)cccc1F)C2	ZINC001054247688	1349243640	/nfs/dbraw/zinc/24/36/40/1349243640.db2.gz	ATYVMXCBZBWEGD-HXUWFJFHSA-N	0	3	328.431	3.086	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)C1CC(C(C)(C)C)C1)C2	ZINC001054247616	1349243867	/nfs/dbraw/zinc/24/38/67/1349243867.db2.gz	ZAQFYETUWQGDTM-WIXQSORDSA-N	0	3	330.516	3.397	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)C3CCC(O)CC3)cc2C1	ZINC001054263335	1349260781	/nfs/dbraw/zinc/26/07/81/1349260781.db2.gz	LYVRBOBQTHKHGQ-UHFFFAOYSA-N	0	3	342.483	3.136	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@@H]3CC[C@H](OC)C3)cc2C1	ZINC001054271008	1349270085	/nfs/dbraw/zinc/27/00/85/1349270085.db2.gz	FFICIIWHRCGXQO-XLIONFOSSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@@H]3CCO[C@H]3CC)cc2C1	ZINC001054275152	1349275739	/nfs/dbraw/zinc/27/57/39/1349275739.db2.gz	GEGFUVHAJLZSRE-MOPGFXCFSA-N	0	3	328.456	3.010	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@@H]3CCOC[C@@H]3C)cc2C1	ZINC001054280891	1349282594	/nfs/dbraw/zinc/28/25/94/1349282594.db2.gz	VYHCAZMDDDPZAV-OXJNMPFZSA-N	0	3	342.483	3.257	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)cc2C1	ZINC001054282486	1349283364	/nfs/dbraw/zinc/28/33/64/1349283364.db2.gz	HJDRJEXNUXIOBH-AQNXPRMDSA-N	0	3	340.467	3.152	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@H]3CCO[C@H](C)C3)cc2C1	ZINC001054286719	1349288931	/nfs/dbraw/zinc/28/89/31/1349288931.db2.gz	OHYHQOIDQAPENV-WBVHZDCISA-N	0	3	328.456	3.010	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCC2CCC2)C[C@H]1NCc1ccc(C#N)c(F)c1	ZINC001054523055	1349382381	/nfs/dbraw/zinc/38/23/81/1349382381.db2.gz	CESLPIHZYYURQP-AUUYWEPGSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H](NCc2c(C)nsc2C)[C@@H](C)C1	ZINC001054970799	1349531537	/nfs/dbraw/zinc/53/15/37/1349531537.db2.gz	ISAABGRLPLQRCV-LRDDRELGSA-N	0	3	335.517	3.299	20	30		EGEDHN
C[C@H]1CN(C(=O)CC2CC(C)(C)C2)C[C@@H]1NCc1ccc(C#N)s1	ZINC001055001383	1349546217	/nfs/dbraw/zinc/54/62/17/1349546217.db2.gz	HEGZMQZIWKSRRX-GUYCJALGSA-N	0	3	345.512	3.383	20	30		EGEDHN
C#CCCN1C[C@@H](C)[C@H](NC(=O)c2cc3cc(Cl)ccc3o2)C1	ZINC001080072745	1357475371	/nfs/dbraw/zinc/47/53/71/1357475371.db2.gz	ODLLYOSIMPLFEN-IUODEOHRSA-N	0	3	330.815	3.160	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CN(Cc3cccc(C)c3)C[C@H]2C)cc1	ZINC001080244706	1357535662	/nfs/dbraw/zinc/53/56/62/1357535662.db2.gz	HULBRXYAQWMKPG-DYESRHJHSA-N	0	3	332.447	3.227	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2ccc(F)c3ccncc23)C1	ZINC001080307755	1357566683	/nfs/dbraw/zinc/56/66/83/1357566683.db2.gz	JUCNJLWSBJHGBN-FZKQIMNGSA-N	0	3	327.403	3.000	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)c3ccc(N(C)C(C)C)cc3)[C@@H]2C1	ZINC001084865620	1358334520	/nfs/dbraw/zinc/33/45/20/1358334520.db2.gz	HQHLEFXBVXHEDK-UYAOXDASSA-N	0	3	341.499	3.254	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)c2ccoc2C(C)C)C1	ZINC001070435507	1354348240	/nfs/dbraw/zinc/34/82/40/1354348240.db2.gz	IQFWQBNDGSROBP-AWEZNQCLSA-N	0	3	342.443	3.031	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)[C@H]2CCCCC2(C)C)C1	ZINC001070435642	1354348657	/nfs/dbraw/zinc/34/86/57/1354348657.db2.gz	MSWGXXSKHJRTQT-NVXWUHKLSA-N	0	3	344.503	3.218	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1cc(C)sc1C)C[C@@H](C)O2	ZINC001071185357	1354491654	/nfs/dbraw/zinc/49/16/54/1354491654.db2.gz	FCOAKMCIQXCEAA-KUHUBIRLSA-N	0	3	348.512	3.246	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)CN(C(=O)CC1(C)CCCCC1)C[C@H](C)O2	ZINC001071190167	1354495060	/nfs/dbraw/zinc/49/50/60/1354495060.db2.gz	VFJPKQPSQNBSJC-GHTZIAJQSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1oc(CC)cc1C)C[C@H](C)O2	ZINC001071227622	1354514238	/nfs/dbraw/zinc/51/42/38/1354514238.db2.gz	ICPAXTMAMAYGNT-JXFKEZNVSA-N	0	3	346.471	3.032	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1ccc(Cl)cc1)C[C@H](C)O2	ZINC001071234406	1354517899	/nfs/dbraw/zinc/51/78/99/1354517899.db2.gz	YRZFMFFJSRCNHD-HNAYVOBHSA-N	0	3	348.874	3.222	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cnn(CC(C)C)c2CC)CC[C@H]1C	ZINC001071501216	1354729714	/nfs/dbraw/zinc/72/97/14/1354729714.db2.gz	LQRBFMUISFNVFZ-IAGOWNOFSA-N	0	3	346.519	3.260	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc3ccccc3c(=O)[nH]2)CC[C@H]1C	ZINC001071567746	1354766730	/nfs/dbraw/zinc/76/67/30/1354766730.db2.gz	BVZDGEHCZWWRLS-ZBFHGGJFSA-N	0	3	339.439	3.099	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2oc3c(cccc3F)c2C)CC[C@@H]1C	ZINC001071568343	1354768180	/nfs/dbraw/zinc/76/81/80/1354768180.db2.gz	MLIPIZZQFCYKHI-DZGCQCFKSA-N	0	3	342.414	3.486	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2sc3nccn3c2C)CC[C@H]1C	ZINC001071574287	1354772485	/nfs/dbraw/zinc/77/24/85/1354772485.db2.gz	MXSGONOCYQUWDI-HIFRSBDPSA-N	0	3	346.500	3.253	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccccc2-c2ccncc2)CC[C@@H]1C	ZINC001071607646	1354793016	/nfs/dbraw/zinc/79/30/16/1354793016.db2.gz	RAGQVDNYXIPSMH-PKOBYXMFSA-N	0	3	347.462	3.355	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2cccc3cnccc32)CC[C@H]1C	ZINC001071609050	1354794337	/nfs/dbraw/zinc/79/43/37/1354794337.db2.gz	GLULCHSLAPJZCH-VQIMIIECSA-N	0	3	337.467	3.323	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2csc(C(F)(F)F)c2)CC[C@H]1C	ZINC001071645882	1354824101	/nfs/dbraw/zinc/82/41/01/1354824101.db2.gz	ORBLECUWHVILDU-YPMHNXCESA-N	0	3	344.402	3.373	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2cccc3ncccc23)CC[C@H]1C	ZINC001071677153	1354845196	/nfs/dbraw/zinc/84/51/96/1354845196.db2.gz	RLYFMLGYUCUWTM-SJLPKXTDSA-N	0	3	337.467	3.323	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc3ccc(OC)cc3[nH]2)CC[C@@H]1C	ZINC001071728473	1354883539	/nfs/dbraw/zinc/88/35/39/1354883539.db2.gz	NGPKOCBQBRCFEL-HOCLYGCPSA-N	0	3	341.455	3.335	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2nsc3ccc(C)cc32)CC[C@@H]1C	ZINC001071742646	1354893634	/nfs/dbraw/zinc/89/36/34/1354893634.db2.gz	RWXNREGUSUEHCG-LSDHHAIUSA-N	0	3	341.480	3.211	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cncc3sccc32)CC[C@H]1C	ZINC001071765718	1354912962	/nfs/dbraw/zinc/91/29/62/1354912962.db2.gz	JWOQANZCQJIDBN-ZIAGYGMSSA-N	0	3	329.469	3.455	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2csc(-c3ccco3)n2)CC[C@@H]1C	ZINC001071775437	1354921802	/nfs/dbraw/zinc/92/18/02/1354921802.db2.gz	CFXGIMVLRQGDSA-UONOGXRCSA-N	0	3	343.452	3.009	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)Cc2c[nH]c3ccc(F)cc23)CC[C@@H]1C	ZINC001071843766	1354973731	/nfs/dbraw/zinc/97/37/31/1354973731.db2.gz	AMNHCMGIJSJZJW-XJKSGUPXSA-N	0	3	329.419	3.005	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)Cc2cccc(OCCC)c2)CC[C@H]1C	ZINC001071969683	1355051071	/nfs/dbraw/zinc/05/10/71/1355051071.db2.gz	AUHDYPVJPROULQ-AEFFLSMTSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc3c(C)cccn3c2)CC[C@@H]1C	ZINC001071988880	1355061152	/nfs/dbraw/zinc/06/11/52/1355061152.db2.gz	MGUMQXSUEKVROL-FUHWJXTLSA-N	0	3	325.456	3.407	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@@H](NCc3cc(C)ccc3F)C2)CCC1	ZINC001183185953	1387274389	/nfs/dbraw/zinc/27/43/89/1387274389.db2.gz	YLBKAORZCVNVNQ-QGZVFWFLSA-N	0	3	328.431	3.018	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccsc2C(F)(F)F)CC[C@@H]1C	ZINC001072026104	1355087335	/nfs/dbraw/zinc/08/73/35/1355087335.db2.gz	CMWDBEGYLYIEAF-NWDGAFQWSA-N	0	3	344.402	3.373	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)Cc2ccc3c(c2)CCCC3)CC[C@@H]1C	ZINC001072065312	1355110257	/nfs/dbraw/zinc/11/02/57/1355110257.db2.gz	BYHDVWZJZWLBTG-JXFKEZNVSA-N	0	3	326.484	3.263	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc3c(cccc3OC)[nH]2)CC[C@H]1C	ZINC001072070963	1355112042	/nfs/dbraw/zinc/11/20/42/1355112042.db2.gz	UGOQLBDYTZTTGN-CABCVRRESA-N	0	3	341.455	3.335	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(OC3CCC3)cc2)CC[C@@H]1C	ZINC001072095684	1355126888	/nfs/dbraw/zinc/12/68/88/1355126888.db2.gz	MTPYDDFPCKZMJM-FUHWJXTLSA-N	0	3	340.467	3.224	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2cc3ccccc3n2C)CC[C@H]1C	ZINC001072101277	1355130472	/nfs/dbraw/zinc/13/04/72/1355130472.db2.gz	FOUKCVMTSODZOL-SJLPKXTDSA-N	0	3	339.483	3.266	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cccc3oc(C)nc32)CC[C@@H]1C	ZINC001072101040	1355130485	/nfs/dbraw/zinc/13/04/85/1355130485.db2.gz	CJNAUVSLOULSRT-DZGCQCFKSA-N	0	3	327.428	3.295	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1csc2cncn21	ZINC001089704274	1360607622	/nfs/dbraw/zinc/60/76/22/1360607622.db2.gz	UTFPLWKWXWRGCI-CQSZACIVSA-N	0	3	346.500	3.192	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)C23CC(C(F)(F)F)(C2)C3)CC[C@H]1C	ZINC001072102093	1355131135	/nfs/dbraw/zinc/13/11/35/1355131135.db2.gz	MRBWVLSGJHSIDP-SQHUISNBSA-N	0	3	330.394	3.264	20	30		EGEDHN
C/C=C(\C)C(=O)N1CC[C@H](C)[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001072240892	1355200941	/nfs/dbraw/zinc/20/09/41/1355200941.db2.gz	ONVNKNYKAJGGKP-ZGTQULCZSA-N	0	3	343.446	3.238	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)CC4CCCC4)C3)C2)c1	ZINC001072416727	1355280274	/nfs/dbraw/zinc/28/02/74/1355280274.db2.gz	WSFVRUCXDDFUOX-UHFFFAOYSA-N	0	3	337.467	3.173	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CN(C(=O)[C@@H]4CCC[C@H]5C[C@H]54)C3)C2)cc1	ZINC001072875051	1355477685	/nfs/dbraw/zinc/47/76/85/1355477685.db2.gz	KCWMUGRCXGLXJS-XUVXKRRUSA-N	0	3	349.478	3.029	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3ccc(O[C@@H](C)CC)cc3)C2)C1	ZINC001073106294	1355600749	/nfs/dbraw/zinc/60/07/49/1355600749.db2.gz	WZNZBNHJNNFNFH-INIZCTEOSA-N	0	3	328.456	3.198	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C3(C(F)(F)F)CCCCC3)C2)C1	ZINC001073480123	1355814335	/nfs/dbraw/zinc/81/43/35/1355814335.db2.gz	FPCIYGZZAVNQQH-UHFFFAOYSA-N	0	3	342.405	3.057	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2ccc(Cl)c(C)c2)C1	ZINC001073753086	1355889305	/nfs/dbraw/zinc/88/93/05/1355889305.db2.gz	NKJADMNYSAALEP-INIZCTEOSA-N	0	3	336.863	3.045	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2ccc(C(C)C)cc2)C1	ZINC001073865748	1355925676	/nfs/dbraw/zinc/92/56/76/1355925676.db2.gz	MQAZPLIXUPRVGF-IBGZPJMESA-N	0	3	330.472	3.207	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2ccc(CC(C)C)cc2)C1	ZINC001073880821	1355937394	/nfs/dbraw/zinc/93/73/94/1355937394.db2.gz	UOMCNGNZHPPWEB-HXUWFJFHSA-N	0	3	344.499	3.282	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2cc3cccc(C)c3o2)C1	ZINC001073902001	1355946508	/nfs/dbraw/zinc/94/65/08/1355946508.db2.gz	NPWNTBNEDPACKE-QGZVFWFLSA-N	0	3	342.439	3.138	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC[C@H](NCc2cccc(Cl)c2Cl)[C@@H]1C	ZINC001074568528	1356210097	/nfs/dbraw/zinc/21/00/97/1356210097.db2.gz	RAYQCGCLIBARLC-MJVIPROJSA-N	0	3	340.254	3.232	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@H](CC)OC3CCCCC3)[C@@H]2C1	ZINC001075787642	1356422319	/nfs/dbraw/zinc/42/23/19/1356422319.db2.gz	TYMQMIYGFDXQKV-UHOSZYNNSA-N	0	3	334.504	3.223	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3cc(Cl)sc3Cl)[C@@H]2C1	ZINC001075882489	1356438148	/nfs/dbraw/zinc/43/81/48/1356438148.db2.gz	NONCMCPVUFDBJF-CMPLNLGQSA-N	0	3	343.279	3.225	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)C3C4CC5CC(C4)CC3C5)[C@@H]2C1	ZINC001075886208	1356440149	/nfs/dbraw/zinc/44/01/49/1356440149.db2.gz	HVNKLJXGBWZCHG-XOMCCCRZSA-N	0	3	328.500	3.168	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc3nc(C)ccc3c1)C2	ZINC001098082167	1363217720	/nfs/dbraw/zinc/21/77/20/1363217720.db2.gz	DCOWVWRFOJALMS-RLLQIKCJSA-N	0	3	335.451	3.454	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)Cc3ccc(CC(C)C)cc3)[C@@H]2C1	ZINC001076007075	1356464952	/nfs/dbraw/zinc/46/49/52/1356464952.db2.gz	GOPUSKCCBDECFH-VQTJNVASSA-N	0	3	326.484	3.146	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cc(-c4cccs4)on3)[C@@H]2C1	ZINC001076100389	1356489766	/nfs/dbraw/zinc/48/97/66/1356489766.db2.gz	GLXAIGPJIZKYPV-DZGCQCFKSA-N	0	3	343.452	3.126	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)[C@H](CC)Cc3cccc(C)c3)[C@@H]2C1	ZINC001076328083	1356548553	/nfs/dbraw/zinc/54/85/53/1356548553.db2.gz	DLTGLIFHXAWDHE-HSALFYBXSA-N	0	3	326.484	3.282	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@H]3Cc4ccc(Cl)cc43)[C@@H]2C1	ZINC001076515181	1356600239	/nfs/dbraw/zinc/60/02/39/1356600239.db2.gz	WHOKKNCOARTHAV-JCGIZDLHSA-N	0	3	330.859	3.089	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@@H](NC(=O)CC2CCC2)C12CCC2	ZINC001078585057	1357019571	/nfs/dbraw/zinc/01/95/71/1357019571.db2.gz	AMOMUSQNKMBQJE-ZIAGYGMSSA-N	0	3	341.293	3.102	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2occ3c2CCC3)C12CCC2	ZINC001078688614	1357054120	/nfs/dbraw/zinc/05/41/20/1357054120.db2.gz	SINAGPJCNRKNRU-CABCVRRESA-N	0	3	334.847	3.151	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2occ3c2CCC3)C12CCC2	ZINC001078688617	1357054464	/nfs/dbraw/zinc/05/44/64/1357054464.db2.gz	SINAGPJCNRKNRU-LSDHHAIUSA-N	0	3	334.847	3.151	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2C[C@@H](NCC(=C)Cl)C23CCC3)cc1	ZINC001078698714	1357060181	/nfs/dbraw/zinc/06/01/81/1357060181.db2.gz	UOVDZTWWVGCTEP-IAGOWNOFSA-N	0	3	328.843	3.051	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2coc(C3CCC3)n2)C12CCC2	ZINC001078773544	1357077943	/nfs/dbraw/zinc/07/79/43/1357077943.db2.gz	JDLXALTZQILDKS-LSDHHAIUSA-N	0	3	349.862	3.325	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2ccc(N(C)CCC)cc2)C1	ZINC001081046775	1357797457	/nfs/dbraw/zinc/79/74/57/1357797457.db2.gz	UBZJCBAWPZMWLJ-VQIMIIECSA-N	0	3	329.488	3.159	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)C2CC(c3ccc(F)cc3)C2)C1	ZINC001081048713	1357799477	/nfs/dbraw/zinc/79/94/77/1357799477.db2.gz	KFJUQCUBWJUCSO-FOSZKXBFSA-N	0	3	330.447	3.332	20	30		EGEDHN
CCCCCCCCOCC(=O)N1CC[C@@H](NC/C=C\Cl)C1	ZINC001183296245	1387293169	/nfs/dbraw/zinc/29/31/69/1387293169.db2.gz	YWKRZFNVNIAPIL-SIJIIQCFSA-N	0	3	330.900	3.307	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2c(C)cccc2C)C[C@H]1c1ccccc1	ZINC001081187365	1357848211	/nfs/dbraw/zinc/84/82/11/1357848211.db2.gz	CKTQJWLYFUMNKW-VQTJNVASSA-N	0	3	332.447	3.134	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CN([C@H](CC)c3ccccc3)C[C@H]2OC)C1	ZINC001082106481	1357947355	/nfs/dbraw/zinc/94/73/55/1357947355.db2.gz	SLYLGWGFGUMMCH-GUDVDZBRSA-N	0	3	342.483	3.309	20	30		EGEDHN
C[C@H](C#N)C(=O)N1C[C@@H](C)[C@H](NCc2cccc(Cl)c2Cl)C1	ZINC001082450698	1358039994	/nfs/dbraw/zinc/03/99/94/1358039994.db2.gz	DWTHZECYJITNQJ-JTNHKYCSSA-N	0	3	340.254	3.090	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H](C)[C@H](NCc2cccc(Cl)n2)C1	ZINC001082721838	1358080060	/nfs/dbraw/zinc/08/00/60/1358080060.db2.gz	MDURFWWNYPIOOJ-DDUZABMNSA-N	0	3	335.879	3.274	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H](C)[C@H](NCc2cccc(OCC)n2)C1	ZINC001082721837	1358080246	/nfs/dbraw/zinc/08/02/46/1358080246.db2.gz	MCGXHMXLCKGFPZ-WRWLIDTKSA-N	0	3	345.487	3.019	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CN([C@@H](CC)c3ccccc3)C[C@@H]2O)CC1	ZINC001083751158	1358134539	/nfs/dbraw/zinc/13/45/39/1358134539.db2.gz	IWFNNKBJALWAHT-AABGKKOBSA-N	0	3	342.483	3.045	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3sc(Cl)nc3C)[C@@H]2C1	ZINC001084375392	1358204012	/nfs/dbraw/zinc/20/40/12/1358204012.db2.gz	HXRVTPPCIVMQEJ-CHWSQXEVSA-N	0	3	339.892	3.217	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2C[C@H]3CCN(CC=C(C)C)C[C@H]32)cc1	ZINC001084459942	1358219476	/nfs/dbraw/zinc/21/94/76/1358219476.db2.gz	CAINPMZSDMHWOV-UYAOXDASSA-N	0	3	340.467	3.364	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3sc(C)nc3CC(C)C)[C@@H]2C1	ZINC001084489830	1358223665	/nfs/dbraw/zinc/22/36/65/1358223665.db2.gz	CJVXXFSKWGOOTM-NVXWUHKLSA-N	0	3	347.528	3.372	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)C[C@@H]3C[C@H]3Cc3ccccc3)[C@@H]2C1	ZINC001084539059	1358233733	/nfs/dbraw/zinc/23/37/33/1358233733.db2.gz	DODMYKLWNULOIU-MXEMCNAFSA-N	0	3	338.495	3.364	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3csc(C(C)(C)C)n3)[C@@H]2C1	ZINC001084721126	1358291618	/nfs/dbraw/zinc/29/16/18/1358291618.db2.gz	ZCEJTEYTLNNFLH-UKRRQHHQSA-N	0	3	333.501	3.163	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)Cc3ccc4ccccc4c3)[C@@H]2C1	ZINC001084820907	1358320660	/nfs/dbraw/zinc/32/06/60/1358320660.db2.gz	VCKZBRZIHGIZHO-NHCUHLMSSA-N	0	3	334.463	3.491	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C[C@@H]3C[C@H]3c3ccccc3)C[C@@H]21	ZINC001084941858	1358352342	/nfs/dbraw/zinc/35/23/42/1358352342.db2.gz	JTHOGGOOUKKDIB-ANULTFPQSA-N	0	3	336.479	3.126	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@@H](c3ccccc3)C(C)C)C[C@@H]21	ZINC001085043850	1358375052	/nfs/dbraw/zinc/37/50/52/1358375052.db2.gz	GXHJJWCJCVFSML-HLAWJBBLSA-N	0	3	338.495	3.372	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C[C@@H](C)c3ccc(F)cc3)C[C@@H]21	ZINC001085099237	1358390656	/nfs/dbraw/zinc/39/06/56/1358390656.db2.gz	KBNKTUFCFVDQHT-POAQFYNOSA-N	0	3	342.458	3.265	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@H](C)Cc3ccc(C)cc3)C[C@@H]21	ZINC001085102611	1358391526	/nfs/dbraw/zinc/39/15/26/1358391526.db2.gz	MSEJDAOCRNGLMX-NRSPTQNISA-N	0	3	338.495	3.120	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@@]3(C)CCC(C)=C(C)C3)C[C@@H]21	ZINC001085104302	1358392714	/nfs/dbraw/zinc/39/27/14/1358392714.db2.gz	XASWUNULCDCVJV-DYXWJJEUSA-N	0	3	328.500	3.459	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@@H]2CCCC[C@H]2NC(=O)CC2CC2)c1	ZINC001085115928	1358396949	/nfs/dbraw/zinc/39/69/49/1358396949.db2.gz	NUJNJCAABFNYPE-QZTJIDSGSA-N	0	3	329.419	3.014	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCCC[C@H]2NCc2ccccn2)CC1	ZINC001085321019	1358464850	/nfs/dbraw/zinc/46/48/50/1358464850.db2.gz	BOZQSMKBDZADIH-RTBURBONSA-N	0	3	327.472	3.345	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccc2c(c1)C[C@@H](C)O2	ZINC001085364900	1358479286	/nfs/dbraw/zinc/47/92/86/1358479286.db2.gz	YCBXJKCCSGTCSW-KBRIMQKVSA-N	0	3	348.874	3.393	20	30		EGEDHN
C=CCOc1cccnc1C(=O)N[C@@H]1CCCC[C@H]1NCC(=C)Cl	ZINC001085389194	1358486025	/nfs/dbraw/zinc/48/60/25/1358486025.db2.gz	XPSVFROJQWDSOD-HUUCEWRRSA-N	0	3	349.862	3.030	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)Cc1ccccc1OC	ZINC001085415201	1358494040	/nfs/dbraw/zinc/49/40/40/1358494040.db2.gz	IPLOBMJAAXZEFD-HZPDHXFCSA-N	0	3	336.863	3.007	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cccc([C@H]2CCOC2)c1	ZINC001085682127	1358683945	/nfs/dbraw/zinc/68/39/45/1358683945.db2.gz	NTCBOMCTCHLIBG-PMACEKPBSA-N	0	3	342.483	3.303	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1[nH]nc(C2CC2)c1Cl	ZINC001085694470	1358690406	/nfs/dbraw/zinc/69/04/06/1358690406.db2.gz	GZAREYPHWLVTPZ-ZDUSSCGKSA-N	0	3	336.867	3.053	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cccc2c1O[C@H](C)C2	ZINC001085729734	1358718043	/nfs/dbraw/zinc/71/80/43/1358718043.db2.gz	FRXOALXSRJVUDE-NVXWUHKLSA-N	0	3	328.456	3.123	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc2cc(F)ccc2[nH]1	ZINC001085753253	1358734532	/nfs/dbraw/zinc/73/45/32/1358734532.db2.gz	BQKFLBQRLNLZIN-MRXNPFEDSA-N	0	3	329.419	3.420	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@@H]1OCC[C@@H]1c1ccccc1	ZINC001085870315	1358835252	/nfs/dbraw/zinc/83/52/52/1358835252.db2.gz	QAKNMFVLNZHGQM-XUVXKRRUSA-N	0	3	342.483	3.058	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccncc1C(F)(F)F	ZINC001085905661	1358864266	/nfs/dbraw/zinc/86/42/66/1358864266.db2.gz	MPHXHHWWQPIPBZ-CYBMUJFWSA-N	0	3	341.377	3.213	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1coc(-c2ccccc2)n1	ZINC001085930153	1358887358	/nfs/dbraw/zinc/88/73/58/1358887358.db2.gz	PMMCKZSJFDGIQL-QGZVFWFLSA-N	0	3	339.439	3.454	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C[C@@H]2CCN2[C@H](CC)c2ccccc2)cn1	ZINC001085933932	1358888902	/nfs/dbraw/zinc/88/89/02/1358888902.db2.gz	NNVNNCHJURBMNV-LEWJYISDSA-N	0	3	347.462	3.361	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1ccsc1C(F)(F)F	ZINC001085944171	1358903413	/nfs/dbraw/zinc/90/34/13/1358903413.db2.gz	BCBLHZIZZFFEFO-NSHDSACASA-N	0	3	332.391	3.489	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc(F)c(C)cc2F)C1	ZINC001086113528	1359000022	/nfs/dbraw/zinc/00/00/22/1359000022.db2.gz	CSPNYRNDZIQWHI-TXEJJXNPSA-N	0	3	328.790	3.124	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)C2CCC(=C)CC2)C1	ZINC001086187017	1359020981	/nfs/dbraw/zinc/02/09/81/1359020981.db2.gz	BPRYLAPNAJOVRT-OTVXOJSOSA-N	0	3	341.293	3.126	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc(F)cc(Cl)c2)C1	ZINC001086208125	1359026887	/nfs/dbraw/zinc/02/68/87/1359026887.db2.gz	AMNGCOAJHPGEKL-WJONMLJTSA-N	0	3	331.218	3.330	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2scnc2C(C)(C)C)C1	ZINC001086219751	1359031090	/nfs/dbraw/zinc/03/10/90/1359031090.db2.gz	QDRHKEUMELUTPE-TXEJJXNPSA-N	0	3	341.908	3.291	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)c2csc(C)c2)C1	ZINC001086225249	1359032631	/nfs/dbraw/zinc/03/26/31/1359032631.db2.gz	KKEJUFUFTDVTQE-BJHJDKERSA-N	0	3	343.290	3.063	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cccc3c2ccn3C)C1	ZINC001086226363	1359032862	/nfs/dbraw/zinc/03/28/62/1359032862.db2.gz	PEBSLQRCLXHEGV-OKILXGFUSA-N	0	3	331.847	3.029	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2coc(C3CCCC3)n2)C1	ZINC001086237766	1359035833	/nfs/dbraw/zinc/03/58/33/1359035833.db2.gz	QIDZDTLUPKDOQT-XBXGTLAGSA-N	0	3	337.851	3.183	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cccc3cnccc32)C1	ZINC001086272706	1359049983	/nfs/dbraw/zinc/04/99/83/1359049983.db2.gz	WEEORFZKYVCKPE-OTVXOJSOSA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)C2C(C)(C)C2(C)C)C1	ZINC001086335127	1359069546	/nfs/dbraw/zinc/06/95/46/1359069546.db2.gz	CNKZYBGEUKNWHD-HAQNSBGRSA-N	0	3	343.309	3.062	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc3ccccc3nc2C)C1	ZINC001086380284	1359083479	/nfs/dbraw/zinc/08/34/79/1359083479.db2.gz	ONHYLKGBMONITR-KOMQPUFPSA-N	0	3	343.858	3.394	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc(F)cc(Cl)c2)C1	ZINC001086487479	1359115826	/nfs/dbraw/zinc/11/58/26/1359115826.db2.gz	AMNGCOAJHPGEKL-YPFXGUDJSA-N	0	3	331.218	3.330	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cccc(F)c2OCC)C1	ZINC001086516525	1359125828	/nfs/dbraw/zinc/12/58/28/1359125828.db2.gz	TWUMFVFVBDWPBS-JOCQHMNTSA-N	0	3	340.826	3.075	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@@H]2C[C@]23CCc2ccccc23)C1	ZINC001086522498	1359130476	/nfs/dbraw/zinc/13/04/76/1359130476.db2.gz	XLZJUZYHOYWJPA-QQDKQVRDSA-N	0	3	344.886	3.127	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@H]2C[C@]23CCc2ccccc23)C1	ZINC001086522496	1359130822	/nfs/dbraw/zinc/13/08/22/1359130822.db2.gz	XLZJUZYHOYWJPA-ODZKNYGOSA-N	0	3	344.886	3.127	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc3ccn(C)c3c2)C1	ZINC001086524806	1359131958	/nfs/dbraw/zinc/13/19/58/1359131958.db2.gz	LQIOLPTULCOFMW-SAZUREKKSA-N	0	3	331.847	3.029	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cc(C)c(CC)s2)C1	ZINC001086547948	1359141626	/nfs/dbraw/zinc/14/16/26/1359141626.db2.gz	MTIXRAYSFUQNCD-JOCQHMNTSA-N	0	3	326.893	3.469	20	30		EGEDHN
C=CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)C2(F)CCCC2)C1	ZINC001086595951	1359159572	/nfs/dbraw/zinc/15/95/72/1359159572.db2.gz	CRFCDZMMOHECSC-ZWKOTPCHSA-N	0	3	330.447	3.429	20	30		EGEDHN
C=C(C)CN1C[C@@H](c2ccccc2)[C@H](NC(=O)Cc2cncc(C)c2)C1	ZINC001086601211	1359160570	/nfs/dbraw/zinc/16/05/70/1359160570.db2.gz	LEGXEEHUPOGHNW-LEWJYISDSA-N	0	3	349.478	3.093	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)[C@@H]2C[C@H]2C2CCC2)C1	ZINC001086614100	1359164478	/nfs/dbraw/zinc/16/44/78/1359164478.db2.gz	COZSISREQJHVTH-JSXRDJHFSA-N	0	3	336.479	3.030	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CC[C@H](CNC(=O)C2CCCC2)C1	ZINC001086630268	1359170654	/nfs/dbraw/zinc/17/06/54/1359170654.db2.gz	RSRDWTDRKHDMAN-HNAYVOBHSA-N	0	3	325.456	3.123	20	30		EGEDHN
C=C(Br)CN[C@@H]1CC[C@H](CNC(=O)c2ccccc2)C1	ZINC001086633894	1359171978	/nfs/dbraw/zinc/17/19/78/1359171978.db2.gz	PHRZWVPRJFNUKH-DZGCQCFKSA-N	0	3	337.261	3.083	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cc3c(o2)CCCC3)C1	ZINC001086715342	1359190643	/nfs/dbraw/zinc/19/06/43/1359190643.db2.gz	ZXQSHCAKNYLHEV-DZGCQCFKSA-N	0	3	336.863	3.399	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cnoc2-c2ccco2)C1	ZINC001086736629	1359193487	/nfs/dbraw/zinc/19/34/87/1359193487.db2.gz	XLEVIWJAZKDLNE-QWHCGFSZSA-N	0	3	349.818	3.175	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccnc3ccccc32)C1	ZINC001086749459	1359194626	/nfs/dbraw/zinc/19/46/26/1359194626.db2.gz	BPWKCUBZYIIIJJ-LSDHHAIUSA-N	0	3	343.858	3.475	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2c(F)ccc(F)c2F)C1	ZINC001086790443	1359202202	/nfs/dbraw/zinc/20/22/02/1359202202.db2.gz	OUTWFJLBLAYECG-WDEREUQCSA-N	0	3	346.780	3.345	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2sc(C)cc2OC)C1	ZINC001086820801	1359208586	/nfs/dbraw/zinc/20/85/86/1359208586.db2.gz	ZNXALHGZAALKFU-QWHCGFSZSA-N	0	3	342.892	3.306	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)[C@H]2[C@@H]3c4ccccc4C[C@H]23)C1	ZINC001086821944	1359208563	/nfs/dbraw/zinc/20/85/63/1359208563.db2.gz	JCYVTAHSLJAQSC-AVCZALEUSA-N	0	3	344.886	3.199	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2nc(C3CC3)oc2C)C1	ZINC001086841582	1359211369	/nfs/dbraw/zinc/21/13/69/1359211369.db2.gz	LXHQFYZYZOWGHR-GXTWGEPZSA-N	0	3	337.851	3.101	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cc(F)cc(F)c2)C1	ZINC001086870636	1359217974	/nfs/dbraw/zinc/21/79/74/1359217974.db2.gz	PLDQFPANPYGOLY-XHDPSFHLSA-N	0	3	328.790	3.205	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cccc3cnccc32)C1	ZINC001086875969	1359219165	/nfs/dbraw/zinc/21/91/65/1359219165.db2.gz	RWWRIXHVNSWKSG-GOEBONIOSA-N	0	3	343.858	3.475	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc(F)c(F)c3)C2)CC1	ZINC001086926762	1359252223	/nfs/dbraw/zinc/25/22/23/1359252223.db2.gz	JFTCLWOHNQKPPY-HNNXBMFYSA-N	0	3	346.421	3.305	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CC2(C[C@@H]1C)CCN(CC#CC)CC2	ZINC001086927225	1359252685	/nfs/dbraw/zinc/25/26/85/1359252685.db2.gz	WEUBGBRHGKLADI-SFHVURJKSA-N	0	3	339.483	3.014	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cccc4cccnc43)C2)CC1	ZINC001086931339	1359255432	/nfs/dbraw/zinc/25/54/32/1359255432.db2.gz	GFSOALYCRJDCDB-KRWDZBQOSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc4ccc(C)cc4[nH]3)C2)CC1	ZINC001086935529	1359258755	/nfs/dbraw/zinc/25/87/55/1359258755.db2.gz	UAKDUBIRIGTYGP-QGZVFWFLSA-N	0	3	349.478	3.426	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)C[C@@H]3CC=CCC3)C2)CC1	ZINC001086937531	1359260085	/nfs/dbraw/zinc/26/00/85/1359260085.db2.gz	RKBKPXIFBHFLBB-RBUKOAKNSA-N	0	3	328.500	3.459	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H](C)c3ccsc3)C2)CC1	ZINC001086941390	1359263164	/nfs/dbraw/zinc/26/31/64/1359263164.db2.gz	SIDWJHPNICJIBK-HOTGVXAUSA-N	0	3	330.497	3.188	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3occc3CC)C2)CC1	ZINC001086941583	1359263284	/nfs/dbraw/zinc/26/32/84/1359263284.db2.gz	XZLKORQROHHQJY-INIZCTEOSA-N	0	3	328.456	3.182	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)CCc3ccccc3C)C2)CC1	ZINC001086945176	1359266311	/nfs/dbraw/zinc/26/63/11/1359266311.db2.gz	UCZFNXVJLRDGHN-LJQANCHMSA-N	0	3	338.495	3.264	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)CCc3ccccc3C)C2)CC1	ZINC001086945175	1359266381	/nfs/dbraw/zinc/26/63/81/1359266381.db2.gz	UCZFNXVJLRDGHN-IBGZPJMESA-N	0	3	338.495	3.264	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@H](C)c3cccc(C)c3)C2)CC1	ZINC001086945460	1359266456	/nfs/dbraw/zinc/26/64/56/1359266456.db2.gz	BTXMAUYBSNTWLN-RTBURBONSA-N	0	3	338.495	3.435	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc([C@@H](C)CC)no3)C2)CC1	ZINC001086947015	1359268142	/nfs/dbraw/zinc/26/81/42/1359268142.db2.gz	OCKIMFCPGDTJCA-JKSUJKDBSA-N	0	3	343.471	3.138	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3csc(C(C)C)n3)C2)CC1	ZINC001086949166	1359270167	/nfs/dbraw/zinc/27/01/67/1359270167.db2.gz	SSXOQUBFRIMLCY-OAHLLOKOSA-N	0	3	345.512	3.216	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@@H](C)c3ccc(C)s3)C2)CC1	ZINC001086953107	1359273030	/nfs/dbraw/zinc/27/30/30/1359273030.db2.gz	ZBTIYAMTRYCBPW-RDJZCZTQSA-N	0	3	344.524	3.496	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc(C)c(C)s3)C2)CC1	ZINC001086956394	1359277119	/nfs/dbraw/zinc/27/71/19/1359277119.db2.gz	MQJPMZPPPLCWIO-OAHLLOKOSA-N	0	3	330.497	3.315	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](CNCc2oc(CCC)nc2C)[C@H](C)C1	ZINC001184078433	1387388864	/nfs/dbraw/zinc/38/88/64/1387388864.db2.gz	OMJTVASKSIYDQF-NVXWUHKLSA-N	0	3	347.503	3.476	20	30		EGEDHN
CC[C@H](F)C(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccc(C#N)s1	ZINC001087200433	1359318243	/nfs/dbraw/zinc/31/82/43/1359318243.db2.gz	WXPBHUNKJOUWAL-WWGRRREGSA-N	0	3	337.464	3.085	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3csc(C)c3C)C(C)(C)[C@H]21	ZINC001087288077	1359367000	/nfs/dbraw/zinc/36/70/00/1359367000.db2.gz	QZGBIISUBNGYKV-OIISXLGYSA-N	0	3	330.497	3.217	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc(F)c(Cl)c3)C(C)(C)[C@H]21	ZINC001087300290	1359382053	/nfs/dbraw/zinc/38/20/53/1359382053.db2.gz	IYDVGFPUYDRAOQ-COXVUDFISA-N	0	3	348.849	3.331	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)CC3CC(C)(C)C3)C(C)(C)[C@@H]21	ZINC001087301946	1359385020	/nfs/dbraw/zinc/38/50/20/1359385020.db2.gz	LGPDBYPOBLOLMS-BHIYHBOVSA-N	0	3	330.516	3.441	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)Cc1cc(C)ccc1C	ZINC001087301687	1359385114	/nfs/dbraw/zinc/38/51/14/1359385114.db2.gz	HCDUIDXCTOVLCJ-HLAWJBBLSA-N	0	3	338.495	3.084	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)Cc3ccc(CC)cc3)C(C)(C)[C@@H]21	ZINC001087307286	1359394088	/nfs/dbraw/zinc/39/40/88/1359394088.db2.gz	XEPDJNXDBRDZJI-HMXCVIKNSA-N	0	3	338.495	3.030	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3csc(C)c3)C(C)(C)[C@H]21	ZINC001087308268	1359395753	/nfs/dbraw/zinc/39/57/53/1359395753.db2.gz	NSERDKGWYKICFC-ZACQAIPSSA-N	0	3	330.497	3.299	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc4cnccc4c3)C(C)(C)[C@H]21	ZINC001087313659	1359403017	/nfs/dbraw/zinc/40/30/17/1359403017.db2.gz	YQFIHDJGJVEFOH-AQNXPRMDSA-N	0	3	347.462	3.087	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc4c(s3)CCC4)C(C)(C)[C@H]21	ZINC001087316863	1359407445	/nfs/dbraw/zinc/40/74/45/1359407445.db2.gz	YNXTXKRDENPNIF-OLMNPRSZSA-N	0	3	342.508	3.089	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc(C)c(C)s1	ZINC001087317422	1359408830	/nfs/dbraw/zinc/40/88/30/1359408830.db2.gz	HZUBMWQDNIIRTN-HYVNUMGLSA-N	0	3	330.497	3.217	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3[C@H](C2)[C@@H]2CC[C@H]3CN2C/C=C\Cl)C1	ZINC001087390116	1359444887	/nfs/dbraw/zinc/44/48/87/1359444887.db2.gz	VTODLRMSVGJZMX-QJLVMFLBSA-N	0	3	334.891	3.264	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)C[C@@H]2C=CCC2)C1	ZINC001087421132	1359458208	/nfs/dbraw/zinc/45/82/08/1359458208.db2.gz	OFTTXIRPOUKGPW-HMXCVIKNSA-N	0	3	336.479	3.340	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)[C@H](C)n2cccc2)C1	ZINC001087425715	1359461155	/nfs/dbraw/zinc/46/11/55/1359461155.db2.gz	OFJAMEZJYXAHLQ-CEWLAPEOSA-N	0	3	349.478	3.047	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)[C@H]2CCC2(C)C)C1	ZINC001087435386	1359464404	/nfs/dbraw/zinc/46/44/04/1359464404.db2.gz	MPTICXWYBHAAKF-VAMGGRTRSA-N	0	3	338.495	3.420	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)c2c[nH]c(C#N)c2)CCN1Cc1csc(C)c1	ZINC001087548630	1359526394	/nfs/dbraw/zinc/52/63/94/1359526394.db2.gz	GQPWPJKKCVCMGQ-DLBZAZTESA-N	0	3	342.468	3.039	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2csc([C@@H](C)OC)n2)[C@H]1CC	ZINC001087570632	1359536456	/nfs/dbraw/zinc/53/64/56/1359536456.db2.gz	BRBFYNKQYJRBBX-VNHYZAJKSA-N	0	3	337.489	3.009	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)[C@@H]2C[C@H]2c2c(F)cccc2F)[C@H]1CC	ZINC001087719088	1359610799	/nfs/dbraw/zinc/61/07/99/1359610799.db2.gz	ZHXQQSMUNHEENP-UTJXIGIESA-N	0	3	334.410	3.223	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)Cc2c[nH]c3cccc(C)c23)[C@H]1CC	ZINC001087799799	1359651315	/nfs/dbraw/zinc/65/13/15/1359651315.db2.gz	PAGOSASXWANWCM-FUHWJXTLSA-N	0	3	325.456	3.174	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2c(C)nn(CC)c2Cl)[C@H]1CC	ZINC001087834738	1359670799	/nfs/dbraw/zinc/67/07/99/1359670799.db2.gz	SOUIPUDBORNVNM-UONOGXRCSA-N	0	3	338.883	3.024	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)c3ccc(C(F)F)cc3)C[C@@H]2C1	ZINC001088140207	1359771262	/nfs/dbraw/zinc/77/12/62/1359771262.db2.gz	ZKWRPBWPVBDTBY-SJORKVTESA-N	0	3	332.394	3.041	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3ccc(Cl)cc3Cl)C[C@@H]2C1	ZINC001088180100	1359783947	/nfs/dbraw/zinc/78/39/47/1359783947.db2.gz	PQIISRAHBNOYLR-OLZOCXBDSA-N	0	3	337.250	3.021	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)[C@H]2CCO[C@H]2C(=C)C)C1	ZINC001088397938	1359873157	/nfs/dbraw/zinc/87/31/57/1359873157.db2.gz	VORHZQVLOABDLH-ULQDDVLXSA-N	0	3	340.895	3.081	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2cnn3ccccc23)C1	ZINC001088400506	1359874808	/nfs/dbraw/zinc/87/48/08/1359874808.db2.gz	QXMSCKYLOMFQSW-OAHLLOKOSA-N	0	3	346.862	3.061	20	30		EGEDHN
COc1ccc(CN(C)C[C@@H]2CCCCN2C(=O)C(C)C)cc1C#N	ZINC001089121877	1360185217	/nfs/dbraw/zinc/18/52/17/1360185217.db2.gz	OTLPOKASMNETND-SFHVURJKSA-N	0	3	343.471	3.036	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N1CCCC[C@H]1CN(C)Cc1cccc(C#N)c1	ZINC001089211534	1360256837	/nfs/dbraw/zinc/25/68/37/1360256837.db2.gz	LGWMDCAOZSMLDI-SNRMKQJTSA-N	0	3	325.456	3.027	20	30		EGEDHN
CC1(C)C[C@@H](NC(=O)C2CC2)CCN(Cc2ccc(C#N)s2)C1	ZINC001089294316	1360312331	/nfs/dbraw/zinc/31/23/31/1360312331.db2.gz	YRHNKUYYIKYTEN-AWEZNQCLSA-N	0	3	331.485	3.137	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccoc2C(F)(F)F)CC(C)(C)C1	ZINC001089398177	1360398236	/nfs/dbraw/zinc/39/82/36/1360398236.db2.gz	YCYMJVCZGQHBLW-GFCCVEGCSA-N	0	3	342.361	3.152	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(OCC=C)cc2)CC(C)(C)C1	ZINC001089423755	1360417352	/nfs/dbraw/zinc/41/73/52/1360417352.db2.gz	NSAVLNBFLGQNIF-GOSISDBHSA-N	0	3	340.467	3.105	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2coc3cc(F)ccc23)CC(C)(C)C1	ZINC001089426880	1360419821	/nfs/dbraw/zinc/41/98/21/1360419821.db2.gz	LZVNKNMANQYRSW-HNNXBMFYSA-N	0	3	342.414	3.426	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cn(C)c3ccccc23)CC(C)(C)C1	ZINC001089433758	1360424974	/nfs/dbraw/zinc/42/49/74/1360424974.db2.gz	MQMUYFAAPLXYOQ-MRXNPFEDSA-N	0	3	337.467	3.032	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2ccc3cnccc3c2)CC(C)(C)C1	ZINC001089438996	1360429003	/nfs/dbraw/zinc/42/90/03/1360429003.db2.gz	NUDSUOSLGKBHTG-HXUWFJFHSA-N	0	3	349.478	3.017	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2cccc(C(F)F)c2)CC(C)(C)C1	ZINC001089438547	1360429008	/nfs/dbraw/zinc/42/90/08/1360429008.db2.gz	JTAIWJFJYCGOTO-QGZVFWFLSA-N	0	3	348.437	3.407	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@@H]2CCCCC2(F)F)CC(C)(C)C1	ZINC001089448343	1360437200	/nfs/dbraw/zinc/43/72/00/1360437200.db2.gz	CHPCPWIRATYGMH-GJZGRUSLSA-N	0	3	326.431	3.052	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3ocnc3C)CC(C)(C)C2)C1	ZINC001089485138	1360465684	/nfs/dbraw/zinc/46/56/84/1360465684.db2.gz	HYKUDBDMKMZXMU-INIZCTEOSA-N	0	3	345.487	3.446	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CCN(C/C=C\Cl)CC(C)(C)C2)c1	ZINC001089488532	1360468557	/nfs/dbraw/zinc/46/85/57/1360468557.db2.gz	VOGRRLGQKXPBBQ-XTKXOIQPSA-N	0	3	345.874	3.036	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C(C)(C)c2cccc(F)c2)CC(C)(C)C1	ZINC001089490813	1360469621	/nfs/dbraw/zinc/46/96/21/1360469621.db2.gz	FQABQUFOZSSCCB-GOSISDBHSA-N	0	3	344.474	3.343	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)ccc2F)CC(C)(C)C1	ZINC001089501729	1360475625	/nfs/dbraw/zinc/47/56/25/1360475625.db2.gz	GTKIAJRVONSTSO-INIZCTEOSA-N	0	3	330.447	3.378	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccoc2CCC)CC(C)(C)C1	ZINC001089539044	1360496883	/nfs/dbraw/zinc/49/68/83/1360496883.db2.gz	ZPFAMNIBMCEHGV-MRXNPFEDSA-N	0	3	330.472	3.476	20	30		EGEDHN
CC(C)=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(C#N)[nH]1	ZINC001089626337	1360544479	/nfs/dbraw/zinc/54/44/79/1360544479.db2.gz	GJTRKALSWAKVDH-MRXNPFEDSA-N	0	3	328.460	3.073	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(C(C)C)n(C)n1	ZINC001089638225	1360552116	/nfs/dbraw/zinc/55/21/16/1360552116.db2.gz	WGRZOVBUFLHIJN-INIZCTEOSA-N	0	3	346.519	3.340	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cc2n(n1)CCCC2	ZINC001089654705	1360567262	/nfs/dbraw/zinc/56/72/62/1360567262.db2.gz	KYOZDWCIZKBYHS-KRWDZBQOSA-N	0	3	344.503	3.016	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1c(C)cncc1C	ZINC001089668783	1360578848	/nfs/dbraw/zinc/57/88/48/1360578848.db2.gz	AGATYBFPGNYFTL-QGZVFWFLSA-N	0	3	329.488	3.495	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(CCC)n[nH]1	ZINC001089677723	1360585680	/nfs/dbraw/zinc/58/56/80/1360585680.db2.gz	BJVCAHWSACJULT-INIZCTEOSA-N	0	3	332.492	3.159	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc2[nH]ccc2c1	ZINC001089687238	1360593732	/nfs/dbraw/zinc/59/37/32/1360593732.db2.gz	GBHXUJSOTQMCBV-GOSISDBHSA-N	0	3	337.467	3.412	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc([C@@H](C)CC)no1	ZINC001089707780	1360612132	/nfs/dbraw/zinc/61/21/32/1360612132.db2.gz	SZRZVFGECXPLTF-HOTGVXAUSA-N	0	3	345.487	3.432	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc2cccnc2c1	ZINC001089711240	1360614506	/nfs/dbraw/zinc/61/45/06/1360614506.db2.gz	PPUIUGHQPKZWCQ-IBGZPJMESA-N	0	3	349.478	3.479	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cnoc1C(C)C	ZINC001089720417	1360622275	/nfs/dbraw/zinc/62/22/75/1360622275.db2.gz	WOYBOOQOUCGBAK-OAHLLOKOSA-N	0	3	331.460	3.042	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1c(F)cccc1F	ZINC001089726582	1360630338	/nfs/dbraw/zinc/63/03/38/1360630338.db2.gz	OKQVRWXBGWHCFX-AWEZNQCLSA-N	0	3	334.410	3.209	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1cccs1	ZINC001089762029	1360653677	/nfs/dbraw/zinc/65/36/77/1360653677.db2.gz	CGRGONYHUCSMBB-XQLPTFJDSA-N	0	3	336.888	3.283	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1(C2CC2)CCC1	ZINC001089841651	1360691399	/nfs/dbraw/zinc/69/13/99/1360691399.db2.gz	GKYOFOPCAWWEDV-HPBDAGMYSA-N	0	3	348.918	3.488	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C(C)(C)C(F)F	ZINC001089865617	1360708380	/nfs/dbraw/zinc/70/83/80/1360708380.db2.gz	RIYYNSZSSUOGBP-DGAVXFQQSA-N	0	3	346.849	3.199	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)C(C2CC2)C2CC2)C1	ZINC001089885404	1360719152	/nfs/dbraw/zinc/71/91/52/1360719152.db2.gz	GBABMVOWMNVEMP-XSLAGTTESA-N	0	3	348.918	3.344	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cccc(C)c2)CC2(CCOCC2)C1	ZINC001089920467	1360744999	/nfs/dbraw/zinc/74/49/99/1360744999.db2.gz	RVFUWLHEXVQNDH-IBGZPJMESA-N	0	3	342.483	3.172	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C[C@@H]2C=CCCC2)CC2(CCOCC2)C1	ZINC001089944337	1360757587	/nfs/dbraw/zinc/75/75/87/1360757587.db2.gz	BRFKWRZCOIXZNR-RTBURBONSA-N	0	3	346.515	3.296	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)[C@@H]2C[C@H]2C(C)(C)C)CC2(CCOCC2)C1	ZINC001089947095	1360758414	/nfs/dbraw/zinc/75/84/14/1360758414.db2.gz	WKGZHIJRPRETRC-RCCFBDPRSA-N	0	3	348.531	3.232	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CC2CC(C)(C)C2)CC2(CCOCC2)C1	ZINC001089952611	1360762206	/nfs/dbraw/zinc/76/22/06/1360762206.db2.gz	KTEGIEVJDQQKDP-SFHVURJKSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)[C@H]2CC23CCCC3)CC2(CCOCC2)C1	ZINC001089965389	1360769832	/nfs/dbraw/zinc/76/98/32/1360769832.db2.gz	ZGLKAXVWZDHIDE-ZWKOTPCHSA-N	0	3	346.515	3.130	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)[C@H]2CCCC(C)(C)C2)CC2(CCOCC2)C1	ZINC001089969398	1360773035	/nfs/dbraw/zinc/77/30/35/1360773035.db2.gz	KPIGZKWTWRTOIW-ZWKOTPCHSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](CNCc2cc(C3CC3)no2)[C@H](C)C1	ZINC001184498815	1387473818	/nfs/dbraw/zinc/47/38/18/1387473818.db2.gz	VWMYFEKKWAEFTL-WBVHZDCISA-N	0	3	345.487	3.483	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cn(C)c3ccc(F)cc23)C1	ZINC001091069696	1360988623	/nfs/dbraw/zinc/98/86/23/1360988623.db2.gz	BBFMVVYBBWCVMG-UHFFFAOYSA-N	0	3	349.837	3.168	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc3cc(C)ccc3[nH]2)C1	ZINC001091176092	1361001378	/nfs/dbraw/zinc/00/13/78/1361001378.db2.gz	GLNSTJLCTUYFBJ-UHFFFAOYSA-N	0	3	331.847	3.327	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cccc3c2ccn3C)C1	ZINC001091285371	1361031550	/nfs/dbraw/zinc/03/15/50/1361031550.db2.gz	PEBSLQRCLXHEGV-UHFFFAOYSA-N	0	3	331.847	3.029	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cnc(CC(C)C)s2)C1	ZINC001091388647	1361074798	/nfs/dbraw/zinc/07/47/98/1361074798.db2.gz	ORIJEJOQGNKCDR-UHFFFAOYSA-N	0	3	341.908	3.192	20	30		EGEDHN
C/C(=C/C(=O)N1C[C@H]2CN(Cc3ccc(C#N)cc3)C[C@@]2(C)C1)C1CC1	ZINC001091509365	1361131151	/nfs/dbraw/zinc/13/11/51/1361131151.db2.gz	QROKUFATRJQONT-RPAIWPSSSA-N	0	3	349.478	3.195	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CN(Cc3ccc(F)cc3)C[C@@]2(C)C1	ZINC001091916921	1361247644	/nfs/dbraw/zinc/24/76/44/1361247644.db2.gz	QKOAOMCTDCYIGS-UZLBHIALSA-N	0	3	330.447	3.318	20	30		EGEDHN
C#CCN1C[C@@H](CNC(=O)c2cc3cc(Cl)ccc3o2)[C@H](C)C1	ZINC001092798205	1361457945	/nfs/dbraw/zinc/45/79/45/1361457945.db2.gz	XJVBABRXEVNHMD-TZMCWYRMSA-N	0	3	330.815	3.017	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)Cc2cccs2)CC1	ZINC001093352222	1361565984	/nfs/dbraw/zinc/56/59/84/1361565984.db2.gz	VMXCSGOTRHGERK-LJQANCHMSA-N	0	3	342.508	3.017	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C[C@H]2C=CCC2)CC1	ZINC001093353548	1361567475	/nfs/dbraw/zinc/56/74/75/1361567475.db2.gz	AVIRJMPFDNIFFR-FXAWDEMLSA-N	0	3	326.484	3.069	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)c2ccc(Cl)o2)CC1	ZINC001093358283	1361570730	/nfs/dbraw/zinc/57/07/30/1361570730.db2.gz	BLHTVWVXLBKNRC-QGZVFWFLSA-N	0	3	346.858	3.273	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C2(CC)CCC2)CC1	ZINC001093375902	1361586399	/nfs/dbraw/zinc/58/63/99/1361586399.db2.gz	DTWIDRPROGNIGO-SFHVURJKSA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cccc4c(C)c(C)[nH]c43)CCC[C@@H]12	ZINC001094449990	1361806205	/nfs/dbraw/zinc/80/62/05/1361806205.db2.gz	CYTQVSNGTWLDCH-DENIHFKCSA-N	0	3	349.478	3.392	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cc4cc(F)ccc4o3)CCC[C@@H]12	ZINC001094526957	1361845206	/nfs/dbraw/zinc/84/52/06/1361845206.db2.gz	IKUQBYOUNUYKAO-UYAOXDASSA-N	0	3	340.398	3.180	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3oc4ccccc4c3C)CCC[C@@H]12	ZINC001094573474	1361865765	/nfs/dbraw/zinc/86/57/65/1361865765.db2.gz	BDCXCCJBNSMLOW-WIYYLYMNSA-N	0	3	336.435	3.349	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCC(F)F)CC[C@@H]1CNCc1ccccc1C#N	ZINC001184831861	1387546085	/nfs/dbraw/zinc/54/60/85/1387546085.db2.gz	NJVBDZHCJPFBNQ-GDBMZVCRSA-N	0	3	349.425	3.178	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc(-c3ccccc3)on1)C2	ZINC001095726641	1362214212	/nfs/dbraw/zinc/21/42/12/1362214212.db2.gz	FUTVMXDVPBXVJR-RYRKJORJSA-N	0	3	337.423	3.253	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3C[C@@H]2CC(C)(C)CO2)CC1	ZINC001095968171	1362314495	/nfs/dbraw/zinc/31/44/95/1362314495.db2.gz	LHUOCNAAPBBPTQ-XWSJACJDSA-N	0	3	346.515	3.269	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccnc(C3CCCC3)n1)C2	ZINC001096265936	1362451062	/nfs/dbraw/zinc/45/10/62/1362451062.db2.gz	AMMMZBRFEYXUBZ-NJAFHUGGSA-N	0	3	340.471	3.045	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C1CC(c3cccc(F)c3)C1)C2	ZINC001096666776	1362624653	/nfs/dbraw/zinc/62/46/53/1362624653.db2.gz	UFKRXHSSTRDBHD-BLXWGWSPSA-N	0	3	340.442	3.064	20	30		EGEDHN
Cc1cccc([C@H](C)N2[C@@H]3CC[C@H]2[C@H](NC(=O)c2cc(C#N)c[nH]2)C3)c1	ZINC001096924462	1362778509	/nfs/dbraw/zinc/77/85/09/1362778509.db2.gz	IHZYFHXDAUAHQG-IVGZAAIESA-N	0	3	348.450	3.291	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(-n3cccc3)cc1)C2	ZINC001097462537	1363004963	/nfs/dbraw/zinc/00/49/63/1363004963.db2.gz	LWOISVQWHCZOEH-AQNXPRMDSA-N	0	3	335.451	3.389	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C(C)(C)c1ccc(Cl)cc1)C2	ZINC001097771152	1363117160	/nfs/dbraw/zinc/11/71/60/1363117160.db2.gz	HWZMHSDEYNKUPB-KURKYZTESA-N	0	3	344.886	3.362	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3C[C@@H]2CCCCO2)CC1	ZINC001097788962	1363121765	/nfs/dbraw/zinc/12/17/65/1363121765.db2.gz	NFHZKDYJQOQIAR-HCXYKTFWSA-N	0	3	332.488	3.023	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1c[nH]c3ccc(F)cc13)C2	ZINC001097926032	1363168582	/nfs/dbraw/zinc/16/85/82/1363168582.db2.gz	RWJVXSHACBUOEZ-LZQZEXGQSA-N	0	3	341.430	3.147	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1c[nH]c3c1cccc3C)C2	ZINC001097970590	1363184456	/nfs/dbraw/zinc/18/44/56/1363184456.db2.gz	LGFJVQVVDFIENY-QRQLOZEOSA-N	0	3	337.467	3.316	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3[C@@H](C)c2ccccc2)nc1	ZINC001098245547	1363268431	/nfs/dbraw/zinc/26/84/31/1363268431.db2.gz	QLLIJHYBLBCVDF-SKRQURTPSA-N	0	3	345.446	3.159	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc3c(cccc3OC)[nH]1)C2	ZINC001098386967	1363314381	/nfs/dbraw/zinc/31/43/81/1363314381.db2.gz	QTEGRSBOPRLWOB-QBIMZIAESA-N	0	3	339.439	3.088	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1sc(CCC)nc1C)C2	ZINC001098388247	1363314753	/nfs/dbraw/zinc/31/47/53/1363314753.db2.gz	SGANKQTUGBNDPF-KFWWJZLASA-N	0	3	333.501	3.315	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H]1CCCCc3ccccc31)C2	ZINC001098470181	1363336005	/nfs/dbraw/zinc/33/60/05/1363336005.db2.gz	GXKLHOPTSGJPOF-WLRLJWMZSA-N	0	3	336.479	3.241	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(N(C)CC)cc1)C2	ZINC001098490895	1363342105	/nfs/dbraw/zinc/34/21/05/1363342105.db2.gz	IVGPJNPXSSQWAZ-QRVBRYPASA-N	0	3	327.472	3.054	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H](C)CC1CCCC1)C[C@@H](C)O2	ZINC001098642913	1363413342	/nfs/dbraw/zinc/41/33/42/1363413342.db2.gz	PAGATGNKEFGFJM-ZWKOTPCHSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H](C)c1ccccc1)C[C@@H](C)O2	ZINC001098655034	1363420262	/nfs/dbraw/zinc/42/02/62/1363420262.db2.gz	ILHWKRVYRCDGAB-QZTJIDSGSA-N	0	3	342.483	3.058	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H](C)c1ccccc1)C[C@H](C)O2	ZINC001098655045	1363420280	/nfs/dbraw/zinc/42/02/80/1363420280.db2.gz	ILHWKRVYRCDGAB-ZWKOTPCHSA-N	0	3	342.483	3.058	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](n2cc(CNCCCCCC)nn2)C1	ZINC001098680950	1363433209	/nfs/dbraw/zinc/43/32/09/1363433209.db2.gz	LXYZGSTYKCRKFA-SFHVURJKSA-N	0	3	347.507	3.078	20	30		EGEDHN
C#CCCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(-c3ccco3)o2)C1	ZINC001098937040	1363528783	/nfs/dbraw/zinc/52/87/83/1363528783.db2.gz	SLGFMZRUFCWFSI-YWZLYKJASA-N	0	3	338.407	3.147	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H](C)c2c(F)cccc2F)C1	ZINC001098945499	1363534152	/nfs/dbraw/zinc/53/41/52/1363534152.db2.gz	ZSLFTVKBPBGITB-TYILLQQXSA-N	0	3	334.410	3.225	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)COCC1CCCC1	ZINC001099110747	1363628932	/nfs/dbraw/zinc/62/89/32/1363628932.db2.gz	IFFFNKNOKWUZQR-GOSISDBHSA-N	0	3	336.520	3.376	20	30		EGEDHN
C#CCCN1C[C@@H]2CCC[C@]2(NC(=O)c2sc(CCC)nc2C)C1	ZINC001099158387	1363661954	/nfs/dbraw/zinc/66/19/54/1363661954.db2.gz	YNPKMEHSHYELAY-KXBFYZLASA-N	0	3	345.512	3.012	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2coc(C3CCCCC3)n2)C1	ZINC001099180817	1363676394	/nfs/dbraw/zinc/67/63/94/1363676394.db2.gz	CXAWSZFDUBJPPR-JXFKEZNVSA-N	0	3	343.471	3.493	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)CCCC1CC1	ZINC001099188908	1363681371	/nfs/dbraw/zinc/68/13/71/1363681371.db2.gz	LPAATAMFUHQGDT-SFHVURJKSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2c(C)cc(F)cc2C)C[C@H]1C(F)(F)F	ZINC001099288276	1363733673	/nfs/dbraw/zinc/73/36/73/1363733673.db2.gz	HSOXEIUAHSABQW-ZIAGYGMSSA-N	0	3	344.352	3.221	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)C1(C)CC(F)(F)C1	ZINC001099304240	1363739748	/nfs/dbraw/zinc/73/97/48/1363739748.db2.gz	NFXSBCMCKHFBJO-AWEZNQCLSA-N	0	3	326.431	3.052	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@H](C)CC2CCCC2)C[C@H]1C(F)(F)F	ZINC001099317196	1363746506	/nfs/dbraw/zinc/74/65/06/1363746506.db2.gz	VEDHKJZZFCLVFT-BPLDGKMQSA-N	0	3	332.410	3.368	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)Cc1ccc2c(c1)COC2	ZINC001099320958	1363748683	/nfs/dbraw/zinc/74/86/83/1363748683.db2.gz	NEWMWVIRPNUQMY-IBGZPJMESA-N	0	3	342.483	3.052	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)C[C@H]1OCc2ccccc21	ZINC001099321526	1363750210	/nfs/dbraw/zinc/75/02/10/1363750210.db2.gz	YETOTNXQZALHHH-IEBWSBKVSA-N	0	3	342.483	3.441	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)Cc2ccccc2Cl)C[C@H]1C(F)(F)F	ZINC001099340229	1363760549	/nfs/dbraw/zinc/76/05/49/1363760549.db2.gz	OFKOBVWSZPKXMZ-TZMCWYRMSA-N	0	3	346.780	3.047	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)[C@H](C)n1nc(C)cc1C	ZINC001099372205	1363777780	/nfs/dbraw/zinc/77/77/80/1363777780.db2.gz	LVDCVECYQBDUIO-ZWKOTPCHSA-N	0	3	346.519	3.244	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)CCSCC	ZINC001099424737	1363794422	/nfs/dbraw/zinc/79/44/22/1363794422.db2.gz	LJCYNJSYJMWSTA-FZKCQIBNSA-N	0	3	342.936	3.051	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1(CCC)CC1	ZINC001099529696	1363834332	/nfs/dbraw/zinc/83/43/32/1363834332.db2.gz	UYYCZLPDKDPJDV-NXOAAHMSSA-N	0	3	336.907	3.488	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)[C@H](CC)CC(C)C)CC2(CCOCC2)C1	ZINC001099597039	1363879892	/nfs/dbraw/zinc/87/98/92/1363879892.db2.gz	RDXONZVAEJYZBA-MSOLQXFVSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1CCN(Cc2ccc(C(C)C)cc2)C[C@H]1O	ZINC001099944624	1363989013	/nfs/dbraw/zinc/98/90/13/1363989013.db2.gz	OXFMDZOGQBNBTF-RBUKOAKNSA-N	0	3	344.499	3.074	20	30		EGEDHN
CCC[C@H](C)CC(=O)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100180593	1364037405	/nfs/dbraw/zinc/03/74/05/1364037405.db2.gz	AXLMVPYCGXBFAV-KKXNLOMOSA-N	0	3	326.484	3.349	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)CC2=CCCCC2)C1	ZINC001100184510	1364037960	/nfs/dbraw/zinc/03/79/60/1364037960.db2.gz	MDAOIASHFBXQET-UHFFFAOYSA-N	0	3	341.293	3.270	20	30		EGEDHN
CC(C)C#CC(=O)NCC1CC(N[C@@H](C)c2cc(F)ccc2F)C1	ZINC001100304517	1364073446	/nfs/dbraw/zinc/07/34/46/1364073446.db2.gz	BGJXEWAVGOIAHY-HLIUYOAVSA-N	0	3	334.410	3.170	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@H](C)OCCCCCC)C1	ZINC001100323784	1364080647	/nfs/dbraw/zinc/08/06/47/1364080647.db2.gz	LDBBLFIAZQHYAK-FHERZECASA-N	0	3	330.900	3.209	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NCC1CC(NCc2cc(C)ns2)C1	ZINC001100361854	1364091843	/nfs/dbraw/zinc/09/18/43/1364091843.db2.gz	FRGHVPUEIFSDOE-UHFFFAOYSA-N	0	3	341.908	3.215	20	30		EGEDHN
C[C@H](C(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1)C1CCC1	ZINC001100436813	1364113599	/nfs/dbraw/zinc/11/35/99/1364113599.db2.gz	MDKNZGDDSFWWTM-FVWXCPNNSA-N	0	3	342.458	3.098	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC1CC(NCc2ccncc2Cl)C1	ZINC001100559755	1364162006	/nfs/dbraw/zinc/16/20/06/1364162006.db2.gz	IXFYAIUDXBYMAQ-UHFFFAOYSA-N	0	3	335.879	3.322	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)C[C@H]2CC=CCC2)C1	ZINC001100572379	1364168537	/nfs/dbraw/zinc/16/85/37/1364168537.db2.gz	ASURWYRRPULGJT-NFOMZHRRSA-N	0	3	341.293	3.126	20	30		EGEDHN
C=CCCC1(C(=O)NCC2CC(NCc3c(C)nsc3C)C2)CC1	ZINC001100642663	1364201173	/nfs/dbraw/zinc/20/11/73/1364201173.db2.gz	JLUOWULTWMIBNZ-UHFFFAOYSA-N	0	3	347.528	3.491	20	30		EGEDHN
C=CCCC1(C(=O)NCC2CC(N[C@H](C)c3cnc(C)cn3)C2)CC1	ZINC001100642838	1364201255	/nfs/dbraw/zinc/20/12/55/1364201255.db2.gz	QCLFEQWAPZUWOH-KLAILNCOSA-N	0	3	342.487	3.077	20	30		EGEDHN
C=CCCC1(C(=O)NCC2CC(NCc3cc(C)ns3)C2)CC1	ZINC001100643720	1364201549	/nfs/dbraw/zinc/20/15/49/1364201549.db2.gz	LOVCRXAZONRSDO-UHFFFAOYSA-N	0	3	333.501	3.182	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC1CC(NCc2c(C)noc2CC)C1	ZINC001100644935	1364202591	/nfs/dbraw/zinc/20/25/91/1364202591.db2.gz	NKNCTHSTHINADJ-ZOJXTTQQSA-N	0	3	333.476	3.132	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC2CC(NCc3cccc(F)c3F)C2)C1	ZINC001100661376	1364208406	/nfs/dbraw/zinc/20/84/06/1364208406.db2.gz	QBLVIGNFVOPFRU-UHFFFAOYSA-N	0	3	334.410	3.306	20	30		EGEDHN
C=Cc1ccc(C(=O)NCC2CC(NCC#Cc3ccccc3)C2)cc1	ZINC001100695344	1364221391	/nfs/dbraw/zinc/22/13/91/1364221391.db2.gz	NBKHODKLTPYONQ-UHFFFAOYSA-N	0	3	344.458	3.479	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)[C@@H](CCC)C(C)C)C1	ZINC001100720071	1364234416	/nfs/dbraw/zinc/23/44/16/1364234416.db2.gz	FRHUYKOVWAAEON-NRXISQOPSA-N	0	3	345.325	3.452	20	30		EGEDHN
C=CC1(CC(=O)NCC2CC(NCc3cnoc3C)C2)CCCCC1	ZINC001100749550	1364245824	/nfs/dbraw/zinc/24/58/24/1364245824.db2.gz	FAWPQSUGVDHPTE-UHFFFAOYSA-N	0	3	345.487	3.494	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)CCc2ccc(F)cc2F)C1	ZINC001100818248	1364276895	/nfs/dbraw/zinc/27/68/95/1364276895.db2.gz	VCPDBHQPCRXFBX-UHFFFAOYSA-N	0	3	342.817	3.134	20	30		EGEDHN
CC1(CCC(=O)NCC2CC(NCc3ccc(C#N)cc3F)C2)CC1	ZINC001100824494	1364279618	/nfs/dbraw/zinc/27/96/18/1364279618.db2.gz	RAGWMXVBGZZZHO-UHFFFAOYSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@]2(C)CCc3ccccc32)C1	ZINC001101058039	1364395582	/nfs/dbraw/zinc/39/55/82/1364395582.db2.gz	YCOZDHRLICQCHC-GSQSYGFSSA-N	0	3	332.875	3.127	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@]2(C)CCc3ccccc32)C1	ZINC001101058040	1364395725	/nfs/dbraw/zinc/39/57/25/1364395725.db2.gz	YCOZDHRLICQCHC-KJXMEXGPSA-N	0	3	332.875	3.127	20	30		EGEDHN
C=CCN1CC[C@H](Oc2ccnc(CNC(=O)C(C)(CC)CC)c2)C1	ZINC001101100258	1364413927	/nfs/dbraw/zinc/41/39/27/1364413927.db2.gz	TYGDNAJUTKDUAX-SFHVURJKSA-N	0	3	345.487	3.163	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@H]2CN(Cc3cccc(F)c3)C[C@@]2(C)C1	ZINC001101203452	1364461707	/nfs/dbraw/zinc/46/17/07/1364461707.db2.gz	WOGGSQMYNPUABP-NQIIRXRSSA-N	0	3	342.458	3.300	20	30		EGEDHN
CC[C@H](C)CC(=O)N1C[C@H]2CN(Cc3ccc(C#N)cc3)C[C@@]2(C)C1	ZINC001101215240	1364466238	/nfs/dbraw/zinc/46/62/38/1364466238.db2.gz	LXNABIVMRDKFTN-SCWSEQNSSA-N	0	3	339.483	3.275	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@H]2CN(Cc3c(C)onc3CC)C[C@@]2(C)C1	ZINC001101253527	1364487298	/nfs/dbraw/zinc/48/72/98/1364487298.db2.gz	PJTUTEATXOPQDK-UZLBHIALSA-N	0	3	345.487	3.182	20	30		EGEDHN
C=CCCC(=O)NC[C@@H]1CN(Cc2oc(C(C)C)nc2C)C[C@H]1C	ZINC001101805297	1364733115	/nfs/dbraw/zinc/73/31/15/1364733115.db2.gz	LLFOUXIEXBVLOP-GDBMZVCRSA-N	0	3	333.476	3.257	20	30		EGEDHN
CC/C(C)=C/C(=O)NC[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1C	ZINC001101940886	1364783084	/nfs/dbraw/zinc/78/30/84/1364783084.db2.gz	UMPRUZIAJYAEPO-SMODISSLSA-N	0	3	343.446	3.238	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC[C@@H]1CN(Cc2cnc(C)s2)C[C@H]1C	ZINC001101997089	1364804259	/nfs/dbraw/zinc/80/42/59/1364804259.db2.gz	XGULOSRYPLARHH-RHSMWYFYSA-N	0	3	347.528	3.404	20	30		EGEDHN
C=C/C(C)=C\CC(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C	ZINC001102244735	1364960029	/nfs/dbraw/zinc/96/00/29/1364960029.db2.gz	PLNHDLYYVQSYKO-SXCBWIKFSA-N	0	3	336.479	3.245	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@@H]1CN(Cc2cnc(C)s2)C[C@H]1C	ZINC001102261113	1364974160	/nfs/dbraw/zinc/97/41/60/1364974160.db2.gz	OOVCHYYHZSOKCA-SQWLQELKSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@@H]1CN(Cc2c(C)onc2CC)C[C@H]1C	ZINC001102261175	1364974193	/nfs/dbraw/zinc/97/41/93/1364974193.db2.gz	QCIJCJSNNDMACI-ZMSDIMECSA-N	0	3	347.503	3.332	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@@H]1CN(Cc2c(C)noc2CC)C[C@H]1C	ZINC001102263017	1364975478	/nfs/dbraw/zinc/97/54/78/1364975478.db2.gz	RTMXYPYVTOABOA-HYVNUMGLSA-N	0	3	347.503	3.332	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](NCc3ccc(C#N)s3)C2)CC1	ZINC001185439719	1387717623	/nfs/dbraw/zinc/71/76/23/1387717623.db2.gz	XIATVZHIZKJNKH-CQSZACIVSA-N	0	3	329.469	3.057	20	30		EGEDHN
CC(C)C[C@@H](C)C(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C	ZINC001102485572	1365083286	/nfs/dbraw/zinc/08/32/86/1365083286.db2.gz	WVCZRGNWYYGZDR-SFHLNBCPSA-N	0	3	340.511	3.404	20	30		EGEDHN
C[C@@H]1CN(Cc2cc(C#N)ccc2F)C[C@H]1CCNC(=O)C(C)(C)F	ZINC001102634749	1365146146	/nfs/dbraw/zinc/14/61/46/1365146146.db2.gz	BWHRSLNMJFZSQX-UKRRQHHQSA-N	0	3	349.425	3.020	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCC[C@@H]1CN(Cc2cncs2)C[C@H]1C	ZINC001103346141	1365511151	/nfs/dbraw/zinc/51/11/51/1365511151.db2.gz	FPPFYKGGXIKSAF-OWCLPIDISA-N	0	3	335.517	3.320	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2csc(C#N)c2)CN1Cc1ccccc1	ZINC001324709084	1387746666	/nfs/dbraw/zinc/74/66/66/1387746666.db2.gz	WDIOMLGIQRFLRW-CZUORRHYSA-N	0	3	325.437	3.013	20	30		EGEDHN
CC(C)[C@H](C)C(=O)NCC[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1C	ZINC001103489650	1365593034	/nfs/dbraw/zinc/59/30/34/1365593034.db2.gz	OCTSWYVNHHTWCB-ZIFCJYIRSA-N	0	3	341.499	3.425	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)Cc2ccc(C)s2)C1	ZINC001103752350	1365764630	/nfs/dbraw/zinc/76/46/30/1365764630.db2.gz	ATEARRUDOZKRHP-IUODEOHRSA-N	0	3	340.920	3.426	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2ccccc2N(C)C)C1	ZINC001103775902	1365779018	/nfs/dbraw/zinc/77/90/18/1365779018.db2.gz	PAVDAZJWNYJCQS-GDBMZVCRSA-N	0	3	349.906	3.193	20	30		EGEDHN
CCCC(=O)N1C[C@@H](C)[C@H](CCNCc2cc(C#N)ccc2F)C1	ZINC001103819876	1365797049	/nfs/dbraw/zinc/79/70/49/1365797049.db2.gz	YYXKKTPSLJBNSJ-GDBMZVCRSA-N	0	3	331.435	3.072	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2(C)CC2)C[C@H]1CCNCc1ccc(C#N)cc1F	ZINC001104221551	1365956980	/nfs/dbraw/zinc/95/69/80/1365956980.db2.gz	OXPCFSICGVSZEW-RHSMWYFYSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H](C)[C@H](CCNCc2conc2CC)C1	ZINC001104631422	1366109923	/nfs/dbraw/zinc/10/99/23/1366109923.db2.gz	MYJSVRHLGNZMSH-QINHECLXSA-N	0	3	347.503	3.414	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2ccc(OC)cc2)C[C@H]1C	ZINC001104943350	1366234274	/nfs/dbraw/zinc/23/42/74/1366234274.db2.gz	RCJAYMBPOHMEAG-CZUORRHYSA-N	0	3	336.863	3.136	20	30		EGEDHN
CC(C)CCCC(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001185832437	1387809824	/nfs/dbraw/zinc/80/98/24/1387809824.db2.gz	CUBONJHJEHBHEX-QGZVFWFLSA-N	0	3	331.435	3.214	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)/C=C/C(C)(C)C)CC1	ZINC001105391853	1366439680	/nfs/dbraw/zinc/43/96/80/1366439680.db2.gz	NXEKRUHVOGSZKY-UBIUBJKMSA-N	0	3	328.500	3.315	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C(C)(C)CC=C)CC1	ZINC001105396689	1366445510	/nfs/dbraw/zinc/44/55/10/1366445510.db2.gz	SJWRQNSAEXBZRG-SFHVURJKSA-N	0	3	328.500	3.315	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(c2ccccc2)C[C@H](NC(=O)[C@@H]2CC23CC3)C1	ZINC001105441583	1366470111	/nfs/dbraw/zinc/47/01/11/1366470111.db2.gz	ZCSVRTGOMJDCNR-ABSDTBQOSA-N	0	3	344.886	3.345	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@@H](CNCc2c(F)cccc2F)[C@H](C)C1	ZINC001106026117	1366606927	/nfs/dbraw/zinc/60/69/27/1366606927.db2.gz	WROCUQKEFOGREU-HZPDHXFCSA-N	0	3	348.437	3.343	20	30		EGEDHN
C=CCC[C@H](C)NCc1cn([C@H]2CCCN(C(=O)CCCC)C2)nn1	ZINC001185871377	1387821552	/nfs/dbraw/zinc/82/15/52/1387821552.db2.gz	AUDYJDIPRQISDR-WMZOPIPTSA-N	0	3	347.507	3.076	20	30		EGEDHN
C#CCCCCCC(=O)N1C[C@@H](CNCc2csc(C)n2)[C@H](C)C1	ZINC001106533781	1366725527	/nfs/dbraw/zinc/72/55/27/1366725527.db2.gz	KKHLRPKIJJQBFG-NVXWUHKLSA-N	0	3	347.528	3.219	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](CNCc2csc(CC)n2)[C@H](C)C1	ZINC001106563543	1366737314	/nfs/dbraw/zinc/73/73/14/1366737314.db2.gz	DFDCPMYWSWSEJW-ARFHVFGLSA-N	0	3	349.544	3.492	20	30		EGEDHN
C=CCCC[N@@H+]1CC[C@@]2(CNC(=O)c3ccccc3[O-])CCC[C@@H]12	ZINC001107286074	1366916721	/nfs/dbraw/zinc/91/67/21/1366916721.db2.gz	YSYWAPPEGUAHDZ-UYAOXDASSA-N	0	3	328.456	3.333	20	30		EGEDHN
C=CCCC[N@H+]1CC[C@@]2(CNC(=O)c3ccccc3[O-])CCC[C@@H]12	ZINC001107286074	1366916722	/nfs/dbraw/zinc/91/67/22/1366916722.db2.gz	YSYWAPPEGUAHDZ-UYAOXDASSA-N	0	3	328.456	3.333	20	30		EGEDHN
C/C=C(/C)C(=O)NC[C@]12CCC[C@H]1N(Cc1ccc(C#N)s1)CC2	ZINC001107355598	1366940204	/nfs/dbraw/zinc/94/02/04/1366940204.db2.gz	JJFLSMGDXSYKKT-AZDZRYJGSA-N	0	3	343.496	3.447	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccc(CF)cc1	ZINC001109208478	1367003848	/nfs/dbraw/zinc/00/38/48/1367003848.db2.gz	PJQAQNBDSRGXEK-QYZOEREBSA-N	0	3	328.431	3.181	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1cccc2cccnc21	ZINC001109212350	1367006171	/nfs/dbraw/zinc/00/61/71/1367006171.db2.gz	ZVDFYOUIHYLXKX-AABGKKOBSA-N	0	3	347.462	3.260	20	30		EGEDHN
CC#CCCCC(=O)NC[C@]12CCC[C@H]1N(Cc1ocnc1C)CC2	ZINC001107513238	1367012322	/nfs/dbraw/zinc/01/23/22/1367012322.db2.gz	WJACIOMFQBSIGL-UYAOXDASSA-N	0	3	343.471	3.037	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1CC[C@H](N(C)Cc2ccc(OC)c(C#N)c2)C1	ZINC001189462557	1367029428	/nfs/dbraw/zinc/02/94/28/1367029428.db2.gz	XJHUPBOZOOGCCK-QAPCUYQASA-N	0	3	343.471	3.036	20	30		EGEDHN
C=CCOCCCC(=O)N1CC[C@@H](N(C)Cc2ccc(F)cc2C)C1	ZINC001189574629	1367058116	/nfs/dbraw/zinc/05/81/16/1367058116.db2.gz	MMIHYFHFCUFJBU-LJQANCHMSA-N	0	3	348.462	3.150	20	30		EGEDHN
C=C[C@H](C(=O)NC[C@]12CCC[C@H]1N(CCF)CC2)c1ccccc1	ZINC001107640998	1367088875	/nfs/dbraw/zinc/08/88/75/1367088875.db2.gz	VEQQLCMIOXAOHG-NLWGTHIKSA-N	0	3	330.447	3.287	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](N(C)CCc2c(F)cccc2F)C1	ZINC001189744463	1367100134	/nfs/dbraw/zinc/10/01/34/1367100134.db2.gz	TUQNUDRNQWCKQO-INIZCTEOSA-N	0	3	348.437	3.234	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2cccc(C)c2)C1	ZINC001107711644	1367114054	/nfs/dbraw/zinc/11/40/54/1367114054.db2.gz	JGVZRYWOEPHXFG-XLIONFOSSA-N	0	3	330.472	3.170	20	30		EGEDHN
CCC[C@@H](CC1CCCCC1)C(=O)N1CC[C@@H](NCC#CCOC)C1	ZINC001186049198	1387855638	/nfs/dbraw/zinc/85/56/38/1387855638.db2.gz	NWNWRHKNESNKQM-VQTJNVASSA-N	0	3	348.531	3.213	20	30		EGEDHN
CN(C/C=C/c1ccc(Cl)cc1)[C@@H]1CCN(C(=O)C#CC2CC2)C1	ZINC001190037575	1367158436	/nfs/dbraw/zinc/15/84/36/1367158436.db2.gz	UNGJTGLRIKJSEL-LSTKMXGYSA-N	0	3	342.870	3.299	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2c(C)coc2C)C1	ZINC001107914889	1367200535	/nfs/dbraw/zinc/20/05/35/1367200535.db2.gz	SZMFEBDGWVASPQ-HNAYVOBHSA-N	0	3	334.460	3.072	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCOCCC(C)C	ZINC001109607327	1367230173	/nfs/dbraw/zinc/23/01/73/1367230173.db2.gz	SQAAIBLPUBFCEW-AABGKKOBSA-N	0	3	348.531	3.354	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](N(C)CCc2csc(C)n2)C1	ZINC001190395978	1367251421	/nfs/dbraw/zinc/25/14/21/1367251421.db2.gz	CHTWAWREZFFJQL-INIZCTEOSA-N	0	3	335.517	3.129	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCc1scnc1C	ZINC001109634606	1367253941	/nfs/dbraw/zinc/25/39/41/1367253941.db2.gz	RMGPXFVEDFHJJC-YVSFHVDLSA-N	0	3	347.528	3.318	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](N(C)C[C@@H](O)c2ccc(CC)cc2)C1	ZINC001190429287	1367262195	/nfs/dbraw/zinc/26/21/95/1367262195.db2.gz	ZUKDMDLWIQAADF-WOJBJXKFSA-N	0	3	344.499	3.171	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2c(C)oc(C)c2C)C1	ZINC001108061050	1367262210	/nfs/dbraw/zinc/26/22/10/1367262210.db2.gz	FOUXHZUEEJDBOY-VBKZILBWSA-N	0	3	348.487	3.380	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](N(C)C[C@H](OC)c2ccccc2)C1	ZINC001190428683	1367262364	/nfs/dbraw/zinc/26/23/64/1367262364.db2.gz	NNJHEBJFJVJJHM-MOPGFXCFSA-N	0	3	330.472	3.263	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](N(C)C[C@@H](OC)c2ccccc2)C1	ZINC001190428689	1367262477	/nfs/dbraw/zinc/26/24/77/1367262477.db2.gz	NNJHEBJFJVJJHM-RTBURBONSA-N	0	3	330.472	3.263	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2c(C)oc(C)c2C)C1	ZINC001108061053	1367262850	/nfs/dbraw/zinc/26/28/50/1367262850.db2.gz	FOUXHZUEEJDBOY-XOBRGWDASA-N	0	3	348.487	3.380	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@]1(C)CN(CC2CCCCCC2)CCO1	ZINC001108119078	1367291240	/nfs/dbraw/zinc/29/12/40/1367291240.db2.gz	HQUYWLHMSVNHPY-FQEVSTJZSA-N	0	3	336.520	3.376	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@]1(C)CN([C@@H](C)CCC=C)CCO1	ZINC001108121728	1367291376	/nfs/dbraw/zinc/29/13/76/1367291376.db2.gz	FLZISQGCTBXHAF-AZUAARDMSA-N	0	3	334.504	3.132	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@]1(C)CN(CC2CCCCC2)CCO1	ZINC001108189839	1367332360	/nfs/dbraw/zinc/33/23/60/1367332360.db2.gz	MINHACLBYCYWPC-VQTJNVASSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CC1(CC(=O)N[C@H]2C[C@H]3CC[C@@H]2N3C[C@@H](C)OC)CCCCC1	ZINC001109830067	1367344632	/nfs/dbraw/zinc/34/46/32/1367344632.db2.gz	KGGOVBPNCCPIFZ-BDXSIMOUSA-N	0	3	334.504	3.269	20	30		EGEDHN
C=CCC1(S(=O)(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)CC1	ZINC001190822525	1367360341	/nfs/dbraw/zinc/36/03/41/1367360341.db2.gz	YXZDORLQDYQIOP-SJLPKXTDSA-N	0	3	348.512	3.068	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2csc(C)c2)C1	ZINC001108280704	1367377370	/nfs/dbraw/zinc/37/73/70/1367377370.db2.gz	XPXMIARJGVGPCO-KBXCAEBGSA-N	0	3	336.501	3.232	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2cc(C)ccc2C)C1	ZINC001108364959	1367414283	/nfs/dbraw/zinc/41/42/83/1367414283.db2.gz	YRQCQFJODVJUSZ-WIYYLYMNSA-N	0	3	344.499	3.479	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2ccc(CC)cc2)C1	ZINC001108374391	1367422034	/nfs/dbraw/zinc/42/20/34/1367422034.db2.gz	KUIUYGFDUIPSCW-UWJYYQICSA-N	0	3	344.499	3.424	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2ccc(C)c(C)c2)C1	ZINC001108378163	1367424619	/nfs/dbraw/zinc/42/46/19/1367424619.db2.gz	CCQIIFSFCYFRGM-RXVVDRJESA-N	0	3	344.499	3.479	20	30		EGEDHN
C=CCCC(=O)N1CCC([C@@H]2OCCC[C@H]2NCC(=C)Cl)CC1	ZINC001186122553	1387874131	/nfs/dbraw/zinc/87/41/31/1387874131.db2.gz	CAPUHFANAZMVLP-AEFFLSMTSA-N	0	3	340.895	3.081	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](CCCC)C(C)C)C2	ZINC001110169774	1367541530	/nfs/dbraw/zinc/54/15/30/1367541530.db2.gz	XIVNAVBTUWLZOA-YRXWBPOGSA-N	0	3	336.520	3.373	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](CCCC)C(C)C)C2	ZINC001110169773	1367541558	/nfs/dbraw/zinc/54/15/58/1367541558.db2.gz	XIVNAVBTUWLZOA-XWSJACJDSA-N	0	3	336.520	3.373	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCCC1CCCC1)C2	ZINC001110170584	1367541942	/nfs/dbraw/zinc/54/19/42/1367541942.db2.gz	LUCPGVNEACFKFP-QYZOEREBSA-N	0	3	334.504	3.271	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](N(C)CCOc2ccc(C)cc2)C1	ZINC001191727107	1367571463	/nfs/dbraw/zinc/57/14/63/1367571463.db2.gz	GCMMQFNCWKOYNM-KRWDZBQOSA-N	0	3	330.472	3.119	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](N(C)Cc2cccc(F)c2)C1	ZINC001191754573	1367577925	/nfs/dbraw/zinc/57/79/25/1367577925.db2.gz	QRWBOMAHRAAJCC-LJQANCHMSA-N	0	3	330.447	3.442	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](N(C)CCc2csc(C)n2)C1	ZINC001191868103	1367621224	/nfs/dbraw/zinc/62/12/24/1367621224.db2.gz	NZOVHPJYZQFNEF-YOEHRIQHSA-N	0	3	335.517	3.129	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@@H](N(C)Cc2ccc3c(c2)COC3)C1	ZINC001191911334	1367635486	/nfs/dbraw/zinc/63/54/86/1367635486.db2.gz	FBBZAUKZRRCRLN-OXQOHEQNSA-N	0	3	342.483	3.352	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCCc1ccc(Cl)cc1	ZINC001110401549	1367693545	/nfs/dbraw/zinc/69/35/45/1367693545.db2.gz	HTHLTRHYMKGHLG-PILAGYSTSA-N	0	3	345.874	3.154	20	30		EGEDHN
C=CCN1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)C2(C)CC2)C1	ZINC001186188588	1387893625	/nfs/dbraw/zinc/89/36/25/1387893625.db2.gz	FWKNFZJAGSKWLL-SJLPKXTDSA-N	0	3	330.447	3.334	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H](N(C)CCOc2cccc(F)c2)C1	ZINC001192161920	1367704115	/nfs/dbraw/zinc/70/41/15/1367704115.db2.gz	LUPZHQKQGNNRDN-PXNSSMCTSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@H](N(C)CCOc2ccccc2)C1	ZINC001192162124	1367704993	/nfs/dbraw/zinc/70/49/93/1367704993.db2.gz	MXKUAVAOYJOPAY-FXAWDEMLSA-N	0	3	330.472	3.200	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@H](N(C)CCOc2ccccc2)C1	ZINC001192162132	1367705711	/nfs/dbraw/zinc/70/57/11/1367705711.db2.gz	MXKUAVAOYJOPAY-XLIONFOSSA-N	0	3	330.472	3.200	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](N(C)CCOc3ccccc3)C2)CC1	ZINC001192180664	1367708296	/nfs/dbraw/zinc/70/82/96/1367708296.db2.gz	KVUYGCJPYONDJE-LJQANCHMSA-N	0	3	342.483	3.345	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](N(C)CCOCc3ccccc3)C2)C1	ZINC001192256622	1367731002	/nfs/dbraw/zinc/73/10/02/1367731002.db2.gz	IKUIAUUUSGTHNJ-IBGZPJMESA-N	0	3	342.483	3.092	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccc(COC)cc1	ZINC001109045920	1367738190	/nfs/dbraw/zinc/73/81/90/1367738190.db2.gz	DZQAGWJGTPCWNJ-QYZOEREBSA-N	0	3	328.456	3.021	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)C[C@@H](C)c2cccc(F)c2)C1	ZINC001192282483	1367738581	/nfs/dbraw/zinc/73/85/81/1367738581.db2.gz	AFYRNRSHIDXKLR-VQIMIIECSA-N	0	3	348.462	3.055	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@H](OCC)C1=CCCC1)C2	ZINC001110565782	1367837571	/nfs/dbraw/zinc/83/75/71/1367837571.db2.gz	NGJWSJLCBCIABE-YRXWBPOGSA-N	0	3	332.488	3.190	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2C[C@@H]1CCCCO1	ZINC001110601325	1367862193	/nfs/dbraw/zinc/86/21/93/1367862193.db2.gz	TUMYYGNFRZBZCU-QXSJWSMHSA-N	0	3	340.895	3.056	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2ccc3sccc3c2)C1	ZINC001193196573	1367964065	/nfs/dbraw/zinc/96/40/65/1367964065.db2.gz	ZCBVLJZSEDANKN-KRWDZBQOSA-N	0	3	344.480	3.250	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)c1c[nH]c(-c2cccc(OC)c2)c1	ZINC001193861139	1368132283	/nfs/dbraw/zinc/13/22/83/1368132283.db2.gz	AKLFKDTYOUNNEW-KRWDZBQOSA-N	0	3	339.439	3.071	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)CC(C1CCC1)C1CCC1)C2	ZINC001111030519	1368145396	/nfs/dbraw/zinc/14/53/96/1368145396.db2.gz	NSGVSKLHTWWITC-RLLQIKCJSA-N	0	3	328.500	3.338	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](CC)c1c(C)noc1C)C2	ZINC001111148383	1368164816	/nfs/dbraw/zinc/16/48/16/1368164816.db2.gz	IKTBIHYPCXBGHV-TWMKSMIVSA-N	0	3	331.460	3.083	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2ccccc2CC(C)C)C1	ZINC001194359999	1368243388	/nfs/dbraw/zinc/24/33/88/1368243388.db2.gz	VCENXVSFYDPUDM-IBGZPJMESA-N	0	3	344.499	3.234	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCc1ccccc1Cl)C2	ZINC001111369666	1368274309	/nfs/dbraw/zinc/27/43/09/1368274309.db2.gz	JWYBWGXSGAWDGC-NXHRZFHOSA-N	0	3	330.859	3.017	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)CC(C)(C)c1ccc(C)cc1)C2	ZINC001111372899	1368274860	/nfs/dbraw/zinc/27/48/60/1368274860.db2.gz	MZAQUGOWCKKLQH-AQNXPRMDSA-N	0	3	338.495	3.408	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)C[C@@H]2CCCCC2(C)C)C1	ZINC001194532494	1368280582	/nfs/dbraw/zinc/28/05/82/1368280582.db2.gz	TVEGBDSYOOZNOG-ROUUACIJSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](N(C)CCOCCCC)C2)CCCC1	ZINC001194568855	1368288529	/nfs/dbraw/zinc/28/85/29/1368288529.db2.gz	VUWOPKBOZCMPLH-SFHVURJKSA-N	0	3	336.520	3.472	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H](CC)c1ccc(OC)cc1)C2	ZINC001111443853	1368308962	/nfs/dbraw/zinc/30/89/62/1368308962.db2.gz	YTJQCQIVURILAJ-MDNKFWRPSA-N	0	3	342.483	3.486	20	30		EGEDHN
CCCCCCCCOC(=O)N1CCO[C@H](CN2CCCC2)C1	ZINC001194743949	1368315913	/nfs/dbraw/zinc/31/59/13/1368315913.db2.gz	UZVSWNBSHRQDOF-QGZVFWFLSA-N	0	3	326.481	3.280	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1c(C)cccc1C	ZINC001111489869	1368319757	/nfs/dbraw/zinc/31/97/57/1368319757.db2.gz	NEJCDOHQOKWDAW-CUDHKJQZSA-N	0	3	342.483	3.116	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)C[C@@H](NC(=O)CCC=C)c1ccccc1O2	ZINC001111529642	1368327977	/nfs/dbraw/zinc/32/79/77/1368327977.db2.gz	NNSOHYPQDHZLAC-NQIIRXRSSA-N	0	3	338.451	3.060	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)CCCC(C)(C)C)C[C@H](C)O2	ZINC001111540859	1368336126	/nfs/dbraw/zinc/33/61/26/1368336126.db2.gz	TVKPKSRFNJQNJE-KRWDZBQOSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@](C)(CC)CCC)C[C@H](C)O2	ZINC001111551204	1368343252	/nfs/dbraw/zinc/34/32/52/1368343252.db2.gz	UGVVNRIGMYXUPX-PKOBYXMFSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C(C)(C)CC(C)C)C[C@H](C)O2	ZINC001111552624	1368343833	/nfs/dbraw/zinc/34/38/33/1368343833.db2.gz	JHJFHTQWRJXQJW-KRWDZBQOSA-N	0	3	336.520	3.327	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@H](CC)C(C)C)C[C@@H](C)O2	ZINC001111552956	1368344349	/nfs/dbraw/zinc/34/43/49/1368344349.db2.gz	QUUNRGHTGMWIDN-MSOLQXFVSA-N	0	3	336.520	3.327	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CCCN(CCc2ccc(C)cc2)CC1	ZINC001195174077	1368393312	/nfs/dbraw/zinc/39/33/12/1368393312.db2.gz	IRZVJJNCDNCUHI-IBGZPJMESA-N	0	3	344.499	3.053	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@]12CCC[C@H]1CN(Cc1cc3ccccc3o1)C2	ZINC001111666485	1368415601	/nfs/dbraw/zinc/41/56/01/1368415601.db2.gz	DBJLRKCDRLGFNE-IIMJZQEZSA-N	0	3	337.423	3.063	20	30		EGEDHN
C=C(C)CCC(=O)N[C@]12CCC[C@H]1CN(Cc1ncccc1C)C2	ZINC001111763735	1368450703	/nfs/dbraw/zinc/45/07/03/1368450703.db2.gz	FFRUJYZGOVLZMO-PXNSSMCTSA-N	0	3	327.472	3.217	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(C#N)cc1)C2	ZINC001111844055	1368498833	/nfs/dbraw/zinc/49/88/33/1368498833.db2.gz	AKPUOHGGOAGRPS-NSHGMRRFSA-N	0	3	343.446	3.023	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N1CCCN(CC/C=C/CCC)CC1	ZINC001195885770	1368510922	/nfs/dbraw/zinc/51/09/22/1368510922.db2.gz	CMQYAMTTYSFWNB-KAGICYHLSA-N	0	3	334.504	3.248	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCCN(C[C@@H](OCC)C2CC2)CC1	ZINC001195958019	1368522331	/nfs/dbraw/zinc/52/23/31/1368522331.db2.gz	LLQRQQACKOEDEG-MRXNPFEDSA-N	0	3	342.911	3.115	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CCCN(CCc2ccccc2)CC1)OCC	ZINC001196025689	1368538254	/nfs/dbraw/zinc/53/82/54/1368538254.db2.gz	SQLQRIGPSPQGDA-FQEVSTJZSA-N	0	3	344.499	3.135	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@@H](C)CC2CCCC2)C1	ZINC001196591460	1368644303	/nfs/dbraw/zinc/64/43/03/1368644303.db2.gz	YGBCYJKOPMHYLU-QXAKKESOSA-N	0	3	338.536	3.335	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2noc3c2CC(C)(C)CC3)CC1	ZINC001196603063	1368647397	/nfs/dbraw/zinc/64/73/97/1368647397.db2.gz	RSFXQRQUIGATRX-UHFFFAOYSA-N	0	3	345.487	3.304	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)C[C@@H](C)C(C)(C)C)C[C@H]1C(F)(F)F	ZINC001112199559	1368710567	/nfs/dbraw/zinc/71/05/67/1368710567.db2.gz	YQHIMGDYACVTIX-MGPQQGTHSA-N	0	3	332.410	3.061	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)C(C)(C)CC(C)(C)C)C[C@H]1C(F)(F)F	ZINC001112211081	1368720555	/nfs/dbraw/zinc/72/05/55/1368720555.db2.gz	VWSNNWQZAVAQOB-ZIAGYGMSSA-N	0	3	346.437	3.451	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2ccc(F)c(F)c2F)CC1	ZINC001196963408	1368721668	/nfs/dbraw/zinc/72/16/68/1368721668.db2.gz	RGFGLBIFJLKWNH-UHFFFAOYSA-N	0	3	326.362	3.218	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H]2CCC[C@]2(CNCc2csc(CC)n2)C1	ZINC001112282653	1368747684	/nfs/dbraw/zinc/74/76/84/1368747684.db2.gz	JKIZHVCXKAPFLJ-KXBFYZLASA-N	0	3	347.528	3.390	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)c2cc(C(C)C)oc2C)C1	ZINC001197395871	1368805651	/nfs/dbraw/zinc/80/56/51/1368805651.db2.gz	JUVRCRYIGORIHV-QZTJIDSGSA-N	0	3	348.487	3.233	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cnn(CC)c2C)CC1	ZINC001197536821	1368834436	/nfs/dbraw/zinc/83/44/36/1368834436.db2.gz	QDHDIUGDFJHTJK-UHFFFAOYSA-N	0	3	334.508	3.330	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cnoc2C2CC2)CC1	ZINC001197669029	1368869139	/nfs/dbraw/zinc/86/91/39/1368869139.db2.gz	KJSFYTBHRBOHNN-UHFFFAOYSA-N	0	3	331.460	3.446	20	30		EGEDHN
C=CCOc1cccnc1C(=O)N1CCCN(CCCC(C)C)CC1	ZINC001197769143	1368892952	/nfs/dbraw/zinc/89/29/52/1368892952.db2.gz	SAPSYOMXJNGXFT-UHFFFAOYSA-N	0	3	345.487	3.231	20	30		EGEDHN
CCCCCCCCC(=O)N[C@@H]1CN(CCCCCF)C[C@H]1O	ZINC001198087594	1368957432	/nfs/dbraw/zinc/95/74/32/1368957432.db2.gz	FNKKMWDJYTUCLR-IAGOWNOFSA-N	0	3	330.488	3.038	20	30		EGEDHN
C=CCCOCCCCC(=O)N1CCN(C[C@@H]2CC[C@H]3C[C@H]3C2)CC1	ZINC001112851106	1369045997	/nfs/dbraw/zinc/04/59/97/1369045997.db2.gz	VESZTSSLXBYNMP-HSALFYBXSA-N	0	3	348.531	3.330	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)/C=C\c1ccco1)c1ccccc1OC	ZINC001198498929	1369046603	/nfs/dbraw/zinc/04/66/03/1369046603.db2.gz	FOLVUORTAQANOF-JYBLJSLWSA-N	0	3	340.423	3.325	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)Cc1ccsc1)c1ccccc1OC	ZINC001198507074	1369048181	/nfs/dbraw/zinc/04/81/81/1369048181.db2.gz	IYKSKBCPCLLACA-QGZVFWFLSA-N	0	3	344.480	3.322	20	30		EGEDHN
C=CCOCC(=O)NC[C@H](NCC/C=C/CC)c1ccccc1OC	ZINC001198605877	1369071639	/nfs/dbraw/zinc/07/16/39/1369071639.db2.gz	LCHXRDZAXFTPMM-DKFQHHCZSA-N	0	3	346.471	3.001	20	30		EGEDHN
CCCCCCN[C@H](CNC(=O)[C@H](C)C#N)c1ccccc1OC	ZINC001198616278	1369073343	/nfs/dbraw/zinc/07/33/43/1369073343.db2.gz	GXKMUVWPRZNFKO-NVXWUHKLSA-N	0	3	331.460	3.182	20	30		EGEDHN
COc1ccccc1[C@@H](CNC(=O)[C@@H](C)C#N)NCCC1CCCC1	ZINC001198618099	1369074334	/nfs/dbraw/zinc/07/43/34/1369074334.db2.gz	WPLLHRJHWKJVDY-MAUKXSAKSA-N	0	3	343.471	3.182	20	30		EGEDHN
C=C(C)CCC(=O)N1CCN(C[C@@H]2CCc3ccccc3C2)CC1	ZINC001112901232	1369080744	/nfs/dbraw/zinc/08/07/44/1369080744.db2.gz	CGIBGAOVSBUOAV-GOSISDBHSA-N	0	3	326.484	3.292	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CCN(CC2CCC3(CC3)CC2)CC1)OCC	ZINC001112908919	1369085848	/nfs/dbraw/zinc/08/58/48/1369085848.db2.gz	IOGGHMVJQBBTNF-LJQANCHMSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@@H](C)n1cccc1)c1ccccc1OC	ZINC001198669205	1369087447	/nfs/dbraw/zinc/08/74/47/1369087447.db2.gz	XSFVVBSUJMOLDI-AEFFLSMTSA-N	0	3	341.455	3.081	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)Cc1ccoc1)c1ccccc1OC	ZINC001198685805	1369090539	/nfs/dbraw/zinc/09/05/39/1369090539.db2.gz	FRTWHGHWUNRDDK-GOSISDBHSA-N	0	3	342.439	3.244	20	30		EGEDHN
CCCCCN[C@H](CNC(=O)C#CC1CC1)c1ccccc1OC	ZINC001198723837	1369099432	/nfs/dbraw/zinc/09/94/32/1369099432.db2.gz	LHADJGRRHRDYNC-GOSISDBHSA-N	0	3	328.456	3.046	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)c1cc[nH]c1)c1ccccc1OC	ZINC001198743472	1369103625	/nfs/dbraw/zinc/10/36/25/1369103625.db2.gz	ZPEUXFZZPUKUQR-QGZVFWFLSA-N	0	3	327.428	3.050	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)c1ccns1)c1ccccc1OC	ZINC001198753040	1369106205	/nfs/dbraw/zinc/10/62/05/1369106205.db2.gz	XHLWRBXZOYLFBP-HNNXBMFYSA-N	0	3	345.468	3.179	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)c1cc(F)c[nH]1)c1ccccc1OC	ZINC001198796386	1369116616	/nfs/dbraw/zinc/11/66/16/1369116616.db2.gz	LIBONOWAHFQIJV-QGZVFWFLSA-N	0	3	345.418	3.189	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@@H](NCCCF)c1ccccc1OC	ZINC001198857539	1369131501	/nfs/dbraw/zinc/13/15/01/1369131501.db2.gz	QSWORGVVZKLVRE-DOTOQJQBSA-N	0	3	336.451	3.404	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)c1cc(C)co1)c1ccccc1OC	ZINC001198857671	1369132645	/nfs/dbraw/zinc/13/26/45/1369132645.db2.gz	VLTBOKUEHOUDNV-INIZCTEOSA-N	0	3	328.412	3.233	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)c1conc1C)c1ccccc1OC	ZINC001198876490	1369137073	/nfs/dbraw/zinc/13/70/73/1369137073.db2.gz	SITLMBOWANWNCK-KRWDZBQOSA-N	0	3	343.427	3.019	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@H](NCC1CC1)c1ccccc1OC	ZINC001198885746	1369139968	/nfs/dbraw/zinc/13/99/68/1369139968.db2.gz	RIERIJUXBLEHJO-PXNSSMCTSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@H](NCC1CC1)c1ccccc1OC	ZINC001198885745	1369140404	/nfs/dbraw/zinc/14/04/04/1369140404.db2.gz	RIERIJUXBLEHJO-FXAWDEMLSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)C1(CF)CC1)c1ccccc1OC	ZINC001198902916	1369144976	/nfs/dbraw/zinc/14/49/76/1369144976.db2.gz	RRTCEZJTHDICBV-INIZCTEOSA-N	0	3	334.435	3.158	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)Cc1ccco1)c1ccccc1OC	ZINC001198941690	1369153505	/nfs/dbraw/zinc/15/35/05/1369153505.db2.gz	ZBAVSOOSCZDFLW-SFHVURJKSA-N	0	3	342.439	3.244	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CC/C=C\CC)C[C@H]2O)CCCCC1	ZINC001198944863	1369154857	/nfs/dbraw/zinc/15/48/57/1369154857.db2.gz	PGVZSALXBWPHBX-OSFIAYCASA-N	0	3	334.504	3.031	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)CCCOC(C)C)c1ccccc1OC	ZINC001199016246	1369171199	/nfs/dbraw/zinc/17/11/99/1369171199.db2.gz	HFIJIXYGQPOQJN-GOSISDBHSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCC[C@H](C(=O)N[C@@H]1CN(CCCCC)C[C@H]1O)c1ccccc1	ZINC001199567522	1369238119	/nfs/dbraw/zinc/23/81/19/1369238119.db2.gz	RYUFRLNCAFOXHJ-XUVXKRRUSA-N	0	3	344.499	3.088	20	30		EGEDHN
CCC[C@H](CC)C(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001186630389	1387990175	/nfs/dbraw/zinc/99/01/75/1387990175.db2.gz	IDRBZZBJUTWZHK-DOTOQJQBSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=C(Br)CNC1CCN(C(=O)C=C(CC)CC)CC1	ZINC001200070157	1369312325	/nfs/dbraw/zinc/31/23/25/1369312325.db2.gz	BCGJKEMUFWAGEA-UHFFFAOYSA-N	0	3	329.282	3.222	20	30		EGEDHN
C#CCCCCC(=O)N1CCC(NCc2nc(C)sc2C)CC1	ZINC001200156141	1369322036	/nfs/dbraw/zinc/32/20/36/1369322036.db2.gz	RDPHWUTZBYTQDC-UHFFFAOYSA-N	0	3	333.501	3.034	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC(N[C@H](C)c2c(F)cccc2F)CC1	ZINC001200414442	1369362691	/nfs/dbraw/zinc/36/26/91/1369362691.db2.gz	HGZKIVRLRUGWHD-CQSZACIVSA-N	0	3	334.410	3.266	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)CC#Cc1ccccc1	ZINC001325529480	1387998031	/nfs/dbraw/zinc/99/80/31/1387998031.db2.gz	IACYKPXUMACORM-RXVVDRJESA-N	0	3	332.447	3.065	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)CCN(C)c2ccccc2)CC1	ZINC001113440742	1369430614	/nfs/dbraw/zinc/43/06/14/1369430614.db2.gz	MSAKELOYYHYFFV-GOSISDBHSA-N	0	3	329.488	3.012	20	30		EGEDHN
CC(C)(CC(F)F)C(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001201011616	1369466397	/nfs/dbraw/zinc/46/63/97/1369466397.db2.gz	JZITXWQFLOULTL-UHFFFAOYSA-N	0	3	349.425	3.320	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)[C@@H](c2ccccc2)N(C)CC)CC1	ZINC001113529059	1369479380	/nfs/dbraw/zinc/47/93/80/1369479380.db2.gz	BUOXKCLCXVFFOA-UYAOXDASSA-N	0	3	343.515	3.178	20	30		EGEDHN
C=CCCCCCN1CCN(C(=O)c2cccc(CN(C)C)c2)CC1	ZINC001113674839	1369559625	/nfs/dbraw/zinc/55/96/25/1369559625.db2.gz	OQVDFDZNJWVSMQ-UHFFFAOYSA-N	0	3	343.515	3.252	20	30		EGEDHN
C#CCNC[C@@H]1CN(C(=O)CCCCCCCCCC)CCCO1	ZINC001201932188	1369645200	/nfs/dbraw/zinc/64/52/00/1369645200.db2.gz	UCNUNXNGKMSZJA-LJQANCHMSA-N	0	3	336.520	3.358	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)N1CCC(NCc2nc(C)c(C)s2)CC1	ZINC001202085024	1369684437	/nfs/dbraw/zinc/68/44/37/1369684437.db2.gz	OEYGAQYHGMXKKX-OLZOCXBDSA-N	0	3	335.517	3.299	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC(N[C@@H](C)c2cnc(C)cn2)CC1	ZINC001202130046	1369695923	/nfs/dbraw/zinc/69/59/23/1369695923.db2.gz	CZYGPCISLJDTCG-JKSUJKDBSA-N	0	3	330.476	3.029	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC(N[C@H](C)c2cnc(C)cn2)CC1	ZINC001202130045	1369696022	/nfs/dbraw/zinc/69/60/22/1369696022.db2.gz	CZYGPCISLJDTCG-HZPDHXFCSA-N	0	3	330.476	3.029	20	30		EGEDHN
CC#CCNC[C@H]1CN(C(=O)c2ccc([C@@H](C)CC)cc2)CCCO1	ZINC001202174538	1369707948	/nfs/dbraw/zinc/70/79/48/1369707948.db2.gz	VYJZBEWFZZXBBE-PXNSSMCTSA-N	0	3	342.483	3.044	20	30		EGEDHN
C=C(Cl)CN1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)Cc1ccc(C)nc1)C2	ZINC001325643665	1388021107	/nfs/dbraw/zinc/02/11/07/1388021107.db2.gz	QARSOPGKOTUYHR-BCDXTJNWSA-N	0	3	347.890	3.044	20	30		EGEDHN
CCC(=O)N[C@@H]1C[C@H](NCC#Cc2ccccc2Cl)C12CCC2	ZINC001202257682	1369724483	/nfs/dbraw/zinc/72/44/83/1369724483.db2.gz	BIXAHZQFBSQZEI-DLBZAZTESA-N	0	3	330.859	3.119	20	30		EGEDHN
CCCCC(=O)N[C@@H]1C[C@H](NCC#Cc2ccc(F)cc2)C12CCC2	ZINC001202488090	1369788003	/nfs/dbraw/zinc/78/80/03/1369788003.db2.gz	FCMIFOWKTBBWKC-RBUKOAKNSA-N	0	3	342.458	3.384	20	30		EGEDHN
CC(C)(C)CC(=O)N[C@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202502497	1369793008	/nfs/dbraw/zinc/79/30/08/1369793008.db2.gz	UYRUZFUJRKKPSB-OALUTQOASA-N	0	3	338.495	3.491	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@H](NCc2ccncc2Cl)C12CCC2	ZINC001202593290	1369817045	/nfs/dbraw/zinc/81/70/45/1369817045.db2.gz	ZMZGXYLVTJCXMZ-JKSUJKDBSA-N	0	3	333.863	3.218	20	30		EGEDHN
CC(C)c1ccc(CN2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)C#CC(C)(C)C)cc1	ZINC001114256381	1369831980	/nfs/dbraw/zinc/83/19/80/1369831980.db2.gz	ZJENZOHYLNLSLB-KXTWHKPSSA-N	0	3	338.495	3.406	20	30		EGEDHN
O=C(N[C@@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2)C1=CCCC1	ZINC001202755681	1369879734	/nfs/dbraw/zinc/87/97/34/1369879734.db2.gz	PCNGBEHNESYLTM-WOJBJXKFSA-N	0	3	334.463	3.165	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1C[C@H](NCc2c(C)noc2C)C12CCC2	ZINC001202766688	1369884593	/nfs/dbraw/zinc/88/45/93/1369884593.db2.gz	WRGXBKOMIIMMJD-ZWKOTPCHSA-N	0	3	343.471	3.002	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1C[C@@H](NCc2ccccc2F)C12CCC2	ZINC001202830755	1369904107	/nfs/dbraw/zinc/90/41/07/1369904107.db2.gz	ACVHNFVFJFDRBX-MSOLQXFVSA-N	0	3	328.431	3.146	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1C[C@H](NCc2conc2C)C12CCC2	ZINC001202951635	1369934756	/nfs/dbraw/zinc/93/47/56/1369934756.db2.gz	SKXWXUPIRYENSP-ZWKOTPCHSA-N	0	3	343.471	3.268	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1C[C@H](NCc2ccns2)C12CCC2	ZINC001202959448	1369936709	/nfs/dbraw/zinc/93/67/09/1369936709.db2.gz	DZAHDVSOUFKNKF-IRXDYDNUSA-N	0	3	345.512	3.429	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1[C@H]2CN(Cc3cc(F)ccc3C)C[C@H]21	ZINC001114678600	1370020664	/nfs/dbraw/zinc/02/06/64/1370020664.db2.gz	PGNMODBNTTUSNR-PIIMJCKOSA-N	0	3	330.447	3.283	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1[C@H]2CN(CCc3ccccc3F)C[C@H]21	ZINC001114724053	1370046450	/nfs/dbraw/zinc/04/64/50/1370046450.db2.gz	FPNUGOSZHISKNF-ITQYTPKQSA-N	0	3	330.447	3.017	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1[C@H]2CN(Cc3cc(C)ccc3OC)C[C@H]21	ZINC001114724347	1370047244	/nfs/dbraw/zinc/04/72/44/1370047244.db2.gz	KYDXWTRJEKJMOX-WOGUSJMUSA-N	0	3	342.483	3.152	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1[C@H]2CN(CCc3ccccc3F)C[C@H]21	ZINC001114726484	1370048881	/nfs/dbraw/zinc/04/88/81/1370048881.db2.gz	MLWLTFMGSQPUNM-UJAMICLKSA-N	0	3	330.447	3.017	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1[C@H]2CN(Cc3cc(F)ccc3C)C[C@H]21	ZINC001114727250	1370049729	/nfs/dbraw/zinc/04/97/29/1370049729.db2.gz	UMFZJEBVJJODFA-QKUWSGOFSA-N	0	3	330.447	3.283	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1C[C@@H](NCc2cccc(Cl)n2)C12CCC2	ZINC001203273976	1370055302	/nfs/dbraw/zinc/05/53/02/1370055302.db2.gz	LRCBUEMLEKJCMJ-CABCVRRESA-N	0	3	347.890	3.464	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1C[C@H](NCC(=C)Br)C12CCC2	ZINC001203275288	1370055733	/nfs/dbraw/zinc/05/57/33/1370055733.db2.gz	SBMHSQHDISEEQL-STQMWFEESA-N	0	3	341.293	3.124	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H]2C[C@H](NCc3ocnc3C)C23CCC3)CC1	ZINC001203375608	1370104855	/nfs/dbraw/zinc/10/48/55/1370104855.db2.gz	RJXVILHQVAJLMM-IRXDYDNUSA-N	0	3	343.471	3.246	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1C[C@@H](NCc2ccccn2)C12CCC2	ZINC001203450612	1370130489	/nfs/dbraw/zinc/13/04/89/1370130489.db2.gz	CUCUHCMKPZABHR-IAGOWNOFSA-N	0	3	327.472	3.201	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1C[C@H](NCc2cnc(C)o2)C12CCC2	ZINC001203450532	1370130660	/nfs/dbraw/zinc/13/06/60/1370130660.db2.gz	BMURUQWUXPAROF-HOTGVXAUSA-N	0	3	331.460	3.102	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@@H]2CN(Cc3cccc(C#N)c3)C[C@@H]21	ZINC001203757338	1370251303	/nfs/dbraw/zinc/25/13/03/1370251303.db2.gz	LKOZVTQCTKCEIV-MSOLQXFVSA-N	0	3	341.455	3.390	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CC2)C(=O)NC[C@H]3c2ccccc2)c1	ZINC001203762376	1370254521	/nfs/dbraw/zinc/25/45/21/1370254521.db2.gz	PTSDZBZGZIZJLL-FQEVSTJZSA-N	0	3	345.446	3.054	20	30		EGEDHN
N#Cc1cccc(CN2CCc3ncnc(-c4cccnc4)c3CC2)c1	ZINC001203762961	1370255468	/nfs/dbraw/zinc/25/54/68/1370255468.db2.gz	YHJWKDLIZDRNIA-UHFFFAOYSA-N	0	3	341.418	3.011	20	30		EGEDHN
C=CCN1C(=O)CCC[C@@]12CCCN(Cc1cccc(OC)c1)C2	ZINC001203821928	1370277915	/nfs/dbraw/zinc/27/79/15/1370277915.db2.gz	ZILLAVUMVUMAIZ-FQEVSTJZSA-N	0	3	328.456	3.228	20	30		EGEDHN
C=CCOc1ccc(CN2C[C@H]3[C@@H](C2)[C@@H]3NC(=O)OC(C)(C)C)cc1	ZINC001204297819	1370435216	/nfs/dbraw/zinc/43/52/16/1370435216.db2.gz	SUQIKFWPLHUKFR-PIIMJCKOSA-N	0	3	344.455	3.206	20	30		EGEDHN
C=CCOc1ccc(CN2CC[C@@H](Oc3ccc(OC)cn3)C2)cc1	ZINC001204302481	1370437395	/nfs/dbraw/zinc/43/73/95/1370437395.db2.gz	JVVPHXDIEBJIOJ-LJQANCHMSA-N	0	3	340.423	3.308	20	30		EGEDHN
COC(=O)N1CCC2(CCN(Cc3ccccc3C#N)CC2)CC1	ZINC001204366499	1370454662	/nfs/dbraw/zinc/45/46/62/1370454662.db2.gz	LFLTWCYCTZCTCU-UHFFFAOYSA-N	0	3	327.428	3.003	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@@]2(CCN(c3ccsc3)C2=O)C1	ZINC001204368564	1370455605	/nfs/dbraw/zinc/45/56/05/1370455605.db2.gz	YSJZUWUCGYMNHT-LJQANCHMSA-N	0	3	337.448	3.249	20	30		EGEDHN
O=C1C=C2CN(Cc3ccccc3OC(F)(F)F)CCC2S1	ZINC001204424352	1370473238	/nfs/dbraw/zinc/47/32/38/1370473238.db2.gz	GYHUNOIERCCLNN-CYBMUJFWSA-N	0	3	329.343	3.359	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)C2(C)CC2)CCCCC1	ZINC001115546817	1370543381	/nfs/dbraw/zinc/54/33/81/1370543381.db2.gz	FXUWFNDPEQCMPV-UHFFFAOYSA-N	0	3	329.282	3.104	20	30		EGEDHN
CCCCCCC[NH2+]C1(CNC(=O)c2cnc[n-]c2=O)CCCCC1	ZINC001115587756	1370588793	/nfs/dbraw/zinc/58/87/93/1370588793.db2.gz	WDJXSXDXGYQNHC-UHFFFAOYSA-N	0	3	348.491	3.175	20	30		EGEDHN
C#Cc1ccc(C(=O)NCC2(NCc3ccccn3)CCCCC2)cc1	ZINC001115658871	1370643845	/nfs/dbraw/zinc/64/38/45/1370643845.db2.gz	IJYLZYIVXDIYAO-UHFFFAOYSA-N	0	3	347.462	3.285	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N(Cc1ccccc1)[C@@H]1CN(C(C)C)C[C@H]1O	ZINC001205174999	1370669794	/nfs/dbraw/zinc/66/97/94/1370669794.db2.gz	GKYNQWIVSQSILX-DFQSSKMNSA-N	0	3	344.499	3.071	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2csc(C)n2)CCCCC1	ZINC001115691326	1370673323	/nfs/dbraw/zinc/67/33/23/1370673323.db2.gz	SXCULUJVAWKCJT-UHFFFAOYSA-N	0	3	327.881	3.226	20	30		EGEDHN
C=CCCCC(=O)NCC1(NCc2cccc(OC)n2)CCCCC1	ZINC001115701547	1370682263	/nfs/dbraw/zinc/68/22/63/1370682263.db2.gz	UHDKDTVGWHTZPQ-UHFFFAOYSA-N	0	3	345.487	3.355	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)/C=C/C(C)(C)C)CC[C@H]1c1ccc(F)cc1	ZINC001205269933	1370701371	/nfs/dbraw/zinc/70/13/71/1370701371.db2.gz	IHNARXCPGYXHQB-GMIBQGTOSA-N	0	3	342.458	3.335	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC1(NCc2cnc(C)nc2)CCCCC1	ZINC001115750074	1370730644	/nfs/dbraw/zinc/73/06/44/1370730644.db2.gz	IPHXRZBALOTEGZ-UHFFFAOYSA-N	0	3	344.503	3.296	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CC[C@@H]2CCCCO2)CCCCC1	ZINC001115754058	1370735477	/nfs/dbraw/zinc/73/54/77/1370735477.db2.gz	NVSWGPZSSJQZEP-INIZCTEOSA-N	0	3	342.911	3.497	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)/C(C)=C\CC)C[C@H]1c1cccc(F)c1	ZINC001205383588	1370737914	/nfs/dbraw/zinc/73/79/14/1370737914.db2.gz	DOIADXFIIJSNQL-RNAGXQGASA-N	0	3	328.431	3.089	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@H](C)CCC)C[C@H]1c1cccc(F)c1	ZINC001205391301	1370740265	/nfs/dbraw/zinc/74/02/65/1370740265.db2.gz	RAAZQZKKRFYVIU-AYOQOUSVSA-N	0	3	330.447	3.169	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cccn3ccnc23)CCCCC1	ZINC001115770935	1370755202	/nfs/dbraw/zinc/75/52/02/1370755202.db2.gz	JFEAIKNQADXILI-UHFFFAOYSA-N	0	3	346.862	3.109	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@H](C)C(CC)CC)[C@@H]3COC[C@@H]32)CC1	ZINC001205502660	1370774148	/nfs/dbraw/zinc/77/41/48/1370774148.db2.gz	IQRCZTIHLPMEFI-NZSAHSFTSA-N	0	3	348.531	3.184	20	30		EGEDHN
CCCCCCCCCC(=O)N1CC[C@@H](NCc2cncn2C)C1	ZINC001187366984	1388100049	/nfs/dbraw/zinc/10/00/49/1388100049.db2.gz	IFJVQPAFERGBBN-QGZVFWFLSA-N	0	3	334.508	3.251	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)N1CCC(CNCc2ccn(C(C)C)n2)CC1	ZINC001205955301	1370922230	/nfs/dbraw/zinc/92/22/30/1370922230.db2.gz	OXMFOMICQXABKE-SJORKVTESA-N	0	3	346.519	3.250	20	30		EGEDHN
C=C(CN1CCCC1)c1nc(-c2cc(OC)c(OC)cc2F)no1	ZINC001206099775	1370959680	/nfs/dbraw/zinc/95/96/80/1370959680.db2.gz	DFFWNIMXWZTKPL-UHFFFAOYSA-N	0	3	333.363	3.002	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC(CNCc3cc(C)no3)CC2)CC1	ZINC001206177017	1370981850	/nfs/dbraw/zinc/98/18/50/1370981850.db2.gz	ZOCNAHPVADIDSB-UHFFFAOYSA-N	0	3	331.460	3.058	20	30		EGEDHN
Cc1cc([C@@H](C)NC[C@H](O)COc2ccc(CC#N)cc2)c(C)o1	ZINC001326148446	1388119551	/nfs/dbraw/zinc/11/95/51/1388119551.db2.gz	ZSQMKPZKPVLLAM-PBHICJAKSA-N	0	3	328.412	3.053	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CN([C@H]2CCCc3ccc(F)cc32)C[C@H]1C	ZINC001206912550	1371221506	/nfs/dbraw/zinc/22/15/06/1371221506.db2.gz	QYVWIIQDFLSVSE-YSGRDPCXSA-N	0	3	342.458	3.443	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H]2CN(Cc3ccc(CF)cc3)C[C@H]21	ZINC001187569367	1388126797	/nfs/dbraw/zinc/12/67/97/1388126797.db2.gz	IXYUUYOCJQIUSJ-VQTJNVASSA-N	0	3	342.458	3.382	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(CNCc3cc(C)no3)CC2)CCCC1	ZINC001206977561	1371256074	/nfs/dbraw/zinc/25/60/74/1371256074.db2.gz	OGJYSEWHDQYCDG-UHFFFAOYSA-N	0	3	345.487	3.448	20	30		EGEDHN
CCC(=O)N1CCC[C@@H](NCC#Cc2ccc(C(F)(F)F)cc2)C1	ZINC001206982131	1371258765	/nfs/dbraw/zinc/25/87/65/1371258765.db2.gz	HXLDHVVAXHBVQJ-MRXNPFEDSA-N	0	3	338.373	3.048	20	30		EGEDHN
O=C(C1CCCC1)N1CCC[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207021816	1371269279	/nfs/dbraw/zinc/26/92/79/1371269279.db2.gz	PEAOZMHAIDAAQI-IBGZPJMESA-N	0	3	344.886	3.462	20	30		EGEDHN
O=C(c1ccccc1F)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001207091224	1371291131	/nfs/dbraw/zinc/29/11/31/1371291131.db2.gz	NICAYIBSWOJYRW-GOSISDBHSA-N	0	3	336.410	3.072	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1CN(CCOCC2CCC2)C[C@H]1C	ZINC001207107746	1371295902	/nfs/dbraw/zinc/29/59/02/1371295902.db2.gz	PFAKGSNUCBHXQW-VQIMIIECSA-N	0	3	334.504	3.008	20	30		EGEDHN
CC(C)N(Cc1cc(C#N)n(C)c1)[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC001207107850	1371296175	/nfs/dbraw/zinc/29/61/75/1371296175.db2.gz	COGAEUJFZSJSPW-INIZCTEOSA-N	0	3	346.475	3.117	20	30		EGEDHN
O=C(c1cccc(F)c1)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001207126708	1371302374	/nfs/dbraw/zinc/30/23/74/1371302374.db2.gz	QXFBXLGYGLRRQZ-FQEVSTJZSA-N	0	3	336.410	3.072	20	30		EGEDHN
CC(C)=CC(=O)N1CCC[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207167765	1371317888	/nfs/dbraw/zinc/31/78/88/1371317888.db2.gz	PQYOLAVAGZHXMQ-SFHVURJKSA-N	0	3	330.859	3.238	20	30		EGEDHN
C=CCN(CCN1CC[C@@H](c2ccncc2)C1)C(=O)OC(C)(C)C	ZINC001207205529	1371328440	/nfs/dbraw/zinc/32/84/40/1371328440.db2.gz	KKJKLTCOGSBABL-QGZVFWFLSA-N	0	3	331.460	3.294	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2CN(Cc3ccc(C)c(C)c3)C[C@H]2C)CCC1	ZINC001207522029	1371424463	/nfs/dbraw/zinc/42/44/63/1371424463.db2.gz	SONWGBJQQFTYMA-UYAOXDASSA-N	0	3	338.495	3.434	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cc3c([nH]2)CCC3)CCCCC1	ZINC001119993812	1371447059	/nfs/dbraw/zinc/44/70/59/1371447059.db2.gz	UJBBHLHLYWRWKI-UHFFFAOYSA-N	0	3	335.879	3.278	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207635493	1371459751	/nfs/dbraw/zinc/45/97/51/1371459751.db2.gz	LAFNJVYROAENTF-SFHVURJKSA-N	0	3	330.859	3.238	20	30		EGEDHN
CC(C)[C@H](C)CC(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207645154	1371462882	/nfs/dbraw/zinc/46/28/82/1371462882.db2.gz	KLJCYXZEFARDSK-XLIONFOSSA-N	0	3	344.474	3.440	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H](NCc2cc(Cl)cc3c2OCC3)C1	ZINC001207653512	1371465761	/nfs/dbraw/zinc/46/57/61/1371465761.db2.gz	ICRMALXTZBLUMH-KRWDZBQOSA-N	0	3	348.874	3.322	20	30		EGEDHN
O=C(CC1CCC1)N1CCC[C@@H](NCC#Cc2ccccc2Cl)C1	ZINC001207737679	1371489167	/nfs/dbraw/zinc/48/91/67/1371489167.db2.gz	JFVZSTNJVTVSJO-GOSISDBHSA-N	0	3	344.886	3.462	20	30		EGEDHN
CC1(C)C(C(=O)N2CCC[C@H](NCC#Cc3ccccc3)C2)C1(C)C	ZINC001207749417	1371493455	/nfs/dbraw/zinc/49/34/55/1371493455.db2.gz	DSJNAVKZLGMAIN-SFHVURJKSA-N	0	3	338.495	3.301	20	30		EGEDHN
C#CCCN1C[C@@H](C)[C@H](NC(=O)C2(CC)CCC(F)(F)CC2)C1	ZINC001207754232	1371494965	/nfs/dbraw/zinc/49/49/65/1371494965.db2.gz	QLJDRZGEBQFUMR-HUUCEWRRSA-N	0	3	326.431	3.052	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)CCOC(C)C)C1	ZINC001120317887	1371531177	/nfs/dbraw/zinc/53/11/77/1371531177.db2.gz	CPGNRKIAPPXNBI-IRXDYDNUSA-N	0	3	342.911	3.257	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)c2ccc(CCCC)cc2)C1	ZINC001207897543	1371532201	/nfs/dbraw/zinc/53/22/01/1371532201.db2.gz	NNDXYIRYMTXXRD-YLJYHZDGSA-N	0	3	344.499	3.282	20	30		EGEDHN
C=CCOC[C@@H]1c2c(ncn2C)CCN1C[C@@H](C)c1ccccc1	ZINC001207904160	1371533291	/nfs/dbraw/zinc/53/32/91/1371533291.db2.gz	CNKURKKSZAMQNB-VQIMIIECSA-N	0	3	325.456	3.326	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)CCCOCC)C1	ZINC001120329691	1371537230	/nfs/dbraw/zinc/53/72/30/1371537230.db2.gz	UKLNVCZOQMKIMM-IRXDYDNUSA-N	0	3	342.911	3.259	20	30		EGEDHN
C#CCOCCC(=O)N1CCC[C@H](N[C@@H](C)c2ccccc2Cl)C1	ZINC001208029492	1371574361	/nfs/dbraw/zinc/57/43/61/1371574361.db2.gz	XKRFOMCVGSXABV-HOTGVXAUSA-N	0	3	348.874	3.022	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1CN(CCc2scnc2C)C[C@H]1C	ZINC001208294968	1371705177	/nfs/dbraw/zinc/70/51/77/1371705177.db2.gz	URKMNMDZJWQNGC-UKRRQHHQSA-N	0	3	335.517	3.033	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN(CC[C@H]2CC2(Cl)Cl)C[C@H]1C	ZINC001208315034	1371712405	/nfs/dbraw/zinc/71/24/05/1371712405.db2.gz	GVJBFWBPOVHPCZ-FRRDWIJNSA-N	0	3	333.303	3.219	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CN(Cc2ccc3c(c2)COC3)C[C@H]1C	ZINC001208387761	1371748251	/nfs/dbraw/zinc/74/82/51/1371748251.db2.gz	AYCYRCKABRZYDU-RZQQEMMASA-N	0	3	342.483	3.256	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1CN(CCOc2ccc(C)cc2)C[C@H]1C	ZINC001208395668	1371752944	/nfs/dbraw/zinc/75/29/44/1371752944.db2.gz	AUNFBIWYQBLIRB-QWFCFKBJSA-N	0	3	344.499	3.413	20	30		EGEDHN
C/C=C(/C)C(=O)NC1CC2(CC(NCc3cc(F)ccc3C#N)C2)C1	ZINC001120914503	1371805641	/nfs/dbraw/zinc/80/56/41/1371805641.db2.gz	HATGJGAIRSRPPX-DXNYSGJVSA-N	0	3	341.430	3.181	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC1CC2(CC(NCc3conc3C)C2)C1	ZINC001121155332	1371870110	/nfs/dbraw/zinc/87/01/10/1371870110.db2.gz	ANLBCMQUHAYBLK-UHFFFAOYSA-N	0	3	343.471	3.268	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC1CC2(CC(NCc3nccs3)C2)C1	ZINC001121155741	1371870316	/nfs/dbraw/zinc/87/03/16/1371870316.db2.gz	SVDUGRLXQWNVDR-UHFFFAOYSA-N	0	3	345.512	3.429	20	30		EGEDHN
O=C(N1CCC[C@H](NCC#Cc2ccccc2)C1)C1(C2CC2)CCC1	ZINC001208770236	1371890048	/nfs/dbraw/zinc/89/00/48/1371890048.db2.gz	RCJQLAPRUHQXJJ-FQEVSTJZSA-N	0	3	336.479	3.199	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC[C@@H](NCc2cnc(C)s2)C1	ZINC001209005297	1371972959	/nfs/dbraw/zinc/97/29/59/1371972959.db2.gz	UNKRCXGXJJZRAC-MRXNPFEDSA-N	0	3	333.501	3.116	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001209050003	1371983506	/nfs/dbraw/zinc/98/35/06/1371983506.db2.gz	BHTRHWYRXXCRMC-WRFQGRBFSA-N	0	3	340.442	3.280	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001209049999	1371983792	/nfs/dbraw/zinc/98/37/92/1371983792.db2.gz	BHTRHWYRXXCRMC-GPGPQOAVSA-N	0	3	340.442	3.280	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC1CC2(C1)CC(N[C@@H](C)c1cnccn1)C2	ZINC001121527222	1372000571	/nfs/dbraw/zinc/00/05/71/1372000571.db2.gz	CGNHJBKBJDOARM-VPDSAYSTSA-N	0	3	342.487	3.157	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@@H](NCc2cccc(C(C)C)n2)C1	ZINC001209112863	1372001437	/nfs/dbraw/zinc/00/14/37/1372001437.db2.gz	WRXGFONRNUBHMP-LJQANCHMSA-N	0	3	341.499	3.479	20	30		EGEDHN
C#CCCCN1CCN(c2ccc(C(F)(F)F)c(Cl)n2)CC1	ZINC001209265732	1372054898	/nfs/dbraw/zinc/05/48/98/1372054898.db2.gz	GHNOCVVXBAWEQZ-UHFFFAOYSA-N	0	3	331.769	3.289	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)C1(C(C)(F)F)CC1)C2	ZINC001121791157	1372082251	/nfs/dbraw/zinc/08/22/51/1372082251.db2.gz	JDKYCRTZJHMIMH-UHFFFAOYSA-N	0	3	332.822	3.191	20	30		EGEDHN
C=CCCCCCN1CCO[C@]2(CCCN(c3cccnc3)C2)C1	ZINC001209423338	1372102975	/nfs/dbraw/zinc/10/29/75/1372102975.db2.gz	SPDITSMNCQDYGK-HXUWFJFHSA-N	0	3	329.488	3.499	20	30		EGEDHN
C=CCCCCCCN1CCN(CCNC(=O)OC(C)(C)C)CC1	ZINC001209431866	1372104477	/nfs/dbraw/zinc/10/44/77/1372104477.db2.gz	VEMONOJKEQIYCC-UHFFFAOYSA-N	0	3	339.524	3.265	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC[C@@H](NCc3cnc(C)s3)C2)CC1	ZINC001209464120	1372113052	/nfs/dbraw/zinc/11/30/52/1372113052.db2.gz	BCPJYWVUKXNQMB-OAHLLOKOSA-N	0	3	333.501	3.279	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3c[nH]c4c3cccc4C)C2)C1=O	ZINC001209482208	1372117862	/nfs/dbraw/zinc/11/78/62/1372117862.db2.gz	GIUDVVIEYCHGCH-OAQYLSRUSA-N	0	3	337.467	3.477	20	30		EGEDHN
CCCC1(C(=O)N2CCC[C@@H](NCc3ccc(C#N)c(F)c3)C2)CC1	ZINC001209534934	1372130594	/nfs/dbraw/zinc/13/05/94/1372130594.db2.gz	GFQFPSCKCVCIBI-QGZVFWFLSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@H](NCc2c(C)nsc2C)C1	ZINC001209867408	1372217914	/nfs/dbraw/zinc/21/79/14/1372217914.db2.gz	YPNGWDUCXGUMFD-HNNXBMFYSA-N	0	3	335.517	3.443	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CCCN(C)C2)nnc1N1CC(C)(C)C[C@H]1C	ZINC001122543598	1372271389	/nfs/dbraw/zinc/27/13/89/1372271389.db2.gz	LHKKOZPUUMBGPO-CVEARBPZSA-N	0	3	331.508	3.288	20	30		EGEDHN
C=C(C)Cn1c(-c2ccsc2)nnc1N1CCN(CC2CC2)CC1	ZINC001122546620	1372271850	/nfs/dbraw/zinc/27/18/50/1372271850.db2.gz	ZURDIMBDQHRSGK-UHFFFAOYSA-N	0	3	343.500	3.115	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)[C@@H](CCCCC)C(C)C)C1	ZINC001210111574	1372273640	/nfs/dbraw/zinc/27/36/40/1372273640.db2.gz	MGVCTRWRZRMJTL-CEXWTWQISA-N	0	3	338.536	3.478	20	30		EGEDHN
N#CC(C(=O)CCc1nnc(C2CCCC2)o1)c1cccc(F)n1	ZINC001122632197	1372287977	/nfs/dbraw/zinc/28/79/77/1372287977.db2.gz	RKVAUHURBJRDTC-GFCCVEGCSA-N	0	3	328.347	3.070	20	30		EGEDHN
CC(C)(C)CCC(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001210206537	1372294463	/nfs/dbraw/zinc/29/44/63/1372294463.db2.gz	NMERQTKOOOQNAM-IBGZPJMESA-N	0	3	326.484	3.445	20	30		EGEDHN
CC(C)C[C@H](C)C(=O)N1CCC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001210358883	1372332238	/nfs/dbraw/zinc/33/22/38/1372332238.db2.gz	QISCAOBNXNPUNO-MAUKXSAKSA-N	0	3	345.462	3.460	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCC(=O)c1ccc2c(c1)CCC2	ZINC001123234496	1372403665	/nfs/dbraw/zinc/40/36/65/1372403665.db2.gz	WAEFELSQQWQPIJ-KRWDZBQOSA-N	0	3	335.407	3.231	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)CCOc2cc(C)ccc2C)C1	ZINC001210769080	1372423738	/nfs/dbraw/zinc/42/37/38/1372423738.db2.gz	VIUDCTYKGCDIIP-QZTJIDSGSA-N	0	3	330.472	3.085	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCC(=O)c1cc(C)sc1C	ZINC001123338101	1372431596	/nfs/dbraw/zinc/43/15/96/1372431596.db2.gz	YBXPINYOMQPJON-CQSZACIVSA-N	0	3	329.425	3.421	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C(C)(C)C(C)(F)F)C[C@H]1c1ccccc1	ZINC001211715718	1372607558	/nfs/dbraw/zinc/60/75/58/1372607558.db2.gz	KQMKXPWSUAKWTR-DLBZAZTESA-N	0	3	348.437	3.275	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)Cc2ccsc2)[C@H](OC)C1	ZINC001211795584	1372616685	/nfs/dbraw/zinc/61/66/85/1372616685.db2.gz	VCPSRIAGBLGWFF-IAGOWNOFSA-N	0	3	338.517	3.076	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2ccccc2C(C)(C)C)[C@H](OC)C1	ZINC001212444283	1372707717	/nfs/dbraw/zinc/70/77/17/1372707717.db2.gz	NVFMFQNSUVQLFY-RTBURBONSA-N	0	3	344.499	3.379	20	30		EGEDHN
C=C[C@H](CC(=O)N1CC[C@@H](NCc2cnccc2C)C1)c1ccccc1	ZINC001188040511	1388224553	/nfs/dbraw/zinc/22/45/53/1388224553.db2.gz	QBTPOSAYTCKCHN-WIYYLYMNSA-N	0	3	349.478	3.440	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H](NC(=O)c2ccc(CC)s2)[C@H](OC)C1	ZINC001213133697	1372846871	/nfs/dbraw/zinc/84/68/71/1372846871.db2.gz	UTEWALQYZOGUEY-FVQBIDKESA-N	0	3	336.501	3.094	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CN(CCCCCCC)C[C@H]2OC)cc1	ZINC001213250671	1372868108	/nfs/dbraw/zinc/86/81/08/1372868108.db2.gz	GQBNEYZFQUPGHY-WOJBJXKFSA-N	0	3	342.483	3.067	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2ccc(Cl)c(C)c2)[C@H](OC)C1	ZINC001213364920	1372893495	/nfs/dbraw/zinc/89/34/95/1372893495.db2.gz	MMNJQQKMNLHSGL-IAGOWNOFSA-N	0	3	336.863	3.044	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)[C@]23C[C@H]2CCCC3)[C@H](OC)C1	ZINC001213403619	1372901794	/nfs/dbraw/zinc/90/17/94/1372901794.db2.gz	JFEFAFZGCXTSMI-SOAMZJECSA-N	0	3	334.504	3.129	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccoc2)C[C@H]1NCC#Cc1ccc(Cl)cc1	ZINC001214132243	1373013089	/nfs/dbraw/zinc/01/30/89/1373013089.db2.gz	QDJHBRJVTRGAMB-RDTXWAMCSA-N	0	3	342.826	3.035	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1C[C@@H](C)[C@H](NCc2cc(C)ccc2F)C1	ZINC001214282071	1373037471	/nfs/dbraw/zinc/03/74/71/1373037471.db2.gz	BDKUWAWPUOOICF-GPMSIDNRSA-N	0	3	348.462	3.052	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@H](NCc2cccc(OC)c2Cl)C1	ZINC001214303824	1373040492	/nfs/dbraw/zinc/04/04/92/1373040492.db2.gz	BEUUEBJDLJFPHY-UKRRQHHQSA-N	0	3	336.863	3.251	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@H](NCc2ccccc2OC2CC2)C1	ZINC001214304457	1373040637	/nfs/dbraw/zinc/04/06/37/1373040637.db2.gz	UGKIJISTUOXPEC-CRAIPNDOSA-N	0	3	328.456	3.131	20	30		EGEDHN
COc1ccc(C(C)C)cc1CNCCNC(=O)C#CC(C)(C)C	ZINC001126916497	1373051820	/nfs/dbraw/zinc/05/18/20/1373051820.db2.gz	VOPZFDVOOCBLQZ-UHFFFAOYSA-N	0	3	330.472	3.074	20	30		EGEDHN
C[C@@H]1CN(C(=O)C=C2CCC2)C[C@H]1NCC#Cc1cccc(Cl)c1	ZINC001214426539	1373059198	/nfs/dbraw/zinc/05/91/98/1373059198.db2.gz	CGDOTPDOXAUYNJ-DNVCBOLYSA-N	0	3	342.870	3.238	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2cc(C(F)F)ccc2F)c1	ZINC001127486643	1373130982	/nfs/dbraw/zinc/13/09/82/1373130982.db2.gz	RVNDMDPDOHTICG-UHFFFAOYSA-N	0	3	347.340	3.155	20	30		EGEDHN
C=C(C)CNCc1ccncc1O[C@H]1CCN(C(=O)CCCCC)C1	ZINC001127868002	1373192469	/nfs/dbraw/zinc/19/24/69/1373192469.db2.gz	XKQZFSNPKAWHJX-SFHVURJKSA-N	0	3	345.487	3.307	20	30		EGEDHN
C#CCCCCCC(=O)N1C[C@@H](C)[C@H](NCC=C(Cl)Cl)C1	ZINC001215324870	1373198150	/nfs/dbraw/zinc/19/81/50/1373198150.db2.gz	QJHCPQJZVSSAIP-ZIAGYGMSSA-N	0	3	331.287	3.326	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCCC2CC2)C[C@H]1NCc1ccc(C#N)s1	ZINC001215367740	1373203637	/nfs/dbraw/zinc/20/36/37/1373203637.db2.gz	UHFIEORNDOSNOY-CXAGYDPISA-N	0	3	331.485	3.137	20	30		EGEDHN
COc1ccc(CNCCNC(=O)CCCCC(C)(C)C)cc1C#N	ZINC001128044405	1373212043	/nfs/dbraw/zinc/21/20/43/1373212043.db2.gz	PGWJCTISDYXDNT-UHFFFAOYSA-N	0	3	345.487	3.379	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NCCNCc1ccc(Cl)c(F)c1	ZINC001128209055	1373235429	/nfs/dbraw/zinc/23/54/29/1373235429.db2.gz	NAHQOGXXEQQYQJ-UHFFFAOYSA-N	0	3	333.234	3.464	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@@H]2CC23CCCC3)C[C@H]1NCC#Cc1ccccc1	ZINC001216212672	1373281073	/nfs/dbraw/zinc/28/10/73/1373281073.db2.gz	CIHHYTYQUMZMRE-YZGWKJHDSA-N	0	3	336.479	3.055	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NCCNCc1ccccc1OC(C)C)OCC	ZINC001128528681	1373284352	/nfs/dbraw/zinc/28/43/52/1373284352.db2.gz	RPBPRSBTURVQSQ-LJQANCHMSA-N	0	3	348.487	3.051	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)C3CCCCC3)[C@H]2C1	ZINC001217201270	1373405059	/nfs/dbraw/zinc/40/50/59/1373405059.db2.gz	YSPTUZMLMPZIRJ-RBUKOAKNSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCOc1ccc(C(=O)NCCNCc2csc(C)c2)cc1	ZINC001130371150	1373508008	/nfs/dbraw/zinc/50/80/08/1373508008.db2.gz	FMBLKZYVPLWPSU-UHFFFAOYSA-N	0	3	330.453	3.141	20	30		EGEDHN
N#Cc1ccc(-c2ccc(Cl)cc2)nc1O[C@H]1CCNC[C@H]1F	ZINC001218066562	1373551698	/nfs/dbraw/zinc/55/16/98/1373551698.db2.gz	MAURDZDLOPVEDN-ZBFHGGJFSA-N	0	3	331.778	3.352	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)c3cc(C)cc(Cl)c3)[C@H]2C1	ZINC001218299444	1373590273	/nfs/dbraw/zinc/59/02/73/1373590273.db2.gz	ZCSXNHAKDNJWID-ZWKOTPCHSA-N	0	3	348.874	3.140	20	30		EGEDHN
C=C[C@H](C#CC(C)(C)C)Oc1nc2onc(C)c2c2c1CNCC2	ZINC001218414478	1373610284	/nfs/dbraw/zinc/61/02/84/1373610284.db2.gz	ZAZGAZWDQYUVSS-CYBMUJFWSA-N	0	3	325.412	3.160	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)Nc1ccc(Br)nc1	ZINC001218538651	1373631713	/nfs/dbraw/zinc/63/17/13/1373631713.db2.gz	PSIRUDXEQATSBC-LBPRGKRZSA-N	0	3	326.238	3.246	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)c3ccc(C)c(Cl)c3)[C@H]2C1	ZINC001218576372	1373634065	/nfs/dbraw/zinc/63/40/65/1373634065.db2.gz	ZPVBNONNOIKROZ-ZWKOTPCHSA-N	0	3	348.874	3.140	20	30		EGEDHN
C=C1CCC(C(=O)N2CCO[C@@H]3CN(CCCCCC)C[C@@H]32)CC1	ZINC001218591064	1373634808	/nfs/dbraw/zinc/63/48/08/1373634808.db2.gz	UFZWDPCJAVJJQB-RBUKOAKNSA-N	0	3	334.504	3.225	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)[C@H]2CCC[C@@H]2c2ccccc2)c1	ZINC001131157834	1373655563	/nfs/dbraw/zinc/65/55/63/1373655563.db2.gz	ZJVUWHHWINEBOW-RTWAWAEBSA-N	0	3	347.462	3.348	20	30		EGEDHN
N#Cc1cc(NC(=O)[C@@H](N)CC2CCCC2)ccc1N1CCCCC1	ZINC001218944840	1373669973	/nfs/dbraw/zinc/66/99/73/1373669973.db2.gz	RAQGIWRNBKLHDL-SFHVURJKSA-N	0	3	340.471	3.395	20	30		EGEDHN
CNc1ccc(C#N)cc1NC(=O)[C@H](N)C12CC3CC(CC(C3)C1)C2	ZINC001218981793	1373674285	/nfs/dbraw/zinc/67/42/85/1373674285.db2.gz	VPVFUBDXYIYCMF-ITOSSNOYSA-N	0	3	338.455	3.082	20	30		EGEDHN
C=CCCOc1ccc(C(=O)Nc2ccc3c(c2)CNCCO3)cc1	ZINC001219029549	1373681550	/nfs/dbraw/zinc/68/15/50/1373681550.db2.gz	CHSLWOCXZMHBRI-UHFFFAOYSA-N	0	3	338.407	3.376	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@H](CC)CCCC)[C@@H](O)C1	ZINC001219240181	1373694865	/nfs/dbraw/zinc/69/48/65/1373694865.db2.gz	DXFGZTZJCSSQPW-KURKYZTESA-N	0	3	326.525	3.335	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)C2(CC=C)CCCC2)[C@@H](O)C1	ZINC001221197043	1373767948	/nfs/dbraw/zinc/76/79/48/1373767948.db2.gz	RZLZGNJOMBXVJV-MSOLQXFVSA-N	0	3	334.504	3.031	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)[C@H]2CCCC[C@@H]2C2CC2)ccc1F	ZINC001131743404	1373782027	/nfs/dbraw/zinc/78/20/27/1373782027.db2.gz	ZGPOBUFQCULQTJ-MSOLQXFVSA-N	0	3	343.446	3.120	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)CCCc3ccccc3Cl)[C@@H]2C1	ZINC001221603766	1373782401	/nfs/dbraw/zinc/78/24/01/1373782401.db2.gz	ZBDPUTLIMJMIST-IEBWSBKVSA-N	0	3	344.886	3.219	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)C3CCCCCCC3)[C@@H]2C1	ZINC001188517985	1388324663	/nfs/dbraw/zinc/32/46/63/1388324663.db2.gz	KFIHKRCKEHAMMY-RBUKOAKNSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC[C@@H](C)N(CCOc2ccc(OC)cc2)C1	ZINC001131895254	1375032721	/nfs/dbraw/zinc/03/27/21/1375032721.db2.gz	HNGAZIAOLQFORX-SJORKVTESA-N	0	3	346.471	3.009	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC1CCN(Cc2cnccc2C)CC1	ZINC001224013628	1375052292	/nfs/dbraw/zinc/05/22/92/1375052292.db2.gz	CNSBHDHPFKIPPE-UHFFFAOYSA-N	0	3	329.488	3.321	20	30		EGEDHN
C=CCOCCCC(=O)N[C@H]1CC[C@H](C)N(Cc2ccc(C)cc2)C1	ZINC001131940184	1375058524	/nfs/dbraw/zinc/05/85/24/1375058524.db2.gz	ZTEPEHZVYBGNRC-ICSRJNTNSA-N	0	3	344.499	3.447	20	30		EGEDHN
O=C(N[C@@H]1CCCC[C@H]1NCC#Cc1ccc(F)cc1)c1ccoc1	ZINC001224765960	1375075606	/nfs/dbraw/zinc/07/56/06/1375075606.db2.gz	KJBSUPKJDSCBHC-RTBURBONSA-N	0	3	340.398	3.101	20	30		EGEDHN
CCCCC(=O)N[C@@H]1CCCC[C@H]1NCc1ccc(C#N)cc1F	ZINC001224871875	1375081829	/nfs/dbraw/zinc/08/18/29/1375081829.db2.gz	ZPLANOLQDKKNRM-QZTJIDSGSA-N	0	3	331.435	3.405	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CC[C@@H](C)N(CCc2ccccc2F)C1	ZINC001132002012	1375092173	/nfs/dbraw/zinc/09/21/73/1375092173.db2.gz	GILLUQDDXSXOGJ-AEFFLSMTSA-N	0	3	330.447	3.141	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@H](C)N(Cc2ccc3cc[nH]c3c2)C1	ZINC001132003597	1375094218	/nfs/dbraw/zinc/09/42/18/1375094218.db2.gz	XRFQCXXDKCCGRC-QFBILLFUSA-N	0	3	337.467	3.441	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)C2(c3ccc(C)cc3)CCC2)CC1	ZINC001225618236	1375132640	/nfs/dbraw/zinc/13/26/40/1375132640.db2.gz	XUDRDFZOKUZGAP-UHFFFAOYSA-N	0	3	338.495	3.268	20	30		EGEDHN
C=CCCCN1C[C@H](NC(=O)c2nc3c(s2)CCC3)CC[C@@H]1C	ZINC001132187009	1375195825	/nfs/dbraw/zinc/19/58/25/1375195825.db2.gz	GYPKHRDEMSSKNN-UONOGXRCSA-N	0	3	333.501	3.181	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)CC(C)(C)CC(F)F)CC[C@H]1C	ZINC001132190695	1375197216	/nfs/dbraw/zinc/19/72/16/1375197216.db2.gz	MPDQGICMRXIOKF-HUUCEWRRSA-N	0	3	346.462	3.230	20	30		EGEDHN
CCCCCCC[N@@H+]1C[C@H](NC(=O)c2c(C)nc[n-]c2=O)CC[C@H]1C	ZINC001132235684	1375231170	/nfs/dbraw/zinc/23/11/70/1375231170.db2.gz	ROKUPACLVQGOMW-GDBMZVCRSA-N	0	3	348.491	3.044	20	30		EGEDHN
CCCCCCC[N@H+]1C[C@H](NC(=O)c2c(C)nc[n-]c2=O)CC[C@H]1C	ZINC001132235684	1375231174	/nfs/dbraw/zinc/23/11/74/1375231174.db2.gz	ROKUPACLVQGOMW-GDBMZVCRSA-N	0	3	348.491	3.044	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC1CCN(Cc2ccc(CF)cc2)CC1	ZINC001226455559	1375262237	/nfs/dbraw/zinc/26/22/37/1375262237.db2.gz	GFUVOJUSEBOHTJ-INIZCTEOSA-N	0	3	348.462	3.218	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CC[C@@H](C)N(CCOCC(C)C)C2)CCC1	ZINC001132283177	1375266021	/nfs/dbraw/zinc/26/60/21/1375266021.db2.gz	TVZSNIVZFKKGSV-QZTJIDSGSA-N	0	3	336.520	3.375	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC1CCN([C@H]2CCc3ccc(Cl)cc32)CC1	ZINC001226641284	1375298461	/nfs/dbraw/zinc/29/84/61/1375298461.db2.gz	XYEJFCHNGJWPPJ-SJCJKPOMSA-N	0	3	331.847	3.068	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2c(C)cccc2C)CC[C@H]1C	ZINC001132322861	1375301357	/nfs/dbraw/zinc/30/13/57/1375301357.db2.gz	WFZUSAPYYCUXMW-MSOLQXFVSA-N	0	3	330.472	3.089	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc(CCCCC)n[nH]2)CC[C@H]1C	ZINC001132348727	1375325269	/nfs/dbraw/zinc/32/52/69/1375325269.db2.gz	RESHSLKYQHVOAS-NVXWUHKLSA-N	0	3	332.492	3.301	20	30		EGEDHN
C#CCCCCC(=O)NC1CCN(CCOc2ccc(C)cc2)CC1	ZINC001226961666	1375372462	/nfs/dbraw/zinc/37/24/62/1375372462.db2.gz	JRYMDECVYMWHAF-UHFFFAOYSA-N	0	3	342.483	3.148	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CC[C@H](C)N(CC=C(C)C)C2)CCOCC1	ZINC001132454048	1375396990	/nfs/dbraw/zinc/39/69/90/1375396990.db2.gz	VGLVFCCIAGZGCS-ZWKOTPCHSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2ccc(CC)cc2)CC[C@@H]1C	ZINC001132458318	1375401030	/nfs/dbraw/zinc/40/10/30/1375401030.db2.gz	TZOSTPMROFGQMN-QFBILLFUSA-N	0	3	330.472	3.034	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2ccc(C)cc2C)CC[C@@H]1C	ZINC001132458187	1375401136	/nfs/dbraw/zinc/40/11/36/1375401136.db2.gz	QXZFZINJAVNJKE-ZWKOTPCHSA-N	0	3	330.472	3.089	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCCOc2ccc(C)cc2)CC[C@H]1C	ZINC001132459652	1375402134	/nfs/dbraw/zinc/40/21/34/1375402134.db2.gz	CLHMFRJVGLUMFE-MSOLQXFVSA-N	0	3	330.472	3.309	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCc2nc3ccccc3o2)CC[C@@H]1C	ZINC001132477525	1375415177	/nfs/dbraw/zinc/41/51/77/1375415177.db2.gz	FGNGMZOWTUGAAN-HOTGVXAUSA-N	0	3	341.455	3.306	20	30		EGEDHN
CC1(CC(=O)N[C@@H]2CCCC[C@H]2NCc2ccc(C#N)cc2F)CC1	ZINC001227603401	1375451083	/nfs/dbraw/zinc/45/10/83/1375451083.db2.gz	PKVHGIXNDGFCGT-QZTJIDSGSA-N	0	3	343.446	3.405	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)C2(C)C(C)(C)C2(C)C)CC[C@H]1C	ZINC001132546549	1375453796	/nfs/dbraw/zinc/45/37/96/1375453796.db2.gz	NVOXKIITVTWGDR-CVEARBPZSA-N	0	3	336.520	3.230	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)C1(CCF)CC1	ZINC001227680771	1375460700	/nfs/dbraw/zinc/46/07/00/1375460700.db2.gz	MYDSZHULNIGXPQ-CHWSQXEVSA-N	0	3	347.272	3.052	20	30		EGEDHN
C#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)C[C@H](C)CC)CC1	ZINC001132554732	1375460817	/nfs/dbraw/zinc/46/08/17/1375460817.db2.gz	LBTCDZAHXPJKJZ-UYAOXDASSA-N	0	3	341.499	3.334	20	30		EGEDHN
CC#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)CCCF)CC1	ZINC001132555603	1375463027	/nfs/dbraw/zinc/46/30/27/1375463027.db2.gz	XDGJBJGASKZDEP-IBGZPJMESA-N	0	3	345.462	3.038	20	30		EGEDHN
C#CCN1CC[C@H](CN(Cc2scnc2C)C(=O)[C@H](C)CCC)C1	ZINC001132558306	1375465282	/nfs/dbraw/zinc/46/52/82/1375465282.db2.gz	KTCHEANNEXADFH-WBVHZDCISA-N	0	3	347.528	3.171	20	30		EGEDHN
C#CCN1CC[C@@H](CN(Cc2scnc2C)C(=O)[C@H](C)CCC)C1	ZINC001132558304	1375465587	/nfs/dbraw/zinc/46/55/87/1375465587.db2.gz	KTCHEANNEXADFH-NVXWUHKLSA-N	0	3	347.528	3.171	20	30		EGEDHN
C#CCN1CC[C@H](CN(Cc2scnc2C)C(=O)[C@@H](C)C(C)C)C1	ZINC001132562062	1375468804	/nfs/dbraw/zinc/46/88/04/1375468804.db2.gz	DNIJEGZJDMAIKX-RDJZCZTQSA-N	0	3	347.528	3.027	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2N(Cc2ccsc2)C(=O)C(C)C)CC1	ZINC001132563988	1375469313	/nfs/dbraw/zinc/46/93/13/1375469313.db2.gz	ZZPKVGRUYDTZDA-QGZVFWFLSA-N	0	3	330.497	3.220	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCCNCc1csc(Br)c1	ZINC001132667840	1375505600	/nfs/dbraw/zinc/50/56/00/1375505600.db2.gz	URKKEXLSUZTAFX-LLVKDONJSA-N	0	3	345.306	3.319	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](C)[C@H](CNCc2nc(C)sc2C)C1	ZINC001132786219	1375563680	/nfs/dbraw/zinc/56/36/80/1375563680.db2.gz	QHDWPGXPQUQRPH-RHSMWYFYSA-N	0	3	347.528	3.138	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](C)[C@H](CNCc2cnc(C)o2)C1	ZINC001132843344	1375595098	/nfs/dbraw/zinc/59/50/98/1375595098.db2.gz	LNZGPSOAOMFTSS-CRAIPNDOSA-N	0	3	345.487	3.326	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](C)[C@H](CNCc2nccs2)C1	ZINC001132846902	1375598529	/nfs/dbraw/zinc/59/85/29/1375598529.db2.gz	OFNYKORTPHJOIL-LSDHHAIUSA-N	0	3	335.517	3.320	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC1CCN(Cc2ccc(OC)cc2)CC1	ZINC001228580583	1375604973	/nfs/dbraw/zinc/60/49/73/1375604973.db2.gz	WULDLJGGQFLYGM-UHFFFAOYSA-N	0	3	330.472	3.378	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CCN(Cc2ccc(OC)c(C)c2)CC1	ZINC001228631578	1375621600	/nfs/dbraw/zinc/62/16/00/1375621600.db2.gz	PKDPBRKQNLPULI-UHFFFAOYSA-N	0	3	330.472	3.296	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NC1CCN(CCOCc2ccccc2)CC1	ZINC001228748208	1375660052	/nfs/dbraw/zinc/66/00/52/1375660052.db2.gz	KDSRYULOCMWGIS-MSOLQXFVSA-N	0	3	344.499	3.242	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC1CCN(CCOc2ccccc2)CC1	ZINC001228794813	1375678725	/nfs/dbraw/zinc/67/87/25/1375678725.db2.gz	NCEMYYPLURPTRC-QGZVFWFLSA-N	0	3	330.472	3.248	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC1CCN(Cc2cccc(N(C)C)c2)CC1	ZINC001228809465	1375682893	/nfs/dbraw/zinc/68/28/93/1375682893.db2.gz	IPLCRKWRLLHJBK-QGZVFWFLSA-N	0	3	343.515	3.436	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H](CC)OC1CCCC1	ZINC001228877917	1375702902	/nfs/dbraw/zinc/70/29/02/1375702902.db2.gz	PALYBSOFYWOYPH-BRWVUGGUSA-N	0	3	342.911	3.494	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](C)[C@H](CNCc2nccs2)C1	ZINC001133038339	1375728582	/nfs/dbraw/zinc/72/85/82/1375728582.db2.gz	APFSXSPCGKFVIZ-DLBZAZTESA-N	0	3	347.528	3.301	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](C)[C@@H](CNCc2cnc(C)o2)C1	ZINC001133038899	1375729804	/nfs/dbraw/zinc/72/98/04/1375729804.db2.gz	HSZUQCBBMCZGKJ-AEFFLSMTSA-N	0	3	345.487	3.141	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](C)[C@H](CNCc2ncc(C)s2)C1	ZINC001133068673	1375756224	/nfs/dbraw/zinc/75/62/24/1375756224.db2.gz	JIQWIBTYCKDMDR-DOTOQJQBSA-N	0	3	347.528	3.219	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@H]2CN(Cc3cccc(OC)c3)C[C@H]21	ZINC001188883878	1388399058	/nfs/dbraw/zinc/39/90/58/1388399058.db2.gz	ASSVKYDTBHFZDV-IMFGXOCKSA-N	0	3	342.483	3.330	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](C)[C@H](CNCc3ocnc3C)C2)CCC1	ZINC001133105314	1375778596	/nfs/dbraw/zinc/77/85/96/1375778596.db2.gz	SBXMTWBSTJBDBB-NVXWUHKLSA-N	0	3	345.487	3.304	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cccc(Cl)c2F)cc1F	ZINC001133215853	1375848253	/nfs/dbraw/zinc/84/82/53/1375848253.db2.gz	RTXOTUKZMCUMBF-UHFFFAOYSA-N	0	3	349.768	3.009	20	30		EGEDHN
Cc1ccc(C(=O)NCCNCc2ccc(C#N)c(F)c2)cc1Cl	ZINC001133261631	1375877283	/nfs/dbraw/zinc/87/72/83/1375877283.db2.gz	QOALHQUGVXLMOX-UHFFFAOYSA-N	0	3	345.805	3.179	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1ccoc1C	ZINC001133377076	1375958551	/nfs/dbraw/zinc/95/85/51/1375958551.db2.gz	LSQRNCSPZAUJLO-UHFFFAOYSA-N	0	3	330.815	3.107	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H]1CC[C@H](F)C1	ZINC001133401529	1375984679	/nfs/dbraw/zinc/98/46/79/1375984679.db2.gz	FTGGFBZGVIMYMI-WBVHZDCISA-N	0	3	336.838	3.030	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H](C)CC(=C)C	ZINC001133401333	1375985243	/nfs/dbraw/zinc/98/52/43/1375985243.db2.gz	AKMDAZRSQYXSSD-INIZCTEOSA-N	0	3	332.875	3.494	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)C1(CCOC)CCCC1	ZINC001230310407	1375992400	/nfs/dbraw/zinc/99/24/00/1375992400.db2.gz	POZLPLYCMLFJLC-HZPDHXFCSA-N	0	3	342.911	3.353	20	30		EGEDHN
C#CC[C@H](CC(=O)N[C@@H]1CCCC[C@H]1NCCF)c1ccccc1	ZINC001230373850	1376009326	/nfs/dbraw/zinc/00/93/26/1376009326.db2.gz	QIJAGWPMCWIADY-GUDVDZBRSA-N	0	3	330.447	3.170	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)c1ccccc1F	ZINC001133523906	1376057735	/nfs/dbraw/zinc/05/77/35/1376057735.db2.gz	AYBYJWHDYXMPEW-NEPJUHHUSA-N	0	3	343.240	3.221	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1C1CCN(C(=O)[C@@H](C)CSC)CC1	ZINC001230537784	1376059915	/nfs/dbraw/zinc/05/99/15/1376059915.db2.gz	KRVACQZPRSCNMF-BBRMVZONSA-N	0	3	344.952	3.441	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)c1cccc(C)c1	ZINC001133567829	1376093217	/nfs/dbraw/zinc/09/32/17/1376093217.db2.gz	CDERXIGVXYVJSK-UONOGXRCSA-N	0	3	339.277	3.390	20	30		EGEDHN
C#CCCN(CCCNC(=O)CCC1CCCC1)Cc1cccnc1	ZINC001230656197	1376119417	/nfs/dbraw/zinc/11/94/17/1376119417.db2.gz	XFGNZSSMDHNRLA-UHFFFAOYSA-N	0	3	341.499	3.384	20	30		EGEDHN
C#CCCN(CCCNC(=O)c1cscc1C)Cc1cccnc1	ZINC001230727213	1376135685	/nfs/dbraw/zinc/13/56/85/1376135685.db2.gz	VSNKVIXDFQTEOM-UHFFFAOYSA-N	0	3	341.480	3.097	20	30		EGEDHN
C#CCCN(CCCNC(=O)CC(C)(C)CC)Cc1cccnc1	ZINC001230769398	1376145333	/nfs/dbraw/zinc/14/53/33/1376145333.db2.gz	OSEPUIAXWYUEJK-UHFFFAOYSA-N	0	3	329.488	3.240	20	30		EGEDHN
C#CCCN(CCCNC(=O)C(C)(C)C1CCC1)Cc1cccnc1	ZINC001230808095	1376153986	/nfs/dbraw/zinc/15/39/86/1376153986.db2.gz	OPBCBHREYHLTNW-UHFFFAOYSA-N	0	3	341.499	3.240	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCCN(CCCOC)Cc1cccnc1	ZINC001230838914	1376164027	/nfs/dbraw/zinc/16/40/27/1376164027.db2.gz	WQMNCPANZQNWKZ-FQEVSTJZSA-N	0	3	347.503	3.029	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCCN(CCCF)Cc1cccnc1	ZINC001230859920	1376167254	/nfs/dbraw/zinc/16/72/54/1376167254.db2.gz	WHHTXFVJMWBBNQ-UHFFFAOYSA-N	0	3	335.467	3.352	20	30		EGEDHN
C#CCCN(CCCNC(=O)c1csc(C)c1)Cc1cccnc1	ZINC001230871572	1376171287	/nfs/dbraw/zinc/17/12/87/1376171287.db2.gz	MUOASHYHCQYUDU-UHFFFAOYSA-N	0	3	341.480	3.097	20	30		EGEDHN
Cc1c(C)c(C)c(CN2CC[C@@H]2CN(C)C(=O)[C@H](C)C#N)c(C)c1C	ZINC001231284863	1376221115	/nfs/dbraw/zinc/22/11/15/1376221115.db2.gz	WVEJXQIDYTYFOD-BFUOFWGJSA-N	0	3	341.499	3.421	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)c1cscc1C	ZINC001134035887	1376323245	/nfs/dbraw/zinc/32/32/45/1376323245.db2.gz	WJTHBFRNMBNKEW-NWDGAFQWSA-N	0	3	345.306	3.452	20	30		EGEDHN
Cc1cc(C)c(C(=O)N[C@H](C)C[C@H](C)NCc2ccccc2C#N)o1	ZINC001134041812	1376328137	/nfs/dbraw/zinc/32/81/37/1376328137.db2.gz	JHDIFMIVAZMWGT-LSDHHAIUSA-N	0	3	339.439	3.455	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CCN(Cc3cc(C)nc(C)c3)C2)C1	ZINC001231995072	1376375049	/nfs/dbraw/zinc/37/50/49/1376375049.db2.gz	GWIHOZWIKVBLGR-FQEVSTJZSA-N	0	3	343.471	3.309	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)c1ccoc1Cl	ZINC001134250796	1376433926	/nfs/dbraw/zinc/43/39/26/1376433926.db2.gz	AYJAKRGLDZEKNK-VHSXEESVSA-N	0	3	349.656	3.328	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)C1CC(C)(C)C1	ZINC001134255462	1376439151	/nfs/dbraw/zinc/43/91/51/1376439151.db2.gz	BDMCFXUJXFRYRH-RYUDHWBXSA-N	0	3	331.298	3.204	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)c1sccc1F	ZINC001134273626	1376448794	/nfs/dbraw/zinc/44/87/94/1376448794.db2.gz	HVGYSPCPKWKTLL-NXEZZACHSA-N	0	3	349.269	3.282	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H](C)C[C@H](C)NCc1conc1CC	ZINC001134418277	1376523187	/nfs/dbraw/zinc/52/31/87/1376523187.db2.gz	IADJRAULESJTEE-GJZGRUSLSA-N	0	3	333.476	3.378	20	30		EGEDHN
CCCCCCC[NH2+][C@@H](C)C[C@H](C)NC(=O)c1cccc2n[n-]nc21	ZINC001134419753	1376525607	/nfs/dbraw/zinc/52/56/07/1376525607.db2.gz	ZTDZOOBJRFIVFS-GJZGRUSLSA-N	0	3	345.491	3.415	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@H](C)C[C@@H](C)NCc1conc1C	ZINC001134450071	1376544516	/nfs/dbraw/zinc/54/45/16/1376544516.db2.gz	ZMNJULRTCHFBJX-GHMZBOCLSA-N	0	3	327.856	3.135	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H](C)C[C@@H](C)NCc1conc1CC	ZINC001134456760	1376547369	/nfs/dbraw/zinc/54/73/69/1376547369.db2.gz	CWQKILNYZLHRDE-NEPJUHHUSA-N	0	3	341.883	3.389	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1C[C@H](Oc2cccnc2)[C@H]2OCCC[C@@H]21	ZINC001233080415	1376566088	/nfs/dbraw/zinc/56/60/88/1376566088.db2.gz	XQMGBAFIPMEDFZ-ACRUOGEOSA-N	0	3	349.434	3.073	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)c1ccc(CC)o1	ZINC001134749197	1376697806	/nfs/dbraw/zinc/69/78/06/1376697806.db2.gz	QPKPVJPRCCNVIH-RYUDHWBXSA-N	0	3	343.265	3.237	20	30		EGEDHN
C[C@H]1CC[C@@](C)(C(=O)NCCNCc2ccc(C#N)c(F)c2)C1(C)C	ZINC001134786033	1376719776	/nfs/dbraw/zinc/71/97/76/1376719776.db2.gz	OEZPBZYGADECQK-XOBRGWDASA-N	0	3	345.462	3.366	20	30		EGEDHN
CCCCCCCN1CC[C@H]1CN(C)C(=O)c1cn(C)nc1CC	ZINC001235666451	1376883618	/nfs/dbraw/zinc/88/36/18/1376883618.db2.gz	RGJMJJUSZUJBNL-INIZCTEOSA-N	0	3	334.508	3.099	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)C1(C)CCC1)NCc1cc(F)ccc1C#N	ZINC001135206648	1376976139	/nfs/dbraw/zinc/97/61/39/1376976139.db2.gz	CDRKUIOFOVBQJE-KBPBESRZSA-N	0	3	331.435	3.260	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H](C)C[C@H](C)NCc1nc2ccccc2o1	ZINC001135229455	1376988671	/nfs/dbraw/zinc/98/86/71/1376988671.db2.gz	ANIBKBQIEMEFFK-KBPBESRZSA-N	0	3	329.444	3.413	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H](C)C[C@H](C)NCc1cc(F)ccc1C#N	ZINC001135236428	1376992930	/nfs/dbraw/zinc/99/29/30/1376992930.db2.gz	SENWVHOUVMGUJP-HOTGVXAUSA-N	0	3	343.446	3.264	20	30		EGEDHN
Cc1ccc(Cl)cc1C(=O)NCCNCc1ccc(C#N)cc1	ZINC001135499209	1377119453	/nfs/dbraw/zinc/11/94/53/1377119453.db2.gz	LIOHWLGAMWPQJE-UHFFFAOYSA-N	0	3	327.815	3.040	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H](C)C[C@H](C)NCc1csnc1OC	ZINC001135565204	1377147551	/nfs/dbraw/zinc/14/75/51/1377147551.db2.gz	QVTNLTSNYSXTGO-QWHCGFSZSA-N	0	3	339.505	3.127	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H](C)C[C@H](C)NCc1cc2n(n1)CCCC2	ZINC001135565111	1377147950	/nfs/dbraw/zinc/14/79/50/1377147950.db2.gz	PKVXJIBYNBPKBE-HOTGVXAUSA-N	0	3	346.519	3.195	20	30		EGEDHN
CCCN(CCNC(=O)[C@@H]1CC12CCCC2)Cc1cccc(C#N)c1	ZINC001266575652	1377336097	/nfs/dbraw/zinc/33/60/97/1377336097.db2.gz	YBLSHOKZJOKRDI-IBGZPJMESA-N	0	3	339.483	3.467	20	30		EGEDHN
CCOC(=O)C1(CC)CCN(Cc2ccc(OCC#N)cc2)CC1	ZINC001137122707	1377482516	/nfs/dbraw/zinc/48/25/16/1377482516.db2.gz	OMRLGMKHVQUFFA-UHFFFAOYSA-N	0	3	330.428	3.144	20	30		EGEDHN
Cc1scc(C(=O)NCC2(NCc3ccc(C#N)cc3)CC2)c1C	ZINC001269419297	1377554058	/nfs/dbraw/zinc/55/40/58/1377554058.db2.gz	BNSVHJVFCVYCPL-UHFFFAOYSA-N	0	3	339.464	3.289	20	30		EGEDHN
C=CCOC(=O)N[C@H]1CCCN(Cc2cccc3ncccc23)C1	ZINC001137632638	1377577402	/nfs/dbraw/zinc/57/74/02/1377577402.db2.gz	GMFWEDUFRSRFIE-INIZCTEOSA-N	0	3	325.412	3.111	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](N(C)[C@H]2CCc3c2cc(F)cc3F)C1	ZINC001189278751	1388505220	/nfs/dbraw/zinc/50/52/20/1388505220.db2.gz	BJVLRTQPVNBTOP-KSSFIOAISA-N	0	3	334.410	3.451	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](N(C)[C@@H]2CCc3c2cc(F)cc3F)C1	ZINC001189278749	1388505637	/nfs/dbraw/zinc/50/56/37/1388505637.db2.gz	BJVLRTQPVNBTOP-KBXCAEBGSA-N	0	3	334.410	3.451	20	30		EGEDHN
O=C1C=C2CN(Cc3ccc(N4CCCCC4)cc3)CCC2S1	ZINC001138216937	1377690541	/nfs/dbraw/zinc/69/05/41/1377690541.db2.gz	PZLLDVXSEWKRNF-GOSISDBHSA-N	0	3	328.481	3.451	20	30		EGEDHN
O=C1C=C2CN(Cc3ccc(N4CCCCC4)cc3)CC[C@H]2S1	ZINC001138216937	1377690543	/nfs/dbraw/zinc/69/05/43/1377690543.db2.gz	PZLLDVXSEWKRNF-GOSISDBHSA-N	0	3	328.481	3.451	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3cc(C)ccc3OC)C2)C1=O	ZINC001138484079	1377730258	/nfs/dbraw/zinc/73/02/58/1377730258.db2.gz	IFJUEHOELOGLOH-FQEVSTJZSA-N	0	3	328.456	3.004	20	30		EGEDHN
C=CCO[C@@H]1CO[C@]2(C1)CCCN(Cc1c[nH]nc1C(C)(C)C)C2	ZINC001138578948	1377746745	/nfs/dbraw/zinc/74/67/45/1377746745.db2.gz	HHSQHMIBIOUHSM-LPHOPBHVSA-N	0	3	333.476	3.033	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@H]3[C@H]2CCN3Cc2cccnc2)c1[O-]	ZINC001138626400	1377755543	/nfs/dbraw/zinc/75/55/43/1377755543.db2.gz	HAXZOBPRUITITH-LEWJYISDSA-N	0	3	349.478	3.365	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@H]3[C@H]2CCN3Cc2cccnc2)c1[O-]	ZINC001138626400	1377755544	/nfs/dbraw/zinc/75/55/44/1377755544.db2.gz	HAXZOBPRUITITH-LEWJYISDSA-N	0	3	349.478	3.365	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@](O)(C(F)(F)F)CC2)c1[O-]	ZINC001138624341	1377755711	/nfs/dbraw/zinc/75/57/11/1377755711.db2.gz	DWZKSQNRYQUDCP-MRXNPFEDSA-N	0	3	329.362	3.400	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@](O)(C(F)(F)F)CC2)c1[O-]	ZINC001138624341	1377755721	/nfs/dbraw/zinc/75/57/21/1377755721.db2.gz	DWZKSQNRYQUDCP-MRXNPFEDSA-N	0	3	329.362	3.400	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@](O)(C(F)(F)F)[C@@H](C)C2)c1[O-]	ZINC001138626066	1377755993	/nfs/dbraw/zinc/75/59/93/1377755993.db2.gz	ZNHXWBRPVZDIKS-BLLLJJGKSA-N	0	3	329.362	3.256	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@](O)(C(F)(F)F)[C@@H](C)C2)c1[O-]	ZINC001138626066	1377755997	/nfs/dbraw/zinc/75/59/97/1377755997.db2.gz	ZNHXWBRPVZDIKS-BLLLJJGKSA-N	0	3	329.362	3.256	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2C[C@@H]3[C@H](NC(=O)OC(C)(C)C)[C@@H]3C2)c1[O-]	ZINC001138627162	1377756682	/nfs/dbraw/zinc/75/66/82/1377756682.db2.gz	YJWAFMMNJLEWMX-BJWYYQGGSA-N	0	3	344.455	3.076	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2C[C@@H]3[C@H](NC(=O)OC(C)(C)C)[C@@H]3C2)c1[O-]	ZINC001138627162	1377756685	/nfs/dbraw/zinc/75/66/85/1377756685.db2.gz	YJWAFMMNJLEWMX-BJWYYQGGSA-N	0	3	344.455	3.076	20	30		EGEDHN
C=CCc1cccc(CN2CCN(c3cc(Cl)ccn3)CC2)c1O	ZINC001138627803	1377756745	/nfs/dbraw/zinc/75/67/45/1377756745.db2.gz	FWKZOUMMQBKLHC-UHFFFAOYSA-N	0	3	343.858	3.491	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@@]3(C2)CCCCN3C(C)=O)c1[O-]	ZINC001138629334	1377756785	/nfs/dbraw/zinc/75/67/85/1377756785.db2.gz	UYLALZFEWDYLAE-HXUWFJFHSA-N	0	3	328.456	3.098	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@@]3(C2)CCCCN3C(C)=O)c1[O-]	ZINC001138629334	1377756786	/nfs/dbraw/zinc/75/67/86/1377756786.db2.gz	UYLALZFEWDYLAE-HXUWFJFHSA-N	0	3	328.456	3.098	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@@H](Oc3cccc(OC)n3)C2)c1[O-]	ZINC001138631074	1377757899	/nfs/dbraw/zinc/75/78/99/1377757899.db2.gz	KDYQJTBDPZQDPR-QGZVFWFLSA-N	0	3	340.423	3.178	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@@H](Oc3cccc(OC)n3)C2)c1[O-]	ZINC001138631074	1377757904	/nfs/dbraw/zinc/75/79/04/1377757904.db2.gz	KDYQJTBDPZQDPR-QGZVFWFLSA-N	0	3	340.423	3.178	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CCC(N(CC)C(=O)CC)CC2)c1[O-]	ZINC001138631188	1377757925	/nfs/dbraw/zinc/75/79/25/1377757925.db2.gz	MQYZTERNXZCRTE-UHFFFAOYSA-N	0	3	330.472	3.344	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CCC(Oc3ncc(F)cn3)CC2)c1[O-]	ZINC001138631688	1377758199	/nfs/dbraw/zinc/75/81/99/1377758199.db2.gz	YNODVEHKCCCWLH-UHFFFAOYSA-N	0	3	343.402	3.093	20	30		EGEDHN
C=CCOc1ccccc1CN1CCCN(Cc2ccncc2)CC1	ZINC001139027179	1377819277	/nfs/dbraw/zinc/81/92/77/1377819277.db2.gz	OYSFPJUSXUMLMA-UHFFFAOYSA-N	0	3	337.467	3.354	20	30		EGEDHN
C=CCOc1ccccc1CN1CCC(C)(C(=O)N2CCCC2)CC1	ZINC001139029682	1377820105	/nfs/dbraw/zinc/82/01/05/1377820105.db2.gz	GVNLQYQWQMBRBL-UHFFFAOYSA-N	0	3	342.483	3.476	20	30		EGEDHN
CCCN1CCN(Cc2ccc(Oc3ccc(C#N)cc3)nc2)CC1	ZINC001139425176	1377882211	/nfs/dbraw/zinc/88/22/11/1377882211.db2.gz	FHFOGYFDMHFIBV-UHFFFAOYSA-N	0	3	336.439	3.273	20	30		EGEDHN
C[C@H]1CCN(Cc2ccc(Oc3ccc(C#N)cc3)nc2)CC[C@@H]1O	ZINC001139424661	1377882383	/nfs/dbraw/zinc/88/23/83/1377882383.db2.gz	SVQRTZLBEHFJQO-KXBFYZLASA-N	0	3	337.423	3.338	20	30		EGEDHN
N#Cc1cccc2c(CN3CCCC[C@@](O)(C(F)(F)F)C3)c[nH]c21	ZINC001139701359	1377937532	/nfs/dbraw/zinc/93/75/32/1377937532.db2.gz	FPJQLZGPJDLFAJ-INIZCTEOSA-N	0	3	337.345	3.319	20	30		EGEDHN
C=CCOC(=O)N1CC2(C1)CCN(Cc1ccc(C)c(C#N)c1)CC2	ZINC001139723264	1377941659	/nfs/dbraw/zinc/94/16/59/1377941659.db2.gz	YCSSLSDBSHEFPG-UHFFFAOYSA-N	0	3	339.439	3.087	20	30		EGEDHN
N#Cc1ccc(N2CCCN(Cc3cc4ccccc4cn3)CC2)nc1	ZINC001139999592	1377989645	/nfs/dbraw/zinc/98/96/45/1377989645.db2.gz	WGXDNMUTGBKHSJ-UHFFFAOYSA-N	0	3	343.434	3.214	20	30		EGEDHN
Cc1cncnc1O[C@@H]1CCCN(Cc2c[nH]c3ccc(C#N)cc23)C1	ZINC001140116691	1378011465	/nfs/dbraw/zinc/01/14/65/1378011465.db2.gz	CWOSYMOLVUMDJV-QGZVFWFLSA-N	0	3	347.422	3.181	20	30		EGEDHN
Cc1cnccc1O[C@H]1CCN(Cc2c[nH]c3ccc(C#N)cc23)C1	ZINC001140117020	1378011756	/nfs/dbraw/zinc/01/17/56/1378011756.db2.gz	KJDAFWQADQYBHB-KRWDZBQOSA-N	0	3	332.407	3.396	20	30		EGEDHN
Cc1cccnc1O[C@@H]1CCN(Cc2c[nH]c3ccc(C#N)cc23)C1	ZINC001140116963	1378011859	/nfs/dbraw/zinc/01/18/59/1378011859.db2.gz	JDSYHFOBVWJYFX-QGZVFWFLSA-N	0	3	332.407	3.396	20	30		EGEDHN
Cc1cncnc1O[C@H]1CCCN(Cc2c[nH]c3ccc(C#N)cc23)C1	ZINC001140116690	1378012103	/nfs/dbraw/zinc/01/21/03/1378012103.db2.gz	CWOSYMOLVUMDJV-KRWDZBQOSA-N	0	3	347.422	3.181	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1ccc(O)cc1F)CC2	ZINC001140125666	1378013759	/nfs/dbraw/zinc/01/37/59/1378013759.db2.gz	GCIMZNQYXUHCRG-IBGZPJMESA-N	0	3	332.419	3.064	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CC2)C(=O)N[C@@H]3c2ccccc2)c(F)c1	ZINC001140137788	1378017833	/nfs/dbraw/zinc/01/78/33/1378017833.db2.gz	ZDEJLRNZGOQYQY-LJQANCHMSA-N	0	3	349.409	3.151	20	30		EGEDHN
C=C(C)CN1CC[C@]2(CCC[N@H+](Cc3ccccc3[O-])CC2)C1=O	ZINC001272618939	1378076806	/nfs/dbraw/zinc/07/68/06/1378076806.db2.gz	QBDOQZWIFSGYPG-HXUWFJFHSA-N	0	3	328.456	3.173	20	30		EGEDHN
C=C(C)CN1CC[C@]2(CCC[N@@H+](Cc3ccccc3[O-])CC2)C1=O	ZINC001272618939	1378076808	/nfs/dbraw/zinc/07/68/08/1378076808.db2.gz	QBDOQZWIFSGYPG-HXUWFJFHSA-N	0	3	328.456	3.173	20	30		EGEDHN
Cc1cc(CN2CCC3(C[C@@H]3C(=O)NCCCC#N)CC2)ccc1F	ZINC001272686708	1378078794	/nfs/dbraw/zinc/07/87/94/1378078794.db2.gz	PNEKBBYNOXHGGQ-QGZVFWFLSA-N	0	3	343.446	3.156	20	30		EGEDHN
C=CCNC(=O)[C@@H]1CC12CCN(CCc1cccc(Cl)c1)CC2	ZINC001272894038	1378082785	/nfs/dbraw/zinc/08/27/85/1378082785.db2.gz	UJALGOATDJMOOJ-KRWDZBQOSA-N	0	3	332.875	3.287	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3cccc(F)c3Cl)C2)C1=O	ZINC001140561833	1378085819	/nfs/dbraw/zinc/08/58/19/1378085819.db2.gz	YTAOHBHLFFVHLU-SFHVURJKSA-N	0	3	336.838	3.480	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]3[C@@H]2CCN3CCCC(F)(F)F)C1	ZINC001273135275	1378090146	/nfs/dbraw/zinc/09/01/46/1378090146.db2.gz	NYASBOIUEOWFMR-KBPBESRZSA-N	0	3	330.394	3.360	20	30		EGEDHN
C=CCOC[C@@H]1CCC[C@@]12CN(Cc1cc(C)ccc1O)CCO2	ZINC001140620155	1378099613	/nfs/dbraw/zinc/09/96/13/1378099613.db2.gz	DXRDCSDLHNTMIM-AZUAARDMSA-N	0	3	331.456	3.274	20	30		EGEDHN
C=CCN1CC[C@]2(CCN(Cc3ccc(Cl)c(C)c3F)C2)C1=O	ZINC001274473304	1378125978	/nfs/dbraw/zinc/12/59/78/1378125978.db2.gz	PFFCXMYSOCHXRG-SFHVURJKSA-N	0	3	336.838	3.398	20	30		EGEDHN
N#Cc1c(N)sc(CN2CCC[C@H]2Cc2ccccn2)c1Cl	ZINC001141112013	1378242453	/nfs/dbraw/zinc/24/24/53/1378242453.db2.gz	MBEDLMKGLBQUEG-LBPRGKRZSA-N	0	3	332.860	3.457	20	30		EGEDHN
CC(C)N1CCN(Cc2cc(C#N)ccc2Br)C[C@@H]1C	ZINC001141664520	1378359234	/nfs/dbraw/zinc/35/92/34/1378359234.db2.gz	OLJYJRRMMMLRNK-ZDUSSCGKSA-N	0	3	336.277	3.235	20	30		EGEDHN
Cc1ccnc(O[C@@H]2CCCN(Cc3c[nH]c4cc(C#N)ccc34)C2)n1	ZINC001142931963	1378511980	/nfs/dbraw/zinc/51/19/80/1378511980.db2.gz	UHGIBJXQZCYXCV-QGZVFWFLSA-N	0	3	347.422	3.181	20	30		EGEDHN
CCCCCCCCCCN(C)C(=O)CCN1CCN(C)CC1	ZINC001143231732	1378566980	/nfs/dbraw/zinc/56/69/80/1378566980.db2.gz	RHEVNTAKZPBUBL-UHFFFAOYSA-N	0	3	325.541	3.223	20	30		EGEDHN
COC(=O)[C@H](c1ccccc1)[C@@H]1CCCCN1Cc1cncc(C#N)c1	ZINC001144083628	1378680725	/nfs/dbraw/zinc/68/07/25/1378680725.db2.gz	LXTNERDUIUOUJQ-VQTJNVASSA-N	0	3	349.434	3.265	20	30		EGEDHN
C#Cc1ccc(CN2CCC3(CC2)C(=O)N[C@@H]3c2ccccc2)cc1	ZINC001144573595	1378747162	/nfs/dbraw/zinc/74/71/62/1378747162.db2.gz	MJEWQLXOKWQJHX-HXUWFJFHSA-N	0	3	330.431	3.121	20	30		EGEDHN
CC(C)c1cccc(C(=O)NCCNCc2ccc(F)c(C#N)c2)c1	ZINC001146624132	1378880512	/nfs/dbraw/zinc/88/05/12/1378880512.db2.gz	XCIFMURPTQBXGB-UHFFFAOYSA-N	0	3	339.414	3.340	20	30		EGEDHN
CCC1(C(=O)N(C)[C@H](CNCc2cc(C#N)ccc2F)C2CC2)CC1	ZINC001283533995	1379004948	/nfs/dbraw/zinc/00/49/48/1379004948.db2.gz	VLJBXPAFSVAOJG-GOSISDBHSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC2(C1)CCN(CCOc1ccccc1)C2	ZINC001148126248	1379121807	/nfs/dbraw/zinc/12/18/07/1379121807.db2.gz	UNLAYMISRWCFFX-SFHVURJKSA-N	0	3	342.483	3.202	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC2(C1)CCN(Cc1cccc(OC)c1)C2	ZINC001148146512	1379124794	/nfs/dbraw/zinc/12/47/94/1379124794.db2.gz	FTGMJDLGPOPUTQ-QGZVFWFLSA-N	0	3	342.483	3.332	20	30		EGEDHN
C=CCCCC(=O)N1CC2(C1)CCN(Cc1cc(C)ccc1OC)C2	ZINC001148181935	1379129717	/nfs/dbraw/zinc/12/97/17/1379129717.db2.gz	XFBFLLJRAJRPQG-UHFFFAOYSA-N	0	3	342.483	3.394	20	30		EGEDHN
CCC[C@@H](CC)C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001148507386	1379197217	/nfs/dbraw/zinc/19/72/17/1379197217.db2.gz	SVJDDDOGWMXWQA-LJQANCHMSA-N	0	3	339.483	3.419	20	30		EGEDHN
CCCCCCCCC(=O)NCCNCc1ccc2nonc2c1	ZINC001148738726	1379256838	/nfs/dbraw/zinc/25/68/38/1379256838.db2.gz	YGCCKTHUEHPSQS-UHFFFAOYSA-N	0	3	332.448	3.179	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)c2c(F)cccc2Cl)ccc1F	ZINC001148757397	1379262459	/nfs/dbraw/zinc/26/24/59/1379262459.db2.gz	NNGBSCZBHCVCOF-UHFFFAOYSA-N	0	3	349.768	3.009	20	30		EGEDHN
CCCCCCCCCCC(=O)NCCNCC(=O)N[C@H](C)CC	ZINC001148764823	1379264148	/nfs/dbraw/zinc/26/41/48/1379264148.db2.gz	YSBMIFNNJYOOAH-QGZVFWFLSA-N	0	3	341.540	3.138	20	30		EGEDHN
CC(C)c1ccc(C(=O)NCCNCc2ccc(F)c(C#N)c2)cc1	ZINC001148845523	1379282145	/nfs/dbraw/zinc/28/21/45/1379282145.db2.gz	HODLZHOHEKQOLJ-UHFFFAOYSA-N	0	3	339.414	3.340	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)CCCc3cc(C)sc3C)C2)C1	ZINC001148851279	1379284145	/nfs/dbraw/zinc/28/41/45/1379284145.db2.gz	PORQDUUIXNNVQF-UHFFFAOYSA-N	0	3	332.513	3.408	20	30		EGEDHN
C=CCCOCC(=O)N1CC2(C1)CCN([C@H](C)c1cccc(F)c1)C2	ZINC001148874185	1379289021	/nfs/dbraw/zinc/28/90/21/1379289021.db2.gz	LSBXDHZXHHSTMA-MRXNPFEDSA-N	0	3	346.446	3.014	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H]1CN(Cc2ccccc2C)CCCO1	ZINC001150210269	1379516292	/nfs/dbraw/zinc/51/62/92/1379516292.db2.gz	CPCLAJAAGWWHJR-LJQANCHMSA-N	0	3	330.472	3.058	20	30		EGEDHN
C=CCCCC(=O)NC[C@H]1CN(Cc2ccccc2CC)CCCO1	ZINC001150224418	1379518266	/nfs/dbraw/zinc/51/82/66/1379518266.db2.gz	LLJLQKGIMBHFNA-FQEVSTJZSA-N	0	3	344.499	3.312	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@@H]1CN(Cc2ccccc2C)CCCO1	ZINC001150245972	1379522002	/nfs/dbraw/zinc/52/20/02/1379522002.db2.gz	BMCYOBMPMBMPRC-CTNGQTDRSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)C[C@H](C)c2ccccc2F)C1	ZINC001150445199	1379553601	/nfs/dbraw/zinc/55/36/01/1379553601.db2.gz	SYMJUFYNALGDAD-DLBZAZTESA-N	0	3	348.462	3.103	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)C[C@H]2CCCCC2(C)C)C1	ZINC001150829961	1379619924	/nfs/dbraw/zinc/61/99/24/1379619924.db2.gz	BGZBNHFLLOMQJV-QZTJIDSGSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)C[C@@H]2CCC[C@@H]2C)CC1	ZINC001151131930	1379665174	/nfs/dbraw/zinc/66/51/74/1379665174.db2.gz	JUDLDTROLQBIDM-ROUUACIJSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@@H]2CCCC23CC3)CC1	ZINC001151174942	1379672268	/nfs/dbraw/zinc/67/22/68/1379672268.db2.gz	PTPGEUIBBMOWCH-KRWDZBQOSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2coc(C(F)F)c2)CC1	ZINC001151266714	1379690895	/nfs/dbraw/zinc/69/08/95/1379690895.db2.gz	QGWRWAUSMBOJQE-UHFFFAOYSA-N	0	3	342.386	3.004	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@@H]2CCC(C)(C)C2)CC1	ZINC001151302294	1379697025	/nfs/dbraw/zinc/69/70/25/1379697025.db2.gz	GSSMTOWTDWOZQT-QGZVFWFLSA-N	0	3	336.520	3.376	20	30		EGEDHN
CCSCCC(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)cc1	ZINC001152072672	1379856700	/nfs/dbraw/zinc/85/67/00/1379856700.db2.gz	YYMAYPYGFCSBSC-OAHLLOKOSA-N	0	3	333.501	3.028	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC[C@@H](C)N(CC)Cc1cccc(F)c1	ZINC001152235091	1379892248	/nfs/dbraw/zinc/89/22/48/1379892248.db2.gz	UBPJMJIZEAKWSJ-HZPDHXFCSA-N	0	3	336.451	3.134	20	30		EGEDHN
CC(C)CC(CC(C)C)C(=O)NCCNCc1ccc(C#N)cc1	ZINC001152668508	1379966724	/nfs/dbraw/zinc/96/67/24/1379966724.db2.gz	ZOLCPBPNPOVCIY-UHFFFAOYSA-N	0	3	329.488	3.472	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C[C@@H](C)Cc1cccc(F)c1	ZINC001153350220	1380060652	/nfs/dbraw/zinc/06/06/52/1380060652.db2.gz	XSVKVJQWDYYKCX-DLBZAZTESA-N	0	3	332.463	3.244	20	30		EGEDHN
C#CCC1(C(=O)NC[C@@H](C)N(CC)Cc2ccc(C)nc2C)CCC1	ZINC001153777023	1380127692	/nfs/dbraw/zinc/12/76/92/1380127692.db2.gz	YUCZYARIDIZUBS-QGZVFWFLSA-N	0	3	341.499	3.219	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@@H]1CCCC[C@H]1C(F)(F)F	ZINC001153883456	1380149176	/nfs/dbraw/zinc/14/91/76/1380149176.db2.gz	MIECYKMIVCKUEJ-RBSFLKMASA-N	0	3	332.410	3.205	20	30		EGEDHN
CC(F)(F)c1ccc(C(=O)NCCNCc2ccc(C#N)s2)cc1	ZINC001153959390	1380162792	/nfs/dbraw/zinc/16/27/92/1380162792.db2.gz	IKKKBIRWZMDMAF-UHFFFAOYSA-N	0	3	349.406	3.251	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1c(C)occ1C(F)(F)F	ZINC001154367971	1380265908	/nfs/dbraw/zinc/26/59/08/1380265908.db2.gz	ONGMJAHNVAGAAP-LLVKDONJSA-N	0	3	330.350	3.070	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)[C@@H]1CCC1(C)C	ZINC001154756825	1380346721	/nfs/dbraw/zinc/34/67/21/1380346721.db2.gz	HDQNRYNFFYDXQL-QAPCUYQASA-N	0	3	327.472	3.321	20	30		EGEDHN
C=CCCC(=O)NCCCNCC(=O)Nc1ccc([C@@H](C)CC)cc1	ZINC001155593281	1380471041	/nfs/dbraw/zinc/47/10/41/1380471041.db2.gz	GFNOERHDDIZOLU-INIZCTEOSA-N	0	3	345.487	3.201	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)Cc1cccc2sccc21	ZINC001155653950	1380479302	/nfs/dbraw/zinc/47/93/02/1380479302.db2.gz	JEPFOORXZBCRKE-OAHLLOKOSA-N	0	3	328.481	3.294	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@]1(c2ccccc2)CC1(C)C	ZINC001155980480	1380510182	/nfs/dbraw/zinc/51/01/82/1380510182.db2.gz	ZEPUUQVLNCEZRV-DYESRHJHSA-N	0	3	326.484	3.204	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1ccc(-c2ccco2)s1	ZINC001156149469	1380531247	/nfs/dbraw/zinc/53/12/47/1380531247.db2.gz	LIMLNFGQXISBNM-CQSZACIVSA-N	0	3	330.453	3.472	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C[C@@H]1CCc2ccccc2C1	ZINC001156606408	1380599398	/nfs/dbraw/zinc/59/93/98/1380599398.db2.gz	ITQUQFHDIYAZFO-QZTJIDSGSA-N	0	3	326.484	3.032	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1ccc(COC(C)C)cc1	ZINC001156839742	1380686104	/nfs/dbraw/zinc/68/61/04/1380686104.db2.gz	URNXTTRWJMEJOL-QGZVFWFLSA-N	0	3	330.472	3.075	20	30		EGEDHN
N#Cc1cc(Cl)ncc1C(F)(F)n1nc(CN)c2ccccc21	ZINC001156860958	1380702021	/nfs/dbraw/zinc/70/20/21/1380702021.db2.gz	WQPKVHURWVIILB-UHFFFAOYSA-N	0	3	333.729	3.013	20	30		EGEDHN
CC1(C)CN(Cc2cccc(C#N)c2)CC[C@@H]1NC(=O)CCCF	ZINC001328103947	1388675230	/nfs/dbraw/zinc/67/52/30/1388675230.db2.gz	YUKFQEVMVPIEBN-KRWDZBQOSA-N	0	3	331.435	3.025	20	30		EGEDHN
N#Cc1nc(N2CCN[C@H](c3ccccc3)C2)c(Cl)cc1Cl	ZINC001157766726	1381027954	/nfs/dbraw/zinc/02/79/54/1381027954.db2.gz	MVHPWURVKCWMTB-HNNXBMFYSA-N	0	3	333.222	3.411	20	30		EGEDHN
C=CCCOCCCCC(=O)NCCCNCC=C(Cl)Cl	ZINC001157932418	1381075545	/nfs/dbraw/zinc/07/55/45/1381075545.db2.gz	NCILWWOWEHHEPK-UHFFFAOYSA-N	0	3	337.291	3.164	20	30		EGEDHN
CC(C)C#CC(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(F)cc1	ZINC001157940423	1381076186	/nfs/dbraw/zinc/07/61/86/1381076186.db2.gz	YUQARHHTIBMLJW-LJQANCHMSA-N	0	3	330.447	3.298	20	30		EGEDHN
C=C(C)CCC(=O)N1CCCC[C@@H]1CN(C)CCc1ccns1	ZINC001158011685	1381102879	/nfs/dbraw/zinc/10/28/79/1381102879.db2.gz	KWUQPTCSINRGEV-MRXNPFEDSA-N	0	3	335.517	3.355	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc(-c2ccccc2)n[nH]1	ZINC001158195290	1381155463	/nfs/dbraw/zinc/15/54/63/1381155463.db2.gz	VMWWNOXKEUYDPB-QGZVFWFLSA-N	0	3	338.455	3.189	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H]1CCc2ccc(F)cc2O1	ZINC001158220755	1381163453	/nfs/dbraw/zinc/16/34/53/1381163453.db2.gz	DXFHQTRAMPHPQO-QZTJIDSGSA-N	0	3	346.446	3.018	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)CCCOc1ccc(F)cc1	ZINC001158296278	1381188479	/nfs/dbraw/zinc/18/84/79/1381188479.db2.gz	ITTKRBFYKCPLRT-GOSISDBHSA-N	0	3	348.462	3.484	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cnc2ccsc2c1	ZINC001158310986	1381194957	/nfs/dbraw/zinc/19/49/57/1381194957.db2.gz	PZCABWHJXBSJJR-OAHLLOKOSA-N	0	3	329.469	3.409	20	30		EGEDHN
C#CCCCCCC(=O)N1CCCC[C@@H]1CN(C)CCOC(C)C	ZINC001158316937	1381198166	/nfs/dbraw/zinc/19/81/66/1381198166.db2.gz	XFWOUXNORBREIL-LJQANCHMSA-N	0	3	336.520	3.308	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCCC[C@@H]1CN(C)CCOCC1CC1	ZINC001158377167	1381225556	/nfs/dbraw/zinc/22/55/56/1381225556.db2.gz	HOPCUIFQIYPIKY-PKOBYXMFSA-N	0	3	336.520	3.328	20	30		EGEDHN
CN1CCN(C(F)(F)c2cc(Cl)nc(C#N)c2)C2(CCCC2)C1	ZINC001158408373	1381234244	/nfs/dbraw/zinc/23/42/44/1381234244.db2.gz	GRTDVWNVCSRRGI-UHFFFAOYSA-N	0	3	340.805	3.216	20	30		EGEDHN
CN1CCN(c2nc(-c3ccncc3)ccc2C#N)C2(CCCC2)C1	ZINC001158410780	1381235836	/nfs/dbraw/zinc/23/58/36/1381235836.db2.gz	ZZHYTVYVKKDVDL-UHFFFAOYSA-N	0	3	333.439	3.080	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc(OC)cc1Cl	ZINC001158611280	1381319725	/nfs/dbraw/zinc/31/97/25/1381319725.db2.gz	DYXMGYKVIVCSQB-CQSZACIVSA-N	0	3	336.863	3.461	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cccc(NC(C)=O)c1C	ZINC001158750232	1381382840	/nfs/dbraw/zinc/38/28/40/1381382840.db2.gz	GNUSGWWWIAHYOV-QGZVFWFLSA-N	0	3	343.471	3.066	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)CCc1ccccc1	ZINC001158781301	1381395749	/nfs/dbraw/zinc/39/57/49/1381395749.db2.gz	MDLFAVCMIPQTIB-HXUWFJFHSA-N	0	3	344.499	3.135	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)COC[C@@H](C)c1ccccc1	ZINC001158806283	1381408523	/nfs/dbraw/zinc/40/85/23/1381408523.db2.gz	FOYLACPBKDZQOP-UYAOXDASSA-N	0	3	344.499	3.306	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H](C)OCCc1ccccc1	ZINC001158811242	1381411096	/nfs/dbraw/zinc/41/10/96/1381411096.db2.gz	DYSTXMSHUWQPQN-UYAOXDASSA-N	0	3	344.499	3.133	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)CN(CC)c1ccccc1	ZINC001158909678	1381459580	/nfs/dbraw/zinc/45/95/80/1381459580.db2.gz	VGFDMMPSOKECFP-LJQANCHMSA-N	0	3	329.488	3.012	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H](OCC)c1ccccc1	ZINC001158943320	1381476356	/nfs/dbraw/zinc/47/63/56/1381476356.db2.gz	VRPHHJDQOSWBCI-RTBURBONSA-N	0	3	330.472	3.263	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N1CCCC[C@@H]1CN(C)Cc1cccc(F)c1	ZINC001158949246	1381479223	/nfs/dbraw/zinc/47/92/23/1381479223.db2.gz	HVYGGOYAIPSUCU-VQIMIIECSA-N	0	3	348.462	3.230	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(F)cc1	ZINC001158966536	1381489632	/nfs/dbraw/zinc/48/96/32/1381489632.db2.gz	KETNXJCSEWCMOL-QFBILLFUSA-N	0	3	348.462	3.230	20	30		EGEDHN
N#Cc1cc(Nc2ccc(Br)cc2[O-])cc(C2C[NH2+]C2)c1	ZINC001159478012	1381802832	/nfs/dbraw/zinc/80/28/32/1381802832.db2.gz	UUFHUMAQYAFEKK-UHFFFAOYSA-N	0	3	344.212	3.457	20	30		EGEDHN
C#CCC1(C(=O)NCCCNCc2c(Cl)cccc2OC)CCC1	ZINC001159644943	1381857096	/nfs/dbraw/zinc/85/70/96/1381857096.db2.gz	ZHVBFBOQQGOEFF-UHFFFAOYSA-N	0	3	348.874	3.138	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc([C@H]3C[C@H]3C)o2)CC1	ZINC001160121316	1382004438	/nfs/dbraw/zinc/00/44/38/1382004438.db2.gz	WOAMMNTVLVIXCT-WBVHZDCISA-N	0	3	326.440	3.178	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc3nccc(C)c3c2)CC1	ZINC001160236351	1382042922	/nfs/dbraw/zinc/04/29/22/1382042922.db2.gz	QBXSTHJORNIXTK-UHFFFAOYSA-N	0	3	347.462	3.319	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)[C@@H]1CCCC[C@H]1C(F)(F)F	ZINC001160280567	1382060224	/nfs/dbraw/zinc/06/02/24/1382060224.db2.gz	MNDKYBIKFCXMGI-VXGBXAGGSA-N	0	3	326.790	3.204	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H]2CCc3cc(OC)ccc32)CC1	ZINC001160301867	1382066551	/nfs/dbraw/zinc/06/65/51/1382066551.db2.gz	GPMWZSQQSAHDPO-HXUWFJFHSA-N	0	3	340.467	3.049	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@](C)(OC)c2ccccc2F)CC1	ZINC001160337030	1382076808	/nfs/dbraw/zinc/07/68/08/1382076808.db2.gz	FAYJSPGOPAWQIS-HXUWFJFHSA-N	0	3	346.446	3.012	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)CCCc1ccsc1	ZINC001160457318	1382108998	/nfs/dbraw/zinc/10/89/98/1382108998.db2.gz	HYZRLBKQNBZVKY-UHFFFAOYSA-N	0	3	345.306	3.075	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc(C)cc(OC)c2C)CC1	ZINC001160600869	1382151323	/nfs/dbraw/zinc/15/13/23/1382151323.db2.gz	YCDCFAGIZCKTHQ-UHFFFAOYSA-N	0	3	340.467	3.087	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCC1=CCN(CCOCC2CC2)CC1	ZINC001160941213	1382244386	/nfs/dbraw/zinc/24/43/86/1382244386.db2.gz	LNZMXNNYYISTNA-IRXDYDNUSA-N	0	3	334.504	3.010	20	30		EGEDHN
C=CCN1CCC[C@H]1CNc1ccc(C(=O)N2CCC[C@@H](C)C2)cn1	ZINC001160957810	1382250880	/nfs/dbraw/zinc/25/08/80/1382250880.db2.gz	VEECWJIDBLREQF-AEFFLSMTSA-N	0	3	342.487	3.016	20	30		EGEDHN
N#Cc1ccc(CN2CC=C(CCNC(=O)[C@H]3C[C@H]4C[C@H]4C3)CC2)cc1	ZINC001160980319	1382260733	/nfs/dbraw/zinc/26/07/33/1382260733.db2.gz	UBKNNDMAQSWCDM-AERCQKQUSA-N	0	3	349.478	3.243	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc(Cl)cc2C)CC1	ZINC001161121189	1382308171	/nfs/dbraw/zinc/30/81/71/1382308171.db2.gz	BAIXXCYRPUJTTD-UHFFFAOYSA-N	0	3	330.859	3.424	20	30		EGEDHN
N#Cc1cc2c(nc1NC1CCN(Cc3ccc(O)cc3)CC1)CCC2	ZINC001161136879	1382314921	/nfs/dbraw/zinc/31/49/21/1382314921.db2.gz	LXLGQXSATBCYIN-UHFFFAOYSA-N	0	3	348.450	3.224	20	30		EGEDHN
CCCCCCCCCCN(C)C(=O)[C@@H](N)C1CCC(O)CC1	ZINC001161227444	1382349268	/nfs/dbraw/zinc/34/92/68/1382349268.db2.gz	PHKGAMSSPBVUON-ABHNRTSZSA-N	0	3	326.525	3.464	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@H](C)c2cc(C)oc2C)CC1	ZINC001161477493	1382418705	/nfs/dbraw/zinc/41/87/05/1382418705.db2.gz	DXUZSZYVCLNVTE-MRXNPFEDSA-N	0	3	328.456	3.162	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cccc(C(F)(F)F)n2)CC1	ZINC001161543628	1382436101	/nfs/dbraw/zinc/43/61/01/1382436101.db2.gz	INHSSBHQUKPGDG-UHFFFAOYSA-N	0	3	339.361	3.038	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)c1cc(C)nn1C(CC)CC	ZINC001161558615	1382438920	/nfs/dbraw/zinc/43/89/20/1382438920.db2.gz	KMZAVHOUOHNTGZ-UHFFFAOYSA-N	0	3	326.872	3.015	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccnc(C3CCCC3)n2)CC1	ZINC001161631781	1382465242	/nfs/dbraw/zinc/46/52/42/1382465242.db2.gz	JDBFJGLESFOMMW-UHFFFAOYSA-N	0	3	340.471	3.072	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)CCc2cc(C)cc(C)c2)CC1	ZINC001161645461	1382469151	/nfs/dbraw/zinc/46/91/51/1382469151.db2.gz	HBIOWNJXUSFTEK-UHFFFAOYSA-N	0	3	338.495	3.398	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@H](F)CC2CCCCC2)CC1	ZINC001161723216	1382489618	/nfs/dbraw/zinc/48/96/18/1382489618.db2.gz	NHXVJUQIYWQVPE-LJQANCHMSA-N	0	3	334.479	3.457	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CCCC[C@H]1CNCc1ccccc1F	ZINC001328612745	1388789591	/nfs/dbraw/zinc/78/95/91/1388789591.db2.gz	IJHXTDLDGPABIH-KRWDZBQOSA-N	0	3	330.447	3.346	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccccc2OCC2CC2)CC1	ZINC001161931314	1382559332	/nfs/dbraw/zinc/55/93/32/1382559332.db2.gz	LOARFCCXBZSNJA-UHFFFAOYSA-N	0	3	340.467	3.413	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2csc(CC(C)C)n2)CC1	ZINC001161987285	1382590926	/nfs/dbraw/zinc/59/09/26/1382590926.db2.gz	VNALEZOHJCIYNW-UHFFFAOYSA-N	0	3	333.501	3.280	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C2(C(F)(F)F)CCCC2)CC1	ZINC001162003209	1382597023	/nfs/dbraw/zinc/59/70/23/1382597023.db2.gz	YYPIHSUUIWTFIC-UHFFFAOYSA-N	0	3	330.394	3.434	20	30		EGEDHN
C#CCN1CCC(CNC(=O)C[C@@H](CC)CCCC)(COC)CC1	ZINC001162362928	1382740751	/nfs/dbraw/zinc/74/07/51/1382740751.db2.gz	XFBURMMZDSFBML-SFHVURJKSA-N	0	3	336.520	3.071	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CCC[C@@H](F)C1	ZINC001162807167	1382878696	/nfs/dbraw/zinc/87/86/96/1382878696.db2.gz	ZCJMQDBCJREFTO-WOJBJXKFSA-N	0	3	344.474	3.199	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1CCC1(C)C	ZINC001162897627	1382908276	/nfs/dbraw/zinc/90/82/76/1382908276.db2.gz	DSOQGFDMRMYWEW-IBGZPJMESA-N	0	3	326.484	3.107	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C[C@H](C)C(C)(C)C	ZINC001162992594	1382940370	/nfs/dbraw/zinc/94/03/70/1382940370.db2.gz	SWJBJLBLVMWPJU-SFHVURJKSA-N	0	3	328.500	3.353	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C(C)(C)c1ccccc1	ZINC001162997517	1382942717	/nfs/dbraw/zinc/94/27/17/1382942717.db2.gz	WJDQUNCQOWLDDK-UHFFFAOYSA-N	0	3	348.490	3.258	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C1C[C@@H](C)C[C@H](C)C1	ZINC001163006996	1382946527	/nfs/dbraw/zinc/94/65/27/1382946527.db2.gz	MFJYRIDKAKPIJX-OALUTQOASA-N	0	3	340.511	3.353	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)CCC(C)C)CC1	ZINC001163324907	1383022374	/nfs/dbraw/zinc/02/23/74/1383022374.db2.gz	RKOFCSRDGKJKET-UHFFFAOYSA-N	0	3	331.298	3.207	20	30		EGEDHN
N#Cc1ccc(-c2ccccc2)nc1N[C@H]1CCCC[C@@]12CNCCO2	ZINC001163645055	1383094528	/nfs/dbraw/zinc/09/45/28/1383094528.db2.gz	YPHAOFWWDCPEJQ-PZJWPPBQSA-N	0	3	348.450	3.333	20	30		EGEDHN
C[C@H]1Oc2ccc(NC(=N)c3ccc(C(F)(F)F)cc3)cc2NC1=O	ZINC001163680630	1383104796	/nfs/dbraw/zinc/10/47/96/1383104796.db2.gz	UARLWQLQAGABJS-SECBINFHSA-N	0	3	349.312	3.462	20	30		EGEDHN
N=C(Nc1ccc(-n2ccnc2)nc1)c1ccc(C(F)(F)F)cc1	ZINC001163683510	1383105400	/nfs/dbraw/zinc/10/54/00/1383105400.db2.gz	DNTKDRLMFSRCDZ-UHFFFAOYSA-N	0	3	331.301	3.323	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCC1(CN[C@@H](C)c2c(F)cccc2F)CC1	ZINC001163841003	1383127876	/nfs/dbraw/zinc/12/78/76/1383127876.db2.gz	LHVKNVRUJHJSOK-OLZOCXBDSA-N	0	3	335.398	3.062	20	30		EGEDHN
N#Cc1ccc(CNCC2(CCNC(=O)CCC3CC3)CC2)c(F)c1	ZINC001163899762	1383134259	/nfs/dbraw/zinc/13/42/59/1383134259.db2.gz	MFKQIGJHVZEKNN-UHFFFAOYSA-N	0	3	343.446	3.264	20	30		EGEDHN
C[C@@H](C(=O)NCCC1(CNCc2cc(C#N)ccc2F)CC1)C1CC1	ZINC001163965478	1383140677	/nfs/dbraw/zinc/14/06/77/1383140677.db2.gz	SGUBPXQPZNSCRF-CQSZACIVSA-N	0	3	343.446	3.120	20	30		EGEDHN
N#Cc1ccc(CNCC2(CCNC(=O)C3=CCCC3)CC2)c(F)c1	ZINC001164074946	1383153319	/nfs/dbraw/zinc/15/33/19/1383153319.db2.gz	DCHCVYFHFOBGOY-UHFFFAOYSA-N	0	3	341.430	3.184	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCCNCc1c(Cl)cccc1OC	ZINC001164221557	1383167742	/nfs/dbraw/zinc/16/77/42/1383167742.db2.gz	CDKAACATCFGJRP-KGLIPLIRSA-N	0	3	338.879	3.403	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCCNCc1nc(C(C)(C)C)cs1	ZINC001164233636	1383169146	/nfs/dbraw/zinc/16/91/46/1383169146.db2.gz	INOGXOGGDCYZOW-KBPBESRZSA-N	0	3	337.533	3.495	20	30		EGEDHN
N#Cc1c(Cl)nc2cccc(Cl)c2c1-n1cnc2c1CNCC2	ZINC001164317597	1383177195	/nfs/dbraw/zinc/17/71/95/1383177195.db2.gz	VMCIGBLCGDUGFE-UHFFFAOYSA-N	0	3	344.205	3.245	20	30		EGEDHN
Cc1c(C(=O)NCCCNCc2ccccc2C#N)ccn1C(C)C	ZINC001164445689	1383187686	/nfs/dbraw/zinc/18/76/86/1383187686.db2.gz	ZIGBVUUCXRYDBP-UHFFFAOYSA-N	0	3	338.455	3.159	20	30		EGEDHN
O=C(C#CC1CC1)NCCC1(CNCc2cccc(Cl)c2F)CC1	ZINC001164487216	1383192278	/nfs/dbraw/zinc/19/22/78/1383192278.db2.gz	KPNAYQOYMHTPQP-UHFFFAOYSA-N	0	3	348.849	3.269	20	30		EGEDHN
N#Cc1c(Cl)nccc1C(F)(F)N1CCN[C@@H](c2ccccc2)C1	ZINC001165195447	1383244665	/nfs/dbraw/zinc/24/46/65/1383244665.db2.gz	AGWOBOCDYHHPSJ-OAHLLOKOSA-N	0	3	348.784	3.302	20	30		EGEDHN
C=C(C)CCC(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001165258995	1383259822	/nfs/dbraw/zinc/25/98/22/1383259822.db2.gz	ZNXNWBKGFWQLQC-UHFFFAOYSA-N	0	3	325.456	3.291	20	30		EGEDHN
C[C@H]1CCCC[C@@H]1C(=O)NCCCNCc1ccc(C#N)cc1F	ZINC001165410518	1383289531	/nfs/dbraw/zinc/28/95/31/1383289531.db2.gz	QBSBFIOKNGNVLY-YOEHRIQHSA-N	0	3	331.435	3.120	20	30		EGEDHN
CO/N=C/c1cc(NCC2CN(Cc3ccccc3)C2)cc(F)c1F	ZINC001165468880	1383299676	/nfs/dbraw/zinc/29/96/76/1383299676.db2.gz	JDAOGZITXPPFAM-AUEPDCJTSA-N	0	3	345.393	3.489	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2c(C)noc2C(F)F)CC1	ZINC001165681753	1383324975	/nfs/dbraw/zinc/32/49/75/1383324975.db2.gz	APVRTOFFMOUZJF-UHFFFAOYSA-N	0	3	347.793	3.163	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)[C@@H](C)C(C)(C)C)CC1	ZINC001165764151	1383341957	/nfs/dbraw/zinc/34/19/57/1383341957.db2.gz	NESGGMAZLJVUNE-CYBMUJFWSA-N	0	3	345.325	3.453	20	30		EGEDHN
C[C@@H](C(=O)NCCCNCc1ccccc1C#N)c1cccs1	ZINC001166510589	1383431193	/nfs/dbraw/zinc/43/11/93/1383431193.db2.gz	PRDGQFVODJUXAM-CQSZACIVSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCC1(CNCc2ccccc2[N+](=O)[O-])CC1	ZINC001166579737	1383441410	/nfs/dbraw/zinc/44/14/10/1383441410.db2.gz	QDAWAXVZTKVZEC-UHFFFAOYSA-N	0	3	345.443	3.183	20	30		EGEDHN
CC#CCCCC(=O)NCCC1(CNCc2c(C)onc2CC)CC1	ZINC001166704479	1383464354	/nfs/dbraw/zinc/46/43/54/1383464354.db2.gz	QSXYYYZVDICIIP-UHFFFAOYSA-N	0	3	345.487	3.115	20	30		EGEDHN
COc1cc(CN(C)C)ccc1NC(=O)c1ccc(F)c(C#N)c1	ZINC001299106563	1383467127	/nfs/dbraw/zinc/46/71/27/1383467127.db2.gz	UZXOZLVGCLQRCE-UHFFFAOYSA-N	0	3	327.359	3.020	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)CO[C@@H]2CCC[C@H](C)C2)CC1	ZINC001167362623	1383610170	/nfs/dbraw/zinc/61/01/70/1383610170.db2.gz	OLABNEHNELKTEO-GOEBONIOSA-N	0	3	342.911	3.210	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@H]2[C@@H]3c4ccccc4C[C@H]23)CC1	ZINC001167402707	1383623839	/nfs/dbraw/zinc/62/38/39/1383623839.db2.gz	HAQQGRLMJLJNFD-RCCFBDPRSA-N	0	3	344.886	3.201	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1csc(Cl)c1	ZINC001167645290	1383697057	/nfs/dbraw/zinc/69/70/57/1383697057.db2.gz	FESUNWGOGNDEOB-UHFFFAOYSA-N	0	3	333.844	3.183	20	30		EGEDHN
C=C(C)C(=O)NCCCNc1ccnc2ccc(C(F)(F)F)cc21	ZINC001167669539	1383705618	/nfs/dbraw/zinc/70/56/18/1383705618.db2.gz	ISSFHAQQOZUWRD-UHFFFAOYSA-N	0	3	337.345	3.170	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cc3nc(C)ccc3o2)CC1	ZINC001167806047	1383744004	/nfs/dbraw/zinc/74/40/04/1383744004.db2.gz	APFCSIGFVXHIAJ-UHFFFAOYSA-N	0	3	347.846	3.378	20	30		EGEDHN
C[C@H](C(=O)NCCCNCc1ccccc1C#N)[C@H](C)C(C)(C)C	ZINC001168163760	1383830474	/nfs/dbraw/zinc/83/04/74/1383830474.db2.gz	BJOYHZSLCRCCPM-HOTGVXAUSA-N	0	3	329.488	3.472	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@@H](C)Cc2ccccc2)CC1	ZINC001168264257	1383857018	/nfs/dbraw/zinc/85/70/18/1383857018.db2.gz	ZINJOPPKDBMCBL-HNNXBMFYSA-N	0	3	334.891	3.494	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc(N(C)CC)cc2)CC1	ZINC001168485412	1383920134	/nfs/dbraw/zinc/92/01/34/1383920134.db2.gz	SQCDWOXLHKBZJO-UHFFFAOYSA-N	0	3	349.906	3.385	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2ccc(F)c(C#N)c2)CN1C(=O)OC(C)(C)C	ZINC001168813758	1384015905	/nfs/dbraw/zinc/01/59/05/1384015905.db2.gz	ASEBZUMSKBWJMK-DOMZBBRYSA-N	0	3	333.407	3.185	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)[C@H]2C[C@@H]2C2CCCC2)c(F)c1	ZINC001169678499	1384172333	/nfs/dbraw/zinc/17/23/33/1384172333.db2.gz	CWNQOMODFYZOJT-MSOLQXFVSA-N	0	3	343.446	3.120	20	30		EGEDHN
C=CCCC(=O)N[C@H](C)CCCCNCc1nccn1C(F)F	ZINC001169712656	1384176718	/nfs/dbraw/zinc/17/67/18/1384176718.db2.gz	GZQYORNEFFUVBE-CYBMUJFWSA-N	0	3	328.407	3.009	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)[C@@H](C)C1CC1	ZINC001170018289	1384219085	/nfs/dbraw/zinc/21/90/85/1384219085.db2.gz	IQVINCHPEPBLTG-HOTGVXAUSA-N	0	3	327.472	3.369	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)Cc1ccoc1	ZINC001170348370	1384297639	/nfs/dbraw/zinc/29/76/39/1384297639.db2.gz	SXYOVYLCVKEFJM-INIZCTEOSA-N	0	3	339.439	3.159	20	30		EGEDHN
C#CCCCC(=O)N[C@H](C)CCCCNCc1cc(C2CC2)no1	ZINC001170452799	1384322768	/nfs/dbraw/zinc/32/27/68/1384322768.db2.gz	DUKJLKZKHZMUQK-OAHLLOKOSA-N	0	3	331.460	3.120	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)C#CC(C)(C)C	ZINC001170708871	1384371209	/nfs/dbraw/zinc/37/12/09/1384371209.db2.gz	FDWOPWZVZSUTPV-QGZVFWFLSA-N	0	3	339.483	3.372	20	30		EGEDHN
COC[C@H](NC[C@H](O)c1cccc(C#N)c1)c1cccc(Cl)c1	ZINC001170864520	1384400769	/nfs/dbraw/zinc/40/07/69/1384400769.db2.gz	YFNQGNQAWDOZND-ROUUACIJSA-N	0	3	330.815	3.222	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H](C)CCCCN[C@H](C)c1nnc(C)[nH]1	ZINC001170998536	1384427308	/nfs/dbraw/zinc/42/73/08/1384427308.db2.gz	SZMBIJXIZHARCS-ZIAGYGMSSA-N	0	3	335.496	3.041	20	30		EGEDHN
CC(C)CC(=O)N1CCCN([C@@H](C)Cc2cccc(C#N)c2)CC1	ZINC001171229546	1384474976	/nfs/dbraw/zinc/47/49/76/1384474976.db2.gz	OUAQZEIFHODVEJ-KRWDZBQOSA-N	0	3	327.472	3.070	20	30		EGEDHN
CCc1cc(C(=O)NCCCNCc2ccccc2C#N)oc1CC	ZINC001171285310	1384485432	/nfs/dbraw/zinc/48/54/32/1384485432.db2.gz	JZMBVVUHRDIOGZ-UHFFFAOYSA-N	0	3	339.439	3.186	20	30		EGEDHN
COc1ccc(Cl)c2c1C[C@@H](NC(=N)c1ccc(F)cn1)CC2	ZINC001171287161	1384485893	/nfs/dbraw/zinc/48/58/93/1384485893.db2.gz	CHOSRRARJNTKKH-NSHDSACASA-N	0	3	333.794	3.146	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)C2(F)CCCCC2)C1	ZINC001316621872	1384487489	/nfs/dbraw/zinc/48/74/89/1384487489.db2.gz	HQZVUFOLKBLUTN-BETUJISGSA-N	0	3	347.272	3.052	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1coc(C2CC2)n1	ZINC001316883753	1384666961	/nfs/dbraw/zinc/66/69/61/1384666961.db2.gz	YTCGNKXDSOIFOE-SWLSCSKDSA-N	0	3	337.851	3.277	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)NCc1ccnc(OCC2CCC2)n1	ZINC001172300635	1384763962	/nfs/dbraw/zinc/76/39/62/1384763962.db2.gz	ZAMZRMOIWZWKCR-HNNXBMFYSA-N	0	3	336.439	3.248	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)CCC2CCCC2)C1	ZINC001317070479	1384839209	/nfs/dbraw/zinc/83/92/09/1384839209.db2.gz	IGAJAUMMYLAJBJ-HDJSIYSDSA-N	0	3	329.282	3.102	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H](NC(C)(C)c2cccnc2)C[C@H]1C#N	ZINC001172967216	1384892222	/nfs/dbraw/zinc/89/22/22/1384892222.db2.gz	UTYLRXFOUDLMMM-HOTGVXAUSA-N	0	3	344.459	3.198	20	30		EGEDHN
C[C@@H]1CC[C@@H](NCC#Cc2ccccc2)CN1C(=O)OC(C)(C)C	ZINC001173061925	1384904820	/nfs/dbraw/zinc/90/48/20/1384904820.db2.gz	GWPXPKUZCHSACI-SJLPKXTDSA-N	0	3	328.456	3.416	20	30		EGEDHN
CC[C@H](C)[C@H]([NH2+][C@H](C)Cc1ccc(OC(F)(F)F)cc1)C(=O)N[O-]	ZINC001173090817	1384912435	/nfs/dbraw/zinc/91/24/35/1384912435.db2.gz	MHNRAMYPHOBCSL-WDMOLILDSA-N	0	3	348.365	3.026	20	30		EGEDHN
CCc1ccc(C[C@H](C)N2CCN(c3cc(C#N)ccn3)CC2)cc1	ZINC001173242115	1384943730	/nfs/dbraw/zinc/94/37/30/1384943730.db2.gz	DOMTXHKYWWTKLF-KRWDZBQOSA-N	0	3	334.467	3.269	20	30		EGEDHN
COc1ccc(N2CCN(C3CCC(CC#N)CC3)CC2)c(OC)c1	ZINC001173341216	1384962561	/nfs/dbraw/zinc/96/25/61/1384962561.db2.gz	SFYNVGIDNGNMEL-UHFFFAOYSA-N	0	3	343.471	3.298	20	30		EGEDHN
C=CCO[C@@H]1CO[C@]2(C1)CCCN(C1Cc3cc(F)c(F)cc3C1)C2	ZINC001173482336	1384979451	/nfs/dbraw/zinc/97/94/51/1384979451.db2.gz	IAVVDFGANMYXFU-PXNSSMCTSA-N	0	3	349.421	3.258	20	30		EGEDHN
CCc1ccccc1C(=O)NC[C@H](C)NCc1ccc(F)c(C#N)c1	ZINC001317267521	1385037407	/nfs/dbraw/zinc/03/74/07/1385037407.db2.gz	IZVLTDQJRNRKPQ-AWEZNQCLSA-N	0	3	339.414	3.168	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)C1(C2CCCCC2)CC1	ZINC001174692572	1385135093	/nfs/dbraw/zinc/13/50/93/1385135093.db2.gz	VXLNSPWMQSJXEB-UHFFFAOYSA-N	0	3	343.309	3.351	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)CCc1ccc2[nH]ccc2c1	ZINC001317401307	1385116150	/nfs/dbraw/zinc/11/61/50/1385116150.db2.gz	QKGHNNPUWGHHJC-CQSZACIVSA-N	0	3	333.863	3.337	20	30		EGEDHN
CC#CCCCC(=O)N[C@H](C)CCCCNCc1ccn(C(C)C)n1	ZINC001174798125	1385150566	/nfs/dbraw/zinc/15/05/66/1385150566.db2.gz	IBBNKEKNSKSQJW-GOSISDBHSA-N	0	3	346.519	3.422	20	30		EGEDHN
CCc1ccc(C(=O)NCCN(CC)Cc2cccc(C#N)c2)s1	ZINC001317485445	1385182500	/nfs/dbraw/zinc/18/25/00/1385182500.db2.gz	TWCVFNYFPSEUEB-UHFFFAOYSA-N	0	3	341.480	3.434	20	30		EGEDHN
CCN(CCNC(=O)[C@H](C)c1ccccc1)Cc1ccc(C#N)cc1	ZINC001317491127	1385191338	/nfs/dbraw/zinc/19/13/38/1385191338.db2.gz	QGWZSEJKOAOLDW-QGZVFWFLSA-N	0	3	335.451	3.300	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H](C)CCCCNCc2cnc(C)o2)CC1	ZINC001175083413	1385192446	/nfs/dbraw/zinc/19/24/46/1385192446.db2.gz	YZKCHONDEFJTQO-OAHLLOKOSA-N	0	3	333.476	3.494	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H](C)CCCCNCc2nnc(C(C)C)[nH]2)C1	ZINC001175149815	1385204490	/nfs/dbraw/zinc/20/44/90/1385204490.db2.gz	IBOXFRIDUZWJHL-OAHLLOKOSA-N	0	3	347.507	3.049	20	30		EGEDHN
CCC1(C(=O)NC[C@@H]2CCN(Cc3cccc(C#N)c3)C2)CCC1	ZINC001317537062	1385267967	/nfs/dbraw/zinc/26/79/67/1385267967.db2.gz	NFXMGXZYJLMQAF-SFHVURJKSA-N	0	3	325.456	3.077	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCCN(C/C=C/c1ccc(Cl)cc1)C1CC1	ZINC001317549370	1385305173	/nfs/dbraw/zinc/30/51/73/1385305173.db2.gz	RXMLJMCCEQOARV-HSWBROFVSA-N	0	3	331.847	3.093	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)C(=O)NCCCNCc1cnc(C)o1	ZINC001176744914	1385679900	/nfs/dbraw/zinc/67/99/00/1385679900.db2.gz	NFJKOAUWTOXYBB-SFHVURJKSA-N	0	3	341.455	3.014	20	30		EGEDHN
C=C[C@H](CC(=O)NCCCNCc1conc1CC)c1ccccc1	ZINC001176762975	1385687536	/nfs/dbraw/zinc/68/75/36/1385687536.db2.gz	NBMSWPTZOMHEDL-MRXNPFEDSA-N	0	3	341.455	3.193	20	30		EGEDHN
Cc1ccc(C[C@@H](C)C(=O)NCCCNCc2ccccc2C#N)cc1	ZINC001177099822	1385811505	/nfs/dbraw/zinc/81/15/05/1385811505.db2.gz	SEKXPVYIIZZZCE-GOSISDBHSA-N	0	3	349.478	3.341	20	30		EGEDHN
C[C@H]1C[C@H](C(=O)NCCCNCc2cc(C#N)ccc2F)C[C@@H](C)C1	ZINC001177136733	1385829528	/nfs/dbraw/zinc/82/95/28/1385829528.db2.gz	RJLUICJAAOMKQC-QLPKVWCKSA-N	0	3	345.462	3.366	20	30		EGEDHN
COc1ccc(Cl)c(CNC2(CNC(=O)[C@@H](C)C#N)CCCC2)c1	ZINC001319341435	1386068941	/nfs/dbraw/zinc/06/89/41/1386068941.db2.gz	ROGMVHXBARGHLA-ZDUSSCGKSA-N	0	3	349.862	3.027	20	30		EGEDHN
N#CC(Cc1cccs1)C(=O)Nc1cnc(Cl)nc1Cl	ZINC001177903604	1386078322	/nfs/dbraw/zinc/07/83/22/1386078322.db2.gz	IUSVIFFCQCWZOY-SSDOTTSWSA-N	0	3	327.196	3.166	20	30		EGEDHN
N#CC(Cc1cccs1)C(=O)Nc1nc2c(s1)C(=O)CCC2	ZINC001177904099	1386078983	/nfs/dbraw/zinc/07/89/83/1386078983.db2.gz	MVSQCGSYMZQGMV-SECBINFHSA-N	0	3	331.422	3.045	20	30		EGEDHN
N#CC(Cc1cccs1)C(=O)Nc1cc(-c2ccccc2O)no1	ZINC001177904364	1386079164	/nfs/dbraw/zinc/07/91/64/1386079164.db2.gz	OVWCRRQJPWZWKU-LLVKDONJSA-N	0	3	339.376	3.430	20	30		EGEDHN
C=CCOCCCC(=O)N1CC[C@H](N[C@@H](C)c2ccccc2F)[C@@H]1C	ZINC001178432355	1386215270	/nfs/dbraw/zinc/21/52/70/1386215270.db2.gz	YLWOWTSOPFDIRJ-BXWFABGCSA-N	0	3	348.462	3.449	20	30		EGEDHN
O=C(C#CC1CC1)NCCCCCCNCc1nc2ccccc2o1	ZINC001178435196	1386216647	/nfs/dbraw/zinc/21/66/47/1386216647.db2.gz	IBCWTLBUCBMXKF-UHFFFAOYSA-N	0	3	339.439	3.007	20	30		EGEDHN
C[C@H]1[C@@H](NCc2ccccc2Cl)CCN1C(=O)C#CC(C)(C)C	ZINC001178671495	1386273567	/nfs/dbraw/zinc/27/35/67/1386273567.db2.gz	CJESESUDCSGTLE-YOEHRIQHSA-N	0	3	332.875	3.469	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)C1(F)CCCC1)NCc1cc(C#N)ccc1F	ZINC001319921221	1386392919	/nfs/dbraw/zinc/39/29/19/1386392919.db2.gz	DYPVERNHMCMCOA-QGZVFWFLSA-N	0	3	349.425	3.210	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1ccoc1Br)C(C)C	ZINC001319954945	1386415300	/nfs/dbraw/zinc/41/53/00/1386415300.db2.gz	AVUXJPWCGXUQNH-NSHDSACASA-N	0	3	349.656	3.139	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCCCCCNCc1nccn1CC	ZINC001179212210	1386424559	/nfs/dbraw/zinc/42/45/59/1386424559.db2.gz	IKMAAHBEYXQKQJ-UHFFFAOYSA-N	0	3	334.508	3.272	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](NCc2cnc(C)s2)[C@@H]1C	ZINC001179313816	1386448319	/nfs/dbraw/zinc/44/83/19/1386448319.db2.gz	LSRDHEQSUQRSQA-YOEHRIQHSA-N	0	3	333.501	3.114	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccc(F)cc2)CCN1C(=O)[C@H]1CCC1(C)C	ZINC001179364915	1386463874	/nfs/dbraw/zinc/46/38/74/1386463874.db2.gz	RCTCEAGWPSBHFT-IPELMVKDSA-N	0	3	342.458	3.192	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)[C@@H]1C	ZINC001179380072	1386468402	/nfs/dbraw/zinc/46/84/02/1386468402.db2.gz	DATAFUFCJFDOOG-DOXZYTNZSA-N	0	3	343.446	3.379	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCCCCCNCc1cc(C)n(C)n1	ZINC001179481779	1386494429	/nfs/dbraw/zinc/49/44/29/1386494429.db2.gz	LGTKBMKLAZUFDD-LJQANCHMSA-N	0	3	334.508	3.097	20	30		EGEDHN
CCc1ccoc1C(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C	ZINC001179499964	1386499724	/nfs/dbraw/zinc/49/97/24/1386499724.db2.gz	OJERSBGZZQKUNK-LPHOPBHVSA-N	0	3	336.435	3.086	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCCCCCN[C@@H](C)c2nnc(CC)[nH]2)C1	ZINC001179532865	1386507822	/nfs/dbraw/zinc/50/78/22/1386507822.db2.gz	ABIANAGPMBLJPM-HNNXBMFYSA-N	0	3	347.507	3.051	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)NCCCCCCNCc1ccccc1C#N	ZINC001179634556	1386537213	/nfs/dbraw/zinc/53/72/13/1386537213.db2.gz	TWQFHIQBXLXRCR-VQIMIIECSA-N	0	3	327.472	3.371	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2oc(CCC)nc2C)C1	ZINC001180846752	1386883270	/nfs/dbraw/zinc/88/32/70/1386883270.db2.gz	VVTLGIJQTRJTJF-FOIQADDNSA-N	0	3	347.503	3.476	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2ccccc2C#N)C1	ZINC001180846772	1386883375	/nfs/dbraw/zinc/88/33/75/1386883375.db2.gz	WYGIKZKPNNCWGB-OXQOHEQNSA-N	0	3	325.456	3.099	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](C)[C@](C)(CNCc2nccs2)C1	ZINC001181594555	1387022274	/nfs/dbraw/zinc/02/22/74/1387022274.db2.gz	UXQWBGDDOLKUNE-RDTXWAMCSA-N	0	3	335.517	3.320	20	30		EGEDHN
CCN1CCCC[C@H]1C(=O)N1CCC(Cc2ccc(C#N)cc2)CC1	ZINC001181993147	1387088738	/nfs/dbraw/zinc/08/87/38/1387088738.db2.gz	AQGBJISDMKTWTD-FQEVSTJZSA-N	0	3	339.483	3.214	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](N[C@H]2CCc3c2cc(F)cc3F)C1	ZINC001182108762	1387106289	/nfs/dbraw/zinc/10/62/89/1387106289.db2.gz	VMHMXGMHZFXOGK-BEFAXECRSA-N	0	3	346.421	3.336	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](N[C@@H]2CCc3c2cc(F)cc3F)C1	ZINC001182108763	1387106319	/nfs/dbraw/zinc/10/63/19/1387106319.db2.gz	VMHMXGMHZFXOGK-DNVCBOLYSA-N	0	3	346.421	3.336	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2oc(C)nc2C)C1	ZINC001182465299	1387170942	/nfs/dbraw/zinc/17/09/42/1387170942.db2.gz	SYCKUBOEKJRKOP-AUUYWEPGSA-N	0	3	333.476	3.222	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2nccn2CC)C1	ZINC001182749873	1387218689	/nfs/dbraw/zinc/21/86/89/1387218689.db2.gz	DCTXFZXXTUWUIK-OXQOHEQNSA-N	0	3	346.519	3.080	20	30		EGEDHN
CC(C)C(=O)NCc1ccc(CNCc2ccc(F)c(C#N)c2)cc1	ZINC001698716166	1406359813	/nfs/dbraw/zinc/35/98/13/1406359813.db2.gz	GXISDRZYGSETFJ-UHFFFAOYSA-N	0	3	339.414	3.259	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N1CCO[C@@H](c2ccc(F)c(Cl)c2)C1	ZINC001339899132	1390185025	/nfs/dbraw/zinc/18/50/25/1390185025.db2.gz	NSDVMMYPXXBIHX-JKSUJKDBSA-N	0	3	340.826	3.063	20	30		EGEDHN
C[C@@H](CNCc1ccccc1C#N)CNC(=O)[C@@H]1CC[C@@H](C)CC1	ZINC001698769865	1406428583	/nfs/dbraw/zinc/42/85/83/1406428583.db2.gz	AKGNDVVXJMPXEW-ULQDDVLXSA-N	0	3	327.472	3.226	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)[C@H]1CCCC(F)(F)C1	ZINC001698769278	1406427817	/nfs/dbraw/zinc/42/78/17/1406427817.db2.gz	XWVCCVAFRFFTIY-CABCVRRESA-N	0	3	349.425	3.226	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N1CCC[C@H]2CCC[C@@H]21	ZINC001340207164	1390250309	/nfs/dbraw/zinc/25/03/09/1390250309.db2.gz	LVFFSYYSECIRLE-IKGGRYGDSA-N	0	3	329.492	3.042	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N(C)[C@@H](C)c1ccco1	ZINC001340207456	1390250341	/nfs/dbraw/zinc/25/03/41/1390250341.db2.gz	QHNFFVJKUHTJIP-GJZGRUSLSA-N	0	3	329.448	3.064	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1nccn1Cc1ccccc1Cl	ZINC001341568175	1390503652	/nfs/dbraw/zinc/50/36/52/1390503652.db2.gz	YJHADUCCARTJDN-OAHLLOKOSA-N	0	3	332.835	3.207	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)CCc1ccc2c(c1)CCO2	ZINC001341924351	1390550344	/nfs/dbraw/zinc/55/03/44/1390550344.db2.gz	ISDHTPPNDOSXAA-MRXNPFEDSA-N	0	3	345.402	3.317	20	30		EGEDHN
C=CCn1c([C@@H](C)SC)nnc1N1CCN(C2CCCCC2)CC1	ZINC001342219871	1390586571	/nfs/dbraw/zinc/58/65/71/1390586571.db2.gz	HSQMTRBJPAVVQM-OAHLLOKOSA-N	0	3	349.548	3.343	20	30		EGEDHN
N#CC(C(=O)CCc1cccnc1)c1nccn1Cc1ccccc1	ZINC001342604352	1390631047	/nfs/dbraw/zinc/63/10/47/1390631047.db2.gz	OWHMOVNZNWSREJ-GOSISDBHSA-N	0	3	330.391	3.135	20	30		EGEDHN
CC[C@H](C)c1ccc(NC(=O)C(C#N)C(=O)Cc2cc(C)on2)cc1	ZINC001343599463	1390725580	/nfs/dbraw/zinc/72/55/80/1390725580.db2.gz	LNZKGYMNEQRUPR-SJCJKPOMSA-N	0	3	339.395	3.387	20	30		EGEDHN
C=C(C)Cn1c(C(F)F)nnc1N1CCN(C(C)(C)CC)CC1	ZINC001343612007	1390726404	/nfs/dbraw/zinc/72/64/04/1390726404.db2.gz	AVPYWPQUUXNVIC-UHFFFAOYSA-N	0	3	327.423	3.102	20	30		EGEDHN
Cn1ccnc1C(C#N)C(=O)c1c(Cl)cccc1OCC1CC1	ZINC001343705300	1390732197	/nfs/dbraw/zinc/73/21/97/1390732197.db2.gz	QJBPMLXDDYIXHE-GFCCVEGCSA-N	0	3	329.787	3.352	20	30		EGEDHN
N#CC(C(=O)c1ccc2c(c1)CCC2)c1nc(N)c2ccccc2n1	ZINC001343983905	1390748290	/nfs/dbraw/zinc/74/82/90/1390748290.db2.gz	ZPYPPAFAMKLXNT-INIZCTEOSA-N	0	3	328.375	3.191	20	30		EGEDHN
CCN1C[C@H](C)N(c2nnc([C@H](C)CCC#N)n2CC(C)C)C[C@@H]1C	ZINC001344342993	1390784807	/nfs/dbraw/zinc/78/48/07/1390784807.db2.gz	OKHWINPOAQQFJV-IKGGRYGDSA-N	0	3	346.523	3.260	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)Cc1cccc(Br)c1	ZINC001345646937	1390871962	/nfs/dbraw/zinc/87/19/62/1390871962.db2.gz	QYHDQCPBNSLQCV-ZDUSSCGKSA-N	0	3	332.201	3.084	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)c1cnn(CC(C)C)c1C(F)F	ZINC001345645923	1390872021	/nfs/dbraw/zinc/87/20/21/1390872021.db2.gz	CIICEQXXZMVYCM-LLVKDONJSA-N	0	3	335.358	3.183	20	30		EGEDHN
CCn1ncc(C(=O)C(C#N)c2nc3c(cccc3Cl)[nH]2)c1C	ZINC001345673344	1390874641	/nfs/dbraw/zinc/87/46/41/1390874641.db2.gz	MDNILMWNYYBUOD-JTQLQIEISA-N	0	3	327.775	3.231	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H](OC)c2ccccc2)CCCC1	ZINC001698805552	1406486316	/nfs/dbraw/zinc/48/63/16/1406486316.db2.gz	HHFNWEZPHPALIK-MRXNPFEDSA-N	0	3	336.863	3.145	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2oc(CCC)nc2C)CCCC1	ZINC001698806479	1406487859	/nfs/dbraw/zinc/48/78/59/1406487859.db2.gz	OEDWVNUMCPTDNI-UHFFFAOYSA-N	0	3	339.867	3.320	20	30		EGEDHN
Cn1c(Cl)cnc1C(C#N)C(=O)CCc1ncc(C(C)(C)C)o1	ZINC001349702464	1391356110	/nfs/dbraw/zinc/35/61/10/1391356110.db2.gz	QASAWLMSRHCGHS-JTQLQIEISA-N	0	3	334.807	3.168	20	30		EGEDHN
CC(C)CN(Cc1ccc(C#N)cc1)C(=O)[C@H]1CCCN1C(C)C	ZINC001353414866	1392006115	/nfs/dbraw/zinc/00/61/15/1392006115.db2.gz	VBMFYOJKFJVVHW-LJQANCHMSA-N	0	3	327.472	3.416	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@@H](OCC)c2ccccc2)C1	ZINC001479418501	1392240128	/nfs/dbraw/zinc/24/01/28/1392240128.db2.gz	MADZPXLSJDTEJO-XIRDDKMYSA-N	0	3	336.863	3.001	20	30		EGEDHN
CC1(CCC(=O)NC[C@@H](NCc2ccc(C#N)cc2F)C2CC2)CC1	ZINC001480055538	1392553775	/nfs/dbraw/zinc/55/37/75/1392553775.db2.gz	BTMXJIIWMYSIAI-GOSISDBHSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=CCCOCC(=O)N1CC[C@H](N[C@@H](C)c2ccccc2Cl)C1	ZINC001480122598	1392595077	/nfs/dbraw/zinc/59/50/77/1392595077.db2.gz	JYUPBHWOXSITIW-GJZGRUSLSA-N	0	3	336.863	3.184	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C(CC)(CC)CC)C1	ZINC001480164236	1392606175	/nfs/dbraw/zinc/60/61/75/1392606175.db2.gz	XGDGVUYYYHOGIE-JOCQHMNTSA-N	0	3	331.298	3.348	20	30		EGEDHN
C[C@@H](CNC(=O)CC(C1CC1)C1CC1)NCc1ccc(F)c(C#N)c1	ZINC001480600367	1392814816	/nfs/dbraw/zinc/81/48/16/1392814816.db2.gz	XEHIUHKHHUNTSC-ZDUSSCGKSA-N	0	3	343.446	3.118	20	30		EGEDHN
CCN(CCNC(=O)[C@@H](C)C#N)[C@H](C)c1ccc(F)c(Cl)c1	ZINC001480968387	1393054300	/nfs/dbraw/zinc/05/43/00/1393054300.db2.gz	WIKMLKBSTBJJRI-NWDGAFQWSA-N	0	3	325.815	3.138	20	30		EGEDHN
CC[C@@H](CNC(=O)c1cccc(F)c1C)NCc1ccc(C#N)s1	ZINC001481813286	1394541956	/nfs/dbraw/zinc/54/19/56/1394541956.db2.gz	FQVFYVNDEHPOPN-ZDUSSCGKSA-N	0	3	345.443	3.366	20	30		EGEDHN
CC1(CC(=O)NC2(CNCc3cc(C#N)ccc3F)CCCC2)CC1	ZINC001481900573	1394586897	/nfs/dbraw/zinc/58/68/97/1394586897.db2.gz	CLFRQTNVCGDAHW-UHFFFAOYSA-N	0	3	343.446	3.406	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)Cc2cccnc2)CCCC[C@@H]1C	ZINC001481958220	1394619858	/nfs/dbraw/zinc/61/98/58/1394619858.db2.gz	UUZLFMSJBATGOG-KSSFIOAISA-N	0	3	335.879	3.031	20	30		EGEDHN
C=C(Cl)CNCc1ccc(CNC(=O)[C@@H]2CCCCN2CC)cc1	ZINC001482035516	1394696273	/nfs/dbraw/zinc/69/62/73/1394696273.db2.gz	CPVSZBDFJOVBIG-SFHVURJKSA-N	0	3	349.906	3.019	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)C[C@H](C)c2ccncc2)CCCC1	ZINC001482221723	1394815141	/nfs/dbraw/zinc/81/51/41/1394815141.db2.gz	DMNSUQUQUNSVPH-AWEZNQCLSA-N	0	3	335.879	3.346	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2c(F)cccc2F)CCCC1	ZINC001482237157	1394832765	/nfs/dbraw/zinc/83/27/65/1394832765.db2.gz	VEBJOGOWYXUJIY-UHFFFAOYSA-N	0	3	328.790	3.350	20	30		EGEDHN
Cc1oc(C)c(C(=O)N(C)[C@H](C)CNCc2ccc(C#N)s2)c1C	ZINC001482307049	1394880860	/nfs/dbraw/zinc/88/08/60/1394880860.db2.gz	UTQKRMBZKYEKQV-LLVKDONJSA-N	0	3	345.468	3.388	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1oc(C(C)C)nc1C)C(C)C	ZINC001698972590	1406737662	/nfs/dbraw/zinc/73/76/62/1406737662.db2.gz	FMJZKWYXCJRMNE-CYBMUJFWSA-N	0	3	327.856	3.203	20	30		EGEDHN
CC(C)SCC(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1	ZINC001483961223	1395163811	/nfs/dbraw/zinc/16/38/11/1395163811.db2.gz	GCLNJUIPVXHYMS-UHFFFAOYSA-N	0	3	345.512	3.171	20	30		EGEDHN
CCc1ccc(C(=O)NCC[C@H](C)NCc2ccccc2C#N)s1	ZINC001484995217	1395640146	/nfs/dbraw/zinc/64/01/46/1395640146.db2.gz	OBCITXJUVOUFAR-AWEZNQCLSA-N	0	3	341.480	3.480	20	30		EGEDHN
CCC(C)(C)C(=O)N[C@H]1CC[C@@H](CNCc2ccccc2C#N)C1	ZINC001486210218	1396182877	/nfs/dbraw/zinc/18/28/77/1396182877.db2.gz	IWGKLHBPZUQQHN-QAPCUYQASA-N	0	3	327.472	3.369	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)N(C)C(=O)c1ccoc1C1CC1	ZINC001496143891	1396610323	/nfs/dbraw/zinc/61/03/23/1396610323.db2.gz	KBSOLRUBWSJVRE-LBPRGKRZSA-N	0	3	343.452	3.340	20	30		EGEDHN
C[C@@H](CN(C)Cc1cccc(C#N)c1)NC(=O)c1cccc(F)c1F	ZINC001498369535	1396976873	/nfs/dbraw/zinc/97/68/73/1396976873.db2.gz	NNWHKGAKBGYMDD-ZDUSSCGKSA-N	0	3	343.377	3.087	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](C)CN(C)Cc2ccc(C#N)cc2)sc1C	ZINC001498445536	1396997295	/nfs/dbraw/zinc/99/72/95/1396997295.db2.gz	SEJOLSYMBVZUAT-CQSZACIVSA-N	0	3	341.480	3.487	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC[C@H]1C[C@@H](NCc2cccc(Cl)c2Cl)C1	ZINC001691087424	1405021163	/nfs/dbraw/zinc/02/11/63/1405021163.db2.gz	QBAIXNPUDCUXBW-GMXVVIOVSA-N	0	3	340.254	3.137	20	30		EGEDHN
CCCN(CCNC(=O)[C@H](C)C(C)(F)F)Cc1cccc(C#N)c1	ZINC001691190649	1405129788	/nfs/dbraw/zinc/12/97/88/1405129788.db2.gz	JQPGJVROOXDROG-AWEZNQCLSA-N	0	3	337.414	3.178	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)C(C)(C)CCC)C1	ZINC001691461197	1405284302	/nfs/dbraw/zinc/28/43/02/1405284302.db2.gz	SUPHXWAIFMVKCK-BETUJISGSA-N	0	3	331.298	3.206	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@H](C)Cc2ccccc2C)C1	ZINC001691540799	1405331364	/nfs/dbraw/zinc/33/13/64/1405331364.db2.gz	HFMVFXLIUWBFPR-QGPMSJSTSA-N	0	3	334.891	3.411	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)Cn2cc(C)c3ccccc32)C1	ZINC001691817967	1405532368	/nfs/dbraw/zinc/53/23/68/1405532368.db2.gz	NMXQVXXHUIMGDD-WKILWMFISA-N	0	3	345.874	3.187	20	30		EGEDHN
CCC1(C(=O)NCC[C@@H]2CCN(Cc3ccccc3C#N)C2)CC1	ZINC001732052047	1428292907	/nfs/dbraw/zinc/29/29/07/1428292907.db2.gz	CIUXAHQYTINLMZ-MRXNPFEDSA-N	0	3	325.456	3.077	20	30		EGEDHN
C=C(Br)CNCC1(NC(=O)C[C@@H](C)C2CC2)CCCC1	ZINC001732236932	1428482838	/nfs/dbraw/zinc/48/28/38/1428482838.db2.gz	HHPDKSSRZRXFKY-GFCCVEGCSA-N	0	3	343.309	3.350	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1ncc(Cl)s1)C1CC1	ZINC001732245294	1428489535	/nfs/dbraw/zinc/48/95/35/1428489535.db2.gz	PWRMLHZIKRGVQP-CYBMUJFWSA-N	0	3	334.272	3.037	20	30		EGEDHN
CCCC1(C(=O)N[C@@H](C)CNCc2ccc(F)c(C#N)c2)CCC1	ZINC001699417854	1412732114	/nfs/dbraw/zinc/73/21/14/1412732114.db2.gz	AOGMSKCOAAHKMZ-AWEZNQCLSA-N	0	3	331.435	3.262	20	30		EGEDHN
Cc1sccc1C(=O)N[C@H](C)CN(C)Cc1cccc(C#N)c1	ZINC001699448118	1412784538	/nfs/dbraw/zinc/78/45/38/1412784538.db2.gz	OOTSPZYWQDOQFQ-CYBMUJFWSA-N	0	3	327.453	3.179	20	30		EGEDHN
CC[C@@H](SC)C(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1	ZINC001699770428	1413176464	/nfs/dbraw/zinc/17/64/64/1413176464.db2.gz	PMZIDAGVYYZANM-QGZVFWFLSA-N	0	3	345.512	3.171	20	30		EGEDHN
CC(C)(C)C(=O)NC[C@]1(C)CCCN(Cc2cccc(C#N)c2)C1	ZINC001699877504	1413338391	/nfs/dbraw/zinc/33/83/91/1413338391.db2.gz	ZMTNBTWRHBXVDF-FQEVSTJZSA-N	0	3	327.472	3.323	20	30		EGEDHN
Cc1cc(C)cc(CC(=O)NC[C@@H](C)N(C)Cc2cccc(C#N)c2)c1	ZINC001700475140	1414100402	/nfs/dbraw/zinc/10/04/02/1414100402.db2.gz	VOHLONFCVRRWLL-GOSISDBHSA-N	0	3	349.478	3.354	20	30		EGEDHN
C=C(Cl)CNC[C@@H](C1CC1)N(C)C(=O)c1cc(C)cc2cn[nH]c21	ZINC001700732122	1414396148	/nfs/dbraw/zinc/39/61/48/1414396148.db2.gz	DRCUBKXWUHEUHD-INIZCTEOSA-N	0	3	346.862	3.064	20	30		EGEDHN
C=C(Cl)CNC[C@@H](C1CC1)N(C)C(=O)c1cc(C)cc2c[nH]nc21	ZINC001700732122	1414396152	/nfs/dbraw/zinc/39/61/52/1414396152.db2.gz	DRCUBKXWUHEUHD-INIZCTEOSA-N	0	3	346.862	3.064	20	30		EGEDHN
C[C@H](C#N)C(=O)NCc1ccc(CN[C@H](C)c2ccccc2)cc1F	ZINC001701063558	1414720815	/nfs/dbraw/zinc/72/08/15/1414720815.db2.gz	NALUVMKXOTVBBM-HUUCEWRRSA-N	0	3	339.414	3.452	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1cc(C2CC2)no1	ZINC001707449363	1417353368	/nfs/dbraw/zinc/35/33/68/1417353368.db2.gz	WGXZKGVOQWQRKT-WFASDCNBSA-N	0	3	337.851	3.277	20	30		EGEDHN
CCCCC(=O)NCC[C@H]1CCN(Cc2ccc(OC)c(C#N)c2)C1	ZINC001713725120	1418503337	/nfs/dbraw/zinc/50/33/37/1418503337.db2.gz	WUWSPCMJMYSHNL-INIZCTEOSA-N	0	3	343.471	3.085	20	30		EGEDHN
CC1(CC(=O)NCC[C@H]2CCN(Cc3ccccc3C#N)C2)CC1	ZINC001713732948	1418521930	/nfs/dbraw/zinc/52/19/30/1418521930.db2.gz	RGYWYWIAYRYAIE-INIZCTEOSA-N	0	3	325.456	3.077	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2cncc(C)c2)CCCC[C@@H]1C	ZINC001714180549	1418988938	/nfs/dbraw/zinc/98/89/38/1418988938.db2.gz	QCPCWCRHLFOOTR-KBXCAEBGSA-N	0	3	335.879	3.411	20	30		EGEDHN
CC(C)SCC(=O)NC1CCC(NCc2ccccc2C#N)CC1	ZINC001714181534	1418989998	/nfs/dbraw/zinc/98/99/98/1418989998.db2.gz	IXZOUCTXIRQEGS-UHFFFAOYSA-N	0	3	345.512	3.217	20	30		EGEDHN
CCCCCC(=O)N1CCC[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001714332160	1419112284	/nfs/dbraw/zinc/11/22/84/1419112284.db2.gz	ASMWBLCBUIMMLG-QGZVFWFLSA-N	0	3	331.435	3.358	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2ccc3cnccc3n2)CCCC1	ZINC001715103958	1419844934	/nfs/dbraw/zinc/84/49/34/1419844934.db2.gz	HCXHRACQBNATDZ-UHFFFAOYSA-N	0	3	344.846	3.015	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)CN(CC)c2ccccc2)CCCC1	ZINC001715104815	1419846366	/nfs/dbraw/zinc/84/63/66/1419846366.db2.gz	UPIKZZBJLBFYIO-UHFFFAOYSA-N	0	3	349.906	3.284	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1cc(C)cc2c[nH]nc21)C1CC1	ZINC001715121785	1419866628	/nfs/dbraw/zinc/86/66/28/1419866628.db2.gz	XHMWNTLFTOIKRG-SFHVURJKSA-N	0	3	346.862	3.112	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)c1ccsc1)NCc1cc(C#N)ccc1F	ZINC001715514128	1420199438	/nfs/dbraw/zinc/19/94/38/1420199438.db2.gz	IINZYMLHSUGEDR-QGZVFWFLSA-N	0	3	345.443	3.303	20	30		EGEDHN
CCCCC(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccccc2C#N)C1	ZINC001715554509	1420249122	/nfs/dbraw/zinc/24/91/22/1420249122.db2.gz	SPFVNRYPAWFIQA-RBUKOAKNSA-N	0	3	325.456	3.171	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)NC(=O)C(C1CCC1)C1CCC1	ZINC001715992034	1420446907	/nfs/dbraw/zinc/44/69/07/1420446907.db2.gz	FFQPEBHDPGVEOB-ZDUSSCGKSA-N	0	3	345.512	3.430	20	30		EGEDHN
Cc1ccc(C(=O)NCC[C@H](C)NCc2cc(C#N)ccc2F)s1	ZINC001717339484	1421277328	/nfs/dbraw/zinc/27/73/28/1421277328.db2.gz	QTKNWADTBIGEFG-LBPRGKRZSA-N	0	3	345.443	3.366	20	30		EGEDHN
Cc1csc(C(=O)NC[C@H](C)N(C)Cc2ccc(C#N)cc2)c1	ZINC001717471991	1421405284	/nfs/dbraw/zinc/40/52/84/1421405284.db2.gz	HXUGHSTXPRIKFW-AWEZNQCLSA-N	0	3	327.453	3.179	20	30		EGEDHN
CC[C@@H](C)CC(=O)N1CC2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001717628445	1421537377	/nfs/dbraw/zinc/53/73/77/1421537377.db2.gz	VVRPLEBFWAOSHD-QGZVFWFLSA-N	0	3	339.483	3.419	20	30		EGEDHN
CC(C)CCC(=O)N1CC[C@@](C)(CNCc2ccccc2C#N)C1	ZINC001733417329	1429622110	/nfs/dbraw/zinc/62/21/10/1429622110.db2.gz	GNHJKFKSTPDFJW-FQEVSTJZSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C(Cl)Cn1c([C@H](C)CC)nnc1N1C[C@@H](C)N(CC)C[C@H]1C	ZINC001722544626	1424212846	/nfs/dbraw/zinc/21/28/46/1424212846.db2.gz	UOPVZHDBACXHRX-BPLDGKMQSA-N	0	3	339.915	3.463	20	30		EGEDHN
CCCCC(=O)NC[C@]1(C)CCCN(Cc2ccc(C#N)cc2)C1	ZINC001724312094	1424796628	/nfs/dbraw/zinc/79/66/28/1424796628.db2.gz	SFMFFRUTAPTPON-FQEVSTJZSA-N	0	3	327.472	3.467	20	30		EGEDHN
N#Cc1cc(CNC2(CNC(=O)[C@H]3CC34CCC4)CCC2)ccc1F	ZINC001724797043	1425165416	/nfs/dbraw/zinc/16/54/16/1425165416.db2.gz	PSCATACGBBGOJN-MRXNPFEDSA-N	0	3	341.430	3.016	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCc1ccc2c(c1)CN(CCCC1CCC1)C2	ZINC001724923419	1425311365	/nfs/dbraw/zinc/31/13/65/1425311365.db2.gz	ZJKMBHJISHAJNV-HNNXBMFYSA-N	0	3	325.456	3.358	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1coc(C2CCC2)n1	ZINC001725145149	1425625529	/nfs/dbraw/zinc/62/55/29/1425625529.db2.gz	AACGZGQAQCQHJS-UHFFFAOYSA-N	0	3	339.867	3.382	20	30		EGEDHN
C[C@H](CNC(=O)c1cc2ccccc2[nH]1)N(C)Cc1cccc(C#N)c1	ZINC001725193451	1425743040	/nfs/dbraw/zinc/74/30/40/1425743040.db2.gz	PRSKYKJUTCEPFQ-OAHLLOKOSA-N	0	3	346.434	3.290	20	30		EGEDHN
C[C@H](CNC(=O)C1(c2ccccc2)CC1)N(C)Cc1cccc(C#N)c1	ZINC001725194874	1425747770	/nfs/dbraw/zinc/74/77/70/1425747770.db2.gz	LSNJIVDIALVDRH-QGZVFWFLSA-N	0	3	347.462	3.227	20	30		EGEDHN
CC(C)(C)[C@H](CNCc1ccc(C#N)s1)NC(=O)CC(F)(F)F	ZINC001725746458	1426424353	/nfs/dbraw/zinc/42/43/53/1426424353.db2.gz	OXRLXBYTZBGPBM-LBPRGKRZSA-N	0	3	347.406	3.193	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)COc1ccsc1	ZINC001731290533	1427232746	/nfs/dbraw/zinc/23/27/46/1427232746.db2.gz	AAPRPKNZFMZBGS-DZGCQCFKSA-N	0	3	342.892	3.239	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C2(CCC)CCC2)C1	ZINC001731450245	1427426620	/nfs/dbraw/zinc/42/66/20/1427426620.db2.gz	GRHLLMYPEUUKRR-JOCQHMNTSA-N	0	3	329.282	3.102	20	30		EGEDHN
CCc1sc(C(=O)NC[C@H](C)NCc2ccc(C#N)s2)cc1C	ZINC001731635387	1427690013	/nfs/dbraw/zinc/69/00/13/1427690013.db2.gz	UXKHXOXXWZQQRC-LBPRGKRZSA-N	0	3	347.509	3.460	20	30		EGEDHN
CC(C)SCC(=O)N[C@@H]1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC001733754149	1429966794	/nfs/dbraw/zinc/96/67/94/1429966794.db2.gz	LELLVQQBMHPHTG-GOSISDBHSA-N	0	3	345.512	3.171	20	30		EGEDHN
Cc1scc(C(=O)NC[C@H](C)N(C)Cc2ccc(C#N)cc2)c1C	ZINC001734038467	1437826800	/nfs/dbraw/zinc/82/68/00/1437826800.db2.gz	OYTTWRXUMHLGTP-ZDUSSCGKSA-N	0	3	341.480	3.487	20	30		EGEDHN
C=C(Cl)CNC[C@H]1C[C@H](NC(=O)CCc2cccc(F)c2F)C1	ZINC001734221710	1437948210	/nfs/dbraw/zinc/94/82/10/1437948210.db2.gz	FZULQKQGUQYMTQ-MQMHXKEQSA-N	0	3	342.817	3.134	20	30		EGEDHN
CC(C)(C)[C@H](CNCc1ccc(C#N)s1)NC(=O)CC(C)(F)F	ZINC001734570793	1438165061	/nfs/dbraw/zinc/16/50/61/1438165061.db2.gz	NPYLIKLHAMYTJC-ZDUSSCGKSA-N	0	3	343.443	3.286	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCCC[C@@H]2[C@@H](C)NCC(=C)Cl)cc1	ZINC001752145254	1440145622	/nfs/dbraw/zinc/14/56/22/1440145622.db2.gz	UFHHFLXULZJSJW-CRAIPNDOSA-N	0	3	330.859	3.393	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)CCc1ccccn1	ZINC001752146252	1440146106	/nfs/dbraw/zinc/14/61/06/1440146106.db2.gz	ZFZIMGKWGZERAV-WBVHZDCISA-N	0	3	335.879	3.126	20	30		EGEDHN
CCN(CC#Cc1ccccc1)CCCNC(=O)CCc1ccoc1	ZINC001752173388	1440150521	/nfs/dbraw/zinc/15/05/21/1440150521.db2.gz	USUKTZMPGUAGRR-UHFFFAOYSA-N	0	3	338.451	3.092	20	30		EGEDHN
C=CCN1CCC(N(CCC)C(=O)[C@@H]2Cc3cccc(C)c3O2)CC1	ZINC001752441792	1440181499	/nfs/dbraw/zinc/18/14/99/1440181499.db2.gz	MJVQDGJWHZQZIV-IBGZPJMESA-N	0	3	342.483	3.188	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@H](NCC#Cc1ccccc1Cl)C1CC1	ZINC001752473277	1440184777	/nfs/dbraw/zinc/18/47/77/1440184777.db2.gz	OXGYCCCAMZSOKT-SFHVURJKSA-N	0	3	344.886	3.388	20	30		EGEDHN
CC(F)(F)C(C)(C)C(=O)NC[C@H](NCC#Cc1ccccc1)C1CC1	ZINC001752494310	1440187195	/nfs/dbraw/zinc/18/71/95/1440187195.db2.gz	NTMFFRDDUJHUPG-KRWDZBQOSA-N	0	3	348.437	3.204	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1cccc(Cl)c1	ZINC001752690158	1440200486	/nfs/dbraw/zinc/20/04/86/1440200486.db2.gz	QGBBDKLYZBSWIJ-RJCAOGMDSA-N	0	3	331.847	3.111	20	30		EGEDHN
CC1(C)C(C)(C)C1(C)C(=O)N[C@H]1C[C@H](NCC#Cc2ccccc2)C1	ZINC001752692702	1440200734	/nfs/dbraw/zinc/20/07/34/1440200734.db2.gz	XBNLHCQOLXMLPE-IYARVYRRSA-N	0	3	338.495	3.347	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1C[C@@H](NCc2cnc(Cl)s2)C1	ZINC001752768682	1440205851	/nfs/dbraw/zinc/20/58/51/1440205851.db2.gz	KEXXBGRWYQHLIU-PHIMTYICSA-N	0	3	327.881	3.136	20	30		EGEDHN
Cc1cc(C(=O)N2CCCC[C@H]2CNCC#Cc2ccccc2)co1	ZINC001752826521	1440223815	/nfs/dbraw/zinc/22/38/15/1440223815.db2.gz	BQXUJTPNNHPKIA-FQEVSTJZSA-N	0	3	336.435	3.224	20	30		EGEDHN
C[C@H](CC(=O)NC[C@H](C)NCc1ccc(F)c(C#N)c1)c1ccco1	ZINC001752912677	1440245915	/nfs/dbraw/zinc/24/59/15/1440245915.db2.gz	DSQUGQGXNNKZIK-KGLIPLIRSA-N	0	3	343.402	3.078	20	30		EGEDHN
C/C=C(\C)C(=O)N[C@@H]1CCC[C@@H](NCc2cc(F)ccc2C#N)C1	ZINC001752966820	1440254149	/nfs/dbraw/zinc/25/41/49/1440254149.db2.gz	KNLILVFUZWFTBY-KXVSIHCVSA-N	0	3	329.419	3.181	20	30		EGEDHN
CC#CCN(C)[C@H]1CCCN(C(=O)c2cscc2C(F)F)C1	ZINC001752990817	1440259414	/nfs/dbraw/zinc/25/94/14/1440259414.db2.gz	JDTSHQKURZAUJY-LBPRGKRZSA-N	0	3	326.412	3.245	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@H](N(C)C[C@@H](O)c2ccccc2)C1	ZINC001752992312	1440259972	/nfs/dbraw/zinc/25/99/72/1440259972.db2.gz	JQESNFFTJAQNII-RBUKOAKNSA-N	0	3	344.499	3.245	20	30		EGEDHN
CC#CCN(C)[C@H]1CCCN(C(=O)C2C3CC4CC(C3)CC2C4)C1	ZINC001752992382	1440260031	/nfs/dbraw/zinc/26/00/31/1440260031.db2.gz	LBFLVZYONMDKMS-BIKXEMDZSA-N	0	3	328.500	3.005	20	30		EGEDHN
CC#CCN(C)[C@@H]1CCCN(C(=O)C[C@@H]2CCCc3ccccc32)C1	ZINC001752996988	1440262489	/nfs/dbraw/zinc/26/24/89/1440262489.db2.gz	JZZITPZLIYLDME-VQTJNVASSA-N	0	3	338.495	3.443	20	30		EGEDHN
C[C@H](C(=O)NCCC[C@@H]1CCCN1Cc1ccccc1C#N)C1CC1	ZINC001753025646	1440271286	/nfs/dbraw/zinc/27/12/86/1440271286.db2.gz	YKQRJSRJKUCNHU-OXJNMPFZSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC(C)C#CC(=O)NCCC[C@@H]1CCCN1Cc1cc(F)cc(F)c1	ZINC001753028666	1440272191	/nfs/dbraw/zinc/27/21/91/1440272191.db2.gz	LRPLVTBPOGHGNN-LJQANCHMSA-N	0	3	348.437	3.485	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1CCCNC(=O)c1cnn2ccccc12	ZINC001753035990	1440274610	/nfs/dbraw/zinc/27/46/10/1440274610.db2.gz	OMRKSELYNYLAHG-OAHLLOKOSA-N	0	3	346.862	3.061	20	30		EGEDHN
CCC[C@H](C)CC(=O)NC[C@H]1CCN(Cc2ccc(C#N)cc2)C1	ZINC001753122780	1440314045	/nfs/dbraw/zinc/31/40/45/1440314045.db2.gz	MTGPYHGIEZVKMY-QFBILLFUSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@H]1CCN(Cc2oc(CC)nc2C)C1	ZINC001753132304	1440317343	/nfs/dbraw/zinc/31/73/43/1440317343.db2.gz	LYDDRJMTALHALM-HZPDHXFCSA-N	0	3	333.476	3.086	20	30		EGEDHN
CCCN(CCNC(=O)C1CCCC1)Cc1ccc(OC)c(C#N)c1	ZINC001753140674	1440320980	/nfs/dbraw/zinc/32/09/80/1440320980.db2.gz	OBJMTYWIWAVHGS-UHFFFAOYSA-N	0	3	343.471	3.085	20	30		EGEDHN
CC#CCN(CCC)CCNC(=O)c1ccc(F)c2ccccc12	ZINC001753147508	1440325252	/nfs/dbraw/zinc/32/52/52/1440325252.db2.gz	GVPYOEQJBDDNIC-UHFFFAOYSA-N	0	3	326.415	3.444	20	30		EGEDHN
Cc1ccc(C(=O)N(C)CCNCc2ccc(F)c(C#N)c2)c(F)c1	ZINC001753235057	1440341616	/nfs/dbraw/zinc/34/16/16/1440341616.db2.gz	VZSSZWQYAFZDGY-UHFFFAOYSA-N	0	3	343.377	3.007	20	30		EGEDHN
CC1=CC[C@](C)(C(=O)N(C)CCNCc2ccc(C#N)cc2)CC1	ZINC001753272042	1440345592	/nfs/dbraw/zinc/34/55/92/1440345592.db2.gz	ISOICPVKJGBCOU-FQEVSTJZSA-N	0	3	325.456	3.243	20	30		EGEDHN
C#CCCN[C@H](CNC(=O)c1cccc(C(C)C)n1)c1ccccc1	ZINC001753299697	1440353533	/nfs/dbraw/zinc/35/35/33/1440353533.db2.gz	GAWNMXGDYBWWNZ-HXUWFJFHSA-N	0	3	335.451	3.289	20	30		EGEDHN
C=CCN[C@H](CNC(=O)CCc1nc2ccccc2o1)c1ccccc1	ZINC001753303033	1440354730	/nfs/dbraw/zinc/35/47/30/1440354730.db2.gz	NXIZVLCWFFDEAB-GOSISDBHSA-N	0	3	349.434	3.394	20	30		EGEDHN
C=CCN[C@H](CNC(=O)[C@@H]1CCc2ccccc2O1)c1ccccc1	ZINC001753311415	1440356710	/nfs/dbraw/zinc/35/67/10/1440356710.db2.gz	NHPRVTPSQDPKOS-QUCCMNQESA-N	0	3	336.435	3.013	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CCC)C(=O)c2cccc3c2COCC3)C1	ZINC001753317790	1440360764	/nfs/dbraw/zinc/36/07/64/1440360764.db2.gz	VZKHFAILGDRMIJ-GOSISDBHSA-N	0	3	342.483	3.262	20	30		EGEDHN
CC(C)(C(=O)NCC[C@@H]1CCN(CC#Cc2ccccc2)C1)C(F)F	ZINC001753335241	1440371778	/nfs/dbraw/zinc/37/17/78/1440371778.db2.gz	PQYQGSKMJZXTBJ-QGZVFWFLSA-N	0	3	348.437	3.158	20	30		EGEDHN
C=CCCN1CCN(CCN(C)C(=O)C2(CC=C)CCCCC2)CC1	ZINC001753344820	1440375939	/nfs/dbraw/zinc/37/59/39/1440375939.db2.gz	USWBDGCPUIYVGV-UHFFFAOYSA-N	0	3	347.547	3.165	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](CN(C)Cc2oc(CC)nc2C)C1	ZINC001753354943	1440379695	/nfs/dbraw/zinc/37/96/95/1440379695.db2.gz	MBBDSIMXZXVEQI-MRXNPFEDSA-N	0	3	333.476	3.182	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H]3C[C@H]2CN3CCCC2CCOCC2)CCC1	ZINC001753423825	1440396214	/nfs/dbraw/zinc/39/62/14/1440396214.db2.gz	AAVUARGWSFVWKF-OALUTQOASA-N	0	3	346.515	3.225	20	30		EGEDHN
C=CCCCN1C[C@@H]2C[C@H]1CN2C(=O)C[C@H](C)c1ccccc1OC	ZINC001753426752	1440397138	/nfs/dbraw/zinc/39/71/38/1440397138.db2.gz	OGUSOEBJBKRKDG-BZSNNMDCSA-N	0	3	342.483	3.440	20	30		EGEDHN
C=CCCC(=O)N(CC)[C@H]1CCN(CCOc2cccc(C)c2)C1	ZINC001753453537	1440407116	/nfs/dbraw/zinc/40/71/16/1440407116.db2.gz	SFIGWXLYAMMHRA-SFHVURJKSA-N	0	3	330.472	3.263	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H](CC)NCC=C(Cl)Cl)cc1	ZINC001753481810	1440416727	/nfs/dbraw/zinc/41/67/27/1440416727.db2.gz	YUZHRCCQFXRWJX-CQSZACIVSA-N	0	3	325.239	3.085	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H](CC)NCc2cccc(C(C)C)n2)cc1	ZINC001753481832	1440416781	/nfs/dbraw/zinc/41/67/81/1440416781.db2.gz	ZFIGHEZJBGIUEQ-LJQANCHMSA-N	0	3	349.478	3.485	20	30		EGEDHN
Cc1occc1C(=O)NC1(CNCC#Cc2ccccc2)CCCC1	ZINC001753499180	1440422841	/nfs/dbraw/zinc/42/28/41/1440422841.db2.gz	MMCVKQATHRDNCT-UHFFFAOYSA-N	0	3	336.435	3.272	20	30		EGEDHN
C=C(Br)CNCC1(NC(=O)[C@@H]2CC23CCC3)CCCC1	ZINC001753508772	1440425169	/nfs/dbraw/zinc/42/51/69/1440425169.db2.gz	BSIQJTYUWIFBMR-ZDUSSCGKSA-N	0	3	341.293	3.104	20	30		EGEDHN
C=C(Br)CNC[C@@](C)(NC(=O)c1ccsc1)C1CC1	ZINC001753513203	1440426673	/nfs/dbraw/zinc/42/66/73/1440426673.db2.gz	KJZPBEWLJHLWRW-CQSZACIVSA-N	0	3	343.290	3.145	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2ccc(OC)o2)CCCC[C@H]1C	ZINC001753536246	1440432611	/nfs/dbraw/zinc/43/26/11/1440432611.db2.gz	RMEZCVMFPAJZLR-PXAZEXFGSA-N	0	3	340.851	3.309	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1CC[C@H](NCc2cnc(C)o2)CC1	ZINC001753581794	1440440297	/nfs/dbraw/zinc/44/02/97/1440440297.db2.gz	BMELJSXXWXZDEP-QAQDUYKDSA-N	0	3	331.460	3.268	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)C2(CC)CC2)CC1	ZINC001753586047	1440441329	/nfs/dbraw/zinc/44/13/29/1440441329.db2.gz	SUKPEWVGPXLVOQ-JOCQHMNTSA-N	0	3	329.282	3.102	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H](C)CNCc2nccnc2C)CCCCC1	ZINC001753644654	1440455387	/nfs/dbraw/zinc/45/53/87/1440455387.db2.gz	KKEORTKUIWNROU-INIZCTEOSA-N	0	3	344.503	3.154	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC1(N[C@H](C)c2n[nH]c(CC)n2)CCCC1	ZINC001753667931	1440460933	/nfs/dbraw/zinc/46/09/33/1440460933.db2.gz	OKDITCXPHQWTHI-RDTXWAMCSA-N	0	3	347.507	3.049	20	30		EGEDHN
Cc1sccc1C(=O)N(C)[C@H](C)CNCc1ccc(C#N)c(F)c1	ZINC001753690552	1440466360	/nfs/dbraw/zinc/46/63/60/1440466360.db2.gz	UNPBPYTZCDEGIY-GFCCVEGCSA-N	0	3	345.443	3.318	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N(C)[C@H](C)CNCc1ccc(C#N)c(F)c1	ZINC001753709385	1440470200	/nfs/dbraw/zinc/47/02/00/1440470200.db2.gz	XSVUORICRXALEP-HUUCEWRRSA-N	0	3	331.435	3.236	20	30		EGEDHN
C#CCC1(C(=O)N(C)[C@@H](C)CNCc2cnc(C)s2)CCCCC1	ZINC001753727713	1440474861	/nfs/dbraw/zinc/47/48/61/1440474861.db2.gz	HPFSRLMQBSHQCK-HNNXBMFYSA-N	0	3	347.528	3.362	20	30		EGEDHN
CC(C)C[C@H](CNCc1ccc(C#N)s1)NC(=O)C=C1CCC1	ZINC001753732467	1440476499	/nfs/dbraw/zinc/47/64/99/1440476499.db2.gz	GXHAYOYFYBKNLU-OAHLLOKOSA-N	0	3	331.485	3.351	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@@H](CNCc1ccc(F)cc1F)C1CCCCC1	ZINC001753744676	1440480561	/nfs/dbraw/zinc/48/05/61/1440480561.db2.gz	MITMYFCROCCVOQ-ACJLOTCBSA-N	0	3	349.425	3.279	20	30		EGEDHN
C=C(Br)CNCC[C@H]1CCCCN1C(=O)C=C1CCC1	ZINC001753775067	1440486411	/nfs/dbraw/zinc/48/64/11/1440486411.db2.gz	FCPKCJNEWABKRJ-OAHLLOKOSA-N	0	3	341.293	3.366	20	30		EGEDHN
C=CCCCC(=O)N1CCCC[C@H]1CCNCc1ccc(F)cn1	ZINC001753785470	1440488064	/nfs/dbraw/zinc/48/80/64/1440488064.db2.gz	UJWVYFOWKIYLNY-SFHVURJKSA-N	0	3	333.451	3.438	20	30		EGEDHN
CC/C=C(/C)C(=O)NC[C@@H](NCc1cc(C#N)ccc1OC)C(C)C	ZINC001753824948	1440497901	/nfs/dbraw/zinc/49/79/01/1440497901.db2.gz	ACNCRPCNEFESIU-CFQIGZHASA-N	0	3	343.471	3.154	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)C#CC1CC1)NCc1cccc(Cl)c1F	ZINC001753828884	1440499053	/nfs/dbraw/zinc/49/90/53/1440499053.db2.gz	GPYVMEBVNGBHPF-MRXNPFEDSA-N	0	3	336.838	3.123	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1c(F)cc(C)cc1F)C(C)C	ZINC001753834444	1440500536	/nfs/dbraw/zinc/50/05/36/1440500536.db2.gz	MCBRTBKFXVJRBP-AWEZNQCLSA-N	0	3	330.806	3.370	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1scnc1C1CC1)C(C)C	ZINC001753839746	1440502263	/nfs/dbraw/zinc/50/22/63/1440502263.db2.gz	OLRKPWORFOZLTI-LBPRGKRZSA-N	0	3	327.881	3.117	20	30		EGEDHN
Cc1ccccc1CN(C)CCN(C)C(=O)CC#Cc1ccccc1	ZINC001753869471	1440516821	/nfs/dbraw/zinc/51/68/21/1440516821.db2.gz	UGWZVSXDNHMNDZ-UHFFFAOYSA-N	0	3	334.463	3.327	20	30		EGEDHN
C[C@H](CCN[C@@H](C)c1c(F)cccc1F)NC(=O)c1cc(C#N)c[nH]1	ZINC001753956363	1440525696	/nfs/dbraw/zinc/52/56/96/1440525696.db2.gz	SJMJSRBFELDREJ-NEPJUHHUSA-N	0	3	346.381	3.024	20	30		EGEDHN
CCN(CCNCc1ccc(C#N)cc1)C(=O)C[C@@H]1CC=CCC1	ZINC001754062189	1440536975	/nfs/dbraw/zinc/53/69/75/1440536975.db2.gz	VXRHNGRZULZLDC-QGZVFWFLSA-N	0	3	325.456	3.243	20	30		EGEDHN
CCN(CCNCc1ccc(F)c(C#N)c1)C(=O)[C@@]1(C)CCC[C@@H]1C	ZINC001754065386	1440537405	/nfs/dbraw/zinc/53/74/05/1440537405.db2.gz	DDLGPBYKYVHSEG-YWZLYKJASA-N	0	3	345.462	3.462	20	30		EGEDHN
CCN(CCNCc1cccc(C#N)c1)C(=O)c1cccc(F)c1F	ZINC001754071996	1440538238	/nfs/dbraw/zinc/53/82/38/1440538238.db2.gz	OIAKOVKYMIWQAX-UHFFFAOYSA-N	0	3	343.377	3.088	20	30		EGEDHN
C=C[C@H](C(=O)N(CC)CCNCc1cncc(F)c1)c1ccccc1	ZINC001754085285	1440540072	/nfs/dbraw/zinc/54/00/72/1440540072.db2.gz	WPFQVFNYDHMHGL-IBGZPJMESA-N	0	3	341.430	3.129	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@H](C)CNCc1cnn(-c2ccccc2)c1	ZINC001754241062	1440555833	/nfs/dbraw/zinc/55/58/33/1440555833.db2.gz	BCYDBLDQAWUNBX-UZLBHIALSA-N	0	3	340.471	3.069	20	30		EGEDHN
C[C@@H](CNCC#Cc1cccc(Cl)c1)NC(=O)C(C)(C)C1CC1	ZINC001754279867	1440562901	/nfs/dbraw/zinc/56/29/01/1440562901.db2.gz	VSPKDZPQXNGCNL-AWEZNQCLSA-N	0	3	332.875	3.222	20	30		EGEDHN
Cc1cc(F)cc(C(=O)N[C@@H](C)CNCc2ccc(F)c(C#N)c2)c1	ZINC001754285239	1440564044	/nfs/dbraw/zinc/56/40/44/1440564044.db2.gz	NYFSMOXPSQHDIG-ZDUSSCGKSA-N	0	3	343.377	3.053	20	30		EGEDHN
CN(CCCNCc1ccccc1C#N)C(=O)[C@H]1CCC(C)(C)C1	ZINC001754394555	1440594434	/nfs/dbraw/zinc/59/44/34/1440594434.db2.gz	DBAFOGHMEJGJPG-INIZCTEOSA-N	0	3	327.472	3.323	20	30		EGEDHN
CC1(C(=O)N[C@H](CNCc2ccc(C#N)c(F)c2)C2CC2)CCCC1	ZINC001754446829	1440600153	/nfs/dbraw/zinc/60/01/53/1440600153.db2.gz	QSXSCCZCHYMPFA-GOSISDBHSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@H](CNCc1c(C)nsc1C)C1CC1	ZINC001754450137	1440600910	/nfs/dbraw/zinc/60/09/10/1440600910.db2.gz	HJIHPEODRFREDU-SJLPKXTDSA-N	0	3	335.517	3.347	20	30		EGEDHN
CC#CCCCC(=O)N1C[C@H]2CCC[C@@H](C1)N2CCC[C@@H]1CCOC1	ZINC001754552220	1440630207	/nfs/dbraw/zinc/63/02/07/1440630207.db2.gz	CEZQYQPQIKIMET-AQNXPRMDSA-N	0	3	346.515	3.062	20	30		EGEDHN
Cc1nc(CN[C@@H]2CCN(C(=O)C#CC(C)(C)C)[C@H](C)C2)sc1C	ZINC001754596815	1440641702	/nfs/dbraw/zinc/64/17/02/1440641702.db2.gz	ZJSULNVLKCVCRP-CZUORRHYSA-N	0	3	347.528	3.279	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](NCc2nc(C)c(C)s2)C[C@H]1C	ZINC001754597711	1440641770	/nfs/dbraw/zinc/64/17/70/1440641770.db2.gz	FGOSTVPDSJNLPY-RHSMWYFYSA-N	0	3	347.528	3.423	20	30		EGEDHN
C#CCN(C(=O)c1ccc(C(C)(C)C)cn1)C1CCN(CC=C)CC1	ZINC001754637417	1440648734	/nfs/dbraw/zinc/64/87/34/1440648734.db2.gz	KHZJZBKYGMDBKN-UHFFFAOYSA-N	0	3	339.483	3.105	20	30		EGEDHN
C#CCN(C(=O)c1cc2ccc(C)cc2[nH]1)C1CCN(CC=C)CC1	ZINC001754639246	1440648907	/nfs/dbraw/zinc/64/89/07/1440648907.db2.gz	AVXIMZXFKMZXMT-UHFFFAOYSA-N	0	3	335.451	3.202	20	30		EGEDHN
C#CCN(C(=O)c1cccc(OC)c1C)C1CCN(CC(=C)C)CC1	ZINC001754640933	1440649208	/nfs/dbraw/zinc/64/92/08/1440649208.db2.gz	JPAZXACJSXWBHB-UHFFFAOYSA-N	0	3	340.467	3.120	20	30		EGEDHN
C#CCN(C(=O)c1ccc2ccccc2n1)C1CCN(CC(=C)C)CC1	ZINC001754642645	1440649310	/nfs/dbraw/zinc/64/93/10/1440649310.db2.gz	SNKLVIMNMZGWCH-UHFFFAOYSA-N	0	3	347.462	3.351	20	30		EGEDHN
C#CCN(C(=O)Cc1cccc2ccccc21)C1CCN(CC=C)CC1	ZINC001754642633	1440649315	/nfs/dbraw/zinc/64/93/15/1440649315.db2.gz	SBPYEKBKLXADBQ-UHFFFAOYSA-N	0	3	346.474	3.495	20	30		EGEDHN
C#CCNC[C@@H](NC(=O)[C@H](F)C(C)C)c1ccc2ccccc2c1	ZINC001754644159	1440649721	/nfs/dbraw/zinc/64/97/21/1440649721.db2.gz	PEWMMEBUYYHPBF-RTBURBONSA-N	0	3	326.415	3.214	20	30		EGEDHN
C#CCCCC(=O)NCC1(C)CCN(Cc2ccc(F)cc2)CC1	ZINC001754716955	1440671736	/nfs/dbraw/zinc/67/17/36/1440671736.db2.gz	ASAQYHLXGRTYBM-UHFFFAOYSA-N	0	3	330.447	3.348	20	30		EGEDHN
C=CCN1CCC[C@@](C)(CNC(=O)[C@@H](C)n2cnc3ccccc32)C1	ZINC001754731410	1440679395	/nfs/dbraw/zinc/67/93/95/1440679395.db2.gz	GFKCTLKABSBLPG-UZLBHIALSA-N	0	3	340.471	3.002	20	30		EGEDHN
C=CCN1CCC[C@](C)(CNC(=O)Cc2cccc3cccnc32)C1	ZINC001754737081	1440682653	/nfs/dbraw/zinc/68/26/53/1440682653.db2.gz	ZEFBOZVCUUMNDQ-OAQYLSRUSA-N	0	3	337.467	3.182	20	30		EGEDHN
C/C=C(\C)C(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(Cc1ccc(C#N)cc1F)C2	ZINC001754782023	1440686559	/nfs/dbraw/zinc/68/65/59/1440686559.db2.gz	WEEWWGMGLFEMAJ-MBVZXMAYSA-N	0	3	341.430	3.133	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1C[C@H]2C[C@@H](C1)N(Cc1cncs1)C2	ZINC001754785086	1440687505	/nfs/dbraw/zinc/68/75/05/1440687505.db2.gz	JGVRXDZRPGXECS-ZNMIVQPWSA-N	0	3	333.501	3.215	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(Cc1cncs1)C2	ZINC001754785084	1440687520	/nfs/dbraw/zinc/68/75/20/1440687520.db2.gz	JGVRXDZRPGXECS-KKUMJFAQSA-N	0	3	333.501	3.215	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H]([C@@H](C)NCc2csc(C3CC3)n2)C1	ZINC001754787644	1440688188	/nfs/dbraw/zinc/68/81/88/1440688188.db2.gz	MYFXORYWEZTVEZ-UKRRQHHQSA-N	0	3	333.501	3.313	20	30		EGEDHN
CC#CCCCC(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2Cc1cnoc1C	ZINC001754831485	1440695465	/nfs/dbraw/zinc/69/54/65/1440695465.db2.gz	CIQWEZYTFAIMAP-GGPHIMKMSA-N	0	3	343.471	3.036	20	30		EGEDHN
C#CCNCCN(Cc1ccccc1)C(=O)c1ccc(C(C)(C)C)cn1	ZINC001754837524	1440697132	/nfs/dbraw/zinc/69/71/32/1440697132.db2.gz	OLRJEZVRSXWXDP-UHFFFAOYSA-N	0	3	349.478	3.244	20	30		EGEDHN
CCCCCC[C@@H](CC)C(=O)N1C[C@H]2CN(CC#CCOC)C[C@H]2C1	ZINC001754843533	1440698362	/nfs/dbraw/zinc/69/83/62/1440698362.db2.gz	HKEHMNYYOVWXIV-AQNXPRMDSA-N	0	3	348.531	3.023	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC[C@H]2[C@@H]1CCN2CCCCC(F)(F)F	ZINC001754864827	1440702368	/nfs/dbraw/zinc/70/23/68/1440702368.db2.gz	DTSHLBUIHFVLGH-HOTGVXAUSA-N	0	3	344.421	3.444	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)CCCc1sccc1C	ZINC001754872432	1440705567	/nfs/dbraw/zinc/70/55/67/1440705567.db2.gz	YSDQNFWHKAXNEC-MSOLQXFVSA-N	0	3	344.524	3.468	20	30		EGEDHN
Cc1cc(CN2C[C@@H]3CCCN(C(=O)C#CC(C)C)[C@@H]3C2)cs1	ZINC001754872915	1440705860	/nfs/dbraw/zinc/70/58/60/1440705860.db2.gz	OYGKFWJWSYHLMT-ZWKOTPCHSA-N	0	3	330.497	3.139	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](CCNCc2cc(F)ccc2F)C1	ZINC001754910290	1440708039	/nfs/dbraw/zinc/70/80/39/1440708039.db2.gz	IDDCIBMCOHJIMA-INIZCTEOSA-N	0	3	348.437	3.487	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CCN(C(=O)/C=C(\C)CC)C1	ZINC001754914878	1440708459	/nfs/dbraw/zinc/70/84/59/1440708459.db2.gz	NZRUGGPJHMKENO-BRADTZPFSA-N	0	3	329.282	3.080	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](CCNCc3conc3C)C2)CC1	ZINC001754930844	1440710440	/nfs/dbraw/zinc/71/04/40/1440710440.db2.gz	QUGJKSZOFQADRW-INIZCTEOSA-N	0	3	331.460	3.058	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCN(C(=O)[C@@H](CC)OC2CCCC2)C1	ZINC001754934073	1440710985	/nfs/dbraw/zinc/71/09/85/1440710985.db2.gz	IPHBJBDJMBWGCD-NVXWUHKLSA-N	0	3	342.911	3.305	20	30		EGEDHN
C=CCCC(=O)NCc1ccccc1CN(C)C[C@H]1CCCCO1	ZINC001754946208	1440713090	/nfs/dbraw/zinc/71/30/90/1440713090.db2.gz	ZKDDQKPKRINQDK-LJQANCHMSA-N	0	3	330.472	3.270	20	30		EGEDHN
COCC#CCN[C@@H](C)c1ccc(CNC(=O)C2CCCCC2)cc1	ZINC001754954812	1440716064	/nfs/dbraw/zinc/71/60/64/1440716064.db2.gz	SWMONSAMAOFFRD-KRWDZBQOSA-N	0	3	342.483	3.184	20	30		EGEDHN
C=CCCC(=O)N1CCO[C@H](CN[C@@H](C)c2ccccc2Cl)C1	ZINC001754994828	1440725495	/nfs/dbraw/zinc/72/54/95/1440725495.db2.gz	CIHFZHKUKZGCAZ-LSDHHAIUSA-N	0	3	336.863	3.184	20	30		EGEDHN
C=CCCCN1CCN([C@H]2CCN(C(=O)C(C)=C3CCCC3)C2)CC1	ZINC001755018038	1440726343	/nfs/dbraw/zinc/72/63/43/1440726343.db2.gz	SRHVIUYNXIPELJ-FQEVSTJZSA-N	0	3	345.531	3.062	20	30		EGEDHN
C=CCCCN1CCN([C@@H]2CCN(C(=O)C3=CCCCCC3)C2)CC1	ZINC001755018065	1440726395	/nfs/dbraw/zinc/72/63/95/1440726395.db2.gz	TVCUJLAYRJLWFM-HXUWFJFHSA-N	0	3	345.531	3.062	20	30		EGEDHN
CC[C@H](C)CCCCC(=O)N[C@@H]1CCCN(CC#CCOC)CC1	ZINC001755024666	1440728234	/nfs/dbraw/zinc/72/82/34/1440728234.db2.gz	GBHTXDLFYNJBEC-RBUKOAKNSA-N	0	3	336.520	3.213	20	30		EGEDHN
C=C1CC(C)(C(=O)N(C)CCCN(C)Cc2cccc([N+](=O)[O-])c2)C1	ZINC001755041064	1440737301	/nfs/dbraw/zinc/73/73/01/1440737301.db2.gz	GGPMOQJCWXOJIB-UHFFFAOYSA-N	0	3	345.443	3.231	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)CCCC(F)(F)F)C1	ZINC001755047037	1440741655	/nfs/dbraw/zinc/74/16/55/1440741655.db2.gz	LFMFYICUIDGUBO-CVEARBPZSA-N	0	3	344.421	3.445	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H](C)[C@@H](NCc2cnn(C(C)(C)C)c2)C1	ZINC001755115874	1440755026	/nfs/dbraw/zinc/75/50/26/1440755026.db2.gz	DNKRPCGKTADQBP-WBVHZDCISA-N	0	3	346.519	3.177	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)CCc2cc(F)ccc2F)C(C)(C)C1	ZINC001755143041	1440761897	/nfs/dbraw/zinc/76/18/97/1440761897.db2.gz	HEEJZXHJWQPSDR-GOSISDBHSA-N	0	3	348.437	3.137	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)CCc2cccc(Cl)c2)C[C@@H]1C	ZINC001755161896	1440765041	/nfs/dbraw/zinc/76/50/41/1440765041.db2.gz	NXAWUAIKLZSZBT-MAUKXSAKSA-N	0	3	332.875	3.265	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)CCOc2cccc(C)c2C)C[C@@H]1C	ZINC001755162717	1440765607	/nfs/dbraw/zinc/76/56/07/1440765607.db2.gz	YMYNXPRGXLJQJS-PKOBYXMFSA-N	0	3	342.483	3.065	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CCN(Cc2cccc(F)c2)[C@@H](C)C1	ZINC001755168744	1440768011	/nfs/dbraw/zinc/76/80/11/1440768011.db2.gz	GOEPTFCUWBEHAL-QFBILLFUSA-N	0	3	330.447	3.488	20	30		EGEDHN
C#CCCN[C@@H]1c2ccccc2C[C@H]1NC(=O)C[C@H]1CCCC1(F)F	ZINC001755186976	1440773526	/nfs/dbraw/zinc/77/35/26/1440773526.db2.gz	OTJDZNTXVOSAOY-SZVBFZGTSA-N	0	3	346.421	3.207	20	30		EGEDHN
C[C@@H](NCC#Cc1cccc(Cl)c1)[C@@H](C)NC(=O)CC1CCC1	ZINC001755229190	1440786539	/nfs/dbraw/zinc/78/65/39/1440786539.db2.gz	AAWKHTMVBPNNRK-HUUCEWRRSA-N	0	3	332.875	3.365	20	30		EGEDHN
Cc1cscc1C(=O)N[C@@H](C)[C@H](C)NCC#Cc1ccccc1	ZINC001755229598	1440786715	/nfs/dbraw/zinc/78/67/15/1440786715.db2.gz	DNDGEBGFJABEAB-HOTGVXAUSA-N	0	3	326.465	3.205	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@H](C)N(C)Cc2ccc(C)c(OC)c2)C1	ZINC001755315599	1440815463	/nfs/dbraw/zinc/81/54/63/1440815463.db2.gz	SNXDNWDFWOOLER-INIZCTEOSA-N	0	3	330.472	3.296	20	30		EGEDHN
C[C@@H](CNC(=O)[C@@H]1C[C@H]1c1ccccc1)N(C)Cc1cccc(C#N)c1	ZINC001755322999	1440819747	/nfs/dbraw/zinc/81/97/47/1440819747.db2.gz	PASOHIRFIWEVFF-ORYQWCPZSA-N	0	3	347.462	3.298	20	30		EGEDHN
CC(C)[C@@H](CCN(C)C(=O)C1CC1)NCc1cc(F)ccc1C#N	ZINC001755344793	1440826310	/nfs/dbraw/zinc/82/63/10/1440826310.db2.gz	ULHGUOHYANAHDO-GOSISDBHSA-N	0	3	331.435	3.070	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)COc1ccccc1CC	ZINC001755369010	1440836708	/nfs/dbraw/zinc/83/67/08/1440836708.db2.gz	ZFLANRQUXMSXAE-IBGZPJMESA-N	0	3	342.483	3.012	20	30		EGEDHN
C#CCC1(C(=O)N[C@H]2CN(CCOC(C)C)CC2(C)C)CCCCC1	ZINC001755416812	1440849418	/nfs/dbraw/zinc/84/94/18/1440849418.db2.gz	XHBDBRDCMHQVBQ-SFHVURJKSA-N	0	3	348.531	3.212	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCOc2cc(C)ccc2C)C(C)(C)C1	ZINC001755417030	1440849473	/nfs/dbraw/zinc/84/94/73/1440849473.db2.gz	XHEYOFKTRFGASC-SFHVURJKSA-N	0	3	330.472	3.085	20	30		EGEDHN
CC#CCN1C[C@@H]2[C@@H](CNC(=O)C[C@H](C)c3ccc(CC)cc3)[C@@H]2C1	ZINC001755432009	1440851200	/nfs/dbraw/zinc/85/12/00/1440851200.db2.gz	QHSQVDOWVZWTRJ-LRGNLBRXSA-N	0	3	338.495	3.060	20	30		EGEDHN
C[C@@H](CCCNCc1ccccc1C#N)NC(=O)c1ccoc1Cl	ZINC001755495188	1440862041	/nfs/dbraw/zinc/86/20/41/1440862041.db2.gz	CDGCIBNOQZJJGC-ZDUSSCGKSA-N	0	3	345.830	3.493	20	30		EGEDHN
C=C(Cl)CNCCC[C@@H](C)NC(=O)c1cn(C(C)(C)C)nc1C	ZINC001755499035	1440862415	/nfs/dbraw/zinc/86/24/15/1440862415.db2.gz	SXJFAGLWAWFRDW-CYBMUJFWSA-N	0	3	340.899	3.187	20	30		EGEDHN
C[C@@H](CCCNCc1cc(C#N)ccc1F)NC(=O)[C@@]1(C)C=CCC1	ZINC001755510857	1440863569	/nfs/dbraw/zinc/86/35/69/1440863569.db2.gz	JCONUKXSPJGGJQ-YWZLYKJASA-N	0	3	343.446	3.428	20	30		EGEDHN
C[C@H]1CC[C@@H](C(=O)N2CCC(N(C)CC#Cc3ccccc3)CC2)C1	ZINC001755534411	1440868696	/nfs/dbraw/zinc/86/86/96/1440868696.db2.gz	LYYDDMWIBLPQCJ-AZUAARDMSA-N	0	3	338.495	3.397	20	30		EGEDHN
CN(C(=O)C=C1CCC1)[C@@H](CNCc1cc(C#N)ccc1F)C1CC1	ZINC001755559092	1440874180	/nfs/dbraw/zinc/87/41/80/1440874180.db2.gz	VIRIKGQNHRPOIH-IBGZPJMESA-N	0	3	341.430	3.134	20	30		EGEDHN
C=C(Br)CNC[C@H](C1CC1)N(C)C(=O)[C@@H](C)C(C)(C)C	ZINC001755559897	1440874318	/nfs/dbraw/zinc/87/43/18/1440874318.db2.gz	LUBPCNZOUWPALK-TZMCWYRMSA-N	0	3	345.325	3.404	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N(C)[C@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001755566529	1440875878	/nfs/dbraw/zinc/87/58/78/1440875878.db2.gz	WGDFZARMNJVVHJ-ZTFGCOKTSA-N	0	3	345.512	3.383	20	30		EGEDHN
C[C@H](NC[C@@H](C1CC1)N(C)C(=O)C#CC1CC1)c1ccccc1F	ZINC001755572920	1440877467	/nfs/dbraw/zinc/87/74/67/1440877467.db2.gz	SENRYMRWQKGHIP-LIRRHRJNSA-N	0	3	328.431	3.127	20	30		EGEDHN
COc1ccc(CN[C@H](C)CN(C)C(=O)/C=C\C(C)(C)C)cc1C#N	ZINC001755581457	1440879524	/nfs/dbraw/zinc/87/95/24/1440879524.db2.gz	HNVNRVHNDQZRNW-FJVVXJACSA-N	0	3	343.471	3.106	20	30		EGEDHN
CCCc1[nH]ccc1C(=O)N(C)C[C@@H](C)NCc1ccc(C#N)s1	ZINC001755601675	1440884273	/nfs/dbraw/zinc/88/42/73/1440884273.db2.gz	NGAFRLAXEWUZDK-CYBMUJFWSA-N	0	3	344.484	3.151	20	30		EGEDHN
C#CCN1CC[C@@]2(NC(=O)CCCc3ccccc3Cl)CCC[C@H]12	ZINC001755700090	1440899648	/nfs/dbraw/zinc/89/96/48/1440899648.db2.gz	CCLPCGITFMTNKH-ICSRJNTNSA-N	0	3	344.886	3.409	20	30		EGEDHN
C/C=C(\C)C(=O)N1C[C@@H](NCC#Cc2ccc(Cl)cc2)C(C)(C)C1	ZINC001755754529	1440913742	/nfs/dbraw/zinc/91/37/42/1440913742.db2.gz	WZGRLSOAVALFOE-LUFMRPCYSA-N	0	3	344.886	3.484	20	30		EGEDHN
C=C(C)CN(C)CCN(C(=O)Cn1c(C)nc2ccccc21)C(C)C	ZINC001755810995	1440920480	/nfs/dbraw/zinc/92/04/80/1440920480.db2.gz	UHCGKDPGEWRLJF-UHFFFAOYSA-N	0	3	342.487	3.090	20	30		EGEDHN
C=C(Br)CNC[C@@H](NC(=O)CC1CCC1)C(C)(C)C	ZINC001755820441	1440925489	/nfs/dbraw/zinc/92/54/89/1440925489.db2.gz	PVOOKUULBMCROJ-CYBMUJFWSA-N	0	3	331.298	3.206	20	30		EGEDHN
CC(C)(C)[C@@H](CNCc1ccc(C#N)s1)NC(=O)CCC1CC1	ZINC001755821606	1440925904	/nfs/dbraw/zinc/92/59/04/1440925904.db2.gz	OXLPPAMVKGUCFR-MRXNPFEDSA-N	0	3	333.501	3.430	20	30		EGEDHN
C=C(C)CN(CCNC(=O)c1oc2ccc(F)cc2c1C)CCOC	ZINC001755839370	1440931250	/nfs/dbraw/zinc/93/12/50/1440931250.db2.gz	MIPGQDHPRBIXSI-UHFFFAOYSA-N	0	3	348.418	3.135	20	30		EGEDHN
CC#CCN1CCC([C@@H](C)NC(=O)Cc2cccc3cccnc32)CC1	ZINC001755844181	1440932559	/nfs/dbraw/zinc/93/25/59/1440932559.db2.gz	LFRAVJPNAGZIGA-QGZVFWFLSA-N	0	3	349.478	3.017	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N(C)C1CC(NCc2ccncc2Cl)C1	ZINC001755859638	1440936322	/nfs/dbraw/zinc/93/63/22/1440936322.db2.gz	ASFSEWSZDSOXPR-JEYLPNPQSA-N	0	3	335.879	3.416	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N(C)C1CC(NCc2ccc(C#N)cc2F)C1	ZINC001755860271	1440936561	/nfs/dbraw/zinc/93/65/61/1440936561.db2.gz	YLEGEUVJMQKMJL-LHHJGKSTSA-N	0	3	341.430	3.299	20	30		EGEDHN
C=CCN1CC=C(CNC(=O)CCOc2cc(C)cc(C)c2)CC1	ZINC001755887196	1440940538	/nfs/dbraw/zinc/94/05/38/1440940538.db2.gz	JGBBGYJQJLXULX-UHFFFAOYSA-N	0	3	328.456	3.007	20	30		EGEDHN
COc1ccc([C@@H](CNCc2cccc(C#N)c2)N2CCCC2)cc1	ZINC000053095684	214163724	/nfs/dbraw/zinc/16/37/24/214163724.db2.gz	QQQYPKYXZOHTIF-OAQYLSRUSA-N	0	3	335.451	3.494	20	30		EGEDHN
CN(Cc1cc(C#N)n(C)c1)[C@H]1CCCN(C(=O)OC(C)(C)C)CC1	ZINC000369001784	168390701	/nfs/dbraw/zinc/39/07/01/168390701.db2.gz	QVFJESBHTFTBFV-INIZCTEOSA-N	0	3	346.475	3.118	20	30		EGEDHN
CCc1ccc([C@@H](CN2CCOCC2)NCc2cccc(C#N)c2)cc1	ZINC000183343795	529707869	/nfs/dbraw/zinc/70/78/69/529707869.db2.gz	WGUCRQXDRJAEHJ-JOCHJYFZSA-N	0	3	349.478	3.284	20	30		EGEDHN
CCN(C)CCNC(=O)c1ccccc1Sc1ccccc1C#N	ZINC000066958460	215098384	/nfs/dbraw/zinc/09/83/84/215098384.db2.gz	KUMIOKYSCLIUGB-UHFFFAOYSA-N	0	3	339.464	3.391	20	30		EGEDHN
C[C@@H](NC(C)(C)CNC(=O)Cc1ccc(C#N)cc1)c1ccccc1	ZINC000068387389	215303715	/nfs/dbraw/zinc/30/37/15/215303715.db2.gz	ODWFVMXQKQCZHR-MRXNPFEDSA-N	0	3	335.451	3.346	20	30		EGEDHN
C[C@H](NCc1cccc(CN2CCOCC2)c1)c1cccc(C#N)c1	ZINC000181530573	234220559	/nfs/dbraw/zinc/22/05/59/234220559.db2.gz	WZDZPWRIDFESDO-KRWDZBQOSA-N	0	3	335.451	3.241	20	30		EGEDHN
C#CCOc1ccc(CN[C@H](C)c2ccc3c(c2)CC(=O)N3C)cc1	ZINC000264962143	247091250	/nfs/dbraw/zinc/09/12/50/247091250.db2.gz	OMLJHZMQXZHFOJ-OAHLLOKOSA-N	0	3	334.419	3.068	20	30		EGEDHN
C#CCCOc1ccc(CN[C@@H](C)[C@@H](O)c2ccc(F)cc2)cc1	ZINC000265243699	247331885	/nfs/dbraw/zinc/33/18/85/247331885.db2.gz	MGKFESJMVRJTMS-MGPUTAFESA-N	0	3	327.399	3.440	20	30		EGEDHN
CC[C@@H](CNc1ccccc1)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000452459425	269675370	/nfs/dbraw/zinc/67/53/70/269675370.db2.gz	IWIZEXHBIKGHBI-OALUTQOASA-N	0	3	346.434	3.247	20	30		EGEDHN
C[C@H](N[C@@H]1CC(=O)N([C@@H]2C[C@@H]2c2ccccc2)C1)c1cccc(C#N)c1	ZINC000378449765	169122804	/nfs/dbraw/zinc/12/28/04/169122804.db2.gz	GIPCYQOFHNHTEM-LWILDLIXSA-N	0	3	345.446	3.366	20	30		EGEDHN
C[C@H](N[C@@H]1CC(=O)N([C@@H]2C[C@H]2c2ccccc2)C1)c1cccc(C#N)c1	ZINC000378449768	169123559	/nfs/dbraw/zinc/12/35/59/169123559.db2.gz	GIPCYQOFHNHTEM-PSMQTCRGSA-N	0	3	345.446	3.366	20	30		EGEDHN
CN(CCC1CCN(c2ccncc2)CC1)C(=O)c1ccc(C#N)cc1	ZINC000092503634	218146146	/nfs/dbraw/zinc/14/61/46/218146146.db2.gz	IFQRDGOOMPHNMU-UHFFFAOYSA-N	0	3	348.450	3.332	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(c3ncnc4sccc43)CC2)cc1	ZINC000009721565	211117227	/nfs/dbraw/zinc/11/72/27/211117227.db2.gz	VXFJDQBOMXEZCG-UHFFFAOYSA-N	0	3	349.463	3.275	20	30		EGEDHN
C[C@H]1CCN(C[C@@H](O)c2ccc(C#N)cc2)CCN1Cc1ccccc1	ZINC000268616606	252071404	/nfs/dbraw/zinc/07/14/04/252071404.db2.gz	MNLBXTACDTYPTP-PGRDOPGGSA-N	0	3	349.478	3.188	20	30		EGEDHN
C[C@@H](NCc1ccccc1CN1CCOCC1)c1ccc(C#N)cc1	ZINC000173821886	533460325	/nfs/dbraw/zinc/46/03/25/533460325.db2.gz	YCJVJFJPAYXPGU-QGZVFWFLSA-N	0	3	335.451	3.241	20	30		EGEDHN
CN(C)C[C@@H](NC(=O)Nc1cccc(C#N)c1)c1ccc(F)cc1	ZINC000338359120	141105999	/nfs/dbraw/zinc/10/59/99/141105999.db2.gz	OOHFJMPRDCBKPL-QGZVFWFLSA-N	0	3	326.375	3.122	20	30		EGEDHN
Cc1nsc(N(C)[C@@H]2CCCN(Cc3ccccc3)C2)c1C#N	ZINC000342793588	141149003	/nfs/dbraw/zinc/14/90/03/141149003.db2.gz	VTXHJDJTCPYMKJ-MRXNPFEDSA-N	0	3	326.469	3.424	20	30		EGEDHN
N#Cc1ccc(CNCCCc2nc(-c3ccc(F)cc3)no2)o1	ZINC000184170442	144087957	/nfs/dbraw/zinc/08/79/57/144087957.db2.gz	SPGQBRGLWNRJQR-UHFFFAOYSA-N	0	3	326.331	3.063	20	30		EGEDHN
C[C@@H](CNC(=O)CSc1ccc(C#N)cc1)N1CCCC[C@@H]1C	ZINC000343206217	144194566	/nfs/dbraw/zinc/19/45/66/144194566.db2.gz	MLSFSLSBFFQIAN-GJZGRUSLSA-N	0	3	331.485	3.029	20	30		EGEDHN
CN(C)CCOc1ccc(NC(=O)c2cccc(C#N)c2)cc1Cl	ZINC000116816721	152077122	/nfs/dbraw/zinc/07/71/22/152077122.db2.gz	LQJVMUNOZVYZGE-UHFFFAOYSA-N	0	3	343.814	3.404	20	30		EGEDHN
CCN1C[C@@H](C)N(Cc2ccc(Br)cc2C#N)C[C@H]1C	ZINC000346979479	156228496	/nfs/dbraw/zinc/22/84/96/156228496.db2.gz	LQXVCACWOAVJSU-CHWSQXEVSA-N	0	3	336.277	3.235	20	30		EGEDHN
C[C@H](NC[C@H]1CC[C@@H](c2nc(C3CC3)no2)O1)c1cccc(C#N)c1	ZINC000372621313	157369204	/nfs/dbraw/zinc/36/92/04/157369204.db2.gz	RRHAKQFHISFKAV-VUCTXSBTSA-N	0	3	338.411	3.390	20	30		EGEDHN
C[C@@H](NC(=O)Cc1c(F)cccc1C#N)[C@@H](c1ccccc1)N(C)C	ZINC000354768783	166027455	/nfs/dbraw/zinc/02/74/55/166027455.db2.gz	YJYIVUUJEBGDIM-VLIAUNLRSA-N	0	3	339.414	3.047	20	30		EGEDHN
CN(CCOCc1ccc(C#N)cc1)CCOc1cccc(F)c1	ZINC000344116608	164106655	/nfs/dbraw/zinc/10/66/55/164106655.db2.gz	OFODDGNQAVBWKB-UHFFFAOYSA-N	0	3	328.387	3.225	20	30		EGEDHN
CCCN(CCN1CCN(CC)CC1)Cc1ccc(Cl)cc1C#N	ZINC000344116890	164106760	/nfs/dbraw/zinc/10/67/60/164106760.db2.gz	AYUFFZBKGWGKAF-UHFFFAOYSA-N	0	3	348.922	3.061	20	30		EGEDHN
COc1ccccc1OCCN(C)CCOCc1ccc(C#N)cc1	ZINC000344121200	164108758	/nfs/dbraw/zinc/10/87/58/164108758.db2.gz	SQXCJUGSWYKRPU-UHFFFAOYSA-N	0	3	340.423	3.094	20	30		EGEDHN
COc1cccc(N2C[C@H](N[C@@H](C)c3ccc(C#N)cc3)CC2=O)c1	ZINC000344172079	164119665	/nfs/dbraw/zinc/11/96/65/164119665.db2.gz	OCFJPHLMACRRNF-WMLDXEAASA-N	0	3	335.407	3.023	20	30		EGEDHN
C[C@H](NCCNC(=O)c1ccccc1Cl)c1ccc(C#N)c(F)c1	ZINC000346177092	164357287	/nfs/dbraw/zinc/35/72/87/164357287.db2.gz	IHQJOTAZYULXAW-LBPRGKRZSA-N	0	3	345.805	3.431	20	30		EGEDHN
CC[C@@H](C)N[C@H](CNC(=O)c1c(F)cc(C#N)cc1F)c1ccco1	ZINC000359564634	167195529	/nfs/dbraw/zinc/19/55/29/167195529.db2.gz	UEOZAKUBMIUERR-IAQYHMDHSA-N	0	3	347.365	3.289	20	30		EGEDHN
C[C@@H](NC[C@@H](O)Cn1cccn1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000359856018	167251008	/nfs/dbraw/zinc/25/10/08/167251008.db2.gz	CAINBJMQNALCJB-IIBYNOLFSA-N	0	3	346.434	3.133	20	30		EGEDHN
C[C@H]1COc2ccccc2CN1CCC(=O)Nc1ccccc1C#N	ZINC000360680756	167386723	/nfs/dbraw/zinc/38/67/23/167386723.db2.gz	NANHCPCUVCLYAJ-HNNXBMFYSA-N	0	3	335.407	3.170	20	30		EGEDHN
C[C@H]1C[C@H](Nc2cc(C#N)c3cc([N+](=O)[O-])ccc3n2)CN1C1CC1	ZINC000302702862	269895629	/nfs/dbraw/zinc/89/56/29/269895629.db2.gz	XTKHVBCQCYXERO-AAEUAGOBSA-N	0	3	337.383	3.052	20	30		EGEDHN
N#Cc1cccc(Cl)c1NC[C@@H](O)CN1CCc2ccccc2C1	ZINC000301532511	270044054	/nfs/dbraw/zinc/04/40/54/270044054.db2.gz	PXZBRKFRVSOECC-QGZVFWFLSA-N	0	3	341.842	3.043	20	30		EGEDHN
C#CCNC(=O)[C@H](C)N[C@H](C)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000368057149	270045829	/nfs/dbraw/zinc/04/58/29/270045829.db2.gz	BUQCPCMPYJYZAQ-CVEARBPZSA-N	0	3	331.419	3.014	20	30		EGEDHN
CCC(CC)N(CC)CC(=O)Nc1c(C#N)cnn1-c1ccccc1	ZINC000289476890	266002901	/nfs/dbraw/zinc/00/29/01/266002901.db2.gz	RKTLJYRORUZYIR-UHFFFAOYSA-N	0	3	339.443	3.193	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)C[C@@H](O)COCc1cccs1	ZINC000298581331	266050576	/nfs/dbraw/zinc/05/05/76/266050576.db2.gz	UXXTYRKZIHGSLX-GOSISDBHSA-N	0	3	344.480	3.409	20	30		EGEDHN
CCCCCNC(=O)C1CCN(Cc2ccc(C#N)c(C)c2)CC1	ZINC000486794603	267002816	/nfs/dbraw/zinc/00/28/16/267002816.db2.gz	NSNINTLPAJMQAE-UHFFFAOYSA-N	0	3	327.472	3.385	20	30		EGEDHN
CCCCNC(=O)[C@@H]1CC[C@H](C)N(Cc2ccc(C#N)c(C)c2)C1	ZINC000486702498	267009666	/nfs/dbraw/zinc/00/96/66/267009666.db2.gz	BTMSFETWFHXZPL-QFBILLFUSA-N	0	3	327.472	3.384	20	30		EGEDHN
CCC[C@@H](CCc1ccccc1)N[C@@H](C(N)=O)c1ccc(C#N)cc1	ZINC000439602076	267032357	/nfs/dbraw/zinc/03/23/57/267032357.db2.gz	FBOFVWYGDDTPQI-VQTJNVASSA-N	0	3	335.451	3.476	20	30		EGEDHN
C[C@@H]1CN(CCC2CCN(c3ccc(C#N)cc3)CC2)C[C@H](C)O1	ZINC000301558126	267048103	/nfs/dbraw/zinc/04/81/03/267048103.db2.gz	NYPJMACGHRKQTK-CALCHBBNSA-N	0	3	327.472	3.274	20	30		EGEDHN
C[C@@H]1CN(CCC2CCN(c3cccc(F)c3C#N)CC2)C[C@H](C)O1	ZINC000301528666	267048272	/nfs/dbraw/zinc/04/82/72/267048272.db2.gz	GWRXQQRAUPKQIP-IYBDPMFKSA-N	0	3	345.462	3.413	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)c1cc(C#N)[nH]c1C)c1ccsc1	ZINC000448693874	267060637	/nfs/dbraw/zinc/06/06/37/267060637.db2.gz	HLXWJOMWADWOCN-MRXNPFEDSA-N	0	3	330.457	3.069	20	30		EGEDHN
C[C@@H]1CN(c2ncc(Br)cc2C#N)CCN(C2CCC2)C1	ZINC000295647486	267065131	/nfs/dbraw/zinc/06/51/31/267065131.db2.gz	FYAFFJCQNJGXEZ-LBPRGKRZSA-N	0	3	349.276	3.026	20	30		EGEDHN
CCO[C@@H]1C[C@H](NCc2ccc(C#N)c(F)c2)[C@H]1Oc1ccccc1	ZINC000453368727	267152387	/nfs/dbraw/zinc/15/23/87/267152387.db2.gz	DTSUHVZIBLUSBR-XUVXKRRUSA-N	0	3	340.398	3.412	20	30		EGEDHN
C[C@H](NCCC(=O)Nc1sc2c(c1C#N)CCC2)c1cccnc1	ZINC000299722755	267181438	/nfs/dbraw/zinc/18/14/38/267181438.db2.gz	SUSDUFLTMYTSKO-LBPRGKRZSA-N	0	3	340.452	3.183	20	30		EGEDHN
C[C@H]1CCC[C@@H]1CC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000185896277	267215380	/nfs/dbraw/zinc/21/53/80/267215380.db2.gz	OSSDDXKVAGNZHO-QFBILLFUSA-N	0	3	327.472	3.275	20	30		EGEDHN
C[C@H]1CC[C@@H](CC(=O)N(CCN(C)C)Cc2cccc(C#N)c2)C1	ZINC000177689027	267220729	/nfs/dbraw/zinc/22/07/29/267220729.db2.gz	SFLLSMIIKRSRMV-DLBZAZTESA-N	0	3	327.472	3.275	20	30		EGEDHN
C[C@H]1[C@H](NC(=O)NCc2ccc(C#N)cc2)CCN1Cc1ccccc1	ZINC000287083051	267252790	/nfs/dbraw/zinc/25/27/90/267252790.db2.gz	MAXNHPOPXDOIRO-OXJNMPFZSA-N	0	3	348.450	3.020	20	30		EGEDHN
CN(C)[C@@H](CNc1ncc(Br)cc1C#N)c1ccccc1	ZINC000450220490	267285691	/nfs/dbraw/zinc/28/56/91/267285691.db2.gz	ZPNWMEKIPNRCRK-HNNXBMFYSA-N	0	3	345.244	3.431	20	30		EGEDHN
Cc1cc(N2CCCN(Cc3ccc(C#N)cc3)CC2)nc(C(C)C)n1	ZINC000301106248	267335632	/nfs/dbraw/zinc/33/56/32/267335632.db2.gz	UCQGBNOLRVWABD-UHFFFAOYSA-N	0	3	349.482	3.492	20	30		EGEDHN
C[C@H](CCCc1cccnc1)N[C@@H](C)C(=O)Nc1cccc(C#N)c1	ZINC000459631139	267819650	/nfs/dbraw/zinc/81/96/50/267819650.db2.gz	BPDOHRGUBJCIPT-CVEARBPZSA-N	0	3	336.439	3.281	20	30		EGEDHN
Cc1ccc([C@@H]2C[C@@H](C)N(CC(=O)NCc3cccc(C#N)c3)C2)cc1	ZINC000490101024	268044937	/nfs/dbraw/zinc/04/49/37/268044937.db2.gz	QSJVIUKNKNHCSA-DYESRHJHSA-N	0	3	347.462	3.361	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCCc2cc3ccccc3[nH]2)cc1	ZINC000348323134	268085216	/nfs/dbraw/zinc/08/52/16/268085216.db2.gz	HIEYUJGLPRAQBE-SFHVURJKSA-N	0	3	342.402	3.081	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCC2(c3cccc(F)c3)CC2)cc1	ZINC000280296230	268085520	/nfs/dbraw/zinc/08/55/20/268085520.db2.gz	FLMFGWCUAQSGOE-KRWDZBQOSA-N	0	3	347.393	3.228	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@H]2C[C@H](c3cccc(F)c3)C2)cc1	ZINC000280800876	268092171	/nfs/dbraw/zinc/09/21/71/268092171.db2.gz	YGYZQHOFGJRTDT-QWFCFKBJSA-N	0	3	347.393	3.442	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@@H]2C[C@@H]2c2ccc(F)cc2)cc1	ZINC000348504416	268092207	/nfs/dbraw/zinc/09/22/07/268092207.db2.gz	CFTZNEOVOKPFTR-BHIYHBOVSA-N	0	3	333.366	3.052	20	30		EGEDHN
N#Cc1cc(Br)ccc1CN[C@@H]([C@H](CO)C1CC1)C1CC1	ZINC000451611108	268174760	/nfs/dbraw/zinc/17/47/60/268174760.db2.gz	LBQDANDNZKOEAS-IAGOWNOFSA-N	0	3	349.272	3.207	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCN(C[C@H]3CCC4(CCCCC4)O3)C2)nc1	ZINC000330223040	268181658	/nfs/dbraw/zinc/18/16/58/268181658.db2.gz	ACHPVOMBYUYZGV-QZTJIDSGSA-N	0	3	341.455	3.288	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCN(CCCCC3CCOCC3)C2)nc1	ZINC000292242906	268185117	/nfs/dbraw/zinc/18/51/17/268185117.db2.gz	QIVUFRCWCBSNKL-SFHVURJKSA-N	0	3	329.444	3.003	20	30		EGEDHN
N#Cc1cc2c(nc1N1C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C1)CCC2	ZINC000425281138	268193900	/nfs/dbraw/zinc/19/39/00/268193900.db2.gz	YRITVGWJJXRRHO-GHTZIAJQSA-N	0	3	344.462	3.153	20	30		EGEDHN
N#Cc1ccc(CNC(=O)[C@H]2CCCCN2C2CCCC2)cc1F	ZINC000456838317	268230988	/nfs/dbraw/zinc/23/09/88/268230988.db2.gz	NFPVKBGFWLMZPM-GOSISDBHSA-N	0	3	329.419	3.111	20	30		EGEDHN
N#Cc1cccc(C2(NC[C@H](O)COc3ccccc3Cl)CC2)c1	ZINC000271819828	268241123	/nfs/dbraw/zinc/24/11/23/268241123.db2.gz	RXROJNBMUROWQW-INIZCTEOSA-N	0	3	342.826	3.230	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@H](c3nnc4n3CCCCC4)C2)c1	ZINC000298107528	268248132	/nfs/dbraw/zinc/24/81/32/268248132.db2.gz	KIWSYQKOYXHNAZ-GOSISDBHSA-N	0	3	335.455	3.256	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CN1CCC[C@H]1c1ccsc1	ZINC000528350220	268300916	/nfs/dbraw/zinc/30/09/16/268300916.db2.gz	LSKKFLOWSKMREV-SJORKVTESA-N	0	3	328.437	3.197	20	30		EGEDHN
CCCN(CCN1CCCCC1)C(=O)[C@@H](C)c1cccc(C#N)c1	ZINC000462448786	269652544	/nfs/dbraw/zinc/65/25/44/269652544.db2.gz	BBFBPDOCNQMTQH-KRWDZBQOSA-N	0	3	327.472	3.386	20	30		EGEDHN
CCN(CCc1ccccc1)[C@H]1CCN(c2ccc(C#N)cc2)C1=O	ZINC000343587924	276134689	/nfs/dbraw/zinc/13/46/89/276134689.db2.gz	HTPBPEXEBQJNCR-FQEVSTJZSA-N	0	3	333.435	3.228	20	30		EGEDHN
CN(C)CCN(Cc1cccs1)C(=O)/C=C\c1cccc(C#N)c1	ZINC000255642030	308056718	/nfs/dbraw/zinc/05/67/18/308056718.db2.gz	PRKAKVABFIUITB-HJWRWDBZSA-N	0	3	339.464	3.223	20	30		EGEDHN
N#Cc1cccc(OC2CCN(Cc3ccc4[nH]cnc4c3)CC2)c1	ZINC000535081266	314025182	/nfs/dbraw/zinc/02/51/82/314025182.db2.gz	PYQJNMRURPXSHN-UHFFFAOYSA-N	0	3	332.407	3.478	20	30		EGEDHN
N#Cc1cccc(OC2CCN(Cc3ccc4nc[nH]c4c3)CC2)c1	ZINC000535081266	314025185	/nfs/dbraw/zinc/02/51/85/314025185.db2.gz	PYQJNMRURPXSHN-UHFFFAOYSA-N	0	3	332.407	3.478	20	30		EGEDHN
CCOC(=O)COc1ccc(CN[C@H](C)c2ccc(C#N)cc2)cc1	ZINC000537295151	314172779	/nfs/dbraw/zinc/17/27/79/314172779.db2.gz	NICYVRLHKRHMNZ-OAHLLOKOSA-N	0	3	338.407	3.351	20	30		EGEDHN
N#Cc1cnn2c1NC[C@H](CN[C@@H](CC(F)(F)F)c1ccccc1)C2	ZINC000561220757	315749563	/nfs/dbraw/zinc/74/95/63/315749563.db2.gz	BKYVIUIEKMAQBD-WFASDCNBSA-N	0	3	349.360	3.080	20	30		EGEDHN
Cc1c(CNC[C@@H](O)COc2ccc(C#N)cc2)oc2ccccc12	ZINC000563952648	316095864	/nfs/dbraw/zinc/09/58/64/316095864.db2.gz	OTFWVUBZSXQUGG-MRXNPFEDSA-N	0	3	336.391	3.142	20	30		EGEDHN
N#Cc1ccc(NC(=O)N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)cc1	ZINC000564831263	316214137	/nfs/dbraw/zinc/21/41/37/316214137.db2.gz	USHNLWVSUJAITK-AZUAARDMSA-N	0	3	346.434	3.296	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2NC[C@@H](O)COCc1ccccc1	ZINC000564857433	316219902	/nfs/dbraw/zinc/21/99/02/316219902.db2.gz	MILNNMHDYINJTC-CTNGQTDRSA-N	0	3	336.435	3.103	20	30		EGEDHN
Cc1nc(C(=O)N(CCN2CCCCCC2)C2CCC2)ccc1C#N	ZINC000572395703	317332604	/nfs/dbraw/zinc/33/26/04/317332604.db2.gz	VIJVWYFBSAECMG-UHFFFAOYSA-N	0	3	340.471	3.132	20	30		EGEDHN
C=CCN1CCC(NC(=O)COc2cc(Cl)ccc2Cl)CC1	ZINC000171721814	455088464	/nfs/dbraw/zinc/08/84/64/455088464.db2.gz	KORROFWCCIBOFM-UHFFFAOYSA-N	0	3	343.254	3.139	20	30		EGEDHN
CN(CCCSCC#N)C[C@H](O)c1ccccc1Br	ZINC000295248518	455843023	/nfs/dbraw/zinc/84/30/23/455843023.db2.gz	FMWXJXSNUSQMKJ-AWEZNQCLSA-N	0	3	343.290	3.061	20	30		EGEDHN
COCCN(CCC(=O)Nc1cccc(C#N)c1)Cc1ccccc1	ZINC000384351240	324259412	/nfs/dbraw/zinc/25/94/12/324259412.db2.gz	AGJLLOFREZTMNS-UHFFFAOYSA-N	0	3	337.423	3.035	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@H]1Nc1ccc(C#N)c([N+](=O)[O-])c1	ZINC000389832267	324279812	/nfs/dbraw/zinc/27/98/12/324279812.db2.gz	IDEPGKNGFFKJAI-RDTXWAMCSA-N	0	3	336.395	3.399	20	30		EGEDHN
Cc1nc(N2CCN(c3ccnc4ccccc43)CC2)ccc1C#N	ZINC000580895456	325306599	/nfs/dbraw/zinc/30/65/99/325306599.db2.gz	BDNNTYGEDJQSMP-UHFFFAOYSA-N	0	3	329.407	3.137	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@@H](NCCNc1ccc3ccccc3n1)CC2	ZINC000581913586	325398193	/nfs/dbraw/zinc/39/81/93/325398193.db2.gz	PYRMSVQMRDCQGC-FQEVSTJZSA-N	0	3	328.419	3.217	20	30		EGEDHN
CC1(C)CCC[C@H](CNCCS(=O)(=O)c2ccc(C#N)cc2)C1	ZINC000583140039	325498403	/nfs/dbraw/zinc/49/84/03/325498403.db2.gz	JKJAVFKSKSVYCB-INIZCTEOSA-N	0	3	334.485	3.138	20	30		EGEDHN
C[S@@](=O)C[C@H](NCCCOc1cccc(C#N)c1)c1ccccc1	ZINC000183086281	455224901	/nfs/dbraw/zinc/22/49/01/455224901.db2.gz	RQQFFKHPJRIBPA-YADARESESA-N	0	3	342.464	3.037	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2csc(-c3ccc(F)cc3)n2)CC1	ZINC000264501545	455225640	/nfs/dbraw/zinc/22/56/40/455225640.db2.gz	QJBSOTCUDZHXLD-UHFFFAOYSA-N	0	3	345.443	3.329	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@@H]1NC(=O)Nc1cccc(C#N)c1	ZINC000157773836	455229919	/nfs/dbraw/zinc/22/99/19/455229919.db2.gz	WPFCHBIHIBLVQI-KXBFYZLASA-N	0	3	334.423	3.200	20	30		EGEDHN
CCOc1cccc([C@H](C)NC[C@H](O)COc2ccc(C#N)cc2)c1	ZINC000180710356	455232435	/nfs/dbraw/zinc/23/24/35/455232435.db2.gz	NJFRQSWLPJJJSI-YJBOKZPZSA-N	0	3	340.423	3.047	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCCOc1ccc(Cl)cc1Br	ZINC000451603451	458482252	/nfs/dbraw/zinc/48/22/52/458482252.db2.gz	ZTJVOUICGIBXKX-OLZOCXBDSA-N	0	3	346.652	3.414	20	30		EGEDHN
CCCCCC(=O)NC1CCN(Cc2ccc(OCC#N)cc2)CC1	ZINC000264592306	455243511	/nfs/dbraw/zinc/24/35/11/455243511.db2.gz	ZKZQSCDMPMRSOB-UHFFFAOYSA-N	0	3	343.471	3.250	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@@H]2CCc3c[nH]nc3C2)cc1OC	ZINC000623446900	460554886	/nfs/dbraw/zinc/55/48/86/460554886.db2.gz	VXHWTWXMNLCCDP-CQSZACIVSA-N	0	3	347.846	3.284	20	30		EGEDHN
COc1cccc([C@@H](CNc2ccc([N+](=O)[O-])cc2C#N)N(C)C)c1	ZINC000006250205	452929189	/nfs/dbraw/zinc/92/91/89/452929189.db2.gz	NHMSUFLBZZMARB-GOSISDBHSA-N	0	3	340.383	3.190	20	30		EGEDHN
CC[C@@H](C(=O)NCC#Cc1cccc(C(F)(F)F)c1)N(CC)CC	ZINC000605451589	460585145	/nfs/dbraw/zinc/58/51/45/460585145.db2.gz	QMODRMGICYJVOK-INIZCTEOSA-N	0	3	340.389	3.294	20	30		EGEDHN
Cc1cc(CNC[C@@H](O)COc2ccccc2C#N)ccc1Cl	ZINC000600738138	460585869	/nfs/dbraw/zinc/58/58/69/460585869.db2.gz	YLPLDHLLOMSUSK-MRXNPFEDSA-N	0	3	330.815	3.050	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(CCC)CCc2cccs2)CC1	ZINC000184119920	455354432	/nfs/dbraw/zinc/35/44/32/455354432.db2.gz	VNGZSPSUXFKJCM-UHFFFAOYSA-N	0	3	335.517	3.363	20	30		EGEDHN
C=CCOc1c(Cl)cc(CNCCc2cnc(C)cn2)cc1OC	ZINC000623544835	460605771	/nfs/dbraw/zinc/60/57/71/460605771.db2.gz	MSDROVUVCONGSU-UHFFFAOYSA-N	0	3	347.846	3.344	20	30		EGEDHN
C=CCN(CCC(=O)NC(=O)Nc1ccccc1)Cc1cccs1	ZINC000016395492	453605128	/nfs/dbraw/zinc/60/51/28/453605128.db2.gz	LHUGMTZUPKMRNP-UHFFFAOYSA-N	0	3	343.452	3.475	20	30		EGEDHN
CC(C)[C@@H](NC[C@@H](O)COc1ccc(C#N)cc1)c1ccc(F)cc1	ZINC000023678034	453715297	/nfs/dbraw/zinc/71/52/97/453715297.db2.gz	CZATWODAYBBWGI-UYAOXDASSA-N	0	3	342.414	3.424	20	30		EGEDHN
CCn1ccc(CN(C)CCC(=O)Nc2ccc(C#N)c(Cl)c2)c1	ZINC000616785216	460618723	/nfs/dbraw/zinc/61/87/23/460618723.db2.gz	CJAJKHXXTOLQOV-UHFFFAOYSA-N	0	3	344.846	3.494	20	30		EGEDHN
N#CCc1ccc(OC[C@@H](O)CN(Cc2ccccc2)C2CC2)cc1	ZINC000025259854	453762905	/nfs/dbraw/zinc/76/29/05/453762905.db2.gz	XZNBZDKZKQJYIR-FQEVSTJZSA-N	0	3	336.435	3.157	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)c1ccc(C#N)cc1)N1CCc2ccccc2C1	ZINC000025536194	453776945	/nfs/dbraw/zinc/77/69/45/453776945.db2.gz	LWDKGMSCCHVLMD-OAQYLSRUSA-N	0	3	347.462	3.371	20	30		EGEDHN
C[C@H](c1ccc(F)c(F)c1)N(C)C[C@@H](O)COc1ccc(C#N)cc1	ZINC000028275523	453823015	/nfs/dbraw/zinc/82/30/15/453823015.db2.gz	RDYCDNRIMOXPPU-CZUORRHYSA-N	0	3	346.377	3.269	20	30		EGEDHN
C=CCNC(=O)[C@H](C)N1CCC(c2c[nH]c3ccc(OC)cc32)CC1	ZINC000066436621	453845326	/nfs/dbraw/zinc/84/53/26/453845326.db2.gz	ANGOFBJDVBJKTF-AWEZNQCLSA-N	0	3	341.455	3.047	20	30		EGEDHN
CC[NH+](CC)[C@H](C/N=C/c1c([O-])c(C)ncc1CO)c1ccsc1	ZINC000032070382	453862949	/nfs/dbraw/zinc/86/29/49/453862949.db2.gz	OIYWFXYHPDUGGO-AHUIGUKZSA-N	0	3	347.484	3.151	20	30		EGEDHN
CCN(CC)[C@H](C/N=C/c1c(O)c(C)ncc1CO)c1ccsc1	ZINC000032070382	453862952	/nfs/dbraw/zinc/86/29/52/453862952.db2.gz	OIYWFXYHPDUGGO-AHUIGUKZSA-N	0	3	347.484	3.151	20	30		EGEDHN
COc1cccc(/C=N/CC2(N3CCSCC3)CCCC2)c1O	ZINC000032070235	453863247	/nfs/dbraw/zinc/86/32/47/453863247.db2.gz	CZGCXRHQPDSINY-CPNJWEJPSA-N	0	3	334.485	3.181	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N1CC[C@@H](COCC)C1	ZINC000081520407	453882442	/nfs/dbraw/zinc/88/24/42/453882442.db2.gz	BBFFNZLERGNGEM-JKSUJKDBSA-N	0	3	336.501	3.010	20	30		EGEDHN
Cc1cccc(OCCN(C)CCC(=O)Nc2sccc2C#N)c1	ZINC000032806039	453892263	/nfs/dbraw/zinc/89/22/63/453892263.db2.gz	RTWLRBJHSUSOFQ-UHFFFAOYSA-N	0	3	343.452	3.268	20	30		EGEDHN
N#Cc1ccc(N2CCC(NCc3cc4ccccc4o3)CC2)nc1	ZINC000067011029	453894154	/nfs/dbraw/zinc/89/41/54/453894154.db2.gz	BGLYDJXKNQVAMM-UHFFFAOYSA-N	0	3	332.407	3.458	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N[C@H](CN1CCCCC1)c1ccccc1	ZINC000075630653	453912943	/nfs/dbraw/zinc/91/29/43/453912943.db2.gz	JBBHGOZJEZHIBL-IEBWSBKVSA-N	0	3	330.472	3.311	20	30		EGEDHN
C=C(C)COc1cccc(NC(=O)N2CC[C@H](N3CCCC3)C2)c1	ZINC000067320800	453921795	/nfs/dbraw/zinc/92/17/95/453921795.db2.gz	JAAUUJAEACZPLJ-KRWDZBQOSA-N	0	3	329.444	3.344	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)CN(Cc1ccccc1)CC1CCC1	ZINC000067462875	453933530	/nfs/dbraw/zinc/93/35/30/453933530.db2.gz	DNVDMILRDHYDKR-HXUWFJFHSA-N	0	3	327.472	3.343	20	30		EGEDHN
C=C(C)C[N@@H+](C)Cc1cccc([N-]S(=O)(=O)c2ccccc2)c1	ZINC000075938805	453940556	/nfs/dbraw/zinc/94/05/56/453940556.db2.gz	HEIKDEVMXBCNGU-UHFFFAOYSA-N	0	3	330.453	3.495	20	30		EGEDHN
C=C(C)C[N@H+](C)Cc1cccc([N-]S(=O)(=O)c2ccccc2)c1	ZINC000075938805	453940558	/nfs/dbraw/zinc/94/05/58/453940558.db2.gz	HEIKDEVMXBCNGU-UHFFFAOYSA-N	0	3	330.453	3.495	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2ccc(C#N)cc2)C1	ZINC000054720030	453944689	/nfs/dbraw/zinc/94/46/89/453944689.db2.gz	PPGFTGDBKKBEIT-UZLBHIALSA-N	0	3	348.450	3.193	20	30		EGEDHN
C[C@H](CN1CCC[C@@H](C)C1)NC(=O)CSCc1ccc(C#N)cc1	ZINC000055406256	453982165	/nfs/dbraw/zinc/98/21/65/453982165.db2.gz	VSPABBGRAKEQCJ-HZPDHXFCSA-N	0	3	345.512	3.028	20	30		EGEDHN
C[C@@H](N[C@@H]1CCN(c2ncccc2F)C1)c1ccc(OCC#N)cc1	ZINC000181884889	455394243	/nfs/dbraw/zinc/39/42/43/455394243.db2.gz	MYHMYHHWFPMNQC-GDBMZVCRSA-N	0	3	340.402	3.053	20	30		EGEDHN
CCN(CCOc1ccc(C#N)cc1)C[C@H]1COc2ccccc2O1	ZINC000069286495	454091956	/nfs/dbraw/zinc/09/19/56/454091956.db2.gz	ZNAAPBQXMWVABS-SFHVURJKSA-N	0	3	338.407	3.099	20	30		EGEDHN
Cc1csc(CON=C(N)c2cccc(CN3CCCCC3)c2)n1	ZINC000088519742	454109471	/nfs/dbraw/zinc/10/94/71/454109471.db2.gz	NDHZXSAREQHCOK-UHFFFAOYSA-N	0	3	344.484	3.275	20	30		EGEDHN
C#CCOc1ccccc1CNC1CCN(C(=O)C(CC)CC)CC1	ZINC000069756454	454141026	/nfs/dbraw/zinc/14/10/26/454141026.db2.gz	IUSBRVIAMOOFED-UHFFFAOYSA-N	0	3	342.483	3.215	20	30		EGEDHN
C=C(C)COc1cc(CNCCC(=O)N[C@H](C)CC)ccc1OC	ZINC000057965136	454158708	/nfs/dbraw/zinc/15/87/08/454158708.db2.gz	WASGNHAPZQMZER-OAHLLOKOSA-N	0	3	334.460	3.045	20	30		EGEDHN
C=C(C)COCCNC(=O)NCC(C)(C)N[C@@H](C)c1ccccc1	ZINC000130206821	454181418	/nfs/dbraw/zinc/18/14/18/454181418.db2.gz	KQVKMTVIPNGVRA-INIZCTEOSA-N	0	3	333.476	3.008	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H](c2ccc(F)cc2F)C(C)C)CC1	ZINC000119289507	454184585	/nfs/dbraw/zinc/18/45/85/454184585.db2.gz	UIYWSMOZWUECKA-SFHVURJKSA-N	0	3	334.410	3.123	20	30		EGEDHN
CCOC(=O)COc1ccc(CN(C)Cc2cccc(C#N)c2)cc1	ZINC000130777891	454218075	/nfs/dbraw/zinc/21/80/75/454218075.db2.gz	YUSJUAAAKCZTDO-UHFFFAOYSA-N	0	3	338.407	3.132	20	30		EGEDHN
C[C@@H]1CN(CC2CCN(Cc3ccc(F)c(C#N)c3)CC2)C[C@@H](C)O1	ZINC000119795695	454221372	/nfs/dbraw/zinc/22/13/72/454221372.db2.gz	MVDPYRMTEOCRMS-HZPDHXFCSA-N	0	3	345.462	3.019	20	30		EGEDHN
C=C(C)CN(CC)C[C@@H](O)COc1ccc(Br)cc1	ZINC000046342169	454243173	/nfs/dbraw/zinc/24/31/73/454243173.db2.gz	RTKRDMUNKNFDIX-CQSZACIVSA-N	0	3	328.250	3.087	20	30		EGEDHN
COc1ccc(CNCCN2CCC(C)CC2)cc1OCCCC#N	ZINC000119998263	454245443	/nfs/dbraw/zinc/24/54/43/454245443.db2.gz	PLBZRBRYSUDQMT-UHFFFAOYSA-N	0	3	345.487	3.199	20	30		EGEDHN
Cn1ccnc1C[C@H]1CCCN(CC#Cc2cccc(Cl)c2)C1	ZINC000090004356	454260567	/nfs/dbraw/zinc/26/05/67/454260567.db2.gz	POUPYPBTISXONG-QGZVFWFLSA-N	0	3	327.859	3.380	20	30		EGEDHN
CCc1ccc([C@H](C)NC[C@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000120229906	454275421	/nfs/dbraw/zinc/27/54/21/454275421.db2.gz	NTPUKCAYVDYHGL-JXFKEZNVSA-N	0	3	338.451	3.406	20	30		EGEDHN
Cc1ncc([C@H](C)NC2CCN(c3ccc(C#N)cn3)CC2)s1	ZINC000090407463	454300808	/nfs/dbraw/zinc/30/08/08/454300808.db2.gz	UFBKQUVKNKOGSB-LBPRGKRZSA-N	0	3	327.457	3.038	20	30		EGEDHN
CCc1ccc([C@@H](NCC(=O)N[C@@](C)(C#N)C2CC2)C(C)C)cc1	ZINC000072835429	454347684	/nfs/dbraw/zinc/34/76/84/454347684.db2.gz	RGSKWHLJDMDIIM-PMACEKPBSA-N	0	3	327.472	3.344	20	30		EGEDHN
O=C(NCC#Cc1ccccc1)N[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000061660994	454352130	/nfs/dbraw/zinc/35/21/30/454352130.db2.gz	RFUJLEOUFFSTQA-OAQYLSRUSA-N	0	3	347.462	3.002	20	30		EGEDHN
C=CCN(CCc1ccccc1)C[C@@H](O)COc1cccc(C)c1	ZINC000062364274	454375137	/nfs/dbraw/zinc/37/51/37/454375137.db2.gz	IDKCAGFXQBLRNC-HXUWFJFHSA-N	0	3	325.452	3.465	20	30		EGEDHN
N#Cc1cc([N+](=O)[O-])ccc1N1CCCN(Cc2ccccc2)CC1	ZINC000073109753	454396098	/nfs/dbraw/zinc/39/60/98/454396098.db2.gz	XRCQDONBRKPJNX-UHFFFAOYSA-N	0	3	336.395	3.179	20	30		EGEDHN
CN(C)[C@@H](CNC(=O)c1cccc(SCC#N)c1)c1ccccc1	ZINC000079383865	454405755	/nfs/dbraw/zinc/40/57/55/454405755.db2.gz	UIEBKSZRJFFWNX-SFHVURJKSA-N	0	3	339.464	3.335	20	30		EGEDHN
CN(CCNC(=O)c1cccc(SCC#N)c1)Cc1ccccc1	ZINC000079437838	454414809	/nfs/dbraw/zinc/41/48/09/454414809.db2.gz	JVZUYHRXJNATLI-UHFFFAOYSA-N	0	3	339.464	3.164	20	30		EGEDHN
C[C@@H](CNC(=O)c1cccc(SCC#N)c1)N1CCC(C)CC1	ZINC000079537082	454433275	/nfs/dbraw/zinc/43/32/75/454433275.db2.gz	NOGJQLDQLDWFPU-HNNXBMFYSA-N	0	3	331.485	3.152	20	30		EGEDHN
CN(C)Cc1cccc(C(=O)N[C@H](C#N)c2ccc(Cl)cc2)c1	ZINC000073455070	454437012	/nfs/dbraw/zinc/43/70/12/454437012.db2.gz	BEHZQCTZSPXPCS-QGZVFWFLSA-N	0	3	327.815	3.396	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2CCCN(C(C)(C)C)CC2)cc1OC	ZINC000063727494	454442832	/nfs/dbraw/zinc/44/28/32/454442832.db2.gz	RLJZWOGUTYGYKN-UHFFFAOYSA-N	0	3	346.471	3.206	20	30		EGEDHN
C#CCCOc1ccc(CN2CCC[C@@H](c3nc(C)no3)C2)cc1	ZINC000091832898	454478521	/nfs/dbraw/zinc/47/85/21/454478521.db2.gz	RKYDORHUKLKRCN-QGZVFWFLSA-N	0	3	325.412	3.160	20	30		EGEDHN
C[C@@H](NC(=O)NC[C@H](C)N1CCC(C)CC1)c1cccc(C#N)c1	ZINC000073897912	454498624	/nfs/dbraw/zinc/49/86/24/454498624.db2.gz	GUERIKXWLSGRPV-JKSUJKDBSA-N	0	3	328.460	3.039	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN(CCCO)Cc2cccc(Cl)c2)cc1	ZINC000134293100	454524735	/nfs/dbraw/zinc/52/47/35/454524735.db2.gz	MOAIARRZPVJJFN-IBGZPJMESA-N	0	3	344.842	3.130	20	30		EGEDHN
C=CCN1CCC(NC(=O)/C=C/c2cnc(C(C)(C)C)s2)CC1	ZINC000080079434	454529267	/nfs/dbraw/zinc/52/92/67/454529267.db2.gz	MWDAUHKXGWPASP-VOTSOKGWSA-N	0	3	333.501	3.220	20	30		EGEDHN
N#CCc1cccc(C(=O)NC2CCN(Cc3ccccc3)CC2)c1	ZINC000049637962	454554046	/nfs/dbraw/zinc/55/40/46/454554046.db2.gz	KXXCZNQAZHJCBJ-UHFFFAOYSA-N	0	3	333.435	3.147	20	30		EGEDHN
Cc1ccccc1CCC(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000103432696	454556471	/nfs/dbraw/zinc/55/64/71/454556471.db2.gz	OWZSGCLSVRLKNT-UHFFFAOYSA-N	0	3	349.478	3.390	20	30		EGEDHN
COc1cc(CN[C@H](C)c2ccc(C#N)cc2)cc(OC)c1OC	ZINC000074336446	454566390	/nfs/dbraw/zinc/56/63/90/454566390.db2.gz	IVKMXKHZCKIBCC-CYBMUJFWSA-N	0	3	326.396	3.435	20	30		EGEDHN
CN(CCNC(=O)Nc1ccc(C#N)c(Cl)c1)Cc1ccccc1	ZINC000065438008	454567378	/nfs/dbraw/zinc/56/73/78/454567378.db2.gz	KSJZBGRJKJTHPV-UHFFFAOYSA-N	0	3	342.830	3.465	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)c1ccc(C(F)(F)F)nc1	ZINC000122890277	454579010	/nfs/dbraw/zinc/57/90/10/454579010.db2.gz	XHYACYUVYSMVFG-LLVKDONJSA-N	0	3	344.296	3.477	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H](C)c2ccc(-c3ccncc3)cc2)CC1	ZINC000080462044	454584826	/nfs/dbraw/zinc/58/48/26/454584826.db2.gz	DEXYPLDGZXIWNB-QGZVFWFLSA-N	0	3	347.462	3.271	20	30		EGEDHN
CCC(=O)Nc1cccc(C([O-])=C(C#N)c2nc3ccccc3n2C)c1	ZINC000123001199	454590869	/nfs/dbraw/zinc/59/08/69/454590869.db2.gz	NXZCYULRABJLNY-HNNXBMFYSA-N	0	3	346.390	3.412	20	30		EGEDHN
CCC(=O)Nc1cccc(C(=O)C(C#N)c2nc3ccccc3n2C)c1	ZINC000123001199	454590877	/nfs/dbraw/zinc/59/08/77/454590877.db2.gz	NXZCYULRABJLNY-HNNXBMFYSA-N	0	3	346.390	3.412	20	30		EGEDHN
N#Cc1ccc(OCCN2CCC(Oc3cccc(C#N)c3)CC2)cc1	ZINC000104715635	454598480	/nfs/dbraw/zinc/59/84/80/454598480.db2.gz	VTZPEMRRUXYRTM-UHFFFAOYSA-N	0	3	347.418	3.352	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)CC1	ZINC000134862465	454599223	/nfs/dbraw/zinc/59/92/23/454599223.db2.gz	DZWJYYHJPXUACO-UHFFFAOYSA-N	0	3	337.807	3.019	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)CCc2ccc(C#N)cc2)CN1Cc1ccccc1	ZINC000134887883	454603023	/nfs/dbraw/zinc/60/30/23/454603023.db2.gz	LSDSLNAZGJFORA-UTKZUKDTSA-N	0	3	347.462	3.270	20	30		EGEDHN
CC(C)(CCC#N)CN1CC[C@@H](NC(=O)Nc2ccc(F)cc2)C1	ZINC000092704805	454614523	/nfs/dbraw/zinc/61/45/23/454614523.db2.gz	ZRAUSBQWTBUYCN-MRXNPFEDSA-N	0	3	332.423	3.351	20	30		EGEDHN
CCN(C[C@@H](O)COc1ccc(C#N)cc1)[C@@H](C)c1cccc(O)c1	ZINC000080932392	454649661	/nfs/dbraw/zinc/64/96/61/454649661.db2.gz	MEJCUXKACUMAJP-HNAYVOBHSA-N	0	3	340.423	3.087	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Cc2c(C)[nH]c3ccccc32)CC1	ZINC000106037439	454674916	/nfs/dbraw/zinc/67/49/16/454674916.db2.gz	NAGWVZZWKMVIDW-UHFFFAOYSA-N	0	3	325.456	3.176	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(SC)c([N+](=O)[O-])c2)CC1	ZINC000106040217	454675542	/nfs/dbraw/zinc/67/55/42/454675542.db2.gz	HZNZUKFVWGAQSR-UHFFFAOYSA-N	0	3	349.456	3.087	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CCCN(Cc2ccccc2C)CC1	ZINC000066314756	454682906	/nfs/dbraw/zinc/68/29/06/454682906.db2.gz	DKDRHWBYRFCTOY-GOSISDBHSA-N	0	3	330.472	3.011	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N[C@@H](C)c1nccs1)C(C)C	ZINC000106332274	454691161	/nfs/dbraw/zinc/69/11/61/454691161.db2.gz	RPCURIAMJDSADF-LSDHHAIUSA-N	0	3	336.505	3.202	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCc3ccccc3[C@H]2C)CC1	ZINC000106562877	454701491	/nfs/dbraw/zinc/70/14/91/454701491.db2.gz	VFKNKFUGCWEFJT-MRXNPFEDSA-N	0	3	327.472	3.356	20	30		EGEDHN
COc1ccccc1[C@@H](C)NC1CCN(c2ccc(C#N)cn2)CC1	ZINC000161691066	454714024	/nfs/dbraw/zinc/71/40/24/454714024.db2.gz	MJPBUHGRJBICKO-OAHLLOKOSA-N	0	3	336.439	3.281	20	30		EGEDHN
COc1ccc(CN2CCC[C@H]2C[C@H](C)O)cc1OCCCC#N	ZINC000093483151	454719523	/nfs/dbraw/zinc/71/95/23/454719523.db2.gz	ZAZWNMZJHRISTA-RDJZCZTQSA-N	0	3	332.444	3.113	20	30		EGEDHN
C=CCCOCCNC(=O)NC1CCN([C@H](C)c2ccccc2)CC1	ZINC000124375664	454725900	/nfs/dbraw/zinc/72/59/00/454725900.db2.gz	XXOSNGFSIPMLPX-QGZVFWFLSA-N	0	3	345.487	3.104	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](c2nc(C)cs2)C2CC2)CC1	ZINC000176498208	454752602	/nfs/dbraw/zinc/75/26/02/454752602.db2.gz	AMUSPOYHOHOOOG-MRXNPFEDSA-N	0	3	348.516	3.242	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2C[C@@H](C)[C@H]2c2ccccc2)CC1	ZINC000176498506	454753077	/nfs/dbraw/zinc/75/30/77/454753077.db2.gz	WAQZAUZOJXQMLT-APWZRJJASA-N	0	3	327.472	3.430	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN2C[C@@H]3CCC[C@H]3C2)cc1	ZINC000153072091	454757206	/nfs/dbraw/zinc/75/72/06/454757206.db2.gz	VMNFHMRJDPIVCR-IRXDYDNUSA-N	0	3	341.455	3.064	20	30		EGEDHN
CCC1(CC)[C@H](NCC(=O)N(CCC#N)c2ccccc2)C[C@H]1OC	ZINC000191380980	455482209	/nfs/dbraw/zinc/48/22/09/455482209.db2.gz	NPSQTSQYDZPNEQ-QZTJIDSGSA-N	0	3	343.471	3.117	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN[C@@H](C)c1ccc2c(c1)CCCC2	ZINC000154342733	454887094	/nfs/dbraw/zinc/88/70/94/454887094.db2.gz	ABKQZIZOUCFQNQ-CVEARBPZSA-N	0	3	327.472	3.224	20	30		EGEDHN
Cc1noc(C)c1CCNCc1cn(CCC#N)nc1-c1ccccc1	ZINC000113339558	454924299	/nfs/dbraw/zinc/92/42/99/454924299.db2.gz	SAGCEGWOTZNCIA-UHFFFAOYSA-N	0	3	349.438	3.401	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](C)c2cccc(F)c2F)CC1	ZINC000127356722	454957275	/nfs/dbraw/zinc/95/72/75/454957275.db2.gz	YAGYCSOIOSLXJN-CYBMUJFWSA-N	0	3	337.414	3.366	20	30		EGEDHN
N#CCCCCNC(=O)N1CCCN(CCCc2ccccc2)CC1	ZINC000170884936	454994422	/nfs/dbraw/zinc/99/44/22/454994422.db2.gz	IQVCIZKGZAMVAO-UHFFFAOYSA-N	0	3	342.487	3.030	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cccc(-c3ncco3)c2)CC1	ZINC000179160685	455014788	/nfs/dbraw/zinc/01/47/88/455014788.db2.gz	ZUGUJVQINPAZCT-UHFFFAOYSA-N	0	3	326.400	3.114	20	30		EGEDHN
C#CCCOc1ccc(CN2CCC(C(=O)NCCCC)CC2)cc1	ZINC000179330959	455034322	/nfs/dbraw/zinc/03/43/22/455034322.db2.gz	QLVXCTDKQILIQM-UHFFFAOYSA-N	0	3	342.483	3.217	20	30		EGEDHN
C[C@@H]1CCC[C@@](C#N)(NC(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000116798501	455068691	/nfs/dbraw/zinc/06/86/91/455068691.db2.gz	COSULTPVVSZWDY-OXQOHEQNSA-N	0	3	325.456	3.485	20	30		EGEDHN
C[C@@H]1CCC[C@](C#N)(NC(=O)c2cccc(CN3CCCC3)c2)C1	ZINC000116798505	455069042	/nfs/dbraw/zinc/06/90/42/455069042.db2.gz	COSULTPVVSZWDY-UZLBHIALSA-N	0	3	325.456	3.485	20	30		EGEDHN
Cc1ccc([C@@H](CNC(=O)NCCCCC#N)N2CCCC2)cc1	ZINC000171435450	455070093	/nfs/dbraw/zinc/07/00/93/455070093.db2.gz	IUCAPCWHRFMXNK-GOSISDBHSA-N	0	3	328.460	3.125	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H]2CCCOc3c(Cl)cccc32)CC1	ZINC000179757938	455075019	/nfs/dbraw/zinc/07/50/19/455075019.db2.gz	ZSGBJUKCZBDWQX-QGZVFWFLSA-N	0	3	346.858	3.015	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cccc(-c3csc(C)n3)c2)CC1	ZINC000128652086	455075277	/nfs/dbraw/zinc/07/52/77/455075277.db2.gz	FTFOTUBFSBHAMY-UHFFFAOYSA-N	0	3	339.464	3.402	20	30		EGEDHN
C=CC[C@H](C)NC(=O)NC[C@@H](c1cccc(OC)c1)N1CCCC1	ZINC000117026300	455077719	/nfs/dbraw/zinc/07/77/19/455077719.db2.gz	JNRMXZZOYDHUEQ-YJBOKZPZSA-N	0	3	331.460	3.096	20	30		EGEDHN
N#Cc1ccc(F)cc1CN1CCC[C@@H](c2n[nH]c(C3CC3)n2)C1	ZINC000152250114	455092035	/nfs/dbraw/zinc/09/20/35/455092035.db2.gz	IBMDEZVQQUOULG-CQSZACIVSA-N	0	3	325.391	3.072	20	30		EGEDHN
C[C@@H]1C[C@H]1[C@H](NCCC(=O)N(C)CCC#N)c1ccc(Cl)cc1	ZINC000180016366	455116348	/nfs/dbraw/zinc/11/63/48/455116348.db2.gz	CPGRNMVXDALQSD-MZMPZRCHSA-N	0	3	333.863	3.389	20	30		EGEDHN
C[C@@H]1C[C@@H]1[C@H](NCC(=O)N[C@@](C)(C#N)C1CC1)c1ccc(Cl)cc1	ZINC000180025224	455118573	/nfs/dbraw/zinc/11/85/73/455118573.db2.gz	JZURBRWCTHFZNH-QUSXHRHCSA-N	0	3	345.874	3.435	20	30		EGEDHN
C[C@@H](O)c1ccc(CNCc2cn(C)nc2-c2ccc(C#N)cc2)cc1	ZINC000180119795	455135028	/nfs/dbraw/zinc/13/50/28/455135028.db2.gz	JWOPAGALYSEICF-OAHLLOKOSA-N	0	3	346.434	3.302	20	30		EGEDHN
COc1ccc(C#N)cc1CN(CCc1ccccc1)[C@H]1CCOC1	ZINC000156717426	455146552	/nfs/dbraw/zinc/14/65/52/455146552.db2.gz	UEBNKFXVKGELDM-FQEVSTJZSA-N	0	3	336.435	3.400	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](C)c2cc(C)ccc2OC)CC1	ZINC000264377009	455200546	/nfs/dbraw/zinc/20/05/46/455200546.db2.gz	KEVHCMDNPWYLGP-INIZCTEOSA-N	0	3	345.487	3.404	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CNC[C@H]2COC3(CCC(C)CC3)O2)cc1	ZINC000181085128	455284780	/nfs/dbraw/zinc/28/47/80/455284780.db2.gz	UKBJLUOFJPPJMB-ZPDUDEBLSA-N	0	3	344.455	3.389	20	30		EGEDHN
COc1ccc(O)c(/C=N/C2CCN([C@@H](C)c3ccncc3)CC2)c1	ZINC000158273116	455287083	/nfs/dbraw/zinc/28/70/83/455287083.db2.gz	BBAYTARXVAFBGX-WXUSHSQQSA-N	0	3	339.439	3.440	20	30		EGEDHN
N#CC(C(=O)c1cnc(OCC2CC2)c(Cl)c1)c1ccccn1	ZINC000181484784	455341884	/nfs/dbraw/zinc/34/18/84/455341884.db2.gz	XQBLVJNEMXXRDL-CYBMUJFWSA-N	0	3	327.771	3.409	20	30		EGEDHN
N#CCN(C(=O)C1CCN(Cc2ccccc2)CC1)C1CCCC1	ZINC000265634864	455352815	/nfs/dbraw/zinc/35/28/15/455352815.db2.gz	RFFCXUJJTVUHMO-UHFFFAOYSA-N	0	3	325.456	3.193	20	30		EGEDHN
C[C@@H](C#N)CSc1ccccc1NC(=O)N(C)CCN(C)C1CC1	ZINC000184321730	455371202	/nfs/dbraw/zinc/37/12/02/455371202.db2.gz	HXXDDTGCRZNPFD-AWEZNQCLSA-N	0	3	346.500	3.496	20	30		EGEDHN
CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)NCCCCC#N	ZINC000184560056	455402336	/nfs/dbraw/zinc/40/23/36/455402336.db2.gz	LGCDIIUTNFBVSP-GOSISDBHSA-N	0	3	330.476	3.136	20	30		EGEDHN
COc1ccc(CN(C)C[C@@H]2CCCC[C@H]2O)cc1OCCCC#N	ZINC000246019540	455415044	/nfs/dbraw/zinc/41/50/44/455415044.db2.gz	UUKYQJOXUVYMNG-ZWKOTPCHSA-N	0	3	346.471	3.361	20	30		EGEDHN
CC(C)(C#N)CCCN(CCO)Cc1cnn(Cc2ccccc2)c1	ZINC000174856209	455417040	/nfs/dbraw/zinc/41/70/40/455417040.db2.gz	WWCIMDLGOCQTAT-UHFFFAOYSA-N	0	3	340.471	3.056	20	30		EGEDHN
C=CCOc1cccc(CN2CCC[C@@H](Cc3nccn3C)C2)c1	ZINC000182090310	455433327	/nfs/dbraw/zinc/43/33/27/455433327.db2.gz	MSNFQLKXJCUZHY-SFHVURJKSA-N	0	3	325.456	3.440	20	30		EGEDHN
CN(C)C[C@@H](NC(=O)c1cccc(SCC#N)c1)c1ccccc1	ZINC000175546206	455461292	/nfs/dbraw/zinc/46/12/92/455461292.db2.gz	NXLXPFBYSTVHMZ-GOSISDBHSA-N	0	3	339.464	3.335	20	30		EGEDHN
CC[C@@H](NCC(=O)N(CCC#N)c1cc(C)cc(C)c1)[C@H]1CCCO1	ZINC000182304284	455484045	/nfs/dbraw/zinc/48/40/45/455484045.db2.gz	CYXZBIUGKUNRIV-RTBURBONSA-N	0	3	343.471	3.097	20	30		EGEDHN
N#CCC[C@H](NC(=O)N1CCN(C2CCCC2)CC1)c1ccccc1	ZINC000160668478	455485786	/nfs/dbraw/zinc/48/57/86/455485786.db2.gz	RPZBEVOESKPIDQ-IBGZPJMESA-N	0	3	340.471	3.301	20	30		EGEDHN
C[C@@H](NCCC(=O)N(C)CCC#N)c1ccc(C(F)(F)F)cc1	ZINC000182462357	455517881	/nfs/dbraw/zinc/51/78/81/455517881.db2.gz	GFELEONVPRKEKK-GFCCVEGCSA-N	0	3	327.350	3.118	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H](CNC(=O)Cc1ccc(C#N)cc1)C1CC1	ZINC000185321314	455539138	/nfs/dbraw/zinc/53/91/38/455539138.db2.gz	XTJHMEAVHULEIR-NRFANRHFSA-N	0	3	347.462	3.128	20	30		EGEDHN
COc1ccc(CN[C@@H]2CCO[C@@H]2c2ccc(F)c(F)c2)cc1C#N	ZINC000182695829	455570124	/nfs/dbraw/zinc/57/01/24/455570124.db2.gz	RPFZZCBNDSHFFN-IEBWSBKVSA-N	0	3	344.361	3.465	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC[C@@H]1CN(Cc2ccccc2)CCCO1	ZINC000192214346	455574346	/nfs/dbraw/zinc/57/43/46/455574346.db2.gz	PJKRQKMSYLRUNY-HXUWFJFHSA-N	0	3	342.483	3.162	20	30		EGEDHN
CCN1CCN(c2ccc(CN[C@@H]3CCC[C@@H](C#N)C3)cc2F)CC1	ZINC000185817515	455627745	/nfs/dbraw/zinc/62/77/45/455627745.db2.gz	FIRRJMQXPVNOFG-SJLPKXTDSA-N	0	3	344.478	3.140	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@@H](C)Oc2cccc3ccccc32)CC1	ZINC000192532973	455638358	/nfs/dbraw/zinc/63/83/58/455638358.db2.gz	BYHXTVIOTBOVAK-MRXNPFEDSA-N	0	3	338.451	3.374	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2Cc3ccccc3O[C@@H](C)C2)CC1	ZINC000292399099	455651879	/nfs/dbraw/zinc/65/18/79/455651879.db2.gz	UVAMGXOPIJQOSN-INIZCTEOSA-N	0	3	343.471	3.020	20	30		EGEDHN
C[C@H](NCC(=O)N[C@@](C)(C#N)C1CC1)C1(c2ccccc2)CCCC1	ZINC000185953796	455660849	/nfs/dbraw/zinc/66/08/49/455660849.db2.gz	WJGAOMVXHBTHLP-JXFKEZNVSA-N	0	3	339.483	3.285	20	30		EGEDHN
C[C@H](NCC(=O)N[C@](C)(C#N)C1CC1)C1(c2ccccc2)CCCC1	ZINC000185953832	455660984	/nfs/dbraw/zinc/66/09/84/455660984.db2.gz	WJGAOMVXHBTHLP-OXJNMPFZSA-N	0	3	339.483	3.285	20	30		EGEDHN
CC[C@@H](CSC)N(C)[C@@H]1CCCN(c2ccc(C#N)cc2)C1=O	ZINC000192720657	455678162	/nfs/dbraw/zinc/67/81/62/455678162.db2.gz	KCCRNNCLYGQJGS-DOTOQJQBSA-N	0	3	331.485	3.127	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC000186159484	455706009	/nfs/dbraw/zinc/70/60/09/455706009.db2.gz	UVOUATFIVAZEIU-UHFFFAOYSA-N	0	3	344.462	3.446	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N1CCC(CC(=O)N2CCCC2)CC1	ZINC000186160485	455706572	/nfs/dbraw/zinc/70/65/72/455706572.db2.gz	RMVJVECKAKLNGY-INIZCTEOSA-N	0	3	325.456	3.344	20	30		EGEDHN
C[C@H](NC(=O)c1ccc(F)c(C#N)c1)[C@@H](c1ccccc1)N(C)C	ZINC000284595004	455711707	/nfs/dbraw/zinc/71/17/07/455711707.db2.gz	HDWHZVNRSCYSRD-UGSOOPFHSA-N	0	3	325.387	3.119	20	30		EGEDHN
C=CCC[C@@H](O)CN[C@H](C)c1ccc(OC)c(Br)c1	ZINC000271712838	455730645	/nfs/dbraw/zinc/73/06/45/455730645.db2.gz	VLXJNMMLNNZKQL-DGCLKSJQSA-N	0	3	328.250	3.435	20	30		EGEDHN
CC(C)(C#N)c1ccc(NC(=O)NC2CCN(C3CC3)CC2)cc1	ZINC000193052258	455738854	/nfs/dbraw/zinc/73/88/54/455738854.db2.gz	GNLDYZYOEHOQPX-UHFFFAOYSA-N	0	3	326.444	3.236	20	30		EGEDHN
N#C[C@H]1CCC[C@H](N[C@@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)C1	ZINC000193059984	455740933	/nfs/dbraw/zinc/74/09/33/455740933.db2.gz	XNTFRIFVHFPBKE-MQIPJXDCSA-N	0	3	335.810	3.256	20	30		EGEDHN
CC(C)C[C@H]1OCCC[C@@H]1NCC(=O)Nc1cc(Cl)ccc1C#N	ZINC000186323339	455743684	/nfs/dbraw/zinc/74/36/84/455743684.db2.gz	UPPQVLFVBMJQGK-DOTOQJQBSA-N	0	3	349.862	3.333	20	30		EGEDHN
CC1(C)CCCN(C(=O)C2CCN(Cc3ccccc3)CC2)[C@@H]1C#N	ZINC000278098491	455757219	/nfs/dbraw/zinc/75/72/19/455757219.db2.gz	ZEYOKJCRJYUSKM-LJQANCHMSA-N	0	3	339.483	3.439	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1cnn(C(C)(C)C)c1C)C(C)C	ZINC000193467509	455759698	/nfs/dbraw/zinc/75/96/98/455759698.db2.gz	JWMPCQJEEJARHF-SFHVURJKSA-N	0	3	346.519	3.375	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCc3cc(F)ccc3[C@@H]2C)CC1	ZINC000606511194	460689861	/nfs/dbraw/zinc/68/98/61/460689861.db2.gz	KWXSPDHNCWAFOL-AWEZNQCLSA-N	0	3	331.435	3.105	20	30		EGEDHN
C#CCN1CCC(C(=O)NC2(Cc3ccc(Cl)cc3)CCC2)CC1	ZINC000293732089	455795700	/nfs/dbraw/zinc/79/57/00/455795700.db2.gz	KQRZATPZMUAAQA-UHFFFAOYSA-N	0	3	344.886	3.267	20	30		EGEDHN
CN1CCC[C@]2(CCN(C(=O)c3ccc(C(C)(C)C#N)cc3)C2)C1	ZINC000293829960	455798615	/nfs/dbraw/zinc/79/86/15/455798615.db2.gz	BWANLAFNFQDBFT-FQEVSTJZSA-N	0	3	325.456	3.046	20	30		EGEDHN
CC[C@@H](NC[C@H](O)CN1CCc2ccccc2C1)c1ccc(C#N)cc1	ZINC000278281607	455804795	/nfs/dbraw/zinc/80/47/95/455804795.db2.gz	QCRMQZYSWMSVIX-FCHUYYIVSA-N	0	3	349.478	3.018	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN2CC[C@]3(C2)OCc2ccccc23)c1	ZINC000186617071	455805993	/nfs/dbraw/zinc/80/59/93/455805993.db2.gz	KBWGGMDGIOBARP-OAQYLSRUSA-N	0	3	347.418	3.018	20	30		EGEDHN
C[C@H](N[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccc(C#N)c(F)c1	ZINC000271966326	455806813	/nfs/dbraw/zinc/80/68/13/455806813.db2.gz	SPMSAKWGFYSNBI-WFASDCNBSA-N	0	3	333.407	3.357	20	30		EGEDHN
COc1cc(OC)cc([C@@H](O)CN[C@H](C)c2ccc(C#N)c(F)c2)c1	ZINC000271969354	455808102	/nfs/dbraw/zinc/80/81/02/455808102.db2.gz	UBRTYDUVFNOPLX-BLVKFPJESA-N	0	3	344.386	3.099	20	30		EGEDHN
CS(=O)(=O)CC1CCC(N[C@@H](CCC#N)c2ccccc2)CC1	ZINC000294836169	455830041	/nfs/dbraw/zinc/83/00/41/455830041.db2.gz	RLQOSCNJSOISDN-VJFUWPCTSA-N	0	3	334.485	3.224	20	30		EGEDHN
CO[C@H]1CCN(Cc2cn(C)nc2-c2ccc(C#N)cc2)CC1(C)C	ZINC000294925844	455832485	/nfs/dbraw/zinc/83/24/85/455832485.db2.gz	FWNQQOOPJXDGRX-SFHVURJKSA-N	0	3	338.455	3.206	20	30		EGEDHN
COC[C@@]1(C)CCN(Cc2ccc(OC)c(OCCCC#N)c2)C1	ZINC000295048599	455836703	/nfs/dbraw/zinc/83/67/03/455836703.db2.gz	FMWNDNPLMLKLOR-IBGZPJMESA-N	0	3	332.444	3.236	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1c2ccc(C)cc2[C@@H]2CN(C)CC[C@H]21	ZINC000253384790	455836805	/nfs/dbraw/zinc/83/68/05/455836805.db2.gz	QDZMAONZQTYNNO-HHXXYDBFSA-N	0	3	328.456	3.111	20	30		EGEDHN
CC1(C)[C@H](NCc2ccc(Br)cc2C#N)[C@H]2CCO[C@@H]21	ZINC000295094915	455838832	/nfs/dbraw/zinc/83/88/32/455838832.db2.gz	AKQMSVJUTCEBIF-KFWWJZLASA-N	0	3	335.245	3.224	20	30		EGEDHN
CCN1CCN(c2ccc(NC(=O)CC(C)(C)C#N)c(C)c2)CC1	ZINC000278580376	455841368	/nfs/dbraw/zinc/84/13/68/455841368.db2.gz	RSYNOONSTUEIRO-UHFFFAOYSA-N	0	3	328.460	3.015	20	30		EGEDHN
C[C@@H](CC#N)Sc1ccccc1NC(=O)CN[C@@H](CO)C(C)(C)C	ZINC000278578045	455842002	/nfs/dbraw/zinc/84/20/02/455842002.db2.gz	CLFNMNXMPCPUGD-BBRMVZONSA-N	0	3	349.500	3.016	20	30		EGEDHN
Cn1cc(CN[C@H]2CCC[C@H]2Oc2cc(F)cc(F)c2)cc1C#N	ZINC000285447920	455848020	/nfs/dbraw/zinc/84/80/20/455848020.db2.gz	IRVHDJNATXJOGR-ZWKOTPCHSA-N	0	3	331.366	3.265	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1C(=O)N[C@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000278918176	455853053	/nfs/dbraw/zinc/85/30/53/455853053.db2.gz	CRTNOXCTCKYZRH-GSEOLPGOSA-N	0	3	342.483	3.137	20	30		EGEDHN
CC(C)(C#N)CC(=O)N1CCCN(CCCc2ccccc2)CC1	ZINC000279290596	455862597	/nfs/dbraw/zinc/86/25/97/455862597.db2.gz	PGRGFKOZKYEHLR-UHFFFAOYSA-N	0	3	327.472	3.093	20	30		EGEDHN
COc1cccc([C@H](C)N[C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)c1	ZINC000272173824	455866180	/nfs/dbraw/zinc/86/61/80/455866180.db2.gz	GTAPILBMSZIKEL-MGPUTAFESA-N	0	3	349.434	3.413	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN1CCC[C@@H](c2ccncc2)C1	ZINC000296008031	455866610	/nfs/dbraw/zinc/86/66/10/455866610.db2.gz	QHPDMUSTEJERST-GOSISDBHSA-N	0	3	337.423	3.220	20	30		EGEDHN
C=CCSCCNC(=O)NC[C@@H](c1ccccc1)N1CCCC1	ZINC000194637199	455866962	/nfs/dbraw/zinc/86/69/62/455866962.db2.gz	HFDFOVUJFQDBRM-KRWDZBQOSA-N	0	3	333.501	3.042	20	30		EGEDHN
C[C@@H](CCc1ccccc1)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000279504469	455867144	/nfs/dbraw/zinc/86/71/44/455867144.db2.gz	QTKZUUNZNAWMIJ-JXFKEZNVSA-N	0	3	331.419	3.378	20	30		EGEDHN
CC[C@@H]1CN(Cc2cn(CCC#N)nc2-c2ccncc2)CCS1	ZINC000279500275	455867282	/nfs/dbraw/zinc/86/72/82/455867282.db2.gz	ZFPVTVSEPYTZGP-QGZVFWFLSA-N	0	3	341.484	3.186	20	30		EGEDHN
C=CCN1CCC(NC(=O)/C=C\c2ccccc2Br)CC1	ZINC000255864027	455874217	/nfs/dbraw/zinc/87/42/17/455874217.db2.gz	RMPAVRSVIABPFR-FPLPWBNLSA-N	0	3	349.272	3.229	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1c(C)cccc1[N+](=O)[O-])C(C)C	ZINC000194703350	455874466	/nfs/dbraw/zinc/87/44/66/455874466.db2.gz	DODGPNHYZPVMLN-QGZVFWFLSA-N	0	3	345.443	3.332	20	30		EGEDHN
C=CCN(CCc1ccco1)C[C@H](O)COc1cccc2[nH]ccc21	ZINC000272239062	455888266	/nfs/dbraw/zinc/88/82/66/455888266.db2.gz	GDOLIFOZJOKDLH-INIZCTEOSA-N	0	3	340.423	3.231	20	30		EGEDHN
COc1cc(C#N)ccc1CN(C)CCCN(C)Cc1ccco1	ZINC000285680954	455895211	/nfs/dbraw/zinc/89/52/11/455895211.db2.gz	NWTRJNYWIZBGMH-UHFFFAOYSA-N	0	3	327.428	3.114	20	30		EGEDHN
CCOC[C@@H](N[C@@H](C)C(=O)N(CCC#N)c1ccc(C)cc1)C(C)C	ZINC000285703642	455900529	/nfs/dbraw/zinc/90/05/29/455900529.db2.gz	CVQDZCPOEACMHE-PKOBYXMFSA-N	0	3	345.487	3.281	20	30		EGEDHN
CCc1ccc(CCNC(=O)C(C#N)Cc2ccc(C#N)cc2)cc1	ZINC000280275346	455933248	/nfs/dbraw/zinc/93/32/48/455933248.db2.gz	DFTVFXHPUJJUKR-FQEVSTJZSA-N	0	3	331.419	3.162	20	30		EGEDHN
C=C(C)[C@H](NC[C@H](O)COCc1ccco1)c1ccc(F)c(F)c1	ZINC000187786036	455952007	/nfs/dbraw/zinc/95/20/07/455952007.db2.gz	QWBHUIQLBSZREC-KSSFIOAISA-N	0	3	337.366	3.342	20	30		EGEDHN
CN(C)Cc1ccc(C(=O)N(Cc2ccc(C#N)cc2)C2CC2)cc1	ZINC000195471675	455965655	/nfs/dbraw/zinc/96/56/55/455965655.db2.gz	TXACRFIIHDFWSF-UHFFFAOYSA-N	0	3	333.435	3.425	20	30		EGEDHN
CN(C(=O)[C@H]1CCN(Cc2ccc(OCC#N)cc2)C1)c1ccccc1	ZINC000280497892	455984553	/nfs/dbraw/zinc/98/45/53/455984553.db2.gz	BBISPYCXWNFALA-SFHVURJKSA-N	0	3	349.434	3.074	20	30		EGEDHN
CN1CCC[C@@]2(CCN(C(=O)Nc3cc(C#N)cn3C(C)(C)C)C2)C1	ZINC000296620258	455991183	/nfs/dbraw/zinc/99/11/83/455991183.db2.gz	QCGLZIDZHDZXOU-LJQANCHMSA-N	0	3	343.475	3.064	20	30		EGEDHN
C=CCC[C@H](NCCNC(=O)c1cccc(OC)c1)c1ccco1	ZINC000286277345	456014452	/nfs/dbraw/zinc/01/44/52/456014452.db2.gz	VOKJUFOAYKVXDT-KRWDZBQOSA-N	0	3	328.412	3.315	20	30		EGEDHN
C#CCOc1ccc(F)cc1NC(=O)N(C)[C@H](C)C1CCN(C)CC1	ZINC000272619927	456016613	/nfs/dbraw/zinc/01/66/13/456016613.db2.gz	ULEAACHWOKXVTA-CQSZACIVSA-N	0	3	347.434	3.032	20	30		EGEDHN
C=CCSCCNCc1cc2c(c(Br)c1)OCO2	ZINC000222064458	456045039	/nfs/dbraw/zinc/04/50/39/456045039.db2.gz	RVEZULMOIIYCGQ-UHFFFAOYSA-N	0	3	330.247	3.187	20	30		EGEDHN
CC(C)(C#N)c1ccccc1CN1CC[C@H](C(F)(F)F)[C@@H](CO)C1	ZINC000286549134	456049175	/nfs/dbraw/zinc/04/91/75/456049175.db2.gz	ONPJYQWQPDZRLW-ZBFHGGJFSA-N	0	3	340.389	3.480	20	30		EGEDHN
CC(C)C[C@@H](CN1CCCC1)NC(=O)N(C)Cc1ccc(C#N)cc1	ZINC000296950961	456072994	/nfs/dbraw/zinc/07/29/94/456072994.db2.gz	RCTDNELTBNVYEU-IBGZPJMESA-N	0	3	342.487	3.210	20	30		EGEDHN
CN(C(=O)[C@@H]1CCN(Cc2ccc(C#N)s2)C1)c1ccccc1	ZINC000280902042	456077929	/nfs/dbraw/zinc/07/79/29/456077929.db2.gz	FLSXDLGUMHDSJK-CQSZACIVSA-N	0	3	325.437	3.105	20	30		EGEDHN
C=CCS(=O)(=O)CCN[C@@H](C)CCc1cccc(C(F)(F)F)c1	ZINC000272926709	456115492	/nfs/dbraw/zinc/11/54/92/456115492.db2.gz	YWPPWWDIWWIABL-ZDUSSCGKSA-N	0	3	349.418	3.217	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CN[C@H](c1nc[nH]n1)c1ccccc1)C(C)C	ZINC000289199308	456117670	/nfs/dbraw/zinc/11/76/70/456117670.db2.gz	JOXOHBHUKZMXOM-OALUTQOASA-N	0	3	339.487	3.182	20	30		EGEDHN
C=CCn1c(C2CC2)nnc1N1CCCN(Cc2ccccc2)CC1	ZINC000289585353	456131549	/nfs/dbraw/zinc/13/15/49/456131549.db2.gz	HSDMZWGKKDTXBY-UHFFFAOYSA-N	0	3	337.471	3.054	20	30		EGEDHN
C=C[C@@H](CO)N[C@@H]1CCCc2nc(-c3ccc(OC)cc3)sc21	ZINC000289781135	456142310	/nfs/dbraw/zinc/14/23/10/456142310.db2.gz	MSPULYVXFDRCTC-DZGCQCFKSA-N	0	3	330.453	3.333	20	30		EGEDHN
CC1CCC(N2CCN(C(=O)NCC3CCC(C#N)CC3)CC2)CC1	ZINC000333074578	456156949	/nfs/dbraw/zinc/15/69/49/456156949.db2.gz	PHQUTTLHGJPPIO-UHFFFAOYSA-N	0	3	346.519	3.222	20	30		EGEDHN
CCc1nnc(NC[C@H](c2cccs2)N(C)C)c(C#N)c1CC	ZINC000301608988	456161231	/nfs/dbraw/zinc/16/12/31/456161231.db2.gz	ANSRWVMSCUMRHU-OAHLLOKOSA-N	0	3	329.473	3.249	20	30		EGEDHN
CCN1CCN([C@H](C)CNc2ccc(C(F)(F)F)cc2C#N)CC1	ZINC000301630189	456167655	/nfs/dbraw/zinc/16/76/55/456167655.db2.gz	SMUMOTZRRXGLOK-CYBMUJFWSA-N	0	3	340.393	3.015	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cc(C)n(C3CCCCC3)n2)CC1	ZINC000289940656	456189244	/nfs/dbraw/zinc/18/92/44/456189244.db2.gz	VQJWDWBMJKQDAU-UHFFFAOYSA-N	0	3	345.491	3.469	20	30		EGEDHN
C=CCOc1cccc(CNCCN2CCc3ccccc3C2=O)c1	ZINC000189054488	456213877	/nfs/dbraw/zinc/21/38/77/456213877.db2.gz	MFQKJDJBAZHJFF-UHFFFAOYSA-N	0	3	336.435	3.040	20	30		EGEDHN
CC1CCN([C@@H](CNc2nccnc2C#N)c2cccs2)CC1	ZINC000263809907	456230700	/nfs/dbraw/zinc/23/07/00/456230700.db2.gz	MZLOKTKDILCYIR-HNNXBMFYSA-N	0	3	327.457	3.295	20	30		EGEDHN
C=CC[C@H](CO)NCc1ccc(OCC(F)(F)F)c(OCC)c1	ZINC000273537339	456237905	/nfs/dbraw/zinc/23/79/05/456237905.db2.gz	WMKJVWQFQXPUNU-CYBMUJFWSA-N	0	3	333.350	3.053	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CCC([C@@H]2CCCO2)CC1	ZINC000189151583	456241977	/nfs/dbraw/zinc/24/19/77/456241977.db2.gz	KLWJYEMMQINQQK-UXHICEINSA-N	0	3	345.483	3.046	20	30		EGEDHN
COc1cc(CN[C@H](C)c2cccc(C#N)c2)cc(OC)c1OC	ZINC000237224364	456249679	/nfs/dbraw/zinc/24/96/79/456249679.db2.gz	ZKZZDBFRIRXJGB-CYBMUJFWSA-N	0	3	326.396	3.435	20	30		EGEDHN
C=C(C)[C@@H](NC(=O)NCC1=CCN(C)CC1)c1ccc(F)c(F)c1	ZINC000274852869	456266318	/nfs/dbraw/zinc/26/63/18/456266318.db2.gz	BHKXAOIERNVWAD-QGZVFWFLSA-N	0	3	335.398	3.143	20	30		EGEDHN
C#C[C@H](N[C@H](C)CC(=O)Nc1ccc(OC)cc1OC)C(C)(C)C	ZINC000290244657	456274038	/nfs/dbraw/zinc/27/40/38/456274038.db2.gz	VBYZPSKSEQYFBR-DYVFJYSZSA-N	0	3	332.444	3.058	20	30		EGEDHN
C#CCCCCNC(=O)NC[C@H](c1ccc(SC)cc1)N(C)C	ZINC000297743650	456284898	/nfs/dbraw/zinc/28/48/98/456284898.db2.gz	BUGXSIQDWZZXEO-QGZVFWFLSA-N	0	3	333.501	3.114	20	30		EGEDHN
CN(C)[C@@H](CNc1cc(C#N)ccc1[N+](=O)[O-])c1cccc(F)c1	ZINC000302199662	456315620	/nfs/dbraw/zinc/31/56/20/456315620.db2.gz	GSRLGPFOEOGXQC-KRWDZBQOSA-N	0	3	328.347	3.320	20	30		EGEDHN
CN(C)[C@@H](CNc1ccc(C#N)nn1)c1cccc(C(F)(F)F)c1	ZINC000302216780	456320824	/nfs/dbraw/zinc/32/08/24/456320824.db2.gz	IZIOBMMTDVUUFV-AWEZNQCLSA-N	0	3	335.333	3.082	20	30		EGEDHN
C[C@@H]1CC[C@H](C)N1CC(=O)N1CCC[C@@H]1[C@@H](C#N)c1ccccc1	ZINC000347751343	456348991	/nfs/dbraw/zinc/34/89/91/456348991.db2.gz	FJPDAHSNTTVURB-OGWHTMIXSA-N	0	3	325.456	3.158	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)NC[C@@H](C)N1CCC(C)CC1	ZINC000303510624	456464558	/nfs/dbraw/zinc/46/45/58/456464558.db2.gz	WVWDWOWVDFLJKV-QGZVFWFLSA-N	0	3	345.487	3.171	20	30		EGEDHN
COc1ccc(CNC[C@@](C)(OC)C2CC2)cc1OCCCC#N	ZINC000291029069	456501886	/nfs/dbraw/zinc/50/18/86/456501886.db2.gz	IKISCFMUFHGJQW-LJQANCHMSA-N	0	3	332.444	3.282	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)s1)c1ccc(N2CCCNC2=O)cc1	ZINC000291068492	456517959	/nfs/dbraw/zinc/51/79/59/456517959.db2.gz	LGQKKVQIRPTLSD-ZDUSSCGKSA-N	0	3	340.452	3.390	20	30		EGEDHN
N#Cc1cccc(C(=O)NCCN2CCC3(CCCCC3)CC2)c1	ZINC000337761873	456529819	/nfs/dbraw/zinc/52/98/19/456529819.db2.gz	ZYENCMYICRVAJW-UHFFFAOYSA-N	0	3	325.456	3.334	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)C[C@@H](O)COCc1cccs1	ZINC000298777361	456537464	/nfs/dbraw/zinc/53/74/64/456537464.db2.gz	JPFZFQSNHMKJDO-QGZVFWFLSA-N	0	3	347.480	3.322	20	30		EGEDHN
C[C@H](NCc1cc(C#N)n(C)c1)[C@H](O)c1c(Cl)cccc1Cl	ZINC000276676532	456549587	/nfs/dbraw/zinc/54/95/87/456549587.db2.gz	ZRVGYZIDEXPNBR-QFYYESIMSA-N	0	3	338.238	3.415	20	30		EGEDHN
C#CC[C@@H](NCCC(=O)Nc1ccc2c(c1)OCO2)c1ccccc1	ZINC000298927269	456571540	/nfs/dbraw/zinc/57/15/40/456571540.db2.gz	NTBCOIWATPTPMW-QGZVFWFLSA-N	0	3	336.391	3.098	20	30		EGEDHN
C=CCn1c(C)nnc1N1CCN(Cc2ccccc2)[C@H](CCC)C1	ZINC000337851192	456571513	/nfs/dbraw/zinc/57/15/13/456571513.db2.gz	JKNAZIQUCKHQIV-LJQANCHMSA-N	0	3	339.487	3.263	20	30		EGEDHN
CCc1nc(C#N)cc(N[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)n1	ZINC000308170302	456572199	/nfs/dbraw/zinc/57/21/99/456572199.db2.gz	QEUJBZVRTUBYQO-NVXWUHKLSA-N	0	3	335.455	3.376	20	30		EGEDHN
CCN1CCO[C@H](CNCc2cc(C#N)cs2)[C@H]1c1ccccc1	ZINC000343389995	456584215	/nfs/dbraw/zinc/58/42/15/456584215.db2.gz	CMXMSUMLKHEJAP-RTBURBONSA-N	0	3	341.480	3.171	20	30		EGEDHN
Cc1ccc(C[C@@H](C)NC(=O)C(C#N)Cc2ccc(C#N)cc2)s1	ZINC000348281198	456595342	/nfs/dbraw/zinc/59/53/42/456595342.db2.gz	KERUYEDRFJFWIH-DYVFJYSZSA-N	0	3	337.448	3.358	20	30		EGEDHN
N#CC1(NC(=O)C2CCN(Cc3ccccc3)CC2)CCCCC1	ZINC000299136588	456615394	/nfs/dbraw/zinc/61/53/94/456615394.db2.gz	GXRWIDQOEANFLR-UHFFFAOYSA-N	0	3	325.456	3.241	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C(=O)[C@@H]1CCCN1Cc1ccccc1	ZINC000299149236	456620155	/nfs/dbraw/zinc/62/01/55/456620155.db2.gz	LOVPXVAWWNGXNZ-FQEVSTJZSA-N	0	3	333.435	3.181	20	30		EGEDHN
C[C@@H](NCCC(=O)N1CCOc2ccccc21)c1ccc(C#N)cc1	ZINC000348320248	456620402	/nfs/dbraw/zinc/62/04/02/456620402.db2.gz	NVJNHQUGMKBGGO-OAHLLOKOSA-N	0	3	335.407	3.025	20	30		EGEDHN
C[C@@H](CNC(=O)OC(C)(C)C)NCc1ccc(N(C)CCC#N)cc1	ZINC000276938994	456625422	/nfs/dbraw/zinc/62/54/22/456625422.db2.gz	NINGTSQOCHABLC-HNNXBMFYSA-N	0	3	346.475	3.039	20	30		EGEDHN
CCC(C#N)(CC)C(=O)N1CCN(Cc2ccccc2)C[C@H](C)C1	ZINC000324125348	456661652	/nfs/dbraw/zinc/66/16/52/456661652.db2.gz	JCPURAJWKNGABI-KRWDZBQOSA-N	0	3	327.472	3.297	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc3c(C)nn(C)c3c2)CC1	ZINC000291658489	456711565	/nfs/dbraw/zinc/71/15/65/456711565.db2.gz	FMAKQHUMILBZSV-UHFFFAOYSA-N	0	3	341.459	3.044	20	30		EGEDHN
CC(C)(C)CN(CCC#N)C[C@H]1CCN(C(=O)c2ccccc2)C1	ZINC000283137205	456720251	/nfs/dbraw/zinc/72/02/51/456720251.db2.gz	NSXQNRSUVHYJBC-QGZVFWFLSA-N	0	3	327.472	3.410	20	30		EGEDHN
COc1ccc(CN[C@H]2CCN(c3ccccc3F)C2)cc1C#N	ZINC000291722760	456734983	/nfs/dbraw/zinc/73/49/83/456734983.db2.gz	MUPRNULMGZVSIK-INIZCTEOSA-N	0	3	325.387	3.074	20	30		EGEDHN
Cc1ccc(NC(=O)[C@H](C)N2CCC[C@@H]2[C@@H]2COCC[C@@H]2O)c(C)c1	ZINC000328694246	456738673	/nfs/dbraw/zinc/73/86/73/456738673.db2.gz	CVWDTDMZSONNBZ-DKKFBQAASA-N	0	3	346.471	3.142	20	30		EGEDHN
C[C@H](N[C@H]1CCC(=O)NC12CCC2)C(=O)NC1(C#N)CCCCC1	ZINC000328720126	456743758	/nfs/dbraw/zinc/74/37/58/456743758.db2.gz	VXSFXOUZLSEUTF-KBPBESRZSA-N	0	3	332.448	3.189	20	30		EGEDHN
C[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1NCc1ccccc1C#N	ZINC000277251969	456745744	/nfs/dbraw/zinc/74/57/44/456745744.db2.gz	AEOHEJRQBVRWAK-RHSMWYFYSA-N	0	3	329.444	3.293	20	30		EGEDHN
CCN1CCC[C@@H]1CNC(=O)[C@H]1CCN(c2ccc(Cl)cc2)C1=O	ZINC000328978176	456805950	/nfs/dbraw/zinc/80/59/50/456805950.db2.gz	CGMSTKZILOWGBR-HZPDHXFCSA-N	0	3	349.862	3.134	20	30		EGEDHN
CN(c1ccccc1CN1CCC(F)(C#N)CC1)C1CCN(C)CC1	ZINC000348709716	456824693	/nfs/dbraw/zinc/82/46/93/456824693.db2.gz	NCWBCDIEFRFZEM-UHFFFAOYSA-N	0	3	344.478	3.045	20	30		EGEDHN
C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@H]1CCN(C)[C@@H](C)C1	ZINC000353643837	456825128	/nfs/dbraw/zinc/82/51/28/456825128.db2.gz	PUFQETOFYAPXOS-WMZOPIPTSA-N	0	3	347.507	3.034	20	30		EGEDHN
CC(C)[C@@H]1N(C[C@@H](O)COc2ccc(CC#N)cc2)CC12CCC2	ZINC000292003244	456827256	/nfs/dbraw/zinc/82/72/56/456827256.db2.gz	XTJYICVRCNQNEV-MJGOQNOKSA-N	0	3	328.456	3.003	20	30		EGEDHN
C[C@@H](c1ccccc1)[C@@H](NCc1ccccc1C(C)(C)C#N)C(N)=O	ZINC000292075809	456847794	/nfs/dbraw/zinc/84/77/94/456847794.db2.gz	DBPVJYBSOUUVHJ-HNAYVOBHSA-N	0	3	335.451	3.235	20	30		EGEDHN
C[C@@H](N[C@@H]1CCCN(C(=O)N2CCCC2)C1)c1ccc(C#N)c(F)c1	ZINC000329178307	456848872	/nfs/dbraw/zinc/84/88/72/456848872.db2.gz	NCDHAGMTAWXSGT-RHSMWYFYSA-N	0	3	344.434	3.028	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2cnc3c(F)ccc(F)c3c2)nc(C)n1	ZINC000344727763	456852380	/nfs/dbraw/zinc/85/23/80/456852380.db2.gz	MBHOBGXLDRMXJB-CYBMUJFWSA-N	0	3	338.317	3.410	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cccc([N+](=O)[O-])c1)C(C)C	ZINC000344789878	456859116	/nfs/dbraw/zinc/85/91/16/456859116.db2.gz	PPUGODXGSSLWNY-QGZVFWFLSA-N	0	3	331.416	3.023	20	30		EGEDHN
C=CCOCCN1CCCN(Cc2ccc(C(F)(F)F)cc2)CC1	ZINC000338896693	456867126	/nfs/dbraw/zinc/86/71/26/456867126.db2.gz	ABCHBALCPNDWGW-UHFFFAOYSA-N	0	3	342.405	3.416	20	30		EGEDHN
COc1cc(OC)cc(OCCCNCc2ccc(C#N)cc2F)c1	ZINC000344978341	456885461	/nfs/dbraw/zinc/88/54/61/456885461.db2.gz	UDYOZWKQRPQREY-UHFFFAOYSA-N	0	3	344.386	3.273	20	30		EGEDHN
CC1(C)CN(C2(CNC(=O)CCc3ncc[nH]3)CCCCC2)CCO1	ZINC000329542832	456906114	/nfs/dbraw/zinc/90/61/14/456906114.db2.gz	NUIFNKORQGOIBO-UHFFFAOYSA-N	0	3	348.491	3.113	20	30		EGEDHN
C[C@@H]1CN(C2CC2)C[C@@H]1NC(=O)c1cnc(OCC2CC2)c(Cl)c1	ZINC000329564051	456910032	/nfs/dbraw/zinc/91/00/32/456910032.db2.gz	NRWAZHGSVVDCOM-BZNIZROVSA-N	0	3	349.862	3.311	20	30		EGEDHN
[O-]C(NC[C@@H]1CCc2nccn2C1)=[NH+][C@H]1CCCCC12CCCC2	ZINC000329606896	456914539	/nfs/dbraw/zinc/91/45/39/456914539.db2.gz	IEZCLQFQPPQQCR-HOTGVXAUSA-N	0	3	330.476	3.452	20	30		EGEDHN
C=CCOc1ccc(CN[C@H](C)c2ccc(-n3cnnn3)cc2)cc1	ZINC000353859186	456939000	/nfs/dbraw/zinc/93/90/00/456939000.db2.gz	VVHXHFRMLOMOPP-OAHLLOKOSA-N	0	3	335.411	3.078	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cnc(C(F)(F)F)cc2C)CC1	ZINC000353861458	456939673	/nfs/dbraw/zinc/93/96/73/456939673.db2.gz	POIQTRYMRLZATO-UHFFFAOYSA-N	0	3	342.365	3.181	20	30		EGEDHN
O=C(NCc1nnc(C2CC2)n1C1CC1)[C@H]1CCCN1C1CCCC1	ZINC000329824161	456946981	/nfs/dbraw/zinc/94/69/81/456946981.db2.gz	BJBZXUDHOYOBDZ-MRXNPFEDSA-N	0	3	343.475	3.354	20	30		EGEDHN
C[C@@H]1CCC[C@](CNC(=O)[C@@H]2CCC(=O)c3cccn32)(N(C)C)C1	ZINC000329859552	456952243	/nfs/dbraw/zinc/95/22/43/456952243.db2.gz	OWLALKTWHFFLEU-ALKREAHSSA-N	0	3	331.460	3.473	20	30		EGEDHN
C[C@@H]1CCN(Cc2cccc(OCc3cccc(C#N)c3)c2)C[C@@H]1O	ZINC000349420755	456966223	/nfs/dbraw/zinc/96/62/23/456966223.db2.gz	RNPMEFBRMJCCHG-IERDGZPVSA-N	0	3	336.435	3.340	20	30		EGEDHN
C[C@@H](NCc1ccc(F)cc1C#N)C1CCN(CC(F)(F)F)CC1	ZINC000339155016	456967441	/nfs/dbraw/zinc/96/74/41/456967441.db2.gz	BADCRSLUHCTBLC-GFCCVEGCSA-N	0	3	343.368	3.450	20	30		EGEDHN
COc1ccc(CC[C@H]2CCCCN2C(=O)C(C)C#N)cc1OC	ZINC000345224203	456971851	/nfs/dbraw/zinc/97/18/51/456971851.db2.gz	CHKNTRYOIDWMDM-GOEBONIOSA-N	0	3	330.428	3.177	20	30		EGEDHN
CC(C)[C@@H]1CCCC[C@@H]1NC(=O)C(C)S(=O)(=O)C1CCOCC1	ZINC000330046270	456978518	/nfs/dbraw/zinc/97/85/18/456978518.db2.gz	IPBWPQKMKKFVCF-KBMXLJTQSA-N	0	3	345.505	3.140	20	30		EGEDHN
CN(CCC(C)(C)C#N)C[C@H](O)COc1ccc(C(F)(F)F)cc1	ZINC000345718011	456988997	/nfs/dbraw/zinc/98/89/97/456988997.db2.gz	VQAHAAPXXFWUHY-AWEZNQCLSA-N	0	3	344.377	3.317	20	30		EGEDHN
CCCN(C)[C@@H](CNC(=O)c1ccc(C#N)[nH]1)c1ccc(Cl)cc1	ZINC000358842961	456999362	/nfs/dbraw/zinc/99/93/62/456999362.db2.gz	PONCYQPFVAGXBY-KRWDZBQOSA-N	0	3	344.846	3.353	20	30		EGEDHN
CCCN(CCN(C)C)C(=O)c1cn(CCCC#N)c2ccccc12	ZINC000345847095	457001407	/nfs/dbraw/zinc/00/14/07/457001407.db2.gz	APXYOXGBVIOONR-UHFFFAOYSA-N	0	3	340.471	3.359	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@@H](C)N2CCC[C@@H](C)C2)cc1OC	ZINC000345845035	457001431	/nfs/dbraw/zinc/00/14/31/457001431.db2.gz	YGBSIKZHVPWVHN-HZPDHXFCSA-N	0	3	346.471	3.110	20	30		EGEDHN
C=CCC[C@@H](NCC(=O)NCC(=O)c1cccs1)c1ccccc1	ZINC000341930413	457009410	/nfs/dbraw/zinc/00/94/10/457009410.db2.gz	MKCJVTIXIISPKK-MRXNPFEDSA-N	0	3	342.464	3.344	20	30		EGEDHN
Cn1cncc1[C@@H]1C[C@H](NC(=O)[C@@H]2CCCN2C2CCCC2)CCO1	ZINC000330330791	457028998	/nfs/dbraw/zinc/02/89/98/457028998.db2.gz	NOQQXEDYODQGSV-HFTRVMKXSA-N	0	3	346.475	3.004	20	30		EGEDHN
Cc1nc(C(C#N)C(=O)Nc2ccc(-c3ncon3)cc2)sc1C	ZINC000346319920	457033145	/nfs/dbraw/zinc/03/31/45/457033145.db2.gz	PSMRUXPHDLNTER-CYBMUJFWSA-N	0	3	339.380	3.056	20	30		EGEDHN
N#CC(C(=O)c1cccc(C(=O)Nc2ccccc2)c1)c1ccncn1	ZINC000354053928	457034269	/nfs/dbraw/zinc/03/42/69/457034269.db2.gz	PYTHSAYMPNZQAD-KRWDZBQOSA-N	0	3	342.358	3.219	20	30		EGEDHN
COc1cc(CN[C@H]2CC[C@H](C#N)C2)cc(Br)c1OC	ZINC000349803973	457058771	/nfs/dbraw/zinc/05/87/71/457058771.db2.gz	RYSCWGDRBXRMJM-JQWIXIFHSA-N	0	3	339.233	3.248	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1)OCC	ZINC000339437918	457118204	/nfs/dbraw/zinc/11/82/04/457118204.db2.gz	HWDLXLUGIPMQMJ-WDSOQIARSA-N	0	3	330.472	3.137	20	30		EGEDHN
Cc1nsc(NCC2(N3CCSCC3)CCCCC2)c1C#N	ZINC000342146806	457135396	/nfs/dbraw/zinc/13/53/96/457135396.db2.gz	BWXYAOHQOSUTEQ-UHFFFAOYSA-N	0	3	336.530	3.487	20	30		EGEDHN
CC(C)Cn1cc(NC(=O)N2CCN(CCC(C)(C)C)CC2)cn1	ZINC000331235243	457151094	/nfs/dbraw/zinc/15/10/94/457151094.db2.gz	GTKJOHGSDYPJQW-UHFFFAOYSA-N	0	3	335.496	3.138	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C(=O)NC[C@H]1N(C)CCCC1(C)C	ZINC000331306542	457164698	/nfs/dbraw/zinc/16/46/98/457164698.db2.gz	FBGDSCANLWGPDB-QGZVFWFLSA-N	0	3	328.460	3.024	20	30		EGEDHN
CCCN(CCN1CCCC1)C(=O)C[C@@H](CC#N)c1ccccc1	ZINC000342276363	457205462	/nfs/dbraw/zinc/20/54/62/457205462.db2.gz	CJFJGOPJFRBADE-LJQANCHMSA-N	0	3	327.472	3.408	20	30		EGEDHN
CC1(C)CN(CC(=O)N(CCC#N)c2ccccc2)[C@@H]2CCC[C@@H]21	ZINC000339715265	457230080	/nfs/dbraw/zinc/23/00/80/457230080.db2.gz	FXPJDVXGKIWYRN-ZWKOTPCHSA-N	0	3	325.456	3.444	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1CCCC[C@@H]1Cc1ccccc1	ZINC000339724621	457233273	/nfs/dbraw/zinc/23/32/73/457233273.db2.gz	ANRDXBLGHCJWQD-IEBWSBKVSA-N	0	3	327.472	3.092	20	30		EGEDHN
COc1cc(C(=O)C(C#N)c2ccncn2)cc(OC)c1C(C)C	ZINC000354459555	457236642	/nfs/dbraw/zinc/23/66/42/457236642.db2.gz	DZNDHLKMGYOMPJ-CYBMUJFWSA-N	0	3	325.368	3.107	20	30		EGEDHN
CCOc1c(Cl)cc(C(=O)C(C#N)c2ccncn2)cc1OC	ZINC000354458528	457237026	/nfs/dbraw/zinc/23/70/26/457237026.db2.gz	BOULOBFYBLEIQM-LLVKDONJSA-N	0	3	331.759	3.027	20	30		EGEDHN
CC(C)n1cc(Br)cc1C(=O)C(C#N)c1ccncn1	ZINC000354466908	457241776	/nfs/dbraw/zinc/24/17/76/457241776.db2.gz	NKKRQPSBYJNMFZ-NSHDSACASA-N	0	3	333.189	3.112	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H]1CN1CCCCC1)c1cccc(C#N)c1	ZINC000360157731	457280455	/nfs/dbraw/zinc/28/04/55/457280455.db2.gz	VXBJTRAHJQUULI-LPHOPBHVSA-N	0	3	325.456	3.139	20	30		EGEDHN
C[C@H](O)C[C@H]1CCCCCN1C(=O)C(C#N)CCc1ccccc1	ZINC000331995134	457285990	/nfs/dbraw/zinc/28/59/90/457285990.db2.gz	NDCAWCHOOQTHRU-QXAKKESOSA-N	0	3	328.456	3.301	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN2CC[C@H](C)[C@@H]2CC)cc1	ZINC000360477745	457314062	/nfs/dbraw/zinc/31/40/62/457314062.db2.gz	LOMZJOYWGJFZIK-LPHOPBHVSA-N	0	3	343.471	3.452	20	30		EGEDHN
CN(CCC#N)C(=O)CCN(Cc1ccccc1Cl)CC1CC1	ZINC000352242178	457351189	/nfs/dbraw/zinc/35/11/89/457351189.db2.gz	PDSMIPGIZZBTAM-UHFFFAOYSA-N	0	3	333.863	3.314	20	30		EGEDHN
Cc1cc(C(=O)C(C#N)c2cc(C)nc(C)n2)c2cnn(C(C)C)c2n1	ZINC000347347573	457366803	/nfs/dbraw/zinc/36/68/03/457366803.db2.gz	UNZVNXSCBIHPAU-OAHLLOKOSA-N	0	3	348.410	3.218	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC(CN3C[C@@H](C)O[C@@H](C)C3)CC2)CC1	ZINC000355554852	457389203	/nfs/dbraw/zinc/38/92/03/457389203.db2.gz	XRUNLIUYGRJXBV-CALCHBBNSA-N	0	3	334.504	3.081	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN2CC[C@](O)(c3ccc(F)cc3)C2)cc1	ZINC000378520383	457407117	/nfs/dbraw/zinc/40/71/17/457407117.db2.gz	NBDJGBUFLALQGX-MGPUTAFESA-N	0	3	340.398	3.210	20	30		EGEDHN
COC(=O)COc1ccc([C@H](C)NCc2ccc(CC#N)cc2)cc1	ZINC000342629178	457415524	/nfs/dbraw/zinc/41/55/24/457415524.db2.gz	DLUTXGQIKLMDOC-HNNXBMFYSA-N	0	3	338.407	3.155	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2CCN(C3CCCCC3)CC2)cc1	ZINC000360907678	457426092	/nfs/dbraw/zinc/42/60/92/457426092.db2.gz	AZDLMYPREOKVDZ-UHFFFAOYSA-N	0	3	328.456	3.342	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000363859820	457455773	/nfs/dbraw/zinc/45/57/73/457455773.db2.gz	WLDATYKVMOANFP-FPOVZHCZSA-N	0	3	344.499	3.244	20	30		EGEDHN
C#CCCCNC(=O)N1CC[C@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000370055281	457519530	/nfs/dbraw/zinc/51/95/30/457519530.db2.gz	HYCAUVJADXQCCI-OAQYLSRUSA-N	0	3	339.483	3.098	20	30		EGEDHN
N#Cc1ccc(N2CC[C@]3(C2)CCCN(Cc2ccccc2)C3)nc1	ZINC000374198103	457520158	/nfs/dbraw/zinc/52/01/58/457520158.db2.gz	HCWPVGDFVMYQAZ-OAQYLSRUSA-N	0	3	332.451	3.446	20	30		EGEDHN
C=CCOc1cccnc1C(=O)N[C@H](C)[C@@H](c1ccccc1)N(C)C	ZINC000356260238	457553960	/nfs/dbraw/zinc/55/39/60/457553960.db2.gz	VAMZLBSDRFZHHX-BEFAXECRSA-N	0	3	339.439	3.068	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N(C)CCC(=O)Nc1ccccc1C#N	ZINC000425532260	457587210	/nfs/dbraw/zinc/58/72/10/457587210.db2.gz	IWRQKCQSSYKQLC-HNNXBMFYSA-N	0	3	332.407	3.452	20	30		EGEDHN
N#Cc1csc(CN2CCC[C@](CO)(Cc3ccccc3)C2)c1	ZINC000361250287	457666932	/nfs/dbraw/zinc/66/69/32/457666932.db2.gz	KCMMQPQEMMEYEQ-IBGZPJMESA-N	0	3	326.465	3.437	20	30		EGEDHN
CCN(CC1CCC1)[C@@H](C)C(=O)N(CCC#N)c1ccccc1OC	ZINC000361481612	457745212	/nfs/dbraw/zinc/74/52/12/457745212.db2.gz	OXNLUDRXXMVBAJ-INIZCTEOSA-N	0	3	343.471	3.452	20	30		EGEDHN
N#C[C@H](c1ccccc1)[C@H]1CCCN1C(=O)C1CCN(C2CC2)CC1	ZINC000365927867	457783657	/nfs/dbraw/zinc/78/36/57/457783657.db2.gz	BGMIFHSGFDKXPM-WOJBJXKFSA-N	0	3	337.467	3.159	20	30		EGEDHN
CN1CCC(CC(=O)N2CCC[C@H]2[C@@H](C#N)c2ccccc2)CC1	ZINC000365959600	457785874	/nfs/dbraw/zinc/78/58/74/457785874.db2.gz	AYWQWMMZPQLZSU-OALUTQOASA-N	0	3	325.456	3.017	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1)OCC	ZINC000366823098	457902827	/nfs/dbraw/zinc/90/28/27/457902827.db2.gz	DJPPQUIBJJCTSE-PMACEKPBSA-N	0	3	344.499	3.386	20	30		EGEDHN
CCN(CCCCC(C)(C)C#N)CC(=O)NCc1ccc(F)cc1	ZINC000444590285	457913837	/nfs/dbraw/zinc/91/38/37/457913837.db2.gz	LWNFCBKFTSGFJQ-UHFFFAOYSA-N	0	3	333.451	3.484	20	30		EGEDHN
CN(Cc1c(F)cccc1F)C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000358324062	457933630	/nfs/dbraw/zinc/93/36/30/457933630.db2.gz	OUZIUXCIGJRXOV-OAHLLOKOSA-N	0	3	339.345	3.177	20	30		EGEDHN
C=CCN(C)CCN(CC)Cc1ccc(Oc2ccccc2)nn1	ZINC000411636338	457934512	/nfs/dbraw/zinc/93/45/12/457934512.db2.gz	DDTAEKJRTHHPGQ-UHFFFAOYSA-N	0	3	326.444	3.209	20	30		EGEDHN
CC(C)(CC#N)CNC(=O)NC[C@@H]1CCCN(Cc2cccs2)C1	ZINC000458117277	457936940	/nfs/dbraw/zinc/93/69/40/457936940.db2.gz	XRIAUWUTQVVPIA-HNNXBMFYSA-N	0	3	348.516	3.199	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CC[C@H](CC(F)(F)F)C1	ZINC000444696263	457943419	/nfs/dbraw/zinc/94/34/19/457943419.db2.gz	VNTSEUDVUCZRDH-GDBMZVCRSA-N	0	3	343.389	3.429	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CC[C@@H](CC(F)(F)F)C1	ZINC000444696264	457944474	/nfs/dbraw/zinc/94/44/74/457944474.db2.gz	VNTSEUDVUCZRDH-GOEBONIOSA-N	0	3	343.389	3.429	20	30		EGEDHN
Cc1ccc([C@@H](CNC(=O)NCC(C)(C)CC#N)N2CCCC2)cc1	ZINC000458142582	457944532	/nfs/dbraw/zinc/94/45/32/457944532.db2.gz	MKSJFARFAMQQQS-GOSISDBHSA-N	0	3	342.487	3.371	20	30		EGEDHN
CCN1CCCN(c2c(C#N)cnc3c(F)c(F)c(F)cc32)CC1	ZINC000367444009	457955835	/nfs/dbraw/zinc/95/58/35/457955835.db2.gz	XZBIOAPITSUJKB-UHFFFAOYSA-N	0	3	334.345	3.056	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCc3cccc(Cl)c3C2)CC1	ZINC000458319368	458011134	/nfs/dbraw/zinc/01/11/34/458011134.db2.gz	GGLZZJGFIPSXHO-UHFFFAOYSA-N	0	3	333.863	3.058	20	30		EGEDHN
Cc1ccc(C#N)c(N2C[C@H]3CN(Cc4ccccc4)CC[C@@H]3C2)n1	ZINC000368130299	458014620	/nfs/dbraw/zinc/01/46/20/458014620.db2.gz	AOCSWDFUJCKVGE-WOJBJXKFSA-N	0	3	332.451	3.220	20	30		EGEDHN
N#CC(C(=O)c1ccnn1CC(F)F)c1ccc(C(F)(F)F)cn1	ZINC000434617424	458021971	/nfs/dbraw/zinc/02/19/71/458021971.db2.gz	TYVNKCXEQNBASS-SECBINFHSA-N	0	3	344.243	3.052	20	30		EGEDHN
N#CC(C(=O)c1cccc2c1OCCO2)c1cc(C(F)(F)F)ccn1	ZINC000362129685	458033100	/nfs/dbraw/zinc/03/31/00/458033100.db2.gz	NJOUUSONRCUEGT-LBPRGKRZSA-N	0	3	348.280	3.362	20	30		EGEDHN
COc1cc(CN2CC[C@H](n3ncc4ccccc43)C2)ccc1C#N	ZINC000369117035	458088445	/nfs/dbraw/zinc/08/84/45/458088445.db2.gz	PADHYUIMZJEBMD-SFHVURJKSA-N	0	3	332.407	3.364	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCN(CCSCc3ccccc3)C2)nc1	ZINC000428785387	458212029	/nfs/dbraw/zinc/21/20/29/458212029.db2.gz	LXBVFMMCBMOGFR-SFHVURJKSA-N	0	3	339.464	3.340	20	30		EGEDHN
C=CCN(C(=O)NCC1(N(C)Cc2ccccc2)CCC1)C1CC1	ZINC000458980823	458235930	/nfs/dbraw/zinc/23/59/30/458235930.db2.gz	SOMFEVAVWNOYRP-UHFFFAOYSA-N	0	3	327.472	3.401	20	30		EGEDHN
N#Cc1cnc(NC[C@H]2CCCN(Cc3cccs3)C2)c(F)c1	ZINC000413112736	458292154	/nfs/dbraw/zinc/29/21/54/458292154.db2.gz	XTNLRMFOBZYRKN-CYBMUJFWSA-N	0	3	330.432	3.478	20	30		EGEDHN
C[C@@H]1CCN(C(=O)NCC(C)(C)CC#N)CCN1Cc1ccccc1	ZINC000459262112	458306237	/nfs/dbraw/zinc/30/62/37/458306237.db2.gz	UCIYGTLUTFHTGN-QGZVFWFLSA-N	0	3	342.487	3.232	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)NC(=O)N1CCN(C2CC2)C[C@H](C)C1	ZINC000413836160	458309581	/nfs/dbraw/zinc/30/95/81/458309581.db2.gz	ORGVWSIVWNYPIG-HKUYNNGSSA-N	0	3	341.499	3.300	20	30		EGEDHN
CCO[C@@H]1C[C@H](N[C@H](C)C(=O)N[C@](C)(C#N)C(C)C)C1(CC)CC	ZINC000429342822	458318782	/nfs/dbraw/zinc/31/87/82/458318782.db2.gz	COVFWPWTLMMSCA-KYHPRHEASA-N	0	3	337.508	3.003	20	30		EGEDHN
CC(C)CN(Cc1ccc(C#N)cc1)C(=O)C12CCCN1CCC2	ZINC000414849886	458325176	/nfs/dbraw/zinc/32/51/76/458325176.db2.gz	MKARFDDRSSJESG-UHFFFAOYSA-N	0	3	325.456	3.171	20	30		EGEDHN
C[C@H](C#N)CSc1ccccc1NC(=O)N1C[C@@H](C)NC[C@@H]1C	ZINC000415152865	458328763	/nfs/dbraw/zinc/32/87/63/458328763.db2.gz	CGRZJNCCSOXZKK-MCIONIFRSA-N	0	3	332.473	3.152	20	30		EGEDHN
CC(C)c1ccc([C@H](N)CNC(=O)NCc2ccc(C#N)cc2)cc1	ZINC000417716121	458367541	/nfs/dbraw/zinc/36/75/41/458367541.db2.gz	FKVGZUXGXHWFRN-LJQANCHMSA-N	0	3	336.439	3.181	20	30		EGEDHN
C[C@H](CCCCN1C(=O)c2ccccc2C1=O)NCC1(C#N)CCC1	ZINC000418137118	458371356	/nfs/dbraw/zinc/37/13/56/458371356.db2.gz	DDBBLPJMOABGLN-OAHLLOKOSA-N	0	3	339.439	3.125	20	30		EGEDHN
C[C@H](CNC(=O)c1cccc(SCC#N)c1)N1CCCC[C@@H]1C	ZINC000429954372	458384400	/nfs/dbraw/zinc/38/44/00/458384400.db2.gz	VHTLWQQUSUWJRO-LSDHHAIUSA-N	0	3	331.485	3.295	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(CC)CCOc2ccccc2C)CC1	ZINC000420909586	458403830	/nfs/dbraw/zinc/40/38/30/458403830.db2.gz	FUBRKLBVWASYES-UHFFFAOYSA-N	0	3	345.487	3.056	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)c(F)c1)Cc1ccccc1F	ZINC000421359733	458411980	/nfs/dbraw/zinc/41/19/80/458411980.db2.gz	XVGMWQSKDLSXDX-UHFFFAOYSA-N	0	3	329.394	3.400	20	30		EGEDHN
CN(C)C(=O)C1(NCc2cccc(OCCCC#N)c2)CCCCC1	ZINC000449458068	458424771	/nfs/dbraw/zinc/42/47/71/458424771.db2.gz	HNOFXKOKKZJLOV-UHFFFAOYSA-N	0	3	343.471	3.250	20	30		EGEDHN
CC(C)(C)O[C@@H]1C[C@@H](NCc2cc(C#N)cs2)[C@@H]1n1cccn1	ZINC000449653326	458427786	/nfs/dbraw/zinc/42/77/86/458427786.db2.gz	BZHNQBZRVGJMQD-OAGGEKHMSA-N	0	3	330.457	3.103	20	30		EGEDHN
C[C@@H]1C[C@]1(C#N)C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000449951977	458436275	/nfs/dbraw/zinc/43/62/75/458436275.db2.gz	JBAIYTNOOFUATG-QQTQMKHKSA-N	0	3	325.456	3.048	20	30		EGEDHN
C[C@@H]1C[C@]1(C#N)C(=O)N1CC[C@@]2(C1)CCCN(Cc1ccccc1)C2	ZINC000450024713	458437188	/nfs/dbraw/zinc/43/71/88/458437188.db2.gz	QNFIUICEBUBJDQ-JRGCBEDISA-N	0	3	337.467	3.051	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N[C@@H]1C[C@@H](OC)C12CCC2	ZINC000459746648	458467505	/nfs/dbraw/zinc/46/75/05/458467505.db2.gz	FWEGECBOCXLIMQ-USXIJHARSA-N	0	3	348.512	3.198	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NC[C@H](c1ccc(CC)cc1)N(C)C	ZINC000437641914	458478386	/nfs/dbraw/zinc/47/83/86/458478386.db2.gz	SIGUHCASQJLRPD-QUCCMNQESA-N	0	3	332.488	3.197	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NC[C@H](CC)N1CCc2ccccc2C1	ZINC000437727407	458486713	/nfs/dbraw/zinc/48/67/13/458486713.db2.gz	QBGNIOKFQFCKBW-FPOVZHCZSA-N	0	3	344.499	3.168	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)NCC1(N(C)Cc2ccccc2)CCC1	ZINC000452730074	458508064	/nfs/dbraw/zinc/50/80/64/458508064.db2.gz	LOGLBCRBMXUOJA-UHFFFAOYSA-N	0	3	337.423	3.244	20	30		EGEDHN
C=C(C)Cn1c(C(C)C)nnc1N1CCN([C@@H]2C[C@@H]2C)C[C@H](C)C1	ZINC000453453122	458532336	/nfs/dbraw/zinc/53/23/36/458532336.db2.gz	NFUKVDIUUNLTJH-YESZJQIVSA-N	0	3	331.508	3.144	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1nc(-c2ccc3c(c2)CCC3)cs1	ZINC000424065494	458549243	/nfs/dbraw/zinc/54/92/43/458549243.db2.gz	LYMOZLJLLUYTOV-HNNXBMFYSA-N	0	3	340.452	3.258	20	30		EGEDHN
COc1ccc(NC(=O)[C@H](N)CCCC#N)cc1Cc1ccccc1	ZINC000424068581	458550395	/nfs/dbraw/zinc/55/03/95/458550395.db2.gz	ZPAFMKXGCNDDGO-GOSISDBHSA-N	0	3	337.423	3.246	20	30		EGEDHN
COc1ccc(-c2nc(NC(=O)[C@H](N)CCCC#N)sc2C)cc1	ZINC000424078043	458552963	/nfs/dbraw/zinc/55/29/63/458552963.db2.gz	PBEVKLWNNUSCFQ-CQSZACIVSA-N	0	3	344.440	3.087	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)NCC1(c2cccc(F)c2)CCCCC1	ZINC000424103486	458559131	/nfs/dbraw/zinc/55/91/31/458559131.db2.gz	NGAJJCUHNXYIGJ-KRWDZBQOSA-N	0	3	331.435	3.165	20	30		EGEDHN
C[C@H](CCNC(=O)[C@H](N)CCCC#N)c1cccc(C(F)(F)F)c1	ZINC000424126667	458565120	/nfs/dbraw/zinc/56/51/20/458565120.db2.gz	TWUCKHUEHFNKCI-IUODEOHRSA-N	0	3	341.377	3.336	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1cccc(CSC2CCOCC2)c1	ZINC000424131082	458566459	/nfs/dbraw/zinc/56/64/59/458566459.db2.gz	USVBFLQQVBJSMV-QGZVFWFLSA-N	0	3	347.484	3.058	20	30		EGEDHN
C[C@@H]1CCCCN1CCNC(=O)C(C)(C)Cc1ccc(C#N)cc1	ZINC000454746791	458573325	/nfs/dbraw/zinc/57/33/25/458573325.db2.gz	VPMDVQUNWHAAMR-MRXNPFEDSA-N	0	3	327.472	3.118	20	30		EGEDHN
CC(C)Oc1ccc2ccccc2c1CNC(=O)[C@H](N)CCCC#N	ZINC000424168266	458576224	/nfs/dbraw/zinc/57/62/24/458576224.db2.gz	IHCRPWIHXGDJON-GOSISDBHSA-N	0	3	339.439	3.264	20	30		EGEDHN
CCN(Cc1cccc(-c2ccncc2)c1)C(=O)[C@H](N)CCCC#N	ZINC000424168560	458576516	/nfs/dbraw/zinc/57/65/16/458576516.db2.gz	GBZHXVCYLKYVKR-LJQANCHMSA-N	0	3	336.439	3.118	20	30		EGEDHN
C[C@H](Cc1c(Cl)cccc1Cl)NC(=O)[C@@H](N)CCCC#N	ZINC000424172432	458576526	/nfs/dbraw/zinc/57/65/26/458576526.db2.gz	NXTSRCAYISUYRS-YGRLFVJLSA-N	0	3	328.243	3.062	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N1CCc2ccccc2[C@H]1Cc1ccccc1	ZINC000424172799	458577784	/nfs/dbraw/zinc/57/77/84/458577784.db2.gz	MEXSGWOWULNDQJ-LEWJYISDSA-N	0	3	347.462	3.376	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CCCS2)nnc1N1CCN(C)[C@@H](C(C)C)C1	ZINC000424232152	458588788	/nfs/dbraw/zinc/58/87/88/458588788.db2.gz	BUIRPSNZWQBNQK-HZPDHXFCSA-N	0	3	349.548	3.199	20	30		EGEDHN
C[C@@H]1C[C@@H](N2CCCC2)CN1C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000455728883	458609874	/nfs/dbraw/zinc/60/98/74/458609874.db2.gz	IEKHXYSNUFAWBA-UKRRQHHQSA-N	0	3	346.862	3.497	20	30		EGEDHN
CCOC(=O)[C@@](C)(CNCc1ccc(C#N)cc1F)c1ccccc1	ZINC000470138478	458616605	/nfs/dbraw/zinc/61/66/05/458616605.db2.gz	PQMNYBKIMRKNBV-FQEVSTJZSA-N	0	3	340.398	3.308	20	30		EGEDHN
CN(C)C[C@@H](NC(=O)Nc1cccc(CC#N)c1)c1ccc(F)cc1	ZINC000455905236	458619487	/nfs/dbraw/zinc/61/94/87/458619487.db2.gz	LKCNKZJMAMWIML-GOSISDBHSA-N	0	3	340.402	3.316	20	30		EGEDHN
C[C@@H](NC(=O)[C@@H](C)c1cccc(C#N)c1)[C@H](c1ccccc1)N(C)C	ZINC000462494968	458626407	/nfs/dbraw/zinc/62/64/07/458626407.db2.gz	BWQDBLAZVMXEBD-RZQQEMMASA-N	0	3	335.451	3.469	20	30		EGEDHN
C=Cc1ccc(CCNC(=O)C(C#N)Cc2ccc(C#N)cc2)cc1	ZINC000462574304	458631801	/nfs/dbraw/zinc/63/18/01/458631801.db2.gz	QEXZPPXYZBRDNM-FQEVSTJZSA-N	0	3	329.403	3.242	20	30		EGEDHN
CN(CCCc1ccccc1)C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000470841720	458655362	/nfs/dbraw/zinc/65/53/62/458655362.db2.gz	PITYFRNGADZONZ-HXUWFJFHSA-N	0	3	331.419	3.332	20	30		EGEDHN
C=CCC(C)(C)CNC(=O)NCc1cccc(OCCN(C)C)c1	ZINC000432090724	458676668	/nfs/dbraw/zinc/67/66/68/458676668.db2.gz	SNCNWJSHCUNHRR-UHFFFAOYSA-N	0	3	333.476	3.029	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)NCc1ccccc1C)C(C)C	ZINC000503406849	458706955	/nfs/dbraw/zinc/70/69/55/458706955.db2.gz	NRZOWTHKGZXWDY-LJQANCHMSA-N	0	3	329.488	3.493	20	30		EGEDHN
C=CCCn1cc(C(=O)Nc2cc(CN3CCCC3)ccc2C)nn1	ZINC000424738489	458724589	/nfs/dbraw/zinc/72/45/89/458724589.db2.gz	MRGORRULVDMOQE-UHFFFAOYSA-N	0	3	339.443	3.011	20	30		EGEDHN
CCCN(CCN1CCCCC1)C(=O)NCC1CCC(C#N)CC1	ZINC000503921610	458729523	/nfs/dbraw/zinc/72/95/23/458729523.db2.gz	RIAFDDSTXSTGCE-UHFFFAOYSA-N	0	3	334.508	3.224	20	30		EGEDHN
C[C@H](CNC(=O)C(C)(C)c1cc(F)cc(C#N)c1)N1CCCC[C@H]1C	ZINC000506494436	458751173	/nfs/dbraw/zinc/75/11/73/458751173.db2.gz	DJVNELYBIVTSRJ-HUUCEWRRSA-N	0	3	345.462	3.354	20	30		EGEDHN
C=CCn1c(CC2CCCC2)nnc1N1CC[C@@H](N2CCCCC2)C1	ZINC000508880954	458765689	/nfs/dbraw/zinc/76/56/89/458765689.db2.gz	NRRWWVOKWDWENE-GOSISDBHSA-N	0	3	343.519	3.261	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)CN1CCC[C@@](C)(c2ccccc2)CC1	ZINC000510079916	458774821	/nfs/dbraw/zinc/77/48/21/458774821.db2.gz	QYONQUQHHWLSRZ-RTWAWAEBSA-N	0	3	341.499	3.485	20	30		EGEDHN
C[C@H](NC(=O)OC(C)(C)C)[C@H]1CCN(Cc2ccc(CC#N)cc2)C1	ZINC000495033179	458785574	/nfs/dbraw/zinc/78/55/74/458785574.db2.gz	UTMIUTVWLIOZGR-YJBOKZPZSA-N	0	3	343.471	3.488	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN[C@@H]1CC[C@H](c2ccccc2)C[C@@H]1OC	ZINC000515443354	458809879	/nfs/dbraw/zinc/80/98/79/458809879.db2.gz	HWYIECIIUBWJJF-ZCNNSNEGSA-N	0	3	344.499	3.352	20	30		EGEDHN
C[C@@H](S[C@@H]1CCCN(Cc2ccccc2)C1)C(=O)N(C)CCC#N	ZINC000516062460	458814300	/nfs/dbraw/zinc/81/43/00/458814300.db2.gz	AKYCRDHFNZVHSA-SJLPKXTDSA-N	0	3	345.512	3.145	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN1CCC(CCc2ccc(O)cc2)CC1	ZINC000516287357	458816171	/nfs/dbraw/zinc/81/61/71/458816171.db2.gz	NPNXGCZOLIUJDO-UHFFFAOYSA-N	0	3	344.499	3.461	20	30		EGEDHN
C[C@H](NC[C@H](C#N)CCC#N)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000495269181	458823866	/nfs/dbraw/zinc/82/38/66/458823866.db2.gz	CKCFLNUNGTXUKC-HRCADAONSA-N	0	3	334.464	3.055	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@H](NCc1ccc(CC#N)cc1)C1CC1	ZINC000495302770	458830897	/nfs/dbraw/zinc/83/08/97/458830897.db2.gz	VKEVQHGOOGBPKE-KRWDZBQOSA-N	0	3	329.444	3.146	20	30		EGEDHN
COc1cc(CNC[C@@H](c2ccccc2)N2CCCC2)ccc1C#N	ZINC000440816238	458857082	/nfs/dbraw/zinc/85/70/82/458857082.db2.gz	MBRFOIWTTDTCTO-FQEVSTJZSA-N	0	3	335.451	3.494	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)NCC(C)(C)CCC#N)N(C)C)cc1	ZINC000554217202	458897283	/nfs/dbraw/zinc/89/72/83/458897283.db2.gz	XSDWACLQMFNJMZ-GOSISDBHSA-N	0	3	344.503	3.481	20	30		EGEDHN
Cc1ccc(C[C@H]2CCCN([C@H](C)C(=O)N(C)CCC#N)C2)cc1	ZINC000554586905	458899712	/nfs/dbraw/zinc/89/97/12/458899712.db2.gz	FKKJHOFRKIVHAR-IEBWSBKVSA-N	0	3	327.472	3.010	20	30		EGEDHN
CO[C@H]1CCCC[C@@H]1NCC#Cc1ccc(OC(F)(F)F)cc1	ZINC000441269702	458908006	/nfs/dbraw/zinc/90/80/06/458908006.db2.gz	MWCNRRPRZZSWHT-HOTGVXAUSA-N	0	3	327.346	3.484	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@@H](C)N1CCC(c2ccc(OC)cc2)CC1	ZINC000466701939	458913803	/nfs/dbraw/zinc/91/38/03/458913803.db2.gz	ABYBYNNKYVVOMW-QGZVFWFLSA-N	0	3	342.483	3.464	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)OC(C)(C)C)NCc1ccc(C#N)cc1F	ZINC000495691156	458921299	/nfs/dbraw/zinc/92/12/99/458921299.db2.gz	PZWNPINXLUGLJC-CHWSQXEVSA-N	0	3	335.423	3.479	20	30		EGEDHN
COC(=O)[C@H](Cc1ccccc1)[C@H](C)NCc1cc(C#N)ccc1F	ZINC000556516700	458968298	/nfs/dbraw/zinc/96/82/98/458968298.db2.gz	MGOLHOFRFPRXGI-KBXCAEBGSA-N	0	3	340.398	3.207	20	30		EGEDHN
CC(C)(CC#N)CNC(=O)NC[C@@H](c1cccs1)N1CCCC1	ZINC000457486117	458973639	/nfs/dbraw/zinc/97/36/39/458973639.db2.gz	HQKVFYTVIRUYMM-AWEZNQCLSA-N	0	3	334.489	3.124	20	30		EGEDHN
C[C@@H]1C[C@H](Nc2c(C#N)cnc3c(F)ccc(Cl)c32)CN1C1CC1	ZINC000566652543	458976064	/nfs/dbraw/zinc/97/60/64/458976064.db2.gz	QWFNBUCCYUYICK-PWSUYJOCSA-N	0	3	344.821	3.358	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN(CCc1ccccc1)CC(C)C	ZINC000531842022	458987961	/nfs/dbraw/zinc/98/79/61/458987961.db2.gz	ZBNBAVFXEKBGLG-SFHVURJKSA-N	0	3	329.488	3.195	20	30		EGEDHN
Cc1c(C(=O)C(C#N)c2cc(C)nc(C)n2)cnn1CCC(C)C	ZINC000442041378	458988988	/nfs/dbraw/zinc/98/89/88/458988988.db2.gz	HFLFDTIFKKBDJG-HNNXBMFYSA-N	0	3	325.416	3.135	20	30		EGEDHN
Cn1cc(CNCc2cccc(COCc3ccco3)c2)cc1C#N	ZINC000577335786	459017458	/nfs/dbraw/zinc/01/74/58/459017458.db2.gz	GKZTUNTVKHVCAI-UHFFFAOYSA-N	0	3	335.407	3.496	20	30		EGEDHN
C=CCOc1ccc(CNCc2ccc(-n3cncn3)c(F)c2)cc1	ZINC000556839510	459018404	/nfs/dbraw/zinc/01/84/04/459018404.db2.gz	FQYTUBCYWDQSOO-UHFFFAOYSA-N	0	3	338.386	3.261	20	30		EGEDHN
C[C@H](N[C@H]1CCN(c2ccc(C#N)cc2)C1=O)[C@@H](C)c1ccccc1	ZINC000476824481	459018693	/nfs/dbraw/zinc/01/86/93/459018693.db2.gz	OTZYKZVNNJLTEO-GUXCAODWSA-N	0	3	333.435	3.445	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N[C@@H]1CCN(C)[C@@H](C)C1)c1ccc(F)c(F)c1	ZINC000477048863	459028744	/nfs/dbraw/zinc/02/87/44/459028744.db2.gz	YZJFGFOBRTUGHA-QEORTHHSSA-N	0	3	337.414	3.364	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2CN[C@@H]2CC[C@H](C#N)C2)C[C@@H](C)O1	ZINC000442781591	459035117	/nfs/dbraw/zinc/03/51/17/459035117.db2.gz	JKUQNASMLAFRIN-PDOICOKGSA-N	0	3	327.472	3.078	20	30		EGEDHN
Cc1cc(CN[C@H]2CC[C@H](C#N)C2)ccc1I	ZINC000442854312	459046092	/nfs/dbraw/zinc/04/60/92/459046092.db2.gz	ADLQWNSZZXIKHU-AAEUAGOBSA-N	0	3	340.208	3.382	20	30		EGEDHN
N#C[C@@H]1CC[C@@H](NCCOc2ncc(C(F)(F)F)cc2Cl)C1	ZINC000442879403	459050439	/nfs/dbraw/zinc/05/04/39/459050439.db2.gz	VRIGPDBWVAZYFS-MWLCHTKSSA-N	0	3	333.741	3.414	20	30		EGEDHN
C[C@@H](NC(=O)NCC#Cc1ccccc1)[C@@H](c1ccccc1)N(C)C	ZINC000477820123	459061363	/nfs/dbraw/zinc/06/13/63/459061363.db2.gz	PMLRHHPDBCNRFJ-XLIONFOSSA-N	0	3	335.451	3.029	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2N[C@@H]1CCc2ccccc2NC1=O	ZINC000594510352	459069787	/nfs/dbraw/zinc/06/97/87/459069787.db2.gz	IXCNWZCGXNLUKM-VQTJNVASSA-N	0	3	331.419	3.479	20	30		EGEDHN
COc1cc(CNC[C@@H](C(=O)OC(C)(C)C)C(C)C)ccc1C#N	ZINC000594518746	459075593	/nfs/dbraw/zinc/07/55/93/459075593.db2.gz	KROYSUZVYMZKTO-MRXNPFEDSA-N	0	3	332.444	3.270	20	30		EGEDHN
C[C@H](C(=O)N[C@H]1CCCc2cc(C#N)ccc21)N1CCCCCC1	ZINC000520766499	459092800	/nfs/dbraw/zinc/09/28/00/459092800.db2.gz	DAUVESNLTJXVNK-BEFAXECRSA-N	0	3	325.456	3.316	20	30		EGEDHN
CO[C@H](C)c1nc(CN2CCCN([C@@H]3CC[C@@H](C#N)C3)CC2)cs1	ZINC000590161285	459095536	/nfs/dbraw/zinc/09/55/36/459095536.db2.gz	SODBCHSYFCAKOQ-BFYDXBDKSA-N	0	3	348.516	3.050	20	30		EGEDHN
Cc1cccc2c1CC[C@H]2NC[C@@H](O)COc1ccc(CC#N)cc1	ZINC000567464342	459110963	/nfs/dbraw/zinc/11/09/63/459110963.db2.gz	OZMZBNUZCRCSQX-DYESRHJHSA-N	0	3	336.435	3.078	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)NCCN2CCCC[C@@H]2CC)cc1	ZINC000557853802	459113777	/nfs/dbraw/zinc/11/37/77/459113777.db2.gz	LWOXBPNVHAWBMG-SFHVURJKSA-N	0	3	345.487	3.315	20	30		EGEDHN
N#Cc1nc(NC2CCN(Cc3ccccc3)CC2)sc1Cl	ZINC000590570220	459151519	/nfs/dbraw/zinc/15/15/19/459151519.db2.gz	ZYNXIVTYGMFIKF-UHFFFAOYSA-N	0	3	332.860	3.167	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H]1CCN(C(=O)[C@]2(C#N)CC23CCCC3)C1	ZINC000590671444	459177835	/nfs/dbraw/zinc/17/78/35/459177835.db2.gz	SMGBOSBFQYLXAL-WIYYLYMNSA-N	0	3	337.467	3.193	20	30		EGEDHN
C=CCCSCCNCc1c[nH]nc1-c1ccc2c(c1)OCCO2	ZINC000594960618	459192994	/nfs/dbraw/zinc/19/29/94/459192994.db2.gz	WKFSEIPKVXVEJS-UHFFFAOYSA-N	0	3	345.468	3.247	20	30		EGEDHN
C=CCOCCN[C@H]1CCc2ccc(I)cc21	ZINC000595031779	459221851	/nfs/dbraw/zinc/22/18/51/459221851.db2.gz	DLCIUGCXRKPHIM-AWEZNQCLSA-N	0	3	343.208	3.071	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CNCc1sc(C)nc1C	ZINC000580183098	459256892	/nfs/dbraw/zinc/25/68/92/459256892.db2.gz	SYDPRXJJIHXKIJ-INIZCTEOSA-N	0	3	332.469	3.018	20	30		EGEDHN
CN(CC#Cc1ccc(OC(F)(F)F)cc1)C[C@@H]1CCCC[C@@H]1O	ZINC000481546531	459260084	/nfs/dbraw/zinc/26/00/84/459260084.db2.gz	TXADXUQKVUBOIL-RDJZCZTQSA-N	0	3	341.373	3.420	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)[C@@H]1C[C@H]2CCCC[C@H]2NC1=O	ZINC000595290918	459267325	/nfs/dbraw/zinc/26/73/25/459267325.db2.gz	NODSVYFEMOUOQK-GUDVDZBRSA-N	0	3	325.456	3.218	20	30		EGEDHN
Cn1nnc2cc(C(=O)C(C#N)c3ccc4ccccc4n3)ccc21	ZINC000591020051	459294716	/nfs/dbraw/zinc/29/47/16/459294716.db2.gz	HEAWFFJSDICZHN-CQSZACIVSA-N	0	3	327.347	3.007	20	30		EGEDHN
Cc1ccccc1[C@@H]1C[C@H](C)N(CC(=O)NCc2ccc(C#N)cc2)C1	ZINC000523441468	459303542	/nfs/dbraw/zinc/30/35/42/459303542.db2.gz	UWYBSIGVOVZMQV-FXAWDEMLSA-N	0	3	347.462	3.361	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)N1CCC[C@@H](CC#N)C1)c1ccsc1	ZINC000595451279	459306942	/nfs/dbraw/zinc/30/69/42/459306942.db2.gz	ZONIRJCMMCCDON-DOTOQJQBSA-N	0	3	348.516	3.466	20	30		EGEDHN
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NCc1cccc(C#N)c1F	ZINC000560178446	459309434	/nfs/dbraw/zinc/30/94/34/459309434.db2.gz	OAHCBCPDDHHFDV-KDOFPFPSSA-N	0	3	340.398	3.207	20	30		EGEDHN
Cc1ccc([C@@]2(C)CCN(Cc3cnc4c(C#N)cnn4c3)C2)cc1	ZINC000582181795	459321997	/nfs/dbraw/zinc/32/19/97/459321997.db2.gz	RNQBPDCEMIPBNN-FQEVSTJZSA-N	0	3	331.423	3.073	20	30		EGEDHN
N#CC(C(=O)c1ccc2c(c1)CCCC2=O)c1nnc2n1CCCCC2	ZINC000560350007	459328317	/nfs/dbraw/zinc/32/83/17/459328317.db2.gz	DXOFDNKGGLGJLX-MRXNPFEDSA-N	0	3	348.406	3.014	20	30		EGEDHN
N#Cc1ccc(CN(C(=O)Nc2ccc3c(c2)CNCC3)C2CC2)cc1	ZINC000591310264	459350261	/nfs/dbraw/zinc/35/02/61/459350261.db2.gz	SBYUJGMRKILGPC-UHFFFAOYSA-N	0	3	346.434	3.400	20	30		EGEDHN
C[C@H](c1ccccc1)[C@@H](CO)NC(=O)C(C#N)CCc1ccccc1	ZINC000591320257	459353916	/nfs/dbraw/zinc/35/39/16/459353916.db2.gz	YJSMRISYTGRTMQ-LSTHTHJFSA-N	0	3	336.435	3.040	20	30		EGEDHN
C=CC[C@H](CC)NC(=O)NC[C@H](c1cccc(OC)c1)N1CCCC1	ZINC000537401418	459365157	/nfs/dbraw/zinc/36/51/57/459365157.db2.gz	SDJQKFAUWFABKD-PKOBYXMFSA-N	0	3	345.487	3.486	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)[C@H](C)N[C@H](C)C(C)(C)c1ccccc1	ZINC000538153500	459369099	/nfs/dbraw/zinc/36/90/99/459369099.db2.gz	SKQGPGTZIMYITC-RZQQEMMASA-N	0	3	329.488	3.385	20	30		EGEDHN
C=CCCC[C@@H](C)NC(=O)NCCCN1CCc2ccccc2C1	ZINC000538286684	459370599	/nfs/dbraw/zinc/37/05/99/459370599.db2.gz	HYPJJKKGZKOJIW-QGZVFWFLSA-N	0	3	329.488	3.479	20	30		EGEDHN
C[C@]1(NCC(=O)NC2(C#N)CCCCC2)CCCc2ccccc21	ZINC000538707964	459373153	/nfs/dbraw/zinc/37/31/53/459373153.db2.gz	GYVMAEQOBWODJU-IBGZPJMESA-N	0	3	325.456	3.170	20	30		EGEDHN
C=CC[C@@H](CO)CN[C@H](C)c1ccccc1I	ZINC000540393427	459380247	/nfs/dbraw/zinc/38/02/47/459380247.db2.gz	JANBWICTQLENEQ-VXGBXAGGSA-N	0	3	345.224	3.126	20	30		EGEDHN
CO[C@@H]1CCCC[C@@H]1NCC#Cc1ccc(OC(F)(F)F)cc1	ZINC000483699578	459384052	/nfs/dbraw/zinc/38/40/52/459384052.db2.gz	MWCNRRPRZZSWHT-JKSUJKDBSA-N	0	3	327.346	3.484	20	30		EGEDHN
C/C=C/c1ccc(OC[C@@H](O)CN2CCC(CC#N)CC2)c(OC)c1	ZINC000541022930	459419205	/nfs/dbraw/zinc/41/92/05/459419205.db2.gz	OMUKJQSCSPUXJH-WHLIDYPQSA-N	0	3	344.455	3.094	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](Nc2nc3ccccn3c2C#N)C1	ZINC000541114441	459428312	/nfs/dbraw/zinc/42/83/12/459428312.db2.gz	WIVUTZCHYVQDLA-WBVHZDCISA-N	0	3	331.423	3.453	20	30		EGEDHN
N#CCC[C@@H](NC[C@@H](O)COc1ccccc1F)c1ccccc1	ZINC000561189949	459429498	/nfs/dbraw/zinc/42/94/98/459429498.db2.gz	BDHGYAJDSSJMGV-SJLPKXTDSA-N	0	3	328.387	3.200	20	30		EGEDHN
C[C@@H](CN1CCC(C)CC1)NC(=O)N(C)[C@@H](C)c1cccc(C#N)c1	ZINC000595786003	459440164	/nfs/dbraw/zinc/44/01/64/459440164.db2.gz	OUNMFAZYAAFJNE-IRXDYDNUSA-N	0	3	342.487	3.381	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CCC(C(F)F)CC1)C(C)C	ZINC000485565069	459460627	/nfs/dbraw/zinc/46/06/27/459460627.db2.gz	RUOMQQQNINYVDA-MRXNPFEDSA-N	0	3	343.462	3.372	20	30		EGEDHN
C#CCCCCNCc1nc2c(s1)CN(C(=O)OC(C)(C)C)CC2	ZINC000497150842	459460823	/nfs/dbraw/zinc/46/08/23/459460823.db2.gz	VJDKQEQIPQBJEL-UHFFFAOYSA-N	0	3	349.500	3.329	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN[C@H](Cc1ccccc1OC)C(C)C	ZINC000541628726	459475962	/nfs/dbraw/zinc/47/59/62/459475962.db2.gz	RYFBKFXDAGPVPX-GOSISDBHSA-N	0	3	332.488	3.277	20	30		EGEDHN
C[C@H](N(CC(=O)NC1(C#N)CCC1)Cc1ccccc1)C(C)(C)C	ZINC000525885642	459511558	/nfs/dbraw/zinc/51/15/58/459511558.db2.gz	KJTHHFANBLWCCR-INIZCTEOSA-N	0	3	327.472	3.486	20	30		EGEDHN
N#CC1(NC(=O)CN2C[C@H](c3ccccc3)[C@@H]3CCCC[C@H]32)CCC1	ZINC000525886119	459511781	/nfs/dbraw/zinc/51/17/81/459511781.db2.gz	CGUMTUHLPVVXMA-IPMKNSEASA-N	0	3	337.467	3.207	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)N2CCC[C@H](CC#N)C2)N(C)C)cc1	ZINC000596093836	459517730	/nfs/dbraw/zinc/51/77/30/459517730.db2.gz	YDASRQSEGOJGDJ-IEBWSBKVSA-N	0	3	342.487	3.187	20	30		EGEDHN
N#CC[C@]1(O)CCN(CCCCOc2ccccc2C(F)(F)F)C1	ZINC000592151415	459537928	/nfs/dbraw/zinc/53/79/28/459537928.db2.gz	OQIWMAMUGKOMKS-INIZCTEOSA-N	0	3	342.361	3.215	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CC[C@@H](C(=O)NCc2ccccc2)C1	ZINC000592155554	459538215	/nfs/dbraw/zinc/53/82/15/459538215.db2.gz	OVINRIPITPBKIH-HXUWFJFHSA-N	0	3	333.435	3.005	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CC[C@H]1Nc1nc(C#N)c(Cl)s1	ZINC000596151845	459538524	/nfs/dbraw/zinc/53/85/24/459538524.db2.gz	BLDOBBWSOZHBMS-TZMCWYRMSA-N	0	3	346.887	3.413	20	30		EGEDHN
C=CCc1ccc(OC[C@@H](O)CN2CC3(C2)CCCC3)c(OC)c1	ZINC000488585391	459546610	/nfs/dbraw/zinc/54/66/10/459546610.db2.gz	UAMBBZSCYQVAJF-KRWDZBQOSA-N	0	3	331.456	3.039	20	30		EGEDHN
C[C@H]1C[C@H]1N1CCN(c2nc(C(F)(F)F)ccc2C#N)C[C@@H](C)C1	ZINC000488738390	459550631	/nfs/dbraw/zinc/55/06/31/459550631.db2.gz	YXNMCRPEJUVPTH-SGMGOOAPSA-N	0	3	338.377	3.139	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCN(Cc3ccnc4ccccc34)C2)nc1	ZINC000562386490	459551521	/nfs/dbraw/zinc/55/15/21/459551521.db2.gz	WXRMQBYILZSYEE-KRWDZBQOSA-N	0	3	330.391	3.155	20	30		EGEDHN
C=CCn1cccc1C(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000488770741	459551752	/nfs/dbraw/zinc/55/17/52/459551752.db2.gz	VOTYTLOAAHIFJN-LJQANCHMSA-N	0	3	337.467	3.411	20	30		EGEDHN
CCCN(CC(=O)NCC#Cc1cccc(C(F)(F)F)c1)C(C)C	ZINC000570291114	459554635	/nfs/dbraw/zinc/55/46/35/459554635.db2.gz	ICNFNBQVHYDSLX-UHFFFAOYSA-N	0	3	340.389	3.294	20	30		EGEDHN
C[C@H](c1ccc(Cl)cc1)[C@H](C)N(C)CC(=O)NC1(C#N)CCC1	ZINC000526135419	459555099	/nfs/dbraw/zinc/55/50/99/459555099.db2.gz	BYYIYKHWGJXOIA-KBPBESRZSA-N	0	3	333.863	3.326	20	30		EGEDHN
C=CCN(CC=C)C(=O)CN1CCC[C@H](Cc2ccc(OC)cc2)C1	ZINC000570387039	459555494	/nfs/dbraw/zinc/55/54/94/459555494.db2.gz	FMYVREAYANKAQA-LJQANCHMSA-N	0	3	342.483	3.150	20	30		EGEDHN
Cc1c(C)n(-c2ccccc2)c(NC(=O)CNC2(C3CC3)CC2)c1C#N	ZINC000542521765	459565600	/nfs/dbraw/zinc/56/56/00/459565600.db2.gz	PIVHWASYOAULDR-UHFFFAOYSA-N	0	3	348.450	3.437	20	30		EGEDHN
Cc1ccc(C#N)nc1NCc1ccc(OC2CCN(C)CC2)cc1	ZINC000596226044	459567263	/nfs/dbraw/zinc/56/72/63/459567263.db2.gz	NOTCKDPDGQYXNE-UHFFFAOYSA-N	0	3	336.439	3.347	20	30		EGEDHN
C[C@@H]1[C@@H](Nc2nc(C#N)c(Cl)s2)CCN1Cc1ccccc1	ZINC000596236481	459570366	/nfs/dbraw/zinc/57/03/66/459570366.db2.gz	XKDJPUQIBPKOFN-YPMHNXCESA-N	0	3	332.860	3.165	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCCCc2ccc(C)cc2C)CC1	ZINC000592478766	459610242	/nfs/dbraw/zinc/61/02/42/459610242.db2.gz	KVLGYAREVAIZTF-UHFFFAOYSA-N	0	3	329.488	3.186	20	30		EGEDHN
C=CCN(CCc1ccco1)C[C@@H](O)COc1c(C)cccc1C	ZINC000491369745	459621258	/nfs/dbraw/zinc/62/12/58/459621258.db2.gz	WKMDSJZDRFNTOJ-GOSISDBHSA-N	0	3	329.440	3.367	20	30		EGEDHN
COC[C@@H](NCC(=O)Nc1ccccc1S[C@@H](C)CC#N)C(C)C	ZINC000543452130	459659617	/nfs/dbraw/zinc/65/96/17/459659617.db2.gz	KUYMSYGXWHYYDP-GOEBONIOSA-N	0	3	349.500	3.280	20	30		EGEDHN
C=CCC[C@H](C)NCc1ccc(S(=O)(=O)N(CC)CC)s1	ZINC000543603848	459674468	/nfs/dbraw/zinc/67/44/68/459674468.db2.gz	XEHPAYIZNBTZCO-ZDUSSCGKSA-N	0	3	330.519	3.223	20	30		EGEDHN
C/C=C(/C=C\C(=O)N(CCN(C)C)Cc1ccc(C#N)cc1)CC	ZINC000492173534	459695213	/nfs/dbraw/zinc/69/52/13/459695213.db2.gz	ZCNNOKHHTPSWBW-OMINHHBISA-N	0	3	325.456	3.361	20	30		EGEDHN
CC[C@H](C)N1CCN([C@@H](C#N)c2ccc(Br)cc2)CC1	ZINC000501028744	459706991	/nfs/dbraw/zinc/70/69/91/459706991.db2.gz	JRTGPUCLPQCDFD-BBRMVZONSA-N	0	3	336.277	3.430	20	30		EGEDHN
N#C[C@H](c1ccc(Br)cc1)N1CCN(CCC2CC2)CC1	ZINC000501064583	459710247	/nfs/dbraw/zinc/71/02/47/459710247.db2.gz	XYDWWLNVBLIYED-QGZVFWFLSA-N	0	3	348.288	3.431	20	30		EGEDHN
CC(C)n1ccc(CNC2CCN(Cc3ccc(C#N)cc3)CC2)n1	ZINC000584368143	459720698	/nfs/dbraw/zinc/72/06/98/459720698.db2.gz	AICZTWSQHDUCQG-UHFFFAOYSA-N	0	3	337.471	3.090	20	30		EGEDHN
C=CCN(Cc1cccc(C#N)c1)C(=O)N[C@@H]1CCN(C(C)(C)C)C1	ZINC000596677234	459725202	/nfs/dbraw/zinc/72/52/02/459725202.db2.gz	SUHRJCOYBSMFFG-GOSISDBHSA-N	0	3	340.471	3.129	20	30		EGEDHN
C=CCCSCCNC(=O)N[C@@H](CN(C)C)c1ccc(F)cc1	ZINC000596715948	459739184	/nfs/dbraw/zinc/73/91/84/459739184.db2.gz	OUGQTFBVIMYIIV-INIZCTEOSA-N	0	3	339.480	3.037	20	30		EGEDHN
C[C@@H]1CCCc2ccccc2[C@H]1NCc1cnc2c(C#N)cnn2c1	ZINC000574205801	459790869	/nfs/dbraw/zinc/79/08/69/459790869.db2.gz	LHLPLSJWRAMNSK-KUHUBIRLSA-N	0	3	331.423	3.404	20	30		EGEDHN
CCC(C#N)(CC)C(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000528032703	459797790	/nfs/dbraw/zinc/79/77/90/459797790.db2.gz	HZPUPNRIQFQCQI-UHFFFAOYSA-N	0	3	327.472	3.406	20	30		EGEDHN
CN(CCC#N)C[C@@H](O)CN[C@H](CC(C)(C)C)c1ccc(F)cc1	ZINC000566106285	459805929	/nfs/dbraw/zinc/80/59/29/459805929.db2.gz	LYKIPTWCQBDICS-ZWKOTPCHSA-N	0	3	335.467	3.099	20	30		EGEDHN
C=CCN1CCC(NC(=O)Cc2c(CC)oc3ccccc32)CC1	ZINC000528447970	459807554	/nfs/dbraw/zinc/80/75/54/459807554.db2.gz	JEBUJSDDWNPCIR-UHFFFAOYSA-N	0	3	326.440	3.304	20	30		EGEDHN
N#CC1(C[C@@H](O)CN2CCC[C@@H]2c2nc3ccc(Cl)cc3[nH]2)CC1	ZINC000528500497	459809040	/nfs/dbraw/zinc/80/90/40/459809040.db2.gz	BSAFCUKURJPTJQ-CZUORRHYSA-N	0	3	344.846	3.408	20	30		EGEDHN
COC(=O)c1oc(CNCCSCc2ccccc2C#N)cc1C	ZINC000597043172	459822583	/nfs/dbraw/zinc/82/25/83/459822583.db2.gz	JPIBVFAJMTZISA-UHFFFAOYSA-N	0	3	344.436	3.269	20	30		EGEDHN
Cc1cc(C)c(C#N)c(NC(=O)[C@H]2CCN(Cc3ccccc3)C2)n1	ZINC000602356922	459903180	/nfs/dbraw/zinc/90/31/80/459903180.db2.gz	UQJJVKWAXRHIRQ-KRWDZBQOSA-N	0	3	334.423	3.031	20	30		EGEDHN
Cc1nc(C)c(C)c(NC2CCN(Cc3cccc(C#N)c3)CC2)n1	ZINC000593515662	459913135	/nfs/dbraw/zinc/91/31/35/459913135.db2.gz	QEEAJVMQBRAYRC-UHFFFAOYSA-N	0	3	335.455	3.350	20	30		EGEDHN
CN(C)[C@H](CNC(=O)c1cc2ccccc2n1CC#N)c1ccccc1	ZINC000609160027	459914507	/nfs/dbraw/zinc/91/45/07/459914507.db2.gz	WMWWHQYVYCDVMW-HXUWFJFHSA-N	0	3	346.434	3.198	20	30		EGEDHN
CCC(C#N)C(=O)N1CCc2ccccc2[C@H]1C(=O)OC(C)(C)C	ZINC000598568163	459941249	/nfs/dbraw/zinc/94/12/49/459941249.db2.gz	IIVGHZFRQYMOAQ-CJNGLKHVSA-N	0	3	328.412	3.004	20	30		EGEDHN
CCN1CCN(Cc2ccc(NC(=O)CCCCCC#N)cc2)CC1	ZINC000588284549	459942462	/nfs/dbraw/zinc/94/24/62/459942462.db2.gz	ISQHTZKEWBDYNP-UHFFFAOYSA-N	0	3	342.487	3.237	20	30		EGEDHN
N#Cc1cccc(CN2CCC(NCc3cccc4c3OCO4)CC2)c1	ZINC000593692319	459953185	/nfs/dbraw/zinc/95/31/85/459953185.db2.gz	AXPUXXAUNWPPHX-UHFFFAOYSA-N	0	3	349.434	3.041	20	30		EGEDHN
COc1cc(CN(C)C[C@@H](O)CC(C)(C)C#N)ccc1OC(F)F	ZINC000598589428	459954984	/nfs/dbraw/zinc/95/49/84/459954984.db2.gz	NBBLYIROSCSAMF-ZDUSSCGKSA-N	0	3	342.386	3.029	20	30		EGEDHN
C[C@@H]1Cc2ccccc2N1C1CCN(C[C@H](O)CC(C)(C)C#N)CC1	ZINC000598594035	459956950	/nfs/dbraw/zinc/95/69/50/459956950.db2.gz	FENXQRUUULCMQL-VQIMIIECSA-N	0	3	341.499	3.203	20	30		EGEDHN
C[C@H](CCC#N)CN1CCN(C(=O)Cc2cccc(Cl)c2)[C@H](C)C1	ZINC000602475011	459958549	/nfs/dbraw/zinc/95/85/49/459958549.db2.gz	HCZRTKYIDOTZBJ-HZPDHXFCSA-N	0	3	347.890	3.355	20	30		EGEDHN
CCCN(C[C@@H](O)CC(C)(C)C#N)[C@@H](C)C(=O)Nc1ccccc1C	ZINC000598612926	459963474	/nfs/dbraw/zinc/96/34/74/459963474.db2.gz	FROHFGRLBMSVBS-IRXDYDNUSA-N	0	3	345.487	3.335	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN[C@](C)(CO)c1cc(Cl)cc(Cl)c1	ZINC000598620187	459964177	/nfs/dbraw/zinc/96/41/77/459964177.db2.gz	JGOZEMTXWUKMEY-GOEBONIOSA-N	0	3	345.270	3.091	20	30		EGEDHN
C[C@@H]1CN(c2cccc(Cl)c2)CCN1C[C@@H](O)CC(C)(C)C#N	ZINC000598618299	459965414	/nfs/dbraw/zinc/96/54/14/459965414.db2.gz	OOIVIDFYOHPPFP-PBHICJAKSA-N	0	3	335.879	3.151	20	30		EGEDHN
CC(C)c1cc(N2CCCN(Cc3ccc(C#N)cc3)CC2)ncn1	ZINC000609495252	459971270	/nfs/dbraw/zinc/97/12/70/459971270.db2.gz	AUBBIYSALJNENQ-UHFFFAOYSA-N	0	3	335.455	3.184	20	30		EGEDHN
Cc1ccccc1[C@@H]([C@H](C)NC(=O)N1CCC(CC#N)CC1)N(C)C	ZINC000588722075	459975908	/nfs/dbraw/zinc/97/59/08/459975908.db2.gz	VOZPHFKTOXZWTE-QFBILLFUSA-N	0	3	342.487	3.322	20	30		EGEDHN
Cc1cc(C)n(-c2ccc(CCNCc3cccc(C#N)n3)cc2)n1	ZINC000602515879	459978021	/nfs/dbraw/zinc/97/80/21/459978021.db2.gz	SGDDKLJWYAYFOG-UHFFFAOYSA-N	0	3	331.423	3.088	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)C[C@H]1NC(=O)CC1(C#N)CCCCC1	ZINC000597515646	459981138	/nfs/dbraw/zinc/98/11/38/459981138.db2.gz	CTAQOGJWYZCQCN-IEBWSBKVSA-N	0	3	339.483	3.487	20	30		EGEDHN
N#Cc1cccc(CNC[C@H]2CCN(c3ccc(Cl)cc3)C2)n1	ZINC000602532120	459985419	/nfs/dbraw/zinc/98/54/19/459985419.db2.gz	KMLLEVJGZIIHHL-CQSZACIVSA-N	0	3	326.831	3.223	20	30		EGEDHN
CC[C@@H]1CCCCN1CCNC(=O)c1cc2ccccc2n1CC#N	ZINC000609594371	459990495	/nfs/dbraw/zinc/99/04/95/459990495.db2.gz	DPITUVJOSAFIQM-QGZVFWFLSA-N	0	3	338.455	3.159	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N[C@@H]1CCCc2c3cc(Cl)ccc3[nH]c21	ZINC000602565417	459999406	/nfs/dbraw/zinc/99/94/06/459999406.db2.gz	HTNUHTNZLRTAFV-GDBMZVCRSA-N	0	3	344.846	3.336	20	30		EGEDHN
COc1ccc(CNC[C@H](O)CC(C)(C)C#N)c(OC2CCCC2)c1	ZINC000598722593	460006748	/nfs/dbraw/zinc/00/67/48/460006748.db2.gz	BQNAKHMZXCRKDS-MRXNPFEDSA-N	0	3	346.471	3.407	20	30		EGEDHN
CC(C)(C)[C@@H]1CCCN(CC(=O)NCc2ccc(C#N)cc2)CC1	ZINC000609706169	460009475	/nfs/dbraw/zinc/00/94/75/460009475.db2.gz	SFFILPCIXIHMOE-GOSISDBHSA-N	0	3	327.472	3.323	20	30		EGEDHN
N#CC(C(=O)c1cnc2n1CCCCC2)c1cnc2ccccc2n1	ZINC000621717331	460021765	/nfs/dbraw/zinc/02/17/65/460021765.db2.gz	ARUJDKQIUVUBHP-CYBMUJFWSA-N	0	3	331.379	3.043	20	30		EGEDHN
CN(Cc1cccc(C#N)n1)[C@H]1CCO[C@H](c2ccc(F)cc2)C1	ZINC000602615204	460024350	/nfs/dbraw/zinc/02/43/50/460024350.db2.gz	WLFUHBFPWNIYBV-OALUTQOASA-N	0	3	325.387	3.444	20	30		EGEDHN
C[C@H](NC1CCN(c2ccc(C#N)cn2)CC1)c1ccc(Cl)cn1	ZINC000614139374	460026027	/nfs/dbraw/zinc/02/60/27/460026027.db2.gz	USIXNKBYLLPOST-ZDUSSCGKSA-N	0	3	341.846	3.321	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)C(=O)N(CCN(C)C)C1CCCCC1	ZINC000593969249	460033980	/nfs/dbraw/zinc/03/39/80/460033980.db2.gz	ZJADXZJKAMILMJ-KRWDZBQOSA-N	0	3	341.499	3.460	20	30		EGEDHN
CN(C)CCN(CC1CCCCC1)C(=O)NCc1ccc(C#N)cc1	ZINC000610023741	460051820	/nfs/dbraw/zinc/05/18/20/460051820.db2.gz	QXQTZCNJPSBQKX-UHFFFAOYSA-N	0	3	342.487	3.212	20	30		EGEDHN
CC(C)(C)c1cnc(C(C#N)C(=O)c2cnc3n2CCCC3)s1	ZINC000576110814	460073059	/nfs/dbraw/zinc/07/30/59/460073059.db2.gz	NTIPZVOPGUWWAF-NSHDSACASA-N	0	3	328.441	3.463	20	30		EGEDHN
C[C@]1(Cc2cccc(F)c2)CCCN1Cc1cnc2c(C#N)cnn2c1	ZINC000576161148	460082009	/nfs/dbraw/zinc/08/20/09/460082009.db2.gz	PPGRUFUKNUBINT-HXUWFJFHSA-N	0	3	349.413	3.337	20	30		EGEDHN
CN1CCC(n2ncc3cc(-c4ccc(F)c(C#N)c4)cnc32)CC1	ZINC000598929547	460092745	/nfs/dbraw/zinc/09/27/45/460092745.db2.gz	IPDYPYLXELHFLC-UHFFFAOYSA-N	0	3	335.386	3.376	20	30		EGEDHN
COc1cccc(CN(CC2(CC#N)CC2)C2CCC(O)CC2)c1	ZINC000602785829	460124323	/nfs/dbraw/zinc/12/43/23/460124323.db2.gz	YGBLQYSXRBDVQL-UHFFFAOYSA-N	0	3	328.456	3.495	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)C(=O)NCc1ccccc1CN(C)C	ZINC000594216618	460155630	/nfs/dbraw/zinc/15/56/30/460155630.db2.gz	UFXLFHJYFAFYJK-INIZCTEOSA-N	0	3	335.451	3.115	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)C(=O)N1CCC[C@@H]1CN1CCCCC1	ZINC000594277807	460178884	/nfs/dbraw/zinc/17/88/84/460178884.db2.gz	NPBJEPKQNGCEFM-FXAWDEMLSA-N	0	3	339.483	3.214	20	30		EGEDHN
CSC1CCN(CCC(=O)Nc2sc3c(c2C#N)CCC3)CC1	ZINC000602922324	460186195	/nfs/dbraw/zinc/18/61/95/460186195.db2.gz	HMSZYKPSDIKPIF-UHFFFAOYSA-N	0	3	349.525	3.264	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CCC[C@H](OC2CCC2)C1	ZINC000594390900	460203521	/nfs/dbraw/zinc/20/35/21/460203521.db2.gz	YCGPSAWVEMCDKO-MJGOQNOKSA-N	0	3	326.440	3.319	20	30		EGEDHN
N#CCCCC[C@@H](N)C(=O)Nc1cccc(OCc2cccnc2)c1	ZINC000594441281	460221721	/nfs/dbraw/zinc/22/17/21/460221721.db2.gz	QKXRCZKUTSVNRI-GOSISDBHSA-N	0	3	338.411	3.010	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CNC1(c2cccc(Cl)c2)CC1	ZINC000599356259	460236756	/nfs/dbraw/zinc/23/67/56/460236756.db2.gz	KNVGYCZGUSWFEJ-KRWDZBQOSA-N	0	3	342.826	3.230	20	30		EGEDHN
N#Cc1ccccc1N1CCN(C[C@H]2CCOc3ccccc32)CC1	ZINC000611253810	460318288	/nfs/dbraw/zinc/31/82/88/460318288.db2.gz	LVBFGEMACFPTRO-GOSISDBHSA-N	0	3	333.435	3.247	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NC[C@@H]2CCc3ccccc3C2)cc1	ZINC000619291792	460322343	/nfs/dbraw/zinc/32/23/43/460322343.db2.gz	PHZUUPFZDBIJBT-NQIIRXRSSA-N	0	3	343.430	3.162	20	30		EGEDHN
C[C@]1(c2ccccc2)C[C@H]1NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000619292042	460322494	/nfs/dbraw/zinc/32/24/94/460322494.db2.gz	PVNTXHLMEXSDSJ-YFVAEKQCSA-N	0	3	329.403	3.087	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2N[C@H]1CCN(Cc2ccccc2)C1=O	ZINC000611393762	460353394	/nfs/dbraw/zinc/35/33/94/460353394.db2.gz	VULDIWFSBIULTL-RTWAWAEBSA-N	0	3	345.446	3.326	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2N[C@@H]1CCN(C(=O)C2CCCC2)C1	ZINC000611393770	460353816	/nfs/dbraw/zinc/35/38/16/460353816.db2.gz	WXMDCYVBRXLQNV-QUCCMNQESA-N	0	3	337.467	3.316	20	30		EGEDHN
Cc1noc(C)c1[C@@H](C)NC1CCN(Cc2ccc(C#N)cc2)CC1	ZINC000611438571	460365240	/nfs/dbraw/zinc/36/52/40/460365240.db2.gz	BUBIUZPKANSKRM-CQSZACIVSA-N	0	3	338.455	3.478	20	30		EGEDHN
N#Cc1ccc(CN2CCN(c3cc[nH+]c4c([O-])cccc34)CC2)cc1	ZINC000619473933	460365775	/nfs/dbraw/zinc/36/57/75/460365775.db2.gz	GFAAUBMGEIVZEM-UHFFFAOYSA-N	0	3	344.418	3.134	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)NC[C@@H]1Cc2ccccc21)C(C)C	ZINC000615681535	460373063	/nfs/dbraw/zinc/37/30/63/460373063.db2.gz	ALCPQEOOAHMQST-AZUAARDMSA-N	0	3	341.499	3.324	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@@H](C)N(C)CC(O)(CC)CC	ZINC000626110771	460375554	/nfs/dbraw/zinc/37/55/54/460375554.db2.gz	QSJTZIYBYGOGHX-OAHLLOKOSA-N	0	3	338.517	3.134	20	30		EGEDHN
C=CCN(Cc1ccc(Cl)s1)C(=O)N[C@@H]1CCN(C2CC2)C1	ZINC000604203116	460389647	/nfs/dbraw/zinc/38/96/47/460389647.db2.gz	LQABUMUMPRCZFR-GFCCVEGCSA-N	0	3	339.892	3.336	20	30		EGEDHN
Cc1ccc([C@@H](C)CN[C@@H]2CCN(Cc3ccc(C#N)cc3)C2=O)cc1	ZINC000600149998	460407934	/nfs/dbraw/zinc/40/79/34/460407934.db2.gz	GKCVXGNMOKIXCX-LAUBAEHRSA-N	0	3	347.462	3.361	20	30		EGEDHN
Cc1cc(CNCc2ccc(C#N)c(Cl)c2)ccc1-n1cncn1	ZINC000619748475	460429237	/nfs/dbraw/zinc/42/92/37/460429237.db2.gz	MEYDRJCRKQQRFV-UHFFFAOYSA-N	0	3	337.814	3.391	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)c(Cl)c1)c1cccc(-n2cnnn2)c1	ZINC000619755153	460431739	/nfs/dbraw/zinc/43/17/39/460431739.db2.gz	UPMSQKFPPUSLKA-LBPRGKRZSA-N	0	3	338.802	3.038	20	30		EGEDHN
CC(C)CN(CCc1ccc(F)cc1)CC(=O)N[C@@](C)(C#N)C(C)C	ZINC000604493538	460434705	/nfs/dbraw/zinc/43/47/05/460434705.db2.gz	CKIRHYFDGRDOLM-FQEVSTJZSA-N	0	3	347.478	3.381	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)N2CCC[C@](C)(C#N)C2)C1	ZINC000612114436	460544124	/nfs/dbraw/zinc/54/41/24/460544124.db2.gz	GKRVLUAATNYQQD-IMFGXOCKSA-N	0	3	340.471	3.157	20	30		EGEDHN
Cc1cccc2c1CC[C@H]2N[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000617099081	460743193	/nfs/dbraw/zinc/74/31/93/460743193.db2.gz	PWGHAOKUTZYXNR-RTWAWAEBSA-N	0	3	345.446	3.245	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N1CC[C@H](c2ccco2)C1)C(C)C	ZINC000601255781	460766390	/nfs/dbraw/zinc/76/63/90/460766390.db2.gz	RKYZVLHOGOSIBY-ROUUACIJSA-N	0	3	345.487	3.477	20	30		EGEDHN
C[C@H]1CN(C)CC[C@H]1N(C)C(=O)c1ccc(C#Cc2ccccc2)cc1	ZINC000607515873	460855135	/nfs/dbraw/zinc/85/51/35/460855135.db2.gz	ZLXJUAKRRRJAPM-PGRDOPGGSA-N	0	3	346.474	3.499	20	30		EGEDHN
C[C@@H](NC(=O)C(C#N)CCc1ccccc1)c1ccc2[nH]c(=O)oc2c1	ZINC000601864967	460929967	/nfs/dbraw/zinc/92/99/67/460929967.db2.gz	NLMVPVFHKZFRNB-CJNGLKHVSA-N	0	3	349.390	3.483	20	30		EGEDHN
C=CCC[C@H]1NC(=O)N([C@H](CN2CCCCC2)c2ccccc2)C1=O	ZINC000642927420	461580575	/nfs/dbraw/zinc/58/05/75/461580575.db2.gz	KUPGXVGITMRNQX-QZTJIDSGSA-N	0	3	341.455	3.100	20	30		EGEDHN
C=CCCC[C@H](C)NC(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000660989999	462051660	/nfs/dbraw/zinc/05/16/60/462051660.db2.gz	CQRFEOYEOWAVAG-KRWDZBQOSA-N	0	3	344.503	3.338	20	30		EGEDHN
C=CC[C@@H]1CCCN([C@H](C)C(=O)N[C@@H]2CCOc3ccccc32)C1	ZINC000661378769	462223649	/nfs/dbraw/zinc/22/36/49/462223649.db2.gz	LVVSAHFARSMAND-JFIYKMOQSA-N	0	3	328.456	3.303	20	30		EGEDHN
C=CC[C@@H](C(=O)N1CCCN(c2ccncc2)CC1)c1ccccc1	ZINC000640445118	462409528	/nfs/dbraw/zinc/40/95/28/462409528.db2.gz	PLZKIWQZBPSUMO-HXUWFJFHSA-N	0	3	335.451	3.480	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N(C)C[C@@H]1CCCOC1	ZINC000174148521	526374643	/nfs/dbraw/zinc/37/46/43/526374643.db2.gz	HSHPSCAVBNHDIR-HOTGVXAUSA-N	0	3	336.501	3.010	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC1	ZINC000171738764	526442037	/nfs/dbraw/zinc/44/20/37/526442037.db2.gz	QPRPTYFQFXGUKO-UHFFFAOYSA-N	0	3	338.795	3.020	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(N(C)CCCC)cc2)CC1	ZINC000171714544	526448373	/nfs/dbraw/zinc/44/83/73/526448373.db2.gz	NCAUOUDPOWUSCX-UHFFFAOYSA-N	0	3	329.488	3.303	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2coc(-c3ccccc3)n2)CC1	ZINC000159234117	526602743	/nfs/dbraw/zinc/60/27/43/526602743.db2.gz	QTISHMHYABCSRI-UHFFFAOYSA-N	0	3	325.412	3.112	20	30		EGEDHN
C#CCCCCNC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000155038005	526695758	/nfs/dbraw/zinc/69/57/58/526695758.db2.gz	YPMVLZFZLDSJRD-UYAOXDASSA-N	0	3	341.499	3.484	20	30		EGEDHN
C=C(Cl)COc1ccc([C@@H](C)N[C@H](C)CN2CCCC2=O)cc1	ZINC000178498769	526890798	/nfs/dbraw/zinc/89/07/98/526890798.db2.gz	YEMPCDJQYAPBHK-HUUCEWRRSA-N	0	3	336.863	3.479	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cccc(N3CCC(C)CC3)c2)CC1	ZINC000153855657	526933626	/nfs/dbraw/zinc/93/36/26/526933626.db2.gz	IHUNQMGJKPFLSU-UHFFFAOYSA-N	0	3	339.483	3.207	20	30		EGEDHN
C=CCC[C@H](NC(=O)N[C@H]1CCN(CC2CC2)C1)c1ccccc1	ZINC000158690043	546930016	/nfs/dbraw/zinc/93/00/16/546930016.db2.gz	IFOJLSJXYWKGOL-OALUTQOASA-N	0	3	327.472	3.477	20	30		EGEDHN
N#CC(C(=O)c1ccc2ncccc2c1)c1nnc2n1CCCCC2	ZINC000179000209	547042061	/nfs/dbraw/zinc/04/20/61/547042061.db2.gz	INRKPBFXSODZPH-OAHLLOKOSA-N	0	3	331.379	3.043	20	30		EGEDHN
C[C@@H]1CC[C@@H](C)N1CC(=O)Nc1cccc([C@@]2(C)NC(=O)NC2=O)c1	ZINC000329572627	547501968	/nfs/dbraw/zinc/50/19/68/547501968.db2.gz	NCITWYPTWRWCLS-SEDUGSJDSA-N	0	3	344.415	3.247	20	30		EGEDHN
Cc1cnn(CCCCCN2CCC(C#N)(c3ccccn3)CC2)c1	ZINC000374291276	547806430	/nfs/dbraw/zinc/80/64/30/547806430.db2.gz	JKDJVZKVOVDUAA-UHFFFAOYSA-N	0	3	337.471	3.314	20	30		EGEDHN
N#Cc1ccc(NC(=S)N2CC[C@@H](N3CCCC3)C2)cc1Cl	ZINC000727089367	574647601	/nfs/dbraw/zinc/64/76/01/574647601.db2.gz	RGYGFTSTRHUSCX-CQSZACIVSA-N	0	3	334.876	3.079	20	30		EGEDHN
C=C(C)COc1cccc(NC(=S)NC[C@H]2CCCN2CC)c1	ZINC000727283501	574657926	/nfs/dbraw/zinc/65/79/26/574657926.db2.gz	PBFGRDDUMLTLCK-MRXNPFEDSA-N	0	3	333.501	3.412	20	30		EGEDHN
C#Cc1cccc(N(Cc2ccccc2)C(=S)NCCN(C)C)c1	ZINC000728227456	574731060	/nfs/dbraw/zinc/73/10/60/574731060.db2.gz	KPXFFYXVRGYCOG-UHFFFAOYSA-N	0	3	337.492	3.111	20	30		EGEDHN
Brc1cnn(N=C2CCCC[C@@H]2N2CCCCC2)c1	ZINC000752748001	574815422	/nfs/dbraw/zinc/81/54/22/574815422.db2.gz	SYFXAMYHCJUCSO-AWEZNQCLSA-N	0	3	325.254	3.278	20	30		EGEDHN
C#CCCN1CCC(NC(=O)CCSc2ccc(C)cc2)CC1	ZINC000740736118	574810367	/nfs/dbraw/zinc/81/03/67/574810367.db2.gz	FFIPCVGCMQOWHY-UHFFFAOYSA-N	0	3	330.497	3.081	20	30		EGEDHN
COc1ccccc1OCCN(C)Cc1ccc(OCC#N)cc1	ZINC000729268129	574834516	/nfs/dbraw/zinc/83/45/16/574834516.db2.gz	MPLBKJWTJXADFG-UHFFFAOYSA-N	0	3	326.396	3.108	20	30		EGEDHN
C#CCOc1ccc(NC(=O)N2CCN(CCC(C)(C)C)CC2)cc1	ZINC000731115128	575055706	/nfs/dbraw/zinc/05/57/06/575055706.db2.gz	YYDVPHMZJVDOFB-UHFFFAOYSA-N	0	3	343.471	3.284	20	30		EGEDHN
CC(C)CCC(=O)NCC(=O)C(C#N)c1nc2cc(F)ccc2s1	ZINC000732505500	575273038	/nfs/dbraw/zinc/27/30/38/575273038.db2.gz	VSMJPQJRNQVEIO-LBPRGKRZSA-N	0	3	347.415	3.164	20	30		EGEDHN
C#CCOc1cccc(NC(=O)NCCN2CCCC[C@@H]2CC)c1	ZINC000733634618	575376126	/nfs/dbraw/zinc/37/61/26/575376126.db2.gz	UHLSONKOYUJRKE-KRWDZBQOSA-N	0	3	329.444	3.085	20	30		EGEDHN
Cc1nc(CCC(=O)C(C#N)C(=O)Nc2cccc(C)c2)cs1	ZINC000733678921	575381200	/nfs/dbraw/zinc/38/12/00/575381200.db2.gz	ODNADEVZSQXBEZ-HNNXBMFYSA-N	0	3	327.409	3.040	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)Cc3ccccc3[N+](=O)[O-])nc21	ZINC000735791640	575714278	/nfs/dbraw/zinc/71/42/78/575714278.db2.gz	ANTPZGLEBLVZFB-CYBMUJFWSA-N	0	3	334.335	3.199	20	30		EGEDHN
C=CCNC(=O)CN[C@@H](c1ccc(Br)cc1)C1CCC1	ZINC000678756961	576170154	/nfs/dbraw/zinc/17/01/54/576170154.db2.gz	SQKTYCIGDFWMMQ-MRXNPFEDSA-N	0	3	337.261	3.182	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@H](C)Cc1ccccc1F	ZINC000739143370	576379648	/nfs/dbraw/zinc/37/96/48/576379648.db2.gz	KDWCBDXFPKOUIP-GDBMZVCRSA-N	0	3	332.419	3.410	20	30		EGEDHN
C#CCCN1CCC(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2C)CC1	ZINC000740736250	576621645	/nfs/dbraw/zinc/62/16/45/576621645.db2.gz	LBZMTMSAWWJFEM-OAHLLOKOSA-N	0	3	348.874	3.020	20	30		EGEDHN
COc1ccc(CN[C@H]2CCN(c3ccc(F)cc3F)C2)cc1C#N	ZINC000742370166	576774717	/nfs/dbraw/zinc/77/47/17/576774717.db2.gz	SMYXCOLGUPKPHD-INIZCTEOSA-N	0	3	343.377	3.214	20	30		EGEDHN
C#CCOc1cc(F)ccc1NC(=O)NC[C@@H](C)N1CCC(C)CC1	ZINC000743195451	576803019	/nfs/dbraw/zinc/80/30/19/576803019.db2.gz	XLJCUKRUCIQJAT-OAHLLOKOSA-N	0	3	347.434	3.080	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)[C@@H](C)c2ccc(C)o2)c1	ZINC000744027048	576819064	/nfs/dbraw/zinc/81/90/64/576819064.db2.gz	GRNQXOXNYDECDA-WFASDCNBSA-N	0	3	326.352	3.048	20	30		EGEDHN
C[C@@H]1CC[C@@H](CCC(=O)C(C#N)C(=O)Nc2ccccc2Cl)O1	ZINC000744027689	576819094	/nfs/dbraw/zinc/81/90/94/576819094.db2.gz	BIZJKXBKDRLXMK-AGIUHOORSA-N	0	3	334.803	3.335	20	30		EGEDHN
C=CCNC(=O)C(C#N)C(=O)[C@@H]1C[C@@H]1c1cc(Cl)cc(Cl)c1	ZINC000744031118	576819165	/nfs/dbraw/zinc/81/91/65/576819165.db2.gz	QTEPABNQFLVSGD-MGPQQGTHSA-N	0	3	337.206	3.108	20	30		EGEDHN
CC[C@@H]1CN(CC(=O)C(C#N)c2nc3ccccc3s2)CCS1	ZINC000744424800	576827859	/nfs/dbraw/zinc/82/78/59/576827859.db2.gz	VTDRNGNUXWIDOD-OLZOCXBDSA-N	0	3	345.493	3.300	20	30		EGEDHN
C#CCNC(=O)[C@H](C)N[C@@H](Cc1ccccc1Cl)c1ccccc1	ZINC000745175784	576842969	/nfs/dbraw/zinc/84/29/69/576842969.db2.gz	JNDALKLBHIZMPE-KXBFYZLASA-N	0	3	340.854	3.351	20	30		EGEDHN
C=CCC[C@@H]([NH2+]CCSCc1ccccc1-c1nnn[n-]1)C1CC1	ZINC000823894514	607684112	/nfs/dbraw/zinc/68/41/12/607684112.db2.gz	RWXAWTKWYHALFQ-QGZVFWFLSA-N	0	3	343.500	3.434	20	30		EGEDHN
C=CCC[C@@H]([NH2+]CCSCc1ccccc1-c1nn[n-]n1)C1CC1	ZINC000823894514	607684114	/nfs/dbraw/zinc/68/41/14/607684114.db2.gz	RWXAWTKWYHALFQ-QGZVFWFLSA-N	0	3	343.500	3.434	20	30		EGEDHN
C[C@@H](SCc1ccccc1)C(=O)C(C#N)C(=O)NC1CCCCC1	ZINC000050683760	1291655254	/nfs/dbraw/zinc/65/52/54/1291655254.db2.gz	ADUWXCLBTHANHH-RHSMWYFYSA-N	0	3	344.480	3.466	20	30		EGEDHN
C[C@@H]1CCC[C@H](C)N1Cc1cc(=O)n2c3ccccc3[nH]c2c1C#N	ZINC000072697364	1292287625	/nfs/dbraw/zinc/28/76/25/1292287625.db2.gz	WGNATGUFCXWART-IJEWVQPXSA-N	0	3	334.423	3.487	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC(=O)Nc1ccc(SC(F)F)cc1	ZINC000831828787	1292924771	/nfs/dbraw/zinc/92/47/71/1292924771.db2.gz	BUPOFMDHJRNBKS-KGLIPLIRSA-N	0	3	342.411	3.263	20	30		EGEDHN
COc1ccccc1[C@@H](C)CC(=O)C(C#N)C(=O)NC1CCCCC1	ZINC000103329977	1293002603	/nfs/dbraw/zinc/00/26/03/1293002603.db2.gz	WXUXGZVCQMNYQP-WMLDXEAASA-N	0	3	342.439	3.347	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCN(C(=O)OC(C)(C)C)C1(C)C	ZINC000832645857	1293031938	/nfs/dbraw/zinc/03/19/38/1293031938.db2.gz	QVQCJBHDBKDUCV-LLVKDONJSA-N	0	3	333.270	3.273	20	30		EGEDHN
C#Cc1cccc(CN[C@@H](C)c2ccc(N3CCOCC3)c(F)c2)c1	ZINC000834902337	1293170068	/nfs/dbraw/zinc/17/00/68/1293170068.db2.gz	GXGYORJRYXZXFI-INIZCTEOSA-N	0	3	338.426	3.494	20	30		EGEDHN
CN(C)C[C@](C)(C=NNc1nc(=O)c2ccccc2[nH]1)c1ccccc1	ZINC000834960827	1293180910	/nfs/dbraw/zinc/18/09/10/1293180910.db2.gz	CSVNJLQLNPVVDW-FQEVSTJZSA-N	0	3	349.438	3.253	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)[C@@H]1CC12CCSCC2	ZINC000835034977	1293191384	/nfs/dbraw/zinc/19/13/84/1293191384.db2.gz	DBZSHKPKHBENLM-OLZOCXBDSA-N	0	3	325.437	3.283	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)COCC2CCCC2)cc1	ZINC000835061628	1293195659	/nfs/dbraw/zinc/19/56/59/1293195659.db2.gz	ILCASLRYWKGGRX-KRWDZBQOSA-N	0	3	328.412	3.103	20	30		EGEDHN
N#CC(C(=O)CCCC(=O)C1CC1)C(=O)Nc1ccccc1Cl	ZINC000835063201	1293196809	/nfs/dbraw/zinc/19/68/09/1293196809.db2.gz	IJQYSYNFVUFLDN-GFCCVEGCSA-N	0	3	332.787	3.137	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)C(C#N)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000119627821	1293281019	/nfs/dbraw/zinc/28/10/19/1293281019.db2.gz	AJRHPXKPWFCGPW-PWSUYJOCSA-N	0	3	338.766	3.108	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)CCO[C@@H](C)CC(C)C	ZINC000120062511	1293301331	/nfs/dbraw/zinc/30/13/31/1293301331.db2.gz	VACBBSWDPJONET-LSDHHAIUSA-N	0	3	346.427	3.184	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(Cl)cc1Cl)C(=O)[C@@H]1CCCCO1	ZINC000121988892	1293397633	/nfs/dbraw/zinc/39/76/33/1293397633.db2.gz	UGLQUERERDFKRE-GWCFXTLKSA-N	0	3	341.194	3.210	20	30		EGEDHN
COc1ccc(Cl)cc1CC(=O)C(C#N)C(=O)NC1CCCCC1	ZINC000127323350	1293559629	/nfs/dbraw/zinc/55/96/29/1293559629.db2.gz	ORMQMVDVPBRXJB-OAHLLOKOSA-N	0	3	348.830	3.049	20	30		EGEDHN
Cc1cc(Cl)ccc1OCC(=O)C(C#N)C(=O)Nc1ccccc1	ZINC000127853186	1293575548	/nfs/dbraw/zinc/57/55/48/1293575548.db2.gz	KKWXEWRQVUJJIR-OAHLLOKOSA-N	0	3	342.782	3.375	20	30		EGEDHN
C[C@H](Oc1cccc(Cl)c1)C(=O)C(C#N)C(=O)Nc1ccccc1	ZINC000127951683	1293578445	/nfs/dbraw/zinc/57/84/45/1293578445.db2.gz	UDSILVDKGLAIIC-LRDDRELGSA-N	0	3	342.782	3.455	20	30		EGEDHN
CC(C)Cc1ccc(C(=O)CCC(=O)C(C#N)C(=O)NC(C)C)cc1	ZINC000130998864	1293675586	/nfs/dbraw/zinc/67/55/86/1293675586.db2.gz	ABFRHSLJJFHLDJ-KRWDZBQOSA-N	0	3	342.439	3.081	20	30		EGEDHN
C#Cc1cccc(NC(=O)N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)c1	ZINC000161648152	1294297485	/nfs/dbraw/zinc/29/74/85/1294297485.db2.gz	ASNQIWSFOXJUHA-JXFKEZNVSA-N	0	3	333.435	3.310	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCc3c(C)cccc3C2)CC1	ZINC000171560623	1294411670	/nfs/dbraw/zinc/41/16/70/1294411670.db2.gz	BEPVRKGROBKEQL-UHFFFAOYSA-N	0	3	327.472	3.103	20	30		EGEDHN
N#CC(C(=O)CC[C@@H]1CCCCO1)C(=O)Nc1ccc(Cl)cc1	ZINC000171796838	1294417366	/nfs/dbraw/zinc/41/73/66/1294417366.db2.gz	IDABCXCZNOKXKF-GJZGRUSLSA-N	0	3	334.803	3.337	20	30		EGEDHN
C[C@@H](CCc1ccccc1F)C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000174013100	1294476946	/nfs/dbraw/zinc/47/69/46/1294476946.db2.gz	WNBVNZCAEMKHCR-ZFWWWQNUSA-N	0	3	339.370	3.137	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)Cc2cccc(F)c2F)cc1	ZINC000176917142	1294643360	/nfs/dbraw/zinc/64/33/60/1294643360.db2.gz	DMAOPHVGBMUEBS-HNNXBMFYSA-N	0	3	342.345	3.417	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)OC(C)(C)C	ZINC000189475934	1295524355	/nfs/dbraw/zinc/52/43/55/1295524355.db2.gz	SCAXKUHWRRBBGD-VXGBXAGGSA-N	0	3	333.270	3.321	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)CCn1ccc2ccccc21	ZINC000193371663	1295858654	/nfs/dbraw/zinc/85/86/54/1295858654.db2.gz	OZHIJUZXUVETAV-INIZCTEOSA-N	0	3	325.412	3.047	20	30		EGEDHN
CO[C@H](C)CC(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000195492286	1296072669	/nfs/dbraw/zinc/07/26/69/1296072669.db2.gz	XITXZGZFRGGLME-SCZZXKLOSA-N	0	3	329.183	3.066	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@H]1C[C@H]1c1cccc(F)c1F	ZINC000246652670	1296365405	/nfs/dbraw/zinc/36/54/05/1296365405.db2.gz	WTXJMJUAWJQLKO-SOUVJXGZSA-N	0	3	348.393	3.474	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)Nc2cc(CC#N)ccn2)C1	ZINC000871721047	1296499941	/nfs/dbraw/zinc/49/99/41/1296499941.db2.gz	IXKOUBOMPZSSSP-YJBOKZPZSA-N	0	3	349.438	3.105	20	30		EGEDHN
CN(C)[C@@H](C/N=C\c1ccc(O)c(O)c1O)c1ccc(Cl)cc1	ZINC000746815353	1298664047	/nfs/dbraw/zinc/66/40/47/1298664047.db2.gz	HRLGXEJHVZJFSK-GPMKDSKKSA-N	0	3	334.803	3.179	20	30		EGEDHN
CC(C)C(=O)N1CCCC[C@@H]1C(=O)C(C#N)c1nc(C(C)C)cs1	ZINC000747196989	1298740630	/nfs/dbraw/zinc/74/06/30/1298740630.db2.gz	STQJBJBVJLPFLQ-DZGCQCFKSA-N	0	3	347.484	3.480	20	30		EGEDHN
CC(C)C(=O)N1CCCC[C@H]1C(=O)C(C#N)c1nc(C(C)C)cs1	ZINC000747196990	1298740754	/nfs/dbraw/zinc/74/07/54/1298740754.db2.gz	STQJBJBVJLPFLQ-HIFRSBDPSA-N	0	3	347.484	3.480	20	30		EGEDHN
C=C(Cl)C[C@@H](N)C(=O)NCc1c(C)cc(Br)cc1C	ZINC000876629719	1298881645	/nfs/dbraw/zinc/88/16/45/1298881645.db2.gz	MIKLPEBITFRDNJ-CYBMUJFWSA-N	0	3	345.668	3.152	20	30		EGEDHN
C=C(Cl)C[C@H](N)C(=O)N1CCc2nc(-c3ccccc3)sc2C1	ZINC000876963343	1299090617	/nfs/dbraw/zinc/09/06/17/1299090617.db2.gz	MLEDXAWMZXOHAR-ZDUSSCGKSA-N	0	3	347.871	3.165	20	30		EGEDHN
Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@H]1N2C(=O)c1ccc(C#N)s1	ZINC000749315236	1299191734	/nfs/dbraw/zinc/19/17/34/1299191734.db2.gz	COWNTHUYMZLENM-DOTOQJQBSA-N	0	3	337.448	3.376	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@@H]2C[C@@H](NCC3(C#N)CC3)CC[C@@H]21	ZINC000877493532	1299344995	/nfs/dbraw/zinc/34/49/95/1299344995.db2.gz	FDYBXNAHGMIOSL-PMPSAXMXSA-N	0	3	333.476	3.448	20	30		EGEDHN
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@H]1NCc1cccc(C#N)n1	ZINC000877522818	1299366166	/nfs/dbraw/zinc/36/61/66/1299366166.db2.gz	GTQBAAQYODQZNH-KEYYUXOJSA-N	0	3	344.459	3.077	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=S)Nc2ccc(C#N)c(Cl)c2)CN1C1CC1	ZINC000753958825	1300053411	/nfs/dbraw/zinc/05/34/11/1300053411.db2.gz	AOXRPKOTPYLPTE-GXFFZTMASA-N	0	3	334.876	3.123	20	30		EGEDHN
CCc1cc(N=NC2CN(C(C)C)C[C@H]2C)nc(-c2ccccn2)n1	ZINC000754261032	1300112369	/nfs/dbraw/zinc/11/23/69/1300112369.db2.gz	TWNZXVYOEHRMGS-CQSZACIVSA-N	0	3	338.459	3.229	20	30		EGEDHN
COc1cc(C#N)ccc1COC(=O)C(C)(C)N(C)C1CCCC1	ZINC000754867885	1300234601	/nfs/dbraw/zinc/23/46/01/1300234601.db2.gz	FLWSCYPRVJZKNV-UHFFFAOYSA-N	0	3	330.428	3.263	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)cc1	ZINC000758200914	1300809270	/nfs/dbraw/zinc/80/92/70/1300809270.db2.gz	FXSAARNELMUZOZ-YLJYHZDGSA-N	0	3	348.446	3.091	20	30		EGEDHN
N#CCc1cccc(C(=O)OCC2CCN(Cc3ccco3)CC2)c1	ZINC000760135014	1301225282	/nfs/dbraw/zinc/22/52/82/1301225282.db2.gz	BVKGNLZEJYJQEZ-UHFFFAOYSA-N	0	3	338.407	3.415	20	30		EGEDHN
C#CCNC(=O)CCN[C@H](CC(C)C)c1cc(Cl)ccc1OC	ZINC000765506989	1302275308	/nfs/dbraw/zinc/27/53/08/1302275308.db2.gz	PBFXCQFQISHNCG-MRXNPFEDSA-N	0	3	336.863	3.165	20	30		EGEDHN
C=CC[C@@H](NC(=O)N1CCN(C2CCCCC2)CC1)c1ccncc1	ZINC000767020111	1302565057	/nfs/dbraw/zinc/56/50/57/1302565057.db2.gz	WMQYCOHSPJTDNB-LJQANCHMSA-N	0	3	342.487	3.359	20	30		EGEDHN
COc1cccc([O-])c1C[NH+]1CCC(Oc2cccc(C#N)c2)CC1	ZINC000768893838	1303008658	/nfs/dbraw/zinc/00/86/58/1303008658.db2.gz	SVKYFPMXOFCDQV-UHFFFAOYSA-N	0	3	338.407	3.316	20	30		EGEDHN
COc1ccc(C(C)=NNCC(F)(F)F)cc1CN1CCCC1	ZINC000769824726	1303180713	/nfs/dbraw/zinc/18/07/13/1303180713.db2.gz	LYHZVYUMLPDETD-UHFFFAOYSA-N	0	3	329.366	3.167	20	30		EGEDHN
C#C[C@H](C)N(C)C[C@@H](O)CO[C@H](c1ccccc1)c1ccc(C)cc1	ZINC000769962189	1303199070	/nfs/dbraw/zinc/19/90/70/1303199070.db2.gz	BZRYUILZZACUQG-VLCRHTCISA-N	0	3	337.463	3.415	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@@H](C)N1CCC(c2nc(C)c(C)[nH]2)CC1	ZINC000886668398	1303547863	/nfs/dbraw/zinc/54/78/63/1303547863.db2.gz	RVIAYPXRVLAWRT-MRXNPFEDSA-N	0	3	332.492	3.019	20	30		EGEDHN
CCN(CC)C(=O)[C@H](Cc1ccccc1)N[C@@H]1CCC[C@H](C#N)C1	ZINC000774110512	1303775686	/nfs/dbraw/zinc/77/56/86/1303775686.db2.gz	IAZDMCAMJVUKAO-OTWHNJEPSA-N	0	3	327.472	3.138	20	30		EGEDHN
CCOCCON=C(C)c1ccc(OC)c(CN2CCCCC2)c1	ZINC000774415763	1303807616	/nfs/dbraw/zinc/80/76/16/1303807616.db2.gz	SMYOQMSNASXJSD-UHFFFAOYSA-N	0	3	334.460	3.458	20	30		EGEDHN
C[C@@H](N[C@H](C)c1ccc(N(C)C)cc1)C(=O)NC1(C#N)CCCCC1	ZINC000774484675	1303815987	/nfs/dbraw/zinc/81/59/87/1303815987.db2.gz	PLONEHHHXBYHOE-HZPDHXFCSA-N	0	3	342.487	3.134	20	30		EGEDHN
N#Cc1ccc(C2CCN(C(=O)[C@H]3CCN3C3CCCC3)CC2)cc1	ZINC000887699392	1303898522	/nfs/dbraw/zinc/89/85/22/1303898522.db2.gz	YAJMCBZUYPNYIL-HXUWFJFHSA-N	0	3	337.467	3.281	20	30		EGEDHN
C=CCC[C@H](NCC(=O)NCCC#N)c1ccc(C(F)(F)F)cc1	ZINC000775552093	1303982891	/nfs/dbraw/zinc/98/28/91/1303982891.db2.gz	DSIXRPNPJUNCLD-HNNXBMFYSA-N	0	3	339.361	3.332	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]\CCc2ccc(CO)cc2)c([O-])c1	ZINC000775629382	1303997920	/nfs/dbraw/zinc/99/79/20/1303997920.db2.gz	FOKZLPUVKFPRJR-STZFKDTASA-N	0	3	326.440	3.392	20	30		EGEDHN
Cc1cccc(C)c1NC(=S)NN=Cc1cnccc1N(C)C	ZINC000776183880	1304108598	/nfs/dbraw/zinc/10/85/98/1304108598.db2.gz	RFEMQMGEVJEPAX-UHFFFAOYSA-N	0	3	327.457	3.085	20	30		EGEDHN
N#Cc1cccn(CN2C[C@H](c3ccccc3)[C@H]3CCCC[C@H]32)c1=O	ZINC000776771237	1304196398	/nfs/dbraw/zinc/19/63/98/1304196398.db2.gz	GWRAXYKLUCKQNG-VAMGGRTRSA-N	0	3	333.435	3.336	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)c1nc2ccccc2o1)NC(=O)OC(C)(C)C	ZINC000777296954	1304280038	/nfs/dbraw/zinc/28/00/38/1304280038.db2.gz	MRWVEPASNUXGMB-RYUDHWBXSA-N	0	3	343.383	3.307	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)c1nc2ccccc2o1)NC(=O)OC(C)(C)C	ZINC000777296953	1304280230	/nfs/dbraw/zinc/28/02/30/1304280230.db2.gz	MRWVEPASNUXGMB-NWDGAFQWSA-N	0	3	343.383	3.307	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CN[C@H]1CCC[C@@H](C(=O)N(C)C)C1	ZINC000778168263	1304408701	/nfs/dbraw/zinc/40/87/01/1304408701.db2.gz	AMMGJZUTQOFRAO-CABCVRRESA-N	0	3	348.874	3.089	20	30		EGEDHN
Cc1ccc([C@@H](CNC(=O)Nc2ccc(C#N)cn2)N2CCCC2)cc1	ZINC000889223625	1304417755	/nfs/dbraw/zinc/41/77/55/1304417755.db2.gz	GPFOWCKNUHZNFK-GOSISDBHSA-N	0	3	349.438	3.220	20	30		EGEDHN
N#Cc1c(F)cccc1C(=O)OCC1CCN(Cc2ccco2)CC1	ZINC000778687156	1304479447	/nfs/dbraw/zinc/47/94/47/1304479447.db2.gz	DRHVCCUAXYZQMI-UHFFFAOYSA-N	0	3	342.370	3.359	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H]2CN(Cc3ccccc3)CCCO2)CC1	ZINC000890215062	1304710749	/nfs/dbraw/zinc/71/07/49/1304710749.db2.gz	HWVMZMHHVPLAIK-HXUWFJFHSA-N	0	3	342.483	3.140	20	30		EGEDHN
CC(C)Cn1cc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)cn1	ZINC000781767684	1304872467	/nfs/dbraw/zinc/87/24/67/1304872467.db2.gz	WQDNZOOSAKVFQB-ZDUSSCGKSA-N	0	3	344.802	3.154	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)cn1)[C@H]1CCCCN1C(=O)OC(C)(C)C	ZINC000783300634	1305078942	/nfs/dbraw/zinc/07/89/42/1305078942.db2.gz	OPCHJIYEGYZCFP-RHSMWYFYSA-N	0	3	344.459	3.221	20	30		EGEDHN
C=CCS(=O)(=O)CCN[C@H](Cc1ccccc1)c1ccccc1	ZINC000783530536	1305103724	/nfs/dbraw/zinc/10/37/24/1305103724.db2.gz	AYZZYRBEFPACJX-LJQANCHMSA-N	0	3	329.465	3.161	20	30		EGEDHN
Cc1nc(C)c(CC(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)s1	ZINC000892493973	1305405844	/nfs/dbraw/zinc/40/58/44/1305405844.db2.gz	WKTRYTDOORBHLJ-ZDUSSCGKSA-N	0	3	347.827	3.303	20	30		EGEDHN
N#CC(C(=O)CC[C@@H]1CCCCO1)C(=O)NCc1cccc(Cl)c1	ZINC000786546814	1305595468	/nfs/dbraw/zinc/59/54/68/1305595468.db2.gz	MBIIENRXGQHLNX-JKSUJKDBSA-N	0	3	348.830	3.014	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)[C@H](C)OCC(C)C)c1ccccc1	ZINC000787048051	1305684018	/nfs/dbraw/zinc/68/40/18/1305684018.db2.gz	YTLXJGGEAYLXEW-XIRDDKMYSA-N	0	3	330.428	3.024	20	30		EGEDHN
C#CCOc1ccc(CNc2cccc(N3CCN(CC)CC3)c2)cc1	ZINC000788430785	1305941249	/nfs/dbraw/zinc/94/12/49/1305941249.db2.gz	CVTPGWQPERMRDW-UHFFFAOYSA-N	0	3	349.478	3.453	20	30		EGEDHN
C[C@@H](CN1CCCCC1)NC(=O)C#Cc1ccc(C(F)(F)F)cc1	ZINC000790293166	1306291629	/nfs/dbraw/zinc/29/16/29/1306291629.db2.gz	HWLMGSDSQQOBDP-AWEZNQCLSA-N	0	3	338.373	3.048	20	30		EGEDHN
O=C1[C@H]([NH2+][C@@H]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)CCCN1[O-]	ZINC000895162441	1309217635	/nfs/dbraw/zinc/21/76/35/1309217635.db2.gz	ZOADIKPNDFJNDT-BPLDGKMQSA-N	0	3	342.361	3.311	20	30		EGEDHN
Cc1nn(-c2ccccc2)c(N)c1C=NNCCCc1ccccc1	ZINC000794905659	1309619470	/nfs/dbraw/zinc/61/94/70/1309619470.db2.gz	XVOSXXIVVSWSLS-UHFFFAOYSA-N	0	3	333.439	3.319	20	30		EGEDHN
N#Cc1ccc2c(c1)CCCC[C@H]2NCc1ccc(-n2cncn2)nc1	ZINC000795778953	1309832353	/nfs/dbraw/zinc/83/23/53/1309832353.db2.gz	VOOAZTUSIUWZFF-LJQANCHMSA-N	0	3	344.422	3.091	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)CCCOC(C)(C)C)cc1	ZINC000796799548	1310089999	/nfs/dbraw/zinc/08/99/99/1310089999.db2.gz	QTPRNEUBGPDXFB-INIZCTEOSA-N	0	3	330.428	3.492	20	30		EGEDHN
C[C@@H](Cn1ccc2ccccc21)C(=O)C(C#N)C(=O)NC1CCCC1	ZINC000796805464	1310090910	/nfs/dbraw/zinc/09/09/10/1310090910.db2.gz	ZNMTYGWEBLUHSE-WMLDXEAASA-N	0	3	337.423	3.045	20	30		EGEDHN
C=CC[C@H](CC)NC(=O)Nc1ccc(N2CCN(CC)CC2)cc1	ZINC000798496695	1310371469	/nfs/dbraw/zinc/37/14/69/1310371469.db2.gz	PLGWCOUSHVPHIN-INIZCTEOSA-N	0	3	330.476	3.305	20	30		EGEDHN
Cc1ccc(C(=O)N(CCc2ccccc2)CCN(C)C)cc1C#N	ZINC000799309775	1310522808	/nfs/dbraw/zinc/52/28/08/1310522808.db2.gz	KQSCNXTVCAACPI-UHFFFAOYSA-N	0	3	335.451	3.113	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)c2ccc(C)c(C#N)c2)N(C)C)cc1	ZINC000799529088	1310567939	/nfs/dbraw/zinc/56/79/39/1310567939.db2.gz	OIGCQOMCVYHCBS-HXUWFJFHSA-N	0	3	335.451	3.462	20	30		EGEDHN
CCOC(=O)Oc1ccc(C(=O)C(C#N)c2cc(C)nc(C)n2)cc1	ZINC000800384941	1310747680	/nfs/dbraw/zinc/74/76/80/1310747680.db2.gz	NJSQGUSQHJKASF-HNNXBMFYSA-N	0	3	339.351	3.119	20	30		EGEDHN
C#CCN(C)[C@@H]1CCCN(C(=O)c2ccc(Cl)cc2Cl)C1	ZINC001027661350	1328049790	/nfs/dbraw/zinc/04/97/90/1328049790.db2.gz	DMOSSYOMWUNYRX-CYBMUJFWSA-N	0	3	325.239	3.163	20	30		EGEDHN
C[C@@H](C#N)OCCN(Cc1ccccc1)C[C@H](O)c1cccs1	ZINC000801926895	1316967045	/nfs/dbraw/zinc/96/70/45/1316967045.db2.gz	YGGDFUJIZVDTKU-RDJZCZTQSA-N	0	3	330.453	3.212	20	30		EGEDHN
C[C@H](C#N)OCCN[C@@H](COc1ccccc1F)c1ccccc1	ZINC000801937571	1316969853	/nfs/dbraw/zinc/96/98/53/1316969853.db2.gz	PZVZEXRBFBVWPV-QAPCUYQASA-N	0	3	328.387	3.464	20	30		EGEDHN
C[C@H]1CC[C@H](C(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)CC1	ZINC001019682072	1317329203	/nfs/dbraw/zinc/32/92/03/1317329203.db2.gz	NKBHQJYRMPYFOH-KKUMJFAQSA-N	0	3	331.485	3.137	20	30		EGEDHN
Cc1ccccc1C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001019949222	1317472666	/nfs/dbraw/zinc/47/26/66/1317472666.db2.gz	LOVHSSGKZSFBOA-QAQDUYKDSA-N	0	3	337.398	3.056	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N[C@H]1C[C@H](N[C@H](C)c2ccccc2F)C1	ZINC001020168868	1317571872	/nfs/dbraw/zinc/57/18/72/1317571872.db2.gz	ATJHXWUOASWGHU-GHJUNDHASA-N	0	3	346.446	3.105	20	30		EGEDHN
C#Cc1cccc(NC(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H]2C)c1	ZINC000807621253	1317574415	/nfs/dbraw/zinc/57/44/15/1317574415.db2.gz	XMENUWCKZYZEMC-OXJNMPFZSA-N	0	3	333.435	3.452	20	30		EGEDHN
C#CCOc1ccc(C(=O)NC[C@@H](N[C@@H](C)CC)c2ccco2)cc1	ZINC000807680095	1317577556	/nfs/dbraw/zinc/57/75/56/1317577556.db2.gz	LRRZDYYIXNJDNL-MAUKXSAKSA-N	0	3	340.423	3.151	20	30		EGEDHN
CN(C)C[C@@H](NC(=O)/C=C/c1ccccc1C#N)c1ccc(F)cc1	ZINC000807703518	1317578397	/nfs/dbraw/zinc/57/83/97/1317578397.db2.gz	IWZXOTQCJZYQST-VSRDTVRMSA-N	0	3	337.398	3.130	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H]2C)cc1	ZINC000807738233	1317581637	/nfs/dbraw/zinc/58/16/37/1317581637.db2.gz	CBVOPSPBVVIDIE-DYESRHJHSA-N	0	3	348.446	3.091	20	30		EGEDHN
C[C@@]1(C(=O)N[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)CC=CCC1	ZINC001020193393	1317587380	/nfs/dbraw/zinc/58/73/80/1317587380.db2.gz	UAQIHNWXURLOOC-MBOZVWFJSA-N	0	3	341.430	3.181	20	30		EGEDHN
C[C@H](NCC1(NC(=O)OC(C)(C)C)CC1)c1ccc(C#N)cc1F	ZINC000903240178	1317680571	/nfs/dbraw/zinc/68/05/71/1317680571.db2.gz	UHXXTSWQYIIUHX-LBPRGKRZSA-N	0	3	333.407	3.405	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2nc(Cl)sc2Cl)C1	ZINC001020463883	1317708594	/nfs/dbraw/zinc/70/85/94/1317708594.db2.gz	MCJVVJGQYPIFCB-LJGSYFOKSA-N	0	3	340.663	3.053	20	30		EGEDHN
C[C@@H]1CC[C@@H](CC(=O)N[C@H]2C[C@H](NCc3ccc(C#N)cc3F)C2)C1	ZINC001020482546	1317718011	/nfs/dbraw/zinc/71/80/11/1317718011.db2.gz	GPVYUBJLVVSNSR-DTTOXWODSA-N	0	3	343.446	3.260	20	30		EGEDHN
C[C@H]1CCC[C@H](C(=O)N[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)C1	ZINC001020524766	1317744246	/nfs/dbraw/zinc/74/42/46/1317744246.db2.gz	ZWHVWUDSXXDKIT-IKICRFKJSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C[C@@H](CC)Cc1nc(-c2ccc(N3CCCN(C)CC3)nc2)no1	ZINC000904000243	1317765139	/nfs/dbraw/zinc/76/51/39/1317765139.db2.gz	YGJJQRCEZVIGLV-HNNXBMFYSA-N	0	3	341.459	3.028	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(O)Cc2cccc3ccccc32)CC1	ZINC000904168531	1317802297	/nfs/dbraw/zinc/80/22/97/1317802297.db2.gz	FGAXEWNUERFSNP-UHFFFAOYSA-N	0	3	339.439	3.391	20	30		EGEDHN
C#Cc1ccc(CN2CCC(NC(=O)c3ccc(F)cc3)CC2)cc1	ZINC000809545337	1317828597	/nfs/dbraw/zinc/82/85/97/1317828597.db2.gz	ZULPHVCYFHIBJS-UHFFFAOYSA-N	0	3	336.410	3.201	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)[C@H]2CCCC[C@@H]2CC)C1	ZINC001020843481	1317951426	/nfs/dbraw/zinc/95/14/26/1317951426.db2.gz	HOFUYXDTYYQADA-AJNGGQMLSA-N	0	3	343.309	3.348	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NC1C[C@H]2CC[C@@H](C1)N2C[C@@H](F)CC	ZINC001021447385	1318257333	/nfs/dbraw/zinc/25/73/33/1318257333.db2.gz	KQEHPRHPBMGKMT-UMQXSMKFSA-N	0	3	342.458	3.070	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)CCC2CC2)cc1F	ZINC000959930070	1318270597	/nfs/dbraw/zinc/27/05/97/1318270597.db2.gz	XULKMVAGQIETCJ-SFHVURJKSA-N	0	3	343.446	3.358	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@H](CCCN3C(=O)c3ccco3)C2)cc1	ZINC001021492974	1318292984	/nfs/dbraw/zinc/29/29/84/1318292984.db2.gz	OCZOHHBPSPHRDA-MOPGFXCFSA-N	0	3	349.434	3.278	20	30		EGEDHN
CC(F)(F)C(=O)N1CCC[C@@H]2CN(Cc3ccc(C#N)cc3)CC[C@@H]21	ZINC001021502691	1318314328	/nfs/dbraw/zinc/31/43/28/1318314328.db2.gz	OOBUYNUBEDFKIS-SJORKVTESA-N	0	3	347.409	3.026	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@@H](CCCN3C(=O)c3ccc[nH]3)C2)c1	ZINC001021519370	1318346979	/nfs/dbraw/zinc/34/69/79/1318346979.db2.gz	NIQRUBURQYCLQW-AZUAARDMSA-N	0	3	348.450	3.013	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc(Cl)o1	ZINC000960256238	1318432359	/nfs/dbraw/zinc/43/23/59/1318432359.db2.gz	YBKDBPRMSHWVHD-RHSMWYFYSA-N	0	3	330.815	3.495	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)C1(c2ccccn2)CC1	ZINC000960267200	1318435975	/nfs/dbraw/zinc/43/59/75/1318435975.db2.gz	KSMAGJMZEYLOQH-UYAOXDASSA-N	0	3	347.462	3.061	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1scnc1C(F)F	ZINC000960280538	1318442573	/nfs/dbraw/zinc/44/25/73/1318442573.db2.gz	FRRZJLVNGFQSTO-CHWSQXEVSA-N	0	3	349.406	3.252	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)Cc1cc(F)ccc1F	ZINC000960298568	1318449591	/nfs/dbraw/zinc/44/95/91/1318449591.db2.gz	BKRGTCBOWQOABU-UYAOXDASSA-N	0	3	342.389	3.065	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(C)c(F)cc2F)C1	ZINC001021609893	1318456190	/nfs/dbraw/zinc/45/61/90/1318456190.db2.gz	BDKLWGUHJUUTEZ-DNVCBOLYSA-N	0	3	346.421	3.223	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)C1(c2ccccc2)CC1	ZINC000960331689	1318466079	/nfs/dbraw/zinc/46/60/79/1318466079.db2.gz	XSFLDNUHMDPASA-WOJBJXKFSA-N	0	3	332.447	3.276	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cn(C)c3ccccc23)C1	ZINC001021628481	1318481668	/nfs/dbraw/zinc/48/16/68/1318481668.db2.gz	WLVOPCMCVWTRCB-FXAWDEMLSA-N	0	3	349.478	3.128	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)CCc2ccc(C)cc2)C1	ZINC001021629544	1318483373	/nfs/dbraw/zinc/48/33/73/1318483373.db2.gz	HGRAHIPINVQUPU-RTWAWAEBSA-N	0	3	338.495	3.264	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)Cc2cccc(C(F)F)c2)C1	ZINC001021633335	1318487498	/nfs/dbraw/zinc/48/74/98/1318487498.db2.gz	QINHUPHJYOZPQT-MSOLQXFVSA-N	0	3	346.421	3.113	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cnc3ccccc3c2C)C1	ZINC001021637219	1318493533	/nfs/dbraw/zinc/49/35/33/1318493533.db2.gz	ZHBJDLUKKXYXTM-LAUBAEHRSA-N	0	3	347.462	3.103	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc3cc(C)ccc3[nH]2)C1	ZINC001021646885	1318504267	/nfs/dbraw/zinc/50/42/67/1318504267.db2.gz	SXWYOMHDTVCTNB-OXQOHEQNSA-N	0	3	335.451	3.036	20	30		EGEDHN
Cc1ccc(C(=O)N2CCC[C@@H]2CN(C)Cc2ccc(C#N)cc2)o1	ZINC000960391103	1318517304	/nfs/dbraw/zinc/51/73/04/1318517304.db2.gz	LXCVQVCAYXAZBR-GOSISDBHSA-N	0	3	337.423	3.196	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(C(C)(C)C)oc2C)C1	ZINC001021679910	1318551247	/nfs/dbraw/zinc/55/12/47/1318551247.db2.gz	USELUGOLCJBDFQ-SJLPKXTDSA-N	0	3	342.483	3.445	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(C(CC)CC)no2)C1	ZINC001021686391	1318560579	/nfs/dbraw/zinc/56/05/79/1318560579.db2.gz	YIMUQKMOBFUMRQ-FUHWJXTLSA-N	0	3	343.471	3.138	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2oc(CC)cc2C)C1	ZINC001021717011	1318597976	/nfs/dbraw/zinc/59/79/76/1318597976.db2.gz	NPHIGLHIZQZTKE-AEFFLSMTSA-N	0	3	328.456	3.100	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(CC)c(CC)o2)C1	ZINC001021718341	1318600055	/nfs/dbraw/zinc/60/00/55/1318600055.db2.gz	WWWZWUCGDIIDDI-ROUUACIJSA-N	0	3	342.483	3.354	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC[C@H]1CN(C)Cc1cc2ccccc2o1	ZINC000960498067	1318606902	/nfs/dbraw/zinc/60/69/02/1318606902.db2.gz	CGGRGMGRCDVVRK-HOCLYGCPSA-N	0	3	325.412	3.015	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2occ3c2CCCC3)C1	ZINC001021723463	1318613445	/nfs/dbraw/zinc/61/34/45/1318613445.db2.gz	UVXBWQXDRXOAAH-VQIMIIECSA-N	0	3	340.467	3.108	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(C)c3c2CCC3)C1	ZINC001021742055	1318654734	/nfs/dbraw/zinc/65/47/34/1318654734.db2.gz	BNRIUXVUTZPNGF-UTKZUKDTSA-N	0	3	336.479	3.043	20	30		EGEDHN
Cc1cc(C(=O)N2CCC[C@H]2CN(C)Cc2ccc(C#N)cc2)co1	ZINC000960589703	1318720298	/nfs/dbraw/zinc/72/02/98/1318720298.db2.gz	LGEIIULBGZFATH-IBGZPJMESA-N	0	3	337.423	3.196	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@@H](NC(=O)C(F)=C3CCCC3)C2)c1	ZINC001021963917	1318752358	/nfs/dbraw/zinc/75/23/58/1318752358.db2.gz	KORNHAZOMGDPKH-IYBDPMFKSA-N	0	3	345.393	3.232	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)Nc1ccc2c(c1)NC(=O)CO2	ZINC000912068190	1318800872	/nfs/dbraw/zinc/80/08/72/1318800872.db2.gz	LPYINYGVOONOED-AWEZNQCLSA-N	0	3	333.432	3.034	20	30		EGEDHN
CN(C)Cc1c2ccccc2oc1C(=O)NCCC#C[Si](C)(C)C	ZINC000912332586	1318872369	/nfs/dbraw/zinc/87/23/69/1318872369.db2.gz	USKSIVQZHWTWAE-UHFFFAOYSA-N	0	3	342.515	3.495	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cc3c([nH]2)c(F)ccc3C)C1	ZINC001022334808	1318897703	/nfs/dbraw/zinc/89/77/03/1318897703.db2.gz	XVJMLRSNKSGZHM-TXEJJXNPSA-N	0	3	335.810	3.218	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)[C@@]1(C)C=CCC1	ZINC000960792970	1318900975	/nfs/dbraw/zinc/90/09/75/1318900975.db2.gz	SHMSIRAEAOATRL-CTNGQTDRSA-N	0	3	337.467	3.337	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2[nH]c3ccccc3c2Cl)C1	ZINC001022363612	1318906474	/nfs/dbraw/zinc/90/64/74/1318906474.db2.gz	UJQMAYHLUMRTEM-PHIMTYICSA-N	0	3	338.238	3.424	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)Cc2ccc(C(F)F)cc2)C1	ZINC001022422443	1318933991	/nfs/dbraw/zinc/93/39/91/1318933991.db2.gz	KIOOGJSIVUDBTQ-OKILXGFUSA-N	0	3	328.790	3.156	20	30		EGEDHN
C[C@@H]1CC[C@@H](CC(=O)N[C@H]2C[C@@H](NCc3ccc(C#N)cc3F)C2)C1	ZINC001022563364	1318993028	/nfs/dbraw/zinc/99/30/28/1318993028.db2.gz	GPVYUBJLVVSNSR-DTDBQYNISA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N1CCC[C@H]1CN(C)Cc1csc(C)c1	ZINC000960881587	1319018212	/nfs/dbraw/zinc/01/82/12/1319018212.db2.gz	GMCYTEUGQIDEHN-KSZLIROESA-N	0	3	348.512	3.070	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)Cc2ccc(F)cc2Cl)C1	ZINC001022648967	1319041167	/nfs/dbraw/zinc/04/11/67/1319041167.db2.gz	VZHHBKVZLVUYNV-BETUJISGSA-N	0	3	331.218	3.011	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)[C@H]1CC12CCC2	ZINC000960913778	1319061073	/nfs/dbraw/zinc/06/10/73/1319061073.db2.gz	SFQNVNROJJPQJR-RTBURBONSA-N	0	3	337.467	3.171	20	30		EGEDHN
CC[C@@H](NC(=O)C(C#N)C(=O)CCc1cncs1)c1ccccc1	ZINC000816038567	1319091932	/nfs/dbraw/zinc/09/19/32/1319091932.db2.gz	ATARHBMBCZFDMR-HZPDHXFCSA-N	0	3	341.436	3.052	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)[C@@H]2CCCC[C@H]2CC)C1	ZINC001022904214	1319155999	/nfs/dbraw/zinc/15/59/99/1319155999.db2.gz	HOFUYXDTYYQADA-APIJFGDWSA-N	0	3	343.309	3.348	20	30		EGEDHN
Cc1cc(C#N)cnc1C(=O)O[C@@H]1CCCN(Cc2ccccc2)[C@H]1C	ZINC000816471805	1319161062	/nfs/dbraw/zinc/16/10/62/1319161062.db2.gz	NJPDWQHRAGAJBA-QFBILLFUSA-N	0	3	349.434	3.472	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2[nH]c3ccc(C)cc3c2C)C1	ZINC001022920642	1319171142	/nfs/dbraw/zinc/17/11/42/1319171142.db2.gz	IKGUTNACRYAWLJ-OKILXGFUSA-N	0	3	331.847	3.388	20	30		EGEDHN
CCCC(=O)N1CCC[C@H]([C@@H]2CCN(CC#Cc3ccccc3)C2)C1	ZINC000961101313	1319211203	/nfs/dbraw/zinc/21/12/03/1319211203.db2.gz	RVCXLHYSCCZAHM-LEWJYISDSA-N	0	3	338.495	3.399	20	30		EGEDHN
CC(C)C(=O)N1CCC[C@@H]([C@@H]2CCN(Cc3ccccc3C#N)C2)C1	ZINC000961132645	1319247501	/nfs/dbraw/zinc/24/75/01/1319247501.db2.gz	FEUJHMQVDRWYGQ-WOJBJXKFSA-N	0	3	339.483	3.275	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]([C@@H]2CCN(Cc3cncs3)C2)C1	ZINC000961229164	1319357501	/nfs/dbraw/zinc/35/75/01/1319357501.db2.gz	LQJZRGXJJVXPQT-HZPDHXFCSA-N	0	3	347.528	3.416	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@H](CNC(=O)[C@H]3CC=CCC3)C2)c1	ZINC001023230341	1319370083	/nfs/dbraw/zinc/37/00/83/1319370083.db2.gz	TVBZUPYZXBYCJA-PMACEKPBSA-N	0	3	337.467	3.243	20	30		EGEDHN
N#Cc1cc(C(=O)NC[C@@H]2CCCN(C/C=C/c3ccccc3)C2)c[nH]1	ZINC001023314398	1319439351	/nfs/dbraw/zinc/43/93/51/1319439351.db2.gz	LKFPAAFFRAKTQU-PYJQOMOHSA-N	0	3	348.450	3.042	20	30		EGEDHN
CC(=O)N1CCC([C@@H]2CCCN(CC#Cc3ccc(F)cc3)C2)CC1	ZINC000961296598	1319460217	/nfs/dbraw/zinc/46/02/17/1319460217.db2.gz	HZNBBKQHRHYWFG-HXUWFJFHSA-N	0	3	342.458	3.148	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@@H]1CCCN(CCC(F)(F)F)C1	ZINC001023416356	1319519923	/nfs/dbraw/zinc/51/99/23/1319519923.db2.gz	XXBQHQVMTYSMDR-AWEZNQCLSA-N	0	3	343.393	3.068	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@@H]2CCCN(C[C@@H](F)CC)C2)cc1	ZINC001023448814	1319549319	/nfs/dbraw/zinc/54/93/19/1319549319.db2.gz	YQXIRIQEQCPEKM-WMZOPIPTSA-N	0	3	348.462	3.441	20	30		EGEDHN
C#CCN1CCC[C@@H](CNC(=O)c2cc3cccc(C)c3s2)C1	ZINC001023449101	1319551078	/nfs/dbraw/zinc/55/10/78/1319551078.db2.gz	HLQQFMGVDCRZFV-HNNXBMFYSA-N	0	3	326.465	3.285	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)C2CCc3ccccc3CC2)C1	ZINC001023455801	1319559482	/nfs/dbraw/zinc/55/94/82/1319559482.db2.gz	RKYXWYBOOCDHBJ-SFHVURJKSA-N	0	3	338.495	3.033	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2csc(C(F)(F)F)c2)C1	ZINC001023465466	1319562471	/nfs/dbraw/zinc/56/24/71/1319562471.db2.gz	SPPZKKKZBJWEPS-GFCCVEGCSA-N	0	3	344.402	3.232	20	30		EGEDHN
C#CCN(C)CCCNC(=O)C[C@H](C)c1ccc(C(F)(F)F)cc1	ZINC000818583995	1319563677	/nfs/dbraw/zinc/56/36/77/1319563677.db2.gz	ACBRNDHDSXOQSX-AWEZNQCLSA-N	0	3	340.389	3.270	20	30		EGEDHN
CC(C)[C@@H](NC[C@@H](O)c1ccc(C#N)cc1)c1nc2ccccc2[nH]1	ZINC000818947683	1319585787	/nfs/dbraw/zinc/58/57/87/1319585787.db2.gz	QOLKNCZOZZIPTG-RTBURBONSA-N	0	3	334.423	3.455	20	30		EGEDHN
COC(=O)[C@@H]1C[C@@H]2[C@@H](CC[C@@H](C)N2CCCCC2(C#N)CCC2)O1	ZINC000930350380	1328839599	/nfs/dbraw/zinc/83/95/99/1328839599.db2.gz	GYFWBYQELYQHDS-VQHPVUNQSA-N	0	3	334.460	3.034	20	30		EGEDHN
CC[C@@H](C#N)Oc1cccc(CNC[C@@H](O)c2c(F)cccc2F)c1	ZINC000819067466	1319626533	/nfs/dbraw/zinc/62/65/33/1319626533.db2.gz	LFISQURPCMWMDI-KBXCAEBGSA-N	0	3	346.377	3.469	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2[C@H]3CN(Cc4ccc(CF)cc4)C[C@H]32)CC1	ZINC000961681151	1319695615	/nfs/dbraw/zinc/69/56/15/1319695615.db2.gz	YTCJYJNEMBZPJB-PMOLBWCYSA-N	0	3	342.458	3.449	20	30		EGEDHN
Cc1nccc([C@H]2CCCN(CCCOc3ccc(C#N)cc3)C2)n1	ZINC000916741920	1319702768	/nfs/dbraw/zinc/70/27/68/1319702768.db2.gz	MMNYVOVCAFQSJR-SFHVURJKSA-N	0	3	336.439	3.305	20	30		EGEDHN
N#CC(C(=O)COc1ccc(F)cc1)C(=O)Nc1ccc(Cl)cc1	ZINC000916882747	1319720218	/nfs/dbraw/zinc/72/02/18/1319720218.db2.gz	JRYWZPGWAZILRY-OAHLLOKOSA-N	0	3	346.745	3.205	20	30		EGEDHN
C=CCN(Cc1ccccc1)C[C@H](O)c1cc(OC)ccc1OC	ZINC000917001399	1319734603	/nfs/dbraw/zinc/73/46/03/1319734603.db2.gz	QDMRUTYHKABAET-IBGZPJMESA-N	0	3	327.424	3.425	20	30		EGEDHN
C[C@H](C(=O)NC1CC(CNCc2cc(C#N)ccc2F)C1)C1CCC1	ZINC000961982507	1319790109	/nfs/dbraw/zinc/79/01/09/1319790109.db2.gz	PREJDGIHVIYYJX-UQHVZDHRSA-N	0	3	343.446	3.118	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cccc(-c3ccoc3)c2)C1	ZINC001023693626	1319817820	/nfs/dbraw/zinc/81/78/20/1319817820.db2.gz	ZTEUMAXIYWQVIB-QGZVFWFLSA-N	0	3	336.435	3.412	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2cc3c(s2)CCCCC3)C1	ZINC001023733340	1319873408	/nfs/dbraw/zinc/87/34/08/1319873408.db2.gz	HXFVRCCHWUNBRY-MRXNPFEDSA-N	0	3	344.524	3.482	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2csc3c2CC[C@@H](C)C3)C1	ZINC001023734187	1319875415	/nfs/dbraw/zinc/87/54/15/1319875415.db2.gz	XOZMAOAXXDNJQT-CVEARBPZSA-N	0	3	344.524	3.338	20	30		EGEDHN
C#CCN1CCC[C@H](CNC(=O)c2cc3c(cccc3F)s2)C1	ZINC001023738873	1319884263	/nfs/dbraw/zinc/88/42/63/1319884263.db2.gz	JWPUNEKROCCXKO-CYBMUJFWSA-N	0	3	330.428	3.115	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc3c(s2)CC[C@H](C)C3)C1	ZINC001023742656	1319889719	/nfs/dbraw/zinc/88/97/19/1319889719.db2.gz	JWXIOZDAWKEWGO-HOTGVXAUSA-N	0	3	344.524	3.338	20	30		EGEDHN
C=CCN1CCC[C@@H](CNC(=O)c2sc(Cl)nc2Cl)C1	ZINC001023751141	1319897434	/nfs/dbraw/zinc/89/74/34/1319897434.db2.gz	CIYWRUFXKXDQOE-VIFPVBQESA-N	0	3	334.272	3.078	20	30		EGEDHN
Cc1occc1C(=O)N1CCC[C@H](CNCc2ccccc2C#N)C1	ZINC001023831711	1319975615	/nfs/dbraw/zinc/97/56/15/1319975615.db2.gz	QBWDHDVOVAEQQD-MRXNPFEDSA-N	0	3	337.423	3.102	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCN(C(=O)[C@H]2CC=CCC2)C1	ZINC001023837435	1319979688	/nfs/dbraw/zinc/97/96/88/1319979688.db2.gz	WQVMULNQQZKBRW-ROUUACIJSA-N	0	3	337.467	3.243	20	30		EGEDHN
C=CCS(=O)(=O)CCNCc1ccccc1-c1ccccc1C	ZINC000824142180	1320232307	/nfs/dbraw/zinc/23/23/07/1320232307.db2.gz	LHTKIZNAZLXEFD-UHFFFAOYSA-N	0	3	329.465	3.352	20	30		EGEDHN
C=CCC[C@H](CO)[NH2+]Cc1ccc(OCc2ccccc2)cc1[O-]	ZINC000825168109	1320316374	/nfs/dbraw/zinc/31/63/74/1320316374.db2.gz	DOUAJHZVIXNZTQ-GOSISDBHSA-N	0	3	327.424	3.388	20	30		EGEDHN
C#Cc1cnc(NC[C@@H](c2ccccc2OC)N2CCCCC2)nc1	ZINC000827425062	1320452259	/nfs/dbraw/zinc/45/22/59/1320452259.db2.gz	GNHYECXEUYKXLP-SFHVURJKSA-N	0	3	336.439	3.106	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N[C@@H](C)c1ccccc1C(F)(F)F	ZINC000836252005	1320464977	/nfs/dbraw/zinc/46/49/77/1320464977.db2.gz	FFQMJJNXVYKICB-ZDUSSCGKSA-N	0	3	341.377	3.021	20	30		EGEDHN
C=CCCCCOC(=O)c1ccc(CN2CCC(CO)CC2)cc1	ZINC000837679998	1320666136	/nfs/dbraw/zinc/66/61/36/1320666136.db2.gz	ALUXMBREXKXONV-UHFFFAOYSA-N	0	3	331.456	3.404	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1ccc(OC2CCCC2)cc1	ZINC000838624089	1320796136	/nfs/dbraw/zinc/79/61/36/1320796136.db2.gz	GNJQOZXUHJWINW-UHFFFAOYSA-N	0	3	329.444	3.085	20	30		EGEDHN
CCCCCCCOc1cccc(CN2CC[C@H](O)[C@@H](CO)C2)c1	ZINC000840975303	1321192766	/nfs/dbraw/zinc/19/27/66/1321192766.db2.gz	MZQQZRWAQWYPIM-QUCCMNQESA-N	0	3	335.488	3.211	20	30		EGEDHN
CC[C@@H](OC1CCCC1)C(=O)C(C#N)C(=O)Nc1ccccc1OC	ZINC000842289529	1321367823	/nfs/dbraw/zinc/36/78/23/1321367823.db2.gz	QROKRELVTKJGAE-GDBMZVCRSA-N	0	3	344.411	3.080	20	30		EGEDHN
C[C@@H](NC(=O)CC(C)(C)C)C(=O)C(C#N)c1nc(C2CC2)cs1	ZINC000842947179	1321453060	/nfs/dbraw/zinc/45/30/60/1321453060.db2.gz	ZKGZQUCBUPXPJX-PWSUYJOCSA-N	0	3	333.457	3.138	20	30		EGEDHN
CCOCCCC(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847745672	1321899557	/nfs/dbraw/zinc/89/95/57/1321899557.db2.gz	MDYZIENZFNIFSV-UHFFFAOYSA-N	0	3	344.455	3.152	20	30		EGEDHN
N#CC1(COC(=O)[C@H]2C[C@@H]2C2CC2)CCN(Cc2ccccc2)CC1	ZINC000847746991	1321900672	/nfs/dbraw/zinc/90/06/72/1321900672.db2.gz	VAWMLGRDCVRAII-MOPGFXCFSA-N	0	3	338.451	3.382	20	30		EGEDHN
N#CCSc1ccccc1C(=O)N[C@@H]1CCCN2CCCC[C@@H]12	ZINC000848349451	1321953274	/nfs/dbraw/zinc/95/32/74/1321953274.db2.gz	IDHJGVLTJXUSNK-CVEARBPZSA-N	0	3	329.469	3.049	20	30		EGEDHN
C[C@@H](C(=O)NC1CC(CNCc2ccccc2C#N)C1)C1CCCC1	ZINC000962518583	1321982978	/nfs/dbraw/zinc/98/29/78/1321982978.db2.gz	IKRZUDNDLGVRLH-LSWWBPAMSA-N	0	3	339.483	3.369	20	30		EGEDHN
[O-]c1ccc(Cl)cc1/C=N\CC1CC[NH+](C2CCOCC2)CC1	ZINC000849169307	1322093453	/nfs/dbraw/zinc/09/34/53/1322093453.db2.gz	DUBIZCLCVSLMCV-MOSHPQCFSA-N	0	3	336.863	3.356	20	30		EGEDHN
CCO[C@H](CC)C(=O)C(C#N)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000920111029	1322137901	/nfs/dbraw/zinc/13/79/01/1322137901.db2.gz	IERGFFCDGKGMOR-QWHCGFSZSA-N	0	3	343.210	3.456	20	30		EGEDHN
CCc1cccc(CC)c1NC(=O)C(C#N)C(=O)[C@H](C)OCC1CC1	ZINC000920789813	1322222583	/nfs/dbraw/zinc/22/25/83/1322222583.db2.gz	GNAJWDMWJDVBHZ-GUYCJALGSA-N	0	3	342.439	3.274	20	30		EGEDHN
C[C@H](NCc1ccc(N2CCCNC2=O)cc1)c1cccc(C#N)c1	ZINC000850574587	1322270899	/nfs/dbraw/zinc/27/08/99/1322270899.db2.gz	GZJOAJZCBYRJTG-HNNXBMFYSA-N	0	3	334.423	3.329	20	30		EGEDHN
C[C@H](CC(C)(C)C#N)OC(=O)C1CCN(c2ccc(F)cc2)C1=O	ZINC000851210938	1323002127	/nfs/dbraw/zinc/00/21/27/1323002127.db2.gz	WEXMKPQXJZUHGV-IUODEOHRSA-N	0	3	332.375	3.050	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@@H]1CCCN(C(=O)C=C2CCC2)C1	ZINC001023927846	1323034144	/nfs/dbraw/zinc/03/41/44/1323034144.db2.gz	HCXVMLXZGFEIQS-INIZCTEOSA-N	0	3	341.430	3.136	20	30		EGEDHN
C[C@@H](NC[C@H]1CCCN(C(=O)C#CC2CC2)C1)c1c(F)cccc1F	ZINC001023980980	1323062785	/nfs/dbraw/zinc/06/27/85/1323062785.db2.gz	GAAGQMXUJIDTHN-GDBMZVCRSA-N	0	3	346.421	3.267	20	30		EGEDHN
C#CCOCCN[C@H](Cn1cnc2ccccc21)c1ccc(F)cc1	ZINC000851921663	1323115046	/nfs/dbraw/zinc/11/50/46/1323115046.db2.gz	YLVVADHSDOAWKT-LJQANCHMSA-N	0	3	337.398	3.156	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H](CNCc2cc(C3CC3)no2)C1	ZINC001024090423	1323123102	/nfs/dbraw/zinc/12/31/02/1323123102.db2.gz	HYAUAPZPMMPUTK-HNNXBMFYSA-N	0	3	345.487	3.483	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](CNCc2csc(CC)n2)C1	ZINC001024092927	1323124267	/nfs/dbraw/zinc/12/42/67/1323124267.db2.gz	LJYSRTOSWSTHOO-AWEZNQCLSA-N	0	3	335.517	3.246	20	30		EGEDHN
C[C@@]1(C(=O)N2CCC[C@@H](CNCc3ccccc3C#N)C2)C=CCC1	ZINC001024105314	1323137819	/nfs/dbraw/zinc/13/78/19/1323137819.db2.gz	IBGAWKYUEJRHKJ-LAUBAEHRSA-N	0	3	337.467	3.243	20	30		EGEDHN
CC(C)[C@H](F)C(=O)N1CCC[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001024107741	1323140158	/nfs/dbraw/zinc/14/01/58/1323140158.db2.gz	WHVCRIYYPKCXTH-KDOFPFPSSA-N	0	3	349.425	3.020	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC[C@@H](CN[C@@H](C)c3cnccn3)C2)CC1	ZINC001024133797	1323158211	/nfs/dbraw/zinc/15/82/11/1323158211.db2.gz	OQMNTGAHJGLZTB-IRXDYDNUSA-N	0	3	342.487	3.112	20	30		EGEDHN
C=CCC[N@H+]1CCC[C@@H]1[C@@H]1CCCN(C(=O)c2ccccc2[O-])C1	ZINC000963252457	1323263063	/nfs/dbraw/zinc/26/30/63/1323263063.db2.gz	WBWMSUNDVPHEGL-SJLPKXTDSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=CCC[N@@H+]1CCC[C@@H]1[C@@H]1CCCN(C(=O)c2ccccc2[O-])C1	ZINC000963252457	1323263069	/nfs/dbraw/zinc/26/30/69/1323263069.db2.gz	WBWMSUNDVPHEGL-SJLPKXTDSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)c2cccn2C)C1	ZINC000963258080	1323266912	/nfs/dbraw/zinc/26/69/12/1323266912.db2.gz	CAYZLCSEZTUHHK-HOTGVXAUSA-N	0	3	335.879	3.094	20	30		EGEDHN
C=CCCN1CCCC[C@@H]1CNC(=O)c1cnc([C@H](C)OC)s1	ZINC001024439586	1323402490	/nfs/dbraw/zinc/40/24/90/1323402490.db2.gz	CWEOEHDBLUZDNV-UONOGXRCSA-N	0	3	337.489	3.011	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1cc(C(F)F)ccc1F	ZINC001024442854	1323403941	/nfs/dbraw/zinc/40/39/41/1323403941.db2.gz	ZRHUWBWFKSGMAE-AWEZNQCLSA-N	0	3	338.373	3.371	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cn(-c2ccccc2)cn1	ZINC001024452330	1323408308	/nfs/dbraw/zinc/40/83/08/1323408308.db2.gz	JBCKOUQHIPTRTN-SFHVURJKSA-N	0	3	338.455	3.033	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1cccc(OCCC)c1	ZINC001024466619	1323421533	/nfs/dbraw/zinc/42/15/33/1323421533.db2.gz	IHKFONAKCLDOHD-GOSISDBHSA-N	0	3	328.456	3.083	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccccc1-c1cn[nH]c1	ZINC001024467651	1323422746	/nfs/dbraw/zinc/42/27/46/1323422746.db2.gz	JFQTWBNKYYCLTC-KRWDZBQOSA-N	0	3	338.455	3.237	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cnn2c1ccc(C)c2C	ZINC001024488333	1323440528	/nfs/dbraw/zinc/44/05/28/1323440528.db2.gz	XEFAFPQJCOQFBH-QGZVFWFLSA-N	0	3	340.471	3.112	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cc(C)n([C@@H](C)C2CC2)n1	ZINC001024518006	1323467056	/nfs/dbraw/zinc/46/70/56/1323467056.db2.gz	DYMXZRBUMFZAOO-FUHWJXTLSA-N	0	3	344.503	3.323	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cc(C(C)C)nn1CC	ZINC001024528816	1323475656	/nfs/dbraw/zinc/47/56/56/1323475656.db2.gz	MTSKWBNXILOXBJ-MRXNPFEDSA-N	0	3	332.492	3.187	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@H]1CCc2ccccc2C1	ZINC001024681985	1323596650	/nfs/dbraw/zinc/59/66/50/1323596650.db2.gz	UZNMQJPZRAGYJB-PMACEKPBSA-N	0	3	326.484	3.338	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@H]1CCc2cccc(OC)c21	ZINC001024696325	1323613144	/nfs/dbraw/zinc/61/31/44/1323613144.db2.gz	GHEQGYVLHKEFER-ROUUACIJSA-N	0	3	342.483	3.272	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCCCN2Cc2cccc(C)c2)nc1	ZINC001024763518	1323664114	/nfs/dbraw/zinc/66/41/14/1323664114.db2.gz	HRUIFZRDZCEEIO-HXUWFJFHSA-N	0	3	347.462	3.156	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccc(COC(C)C)cc1	ZINC001024793803	1323698990	/nfs/dbraw/zinc/69/89/90/1323698990.db2.gz	CHKDXTAGKBMOAP-HXUWFJFHSA-N	0	3	342.483	3.219	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)[C@H]2CC=CCC2)s1	ZINC001024865398	1323755781	/nfs/dbraw/zinc/75/57/81/1323755781.db2.gz	VFXFBWFXPGUVLQ-JKSUJKDBSA-N	0	3	343.496	3.447	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCCC[C@@H]1CNCc1cc(C#N)ccc1OC	ZINC001024875531	1323761137	/nfs/dbraw/zinc/76/11/37/1323761137.db2.gz	YZMWMZIMEDXTFZ-MAUKXSAKSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CCCC[C@H]1CNCc1ccccn1	ZINC001024973862	1323807125	/nfs/dbraw/zinc/80/71/25/1323807125.db2.gz	APNVAUXQXUMCCS-INIZCTEOSA-N	0	3	335.879	3.331	20	30		EGEDHN
CC1(CC(=O)N2CCCC[C@@H]2CNCc2ccc(C#N)cc2F)CC1	ZINC001025021404	1323829297	/nfs/dbraw/zinc/82/92/97/1323829297.db2.gz	LRPXJDURZQHPOF-QGZVFWFLSA-N	0	3	343.446	3.358	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc(F)cc1	ZINC001025190783	1323970194	/nfs/dbraw/zinc/97/01/94/1323970194.db2.gz	AZFVRUCXRFOAEL-RBUKOAKNSA-N	0	3	328.431	3.308	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(CC)ccn1	ZINC001025232031	1324019115	/nfs/dbraw/zinc/01/91/15/1324019115.db2.gz	JZKLQNNDYHIPAV-RTBURBONSA-N	0	3	327.472	3.289	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1conc1C(C)C	ZINC001025236098	1324025143	/nfs/dbraw/zinc/02/51/43/1324025143.db2.gz	DGAWWRNUDBHAHW-IAGOWNOFSA-N	0	3	331.460	3.443	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)Cc1c(C)cccc1C	ZINC001025236129	1324025351	/nfs/dbraw/zinc/02/53/51/1324025351.db2.gz	DIIGEUQKBQXOND-NHCUHLMSSA-N	0	3	338.495	3.325	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc(F)c(F)c1	ZINC001025241038	1324034702	/nfs/dbraw/zinc/03/47/02/1324034702.db2.gz	SVYMYFUCIOYDEC-MOPGFXCFSA-N	0	3	346.421	3.447	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cccc2cccnc21	ZINC001025247520	1324047907	/nfs/dbraw/zinc/04/79/07/1324047907.db2.gz	LRKMSUZGXXKYCK-UXHICEINSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(C)ccc1OC	ZINC001025252561	1324057220	/nfs/dbraw/zinc/05/72/20/1324057220.db2.gz	XYERBQRXKHPHNE-MOPGFXCFSA-N	0	3	340.467	3.096	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cc(C(C)C)on1	ZINC001025255476	1324063212	/nfs/dbraw/zinc/06/32/12/1324063212.db2.gz	QTDCKNIFKNAADG-IAGOWNOFSA-N	0	3	331.460	3.443	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)C1CC2(CCC2)C1	ZINC001025257835	1324065717	/nfs/dbraw/zinc/06/57/17/1324065717.db2.gz	AJQNBJAVCPAUNW-OALUTQOASA-N	0	3	328.500	3.436	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cccc(F)c1F	ZINC001025258817	1324068117	/nfs/dbraw/zinc/06/81/17/1324068117.db2.gz	JFNSGWJUOAFZRM-ROUUACIJSA-N	0	3	346.421	3.447	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc(F)c(C)c1	ZINC001025261896	1324074078	/nfs/dbraw/zinc/07/40/78/1324074078.db2.gz	YZLHMNPRDNZCTE-RTBURBONSA-N	0	3	328.431	3.226	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cncc(Cl)c1	ZINC001025276273	1324098241	/nfs/dbraw/zinc/09/82/41/1324098241.db2.gz	IMUKBBXAMSOHJP-IRXDYDNUSA-N	0	3	333.863	3.380	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc(C)nc1OC	ZINC001025277801	1324099803	/nfs/dbraw/zinc/09/98/03/1324099803.db2.gz	PQYZEFDYPUJKJQ-ZWKOTPCHSA-N	0	3	343.471	3.044	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc2ccn(C)c2c1	ZINC001025288134	1324111006	/nfs/dbraw/zinc/11/10/06/1324111006.db2.gz	RYOAEDJUJKCRAA-VQTJNVASSA-N	0	3	349.478	3.271	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)C1(c2ccccc2)CC1	ZINC001025295454	1324125896	/nfs/dbraw/zinc/12/58/96/1324125896.db2.gz	FZUQDJFPQCIXQO-VQTJNVASSA-N	0	3	336.479	3.197	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)Cc1cccc(F)c1	ZINC001025297085	1324129387	/nfs/dbraw/zinc/12/93/87/1324129387.db2.gz	OBWLYWOKPZNYRH-UXHICEINSA-N	0	3	342.458	3.237	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ncccc1OCC	ZINC001025303507	1324137541	/nfs/dbraw/zinc/13/75/41/1324137541.db2.gz	HZMAZOQERJKAAW-IAGOWNOFSA-N	0	3	343.471	3.125	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1c(C)cccc1F	ZINC001025303144	1324137739	/nfs/dbraw/zinc/13/77/39/1324137739.db2.gz	FELSNZAKUPMFCM-ZWKOTPCHSA-N	0	3	328.431	3.226	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2coc3ccc(CC)cc23)C1	ZINC001025418961	1324251591	/nfs/dbraw/zinc/25/15/91/1324251591.db2.gz	GWISYLHUTADWAE-RDJZCZTQSA-N	0	3	338.451	3.459	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(C(C)(C)C)cn2)C1	ZINC001025420288	1324254983	/nfs/dbraw/zinc/25/49/83/1324254983.db2.gz	AHGCFAUWZWKFBO-DLBZAZTESA-N	0	3	341.499	3.233	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cccc3c2CCCC3)C1	ZINC001025425948	1324260658	/nfs/dbraw/zinc/26/06/58/1324260658.db2.gz	TWSKWACAHYRMHG-IEBWSBKVSA-N	0	3	338.495	3.419	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cn(C)c3ccccc23)C1	ZINC001025480134	1324326095	/nfs/dbraw/zinc/32/60/95/1324326095.db2.gz	QEZGZLXOTRMXLL-SJORKVTESA-N	0	3	337.467	3.032	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2sccc2-n2cccc2)C1	ZINC001025493543	1324344683	/nfs/dbraw/zinc/34/46/83/1324344683.db2.gz	PAKCIQPFUXBQNX-HOTGVXAUSA-N	0	3	341.480	3.002	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(C)c(Cl)cc2C)C1	ZINC001025500591	1324349511	/nfs/dbraw/zinc/34/95/11/1324349511.db2.gz	UVDXDLCMBUWIFJ-HOTGVXAUSA-N	0	3	332.875	3.420	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cccc(Cl)c2F)C1	ZINC001025519050	1324362834	/nfs/dbraw/zinc/36/28/34/1324362834.db2.gz	JLBMBCJSZHOXRX-ZIAGYGMSSA-N	0	3	336.838	3.333	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccccc2-n2cccc2)C1	ZINC001025521655	1324365722	/nfs/dbraw/zinc/36/57/22/1324365722.db2.gz	CUAXWBJAQXIUBB-OALUTQOASA-N	0	3	349.478	3.331	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc3nc(C)ccc3c2)C1	ZINC001025564976	1324411244	/nfs/dbraw/zinc/41/12/44/1324411244.db2.gz	OBXSHFVSAUDGFV-APWZRJJASA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc3c(C)cccn3c2)C1	ZINC001025595425	1324443371	/nfs/dbraw/zinc/44/33/71/1324443371.db2.gz	OCFMLHWOHSRSBM-MSOLQXFVSA-N	0	3	337.467	3.101	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(Cl)c(Cl)c2)C1	ZINC001025607909	1324458910	/nfs/dbraw/zinc/45/89/10/1324458910.db2.gz	JFDAWZUQDOWGCG-GXTWGEPZSA-N	0	3	339.266	3.457	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(CC)c(C)s2)C1	ZINC001025614073	1324466339	/nfs/dbraw/zinc/46/63/39/1324466339.db2.gz	FZMCKIKOYQUCIR-RHSMWYFYSA-N	0	3	332.513	3.473	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2c(Cl)cccc2OC)C1	ZINC001025630095	1324482120	/nfs/dbraw/zinc/48/21/20/1324482120.db2.gz	OWRBSJJDZRVIFO-CABCVRRESA-N	0	3	348.874	3.202	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H]2CC[C@H](NCc3ncc(C)s3)[C@H]2C1	ZINC001026330912	1324731381	/nfs/dbraw/zinc/73/13/81/1324731381.db2.gz	MYQLJDXFPYKHSB-JYJNAYRXSA-N	0	3	347.528	3.380	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H]3CC[C@@H](NCc4nc(C)cs4)[C@H]3C2)C1	ZINC001026354641	1324747700	/nfs/dbraw/zinc/74/77/00/1324747700.db2.gz	BJXDIWYQEWHKHU-HRCADAONSA-N	0	3	345.512	3.134	20	30		EGEDHN
CC(C)(C)C(=O)N1C[C@@H]2CC[C@@H](NCc3cc(F)ccc3C#N)[C@H]2C1	ZINC001026406144	1324778682	/nfs/dbraw/zinc/77/86/82/1324778682.db2.gz	VHEPFISXKMZSOV-JCGIZDLHSA-N	0	3	343.446	3.070	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)NC1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001026563141	1324897575	/nfs/dbraw/zinc/89/75/75/1324897575.db2.gz	HPIHRRGBYWSZET-GPIZFROPSA-N	0	3	343.446	3.260	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)C2CCCCC2)C1	ZINC001026653937	1324953173	/nfs/dbraw/zinc/95/31/73/1324953173.db2.gz	VCUFFGRTWQYLQR-INIZCTEOSA-N	0	3	325.456	3.077	20	30		EGEDHN
C[C@@]1(C(=O)N2CC[C@@H](CNCc3ccccc3C#N)C2)CC=CCC1	ZINC001026863787	1325051501	/nfs/dbraw/zinc/05/15/01/1325051501.db2.gz	RLFVYIREWSDPGD-LAUBAEHRSA-N	0	3	337.467	3.243	20	30		EGEDHN
C#Cc1cccnc1NCCCCN1CCN(c2ccccc2)CC1	ZINC000853193621	1325059960	/nfs/dbraw/zinc/05/99/60/1325059960.db2.gz	VYGMITQOSGSUCF-UHFFFAOYSA-N	0	3	334.467	3.077	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCN(C(=O)c2[nH]ccc2C2CC2)C1	ZINC001026882242	1325061233	/nfs/dbraw/zinc/06/12/33/1325061233.db2.gz	YBBJQRPPUNRELG-OAHLLOKOSA-N	0	3	348.450	3.016	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](CNCc2ccn(C(C)C)n2)C1	ZINC001026989173	1325128754	/nfs/dbraw/zinc/12/87/54/1325128754.db2.gz	ZCYCKHJABGGQOS-INIZCTEOSA-N	0	3	332.492	3.004	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](CNCc2cc(-c3ccco3)on2)C1	ZINC001026992756	1325130914	/nfs/dbraw/zinc/13/09/14/1325130914.db2.gz	RYYXRPGKUAOXOD-AWEZNQCLSA-N	0	3	343.427	3.085	20	30		EGEDHN
CCc1ccccc1C(=O)N1CC[C@@H](CNCc2ccccc2C#N)C1	ZINC001027026623	1325162767	/nfs/dbraw/zinc/16/27/67/1325162767.db2.gz	ZMWFPQXKWTVWAQ-KRWDZBQOSA-N	0	3	347.462	3.373	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)C2(CF)CC2)C1	ZINC000963365833	1325168538	/nfs/dbraw/zinc/16/85/38/1325168538.db2.gz	QYUWGVPXIQSLSC-HUUCEWRRSA-N	0	3	328.859	3.192	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](CNCc3csc(CC)n3)C2)CC1	ZINC001027036856	1325171074	/nfs/dbraw/zinc/17/10/74/1325171074.db2.gz	JIWNPOAPHGMHMU-HNNXBMFYSA-N	0	3	347.528	3.390	20	30		EGEDHN
Cc1cccc(C)c1C(=O)N1CC[C@@H](CNCc2ccccc2C#N)C1	ZINC001027084735	1325210020	/nfs/dbraw/zinc/21/00/20/1325210020.db2.gz	LADQGIHUFDRBQI-SFHVURJKSA-N	0	3	347.462	3.427	20	30		EGEDHN
CCc1ccc([C@@H](CNC(=O)c2cc(C#N)ccc2F)N(C)C)cc1	ZINC000854304226	1325241557	/nfs/dbraw/zinc/24/15/57/1325241557.db2.gz	DCISTJPBRVQZMI-LJQANCHMSA-N	0	3	339.414	3.292	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)NC1CC2(CC(NCc3ccccc3C#N)C2)C1	ZINC000963696117	1325376667	/nfs/dbraw/zinc/37/66/67/1325376667.db2.gz	UHGWEAHAJXHNBP-IKQKDXEZSA-N	0	3	337.467	3.121	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)c2ccsc2)C1	ZINC001027288932	1325421489	/nfs/dbraw/zinc/42/14/89/1325421489.db2.gz	NGSHHYMTPMFFNV-SFHVURJKSA-N	0	3	339.464	3.356	20	30		EGEDHN
CN(Cc1ccc(F)c(C#N)c1)[C@@H]1CCCN(C(=O)C2CC=CC2)C1	ZINC001027344699	1325505686	/nfs/dbraw/zinc/50/56/86/1325505686.db2.gz	AVVYCTAQOPTFMC-GOSISDBHSA-N	0	3	341.430	3.086	20	30		EGEDHN
CCN(C(=O)OC(C)(C)C)[C@@H](C)C(=O)C(C#N)c1nc(C)cs1	ZINC000860449617	1329318718	/nfs/dbraw/zinc/31/87/18/1329318718.db2.gz	CLUQLAYRROHFJP-RYUDHWBXSA-N	0	3	337.445	3.273	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)C(=O)NCc1cccc(Cl)c1)c1ccco1	ZINC000860692042	1329344816	/nfs/dbraw/zinc/34/48/16/1329344816.db2.gz	WZBOCXVXUKBBRS-WFASDCNBSA-N	0	3	344.798	3.452	20	30		EGEDHN
C[C@H](CC(C)(C)C#N)NCc1cc(F)c(N2CCOCC2)c(F)c1	ZINC000926558315	1327616678	/nfs/dbraw/zinc/61/66/78/1327616678.db2.gz	DCNKQKOBBUIHQX-CYBMUJFWSA-N	0	3	337.414	3.219	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)c2csc3cc(C)ccc32)C1	ZINC001027425653	1327659511	/nfs/dbraw/zinc/65/95/11/1327659511.db2.gz	KRBZBVAMKDGPNF-HNNXBMFYSA-N	0	3	326.465	3.379	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@@H](N(C)Cc2ccc(C#N)cc2)C1)C1CCC1	ZINC001027461019	1327707375	/nfs/dbraw/zinc/70/73/75/1327707375.db2.gz	SVFMKMZRHUAEBE-OXQOHEQNSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=C1CCC(C(=O)NC2CC3(CC(NCc4conc4C)C3)C2)CC1	ZINC000964879827	1327746336	/nfs/dbraw/zinc/74/63/36/1327746336.db2.gz	FXHIHFGTSHVCFM-UHFFFAOYSA-N	0	3	343.471	3.246	20	30		EGEDHN
Cc1coc(C(=O)N2CCC[C@@H](N(C)Cc3ccc(C#N)cc3)C2)c1	ZINC001027537439	1327834055	/nfs/dbraw/zinc/83/40/55/1327834055.db2.gz	IRJLCILNXIWCDC-GOSISDBHSA-N	0	3	337.423	3.196	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2cccc(C(F)F)c2F)C1	ZINC000966165365	1328212505	/nfs/dbraw/zinc/21/25/05/1328212505.db2.gz	FTPWNSWKJCLSMS-SWLSCSKDSA-N	0	3	338.373	3.227	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)[C@H]2CC[C@H](C3CCC3)CC2)C1	ZINC000966874179	1328446752	/nfs/dbraw/zinc/44/67/52/1328446752.db2.gz	DCDPUDSICWAODH-AFYVEPGGSA-N	0	3	330.516	3.443	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](C)[C@@H](NC(=O)c2c(C)noc2C(F)F)C1	ZINC000966887834	1328452930	/nfs/dbraw/zinc/45/29/30/1328452930.db2.gz	JCSIMXJNMFJCIX-YPMHNXCESA-N	0	3	341.402	3.327	20	30		EGEDHN
C=C(C)c1cccc(NC(=O)NC[C@@H]2CCN2C2CCOCC2)c1	ZINC000934886819	1330014913	/nfs/dbraw/zinc/01/49/13/1330014913.db2.gz	MMWMLISPDCMTIX-SFHVURJKSA-N	0	3	329.444	3.095	20	30		EGEDHN
C#Cc1ccc(NC(=O)N(CCN(C)C)Cc2cccs2)cc1	ZINC000934936389	1330018814	/nfs/dbraw/zinc/01/88/14/1330018814.db2.gz	ZXYYZRRJFJNAOJ-UHFFFAOYSA-N	0	3	327.453	3.325	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H](C)[C@H](NCc3c(C)nsc3C)C2)CC1	ZINC000939054635	1330365609	/nfs/dbraw/zinc/36/56/09/1330365609.db2.gz	MMBQIFMRNNRUQD-FZKQIMNGSA-N	0	3	347.528	3.443	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2ccc(CCCC)cc2)[C@H](C)C1	ZINC000942274828	1331893375	/nfs/dbraw/zinc/89/33/75/1331893375.db2.gz	YLYJGHWALYLRLV-XLIONFOSSA-N	0	3	326.484	3.032	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cn(CC)c3ccccc23)[C@@H](C)C1	ZINC000942390749	1331920737	/nfs/dbraw/zinc/92/07/37/1331920737.db2.gz	BSFVURSDNHZUOK-LPHOPBHVSA-N	0	3	337.467	3.125	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc3c4c(cccc42)CC3)[C@H](C)C1	ZINC000942392007	1331921365	/nfs/dbraw/zinc/92/13/65/1331921365.db2.gz	IIBLJUFGZOXRPH-IIBYNOLFSA-N	0	3	346.474	3.402	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc3c4c(cccc42)CC3)[C@@H](C)C1	ZINC000942392005	1331921387	/nfs/dbraw/zinc/92/13/87/1331921387.db2.gz	IIBLJUFGZOXRPH-HRAATJIYSA-N	0	3	346.474	3.402	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2nc3ccccc3cc2C)[C@H](C)C1	ZINC000942525118	1331955314	/nfs/dbraw/zinc/95/53/14/1331955314.db2.gz	KBNNZBIPCNPSJH-AEFFLSMTSA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2sccc2-n2cccc2)[C@H](C)C1	ZINC000942544756	1331966986	/nfs/dbraw/zinc/96/69/86/1331966986.db2.gz	DZTYQKOJZVJPGW-HZPDHXFCSA-N	0	3	341.480	3.002	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(Cc3cnccc3C)C[C@@H]2C)cc1	ZINC000942553942	1331970348	/nfs/dbraw/zinc/97/03/48/1331970348.db2.gz	WFHAPUVYUZOGEB-LAUBAEHRSA-N	0	3	347.462	3.012	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C(C)(C)c2cccc(Cl)c2)[C@H](C)C1	ZINC000943211108	1332122411	/nfs/dbraw/zinc/12/24/11/1332122411.db2.gz	WYTDZEYBWDJZPZ-RHSMWYFYSA-N	0	3	332.875	3.077	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccccc2OCC(C)C)[C@@H](C)C1	ZINC000943690508	1332239346	/nfs/dbraw/zinc/23/93/46/1332239346.db2.gz	SWSKFRRSFCEKLO-FUHWJXTLSA-N	0	3	330.472	3.348	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cccc3ccsc32)[C@H](C)C1	ZINC000943985878	1332304049	/nfs/dbraw/zinc/30/40/49/1332304049.db2.gz	BJGLZPRDBLXMCB-RHSMWYFYSA-N	0	3	326.465	3.365	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnc3ccc(F)cc3c2)[C@H](C)C1	ZINC000943985814	1332304100	/nfs/dbraw/zinc/30/41/00/1332304100.db2.gz	ALYFTGYZQAFBRX-DYVFJYSZSA-N	0	3	327.403	3.000	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc3nc(C)sc3c2)[C@H](C)C1	ZINC000943990025	1332305443	/nfs/dbraw/zinc/30/54/43/1332305443.db2.gz	ZUIWYFPGSUHJCC-CJNGLKHVSA-N	0	3	341.480	3.068	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)c(F)cc2Cl)[C@H](C)C1	ZINC000944345299	1332379743	/nfs/dbraw/zinc/37/97/43/1332379743.db2.gz	FLLGDWLLDQMYCV-CXAGYDPISA-N	0	3	336.838	3.251	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(F)c(F)cc2Cl)[C@H](C)C1	ZINC000944619667	1332419564	/nfs/dbraw/zinc/41/95/64/1332419564.db2.gz	OIUFFYHMYXMAMH-BDJLRTHQSA-N	0	3	340.801	3.082	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(OCC(C)C)cc2)[C@@H](C)C1	ZINC000944652681	1332421697	/nfs/dbraw/zinc/42/16/97/1332421697.db2.gz	IYUQHWCEBLIGLD-PXNSSMCTSA-N	0	3	342.483	3.185	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc3ccccc3c2)[C@@H](C)C1	ZINC000944814242	1332428033	/nfs/dbraw/zinc/42/80/33/1332428033.db2.gz	XQTPGJWMVNUYBZ-UWJYYQICSA-N	0	3	334.463	3.232	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2sc(Cl)nc2Cl)[C@H](C)C1	ZINC000944944980	1332460072	/nfs/dbraw/zinc/46/00/72/1332460072.db2.gz	PRBOYUYFBRPSOM-BDAKNGLRSA-N	0	3	334.272	3.076	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)CC3CC(F)(F)C3)CC[C@@H]2C1	ZINC000946649403	1332870430	/nfs/dbraw/zinc/87/04/30/1332870430.db2.gz	YLMGYPFSIQCUCM-GASCZTMLSA-N	0	3	346.849	3.345	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)[C@@H]3Cc4ccccc43)CC[C@@H]2C1	ZINC000946743395	1332889617	/nfs/dbraw/zinc/88/96/17/1332889617.db2.gz	SHSCJUKEAKPWFZ-ZIFCJYIRSA-N	0	3	344.886	3.249	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2ccccc2[O-])CC[N@@H+]1Cc1ccc(C#N)cc1	ZINC000947070963	1333001951	/nfs/dbraw/zinc/00/19/51/1333001951.db2.gz	NSNJWHKYUBONEH-CRAIPNDOSA-N	0	3	349.434	3.047	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2ccccc2[O-])CC[N@H+]1Cc1ccc(C#N)cc1	ZINC000947070963	1333001953	/nfs/dbraw/zinc/00/19/53/1333001953.db2.gz	NSNJWHKYUBONEH-CRAIPNDOSA-N	0	3	349.434	3.047	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2ccccc2[O-])CC[N@@H+]1Cc1ccc(C#N)cc1	ZINC000947070965	1333002486	/nfs/dbraw/zinc/00/24/86/1333002486.db2.gz	NSNJWHKYUBONEH-QAPCUYQASA-N	0	3	349.434	3.047	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2ccccc2[O-])CC[N@H+]1Cc1ccc(C#N)cc1	ZINC000947070965	1333002488	/nfs/dbraw/zinc/00/24/88/1333002488.db2.gz	NSNJWHKYUBONEH-QAPCUYQASA-N	0	3	349.434	3.047	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2coc3ccc(OC)cc23)C[C@H]1C	ZINC000947536992	1333162140	/nfs/dbraw/zinc/16/21/40/1333162140.db2.gz	KPXNDQQHXHOEMZ-HUUCEWRRSA-N	0	3	340.423	3.047	20	30		EGEDHN
Cc1cocc1C(=O)N[C@@H]1CCN(Cc2ccc(C#N)cc2)[C@H](C)C1	ZINC000947625259	1333198556	/nfs/dbraw/zinc/19/85/56/1333198556.db2.gz	UKUHFBGXVJEDRI-CRAIPNDOSA-N	0	3	337.423	3.243	20	30		EGEDHN
Cc1cocc1C(=O)N[C@H]1CCN(Cc2ccc(C#N)cc2)[C@@H](C)C1	ZINC000947625262	1333198759	/nfs/dbraw/zinc/19/87/59/1333198759.db2.gz	UKUHFBGXVJEDRI-YJBOKZPZSA-N	0	3	337.423	3.243	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3cccc(OC)c3o2)C[C@@H]1C	ZINC000947668577	1333216670	/nfs/dbraw/zinc/21/66/70/1333216670.db2.gz	YDCCGOSISJIPKO-HOCLYGCPSA-N	0	3	340.423	3.047	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3cccnc3C)[C@@H](C)C2)C1	ZINC000947703454	1333233661	/nfs/dbraw/zinc/23/36/61/1333233661.db2.gz	YVODJMNEPVCAJL-MAUKXSAKSA-N	0	3	327.472	3.215	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccccc2OC2CCC2)C[C@@H]1C	ZINC000947712036	1333236709	/nfs/dbraw/zinc/23/67/09/1333236709.db2.gz	ZYFDXKSZHKWTNA-DLBZAZTESA-N	0	3	340.467	3.224	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)oc2C(F)(F)F)C[C@H]1C	ZINC000947757803	1333253042	/nfs/dbraw/zinc/25/30/42/1333253042.db2.gz	FTSQNINLUMXYTN-DGCLKSJQSA-N	0	3	342.361	3.213	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc3nc(C)sc3c2)C[C@H]1C	ZINC000947894698	1333295392	/nfs/dbraw/zinc/29/53/92/1333295392.db2.gz	BYQIATIJYGZKJF-CJNGLKHVSA-N	0	3	341.480	3.211	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnn(C3CCCC3)c2C)C[C@@H]1C	ZINC000947912609	1333304092	/nfs/dbraw/zinc/30/40/92/1333304092.db2.gz	NUEJHKXWFYNLEI-GOEBONIOSA-N	0	3	330.476	3.075	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2c(F)cccc2Cl)C[C@@H]1C	ZINC000947967231	1333324928	/nfs/dbraw/zinc/32/49/28/1333324928.db2.gz	NBODQMZGPVOKRX-KBPBESRZSA-N	0	3	336.838	3.014	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(F)c(F)cc2Cl)C[C@@H]1C	ZINC000947999007	1333337505	/nfs/dbraw/zinc/33/75/05/1333337505.db2.gz	RZYBESCCUOWXPT-QWRGUYRKSA-N	0	3	328.790	3.387	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(OCC(C)C)cc2)C[C@@H]1C	ZINC000948002321	1333338505	/nfs/dbraw/zinc/33/85/05/1333338505.db2.gz	OGORBKNUGYFXFG-PKOBYXMFSA-N	0	3	342.483	3.327	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2csc3c2CCCC3)C[C@@H]1C	ZINC000948008137	1333340162	/nfs/dbraw/zinc/34/01/62/1333340162.db2.gz	ZYHSOPGKXHEFKJ-LSDHHAIUSA-N	0	3	330.497	3.233	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc(OCC(C)C)c2)C[C@@H]1C	ZINC000948017980	1333343717	/nfs/dbraw/zinc/34/37/17/1333343717.db2.gz	YHPXPLAKNAIVSZ-HKUYNNGSSA-N	0	3	342.483	3.327	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccccc2OCC2CC2)C[C@@H]1C	ZINC000948061481	1333359963	/nfs/dbraw/zinc/35/99/63/1333359963.db2.gz	VBVGBKGRQJBASN-RDJZCZTQSA-N	0	3	328.456	3.244	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](NC(=O)c2ccccc2CN(C)C)C[C@H]1C	ZINC000948070349	1333364863	/nfs/dbraw/zinc/36/48/63/1333364863.db2.gz	OOVORDGVTXTZNQ-WBVHZDCISA-N	0	3	349.906	3.083	20	30		EGEDHN
CN(C(=O)c1ccco1)[C@@H]1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC000948149572	1333395729	/nfs/dbraw/zinc/39/57/29/1333395729.db2.gz	XSCIGICCXPLTKR-GOSISDBHSA-N	0	3	337.423	3.278	20	30		EGEDHN
CN(C(=O)c1ccoc1)[C@H]1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC000948189401	1333415400	/nfs/dbraw/zinc/41/54/00/1333415400.db2.gz	WYFVRNGCLRNIJR-IBGZPJMESA-N	0	3	337.423	3.278	20	30		EGEDHN
CN(C(=O)C1=CCCC1)[C@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948295584	1333469408	/nfs/dbraw/zinc/46/94/08/1333469408.db2.gz	YFEMOFNDQIUBMO-FQEVSTJZSA-N	0	3	337.467	3.481	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2sc(C3CC3)nc2C)CC1	ZINC000948362111	1333493921	/nfs/dbraw/zinc/49/39/21/1333493921.db2.gz	VJHVRIRPJNPINO-MRXNPFEDSA-N	0	3	345.512	3.279	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2cc(C(F)F)ccc2F)CC1	ZINC000948376911	1333501973	/nfs/dbraw/zinc/50/19/73/1333501973.db2.gz	DLYRNPLXILYFKT-AWEZNQCLSA-N	0	3	338.373	3.323	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)Cc2coc3ccc(C)cc23)CC1	ZINC000948412765	1333515312	/nfs/dbraw/zinc/51/53/12/1333515312.db2.gz	YXEIRSYWNFTVAT-GOSISDBHSA-N	0	3	338.451	3.230	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)Cc2cncc3ccccc32)CC1	ZINC000948445215	1333528667	/nfs/dbraw/zinc/52/86/67/1333528667.db2.gz	XJWULGICHUAIPP-FQEVSTJZSA-N	0	3	349.478	3.114	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2ccccc2-c2ccncc2)CC1	ZINC000948546818	1333567444	/nfs/dbraw/zinc/56/74/44/1333567444.db2.gz	IPZXXFDPBNBDMV-IBGZPJMESA-N	0	3	347.462	3.308	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)Cc2ccc(CC(C)C)cc2)CC1	ZINC000948599671	1333590848	/nfs/dbraw/zinc/59/08/48/1333590848.db2.gz	WMVOCOVBPSYBAZ-OAQYLSRUSA-N	0	3	340.511	3.374	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2scnc2C(F)F)CC1	ZINC000948608323	1333595139	/nfs/dbraw/zinc/59/51/39/1333595139.db2.gz	MYQSHMHCVFLMNI-LBPRGKRZSA-N	0	3	341.427	3.031	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)[C@H]2CCCCC2(F)F)CC1	ZINC000948648780	1333612368	/nfs/dbraw/zinc/61/23/68/1333612368.db2.gz	WAYPJTODLCUBBM-HZPDHXFCSA-N	0	3	326.431	3.148	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](N(C)C(=O)c2cc(CCC)[nH]n2)CC1	ZINC000948665188	1333620371	/nfs/dbraw/zinc/62/03/71/1333620371.db2.gz	GVEGEVCFBLFSJT-HNNXBMFYSA-N	0	3	338.883	3.041	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)[C@@H]2C[C@H]2c2c(F)cccc2F)CC1	ZINC000948754545	1333662656	/nfs/dbraw/zinc/66/26/56/1333662656.db2.gz	YZURQHPWZXXDNK-BZUAXINKSA-N	0	3	346.421	3.014	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)C(C)(C)c2cccc(F)c2)CC1	ZINC000948772148	1333672514	/nfs/dbraw/zinc/67/25/14/1333672514.db2.gz	UJCIVXIUIYGOIX-LJQANCHMSA-N	0	3	344.474	3.440	20	30		EGEDHN
N#Cc1c[nH]c(C(=O)NC[C@@H]2c3ccccc3CCN2CCC2CC2)c1	ZINC000948901896	1333726159	/nfs/dbraw/zinc/72/61/59/1333726159.db2.gz	GMMOKTOLMDSCMD-HXUWFJFHSA-N	0	3	348.450	3.016	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@@H]1CNC(=O)[C@@H]1CCO[C@H]1CC	ZINC000948941532	1333742321	/nfs/dbraw/zinc/74/23/21/1333742321.db2.gz	YWJPGDUPPORYJE-AABGKKOBSA-N	0	3	342.483	3.093	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@@H]1CNC(=O)[C@H]1OCC[C@H]1C	ZINC000948961022	1333748372	/nfs/dbraw/zinc/74/83/72/1333748372.db2.gz	HLGQDBAPXWZHAT-UXPWSPDFSA-N	0	3	342.483	3.093	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@@H]3CC[C@H]4C[C@H]4C3)CC2)C1	ZINC000949402021	1333838524	/nfs/dbraw/zinc/83/85/24/1333838524.db2.gz	SWVHANZXYQIGEI-OTWHNJEPSA-N	0	3	346.515	3.082	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@@H]3C[C@H]3C(C)(C)C)CC2)C1	ZINC000949412546	1333841129	/nfs/dbraw/zinc/84/11/29/1333841129.db2.gz	YGBUWLGZCZCCHP-QZTJIDSGSA-N	0	3	348.531	3.328	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC3(CC2)CN(CCC(C)C)CCO3)C1	ZINC000949467090	1333856223	/nfs/dbraw/zinc/85/62/23/1333856223.db2.gz	YVQOKUULEWCUQW-UHFFFAOYSA-N	0	3	334.504	3.082	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)Cc2ccc(C)cc2Cl)C1	ZINC000967004468	1335640434	/nfs/dbraw/zinc/64/04/34/1335640434.db2.gz	ATHNWUUXUYEXQT-YJBOKZPZSA-N	0	3	332.875	3.041	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)c2cc(C)cc(OC)c2C)C1	ZINC000967258283	1335679562	/nfs/dbraw/zinc/67/95/62/1335679562.db2.gz	OVVDQUZBSKUCSP-QAPCUYQASA-N	0	3	330.472	3.328	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)Cc2cccc3ncccc23)C1	ZINC000967290969	1335691686	/nfs/dbraw/zinc/69/16/86/1335691686.db2.gz	GJQMBFQHFMAKOJ-UZLBHIALSA-N	0	3	337.467	3.180	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)c2ccc(C)c(Cl)c2F)C1	ZINC000967420881	1335733028	/nfs/dbraw/zinc/73/30/28/1335733028.db2.gz	ZHIIMDFVALXWJD-DOMZBBRYSA-N	0	3	336.838	3.251	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2sccc2-n2cccc2)C1	ZINC000967619207	1335793882	/nfs/dbraw/zinc/79/38/82/1335793882.db2.gz	BTZIJDNMPSVBHA-HZPDHXFCSA-N	0	3	341.480	3.002	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2ccc(C(F)F)c(F)c2)C1	ZINC000968327975	1335891637	/nfs/dbraw/zinc/89/16/37/1335891637.db2.gz	VPSRUQXRMYLEPQ-BLLLJJGKSA-N	0	3	338.373	3.227	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)Cc2ccc(C(C)(C)C)cc2)C1	ZINC000968354464	1335899846	/nfs/dbraw/zinc/89/98/46/1335899846.db2.gz	SZOKSPGQAQDAER-XLIONFOSSA-N	0	3	340.511	3.377	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@@H]2CN(CC=C(C)C)CC[C@H]2C)cc1	ZINC000968391427	1335917240	/nfs/dbraw/zinc/91/72/40/1335917240.db2.gz	SBYKLBOYCBKEHF-YLJYHZDGSA-N	0	3	340.467	3.105	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2cc(-c3ccccc3)ccn2)C1	ZINC000968471346	1335934024	/nfs/dbraw/zinc/93/40/24/1335934024.db2.gz	DHZSRATZJKMHMB-LAUBAEHRSA-N	0	3	347.462	3.212	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2ncccc2C(F)(F)F)C1	ZINC000968500383	1335942781	/nfs/dbraw/zinc/94/27/81/1335942781.db2.gz	CZWPPRXWCACZHS-GXTWGEPZSA-N	0	3	341.377	3.117	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)Cc2c(C)nn(C(C)C)c2C)C1	ZINC000968528918	1335955191	/nfs/dbraw/zinc/95/51/91/1335955191.db2.gz	INNYTIBWOIJZOV-KXBFYZLASA-N	0	3	346.519	3.026	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)Cn2ccc3ccccc32)C1	ZINC000968664965	1336002339	/nfs/dbraw/zinc/00/23/39/1336002339.db2.gz	KULWWJPMFVWKDN-AEFFLSMTSA-N	0	3	325.456	3.044	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)Cc2c(C)oc3ccccc32)C1	ZINC000968713570	1336021312	/nfs/dbraw/zinc/02/13/12/1336021312.db2.gz	SLSBKADPJKGJAE-KXBFYZLASA-N	0	3	338.451	3.134	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccnn1-c1ccccc1	ZINC000968917135	1336088252	/nfs/dbraw/zinc/08/82/52/1336088252.db2.gz	OWZPFBAHHRNZSY-GOSISDBHSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccc2[nH]nc(C)c2c1	ZINC000968944939	1336100089	/nfs/dbraw/zinc/10/00/89/1336100089.db2.gz	RYZHLGXXOVNHNS-INIZCTEOSA-N	0	3	326.444	3.032	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cccc2c1O[C@H](C)C2	ZINC000968954274	1336101847	/nfs/dbraw/zinc/10/18/47/1336101847.db2.gz	AHUIBBXWCJAPTA-NVXWUHKLSA-N	0	3	328.456	3.170	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)[C@@H]1C[C@]1(C)c1ccccc1	ZINC000968957557	1336102860	/nfs/dbraw/zinc/10/28/60/1336102860.db2.gz	LRIJIGVCWJOHNN-JAXLGGSGSA-N	0	3	338.495	3.348	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cc(-c2ccco2)on1	ZINC000968973239	1336105875	/nfs/dbraw/zinc/10/58/75/1336105875.db2.gz	DXKCQVZADCLKLV-CQSZACIVSA-N	0	3	329.400	3.095	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cc2ccc(OC)cc2[nH]1	ZINC000968977162	1336106919	/nfs/dbraw/zinc/10/69/19/1336106919.db2.gz	OYIOHTANQNBCIU-INIZCTEOSA-N	0	3	341.455	3.337	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1ccc(OC)cc1C	ZINC000969008795	1336117184	/nfs/dbraw/zinc/11/71/84/1336117184.db2.gz	XNHJLWNRHSWNIX-KRWDZBQOSA-N	0	3	328.456	3.001	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cn(CC)nc1C(C)C	ZINC000969046722	1336126796	/nfs/dbraw/zinc/12/67/96/1336126796.db2.gz	TUVXENYEIKYLFH-INIZCTEOSA-N	0	3	332.492	3.187	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cc(C(F)(F)F)ccn1	ZINC000969103586	1336144944	/nfs/dbraw/zinc/14/49/44/1336144944.db2.gz	YXLAAJHOURBEGK-CQSZACIVSA-N	0	3	341.377	3.261	20	30		EGEDHN
C#CCN1CCCCC[C@H]1CNC(=O)c1cc(C)nc2ccccc21	ZINC000969133783	1336155638	/nfs/dbraw/zinc/15/56/38/1336155638.db2.gz	SJRPPFNLRNAPMR-KRWDZBQOSA-N	0	3	335.451	3.151	20	30		EGEDHN
CC#CCN1CCCCC[C@H]1CNC(=O)c1cc(C)c(F)c(C)c1	ZINC000969148324	1336162200	/nfs/dbraw/zinc/16/22/00/1336162200.db2.gz	RYBRTJLHTPTAPU-SFHVURJKSA-N	0	3	330.447	3.440	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccc(OCC2CC2)nc1	ZINC000969156324	1336166029	/nfs/dbraw/zinc/16/60/29/1336166029.db2.gz	PNSMFHRROWWWIQ-GOSISDBHSA-N	0	3	343.471	3.031	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1cccnc1OC(C)C	ZINC000969173683	1336171078	/nfs/dbraw/zinc/17/10/78/1336171078.db2.gz	PUKVCFMNPTULMX-KRWDZBQOSA-N	0	3	345.487	3.419	20	30		EGEDHN
CC1(C(=O)N2CC[C@@H](NCc3ccc(C#N)s3)C2)CCCCC1	ZINC000969811957	1336250379	/nfs/dbraw/zinc/25/03/79/1336250379.db2.gz	YBVDRYUMOWDVDC-CQSZACIVSA-N	0	3	331.485	3.281	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N[C@H](C)C1CN(CC=C(C)C)C1	ZINC000969989381	1336269538	/nfs/dbraw/zinc/26/95/38/1336269538.db2.gz	OGVMVXLRZXYSRM-MRXNPFEDSA-N	0	3	328.456	3.268	20	30		EGEDHN
C#CCCN1CC([C@H](C)NC(=O)c2cc3ccc(F)cc3s2)C1	ZINC000970090126	1336279112	/nfs/dbraw/zinc/27/91/12/1336279112.db2.gz	PFSXQSJSUSSABQ-LBPRGKRZSA-N	0	3	330.428	3.114	20	30		EGEDHN
C#CCCN1CC([C@@H](C)NC(=O)c2ccc(-c3ccco3)s2)C1	ZINC000970673500	1336331987	/nfs/dbraw/zinc/33/19/87/1336331987.db2.gz	RVTHPNVHVZVFBS-CYBMUJFWSA-N	0	3	328.437	3.082	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)Cc2coc3ccc(C)cc23)CC1	ZINC001005446154	1336351284	/nfs/dbraw/zinc/35/12/84/1336351284.db2.gz	RBYLIHIJGKNWCB-UHFFFAOYSA-N	0	3	326.440	3.393	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cnc(C)nc2C(C)C)CC1	ZINC001006088551	1336450683	/nfs/dbraw/zinc/45/06/83/1336450683.db2.gz	SQCCQCBBLNZGML-UHFFFAOYSA-N	0	3	330.476	3.021	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cnc([C@@H]3CCCO3)s2)CC1	ZINC001006103883	1336452740	/nfs/dbraw/zinc/45/27/40/1336452740.db2.gz	OGVQAEOTRHFHHV-HNNXBMFYSA-N	0	3	349.500	3.107	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2coc(C3CCCCC3)n2)CC1	ZINC001006463371	1336511831	/nfs/dbraw/zinc/51/18/31/1336511831.db2.gz	PTGACSBPIAIOSX-UHFFFAOYSA-N	0	3	331.460	3.445	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H](NC(=O)c2coc(Br)c2)C1	ZINC001007452481	1336649468	/nfs/dbraw/zinc/64/94/68/1336649468.db2.gz	MMJXVUJVPFYXEO-CYBMUJFWSA-N	0	3	341.249	3.203	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CCCN(CCc2ccccc2)C1	ZINC001007501599	1336659342	/nfs/dbraw/zinc/65/93/42/1336659342.db2.gz	ZOZSDTOAJBOJJP-LJQANCHMSA-N	0	3	337.467	3.111	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CCCN([C@@H](CC)c3ccccc3)C2)c1	ZINC001008465697	1336863808	/nfs/dbraw/zinc/86/38/08/1336863808.db2.gz	ACJSKWKKVDQHLX-RTWAWAEBSA-N	0	3	347.462	3.408	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CCCN([C@H](C)c3cccc(C)c3)C2)c1	ZINC001008466939	1336864349	/nfs/dbraw/zinc/86/43/49/1336864349.db2.gz	ATCYFILDMALURA-UTKZUKDTSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#CCCN1CCC[C@@H](NC(=O)c2ccc(O[C@H](C)CC)cc2)C1	ZINC001009105706	1336970125	/nfs/dbraw/zinc/97/01/25/1336970125.db2.gz	COPNELHXTSQRHY-SJLPKXTDSA-N	0	3	328.456	3.081	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)c2cc(C)n(CC3CC3)c2C)C1	ZINC001009244960	1336989664	/nfs/dbraw/zinc/98/96/64/1336989664.db2.gz	GYVVBGBNOLHVQJ-SFHVURJKSA-N	0	3	329.488	3.285	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)Cc2c[nH]c3cccc(C)c23)C1	ZINC001009245029	1336990112	/nfs/dbraw/zinc/99/01/12/1336990112.db2.gz	ITEWLYKSTQKDCS-KRWDZBQOSA-N	0	3	325.456	3.176	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(Cc3cc(C)cc(C)c3)C2)cc1	ZINC001015483419	1338156179	/nfs/dbraw/zinc/15/61/79/1338156179.db2.gz	WIXTTZACKRJRLH-OAQYLSRUSA-N	0	3	332.447	3.289	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](NC(=O)c2nc(Cl)sc2Cl)C1	ZINC001015486868	1338156856	/nfs/dbraw/zinc/15/68/56/1338156856.db2.gz	IXDZYKINKBCJHS-SECBINFHSA-N	0	3	334.272	3.220	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN([C@H](C)c3cc(C)ccc3C)C2)nc1	ZINC001016026360	1338413732	/nfs/dbraw/zinc/41/37/32/1338413732.db2.gz	FXZFTYYJRKVPHE-MJGOQNOKSA-N	0	3	347.462	3.245	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN([C@@H](C)c3cc(C)ccc3C)C2)nc1	ZINC001016026358	1338413879	/nfs/dbraw/zinc/41/38/79/1338413879.db2.gz	FXZFTYYJRKVPHE-HKUYNNGSSA-N	0	3	347.462	3.245	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2occc2-c2ccccc2)CC1	ZINC001016719861	1338701896	/nfs/dbraw/zinc/70/18/96/1338701896.db2.gz	SUCWPSNBFSTCQD-GOSISDBHSA-N	0	3	334.419	3.164	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)[C@@H](C)c2c(F)cccc2F)CC1	ZINC001016738957	1338708310	/nfs/dbraw/zinc/70/83/10/1338708310.db2.gz	UVSWDZOADWLWQC-WMLDXEAASA-N	0	3	346.421	3.062	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cc3ccc(C)cc3[nH]2)CC1	ZINC001016753442	1338712406	/nfs/dbraw/zinc/71/24/06/1338712406.db2.gz	JTUFFFTZCYCIGO-IBGZPJMESA-N	0	3	335.451	3.084	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2ccc(-c3ccccc3)o2)CC1	ZINC001016832711	1338740452	/nfs/dbraw/zinc/74/04/52/1338740452.db2.gz	NIOKLGUXOKGDKO-LJQANCHMSA-N	0	3	334.419	3.164	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2scnc2C(C)(C)C)CC1	ZINC001016867751	1338752840	/nfs/dbraw/zinc/75/28/40/1338752840.db2.gz	MTQCPRZQAASSEI-CQSZACIVSA-N	0	3	345.512	3.048	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2csc(C(C)(C)C)n2)CC1	ZINC001016876205	1338756143	/nfs/dbraw/zinc/75/61/43/1338756143.db2.gz	GCWBMULMDFEZDU-HNNXBMFYSA-N	0	3	345.512	3.048	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccccc2OC(C)C)CC1	ZINC001016942315	1338778113	/nfs/dbraw/zinc/77/81/13/1338778113.db2.gz	XRYOBPOLQQMGOS-IBGZPJMESA-N	0	3	340.467	3.081	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cc(C)nc3ccccc32)CC1	ZINC001016955037	1338783208	/nfs/dbraw/zinc/78/32/08/1338783208.db2.gz	GMKIZCNFXXXRTC-FQEVSTJZSA-N	0	3	347.462	3.151	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)C2CCC(C(C)(C)C)CC2)CC1	ZINC001016958067	1338784220	/nfs/dbraw/zinc/78/42/20/1338784220.db2.gz	HMUFDAGGFZZDGJ-ABHNRTSZSA-N	0	3	330.516	3.443	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2cc3cc(F)ccc3s2)CC1	ZINC001016962733	1338785913	/nfs/dbraw/zinc/78/59/13/1338785913.db2.gz	CSWTVVWUPJTROV-QGZVFWFLSA-N	0	3	342.439	3.258	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2cc3c(s2)CC[C@H](C)C3)CC1	ZINC001016964145	1338786208	/nfs/dbraw/zinc/78/62/08/1338786208.db2.gz	YYTYTRLCEKTZBC-KBXCAEBGSA-N	0	3	342.508	3.090	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cc(C)n(C(C)C)c2C)CC1	ZINC001016969319	1338787326	/nfs/dbraw/zinc/78/73/26/1338787326.db2.gz	SPWUUVAFQOVKNE-LJQANCHMSA-N	0	3	341.499	3.293	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H](CN(C)Cc2cncc(F)c2)C1	ZINC001017201519	1338946144	/nfs/dbraw/zinc/94/61/44/1338946144.db2.gz	JZFBUAUOQMKMDP-OXQOHEQNSA-N	0	3	347.478	3.493	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H](CN(C)Cc2ccc(F)cn2)C1	ZINC001017202287	1338947219	/nfs/dbraw/zinc/94/72/19/1338947219.db2.gz	RZHCKYBRBFBZMH-JXFKEZNVSA-N	0	3	347.478	3.493	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H](CN(C)Cc3c(C)noc3C)C2)C1	ZINC001017206592	1338952910	/nfs/dbraw/zinc/95/29/10/1338952910.db2.gz	JYYPYBSHBSHMOU-KRWDZBQOSA-N	0	3	345.487	3.318	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1c(F)cccc1F	ZINC001017861643	1339433281	/nfs/dbraw/zinc/43/32/81/1339433281.db2.gz	YWBDFDRTIGABIO-GASCZTMLSA-N	0	3	334.410	3.149	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cccc2ccncc21	ZINC001018132851	1339509464	/nfs/dbraw/zinc/50/94/64/1339509464.db2.gz	PYWKGSJXHVUASG-HDICACEKSA-N	0	3	335.451	3.490	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2ccncc2c1	ZINC001018142748	1339513036	/nfs/dbraw/zinc/51/30/36/1339513036.db2.gz	SFFWTAIYXRANAD-BGYRXZFFSA-N	0	3	335.451	3.490	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc(OCC)cc1	ZINC001018241179	1339545490	/nfs/dbraw/zinc/54/54/90/1339545490.db2.gz	XTUVKSXVRCQXTC-KDURUIRLSA-N	0	3	342.483	3.269	20	30		EGEDHN
CC1=C(C)C[C@@H](C(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)CC1	ZINC001018903185	1339747233	/nfs/dbraw/zinc/74/72/33/1339747233.db2.gz	VYQCDGWZBXUAFV-HOTGVXAUSA-N	0	3	343.496	3.447	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001018907453	1339749076	/nfs/dbraw/zinc/74/90/76/1339749076.db2.gz	HOMWHRAXAMOQTL-INIZCTEOSA-N	0	3	331.435	3.070	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1ccc(OC)c(C2CC2)c1	ZINC001028231965	1340495795	/nfs/dbraw/zinc/49/57/95/1340495795.db2.gz	ZRJNKPBNWJKSOI-KRWDZBQOSA-N	0	3	328.456	3.343	20	30		EGEDHN
C#CCCN1CCC[C@H]1CNC(=O)c1cc(Cl)ccc1Cl	ZINC001028283460	1340538889	/nfs/dbraw/zinc/53/88/89/1340538889.db2.gz	GXLMWHDFYMYMCY-ZDUSSCGKSA-N	0	3	325.239	3.211	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1ccc(OCC(C)C)cc1	ZINC001028302395	1340551104	/nfs/dbraw/zinc/55/11/04/1340551104.db2.gz	ATBLAESCLIGUPP-SFHVURJKSA-N	0	3	330.472	3.492	20	30		EGEDHN
Cc1ccc(C(=O)NC[C@@H]2CCN(Cc3ccc(C#N)cc3)C2)s1	ZINC001028378813	1340607920	/nfs/dbraw/zinc/60/79/20/1340607920.db2.gz	YPBYQMDVAFAFFT-KRWDZBQOSA-N	0	3	339.464	3.180	20	30		EGEDHN
C#CCN1CC[C@H](CNC(=O)[C@@H]2C[C@H]2c2cccc3ccccc32)C1	ZINC001028874003	1340873473	/nfs/dbraw/zinc/87/34/73/1340873473.db2.gz	NVLKHFKCDHMZRL-TYCQWZJGSA-N	0	3	332.447	3.015	20	30		EGEDHN
CC#CCN1CC[C@@H](CNC(=O)c2cc3cc(C)ccc3s2)C1	ZINC001028902046	1340879313	/nfs/dbraw/zinc/87/93/13/1340879313.db2.gz	NDBWCDYQXJUMQU-HNNXBMFYSA-N	0	3	326.465	3.285	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H](CNC(=O)[C@H]3CC34CCCC4)C2)c1	ZINC001028908434	1340880846	/nfs/dbraw/zinc/88/08/46/1340880846.db2.gz	MCCKQVNPQPCILK-RTBURBONSA-N	0	3	337.467	3.077	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H](CNC(=O)c3ccc(F)s3)C2)c1	ZINC001029016426	1340910525	/nfs/dbraw/zinc/91/05/25/1340910525.db2.gz	XHFRNCFWCXKONX-HNNXBMFYSA-N	0	3	343.427	3.011	20	30		EGEDHN
CC(C)CC(=O)N1CCC([C@H](C)NCc2cc(F)ccc2C#N)CC1	ZINC001029041183	1340915413	/nfs/dbraw/zinc/91/54/13/1340915413.db2.gz	JUEKDYKNQJIWGT-HNNXBMFYSA-N	0	3	345.462	3.460	20	30		EGEDHN
CS[C@H](C)C(=O)N1CCC([C@H](C)NCc2ccccc2C#N)CC1	ZINC001029054494	1340920293	/nfs/dbraw/zinc/92/02/93/1340920293.db2.gz	WEVPVDSNFWNWOH-LSDHHAIUSA-N	0	3	345.512	3.026	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)N1CCC([C@@H](C)NCc2ccccc2C#N)CC1	ZINC001029132016	1340938837	/nfs/dbraw/zinc/93/88/37/1340938837.db2.gz	YXXGXUZZCMAZLZ-DNVCBOLYSA-N	0	3	345.462	3.269	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC([C@H](C)NCc3cnns3)CC2)CC1	ZINC001029136376	1340939744	/nfs/dbraw/zinc/93/97/44/1340939744.db2.gz	FWVVIHUKOSMLDS-AWEZNQCLSA-N	0	3	348.516	3.001	20	30		EGEDHN
O=C(C#CC1CC1)N1C[C@H]2CC[C@@H](C1)N2CCC1CCCCCC1	ZINC001029302909	1340969197	/nfs/dbraw/zinc/96/91/97/1340969197.db2.gz	WTCIKQTXBRSIOU-BGYRXZFFSA-N	0	3	328.500	3.436	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CC[C@@H](C1)N2CCC[C@H]1CCOC1	ZINC001029456767	1340994315	/nfs/dbraw/zinc/99/43/15/1340994315.db2.gz	PQMHNRRDOHAIJX-GNBUJSLZSA-N	0	3	334.504	3.081	20	30		EGEDHN
C#Cc1ccc(C(=O)N2C[C@H]3CC[C@@H](C2)N3CCC2=CCCCC2)cn1	ZINC001029558851	1341012115	/nfs/dbraw/zinc/01/21/15/1341012115.db2.gz	YCMCALMFBJWOBC-OYRHEFFESA-N	0	3	349.478	3.242	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001029652131	1341034605	/nfs/dbraw/zinc/03/46/05/1341034605.db2.gz	NULNCZDGYMYQNP-CQSZACIVSA-N	0	3	333.501	3.336	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCN(C(=O)CCC2CC2)C1	ZINC001029683741	1341042371	/nfs/dbraw/zinc/04/23/71/1341042371.db2.gz	FEMRQBKUNSIXPX-HNNXBMFYSA-N	0	3	331.485	3.090	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@H](CN(C)Cc2c(C)noc2C)C1	ZINC001029825796	1341087382	/nfs/dbraw/zinc/08/73/82/1341087382.db2.gz	IHMGSPJNWQTHET-LPHOPBHVSA-N	0	3	333.476	3.174	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC(CN(C)Cc2cncc(F)c2)CC1	ZINC001029982090	1341143552	/nfs/dbraw/zinc/14/35/52/1341143552.db2.gz	LUTJIGLCFPAUGH-UHFFFAOYSA-N	0	3	347.478	3.493	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CCC(CN(C)Cc2cc(C#N)ccc2F)CC1	ZINC001029985380	1341144572	/nfs/dbraw/zinc/14/45/72/1341144572.db2.gz	WWXHLJNICDHGFH-QGZVFWFLSA-N	0	3	349.425	3.116	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NCC1CN([C@@H](C)c2ccccc2C)C1	ZINC001031680284	1341387396	/nfs/dbraw/zinc/38/73/96/1341387396.db2.gz	ZFCGIVFPCSVWLP-DBVUQKKJSA-N	0	3	342.483	3.085	20	30		EGEDHN
C=CCn1cccc1C(=O)NCC1CN(Cc2c(C)cccc2C)C1	ZINC001031731229	1341394469	/nfs/dbraw/zinc/39/44/69/1341394469.db2.gz	PPEPMLPRZLLVJL-UHFFFAOYSA-N	0	3	337.467	3.153	20	30		EGEDHN
CC1(C)CCC(CN2C[C@@H]3C[C@H]2CN3C(=O)c2cc(C#N)c[nH]2)CC1	ZINC001032338248	1341498416	/nfs/dbraw/zinc/49/84/16/1341498416.db2.gz	QVFDGFMLOKSXJW-IRXDYDNUSA-N	0	3	340.471	3.001	20	30		EGEDHN
C=CCn1cccc1C(=O)N1C[C@@H]2C[C@H]1CN2CCCC1CCC1	ZINC001032447391	1341512877	/nfs/dbraw/zinc/51/28/77/1341512877.db2.gz	KNMBXZVZEFTXIG-ROUUACIJSA-N	0	3	327.472	3.153	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2C[C@@H]3C[C@H]2CN3CCC(C)C)cc1	ZINC001032484549	1341521469	/nfs/dbraw/zinc/52/14/69/1341521469.db2.gz	VGGWYSUDQJQGKL-ROUUACIJSA-N	0	3	328.456	3.196	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H]3C[C@H]2CN3CCCC2CCOCC2)CC1	ZINC001032606581	1341556410	/nfs/dbraw/zinc/55/64/10/1341556410.db2.gz	WXSYHVUQNCPLCA-PMACEKPBSA-N	0	3	346.515	3.225	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cccc(N2CCCC2)c1	ZINC001032696273	1341583657	/nfs/dbraw/zinc/58/36/57/1341583657.db2.gz	VUQJPYRARUMEKA-PMACEKPBSA-N	0	3	339.483	3.152	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cnn(C2CCCCC2)c1	ZINC001032717393	1341590418	/nfs/dbraw/zinc/59/04/18/1341590418.db2.gz	DYSWRQCYAALPBL-OALUTQOASA-N	0	3	342.487	3.253	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1c(F)cccc1Cl	ZINC001032749813	1341601631	/nfs/dbraw/zinc/60/16/31/1341601631.db2.gz	XRZNNYIBFMWCFR-KBPBESRZSA-N	0	3	336.838	3.273	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H](C)Oc1ccc(C)cc1	ZINC001032769743	1341608928	/nfs/dbraw/zinc/60/89/28/1341608928.db2.gz	WUBVAMKRHYSCCL-SQNIBIBYSA-N	0	3	328.456	3.014	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)[C@H](c1ccc(F)cc1)C(C)C	ZINC001032807160	1341620775	/nfs/dbraw/zinc/62/07/75/1341620775.db2.gz	ZVFIKZFKNHQCPK-FHWLQOOXSA-N	0	3	330.447	3.427	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2cc(F)cc3ccncc32)C1	ZINC001033092247	1341720875	/nfs/dbraw/zinc/72/08/75/1341720875.db2.gz	PCDLJEZICRDOLU-INIZCTEOSA-N	0	3	327.403	3.096	20	30		EGEDHN
C#CCCN1CC[C@H](N(C)C(=O)c2ccccc2CC(C)(C)C)C1	ZINC001033176774	1341745637	/nfs/dbraw/zinc/74/56/37/1341745637.db2.gz	KRIXGRUQJUURMD-SFHVURJKSA-N	0	3	326.484	3.445	20	30		EGEDHN
C#Cc1cncc(C(=O)N(C)[C@H]2CCN(Cc3ccc(C)c(C)c3)C2)c1	ZINC001033406347	1341816934	/nfs/dbraw/zinc/81/69/34/1341816934.db2.gz	VPRBMBQRAGMJJI-NRFANRHFSA-N	0	3	347.462	3.026	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(C)C(=O)c2ncoc2-c2cccs2)C1	ZINC001033508207	1341851224	/nfs/dbraw/zinc/85/12/24/1341851224.db2.gz	QVGRADYIZLPCMB-CYBMUJFWSA-N	0	3	331.441	3.126	20	30		EGEDHN
C=CCCN1CC[C@@H](N(C)C(=O)c2coc(-c3ccccc3)n2)C1	ZINC001033591021	1341887472	/nfs/dbraw/zinc/88/74/72/1341887472.db2.gz	XTPBKMGMDORORO-MRXNPFEDSA-N	0	3	325.412	3.064	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ncn3cc(Cl)ccc23)C1	ZINC001033833133	1342032943	/nfs/dbraw/zinc/03/29/43/1342032943.db2.gz	FRJWXQSIWDLDQP-OAHLLOKOSA-N	0	3	346.862	3.100	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2cc(C)c3ccccc3n2)C1	ZINC001033875725	1342053631	/nfs/dbraw/zinc/05/36/31/1342053631.db2.gz	ZJYNSPAYZRVJFE-KRWDZBQOSA-N	0	3	335.451	3.103	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2ccc(F)c(Cl)c2F)C1	ZINC001033942338	1342103521	/nfs/dbraw/zinc/10/35/21/1342103521.db2.gz	ZHFSLJXEJLGGLZ-LBPRGKRZSA-N	0	3	340.801	3.178	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)[C@@H]2C[C@H]2c2ccc(C)c(C)c2)C1	ZINC001033984010	1342129418	/nfs/dbraw/zinc/12/94/18/1342129418.db2.gz	HOKZVPAANTUXMR-PCCBWWKXSA-N	0	3	338.495	3.353	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@@H]2C[C@H]2c2ccc(OC)cc2)C1	ZINC001033984811	1342130318	/nfs/dbraw/zinc/13/03/18/1342130318.db2.gz	ZQOCRENGQXCWIQ-YZGWKJHDSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccc(OC)cc2Cl)C1	ZINC001033989291	1342132712	/nfs/dbraw/zinc/13/27/12/1342132712.db2.gz	YIDKEPRTYXTRJH-AWEZNQCLSA-N	0	3	336.863	3.461	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2ccc3nc(C)sc3c2)C1	ZINC001034006940	1342144665	/nfs/dbraw/zinc/14/46/65/1342144665.db2.gz	GYPYQGHWVDJYFH-INIZCTEOSA-N	0	3	341.480	3.164	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2ccc(COC(C)C)cc2)C1	ZINC001034033855	1342173303	/nfs/dbraw/zinc/17/33/03/1342173303.db2.gz	CPCDFXYKUCVDFS-HXUWFJFHSA-N	0	3	342.483	3.171	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc(N(C)C)cc2F)C1	ZINC001034250765	1342348141	/nfs/dbraw/zinc/34/81/41/1342348141.db2.gz	SJJPJRDHMQHGKL-HNNXBMFYSA-N	0	3	333.451	3.052	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2coc3cc(F)ccc23)C1	ZINC001034281225	1342370527	/nfs/dbraw/zinc/37/05/27/1342370527.db2.gz	HVBWWHXZSJKQKC-OAHLLOKOSA-N	0	3	328.387	3.180	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@@H]2CCc3cc(C)ccc3O2)C1	ZINC001034311093	1342392739	/nfs/dbraw/zinc/39/27/39/1342392739.db2.gz	ZAVYHSKREJLCHY-ICSRJNTNSA-N	0	3	342.483	3.235	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccncc2OC(C)C)C1	ZINC001034331580	1342405637	/nfs/dbraw/zinc/40/56/37/1342405637.db2.gz	TZEOVIPZHJRCAU-INIZCTEOSA-N	0	3	331.460	3.029	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cc(-c3cccs3)n[nH]2)C1	ZINC001034407756	1342470378	/nfs/dbraw/zinc/47/03/78/1342470378.db2.gz	DYKYQHFPOTWEMF-CQSZACIVSA-N	0	3	344.484	3.299	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)c2cccc(N3CCCC3)c2)C1	ZINC001034462522	1342518151	/nfs/dbraw/zinc/51/81/51/1342518151.db2.gz	OQSVIELXTQGYES-GOSISDBHSA-N	0	3	327.472	3.057	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2coc(C3CCCC3)n2)C1	ZINC001034464772	1342519208	/nfs/dbraw/zinc/51/92/08/1342519208.db2.gz	BJZCMFCQDZUCKZ-INIZCTEOSA-N	0	3	331.460	3.493	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cncc(C(F)(F)F)c2)C1	ZINC001034472682	1342527405	/nfs/dbraw/zinc/52/74/05/1342527405.db2.gz	WEKLZHORHQFTMP-OAHLLOKOSA-N	0	3	341.377	3.261	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)c2ccc(N(CC)CC)cc2)C1	ZINC001034506832	1342564839	/nfs/dbraw/zinc/56/48/39/1342564839.db2.gz	NBTLUBOIQLRWPT-GOSISDBHSA-N	0	3	329.488	3.303	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)c2ccc(OCC(C)C)cc2)C1	ZINC001034513797	1342572066	/nfs/dbraw/zinc/57/20/66/1342572066.db2.gz	CGKYWQNWJCZBAI-SFHVURJKSA-N	0	3	330.472	3.492	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)c2ccc(OCC(C)C)cc2)C1	ZINC001034513796	1342572157	/nfs/dbraw/zinc/57/21/57/1342572157.db2.gz	CGKYWQNWJCZBAI-GOSISDBHSA-N	0	3	330.472	3.492	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)Cn2ccc3ccccc32)C1	ZINC001034533093	1342589355	/nfs/dbraw/zinc/58/93/55/1342589355.db2.gz	XPFLCMJIPZNPTE-GOSISDBHSA-N	0	3	325.456	3.188	20	30		EGEDHN
C=C(Cl)CN1CCCC[C@H](NC(=O)c2ccccc2CN(C)C)C1	ZINC001034545063	1342607185	/nfs/dbraw/zinc/60/71/85/1342607185.db2.gz	XRBXREUNVSDKHI-KRWDZBQOSA-N	0	3	349.906	3.085	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)[C@@]2(C)C=CCC2)CC1	ZINC001034707830	1342703345	/nfs/dbraw/zinc/70/33/45/1342703345.db2.gz	SXJZKBGPPFRKGE-DZKIICNBSA-N	0	3	341.293	3.268	20	30		EGEDHN
C[C@@]1(C(=O)N[C@H]2CC[C@H](NCc3ccccc3C#N)CC2)C=CCC1	ZINC001034711159	1342707797	/nfs/dbraw/zinc/70/77/97/1342707797.db2.gz	VGRBDTJLJADMCR-SFHLNBCPSA-N	0	3	337.467	3.432	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)NCc1ccc(CNCc2cccc(C#N)c2)cc1	ZINC001034806431	1342771928	/nfs/dbraw/zinc/77/19/28/1342771928.db2.gz	GFGAHORSIYLNSQ-FOIQADDNSA-N	0	3	333.435	3.120	20	30		EGEDHN
C[C@@H]1C[C@@H]1C(=O)NCc1ccc(CNCc2ccc(C#N)s2)cc1	ZINC001034808057	1342773333	/nfs/dbraw/zinc/77/33/33/1342773333.db2.gz	UHVIYJZVADTYBY-ACJLOTCBSA-N	0	3	339.464	3.182	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2cccc(N(C)C)c2)C12CCC2	ZINC001078794418	1357088552	/nfs/dbraw/zinc/08/85/52/1357088552.db2.gz	HOMFQFFHGHOAEN-IRXDYDNUSA-N	0	3	347.890	3.136	20	30		EGEDHN
Cc1cc(C)c(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)s2)o1	ZINC001034896752	1342826341	/nfs/dbraw/zinc/82/63/41/1342826341.db2.gz	PKAOJNLUDCLNPT-CQSZACIVSA-N	0	3	343.452	3.224	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2scnc2Cl)C12CCC2	ZINC001078812694	1357093782	/nfs/dbraw/zinc/09/37/82/1357093782.db2.gz	OKXXRUJNCCRVHI-UWVGGRQHSA-N	0	3	346.283	3.180	20	30		EGEDHN
CCCC(=O)N1CCC2(CCN(Cc3ccccc3C#N)C2)CC1	ZINC001035148447	1342960336	/nfs/dbraw/zinc/96/03/36/1342960336.db2.gz	IBUVRLJNZSZGQL-UHFFFAOYSA-N	0	3	325.456	3.173	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(C2)CCN(C(=O)CC2CC2)CC3)s1	ZINC001035151178	1342965155	/nfs/dbraw/zinc/96/51/55/1342965155.db2.gz	WCMGNWVGQJELOK-UHFFFAOYSA-N	0	3	343.496	3.234	20	30		EGEDHN
C[C@@H]1C[C@@H]1C(=O)N1CCC2(CCN(CC#Cc3ccccc3)C2)CC1	ZINC001035156970	1342972838	/nfs/dbraw/zinc/97/28/38/1342972838.db2.gz	OSMVDFOGJOTCJT-QUCCMNQESA-N	0	3	336.479	3.009	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1sc(Cl)nc1C)CC2	ZINC001035716446	1343149535	/nfs/dbraw/zinc/14/95/35/1343149535.db2.gz	ISPGNVOPJRZZJV-UHFFFAOYSA-N	0	3	339.892	3.219	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC2(CN(C[C@H]3CC[C@@H](C)O3)C2)CC1	ZINC001035767725	1343180028	/nfs/dbraw/zinc/18/00/28/1343180028.db2.gz	VOJAVFJOCYELDH-IAGOWNOFSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1csc(C(C)C)n1)CC2	ZINC001035817754	1343213957	/nfs/dbraw/zinc/21/39/57/1343213957.db2.gz	SHHFRVSZCMMHQY-UHFFFAOYSA-N	0	3	333.501	3.381	20	30		EGEDHN
C[C@@H]1CN(C(=O)/C=C/c2ccco2)CC[C@H]1NCc1ccccc1C#N	ZINC001035903142	1343260357	/nfs/dbraw/zinc/26/03/57/1343260357.db2.gz	BDMVMTIXYPGBRW-LMFNFFQTSA-N	0	3	349.434	3.191	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@@H](NCc2cc(F)ccc2C#N)[C@H](C)C1	ZINC001035907377	1343264120	/nfs/dbraw/zinc/26/41/20/1343264120.db2.gz	KVVHAUHLTYTKMV-RDTXWAMCSA-N	0	3	331.435	3.070	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC2CCC2)CC[C@@H]1NCc1cc(F)ccc1C#N	ZINC001035978318	1343297590	/nfs/dbraw/zinc/29/75/90/1343297590.db2.gz	REUQJBQTYGBSBS-KUHUBIRLSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](NCc3ncc(C)s3)[C@H](C)C2)C1	ZINC001036168663	1343342253	/nfs/dbraw/zinc/34/22/53/1343342253.db2.gz	JJZTUDFSJLCMKN-HIFRSBDPSA-N	0	3	333.501	3.134	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](NCc3ccn(C(C)C)n3)[C@@H](C)C2)C1	ZINC001036170748	1343343843	/nfs/dbraw/zinc/34/38/43/1343343843.db2.gz	UDEZBGHFKCKHGM-FUHWJXTLSA-N	0	3	344.503	3.147	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](NCc3ccccc3C#N)[C@H](C)C2)C1	ZINC001036171038	1343344255	/nfs/dbraw/zinc/34/42/55/1343344255.db2.gz	VVRYXBYQOPDUSQ-APWZRJJASA-N	0	3	337.467	3.241	20	30		EGEDHN
C[C@H](NCc1c(F)cccc1F)[C@@H]1CCCN(C(=O)C#CC2CC2)C1	ZINC001036405036	1343467417	/nfs/dbraw/zinc/46/74/17/1343467417.db2.gz	OOPSREWYCFRNMH-GOEBONIOSA-N	0	3	346.421	3.095	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCCN(C(=O)C2(C)CC2)C1	ZINC001036408337	1343469182	/nfs/dbraw/zinc/46/91/82/1343469182.db2.gz	ILIJPMFCYHFJRG-YJBOKZPZSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]([C@@H](C)NCc3cscn3)C2)C1	ZINC001036441761	1343489895	/nfs/dbraw/zinc/48/98/95/1343489895.db2.gz	CWORPFMKSDFZOT-CABCVRRESA-N	0	3	333.501	3.216	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H]([C@H](C)NCc2nccn2CC)C1	ZINC001036444321	1343491728	/nfs/dbraw/zinc/49/17/28/1343491728.db2.gz	YPEZCFWAWXFETO-IRXDYDNUSA-N	0	3	346.519	3.222	20	30		EGEDHN
O=C(c1ccccc1)N1CC[C@@H]2[C@H](CCN2CC#Cc2ccccc2)C1	ZINC001036627244	1343584730	/nfs/dbraw/zinc/58/47/30/1343584730.db2.gz	JRHMFQUXYXDONN-FGZHOGPDSA-N	0	3	344.458	3.275	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@H]2[C@H](CCN2Cc2ccc(C#N)cc2F)C1	ZINC001036632321	1343589566	/nfs/dbraw/zinc/58/95/66/1343589566.db2.gz	LWQNPKDMSFKJSS-MJGOQNOKSA-N	0	3	341.430	3.086	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CN(C(=O)CC4CCC4)CC[C@@H]32)s1	ZINC001036677821	1343618882	/nfs/dbraw/zinc/61/88/82/1343618882.db2.gz	IDNAMIOMRGOQGN-QAPCUYQASA-N	0	3	343.496	3.233	20	30		EGEDHN
C/C=C(\C)C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccc(C#N)s2)C1	ZINC001036682364	1343624670	/nfs/dbraw/zinc/62/46/70/1343624670.db2.gz	CCGCMCOASFWAID-PCTNJGBESA-N	0	3	329.469	3.009	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@@H]2[C@H](CCN2Cc2ccccc2Cl)C1	ZINC001036714092	1343646855	/nfs/dbraw/zinc/64/68/55/1343646855.db2.gz	SIASPDXQFAVIAT-IEBWSBKVSA-N	0	3	342.870	3.176	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]2[C@H](CCN2Cc2cncs2)C1	ZINC001036794331	1343726587	/nfs/dbraw/zinc/72/65/87/1343726587.db2.gz	SSUNSDYTJTXDFE-GDBMZVCRSA-N	0	3	333.501	3.168	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H]3[C@H](CCN3Cc3cc(C)no3)C2)CC1	ZINC001036810708	1343745606	/nfs/dbraw/zinc/74/56/06/1343745606.db2.gz	GZRZEFULFZWZET-IEBWSBKVSA-N	0	3	343.471	3.152	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H]3[C@@H](CCN3Cc3conc3C)C2)CC1	ZINC001036810887	1343745890	/nfs/dbraw/zinc/74/58/90/1343745890.db2.gz	JONXIIPRVPESNP-HKUYNNGSSA-N	0	3	343.471	3.152	20	30		EGEDHN
CC1(C(=O)N2CC[C@H]3[C@H](CCN3Cc3ccccc3C#N)C2)CC=CC1	ZINC001036812816	1343748780	/nfs/dbraw/zinc/74/87/80/1343748780.db2.gz	MTWSHAXWNHBVAW-UXHICEINSA-N	0	3	349.478	3.337	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCC[C@H]2CNCc2csc(C)n2)C1	ZINC001037071208	1343964527	/nfs/dbraw/zinc/96/45/27/1343964527.db2.gz	CQDBOBWVGIFRQE-GOEBONIOSA-N	0	3	333.501	3.182	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCC[C@H]2CNCc2csc(CC)n2)C1	ZINC001037071433	1343965117	/nfs/dbraw/zinc/96/51/17/1343965117.db2.gz	HCHABRXGSRRJDN-HOCLYGCPSA-N	0	3	347.528	3.436	20	30		EGEDHN
N#Cc1ccccc1CNC[C@H]1CCCC[C@@H]1NC(=O)c1ccccn1	ZINC001037159644	1344009349	/nfs/dbraw/zinc/00/93/49/1344009349.db2.gz	GYYCXJYKVQFOEB-MOPGFXCFSA-N	0	3	348.450	3.032	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCCC[C@@H]2CNCc2nccs2)C1	ZINC001037237113	1344059850	/nfs/dbraw/zinc/05/98/50/1344059850.db2.gz	UGQKXZFJNVIGJI-CABCVRRESA-N	0	3	333.501	3.264	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCC[C@H]2CNCc2nccs2)C1	ZINC001037237118	1344060102	/nfs/dbraw/zinc/06/01/02/1344060102.db2.gz	UGQKXZFJNVIGJI-LSDHHAIUSA-N	0	3	333.501	3.264	20	30		EGEDHN
C/C=C(\C)C(=O)N1CC[C@H](NCc2cc(F)ccc2C#N)[C@H](CC)C1	ZINC001037822105	1344118524	/nfs/dbraw/zinc/11/85/24/1344118524.db2.gz	MSZPZRZZIFBXNS-LXKKRYNASA-N	0	3	343.446	3.380	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](NCc3nocc3C)[C@@H](CC)C2)C1	ZINC001037915770	1344176024	/nfs/dbraw/zinc/17/60/24/1344176024.db2.gz	RVAIQPGGIPIKMC-HOTGVXAUSA-N	0	3	331.460	3.056	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1cc(C)nn1C(CC)CC	ZINC001038426462	1344423343	/nfs/dbraw/zinc/42/33/43/1344423343.db2.gz	WNDAEGDHEQFGHH-QGZVFWFLSA-N	0	3	332.492	3.323	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1cnoc1-c1ccccc1	ZINC001038860999	1344616772	/nfs/dbraw/zinc/61/67/72/1344616772.db2.gz	IKBXIIUUJHYVHL-MRXNPFEDSA-N	0	3	325.412	3.112	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C2CCCCC2)CC[C@H]1c1ccc(F)cc1	ZINC001079148909	1357196817	/nfs/dbraw/zinc/19/68/17/1357196817.db2.gz	RUFPPNSMRXEDCN-VQTJNVASSA-N	0	3	342.458	3.313	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1cc2ccccc2n1CC	ZINC001039044789	1344732251	/nfs/dbraw/zinc/73/22/51/1344732251.db2.gz	MKYMOWVTVVHCIO-KRWDZBQOSA-N	0	3	325.456	3.432	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)c3ccc(C)nc3)CC2)C1	ZINC001039110890	1344782205	/nfs/dbraw/zinc/78/22/05/1344782205.db2.gz	XPOSBJZVEGWKMS-SFHVURJKSA-N	0	3	347.890	3.317	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)[C@@H](C)n3cccc3)CC2)C1	ZINC001039125108	1344801412	/nfs/dbraw/zinc/80/14/12/1344801412.db2.gz	PELFCKLCAPYSRR-SJLPKXTDSA-N	0	3	349.906	3.362	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)CCn3cccc3)CC2)C1	ZINC001039166199	1344852100	/nfs/dbraw/zinc/85/21/00/1344852100.db2.gz	SKAFBKJQQWTAGQ-SFHVURJKSA-N	0	3	349.906	3.191	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccoc2CC)C1	ZINC001039221315	1344938824	/nfs/dbraw/zinc/93/88/24/1344938824.db2.gz	NQLFXRMTDRUFMO-FUHWJXTLSA-N	0	3	328.456	3.182	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cccc3ncccc32)C1	ZINC001039226901	1344945485	/nfs/dbraw/zinc/94/54/85/1344945485.db2.gz	ZRXAGGIISVXPLL-UTKZUKDTSA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2occ3c2CCC3)C1	ZINC001039229922	1344949559	/nfs/dbraw/zinc/94/95/59/1344949559.db2.gz	OZXDLJKJYKSKQL-VQIMIIECSA-N	0	3	340.467	3.108	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cccc3c2ccn3C)C1	ZINC001039232868	1344952934	/nfs/dbraw/zinc/95/29/34/1344952934.db2.gz	ZGECQWYNJVREIN-PXNSSMCTSA-N	0	3	349.478	3.128	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)CCc2cccs2)C1	ZINC001039237613	1344960296	/nfs/dbraw/zinc/96/02/96/1344960296.db2.gz	DHHAARUMDXFULY-AEFFLSMTSA-N	0	3	330.497	3.017	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(F)cc2F)C1	ZINC001039238527	1344962308	/nfs/dbraw/zinc/96/23/08/1344962308.db2.gz	IVSFUVOGEQZZNH-BEFAXECRSA-N	0	3	346.421	3.305	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccc3ccccc3n2)C1	ZINC001039242612	1344969040	/nfs/dbraw/zinc/96/90/40/1344969040.db2.gz	BYOAVOVMKUUZEL-GHTZIAJQSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccoc2CCC)C1	ZINC001039242965	1344969246	/nfs/dbraw/zinc/96/92/46/1344969246.db2.gz	DUGXQRWQXNUUQB-FUHWJXTLSA-N	0	3	328.456	3.182	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(OC)cs2)C1	ZINC001039245319	1344973979	/nfs/dbraw/zinc/97/39/79/1344973979.db2.gz	NTQCDLPRMMEHEB-WBVHZDCISA-N	0	3	346.496	3.097	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)CCc2ccccc2)C1	ZINC001039246018	1344975280	/nfs/dbraw/zinc/97/52/80/1344975280.db2.gz	OLJGUJYZFIRZKZ-NHCUHLMSSA-N	0	3	338.495	3.346	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ncccc2Cl)C1	ZINC001039249988	1344980232	/nfs/dbraw/zinc/98/02/32/1344980232.db2.gz	LFKGSILYMCUTRF-NVXWUHKLSA-N	0	3	345.874	3.075	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(OCC)cc2)C1	ZINC001039249825	1344980448	/nfs/dbraw/zinc/98/04/48/1344980448.db2.gz	KDIZIYBTIYWZEY-QUCCMNQESA-N	0	3	340.467	3.035	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(F)s2)C1	ZINC001039250454	1344981674	/nfs/dbraw/zinc/98/16/74/1344981674.db2.gz	KWJLNKWOBXTNNN-HUUCEWRRSA-N	0	3	334.460	3.227	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(Cl)cn2)C1	ZINC001039258695	1344986622	/nfs/dbraw/zinc/98/66/22/1344986622.db2.gz	ZCTOPPYZSRSXLV-QAPCUYQASA-N	0	3	345.874	3.075	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(C#N)c[nH]1	ZINC001039363108	1345029523	/nfs/dbraw/zinc/02/95/23/1345029523.db2.gz	WKLFJKIUGIJVBS-LZQZEXGQSA-N	0	3	348.450	3.326	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](CC)OC1CCCCC1	ZINC001039375225	1345033372	/nfs/dbraw/zinc/03/33/72/1345033372.db2.gz	UULBQAMPOOEFJN-HBFSDRIKSA-N	0	3	346.515	3.203	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2oc(C)nc2c1	ZINC001039392613	1345041328	/nfs/dbraw/zinc/04/13/28/1345041328.db2.gz	XBAWZGJDISZQGY-SJORKVTESA-N	0	3	339.439	3.391	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(F)ccc1CC	ZINC001039399356	1345046763	/nfs/dbraw/zinc/04/67/63/1345046763.db2.gz	WAIIOCITFVGVRD-MSOLQXFVSA-N	0	3	328.431	3.090	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)CCc1ccccc1OCC	ZINC001039400574	1345047206	/nfs/dbraw/zinc/04/72/06/1345047206.db2.gz	ILSXXAVTDLYGIR-MOPGFXCFSA-N	0	3	342.483	3.269	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(C)nc1C(C)C	ZINC001039413320	1345055631	/nfs/dbraw/zinc/05/56/31/1345055631.db2.gz	ODZPJOFHDIIBMX-MSOLQXFVSA-N	0	3	339.483	3.216	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(F)ccc1OC	ZINC001039414634	1345056333	/nfs/dbraw/zinc/05/63/33/1345056333.db2.gz	GWAVWUMTKXDZPK-CVEARBPZSA-N	0	3	332.419	3.089	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1cc(F)ccc1F	ZINC001039426148	1345062572	/nfs/dbraw/zinc/06/25/72/1345062572.db2.gz	RWGBNIQYTAMZRF-SJORKVTESA-N	0	3	334.410	3.149	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1[C@@H]2CCCCCC[C@@H]21	ZINC001039442637	1345068791	/nfs/dbraw/zinc/06/87/91/1345068791.db2.gz	MESZJOORHIIRDN-RMMWZPCPSA-N	0	3	328.500	3.291	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1[nH]ccc1-c1ccccc1	ZINC001039459572	1345079346	/nfs/dbraw/zinc/07/93/46/1345079346.db2.gz	BWMVQHHSYJNSIT-MOPGFXCFSA-N	0	3	347.462	3.384	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H]1CCc2ccccc2C1	ZINC001039464285	1345082465	/nfs/dbraw/zinc/08/24/65/1345082465.db2.gz	CDIWARZJRWDWOB-UIFIKXQLSA-N	0	3	338.495	3.433	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)Oc1cccc(C)c1	ZINC001039467579	1345085418	/nfs/dbraw/zinc/08/54/18/1345085418.db2.gz	QSGPIZQSGHMPDF-OTWHNJEPSA-N	0	3	342.483	3.404	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@H](C)c1ccc(OC)cc1	ZINC001039472960	1345087952	/nfs/dbraw/zinc/08/79/52/1345087952.db2.gz	NZCJQNOIQDSFNO-UHOSZYNNSA-N	0	3	342.483	3.440	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc(OC(C)C)cc1	ZINC001039473474	1345088468	/nfs/dbraw/zinc/08/84/68/1345088468.db2.gz	NXGITTMJAJDNTM-MOPGFXCFSA-N	0	3	342.483	3.268	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3ccn(C4CCCC4)n3)C2)C1	ZINC001040233404	1345387731	/nfs/dbraw/zinc/38/77/31/1345387731.db2.gz	UJEDULXDUBVVIX-FQEVSTJZSA-N	0	3	342.487	3.112	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)C[C@@H]3CCC(F)(F)C3)C2)C1	ZINC001040233115	1345387788	/nfs/dbraw/zinc/38/77/88/1345387788.db2.gz	WTDNJGXEIJIPCU-FUHWJXTLSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@H](c3ccccc3)C3CC3)C2)C1	ZINC001040289088	1345413552	/nfs/dbraw/zinc/41/35/52/1345413552.db2.gz	CCNZHOBQEIJLEB-IFMALSPDSA-N	0	3	336.479	3.128	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@]2(C1)CCCN(Cc1cnccc1C)C2	ZINC001040327662	1345434153	/nfs/dbraw/zinc/43/41/53/1345434153.db2.gz	GQCMRWHCCHEAKB-NRFANRHFSA-N	0	3	341.499	3.417	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ccoc3C3CC3)C2)C1	ZINC001040354105	1345449679	/nfs/dbraw/zinc/44/96/79/1345449679.db2.gz	MXEFUOKFVBEPRM-HXUWFJFHSA-N	0	3	326.440	3.108	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3cc([C@@H](C)CC)no3)C2)C1	ZINC001040436169	1345499545	/nfs/dbraw/zinc/49/95/45/1345499545.db2.gz	SFJOKJPHZBANAX-KXBFYZLASA-N	0	3	331.460	3.302	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)C[C@H](C)c3ccco3)C2)C1	ZINC001040493459	1345518935	/nfs/dbraw/zinc/51/89/35/1345518935.db2.gz	LIPJJSBHBYYXLN-PXNSSMCTSA-N	0	3	328.456	3.111	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cc4c(s3)CCC4)C2)C1	ZINC001040519532	1345530679	/nfs/dbraw/zinc/53/06/79/1345530679.db2.gz	MBNCMNKXTLCMKD-HXUWFJFHSA-N	0	3	342.508	3.188	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3ccc(CC(C)C)cc3)C2)C1	ZINC001040524889	1345532988	/nfs/dbraw/zinc/53/29/88/1345532988.db2.gz	NOXOUAGLFYCFGY-QFIPXVFZSA-N	0	3	338.495	3.446	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3ccc4[nH]c(C)c(C)c4c3)C2)C1	ZINC001040524978	1345533110	/nfs/dbraw/zinc/53/31/10/1345533110.db2.gz	PIIQVXGBGWOCCE-QFIPXVFZSA-N	0	3	349.478	3.346	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3ccc(C(C)(F)F)cc3)C2)C1	ZINC001040557501	1345545400	/nfs/dbraw/zinc/54/54/00/1345545400.db2.gz	YKCXYHCKKKSTMV-FQEVSTJZSA-N	0	3	346.421	3.360	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@@H]3CCC[C@@H]3C(F)F)C2)CC1	ZINC001040730579	1345571989	/nfs/dbraw/zinc/57/19/89/1345571989.db2.gz	WOPZVGQADZOWMK-JKSUJKDBSA-N	0	3	338.442	3.006	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cnc4ccccc4c3C)C2)CC1	ZINC001040772480	1345577377	/nfs/dbraw/zinc/57/73/77/1345577377.db2.gz	CNBGMKCLNXPZTA-UHFFFAOYSA-N	0	3	347.462	3.105	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)C3[C@H]4CCCCCC[C@H]34)C2)CC1	ZINC001040864826	1345589699	/nfs/dbraw/zinc/58/96/99/1345589699.db2.gz	KIBJOINKWGNMBU-ROUUACIJSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cc4sccc4[nH]3)C2)CC1	ZINC001040906776	1345597618	/nfs/dbraw/zinc/59/76/18/1345597618.db2.gz	LQBGAPYJSZFBNL-UHFFFAOYSA-N	0	3	341.480	3.181	20	30		EGEDHN
CC(C)(C)C(=O)N1CCC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001040924114	1345601714	/nfs/dbraw/zinc/60/17/14/1345601714.db2.gz	UJQJIHODFDZDMQ-UHFFFAOYSA-N	0	3	339.483	3.419	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@H](C)c3cccc(Cl)c3)C2)CC1	ZINC001040943855	1345605438	/nfs/dbraw/zinc/60/54/38/1345605438.db2.gz	AMFLHVDRHNBRDL-MRXNPFEDSA-N	0	3	344.886	3.391	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cccn3C(C)C)C2)CC1	ZINC001040940596	1345605497	/nfs/dbraw/zinc/60/54/97/1345605497.db2.gz	CFXSLQVLWWDPOX-UHFFFAOYSA-N	0	3	327.472	3.020	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@@H](C)c3cccc(Cl)c3)C2)CC1	ZINC001040943851	1345605569	/nfs/dbraw/zinc/60/55/69/1345605569.db2.gz	AMFLHVDRHNBRDL-INIZCTEOSA-N	0	3	344.886	3.391	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@H](C)n3c(C)ccc3C)C2)CC1	ZINC001040948771	1345607568	/nfs/dbraw/zinc/60/75/68/1345607568.db2.gz	ZYKLZYQRIBYKPS-IBGZPJMESA-N	0	3	341.499	3.004	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@]3(CCN(C(=O)C[C@H]4C=CCC4)C3)C2)c1	ZINC001041055809	1345638762	/nfs/dbraw/zinc/63/87/62/1345638762.db2.gz	ZDOBNPJCSQHPTP-AVRDEDQJSA-N	0	3	349.478	3.339	20	30		EGEDHN
C[C@H](c1cccc(F)c1)N1CC[C@]2(CCN(C(=O)C#CC3CC3)C2)C1	ZINC001041266708	1345691051	/nfs/dbraw/zinc/69/10/51/1345691051.db2.gz	VGOKSWZBBNHHRE-IERDGZPVSA-N	0	3	340.442	3.225	20	30		EGEDHN
CC(C(=O)N1CC[C@]2(CCN(Cc3ccc(C#N)cc3)C2)C1)=C1CCC1	ZINC001041275092	1345691984	/nfs/dbraw/zinc/69/19/84/1345691984.db2.gz	DCUQTQISQNVAPP-QFIPXVFZSA-N	0	3	349.478	3.483	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3cccc4c3CCCCC4)C2)C1	ZINC001041388379	1345714391	/nfs/dbraw/zinc/71/43/91/1345714391.db2.gz	WJBDYVZCRNZYJE-QFIPXVFZSA-N	0	3	336.479	3.127	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cccc(-n4cccc4)c3)C2)C1	ZINC001041443821	1345728699	/nfs/dbraw/zinc/72/86/99/1345728699.db2.gz	WSWXRLJPFCFCQH-QFIPXVFZSA-N	0	3	347.462	3.039	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cn(CC)c4ccccc34)C2)C1	ZINC001041452180	1345731870	/nfs/dbraw/zinc/73/18/70/1345731870.db2.gz	AIECWIULOFETOY-QFIPXVFZSA-N	0	3	349.478	3.223	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)CCc3cccc(Cl)c3)C2)C1	ZINC001041514037	1345748976	/nfs/dbraw/zinc/74/89/76/1345748976.db2.gz	CQHFTEORJRJPNR-HXUWFJFHSA-N	0	3	344.886	3.220	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@]2(CCN(Cc3ccccn3)C2)C1	ZINC001041627044	1345801390	/nfs/dbraw/zinc/80/13/90/1345801390.db2.gz	ZPUOOKPXNVSFSQ-VQTJNVASSA-N	0	3	327.472	3.108	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3cc(F)cc(Cl)c3)C2)C1	ZINC001041709059	1345825994	/nfs/dbraw/zinc/82/59/94/1345825994.db2.gz	QYXRHWYLDXNSDC-SFHVURJKSA-N	0	3	334.822	3.040	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)[C@@H](c3ccccc3)C(C)C)C2)C1	ZINC001041711787	1345826686	/nfs/dbraw/zinc/82/66/86/1345826686.db2.gz	ILCWIQXBSZITJD-IFMALSPDSA-N	0	3	338.495	3.374	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001041719307	1345829946	/nfs/dbraw/zinc/82/99/46/1345829946.db2.gz	AMLXCABWPCOMDM-UTKZUKDTSA-N	0	3	339.483	3.275	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)[C@H](CC)Cc3ccccc3)C2)C1	ZINC001041720033	1345830271	/nfs/dbraw/zinc/83/02/71/1345830271.db2.gz	HKZFOCJGCNQFRF-IFMALSPDSA-N	0	3	338.495	3.203	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3sc(C(C)C)nc3C)C2)C1	ZINC001041829061	1345865927	/nfs/dbraw/zinc/86/59/27/1345865927.db2.gz	MLSGFQRBPLWGEO-LJQANCHMSA-N	0	3	345.512	3.136	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)[C@@H](C)c3ccc(F)c(F)c3)C2)C1	ZINC001041838819	1345868126	/nfs/dbraw/zinc/86/81/26/1345868126.db2.gz	CFMSEEFHNQNJMO-MGPUTAFESA-N	0	3	346.421	3.016	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)C(C)(C)c3ccccc3C)C2)C1	ZINC001041858907	1345875556	/nfs/dbraw/zinc/87/55/56/1345875556.db2.gz	CQVRCWRJKIVIEU-QFIPXVFZSA-N	0	3	338.495	3.220	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3CCN(C(=O)C4=CCCC4)C[C@H]32)c1	ZINC001042010915	1345924257	/nfs/dbraw/zinc/92/42/57/1345924257.db2.gz	RWDJMXHTRZCONZ-AZUAARDMSA-N	0	3	335.451	3.091	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccn(C4CCCCC4)n3)C[C@H]21	ZINC001042063422	1345933359	/nfs/dbraw/zinc/93/33/59/1345933359.db2.gz	WMMMGLATTDCRCR-QFBILLFUSA-N	0	3	342.487	3.111	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3ccoc3C(F)(F)F)C[C@@H]21	ZINC001042076068	1345938926	/nfs/dbraw/zinc/93/89/26/1345938926.db2.gz	QRAFYVHHYIJIFP-JSGCOSHPSA-N	0	3	342.361	3.411	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3ccoc3C(F)(F)F)C[C@H]21	ZINC001042076067	1345938954	/nfs/dbraw/zinc/93/89/54/1345938954.db2.gz	QRAFYVHHYIJIFP-GXTWGEPZSA-N	0	3	342.361	3.411	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3cccc4c3CCCC4)C[C@H]21	ZINC001042077613	1345939171	/nfs/dbraw/zinc/93/91/71/1345939171.db2.gz	MLIDANYDPPDACD-GHTZIAJQSA-N	0	3	336.479	3.125	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3cc4ccncc4s3)C[C@H]21	ZINC001042096431	1345943171	/nfs/dbraw/zinc/94/31/71/1345943171.db2.gz	YCRPTDLONVGCKY-GDBMZVCRSA-N	0	3	341.480	3.409	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cc(F)cc4ccoc43)C[C@@H]21	ZINC001042122192	1345949846	/nfs/dbraw/zinc/94/98/46/1345949846.db2.gz	NAZZLFRAIZYIOC-KDOFPFPSSA-N	0	3	340.398	3.132	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)Cc3cccc(C(C)C)c3)C[C@H]21	ZINC001042136293	1345952955	/nfs/dbraw/zinc/95/29/55/1345952955.db2.gz	UDXUDUGUGFNQPH-PZJWPPBQSA-N	0	3	338.495	3.299	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)COc3ccc(C(C)C)cc3)C[C@@H]21	ZINC001042139574	1345954059	/nfs/dbraw/zinc/95/40/59/1345954059.db2.gz	XUIYAEHOGLRVTO-QUCCMNQESA-N	0	3	342.483	3.298	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(-c4ccccc4)on3)C[C@@H]21	ZINC001042141712	1345954305	/nfs/dbraw/zinc/95/43/05/1345954305.db2.gz	IMUCSXYFASLICF-YJBOKZPZSA-N	0	3	337.423	3.064	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cnc4ccsc4c3)C[C@@H]21	ZINC001042189046	1345975816	/nfs/dbraw/zinc/97/58/16/1345975816.db2.gz	ZSCFSSQTRNKREM-CJNGLKHVSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(F)c(Cl)cc3F)C[C@@H]21	ZINC001042207777	1345986490	/nfs/dbraw/zinc/98/64/90/1345986490.db2.gz	UCOHLNZKOIFMRM-ZBEGNZNMSA-N	0	3	340.801	3.341	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccccc3-n3cccc3)C[C@H]21	ZINC001042212312	1345987728	/nfs/dbraw/zinc/98/77/28/1345987728.db2.gz	BFQLWOGMEWINNW-GHTZIAJQSA-N	0	3	347.462	3.037	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(C(C)C)nc3CC)C[C@@H]21	ZINC001042237966	1346000125	/nfs/dbraw/zinc/00/01/25/1346000125.db2.gz	NZSRTFSVUJTETH-JXFKEZNVSA-N	0	3	341.499	3.490	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3oc(C(C)C)nc3C)C[C@H]21	ZINC001042262691	1346010116	/nfs/dbraw/zinc/01/01/16/1346010116.db2.gz	OLTOIAXQARVJOM-JKSUJKDBSA-N	0	3	331.460	3.219	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(OC)cc3Cl)C[C@H]21	ZINC001042272078	1346014310	/nfs/dbraw/zinc/01/43/10/1346014310.db2.gz	LAIFVJNJEUBZIU-CXAGYDPISA-N	0	3	334.847	3.071	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc4scnc4c3)C[C@@H]21	ZINC001042296741	1346021554	/nfs/dbraw/zinc/02/15/54/1346021554.db2.gz	FJKBWOZYZQDPPG-CJNGLKHVSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cnn(C(CC)CC)c3C)C[C@@H]21	ZINC001042305003	1346025560	/nfs/dbraw/zinc/02/55/60/1346025560.db2.gz	VRPGRKXSHFMMIH-LPHOPBHVSA-N	0	3	344.503	3.275	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cnn(C(C)C)c3C3CC3)C[C@@H]21	ZINC001042308068	1346027080	/nfs/dbraw/zinc/02/70/80/1346027080.db2.gz	SJMCQRFTJXTQMG-QAPCUYQASA-N	0	3	342.487	3.064	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)c3ccc(Cl)c4occc43)C[C@H]21	ZINC001042309001	1346027619	/nfs/dbraw/zinc/02/76/19/1346027619.db2.gz	JFUFSGJUQHRLMI-CXAGYDPISA-N	0	3	342.826	3.256	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)Cc3cccc4ccccc43)C[C@H]21	ZINC001042323094	1346033217	/nfs/dbraw/zinc/03/32/17/1346033217.db2.gz	RAAWTTNPCLJSNM-SIKLNZKXSA-N	0	3	346.474	3.328	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)C34CC5CC(CC(C5)C3)C4)C[C@@H]21	ZINC001042327944	1346036865	/nfs/dbraw/zinc/03/68/65/1346036865.db2.gz	QJJYWFKOHNAWNT-BIQFSMEISA-N	0	3	340.511	3.149	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cc4ccccc4n3CC)C[C@H]21	ZINC001042367389	1346058527	/nfs/dbraw/zinc/05/85/27/1346058527.db2.gz	GTGMQQUXFOWAOY-OXQOHEQNSA-N	0	3	337.467	3.384	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3cnc(C(C)(C)C)s3)C[C@@H]21	ZINC001042371722	1346061158	/nfs/dbraw/zinc/06/11/58/1346061158.db2.gz	VMMGGOWXPMCRGP-CABCVRRESA-N	0	3	345.512	3.000	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3coc(C4CCCCC4)n3)C[C@@H]21	ZINC001042371281	1346061323	/nfs/dbraw/zinc/06/13/23/1346061323.db2.gz	NZWSTTXOGQCSFQ-QAPCUYQASA-N	0	3	343.471	3.445	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C34CC(c5ccccc5)(C3)C4)C[C@@H]21	ZINC001042376333	1346063788	/nfs/dbraw/zinc/06/37/88/1346063788.db2.gz	QHXGXKAZWWVXML-MDHDCJJKSA-N	0	3	348.490	3.054	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)C34CC(c5ccccc5)(C3)C4)C[C@@H]21	ZINC001042376334	1346064156	/nfs/dbraw/zinc/06/41/56/1346064156.db2.gz	QHXGXKAZWWVXML-YPTQCGQMSA-N	0	3	348.490	3.054	20	30		EGEDHN
C[C@H]1C[C@H](NCc2cc(F)ccc2C#N)CCN1C(=O)CC1CCC1	ZINC001044532953	1346359812	/nfs/dbraw/zinc/35/98/12/1346359812.db2.gz	UKFPRCBGLQHNIN-IFXJQAMLSA-N	0	3	343.446	3.357	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3cnc(C)o3)C[C@H]2C)CC1	ZINC001044729149	1346413995	/nfs/dbraw/zinc/41/39/95/1346413995.db2.gz	FOADQWOAWZFHNI-RHSMWYFYSA-N	0	3	331.460	3.199	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)CCC2CCC2)cc1F	ZINC001044983038	1346474326	/nfs/dbraw/zinc/47/43/26/1346474326.db2.gz	DNDGIENEWMKJJT-SFHVURJKSA-N	0	3	343.446	3.358	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CCC[C@H]1CNCc1ccc(C#N)cc1F	ZINC001044990332	1346476494	/nfs/dbraw/zinc/47/64/94/1346476494.db2.gz	HEYOIGDLKDTDMA-HNNXBMFYSA-N	0	3	333.382	3.041	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)c2ccoc2Cl)s1	ZINC001045013268	1346480511	/nfs/dbraw/zinc/48/05/11/1346480511.db2.gz	DLGFGCSZRVPDNM-NSHDSACASA-N	0	3	349.843	3.261	20	30		EGEDHN
Cc1sccc1C(=O)N1CCC[C@H]1CNCc1ccc(C#N)s1	ZINC001045030817	1346483741	/nfs/dbraw/zinc/48/37/41/1346483741.db2.gz	WWCMIBZQZDQMQB-ZDUSSCGKSA-N	0	3	345.493	3.384	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H]1CNCc1ccc(C#N)c(F)c1)C1CCC1	ZINC001045087451	1346491875	/nfs/dbraw/zinc/49/18/75/1346491875.db2.gz	HFWZVMULWADIDK-KDOFPFPSSA-N	0	3	343.446	3.214	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)C2(C3CC3)CCC2)s1	ZINC001045136656	1346502019	/nfs/dbraw/zinc/50/20/19/1346502019.db2.gz	JUPWBPPWVJPIJB-HNNXBMFYSA-N	0	3	343.496	3.281	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H]1CNCc1cc(CO)ccc1F	ZINC001045148653	1346506080	/nfs/dbraw/zinc/50/60/80/1346506080.db2.gz	COBNMSQUTGAEAJ-KRWDZBQOSA-N	0	3	348.462	3.001	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H]1CNCc1ccc(C#N)s1	ZINC001045149112	1346506606	/nfs/dbraw/zinc/50/66/06/1346506606.db2.gz	QUJPCVZAMODYTB-AWEZNQCLSA-N	0	3	331.485	3.303	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)c2occc2Cl)s1	ZINC001045187896	1346523394	/nfs/dbraw/zinc/52/33/94/1346523394.db2.gz	WGEYQDZJOFOXDK-NSHDSACASA-N	0	3	349.843	3.261	20	30		EGEDHN
C=C[C@H](C(=O)N1CCC[C@H]1CNCc1ccccn1)c1ccccc1	ZINC001045320828	1346559358	/nfs/dbraw/zinc/55/93/58/1346559358.db2.gz	ZUIHPWVBKPFHSH-PMACEKPBSA-N	0	3	335.451	3.132	20	30		EGEDHN
C[C@@H](CC(=O)N1CCC[C@H]1CNCc1ccc(C#N)cc1F)C1CC1	ZINC001045326286	1346561721	/nfs/dbraw/zinc/56/17/21/1346561721.db2.gz	RDNXIMOBXCCSIT-KSSFIOAISA-N	0	3	343.446	3.214	20	30		EGEDHN
CC1(NC(=O)[C@@H]2CC[C@@H](F)C2)CCN(Cc2cccc(C#N)c2)CC1	ZINC001045536573	1346621020	/nfs/dbraw/zinc/62/10/20/1346621020.db2.gz	AOMVZIUCUIKLQY-QZTJIDSGSA-N	0	3	343.446	3.167	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2cnc(-c3ccco3)s2)CC1	ZINC001045623230	1346650538	/nfs/dbraw/zinc/65/05/38/1346650538.db2.gz	JTYITKHTKTYAIN-UHFFFAOYSA-N	0	3	331.441	3.173	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2ccc(C(C)(F)F)cc2)CC1	ZINC001045652419	1346660408	/nfs/dbraw/zinc/66/04/08/1346660408.db2.gz	HMDUXPKAHZUZGH-UHFFFAOYSA-N	0	3	334.410	3.406	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)/C=C\c1ccco1)C2	ZINC001045909183	1346746131	/nfs/dbraw/zinc/74/61/31/1346746131.db2.gz	KHKLIPCBIXCVKG-GWQNQTGSSA-N	0	3	326.440	3.021	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)Cc1cccc(CC)c1)C2	ZINC001045948812	1346784155	/nfs/dbraw/zinc/78/41/55/1346784155.db2.gz	RSHQUBXNMXFBJM-JOCHJYFZSA-N	0	3	338.495	3.129	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc(Cl)cc1F)C2	ZINC001045950643	1346785384	/nfs/dbraw/zinc/78/53/84/1346785384.db2.gz	ICKYIVSHPMZZOM-IBGZPJMESA-N	0	3	348.849	3.431	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)Cc1ccc(C)cc1)C2	ZINC001045950700	1346785427	/nfs/dbraw/zinc/78/54/27/1346785427.db2.gz	JKEGAOWIALFHBE-QFIPXVFZSA-N	0	3	338.495	3.265	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@]2(CCN(Cc3ocnc3C)C2)C1	ZINC001045957829	1346792895	/nfs/dbraw/zinc/79/28/95/1346792895.db2.gz	GIYHNXZPIIDTLT-HXUWFJFHSA-N	0	3	345.487	3.400	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccoc1C1CC1)C2	ZINC001045960247	1346795453	/nfs/dbraw/zinc/79/54/53/1346795453.db2.gz	IAJYAHYHDJYXNH-FQEVSTJZSA-N	0	3	326.440	3.108	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc(Cl)c(F)c1)C2	ZINC001045971712	1346807591	/nfs/dbraw/zinc/80/75/91/1346807591.db2.gz	WRGXBMNONWWJJK-LJQANCHMSA-N	0	3	348.849	3.431	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H](C)Cc1ccco1)C2	ZINC001045972371	1346808772	/nfs/dbraw/zinc/80/87/72/1346808772.db2.gz	ZHAFYRFWMIUXFK-GHTZIAJQSA-N	0	3	342.483	3.186	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@H]1CC13CCCC3)C2	ZINC001045976152	1346812722	/nfs/dbraw/zinc/81/27/22/1346812722.db2.gz	SBGODJDDOXMAAT-QUCCMNQESA-N	0	3	328.500	3.295	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccoc1CCC)C2	ZINC001045978715	1346815394	/nfs/dbraw/zinc/81/53/94/1346815394.db2.gz	GMOSUQVYTRFYPX-HXUWFJFHSA-N	0	3	328.456	3.184	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)CCc1ccccc1)C2	ZINC001045982480	1346821560	/nfs/dbraw/zinc/82/15/60/1346821560.db2.gz	XXXFFHJXMPIIOZ-QFIPXVFZSA-N	0	3	338.495	3.347	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cccn1C(C)C)C2	ZINC001045985299	1346825772	/nfs/dbraw/zinc/82/57/72/1346825772.db2.gz	QUUSFJWNKLHKAM-NRFANRHFSA-N	0	3	341.499	3.411	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1c(C)nsc1C)C2	ZINC001045985698	1346826966	/nfs/dbraw/zinc/82/69/66/1346826966.db2.gz	AHGWIMVXXIHXOU-LJQANCHMSA-N	0	3	345.512	3.101	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2cc(C3CCCCC3)n[nH]2)C1	ZINC001046387728	1346958556	/nfs/dbraw/zinc/95/85/56/1346958556.db2.gz	PGZGWNLUZRDSLF-LJQANCHMSA-N	0	3	330.476	3.228	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@]2(C)CCN(CC=C(C)C)C2)cc1	ZINC001046430199	1346973745	/nfs/dbraw/zinc/97/37/45/1346973745.db2.gz	YNSFGNKYFTXWBD-HXUWFJFHSA-N	0	3	328.456	3.412	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2ccc(F)c(Cl)c2F)C1	ZINC001046590381	1347029031	/nfs/dbraw/zinc/02/90/31/1347029031.db2.gz	IZYRWMLWBAMUBJ-MRXNPFEDSA-N	0	3	328.790	3.389	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@]2(C)CCN([C@@H](C)c3ccccc3)C2)c1	ZINC001046605720	1347036498	/nfs/dbraw/zinc/03/64/98/1347036498.db2.gz	XADMKRQJDSOTEA-KKSFZXQISA-N	0	3	333.435	3.018	20	30		EGEDHN
C#CCCN1CC[C@](C)(NC(=O)c2ccc(O[C@@H](C)CC)cc2)C1	ZINC001046754285	1347084887	/nfs/dbraw/zinc/08/48/87/1347084887.db2.gz	NPMAWYRRPUSSRA-JXFKEZNVSA-N	0	3	328.456	3.081	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2cnn(C(CC)CC)c2C)C1	ZINC001046764667	1347089953	/nfs/dbraw/zinc/08/99/53/1347089953.db2.gz	YHRDBWRJYBQTDD-IBGZPJMESA-N	0	3	332.492	3.323	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@]2(C)CCN(Cc3ccc(CC)cc3)C2)cn1	ZINC001046779335	1347096462	/nfs/dbraw/zinc/09/64/62/1347096462.db2.gz	RIWGSCYOJILOHT-JOCHJYFZSA-N	0	3	347.462	3.020	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2cccc3c2OCC3(C)C)C1	ZINC001046881313	1347142849	/nfs/dbraw/zinc/14/28/49/1347142849.db2.gz	QCMVPXXMZACKCC-FQEVSTJZSA-N	0	3	328.456	3.127	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2cc(OC)cs2)C1	ZINC001046961432	1347166775	/nfs/dbraw/zinc/16/67/75/1347166775.db2.gz	NHQQWUGVAWNOTJ-LBPRGKRZSA-N	0	3	344.427	3.020	20	30		EGEDHN
O=C(N[C@@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1ccccc1)C2)C1=CCCC1	ZINC001047046092	1347195216	/nfs/dbraw/zinc/19/52/16/1347195216.db2.gz	DUZJHGWMJRYBBG-TYPHKJRUSA-N	0	3	334.463	3.118	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)N(Cc2ccns2)C3)CC1	ZINC001047139093	1347217539	/nfs/dbraw/zinc/21/75/39/1347217539.db2.gz	LSZLCVIGLDLRCB-UAGQMJEPSA-N	0	3	345.512	3.359	20	30		EGEDHN
CC(C)(C)C(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(Cc1ccccc1C#N)C2	ZINC001047189309	1347236014	/nfs/dbraw/zinc/23/60/14/1347236014.db2.gz	SHGQYVYPJKAOHG-WBAXXEDZSA-N	0	3	325.456	3.073	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)[C@H](CC)SC)C2)CC1	ZINC001047238013	1347264813	/nfs/dbraw/zinc/26/48/13/1347264813.db2.gz	VXBIURZEEUVWJK-ROUUACIJSA-N	0	3	336.545	3.102	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)c3c(C)coc3C)C2)CC1	ZINC001047238469	1347265243	/nfs/dbraw/zinc/26/52/43/1347265243.db2.gz	AHKUMIMFUKXQHD-LJQANCHMSA-N	0	3	342.483	3.484	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)C3(C4CC4)CC3)C2)CC1	ZINC001047243772	1347269334	/nfs/dbraw/zinc/26/93/34/1347269334.db2.gz	NPQDZDXUAUCBHA-GOSISDBHSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)[C@]3(C)C[C@H]4C[C@H]4C3)C2)CC1	ZINC001047250440	1347275620	/nfs/dbraw/zinc/27/56/20/1347275620.db2.gz	GQVLRCJLQVMEPF-XWSHUIEDSA-N	0	3	342.527	3.397	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)[C@]34C[C@H]3CCC4)C2)CC1	ZINC001047251882	1347276783	/nfs/dbraw/zinc/27/67/83/1347276783.db2.gz	YDSQFFNRGPHQKD-SFHLNBCPSA-N	0	3	328.500	3.151	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCN(C(=O)C2CCCCC2)C1	ZINC001047688959	1347332186	/nfs/dbraw/zinc/33/21/86/1347332186.db2.gz	VHUAYNYQDJQVOH-UZLBHIALSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)Cc2ccccc2)C1	ZINC001047883469	1347398671	/nfs/dbraw/zinc/39/86/71/1347398671.db2.gz	AMMJKNNFYZMQSM-DYESRHJHSA-N	0	3	347.462	3.128	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]([C@@H](C)NCc2ccn(C(C)C)n2)C1	ZINC001047924858	1347411855	/nfs/dbraw/zinc/41/18/55/1347411855.db2.gz	QZIRSZQTKWEDSG-IAGOWNOFSA-N	0	3	346.519	3.393	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H]([C@H](C)NCc3nccs3)C2)CC1	ZINC001047958155	1347423739	/nfs/dbraw/zinc/42/37/39/1347423739.db2.gz	GUPFWMUHPWHZBT-HOCLYGCPSA-N	0	3	333.501	3.216	20	30		EGEDHN
Cc1cccc(C(=O)N2C[C@@H](C)[C@@H](CNCc3ccccc3C#N)C2)c1	ZINC001048121736	1347474041	/nfs/dbraw/zinc/47/40/41/1347474041.db2.gz	HWNWRWFNDLWVFN-UTKZUKDTSA-N	0	3	347.462	3.365	20	30		EGEDHN
N#Cc1ccccc1CN1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)c1ccco1)C2	ZINC001048497586	1347567438	/nfs/dbraw/zinc/56/74/38/1347567438.db2.gz	ORAWHBYPQUKRQM-IDHPPYADSA-N	0	3	349.434	3.324	20	30		EGEDHN
C[C@H]1C[C@H]1C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2CC#Cc1ccccc1	ZINC001048497920	1347568250	/nfs/dbraw/zinc/56/82/50/1347568250.db2.gz	ADMQJZNKXYUTDI-JBINPLMMSA-N	0	3	336.479	3.053	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2CC#Cc1ccccc1	ZINC001048497922	1347568419	/nfs/dbraw/zinc/56/84/19/1347568419.db2.gz	ADMQJZNKXYUTDI-RQUKQETFSA-N	0	3	336.479	3.053	20	30		EGEDHN
O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)N2CC#Cc1ccccc1)c1cc[nH]c1	ZINC001048529889	1347580139	/nfs/dbraw/zinc/58/01/39/1347580139.db2.gz	WHRPCTWLCLEFHQ-NUZGMZIFSA-N	0	3	347.462	3.039	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)[C@@H]2C[C@@H]2C(C)C)CC1	ZINC001048628732	1347624652	/nfs/dbraw/zinc/62/46/52/1347624652.db2.gz	GQCZSORMBYLARE-WOJBJXKFSA-N	0	3	341.499	3.353	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CN(Cc3ccccc3Cl)C[C@H]2C1	ZINC001048982572	1347697854	/nfs/dbraw/zinc/69/78/54/1347697854.db2.gz	VYUSFFYBQYRDPN-IYBDPMFKSA-N	0	3	332.875	3.442	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)c2ccccc2)cc1	ZINC001049299819	1347779353	/nfs/dbraw/zinc/77/93/53/1347779353.db2.gz	UGDCBNILUDIIDJ-LEWJYISDSA-N	0	3	345.446	3.437	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1cccc(C#N)c1	ZINC001049344073	1347798491	/nfs/dbraw/zinc/79/84/91/1347798491.db2.gz	OGHLDBBNFYYTSK-SNRMKQJTSA-N	0	3	325.456	3.170	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cccc(OCCC)c1	ZINC001049502439	1347880771	/nfs/dbraw/zinc/88/07/71/1347880771.db2.gz	NXJLXHVFSNMZGZ-RBUKOAKNSA-N	0	3	328.456	3.340	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cncc(Cl)c1C	ZINC001049533931	1347895228	/nfs/dbraw/zinc/89/52/28/1347895228.db2.gz	XOYWFVXLBGDSKI-IAGOWNOFSA-N	0	3	333.863	3.298	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1cccc(C(C)C)c1	ZINC001049567945	1347914148	/nfs/dbraw/zinc/91/41/48/1347914148.db2.gz	QNMHLAHVOYWSGG-LEWJYISDSA-N	0	3	338.495	3.441	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(COC)cs1	ZINC001049572228	1347915828	/nfs/dbraw/zinc/91/58/28/1347915828.db2.gz	JVOZPIVJSYURFC-JKSUJKDBSA-N	0	3	334.485	3.150	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1c(C)[nH]c2ccccc21	ZINC001049582825	1347921731	/nfs/dbraw/zinc/92/17/31/1347921731.db2.gz	QHMQMPRCWOLSLD-RBUKOAKNSA-N	0	3	335.451	3.179	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)CCc1cc2ccccc2o1	ZINC001049584454	1347922554	/nfs/dbraw/zinc/92/25/54/1347922554.db2.gz	RWFBBXICOBMMGS-RBUKOAKNSA-N	0	3	336.435	3.064	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(C(C)(C)C)on1	ZINC001049590006	1347925512	/nfs/dbraw/zinc/92/55/12/1347925512.db2.gz	WLHUSOIUOALCGP-CVEARBPZSA-N	0	3	331.460	3.227	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cnc2ccccc2c1C	ZINC001049598472	1347929701	/nfs/dbraw/zinc/92/97/01/1347929701.db2.gz	NUVAIGIHKDIFQX-WOJBJXKFSA-N	0	3	335.451	3.408	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@H]2CCCN3C(=O)[C@]23C[C@H]2CCC3)c1	ZINC001049605867	1347933964	/nfs/dbraw/zinc/93/39/64/1347933964.db2.gz	RUDIIHWYWHLXNW-XWSHUIEDSA-N	0	3	349.478	3.314	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]2[C@@H]1CCN2CCc1ccns1	ZINC001049632696	1347944400	/nfs/dbraw/zinc/94/44/00/1347944400.db2.gz	ALKGCFLYGGNNOZ-SJORKVTESA-N	0	3	347.528	3.353	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]2[C@H]1CCN2Cc1cnccc1C	ZINC001049635684	1347946408	/nfs/dbraw/zinc/94/64/08/1347946408.db2.gz	MAVGVDZKDGWULN-ZWKOTPCHSA-N	0	3	327.472	3.168	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1cccnc1C	ZINC001049637205	1347947210	/nfs/dbraw/zinc/94/72/10/1347947210.db2.gz	WOKIOGFTXPKOSI-MSOLQXFVSA-N	0	3	327.472	3.168	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cc(F)c(F)cc1F	ZINC001049676607	1347967883	/nfs/dbraw/zinc/96/78/83/1347967883.db2.gz	PITRVOQZPYIMCU-IRXDYDNUSA-N	0	3	338.373	3.359	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)CC(C1CCC1)C1CCC1	ZINC001049717941	1347989380	/nfs/dbraw/zinc/98/93/80/1347989380.db2.gz	HRDAMHGIRZQLQB-PMACEKPBSA-N	0	3	328.500	3.291	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(F)cc2cccnc21	ZINC001049766568	1348009796	/nfs/dbraw/zinc/00/97/96/1348009796.db2.gz	DFCPKZMSEMLQJN-QZTJIDSGSA-N	0	3	339.414	3.239	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(C(CC)CC)no1	ZINC001049769032	1348012343	/nfs/dbraw/zinc/01/23/43/1348012343.db2.gz	GDUKUXIRKWMMQD-QZTJIDSGSA-N	0	3	343.471	3.280	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccccc1C	ZINC001049783254	1348019867	/nfs/dbraw/zinc/01/98/67/1348019867.db2.gz	UNVXJQUMBPKSNO-JSXRDJHFSA-N	0	3	336.479	3.187	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)[C@@H]1CCO[C@H]1c1ccccc1	ZINC001049785272	1348021243	/nfs/dbraw/zinc/02/12/43/1348021243.db2.gz	YINQTPDIUPLVRI-ZRNYENFQSA-N	0	3	340.467	3.016	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](C)c1ccc(C)s1	ZINC001049835264	1348048799	/nfs/dbraw/zinc/04/87/99/1348048799.db2.gz	HDGZFOQCOFREME-GVDBMIGSSA-N	0	3	330.497	3.249	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(F)c(F)c(F)c1F	ZINC001049853883	1348060209	/nfs/dbraw/zinc/06/02/09/1348060209.db2.gz	HSOPJKJYAVPWIS-OLZOCXBDSA-N	0	3	342.336	3.108	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(N(CC)CC)cc1	ZINC001049863747	1348070258	/nfs/dbraw/zinc/07/02/58/1348070258.db2.gz	NQFJVOSTRVSHMD-VQTJNVASSA-N	0	3	341.499	3.398	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1ccc2ccccc2c1	ZINC001049884180	1348089483	/nfs/dbraw/zinc/08/94/83/1348089483.db2.gz	AGBLMSHKJJKJOK-SFTDATJTSA-N	0	3	332.447	3.081	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(Cl)cc2c1OCC2	ZINC001049919895	1348112676	/nfs/dbraw/zinc/11/26/76/1348112676.db2.gz	YNMYIZZLPLRDBB-IAGOWNOFSA-N	0	3	346.858	3.140	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](C)Cc1cccc(F)c1	ZINC001049923519	1348115254	/nfs/dbraw/zinc/11/52/54/1348115254.db2.gz	MZNCIHHUADRJOT-ZYSHUDEJSA-N	0	3	330.447	3.256	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(N(C)CCC)cc1	ZINC001049924212	1348116044	/nfs/dbraw/zinc/11/60/44/1348116044.db2.gz	CBSRLFLWHYWWTN-WOJBJXKFSA-N	0	3	341.499	3.398	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(N(C)CC)cc1	ZINC001049928926	1348119220	/nfs/dbraw/zinc/11/92/20/1348119220.db2.gz	WLPVKLQRPAYWFG-MOPGFXCFSA-N	0	3	327.472	3.008	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(OC(C)C)cn1	ZINC001049938699	1348123688	/nfs/dbraw/zinc/12/36/88/1348123688.db2.gz	ADJQWYAIGHXPSK-RTBURBONSA-N	0	3	343.471	3.124	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CCCN(C(=O)[C@H]4[C@@H]5CCC[C@@H]54)[C@@H]3C2)c1	ZINC001050011474	1348153284	/nfs/dbraw/zinc/15/32/84/1348153284.db2.gz	IROHMHZDAVBZQL-WRTQPQOASA-N	0	3	349.478	3.027	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3cc4c(o3)CCCC4)[C@@H]2C1	ZINC001050062764	1348170015	/nfs/dbraw/zinc/17/00/15/1348170015.db2.gz	GEUQISVDKFFICY-DLBZAZTESA-N	0	3	328.456	3.271	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)Cc3cccc(C)c3Cl)[C@@H]2C1	ZINC001050094541	1348181317	/nfs/dbraw/zinc/18/13/17/1348181317.db2.gz	YRRKDTMASVNQND-ZWKOTPCHSA-N	0	3	344.886	3.137	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)C[C@@H](C)c3ccccc3F)[C@@H]2C1	ZINC001050164329	1348201312	/nfs/dbraw/zinc/20/13/12/1348201312.db2.gz	CLMQUUZJSDSZHU-FUHIMQAGSA-N	0	3	342.458	3.265	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)Cc3cccc(OCCC)c3)[C@@H]2C1	ZINC001050181281	1348203844	/nfs/dbraw/zinc/20/38/44/1348203844.db2.gz	RIOVEWZSPKTTQR-AZUAARDMSA-N	0	3	342.483	3.127	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)C[C@H]3CCc4ccccc4C3)[C@@H]2C1	ZINC001050190649	1348206633	/nfs/dbraw/zinc/20/66/33/1348206633.db2.gz	MTSUYDCKRYDTJE-DZFGPLHGSA-N	0	3	338.495	3.290	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3c[nH]c4ccc(F)cc34)[C@@H]2C1	ZINC001050215623	1348212727	/nfs/dbraw/zinc/21/27/27/1348212727.db2.gz	YQLMHIWYFDQJBX-SCLBCKFNSA-N	0	3	327.403	3.029	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC2(C1)CCN(Cc1ncccc1C)CC2	ZINC001050614078	1348302830	/nfs/dbraw/zinc/30/28/30/1348302830.db2.gz	MFZSLEWBIPCZBD-UHFFFAOYSA-N	0	3	341.499	3.417	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC2(C1)CCN(Cc1oc(C)nc1C)CC2	ZINC001050645682	1348313987	/nfs/dbraw/zinc/31/39/87/1348313987.db2.gz	UVGAHTNCVSKVOD-IBGZPJMESA-N	0	3	345.487	3.318	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC3(C2)CCN(Cc2cccnc2C)CC3)C1	ZINC001050656437	1348318824	/nfs/dbraw/zinc/31/88/24/1348318824.db2.gz	DCKFBZJWPOCGHO-UHFFFAOYSA-N	0	3	339.483	3.171	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C34CCC(CC3)C4(C)C)C2)CC1	ZINC001050692643	1348329140	/nfs/dbraw/zinc/32/91/40/1348329140.db2.gz	GVNBXTACLASIGO-UHFFFAOYSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C[C@@H](C)c3ccccc3F)C2)CC1	ZINC001050701657	1348331474	/nfs/dbraw/zinc/33/14/74/1348331474.db2.gz	NYYYOUDEVONQLZ-QGZVFWFLSA-N	0	3	342.458	3.267	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3[nH]c4ccc(C)cc4c3C)C2)CC1	ZINC001050717042	1348335483	/nfs/dbraw/zinc/33/54/83/1348335483.db2.gz	NUEZIVIVMARMQN-UHFFFAOYSA-N	0	3	349.478	3.346	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3csc4c3CCCC4)C2)CC1	ZINC001050748589	1348347538	/nfs/dbraw/zinc/34/75/38/1348347538.db2.gz	SVBOWZFWFOXRSF-UHFFFAOYSA-N	0	3	342.508	3.188	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3oc4c(cccc4C)c3C)C2)CC1	ZINC001050765570	1348351910	/nfs/dbraw/zinc/35/19/10/1348351910.db2.gz	SEZVXXNUHMGCSL-UHFFFAOYSA-N	0	3	336.435	3.221	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)[C@@H]3CCCO[C@H]3C)cccc2C1	ZINC001051285046	1348418522	/nfs/dbraw/zinc/41/85/22/1348418522.db2.gz	WKELDMLJAQFVHA-QFBILLFUSA-N	0	3	342.483	3.052	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3[nH]ccc3C3CC3)cccc2C1	ZINC001051290564	1348420607	/nfs/dbraw/zinc/42/06/07/1348420607.db2.gz	XLRWKXQEBGIWAQ-UHFFFAOYSA-N	0	3	347.462	3.204	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3onc(C)c3C)cccc2C1	ZINC001051293970	1348422815	/nfs/dbraw/zinc/42/28/15/1348422815.db2.gz	ZWNSSHKZNDPVKH-UHFFFAOYSA-N	0	3	339.439	3.156	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3ccc(OC)o3)cccc2C1	ZINC001051303194	1348426457	/nfs/dbraw/zinc/42/64/57/1348426457.db2.gz	HMEZMUQOKQCRIH-UHFFFAOYSA-N	0	3	340.423	3.152	20	30		EGEDHN
C[C@@H](C(=O)N[C@@H]1CCCN(Cc2ccc(C#N)cc2)CC1)C1CC1	ZINC001052283086	1348516804	/nfs/dbraw/zinc/51/68/04/1348516804.db2.gz	VGJQFVMLNAKWQM-DNVCBOLYSA-N	0	3	325.456	3.075	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H](NC(=O)[C@@H]3CCC3(F)F)CC2)cc1	ZINC001052480908	1348551668	/nfs/dbraw/zinc/55/16/68/1348551668.db2.gz	FZAKTFMFWBCEPO-SJORKVTESA-N	0	3	347.409	3.074	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@H](C)c2c(F)cccc2F)CC1	ZINC001052562302	1348580538	/nfs/dbraw/zinc/58/05/38/1348580538.db2.gz	OOSFWDPCNQVEDQ-HUUCEWRRSA-N	0	3	334.410	3.062	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc(C)c3cccnc23)CC1	ZINC001052567719	1348582202	/nfs/dbraw/zinc/58/22/02/1348582202.db2.gz	HDSOECQLMLCYRQ-KRWDZBQOSA-N	0	3	335.451	3.151	20	30		EGEDHN
C#CCN1CCC[C@H](NC(=O)c2cc(C3CC3)oc2C2CC2)CC1	ZINC001052577318	1348584762	/nfs/dbraw/zinc/58/47/62/1348584762.db2.gz	BHLJFANWHOHQJM-INIZCTEOSA-N	0	3	326.440	3.252	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc(C)nc2C(C)C)CC1	ZINC001052598374	1348590762	/nfs/dbraw/zinc/59/07/62/1348590762.db2.gz	LMEROWMWHDIFHJ-KRWDZBQOSA-N	0	3	327.472	3.121	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cc(-c3cccs3)on2)CC1	ZINC001052600972	1348591638	/nfs/dbraw/zinc/59/16/38/1348591638.db2.gz	COWAXXGWROCZBF-CQSZACIVSA-N	0	3	343.452	3.011	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN(CCC(F)(F)F)CC2)cc1	ZINC001052615783	1348597490	/nfs/dbraw/zinc/59/74/90/1348597490.db2.gz	RHYKPDLVQPINJU-MRXNPFEDSA-N	0	3	338.373	3.205	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2cc3c(ccc(C)c3C)[nH]2)CC1	ZINC001052620713	1348597846	/nfs/dbraw/zinc/59/78/46/1348597846.db2.gz	SBJZHARGGWMPJE-QGZVFWFLSA-N	0	3	337.467	3.392	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2csc(-c3ccco3)n2)CC1	ZINC001052664673	1348619126	/nfs/dbraw/zinc/61/91/26/1348619126.db2.gz	OTTYWCWFWZCTME-CQSZACIVSA-N	0	3	343.452	3.011	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc(C(C)C)nc2CC)CC1	ZINC001052718418	1348647458	/nfs/dbraw/zinc/64/74/58/1348647458.db2.gz	ADZWIZLVRZPYHT-KRWDZBQOSA-N	0	3	341.499	3.375	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)Cc2cccc3sccc32)CC1	ZINC001052762676	1348668095	/nfs/dbraw/zinc/66/80/95/1348668095.db2.gz	AGESWHGMWCUKBJ-QGZVFWFLSA-N	0	3	340.492	3.438	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2csc(C(C)(C)C)n2)CC1	ZINC001052791896	1348681615	/nfs/dbraw/zinc/68/16/15/1348681615.db2.gz	HZNHJBNHJHDREI-CQSZACIVSA-N	0	3	333.501	3.048	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)C(C)(C)c2ccc(C)cc2)CC1	ZINC001052877258	1348714629	/nfs/dbraw/zinc/71/46/29/1348714629.db2.gz	HHQAKSOEQPIMNE-IBGZPJMESA-N	0	3	326.484	3.267	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccccc2OC(C)C)CC1	ZINC001052879606	1348716993	/nfs/dbraw/zinc/71/69/93/1348716993.db2.gz	BFRYDEPSDDTYJV-QGZVFWFLSA-N	0	3	328.456	3.081	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)C23CC4CC(CC(C4)C2)C3)CC1	ZINC001052888925	1348725174	/nfs/dbraw/zinc/72/51/74/1348725174.db2.gz	LMAOEMDINSVXDT-TWJKGYNYSA-N	0	3	328.500	3.197	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)C[C@H]2CCc3ccccc3C2)CC1	ZINC001052893844	1348730870	/nfs/dbraw/zinc/73/08/70/1348730870.db2.gz	FIEWDUAVKKIPIG-GHTZIAJQSA-N	0	3	338.495	3.176	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@@H](C)c2cccc(Cl)c2)CC1	ZINC001052946676	1348763449	/nfs/dbraw/zinc/76/34/49/1348763449.db2.gz	BLCJRWMLAFAKRO-YJBOKZPZSA-N	0	3	332.875	3.438	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@H](C)c2ccc(F)c(F)c2)CC1	ZINC001052947152	1348764438	/nfs/dbraw/zinc/76/44/38/1348764438.db2.gz	JRFKJYKZWDEFIX-ZBFHGGJFSA-N	0	3	334.410	3.062	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)Cc2ccsc2)C1	ZINC001053063073	1348874027	/nfs/dbraw/zinc/87/40/27/1348874027.db2.gz	GZPFFWCXTPEOTH-ZWKOTPCHSA-N	0	3	330.497	3.017	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccoc2C)C1	ZINC001053065051	1348878380	/nfs/dbraw/zinc/87/83/80/1348878380.db2.gz	BOUZLZZDTAEPLR-HKUYNNGSSA-N	0	3	328.456	3.318	20	30		EGEDHN
C#CCC[N@H+]1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001053068855	1348882154	/nfs/dbraw/zinc/88/21/54/1348882154.db2.gz	WPGWXARDWZOXDE-IEBWSBKVSA-N	0	3	340.467	3.122	20	30		EGEDHN
C#CCC[N@@H+]1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccccc2[O-])C1	ZINC001053068855	1348882160	/nfs/dbraw/zinc/88/21/60/1348882160.db2.gz	WPGWXARDWZOXDE-IEBWSBKVSA-N	0	3	340.467	3.122	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cc(C)c(C)o2)C1	ZINC001053079685	1348900001	/nfs/dbraw/zinc/90/00/01/1348900001.db2.gz	KSBDKGFTIWIPPX-QZTJIDSGSA-N	0	3	328.456	3.236	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cc(C)nc(C)c2)C1	ZINC001053087196	1348911115	/nfs/dbraw/zinc/91/11/15/1348911115.db2.gz	RJMKQEXIUJUFHL-AZUAARDMSA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)CCc2ccsc2)C1	ZINC001053088682	1348914105	/nfs/dbraw/zinc/91/41/05/1348914105.db2.gz	ZECZHWOKSUMCCT-RBUKOAKNSA-N	0	3	344.524	3.407	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2ccc(C)c(C)n2)C1	ZINC001053091558	1348916824	/nfs/dbraw/zinc/91/68/24/1348916824.db2.gz	NEIJKMAJOFMQHX-AZUAARDMSA-N	0	3	339.483	3.038	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2cc(C)co2)C1	ZINC001053094179	1348922353	/nfs/dbraw/zinc/92/23/53/1348922353.db2.gz	UIMUOLCNOJUUMB-ROUUACIJSA-N	0	3	328.456	3.318	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cc[nH]c2C(C)C)C1	ZINC001053094112	1348922416	/nfs/dbraw/zinc/92/24/16/1348922416.db2.gz	CTHHJQMNHQUWPC-MJGOQNOKSA-N	0	3	341.499	3.478	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccn(C)c2C)C1	ZINC001053096809	1348927523	/nfs/dbraw/zinc/92/75/23/1348927523.db2.gz	ZUIYNLWJMCETNG-ICSRJNTNSA-N	0	3	341.499	3.064	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(CF)cc2)C1	ZINC001053107146	1348946783	/nfs/dbraw/zinc/94/67/83/1348946783.db2.gz	ADKHEAVBJNSQSG-WOJBJXKFSA-N	0	3	342.458	3.496	20	30		EGEDHN
C=CCCN1Cc2ccccc2C[C@H]1CNC(=O)c1cc[nH]c1CC	ZINC001054039034	1349135000	/nfs/dbraw/zinc/13/50/00/1349135000.db2.gz	SIIOFDQPYHMHQC-SFHVURJKSA-N	0	3	337.467	3.310	20	30		EGEDHN
C=CCCN1Cc2ccccc2C[C@H]1CNC(=O)C1C=CC=CC=C1	ZINC001054041434	1349136210	/nfs/dbraw/zinc/13/62/10/1349136210.db2.gz	KAOCSOXVQVHHTC-NRFANRHFSA-N	0	3	334.463	3.404	20	30		EGEDHN
C=C(C)CCN1Cc2ccccc2C[C@H]1CNC(=O)c1cc(F)c[nH]1	ZINC001054047494	1349137328	/nfs/dbraw/zinc/13/73/28/1349137328.db2.gz	FCRKEMWMIFIAKX-SFHVURJKSA-N	0	3	341.430	3.277	20	30		EGEDHN
CCCC(=O)N1CCC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001054071680	1349144632	/nfs/dbraw/zinc/14/46/32/1349144632.db2.gz	HFFYBBCDTVHLLW-FQEVSTJZSA-N	0	3	325.456	3.173	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@]2(CCN(Cc3cccnc3)C2)C1	ZINC001054175529	1349176770	/nfs/dbraw/zinc/17/67/70/1349176770.db2.gz	PFWRAQYPBZEVOU-NRFANRHFSA-N	0	3	341.499	3.498	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@]2(CCN(Cc3ccccn3)C2)C1	ZINC001054178018	1349180297	/nfs/dbraw/zinc/18/02/97/1349180297.db2.gz	VYIQGYYCLYZQJM-HXUWFJFHSA-N	0	3	327.472	3.108	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc3c(ccc(C)c3C)[nH]1)C2	ZINC001054177860	1349180738	/nfs/dbraw/zinc/18/07/38/1349180738.db2.gz	SMXKOAJDFODIDT-QFIPXVFZSA-N	0	3	349.478	3.346	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)Cc1cc(C)ccc1C)C2	ZINC001054190226	1349192157	/nfs/dbraw/zinc/19/21/57/1349192157.db2.gz	FDKIWQRUBVEIJD-JOCHJYFZSA-N	0	3	338.495	3.184	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@]3(CCN(Cc4cccnc4)C3)C2)C1	ZINC001054194342	1349196626	/nfs/dbraw/zinc/19/66/26/1349196626.db2.gz	NSQZGDYNIGHUOY-OAQYLSRUSA-N	0	3	339.483	3.252	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cnc3ccccc3c1)C2	ZINC001054205899	1349207677	/nfs/dbraw/zinc/20/76/77/1349207677.db2.gz	ZTTITHOIGLIKRV-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H](C)c1ccc(CC)cc1)C2	ZINC001054214785	1349213930	/nfs/dbraw/zinc/21/39/30/1349213930.db2.gz	HAKVLBNZNOKHIV-AVRDEDQJSA-N	0	3	338.495	3.300	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@H](C)c1ccccc1F)C2	ZINC001054215779	1349214473	/nfs/dbraw/zinc/21/44/73/1349214473.db2.gz	FIGWAQQFONABOI-UTKZUKDTSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)C[C@H](C)c1ccccc1F)C2	ZINC001054215210	1349215033	/nfs/dbraw/zinc/21/50/33/1349215033.db2.gz	PHHKHIHLZCTZHQ-LAUBAEHRSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc3c(c1)CCC=C3)C2	ZINC001054228604	1349222734	/nfs/dbraw/zinc/22/27/34/1349222734.db2.gz	UNYZNUFERRBIOE-JOCHJYFZSA-N	0	3	334.463	3.207	20	30		EGEDHN
CC(C)(C)C(=O)N1CCC[C@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001054231525	1349224959	/nfs/dbraw/zinc/22/49/59/1349224959.db2.gz	UMCVRZVZCWCOCJ-OAQYLSRUSA-N	0	3	339.483	3.419	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)CCc1ccccc1Cl)C2	ZINC001054237251	1349230371	/nfs/dbraw/zinc/23/03/71/1349230371.db2.gz	VZCPOWHKXHXAGK-FQEVSTJZSA-N	0	3	344.886	3.220	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)C(C)(C)c1ccccc1)C2	ZINC001054238257	1349232161	/nfs/dbraw/zinc/23/21/61/1349232161.db2.gz	NWOVKFRGSLKPGI-QFIPXVFZSA-N	0	3	338.495	3.302	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cccc3cnccc31)C2	ZINC001054240186	1349234249	/nfs/dbraw/zinc/23/42/49/1349234249.db2.gz	OIUXMORYRRBAPE-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C=C[C@H](C(=O)N1CCC[C@@]2(CCN(CC#CC)C2)C1)c1ccccc1	ZINC001054244648	1349238474	/nfs/dbraw/zinc/23/84/74/1349238474.db2.gz	XGQWJJYVYKODCA-UNMCSNQZSA-N	0	3	336.479	3.294	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)[C@H](C)Cc1ccc(C)cc1)C2	ZINC001054246370	1349240935	/nfs/dbraw/zinc/24/09/35/1349240935.db2.gz	XMKLNCFIMKCFSX-KNQAVFIVSA-N	0	3	338.495	3.121	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3ccncc3F)cc2C1	ZINC001054259984	1349256116	/nfs/dbraw/zinc/25/61/16/1349256116.db2.gz	WMQBHASKKSFXJC-UHFFFAOYSA-N	0	3	339.414	3.433	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)C3CC(OCC)C3)cc2C1	ZINC001054263593	1349261838	/nfs/dbraw/zinc/26/18/38/1349261838.db2.gz	VGHLLXPNFPMGNI-UHFFFAOYSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NCc1ccc2c(c1)CN(C(C)C)C2	ZINC001054265812	1349264024	/nfs/dbraw/zinc/26/40/24/1349264024.db2.gz	ZOQNKIKZINVAPS-MOPGFXCFSA-N	0	3	328.456	3.008	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)NCc1ccc2c(c1)CN(CC1CCC1)C2	ZINC001054283173	1349284003	/nfs/dbraw/zinc/28/40/03/1349284003.db2.gz	ONCXXUPIONVZSC-UXHICEINSA-N	0	3	340.467	3.010	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NCc1ccc2c(c1)CN(C(C)C)C2	ZINC001054285703	1349287946	/nfs/dbraw/zinc/28/79/46/1349287946.db2.gz	VUGIETNINOXLAL-OALUTQOASA-N	0	3	328.456	3.008	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3nc(C)oc3C)cc2C1	ZINC001054286299	1349288234	/nfs/dbraw/zinc/28/82/34/1349288234.db2.gz	BGKLPIYVFFXNAL-UHFFFAOYSA-N	0	3	325.412	3.113	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@H]3CCO[C@@H](CC)C3)cc2C1	ZINC001054289071	1349293662	/nfs/dbraw/zinc/29/36/62/1349293662.db2.gz	SYZPJDKSWUWZOW-PXNSSMCTSA-N	0	3	342.483	3.400	20	30		EGEDHN
Cc1cccc(C(=O)N2C[C@H](NCc3ccc(C#N)s3)[C@@H](C)C2)c1	ZINC001054354402	1349332078	/nfs/dbraw/zinc/33/20/78/1349332078.db2.gz	AFGDDCMNPWNGSA-KSSFIOAISA-N	0	3	339.464	3.179	20	30		EGEDHN
Cc1cc(C(=O)N2C[C@@H](C)[C@H](NCc3ccc(C#N)s3)C2)c(C)o1	ZINC001054375008	1349340253	/nfs/dbraw/zinc/34/02/53/1349340253.db2.gz	IAEWWTVRXRRODX-PIGZYNQJSA-N	0	3	343.452	3.080	20	30		EGEDHN
C[C@H]1CN(C(=O)c2ccc(Cl)o2)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054389074	1349345444	/nfs/dbraw/zinc/34/54/44/1349345444.db2.gz	FQUHVRQRISQHSP-GWCFXTLKSA-N	0	3	349.843	3.116	20	30		EGEDHN
CCc1ccc(C(=O)N2C[C@@H](C)[C@H](NCc3ccc(C#N)s3)C2)o1	ZINC001054812403	1349473563	/nfs/dbraw/zinc/47/35/63/1349473563.db2.gz	JNBTZHKHUWNAPN-MLGOLLRUSA-N	0	3	343.452	3.025	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)CC1CCCCC1)C[C@@H](C)O2	ZINC001071131881	1354469792	/nfs/dbraw/zinc/46/97/92/1354469792.db2.gz	NXTMAERFMNQBAI-XLIONFOSSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C1CCCCCC1)C[C@H](C)O2	ZINC001071142819	1354475002	/nfs/dbraw/zinc/47/50/02/1354475002.db2.gz	UZHHDHBTMSNXMO-PXNSSMCTSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C(F)=C1CCCC1)C[C@H](C)O2	ZINC001071156173	1354481218	/nfs/dbraw/zinc/48/12/18/1354481218.db2.gz	CPPJTJSPPHPTTK-HNAYVOBHSA-N	0	3	336.451	3.052	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)C(F)=C1CCCC1)C[C@@H](C)O2	ZINC001071156172	1354481568	/nfs/dbraw/zinc/48/15/68/1354481568.db2.gz	CPPJTJSPPHPTTK-DNVCBOLYSA-N	0	3	336.451	3.052	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)O[C@@]2(CCN(CC=C(C)C)C2)C1	ZINC001071199900	1354500241	/nfs/dbraw/zinc/50/02/41/1354500241.db2.gz	QWLANHHFUGRFDB-YLJYHZDGSA-N	0	3	334.504	3.247	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1ccccc1Cl)C[C@H](C)O2	ZINC001071234099	1354517927	/nfs/dbraw/zinc/51/79/27/1354517927.db2.gz	TXPHHEYUVUNMTM-KXBFYZLASA-N	0	3	348.874	3.222	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1cc(C)cc(C)c1)C[C@@H](C)O2	ZINC001071236638	1354520559	/nfs/dbraw/zinc/52/05/59/1354520559.db2.gz	XISGKCNAYHXFQZ-NQIIRXRSSA-N	0	3	342.483	3.185	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1sccc1CC)C[C@H](C)O2	ZINC001071244497	1354524571	/nfs/dbraw/zinc/52/45/71/1354524571.db2.gz	WGRNAWCHKSNQRZ-KXBFYZLASA-N	0	3	348.512	3.192	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cncc3sccc32)C1	ZINC001086176764	1359015862	/nfs/dbraw/zinc/01/58/62/1359015862.db2.gz	OTBRERQKHHTHHO-TXEJJXNPSA-N	0	3	335.860	3.147	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2coc3c2cccc3OC)CC[C@H]1C	ZINC001071512583	1354736908	/nfs/dbraw/zinc/73/69/08/1354736908.db2.gz	ZKUMEVNLLQLMHD-CABCVRRESA-N	0	3	340.423	3.047	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(C)c(NC(C)=O)c2)CC[C@H]1C	ZINC001071527341	1354747185	/nfs/dbraw/zinc/74/71/85/1354747185.db2.gz	BPAZEABJUNMJHM-QAPCUYQASA-N	0	3	343.471	3.112	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)[C@@H](C)C(F)(F)F)C1	ZINC001088359196	1359842704	/nfs/dbraw/zinc/84/27/04/1359842704.db2.gz	TXRLLCYGEXOPMJ-VXGBXAGGSA-N	0	3	326.790	3.298	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cnc3ccccc3c2C)CC[C@H]1C	ZINC001071695730	1354858133	/nfs/dbraw/zinc/85/81/33/1354858133.db2.gz	SISIJXGPQHPRNL-WBVHZDCISA-N	0	3	335.451	3.149	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc3cc(F)ccc3[nH]2)CC[C@@H]1C	ZINC001071728227	1354884443	/nfs/dbraw/zinc/88/44/43/1354884443.db2.gz	JMNKDQPTWJJQIV-BBRMVZONSA-N	0	3	329.419	3.466	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2csc(-c3ccco3)n2)CC[C@@H]1C	ZINC001071775435	1354921598	/nfs/dbraw/zinc/92/15/98/1354921598.db2.gz	CFXGIMVLRQGDSA-KBPBESRZSA-N	0	3	343.452	3.009	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CC[C@@H](C)N(Cc3ccc(CO)cc3)C2)C1	ZINC001071807363	1354952417	/nfs/dbraw/zinc/95/24/17/1354952417.db2.gz	QZYBXLLECGLJIW-APWZRJJASA-N	0	3	342.483	3.004	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CC[C@H](C)N(Cc3ccccc3C)C2)c1	ZINC001071816018	1354957630	/nfs/dbraw/zinc/95/76/30/1354957630.db2.gz	SYZGEMNVLGJURH-UWJYYQICSA-N	0	3	347.462	3.154	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2cc(F)c(F)cc2F)CC[C@H]1C	ZINC001071850055	1354978905	/nfs/dbraw/zinc/97/89/05/1354978905.db2.gz	AMIZJGJKKPCYBG-TZMCWYRMSA-N	0	3	340.389	3.192	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2occc2Br)CC[C@H]1C	ZINC001071903963	1355016251	/nfs/dbraw/zinc/01/62/51/1355016251.db2.gz	AAEFXUHVFBIYAA-NEPJUHHUSA-N	0	3	341.249	3.201	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc3[nH]c(C)nc3c2)CC[C@H]1C	ZINC001071938728	1355035448	/nfs/dbraw/zinc/03/54/48/1355035448.db2.gz	OUAHSVWIUMURGB-CZUORRHYSA-N	0	3	326.444	3.030	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cccc(OC(C)C)n2)CC[C@H]1C	ZINC001071942455	1355036309	/nfs/dbraw/zinc/03/63/09/1355036309.db2.gz	PTJZPAGRNXDBJR-CVEARBPZSA-N	0	3	331.460	3.028	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2(c3ccccc3F)CCC2)CC[C@@H]1C	ZINC001071990299	1355061793	/nfs/dbraw/zinc/06/17/93/1355061793.db2.gz	XTHDRVWNXJTZBY-DLBZAZTESA-N	0	3	342.458	3.240	20	30		EGEDHN
C=C(C)CCN1C[C@H](NC(=O)c2sccc2COC)CC[C@@H]1C	ZINC001071993656	1355063609	/nfs/dbraw/zinc/06/36/09/1355063609.db2.gz	VKPVBTUNYRWEOI-GOEBONIOSA-N	0	3	336.501	3.443	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2(c3ccccc3C)CCC2)CC[C@@H]1C	ZINC001072026524	1355087444	/nfs/dbraw/zinc/08/74/44/1355087444.db2.gz	KDHSTHZDQGJQRE-OALUTQOASA-N	0	3	338.495	3.409	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc(OC)c(OC)cc2C)CC[C@H]1C	ZINC001072091469	1355123406	/nfs/dbraw/zinc/12/34/06/1355123406.db2.gz	BMBLYNDTEDSXQA-HZPDHXFCSA-N	0	3	346.471	3.171	20	30		EGEDHN
C=CCOc1ccc(CC(=O)N[C@H]2CC[C@H](C)N(CC(=C)C)C2)cc1	ZINC001072106895	1355134856	/nfs/dbraw/zinc/13/48/56/1355134856.db2.gz	XNVQUJZWQULSAG-HKUYNNGSSA-N	0	3	342.483	3.339	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1csc(C2CC2)n1	ZINC001089736190	1360641149	/nfs/dbraw/zinc/64/11/49/1360641149.db2.gz	LRQNGQOPSOVWJA-HNNXBMFYSA-N	0	3	345.512	3.264	20	30		EGEDHN
C[C@H]1CCN(C(=O)c2ccccc2)C[C@@H]1CNCc1ccccc1C#N	ZINC001072174608	1355169147	/nfs/dbraw/zinc/16/91/47/1355169147.db2.gz	BAMAUPDBRJAZRA-UWJYYQICSA-N	0	3	347.462	3.446	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](C)[C@H](CNCc2ncc(C)s2)C1	ZINC001072334985	1355244592	/nfs/dbraw/zinc/24/45/92/1355244592.db2.gz	KMZYXIQBNBAMRO-DZGCQCFKSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3cnc(CC(C)(C)C)s3)C2)C1	ZINC001073107432	1355601403	/nfs/dbraw/zinc/60/14/03/1355601403.db2.gz	NQUFYPAGPZLFSG-UHFFFAOYSA-N	0	3	333.501	3.066	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@@H](CC)Cc3ccccc3C)C2)C1	ZINC001073128256	1355611509	/nfs/dbraw/zinc/61/15/09/1355611509.db2.gz	XGRSONXIKBNGGB-SFHVURJKSA-N	0	3	326.484	3.284	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@H](CC)Cc3ccccc3C)C2)C1	ZINC001073128255	1355611940	/nfs/dbraw/zinc/61/19/40/1355611940.db2.gz	XGRSONXIKBNGGB-GOSISDBHSA-N	0	3	326.484	3.284	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)C3CC(c4ccc(F)cc4)C3)C2)C1	ZINC001073490334	1355819960	/nfs/dbraw/zinc/81/99/60/1355819960.db2.gz	XYZSBSXJIOYVBE-UHFFFAOYSA-N	0	3	328.431	3.040	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)[C@H]2CC[C@H](C(C)C)CC2)C1	ZINC001073831900	1355911940	/nfs/dbraw/zinc/91/19/40/1355911940.db2.gz	HXYDRZBXGQAHSD-GUDVDZBRSA-N	0	3	336.520	3.232	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCCC[C@@H]1CN(C)Cc1cccc(C#N)c1	ZINC001073983866	1356013243	/nfs/dbraw/zinc/01/32/43/1356013243.db2.gz	AXFLBBZBTLRCFE-VDGBGEPSSA-N	0	3	325.456	3.337	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCCN1C(=O)c1cc[nH]c1	ZINC001074019850	1356038153	/nfs/dbraw/zinc/03/81/53/1356038153.db2.gz	SKZNPOBAQHZHGU-LJQANCHMSA-N	0	3	336.439	3.013	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCO[C@H]1C1CCN(C(=O)C=C(C)C)CC1	ZINC001075400507	1356357708	/nfs/dbraw/zinc/35/77/08/1356357708.db2.gz	YMHUWNYLZNIIKY-WMZOPIPTSA-N	0	3	340.895	3.081	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@]1(c3ccccc3)CC1(C)C)C2	ZINC001098090609	1363220173	/nfs/dbraw/zinc/22/01/73/1363220173.db2.gz	UEHTYFUEPLADLK-IWQHBPENSA-N	0	3	336.479	3.099	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)CC(C)(C)C2CC2)C[C@H]1C(F)(F)F	ZINC001099248615	1363713225	/nfs/dbraw/zinc/71/32/25/1363713225.db2.gz	GANVIISQYMHMRF-ZIAGYGMSSA-N	0	3	332.410	3.368	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)Cc1csc(C2CC2)n1	ZINC001099257302	1363717527	/nfs/dbraw/zinc/71/75/27/1363717527.db2.gz	CZVJZLUXQIJAIH-INIZCTEOSA-N	0	3	347.528	3.356	20	30		EGEDHN
CC1(C(=O)N[C@H]2C[C@@H](NCc3cc(C#N)ccc3F)C23CCC3)CC1	ZINC001078629822	1357041031	/nfs/dbraw/zinc/04/10/31/1357041031.db2.gz	PIOLBXAQIULSRK-SJORKVTESA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C2(C)CCC2)C12CCC2	ZINC001078701261	1357061975	/nfs/dbraw/zinc/06/19/75/1357061975.db2.gz	YVCOFCGSUDXOGK-STQMWFEESA-N	0	3	341.293	3.102	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2nc(C3CC3)oc2C)C12CCC2	ZINC001078767397	1357073625	/nfs/dbraw/zinc/07/36/25/1357073625.db2.gz	JLVDZFWKVHUIKY-KBPBESRZSA-N	0	3	349.862	3.244	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2coc(C3CCC3)n2)C12CCC2	ZINC001078773543	1357077865	/nfs/dbraw/zinc/07/78/65/1357077865.db2.gz	JDLXALTZQILDKS-HUUCEWRRSA-N	0	3	349.862	3.325	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2ccc3occc3c2)C[C@H]1c1ccccc1	ZINC001081120519	1357839086	/nfs/dbraw/zinc/83/90/86/1357839086.db2.gz	FUSUUCGRLYTFSH-VQTJNVASSA-N	0	3	344.414	3.264	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H]2CCCC(F)(F)C2)C[C@H]1c1ccccc1	ZINC001081179009	1357847549	/nfs/dbraw/zinc/84/75/49/1357847549.db2.gz	ZXBKSWMPBSPMSR-OKZBNKHCSA-N	0	3	346.421	3.029	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2cc(Cl)cs2)C[C@H]1c1ccccc1	ZINC001081190911	1357848216	/nfs/dbraw/zinc/84/82/16/1357848216.db2.gz	YBMKFHMNAVKXOU-JKSUJKDBSA-N	0	3	344.867	3.233	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)C2(C3CCCCC3)CC2)[C@H](OC)C1	ZINC001082347633	1358021014	/nfs/dbraw/zinc/02/10/14/1358021014.db2.gz	MNQCARIIDYOZOS-QZTJIDSGSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2ccccc2CC(C)C)[C@H](OC)C1	ZINC001082391029	1358026270	/nfs/dbraw/zinc/02/62/70/1358026270.db2.gz	QHBVGAQDBXVDRB-WOJBJXKFSA-N	0	3	344.499	3.280	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@H]2CCC2(C)C)C[C@H]1NCc1ccc(C#N)c(F)c1	ZINC001082695383	1358077286	/nfs/dbraw/zinc/07/72/86/1358077286.db2.gz	ONOYUXVBLCPXSP-MZMPZRCHSA-N	0	3	343.446	3.070	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H](C)[C@H](NCc2cccc(OCC)n2)C1	ZINC001082721836	1358079942	/nfs/dbraw/zinc/07/99/42/1358079942.db2.gz	MCGXHMXLCKGFPZ-MDYRTPRTSA-N	0	3	345.487	3.019	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H](C)[C@H](NCc2ccc(Cl)nc2)C1	ZINC001082721901	1358079969	/nfs/dbraw/zinc/07/99/69/1358079969.db2.gz	OGIFGFNTCQRCEW-SIIHOXLZSA-N	0	3	335.879	3.274	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)c3ccc(CCC)cc3)[C@H]2C1	ZINC001083178564	1358121766	/nfs/dbraw/zinc/12/17/66/1358121766.db2.gz	AMBSUPYGWOCLJW-VQTJNVASSA-N	0	3	342.483	3.131	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)C[C@@H](C)C3CCCCC3)[C@H]2C1	ZINC001083222009	1358123793	/nfs/dbraw/zinc/12/37/93/1358123793.db2.gz	BPVGHOJPBRCHPW-NZSAHSFTSA-N	0	3	334.504	3.081	20	30		EGEDHN
Cc1ccccc1[C@H](C)N1CC[C@@H]2CN(C(=O)c3c[nH]c(C#N)c3)[C@@H]2C1	ZINC001084293759	1358186345	/nfs/dbraw/zinc/18/63/45/1358186345.db2.gz	WULMEVQEJBTOTR-RZQQEMMASA-N	0	3	348.450	3.102	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3cc(C(F)F)ccc3F)[C@@H]2C1	ZINC001084349392	1358197340	/nfs/dbraw/zinc/19/73/40/1358197340.db2.gz	JVNXZBPLRUBHLV-CZUORRHYSA-N	0	3	338.373	3.486	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3ccc(-c4ccncc4)o3)[C@@H]2C1	ZINC001084405728	1358207891	/nfs/dbraw/zinc/20/78/91/1358207891.db2.gz	ZVIPJULNEXHKIH-IAGOWNOFSA-N	0	3	337.423	3.064	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3ccnc(-c4ccco4)c3)[C@@H]2C1	ZINC001084438071	1358213070	/nfs/dbraw/zinc/21/30/70/1358213070.db2.gz	OFKUAQARZLZGBR-SJLPKXTDSA-N	0	3	337.423	3.064	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)Cn3cc(C)c4ccccc43)[C@@H]2C1	ZINC001084716974	1358292008	/nfs/dbraw/zinc/29/20/08/1358292008.db2.gz	DWMOHYQATGHJEI-YLJYHZDGSA-N	0	3	337.467	3.059	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)c3c[nH]cc3-c3ccccc3)[C@@H]2C1	ZINC001084830731	1358322254	/nfs/dbraw/zinc/32/22/54/1358322254.db2.gz	FYOHXTZATYRKGP-YLJYHZDGSA-N	0	3	335.451	3.404	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)CC[C@H]3CCc4ccccc43)[C@@H]2C1	ZINC001084846999	1358327630	/nfs/dbraw/zinc/32/76/30/1358327630.db2.gz	HFSVBVJNTFPWTK-SFHLNBCPSA-N	0	3	336.479	3.053	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)CCc3cc(F)ccc3F)[C@@H]2C1	ZINC001084851278	1358329011	/nfs/dbraw/zinc/32/90/11/1358329011.db2.gz	VQCVMKJBPVPGAI-CRAIPNDOSA-N	0	3	334.410	3.006	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC[C@H]2CCN(Cc3ccc(C(F)F)cc3)[C@H]2C1	ZINC001084907034	1358344549	/nfs/dbraw/zinc/34/45/49/1358344549.db2.gz	RLDCESKFJIUVQY-UNEWFSDZSA-N	0	3	347.409	3.207	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3c3ccc(F)cc3F)C[C@@H]21	ZINC001084996761	1358361578	/nfs/dbraw/zinc/36/15/78/1358361578.db2.gz	ZMUNDXAJKOAXRA-TWILYEHCSA-N	0	3	346.421	3.177	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C[C@H](C)c3cccc(F)c3)C[C@@H]21	ZINC001085028582	1358371608	/nfs/dbraw/zinc/37/16/08/1358371608.db2.gz	VAUBXKHPHFYTNH-QKLQHJQFSA-N	0	3	342.458	3.265	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C[C@@H](C)c3ccccc3C)C[C@@H]21	ZINC001085048910	1358378321	/nfs/dbraw/zinc/37/83/21/1358378321.db2.gz	OZRKPHSGHNDRDB-SBHAEUEKSA-N	0	3	338.495	3.435	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@@]3(C)C[C@@H]3c3ccccc3)C[C@@H]21	ZINC001085053709	1358380448	/nfs/dbraw/zinc/38/04/48/1358380448.db2.gz	LXOXPGBQIJTVIY-JBPLPALLSA-N	0	3	336.479	3.126	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)C=C1CCC1	ZINC001085166535	1358421150	/nfs/dbraw/zinc/42/11/50/1358421150.db2.gz	GNLBNDCHSIEOEK-ZIAGYGMSSA-N	0	3	327.266	3.022	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)C(C)=C1CCC1	ZINC001085194561	1358430398	/nfs/dbraw/zinc/43/03/98/1358430398.db2.gz	KHJXOKOOQUFTES-HUUCEWRRSA-N	0	3	341.293	3.412	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)C1(C2CC2)CC1	ZINC001085236478	1358439889	/nfs/dbraw/zinc/43/98/89/1358439889.db2.gz	YSZBGTQMCVUHAV-ZIAGYGMSSA-N	0	3	341.293	3.102	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCCC[C@H]2NC(=O)[C@@H]2CC23CC3)c(F)c1	ZINC001085343707	1358472273	/nfs/dbraw/zinc/47/22/73/1358472273.db2.gz	CTOPNZUIFJCYFW-CGTJXYLNSA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1sc(C)cc1OC	ZINC001085351928	1358475782	/nfs/dbraw/zinc/47/57/82/1358475782.db2.gz	IOEIGWVIQQYPSG-CHWSQXEVSA-N	0	3	342.892	3.448	20	30		EGEDHN
C#CCOc1ccc(C(=O)N[C@@H]2CCCC[C@H]2NCC(=C)Cl)cc1	ZINC001085356434	1358476868	/nfs/dbraw/zinc/47/68/68/1358476868.db2.gz	XECREAAEVYFQFS-QZTJIDSGSA-N	0	3	346.858	3.082	20	30		EGEDHN
CC(C)(C)C(=O)N[C@@H]1CCCC[C@H]1NCc1ccc(C#N)cc1F	ZINC001085402258	1358490483	/nfs/dbraw/zinc/49/04/83/1358490483.db2.gz	CHPWLSBZRIRNHL-IAGOWNOFSA-N	0	3	331.435	3.260	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1c(F)ccc2ccncc21	ZINC001085610697	1358632310	/nfs/dbraw/zinc/63/23/10/1358632310.db2.gz	ZGLZJKCWVATAJS-MRXNPFEDSA-N	0	3	341.430	3.486	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N(C)C[C@H]1CCN1CC1CC(C)C1	ZINC001085678394	1358681937	/nfs/dbraw/zinc/68/19/37/1358681937.db2.gz	IPHSEZTUQAMWEM-DAWZGUTISA-N	0	3	342.483	3.444	20	30		EGEDHN
CCCC[C@@](C)(F)C(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001183799739	1387351060	/nfs/dbraw/zinc/35/10/60/1387351060.db2.gz	LJMBUCVMLJTRGU-VQIMIIECSA-N	0	3	349.425	3.306	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1ccc2c(c1)C(C)(C)CO2	ZINC001085717305	1358708029	/nfs/dbraw/zinc/70/80/29/1358708029.db2.gz	JKCSDINBFFNMKQ-INIZCTEOSA-N	0	3	328.456	3.079	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc2c(c1)C(C)(C)CO2	ZINC001085717442	1358708073	/nfs/dbraw/zinc/70/80/73/1358708073.db2.gz	NKENYKRPSQSHLE-QGZVFWFLSA-N	0	3	342.483	3.469	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@@H]1COc2ccc(Cl)cc21	ZINC001085722576	1358712425	/nfs/dbraw/zinc/71/24/25/1358712425.db2.gz	BHDWRDRKMWTYAQ-NVXWUHKLSA-N	0	3	348.874	3.315	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc(F)c(F)c(F)c1	ZINC001085834655	1358800692	/nfs/dbraw/zinc/80/06/92/1358800692.db2.gz	PYEGTOXVNSNDSJ-ZDUSSCGKSA-N	0	3	326.362	3.216	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccnc(OC2CCC2)c1	ZINC001085897213	1358856052	/nfs/dbraw/zinc/85/60/52/1358856052.db2.gz	YTYDJWDSLSBASY-QGZVFWFLSA-N	0	3	343.471	3.125	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1cnn(C2CCCCC2)c1	ZINC001085913644	1358874195	/nfs/dbraw/zinc/87/41/95/1358874195.db2.gz	GMUYAESKQKGNBD-SFHVURJKSA-N	0	3	330.476	3.111	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1cnn(C(C)C)c1C1CC1	ZINC001085916305	1358876398	/nfs/dbraw/zinc/87/63/98/1358876398.db2.gz	WOBOCLGRPVSYEY-INIZCTEOSA-N	0	3	330.476	3.064	20	30		EGEDHN
C=CCCN1CC[C@@H]1CN(C)C(=O)c1cccc(OCC(C)C)c1	ZINC001085964714	1358922634	/nfs/dbraw/zinc/92/26/34/1358922634.db2.gz	OZAYFFJPSXHTGF-GOSISDBHSA-N	0	3	330.472	3.444	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1csc(CC(C)C)n1	ZINC001085999121	1358954313	/nfs/dbraw/zinc/95/43/13/1358954313.db2.gz	AMWSAYYAKQBNMA-OAHLLOKOSA-N	0	3	335.517	3.454	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(Cl)cc2C)C1	ZINC001086186954	1359020798	/nfs/dbraw/zinc/02/07/98/1359020798.db2.gz	XYTNOBPCJLQMLM-XBXGTLAGSA-N	0	3	327.255	3.499	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(F)c(Cl)c2F)C1	ZINC001086187046	1359020968	/nfs/dbraw/zinc/02/09/68/1359020968.db2.gz	CUZNQSOKBHSZMG-AOOOYVTPSA-N	0	3	349.208	3.469	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)NC[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001086190791	1359022753	/nfs/dbraw/zinc/02/27/53/1359022753.db2.gz	MARRXIDYIPVTLQ-XYVMCAHJSA-N	0	3	343.446	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@H]2CCc3ccccc3C2)C1	ZINC001086210979	1359028375	/nfs/dbraw/zinc/02/83/75/1359028375.db2.gz	GYVWKHILHHVJMH-JCGIZDLHSA-N	0	3	332.875	3.028	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2)C1	ZINC001086282490	1359054678	/nfs/dbraw/zinc/05/46/78/1359054678.db2.gz	OAGVBKUCXPUZOK-NKKGCODLSA-N	0	3	336.838	3.166	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@H](CNC(=O)[C@H]3CC=CCC3)C2)c1	ZINC001086306687	1359063255	/nfs/dbraw/zinc/06/32/55/1359063255.db2.gz	QGYBFQNUUKHJJV-BQFCYCMXSA-N	0	3	341.430	3.038	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc3c(c2)CCCC3)C1	ZINC001086547340	1359141135	/nfs/dbraw/zinc/14/11/35/1359141135.db2.gz	DVNAYJFRDFLKTG-PPUGGXLSSA-N	0	3	332.875	3.416	20	30		EGEDHN
C=C(C)CN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2ccc(C)n2C)C1	ZINC001086574086	1359152746	/nfs/dbraw/zinc/15/27/46/1359152746.db2.gz	ZWMZLILUWHZMEP-RBUKOAKNSA-N	0	3	337.467	3.107	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2cscc2C)C1	ZINC001086581351	1359154809	/nfs/dbraw/zinc/15/48/09/1359154809.db2.gz	VKWLQNJMKCWBCH-PKOBYXMFSA-N	0	3	338.476	3.278	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)[C@@H]2CCCC23CC3)C1	ZINC001086595384	1359158851	/nfs/dbraw/zinc/15/88/51/1359158851.db2.gz	ZGSUUGSDIYRHBY-SLFFLAALSA-N	0	3	336.479	3.174	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)[C@@]23C[C@@H]2CCCC3)C1	ZINC001086608004	1359162716	/nfs/dbraw/zinc/16/27/16/1359162716.db2.gz	ICIAHQSFLUBARX-KEZQHZCBSA-N	0	3	336.479	3.174	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)[C@H]2CC23CCCC3)C1	ZINC001086617884	1359165619	/nfs/dbraw/zinc/16/56/19/1359165619.db2.gz	DIOANSYYWRRKBK-XUVXKRRUSA-N	0	3	336.479	3.174	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)Cc2ccccc2C)C1	ZINC001086623255	1359167816	/nfs/dbraw/zinc/16/78/16/1359167816.db2.gz	UJVAGPZIPFGZAI-FCHUYYIVSA-N	0	3	346.474	3.145	20	30		EGEDHN
C=C(C)CN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2cccn2CC)C1	ZINC001086624590	1359168874	/nfs/dbraw/zinc/16/88/74/1359168874.db2.gz	LPJPZEYNBHUBEE-RBUKOAKNSA-N	0	3	337.467	3.282	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CC[C@H](CNC(=O)[C@H]2CC=CCC2)C1	ZINC001086642504	1359175138	/nfs/dbraw/zinc/17/51/38/1359175138.db2.gz	IKAVUCHNCNTNSW-ABSDTBQOSA-N	0	3	337.467	3.289	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cncc(Cl)c2C)C1	ZINC001086723160	1359191480	/nfs/dbraw/zinc/19/14/80/1359191480.db2.gz	VFSNMAXJXCLKLZ-QWHCGFSZSA-N	0	3	342.270	3.284	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CC[C@H](CNC(=O)C2CC3(CC3)C2)C1	ZINC001086799556	1359204528	/nfs/dbraw/zinc/20/45/28/1359204528.db2.gz	UPSPPSHVKJSDPV-HNAYVOBHSA-N	0	3	337.467	3.123	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)[C@@H]2CCCC(F)(F)C2)C1	ZINC001086800856	1359204656	/nfs/dbraw/zinc/20/46/56/1359204656.db2.gz	FRGZDTGKLCLIKK-BFHYXJOUSA-N	0	3	334.838	3.439	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)C2CCC(F)(F)CC2)C1	ZINC001086814441	1359207235	/nfs/dbraw/zinc/20/72/35/1359207235.db2.gz	UQMAOZBYLLHUON-GXTWGEPZSA-N	0	3	334.838	3.439	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3sc(C)cc3C)C2)CC1	ZINC001086925304	1359250289	/nfs/dbraw/zinc/25/02/89/1359250289.db2.gz	RZAFBSINEOSZPX-OAHLLOKOSA-N	0	3	330.497	3.315	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc(F)c(F)c3)C2)CC1	ZINC001086926763	1359251984	/nfs/dbraw/zinc/25/19/84/1359251984.db2.gz	JFTCLWOHNQKPPY-OAHLLOKOSA-N	0	3	346.421	3.305	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cc(C)c(F)cc3F)C2)CC1	ZINC001086928721	1359253136	/nfs/dbraw/zinc/25/31/36/1359253136.db2.gz	NCRMHZNAXBMSSH-HNNXBMFYSA-N	0	3	346.421	3.223	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3c(C)oc(C)c3C)C2)CC1	ZINC001086931543	1359255304	/nfs/dbraw/zinc/25/53/04/1359255304.db2.gz	LGTXMWGRWDNLND-AWEZNQCLSA-N	0	3	328.456	3.155	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)[C@H]3CCCCC3(F)F)C2)CC1	ZINC001086934155	1359257590	/nfs/dbraw/zinc/25/75/90/1359257590.db2.gz	INQDMXLYZRRTMG-JKSUJKDBSA-N	0	3	338.442	3.148	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc(C)c(F)c3F)C2)CC1	ZINC001086944199	1359265242	/nfs/dbraw/zinc/26/52/42/1359265242.db2.gz	RKJRQISUOKXJQJ-HNNXBMFYSA-N	0	3	346.421	3.223	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H](F)c3ccccc3)C2)CC1	ZINC001086945753	1359266906	/nfs/dbraw/zinc/26/69/06/1359266906.db2.gz	IEFNWIIWEHBGLU-AEFFLSMTSA-N	0	3	328.431	3.033	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3ccc4ccn(C)c4c3)C2)CC1	ZINC001086951764	1359271949	/nfs/dbraw/zinc/27/19/49/1359271949.db2.gz	PHTRKJFFMXCDRE-KRWDZBQOSA-N	0	3	349.478	3.128	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](CNCc2cc(C3CC3)no2)[C@@H](C)C1	ZINC001184079194	1387389446	/nfs/dbraw/zinc/38/94/46/1387389446.db2.gz	VBWOYMRWQDSGSF-GOEBONIOSA-N	0	3	331.460	3.092	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(F)cc3)C(C)(C)[C@H]21	ZINC001087267336	1359339074	/nfs/dbraw/zinc/33/90/74/1359339074.db2.gz	ZJXKFIXILFIVTK-KURKYZTESA-N	0	3	328.431	3.068	20	30		EGEDHN
C=C(C)C[N@@H+]1CCC[C@@H]2[C@@H](NC(=O)c3ccccc3[O-])C(C)(C)[C@H]21	ZINC001087271542	1359344829	/nfs/dbraw/zinc/34/48/29/1359344829.db2.gz	SSCFMEKYLNLVPL-NXHRZFHOSA-N	0	3	328.456	3.187	20	30		EGEDHN
C=C(C)C[N@H+]1CCC[C@@H]2[C@@H](NC(=O)c3ccccc3[O-])C(C)(C)[C@H]21	ZINC001087271542	1359344832	/nfs/dbraw/zinc/34/48/32/1359344832.db2.gz	SSCFMEKYLNLVPL-NXHRZFHOSA-N	0	3	328.456	3.187	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)CC3CC(F)(F)C3)C(C)(C)[C@@H]21	ZINC001087292968	1359373334	/nfs/dbraw/zinc/37/33/34/1359373334.db2.gz	VMETTWUUHDRHCQ-DJIMGWMZSA-N	0	3	338.442	3.050	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(Cl)cc3F)C(C)(C)[C@@H]21	ZINC001087294064	1359374036	/nfs/dbraw/zinc/37/40/36/1359374036.db2.gz	NRIMGZAEUOCFDB-DJIMGWMZSA-N	0	3	348.849	3.331	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cn(C)c2ccccc12	ZINC001087293845	1359374506	/nfs/dbraw/zinc/37/45/06/1359374506.db2.gz	KVTVXBUPTSBQBM-LSTHTHJFSA-N	0	3	349.478	3.030	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1c(C)oc(C)c1C	ZINC001087295220	1359375790	/nfs/dbraw/zinc/37/57/90/1359375790.db2.gz	GFGFANBHVGBBGH-BPQIPLTHSA-N	0	3	328.456	3.057	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)C3CCC4(CC4)CC3)C(C)(C)[C@H]21	ZINC001087297779	1359380749	/nfs/dbraw/zinc/38/07/49/1359380749.db2.gz	TVINVKKZHPMXFX-SQNIBIBYSA-N	0	3	328.500	3.195	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)C3CCC4(CC4)CC3)C(C)(C)[C@@H]21	ZINC001087297778	1359380912	/nfs/dbraw/zinc/38/09/12/1359380912.db2.gz	TVINVKKZHPMXFX-KZNAEPCWSA-N	0	3	328.500	3.195	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc[nH]c3CCC)C(C)(C)[C@@H]21	ZINC001087300614	1359383198	/nfs/dbraw/zinc/38/31/98/1359383198.db2.gz	NYGWROJYEJPXLC-BHIYHBOVSA-N	0	3	341.499	3.209	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2[C@H]3CCCN(CC#CC)[C@H]3C2(C)C)CC1	ZINC001087303364	1359386943	/nfs/dbraw/zinc/38/69/43/1359386943.db2.gz	KMTADJDUQSOHJL-GUDVDZBRSA-N	0	3	328.500	3.361	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc4cc[nH]c43)C(C)(C)[C@H]21	ZINC001087304398	1359388780	/nfs/dbraw/zinc/38/87/80/1359388780.db2.gz	BLKCJOLKJGXJMP-RLLQIKCJSA-N	0	3	349.478	3.410	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc[nH]c3C3CCC3)C(C)(C)[C@@H]21	ZINC001087305564	1359391313	/nfs/dbraw/zinc/39/13/13/1359391313.db2.gz	VLBDJMLWZIEJIJ-BHIYHBOVSA-N	0	3	339.483	3.134	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)Cc1ccsc1C	ZINC001087307847	1359394383	/nfs/dbraw/zinc/39/43/83/1359394383.db2.gz	IEWOLNVAZMEBNL-NZSAHSFTSA-N	0	3	344.524	3.228	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc4c3ccn4C)C(C)(C)[C@@H]21	ZINC001087309046	1359396054	/nfs/dbraw/zinc/39/60/54/1359396054.db2.gz	ZOTHSXBCNFPYKK-MISYRCLQSA-N	0	3	349.478	3.030	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cccc4ccncc43)C(C)(C)[C@H]21	ZINC001087311149	1359398915	/nfs/dbraw/zinc/39/89/15/1359398915.db2.gz	JRYOLOZFBZBZFL-HOJAQTOUSA-N	0	3	347.462	3.087	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)C1(F)CCCCC1	ZINC001087313360	1359402074	/nfs/dbraw/zinc/40/20/74/1359402074.db2.gz	SWQNKNARXVZYNK-IXDOHACOSA-N	0	3	334.479	3.287	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(CC(C)C)c[nH]3)C(C)(C)[C@@H]21	ZINC001087314691	1359404326	/nfs/dbraw/zinc/40/43/26/1359404326.db2.gz	PHXUIPBSPHZASG-BHIYHBOVSA-N	0	3	341.499	3.065	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)Cc3ccc(Cl)cc3)C(C)(C)[C@H]21	ZINC001087315543	1359405963	/nfs/dbraw/zinc/40/59/63/1359405963.db2.gz	DMVGKCMOVHSBLE-QRQLOZEOSA-N	0	3	344.886	3.121	20	30		EGEDHN
C=CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)c2conc2C)C1	ZINC001087436194	1359464926	/nfs/dbraw/zinc/46/49/26/1359464926.db2.gz	DGZCDNSJJSANRG-IEBWSBKVSA-N	0	3	339.439	3.147	20	30		EGEDHN
C=CCCN1CC[C@@H](c2ccc(OC)c(F)c2)[C@@H](NC(=O)C(C)C)C1	ZINC001087476958	1359483091	/nfs/dbraw/zinc/48/30/91/1359483091.db2.gz	ONFKRYUHZPIDMH-WMZOPIPTSA-N	0	3	348.462	3.341	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CN(CC)CC[C@H]2c2ccc(OC)cc2)C1	ZINC001087475327	1359483791	/nfs/dbraw/zinc/48/37/91/1359483791.db2.gz	BVZBTULSZAYGHS-OALUTQOASA-N	0	3	342.483	3.346	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccnn2-c2ccccc2)[C@H]1CC	ZINC001087626410	1359561921	/nfs/dbraw/zinc/56/19/21/1359561921.db2.gz	YBDGGAQUDPXYRI-ZWKOTPCHSA-N	0	3	338.455	3.031	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cc(C)n([C@H](C)CC)n2)[C@H]1CC	ZINC001087635096	1359565292	/nfs/dbraw/zinc/56/52/92/1359565292.db2.gz	JZRFARMMEOPDSL-UWWQBHOKSA-N	0	3	332.492	3.321	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(F)cc2Cl)[C@H]1CC	ZINC001087713119	1359605051	/nfs/dbraw/zinc/60/50/51/1359605051.db2.gz	TVEGGPAANSSSLB-DLBZAZTESA-N	0	3	336.838	3.014	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)C2CC3(CC3)C2)CCN1Cc1ccc(C#N)cc1	ZINC001087719782	1359610813	/nfs/dbraw/zinc/61/08/13/1359610813.db2.gz	MWLZIKNAWKQFOE-RBUKOAKNSA-N	0	3	337.467	3.218	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2csc(-c3ccoc3)n2)[C@H]1CC	ZINC001087765885	1359634274	/nfs/dbraw/zinc/63/42/74/1359634274.db2.gz	CPOKOMUTWRCTRI-GOEBONIOSA-N	0	3	343.452	3.009	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnn(C3CCCCC3)c2)[C@H]1CC	ZINC001087786751	1359643878	/nfs/dbraw/zinc/64/38/78/1359643878.db2.gz	QXWDFARHUCTZIM-ZWKOTPCHSA-N	0	3	330.476	3.157	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cc3nc(C)ccc3o2)[C@H]1CC	ZINC001087804534	1359654119	/nfs/dbraw/zinc/65/41/19/1359654119.db2.gz	HJKDAOVHJUQILJ-GOEBONIOSA-N	0	3	327.428	3.295	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)[C@@]2(c3ccccc3)CCCO2)[C@H]1CC	ZINC001087809012	1359658714	/nfs/dbraw/zinc/65/87/14/1359658714.db2.gz	VKJIXGDBVRRDDW-ZVDOUQERSA-N	0	3	342.483	3.238	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3oc4ccccc4c3CC)C[C@@H]2C1	ZINC001088217249	1359800432	/nfs/dbraw/zinc/80/04/32/1359800432.db2.gz	WBRWVHJHRKXRQM-CVEARBPZSA-N	0	3	336.435	3.022	20	30		EGEDHN
C=CCN1CC[C@H](OCC2CCN(C(=O)c3ccc(C)s3)CC2)C1	ZINC001088228714	1359808198	/nfs/dbraw/zinc/80/81/98/1359808198.db2.gz	YMKQUNSJVNBHES-KRWDZBQOSA-N	0	3	348.512	3.186	20	30		EGEDHN
C=CCN1CC[C@H](OCC2CCN(C(=O)[C@@H]3CCC(C)(C)C3)CC2)C1	ZINC001088238279	1359809830	/nfs/dbraw/zinc/80/98/30/1359809830.db2.gz	QHCYSJPLKXWJJB-MOPGFXCFSA-N	0	3	348.531	3.328	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2cccc3[nH]ncc32)C1	ZINC001088358264	1359841759	/nfs/dbraw/zinc/84/17/59/1359841759.db2.gz	YNEOGQUBVHEZFO-CQSZACIVSA-N	0	3	346.862	3.290	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2cccc3nc[nH]c32)C1	ZINC001088403484	1359876492	/nfs/dbraw/zinc/87/64/92/1359876492.db2.gz	VHBPCXKXYLMHSD-CQSZACIVSA-N	0	3	346.862	3.290	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2cnn(C(C)C)c2)C1	ZINC001088412425	1359883823	/nfs/dbraw/zinc/88/38/23/1359883823.db2.gz	IDCUKFFHTWKKSR-INIZCTEOSA-N	0	3	338.883	3.191	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2ccc(N(C)C)cc2)C1	ZINC001088418813	1359889259	/nfs/dbraw/zinc/88/92/59/1359889259.db2.gz	ZPOKHLJDLMPVFP-QGZVFWFLSA-N	0	3	349.906	3.480	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N[C@H]1CCN(Cc2ccc(C)cc2)[C@@H]1C	ZINC001088575718	1359977659	/nfs/dbraw/zinc/97/76/59/1359977659.db2.gz	CKRYLELJPZZAIE-LMCOJAPRSA-N	0	3	342.483	3.055	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)Cn2c(C)cc3ccccc32)[C@H]1C	ZINC001088720548	1360021505	/nfs/dbraw/zinc/02/15/05/1360021505.db2.gz	PSSAPMLLWYCQMK-AEFFLSMTSA-N	0	3	325.456	3.105	20	30		EGEDHN
C=C(Cl)CN(CC1CC1)C1CCN(C(=O)c2ccsn2)CC1	ZINC001323733957	1387435719	/nfs/dbraw/zinc/43/57/19/1387435719.db2.gz	PVXNDDBKFMHXMU-UHFFFAOYSA-N	0	3	339.892	3.212	20	30		EGEDHN
C=CCCN1CC[C@H](NC(=O)c2sc(Cl)nc2Cl)[C@H]1C	ZINC001089042839	1360145396	/nfs/dbraw/zinc/14/53/96/1360145396.db2.gz	WWDMDHLYZJTJEX-BDAKNGLRSA-N	0	3	334.272	3.219	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@H](CNCc2c(F)cccc2F)[C@H](C)C1	ZINC001184356034	1387439064	/nfs/dbraw/zinc/43/90/64/1387439064.db2.gz	GSYOVEXOGFYXDA-HZPDHXFCSA-N	0	3	348.437	3.198	20	30		EGEDHN
CS[C@@H](C)C(=O)N1CCCC[C@H]1CN(C)Cc1cccc(C#N)c1	ZINC001089124537	1360187469	/nfs/dbraw/zinc/18/74/69/1360187469.db2.gz	ZWYMTOYJEZOBMR-YJBOKZPZSA-N	0	3	345.512	3.123	20	30		EGEDHN
CC1(C)C[C@@H](NC(=O)c2ccc[nH]2)CCN(CC#Cc2ccccc2)C1	ZINC001089312099	1360331044	/nfs/dbraw/zinc/33/10/44/1360331044.db2.gz	HHVHRQLGLGKPOW-IBGZPJMESA-N	0	3	349.478	3.287	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc(F)ccc2CC)CC(C)(C)C1	ZINC001089431094	1360422876	/nfs/dbraw/zinc/42/28/76/1360422876.db2.gz	YTCHDZJMUQRKHF-QGZVFWFLSA-N	0	3	330.447	3.242	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccnc3ccccc32)CC(C)(C)C1	ZINC001089435195	1360426087	/nfs/dbraw/zinc/42/60/87/1360426087.db2.gz	FLMMCRZMCQOAFD-MRXNPFEDSA-N	0	3	335.451	3.088	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)Cc2ccc(C(F)F)cc2)CC(C)(C)C1	ZINC001089440146	1360430212	/nfs/dbraw/zinc/43/02/12/1360430212.db2.gz	WVBHKHDVALESJO-KRWDZBQOSA-N	0	3	348.437	3.407	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2scnc2C(C)C)CC(C)(C)C1	ZINC001089515718	1360486148	/nfs/dbraw/zinc/48/61/48/1360486148.db2.gz	ZAWHERHCJIGDIS-AWEZNQCLSA-N	0	3	333.501	3.120	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@H](C)c2cc(C)oc2C)CC(C)(C)C1	ZINC001089519932	1360488065	/nfs/dbraw/zinc/48/80/65/1360488065.db2.gz	PODDWKYXRKRFBD-NVXWUHKLSA-N	0	3	330.472	3.240	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc3nc(C)ccc3c2)CC(C)(C)C1	ZINC001089524675	1360489541	/nfs/dbraw/zinc/48/95/41/1360489541.db2.gz	RVWDEQGAKFBHEO-IBGZPJMESA-N	0	3	349.478	3.397	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cccn2C2CCCC2)CC(C)(C)C1	ZINC001089525886	1360490441	/nfs/dbraw/zinc/49/04/41/1360490441.db2.gz	ZVTYIRLLZTWQGT-QGZVFWFLSA-N	0	3	341.499	3.457	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2coc3ccccc23)CC(C)(C)C1	ZINC001089528417	1360491762	/nfs/dbraw/zinc/49/17/62/1360491762.db2.gz	KASUDSZWVUMEOQ-QGZVFWFLSA-N	0	3	338.451	3.215	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2c(F)cccc2Cl)CC(C)(C)C1	ZINC001089544888	1360500733	/nfs/dbraw/zinc/50/07/33/1360500733.db2.gz	BNGTZNQPVHKHPM-CYBMUJFWSA-N	0	3	336.838	3.333	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccnn1C(F)F	ZINC001089647314	1360560500	/nfs/dbraw/zinc/56/05/00/1360560500.db2.gz	VFWSBVPVRFXKGY-CYBMUJFWSA-N	0	3	340.418	3.075	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(C)nc(C)c1	ZINC001089648660	1360561769	/nfs/dbraw/zinc/56/17/69/1360561769.db2.gz	OUQZIGAFPWXJPU-SFHVURJKSA-N	0	3	329.488	3.495	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1c(C)cc(C)nc1C	ZINC001089675817	1360584064	/nfs/dbraw/zinc/58/40/64/1360584064.db2.gz	QXTKNRFQBCKEFB-GOSISDBHSA-N	0	3	341.499	3.251	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ccn(C)c1CC	ZINC001089691717	1360597849	/nfs/dbraw/zinc/59/78/49/1360597849.db2.gz	WLHARWQWQFVNQY-INIZCTEOSA-N	0	3	331.504	3.384	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1nccc2[nH]ccc21	ZINC001089695040	1360599961	/nfs/dbraw/zinc/59/99/61/1360599961.db2.gz	AWUYVBGSDPPOHD-HNNXBMFYSA-N	0	3	340.471	3.359	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc2c(c1)C[C@H](C)O2	ZINC001089711730	1360615283	/nfs/dbraw/zinc/61/52/83/1360615283.db2.gz	ZNMZSUKPBUKCPT-YJBOKZPZSA-N	0	3	342.483	3.416	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cnn(CC2CC2)c1	ZINC001089722146	1360624690	/nfs/dbraw/zinc/62/46/90/1360624690.db2.gz	ROIKNXQMKQACTQ-GOSISDBHSA-N	0	3	344.503	3.090	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ccccc1OC	ZINC001089726578	1360630167	/nfs/dbraw/zinc/63/01/67/1360630167.db2.gz	OJTXZUNCIYEROI-INIZCTEOSA-N	0	3	330.472	3.492	20	30		EGEDHN
N#Cc1ccccc1CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)CC1CC1	ZINC001089758805	1360652086	/nfs/dbraw/zinc/65/20/86/1360652086.db2.gz	SZZHDCYVSBAWKS-WOZUAGRISA-N	0	3	349.478	3.027	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C1CC(C)(C)C1	ZINC001089807986	1360672373	/nfs/dbraw/zinc/67/23/73/1360672373.db2.gz	DSLBLBBESVAJBS-LLLHUVSDSA-N	0	3	336.907	3.344	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1[nH]c(C)cc1C	ZINC001089825539	1360681981	/nfs/dbraw/zinc/68/19/81/1360681981.db2.gz	CKVCCJFGIVHUON-NXOAAHMSSA-N	0	3	347.890	3.166	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)C12CCC(CC1)C2	ZINC001089826027	1360681992	/nfs/dbraw/zinc/68/19/92/1360681992.db2.gz	FOWBOGONNSBYPL-OTXAENBESA-N	0	3	348.918	3.488	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C2CCC(=C)CC2)CC2(CCOCC2)C1	ZINC001089950974	1360760730	/nfs/dbraw/zinc/76/07/30/1360760730.db2.gz	DRFHOVVRSXGQNR-LJQANCHMSA-N	0	3	346.515	3.296	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)C2CCC(C)(C)CC2)CC2(CCOCC2)C1	ZINC001089969625	1360772516	/nfs/dbraw/zinc/77/25/16/1360772516.db2.gz	LNDMFMVOIYKFBP-SFHVURJKSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)c2ccccc2C)C1	ZINC001090906582	1360951534	/nfs/dbraw/zinc/95/15/34/1360951534.db2.gz	WCNDKJOFPMZYDS-UHFFFAOYSA-N	0	3	337.261	3.002	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccnn2C(CC)CC)C1	ZINC001091068890	1360988652	/nfs/dbraw/zinc/98/86/52/1360988652.db2.gz	ITHCIBGYWMTGFU-UHFFFAOYSA-N	0	3	338.883	3.095	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H]2COc3cc(C)c(C)cc32)C1	ZINC001091162383	1360999769	/nfs/dbraw/zinc/99/97/69/1360999769.db2.gz	KTOQFYIHSBVNJC-VMBOVVBDSA-N	0	3	348.874	3.016	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc(F)cc3cccnc32)C1	ZINC001091265930	1361026609	/nfs/dbraw/zinc/02/66/09/1361026609.db2.gz	PFUPUQJXQWGTTH-UHFFFAOYSA-N	0	3	347.821	3.224	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)C1	ZINC001091275686	1361028738	/nfs/dbraw/zinc/02/87/38/1361028738.db2.gz	MZRJTGOUZRUBRH-NWCILSHNSA-N	0	3	348.874	3.036	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc(C)nc3ccccc32)C1	ZINC001091353137	1361056833	/nfs/dbraw/zinc/05/68/33/1361056833.db2.gz	XHEAQGZBAKQTQX-UHFFFAOYSA-N	0	3	343.858	3.394	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2c[nH]c3ccc(C)cc23)C1	ZINC001091379755	1361069625	/nfs/dbraw/zinc/06/96/25/1361069625.db2.gz	FFESIMDRYTWYIL-UHFFFAOYSA-N	0	3	331.847	3.327	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccccc3C(C)(C)C)C[C@]2(C)C1	ZINC001091768715	1361215444	/nfs/dbraw/zinc/21/54/44/1361215444.db2.gz	PMJZQIKNUKCLBS-VGSWGCGISA-N	0	3	338.495	3.401	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc(CCCC)cc3)C[C@]2(C)C1	ZINC001091834025	1361232100	/nfs/dbraw/zinc/23/21/00/1361232100.db2.gz	IJJKJHYNKILFMQ-IRLDBZIGSA-N	0	3	338.495	3.446	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)[C@@H](CC3CCCC3)C(C)C)C[C@]2(C)C1	ZINC001092065478	1361286675	/nfs/dbraw/zinc/28/66/75/1361286675.db2.gz	NGECCXRSCASNTJ-DYXWJJEUSA-N	0	3	330.516	3.252	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C[C@@H]3CCCC(C)(C)C3)C[C@]2(C)C1	ZINC001092200087	1361321000	/nfs/dbraw/zinc/32/10/00/1361321000.db2.gz	CWFFIWZWNQZKHF-UEXGIBASSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3sccc3C(F)F)C[C@]2(C)C1	ZINC001092238916	1361336808	/nfs/dbraw/zinc/33/68/08/1361336808.db2.gz	YZZXYCPPMBCYBW-PXAZEXFGSA-N	0	3	338.423	3.103	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)Cc3ccc4ccccc4c3)C[C@]2(C)C1	ZINC001092259697	1361346626	/nfs/dbraw/zinc/34/66/26/1361346626.db2.gz	LBTDGEWZFNMMQJ-GGAORHGYSA-N	0	3	346.474	3.186	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3cc4c(cccc4F)s3)C[C@]2(C)C1	ZINC001092259964	1361346801	/nfs/dbraw/zinc/34/68/01/1361346801.db2.gz	ZDCYUVSUWPRVOY-YJYMSZOUSA-N	0	3	342.439	3.068	20	30		EGEDHN
C=C[C@H](COC)N[C@@H]1C[C@H](NC(=O)OC(C)(C)C)c2ccccc21	ZINC001324020751	1387512065	/nfs/dbraw/zinc/51/20/65/1387512065.db2.gz	BCHUSNZMRUYJEI-XYPHTWIQSA-N	0	3	332.444	3.488	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1CNC(=O)c1ccccc1	ZINC001092437286	1361383810	/nfs/dbraw/zinc/38/38/10/1361383810.db2.gz	CYMLRYKQSFWSMG-WIYYLYMNSA-N	0	3	332.447	3.036	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)c2cc(C)cs2)CC1	ZINC001093369759	1361578660	/nfs/dbraw/zinc/57/86/60/1361578660.db2.gz	KTEOHVMKAWASPM-SFHVURJKSA-N	0	3	342.508	3.396	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C23CCC(CC2)C3)CC1	ZINC001093371683	1361581381	/nfs/dbraw/zinc/58/13/81/1361581381.db2.gz	ASHDDZRGIFWXDQ-BIXGBWIQSA-N	0	3	340.511	3.293	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)[C@H](C)C2CCC2)CC1	ZINC001093373508	1361583020	/nfs/dbraw/zinc/58/30/20/1361583020.db2.gz	NTZCENCNVUZSIZ-VQIMIIECSA-N	0	3	328.500	3.149	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C[C@@H]2C[C@H]2C2CC2)CC1	ZINC001093374141	1361583988	/nfs/dbraw/zinc/58/39/88/1361583988.db2.gz	AVKIGCSDOCQJOO-ZJOUEHCJSA-N	0	3	340.511	3.149	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C2(C)CCCC2)CC1	ZINC001093375304	1361585657	/nfs/dbraw/zinc/58/56/57/1361585657.db2.gz	RYFWQPIUSXZCHH-SFHVURJKSA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@@H]2CC23CCCC3)CC1	ZINC001093381101	1361592245	/nfs/dbraw/zinc/59/22/45/1361592245.db2.gz	GRDISHHYJBPRSQ-OALUTQOASA-N	0	3	340.511	3.293	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)C[C@@H](C)C2CC2)CC1	ZINC001093383027	1361594910	/nfs/dbraw/zinc/59/49/10/1361594910.db2.gz	HMQDEWYXCWNLOX-OXQOHEQNSA-N	0	3	328.500	3.149	20	30		EGEDHN
Cc1ccc(C)c(CN2[C@@H]3CC[C@H]2[C@@H](NC(=O)c2cc(C#N)c[nH]2)C3)c1	ZINC001095282086	1362082796	/nfs/dbraw/zinc/08/27/96/1362082796.db2.gz	NOHZTDVJXJBWMZ-HBFSDRIKSA-N	0	3	348.450	3.039	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc(-c3cnco3)cc1)C2	ZINC001095627851	1362190433	/nfs/dbraw/zinc/19/04/33/1362190433.db2.gz	NKSTWAGITPUIRO-SQNIBIBYSA-N	0	3	337.423	3.253	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H]1COc3cc(C)c(C)cc31)C2	ZINC001095817168	1362244222	/nfs/dbraw/zinc/24/42/22/1362244222.db2.gz	VMCMYKCJEWCIPU-YSHGAJCASA-N	0	3	340.467	3.077	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc3cc(Cl)ccc3[nH]1)C2	ZINC001095849919	1362254219	/nfs/dbraw/zinc/25/42/19/1362254219.db2.gz	NGSIMSOIZIFVHG-HFTRVMKXSA-N	0	3	341.842	3.180	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3CCOC2CCC2)CC1	ZINC001095971979	1362315791	/nfs/dbraw/zinc/31/57/91/1362315791.db2.gz	URLWDKMGQSLZJD-NEWSRXKRSA-N	0	3	332.488	3.023	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1scnc1C1CC1)C2	ZINC001096127837	1362397298	/nfs/dbraw/zinc/39/72/98/1362397298.db2.gz	JUMJCNBRSYHMCU-ILXRZTDVSA-N	0	3	331.485	3.322	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc3nc(C)ccc3c1)C2	ZINC001096220640	1362438240	/nfs/dbraw/zinc/43/82/40/1362438240.db2.gz	DCOWVWRFOJALMS-HOJAQTOUSA-N	0	3	335.451	3.454	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](C)c1cc3ccccc3o1)C2	ZINC001096305160	1362458312	/nfs/dbraw/zinc/45/83/12/1362458312.db2.gz	OMZVBJSVLYKGJX-RANZSIQMSA-N	0	3	336.435	3.281	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@H]1CCC3(CCC3)CO1)C2	ZINC001096400045	1362489506	/nfs/dbraw/zinc/48/95/06/1362489506.db2.gz	VIJROPMFRPBXMU-BDXSIMOUSA-N	0	3	332.488	3.023	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C1(c3ccc(C)cc3)CCC1)C2	ZINC001096635987	1362610208	/nfs/dbraw/zinc/61/02/08/1362610208.db2.gz	BHEIZZXFMHIOMK-AABGKKOBSA-N	0	3	336.479	3.162	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cccc([C@H]3CCOC3)c1)C2	ZINC001097380823	1362962619	/nfs/dbraw/zinc/96/26/19/1362962619.db2.gz	IVHZRGGLVHMWFL-NMLBUPMWSA-N	0	3	340.467	3.102	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cc3ncccc3o1)C2	ZINC001097559920	1363056515	/nfs/dbraw/zinc/05/65/15/1363056515.db2.gz	WILZHEKEJWKXLR-FMKPAKJESA-N	0	3	325.412	3.129	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1ccc(C(C)(C)C)cc1)C2	ZINC001097934441	1363170954	/nfs/dbraw/zinc/17/09/54/1363170954.db2.gz	ZZAHGSOIEGCRAG-AQNXPRMDSA-N	0	3	338.495	3.271	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)C[C@@H](NC(=O)C(C)C)c1ccccc1O2	ZINC001098541909	1363364127	/nfs/dbraw/zinc/36/41/27/1363364127.db2.gz	TVRQOXCSZLWKMA-XLIONFOSSA-N	0	3	328.456	3.303	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)C[C@@H](NC(=O)C1CC1)c1ccccc1O2	ZINC001098542116	1363364817	/nfs/dbraw/zinc/36/48/17/1363364817.db2.gz	VZVNBIVXRXPFJV-XLIONFOSSA-N	0	3	326.440	3.057	20	30		EGEDHN
CCCCCCCCCC(=O)N1CCC(N(CCO)CCF)CC1	ZINC001098543687	1363365767	/nfs/dbraw/zinc/36/57/67/1363365767.db2.gz	WNMMYCZDSFUHBL-UHFFFAOYSA-N	0	3	344.515	3.382	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H]1C[C@H]1CC(C)(C)C)C[C@@H](C)O2	ZINC001098603856	1363395043	/nfs/dbraw/zinc/39/50/43/1363395043.db2.gz	ZWFDRXCALQGAPP-FGTMMUONSA-N	0	3	348.531	3.327	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1sc(C)cc1C)C[C@@H](C)O2	ZINC001098603261	1363395053	/nfs/dbraw/zinc/39/50/53/1363395053.db2.gz	MCUARUYSTOYWNM-OAHLLOKOSA-N	0	3	348.512	3.246	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1CCC(C)(C)CC1)C[C@@H](C)O2	ZINC001098664896	1363426071	/nfs/dbraw/zinc/42/60/71/1363426071.db2.gz	YCTRAWSZLMUDCU-QGZVFWFLSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H]1CCCC(C)(C)C1)C[C@H](C)O2	ZINC001098664754	1363426155	/nfs/dbraw/zinc/42/61/55/1363426155.db2.gz	WAAQOXPTRBTMTK-ZWKOTPCHSA-N	0	3	348.531	3.471	20	30		EGEDHN
Cc1ccc(CN2CC(C)(C)CC[C@@H]2CNC(=O)[C@H](C)C#N)cc1	ZINC001098975696	1363550459	/nfs/dbraw/zinc/55/04/59/1363550459.db2.gz	MCFJMCBJVZWRQP-SJLPKXTDSA-N	0	3	327.472	3.262	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(C)c(F)c2F)C1	ZINC001099042009	1363589586	/nfs/dbraw/zinc/58/95/86/1363589586.db2.gz	HSNVGVAIDOZGRS-LIRRHRJNSA-N	0	3	334.410	3.434	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2ccc(Cl)c(OC)c2)C1	ZINC001099063077	1363602780	/nfs/dbraw/zinc/60/27/80/1363602780.db2.gz	PVFMCSQANCMBAI-KSSFIOAISA-N	0	3	334.847	3.119	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@H]1CCC(C)(C)CN1C[C@@H]1CC(C)(C)CO1	ZINC001099065104	1363604413	/nfs/dbraw/zinc/60/44/13/1363604413.db2.gz	MPLOREIFWZCMAO-MSOLQXFVSA-N	0	3	348.531	3.068	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@@H]1CCC(C)(C)CN1Cc1ccccc1	ZINC001099065908	1363604987	/nfs/dbraw/zinc/60/49/87/1363604987.db2.gz	ZPXPXFMPEVGKKY-IBGZPJMESA-N	0	3	326.484	3.453	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)C[C@@H](C)n1ccnc1CC	ZINC001099080124	1363612079	/nfs/dbraw/zinc/61/20/79/1363612079.db2.gz	MOVKKUUWNAPQHU-SJORKVTESA-N	0	3	346.519	3.189	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)Cc1ccc(F)cc1F	ZINC001099085398	1363615292	/nfs/dbraw/zinc/61/52/92/1363615292.db2.gz	OHRFWUCJOSKVET-INIZCTEOSA-N	0	3	336.426	3.300	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@@H]1CCCC12CC2	ZINC001099121709	1363635932	/nfs/dbraw/zinc/63/59/32/1363635932.db2.gz	NMPRVQSARGDVFN-MSOLQXFVSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2coc(-c3ccccc3)n2)C1	ZINC001099125027	1363637664	/nfs/dbraw/zinc/63/76/64/1363637664.db2.gz	OHOWWHNFJQCZGL-JXFKEZNVSA-N	0	3	337.423	3.112	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)[C@]1(C)C[C@H]2C[C@H]2C1	ZINC001099152933	1363658726	/nfs/dbraw/zinc/65/87/26/1363658726.db2.gz	BDBNUUZLYPIHLL-BMQTXXJKSA-N	0	3	348.531	3.232	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cocc1C	ZINC001099166325	1363666269	/nfs/dbraw/zinc/66/62/69/1363666269.db2.gz	UOMGHFVLAVHNOM-INIZCTEOSA-N	0	3	334.460	3.011	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H](C)c2ccc(F)cc2F)C1	ZINC001099169411	1363667814	/nfs/dbraw/zinc/66/78/14/1363667814.db2.gz	SUYKQQOCIKEDRV-NJSLBKSFSA-N	0	3	334.410	3.225	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@H]1CCC(C)(C)CN1CCOCC(C)C	ZINC001099171819	1363670113	/nfs/dbraw/zinc/67/01/13/1363670113.db2.gz	URLUMAWBAVOEDO-QGZVFWFLSA-N	0	3	338.536	3.478	20	30		EGEDHN
C#CCCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc3cc(C)ccc3o2)C1	ZINC001099174341	1363671275	/nfs/dbraw/zinc/67/12/75/1363671275.db2.gz	JEPFLJBZZQZBPI-UWJYYQICSA-N	0	3	336.435	3.349	20	30		EGEDHN
CC#CCCCC(=O)NC[C@H]1CCC(C)(C)CN1CCOCC1CC1	ZINC001099189459	1363681699	/nfs/dbraw/zinc/68/16/99/1363681699.db2.gz	RTPUGPLPBJXRKY-LJQANCHMSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)C[C@H](C=C)CC	ZINC001099194841	1363686620	/nfs/dbraw/zinc/68/66/20/1363686620.db2.gz	SWNCJJQGXLTKEI-QZTJIDSGSA-N	0	3	336.520	3.398	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@H](C)C(C)(F)F	ZINC001099234863	1363705747	/nfs/dbraw/zinc/70/57/47/1363705747.db2.gz	NRRDOCVQVYURSH-GJZGRUSLSA-N	0	3	346.462	3.087	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)C(C)(C)C(=C)Cl)C[C@H]1C(F)(F)F	ZINC001099256715	1363716912	/nfs/dbraw/zinc/71/69/12/1363716912.db2.gz	QMNQEKPOTNDCCS-VXGBXAGGSA-N	0	3	338.801	3.320	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)[C@H](C)Cc1c(C)noc1C	ZINC001099258646	1363719159	/nfs/dbraw/zinc/71/91/59/1363719159.db2.gz	SHSSHWRVHMDYOU-PBHICJAKSA-N	0	3	347.503	3.263	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@@H]2CCCC2(C)C)C[C@H]1C(F)(F)F	ZINC001099292151	1363735177	/nfs/dbraw/zinc/73/51/77/1363735177.db2.gz	IQWGXQAJSWRNBU-BFHYXJOUSA-N	0	3	332.410	3.368	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)Cc2ccsc2C)C[C@H]1C(F)(F)F	ZINC001099317557	1363746083	/nfs/dbraw/zinc/74/60/83/1363746083.db2.gz	HKJJXSXJDJRZCQ-ZIAGYGMSSA-N	0	3	346.418	3.154	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2csc(C(C)C)n2)C[C@H]1C(F)(F)F	ZINC001099322097	1363749884	/nfs/dbraw/zinc/74/98/84/1363749884.db2.gz	RJSPVCKFTYADMS-GHMZBOCLSA-N	0	3	347.406	3.045	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)C[C@@H]1OCc2ccccc21	ZINC001099321525	1363750052	/nfs/dbraw/zinc/75/00/52/1363750052.db2.gz	YETOTNXQZALHHH-HKUYNNGSSA-N	0	3	342.483	3.441	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)Cc1cccc(OCC)c1	ZINC001099353921	1363767905	/nfs/dbraw/zinc/76/79/05/1363767905.db2.gz	IRCIWAVTEYAGMF-SFHVURJKSA-N	0	3	344.499	3.421	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)C2(CCC)CC2)C1	ZINC001099529697	1363834612	/nfs/dbraw/zinc/83/46/12/1363834612.db2.gz	UYYCZLPDKDPJDV-QAETUUGQSA-N	0	3	336.907	3.488	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N[C@@H]1CN(CC(=C)C)CC2(CCOCC2)C1	ZINC001099586711	1363868389	/nfs/dbraw/zinc/86/83/89/1363868389.db2.gz	GCKABQCEPRWXHE-HELGNCAXSA-N	0	3	332.488	3.072	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)C[C@H](C)C(C)(C)C)CC2(CCOCC2)C1	ZINC001099596601	1363879223	/nfs/dbraw/zinc/87/92/23/1363879223.db2.gz	HIFCMLAGJLAYSC-IRXDYDNUSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CCN(Cc2ccc(C(C)(C)C)cc2)C[C@H]1O	ZINC001099728464	1363927633	/nfs/dbraw/zinc/92/76/33/1363927633.db2.gz	XIIRQJOHYCGSRB-RBUKOAKNSA-N	0	3	344.499	3.002	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](CNCc2ocnc2C)[C@H](C)C1	ZINC001185224667	1387656171	/nfs/dbraw/zinc/65/61/71/1387656171.db2.gz	GIDHQAUEQXIGPZ-ZBFHGGJFSA-N	0	3	333.476	3.160	20	30		EGEDHN
O=C(CCC1CC1)NCC1CC(NCC#Cc2ccc(Cl)cc2)C1	ZINC001100199541	1364042951	/nfs/dbraw/zinc/04/29/51/1364042951.db2.gz	OJDDYBKPWGJBFZ-UHFFFAOYSA-N	0	3	344.886	3.366	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](CNCc2cnc(C)o2)[C@@H](C)C1	ZINC001185226506	1387656472	/nfs/dbraw/zinc/65/64/72/1387656472.db2.gz	PPLKTIDOJUUEBO-GOEBONIOSA-N	0	3	333.476	3.160	20	30		EGEDHN
C#CCCCCC(=O)NCC1CC(NCc2cc(C)ccc2F)C1	ZINC001100259888	1364060781	/nfs/dbraw/zinc/06/07/81/1364060781.db2.gz	XPYMWXAMGXJKNN-UHFFFAOYSA-N	0	3	330.447	3.312	20	30		EGEDHN
C#CCCCC(=O)NCC1CC(N[C@H](C)c2cc(F)ccc2F)C1	ZINC001100285512	1364067835	/nfs/dbraw/zinc/06/78/35/1364067835.db2.gz	KRUJKROYNYRYLB-VQCLRJIVSA-N	0	3	334.410	3.314	20	30		EGEDHN
O=C(NCC1CC(NCC#Cc2ccccc2)C1)c1sccc1F	ZINC001100297618	1364071917	/nfs/dbraw/zinc/07/19/17/1364071917.db2.gz	ASGXOKDAWKHGJE-UHFFFAOYSA-N	0	3	342.439	3.037	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCC1CC(NCc2cccc(Cl)n2)C1	ZINC001100364449	1364092368	/nfs/dbraw/zinc/09/23/68/1364092368.db2.gz	FMPRHGNEYXBPDE-UHFFFAOYSA-N	0	3	335.879	3.322	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCC1CC(NCc2cc(F)ccc2OC)C1	ZINC001100367422	1364094323	/nfs/dbraw/zinc/09/43/23/1364094323.db2.gz	GPLLMAJIUCLMPR-UHFFFAOYSA-N	0	3	348.462	3.421	20	30		EGEDHN
O=C(C[C@H]1C=CCCC1)NCC1CC(NCC#Cc2ccccc2)C1	ZINC001100440432	1364115261	/nfs/dbraw/zinc/11/52/61/1364115261.db2.gz	VTMFGEIIEBGNDN-MWXLCCTBSA-N	0	3	336.479	3.269	20	30		EGEDHN
C[C@@H](C(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1)C(C)(C)C	ZINC001100447939	1364118207	/nfs/dbraw/zinc/11/82/07/1364118207.db2.gz	BMJSEHIFNKPROK-KTAKPFMOSA-N	0	3	345.462	3.364	20	30		EGEDHN
C=CCCC1(C(=O)NCC2CC(NCc3oc(CC)nc3C)C2)CC1	ZINC001100642536	1364201009	/nfs/dbraw/zinc/20/10/09/1364201009.db2.gz	BJIDDYKJIGODDK-UHFFFAOYSA-N	0	3	345.487	3.276	20	30		EGEDHN
C=CCCC1(C(=O)NCC2CC(NCc3ccncc3Cl)C2)CC1	ZINC001100642828	1364201295	/nfs/dbraw/zinc/20/12/95/1364201295.db2.gz	PQNYVJVWKOZWSW-UHFFFAOYSA-N	0	3	347.890	3.466	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)Cc2c[nH]c3cc(C)ccc23)C1	ZINC001100752637	1364246799	/nfs/dbraw/zinc/24/67/99/1364246799.db2.gz	JSFMOXZTCOFOIP-UHFFFAOYSA-N	0	3	345.874	3.256	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C(C)(C)Cc2ccccc2)C1	ZINC001100833813	1364283254	/nfs/dbraw/zinc/28/32/54/1364283254.db2.gz	GFGYCSFAQVAQAL-UHFFFAOYSA-N	0	3	334.891	3.492	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@H](CC)CC(F)(F)F)C1	ZINC001100877666	1364307542	/nfs/dbraw/zinc/30/75/42/1364307542.db2.gz	KSUNMLQYOXMOEE-MOENNCHZSA-N	0	3	326.790	3.202	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)Cc2ccc3c(c2)CCCC3)C1	ZINC001100968459	1364351677	/nfs/dbraw/zinc/35/16/77/1364351677.db2.gz	AHUUSTVLZXQTSY-UHFFFAOYSA-N	0	3	346.902	3.345	20	30		EGEDHN
C=CCN1CC[C@@H](Oc2ccnc(CNC(=O)CC(C)=C(C)C)c2)C1	ZINC001101095956	1364411700	/nfs/dbraw/zinc/41/17/00/1364411700.db2.gz	UWDQAFHGILFBRO-LJQANCHMSA-N	0	3	343.471	3.083	20	30		EGEDHN
C=CCN1CC[C@@H](Oc2ccnc(CNC(=O)CC(CC)CC)c2)C1	ZINC001101096926	1364412272	/nfs/dbraw/zinc/41/22/72/1364412272.db2.gz	FSKJKTUKYVADBC-LJQANCHMSA-N	0	3	345.487	3.163	20	30		EGEDHN
C#CCCCC(=O)N1C[C@H]2CN([C@@H](C)c3ccccc3F)C[C@@]2(C)C1	ZINC001101213200	1364465071	/nfs/dbraw/zinc/46/50/71/1364465071.db2.gz	YDJPHIOLFYTJLD-FVJLSDCUSA-N	0	3	342.458	3.471	20	30		EGEDHN
CC[C@H](C)CC(=O)N1C[C@H]2CN(Cc3cccc(C#N)c3)C[C@@]2(C)C1	ZINC001101215034	1364466761	/nfs/dbraw/zinc/46/67/61/1364466761.db2.gz	GLIPKFLWWJIRLS-SCWSEQNSSA-N	0	3	339.483	3.275	20	30		EGEDHN
CCCCC[C@H](C)CC(=O)N1C[C@H]2CN(CC#CCOC)C[C@@]2(C)C1	ZINC001101384594	1364539675	/nfs/dbraw/zinc/53/96/75/1364539675.db2.gz	KTVFYWCNDZIJKW-ZVDOUQERSA-N	0	3	348.531	3.023	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1CC2(CN(CC3CCCC3)C2)n2ccnc21	ZINC001101640397	1364666442	/nfs/dbraw/zinc/66/64/42/1364666442.db2.gz	AATWAFFHBUBNHL-KRWDZBQOSA-N	0	3	342.487	3.002	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CC2(CN([C@@H](C)CCC=C)C2)n2ccnc21	ZINC001101641050	1364666451	/nfs/dbraw/zinc/66/64/51/1364666451.db2.gz	IINUMTNAGZRRAB-DLBZAZTESA-N	0	3	342.487	3.166	20	30		EGEDHN
CC/C=C(\C)C(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001101777962	1364723241	/nfs/dbraw/zinc/72/32/41/1364723241.db2.gz	VMGVIYCQIAWXEL-HMBIXPHWSA-N	0	3	331.485	3.160	20	30		EGEDHN
CCC[C@H](C)C(=O)NC[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1C	ZINC001101828564	1364741873	/nfs/dbraw/zinc/74/18/73/1364741873.db2.gz	CCZKXANURCYDIG-HDMKZQKVSA-N	0	3	345.462	3.318	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H]1CN(Cc2c(C)nsc2C)C[C@H]1C	ZINC001101893797	1364766027	/nfs/dbraw/zinc/76/60/27/1364766027.db2.gz	RYVKGYGZISWGGD-RHSMWYFYSA-N	0	3	347.528	3.138	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@@H]1CN(Cc2cccc(C(F)F)c2)C[C@H]1C	ZINC001101948156	1364786349	/nfs/dbraw/zinc/78/63/49/1364786349.db2.gz	ZPGZTXOWNMRWLK-CRAIPNDOSA-N	0	3	348.437	3.468	20	30		EGEDHN
COCC#CCN1C[C@@H](CNC(=O)CCC2CCCCCC2)[C@H](C)C1	ZINC001102161691	1364902295	/nfs/dbraw/zinc/90/22/95/1364902295.db2.gz	VWVUNLRKDAXTEN-UYAOXDASSA-N	0	3	348.531	3.071	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](NCc3ccc(Cl)nc3)C2)CC1	ZINC001185439845	1387717438	/nfs/dbraw/zinc/71/74/38/1387717438.db2.gz	ZQDCYVPJXGWRNL-OAHLLOKOSA-N	0	3	333.863	3.172	20	30		EGEDHN
Cc1cnc([C@H](C)N2C[C@@H](C)[C@H](CCNC(=O)C#CC(C)(C)C)C2)o1	ZINC001102964635	1365319281	/nfs/dbraw/zinc/31/92/81/1365319281.db2.gz	PUYAICBORUPLOL-HYVNUMGLSA-N	0	3	345.487	3.168	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCC[C@@H]1CN(Cc2cncs2)C[C@H]1C	ZINC001103022079	1365341679	/nfs/dbraw/zinc/34/16/79/1365341679.db2.gz	XKVNHRTYGNTDBS-NVXWUHKLSA-N	0	3	347.528	3.486	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)Cc2ccc(C)cc2)C1	ZINC001103201849	1365432986	/nfs/dbraw/zinc/43/29/86/1365432986.db2.gz	PEMWGWLLVQHEDZ-CRAIPNDOSA-N	0	3	334.891	3.364	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCC[C@@H]1CN(Cc2ccns2)C[C@H]1C	ZINC001103346763	1365510798	/nfs/dbraw/zinc/51/07/98/1365510798.db2.gz	REKJSJROPOVJTB-OWCLPIDISA-N	0	3	335.517	3.320	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCC[C@@H]1CN(Cc2cncc(F)c2)C[C@H]1C	ZINC001103345038	1365510998	/nfs/dbraw/zinc/51/09/98/1365510998.db2.gz	YNBQUSBQNGWCSO-JFIYKMOQSA-N	0	3	347.478	3.397	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC[C@@H]1CN(Cc2cncc(F)c2)C[C@H]1C	ZINC001103401461	1365537554	/nfs/dbraw/zinc/53/75/54/1365537554.db2.gz	CCMJWTUNEZZNLW-WRWLIDTKSA-N	0	3	347.478	3.397	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC[C@@H]1CN(Cc2ccc(F)cn2)C[C@H]1C	ZINC001103402006	1365538066	/nfs/dbraw/zinc/53/80/66/1365538066.db2.gz	XEOYXCUKDSAGLK-JXXFODFXSA-N	0	3	347.478	3.397	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)C[C@@H](C)c2cccnc2)C1	ZINC001103494073	1365596009	/nfs/dbraw/zinc/59/60/09/1365596009.db2.gz	JNPXEGKVVCFSRH-IIDMSEBBSA-N	0	3	349.906	3.402	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)[C@H](C)OCCCC)C[C@H]1C	ZINC001103964542	1365851157	/nfs/dbraw/zinc/85/11/57/1365851157.db2.gz	UDEMJJVMFZUPKX-VNQPRFMTSA-N	0	3	330.900	3.018	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CN(C(=O)C(F)=C(C)C)C[C@H]1C	ZINC001104065267	1365896842	/nfs/dbraw/zinc/89/68/42/1365896842.db2.gz	KTTYLCMQXHEMDV-DGCLKSJQSA-N	0	3	347.272	3.233	20	30		EGEDHN
Cc1csc(CNCC[C@@H]2CN(C(=O)C#CC(C)(C)C)C[C@H]2C)n1	ZINC001104175170	1365937497	/nfs/dbraw/zinc/93/74/97/1365937497.db2.gz	VVIKYTCMDULUNK-GDBMZVCRSA-N	0	3	347.528	3.075	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](C)[C@H](CCNCc2nccn2CC)C1	ZINC001104238939	1365965367	/nfs/dbraw/zinc/96/53/67/1365965367.db2.gz	UMFKKRVPGJGPSJ-IAGOWNOFSA-N	0	3	346.519	3.080	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](C)[C@H](CCNCc2cnoc2C)C1	ZINC001104239622	1365965903	/nfs/dbraw/zinc/96/59/03/1365965903.db2.gz	HRFQLMWTMBYPPS-GDBMZVCRSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2ccc3cc[nH]c3n2)C[C@H]1C	ZINC001104322458	1365980130	/nfs/dbraw/zinc/98/01/30/1365980130.db2.gz	LEPSDJYPWMSJSA-IUODEOHRSA-N	0	3	346.862	3.003	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)[C@H](CCNCc2c(C)noc2CC)C1	ZINC001104493906	1366047611	/nfs/dbraw/zinc/04/76/11/1366047611.db2.gz	RTENYRQWAZKNPI-GDBMZVCRSA-N	0	3	347.503	3.332	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@@H](C)[C@H](CCNCc2cnc(C)o2)C1	ZINC001104564494	1366078654	/nfs/dbraw/zinc/07/86/54/1366078654.db2.gz	MNZDENNNLDKKMB-HYVNUMGLSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)c2nccc3[nH]ccc32)C[C@H]1C	ZINC001104694401	1366134230	/nfs/dbraw/zinc/13/42/30/1366134230.db2.gz	PSWPFGHTGCYYJY-TZMCWYRMSA-N	0	3	346.862	3.003	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)C[C@H](C)c2cccnc2)C[C@H]1C	ZINC001104752331	1366157007	/nfs/dbraw/zinc/15/70/07/1366157007.db2.gz	CGSZRQIGYDVSCA-HDMKZQKVSA-N	0	3	349.906	3.402	20	30		EGEDHN
CCCCCCCNCc1cn(C2CN(C(=O)C(CC)CC)C2)nn1	ZINC001105166229	1366352787	/nfs/dbraw/zinc/35/27/87/1366352787.db2.gz	XSSHOFTVIFBZJJ-UHFFFAOYSA-N	0	3	349.523	3.158	20	30		EGEDHN
CC[C@H](F)CN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C#CC(C)C)CC1	ZINC001105392054	1366440911	/nfs/dbraw/zinc/44/09/11/1366440911.db2.gz	RJYDARZPOFBPSN-ICSRJNTNSA-N	0	3	348.506	3.487	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)[C@H](C)CC(=C)C)CC1	ZINC001105394038	1366442852	/nfs/dbraw/zinc/44/28/52/1366442852.db2.gz	NFUWPIINAIFISH-IEBWSBKVSA-N	0	3	328.500	3.315	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(c2ccccc2)C[C@H](NC(=O)[C@H]2C[C@H]2C)C1	ZINC001105403002	1366449611	/nfs/dbraw/zinc/44/96/11/1366449611.db2.gz	JWPAQIJDECOPLP-WKCGWZECSA-N	0	3	332.875	3.201	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(c2ccccc2)C[C@H](NC(=O)C2(C)CC2)C1	ZINC001105425520	1366460795	/nfs/dbraw/zinc/46/07/95/1366460795.db2.gz	KWUMRPUQSRBOJA-UWUNEBHHSA-N	0	3	332.875	3.345	20	30		EGEDHN
CC#CC[NH2+]CC1([C@@H]2CCCCN2C(=O)c2ccccc2[O-])CCC1	ZINC001105509347	1366500400	/nfs/dbraw/zinc/50/04/00/1366500400.db2.gz	XLWSXQPAZSZROU-IBGZPJMESA-N	0	3	340.467	3.170	20	30		EGEDHN
CC(C)[C@H](C)CC(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001105930245	1366599866	/nfs/dbraw/zinc/59/98/66/1366599866.db2.gz	PCOIVDWJTDVZQC-MBOZVWFJSA-N	0	3	341.499	3.425	20	30		EGEDHN
CC[C@@H](C)CC(=O)N1C[C@@H](CNCc2cc(F)ccc2C#N)[C@H](C)C1	ZINC001106061526	1366608538	/nfs/dbraw/zinc/60/85/38/1366608538.db2.gz	GWLUCQOJGOVATH-IIDMSEBBSA-N	0	3	345.462	3.318	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](CNCc2ccn(C(C)C)n2)[C@H](C)C1	ZINC001106563659	1366737100	/nfs/dbraw/zinc/73/71/00/1366737100.db2.gz	HPMDIGKZHRWODQ-RCCFBDPRSA-N	0	3	346.519	3.250	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@@H](CNCc2ncc(C)s2)[C@H](C)C1	ZINC001106567733	1366739782	/nfs/dbraw/zinc/73/97/82/1366739782.db2.gz	RBRQTZHSTQINMZ-FVQBIDKESA-N	0	3	335.517	3.238	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](CNCc2nc(C)sc2C)[C@H](C)C1	ZINC001106609933	1366754450	/nfs/dbraw/zinc/75/44/50/1366754450.db2.gz	VGUNQSXSQDQNEX-CZUORRHYSA-N	0	3	335.517	3.300	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](CNCc3cc(C)no3)[C@H](C)C2)CCCC1	ZINC001107099129	1366874304	/nfs/dbraw/zinc/87/43/04/1366874304.db2.gz	WVXNOEIRABNAKA-NVXWUHKLSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCCC(=O)NC[C@]12CCC[C@H]1N(Cc1c(C)noc1CC)CC2	ZINC001107326854	1366929154	/nfs/dbraw/zinc/92/91/54/1366929154.db2.gz	KLJMWWMDXNIFMO-UYAOXDASSA-N	0	3	345.487	3.372	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)[C@@H](CC)CC3CCCC3)[C@@H]2C1	ZINC001189302554	1366982182	/nfs/dbraw/zinc/98/21/82/1366982182.db2.gz	FOPXGAWNFXTXRS-SLFFLAALSA-N	0	3	348.531	3.328	20	30		EGEDHN
CC#CCCCC(=O)NC[C@]12CCC[C@H]1N(Cc1ccccn1)CC2	ZINC001107512731	1367011921	/nfs/dbraw/zinc/01/19/21/1367011921.db2.gz	GIMKMYVSYFJEGP-TZIWHRDSSA-N	0	3	339.483	3.136	20	30		EGEDHN
C=CCOCCCC(=O)N1CC[C@H](N(C)Cc2ccc(CF)cc2)C1	ZINC001189564380	1367055449	/nfs/dbraw/zinc/05/54/49/1367055449.db2.gz	BPOHGWVYXCYERC-IBGZPJMESA-N	0	3	348.462	3.172	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2C[C@@H](OC)c1ccccc1	ZINC001109353166	1367083801	/nfs/dbraw/zinc/08/38/01/1367083801.db2.gz	LIKQJFGAUUIDCN-FUMNGEBKSA-N	0	3	342.483	3.452	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](N(C)CCOc2ccccc2Cl)C1	ZINC001189926826	1367134025	/nfs/dbraw/zinc/13/40/25/1367134025.db2.gz	SUGGIQPCUCXKKT-INIZCTEOSA-N	0	3	348.874	3.055	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@@H](N(C)Cc2cccc(C(F)F)c2)C1	ZINC001190053059	1367161486	/nfs/dbraw/zinc/16/14/86/1367161486.db2.gz	DCJVCVIYEFWJOJ-QGZVFWFLSA-N	0	3	334.410	3.316	20	30		EGEDHN
CN(Cc1ccc(Cl)cc1)[C@@H]1CCN(C(=O)C#CC(C)(C)C)C1	ZINC001190076232	1367167551	/nfs/dbraw/zinc/16/75/51/1367167551.db2.gz	MUIMNCQEBVQZSB-QGZVFWFLSA-N	0	3	332.875	3.422	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CC1CC(F)(F)C1	ZINC001109597686	1367221669	/nfs/dbraw/zinc/22/16/69/1367221669.db2.gz	UOHMSXYVEHCKAZ-ILXRZTDVSA-N	0	3	326.431	3.356	20	30		EGEDHN
CCOC(=O)C(C#N)NC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC001190426820	1367261383	/nfs/dbraw/zinc/26/13/83/1367261383.db2.gz	IFAFXKKOSYEEKP-MRXNPFEDSA-N	0	3	339.351	3.056	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2ccc(C)c(F)c2)C1	ZINC001108058290	1367261340	/nfs/dbraw/zinc/26/13/40/1367261340.db2.gz	XVLOFXVJQPVQSE-OXJNMPFZSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](N(C)C[C@@H](O)c2ccc(CC)cc2)C1	ZINC001190429286	1367262525	/nfs/dbraw/zinc/26/25/25/1367262525.db2.gz	ZUKDMDLWIQAADF-VQTJNVASSA-N	0	3	344.499	3.171	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](N(C)Cc2ccc3c(c2)COC3)C1	ZINC001190428103	1367263140	/nfs/dbraw/zinc/26/31/40/1367263140.db2.gz	BWEMEXZYQSLASC-IBGZPJMESA-N	0	3	328.456	3.106	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2ccc(C3CCC3)cc2)C1	ZINC001190527799	1367285838	/nfs/dbraw/zinc/28/58/38/1367285838.db2.gz	JTFSEDKBTXUPQJ-HXUWFJFHSA-N	0	3	342.483	3.303	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@@H](N(C)Cc3cc(F)ccc3C)C2)CCC1	ZINC001190593749	1367300625	/nfs/dbraw/zinc/30/06/25/1367300625.db2.gz	DDOSACPAWYGIGH-LJQANCHMSA-N	0	3	342.458	3.360	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@]1(C)CN(CC2CCC(C)CC2)CCO1	ZINC001108143913	1367306421	/nfs/dbraw/zinc/30/64/21/1367306421.db2.gz	HMCWDAYAPKFGKU-GRERDSQWSA-N	0	3	348.531	3.213	20	30		EGEDHN
CC[C@H](CC(F)F)C(=O)N1CC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001190614399	1367308715	/nfs/dbraw/zinc/30/87/15/1367308715.db2.gz	YHCZUIVNNQNJIH-SJORKVTESA-N	0	3	349.425	3.272	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@@]1(C)CN(CC2CC(C)(C)C2)CCO1	ZINC001108151885	1367312862	/nfs/dbraw/zinc/31/28/62/1367312862.db2.gz	VWLGBTCEPRLTDZ-JXFKEZNVSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2ccc(F)c(C)c2)C1	ZINC001108172533	1367322812	/nfs/dbraw/zinc/32/28/12/1367322812.db2.gz	FAFYAOZBTIINBT-OXQOHEQNSA-N	0	3	348.462	3.310	20	30		EGEDHN
C[C@@H](CC(C)(C)C)C(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001186111104	1387873081	/nfs/dbraw/zinc/87/30/81/1387873081.db2.gz	PEIPZCXIIYMAIJ-WMLDXEAASA-N	0	3	345.462	3.460	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2cccn2C(C)C)C1	ZINC001108400562	1367434421	/nfs/dbraw/zinc/43/44/21/1367434421.db2.gz	JHCRQPGFDDLMSR-YLJYHZDGSA-N	0	3	347.503	3.244	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2ccc(CCCC)cc2)C1	ZINC001191226640	1367451948	/nfs/dbraw/zinc/45/19/48/1367451948.db2.gz	KXUCNDDLXOOVMY-FQEVSTJZSA-N	0	3	344.499	3.378	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCc1cc(F)ccc1F)C2	ZINC001110154940	1367528977	/nfs/dbraw/zinc/52/89/77/1367528977.db2.gz	PMIZQZXZHCJKNH-NJAFHUGGSA-N	0	3	334.410	3.195	20	30		EGEDHN
C#CCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3CCOC(C)C)CCCCC1	ZINC001110178080	1367548424	/nfs/dbraw/zinc/54/84/24/1367548424.db2.gz	RJAOZABXCDRFMX-QYZOEREBSA-N	0	3	346.515	3.107	20	30		EGEDHN
C=CCC[C@H](C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCOC)c1ccccc1	ZINC001110212892	1367566226	/nfs/dbraw/zinc/56/62/26/1367566226.db2.gz	TVVVZAVLHQVCFK-FYQPLNBISA-N	0	3	342.483	3.104	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](N(C)Cc2cccc(OC)c2)C1	ZINC001191754794	1367578584	/nfs/dbraw/zinc/57/85/84/1367578584.db2.gz	TWOGQOMLUITMII-IBGZPJMESA-N	0	3	342.483	3.312	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](N(C)Cc2cccc(COC)c2)C1	ZINC001191838280	1367608746	/nfs/dbraw/zinc/60/87/46/1367608746.db2.gz	ICJACPGFFFPQPM-HXUWFJFHSA-N	0	3	342.483	3.059	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)C[C@@H]1CCc2cc(F)ccc2C1	ZINC001186165978	1387887494	/nfs/dbraw/zinc/88/74/94/1387887494.db2.gz	QWLWWMRADGPYCY-BEFAXECRSA-N	0	3	330.447	3.087	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@H](N(C)Cc2cccc(OC)c2)C1	ZINC001191867719	1367620866	/nfs/dbraw/zinc/62/08/66/1367620866.db2.gz	HFCRNEJHAWTLQA-WMZOPIPTSA-N	0	3	330.472	3.330	20	30		EGEDHN
CC[C@@H](c1ccccc1)N1[C@@H]2CC[C@H]1[C@H](NC(=O)CSCC#N)C2	ZINC001110301389	1367623136	/nfs/dbraw/zinc/62/31/36/1367623136.db2.gz	DBPQFIRNMBMQRM-BDXSIMOUSA-N	0	3	343.496	3.116	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@H](N(C)CCOCc2ccccc2)C1	ZINC001192162491	1367705424	/nfs/dbraw/zinc/70/54/24/1367705424.db2.gz	PDMFNXROYYDUJJ-CTNGQTDRSA-N	0	3	344.499	3.338	20	30		EGEDHN
C=CCCCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1oc(C)nc1C)C2	ZINC001110417168	1367706516	/nfs/dbraw/zinc/70/65/16/1367706516.db2.gz	MNUDAFLKWXPHMH-ZACQAIPSSA-N	0	3	331.460	3.373	20	30		EGEDHN
C=CCCCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1oc(C)nc1C)C2	ZINC001109110366	1367776631	/nfs/dbraw/zinc/77/66/31/1367776631.db2.gz	MNUDAFLKWXPHMH-IKGGRYGDSA-N	0	3	331.460	3.373	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@H](C)Cc1cccc(F)c1)C2	ZINC001110564771	1367836237	/nfs/dbraw/zinc/83/62/37/1367836237.db2.gz	SCLHAIJRGJNKKH-XLNTUCKNSA-N	0	3	342.458	3.139	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCc1ccc(OC)cc1	ZINC001110605749	1367868294	/nfs/dbraw/zinc/86/82/94/1367868294.db2.gz	FXEMKSGKGRBUIG-RLLQIKCJSA-N	0	3	342.483	3.316	20	30		EGEDHN
C=CC1(CC(=O)N2CC[C@H](N(C)CCOC(C)C)C2)CCCCC1	ZINC001192827865	1367884131	/nfs/dbraw/zinc/88/41/31/1367884131.db2.gz	YSWWWKQLHAOVKZ-SFHVURJKSA-N	0	3	336.520	3.471	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3Cc2ccc(C)cc2)CCC1	ZINC001110651084	1367894562	/nfs/dbraw/zinc/89/45/62/1367894562.db2.gz	MOQFNWSGNRYYFQ-AQNXPRMDSA-N	0	3	336.479	3.410	20	30		EGEDHN
CC[C@@H](C)CCC(=O)N1CC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001193018120	1367924696	/nfs/dbraw/zinc/92/46/96/1367924696.db2.gz	RFWGZRPDIAJLHK-APWZRJJASA-N	0	3	327.472	3.417	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1c(C)noc1C(F)F)C2	ZINC001110704502	1367939229	/nfs/dbraw/zinc/93/92/29/1367939229.db2.gz	VBGFGRQCMNWMMV-UPJWGTAASA-N	0	3	339.386	3.222	20	30		EGEDHN
CC(C)C[C@@H](C)C(=O)N1CC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001193099185	1367943502	/nfs/dbraw/zinc/94/35/02/1367943502.db2.gz	KJWSJVZYXACPPK-VQIMIIECSA-N	0	3	327.472	3.273	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2C[C@@H]1CC(C)(C)CO1	ZINC001110900464	1368074719	/nfs/dbraw/zinc/07/47/19/1368074719.db2.gz	AZZGSJVSSSKPNG-HCXYKTFWSA-N	0	3	346.515	3.107	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccccc1N(C)C	ZINC001110964235	1368127118	/nfs/dbraw/zinc/12/71/18/1368127118.db2.gz	ALXRAWAJQZFFHD-GGPKGHCWSA-N	0	3	341.499	3.330	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@@H](C)CC(C)(C)C)C2	ZINC001111061912	1368150902	/nfs/dbraw/zinc/15/09/02/1368150902.db2.gz	PQYSXUOCXSJXJD-TVFCKZIOSA-N	0	3	336.520	3.373	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](N(C)CCOCC3CC3)C2)CCCCC1	ZINC001194201468	1368207723	/nfs/dbraw/zinc/20/77/23/1368207723.db2.gz	UHYZASPVNAEWLY-IBGZPJMESA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCOc1ccccc1CC)C2	ZINC001111263560	1368229992	/nfs/dbraw/zinc/22/99/92/1368229992.db2.gz	XTTHVWKJQTWMNI-QRVBRYPASA-N	0	3	342.483	3.316	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3CC/C=C/CCC)nc1	ZINC001111292279	1368255049	/nfs/dbraw/zinc/25/50/49/1368255049.db2.gz	AYZZSOCOSIGUAW-OSECFARBSA-N	0	3	337.467	3.144	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](N(C)CCOCC(C)C)C2)CCCC1	ZINC001194554531	1368284605	/nfs/dbraw/zinc/28/46/05/1368284605.db2.gz	BCGMKDXFKAOIEX-SFHVURJKSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)C/C=C\c2ccc(C)cc2)C1	ZINC001194590039	1368292655	/nfs/dbraw/zinc/29/26/55/1368292655.db2.gz	CZPNXTKVPHWIKJ-PRPIBZDOSA-N	0	3	342.483	3.134	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCCc1ccc(C)s1)C2	ZINC001111525321	1368326491	/nfs/dbraw/zinc/32/64/91/1368326491.db2.gz	VMAQZESKGIHZSJ-NXHRZFHOSA-N	0	3	330.497	3.124	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)C[C@@H](NC(=O)CCCF)c1ccccc1O2	ZINC001111531644	1368330599	/nfs/dbraw/zinc/33/05/99/1368330599.db2.gz	GHOJZCNGKADYER-XLIONFOSSA-N	0	3	346.446	3.397	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H](CCC)C(C)C)C[C@@H](C)O2	ZINC001111551169	1368342846	/nfs/dbraw/zinc/34/28/46/1368342846.db2.gz	SSCGNIYLSDFZJQ-MSOLQXFVSA-N	0	3	336.520	3.327	20	30		EGEDHN
CCC(CC)C(=O)N[C@]12CCC[C@H]1CN(Cc1cccc(C#N)c1)C2	ZINC001111604358	1368367135	/nfs/dbraw/zinc/36/71/35/1368367135.db2.gz	PNRCXYDCOFEBND-FPOVZHCZSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H](C)OC2CCCCCC2)C1	ZINC001111867301	1368515499	/nfs/dbraw/zinc/51/54/99/1368515499.db2.gz	FMLPYJVFZCLRRK-ZWOKBUDYSA-N	0	3	334.504	3.271	20	30		EGEDHN
C=C(C)CCC(=O)N1CCCN(C[C@H](O)[C@@H](C)c2ccccc2)CC1	ZINC001196018482	1368536535	/nfs/dbraw/zinc/53/65/35/1368536535.db2.gz	WEESOXPURNUDQN-ICSRJNTNSA-N	0	3	344.499	3.042	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)[C@](C)(OC)c2ccccc2F)CC1	ZINC001196092878	1368548175	/nfs/dbraw/zinc/54/81/75/1368548175.db2.gz	NNTWYUZYLPNNNN-HXUWFJFHSA-N	0	3	348.462	3.188	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2occ3c2CCOC3)CC1	ZINC001196647782	1368655225	/nfs/dbraw/zinc/65/52/25/1368655225.db2.gz	BBMWTAGTPQVWKL-UHFFFAOYSA-N	0	3	348.487	3.471	20	30		EGEDHN
C=C(C)CN1CCCN(C(=O)CCCOc2ccccc2C)CC1	ZINC001196711101	1368668474	/nfs/dbraw/zinc/66/84/74/1368668474.db2.gz	QNLLKHCPQIAIJY-UHFFFAOYSA-N	0	3	330.472	3.264	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)C(CCC)CCC)C[C@H]1C(F)(F)F	ZINC001112155863	1368687400	/nfs/dbraw/zinc/68/74/00/1368687400.db2.gz	NWIKDUZVLFOFRT-HUUCEWRRSA-N	0	3	332.410	3.205	20	30		EGEDHN
CC(C)CCC(=O)N1CC[C@@H]([C@H](C)NCc2ccccc2C#N)C1	ZINC001325381659	1387956865	/nfs/dbraw/zinc/95/68/65/1387956865.db2.gz	VTMKRUKWFMMFQA-QFBILLFUSA-N	0	3	327.472	3.321	20	30		EGEDHN
C=CCC1(C(=O)N2CCCN(C[C@@H](OCC)C3CC3)CC2)CCC1	ZINC001197077761	1368742222	/nfs/dbraw/zinc/74/22/22/1368742222.db2.gz	XHHUSDVQZCFZEW-GOSISDBHSA-N	0	3	334.504	3.082	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@](C)(CC)CCC)C1	ZINC001197215328	1368764730	/nfs/dbraw/zinc/76/47/30/1368764730.db2.gz	PVUWIZNYHQGPOA-ZHALLVOQSA-N	0	3	326.525	3.335	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2cccc(C(F)(F)F)n2)CC1	ZINC001197527811	1368832898	/nfs/dbraw/zinc/83/28/98/1368832898.db2.gz	IJPVGCPQOUXQFO-UHFFFAOYSA-N	0	3	341.377	3.215	20	30		EGEDHN
CC[C@@H](C)CCC(=O)N1CC[C@@H](NCc2ccc(OC)c(C#N)c2)C1	ZINC001186537394	1387965984	/nfs/dbraw/zinc/96/59/84/1387965984.db2.gz	OEKMAFYQZQOYJI-CRAIPNDOSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=CCCCN1C[C@@H](O)[C@H](NC(=O)c2cccc(C3CCCC3)c2)C1	ZINC001197775432	1368894239	/nfs/dbraw/zinc/89/42/39/1368894239.db2.gz	JKCSMXFXAUIXJL-WOJBJXKFSA-N	0	3	342.483	3.085	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cn(C)nc2Cl)CC1	ZINC001197787235	1368896118	/nfs/dbraw/zinc/89/61/18/1368896118.db2.gz	QEJQYNGOHTXYFY-UHFFFAOYSA-N	0	3	340.899	3.192	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2nccs2)C1	ZINC001112514959	1368908870	/nfs/dbraw/zinc/90/88/70/1368908870.db2.gz	PQCXYASTDZJFLM-BXWFABGCSA-N	0	3	347.528	3.464	20	30		EGEDHN
CCCCCCCCCCC(=O)N[C@@H]1CN(CC[C@H](C)F)C[C@H]1O	ZINC001198068544	1368954095	/nfs/dbraw/zinc/95/40/95/1368954095.db2.gz	HFEMOBSMMZUFGZ-RCCFBDPRSA-N	0	3	344.515	3.427	20	30		EGEDHN
C=CC[C@@H](C(=O)N1CCCN(CCCCOC)CC1)c1ccccc1	ZINC001198197002	1368979162	/nfs/dbraw/zinc/97/91/62/1368979162.db2.gz	KGLGBJYGEVSOPH-HXUWFJFHSA-N	0	3	344.499	3.307	20	30		EGEDHN
C=CCC1(C(=O)N2CCCN(CCC[C@H](C)O)CC2)CCCCC1	ZINC001198222350	1368983491	/nfs/dbraw/zinc/98/34/91/1368983491.db2.gz	YTUMKUGTQVAMJR-SFHVURJKSA-N	0	3	336.520	3.208	20	30		EGEDHN
C=CCC1(C(=O)N2CCCN(CCC[C@@H](C)O)CC2)CCCCC1	ZINC001198222349	1368983747	/nfs/dbraw/zinc/98/37/47/1368983747.db2.gz	YTUMKUGTQVAMJR-GOSISDBHSA-N	0	3	336.520	3.208	20	30		EGEDHN
C=CCCOCC(=O)N1CCCN([C@@H](C)c2cccc(C)c2)CC1	ZINC001198337334	1369011096	/nfs/dbraw/zinc/01/10/96/1369011096.db2.gz	NFKVHNAETLUQOU-SFHVURJKSA-N	0	3	330.472	3.183	20	30		EGEDHN
C=CCO[C@H](C)C(=O)N1CCCN([C@@H](C)c2cccc(C)c2)CC1	ZINC001198343973	1369012633	/nfs/dbraw/zinc/01/26/33/1369012633.db2.gz	POYAOHFFKLLUKK-ZWKOTPCHSA-N	0	3	330.472	3.181	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N1CCCN([C@@H](C)c2cc(C)ccc2C)CC1	ZINC001198344202	1369012836	/nfs/dbraw/zinc/01/28/36/1369012836.db2.gz	RDFJUVBVETZANR-OALUTQOASA-N	0	3	344.499	3.490	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)c1ccco1)c1ccccc1OC	ZINC001198498687	1369045770	/nfs/dbraw/zinc/04/57/70/1369045770.db2.gz	AGRQEQSLPZWCOE-INIZCTEOSA-N	0	3	328.412	3.315	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)CCCC(C)=O)c1ccccc1OC	ZINC001198529582	1369054728	/nfs/dbraw/zinc/05/47/28/1369054728.db2.gz	ISSBHZZDZNRBSF-GOSISDBHSA-N	0	3	346.471	3.168	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)CCCC(C)=O)c1ccccc1OC	ZINC001198529583	1369054760	/nfs/dbraw/zinc/05/47/60/1369054760.db2.gz	ISSBHZZDZNRBSF-SFHVURJKSA-N	0	3	346.471	3.168	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)CCCOCC=C)c1ccccc1OC	ZINC001198635880	1369078610	/nfs/dbraw/zinc/07/86/10/1369078610.db2.gz	IEQQYWJKZBDCIJ-SFHVURJKSA-N	0	3	346.471	3.001	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)/C=C/C1CC1)c1ccccc1OC	ZINC001198637669	1369079191	/nfs/dbraw/zinc/07/91/91/1369079191.db2.gz	SHAOIVZROYARAL-QFQMRYFISA-N	0	3	328.456	3.375	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)CC[C@@H](C)OC)c1ccccc1OC	ZINC001198676786	1369088834	/nfs/dbraw/zinc/08/88/34/1369088834.db2.gz	CYYSBEUEGYTVOO-AEFFLSMTSA-N	0	3	348.487	3.223	20	30		EGEDHN
C#CCCCCC(=O)NC[C@H](NCCC=C)c1ccccc1OC	ZINC001198678145	1369089310	/nfs/dbraw/zinc/08/93/10/1369089310.db2.gz	YMXCXHNGAWVNLY-SFHVURJKSA-N	0	3	328.456	3.212	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NC[C@@H](NCCC)c1ccccc1OC)OCC	ZINC001198752172	1369105243	/nfs/dbraw/zinc/10/52/43/1369105243.db2.gz	MYBMMKFRZDGHOB-IEBWSBKVSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@@H](NCCC)c1ccccc1OC	ZINC001198759680	1369106646	/nfs/dbraw/zinc/10/66/46/1369106646.db2.gz	KEDUJPDCQXGBFT-QGZVFWFLSA-N	0	3	341.455	3.153	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)CCc2ncc(C(C)(C)C)o2)CC1	ZINC001112972377	1369117692	/nfs/dbraw/zinc/11/76/92/1369117692.db2.gz	VTOCVWWJDNEJIE-MRXNPFEDSA-N	0	3	347.503	3.404	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)c2cn(C)c3ccc(F)cc23)CC1	ZINC001112972109	1369117901	/nfs/dbraw/zinc/11/79/01/1369117901.db2.gz	FHDYCRAFVQYEBX-OAHLLOKOSA-N	0	3	343.446	3.430	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@H](NCC1CC1)c1ccccc1OC	ZINC001198825297	1369122663	/nfs/dbraw/zinc/12/26/63/1369122663.db2.gz	BLBAPLDQVLXNPL-KRWDZBQOSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H](NCCCCOC)c1ccccc1OC	ZINC001198835628	1369126582	/nfs/dbraw/zinc/12/65/82/1369126582.db2.gz	VBPACUZXXHTMDA-QGZVFWFLSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)[C@@H](F)C(C)C)c1ccccc1OC	ZINC001198842268	1369127105	/nfs/dbraw/zinc/12/71/05/1369127105.db2.gz	FXGOVEDWAWGCSC-WMZOPIPTSA-N	0	3	336.451	3.402	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)[C@H](OC)C(C)C)c1ccccc1OC	ZINC001198876361	1369137268	/nfs/dbraw/zinc/13/72/68/1369137268.db2.gz	RXJBYGDOLWXLJR-IEBWSBKVSA-N	0	3	348.487	3.079	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)C[C@@H](C)COC)c1ccccc1OC	ZINC001198945726	1369155432	/nfs/dbraw/zinc/15/54/32/1369155432.db2.gz	PRKRBDVZYFNMPG-SJLPKXTDSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)[C@@H](C)CCOC)c1ccccc1OC	ZINC001198994385	1369168461	/nfs/dbraw/zinc/16/84/61/1369168461.db2.gz	YCPPSQJXBBBADW-FUHWJXTLSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NC[C@H](NCCCCC)c1ccccc1OC	ZINC001199001891	1369169936	/nfs/dbraw/zinc/16/99/36/1369169936.db2.gz	MMSYUKFHBXPKPE-AEFFLSMTSA-N	0	3	348.487	3.223	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)c2ccoc2C(C)C)C1	ZINC001199261649	1369198917	/nfs/dbraw/zinc/19/89/17/1369198917.db2.gz	PXFHGGCNZNVYIE-IAGOWNOFSA-N	0	3	336.476	3.148	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CCCCCCC)C[C@H]2O)CCCC1	ZINC001199567637	1369237939	/nfs/dbraw/zinc/23/79/39/1369237939.db2.gz	XAGVSZCHYJTHSJ-QZTJIDSGSA-N	0	3	336.520	3.255	20	30		EGEDHN
C#CCCCC(=O)N1CCC(NCc2nc(C(C)(C)C)cs2)CC1	ZINC001200317369	1369347049	/nfs/dbraw/zinc/34/70/49/1369347049.db2.gz	SQTNQCFSBURTNV-UHFFFAOYSA-N	0	3	347.528	3.325	20	30		EGEDHN
O=C1C=C2CN(C(=S)Nc3ccc(F)c(Cl)c3)CCC2S1	ZINC001200584155	1369395430	/nfs/dbraw/zinc/39/54/30/1369395430.db2.gz	XDGHBHDMIKMIFX-GFCCVEGCSA-N	0	3	342.848	3.450	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCCO[C@@H](CNCc2cccc(F)c2)C1	ZINC001201209603	1369496357	/nfs/dbraw/zinc/49/63/57/1369496357.db2.gz	BOZGYVLASWOERW-APWZRJJASA-N	0	3	348.462	3.135	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)C[C@@H]2CCC3(CCC3)CO2)CC1	ZINC001113569700	1369496855	/nfs/dbraw/zinc/49/68/55/1369496855.db2.gz	SOWRFKGSMCPQLZ-ROUUACIJSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCCO[C@H](CNCc2cccc(F)c2)C1	ZINC001201233253	1369501770	/nfs/dbraw/zinc/50/17/70/1369501770.db2.gz	MWEYENWIUYNQJZ-QFBILLFUSA-N	0	3	348.462	3.135	20	30		EGEDHN
CCCCCCCN1CC[C@@](NC(=O)OC(C)(C)C)(C(=O)OC)C1	ZINC001201797630	1369625928	/nfs/dbraw/zinc/62/59/28/1369625928.db2.gz	AGZSIYGOMAEHOX-SFHVURJKSA-N	0	3	342.480	3.099	20	30		EGEDHN
CCCCCCCCCN1CC[C@H]2[C@H]1CC(=O)N2c1cnn(C)c1	ZINC001201840423	1369632479	/nfs/dbraw/zinc/63/24/79/1369632479.db2.gz	ZYWPLGIVMHANHI-ZWKOTPCHSA-N	0	3	332.492	3.350	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)N1CCC(NCc2nc(C)c(C)s2)CC1	ZINC001202085023	1369684254	/nfs/dbraw/zinc/68/42/54/1369684254.db2.gz	OEYGAQYHGMXKKX-CHWSQXEVSA-N	0	3	335.517	3.299	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001202085776	1369684735	/nfs/dbraw/zinc/68/47/35/1369684735.db2.gz	ZMSRHEMMIIWVDL-CVEARBPZSA-N	0	3	325.456	3.097	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)N1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001202101813	1369687768	/nfs/dbraw/zinc/68/77/68/1369687768.db2.gz	SZMZKYPYUWNWJT-GJZGRUSLSA-N	0	3	343.446	3.236	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC(N[C@@H](C)c2cnc(C)cn2)CC1	ZINC001202130044	1369694970	/nfs/dbraw/zinc/69/49/70/1369694970.db2.gz	CZYGPCISLJDTCG-HOTGVXAUSA-N	0	3	330.476	3.029	20	30		EGEDHN
Cc1occc1C(=O)N[C@@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202383974	1369756877	/nfs/dbraw/zinc/75/68/77/1369756877.db2.gz	ONDYTGBNUUKWDV-WOJBJXKFSA-N	0	3	348.446	3.270	20	30		EGEDHN
CC(C)C(=O)N[C@@H]1C[C@@H](NCC#Cc2ccc(Cl)cc2)C12CCC2	ZINC001202460551	1369778437	/nfs/dbraw/zinc/77/84/37/1369778437.db2.gz	VYVWWXYSGXDYJB-QZTJIDSGSA-N	0	3	344.886	3.365	20	30		EGEDHN
CCCCC(=O)N[C@@H]1C[C@@H](NCC#Cc2ccc(F)cc2)C12CCC2	ZINC001202488093	1369788228	/nfs/dbraw/zinc/78/82/28/1369788228.db2.gz	FCMIFOWKTBBWKC-RTBURBONSA-N	0	3	342.458	3.384	20	30		EGEDHN
C=CCOCC(=O)N[C@H]1C[C@@H](NCc2ccccc2Cl)C12CCC2	ZINC001202633691	1369832292	/nfs/dbraw/zinc/83/22/92/1369832292.db2.gz	PCBWVAOXIIVRIU-SJORKVTESA-N	0	3	348.874	3.060	20	30		EGEDHN
O=C(CCC1CC1)N[C@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202652408	1369838146	/nfs/dbraw/zinc/83/81/46/1369838146.db2.gz	CBSHQNHYNJRWGH-UXHICEINSA-N	0	3	336.479	3.245	20	30		EGEDHN
O=C(N[C@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2)C1=CCCC1	ZINC001202755669	1369879560	/nfs/dbraw/zinc/87/95/60/1369879560.db2.gz	PCNGBEHNESYLTM-PMACEKPBSA-N	0	3	334.463	3.165	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1C[C@H](NCc2ncccc2C)C12CCC2	ZINC001202785071	1369890832	/nfs/dbraw/zinc/89/08/32/1369890832.db2.gz	OOQPSGVSKPZZDD-RBUKOAKNSA-N	0	3	339.483	3.101	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1[C@H]2CN(CCOc3cc(C)cc(C)c3)C[C@H]21	ZINC001114352683	1369907839	/nfs/dbraw/zinc/90/78/39/1369907839.db2.gz	FQMJPDGOJWCGFH-KXTWHKPSSA-N	0	3	342.483	3.085	20	30		EGEDHN
C=C(Br)CNC1CCN(C(=O)[C@H](CC)CCC)CC1	ZINC001203098679	1369982375	/nfs/dbraw/zinc/98/23/75/1369982375.db2.gz	CCSZCZWSVZTDLI-CYBMUJFWSA-N	0	3	331.298	3.302	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1[C@H]2CN(Cc3ccc(F)cc3C)C[C@H]21	ZINC001114725898	1370048982	/nfs/dbraw/zinc/04/89/82/1370048982.db2.gz	DFMVJHUUZXQMBJ-FEUVXWNVSA-N	0	3	330.447	3.283	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1[C@H]2CN(Cc3cc(F)ccc3C)C[C@H]21	ZINC001114727248	1370049523	/nfs/dbraw/zinc/04/95/23/1370049523.db2.gz	UMFZJEBVJJODFA-FEUVXWNVSA-N	0	3	330.447	3.283	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1C[C@@H](NCc2ccccn2)C12CCC2	ZINC001203295311	1370067492	/nfs/dbraw/zinc/06/74/92/1370067492.db2.gz	JRFIQTBTXICLSK-MOPGFXCFSA-N	0	3	339.483	3.182	20	30		EGEDHN
Cc1ccc(CN2CC[C@@]3(CC(=O)N(c4cccc(C#N)c4)C3)C2)o1	ZINC001203295957	1370067834	/nfs/dbraw/zinc/06/78/34/1370067834.db2.gz	HCIWPNJRCUCBAV-HXUWFJFHSA-N	0	3	335.407	3.089	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)CCCC(F)(F)F)C12CCC2	ZINC001203428628	1370122366	/nfs/dbraw/zinc/12/23/66/1370122366.db2.gz	ZEWAUVADTFETIZ-RYUDHWBXSA-N	0	3	338.801	3.489	20	30		EGEDHN
C=CCN1C(=O)CCC12CCN(Cc1ccccc1OCC)CC2	ZINC001203537581	1370160160	/nfs/dbraw/zinc/16/01/60/1370160160.db2.gz	XNEUEHMREFCQDU-UHFFFAOYSA-N	0	3	328.456	3.228	20	30		EGEDHN
C=CCOC(=O)N1CCCC2(CC[NH+](Cc3ccccc3[O-])CC2)C1	ZINC001203547261	1370165549	/nfs/dbraw/zinc/16/55/49/1370165549.db2.gz	LITIBLLMJKWEJU-UHFFFAOYSA-N	0	3	344.455	3.393	20	30		EGEDHN
CCN(C)C(C)(C)C(=O)N[C@@H](C)CCCNc1cccc(F)c1C#N	ZINC001115030359	1370224911	/nfs/dbraw/zinc/22/49/11/1370224911.db2.gz	WLMBVGKLTYWBES-AWEZNQCLSA-N	0	3	348.466	3.124	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001203757092	1370250788	/nfs/dbraw/zinc/25/07/88/1370250788.db2.gz	IBUQDIFTIOHVGH-FQEVSTJZSA-N	0	3	339.439	3.169	20	30		EGEDHN
CN1C(=O)C2(CCN(Cc3cccc(C#N)c3)CC2)[C@@H]1c1ccccc1	ZINC001203760390	1370252709	/nfs/dbraw/zinc/25/27/09/1370252709.db2.gz	IVMGBCTVLNTFJE-FQEVSTJZSA-N	0	3	345.446	3.354	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CCN(Cc3cccc(C)n3)C2)C1	ZINC001204065915	1370365782	/nfs/dbraw/zinc/36/57/82/1370365782.db2.gz	NYFWNSBZLQQNAM-LJQANCHMSA-N	0	3	329.444	3.001	20	30		EGEDHN
CCCC(=O)NCC1(NCc2cc(C#N)ccc2OC)CCCCC1	ZINC001115381386	1370419332	/nfs/dbraw/zinc/41/93/32/1370419332.db2.gz	SFFVJWTZJRIWMJ-UHFFFAOYSA-N	0	3	343.471	3.276	20	30		EGEDHN
Cc1nc(C(C)C)oc1CNC1(CNC(=O)[C@H](C)C#N)CCCCC1	ZINC001115451863	1370459008	/nfs/dbraw/zinc/45/90/08/1370459008.db2.gz	JIJSBBLEQQBROP-CQSZACIVSA-N	0	3	346.475	3.175	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)/C=C/C2CC2)CCCCC1	ZINC001115464965	1370469661	/nfs/dbraw/zinc/46/96/61/1370469661.db2.gz	QVGQOBQYVWVYQQ-BQYQJAHWSA-N	0	3	341.293	3.270	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)/C(C)=C/C)CCCCC1	ZINC001115473211	1370479602	/nfs/dbraw/zinc/47/96/02/1370479602.db2.gz	QXLZIGCLEZAJJJ-UUILKARUSA-N	0	3	329.282	3.270	20	30		EGEDHN
CC/C=C(/C)C(=O)N1CCC(CNCc2cc(F)ccc2C#N)CC1	ZINC001204663463	1370539578	/nfs/dbraw/zinc/53/95/78/1370539578.db2.gz	XBHWVTVZENIZIS-TVPGTPATSA-N	0	3	343.446	3.382	20	30		EGEDHN
CN1CCN(Cc2ccc(Nc3ccc(Cl)nc3C#N)cc2)CC1	ZINC001204724217	1370554599	/nfs/dbraw/zinc/55/45/99/1370554599.db2.gz	CXKNCWNJVATVGY-UHFFFAOYSA-N	0	3	341.846	3.098	20	30		EGEDHN
C=C(C)CCC(=O)NCC1(NCc2nccnc2C)CCCCC1	ZINC001115556876	1370554802	/nfs/dbraw/zinc/55/48/02/1370554802.db2.gz	GUZPFJVLHXIPCA-UHFFFAOYSA-N	0	3	330.476	3.050	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H]2CN(CCOC3CCCCCC3)C[C@H]21	ZINC001187239463	1388079405	/nfs/dbraw/zinc/07/94/05/1388079405.db2.gz	CPTPNEADPVODBW-PKOBYXMFSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H]2CCO[C@@H]2C(C)C)CCCCC1	ZINC001115567959	1370568701	/nfs/dbraw/zinc/56/87/01/1370568701.db2.gz	XPCQVMITSQOOMK-HZPDHXFCSA-N	0	3	342.911	3.209	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cccc3nccn32)CCCCC1	ZINC001115627460	1370621171	/nfs/dbraw/zinc/62/11/71/1370621171.db2.gz	FWPBITXZQFIWRF-UHFFFAOYSA-N	0	3	346.862	3.109	20	30		EGEDHN
CN1CCN(C2(c3ccc(Nc4c(O)cccc4C#N)cc3)CC2)CC1	ZINC001205119644	1370655885	/nfs/dbraw/zinc/65/58/85/1370655885.db2.gz	DOAITCLIAIQKLD-UHFFFAOYSA-N	0	3	348.450	3.244	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)CCC(C)C)C[C@H]1c1cccc(F)c1	ZINC001205360567	1370731604	/nfs/dbraw/zinc/73/16/04/1370731604.db2.gz	DVNKCAVBKMNTCC-RBUKOAKNSA-N	0	3	330.447	3.169	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C(CC)CC)C[C@H]1c1cccc(F)c1	ZINC001205367502	1370732622	/nfs/dbraw/zinc/73/26/22/1370732622.db2.gz	LRGBDPMEHGKNIH-RBUKOAKNSA-N	0	3	330.447	3.169	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)CCCCCC)C[C@H]1c1cccc(F)c1	ZINC001205456128	1370760498	/nfs/dbraw/zinc/76/04/98/1370760498.db2.gz	GNDSCTLFMTYJGP-RBUKOAKNSA-N	0	3	330.447	3.313	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C[C@@H](C)C2CC2)C[C@H]1c1cccc(F)c1	ZINC001205458426	1370761849	/nfs/dbraw/zinc/76/18/49/1370761849.db2.gz	KYWOXTOIKXWQJL-UIAACRFSSA-N	0	3	342.458	3.169	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@@H](CC)CC(C)C)[C@@H]3COC[C@@H]32)CC1	ZINC001205516589	1370777955	/nfs/dbraw/zinc/77/79/55/1370777955.db2.gz	MCCNNSUHQTYRKO-GBESFXJTSA-N	0	3	348.531	3.184	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)C[C@@H](CC)C(C)C)[C@@H]3COC[C@@H]32)CC1	ZINC001205516541	1370778193	/nfs/dbraw/zinc/77/81/93/1370778193.db2.gz	JJCNEVYBTXKZKE-CEXWTWQISA-N	0	3	348.531	3.184	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H]2CCO[C@@H](CC)C2)CCCCC1	ZINC001115809188	1370792169	/nfs/dbraw/zinc/79/21/69/1370792169.db2.gz	BLBSQEFJAGOJPD-CVEARBPZSA-N	0	3	342.911	3.353	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CN(Cc3ccc4[nH]ccc4c3)C2)CC1	ZINC001205562877	1370792307	/nfs/dbraw/zinc/79/23/07/1370792307.db2.gz	CSXZMXPGAZMBMY-UHFFFAOYSA-N	0	3	339.439	3.388	20	30		EGEDHN
COc1cccc(-c2n[nH]cc2CNCc2cccc(OCC#N)c2)c1	ZINC001116059954	1370829246	/nfs/dbraw/zinc/82/92/46/1370829246.db2.gz	XSPJVFUBDGSBCI-UHFFFAOYSA-N	0	3	348.406	3.277	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)N1CCC(CNCc2nc(C)cs2)CC1	ZINC001205956089	1370923221	/nfs/dbraw/zinc/92/32/21/1370923221.db2.gz	ZUCAMZNQGZESED-ZFWWWQNUSA-N	0	3	335.517	3.238	20	30		EGEDHN
C#CC[C@@H](NCc1ccc(OCC(=O)OCC)cc1)c1ccccc1	ZINC001116489802	1370923452	/nfs/dbraw/zinc/92/34/52/1370923452.db2.gz	NFNACBATPVEMNT-HXUWFJFHSA-N	0	3	337.419	3.483	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC(CNCc2ccccc2C#N)CC1	ZINC001205989229	1370931756	/nfs/dbraw/zinc/93/17/56/1370931756.db2.gz	RSKZFPYGPWPNHK-KRWDZBQOSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CN(CCOc2cc(C)cc(C)c2)C[C@H]1C	ZINC001206509243	1371077938	/nfs/dbraw/zinc/07/79/38/1371077938.db2.gz	HELRENFQRPVGHT-IEBWSBKVSA-N	0	3	330.472	3.085	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN[C@@H]2CCOc3ccc(F)cc32)c1	ZINC001118087559	1371130283	/nfs/dbraw/zinc/13/02/83/1371130283.db2.gz	BYEQZGUYTPAKSO-QGZVFWFLSA-N	0	3	339.370	3.139	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CCN(Cc3cncc(C)c3)C2)C1	ZINC001207154484	1371313263	/nfs/dbraw/zinc/31/32/63/1371313263.db2.gz	ZQLJJKQYCBROCU-LJQANCHMSA-N	0	3	329.444	3.001	20	30		EGEDHN
C=CCN(CCN1CCC(CCOC)CC1)C(=O)OC(C)(C)C	ZINC001207206210	1371329156	/nfs/dbraw/zinc/32/91/56/1371329156.db2.gz	RTZKUCIMARFOCO-UHFFFAOYSA-N	0	3	326.481	3.158	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN(Cc2ccc(C)c(OC)c2)C[C@H]1C	ZINC001207215684	1371331867	/nfs/dbraw/zinc/33/18/67/1371331867.db2.gz	OKLVUOVHFDVNJK-SJLPKXTDSA-N	0	3	330.472	3.296	20	30		EGEDHN
O=C(C[C@@H]1C=CCC1)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207232055	1371337229	/nfs/dbraw/zinc/33/72/29/1371337229.db2.gz	IAHCQOKQGXPFIR-QUCCMNQESA-N	0	3	340.442	3.114	20	30		EGEDHN
COc1cccc(CCCN2CCN(c3cccc(C#N)c3)CC2)c1	ZINC001207573493	1371439769	/nfs/dbraw/zinc/43/97/69/1371439769.db2.gz	XDCXUQXKDGHIGU-UHFFFAOYSA-N	0	3	335.451	3.322	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H](NCc2ccccc2OC2CC2)C1	ZINC001207654462	1371465676	/nfs/dbraw/zinc/46/56/76/1371465676.db2.gz	RCNNPJBMUPEGHY-KRWDZBQOSA-N	0	3	328.456	3.275	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)c2ccccc2C(C)(C)C)C1	ZINC001207659675	1371466462	/nfs/dbraw/zinc/46/64/62/1371466462.db2.gz	HUJOILMMFUALIH-VQIMIIECSA-N	0	3	344.499	3.237	20	30		EGEDHN
CC[C@@H](C)CC(=O)N1CCC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001207915846	1371538219	/nfs/dbraw/zinc/53/82/19/1371538219.db2.gz	ZRZGSIJWSYBKGS-PBHICJAKSA-N	0	3	331.435	3.214	20	30		EGEDHN
CC(C)c1cccc(CN[C@H]2CCCN(C(=O)C#CC(C)(C)C)C2)n1	ZINC001208011027	1371567486	/nfs/dbraw/zinc/56/74/86/1371567486.db2.gz	TUFOYKHPSFWTFZ-SFHVURJKSA-N	0	3	341.499	3.335	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@@H](NCc2ccc(C#N)s2)C1	ZINC001208240188	1371674471	/nfs/dbraw/zinc/67/44/71/1371674471.db2.gz	KIGGGNFHYZBVGM-CQSZACIVSA-N	0	3	331.485	3.303	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1CCC[C@@H](NCc2ccccc2F)C1)OCC	ZINC001208263792	1371689892	/nfs/dbraw/zinc/68/98/92/1371689892.db2.gz	CLXHJLLKJSNROL-IEBWSBKVSA-N	0	3	348.462	3.278	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)CCCOc2ccccc2C)C1	ZINC001208269621	1371691522	/nfs/dbraw/zinc/69/15/22/1371691522.db2.gz	BVTQOFZLPKQLKN-QZTJIDSGSA-N	0	3	330.472	3.167	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CN(Cc2ccc(C)c(OC)c2)C[C@H]1C	ZINC001208374799	1371741470	/nfs/dbraw/zinc/74/14/70/1371741470.db2.gz	XPVAMOKHIGFADB-IEBWSBKVSA-N	0	3	342.483	3.134	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CN(Cc2cccc(N(C)C)c2)C[C@H]1C	ZINC001208388902	1371747423	/nfs/dbraw/zinc/74/74/23/1371747423.db2.gz	RUIDAOAQWPYVGA-SQGPQFPESA-N	0	3	343.515	3.291	20	30		EGEDHN
C=C(Br)CNC1CC2(C1)CC(NC(=O)[C@@H](C)CCC)C2	ZINC001120858867	1371787163	/nfs/dbraw/zinc/78/71/63/1371787163.db2.gz	JLMUQOAHGQSDBJ-VBTSJIPESA-N	0	3	343.309	3.348	20	30		EGEDHN
C=C(Br)CNC1CC2(C1)CC(NC(=O)[C@H](C)CCC)C2	ZINC001120858866	1371787273	/nfs/dbraw/zinc/78/72/73/1371787273.db2.gz	JLMUQOAHGQSDBJ-NYKNNPSKSA-N	0	3	343.309	3.348	20	30		EGEDHN
N#Cc1cccc(CCCN2CCN(c3noc4ccccc43)CC2)c1	ZINC001208844521	1371914906	/nfs/dbraw/zinc/91/49/06/1371914906.db2.gz	KCAFABSQQBKCDX-UHFFFAOYSA-N	0	3	346.434	3.454	20	30		EGEDHN
C=C/C(C)=C\CC(=O)N1CCC[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001209051423	1371983564	/nfs/dbraw/zinc/98/35/64/1371983564.db2.gz	JCDZTAROGDIDEG-HMMSMWIJSA-N	0	3	341.430	3.300	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@@H](NCC#Cc3ccc(F)cc3)C2)CCC1	ZINC001209100264	1371997895	/nfs/dbraw/zinc/99/78/95/1371997895.db2.gz	HPLSHRTVJLQZER-LJQANCHMSA-N	0	3	342.458	3.338	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC[C@H](NCc2cnn(C(C)(C)C)c2)C1	ZINC001209185750	1372030533	/nfs/dbraw/zinc/03/05/33/1372030533.db2.gz	XJBBEQHIIVVKAF-AEFFLSMTSA-N	0	3	346.519	3.321	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC[C@@H](NCc2c(C)nsc2C)C1	ZINC001209193110	1372033519	/nfs/dbraw/zinc/03/35/19/1372033519.db2.gz	GGCIXJCDFCJURR-HZPDHXFCSA-N	0	3	335.517	3.443	20	30		EGEDHN
C=CCCCCN1Cc2cncn2C[C@H](COCc2ccccn2)C1	ZINC001209204065	1372037172	/nfs/dbraw/zinc/03/71/72/1372037172.db2.gz	YJPINTHMQUQAOA-GOSISDBHSA-N	0	3	340.471	3.283	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)C[C@@H](C)c1cccnc1)C2	ZINC001121867080	1372107703	/nfs/dbraw/zinc/10/77/03/1372107703.db2.gz	JWJRFMBHSQWYBE-HKYFHIHASA-N	0	3	347.890	3.345	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N[C@@H](C)c1nc(-c2ccc(F)c(C)c2)no1	ZINC001121896328	1372117500	/nfs/dbraw/zinc/11/75/00/1372117500.db2.gz	LFJHVDPQYJVXNL-WFASDCNBSA-N	0	3	346.406	3.045	20	30		EGEDHN
C=CCCC1(C(=O)N2CCC[C@@H](NCc3ccc(C#N)s3)C2)CC1	ZINC001209493479	1372120412	/nfs/dbraw/zinc/12/04/12/1372120412.db2.gz	MBQBJFQAIBMBOV-OAHLLOKOSA-N	0	3	343.496	3.447	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc(Oc2ncccn2)cc1C	ZINC001121938681	1372127800	/nfs/dbraw/zinc/12/78/00/1372127800.db2.gz	QCMNFDDNJIIBMV-HNNXBMFYSA-N	0	3	326.400	3.199	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)Nc1cc(C2CCOCC2)[nH]n1	ZINC001121968235	1372137781	/nfs/dbraw/zinc/13/77/81/1372137781.db2.gz	UXXMZMIBKTVKCU-HNNXBMFYSA-N	0	3	336.480	3.320	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1)c1ccco1	ZINC001209601760	1372148196	/nfs/dbraw/zinc/14/81/96/1372148196.db2.gz	PVGVCBMYKMBZOM-HKUYNNGSSA-N	0	3	336.435	3.015	20	30		EGEDHN
C=C(C)Cn1c([C@@H](C)CCC#N)nnc1N1CCN(CC(C)C)CC1	ZINC001122525240	1372266840	/nfs/dbraw/zinc/26/68/40/1372266840.db2.gz	FSMXMDJWHNKQES-KRWDZBQOSA-N	0	3	344.507	3.039	20	30		EGEDHN
CCc1nc(-c2ccc(C(=O)C(C#N)c3cccc(F)n3)cc2)n[nH]1	ZINC001122721651	1372306287	/nfs/dbraw/zinc/30/62/87/1372306287.db2.gz	XWEQAIOUTDZFQM-CYBMUJFWSA-N	0	3	335.342	3.058	20	30		EGEDHN
CN(c1ccc(C#N)cc1)c1ccc(CN2CCNC[C@@H](F)C2)cc1	ZINC001210581561	1372383989	/nfs/dbraw/zinc/38/39/89/1372383989.db2.gz	RGGJXEXYGPTMSN-GOSISDBHSA-N	0	3	338.430	3.069	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)C2(CCc3ccccc3)CC2)C1	ZINC001211508788	1372570854	/nfs/dbraw/zinc/57/08/54/1372570854.db2.gz	JBRDCWVFTAQERP-IEBWSBKVSA-N	0	3	326.484	3.412	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](c2ccccc2)[C@H](NCc2cncs2)C1	ZINC001211553965	1372579306	/nfs/dbraw/zinc/57/93/06/1372579306.db2.gz	PTCFJWBITPGKAQ-ZWKOTPCHSA-N	0	3	341.480	3.194	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2sccc2C)[C@H](OC)C1	ZINC001211766104	1372614012	/nfs/dbraw/zinc/61/40/12/1372614012.db2.gz	RZJLXJVCJKZVAC-HZPDHXFCSA-N	0	3	336.501	3.232	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2cccc(F)c2)[C@H](OC)C1	ZINC001211784454	1372614885	/nfs/dbraw/zinc/61/48/85/1372614885.db2.gz	XUUADAZUKCCJNZ-QZTJIDSGSA-N	0	3	334.435	3.001	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)[C@H](C)C(C)(C)C)[C@H](OC)C1	ZINC001212470070	1372711599	/nfs/dbraw/zinc/71/15/99/1372711599.db2.gz	UGVRWKNVVHKLMS-GVDBMIGSSA-N	0	3	326.525	3.454	20	30		EGEDHN
C=CCCC(=O)NCCNCc1sc(-c2ccccc2)nc1C	ZINC001124640583	1372718735	/nfs/dbraw/zinc/71/87/35/1372718735.db2.gz	KJAFYYJSOHJSAU-UHFFFAOYSA-N	0	3	329.469	3.291	20	30		EGEDHN
Cc1cccc(CN(CCN(C)C)C(=O)c2ccc(C#N)cc2F)c1	ZINC001125847308	1372872228	/nfs/dbraw/zinc/87/22/28/1372872228.db2.gz	JKSNVUMWOUXNQN-UHFFFAOYSA-N	0	3	339.414	3.210	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2cc[nH]c2C2CC2)[C@H](OC)C1	ZINC001213335971	1372886797	/nfs/dbraw/zinc/88/67/97/1372886797.db2.gz	NWBDFTHREZBICK-QZTJIDSGSA-N	0	3	345.487	3.068	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](NCc3cncc(F)c3)C2)CCCCC1	ZINC001188052411	1388229556	/nfs/dbraw/zinc/22/95/56/1388229556.db2.gz	DHEFQVPCZAYRPB-GOSISDBHSA-N	0	3	345.462	3.438	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2cccc(C(C)(C)C)c2)[C@H](OC)C1	ZINC001213603509	1372933136	/nfs/dbraw/zinc/93/31/36/1372933136.db2.gz	FZGXCIMQLDBDJY-RTBURBONSA-N	0	3	344.499	3.379	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2ccccc2OC)[C@H](OC)C1	ZINC001213767474	1372958357	/nfs/dbraw/zinc/95/83/57/1372958357.db2.gz	VPKDJFXGQMRGTH-IEBWSBKVSA-N	0	3	348.487	3.095	20	30		EGEDHN
Cc1ccc(CN2CC[C@@H](NC(=O)Nc3ccc(C#N)cc3)C2)cc1	ZINC001214156952	1373016256	/nfs/dbraw/zinc/01/62/56/1373016256.db2.gz	QZIMEYZYKQKRGI-LJQANCHMSA-N	0	3	334.423	3.263	20	30		EGEDHN
CC(C)C#CC(=O)NCCN[C@H](C)c1ccc(Cl)c(Cl)c1	ZINC001126816006	1373033594	/nfs/dbraw/zinc/03/35/94/1373033594.db2.gz	RFPWOFQATQATFM-GFCCVEGCSA-N	0	3	327.255	3.420	20	30		EGEDHN
CC(C)(C)C#CC(=O)NCCNCc1cnc(-c2ccccc2)s1	ZINC001126921750	1373052173	/nfs/dbraw/zinc/05/21/73/1373052173.db2.gz	VULDCBGELSDHOQ-UHFFFAOYSA-N	0	3	341.480	3.065	20	30		EGEDHN
C[C@@H]1CN(C(=O)C(F)=C2CCCC2)C[C@H]1NCC#Cc1ccccc1	ZINC001214437804	1373061743	/nfs/dbraw/zinc/06/17/43/1373061743.db2.gz	XUXJLUDWYHKDIE-VQIMIIECSA-N	0	3	340.442	3.272	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](C)[C@H](N[C@@H]2CCc3c2c(F)ccc3F)C1	ZINC001214529436	1373075128	/nfs/dbraw/zinc/07/51/28/1373075128.db2.gz	ZBHHLQDZNBYLAX-FSPWUOQZSA-N	0	3	346.421	3.192	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001214708325	1373105833	/nfs/dbraw/zinc/10/58/33/1373105833.db2.gz	ASDSOVQOFKOLOP-VQIMIIECSA-N	0	3	344.474	3.296	20	30		EGEDHN
Cc1c(Cl)cccc1C(=O)NCCNCc1cccc(C#N)c1	ZINC001127875844	1373194026	/nfs/dbraw/zinc/19/40/26/1373194026.db2.gz	NBSUNRJIVGRMBR-UHFFFAOYSA-N	0	3	327.815	3.040	20	30		EGEDHN
C=CCNCc1cccc(N2CC[C@@H](NC(=O)CCCCCC)C2)n1	ZINC001128132525	1373222319	/nfs/dbraw/zinc/22/23/19/1373222319.db2.gz	FDMDYJIJKCCXNZ-GOSISDBHSA-N	0	3	344.503	3.023	20	30		EGEDHN
C=C(C)CCC(=O)NCCNCc1ccc(F)c(Br)c1	ZINC001128408757	1373263316	/nfs/dbraw/zinc/26/33/16/1373263316.db2.gz	DJOFTAHEJGHOGR-UHFFFAOYSA-N	0	3	343.240	3.150	20	30		EGEDHN
C=C(C)CCC(=O)NCCNCc1ccccc1OCC(F)(F)F	ZINC001128413747	1373264064	/nfs/dbraw/zinc/26/40/64/1373264064.db2.gz	MCYXGFARTQUJIA-UHFFFAOYSA-N	0	3	344.377	3.190	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)CC(C)(C)C)[C@@H](n2ccnn2)C1	ZINC001128705496	1373304232	/nfs/dbraw/zinc/30/42/32/1373304232.db2.gz	MYPKCOFRGLZMCD-SJORKVTESA-N	0	3	349.523	3.026	20	30		EGEDHN
CC1(C(=O)NCCNCc2ccc(F)c(C#N)c2)CCCCCC1	ZINC001129648378	1373407643	/nfs/dbraw/zinc/40/76/43/1373407643.db2.gz	XQTVRBCNVSAQSP-UHFFFAOYSA-N	0	3	331.435	3.264	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)[C@H]2CC[C@H](C3CCC3)CC2)cc1	ZINC001129835684	1373426890	/nfs/dbraw/zinc/42/68/90/1373426890.db2.gz	NWJAJKMCMZJGIO-MXVIHJGJSA-N	0	3	339.483	3.371	20	30		EGEDHN
CC[C@H]1CCC[C@@]1(C)C(=O)NCCNCc1ccc(C#N)c(F)c1	ZINC001130259048	1373479730	/nfs/dbraw/zinc/47/97/30/1373479730.db2.gz	VCNBDWBDRAGIFO-QFBILLFUSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)[C@H](CC)CC(C)C)C1	ZINC001130438601	1373540129	/nfs/dbraw/zinc/54/01/29/1373540129.db2.gz	MPJUZJOIADWBCW-CVEARBPZSA-N	0	3	332.492	3.074	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)[C@@H](C)CCC(C)(C)C)C1	ZINC001130441715	1373540809	/nfs/dbraw/zinc/54/08/09/1373540809.db2.gz	DPMSAYMFDBBAEF-JKSUJKDBSA-N	0	3	346.519	3.464	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)C2(C)C(C)(C)C2(C)C)C1	ZINC001130457250	1373545603	/nfs/dbraw/zinc/54/56/03/1373545603.db2.gz	SSCVPLWVWHEWKT-CQSZACIVSA-N	0	3	344.503	3.074	20	30		EGEDHN
N#Cc1ccc(OCc2ccccc2)cc1O[C@H]1CCNC[C@H]1F	ZINC001218066949	1373551728	/nfs/dbraw/zinc/55/17/28/1373551728.db2.gz	OWXLERZXSIGMFP-MSOLQXFVSA-N	0	3	326.371	3.216	20	30		EGEDHN
Fc1ccc(/N=C/c2ccc(O[C@H]3CC[C@@H]4NCCO[C@@H]43)cc2)cc1	ZINC001218118839	1373564214	/nfs/dbraw/zinc/56/42/14/1373564214.db2.gz	GJKJPFWCKVNKGT-YAGMQUQISA-N	0	3	340.398	3.475	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2OCCN(C(=O)c3ccoc3C3CC3)[C@H]2C1	ZINC001218536038	1373631598	/nfs/dbraw/zinc/63/15/98/1373631598.db2.gz	HQMLZJAFFICKDP-FHLIZLRMSA-N	0	3	344.455	3.037	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)CCc2cc3ccccc3o2)cc1	ZINC001131069070	1373637478	/nfs/dbraw/zinc/63/74/78/1373637478.db2.gz	ULXMPLDLQDHTRC-UHFFFAOYSA-N	0	3	347.418	3.143	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)Nc1c[nH]c(=O)c(C(F)(F)F)c1	ZINC001218690898	1373644391	/nfs/dbraw/zinc/64/43/91/1373644391.db2.gz	QKGBWRRWFLZNNA-LBPRGKRZSA-N	0	3	331.338	3.208	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)C3[C@@H]4CCCCCC[C@@H]34)[C@H]2C1	ZINC001218688336	1373644404	/nfs/dbraw/zinc/64/44/04/1373644404.db2.gz	CZBIUQXHNYIFRT-AKHDSKFASA-N	0	3	346.515	3.081	20	30		EGEDHN
COc1ccc(CNCCNC(=O)CC2(C)CCCCC2)cc1C#N	ZINC001131140821	1373650104	/nfs/dbraw/zinc/65/01/04/1373650104.db2.gz	UKYKEVHVRAKYCM-UHFFFAOYSA-N	0	3	343.471	3.133	20	30		EGEDHN
CNc1ccc(C#N)cc1NC(=O)[C@@H]1CCC[C@H](c2ccccc2)N1	ZINC001218980696	1373674425	/nfs/dbraw/zinc/67/44/25/1373674425.db2.gz	IUFKDMDBSMMFQV-AEFFLSMTSA-N	0	3	334.423	3.422	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)c3ccc(C(C)C)cc3)[C@H]2C1	ZINC001219006468	1373678827	/nfs/dbraw/zinc/67/88/27/1373678827.db2.gz	JZGGKWHFEZNXNW-VQTJNVASSA-N	0	3	342.483	3.301	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C(CCC)CCC)C[C@@H](C)O2	ZINC001131681651	1373760159	/nfs/dbraw/zinc/76/01/59/1373760159.db2.gz	GBGOBDWAILDBCL-XLIONFOSSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](C)O[C@]3(CCN(CC(=C)C)C3)C2)CCC1	ZINC001131681903	1373760358	/nfs/dbraw/zinc/76/03/58/1373760358.db2.gz	JYOICJJMOQFOLX-XLIONFOSSA-N	0	3	332.488	3.001	20	30		EGEDHN
C[C@H]1[C@H]2C[C@@H](C[C@H]1NC(=O)C[C@@H](N)c1ccc(C#N)cc1)C2(C)C	ZINC001221198567	1373767880	/nfs/dbraw/zinc/76/78/80/1373767880.db2.gz	DDWHLSRJQYILLM-KMJFJPQNSA-N	0	3	325.456	3.135	20	30		EGEDHN
O=C(C#CC1CC1)N1C[C@H]2CCN(CC/C=C\c3ccccc3)C[C@H]21	ZINC001221530368	1373777481	/nfs/dbraw/zinc/77/74/81/1373777481.db2.gz	HZBRVQGCMNUILH-VEZITOEXSA-N	0	3	334.463	3.036	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)CCCCc3ccc(F)cc3)[C@@H]2C1	ZINC001221834433	1373795218	/nfs/dbraw/zinc/79/52/18/1373795218.db2.gz	ZOIFMTGKTMVNKG-UYAOXDASSA-N	0	3	342.458	3.095	20	30		EGEDHN
Cc1ccc(CN2C[C@@H](NC(=O)CSCC#N)CC[C@H]2C)cc1C	ZINC001131829309	1373827663	/nfs/dbraw/zinc/82/76/63/1373827663.db2.gz	DLOGKYWZSKHZFI-AEFFLSMTSA-N	0	3	345.512	3.029	20	30		EGEDHN
C=CCOCCCC(=O)N[C@H]1CC[C@H](C)N(Cc2cccc(C)c2)C1	ZINC001131938344	1375056873	/nfs/dbraw/zinc/05/68/73/1375056873.db2.gz	FVLZOYKBNPRFDB-ICSRJNTNSA-N	0	3	344.499	3.447	20	30		EGEDHN
C=CCOCC(=O)N[C@H]1CC[C@@H](C)N(Cc2ccc(C(C)C)cc2)C1	ZINC001131947883	1375062594	/nfs/dbraw/zinc/06/25/94/1375062594.db2.gz	YVCPGVVHKBTHLQ-XLIONFOSSA-N	0	3	344.499	3.482	20	30		EGEDHN
CC(C)C#CC(=O)N[C@H]1CC[C@@H](C)N(Cc2cccc3cccnc32)C1	ZINC001132018845	1375101397	/nfs/dbraw/zinc/10/13/97/1375101397.db2.gz	ZENDJOYGQXTHJA-XLIONFOSSA-N	0	3	349.478	3.363	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N[C@@H]2CC[C@@H](C)N(CC(=C)C)C2)cc1	ZINC001132041480	1375112881	/nfs/dbraw/zinc/11/28/81/1375112881.db2.gz	FQZOURTYQHEIOH-IEBWSBKVSA-N	0	3	340.467	3.248	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCCc2csc(C)n2)CC[C@H]1C	ZINC001132050675	1375118156	/nfs/dbraw/zinc/11/81/56/1375118156.db2.gz	QULQKMMQRHHHLI-ZBFHGGJFSA-N	0	3	335.517	3.319	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)CCCc2cc(C)ccc2C)CC1	ZINC001225526226	1375118596	/nfs/dbraw/zinc/11/85/96/1375118596.db2.gz	VDAORXCFVKXQSL-UHFFFAOYSA-N	0	3	340.511	3.478	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1CC[C@@H](C)N(CCOc2ccccc2)C1	ZINC001132071613	1375132472	/nfs/dbraw/zinc/13/24/72/1375132472.db2.gz	BOVXPXQNMGBDEV-MSOLQXFVSA-N	0	3	330.472	3.391	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1CC[C@H](C)N(Cc2ccc(CO)cc2)C1	ZINC001132073358	1375133762	/nfs/dbraw/zinc/13/37/62/1375133762.db2.gz	VHKJINGNYJHUMH-LPHOPBHVSA-N	0	3	330.472	3.004	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@H]1CC[C@H](C)N(CCOC2CCC2)C1	ZINC001132079396	1375136260	/nfs/dbraw/zinc/13/62/60/1375136260.db2.gz	XZXJIWZOBLDDSZ-ZFWWWQNUSA-N	0	3	342.911	3.303	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCOc2c(C)cccc2C)CC[C@H]1C	ZINC001132098193	1375147099	/nfs/dbraw/zinc/14/70/99/1375147099.db2.gz	VKGMMTOAJSYVRH-MSOLQXFVSA-N	0	3	330.472	3.227	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCc2ncc(C(C)(C)C)o2)CC[C@H]1C	ZINC001132114286	1375155628	/nfs/dbraw/zinc/15/56/28/1375155628.db2.gz	GRZLRRIBEIEIGN-HZPDHXFCSA-N	0	3	347.503	3.450	20	30		EGEDHN
Cc1cnccc1C(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1	ZINC001226065345	1375198676	/nfs/dbraw/zinc/19/86/76/1375198676.db2.gz	AIFHOCKDVRGZJJ-NHCUHLMSSA-N	0	3	347.462	3.072	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1CC[C@@H](C)N(CCc2scnc2C)C1	ZINC001132228164	1375223963	/nfs/dbraw/zinc/22/39/63/1375223963.db2.gz	NJBZJWJYZIRZAI-HIFRSBDPSA-N	0	3	335.517	3.175	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)Cc2cc(C)cc(C)c2)CC[C@@H]1C	ZINC001132262611	1375253626	/nfs/dbraw/zinc/25/36/26/1375253626.db2.gz	ZWQNPZGKQXAVPS-ICSRJNTNSA-N	0	3	344.499	3.018	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2(Cc3ccc(F)cc3)CC2)CC[C@H]1C	ZINC001132340672	1375321180	/nfs/dbraw/zinc/32/11/80/1375321180.db2.gz	XCBNGIJXWAUCDL-APWZRJJASA-N	0	3	342.458	3.141	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)[C@H]2CC[C@H](CC)CC2)CC[C@H]1C	ZINC001132429815	1375376856	/nfs/dbraw/zinc/37/68/56/1375376856.db2.gz	PXAHXNOQIBLDAW-MKXGPGLRSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=C[C@@](C)(O)CC(=O)NC1CCN([C@@H](CC)c2ccc(F)cc2)CC1	ZINC001227124589	1375394404	/nfs/dbraw/zinc/39/44/04/1375394404.db2.gz	VONILTMKLSPIEV-AZUAARDMSA-N	0	3	348.462	3.185	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2cccc(C)c2C)CC[C@@H]1C	ZINC001132458525	1375401166	/nfs/dbraw/zinc/40/11/66/1375401166.db2.gz	WEPLTTSAEPJJQA-FUHWJXTLSA-N	0	3	330.472	3.089	20	30		EGEDHN
N#Cc1ccc2nc(O[C@H]3CCN4Cc5ccccc5N=C34)[nH]c2c1	ZINC001227218975	1375407758	/nfs/dbraw/zinc/40/77/58/1375407758.db2.gz	JEWDVUFPEPNUJZ-KRWDZBQOSA-N	0	3	329.363	3.131	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)C(C)(C)c2ccccc2)CC[C@H]1C	ZINC001132467743	1375409227	/nfs/dbraw/zinc/40/92/27/1375409227.db2.gz	KHIFZZLECNTZRA-MJGOQNOKSA-N	0	3	344.499	3.136	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COc2cccc(Cl)c2)CC[C@H]1C	ZINC001132468014	1375409901	/nfs/dbraw/zinc/40/99/01/1375409901.db2.gz	LIAHQHQVVVWAIK-GDBMZVCRSA-N	0	3	336.863	3.264	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)Cc2ccc(C)c(C)c2)CC[C@H]1C	ZINC001132469791	1375411102	/nfs/dbraw/zinc/41/11/02/1375411102.db2.gz	WMIIRVYOCOLWRY-QUCCMNQESA-N	0	3	344.499	3.018	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCc2nc3ccccc3o2)CC[C@H]1C	ZINC001132477524	1375415231	/nfs/dbraw/zinc/41/52/31/1375415231.db2.gz	FGNGMZOWTUGAAN-CVEARBPZSA-N	0	3	341.455	3.306	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCc2ccc(Cl)s2)CC[C@H]1C	ZINC001132482850	1375418896	/nfs/dbraw/zinc/41/88/96/1375418896.db2.gz	ZTUGXPSBVVOATM-OLZOCXBDSA-N	0	3	326.893	3.489	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(OCCCC)cc2)CC[C@H]1C	ZINC001132487050	1375420835	/nfs/dbraw/zinc/42/08/35/1375420835.db2.gz	QXIMJHDQLQIGGW-MJGOQNOKSA-N	0	3	342.483	3.472	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2cccc(Cl)c2C)CC1	ZINC001227480398	1375435436	/nfs/dbraw/zinc/43/54/36/1375435436.db2.gz	HSWNQIZHBWIEFW-UHFFFAOYSA-N	0	3	336.863	3.045	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2coc3ccccc32)CC[C@H]1C	ZINC001132536462	1375446067	/nfs/dbraw/zinc/44/60/67/1375446067.db2.gz	AVLXOHIOCFZOTL-HZPDHXFCSA-N	0	3	342.439	3.218	20	30		EGEDHN
C=C(C)CCC(=O)NC1CCN(CCOc2cccc(OC)c2)CC1	ZINC001227596630	1375449502	/nfs/dbraw/zinc/44/95/02/1375449502.db2.gz	IDLVPFGFZBCLBR-UHFFFAOYSA-N	0	3	346.471	3.011	20	30		EGEDHN
C#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)/C=C(\C)CC)CC1	ZINC001132554504	1375461257	/nfs/dbraw/zinc/46/12/57/1375461257.db2.gz	HPAABAMEFSWLFX-IETCZJMGSA-N	0	3	339.483	3.254	20	30		EGEDHN
CC#CCN1CC[C@H](CN(Cc2scnc2C)C(=O)C=C(C)C)C1	ZINC001132557979	1375464744	/nfs/dbraw/zinc/46/47/44/1375464744.db2.gz	HOIJNYVVTVZWAO-KRWDZBQOSA-N	0	3	345.512	3.092	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCNCc1csc(Br)c1	ZINC001132577474	1375473735	/nfs/dbraw/zinc/47/37/35/1375473735.db2.gz	WFBORLRUDJXBEL-MNOVXSKESA-N	0	3	345.306	3.175	20	30		EGEDHN
N#Cc1ccc2c(cccc2O[C@H]2CC[C@H](N3CCOCC3)CC2)n1	ZINC001227797379	1375476224	/nfs/dbraw/zinc/47/62/24/1375476224.db2.gz	DPONHOVBAKEVPX-QAQDUYKDSA-N	0	3	337.423	3.129	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](C)[C@H](CNCc2nc3ccccc3o2)C1	ZINC001132696576	1375518742	/nfs/dbraw/zinc/51/87/42/1375518742.db2.gz	LPUUVDRPXNSNGX-HZPDHXFCSA-N	0	3	341.455	3.368	20	30		EGEDHN
C=CCc1cc(OC)c(O[C@@H]2CCCN(CC)C2)c(C(=O)OC)c1	ZINC001228246721	1375533282	/nfs/dbraw/zinc/53/32/82/1375533282.db2.gz	ZUXOHSXRGDAKOZ-OAHLLOKOSA-N	0	3	333.428	3.073	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](C)[C@H](CNCc2nc(C)sc2C)C1	ZINC001132786220	1375563647	/nfs/dbraw/zinc/56/36/47/1375563647.db2.gz	QHDWPGXPQUQRPH-WMLDXEAASA-N	0	3	347.528	3.138	20	30		EGEDHN
CC/C(C)=C\C(=O)N1CC[C@H](C)[C@H](CNCc2ccccc2C#N)C1	ZINC001132804176	1375570842	/nfs/dbraw/zinc/57/08/42/1375570842.db2.gz	GKLGLFKODGZNET-UUUQTGMNSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](C)[C@H](CNCc2nccs2)C1	ZINC001132843200	1375595415	/nfs/dbraw/zinc/59/54/15/1375595415.db2.gz	JGNFDDHYMHUDDT-DOTOQJQBSA-N	0	3	347.528	3.486	20	30		EGEDHN
CC#CCCCC(=O)NC1CCN(Cc2cc(C)ccc2OC)CC1	ZINC001228712257	1375648937	/nfs/dbraw/zinc/64/89/37/1375648937.db2.gz	MZBLYZBXGCKRRH-UHFFFAOYSA-N	0	3	342.483	3.278	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NC1CCN(Cc2ccccc2N(C)C)CC1	ZINC001228760582	1375667941	/nfs/dbraw/zinc/66/79/41/1375667941.db2.gz	MTTWLSMWMRJEBE-IAGOWNOFSA-N	0	3	343.515	3.291	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@H](C)[C@@H](CNCc3cc(C)no3)C2)CC1	ZINC001133104826	1375777175	/nfs/dbraw/zinc/77/71/75/1375777175.db2.gz	KUMAZNJORGZEGL-RDJZCZTQSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](C)[C@@H](CNCc3cscn3)C2)CCC1	ZINC001133105765	1375778023	/nfs/dbraw/zinc/77/80/23/1375778023.db2.gz	XIIAYSBPBNTLSQ-HOTGVXAUSA-N	0	3	347.528	3.464	20	30		EGEDHN
COc1ccc2nc(O[C@H]3CCN(Cc4ccccc4C#N)C3)[nH]c2c1	ZINC001229728881	1375882051	/nfs/dbraw/zinc/88/20/51/1375882051.db2.gz	FTZIYMOYPALADG-KRWDZBQOSA-N	0	3	348.406	3.096	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2ccc(F)c(Cl)c2F)c1	ZINC001133319213	1375919637	/nfs/dbraw/zinc/91/96/37/1375919637.db2.gz	UTGZLCAZRNBSEG-UHFFFAOYSA-N	0	3	349.768	3.009	20	30		EGEDHN
C=C1CCC(C(=O)NCCNCc2ccc(Cl)c(OC)c2)CC1	ZINC001133365264	1375946692	/nfs/dbraw/zinc/94/66/92/1375946692.db2.gz	JXJIPQDJKGHSAR-UHFFFAOYSA-N	0	3	336.863	3.301	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1cc(C)oc1C	ZINC001133377334	1375958244	/nfs/dbraw/zinc/95/82/44/1375958244.db2.gz	RLXUHPCDQUSNJM-UHFFFAOYSA-N	0	3	344.842	3.415	20	30		EGEDHN
CC(=O)N(CCNCc1ccc(C#N)s1)Cc1cccc(Cl)c1	ZINC001133379926	1375960067	/nfs/dbraw/zinc/96/00/67/1375960067.db2.gz	NQFIVJQQAATAJY-UHFFFAOYSA-N	0	3	347.871	3.411	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)/C=C\c1ccco1	ZINC001133516167	1376051583	/nfs/dbraw/zinc/05/15/83/1376051583.db2.gz	XAGTVFLGBWYLQT-ZSBJFDRYSA-N	0	3	341.249	3.074	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)c1ccc(F)cc1	ZINC001133550473	1376080239	/nfs/dbraw/zinc/08/02/39/1376080239.db2.gz	PZNNDXZDIXVVHF-NEPJUHHUSA-N	0	3	343.240	3.221	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)c1ccccc1C	ZINC001133554273	1376082556	/nfs/dbraw/zinc/08/25/56/1376082556.db2.gz	AAWUVTGAAPTFES-KBPBESRZSA-N	0	3	339.277	3.390	20	30		EGEDHN
C#CCCN(CCCNC(=O)c1ccc(C)s1)Cc1cccnc1	ZINC001230652994	1376116063	/nfs/dbraw/zinc/11/60/63/1376116063.db2.gz	JWXZTYBOXXUCAL-UHFFFAOYSA-N	0	3	341.480	3.097	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)C[C@H](C)SC)Cc1cccnc1	ZINC001230733997	1376136706	/nfs/dbraw/zinc/13/67/06/1376136706.db2.gz	COBKSMGZVVCNNV-INIZCTEOSA-N	0	3	335.517	3.108	20	30		EGEDHN
C=C(C)CCC(=O)NCCCN(Cc1cccnc1)C[C@H](CC)OC	ZINC001230771309	1376147808	/nfs/dbraw/zinc/14/78/08/1376147808.db2.gz	DIDIAWASCLXEBE-IBGZPJMESA-N	0	3	347.503	3.171	20	30		EGEDHN
C#CCCN(CCCNC(=O)C1(CC(C)C)CC1)Cc1cccnc1	ZINC001230777925	1376150151	/nfs/dbraw/zinc/15/01/51/1376150151.db2.gz	GCDBPJFFCDWYPS-UHFFFAOYSA-N	0	3	341.499	3.240	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)c1ccc(Cl)o1	ZINC001133682714	1376151185	/nfs/dbraw/zinc/15/11/85/1376151185.db2.gz	CABNBYBOOXGVCS-ZJUUUORDSA-N	0	3	349.656	3.328	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCCN(Cc1cccnc1)[C@@H](C)COC	ZINC001230859595	1376166718	/nfs/dbraw/zinc/16/67/18/1376166718.db2.gz	GHTATWYXKUCSEH-KRWDZBQOSA-N	0	3	347.503	3.027	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)CCC1CC1)NCc1cc(F)ccc1C#N	ZINC001133960860	1376286400	/nfs/dbraw/zinc/28/64/00/1376286400.db2.gz	SJMPFOKNOFIADO-KBPBESRZSA-N	0	3	331.435	3.260	20	30		EGEDHN
C#Cc1cccc(CN2C[C@@H]3CCN(C(=O)OC(C)(C)C)[C@@H]3C2)c1	ZINC001231655712	1376295538	/nfs/dbraw/zinc/29/55/38/1376295538.db2.gz	BHLNJKHIIFDDRD-ZWKOTPCHSA-N	0	3	326.440	3.109	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)CC1CCC1)NCc1cc(F)ccc1C#N	ZINC001134027129	1376318495	/nfs/dbraw/zinc/31/84/95/1376318495.db2.gz	ZCFQBXLYZJZEKM-KBPBESRZSA-N	0	3	331.435	3.260	20	30		EGEDHN
C#CCCCCC(=O)N[C@H](C)C[C@H](C)NCc1nc2ccccc2o1	ZINC001134115216	1376375513	/nfs/dbraw/zinc/37/55/13/1376375513.db2.gz	QLQKXIQBFOKVDR-JKSUJKDBSA-N	0	3	341.455	3.394	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](C)C[C@@H](C)NCc2cc(F)ccc2C#N)co1	ZINC001134176452	1376400266	/nfs/dbraw/zinc/40/02/66/1376400266.db2.gz	BDGPHJBWYRRXNI-CHWSQXEVSA-N	0	3	343.402	3.286	20	30		EGEDHN
C#CCCCC(=O)N[C@H](C)C[C@@H](C)NCc1cc(O)ccc1Cl	ZINC001134206416	1376417727	/nfs/dbraw/zinc/41/77/27/1376417727.db2.gz	UNPOSWXYODBKJF-ZIAGYGMSSA-N	0	3	336.863	3.222	20	30		EGEDHN
C#CCCCC(=O)N[C@@H](C)C[C@H](C)NCc1nc2ccc(F)cc2o1	ZINC001134206457	1376418318	/nfs/dbraw/zinc/41/83/18/1376418318.db2.gz	VEMGMUSXXMQIDJ-KBPBESRZSA-N	0	3	345.418	3.143	20	30		EGEDHN
CCc1occc1C(=O)N[C@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001134273444	1376448700	/nfs/dbraw/zinc/44/87/00/1376448700.db2.gz	GHEBMFHDSFZDRR-LSDHHAIUSA-N	0	3	339.439	3.400	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H](C)C[C@H](C)NCc1nc(C(C)(C)C)cs1	ZINC001134316849	1376471981	/nfs/dbraw/zinc/47/19/81/1376471981.db2.gz	BWOTZFFZAKIEQP-GJZGRUSLSA-N	0	3	349.544	3.473	20	30		EGEDHN
COc1cccc(Cl)c1CN[C@@H](C)C[C@H](C)NC(=O)C#CC1CC1	ZINC001134322680	1376475425	/nfs/dbraw/zinc/47/54/25/1376475425.db2.gz	VJJKEPGOOXZJOB-KBPBESRZSA-N	0	3	348.874	3.135	20	30		EGEDHN
CN(Cc1ccccc1F)C1CCN(Cc2cccc(C#N)n2)CC1	ZINC001232926636	1376538548	/nfs/dbraw/zinc/53/85/48/1376538548.db2.gz	XJHRQQZGNIISSK-UHFFFAOYSA-N	0	3	338.430	3.189	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CCN(Cc3cc(C)ns3)CC2)CC1	ZINC001233309555	1376608961	/nfs/dbraw/zinc/60/89/61/1376608961.db2.gz	OQOCMLOPWAWJMI-UHFFFAOYSA-N	0	3	349.500	3.452	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)C[C@H](C)NCc2nc(C)sc2C)CCC1	ZINC001134592390	1376614369	/nfs/dbraw/zinc/61/43/69/1376614369.db2.gz	CSWXPHWNATZJKT-UONOGXRCSA-N	0	3	347.528	3.326	20	30		EGEDHN
C[C@@H](CC1CCCCC1)C(=O)NCCNCc1ccc(C#N)s1	ZINC001134678306	1376651493	/nfs/dbraw/zinc/65/14/93/1376651493.db2.gz	VLYHJFPMWFRDQE-AWEZNQCLSA-N	0	3	333.501	3.432	20	30		EGEDHN
Cc1cc(C)c(C(=O)N[C@H](C)C[C@@H](C)NCc2ccccc2C#N)[nH]1	ZINC001134757146	1376702964	/nfs/dbraw/zinc/70/29/64/1376702964.db2.gz	UNNUPDWIVHAULC-GDBMZVCRSA-N	0	3	338.455	3.190	20	30		EGEDHN
CCCCC[C@@H](C)CC(=O)NCCNCc1ccc(OC)c(C#N)c1	ZINC001134824024	1376743513	/nfs/dbraw/zinc/74/35/13/1376743513.db2.gz	KSNVDNVDCJXLGV-MRXNPFEDSA-N	0	3	345.487	3.379	20	30		EGEDHN
C#CCCCC(=O)N(C)C[C@H]1CCN1[C@H](CCOC)c1ccccc1	ZINC001233967258	1376745228	/nfs/dbraw/zinc/74/52/28/1376745228.db2.gz	YFPZTXAMBASDPX-WOJBJXKFSA-N	0	3	342.483	3.100	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)N(C)C[C@@H]1CCN1Cc1ccccc1C(C)C	ZINC001233978032	1376747910	/nfs/dbraw/zinc/74/79/10/1376747910.db2.gz	QLDWEJDAYIBBAW-RXVVDRJESA-N	0	3	344.499	3.170	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N(C)C[C@@H]2CCN2CCC2CC2)cc1	ZINC001234255656	1376793638	/nfs/dbraw/zinc/79/36/38/1376793638.db2.gz	OXTHVSWUGXRQOC-IBGZPJMESA-N	0	3	340.467	3.035	20	30		EGEDHN
C=CCCCN1CC[C@@H]1CN(C)C(=O)[C@](C)(OC)c1ccccc1F	ZINC001235125071	1376855137	/nfs/dbraw/zinc/85/51/37/1376855137.db2.gz	VCDCVUCRYMKXKL-OXQOHEQNSA-N	0	3	348.462	3.186	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)C1(C2CC2)CCC1	ZINC001135086852	1376888391	/nfs/dbraw/zinc/88/83/91/1376888391.db2.gz	LKMDSIDAORCBBO-CHWSQXEVSA-N	0	3	343.309	3.348	20	30		EGEDHN
C[C@H](C(=O)NCCNCc1ccc(C#N)c(F)c1)[C@H](C)C(C)(C)C	ZINC001135177677	1376951193	/nfs/dbraw/zinc/95/11/93/1376951193.db2.gz	KAPRVRBADYHBRF-KBPBESRZSA-N	0	3	333.451	3.221	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)c2ccc3c(c2)C=CCC3)ccc1F	ZINC001135196873	1376968803	/nfs/dbraw/zinc/96/88/03/1376968803.db2.gz	MWDVMMQVPMRCCH-UHFFFAOYSA-N	0	3	349.409	3.176	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H](C)C[C@@H](C)NCc1nc2ccccc2n1C	ZINC001135231236	1376990998	/nfs/dbraw/zinc/99/09/98/1376990998.db2.gz	YDWTYBPHSBAIRN-CABCVRRESA-N	0	3	342.487	3.158	20	30		EGEDHN
Cc1nc(C(=O)N[C@@H](C)C[C@H](C)NCc2ccccc2C#N)cs1	ZINC001135275395	1377016933	/nfs/dbraw/zinc/01/69/33/1377016933.db2.gz	XIPFSHSANZBTAC-STQMWFEESA-N	0	3	342.468	3.010	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)C1(C)CC=CC1	ZINC001135410773	1377080156	/nfs/dbraw/zinc/08/01/56/1377080156.db2.gz	GDBQPYINBKRLQT-QWHCGFSZSA-N	0	3	329.282	3.124	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](C)C[C@@H](C)NCc2conc2CC)CC1	ZINC001135416137	1377083340	/nfs/dbraw/zinc/08/33/40/1377083340.db2.gz	QUMVFJRXPPUHBR-CABCVRRESA-N	0	3	333.476	3.356	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)[C@@H](C)c2ccc(F)c(F)c2)C1	ZINC001264438992	1377143354	/nfs/dbraw/zinc/14/33/54/1377143354.db2.gz	HTJJSBOOFRMCEK-OBJOEFQTSA-N	0	3	342.817	3.305	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H](C)C[C@H](C)NCc1nccn1C(F)F	ZINC001135562374	1377145955	/nfs/dbraw/zinc/14/59/55/1377145955.db2.gz	YIDUKPONMZNCRT-QWHCGFSZSA-N	0	3	342.434	3.253	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1ccc2cc(C)ccc2n1	ZINC001266158535	1377210746	/nfs/dbraw/zinc/21/07/46/1377210746.db2.gz	QANGBZQRJWRVOS-AWEZNQCLSA-N	0	3	331.847	3.394	20	30		EGEDHN
C=CCN1C(=O)CCC[C@@]12CCCN(Cc1ccc3c(c1)COC3)C2	ZINC001137023586	1377459694	/nfs/dbraw/zinc/45/96/94/1377459694.db2.gz	WIPNTCRHXKVNOX-NRFANRHFSA-N	0	3	340.467	3.250	20	30		EGEDHN
N#Cc1ccccc1O[C@@H]1CCCN(Cc2ccc3[nH]cnc3c2)C1	ZINC001137047728	1377465912	/nfs/dbraw/zinc/46/59/12/1377465912.db2.gz	IMRKFCBZJJPQPU-QGZVFWFLSA-N	0	3	332.407	3.478	20	30		EGEDHN
N#Cc1ccccc1O[C@@H]1CCCN(Cc2ccc3nc[nH]c3c2)C1	ZINC001137047728	1377465913	/nfs/dbraw/zinc/46/59/13/1377465913.db2.gz	IMRKFCBZJJPQPU-QGZVFWFLSA-N	0	3	332.407	3.478	20	30		EGEDHN
CCOC(=O)C1(C(C)C)CCN(Cc2ccc(OCC#N)cc2)CC1	ZINC001137122768	1377481919	/nfs/dbraw/zinc/48/19/19/1377481919.db2.gz	RFKKNRFXOZIHLU-UHFFFAOYSA-N	0	3	344.455	3.390	20	30		EGEDHN
Cc1ccnc(O[C@@H]2CCCN(Cc3ccc(OCC#N)cc3)C2)c1	ZINC001137122559	1377482141	/nfs/dbraw/zinc/48/21/41/1377482141.db2.gz	HHBVZJUDEAGGGN-LJQANCHMSA-N	0	3	337.423	3.336	20	30		EGEDHN
CCC#CC(=O)N1CCC[C@]2(CN(C[C@@H](CC)CCCC)CCO2)C1	ZINC001268951562	1377532326	/nfs/dbraw/zinc/53/23/26/1377532326.db2.gz	VPTXBBOTXYRNCM-FPOVZHCZSA-N	0	3	348.531	3.310	20	30		EGEDHN
O=C1C=C2CN(Cc3ccc(F)c(Br)c3)CCC2S1	ZINC001137553204	1377565050	/nfs/dbraw/zinc/56/50/50/1377565050.db2.gz	CRVRQPRPWZKDIB-ZDUSSCGKSA-N	0	3	342.233	3.362	20	30		EGEDHN
O=C1C=C2CN(Cc3ccc(F)cc3Br)CCC2S1	ZINC001137545361	1377564059	/nfs/dbraw/zinc/56/40/59/1377564059.db2.gz	KMAGVNORGSJXBQ-CYBMUJFWSA-N	0	3	342.233	3.362	20	30		EGEDHN
C#CCOc1ccc(CN2CCC[C@](O)(C(F)(F)F)[C@H](C)C2)cc1	ZINC001138556007	1377741689	/nfs/dbraw/zinc/74/16/89/1377741689.db2.gz	AUSNMSNNCQSSKF-RHSMWYFYSA-N	0	3	341.373	3.224	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@@H](CNC(=O)OC(C)(C)C)C2)c1[O-]	ZINC001138629037	1377756878	/nfs/dbraw/zinc/75/68/78/1377756878.db2.gz	LXYCKRWYSMCUKB-HNNXBMFYSA-N	0	3	346.471	3.467	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@@H](CNC(=O)OC(C)(C)C)C2)c1[O-]	ZINC001138629037	1377756879	/nfs/dbraw/zinc/75/68/79/1377756879.db2.gz	LXYCKRWYSMCUKB-HNNXBMFYSA-N	0	3	346.471	3.467	20	30		EGEDHN
C=C(C)COc1ccccc1CN1CCC[C@@]2(CCN(CC)C2=O)C1	ZINC001138664681	1377765244	/nfs/dbraw/zinc/76/52/44/1377765244.db2.gz	UVCAUEFPDLXFGS-OAQYLSRUSA-N	0	3	342.483	3.476	20	30		EGEDHN
N#Cc1ccc(N2CCN(Cc3ccc(-n4ccnc4)cc3)CC2)cc1	ZINC001139360373	1377874324	/nfs/dbraw/zinc/87/43/24/1377874324.db2.gz	QCPPSJSPHBLLIV-UHFFFAOYSA-N	0	3	343.434	3.066	20	30		EGEDHN
CCC(=O)N[C@@H]1CCCN(Cc2ccc(-c3cc(C#N)ccn3)cc2)C1	ZINC001139406242	1377880264	/nfs/dbraw/zinc/88/02/64/1377880264.db2.gz	NVHZEXHUDBTMOB-LJQANCHMSA-N	0	3	348.450	3.111	20	30		EGEDHN
N#Cc1cccc2c(CN3CC[C@@H](N4CCCCC4)[C@@H](F)C3)c[nH]c21	ZINC001139707837	1377939183	/nfs/dbraw/zinc/93/91/83/1377939183.db2.gz	VNLJNKUFUAYOFS-RBUKOAKNSA-N	0	3	340.446	3.438	20	30		EGEDHN
CC(=O)N1CCCC[C@]12CCCN(Cc1ccc(C)c(C#N)c1)C2	ZINC001139724365	1377941635	/nfs/dbraw/zinc/94/16/35/1377941635.db2.gz	QAFXASYBASTXFY-HXUWFJFHSA-N	0	3	325.456	3.234	20	30		EGEDHN
C=CCn1cc(CN2CCc3ncnc(-c4ccccc4)c3CC2)cn1	ZINC001139771749	1377948877	/nfs/dbraw/zinc/94/88/77/1377948877.db2.gz	NLFKKZLBVMCMHS-UHFFFAOYSA-N	0	3	345.450	3.127	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@@H]1CCN(Cc1ccc(O)cc1F)C2	ZINC001140127305	1378013866	/nfs/dbraw/zinc/01/38/66/1378013866.db2.gz	YWPVSZKEWHDWIQ-RTBURBONSA-N	0	3	335.419	3.105	20	30		EGEDHN
C=CCOCc1ncn2c1CN(Cc1c(C)ccc(C)c1O)CCC2	ZINC001140181194	1378027454	/nfs/dbraw/zinc/02/74/54/1378027454.db2.gz	PNJWOUHDGUKQHP-UHFFFAOYSA-N	0	3	341.455	3.314	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCCC[C@]23CC(=O)N(CC=C)C3)c1[O-]	ZINC001273360854	1378099184	/nfs/dbraw/zinc/09/91/84/1378099184.db2.gz	WPVCUGPSAQWTAT-OAQYLSRUSA-N	0	3	340.467	3.264	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCCC[C@]23CC(=O)N(CC=C)C3)c1[O-]	ZINC001273360854	1378099187	/nfs/dbraw/zinc/09/91/87/1378099187.db2.gz	WPVCUGPSAQWTAT-OAQYLSRUSA-N	0	3	340.467	3.264	20	30		EGEDHN
C=CCN1CC[C@]2(CCC[N@H+]2Cc2c([O-])ccc3ccccc32)C1=O	ZINC001273769016	1378110399	/nfs/dbraw/zinc/11/03/99/1378110399.db2.gz	DULQRONOMXQDJN-OAQYLSRUSA-N	0	3	336.435	3.298	20	30		EGEDHN
C=CCN1CC[C@]2(CCC[N@@H+]2Cc2c([O-])ccc3ccccc32)C1=O	ZINC001273769016	1378110400	/nfs/dbraw/zinc/11/04/00/1378110400.db2.gz	DULQRONOMXQDJN-OAQYLSRUSA-N	0	3	336.435	3.298	20	30		EGEDHN
CC[C@H](C)N1CC[C@@]2(CCN(Cc3ccc(C#N)c(Cl)c3)C2)C1=O	ZINC001274492932	1378128272	/nfs/dbraw/zinc/12/82/72/1378128272.db2.gz	XHTNMHWWYGMOEP-IFXJQAMLSA-N	0	3	345.874	3.435	20	30		EGEDHN
N#Cc1cccc(N2CCC[C@]3(CCCN(Cc4cn[nH]c4)C3)C2)c1	ZINC001276953011	1378196817	/nfs/dbraw/zinc/19/68/17/1378196817.db2.gz	FCULZGAMDMNDEP-FQEVSTJZSA-N	0	3	335.455	3.164	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CC3(C[C@@H]3C(=O)N(CC)C(C)C)C2)c1[O-]	ZINC001277463381	1378223848	/nfs/dbraw/zinc/22/38/48/1378223848.db2.gz	KGOULQZGXADQNJ-GOSISDBHSA-N	0	3	342.483	3.200	20	30		EGEDHN
C=CCc1cccc(CN2CC3(C[C@@H]3C(=O)N(CC)C(C)C)C2)c1O	ZINC001277463381	1378223853	/nfs/dbraw/zinc/22/38/53/1378223853.db2.gz	KGOULQZGXADQNJ-GOSISDBHSA-N	0	3	342.483	3.200	20	30		EGEDHN
CCCCN1CCN(Cc2ccc(Br)cc2C#N)CC1	ZINC001141813389	1378381231	/nfs/dbraw/zinc/38/12/31/1378381231.db2.gz	LJQWLJLNEUQIHW-UHFFFAOYSA-N	0	3	336.277	3.238	20	30		EGEDHN
C=CCOC[C@H]1CCC[C@@]12CN(Cc1cccc3nc[nH]c31)CCO2	ZINC001142682762	1378475494	/nfs/dbraw/zinc/47/54/94/1378475494.db2.gz	HSPJQKIMWRFMCZ-YLJYHZDGSA-N	0	3	341.455	3.137	20	30		EGEDHN
O=C(C#Cc1ccccc1)NCCN1CCC(Cc2ccccc2)CC1	ZINC001142861682	1378497602	/nfs/dbraw/zinc/49/76/02/1378497602.db2.gz	ZHQZZZMCEMKWJX-UHFFFAOYSA-N	0	3	346.474	3.109	20	30		EGEDHN
N#Cc1ccc2c(CN3CCC4(CC(F)(F)CO4)CC3)c[nH]c2c1	ZINC001142916703	1378508262	/nfs/dbraw/zinc/50/82/62/1378508262.db2.gz	XRUHSLQEFSVCOI-UHFFFAOYSA-N	0	3	331.366	3.430	20	30		EGEDHN
C=CCOC[C@]12CCCO[C@@H]1CCN(Cc1cccc(F)c1OC)C2	ZINC001143524366	1378608591	/nfs/dbraw/zinc/60/85/91/1378608591.db2.gz	QBVOGPYLDXRDIG-UYAOXDASSA-N	0	3	349.446	3.408	20	30		EGEDHN
CCOc1cc(F)c(CN2CCC3SC(=O)C=C3C2)c(F)c1	ZINC001143568707	1378618503	/nfs/dbraw/zinc/61/85/03/1378618503.db2.gz	HTYOGIMXAQZCAW-HNNXBMFYSA-N	0	3	325.380	3.138	20	30		EGEDHN
CCOc1c(F)cc(CN2CCC3SC(=O)C=C3C2)cc1F	ZINC001144016777	1378671404	/nfs/dbraw/zinc/67/14/04/1378671404.db2.gz	IETMOIPZSCDIBF-CQSZACIVSA-N	0	3	325.380	3.138	20	30		EGEDHN
C#Cc1ccc(CN2CCC[C@@]3(C[C@@H](Oc4ccccn4)CO3)C2)cc1	ZINC001144573601	1378746858	/nfs/dbraw/zinc/74/68/58/1378746858.db2.gz	MPRALMQHZRMOMP-IFMALSPDSA-N	0	3	348.446	3.265	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cccc3ccsc32)cc1	ZINC001146648951	1378888345	/nfs/dbraw/zinc/88/83/45/1378888345.db2.gz	BBUUNPUXRNEYLT-UHFFFAOYSA-N	0	3	335.432	3.293	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C[C@H](C)NCc2conc2C)CCCC1	ZINC001146823389	1378929089	/nfs/dbraw/zinc/92/90/89/1378929089.db2.gz	ZAXYFOLPFBUAAG-LSDHHAIUSA-N	0	3	333.476	3.492	20	30		EGEDHN
CC(C)[C@H](C)CC(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001147244154	1378995939	/nfs/dbraw/zinc/99/59/39/1378995939.db2.gz	CEJLYRQBYNJVNU-QGZVFWFLSA-N	0	3	339.483	3.275	20	30		EGEDHN
C#CCCCCC(=O)N1CC2(C1)CCN(CCc1ccccc1F)C2	ZINC001147374765	1379011737	/nfs/dbraw/zinc/01/17/37/1379011737.db2.gz	SSMIKYQDQJMPNR-UHFFFAOYSA-N	0	3	342.458	3.096	20	30		EGEDHN
C#CCCCC(=O)N1CC2(C1)CCN(CCCCC(F)(F)F)C2	ZINC001147427960	1379018204	/nfs/dbraw/zinc/01/82/04/1379018204.db2.gz	FHTQIHBRCDBEAW-UHFFFAOYSA-N	0	3	330.394	3.057	20	30		EGEDHN
C[C@@H](CN(C)C(=O)c1ccccc1F)NCc1ccc(C#N)s1	ZINC001283567326	1379024875	/nfs/dbraw/zinc/02/48/75/1379024875.db2.gz	SYBWXUCMIFXGKC-LBPRGKRZSA-N	0	3	331.416	3.009	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)N1CC2(C1)CCN(Cc1sc(C)nc1C)C2	ZINC001148137974	1379123569	/nfs/dbraw/zinc/12/35/69/1379123569.db2.gz	KHUUJEFOZXEIHF-KBPBESRZSA-N	0	3	347.528	3.252	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001148146219	1379124744	/nfs/dbraw/zinc/12/47/44/1379124744.db2.gz	AOQUVMPOXSCRRI-QGZVFWFLSA-N	0	3	337.467	3.195	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H](c3ccccc3)[C@H](C)CC)C2)C1	ZINC001148726429	1379254286	/nfs/dbraw/zinc/25/42/86/1379254286.db2.gz	HZXBEYXWYCAWAK-QUCCMNQESA-N	0	3	338.495	3.374	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)CCCc3cc(C)ccc3C)C2)C1	ZINC001148818887	1379275787	/nfs/dbraw/zinc/27/57/87/1379275787.db2.gz	JUOWNHNUZDNOPQ-UHFFFAOYSA-N	0	3	338.495	3.184	20	30		EGEDHN
CCCCCCCCCC(=O)NCCNCc1ccc(C(N)=O)cc1	ZINC001148821214	1379276335	/nfs/dbraw/zinc/27/63/35/1379276335.db2.gz	XTAAKLPBWBKJPZ-UHFFFAOYSA-N	0	3	347.503	3.132	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cc(F)c(F)cc2Cl)cc1	ZINC001149735480	1379437726	/nfs/dbraw/zinc/43/77/26/1379437726.db2.gz	UUHKRCHWEIHTRU-UHFFFAOYSA-N	0	3	349.768	3.009	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@H]1CN(Cc2cccc(CC)c2)CCCO1	ZINC001149789904	1379446954	/nfs/dbraw/zinc/44/69/54/1379446954.db2.gz	RSRZZJMWVQVKDL-FQEVSTJZSA-N	0	3	344.499	3.312	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)C/C=C\c2ccc(F)cc2)C1	ZINC001149882165	1379459019	/nfs/dbraw/zinc/45/90/19/1379459019.db2.gz	YGERIKSZWAHBES-SIEMBAAWSA-N	0	3	346.446	3.012	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2cc3c(s2)CCCC3)s1	ZINC001150003884	1379482974	/nfs/dbraw/zinc/48/29/74/1379482974.db2.gz	PYFFNNVWTDERAP-UHFFFAOYSA-N	0	3	345.493	3.080	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)c2sccc2C2CC2)ccc1F	ZINC001150034227	1379486777	/nfs/dbraw/zinc/48/67/77/1379486777.db2.gz	JHSLIHNPZZYSDV-UHFFFAOYSA-N	0	3	343.427	3.156	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H]1CN(Cc2ccc(C)cc2)CCCO1	ZINC001150224401	1379518603	/nfs/dbraw/zinc/51/86/03/1379518603.db2.gz	LBCUQWDJAQZMTC-LJQANCHMSA-N	0	3	330.472	3.058	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@H]2CN(Cc3ccccc3C)CCCO2)C1	ZINC001150283254	1379528596	/nfs/dbraw/zinc/52/85/96/1379528596.db2.gz	SLBAJFRNSMBXBP-IBGZPJMESA-N	0	3	342.483	3.058	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)C[C@H](C)c2cccc(F)c2)C1	ZINC001150282675	1379528897	/nfs/dbraw/zinc/52/88/97/1379528897.db2.gz	PHXGUXHKBHPZBR-LPHOPBHVSA-N	0	3	348.462	3.103	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@@H]1CN(Cc2ccc(C)cc2)CCCO1	ZINC001150380281	1379542435	/nfs/dbraw/zinc/54/24/35/1379542435.db2.gz	QTVYLNUSTSFKHD-LJQANCHMSA-N	0	3	344.499	3.304	20	30		EGEDHN
C#CCCN1CCCO[C@H](CNC(=O)C[C@H](C)CCCCCC)C1	ZINC001150579542	1379572337	/nfs/dbraw/zinc/57/23/37/1379572337.db2.gz	NJQMYIIFKBWTPG-RTBURBONSA-N	0	3	336.520	3.213	20	30		EGEDHN
CC(C)Cc1ccc(C(=O)NCCNCc2ccc(C#N)cc2)cc1	ZINC001150597037	1379576301	/nfs/dbraw/zinc/57/63/01/1379576301.db2.gz	JPQMLKCBVNNPAV-UHFFFAOYSA-N	0	3	335.451	3.276	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@H]2CCC[C@H]2CCC)CC1	ZINC001151210245	1379677564	/nfs/dbraw/zinc/67/75/64/1379677564.db2.gz	RWCVCDRYQSAJJU-MSOLQXFVSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2ccc(C=C)cc2)CC1	ZINC001151345946	1379702444	/nfs/dbraw/zinc/70/24/44/1379702444.db2.gz	LAVRDXBCSFZCLJ-UHFFFAOYSA-N	0	3	328.456	3.117	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@H](C)c2cc(C)oc2C)CC1	ZINC001151356933	1379705273	/nfs/dbraw/zinc/70/52/73/1379705273.db2.gz	JWNMVGYBCYRSRJ-MRXNPFEDSA-N	0	3	348.487	3.173	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@H]2C[C@H]2C2CCCC2)CC1	ZINC001151374513	1379707157	/nfs/dbraw/zinc/70/71/57/1379707157.db2.gz	JFIRKCBIDQHMCL-OALUTQOASA-N	0	3	348.531	3.376	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@@H]2CCCC[C@H]2CC)CC1	ZINC001151382132	1379709529	/nfs/dbraw/zinc/70/95/29/1379709529.db2.gz	YJJRBZMSZQOFKT-QZTJIDSGSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2ccoc2CCC)CC1	ZINC001151392054	1379710163	/nfs/dbraw/zinc/71/01/63/1379710163.db2.gz	BICHHHOVAFXJDC-UHFFFAOYSA-N	0	3	334.460	3.019	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@@H](C)c2ccc(C)cc2)CC1	ZINC001151399126	1379710998	/nfs/dbraw/zinc/71/09/98/1379710998.db2.gz	PPQSMYDJJZCJSL-SFHVURJKSA-N	0	3	344.499	3.272	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2ccc(CC)cc2)CC1	ZINC001151405927	1379712410	/nfs/dbraw/zinc/71/24/10/1379712410.db2.gz	OQOCFSCUQIVRMO-UHFFFAOYSA-N	0	3	330.472	3.036	20	30		EGEDHN
C=C[C@H](CC(=O)NCCNCc1ccc(C#N)s1)c1ccccc1	ZINC001151942496	1379821272	/nfs/dbraw/zinc/82/12/72/1379821272.db2.gz	IEWLQXLWNDFCRN-OAHLLOKOSA-N	0	3	339.464	3.185	20	30		EGEDHN
O=C(CC#Cc1ccccc1)NCCNCc1ccc(Cl)c(F)c1	ZINC001151952835	1379824526	/nfs/dbraw/zinc/82/45/26/1379824526.db2.gz	JCNNJPONVIQXCW-UHFFFAOYSA-N	0	3	344.817	3.127	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)/C=C\C(C)(C)C	ZINC001152425780	1379931379	/nfs/dbraw/zinc/93/13/79/1379931379.db2.gz	ADSLJLHWKZPFKV-BLIJAFNYSA-N	0	3	327.472	3.487	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)/C=C\C(C)(C)C	ZINC001152426074	1379932012	/nfs/dbraw/zinc/93/20/12/1379932012.db2.gz	KEXPTPJKCVSYMG-YUQCYMQKSA-N	0	3	327.472	3.487	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)CCCC2CCCC2)ccc1F	ZINC001152684348	1379970174	/nfs/dbraw/zinc/97/01/74/1379970174.db2.gz	LQZTZQQHNCMTRA-UHFFFAOYSA-N	0	3	331.435	3.264	20	30		EGEDHN
CCC[C@@H](CC(C)C)C(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001152875351	1379989159	/nfs/dbraw/zinc/98/91/59/1379989159.db2.gz	CEQDCXYYFRRSTJ-INIZCTEOSA-N	0	3	333.451	3.366	20	30		EGEDHN
C[C@H]1CCCC[C@H]1CC(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001153255322	1380045649	/nfs/dbraw/zinc/04/56/49/1380045649.db2.gz	ZNCXIDWRVJYREX-HOCLYGCPSA-N	0	3	331.435	3.120	20	30		EGEDHN
CCN(Cc1ccc(C)nc1C)[C@H](C)CNC(=O)C#CC(C)(C)C	ZINC001153281488	1380048097	/nfs/dbraw/zinc/04/80/97/1380048097.db2.gz	PYJKHZRBQZFHSB-MRXNPFEDSA-N	0	3	329.488	3.075	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)C#CC(C)(C)C	ZINC001153281560	1380048552	/nfs/dbraw/zinc/04/85/52/1380048552.db2.gz	UDQSZQWCMMBYKZ-OAHLLOKOSA-N	0	3	343.446	3.073	20	30		EGEDHN
C#CCN(CC)[C@H](C)CNC(=O)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC001153424779	1380075151	/nfs/dbraw/zinc/07/51/51/1380075151.db2.gz	PGPSPPAMWBZNGB-WNZFAQLISA-N	0	3	344.421	3.061	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@@H](C)N(CC)Cc1ccc(F)cc1	ZINC001153831112	1380139677	/nfs/dbraw/zinc/13/96/77/1380139677.db2.gz	VSVAHCVUHYAROI-MRXNPFEDSA-N	0	3	343.446	3.454	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1cc(C2CC2)[nH]c1C1CC1	ZINC001154004713	1380176095	/nfs/dbraw/zinc/17/60/95/1380176095.db2.gz	CBQWICGOZFJKNM-CQSZACIVSA-N	0	3	327.472	3.233	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)CCC2CCCC2)c1	ZINC001154278012	1380245199	/nfs/dbraw/zinc/24/51/99/1380245199.db2.gz	JFPOYKQMRYNGEA-UHFFFAOYSA-N	0	3	331.435	3.264	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@@H](C)N(CC)Cc1cccc(C#N)c1	ZINC001154742349	1380343944	/nfs/dbraw/zinc/34/39/44/1380343944.db2.gz	DKPGSNUIKXAEOM-DLBZAZTESA-N	0	3	327.472	3.487	20	30		EGEDHN
CCN(Cc1ccc(F)c(C#N)c1)[C@H](C)CNC(=O)[C@H]1C[C@H]2C[C@H]2C1	ZINC001154768069	1380348129	/nfs/dbraw/zinc/34/81/29/1380348129.db2.gz	JUVPOIANIRAFOU-SIXLDLHFSA-N	0	3	343.446	3.070	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@H](C)N(CC)C[C@@H](O)c2ccc(F)cc2)C1	ZINC001155126091	1380413611	/nfs/dbraw/zinc/41/36/11/1380413611.db2.gz	CMFZJQZSWTXVOR-CRAIPNDOSA-N	0	3	348.462	3.042	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1ccccc1OC1CCC1	ZINC001155160389	1380417584	/nfs/dbraw/zinc/41/75/84/1380417584.db2.gz	DFORJEVDGIWPDT-MRXNPFEDSA-N	0	3	328.456	3.081	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@H](C)Cc1ccccc1Cl	ZINC001155564272	1380469405	/nfs/dbraw/zinc/46/94/05/1380469405.db2.gz	SEUAJFKCZAQFIG-HZPDHXFCSA-N	0	3	334.891	3.369	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@@H](CC)Oc1cccc(C)c1	ZINC001155770866	1380491164	/nfs/dbraw/zinc/49/11/64/1380491164.db2.gz	GYCDYFDKXFTAGN-IEBWSBKVSA-N	0	3	330.472	3.002	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1ccc(-c2ccccc2)nc1	ZINC001155985814	1380510408	/nfs/dbraw/zinc/51/04/08/1380510408.db2.gz	VHLLVTNVAYUACB-QGZVFWFLSA-N	0	3	335.451	3.212	20	30		EGEDHN
Cc1cc(CN)nn1-c1c(C#N)c(Cl)nc2ccc(F)c(C)c21	ZINC001156044013	1380516110	/nfs/dbraw/zinc/51/61/10/1380516110.db2.gz	GZCDSFNOEBBOSO-UHFFFAOYSA-N	0	3	329.766	3.160	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C(C)(C)c1ccc(CC)cc1	ZINC001156264001	1380550006	/nfs/dbraw/zinc/55/00/06/1380550006.db2.gz	FPAJTVGYUNZLPA-QGZVFWFLSA-N	0	3	328.500	3.377	20	30		EGEDHN
Cc1nc(-n2cncc2CNCc2ccccc2)c(Cl)cc1C#N	ZINC001156508602	1380585669	/nfs/dbraw/zinc/58/56/69/1380585669.db2.gz	HUHKYBDBJXSNBS-UHFFFAOYSA-N	0	3	337.814	3.391	20	30		EGEDHN
N#Cc1c(Cl)ncnc1NC[C@H](c1ccccc1)N1CCCC1	ZINC001156529251	1380588722	/nfs/dbraw/zinc/58/87/22/1380588722.db2.gz	FDHCMHRCASSKDQ-OAHLLOKOSA-N	0	3	327.819	3.251	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1ccn(C)c1CC	ZINC001755286512	1440802168	/nfs/dbraw/zinc/80/21/68/1440802168.db2.gz	SLHVKOAYYLSWOV-UHFFFAOYSA-N	0	3	325.884	3.028	20	30		EGEDHN
C#CCCCC(=O)NCCCNCc1cccc(Cl)c1Cl	ZINC001157170481	1380793491	/nfs/dbraw/zinc/79/34/91/1380793491.db2.gz	IOOLQEVRTBFIED-UHFFFAOYSA-N	0	3	327.255	3.393	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1ccc(Cl)o1	ZINC001157529355	1380957912	/nfs/dbraw/zinc/95/79/12/1380957912.db2.gz	YOBQUGKOFSBDQX-CQSZACIVSA-N	0	3	340.851	3.062	20	30		EGEDHN
N#Cc1cc(C(F)(F)N2CCN[C@H](c3ccccc3)C2)cnc1Cl	ZINC001157765410	1381027292	/nfs/dbraw/zinc/02/72/92/1381027292.db2.gz	QKKGPFIMAWGLKG-HNNXBMFYSA-N	0	3	348.784	3.302	20	30		EGEDHN
C[C@H]1C[C@@H]1c1ccc(C(=O)NCCCNCc2ccccc2C#N)o1	ZINC001157919265	1381070167	/nfs/dbraw/zinc/07/01/67/1381070167.db2.gz	PGHDCARULRQHMA-YOEHRIQHSA-N	0	3	337.423	3.184	20	30		EGEDHN
C[C@@H]1C[C@H]1c1ccc(C(=O)NCCCNCc2ccccc2C#N)o1	ZINC001157919263	1381070357	/nfs/dbraw/zinc/07/03/57/1381070357.db2.gz	PGHDCARULRQHMA-RHSMWYFYSA-N	0	3	337.423	3.184	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1cccc(F)c1C	ZINC001157982144	1381092456	/nfs/dbraw/zinc/09/24/56/1381092456.db2.gz	OWZPSCUXUNMBCQ-QGZVFWFLSA-N	0	3	348.462	3.263	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)[C@@H]1CCCC2(CC2)C1	ZINC001158002380	1381098897	/nfs/dbraw/zinc/09/88/97/1381098897.db2.gz	DHMFVGNBJBACLN-MRXNPFEDSA-N	0	3	325.456	3.125	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cnc(-c2ccccc2)o1	ZINC001158102055	1381128588	/nfs/dbraw/zinc/12/85/88/1381128588.db2.gz	VRMBWVHKVMOIJK-QGZVFWFLSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H]1CCc2cc(F)ccc21	ZINC001158233965	1381170757	/nfs/dbraw/zinc/17/07/57/1381170757.db2.gz	VGUQBODRTDAMGC-MJGOQNOKSA-N	0	3	330.447	3.354	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1noc2c1CC(C)(C)CC2	ZINC001158277433	1381182007	/nfs/dbraw/zinc/18/20/07/1381182007.db2.gz	SCRQBRITBGBPPZ-OAHLLOKOSA-N	0	3	345.487	3.302	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)[C@H]1CCCC1(C)C	ZINC001158322316	1381200596	/nfs/dbraw/zinc/20/05/96/1381200596.db2.gz	YLAOVEFXSITIBE-QZTJIDSGSA-N	0	3	336.520	3.328	20	30		EGEDHN
C[C@H](N)c1ccn(C(F)(F)c2cc(Cl)nc(Cl)c2C#N)n1	ZINC001158344364	1381209979	/nfs/dbraw/zinc/20/99/79/1381209979.db2.gz	AFYKEPQQHINECM-LURJTMIESA-N	0	3	332.141	3.074	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1cc[nH]c1C1CC1	ZINC001158405378	1381232567	/nfs/dbraw/zinc/23/25/67/1381232567.db2.gz	RGJNSSXVZHAWKV-QGZVFWFLSA-N	0	3	345.487	3.021	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1ccccc1CC	ZINC001158411151	1381235776	/nfs/dbraw/zinc/23/57/76/1381235776.db2.gz	AOXHZLMUWHNIHH-LJQANCHMSA-N	0	3	344.499	3.378	20	30		EGEDHN
C=CCCCC(=O)N1CCCC[C@@H]1CN(C)C[C@@H](O)c1ccccc1	ZINC001158419367	1381239212	/nfs/dbraw/zinc/23/92/12/1381239212.db2.gz	MSQBAUQKSMWTCH-WOJBJXKFSA-N	0	3	344.499	3.389	20	30		EGEDHN
CN1CCC(N(Cc2ccc(F)cc2)c2nccc(F)c2C#N)CC1	ZINC001158449242	1381249330	/nfs/dbraw/zinc/24/93/30/1381249330.db2.gz	XZVWTBBLLYXJNW-UHFFFAOYSA-N	0	3	342.393	3.332	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)Cc1cc(F)c(F)cc1F	ZINC001158518081	1381277957	/nfs/dbraw/zinc/27/79/57/1381277957.db2.gz	AEKXCGIFGLZBBV-CQSZACIVSA-N	0	3	340.389	3.145	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc2c(C)cccn2c1	ZINC001158732006	1381374466	/nfs/dbraw/zinc/37/44/66/1381374466.db2.gz	JUDKJYNEVZUMJA-GOSISDBHSA-N	0	3	325.456	3.360	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)C1CCC=CCC1	ZINC001158872629	1381444427	/nfs/dbraw/zinc/44/44/27/1381444427.db2.gz	SDQGKSMAGRXPNO-LJQANCHMSA-N	0	3	334.504	3.248	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N1CCCC[C@@H]1CN(C)Cc1cccc(F)c1	ZINC001158949245	1381480043	/nfs/dbraw/zinc/48/00/43/1381480043.db2.gz	HVYGGOYAIPSUCU-QFBILLFUSA-N	0	3	348.462	3.230	20	30		EGEDHN
CCOC(=O)[C@H]1CCCc2sc(NC3=CNCCC3)c(C#N)c21	ZINC001159167081	1381695842	/nfs/dbraw/zinc/69/58/42/1381695842.db2.gz	JCQFPNRNKNQWIF-LBPRGKRZSA-N	0	3	331.441	3.239	20	30		EGEDHN
C=C(C)CN(CCNC(=O)c1cccc(Cl)c1Cl)CCOC	ZINC001755841675	1440931712	/nfs/dbraw/zinc/93/17/12/1440931712.db2.gz	SWUICSTYCVUYNO-UHFFFAOYSA-N	0	3	345.270	3.248	20	30		EGEDHN
C[C@H](c1cccc(F)c1)N1CC=C(CCNC(=O)[C@@H](C)C#N)CC1	ZINC001159595437	1381842294	/nfs/dbraw/zinc/84/22/94/1381842294.db2.gz	YTAVVGWQJYBVDV-LSDHHAIUSA-N	0	3	329.419	3.185	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccc(CCC)s2)CC1	ZINC001160257845	1382052373	/nfs/dbraw/zinc/05/23/73/1382052373.db2.gz	GVLKANJPBPBTFE-UHFFFAOYSA-N	0	3	330.497	3.476	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H]2CCc3ccc(OC)cc32)CC1	ZINC001160368005	1382085185	/nfs/dbraw/zinc/08/51/85/1382085185.db2.gz	YMXWLHDJBVRRJW-IBGZPJMESA-N	0	3	340.467	3.049	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cccc([C@H]3CCOC3)c2)CC1	ZINC001160551267	1382139304	/nfs/dbraw/zinc/13/93/04/1382139304.db2.gz	IALOBRPHYGXMAR-FQEVSTJZSA-N	0	3	340.467	3.129	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)C[C@@H]2C=CCCC2)c(F)c1	ZINC001160802945	1382201723	/nfs/dbraw/zinc/20/17/23/1382201723.db2.gz	FLLYMYWVDJKAGL-OAHLLOKOSA-N	0	3	329.419	3.040	20	30		EGEDHN
C=CCN1CCC[C@H]1CNc1nc(Cl)nc2ccc([N+](=O)[O-])cc21	ZINC001160952984	1382250055	/nfs/dbraw/zinc/25/00/55/1382250055.db2.gz	LKRPIHTZMYEWDO-LBPRGKRZSA-N	0	3	347.806	3.254	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)CCCc2ccc(C)cc2)CC1	ZINC001161121755	1382308060	/nfs/dbraw/zinc/30/80/60/1382308060.db2.gz	TVMBKFHVGLCKQC-UHFFFAOYSA-N	0	3	338.495	3.479	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C(C)(C)c2cccc(F)c2)CC1	ZINC001161195508	1382337761	/nfs/dbraw/zinc/33/77/61/1382337761.db2.gz	XLBFLGOVZITUHB-UHFFFAOYSA-N	0	3	342.458	3.265	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)Cc2c[nH]c3cc(C)ccc23)CC1	ZINC001161452744	1382415267	/nfs/dbraw/zinc/41/52/67/1382415267.db2.gz	XGMMLARXZQIGSL-UHFFFAOYSA-N	0	3	337.467	3.343	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2csc(C(C)C)n2)CC1	ZINC001161478565	1382419083	/nfs/dbraw/zinc/41/90/83/1382419083.db2.gz	RHXBLXRXDAOMCP-UHFFFAOYSA-N	0	3	331.485	3.042	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C[C@H]2OCCc3ccccc32)CC1	ZINC001161733584	1382491432	/nfs/dbraw/zinc/49/14/32/1382491432.db2.gz	DXEMCYAKNQPXNS-HXUWFJFHSA-N	0	3	340.467	3.015	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C(C)(C)c2ccc(F)cc2)CC1	ZINC001161738194	1382492428	/nfs/dbraw/zinc/49/24/28/1382492428.db2.gz	ZSOQOEATRZKLJI-UHFFFAOYSA-N	0	3	342.458	3.265	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)CCc2cc(C)sc2C)CC1	ZINC001161968431	1382576626	/nfs/dbraw/zinc/57/66/26/1382576626.db2.gz	TZMIWBKPXYQOTH-UHFFFAOYSA-N	0	3	344.524	3.459	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C23CC(C(C)(C)C)(C2)C3)CC1	ZINC001161978050	1382584606	/nfs/dbraw/zinc/58/46/06/1382584606.db2.gz	LKLPKOMLZRFONI-UHFFFAOYSA-N	0	3	328.500	3.365	20	30		EGEDHN
Cc1cc(C(=O)NCCCNCc2cc(C#N)ccc2F)c(C)s1	ZINC001161978638	1382585162	/nfs/dbraw/zinc/58/51/62/1382585162.db2.gz	UTGJUSZMUDOLQO-UHFFFAOYSA-N	0	3	345.443	3.285	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H](C)Cc2ccc(F)cc2)CC1	ZINC001161983294	1382587593	/nfs/dbraw/zinc/58/75/93/1382587593.db2.gz	ZOJDTJKHSDJLIO-MRXNPFEDSA-N	0	3	330.447	3.329	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H](OC(C)C)c2ccccc2)CC1	ZINC001162026801	1382607288	/nfs/dbraw/zinc/60/72/88/1382607288.db2.gz	LRTQKCSBYGXRKE-HXUWFJFHSA-N	0	3	342.483	3.477	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)CC1CCCC1	ZINC001162678423	1382830706	/nfs/dbraw/zinc/83/07/06/1382830706.db2.gz	NVJBHQSDHKGWDJ-UHFFFAOYSA-N	0	3	326.484	3.251	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H](C)[C@@H](C)CC	ZINC001162964307	1382930011	/nfs/dbraw/zinc/93/00/11/1382930011.db2.gz	VTWZZPRQDFUJTC-OALUTQOASA-N	0	3	328.500	3.353	20	30		EGEDHN
CC(C)CC(=O)NCCC1(CNCc2ccc(C#N)cc2F)CC1	ZINC001163201485	1382992125	/nfs/dbraw/zinc/99/21/25/1382992125.db2.gz	GWKRLRNEMINCGU-UHFFFAOYSA-N	0	3	331.435	3.120	20	30		EGEDHN
N#Cc1ccccc1CNCC1(CCNC(=O)c2ccsc2)CC1	ZINC001163337198	1383025246	/nfs/dbraw/zinc/02/52/46/1383025246.db2.gz	HWHNMEHSGHAUGF-UHFFFAOYSA-N	0	3	339.464	3.310	20	30		EGEDHN
N#Cc1ccccc1CNCC1(CCNC(=O)C[C@H]2C=CCC2)CC1	ZINC001163369303	1383033974	/nfs/dbraw/zinc/03/39/74/1383033974.db2.gz	JHMSMHKFRGYQBS-KRWDZBQOSA-N	0	3	337.467	3.291	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1cc2ccsc2[nH]1	ZINC001163623391	1383091104	/nfs/dbraw/zinc/09/11/04/1383091104.db2.gz	YCQJBPNIINLSSW-UHFFFAOYSA-N	0	3	338.436	3.011	20	30		EGEDHN
CC/C=C(/C)C(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001163676638	1383103379	/nfs/dbraw/zinc/10/33/79/1383103379.db2.gz	GCWPSQXKVSQQKL-SOFYXZRVSA-N	0	3	325.456	3.291	20	30		EGEDHN
N#Cc1ccc(CNCC2(CCNC(=O)/C=C/C3CC3)CC2)c(F)c1	ZINC001163940529	1383137886	/nfs/dbraw/zinc/13/78/86/1383137886.db2.gz	NSXPZCMPZQDAMK-GQCTYLIASA-N	0	3	341.430	3.040	20	30		EGEDHN
C#CCCCCCC(=O)NCCCNCc1ccn(C2CCCC2)n1	ZINC001163963806	1383140518	/nfs/dbraw/zinc/14/05/18/1383140518.db2.gz	KUYUAFVGABDMQM-UHFFFAOYSA-N	0	3	344.503	3.178	20	30		EGEDHN
CC[C@@H](SC)C(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001164102402	1383156754	/nfs/dbraw/zinc/15/67/54/1383156754.db2.gz	LVQZJCBGYBZNDZ-QGZVFWFLSA-N	0	3	345.512	3.076	20	30		EGEDHN
CC1(C)CC(CC(=O)NCCCNCc2ccc(C#N)cc2F)C1	ZINC001164483598	1383191412	/nfs/dbraw/zinc/19/14/12/1383191412.db2.gz	PULIYGIWKOPBNI-UHFFFAOYSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=C(C)CCC(=O)NCCC1(CNCc2nc(C)c(C)s2)CC1	ZINC001165258628	1383259089	/nfs/dbraw/zinc/25/90/89/1383259089.db2.gz	IVMURVFIQBHFKJ-UHFFFAOYSA-N	0	3	335.517	3.492	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C[C@@H](OCC)C(C)C)CC1	ZINC001165472705	1383300283	/nfs/dbraw/zinc/30/02/83/1383300283.db2.gz	RIFZGRJEBLOZGH-OAHLLOKOSA-N	0	3	330.900	3.066	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccn3c2CCCC3)CC1	ZINC001165538699	1383308832	/nfs/dbraw/zinc/30/88/32/1383308832.db2.gz	HWTYABWZPNULGJ-UHFFFAOYSA-N	0	3	335.879	3.067	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc(OC)c(F)c2)CC1	ZINC001165600725	1383314367	/nfs/dbraw/zinc/31/43/67/1383314367.db2.gz	JMTOILXFQQJNFC-UHFFFAOYSA-N	0	3	340.826	3.077	20	30		EGEDHN
C[C@@H](C(=O)NCCC1(CNCc2ccccc2C#N)CC1)C1CCC1	ZINC001165696903	1383327089	/nfs/dbraw/zinc/32/70/89/1383327089.db2.gz	MRYWQGQNNDJFSH-MRXNPFEDSA-N	0	3	339.483	3.371	20	30		EGEDHN
C=CCC1(C(=O)NCCCNCc2oc(C(C)C)nc2C)CCC1	ZINC001165998074	1383375355	/nfs/dbraw/zinc/37/53/55/1383375355.db2.gz	NGGJUTUVZAGCRO-UHFFFAOYSA-N	0	3	333.476	3.449	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@H](OCC)C2CCCC2)CC1	ZINC001166408595	1383419304	/nfs/dbraw/zinc/41/93/04/1383419304.db2.gz	CIDLTYCKQDYYED-MRXNPFEDSA-N	0	3	342.911	3.210	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCC1(CNCc2c(C)onc2CC)CC1	ZINC001166574650	1383440248	/nfs/dbraw/zinc/44/02/48/1383440248.db2.gz	UHHUVPLUOJTHAW-UHFFFAOYSA-N	0	3	333.476	3.134	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCCC1(CNCc2c(C)noc2C)CC1	ZINC001166755168	1383472522	/nfs/dbraw/zinc/47/25/22/1383472522.db2.gz	FULFNAWCYLONNF-INIZCTEOSA-N	0	3	333.476	3.270	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCCC1(CNCC(=C)Br)CC1	ZINC001166755561	1383472561	/nfs/dbraw/zinc/47/25/61/1383472561.db2.gz	KVECAAYPOVLFOM-AWEZNQCLSA-N	0	3	343.309	3.373	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCCC1(CNCc2oc(C)nc2C)CC1	ZINC001166755786	1383472583	/nfs/dbraw/zinc/47/25/83/1383472583.db2.gz	MQFKUGVPKPWSBI-CQSZACIVSA-N	0	3	333.476	3.270	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2coc(C(F)F)c2)CC1	ZINC001166851388	1383487903	/nfs/dbraw/zinc/48/79/03/1383487903.db2.gz	ZMIZPGCLOWNSBS-UHFFFAOYSA-N	0	3	332.778	3.459	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2c(F)ccc(F)c2F)CC1	ZINC001166896355	1383495695	/nfs/dbraw/zinc/49/56/95/1383495695.db2.gz	IWZOBLSQSMQHAB-UHFFFAOYSA-N	0	3	346.780	3.346	20	30		EGEDHN
C[C@H]1C[C@H]1CC(=O)NCCC1(CNCc2ccc(C#N)cc2F)CC1	ZINC001167013776	1383518891	/nfs/dbraw/zinc/51/88/91/1383518891.db2.gz	WXDACOLNBGGYRI-YOEHRIQHSA-N	0	3	343.446	3.120	20	30		EGEDHN
C=CCCC1(C(=O)NCCC2(CNCc3c(C)noc3C)CC2)CC1	ZINC001167025503	1383522098	/nfs/dbraw/zinc/52/20/98/1383522098.db2.gz	ITRVEISFKZAYPV-UHFFFAOYSA-N	0	3	345.487	3.414	20	30		EGEDHN
CCC1(C(=O)NCCC2(CNCc3ccccc3C#N)CC2)CC1	ZINC001167057575	1383530123	/nfs/dbraw/zinc/53/01/23/1383530123.db2.gz	ROEWFVVWZPVTIE-UHFFFAOYSA-N	0	3	325.456	3.125	20	30		EGEDHN
Cc1ccc(C(=O)NCCCNCc2ccc(C#N)cc2F)c(F)c1	ZINC001167289917	1383585554	/nfs/dbraw/zinc/58/55/54/1383585554.db2.gz	YTMVPOQEAYVEAT-UHFFFAOYSA-N	0	3	343.377	3.055	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCCC1(CNCc2cc(OC)ccn2)CC1	ZINC001167339786	1383602713	/nfs/dbraw/zinc/60/27/13/1383602713.db2.gz	LZYRYLKUUVSXRB-UHFFFAOYSA-N	0	3	345.487	3.069	20	30		EGEDHN
Cc1cccc([C@@H](C)C(=O)NCCCNCc2ccccc2C#N)c1	ZINC001167408200	1383625154	/nfs/dbraw/zinc/62/51/54/1383625154.db2.gz	COGSPMVNVYAWAX-QGZVFWFLSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@@H](c2cccnc2)C(C)C)CC1	ZINC001167535097	1383659483	/nfs/dbraw/zinc/65/94/83/1383659483.db2.gz	JONMQCCXGNWLBH-QGZVFWFLSA-N	0	3	349.906	3.450	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1csc(Cl)c1	ZINC001167645197	1383697225	/nfs/dbraw/zinc/69/72/25/1383697225.db2.gz	ARWPQBHROZEHSU-UHFFFAOYSA-N	0	3	337.670	3.020	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ncoc2C(C)C)CC1	ZINC001167656337	1383700422	/nfs/dbraw/zinc/70/04/22/1383700422.db2.gz	FWUGEQHZNSLCBP-UHFFFAOYSA-N	0	3	325.840	3.040	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)CC[C@H]2CC(C)(C)CO2)CC1	ZINC001167874488	1383762930	/nfs/dbraw/zinc/76/29/30/1383762930.db2.gz	DOKJOOCVXGAXRH-HNNXBMFYSA-N	0	3	342.911	3.210	20	30		EGEDHN
CN(C)/C=N/c1ccc(NCc2cccc3cn(C)nc32)cc1C#N	ZINC001168200726	1383842423	/nfs/dbraw/zinc/84/24/23/1383842423.db2.gz	OZQAAJQCKATISK-LPYMAVHISA-N	0	3	332.411	3.278	20	30		EGEDHN
C[C@@H](CC#N)N[C@H]1CCN(C(=O)OC(C)(C)C)[C@H](C(F)(F)F)C1	ZINC001168531107	1383931352	/nfs/dbraw/zinc/93/13/52/1383931352.db2.gz	UQNRMVWPRPAMNU-SRVKXCTJSA-N	0	3	335.370	3.209	20	30		EGEDHN
C[C@@H](NCCC(=O)Nc1ccc(C#N)c(Cl)c1)c1cccnc1	ZINC001168786090	1384004370	/nfs/dbraw/zinc/00/43/70/1384004370.db2.gz	WUXAZZHBSBEUEQ-GFCCVEGCSA-N	0	3	328.803	3.286	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1(C)C	ZINC001308941210	1384161058	/nfs/dbraw/zinc/16/10/58/1384161058.db2.gz	OEYFJGMNZRHQCH-HZPDHXFCSA-N	0	3	347.434	3.479	20	30		EGEDHN
CC(C)(C)C(=O)Nc1ccc(CN)nc1NCc1ccc(C#N)s1	ZINC001170199770	1384261952	/nfs/dbraw/zinc/26/19/52/1384261952.db2.gz	XXJCDSMZJQRVHV-UHFFFAOYSA-N	0	3	343.456	3.070	20	30		EGEDHN
CCOC(=O)C1=C(Nc2ccc([C@@H](C#N)C(C)C)cc2)CCNC1	ZINC001170516873	1384333439	/nfs/dbraw/zinc/33/34/39/1384333439.db2.gz	IZRRCIQIFXVOOE-INIZCTEOSA-N	0	3	327.428	3.172	20	30		EGEDHN
C[C@@H](Nc1c(F)c(F)c(C(F)(F)F)c(F)c1F)[C@H]1CNCCO1	ZINC001170568270	1384343979	/nfs/dbraw/zinc/34/39/79/1384343979.db2.gz	FXSIEUXQHAKLKT-PHDIDXHHSA-N	0	3	346.246	3.051	20	30		EGEDHN
C[C@H](N)c1ncc(-c2ccccc2)n1-c1ccc(C#N)cc1[N+](=O)[O-]	ZINC001170682804	1384364763	/nfs/dbraw/zinc/36/47/63/1384364763.db2.gz	UGDQCWGWDOHJMV-LBPRGKRZSA-N	0	3	333.351	3.339	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H](C)CCCCNCc1cc(OC)no1	ZINC001170963135	1384419323	/nfs/dbraw/zinc/41/93/23/1384419323.db2.gz	OUJFVFVGQYPYAS-OAHLLOKOSA-N	0	3	349.475	3.216	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)CCCCNCc2csc(C)n2)CCC1	ZINC001171187516	1384463998	/nfs/dbraw/zinc/46/39/98/1384463998.db2.gz	VKLKNQDZYFOPDG-OAHLLOKOSA-N	0	3	347.528	3.410	20	30		EGEDHN
C[C@@H](CC(=O)NC[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1)C1CC1	ZINC001316640943	1384500780	/nfs/dbraw/zinc/50/07/80/1384500780.db2.gz	DOWLTAUZJIYXPD-YEWWUXTCSA-N	0	3	343.446	3.118	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1ccc2c(c1)CCC=C2	ZINC001171361618	1384502545	/nfs/dbraw/zinc/50/25/45/1384502545.db2.gz	AGDJRTTUUREQRC-UHFFFAOYSA-N	0	3	345.446	3.427	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)N1C[C@H]2CN(C(=O)OC(C)(C)C)[C@@H]2C1	ZINC001172312595	1384767036	/nfs/dbraw/zinc/76/70/36/1384767036.db2.gz	HLJOXGPVZOYBOY-FHLIZLRMSA-N	0	3	341.455	3.040	20	30		EGEDHN
COC(=O)c1ccc(CN[C@H](C)CCCC#N)c(Br)c1	ZINC001172489749	1384803808	/nfs/dbraw/zinc/80/38/08/1384803808.db2.gz	ZCDFEMPJIVCOIY-LLVKDONJSA-N	0	3	339.233	3.408	20	30		EGEDHN
CC[C@H](C)[C@H]([NH2+][C@H](C)CCc1c(F)cc(Cl)cc1F)C(=O)N[O-]	ZINC001172569034	1384813387	/nfs/dbraw/zinc/81/33/87/1384813387.db2.gz	CMLFBXDKJIVWAS-WMFXKJRFSA-N	0	3	348.821	3.449	20	30		EGEDHN
C[N@H+](Cc1ccccc1[O-])[C@H]1CCN(C(=O)OC(C)(C)C)[C@H](C#N)C1	ZINC001172991901	1384895926	/nfs/dbraw/zinc/89/59/26/1384895926.db2.gz	NMOXGHBPHKRBKT-HOTGVXAUSA-N	0	3	345.443	3.116	20	30		EGEDHN
C[N@@H+](Cc1ccccc1[O-])[C@H]1CCN(C(=O)OC(C)(C)C)[C@H](C#N)C1	ZINC001172991901	1384895932	/nfs/dbraw/zinc/89/59/32/1384895932.db2.gz	NMOXGHBPHKRBKT-HOTGVXAUSA-N	0	3	345.443	3.116	20	30		EGEDHN
CC(C)C[C@H]([NH2+][C@@H](C)Cc1ccc(OC(F)(F)F)cc1)C(=O)N[O-]	ZINC001173089712	1384911853	/nfs/dbraw/zinc/91/18/53/1384911853.db2.gz	IEENGIQIMXTLJC-FZMZJTMJSA-N	0	3	348.365	3.026	20	30		EGEDHN
CC(C)SCC(=O)N1CCC[C@H](CNCc2ccccc2C#N)C1	ZINC001317146930	1384914618	/nfs/dbraw/zinc/91/46/18/1384914618.db2.gz	VBHFLCFGWSBWDK-MRXNPFEDSA-N	0	3	345.512	3.028	20	30		EGEDHN
C[C@@H]1CC(NCc2cc(C#N)co2)C[C@@H](C)N1C(=O)OC(C)(C)C	ZINC001173680542	1385003400	/nfs/dbraw/zinc/00/34/00/1385003400.db2.gz	SWFWKCOULUIGDZ-CHWSQXEVSA-N	0	3	333.432	3.417	20	30		EGEDHN
COC(=O)c1ccc(C[C@@H](C)NC(=N)c2ccc3ccccc3n2)cc1	ZINC001173717074	1385008441	/nfs/dbraw/zinc/00/84/41/1385008441.db2.gz	LBXIKEGWAZTJSF-CQSZACIVSA-N	0	3	347.418	3.358	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)C(C)(C)CC(C)C	ZINC001317410685	1385121900	/nfs/dbraw/zinc/12/19/00/1385121900.db2.gz	LVHKZGMCXOHSAF-CYBMUJFWSA-N	0	3	333.314	3.452	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H](C)CCCCNCc2cc(C)no2)cc1	ZINC001174634598	1385128117	/nfs/dbraw/zinc/12/81/17/1385128117.db2.gz	CABPUYSPPHMQPU-HNNXBMFYSA-N	0	3	339.439	3.043	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H](C)CCCCNCc1cnc(C)o1	ZINC001174693994	1385135411	/nfs/dbraw/zinc/13/54/11/1385135411.db2.gz	GNXDZLZVDZMREQ-INIZCTEOSA-N	0	3	333.476	3.331	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H](C)CCCCNCc1cc(OC)no1	ZINC001174694290	1385135513	/nfs/dbraw/zinc/13/55/13/1385135513.db2.gz	LBSDSXCOMZNNSG-INIZCTEOSA-N	0	3	349.475	3.032	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H](C)CCCCNCc1cc(C)no1	ZINC001174694652	1385135647	/nfs/dbraw/zinc/13/56/47/1385135647.db2.gz	UXVIHQIONZHJQV-INIZCTEOSA-N	0	3	333.476	3.331	20	30		EGEDHN
CCN(CCNC(=O)C1=CCCCCC1)Cc1ccc(C#N)cc1	ZINC001317474859	1385170815	/nfs/dbraw/zinc/17/08/15/1385170815.db2.gz	PMMWYOIPNOJSNE-UHFFFAOYSA-N	0	3	325.456	3.387	20	30		EGEDHN
C=CCCCC(=O)N[C@@H](C)CCCCNCc1cn(C(C)(C)C)nn1	ZINC001174979031	1385177784	/nfs/dbraw/zinc/17/77/84/1385177784.db2.gz	SSEZURNFTPRAPP-INIZCTEOSA-N	0	3	349.523	3.154	20	30		EGEDHN
CCN1CCN(c2ccc(Nc3cc(Cl)cnc3C#N)cc2)CC1	ZINC001175780900	1385402451	/nfs/dbraw/zinc/40/24/51/1385402451.db2.gz	BOGLPARHYGRLLA-UHFFFAOYSA-N	0	3	341.846	3.492	20	30		EGEDHN
CCN1CCN(c2ccc(Nc3ccc(C#N)cc3OC)cc2)CC1	ZINC001175780600	1385402527	/nfs/dbraw/zinc/40/25/27/1385402527.db2.gz	KVZARIGWNCAURQ-UHFFFAOYSA-N	0	3	336.439	3.452	20	30		EGEDHN
N#Cc1cc(I)c(Cl)cc1Nc1ncc[nH]1	ZINC001176091374	1385481713	/nfs/dbraw/zinc/48/17/13/1385481713.db2.gz	ZEJFVFPPSGTQIC-UHFFFAOYSA-N	0	3	344.543	3.283	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)[C@@H](C)CCc1cccc(F)c1	ZINC001176628719	1385643508	/nfs/dbraw/zinc/64/35/08/1385643508.db2.gz	XEKMEHZAJLAKEN-ZDUSSCGKSA-N	0	3	326.843	3.243	20	30		EGEDHN
C=C[C@@H](CC(=O)NCCCNCc1oc(C)nc1C)c1ccccc1	ZINC001176762576	1385687900	/nfs/dbraw/zinc/68/79/00/1385687900.db2.gz	GTFFYGJTPZQRII-KRWDZBQOSA-N	0	3	341.455	3.247	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H](C)CCCCNC/C(Cl)=C/Cl	ZINC001176801698	1385706321	/nfs/dbraw/zinc/70/63/21/1385706321.db2.gz	PRJZSTWQXBJOJV-ODUNQGDFSA-N	0	3	337.291	3.163	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)CCCCNCc2ccn(C)n2)CCCC1	ZINC001176848062	1385723261	/nfs/dbraw/zinc/72/32/61/1385723261.db2.gz	PUKFXKVXGNASER-KRWDZBQOSA-N	0	3	346.519	3.321	20	30		EGEDHN
CC[C@@H](CNC(=O)C(C1CC1)C1CC1)NCc1ccc(C#N)s1	ZINC001698617272	1406251084	/nfs/dbraw/zinc/25/10/84/1406251084.db2.gz	NHFFSUCAGPUQHY-AWEZNQCLSA-N	0	3	331.485	3.040	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)Cc2cccc(OC)c2)CCCC1	ZINC001318666933	1385826937	/nfs/dbraw/zinc/82/69/37/1385826937.db2.gz	ZAWNXNMEEPXTFC-UHFFFAOYSA-N	0	3	336.863	3.009	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@H]1C[C@H]1OCC	ZINC001177235906	1385879288	/nfs/dbraw/zinc/87/92/88/1385879288.db2.gz	PUNAFYJDZPKDDL-DLBZAZTESA-N	0	3	342.911	3.162	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)C1=COCCC1	ZINC001177245952	1385883004	/nfs/dbraw/zinc/88/30/04/1385883004.db2.gz	QNXNDVYADUMIID-UHFFFAOYSA-N	0	3	340.895	3.432	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@H](OC)C(C)C	ZINC001177406230	1385945501	/nfs/dbraw/zinc/94/55/01/1385945501.db2.gz	SNURMIMQCIJEPJ-QGZVFWFLSA-N	0	3	344.927	3.408	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCCCCCNCc1c(F)cccc1Cl	ZINC001178049365	1386115941	/nfs/dbraw/zinc/11/59/41/1386115941.db2.gz	AJKZRLBYJJRGLX-CYBMUJFWSA-N	0	3	339.842	3.405	20	30		EGEDHN
Cc1cc(C)c(C(=O)N(C)[C@H](C)CNCc2ccc(C#N)s2)o1	ZINC001319439924	1386122728	/nfs/dbraw/zinc/12/27/28/1386122728.db2.gz	QBYUSUHAFPLOPE-GFCCVEGCSA-N	0	3	331.441	3.080	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccc(F)cc2)CCN1C(=O)C[C@H]1C=CCC1	ZINC001178086634	1386125691	/nfs/dbraw/zinc/12/56/91/1386125691.db2.gz	YSTSCAPQYYARLM-QRFRQXIXSA-N	0	3	340.442	3.113	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N(C)[C@@H](C)CNCc1ccc(F)c(C#N)c1	ZINC001319462793	1386132609	/nfs/dbraw/zinc/13/26/09/1386132609.db2.gz	HYXDCXYDDKXIGB-AWEZNQCLSA-N	0	3	333.451	3.316	20	30		EGEDHN
CC1CC(C(=O)NCCCCCCNCc2ccccc2C#N)C1	ZINC001178162101	1386147088	/nfs/dbraw/zinc/14/70/88/1386147088.db2.gz	MHPWKQOEYIAUJV-UHFFFAOYSA-N	0	3	327.472	3.371	20	30		EGEDHN
CCC1(C(=O)N(C)[C@H](C)CNCc2cc(C#N)ccc2OC)CCC1	ZINC001319513934	1386155012	/nfs/dbraw/zinc/15/50/12/1386155012.db2.gz	FGSDUKSXBDXBOB-OAHLLOKOSA-N	0	3	343.471	3.084	20	30		EGEDHN
CC/C=C(/C)C(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)[C@@H]1C	ZINC001178245677	1386170476	/nfs/dbraw/zinc/17/04/76/1386170476.db2.gz	OCBHAFWTNSUMDT-ILLYDAJRSA-N	0	3	329.419	3.133	20	30		EGEDHN
C=CCN1CCC[C@H]1CNC(=O)Cc1ccc(-c2ccnc(C)c2)cc1	ZINC001178382656	1386203928	/nfs/dbraw/zinc/20/39/28/1386203928.db2.gz	AGKPEQRGJCBOTI-NRFANRHFSA-N	0	3	349.478	3.366	20	30		EGEDHN
C=CCC[C@H](C)[NH2+]CCCCCCNC(=O)c1cccc2n[n-]nc21	ZINC001178564347	1386249514	/nfs/dbraw/zinc/24/95/14/1386249514.db2.gz	IXGPMXZUTDIRMT-HNNXBMFYSA-N	0	3	343.475	3.192	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](NCc2ccc(Cl)nc2)[C@@H]1C	ZINC001178791498	1386305407	/nfs/dbraw/zinc/30/54/07/1386305407.db2.gz	DKFNWYHQYJINHZ-ZFWWWQNUSA-N	0	3	335.879	3.416	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)[C@@H](C)Oc2ccccc2)CCCC1	ZINC001698639808	1406287150	/nfs/dbraw/zinc/28/71/50/1406287150.db2.gz	WHWGVNPIJWJMEG-OAHLLOKOSA-N	0	3	336.863	3.225	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCCCCCCNCc1cc2n(n1)CCC2	ZINC001179339254	1386455402	/nfs/dbraw/zinc/45/54/02/1386455402.db2.gz	AHUIFQDBPWWTLK-KRWDZBQOSA-N	0	3	346.519	3.198	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCCCCCCN[C@@H](C)c1nnc(C)[nH]1	ZINC001179340336	1386457386	/nfs/dbraw/zinc/45/73/86/1386457386.db2.gz	ZIYYDTSPNHISDV-GOEBONIOSA-N	0	3	335.496	3.043	20	30		EGEDHN
C[C@@H]1C[C@@H]1CC(=O)NCCCCCCNCc1ccccc1C#N	ZINC001179474227	1386491737	/nfs/dbraw/zinc/49/17/37/1386491737.db2.gz	CVNIDVDLCONNIE-VQIMIIECSA-N	0	3	327.472	3.371	20	30		EGEDHN
C[C@@H](C#N)C(=O)N(Cc1ccccc1)[C@H]1CCN(Cc2ccccc2)C1	ZINC001179895352	1386621162	/nfs/dbraw/zinc/62/11/62/1386621162.db2.gz	MPZXPABPBUUBAQ-RXVVDRJESA-N	0	3	347.462	3.449	20	30		EGEDHN
CC(C)CC(=O)N1C[C@@H](C)[C@](C)(CNCc2cc(F)ccc2C#N)C1	ZINC001180430176	1386794587	/nfs/dbraw/zinc/79/45/87/1386794587.db2.gz	BNXTYJSOWIUPNC-FOIQADDNSA-N	0	3	345.462	3.318	20	30		EGEDHN
CC[C@H](NC[C@@H](C)NC(=O)c1cc(C#N)c[nH]1)c1ccc(F)cc1F	ZINC001321479733	1386914072	/nfs/dbraw/zinc/91/40/72/1386914072.db2.gz	CTCQWNBYTDVMJY-BZNIZROVSA-N	0	3	346.381	3.024	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CC[C@@H](NCc2cc3ccccc3o2)C1	ZINC001181476854	1387001399	/nfs/dbraw/zinc/00/13/99/1387001399.db2.gz	UWKJLIMWLHRUBW-NVXWUHKLSA-N	0	3	342.439	3.105	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2cc(C)no2)C1	ZINC001182304971	1387143151	/nfs/dbraw/zinc/14/31/51/1387143151.db2.gz	BVSYBAGMBWPYNA-SPYBWZPUSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=CCCC1(C(=O)N2C[C@@H](C)[C@](C)(CNCc3cc(C)no3)C2)CC1	ZINC001182500556	1387178291	/nfs/dbraw/zinc/17/82/91/1387178291.db2.gz	YFJYUMQXTMGJTK-DNVCBOLYSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@@H](C)[C@](C)(CNCc3cnc(C)o3)C2)CCC1	ZINC001182506474	1387179765	/nfs/dbraw/zinc/17/97/65/1387179765.db2.gz	NOCORWJPHJHFGX-DNVCBOLYSA-N	0	3	345.487	3.304	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1C[C@@H](C)[C@](C)(CNCc2ccccc2C#N)C1	ZINC001182693635	1387208728	/nfs/dbraw/zinc/20/87/28/1387208728.db2.gz	UOASGBLLNCJDQX-NVEXJGOOSA-N	0	3	339.483	3.179	20	30		EGEDHN
C[C@H](C(=O)N(C)CCN(C)Cc1ccccc1)c1ccc(C#N)cc1	ZINC001182793659	1387225341	/nfs/dbraw/zinc/22/53/41/1387225341.db2.gz	NDVCDTMWHMOIKW-KRWDZBQOSA-N	0	3	335.451	3.252	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1c(C)cc(C)nc1C	ZINC001329316874	1389059611	/nfs/dbraw/zinc/05/96/11/1389059611.db2.gz	JJTSYKARSGSZPL-UHFFFAOYSA-N	0	3	337.895	3.447	20	30		EGEDHN
C[C@@H](NC[C@H](O)COc1ccc(C#N)cc1)c1ccc(Cl)c(F)c1	ZINC001337222161	1389279718	/nfs/dbraw/zinc/27/97/18/1389279718.db2.gz	WSJIUMAPSYFYGI-DOMZBBRYSA-N	0	3	348.805	3.441	20	30		EGEDHN
CN1CCCC[C@H]1CNC(=O)c1cn(CCCC#N)c2ccccc12	ZINC001337536853	1389382060	/nfs/dbraw/zinc/38/20/60/1389382060.db2.gz	YFNFAIIJQUQUPM-INIZCTEOSA-N	0	3	338.455	3.159	20	30		EGEDHN
CC(C)(C)[C@H](CNCc1ccc(C#N)s1)NC(=O)c1ccsn1	ZINC001332809273	1390192083	/nfs/dbraw/zinc/19/20/83/1390192083.db2.gz	XGRDRSCZSKWUMA-AWEZNQCLSA-N	0	3	348.497	3.011	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)Nc1cc(C(N)=O)sc1C	ZINC001341513440	1390496567	/nfs/dbraw/zinc/49/65/67/1390496567.db2.gz	DMCHFFKVGFBFNI-GFCCVEGCSA-N	0	3	325.478	3.172	20	30		EGEDHN
N#Cc1ccsc1NC(=O)NCCCN1CCc2ccccc2C1	ZINC001334452573	1390540613	/nfs/dbraw/zinc/54/06/13/1390540613.db2.gz	YJJPSFRYVHVSJI-UHFFFAOYSA-N	0	3	340.452	3.190	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)Nc1cn(C)nc1C(F)(F)F	ZINC001341878922	1390543863	/nfs/dbraw/zinc/54/38/63/1390543863.db2.gz	WUSMODMZFDBGDV-NSHDSACASA-N	0	3	334.386	3.455	20	30		EGEDHN
C=C(C)Cn1c(N2CCN(C(C)(C)CC)CC2)nnc1C(C)(F)F	ZINC001341880080	1390544153	/nfs/dbraw/zinc/54/41/53/1390544153.db2.gz	XOVAPZSOAQGJCA-UHFFFAOYSA-N	0	3	341.450	3.277	20	30		EGEDHN
C=CCn1c(Nc2ccc(OC)cc2)nnc1[C@H]1CCCN(C)C1	ZINC001342019731	1390562788	/nfs/dbraw/zinc/56/27/88/1390562788.db2.gz	JITNUKKASBOVAR-AWEZNQCLSA-N	0	3	327.432	3.026	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CCCN(C)C2)nnc1N1Cc2ccccc2C1	ZINC001342246776	1390591031	/nfs/dbraw/zinc/59/10/31/1390591031.db2.gz	FSXMTRZZZUWPQZ-SFHVURJKSA-N	0	3	337.471	3.184	20	30		EGEDHN
COC(=O)C[C@@](C)(NCCCCC1(C#N)CCC1)c1ccccn1	ZINC001334798770	1390591746	/nfs/dbraw/zinc/59/17/46/1390591746.db2.gz	NTVNIMMNIFWTAD-GOSISDBHSA-N	0	3	329.444	3.314	20	30		EGEDHN
C[C@H](NC(=O)C(C#N)C(=O)[C@H]1C[C@H]1F)c1ccc(Cl)cc1Cl	ZINC001343442783	1390714263	/nfs/dbraw/zinc/71/42/63/1390714263.db2.gz	SFRIIIDTAKOHDV-UVRHIYEWSA-N	0	3	343.185	3.237	20	30		EGEDHN
CC[C@@H](C)N1CCN(c2nnc([C@@H](C)CCC#N)n2CC(C)C)CC1	ZINC001343482414	1390716693	/nfs/dbraw/zinc/71/66/93/1390716693.db2.gz	LUOBRACSMBLJGN-DLBZAZTESA-N	0	3	346.523	3.262	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)C[C@@H](C)Cc1ccccc1OC	ZINC001346096515	1390907302	/nfs/dbraw/zinc/90/73/02/1390907302.db2.gz	QVLQYHNRGNNKAZ-GOEBONIOSA-N	0	3	325.412	3.357	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc3ccccc3nc2Cl)CC1	ZINC001351166681	1391606739	/nfs/dbraw/zinc/60/67/39/1391606739.db2.gz	UMFRZJWEXICWEP-UHFFFAOYSA-N	0	3	329.831	3.268	20	30		EGEDHN
CCC[C@H](C)C(=O)NC[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001488818679	1391729212	/nfs/dbraw/zinc/72/92/12/1391729212.db2.gz	VKMQVGBNCCLWTA-QRTARXTBSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=CCCC(=O)NCC[C@H](C)NCc1ccccc1Br	ZINC001480753292	1392914312	/nfs/dbraw/zinc/91/43/12/1392914312.db2.gz	CZFCLLUZKKGOMH-ZDUSSCGKSA-N	0	3	339.277	3.400	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1c[nH]nc1C1CCCCC1	ZINC001480804623	1392944073	/nfs/dbraw/zinc/94/40/73/1392944073.db2.gz	ZJWVZRQTSYCDMD-CYBMUJFWSA-N	0	3	338.883	3.308	20	30		EGEDHN
CCN(CCNC(=O)Cc1ccc(C)cc1)Cc1ccc(C#N)cc1	ZINC001480987194	1393069958	/nfs/dbraw/zinc/06/99/58/1393069958.db2.gz	YRIBVTJHDBFSOT-UHFFFAOYSA-N	0	3	335.451	3.048	20	30		EGEDHN
CCN(CCNC(=O)[C@H]1CCCCC1(F)F)Cc1cccc(C#N)c1	ZINC001480990266	1393071639	/nfs/dbraw/zinc/07/16/39/1393071639.db2.gz	JITHRZQHSRTXMH-QGZVFWFLSA-N	0	3	349.425	3.322	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCN(C(=O)CCCC2CC2)C1	ZINC001481493634	1394338044	/nfs/dbraw/zinc/33/80/44/1394338044.db2.gz	CSKNXLIFLFOGKM-MRXNPFEDSA-N	0	3	345.512	3.480	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)Cc2sc(C)nc2C)CCCC1	ZINC001481901767	1394587554	/nfs/dbraw/zinc/58/75/54/1394587554.db2.gz	NBVHPGHYKFYLCZ-UHFFFAOYSA-N	0	3	341.908	3.074	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1sc(C2CC2)nc1C)C(C)C	ZINC001698960574	1406713643	/nfs/dbraw/zinc/71/36/43/1406713643.db2.gz	HNCOTRGZHAFLDX-ZDUSSCGKSA-N	0	3	341.908	3.425	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)C(C)(C)C1CC1)NCc1ccc(C#N)cc1F	ZINC001698975463	1406744058	/nfs/dbraw/zinc/74/40/58/1406744058.db2.gz	KLLRHRCZTYNDFI-GOSISDBHSA-N	0	3	345.462	3.364	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cncc(C(F)(F)F)c1)C(C)C	ZINC001698977186	1406748351	/nfs/dbraw/zinc/74/83/51/1406748351.db2.gz	GNWWSUYSHSSXQJ-ZDUSSCGKSA-N	0	3	349.784	3.197	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CN(C(=O)CCCC4CC4)C[C@@H]3C2)c1	ZINC001484410713	1395376511	/nfs/dbraw/zinc/37/65/11/1395376511.db2.gz	LJNJMGJSLOJZLP-BGYRXZFFSA-N	0	3	337.467	3.029	20	30		EGEDHN
C/C(=C\C(=O)NCC[C@H](C)NCc1cc(C#N)ccc1F)C1CC1	ZINC001484989683	1395633404	/nfs/dbraw/zinc/63/34/04/1395633404.db2.gz	HXEVSQRQTDGJPV-SSUFTNFISA-N	0	3	329.419	3.038	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](C2CCN(C(=O)CCCF)CC2)C1	ZINC001485085275	1395654546	/nfs/dbraw/zinc/65/45/46/1395654546.db2.gz	SYTINKJBSMKHEU-MRXNPFEDSA-N	0	3	330.875	3.439	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)[C@H](C)OC1CCCCCC1	ZINC001503468339	1396255749	/nfs/dbraw/zinc/25/57/49/1396255749.db2.gz	OCLYHJSYRWBUDJ-GJZGRUSLSA-N	0	3	330.900	3.351	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccnn2[C@@H](C)CC)CCCC1	ZINC001495918732	1396572295	/nfs/dbraw/zinc/57/22/95/1396572295.db2.gz	NQKIDVRKIWLQTN-AWEZNQCLSA-N	0	3	338.883	3.239	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1cnc(CC)s1	ZINC001689911263	1404203782	/nfs/dbraw/zinc/20/37/82/1404203782.db2.gz	DEFDHIYETWWSOB-STQMWFEESA-N	0	3	341.908	3.431	20	30		EGEDHN
CCCN(C(=O)CC)C1CCN(Cc2ccc(OCC#N)cc2)CC1	ZINC001690131175	1404326026	/nfs/dbraw/zinc/32/60/26/1404326026.db2.gz	OJNRHBJDFLLXKK-UHFFFAOYSA-N	0	3	343.471	3.202	20	30		EGEDHN
CC(F)(F)CCC(=O)NC[C@H]1CCCN(Cc2ccc(C#N)cc2)C1	ZINC001690385525	1404518012	/nfs/dbraw/zinc/51/80/12/1404518012.db2.gz	NWOFMCVQBBMNTB-QGZVFWFLSA-N	0	3	349.425	3.322	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)[C@H](C)c1ccccc1	ZINC001690874568	1404788819	/nfs/dbraw/zinc/78/88/19/1404788819.db2.gz	MLYVQPYHTIYOTC-ZIAGYGMSSA-N	0	3	339.277	3.183	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@H](CNC(=O)CCCC3CC3)C2)c(F)c1	ZINC001691807195	1405519452	/nfs/dbraw/zinc/51/94/52/1405519452.db2.gz	JEPYIHCZQUSPGG-SAABIXHNSA-N	0	3	343.446	3.262	20	30		EGEDHN
CCC(CC)C(=O)NCC[C@@H]1CCN(Cc2ccc(F)c(C#N)c2)C1	ZINC001691872655	1405595275	/nfs/dbraw/zinc/59/52/75/1405595275.db2.gz	JKULPXITJCBDEV-OAHLLOKOSA-N	0	3	345.462	3.462	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H](CNC(=O)C3(F)CCCCC3)C2)c1	ZINC001731857549	1428093322	/nfs/dbraw/zinc/09/33/22/1428093322.db2.gz	MUYZLSZRLKLIEU-GOSISDBHSA-N	0	3	343.446	3.169	20	30		EGEDHN
C[C@@H](CNCc1ccccc1C#N)CNC(=O)c1ccc2cc[nH]c2c1	ZINC001732365616	1428549837	/nfs/dbraw/zinc/54/98/37/1428549837.db2.gz	RPBZWKOACYXAJU-HNNXBMFYSA-N	0	3	346.434	3.195	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)[C@@H]3CC34CC4)CCCC2)c(F)c1	ZINC001732396295	1428563494	/nfs/dbraw/zinc/56/34/94/1428563494.db2.gz	IDOKKCOJBOHCIE-INIZCTEOSA-N	0	3	341.430	3.016	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)c1ccc(Cl)cc1	ZINC001699471853	1412853403	/nfs/dbraw/zinc/85/34/03/1412853403.db2.gz	PINZPBWPJJOELR-AWEZNQCLSA-N	0	3	341.842	3.462	20	30		EGEDHN
Cc1cscc1C(=O)NCC1(NCc2ccc(F)c(C#N)c2)CC1	ZINC001699649262	1413032009	/nfs/dbraw/zinc/03/20/09/1413032009.db2.gz	MVOPDOJNCUUXHC-UHFFFAOYSA-N	0	3	343.427	3.120	20	30		EGEDHN
CC1(C)CN(Cc2ccc(C#N)cc2)CC[C@H]1NC(=O)CCCF	ZINC001700290109	1413740609	/nfs/dbraw/zinc/74/06/09/1413740609.db2.gz	HELNXPZLCXIYSC-QGZVFWFLSA-N	0	3	331.435	3.025	20	30		EGEDHN
C#CCC1(C(=O)NCC[C@H](C)NCc2oc(C)nc2C)CCCCC1	ZINC001700328681	1413800779	/nfs/dbraw/zinc/80/07/79/1413800779.db2.gz	PGBAVQASTJTCBV-HNNXBMFYSA-N	0	3	345.487	3.250	20	30		EGEDHN
CCCC(=O)NCc1ccc(CNCc2ccc(C#N)cc2)cc1F	ZINC001701065039	1414722527	/nfs/dbraw/zinc/72/25/27/1414722527.db2.gz	PMPIOQOMPAUBSG-UHFFFAOYSA-N	0	3	339.414	3.403	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)CCc2ccc(F)cc2F)C1	ZINC001707077183	1417187571	/nfs/dbraw/zinc/18/75/71/1417187571.db2.gz	VCPDBHQPCRXFBX-JNSHFYNHSA-N	0	3	342.817	3.134	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)[C@@H](CC)CCC)C1	ZINC001707090527	1417196777	/nfs/dbraw/zinc/19/67/77/1417196777.db2.gz	UMXAJZNLVQITCJ-IHRRRGAJSA-N	0	3	331.298	3.206	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1cn(C(C)C)cn1	ZINC001707444704	1417348456	/nfs/dbraw/zinc/34/84/56/1417348456.db2.gz	ROCDMDNYRHJYLU-GOEBONIOSA-N	0	3	338.883	3.189	20	30		EGEDHN
CCCC[C@@](C)(F)C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001713163079	1417738195	/nfs/dbraw/zinc/73/81/95/1417738195.db2.gz	YHFWSRIRQJUVBI-GPMSIDNRSA-N	0	3	349.425	3.353	20	30		EGEDHN
CC1(CCC(=O)N[C@H]2C[C@H](NCc3ccc(C#N)cc3F)C2)CC1	ZINC001713171736	1417744751	/nfs/dbraw/zinc/74/47/51/1417744751.db2.gz	FACADERHQPMABS-WKILWMFISA-N	0	3	329.419	3.014	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1CCC[C@@H](NC(=O)CC(F)(F)F)C1	ZINC001713369638	1417981685	/nfs/dbraw/zinc/98/16/85/1417981685.db2.gz	UJVYPXVZJNLVFT-LSDHHAIUSA-N	0	3	339.361	3.028	20	30		EGEDHN
Cc1occc1C(=O)NCC[C@@H]1CCN(Cc2ccccc2C#N)C1	ZINC001713724587	1418502685	/nfs/dbraw/zinc/50/26/85/1418502685.db2.gz	RZLYOZHETYYHHZ-MRXNPFEDSA-N	0	3	337.423	3.102	20	30		EGEDHN
CCc1occc1C(=O)NC[C@@H](NCc1ccc(C#N)s1)C1CC1	ZINC001713863808	1418661120	/nfs/dbraw/zinc/66/11/20/1418661120.db2.gz	CSAQXQKUHQSYHL-MRXNPFEDSA-N	0	3	343.452	3.073	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2scnc2CC)CCCC1	ZINC001714133832	1418936640	/nfs/dbraw/zinc/93/66/40/1418936640.db2.gz	KGYKXSQWMPSLJF-UHFFFAOYSA-N	0	3	327.881	3.090	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2cc(F)c[nH]2)CCCC[C@@H]1C	ZINC001714189026	1418995915	/nfs/dbraw/zinc/99/59/15/1418995915.db2.gz	POQRFNLBEBWXOO-ZBEGNZNMSA-N	0	3	327.831	3.175	20	30		EGEDHN
CCc1ccc(C(=O)NC[C@H](C)NCc2ccc(F)c(C#N)c2)cc1	ZINC001714298809	1419077465	/nfs/dbraw/zinc/07/74/65/1419077465.db2.gz	FKUCKMRTPRNJPN-AWEZNQCLSA-N	0	3	339.414	3.168	20	30		EGEDHN
O=C(C1CC=CC1)N1CCC[C@@H]1CNCC#Cc1cccc(Cl)c1	ZINC001714333645	1419113211	/nfs/dbraw/zinc/11/32/11/1419113211.db2.gz	BYEDAPHFGACOHR-LJQANCHMSA-N	0	3	342.870	3.238	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccc(C)c(OC)c2)CCCC1	ZINC001714498008	1419222878	/nfs/dbraw/zinc/22/28/78/1419222878.db2.gz	ZPYHHBGGYFRZCG-UHFFFAOYSA-N	0	3	336.863	3.388	20	30		EGEDHN
Cc1cccc(Cl)c1CNC[C@@H](C)N(C)C(=O)c1cc(C#N)c[nH]1	ZINC001714575761	1419311633	/nfs/dbraw/zinc/31/16/33/1419311633.db2.gz	LTGQSSUWCWIKPN-CYBMUJFWSA-N	0	3	344.846	3.099	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)Cc2cc(C)ccc2F)CCCC1	ZINC001715102278	1419843467	/nfs/dbraw/zinc/84/34/67/1419843467.db2.gz	HSCUFWYOMGVXQW-UHFFFAOYSA-N	0	3	338.854	3.448	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)c1cc(C)cc2c[nH]nc21)C1CC1	ZINC001715121783	1419866614	/nfs/dbraw/zinc/86/66/14/1419866614.db2.gz	XHMWNTLFTOIKRG-GOSISDBHSA-N	0	3	346.862	3.112	20	30		EGEDHN
C=C(Br)CNC[C@H]1[C@H](C)CCCN1C(=O)CC1CCC1	ZINC001715354181	1420054130	/nfs/dbraw/zinc/05/41/30/1420054130.db2.gz	HOYQXCGYVPSLNX-DOMZBBRYSA-N	0	3	343.309	3.302	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1ccc(C)c(F)c1F)C(C)C	ZINC001715504248	1420187274	/nfs/dbraw/zinc/18/72/74/1420187274.db2.gz	NSKXHTLSVIQKNE-ZDUSSCGKSA-N	0	3	330.806	3.370	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cc2ccccc2n1C)C(C)C	ZINC001715506577	1420190067	/nfs/dbraw/zinc/19/00/67/1420190067.db2.gz	LZDJDHKUACPFDD-OAHLLOKOSA-N	0	3	333.863	3.275	20	30		EGEDHN
CCC1(C(=O)NC[C@@H](NCc2cc(C#N)ccc2F)C(C)C)CC1	ZINC001715645563	1420277287	/nfs/dbraw/zinc/27/72/87/1420277287.db2.gz	OSTSYGCBZDLVJB-QGZVFWFLSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cnc(C)nc1C(C)C)C(C)C	ZINC001715659415	1420282702	/nfs/dbraw/zinc/28/27/02/1420282702.db2.gz	JFWKAAIMCZPHSP-OAHLLOKOSA-N	0	3	338.883	3.005	20	30		EGEDHN
C=Cc1ccc(C(=O)NCC2(NCc3cccc(C#N)c3)CC2)cc1	ZINC001716694864	1420848017	/nfs/dbraw/zinc/84/80/17/1420848017.db2.gz	GUMBPXKCDOSHOE-UHFFFAOYSA-N	0	3	331.419	3.253	20	30		EGEDHN
CC1(NC(=O)C2(F)CCCC2)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001716796236	1420929097	/nfs/dbraw/zinc/92/90/97/1420929097.db2.gz	SIYFSLHZAZRKLZ-UHFFFAOYSA-N	0	3	343.446	3.311	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)Cc3cccs3)CCC2)s1	ZINC001717146170	1421138352	/nfs/dbraw/zinc/13/83/52/1421138352.db2.gz	UOFIGFHTILQCLH-UHFFFAOYSA-N	0	3	345.493	3.052	20	30		EGEDHN
CCCC[C@@H](CNCc1ccc(C#N)s1)NC(=O)c1ccco1	ZINC001717529474	1421465544	/nfs/dbraw/zinc/46/55/44/1421465544.db2.gz	VBWRGWLQZMPXKX-ZDUSSCGKSA-N	0	3	331.441	3.291	20	30		EGEDHN
C=C(Br)CNC[C@@H](NC(=O)C(C)(C)C1CC1)C(C)(C)C	ZINC001717965232	1421736937	/nfs/dbraw/zinc/73/69/37/1421736937.db2.gz	LOARLTOLQDVLLD-CYBMUJFWSA-N	0	3	345.325	3.452	20	30		EGEDHN
C=C(Cl)Cn1c([C@H](C)CC)nnc1N1CCN(CC2CC2)CC1	ZINC001722543756	1424212872	/nfs/dbraw/zinc/21/28/72/1424212872.db2.gz	SXUJLZKXEMQSLC-CYBMUJFWSA-N	0	3	337.899	3.076	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1ccc(F)cc1F	ZINC001725146214	1425628426	/nfs/dbraw/zinc/62/84/26/1425628426.db2.gz	JIBBSKCIBPRMNU-UHFFFAOYSA-N	0	3	330.806	3.405	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)C(C)(C)C(F)(F)F	ZINC001725146722	1425628971	/nfs/dbraw/zinc/62/89/71/1425628971.db2.gz	ODMAVERTCAIQQW-UHFFFAOYSA-N	0	3	328.806	3.402	20	30		EGEDHN
Cc1cc(F)ccc1C(=O)NC[C@H](C)N(C)Cc1cccc(C#N)c1	ZINC001725188941	1425728134	/nfs/dbraw/zinc/72/81/34/1425728134.db2.gz	KYMWQKOMYDGASA-HNNXBMFYSA-N	0	3	339.414	3.256	20	30		EGEDHN
CCCC[C@@H](CNCc1ccc(C#N)s1)NC(=O)c1ccns1	ZINC001725235378	1425818470	/nfs/dbraw/zinc/81/84/70/1425818470.db2.gz	VRRXFCMPHPMVQX-LBPRGKRZSA-N	0	3	348.497	3.155	20	30		EGEDHN
C=C(Br)CNC[C@H](NC(=O)C(CC)CC)C(C)(C)C	ZINC001725742346	1426418707	/nfs/dbraw/zinc/41/87/07/1426418707.db2.gz	BWNFTHKZMHMKBD-ZDUSSCGKSA-N	0	3	333.314	3.452	20	30		EGEDHN
C=C(Br)CNC[C@@H](NC(=O)c1cocc1C)C(C)(C)C	ZINC001725792679	1426477927	/nfs/dbraw/zinc/47/79/27/1426477927.db2.gz	KKOAVQCIAXQHNL-CYBMUJFWSA-N	0	3	343.265	3.231	20	30		EGEDHN
CCCC1(C(=O)NC[C@@H](NCc2ccc(C#N)s2)C2CC2)CC1	ZINC001731405621	1427367375	/nfs/dbraw/zinc/36/73/75/1427367375.db2.gz	OPNMHUSXBWRNKW-MRXNPFEDSA-N	0	3	331.485	3.184	20	30		EGEDHN
CCC(C)(C)C(=O)NC[C@H]1CCCN(Cc2ccc(C#N)cc2)C1	ZINC001731498407	1427476079	/nfs/dbraw/zinc/47/60/79/1427476079.db2.gz	LWMLHXWBPMRBIH-GOSISDBHSA-N	0	3	327.472	3.323	20	30		EGEDHN
C[C@H](CNC(=O)CC(C1CC1)C1CC1)NCc1ccc(C#N)s1	ZINC001731641866	1427701607	/nfs/dbraw/zinc/70/16/07/1427701607.db2.gz	XFXMAWWRSLRXOA-GFCCVEGCSA-N	0	3	331.485	3.040	20	30		EGEDHN
C=CCC1(C(=O)NCC[C@H](C)NCc2ccncc2Cl)CCC1	ZINC001731734540	1427813759	/nfs/dbraw/zinc/81/37/59/1427813759.db2.gz	WEFQYQIWFOZWHE-AWEZNQCLSA-N	0	3	335.879	3.466	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)c1ccc(CNC(=O)CCc2c[nH]cn2)cc1	ZINC001733681867	1429892620	/nfs/dbraw/zinc/89/26/20/1429892620.db2.gz	LOFKGSADGLRTJO-AWEZNQCLSA-N	0	3	346.862	3.062	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)c1ccc(CNC(=O)CCc2cnc[nH]2)cc1	ZINC001733681867	1429892625	/nfs/dbraw/zinc/89/26/25/1429892625.db2.gz	LOFKGSADGLRTJO-AWEZNQCLSA-N	0	3	346.862	3.062	20	30		EGEDHN
C[C@H]1CN(C(=O)CCCC2CC2)C[C@H]1NCc1ccc(C#N)s1	ZINC001733850591	1430117430	/nfs/dbraw/zinc/11/74/30/1430117430.db2.gz	UHFIEORNDOSNOY-SUMWQHHRSA-N	0	3	331.485	3.137	20	30		EGEDHN
Cc1cc(F)cc(C(=O)NC[C@H](C)N(C)Cc2ccc(C#N)cc2)c1	ZINC001734056534	1437847821	/nfs/dbraw/zinc/84/78/21/1437847821.db2.gz	XWQZZMYAQVQCOK-HNNXBMFYSA-N	0	3	339.414	3.256	20	30		EGEDHN
CN(C(=O)C(C)(C)C)[C@H](CNCc1cc(C#N)ccc1F)C1CC1	ZINC001734310284	1438041184	/nfs/dbraw/zinc/04/11/84/1438041184.db2.gz	INVOZSRUARCWIN-QGZVFWFLSA-N	0	3	331.435	3.070	20	30		EGEDHN
CN(CCCNC(=O)/C=C/C(C)(C)C)Cc1ccc(F)c(C#N)c1	ZINC001751953716	1440128270	/nfs/dbraw/zinc/12/82/70/1440128270.db2.gz	XMHQISIADBJOMT-CMDGGOBGSA-N	0	3	331.435	3.238	20	30		EGEDHN
C[C@H](NCC#Cc1ccccc1)[C@H]1CCCCN1C(=O)c1ccc[nH]1	ZINC001752132947	1440143753	/nfs/dbraw/zinc/14/37/53/1440143753.db2.gz	XLIFSNUHWKTJFR-FXAWDEMLSA-N	0	3	335.451	3.039	20	30		EGEDHN
C[C@@H](NCC#Cc1ccccc1)[C@@H]1CCCCN1C(=O)CCCF	ZINC001752144529	1440145412	/nfs/dbraw/zinc/14/54/12/1440145412.db2.gz	QRHNVLFTWQIBRX-MJGOQNOKSA-N	0	3	330.447	3.147	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1cnc2[nH]ccc2c1	ZINC001752148408	1440146443	/nfs/dbraw/zinc/14/64/43/1440146443.db2.gz	YZTGZXLOQNBZAR-XJKSGUPXSA-N	0	3	346.862	3.240	20	30		EGEDHN
CCN(CC#Cc1ccccc1)CCCNC(=O)[C@@H]1CC[C@@H]2C[C@@H]2C1	ZINC001752193823	1440152697	/nfs/dbraw/zinc/15/26/97/1440152697.db2.gz	ZDJVBXTWYLJBRO-NJDAHSKKSA-N	0	3	338.495	3.303	20	30		EGEDHN
C=CCOCC(=O)N(C)C1CCN(Cc2ccc(C(C)C)cc2)CC1	ZINC001752295644	1440167130	/nfs/dbraw/zinc/16/71/30/1440167130.db2.gz	UTCBKUHRCAGMBW-UHFFFAOYSA-N	0	3	344.499	3.435	20	30		EGEDHN
C=CCOCCN1CCC(N(C)C(=O)c2coc3ccccc23)CC1	ZINC001752310581	1440170080	/nfs/dbraw/zinc/17/00/80/1440170080.db2.gz	QXJIXKAFJOOLFJ-UHFFFAOYSA-N	0	3	342.439	3.172	20	30		EGEDHN
C=C1CCC(C(=O)NCCN2CCN(CC/C=C\CCC)CC2)CC1	ZINC001752373263	1440172353	/nfs/dbraw/zinc/17/23/53/1440172353.db2.gz	PNFMYWXJQOXNDV-WAYWQWQTSA-N	0	3	347.547	3.213	20	30		EGEDHN
CC1(CC(=O)N[C@@H]2CC23CCN(Cc2cccc(C#N)c2)CC3)CC1	ZINC001752425234	1440176697	/nfs/dbraw/zinc/17/66/97/1440176697.db2.gz	CPXIQCQQQRGEKE-GOSISDBHSA-N	0	3	337.467	3.219	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1CC12CCN(CCC(F)(F)F)CC2	ZINC001752426813	1440177272	/nfs/dbraw/zinc/17/72/72/1440177272.db2.gz	ZVBDXGWRSWKQEZ-OAHLLOKOSA-N	0	3	344.421	3.493	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCC[C@@H](CN(C)CC#Cc2ccccc2)C1	ZINC001752498314	1440187981	/nfs/dbraw/zinc/18/79/81/1440187981.db2.gz	XYWNXGUYUBTFNY-QUCCMNQESA-N	0	3	326.484	3.255	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@H](CN(C)Cc2ncccc2C)C1	ZINC001752519040	1440192058	/nfs/dbraw/zinc/19/20/58/1440192058.db2.gz	RCDNJOGJIGBQDA-LJQANCHMSA-N	0	3	341.499	3.254	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)c1cc(CC)ccn1	ZINC001752534094	1440194077	/nfs/dbraw/zinc/19/40/77/1440194077.db2.gz	GHCVTIBISCQPIE-NXHRZFHOSA-N	0	3	327.472	3.288	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H](NCc3c(C)nsc3C)C2)CCC1	ZINC001752664062	1440198529	/nfs/dbraw/zinc/19/85/29/1440198529.db2.gz	NLDHDEHSYVBEQP-SHTZXODSSA-N	0	3	333.501	3.243	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C[C@@H](CC)C(C)C)C1	ZINC001752680790	1440199630	/nfs/dbraw/zinc/19/96/30/1440199630.db2.gz	BLKXHHCCCRPNRF-MGPQQGTHSA-N	0	3	331.298	3.204	20	30		EGEDHN
CC1=C(C)C[C@@H](C(=O)N[C@H]2C[C@@H](NCC#Cc3ccccc3)C2)CC1	ZINC001752730790	1440204169	/nfs/dbraw/zinc/20/41/69/1440204169.db2.gz	HTCVJUWIXYUWFR-PCCBWWKXSA-N	0	3	336.479	3.411	20	30		EGEDHN
O=C(N[C@H]1C[C@@H](NCC#Cc2cccc(Cl)c2)C1)C1CC2(CC2)C1	ZINC001752765598	1440205647	/nfs/dbraw/zinc/20/56/47/1440205647.db2.gz	OHRNUNKGCJNBQR-HDICACEKSA-N	0	3	342.870	3.119	20	30		EGEDHN
CC[C@@H](C)CCC(=O)N[C@H]1C[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001752771387	1440206000	/nfs/dbraw/zinc/20/60/00/1440206000.db2.gz	PFQBSEAYQSDLNY-LZQZEXGQSA-N	0	3	330.447	3.240	20	30		EGEDHN
CC(C)(C)/C=C\C(=O)N1CCC[C@@H](CNCc2ccccc2C#N)C1	ZINC001752795713	1440214339	/nfs/dbraw/zinc/21/43/39/1440214339.db2.gz	YKYJZQVMJFCEKQ-MQNTZWLQSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@@](C)(OC)c1ccccc1	ZINC001752823927	1440222564	/nfs/dbraw/zinc/22/25/64/1440222564.db2.gz	MUKXBZLLTITGDK-QUCCMNQESA-N	0	3	330.472	3.095	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCCC[C@@H]1CNCc1c(C)noc1C	ZINC001752827486	1440224234	/nfs/dbraw/zinc/22/42/34/1440224234.db2.gz	PCKLSNJWSIGTTC-MRXNPFEDSA-N	0	3	333.476	3.364	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)COCCCCCC	ZINC001752834560	1440226931	/nfs/dbraw/zinc/22/69/31/1440226931.db2.gz	UKTFKIHTNUXXPJ-RTBURBONSA-N	0	3	334.504	3.062	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)Cc2cc(F)c(C)cc2F)C1	ZINC001752836452	1440228020	/nfs/dbraw/zinc/22/80/20/1440228020.db2.gz	NHDGNFRXIRLRSZ-JKSUJKDBSA-N	0	3	348.437	3.056	20	30		EGEDHN
C#CCCCC(=O)NC[C@H](C)NCc1ccc(Cl)c(Cl)c1	ZINC001752870894	1440237151	/nfs/dbraw/zinc/23/71/51/1440237151.db2.gz	PYBALRKJHVWJEP-LBPRGKRZSA-N	0	3	327.255	3.391	20	30		EGEDHN
CC(C)c1ccc(C(=O)NC[C@@H](C)NCc2ccc(C#N)s2)cn1	ZINC001752879935	1440238671	/nfs/dbraw/zinc/23/86/71/1440238671.db2.gz	OPXCNRBGJHBHHJ-CYBMUJFWSA-N	0	3	342.468	3.046	20	30		EGEDHN
C[C@H](CNC(=O)C[C@H](C)c1ccco1)NCc1ccc(F)c(C#N)c1	ZINC001752912678	1440246022	/nfs/dbraw/zinc/24/60/22/1440246022.db2.gz	DSQUGQGXNNKZIK-UONOGXRCSA-N	0	3	343.402	3.078	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H](C)N[C@@H](C)c2ccccc2F)CCOCC1	ZINC001752916194	1440247105	/nfs/dbraw/zinc/24/71/05/1440247105.db2.gz	KWZJEUNUFRXRER-CVEARBPZSA-N	0	3	348.462	3.354	20	30		EGEDHN
C#CCC1(C(=O)NC[C@H](C)NCc2sc(C)nc2C)CCCCC1	ZINC001752922542	1440249238	/nfs/dbraw/zinc/24/92/38/1440249238.db2.gz	NVNYSVMYBGPREU-AWEZNQCLSA-N	0	3	347.528	3.328	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H]1CCC[C@H](NCc2cnc(C)cn2)C1	ZINC001752968594	1440254609	/nfs/dbraw/zinc/25/46/09/1440254609.db2.gz	LWAFPNSNLJEPCS-ZWKOTPCHSA-N	0	3	342.487	3.070	20	30		EGEDHN
CC#CCN(C)[C@H]1CCCN(C(=O)c2ccc(N(C)CCC)cc2)C1	ZINC001753001009	1440264640	/nfs/dbraw/zinc/26/46/40/1440264640.db2.gz	RBGXOISBWIOAMC-FQEVSTJZSA-N	0	3	341.499	3.093	20	30		EGEDHN
C=C(Br)CN[C@H](C)CCNC(=O)C1CCCCCC1	ZINC001753003072	1440265187	/nfs/dbraw/zinc/26/51/87/1440265187.db2.gz	SQTJUWHNTBIGNL-CYBMUJFWSA-N	0	3	331.298	3.350	20	30		EGEDHN
C[C@H](CCNC(=O)C1(F)CCCCC1)NCc1cc(C#N)ccc1F	ZINC001753017538	1440268970	/nfs/dbraw/zinc/26/89/70/1440268970.db2.gz	PQKBKKZEHOWWLA-CQSZACIVSA-N	0	3	349.425	3.354	20	30		EGEDHN
C[C@@H](C(=O)NCCC[C@@H]1CCCN1Cc1ccccc1C#N)C1CC1	ZINC001753025647	1440271345	/nfs/dbraw/zinc/27/13/45/1440271345.db2.gz	YKQRJSRJKUCNHU-OXQOHEQNSA-N	0	3	339.483	3.465	20	30		EGEDHN
O=C(C#CC1CC1)NCCC[C@@H]1CCCN1Cc1cccc(F)c1F	ZINC001753028016	1440272040	/nfs/dbraw/zinc/27/20/40/1440272040.db2.gz	BJUJIBJBQSXGTR-QGZVFWFLSA-N	0	3	346.421	3.239	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCC[C@@H]1CCCN1Cc1nccnc1C	ZINC001753033404	1440273714	/nfs/dbraw/zinc/27/37/14/1440273714.db2.gz	LVTHKLMSJATQCJ-YLJYHZDGSA-N	0	3	344.503	3.248	20	30		EGEDHN
CCN(CCNC(=O)c1cc(F)ccc1C)Cc1cccc(C#N)c1	ZINC001753086526	1440296514	/nfs/dbraw/zinc/29/65/14/1440296514.db2.gz	VQGLAGOITXJDLC-UHFFFAOYSA-N	0	3	339.414	3.258	20	30		EGEDHN
C=CCC1(C(=O)NCCN(CC)C[C@@H]2CC(C)(C)CO2)CCCC1	ZINC001753095577	1440302391	/nfs/dbraw/zinc/30/23/91/1440302391.db2.gz	BOBXWMHXMOABFD-KRWDZBQOSA-N	0	3	336.520	3.376	20	30		EGEDHN
C#CCCN1CCC[C@H]1CNC(=O)c1ccc(OCCCC)cc1	ZINC001753116783	1440311709	/nfs/dbraw/zinc/31/17/09/1440311709.db2.gz	ZSQBHCGVHXJDLV-SFHVURJKSA-N	0	3	328.456	3.083	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@H]1CCN(Cc2c(C)nsc2C)C1	ZINC001753133356	1440317711	/nfs/dbraw/zinc/31/77/11/1440317711.db2.gz	VRBZUNFQLYNNLV-QGZVFWFLSA-N	0	3	347.528	3.282	20	30		EGEDHN
CC[C@@H](CC1CCCCC1)C(=O)NC[C@H]1CCN(CC#CCOC)C1	ZINC001753135253	1440318561	/nfs/dbraw/zinc/31/85/61/1440318561.db2.gz	JEDAZXKMXGSVAZ-UXHICEINSA-N	0	3	348.531	3.071	20	30		EGEDHN
CC#CCN(CCC)CCNC(=O)C1(c2cccc(F)c2)CCC1	ZINC001753146177	1440324605	/nfs/dbraw/zinc/32/46/05/1440324605.db2.gz	LCEFXKONMFKULO-UHFFFAOYSA-N	0	3	330.447	3.099	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCN(CCC)Cc2ccc(C)nc2C)cc1	ZINC001753146350	1440324672	/nfs/dbraw/zinc/32/46/72/1440324672.db2.gz	RWHLLKLUZYNVDH-UHFFFAOYSA-N	0	3	349.478	3.322	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCN(CCC)Cc2ccccc2N(C)C)C1	ZINC001753147563	1440325598	/nfs/dbraw/zinc/32/55/98/1440325598.db2.gz	IUSCTFMAJQNOBE-UHFFFAOYSA-N	0	3	343.515	3.437	20	30		EGEDHN
CC[C@H](F)C(=O)NCCCN(CC#Cc1ccc(F)cc1)C(C)C	ZINC001753290319	1440350097	/nfs/dbraw/zinc/35/00/97/1440350097.db2.gz	RZLFSODIAHNNEF-SFHVURJKSA-N	0	3	336.426	3.142	20	30		EGEDHN
C=CCN[C@H](CNC(=O)Cc1cccc2ncccc12)c1ccccc1	ZINC001753300404	1440353658	/nfs/dbraw/zinc/35/36/58/1440353658.db2.gz	RXACATWJBTZUGD-OAQYLSRUSA-N	0	3	345.446	3.410	20	30		EGEDHN
C#CCCN[C@@H](CNC(=O)C[C@H]1CCC(C)(C)CO1)c1ccccc1	ZINC001753300571	1440353875	/nfs/dbraw/zinc/35/38/75/1440353875.db2.gz	WJXJBEJTQZTDDB-MOPGFXCFSA-N	0	3	342.483	3.052	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CCC)C(=O)c2ccc3nc(C)ccc3c2)C1	ZINC001753320259	1440362855	/nfs/dbraw/zinc/36/28/55/1440362855.db2.gz	XPLMLIQJDYUISJ-HXUWFJFHSA-N	0	3	349.478	3.493	20	30		EGEDHN
CC[C@@H](C)CC(=O)NCC[C@@H]1CCN(CC#Cc2ccc(F)cc2)C1	ZINC001753326369	1440366862	/nfs/dbraw/zinc/36/68/62/1440366862.db2.gz	JSUHJWDZHWLMKD-IEBWSBKVSA-N	0	3	344.474	3.442	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](CN(C)Cc2oc(CC)nc2C)C1	ZINC001753354942	1440379747	/nfs/dbraw/zinc/37/97/47/1440379747.db2.gz	MBBDSIMXZXVEQI-INIZCTEOSA-N	0	3	333.476	3.182	20	30		EGEDHN
C=C(C)CN1CCC[C@H](N(Cc2ccccc2)C(=O)COCC)C1	ZINC001753361741	1440383193	/nfs/dbraw/zinc/38/31/93/1440383193.db2.gz	NRAWCDYONMZJCI-IBGZPJMESA-N	0	3	330.472	3.092	20	30		EGEDHN
C=CCCCN1C[C@@H]2C[C@H]1CN2C(=O)C1(c2ccc(F)cc2)CCC1	ZINC001753423061	1440395973	/nfs/dbraw/zinc/39/59/73/1440395973.db2.gz	VKKGOGXQBPVYPJ-OALUTQOASA-N	0	3	342.458	3.499	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H]2C[C@H]1CN2C(=O)c1ncccc1OC(C)C	ZINC001753426544	1440397155	/nfs/dbraw/zinc/39/71/55/1440397155.db2.gz	FJNNOXIDYZGBBM-IKGGRYGDSA-N	0	3	343.471	3.122	20	30		EGEDHN
C=CCCC(=O)N(C)[C@H]1CCN(CCCOc2ccccc2C)C1	ZINC001753433731	1440399188	/nfs/dbraw/zinc/39/91/88/1440399188.db2.gz	MQFPHZACNCJTJD-SFHVURJKSA-N	0	3	330.472	3.263	20	30		EGEDHN
C#CCCCC(=O)N(CC)[C@@H]1CCN([C@@H](C)c2cccc(OC)c2)C1	ZINC001753456045	1440408168	/nfs/dbraw/zinc/40/81/68/1440408168.db2.gz	QXNLNKMJEDIFDR-PKOBYXMFSA-N	0	3	342.483	3.483	20	30		EGEDHN
CC[C@H](CNC(=O)C(C)C)NCC#Cc1ccc(C(F)(F)F)cc1	ZINC001753465511	1440412616	/nfs/dbraw/zinc/41/26/16/1440412616.db2.gz	BFVVFEAOTKZISI-MRXNPFEDSA-N	0	3	340.389	3.197	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H](CC)N[C@H](C)C(=O)Nc1ccccc1	ZINC001753481563	1440416774	/nfs/dbraw/zinc/41/67/74/1440416774.db2.gz	SRJXVKMVKGKNBK-HZPDHXFCSA-N	0	3	345.487	3.100	20	30		EGEDHN
C=C(C)CCC(=O)N[C@](C)(CNCc1ccncc1Cl)C1CC1	ZINC001753518390	1440428102	/nfs/dbraw/zinc/42/81/02/1440428102.db2.gz	HGLMCSKJLKJZIV-GOSISDBHSA-N	0	3	335.879	3.466	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)Cc1ccc2c(c1)CCC2)C1CC1	ZINC001753526724	1440429778	/nfs/dbraw/zinc/42/97/78/1440429778.db2.gz	BLCRBCITTHUKRN-FQEVSTJZSA-N	0	3	346.902	3.345	20	30		EGEDHN
Cc1nocc1CNC[C@]1(NC(=O)C#CC(C)(C)C)CCCC[C@@H]1C	ZINC001753531683	1440431295	/nfs/dbraw/zinc/43/12/95/1440431295.db2.gz	LLYRHCOHMDCPCF-MGPUTAFESA-N	0	3	345.487	3.187	20	30		EGEDHN
C=C(C)CCC(=O)NCC1(NCC(=O)Nc2ccccc2)CCCC1	ZINC001753664014	1440459563	/nfs/dbraw/zinc/45/95/63/1440459563.db2.gz	MZYRMWAHGZFYJB-UHFFFAOYSA-N	0	3	343.471	3.000	20	30		EGEDHN
COc1ccc(C#N)cc1CNC[C@H](C)N(C)C(=O)CC1CCCC1	ZINC001753678154	1440463859	/nfs/dbraw/zinc/46/38/59/1440463859.db2.gz	XVKGNOOBDZHMIG-HNNXBMFYSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N(C)[C@@H](C)CNCc1ccc(C#N)c(F)c1	ZINC001753709386	1440470160	/nfs/dbraw/zinc/47/01/60/1440470160.db2.gz	XSVUORICRXALEP-LSDHHAIUSA-N	0	3	331.435	3.236	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N(C)[C@H](C)CNCC#Cc1ccc(F)cc1	ZINC001753710618	1440470440	/nfs/dbraw/zinc/47/04/40/1440470440.db2.gz	GKQMQEBNNUFICH-SZVBFZGTSA-N	0	3	330.447	3.050	20	30		EGEDHN
CCCC(C)(C)C(=O)N(C)[C@H](C)CNCC#Cc1ccc(F)cc1	ZINC001753711152	1440470662	/nfs/dbraw/zinc/47/06/62/1440470662.db2.gz	VVHZDJBSXNHKLN-MRXNPFEDSA-N	0	3	332.463	3.440	20	30		EGEDHN
C=CCCCC(=O)N(C)[C@@H](C)CNCC#Cc1cccc(Cl)c1	ZINC001753711361	1440470717	/nfs/dbraw/zinc/47/07/17/1440470717.db2.gz	YQCVYXFHYQQKJJ-INIZCTEOSA-N	0	3	332.875	3.484	20	30		EGEDHN
CC(C)C[C@H](CNCc1ccc(C#N)s1)NC(=O)[C@H]1C[C@H]2C[C@H]2C1	ZINC001753738108	1440478380	/nfs/dbraw/zinc/47/83/80/1440478380.db2.gz	CRICICHOQVTOMF-FXUDXRNXSA-N	0	3	345.512	3.286	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCCCN1C(=O)c1ccc2n[nH]cc2c1	ZINC001753783531	1440487746	/nfs/dbraw/zinc/48/77/46/1440487746.db2.gz	DVODBBLRABUKRP-MRXNPFEDSA-N	0	3	346.862	3.290	20	30		EGEDHN
CC(F)(F)CC(=O)N1CCCC[C@H]1CCNCc1ccccc1C#N	ZINC001753796504	1440489865	/nfs/dbraw/zinc/48/98/65/1440489865.db2.gz	KBJDYLKKAPAZKY-KRWDZBQOSA-N	0	3	349.425	3.464	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H](C)[C@H]1CNCc1c(C)noc1CC	ZINC001753820690	1440495573	/nfs/dbraw/zinc/49/55/73/1440495573.db2.gz	ZYJDASOANDXXMN-CRAIPNDOSA-N	0	3	345.487	3.066	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1ccc2cc(C)cn2c1)C(C)C	ZINC001753829932	1440499383	/nfs/dbraw/zinc/49/93/83/1440499383.db2.gz	DKNAJFXBFQHCHF-QGZVFWFLSA-N	0	3	333.863	3.344	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H](NCc2ccnn2C)C(C)C)CCCCC1	ZINC001753845658	1440504265	/nfs/dbraw/zinc/50/42/65/1440504265.db2.gz	OKWYZQOPPVWMJH-GOSISDBHSA-N	0	3	346.519	3.177	20	30		EGEDHN
C[C@H](CCNCc1cc(C#N)ccc1F)NC(=O)[C@H]1CC=CCC1	ZINC001753944182	1440524775	/nfs/dbraw/zinc/52/47/75/1440524775.db2.gz	IDJQWNCKFLHYGB-ZBFHGGJFSA-N	0	3	329.419	3.038	20	30		EGEDHN
C#Cc1cncc(C(=O)N(CC)CCN[C@@H](C)c2ccccc2F)c1	ZINC001754065900	1440537433	/nfs/dbraw/zinc/53/74/33/1440537433.db2.gz	AIYRLQUYMZLIHN-HNNXBMFYSA-N	0	3	339.414	3.015	20	30		EGEDHN
CCc1ccccc1CC(=O)NC/C=C\CNCc1ccc(C#N)cc1	ZINC001754138888	1440544176	/nfs/dbraw/zinc/54/41/76/1440544176.db2.gz	WQXAIDUNBVNZCF-WAYWQWQTSA-N	0	3	347.462	3.125	20	30		EGEDHN
N#Cc1ccc(CNC/C=C/CNC(=O)c2cc(Cl)cs2)cc1	ZINC001754179844	1440548001	/nfs/dbraw/zinc/54/80/01/1440548001.db2.gz	PVDPURCUPFIWGN-OWOJBTEDSA-N	0	3	345.855	3.349	20	30		EGEDHN
CC(C)[C@]1(C)C[C@H]1C(=O)NC/C=C/CNCc1cccc(C#N)c1	ZINC001754190181	1440548915	/nfs/dbraw/zinc/54/89/15/1440548915.db2.gz	BOEZAJBMQZVCKG-BJUCQYRTSA-N	0	3	325.456	3.002	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H](C)CNCc2ccccc2Cl)cc1	ZINC001754237533	1440555080	/nfs/dbraw/zinc/55/50/80/1440555080.db2.gz	KEZWOPATJAXSQW-CQSZACIVSA-N	0	3	326.827	3.229	20	30		EGEDHN
CC[C@H](C)C(=O)N[C@@H](C)CNCC#Cc1ccc(C(F)(F)F)cc1	ZINC001754260181	1440559950	/nfs/dbraw/zinc/55/99/50/1440559950.db2.gz	QSWQHNZTZZRORQ-KBPBESRZSA-N	0	3	340.389	3.197	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H](C)CNCC#Cc2ccc(Cl)cc2)C1	ZINC001754281696	1440563375	/nfs/dbraw/zinc/56/33/75/1440563375.db2.gz	ALVWRRSUYHHZIB-HNNXBMFYSA-N	0	3	330.859	3.142	20	30		EGEDHN
Cc1cc(C)c(CC(=O)N[C@@H](C)CNCC#Cc2ccccc2)s1	ZINC001754293983	1440565922	/nfs/dbraw/zinc/56/59/22/1440565922.db2.gz	QRZMJEFKABCHAL-INIZCTEOSA-N	0	3	340.492	3.053	20	30		EGEDHN
C[C@@H](CN(C)Cc1ccc(C2CC2)cc1)NC(=O)c1ccc(C#N)[nH]1	ZINC001754306246	1440571158	/nfs/dbraw/zinc/57/11/58/1440571158.db2.gz	WTFBNUOJCXDGSP-AWEZNQCLSA-N	0	3	336.439	3.014	20	30		EGEDHN
C[C@@H](CN(C)Cc1cccc(C#N)c1)NC(=O)[C@H](F)c1ccccc1	ZINC001754326823	1440581256	/nfs/dbraw/zinc/58/12/56/1440581256.db2.gz	RSFLUOFMYOLZJG-HNAYVOBHSA-N	0	3	339.414	3.206	20	30		EGEDHN
C#CCCCCC(=O)N[C@H]1CCCC[C@@H]1CNCc1ncc(C)s1	ZINC001754339477	1440587895	/nfs/dbraw/zinc/58/78/95/1440587895.db2.gz	FIDNIWYNAFACDB-SJORKVTESA-N	0	3	347.528	3.410	20	30		EGEDHN
C=C(Br)CNCCCN(C)C(=O)[C@H]1CCC(C)(C)C1	ZINC001754394495	1440594511	/nfs/dbraw/zinc/59/45/11/1440594511.db2.gz	BQAHDYSEQBVBIR-ZDUSSCGKSA-N	0	3	331.298	3.159	20	30		EGEDHN
CCC[C@H](C)C(=O)N[C@@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001754436300	1440598136	/nfs/dbraw/zinc/59/81/36/1440598136.db2.gz	SVIUIHCIBZRLIW-UGSOOPFHSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=CCC[C@H](C)N1CC[C@@H]1CNC(=O)c1cnccc1C(F)(F)F	ZINC001754494931	1440611645	/nfs/dbraw/zinc/61/16/45/1440611645.db2.gz	AYLKIXPWCGPIDC-QWHCGFSZSA-N	0	3	341.377	3.259	20	30		EGEDHN
CCCCCCCN1CC[C@H]1CNC(=O)[C@H]1Cc2cc(F)ccc2O1	ZINC001754495024	1440611687	/nfs/dbraw/zinc/61/16/87/1440611687.db2.gz	CVWIJCKMIHUTOT-PKOBYXMFSA-N	0	3	348.462	3.290	20	30		EGEDHN
CC[C@@H](C)CCC(=O)NCC1(NCc2ccc(F)c(C#N)c2)CC1	ZINC001754529291	1440621846	/nfs/dbraw/zinc/62/18/46/1440621846.db2.gz	DUCBYXMKOYPXED-CQSZACIVSA-N	0	3	331.435	3.262	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1C[C@H]2CCC[C@@H](C1)N2CCCC(C)C	ZINC001754550595	1440629835	/nfs/dbraw/zinc/62/98/35/1440629835.db2.gz	WOEBWJXQCVLDLF-GBESFXJTSA-N	0	3	336.520	3.469	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@]2(C1)CCCN(Cc1ccccn1)C2	ZINC001754557685	1440632258	/nfs/dbraw/zinc/63/22/58/1440632258.db2.gz	QWOMDFWUFIVUGZ-OAQYLSRUSA-N	0	3	339.483	3.090	20	30		EGEDHN
CCC[C@H](C)C(=O)N1CC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001754563417	1440634617	/nfs/dbraw/zinc/63/46/17/1440634617.db2.gz	JRBOPXHHVXAPOL-LAUBAEHRSA-N	0	3	339.483	3.419	20	30		EGEDHN
C[C@@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)CCC(C)(F)F	ZINC001754596293	1440641586	/nfs/dbraw/zinc/64/15/86/1440641586.db2.gz	DVZUBVUCTLSWRR-PBHICJAKSA-N	0	3	349.425	3.463	20	30		EGEDHN
C[C@@H]1C[C@H](NCc2ccccc2C#N)CCN1C(=O)C1(CCF)CC1	ZINC001754596857	1440641642	/nfs/dbraw/zinc/64/16/42/1440641642.db2.gz	ICGQIRPSWDNTNV-CRAIPNDOSA-N	0	3	343.446	3.167	20	30		EGEDHN
CCCCC(=O)N1CCC[C@H]1CNCC#Cc1cccc(Cl)c1	ZINC001754606387	1440643234	/nfs/dbraw/zinc/64/32/34/1440643234.db2.gz	OKMBTRBGSPKYDT-SFHVURJKSA-N	0	3	332.875	3.462	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CCC[C@H]1CNCc1cc(C)ccc1F	ZINC001754608527	1440643443	/nfs/dbraw/zinc/64/34/43/1440643443.db2.gz	RGRPNRUFEKGELJ-WMZOPIPTSA-N	0	3	348.462	3.196	20	30		EGEDHN
C=CCCCC(=O)NC1(C)CCN(Cc2ccc3nonc3c2)CC1	ZINC001754628694	1440647036	/nfs/dbraw/zinc/64/70/36/1440647036.db2.gz	CDSWYTOQXVPYEO-UHFFFAOYSA-N	0	3	342.443	3.050	20	30		EGEDHN
C#CCN(C(=O)C(C)C)C1CCN(Cc2ccc3c(c2)CCC3)CC1	ZINC001754634575	1440648348	/nfs/dbraw/zinc/64/83/48/1440648348.db2.gz	RDBPJGPAFXCWNJ-UHFFFAOYSA-N	0	3	338.495	3.258	20	30		EGEDHN
C#CCN(C(=O)C[C@@H]1CC[C@@H](C)C1)C1CCN(CCOC(C)C)CC1	ZINC001754639775	1440648983	/nfs/dbraw/zinc/64/89/83/1440648983.db2.gz	VZTICUDCMCAXJQ-RTBURBONSA-N	0	3	348.531	3.164	20	30		EGEDHN
C#CCNC[C@H](NC(=O)C1(CCF)CC1)c1ccc2ccccc2c1	ZINC001754643542	1440649447	/nfs/dbraw/zinc/64/94/47/1440649447.db2.gz	BADKPBNSMPLTBF-IBGZPJMESA-N	0	3	338.426	3.360	20	30		EGEDHN
CC#CCNC[C@@H](NC(=O)c1ncoc1C)c1ccc2ccccc2c1	ZINC001754644180	1440649634	/nfs/dbraw/zinc/64/96/34/1440649634.db2.gz	PRNZNBPINNTADQ-LJQANCHMSA-N	0	3	347.418	3.220	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@]1(C)CCN(Cc2ccc(C3CCC3)cc2)C1	ZINC001754668800	1440657409	/nfs/dbraw/zinc/65/74/09/1440657409.db2.gz	SHLKZXOOSMVNFK-FOIQADDNSA-N	0	3	325.456	3.194	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@](C)(CNCc2cc(C3CC3)no2)C1	ZINC001754692836	1440666484	/nfs/dbraw/zinc/66/64/84/1440666484.db2.gz	NKFQXHCFNFUDSY-HXUWFJFHSA-N	0	3	343.471	3.074	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@](C)(CN[C@H](C)c3cnccn3)C2)CC1	ZINC001754704974	1440668913	/nfs/dbraw/zinc/66/89/13/1440668913.db2.gz	SRZJDACIYMVDPB-UZLBHIALSA-N	0	3	342.487	3.112	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCC1(C)CCN(Cc2cc(C)no2)CC1	ZINC001754720355	1440673031	/nfs/dbraw/zinc/67/30/31/1440673031.db2.gz	MTXPCETWXIVDPO-IBGZPJMESA-N	0	3	333.476	3.304	20	30		EGEDHN
C#CCN1CCC(C)(CNC(=O)[C@@H](c2ccccc2)C(C)C)CC1	ZINC001754720718	1440673057	/nfs/dbraw/zinc/67/30/57/1440673057.db2.gz	SHDRKBXWULILPQ-LJQANCHMSA-N	0	3	326.484	3.278	20	30		EGEDHN
C=CCCC(=O)NC[C@]1(C)CCCN(Cc2sc(C)nc2C)C1	ZINC001754725234	1440675399	/nfs/dbraw/zinc/67/53/99/1440675399.db2.gz	XXSFEWJWDOSHFG-SFHVURJKSA-N	0	3	335.517	3.444	20	30		EGEDHN
C=CCN1CCC[C@](C)(CNC(=O)c2cc3cccc(OC)c3o2)C1	ZINC001754729518	1440678307	/nfs/dbraw/zinc/67/83/07/1440678307.db2.gz	LJOANGIFCIMUSY-HXUWFJFHSA-N	0	3	342.439	3.459	20	30		EGEDHN
C=CCN1CCC[C@](C)(CNC(=O)Cc2c[nH]c3cc(C)ccc23)C1	ZINC001754732118	1440680231	/nfs/dbraw/zinc/68/02/31/1440680231.db2.gz	NTJHAWWKWUGLLX-OAQYLSRUSA-N	0	3	339.483	3.423	20	30		EGEDHN
C=C(C)CN[C@H](CNC(=O)Cc1cc(C)on1)c1ccccc1CC	ZINC001754785683	1440687693	/nfs/dbraw/zinc/68/76/93/1440687693.db2.gz	PIWVJXDKYILECO-LJQANCHMSA-N	0	3	341.455	3.111	20	30		EGEDHN
C#CCCN[C@H](CNC(=O)C(C)(C)C1CC1)c1ccccc1CC	ZINC001754786134	1440687808	/nfs/dbraw/zinc/68/78/08/1440687808.db2.gz	VDWOVOUNUVMSHZ-LJQANCHMSA-N	0	3	326.484	3.455	20	30		EGEDHN
C=C(C)CN[C@@H](CNC(=O)[C@H]1CCCOCC1)c1ccccc1CC	ZINC001754786299	1440687888	/nfs/dbraw/zinc/68/78/88/1440687888.db2.gz	WTJITXQFKQZRMU-ICSRJNTNSA-N	0	3	344.499	3.389	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H]([C@H](C)NCc2csc(CC)n2)C1	ZINC001754801035	1440690307	/nfs/dbraw/zinc/69/03/07/1440690307.db2.gz	YFSDHEASJOSQBU-GJZGRUSLSA-N	0	3	335.517	3.388	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@H]1CC[C@H](C[NH2+][C@H](C)c2nnc(C)[n-]2)CC1	ZINC001754833995	1440696286	/nfs/dbraw/zinc/69/62/86/1440696286.db2.gz	TVGFJHWXYVOJOJ-DJIMGWMZSA-N	0	3	347.507	3.043	20	30		EGEDHN
C=C(C)CCC(=O)N[C@]1(CO)CCCN(Cc2ccc(C)c(C)c2)C1	ZINC001754856405	1440700615	/nfs/dbraw/zinc/70/06/15/1440700615.db2.gz	KNRIHKSQWOYGIK-OAQYLSRUSA-N	0	3	344.499	3.103	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1ccc(F)cc1	ZINC001754865236	1440702788	/nfs/dbraw/zinc/70/27/88/1440702788.db2.gz	IRYPGGKJLFUBEQ-MOPGFXCFSA-N	0	3	328.431	3.195	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CCN(C(=O)/C=C(/C)CC)C1	ZINC001754914879	1440708446	/nfs/dbraw/zinc/70/84/46/1440708446.db2.gz	NZRUGGPJHMKENO-FWLQQBITSA-N	0	3	329.282	3.080	20	30		EGEDHN
C#CCN[C@@H](C)c1ccc(CNC(=O)c2cc(C)cc3c[nH]nc32)cc1	ZINC001754948706	1440714316	/nfs/dbraw/zinc/71/43/16/1440714316.db2.gz	NOGMKTNVSDDUBQ-HNNXBMFYSA-N	0	3	346.434	3.085	20	30		EGEDHN
CC#CCN[C@@H](C)c1ccc(CNC(=O)CN(C)c2ccccc2)cc1	ZINC001754951026	1440714919	/nfs/dbraw/zinc/71/49/19/1440714919.db2.gz	GNIREUSHLJCLHA-SFHVURJKSA-N	0	3	349.478	3.113	20	30		EGEDHN
CC#CCCCC(=O)NCC1(NCc2sc(C)nc2C)CCC1	ZINC001754985258	1440722604	/nfs/dbraw/zinc/72/26/04/1440722604.db2.gz	MFVZOYOQWGXWKO-UHFFFAOYSA-N	0	3	333.501	3.082	20	30		EGEDHN
C=CCC1(C(=O)N2CCO[C@H](CNCc3ccsc3)C2)CCCC1	ZINC001755018317	1440726289	/nfs/dbraw/zinc/72/62/89/1440726289.db2.gz	WTDLEQFJDDMYFP-QGZVFWFLSA-N	0	3	348.512	3.202	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1CCCN(Cc2cncc(C)c2)CC1	ZINC001755028705	1440730298	/nfs/dbraw/zinc/73/02/98/1440730298.db2.gz	PFRSJAXNHZQIPJ-HXUWFJFHSA-N	0	3	341.499	3.444	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1CCCN(C[C@H](O)c2ccccc2F)CC1	ZINC001755028809	1440730413	/nfs/dbraw/zinc/73/04/13/1440730413.db2.gz	PUYMLXBRVMYEIE-YJBOKZPZSA-N	0	3	348.462	3.042	20	30		EGEDHN
COCC#CCN1CCC[C@H](NC(=O)c2ccc(C(C)C)cc2)CC1	ZINC001755031591	1440731951	/nfs/dbraw/zinc/73/19/51/1440731951.db2.gz	VKTBCBNCQCGSCK-FQEVSTJZSA-N	0	3	342.483	3.044	20	30		EGEDHN
C[C@H]1CN(C(=O)c2ccoc2Cl)C[C@H]1NCC#Cc1ccccc1	ZINC001755108956	1440754050	/nfs/dbraw/zinc/75/40/50/1440754050.db2.gz	OEVMCPISJMCRIO-WMLDXEAASA-N	0	3	342.826	3.035	20	30		EGEDHN
C=Cc1ccc(C(=O)N2C[C@@H](C)[C@@H](NCC#Cc3ccccc3)C2)cc1	ZINC001755116401	1440754970	/nfs/dbraw/zinc/75/49/70/1440754970.db2.gz	NFFHRYWYVVMGGP-GCJKJVERSA-N	0	3	344.458	3.431	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CCN(Cc2scnc2C)[C@H](C)C1	ZINC001755164502	1440766331	/nfs/dbraw/zinc/76/63/31/1440766331.db2.gz	WOMFEONFZNJNTN-GDBMZVCRSA-N	0	3	333.501	3.114	20	30		EGEDHN
CC#CCN1CCC2(CC1)CN(C(=O)CCCCCC(C)C)CCO2	ZINC001755174753	1440770558	/nfs/dbraw/zinc/77/05/58/1440770558.db2.gz	WIUBLARYDBVMKT-UHFFFAOYSA-N	0	3	348.531	3.310	20	30		EGEDHN
COCC#CCN1CCC2(CC1)CCN(C(=O)[C@H](C)C(C)(C)C)CC2	ZINC001755175855	1440770807	/nfs/dbraw/zinc/77/08/07/1440770807.db2.gz	JYWAUTWHMWIBNG-SFHVURJKSA-N	0	3	348.531	3.023	20	30		EGEDHN
C#CCCN[C@@H]1c2ccccc2C[C@H]1NC(=O)C1(C2CCC2)CCC1	ZINC001755187048	1440773435	/nfs/dbraw/zinc/77/34/35/1440773435.db2.gz	SSFGBNXXUSGHAL-WOJBJXKFSA-N	0	3	336.479	3.352	20	30		EGEDHN
CN(CCOC1CCCCCC1)C[C@@H]1CCCN1C(=O)C#CC1CC1	ZINC001755192506	1440775277	/nfs/dbraw/zinc/77/52/77/1440775277.db2.gz	GUWCOHSOSNTKQW-IBGZPJMESA-N	0	3	346.515	3.062	20	30		EGEDHN
C[C@@H](NCC#Cc1cccc(Cl)c1)[C@H](C)NC(=O)C1CCCC1	ZINC001755225208	1440785784	/nfs/dbraw/zinc/78/57/84/1440785784.db2.gz	YYWARCHCAGGTOZ-CABCVRRESA-N	0	3	332.875	3.365	20	30		EGEDHN
C[C@@H](NCC#Cc1ccccc1)[C@H](C)NC(=O)c1cccc2cc[nH]c21	ZINC001755258783	1440793957	/nfs/dbraw/zinc/79/39/57/1440793957.db2.gz	VSYNKUZCKRDPOI-SJORKVTESA-N	0	3	345.446	3.316	20	30		EGEDHN
C=CCC(C)(C)C(=O)N(C)C1CCC(N[C@@H](C)c2cnccn2)CC1	ZINC001755276108	1440799159	/nfs/dbraw/zinc/79/91/59/1440799159.db2.gz	SPEWXKPUHMACIY-GTPINHCMSA-N	0	3	344.503	3.499	20	30		EGEDHN
C=C/C(C)=C/CC(=O)N(C)CC(C)(C)CNCC(=C)Br	ZINC001755284190	1440801602	/nfs/dbraw/zinc/80/16/02/1440801602.db2.gz	JOKPWOYPPBUAEV-MDWZMJQESA-N	0	3	343.309	3.492	20	30		EGEDHN
C=CCC1(C(=O)N(C)CC(C)(C)CNCC(=C)Cl)CCOCC1	ZINC001755288746	1440803096	/nfs/dbraw/zinc/80/30/96/1440803096.db2.gz	BMWMBLHMFWVRRH-UHFFFAOYSA-N	0	3	342.911	3.186	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)[C@@H](OC)[C@@H](C)CC)CCCCC1	ZINC001755352582	1440828346	/nfs/dbraw/zinc/82/83/46/1440828346.db2.gz	GKFJVTMGUSGYEH-ZFWWWQNUSA-N	0	3	330.900	3.209	20	30		EGEDHN
CC(C)C#CC(=O)NC[C@@H]1CCCCCN1CCc1ccccc1F	ZINC001755364100	1440833403	/nfs/dbraw/zinc/83/34/03/1440833403.db2.gz	QPPQVNNFFROGMH-IBGZPJMESA-N	0	3	344.474	3.388	20	30		EGEDHN
C=CCOCCN1CCCCC[C@H]1CNC(=O)c1ccc(C)cc1F	ZINC001755367845	1440835667	/nfs/dbraw/zinc/83/56/67/1440835667.db2.gz	JKKCXJRZRBPEOQ-KRWDZBQOSA-N	0	3	348.462	3.311	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H](C)C1CN(CCc2scnc2C)C1	ZINC001755376763	1440838205	/nfs/dbraw/zinc/83/82/05/1440838205.db2.gz	JLDKZQXTYARAMH-ZDUSSCGKSA-N	0	3	335.517	3.033	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)[C@H](C)CCc2ccccc2F)C(C)(C)C1	ZINC001755412375	1440846717	/nfs/dbraw/zinc/84/67/17/1440846717.db2.gz	UCMBABYIANBDKW-VQIMIIECSA-N	0	3	344.474	3.244	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)C[C@H](C)c2ccccc2OC)C(C)(C)C1	ZINC001755415977	1440848901	/nfs/dbraw/zinc/84/89/01/1440848901.db2.gz	MYHCXNLIHIDZGM-YJBOKZPZSA-N	0	3	330.472	3.201	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CC[C@@H](NC(=O)CCc3ccco3)C[C@H]2C1	ZINC001755449463	1440852733	/nfs/dbraw/zinc/85/27/33/1440852733.db2.gz	FXTWUZOSCGODPQ-HRCADAONSA-N	0	3	336.863	3.181	20	30		EGEDHN
C=C(Cl)CNC[C@H]1C[C@H](NC(=O)C2CCc3ccccc3CC2)C1	ZINC001755473514	1440859159	/nfs/dbraw/zinc/85/91/59/1440859159.db2.gz	NNIBHXBVYTZVKX-RHDGDCLCSA-N	0	3	346.902	3.419	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1C[C@H](CNCc2oc(C(C)C)nc2C)C1	ZINC001755476669	1440859486	/nfs/dbraw/zinc/85/94/86/1440859486.db2.gz	TYPVYGHFLVHZLV-SHTZXODSSA-N	0	3	333.476	3.303	20	30		EGEDHN
C=C(Cl)CNC[C@H]1C[C@H](NC(=O)[C@@H](C)c2ccc(F)cc2F)C1	ZINC001755483763	1440860545	/nfs/dbraw/zinc/86/05/45/1440860545.db2.gz	VAPLZDSWAZZUBF-OBJOEFQTSA-N	0	3	342.817	3.305	20	30		EGEDHN
C[C@@H](CCCNCC#Cc1ccccc1Cl)NC(=O)C(C)(F)F	ZINC001755487362	1440861008	/nfs/dbraw/zinc/86/10/08/1440861008.db2.gz	FEWGPDDOWCKYQV-ZDUSSCGKSA-N	0	3	342.817	3.221	20	30		EGEDHN
CCc1occc1C(=O)N[C@H](C)CCCNCc1ccccc1C#N	ZINC001755495414	1440861914	/nfs/dbraw/zinc/86/19/14/1440861914.db2.gz	INACUOPDXMFISU-OAHLLOKOSA-N	0	3	339.439	3.402	20	30		EGEDHN
C=C(Cl)CNCCC[C@@H](C)NC(=O)c1cnn(C(C)(C)C)c1C	ZINC001755501205	1440862625	/nfs/dbraw/zinc/86/26/25/1440862625.db2.gz	ARSRRJKMPZJJDI-CYBMUJFWSA-N	0	3	340.899	3.187	20	30		EGEDHN
C=C(Cl)CNCCC[C@@H](C)NC(=O)C[C@H]1OCc2ccccc21	ZINC001755523320	1440865304	/nfs/dbraw/zinc/86/53/04/1440865304.db2.gz	UKBKTLYHEVWCBT-RHSMWYFYSA-N	0	3	336.863	3.275	20	30		EGEDHN
CN(CC#Cc1ccccc1)C1CCN(C(=O)[C@H]2[C@@H]3CCC[C@@H]32)CC1	ZINC001755528261	1440866154	/nfs/dbraw/zinc/86/61/54/1440866154.db2.gz	FIANTPDOCPQPSE-AERCQKQUSA-N	0	3	336.479	3.007	20	30		EGEDHN
CC#CCCCC(=O)N1CCC(N(C)Cc2ccccc2F)CC1	ZINC001755532633	1440867951	/nfs/dbraw/zinc/86/79/51/1440867951.db2.gz	UTPOTQVZYADINV-UHFFFAOYSA-N	0	3	330.447	3.442	20	30		EGEDHN
C=C(Cl)CNCCC[C@H](NC(=O)c1[nH]cnc1C)c1ccccc1	ZINC001755546964	1440870820	/nfs/dbraw/zinc/87/08/20/1440870820.db2.gz	AGSAACCKILUXKG-INIZCTEOSA-N	0	3	346.862	3.312	20	30		EGEDHN
C/C=C(\C)C(=O)N(C)[C@@H](CNCC#Cc1ccc(Cl)cc1)C1CC1	ZINC001755559031	1440874089	/nfs/dbraw/zinc/87/40/89/1440874089.db2.gz	UJQWVQCJWBPWLN-MJSAPAGGSA-N	0	3	344.886	3.484	20	30		EGEDHN
C=C(Br)CNC[C@@H](C1CC1)N(C)C(=O)C[C@H](C)CC	ZINC001755572223	1440877140	/nfs/dbraw/zinc/87/71/40/1440877140.db2.gz	RMDINYVUZPPYLM-RISCZKNCSA-N	0	3	331.298	3.158	20	30		EGEDHN
C[C@H](CN(C)C(=O)[C@H]1[C@@H]2CCCC[C@@H]21)NCc1ccc(C#N)c(F)c1	ZINC001755584402	1440880183	/nfs/dbraw/zinc/88/01/83/1440880183.db2.gz	XEZQDNLHKIMVLF-WKCGWZECSA-N	0	3	343.446	3.070	20	30		EGEDHN
C[C@@H](CN(C)C(=O)c1ccc(F)c(F)c1)NCc1ccc(C#N)s1	ZINC001755590420	1440881484	/nfs/dbraw/zinc/88/14/84/1440881484.db2.gz	NMKBHAUGWDBBSS-NSHDSACASA-N	0	3	349.406	3.148	20	30		EGEDHN
C=CCC1(C(=O)N(C)C[C@@H](C)NCc2sc(C)nc2C)CCC1	ZINC001755605817	1440885528	/nfs/dbraw/zinc/88/55/28/1440885528.db2.gz	MBOYOTCBJYJLQP-CYBMUJFWSA-N	0	3	335.517	3.443	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H](CO)N[C@H](C)c1ccc2ccccc2c1	ZINC001755630980	1440890782	/nfs/dbraw/zinc/89/07/82/1440890782.db2.gz	UYSYZJRHAPSJCN-UZLBHIALSA-N	0	3	340.467	3.324	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](NCc2cc(C)ccc2OC)[C@H]1C	ZINC001755657937	1440892295	/nfs/dbraw/zinc/89/22/95/1440892295.db2.gz	DKBZYPDYGXLHFQ-SJLPKXTDSA-N	0	3	330.472	3.439	20	30		EGEDHN
C[C@@H]1[C@H](NCc2ccc(C#N)s2)CCN1C(=O)CCCC1CC1	ZINC001755659581	1440892569	/nfs/dbraw/zinc/89/25/69/1440892569.db2.gz	SSPPGTNCVGOLSM-CXAGYDPISA-N	0	3	331.485	3.279	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CCCN(Cc2ccc3c(c2)CCC3)[C@@H]1C	ZINC001755730731	1440910158	/nfs/dbraw/zinc/91/01/58/1440910158.db2.gz	NCZNWCZMCNSOCK-DYESRHJHSA-N	0	3	338.495	3.448	20	30		EGEDHN
C#CCCCCCC(=O)N1C[C@H](NCc2cncc(F)c2)C(C)(C)C1	ZINC001755775880	1440917210	/nfs/dbraw/zinc/91/72/10/1440917210.db2.gz	SPHCJKJYHNXQLX-SFHVURJKSA-N	0	3	345.462	3.131	20	30		EGEDHN
CC(C)(C)[C@H](CNCC#Cc1ccccc1)NC(=O)C1(CCF)CC1	ZINC001755828656	1440928039	/nfs/dbraw/zinc/92/80/39/1440928039.db2.gz	MTQPYNJLQISSQR-SFHVURJKSA-N	0	3	344.474	3.298	20	30		EGEDHN
CC#CCN1CCC([C@@H](C)NC(=O)C/C=C/c2ccc(F)cc2)CC1	ZINC001755843390	1440932403	/nfs/dbraw/zinc/93/24/03/1440932403.db2.gz	GCWKKJHLDIQBTC-FUTAKVPZSA-N	0	3	342.458	3.469	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H](C)C1CCN(Cc2ncccc2C)CC1	ZINC001755844376	1440932679	/nfs/dbraw/zinc/93/26/79/1440932679.db2.gz	SPJRHGSIXONJCR-MRXNPFEDSA-N	0	3	329.488	3.319	20	30		EGEDHN
C#CCCCC(=O)N(C)C1CC(NCc2cccc(Cl)c2F)C1	ZINC001755856361	1440935830	/nfs/dbraw/zinc/93/58/30/1440935830.db2.gz	VSVQUCLYLPZOGS-UHFFFAOYSA-N	0	3	336.838	3.362	20	30		EGEDHN
CN(C(=O)CCCF)C1CC(NCC#Cc2ccccc2Cl)C1	ZINC001755860176	1440936524	/nfs/dbraw/zinc/93/65/24/1440936524.db2.gz	UUXOYKDYSGXOSR-UHFFFAOYSA-N	0	3	336.838	3.020	20	30		EGEDHN
C=C(Cl)CNC1CC(N(C)C(=O)COc2ccc(Cl)cc2)C1	ZINC001755864722	1440937547	/nfs/dbraw/zinc/93/75/47/1440937547.db2.gz	YYPCDHRHQUTHFG-UHFFFAOYSA-N	0	3	343.254	3.050	20	30		EGEDHN
O=C(C#CC1CC1)NC1(C2CCN(Cc3ccc(F)cc3)CC2)CC1	ZINC001755868311	1440938376	/nfs/dbraw/zinc/93/83/76/1440938376.db2.gz	POTPNEYBAILNHX-UHFFFAOYSA-N	0	3	340.442	3.100	20	30		EGEDHN
N#Cc1cccc(NC(=O)CN[C@@H](C[C@@H]2CCOC2)c2ccccc2)c1	ZINC000181183230	234109235	/nfs/dbraw/zinc/10/92/35/234109235.db2.gz	FPLVQWHYQMDLJF-PXNSSMCTSA-N	0	3	349.434	3.254	20	30		EGEDHN
COc1cc(F)c([C@@H](C)NCCOc2ccccc2C#N)cc1OC	ZINC000183505208	235114739	/nfs/dbraw/zinc/11/47/39/235114739.db2.gz	DRXJRAZAYWEEHY-CYBMUJFWSA-N	0	3	344.386	3.444	20	30		EGEDHN
C[C@@H](N[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O)[C@H](C)c1ccccc1	ZINC000190622135	238635730	/nfs/dbraw/zinc/63/57/30/238635730.db2.gz	BHFQNSFPQNDDLZ-CSODHUTKSA-N	0	3	347.462	3.441	20	30		EGEDHN
CCN1CCC(n2nccc2NC(=O)/C=C/c2ccccc2C#N)CC1	ZINC000073153138	216356857	/nfs/dbraw/zinc/35/68/57/216356857.db2.gz	IKXHATWXWYKWQH-BQYQJAHWSA-N	0	3	349.438	3.063	20	30		EGEDHN
Cn1cc(CN2CCC[C@H]2C[C@H](O)c2ccc(F)cc2)cc1C#N	ZINC000191444186	239114720	/nfs/dbraw/zinc/11/47/20/239114720.db2.gz	KWMFUGUCCSKQMQ-HKUYNNGSSA-N	0	3	327.403	3.124	20	30		EGEDHN
Cn1cc(CN[C@@H]2CCO[C@H]2c2ccc(Cl)c(F)c2)cc1C#N	ZINC000191550494	239180113	/nfs/dbraw/zinc/18/01/13/239180113.db2.gz	NUOVRCSUXBHUGY-SJORKVTESA-N	0	3	333.794	3.309	20	30		EGEDHN
COc1ccsc1[C@H](C)NC1CCN(c2ccc(C#N)cn2)CC1	ZINC000372117598	242042784	/nfs/dbraw/zinc/04/27/84/242042784.db2.gz	UVHOKYLWLOEJRI-ZDUSSCGKSA-N	0	3	342.468	3.343	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@@H]2Cc2ccccc2)CC1	ZINC000264338644	246371917	/nfs/dbraw/zinc/37/19/17/246371917.db2.gz	HSXTWDSYMRHJOJ-LJQANCHMSA-N	0	3	327.472	3.054	20	30		EGEDHN
N#Cc1cccc(OCCCN(Cc2ccc(C(N)=O)cc2)C2CC2)c1	ZINC000268630180	252083591	/nfs/dbraw/zinc/08/35/91/252083591.db2.gz	BOJJJOYGXTWNMB-UHFFFAOYSA-N	0	3	349.434	3.091	20	30		EGEDHN
CCc1ccc2c(CN3CC[C@H](CNC(C)=O)C3)cc(=O)oc2c1	ZINC000328597063	258042395	/nfs/dbraw/zinc/04/23/95/258042395.db2.gz	CZKOCTYCUKALHG-OAHLLOKOSA-N	0	3	328.412	3.154	20	30		EGEDHN
C[C@@H](N[C@H]1CCCN(c2ccc(C#N)cc2)C1=O)c1cccs1	ZINC000179963864	533541874	/nfs/dbraw/zinc/54/18/74/533541874.db2.gz	OBZVVLQSVQTGIZ-CJNGLKHVSA-N	0	3	325.437	3.466	20	30		EGEDHN
C[C@@H](CNC(=O)Nc1cc(C#N)cn1C(C)(C)C)N1CCCC[C@H]1C	ZINC000337863004	141068906	/nfs/dbraw/zinc/06/89/06/141068906.db2.gz	NMEJQYRYLIBVLU-CABCVRRESA-N	0	3	345.491	3.499	20	30		EGEDHN
CC(C)C[C@@H](CN[C@@H](C)c1ccc(C#N)c(F)c1)N1CCOCC1	ZINC000346195510	141177520	/nfs/dbraw/zinc/17/75/20/141177520.db2.gz	OXMMLEPUKCIVFF-YJBOKZPZSA-N	0	3	333.451	3.095	20	30		EGEDHN
C[C@H](NC(=O)C1(c2cccc(C#N)c2)CC1)[C@@H](c1ccccc1)N(C)C	ZINC000356233333	141324487	/nfs/dbraw/zinc/32/44/87/141324487.db2.gz	PTSIMJRFXSOKHD-JXFKEZNVSA-N	0	3	347.462	3.397	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCN2CCOC3(C2)CCCCCC3)cc1	ZINC000357957505	141367415	/nfs/dbraw/zinc/36/74/15/141367415.db2.gz	IGDRVUZHGRQQMY-UHFFFAOYSA-N	0	3	341.455	3.312	20	30		EGEDHN
C[C@@H](CN1CCCCC1)NC(=O)Nc1cc(C#N)cn1C(C)(C)C	ZINC000171145354	144001276	/nfs/dbraw/zinc/00/12/76/144001276.db2.gz	APPRBKXCUVNTNR-AWEZNQCLSA-N	0	3	331.464	3.111	20	30		EGEDHN
CC(C)n1cc(CN2CCCN(Cc3ccc(C#N)cc3)CC2)cn1	ZINC000171596388	144007469	/nfs/dbraw/zinc/00/74/69/144007469.db2.gz	TVHPLAIGUCBAFM-UHFFFAOYSA-N	0	3	337.471	3.044	20	30		EGEDHN
N#Cc1ccc(OCCN2CCC(n3cc(Cl)cn3)CC2)cc1	ZINC000361741954	144358624	/nfs/dbraw/zinc/35/86/24/144358624.db2.gz	BFBUOYLJBQSRBJ-UHFFFAOYSA-N	0	3	330.819	3.124	20	30		EGEDHN
Cc1ccnc(N2C[C@H]3CN(Cc4ccccc4)CC[C@@H]3C2)c1C#N	ZINC000310994026	154144206	/nfs/dbraw/zinc/14/42/06/154144206.db2.gz	HEPUSQONBQGKNE-RTBURBONSA-N	0	3	332.451	3.220	20	30		EGEDHN
CN(C)c1ccccc1CN(C)CCC(=O)Nc1cccc(C#N)c1	ZINC000344074780	164097010	/nfs/dbraw/zinc/09/70/10/164097010.db2.gz	QVVUUMDJSJCYTM-UHFFFAOYSA-N	0	3	336.439	3.085	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)N[C@H](C)C1=CCN(C)CC1	ZINC000346105350	164337388	/nfs/dbraw/zinc/33/73/88/164337388.db2.gz	GORHZVIDYCTTFC-CYBMUJFWSA-N	0	3	339.464	3.462	20	30		EGEDHN
COc1cc(CN[C@@H]2CCCN(c3ccc(C#N)cc3)C2=O)ccc1C	ZINC000351889549	165139119	/nfs/dbraw/zinc/13/91/19/165139119.db2.gz	MKPBIKKIERTSHP-LJQANCHMSA-N	0	3	349.434	3.161	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@@H](NCc3cccc4[nH]ccc43)C2=O)cc1	ZINC000355772971	166303078	/nfs/dbraw/zinc/30/30/78/166303078.db2.gz	MCAKNTLVAVBYIL-HXUWFJFHSA-N	0	3	344.418	3.325	20	30		EGEDHN
N#Cc1ccnc(N2CC[C@@]3(C2)CCCN(Cc2ccccc2)C3)c1	ZINC000367340463	168210514	/nfs/dbraw/zinc/21/05/14/168210514.db2.gz	XFVUGWZVXSRKGM-NRFANRHFSA-N	0	3	332.451	3.446	20	30		EGEDHN
COc1ccc(CNCCc2cc(C(F)(F)F)ccn2)cc1C#N	ZINC000293022690	269781907	/nfs/dbraw/zinc/78/19/07/269781907.db2.gz	QVEQDUGIZZUWCR-UHFFFAOYSA-N	0	3	335.329	3.313	20	30		EGEDHN
N#Cc1c(Br)cccc1N1CC[C@H](N2CCCCC2)C1	ZINC000168537491	264929411	/nfs/dbraw/zinc/92/94/11/264929411.db2.gz	MIZAMSSWQPXKLT-ZDUSSCGKSA-N	0	3	334.261	3.385	20	30		EGEDHN
CC(C)(CO)[C@@H](NCc1ccc(Br)cc1C#N)C1CC1	ZINC000293042492	270042370	/nfs/dbraw/zinc/04/23/70/270042370.db2.gz	MFJYRPWIYKFEMO-HNNXBMFYSA-N	0	3	337.261	3.207	20	30		EGEDHN
N#Cc1cncc(N[C@@H]2CCN(Cc3ccc(C(F)(F)F)cc3)C2)n1	ZINC000420601192	270048852	/nfs/dbraw/zinc/04/88/52/270048852.db2.gz	MYHFRCYZTLRKDE-CQSZACIVSA-N	0	3	347.344	3.053	20	30		EGEDHN
CCN(CCc1ccccc1)C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000279729749	266131686	/nfs/dbraw/zinc/13/16/86/266131686.db2.gz	NLOIBHCBYHFZAA-FQEVSTJZSA-N	0	3	331.419	3.332	20	30		EGEDHN
CCN(Cc1ccc(CN(C)C)cc1)C(=O)c1ccc(F)c(C#N)c1	ZINC000285344352	266136542	/nfs/dbraw/zinc/13/65/42/266136542.db2.gz	PNJJFUCCQIPOGE-UHFFFAOYSA-N	0	3	339.414	3.421	20	30		EGEDHN
CCOC(=O)N1CCC([C@@H](C)NCc2cc(C#N)ccc2F)CC1	ZINC000186409372	266257978	/nfs/dbraw/zinc/25/79/78/266257978.db2.gz	YATVXHVFUAYWOL-CYBMUJFWSA-N	0	3	333.407	3.044	20	30		EGEDHN
CCOCCCN1CC[C@H](Nc2nc(Cl)c(C#N)s2)[C@@H](C)C1	ZINC000287263806	266273171	/nfs/dbraw/zinc/27/31/71/266273171.db2.gz	KWSZDWMHUTXQQZ-RYUDHWBXSA-N	0	3	342.896	3.217	20	30		EGEDHN
CCS[C@@H]1CC[C@H](N(C)C(=O)C(C#N)Cc2ccc(C#N)cc2)C1	ZINC000348320670	266347877	/nfs/dbraw/zinc/34/78/77/266347877.db2.gz	NXNSBDTYJADFNV-OKZBNKHCSA-N	0	3	341.480	3.373	20	30		EGEDHN
C[C@@H]1CN(CCC2CCN(c3ccc(C#N)cc3)CC2)C[C@@H](C)O1	ZINC000301558127	267047724	/nfs/dbraw/zinc/04/77/24/267047724.db2.gz	NYPJMACGHRKQTK-IAGOWNOFSA-N	0	3	327.472	3.274	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(CNCc3ccc(C#N)o3)cc2)C[C@@H](C)O1	ZINC000174257390	267054480	/nfs/dbraw/zinc/05/44/80/267054480.db2.gz	FYFDDSJXZRLLBR-HZPDHXFCSA-N	0	3	339.439	3.050	20	30		EGEDHN
C[C@@H]1C[C@@H](Nc2cc(C#N)c3cc([N+](=O)[O-])ccc3n2)CN1C1CC1	ZINC000302702865	267082335	/nfs/dbraw/zinc/08/23/35/267082335.db2.gz	XTKHVBCQCYXERO-DGCLKSJQSA-N	0	3	337.383	3.052	20	30		EGEDHN
CCOC(=O)N1CCC[C@@H]([C@H](C)NCc2cccc(C#N)c2F)C1	ZINC000495486514	267123945	/nfs/dbraw/zinc/12/39/45/267123945.db2.gz	HTNLGQGZILSLLM-XJKSGUPXSA-N	0	3	333.407	3.044	20	30		EGEDHN
CN1CC=C(CNc2c(C#N)cnc3ccc(OC(F)F)cc32)CC1	ZINC000273931060	267145543	/nfs/dbraw/zinc/14/55/43/267145543.db2.gz	KNINOSDTJKXHCL-UHFFFAOYSA-N	0	3	344.365	3.382	20	30		EGEDHN
C[C@H](c1ccc(C#N)c(F)c1)N1CCC[C@@H](CC(C)(C)C(N)=O)C1	ZINC000296259383	267206416	/nfs/dbraw/zinc/20/64/16/267206416.db2.gz	DEEKLWAGTJTKNX-KGLIPLIRSA-N	0	3	331.435	3.372	20	30		EGEDHN
CC[C@H](N[C@@H]1CC(=O)N(c2cccc(OC)c2)C1)c1ccc(C#N)cc1	ZINC000521536259	267223632	/nfs/dbraw/zinc/22/36/32/267223632.db2.gz	OABGXSLRXNFOMS-XLIONFOSSA-N	0	3	349.434	3.413	20	30		EGEDHN
CN1CCC(N(Cc2ccco2)Cc2ccc(C#N)c(F)c2)CC1	ZINC000421358416	267331507	/nfs/dbraw/zinc/33/15/07/267331507.db2.gz	SWKYYQMVOXVJDA-UHFFFAOYSA-N	0	3	327.403	3.387	20	30		EGEDHN
COC(=O)[C@H]1CN(Cc2ccc(C#N)cc2F)C[C@@H]1c1ccccc1	ZINC000449751636	267389516	/nfs/dbraw/zinc/38/95/16/267389516.db2.gz	ACEGPBDAMXDALI-MSOLQXFVSA-N	0	3	338.382	3.086	20	30		EGEDHN
C[C@@H](c1ccc(C#N)cc1F)N1C[C@H]2C[C@H](Cn3c(=O)cccc32)C1	ZINC000453277481	267720456	/nfs/dbraw/zinc/72/04/56/267720456.db2.gz	JXYOYMBWOOVWNT-CWRNSKLLSA-N	0	3	337.398	3.039	20	30		EGEDHN
Cn1cc(CN[C@@H](CNC(=O)OC(C)(C)C)C2CCCC2)cc1C#N	ZINC000195457951	267800831	/nfs/dbraw/zinc/80/08/31/267800831.db2.gz	SAZVMCIOQCXPTM-KRWDZBQOSA-N	0	3	346.475	3.070	20	30		EGEDHN
Cc1ccc(CN(CCN(C)C)C(=O)/C=C\c2cccc(C#N)c2)o1	ZINC000491399199	268036276	/nfs/dbraw/zinc/03/62/76/268036276.db2.gz	DJKNKNUNTUGCML-NTMALXAHSA-N	0	3	337.423	3.063	20	30		EGEDHN
Cc1cccc([C@H](C)CNC(=O)C(C#N)Cc2ccc(C#N)cc2)c1	ZINC000470972902	268057337	/nfs/dbraw/zinc/05/73/37/268057337.db2.gz	BIDGUOVGYSUZJR-OXQOHEQNSA-N	0	3	331.419	3.469	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NC[C@H]2CCCC(F)(F)C2)cc1	ZINC000282678259	268085393	/nfs/dbraw/zinc/08/53/93/268085393.db2.gz	OJIHNYZBYQBLSB-HOTGVXAUSA-N	0	3	331.366	3.182	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCCC2Cc3ccccc3C2)cc1	ZINC000280194528	268085813	/nfs/dbraw/zinc/08/58/13/268085813.db2.gz	UHNXRSWCTRKCFM-NRFANRHFSA-N	0	3	343.430	3.162	20	30		EGEDHN
N#Cc1cc(NC(=O)NC[C@H]2CCN2C2CCCCC2)ccc1F	ZINC000528965289	268188937	/nfs/dbraw/zinc/18/89/37/268188937.db2.gz	XNZYVIIYYSQYNC-MRXNPFEDSA-N	0	3	330.407	3.226	20	30		EGEDHN
N#Cc1cccc(C2(NC[C@H](O)Cc3cccc(Cl)c3)CC2)c1	ZINC000287674719	268241425	/nfs/dbraw/zinc/24/14/25/268241425.db2.gz	HUXYLXDFCVSMOI-GOSISDBHSA-N	0	3	326.827	3.394	20	30		EGEDHN
N#Cc1cccnc1Nc1cccc(N2CCN(CC3CC3)CC2)c1	ZINC000301506874	268287620	/nfs/dbraw/zinc/28/76/20/268287620.db2.gz	BSYCTOOAECRUDR-UHFFFAOYSA-N	0	3	333.439	3.229	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CN(C1CC1)[C@@H]1CCc2ccccc21	ZINC000528410325	268298566	/nfs/dbraw/zinc/29/85/66/268298566.db2.gz	LBBOZNDEQMQIEK-TZIWHRDSSA-N	0	3	348.446	3.450	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@]1(C)CCN(Cc2cccc(C#N)c2)C1	ZINC000495790334	269593232	/nfs/dbraw/zinc/59/32/32/269593232.db2.gz	ZXSWGDSRQZZACV-IBGZPJMESA-N	0	3	329.444	3.295	20	30		EGEDHN
CCCN(CCN1CCCC1)C(=O)N[C@H](C)c1ccc(C#N)cc1	ZINC000286942257	276060984	/nfs/dbraw/zinc/06/09/84/276060984.db2.gz	HVMWQAXSDYTKKT-MRXNPFEDSA-N	0	3	328.460	3.137	20	30		EGEDHN
CC(C)(CO)[C@@H](NC[C@@H](O)c1ccc(C#N)cc1)c1cccs1	ZINC000289782834	276393586	/nfs/dbraw/zinc/39/35/86/276393586.db2.gz	MSYMSZMJODCUFG-WBVHZDCISA-N	0	3	330.453	3.003	20	30		EGEDHN
CN(C)CCOC1CCN(c2ccc(C#N)cc2C(F)(F)F)CC1	ZINC000361707075	276791874	/nfs/dbraw/zinc/79/18/74/276791874.db2.gz	FGLDRJWBUPNTAN-UHFFFAOYSA-N	0	3	341.377	3.124	20	30		EGEDHN
C[C@@H]1CN(C[C@@H]2CCCN2CC#Cc2cccc(Cl)c2)C[C@@H](C)O1	ZINC000156364289	288191258	/nfs/dbraw/zinc/19/12/58/288191258.db2.gz	DLHNFMCPASEGCC-HLIPFELVSA-N	0	3	346.902	3.265	20	30		EGEDHN
COC(=O)[C@H](C)[C@@H](NCCOc1ccc(C#N)cc1)c1ccccc1	ZINC000079922277	307429927	/nfs/dbraw/zinc/42/99/27/307429927.db2.gz	HNMQYQPBWFUYJV-DNVCBOLYSA-N	0	3	338.407	3.077	20	30		EGEDHN
CC[C@H](NCc1ccc(C#N)cc1)[C@@H]1CN(Cc2ccccc2)CCO1	ZINC000153654982	307777917	/nfs/dbraw/zinc/77/79/17/307777917.db2.gz	TUFFSOYYLYGQKU-VXKWHMMOSA-N	0	3	349.478	3.327	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@@H](N3CCc4ccccc4CC3)C2=O)cc1	ZINC000537604652	314194769	/nfs/dbraw/zinc/19/47/69/314194769.db2.gz	ABTNXWXCRPGYLF-OAQYLSRUSA-N	0	3	345.446	3.154	20	30		EGEDHN
C[C@H](NCCN1CCN(c2ccccc2)CC1)c1cccc(C#N)c1	ZINC000539500037	314318088	/nfs/dbraw/zinc/31/80/88/314318088.db2.gz	OWZULNBTZQUPIC-SFHVURJKSA-N	0	3	334.467	3.031	20	30		EGEDHN
CC[C@@H]1CN(Cc2cccc(OCc3ccccc3C#N)c2)C[C@@H]1O	ZINC000539897037	314349107	/nfs/dbraw/zinc/34/91/07/314349107.db2.gz	VAELLGYFNOZKAK-UTKZUKDTSA-N	0	3	336.435	3.340	20	30		EGEDHN
CN(C)C[C@H](CNC(=O)c1cccc(C#N)c1)c1ccc(Cl)cc1	ZINC000552025149	315189499	/nfs/dbraw/zinc/18/94/99/315189499.db2.gz	ADQYYPMAAIVIBC-KRWDZBQOSA-N	0	3	341.842	3.287	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@@H](NCc1ccccc1CN1CCCC1=O)CC2	ZINC000558499227	315574335	/nfs/dbraw/zinc/57/43/35/315574335.db2.gz	QTWWDOGKTLEOQO-NRFANRHFSA-N	0	3	345.446	3.458	20	30		EGEDHN
CCCCC1CCC(NCCS(=O)(=O)c2ccc(C#N)cn2)CC1	ZINC000564203395	316123379	/nfs/dbraw/zinc/12/33/79/316123379.db2.gz	JGNZEGKWKJOMHT-UHFFFAOYSA-N	0	3	349.500	3.066	20	30		EGEDHN
CC(C)(C)N1CC[C@H](N[C@H]2CCCCc3cc(C#N)ccc32)C1=O	ZINC000567856164	316684597	/nfs/dbraw/zinc/68/45/97/316684597.db2.gz	DBLWLIRWWJGSQN-ROUUACIJSA-N	0	3	325.456	3.315	20	30		EGEDHN
N#Cc1cnc2c(Cl)cccc2c1NC[C@H]1CCCN1CCCO	ZINC000570678356	317092751	/nfs/dbraw/zinc/09/27/51/317092751.db2.gz	OXHPXXLHSWUSQO-CQSZACIVSA-N	0	3	344.846	3.019	20	30		EGEDHN
N#Cc1cccc([C@@H]2C[C@H]2C(=O)N[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000570779429	317106332	/nfs/dbraw/zinc/10/63/32/317106332.db2.gz	CLWSJRVVRYCKHX-QHAWAJNXSA-N	0	3	345.446	3.052	20	30		EGEDHN
Cc1cccc(OC[C@H](O)CN[C@H]2CCCc3cc(C#N)ccc32)c1	ZINC000572865823	317403185	/nfs/dbraw/zinc/40/31/85/317403185.db2.gz	FCJJLWWMVVGOQA-NQIIRXRSSA-N	0	3	336.435	3.274	20	30		EGEDHN
C#C[C@H](NCc1cc(OC)c(OCC(F)F)c(OC)c1)C(C)C	ZINC000289516548	456128606	/nfs/dbraw/zinc/12/86/06/456128606.db2.gz	PASKUZCTAJJQPQ-ZDUSSCGKSA-N	0	3	327.371	3.095	20	30		EGEDHN
COc1cc(OC)cc(N2CC[C@@H](NCc3cc(C#N)cs3)C2)c1	ZINC000174930892	323312959	/nfs/dbraw/zinc/31/29/59/323312959.db2.gz	FFWTVBLHFSKRLN-CQSZACIVSA-N	0	3	343.452	3.005	20	30		EGEDHN
N#Cc1csc(CNCc2ccc(CN3CCCC3=O)cc2)c1	ZINC000177688717	323344796	/nfs/dbraw/zinc/34/47/96/323344796.db2.gz	SZLLCINGWUPWFO-UHFFFAOYSA-N	0	3	325.437	3.032	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@H](NCCc1nnc(-c3ccccc3)o1)CC2	ZINC000579043070	325053889	/nfs/dbraw/zinc/05/38/89/325053889.db2.gz	AMTGIQKYTNQMII-GOSISDBHSA-N	0	3	330.391	3.428	20	30		EGEDHN
N#Cc1ccc(S(=O)(=O)CCNCCCCC2CCCC2)cc1	ZINC000580182859	325214287	/nfs/dbraw/zinc/21/42/87/325214287.db2.gz	IVORJECBDOYSNX-UHFFFAOYSA-N	0	3	334.485	3.282	20	30		EGEDHN
CC[C@@H](NCc1cccc(OCCCC#N)c1)[C@H](O)C(F)(F)F	ZINC000345816297	456999559	/nfs/dbraw/zinc/99/95/59/456999559.db2.gz	LBDQLHKNJCCJGX-CABCVRRESA-N	0	3	330.350	3.161	20	30		EGEDHN
CC(C)[C@H]1CN(Cc2ccc(Br)cc2C#N)CCN1C	ZINC000347132716	457247677	/nfs/dbraw/zinc/24/76/77/457247677.db2.gz	QAKYDIMFOJTACI-MRXNPFEDSA-N	0	3	336.277	3.093	20	30		EGEDHN
C[C@H](CNC(=O)Nc1ccc(Oc2cccc(C#N)c2)cc1)N(C)C	ZINC000264523490	455229624	/nfs/dbraw/zinc/22/96/24/455229624.db2.gz	DWYLNDKCYJODFO-CQSZACIVSA-N	0	3	338.411	3.422	20	30		EGEDHN
CCO[C@@H]1C[C@H](N[C@@H](C)C(=O)N[C@](C)(C#N)C(C)C)C1(CC)CC	ZINC000429342823	458318520	/nfs/dbraw/zinc/31/85/20/458318520.db2.gz	COVFWPWTLMMSCA-LISAXSMJSA-N	0	3	337.508	3.003	20	30		EGEDHN
C[C@H]1c2c(Cl)cc(Cl)cc2CCN1C(=O)[C@H](N)CCCC#N	ZINC000424153269	458572054	/nfs/dbraw/zinc/57/20/54/458572054.db2.gz	MVTRPBYMNNJAHN-IINYFYTJSA-N	0	3	340.254	3.460	20	30		EGEDHN
COc1ncc(C)cc1NC1CCN(Cc2ccc(C#N)cc2)CC1	ZINC000183193803	455248649	/nfs/dbraw/zinc/24/86/49/455248649.db2.gz	GWYLAOJMHBVEQH-UHFFFAOYSA-N	0	3	336.439	3.347	20	30		EGEDHN
C=CCOCCCC(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000173647790	455323283	/nfs/dbraw/zinc/32/32/83/455323283.db2.gz	BUQNHXPYGKJHOV-AZUAARDMSA-N	0	3	344.499	3.481	20	30		EGEDHN
Cc1oc([N-]C(=O)C[NH2+][C@@H](Cc2ccccc2)C2CC2)c(C#N)c1C	ZINC000181550778	455353570	/nfs/dbraw/zinc/35/35/70/455353570.db2.gz	QTUUIDLHYMJFPY-SFHVURJKSA-N	0	3	337.423	3.318	20	30		EGEDHN
Cc1oc(NC(=O)CN[C@@H](Cc2ccccc2)C2CC2)c(C#N)c1C	ZINC000181550778	455353571	/nfs/dbraw/zinc/35/35/71/455353571.db2.gz	QTUUIDLHYMJFPY-SFHVURJKSA-N	0	3	337.423	3.318	20	30		EGEDHN
C=CCOc1c(Cl)cc(CNC[C@H](O)C2CCC2)cc1OC	ZINC000623542481	460604121	/nfs/dbraw/zinc/60/41/21/460604121.db2.gz	CFXVYHLSDYMYKX-HNNXBMFYSA-N	0	3	325.836	3.164	20	30		EGEDHN
C[C@@]1(C#N)CCCN(C(=O)NC[C@@H](c2cccs2)N2CCCC2)C1	ZINC000612357394	460604768	/nfs/dbraw/zinc/60/47/68/460604768.db2.gz	AFKNXVXRGYHNAA-YJBOKZPZSA-N	0	3	346.500	3.220	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)N2CCC[C@@](C)(C#N)C2)N(C)C)cc1	ZINC000612357986	460604889	/nfs/dbraw/zinc/60/48/89/460604889.db2.gz	YXALQNOFXPQWSZ-ICSRJNTNSA-N	0	3	342.487	3.187	20	30		EGEDHN
C[C@@]1(C#N)CCCN(C(=O)NC[C@H](c2cccs2)N2CCCC2)C1	ZINC000612357393	460605027	/nfs/dbraw/zinc/60/50/27/460605027.db2.gz	AFKNXVXRGYHNAA-QAPCUYQASA-N	0	3	346.500	3.220	20	30		EGEDHN
COc1ccc([C@@H](NC(=O)C(C#N)CCc2ccccc2)C2CC2)cn1	ZINC000600811164	460611821	/nfs/dbraw/zinc/61/18/21/460611821.db2.gz	CDDPYGIKISYVRF-XLIONFOSSA-N	0	3	349.434	3.430	20	30		EGEDHN
N#CCc1ccc(OC[C@H](O)CN[C@@H](c2ccccc2)C2CC2)cc1	ZINC000023678821	453714982	/nfs/dbraw/zinc/71/49/82/453714982.db2.gz	ZHKRJPQPOAYZKL-CTNGQTDRSA-N	0	3	336.435	3.233	20	30		EGEDHN
C[C@@H](NC[C@@H](O)COCc1ccc(Cl)cc1)c1ccc(C#N)cc1	ZINC000030532585	453836413	/nfs/dbraw/zinc/83/64/13/453836413.db2.gz	SYAWUWXSQXLIDF-AUUYWEPGSA-N	0	3	344.842	3.440	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(OCCC)c(Cl)c2)CC1	ZINC000066921073	453885712	/nfs/dbraw/zinc/88/57/12/453885712.db2.gz	JEEOXSLKOGGWEV-UHFFFAOYSA-N	0	3	334.847	3.413	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N[C@H](CN1CCCCC1)c1ccccc1	ZINC000075630652	453912862	/nfs/dbraw/zinc/91/28/62/453912862.db2.gz	JBBHGOZJEZHIBL-PKOBYXMFSA-N	0	3	330.472	3.311	20	30		EGEDHN
C=CCC[C@@H](O)CN1CCN(c2cccc(C(F)(F)F)c2)CC1	ZINC000033924295	453918312	/nfs/dbraw/zinc/91/83/12/453918312.db2.gz	XHBJPQZMTKFJQC-MRXNPFEDSA-N	0	3	328.378	3.155	20	30		EGEDHN
N#CCc1ccc(OC[C@@H](O)CN2CCC[C@H]2c2ccccc2)cc1	ZINC000054993535	453955638	/nfs/dbraw/zinc/95/56/38/453955638.db2.gz	SIMVSEIQFYZBSC-FPOVZHCZSA-N	0	3	336.435	3.329	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC(c3ccc(F)cc3)CC2)CC1	ZINC000083720972	453958261	/nfs/dbraw/zinc/95/82/61/453958261.db2.gz	BESFMVNMALVGKK-UHFFFAOYSA-N	0	3	345.462	3.365	20	30		EGEDHN
C[C@H](CNC(=O)N[C@@H](C)c1ccc(C#N)cc1)N1CCC(C)CC1	ZINC000067706531	453959447	/nfs/dbraw/zinc/95/94/47/453959447.db2.gz	KRBGFNAVJUWHSB-CVEARBPZSA-N	0	3	328.460	3.039	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCc3c(F)ccc(F)c3C2)CC1	ZINC000084157973	453974480	/nfs/dbraw/zinc/97/44/80/453974480.db2.gz	DTCDOCNCGMMYSI-UHFFFAOYSA-N	0	3	349.425	3.073	20	30		EGEDHN
CCN(Cc1ccc(CN(C)C)cc1)C(=O)c1cc(C#N)cs1	ZINC000084187117	453975733	/nfs/dbraw/zinc/97/57/33/453975733.db2.gz	LXLKJCHCXSYCKJ-UHFFFAOYSA-N	0	3	327.453	3.344	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1C[C@H](c2ccccc2C)C[C@@H]1C	ZINC000076388774	453995668	/nfs/dbraw/zinc/99/56/68/453995668.db2.gz	DRODYVIUKLUADB-BPQIPLTHSA-N	0	3	327.472	3.181	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C[C@@H](C)c2cccc(OC)c2)CC1	ZINC000084599923	454000255	/nfs/dbraw/zinc/00/02/55/454000255.db2.gz	JATMOZGFTNZJTC-MRXNPFEDSA-N	0	3	330.472	3.346	20	30		EGEDHN
CCCCS[C@H](C)C(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000068309966	454015873	/nfs/dbraw/zinc/01/58/73/454015873.db2.gz	DYUAHBIWJQKGMY-MRXNPFEDSA-N	0	3	347.528	3.370	20	30		EGEDHN
N#Cc1ccc(OCCN2CCC([C@H](O)c3ccccc3)CC2)cc1	ZINC000042634781	454016852	/nfs/dbraw/zinc/01/68/52/454016852.db2.gz	CUKPKFVNBZPCJA-OAQYLSRUSA-N	0	3	336.435	3.383	20	30		EGEDHN
CCN1CCCC[C@H]1CNC(=O)N[C@H](CCC#N)c1ccccc1	ZINC000245955832	455407629	/nfs/dbraw/zinc/40/76/29/455407629.db2.gz	QOKANUOJMHMZIJ-ZWKOTPCHSA-N	0	3	328.460	3.205	20	30		EGEDHN
COCCOc1ccc(C([O-])=C(C#N)c2cnc3ccccc3n2)cc1	ZINC000190889353	455398407	/nfs/dbraw/zinc/39/84/07/455398407.db2.gz	DDFYPHNDMOENEM-INIZCTEOSA-N	0	3	347.374	3.145	20	30		EGEDHN
COCCOc1ccc(C(=O)C(C#N)c2cnc3ccccc3n2)cc1	ZINC000190889353	455398411	/nfs/dbraw/zinc/39/84/11/455398411.db2.gz	DDFYPHNDMOENEM-INIZCTEOSA-N	0	3	347.374	3.145	20	30		EGEDHN
COc1ccc(F)cc1CN1CCN(CC(C)(C)CCC#N)CC1	ZINC000119232262	454179622	/nfs/dbraw/zinc/17/96/22/454179622.db2.gz	KKHAOBQDWXUOEI-UHFFFAOYSA-N	0	3	333.451	3.282	20	30		EGEDHN
CC(C)(CCC#N)CNCc1nnc2ccc(C(F)(F)F)cn21	ZINC000266212948	455424983	/nfs/dbraw/zinc/42/49/83/455424983.db2.gz	OXTPZQWPCMZKLU-UHFFFAOYSA-N	0	3	325.338	3.168	20	30		EGEDHN
CN(C)c1cccc(CN(C)CCC(=O)Nc2cccc(C#N)c2)c1	ZINC000089921852	454235021	/nfs/dbraw/zinc/23/50/21/454235021.db2.gz	CRRSTTOKEIPWMF-UHFFFAOYSA-N	0	3	336.439	3.085	20	30		EGEDHN
C#CCOc1ccccc1CNC1CCN([C@H](C)c2ccncc2)CC1	ZINC000131112965	454236800	/nfs/dbraw/zinc/23/68/00/454236800.db2.gz	ZXRDYPNZZZETIJ-GOSISDBHSA-N	0	3	349.478	3.409	20	30		EGEDHN
C[C@@H](CNC(=O)Nc1ccc(C#N)c(Cl)c1)N1CCC[C@@H](C)C1	ZINC000058859467	454237610	/nfs/dbraw/zinc/23/76/10/454237610.db2.gz	PPRSNQLUCIYKTA-OLZOCXBDSA-N	0	3	334.851	3.454	20	30		EGEDHN
COc1cc(CN(CCOc2cccc(C#N)c2)C2CC2)ccc1O	ZINC000089972069	454250897	/nfs/dbraw/zinc/25/08/97/454250897.db2.gz	IILHMFDBUZJHHL-UHFFFAOYSA-N	0	3	338.407	3.316	20	30		EGEDHN
Cn1ccnc1C[C@@H]1CCCN(CC#Cc2ccc(Cl)cc2)C1	ZINC000090003634	454261165	/nfs/dbraw/zinc/26/11/65/454261165.db2.gz	LXABKEJTNMFNMV-KRWDZBQOSA-N	0	3	327.859	3.380	20	30		EGEDHN
CC[C@H](Cc1ccccc1)N(CC)CC(=O)N[C@@](C)(C#N)C1CC1	ZINC000120427752	454300822	/nfs/dbraw/zinc/30/08/22/454300822.db2.gz	IARZCMDPLDDGHO-QUCCMNQESA-N	0	3	327.472	3.138	20	30		EGEDHN
C=C(C)COCCN[C@@H](C)c1ccc(OCc2nccn2C)cc1	ZINC000090451233	454307496	/nfs/dbraw/zinc/30/74/96/454307496.db2.gz	ABTLXYXFYWFZRY-INIZCTEOSA-N	0	3	329.444	3.242	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@@H](C)C1	ZINC000132387907	454334102	/nfs/dbraw/zinc/33/41/02/454334102.db2.gz	MOQZOMVPZGBMTG-NSHGMRRFSA-N	0	3	344.499	3.479	20	30		EGEDHN
N#CC1(NC(=O)CN[C@@H]2CCC[C@H]2c2ccccc2)CCCCC1	ZINC000133586410	454442668	/nfs/dbraw/zinc/44/26/68/454442668.db2.gz	RBGTUJFWJOVZRI-ZWKOTPCHSA-N	0	3	325.456	3.255	20	30		EGEDHN
C[C@H](CN1CCCCC1)NC(=O)N[C@@H](CCC#N)c1ccccc1	ZINC000133798646	454468861	/nfs/dbraw/zinc/46/88/61/454468861.db2.gz	AJBGLFFMHHQLBO-AEFFLSMTSA-N	0	3	328.460	3.205	20	30		EGEDHN
Cc1noc(C2CCN(Cc3ccc(N(C)CCC#N)cc3)CC2)n1	ZINC000091836157	454479531	/nfs/dbraw/zinc/47/95/31/454479531.db2.gz	CCKBYYZRSZZLEZ-UHFFFAOYSA-N	0	3	339.443	3.108	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN(C)[C@@H](C)C2CC2)cc1	ZINC000073800500	454484789	/nfs/dbraw/zinc/48/47/89/454484789.db2.gz	FKCWDQKTJYREIZ-HNNXBMFYSA-N	0	3	329.444	3.062	20	30		EGEDHN
N#CC(C(=O)c1ccc(C(F)(F)F)nc1)c1nc2ccccc2[nH]1	ZINC000073972196	454509697	/nfs/dbraw/zinc/50/96/97/454509697.db2.gz	LFILZMNAFFBJAU-JTQLQIEISA-N	0	3	330.269	3.467	20	30		EGEDHN
COc1ccc([C@@H](NCC(=O)Nc2cccc(C#N)c2)C(C)C)cc1	ZINC000102692987	454516176	/nfs/dbraw/zinc/51/61/76/454516176.db2.gz	DBWGZRNRYNLNIZ-FQEVSTJZSA-N	0	3	337.423	3.492	20	30		EGEDHN
CC(C)(CCC#N)CNc1ccccc1CN1CCC[C@H](C(N)=O)C1	ZINC000092161078	454530255	/nfs/dbraw/zinc/53/02/55/454530255.db2.gz	UNFBGSXGSLJFTR-KRWDZBQOSA-N	0	3	342.487	3.126	20	30		EGEDHN
CCN(Cc1ccc(OC)c(OCCCC#N)c1)C[C@@H]1CCCO1	ZINC000092407761	454562597	/nfs/dbraw/zinc/56/25/97/454562597.db2.gz	ZKYDFHJXGSOHCB-KRWDZBQOSA-N	0	3	332.444	3.379	20	30		EGEDHN
N#Cc1ccc(CCC(=O)N2CCN(CC3CCCCC3)CC2)cc1	ZINC000050008889	454568958	/nfs/dbraw/zinc/56/89/58/454568958.db2.gz	GUUYLJYVXTXOJT-UHFFFAOYSA-N	0	3	339.483	3.215	20	30		EGEDHN
C=CCN(CC=C)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000065517746	454582176	/nfs/dbraw/zinc/58/21/76/454582176.db2.gz	HMIZMSHDFLYMHQ-IBGZPJMESA-N	0	3	327.472	3.282	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N(C)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000074446836	454583137	/nfs/dbraw/zinc/58/31/37/454583137.db2.gz	CWAPBVBRRGINCO-IEBWSBKVSA-N	0	3	330.472	3.091	20	30		EGEDHN
CC#CCNC(=O)NCc1ccccc1-c1ccc(CN(C)C)cc1	ZINC000135007093	454623020	/nfs/dbraw/zinc/62/30/20/454623020.db2.gz	WBHZZFDQYUESJX-UHFFFAOYSA-N	0	3	335.451	3.238	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)CC1CCCCC1	ZINC000065931146	454640702	/nfs/dbraw/zinc/64/07/02/454640702.db2.gz	QERGJBBCGDWXOL-UHFFFAOYSA-N	0	3	327.472	3.419	20	30		EGEDHN
C=CCOc1ccc(CN2CCC(CCC(=O)OC)CC2)cc1OC	ZINC000093341555	454704709	/nfs/dbraw/zinc/70/47/09/454704709.db2.gz	ZEKWYQNFAAPXMZ-UHFFFAOYSA-N	0	3	347.455	3.425	20	30		EGEDHN
CC[C@@H](NCC(=O)N(C)C1(C#N)CCCCC1)c1ccc(OC)cc1	ZINC000124188592	454705067	/nfs/dbraw/zinc/70/50/67/454705067.db2.gz	HPYXRCIDNHLEKD-GOSISDBHSA-N	0	3	343.471	3.421	20	30		EGEDHN
C=CCNc1ncc(C(=O)NC[C@@H](c2ccc(C)cc2)N(C)C)s1	ZINC000136222465	454729926	/nfs/dbraw/zinc/72/99/26/454729926.db2.gz	URTIKYXGDNGZIW-HNNXBMFYSA-N	0	3	344.484	3.082	20	30		EGEDHN
C=CCCC(=O)NC1CCN(CCOc2ccc(Cl)cc2)CC1	ZINC000136693050	454752472	/nfs/dbraw/zinc/75/24/72/454752472.db2.gz	PRJNDHXIAZQHRH-UHFFFAOYSA-N	0	3	336.863	3.266	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cncc(-c3ccc(C)cc3)c2)CC1	ZINC000176574853	454759884	/nfs/dbraw/zinc/75/98/84/454759884.db2.gz	BGBLCGHNHKWVED-UHFFFAOYSA-N	0	3	335.451	3.437	20	30		EGEDHN
CCCN(CC(=O)N[C@@](C)(C#N)C(C)C)[C@@H]1CCc2ccccc2C1	ZINC000138499574	454793816	/nfs/dbraw/zinc/79/38/16/454793816.db2.gz	QTSXGKHNBMEFGO-CTNGQTDRSA-N	0	3	341.499	3.310	20	30		EGEDHN
C=CCN(Cc1ccc(Cl)s1)C(=O)NC[C@H]1CCCN1C	ZINC000139387467	454805504	/nfs/dbraw/zinc/80/55/04/454805504.db2.gz	CXECPUDMYHAPCK-GFCCVEGCSA-N	0	3	327.881	3.193	20	30		EGEDHN
C[C@@H]1CCCN(C(C)(C)CNC(=O)c2c(F)cc(C#N)cc2F)C1	ZINC000125821896	454850123	/nfs/dbraw/zinc/85/01/23/454850123.db2.gz	KGJWDDSWWCOWFY-GFCCVEGCSA-N	0	3	335.398	3.077	20	30		EGEDHN
N#CC1(C(=O)NCC2CCN(Cc3cccs3)CC2)CCCC1	ZINC000145770199	454855268	/nfs/dbraw/zinc/85/52/68/454855268.db2.gz	VUJUSEDJEKQZCU-UHFFFAOYSA-N	0	3	331.485	3.160	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](C)Cc2ccc(C)s2)CC1	ZINC000125975712	454861346	/nfs/dbraw/zinc/86/13/46/454861346.db2.gz	WFYYJVLTRFOHLW-CQSZACIVSA-N	0	3	335.517	3.327	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)c2cc(C#N)cs2)CCN1Cc1ccccc1	ZINC000177510947	454871910	/nfs/dbraw/zinc/87/19/10/454871910.db2.gz	SOEUPHDWDHVICF-RHSMWYFYSA-N	0	3	339.464	3.403	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CNCC(C)(C)NC(=O)OC(C)(C)C)cc1	ZINC000177591424	454880639	/nfs/dbraw/zinc/88/06/39/454880639.db2.gz	IZPCSMMRJSUWGQ-CQSZACIVSA-N	0	3	347.459	3.370	20	30		EGEDHN
C[C@@H](N[C@@H](C)c1ccc(C(F)(F)F)cc1)C(=O)N(C)CCC#N	ZINC000112523198	454889234	/nfs/dbraw/zinc/88/92/34/454889234.db2.gz	JBAVKFMAXCHWJX-NWDGAFQWSA-N	0	3	327.350	3.117	20	30		EGEDHN
Cc1cccc(C2(CN[C@H](C)C(=O)N(C)CCC#N)CCCC2)c1	ZINC000112541713	454889398	/nfs/dbraw/zinc/88/93/98/454889398.db2.gz	LKXPZNRZUKFMFO-QGZVFWFLSA-N	0	3	327.472	3.157	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ccc(F)cc2C(F)(F)F)CC1	ZINC000177874735	454915319	/nfs/dbraw/zinc/91/53/19/454915319.db2.gz	MDIYFYFYAGBVOD-UHFFFAOYSA-N	0	3	330.325	3.225	20	30		EGEDHN
C=CC1CCN(C(=O)Nc2ccc(C)cc2OCCN(C)C)CC1	ZINC000154676493	454918399	/nfs/dbraw/zinc/91/83/99/454918399.db2.gz	QSUFWBHESZDFGX-UHFFFAOYSA-N	0	3	331.460	3.365	20	30		EGEDHN
COc1cc2[nH]c(CCCNCc3ccc(C#N)o3)cc2c(OC)c1	ZINC000151144248	454943653	/nfs/dbraw/zinc/94/36/53/454943653.db2.gz	OFYFOHSXHRTIOM-UHFFFAOYSA-N	0	3	339.395	3.372	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N(C)CC1CCOCC1	ZINC000156024606	455073604	/nfs/dbraw/zinc/07/36/04/455073604.db2.gz	VIMQKZYYJLOVFX-HNNXBMFYSA-N	0	3	336.501	3.010	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCc2ccccc2COCCC)CC1	ZINC000171716888	455088331	/nfs/dbraw/zinc/08/83/31/455088331.db2.gz	QFQGPNXNDFCYLZ-UHFFFAOYSA-N	0	3	345.487	3.063	20	30		EGEDHN
CC[C@@H](NCC(=O)N[C@](C)(C#N)C(C)C)C(C)(C)c1ccccc1	ZINC000180011305	455115500	/nfs/dbraw/zinc/11/55/00/455115500.db2.gz	BKPRBGOUGMYZAA-YLJYHZDGSA-N	0	3	329.488	3.387	20	30		EGEDHN
CC[C@H]1CCCCN1CCNC(=O)Nc1ccccc1O[C@@H](C)C#N	ZINC000180073432	455127250	/nfs/dbraw/zinc/12/72/50/455127250.db2.gz	JNGBCTGQNVPGCI-HOTGVXAUSA-N	0	3	344.459	3.363	20	30		EGEDHN
CC(C)CCOCCNCc1cn(C)nc1-c1ccc(C#N)cc1	ZINC000180152757	455140812	/nfs/dbraw/zinc/14/08/12/455140812.db2.gz	XTVFLNASDWOJJK-UHFFFAOYSA-N	0	3	326.444	3.111	20	30		EGEDHN
FC(F)(F)Oc1ccc(C#CCN2CC[C@@]3(CCOC3)C2)cc1	ZINC000156826171	455152128	/nfs/dbraw/zinc/15/21/28/455152128.db2.gz	HKLICGBLTMOERV-MRXNPFEDSA-N	0	3	325.330	3.049	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1CCCN(C2CCCC2)CC1	ZINC000172416178	455152265	/nfs/dbraw/zinc/15/22/65/455152265.db2.gz	CDEFVAXUANXJNB-UHFFFAOYSA-N	0	3	328.456	3.342	20	30		EGEDHN
Cc1nc(C)c(CN2CCCN(c3ccccc3C#N)CC2)s1	ZINC000172752821	455182893	/nfs/dbraw/zinc/18/28/93/455182893.db2.gz	MMIPWWPPBACCQB-UHFFFAOYSA-N	0	3	326.469	3.344	20	30		EGEDHN
N#Cc1cnc2c(F)ccc(Cl)c2c1N1CC[C@H](N2CC=CC2)C1	ZINC000172773174	455186191	/nfs/dbraw/zinc/18/61/91/455186191.db2.gz	GDZNJHBCHBOKRN-ZDUSSCGKSA-N	0	3	342.805	3.349	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC000158325483	455292448	/nfs/dbraw/zinc/29/24/48/455292448.db2.gz	KRWMPCRAJNWNHU-HXUWFJFHSA-N	0	3	341.455	3.391	20	30		EGEDHN
CN(C)Cc1ccc(CNC(=O)c2ccc(C3(C#N)CC3)cc2)cc1	ZINC000183472172	455296945	/nfs/dbraw/zinc/29/69/45/455296945.db2.gz	AHZQDOPSZDELRS-UHFFFAOYSA-N	0	3	333.435	3.233	20	30		EGEDHN
C[C@@H]1CCC[C@@](C#N)(NC(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000265370297	455313771	/nfs/dbraw/zinc/31/37/71/455313771.db2.gz	OBOZPEGURBKJKX-DYESRHJHSA-N	0	3	339.483	3.487	20	30		EGEDHN
N#Cc1cccc(OC2CCN(C[C@H](O)C3CCCCC3)CC2)c1	ZINC000190517639	455336873	/nfs/dbraw/zinc/33/68/73/455336873.db2.gz	SRPZDMKFLDCHBF-FQEVSTJZSA-N	0	3	328.456	3.343	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCC1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC000184303297	455369198	/nfs/dbraw/zinc/36/91/98/455369198.db2.gz	VLFCXKBJMQFPDL-YLJYHZDGSA-N	0	3	344.499	3.151	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCCCN1CCN(c2ccccc2)CC1	ZINC000190739185	455376983	/nfs/dbraw/zinc/37/69/83/455376983.db2.gz	XKSWBZMBAXQCPT-NRFANRHFSA-N	0	3	343.515	3.307	20	30		EGEDHN
C[C@@H](NCC(=O)NC1(C#N)CCCCC1)C(C)(C)c1ccccc1	ZINC000181799395	455382963	/nfs/dbraw/zinc/38/29/63/455382963.db2.gz	JDKCJQSJAOAHKO-MRXNPFEDSA-N	0	3	327.472	3.285	20	30		EGEDHN
CCCN(CC(=O)Nc1cccc(C#N)c1)[C@@H]1[C@H]2CCO[C@H]2C1(C)C	ZINC000265897517	455401115	/nfs/dbraw/zinc/40/11/15/455401115.db2.gz	TZFWKILBRMWJHQ-BHIYHBOVSA-N	0	3	341.455	3.022	20	30		EGEDHN
CC(C)(C#N)CCCN1CCC(n2c3ccccc3[nH]c2=O)CC1	ZINC000174812748	455414910	/nfs/dbraw/zinc/41/49/10/455414910.db2.gz	WNRNGFVXYHFGHR-UHFFFAOYSA-N	0	3	326.444	3.296	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N[C@@H]1[C@H]2CCO[C@@H]2C1(C)C	ZINC000265970598	455417351	/nfs/dbraw/zinc/41/73/51/455417351.db2.gz	KRJVWRCGWRTBON-SVGFKBNWSA-N	0	3	348.512	3.054	20	30		EGEDHN
N#CC(C(=O)c1ccc2c(c1)OCCCO2)c1cnc2ccccc2n1	ZINC000190985737	455419659	/nfs/dbraw/zinc/41/96/59/455419659.db2.gz	YSCOLRPNSVTIJB-AWEZNQCLSA-N	0	3	345.358	3.281	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)Nc2ccc(Br)cc2)n1	ZINC000160129065	455431140	/nfs/dbraw/zinc/43/11/40/455431140.db2.gz	LRMIGQFCHTVTAL-NSHDSACASA-N	0	3	336.214	3.460	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC[C@H](c3ccccc3)[C@@H]2C)CC1	ZINC000175439492	455448951	/nfs/dbraw/zinc/44/89/51/455448951.db2.gz	VTGCREMQYDCTSF-LPHOPBHVSA-N	0	3	327.472	3.224	20	30		EGEDHN
CN(CCC#N)C(=O)CCNC(C)(c1ccccc1)c1ccccc1	ZINC000182212777	455462957	/nfs/dbraw/zinc/46/29/57/455462957.db2.gz	HSRRXDVAMBAUCI-UHFFFAOYSA-N	0	3	335.451	3.302	20	30		EGEDHN
C=CCCCC(=O)NCC1(N[C@@H](C)c2ccccc2)CCOCC1	ZINC000175658207	455478312	/nfs/dbraw/zinc/47/83/12/455478312.db2.gz	CAKPVZKVWIFVLV-KRWDZBQOSA-N	0	3	330.472	3.359	20	30		EGEDHN
CC[C@@H](NCCC(=O)Nc1ccc(C#N)cc1)c1c(C)noc1C	ZINC000182396865	455506081	/nfs/dbraw/zinc/50/60/81/455506081.db2.gz	WQOIINVPDKQGRZ-MRXNPFEDSA-N	0	3	326.400	3.233	20	30		EGEDHN
C=CCC1(C(=O)NCc2ccc(CN3CCC(O)CC3)cc2)CCC1	ZINC000191771440	455518344	/nfs/dbraw/zinc/51/83/44/455518344.db2.gz	FVSQPXTZRKSEHX-UHFFFAOYSA-N	0	3	342.483	3.006	20	30		EGEDHN
CCO[C@@H]1C[C@@H](N[C@H](C)C(=O)Nc2ccccc2C#N)C1(CC)CC	ZINC000247092226	455558704	/nfs/dbraw/zinc/55/87/04/455558704.db2.gz	PWLRHSWCMFNHQE-ZTFGCOKTSA-N	0	3	343.471	3.459	20	30		EGEDHN
N#Cc1ccc(NC[C@H](c2ccco2)N2CCCC2)cc1[N+](=O)[O-]	ZINC000267920737	455564829	/nfs/dbraw/zinc/56/48/29/455564829.db2.gz	IPQSQEPCGLTMNK-MRXNPFEDSA-N	0	3	326.356	3.308	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc([N+](=O)[O-])c(C)c2)CC1	ZINC000182761901	455582691	/nfs/dbraw/zinc/58/26/91/455582691.db2.gz	XSTSNJVTXXBXSL-UHFFFAOYSA-N	0	3	332.404	3.065	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(CN[C@@H]3CCC[C@H](C#N)C3)cc2)C[C@@H](C)O1	ZINC000185770342	455619478	/nfs/dbraw/zinc/61/94/78/455619478.db2.gz	JSNWOHOTYCJEJL-SGLNWRHMSA-N	0	3	341.499	3.468	20	30		EGEDHN
CC[C@@H](Cc1ccc(C)cc1)N(C)CC(=O)N[C@](C)(C#N)C(C)C	ZINC000247536886	455620824	/nfs/dbraw/zinc/62/08/24/455620824.db2.gz	OTTLRTVMQSWVLQ-AZUAARDMSA-N	0	3	329.488	3.302	20	30		EGEDHN
C[C@@H]1CCC[C@@](C#N)(NC(=O)[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000247557589	455624404	/nfs/dbraw/zinc/62/44/04/455624404.db2.gz	UHMRTEAPKFDUNJ-SLYNCCJLSA-N	0	3	339.483	3.487	20	30		EGEDHN
CCC[C@@H](N[C@H]1CCC[C@H](C#N)C1)C(=O)N1CCc2sccc2C1	ZINC000185810641	455626352	/nfs/dbraw/zinc/62/63/52/455626352.db2.gz	FKWLEUNNHXKCFP-BHYGNILZSA-N	0	3	345.512	3.473	20	30		EGEDHN
CCN1CCN(c2ccc(CN[C@H]3CCC[C@@H](C#N)C3)cc2F)CC1	ZINC000185817528	455627499	/nfs/dbraw/zinc/62/74/99/455627499.db2.gz	FIRRJMQXPVNOFG-AEFFLSMTSA-N	0	3	344.478	3.140	20	30		EGEDHN
Cn1cc(CN[C@@H](c2cncc(Br)c2)C2CC2)cc1C#N	ZINC000284051456	455629154	/nfs/dbraw/zinc/62/91/54/455629154.db2.gz	PIXQKRKXTZTBBJ-MRXNPFEDSA-N	0	3	345.244	3.295	20	30		EGEDHN
Cn1cc(CN[C@H](c2cncc(Br)c2)C2CC2)cc1C#N	ZINC000284049820	455629623	/nfs/dbraw/zinc/62/96/23/455629623.db2.gz	PIXQKRKXTZTBBJ-INIZCTEOSA-N	0	3	345.244	3.295	20	30		EGEDHN
C#CCOc1ccccc1CN1CCC[C@H](c2nnc(C3CC3)[nH]2)C1	ZINC000271423636	455631258	/nfs/dbraw/zinc/63/12/58/455631258.db2.gz	ZTQLKCOMTDBMOO-KRWDZBQOSA-N	0	3	336.439	3.074	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)c1ncnc2sccc21	ZINC000268328750	455651954	/nfs/dbraw/zinc/65/19/54/455651954.db2.gz	PKSITNJGKWMHNN-UHFFFAOYSA-N	0	3	337.452	3.131	20	30		EGEDHN
C[C@@H](c1cccc(C(F)(F)F)c1)N(C)CCC(=O)N(C)CCC#N	ZINC000271585276	455692764	/nfs/dbraw/zinc/69/27/64/455692764.db2.gz	RMVNGEYZEQFDRX-ZDUSSCGKSA-N	0	3	341.377	3.460	20	30		EGEDHN
CCc1ccc([C@@H](CNc2nccc(C#N)c2[N+](=O)[O-])N(C)C)cc1	ZINC000268481253	455695278	/nfs/dbraw/zinc/69/52/78/455695278.db2.gz	LLKFTQPEINRLPD-MRXNPFEDSA-N	0	3	339.399	3.139	20	30		EGEDHN
N#C[C@@H]1CCC[C@H](NCC(=O)N2CCC(Cc3ccccc3)CC2)C1	ZINC000192924581	455719544	/nfs/dbraw/zinc/71/95/44/455719544.db2.gz	SJVAYNMEJTTXJI-UXHICEINSA-N	0	3	339.483	3.140	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCC[C@@H](CNC(=O)C(C)(C)C)C1	ZINC000186229916	455721478	/nfs/dbraw/zinc/72/14/78/455721478.db2.gz	PJIZWAVKMPXHHF-KRWDZBQOSA-N	0	3	327.472	3.241	20	30		EGEDHN
COC(=O)[C@@H]1CCN(Cc2cccc(OCCCC#N)c2)C[C@H]1C	ZINC000248873506	455736098	/nfs/dbraw/zinc/73/60/98/455736098.db2.gz	BSEDVFSKDMNKTD-CRAIPNDOSA-N	0	3	330.428	3.000	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H](OC(C)C)c2ccccc2)CC1	ZINC000292794882	455759427	/nfs/dbraw/zinc/75/94/27/455759427.db2.gz	MXADKGDQMAFLFQ-LJQANCHMSA-N	0	3	330.472	3.309	20	30		EGEDHN
C[C@@H](N[C@@H]1CCN(Cc2ccccc2)C1=O)c1ccc(OCC#N)cc1	ZINC000271788632	455761038	/nfs/dbraw/zinc/76/10/38/455761038.db2.gz	IONPASOVYWLLSG-OXQOHEQNSA-N	0	3	349.434	3.041	20	30		EGEDHN
C[C@H]1CCNC(=O)[C@H]1NCCC(C#N)(c1ccccc1)c1ccccc1	ZINC000193662683	455769124	/nfs/dbraw/zinc/76/91/24/455769124.db2.gz	LAVVTYMFQHXOAL-PXNSSMCTSA-N	0	3	347.462	3.001	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN(Cc1ccccc1)[C@H](C)C1CC1	ZINC000249708339	455769486	/nfs/dbraw/zinc/76/94/86/455769486.db2.gz	BVONDDCSZAWGRY-IAGOWNOFSA-N	0	3	327.472	3.295	20	30		EGEDHN
CCN(CCN[C@@H](C)c1ccc(OCC#N)cc1)C(=O)OC(C)(C)C	ZINC000271855823	455788066	/nfs/dbraw/zinc/78/80/66/455788066.db2.gz	JHZCSPCSJLXSOI-HNNXBMFYSA-N	0	3	347.459	3.497	20	30		EGEDHN
CC#CCNC1(Cc2ccc(F)cc2Br)CCOCC1	ZINC000293738537	455796135	/nfs/dbraw/zinc/79/61/35/455796135.db2.gz	ZXKVUOHFWNXPJH-UHFFFAOYSA-N	0	3	340.236	3.293	20	30		EGEDHN
CCCC[C@H](NCCC(=O)N(C)CCC#N)c1ccc(OC)cc1	ZINC000271881260	455797647	/nfs/dbraw/zinc/79/76/47/455797647.db2.gz	ZIBBJNCHBBVTFS-SFHVURJKSA-N	0	3	331.460	3.278	20	30		EGEDHN
CC(C)CCOC1CCN(CCC(=O)Nc2ccccc2C#N)CC1	ZINC000194339288	455829955	/nfs/dbraw/zinc/82/99/55/455829955.db2.gz	SREFBKTYBJVCEA-UHFFFAOYSA-N	0	3	343.471	3.414	20	30		EGEDHN
N#C[C@@H]1CCC[C@H](NCCCS(=O)(=O)c2ccc(Cl)cc2)C1	ZINC000295027591	455835631	/nfs/dbraw/zinc/83/56/31/455835631.db2.gz	OEZXVADJJAGPNP-HIFRSBDPSA-N	0	3	340.876	3.176	20	30		EGEDHN
C=CCN1CCC(Nc2cc(C(F)(F)F)ncc2[N+](=O)[O-])CC1	ZINC000278453545	455835791	/nfs/dbraw/zinc/83/57/91/455835791.db2.gz	RWGCMRHGESXJNU-UHFFFAOYSA-N	0	3	330.310	3.071	20	30		EGEDHN
CN(C)C(=O)C1(NCc2ccccc2C(C)(C)C#N)CCCCC1	ZINC000295063351	455837748	/nfs/dbraw/zinc/83/77/48/455837748.db2.gz	CISVCBZCZNQBJH-UHFFFAOYSA-N	0	3	327.472	3.368	20	30		EGEDHN
C[C@H]1CN(C(=O)c2ccc(C(C)(C)C#N)cc2)CCN(C2CC2)C1	ZINC000295464530	455849725	/nfs/dbraw/zinc/84/97/25/455849725.db2.gz	XTTNDYYXEKFVBX-OAHLLOKOSA-N	0	3	325.456	3.044	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H]2CC[C@@H](c3ccc(F)cc3)C2)CC1	ZINC000279395440	455864547	/nfs/dbraw/zinc/86/45/47/455864547.db2.gz	ATSOFGQIVJJWGB-VQIMIIECSA-N	0	3	345.462	3.411	20	30		EGEDHN
C=CCC[C@@H](CC)N[C@@H](C(N)=O)c1cccc(Br)c1	ZINC000279592184	455868542	/nfs/dbraw/zinc/86/85/42/455868542.db2.gz	CRKXYBYLGCYGMG-ZIAGYGMSSA-N	0	3	325.250	3.310	20	30		EGEDHN
COc1ccc([C@@H](C)NC(=O)C(C#N)Cc2ccc(C#N)cc2)cc1	ZINC000279812892	455874149	/nfs/dbraw/zinc/87/41/49/455874149.db2.gz	XNEVMIMYSYSADQ-KDOFPFPSSA-N	0	3	333.391	3.127	20	30		EGEDHN
CC(C)[C@H](CNC(=O)C(C#N)Cc1ccc(C#N)cc1)c1cccnc1	ZINC000280048824	455881670	/nfs/dbraw/zinc/88/16/70/455881670.db2.gz	MBDDBMQIQKUKHH-UXHICEINSA-N	0	3	346.434	3.192	20	30		EGEDHN
N#Cc1ccc(Br)c(CN[C@@H]2[C@H]3CCO[C@H]3C23CCC3)c1	ZINC000296221308	455883382	/nfs/dbraw/zinc/88/33/82/455883382.db2.gz	WXDPQQKKJFRZBK-FVQBIDKESA-N	0	3	347.256	3.368	20	30		EGEDHN
Cc1ccc([C@@H](CNC(=O)Cc2ccc(C#N)cc2)N2CCCC2)cc1	ZINC000194882324	455895367	/nfs/dbraw/zinc/89/53/67/455895367.db2.gz	NQYVVYRUOLKFSL-OAQYLSRUSA-N	0	3	347.462	3.363	20	30		EGEDHN
C[C@@H](C1CCN(C)CC1)N(C)C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000272342734	455919739	/nfs/dbraw/zinc/91/97/39/455919739.db2.gz	MYTAMOPLWLHAFO-LBPRGKRZSA-N	0	3	334.851	3.406	20	30		EGEDHN
C=C(C)COc1cccc(NC(=O)N2CC[C@H]3CCN(C)C[C@H]32)c1	ZINC000272368059	455927557	/nfs/dbraw/zinc/92/75/57/455927557.db2.gz	GGCREYKBMTVZIV-CRAIPNDOSA-N	0	3	329.444	3.199	20	30		EGEDHN
CC[C@](C)(C#N)C(=O)N(C)CCC1CCN(c2ccncc2)CC1	ZINC000285898779	455938103	/nfs/dbraw/zinc/93/81/03/455938103.db2.gz	UVFUUQGXKYVLID-LJQANCHMSA-N	0	3	328.460	3.086	20	30		EGEDHN
CN(C)CCN(CCCc1ccccc1)C(=O)c1ccc(CC#N)cc1	ZINC000270366960	455939511	/nfs/dbraw/zinc/93/95/11/455939511.db2.gz	TWLRUPLOBKCDOC-UHFFFAOYSA-N	0	3	349.478	3.389	20	30		EGEDHN
COc1ccc([C@@H](CNc2ccc(C#N)cc2)N(C)C)cc1OC	ZINC000280465246	455977297	/nfs/dbraw/zinc/97/72/97/455977297.db2.gz	MHEHWYSONJKAGG-QGZVFWFLSA-N	0	3	325.412	3.290	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(C3CC3)cnc2Cl)CC1	ZINC000280493764	455983328	/nfs/dbraw/zinc/98/33/28/455983328.db2.gz	KHHOSGBMNUJTBP-UHFFFAOYSA-N	0	3	333.863	3.383	20	30		EGEDHN
CCCNc1ccc(CNC(=O)C(C#N)Cc2ccc(C#N)cc2)cc1	ZINC000280521384	455988870	/nfs/dbraw/zinc/98/88/70/455988870.db2.gz	JBDOPEOUXQWQEN-IBGZPJMESA-N	0	3	346.434	3.379	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2c(C)onc2-c2ccccc2C)CC1	ZINC000280640263	456021212	/nfs/dbraw/zinc/02/12/12/456021212.db2.gz	YGXSLLKWDLFXPY-UHFFFAOYSA-N	0	3	339.439	3.339	20	30		EGEDHN
CC(C)C[C@@H](NCC(=O)N(CCC#N)CCC#N)c1ccccc1	ZINC000272777891	456068645	/nfs/dbraw/zinc/06/86/45/456068645.db2.gz	AUICJRFGZTZQGB-GOSISDBHSA-N	0	3	326.444	3.019	20	30		EGEDHN
COc1c(O)cccc1CNCCSCc1ccccc1C#N	ZINC000287884353	456080491	/nfs/dbraw/zinc/08/04/91/456080491.db2.gz	ZLBHYRBPYRZGMO-UHFFFAOYSA-N	0	3	328.437	3.295	20	30		EGEDHN
CCOc1cc(CNCCCC#N)cc(Br)c1OC	ZINC000273038975	456156804	/nfs/dbraw/zinc/15/68/04/456156804.db2.gz	HXIJFNBHJZDTGR-UHFFFAOYSA-N	0	3	327.222	3.250	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N1CCCN(Cc2ccccc2)C[C@H]1C	ZINC000188992628	456193162	/nfs/dbraw/zinc/19/31/62/456193162.db2.gz	LMJQBRVKZSMPOC-WIYYLYMNSA-N	0	3	344.499	3.338	20	30		EGEDHN
C[C@@H]1CN(CC2CCN(c3cccc(F)c3C#N)CC2)C[C@@H](C)O1	ZINC000263779189	456219894	/nfs/dbraw/zinc/21/98/94/456219894.db2.gz	VIVITNYCAWABEP-HUUCEWRRSA-N	0	3	331.435	3.023	20	30		EGEDHN
C[C@]12CN(C(=O)C(C#N)Cc3ccc(C#N)cc3)C[C@@H]1[C@@H]1CC[C@H]2C1	ZINC000333546761	456232638	/nfs/dbraw/zinc/23/26/38/456232638.db2.gz	TUFDMFJJAVYTTG-WVXKDWSHSA-N	0	3	333.435	3.135	20	30		EGEDHN
C=CCOc1ccc(CNCc2cc(OC)c(O)c(OC)c2)cc1	ZINC000237104699	456233903	/nfs/dbraw/zinc/23/39/03/456233903.db2.gz	ZXFZRGCDNCLLIE-UHFFFAOYSA-N	0	3	329.396	3.264	20	30		EGEDHN
C=CCc1cc(C(=O)Nc2cccc(CNC)c2)cc(OC)c1OC	ZINC000237237093	456250974	/nfs/dbraw/zinc/25/09/74/456250974.db2.gz	FBRIYCIXUIGYKF-UHFFFAOYSA-N	0	3	340.423	3.404	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N(C)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000189192912	456251462	/nfs/dbraw/zinc/25/14/62/456251462.db2.gz	SQHPZXMLNOWXBP-FPOVZHCZSA-N	0	3	344.499	3.338	20	30		EGEDHN
N#C[C@H]1CCC[C@@H](NCc2cccc(C(=O)NCc3ccco3)c2)C1	ZINC000274205011	456252805	/nfs/dbraw/zinc/25/28/05/456252805.db2.gz	MBHDZOVMMINWID-MAUKXSAKSA-N	0	3	337.423	3.382	20	30		EGEDHN
CSc1ccc([C@H](CNC(=O)NCCCCC#N)N(C)C)cc1	ZINC000297670966	456273367	/nfs/dbraw/zinc/27/33/67/456273367.db2.gz	NVABOBARXQSXBB-INIZCTEOSA-N	0	3	334.489	3.004	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)NCc1c(C)onc1CC)C(C)C	ZINC000297851445	456309940	/nfs/dbraw/zinc/30/99/40/456309940.db2.gz	SUNNMKURANPELG-GOSISDBHSA-N	0	3	348.491	3.043	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)[C@H]1CCCC(F)(F)C1	ZINC000281767126	456314724	/nfs/dbraw/zinc/31/47/24/456314724.db2.gz	CZYWYUXQNJESMU-KRWDZBQOSA-N	0	3	349.425	3.274	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@H](CN(C)Cc2scnc2C)C1	ZINC000275941879	456356105	/nfs/dbraw/zinc/35/61/05/456356105.db2.gz	DZEZWUWQSBXVMW-YJBOKZPZSA-N	0	3	335.517	3.334	20	30		EGEDHN
N#Cc1ccccc1COc1cccc(CN[C@H]2C=C[C@@H](CO)C2)c1	ZINC000347777881	456363004	/nfs/dbraw/zinc/36/30/04/456363004.db2.gz	MTGMAWWBVIUHID-XLIONFOSSA-N	0	3	334.419	3.164	20	30		EGEDHN
C=CC[C@H](CC)NC(=O)Nc1cccc(N2CCN(CC)CC2)c1	ZINC000282008411	456389354	/nfs/dbraw/zinc/38/93/54/456389354.db2.gz	RBLOZKDHGRFPFJ-INIZCTEOSA-N	0	3	330.476	3.305	20	30		EGEDHN
C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)NC[C@H](C)N(C)C1CC1	ZINC000352897570	456398645	/nfs/dbraw/zinc/39/86/45/456398645.db2.gz	BQIJUXRGFTUTTR-INIZCTEOSA-N	0	3	347.507	3.034	20	30		EGEDHN
C=CCN1CC[C@H](N2CCCCC[C@H]2C[C@@H](O)c2ccccc2)C1=O	ZINC000282067999	456405758	/nfs/dbraw/zinc/40/57/58/456405758.db2.gz	SQWDXLIXFAWKFQ-SLFFLAALSA-N	0	3	342.483	3.142	20	30		EGEDHN
COc1cc2c(cc1OC)CN(CCCC1(C#N)CCOCC1)CC2	ZINC000282120765	456417415	/nfs/dbraw/zinc/41/74/15/456417415.db2.gz	XSXAVHCXMMXKDC-UHFFFAOYSA-N	0	3	344.455	3.162	20	30		EGEDHN
CCCN(CC(=O)NC1(C#N)CCCCC1)[C@H]1C[C@@H](OCC)C1(C)C	ZINC000303928172	456495755	/nfs/dbraw/zinc/49/57/55/456495755.db2.gz	WUSDWSNJNBUDCJ-DLBZAZTESA-N	0	3	349.519	3.245	20	30		EGEDHN
N#Cc1ccc(CNCCc2nccn2Cc2ccccc2)c(F)c1	ZINC000343271874	456498959	/nfs/dbraw/zinc/49/89/59/456498959.db2.gz	PHYKUZGSZIETQM-UHFFFAOYSA-N	0	3	334.398	3.274	20	30		EGEDHN
C[C@@H](CNC(=O)NCC(C)(C)CCC#N)N(C)Cc1ccccc1	ZINC000353115173	456499728	/nfs/dbraw/zinc/49/97/28/456499728.db2.gz	UVFHPAYENJGHMI-INIZCTEOSA-N	0	3	330.476	3.136	20	30		EGEDHN
COc1cc(CNCc2ccccc2Cn2ccnc2)ccc1C#N	ZINC000348192994	456527083	/nfs/dbraw/zinc/52/70/83/456527083.db2.gz	NGTZYPIFYZQRBG-UHFFFAOYSA-N	0	3	332.407	3.101	20	30		EGEDHN
C=CCn1c(C2CCC2)nnc1N1CCN(C2CCCCC2)CC1	ZINC000337829881	456567613	/nfs/dbraw/zinc/56/76/13/456567613.db2.gz	YMLBXTFJAMWVBX-UHFFFAOYSA-N	0	3	329.492	3.186	20	30		EGEDHN
N#CCCCOc1cccc(CN[C@@H]2CCO[C@@H]2c2cccnc2)c1	ZINC000343392788	456586944	/nfs/dbraw/zinc/58/69/44/456586944.db2.gz	VQVMDXKGCYEJLG-WOJBJXKFSA-N	0	3	337.423	3.384	20	30		EGEDHN
CCN1CCO[C@@H](CNCc2ccc(C#N)cc2)[C@H]1c1ccccc1	ZINC000343406349	456600061	/nfs/dbraw/zinc/60/00/61/456600061.db2.gz	VAWQCRFHBACYBW-LEWJYISDSA-N	0	3	335.451	3.110	20	30		EGEDHN
CC(C)(C)[C@@H](NCC(=O)N(CCC#N)CCC#N)c1ccc(F)cc1	ZINC000299110511	456608385	/nfs/dbraw/zinc/60/83/85/456608385.db2.gz	ZYHYYXXTFBWIDO-SFHVURJKSA-N	0	3	344.434	3.158	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1CC[C@H](c2ccc(C)cc2C)C1	ZINC000348306469	456611685	/nfs/dbraw/zinc/61/16/85/456611685.db2.gz	MGQMTJWWTCEJBF-AEFFLSMTSA-N	0	3	327.472	3.101	20	30		EGEDHN
C[C@H](C#N)CN(C)C(=O)N[C@@H]1CCN(Cc2ccccc2)CC1(C)C	ZINC000282759242	456616049	/nfs/dbraw/zinc/61/60/49/456616049.db2.gz	BVYJZAWINXMTRH-SJLPKXTDSA-N	0	3	342.487	3.088	20	30		EGEDHN
COCCN(C)CC[C@H](Nc1nccc(C)c1C#N)c1ccccc1	ZINC000343438898	456622255	/nfs/dbraw/zinc/62/22/55/456622255.db2.gz	NLTICWLCHXDUMC-IBGZPJMESA-N	0	3	338.455	3.383	20	30		EGEDHN
CN(C)C[C@@H](NC(=O)c1cccc(CC#N)c1)c1ccc(Cl)cc1	ZINC000282817992	456634323	/nfs/dbraw/zinc/63/43/23/456634323.db2.gz	IOSAJHGKHFMCDS-GOSISDBHSA-N	0	3	341.842	3.439	20	30		EGEDHN
C[C@H](CN1CCOCC1)N(Cc1ccccc1)Cc1cccc(C#N)c1	ZINC000353324075	456638906	/nfs/dbraw/zinc/63/89/06/456638906.db2.gz	GJCRYBUFSATTCR-LJQANCHMSA-N	0	3	349.478	3.281	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N[C@H]1CCCC[C@H]1OC	ZINC000277008809	456651642	/nfs/dbraw/zinc/65/16/42/456651642.db2.gz	PHKPRCZQAKPHBC-BHYGNILZSA-N	0	3	336.501	3.198	20	30		EGEDHN
Cc1c([C@@H](C)NCCc2cccc(C#N)c2)nnn1-c1ccc(F)cc1	ZINC000343508377	456668909	/nfs/dbraw/zinc/66/89/09/456668909.db2.gz	ICDPBVFGYLNFHY-CQSZACIVSA-N	0	3	349.413	3.480	20	30		EGEDHN
N#CCOc1ccc(CN[C@@H]2CCO[C@@H]2c2ccc(F)c(F)c2)cc1	ZINC000277074024	456671717	/nfs/dbraw/zinc/67/17/17/456671717.db2.gz	PFAKGLFPYSDJKP-RTBURBONSA-N	0	3	344.361	3.487	20	30		EGEDHN
CN(C)C[C@H](NC(=O)c1ccc(CC#N)cc1)c1ccc(Cl)cc1	ZINC000282944640	456672433	/nfs/dbraw/zinc/67/24/33/456672433.db2.gz	MYFXCTBDAKQETC-SFHVURJKSA-N	0	3	341.842	3.439	20	30		EGEDHN
C[C@@H](NC(=O)C(C#N)Cc1ccc(C#N)cc1)c1cccc(F)c1F	ZINC000348418204	456677564	/nfs/dbraw/zinc/67/75/64/456677564.db2.gz	WUYUJIHAZHGUJT-IUODEOHRSA-N	0	3	339.345	3.396	20	30		EGEDHN
COCCN(Cc1ccc(C#N)cc1)C[C@H](O)c1ccccc1Cl	ZINC000299442492	456694602	/nfs/dbraw/zinc/69/46/02/456694602.db2.gz	XCRPGYSWGVBQSI-IBGZPJMESA-N	0	3	344.842	3.394	20	30		EGEDHN
Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@H]1N2C(=O)Cc1ccc(C#N)cc1	ZINC000299527734	456718535	/nfs/dbraw/zinc/71/85/35/456718535.db2.gz	KVPGCHFHMLLZOI-PZJWPPBQSA-N	0	3	345.446	3.244	20	30		EGEDHN
C[C@@H](C1CCN(C)CC1)N(C)C(=O)Nc1nccn1-c1ccccc1	ZINC000328732105	456747300	/nfs/dbraw/zinc/74/73/00/456747300.db2.gz	GYRCOCCZPGCPAY-HNNXBMFYSA-N	0	3	341.459	3.080	20	30		EGEDHN
COC1(C(=O)NCc2ccccc2CN2CCCCC2)CCOCC1	ZINC000328832657	456771248	/nfs/dbraw/zinc/77/12/48/456771248.db2.gz	VNGJXUJXUPUCQK-UHFFFAOYSA-N	0	3	346.471	3.325	20	30		EGEDHN
C[C@@H](C(=O)Nc1cccc(C#N)c1)N1CC[C@H](C2CCOCC2)C1	ZINC000328856905	456778138	/nfs/dbraw/zinc/77/81/38/456778138.db2.gz	UJGSETJDNKLGPW-YOEHRIQHSA-N	0	3	327.428	3.283	20	30		EGEDHN
CN1CCC(Oc2ccc(CNC(=O)[C@@H]3C[C@]34CCOC4)cc2)CC1	ZINC000328857778	456778150	/nfs/dbraw/zinc/77/81/50/456778150.db2.gz	DIVBWTVVJBTIRH-ICSRJNTNSA-N	0	3	344.455	3.043	20	30		EGEDHN
CO[C@@H](CO/N=C/c1ccc(N2CCOCC2)cc1)c1ccccc1	ZINC000283526569	456796569	/nfs/dbraw/zinc/79/65/69/456796569.db2.gz	WWWIJUFDLGOEOR-GDUPUGJQSA-N	0	3	340.423	3.261	20	30		EGEDHN
C=C(C)CN(CC)C(=O)c1cnn(CCN(C)C)c1-c1ccccc1	ZINC000277365987	456797572	/nfs/dbraw/zinc/79/75/72/456797572.db2.gz	IRAXKGPQPDLELQ-UHFFFAOYSA-N	0	3	340.471	3.150	20	30		EGEDHN
N#CCc1ccc(CN2CC[C@@](CO)(Cc3ccc(F)cc3)C2)cc1	ZINC000344170168	456802895	/nfs/dbraw/zinc/80/28/95/456802895.db2.gz	QMWOZRLMYBJPLR-OAQYLSRUSA-N	0	3	338.426	3.319	20	30		EGEDHN
CC(C)n1nccc1[C@H]1OCC[C@@H]1NC(=O)[C@H](C1CC1)N1CCCC1	ZINC000329067936	456827612	/nfs/dbraw/zinc/82/76/12/456827612.db2.gz	XHQKTVALYMNUPZ-SZMVWBNQSA-N	0	3	346.475	3.125	20	30		EGEDHN
CSCC[C@](C)(C#N)NC(=O)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000344698577	456848988	/nfs/dbraw/zinc/84/89/88/456848988.db2.gz	JAVPYMAEUMIGSY-IEBWSBKVSA-N	0	3	345.512	3.050	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@H]2N(C)CCCC2(C)C)cc1OC	ZINC000344695858	456849033	/nfs/dbraw/zinc/84/90/33/456849033.db2.gz	GWZGJOIXVSOUAR-GOSISDBHSA-N	0	3	346.471	3.110	20	30		EGEDHN
CC(C)(C#N)CNC(=O)N[C@@H]1CCN(Cc2ccccc2)CC1(C)C	ZINC000338659601	456849226	/nfs/dbraw/zinc/84/92/26/456849226.db2.gz	QWQUBWDFCBNKHI-QGZVFWFLSA-N	0	3	342.487	3.136	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccc(OC(F)F)c(F)c2)nc(C)n1	ZINC000344725553	456852614	/nfs/dbraw/zinc/85/26/14/456852614.db2.gz	LEVJWWKAWOHASM-NSHDSACASA-N	0	3	335.285	3.324	20	30		EGEDHN
CN(C)Cc1ccc(CNC(=O)C[C@@H](CC#N)c2ccccc2)cc1	ZINC000353688336	456855384	/nfs/dbraw/zinc/85/53/84/456855384.db2.gz	XCZPHQCGSLTUCS-HXUWFJFHSA-N	0	3	335.451	3.452	20	30		EGEDHN
C=C(C)Cn1c(C2CCC2)nnc1N1CCN(C2CCCC2)CC1	ZINC000338785853	456857698	/nfs/dbraw/zinc/85/76/98/456857698.db2.gz	DPIBMCSKKBPGOR-UHFFFAOYSA-N	0	3	329.492	3.186	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccc([C@@H]3CCCOC3)cc2)nc(C)n1	ZINC000329250922	456860730	/nfs/dbraw/zinc/86/07/30/456860730.db2.gz	BGWFDYBEDRCCOZ-QZTJIDSGSA-N	0	3	335.407	3.478	20	30		EGEDHN
CN1CCC(NC(=O)c2ccc(Oc3ccc(CC#N)cc3)cc2)CC1	ZINC000348811509	456866984	/nfs/dbraw/zinc/86/69/84/456866984.db2.gz	ORNKXQDPETVUHJ-UHFFFAOYSA-N	0	3	349.434	3.369	20	30		EGEDHN
CCN1CCO[C@H](CN[C@@H]2CCC[C@@H](C#N)C2)[C@H]1c1ccccc1	ZINC000344900749	456870048	/nfs/dbraw/zinc/87/00/48/456870048.db2.gz	YVKPIZMJKYKVQM-VBSBHUPXSA-N	0	3	327.472	3.120	20	30		EGEDHN
CC[C@H](C)n1ncc(NC(=O)N2CC[C@@H]3CCN(C)C[C@H]32)c1C1CC1	ZINC000329408473	456886006	/nfs/dbraw/zinc/88/60/06/456886006.db2.gz	CMDGSXQVRSAWMO-GRDNDAEWSA-N	0	3	345.491	3.303	20	30		EGEDHN
O=C(NCc1ccc2c(c1)C(=O)NCC2)[C@H]1CCCN1C1CCCC1	ZINC000329430251	456889953	/nfs/dbraw/zinc/88/99/53/456889953.db2.gz	KEBPUDGDVVLFLJ-GOSISDBHSA-N	0	3	341.455	3.411	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](CO)Cc2ccccc2C(F)(F)F)o1	ZINC000345044715	456907999	/nfs/dbraw/zinc/90/79/99/456907999.db2.gz	WAAOVVCPXAXROZ-LBPRGKRZSA-N	0	3	338.329	3.111	20	30		EGEDHN
CC1(C)CCCc2sc(NC(=O)N[C@H]3CCc4nc[nH]c4C3)nc21	ZINC000329559455	456908654	/nfs/dbraw/zinc/90/86/54/456908654.db2.gz	ILQZGQKCCQTQKX-JTQLQIEISA-N	0	3	345.472	3.364	20	30		EGEDHN
COc1ccc(CCCN(C)[C@@H](C)C(=O)N[C@](C)(C#N)C(C)C)cc1	ZINC000345093063	456923306	/nfs/dbraw/zinc/92/33/06/456923306.db2.gz	RTVLHVUWDLAKOA-OXJNMPFZSA-N	0	3	345.487	3.003	20	30		EGEDHN
O=C(NC1CCCCC1)NC1CCN(CC2CCC(=O)CC2)CC1	ZINC000329661128	456923329	/nfs/dbraw/zinc/92/33/29/456923329.db2.gz	INKCVEOBIAYRSP-UHFFFAOYSA-N	0	3	335.492	3.046	20	30		EGEDHN
Cn1nc2c(c1CNC(=O)[C@H]1CCCN1C1CCCC1)CCCC2	ZINC000329742751	456934654	/nfs/dbraw/zinc/93/46/54/456934654.db2.gz	PPZKSTBSONUJSO-QGZVFWFLSA-N	0	3	330.476	3.162	20	30		EGEDHN
O=C(NC[C@@H]1CCCCN1C1CC1)[C@@H]1CC[C@H](C(F)(F)F)NC1=O	ZINC000329930961	456962682	/nfs/dbraw/zinc/96/26/82/456962682.db2.gz	AMIUQPINSIYKER-RWMBFGLXSA-N	0	3	347.381	3.257	20	30		EGEDHN
N#Cc1ccnc(NC[C@@H]2CCCN(Cc3cccs3)C2)c1Cl	ZINC000341850423	456971260	/nfs/dbraw/zinc/97/12/60/456971260.db2.gz	CVXHUEFLILAEEV-ZDUSSCGKSA-N	0	3	346.887	3.414	20	30		EGEDHN
C[C@H]1[C@@H](NC(=O)Nc2cccc(C#Cc3ccccn3)c2)CCCN1C	ZINC000345306726	456973709	/nfs/dbraw/zinc/97/37/09/456973709.db2.gz	YUCPLFPXZYDIHW-JXFKEZNVSA-N	0	3	348.450	3.086	20	30		EGEDHN
C=CC[C@H](CO)CN[C@H]1CCc2c1c(Br)ccc2F	ZINC000341869925	456979414	/nfs/dbraw/zinc/97/94/14/456979414.db2.gz	AKHARSQKXXXRJI-HZMBPMFUSA-N	0	3	328.225	3.350	20	30		EGEDHN
CC(C(=O)NCC[C@H]1CCC[C@@H](C)C1)S(=O)(=O)C1CCOCC1	ZINC000330151811	456993063	/nfs/dbraw/zinc/99/30/63/456993063.db2.gz	LPJCWIFZOLEHCM-RBSFLKMASA-N	0	3	345.505	3.142	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NC[C@H]1CCCN1Cc1ccccc1)OCC	ZINC000339220858	456999906	/nfs/dbraw/zinc/99/99/06/456999906.db2.gz	VATUGKNBNNDKJS-RTBURBONSA-N	0	3	330.472	3.139	20	30		EGEDHN
C[C@H]1C[C@H]1N1CCN(C(=O)c2cccc(SCC#N)c2)C[C@@H](C)C1	ZINC000346285327	457028512	/nfs/dbraw/zinc/02/85/12/457028512.db2.gz	YLSMIHLQOJFINB-RLFYNMQTSA-N	0	3	343.496	3.105	20	30		EGEDHN
CCCN(C)[C@@H](CNC(=O)CSCC#N)c1ccc(Cl)cc1	ZINC000358923037	457036921	/nfs/dbraw/zinc/03/69/21/457036921.db2.gz	VZQJRRWXNHNYGP-HNNXBMFYSA-N	0	3	339.892	3.096	20	30		EGEDHN
CCCN(CC(=O)N(CC)C[C@H](C)C#N)[C@H]1CCc2ccccc21	ZINC000346569569	457051240	/nfs/dbraw/zinc/05/12/40/457051240.db2.gz	BOEJPSWONHZULE-APWZRJJASA-N	0	3	327.472	3.394	20	30		EGEDHN
COc1cc(CN[C@@H]2CC[C@H](C#N)C2)cc(Br)c1OC	ZINC000349803972	457058146	/nfs/dbraw/zinc/05/81/46/457058146.db2.gz	RYSCWGDRBXRMJM-CMPLNLGQSA-N	0	3	339.233	3.248	20	30		EGEDHN
C=C(C)Cn1c(C)nnc1N1C[C@@H](C)N(Cc2ccccc2)C[C@H]1C	ZINC000359235621	457067003	/nfs/dbraw/zinc/06/70/03/457067003.db2.gz	VCIOISDLFSVIGV-IAGOWNOFSA-N	0	3	339.487	3.262	20	30		EGEDHN
COc1ccc(SC)c(OC)c1C(=O)N[C@@H]1CCN(C)[C@H](C)C1	ZINC000330673679	457069592	/nfs/dbraw/zinc/06/95/92/457069592.db2.gz	YSATZVJEJNETRP-VXGBXAGGSA-N	0	3	338.473	3.213	20	30		EGEDHN
CC(C)CN(Cc1ccc(C#N)cc1)C(=O)CN1[C@@H](C)CC[C@@H]1C	ZINC000342032765	457069719	/nfs/dbraw/zinc/06/97/19/457069719.db2.gz	AMIMWTKQGQJFDQ-IRXDYDNUSA-N	0	3	327.472	3.416	20	30		EGEDHN
Cc1c(NC(=O)N(C)[C@@H](C)C2CCN(C)CC2)cccc1[N+](=O)[O-]	ZINC000330702947	457072936	/nfs/dbraw/zinc/07/29/36/457072936.db2.gz	IQFPISPZOGYOSF-ZDUSSCGKSA-N	0	3	334.420	3.111	20	30		EGEDHN
CC(C)CC(=O)N1CCC(N[C@@H](C)c2ccc(C#N)cc2F)CC1	ZINC000330789550	457085482	/nfs/dbraw/zinc/08/54/82/457085482.db2.gz	SBMJIPBKVBQGAO-AWEZNQCLSA-N	0	3	331.435	3.385	20	30		EGEDHN
Cc1nn(CC(F)(F)F)cc1C(=O)N[C@H](C)CN1CCC[C@@H](C)C1	ZINC000331041272	457124533	/nfs/dbraw/zinc/12/45/33/457124533.db2.gz	DMIUGFXDDQZLAE-VXGBXAGGSA-N	0	3	346.397	3.179	20	30		EGEDHN
CC(C)(CNC(=O)Nc1ccc(C(N)=O)cc1F)N1CCCCC1	ZINC000331083461	457129156	/nfs/dbraw/zinc/12/91/56/457129156.db2.gz	YUUAZPSHZFGEAW-UHFFFAOYSA-N	0	3	336.411	3.299	20	30		EGEDHN
CC(C)CCn1ncc(NC(=O)NC2CCN(C)CC2)c1C(C)C	ZINC000331108023	457133761	/nfs/dbraw/zinc/13/37/61/457133761.db2.gz	JTNCLMPAICKVFO-UHFFFAOYSA-N	0	3	335.496	3.473	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H]1C)OCC	ZINC000359829601	457135422	/nfs/dbraw/zinc/13/54/22/457135422.db2.gz	FYQRDWZDLWKRQV-UHOSZYNNSA-N	0	3	330.472	3.137	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCN1C	ZINC000331228318	457150451	/nfs/dbraw/zinc/15/04/51/457150451.db2.gz	GIKWNQXQXGPSLV-SKDRFNHKSA-N	0	3	345.321	3.401	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)c1ccc(C#N)s1)c1ccsc1	ZINC000362964951	457178214	/nfs/dbraw/zinc/17/82/14/457178214.db2.gz	YGUIXGZFUULMSV-CQSZACIVSA-N	0	3	333.482	3.494	20	30		EGEDHN
CC(C#N)C(=O)N[C@@H]1CCCN(c2ccc(Cl)cc2Cl)C1	ZINC000356846753	457182262	/nfs/dbraw/zinc/18/22/62/457182262.db2.gz	PNYOEPCGYLOZMU-CMPLNLGQSA-N	0	3	326.227	3.238	20	30		EGEDHN
C[C@@H]1C[C@H](N(C)C(=O)c2cnccc2C#N)CCN1Cc1ccccc1	ZINC000342269621	457201308	/nfs/dbraw/zinc/20/13/08/457201308.db2.gz	BMDNCMAGEVYYIH-VQIMIIECSA-N	0	3	348.450	3.078	20	30		EGEDHN
N#Cc1ccc([C@H](NCCC23CC4CC(CC(C4)C2)C3)C(N)=O)cc1	ZINC000360060713	457232541	/nfs/dbraw/zinc/23/25/41/457232541.db2.gz	OKFMGYBUXHSHFW-ILCGBQQYSA-N	0	3	337.467	3.281	20	30		EGEDHN
CCN(Cc1ccc(C(=O)N2CCC(C)(C#N)CC2)cc1)C1CC1	ZINC000356971279	457250272	/nfs/dbraw/zinc/25/02/72/457250272.db2.gz	JLZBIVQGWGYMQD-UHFFFAOYSA-N	0	3	325.456	3.437	20	30		EGEDHN
CCS[C@@H]1CCCCN([C@@H](C)C(=O)N[C@](C)(C#N)C(C)C)C1	ZINC000331936466	457276024	/nfs/dbraw/zinc/27/60/24/457276024.db2.gz	WYNUZFFMSDBIFF-ZMSDIMECSA-N	0	3	325.522	3.037	20	30		EGEDHN
C[C@H](c1cccc(N2CCCS2(=O)=O)c1)N(C)CCC(C)(C)C#N	ZINC000347218852	457293380	/nfs/dbraw/zinc/29/33/80/457293380.db2.gz	BSTLSRXTYJCGJL-OAHLLOKOSA-N	0	3	349.500	3.159	20	30		EGEDHN
C=CCOCC(=O)N(c1cccc(SC)c1)C1CCN(C)CC1	ZINC000351802561	457318522	/nfs/dbraw/zinc/31/85/22/457318522.db2.gz	ZRQXYIPUMKSNLF-UHFFFAOYSA-N	0	3	334.485	3.038	20	30		EGEDHN
C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)N[C@@H]1CCCN(C)[C@@H]1C	ZINC000355079955	457340344	/nfs/dbraw/zinc/34/03/44/457340344.db2.gz	JXWWEWPUDDGQFC-SJLPKXTDSA-N	0	3	347.507	3.034	20	30		EGEDHN
C[C@@H](N[C@@H](C)c1ccc(F)c2ccccc21)C(=O)N(C)CCC#N	ZINC000352249012	457351575	/nfs/dbraw/zinc/35/15/75/457351575.db2.gz	FTGFHXJDKQQFIR-UONOGXRCSA-N	0	3	327.403	3.390	20	30		EGEDHN
CN1CCCC(C)(C)[C@H]1CNC(=O)C[C@H](CC#N)c1ccccc1	ZINC000357169517	457356805	/nfs/dbraw/zinc/35/68/05/457356805.db2.gz	LTDTVJVKKANXKK-ZWKOTPCHSA-N	0	3	327.472	3.311	20	30		EGEDHN
C[C@H]1C[C@@H](Nc2nccc(C#N)c2Cl)CCN1Cc1ccccc1	ZINC000342566805	457368851	/nfs/dbraw/zinc/36/88/51/457368851.db2.gz	LTVLNQWVJRTJNC-YOEHRIQHSA-N	0	3	340.858	3.494	20	30		EGEDHN
C=CCNC(=O)NC(=O)[C@@H](C)N[C@H](c1ccc(Cl)cc1)C(C)C	ZINC000357196759	457370078	/nfs/dbraw/zinc/37/00/78/457370078.db2.gz	DPUCNILSBUQHBG-DOMZBBRYSA-N	0	3	337.851	3.027	20	30		EGEDHN
Cc1cc(NC(=O)C2(C#N)CCC2)cc(N2CCN(C(C)C)CC2)c1	ZINC000360907518	457425089	/nfs/dbraw/zinc/42/50/89/457425089.db2.gz	YKLWBSJAGXDLAU-UHFFFAOYSA-N	0	3	340.471	3.158	20	30		EGEDHN
C=CC[C@H](CO)CNCc1ccc(-c2ccc(C(=O)OC)cc2)o1	ZINC000360907886	457425914	/nfs/dbraw/zinc/42/59/14/457425914.db2.gz	BWGSHRYBSMJGTB-AWEZNQCLSA-N	0	3	329.396	3.007	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1CCC[C@@]1(C)Cc1ccccc1	ZINC000342682779	457453442	/nfs/dbraw/zinc/45/34/42/457453442.db2.gz	ZUJPWERJCHJEQW-XLIONFOSSA-N	0	3	327.472	3.092	20	30		EGEDHN
CCNC(=O)C[C@@H]1CCCCN1Cc1cccc(OCCCC#N)c1	ZINC000342825011	457543340	/nfs/dbraw/zinc/54/33/40/457543340.db2.gz	QFCUKPNTTXFFKE-SFHVURJKSA-N	0	3	343.471	3.250	20	30		EGEDHN
C=CCCC1(C(=O)NCc2ccccc2CN2CCC(O)CC2)CC1	ZINC000356241138	457549534	/nfs/dbraw/zinc/54/95/34/457549534.db2.gz	COXGWLFIAUCBLX-UHFFFAOYSA-N	0	3	342.483	3.006	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)C(=O)NC[C@H]1N(C)CCCC1(C)C	ZINC000425510883	457581200	/nfs/dbraw/zinc/58/12/00/457581200.db2.gz	AAEMHXSTBVWZPP-CRAIPNDOSA-N	0	3	342.487	3.381	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N(C)C[C@@H](O)COCc1ccccc1F	ZINC000425540123	457591362	/nfs/dbraw/zinc/59/13/62/457591362.db2.gz	UVJQDZULIQMKKC-HNAYVOBHSA-N	0	3	342.414	3.268	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)N1c2ccccc2CC[C@H]1CN(C)C)OCC	ZINC000425599776	457608483	/nfs/dbraw/zinc/60/84/83/457608483.db2.gz	AEHJBAPPOMQOSB-PKOBYXMFSA-N	0	3	330.472	3.267	20	30		EGEDHN
Cn1cc([C@@H](NCCCOc2cccc(C#N)c2)c2ccccc2)cn1	ZINC000374633265	457676821	/nfs/dbraw/zinc/67/68/21/457676821.db2.gz	XMERXNWEAZZVPA-NRFANRHFSA-N	0	3	346.434	3.440	20	30		EGEDHN
CC(C#N)C(=O)N1CCC[C@H]1C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000357798317	457693908	/nfs/dbraw/zinc/69/39/08/457693908.db2.gz	LEXUJMPSUNSHRJ-ZANVPECISA-N	0	3	340.210	3.083	20	30		EGEDHN
CO[C@]1(C)CCCN([C@H](C)C(=O)N(C)C2(C#N)CCC(C)CC2)CC1	ZINC000361414419	457724733	/nfs/dbraw/zinc/72/47/33/457724733.db2.gz	VNTJBCGMYONGIB-VXLIZBOYSA-N	0	3	349.519	3.197	20	30		EGEDHN
CN(C)c1ccccc1CN(C)C(=O)C(C#N)CCc1ccccc1	ZINC000425973398	457750047	/nfs/dbraw/zinc/75/00/47/457750047.db2.gz	IMTLAHFQSAYXBV-SFHVURJKSA-N	0	3	335.451	3.484	20	30		EGEDHN
COc1ccc(C)cc1CCNC(=O)C(C#N)CCc1ccccc1	ZINC000433167671	457768731	/nfs/dbraw/zinc/76/87/31/457768731.db2.gz	OHUGLARAEFOAIM-LJQANCHMSA-N	0	3	336.435	3.435	20	30		EGEDHN
Cc1ccccc1CN1CCC(NC(=O)N(C)CC(C)(C)C#N)CC1	ZINC000457636104	457774981	/nfs/dbraw/zinc/77/49/81/457774981.db2.gz	JVKDDGJOTSDAAJ-UHFFFAOYSA-N	0	3	342.487	3.151	20	30		EGEDHN
C[C@@H](CN1CCC[C@H](C)C1)NC(=O)Nc1ccc(C#N)cc1Cl	ZINC000426134026	457776899	/nfs/dbraw/zinc/77/68/99/457776899.db2.gz	QDQNMYDIJFDQHH-STQMWFEESA-N	0	3	334.851	3.454	20	30		EGEDHN
COc1ccc(OC)c(CNC(=O)C(C#N)CCc2ccccc2)c1	ZINC000433222065	457782439	/nfs/dbraw/zinc/78/24/39/457782439.db2.gz	WXSDRJRMIKSGGK-MRXNPFEDSA-N	0	3	338.407	3.093	20	30		EGEDHN
CN(CCOc1ccc(F)cc1)C(=O)C(C#N)CCc1ccccc1	ZINC000433226264	457783965	/nfs/dbraw/zinc/78/39/65/457783965.db2.gz	FZMNUDGNEBCKLN-QGZVFWFLSA-N	0	3	340.398	3.435	20	30		EGEDHN
CC1(C)CN(C(=O)C(C#N)CCc2ccccc2)[C@@H]1[C@@H]1CCCO1	ZINC000426238642	457792630	/nfs/dbraw/zinc/79/26/30/457792630.db2.gz	LNPUHXIYSQHRRY-OKZBNKHCSA-N	0	3	326.440	3.175	20	30		EGEDHN
CCCN(CCC)[C@@H](C)C(=O)N(CCC#N)c1ccccc1OC	ZINC000411164633	457818387	/nfs/dbraw/zinc/81/83/87/457818387.db2.gz	ILIAIYGJFCAFMO-INIZCTEOSA-N	0	3	331.460	3.452	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC2(C[C@H]2NCc2ccc(C#N)cc2)CC1	ZINC000366474744	457820195	/nfs/dbraw/zinc/82/01/95/457820195.db2.gz	OSJGIGKAHFWXHB-QGZVFWFLSA-N	0	3	341.455	3.437	20	30		EGEDHN
CCc1ccc([C@H](COC)NC(=O)C(C#N)CCc2ccccc2)o1	ZINC000433369923	457823087	/nfs/dbraw/zinc/82/30/87/457823087.db2.gz	AXOUVTXPJDJLGX-WMZOPIPTSA-N	0	3	340.423	3.418	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cc(C)nn2CCCCC)CC1	ZINC000361692523	457824823	/nfs/dbraw/zinc/82/48/23/457824823.db2.gz	LMECCJOHDWAMTA-UHFFFAOYSA-N	0	3	333.480	3.154	20	30		EGEDHN
C=CCN(Cc1cccc(C#N)c1)C(=O)[C@@H](C)N1[C@H](C)CC[C@@H]1C	ZINC000411713002	457959218	/nfs/dbraw/zinc/95/92/18/457959218.db2.gz	VNAPTGZHXRDQNZ-IXDOHACOSA-N	0	3	325.456	3.334	20	30		EGEDHN
CC#CCN(C)CCC(=O)N[C@H](c1cccs1)c1ccccc1	ZINC000411775264	457976329	/nfs/dbraw/zinc/97/63/29/457976329.db2.gz	XMFVSOHTPHNVAZ-IBGZPJMESA-N	0	3	326.465	3.299	20	30		EGEDHN
CC1(C)CCCN(CCNC(=O)Nc2ccc(C#N)cc2Cl)C1	ZINC000444905859	457994055	/nfs/dbraw/zinc/99/40/55/457994055.db2.gz	VIXLGRWHDLMDQT-UHFFFAOYSA-N	0	3	334.851	3.455	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000368101496	458009218	/nfs/dbraw/zinc/00/92/18/458009218.db2.gz	KTIJCLVUWBANCV-FQEVSTJZSA-N	0	3	346.474	3.239	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CC(CC)(c3ccccc3)C2)CC1	ZINC000458333423	458016082	/nfs/dbraw/zinc/01/60/82/458016082.db2.gz	KVHPZLXRPXMJIF-UHFFFAOYSA-N	0	3	327.472	3.010	20	30		EGEDHN
C=CC[C@H]1N(C(=O)NC[C@@]2(N(C)C)CCSC2)CCCC1(C)C	ZINC000445122492	458018206	/nfs/dbraw/zinc/01/82/06/458018206.db2.gz	YHUAHEMNAQBQJW-QAPCUYQASA-N	0	3	339.549	3.200	20	30		EGEDHN
C=CCOc1cccc(NC(=O)NCCN2CCCC(C)(C)C2)c1	ZINC000445241807	458030417	/nfs/dbraw/zinc/03/04/17/458030417.db2.gz	ISXURFYUWINQOY-UHFFFAOYSA-N	0	3	331.460	3.495	20	30		EGEDHN
N#CC(C(=O)c1cccc(NC(N)=O)c1)c1cc(C(F)(F)F)ccn1	ZINC000362193433	458042823	/nfs/dbraw/zinc/04/28/23/458042823.db2.gz	VQBXOSOADIJAKY-GFCCVEGCSA-N	0	3	348.284	3.081	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Cc1ccc(F)c(F)c1)C(C)C	ZINC000446115120	458150670	/nfs/dbraw/zinc/15/06/70/458150670.db2.gz	ZEAHSDVHRIXOEN-GOSISDBHSA-N	0	3	336.426	3.322	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCN(CCSC3CCCCC3)C2)nc1	ZINC000428789899	458212470	/nfs/dbraw/zinc/21/24/70/458212470.db2.gz	PSPVYYDDSPGTNY-INIZCTEOSA-N	0	3	331.485	3.472	20	30		EGEDHN
COCC[C@H](c1ccccc1)N1CC[C@H](Oc2ccc(C#N)cn2)C1	ZINC000428800209	458214367	/nfs/dbraw/zinc/21/43/67/458214367.db2.gz	FTQSACKALAOCAB-RBUKOAKNSA-N	0	3	337.423	3.184	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1CNc1ccnc2cc(OC)c(OC)cc21	ZINC000413261725	458296190	/nfs/dbraw/zinc/29/61/90/458296190.db2.gz	FDZOLUWTFIPANZ-ORAYPTAESA-N	0	3	328.412	3.067	20	30		EGEDHN
CC(C)(C#N)c1ccc(NC(=O)NC[C@H]2NCCc3ccccc32)cc1	ZINC000414838015	458325162	/nfs/dbraw/zinc/32/51/62/458325162.db2.gz	XZIONIQZEORHJW-LJQANCHMSA-N	0	3	348.450	3.496	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)Nc1cc(N)ccc1F)C(C)C	ZINC000415900980	458335501	/nfs/dbraw/zinc/33/55/01/458335501.db2.gz	JTEWIZXNIFMEFV-QGZVFWFLSA-N	0	3	334.439	3.228	20	30		EGEDHN
C[C@@H]1C[C@H](c2cccnc2)N(CCC(=O)Nc2sccc2C#N)C1	ZINC000376552631	458336005	/nfs/dbraw/zinc/33/60/05/458336005.db2.gz	KYAQCBSVRMQVEY-CZUORRHYSA-N	0	3	340.452	3.426	20	30		EGEDHN
N#CCCn1cc(CN[C@@H]2CCCC[C@H]2F)c(-c2ccncc2)n1	ZINC000419812889	458392636	/nfs/dbraw/zinc/39/26/36/458392636.db2.gz	GXUXXTXQORDGIB-IAGOWNOFSA-N	0	3	327.407	3.229	20	30		EGEDHN
C=CCC[C@H]1NC(=O)N(C[C@H](c2ccc(C)cc2)N2CCCC2)C1=O	ZINC000419957170	458395425	/nfs/dbraw/zinc/39/54/25/458395425.db2.gz	VABOPVLXDZUDBV-QZTJIDSGSA-N	0	3	341.455	3.019	20	30		EGEDHN
COc1cc(F)cc(CN(CCN(C)C)Cc2ccc(C#N)cc2)c1	ZINC000449319140	458423109	/nfs/dbraw/zinc/42/31/09/458423109.db2.gz	IUMMURMXPPKJIZ-UHFFFAOYSA-N	0	3	341.430	3.270	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1NCc1ccc(OCC(F)(F)F)c(OC)c1	ZINC000449518057	458426787	/nfs/dbraw/zinc/42/67/87/458426787.db2.gz	IGUAQDWIHLHPRS-OLZOCXBDSA-N	0	3	331.334	3.069	20	30		EGEDHN
C=CCC[C@@H](CO)NCc1cnn(-c2ccc(C(F)(F)F)cc2)c1	ZINC000449701376	458429979	/nfs/dbraw/zinc/42/99/79/458429979.db2.gz	WCHVJVLRZDLUDD-HNNXBMFYSA-N	0	3	339.361	3.308	20	30		EGEDHN
C=CCC[C@@H](CO)N[C@H](C)c1ccc(OC)cc1Br	ZINC000449696339	458430142	/nfs/dbraw/zinc/43/01/42/458430142.db2.gz	HUVYVUQHGRXNJW-NEPJUHHUSA-N	0	3	328.250	3.435	20	30		EGEDHN
C[C@H]1C[C@@]1(C#N)C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000449951978	458436413	/nfs/dbraw/zinc/43/64/13/458436413.db2.gz	JBAIYTNOOFUATG-QXOCSCLMSA-N	0	3	325.456	3.048	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN(C)[C@@H]1CCC[C@@H]1c1ccccc1	ZINC000459670961	458442500	/nfs/dbraw/zinc/44/25/00/458442500.db2.gz	GHFJTVBIYCYWBN-BHIYHBOVSA-N	0	3	327.472	3.263	20	30		EGEDHN
C[C@H](CNc1cccc(C#N)c1[N+](=O)[O-])N1CCc2ccccc2C1	ZINC000450247336	458443169	/nfs/dbraw/zinc/44/31/69/458443169.db2.gz	NBLNKJJXEBQSFU-CQSZACIVSA-N	0	3	336.395	3.325	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCN(CCc3ccc(Cl)cc3)C2)nc1	ZINC000451060557	458464160	/nfs/dbraw/zinc/46/41/60/458464160.db2.gz	XDUOHJUQYOJUMV-QGZVFWFLSA-N	0	3	327.815	3.302	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(Br)cc2C#N)CCN(C2CC2)C1	ZINC000451096619	458464873	/nfs/dbraw/zinc/46/48/73/458464873.db2.gz	XLAFPWKQPQJTMD-CYBMUJFWSA-N	0	3	348.288	3.237	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCC(=O)N(CCC)Cc1ccc(C)cc1	ZINC000451681671	458485607	/nfs/dbraw/zinc/48/56/07/458485607.db2.gz	PDURMJBVTHZELZ-MOPGFXCFSA-N	0	3	330.472	3.057	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCOC[C@H]1[C@H]1CCCN1C(=O)OC(C)(C)C	ZINC000373422615	458488210	/nfs/dbraw/zinc/48/82/10/458488210.db2.gz	OOUCXCBTALJHRH-RBSFLKMASA-N	0	3	344.883	3.133	20	30		EGEDHN
C=CCN1CC[C@H](N2CCC(Cc3cc(F)cc(F)c3)CC2)C1=O	ZINC000451929560	458490387	/nfs/dbraw/zinc/49/03/87/458490387.db2.gz	SVASECQEXPGSNA-SFHVURJKSA-N	0	3	334.410	3.006	20	30		EGEDHN
COc1ccc(C#N)cc1CNC1(Cc2ccccc2)CCOCC1	ZINC000451943291	458491274	/nfs/dbraw/zinc/49/12/74/458491274.db2.gz	VYIDBUGDYOJGEK-UHFFFAOYSA-N	0	3	336.435	3.448	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NC[C@@H]2CSc3ccccc32)cc1	ZINC000452214727	458496832	/nfs/dbraw/zinc/49/68/32/458496832.db2.gz	OGIHSXCGEBCCJT-IAGOWNOFSA-N	0	3	347.443	3.246	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C2(c3cccnc3)CCCC2)CC1	ZINC000377319933	458496914	/nfs/dbraw/zinc/49/69/14/458496914.db2.gz	GEHGKHLMNOJFNL-UHFFFAOYSA-N	0	3	327.472	3.050	20	30		EGEDHN
CO[C@H](CNC(=O)C(C#N)CCc1ccccc1)Cc1ccccc1	ZINC000452816777	458511608	/nfs/dbraw/zinc/51/16/08/458511608.db2.gz	MXBUINGNPPUZJA-UXHICEINSA-N	0	3	336.435	3.133	20	30		EGEDHN
CN1C[C@H](NC(=O)C[C@H](CC#N)c2ccccc2)[C@H](c2ccccc2)C1	ZINC000373534842	458522778	/nfs/dbraw/zinc/52/27/78/458522778.db2.gz	KNAQOOVNPDLGMH-ACRUOGEOSA-N	0	3	347.462	3.288	20	30		EGEDHN
COc1cc2c(cc1OC)[C@@H](NCc1ccc(C#N)c(F)c1)CC2	ZINC000453370188	458526404	/nfs/dbraw/zinc/52/64/04/458526404.db2.gz	FRPNNTZKOXVWFA-KRWDZBQOSA-N	0	3	326.371	3.492	20	30		EGEDHN
C=CCn1c([C@H](C)CC)nnc1N1CCN([C@@H]2C[C@H]2C)C[C@H](C)C1	ZINC000453423105	458527712	/nfs/dbraw/zinc/52/77/12/458527712.db2.gz	BKKWNQJBXDBLBJ-YLFCFFPRSA-N	0	3	331.508	3.144	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CCCCO2)nnc1N1CCCN(C(C)C)CC1	ZINC000453467481	458534350	/nfs/dbraw/zinc/53/43/50/458534350.db2.gz	QUQUCFRVYWONRE-QGZVFWFLSA-N	0	3	347.507	3.016	20	30		EGEDHN
C=C(C)Cn1c([C@@H]2CCCCO2)nnc1N1CCCN(C(C)C)CC1	ZINC000453467480	458534498	/nfs/dbraw/zinc/53/44/98/458534498.db2.gz	QUQUCFRVYWONRE-KRWDZBQOSA-N	0	3	347.507	3.016	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)Nc1nc(-c2ccccc2Cl)cs1	ZINC000424082156	458554444	/nfs/dbraw/zinc/55/44/44/458554444.db2.gz	VZFGRYNNBUWBED-GFCCVEGCSA-N	0	3	334.832	3.423	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)N1Cc2ccccc2[C@@H](c2ccccc2)C1	ZINC000424085346	458554519	/nfs/dbraw/zinc/55/45/19/458554519.db2.gz	PLDXHDBHOGXQHA-UXHICEINSA-N	0	3	333.435	3.182	20	30		EGEDHN
Cc1nc(-c2ccc([C@@H](C)NC(=O)[C@@H](N)CCCC#N)cc2)cs1	ZINC000424088071	458555879	/nfs/dbraw/zinc/55/58/79/458555879.db2.gz	IVQQRWYCTOUKDA-WBMJQRKESA-N	0	3	342.468	3.317	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N[C@@H](c1ccccc1)c1ccc(F)cc1	ZINC000424104528	458558774	/nfs/dbraw/zinc/55/87/74/458558774.db2.gz	UPNRNJNPYNQBBR-MSOLQXFVSA-N	0	3	325.387	3.052	20	30		EGEDHN
C=C(CC)CNC(=O)NCC1CCN(Cc2ccc(OC)cc2)CC1	ZINC000454402333	458560910	/nfs/dbraw/zinc/56/09/10/458560910.db2.gz	FQEZOIAOQNYSFW-UHFFFAOYSA-N	0	3	345.487	3.173	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1nc2ccccc2n1C1CCCC1	ZINC000424122087	458563100	/nfs/dbraw/zinc/56/31/00/458563100.db2.gz	IXFMKVLRMPPEDM-AWEZNQCLSA-N	0	3	325.416	3.111	20	30		EGEDHN
Cc1ccc(Oc2ccc(NC(=O)[C@@H](N)CCCC#N)cn2)cc1C	ZINC000424135736	458567540	/nfs/dbraw/zinc/56/75/40/458567540.db2.gz	PLEZDFUMNSGHMJ-KRWDZBQOSA-N	0	3	338.411	3.450	20	30		EGEDHN
C=CCn1cc(CNC[C@H](C)c2cccc(Br)c2)nn1	ZINC000424173313	458577483	/nfs/dbraw/zinc/57/74/83/458577483.db2.gz	PGZNJGMTOBCHTH-LBPRGKRZSA-N	0	3	335.249	3.120	20	30		EGEDHN
CCc1c(NC(=O)[C@@H](N)CCCC#N)cnn1-c1ccccc1Cl	ZINC000424194910	458581184	/nfs/dbraw/zinc/58/11/84/458581184.db2.gz	YAVWFXSELYCDQU-ZDUSSCGKSA-N	0	3	345.834	3.048	20	30		EGEDHN
COCc1ccc(CNC2CCC(Oc3ncccc3C#N)CC2)o1	ZINC000438498108	458587326	/nfs/dbraw/zinc/58/73/26/458587326.db2.gz	XMJCDZABDUHENT-UHFFFAOYSA-N	0	3	341.411	3.172	20	30		EGEDHN
C=C(C)CCNC(=O)N1CC[C@@]2(CCN(Cc3ccccc3)C2)C1	ZINC000455310021	458592995	/nfs/dbraw/zinc/59/29/95/458592995.db2.gz	COYHGBZBDPDUEQ-HXUWFJFHSA-N	0	3	327.472	3.260	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cnn(CCC)c2C2CC2)CC1	ZINC000455824007	458617145	/nfs/dbraw/zinc/61/71/45/458617145.db2.gz	GOUPQXPGEOPMEZ-UHFFFAOYSA-N	0	3	345.491	3.333	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)NC[C@@H]1CCCCN1C1CC1	ZINC000470165737	458619883	/nfs/dbraw/zinc/61/98/83/458619883.db2.gz	BBMCUXIMVCRSNB-INIZCTEOSA-N	0	3	344.455	3.007	20	30		EGEDHN
C[C@H](C(=O)N[C@@H](CN(C)C)c1ccc(F)cc1)c1cccc(C#N)c1	ZINC000462465977	458622951	/nfs/dbraw/zinc/62/29/51/458622951.db2.gz	MYDSQTIVJOBHPV-LIRRHRJNSA-N	0	3	339.414	3.220	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCCc2ccc(Cl)cc2)cc1	ZINC000470720473	458645555	/nfs/dbraw/zinc/64/55/55/458645555.db2.gz	VHYBVOLZYMTZNQ-KRWDZBQOSA-N	0	3	337.810	3.253	20	30		EGEDHN
Cc1c(C#N)cccc1NC(=O)NCC1(N(C)C)Cc2ccccc2C1	ZINC000431944035	458650902	/nfs/dbraw/zinc/65/09/02/458650902.db2.gz	ANOSODYLFLQBAC-UHFFFAOYSA-N	0	3	348.450	3.087	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@H](Cc2ccccc2)C2CC2)cc1	ZINC000470974063	458671661	/nfs/dbraw/zinc/67/16/61/458671661.db2.gz	GVQLCSUWSUPVRL-LEWJYISDSA-N	0	3	343.430	3.378	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@@H](Cc2ccccc2)C2CC2)cc1	ZINC000470974065	458672511	/nfs/dbraw/zinc/67/25/11/458672511.db2.gz	GVQLCSUWSUPVRL-RTWAWAEBSA-N	0	3	343.430	3.378	20	30		EGEDHN
N#Cc1ccc(OC[C@H](O)CN2CCC[C@H]2/C=C/c2ccccc2)cc1	ZINC000505899771	458749445	/nfs/dbraw/zinc/74/94/45/458749445.db2.gz	AJULLHVYMLBXQT-FFLQPZBESA-N	0	3	348.446	3.476	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@@H](C)N1CC[C@@H](COc2ccccc2)C1	ZINC000505862812	458749525	/nfs/dbraw/zinc/74/95/25/458749525.db2.gz	ONYNWISVUZMAGN-QZTJIDSGSA-N	0	3	330.472	3.200	20	30		EGEDHN
Cc1cc([C@@H](N[C@@H](C)C(=O)NC2(C#N)CCC2)C2CC2)ccc1F	ZINC000530337018	458750674	/nfs/dbraw/zinc/75/06/74/458750674.db2.gz	ZYJJSCRWZVFAPC-GUYCJALGSA-N	0	3	329.419	3.126	20	30		EGEDHN
C[C@H](N[C@@H](C)c1ccc(-c2ccncc2)cc1)C(=O)NC1(C#N)CCC1	ZINC000530337199	458750902	/nfs/dbraw/zinc/75/09/02/458750902.db2.gz	UNWFDOGZSKIQCY-HOTGVXAUSA-N	0	3	348.450	3.350	20	30		EGEDHN
C=CCn1c(CC2CC2)nnc1N1CCN(CC2CCCCC2)CC1	ZINC000508882685	458765941	/nfs/dbraw/zinc/76/59/41/458765941.db2.gz	ZIKQEIRNLGFEFG-UHFFFAOYSA-N	0	3	343.519	3.119	20	30		EGEDHN
N#Cc1ccnc(N2CCN(CCc3ccc4ccccc4c3)CC2)c1	ZINC000511703241	458779992	/nfs/dbraw/zinc/77/99/92/458779992.db2.gz	OPXCBITVWORLIK-UHFFFAOYSA-N	0	3	342.446	3.471	20	30		EGEDHN
C[C@H]1[C@@H](Cc2ccccc2)CCN1CC(=O)NCc1ccc(C#N)cc1	ZINC000472349976	458789349	/nfs/dbraw/zinc/78/93/49/458789349.db2.gz	PHLCBJDNRIXULU-LAUBAEHRSA-N	0	3	347.462	3.128	20	30		EGEDHN
CC(C)(CNC(=O)C(C#N)CCc1ccccc1)C1(O)CCCC1	ZINC000456837482	458795123	/nfs/dbraw/zinc/79/51/23/458795123.db2.gz	AEZOJTUKEQMIBM-QGZVFWFLSA-N	0	3	328.456	3.206	20	30		EGEDHN
N#Cc1cc(F)c(NC2CCN(C3CC3)CC2)cc1Br	ZINC000516193832	458815083	/nfs/dbraw/zinc/81/50/83/458815083.db2.gz	REEWGANKDAJFTR-UHFFFAOYSA-N	0	3	338.224	3.499	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1SC[C@@H](F)CC	ZINC000440573446	458827606	/nfs/dbraw/zinc/82/76/06/458827606.db2.gz	GVMHJQAZGQMIBJ-AWEZNQCLSA-N	0	3	326.485	3.333	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CCS[C@@H](CC)C1)C(C)C	ZINC000465539314	458832258	/nfs/dbraw/zinc/83/22/58/458832258.db2.gz	CSLNLQQPSHKEMI-DLBZAZTESA-N	0	3	339.549	3.222	20	30		EGEDHN
COc1cc(CNC[C@@]2(O)CCC[C@@H](C(F)(F)F)C2)ccc1C#N	ZINC000440638715	458836568	/nfs/dbraw/zinc/83/65/68/458836568.db2.gz	OQVSIFNTAGEJLY-GDBMZVCRSA-N	0	3	342.361	3.140	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@@H]2CCc3ccc(F)cc32)cc1	ZINC000548753824	458873379	/nfs/dbraw/zinc/87/33/79/458873379.db2.gz	TWTRTYBXFRQNLJ-VQIMIIECSA-N	0	3	333.366	3.183	20	30		EGEDHN
C=CCNC(=O)CN1CCc2ccccc2[C@H](c2ccccc2)[C@H]1C	ZINC000441088858	458886126	/nfs/dbraw/zinc/88/61/26/458886126.db2.gz	ADSYFWWCCPYLBX-VGSWGCGISA-N	0	3	334.463	3.367	20	30		EGEDHN
Cc1ccc(CN2CC[C@@H](CN(C)C(=O)C3(C#N)CCC3)C2)s1	ZINC000552134325	458890801	/nfs/dbraw/zinc/89/08/01/458890801.db2.gz	ITSQTWBJLZFYQB-HNNXBMFYSA-N	0	3	331.485	3.031	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cnc(C(C)(C)C)nc1)C(C)C	ZINC000554324243	458898105	/nfs/dbraw/zinc/89/81/05/458898105.db2.gz	OXRZKIKNGTUWNZ-QGZVFWFLSA-N	0	3	344.503	3.203	20	30		EGEDHN
C[C@@](O)(C1CCN(CCCC2(C#N)CCOCC2)CC1)C(F)(F)F	ZINC000531444860	458918833	/nfs/dbraw/zinc/91/88/33/458918833.db2.gz	FNYYTYCDCDWRGH-OAHLLOKOSA-N	0	3	348.409	3.112	20	30		EGEDHN
CC(C)CN(Cc1ccc(C#N)cc1)C(=O)NC[C@@H]1CCCN(C)C1	ZINC000531483878	458924561	/nfs/dbraw/zinc/92/45/61/458924561.db2.gz	CZSADULWIQESSK-IBGZPJMESA-N	0	3	342.487	3.068	20	30		EGEDHN
CC(C#N)C(=O)N(CCCNC(=O)OC(C)(C)C)CC1CCCC1	ZINC000495706578	458925333	/nfs/dbraw/zinc/92/53/33/458925333.db2.gz	NGOCZGFFBUTSQF-AWEZNQCLSA-N	0	3	337.464	3.080	20	30		EGEDHN
CC[C@@H](Cc1ccc(C)cc1)N(CC)CC(=O)N[C@](C)(C#N)C1CC1	ZINC000441358825	458926671	/nfs/dbraw/zinc/92/66/71/458926671.db2.gz	OQTJONCVWJJMJS-PZJWPPBQSA-N	0	3	341.499	3.447	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1c2ccccc2nn1C)C(C)C	ZINC000475296463	458932891	/nfs/dbraw/zinc/93/28/91/458932891.db2.gz	LSSQFJUBDZYXFT-GOSISDBHSA-N	0	3	340.471	3.002	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N1CCC[C@@H](c2nc3ccccc3s2)C1	ZINC000519391526	458942865	/nfs/dbraw/zinc/94/28/65/458942865.db2.gz	DXKSCSHMIRXQAW-ZIAGYGMSSA-N	0	3	342.468	3.023	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)[C@H]1OCCc2ccccc21)C(C)C	ZINC000441492529	458954777	/nfs/dbraw/zinc/95/47/77/458954777.db2.gz	VQIUJWGSPBMUSL-UXHICEINSA-N	0	3	342.483	3.115	20	30		EGEDHN
C=CCCN(C)CCc1nc2sc3c(c2c(N)n1)CC[C@H](C)C3	ZINC000467293734	458965992	/nfs/dbraw/zinc/96/59/92/458965992.db2.gz	OKSGWXQZPSZDKF-LBPRGKRZSA-N	0	3	330.501	3.449	20	30		EGEDHN
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NCc1ccc(C#N)c(F)c1	ZINC000556514731	458968502	/nfs/dbraw/zinc/96/85/02/458968502.db2.gz	HZZCXUVTUMEIRM-KDOFPFPSSA-N	0	3	340.398	3.207	20	30		EGEDHN
CCN1CCN(Cc2ccc(CNc3cc(C)nc(C#N)c3)cc2)CC1	ZINC000519731703	458995264	/nfs/dbraw/zinc/99/52/64/458995264.db2.gz	XXHACWMLBPDIAZ-UHFFFAOYSA-N	0	3	349.482	3.011	20	30		EGEDHN
CCCN(CC(=O)N[C@](C)(C#N)C(C)C)[C@@H]1CCc2ccccc21	ZINC000519906551	459020710	/nfs/dbraw/zinc/02/07/10/459020710.db2.gz	JMBPAUWXIPZGLJ-UYAOXDASSA-N	0	3	327.472	3.440	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cc(C)cc([N+](=O)[O-])c1)C(C)C	ZINC000495980788	459026554	/nfs/dbraw/zinc/02/65/54/459026554.db2.gz	GQGKYNOBCVRYPD-GOSISDBHSA-N	0	3	345.443	3.332	20	30		EGEDHN
CN(C)Cc1c2ccccc2oc1C(=O)Nc1cc(CC#N)ccn1	ZINC000532181803	459044210	/nfs/dbraw/zinc/04/42/10/459044210.db2.gz	HBCQMAHQJZWXCK-UHFFFAOYSA-N	0	3	334.379	3.208	20	30		EGEDHN
COC(=O)N1CCC(CN[C@@H](CCC#N)c2ccc(OC)cc2)CC1	ZINC000496039355	459045856	/nfs/dbraw/zinc/04/58/56/459045856.db2.gz	CNPXEGQIZJVYHE-SFHVURJKSA-N	0	3	345.443	3.108	20	30		EGEDHN
N#C[C@@H]1CC[C@@H](N[C@H](Cc2ccccc2)C(=O)NCc2ccccc2)C1	ZINC000442865236	459047528	/nfs/dbraw/zinc/04/75/28/459047528.db2.gz	SVIFTWMZLXUSGQ-NJDAHSKKSA-N	0	3	347.462	3.196	20	30		EGEDHN
N#C[C@@H]1CC[C@H](N[C@@H](Cc2ccccc2)C(=O)NCc2ccccc2)C1	ZINC000442865235	459047726	/nfs/dbraw/zinc/04/77/26/459047726.db2.gz	SVIFTWMZLXUSGQ-HKBOAZHASA-N	0	3	347.462	3.196	20	30		EGEDHN
C=CCc1cc(CNC[C@H](C)C(=O)OC(C)(C)C)cc(OC)c1O	ZINC000594516348	459073855	/nfs/dbraw/zinc/07/38/55/459073855.db2.gz	VWHKKHKMWQRTOZ-ZDUSSCGKSA-N	0	3	335.444	3.197	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@@H]2NC[C@H](O)COCc1ccccc1	ZINC000520797968	459095384	/nfs/dbraw/zinc/09/53/84/459095384.db2.gz	MILNNMHDYINJTC-FPOVZHCZSA-N	0	3	336.435	3.103	20	30		EGEDHN
C=CCCCCCN(C)CC(=O)NC(=O)Nc1ccc(OC)cc1	ZINC000558461758	459163241	/nfs/dbraw/zinc/16/32/41/459163241.db2.gz	MEZWEHHJIOMZFQ-UHFFFAOYSA-N	0	3	333.432	3.022	20	30		EGEDHN
N#Cc1ccccc1CSCCNCc1ccnn1CC1CC1	ZINC000594925387	459178213	/nfs/dbraw/zinc/17/82/13/459178213.db2.gz	XFFVMDNOQXMACS-UHFFFAOYSA-N	0	3	326.469	3.188	20	30		EGEDHN
C[C@@H](N[C@H](c1ccc(F)c(Cl)c1)C1CC1)C(=O)NC1(C#N)CCC1	ZINC000590751377	459204267	/nfs/dbraw/zinc/20/42/67/459204267.db2.gz	VCRDCXXJWUIFMV-BZNIZROVSA-N	0	3	349.837	3.471	20	30		EGEDHN
C[C@H]1[C@@H](NC(=O)OC(C)(C)C)CCN1Cc1ccc(CC#N)cc1	ZINC000496552636	459237427	/nfs/dbraw/zinc/23/74/27/459237427.db2.gz	QQDWEJXPJIFEAP-YOEHRIQHSA-N	0	3	329.444	3.240	20	30		EGEDHN
CC(C)C[C@@]1(CO)CCCN1C(=O)C(C#N)CCc1ccccc1	ZINC000559297417	459249080	/nfs/dbraw/zinc/24/90/80/459249080.db2.gz	GYRNESOLIVQEHM-AZUAARDMSA-N	0	3	328.456	3.159	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN1CCC[C@H](Cc2ccc(OC)cc2)C1	ZINC000580140514	459256425	/nfs/dbraw/zinc/25/64/25/459256425.db2.gz	VEVCGJJRSGITSY-LJQANCHMSA-N	0	3	344.499	3.374	20	30		EGEDHN
CCCCN(C)C(=O)C1CCN(CCc2ccc(C#N)cc2)CC1	ZINC000595292908	459269697	/nfs/dbraw/zinc/26/96/97/459269697.db2.gz	FGPWTWKLTBIABW-UHFFFAOYSA-N	0	3	327.472	3.071	20	30		EGEDHN
C[C@H]1C[C@H](NC2CCN(Cc3ccc(C#N)cc3)CC2)c2nccn21	ZINC000568355104	459272821	/nfs/dbraw/zinc/27/28/21/459272821.db2.gz	ORWWRXSSCJRHEQ-KXBFYZLASA-N	0	3	335.455	3.015	20	30		EGEDHN
C=CCCCCN1CC[C@H](OC)C[C@@H]1CNC(=O)OC(C)(C)C	ZINC000496676019	459282531	/nfs/dbraw/zinc/28/25/31/459282531.db2.gz	BAYZXTHDRSTWBQ-CVEARBPZSA-N	0	3	326.481	3.347	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)Cc1ccc2c(n1)CCC2	ZINC000590965076	459285368	/nfs/dbraw/zinc/28/53/68/459285368.db2.gz	VESBIBGZJXFXEQ-UHFFFAOYSA-N	0	3	334.467	3.006	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1ccnn1C1CCCC1)C(C)C	ZINC000482159875	459294413	/nfs/dbraw/zinc/29/44/13/459294413.db2.gz	XUCNWYQOSPRXSY-LJQANCHMSA-N	0	3	344.503	3.427	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc(OCCCC)nc2)CC1	ZINC000482551971	459313618	/nfs/dbraw/zinc/31/36/18/459313618.db2.gz	DCCDFENDZCLITG-UHFFFAOYSA-N	0	3	346.475	3.423	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1ccc(N(C)C)c(F)c1)C(C)C	ZINC000523655293	459319810	/nfs/dbraw/zinc/31/98/10/459319810.db2.gz	BJCVREZPCSTSOT-IBGZPJMESA-N	0	3	347.478	3.320	20	30		EGEDHN
CC(C)(C)[C@H]1CCCN([C@@H]2CCN(c3ccc(C#N)cc3)C2=O)C1	ZINC000483243789	459352505	/nfs/dbraw/zinc/35/25/05/459352505.db2.gz	YKYIXOAEANSJTD-FUHWJXTLSA-N	0	3	325.456	3.422	20	30		EGEDHN
C[C@@H]1[C@H](Cc2ccccc2)CCN1Cc1cnc2c(C#N)cnn2c1	ZINC000582360837	459353636	/nfs/dbraw/zinc/35/36/36/459353636.db2.gz	UESYWFOCKXYBIX-QAPCUYQASA-N	0	3	331.423	3.054	20	30		EGEDHN
C=CCCSCCNC(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000595597571	459359793	/nfs/dbraw/zinc/35/97/93/459359793.db2.gz	SAQLZTAUKAGKCU-SFHVURJKSA-N	0	3	347.528	3.117	20	30		EGEDHN
C=CC[C@H](CO)CN[C@@H](C)c1ccc(OC)cc1Br	ZINC000538406350	459371093	/nfs/dbraw/zinc/37/10/93/459371093.db2.gz	AWOFLPQSMWJGCI-RYUDHWBXSA-N	0	3	328.250	3.293	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(C)n(C3CCCCC3)n2)CC1	ZINC000538491130	459372285	/nfs/dbraw/zinc/37/22/85/459372285.db2.gz	LUOIAIZXSQYXML-UHFFFAOYSA-N	0	3	330.476	3.077	20	30		EGEDHN
N#CC[C@H]1CCCN(C[C@@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000595619539	459372383	/nfs/dbraw/zinc/37/23/83/459372383.db2.gz	CQSOXTULDLFKHD-ZIAGYGMSSA-N	0	3	342.361	3.071	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H]2CN(Cc3ccc(C#N)s3)C[C@H]2C1	ZINC000496941294	459379110	/nfs/dbraw/zinc/37/91/10/459379110.db2.gz	UVPFQJZKXPOQFX-KBPBESRZSA-N	0	3	347.484	3.309	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@@H]2CN(Cc3ccc(C#N)s3)C[C@H]2C1	ZINC000496941295	459379452	/nfs/dbraw/zinc/37/94/52/459379452.db2.gz	UVPFQJZKXPOQFX-KGLIPLIRSA-N	0	3	347.484	3.309	20	30		EGEDHN
C=CCN(C(=O)NCC1(N2CCSCC2)CCCCC1)C1CC1	ZINC000540110638	459379944	/nfs/dbraw/zinc/37/99/44/459379944.db2.gz	JWMCNIOMXWFPRF-UHFFFAOYSA-N	0	3	337.533	3.098	20	30		EGEDHN
CC(C)[C@H]1CCCN([C@@H]2CCN(c3ccc(C#N)cc3)C2=O)CC1	ZINC000569025963	459384420	/nfs/dbraw/zinc/38/44/20/459384420.db2.gz	YGAHPUHNLHACEV-PKOBYXMFSA-N	0	3	325.456	3.422	20	30		EGEDHN
CN(CC(=O)NC1(C#N)CCC1)[C@H]1CCCC[C@@H]1c1ccccc1	ZINC000560725214	459390743	/nfs/dbraw/zinc/39/07/43/459390743.db2.gz	XHLCYLLTGGEVJY-MSOLQXFVSA-N	0	3	325.456	3.207	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1C[C@@H](C)S[C@H](C)C1)C(C)C	ZINC000525295177	459444895	/nfs/dbraw/zinc/44/48/95/459444895.db2.gz	XXCPYYLFLKNMKO-BRWVUGGUSA-N	0	3	339.549	3.220	20	30		EGEDHN
N#Cc1ccccc1COc1cccc(CNCCOCCF)c1	ZINC000596057269	459504302	/nfs/dbraw/zinc/50/43/02/459504302.db2.gz	LVUDQJBNLJGSNO-UHFFFAOYSA-N	0	3	328.387	3.213	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@@H](N[C@H]3CCc4cc(F)ccc43)C2=O)cc1	ZINC000541881728	459506219	/nfs/dbraw/zinc/50/62/19/459506219.db2.gz	NCQLGEUAEQGVKG-VQTJNVASSA-N	0	3	349.409	3.470	20	30		EGEDHN
CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1NCc1ccc(CC#N)cc1	ZINC000497267574	459508353	/nfs/dbraw/zinc/50/83/53/459508353.db2.gz	DKHGJRWANPPYHE-DLBZAZTESA-N	0	3	329.444	3.288	20	30		EGEDHN
CCN1CCN(Cc2ccccc2CNc2nc(C#N)ccc2C)CC1	ZINC000596073567	459509648	/nfs/dbraw/zinc/50/96/48/459509648.db2.gz	JGEAFWBCEDYLEI-UHFFFAOYSA-N	0	3	349.482	3.011	20	30		EGEDHN
C=CCn1c(C2CCCC2)nnc1N1CCN([C@@H]2C[C@H]2C)C[C@@H](C)C1	ZINC000569901404	459527514	/nfs/dbraw/zinc/52/75/14/459527514.db2.gz	LXFXJPGFPIRDNJ-JFIYKMOQSA-N	0	3	343.519	3.288	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@@H](C)N(C)CCCc1ccc(OC)cc1	ZINC000497477137	459539029	/nfs/dbraw/zinc/53/90/29/459539029.db2.gz	UNUSSPBEXWRPCZ-QGZVFWFLSA-N	0	3	332.488	3.373	20	30		EGEDHN
N#CCCN(C(=O)CN[C@@H]1CCC[C@@H]2C[C@@H]21)c1cccc(Cl)c1	ZINC000583485561	459547610	/nfs/dbraw/zinc/54/76/10/459547610.db2.gz	LRFAFZYOXAMPFL-XOKHGSTOSA-N	0	3	331.847	3.365	20	30		EGEDHN
CC(C)c1ccc(OC2CCN(C(=O)[C@@H](N)CCCC#N)CC2)cc1	ZINC000570508385	459556735	/nfs/dbraw/zinc/55/67/35/459556735.db2.gz	OYTXNMKVKUUTPO-IBGZPJMESA-N	0	3	343.471	3.201	20	30		EGEDHN
C=CCn1cccc1C(=O)N1CCCN(Cc2ccccc2)C[C@H]1C	ZINC000488957620	459557684	/nfs/dbraw/zinc/55/76/84/459557684.db2.gz	STXJHPVVQAXLCP-GOSISDBHSA-N	0	3	337.467	3.411	20	30		EGEDHN
COc1ccc([C@@H](CCC#N)NC[C@H](CO)Cc2ccco2)cc1	ZINC000562499113	459572107	/nfs/dbraw/zinc/57/21/07/459572107.db2.gz	YUZISRUPVKFRRL-DNVCBOLYSA-N	0	3	328.412	3.074	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1)C(C)C	ZINC000498379510	459587619	/nfs/dbraw/zinc/58/76/19/459587619.db2.gz	ZEIVSUVJKCZHDV-KRWDZBQOSA-N	0	3	331.416	3.023	20	30		EGEDHN
C#C[C@@H](NC(=O)N[C@H](C)C1=CCN(C)CC1)c1ccc(Cl)cc1F	ZINC000491220042	459606087	/nfs/dbraw/zinc/60/60/87/459606087.db2.gz	JSOFEGKNZALHBF-SJKOYZFVSA-N	0	3	349.837	3.103	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc3nc(Cl)sc3c2)CC1	ZINC000491439278	459627446	/nfs/dbraw/zinc/62/74/46/459627446.db2.gz	IVCXUEJCPPNYKN-UHFFFAOYSA-N	0	3	333.844	3.233	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@H]2CC[C@H](c3ccc(Cl)cc3)C2)CC1	ZINC000491556767	459636959	/nfs/dbraw/zinc/63/69/59/459636959.db2.gz	YYVDUZWCKNZTOR-HKUYNNGSSA-N	0	3	344.886	3.438	20	30		EGEDHN
CN(Cc1ccccc1)C1(CNC(=O)Cc2cccc(C#N)c2)CCC1	ZINC000562760938	459642764	/nfs/dbraw/zinc/64/27/64/459642764.db2.gz	OWLGTDAQOCNYLA-UHFFFAOYSA-N	0	3	347.462	3.272	20	30		EGEDHN
C#CCCN1CCC(NC(=O)/C=C/c2cnc(C(C)(C)C)s2)CC1	ZINC000492092675	459691790	/nfs/dbraw/zinc/69/17/90/459691790.db2.gz	YYNGXXKBMNAFDG-BQYQJAHWSA-N	0	3	345.512	3.058	20	30		EGEDHN
CN1CC[C@H](NC(=O)/C=C/c2ccc(C#N)cc2)[C@@H]1c1ccccc1	ZINC000492248324	459697763	/nfs/dbraw/zinc/69/77/63/459697763.db2.gz	MIEXSQLKEXQBKM-ZKCNSREISA-N	0	3	331.419	3.133	20	30		EGEDHN
CSc1ccc(OC[C@@H](O)CN2CCC(CCC#N)CC2)cc1	ZINC000573718355	459723747	/nfs/dbraw/zinc/72/37/47/459723747.db2.gz	LZEDNJADDYWNKX-INIZCTEOSA-N	0	3	334.485	3.164	20	30		EGEDHN
CN(C(=O)C(C[C@H]1CCCO1)C(F)(F)F)c1cccc(C#N)c1	ZINC000593038134	459749427	/nfs/dbraw/zinc/74/94/27/459749427.db2.gz	WILFRLYWSBIUQB-ZIAGYGMSSA-N	0	3	326.318	3.269	20	30		EGEDHN
C[C@H](NC1CCN(Cc2ccc(C#N)cc2)CC1)c1ncccc1F	ZINC000527827854	459751400	/nfs/dbraw/zinc/75/14/00/459751400.db2.gz	LDAGVUZQHFQZQT-HNNXBMFYSA-N	0	3	338.430	3.408	20	30		EGEDHN
N#CC1(CC(=O)NCCCN2CCc3ccccc3C2)CCCCC1	ZINC000596777408	459760691	/nfs/dbraw/zinc/76/06/91/459760691.db2.gz	YQVYLAATMBCFTH-UHFFFAOYSA-N	0	3	339.483	3.415	20	30		EGEDHN
CC(C)Oc1ccc([C@H](CNC[C@H](C#N)CCC#N)N(C)C)cc1	ZINC000564868899	459778293	/nfs/dbraw/zinc/77/82/93/459778293.db2.gz	KGKASTXYBYBPTR-LPHOPBHVSA-N	0	3	328.460	3.110	20	30		EGEDHN
C=CC[NH+]1CCC(Nc2c(C(=O)[O-])cnc3c(C)cc(C)cc32)CC1	ZINC000565036266	459780862	/nfs/dbraw/zinc/78/08/62/459780862.db2.gz	SWFHVFJNFAZKIG-UHFFFAOYSA-N	0	3	339.439	3.034	20	30		EGEDHN
C[C@H](NCC(=O)N[C@@](C)(C#N)C1CC1)c1ccc(F)c2ccccc21	ZINC000565269775	459782637	/nfs/dbraw/zinc/78/26/37/459782637.db2.gz	JXHLUVVYVRCEFN-RBZFPXEDSA-N	0	3	339.414	3.438	20	30		EGEDHN
C[C@H]1CCCc2ccccc2[C@@H]1NCc1cnc2c(C#N)cnn2c1	ZINC000574205799	459790548	/nfs/dbraw/zinc/79/05/48/459790548.db2.gz	LHLPLSJWRAMNSK-IFXJQAMLSA-N	0	3	331.423	3.404	20	30		EGEDHN
COCc1csc(CN2CCCN(c3ccccc3C#N)CC2)c1	ZINC000596988094	459812026	/nfs/dbraw/zinc/81/20/26/459812026.db2.gz	SJRXVXGCGCLSDH-UHFFFAOYSA-N	0	3	341.480	3.478	20	30		EGEDHN
COCc1ccc(NC(=O)NC[C@H](C)N2CCCC[C@H]2C)cc1C#N	ZINC000529211933	459825783	/nfs/dbraw/zinc/82/57/83/459825783.db2.gz	QCEUYVKXGOAGTO-CABCVRRESA-N	0	3	344.459	3.089	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)C1CC2(CCC2)C1	ZINC000566256283	459829751	/nfs/dbraw/zinc/82/97/51/459829751.db2.gz	IOUCRSAUPSBHQB-UHFFFAOYSA-N	0	3	325.456	3.029	20	30		EGEDHN
N#CCCC1CCN(C(=O)C2CCN(Cc3ccccc3)CC2)CC1	ZINC000566275310	459834062	/nfs/dbraw/zinc/83/40/62/459834062.db2.gz	PVUKVNXGHFRYMC-UHFFFAOYSA-N	0	3	339.483	3.441	20	30		EGEDHN
C[C@H](CNC(=O)c1cc2ccccc2n1CC#N)N1CCC[C@H](C)C1	ZINC000609163465	459916066	/nfs/dbraw/zinc/91/60/66/459916066.db2.gz	MHDJDQYDKCRCEK-JKSUJKDBSA-N	0	3	338.455	3.015	20	30		EGEDHN
C[C@H](CNC(=O)c1cc2ccccc2n1CC#N)N1CCCC[C@H]1C	ZINC000609163435	459916141	/nfs/dbraw/zinc/91/61/41/459916141.db2.gz	LEVDFVHBAAMFRJ-HZPDHXFCSA-N	0	3	338.455	3.158	20	30		EGEDHN
N#CCc1ccc(OC[C@H](O)CNCc2ccc(F)c(Cl)c2)cc1	ZINC000575052888	459916174	/nfs/dbraw/zinc/91/61/74/459916174.db2.gz	QOQLMWZSAIHPJM-OAHLLOKOSA-N	0	3	348.805	3.075	20	30		EGEDHN
N#Cc1ccccc1N1CCCN(Cc2cc3cnccc3o2)CC1	ZINC000593571927	459925197	/nfs/dbraw/zinc/92/51/97/459925197.db2.gz	XJIDKGJTNXKIOT-UHFFFAOYSA-N	0	3	332.407	3.412	20	30		EGEDHN
Cc1cc(CN[C@@H](Cc2ccccc2)[C@@H](O)C(F)(F)F)ccc1C#N	ZINC000618193481	459928398	/nfs/dbraw/zinc/92/83/98/459928398.db2.gz	ILDSIDUKMSDCEV-ZWKOTPCHSA-N	0	3	348.368	3.491	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CSCc2ccc(F)cc2)CC1	ZINC000609266421	459933489	/nfs/dbraw/zinc/93/34/89/459933489.db2.gz	HANVROMMRPZRFR-UHFFFAOYSA-N	0	3	336.476	3.216	20	30		EGEDHN
COc1ccc(CN2CCC([C@@H](C)CO)CC2)cc1OCCCC#N	ZINC000593677204	459947660	/nfs/dbraw/zinc/94/76/60/459947660.db2.gz	UKGLHMBWZHWFRU-INIZCTEOSA-N	0	3	346.471	3.218	20	30		EGEDHN
Cc1ccc(C)c(OC2CCN(C[C@@H](O)CC(C)(C)C#N)CC2)c1	ZINC000598586323	459954061	/nfs/dbraw/zinc/95/40/61/459954061.db2.gz	FTXDJPLIEKXLBI-KRWDZBQOSA-N	0	3	330.472	3.447	20	30		EGEDHN
CCc1cnc(CNC2CCN(Cc3cccc(C#N)c3)CC2)s1	ZINC000593693126	459954619	/nfs/dbraw/zinc/95/46/19/459954619.db2.gz	PULPMZATQMMARP-UHFFFAOYSA-N	0	3	340.496	3.331	20	30		EGEDHN
C[C@H]1Cc2ccccc2N1C1CCN(C[C@H](O)CC(C)(C)C#N)CC1	ZINC000598594034	459957482	/nfs/dbraw/zinc/95/74/82/459957482.db2.gz	FENXQRUUULCMQL-QFBILLFUSA-N	0	3	341.499	3.203	20	30		EGEDHN
COC1CCN(CCNc2cc(C#N)ccc2C(F)(F)F)CC1	ZINC000613883468	459959762	/nfs/dbraw/zinc/95/97/62/459959762.db2.gz	HKZIHNIKPOYSEZ-UHFFFAOYSA-N	0	3	327.350	3.100	20	30		EGEDHN
CN(CCOc1ccc(C(F)(F)F)cc1)C[C@@H](O)CC(C)(C)C#N	ZINC000598615697	459965040	/nfs/dbraw/zinc/96/50/40/459965040.db2.gz	LBCBWBZRIRJVOQ-AWEZNQCLSA-N	0	3	344.377	3.317	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN[C@@H](CCO)c1ccc(Cl)c(Cl)c1	ZINC000598617496	459965904	/nfs/dbraw/zinc/96/59/04/459965904.db2.gz	SQVNBYPUDLRICO-DOMZBBRYSA-N	0	3	345.270	3.307	20	30		EGEDHN
CC(C)CN(Cc1ccc(F)c(Cl)c1)C(=O)[C@@H](N)CCCC#N	ZINC000602535711	459987366	/nfs/dbraw/zinc/98/73/66/459987366.db2.gz	YAWYEKKSUQRGLF-INIZCTEOSA-N	0	3	339.842	3.485	20	30		EGEDHN
C[C@@H](CCC#N)CN[C@H]1CCN(c2ccc(C(F)(F)F)cc2)C1=O	ZINC000602545576	459991900	/nfs/dbraw/zinc/99/19/00/459991900.db2.gz	FYVGPKQLFXRQRN-WFASDCNBSA-N	0	3	339.361	3.340	20	30		EGEDHN
CCOc1c(Cl)cc(CNC[C@H](O)CC(C)(C)C#N)cc1OC	ZINC000598701552	459999873	/nfs/dbraw/zinc/99/98/73/459999873.db2.gz	XDOMDUAMILTZDD-CYBMUJFWSA-N	0	3	340.851	3.138	20	30		EGEDHN
CCc1nc2cc(CNC[C@@H](O)CC(C)(C)C#N)ccc2n1C1CC1	ZINC000598728942	460009068	/nfs/dbraw/zinc/00/90/68/460009068.db2.gz	XPQLBFCZILMBIB-INIZCTEOSA-N	0	3	340.471	3.324	20	30		EGEDHN
Cc1cc(C[C@H](C)NCc2cccc(C#N)n2)n(-c2ccccc2)n1	ZINC000602583811	460009524	/nfs/dbraw/zinc/00/95/24/460009524.db2.gz	YUAVPJITIUWMRA-HNNXBMFYSA-N	0	3	331.423	3.168	20	30		EGEDHN
N#C[C@@H](NC(=O)[C@@H]1CCN(Cc2ccccc2)C1)C1CCCCC1	ZINC000575812606	460009493	/nfs/dbraw/zinc/00/94/93/460009493.db2.gz	NGDGKHYIKLOBEM-RTBURBONSA-N	0	3	325.456	3.097	20	30		EGEDHN
N#Cc1ccccc1N1CCCN(CCc2noc3ccccc32)CC1	ZINC000593944864	460022287	/nfs/dbraw/zinc/02/22/87/460022287.db2.gz	NNLXHOWHUWMXST-UHFFFAOYSA-N	0	3	346.434	3.454	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)C(=O)NC[C@H](C)N(C)Cc1ccccc1	ZINC000593974818	460036312	/nfs/dbraw/zinc/03/63/12/460036312.db2.gz	GTNNAELAQORXNM-MSOLQXFVSA-N	0	3	349.478	3.374	20	30		EGEDHN
CN(Cc1cccc(OCc2cccc(C#N)c2)c1)C[C@@H](O)C1CC1	ZINC000589198197	460052725	/nfs/dbraw/zinc/05/27/25/460052725.db2.gz	QNOOJGFRLOBOOI-OAQYLSRUSA-N	0	3	336.435	3.340	20	30		EGEDHN
N#Cc1ccc(NCC(=O)N(CCN2CCCC2)c2ccccc2)cc1	ZINC000610069094	460057765	/nfs/dbraw/zinc/05/77/65/460057765.db2.gz	UGEGSNAQJMQDQQ-UHFFFAOYSA-N	0	3	348.450	3.099	20	30		EGEDHN
CCC(C)(C)N1CCN(C(=O)N[C@H](C)c2ccc(C#N)cc2)CC1	ZINC000594067246	460084732	/nfs/dbraw/zinc/08/47/32/460084732.db2.gz	NJGQOSXTLBNQQQ-OAHLLOKOSA-N	0	3	328.460	3.135	20	30		EGEDHN
N#CCC1(CN2CCC[C@H](CNC(=O)Nc3cccc(F)c3)C2)CC1	ZINC000602785789	460124154	/nfs/dbraw/zinc/12/41/54/460124154.db2.gz	CNJFIHNYYLCSSZ-OAHLLOKOSA-N	0	3	344.434	3.353	20	30		EGEDHN
CC(C)(C(=O)N[C@@H]1CCCN2CCCC[C@H]12)c1cc(F)cc(C#N)c1	ZINC000594196799	460143545	/nfs/dbraw/zinc/14/35/45/460143545.db2.gz	MUPFVQHQLOBGCM-QZTJIDSGSA-N	0	3	343.446	3.108	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(c3ccncc3)CC2)c(Cl)c1	ZINC000602851109	460157090	/nfs/dbraw/zinc/15/70/90/460157090.db2.gz	ZHSPFLYAXLXYQQ-UHFFFAOYSA-N	0	3	326.831	3.319	20	30		EGEDHN
Cc1ncc(CNC(=O)CCN(C)[C@H](C)c2cccc(C#N)c2)s1	ZINC000602846124	460158437	/nfs/dbraw/zinc/15/84/37/460158437.db2.gz	MSBANTBAZUGGDU-CYBMUJFWSA-N	0	3	342.468	3.023	20	30		EGEDHN
N#CC[C@H]1CCCN(C[C@@H](O)COc2cc(Cl)cc(Cl)c2)C1	ZINC000602883758	460169341	/nfs/dbraw/zinc/16/93/41/460169341.db2.gz	MGLJBQQFUQECHB-IUODEOHRSA-N	0	3	343.254	3.359	20	30		EGEDHN
Cc1ccc(CCNC(=O)C(C#N)Cc2ccc(C#N)cc2)cc1C	ZINC000598144552	460188618	/nfs/dbraw/zinc/18/86/18/460188618.db2.gz	ZSYHMBAWBOEHLG-FQEVSTJZSA-N	0	3	331.419	3.216	20	30		EGEDHN
N#CCCCC[C@@H](N)C(=O)NCC1(c2ccccc2)CCCCC1	ZINC000594426818	460215281	/nfs/dbraw/zinc/21/52/81/460215281.db2.gz	FNTOHBDMYYIMHA-GOSISDBHSA-N	0	3	327.472	3.416	20	30		EGEDHN
COc1ccc2c(c1)C[C@@H](C(C)C)CN2C(=O)[C@H](N)CCCCC#N	ZINC000594449811	460225028	/nfs/dbraw/zinc/22/50/28/460225028.db2.gz	OMSAVJSAZXAXEK-SJLPKXTDSA-N	0	3	343.471	3.268	20	30		EGEDHN
CC(C)(NC[C@H](O)COc1ccccc1C#N)c1ccc(Cl)cc1	ZINC000599323754	460227860	/nfs/dbraw/zinc/22/78/60/460227860.db2.gz	KXUGZHYSZKAMTM-KRWDZBQOSA-N	0	3	344.842	3.476	20	30		EGEDHN
CC(C)(NC[C@H](O)COc1ccccc1C#N)c1cccc(Cl)c1	ZINC000599357710	460237680	/nfs/dbraw/zinc/23/76/80/460237680.db2.gz	WPGDUOYTBZCGHT-KRWDZBQOSA-N	0	3	344.842	3.476	20	30		EGEDHN
COC(=O)c1[nH]c(C)c(C(=O)C(C#N)c2ccc3ccccc3n2)c1C	ZINC000610871176	460252739	/nfs/dbraw/zinc/25/27/39/460252739.db2.gz	RNBUUYZCZXXQPM-AWEZNQCLSA-N	0	3	347.374	3.456	20	30		EGEDHN
CN(CCOC(C)(C)C)Cc1cn(CCC#N)nc1-c1ccncc1	ZINC000619071341	460262107	/nfs/dbraw/zinc/26/21/07/460262107.db2.gz	VQZSYMXXWTTWMF-UHFFFAOYSA-N	0	3	341.459	3.106	20	30		EGEDHN
N#Cc1ccc(C(=O)N2CC[C@@]3(C2)CCCN(Cc2ccccc2)C3)[nH]1	ZINC000611035719	460280477	/nfs/dbraw/zinc/28/04/77/460280477.db2.gz	NUOBVGAPOOFJOL-NRFANRHFSA-N	0	3	348.450	3.015	20	30		EGEDHN
CN(C)[C@@H]1CCCN(C(=O)c2c(Cl)cc(C#N)cc2Cl)C1	ZINC000611093786	460288924	/nfs/dbraw/zinc/28/89/24/460288924.db2.gz	DZWAJKIGRKMELK-LLVKDONJSA-N	0	3	326.227	3.031	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@]3(C2)C(=O)Nc2ccccc23)c(Cl)c1	ZINC000615232057	460295819	/nfs/dbraw/zinc/29/58/19/460295819.db2.gz	XPPJCTRBFUBOHS-IBGZPJMESA-N	0	3	337.810	3.307	20	30		EGEDHN
CCOC(=O)C[C@H](c1ccccc1)C1CCN(CC#CCOC)CC1	ZINC000611194836	460306031	/nfs/dbraw/zinc/30/60/31/460306031.db2.gz	UWZYBQUMTXRCAP-HXUWFJFHSA-N	0	3	343.467	3.085	20	30		EGEDHN
CCC[C@@H](C#N)NC(=O)c1ccccc1OCCN1CCCC[C@H]1C	ZINC000611286025	460328978	/nfs/dbraw/zinc/32/89/78/460328978.db2.gz	AJIVDHGJPZWTAK-SJORKVTESA-N	0	3	343.471	3.362	20	30		EGEDHN
CN(C)C(=O)c1cccc(CN[C@@H]2CCCc3cc(C#N)ccc32)c1	ZINC000611391010	460352361	/nfs/dbraw/zinc/35/23/61/460352361.db2.gz	ZJLJURMKBHZJMY-HXUWFJFHSA-N	0	3	333.435	3.427	20	30		EGEDHN
N#Cc1ccc2c(c1)CCC[C@H]2N[C@@H]1CC(=O)N(c2ccccc2)C1	ZINC000611391724	460354158	/nfs/dbraw/zinc/35/41/58/460354158.db2.gz	GFVGFAWSNPPLGU-YLJYHZDGSA-N	0	3	331.419	3.331	20	30		EGEDHN
N#Cc1cnn2cc(CNCCc3ccc(Cl)cc3Cl)cnc12	ZINC000603891255	460355713	/nfs/dbraw/zinc/35/57/13/460355713.db2.gz	RJWRKHPNTAXMOF-UHFFFAOYSA-N	0	3	346.221	3.240	20	30		EGEDHN
CN(C)Cc1ccccc1NC(=O)c1ccn(-c2cccc(C#N)c2)n1	ZINC000619610772	460396554	/nfs/dbraw/zinc/39/65/54/460396554.db2.gz	OCTBIWBJQMDUSW-UHFFFAOYSA-N	0	3	345.406	3.058	20	30		EGEDHN
N#Cc1cccc(CN2CCC(CC(=O)NC3CCCC3)CC2)c1	ZINC000604415918	460423714	/nfs/dbraw/zinc/42/37/14/460423714.db2.gz	KYYLQPIWIAPREJ-UHFFFAOYSA-N	0	3	325.456	3.219	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)[C@@H](C(C)C)N1CCCCC1	ZINC000600460987	460499023	/nfs/dbraw/zinc/49/90/23/460499023.db2.gz	MMNREKGUYHIYNF-LJQANCHMSA-N	0	3	330.472	3.378	20	30		EGEDHN
CCN(CC)[C@H](CNC(=O)N1CCC[C@@](C)(C#N)C1)c1ccccc1	ZINC000612094736	460537569	/nfs/dbraw/zinc/53/75/69/460537569.db2.gz	WGCMCPYNBOJJFK-QUCCMNQESA-N	0	3	342.487	3.405	20	30		EGEDHN
C=CCCOCc1nc(-c2ccc3c(c2)C(SC)C(=O)N3)no1	ZINC000612922611	460773309	/nfs/dbraw/zinc/77/33/09/460773309.db2.gz	ATBPXEMBIBYOLY-CQSZACIVSA-N	0	3	331.397	3.186	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN1CCC[C@H]1CC(=O)c1ccc(F)cc1	ZINC000621269078	460968806	/nfs/dbraw/zinc/96/88/06/460968806.db2.gz	IVRNUSTWWPGJFH-IRXDYDNUSA-N	0	3	332.419	3.164	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN(C[C@@H](C)O)C2CC2)cc1OC	ZINC000628328298	461089582	/nfs/dbraw/zinc/08/95/82/461089582.db2.gz	KGGULBKBCPZXNY-GFCCVEGCSA-N	0	3	325.836	3.259	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2ncsc2Nc2ccccc2)CC1	ZINC000668368619	461257959	/nfs/dbraw/zinc/25/79/59/461257959.db2.gz	BXTDYVSCYRIPKA-UHFFFAOYSA-N	0	3	342.468	3.267	20	30		EGEDHN
C=CCC[C@H](CO)NCc1cc(Cl)ccc1OC[C@H]1CCCO1	ZINC000641759587	461355659	/nfs/dbraw/zinc/35/56/59/461355659.db2.gz	GVFJSYNDRBKQCM-IAGOWNOFSA-N	0	3	339.863	3.315	20	30		EGEDHN
C=CCC[C@@H](CO)NCc1cc(Cl)ccc1OC[C@@H]1CCCO1	ZINC000641759588	461355943	/nfs/dbraw/zinc/35/59/43/461355943.db2.gz	GVFJSYNDRBKQCM-IRXDYDNUSA-N	0	3	339.863	3.315	20	30		EGEDHN
C=C(C)[C@@H](NC1CCN([C@@H]2CCOC2)CC1)c1ccc(F)c(F)c1	ZINC000655757652	461424813	/nfs/dbraw/zinc/42/48/13/461424813.db2.gz	WLWNBFVNAOIFPK-VQIMIIECSA-N	0	3	336.426	3.425	20	30		EGEDHN
C=CCN1CCC(NC(=O)CCc2ccccc2C(F)(F)F)CC1	ZINC000630942016	461426980	/nfs/dbraw/zinc/42/69/80/461426980.db2.gz	HMSFTGSHZOITGR-UHFFFAOYSA-N	0	3	340.389	3.405	20	30		EGEDHN
C=CCN(C(=O)NC[C@H](c1ccccc1)N1CCCC1)[C@H](C)COC	ZINC000663400150	461620650	/nfs/dbraw/zinc/62/06/50/461620650.db2.gz	MUKUKELSPNACEW-IEBWSBKVSA-N	0	3	345.487	3.056	20	30		EGEDHN
C=CCC[C@@H](NCc1ccc(S(=O)(=O)NC)cc1)c1ccccc1	ZINC000660201956	461636053	/nfs/dbraw/zinc/63/60/53/461636053.db2.gz	ZYVOGLRXBACHRP-LJQANCHMSA-N	0	3	344.480	3.392	20	30		EGEDHN
C[C@H](C[C@@H]1CCCC(=O)N1)NCC#Cc1ccc(C(F)(F)F)cc1	ZINC000638897349	461643019	/nfs/dbraw/zinc/64/30/19/461643019.db2.gz	GVEABNGEYRTQAU-CJNGLKHVSA-N	0	3	338.373	3.094	20	30		EGEDHN
C=CCN(Cc1ccc(Cl)s1)C(=O)[C@@H]1CNCCC1(F)F	ZINC000643983557	461851103	/nfs/dbraw/zinc/85/11/03/461851103.db2.gz	CGKOZVSOYROVSP-NSHDSACASA-N	0	3	334.819	3.161	20	30		EGEDHN
C=C(C)[C@@H](NC(=O)N[C@@H]1CCN(CCC)C1)c1ccc(F)c(F)c1	ZINC000661036971	462074994	/nfs/dbraw/zinc/07/49/94/462074994.db2.gz	NCFHKNQLDYDNCO-RHSMWYFYSA-N	0	3	337.414	3.366	20	30		EGEDHN
C=CCCn1cc(CN[C@H]2CCc3[nH]c4ccc(C)cc4c3C2)nn1	ZINC000657429702	462118502	/nfs/dbraw/zinc/11/85/02/462118502.db2.gz	IVLCWPXQBPJKBM-HNNXBMFYSA-N	0	3	335.455	3.291	20	30		EGEDHN
C=CCN(C[C@@H](O)COc1ccc2ccccc2c1)[C@H](C)COC	ZINC000661248128	462169884	/nfs/dbraw/zinc/16/98/84/462169884.db2.gz	SBUMSPACTYFGDU-VQIMIIECSA-N	0	3	329.440	3.102	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)N[C@@H]1CCCN2CCCC[C@@H]12	ZINC000654726626	462355621	/nfs/dbraw/zinc/35/56/21/462355621.db2.gz	XFWWNZYXWVMLIM-SJORKVTESA-N	0	3	333.501	3.463	20	30		EGEDHN
C=CCN(Cc1ccccc1)C(=O)N[C@@H]1CCCN2CCCC[C@@H]12	ZINC000654726584	462355780	/nfs/dbraw/zinc/35/57/80/462355780.db2.gz	WRZYCKIUBNFLFR-MOPGFXCFSA-N	0	3	327.472	3.401	20	30		EGEDHN
C=C[C@H](CC(=O)N1CCCN(c2ccncc2)CC1)c1ccccc1	ZINC000640446400	462408922	/nfs/dbraw/zinc/40/89/22/462408922.db2.gz	VYHIQESEMUHSIJ-GOSISDBHSA-N	0	3	335.451	3.480	20	30		EGEDHN
Cc1oc(NC(=O)CN[C@H](C)[C@@H](C)c2ccccc2)c(C#N)c1C	ZINC000181528104	534549008	/nfs/dbraw/zinc/54/90/08/534549008.db2.gz	MQCABMIPWQWEFP-TZMCWYRMSA-N	0	3	325.412	3.488	20	30		EGEDHN
Cc1oc([N-]C(=O)C[NH2+][C@H](C)[C@@H](C)c2ccccc2)c(C#N)c1C	ZINC000181528104	534549012	/nfs/dbraw/zinc/54/90/12/534549012.db2.gz	MQCABMIPWQWEFP-TZMCWYRMSA-N	0	3	325.412	3.488	20	30		EGEDHN
C=CCN1CCC(NC(=O)C2(c3ccc(F)cc3)CCCC2)CC1	ZINC000171720371	526421133	/nfs/dbraw/zinc/42/11/33/526421133.db2.gz	LKRVXMFHHLLAIZ-UHFFFAOYSA-N	0	3	330.447	3.404	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@H](C)Oc2cc(C)ccc2Cl)CC1	ZINC000171717872	526445207	/nfs/dbraw/zinc/44/52/07/526445207.db2.gz	PXCINEXXYBAYRS-AWEZNQCLSA-N	0	3	336.863	3.182	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCCc2ccc(Cl)s2)CC1	ZINC000171554273	526590810	/nfs/dbraw/zinc/59/08/10/526590810.db2.gz	QMHBHZKEIYKPLU-UHFFFAOYSA-N	0	3	341.908	3.284	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H](C)CCOc2ccccc2)CC1	ZINC000174296086	526598179	/nfs/dbraw/zinc/59/81/79/526598179.db2.gz	LRLFOPTUQXYEJP-QGZVFWFLSA-N	0	3	330.472	3.248	20	30		EGEDHN
C=CCOc1cccc(CN2CCC3(CC2)[C@H](OCC)C[C@@H]3O)c1	ZINC000130230484	526898173	/nfs/dbraw/zinc/89/81/73/526898173.db2.gz	PRGUUGIADZOIII-RBUKOAKNSA-N	0	3	331.456	3.003	20	30		EGEDHN
CC(C)Cn1cc(CNCCSCc2ccccc2C#N)cn1	ZINC000181758067	528710793	/nfs/dbraw/zinc/71/07/93/528710793.db2.gz	DFAHTSDVWCVFNS-UHFFFAOYSA-N	0	3	328.485	3.434	20	30		EGEDHN
C[C@H](CC#N)N(C)C(=O)Nc1ccc(OCCN2CCCCC2)cc1	ZINC000127320615	546768284	/nfs/dbraw/zinc/76/82/84/546768284.db2.gz	AMJTUZPSBQASDO-MRXNPFEDSA-N	0	3	344.459	3.317	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cc(C(F)(F)F)ccn2)CC1	ZINC000181897693	547074476	/nfs/dbraw/zinc/07/44/76/547074476.db2.gz	JWDHDOZXOQBQJV-UHFFFAOYSA-N	0	3	342.365	3.262	20	30		EGEDHN
CCN1CCCC[C@@H]1CNC(=O)Nc1ccc(N2CCCC2=O)cc1	ZINC000329451835	547498362	/nfs/dbraw/zinc/49/83/62/547498362.db2.gz	NCDWSJHIWXNDTJ-QGZVFWFLSA-N	0	3	344.459	3.014	20	30		EGEDHN
C[C@@H]1CC[C@H](C)N1CC(=O)Nc1cccc([C@]2(C)NC(=O)NC2=O)c1	ZINC000329572625	547501502	/nfs/dbraw/zinc/50/15/02/547501502.db2.gz	NCITWYPTWRWCLS-IUUKEHGRSA-N	0	3	344.415	3.247	20	30		EGEDHN
C[C@H](NC(=O)C1CCCCC1)C(=O)N1CCCN(C2CCCC2)CC1	ZINC000329689812	547504997	/nfs/dbraw/zinc/50/49/97/547504997.db2.gz	VWGFLTDUUVAKSZ-INIZCTEOSA-N	0	3	349.519	3.389	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N[C@@H](C)c1cnccc1C)C(C)C	ZINC000678436187	549492118	/nfs/dbraw/zinc/49/21/18/549492118.db2.gz	MINHOQWRAYOKKS-HKUYNNGSSA-N	0	3	344.503	3.449	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2C[C@@H](C(F)(F)F)CC[C@@H]2C)CC1	ZINC000679487637	549718879	/nfs/dbraw/zinc/71/88/79/549718879.db2.gz	JQNPMTCBBVFCQY-KBPBESRZSA-N	0	3	347.425	3.399	20	30		EGEDHN
C=C(C)[C@@H](NC(=O)N[C@@H]1CCN(CC2CC2)C1)c1ccc(F)c(F)c1	ZINC000681311042	549981010	/nfs/dbraw/zinc/98/10/10/549981010.db2.gz	NJDIRORNTVKZRT-CRAIPNDOSA-N	0	3	349.425	3.366	20	30		EGEDHN
C#Cc1cccc(NC(=S)N[C@@H]2CCN(Cc3ccccc3)C2)c1	ZINC000726440713	574555123	/nfs/dbraw/zinc/55/51/23/574555123.db2.gz	GKYFNOPXRIHNOM-LJQANCHMSA-N	0	3	335.476	3.229	20	30		EGEDHN
C#Cc1ccc(C(=O)N(CC)[C@H]2CCN([C@H](C)c3ccccc3)C2)cn1	ZINC000728861210	574779772	/nfs/dbraw/zinc/77/97/72/574779772.db2.gz	IONNYDCRAMEPFI-UTKZUKDTSA-N	0	3	347.462	3.361	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](CC)c2ccccc2OC)CC1	ZINC000730030253	574908023	/nfs/dbraw/zinc/90/80/23/574908023.db2.gz	ZLBDKOWKHXTBIO-SFHVURJKSA-N	0	3	345.487	3.486	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cccc(N3CCCCC3)c2)CC1	ZINC000730125085	574922210	/nfs/dbraw/zinc/92/22/10/574922210.db2.gz	MKQOWGLTXISKIP-UHFFFAOYSA-N	0	3	342.487	3.449	20	30		EGEDHN
Cc1ncc(C=CC(=O)C(C#N)C(=O)Nc2ccccc2Cl)s1	ZINC000732900487	575295180	/nfs/dbraw/zinc/29/51/80/575295180.db2.gz	PCKSPSLDJFWGQF-ZHRWSRJISA-N	0	3	345.811	3.466	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)/C=C/c1cncc(F)c1)C(C)C	ZINC000733162505	575311866	/nfs/dbraw/zinc/31/18/66/575311866.db2.gz	ZPIJQYZANLYVPA-DVBCCOPCSA-N	0	3	331.435	3.049	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)/C=C\c1cnc(C)s1)C(C)C	ZINC000733161810	575312389	/nfs/dbraw/zinc/31/23/89/575312389.db2.gz	QDBUNLCCFHGIAM-XZVRFQMRSA-N	0	3	333.501	3.280	20	30		EGEDHN
CC[C@H](C#N)Oc1cccc(CNC(=O)[C@H](C)N2[C@H](C)CC[C@H]2C)c1	ZINC000733810041	575393168	/nfs/dbraw/zinc/39/31/68/575393168.db2.gz	QQIMZFIHVJAELX-XLMAVXFVSA-N	0	3	343.471	3.245	20	30		EGEDHN
C=CC[C@H](NC(=O)NCc1cccc(CN(C)C)c1)c1ccncc1	ZINC000734657591	575532833	/nfs/dbraw/zinc/53/28/33/575532833.db2.gz	JJCHFQBOZOPCIU-IBGZPJMESA-N	0	3	338.455	3.260	20	30		EGEDHN
C=CC[C@@H](NC(=O)NC1CCN(CC(=C)C)CC1)c1ccncc1	ZINC000734668825	575534727	/nfs/dbraw/zinc/53/47/27/575534727.db2.gz	INTIZTZCVSOTMZ-GOSISDBHSA-N	0	3	328.460	3.039	20	30		EGEDHN
C=CC[C@@H](NC(=O)N1CCN(CCC(C)(C)C)CC1)c1ccncc1	ZINC000734678122	575541114	/nfs/dbraw/zinc/54/11/14/575541114.db2.gz	DJNXZCUKEPQFDY-GOSISDBHSA-N	0	3	344.503	3.462	20	30		EGEDHN
C[C@@H](CC(=O)C(C#N)C(=O)NC1CCCCC1)c1cccc(F)c1	ZINC000734964742	575582369	/nfs/dbraw/zinc/58/23/69/575582369.db2.gz	ZUXYGGYOINCEOO-SUMWQHHRSA-N	0	3	330.403	3.477	20	30		EGEDHN
C[C@@H]1[C@H](C)SCCN1CC(=O)C(C#N)c1nc2ccccc2s1	ZINC000735673398	575698206	/nfs/dbraw/zinc/69/82/06/575698206.db2.gz	BCALNQMXEOVZQN-AGIUHOORSA-N	0	3	345.493	3.298	20	30		EGEDHN
C#CCOc1ccc(C(=O)NC[C@H]2CCCCN2CCCC)cc1	ZINC000741680260	576710740	/nfs/dbraw/zinc/71/07/40/576710740.db2.gz	GZBSBFBBCASAKH-GOSISDBHSA-N	0	3	328.456	3.083	20	30		EGEDHN
C#CCOc1ccc(CN[C@@H]2CCCN(c3ccc(C)cc3)C2=O)cc1	ZINC000742380072	576776578	/nfs/dbraw/zinc/77/65/78/576776578.db2.gz	KOKNHGBWIHBZKS-OAQYLSRUSA-N	0	3	348.446	3.292	20	30		EGEDHN
C#CCOc1cc(F)ccc1NC(=O)N[C@H](C)CN1CCC[C@@H](C)C1	ZINC000743199580	576803181	/nfs/dbraw/zinc/80/31/81/576803181.db2.gz	HMMHFQIBJCMVQG-HUUCEWRRSA-N	0	3	347.434	3.080	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)C(C#N)C(=O)Nc1c(CC)cccc1CC	ZINC000743450166	576809407	/nfs/dbraw/zinc/80/94/07/576809407.db2.gz	XTWGQDMRMPYJGL-WMLDXEAASA-N	0	3	342.439	3.440	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2cc3ccccc3cc2OC)CC1	ZINC000743489907	576810237	/nfs/dbraw/zinc/81/02/37/576810237.db2.gz	LWONIGPXBGIZLH-UHFFFAOYSA-N	0	3	336.435	3.066	20	30		EGEDHN
C#CCOc1cc(F)ccc1NC(=O)c1cccc(CN(C)C)c1	ZINC000743640242	576813869	/nfs/dbraw/zinc/81/38/69/576813869.db2.gz	FOBFOCFATFKOKY-UHFFFAOYSA-N	0	3	326.371	3.152	20	30		EGEDHN
C[C@@H]1CC[C@H](CCC(=O)C(C#N)C(=O)Nc2ccccc2Cl)O1	ZINC000744027692	576819138	/nfs/dbraw/zinc/81/91/38/576819138.db2.gz	BIZJKXBKDRLXMK-UPJWGTAASA-N	0	3	334.803	3.335	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)[C@@H](C)c1ccc(C)o1	ZINC000744031121	576819161	/nfs/dbraw/zinc/81/91/61/576819161.db2.gz	QUMVYFGWPFPSDU-UONOGXRCSA-N	0	3	340.379	3.438	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)[C@@H](C)c1ccccc1C(F)(F)F	ZINC000744032090	576819265	/nfs/dbraw/zinc/81/92/65/576819265.db2.gz	BZIUEEBZLSNDEK-JQWIXIFHSA-N	0	3	326.318	3.042	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CNCc2ccc([S@@](C)=O)cc2)cc1	ZINC000751151812	1299516703	/nfs/dbraw/zinc/51/67/03/1299516703.db2.gz	FYFDPDXYIYFVML-LFVRLGFBSA-N	0	3	328.437	3.005	20	30		EGEDHN
C#C[C@@](C)(CC)NC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C	ZINC000878010217	1299703534	/nfs/dbraw/zinc/70/35/34/1299703534.db2.gz	LBRNMQLXYMYFDI-FQEVSTJZSA-N	0	3	342.487	3.060	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)c2cc(C#N)ccc2F)CN1Cc1ccccc1	ZINC000830009984	1292653583	/nfs/dbraw/zinc/65/35/83/1292653583.db2.gz	KDSUFBDDWYCQRC-WMLDXEAASA-N	0	3	337.398	3.090	20	30		EGEDHN
C=CCc1cc(OC)cc(CN2CCC(O)(C(F)(F)F)CC2)c1O	ZINC000089651764	1292774821	/nfs/dbraw/zinc/77/48/21/1292774821.db2.gz	MZGMZFGEVNUEPB-UHFFFAOYSA-N	0	3	345.361	3.019	20	30		EGEDHN
CCO[C@@H]1CCC[C@H]1N[C@@H](C)C(=O)N(CCC#N)c1ccc(C)cc1	ZINC000832569207	1293023704	/nfs/dbraw/zinc/02/37/04/1293023704.db2.gz	APULBKHSDXWQQX-QXAKKESOSA-N	0	3	343.471	3.177	20	30		EGEDHN
C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)C(C#N)C(=O)NC1CC1	ZINC000107409275	1293066267	/nfs/dbraw/zinc/06/62/67/1293066267.db2.gz	WBFLJTFCQXCPEH-ZANVPECISA-N	0	3	339.222	3.159	20	30		EGEDHN
CC[C@H](CC(F)(F)F)C(=O)C(C#N)C(=O)Nc1cccc(OC)c1	ZINC000835060552	1293195877	/nfs/dbraw/zinc/19/58/77/1293195877.db2.gz	FRPOIGFYILTTAC-MFKMUULPSA-N	0	3	342.317	3.321	20	30		EGEDHN
CC[C@@H](NC(=O)C(C#N)C(=O)CCCC(=O)C1CC1)c1ccccc1	ZINC000835342204	1293268755	/nfs/dbraw/zinc/26/87/55/1293268755.db2.gz	ZPLKKEIURIYAGE-IAGOWNOFSA-N	0	3	340.423	3.112	20	30		EGEDHN
C[C@@H]1[C@@H](OC(=O)c2ccc(C#N)n2C)CCCN1Cc1ccccc1	ZINC000835480402	1293300248	/nfs/dbraw/zinc/30/02/48/1293300248.db2.gz	IMRJXRWPAATPMA-BEFAXECRSA-N	0	3	337.423	3.107	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CNC(C)(C)C(=O)NCC(C)(C)C)cc1	ZINC000121196309	1293359947	/nfs/dbraw/zinc/35/99/47/1293359947.db2.gz	JQUBYVDOCAVVOH-CQSZACIVSA-N	0	3	331.460	3.008	20	30		EGEDHN
CC(C)Oc1cccc(CC(=O)C(C#N)C(=O)NC2CCCCC2)c1	ZINC000124759613	1293484595	/nfs/dbraw/zinc/48/45/95/1293484595.db2.gz	PSSIXIFNNWHQHD-GOSISDBHSA-N	0	3	342.439	3.174	20	30		EGEDHN
Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)C(C#N)C(=O)N2CCCC2)c1	ZINC000124815555	1293485963	/nfs/dbraw/zinc/48/59/63/1293485963.db2.gz	XBFJAJVLDVUBTC-RDJZCZTQSA-N	0	3	342.439	3.217	20	30		EGEDHN
Cc1cc(OCC(=O)C(C#N)C(=O)Nc2ccccc2)ccc1Cl	ZINC000128080509	1293582549	/nfs/dbraw/zinc/58/25/49/1293582549.db2.gz	GWWCHEKHELDQCO-OAHLLOKOSA-N	0	3	342.782	3.375	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)CSc2ccncc2)cc1	ZINC000128380092	1293591542	/nfs/dbraw/zinc/59/15/42/1293591542.db2.gz	FWKUNNQJHKMXPK-INIZCTEOSA-N	0	3	339.420	3.084	20	30		EGEDHN
COCCCC(=O)C(C#N)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000130498221	1293659240	/nfs/dbraw/zinc/65/92/40/1293659240.db2.gz	MMOBJYKYLNOBQB-GFCCVEGCSA-N	0	3	329.183	3.067	20	30		EGEDHN
CNC(=O)C(C#N)C(=O)COc1ccc(C(C)(C)C)cc1C(C)(C)C	ZINC000133451718	1293745121	/nfs/dbraw/zinc/74/51/21/1293745121.db2.gz	BRENDITZBXSYBF-AWEZNQCLSA-N	0	3	344.455	3.115	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CN1CCC[C@@H]1C[C@H](O)c1ccc(F)cc1	ZINC000134797326	1293782161	/nfs/dbraw/zinc/78/21/61/1293782161.db2.gz	NNGRBEFWNVIYAL-MOPGFXCFSA-N	0	3	348.462	3.138	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CNC(C)(C)C(=O)NCC2CCCC2)cc1	ZINC000136034013	1293807820	/nfs/dbraw/zinc/80/78/20/1293807820.db2.gz	VTQFBFSWEGLMLG-OAHLLOKOSA-N	0	3	343.471	3.152	20	30		EGEDHN
COc1ccc(C[C@H](C)C(=O)C(C#N)C(=O)NC2CCCCC2)cc1	ZINC000136583963	1293818144	/nfs/dbraw/zinc/81/81/44/1293818144.db2.gz	CHIKXNHKJRFWNA-KBXCAEBGSA-N	0	3	342.439	3.032	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)c1ccc(Cl)c(F)c1	ZINC000161953241	1294302487	/nfs/dbraw/zinc/30/24/87/1294302487.db2.gz	GVPWQWZWFJIWOP-NSHDSACASA-N	0	3	346.745	3.449	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)c1ccc(Cl)c(F)c1	ZINC000161953337	1294302947	/nfs/dbraw/zinc/30/29/47/1294302947.db2.gz	GVPWQWZWFJIWOP-LLVKDONJSA-N	0	3	346.745	3.449	20	30		EGEDHN
C[C@H](OC1CCCCCC1)C(=O)C(C#N)C(=O)Nc1ccccc1	ZINC000162418750	1294314934	/nfs/dbraw/zinc/31/49/34/1294314934.db2.gz	KXWOERJDYZDZKA-WMLDXEAASA-N	0	3	328.412	3.462	20	30		EGEDHN
C[C@@H](OC1CCCCCC1)C(=O)C(C#N)c1nnc2n1CCCCC2	ZINC000162681013	1294320345	/nfs/dbraw/zinc/32/03/45/1294320345.db2.gz	NGMHFPNMPDULOI-GDBMZVCRSA-N	0	3	344.459	3.309	20	30		EGEDHN
N#CC(C(=O)CC[C@H]1CCCCO1)C(=O)Nc1ccc(Cl)cc1	ZINC000171796843	1294417431	/nfs/dbraw/zinc/41/74/31/1294417431.db2.gz	IDABCXCZNOKXKF-HUUCEWRRSA-N	0	3	334.803	3.337	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)CCC(F)(F)F	ZINC000173972861	1294475448	/nfs/dbraw/zinc/47/54/48/1294475448.db2.gz	DGEXKBZPFVMXDR-JTQLQIEISA-N	0	3	328.290	3.075	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)CC[C@H]2CCOC2)cc1	ZINC000176092220	1294590125	/nfs/dbraw/zinc/59/01/25/1294590125.db2.gz	HLMFXTHRWZAEFR-WMZOPIPTSA-N	0	3	342.439	3.493	20	30		EGEDHN
COc1ccc(CNCc2cn(C)nc2-c2ccccc2)cc1C#N	ZINC000180250614	1294874907	/nfs/dbraw/zinc/87/49/07/1294874907.db2.gz	VWBQRIJWDTZWKK-UHFFFAOYSA-N	0	3	332.407	3.257	20	30		EGEDHN
CC(C)N1CCN(c2ccc(C(=O)OCC(C)(C)CC#N)cc2)CC1	ZINC000184775231	1295218099	/nfs/dbraw/zinc/21/80/99/1295218099.db2.gz	CGAXLRZVOOHRDQ-UHFFFAOYSA-N	0	3	343.471	3.314	20	30		EGEDHN
CC[C@H](C)c1ccc(NC(=O)C(C#N)C(=O)COCC2CC2)cc1	ZINC000193492988	1295877116	/nfs/dbraw/zinc/87/71/16/1295877116.db2.gz	QVHBUXDRKMNCHD-SUMWQHHRSA-N	0	3	328.412	3.274	20	30		EGEDHN
C#CCOc1ccc(Br)cc1CNC[C@H](CCC)OC	ZINC000393521781	1297669859	/nfs/dbraw/zinc/66/98/59/1297669859.db2.gz	PFVOFDVMNJKCHF-HNNXBMFYSA-N	0	3	340.261	3.366	20	30		EGEDHN
Cc1nnc(N2CCN(Cc3ccccc3)[C@H](C(C)C)C2)c(C#N)c1C	ZINC000704716454	1298206546	/nfs/dbraw/zinc/20/65/46/1298206546.db2.gz	GAIREOGLAQZONP-FQEVSTJZSA-N	0	3	349.482	3.312	20	30		EGEDHN
C=CCN(C(=O)c1ccc(N2CCN(C(C)C)CC2)cc1)C(C)C	ZINC000747123961	1298731595	/nfs/dbraw/zinc/73/15/95/1298731595.db2.gz	NRVNFEPLQKINKM-UHFFFAOYSA-N	0	3	329.488	3.254	20	30		EGEDHN
C=C(Cl)C[C@@H](N)C(=O)Nc1ccc(-c2ncc3n2CCCC3)cc1	ZINC000876730956	1298943909	/nfs/dbraw/zinc/94/39/09/1298943909.db2.gz	MOBQWCVEICGVIQ-MRXNPFEDSA-N	0	3	344.846	3.295	20	30		EGEDHN
COC(=O)c1ccccc1CC(=O)C(C#N)c1nc2ccccc2o1	ZINC000755615983	1300366637	/nfs/dbraw/zinc/36/66/37/1300366637.db2.gz	OPGQTWRPQGSJRH-CQSZACIVSA-N	0	3	334.331	3.033	20	30		EGEDHN
COc1ccc(CNC(=O)C(C#N)C(=O)[C@@H](C)CCC(C)(C)C)cc1	ZINC000755610469	1300367170	/nfs/dbraw/zinc/36/71/70/1300367170.db2.gz	OHBKCVCJFHINCV-YOEHRIQHSA-N	0	3	344.455	3.483	20	30		EGEDHN
CCCCc1ccc(NC(=O)C(C#N)C(=O)C[C@H](C)COC)cc1	ZINC000756232624	1300454498	/nfs/dbraw/zinc/45/44/98/1300454498.db2.gz	CHTVNLWLCAZCIC-YOEHRIQHSA-N	0	3	330.428	3.349	20	30		EGEDHN
C#CCCOc1ccc(CN[C@@H]2CC(=O)N(C3CCCCC3)C2)cc1	ZINC000757923641	1300757834	/nfs/dbraw/zinc/75/78/34/1300757834.db2.gz	LXAYBSCSOQNRAO-GOSISDBHSA-N	0	3	340.467	3.112	20	30		EGEDHN
CCCN(Cn1ccc(C)c(C#N)c1=O)[C@H]1CCc2ccccc2C1	ZINC000758199798	1300809556	/nfs/dbraw/zinc/80/95/56/1300809556.db2.gz	UDMJYMVBFYGIFT-IBGZPJMESA-N	0	3	335.451	3.255	20	30		EGEDHN
CCN(Cn1cccc(C#N)c1=O)[C@@H](Cc1ccc(F)cc1)C(C)C	ZINC000758231468	1300823698	/nfs/dbraw/zinc/82/36/98/1300823698.db2.gz	MZFAMTJVHFWPLL-IBGZPJMESA-N	0	3	341.430	3.406	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)c2cc(Cl)cs2)cc1	ZINC000759438641	1301092487	/nfs/dbraw/zinc/09/24/87/1301092487.db2.gz	UKOLJWFVQRPWJK-GFCCVEGCSA-N	0	3	334.784	3.371	20	30		EGEDHN
CCO[C@H](CC(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1)C(C)C	ZINC000761037276	1301384873	/nfs/dbraw/zinc/38/48/73/1301384873.db2.gz	FBEMJMJPYZMTER-GDBMZVCRSA-N	0	3	336.819	3.439	20	30		EGEDHN
C[C@@H]1C[C@H](Nc2nccc(Oc3cccc(C#N)c3)n2)CN1C1CC1	ZINC000882073739	1301815828	/nfs/dbraw/zinc/81/58/28/1301815828.db2.gz	UGQMJUQASYRHEX-HIFRSBDPSA-N	0	3	335.411	3.178	20	30		EGEDHN
C[C@@H]1CN(C[C@@H](O)COc2ccc(CC#N)cc2)Cc2ccccc21	ZINC000763628394	1301936652	/nfs/dbraw/zinc/93/66/52/1301936652.db2.gz	JHXMRATWOAJNCL-VQIMIIECSA-N	0	3	336.435	3.112	20	30		EGEDHN
CC(C)(NCc1ccc(OCC#N)cc1)C(=O)NCC1CCCCC1	ZINC000767674201	1302742674	/nfs/dbraw/zinc/74/26/74/1302742674.db2.gz	ZSEITROZKPDAOH-UHFFFAOYSA-N	0	3	343.471	3.154	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN(C)Cc2ccc3c(c2)OCCO3)cc1	ZINC000768184994	1302848935	/nfs/dbraw/zinc/84/89/35/1302848935.db2.gz	VZJBJDOBPMQIPU-HNNXBMFYSA-N	0	3	338.407	3.381	20	30		EGEDHN
C=CCc1cc(OC)cc(CN2CCC(C(=O)OC(C)C)CC2)c1O	ZINC000884476073	1302873281	/nfs/dbraw/zinc/87/32/81/1302873281.db2.gz	BSKVENXEQGQGKQ-UHFFFAOYSA-N	0	3	347.455	3.293	20	30		EGEDHN
C#CCOc1ccccc1CN1CCC[C@H](C(=O)N[C@H](C)CCC)C1	ZINC000769212502	1303072299	/nfs/dbraw/zinc/07/22/99/1303072299.db2.gz	KBVBJCSZKIPOHP-MJGOQNOKSA-N	0	3	342.483	3.215	20	30		EGEDHN
C#C[C@H](C)N(C)C[C@@H](O)CO[C@@H](c1ccccc1)c1ccc(C)cc1	ZINC000769962184	1303198947	/nfs/dbraw/zinc/19/89/47/1303198947.db2.gz	BZRYUILZZACUQG-BWAGFHJFSA-N	0	3	337.463	3.415	20	30		EGEDHN
CCCCCCN(C)CC(=O)N[C@]1(C#N)CCc2ccccc2C1	ZINC000771593235	1303424282	/nfs/dbraw/zinc/42/42/82/1303424282.db2.gz	YFBDLAUCZXDQPF-HXUWFJFHSA-N	0	3	327.472	3.066	20	30		EGEDHN
C#C[C@H](N[C@@H](C)CC(=O)Nc1ccc(C)c(Cl)c1)[C@H]1CCCO1	ZINC000775573687	1303987323	/nfs/dbraw/zinc/98/73/23/1303987323.db2.gz	JBNLBDPHCWHTEK-RRQGHBQHSA-N	0	3	334.847	3.136	20	30		EGEDHN
C#CCSCCNCc1ccc(-c2ccccc2C(=O)OC)o1	ZINC000775955533	1304068949	/nfs/dbraw/zinc/06/89/49/1304068949.db2.gz	NINBGTRUEJOUQT-UHFFFAOYSA-N	0	3	329.421	3.189	20	30		EGEDHN
CN1CCC(N(C(=O)c2cc(C#N)ccc2F)c2ccccc2)CC1	ZINC000888272474	1304093738	/nfs/dbraw/zinc/09/37/38/1304093738.db2.gz	LVXDFQDTZLOKCT-UHFFFAOYSA-N	0	3	337.398	3.438	20	30		EGEDHN
CN(C)CCN(Cc1cccs1)C(=O)Nc1cc(C#N)ccc1F	ZINC000888360866	1304131186	/nfs/dbraw/zinc/13/11/86/1304131186.db2.gz	SLQFCRAIXDLVKD-UHFFFAOYSA-N	0	3	346.431	3.355	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)Cc2ccccc2CC#N)C1	ZINC000776842256	1304209467	/nfs/dbraw/zinc/20/94/67/1304209467.db2.gz	UEOQVNHTUQKNNM-UWJYYQICSA-N	0	3	347.462	3.247	20	30		EGEDHN
C=CCNC(=O)CNCc1cc(C(C)(C)C)cc(C(C)(C)C)c1O	ZINC000776959463	1304223662	/nfs/dbraw/zinc/22/36/62/1304223662.db2.gz	ZYIJPDBQPFIFJI-UHFFFAOYSA-N	0	3	332.488	3.379	20	30		EGEDHN
N#CCc1ccccc1CC(=O)N[C@H]1CCCN(Cc2ccccc2)C1	ZINC000777301467	1304280446	/nfs/dbraw/zinc/28/04/46/1304280446.db2.gz	DTTJEAJVHYRYSA-NRFANRHFSA-N	0	3	347.462	3.076	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N1CCC[C@@H](C(=O)Nc2ccccn2)C1	ZINC000777711811	1304337904	/nfs/dbraw/zinc/33/79/04/1304337904.db2.gz	XYDGJOCIMJEIOU-CRAIPNDOSA-N	0	3	334.423	3.365	20	30		EGEDHN
C=CCN(CCc1ccco1)C[C@@H](O)c1cc(OC)ccc1OC	ZINC000778996882	1304516295	/nfs/dbraw/zinc/51/62/95/1304516295.db2.gz	VGVNAWPGKZBNCS-GOSISDBHSA-N	0	3	331.412	3.061	20	30		EGEDHN
C=CCS(=O)(=O)CCN[C@@H](CC(C)(C)C)c1ccc(F)cc1	ZINC000783531636	1305104239	/nfs/dbraw/zinc/10/42/39/1305104239.db2.gz	JTSGZXQQHGTYOY-INIZCTEOSA-N	0	3	327.465	3.493	20	30		EGEDHN
COc1ccc(CN(Cc2ccc(C#N)cc2)C2CC2)c(O)c1OC	ZINC000891596242	1305104640	/nfs/dbraw/zinc/10/46/40/1305104640.db2.gz	QBPYEHQOJITIKX-UHFFFAOYSA-N	0	3	338.407	3.446	20	30		EGEDHN
C=C[C@H]1CCCCN1C(=O)Nc1ccc(N2CCN(CC)CC2)cc1	ZINC000785642135	1305401161	/nfs/dbraw/zinc/40/11/61/1305401161.db2.gz	NWBUEVGPBGSDRD-SFHVURJKSA-N	0	3	342.487	3.401	20	30		EGEDHN
C[C@H](CC(=O)C(C#N)C(=O)NC1CCCC1)c1c[nH]c2ccccc21	ZINC000786320828	1305556509	/nfs/dbraw/zinc/55/65/09/1305556509.db2.gz	CVBKAYHTFUFKMH-CJNGLKHVSA-N	0	3	337.423	3.429	20	30		EGEDHN
N#CC(C(=O)CCCC(F)(F)F)C(=O)NCc1ccc(F)c(F)c1	ZINC000786569439	1305600532	/nfs/dbraw/zinc/60/05/32/1305600532.db2.gz	NEPYMDGRWOGFAX-JTQLQIEISA-N	0	3	348.271	3.022	20	30		EGEDHN
CCO[C@H](CC(=O)C(C#N)C(=O)N[C@H](CC)c1ccccc1)C(C)C	ZINC000787036592	1305680548	/nfs/dbraw/zinc/68/05/48/1305680548.db2.gz	PAPHBDDZPJBRHL-YQVWRLOYSA-N	0	3	344.455	3.414	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)CC[C@@H](C)SC)c1ccccc1	ZINC000787042551	1305683049	/nfs/dbraw/zinc/68/30/49/1305683049.db2.gz	WZNOFTGMCKWGJZ-KBMXLJTQSA-N	0	3	332.469	3.494	20	30		EGEDHN
C[C@H](CN1CCCCC1)NC(=O)C#Cc1ccc(C(F)(F)F)cc1	ZINC000790293167	1306291263	/nfs/dbraw/zinc/29/12/63/1306291263.db2.gz	HWLMGSDSQQOBDP-CQSZACIVSA-N	0	3	338.373	3.048	20	30		EGEDHN
CCC#C[C@@H](C)N1CCC[C@H](CNC(=O)OCc2ccccc2)C1	ZINC000796466083	1310007703	/nfs/dbraw/zinc/00/77/03/1310007703.db2.gz	PLOXRGRTJLMWKO-IEBWSBKVSA-N	0	3	328.456	3.427	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CNCc2ccc(C[S@](C)=O)cc2)cc1	ZINC000796525433	1310020835	/nfs/dbraw/zinc/02/08/35/1310020835.db2.gz	CPMWDDHCEJJBCE-OWJWWREXSA-N	0	3	342.464	3.146	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)[C@H]1CCC(F)(F)C1	ZINC000796638029	1310052367	/nfs/dbraw/zinc/05/23/67/1310052367.db2.gz	YNCDTAGUUDCDNF-RYUDHWBXSA-N	0	3	336.338	3.168	20	30		EGEDHN
N#CC(C(=O)Nc1ccccn1)C(=O)C1CC(c2ccc(F)cc2)C1	ZINC000796776905	1310084961	/nfs/dbraw/zinc/08/49/61/1310084961.db2.gz	YRAPTTYQIOZSRD-ZBCRRDGASA-N	0	3	337.354	3.062	20	30		EGEDHN
CC(C)[C@@H](C(=O)C(C#N)c1ncc(C(C)(C)C)s1)N1CCCC1=O	ZINC000797572443	1310213816	/nfs/dbraw/zinc/21/38/16/1310213816.db2.gz	ZSJVNEXQBFCMHK-WFASDCNBSA-N	0	3	347.484	3.264	20	30		EGEDHN
N#CC(C(=O)NC1CCCCC1)C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1	ZINC000798287168	1310337481	/nfs/dbraw/zinc/33/74/81/1310337481.db2.gz	CJHBHPBAKQDTIQ-BBWFWOEESA-N	0	3	328.387	3.087	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2sccc2C(F)F)C1	ZINC001023727916	1319867015	/nfs/dbraw/zinc/86/70/15/1319867015.db2.gz	WVLMFKZXLPSYGM-GFCCVEGCSA-N	0	3	326.412	3.151	20	30		EGEDHN
C#CCN(C)CCCNC(=O)N(C)Cc1cccc(Cl)c1Cl	ZINC000836486770	1320494048	/nfs/dbraw/zinc/49/40/48/1320494048.db2.gz	IDLFHMPLLLPOLQ-UHFFFAOYSA-N	0	3	342.270	3.090	20	30		EGEDHN
C[C@H](Oc1ccc(C#N)cc1)C(=O)OCCN(C)Cc1ccccc1	ZINC000837373844	1320606568	/nfs/dbraw/zinc/60/65/68/1320606568.db2.gz	ZZPUNRMKZYBHGR-INIZCTEOSA-N	0	3	338.407	3.001	20	30		EGEDHN
C#C[C@H](NCCC(=O)Nc1ccccc1-c1ccccc1)[C@H]1CCCO1	ZINC000839563275	1320938479	/nfs/dbraw/zinc/93/84/79/1320938479.db2.gz	GQLIQZMEHUUJCU-PZJWPPBQSA-N	0	3	348.446	3.453	20	30		EGEDHN
Cc1ccc(C#N)cc1C(=O)NC[C@H](c1ccccc1)N1CCCC1	ZINC000929469843	1328606867	/nfs/dbraw/zinc/60/68/67/1328606867.db2.gz	QONLBYWRHFLREO-HXUWFJFHSA-N	0	3	333.435	3.434	20	30		EGEDHN
CC(C)(C#N)c1ccccc1COC(=O)C1CCN(C2CC2)CC1	ZINC000801871502	1316959447	/nfs/dbraw/zinc/95/94/47/1316959447.db2.gz	CUJXEQALSASYLD-UHFFFAOYSA-N	0	3	326.440	3.405	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)Cc1ccc(Cl)s1	ZINC000802039400	1316976247	/nfs/dbraw/zinc/97/62/47/1316976247.db2.gz	HEZPEAXFUHCSRG-LBPRGKRZSA-N	0	3	326.849	3.349	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)C[C@H]3CC=CCC3)C2)cc1F	ZINC001019243952	1317120778	/nfs/dbraw/zinc/12/07/78/1317120778.db2.gz	MXXJNQWQEUHLHM-YJBOKZPZSA-N	0	3	341.430	3.134	20	30		EGEDHN
CCC1(C(=O)N2CC[C@H](NCc3ccc(F)c(C#N)c3)C2)CCCC1	ZINC001019587570	1317297061	/nfs/dbraw/zinc/29/70/61/1317297061.db2.gz	WDEXLOIQUUBBQC-KRWDZBQOSA-N	0	3	343.446	3.358	20	30		EGEDHN
Cc1cccc(C(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)c1C	ZINC001019727133	1317375377	/nfs/dbraw/zinc/37/53/77/1317375377.db2.gz	LAVLWCFUPUWMQI-HNNXBMFYSA-N	0	3	339.464	3.241	20	30		EGEDHN
C=C1CCC(C(=O)Nc2ccc(CN3CCC(O)CC3)cc2)CC1	ZINC000901252349	1317396984	/nfs/dbraw/zinc/39/69/84/1317396984.db2.gz	UIYZKZIFWACVOD-UHFFFAOYSA-N	0	3	328.456	3.328	20	30		EGEDHN
C#CCN(Cc1ccccc1)C(=O)NC[C@H](c1ccccc1)N(C)C	ZINC000806289178	1317477395	/nfs/dbraw/zinc/47/73/95/1317477395.db2.gz	GQZOTLYGZBGCOU-HXUWFJFHSA-N	0	3	335.451	3.134	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1F)CC1CCN(C(=O)C2CC2)CC1	ZINC000957661267	1317532659	/nfs/dbraw/zinc/53/26/59/1317532659.db2.gz	QWOZJRDIENMNTC-UHFFFAOYSA-N	0	3	343.446	3.168	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)C2(c3cccc(Cl)c3)CC2)C1	ZINC001020214410	1317596074	/nfs/dbraw/zinc/59/60/74/1317596074.db2.gz	SFJYFEOZQGXACJ-SHTZXODSSA-N	0	3	339.266	3.361	20	30		EGEDHN
COc1cc(C#N)ccc1C(=O)N(c1ccccc1)C1CCN(C)CC1	ZINC000902681482	1317605781	/nfs/dbraw/zinc/60/57/81/1317605781.db2.gz	AFVLSSKNMQCIFA-UHFFFAOYSA-N	0	3	349.434	3.308	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC(CN(CC)Cc3cc(C)no3)CC2)C1	ZINC000957751508	1317620848	/nfs/dbraw/zinc/62/08/48/1317620848.db2.gz	XOQKHNVEURKCJF-UHFFFAOYSA-N	0	3	345.487	3.400	20	30		EGEDHN
C#CCN(C(=O)Nc1ccc(N2CCN(CC)CC2)cc1C)C(C)C	ZINC000902937504	1317631803	/nfs/dbraw/zinc/63/18/03/1317631803.db2.gz	KVHUHBGWESYJLQ-UHFFFAOYSA-N	0	3	342.487	3.012	20	30		EGEDHN
C#C[C@@H](NC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C)C(C)(C)C	ZINC000808313675	1317660356	/nfs/dbraw/zinc/66/03/56/1317660356.db2.gz	ZTGLTEYVJGUFCW-IEBWSBKVSA-N	0	3	341.499	3.340	20	30		EGEDHN
C[C@@H]1CCC[C@]1(C)C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001020555982	1317769297	/nfs/dbraw/zinc/76/92/97/1317769297.db2.gz	XGFQJNNEQUEYSD-RKURPORMSA-N	0	3	343.446	3.260	20	30		EGEDHN
CC1(C)CC[C@H](C(=O)N[C@H]2C[C@H](NCc3cc(C#N)ccc3F)C2)C1	ZINC001020561861	1317773385	/nfs/dbraw/zinc/77/33/85/1317773385.db2.gz	MCMZSEFXLIXRDJ-XIRDDKMYSA-N	0	3	343.446	3.260	20	30		EGEDHN
CC1/C(=C\c2cccc(C(=O)OC(C)(C)C)c2)C(=O)c2ncnn21	ZINC000905083807	1317921655	/nfs/dbraw/zinc/92/16/55/1317921655.db2.gz	FOTVPWMCQAPCRT-ZECSTPGPSA-N	0	3	325.368	3.074	20	30		EGEDHN
CC1/C(=C\c2ccc(OCC(F)(F)F)c(F)c2)C(=O)c2ncnn21	ZINC000905087835	1317921842	/nfs/dbraw/zinc/92/18/42/1317921842.db2.gz	ZSZGGFSRTMMCET-JVVDXDAESA-N	0	3	341.264	3.199	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)[C@H]2C[C@@]2(CC)C(C)C)C1	ZINC001020853563	1317956790	/nfs/dbraw/zinc/95/67/90/1317956790.db2.gz	RUXOXTHUCJWINC-KQTLUZQSSA-N	0	3	343.309	3.204	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@@H]1CCN([C@H](C)c2ccccc2)C1	ZINC000810192179	1317972739	/nfs/dbraw/zinc/97/27/39/1317972739.db2.gz	LIGXYPDRRBSHNJ-DYESRHJHSA-N	0	3	332.447	3.162	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1	ZINC000810268360	1317990991	/nfs/dbraw/zinc/99/09/91/1317990991.db2.gz	QUIUIIOPLKTDLE-JOCHJYFZSA-N	0	3	346.474	3.472	20	30		EGEDHN
C[C@H](C(=O)N[C@H]1C[C@H](NCc2cc(C#N)ccc2F)C1)C1CCCC1	ZINC001020907418	1317993000	/nfs/dbraw/zinc/99/30/00/1317993000.db2.gz	AMAJCHROQIFEMY-KKXDTOCCSA-N	0	3	343.446	3.260	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1CCCN(Cc2ccccc2)C[C@H]1C	ZINC000810431163	1318008466	/nfs/dbraw/zinc/00/84/66/1318008466.db2.gz	MLSDRRAYUVQVLR-LJQANCHMSA-N	0	3	346.474	3.333	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)c2ccc(Cl)s2)C1	ZINC001021011134	1318043342	/nfs/dbraw/zinc/04/33/42/1318043342.db2.gz	KUOLQJVSQGYTDF-KYZUINATSA-N	0	3	349.681	3.161	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)[C@H]1CCCSC1)c1ccccc1	ZINC000810710772	1318047267	/nfs/dbraw/zinc/04/72/67/1318047267.db2.gz	VEZSPVBLUTXRFO-JYJNAYRXSA-N	0	3	330.453	3.106	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@H]2C[C@@H]2c2cc(F)ccc2F)C1	ZINC001021069880	1318067036	/nfs/dbraw/zinc/06/70/36/1318067036.db2.gz	NRGNPJKVOCTPSC-BHPKHCPMSA-N	0	3	340.801	3.058	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C[C@H]2CCCC[C@@H]2C)C1	ZINC001021119046	1318102493	/nfs/dbraw/zinc/10/24/93/1318102493.db2.gz	QYDYWDKODGLSCC-ATGSNQNLSA-N	0	3	343.309	3.348	20	30		EGEDHN
N#Cc1sccc1C(=O)NC[C@H]1CCCN1Cc1ccccc1	ZINC000906703036	1318139014	/nfs/dbraw/zinc/13/90/14/1318139014.db2.gz	IPBIUYABXWWCBS-OAHLLOKOSA-N	0	3	325.437	3.014	20	30		EGEDHN
C=C1CCC(C(=O)NC2C[C@H]3CC[C@@H](C2)N3Cc2cnoc2C)CC1	ZINC001021368766	1318214806	/nfs/dbraw/zinc/21/48/06/1318214806.db2.gz	TWAKDQVDLOIMOG-YQQQUEKLSA-N	0	3	343.471	3.341	20	30		EGEDHN
Cc1c[nH]cc1C(=O)NC1C[C@H]2CC[C@@H](C1)N2Cc1cccc(C#N)c1	ZINC001021459617	1318264098	/nfs/dbraw/zinc/26/40/98/1318264098.db2.gz	OFSDZOWYZSNOAW-YQQQUEKLSA-N	0	3	348.450	3.120	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@H](CCCN3C(=O)C3CCC3)C2)c1	ZINC001021493727	1318295324	/nfs/dbraw/zinc/29/53/24/1318295324.db2.gz	VPQDQFZGLLNOEV-UXHICEINSA-N	0	3	337.467	3.171	20	30		EGEDHN
O=C(C#CC1CC1)N1CCCC[C@H]1CNCc1ccc(F)cc1Cl	ZINC000960004184	1318308699	/nfs/dbraw/zinc/30/86/99/1318308699.db2.gz	UEWDBQCJYVADBQ-KRWDZBQOSA-N	0	3	348.849	3.363	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(C[C@@H]2CCC[C@@H](C)C2)OC)CC1	ZINC000812032958	1318313548	/nfs/dbraw/zinc/31/35/48/1318313548.db2.gz	VGUNKANRDWZQIH-IAGOWNOFSA-N	0	3	337.508	3.426	20	30		EGEDHN
C#C[C@@H](NC(=O)N[C@@H](CN1CCCCC1)c1ccccc1)C(C)C	ZINC000812045849	1318315039	/nfs/dbraw/zinc/31/50/39/1318315039.db2.gz	RSSAWZQFFPZMQS-MOPGFXCFSA-N	0	3	327.472	3.171	20	30		EGEDHN
CSc1ccc([C@@H](CNC(=O)c2ccsc2C#N)N(C)C)cc1	ZINC000908458817	1318348089	/nfs/dbraw/zinc/34/80/89/1318348089.db2.gz	YIXFHAFKFYXEDY-OAHLLOKOSA-N	0	3	345.493	3.374	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@H](CCCN3C(=O)c3ccoc3)C2)cc1	ZINC001021520372	1318349232	/nfs/dbraw/zinc/34/92/32/1318349232.db2.gz	WIVQKYQKMRKWAD-QUCCMNQESA-N	0	3	349.434	3.278	20	30		EGEDHN
CC(C)[C@H](F)C(=O)N1CCCC[C@H]1CNCc1ccc(C#N)cc1F	ZINC000960101393	1318356929	/nfs/dbraw/zinc/35/69/29/1318356929.db2.gz	OYSHIPUVRPQJEP-WMZOPIPTSA-N	0	3	349.425	3.162	20	30		EGEDHN
CN1CCN(C(=O)c2ccccc2SCC#N)CC12CCCCC2	ZINC000908576444	1318367891	/nfs/dbraw/zinc/36/78/91/1318367891.db2.gz	DTQPXOFFGONSCM-UHFFFAOYSA-N	0	3	343.496	3.393	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@@H](CCCN3C(=O)C3CC=CC3)C2)cc1	ZINC001021552030	1318392064	/nfs/dbraw/zinc/39/20/64/1318392064.db2.gz	VXHXGRATBZSSCV-LEWJYISDSA-N	0	3	349.478	3.337	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cnc2cc[nH]c2c1	ZINC000960277781	1318440982	/nfs/dbraw/zinc/44/09/82/1318440982.db2.gz	HCNWVFYYRFRFJT-WOJBJXKFSA-N	0	3	346.434	3.124	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2sc(C)cc2C)C1	ZINC001021595592	1318441780	/nfs/dbraw/zinc/44/17/80/1318441780.db2.gz	BSJFYYMZGZWIFB-SJORKVTESA-N	0	3	330.497	3.315	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc3cc(C)cn3c2)C1	ZINC001021599599	1318443124	/nfs/dbraw/zinc/44/31/24/1318443124.db2.gz	IJAGJYVBAMFXJQ-RXVVDRJESA-N	0	3	349.478	3.198	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc2[nH]ccc2n1	ZINC000960283997	1318444881	/nfs/dbraw/zinc/44/48/81/1318444881.db2.gz	SWCURFVMTWUSQL-WOJBJXKFSA-N	0	3	346.434	3.124	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc3c(o2)CCCC3)C1	ZINC001021603486	1318447252	/nfs/dbraw/zinc/44/72/52/1318447252.db2.gz	PTKUXCUNILVWET-ROUUACIJSA-N	0	3	340.467	3.108	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)Cc2cccc(CC)c2)C1	ZINC001021617598	1318466815	/nfs/dbraw/zinc/46/68/15/1318466815.db2.gz	WCRJBGAXLFUREJ-NHCUHLMSSA-N	0	3	338.495	3.128	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)CCc2ccc(C)cc2)C1	ZINC001021629543	1318483666	/nfs/dbraw/zinc/48/36/66/1318483666.db2.gz	HGRAHIPINVQUPU-NHCUHLMSSA-N	0	3	338.495	3.264	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)Cc2cccc(C)c2Cl)C1	ZINC001021633284	1318487766	/nfs/dbraw/zinc/48/77/66/1318487766.db2.gz	PVNGMTFDNUBAEL-ZWKOTPCHSA-N	0	3	344.886	3.137	20	30		EGEDHN
CCc1cccc(CC)c1NC(=O)C(C#N)C(=O)[C@H](C)[C@H](C)COC	ZINC000813060059	1318493203	/nfs/dbraw/zinc/49/32/03/1318493203.db2.gz	ONSPFYOSCYHDFQ-CKEIUWERSA-N	0	3	344.455	3.377	20	30		EGEDHN
N#Cc1ccc(OCC(=O)C(C#N)c2cc(C(F)(F)F)ccn2)cc1	ZINC000813211328	1318514775	/nfs/dbraw/zinc/51/47/75/1318514775.db2.gz	IGNCZGJGBYICKX-CQSZACIVSA-N	0	3	345.280	3.227	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(F)c(Cl)c2)C1	ZINC001021658471	1318520293	/nfs/dbraw/zinc/52/02/93/1318520293.db2.gz	NPJBKKYEVGOIEJ-YJBOKZPZSA-N	0	3	348.849	3.429	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2nccc3ccccc32)C1	ZINC001021661836	1318524908	/nfs/dbraw/zinc/52/49/08/1318524908.db2.gz	RYYHUISLLKQUIO-ICSRJNTNSA-N	0	3	347.462	3.185	20	30		EGEDHN
Cc1occc1C(=O)N1CCC[C@@H]1CN(C)Cc1ccc(C#N)cc1	ZINC000960398933	1318525127	/nfs/dbraw/zinc/52/51/27/1318525127.db2.gz	MTPRJQDTMOMJSW-GOSISDBHSA-N	0	3	337.423	3.196	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)[C@H]1CC=CCC1	ZINC000960417612	1318541206	/nfs/dbraw/zinc/54/12/06/1318541206.db2.gz	LJGZRFAWHKNGLR-VQTJNVASSA-N	0	3	337.467	3.337	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)CCc2ccccc2C)C1	ZINC001021678408	1318547474	/nfs/dbraw/zinc/54/74/74/1318547474.db2.gz	YCUBOUSNIKARNP-SFTDATJTSA-N	0	3	338.495	3.264	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2csc(C(C)C)n2)C1	ZINC001021692638	1318567009	/nfs/dbraw/zinc/56/70/09/1318567009.db2.gz	VQAGQUJVAKSUKR-DOTOQJQBSA-N	0	3	345.512	3.216	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC[C@@H]1CN(C)Cc1ccc(OCC#N)cc1	ZINC000960455043	1318578153	/nfs/dbraw/zinc/57/81/53/1318578153.db2.gz	ZSKHOHVHKZBXBD-FUHWJXTLSA-N	0	3	343.471	3.058	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc3c(C)cccn3c2)C1	ZINC001021709661	1318586280	/nfs/dbraw/zinc/58/62/80/1318586280.db2.gz	CYCHRGNFLGNNRZ-QUCCMNQESA-N	0	3	349.478	3.198	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(Cl)cc2)C1	ZINC001021720690	1318603843	/nfs/dbraw/zinc/60/38/43/1318603843.db2.gz	YQCPFUWEADVGLW-AEFFLSMTSA-N	0	3	330.859	3.290	20	30		EGEDHN
CC(C)Oc1cccc(CN(C)C[C@H]2CCCN2C(=O)[C@@H](C)C#N)c1	ZINC000960496874	1318606564	/nfs/dbraw/zinc/60/65/64/1318606564.db2.gz	UNJXLCOGGWDECU-FUHWJXTLSA-N	0	3	343.471	3.056	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)Cc2c[nH]c3ccccc23)C1	ZINC001021722506	1318609916	/nfs/dbraw/zinc/60/99/16/1318609916.db2.gz	OICMMVQHLVWDCU-UTKZUKDTSA-N	0	3	349.478	3.047	20	30		EGEDHN
COc1ccc(CN[C@@H](C)c2ccc(C(=O)N(C)C)cc2)cc1C#N	ZINC000813858948	1318644808	/nfs/dbraw/zinc/64/48/08/1318644808.db2.gz	MPUORJPYDHWXOK-AWEZNQCLSA-N	0	3	337.423	3.119	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(C)c(F)c(C)c2)C1	ZINC001021737971	1318646474	/nfs/dbraw/zinc/64/64/74/1318646474.db2.gz	XTDAEYBLAXETTF-PKOBYXMFSA-N	0	3	342.458	3.392	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cnc(C(C)(C)C)s2)C1	ZINC001021739941	1318650227	/nfs/dbraw/zinc/65/02/27/1318650227.db2.gz	PEDHEZGPYXOGMN-LSDHHAIUSA-N	0	3	345.512	3.000	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(C3CCCC3)no2)C1	ZINC001021742430	1318655707	/nfs/dbraw/zinc/65/57/07/1318655707.db2.gz	LDORJROINKAUFV-AEFFLSMTSA-N	0	3	343.471	3.445	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)[C@H]1CCC1(F)F	ZINC000960692110	1318795816	/nfs/dbraw/zinc/79/58/16/1318795816.db2.gz	HYOZREJHIQKSNA-DLBZAZTESA-N	0	3	347.409	3.026	20	30		EGEDHN
C[C@@H]1CCC[C@@H]1CC(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001022122040	1318803625	/nfs/dbraw/zinc/80/36/25/1318803625.db2.gz	OPYRCVDDEAQRDA-UWIFEVILSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1ccc(N2CCCC2=O)c(Cl)c1	ZINC000912174360	1318837065	/nfs/dbraw/zinc/83/70/65/1318837065.db2.gz	VOJPXHDUOMTXIN-CQSZACIVSA-N	0	3	335.835	3.089	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@@H]1CCCN1C(=O)[C@@H]1CCC1(C)C	ZINC000960814401	1318935034	/nfs/dbraw/zinc/93/50/34/1318935034.db2.gz	JAPNZRCDQCEVJR-OALUTQOASA-N	0	3	339.483	3.417	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)C1(C)CC=CC1	ZINC000960836370	1318968202	/nfs/dbraw/zinc/96/82/02/1318968202.db2.gz	FWOGBMWZNFKSRL-LJQANCHMSA-N	0	3	337.467	3.337	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2nc(Cl)sc2Cl)C1	ZINC001022535675	1318980434	/nfs/dbraw/zinc/98/04/34/1318980434.db2.gz	MCJVVJGQYPIFCB-KNVOCYPGSA-N	0	3	340.663	3.053	20	30		EGEDHN
CC(C)C1(C(=O)N2CCC[C@H]2CN(C)Cc2cccc(C#N)c2)CC1	ZINC000960847612	1318986430	/nfs/dbraw/zinc/98/64/30/1318986430.db2.gz	QMNONKWFMWIUMU-IBGZPJMESA-N	0	3	339.483	3.417	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@@H](NC(=O)C3CC4(CCC4)C3)C2)c(F)c1	ZINC001022567791	1318997111	/nfs/dbraw/zinc/99/71/11/1318997111.db2.gz	DDYCYYZXLWOVBE-CALCHBBNSA-N	0	3	341.430	3.014	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@@H](NC(=O)[C@@]34C[C@@H]3CCCC4)C2)c(F)c1	ZINC001022683188	1319066976	/nfs/dbraw/zinc/06/69/76/1319066976.db2.gz	XYJZXTDVRVDYSX-LJCCNALRSA-N	0	3	341.430	3.014	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)CC2CCCCCC2)C1	ZINC001022775966	1319102475	/nfs/dbraw/zinc/10/24/75/1319102475.db2.gz	QDLZFAGHGYMCJV-GASCZTMLSA-N	0	3	343.309	3.492	20	30		EGEDHN
CC(C)[C@]1(C)C[C@H]1C(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001022916659	1319167127	/nfs/dbraw/zinc/16/71/27/1319167127.db2.gz	CTJPMWKTAHKTSH-CLWJZODNSA-N	0	3	343.446	3.116	20	30		EGEDHN
CC(C)[C@]1(C)C[C@@H]1C(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001022916661	1319168592	/nfs/dbraw/zinc/16/85/92/1319168592.db2.gz	CTJPMWKTAHKTSH-YZLZLFLDSA-N	0	3	343.446	3.116	20	30		EGEDHN
CC(C)[C@]1(C)C[C@H]1C(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001022917166	1319170017	/nfs/dbraw/zinc/17/00/17/1319170017.db2.gz	QXLFELFJVALJMN-CLWJZODNSA-N	0	3	343.446	3.116	20	30		EGEDHN
C[C@@H](NC[C@H](O)CC#N)c1ccc(OCc2ccc(F)cc2)cc1	ZINC000930212449	1328813324	/nfs/dbraw/zinc/81/33/24/1328813324.db2.gz	FRAZPJZFTHWXHX-RDTXWAMCSA-N	0	3	328.387	3.330	20	30		EGEDHN
CCC(=O)N1CCC[C@H]([C@H]2CCN(Cc3ccc(C#N)s3)C2)C1	ZINC000961092663	1319203810	/nfs/dbraw/zinc/20/38/10/1319203810.db2.gz	SNRWKWCBNJHVSQ-GJZGRUSLSA-N	0	3	331.485	3.090	20	30		EGEDHN
C=C(C)C[N@@H+]1CC[C@@H]([C@@H]2CCCN(C(=O)c3ccccc3[O-])C2)C1	ZINC000961099831	1319210264	/nfs/dbraw/zinc/21/02/64/1319210264.db2.gz	ZRIYCWZSMLRAMN-IAGOWNOFSA-N	0	3	328.456	3.142	20	30		EGEDHN
C=C(C)C[N@H+]1CC[C@@H]([C@@H]2CCCN(C(=O)c3ccccc3[O-])C2)C1	ZINC000961099831	1319210274	/nfs/dbraw/zinc/21/02/74/1319210274.db2.gz	ZRIYCWZSMLRAMN-IAGOWNOFSA-N	0	3	328.456	3.142	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)C[C@@H]2CCCC[C@H]2C)C1	ZINC001023152217	1319297360	/nfs/dbraw/zinc/29/73/60/1319297360.db2.gz	QYDYWDKODGLSCC-BEAPCOKYSA-N	0	3	343.309	3.348	20	30		EGEDHN
C[C@@H](C#N)OCCN1CCC[C@@H]1Cc1ccccc1Br	ZINC000817276513	1319310106	/nfs/dbraw/zinc/31/01/06/1319310106.db2.gz	HDCBKHWTFZYROM-DZGCQCFKSA-N	0	3	337.261	3.385	20	30		EGEDHN
CC[C@H]1CCCCN1Cc1cc(=O)n2c3ccccc3[nH]c2c1C#N	ZINC000915217613	1319445624	/nfs/dbraw/zinc/44/56/24/1319445624.db2.gz	WOQAFTMRTBHPNH-HOTGVXAUSA-N	0	3	334.423	3.488	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2coc3ccc(CC)cc23)C1	ZINC001023368815	1319482522	/nfs/dbraw/zinc/48/25/22/1319482522.db2.gz	WVQLMRRWOGMCCD-QGZVFWFLSA-N	0	3	338.451	3.460	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](C2CCN(C(=O)[C@@H](C)SC)CC2)C1	ZINC000961328940	1319484403	/nfs/dbraw/zinc/48/44/03/1319484403.db2.gz	CVJHYKFPPDKRBY-GDBMZVCRSA-N	0	3	344.952	3.441	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc(C3CC3)[nH]c2C2CC2)C1	ZINC001023444530	1319541959	/nfs/dbraw/zinc/54/19/59/1319541959.db2.gz	OOZOXKUPSOMQSJ-HNNXBMFYSA-N	0	3	339.483	3.235	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1ccccc1N(C)c1ccccc1	ZINC000818593425	1319565012	/nfs/dbraw/zinc/56/50/12/1319565012.db2.gz	ZXHWSMKTDPXQNR-UHFFFAOYSA-N	0	3	335.451	3.139	20	30		EGEDHN
C=CCc1cc(CNC[C@H](O)c2ccccc2F)cc(OC)c1OC	ZINC000818989805	1319609327	/nfs/dbraw/zinc/60/93/27/1319609327.db2.gz	UEYOUUFDPHTJER-SFHVURJKSA-N	0	3	345.414	3.395	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2CCCN(Cc3cccnc3C)C2)cc1	ZINC001023527270	1319632884	/nfs/dbraw/zinc/63/28/84/1319632884.db2.gz	SCRHDLQXXAYYCH-IBGZPJMESA-N	0	3	347.462	3.013	20	30		EGEDHN
S=C(NN=C1CCCCC1)NC1CCN(Cc2ccccc2)CC1	ZINC000916307068	1319636830	/nfs/dbraw/zinc/63/68/30/1319636830.db2.gz	PKQFDDJUVMKZFB-UHFFFAOYSA-N	0	3	344.528	3.435	20	30		EGEDHN
Cc1cocc1C(=O)NC[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001023534192	1319637023	/nfs/dbraw/zinc/63/70/23/1319637023.db2.gz	JAPFLLJTVGOSPU-SFHVURJKSA-N	0	3	337.423	3.102	20	30		EGEDHN
CC1(C)CC[C@@H]1C(=O)NC[C@H]1CCCN(Cc2ccc(C#N)cc2)C1	ZINC001023537681	1319643751	/nfs/dbraw/zinc/64/37/51/1319643751.db2.gz	MPEXLWFYZPGGAC-RTBURBONSA-N	0	3	339.483	3.323	20	30		EGEDHN
Cc1coc(C(=O)NC[C@@H]2CCCN(Cc3cccc(C#N)c3)C2)c1	ZINC001023547893	1319658343	/nfs/dbraw/zinc/65/83/43/1319658343.db2.gz	YBEKTTNHIYJZSO-SFHVURJKSA-N	0	3	337.423	3.102	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)COc1ccc2ccccc2c1	ZINC000916876717	1319718746	/nfs/dbraw/zinc/71/87/46/1319718746.db2.gz	IMHYXYMALFBVAO-SFHVURJKSA-N	0	3	338.407	3.234	20	30		EGEDHN
CCOCCCC(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1Cl	ZINC000916932620	1319725809	/nfs/dbraw/zinc/72/58/09/1319725809.db2.gz	ZWCVKJGTSKGJSJ-NSHDSACASA-N	0	3	343.210	3.457	20	30		EGEDHN
Cc1coc(C)c1C(=O)NC1CC(CNCc2ccccc2C#N)C1	ZINC000961796302	1319734686	/nfs/dbraw/zinc/73/46/86/1319734686.db2.gz	CFIQSYPBMNDGTG-UHFFFAOYSA-N	0	3	337.423	3.066	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@H](CNC(=O)[C@@H]3CC34CCC4)C2)c1	ZINC001023620463	1319739195	/nfs/dbraw/zinc/73/91/95/1319739195.db2.gz	VFDWSYGNAGHUHP-MOPGFXCFSA-N	0	3	337.467	3.077	20	30		EGEDHN
C#CCN1CCC[C@H](CNC(=O)[C@@H]2C[C@H]2c2cccc3ccccc32)C1	ZINC001023652924	1319775367	/nfs/dbraw/zinc/77/53/67/1319775367.db2.gz	RJKRIVJFYVPLJW-VOQZNFBZSA-N	0	3	346.474	3.405	20	30		EGEDHN
C#CCN1CCC[C@@H](CNC(=O)c2ccc(Cl)c(CCC)c2)C1	ZINC001023697649	1319823825	/nfs/dbraw/zinc/82/38/25/1319823825.db2.gz	CWWRJVQQSUGOAQ-HNNXBMFYSA-N	0	3	332.875	3.368	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccc(CC(C)C)cc2)C1	ZINC001023740726	1319887480	/nfs/dbraw/zinc/88/74/80/1319887480.db2.gz	LPMKJGTZMBWQGI-IBGZPJMESA-N	0	3	326.484	3.350	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc(-c3ccccc3)[nH]2)C1	ZINC001023774879	1319923796	/nfs/dbraw/zinc/92/37/96/1319923796.db2.gz	QFSIDXKALSUFKD-QGZVFWFLSA-N	0	3	335.451	3.147	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2cc(C#N)ccc2F)C1	ZINC000823268943	1320167025	/nfs/dbraw/zinc/16/70/25/1320167025.db2.gz	SXNYMBHKNVHKTC-RHSMWYFYSA-N	0	3	337.398	3.263	20	30		EGEDHN
CN(C)CCN(Cc1ccccc1F)C(=O)c1cc(C#N)ccc1F	ZINC000823446012	1320179800	/nfs/dbraw/zinc/17/98/00/1320179800.db2.gz	PURPQRSOHBBKOV-UHFFFAOYSA-N	0	3	343.377	3.040	20	30		EGEDHN
Cc1ccc([C@H](CNC(=O)c2cc(C#N)ccc2F)N(C)C)cc1	ZINC000824245797	1320241656	/nfs/dbraw/zinc/24/16/56/1320241656.db2.gz	RITNOIIYLVVRHI-SFHVURJKSA-N	0	3	325.387	3.039	20	30		EGEDHN
COc1cc(CN(C)C2CC(NC(=O)OC(C)(C)C)C2)ccc1C#N	ZINC000824733470	1320282095	/nfs/dbraw/zinc/28/20/95/1320282095.db2.gz	VKOVIPCBZVIJBX-UHFFFAOYSA-N	0	3	345.443	3.054	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)C#Cc1cccs1)c1ccsc1	ZINC000825011642	1320303860	/nfs/dbraw/zinc/30/38/60/1320303860.db2.gz	QYZZDXATUHTKAP-INIZCTEOSA-N	0	3	332.494	3.360	20	30		EGEDHN
CC(C)(CC#N)CNC(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000840844999	1321161920	/nfs/dbraw/zinc/16/19/20/1321161920.db2.gz	KNUSGANDICCNGW-UHFFFAOYSA-N	0	3	344.528	3.055	20	30		EGEDHN
C[C@@H]1[C@@H](C)[C@H](C)CN1CC(=O)C(C#N)c1nc2ccccc2s1	ZINC000842166252	1321356673	/nfs/dbraw/zinc/35/66/73/1321356673.db2.gz	JVWBDPYOHFJDFU-RQJABVFESA-N	0	3	327.453	3.449	20	30		EGEDHN
CC[N@H+](CCC/N=C/c1c([O-])c(C)ncc1CO)C1CCCCC1	ZINC000844272078	1321583532	/nfs/dbraw/zinc/58/35/32/1321583532.db2.gz	UNQJCIBTVRKVND-DEDYPNTBSA-N	0	3	333.476	3.052	20	30		EGEDHN
CC[N@@H+](CCC/N=C/c1c([O-])c(C)ncc1CO)C1CCCCC1	ZINC000844272078	1321583537	/nfs/dbraw/zinc/58/35/37/1321583537.db2.gz	UNQJCIBTVRKVND-DEDYPNTBSA-N	0	3	333.476	3.052	20	30		EGEDHN
C#Cc1cccc(N(C)C(=O)C(C[C@H]2CCCO2)C(F)(F)F)c1	ZINC000844375921	1321595797	/nfs/dbraw/zinc/59/57/97/1321595797.db2.gz	NVBUFEJUVWJZGS-HUUCEWRRSA-N	0	3	325.330	3.378	20	30		EGEDHN
CCc1cccc(CC)c1NC(=O)C(C#N)C(=O)C[C@H]1CCCO1	ZINC000845441028	1321707436	/nfs/dbraw/zinc/70/74/36/1321707436.db2.gz	BHDHCZJNLLJMER-HZPDHXFCSA-N	0	3	328.412	3.028	20	30		EGEDHN
CCC[C@H](OC)C(=O)OCC1(C#N)CCN(Cc2ccccc2)CC1	ZINC000847747081	1321900211	/nfs/dbraw/zinc/90/02/11/1321900211.db2.gz	XARLIVIPEVSRRX-SFHVURJKSA-N	0	3	344.455	3.151	20	30		EGEDHN
C#CCN(CC)C[C@@H](O)CO[C@@H](c1ccccc1)c1ccc(C)cc1	ZINC000920096490	1322137021	/nfs/dbraw/zinc/13/70/21/1322137021.db2.gz	XVTXPPWWDLGKFT-YADHBBJMSA-N	0	3	337.463	3.417	20	30		EGEDHN
C[C@H](NCc1ccc(N2CCC(O)CC2)cc1)c1cccc(C#N)c1	ZINC000850567451	1322270116	/nfs/dbraw/zinc/27/01/16/1322270116.db2.gz	CIRNXYKFTLBNOF-INIZCTEOSA-N	0	3	335.451	3.370	20	30		EGEDHN
CCOC(=O)c1c[nH]nc1[C@@H]1CCN([C@H](C)c2ccc(C#N)cc2)C1	ZINC000931010900	1329027805	/nfs/dbraw/zinc/02/78/05/1329027805.db2.gz	REPCKCOTIRQSAR-CZUORRHYSA-N	0	3	338.411	3.009	20	30		EGEDHN
CC1(C(=O)N2CCC[C@@H](CNCc3ccccc3C#N)C2)CCC1	ZINC001024098118	1323129396	/nfs/dbraw/zinc/12/93/96/1323129396.db2.gz	ZQUIJMPMSIBALT-INIZCTEOSA-N	0	3	325.456	3.077	20	30		EGEDHN
C#C[C@@](C)(CC)N[C@@H](C)C(=O)N(C)Cc1nc2ccccc2s1	ZINC000852101354	1323147353	/nfs/dbraw/zinc/14/73/53/1323147353.db2.gz	PKKGVTHNEWKHPU-UGSOOPFHSA-N	0	3	329.469	3.035	20	30		EGEDHN
C[C@@H](CC(C)(C)C#N)NCc1cccc(NC(=O)[C@@H]2CCCO2)c1	ZINC000924778562	1323159329	/nfs/dbraw/zinc/15/93/29/1323159329.db2.gz	UYIZOMFJGMPJQS-YOEHRIQHSA-N	0	3	329.444	3.222	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H](CNCc2nc(C)cs2)C1	ZINC001024135095	1323160149	/nfs/dbraw/zinc/16/01/49/1323160149.db2.gz	IUNYGRILVPKISH-CRAIPNDOSA-N	0	3	335.517	3.382	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCC[C@@H](CNCc2ccccc2C#N)C1	ZINC001024186259	1323197176	/nfs/dbraw/zinc/19/71/76/1323197176.db2.gz	OCYXAJMFWPGGOT-IRXDYDNUSA-N	0	3	327.472	3.179	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CCC[C@@H](CNCc2ccccc2C#N)C1	ZINC001024186260	1323197654	/nfs/dbraw/zinc/19/76/54/1323197654.db2.gz	OCYXAJMFWPGGOT-SJORKVTESA-N	0	3	327.472	3.179	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@@H]1CCCN(C(=O)c2ccncc2)C1	ZINC000963242988	1323249320	/nfs/dbraw/zinc/24/93/20/1323249320.db2.gz	HIPWRKSWWMBLML-IAGOWNOFSA-N	0	3	333.863	3.151	20	30		EGEDHN
C=CCC[N@H+]1CCC[C@H]1[C@H]1CCCN(C(=O)c2ccccc2[O-])C1	ZINC000963252458	1323263121	/nfs/dbraw/zinc/26/31/21/1323263121.db2.gz	WBWMSUNDVPHEGL-WMZOPIPTSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=CCC[N@@H+]1CCC[C@H]1[C@H]1CCCN(C(=O)c2ccccc2[O-])C1	ZINC000963252458	1323263126	/nfs/dbraw/zinc/26/31/26/1323263126.db2.gz	WBWMSUNDVPHEGL-WMZOPIPTSA-N	0	3	328.456	3.285	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)c2ccccc2O)C1	ZINC000963252413	1323263270	/nfs/dbraw/zinc/26/32/70/1323263270.db2.gz	VJJYMBHVEMIEKW-RDJZCZTQSA-N	0	3	348.874	3.461	20	30		EGEDHN
C=CCCN1CCCC[C@@H]1CNC(=O)c1oc(CC2CC2)nc1C	ZINC001024437833	1323398723	/nfs/dbraw/zinc/39/87/23/1323398723.db2.gz	BHBBIOJTQWLILM-MRXNPFEDSA-N	0	3	331.460	3.096	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)[C@@H]1CCCC[C@H]1C(F)(F)F	ZINC001024487606	1323439668	/nfs/dbraw/zinc/43/96/68/1323439668.db2.gz	QMURYIOERSPLEX-BZUAXINKSA-N	0	3	344.421	3.349	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1c(C)c(F)ccc1Cl	ZINC001024515622	1323465912	/nfs/dbraw/zinc/46/59/12/1323465912.db2.gz	XIVZUUXOSOQEII-CQSZACIVSA-N	0	3	336.838	3.395	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1cc2c([nH]1)c(F)ccc2C	ZINC001024517039	1323467454	/nfs/dbraw/zinc/46/74/54/1323467454.db2.gz	QHLHXEHOWXEETJ-HNNXBMFYSA-N	0	3	341.430	3.223	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccc(C)nc1C(C)C	ZINC001024578972	1323515915	/nfs/dbraw/zinc/51/59/15/1323515915.db2.gz	CNNRNJVMCQGDND-KRWDZBQOSA-N	0	3	327.472	3.121	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cc(Cl)c(Cl)[nH]1	ZINC001024578212	1323515956	/nfs/dbraw/zinc/51/59/56/1323515956.db2.gz	NZIPYXFUVVMYLH-LLVKDONJSA-N	0	3	330.259	3.482	20	30		EGEDHN
C=CCCN1CCCC[C@@H]1CNC(=O)c1cc(Br)co1	ZINC001024691654	1323607823	/nfs/dbraw/zinc/60/78/23/1323607823.db2.gz	YQMCNPAQXARYNS-CYBMUJFWSA-N	0	3	341.249	3.203	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccc(C(C)C)[nH]c1=O	ZINC001024692881	1323609107	/nfs/dbraw/zinc/60/91/07/1323609107.db2.gz	SQTUGFBQKVWCGI-HNNXBMFYSA-N	0	3	331.460	3.071	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cccc2c1ccn2C	ZINC001024712430	1323621140	/nfs/dbraw/zinc/62/11/40/1323621140.db2.gz	XMTWKKHVIAZYGA-INIZCTEOSA-N	0	3	325.456	3.339	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cnn(CC2CCCC2)c1	ZINC001024732313	1323633551	/nfs/dbraw/zinc/63/35/51/1323633551.db2.gz	SWJKFPDBPHWMHW-IBGZPJMESA-N	0	3	344.503	3.234	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1[nH]c2ccc(C)cc2c1C	ZINC001024741306	1323641849	/nfs/dbraw/zinc/64/18/49/1323641849.db2.gz	ZQHZXKGIFMOZFH-KRWDZBQOSA-N	0	3	337.467	3.392	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cccc(NC(C)=O)c1C	ZINC001024756385	1323655986	/nfs/dbraw/zinc/65/59/86/1323655986.db2.gz	QVBSNHXPBBPYNZ-KRWDZBQOSA-N	0	3	343.471	3.114	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCCCN2Cc2ccccc2C)cn1	ZINC001024769513	1323669356	/nfs/dbraw/zinc/66/93/56/1323669356.db2.gz	IJMKIRWMSHAVPO-OAQYLSRUSA-N	0	3	347.462	3.156	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1csc2c1CC[C@@H](C)C2	ZINC001024787181	1323691995	/nfs/dbraw/zinc/69/19/95/1323691995.db2.gz	ZAUFXSRXYYMYRX-HZPDHXFCSA-N	0	3	344.524	3.481	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cc(-c2ccc(C)o2)n[nH]1	ZINC001024798292	1323701857	/nfs/dbraw/zinc/70/18/57/1323701857.db2.gz	WDZRKBVLDBKBME-HNNXBMFYSA-N	0	3	342.443	3.139	20	30		EGEDHN
C=CCCN1CCCC[C@@H]1CNC(=O)c1cc(C2CCCC2)no1	ZINC001024807210	1323711150	/nfs/dbraw/zinc/71/11/50/1323711150.db2.gz	RFKMZDZAJCGVSO-MRXNPFEDSA-N	0	3	331.460	3.493	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCCC[C@@H]1CNCc1cc(C#N)ccc1OC	ZINC001024875530	1323761382	/nfs/dbraw/zinc/76/13/82/1323761382.db2.gz	YZMWMZIMEDXTFZ-CRAIPNDOSA-N	0	3	343.471	3.084	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)s1	ZINC001024932295	1323790455	/nfs/dbraw/zinc/79/04/55/1323790455.db2.gz	SJNYTSLOOFGPDA-CZUORRHYSA-N	0	3	331.485	3.137	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCCC[C@@H]1CNCc1cncc(C)c1	ZINC001025069878	1323871462	/nfs/dbraw/zinc/87/14/62/1323871462.db2.gz	RHIDTQXBBVJYMW-UYAOXDASSA-N	0	3	329.488	3.463	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCCC[C@H]2CNCc2c(C)noc2C)C1	ZINC001025074590	1323876942	/nfs/dbraw/zinc/87/69/42/1323876942.db2.gz	QAGXAKGDLGLXEN-INIZCTEOSA-N	0	3	331.460	3.118	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@H]2[C@H]2CCCCN2C(=O)C2CC2)c1	ZINC001025183153	1323952104	/nfs/dbraw/zinc/95/21/04/1323952104.db2.gz	JEFNBYPVCCFTKW-VQTJNVASSA-N	0	3	337.467	3.314	20	30		EGEDHN
CCC(=O)N1CCCC[C@@H]1[C@H]1CCCN1Cc1ccc(C#N)s1	ZINC001025186461	1323960115	/nfs/dbraw/zinc/96/01/15/1323960115.db2.gz	XDHXPZBFWQDHFD-IAGOWNOFSA-N	0	3	331.485	3.375	20	30		EGEDHN
N#Cc1ccc(C(=O)N2CCCC[C@@H]2[C@H]2CCCN2C/C=C\Cl)[nH]1	ZINC001025225072	1324013204	/nfs/dbraw/zinc/01/32/04/1324013204.db2.gz	YBCVKCDWVCTNHE-JNZXNGNHSA-N	0	3	346.862	3.098	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)CCc1ccsc1	ZINC001025239356	1324031622	/nfs/dbraw/zinc/03/16/22/1324031622.db2.gz	DLXKJDZMZPRKKF-MSOLQXFVSA-N	0	3	330.497	3.159	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)CC1CC(F)(F)C1	ZINC001025243186	1324039395	/nfs/dbraw/zinc/03/93/95/1324039395.db2.gz	AOUDWOVAGUCYIT-IAGOWNOFSA-N	0	3	338.442	3.291	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cccc2cccnc21	ZINC001025247522	1324047103	/nfs/dbraw/zinc/04/71/03/1324047103.db2.gz	LRKMSUZGXXKYCK-WOJBJXKFSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc2ccsc2[nH]1	ZINC001025256690	1324064788	/nfs/dbraw/zinc/06/47/88/1324064788.db2.gz	ZIOPPCIZRKOUQL-IRXDYDNUSA-N	0	3	341.480	3.322	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccc2[nH]ccc2c1	ZINC001025263806	1324074783	/nfs/dbraw/zinc/07/47/83/1324074783.db2.gz	RNBSTHUNLHNOIZ-UXHICEINSA-N	0	3	335.451	3.260	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)C(C)(C)C(F)F	ZINC001025268503	1324079924	/nfs/dbraw/zinc/07/99/24/1324079924.db2.gz	BUSKUVGVOLFENV-HUUCEWRRSA-N	0	3	326.431	3.147	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc(C)cc1F	ZINC001025274304	1324091557	/nfs/dbraw/zinc/09/15/57/1324091557.db2.gz	WLJRETMWNNMXCI-RTBURBONSA-N	0	3	328.431	3.226	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ncoc1C(C)C	ZINC001025283946	1324104590	/nfs/dbraw/zinc/10/45/90/1324104590.db2.gz	CUIBBLTWCUAVQZ-CVEARBPZSA-N	0	3	331.460	3.443	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cccc2ccncc21	ZINC001025287501	1324109096	/nfs/dbraw/zinc/10/90/96/1324109096.db2.gz	OLKYZPVEDHRJOM-NHCUHLMSSA-N	0	3	347.462	3.327	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1oc(CC)nc1C	ZINC001025287540	1324110277	/nfs/dbraw/zinc/11/02/77/1324110277.db2.gz	OOTFDHFXTLCXHO-CVEARBPZSA-N	0	3	331.460	3.191	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1nc(C)c(C)s1	ZINC001025295032	1324125096	/nfs/dbraw/zinc/12/50/96/1324125096.db2.gz	NQTJUCZLCQRGLS-CVEARBPZSA-N	0	3	333.501	3.405	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(F)cc(F)c1	ZINC001025296794	1324127549	/nfs/dbraw/zinc/12/75/49/1324127549.db2.gz	LLMWGYUTZGAQFZ-ROUUACIJSA-N	0	3	332.394	3.057	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(Cl)cn1CC	ZINC001025297525	1324130640	/nfs/dbraw/zinc/13/06/40/1324130640.db2.gz	YFVAGOQJFXGRTF-IRXDYDNUSA-N	0	3	347.890	3.254	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cccnc1OCC	ZINC001025298272	1324132057	/nfs/dbraw/zinc/13/20/57/1324132057.db2.gz	VSBNKKNVUWVAPA-QZTJIDSGSA-N	0	3	343.471	3.125	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1c(C)nsc1C	ZINC001025300091	1324132580	/nfs/dbraw/zinc/13/25/80/1324132580.db2.gz	BGGVUPOQHOAIPI-DLBZAZTESA-N	0	3	345.512	3.242	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc(CF)cc1	ZINC001025305731	1324140198	/nfs/dbraw/zinc/14/01/98/1324140198.db2.gz	ZNRHAKTYCGMNEJ-RTBURBONSA-N	0	3	328.431	3.248	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cscc2C(F)F)C1	ZINC001025424558	1324258444	/nfs/dbraw/zinc/25/84/44/1324258444.db2.gz	FMBURRXROIXCKZ-RYUDHWBXSA-N	0	3	326.412	3.149	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2nsc3ccccc32)C1	ZINC001025429088	1324264583	/nfs/dbraw/zinc/26/45/83/1324264583.db2.gz	RMYBTPHPJCMKNK-GJZGRUSLSA-N	0	3	341.480	3.150	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(CC(C)C)s2)C1	ZINC001025441688	1324281533	/nfs/dbraw/zinc/28/15/33/1324281533.db2.gz	GVXRWRUDZXBYQD-JKSUJKDBSA-N	0	3	332.513	3.410	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2oc3c(cccc3F)c2C)C1	ZINC001025441582	1324281822	/nfs/dbraw/zinc/28/18/22/1324281822.db2.gz	FUFTZGFWGCYHLB-CABCVRRESA-N	0	3	342.414	3.344	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccnn2C(CC)CC)C1	ZINC001025443913	1324285808	/nfs/dbraw/zinc/28/58/08/1324285808.db2.gz	VKUYQIMUCAVQPI-SJORKVTESA-N	0	3	344.503	3.098	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2nc(C(C)(C)C)cs2)C1	ZINC001025445369	1324286420	/nfs/dbraw/zinc/28/64/20/1324286420.db2.gz	LWRSCXBSJAKUFJ-HUUCEWRRSA-N	0	3	347.528	3.294	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc3cc(C)ccc3n2)C1	ZINC001025477850	1324322081	/nfs/dbraw/zinc/32/20/81/1324322081.db2.gz	JPSJHSQESZWFRO-SJLPKXTDSA-N	0	3	335.451	3.007	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cnc3ccccc3c2C)C1	ZINC001025489387	1324340953	/nfs/dbraw/zinc/34/09/53/1324340953.db2.gz	OZDRHLBZXKJONR-IAGOWNOFSA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(C)c3cccnc23)C1	ZINC001025491597	1324341791	/nfs/dbraw/zinc/34/17/91/1324341791.db2.gz	ZLKSHVYTHHEIDM-ZWKOTPCHSA-N	0	3	349.478	3.397	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc3cc(Cl)ccc3[nH]2)C1	ZINC001025501706	1324349779	/nfs/dbraw/zinc/34/97/79/1324349779.db2.gz	JKECVWLQGYDOFN-KGLIPLIRSA-N	0	3	343.858	3.285	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(F)c(Cl)c2F)C1	ZINC001025524135	1324370116	/nfs/dbraw/zinc/37/01/16/1324370116.db2.gz	SKKUXYIWRKFCSA-VXGBXAGGSA-N	0	3	340.801	3.082	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(C(F)F)c(F)c2)C1	ZINC001025527893	1324373682	/nfs/dbraw/zinc/37/36/82/1324373682.db2.gz	NIIPDCJSHBYMBT-JSGCOSHPSA-N	0	3	338.373	3.227	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc[nH]c2C2CCC2)C1	ZINC001025536903	1324382886	/nfs/dbraw/zinc/38/28/86/1324382886.db2.gz	YTAWDYOGCCDVOH-WBVHZDCISA-N	0	3	327.472	3.136	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(F)c3ccccc23)C1	ZINC001025538469	1324384917	/nfs/dbraw/zinc/38/49/17/1324384917.db2.gz	GOZCCNUHWHOKBE-HZPDHXFCSA-N	0	3	338.426	3.442	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(F)cc(Cl)c2)C1	ZINC001025539556	1324386017	/nfs/dbraw/zinc/38/60/17/1324386017.db2.gz	OYQREFWYVQCQAP-ZIAGYGMSSA-N	0	3	336.838	3.333	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(-c3ccccc3)o2)C1	ZINC001025539881	1324387651	/nfs/dbraw/zinc/38/76/51/1324387651.db2.gz	QOXDWHDOVCZLBY-WMZOPIPTSA-N	0	3	336.435	3.410	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cnc3ccccc3c2)C1	ZINC001025543024	1324390600	/nfs/dbraw/zinc/39/06/00/1324390600.db2.gz	GIWTWXDXJCWMBT-WMZOPIPTSA-N	0	3	335.451	3.088	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(C)c(F)c2F)C1	ZINC001025544548	1324392061	/nfs/dbraw/zinc/39/20/61/1324392061.db2.gz	XAZSKBJPWGNGHM-LSDHHAIUSA-N	0	3	334.410	3.127	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(OCC)c(C)c2)C1	ZINC001025549218	1324397887	/nfs/dbraw/zinc/39/78/87/1324397887.db2.gz	MLTBUXIRPFNUFZ-PKOBYXMFSA-N	0	3	342.483	3.247	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc3nc(C)ccc3c2)C1	ZINC001025564054	1324410100	/nfs/dbraw/zinc/41/01/00/1324410100.db2.gz	GZQLKIOHVOBKGP-YLJYHZDGSA-N	0	3	349.478	3.397	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(-c3ccco3)s2)C1	ZINC001025582225	1324423502	/nfs/dbraw/zinc/42/35/02/1324423502.db2.gz	PZXRQUMQNYSUHK-HUUCEWRRSA-N	0	3	342.464	3.472	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc3cnccc3c2)C1	ZINC001025587759	1324431056	/nfs/dbraw/zinc/43/10/56/1324431056.db2.gz	PNIYCJNDVVTYNU-OXQOHEQNSA-N	0	3	335.451	3.088	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(CC(C)C)c[nH]2)C1	ZINC001025597246	1324445590	/nfs/dbraw/zinc/44/55/90/1324445590.db2.gz	OXRDIVUVTXJLLB-SJLPKXTDSA-N	0	3	329.488	3.067	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(Cl)cc2Cl)C1	ZINC001025608901	1324459681	/nfs/dbraw/zinc/45/96/81/1324459681.db2.gz	MIUKBRRLXRQJLU-QWHCGFSZSA-N	0	3	339.266	3.457	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(Cl)ccc2Cl)C1	ZINC001025610089	1324461509	/nfs/dbraw/zinc/46/15/09/1324461509.db2.gz	RIVKXCFYNZUWBX-QWHCGFSZSA-N	0	3	339.266	3.457	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc3c(c2)CCCC3)C1	ZINC001025611652	1324464349	/nfs/dbraw/zinc/46/43/49/1324464349.db2.gz	NQJVHACSDSDHAO-UTKZUKDTSA-N	0	3	338.495	3.419	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2csc3c2CCCC3)C1	ZINC001025612360	1324464484	/nfs/dbraw/zinc/46/44/84/1324464484.db2.gz	STPOCIPCHXMOLJ-CABCVRRESA-N	0	3	330.497	3.090	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(CCC)c(C)s2)C1	ZINC001025614183	1324466428	/nfs/dbraw/zinc/46/64/28/1324466428.db2.gz	HRNXCZJTCWMDOP-YOEHRIQHSA-N	0	3	332.513	3.473	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc(CCC)c(C)s2)C1	ZINC001025614180	1324466653	/nfs/dbraw/zinc/46/66/53/1324466653.db2.gz	HRNXCZJTCWMDOP-PBHICJAKSA-N	0	3	332.513	3.473	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cccc(OCC(C)C)c2)C1	ZINC001025615596	1324469823	/nfs/dbraw/zinc/46/98/23/1324469823.db2.gz	WNKDEROBPAPDGW-MJGOQNOKSA-N	0	3	342.483	3.185	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2coc(C3CCCCC3)n2)C1	ZINC001025633020	1324484428	/nfs/dbraw/zinc/48/44/28/1324484428.db2.gz	RSHMTSMFYRUACT-RDJZCZTQSA-N	0	3	343.471	3.186	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(C(F)(F)F)s2)C1	ZINC001025635560	1324487621	/nfs/dbraw/zinc/48/76/21/1324487621.db2.gz	RWPTUJYGFYRIED-RYUDHWBXSA-N	0	3	344.402	3.230	20	30		EGEDHN
CC1(CC(=O)N2C[C@@H]3CC[C@@H](NCc4ccccc4C#N)[C@@H]3C2)CC1	ZINC001026317969	1324721829	/nfs/dbraw/zinc/72/18/29/1324721829.db2.gz	QWMCHKQRRVOLFM-IPMKNSEASA-N	0	3	337.467	3.075	20	30		EGEDHN
Cc1coc(C(=O)N2C[C@@H]3CC[C@H](NCc4ccccc4C#N)[C@@H]3C2)c1	ZINC001026334642	1324734530	/nfs/dbraw/zinc/73/45/30/1324734530.db2.gz	LSNYPDMHBMKTPK-OTWHNJEPSA-N	0	3	349.434	3.100	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H]3CC[C@H](NCc4nocc4C)[C@H]3C2)CC1	ZINC001026348671	1324744019	/nfs/dbraw/zinc/74/40/19/1324744019.db2.gz	PQCDQCCIAVOVAZ-BZSNNMDCSA-N	0	3	343.471	3.056	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)NC1CCC(NCc2ccccc2C#N)CC1	ZINC001026563215	1324897644	/nfs/dbraw/zinc/89/76/44/1324897644.db2.gz	LJUJWPQQJSUOPU-YOODTLSXSA-N	0	3	325.456	3.121	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)c2[nH]ccc2C2CC2)C1	ZINC001026882241	1325061468	/nfs/dbraw/zinc/06/14/68/1325061468.db2.gz	YBBJQRPPUNRELG-HNNXBMFYSA-N	0	3	348.450	3.016	20	30		EGEDHN
CC(C)(C(=O)N1CC[C@@H](CNCc2ccccc2C#N)C1)C1CCC1	ZINC001026975469	1325118666	/nfs/dbraw/zinc/11/86/66/1325118666.db2.gz	ZUHQMIAFWPASHW-INIZCTEOSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](CNCc2oc(CCC)nc2C)C1	ZINC001026994918	1325132586	/nfs/dbraw/zinc/13/25/86/1325132586.db2.gz	ZYAXTSIYJPOWPD-HNNXBMFYSA-N	0	3	333.476	3.086	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)C[C@H]2CC=CCC2)C1	ZINC001026999313	1325137067	/nfs/dbraw/zinc/13/70/67/1325137067.db2.gz	SPANAYIIGQQQKZ-ROUUACIJSA-N	0	3	337.467	3.243	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)c2cc[nH]c2C2CC2)C1	ZINC001027024997	1325161267	/nfs/dbraw/zinc/16/12/67/1325161267.db2.gz	UDKUAAJVCDZQLG-HNNXBMFYSA-N	0	3	348.450	3.016	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H](CNCc2oc(CC)nc2C)C1	ZINC001027038046	1325172138	/nfs/dbraw/zinc/17/21/38/1325172138.db2.gz	GUXYEPDPYMNLMX-BEFAXECRSA-N	0	3	333.476	3.086	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](CNCc2csc(CC)n2)C1	ZINC001027040364	1325174833	/nfs/dbraw/zinc/17/48/33/1325174833.db2.gz	AMJOGKBEVAAXGF-KBXCAEBGSA-N	0	3	335.517	3.246	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](CNCc3nc(C)sc3C)C2)C1	ZINC001027051335	1325190470	/nfs/dbraw/zinc/19/04/70/1325190470.db2.gz	XOSPTDGOOOPABJ-OAHLLOKOSA-N	0	3	333.501	3.054	20	30		EGEDHN
C=Cc1ccc(C(=O)N2CC[C@@H](CNCc3ccccc3C#N)C2)cc1	ZINC001027083395	1325208276	/nfs/dbraw/zinc/20/82/76/1325208276.db2.gz	HOLOIAMPQOUJEB-SFHVURJKSA-N	0	3	345.446	3.453	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@@H](CNCc2ccccc2C#N)C1)C1CCCC1	ZINC001027163692	1325265073	/nfs/dbraw/zinc/26/50/73/1325265073.db2.gz	IDPXDTFLOQTHHD-IRXDYDNUSA-N	0	3	339.483	3.323	20	30		EGEDHN
N#Cc1ccccc1CNC1CC2(C1)CC(NC(=O)[C@@H]1CC=CCC1)C2	ZINC000963544695	1325307191	/nfs/dbraw/zinc/30/71/91/1325307191.db2.gz	MYJSILFOESXEES-UDNPVYIMSA-N	0	3	349.478	3.432	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@@H](N(C)Cc2ccc(F)c(C#N)c2)C1	ZINC001027276907	1325391577	/nfs/dbraw/zinc/39/15/77/1325391577.db2.gz	RTXMLMPWXMBVEK-QGZVFWFLSA-N	0	3	331.435	3.166	20	30		EGEDHN
CN(Cc1ccc(F)c(C#N)c1)[C@@H]1CCCN(C(=O)/C=C/C2CC2)C1	ZINC001027340919	1325500266	/nfs/dbraw/zinc/50/02/66/1325500266.db2.gz	GTWMTUZCKIHCHM-PDFOZTTASA-N	0	3	341.430	3.086	20	30		EGEDHN
CN(Cc1ccc(F)c(C#N)c1)[C@H]1CCCN(C(=O)C2CC=CC2)C1	ZINC001027344700	1325506406	/nfs/dbraw/zinc/50/64/06/1325506406.db2.gz	AVVYCTAQOPTFMC-SFHVURJKSA-N	0	3	341.430	3.086	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)[C@H]2[C@@H]3CCC[C@@H]32)C1	ZINC001027354108	1325527454	/nfs/dbraw/zinc/52/74/54/1325527454.db2.gz	XSQDNZRAVIDPQD-VNTMZGSJSA-N	0	3	337.467	3.027	20	30		EGEDHN
CN(Cc1ccc(F)c(C#N)c1)[C@@H]1CCCN(C(=O)C=C2CCC2)C1	ZINC001027364295	1325552674	/nfs/dbraw/zinc/55/26/74/1325552674.db2.gz	XSDMUAQQNBDZID-GOSISDBHSA-N	0	3	341.430	3.230	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)C[C@@H](C)c2ccco2)c1	ZINC000860468180	1329320872	/nfs/dbraw/zinc/32/08/72/1329320872.db2.gz	IPQWCZNDKYBLHD-IUODEOHRSA-N	0	3	326.352	3.129	20	30		EGEDHN
CCO[C@@H](C(=O)C(C#N)C(=O)Nc1cccc2ccccc21)C1CC1	ZINC000860469314	1329321043	/nfs/dbraw/zinc/32/10/43/1329321043.db2.gz	HWANWEHWIUZEBP-QFBILLFUSA-N	0	3	336.391	3.302	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)c2sc3ccccc3c2C)C1	ZINC001027483167	1327739398	/nfs/dbraw/zinc/73/93/98/1327739398.db2.gz	MIWLCPSGZAPCOU-HNNXBMFYSA-N	0	3	326.465	3.379	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)[C@]23C[C@H]2CCC3)C1	ZINC001027499981	1327762739	/nfs/dbraw/zinc/76/27/39/1327762739.db2.gz	RZHWVTJCUGMBKV-SVFBPWRDSA-N	0	3	337.467	3.171	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC[C@@H](N(C)Cc3ccsc3)C2)cc1	ZINC001027516359	1327787466	/nfs/dbraw/zinc/78/74/66/1327787466.db2.gz	DCCWVGMFLOVMEB-LJQANCHMSA-N	0	3	338.476	3.466	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H](N(C)Cc2cccc(C#N)c2)C1)C(C)(F)F	ZINC001027580525	1327917216	/nfs/dbraw/zinc/91/72/16/1327917216.db2.gz	XGTVRWZNGUXTAM-YOEHRIQHSA-N	0	3	349.425	3.272	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)[C@H](C)Cc2ccccc2Cl)C1	ZINC001027598788	1327950757	/nfs/dbraw/zinc/95/07/57/1327950757.db2.gz	USGJSWFZVVOJGZ-WBVHZDCISA-N	0	3	332.875	3.075	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001027604533	1327959612	/nfs/dbraw/zinc/95/96/12/1327959612.db2.gz	RJCILPZOGJHTGT-LPHOPBHVSA-N	0	3	327.472	3.273	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@]2(CCN(C[C@H](F)CC)C2)C1	ZINC001041320549	1345701633	/nfs/dbraw/zinc/70/16/33/1345701633.db2.gz	CYMMHDLPENPJOK-RHSMWYFYSA-N	0	3	330.875	3.438	20	30		EGEDHN
CN(Cc1ccc(F)c(C#N)c1)[C@H]1CCCN(C(=O)C(C)(C)C)C1	ZINC001027658075	1328042429	/nfs/dbraw/zinc/04/24/29/1328042429.db2.gz	CUWKCXBKJJEKEZ-INIZCTEOSA-N	0	3	331.435	3.166	20	30		EGEDHN
C#CCN(C)[C@H]1CCCN(C(=O)c2c(Cl)cccc2Cl)C1	ZINC001027661016	1328048934	/nfs/dbraw/zinc/04/89/34/1328048934.db2.gz	YJXZWEITNANNIH-LBPRGKRZSA-N	0	3	325.239	3.163	20	30		EGEDHN
C=CCN1CCC[C@@H]1CNC(=O)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC001027885029	1328350886	/nfs/dbraw/zinc/35/08/86/1328350886.db2.gz	WQKZPGRCIOJOMB-NCOXYXGASA-N	0	3	344.421	3.368	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccccc2C(C)(C)C)C1	ZINC000966892685	1328458672	/nfs/dbraw/zinc/45/86/72/1328458672.db2.gz	PSFBLOLUOPRDRT-VQIMIIECSA-N	0	3	326.484	3.448	20	30		EGEDHN
CN(C)CCN(Cc1cccs1)C(=O)Nc1sccc1C#N	ZINC000931844354	1329765847	/nfs/dbraw/zinc/76/58/47/1329765847.db2.gz	ZDQFISHENXQIAU-UHFFFAOYSA-N	0	3	334.470	3.277	20	30		EGEDHN
CC(C)(C)OC(=O)NCC[C@H]1CCN(Cc2ccc(F)c(C#N)c2)C1	ZINC000932698069	1329834492	/nfs/dbraw/zinc/83/44/92/1329834492.db2.gz	BMQTZDPZQZSDHA-AWEZNQCLSA-N	0	3	347.434	3.434	20	30		EGEDHN
C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)[C@@H]1CCCN1C(C)C	ZINC000935942840	1330097465	/nfs/dbraw/zinc/09/74/65/1330097465.db2.gz	HFWZHDZXMQEEQM-SFHVURJKSA-N	0	3	332.492	3.242	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cncc(-c3ccccc3)c2)[C@H](C)C1	ZINC000942106239	1331831932	/nfs/dbraw/zinc/83/19/32/1331831932.db2.gz	MTOIDHIPNOMKOG-UTKZUKDTSA-N	0	3	347.462	3.212	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)c3ccccc3n2)[C@@H](C)C1	ZINC000942181182	1331864514	/nfs/dbraw/zinc/86/45/14/1331864514.db2.gz	QRBNKHBUASGWJH-FUHWJXTLSA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3c(o2)c(F)ccc3C)[C@H](C)C1	ZINC000942526883	1331956209	/nfs/dbraw/zinc/95/62/09/1331956209.db2.gz	CTZJLOMDHWTPNY-RHSMWYFYSA-N	0	3	342.414	3.344	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3ccc(F)cc3)CCC2)[C@H](C)C1	ZINC000942547042	1331968552	/nfs/dbraw/zinc/96/85/52/1331968552.db2.gz	FIAOBOYEVQVWEI-APWZRJJASA-N	0	3	342.458	3.097	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3cncc(C)c3)C[C@H]2C)cc1	ZINC000942552484	1331970681	/nfs/dbraw/zinc/97/06/81/1331970681.db2.gz	FWIJCWXDXCPESK-UTKZUKDTSA-N	0	3	347.462	3.012	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCN(Cc3cccnc3C)C[C@@H]2C)CC1	ZINC000942600892	1331998143	/nfs/dbraw/zinc/99/81/43/1331998143.db2.gz	WNMZZQCRZPPJSO-OXJNMPFZSA-N	0	3	341.499	3.463	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(Cc3ncccc3C)C[C@@H]2C)C1	ZINC000942603121	1332001429	/nfs/dbraw/zinc/00/14/29/1332001429.db2.gz	SGTRTCYWPVSKIE-IRXDYDNUSA-N	0	3	327.472	3.073	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3cccc(OC)c3)C[C@H]2C)C1	ZINC000942608106	1332004160	/nfs/dbraw/zinc/00/41/60/1332004160.db2.gz	PNCJPMCAIFIWPA-VQIMIIECSA-N	0	3	342.483	3.378	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc3nc(C)ccc3c2)[C@@H](C)C1	ZINC000943737974	1332249656	/nfs/dbraw/zinc/24/96/56/1332249656.db2.gz	JDJYDWJVJFFVSI-HNAYVOBHSA-N	0	3	335.451	3.007	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccc(C(F)F)cc2F)[C@@H](C)C1	ZINC000943756168	1332254481	/nfs/dbraw/zinc/25/44/81/1332254481.db2.gz	MCGVFLXURWEFLL-XHDPSFHLSA-N	0	3	326.362	3.390	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccn2C2CCCC2)[C@H](C)C1	ZINC000943772082	1332261160	/nfs/dbraw/zinc/26/11/60/1332261160.db2.gz	QAIJWYBHFSMNMY-AEFFLSMTSA-N	0	3	327.472	3.067	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cnn(C(CC)CC)c2C)[C@H](C)C1	ZINC000944063928	1332319841	/nfs/dbraw/zinc/31/98/41/1332319841.db2.gz	WIXSJHWOWAEPQM-RDTXWAMCSA-N	0	3	332.492	3.179	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C(F)(F)F)cc2)[C@@H](C)C1	ZINC000944282323	1332362934	/nfs/dbraw/zinc/36/29/34/1332362934.db2.gz	VLEMBZGINZOTDF-BBRMVZONSA-N	0	3	338.373	3.169	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cccc(Cl)c2Cl)[C@@H](C)C1	ZINC000944304142	1332367306	/nfs/dbraw/zinc/36/73/06/1332367306.db2.gz	GOLFJGNTTXSEPM-FZMZJTMJSA-N	0	3	325.239	3.067	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)c(F)cc2Cl)[C@@H](C)C1	ZINC000944345304	1332380068	/nfs/dbraw/zinc/38/00/68/1332380068.db2.gz	FLLGDWLLDQMYCV-SUMWQHHRSA-N	0	3	336.838	3.251	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc(-c3ccccc3)cc2)[C@H](C)C1	ZINC000944530794	1332414561	/nfs/dbraw/zinc/41/45/61/1332414561.db2.gz	GWBWRVDKZQCRAN-DYESRHJHSA-N	0	3	332.447	3.427	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2sc(C(C)(C)C)nc2C)[C@H](C)C1	ZINC000945809948	1332678995	/nfs/dbraw/zinc/67/89/95/1332678995.db2.gz	WIQSLWHXRRCYCS-UKRRQHHQSA-N	0	3	347.528	3.213	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2c(C)oc3ccccc32)[C@@H](C)C1	ZINC000946315071	1332786355	/nfs/dbraw/zinc/78/63/55/1332786355.db2.gz	WKTGQXVXCPTZNK-KXBFYZLASA-N	0	3	338.451	3.134	20	30		EGEDHN
N#Cc1ccccc1CN1C[C@@H]2CCN(C(=O)C=C3CCC3)CC[C@@H]2C1	ZINC000946550937	1332853338	/nfs/dbraw/zinc/85/33/38/1332853338.db2.gz	RTBSNHGHUSZXCS-OYRHEFFESA-N	0	3	349.478	3.339	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)c2ccccc2)CCN1Cc1cccc(C#N)c1	ZINC000947006357	1332968182	/nfs/dbraw/zinc/96/81/82/1332968182.db2.gz	ZXAXCZZMMQXWIJ-JXFKEZNVSA-N	0	3	333.435	3.341	20	30		EGEDHN
Cc1cccc(C(=O)N[C@H]2CCN(Cc3cccc(C#N)c3)[C@@H](C)C2)n1	ZINC000947075316	1333003089	/nfs/dbraw/zinc/00/30/89/1333003089.db2.gz	PEDLXXOKXCZHMR-LPHOPBHVSA-N	0	3	348.450	3.045	20	30		EGEDHN
Cc1cccnc1C(=O)N[C@@H]1CCN(Cc2ccc(C#N)cc2)[C@@H](C)C1	ZINC000947156498	1333027861	/nfs/dbraw/zinc/02/78/61/1333027861.db2.gz	DSVQFTGZMSTYQU-QFBILLFUSA-N	0	3	348.450	3.045	20	30		EGEDHN
Cc1cccnc1C(=O)N[C@H]1CCN(Cc2cccc(C#N)c2)[C@@H](C)C1	ZINC000947157461	1333028059	/nfs/dbraw/zinc/02/80/59/1333028059.db2.gz	PLLUKTHJSORXFY-LPHOPBHVSA-N	0	3	348.450	3.045	20	30		EGEDHN
Cc1cncc(C(=O)N[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@@H](C)C2)c1	ZINC000947162926	1333031096	/nfs/dbraw/zinc/03/10/96/1333031096.db2.gz	NUBLBGFIDAOPQS-OXJNMPFZSA-N	0	3	348.450	3.045	20	30		EGEDHN
Cc1cc(CN2CC[C@H](NC(=O)c3ccc(C#N)[nH]3)C[C@@H]2C)cs1	ZINC000947217221	1333054804	/nfs/dbraw/zinc/05/48/04/1333054804.db2.gz	LEOIASROIMIPLR-WFASDCNBSA-N	0	3	342.468	3.039	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)C2CC(C)(C)C2)CCN1Cc1ccc(C#N)cc1	ZINC000947278177	1333075248	/nfs/dbraw/zinc/07/52/48/1333075248.db2.gz	XJBLOPQNYWEQEF-DNVCBOLYSA-N	0	3	339.483	3.464	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2oc3c(cccc3F)c2C)C[C@@H]1C	ZINC000947392662	1333113339	/nfs/dbraw/zinc/11/33/39/1333113339.db2.gz	XHBSYZASDNSUPR-ZFWWWQNUSA-N	0	3	342.414	3.486	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccccc2-c2ccncc2)C[C@H]1C	ZINC000947442131	1333129137	/nfs/dbraw/zinc/12/91/37/1333129137.db2.gz	QDRQKDSMKWQZAD-MJGOQNOKSA-N	0	3	347.462	3.355	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2ccc(CCCC)cc2)C[C@H]1C	ZINC000947509890	1333150329	/nfs/dbraw/zinc/15/03/29/1333150329.db2.gz	HZFDEHKIXZIAPC-YLJYHZDGSA-N	0	3	326.484	3.174	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(-c3ccccc3)on2)C[C@H]1C	ZINC000947523527	1333157253	/nfs/dbraw/zinc/15/72/53/1333157253.db2.gz	DSGGJJGXJLNXGG-ZBFHGGJFSA-N	0	3	325.412	3.110	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2nc(Cl)sc2Cl)C[C@H]1C	ZINC000947610938	1333191374	/nfs/dbraw/zinc/19/13/74/1333191374.db2.gz	DAYACAGIAZHURA-BDAKNGLRSA-N	0	3	334.272	3.219	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3ncccc3C)[C@H](C)C2)cc1	ZINC000947611144	1333192203	/nfs/dbraw/zinc/19/22/03/1333192203.db2.gz	HONOCXYKDBFOKZ-XLIONFOSSA-N	0	3	347.462	3.154	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(F)cc3cccnc32)C[C@H]1C	ZINC000947767177	1333255309	/nfs/dbraw/zinc/25/53/09/1333255309.db2.gz	METCKJUPNJGIGL-CJNGLKHVSA-N	0	3	327.403	3.143	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cccc(-c3cnco3)c2)C[C@H]1C	ZINC000947882801	1333290478	/nfs/dbraw/zinc/29/04/78/1333290478.db2.gz	XHNFEXZOKXVIFT-PBHICJAKSA-N	0	3	325.412	3.110	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnn(CCC(C)C)c2C)C[C@@H]1C	ZINC000947903677	1333300076	/nfs/dbraw/zinc/30/00/76/1333300076.db2.gz	LYSRDBSRVJIIIL-RDJZCZTQSA-N	0	3	332.492	3.006	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2cccc(OCCC)c2)C[C@@H]1C	ZINC000947912951	1333304168	/nfs/dbraw/zinc/30/41/68/1333304168.db2.gz	SVILKUMZHYSHCE-PKOBYXMFSA-N	0	3	342.483	3.010	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccccc2C(F)(F)F)C[C@H]1C	ZINC000947962063	1333322093	/nfs/dbraw/zinc/32/20/93/1333322093.db2.gz	JEMWEUIWCANMPT-OLZOCXBDSA-N	0	3	326.362	3.474	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccsc2C(F)(F)F)C[C@@H]1C	ZINC000947975170	1333328702	/nfs/dbraw/zinc/32/87/02/1333328702.db2.gz	KWBWTIPLFREEFO-RYUDHWBXSA-N	0	3	344.402	3.373	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(OC(C)C)cc2)C[C@@H]1C	ZINC000948003073	1333339324	/nfs/dbraw/zinc/33/93/24/1333339324.db2.gz	XULDSQGJTXUHCB-WMZOPIPTSA-N	0	3	328.456	3.080	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc(COC(C)C)cc2)C[C@@H]1C	ZINC000948015636	1333342246	/nfs/dbraw/zinc/34/22/46/1333342246.db2.gz	GBJVOZAELSPASM-LPHOPBHVSA-N	0	3	330.472	3.380	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cccc(OCC(C)C)c2)C[C@H]1C	ZINC000948016417	1333343094	/nfs/dbraw/zinc/34/30/94/1333343094.db2.gz	OITUVUWIQRWYTE-SJLPKXTDSA-N	0	3	330.472	3.490	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cccc(OCC(C)C)c2)C[C@H]1C	ZINC000948016415	1333343169	/nfs/dbraw/zinc/34/31/69/1333343169.db2.gz	OITUVUWIQRWYTE-AEFFLSMTSA-N	0	3	330.472	3.490	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cnc(C(C)(C)C)s2)C[C@@H]1C	ZINC000948070120	1333363879	/nfs/dbraw/zinc/36/38/79/1333363879.db2.gz	MOSLRXGCPYCTRB-UONOGXRCSA-N	0	3	333.501	3.047	20	30		EGEDHN
CN(C(=O)c1ccncc1)[C@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948141667	1333390002	/nfs/dbraw/zinc/39/00/02/1333390002.db2.gz	DFPZMJKXRIGDIW-FQEVSTJZSA-N	0	3	348.450	3.080	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2nccc3ccsc32)CC1	ZINC000948457215	1333533998	/nfs/dbraw/zinc/53/39/98/1333533998.db2.gz	USEJIPYBOURNRY-INIZCTEOSA-N	0	3	341.480	3.246	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2ccc(-n3cccc3)cc2)CC1	ZINC000948595454	1333590118	/nfs/dbraw/zinc/59/01/18/1333590118.db2.gz	YVNOEBDHOXXDCQ-IBGZPJMESA-N	0	3	335.451	3.037	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)Cc2cccc(C(F)F)c2)CC1	ZINC000948612720	1333596697	/nfs/dbraw/zinc/59/66/97/1333596697.db2.gz	QPIRZISWKZJPJZ-QGZVFWFLSA-N	0	3	334.410	3.113	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2ccc3ncccc3c2)CC1	ZINC000948733205	1333651604	/nfs/dbraw/zinc/65/16/04/1333651604.db2.gz	JMKJKNUTRHPELR-LJQANCHMSA-N	0	3	335.451	3.185	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)C2CCC(F)(F)CC2)CC1	ZINC000948809672	1333691025	/nfs/dbraw/zinc/69/10/25/1333691025.db2.gz	RAEJYRLJTQLEJF-MRXNPFEDSA-N	0	3	326.431	3.148	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2ccc(Cl)c(OC)c2)CC1	ZINC000948832773	1333702627	/nfs/dbraw/zinc/70/26/27/1333702627.db2.gz	AMRBUYPOFLYQDV-INIZCTEOSA-N	0	3	348.874	3.298	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cc(Cl)cc(OC)c2)CC1	ZINC000948873245	1333716438	/nfs/dbraw/zinc/71/64/38/1333716438.db2.gz	DNMGXLCOSUDJHP-KRWDZBQOSA-N	0	3	348.874	3.298	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@H]1CNC(=O)c1cnccc1C	ZINC000948906850	1333729116	/nfs/dbraw/zinc/72/91/16/1333729116.db2.gz	SIAVHQRTLFOJQH-HXUWFJFHSA-N	0	3	335.451	3.295	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@H]1CNC(=O)[C@H]1OCC[C@H]1CC	ZINC000948928728	1333736842	/nfs/dbraw/zinc/73/68/42/1333736842.db2.gz	KSALPINTBLAZMX-AHRSYUTCSA-N	0	3	342.483	3.093	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@@H]2c3ccccc3CCN2CC(C)C)c1	ZINC000948959614	1333748811	/nfs/dbraw/zinc/74/88/11/1333748811.db2.gz	ZXMDPERJRJGNHW-OAQYLSRUSA-N	0	3	347.462	3.048	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@@H]3C[C@H]3C3CCC3)CC2)C1	ZINC000949492388	1333860519	/nfs/dbraw/zinc/86/05/19/1333860519.db2.gz	ABGKYZOQGSRUTF-RBUKOAKNSA-N	0	3	346.515	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)c3cc(C)ccc3C)CC2)C1	ZINC000949518054	1333865544	/nfs/dbraw/zinc/86/55/44/1333865544.db2.gz	IIWKFKFJUOBSDJ-UHFFFAOYSA-N	0	3	342.483	3.187	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2cc(F)cc3ccoc32)C1	ZINC000967061242	1335652309	/nfs/dbraw/zinc/65/23/09/1335652309.db2.gz	MMPVWSKTLGEIMW-CXAGYDPISA-N	0	3	328.387	3.035	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2cc(Cl)c(Cl)[nH]2)C1	ZINC000967527101	1335768062	/nfs/dbraw/zinc/76/80/62/1335768062.db2.gz	PSTCOEUSAIAUJQ-GWCFXTLKSA-N	0	3	330.259	3.338	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2cc(Cl)c(Cl)[nH]2)C1	ZINC000967527102	1335768284	/nfs/dbraw/zinc/76/82/84/1335768284.db2.gz	PSTCOEUSAIAUJQ-GXFFZTMASA-N	0	3	330.259	3.338	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC[C@@H](NCc2sc3ccccc3c2Cl)C1	ZINC000967727556	1335808641	/nfs/dbraw/zinc/80/86/41/1335808641.db2.gz	FLUVWGYXKGPLDD-NWDGAFQWSA-N	0	3	347.871	3.405	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CCOCC(C)C)CCCCC1	ZINC001115421098	1370445346	/nfs/dbraw/zinc/44/53/46/1370445346.db2.gz	RZYXVFNTKPWUHC-UHFFFAOYSA-N	0	3	330.900	3.210	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CN(CCc3scnc3C)CC[C@@H]2C)C1	ZINC000968272083	1335881717	/nfs/dbraw/zinc/88/17/17/1335881717.db2.gz	DWOMQQFMBZSUMG-HOCLYGCPSA-N	0	3	347.528	3.177	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CN(CC3CC(F)(F)C3)CC[C@@H]2C)C1	ZINC000968273661	1335882241	/nfs/dbraw/zinc/88/22/41/1335882241.db2.gz	IJVBFDMVZCUTSM-ZFWWWQNUSA-N	0	3	326.431	3.215	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CN(Cc3cccc(C)c3)CC[C@H]2C)c1	ZINC000968316709	1335888447	/nfs/dbraw/zinc/88/84/47/1335888447.db2.gz	GIKLQPWPGBUDLQ-DYESRHJHSA-N	0	3	347.462	3.012	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)Cc2ccc(Cl)c(F)c2)C1	ZINC000968354275	1335899548	/nfs/dbraw/zinc/89/95/48/1335899548.db2.gz	PPUAUTCPLYCOKF-DYVFJYSZSA-N	0	3	338.854	3.424	20	30		EGEDHN
C=C(C)CCN1CC[C@H](C)[C@@H](NC(=O)c2sc(CC)nc2C)C1	ZINC000968406028	1335922514	/nfs/dbraw/zinc/92/25/14/1335922514.db2.gz	WDLLEONJTPSPDO-ZFWWWQNUSA-N	0	3	335.517	3.420	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2ccc(-c3cn[nH]c3)cc2)C1	ZINC000968406254	1335922735	/nfs/dbraw/zinc/92/27/35/1335922735.db2.gz	ZESTUPAUTCHHMX-DNVCBOLYSA-N	0	3	338.455	3.093	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)Cc2ccccc2OC(C)C)C1	ZINC000968413949	1335924075	/nfs/dbraw/zinc/92/40/75/1335924075.db2.gz	NREHSRVDDVOTGJ-PKOBYXMFSA-N	0	3	344.499	3.419	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2cc(-c3ccccc3)ccn2)C1	ZINC000968471345	1335934118	/nfs/dbraw/zinc/93/41/18/1335934118.db2.gz	DHZSRATZJKMHMB-DYESRHJHSA-N	0	3	347.462	3.212	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@@H](NC(=O)c2sc(CC3CC3)nc2C)C1	ZINC000968477794	1335936178	/nfs/dbraw/zinc/93/61/78/1335936178.db2.gz	WMPARBARKUXICD-CJNGLKHVSA-N	0	3	347.528	3.420	20	30		EGEDHN
N#Cc1cc(CN[C@@H]2CCN(C(=O)C3=CCCCCC3)C2)ccc1F	ZINC000968494807	1335941478	/nfs/dbraw/zinc/94/14/78/1335941478.db2.gz	NUJXZLLLJVZAKC-GOSISDBHSA-N	0	3	341.430	3.278	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2cccc(-c3ccoc3)c2)C1	ZINC000968517908	1335951034	/nfs/dbraw/zinc/95/10/34/1335951034.db2.gz	VAYNADQNRCCUAQ-OXQOHEQNSA-N	0	3	336.435	3.410	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2cccc(Cl)c2Cl)C1	ZINC000968584152	1335973334	/nfs/dbraw/zinc/97/33/34/1335973334.db2.gz	SZGSCTDTYRZIBM-WFASDCNBSA-N	0	3	339.266	3.457	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)Cc2c(F)cccc2Cl)C1	ZINC000968584137	1335973567	/nfs/dbraw/zinc/97/35/67/1335973567.db2.gz	STCKXAHOIRRKMO-CXAGYDPISA-N	0	3	338.854	3.424	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)CC23CC4CC(CC(C4)C2)C3)C1	ZINC000968584458	1335974598	/nfs/dbraw/zinc/97/45/98/1335974598.db2.gz	XFSVKFGWQRMVKT-YKOJYSHRSA-N	0	3	342.527	3.443	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2ccc(OCC(C)C)cc2)C1	ZINC000968620323	1335986345	/nfs/dbraw/zinc/98/63/45/1335986345.db2.gz	STPKBNYCLLEUGQ-FXAWDEMLSA-N	0	3	342.483	3.185	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@H](NC(=O)c2cc(C3CCCC3)no2)C1	ZINC000968670406	1336004005	/nfs/dbraw/zinc/00/40/05/1336004005.db2.gz	XFMLKKMVINIUQR-WMLDXEAASA-N	0	3	331.460	3.349	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2ccc(F)c3occc32)C1	ZINC000968677997	1336007198	/nfs/dbraw/zinc/00/71/98/1336007198.db2.gz	MUYYWYGIOOGLCX-GUYCJALGSA-N	0	3	328.387	3.035	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)C23CC(C(F)(F)F)(C2)C3)C1	ZINC000968681411	1336008769	/nfs/dbraw/zinc/00/87/69/1336008769.db2.gz	JCKFQNXSOWOYES-LOCSVTFISA-N	0	3	330.394	3.122	20	30		EGEDHN
N#Cc1ccc(CN2CCCCC[C@@H]2CNC(=O)c2cccnc2)cc1	ZINC000968722962	1336023969	/nfs/dbraw/zinc/02/39/69/1336023969.db2.gz	TVSRBDGDDBZBTK-HXUWFJFHSA-N	0	3	348.450	3.128	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1c(Cl)n[nH]c1CC	ZINC000968884946	1336079623	/nfs/dbraw/zinc/07/96/23/1336079623.db2.gz	HNSUAEWMBAAPLR-CYBMUJFWSA-N	0	3	338.883	3.176	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccc2c(c1)OCCCO2	ZINC000968890571	1336081665	/nfs/dbraw/zinc/08/16/65/1336081665.db2.gz	KQTXQDDBXOBBMX-QGZVFWFLSA-N	0	3	344.455	3.008	20	30		EGEDHN
C#CCCN1CCCCC[C@H]1CNC(=O)c1cc2ncccc2s1	ZINC000968974511	1336106465	/nfs/dbraw/zinc/10/64/65/1336106465.db2.gz	VRXFQYLVNUOQEK-HNNXBMFYSA-N	0	3	341.480	3.294	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1c(F)cc(OC)cc1F	ZINC000969042633	1336125233	/nfs/dbraw/zinc/12/52/33/1336125233.db2.gz	YCVQOFNQPCDNAK-CYBMUJFWSA-N	0	3	338.398	3.134	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccoc1Br	ZINC000969105809	1336146057	/nfs/dbraw/zinc/14/60/57/1336146057.db2.gz	OQNRJYWBQHHQEY-LBPRGKRZSA-N	0	3	341.249	3.203	20	30		EGEDHN
C#CCCN1CCCCC[C@H]1CNC(=O)c1coc(C2CCCC2)n1	ZINC000969097121	1336141551	/nfs/dbraw/zinc/14/15/51/1336141551.db2.gz	HLRQKIJQNBDQCO-KRWDZBQOSA-N	0	3	343.471	3.330	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1cccc2ccncc21	ZINC000969098107	1336142145	/nfs/dbraw/zinc/14/21/45/1336142145.db2.gz	WTPPYRMSMQNANY-GOSISDBHSA-N	0	3	335.451	3.233	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccnc(O[C@H](C)CC)c1	ZINC000969105976	1336146269	/nfs/dbraw/zinc/14/62/69/1336146269.db2.gz	QFTVXHQLMGSSIJ-SJLPKXTDSA-N	0	3	345.487	3.419	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cnn(CCCC)c1C	ZINC000969109210	1336147509	/nfs/dbraw/zinc/14/75/09/1336147509.db2.gz	XPYGUOVOESICOJ-KRWDZBQOSA-N	0	3	332.492	3.152	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)[C@@H]1CCCc2sc(C)nc21	ZINC000969114275	1336148534	/nfs/dbraw/zinc/14/85/34/1336148534.db2.gz	DXQJFDLPWHUIOA-HZPDHXFCSA-N	0	3	347.528	3.418	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cc(OC)c(C)c(OC)c1	ZINC000969135640	1336156731	/nfs/dbraw/zinc/15/67/31/1336156731.db2.gz	DBKYNJXAAATSTP-KRWDZBQOSA-N	0	3	346.471	3.173	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1c[nH]c2ccc(C)cc12	ZINC000969158489	1336166572	/nfs/dbraw/zinc/16/65/72/1336166572.db2.gz	KMDUOZIQSSYICY-QGZVFWFLSA-N	0	3	337.467	3.474	20	30		EGEDHN
CC1(C)CCC[C@@H]1C(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C1	ZINC000969623133	1336229864	/nfs/dbraw/zinc/22/98/64/1336229864.db2.gz	QMUAXUKWDLVKMJ-CZUORRHYSA-N	0	3	331.485	3.137	20	30		EGEDHN
C#CCCN1CC([C@@H](C)NC(=O)c2cc3cc(Cl)ccc3o2)C1	ZINC000970081989	1336277699	/nfs/dbraw/zinc/27/76/99/1336277699.db2.gz	KMUFOVGOMZLFBJ-GFCCVEGCSA-N	0	3	330.815	3.160	20	30		EGEDHN
C#CCCN1CC([C@H](C)NC(=O)[C@@H]2CCCC[C@@H]2c2ccccc2)C1	ZINC000970455496	1336308895	/nfs/dbraw/zinc/30/88/95/1336308895.db2.gz	SNDLSFVLONRABA-IOMROCGXSA-N	0	3	338.495	3.420	20	30		EGEDHN
C=C[C@H](C(=O)N1CC[C@@H](NCc2ccc(C)nc2C)C1)c1ccccc1	ZINC000970773780	1336336871	/nfs/dbraw/zinc/33/68/71/1336336871.db2.gz	CDBYRXWULYZBCY-RTWAWAEBSA-N	0	3	349.478	3.359	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccc(-c3cnco3)cc2)CC1	ZINC001005593207	1336376787	/nfs/dbraw/zinc/37/67/87/1336376787.db2.gz	RHYVTAVTMBNKEQ-UHFFFAOYSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cccc([C@@H]3CCOC3)c2)CC1	ZINC001005630150	1336385595	/nfs/dbraw/zinc/38/55/95/1336385595.db2.gz	WLJNBGYIGQWTMQ-LJQANCHMSA-N	0	3	342.483	3.303	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cnn(C(C)C)c2Cl)CC1	ZINC001005778352	1336401021	/nfs/dbraw/zinc/40/10/21/1336401021.db2.gz	WVUMZLINFKZZIC-UHFFFAOYSA-N	0	3	338.883	3.230	20	30		EGEDHN
C[C@H]1C[C@H]1CC(=O)N(C)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001005929656	1336423730	/nfs/dbraw/zinc/42/37/30/1336423730.db2.gz	KRUHYCCSYCPEFL-YJBOKZPZSA-N	0	3	325.456	3.027	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cn(CC)nc2C(C)C)CC1	ZINC001006068974	1336446482	/nfs/dbraw/zinc/44/64/82/1336446482.db2.gz	TXCHIKXPDGEBJD-UHFFFAOYSA-N	0	3	332.492	3.139	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cccc(C(F)(F)F)c2)CC1	ZINC001006327552	1336489597	/nfs/dbraw/zinc/48/95/97/1336489597.db2.gz	LSULJSZLPBHRGC-UHFFFAOYSA-N	0	3	326.362	3.428	20	30		EGEDHN
C=C(C)CCN1CCC[C@H](NC(=O)c2conc2C2CCCC2)C1	ZINC001007484308	1336656010	/nfs/dbraw/zinc/65/60/10/1336656010.db2.gz	RHAKAEVCQZULNB-INIZCTEOSA-N	0	3	331.460	3.493	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2sccc2-n2cccc2)C1	ZINC001008120093	1336774109	/nfs/dbraw/zinc/77/41/09/1336774109.db2.gz	JDWKBVPGVZOBJW-HNNXBMFYSA-N	0	3	329.469	3.309	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CCCN([C@@H](C)c3ccccc3)C2)c1	ZINC001008468374	1336864228	/nfs/dbraw/zinc/86/42/28/1336864228.db2.gz	LAWSXTBLPBMYTB-JXFKEZNVSA-N	0	3	333.435	3.018	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2cc(F)c3ncccc3c2)C1	ZINC001008885391	1336937388	/nfs/dbraw/zinc/93/73/88/1336937388.db2.gz	ZILOYYOKYIIOBY-MRXNPFEDSA-N	0	3	327.403	3.144	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCN(Cc3ccc(C)cc3C)C2)nc1	ZINC001009270304	1336994248	/nfs/dbraw/zinc/99/42/48/1336994248.db2.gz	RPCBRDNWNGOLKP-FQEVSTJZSA-N	0	3	347.462	3.074	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN([C@H](C)c3ccccc3C)C2)cn1	ZINC001009273157	1336995272	/nfs/dbraw/zinc/99/52/72/1336995272.db2.gz	DFTNFOBXEYXSEN-YLJYHZDGSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN([C@H](CC)c3ccccc3)C2)cn1	ZINC001009278776	1336995717	/nfs/dbraw/zinc/99/57/17/1336995717.db2.gz	WFWZPXYPCMEQHY-NHCUHLMSSA-N	0	3	347.462	3.408	20	30		EGEDHN
C#CCCN1CCC[C@@H](NC(=O)CC2C3CC4CC(C3)CC2C4)C1	ZINC001009586478	1337042034	/nfs/dbraw/zinc/04/20/34/1337042034.db2.gz	DGUAJOMPNSPGST-RDOIFFKNSA-N	0	3	328.500	3.053	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)Cc2c(C)oc3ccccc32)C1	ZINC001009783628	1337074989	/nfs/dbraw/zinc/07/49/89/1337074989.db2.gz	ANZKYDWEHFFDRO-INIZCTEOSA-N	0	3	326.440	3.440	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1CCN(Cc2cc(C)ccc2C)C1	ZINC001014726289	1337887419	/nfs/dbraw/zinc/88/74/19/1337887419.db2.gz	WYCDLUCHGYGZAI-LJQANCHMSA-N	0	3	337.467	3.295	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN(Cc3ccc4cc[nH]c4c3)C2)cc1	ZINC001015482348	1338155513	/nfs/dbraw/zinc/15/55/13/1338155513.db2.gz	MMOAWFHPSSWOLW-HXUWFJFHSA-N	0	3	343.430	3.154	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCN(CCc3ccc(OC)cc3)C2)CC1	ZINC001015654809	1338234511	/nfs/dbraw/zinc/23/45/11/1338234511.db2.gz	FZDJUQZCVXZVCJ-IBGZPJMESA-N	0	3	342.483	3.175	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)Cc2cccc(C)c2Cl)CC1	ZINC001016724132	1338703103	/nfs/dbraw/zinc/70/31/03/1338703103.db2.gz	NXYLQWVUYIZULB-QGZVFWFLSA-N	0	3	344.886	3.185	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)[C@H](c2ccccc2)C2CC2)CC1	ZINC001016726032	1338703553	/nfs/dbraw/zinc/70/35/53/1338703553.db2.gz	LKKOOWFCKKTPEV-VQTJNVASSA-N	0	3	336.479	3.174	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(C[C@H]3NC(=O)[C@H]3C[C@H]4C[C@H]4C3)CC2)c1	ZINC001016787854	1338727441	/nfs/dbraw/zinc/72/74/41/1338727441.db2.gz	ZRSBRSBUQBHGEA-FUMNGEBKSA-N	0	3	349.478	3.075	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)C(C)(C)c2cccc(F)c2)CC1	ZINC001016820871	1338738026	/nfs/dbraw/zinc/73/80/26/1338738026.db2.gz	VWUWRMRIBHITKT-GOSISDBHSA-N	0	3	342.458	3.097	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cc(F)ccc2Cl)CC1	ZINC001016842349	1338743670	/nfs/dbraw/zinc/74/36/70/1338743670.db2.gz	INWFCIQULSPTKL-MRXNPFEDSA-N	0	3	334.822	3.087	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(C(F)F)cc2)CC1	ZINC001016877789	1338756579	/nfs/dbraw/zinc/75/65/79/1338756579.db2.gz	OWCWYPGORXWTCV-INIZCTEOSA-N	0	3	332.394	3.232	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cccc(C)c2Cl)CC1	ZINC001016886433	1338759243	/nfs/dbraw/zinc/75/92/43/1338759243.db2.gz	DNLPBHLRNIKFKO-MRXNPFEDSA-N	0	3	330.859	3.256	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2ccc(-c3ccco3)s2)CC1	ZINC001016910539	1338767063	/nfs/dbraw/zinc/76/70/63/1338767063.db2.gz	VSJIPTPEGFCWDC-QGZVFWFLSA-N	0	3	340.448	3.226	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)[C@H](C)c2ccc(C)s2)CC1	ZINC001016926916	1338772653	/nfs/dbraw/zinc/77/26/53/1338772653.db2.gz	OFADGIGFVVZWPV-NVXWUHKLSA-N	0	3	330.497	3.154	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2oc3ccccc3c2Cl)CC1	ZINC001016928361	1338773128	/nfs/dbraw/zinc/77/31/28/1338773128.db2.gz	WRDMOBNSPAGNHZ-OAHLLOKOSA-N	0	3	342.826	3.304	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2oc3ccccc3c2Cl)CC1	ZINC001016928360	1338773344	/nfs/dbraw/zinc/77/33/44/1338773344.db2.gz	WRDMOBNSPAGNHZ-HNNXBMFYSA-N	0	3	342.826	3.304	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)C2(C3CCCCC3)CC2)CC1	ZINC001016946263	1338780136	/nfs/dbraw/zinc/78/01/36/1338780136.db2.gz	ANNDUZACJJBZCB-SFHVURJKSA-N	0	3	328.500	3.341	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cc(C)n(C(C)C)c2C)CC1	ZINC001016969318	1338787522	/nfs/dbraw/zinc/78/75/22/1338787522.db2.gz	SPWUUVAFQOVKNE-IBGZPJMESA-N	0	3	341.499	3.293	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)C2(c3ccccc3C)CC2)CC1	ZINC001017000564	1338799909	/nfs/dbraw/zinc/79/99/09/1338799909.db2.gz	VWNBRJZIPWBUQG-IBGZPJMESA-N	0	3	336.479	3.021	20	30		EGEDHN
CC(C)c1cccc(CN(C)C[C@H]2CCCN(C(=O)[C@@H](C)C#N)C2)n1	ZINC001017076144	1338849615	/nfs/dbraw/zinc/84/96/15/1338849615.db2.gz	FLWWCAGMRUNWEG-DLBZAZTESA-N	0	3	342.487	3.035	20	30		EGEDHN
C[C@H](c1ccccc1F)N(C)C[C@@H]1CCCN(C(=O)C#CC2CC2)C1	ZINC001017121068	1338879009	/nfs/dbraw/zinc/87/90/09/1338879009.db2.gz	PNDQXCSYPWRDNN-AEFFLSMTSA-N	0	3	342.458	3.471	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc(F)cc1F	ZINC001017570973	1339368997	/nfs/dbraw/zinc/36/89/97/1339368997.db2.gz	KCICZROEUHEXBX-CALCHBBNSA-N	0	3	334.410	3.149	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1CCC[C@@H]1C(F)F	ZINC001017616791	1339377839	/nfs/dbraw/zinc/37/78/39/1339377839.db2.gz	IDRYFEQOSCULEI-FZKCQIBNSA-N	0	3	326.431	3.309	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1cccc2c1O[C@@H](C)C2	ZINC001017742473	1339408505	/nfs/dbraw/zinc/40/85/05/1339408505.db2.gz	QHKOJBUBLSFWMM-RYQLBKOJSA-N	0	3	340.467	3.265	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H]1CCC(C)(C)CO1	ZINC001017746342	1339409990	/nfs/dbraw/zinc/40/99/90/1339409990.db2.gz	BKMDUZKMEPAPSE-KSZLIROESA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1CCCc2cccnc21	ZINC001017835724	1339428837	/nfs/dbraw/zinc/42/88/37/1339428837.db2.gz	OYPDBSMTALJISL-OTWHNJEPSA-N	0	3	339.483	3.143	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1c(C)[nH]c2ccccc21	ZINC001017872863	1339437582	/nfs/dbraw/zinc/43/75/82/1339437582.db2.gz	WIETWOUYQAIMFK-CALCHBBNSA-N	0	3	337.467	3.270	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](CC)OC1CCCC1	ZINC001018013227	1339481664	/nfs/dbraw/zinc/48/16/64/1339481664.db2.gz	ABNINPNANBLPLY-SCTDSRPQSA-N	0	3	334.504	3.366	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)Oc1ccc(F)cc1	ZINC001018249652	1339549688	/nfs/dbraw/zinc/54/96/88/1339549688.db2.gz	QCLIDDXPIPNATH-RYQLBKOJSA-N	0	3	346.446	3.234	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1Oc2ccccc2[C@H]1C	ZINC001018343636	1339585777	/nfs/dbraw/zinc/58/57/77/1339585777.db2.gz	XXBSZVGDBUCUQM-PDOICOKGSA-N	0	3	340.467	3.193	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@H]2CCCN2Cc2ccccc2CC)c1	ZINC001028126795	1340445591	/nfs/dbraw/zinc/44/55/91/1340445591.db2.gz	PUITVDPBQVPKQW-OAQYLSRUSA-N	0	3	347.462	3.020	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@H]2CCCN2Cc2ccc(C)cc2C)c1	ZINC001028128228	1340446637	/nfs/dbraw/zinc/44/66/37/1340446637.db2.gz	BYIXTSFUOWWBDV-OAQYLSRUSA-N	0	3	347.462	3.074	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)NC[C@H]1CCCN1Cc1cccc(C)c1	ZINC001028195503	1340479516	/nfs/dbraw/zinc/47/95/16/1340479516.db2.gz	PERWXHIXKDRYKZ-AABGKKOBSA-N	0	3	342.483	3.057	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1cnoc1-c1ccccc1	ZINC001028235815	1340497631	/nfs/dbraw/zinc/49/76/31/1340497631.db2.gz	DXWJQVKIGKNWJL-INIZCTEOSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)[C@H]1CCCc2sc(C)nc21	ZINC001028259266	1340517381	/nfs/dbraw/zinc/51/73/81/1340517381.db2.gz	LYYVZAVNCGRQCC-GJZGRUSLSA-N	0	3	333.501	3.028	20	30		EGEDHN
C#CCCN1CCC[C@H]1CNC(=O)c1c(Cl)cccc1Cl	ZINC001028283300	1340537493	/nfs/dbraw/zinc/53/74/93/1340537493.db2.gz	CENZGVHBBARYGJ-LBPRGKRZSA-N	0	3	325.239	3.211	20	30		EGEDHN
C#CCCN1CCC[C@@H]1CNC(=O)c1ccc(Cl)c(Cl)c1	ZINC001028284131	1340538526	/nfs/dbraw/zinc/53/85/26/1340538526.db2.gz	ZCLQFBXLMCPQIT-CYBMUJFWSA-N	0	3	325.239	3.211	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)c2ccccc2C(C)(C)CC)C1	ZINC001028616835	1340726170	/nfs/dbraw/zinc/72/61/70/1340726170.db2.gz	BNTGVUXQIYBSRB-QGZVFWFLSA-N	0	3	326.484	3.449	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)c2cc3ccc(F)cc3s2)C1	ZINC001028668812	1340748443	/nfs/dbraw/zinc/74/84/43/1340748443.db2.gz	JXTNVISIEPIEAP-CYBMUJFWSA-N	0	3	330.428	3.115	20	30		EGEDHN
C[C@H](NCc1cc(F)ccc1C#N)C1CCN(C(=O)C(C)(C)F)CC1	ZINC001029034843	1340913511	/nfs/dbraw/zinc/91/35/11/1340913511.db2.gz	IFKGJTBDEYSBQR-ZDUSSCGKSA-N	0	3	349.425	3.162	20	30		EGEDHN
C[C@H](NCc1cc(F)ccc1C#N)C1CCN(C(=O)CC2CC2)CC1	ZINC001029037230	1340914043	/nfs/dbraw/zinc/91/40/43/1340914043.db2.gz	BKDXARFCMFQJHH-AWEZNQCLSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC([C@@H](C)NCc2csc(C)n2)CC1	ZINC001029124839	1340935975	/nfs/dbraw/zinc/93/59/75/1340935975.db2.gz	CDLVZMPPZZOIKE-CYBMUJFWSA-N	0	3	335.517	3.380	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@@H]1CCN(C(=O)CC(C)(C)C)C1	ZINC001029648015	1341033427	/nfs/dbraw/zinc/03/34/27/1341033427.db2.gz	XOHNFZFQULIRBW-AWEZNQCLSA-N	0	3	333.501	3.336	20	30		EGEDHN
C[C@@H](c1ccc(F)cc1F)N(C)C[C@H]1CCN(C(=O)C#CC2CC2)C1	ZINC001029733135	1341057471	/nfs/dbraw/zinc/05/74/71/1341057471.db2.gz	GDHAGVSCWPJZAU-GOEBONIOSA-N	0	3	346.421	3.220	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@H](CN(C)Cc2ncccc2C)C1	ZINC001029826476	1341087607	/nfs/dbraw/zinc/08/76/07/1341087607.db2.gz	QYFBOSVXYNDTFY-PXNSSMCTSA-N	0	3	329.488	3.273	20	30		EGEDHN
CCN1CCC[C@@H](N(Cc2ccccc2)C(=O)c2c[nH]c(C#N)c2)C1	ZINC001029920129	1341119701	/nfs/dbraw/zinc/11/97/01/1341119701.db2.gz	OQSRMHXDZYFPOI-LJQANCHMSA-N	0	3	336.439	3.013	20	30		EGEDHN
CC(C)CC(=O)N1CCC(CN(C)Cc2ccc(C#N)cc2F)CC1	ZINC001029928749	1341123811	/nfs/dbraw/zinc/12/38/11/1341123811.db2.gz	WEZZMDKVVSFCTA-UHFFFAOYSA-N	0	3	345.462	3.414	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1F)CC1CCN(C(=O)C2(C)CC2)CC1	ZINC001029967872	1341137840	/nfs/dbraw/zinc/13/78/40/1341137840.db2.gz	XKWCSYJTQVBJRC-UHFFFAOYSA-N	0	3	343.446	3.168	20	30		EGEDHN
C#Cc1cncc(C(=O)NCC2CN([C@@H](C)c3cc(C)ccc3C)C2)c1	ZINC001031963556	1341433191	/nfs/dbraw/zinc/43/31/91/1341433191.db2.gz	OTJXZCQXRNUWRC-KRWDZBQOSA-N	0	3	347.462	3.103	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@@H]2C[C@H]1CN2CC[C@@H]1CCCCO1	ZINC001032423107	1341509054	/nfs/dbraw/zinc/50/90/54/1341509054.db2.gz	VVJIIULOLSXGPY-JYJNAYRXSA-N	0	3	340.895	3.009	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1cccc2sccc21	ZINC001032665476	1341576419	/nfs/dbraw/zinc/57/64/19/1341576419.db2.gz	XYCHGHMWNJCWKU-HOTGVXAUSA-N	0	3	326.465	3.305	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H]1C[C@H]1c1cccc(F)c1F	ZINC001032792338	1341614848	/nfs/dbraw/zinc/61/48/48/1341614848.db2.gz	VRPRIWHGPUNBRF-NXNVCVFFSA-N	0	3	346.421	3.320	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H](C)c1ccc(F)cc1F	ZINC001032792662	1341614897	/nfs/dbraw/zinc/61/48/97/1341614897.db2.gz	JDEMEPWYQUOKHO-BPUTZDHNSA-N	0	3	334.410	3.320	20	30		EGEDHN
C#Cc1cncc(C(=O)N(C)[C@H]2CCN([C@H](C)c3cccc(C)c3)C2)c1	ZINC001033405899	1341816753	/nfs/dbraw/zinc/81/67/53/1341816753.db2.gz	PZNBTCSIDGGEQB-UTKZUKDTSA-N	0	3	347.462	3.279	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2cc(F)c3ncccc3c2)C1	ZINC001033505341	1341850343	/nfs/dbraw/zinc/85/03/43/1341850343.db2.gz	NVNBHKKNWZPCQW-INIZCTEOSA-N	0	3	327.403	3.096	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2ccc(N(C)CCC)cc2)C1	ZINC001033712838	1341971591	/nfs/dbraw/zinc/97/15/91/1341971591.db2.gz	KVMUHBUFHAGOCR-IBGZPJMESA-N	0	3	329.488	3.255	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2oc3ccc(F)cc3c2C)C1	ZINC001033857147	1342047236	/nfs/dbraw/zinc/04/72/36/1342047236.db2.gz	ANDSVWGHMPSKNQ-MRXNPFEDSA-N	0	3	342.414	3.440	20	30		EGEDHN
C=CCN1CC[C@@H](N(CC)C(=O)c2cn(C)c3ccc(F)cc23)C1	ZINC001033856659	1342047353	/nfs/dbraw/zinc/04/73/53/1342047353.db2.gz	VAYKDUWIUBUWSX-OAHLLOKOSA-N	0	3	329.419	3.040	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2cc(F)cc3ccoc32)C1	ZINC001033879172	1342056147	/nfs/dbraw/zinc/05/61/47/1342056147.db2.gz	WXIGSYLZSFVIEJ-INIZCTEOSA-N	0	3	328.387	3.132	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2[nH]nc(C3CC3)c2Cl)C1	ZINC001033886652	1342059488	/nfs/dbraw/zinc/05/94/88/1342059488.db2.gz	ZPXHJODXVOUJNO-CYBMUJFWSA-N	0	3	336.867	3.053	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2cc3cc(Cl)ccc3[nH]2)C1	ZINC001033916975	1342085466	/nfs/dbraw/zinc/08/54/66/1342085466.db2.gz	QWNAKCVPRWKKDD-INIZCTEOSA-N	0	3	343.858	3.381	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cc3ccccc3n2C)C1	ZINC001033941420	1342103797	/nfs/dbraw/zinc/10/37/97/1342103797.db2.gz	GQZIIKPKEOJIBA-KRWDZBQOSA-N	0	3	325.456	3.291	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@@H]2CCc3ccccc3C2)C1	ZINC001033975345	1342124828	/nfs/dbraw/zinc/12/48/28/1342124828.db2.gz	MGDJCABEYXXXES-WOJBJXKFSA-N	0	3	326.484	3.290	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2[nH]ccc2-c2ccccc2)C1	ZINC001034015735	1342152881	/nfs/dbraw/zinc/15/28/81/1342152881.db2.gz	JHCMNSASJQACKA-GOSISDBHSA-N	0	3	335.451	3.241	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cnn(CCCC)c2C)C1	ZINC001034016207	1342153210	/nfs/dbraw/zinc/15/32/10/1342153210.db2.gz	LCYIWZIYKQQFPO-QGZVFWFLSA-N	0	3	332.492	3.104	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cnn([C@H](C)CC)c2C)C1	ZINC001034017270	1342155156	/nfs/dbraw/zinc/15/51/56/1342155156.db2.gz	QSYAZTBVAYVJIT-WBVHZDCISA-N	0	3	332.492	3.275	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)c2csc3c2CCCC3)C1	ZINC001034035391	1342174625	/nfs/dbraw/zinc/17/46/25/1342174625.db2.gz	KSSHEBLMAPIZHK-OAHLLOKOSA-N	0	3	330.497	3.187	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cc(OC)c(OC)cc2C)C1	ZINC001034048693	1342190033	/nfs/dbraw/zinc/19/00/33/1342190033.db2.gz	SLLYELIILPWPDH-MRXNPFEDSA-N	0	3	346.471	3.125	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2oc(CC3CC3)nc2C)C1	ZINC001034209585	1342319385	/nfs/dbraw/zinc/31/93/85/1342319385.db2.gz	FSWVIZYTEFXMET-INIZCTEOSA-N	0	3	331.460	3.096	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)c2cc(Cl)c(Cl)n2C)C1	ZINC001034238259	1342338951	/nfs/dbraw/zinc/33/89/51/1342338951.db2.gz	BPWWWHKXSILWDI-LLVKDONJSA-N	0	3	330.259	3.102	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccnc(-n3cccc3)c2)C1	ZINC001034264810	1342356705	/nfs/dbraw/zinc/35/67/05/1342356705.db2.gz	NNQFDHBSCFFAOG-SFHVURJKSA-N	0	3	338.455	3.033	20	30		EGEDHN
N#Cc1ccc(CN2CCCC[C@H](NC(=O)Cc3ccccc3)C2)cc1	ZINC001034273102	1342364293	/nfs/dbraw/zinc/36/42/93/1342364293.db2.gz	QPAAXIOGXIIBNQ-NRFANRHFSA-N	0	3	347.462	3.272	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2cc(C)c3ccccc3n2)C1	ZINC001034275016	1342366509	/nfs/dbraw/zinc/36/65/09/1342366509.db2.gz	XRCXPQKMDVPGQV-QGZVFWFLSA-N	0	3	335.451	3.151	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@H]2COc3ccc(Cl)cc32)C1	ZINC001034308170	1342391297	/nfs/dbraw/zinc/39/12/97/1342391297.db2.gz	URFANZLVABVYSN-WBVHZDCISA-N	0	3	348.874	3.363	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2ccc(C)nc2C2CC2)C1	ZINC001034327362	1342402153	/nfs/dbraw/zinc/40/21/53/1342402153.db2.gz	IMORDTDXFUYMHU-QGZVFWFLSA-N	0	3	327.472	3.428	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cc3ccccc3n2C)C1	ZINC001034368550	1342438315	/nfs/dbraw/zinc/43/83/15/1342438315.db2.gz	LBNHKXSJVNSBPG-QGZVFWFLSA-N	0	3	325.456	3.339	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCCCN(CCc3ccns3)C2)CC1	ZINC001034380519	1342450361	/nfs/dbraw/zinc/45/03/61/1342450361.db2.gz	JTOPSPXSSJISRO-QGZVFWFLSA-N	0	3	347.528	3.403	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2ccc(C(C)C)nc2C)C1	ZINC001034403702	1342468132	/nfs/dbraw/zinc/46/81/32/1342468132.db2.gz	AGSHPDXEWBKFFB-KRWDZBQOSA-N	0	3	327.472	3.121	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cnccc2C(F)(F)F)C1	ZINC001034422446	1342484507	/nfs/dbraw/zinc/48/45/07/1342484507.db2.gz	XKHAHQSXBSAVDV-ZDUSSCGKSA-N	0	3	341.377	3.261	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2OC)C1	ZINC001034433277	1342495525	/nfs/dbraw/zinc/49/55/25/1342495525.db2.gz	OECRNNDQUCFUTP-NZSAHSFTSA-N	0	3	342.483	3.346	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@@H]2C[C@H]2c2cccc(OC)c2)C1	ZINC001034433962	1342496141	/nfs/dbraw/zinc/49/61/41/1342496141.db2.gz	UZHUZTOVSJATGR-YSIASYRMSA-N	0	3	342.483	3.346	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)Cc2c[nH]c3c2cccc3C)C1	ZINC001034437057	1342498838	/nfs/dbraw/zinc/49/88/38/1342498838.db2.gz	DFSXRJAVVNIBNC-KRWDZBQOSA-N	0	3	325.456	3.176	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)Cc2cccc(OCCC)c2)C1	ZINC001034476027	1342532356	/nfs/dbraw/zinc/53/23/56/1342532356.db2.gz	ASFJEBIPBREONO-SFHVURJKSA-N	0	3	330.472	3.175	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCCN(Cc3ccc(C)cc3)C2)nc1	ZINC001034492912	1342549654	/nfs/dbraw/zinc/54/96/54/1342549654.db2.gz	IZJGWXGDAIGNLM-HXUWFJFHSA-N	0	3	347.462	3.156	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)C[C@@H]2CCc3ccccc3C2)C1	ZINC001034501647	1342559999	/nfs/dbraw/zinc/55/99/99/1342559999.db2.gz	YIJRDUNYRBKJRS-XLIONFOSSA-N	0	3	326.484	3.338	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cc(Cl)cc3c2OCC3)C1	ZINC001034540068	1342598421	/nfs/dbraw/zinc/59/84/21/1342598421.db2.gz	DUJRNPHTHDYUSW-INIZCTEOSA-N	0	3	348.874	3.435	20	30		EGEDHN
C=C(Br)CN[C@@H]1C[C@H](NC(=O)CC2CCC2)C12CCC2	ZINC001078585055	1357019249	/nfs/dbraw/zinc/01/92/49/1357019249.db2.gz	AMOMUSQNKMBQJE-KGLIPLIRSA-N	0	3	341.293	3.102	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)[C@H]2C[C@H]2C(C)C)CC1	ZINC001034772753	1342751703	/nfs/dbraw/zinc/75/17/03/1342751703.db2.gz	YCXWKHSJAHBLEA-AJNGGQMLSA-N	0	3	343.309	3.204	20	30		EGEDHN
N#Cc1ccc(CNCc2ccc(CNC(=O)c3ccco3)cc2)cc1	ZINC001034804660	1342768746	/nfs/dbraw/zinc/76/87/46/1342768746.db2.gz	ACXIEILNMLGWBP-UHFFFAOYSA-N	0	3	345.402	3.371	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)Cc2ccc(F)cc2)C12CCC2	ZINC001078796565	1357090259	/nfs/dbraw/zinc/09/02/59/1357090259.db2.gz	BJQCGKAVMFJCTD-HZPDHXFCSA-N	0	3	336.838	3.138	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)[C@H]2CCCC23CC3)s1	ZINC001034971635	1342857878	/nfs/dbraw/zinc/85/78/78/1342857878.db2.gz	SETCNLVJRDEWSM-RHSMWYFYSA-N	0	3	343.496	3.281	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@@H]1CNCc1cn(C(C)C)nc1C	ZINC001035036616	1342890635	/nfs/dbraw/zinc/89/06/35/1342890635.db2.gz	COBCNFBDDXHXIV-UYAOXDASSA-N	0	3	346.519	3.455	20	30		EGEDHN
C=C[C@H](C(=O)N1CCC[C@@H]1CNCc1ccccn1)c1ccccc1	ZINC001035134670	1342950083	/nfs/dbraw/zinc/95/00/83/1342950083.db2.gz	ZUIHPWVBKPFHSH-UXHICEINSA-N	0	3	335.451	3.132	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC3(CCN(Cc4cnoc4C)C3)CC2)C1	ZINC001035226094	1343047138	/nfs/dbraw/zinc/04/71/38/1343047138.db2.gz	GSCCGZSEZFUPKH-UHFFFAOYSA-N	0	3	343.471	3.154	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1coc3cc(F)ccc13)CC2	ZINC001035740648	1343163163	/nfs/dbraw/zinc/16/31/63/1343163163.db2.gz	YDDSYGNCIYQKJG-UHFFFAOYSA-N	0	3	340.398	3.133	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc(COC)cs1)CC2	ZINC001035742821	1343164013	/nfs/dbraw/zinc/16/40/13/1343164013.db2.gz	ADPCXYOQRALFSP-UHFFFAOYSA-N	0	3	334.485	3.009	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccc(-n3cccc3)cc1)CC2	ZINC001035743974	1343164379	/nfs/dbraw/zinc/16/43/79/1343164379.db2.gz	BRSBCXBDZBIHMM-UHFFFAOYSA-N	0	3	347.462	3.039	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1scnc1C(C)(C)C)CC2	ZINC001035812719	1343211642	/nfs/dbraw/zinc/21/16/42/1343211642.db2.gz	QJBRRYMPZCMAJT-UHFFFAOYSA-N	0	3	345.512	3.002	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cc(C(C)C)oc1C)CC2	ZINC001035825653	1343215951	/nfs/dbraw/zinc/21/59/51/1343215951.db2.gz	ALMLLFROPSVMMY-UHFFFAOYSA-N	0	3	328.456	3.273	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@@H](CC)c1ccc(F)cc1)CC2	ZINC001035859009	1343235168	/nfs/dbraw/zinc/23/51/68/1343235168.db2.gz	OLYYWIWFGUNXOD-IBGZPJMESA-N	0	3	342.458	3.267	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cnc(CC(C)C)s1)CC2	ZINC001035860082	1343235763	/nfs/dbraw/zinc/23/57/63/1343235763.db2.gz	PTIBCAWGMUFEQF-UHFFFAOYSA-N	0	3	347.528	3.456	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)CCc1cccc(F)c1F)CC2	ZINC001035862304	1343237577	/nfs/dbraw/zinc/23/75/77/1343237577.db2.gz	CTOKWBUGLCRAMB-UHFFFAOYSA-N	0	3	348.437	3.398	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@H](NCc2cc(F)ccc2C#N)[C@@H](C)C1	ZINC001035907375	1343263938	/nfs/dbraw/zinc/26/39/38/1343263938.db2.gz	KVVHAUHLTYTKMV-KSSFIOAISA-N	0	3	331.435	3.070	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@H](NCc2cc(F)ccc2C#N)[C@@H](C)C1	ZINC001035920047	1343273074	/nfs/dbraw/zinc/27/30/74/1343273074.db2.gz	NEZFWLRQVMASOG-LIRRHRJNSA-N	0	3	345.462	3.460	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@@H]([C@@H](C)NCc2ccccc2C#N)C1	ZINC001036343940	1343430637	/nfs/dbraw/zinc/43/06/37/1343430637.db2.gz	JKRVZCFGFLPTPH-VQIMIIECSA-N	0	3	327.472	3.321	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@H]1CCCN(C(=O)c2ccco2)C1	ZINC001036346779	1343433208	/nfs/dbraw/zinc/43/32/08/1343433208.db2.gz	WZHQJKNPIMVJGP-YJBOKZPZSA-N	0	3	337.423	3.182	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)CC2CC2)[C@H]1CNCc1ccc(C#N)s1	ZINC001036492108	1343514777	/nfs/dbraw/zinc/51/47/77/1343514777.db2.gz	BPZUFUVVXWRUCO-DYVFJYSZSA-N	0	3	331.485	3.137	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC[C@H](C)[C@H]1CNCc1ccc(C#N)cc1F	ZINC001036532932	1343540589	/nfs/dbraw/zinc/54/05/89/1343540589.db2.gz	KNRZSYLGTARLRV-GODMXEIXSA-N	0	3	343.446	3.380	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3CN(C(=O)C4CCCC4)CC[C@H]32)s1	ZINC001036621440	1343580379	/nfs/dbraw/zinc/58/03/79/1343580379.db2.gz	UPQRLACVDVMXHS-MAUKXSAKSA-N	0	3	343.496	3.233	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccccc2C#N)C1	ZINC001036629974	1343588028	/nfs/dbraw/zinc/58/80/28/1343588028.db2.gz	ZCSLATPCXJDSJK-RTBURBONSA-N	0	3	325.456	3.027	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@@H]2CN(C(=O)C3=CCCC3)CC[C@@H]21	ZINC001036686796	1343629250	/nfs/dbraw/zinc/62/92/50/1343629250.db2.gz	SKZNABJYQWBVMO-UXHICEINSA-N	0	3	335.451	3.091	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2[C@H](CCN2Cc2conc2C)C1	ZINC001036793674	1343725382	/nfs/dbraw/zinc/72/53/82/1343725382.db2.gz	JLPHPNFSGIHNIU-WBVHZDCISA-N	0	3	331.460	3.008	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@H]2[C@@H](CCN2CC#Cc2ccccc2)C1	ZINC001036804039	1343738661	/nfs/dbraw/zinc/73/86/61/1343738661.db2.gz	DAFJXDOUIQLNIU-PMACEKPBSA-N	0	3	338.495	3.397	20	30		EGEDHN
CC(F)(F)CC(=O)N1CC[C@@H]2[C@H](CCN2CC#Cc2ccccc2)C1	ZINC001036811356	1343747407	/nfs/dbraw/zinc/74/74/07/1343747407.db2.gz	PKXJWTSZSZYWGF-QZTJIDSGSA-N	0	3	346.421	3.006	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]3[C@H](CCN3Cc3cc(C)ns3)C2)C1	ZINC001036816348	1343754417	/nfs/dbraw/zinc/75/44/17/1343754417.db2.gz	TUSLUQCZSFUWFT-NVXWUHKLSA-N	0	3	345.512	3.231	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)C[C@@H](C)C(C)C)[C@H](OC)C1	ZINC001212017609	1372648138	/nfs/dbraw/zinc/64/81/38/1372648138.db2.gz	MWHLKYBIYBNSJW-KZNAEPCWSA-N	0	3	326.525	3.454	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@H]1CCC[C@H]1NC(=O)C=C1CCC1	ZINC001036980218	1343907209	/nfs/dbraw/zinc/90/72/09/1343907209.db2.gz	FJMDGBOIEVVALR-VQIMIIECSA-N	0	3	341.430	3.182	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H]2CCC[C@H]2CNCc2ccccc2C#N)co1	ZINC001036995062	1343917463	/nfs/dbraw/zinc/91/74/63/1343917463.db2.gz	ZVZPITFCHWMPAV-PKOBYXMFSA-N	0	3	337.423	3.148	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCC[C@H]2CNCc2nccn2CC)CC1	ZINC001037070506	1343963963	/nfs/dbraw/zinc/96/39/63/1343963963.db2.gz	SEHUFUOTFJJYNJ-ZWKOTPCHSA-N	0	3	344.503	3.024	20	30		EGEDHN
CC[C@H]1CN(C(=O)CC(C)C)CC[C@@H]1NCc1cc(F)ccc1C#N	ZINC001037766651	1344079577	/nfs/dbraw/zinc/07/95/77/1344079577.db2.gz	NXGDFPZMZGUBPV-KXBFYZLASA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)[C@@H]1C[C@H]1c1ccc(N(C)C)cc1	ZINC001038537997	1344473072	/nfs/dbraw/zinc/47/30/72/1344473072.db2.gz	SSDJEAUCFPVXOQ-SLFFLAALSA-N	0	3	341.499	3.013	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1ccc(F)c(Cl)c1F	ZINC001038660251	1344525790	/nfs/dbraw/zinc/52/57/90/1344525790.db2.gz	BEONYMMUMPFQRW-NSHDSACASA-N	0	3	328.790	3.389	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H](C)C2CCC2)CC[C@H]1c1ccc(F)cc1	ZINC001079154665	1357197848	/nfs/dbraw/zinc/19/78/48/1357197848.db2.gz	PEWLGBIHHLGJHI-UIAACRFSSA-N	0	3	342.458	3.169	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)c2ccc(C)s2)C[C@H]1c1cccc(F)c1	ZINC001079168714	1357199645	/nfs/dbraw/zinc/19/96/45/1357199645.db2.gz	JMBOQANDWMWUQN-DLBZAZTESA-N	0	3	342.439	3.027	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)CC2=CCCCC2)C[C@H]1c1cccc(F)c1	ZINC001079174630	1357200950	/nfs/dbraw/zinc/20/09/50/1357200950.db2.gz	AMNGMVLNATVQMR-VQTJNVASSA-N	0	3	340.442	3.233	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@]2(C)CC=CCC2)C[C@H]1c1cccc(F)c1	ZINC001079185472	1357202988	/nfs/dbraw/zinc/20/29/88/1357202988.db2.gz	RNAVYMOAHDSPJO-ZVDOUQERSA-N	0	3	340.442	3.089	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)[C@H]3CCC3(F)F)CC2)C1	ZINC001039142853	1344824710	/nfs/dbraw/zinc/82/47/10/1344824710.db2.gz	OXOMTTYMSGGYPN-LSDHHAIUSA-N	0	3	346.849	3.345	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)CC(C)(F)F)CC2)C1	ZINC001039154289	1344839389	/nfs/dbraw/zinc/83/93/89/1344839389.db2.gz	TVVBVUYRGAXGEE-CQSZACIVSA-N	0	3	334.838	3.345	20	30		EGEDHN
C=C(Cl)CN1CC[C@H](C2CCN(C(=O)c3nccs3)CC2)C1	ZINC001039161097	1344845641	/nfs/dbraw/zinc/84/56/41/1344845641.db2.gz	DICKKCLKCWUURG-AWEZNQCLSA-N	0	3	339.892	3.070	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)c3nccs3)CC2)C1	ZINC001039161098	1344847029	/nfs/dbraw/zinc/84/70/29/1344847029.db2.gz	DICKKCLKCWUURG-CQSZACIVSA-N	0	3	339.892	3.070	20	30		EGEDHN
CC(=O)N1CCCC[C@H]1[C@H]1CCN(CC#Cc2ccc(Cl)cc2)C1	ZINC001039174693	1344866075	/nfs/dbraw/zinc/86/60/75/1344866075.db2.gz	BMYRYTUWNINSOZ-ICSRJNTNSA-N	0	3	344.886	3.414	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]([C@H]3CCCCN3C(=O)C3CC3)C2)s1	ZINC001039183523	1344882540	/nfs/dbraw/zinc/88/25/40/1344882540.db2.gz	LBDPGBDHMWSSED-MAUKXSAKSA-N	0	3	343.496	3.233	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc(F)ccc2F)C1	ZINC001039212434	1344927205	/nfs/dbraw/zinc/92/72/05/1344927205.db2.gz	FZZYUYKPRRCNDU-KXBFYZLASA-N	0	3	346.421	3.305	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(C(C)C)nc2)C1	ZINC001039212524	1344927361	/nfs/dbraw/zinc/92/73/61/1344927361.db2.gz	GXXJGBYRMKWUSX-UYAOXDASSA-N	0	3	339.483	3.155	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(C(C)C)nc2)C1	ZINC001039212521	1344927580	/nfs/dbraw/zinc/92/75/80/1344927580.db2.gz	GXXJGBYRMKWUSX-ICSRJNTNSA-N	0	3	339.483	3.155	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2ccc(F)c(F)c2)C1	ZINC001039215011	1344930991	/nfs/dbraw/zinc/93/09/91/1344930991.db2.gz	ROWMWZDZBHUKAK-LPHOPBHVSA-N	0	3	346.421	3.305	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(CC)o2)C1	ZINC001039215691	1344932189	/nfs/dbraw/zinc/93/21/89/1344932189.db2.gz	YFKQQJFFVNXQTI-SJLPKXTDSA-N	0	3	328.456	3.182	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2nc(C)sc2C)C1	ZINC001039219989	1344938042	/nfs/dbraw/zinc/93/80/42/1344938042.db2.gz	WKMCWVSYVSPASH-IRXDYDNUSA-N	0	3	345.512	3.100	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cccc(F)c2Cl)C1	ZINC001039237827	1344960318	/nfs/dbraw/zinc/96/03/18/1344960318.db2.gz	LAHHOFYECIWVQU-RHSMWYFYSA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(C)c(F)c2F)C1	ZINC001039237507	1344960328	/nfs/dbraw/zinc/96/03/28/1344960328.db2.gz	IUFDPUMTHJMPML-NVXWUHKLSA-N	0	3	346.421	3.223	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cnc3ccccc3c2)C1	ZINC001039238265	1344961693	/nfs/dbraw/zinc/96/16/93/1344961693.db2.gz	NAYZFGPEOHPLRX-NQIIRXRSSA-N	0	3	347.462	3.185	20	30		EGEDHN
CC#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(OC)cc2)C1	ZINC001039242381	1344969189	/nfs/dbraw/zinc/96/91/89/1344969189.db2.gz	BIRSTQQQLGONJN-QUCCMNQESA-N	0	3	340.467	3.035	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2sccc2CC)C1	ZINC001039244753	1344972762	/nfs/dbraw/zinc/97/27/62/1344972762.db2.gz	YTJCVEQRBREGQM-SJORKVTESA-N	0	3	330.497	3.260	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)CC(C2CC2)C2CC2)C1	ZINC001039244909	1344973679	/nfs/dbraw/zinc/97/36/79/1344973679.db2.gz	ZOPOMHZAIRBRDS-AZUAARDMSA-N	0	3	328.500	3.149	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)Cc2c[nH]c3ccccc23)C1	ZINC001039246118	1344975622	/nfs/dbraw/zinc/97/56/22/1344975622.db2.gz	PEALFLQYSOTWGJ-UWJYYQICSA-N	0	3	349.478	3.047	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cc3c(s2)CCC3)C1	ZINC001039249235	1344979599	/nfs/dbraw/zinc/97/95/99/1344979599.db2.gz	HGYBKWUEMISLKJ-DLBZAZTESA-N	0	3	342.508	3.187	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)Cc2sc(C)cc2C)C1	ZINC001039250567	1344981895	/nfs/dbraw/zinc/98/18/95/1344981895.db2.gz	PLFUGKBWJAEZGS-ZWKOTPCHSA-N	0	3	344.524	3.244	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2cccc3ccncc32)C1	ZINC001039258390	1344986791	/nfs/dbraw/zinc/98/67/91/1344986791.db2.gz	XCCPPRYODIHGTR-GHTZIAJQSA-N	0	3	347.462	3.185	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@H]1Cc2ccccc2O1	ZINC001039379778	1345035362	/nfs/dbraw/zinc/03/53/62/1345035362.db2.gz	IFZCVTNFENKJAT-CEXWTWQISA-N	0	3	340.467	3.022	20	30		EGEDHN
C=CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc(C)c(Cl)c1	ZINC001039392723	1345042209	/nfs/dbraw/zinc/04/22/09/1345042209.db2.gz	BHGPOCNLCFSULC-SJORKVTESA-N	0	3	332.875	3.442	20	30		EGEDHN
C=CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ncc(Cl)s1	ZINC001039404511	1345050301	/nfs/dbraw/zinc/05/03/01/1345050301.db2.gz	FGQMXVZBMHNAGM-NEPJUHHUSA-N	0	3	325.865	3.052	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H]1CCCC1(F)F	ZINC001039424644	1345062172	/nfs/dbraw/zinc/06/21/72/1345062172.db2.gz	AZBWWBKFVINFNN-XHSDSOJGSA-N	0	3	326.431	3.453	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc2cc(F)ccc2o1	ZINC001039446154	1345071191	/nfs/dbraw/zinc/07/11/91/1345071191.db2.gz	VGTALQXKIXUJAT-SJORKVTESA-N	0	3	340.398	3.274	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1coc2ccc(F)cc12	ZINC001039463660	1345081939	/nfs/dbraw/zinc/08/19/39/1345081939.db2.gz	ANFXYMXSGIYQEU-CVEARBPZSA-N	0	3	340.398	3.274	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)Cc1ccc(C)cc1	ZINC001039474694	1345089489	/nfs/dbraw/zinc/08/94/89/1345089489.db2.gz	VHBJFEKKLKZNTJ-NRSPTQNISA-N	0	3	338.495	3.262	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc(C)n(C(C)C)n1	ZINC001039479815	1345093601	/nfs/dbraw/zinc/09/36/01/1345093601.db2.gz	QSUKWUYHRBUBEE-SJORKVTESA-N	0	3	330.476	3.027	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC[C@@H]1CCOC1	ZINC001039896633	1345238756	/nfs/dbraw/zinc/23/87/56/1345238756.db2.gz	NSLOSXDBPGHCPA-XSYGEPLQSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC1CCOCC1	ZINC001039897104	1345239330	/nfs/dbraw/zinc/23/93/30/1345239330.db2.gz	UKJDMIURASHSFA-NSHGMRRFSA-N	0	3	334.504	3.081	20	30		EGEDHN
C#Cc1ccc(C(=O)N2C[C@H]3CCC[C@@H](C2)N3CC(CC)CC)nc1	ZINC001039979406	1345277064	/nfs/dbraw/zinc/27/70/64/1345277064.db2.gz	UGLWFQPCWSIEJL-KDURUIRLSA-N	0	3	339.483	3.178	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@]3(CCN(C(=O)/C=C/C4CC4)C3)C2)cc1	ZINC001040134436	1345346232	/nfs/dbraw/zinc/34/62/32/1345346232.db2.gz	POGLEYFZEXDJDQ-HYGBKTPJSA-N	0	3	349.478	3.339	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3cccc(OCCC)c3)C2)C1	ZINC001040229618	1345385153	/nfs/dbraw/zinc/38/51/53/1345385153.db2.gz	UWOBYOCAJNBGKO-OAQYLSRUSA-N	0	3	340.467	3.037	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cc(COC)cs3)C2)C1	ZINC001040284575	1345412119	/nfs/dbraw/zinc/41/21/19/1345412119.db2.gz	WPZHZDSGHZFKOW-GOSISDBHSA-N	0	3	334.485	3.009	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)CCc3ccc(F)cc3)C2)C1	ZINC001040284935	1345412219	/nfs/dbraw/zinc/41/22/19/1345412219.db2.gz	XOHBHZRSNNLMIG-OAQYLSRUSA-N	0	3	342.458	3.096	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3c[nH]c4ccccc34)C2)C1	ZINC001040284516	1345412392	/nfs/dbraw/zinc/41/23/92/1345412392.db2.gz	VYMMFRMRAKJAJN-OAQYLSRUSA-N	0	3	335.451	3.119	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3c(F)cc(C)cc3F)C2)C1	ZINC001040289284	1345413759	/nfs/dbraw/zinc/41/37/59/1345413759.db2.gz	NLSZJIJKZTVFHB-LJQANCHMSA-N	0	3	334.410	3.387	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@]2(C1)CCCN(Cc1cccnc1C)C2	ZINC001040329497	1345434971	/nfs/dbraw/zinc/43/49/71/1345434971.db2.gz	UYQJTDRKISXWJY-OAQYLSRUSA-N	0	3	341.499	3.417	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3occc3C(C)C)C2)C1	ZINC001040351557	1345449389	/nfs/dbraw/zinc/44/93/89/1345449389.db2.gz	UHTLEUKYUKAWSK-HXUWFJFHSA-N	0	3	328.456	3.354	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3coc(C(F)F)c3)C2)C1	ZINC001040354449	1345450586	/nfs/dbraw/zinc/45/05/86/1345450586.db2.gz	PLGGJEODIRHQBA-SFHVURJKSA-N	0	3	336.382	3.169	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)Cc3cc(C)ccc3C)C2)C1	ZINC001040370779	1345460042	/nfs/dbraw/zinc/46/00/42/1345460042.db2.gz	DVDXEBOFHHLSDN-JOCHJYFZSA-N	0	3	338.495	3.184	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)[C@@H](c3ccccc3)C(C)C)C2)C1	ZINC001040417407	1345486228	/nfs/dbraw/zinc/48/62/28/1345486228.db2.gz	FWPRNDDCYDRQRO-IFMALSPDSA-N	0	3	338.495	3.374	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@@H]3C[C@H]3c3cccc(C)c3)C2)C1	ZINC001040444767	1345503460	/nfs/dbraw/zinc/50/34/60/1345503460.db2.gz	WHPGWQHOUSAOPC-VWPQPMDRSA-N	0	3	336.479	3.046	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3ccc4sccc4c3)C2)C1	ZINC001040480093	1345514210	/nfs/dbraw/zinc/51/42/10/1345514210.db2.gz	RRNIOVKQVHHXNH-FQEVSTJZSA-N	0	3	338.476	3.463	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3ncsc3C(C)C)C2)C1	ZINC001040492082	1345517223	/nfs/dbraw/zinc/51/72/23/1345517223.db2.gz	LZFMUVYYTRFDQL-LJQANCHMSA-N	0	3	345.512	3.218	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cnn([C@@H](C)CC)c3C)C2)C1	ZINC001040493136	1345519013	/nfs/dbraw/zinc/51/90/13/1345519013.db2.gz	YYKZCGIZKRUXEH-OXJNMPFZSA-N	0	3	344.503	3.277	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cn(CCCC)nc3C)C2)C1	ZINC001040492988	1345519147	/nfs/dbraw/zinc/51/91/47/1345519147.db2.gz	WPMOIAYFEMSFBE-HXUWFJFHSA-N	0	3	344.503	3.106	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@H](C)c3ccc(C)cc3)C2)C1	ZINC001040496014	1345520442	/nfs/dbraw/zinc/52/04/42/1345520442.db2.gz	CYCYZCARKVLZJV-KNQAVFIVSA-N	0	3	338.495	3.436	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@H](C)c3ccc(F)c(F)c3)C2)C1	ZINC001040540801	1345537490	/nfs/dbraw/zinc/53/74/90/1345537490.db2.gz	WOMLZGGPRRKFLE-QRWLVFNGSA-N	0	3	346.421	3.016	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(C(C)(F)F)cc3)C2)C1	ZINC001040557503	1345545572	/nfs/dbraw/zinc/54/55/72/1345545572.db2.gz	YKCXYHCKKKSTMV-HXUWFJFHSA-N	0	3	346.421	3.360	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cc4c(o3)CCCC4)C2)CC1	ZINC001040722061	1345570400	/nfs/dbraw/zinc/57/04/00/1345570400.db2.gz	KBNIVZZVKFTHEN-UHFFFAOYSA-N	0	3	340.467	3.110	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)CCc3ccsc3)C2)CC1	ZINC001040725618	1345571291	/nfs/dbraw/zinc/57/12/91/1345571291.db2.gz	DKLMTOKQDGIUCE-UHFFFAOYSA-N	0	3	330.497	3.019	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cccc4cccnc43)C2)CC1	ZINC001040764623	1345576181	/nfs/dbraw/zinc/57/61/81/1345576181.db2.gz	ZTUMALPGTRIWMG-UHFFFAOYSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)[C@@H](C)OC3CCCCCC3)C2)CC1	ZINC001040841637	1345587161	/nfs/dbraw/zinc/58/71/61/1345587161.db2.gz	KZOICZKBTGXQQS-GOSISDBHSA-N	0	3	346.515	3.062	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@H](C)c3ccc(C)s3)C2)CC1	ZINC001040910811	1345598311	/nfs/dbraw/zinc/59/83/11/1345598311.db2.gz	SUZYRXYXMHWNQG-QGZVFWFLSA-N	0	3	344.524	3.498	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3coc4ccc(F)cc34)C2)CC1	ZINC001040926542	1345601973	/nfs/dbraw/zinc/60/19/73/1345601973.db2.gz	LBXURFMSCAHODA-UHFFFAOYSA-N	0	3	340.398	3.133	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@]3(CCN(Cc4ccc(C#N)cc4)C3)C2)o1	ZINC001041044257	1345634436	/nfs/dbraw/zinc/63/44/36/1345634436.db2.gz	CJXOECWKKXOCRG-NRFANRHFSA-N	0	3	349.434	3.198	20	30		EGEDHN
Cc1cccc(Cl)c1CN1CC[C@@]2(CCN(C(=O)[C@H](C)C#N)C2)C1	ZINC001041137492	1345658677	/nfs/dbraw/zinc/65/86/77/1345658677.db2.gz	UBYRFBIJJJLRGJ-DNVCBOLYSA-N	0	3	345.874	3.233	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@]3(CCN(C(=O)C4=CCCC4)C3)C2)cc1	ZINC001041202287	1345677081	/nfs/dbraw/zinc/67/70/81/1345677081.db2.gz	ZJVNSIPMEBZVRW-NRFANRHFSA-N	0	3	335.451	3.093	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3coc4cc(F)ccc43)C2)C1	ZINC001041428088	1345726069	/nfs/dbraw/zinc/72/60/69/1345726069.db2.gz	MNLZLDAUHJQZFA-HXUWFJFHSA-N	0	3	340.398	3.133	20	30		EGEDHN
C=CCN1CC[C@]2(CCN(C(=O)c3cc(-c4ccccc4)no3)C2)C1	ZINC001041438347	1345727387	/nfs/dbraw/zinc/72/73/87/1345727387.db2.gz	YAMSRJKAOFZXDV-FQEVSTJZSA-N	0	3	337.423	3.066	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)CCc3ccc(Cl)cc3)C2)C1	ZINC001041519821	1345751198	/nfs/dbraw/zinc/75/11/98/1345751198.db2.gz	RSNDEFDQJFDJAW-FQEVSTJZSA-N	0	3	344.886	3.220	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3c(C)cc(F)cc3C)C2)C1	ZINC001041532398	1345754618	/nfs/dbraw/zinc/75/46/18/1345754618.db2.gz	QXIOFOLSYXOFOB-HXUWFJFHSA-N	0	3	328.431	3.004	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@]2(CCN(Cc3oc(CC)nc3C)C2)C1	ZINC001041544334	1345759053	/nfs/dbraw/zinc/75/90/53/1345759053.db2.gz	NAARAKPMFDVRKP-HXUWFJFHSA-N	0	3	345.487	3.182	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@]2(CCN(Cc3cnc(C)s3)C2)C1	ZINC001041625933	1345800480	/nfs/dbraw/zinc/80/04/80/1345800480.db2.gz	MPUQHBTYBVKDCV-RBUKOAKNSA-N	0	3	347.528	3.478	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@]2(CCN(Cc3ccccn3)C2)C1	ZINC001041627042	1345801580	/nfs/dbraw/zinc/80/15/80/1345801580.db2.gz	ZPUOOKPXNVSFSQ-UXHICEINSA-N	0	3	327.472	3.108	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)Cc3c(C)cc(C)cc3C)C2)C1	ZINC001041633866	1345804209	/nfs/dbraw/zinc/80/42/09/1345804209.db2.gz	ZTICUXQQHWXOEN-JOCHJYFZSA-N	0	3	338.495	3.102	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)[C@@H](C)Cc3ccccc3Cl)C2)C1	ZINC001041714967	1345828612	/nfs/dbraw/zinc/82/86/12/1345828612.db2.gz	AXDPSYYXYXIYHM-OXJNMPFZSA-N	0	3	344.886	3.076	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccc4[nH]c(C)c(C)c4c3)C2)C1	ZINC001041823053	1345863944	/nfs/dbraw/zinc/86/39/44/1345863944.db2.gz	WHJJUXUOUAGYBM-JOCHJYFZSA-N	0	3	349.478	3.346	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3CCN(C(=O)c4ccccc4)C[C@@H]32)cc1	ZINC001041906524	1345890734	/nfs/dbraw/zinc/89/07/34/1345890734.db2.gz	KJMCAGUMSUDBBI-CTNGQTDRSA-N	0	3	345.446	3.295	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3cccc(Cl)c3C)C[C@@H]21	ZINC001042067184	1345934768	/nfs/dbraw/zinc/93/47/68/1345934768.db2.gz	OHOCIPOAFKEDLC-QAPCUYQASA-N	0	3	330.859	3.208	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(C)c4ccccc4n3)C[C@H]21	ZINC001042115210	1345947788	/nfs/dbraw/zinc/94/77/88/1345947788.db2.gz	SWCHMGBBOAHLTB-OXJNMPFZSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)C3CCc4ccccc4CC3)C[C@@H]21	ZINC001042125306	1345950864	/nfs/dbraw/zinc/95/08/64/1345950864.db2.gz	RKWCKJJPMAKKTH-FPOVZHCZSA-N	0	3	338.495	3.290	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3c(F)cc(C)cc3F)C[C@@H]21	ZINC001042146064	1345956857	/nfs/dbraw/zinc/95/68/57/1345956857.db2.gz	KVMFLCLSKQTUQR-YOEHRIQHSA-N	0	3	334.410	3.386	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)CCc3ccc(C(C)C)cc3)C[C@H]21	ZINC001042150728	1345957309	/nfs/dbraw/zinc/95/73/09/1345957309.db2.gz	YXLHHTYOCAJLEW-NHCUHLMSSA-N	0	3	338.495	3.299	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)CCc3ccc(Cl)cc3)C[C@@H]21	ZINC001042168429	1345964086	/nfs/dbraw/zinc/96/40/86/1345964086.db2.gz	UZDCJESPMBZXAC-HKUYNNGSSA-N	0	3	344.886	3.219	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc(Cl)c(Cl)[nH]3)C[C@@H]21	ZINC001042174870	1345966525	/nfs/dbraw/zinc/96/65/25/1345966525.db2.gz	YTTOADDEVTXVDP-GWCFXTLKSA-N	0	3	328.243	3.044	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2CCN(CCc3csc(C)n3)[C@@H]2C1	ZINC001042181659	1345969759	/nfs/dbraw/zinc/96/97/59/1345969759.db2.gz	IEURLAGIEUVFNR-DOTOQJQBSA-N	0	3	347.528	3.129	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]2CCN(CCC(F)(F)F)[C@H]2C1	ZINC001042183748	1345971129	/nfs/dbraw/zinc/97/11/29/1345971129.db2.gz	MGZGLHJNEVGQEA-KBPBESRZSA-N	0	3	332.410	3.464	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3cccc(OC)c3)[C@@H]2C1	ZINC001042184466	1345971918	/nfs/dbraw/zinc/97/19/18/1345971918.db2.gz	WSTGLFBCVFNBSH-PKOBYXMFSA-N	0	3	342.483	3.330	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3coc(C4CCCC4)n3)C[C@@H]21	ZINC001042293648	1346020175	/nfs/dbraw/zinc/02/01/75/1346020175.db2.gz	HSVPMUJENYWYAD-YOEHRIQHSA-N	0	3	329.444	3.055	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3coc(C4CCC4)n3)C[C@H]21	ZINC001042304515	1346024914	/nfs/dbraw/zinc/02/49/14/1346024914.db2.gz	ONAQHYUERXJFMI-WMLDXEAASA-N	0	3	329.444	3.055	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3ccc(C4CC4)s3)C[C@@H]21	ZINC001042314050	1346029273	/nfs/dbraw/zinc/02/92/73/1346029273.db2.gz	XDFNJHGVFMYYRQ-HOCLYGCPSA-N	0	3	328.481	3.185	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3cccc(C#N)c3)[C@@H]2C1	ZINC001042324934	1346033362	/nfs/dbraw/zinc/03/33/62/1346033362.db2.gz	XSPFKQXIYBVLIV-ZWKOTPCHSA-N	0	3	325.456	3.027	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3sccc3C(F)F)C[C@H]21	ZINC001042330874	1346038404	/nfs/dbraw/zinc/03/84/04/1346038404.db2.gz	IFQVRLUAWSKSBV-TZMCWYRMSA-N	0	3	338.423	3.245	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc4ccccc4c3)C[C@H]21	ZINC001042335552	1346042034	/nfs/dbraw/zinc/04/20/34/1346042034.db2.gz	LMXWPXQNFPOYFY-GHTZIAJQSA-N	0	3	332.447	3.400	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc4ncsc4c3)C[C@@H]21	ZINC001042338861	1346043665	/nfs/dbraw/zinc/04/36/65/1346043665.db2.gz	NBQQIGAXPIFTRF-BBRMVZONSA-N	0	3	327.453	3.019	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(OCC(C)C)cc3)C[C@H]21	ZINC001042340166	1346044705	/nfs/dbraw/zinc/04/47/05/1346044705.db2.gz	FNQRGKRMIVJHHL-YLJYHZDGSA-N	0	3	342.483	3.444	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3ccc(C(C)C)s3)C[C@@H]21	ZINC001042369817	1346059944	/nfs/dbraw/zinc/05/99/44/1346059944.db2.gz	AYGJSKQPLZSWDR-CVEARBPZSA-N	0	3	330.497	3.431	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3csc(CC(C)C)n3)C[C@H]21	ZINC001042373371	1346061986	/nfs/dbraw/zinc/06/19/86/1346061986.db2.gz	FWQMEQKZULPTBC-NVXWUHKLSA-N	0	3	347.528	3.454	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@@H](NCc3ccccc3C#N)C[C@H]2C)o1	ZINC001044446396	1346335165	/nfs/dbraw/zinc/33/51/65/1346335165.db2.gz	KCGXVYQUEJHKHH-RDTXWAMCSA-N	0	3	337.423	3.243	20	30		EGEDHN
C[C@@H]1C[C@@H]([NH2+]Cc2ccccc2C#N)CCN1C(=O)c1ccccc1[O-]	ZINC001044476185	1346343784	/nfs/dbraw/zinc/34/37/84/1346343784.db2.gz	PLCDQBYMJMWRBU-QAPCUYQASA-N	0	3	349.434	3.047	20	30		EGEDHN
C[C@H]1C[C@H]([NH2+]Cc2cccc(C#N)c2)CCN1C(=O)c1ccccc1[O-]	ZINC001044478692	1346343989	/nfs/dbraw/zinc/34/39/89/1346343989.db2.gz	OCDRZOUAZDTNHE-MAUKXSAKSA-N	0	3	349.434	3.047	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@H](NCc2cc(F)ccc2C#N)C[C@@H]1C	ZINC001044541655	1346364490	/nfs/dbraw/zinc/36/44/90/1346364490.db2.gz	DLWLAEWRESPVCM-GUYCJALGSA-N	0	3	347.409	3.430	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3snnc3C)C[C@@H]2C)CC1	ZINC001044729172	1346413917	/nfs/dbraw/zinc/41/39/17/1346413917.db2.gz	FOQPKZVPLWGELN-XJKSGUPXSA-N	0	3	348.516	3.062	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](NCc3ocnc3C)C[C@H]2C)CC1	ZINC001044732033	1346415233	/nfs/dbraw/zinc/41/52/33/1346415233.db2.gz	ZAVBQVZASWYNSF-PBHICJAKSA-N	0	3	331.460	3.199	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)c2cccc(F)c2)s1	ZINC001044906073	1346459912	/nfs/dbraw/zinc/45/99/12/1346459912.db2.gz	DHSOSBSJVNBFOQ-HNNXBMFYSA-N	0	3	343.427	3.153	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H]1CNCc1c(C)nsc1C	ZINC001045148991	1346506683	/nfs/dbraw/zinc/50/66/83/1346506683.db2.gz	KZZLSVPYBVIKDP-HNNXBMFYSA-N	0	3	335.517	3.443	20	30		EGEDHN
CC(C)(C(=O)N1CCC[C@H]1CNCc1ccc(C#N)s1)C1CC1	ZINC001045162670	1346511018	/nfs/dbraw/zinc/51/10/18/1346511018.db2.gz	NNUSSKAANFSRDW-AWEZNQCLSA-N	0	3	331.485	3.137	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N1CCC[C@H]1CNCc1ccccc1Cl	ZINC001045208181	1346530283	/nfs/dbraw/zinc/53/02/83/1346530283.db2.gz	WNVVUDJIPBPIEM-JZXOWHBKSA-N	0	3	348.874	3.012	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2coc3ccc(OC)cc32)CC1	ZINC001045498859	1346610123	/nfs/dbraw/zinc/61/01/23/1346610123.db2.gz	ARWBNQMIBCJXMB-UHFFFAOYSA-N	0	3	328.412	3.212	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2ccc(CC)c(CC)c2)CC1	ZINC001045658425	1346661783	/nfs/dbraw/zinc/66/17/83/1346661783.db2.gz	PBWGDHKKIKTVJU-UHFFFAOYSA-N	0	3	326.484	3.419	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@]3(C2)CCCCN(C(=O)C(F)F)C3)c1	ZINC001045905519	1346742125	/nfs/dbraw/zinc/74/21/25/1346742125.db2.gz	HZHFUPOTKYKHLH-IBGZPJMESA-N	0	3	347.409	3.028	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H]1C[C@H]1CC(C)(C)C)C2	ZINC001045938471	1346774258	/nfs/dbraw/zinc/77/42/58/1346774258.db2.gz	BXOLQSBRFJDBMJ-WAOWUJCRSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc(C)sc1C)C2	ZINC001045950611	1346785320	/nfs/dbraw/zinc/78/53/20/1346785320.db2.gz	HJLPTVIQUFAPLJ-IBGZPJMESA-N	0	3	330.497	3.316	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cccc(C(C)C)n1)C2	ZINC001045950609	1346785393	/nfs/dbraw/zinc/78/53/93/1346785393.db2.gz	HFTTXAHQXPVUIS-NRFANRHFSA-N	0	3	339.483	3.156	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)C1(C3CCC3)CCC1)C2	ZINC001045955643	1346790474	/nfs/dbraw/zinc/79/04/74/1346790474.db2.gz	UVAAOGIUDWKYHN-HXUWFJFHSA-N	0	3	328.500	3.295	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc3ncccc3c1)C2	ZINC001045963045	1346798194	/nfs/dbraw/zinc/79/81/94/1346798194.db2.gz	VZZCMKWPWUJNSC-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc(C)ccc1F)C2	ZINC001045969241	1346804464	/nfs/dbraw/zinc/80/44/64/1346804464.db2.gz	MWAXOQNXEUPCCC-NRFANRHFSA-N	0	3	342.458	3.476	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H](CC)OC1CCCC1)C2	ZINC001045971061	1346806812	/nfs/dbraw/zinc/80/68/12/1346806812.db2.gz	MHHCBVJSXQHZRM-CTNGQTDRSA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cc(Cl)cs1)C2	ZINC001045971022	1346807035	/nfs/dbraw/zinc/80/70/35/1346807035.db2.gz	LFKAVGNKWYHPJJ-KRWDZBQOSA-N	0	3	336.888	3.353	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1oc(CC)cc1C)C2	ZINC001045979469	1346816855	/nfs/dbraw/zinc/81/68/55/1346816855.db2.gz	FCXSMNNQDSPXHB-NRFANRHFSA-N	0	3	342.483	3.492	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1cncc3ccccc31)C2	ZINC001045984692	1346825430	/nfs/dbraw/zinc/82/54/30/1346825430.db2.gz	GVEHEZREBBYFPU-QFIPXVFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1c[nH]c3ccc(C)cc13)C2	ZINC001045986059	1346827037	/nfs/dbraw/zinc/82/70/37/1346827037.db2.gz	GCEANWLYAMMUAJ-JOCHJYFZSA-N	0	3	349.478	3.428	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1c(C)cccc1F)C2	ZINC001045987497	1346829392	/nfs/dbraw/zinc/82/93/92/1346829392.db2.gz	TYFPTZAMSMBLDY-NRFANRHFSA-N	0	3	342.458	3.476	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N[C@]1(C)CCN(Cc2cccc(C)c2)C1	ZINC001046320716	1346934619	/nfs/dbraw/zinc/93/46/19/1346934619.db2.gz	YNTCZHJRSFHKLP-SVFBPWRDSA-N	0	3	342.483	3.057	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)[C@@H]2CC[C@H](c3ccccc3)O2)C1	ZINC001046326473	1346935507	/nfs/dbraw/zinc/93/55/07/1346935507.db2.gz	NUZNSPGYAZFMHK-HBFSDRIKSA-N	0	3	328.456	3.063	20	30		EGEDHN
C=C(C)CCN1CC[C@](C)(NC(=O)c2cnc([C@@H]3CCCO3)s2)C1	ZINC001046685985	1347061684	/nfs/dbraw/zinc/06/16/84/1347061684.db2.gz	GKJZOWZULQZUMH-KSSFIOAISA-N	0	3	349.500	3.155	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2cccc(N3CCCC3)c2)C1	ZINC001046725886	1347073516	/nfs/dbraw/zinc/07/35/16/1347073516.db2.gz	GFFNKYPIIDNIGC-HXUWFJFHSA-N	0	3	327.472	3.057	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2ccc(OCC(C)C)cc2)C1	ZINC001046819462	1347118486	/nfs/dbraw/zinc/11/84/86/1347118486.db2.gz	XQHYYDDBMODQRC-HXUWFJFHSA-N	0	3	330.472	3.492	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2conc2C(C)C)C1	ZINC001046942311	1347158332	/nfs/dbraw/zinc/15/83/32/1347158332.db2.gz	ILBOOACVSRNZOX-CYBMUJFWSA-N	0	3	341.402	3.061	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@@H](CNC(=O)C2CCC(C)(C)CC2)C1	ZINC001046996570	1347179101	/nfs/dbraw/zinc/17/91/01/1347179101.db2.gz	VQZMCPKBRSHSAD-INIZCTEOSA-N	0	3	340.458	3.300	20	30		EGEDHN
CC1(C(=O)N[C@H]2C[C@H]3C[C@@H](C2)N(CC#Cc2ccccc2)C3)CCC1	ZINC001047128074	1347214502	/nfs/dbraw/zinc/21/45/02/1347214502.db2.gz	WQYBZWZHYGUAPP-UFYCRDLUSA-N	0	3	336.479	3.197	20	30		EGEDHN
CC1(C(=O)N[C@@H]2C[C@H]3C[C@@H](C2)N(CC#Cc2ccccc2)C3)CC=CC1	ZINC001047141473	1347218385	/nfs/dbraw/zinc/21/83/85/1347218385.db2.gz	UQUPQRXVVKNTQY-HBMCJLEFSA-N	0	3	348.490	3.364	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@H]3[C@@H]4CCCC[C@@H]43)C2)CC1	ZINC001047232833	1347261503	/nfs/dbraw/zinc/26/15/03/1347261503.db2.gz	PIMSKFAGWNDQGJ-VNTMZGSJSA-N	0	3	328.500	3.006	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)[C@H](CC)SC)C2)CC1	ZINC001047238004	1347264547	/nfs/dbraw/zinc/26/45/47/1347264547.db2.gz	VXBIURZEEUVWJK-MSOLQXFVSA-N	0	3	336.545	3.102	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)/C=C\c3ccc[nH]3)C2)CC1	ZINC001047241446	1347267565	/nfs/dbraw/zinc/26/75/65/1347267565.db2.gz	PXWOSIDVHDAAKI-QWUACUGRSA-N	0	3	339.483	3.002	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)C3CC4(CCC4)C3)C2)CC1	ZINC001047251240	1347276209	/nfs/dbraw/zinc/27/62/09/1347276209.db2.gz	HJYCRRFWXVJBHW-SFHVURJKSA-N	0	3	328.500	3.151	20	30		EGEDHN
CC#CCN1CCC([C@@H]2CCCN(C(=O)C[C@H](C)C3CC3)C2)CC1	ZINC001047265737	1347286558	/nfs/dbraw/zinc/28/65/58/1347286558.db2.gz	MCJZSGCQZIZZAR-FXAWDEMLSA-N	0	3	330.516	3.397	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)C2CCCCC2)C1	ZINC001047688955	1347331679	/nfs/dbraw/zinc/33/16/79/1347331679.db2.gz	VHUAYNYQDJQVOH-OXJNMPFZSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)CC2CCC2)C1	ZINC001047772772	1347366620	/nfs/dbraw/zinc/36/66/20/1347366620.db2.gz	JDCXGFPJHMSKOM-HNAYVOBHSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@H]([C@H](C)NCc2cc(C)no2)C1	ZINC001047855401	1347390227	/nfs/dbraw/zinc/39/02/27/1347390227.db2.gz	LRAVCCRBLREPTM-JSGCOSHPSA-N	0	3	339.867	3.088	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]([C@@H](C)NCc2nc(C)oc2C)C1	ZINC001047924309	1347411430	/nfs/dbraw/zinc/41/14/30/1347411430.db2.gz	MXWSDIQJTPMKFT-CJNGLKHVSA-N	0	3	333.476	3.220	20	30		EGEDHN
C[C@@H]1CN(C(=O)CC(C)(C)C)C[C@H]1CNCc1ccccc1C#N	ZINC001048147598	1347480946	/nfs/dbraw/zinc/48/09/46/1347480946.db2.gz	NIYLGMQXEVOWFF-CRAIPNDOSA-N	0	3	327.472	3.179	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCC2CCC2)C[C@@H]1CNCc1ccccc1C#N	ZINC001048199490	1347491843	/nfs/dbraw/zinc/49/18/43/1347491843.db2.gz	YHHAXMHMANSVLD-UZLBHIALSA-N	0	3	339.483	3.323	20	30		EGEDHN
CC(C)=C(F)C(=O)N1C[C@H](C)[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001048210201	1347495724	/nfs/dbraw/zinc/49/57/24/1347495724.db2.gz	LAIROUSGISCBNF-XJKSGUPXSA-N	0	3	347.409	3.145	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2(F)CCCC2)C[C@@H]1CNCc1ccccc1C#N	ZINC001048295916	1347511815	/nfs/dbraw/zinc/51/18/15/1347511815.db2.gz	RPKUYAUVHXAFKW-QAPCUYQASA-N	0	3	343.446	3.025	20	30		EGEDHN
CCC1(C(=O)N2C[C@H](C)[C@@H](CNCc3ccccc3C#N)C2)CCC1	ZINC001048342063	1347523922	/nfs/dbraw/zinc/52/39/22/1347523922.db2.gz	GGVFAEYFMDYROR-LPHOPBHVSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H](C)[C@@H](CNCc3ncc(C)s3)C2)CC1	ZINC001048373019	1347533967	/nfs/dbraw/zinc/53/39/67/1347533967.db2.gz	JAFJMQMJZSEFCX-PBHICJAKSA-N	0	3	347.528	3.382	20	30		EGEDHN
C=C(C)CN1CCC(N(Cc2ccccn2)C(=O)[C@@H]2CC2(F)F)CC1	ZINC001048628514	1347624728	/nfs/dbraw/zinc/62/47/28/1347624728.db2.gz	ZRMROVFFXZDXPT-KRWDZBQOSA-N	0	3	349.425	3.106	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc4ccccc4cc3F)C[C@@H]2C1	ZINC001048932969	1347687127	/nfs/dbraw/zinc/68/71/27/1347687127.db2.gz	XBAJSRLTIZAGMR-HDICACEKSA-N	0	3	336.410	3.006	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C(CC)(CC)c3ccccc3)C[C@@H]2C1	ZINC001049226474	1347751003	/nfs/dbraw/zinc/75/10/03/1347751003.db2.gz	MQMSUXBEVBBQTL-KDURUIRLSA-N	0	3	338.495	3.158	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@H]2CCCN3C(=O)CC2CCC2)c1	ZINC001049392375	1347817327	/nfs/dbraw/zinc/81/73/27/1347817327.db2.gz	YVVRJPAWYIRFAH-UXHICEINSA-N	0	3	337.467	3.314	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)/C=C/C2CC2)cc1	ZINC001049399886	1347822187	/nfs/dbraw/zinc/82/21/87/1347822187.db2.gz	ZQZOADPKNZMWAC-ILXKITPQSA-N	0	3	335.451	3.090	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc2ccccc2nc1C	ZINC001049514192	1347886145	/nfs/dbraw/zinc/88/61/45/1347886145.db2.gz	YHBOWDBOLUQYHY-UXHICEINSA-N	0	3	335.451	3.408	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H]3[C@@H]2CCCN3C(=O)C2(C3CC3)CC2)cc1	ZINC001049541691	1347898976	/nfs/dbraw/zinc/89/89/76/1347898976.db2.gz	ONRHXXHHFKXETA-VQTJNVASSA-N	0	3	349.478	3.314	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(-c2cnco2)cc1	ZINC001049554385	1347906277	/nfs/dbraw/zinc/90/62/77/1347906277.db2.gz	CHQBHECJXYRXGS-ZWKOTPCHSA-N	0	3	337.423	3.207	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(-c2cnco2)cc1	ZINC001049554362	1347906389	/nfs/dbraw/zinc/90/63/89/1347906389.db2.gz	CHQBHECJXYRXGS-MSOLQXFVSA-N	0	3	337.423	3.207	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2CCC[C@@H]3[C@@H]2CCN3CC=C)cc1	ZINC001049556846	1347907660	/nfs/dbraw/zinc/90/76/60/1347907660.db2.gz	ZDHVMJNKFGQRPB-MOPGFXCFSA-N	0	3	326.440	3.116	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(C)n([C@H](C)CC)n1	ZINC001049564690	1347912590	/nfs/dbraw/zinc/91/25/90/1347912590.db2.gz	PITPMPUBTKAHAT-ZTFGCOKTSA-N	0	3	330.476	3.027	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1cccc(C(C)C)c1	ZINC001049567949	1347913878	/nfs/dbraw/zinc/91/38/78/1347913878.db2.gz	QNMHLAHVOYWSGG-RTWAWAEBSA-N	0	3	338.495	3.441	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cn1c(C)cc2ccccc21	ZINC001049579397	1347919629	/nfs/dbraw/zinc/91/96/29/1347919629.db2.gz	GMAZSZMZHRODEP-PMACEKPBSA-N	0	3	337.467	3.201	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1cccc2cccnc21	ZINC001049626746	1347941500	/nfs/dbraw/zinc/94/15/00/1347941500.db2.gz	SBEJLJSAGCYNAD-MOPGFXCFSA-N	0	3	335.451	3.029	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cc1cc2ccccc2o1	ZINC001049631574	1347943909	/nfs/dbraw/zinc/94/39/09/1347943909.db2.gz	WRBQAEKXJJGVRL-RTBURBONSA-N	0	3	336.435	3.064	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc2c(c1)[C@H](C)CO2	ZINC001049665193	1347963983	/nfs/dbraw/zinc/96/39/83/1347963983.db2.gz	UJMWOFHKKPAKMN-ZTFGCOKTSA-N	0	3	326.440	3.047	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(Cl)cc1OC	ZINC001049671489	1347965793	/nfs/dbraw/zinc/96/57/93/1347965793.db2.gz	LNMTZLZFNNGIQV-CVEARBPZSA-N	0	3	334.847	3.214	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1c(F)ccc(F)c1F	ZINC001049677361	1347968690	/nfs/dbraw/zinc/96/86/90/1347968690.db2.gz	UIACQYBWZJMHMW-LSDHHAIUSA-N	0	3	338.373	3.359	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccccc1-n1cccc1	ZINC001049686808	1347972114	/nfs/dbraw/zinc/97/21/14/1347972114.db2.gz	HOEIWEKPHLPPCH-WOJBJXKFSA-N	0	3	335.451	3.342	20	30		EGEDHN
CC1(C(=O)N2CCC[C@@H]3[C@H]2CCN3Cc2cccc(C#N)c2)CC=CC1	ZINC001049690304	1347973699	/nfs/dbraw/zinc/97/36/99/1347973699.db2.gz	OVVHPQHKOSDUOS-WOJBJXKFSA-N	0	3	349.478	3.480	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@@H]3[C@H]2CCN3Cc2ccc(C#N)cc2)CC1	ZINC001049694963	1347976567	/nfs/dbraw/zinc/97/65/67/1347976567.db2.gz	GDRCJQYJGORCJT-RTBURBONSA-N	0	3	337.467	3.314	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(C(C)C)cn1	ZINC001049723763	1347990984	/nfs/dbraw/zinc/99/09/84/1347990984.db2.gz	OPHMMXPRFOFDPD-RTBURBONSA-N	0	3	327.472	3.460	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CCC[C@H]2[C@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049768951	1348011867	/nfs/dbraw/zinc/01/18/67/1348011867.db2.gz	MABIHXRWGWXRMO-FFZOFVMBSA-N	0	3	339.483	3.416	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)Cc1ccc(Cl)s1	ZINC001049771060	1348013733	/nfs/dbraw/zinc/01/37/33/1348013733.db2.gz	VQOKCNKCWZVABQ-GJZGRUSLSA-N	0	3	336.888	3.033	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C[C@@H](C)c1ccccc1F	ZINC001049788940	1348022546	/nfs/dbraw/zinc/02/25/46/1348022546.db2.gz	SMBLGTPLIZQQES-NSISKUIASA-N	0	3	342.458	3.408	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C(C)(C)c1ccccc1F	ZINC001049788818	1348022702	/nfs/dbraw/zinc/02/27/02/1348022702.db2.gz	RIDVDPGINXUBDU-QZTJIDSGSA-N	0	3	330.447	3.355	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cnn(C2CCCCC2)c1	ZINC001049830615	1348044423	/nfs/dbraw/zinc/04/44/23/1348044423.db2.gz	HHHYLEYMHJUIEN-MOPGFXCFSA-N	0	3	342.487	3.253	20	30		EGEDHN
C#CCCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(C2CC2)s1	ZINC001049839977	1348051993	/nfs/dbraw/zinc/05/19/93/1348051993.db2.gz	KKGBRJTWYFUDLE-JKSUJKDBSA-N	0	3	328.481	3.328	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1oc(CCC)nc1C	ZINC001049849114	1348057915	/nfs/dbraw/zinc/05/79/15/1348057915.db2.gz	NTMQVSSDOYJBJH-HZPDHXFCSA-N	0	3	331.460	3.191	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H](CC)Oc1ccccc1F	ZINC001049850154	1348058483	/nfs/dbraw/zinc/05/84/83/1348058483.db2.gz	SDHYTYMCRUQLRC-KZNAEPCWSA-N	0	3	346.446	3.234	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)C(C)(C)c1ccc(F)cc1	ZINC001049854410	1348060799	/nfs/dbraw/zinc/06/07/99/1348060799.db2.gz	LAAOHGBQNKZZJR-ROUUACIJSA-N	0	3	330.447	3.355	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)C12CC3CC(CC(C3)C1)C2	ZINC001049856674	1348063903	/nfs/dbraw/zinc/06/39/03/1348063903.db2.gz	GRNIFOUBEFCEKW-VQIYKNCMSA-N	0	3	328.500	3.454	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1occ2c1CCCC2	ZINC001049863904	1348071027	/nfs/dbraw/zinc/07/10/27/1348071027.db2.gz	PQAOLFVOKZKSII-ZWKOTPCHSA-N	0	3	328.456	3.413	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N1CCC[C@@H]2[C@@H]1CCN2C[C@H](F)CC	ZINC001049868238	1348074144	/nfs/dbraw/zinc/07/41/44/1348074144.db2.gz	RTMFLFKNDUMPPX-AQNXPRMDSA-N	0	3	342.458	3.024	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)C2(c3cccc(Cl)c3)CC2)C1	ZINC001079804643	1357387482	/nfs/dbraw/zinc/38/74/82/1357387482.db2.gz	BJBVGTXENMCJGB-RHSMWYFYSA-N	0	3	332.875	3.384	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cnn(C(C)(C)C)c1CC	ZINC001049899746	1348099969	/nfs/dbraw/zinc/09/99/69/1348099969.db2.gz	GPDDEXJIPTYGBL-MSOLQXFVSA-N	0	3	344.503	3.065	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](C)c1ccc(F)cc1F	ZINC001049904180	1348103327	/nfs/dbraw/zinc/10/33/27/1348103327.db2.gz	NEOAECRJMKWWDI-MDASCCDHSA-N	0	3	346.421	3.157	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(F)c2occc21	ZINC001049905815	1348104201	/nfs/dbraw/zinc/10/42/01/1348104201.db2.gz	BFLNMTIBXYPCKN-MSOLQXFVSA-N	0	3	340.398	3.274	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1nsc2ccccc21	ZINC001049907697	1348105520	/nfs/dbraw/zinc/10/55/20/1348105520.db2.gz	FBDXXWJMPIIPRY-DLBZAZTESA-N	0	3	341.480	3.090	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1c(Cl)cccc1OC	ZINC001049914844	1348109399	/nfs/dbraw/zinc/10/93/99/1348109399.db2.gz	RHLNPFZDJFXCRI-LSDHHAIUSA-N	0	3	334.847	3.214	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C12CC(c3ccccc3)(C1)C2	ZINC001049916982	1348110810	/nfs/dbraw/zinc/11/08/10/1348110810.db2.gz	KCJMZFRPAGWGSF-LAXGTINGSA-N	0	3	336.479	3.360	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1[nH]c2ccccc2c1OC	ZINC001049919919	1348112846	/nfs/dbraw/zinc/11/28/46/1348112846.db2.gz	YPSZPXVVUGNPPZ-IRXDYDNUSA-N	0	3	339.439	3.041	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cnc(C(C)(C)C)s1	ZINC001049922748	1348114797	/nfs/dbraw/zinc/11/47/97/1348114797.db2.gz	RNMABJIKYHCTSD-CABCVRRESA-N	0	3	345.512	3.143	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@]1(C)CCc2ccccc2C1	ZINC001049937846	1348123476	/nfs/dbraw/zinc/12/34/76/1348123476.db2.gz	WCVZRPYENHVGNG-KCZVDYSFSA-N	0	3	338.495	3.433	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3CCCN(C(=O)C[C@@H]4C=CCC4)[C@@H]3C2)c1	ZINC001049965110	1348136829	/nfs/dbraw/zinc/13/68/29/1348136829.db2.gz	COHAIHQJFMIPLF-JRGCBEDISA-N	0	3	349.478	3.337	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3CCCN(C(=O)[C@H]4[C@@H]5CCC[C@@H]54)[C@@H]3C2)cc1	ZINC001050011769	1348153711	/nfs/dbraw/zinc/15/37/11/1348153711.db2.gz	RIIYFZREJJGUHM-WRTQPQOASA-N	0	3	349.478	3.027	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)Cc3coc4cc(F)ccc34)[C@@H]2C1	ZINC001050043574	1348163712	/nfs/dbraw/zinc/16/37/12/1348163712.db2.gz	DWUQHXGKQIOTDE-KBXCAEBGSA-N	0	3	342.414	3.223	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3coc(C(C)(C)C)n3)[C@@H]2C1	ZINC001050046770	1348164877	/nfs/dbraw/zinc/16/48/77/1348164877.db2.gz	MNRVKRZYRKAWBS-GOEBONIOSA-N	0	3	331.460	3.085	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3ccc(C(C)C)nc3)[C@@H]2C1	ZINC001050067040	1348170992	/nfs/dbraw/zinc/17/09/92/1348170992.db2.gz	LNFWTGXEWUCWFY-PKOBYXMFSA-N	0	3	327.472	3.318	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)CCc3ccccc3OCC)[C@@H]2C1	ZINC001050089153	1348178953	/nfs/dbraw/zinc/17/89/53/1348178953.db2.gz	VLKPLFHXIWJAKL-RBUKOAKNSA-N	0	3	342.483	3.127	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)Cc3cccc(C(F)F)c3)[C@@H]2C1	ZINC001050094291	1348181349	/nfs/dbraw/zinc/18/13/49/1348181349.db2.gz	RLCWVNSLGVADDN-ZWKOTPCHSA-N	0	3	346.421	3.113	20	30		EGEDHN
CC1(CC(=O)N2CCC[C@H]3CN(Cc4ccc(C#N)cc4)C[C@H]32)CC1	ZINC001050099159	1348183039	/nfs/dbraw/zinc/18/30/39/1348183039.db2.gz	BWGOVWCSGIITKG-RBUKOAKNSA-N	0	3	337.467	3.171	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)CCc3ccc(Cl)cc3)[C@@H]2C1	ZINC001050104083	1348184235	/nfs/dbraw/zinc/18/42/35/1348184235.db2.gz	HPBXQPZRYKVNKA-PKOBYXMFSA-N	0	3	344.886	3.219	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3ccc(C(F)F)c(F)c3)[C@@H]2C1	ZINC001050138912	1348194359	/nfs/dbraw/zinc/19/43/59/1348194359.db2.gz	ZUOMBOKUIWWDKF-XJKSGUPXSA-N	0	3	338.373	3.486	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3coc(C4CCCC4)n3)[C@@H]2C1	ZINC001050176049	1348202961	/nfs/dbraw/zinc/20/29/61/1348202961.db2.gz	LSLNEJBMPZZQGH-FUHWJXTLSA-N	0	3	343.471	3.445	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCCN(C(=O)c3sccc3COC)[C@@H]2C1	ZINC001050182764	1348204598	/nfs/dbraw/zinc/20/45/98/1348204598.db2.gz	AXVVVQYZWOEMRB-GOEBONIOSA-N	0	3	334.485	3.007	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)CCc3ccc(CC)cc3)[C@@H]2C1	ZINC001050198579	1348209406	/nfs/dbraw/zinc/20/94/06/1348209406.db2.gz	KBAFPSPCIZFRAM-VQTJNVASSA-N	0	3	326.484	3.290	20	30		EGEDHN
C#CCCN1C[C@@H]2CCCN(C(=O)c3cc4cccc(C)c4o3)[C@@H]2C1	ZINC001050209517	1348211435	/nfs/dbraw/zinc/21/14/35/1348211435.db2.gz	DHMLVARXIRRCGP-ZWKOTPCHSA-N	0	3	336.435	3.301	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)cc1)c1ccc(CNC(=O)C2CC2)cc1	ZINC001050256205	1348220067	/nfs/dbraw/zinc/22/00/67/1348220067.db2.gz	OUPXWVGDICNHKO-OAHLLOKOSA-N	0	3	333.435	3.435	20	30		EGEDHN
C[C@H]1C[C@H]1C(=O)N[C@H]1CC[C@H](CNCc2cc(F)ccc2C#N)CC1	ZINC001050284380	1348226568	/nfs/dbraw/zinc/22/65/68/1348226568.db2.gz	KKXHWBDIZJWGEV-KODHJQJWSA-N	0	3	343.446	3.118	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N[C@H]1CC[C@H](CNCc2cc(F)ccc2C#N)CC1	ZINC001050284381	1348226674	/nfs/dbraw/zinc/22/66/74/1348226674.db2.gz	KKXHWBDIZJWGEV-LSOMNZGLSA-N	0	3	343.446	3.118	20	30		EGEDHN
CC(C)CC(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001050412255	1348256286	/nfs/dbraw/zinc/25/62/86/1348256286.db2.gz	YUGXUCWALSPJNK-UHFFFAOYSA-N	0	3	325.456	3.029	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC2(C1)CCN(C[C@@H](F)CC)CC2	ZINC001050531793	1348284642	/nfs/dbraw/zinc/28/46/42/1348284642.db2.gz	LVASHXYMSFMMPT-AWEZNQCLSA-N	0	3	330.875	3.438	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C[C@H](C)c3cccc(F)c3)C2)CC1	ZINC001050656122	1348319010	/nfs/dbraw/zinc/31/90/10/1348319010.db2.gz	YJELLOPRQYAQKE-KRWDZBQOSA-N	0	3	342.458	3.267	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC3(C2)CCN(Cc2oc(C)nc2C)CC3)C1	ZINC001050657309	1348319553	/nfs/dbraw/zinc/31/95/53/1348319553.db2.gz	OLMMSCXUDCLKPI-UHFFFAOYSA-N	0	3	343.471	3.072	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H](F)CC3CCCCC3)C2)CC1	ZINC001050731730	1348340673	/nfs/dbraw/zinc/34/06/73/1348340673.db2.gz	PKNVQMRHSHBUDJ-SFHVURJKSA-N	0	3	334.479	3.243	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cccc4ccccc43)C2)CC1	ZINC001050745345	1348346233	/nfs/dbraw/zinc/34/62/33/1348346233.db2.gz	MTNYLTSMLUMZRJ-UHFFFAOYSA-N	0	3	332.447	3.401	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3ccc(-c4cccs4)o3)C2)CC1	ZINC001050745136	1348346573	/nfs/dbraw/zinc/34/65/73/1348346573.db2.gz	BERRYELXPZUIIZ-UHFFFAOYSA-N	0	3	340.448	3.179	20	30		EGEDHN
C=C(C)CN1CCc2c(CNC(=O)c3cscn3)cccc2C1	ZINC001051282478	1348416804	/nfs/dbraw/zinc/41/68/04/1348416804.db2.gz	QNJAWCGTDMLIFI-UHFFFAOYSA-N	0	3	327.453	3.007	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H](NC(=O)C3(C4CC4)CC3)CC2)cc1	ZINC001052474718	1348550073	/nfs/dbraw/zinc/55/00/73/1348550073.db2.gz	WOPCQBFZGHFLIB-LJQANCHMSA-N	0	3	337.467	3.219	20	30		EGEDHN
C[C@@H](C(=O)N[C@H]1CCCN(Cc2ccc(C#N)cc2)CC1)C1CCC1	ZINC001052485784	1348552887	/nfs/dbraw/zinc/55/28/87/1348552887.db2.gz	DLTDGTGPAZNVPD-UZLBHIALSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)Cc2cccc(C(C)C)c2)CC1	ZINC001052527060	1348566421	/nfs/dbraw/zinc/56/64/21/1348566421.db2.gz	QFCOCUOKZWPXRG-HXUWFJFHSA-N	0	3	326.484	3.347	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2scnc2C2CCCC2)CC1	ZINC001052532393	1348568203	/nfs/dbraw/zinc/56/82/03/1348568203.db2.gz	FDWJDPDZDAZUFE-OAHLLOKOSA-N	0	3	331.485	3.018	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(F)cc2F)CC1	ZINC001052581872	1348585771	/nfs/dbraw/zinc/58/57/71/1348585771.db2.gz	BAAUZFLYJKUQSB-RYQLBKOJSA-N	0	3	346.421	3.062	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2sccc2-n2cccc2)CC1	ZINC001052607137	1348594956	/nfs/dbraw/zinc/59/49/56/1348594956.db2.gz	DWZZRYDKEWLVRD-INIZCTEOSA-N	0	3	341.480	3.146	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCCN(Cc3ncccc3C)CC2)C1	ZINC001052690789	1348634315	/nfs/dbraw/zinc/63/43/15/1348634315.db2.gz	POZZCPAHSKWYML-KRWDZBQOSA-N	0	3	327.472	3.217	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N[C@@H]1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC001052697018	1348638857	/nfs/dbraw/zinc/63/88/57/1348638857.db2.gz	XNEBESCVQAAUAV-VAMGGRTRSA-N	0	3	339.483	3.465	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@@H]2C[C@H]2c2ccc(C)s2)CC1	ZINC001052779537	1348675809	/nfs/dbraw/zinc/67/58/09/1348675809.db2.gz	HTNDFBINMGDGJF-BRWVUGGUSA-N	0	3	330.497	3.154	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2csc(-c3ccoc3)n2)CC1	ZINC001052799261	1348684875	/nfs/dbraw/zinc/68/48/75/1348684875.db2.gz	HXMIJDCBHPNMAQ-OAHLLOKOSA-N	0	3	343.452	3.011	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc(C(F)(F)F)cc2)CC1	ZINC001052886458	1348723604	/nfs/dbraw/zinc/72/36/04/1348723604.db2.gz	LEXXKGYGFYJKOD-INIZCTEOSA-N	0	3	338.373	3.313	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccsc2C(F)F)CC1	ZINC001052900855	1348734283	/nfs/dbraw/zinc/73/42/83/1348734283.db2.gz	LAEOEINBFVJRGE-LBPRGKRZSA-N	0	3	326.412	3.293	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)Cc2ccc3ccccc3c2)CC1	ZINC001052920553	1348749077	/nfs/dbraw/zinc/74/90/77/1348749077.db2.gz	ZSHJIPBRFCOMSV-OAQYLSRUSA-N	0	3	334.463	3.376	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)Cc2ccc3c(c2)CCCC3)CC1	ZINC001052925272	1348751263	/nfs/dbraw/zinc/75/12/63/1348751263.db2.gz	OFERYDHZBCACJI-NRFANRHFSA-N	0	3	338.495	3.102	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)/C=C(\C)C2CC2)C1	ZINC001053072331	1348887973	/nfs/dbraw/zinc/88/79/73/1348887973.db2.gz	QFTONUVENPPDIE-TWMXPDRFSA-N	0	3	328.500	3.459	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)Cc2ccc(C)o2)C1	ZINC001053080837	1348902448	/nfs/dbraw/zinc/90/24/48/1348902448.db2.gz	SZLLXSYJCDIOFS-UYAOXDASSA-N	0	3	342.483	3.247	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2occ3c2CCC3)C1	ZINC001053093057	1348920715	/nfs/dbraw/zinc/92/07/15/1348920715.db2.gz	UVWJAQOMFBPPEA-APWZRJJASA-N	0	3	340.467	3.108	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(C)co2)C1	ZINC001053094177	1348922637	/nfs/dbraw/zinc/92/26/37/1348922637.db2.gz	UIMUOLCNOJUUMB-MSOLQXFVSA-N	0	3	328.456	3.318	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cc[nH]c2C2CC2)C1	ZINC001053096060	1348926173	/nfs/dbraw/zinc/92/61/73/1348926173.db2.gz	ONRASGNVUCAXCR-PKOBYXMFSA-N	0	3	339.483	3.232	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2nc(C)oc2C)C1	ZINC001053101320	1348934688	/nfs/dbraw/zinc/93/46/88/1348934688.db2.gz	NCKMVZMJHYTSLU-QZTJIDSGSA-N	0	3	343.471	3.021	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)Cc2ccccc2C)C1	ZINC001053104113	1348939510	/nfs/dbraw/zinc/93/95/10/1348939510.db2.gz	CBWYOZVHLBXUEM-LEWJYISDSA-N	0	3	338.495	3.264	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2oc(CC)cc2C)C1	ZINC001053105016	1348941505	/nfs/dbraw/zinc/94/15/05/1348941505.db2.gz	LAESVYDQNDYKFS-HKUYNNGSSA-N	0	3	342.483	3.490	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(C)nc2C)C1	ZINC001053106010	1348943150	/nfs/dbraw/zinc/94/31/50/1348943150.db2.gz	RLCRADFFUKEAGN-UYAOXDASSA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(F)cc2F)C1	ZINC001053106954	1348945669	/nfs/dbraw/zinc/94/56/69/1348945669.db2.gz	XYNDCIPJMFSTKK-BEFAXECRSA-N	0	3	346.421	3.305	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1c(C)c(F)ccc1Cl)C2	ZINC001054155711	1349158954	/nfs/dbraw/zinc/15/89/54/1349158954.db2.gz	XYGNCAMBGYHRMG-IBGZPJMESA-N	0	3	348.849	3.349	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc3ccccc3s1)C2	ZINC001054160930	1349162562	/nfs/dbraw/zinc/16/25/62/1349162562.db2.gz	SIZDYWZYGQDWOK-FQEVSTJZSA-N	0	3	338.476	3.463	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(C)c(F)c1)C2	ZINC001054161495	1349163714	/nfs/dbraw/zinc/16/37/14/1349163714.db2.gz	HFZWZKKEPXVQTL-FQEVSTJZSA-N	0	3	328.431	3.086	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc3cc(C)ccc3[nH]1)C2	ZINC001054174587	1349176314	/nfs/dbraw/zinc/17/63/14/1349176314.db2.gz	UUXSFPOTNXPVNM-QFIPXVFZSA-N	0	3	349.478	3.428	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)N1CCC[C@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001054176690	1349178693	/nfs/dbraw/zinc/17/86/93/1349178693.db2.gz	KUHZOSADVMSAMU-OZOXKJRCSA-N	0	3	337.467	3.029	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)C[C@H]1CCCC1(F)F)C2	ZINC001054184679	1349187295	/nfs/dbraw/zinc/18/72/95/1349187295.db2.gz	JTQZREHQFDTYJW-AEFFLSMTSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc3occc3s1)C2	ZINC001054196468	1349198349	/nfs/dbraw/zinc/19/83/49/1349198349.db2.gz	HVEOKCMQBLUUHX-IBGZPJMESA-N	0	3	342.464	3.446	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H](C)c1cc(C)oc1C)C2	ZINC001054215313	1349214543	/nfs/dbraw/zinc/21/45/43/1349214543.db2.gz	QYQYAIWVMAZWHW-UWJYYQICSA-N	0	3	342.483	3.338	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc(C(C)C)oc1C)C2	ZINC001054221771	1349217242	/nfs/dbraw/zinc/21/72/42/1349217242.db2.gz	BAINVSXKMIVDPG-HXUWFJFHSA-N	0	3	328.456	3.273	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc3c(c1)CCC=C3)C2	ZINC001054228605	1349222380	/nfs/dbraw/zinc/22/23/80/1349222380.db2.gz	UNYZNUFERRBIOE-QFIPXVFZSA-N	0	3	334.463	3.207	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1oc(CC)cc1C)C2	ZINC001054228553	1349222399	/nfs/dbraw/zinc/22/23/99/1349222399.db2.gz	SRWOWTNYKWTITN-HXUWFJFHSA-N	0	3	328.456	3.102	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1sccc1C1CC1)C2	ZINC001054236677	1349229387	/nfs/dbraw/zinc/22/93/87/1349229387.db2.gz	MNQWXGOAYRNZJK-LJQANCHMSA-N	0	3	328.481	3.187	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H](C)c1ccc(F)cc1F)C2	ZINC001054241971	1349235356	/nfs/dbraw/zinc/23/53/56/1349235356.db2.gz	CDTHRVRMKOELOH-MGPUTAFESA-N	0	3	346.421	3.016	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc3c(cccc3C)o1)C2	ZINC001054245738	1349239851	/nfs/dbraw/zinc/23/98/51/1349239851.db2.gz	ATGUESLLQFVSKL-OAQYLSRUSA-N	0	3	336.435	3.303	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(C(C)(F)F)cc1)C2	ZINC001054250667	1349246098	/nfs/dbraw/zinc/24/60/98/1349246098.db2.gz	YTOFQXOLFOLEGD-FQEVSTJZSA-N	0	3	346.421	3.360	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@H]3CCCO[C@@H]3C)cc2C1	ZINC001054262289	1349260208	/nfs/dbraw/zinc/26/02/08/1349260208.db2.gz	URKVIVAIXFOLCS-BEFAXECRSA-N	0	3	328.456	3.010	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@@H]3CC[C@@H](OC)C3)cc2C1	ZINC001054270990	1349270483	/nfs/dbraw/zinc/27/04/83/1349270483.db2.gz	DQFWMCRCXSAPRJ-VQIMIIECSA-N	0	3	328.456	3.010	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@@H]3CCC[C@H](OC)C3)cc2C1	ZINC001054278882	1349279735	/nfs/dbraw/zinc/27/97/35/1349279735.db2.gz	QECLVYJFTCRVRQ-XLIONFOSSA-N	0	3	342.483	3.400	20	30		EGEDHN
Cc1csc(C(=O)N2C[C@H](C)[C@H](NCc3ccc(C#N)s3)C2)c1	ZINC001054633186	1349423103	/nfs/dbraw/zinc/42/31/03/1349423103.db2.gz	JGSDPAGBXFVPGA-SWLSCSKDSA-N	0	3	345.493	3.240	20	30		EGEDHN
C[C@H]1CN(C(=O)C2(C3CC3)CCC2)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054933589	1349517527	/nfs/dbraw/zinc/51/75/27/1349517527.db2.gz	BQQNWXHAABFCSV-GUYCJALGSA-N	0	3	343.496	3.137	20	30		EGEDHN
C[C@H]1CN(C(=O)C2(C)CCCC2)C[C@H]1NCc1ccc(C#N)c(F)c1	ZINC001054942823	1349523251	/nfs/dbraw/zinc/52/32/51/1349523251.db2.gz	AVLHZBKMFFCSLW-KBXCAEBGSA-N	0	3	343.446	3.214	20	30		EGEDHN
CCC(C)(C)C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001055026283	1349555926	/nfs/dbraw/zinc/55/59/26/1349555926.db2.gz	MMUZUDZNIZQILS-CXAGYDPISA-N	0	3	331.435	3.070	20	30		EGEDHN
C=C(C)CCN1C[C@@H](C)[C@H](NC(=O)c2scnc2C(F)F)C1	ZINC001080108087	1357487297	/nfs/dbraw/zinc/48/72/97/1357487297.db2.gz	GHVDBIFTAZBSKX-GHMZBOCLSA-N	0	3	329.416	3.097	20	30		EGEDHN
C#CCCN1C[C@@H](C)[C@H](NC(=O)c2cc(C3CC3)oc2C2CC2)C1	ZINC001080168934	1357509587	/nfs/dbraw/zinc/50/95/87/1357509587.db2.gz	FMWJKIMXWKXCFX-CXAGYDPISA-N	0	3	326.440	3.108	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)Cc2cccc3sccc32)C1	ZINC001080557398	1357678436	/nfs/dbraw/zinc/67/84/36/1357678436.db2.gz	SDVHMTQIARQLMA-RHSMWYFYSA-N	0	3	328.481	3.456	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc(Cl)c(Cl)[nH]1	ZINC001085750293	1358732075	/nfs/dbraw/zinc/73/20/75/1358732075.db2.gz	BCTQRPAKWPRXQZ-NSHDSACASA-N	0	3	330.259	3.434	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H](C)O[C@]3(CCN(CC=C(C)C)C3)C2)CC1	ZINC001071202313	1354502888	/nfs/dbraw/zinc/50/28/88/1354502888.db2.gz	SXNRSGUOMGTJOD-RXVVDRJESA-N	0	3	346.515	3.391	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1ccc(F)c(C)c1)C[C@@H](C)O2	ZINC001071203717	1354503760	/nfs/dbraw/zinc/50/37/60/1354503760.db2.gz	GSFQFRPMWKZHRT-UZLBHIALSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C1(C)CCCCC1)C[C@H](C)O2	ZINC001071206533	1354504662	/nfs/dbraw/zinc/50/46/62/1354504662.db2.gz	LQHGDNKPXNRFKG-PXNSSMCTSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](C)O[C@@]3(CCN(CC=C(C)C)C3)C2)C1	ZINC001071211570	1354507785	/nfs/dbraw/zinc/50/77/85/1354507785.db2.gz	KEDISUAVWXOSBM-YLJYHZDGSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1ccc(CC)cc1)C[C@H](C)O2	ZINC001071238887	1354521941	/nfs/dbraw/zinc/52/19/41/1354521941.db2.gz	SLZOWSLOGCLVGY-UWJYYQICSA-N	0	3	342.483	3.131	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1cc(C)c(C)s1)C[C@@H](C)O2	ZINC001071238433	1354521999	/nfs/dbraw/zinc/52/19/99/1354521999.db2.gz	MMSRVOOAZWCILF-DNVCBOLYSA-N	0	3	348.512	3.246	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)CC(C1CC1)C1CC1)C[C@@H](C)O2	ZINC001071244343	1354524430	/nfs/dbraw/zinc/52/44/30/1354524430.db2.gz	SYNUMJYMHVBGIW-IERDGZPVSA-N	0	3	346.515	3.081	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccc3ccccc3n2)C1	ZINC001086860245	1359216152	/nfs/dbraw/zinc/21/61/52/1359216152.db2.gz	RBKVYWILKBNSOP-GOEBONIOSA-N	0	3	343.858	3.475	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cn(-c3ccccc3)cn2)CC[C@H]1C	ZINC001071527548	1354747299	/nfs/dbraw/zinc/74/72/99/1354747299.db2.gz	FSBLVJFYINAYLF-IAGOWNOFSA-N	0	3	338.455	3.031	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)CC[C@H]2CCCO2)C1	ZINC001088268406	1359823328	/nfs/dbraw/zinc/82/33/28/1359823328.db2.gz	NSWJNXSYHCYUDR-JKSUJKDBSA-N	0	3	328.884	3.059	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2(c3cccc(Cl)c3)CC2)CC[C@@H]1C	ZINC001071544458	1354757939	/nfs/dbraw/zinc/75/79/39/1354757939.db2.gz	YWJKVHWXGFFXPZ-YJBOKZPZSA-N	0	3	344.886	3.364	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCCC[C@@H](NCc2c(C)noc2C)C1	ZINC001088359324	1359843278	/nfs/dbraw/zinc/84/32/78/1359843278.db2.gz	WNQFFQABTXLHLZ-MRXNPFEDSA-N	0	3	333.476	3.364	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2conc2C2CCCC2)CC[C@@H]1C	ZINC001071561705	1354764792	/nfs/dbraw/zinc/76/47/92/1354764792.db2.gz	TXISZMHQFLIUIL-HOCLYGCPSA-N	0	3	331.460	3.491	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc3c([nH]2)c(F)ccc3C)CC[C@@H]1C	ZINC001071624717	1354808316	/nfs/dbraw/zinc/80/83/16/1354808316.db2.gz	JKUTUETXNQXGQN-GJZGRUSLSA-N	0	3	341.430	3.221	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc(C)nn2C(CC)CC)CC[C@H]1C	ZINC001071631642	1354814120	/nfs/dbraw/zinc/81/41/20/1354814120.db2.gz	PNYCPURDCFWJKF-SJORKVTESA-N	0	3	344.503	3.159	20	30		EGEDHN
C=CCCN1C[C@H](NC(=O)c2scnc2C(F)F)CC[C@H]1C	ZINC001071675727	1354843564	/nfs/dbraw/zinc/84/35/64/1354843564.db2.gz	GSUOVIDVTMTSLX-GHMZBOCLSA-N	0	3	329.416	3.240	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cncc(OC(C)C)c2)CC[C@H]1C	ZINC001071739028	1354889172	/nfs/dbraw/zinc/88/91/72/1354889172.db2.gz	MAYWJCWGYPEQGY-NVXWUHKLSA-N	0	3	331.460	3.028	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)c2ccc(F)c3ccncc23)CC[C@@H]1C	ZINC001071759389	1354907778	/nfs/dbraw/zinc/90/77/78/1354907778.db2.gz	HDPUMJILBYKQAR-UONOGXRCSA-N	0	3	327.403	3.143	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cncc3sccc32)CC[C@H]1C	ZINC001071765716	1354912775	/nfs/dbraw/zinc/91/27/75/1354912775.db2.gz	JWOQANZCQJIDBN-KGLIPLIRSA-N	0	3	329.469	3.455	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc3cc(OC)ccc3[nH]2)CC[C@H]1C	ZINC001071779027	1354926121	/nfs/dbraw/zinc/92/61/21/1354926121.db2.gz	DHZATCLBTZYKTQ-GDBMZVCRSA-N	0	3	341.455	3.335	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)Cc2cn(C)c3ccccc23)CC[C@H]1C	ZINC001071779725	1354927105	/nfs/dbraw/zinc/92/71/05/1354927105.db2.gz	ODYMRLIRHWIWMT-SJLPKXTDSA-N	0	3	339.483	3.266	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CC[C@@H](C)N(CC3=CCCCC3)C2)c1	ZINC001071814613	1354955889	/nfs/dbraw/zinc/95/58/89/1354955889.db2.gz	KLBBSCZESXVFFM-OXQOHEQNSA-N	0	3	337.467	3.146	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc(-c3cccs3)n[nH]2)CC[C@H]1C	ZINC001071831170	1354967827	/nfs/dbraw/zinc/96/78/27/1354967827.db2.gz	AOQOIRVJWDWKPU-ZIAGYGMSSA-N	0	3	344.484	3.297	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2c(C)noc2C(F)(F)F)CC[C@H]1C	ZINC001071854729	1354982264	/nfs/dbraw/zinc/98/22/64/1354982264.db2.gz	FFWXDIWKBVUDRG-PWSUYJOCSA-N	0	3	345.365	3.161	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cnc(-c3ccccc3)[nH]2)CC[C@@H]1C	ZINC001071857136	1354986607	/nfs/dbraw/zinc/98/66/07/1354986607.db2.gz	DQKKXRAIPYFWHG-RDJZCZTQSA-N	0	3	338.455	3.236	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(C(C)C)[nH]c2=O)CC[C@@H]1C	ZINC001071879536	1355002414	/nfs/dbraw/zinc/00/24/14/1355002414.db2.gz	FJNCOFBEWBZUJK-GJZGRUSLSA-N	0	3	331.460	3.069	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)Cc2ccccc2OC(C)C)CC[C@@H]1C	ZINC001071890528	1355008734	/nfs/dbraw/zinc/00/87/34/1355008734.db2.gz	NSHWLZLFSGEGJH-FUHWJXTLSA-N	0	3	330.472	3.171	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cccc(OC(C)C)n2)CC[C@@H]1C	ZINC001071942459	1355036122	/nfs/dbraw/zinc/03/61/22/1355036122.db2.gz	PTJZPAGRNXDBJR-JKSUJKDBSA-N	0	3	331.460	3.028	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2[nH]c3ccc(C)cc3c2C)CC[C@@H]1C	ZINC001071954953	1355041243	/nfs/dbraw/zinc/04/12/43/1355041243.db2.gz	ZFYPGUZOXNIVJG-RDJZCZTQSA-N	0	3	337.467	3.391	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccnc(C(F)(F)F)c2)CC[C@H]1C	ZINC001071961713	1355046130	/nfs/dbraw/zinc/04/61/30/1355046130.db2.gz	VDMPMAVCVOVMFH-OCCSQVGLSA-N	0	3	341.377	3.259	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccnc(C(F)(F)F)c2)CC[C@H]1C	ZINC001071961714	1355046438	/nfs/dbraw/zinc/04/64/38/1355046438.db2.gz	VDMPMAVCVOVMFH-TZMCWYRMSA-N	0	3	341.377	3.259	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cnn(CCC(C)C)c2C)CC[C@H]1C	ZINC001071972825	1355054497	/nfs/dbraw/zinc/05/44/97/1355054497.db2.gz	BPUZIPJHXPSQHH-SJLPKXTDSA-N	0	3	346.519	3.396	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccnc(OC(C)C)c2)CC[C@H]1C	ZINC001071986322	1355059767	/nfs/dbraw/zinc/05/97/67/1355059767.db2.gz	SGHLJVXEHWLPRL-WBVHZDCISA-N	0	3	331.460	3.028	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cc3c(C)cccn3c2)CC[C@@H]1C	ZINC001071988882	1355061169	/nfs/dbraw/zinc/06/11/69/1355061169.db2.gz	MGUMQXSUEKVROL-WMZOPIPTSA-N	0	3	325.456	3.407	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@@H](NCc3cc4ccccc4o3)C2)CCC1	ZINC001183185480	1387273687	/nfs/dbraw/zinc/27/36/87/1387273687.db2.gz	KKEJIYQFSFVTJH-QGZVFWFLSA-N	0	3	336.435	3.317	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cnn(CC(C)C)c2C)CC[C@H]1C	ZINC001072029804	1355091383	/nfs/dbraw/zinc/09/13/83/1355091383.db2.gz	JUZGJLKRBRSNIZ-NVXWUHKLSA-N	0	3	332.492	3.006	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccsc2C(F)F)CC[C@H]1C	ZINC001072032559	1355092066	/nfs/dbraw/zinc/09/20/66/1355092066.db2.gz	DZLOGOLHKHWUPM-NEPJUHHUSA-N	0	3	326.412	3.292	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2c(Cl)nc3ccccn32)CC[C@@H]1C	ZINC001072048473	1355102610	/nfs/dbraw/zinc/10/26/10/1355102610.db2.gz	KMRIWIKIEFPFTE-UONOGXRCSA-N	0	3	346.862	3.147	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(OCC)c(OC)c2)CC[C@H]1C	ZINC001072058914	1355107926	/nfs/dbraw/zinc/10/79/26/1355107926.db2.gz	UWYAEPUJVMIABH-WBVHZDCISA-N	0	3	346.471	3.253	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(COC(C)C)cc2)CC[C@H]1C	ZINC001072063603	1355109366	/nfs/dbraw/zinc/10/93/66/1355109366.db2.gz	VJOJRYWBGCRWIA-YLJYHZDGSA-N	0	3	342.483	3.218	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](NC(=O)c2ccccc2CN(C)C)CC[C@H]1C	ZINC001072099710	1355130173	/nfs/dbraw/zinc/13/01/73/1355130173.db2.gz	WIXSKLZMMYRNRS-WBVHZDCISA-N	0	3	349.906	3.083	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2coc(C3CCCCC3)n2)CC[C@H]1C	ZINC001072102003	1355131449	/nfs/dbraw/zinc/13/14/49/1355131449.db2.gz	MAUHTEFUGBBGKT-WBVHZDCISA-N	0	3	343.471	3.328	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2[nH]c3ccccc3c2OC)CC[C@H]1C	ZINC001072104943	1355133231	/nfs/dbraw/zinc/13/32/31/1355133231.db2.gz	FIYSLUIWUVVTOP-CABCVRRESA-N	0	3	341.455	3.335	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc(NC(C)=O)ccc2C)CC[C@@H]1C	ZINC001072120700	1355141256	/nfs/dbraw/zinc/14/12/56/1355141256.db2.gz	XWFRJULTAFJKAC-MAUKXSAKSA-N	0	3	343.471	3.112	20	30		EGEDHN
C[C@@H]1CCN(C(=O)CC2CC2)C[C@H]1CNCc1cc(F)ccc1C#N	ZINC001072160865	1355159845	/nfs/dbraw/zinc/15/98/45/1355159845.db2.gz	WNDDROQHPJDMIL-RDTXWAMCSA-N	0	3	343.446	3.072	20	30		EGEDHN
C/C=C(\C)C(=O)N1CC[C@H](C)[C@H](CNCc2ccccc2C#N)C1	ZINC001072240547	1355200711	/nfs/dbraw/zinc/20/07/11/1355200711.db2.gz	JIUANBHWQDINFF-WFIUYUHWSA-N	0	3	325.456	3.099	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](C)[C@H](CNCc2nccs2)C1	ZINC001072337387	1355245592	/nfs/dbraw/zinc/24/55/92/1355245592.db2.gz	XTYHEAUXSORPOK-HUUCEWRRSA-N	0	3	335.517	3.320	20	30		EGEDHN
CC(C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2)=C1CCC1	ZINC001072713675	1355400369	/nfs/dbraw/zinc/40/03/69/1355400369.db2.gz	HFBQBEZLLPYUDA-UHFFFAOYSA-N	0	3	335.451	3.093	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)CC3CC(c4ccccc4)C3)C2)C1	ZINC001072879520	1355480521	/nfs/dbraw/zinc/48/05/21/1355480521.db2.gz	STHINJTUFUSIIU-UHFFFAOYSA-N	0	3	336.479	3.128	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)[C@@H]3C[C@H]3c3ccc(Cl)s3)C2)C1	ZINC001072915109	1355494685	/nfs/dbraw/zinc/49/46/85/1355494685.db2.gz	MDWPSEYPIGLTQW-CHWSQXEVSA-N	0	3	336.888	3.225	20	30		EGEDHN
C=C1CCC(C(=O)N2CC3(C2)CCN(Cc2ncccc2C)C3)CC1	ZINC001072946195	1355514177	/nfs/dbraw/zinc/51/41/77/1355514177.db2.gz	DIOAJYYWCIZIEO-UHFFFAOYSA-N	0	3	339.483	3.171	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H](Cc3ccccc3)C(C)C)C2)C1	ZINC001072976322	1355532354	/nfs/dbraw/zinc/53/23/54/1355532354.db2.gz	VADWIAFQSMKAAN-FQEVSTJZSA-N	0	3	338.495	3.059	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3ccccc3O[C@H](C)CC)C2)C1	ZINC001073019974	1355551865	/nfs/dbraw/zinc/55/18/65/1355551865.db2.gz	DCUKGYRYKTULJL-MRXNPFEDSA-N	0	3	328.456	3.198	20	30		EGEDHN
C[C@H]1CC[C@@H](C(=O)N2CC3(C2)CCN(Cc2ccc(C#N)cc2)C3)C1	ZINC001073033600	1355561275	/nfs/dbraw/zinc/56/12/75/1355561275.db2.gz	PFKNKAGVNXZUCU-QFBILLFUSA-N	0	3	337.467	3.029	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C[C@H]3C[C@@H](C)CC(C)(C)C3)C2)C1	ZINC001073062894	1355575906	/nfs/dbraw/zinc/57/59/06/1355575906.db2.gz	XMPHZXRVSFJSRA-QZTJIDSGSA-N	0	3	330.516	3.397	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3ccc(-c4ccco4)s3)C2)C1	ZINC001073098779	1355595891	/nfs/dbraw/zinc/59/58/91/1355595891.db2.gz	QOHFDDWCRNREMK-UHFFFAOYSA-N	0	3	328.437	3.342	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3ccc(Cl)c(Cl)c3)C2)C1	ZINC001073144989	1355623673	/nfs/dbraw/zinc/62/36/73/1355623673.db2.gz	HQCLTGWGWIAENW-UHFFFAOYSA-N	0	3	337.250	3.165	20	30		EGEDHN
Cc1ccc(C(=O)N2CC3(C2)CCN(Cc2ccc(C#N)cc2)C3)cc1	ZINC001073147522	1355626098	/nfs/dbraw/zinc/62/60/98/1355626098.db2.gz	ADQQFKKRHBIXIK-UHFFFAOYSA-N	0	3	345.446	3.215	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)CC(C)(C)c3ccc(C)cc3)C2)C1	ZINC001073412330	1355765464	/nfs/dbraw/zinc/76/54/64/1355765464.db2.gz	MCUDYEJCFHBIES-UHFFFAOYSA-N	0	3	338.495	3.220	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2cc(C)ccc2C2CC2)C1	ZINC001073709997	1355872628	/nfs/dbraw/zinc/87/26/28/1355872628.db2.gz	NUOBZFYBEUCJSD-GOSISDBHSA-N	0	3	342.483	3.269	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(C#N)cc1	ZINC001073953059	1355989493	/nfs/dbraw/zinc/98/94/93/1355989493.db2.gz	SNJNFZIKKDIIDR-VQIMIIECSA-N	0	3	327.472	3.417	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCCN1C(=O)C=C1CCC1	ZINC001073989819	1356018690	/nfs/dbraw/zinc/01/86/90/1356018690.db2.gz	RAGRULCPCVWJEY-HXUWFJFHSA-N	0	3	337.467	3.481	20	30		EGEDHN
Cc1ccc(CN(C)C[C@H]2CCCCN2C(=O)C#CC2CC2)cc1F	ZINC001074012670	1356035071	/nfs/dbraw/zinc/03/50/71/1356035071.db2.gz	HBOOPUKGECJIAH-LJQANCHMSA-N	0	3	342.458	3.360	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H](C2CCN(C(=O)C(F)F)CC2)CC1	ZINC001075443064	1356372861	/nfs/dbraw/zinc/37/28/61/1356372861.db2.gz	GUEYZHMTTFICAM-ZDUSSCGKSA-N	0	3	334.838	3.345	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3coc4ccc(CC)cc43)[C@@H]2C1	ZINC001075792185	1356423517	/nfs/dbraw/zinc/42/35/17/1356423517.db2.gz	HETVHABYLYBAHE-QFBILLFUSA-N	0	3	336.435	3.165	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)CC(C)(C)c3ccc(C)cc3)[C@@H]2C1	ZINC001076546911	1356614606	/nfs/dbraw/zinc/61/46/06/1356614606.db2.gz	ZDGINUWVIKKXRA-PKOBYXMFSA-N	0	3	326.484	3.381	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cc(C)n(C(C)C)c3C)[C@@H]2C1	ZINC001076550940	1356615172	/nfs/dbraw/zinc/61/51/72/1356615172.db2.gz	DKFHKZCMQRRCSE-PKOBYXMFSA-N	0	3	329.488	3.408	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@@H](CC)c3ccc(OC)cc3)[C@@H]2C1	ZINC001076598307	1356628091	/nfs/dbraw/zinc/62/80/91/1356628091.db2.gz	VRPIXXHMWIGSGV-YSIASYRMSA-N	0	3	342.483	3.298	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)Cc1cc(C)c(Cl)cn1	ZINC001099125748	1363638923	/nfs/dbraw/zinc/63/89/23/1363638923.db2.gz	KDSVJUJPFQWANG-MRXNPFEDSA-N	0	3	349.906	3.379	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)c2cc(C)cs2)C[C@H]1C(F)(F)F	ZINC001099249116	1363712957	/nfs/dbraw/zinc/71/29/57/1363712957.db2.gz	QUFPELDIVOERFP-VXGBXAGGSA-N	0	3	332.391	3.225	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H]2CCC(C)(C)CN2CCO)CCCCC1	ZINC001099349378	1363766426	/nfs/dbraw/zinc/76/64/26/1363766426.db2.gz	QDMBIRHAKZEUNX-KRWDZBQOSA-N	0	3	336.520	3.112	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2ccc(O[C@@H](C)CC)cc2)C1	ZINC001080731915	1357729956	/nfs/dbraw/zinc/72/99/56/1357729956.db2.gz	OTKCUJRLHZANSP-JTDSTZFVSA-N	0	3	330.472	3.490	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2cc3occc3[nH]2)C12CCC2	ZINC001078639947	1357047668	/nfs/dbraw/zinc/04/76/68/1357047668.db2.gz	PXWMWEKQYPDPDO-HUUCEWRRSA-N	0	3	333.819	3.144	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2C[C@H](NCc3ccns3)C23CCC3)CC1	ZINC001078716805	1357062787	/nfs/dbraw/zinc/06/27/87/1357062787.db2.gz	YWAQPZAHGAHSJQ-DLBZAZTESA-N	0	3	345.512	3.407	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@H](NCc3oc(C)nc3C)C23CCC3)C1	ZINC001078721064	1357065697	/nfs/dbraw/zinc/06/56/97/1357065697.db2.gz	VMHBELFBRLFVJD-IRXDYDNUSA-N	0	3	343.471	3.165	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2C[C@H](NCc3ccns3)C23CCC3)C1	ZINC001078720583	1357065954	/nfs/dbraw/zinc/06/59/54/1357065954.db2.gz	NJMOGMIPQLCOFX-GJZGRUSLSA-N	0	3	331.485	3.016	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)Cc2ccsc2C)C12CCC2	ZINC001078742527	1357068200	/nfs/dbraw/zinc/06/82/00/1357068200.db2.gz	XOBACNFQGSGROK-HUUCEWRRSA-N	0	3	338.904	3.369	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)C2(F)CCCCC2)C12CCC2	ZINC001078771174	1357076442	/nfs/dbraw/zinc/07/64/42/1357076442.db2.gz	QJTGBOHCAWRFTN-ZIAGYGMSSA-N	0	3	328.859	3.428	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C2CCC3(CC3)CC2)C[C@H]1c1ccccc1	ZINC001081146826	1357845420	/nfs/dbraw/zinc/84/54/20/1357845420.db2.gz	RARZHHGKYNRZLE-VQTJNVASSA-N	0	3	336.479	3.174	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2cccc(C(C)(C)C)c2)[C@H](OC)C1	ZINC001082264098	1357998902	/nfs/dbraw/zinc/99/89/02/1357998902.db2.gz	JLTMKRPCQDQVNX-RTBURBONSA-N	0	3	344.499	3.379	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)C2CCC(C(C)(C)C)CC2)[C@H](OC)C1	ZINC001082354309	1358021763	/nfs/dbraw/zinc/02/17/63/1358021763.db2.gz	PLJJHDJIQBHWSQ-OPQOLIRYSA-N	0	3	336.520	3.230	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3ccn(C4CCCCC4)n3)[C@@H]2C1	ZINC001084343412	1358197424	/nfs/dbraw/zinc/19/74/24/1358197424.db2.gz	JCVHXRJRHBIJNW-VQIMIIECSA-N	0	3	342.487	3.111	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N1C[C@H]2CCN(CC3=CCCCC3)C[C@H]21	ZINC001084353546	1358198284	/nfs/dbraw/zinc/19/82/84/1358198284.db2.gz	QSSHKKOMTSSTGX-WTGUMLROSA-N	0	3	344.499	3.001	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)CCc3cc4ccccc4o3)[C@@H]2C1	ZINC001084502512	1358226349	/nfs/dbraw/zinc/22/63/49/1358226349.db2.gz	WXBDYLAOBSBSCG-IEBWSBKVSA-N	0	3	338.451	3.474	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)c3ccccc3O[C@@H](C)CC)[C@@H]2C1	ZINC001084690928	1358281729	/nfs/dbraw/zinc/28/17/29/1358281729.db2.gz	XAWYNKSDGYSZHE-YQVWRLOYSA-N	0	3	340.467	3.034	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)CCc3cc(Cl)cs3)[C@@H]2C1	ZINC001084689814	1358282022	/nfs/dbraw/zinc/28/20/22/1358282022.db2.gz	USRBINLYLDXBNM-CZUORRHYSA-N	0	3	338.904	3.443	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CC[C@H]2CCN(Cc3ccc(C#N)cc3)[C@H]2C1	ZINC001084891999	1358341339	/nfs/dbraw/zinc/34/13/39/1358341339.db2.gz	HJYFFEMYNBTRGS-LZQZEXGQSA-N	0	3	325.456	3.027	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@H]2CCN(Cc3cccc(C#N)c3)[C@H]2C1)C1CC1	ZINC001084913239	1358345931	/nfs/dbraw/zinc/34/59/31/1358345931.db2.gz	FYCHABQFWUEJNP-YSGRDPCXSA-N	0	3	337.467	3.027	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3c3cccc(F)c3F)C[C@@H]21	ZINC001085097144	1358389460	/nfs/dbraw/zinc/38/94/60/1358389460.db2.gz	PBUZEISSIRQDBQ-VUNQQRPYSA-N	0	3	346.421	3.177	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccc(F)c(F)c1	ZINC001085224705	1358437474	/nfs/dbraw/zinc/43/74/74/1358437474.db2.gz	QZJXRFXPWJLBEV-HUUCEWRRSA-N	0	3	328.790	3.348	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1c2c[nH]nc2ccc1C	ZINC001085252033	1358445290	/nfs/dbraw/zinc/44/52/90/1358445290.db2.gz	RXYSZAXMLRMOPG-HZPDHXFCSA-N	0	3	346.862	3.254	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc2oc(C)nc2c1	ZINC001085664247	1358667479	/nfs/dbraw/zinc/66/74/79/1358667479.db2.gz	GUOBBXIOQXPJBZ-MRXNPFEDSA-N	0	3	327.428	3.249	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C[C@H]2CCN2C[C@@H]2CCC(F)(F)C2)cc1	ZINC001085758100	1358737694	/nfs/dbraw/zinc/73/76/94/1358737694.db2.gz	ZLPRCKIMPUMEPO-SJLPKXTDSA-N	0	3	346.421	3.250	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ccc2c(c1)[C@H](C)CO2	ZINC001085775851	1358749090	/nfs/dbraw/zinc/74/90/90/1358749090.db2.gz	DCWKHHUXIQKTTN-NVXWUHKLSA-N	0	3	328.456	3.295	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)[C@H]1CCCc2cccnc21	ZINC001085781336	1358756644	/nfs/dbraw/zinc/75/66/44/1358756644.db2.gz	TXKBPXNRQDRDGE-ROUUACIJSA-N	0	3	327.472	3.000	20	30		EGEDHN
C=C1CCC(C(=O)N(C)C[C@@H]2CCN2CCC[C@@H]2CCOC2)CC1	ZINC001085801486	1358777151	/nfs/dbraw/zinc/77/71/51/1358777151.db2.gz	UIOAVNOLPQYJHC-MJGOQNOKSA-N	0	3	334.504	3.082	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cc(F)c2ncccc2c1	ZINC001085876055	1358840689	/nfs/dbraw/zinc/84/06/89/1358840689.db2.gz	PZOUQNMBGQHAMZ-QGZVFWFLSA-N	0	3	341.430	3.486	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cnn(CC2CCCC2)c1	ZINC001085894513	1358855648	/nfs/dbraw/zinc/85/56/48/1358855648.db2.gz	DGLSGVUQHSFITF-LJQANCHMSA-N	0	3	344.503	3.186	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C[C@@H]2CCN2[C@H](C)c2ccccc2C)cn1	ZINC001085932916	1358887879	/nfs/dbraw/zinc/88/78/79/1358887879.db2.gz	LTSQIYNRDXGDJS-XLIONFOSSA-N	0	3	347.462	3.279	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1c(Cl)nc2ccccn21	ZINC001085959980	1358918006	/nfs/dbraw/zinc/91/80/06/1358918006.db2.gz	ROMBCERZZVZAOZ-AWEZNQCLSA-N	0	3	346.862	3.100	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ocnc2-c2ccccc2)C1	ZINC001086104205	1358998395	/nfs/dbraw/zinc/99/83/95/1358998395.db2.gz	AQUGVKHQZGJXIM-OTVXOJSOSA-N	0	3	345.830	3.192	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@H]2CCCc3ccccc32)C1	ZINC001086121605	1359002754	/nfs/dbraw/zinc/00/27/54/1359002754.db2.gz	AYDHOFUFMAWNTA-LESCRADOSA-N	0	3	332.875	3.343	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc3cc(C)ccc3n2)C1	ZINC001086144390	1359007442	/nfs/dbraw/zinc/00/74/42/1359007442.db2.gz	NPIBHQYZLZNIBH-FZNQNYSPSA-N	0	3	343.858	3.394	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@@H]2CC[C@@H](C(F)(F)F)C2)C1	ZINC001086178178	1359016033	/nfs/dbraw/zinc/01/60/33/1359016033.db2.gz	WGKKABZBUKYCCI-LPWJVIDDSA-N	0	3	338.801	3.202	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2C[C@@H](NCc3c(C)noc3C)C2)CC1	ZINC001086187275	1359020669	/nfs/dbraw/zinc/02/06/69/1359020669.db2.gz	OCFFFOWPWWLZMJ-WOVMCDHWSA-N	0	3	331.460	3.022	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2c(C)cccc2Cl)C1	ZINC001086467144	1359108820	/nfs/dbraw/zinc/10/88/20/1359108820.db2.gz	OBBMFCSKDFNBHL-JOCQHMNTSA-N	0	3	327.255	3.499	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)[C@@H]2C[C@H]2CC(C)C)C1	ZINC001086482430	1359113773	/nfs/dbraw/zinc/11/37/73/1359113773.db2.gz	FTKIOBUPVUWXSK-KBUPBQIOSA-N	0	3	343.309	3.062	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2sc(CCC)nc2C)C1	ZINC001086552702	1359142229	/nfs/dbraw/zinc/14/22/29/1359142229.db2.gz	ZWYBYYSMAWFUPD-JOCQHMNTSA-N	0	3	341.908	3.255	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](CNCc2cc(F)ccc2C#N)[C@H](C)C1	ZINC001184019601	1387382571	/nfs/dbraw/zinc/38/25/71/1387382571.db2.gz	LLCRZLAKDIAYKC-NVXWUHKLSA-N	0	3	343.446	3.238	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2c(C)noc2C(F)F)C1	ZINC001086730526	1359192458	/nfs/dbraw/zinc/19/24/58/1359192458.db2.gz	XBGZSSDFMDIQLE-WDEREUQCSA-N	0	3	347.793	3.161	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cccc(F)c2F)C1	ZINC001086789352	1359201823	/nfs/dbraw/zinc/20/18/23/1359201823.db2.gz	JAKXCVKWSUXSDE-NWDGAFQWSA-N	0	3	328.790	3.205	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CC[C@H](CNC(=O)[C@H]2CC23CCC3)C1	ZINC001086815851	1359207607	/nfs/dbraw/zinc/20/76/07/1359207607.db2.gz	LHHPISBFJVUHMR-KFKAGJAMSA-N	0	3	337.467	3.123	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cn(C(C)C)nc2C)C1	ZINC001086851425	1359213552	/nfs/dbraw/zinc/21/35/52/1359213552.db2.gz	CVLOBFJKPGOBOB-LSDHHAIUSA-N	0	3	338.883	3.013	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CC2(C[C@H]1C)CCN(Cc1ccc(F)cc1)CC2	ZINC001086910246	1359237681	/nfs/dbraw/zinc/23/76/81/1359237681.db2.gz	PAQXGPVTWVVULU-JKSUJKDBSA-N	0	3	343.446	3.188	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)[C@H]3CC[C@@H]4C[C@@H]4CC3)C2)CC1	ZINC001086934244	1359257797	/nfs/dbraw/zinc/25/77/97/1359257797.db2.gz	KPIZMZCBTXOINC-AKHDSKFASA-N	0	3	328.500	3.149	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)Cc3ccsc3C)C2)CC1	ZINC001086947281	1359268681	/nfs/dbraw/zinc/26/86/81/1359268681.db2.gz	UCFGNEJIKQXIGU-MRXNPFEDSA-N	0	3	344.524	3.325	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccccc3OC)C2)CC1	ZINC001086953959	1359274095	/nfs/dbraw/zinc/27/40/95/1359274095.db2.gz	YFTXXKDCAXWACC-QGZVFWFLSA-N	0	3	340.467	3.035	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)Cc3c[nH]c4ccccc34)C2)CC1	ZINC001086954449	1359274651	/nfs/dbraw/zinc/27/46/51/1359274651.db2.gz	LPSHATMEFWLVTP-KRWDZBQOSA-N	0	3	349.478	3.047	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cccc4cnccc43)C2)CC1	ZINC001086957468	1359278227	/nfs/dbraw/zinc/27/82/27/1359278227.db2.gz	OSNMCNRRFJDDSJ-QGZVFWFLSA-N	0	3	347.462	3.185	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](CNCc2ccn(C(C)C)n2)[C@@H](C)C1	ZINC001184079130	1387389798	/nfs/dbraw/zinc/38/97/98/1387389798.db2.gz	UHHXGLBDULEMRC-DLBZAZTESA-N	0	3	332.492	3.004	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](CNCc2cc(C3CC3)no2)[C@H](C)C1	ZINC001184079196	1387389994	/nfs/dbraw/zinc/38/99/94/1387389994.db2.gz	VBWOYMRWQDSGSF-ZBFHGGJFSA-N	0	3	331.460	3.092	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc2occc2[nH]1	ZINC001087288797	1359368064	/nfs/dbraw/zinc/36/80/64/1359368064.db2.gz	CANHBNJCMCRKLR-JEBQAFNWSA-N	0	3	339.439	3.003	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3c[nH]c4ccccc34)C(C)(C)[C@H]21	ZINC001087293359	1359374302	/nfs/dbraw/zinc/37/43/02/1359374302.db2.gz	COIUQXVWULJFPZ-MNEFBYGVSA-N	0	3	335.451	3.020	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(C)c(F)c3)C(C)(C)[C@H]21	ZINC001087295595	1359376528	/nfs/dbraw/zinc/37/65/28/1359376528.db2.gz	LHOXQDXPXRCALC-QRQLOZEOSA-N	0	3	342.458	3.376	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc4ccc(C)cc4[nH]3)C(C)(C)[C@@H]21	ZINC001087296622	1359377457	/nfs/dbraw/zinc/37/74/57/1359377457.db2.gz	CLJJRFFEPSJHQK-NSISKUIASA-N	0	3	349.478	3.328	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc4cc[nH]c43)C(C)(C)[C@H]21	ZINC001087304703	1359388850	/nfs/dbraw/zinc/38/88/50/1359388850.db2.gz	GMCIKRSRQVBKNR-QRQLOZEOSA-N	0	3	335.451	3.020	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc4cc[nH]c4c3)C(C)(C)[C@@H]21	ZINC001087307368	1359394628	/nfs/dbraw/zinc/39/46/28/1359394628.db2.gz	YTYJGBMCJFTYQP-BHIYHBOVSA-N	0	3	335.451	3.020	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3ccc4cccnc4c3)C(C)(C)[C@H]21	ZINC001087307925	1359394823	/nfs/dbraw/zinc/39/48/23/1359394823.db2.gz	JIGAKOXJTNWZFJ-HOJAQTOUSA-N	0	3	347.462	3.087	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3csc(C)c3)C(C)(C)[C@@H]21	ZINC001087308265	1359395159	/nfs/dbraw/zinc/39/51/59/1359395159.db2.gz	NSERDKGWYKICFC-BRWVUGGUSA-N	0	3	330.497	3.299	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc(C)c(CC)o1	ZINC001087312338	1359400441	/nfs/dbraw/zinc/40/04/41/1359400441.db2.gz	CTZLLLVOPQDOKX-FHLIZLRMSA-N	0	3	328.456	3.002	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)Cc1ccc(C)s1	ZINC001087318280	1359410076	/nfs/dbraw/zinc/41/00/76/1359410076.db2.gz	UVUNSLNTORDEFB-NZSAHSFTSA-N	0	3	344.524	3.228	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cccn1C(C)C	ZINC001087319660	1359412417	/nfs/dbraw/zinc/41/24/17/1359412417.db2.gz	ROGXCSPYUBLWRI-NZSAHSFTSA-N	0	3	341.499	3.311	20	30		EGEDHN
CCCC(=O)N1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1Cc1ccc(C#N)s1	ZINC001087329616	1359419269	/nfs/dbraw/zinc/41/92/69/1359419269.db2.gz	RPDXBCKACJXPMI-NBMRYCAZSA-N	0	3	343.496	3.089	20	30		EGEDHN
C=CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)c2cc(C)on2)C1	ZINC001087420825	1359457326	/nfs/dbraw/zinc/45/73/26/1359457326.db2.gz	XZVSRIAQRDVMQF-IEBWSBKVSA-N	0	3	339.439	3.147	20	30		EGEDHN
C=CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)[C@H]2CCCCO2)C1	ZINC001087425516	1359461235	/nfs/dbraw/zinc/46/12/35/1359461235.db2.gz	ZSCMEFCKGNJHAS-VAMGGRTRSA-N	0	3	342.483	3.106	20	30		EGEDHN
C#Cc1ccccc1CC(=O)N[C@@H]1CN(CC)CC[C@@H]1c1ccccc1	ZINC001087442377	1359466823	/nfs/dbraw/zinc/46/68/23/1359466823.db2.gz	GTDGKSKWDTYGBG-FGZHOGPDSA-N	0	3	346.474	3.205	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(C3CCCCC3)n[nH]2)[C@H]1CC	ZINC001087605654	1359551570	/nfs/dbraw/zinc/55/15/70/1359551570.db2.gz	PGLUQKICDJCJGC-MAUKXSAKSA-N	0	3	330.476	3.226	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2c(C)cc(C)cc2C)[C@H]1CC	ZINC001087711812	1359603771	/nfs/dbraw/zinc/60/37/71/1359603771.db2.gz	YLNAADQTTWEFHY-VQTJNVASSA-N	0	3	326.484	3.147	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cn(CC)nc2C(C)C)[C@H]1CC	ZINC001087745043	1359624541	/nfs/dbraw/zinc/62/45/41/1359624541.db2.gz	ZNSPYJYWXRWALD-DLBZAZTESA-N	0	3	332.492	3.185	20	30		EGEDHN
C=CCOc1cccnc1C(=O)N[C@H]1CCN(CC=C(C)C)[C@@H]1CC	ZINC001087790190	1359646179	/nfs/dbraw/zinc/64/61/79/1359646179.db2.gz	YUEZUASLNSISPE-DLBZAZTESA-N	0	3	343.471	3.195	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc3ccccc3c2)[C@H]1CC	ZINC001087822701	1359664948	/nfs/dbraw/zinc/66/49/48/1359664948.db2.gz	FSCUWZHNFLYOOI-LEWJYISDSA-N	0	3	334.463	3.375	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2c[nH]c3c2cccc3CC)[C@H]1CC	ZINC001087840541	1359674437	/nfs/dbraw/zinc/67/44/37/1359674437.db2.gz	BUNFNCXGNIJWBR-RBUKOAKNSA-N	0	3	337.467	3.336	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2coc(C3CCCCC3)n2)[C@H]1CC	ZINC001087844751	1359678509	/nfs/dbraw/zinc/67/85/09/1359678509.db2.gz	OXXOKFGTLSULIJ-FUHWJXTLSA-N	0	3	343.471	3.328	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)C3(CC)CCC(F)(F)CC3)C[C@@H]2C1	ZINC001088016685	1359725934	/nfs/dbraw/zinc/72/59/34/1359725934.db2.gz	QIPUDYCPMUPZIX-CVEARBPZSA-N	0	3	338.442	3.006	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)CCc3cccc(Cl)c3)C[C@@H]2C1	ZINC001088056871	1359738020	/nfs/dbraw/zinc/73/80/20/1359738020.db2.gz	XHUVUDPLXJIXJF-MSOLQXFVSA-N	0	3	344.886	3.076	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H]3CCN(Cc4cccnc4)C[C@H]3C2)CC1	ZINC001088090738	1359752916	/nfs/dbraw/zinc/75/29/16/1359752916.db2.gz	DGVJEMWUGLQXFF-UXHICEINSA-N	0	3	339.483	3.108	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CCN(Cc4cccc(F)c4)C[C@H]3C2)C1	ZINC001088098642	1359756143	/nfs/dbraw/zinc/75/61/43/1359756143.db2.gz	USXOFJHLAACOMK-MSOLQXFVSA-N	0	3	342.458	3.462	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3ccc(-c4ccco4)s3)C[C@@H]2C1	ZINC001088157456	1359775196	/nfs/dbraw/zinc/77/51/96/1359775196.db2.gz	PETPTEGXDBRDOA-CABCVRRESA-N	0	3	340.448	3.035	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@H](CNCc2oc(C)nc2C)[C@@H](C)C1	ZINC001184231134	1387417069	/nfs/dbraw/zinc/41/70/69/1387417069.db2.gz	LHROPLGVCMHGKG-MAUKXSAKSA-N	0	3	345.487	3.059	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)C[C@H]3CCCCC3(C)C)C[C@@H]2C1	ZINC001088223137	1359803015	/nfs/dbraw/zinc/80/30/15/1359803015.db2.gz	ODIIYLHUCWDZER-CEXWTWQISA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](CNCc2ncc(C)s2)[C@@H](C)C1	ZINC001184232122	1387417232	/nfs/dbraw/zinc/41/72/32/1387417232.db2.gz	RKLVUWUALCGWFJ-RDJZCZTQSA-N	0	3	347.528	3.219	20	30		EGEDHN
C=CCN1CC[C@H](OCC2CCN(C(=O)c3ccccc3C)CC2)C1	ZINC001088228470	1359807398	/nfs/dbraw/zinc/80/73/98/1359807398.db2.gz	QYJDCRKEVKKDBK-IBGZPJMESA-N	0	3	342.483	3.124	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N1CCCCC[C@H](NCc2cc(C#N)ccc2F)C1	ZINC001088363454	1359846256	/nfs/dbraw/zinc/84/62/56/1359846256.db2.gz	PUKGMYIUVHLURF-WBAXXEDZSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2ccc(Cl)[nH]2)C1	ZINC001088377424	1359859809	/nfs/dbraw/zinc/85/98/09/1359859809.db2.gz	ITIPDEDXSNSMIQ-LBPRGKRZSA-N	0	3	330.259	3.395	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2nc(CC)oc2C)C1	ZINC001088396283	1359871843	/nfs/dbraw/zinc/87/18/43/1359871843.db2.gz	CSTIDYXRGNDQRX-AWEZNQCLSA-N	0	3	339.867	3.272	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2cnn(C(F)F)c2)C1	ZINC001088405874	1359877615	/nfs/dbraw/zinc/87/76/15/1359877615.db2.gz	IFEWFTJOZDFDQB-ZDUSSCGKSA-N	0	3	346.809	3.005	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)CCc2nccs2)C1	ZINC001088427900	1359895853	/nfs/dbraw/zinc/89/58/53/1359895853.db2.gz	GWSVBHZUSVFFRA-CQSZACIVSA-N	0	3	341.908	3.189	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](CNC/C(Cl)=C/Cl)[C@@H](C)C1	ZINC001184311590	1387426906	/nfs/dbraw/zinc/42/69/06/1387426906.db2.gz	KDJWRDZDDQAHIQ-AVWIDUKFSA-N	0	3	331.287	3.183	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3cccc(C)c3)[C@@H]2C)cc1	ZINC001088786847	1360044472	/nfs/dbraw/zinc/04/44/72/1360044472.db2.gz	CCUNHNBFDKTUPX-UTKZUKDTSA-N	0	3	332.447	3.369	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(C[C@H](OC)c3ccccc3)[C@@H]2C)C1	ZINC001088844382	1360078036	/nfs/dbraw/zinc/07/80/36/1360078036.db2.gz	OPTHNBUPDMRSFR-NEWSRXKRSA-N	0	3	342.483	3.309	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)Cc2ccc3c(c2)CCCC3)[C@H]1C	ZINC001089031388	1360142944	/nfs/dbraw/zinc/14/29/44/1360142944.db2.gz	GOIDNXAMQQPLSI-UZLBHIALSA-N	0	3	326.484	3.263	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)[C@@H]2C[C@H]2c2cccc(F)c2F)[C@H]1C	ZINC001089049742	1360147917	/nfs/dbraw/zinc/14/79/17/1360147917.db2.gz	AEFDDBKAMMDOPD-JWDQPFGJSA-N	0	3	334.410	3.223	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)Cc2ccc(OC(C)C)cc2)[C@H]1C	ZINC001089055797	1360150451	/nfs/dbraw/zinc/15/04/51/1360150451.db2.gz	BSGVLUNTTVPGQR-APWZRJJASA-N	0	3	330.472	3.171	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCCN1C(=O)C(C)(C)F	ZINC001089099706	1360166274	/nfs/dbraw/zinc/16/62/74/1360166274.db2.gz	CMHRWAAESHCBHK-KRWDZBQOSA-N	0	3	331.435	3.119	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCCC[C@H]1CN(C)Cc1cccc(C#N)c1	ZINC001089151966	1360207782	/nfs/dbraw/zinc/20/77/82/1360207782.db2.gz	AXFLBBZBTLRCFE-YDIVSAOHSA-N	0	3	325.456	3.337	20	30		EGEDHN
Cc1cc(F)ccc1CN(C)C[C@@H]1CCCCN1C(=O)C#CC1CC1	ZINC001089175200	1360228671	/nfs/dbraw/zinc/22/86/71/1360228671.db2.gz	RQGSMUIBMVIMOP-FQEVSTJZSA-N	0	3	342.458	3.360	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C[C@H]2CCC(F)(F)C2)CC(C)(C)C1	ZINC001089403283	1360402507	/nfs/dbraw/zinc/40/25/07/1360402507.db2.gz	QGLGHXJBXPVBSS-CABCVRRESA-N	0	3	326.431	3.052	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C(C2CCC2)C2CCC2)CC(C)(C)C1	ZINC001089472626	1360456031	/nfs/dbraw/zinc/45/60/31/1360456031.db2.gz	LFIQDLSMSMKWQW-SFHVURJKSA-N	0	3	330.516	3.443	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C[C@@H]2CCc3ccccc32)CC(C)(C)C1	ZINC001089523766	1360489342	/nfs/dbraw/zinc/48/93/42/1360489342.db2.gz	HBNGJWIRNBHUQL-OALUTQOASA-N	0	3	338.495	3.347	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2coc(C3CCCC3)n2)CC(C)(C)C1	ZINC001089529093	1360491986	/nfs/dbraw/zinc/49/19/86/1360491986.db2.gz	QRDXSSUTRIDNPK-MRXNPFEDSA-N	0	3	343.471	3.186	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2csc(Cl)n2)CC(C)(C)C1	ZINC001089534096	1360494040	/nfs/dbraw/zinc/49/40/40/1360494040.db2.gz	OMJKQGFVEOXKJF-GFCCVEGCSA-N	0	3	339.892	3.040	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc3cccnc3s2)CC(C)(C)C1	ZINC001089535352	1360495302	/nfs/dbraw/zinc/49/53/02/1360495302.db2.gz	JEHVXKOYRKQLGQ-OAHLLOKOSA-N	0	3	341.480	3.150	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@H](C)c2ccc(C)cc2)CC(C)(C)C1	ZINC001089539887	1360497229	/nfs/dbraw/zinc/49/72/29/1360497229.db2.gz	OYHSQYKULQVMNY-IEBWSBKVSA-N	0	3	326.484	3.339	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@H](C)c2ccc(C)cc2)CC(C)(C)C1	ZINC001089539889	1360497481	/nfs/dbraw/zinc/49/74/81/1360497481.db2.gz	OYHSQYKULQVMNY-MJGOQNOKSA-N	0	3	326.484	3.339	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2oc(CCC)nc2C)CC(C)(C)C1	ZINC001089540961	1360498082	/nfs/dbraw/zinc/49/80/82/1360498082.db2.gz	GECNTUWAACBDLY-MRXNPFEDSA-N	0	3	345.487	3.179	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc3ccccc3n2)CC(C)(C)C1	ZINC001089545266	1360500957	/nfs/dbraw/zinc/50/09/57/1360500957.db2.gz	IXIUMWWEDMEGMX-QGZVFWFLSA-N	0	3	335.451	3.088	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc3cccc(F)c3o2)CC(C)(C)C1	ZINC001089561538	1360508713	/nfs/dbraw/zinc/50/87/13/1360508713.db2.gz	QXDOHQSLJFPKJD-HNNXBMFYSA-N	0	3	342.414	3.426	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@H](C)c2cccc(OC)c2)CC(C)(C)C1	ZINC001089567130	1360513518	/nfs/dbraw/zinc/51/35/18/1360513518.db2.gz	WKWWQKHTSZTWRZ-AEFFLSMTSA-N	0	3	342.483	3.039	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1coc(C(C)(C)C)n1	ZINC001089640228	1360553881	/nfs/dbraw/zinc/55/38/81/1360553881.db2.gz	CNGRXSQTCIHHBX-HNNXBMFYSA-N	0	3	345.487	3.216	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cncc(Cl)c1C	ZINC001089652476	1360565235	/nfs/dbraw/zinc/56/52/35/1360565235.db2.gz	FJVRIMWHKMCVHG-OAHLLOKOSA-N	0	3	347.890	3.287	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(C2CC2)n[nH]1	ZINC001089696205	1360601093	/nfs/dbraw/zinc/60/10/93/1360601093.db2.gz	UQPOLECBXJHENR-OAHLLOKOSA-N	0	3	330.476	3.084	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cccc2[nH]cnc21	ZINC001089715323	1360616906	/nfs/dbraw/zinc/61/69/06/1360616906.db2.gz	UGLJCFXNLMOBAQ-OAHLLOKOSA-N	0	3	340.471	3.359	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cn(CCC)nc1C	ZINC001089716302	1360617324	/nfs/dbraw/zinc/61/73/24/1360617324.db2.gz	FHSOLGUGJASVIP-QGZVFWFLSA-N	0	3	346.519	3.398	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1cccc2nsnc21	ZINC001089718634	1360620960	/nfs/dbraw/zinc/62/09/60/1360620960.db2.gz	RUTFVLKRFWFIIQ-ZDUSSCGKSA-N	0	3	344.484	3.098	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)CCc1ccco1	ZINC001089769284	1360657413	/nfs/dbraw/zinc/65/74/13/1360657413.db2.gz	KAMOFQHBNQWZJO-HPBDAGMYSA-N	0	3	348.874	3.134	20	30		EGEDHN
C=C(C)CC[N@@H+]1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1ccccc1[O-]	ZINC001089776661	1360659747	/nfs/dbraw/zinc/65/97/47/1360659747.db2.gz	GMSXJQMTUPQIDW-NQYYFHDYSA-N	0	3	340.467	3.141	20	30		EGEDHN
C=C(C)CC[N@H+]1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1ccccc1[O-]	ZINC001089776661	1360659750	/nfs/dbraw/zinc/65/97/50/1360659750.db2.gz	GMSXJQMTUPQIDW-NQYYFHDYSA-N	0	3	340.467	3.141	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1oc(C)cc1C	ZINC001089791400	1360664709	/nfs/dbraw/zinc/66/47/09/1360664709.db2.gz	GKSURTLSMHHAPI-YVSFHVDLSA-N	0	3	348.874	3.431	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)C2CC3(CC3)C2)C1	ZINC001089865756	1360708741	/nfs/dbraw/zinc/70/87/41/1360708741.db2.gz	TXMJLDJIRZFQBR-HJWJTTGWSA-N	0	3	334.891	3.098	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](CNCc2nccs2)[C@H](C)C1	ZINC001184488706	1387470214	/nfs/dbraw/zinc/47/02/14/1387470214.db2.gz	XURGKKMBUQITHB-HUUCEWRRSA-N	0	3	335.517	3.320	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)C(C)=C2CCCC2)CC2(CCOCC2)C1	ZINC001089936009	1360752641	/nfs/dbraw/zinc/75/26/41/1360752641.db2.gz	IMVPHAYNHUODSE-SFHVURJKSA-N	0	3	332.488	3.050	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)[C@H]2CCC=CCCC2)CC2(CCOCC2)C1	ZINC001089945005	1360757275	/nfs/dbraw/zinc/75/72/75/1360757275.db2.gz	JFPVHXXWWNMWJI-OALUTQOASA-N	0	3	346.515	3.296	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cnc3ccccc3c2C)C1	ZINC001091147996	1360998181	/nfs/dbraw/zinc/99/81/81/1360998181.db2.gz	FDJYONJBTOBWKE-UHFFFAOYSA-N	0	3	343.858	3.394	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccccc2-n2cccc2)C1	ZINC001091212410	1361008935	/nfs/dbraw/zinc/00/89/35/1361008935.db2.gz	YFGATRMDCXYHJM-UHFFFAOYSA-N	0	3	343.858	3.328	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc3cccnc3s2)C1	ZINC001091311049	1361039310	/nfs/dbraw/zinc/03/93/10/1361039310.db2.gz	YHAMTBPWFASAEG-UHFFFAOYSA-N	0	3	335.860	3.147	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2sc(CCC)nc2C)C1	ZINC001091362511	1361061445	/nfs/dbraw/zinc/06/14/45/1361061445.db2.gz	ZWYBYYSMAWFUPD-UHFFFAOYSA-N	0	3	341.908	3.255	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2ccc(N(C)CCC)cc2)C1	ZINC001091392685	1361078367	/nfs/dbraw/zinc/07/83/67/1361078367.db2.gz	QDNMOFRWLKLZKS-UHFFFAOYSA-N	0	3	349.906	3.383	20	30		EGEDHN
C[C@H](C#N)C(=O)N1C[C@H]2CN(Cc3cccc(C(F)F)c3)C[C@@]2(C)C1	ZINC001091543911	1361141007	/nfs/dbraw/zinc/14/10/07/1361141007.db2.gz	QGGGDPGFNLXKII-NRXGSXMXSA-N	0	3	347.409	3.064	20	30		EGEDHN
Cc1cc(C(=O)N2C[C@H]3CN(Cc4ccc(C#N)cc4)C[C@@]3(C)C2)co1	ZINC001091623544	1361161751	/nfs/dbraw/zinc/16/17/51/1361161751.db2.gz	NQSPSYCLAYJYMM-CTNGQTDRSA-N	0	3	349.434	3.054	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)CCc3cccc(Cl)c3)C[C@]2(C)C1	ZINC001091891354	1361241219	/nfs/dbraw/zinc/24/12/19/1361241219.db2.gz	AVSLQLDMHMJJPU-XLIONFOSSA-N	0	3	344.886	3.076	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)C(C)(C)c3cccc(Cl)c3)C[C@]2(C)C1	ZINC001092055400	1361284328	/nfs/dbraw/zinc/28/43/28/1361284328.db2.gz	IKAYPSWEMIKXQR-UZLBHIALSA-N	0	3	344.886	3.031	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)C(CC)(CC)c3ccccc3)C[C@]2(C)C1	ZINC001092294003	1361356358	/nfs/dbraw/zinc/35/63/58/1361356358.db2.gz	FXQJRCHVSLQRGS-CTNGQTDRSA-N	0	3	338.495	3.158	20	30		EGEDHN
C[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1CNC(=O)c1ccsc1	ZINC001092453702	1361387462	/nfs/dbraw/zinc/38/74/62/1361387462.db2.gz	WJJRNVYZKPIZRJ-VQIMIIECSA-N	0	3	338.476	3.098	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CNC(=O)[C@@H]1CC=CCC1	ZINC001092459626	1361388642	/nfs/dbraw/zinc/38/86/42/1361388642.db2.gz	PIJNVVPNHNLCHA-BZUAXINKSA-N	0	3	343.496	3.160	20	30		EGEDHN
C#CCN1C[C@@H](CNC(=O)c2c(Cl)oc3ccccc32)[C@H](C)C1	ZINC001092907434	1361484283	/nfs/dbraw/zinc/48/42/83/1361484283.db2.gz	MXSNXDUJINDORK-CHWSQXEVSA-N	0	3	330.815	3.017	20	30		EGEDHN
C#CCN1C[C@@H](CNC(=O)c2ccc(Cl)c3occc32)[C@H](C)C1	ZINC001093126371	1361534675	/nfs/dbraw/zinc/53/46/75/1361534675.db2.gz	SFLPOIBPWBEBHD-CHWSQXEVSA-N	0	3	330.815	3.017	20	30		EGEDHN
C=C(C)CN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C(=O)C(C)(C)C)CC1	ZINC001093361220	1361572950	/nfs/dbraw/zinc/57/29/50/1361572950.db2.gz	IBUYYMOZUSZQBF-KRWDZBQOSA-N	0	3	346.515	3.271	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)c2c(C)coc2C)CC1	ZINC001093370664	1361579694	/nfs/dbraw/zinc/57/96/94/1361579694.db2.gz	WQBMTJHMITYDCH-LJQANCHMSA-N	0	3	340.467	3.236	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C[C@H]2CC=CCC2)CC1	ZINC001093376801	1361587324	/nfs/dbraw/zinc/58/73/24/1361587324.db2.gz	OGVUPRHSLVBHOY-RXVVDRJESA-N	0	3	340.511	3.459	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)[C@@]2(C)C=CCC2)CC1	ZINC001093377086	1361587475	/nfs/dbraw/zinc/58/74/75/1361587475.db2.gz	PVAXTCMHIYMATC-QUCCMNQESA-N	0	3	326.484	3.069	20	30		EGEDHN
O=C(NC[C@]12CCC[C@H]1N(CC#Cc1ccccc1)CC2)c1ccoc1	ZINC001094362225	1361776707	/nfs/dbraw/zinc/77/67/07/1361776707.db2.gz	JYSCGDMVNOCUNM-IFMALSPDSA-N	0	3	348.446	3.306	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cn(C)c3ccc(F)cc13)C2	ZINC001095545755	1362165334	/nfs/dbraw/zinc/16/53/34/1362165334.db2.gz	RSSAEMBAHWWZMK-LJHODMEESA-N	0	3	341.430	3.229	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cccc(-n3cccc3)c1)C2	ZINC001095707593	1362207462	/nfs/dbraw/zinc/20/74/62/1362207462.db2.gz	ZHCBPGRKDHWVOQ-AABGKKOBSA-N	0	3	335.451	3.389	20	30		EGEDHN
CC(C)=C(C)CC(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001184918487	1387561768	/nfs/dbraw/zinc/56/17/68/1387561768.db2.gz	XOFIWJJAXXIASU-QGZVFWFLSA-N	0	3	329.419	3.134	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc3ncccc3s1)C2	ZINC001095864276	1362259052	/nfs/dbraw/zinc/25/90/52/1362259052.db2.gz	CXQTVSWTHSDDMH-IPYPFGDCSA-N	0	3	327.453	3.208	20	30		EGEDHN
C[C@@H]1CN(C(=O)CCCF)CC[C@H]1CNCc1cc(F)ccc1C#N	ZINC001184955294	1387571717	/nfs/dbraw/zinc/57/17/17/1387571717.db2.gz	CYSXORLQQGFGMT-ZBFHGGJFSA-N	0	3	349.425	3.021	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1[nH]ccc1-c1ccccc1)C2	ZINC001096328724	1362463828	/nfs/dbraw/zinc/46/38/28/1362463828.db2.gz	JXZFICORZJGKIK-NEWSRXKRSA-N	0	3	333.435	3.040	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H]1Cc3c1cccc3Cl)C2	ZINC001096638076	1362611307	/nfs/dbraw/zinc/61/13/07/1362611307.db2.gz	QSHHVMBHUKLWLN-VFAJRCTISA-N	0	3	330.859	3.277	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3C[C@H]2CCCCO2)CC1	ZINC001097788963	1363122005	/nfs/dbraw/zinc/12/20/05/1363122005.db2.gz	NFHZKDYJQOQIAR-MKXGPGLRSA-N	0	3	332.488	3.023	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H]1C[C@H]1c1ccc(C)c(C)c1)C2	ZINC001098002705	1363194348	/nfs/dbraw/zinc/19/43/48/1363194348.db2.gz	RSNZFKHMFXILFL-XNTOXWQXSA-N	0	3	336.479	3.152	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1CCC=CCCC1)C[C@H](C)O2	ZINC001098606356	1363396439	/nfs/dbraw/zinc/39/64/39/1363396439.db2.gz	QOHSUBJMSLRZFL-OALUTQOASA-N	0	3	346.515	3.391	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H](C)c1ccsc1)C[C@@H](C)O2	ZINC001098635224	1363409192	/nfs/dbraw/zinc/40/91/92/1363409192.db2.gz	FJAGJIHIQOPYIC-CVEARBPZSA-N	0	3	348.512	3.120	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2coc(C(C)(C)C)n2)C1	ZINC001098834452	1363487715	/nfs/dbraw/zinc/48/77/15/1363487715.db2.gz	MCCYDDYVOOKMAU-LIRRHRJNSA-N	0	3	331.460	3.133	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc(F)cc3ccncc32)C1	ZINC001098842361	1363489573	/nfs/dbraw/zinc/48/95/73/1363489573.db2.gz	ARJWQMQDFIRGBY-YWZLYKJASA-N	0	3	339.414	3.144	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccsc1	ZINC001098867773	1363498622	/nfs/dbraw/zinc/49/86/22/1363498622.db2.gz	JKAVVNXHLJSJRT-MRXNPFEDSA-N	0	3	336.501	3.171	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H]1CC=CCC1	ZINC001098881338	1363503807	/nfs/dbraw/zinc/50/38/07/1363503807.db2.gz	ZJRNBTAATHRASK-MSOLQXFVSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H]2CCc3cc(F)ccc32)C1	ZINC001098946072	1363534588	/nfs/dbraw/zinc/53/45/88/1363534588.db2.gz	XQNWDXWDZLBJNB-CVAIRZPRSA-N	0	3	328.431	3.012	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H](C)c2ccc(Cl)cc2)C1	ZINC001099013844	1363574227	/nfs/dbraw/zinc/57/42/27/1363574227.db2.gz	YYHJCBCBXGWCDA-SYNHAJSKSA-N	0	3	344.886	3.438	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)Cc2c(F)cccc2Cl)C1	ZINC001099133427	1363644405	/nfs/dbraw/zinc/64/44/05/1363644405.db2.gz	MVXUEZGRACUJSE-UGSOOPFHSA-N	0	3	336.838	3.178	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H]2Cc3ccc(Cl)cc32)C1	ZINC001099142240	1363651380	/nfs/dbraw/zinc/65/13/80/1363651380.db2.gz	BMIAUZMZJAFIEJ-YJLNNSPDSA-N	0	3	330.859	3.136	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cccc3ccccc32)C1	ZINC001099146316	1363653722	/nfs/dbraw/zinc/65/37/22/1363653722.db2.gz	JMKZRVIEVNFPTQ-AVRDEDQJSA-N	0	3	332.447	3.447	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)c2cc3ccccc3n2CC)C1	ZINC001099173328	1363670938	/nfs/dbraw/zinc/67/09/38/1363670938.db2.gz	QUBQIGYXZHWBOI-UWJYYQICSA-N	0	3	337.467	3.432	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H]2Cc3c2cccc3Cl)C1	ZINC001099180963	1363676695	/nfs/dbraw/zinc/67/66/95/1363676695.db2.gz	HHGWEUVOLIALER-CRFBAAHOSA-N	0	3	330.859	3.136	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@H]2CCCC23CC3)C[C@H]1C(F)(F)F	ZINC001099269851	1363724865	/nfs/dbraw/zinc/72/48/65/1363724865.db2.gz	SXKOLDIRULAYMX-MGPQQGTHSA-N	0	3	330.394	3.122	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2cc(C)cc(Cl)c2)C[C@H]1C(F)(F)F	ZINC001099279946	1363729419	/nfs/dbraw/zinc/72/94/19/1363729419.db2.gz	DLCPVSGJUZAYSW-ZIAGYGMSSA-N	0	3	346.780	3.427	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)[C@H](C)c1cccnc1	ZINC001099310508	1363743764	/nfs/dbraw/zinc/74/37/64/1363743764.db2.gz	OICGDSZGPPOZED-AEFFLSMTSA-N	0	3	329.488	3.368	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)CC[C@H]1CC(C)(C)CO1	ZINC001099321059	1363749272	/nfs/dbraw/zinc/74/92/72/1363749272.db2.gz	PKRLVNBNYQRUDG-IRXDYDNUSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2cc(C)c(CC)s2)C[C@H]1C(F)(F)F	ZINC001099340662	1363760307	/nfs/dbraw/zinc/76/03/07/1363760307.db2.gz	XZIMOZXYXUJLCQ-VXGBXAGGSA-N	0	3	346.418	3.397	20	30		EGEDHN
CC(C)CC(=O)N1C[C@@H]2CCC[C@]2(CNCc2ccccc2C#N)C1	ZINC001099366139	1363775905	/nfs/dbraw/zinc/77/59/05/1363775905.db2.gz	TYOZDIHTNPVGFO-FPOVZHCZSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C(C)(C)C(=C)C)CC2(CCOCC2)C1	ZINC001099586682	1363868109	/nfs/dbraw/zinc/86/81/09/1363868109.db2.gz	FNESBPAKPPUBBW-QGZVFWFLSA-N	0	3	334.504	3.152	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)C[C@@H](C)C(C)(C)C)CC2(CCOCC2)C1	ZINC001099596600	1363878786	/nfs/dbraw/zinc/87/87/86/1363878786.db2.gz	HIFCMLAGJLAYSC-IAGOWNOFSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CCN(Cc2ccc(C(C)C)cc2)C[C@@H]1O	ZINC001099975782	1363994771	/nfs/dbraw/zinc/99/47/71/1363994771.db2.gz	GXLYLFVDBKMUQR-UXHICEINSA-N	0	3	344.499	3.218	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](c2ccc(OC)cc2)[C@H](NC[C@@H](F)CC)C1	ZINC001100154700	1364029220	/nfs/dbraw/zinc/02/92/20/1364029220.db2.gz	ARTATOBGXOOSPZ-YTQUADARSA-N	0	3	348.462	3.294	20	30		EGEDHN
O=C(/C=C\C1CC1)NCC1CC(NCC#Cc2ccccc2Cl)C1	ZINC001100219188	1364046967	/nfs/dbraw/zinc/04/69/67/1364046967.db2.gz	SSDOLVAVCXMMNI-KTKRTIGZSA-N	0	3	342.870	3.142	20	30		EGEDHN
C#CCCCC(=O)NCC1CC(NCc2cc(Cl)ccc2OC)C1	ZINC001100285917	1364068012	/nfs/dbraw/zinc/06/80/12/1364068012.db2.gz	YSXIRMICAKDZEF-UHFFFAOYSA-N	0	3	348.874	3.137	20	30		EGEDHN
CC/C(C)=C/C(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100306578	1364074731	/nfs/dbraw/zinc/07/47/31/1364074731.db2.gz	UQDKLZGGISGAJN-RVDMUPIBSA-N	0	3	328.431	3.018	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1	ZINC001100560546	1364162607	/nfs/dbraw/zinc/16/26/07/1364162607.db2.gz	KTKIISIQIHKIOH-UHFFFAOYSA-N	0	3	343.446	3.284	20	30		EGEDHN
CC1(C)CC[C@H]1C(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100586115	1364176015	/nfs/dbraw/zinc/17/60/15/1364176015.db2.gz	NOGQJWJDNMLYLU-KVZIAJEVSA-N	0	3	342.458	3.098	20	30		EGEDHN
C=CCCCC(=O)NCC1CC(NCc2oc(CCC)nc2C)C1	ZINC001100623632	1364194190	/nfs/dbraw/zinc/19/41/90/1364194190.db2.gz	YCOKULLPYCPBQW-UHFFFAOYSA-N	0	3	333.476	3.276	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)CC[C@H](C)CC)C1	ZINC001100775687	1364256813	/nfs/dbraw/zinc/25/68/13/1364256813.db2.gz	DVHWKMKYZCATCH-LMWSTFAQSA-N	0	3	331.298	3.206	20	30		EGEDHN
CC[C@H](C)CCC(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100780650	1364259482	/nfs/dbraw/zinc/25/94/82/1364259482.db2.gz	YUVIEBCCWGTOCA-VQSBYGRUSA-N	0	3	344.474	3.488	20	30		EGEDHN
CC(C)C[C@@H](C)C(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1	ZINC001100795939	1364265703	/nfs/dbraw/zinc/26/57/03/1364265703.db2.gz	MZJSIWCZUWFOBF-MXWWQKGMSA-N	0	3	345.462	3.364	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)[C@@H](C)c2ccc(C)s2)C1	ZINC001100867538	1364301246	/nfs/dbraw/zinc/30/12/46/1364301246.db2.gz	ZBNOJWKOSKYSBP-HSBZDZAISA-N	0	3	326.893	3.397	20	30		EGEDHN
CC/C(C)=C/C(=O)N1C[C@H]2CN(Cc3ccc(C#N)cc3)C[C@@]2(C)C1	ZINC001101225692	1364473708	/nfs/dbraw/zinc/47/37/08/1364473708.db2.gz	RKQDRJVKOSPOND-UXSGICRXSA-N	0	3	337.467	3.195	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@H]2CN(Cc3ccccn3)C[C@@]2(C)C1	ZINC001101248882	1364484958	/nfs/dbraw/zinc/48/49/58/1364484958.db2.gz	XWUPBNAWACGBGL-NQIIRXRSSA-N	0	3	339.483	3.130	20	30		EGEDHN
CC(C)CCC(=O)N[C@@]1(C)CCN(Cc2ccc(OCC#N)cc2)C1	ZINC001324572822	1387682050	/nfs/dbraw/zinc/68/20/50/1387682050.db2.gz	JXKGWKVPJRDNOW-FQEVSTJZSA-N	0	3	343.471	3.106	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@H]2CN(Cc3cnccc3C)C[C@@]2(C)C1	ZINC001101337961	1364516169	/nfs/dbraw/zinc/51/61/69/1364516169.db2.gz	RRUWQVIIYPVTMT-QFUCXCTJSA-N	0	3	341.499	3.273	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@H]2CN(Cc3cnc(C)s3)C[C@@]2(C)C1	ZINC001101337899	1364516810	/nfs/dbraw/zinc/51/68/10/1364516810.db2.gz	PMTPNBIDVHFKEQ-MDZRGWNJSA-N	0	3	347.528	3.334	20	30		EGEDHN
CCCCC[C@H](CC)C(=O)N1C[C@H]2CN(CC#CCOC)C[C@@]2(C)C1	ZINC001101471430	1364574972	/nfs/dbraw/zinc/57/49/72/1364574972.db2.gz	QUEBYALGWYAYHF-ZVDOUQERSA-N	0	3	348.531	3.023	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC(C(C)(C)CNC/C(Cl)=C\Cl)CC1	ZINC001101521932	1364596922	/nfs/dbraw/zinc/59/69/22/1364596922.db2.gz	HFGUZMNDBPJFAP-ACLQVGRQSA-N	0	3	346.302	3.319	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC(C(C)(C)CNCc2nccs2)CC1	ZINC001101539498	1364606272	/nfs/dbraw/zinc/60/62/72/1364606272.db2.gz	VDXBGZYSHCEUSG-UHFFFAOYSA-N	0	3	347.528	3.157	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)N1CCC(C(C)(C)CNCc2ccon2)CC1	ZINC001101564790	1364621461	/nfs/dbraw/zinc/62/14/61/1364621461.db2.gz	GCZSODLEGPKGQP-HOTGVXAUSA-N	0	3	347.503	3.487	20	30		EGEDHN
CC(C)=CC(=O)NC[C@@H]1CN(CC#Cc2ccc(Cl)cc2)C[C@H]1C	ZINC001101699839	1364695040	/nfs/dbraw/zinc/69/50/40/1364695040.db2.gz	UVWSUMPZUHJBSL-SJLPKXTDSA-N	0	3	344.886	3.342	20	30		EGEDHN
CC(C)CCC(=O)NC[C@@H]1CN(CC#Cc2ccccc2)C[C@H]1C	ZINC001101709816	1364698456	/nfs/dbraw/zinc/69/84/56/1364698456.db2.gz	NKSBUDJOCJRCBF-UYAOXDASSA-N	0	3	326.484	3.158	20	30		EGEDHN
CC/C(C)=C\C(=O)NC[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1C	ZINC001101940885	1364783101	/nfs/dbraw/zinc/78/31/01/1364783101.db2.gz	UMPRUZIAJYAEPO-CYKNGCMHSA-N	0	3	343.446	3.238	20	30		EGEDHN
CC(C)[C@H](C)C(=O)NC[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1C	ZINC001102422982	1365047381	/nfs/dbraw/zinc/04/73/81/1365047381.db2.gz	IQIURRRGHPKWOH-RVKKMQEKSA-N	0	3	345.462	3.174	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H]2CN(Cc3ocnc3C)C[C@H]2C)CCCC1	ZINC001102621036	1365139867	/nfs/dbraw/zinc/13/98/67/1365139867.db2.gz	HETTZBFCEWQYJR-NVXWUHKLSA-N	0	3	345.487	3.304	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1CCNC(=O)C1CCC1	ZINC001102632264	1365144570	/nfs/dbraw/zinc/14/45/70/1365144570.db2.gz	OBWQBAVMLFBNDO-RHSMWYFYSA-N	0	3	343.446	3.072	20	30		EGEDHN
CCCCC(=O)NCC[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1C	ZINC001102670487	1365164115	/nfs/dbraw/zinc/16/41/15/1365164115.db2.gz	CXVHMUFVAQAYHX-CRAIPNDOSA-N	0	3	345.462	3.462	20	30		EGEDHN
C#CCCCC(=O)NCC[C@@H]1CN(Cc2ccc(F)cc2F)C[C@H]1C	ZINC001102917202	1365291024	/nfs/dbraw/zinc/29/10/24/1365291024.db2.gz	RJQHIWVEXHXITC-HZPDHXFCSA-N	0	3	348.437	3.343	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)cc2F)C[C@H]1CCNC(=O)C1(C)CC1	ZINC001103013735	1365337512	/nfs/dbraw/zinc/33/75/12/1365337512.db2.gz	MYLHYMSOSAHRHL-GDBMZVCRSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)C[C@H]2CC(C)(C)CO2)C1	ZINC001103222458	1365443027	/nfs/dbraw/zinc/44/30/27/1365443027.db2.gz	NWLIATTUWABXQY-BMFZPTHFSA-N	0	3	342.911	3.018	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)C2CCC(OC)CC2)C1	ZINC001103380388	1365526300	/nfs/dbraw/zinc/52/63/00/1365526300.db2.gz	UOVNTKPFABEORD-CRYBEJKASA-N	0	3	342.911	3.018	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)CC(F)(F)C(F)F)C1	ZINC001103435813	1365558938	/nfs/dbraw/zinc/55/89/38/1365558938.db2.gz	AMBQKUCRFVMLEE-MWLCHTKSSA-N	0	3	344.780	3.104	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)NCC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001103453393	1365569338	/nfs/dbraw/zinc/56/93/38/1365569338.db2.gz	XAUDOUAUDGBHQH-ATNYBXOESA-N	0	3	345.512	3.240	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC[C@@H]1CN(Cc2ccc(F)cn2)C[C@H]1C	ZINC001103475233	1365584397	/nfs/dbraw/zinc/58/43/97/1365584397.db2.gz	YKSOVGSENFPUEZ-HZPDHXFCSA-N	0	3	347.478	3.397	20	30		EGEDHN
CC(C)[C@H](C)C(=O)NCC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001103489235	1365593217	/nfs/dbraw/zinc/59/32/17/1365593217.db2.gz	HHZWAXMVTIATEZ-OWCLPIDISA-N	0	3	347.528	3.486	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)C(C)(C)C(F)(F)F)C1	ZINC001103662012	1365710441	/nfs/dbraw/zinc/71/04/41/1365710441.db2.gz	YROHMPHJQZVPMI-ZYHUDNBSSA-N	0	3	340.817	3.402	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)CC#Cc2ccccc2)C1	ZINC001103744441	1365760364	/nfs/dbraw/zinc/76/03/64/1365760364.db2.gz	AUCIFEYWIUCXQH-VQIMIIECSA-N	0	3	344.886	3.255	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2ccc(F)s2)C1	ZINC001103774892	1365778318	/nfs/dbraw/zinc/77/83/18/1365778318.db2.gz	WVVPSIAQZRXPNL-ZYHUDNBSSA-N	0	3	330.856	3.328	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CN(C(=O)[C@H](C)CC)C[C@H]1C	ZINC001103902875	1365828381	/nfs/dbraw/zinc/82/83/81/1365828381.db2.gz	VZFVYWNBTQXSFS-YRGRVCCFSA-N	0	3	331.298	3.015	20	30		EGEDHN
CC(C)C#CC(=O)N1C[C@@H](C)[C@H](CCNCc2ccc(F)cc2F)C1	ZINC001104163268	1365932626	/nfs/dbraw/zinc/93/26/26/1365932626.db2.gz	FJRYAXOQBGMXGF-NVXWUHKLSA-N	0	3	348.437	3.198	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H](C)[C@H](CCNCc2conc2C)C1	ZINC001104231727	1365961822	/nfs/dbraw/zinc/96/18/22/1365961822.db2.gz	OTPXBDXIIWMDDC-CRAIPNDOSA-N	0	3	345.487	3.326	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)[C@H](CCN[C@H](C)c2cnc(C)cn2)C1	ZINC001104246889	1365967494	/nfs/dbraw/zinc/96/74/94/1365967494.db2.gz	LQGTVBOUCYKNGL-KBAYOESNSA-N	0	3	344.503	3.277	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1C[C@@H](C)[C@H](CCNCc2conc2CC)C1	ZINC001104563018	1366078141	/nfs/dbraw/zinc/07/81/41/1366078141.db2.gz	HIJYBWBDJJXPDO-IXDOHACOSA-N	0	3	347.503	3.414	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](C)[C@H](CCN[C@H](C)c2cnc(C)cn2)C1	ZINC001104606705	1366098525	/nfs/dbraw/zinc/09/85/25/1366098525.db2.gz	BJLKHCROZJVHFG-KBAYOESNSA-N	0	3	344.503	3.277	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H](C)[C@H](CCN[C@H](C)c2cnccn2)C1	ZINC001104731563	1366149000	/nfs/dbraw/zinc/14/90/00/1366149000.db2.gz	OJGHAJXECFAPKS-BRWVUGGUSA-N	0	3	344.503	3.214	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)C[C@H](C)n2cccc2)C[C@H]1C	ZINC001104926835	1366226979	/nfs/dbraw/zinc/22/69/79/1366226979.db2.gz	GDRMMCAMZGXIKB-HYVNUMGLSA-N	0	3	337.895	3.266	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)CCC(F)(F)F)CC1	ZINC001105391430	1366439336	/nfs/dbraw/zinc/43/93/36/1366439336.db2.gz	DYUVJAMYOSJNGW-INIZCTEOSA-N	0	3	342.405	3.055	20	30		EGEDHN
C[C@@H]1CN(C(=O)C#CC(C)(C)C)C[C@H]1CNC/C(Cl)=C/Cl	ZINC001106109021	1366611896	/nfs/dbraw/zinc/61/18/96/1366611896.db2.gz	AOBSRHHVMBSQID-HBMOZRESSA-N	0	3	331.287	3.039	20	30		EGEDHN
C#CCCCCCC(=O)N1C[C@@H](CNCc2nc(C)cs2)[C@H](C)C1	ZINC001106533856	1366725228	/nfs/dbraw/zinc/72/52/28/1366725228.db2.gz	OPTSTONVHCZDKO-NVXWUHKLSA-N	0	3	347.528	3.219	20	30		EGEDHN
C#CCCCCCC(=O)N1C[C@@H](CNCc2ncc(C)s2)[C@H](C)C1	ZINC001106533670	1366725416	/nfs/dbraw/zinc/72/54/16/1366725416.db2.gz	GAWRUSJXSNCPAA-NVXWUHKLSA-N	0	3	347.528	3.219	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@@H](CNCc2csc(C)n2)[C@H](C)C1	ZINC001106562659	1366736720	/nfs/dbraw/zinc/73/67/20/1366736720.db2.gz	DALQPRFWDIPDDR-FVQBIDKESA-N	0	3	335.517	3.238	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@@H](CNCc2csc(CC)n2)[C@H](C)C1	ZINC001106562705	1366736840	/nfs/dbraw/zinc/73/68/40/1366736840.db2.gz	DJXZYAKVDRUUJO-BZUAXINKSA-N	0	3	349.544	3.492	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1C[C@@H](CNCc2cc(C3CC3)no2)[C@H](C)C1	ZINC001106563997	1366737422	/nfs/dbraw/zinc/73/74/22/1366737422.db2.gz	PKXYFXWBODXHPA-ZMSDIMECSA-N	0	3	345.487	3.338	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](N(C)CCOc2cc(C)ccc2C)C1	ZINC001189318711	1366988704	/nfs/dbraw/zinc/98/87/04/1366988704.db2.gz	OBFWAOFWIQSZEM-SFHVURJKSA-N	0	3	330.472	3.181	20	30		EGEDHN
CCC[C@@H](C(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C1)C(C)C	ZINC001186019963	1387847161	/nfs/dbraw/zinc/84/71/61/1387847161.db2.gz	UTYNDMNARNYLIK-RHSMWYFYSA-N	0	3	333.501	3.383	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCCc1csc(C)n1)C2	ZINC001109291521	1367042116	/nfs/dbraw/zinc/04/21/16/1367042116.db2.gz	SOKZIWBLGKGPHU-IKGGRYGDSA-N	0	3	333.501	3.072	20	30		EGEDHN
CCC(CC)(CC)C(=O)NC[C@]12CCC[C@H]1N(CC#CCOC)CC2	ZINC001107587455	1367058613	/nfs/dbraw/zinc/05/86/13/1367058613.db2.gz	PQNUFCKCANYAHE-WIYYLYMNSA-N	0	3	348.531	3.213	20	30		EGEDHN
COCC#CCN1CC[C@@]2(CNC(=O)C[C@@H](C)C(C)(C)C)CCC[C@@H]12	ZINC001107618387	1367075953	/nfs/dbraw/zinc/07/59/53/1367075953.db2.gz	BMRHKBWDIROYHY-DBXWQHBBSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCc1scnc1C	ZINC001109353165	1367084192	/nfs/dbraw/zinc/08/41/92/1367084192.db2.gz	LHOXCRDMVMMFEM-PMPSAXMXSA-N	0	3	333.501	3.072	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](N(C)Cc2ccc(COC)cc2)C1	ZINC001189744689	1367100858	/nfs/dbraw/zinc/10/08/58/1367100858.db2.gz	XMFKHQWBIIQIOT-HXUWFJFHSA-N	0	3	342.483	3.059	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](N(C)Cc2cccc(OCCC)c2)C1	ZINC001189911014	1367129377	/nfs/dbraw/zinc/12/93/77/1367129377.db2.gz	WMECGDPMDZYXSW-LJQANCHMSA-N	0	3	342.483	3.312	20	30		EGEDHN
C=CCC[C@H](C)N1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ncc(Cl)s1)C2	ZINC001109517160	1367172060	/nfs/dbraw/zinc/17/20/60/1367172060.db2.gz	YRQRPUWSLXFOCA-RNJOBUHISA-N	0	3	339.892	3.486	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@](C)(CNC(=O)c2c(C)coc2C)C1	ZINC001107914888	1367200959	/nfs/dbraw/zinc/20/09/59/1367200959.db2.gz	SZMFEBDGWVASPQ-DNVCBOLYSA-N	0	3	334.460	3.072	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3CCCCCF)cc1	ZINC001109587692	1367213673	/nfs/dbraw/zinc/21/36/73/1367213673.db2.gz	VENNYVLEDHOGLF-QYZOEREBSA-N	0	3	328.431	3.143	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2cccc(F)c2C)C1	ZINC001107957916	1367216282	/nfs/dbraw/zinc/21/62/82/1367216282.db2.gz	QGCGPKHHGXMBMH-YWZLYKJASA-N	0	3	348.462	3.310	20	30		EGEDHN
CCC(C)(C)CC(=O)N1CC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001190361059	1367239282	/nfs/dbraw/zinc/23/92/82/1367239282.db2.gz	BFHASSLQTSZPDV-GOSISDBHSA-N	0	3	327.472	3.417	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001190387157	1367247252	/nfs/dbraw/zinc/24/72/52/1367247252.db2.gz	AEEUYVFEWDNUHR-GOSISDBHSA-N	0	3	325.456	3.193	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](N(C)CCc2scnc2C)C1	ZINC001190397106	1367252552	/nfs/dbraw/zinc/25/25/52/1367252552.db2.gz	IGOKVTXHMSAEIW-OAHLLOKOSA-N	0	3	335.517	3.129	20	30		EGEDHN
CCOC(=O)C(C#N)NC(=O)Nc1ccc(Oc2ccccc2)cc1	ZINC001190426819	1367261450	/nfs/dbraw/zinc/26/14/50/1367261450.db2.gz	IFAFXKKOSYEEKP-INIZCTEOSA-N	0	3	339.351	3.056	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](N(C)Cc2cccc(COC)c2)C1	ZINC001190428751	1367263303	/nfs/dbraw/zinc/26/33/03/1367263303.db2.gz	OQGIYLWTXREIPO-LJQANCHMSA-N	0	3	330.472	3.222	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)C2(CC=C)CCC2)C1	ZINC001108187981	1367331679	/nfs/dbraw/zinc/33/16/79/1367331679.db2.gz	PIGVXCUVBFOUIB-HKUYNNGSSA-N	0	3	334.504	3.295	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@@](C)(CNC(=O)c2ccoc2CCC)C1	ZINC001108340400	1367398524	/nfs/dbraw/zinc/39/85/24/1367398524.db2.gz	AULBQACEMUXAEX-JXFKEZNVSA-N	0	3	348.487	3.408	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](C)c1ccc(C)s1)C2	ZINC001109975438	1367439625	/nfs/dbraw/zinc/43/96/25/1367439625.db2.gz	UEGXOTLVALJCOO-NCOADZHNSA-N	0	3	348.512	3.084	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)CCc2ccc(C)o2)C1	ZINC001108417431	1367444224	/nfs/dbraw/zinc/44/42/24/1367444224.db2.gz	AQGKFVHTBJYLAF-UZLBHIALSA-N	0	3	348.487	3.082	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)CC(C2CC2)C2CC2)C1	ZINC001108422145	1367446380	/nfs/dbraw/zinc/44/63/80/1367446380.db2.gz	IXSJBWLAXXZDBU-HRAATJIYSA-N	0	3	348.531	3.375	20	30		EGEDHN
C#CCC1(C(=O)NC[C@]2(C)CN(C[C@@H](C)CC)CCO2)CCCCC1	ZINC001108429699	1367453440	/nfs/dbraw/zinc/45/34/40/1367453440.db2.gz	MODQUJMCNZXNDT-AZUAARDMSA-N	0	3	348.531	3.213	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](c1ccc(F)cc1)C(C)C)C2	ZINC001110171796	1367542472	/nfs/dbraw/zinc/54/24/72/1367542472.db2.gz	UTZQFCBEJUVWQE-FUMNGEBKSA-N	0	3	342.458	3.310	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@@H](C)Cc1cccc(F)c1)C2	ZINC001110188756	1367556394	/nfs/dbraw/zinc/55/63/94/1367556394.db2.gz	PFXZPTZYECTOMC-VLQPXKRTSA-N	0	3	330.447	3.302	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](N(C)Cc2ccc(OC)cc2)C1	ZINC001191754151	1367577289	/nfs/dbraw/zinc/57/72/89/1367577289.db2.gz	MEEYJHHTAJARLE-LJQANCHMSA-N	0	3	342.483	3.312	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CC[C@@H](N(C)CCOCc2ccccc2)C1	ZINC001191902880	1367630874	/nfs/dbraw/zinc/63/08/74/1367630874.db2.gz	STAHLCGGAZQGQW-UYAOXDASSA-N	0	3	344.499	3.338	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCCOc1ccccc1C	ZINC001110371336	1367674247	/nfs/dbraw/zinc/67/42/47/1367674247.db2.gz	JHMNSUPXEXAOAA-QRVBRYPASA-N	0	3	342.483	3.452	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](N(C)Cc2ccccc2N(C)C)C1	ZINC001192073755	1367681430	/nfs/dbraw/zinc/68/14/30/1367681430.db2.gz	WJNLDEKHYMDQDS-GOSISDBHSA-N	0	3	329.488	3.142	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@@H](N(C)C[C@@H](O)c2ccc(CC)cc2)C1	ZINC001192093943	1367685914	/nfs/dbraw/zinc/68/59/14/1367685914.db2.gz	OKJJNTOHWBEKTM-WOJBJXKFSA-N	0	3	344.499	3.171	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCc1ccc2ccccc2c1	ZINC001110402138	1367692681	/nfs/dbraw/zinc/69/26/81/1367692681.db2.gz	YGIPADHRGBDDRS-DOVSJBTNSA-N	0	3	347.462	3.263	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](N(C)CCOc3ccccc3)C2)CCC1	ZINC001192189492	1367710752	/nfs/dbraw/zinc/71/07/52/1367710752.db2.gz	FLWAVCYIPXDYPK-GOSISDBHSA-N	0	3	342.483	3.345	20	30		EGEDHN
COc1cc(C#N)ccc1C(=O)N(C1CCCC1)C1CCN(C)CC1	ZINC001192255695	1367731518	/nfs/dbraw/zinc/73/15/18/1367731518.db2.gz	HWZKFJWWSDMOQV-UHFFFAOYSA-N	0	3	341.455	3.046	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](N(C)Cc2ccc3c(c2)COC3)C1	ZINC001192586042	1367825631	/nfs/dbraw/zinc/82/56/31/1367825631.db2.gz	HTQXMZZKRKYLIG-LJQANCHMSA-N	0	3	342.483	3.352	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)COc1ccc(C(C)C)cc1)C2	ZINC001110775175	1367974738	/nfs/dbraw/zinc/97/47/38/1367974738.db2.gz	CMLPGMMPJCNLGK-RLLQIKCJSA-N	0	3	342.483	3.486	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2cccc3ccsc32)C1	ZINC001193245290	1367978371	/nfs/dbraw/zinc/97/83/71/1367978371.db2.gz	ZGTSHXAUUSZHEK-MRXNPFEDSA-N	0	3	344.480	3.250	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)[C@H](F)CC2CCCCC2)C1	ZINC001193468833	1368038615	/nfs/dbraw/zinc/03/86/15/1368038615.db2.gz	IUYKVDAHFRFZKY-QZTJIDSGSA-N	0	3	340.483	3.030	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](Cc1ccccc1)C(C)C)C2	ZINC001111021604	1368144880	/nfs/dbraw/zinc/14/48/80/1368144880.db2.gz	AWHPYYUWDXZFNV-NCYKPQTJSA-N	0	3	338.495	3.246	20	30		EGEDHN
C=C[C@H](C(=O)N1CC[C@@H](N(C)CCOC2CCC2)C1)c1ccccc1	ZINC001194183807	1368202867	/nfs/dbraw/zinc/20/28/67/1368202867.db2.gz	URZZIQPQQAKCBP-QUCCMNQESA-N	0	3	342.483	3.058	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)C[C@H](C=C)c2ccccc2)C1	ZINC001194200933	1368207123	/nfs/dbraw/zinc/20/71/23/1368207123.db2.gz	QENUQARDKMZXMI-ICSRJNTNSA-N	0	3	342.483	3.082	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)C[C@H](C)c2ccc(F)cc2)C1	ZINC001194200877	1368207625	/nfs/dbraw/zinc/20/76/25/1368207625.db2.gz	PDEFIALWWBYQRC-LPHOPBHVSA-N	0	3	348.462	3.055	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@@H](CC)C(C)(C)C)C2	ZINC001111269041	1368235872	/nfs/dbraw/zinc/23/58/72/1368235872.db2.gz	MZLXXVHIKISYPC-TVFCKZIOSA-N	0	3	336.520	3.373	20	30		EGEDHN
CCCCCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ncccc1OC)C2	ZINC001111319779	1368265847	/nfs/dbraw/zinc/26/58/47/1368265847.db2.gz	FZLMJEUKCPPWRW-ZACQAIPSSA-N	0	3	345.487	3.396	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)COC[C@H](C)c1ccccc1)C2	ZINC001111334232	1368267247	/nfs/dbraw/zinc/26/72/47/1368267247.db2.gz	QJXCSTQVYMOUNP-NBYUQASBSA-N	0	3	342.483	3.104	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)CCc2ccc(C)cc2)C1	ZINC001194545911	1368283251	/nfs/dbraw/zinc/28/32/51/1368283251.db2.gz	SICJHCXMBANUCP-WOJBJXKFSA-N	0	3	346.515	3.059	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](N(C)C[C@H]3CC(C)(C)CO3)C2)CCCC1	ZINC001194565790	1368288183	/nfs/dbraw/zinc/28/81/83/1368288183.db2.gz	ADJWCCITHKODHO-QZTJIDSGSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3[C@@H](C)COC)CCCCC1	ZINC001111442588	1368309263	/nfs/dbraw/zinc/30/92/63/1368309263.db2.gz	YQLOTLMJUFXBTN-MLHJIOFPSA-N	0	3	334.504	3.269	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2[C@@H](C)c1cccc(C)c1	ZINC001111487510	1368318303	/nfs/dbraw/zinc/31/83/03/1368318303.db2.gz	SLFRPIAHFBKADW-NBYUQASBSA-N	0	3	342.483	3.370	20	30		EGEDHN
C=CCCC(=O)N1C[C@H](C)OC2(CCN(Cc3ccsc3)CC2)C1	ZINC001111540412	1368335677	/nfs/dbraw/zinc/33/56/77/1368335677.db2.gz	KWVHLRXONRAIAJ-INIZCTEOSA-N	0	3	348.512	3.296	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)C2(C3CCC3)CCC2)C1	ZINC001195039224	1368365519	/nfs/dbraw/zinc/36/55/19/1368365519.db2.gz	ZYLVBNFMFQYWRK-QZTJIDSGSA-N	0	3	336.520	3.089	20	30		EGEDHN
CCC[C@H](C)C(=O)N[C@]12CCC[C@H]1CN(Cc1cccc(C#N)c1)C2	ZINC001111673098	1368418252	/nfs/dbraw/zinc/41/82/52/1368418252.db2.gz	XYJUVVQJGJKCOX-LRQRDZAKSA-N	0	3	339.483	3.465	20	30		EGEDHN
C#CCCCC(=O)N1CCCN(CCc2ccccc2CC)CC1	ZINC001195674623	1368470034	/nfs/dbraw/zinc/47/00/34/1368470034.db2.gz	IJMZOZBGFXYYJT-UHFFFAOYSA-N	0	3	326.484	3.129	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)CC(C)(C)CC(F)F)C1	ZINC001111810572	1368475135	/nfs/dbraw/zinc/47/51/35/1368475135.db2.gz	FZXDKVFOJHCPAZ-KSSFIOAISA-N	0	3	326.431	3.052	20	30		EGEDHN
Cc1cc(C)c(CN2CCCN(C(=O)C#CC(C)C)CC2)c(C)c1	ZINC001195746780	1368482077	/nfs/dbraw/zinc/48/20/77/1368482077.db2.gz	HDZPUBVFUKABKL-UHFFFAOYSA-N	0	3	326.484	3.306	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H](C)OCc2ccc(C)cc2)C1	ZINC001111822631	1368482785	/nfs/dbraw/zinc/48/27/85/1368482785.db2.gz	IJVQQDQDRAHUMY-CUWPLCDZSA-N	0	3	342.483	3.057	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CCCN(CC2CCC(F)(F)CC2)CC1	ZINC001195785427	1368489585	/nfs/dbraw/zinc/48/95/85/1368489585.db2.gz	LTYGDUXGIOEGLA-UHFFFAOYSA-N	0	3	340.458	3.396	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cn(C)nc2C2CC2)CC1	ZINC001195982578	1368528579	/nfs/dbraw/zinc/52/85/79/1368528579.db2.gz	XVBWDXWXUKBVKC-UHFFFAOYSA-N	0	3	344.503	3.192	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(C#N)cc1)C2	ZINC001111887876	1368531873	/nfs/dbraw/zinc/53/18/73/1368531873.db2.gz	DPHNRXNDZZVDQX-PBEJRMEISA-N	0	3	339.483	3.321	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CCCN(CC2=CCCCC2)CC1)OCC	ZINC001196024681	1368538017	/nfs/dbraw/zinc/53/80/17/1368538017.db2.gz	JGWWFWPNGPQNFZ-IBGZPJMESA-N	0	3	334.504	3.392	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cc3n(n2)CCCC3)CC1	ZINC001196231859	1368572826	/nfs/dbraw/zinc/57/28/26/1368572826.db2.gz	NIMGCLQPPKWPRN-UHFFFAOYSA-N	0	3	344.503	3.114	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@H](CC)c2ccc(OC)cc2)C1	ZINC001112001058	1368605072	/nfs/dbraw/zinc/60/50/72/1368605072.db2.gz	FQSCFJQLXJUUPT-DSKINZAPSA-N	0	3	342.483	3.346	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@H](C)c2cccc(C)c2)C1	ZINC001196447030	1368616674	/nfs/dbraw/zinc/61/66/74/1368616674.db2.gz	ZHFVATNELDCZLS-MISYRCLQSA-N	0	3	346.515	3.230	20	30		EGEDHN
C=CCC[C@H](C)N1CCCN(C(=O)c2nc3cnccc3s2)CC1	ZINC001196480927	1368624618	/nfs/dbraw/zinc/62/46/18/1368624618.db2.gz	SGXXOPLUVHAFKN-AWEZNQCLSA-N	0	3	344.484	3.194	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cc(OCC)no2)CC1	ZINC001196522900	1368632217	/nfs/dbraw/zinc/63/22/17/1368632217.db2.gz	NQOJNMUWXSWYPV-UHFFFAOYSA-N	0	3	337.464	3.192	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C(F)(F)F)[C@H](NCCC(F)(F)F)C1	ZINC001112109519	1368662561	/nfs/dbraw/zinc/66/25/61/1368662561.db2.gz	TTZCWFKQQYHVPB-GHMZBOCLSA-N	0	3	346.315	3.274	20	30		EGEDHN
C=CCCCN1CCCN(C(=O)c2c(F)ccc(F)c2OC)CC1	ZINC001196717855	1368669001	/nfs/dbraw/zinc/66/90/01/1368669001.db2.gz	BZPPEDLDXWUTPB-UHFFFAOYSA-N	0	3	338.398	3.088	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@H](C)CC(F)(F)F)C[C@H]1C(F)(F)F	ZINC001112135607	1368675825	/nfs/dbraw/zinc/67/58/25/1368675825.db2.gz	FPYWTDZBNBXVEG-GMTAPVOTSA-N	0	3	346.315	3.130	20	30		EGEDHN
CC#CCCCC(=O)N1CCCN(CCCc2ccsc2)CC1	ZINC001196846694	1368697012	/nfs/dbraw/zinc/69/70/12/1368697012.db2.gz	IOWQBNWHNWJMOH-UHFFFAOYSA-N	0	3	332.513	3.409	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@H](CC)CC(F)(F)F)C[C@H]1C(F)(F)F	ZINC001112193908	1368708048	/nfs/dbraw/zinc/70/80/48/1368708048.db2.gz	ALSZGOBONNVNLX-GMTAPVOTSA-N	0	3	346.315	3.130	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2ccc(C)nc2OC)CC1	ZINC001197353937	1368795094	/nfs/dbraw/zinc/79/50/94/1368795094.db2.gz	MAAGFNBBMJUNQF-UHFFFAOYSA-N	0	3	345.487	3.293	20	30		EGEDHN
C=CCC1(C(=O)N2CCCN(CCCCCF)CC2)CCOCC1	ZINC001197994654	1368938694	/nfs/dbraw/zinc/93/86/94/1368938694.db2.gz	BTLYGDJFHPQIAU-UHFFFAOYSA-N	0	3	340.483	3.033	20	30		EGEDHN
C=CC[C@@H](C(=O)N1CCCN(CCC[C@H](C)O)CC1)c1ccccc1	ZINC001198196287	1368978018	/nfs/dbraw/zinc/97/80/18/1368978018.db2.gz	AJFMQRFJDXAYBX-AZUAARDMSA-N	0	3	344.499	3.042	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)C(=O)N1CCCN(CCCF)CC1	ZINC001198197509	1368978643	/nfs/dbraw/zinc/97/86/43/1368978643.db2.gz	PAGDNNSHBIAUCB-LJQANCHMSA-N	0	3	332.463	3.315	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N1CCCN(Cc2c(C)cc(C)cc2C)CC1	ZINC001198336526	1369011009	/nfs/dbraw/zinc/01/10/09/1369011009.db2.gz	DHSWUIJYZPDLGK-IBGZPJMESA-N	0	3	344.499	3.237	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N1CCCN([C@@H](C)c2ccccc2C)CC1	ZINC001198344195	1369013239	/nfs/dbraw/zinc/01/32/39/1369013239.db2.gz	RASKVZQGEFXPBU-ROUUACIJSA-N	0	3	330.472	3.181	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)CCCC(C)=O)c1ccccc1OC	ZINC001198529507	1369054564	/nfs/dbraw/zinc/05/45/64/1369054564.db2.gz	GHRQGDNNIAIKGA-SFHVURJKSA-N	0	3	346.471	3.168	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)CCCCOC)c1ccccc1OC	ZINC001198595030	1369069079	/nfs/dbraw/zinc/06/90/79/1369069079.db2.gz	GDYFOANGVMBXJU-GOSISDBHSA-N	0	3	348.487	3.225	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC[C@H](NCCCC)c1ccccc1OC	ZINC001198594944	1369069196	/nfs/dbraw/zinc/06/91/96/1369069196.db2.gz	FPGBLKHHBCRADA-AEFFLSMTSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)c1ccn(C)c1)c1ccccc1OC	ZINC001198655628	1369084546	/nfs/dbraw/zinc/08/45/46/1369084546.db2.gz	GDXDCKLBRPLILB-SFHVURJKSA-N	0	3	341.455	3.061	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)CO[C@@H](C)CC)c1ccccc1OC	ZINC001198668737	1369087394	/nfs/dbraw/zinc/08/73/94/1369087394.db2.gz	VBSYKKNGWOQJAB-WMZOPIPTSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)[C@@H]2CCc3cc(OC)ccc32)CC1	ZINC001112929853	1369094640	/nfs/dbraw/zinc/09/46/40/1369094640.db2.gz	PXNHYOQDRPWZRY-OXQOHEQNSA-N	0	3	342.483	3.224	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)c2ccccc2-c2cn[nH]c2)CC1	ZINC001112936960	1369097095	/nfs/dbraw/zinc/09/70/95/1369097095.db2.gz	JWCSEYQNAHPTRU-MRXNPFEDSA-N	0	3	338.455	3.189	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)C1(C(F)F)CC1)c1ccccc1OC	ZINC001198723698	1369099901	/nfs/dbraw/zinc/09/99/01/1369099901.db2.gz	IMHVIJLYWJJEHG-CQSZACIVSA-N	0	3	338.398	3.064	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)Cc2cncc3ccccc32)CC1	ZINC001112978819	1369121515	/nfs/dbraw/zinc/12/15/15/1369121515.db2.gz	UDGOQRVHQQRMSL-QGZVFWFLSA-N	0	3	337.467	3.276	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@H](NCCCF)c1ccccc1OC	ZINC001198916552	1369148438	/nfs/dbraw/zinc/14/84/38/1369148438.db2.gz	OZCSZJCQZNEGCZ-INIZCTEOSA-N	0	3	336.451	3.404	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)c1nccs1)c1ccccc1OC	ZINC001198944933	1369154310	/nfs/dbraw/zinc/15/43/10/1369154310.db2.gz	IPSMSPMWLQLDRM-OAHLLOKOSA-N	0	3	345.468	3.179	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CCC3CCCC3)C[C@H]2O)CCCCC1	ZINC001198949885	1369156393	/nfs/dbraw/zinc/15/63/93/1369156393.db2.gz	ICAFFQJZTMBBRO-RTBURBONSA-N	0	3	348.531	3.255	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)C2CC(C(C)(C)C)C2)C1	ZINC001199270746	1369200792	/nfs/dbraw/zinc/20/07/92/1369200792.db2.gz	NVLVORYGXJPPBV-OPQOLIRYSA-N	0	3	338.536	3.190	20	30		EGEDHN
C=CCCC(=O)N1CCCO[C@H](CN[C@H](C)c2ccccc2F)C1	ZINC001200101273	1369315622	/nfs/dbraw/zinc/31/56/22/1369315622.db2.gz	TWLOKRJURXDVGE-HZPDHXFCSA-N	0	3	334.435	3.060	20	30		EGEDHN
C#CCCCC(=O)N1CCC(N[C@H](C)c2c(F)cccc2F)CC1	ZINC001200317014	1369347316	/nfs/dbraw/zinc/34/73/16/1369347316.db2.gz	HLAIRHPQEDSFTQ-CQSZACIVSA-N	0	3	334.410	3.410	20	30		EGEDHN
CC/C(C)=C\C(=O)N1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001200406595	1369362086	/nfs/dbraw/zinc/36/20/86/1369362086.db2.gz	USSDDLGOXCXTEB-UVTDQMKNSA-N	0	3	329.419	3.134	20	30		EGEDHN
CC(C)[C@@H](NC(=S)NCCN1CCCCC1)c1cccc(C#N)c1	ZINC001200440394	1369367897	/nfs/dbraw/zinc/36/78/97/1369367897.db2.gz	OCBHNAYJIONHPZ-GOSISDBHSA-N	0	3	344.528	3.205	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCCO[C@H](CNCc2ccsc2)C1	ZINC001200604985	1369399357	/nfs/dbraw/zinc/39/93/57/1369399357.db2.gz	BEWBVBHXZZELGI-MRXNPFEDSA-N	0	3	336.501	3.058	20	30		EGEDHN
C=CCC[C@@H](C)N1CCN(C(=O)Cc2csc(C(C)(C)C)n2)CC1	ZINC001113433696	1369425137	/nfs/dbraw/zinc/42/51/37/1369425137.db2.gz	ZOEHBNWZLWXFLM-OAHLLOKOSA-N	0	3	349.544	3.482	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC(NC/C(Cl)=C/Cl)CC1	ZINC001202005028	1369665393	/nfs/dbraw/zinc/66/53/93/1369665393.db2.gz	WKOPUTZUNXFRMO-OWBHPGMISA-N	0	3	331.287	3.470	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)N1CCC(NCc2cc(C3CC3)no2)CC1	ZINC001202084385	1369683562	/nfs/dbraw/zinc/68/35/62/1369683562.db2.gz	BLSIQTKNCRLOGW-ZIAGYGMSSA-N	0	3	331.460	3.091	20	30		EGEDHN
CC(C)C(=O)N[C@@H]1C[C@H](NCC#Cc2cccc(Cl)c2)C12CCC2	ZINC001202459391	1369778336	/nfs/dbraw/zinc/77/83/36/1369778336.db2.gz	OKIPZIUPOYZPIL-ZWKOTPCHSA-N	0	3	344.886	3.365	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@H](NCc2nc(C)c(C)s2)C12CCC2	ZINC001202592180	1369815707	/nfs/dbraw/zinc/81/57/07/1369815707.db2.gz	RZIIYHWPDZCLKI-GJZGRUSLSA-N	0	3	333.501	3.243	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@@H](NCc2ccncc2Cl)C12CCC2	ZINC001202593286	1369817072	/nfs/dbraw/zinc/81/70/72/1369817072.db2.gz	ZMZGXYLVTJCXMZ-CVEARBPZSA-N	0	3	333.863	3.218	20	30		EGEDHN
O=C(CCC1CC1)N[C@@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202652412	1369838073	/nfs/dbraw/zinc/83/80/73/1369838073.db2.gz	CBSHQNHYNJRWGH-WOJBJXKFSA-N	0	3	336.479	3.245	20	30		EGEDHN
O=C(C=C1CCC1)N[C@@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202711628	1369860785	/nfs/dbraw/zinc/86/07/85/1369860785.db2.gz	BIOMPFKJNHMCQI-WOJBJXKFSA-N	0	3	334.463	3.165	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1C[C@@H](NCc2cc(F)ccc2F)C12CCC2	ZINC001202867365	1369912360	/nfs/dbraw/zinc/91/23/60/1369912360.db2.gz	QHZRAADQTZTYTA-QZTJIDSGSA-N	0	3	346.421	3.141	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1C[C@@H](NCc2ccc(F)cn2)C12CCC2	ZINC001202960211	1369937265	/nfs/dbraw/zinc/93/72/65/1369937265.db2.gz	KSJRUFGPUDBIAE-IAGOWNOFSA-N	0	3	345.462	3.340	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1C[C@@H](NCc2ccccn2)C12CCC2	ZINC001202961405	1369937864	/nfs/dbraw/zinc/93/78/64/1369937864.db2.gz	XIWUAAHGAMDWRN-IAGOWNOFSA-N	0	3	327.472	3.201	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1C[C@H](NCc2oc(C)nc2C)C12CCC2	ZINC001202968138	1369940448	/nfs/dbraw/zinc/94/04/48/1369940448.db2.gz	JHYKKXRPZWHJOU-IRXDYDNUSA-N	0	3	345.487	3.411	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1C[C@@H](NCc2oc(CC)nc2C)C12CCC2	ZINC001202987991	1369947171	/nfs/dbraw/zinc/94/71/71/1369947171.db2.gz	PNOUXJZWLWLLSB-SJORKVTESA-N	0	3	345.487	3.419	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1C[C@H](NCc2oc(CC)nc2C)C12CCC2	ZINC001202987985	1369947398	/nfs/dbraw/zinc/94/73/98/1369947398.db2.gz	PNOUXJZWLWLLSB-DLBZAZTESA-N	0	3	345.487	3.419	20	30		EGEDHN
N#Cc1cccc(O[C@H]2CCCN(Cc3cccc4nonc43)C2)c1	ZINC001203139212	1369995744	/nfs/dbraw/zinc/99/57/44/1369995744.db2.gz	FICNRTVORZUOSR-KRWDZBQOSA-N	0	3	334.379	3.138	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1[C@H]2CN(CCOc3ccc(C)cc3)C[C@H]21	ZINC001114672512	1370018873	/nfs/dbraw/zinc/01/88/73/1370018873.db2.gz	RAXTVZFSUQVAMN-BWTSREIZSA-N	0	3	342.483	3.023	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(F)cc3C)C[C@H]21	ZINC001114679977	1370021768	/nfs/dbraw/zinc/02/17/68/1370021768.db2.gz	CTOCRGDEWFETQN-PIIMJCKOSA-N	0	3	330.447	3.283	20	30		EGEDHN
CC1(CC(=O)N[C@H]2C[C@H](NCC#Cc3ccccc3)C23CCC3)CC1	ZINC001203214700	1370028007	/nfs/dbraw/zinc/02/80/07/1370028007.db2.gz	XUUQKBPBQBDUKL-OALUTQOASA-N	0	3	336.479	3.245	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1C[C@H](NCc2c(C)noc2C)C12CCC2	ZINC001203256295	1370044134	/nfs/dbraw/zinc/04/41/34/1370044134.db2.gz	HIICSALXSBGROO-IRXDYDNUSA-N	0	3	345.487	3.411	20	30		EGEDHN
CC1(C(=O)N[C@H]2C[C@@H](NCC#Cc3ccccc3)C23CCC3)CCC1	ZINC001203259001	1370046242	/nfs/dbraw/zinc/04/62/42/1370046242.db2.gz	UKEZSMXWBYSFLL-MOPGFXCFSA-N	0	3	336.479	3.245	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1C[C@@H](NCc2nc(C)c(C)s2)C12CCC2	ZINC001203274478	1370054989	/nfs/dbraw/zinc/05/49/89/1370054989.db2.gz	NWQDONFIGSAJGH-CABCVRRESA-N	0	3	347.528	3.489	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1C[C@@H](NCc2cccc(Cl)n2)C12CCC2	ZINC001203273979	1370054914	/nfs/dbraw/zinc/05/49/14/1370054914.db2.gz	LRCBUEMLEKJCMJ-HUUCEWRRSA-N	0	3	347.890	3.464	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001203275441	1370055871	/nfs/dbraw/zinc/05/58/71/1370055871.db2.gz	UWSJAHGVRBRRPM-MOPGFXCFSA-N	0	3	336.479	3.267	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1C[C@@H](NCc2cnc(C)o2)C12CCC2	ZINC001203295502	1370066989	/nfs/dbraw/zinc/06/69/89/1370066989.db2.gz	LKZHYTTTXUVYGX-QZTJIDSGSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N[C@@H]1[C@H]2CN(CCCCC(F)(F)F)C[C@H]21	ZINC001114792410	1370083350	/nfs/dbraw/zinc/08/33/50/1370083350.db2.gz	SGTHZTRAAVKHQK-ORIJERBGSA-N	0	3	332.410	3.368	20	30		EGEDHN
CCC(C)(C)C(=O)N[C@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001203331889	1370086021	/nfs/dbraw/zinc/08/60/21/1370086021.db2.gz	JBQPQGWWROWXSL-OALUTQOASA-N	0	3	338.495	3.491	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CCN(Cc3ccccc3F)C2)C1	ZINC001203345948	1370092361	/nfs/dbraw/zinc/09/23/61/1370092361.db2.gz	DWWUYYIYAFGZCO-IBGZPJMESA-N	0	3	332.419	3.436	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)C2(C(C)(F)F)CC2)C12CCC2	ZINC001203419137	1370118061	/nfs/dbraw/zinc/11/80/61/1370118061.db2.gz	KMHZDYSIGCBOKL-VXGBXAGGSA-N	0	3	332.822	3.191	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1C[C@@H](NCc2cnc(C)o2)C12CCC2	ZINC001203450531	1370130514	/nfs/dbraw/zinc/13/05/14/1370130514.db2.gz	BMURUQWUXPAROF-CVEARBPZSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1C[C@H](NCc2ccc(F)cn2)C12CCC2	ZINC001203454323	1370132933	/nfs/dbraw/zinc/13/29/33/1370132933.db2.gz	YOQBSQVBWDSGFI-IRXDYDNUSA-N	0	3	345.462	3.340	20	30		EGEDHN
C=CC1(CC(=O)N[C@@H]2[C@H]3CN(CCOCCCC)C[C@H]32)CCCCC1	ZINC001114968106	1370183335	/nfs/dbraw/zinc/18/33/35/1370183335.db2.gz	GVUDCGYAHMIWBH-RUYXUALKSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)C(C)(C)C(C)(F)F)C12CCC2	ZINC001203670579	1370210008	/nfs/dbraw/zinc/21/00/08/1370210008.db2.gz	PWWNIDOUNQCQIB-NEPJUHHUSA-N	0	3	334.838	3.437	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1ccc(O)c(O)c1)[C@@H]2CC	ZINC001203878206	1370297499	/nfs/dbraw/zinc/29/74/99/1370297499.db2.gz	QYCRLDLTUPKHSB-QUCCMNQESA-N	0	3	344.455	3.019	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001203900194	1370305814	/nfs/dbraw/zinc/30/58/14/1370305814.db2.gz	FABHGBDLEGIDBG-HXUWFJFHSA-N	0	3	339.439	3.169	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(NCc3cc(C)no3)CC2)CCCC1	ZINC001204140635	1370388225	/nfs/dbraw/zinc/38/82/25/1370388225.db2.gz	XIHGLTFNEWQXLN-UHFFFAOYSA-N	0	3	331.460	3.200	20	30		EGEDHN
N#Cc1ccc(F)c(CNC2(CNC(=O)C3CCC3)CCCCC2)c1	ZINC001115377073	1370416491	/nfs/dbraw/zinc/41/64/91/1370416491.db2.gz	AJXHIWBQJFNGJC-UHFFFAOYSA-N	0	3	343.446	3.406	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)NCC1(NCc2ccc(C#N)cc2F)CCCCC1	ZINC001115389182	1370426425	/nfs/dbraw/zinc/42/64/25/1370426425.db2.gz	KGGIVIAYRCTVQC-RHSMWYFYSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=CCOCC(=O)NCC1(NCc2cc(C)ccc2F)CCCCC1	ZINC001115447852	1370457209	/nfs/dbraw/zinc/45/72/09/1370457209.db2.gz	GPWGKBYNFKCKBN-UHFFFAOYSA-N	0	3	348.462	3.245	20	30		EGEDHN
C[C@H](C#N)C(=O)NCC1(NCc2ccccc2Cl)CCCCC1	ZINC001115451699	1370459074	/nfs/dbraw/zinc/45/90/74/1370459074.db2.gz	CXQBNSVBAYSESF-CQSZACIVSA-N	0	3	333.863	3.408	20	30		EGEDHN
Cc1nsc(C)c1CNC1(CNC(=O)C#CC2CC2)CCCCC1	ZINC001115527178	1370525370	/nfs/dbraw/zinc/52/53/70/1370525370.db2.gz	FIGLAXBOBVJHRR-UHFFFAOYSA-N	0	3	345.512	3.082	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H]2CN([C@H]3CCc4c3cc(F)cc4F)C[C@H]21	ZINC001187233670	1388078662	/nfs/dbraw/zinc/07/86/62/1388078662.db2.gz	XDVBHXPEBYAEGP-FASAQXTFSA-N	0	3	346.421	3.451	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCC1(NCc2cnc(C)cn2)CCCCC1	ZINC001115554674	1370551899	/nfs/dbraw/zinc/55/18/99/1370551899.db2.gz	MIWMOSQGGUFPSL-UHFFFAOYSA-N	0	3	344.503	3.296	20	30		EGEDHN
C#CCC1(C(=O)NCC2(NCc3ccccn3)CCCCC2)CCC1	ZINC001115567759	1370569209	/nfs/dbraw/zinc/56/92/09/1370569209.db2.gz	SILVGFWCDTZMDO-UHFFFAOYSA-N	0	3	339.483	3.184	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cccn3nccc23)CCCCC1	ZINC001115614588	1370612625	/nfs/dbraw/zinc/61/26/25/1370612625.db2.gz	JJHBEWYNWAVGJA-UHFFFAOYSA-N	0	3	346.862	3.109	20	30		EGEDHN
C#CCCCCC(=O)N1CCC(CNCc2cc(C3CC3)no2)CC1	ZINC001205039533	1370635936	/nfs/dbraw/zinc/63/59/36/1370635936.db2.gz	XNMFUCXEMMZHQM-UHFFFAOYSA-N	0	3	343.471	3.074	20	30		EGEDHN
C#CCCCC(=O)N1CCC(CNCc2cc(O)ccc2Cl)CC1	ZINC001205137559	1370661473	/nfs/dbraw/zinc/66/14/73/1370661473.db2.gz	NJFWOLRSQXWPDW-UHFFFAOYSA-N	0	3	348.874	3.177	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)C2(c3cccnc3)CC2)CCCCC1	ZINC001115688101	1370671302	/nfs/dbraw/zinc/67/13/02/1370671302.db2.gz	KYBKSEOTVGZZNL-UHFFFAOYSA-N	0	3	347.890	3.274	20	30		EGEDHN
CC/C(C)=C/C(=O)N1CCC(CNCc2cc(F)ccc2C#N)CC1	ZINC001205195832	1370675856	/nfs/dbraw/zinc/67/58/56/1370675856.db2.gz	FQRIAFWRLBUNCM-XNTDXEJSSA-N	0	3	343.446	3.382	20	30		EGEDHN
C[C@H]1C[C@H]1CC(=O)NCC1(NCC#Cc2ccccc2)CCCCC1	ZINC001115710438	1370688913	/nfs/dbraw/zinc/68/89/13/1370688913.db2.gz	KUCAMDIGEYKLMV-ICSRJNTNSA-N	0	3	338.495	3.493	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)C2(CF)CC2)CCCCC1	ZINC001115724254	1370703916	/nfs/dbraw/zinc/70/39/16/1370703916.db2.gz	UQMNZSCMGLLMBG-UHFFFAOYSA-N	0	3	347.272	3.053	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](c2ccc(F)cc2)[C@H](NCC#CC)C1	ZINC001205292666	1370709253	/nfs/dbraw/zinc/70/92/53/1370709253.db2.gz	MCFNXZJVFCWXLZ-VQTJNVASSA-N	0	3	342.458	3.479	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)/C(C)=C/CC)C[C@H]1c1cccc(F)c1	ZINC001205383587	1370737338	/nfs/dbraw/zinc/73/73/38/1370737338.db2.gz	DOIADXFIIJSNQL-READLGFQSA-N	0	3	328.431	3.089	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C[C@@H](C)CCC)C[C@H]1c1cccc(F)c1	ZINC001205386618	1370738332	/nfs/dbraw/zinc/73/83/32/1370738332.db2.gz	YLUBDFCWTGLSHV-ZYSHUDEJSA-N	0	3	330.447	3.169	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](c2cccc(F)c2)[C@H](NC/C=C/Cl)C1	ZINC001205386480	1370738516	/nfs/dbraw/zinc/73/85/16/1370738516.db2.gz	RQYJWAQMNNUSCS-OQRFJMDLSA-N	0	3	336.838	3.428	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC(CNCc2ccccc2C#N)CC1	ZINC001205404790	1370746159	/nfs/dbraw/zinc/74/61/59/1370746159.db2.gz	NPOSHHDMLYZUIJ-UHFFFAOYSA-N	0	3	325.456	3.243	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](c2cccc(F)c2)[C@H](NCC#CC)C1	ZINC001205412219	1370747327	/nfs/dbraw/zinc/74/73/27/1370747327.db2.gz	CUTVVVQESVLQKS-RBUKOAKNSA-N	0	3	342.458	3.335	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H](CCC)C(C)C)C[C@H]1c1cccc(F)c1	ZINC001205439878	1370755595	/nfs/dbraw/zinc/75/55/95/1370755595.db2.gz	OUYBNKAVFPUPEF-SLFFLAALSA-N	0	3	344.474	3.415	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@@H](C)C(C)C)C[C@H]1c1cccc(F)c1	ZINC001205439790	1370755771	/nfs/dbraw/zinc/75/57/71/1370755771.db2.gz	KUSPPPYUQHILQY-ZYSHUDEJSA-N	0	3	330.447	3.025	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N1CCN(C(C)(C)C)CC1	ZINC001116324195	1370886530	/nfs/dbraw/zinc/88/65/30/1370886530.db2.gz	AVYJVDYSXSOJAC-INIZCTEOSA-N	0	3	349.544	3.067	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@@H](NCc3ccc4c(c3)CCC4)C2=O)cc1	ZINC001116511593	1370927403	/nfs/dbraw/zinc/92/74/03/1370927403.db2.gz	ICXNKVMDSWBYNQ-OAQYLSRUSA-N	0	3	345.446	3.332	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CN(CCc2ccccc2Cl)C[C@H]1C	ZINC001206911312	1371220505	/nfs/dbraw/zinc/22/05/05/1371220505.db2.gz	KEYAYWVXBJWJDS-CRAIPNDOSA-N	0	3	332.875	3.123	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1CN(CCOc2cccc(C)c2)C[C@H]1C	ZINC001207190315	1371325517	/nfs/dbraw/zinc/32/55/17/1371325517.db2.gz	MQMRYHXZCWGZCH-IEBWSBKVSA-N	0	3	330.472	3.167	20	30		EGEDHN
O=C([C@@H]1CC=CCC1)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207258000	1371342466	/nfs/dbraw/zinc/34/24/66/1371342466.db2.gz	CCIMFVHXCHCYSL-UYAOXDASSA-N	0	3	340.442	3.114	20	30		EGEDHN
O=C(c1ccc(Cl)o1)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001207306827	1371355833	/nfs/dbraw/zinc/35/58/33/1371355833.db2.gz	OEWQPGNYSDOBGF-MRXNPFEDSA-N	0	3	342.826	3.179	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001207362564	1371374265	/nfs/dbraw/zinc/37/42/65/1371374265.db2.gz	HKMUYQHDAJRESJ-YJBOKZPZSA-N	0	3	332.875	3.318	20	30		EGEDHN
CCCCC(=O)N1CCC[C@@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207372133	1371378245	/nfs/dbraw/zinc/37/82/45/1371378245.db2.gz	BBYIBDXVAKSCML-GOSISDBHSA-N	0	3	332.875	3.462	20	30		EGEDHN
C=CCOC[C@@H]1CCC[C@@]12CN(CCc1ccc(OC)cc1)CCO2	ZINC001207478263	1371407697	/nfs/dbraw/zinc/40/76/97/1371407697.db2.gz	BWVWVDZJSZVASN-PZJWPPBQSA-N	0	3	345.483	3.311	20	30		EGEDHN
N#Cc1ccnc(N2CCN(CCCc3cccc(Cl)c3)CC2)c1	ZINC001207590644	1371445564	/nfs/dbraw/zinc/44/55/64/1371445564.db2.gz	QEOVMMBJUXTDGR-UHFFFAOYSA-N	0	3	340.858	3.361	20	30		EGEDHN
CCC[C@H](C)CC(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001207644409	1371462034	/nfs/dbraw/zinc/46/20/34/1371462034.db2.gz	DRIQTIWESPLDFO-ICSRJNTNSA-N	0	3	326.484	3.445	20	30		EGEDHN
CC(C)[C@@H](C)CC(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001207645152	1371463041	/nfs/dbraw/zinc/46/30/41/1371463041.db2.gz	KLJCYXZEFARDSK-FXAWDEMLSA-N	0	3	344.474	3.440	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207763568	1371497792	/nfs/dbraw/zinc/49/77/92/1371497792.db2.gz	FBFOVDGTKWUKQN-VSEHZYKHSA-N	0	3	330.859	3.238	20	30		EGEDHN
CC1(C)C[C@H]1C(=O)N1CCC[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001207820049	1371513497	/nfs/dbraw/zinc/51/34/97/1371513497.db2.gz	OJTPMLMKTKFANE-IRXDYDNUSA-N	0	3	344.886	3.318	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)CCCOCC)C1	ZINC001120329692	1371536825	/nfs/dbraw/zinc/53/68/25/1371536825.db2.gz	UKLNVCZOQMKIMM-SJORKVTESA-N	0	3	342.911	3.259	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H]([C@@H]2CCCN2Cc2nc(C)oc2C)C1	ZINC001120348583	1371542398	/nfs/dbraw/zinc/54/23/98/1371542398.db2.gz	YSSMJRDKYVLMDU-MJGOQNOKSA-N	0	3	345.487	3.461	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@H]([C@H]2CCCN2Cc2ccns2)C1	ZINC001120382763	1371554821	/nfs/dbraw/zinc/55/48/21/1371554821.db2.gz	RERHUTPECZVOFH-FUHWJXTLSA-N	0	3	345.512	3.150	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N[C@@H]1CN(Cc2ccc(C)cc2)C[C@H]1C	ZINC001208129668	1371603931	/nfs/dbraw/zinc/60/39/31/1371603931.db2.gz	ZWTSODBVUOZIFC-QFUCXCTJSA-N	0	3	344.499	3.160	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)N[C@@H]1CN(Cc2cccc(C)c2)C[C@H]1C	ZINC001208129410	1371604299	/nfs/dbraw/zinc/60/42/99/1371604299.db2.gz	UZFZUJWLAFXCPG-QFUCXCTJSA-N	0	3	344.499	3.160	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H]2CN(Cc3cc4ccccc4o3)C[C@H]21	ZINC001187729682	1388152075	/nfs/dbraw/zinc/15/20/75/1388152075.db2.gz	RXHXQMZXEWCMEV-PKOBYXMFSA-N	0	3	336.435	3.269	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CN(C[C@H](OC)c2ccccc2)C[C@H]1C	ZINC001208374173	1371741726	/nfs/dbraw/zinc/74/17/26/1371741726.db2.gz	BVLMFNNKSXHFNT-RLLQIKCJSA-N	0	3	342.483	3.004	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CN(CCOc2ccc(C)cc2)C[C@H]1C	ZINC001208374628	1371741780	/nfs/dbraw/zinc/74/17/80/1371741780.db2.gz	QFMZXPSERCNWMZ-UYAOXDASSA-N	0	3	342.483	3.004	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1CN(CCOc2ccccc2C)C[C@H]1C	ZINC001208393694	1371751078	/nfs/dbraw/zinc/75/10/78/1371751078.db2.gz	WZLSVRZIDACJHH-GUDVDZBRSA-N	0	3	344.499	3.413	20	30		EGEDHN
O=C(N1CCC[C@H](NCC#Cc2ccccc2)C1)C12CCC(CC1)C2	ZINC001208423771	1371762405	/nfs/dbraw/zinc/76/24/05/1371762405.db2.gz	PEFTVAVFRWZFHS-FUHYEJFZSA-N	0	3	336.479	3.199	20	30		EGEDHN
C=CCOc1ccc(C(=O)N2CCC[C@H](NC[C@H](F)CC)C2)cc1	ZINC001208433226	1371765036	/nfs/dbraw/zinc/76/50/36/1371765036.db2.gz	VNZHCTYXCYXDME-SJORKVTESA-N	0	3	334.435	3.194	20	30		EGEDHN
C=C(Br)CNC1CC2(C1)CC(NC(=O)/C=C(\C)CC)C2	ZINC001121072588	1371848349	/nfs/dbraw/zinc/84/83/49/1371848349.db2.gz	WHLDLONRVVGDGL-VZUCSPMQSA-N	0	3	341.293	3.268	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC1CC2(CC(NCc3nccs3)C2)C1	ZINC001121164053	1371873405	/nfs/dbraw/zinc/87/34/05/1371873405.db2.gz	XRXAXTHACGZCHF-UHFFFAOYSA-N	0	3	333.501	3.262	20	30		EGEDHN
N#Cc1ccc(CCCN2CCN3CCc4ccccc4[C@@H]3C2)cc1	ZINC001208863694	1371923727	/nfs/dbraw/zinc/92/37/27/1371923727.db2.gz	BQQRHIZOPOOBKB-QFIPXVFZSA-N	0	3	331.463	3.406	20	30		EGEDHN
CCOC(=O)CCCc1ccc(C#N)cc1NC1=CCN(C)CC1	ZINC001208980409	1371966918	/nfs/dbraw/zinc/96/69/18/1371966918.db2.gz	TZEHHFZGIVIHGW-UHFFFAOYSA-N	0	3	327.428	3.075	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CC2(C1)CC(N[C@@H](C)c1cnc(C)cn1)C2	ZINC001121534806	1372002848	/nfs/dbraw/zinc/00/28/48/1372002848.db2.gz	WNXZGKUCSMBRSP-VPDSAYSTSA-N	0	3	342.487	3.075	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCC[C@@H](NCc2ccc(Cl)nc2)C1	ZINC001209184198	1372029965	/nfs/dbraw/zinc/02/99/65/1372029965.db2.gz	RRPXNRMSQZSQMT-GDBMZVCRSA-N	0	3	335.879	3.418	20	30		EGEDHN
CC1(C)CC(CC(=O)N2CCC[C@@H](NCC#Cc3ccccc3)C2)C1	ZINC001209212855	1372039847	/nfs/dbraw/zinc/03/98/47/1372039847.db2.gz	HNFPKTXEOZVENQ-HXUWFJFHSA-N	0	3	338.495	3.445	20	30		EGEDHN
C=CCCCC(=O)NC1CC2(CC(NCc3ncc(C)s3)C2)C1	ZINC001121667467	1372040103	/nfs/dbraw/zinc/04/01/03/1372040103.db2.gz	IIMPQUCOMXJNAN-UHFFFAOYSA-N	0	3	333.501	3.325	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001209335906	1372071363	/nfs/dbraw/zinc/07/13/63/1372071363.db2.gz	RZSQIAGAWGDXPP-QGZVFWFLSA-N	0	3	329.419	3.134	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@H](NCc2cccc(NC(C)=O)c2)C1	ZINC001209335955	1372071529	/nfs/dbraw/zinc/07/15/29/1372071529.db2.gz	UCPOHTRARYYOBM-IBGZPJMESA-N	0	3	343.471	3.082	20	30		EGEDHN
COc1cc(C#N)ccc1Nc1ccc(N2CCN(C)CC2)cc1C	ZINC001209410928	1372098111	/nfs/dbraw/zinc/09/81/11/1372098111.db2.gz	FWMFLJVBSALSBM-UHFFFAOYSA-N	0	3	336.439	3.371	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)C[C@H](C)C2CCCCC2)C1	ZINC001209425037	1372103132	/nfs/dbraw/zinc/10/31/32/1372103132.db2.gz	OVQOISHTOFAOIK-YQVWRLOYSA-N	0	3	336.520	3.232	20	30		EGEDHN
O=C(N1CCC[C@H](NCC#Cc2ccccc2)C1)[C@]12C[C@H]1CCCC2	ZINC001209523203	1372127545	/nfs/dbraw/zinc/12/75/45/1372127545.db2.gz	GXTBDQHWCYASLW-RZUBCFFCSA-N	0	3	336.479	3.199	20	30		EGEDHN
CCCC1(C(=O)N2CCC[C@@H](NCc3ccc(C#N)s3)C2)CC1	ZINC001209551083	1372135327	/nfs/dbraw/zinc/13/53/27/1372135327.db2.gz	FOSITXAYIGEJJS-CQSZACIVSA-N	0	3	331.485	3.281	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)C(C)(C)C(C)(F)F)C2	ZINC001122124763	1372180727	/nfs/dbraw/zinc/18/07/27/1372180727.db2.gz	YVJCMSIVEONSDA-UHFFFAOYSA-N	0	3	334.838	3.437	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)COc1ccc(C)cc1)C2	ZINC001122150715	1372188605	/nfs/dbraw/zinc/18/86/05/1372188605.db2.gz	DMUBQULNGYXRME-UHFFFAOYSA-N	0	3	348.874	3.143	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)CCCCCOCC)C2	ZINC001122268154	1372217615	/nfs/dbraw/zinc/21/76/15/1372217615.db2.gz	NPMOSINYKZITQF-UHFFFAOYSA-N	0	3	342.911	3.353	20	30		EGEDHN
C[C@@H](CC(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1)n1cccc1	ZINC001210736020	1372416524	/nfs/dbraw/zinc/41/65/24/1372416524.db2.gz	HNEHWBVHXUMPMA-PZJWPPBQSA-N	0	3	349.478	3.072	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1)c1ccccc1	ZINC001210774088	1372424175	/nfs/dbraw/zinc/42/41/75/1372424175.db2.gz	QZAYVUVBBBPNNS-KNQAVFIVSA-N	0	3	346.474	3.422	20	30		EGEDHN
CCCCCCCCC(=O)N1CCC[C@H](NCc2ccnn2C)C1	ZINC001210804631	1372430130	/nfs/dbraw/zinc/43/01/30/1372430130.db2.gz	KPNUDKASQLWOKS-KRWDZBQOSA-N	0	3	334.508	3.251	20	30		EGEDHN
C=C(CN1CCCCC1)c1nc(-c2ccccc2-n2ccnc2)no1	ZINC001211436116	1372559077	/nfs/dbraw/zinc/55/90/77/1372559077.db2.gz	BEPKHBGLAWIWRJ-UHFFFAOYSA-N	0	3	335.411	3.421	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)CC(C)(C)C2CC2)C[C@H]1c1ccccc1	ZINC001211593363	1372587444	/nfs/dbraw/zinc/58/74/44/1372587444.db2.gz	UOKQAOZHQOADCH-VQTJNVASSA-N	0	3	338.495	3.420	20	30		EGEDHN
CC[C@@H](F)CN[C@@H]1CN(C(=O)C#CC(C)(C)C)C[C@H]1c1ccccc1	ZINC001211596217	1372588051	/nfs/dbraw/zinc/58/80/51/1372588051.db2.gz	BDHFTENNGYAQMI-CEXWTWQISA-N	0	3	344.474	3.368	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@@H](CC)CCC)C[C@H]1c1ccccc1	ZINC001211698447	1372604509	/nfs/dbraw/zinc/60/45/09/1372604509.db2.gz	OLUSDQTXRDCWLJ-YSIASYRMSA-N	0	3	326.484	3.420	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C(C2CC2)C2CC2)C[C@H]1c1ccccc1	ZINC001211705441	1372606180	/nfs/dbraw/zinc/60/61/80/1372606180.db2.gz	JFBXQLHUNFYBOF-VQTJNVASSA-N	0	3	336.479	3.030	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2c(C)oc3ccccc32)[C@H](OC)C1	ZINC001212311431	1372685276	/nfs/dbraw/zinc/68/52/76/1372685276.db2.gz	MXNRAVQVMRGJSZ-SJLPKXTDSA-N	0	3	342.439	3.136	20	30		EGEDHN
Cc1nc2cc(Nc3ccc(N4CCN(C)CC4)c(C#N)c3)ccc2[nH]1	ZINC001213074462	1372834982	/nfs/dbraw/zinc/83/49/82/1372834982.db2.gz	VQIFJYHEMKITCQ-UHFFFAOYSA-N	0	3	346.438	3.238	20	30		EGEDHN
Cc1nc2ccc(Nc3ccc(N4CCN(C)CC4)c(C#N)c3)cc2[nH]1	ZINC001213074462	1372834988	/nfs/dbraw/zinc/83/49/88/1372834988.db2.gz	VQIFJYHEMKITCQ-UHFFFAOYSA-N	0	3	346.438	3.238	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)C2(C3CC3)CCC2)[C@H](OC)C1	ZINC001213224358	1372863969	/nfs/dbraw/zinc/86/39/69/1372863969.db2.gz	YPLWNKYFFRTZPR-QZTJIDSGSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)[C@H]2CC[C@H](C(C)C)CC2)[C@H](OC)C1	ZINC001213615948	1372935523	/nfs/dbraw/zinc/93/55/23/1372935523.db2.gz	MBMKGMGMMZKSER-NCXUSEDFSA-N	0	3	336.520	3.230	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)C(C2CC2)C2CC2)[C@H](OC)C1	ZINC001213697072	1372946603	/nfs/dbraw/zinc/94/66/03/1372946603.db2.gz	DVVKPVVLXQHXPD-QZTJIDSGSA-N	0	3	336.520	3.208	20	30		EGEDHN
N#CC[C@@H](C(=O)NC[C@H]1CCCN1Cc1ccccc1)c1ccccc1	ZINC001126213445	1372949175	/nfs/dbraw/zinc/94/91/75/1372949175.db2.gz	BWAUOZHIDJVVSA-NHCUHLMSSA-N	0	3	347.462	3.465	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)C[C@@H](C)n2cccc2)[C@H](OC)C1	ZINC001213753487	1372956589	/nfs/dbraw/zinc/95/65/89/1372956589.db2.gz	IQBIHOFPYNUQMM-GUDVDZBRSA-N	0	3	349.519	3.225	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H](NC(=O)c2sccc2C2CC2)[C@H](OC)C1	ZINC001213815673	1372965532	/nfs/dbraw/zinc/96/55/32/1372965532.db2.gz	JXSNQFHUOQTXKW-KBRIMQKVSA-N	0	3	348.512	3.409	20	30		EGEDHN
C=C[C@@H](C(=O)N[C@@H]1CN(CC/C=C/CC)C[C@H]1OC)c1ccccc1	ZINC001213900215	1372977976	/nfs/dbraw/zinc/97/79/76/1372977976.db2.gz	VNAWFPQDRWLBCI-PFRNKHFKSA-N	0	3	342.483	3.128	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H](NC(=O)c2sccc2CC)[C@H](OC)C1	ZINC001213905564	1372978384	/nfs/dbraw/zinc/97/83/84/1372978384.db2.gz	DPGMDMVETVRYMG-NUEKZKHPSA-N	0	3	336.501	3.094	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H](NC(=O)c2ccoc2C(C)C)[C@H](OC)C1	ZINC001213953482	1372986003	/nfs/dbraw/zinc/98/60/03/1372986003.db2.gz	IMRZVJZTZIEYGX-DJIMGWMZSA-N	0	3	334.460	3.187	20	30		EGEDHN
CCCCCC(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001214148061	1373015499	/nfs/dbraw/zinc/01/54/99/1373015499.db2.gz	IPQQLTFLDSFVTG-VQIMIIECSA-N	0	3	330.447	3.194	20	30		EGEDHN
CCCC[C@H](C)C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001214550750	1373079073	/nfs/dbraw/zinc/07/90/73/1373079073.db2.gz	QPCXFZQADHPBDE-QMTMVMCOSA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@@H]2C[C@@H]3C=C[C@H]2CC3)C[C@H]1NCC#Cc1ccccc1	ZINC001214670014	1373100095	/nfs/dbraw/zinc/10/00/95/1373100095.db2.gz	FZQOYJKUFLODNP-MIUGBVLSSA-N	0	3	348.490	3.077	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2)C1	ZINC001214713412	1373107009	/nfs/dbraw/zinc/10/70/09/1373107009.db2.gz	IMQPACPXIJXELC-CRAIPNDOSA-N	0	3	344.886	3.253	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NCCNCc1ccc(F)c(Cl)c1	ZINC001128208607	1373235542	/nfs/dbraw/zinc/23/55/42/1373235542.db2.gz	FVIVGINYPZUCFS-UHFFFAOYSA-N	0	3	333.234	3.464	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NCCNCc1ccccc1OC(C)C)OCC	ZINC001128528680	1373283913	/nfs/dbraw/zinc/28/39/13/1373283913.db2.gz	RPBPRSBTURVQSQ-IBGZPJMESA-N	0	3	348.487	3.051	20	30		EGEDHN
C[C@@H]1CN(C(=O)[C@@H]2CC[C@@H](C)CC2)C[C@H]1NCC#Cc1ccccc1	ZINC001216482777	1373310494	/nfs/dbraw/zinc/31/04/94/1373310494.db2.gz	CADWNFKLWMHYOZ-VURPSTOHSA-N	0	3	338.495	3.301	20	30		EGEDHN
C=CCn1cccc1C(=O)NCCN[C@H](C)c1ccc(F)c(F)c1	ZINC001129503137	1373391853	/nfs/dbraw/zinc/39/18/53/1373391853.db2.gz	XAQRUPFWRHXUEX-CYBMUJFWSA-N	0	3	333.382	3.033	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)c3ccccc3)[C@H]2C1	ZINC001217200631	1373404675	/nfs/dbraw/zinc/40/46/75/1373404675.db2.gz	KJRXOZPJBZTTMZ-RBUKOAKNSA-N	0	3	330.472	3.182	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)C2(C)CCCCCC2)C1	ZINC001130396072	1373519332	/nfs/dbraw/zinc/51/93/32/1373519332.db2.gz	WOOCOLKPHJOALE-MRXNPFEDSA-N	0	3	344.503	3.362	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)CC2(C)CCCCC2)C1	ZINC001130401824	1373521127	/nfs/dbraw/zinc/52/11/27/1373521127.db2.gz	NYHDUTYMEQCMBO-MRXNPFEDSA-N	0	3	344.503	3.362	20	30		EGEDHN
C=C(C)CCC(=O)N1CCO[C@@H]2CN(Cc3c(C)cccc3C)C[C@@H]21	ZINC001218032692	1373544093	/nfs/dbraw/zinc/54/40/93/1373544093.db2.gz	ZWFNBIMCTFVCNT-VQTJNVASSA-N	0	3	342.483	3.071	20	30		EGEDHN
N#Cc1ccc(-c2ccc(Cl)cc2)nc1O[C@@H]1CCNC[C@@H]1F	ZINC001218066558	1373552299	/nfs/dbraw/zinc/55/22/99/1373552299.db2.gz	MAURDZDLOPVEDN-GOEBONIOSA-N	0	3	331.778	3.352	20	30		EGEDHN
N#Cc1ccc(OCc2ccccc2)cc1O[C@@H]1CCNC[C@H]1F	ZINC001218066950	1373552319	/nfs/dbraw/zinc/55/23/19/1373552319.db2.gz	OWXLERZXSIGMFP-QZTJIDSGSA-N	0	3	326.371	3.216	20	30		EGEDHN
C(=N/N=C/c1ccccc1O[C@H]1CC[C@@H]2NCCO[C@H]21)\c1ccccc1	ZINC001218149323	1373570273	/nfs/dbraw/zinc/57/02/73/1373570273.db2.gz	IIYUGVPLFAKEEL-OGTQZROLSA-N	0	3	349.434	3.038	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2OCCN(C(=O)c3ccc(CC)s3)[C@H]2C1	ZINC001218253689	1373584906	/nfs/dbraw/zinc/58/49/06/1373584906.db2.gz	ZOVJEIQXFXUKNO-BHYGNILZSA-N	0	3	348.512	3.190	20	30		EGEDHN
N#Cc1ccnc(NC(=O)C[C@@H](N)c2ccc(Cl)cc2Cl)c1	ZINC001218503980	1373627354	/nfs/dbraw/zinc/62/73/54/1373627354.db2.gz	LNWGEQJUSJYJJA-CYBMUJFWSA-N	0	3	335.194	3.289	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)Nc1csc(Br)n1	ZINC001218627810	1373637943	/nfs/dbraw/zinc/63/79/43/1373637943.db2.gz	TYOJGPZIJHYKEP-VIFPVBQESA-N	0	3	332.267	3.308	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)C[C@@H](C)CCCCC)[C@H]2C1	ZINC001218737307	1373649249	/nfs/dbraw/zinc/64/92/49/1373649249.db2.gz	LZKMYYCHKGCRRY-GBESFXJTSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)CCC3CCCCC3)[C@H]2C1	ZINC001219016600	1373679770	/nfs/dbraw/zinc/67/97/70/1373679770.db2.gz	KNWFDUFIIIYSQS-RBUKOAKNSA-N	0	3	334.504	3.225	20	30		EGEDHN
Cc1cc(Cl)cc(C(=O)NCCNCc2ccc(F)c(C#N)c2)c1	ZINC001131362923	1373684138	/nfs/dbraw/zinc/68/41/38/1373684138.db2.gz	RBQJTLRFFQNBQI-UHFFFAOYSA-N	0	3	345.805	3.179	20	30		EGEDHN
Cc1cc(C#N)c(F)cc1NC(=O)[C@H](N)C12CC3CC(CC(C3)C1)C2	ZINC001219112270	1373687768	/nfs/dbraw/zinc/68/77/68/1373687768.db2.gz	AQYFHVZRFDPDJV-HLJROMEYSA-N	0	3	341.430	3.488	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)O[C@@]2(CCN(Cc3ccc(C)cc3)C2)C1	ZINC001131645606	1373741088	/nfs/dbraw/zinc/74/10/88/1373741088.db2.gz	HSNVVIAKHFTGPJ-WIYYLYMNSA-N	0	3	342.483	3.153	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C1(CCC)CCC1)C[C@H](C)O2	ZINC001131673457	1373756118	/nfs/dbraw/zinc/75/61/18/1373756118.db2.gz	MLPWBZRJZKJRLV-PXNSSMCTSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2CN([C@@H](CC)c3ccccc3)C[C@@H]2O)CC1	ZINC001220292153	1373764557	/nfs/dbraw/zinc/76/45/57/1373764557.db2.gz	ORMKWHYCSAKXIZ-QYZOEREBSA-N	0	3	342.483	3.045	20	30		EGEDHN
C=CCCCCCN1CC[C@@H]2CN(C(=O)c3ncoc3C3CC3)[C@@H]2C1	ZINC001221918340	1373803315	/nfs/dbraw/zinc/80/33/15/1373803315.db2.gz	IKABTIMNXKBILA-IAGOWNOFSA-N	0	3	343.471	3.445	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H]2CCN(Cc3cc(C)ccc3OC)[C@H]2C1	ZINC001222398435	1373837395	/nfs/dbraw/zinc/83/73/95/1373837395.db2.gz	XVJKDUFPWJPPRJ-MJGOQNOKSA-N	0	3	342.483	3.393	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC[C@H](C)N(CCOc2ccccc2C)C1	ZINC001131894649	1375032628	/nfs/dbraw/zinc/03/26/28/1375032628.db2.gz	AXDLRUZSEDIQNG-ROUUACIJSA-N	0	3	330.472	3.309	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CC[C@H](C)N(CCOc2ccc(OC)cc2)C1	ZINC001131895251	1375032933	/nfs/dbraw/zinc/03/29/33/1375032933.db2.gz	HNGAZIAOLQFORX-DLBZAZTESA-N	0	3	346.471	3.009	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)Cc2ccc(C3CCC3)cc2)CC1	ZINC001223958040	1375049906	/nfs/dbraw/zinc/04/99/06/1375049906.db2.gz	HFTLYPBXSSJYDJ-UHFFFAOYSA-N	0	3	338.495	3.348	20	30		EGEDHN
C=CCOCC(=O)N[C@@H]1CC[C@H](C)N(Cc2ccccc2C2CC2)C1	ZINC001131947459	1375062771	/nfs/dbraw/zinc/06/27/71/1375062771.db2.gz	UPAYTKWWBLVVQV-QFBILLFUSA-N	0	3	342.483	3.236	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2cc(OC)no2)CC[C@@H]1C	ZINC001131979775	1375080857	/nfs/dbraw/zinc/08/08/57/1375080857.db2.gz	AXHYOACSHXPAKP-GJZGRUSLSA-N	0	3	335.448	3.012	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CC[C@@H](C)N(Cc2cccc(OC)c2C)C1	ZINC001132003207	1375094174	/nfs/dbraw/zinc/09/41/74/1375094174.db2.gz	REASBICIASXGFJ-APWZRJJASA-N	0	3	342.483	3.276	20	30		EGEDHN
CCc1ccc(CN2C[C@H](NC(=O)C#CC(C)C)CC[C@@H]2C)cc1	ZINC001132022121	1375102661	/nfs/dbraw/zinc/10/26/61/1375102661.db2.gz	VGWSXIQMFXEFMS-FXAWDEMLSA-N	0	3	326.484	3.378	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@@H]1CCCC[C@H]1NCc1cccc(Cl)c1F	ZINC001225395932	1375107577	/nfs/dbraw/zinc/10/75/77/1375107577.db2.gz	VCONESZAAGJUOC-KCPJHIHWSA-N	0	3	337.826	3.156	20	30		EGEDHN
O=C(/C=C\C1CC1)N[C@@H]1CCCC[C@H]1NCC#Cc1ccc(F)cc1	ZINC001225560333	1375125449	/nfs/dbraw/zinc/12/54/49/1375125449.db2.gz	LWUQTMJHLMGKBG-OSMDYODNSA-N	0	3	340.442	3.160	20	30		EGEDHN
C/C=C(/C)C(=O)N[C@@H]1CCCC[C@H]1NCc1cc(C#N)ccc1OC	ZINC001225592122	1375129113	/nfs/dbraw/zinc/12/91/13/1375129113.db2.gz	CMYOVWHGMGMOGE-GHXQHCIVSA-N	0	3	341.455	3.050	20	30		EGEDHN
C#CCN1CCC(CNC(=O)CCCCc2ccc(C)cc2)CC1	ZINC001225639223	1375137853	/nfs/dbraw/zinc/13/78/53/1375137853.db2.gz	PAMVUEGLMRLANA-UHFFFAOYSA-N	0	3	326.484	3.169	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCOc2c(C)cccc2C)CC[C@@H]1C	ZINC001132098197	1375147301	/nfs/dbraw/zinc/14/73/01/1375147301.db2.gz	VKGMMTOAJSYVRH-ZWKOTPCHSA-N	0	3	330.472	3.227	20	30		EGEDHN
C[C@H](N[C@@H]1CCCC[C@H]1NC(=O)C#CC1CC1)c1ccccc1F	ZINC001226133360	1375208767	/nfs/dbraw/zinc/20/87/67/1375208767.db2.gz	AYKRFKOFAPWYMP-GDIGMMSISA-N	0	3	328.431	3.317	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCCOc2ccccc2C)CC[C@H]1C	ZINC001132212446	1375212947	/nfs/dbraw/zinc/21/29/47/1375212947.db2.gz	YOCZFDUIBOEFCS-MSOLQXFVSA-N	0	3	330.472	3.309	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CC[C@H](C)N(Cc2ccccc2N(C)C)C1	ZINC001132217698	1375215047	/nfs/dbraw/zinc/21/50/47/1375215047.db2.gz	FYKASNJWQJJVCW-FUHWJXTLSA-N	0	3	343.515	3.434	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CC[C@H](C)N(CCOCc2ccccc2)C1	ZINC001132228182	1375224642	/nfs/dbraw/zinc/22/46/42/1375224642.db2.gz	NKMCVYGPYZBEBT-PKOBYXMFSA-N	0	3	344.499	3.385	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2nc(Cl)cs2)CC[C@@H]1C	ZINC001132238266	1375234059	/nfs/dbraw/zinc/23/40/59/1375234059.db2.gz	QMPBWOKKMKLNRP-RYUDHWBXSA-N	0	3	327.881	3.345	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H]1CCCC[C@H]1NCc1cncs1	ZINC001226468494	1375263790	/nfs/dbraw/zinc/26/37/90/1375263790.db2.gz	KVLZTONFELCNME-ZIAGYGMSSA-N	0	3	341.908	3.439	20	30		EGEDHN
C[C@H](C#N)C(=O)NC1CCN([C@H]2CCc3ccc(Cl)cc32)CC1	ZINC001226641283	1375298162	/nfs/dbraw/zinc/29/81/62/1375298162.db2.gz	XYEJFCHNGJWPPJ-PXAZEXFGSA-N	0	3	331.847	3.068	20	30		EGEDHN
C#CCCCCC(=O)NC1CCN(CCOc2cccc(C)c2)CC1	ZINC001226961880	1375372090	/nfs/dbraw/zinc/37/20/90/1375372090.db2.gz	PPPSLDWRENFJDV-UHFFFAOYSA-N	0	3	342.483	3.148	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)c2ccccc2Cl)CC[C@H]1C	ZINC001132434379	1375378257	/nfs/dbraw/zinc/37/82/57/1375378257.db2.gz	WJBWYCHRMUJWAL-CABCVRRESA-N	0	3	336.863	3.125	20	30		EGEDHN
C[C@@H](C(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1)C1CCC1	ZINC001227005195	1375380529	/nfs/dbraw/zinc/38/05/29/1375380529.db2.gz	LSQWBQCBFHMHMF-DUXKGJEZSA-N	0	3	338.495	3.491	20	30		EGEDHN
C=CCOCCN1C[C@@H](NC(=O)C(C)(C)c2ccccc2)CC[C@@H]1C	ZINC001132467740	1375408961	/nfs/dbraw/zinc/40/89/61/1375408961.db2.gz	KHIFZZLECNTZRA-HKUYNNGSSA-N	0	3	344.499	3.136	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCOc2ccccc2OC)CC[C@@H]1C	ZINC001132472527	1375413659	/nfs/dbraw/zinc/41/36/59/1375413659.db2.gz	IJQBFBFFIZTUHS-DLBZAZTESA-N	0	3	346.471	3.009	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCc2ccc(Cl)s2)CC[C@@H]1C	ZINC001132482852	1375418997	/nfs/dbraw/zinc/41/89/97/1375418997.db2.gz	ZTUGXPSBVVOATM-STQMWFEESA-N	0	3	326.893	3.489	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)C23CC(C(C)(C)C)(C2)C3)CC[C@@H]1C	ZINC001132525202	1375441401	/nfs/dbraw/zinc/44/14/01/1375441401.db2.gz	OYSOPKKHKOFGJR-ZGDXVETISA-N	0	3	348.531	3.375	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1CC[C@@H](C)N(Cc2ccc(C)c(C)c2)C1	ZINC001132533040	1375444410	/nfs/dbraw/zinc/44/44/10/1375444410.db2.gz	JCTLDTOBCBWGQI-UYAOXDASSA-N	0	3	344.499	3.365	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2CC[C@@H](C)N(CCOC(C)C)C2)CCCCC1	ZINC001132530376	1375444826	/nfs/dbraw/zinc/44/48/26/1375444826.db2.gz	XLVOUFSJTQHJPJ-RTBURBONSA-N	0	3	348.531	3.354	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CC(F)(F)C(F)(F)F)CC[C@@H]1C	ZINC001132541123	1375448500	/nfs/dbraw/zinc/44/85/00/1375448500.db2.gz	ADPBVSXSHBDQCY-QWRGUYRKSA-N	0	3	328.325	3.119	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCc2cccc(F)c2F)CC[C@H]1C	ZINC001132545347	1375452530	/nfs/dbraw/zinc/45/25/30/1375452530.db2.gz	AGHMBXUCTRKIKV-GDBMZVCRSA-N	0	3	336.426	3.443	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)CC2CC2)CC1	ZINC001132551886	1375457783	/nfs/dbraw/zinc/45/77/83/1375457783.db2.gz	NRPBGKDQFRRZFB-HXUWFJFHSA-N	0	3	339.483	3.088	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2(CCc3ccccc3)CC2)CC[C@H]1C	ZINC001132551541	1375457828	/nfs/dbraw/zinc/45/78/28/1375457828.db2.gz	JAABMSDOJVLVFM-UYAOXDASSA-N	0	3	338.495	3.392	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(Cc2ccccn2)C(=O)[C@@H](F)CC)CC1	ZINC001132555177	1375462093	/nfs/dbraw/zinc/46/20/93/1375462093.db2.gz	QYPYZMWJSMYWFQ-MOPGFXCFSA-N	0	3	345.462	3.036	20	30		EGEDHN
C#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)[C@H](C)C(C)C)CC1	ZINC001132557837	1375464343	/nfs/dbraw/zinc/46/43/43/1375464343.db2.gz	DWQRQXWYCCKTSB-QUCCMNQESA-N	0	3	341.499	3.190	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2N(Cc2ccsc2)C(=O)CC)CC1	ZINC001132562767	1375468349	/nfs/dbraw/zinc/46/83/49/1375468349.db2.gz	MWXGFZHONXIIEK-QGZVFWFLSA-N	0	3	330.497	3.365	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2N(Cc2ccsc2)C(=O)CCCF)CC1	ZINC001132561933	1375468546	/nfs/dbraw/zinc/46/85/46/1375468546.db2.gz	CPBPISGYJSFUDK-QGZVFWFLSA-N	0	3	348.487	3.314	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CCCC[C@H]1NCc1cc(OC)ns1	ZINC001228270943	1375538197	/nfs/dbraw/zinc/53/81/97/1375538197.db2.gz	VCWGVUCUBOYKFL-HUUCEWRRSA-N	0	3	337.489	3.025	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](C)[C@@H](CNCc2nc(C)c(C)s2)C1	ZINC001132785769	1375563937	/nfs/dbraw/zinc/56/39/37/1375563937.db2.gz	LDWYBSQURYOKKK-YOEHRIQHSA-N	0	3	347.528	3.138	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CCCC[C@H]2NCc2conc2C)CCC1	ZINC001228406574	1375567015	/nfs/dbraw/zinc/56/70/15/1375567015.db2.gz	MCMFPKOOMSKYQU-IAGOWNOFSA-N	0	3	331.460	3.246	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@H](NC(=O)CCC3CC3)CC2)c1	ZINC001327109572	1388382485	/nfs/dbraw/zinc/38/24/85/1388382485.db2.gz	CWJGHYOZMLGBRT-LJQANCHMSA-N	0	3	325.456	3.219	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC1CCN(CCOCc2ccccc2)CC1	ZINC001228597225	1375610063	/nfs/dbraw/zinc/61/00/63/1375610063.db2.gz	QOBZSYKPHFUOIT-UHFFFAOYSA-N	0	3	344.499	3.386	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NC1CCN(CCc2scnc2C)CC1	ZINC001228749101	1375662157	/nfs/dbraw/zinc/66/21/57/1375662157.db2.gz	POCRAJBJXHRVCV-KGLIPLIRSA-N	0	3	335.517	3.033	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC1CCN(C[C@H](O)c2ccc(F)cc2)CC1	ZINC001229017480	1375740290	/nfs/dbraw/zinc/74/02/90/1375740290.db2.gz	TXKMDEJZSCMFKX-AZUAARDMSA-N	0	3	348.462	3.042	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](C)[C@H](CNCc2ccn(CC)n2)C1	ZINC001133141325	1375802469	/nfs/dbraw/zinc/80/24/69/1375802469.db2.gz	BZWIHJHBUCUAOT-DLBZAZTESA-N	0	3	346.519	3.080	20	30		EGEDHN
C=CCCCC(=O)NCCNCc1ccc(Br)s1	ZINC001133158166	1375814657	/nfs/dbraw/zinc/81/46/57/1375814657.db2.gz	ZNWLISJLHWMMRU-UHFFFAOYSA-N	0	3	331.279	3.073	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H]2CN(CCc3ccccc3F)C[C@H]21	ZINC001188903481	1388405476	/nfs/dbraw/zinc/40/54/76/1388405476.db2.gz	XQWPBISEUPJASN-AZUAARDMSA-N	0	3	342.458	3.095	20	30		EGEDHN
C[C@H](C(=O)NCCNCc1ccc(C#N)s1)c1ccc(Cl)cc1	ZINC001133244828	1375865523	/nfs/dbraw/zinc/86/55/23/1375865523.db2.gz	PPLNAWPHADMTBD-LBPRGKRZSA-N	0	3	347.871	3.283	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)c2ccsc2C(F)F)CC1	ZINC001230148289	1375951974	/nfs/dbraw/zinc/95/19/74/1375951974.db2.gz	LRXPWFVOOFFODB-UHFFFAOYSA-N	0	3	344.427	3.083	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)CC1CCC1	ZINC001133390633	1375974246	/nfs/dbraw/zinc/97/42/46/1375974246.db2.gz	AUSULEOOUUFRRL-UHFFFAOYSA-N	0	3	332.875	3.472	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H](C)C1CCC1	ZINC001133399102	1375982306	/nfs/dbraw/zinc/98/23/06/1375982306.db2.gz	CJNJGFGNLBREJK-HNNXBMFYSA-N	0	3	332.875	3.328	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)C[C@H]1C[C@H]1C	ZINC001133403640	1375988922	/nfs/dbraw/zinc/98/89/22/1375988922.db2.gz	BXJQEGFXGKAZQF-NVXWUHKLSA-N	0	3	332.875	3.328	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@H]1CC[C@@H](C)C1	ZINC001133408124	1375993171	/nfs/dbraw/zinc/99/31/71/1375993171.db2.gz	XNHGSPMCYNMIQW-WBVHZDCISA-N	0	3	332.875	3.328	20	30		EGEDHN
C#CCCCC(=O)N1CCC([C@H]2CCCN2Cc2nccs2)CC1	ZINC001230558210	1376079867	/nfs/dbraw/zinc/07/98/67/1376079867.db2.gz	WWDLTCMOXMIJLO-QGZVFWFLSA-N	0	3	345.512	3.150	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)[C@@H](C)OCC(C)C)Cc1cccnc1	ZINC001230701749	1376129681	/nfs/dbraw/zinc/12/96/81/1376129681.db2.gz	RTSZHQJEICZLTM-GOSISDBHSA-N	0	3	347.503	3.027	20	30		EGEDHN
C#CCCN(CCCNC(=O)CC1CC(C)(C)C1)Cc1cccnc1	ZINC001230824637	1376160863	/nfs/dbraw/zinc/16/08/63/1376160863.db2.gz	JUYYINCWAVPVHP-UHFFFAOYSA-N	0	3	341.499	3.240	20	30		EGEDHN
C#CCCN(CCCNC(=O)[C@H]1CCC[C@H](C)C1)Cc1cccnc1	ZINC001230829955	1376162235	/nfs/dbraw/zinc/16/22/35/1376162235.db2.gz	SJHNHENJMFFVSD-ICSRJNTNSA-N	0	3	341.499	3.240	20	30		EGEDHN
C[C@H](C#N)C(=O)N(C)C[C@@H]1CCN1CCc1ccc2ccccc2c1	ZINC001231292698	1376222659	/nfs/dbraw/zinc/22/26/59/1376222659.db2.gz	FDWQUNFHDBGNDR-UZLBHIALSA-N	0	3	335.451	3.075	20	30		EGEDHN
Cc1ncc(C(=O)N[C@H](C)C[C@@H](C)NCc2ccccc2C#N)s1	ZINC001133871107	1376244161	/nfs/dbraw/zinc/24/41/61/1376244161.db2.gz	HKZFWMKLFPGAOT-CHWSQXEVSA-N	0	3	342.468	3.010	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)CC(C2CCC2)C2CCC2)cc1	ZINC001133946638	1376276262	/nfs/dbraw/zinc/27/62/62/1376276262.db2.gz	AMCDWIJNGHLJLJ-UHFFFAOYSA-N	0	3	339.483	3.371	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cnc(F)cc1C)[C@@H]2CC	ZINC001231981902	1376370456	/nfs/dbraw/zinc/37/04/56/1376370456.db2.gz	QVFZPZINBMRZKH-XLIONFOSSA-N	0	3	345.462	3.451	20	30		EGEDHN
C=CCN1C(=O)CC[C@]12CCCN(Cc1cnc(F)cc1C)CC2	ZINC001231982791	1376372025	/nfs/dbraw/zinc/37/20/25/1376372025.db2.gz	IGKDNSPDDZCLSC-IBGZPJMESA-N	0	3	331.435	3.062	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@@H](C)NC(=O)c1ccsc1C	ZINC001134319426	1376474299	/nfs/dbraw/zinc/47/42/99/1376474299.db2.gz	ZUBNFGHXZRVZJT-GHMZBOCLSA-N	0	3	345.306	3.452	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)C#CC1CC1)NCc1c(F)cccc1Cl	ZINC001134321936	1376475106	/nfs/dbraw/zinc/47/51/06/1376475106.db2.gz	NCZCSLDYAABSPR-CHWSQXEVSA-N	0	3	336.838	3.265	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)C#CC(C)(C)C)NCc1c(F)cccc1F	ZINC001134328666	1376479292	/nfs/dbraw/zinc/47/92/92/1376479292.db2.gz	FPVDKCUHPOXDMP-ZIAGYGMSSA-N	0	3	336.426	3.387	20	30		EGEDHN
O=C1C=C2CN(Cc3ccc(-n4cccn4)cc3Cl)CCC2S1	ZINC001232594016	1376485224	/nfs/dbraw/zinc/48/52/24/1376485224.db2.gz	FMGYCKXDSNIGJJ-MRXNPFEDSA-N	0	3	345.855	3.300	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@@H](C)C[C@@H](C)NCc1nccn1CC	ZINC001134418288	1376523567	/nfs/dbraw/zinc/52/35/67/1376523567.db2.gz	IIOIOWOMKAYCCB-CVEARBPZSA-N	0	3	332.492	3.044	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CC[C@@]2(C[C@@H](OCC3CC3)CO2)C1	ZINC001233080708	1376566351	/nfs/dbraw/zinc/56/63/51/1376566351.db2.gz	AJTBAXXTIKUZJV-WOJBJXKFSA-N	0	3	326.440	3.027	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2nc(C)c(C)s2)CCC1	ZINC001134587696	1376610854	/nfs/dbraw/zinc/61/08/54/1376610854.db2.gz	GDZBRYMHDUNTMU-KGLIPLIRSA-N	0	3	347.528	3.326	20	30		EGEDHN
Cc1ccc(CN2C[C@@H]3C[NH+](Cc4ccc(C#N)cc4[O-])C[C@H]3C2)cc1	ZINC001233384911	1376633811	/nfs/dbraw/zinc/63/38/11/1376633811.db2.gz	MYFOUEXPNDQKAU-NHCUHLMSSA-N	0	3	347.462	3.136	20	30		EGEDHN
Cc1ccccc1[C@@H](C)CC(=O)NCCNCc1cccc(C#N)c1	ZINC001134726528	1376680454	/nfs/dbraw/zinc/68/04/54/1376680454.db2.gz	XZUDHTWPSBXMHI-KRWDZBQOSA-N	0	3	335.451	3.266	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)CCC(C)(F)F)NCc1ccccc1C#N	ZINC001134761706	1376706213	/nfs/dbraw/zinc/70/62/13/1376706213.db2.gz	RZTJLADJOUJCJE-KGLIPLIRSA-N	0	3	337.414	3.367	20	30		EGEDHN
CC(C)C#CC(=O)N(C)C[C@H]1CCN1CCCc1ccc(Cl)cc1	ZINC001234170281	1376782884	/nfs/dbraw/zinc/78/28/84/1376782884.db2.gz	IQFBUONAPYTDLJ-LJQANCHMSA-N	0	3	346.902	3.465	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N(C)C[C@@H]2CCN2CCCCC)cc1	ZINC001234255921	1376793530	/nfs/dbraw/zinc/79/35/30/1376793530.db2.gz	SBCLRTZSSMPVGI-IBGZPJMESA-N	0	3	342.483	3.425	20	30		EGEDHN
C=CCCCCCN1CC[C@@H]1CN(C)C(=O)[C@H]1CCCc2n[nH]cc21	ZINC001234322863	1376809945	/nfs/dbraw/zinc/80/99/45/1376809945.db2.gz	LWVMPLCINKHYKH-SJORKVTESA-N	0	3	344.503	3.109	20	30		EGEDHN
CC(C)(C(=O)NCCNCc1ccc(C#N)cc1)C1CCCCC1	ZINC001135004681	1376839945	/nfs/dbraw/zinc/83/99/45/1376839945.db2.gz	TYNSPPVIMWFQKA-UHFFFAOYSA-N	0	3	327.472	3.371	20	30		EGEDHN
CN(CCN(C)Cc1c(F)cc(C#N)cc1F)Cc1ccccc1	ZINC001235666400	1376882503	/nfs/dbraw/zinc/88/25/03/1376882503.db2.gz	JJYGAAWLHZGFIF-UHFFFAOYSA-N	0	3	329.394	3.400	20	30		EGEDHN
C[C@H](C[C@H](C)NC(=O)C1(CCF)CC1)NCc1ccccc1C#N	ZINC001135081470	1376885113	/nfs/dbraw/zinc/88/51/13/1376885113.db2.gz	MVHCTCTYSAKTQN-CABCVRRESA-N	0	3	331.435	3.071	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H](C)C[C@H](C)NCc1cc2n(n1)CCCC2	ZINC001135181676	1376954319	/nfs/dbraw/zinc/95/43/19/1376954319.db2.gz	SVUOCCQAMYBQMZ-JKSUJKDBSA-N	0	3	346.519	3.195	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc3c(c2)C=CCC3)s1	ZINC001135197119	1376968455	/nfs/dbraw/zinc/96/84/55/1376968455.db2.gz	YJKLKMXZEOBXLP-UHFFFAOYSA-N	0	3	337.448	3.099	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@H](C)C[C@@H](C)NCc1nc2ccccc2o1	ZINC001135229459	1376989210	/nfs/dbraw/zinc/98/92/10/1376989210.db2.gz	ANIBKBQIEMEFFK-ZIAGYGMSSA-N	0	3	329.444	3.413	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H](C)C[C@H](C)NCc1cc(F)ccc1C#N	ZINC001135231344	1376991071	/nfs/dbraw/zinc/99/10/71/1376991071.db2.gz	ZJGQQEPTZBPWLI-KBPBESRZSA-N	0	3	331.435	3.282	20	30		EGEDHN
CCc1cc(CN2CC[C@]3(C[C@H](OCC4CC4)CO3)C2)ccc1C#N	ZINC001238776341	1377001975	/nfs/dbraw/zinc/00/19/75/1377001975.db2.gz	VEPPAXCDBNFBHN-SFTDATJTSA-N	0	3	340.467	3.281	20	30		EGEDHN
C=C(Br)CN[C@H](C)C[C@H](C)NC(=O)c1occc1CC	ZINC001135394527	1377071646	/nfs/dbraw/zinc/07/16/46/1377071646.db2.gz	IFWUOCBWCYPJAN-NEPJUHHUSA-N	0	3	343.265	3.237	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](C)C[C@@H](C)NCc2conc2CC)CC1	ZINC001135416139	1377083350	/nfs/dbraw/zinc/08/33/50/1377083350.db2.gz	QUMVFJRXPPUHBR-HUUCEWRRSA-N	0	3	333.476	3.356	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H](C)C[C@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001135418952	1377084383	/nfs/dbraw/zinc/08/43/83/1377084383.db2.gz	ISVDNVKDJTZAMF-LSDHHAIUSA-N	0	3	343.446	3.427	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H](C)C[C@@H](C)NCc2ccncc2Cl)C1	ZINC001135417978	1377084402	/nfs/dbraw/zinc/08/44/02/1377084402.db2.gz	ASWKYBYBAGMFOM-KGLIPLIRSA-N	0	3	335.879	3.464	20	30		EGEDHN
CC1(C)COC2(CCC(NC(=N)c3ccc(Cl)cn3)CC2)OC1	ZINC001258519262	1377117211	/nfs/dbraw/zinc/11/72/11/1377117211.db2.gz	YFIXZPJGPXPHCQ-UHFFFAOYSA-N	0	3	337.851	3.152	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H](C)C[C@@H](C)NCC(=C)Br	ZINC001135560138	1377144140	/nfs/dbraw/zinc/14/41/40/1377144140.db2.gz	BYLQXDGRLRJVII-OLZOCXBDSA-N	0	3	331.298	3.370	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)c1cc(C)[nH]c1C	ZINC001135561572	1377145370	/nfs/dbraw/zinc/14/53/70/1377145370.db2.gz	SSXASZQVOHQKEI-WDEREUQCSA-N	0	3	342.281	3.027	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@@H](C)NC(=O)CCC1(C)CC1	ZINC001135840518	1377229023	/nfs/dbraw/zinc/22/90/23/1377229023.db2.gz	KEBZAUXTDMDYTR-QWHCGFSZSA-N	0	3	331.298	3.348	20	30		EGEDHN
Cc1sccc1C(=O)NC[C@H](NCc1ccc(C#N)s1)C1CC1	ZINC001266406329	1377304569	/nfs/dbraw/zinc/30/45/69/1377304569.db2.gz	AYQRBYUVMBJXJR-INIZCTEOSA-N	0	3	345.493	3.288	20	30		EGEDHN
C[C@@H](CCNC(=O)c1ccnc(C2CC2)c1)NCc1ccccc1C#N	ZINC001267133706	1377416373	/nfs/dbraw/zinc/41/63/73/1377416373.db2.gz	LSBHDOXUXGRDSE-HNNXBMFYSA-N	0	3	348.450	3.129	20	30		EGEDHN
C=CCN1C(=O)CCC12CCN(Cc1c[nH]c3cccc(F)c13)CC2	ZINC001136981414	1377449369	/nfs/dbraw/zinc/44/93/69/1377449369.db2.gz	NXFOJACYNAZITJ-UHFFFAOYSA-N	0	3	341.430	3.450	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3c[nH]c4ccc(F)cc34)C2)C1=O	ZINC001137336430	1377523411	/nfs/dbraw/zinc/52/34/11/1377523411.db2.gz	ADOGIPKMEGEXKE-HXUWFJFHSA-N	0	3	341.430	3.308	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCCN(Cc3[nH]nc4ccccc43)C2)cc1	ZINC001137352467	1377531133	/nfs/dbraw/zinc/53/11/33/1377531133.db2.gz	YXRREDKVZWHUNF-QGZVFWFLSA-N	0	3	332.407	3.478	20	30		EGEDHN
O=C1CCN(Cc2ccc(C#Cc3ccccc3)cc2)C[C@H]2CCCN12	ZINC001138336072	1377704676	/nfs/dbraw/zinc/70/46/76/1377704676.db2.gz	JRAFYDDVYYUDDO-JOCHJYFZSA-N	0	3	344.458	3.283	20	30		EGEDHN
COc1cc(CN2CCC3SC(=O)C=C3C2)ccc1OC(F)F	ZINC001138554119	1377741796	/nfs/dbraw/zinc/74/17/96/1377741796.db2.gz	ZOJYQHCMMXKSQR-AWEZNQCLSA-N	0	3	341.379	3.071	20	30		EGEDHN
C#CCOc1ccc(CN(CCC(=O)OC)Cc2ccccc2)cc1	ZINC001138559624	1377742119	/nfs/dbraw/zinc/74/21/19/1377742119.db2.gz	YFWSQDXFHVABEM-UHFFFAOYSA-N	0	3	337.419	3.264	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CCC3(CCOC[C@H]3COC)CC2)c1[O-]	ZINC001138627715	1377756550	/nfs/dbraw/zinc/75/65/50/1377756550.db2.gz	NDMKOVUASZZDBJ-LJQANCHMSA-N	0	3	345.483	3.386	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CCC(c3nc(CC)no3)CC2)c1[O-]	ZINC001138628338	1377756830	/nfs/dbraw/zinc/75/68/30/1377756830.db2.gz	SIKMGIYZFUCIQZ-UHFFFAOYSA-N	0	3	327.428	3.446	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@@H](Oc3nccnc3C)C2)c1[O-]	ZINC001138631264	1377757463	/nfs/dbraw/zinc/75/74/63/1377757463.db2.gz	MXIROJYKBOOQSH-GOSISDBHSA-N	0	3	339.439	3.263	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@@H](Oc3nccnc3C)C2)c1[O-]	ZINC001138631264	1377757466	/nfs/dbraw/zinc/75/74/66/1377757466.db2.gz	MXIROJYKBOOQSH-GOSISDBHSA-N	0	3	339.439	3.263	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCCN(Cc3cnc4[nH]ccc4c3)C2)cc1	ZINC001138744045	1377778599	/nfs/dbraw/zinc/77/85/99/1377778599.db2.gz	JAJYJPVIKLJMBY-LJQANCHMSA-N	0	3	332.407	3.478	20	30		EGEDHN
C=CCOc1ccccc1CN1CC[C@H]2[C@H]1CCN2Cc1cccnc1	ZINC001139027877	1377819118	/nfs/dbraw/zinc/81/91/18/1377819118.db2.gz	DVLZFQSTALSGIB-LEWJYISDSA-N	0	3	349.478	3.495	20	30		EGEDHN
C=CCOc1ccccc1CN1CC[C@@]2(C[C@H](OCC3CC3)CO2)C1	ZINC001139032359	1377820420	/nfs/dbraw/zinc/82/04/20/1377820420.db2.gz	LMXYTBXOYRBKJN-PZJWPPBQSA-N	0	3	343.467	3.411	20	30		EGEDHN
COc1ccc(CN2CCC3SC(=O)C=C3C2)c(Cl)c1OC	ZINC001139113146	1377831325	/nfs/dbraw/zinc/83/13/25/1377831325.db2.gz	COOWMLBKICERBF-ZDUSSCGKSA-N	0	3	339.844	3.131	20	30		EGEDHN
COc1cccnc1O[C@@H]1CCN(Cc2c[nH]c3c2cccc3C#N)C1	ZINC001139707454	1377938249	/nfs/dbraw/zinc/93/82/49/1377938249.db2.gz	GCQMFKJHMRXAHH-MRXNPFEDSA-N	0	3	348.406	3.096	20	30		EGEDHN
Cc1ccc(CN2CCC[C@@]3(C[C@H](OCC4CC4)CO3)C2)cc1C#N	ZINC001139723514	1377941632	/nfs/dbraw/zinc/94/16/32/1377941632.db2.gz	AGMZMQTXTYNPQA-LEWJYISDSA-N	0	3	340.467	3.417	20	30		EGEDHN
Cc1ccc(CN2CCC3(C[C@@H](OCC4CC4)CO3)CC2)cc1C#N	ZINC001139725518	1377942094	/nfs/dbraw/zinc/94/20/94/1377942094.db2.gz	SCYKJYRFSTZHPS-HXUWFJFHSA-N	0	3	340.467	3.417	20	30		EGEDHN
C=CCN1C(=O)CC[C@@]12CCC[N@@H+](Cc1cc(F)ccc1[O-])CC2	ZINC001140054222	1377996781	/nfs/dbraw/zinc/99/67/81/1377996781.db2.gz	MLHZUXNVBPMELV-LJQANCHMSA-N	0	3	332.419	3.064	20	30		EGEDHN
C=CCN1C(=O)CC[C@@]12CCC[N@H+](Cc1cc(F)ccc1[O-])CC2	ZINC001140054222	1377996782	/nfs/dbraw/zinc/99/67/82/1377996782.db2.gz	MLHZUXNVBPMELV-LJQANCHMSA-N	0	3	332.419	3.064	20	30		EGEDHN
N#Cc1ccccc1O[C@H]1CCC[N@@H+](Cc2cc(F)ccc2[O-])C1	ZINC001140058926	1377998200	/nfs/dbraw/zinc/99/82/00/1377998200.db2.gz	PDSYROSPGDYYIP-KRWDZBQOSA-N	0	3	326.371	3.446	20	30		EGEDHN
N#Cc1ccccc1O[C@H]1CCC[N@H+](Cc2cc(F)ccc2[O-])C1	ZINC001140058926	1377998202	/nfs/dbraw/zinc/99/82/02/1377998202.db2.gz	PDSYROSPGDYYIP-KRWDZBQOSA-N	0	3	326.371	3.446	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@@H]1CCN(Cc1ccc(O)cc1F)C2	ZINC001140127302	1378013546	/nfs/dbraw/zinc/01/35/46/1378013546.db2.gz	YWPVSZKEWHDWIQ-MOPGFXCFSA-N	0	3	335.419	3.105	20	30		EGEDHN
Cn1cnc2ccc(CN3CCC[C@@H](Oc4ccc(C#N)cc4)C3)cc21	ZINC001140743070	1378128324	/nfs/dbraw/zinc/12/83/24/1378128324.db2.gz	WYOXYMRUUJMGSB-LJQANCHMSA-N	0	3	346.434	3.488	20	30		EGEDHN
CC(C)N1CCC2(CCN(Cc3cc(F)c(C#N)c(F)c3)CC2)C1=O	ZINC001140755335	1378130597	/nfs/dbraw/zinc/13/05/97/1378130597.db2.gz	AOAWGNIEBZDDHJ-UHFFFAOYSA-N	0	3	347.409	3.059	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@]3(C2)C(=O)Nc2ccccc23)c1Cl	ZINC001140813448	1378148827	/nfs/dbraw/zinc/14/88/27/1378148827.db2.gz	IPIUXHPOBSJPQP-IBGZPJMESA-N	0	3	337.810	3.307	20	30		EGEDHN
N#Cc1ccc(O[C@@H]2CCCN(Cc3ccn4ccnc4c3)C2)cc1	ZINC001141050045	1378221671	/nfs/dbraw/zinc/22/16/71/1378221671.db2.gz	YCERQSMTSPCKPV-LJQANCHMSA-N	0	3	332.407	3.249	20	30		EGEDHN
COC(=O)[C@@H](c1ccccc1)[C@@H]1CCCCN1Cc1ccc(C#N)cn1	ZINC001144163574	1378690132	/nfs/dbraw/zinc/69/01/32/1378690132.db2.gz	LDQULJYBMGDXRA-PMACEKPBSA-N	0	3	349.434	3.265	20	30		EGEDHN
C#Cc1ccc(CN2CCC(N3C(=O)Cc4ccccc43)CC2)cc1	ZINC001144573149	1378746399	/nfs/dbraw/zinc/74/63/99/1378746399.db2.gz	CLKXFENKRWXIPK-UHFFFAOYSA-N	0	3	330.431	3.222	20	30		EGEDHN
CC(C)[C@H](C)CC(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001147245420	1378996247	/nfs/dbraw/zinc/99/62/47/1378996247.db2.gz	MNYGZXSBICLHRI-QGZVFWFLSA-N	0	3	339.483	3.275	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2ccc3c(c2)CCC=C3)c1	ZINC001148057079	1379109874	/nfs/dbraw/zinc/10/98/74/1379109874.db2.gz	FQDRCPKISCOZHU-UHFFFAOYSA-N	0	3	331.419	3.037	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001148089436	1379115253	/nfs/dbraw/zinc/11/52/53/1379115253.db2.gz	WCLCKFDURULIAV-IRXDYDNUSA-N	0	3	337.467	3.051	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H](CC(C)C)c3ccccc3)C2)C1	ZINC001148402095	1379165944	/nfs/dbraw/zinc/16/59/44/1379165944.db2.gz	GKXGTOJUUBCBQC-FQEVSTJZSA-N	0	3	338.495	3.374	20	30		EGEDHN
CCCCCCCCCC(=O)NCCNCC(=O)N[C@@H](C)CCC	ZINC001148826681	1379277946	/nfs/dbraw/zinc/27/79/46/1379277946.db2.gz	SFMFOBIACVIQQG-KRWDZBQOSA-N	0	3	341.540	3.138	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc3ccccc3c2)cc1F	ZINC001148870595	1379287596	/nfs/dbraw/zinc/28/75/96/1379287596.db2.gz	HNORAFUNBYETKT-UHFFFAOYSA-N	0	3	347.393	3.370	20	30		EGEDHN
C#CCCCC(=O)NC[C@H]1CN([C@H](C)c2cccc(C)c2)CCCO1	ZINC001149646472	1379418668	/nfs/dbraw/zinc/41/86/68/1379418668.db2.gz	NIFBUCACYOMUHJ-QUCCMNQESA-N	0	3	342.483	3.067	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@@H]1CN(Cc2ccc(C)c(C)c2)CCCO1	ZINC001149796754	1379449143	/nfs/dbraw/zinc/44/91/43/1379449143.db2.gz	NNVHRNUNCMNFHB-HXUWFJFHSA-N	0	3	344.499	3.367	20	30		EGEDHN
C[C@H](CC(=O)NCCNCc1ccc(C#N)c(F)c1)c1ccccc1	ZINC001149980018	1379477800	/nfs/dbraw/zinc/47/78/00/1379477800.db2.gz	CSLLWJVKRSVCGV-OAHLLOKOSA-N	0	3	339.414	3.097	20	30		EGEDHN
C#CCCN1CCCO[C@H](CNC(=O)[C@H](CC)CCCCCC)C1	ZINC001150100416	1379494969	/nfs/dbraw/zinc/49/49/69/1379494969.db2.gz	POMZUVKOXZIQRX-RTBURBONSA-N	0	3	336.520	3.213	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NC[C@H]1CN(Cc2cccc(C)c2)CCCO1	ZINC001150140760	1379501435	/nfs/dbraw/zinc/50/14/35/1379501435.db2.gz	VNANIKSAMGIKFW-QUCCMNQESA-N	0	3	344.499	3.304	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@H]1CN(CC2=CCCCC2)CCCO1	ZINC001150159587	1379504925	/nfs/dbraw/zinc/50/49/25/1379504925.db2.gz	KUVKMTATPZMYFR-HKUYNNGSSA-N	0	3	334.504	3.296	20	30		EGEDHN
Cc1cc(C)c(C(=O)NCCNCc2ccc(C#N)c(F)c2)c(C)c1	ZINC001150164070	1379506767	/nfs/dbraw/zinc/50/67/67/1379506767.db2.gz	NLJCCTHFVKXMJE-UHFFFAOYSA-N	0	3	339.414	3.142	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@H]1CN(Cc2cccc(C)c2)CCCO1	ZINC001150246618	1379521769	/nfs/dbraw/zinc/52/17/69/1379521769.db2.gz	GMRZQQUYCQQYOL-PZJWPPBQSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=CC[C@H](C(=O)NC[C@H]1CN(CC(=C)C)CCCO1)c1ccccc1	ZINC001150745413	1379603899	/nfs/dbraw/zinc/60/38/99/1379603899.db2.gz	PFJGLVJEVXYNOX-PMACEKPBSA-N	0	3	342.483	3.130	20	30		EGEDHN
C#CCCN1CCCO[C@@H](CNC(=O)[C@](C)(CC)CCCCC)C1	ZINC001150796853	1379617334	/nfs/dbraw/zinc/61/73/34/1379617334.db2.gz	XVIAGOSZWKAHLY-AZUAARDMSA-N	0	3	336.520	3.213	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2ccsc2Cl)CC1	ZINC001151352134	1379704051	/nfs/dbraw/zinc/70/40/51/1379704051.db2.gz	QDKGXOWEJRWRAJ-UHFFFAOYSA-N	0	3	342.892	3.188	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2cc(CC)c(CC)o2)CC1	ZINC001151398667	1379711075	/nfs/dbraw/zinc/71/10/75/1379711075.db2.gz	CRVKJAKGECOYOY-UHFFFAOYSA-N	0	3	348.487	3.191	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2ccc(CC)cc2)CC1	ZINC001151406001	1379712403	/nfs/dbraw/zinc/71/24/03/1379712403.db2.gz	TZMZQVHKLQNOCO-UHFFFAOYSA-N	0	3	344.499	3.426	20	30		EGEDHN
C=CC[C@H](C(=O)NCCNCc1cccc(F)c1)c1ccccc1	ZINC001151838081	1379793855	/nfs/dbraw/zinc/79/38/55/1379793855.db2.gz	IADIZQFXTOVUJR-IBGZPJMESA-N	0	3	326.415	3.391	20	30		EGEDHN
CCC[C@H](CC(C)C)C(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001152875543	1379989032	/nfs/dbraw/zinc/98/90/32/1379989032.db2.gz	CEQDCXYYFRRSTJ-MRXNPFEDSA-N	0	3	333.451	3.366	20	30		EGEDHN
C#CCC1(C(=O)NCCNCc2cc(F)ccc2C)CCCCC1	ZINC001153009724	1380007155	/nfs/dbraw/zinc/00/71/55/1380007155.db2.gz	QRDVEDMMIRNGCX-UHFFFAOYSA-N	0	3	330.447	3.314	20	30		EGEDHN
COc1ccc(C#N)cc1CNC[C@H](NC(=O)C(C)(C)C)C(C)(C)C	ZINC001284643326	1380049736	/nfs/dbraw/zinc/04/97/36/1380049736.db2.gz	MFMJHFYNKKONLB-KRWDZBQOSA-N	0	3	345.487	3.233	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1cccc(C(F)F)c1F	ZINC001153408210	1380072002	/nfs/dbraw/zinc/07/20/02/1380072002.db2.gz	VOUBBVPBUIUQAB-GFCCVEGCSA-N	0	3	326.362	3.227	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1ccc(OC)c(C(C)C)c1	ZINC001154182516	1380222806	/nfs/dbraw/zinc/22/28/06/1380222806.db2.gz	WQXYQDKTPRTJIL-MRXNPFEDSA-N	0	3	330.472	3.282	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)CC2CCCCC2)c(F)c1	ZINC001154406989	1380271351	/nfs/dbraw/zinc/27/13/51/1380271351.db2.gz	PJBUZNNNDPQUBN-UHFFFAOYSA-N	0	3	331.435	3.264	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)[C@H](C)C(F)(F)F	ZINC001154648592	1380323481	/nfs/dbraw/zinc/32/34/81/1380323481.db2.gz	HHLQJRGHQAWSFE-OLZOCXBDSA-N	0	3	341.377	3.083	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@@H](C)N(CC)Cc1cccc(C#N)c1	ZINC001154751486	1380345674	/nfs/dbraw/zinc/34/56/74/1380345674.db2.gz	YGUHJIXNYMRQBL-IAGOWNOFSA-N	0	3	327.472	3.487	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)NC[C@@H](C)N(CC)Cc1ccc(C#N)cc1	ZINC001155112466	1380411318	/nfs/dbraw/zinc/41/13/18/1380411318.db2.gz	QIRJPIPWBJYTSZ-ATZDWAIDSA-N	0	3	327.472	3.321	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@H](C)N(CC)C[C@H](O)c2ccccc2F)C1	ZINC001155126200	1380413552	/nfs/dbraw/zinc/41/35/52/1380413552.db2.gz	GZBVBTWISNFGQB-QAPCUYQASA-N	0	3	348.462	3.042	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)[C@H](C)C(C)(F)F	ZINC001155295099	1380434376	/nfs/dbraw/zinc/43/43/76/1380434376.db2.gz	KYCJOANPOJTLLN-KGLIPLIRSA-N	0	3	337.414	3.176	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)C1(CF)CCC1	ZINC001155330594	1380437674	/nfs/dbraw/zinc/43/76/74/1380437674.db2.gz	VPFWJRHMDHMESG-CQSZACIVSA-N	0	3	349.425	3.164	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@@H](C)Cc1ccccc1Cl	ZINC001155564274	1380469206	/nfs/dbraw/zinc/46/92/06/1380469206.db2.gz	SEUAJFKCZAQFIG-JKSUJKDBSA-N	0	3	334.891	3.369	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@@H](CC)Cc1cccc(C)c1	ZINC001155661880	1380480125	/nfs/dbraw/zinc/48/01/25/1380480125.db2.gz	JBRVFGAZLYNJHR-QUCCMNQESA-N	0	3	328.500	3.414	20	30		EGEDHN
C=CCOCCCC(=O)NCCCN[C@@H](C)c1c(F)cccc1F	ZINC001156165791	1380534802	/nfs/dbraw/zinc/53/48/02/1380534802.db2.gz	NCXGXNGOIALINW-AWEZNQCLSA-N	0	3	340.414	3.105	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)[C@H]1CC12CCCC2	ZINC001156201123	1380541560	/nfs/dbraw/zinc/54/15/60/1380541560.db2.gz	VUJTUQBQEYPFKI-VQIMIIECSA-N	0	3	339.483	3.465	20	30		EGEDHN
CCC1(C(=O)N[C@H]2CCN(Cc3ccc(C#N)cc3)CC2(C)C)CC1	ZINC001328101693	1388673316	/nfs/dbraw/zinc/67/33/16/1388673316.db2.gz	HLKFVEBQSFCZBR-SFHVURJKSA-N	0	3	339.483	3.465	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)CCCOC(C)C	ZINC001157280352	1380831009	/nfs/dbraw/zinc/83/10/09/1380831009.db2.gz	HEHTVYJAPGJAAJ-QGZVFWFLSA-N	0	3	345.487	3.090	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@@]1(C)CCc2ccccc2C1	ZINC001157395226	1380867030	/nfs/dbraw/zinc/86/70/30/1380867030.db2.gz	NHMFARZVCQPFMW-UTKZUKDTSA-N	0	3	326.484	3.032	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N1CCCC[C@@H]1CN(C)Cc1ccccc1	ZINC001157648239	1380989616	/nfs/dbraw/zinc/98/96/16/1380989616.db2.gz	GCFONJNRVROLTP-AZUAARDMSA-N	0	3	344.499	3.481	20	30		EGEDHN
C=CCCC(=O)N1CCCC[C@@H]1CN(C)CCOc1cccc(F)c1	ZINC001157662072	1380993241	/nfs/dbraw/zinc/99/32/41/1380993241.db2.gz	WUUGDTFNACKSFD-GOSISDBHSA-N	0	3	348.462	3.484	20	30		EGEDHN
C=CCCC(=O)N1CCCC[C@@H]1CN(C)Cc1ccc2c(c1)COC2	ZINC001157705559	1381009136	/nfs/dbraw/zinc/00/91/36/1381009136.db2.gz	DBALITOJPCINFN-HXUWFJFHSA-N	0	3	342.483	3.496	20	30		EGEDHN
Cc1nc(CNCCCNC(=O)C#CC(C)(C)C)sc1C(C)(C)C	ZINC001157727418	1381016481	/nfs/dbraw/zinc/01/64/81/1381016481.db2.gz	MWDQVVHUNLDFMR-UHFFFAOYSA-N	0	3	349.544	3.394	20	30		EGEDHN
C#CCCCCC(=O)N1CCCC[C@@H]1CN(C)CCOC1CCC1	ZINC001157856792	1381052503	/nfs/dbraw/zinc/05/25/03/1381052503.db2.gz	NDXZFFVSWKALBO-GOSISDBHSA-N	0	3	334.504	3.062	20	30		EGEDHN
C=C(Cl)Cn1c(C(C)C)nnc1N1C[C@@H](C)N(CC)C[C@@H]1C	ZINC001286620521	1381122121	/nfs/dbraw/zinc/12/21/21/1381122121.db2.gz	NOCVJAHTRSWYNI-KGLIPLIRSA-N	0	3	325.888	3.073	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc2c(C)nn(C)c2s1	ZINC001158296274	1381189047	/nfs/dbraw/zinc/18/90/47/1381189047.db2.gz	IOJXFIKWPXITPH-CQSZACIVSA-N	0	3	346.500	3.056	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCCN1C(=O)CCCF	ZINC001158329059	1381202065	/nfs/dbraw/zinc/20/20/65/1381202065.db2.gz	ICUIXTAUPWTHIZ-GOSISDBHSA-N	0	3	331.435	3.121	20	30		EGEDHN
CN1CCN(C(F)(F)c2cnc(Cl)cc2C#N)C2(CCCC2)C1	ZINC001158410529	1381235086	/nfs/dbraw/zinc/23/50/86/1381235086.db2.gz	VDTNMQVSSOAZOT-UHFFFAOYSA-N	0	3	340.805	3.216	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)Cc1noc2ccc(F)cc21	ZINC001158587350	1381308423	/nfs/dbraw/zinc/30/84/23/1381308423.db2.gz	BGZFDAOEHQZLDD-OAHLLOKOSA-N	0	3	345.418	3.008	20	30		EGEDHN
C[C@@]1(C(=O)NCCCNCc2cc(C#N)ccc2F)CC=CCC1	ZINC001158761890	1381387914	/nfs/dbraw/zinc/38/79/14/1381387914.db2.gz	SUPNHRDUKHJGAU-LJQANCHMSA-N	0	3	329.419	3.040	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)COc1ccc2c(c1)CCC2	ZINC001158825608	1381419717	/nfs/dbraw/zinc/41/97/17/1381419717.db2.gz	ZWLYNTGCTBFROW-LJQANCHMSA-N	0	3	342.483	3.053	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H](C)Oc1ccc(C)cc1	ZINC001158830042	1381421649	/nfs/dbraw/zinc/42/16/49/1381421649.db2.gz	OJOMUJKUXOGQMV-ZWKOTPCHSA-N	0	3	330.472	3.261	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc(OC)c(Cl)c1	ZINC001158838209	1381424903	/nfs/dbraw/zinc/42/49/03/1381424903.db2.gz	UORUQTDABJUHGA-OAHLLOKOSA-N	0	3	336.863	3.461	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)COc1ccccc1Cl	ZINC001158852820	1381433104	/nfs/dbraw/zinc/43/31/04/1381433104.db2.gz	MDOSJOLBPYVCGY-OAHLLOKOSA-N	0	3	336.863	3.218	20	30		EGEDHN
Cc1ccoc1C(=O)NCCC1=CCN(Cc2ccc(C#N)cc2)CC1	ZINC001159244354	1381742503	/nfs/dbraw/zinc/74/25/03/1381742503.db2.gz	FEXQXXSDHVWBCA-UHFFFAOYSA-N	0	3	349.434	3.412	20	30		EGEDHN
C=CCOCC(=O)NCCC1=CCN([C@@H](C)c2cccc(F)c2)CC1	ZINC001159619028	1381850166	/nfs/dbraw/zinc/85/01/66/1381850166.db2.gz	SUOGRJARKWGTOB-INIZCTEOSA-N	0	3	346.446	3.228	20	30		EGEDHN
O=C(C#CC1CC1)NCCC1=CCN(CCCCC(F)(F)F)CC1	ZINC001160080987	1381990713	/nfs/dbraw/zinc/99/07/13/1381990713.db2.gz	ABIIHHABBFEJQC-UHFFFAOYSA-N	0	3	342.405	3.271	20	30		EGEDHN
C=C(C)CCC(=O)NCCC1=CCN(Cc2cnccc2C)CC1	ZINC001160269506	1382057272	/nfs/dbraw/zinc/05/72/72/1382057272.db2.gz	XVRLDBGNVUUHPW-UHFFFAOYSA-N	0	3	327.472	3.385	20	30		EGEDHN
Cc1ccc([C@@H](C#N)c2ccc(Nc3ccc(CN)nc3)nn2)cc1	ZINC001160396527	1382093268	/nfs/dbraw/zinc/09/32/68/1382093268.db2.gz	KPTHTHIIEWSNAJ-QGZVFWFLSA-N	0	3	330.395	3.038	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2coc3cc(F)ccc23)CC1	ZINC001160580040	1382147407	/nfs/dbraw/zinc/14/74/07/1382147407.db2.gz	FMLVALNUUUNJCU-UHFFFAOYSA-N	0	3	340.398	3.347	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cn(CC)c3ccccc23)CC1	ZINC001160627628	1382155649	/nfs/dbraw/zinc/15/56/49/1382155649.db2.gz	ADYCEPYUBFPSMW-UHFFFAOYSA-N	0	3	349.478	3.437	20	30		EGEDHN
N#CCN(Cc1ccccc1)C(=O)[C@@H]1CCC[C@@H](c2ccccc2)N1	ZINC001160670017	1382166220	/nfs/dbraw/zinc/16/62/20/1382166220.db2.gz	PWZMBQOXNVTWEA-PMACEKPBSA-N	0	3	333.435	3.422	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H]2COc3ccc(Cl)cc32)CC1	ZINC001160695143	1382173549	/nfs/dbraw/zinc/17/35/49/1382173549.db2.gz	WNMRIVPPUASLPV-QGZVFWFLSA-N	0	3	346.858	3.140	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)Cc2cc(F)c(C)cc2F)CC1	ZINC001160779472	1382193571	/nfs/dbraw/zinc/19/35/71/1382193571.db2.gz	ZVWLFKTYHVGBAI-UHFFFAOYSA-N	0	3	334.410	3.140	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@@H]1CCC=CCCC1	ZINC001160814218	1382204722	/nfs/dbraw/zinc/20/47/22/1382204722.db2.gz	AYHQWNBQTIQJFR-CQSZACIVSA-N	0	3	329.282	3.127	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)[C@@H]2CCC=CCCC2)c1	ZINC001160820531	1382208780	/nfs/dbraw/zinc/20/87/80/1382208780.db2.gz	MFMRDTGCRGSGAK-QGZVFWFLSA-N	0	3	343.446	3.430	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc(Cl)c(Cl)[nH]2)CC1	ZINC001160828527	1382211109	/nfs/dbraw/zinc/21/11/09/1382211109.db2.gz	QRFZRLDZIUFKGI-UHFFFAOYSA-N	0	3	340.254	3.097	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cc3cc(C)ccc3[nH]2)CC1	ZINC001160836085	1382213413	/nfs/dbraw/zinc/21/34/13/1382213413.db2.gz	SVCJDVSMBJECDE-UHFFFAOYSA-N	0	3	335.451	3.252	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc3ncccc3s2)CC1	ZINC001160856236	1382216997	/nfs/dbraw/zinc/21/69/97/1382216997.db2.gz	IDCYNOSFHSQSGV-UHFFFAOYSA-N	0	3	327.453	3.234	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2nc(Cl)sc2Cl)CC1	ZINC001160860494	1382218366	/nfs/dbraw/zinc/21/83/66/1382218366.db2.gz	JEXOCNBEUWPOJT-UHFFFAOYSA-N	0	3	346.283	3.388	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCC1=CCN(Cc2ncccc2C)CC1	ZINC001160882457	1382223729	/nfs/dbraw/zinc/22/37/29/1382223729.db2.gz	MYEJHFHGNLNXKN-UHFFFAOYSA-N	0	3	327.472	3.241	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCC1=CCN(CCOCC2CCC2)CC1	ZINC001160940713	1382243427	/nfs/dbraw/zinc/24/34/27/1382243427.db2.gz	FXBYDBYPQQKWMD-ROUUACIJSA-N	0	3	348.531	3.400	20	30		EGEDHN
C#CC[C@H](N)C(=O)N(C)[C@H](C)[C@H](Oc1ccccc1)c1ccccc1	ZINC001160998957	1382267253	/nfs/dbraw/zinc/26/72/53/1382267253.db2.gz	VQRRPWJVIGTDIL-UXPWSPDFSA-N	0	3	336.435	3.004	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCC1=CCN(CCOCC2CC2)CC1	ZINC001161121239	1382307252	/nfs/dbraw/zinc/30/72/52/1382307252.db2.gz	DILMPVXPHFYAOV-FQEVSTJZSA-N	0	3	334.504	3.154	20	30		EGEDHN
CC1(C(=O)NCCCNCc2ccccc2C#N)CCC(F)(F)CC1	ZINC001161209630	1382343046	/nfs/dbraw/zinc/34/30/46/1382343046.db2.gz	SKFDEGAMXJMHHD-UHFFFAOYSA-N	0	3	349.425	3.370	20	30		EGEDHN
CCCCCCCCCCN(C)C(=O)CNC(=O)[C@@H](N)CC(C)C	ZINC001161221705	1382346806	/nfs/dbraw/zinc/34/68/06/1382346806.db2.gz	WDFLNMWLURQJEH-KRWDZBQOSA-N	0	3	341.540	3.075	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)Cc2ccc(F)c(Cl)c2)CC1	ZINC001161313980	1382367712	/nfs/dbraw/zinc/36/77/12/1382367712.db2.gz	FWSPCWDZWOFTKQ-UHFFFAOYSA-N	0	3	348.849	3.183	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C2(c3cccc(F)c3)CC2)CC1	ZINC001161404687	1382400539	/nfs/dbraw/zinc/40/05/39/1382400539.db2.gz	CPJAXQZLDWKJND-UHFFFAOYSA-N	0	3	340.442	3.019	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cnc(-c3ccoc3)s2)CC1	ZINC001161417498	1382403551	/nfs/dbraw/zinc/40/35/51/1382403551.db2.gz	NXIDTUAOLOZNGZ-UHFFFAOYSA-N	0	3	343.452	3.341	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2scnc2C(C)C)CC1	ZINC001161422567	1382405355	/nfs/dbraw/zinc/40/53/55/1382405355.db2.gz	UWBPJTKLHAFSBD-UHFFFAOYSA-N	0	3	331.485	3.042	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)c1cc(C)n(C(CC)CC)n1	ZINC001161546875	1382436082	/nfs/dbraw/zinc/43/60/82/1382436082.db2.gz	GPECVZRSSFINBB-UHFFFAOYSA-N	0	3	326.872	3.015	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C(C)(C)CC2CCOCC2)CC1	ZINC001161611143	1382457196	/nfs/dbraw/zinc/45/71/96/1382457196.db2.gz	PRWJJHFLMHTHRI-UHFFFAOYSA-N	0	3	334.504	3.154	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccsc2C(F)F)CC1	ZINC001161796338	1382508577	/nfs/dbraw/zinc/50/85/77/1382508577.db2.gz	CKAJOUQKWOMVSY-UHFFFAOYSA-N	0	3	338.423	3.461	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc(Cl)ccc2OC)CC1	ZINC001161817973	1382518353	/nfs/dbraw/zinc/51/83/53/1382518353.db2.gz	LAMPWXZNCGDMJO-UHFFFAOYSA-N	0	3	334.847	3.287	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)c1sc(C)nc1CC(C)C	ZINC001161898547	1382543936	/nfs/dbraw/zinc/54/39/36/1382543936.db2.gz	JKMILVVOEJJQMV-UHFFFAOYSA-N	0	3	329.897	3.112	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cnc(C(C)(C)C)s2)CC1	ZINC001161953021	1382569684	/nfs/dbraw/zinc/56/96/84/1382569684.db2.gz	OPNNYFNEKZQVBU-UHFFFAOYSA-N	0	3	333.501	3.379	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CCc2cccc(F)c2F)CC1	ZINC001162007451	1382598851	/nfs/dbraw/zinc/59/88/51/1382598851.db2.gz	PWGKJGJBEZGZON-UHFFFAOYSA-N	0	3	334.410	3.222	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)[C@]2(C)CCC[C@H]2CC)(COC)CC1	ZINC001162327057	1382730659	/nfs/dbraw/zinc/73/06/59/1382730659.db2.gz	OFKYUIKZDNKQRW-UYAOXDASSA-N	0	3	348.531	3.071	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)c1ccccc1F	ZINC001162673454	1382829356	/nfs/dbraw/zinc/82/93/56/1382829356.db2.gz	NEMKPRCMTIKUMO-UHFFFAOYSA-N	0	3	338.426	3.124	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CCC[C@H]1CCC	ZINC001162850710	1382894476	/nfs/dbraw/zinc/89/44/76/1382894476.db2.gz	PRFLPQPCNICEMP-RTWAWAEBSA-N	0	3	340.511	3.497	20	30		EGEDHN
C#CCCCCCC(=O)N(CCNCCF)CCc1ccccc1	ZINC001162880102	1382903997	/nfs/dbraw/zinc/90/39/97/1382903997.db2.gz	LVCZIYHZKBVJOM-UHFFFAOYSA-N	0	3	332.463	3.201	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)N(CCNCC#CC)CCc1ccccc1	ZINC001162892043	1382907117	/nfs/dbraw/zinc/90/71/17/1382907117.db2.gz	FIAJZQMEDMUTTJ-MOPGFXCFSA-N	0	3	326.484	3.129	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CCCC[C@@H]1C	ZINC001162906548	1382911541	/nfs/dbraw/zinc/91/15/41/1382911541.db2.gz	NHTICAZDQGDQNH-FPOVZHCZSA-N	0	3	340.511	3.497	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@@H]1C[C@H]1CC(C)C	ZINC001162940119	1382921789	/nfs/dbraw/zinc/92/17/89/1382921789.db2.gz	QQGGFVADMLTPBO-NHCUHLMSSA-N	0	3	340.511	3.353	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C1(CC)CCCC1	ZINC001162971143	1382932894	/nfs/dbraw/zinc/93/28/94/1382932894.db2.gz	YSZTYTGRFVSLIB-UHFFFAOYSA-N	0	3	326.484	3.251	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C(C1CC1)C1CC1	ZINC001162977448	1382935076	/nfs/dbraw/zinc/93/50/76/1382935076.db2.gz	RGVHOYQVHAFURH-UHFFFAOYSA-N	0	3	338.495	3.107	20	30		EGEDHN
CC(C)SCC(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001163482789	1383060849	/nfs/dbraw/zinc/06/08/49/1383060849.db2.gz	OJSXNEVXMCBFFR-UHFFFAOYSA-N	0	3	345.512	3.076	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)/C=C(/C)C2CC2)CC1	ZINC001163614973	1383089780	/nfs/dbraw/zinc/08/97/80/1383089780.db2.gz	NLCKXJWNWRFBEB-XFXZXTDPSA-N	0	3	341.293	3.127	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCCNCc1cc(-c2ccc(C)cc2)no1	ZINC001163963841	1383140372	/nfs/dbraw/zinc/14/03/72/1383140372.db2.gz	MILCSPUKTPXLLA-UHFFFAOYSA-N	0	3	341.455	3.458	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)NCCC1(CNCc2cc(C#N)ccc2F)CC1	ZINC001164124563	1383158738	/nfs/dbraw/zinc/15/87/38/1383158738.db2.gz	BITFWKQHXCVQIF-MRXNPFEDSA-N	0	3	343.446	3.120	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCCNCc1c(Cl)cccc1OC	ZINC001164221559	1383167511	/nfs/dbraw/zinc/16/75/11/1383167511.db2.gz	CDKAACATCFGJRP-ZIAGYGMSSA-N	0	3	338.879	3.403	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCCNCc1c(Cl)cccc1OC	ZINC001164221556	1383167642	/nfs/dbraw/zinc/16/76/42/1383167642.db2.gz	CDKAACATCFGJRP-KBPBESRZSA-N	0	3	338.879	3.403	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCCCNCc1nsc2ccccc12	ZINC001164324481	1383177842	/nfs/dbraw/zinc/17/78/42/1383177842.db2.gz	VHJAMNGSPRRDBR-AWEZNQCLSA-N	0	3	331.485	3.495	20	30		EGEDHN
C[C@@H]1CCN(Cc2ccccc2)C[C@@H]1N(C)c1ncc(C#N)cc1F	ZINC001165184866	1383243723	/nfs/dbraw/zinc/24/37/23/1383243723.db2.gz	ZNKFXMYGGCKMGD-BEFAXECRSA-N	0	3	338.430	3.439	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C[C@H](OCC)C(C)C)CC1	ZINC001165472704	1383300471	/nfs/dbraw/zinc/30/04/71/1383300471.db2.gz	RIFZGRJEBLOZGH-HNNXBMFYSA-N	0	3	330.900	3.066	20	30		EGEDHN
Cc1ccc(CCCC(=O)NCCCNCc2ccccc2C#N)cc1	ZINC001165731448	1383334073	/nfs/dbraw/zinc/33/40/73/1383334073.db2.gz	BWROPIGUHHXNJT-UHFFFAOYSA-N	0	3	349.478	3.486	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@@H]2C[C@H]2c2ccsc2)CC1	ZINC001165742408	1383337193	/nfs/dbraw/zinc/33/71/93/1383337193.db2.gz	VCWGBXGCUBYNDW-LSDHHAIUSA-N	0	3	338.904	3.480	20	30		EGEDHN
Cc1ccc(C)c(CC(=O)NCCCNCc2ccccc2C#N)c1	ZINC001165800796	1383346436	/nfs/dbraw/zinc/34/64/36/1383346436.db2.gz	HQXITMYXAHPPTB-UHFFFAOYSA-N	0	3	335.451	3.014	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cc3c(cn2)CCCC3)CC1	ZINC001166088582	1383388997	/nfs/dbraw/zinc/38/89/97/1383388997.db2.gz	KDZXDAGPHYELMH-UHFFFAOYSA-N	0	3	347.890	3.203	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1cc2occc2s1	ZINC001166543686	1383435936	/nfs/dbraw/zinc/43/59/36/1383435936.db2.gz	HNDZUMAICPNNRS-UHFFFAOYSA-N	0	3	343.246	3.112	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCCC1(CNCc2c(C)noc2C)CC1	ZINC001166747290	1383470588	/nfs/dbraw/zinc/47/05/88/1383470588.db2.gz	MGJZDYLNUMTUDU-AWEZNQCLSA-N	0	3	333.476	3.270	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cc(F)c(F)cc2F)CC1	ZINC001166890203	1383494728	/nfs/dbraw/zinc/49/47/28/1383494728.db2.gz	FGWWYZISSBLSPM-UHFFFAOYSA-N	0	3	346.780	3.346	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc(C(C)C)cn2)CC1	ZINC001167224907	1383570109	/nfs/dbraw/zinc/57/01/09/1383570109.db2.gz	MYOAHJQDUNQJMF-UHFFFAOYSA-N	0	3	335.879	3.447	20	30		EGEDHN
Cc1ccc(F)c(C(=O)NCCCNCc2cc(C#N)ccc2F)c1	ZINC001167320364	1383596954	/nfs/dbraw/zinc/59/69/54/1383596954.db2.gz	YEUBEEGCNIVLSN-UHFFFAOYSA-N	0	3	343.377	3.055	20	30		EGEDHN
Cc1cc2c(cc1C#N)[nH]nc2NC(=O)[C@H](C(C)C)N1CCCCC1	ZINC001300270141	1383656655	/nfs/dbraw/zinc/65/66/55/1383656655.db2.gz	HGLFAEPTGNLYPJ-KRWDZBQOSA-N	0	3	339.443	3.192	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)[C@@H]2C[C@H]2C(C)C)CC1	ZINC001167579904	1383677267	/nfs/dbraw/zinc/67/72/67/1383677267.db2.gz	WRAFDICOWKBQPF-UONOGXRCSA-N	0	3	343.309	3.063	20	30		EGEDHN
N#Cc1ccccc1CNc1cccc2cc([C@H]3CNCCO3)cn21	ZINC001167633113	1383694283	/nfs/dbraw/zinc/69/42/83/1383694283.db2.gz	GNJBPYGPQVMPBV-LJQANCHMSA-N	0	3	332.407	3.084	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cccc3[nH]c(C)nc32)CC1	ZINC001167647348	1383697588	/nfs/dbraw/zinc/69/75/88/1383697588.db2.gz	JNSCCZCFULXTCY-UHFFFAOYSA-N	0	3	346.862	3.114	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)Cn2ccc3ccccc32)CC1	ZINC001168211113	1383844113	/nfs/dbraw/zinc/84/41/13/1383844113.db2.gz	VHLOJCZCWQKWDF-UHFFFAOYSA-N	0	3	345.874	3.270	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)C[C@@H](C)C2CC2)CC1	ZINC001168355369	1383881679	/nfs/dbraw/zinc/88/16/79/1383881679.db2.gz	YFCNRBSELLYQPK-GFCCVEGCSA-N	0	3	343.309	3.207	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C2(CCOC)CCCC2)CC1	ZINC001168397442	1383896129	/nfs/dbraw/zinc/89/61/29/1383896129.db2.gz	DZZPZPSVPZSUDZ-UHFFFAOYSA-N	0	3	342.911	3.212	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)[C@@H](C)OCCC(C)C)CC1	ZINC001168435370	1383906300	/nfs/dbraw/zinc/90/63/00/1383906300.db2.gz	VDGYNTXLQLIAQA-OAHLLOKOSA-N	0	3	330.900	3.066	20	30		EGEDHN
Cc1cc(NC[C@H](c2cccc(C(F)(F)F)c2)N(C)C)c(C#N)cn1	ZINC001307102095	1383940465	/nfs/dbraw/zinc/94/04/65/1383940465.db2.gz	ABOFFKAKTPYFEU-QGZVFWFLSA-N	0	3	348.372	3.417	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cc3n(c2)CCCC3)CC1	ZINC001168599388	1383945184	/nfs/dbraw/zinc/94/51/84/1383945184.db2.gz	KZVWWYAVNKNBHK-UHFFFAOYSA-N	0	3	335.879	3.067	20	30		EGEDHN
N#Cc1cccc([C@H](O)CN2CC=C(c3c[nH]c4ncccc34)CC2)c1	ZINC001307570297	1384004713	/nfs/dbraw/zinc/00/47/13/1384004713.db2.gz	GICCQFYIOKTGIS-HXUWFJFHSA-N	0	3	344.418	3.257	20	30		EGEDHN
N#Cc1ccc(N2CC[C@H](N3CCCc4ccccc4CC3)C2=O)cc1	ZINC001307775197	1384029594	/nfs/dbraw/zinc/02/95/94/1384029594.db2.gz	ZJOPHPGEIMUJRH-NRFANRHFSA-N	0	3	345.446	3.154	20	30		EGEDHN
Cc1ccc(-n2ccc([C@H](C)N)n2)cc1NC(=O)c1cccc(C#N)c1	ZINC001169232188	1384125325	/nfs/dbraw/zinc/12/53/25/1384125325.db2.gz	AMJZYCSZTIUIIP-AWEZNQCLSA-N	0	3	345.406	3.324	20	30		EGEDHN
C[C@H]1CCN(Cc2ccccc2)C[C@H]1NC(=O)c1ccc(CC#N)cc1	ZINC001169527866	1384156569	/nfs/dbraw/zinc/15/65/69/1384156569.db2.gz	QZZCZSDHCJPUER-LAUBAEHRSA-N	0	3	347.462	3.393	20	30		EGEDHN
Cc1c(C#N)c(N2CCCc3ccc(CN)nc32)nc2ccccc12	ZINC001169590864	1384162689	/nfs/dbraw/zinc/16/26/89/1384162689.db2.gz	QQGPVEVOLBMIMR-UHFFFAOYSA-N	0	3	329.407	3.353	20	30		EGEDHN
N#CC1(c2ccccc2)CCC(N2CCN(c3cnccn3)CC2)CC1	ZINC001170379456	1384303677	/nfs/dbraw/zinc/30/36/77/1384303677.db2.gz	YUSCTIMPNFJKOL-UHFFFAOYSA-N	0	3	347.466	3.003	20	30		EGEDHN
C#CCCCC(=O)N[C@H](C)CCCCNCc1csc(CC)n1	ZINC001170452611	1384322898	/nfs/dbraw/zinc/32/28/98/1384322898.db2.gz	ACXQQSJBCYJIAC-OAHLLOKOSA-N	0	3	335.517	3.274	20	30		EGEDHN
Cc1nc(CNCCCC[C@@H](C)NC(=O)C#CC(C)(C)C)cs1	ZINC001170693514	1384367421	/nfs/dbraw/zinc/36/74/21/1384367421.db2.gz	PZLVJJSSMJXNMS-CQSZACIVSA-N	0	3	335.517	3.266	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1ccc(C2CC2)s1	ZINC001171096843	1384445278	/nfs/dbraw/zinc/44/52/78/1384445278.db2.gz	XYGBJZSVBUWINF-UHFFFAOYSA-N	0	3	343.290	3.244	20	30		EGEDHN
C#CCC1(C(=O)N[C@H](C)CCCCNCc2nccs2)CCC1	ZINC001171187714	1384463790	/nfs/dbraw/zinc/46/37/90/1384463790.db2.gz	XOHNSPDFZQTGKT-OAHLLOKOSA-N	0	3	333.501	3.101	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@H](C)c1ccc(C)cc1	ZINC001171531801	1384553868	/nfs/dbraw/zinc/55/38/68/1384553868.db2.gz	NURMXSUAXPOLMG-CQSZACIVSA-N	0	3	339.277	3.103	20	30		EGEDHN
CC[C@H](CC(=O)NCCCNCc1cc(C#N)ccc1F)C(C)C	ZINC001171561448	1384562573	/nfs/dbraw/zinc/56/25/73/1384562573.db2.gz	OEWOLCUBHYJENY-MRXNPFEDSA-N	0	3	333.451	3.366	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)C1(CCF)CC1	ZINC001171902179	1384675287	/nfs/dbraw/zinc/67/52/87/1384675287.db2.gz	KWXNZQQVCJEWSX-INIZCTEOSA-N	0	3	345.462	3.463	20	30		EGEDHN
CCC(C)(C)C(=O)N(C)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001316936215	1384707924	/nfs/dbraw/zinc/70/79/24/1384707924.db2.gz	SPEPOVAIFNMPCI-UHFFFAOYSA-N	0	3	327.472	3.417	20	30		EGEDHN
COc1cccc(N2CCN([C@H](C)Cc3ccc(C#N)cc3)CC2)c1	ZINC001172308256	1384765083	/nfs/dbraw/zinc/76/50/83/1384765083.db2.gz	JJVLVAKQSGLZJT-QGZVFWFLSA-N	0	3	335.451	3.320	20	30		EGEDHN
C[C@H](CCCC#N)N1CCO[C@@H]2C[C@@H](COc3ccccn3)C[C@H]21	ZINC001172500439	1384806652	/nfs/dbraw/zinc/80/66/52/1384806652.db2.gz	ZKZGSWAKVFLBHR-XMTFNYHQSA-N	0	3	329.444	3.022	20	30		EGEDHN
N#C[C@H]1CCN([C@@H]2CC[C@H]3CN(C(=O)c4ccccc4)CC[C@H]3C2)C1	ZINC001172531512	1384809530	/nfs/dbraw/zinc/80/95/30/1384809530.db2.gz	MQJHTIVDZGDQSB-BTHPGYMESA-N	0	3	337.467	3.163	20	30		EGEDHN
C[C@@H]([NH2+][C@H]1CCN(C(=O)OC(C)(C)C)[C@H](C#N)C1)c1ccccc1[O-]	ZINC001172976744	1384894634	/nfs/dbraw/zinc/89/46/34/1384894634.db2.gz	TWRMYAMGFQLNCE-ILXRZTDVSA-N	0	3	345.443	3.334	20	30		EGEDHN
N#CC1(CNC2CCN(C(=O)c3ccc(F)cc3)CC2)CCCC1	ZINC001172991522	1384896366	/nfs/dbraw/zinc/89/63/66/1384896366.db2.gz	VQCKYPBBWNUPAD-UHFFFAOYSA-N	0	3	329.419	3.104	20	30		EGEDHN
C=C(Br)CN[C@@H](C)CCNC(=O)c1cccc(C)c1	ZINC001317391199	1385110788	/nfs/dbraw/zinc/11/07/88/1385110788.db2.gz	PFVUPGRGQOEEAE-ZDUSSCGKSA-N	0	3	325.250	3.002	20	30		EGEDHN
Cc1sccc1C(=O)NCC[C@@H](C)NCc1ccccc1C#N	ZINC001317393566	1385112078	/nfs/dbraw/zinc/11/20/78/1385112078.db2.gz	GEDIXRJNUPUAGL-CYBMUJFWSA-N	0	3	327.453	3.226	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H](C)CCCCNCc1cnc(C)o1	ZINC001174693995	1385135569	/nfs/dbraw/zinc/13/55/69/1385135569.db2.gz	GNXDZLZVDZMREQ-MRXNPFEDSA-N	0	3	333.476	3.331	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)C1CCC(C(F)F)CC1	ZINC001174951397	1385173961	/nfs/dbraw/zinc/17/39/61/1385173961.db2.gz	WVTTYRIUWJWNCB-UHFFFAOYSA-N	0	3	349.425	3.226	20	30		EGEDHN
Cc1cccc(C(=O)NCCCNCc2ccc(C#N)cc2F)c1C	ZINC001175071659	1385189630	/nfs/dbraw/zinc/18/96/30/1385189630.db2.gz	SRYPHDWEAUXZJX-UHFFFAOYSA-N	0	3	339.414	3.224	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H](C)CCCCNC/C(Cl)=C/Cl	ZINC001175365325	1385267145	/nfs/dbraw/zinc/26/71/45/1385267145.db2.gz	JHWIRCDJKBCARP-ZPPSKKKPSA-N	0	3	349.302	3.161	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)[C@H]1CC12CC2	ZINC001175453778	1385296761	/nfs/dbraw/zinc/29/67/61/1385296761.db2.gz	VXAJIMANYPBPFG-MAUKXSAKSA-N	0	3	325.456	3.123	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H](C)CCCCNCc1cc(OC)no1	ZINC001175470036	1385302009	/nfs/dbraw/zinc/30/20/09/1385302009.db2.gz	ZBHCUFYHJIZIME-CQSZACIVSA-N	0	3	337.464	3.050	20	30		EGEDHN
CC(C)CCC(=O)NCC[C@@H]1CCN(Cc2ccc(F)c(C#N)c2)C1	ZINC001317774938	1385468488	/nfs/dbraw/zinc/46/84/88/1385468488.db2.gz	MLPGWKGPGOWXIU-MRXNPFEDSA-N	0	3	345.462	3.462	20	30		EGEDHN
Cc1occc1C(=O)NCC[C@H]1CCN(Cc2ccc(C#N)s2)C1	ZINC001317775797	1385469588	/nfs/dbraw/zinc/46/95/88/1385469588.db2.gz	UYPMKDJKOIFCBZ-AWEZNQCLSA-N	0	3	343.452	3.163	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)CCOc2ccccc2CC)C1	ZINC001317987255	1385600391	/nfs/dbraw/zinc/60/03/91/1385600391.db2.gz	GNJYYUUYKSCXCK-SFHVURJKSA-N	0	3	330.472	3.175	20	30		EGEDHN
CC1=CC[C@@](C)(C(=O)NCCCNCc2cc(C#N)ccc2F)CC1	ZINC001176745124	1385679825	/nfs/dbraw/zinc/67/98/25/1385679825.db2.gz	OBPPBXGXRVALIX-HXUWFJFHSA-N	0	3	343.446	3.430	20	30		EGEDHN
C=C[C@@H](C(=O)NCCCNCc1c(C)onc1CC)c1ccccc1	ZINC001176778079	1385692457	/nfs/dbraw/zinc/69/24/57/1385692457.db2.gz	JGXUPTSQXXXWGW-QGZVFWFLSA-N	0	3	341.455	3.111	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2nccc3occc32)CCCC1	ZINC001318647318	1385814748	/nfs/dbraw/zinc/81/47/48/1385814748.db2.gz	VMIDWNSUXRWUDM-UHFFFAOYSA-N	0	3	333.819	3.213	20	30		EGEDHN
C#CCC1(C(=O)NCCCNCc2ccn(C(C)C)n2)CCCCC1	ZINC001177224068	1385874326	/nfs/dbraw/zinc/87/43/26/1385874326.db2.gz	POVKKVMEGCZXKU-UHFFFAOYSA-N	0	3	344.503	3.034	20	30		EGEDHN
N#CC(Cc1cccs1)C(=O)Nc1nc2c(s1)C(=O)CCC2	ZINC001177904104	1386079383	/nfs/dbraw/zinc/07/93/83/1386079383.db2.gz	MVSQCGSYMZQGMV-VIFPVBQESA-N	0	3	331.422	3.045	20	30		EGEDHN
Cc1cc(N)cc2sc(=N)n(C(=O)C(C#N)Cc3cccs3)c21	ZINC001177912163	1386080921	/nfs/dbraw/zinc/08/09/21/1386080921.db2.gz	LVOSIWYZBURONS-SNVBAGLBSA-N	0	3	342.449	3.157	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)Cc2ccccc2OC)CCCC1	ZINC001319386638	1386096965	/nfs/dbraw/zinc/09/69/65/1386096965.db2.gz	NLCYKJBGAGHYTP-UHFFFAOYSA-N	0	3	336.863	3.009	20	30		EGEDHN
C[C@H]1[C@@H](NCc2ccc(C#N)s2)CCN1C(=O)CCC(F)(F)F	ZINC001178418131	1386211867	/nfs/dbraw/zinc/21/18/67/1386211867.db2.gz	LLBWLKPSXVLWGG-GWCFXTLKSA-N	0	3	345.390	3.041	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)C1C(C)(C)C1(C)C	ZINC001178422675	1386212340	/nfs/dbraw/zinc/21/23/40/1386212340.db2.gz	XOJFJNILSAKCEC-WMZOPIPTSA-N	0	3	338.495	3.299	20	30		EGEDHN
C/C=C(/C)C(=O)N1CC[C@H](NCC#Cc2ccc(Cl)cc2)[C@@H]1C	ZINC001178437696	1386217725	/nfs/dbraw/zinc/21/77/25/1386217725.db2.gz	NEDWMVUJBOBKMS-PIUYJEMPSA-N	0	3	330.859	3.237	20	30		EGEDHN
CC(C)=C(F)C(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@@H]1C	ZINC001178459208	1386224421	/nfs/dbraw/zinc/22/44/21/1386224421.db2.gz	JYLLKSSTOSRTIJ-YOEHRIQHSA-N	0	3	332.394	3.020	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)Cc2ccc3c(c2)CCC3)CCCC1	ZINC001698635740	1406281212	/nfs/dbraw/zinc/28/12/12/1406281212.db2.gz	CYSOITJYQWJUKR-UHFFFAOYSA-N	0	3	346.902	3.489	20	30		EGEDHN
C=CCC[C@@H](C)[NH2+]CCCCCCNC(=O)c1cccc2n[n-]nc21	ZINC001178564348	1386249427	/nfs/dbraw/zinc/24/94/27/1386249427.db2.gz	IXGPMXZUTDIRMT-OAHLLOKOSA-N	0	3	343.475	3.192	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCCCCCN[C@@H](C)c1nnc(CC)[nH]1	ZINC001178580319	1386254747	/nfs/dbraw/zinc/25/47/47/1386254747.db2.gz	WPWACMLFHNMZQW-HNNXBMFYSA-N	0	3	349.523	3.297	20	30		EGEDHN
CCc1occc1C(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C	ZINC001178591122	1386256931	/nfs/dbraw/zinc/25/69/31/1386256931.db2.gz	FUFQUVTYISXPEN-LPHOPBHVSA-N	0	3	336.435	3.086	20	30		EGEDHN
C[C@H]1[C@@H](NCc2ccc(F)c(F)c2)CCN1C(=O)C#CC(C)(C)C	ZINC001178672041	1386273887	/nfs/dbraw/zinc/27/38/87/1386273887.db2.gz	XHJOEXJVJRGXMH-GUYCJALGSA-N	0	3	334.410	3.093	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C	ZINC001178773794	1386299934	/nfs/dbraw/zinc/29/99/34/1386299934.db2.gz	SOBKIROLVWTYDQ-RXVVDRJESA-N	0	3	336.479	3.386	20	30		EGEDHN
CCc1ccc(C(=O)N2CC[C@H](NCC#Cc3ccccc3)[C@@H]2C)o1	ZINC001179002884	1386372777	/nfs/dbraw/zinc/37/27/77/1386372777.db2.gz	SARQORQUNMOZGL-LPHOPBHVSA-N	0	3	336.435	3.086	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCCCCCNCc1cc(C)n(C)n1	ZINC001179212578	1386425331	/nfs/dbraw/zinc/42/53/31/1386425331.db2.gz	PWXJDBLFCLOIHW-UHFFFAOYSA-N	0	3	334.508	3.097	20	30		EGEDHN
C#CCCCCCC(=O)NCCCCCCNCc1cc(C)n(C)n1	ZINC001179235464	1386429223	/nfs/dbraw/zinc/42/92/23/1386429223.db2.gz	RGDWHHLUFAHNTL-UHFFFAOYSA-N	0	3	346.519	3.078	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@H](NCc2c(C)nsc2C)[C@@H]1C	ZINC001179384496	1386470087	/nfs/dbraw/zinc/47/00/87/1386470087.db2.gz	OGWIPTLLKVGSJJ-QRTARXTBSA-N	0	3	335.517	3.441	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCCCCCCN[C@H](C)c1nnc(C)[nH]1	ZINC001179481503	1386494350	/nfs/dbraw/zinc/49/43/50/1386494350.db2.gz	GOXJOJXKWNAXBY-RDTXWAMCSA-N	0	3	335.496	3.043	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)COc1ccc(C)cc1)C1CC1	ZINC001698653438	1406303863	/nfs/dbraw/zinc/30/38/63/1406303863.db2.gz	PEACJUXSWWJPHX-SFHVURJKSA-N	0	3	336.863	3.001	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1cc2c(C)cccn2c1)C1CC1	ZINC001698654813	1406304857	/nfs/dbraw/zinc/30/48/57/1406304857.db2.gz	XQBHHLSMWKUEMW-IBGZPJMESA-N	0	3	345.874	3.488	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NCCCCCCNC/C(Cl)=C/Cl	ZINC001180433173	1386795087	/nfs/dbraw/zinc/79/50/87/1386795087.db2.gz	CYDZQQIOCXKURP-UROBUVALSA-N	0	3	337.291	3.163	20	30		EGEDHN
CC(C)[C@@H](C)CC(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001181526725	1387009956	/nfs/dbraw/zinc/00/99/56/1387009956.db2.gz	GSSCSMZLSURISM-WMLDXEAASA-N	0	3	331.435	3.070	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](N[C@H](CC)c2ccc(F)cc2F)C1	ZINC001182220649	1387123743	/nfs/dbraw/zinc/12/37/43/1387123743.db2.gz	OIDXMERHNMJDAN-CRAIPNDOSA-N	0	3	334.410	3.410	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H](C)[C@](C)(CNCc2cnc(C)o2)C1	ZINC001182525163	1387181991	/nfs/dbraw/zinc/18/19/91/1387181991.db2.gz	XKDAIBVUZYUTLK-MDASCCDHSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](NCc2ccc(Cl)cc2OC)C1	ZINC001182940133	1387249393	/nfs/dbraw/zinc/24/93/93/1387249393.db2.gz	HHGMSSBTTLQKSC-MRXNPFEDSA-N	0	3	336.863	3.395	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1ccc2c(c1)CCO2	ZINC001329334557	1389066052	/nfs/dbraw/zinc/06/60/52/1389066052.db2.gz	BDZTUIYANPPVOP-UHFFFAOYSA-N	0	3	336.863	3.062	20	30		EGEDHN
Cc1ccc([N+](=O)[O-])c(C)c1CNCc1cccc(OCC#N)c1	ZINC001329791354	1389225853	/nfs/dbraw/zinc/22/58/53/1389225853.db2.gz	YLFAYEBDNGLHMB-UHFFFAOYSA-N	0	3	325.368	3.404	20	30		EGEDHN
CC(C)(C)n1c2ccccc2nc1NC(=O)[C@H](N)CCCCC#N	ZINC001329933533	1389262465	/nfs/dbraw/zinc/26/24/65/1389262465.db2.gz	LPLZUIBISAVLNG-CYBMUJFWSA-N	0	3	327.432	3.141	20	30		EGEDHN
CCN1CCN(c2ccc(NC(=O)c3cccc(C#N)c3C)cc2)CC1	ZINC001339966334	1390200758	/nfs/dbraw/zinc/20/07/58/1390200758.db2.gz	JUGUOPIENSKSSU-UHFFFAOYSA-N	0	3	348.450	3.261	20	30		EGEDHN
C=CCn1c([C@H]2CCCN(C)C2)nnc1N1CCC[C@@H]2CCC[C@@H]21	ZINC001340207166	1390250265	/nfs/dbraw/zinc/25/02/65/1390250265.db2.gz	LVFFSYYSECIRLE-ULQDDVLXSA-N	0	3	329.492	3.042	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1cc(Cl)ccc1O[C@H](C)COC	ZINC001340383188	1390280240	/nfs/dbraw/zinc/28/02/40/1390280240.db2.gz	OBYDOTPLEOGFPR-OCCSQVGLSA-N	0	3	340.851	3.376	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc2oc(C(F)(F)F)nc2c1	ZINC001340620777	1390329880	/nfs/dbraw/zinc/32/98/80/1390329880.db2.gz	KSLDRMZPZSIAOX-JTQLQIEISA-N	0	3	327.306	3.469	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N1CCC[C@@H](c2nc3c(s2)CCCC3)C1	ZINC001341029208	1390428277	/nfs/dbraw/zinc/42/82/77/1390428277.db2.gz	DZXAKQQSPUONFW-HUUCEWRRSA-N	0	3	347.528	3.412	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N1CCC[C@H](c2nc3c(s2)CCCC3)C1	ZINC001341029207	1390428383	/nfs/dbraw/zinc/42/83/83/1390428383.db2.gz	DZXAKQQSPUONFW-GJZGRUSLSA-N	0	3	347.528	3.412	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1nnc(-c2c(F)cccc2F)s1	ZINC001341506757	1390495889	/nfs/dbraw/zinc/49/58/89/1390495889.db2.gz	ANBDBISEZFZWQA-LLVKDONJSA-N	0	3	338.383	3.105	20	30		EGEDHN
Cn1ccnc1C(C#N)C(=O)[C@H]1C2CCC(CC2)[C@@H]1C(F)(F)F	ZINC001342163327	1390580008	/nfs/dbraw/zinc/58/00/08/1390580008.db2.gz	CCYZONWEOJCZQK-JCXRDGCHSA-N	0	3	325.334	3.211	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CCCN(C)C2)nnc1N(C)c1ccccc1	ZINC001342247122	1390590746	/nfs/dbraw/zinc/59/07/46/1390590746.db2.gz	HXSZQCKYZKFZQN-INIZCTEOSA-N	0	3	325.460	3.431	20	30		EGEDHN
Cn1ccnc1C(C#N)C(=O)CCCc1ncc(-c2ccccc2)o1	ZINC001342924148	1390673189	/nfs/dbraw/zinc/67/31/89/1390673189.db2.gz	KCRYRSOAADLPBF-HNNXBMFYSA-N	0	3	334.379	3.274	20	30		EGEDHN
CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)[C@@H](N)CCCC#N	ZINC001343446300	1390714651	/nfs/dbraw/zinc/71/46/51/1390714651.db2.gz	GJUHJMQFVTWHKK-AWEZNQCLSA-N	0	3	327.350	3.075	20	30		EGEDHN
CCc1c(C(=O)C(C#N)c2nccn2CC)cnn1C1CCCC1	ZINC001344864568	1390820060	/nfs/dbraw/zinc/82/00/60/1390820060.db2.gz	TUGPZVPGWDMJLH-AWEZNQCLSA-N	0	3	325.416	3.267	20	30		EGEDHN
CCCN1CCCC[C@@H]1C(=O)N[C@H]1CCCc2cc(C#N)ccc21	ZINC001348538141	1391234214	/nfs/dbraw/zinc/23/42/14/1391234214.db2.gz	UTSFFIAFEBFOHF-RBUKOAKNSA-N	0	3	325.456	3.316	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)NCc1ccc(Oc2cccc(F)c2)nc1	ZINC001353526969	1392031812	/nfs/dbraw/zinc/03/18/12/1392031812.db2.gz	QOVVSLIMYOJAFB-QGZVFWFLSA-N	0	3	343.402	3.313	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1ccccc1S[C@@H](C)CC#N	ZINC001354579318	1392154046	/nfs/dbraw/zinc/15/40/46/1392154046.db2.gz	JPRBWOPBTRDAKQ-HNNXBMFYSA-N	0	3	344.484	3.157	20	30		EGEDHN
CCCN(C(=O)[C@@H](C)C#N)C1CCN(Cc2sc(C)nc2C)CC1	ZINC001479991758	1392523496	/nfs/dbraw/zinc/52/34/96/1392523496.db2.gz	PQFAMPKLKYICMX-ZDUSSCGKSA-N	0	3	348.516	3.123	20	30		EGEDHN
CCCC1(C(=O)N[C@H]2C[C@H](NCc3ccc(C#N)cc3F)C2)CCC1	ZINC001480152993	1392602641	/nfs/dbraw/zinc/60/26/41/1392602641.db2.gz	LPWWVPQSKRKDMJ-QAQDUYKDSA-N	0	3	343.446	3.405	20	30		EGEDHN
CCc1ccc(C(=O)NC[C@H](C)NCc2ccc(F)c(C#N)c2)s1	ZINC001480497851	1392770646	/nfs/dbraw/zinc/77/06/46/1392770646.db2.gz	YQJSDQHADZCXPH-LBPRGKRZSA-N	0	3	345.443	3.229	20	30		EGEDHN
CCCc1occc1C(=O)NC[C@@H](C)NCc1ccc(F)c(C#N)c1	ZINC001480573113	1392797250	/nfs/dbraw/zinc/79/72/50/1392797250.db2.gz	YSYWICGYMQBSIT-CYBMUJFWSA-N	0	3	343.402	3.151	20	30		EGEDHN
CCN(CCNC(=O)C12CCC(CC1)C2)Cc1ccc(C#N)cc1	ZINC001480982631	1393066323	/nfs/dbraw/zinc/06/63/23/1393066323.db2.gz	CBVUYQMIMQGIFI-UHFFFAOYSA-N	0	3	325.456	3.077	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)CCC2CCCCC2)C1	ZINC001490949297	1394382391	/nfs/dbraw/zinc/38/23/91/1394382391.db2.gz	YGOATOGCZQOIKS-SHTZXODSSA-N	0	3	343.309	3.492	20	30		EGEDHN
CC[C@@H](CNC(=O)c1cc(C#N)c[nH]1)N[C@@H](C)c1ccc(F)cc1F	ZINC001481801735	1394536526	/nfs/dbraw/zinc/53/65/26/1394536526.db2.gz	WNBXYEYHRIVZTE-FZMZJTMJSA-N	0	3	346.381	3.024	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1cccc2c1ccn2C)C1CC1	ZINC001481944064	1394608855	/nfs/dbraw/zinc/60/88/55/1394608855.db2.gz	FUBJHWHFJUFDAK-IBGZPJMESA-N	0	3	345.874	3.419	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)Cc2cccnc2)CCCC[C@@H]1C	ZINC001481958217	1394619776	/nfs/dbraw/zinc/61/97/76/1394619776.db2.gz	UUZLFMSJBATGOG-KBXCAEBGSA-N	0	3	335.879	3.031	20	30		EGEDHN
CC(C)[C@H](CNC(=O)c1ccsc1)NCc1ccc(C#N)cc1F	ZINC001698962560	1406717742	/nfs/dbraw/zinc/71/77/42/1406717742.db2.gz	QVNNBLLPIKJHNK-KRWDZBQOSA-N	0	3	345.443	3.303	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1ccc(Cl)c(OC)c1)C(C)C	ZINC001482555845	1395087706	/nfs/dbraw/zinc/08/77/06/1395087706.db2.gz	CSHKESFAKUSBBC-AWEZNQCLSA-N	0	3	345.270	3.445	20	30		EGEDHN
C=C(Cl)CN(CC1CC1)C1CCN(C(=O)[C@@H]2CC2(F)F)CC1	ZINC001483815723	1395101358	/nfs/dbraw/zinc/10/13/58/1395101358.db2.gz	AGIQZDQHVJGNKQ-AWEZNQCLSA-N	0	3	332.822	3.097	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)COc1ccccc1Cl)C(C)C	ZINC001698977463	1406748614	/nfs/dbraw/zinc/74/86/14/1406748614.db2.gz	PYXSAIKYNVMZGN-AWEZNQCLSA-N	0	3	345.270	3.202	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1ccc2ccncc2c1)C(C)C	ZINC001698977584	1406749659	/nfs/dbraw/zinc/74/96/59/1406749659.db2.gz	KQDVPXBIOIISOV-QGZVFWFLSA-N	0	3	331.847	3.331	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)[C@@H]1CCCc2cccnc21	ZINC001485258596	1395745565	/nfs/dbraw/zinc/74/55/65/1395745565.db2.gz	PBEMGKPIHLNDIN-MRXNPFEDSA-N	0	3	349.906	3.328	20	30		EGEDHN
Cc1cc(C(=O)NC[C@@H](C)N(C)Cc2ccc(C#N)cc2)ccc1F	ZINC001485346213	1395817123	/nfs/dbraw/zinc/81/71/23/1395817123.db2.gz	RKKBQSKYJJQLTA-OAHLLOKOSA-N	0	3	339.414	3.256	20	30		EGEDHN
CCC(C)(C)C(=O)N[C@@H]1CC[C@H](CNCc2ccccc2C#N)C1	ZINC001486210217	1396182939	/nfs/dbraw/zinc/18/29/39/1396182939.db2.gz	IWGKLHBPZUQQHN-MAUKXSAKSA-N	0	3	327.472	3.369	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)[C@@H](CC)OCC)CC1	ZINC001505394870	1396282684	/nfs/dbraw/zinc/28/26/84/1396282684.db2.gz	RBGDQFDXFPSXHN-MRXNPFEDSA-N	0	3	330.900	3.115	20	30		EGEDHN
CC[C@H](c1ccc(Cl)cc1)N(C)CCNC(=O)c1cc(C#N)c[nH]1	ZINC001492223413	1396315628	/nfs/dbraw/zinc/31/56/28/1396315628.db2.gz	MYIOTGUALVEGTB-QGZVFWFLSA-N	0	3	344.846	3.353	20	30		EGEDHN
CCN(CCNC(=O)c1cc2ccccn2c1)Cc1cccc(C#N)c1	ZINC001493029831	1396332839	/nfs/dbraw/zinc/33/28/39/1396332839.db2.gz	KNEWRIVVUYUMEV-UHFFFAOYSA-N	0	3	346.434	3.063	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N[C@@H]1CCCN(Cc2cc(C)ccc2C)C1	ZINC001690033867	1404271957	/nfs/dbraw/zinc/27/19/57/1404271957.db2.gz	MYYLBNZTKAPNGO-UYAOXDASSA-N	0	3	344.499	3.365	20	30		EGEDHN
Cc1cc(F)cc(C(=O)NC[C@@H](C)NCc2ccc(F)c(C#N)c2)c1	ZINC001690624911	1404659501	/nfs/dbraw/zinc/65/95/01/1404659501.db2.gz	GFUYEAYYQKKLME-CYBMUJFWSA-N	0	3	343.377	3.053	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1sc(CC2CC2)nc1C	ZINC001690872581	1404788357	/nfs/dbraw/zinc/78/83/57/1404788357.db2.gz	YEIVSWIMTHGNRC-LLVKDONJSA-N	0	3	341.908	3.255	20	30		EGEDHN
CCC1(C(=O)NC[C@@H]2CCN(Cc3ccc(C#N)cc3)C2)CCC1	ZINC001691153649	1405086972	/nfs/dbraw/zinc/08/69/72/1405086972.db2.gz	BGLDVLDEDKYTOY-SFHVURJKSA-N	0	3	325.456	3.077	20	30		EGEDHN
CCCC1(C(=O)NC[C@@H]2CCN(Cc3ccc(C#N)cc3)C2)CCC1	ZINC001691154656	1405089056	/nfs/dbraw/zinc/08/90/56/1405089056.db2.gz	TVJMBYWCRLEZTA-IBGZPJMESA-N	0	3	339.483	3.467	20	30		EGEDHN
C=C(Br)CNC[C@@H](NC(=O)c1cc(C)co1)C(C)(C)C	ZINC001725804212	1426483854	/nfs/dbraw/zinc/48/38/54/1426483854.db2.gz	YCLFFRLFJRDJHG-CYBMUJFWSA-N	0	3	343.265	3.231	20	30		EGEDHN
C=C(Cl)CNC[C@@](C)(NC(=O)C1CCC(F)(F)CC1)C1CC1	ZINC001732248445	1428491223	/nfs/dbraw/zinc/49/12/23/1428491223.db2.gz	RRAQMYSQVINDPK-OAHLLOKOSA-N	0	3	334.838	3.439	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)NC(=O)c1ccccc1Cl	ZINC001699386787	1412698051	/nfs/dbraw/zinc/69/80/51/1412698051.db2.gz	NHCBNGPMSKSKQN-LLVKDONJSA-N	0	3	333.844	3.181	20	30		EGEDHN
Cc1cc(C)c(C(=O)N[C@H](CNCc2ccc(C#N)s2)C2CC2)o1	ZINC001699586727	1412944240	/nfs/dbraw/zinc/94/42/40/1412944240.db2.gz	XHHSWFOQJVTVAB-MRXNPFEDSA-N	0	3	343.452	3.128	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)C3(C(F)F)CCCC3)CC2)cc1	ZINC001699663683	1413049141	/nfs/dbraw/zinc/04/91/41/1413049141.db2.gz	UBQUCEKMIZMHNM-UHFFFAOYSA-N	0	3	347.409	3.122	20	30		EGEDHN
CCC1(C(=O)N(C)[C@H](CNCc2ccc(C#N)s2)C2CC2)CC1	ZINC001700730129	1414392750	/nfs/dbraw/zinc/39/27/50/1414392750.db2.gz	MQFGGFARZLUSIU-MRXNPFEDSA-N	0	3	331.485	3.137	20	30		EGEDHN
Cc1cc(C(=O)NC[C@H](NCc2ccc(C#N)s2)C2CC2)c(C)o1	ZINC001713105278	1417665234	/nfs/dbraw/zinc/66/52/34/1417665234.db2.gz	LVTMRDNCOADAEC-KRWDZBQOSA-N	0	3	343.452	3.128	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1ccc(OC)cc1Cl	ZINC001713418150	1418041941	/nfs/dbraw/zinc/04/19/41/1418041941.db2.gz	ORQGQTVPTGXZBH-NSHDSACASA-N	0	3	331.243	3.199	20	30		EGEDHN
CCN(CCNC(=O)CCC1CCCC1)Cc1cccc(C#N)c1	ZINC001713479807	1418165044	/nfs/dbraw/zinc/16/50/44/1418165044.db2.gz	CWGBZQGMNFJKIU-UHFFFAOYSA-N	0	3	327.472	3.467	20	30		EGEDHN
CCCN(CCNC(=O)CC(C)(C)C)Cc1ccc(OC)c(C#N)c1	ZINC001713545898	1418315388	/nfs/dbraw/zinc/31/53/88/1418315388.db2.gz	QEKWCNWGVQEMTB-UHFFFAOYSA-N	0	3	345.487	3.331	20	30		EGEDHN
CCc1cccc(CN2CC[C@H](NC(=O)CC#Cc3ccccc3)C2)c1	ZINC001713838641	1418636422	/nfs/dbraw/zinc/63/64/22/1418636422.db2.gz	WXCDWPATRDVJAJ-QFIPXVFZSA-N	0	3	346.474	3.381	20	30		EGEDHN
CCc1occc1C(=O)NC[C@H](NCc1ccc(C#N)s1)C1CC1	ZINC001713863802	1418660897	/nfs/dbraw/zinc/66/08/97/1418660897.db2.gz	CSAQXQKUHQSYHL-INIZCTEOSA-N	0	3	343.452	3.073	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)C[C@@H](C)c2ccccc2OC)C1	ZINC001713964535	1418744448	/nfs/dbraw/zinc/74/44/48/1418744448.db2.gz	BKPCSRXNTMXEAP-BPLDGKMQSA-N	0	3	336.863	3.178	20	30		EGEDHN
CC(C)SCC(=O)NC[C@H]1CCCN(Cc2ccc(C#N)cc2)C1	ZINC001714026355	1418811562	/nfs/dbraw/zinc/81/15/62/1418811562.db2.gz	RMYXYWRWSRFZDE-GOSISDBHSA-N	0	3	345.512	3.028	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](NC(=O)C(C2CC2)C2CC2)C2CC2)s1	ZINC001733187593	1429289084	/nfs/dbraw/zinc/28/90/84/1429289084.db2.gz	PACJMDPZIWFFMJ-QGZVFWFLSA-N	0	3	343.496	3.040	20	30		EGEDHN
CC[C@@H](CNC(=O)c1cc(C#N)c[nH]1)N[C@@H](C)c1ccccc1Cl	ZINC001714065339	1418861920	/nfs/dbraw/zinc/86/19/20/1418861920.db2.gz	MEWIFJJAJXOGID-JSGCOSHPSA-N	0	3	344.846	3.399	20	30		EGEDHN
CCc1occc1C(=O)NC[C@@H](CC)NCc1ccc(C#N)s1	ZINC001714073841	1418868315	/nfs/dbraw/zinc/86/83/15/1418868315.db2.gz	PERGUMSOIYFGAN-GFCCVEGCSA-N	0	3	331.441	3.073	20	30		EGEDHN
C[C@H](CNC(=O)[C@H](C)c1ccccc1)NCc1ccc(F)c(C#N)c1	ZINC001714298134	1419077292	/nfs/dbraw/zinc/07/72/92/1419077292.db2.gz	CESVTGQOXBVPGP-HUUCEWRRSA-N	0	3	339.414	3.095	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccc(CF)cc1)NCc1ccc(F)c(C#N)c1	ZINC001714308079	1419088437	/nfs/dbraw/zinc/08/84/37/1419088437.db2.gz	BKNPVTWFNWJNGY-ZDUSSCGKSA-N	0	3	343.377	3.075	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)C[C@H](C)c1ccco1	ZINC001714443584	1419175454	/nfs/dbraw/zinc/17/54/54/1419175454.db2.gz	DHMFJYBXADNBAJ-CVEARBPZSA-N	0	3	339.439	3.187	20	30		EGEDHN
C[C@@H](CCNC(=O)C#CC1CC1)NCc1c(Cl)oc2ccccc21	ZINC001714466664	1419195167	/nfs/dbraw/zinc/19/51/67/1419195167.db2.gz	OJDPQYWPZIBUDO-ZDUSSCGKSA-N	0	3	344.842	3.484	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1cc2ccc(OC)cc2[nH]1	ZINC001714482869	1419205505	/nfs/dbraw/zinc/20/55/05/1419205505.db2.gz	YLCROJUYLOTBPL-GFCCVEGCSA-N	0	3	335.835	3.027	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cc(C(C)(C)C)on2)CCCC1	ZINC001714497642	1419221942	/nfs/dbraw/zinc/22/19/42/1419221942.db2.gz	QAXOLKVNFAFBTM-UHFFFAOYSA-N	0	3	339.867	3.357	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2ccc3c(c2)C[C@@H](C)O3)CCCC1	ZINC001714507092	1419233735	/nfs/dbraw/zinc/23/37/35/1419233735.db2.gz	PHEGCNDOBJXIEZ-CQSZACIVSA-N	0	3	348.874	3.395	20	30		EGEDHN
C=CCCCCCN1CCC[C@@H](NC(=O)c2cc(Cl)n(C)n2)C1	ZINC001714921624	1419674360	/nfs/dbraw/zinc/67/43/60/1419674360.db2.gz	FYJKFRBAEWJGRD-CQSZACIVSA-N	0	3	338.883	3.014	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)Cc2ccc(F)c(F)c2)CCCC1	ZINC001715098971	1419839763	/nfs/dbraw/zinc/83/97/63/1419839763.db2.gz	UFYZRYBBSLSHDS-UHFFFAOYSA-N	0	3	342.817	3.278	20	30		EGEDHN
CCC(=O)N[C@@]1(CNCc2cc(C#N)ccc2OC)CCCC[C@@H]1C	ZINC001715128601	1419877149	/nfs/dbraw/zinc/87/71/49/1419877149.db2.gz	MWCOLLAXDNWRKC-MGPUTAFESA-N	0	3	343.471	3.132	20	30		EGEDHN
Cc1cc(C)cc(C(=O)N(C)[C@H](C)CNCc2ccc(C#N)s2)c1	ZINC001715376769	1420072906	/nfs/dbraw/zinc/07/29/06/1420072906.db2.gz	RLXHXQVXRRXDJU-OAHLLOKOSA-N	0	3	341.480	3.487	20	30		EGEDHN
CC(C)[C@H](CNC(=O)c1ccsc1)NCc1cc(C#N)ccc1F	ZINC001715514125	1420199294	/nfs/dbraw/zinc/19/92/94/1420199294.db2.gz	IINZYMLHSUGEDR-KRWDZBQOSA-N	0	3	345.443	3.303	20	30		EGEDHN
CCCCC(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccccc2C#N)C1	ZINC001715554516	1420249190	/nfs/dbraw/zinc/24/91/90/1420249190.db2.gz	SPFVNRYPAWFIQA-RTBURBONSA-N	0	3	325.456	3.171	20	30		EGEDHN
Cc1cocc1C(=O)NC[C@@H](NCc1ccc(C#N)cc1F)C(C)C	ZINC001715738364	1420319498	/nfs/dbraw/zinc/31/94/98/1420319498.db2.gz	XDHBGWWWHMUUIG-GOSISDBHSA-N	0	3	343.402	3.143	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)NC(=O)C1(C(F)F)CCCC1	ZINC001715946088	1420414131	/nfs/dbraw/zinc/41/41/31/1420414131.db2.gz	XTCVNVRYZNKKPU-LLVKDONJSA-N	0	3	341.427	3.040	20	30		EGEDHN
CCc1ccsc1C(=O)N[C@H](C)CNCc1ccc(C#N)s1	ZINC001715963396	1420429220	/nfs/dbraw/zinc/42/92/20/1420429220.db2.gz	ZWOQNBISBOYBOD-LLVKDONJSA-N	0	3	333.482	3.152	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H](C)CNCc2ccc(F)c(C#N)c2)sc1C	ZINC001716463162	1420676672	/nfs/dbraw/zinc/67/66/72/1420676672.db2.gz	JHBFKJYBBZIUDE-LBPRGKRZSA-N	0	3	345.443	3.284	20	30		EGEDHN
C[C@H](CN(C)Cc1cccc(C#N)c1)NC(=O)c1ccc(CF)cc1	ZINC001716508996	1420740868	/nfs/dbraw/zinc/74/08/68/1420740868.db2.gz	URWDWFKLKMXHMA-OAHLLOKOSA-N	0	3	339.414	3.278	20	30		EGEDHN
CC(C)Oc1ccc(CNC2(CNC(=O)[C@@H](C)C#N)CC2)cc1Cl	ZINC001716677963	1420833220	/nfs/dbraw/zinc/83/32/20/1420833220.db2.gz	OVFVWAXPXCEPPC-ZDUSSCGKSA-N	0	3	349.862	3.025	20	30		EGEDHN
CC(C)(C)CC(=O)N[C@]1(C)CCN(Cc2ccc(OCC#N)cc2)C1	ZINC001716833756	1420960561	/nfs/dbraw/zinc/96/05/61/1420960561.db2.gz	FQPQPJBISHPSAU-HXUWFJFHSA-N	0	3	343.471	3.106	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)COC2CCCC2)CC1	ZINC001717354764	1421289331	/nfs/dbraw/zinc/28/93/31/1421289331.db2.gz	MKAFDBZWCAQUET-UHFFFAOYSA-N	0	3	342.911	3.259	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1cncnc1C(C)C	ZINC001717459481	1421389201	/nfs/dbraw/zinc/38/92/01/1421389201.db2.gz	DAPWPDNMHNHACX-UHFFFAOYSA-N	0	3	338.883	3.040	20	30		EGEDHN
CC1(C)CC(C(=O)N2CC[C@@](C)(CNCc3ccccc3C#N)C2)C1	ZINC001733424924	1429632830	/nfs/dbraw/zinc/63/28/30/1429632830.db2.gz	ZAWDSZAEANGIJS-NRFANRHFSA-N	0	3	339.483	3.323	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@](C)(CNCc3ccccc3C#N)C2)co1	ZINC001733429115	1429636403	/nfs/dbraw/zinc/63/64/03/1429636403.db2.gz	FHFNQQCKXBNNPN-HXUWFJFHSA-N	0	3	337.423	3.102	20	30		EGEDHN
CC1(CCC(=O)N2CC[C@@](C)(CNCc3ccccc3C#N)C2)CC1	ZINC001733440478	1429647801	/nfs/dbraw/zinc/64/78/01/1429647801.db2.gz	AYKPIIXJANMGCB-NRFANRHFSA-N	0	3	339.483	3.467	20	30		EGEDHN
Cc1sccc1C(=O)NCC1(NCc2ccc(F)c(C#N)c2)CC1	ZINC001723514970	1424447661	/nfs/dbraw/zinc/44/76/61/1424447661.db2.gz	OPUBNXUHBJEDHV-UHFFFAOYSA-N	0	3	343.427	3.120	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC(N(CC=C(Cl)Cl)CC2CC2)CC1	ZINC001723640535	1424506239	/nfs/dbraw/zinc/50/62/39/1424506239.db2.gz	PIISWGNNKBMYBH-GFCCVEGCSA-N	0	3	344.286	3.168	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)Cc2cncc(C)c2)CC1	ZINC001725025179	1425442560	/nfs/dbraw/zinc/44/25/60/1425442560.db2.gz	CPBSRFRIECWIQB-UHFFFAOYSA-N	0	3	349.906	3.246	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1ncoc1C1CC1	ZINC001731294985	1427237512	/nfs/dbraw/zinc/23/75/12/1427237512.db2.gz	STHNDIQUUZHXKT-TZMCWYRMSA-N	0	3	337.851	3.277	20	30		EGEDHN
C=C(C)CN1CCN(CCCNC(=O)[C@H](C)CC2CCCCC2)CC1	ZINC001731361073	1427296949	/nfs/dbraw/zinc/29/69/49/1427296949.db2.gz	NEKDZLACEFMFQF-LJQANCHMSA-N	0	3	349.563	3.293	20	30		EGEDHN
CC1(CC(=O)N[C@H]2CCN(Cc3cccc(C#N)c3)CC2(C)C)CC1	ZINC001733874913	1437701088	/nfs/dbraw/zinc/70/10/88/1437701088.db2.gz	HNHGAEDWHDWEOW-SFHVURJKSA-N	0	3	339.483	3.465	20	30		EGEDHN
CN(C(=O)c1cccs1)[C@@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001734293200	1438023822	/nfs/dbraw/zinc/02/38/22/1438023822.db2.gz	VXUMUBJFXWKTET-HNNXBMFYSA-N	0	3	345.493	3.322	20	30		EGEDHN
CN(CCCNC(=O)c1sccc1F)Cc1ccc(C#N)c(F)c1	ZINC001751968214	1440129382	/nfs/dbraw/zinc/12/93/82/1440129382.db2.gz	QBYLQLGOVIQNOT-UHFFFAOYSA-N	0	3	349.406	3.150	20	30		EGEDHN
C[C@@H](NCC#Cc1ccccc1)[C@H]1CCCCN1C(=O)c1ccc[nH]1	ZINC001752132950	1440143724	/nfs/dbraw/zinc/14/37/24/1440143724.db2.gz	XLIFSNUHWKTJFR-YLJYHZDGSA-N	0	3	335.451	3.039	20	30		EGEDHN
CCN(CCCNC(=O)Cc1occc1C)Cc1ccc(C#N)s1	ZINC001752211267	1440155064	/nfs/dbraw/zinc/15/50/64/1440155064.db2.gz	AAPBQWFIPCTQIQ-UHFFFAOYSA-N	0	3	345.468	3.092	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N(C)C1CCN(C[C@@H](O)c2ccccc2)CC1	ZINC001752308664	1440169131	/nfs/dbraw/zinc/16/91/31/1440169131.db2.gz	RBXQORMXNFLBAT-FXAWDEMLSA-N	0	3	344.499	3.245	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1CC12CCN(Cc1cnc(C)s1)CC2	ZINC001752426748	1440177369	/nfs/dbraw/zinc/17/73/69/1440177369.db2.gz	KMMVHTKJFHMAHT-INIZCTEOSA-N	0	3	333.501	3.279	20	30		EGEDHN
C=C(C)CN1CCC(N(CCC)C(=O)CN(C)c2ccccc2)CC1	ZINC001752441262	1440181364	/nfs/dbraw/zinc/18/13/64/1440181364.db2.gz	CKNQYCCAKNNPOI-UHFFFAOYSA-N	0	3	343.515	3.402	20	30		EGEDHN
C[C@@H](C(=O)NC[C@H](NCC#Cc1ccc(F)cc1)C1CC1)C1CCC1	ZINC001752468794	1440184122	/nfs/dbraw/zinc/18/41/22/1440184122.db2.gz	NREGCFGPMSMFBP-QRWLVFNGSA-N	0	3	342.458	3.098	20	30		EGEDHN
C[C@H](C(=O)NC[C@H](NCc1ccc(C#N)cc1F)C1CC1)C(C)(C)C	ZINC001752468564	1440184168	/nfs/dbraw/zinc/18/41/68/1440184168.db2.gz	JPAVRGUAVFVOKH-ACJLOTCBSA-N	0	3	345.462	3.364	20	30		EGEDHN
CCC1(C(=O)NC[C@H](NCC#Cc2cccc(Cl)c2)C2CC2)CC1	ZINC001752482831	1440185925	/nfs/dbraw/zinc/18/59/25/1440185925.db2.gz	SOYUOLZEIHLAOP-SFHVURJKSA-N	0	3	344.886	3.366	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)c1nc(CC)oc1C	ZINC001752564721	1440195451	/nfs/dbraw/zinc/19/54/51/1440195451.db2.gz	JQIWERVODNJJHJ-BMFZPTHFSA-N	0	3	331.460	3.189	20	30		EGEDHN
CC1(C(=O)N[C@H]2C[C@H](NCC#Cc3ccccc3Cl)C2)CCC1	ZINC001752650377	1440197816	/nfs/dbraw/zinc/19/78/16/1440197816.db2.gz	HQJUKWKVPMEBNF-WKILWMFISA-N	0	3	330.859	3.119	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H](NCc3ccns3)C2)CCCCC1	ZINC001752686837	1440199895	/nfs/dbraw/zinc/19/98/95/1440199895.db2.gz	CCSDGKBTAWGPTH-SHTZXODSSA-N	0	3	333.501	3.407	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H](NCc3conc3C)C2)CCCCC1	ZINC001752687552	1440200137	/nfs/dbraw/zinc/20/01/37/1440200137.db2.gz	TWHKLSCXFXYUGO-QAQDUYKDSA-N	0	3	331.460	3.246	20	30		EGEDHN
O=C(C#CC1CC1)NC1C[C@H]2CC[C@@H](C1)N2Cc1ccc(Cl)cc1	ZINC001752694660	1440200882	/nfs/dbraw/zinc/20/08/82/1440200882.db2.gz	VUMXMVILTQMWHQ-YQQQUEKLSA-N	0	3	342.870	3.365	20	30		EGEDHN
O=C(CC1=CCCCC1)N[C@H]1C[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001752720487	1440203902	/nfs/dbraw/zinc/20/39/02/1440203902.db2.gz	ULNYBCMDDSZTQH-BGYRXZFFSA-N	0	3	340.442	3.305	20	30		EGEDHN
CCc1ccsc1C(=O)N[C@H]1C[C@@H](NCC#Cc2ccccc2)C1	ZINC001752774947	1440206712	/nfs/dbraw/zinc/20/67/12/1440206712.db2.gz	BKJOJGVQXIDXEN-HDICACEKSA-N	0	3	338.476	3.213	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)CC23CC4CC(CC(C4)C2)C3)C1	ZINC001752788332	1440212404	/nfs/dbraw/zinc/21/24/04/1440212404.db2.gz	HUZHCIAOERTUMT-WEWRAIFCSA-N	0	3	342.527	3.444	20	30		EGEDHN
CC(F)(F)CCC(=O)N1CCC[C@H](CNCc2ccccc2C#N)C1	ZINC001752801213	1440215027	/nfs/dbraw/zinc/21/50/27/1440215027.db2.gz	IMWJWZWQGUIIPN-OAHLLOKOSA-N	0	3	349.425	3.322	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)C[C@@H](C)c1c(C)noc1C	ZINC001752821613	1440220995	/nfs/dbraw/zinc/22/09/95/1440220995.db2.gz	PKAZAVZANWKREA-RHSMWYFYSA-N	0	3	333.476	3.332	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)[C@@](C)(OC)c1ccccc1	ZINC001752823926	1440222584	/nfs/dbraw/zinc/22/25/84/1440222584.db2.gz	MUKXBZLLTITGDK-ICSRJNTNSA-N	0	3	330.472	3.095	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](CNCc2ccn(C(C)C)n2)C1	ZINC001752937412	1440250540	/nfs/dbraw/zinc/25/05/40/1440250540.db2.gz	FCMAZJBAKGLUTA-MRXNPFEDSA-N	0	3	332.492	3.004	20	30		EGEDHN
CC(C)SCC(=O)N1CCC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001752987425	1440258198	/nfs/dbraw/zinc/25/81/98/1440258198.db2.gz	RRGVJOMULNTJKH-SFHVURJKSA-N	0	3	345.512	3.123	20	30		EGEDHN
CC#CCN(C)[C@@H]1CCCN(C(=O)C[C@@H](C)c2ccccc2F)C1	ZINC001752998831	1440263474	/nfs/dbraw/zinc/26/34/74/1440263474.db2.gz	NSHGCNCBDFOEGC-IAGOWNOFSA-N	0	3	330.447	3.265	20	30		EGEDHN
Cc1cccc(Cl)c1CN1CC[C@@H](CNC(=O)C#CC(C)C)C1	ZINC001753126214	1440315008	/nfs/dbraw/zinc/31/50/08/1440315008.db2.gz	YTIHQUJNXUHGOB-INIZCTEOSA-N	0	3	332.875	3.246	20	30		EGEDHN
CC[C@H](CC1CCCCC1)C(=O)NC[C@H]1CCN(CC#CCOC)C1	ZINC001753135255	1440318428	/nfs/dbraw/zinc/31/84/28/1440318428.db2.gz	JEDAZXKMXGSVAZ-WOJBJXKFSA-N	0	3	348.531	3.071	20	30		EGEDHN
C[C@@H]1CCCC[C@@H]1C(=O)N(C)CCNCc1ccc(C#N)c(F)c1	ZINC001753223990	1440340440	/nfs/dbraw/zinc/34/04/40/1440340440.db2.gz	TYSJEURPOAPLOC-PBHICJAKSA-N	0	3	331.435	3.072	20	30		EGEDHN
Cc1nc(C2CC2)ccc1C(=O)N(C)CCNCc1ccc(C#N)cc1	ZINC001753239760	1440342026	/nfs/dbraw/zinc/34/20/26/1440342026.db2.gz	JBWIVEVQBVMQTA-UHFFFAOYSA-N	0	3	348.450	3.001	20	30		EGEDHN
CC[C@H]1CCCC[C@@H]1C(=O)N(C)CCNCc1ccc(C#N)cc1	ZINC001753248668	1440342812	/nfs/dbraw/zinc/34/28/12/1440342812.db2.gz	VLZOLNTWLHLCRR-OALUTQOASA-N	0	3	327.472	3.323	20	30		EGEDHN
C=CCN[C@H](CNC(=O)c1ccc(C(F)F)nc1)c1ccccc1	ZINC001753298880	1440353344	/nfs/dbraw/zinc/35/33/44/1440353344.db2.gz	OEWPWFNABFIBSO-MRXNPFEDSA-N	0	3	331.366	3.266	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@H](NCCOC2CCC2)c2ccccc2)C1	ZINC001753301969	1440354265	/nfs/dbraw/zinc/35/42/65/1440354265.db2.gz	RICCBVXFNVAXMP-LJQANCHMSA-N	0	3	342.483	3.359	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CCC)C(=O)c2ccc3c(c2)CCOC3)C1	ZINC001753318264	1440361199	/nfs/dbraw/zinc/36/11/99/1440361199.db2.gz	GKRWGUHXNFVQIL-FQEVSTJZSA-N	0	3	342.483	3.262	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CCC)C(=O)[C@H]2CCc3ccccc3O2)C1	ZINC001753319882	1440362796	/nfs/dbraw/zinc/36/27/96/1440362796.db2.gz	OQESQSYTPPIAIO-AZUAARDMSA-N	0	3	342.483	3.269	20	30		EGEDHN
CC/C=C(\C)C(=O)NCC[C@H]1CCN(Cc2ccccc2C#N)C1	ZINC001753322719	1440364514	/nfs/dbraw/zinc/36/45/14/1440364514.db2.gz	PPDFHRSORYITEZ-ZSUDGLGESA-N	0	3	325.456	3.243	20	30		EGEDHN
CCC[C@H](C)C(=O)NCC[C@H]1CCN(CC#Cc2ccc(F)cc2)C1	ZINC001753325058	1440365997	/nfs/dbraw/zinc/36/59/97/1440365997.db2.gz	OUHLOOSKLROCCV-HKUYNNGSSA-N	0	3	344.474	3.442	20	30		EGEDHN
C=CCCN1CCN(CCN(C)C(=O)C[C@H]2CCCCC2(C)C)CC1	ZINC001753346715	1440376353	/nfs/dbraw/zinc/37/63/53/1440376353.db2.gz	KPHDDYCEFNWVRH-LJQANCHMSA-N	0	3	349.563	3.245	20	30		EGEDHN
CCCC(=O)N1CC[C@H](CN(C)CC#Cc2ccc(Cl)cc2)C1	ZINC001753347132	1440376627	/nfs/dbraw/zinc/37/66/27/1440376627.db2.gz	UOVQFXXDAWKDPV-QGZVFWFLSA-N	0	3	332.875	3.272	20	30		EGEDHN
CN(CC#Cc1ccccc1)CC1CCN(C(=O)C2(C)CCC2)CC1	ZINC001753364818	1440384510	/nfs/dbraw/zinc/38/45/10/1440384510.db2.gz	OWKJGRSPAPJIBW-UHFFFAOYSA-N	0	3	338.495	3.399	20	30		EGEDHN
CCCCCCCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H]1C[C@H]1C1CCOCC1	ZINC001753423750	1440396060	/nfs/dbraw/zinc/39/60/60/1440396060.db2.gz	XJUVINGXFVOFBL-LWYYNNOASA-N	0	3	348.531	3.305	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(COC)cc1	ZINC001753427450	1440397290	/nfs/dbraw/zinc/39/72/90/1440397290.db2.gz	IEQKTDKVDDIMCE-SNRMKQJTSA-N	0	3	328.456	3.086	20	30		EGEDHN
C=CCOCCN1CC[C@H](N(C)C(=O)C[C@@H](C)c2cccc(F)c2)C1	ZINC001753444862	1440403387	/nfs/dbraw/zinc/40/33/87/1440403387.db2.gz	ZSDWUWWOXHXRAA-APWZRJJASA-N	0	3	348.462	3.055	20	30		EGEDHN
C#CCC1(C(=O)N(C)[C@H]2CCN(C[C@H]3CCCCO3)C2)CCCCC1	ZINC001753449421	1440405431	/nfs/dbraw/zinc/40/54/31/1440405431.db2.gz	FXFZPOORIPHCSE-RBUKOAKNSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@](C)(CNCc1oc(C)nc1C)C1CC1	ZINC001753518415	1440428082	/nfs/dbraw/zinc/42/80/82/1440428082.db2.gz	HQIIPELQDKYJBG-LJQANCHMSA-N	0	3	333.476	3.268	20	30		EGEDHN
C[C@H]1CCCC[C@@]1(CNCC#Cc1ccccc1)NC(=O)c1cc[nH]c1	ZINC001753532602	1440431527	/nfs/dbraw/zinc/43/15/27/1440431527.db2.gz	TWRIGKPAOMISHN-AVRDEDQJSA-N	0	3	349.478	3.335	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)Cc2cncc(C)c2)CCCC[C@H]1C	ZINC001753534387	1440432055	/nfs/dbraw/zinc/43/20/55/1440432055.db2.gz	SOQVYIVGLJQUQR-DNVCBOLYSA-N	0	3	349.906	3.340	20	30		EGEDHN
C#CCCCCC(=O)N1CCC(CCNCc2ncc(C)s2)CC1	ZINC001753569061	1440438112	/nfs/dbraw/zinc/43/81/12/1440438112.db2.gz	NZADZMJQEDTAMZ-UHFFFAOYSA-N	0	3	347.528	3.363	20	30		EGEDHN
C#Cc1ccc(C(=O)NCCC2CCN(C[C@H](F)CC)CC2)cc1	ZINC001753597391	1440445190	/nfs/dbraw/zinc/44/51/90/1440445190.db2.gz	MEADSUJEAONUOT-LJQANCHMSA-N	0	3	330.447	3.248	20	30		EGEDHN
C[C@H](CNCc1ccccc1C#N)CNC(=O)c1ccsc1Cl	ZINC001753632448	1440452514	/nfs/dbraw/zinc/45/25/14/1440452514.db2.gz	OITDOJDCZQIQSY-GFCCVEGCSA-N	0	3	347.871	3.429	20	30		EGEDHN
CC(C)C[C@@H](CNCC#Cc1ccccc1)NC(=O)CC1(C)CC1	ZINC001753736749	1440477897	/nfs/dbraw/zinc/47/78/97/1440477897.db2.gz	JPMLSOKZPGKKSP-IBGZPJMESA-N	0	3	326.484	3.349	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](NCc2nc(C)oc2C)[C@H](C)C1	ZINC001753755223	1440482988	/nfs/dbraw/zinc/48/29/88/1440482988.db2.gz	OONGVFICQBWYIA-RDTXWAMCSA-N	0	3	345.487	3.386	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H](NCc2c(F)cccc2F)[C@@H](C)C1	ZINC001753759971	1440483847	/nfs/dbraw/zinc/48/38/47/1440483847.db2.gz	MZKCIQPFIATLNX-KXBFYZLASA-N	0	3	348.437	3.485	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCCCN1C(=O)[C@H](CC(C)C)OC	ZINC001753794912	1440489615	/nfs/dbraw/zinc/48/96/15/1440489615.db2.gz	DLYKFJYMDHJFLR-CVEARBPZSA-N	0	3	330.900	3.161	20	30		EGEDHN
CC(C)[C@H](CNC(=O)C1(CCF)CC1)NCC#Cc1ccc(F)cc1	ZINC001753835510	1440500844	/nfs/dbraw/zinc/50/08/44/1440500844.db2.gz	SJFCRTPPAJFIAM-SFHVURJKSA-N	0	3	348.437	3.047	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)Cc1ccccc1Cl)C(C)C	ZINC001753841593	1440502921	/nfs/dbraw/zinc/50/29/21/1440502921.db2.gz	BIBJWXNWYXJGJH-HNNXBMFYSA-N	0	3	329.271	3.365	20	30		EGEDHN
C[C@H](CCNCc1ccccc1C#N)NC(=O)[C@@H](C)C1CCCC1	ZINC001754011899	1440531356	/nfs/dbraw/zinc/53/13/56/1440531356.db2.gz	FXEYROBXUHJNRO-CVEARBPZSA-N	0	3	327.472	3.369	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H](C)CCNCc2cc(C#N)ccc2F)cc1	ZINC001754016246	1440531891	/nfs/dbraw/zinc/53/18/91/1440531891.db2.gz	JSGIWNYUBDWHMJ-OAHLLOKOSA-N	0	3	339.414	3.304	20	30		EGEDHN
CCN(CCNCc1ccccc1C(F)(F)F)C(=O)C#CC(C)C	ZINC001754044206	1440534913	/nfs/dbraw/zinc/53/49/13/1440534913.db2.gz	VEKNXFARNBSCGI-UHFFFAOYSA-N	0	3	340.389	3.303	20	30		EGEDHN
CCc1ccc(C(=O)N(CC)CCNCc2cccc(C#N)c2)s1	ZINC001754056230	1440536281	/nfs/dbraw/zinc/53/62/81/1440536281.db2.gz	VPHYBKXXGDTDLR-UHFFFAOYSA-N	0	3	341.480	3.434	20	30		EGEDHN
CCN(CCNCc1ccc(F)c(C#N)c1)C(=O)[C@]1(C)CCC[C@H]1C	ZINC001754065383	1440537461	/nfs/dbraw/zinc/53/74/61/1440537461.db2.gz	DDLGPBYKYVHSEG-FOIQADDNSA-N	0	3	345.462	3.462	20	30		EGEDHN
C[C@H](C#N)C(=O)NC/C=C/CNCc1cccc(Oc2ccccc2)c1	ZINC001754102482	1440541312	/nfs/dbraw/zinc/54/13/12/1440541312.db2.gz	BPHDYNHMQUKBTD-FUTAKVPZSA-N	0	3	349.434	3.401	20	30		EGEDHN
CCCC(C)(C)C(=O)NC/C=C/CNCc1ccc(F)c(C#N)c1	ZINC001754165296	1440546519	/nfs/dbraw/zinc/54/65/19/1440546519.db2.gz	XQZNGQIPGKUBBP-AATRIKPKSA-N	0	3	331.435	3.286	20	30		EGEDHN
Cc1ccc(C(=O)NC/C=C/CNCc2ccc(C#N)c(F)c2)cc1	ZINC001754200409	1440549937	/nfs/dbraw/zinc/54/99/37/1440549937.db2.gz	GMZXLWSNRCTMNE-NSCUHMNNSA-N	0	3	337.398	3.082	20	30		EGEDHN
N#Cc1ccc(CNC/C=C/CNC(=O)c2ccc3c(c2)CCC3)cc1	ZINC001754203172	1440550354	/nfs/dbraw/zinc/55/03/54/1440550354.db2.gz	DPSNLSMKQQGNME-OWOJBTEDSA-N	0	3	345.446	3.123	20	30		EGEDHN
C[C@H](CNCC#Cc1ccccc1)NC(=O)c1ccc2ncsc2c1	ZINC001754251320	1440558154	/nfs/dbraw/zinc/55/81/54/1440558154.db2.gz	VRWXFUOYDBCJNF-OAHLLOKOSA-N	0	3	349.459	3.056	20	30		EGEDHN
C=CCCC(=O)N[C@@H](C)CNCc1cnc(-c2ccccc2)s1	ZINC001754260540	1440559920	/nfs/dbraw/zinc/55/99/20/1440559920.db2.gz	DMRUKEUENPOITR-AWEZNQCLSA-N	0	3	329.469	3.371	20	30		EGEDHN
Cc1ccoc1C(=O)N[C@@H](C)CNCC#Cc1ccc(Cl)cc1	ZINC001754262152	1440560094	/nfs/dbraw/zinc/56/00/94/1440560094.db2.gz	ASBOXPBNHYKNOU-AWEZNQCLSA-N	0	3	330.815	3.001	20	30		EGEDHN
COc1ccc(C#N)cc1CNC[C@H](C)NC(=O)C(C)=C1CCCC1	ZINC001754263329	1440560224	/nfs/dbraw/zinc/56/02/24/1440560224.db2.gz	MWVVDCNIUZXUFP-AWEZNQCLSA-N	0	3	341.455	3.052	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H](C)CNCc2ccc(F)c(C#N)c2)CCC1	ZINC001754282206	1440563381	/nfs/dbraw/zinc/56/33/81/1440563381.db2.gz	QJLVDYDGINTXHC-AWEZNQCLSA-N	0	3	329.419	3.038	20	30		EGEDHN
Cc1cccc([C@H](C)C(=O)N[C@@H](C)CNCC#Cc2ccccc2)c1	ZINC001754284771	1440563890	/nfs/dbraw/zinc/56/38/90/1440563890.db2.gz	UCGUONKNYMFUDK-OALUTQOASA-N	0	3	334.463	3.245	20	30		EGEDHN
CC[C@@H](C)CCC(=O)N[C@H](CNCC#Cc1ccccc1)C1CC1	ZINC001754455184	1440602006	/nfs/dbraw/zinc/60/20/06/1440602006.db2.gz	NLJRBGKNLVBDIR-YLJYHZDGSA-N	0	3	326.484	3.349	20	30		EGEDHN
CC[C@H]1CN(C(=O)C#CC(C)C)CC[C@@H]1NCc1nc(C)sc1C	ZINC001754464801	1440604005	/nfs/dbraw/zinc/60/40/05/1440604005.db2.gz	MNQJOMZVYYOKKG-IRXDYDNUSA-N	0	3	347.528	3.136	20	30		EGEDHN
CC[C@@H]1CN(C(=O)C#CC(C)C)CC[C@H]1NCc1nc(C)sc1C	ZINC001754464800	1440604050	/nfs/dbraw/zinc/60/40/50/1440604050.db2.gz	MNQJOMZVYYOKKG-IAGOWNOFSA-N	0	3	347.528	3.136	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H]2CCN2CCC2CCCC2)CCOCC1	ZINC001754500496	1440613972	/nfs/dbraw/zinc/61/39/72/1440613972.db2.gz	KMGIEMBHNNYZNG-SFHVURJKSA-N	0	3	334.504	3.130	20	30		EGEDHN
CCC[C@@H](CC)C(=O)NCC1(NCc2ccc(F)c(C#N)c2)CC1	ZINC001754530307	1440622252	/nfs/dbraw/zinc/62/22/52/1440622252.db2.gz	PIQSENUPBZQETD-OAHLLOKOSA-N	0	3	331.435	3.262	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)CC(C)(C)CC(F)(F)F)C2)CC1	ZINC001754560828	1440633696	/nfs/dbraw/zinc/63/36/96/1440633696.db2.gz	CRUGKBXLBMNXNV-UHFFFAOYSA-N	0	3	344.421	3.303	20	30		EGEDHN
CC/C(C)=C\C(=O)N1CCC[C@H]1CNCc1ccc(C#N)c(F)c1	ZINC001754610856	1440643834	/nfs/dbraw/zinc/64/38/34/1440643834.db2.gz	VBLAETRLNWRNAL-DZXKJOIRSA-N	0	3	329.419	3.134	20	30		EGEDHN
C#CCN1CCC2(CO[C@@H](CNC(=O)[C@@H](CCCC)C(C)C)C2)CC1	ZINC001754632052	1440648124	/nfs/dbraw/zinc/64/81/24/1440648124.db2.gz	ISKZYGSXRCGVFU-MOPGFXCFSA-N	0	3	348.531	3.069	20	30		EGEDHN
C#CCN(C(=O)[C@H](C)CC)C1CCN(Cc2cccc(OC)c2)CC1	ZINC001754633390	1440648260	/nfs/dbraw/zinc/64/82/60/1440648260.db2.gz	WEGRXVOMFWUGLT-QGZVFWFLSA-N	0	3	342.483	3.168	20	30		EGEDHN
CC(C)(C)C#CC(=O)NC[C@@]1(C)CCCN(CCOCC2CCC2)C1	ZINC001754726900	1440676797	/nfs/dbraw/zinc/67/67/97/1440676797.db2.gz	ITYRGJVSUNINFF-OAQYLSRUSA-N	0	3	348.531	3.071	20	30		EGEDHN
CC#CCN1CCC[C@](C)(CNC(=O)[C@H](CC)c2c(C)noc2C)C1	ZINC001754732082	1440680153	/nfs/dbraw/zinc/68/01/53/1440680153.db2.gz	NDUYILINRCTXCB-YLJYHZDGSA-N	0	3	345.487	3.027	20	30		EGEDHN
CC#CCN1CCC[C@](C)(CNC(=O)CCCOc2ccccc2)C1	ZINC001754733244	1440680779	/nfs/dbraw/zinc/68/07/79/1440680779.db2.gz	KLUJMDWGYVKXTO-OAQYLSRUSA-N	0	3	342.483	3.087	20	30		EGEDHN
CC#CCN1CCC[C@@](C)(CNC(=O)CCCOc2ccccc2)C1	ZINC001754733243	1440680896	/nfs/dbraw/zinc/68/08/96/1440680896.db2.gz	KLUJMDWGYVKXTO-NRFANRHFSA-N	0	3	342.483	3.087	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)[C@H](C)OCCCC)C2)CC1	ZINC001754782989	1440686952	/nfs/dbraw/zinc/68/69/52/1440686952.db2.gz	IHDJZAMWYJBCSS-ICSRJNTNSA-N	0	3	348.531	3.166	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H]([C@@H](C)NCc3nc(C)oc3C)C2)CCC1	ZINC001754800318	1440690287	/nfs/dbraw/zinc/69/02/87/1440690287.db2.gz	TVBVEHZECAWUHT-RHSMWYFYSA-N	0	3	345.487	3.364	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@]1(CO)CCCN([C@H](C)c2ccccc2)C1	ZINC001754856612	1440700477	/nfs/dbraw/zinc/70/04/77/1440700477.db2.gz	NWYGZCANBXVJPI-UTKZUKDTSA-N	0	3	344.499	3.293	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H]2[C@@H]1CCN2CCOc1cccc(F)c1	ZINC001754864533	1440702219	/nfs/dbraw/zinc/70/22/19/1440702219.db2.gz	XHDDYNWZAUHMRQ-OALUTQOASA-N	0	3	346.446	3.236	20	30		EGEDHN
CC(C)C#CC(=O)N1CCC[C@@H]2[C@H]1CCN2CCCCC(F)(F)F	ZINC001754864829	1440702410	/nfs/dbraw/zinc/70/24/10/1440702410.db2.gz	DTSHLBUIHFVLGH-HZPDHXFCSA-N	0	3	344.421	3.444	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1cccc(C#N)c1	ZINC001754867148	1440703472	/nfs/dbraw/zinc/70/34/72/1440703472.db2.gz	HCCXSWACKOLMRI-NHCUHLMSSA-N	0	3	349.478	3.317	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCN(C(=O)Cc2ccc3c(c2)CCC3)C1	ZINC001754940990	1440711770	/nfs/dbraw/zinc/71/17/70/1440711770.db2.gz	BFJPGYGFCGMITG-INIZCTEOSA-N	0	3	346.902	3.299	20	30		EGEDHN
COCC#CCN[C@@H](C)c1ccc(CNC(=O)[C@@H](C)C(C)(C)C)cc1	ZINC001754947299	1440713739	/nfs/dbraw/zinc/71/37/39/1440713739.db2.gz	JEOGFPZPKDRCMD-SJORKVTESA-N	0	3	344.499	3.285	20	30		EGEDHN
CC#CCN[C@H](C)c1ccc(CNC(=O)c2scnc2C)cc1	ZINC001754954194	1440715912	/nfs/dbraw/zinc/71/59/12/1440715912.db2.gz	NMYJMXVBQAVPSP-CYBMUJFWSA-N	0	3	327.453	3.055	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCC1(NCc2cc(Cl)cc(Cl)c2)CCC1	ZINC001754978876	1440720810	/nfs/dbraw/zinc/72/08/10/1440720810.db2.gz	VJPUCMYRSVOZAI-NSHDSACASA-N	0	3	340.254	3.282	20	30		EGEDHN
CC#CCNC[C@H]1CN(C(=O)[C@H](CCC)CC2CCCCC2)CCO1	ZINC001755009655	1440725868	/nfs/dbraw/zinc/72/58/68/1440725868.db2.gz	PCYGTNJCKKFCTA-UXHICEINSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=C(C)CCN1CCN([C@@H]2CCN(C(=O)[C@@H](C)C(CC)CC)C2)CC1	ZINC001755019976	1440726474	/nfs/dbraw/zinc/72/64/74/1440726474.db2.gz	VTBCDEZDHYGNRD-AZUAARDMSA-N	0	3	349.563	3.243	20	30		EGEDHN
CC#CCN(C)CCCN(C)C(=O)Cc1coc2cc(C)ccc12	ZINC001755045438	1440740483	/nfs/dbraw/zinc/74/04/83/1440740483.db2.gz	VLKVVXLYFUBUOO-UHFFFAOYSA-N	0	3	326.440	3.087	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC(CC)(NCc3cnns3)CC2)CC1	ZINC001755072856	1440747194	/nfs/dbraw/zinc/74/71/94/1440747194.db2.gz	WDIADQXRHZCTBR-UHFFFAOYSA-N	0	3	348.516	3.145	20	30		EGEDHN
Cc1cccc(Cl)c1CN[C@H]1CN(C(=O)C#CC(C)C)C[C@H]1C	ZINC001755108367	1440754006	/nfs/dbraw/zinc/75/40/06/1440754006.db2.gz	DPGQEGUJHFXWAO-QAPCUYQASA-N	0	3	332.875	3.244	20	30		EGEDHN
CC#CCCCC(=O)N1CCC(C)(NCc2csc(C)n2)CC1	ZINC001755131487	1440757238	/nfs/dbraw/zinc/75/72/38/1440757238.db2.gz	JYRKEGQXYUFZON-UHFFFAOYSA-N	0	3	333.501	3.116	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)[C@H](c2cccnc2)C(C)C)C(C)(C)C1	ZINC001755141651	1440760760	/nfs/dbraw/zinc/76/07/60/1440760760.db2.gz	IUTNTNCWBOCNKW-MSOLQXFVSA-N	0	3	329.488	3.224	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)[C@@H](CC)Oc2ccccc2F)C(C)(C)C1	ZINC001755143941	1440762342	/nfs/dbraw/zinc/76/23/42/1440762342.db2.gz	SKEGAGTWDBMGCR-AEFFLSMTSA-N	0	3	348.462	3.386	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCN1C(=O)c1cc(F)c2ncccc2c1	ZINC001755209234	1440782715	/nfs/dbraw/zinc/78/27/15/1440782715.db2.gz	LCQGCULYKPHVGY-MRXNPFEDSA-N	0	3	327.403	3.096	20	30		EGEDHN
C=C(Cl)CNCC1CC(NC(=O)C[C@H](C)c2c(C)noc2C)C1	ZINC001755213615	1440783729	/nfs/dbraw/zinc/78/37/29/1440783729.db2.gz	NLTHIGNAWHROOQ-ISAOAKOHSA-N	0	3	339.867	3.022	20	30		EGEDHN
C=CCC1(C(=O)NC2CC(CNCc3oc(C)nc3C)C2)CCCC1	ZINC001755223899	1440785228	/nfs/dbraw/zinc/78/52/28/1440785228.db2.gz	ONVQTDYNCMUSSO-UHFFFAOYSA-N	0	3	345.487	3.412	20	30		EGEDHN
CC(C)c1cccc(CN[C@H](C)[C@H](C)NC(=O)C#CC(C)(C)C)n1	ZINC001755251596	1440791925	/nfs/dbraw/zinc/79/19/25/1440791925.db2.gz	FPFYWMZEDWRIGU-CVEARBPZSA-N	0	3	329.488	3.237	20	30		EGEDHN
Cc1cc(F)cc(C(=O)N[C@H](C)[C@@H](C)NCc2ccc(C#N)s2)c1	ZINC001755256448	1440793346	/nfs/dbraw/zinc/79/33/46/1440793346.db2.gz	KCCQTQLDXFTRNZ-CHWSQXEVSA-N	0	3	345.443	3.364	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)c1ccnc(C2CC2)c1	ZINC001755283559	1440801238	/nfs/dbraw/zinc/80/12/38/1440801238.db2.gz	PXTDKYXKPVETSS-UHFFFAOYSA-N	0	3	335.879	3.399	20	30		EGEDHN
Cc1cc(C)c(C(=O)NC[C@@H](C)N(C)Cc2cccc(C#N)c2)o1	ZINC001755298460	1440807500	/nfs/dbraw/zinc/80/75/00/1440807500.db2.gz	RPTOFQPRGBLFNA-CQSZACIVSA-N	0	3	325.412	3.018	20	30		EGEDHN
COc1cccc([C@@H](C)N(C)[C@H](C)CNC(=O)C#CC(C)(C)C)c1	ZINC001755299327	1440807986	/nfs/dbraw/zinc/80/79/86/1440807986.db2.gz	AIGPZWNSRPFFSU-HZPDHXFCSA-N	0	3	330.472	3.242	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@H](C)N(C)Cc2ccccc2C2CC2)c1	ZINC001755315563	1440815587	/nfs/dbraw/zinc/81/55/87/1440815587.db2.gz	SCGFUVPDRJEXAE-INIZCTEOSA-N	0	3	347.462	3.191	20	30		EGEDHN
C[C@@H](CNC(=O)[C@H]1CC12CCCC2)N(C)Cc1cccc(C#N)c1	ZINC001755324400	1440820740	/nfs/dbraw/zinc/82/07/40/1440820740.db2.gz	MRXZNKXDKYVZMM-MAUKXSAKSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@H](CNC(=O)[C@H]1CC12CCCC2)N(C)Cc1cccc(C#N)c1	ZINC001755324398	1440820899	/nfs/dbraw/zinc/82/08/99/1440820899.db2.gz	MRXZNKXDKYVZMM-CRAIPNDOSA-N	0	3	325.456	3.075	20	30		EGEDHN
CCCC[C@@H](CNCC#CCOC)NC(=O)C1(C)CCCCCC1	ZINC001755358240	1440830647	/nfs/dbraw/zinc/83/06/47/1440830647.db2.gz	MCOXJMWWNVSVLP-SFHVURJKSA-N	0	3	336.520	3.261	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)[C@]1(C)CCc2ccccc21	ZINC001755371968	1440837344	/nfs/dbraw/zinc/83/73/44/1440837344.db2.gz	YJXLKZCPKZPOEI-DENIHFKCSA-N	0	3	338.495	3.275	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2c[nH]c(C)cc2=O)C(C)(C)C1	ZINC001755414654	1440848101	/nfs/dbraw/zinc/84/81/01/1440848101.db2.gz	AECSXKLKTKFKSY-GOSISDBHSA-N	0	3	347.503	3.094	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1CN([C@@H](C)c2ccccc2)CC1(C)C	ZINC001755416118	1440848910	/nfs/dbraw/zinc/84/89/10/1440848910.db2.gz	OYJWORAJYHTUFZ-WMZOPIPTSA-N	0	3	330.472	3.167	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@@H]1[C@H]2CN(Cc3cccc(F)c3)C[C@H]21	ZINC001755424314	1440850263	/nfs/dbraw/zinc/85/02/63/1440850263.db2.gz	YFUJCVYIRLOLCG-NNZMDNLPSA-N	0	3	330.447	3.222	20	30		EGEDHN
C#CCN1C[C@]2(C)CN(C(=O)C3(CC=C)CCCCC3)C[C@]2(C)C1	ZINC001755461210	1440857575	/nfs/dbraw/zinc/85/75/75/1440857575.db2.gz	XDXAWEYGLPQEQT-BGYRXZFFSA-N	0	3	328.500	3.317	20	30		EGEDHN
C[C@H](CCCNCc1ccccc1C#N)NC(=O)[C@H]1CC=CCC1	ZINC001755487700	1440860929	/nfs/dbraw/zinc/86/09/29/1440860929.db2.gz	BCKOIZCLNBFILP-SJORKVTESA-N	0	3	325.456	3.289	20	30		EGEDHN
CN(C(=O)C=C1CCC1)[C@H](CNCc1cc(C#N)ccc1F)C1CC1	ZINC001755559093	1440874127	/nfs/dbraw/zinc/87/41/27/1440874127.db2.gz	VIRIKGQNHRPOIH-LJQANCHMSA-N	0	3	341.430	3.134	20	30		EGEDHN
Cc1cc(C)c(C(=O)N(C)C[C@H](C)NCC#Cc2ccccc2)s1	ZINC001755588581	1440880898	/nfs/dbraw/zinc/88/08/98/1440880898.db2.gz	BQPKLWXPUMIPFC-INIZCTEOSA-N	0	3	340.492	3.467	20	30		EGEDHN
C[C@@H](C(=O)N(C)C[C@H](C)NCc1ccc(C#N)c(F)c1)C(C)(C)C	ZINC001755592253	1440881552	/nfs/dbraw/zinc/88/15/52/1440881552.db2.gz	BAKTUSSVOXTSDP-KBPBESRZSA-N	0	3	333.451	3.316	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H](CO)N[C@H](C)c1cc(C)ccc1C	ZINC001755635466	1440890764	/nfs/dbraw/zinc/89/07/64/1440890764.db2.gz	YDVWTZBIQPYFGR-SJORKVTESA-N	0	3	332.488	3.033	20	30		EGEDHN
C[C@@H]1[C@@H](NCC#Cc2ccc(F)cc2)CCN1C(=O)CCCC1CC1	ZINC001755659317	1440892522	/nfs/dbraw/zinc/89/25/22/1440892522.db2.gz	QPCYBTWXFRHVCM-UZLBHIALSA-N	0	3	342.458	3.337	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1CCCN(CCn2nc(C)cc2C)[C@H]1C	ZINC001755720025	1440906844	/nfs/dbraw/zinc/90/68/44/1440906844.db2.gz	CDDLAHCCSJAKHA-ROUUACIJSA-N	0	3	346.519	3.071	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)CCc2cc(F)ccc2F)[C@H]1C	ZINC001755722238	1440907970	/nfs/dbraw/zinc/90/79/70/1440907970.db2.gz	GVITVCYTMNZZGK-RDTXWAMCSA-N	0	3	336.426	3.443	20	30		EGEDHN
C=CCN1CCC[C@@H](NC(=O)CCCc2ccc(OC)cc2)[C@@H]1C	ZINC001755723548	1440908613	/nfs/dbraw/zinc/90/86/13/1440908613.db2.gz	RJBUUEYOIIZFSZ-QFBILLFUSA-N	0	3	330.472	3.173	20	30		EGEDHN
CCCCC(=O)N1C[C@@H](NCc2ccc(C#N)c(F)c2)C(C)(C)C1	ZINC001755750896	1440913306	/nfs/dbraw/zinc/91/33/06/1440913306.db2.gz	CUUPUKNCBGHWOL-QGZVFWFLSA-N	0	3	331.435	3.214	20	30		EGEDHN
CC/C(C)=C/C(=O)N1C[C@H](NCc2ccc(F)c(C#N)c2)C(C)(C)C1	ZINC001755759154	1440914632	/nfs/dbraw/zinc/91/46/32/1440914632.db2.gz	LNTUGFOMFWWUJF-QKAYDNCFSA-N	0	3	343.446	3.380	20	30		EGEDHN
CC[C@H](C)C(=O)N[C@@H](CNCc1cc(C#N)ccc1OC)C(C)(C)C	ZINC001755818591	1440924952	/nfs/dbraw/zinc/92/49/52/1440924952.db2.gz	OVGBEKXBAPAFIG-KSSFIOAISA-N	0	3	345.487	3.233	20	30		EGEDHN
C=C(Cl)CNC[C@H](NC(=O)c1nncc2ccccc21)C(C)(C)C	ZINC001755826919	1440927485	/nfs/dbraw/zinc/92/74/85/1440927485.db2.gz	AFIKSLMMVJUPHX-HNNXBMFYSA-N	0	3	346.862	3.116	20	30		EGEDHN
CC[C@@H](F)CN1CCC([C@@H](C)NC(=O)CC#Cc2ccccc2)CC1	ZINC001755845428	1440933102	/nfs/dbraw/zinc/93/31/02/1440933102.db2.gz	JLWPYGANGAKTMV-YLJYHZDGSA-N	0	3	344.474	3.393	20	30		EGEDHN
C#CCN1CCC([C@@H](C)NC(=O)COc2ccccc2C(C)C)CC1	ZINC001755846354	1440933507	/nfs/dbraw/zinc/93/35/07/1440933507.db2.gz	WIHPLXQGUBMFLI-QGZVFWFLSA-N	0	3	342.483	3.039	20	30		EGEDHN
C#CCN1CCC([C@H](C)NC(=O)[C@H](C)CCc2ccc(F)cc2)CC1	ZINC001755848857	1440934214	/nfs/dbraw/zinc/93/42/14/1440934214.db2.gz	NIYPBPQSBVDXBI-SJORKVTESA-N	0	3	344.474	3.244	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N(C)C1CC(NCc2ccc(C#N)cc2F)C1	ZINC001755858320	1440936184	/nfs/dbraw/zinc/93/61/84/1440936184.db2.gz	YAILEFLLYXEDLF-UHFFFAOYSA-N	0	3	345.462	3.459	20	30		EGEDHN
CC#CCN1CCC(C2(NC(=O)[C@@H](C)c3cccc(F)c3)CC2)CC1	ZINC001755869578	1440938813	/nfs/dbraw/zinc/93/88/13/1440938813.db2.gz	KOKMHYICYOZWEX-INIZCTEOSA-N	0	3	342.458	3.313	20	30		EGEDHN
C=C(Cl)Cn1c(N2C[C@@H](C)N(CC)C[C@H]2C)nnc1C(C)(C)C	ZINC001760386498	1441368152	/nfs/dbraw/zinc/36/81/52/1441368152.db2.gz	AOISMKXXZOMBOU-ZIAGYGMSSA-N	0	3	339.915	3.247	20	30		EGEDHN
C=CC[C@@H]1CCCC[C@@H]1[NH2+]CCCOc1ccc(-c2nn[n-]n2)cc1	ZINC001573329712	947424793	/nfs/dbraw/zinc/42/47/93/947424793.db2.gz	NQAVYFCZRZPWFY-QAPCUYQASA-N	0	3	341.459	3.360	20	30		EGEDHN
C[C@H](CN1CCC[C@@H](C)C1)NC(=O)N[C@@H](C)c1ccc(C#N)cc1	ZINC000056787925	214388789	/nfs/dbraw/zinc/38/87/89/214388789.db2.gz	BZMOXYUCTLPWKW-OAGGEKHMSA-N	0	3	328.460	3.039	20	30		EGEDHN
Cc1ccccc1[C@@H](CN1CCOCC1)NCc1cccc(C#N)c1	ZINC000183343752	235019334	/nfs/dbraw/zinc/01/93/34/235019334.db2.gz	DZNXZIGCVDQKHD-OAQYLSRUSA-N	0	3	335.451	3.030	20	30		EGEDHN
COC[C@H](NC[C@@H](O)c1ccc(C#N)cc1)c1ccc(Cl)cc1	ZINC000193668980	240255939	/nfs/dbraw/zinc/25/59/39/240255939.db2.gz	KCFYXRWPXGNUSI-ZWKOTPCHSA-N	0	3	330.815	3.222	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)Nc1ccccc1NC1CCN(C)CC1	ZINC000264040309	246005558	/nfs/dbraw/zinc/00/55/58/246005558.db2.gz	BXOCZEQKFKYHHE-HNNXBMFYSA-N	0	3	331.460	3.112	20	30		EGEDHN
C[C@H](O)CN(CC(=O)Nc1cc(Cl)ccc1C#N)C1CCCCC1	ZINC000264201349	246174725	/nfs/dbraw/zinc/17/47/25/246174725.db2.gz	PPKGRUUUWFXBIZ-ZDUSSCGKSA-N	0	3	349.862	3.166	20	30		EGEDHN
CN(C)CCN(Cc1cccs1)C(=O)Nc1cccc(C#N)c1	ZINC000084070424	217572161	/nfs/dbraw/zinc/57/21/61/217572161.db2.gz	FVGVGPSAFLLQBF-UHFFFAOYSA-N	0	3	328.441	3.215	20	30		EGEDHN
COCCN1CCC(Nc2c(C#N)cnc3c(C)cc(F)cc32)CC1	ZINC000266422757	248293679	/nfs/dbraw/zinc/29/36/79/248293679.db2.gz	SHLJGYHZBDDEAB-UHFFFAOYSA-N	0	3	342.418	3.077	20	30		EGEDHN
C[C@H](c1ccc(C#N)cc1)N1CCC[C@H](C(=O)Nc2ccccn2)C1	ZINC000377719546	169066941	/nfs/dbraw/zinc/06/69/41/169066941.db2.gz	LQYJTKUHLFVECX-QAPCUYQASA-N	0	3	334.423	3.365	20	30		EGEDHN
C[C@H](NC[C@H](O)c1ccc(C#N)cc1)c1ccc(NC(=O)C2CC2)cc1	ZINC000268573822	252035587	/nfs/dbraw/zinc/03/55/87/252035587.db2.gz	BFASBMQRIKYCKB-XOBRGWDASA-N	0	3	349.434	3.291	20	30		EGEDHN
C[C@@H](NC[C@H](O)c1ccc(C#N)cc1)c1ccc(NC(=O)C2CC2)cc1	ZINC000268573818	252035681	/nfs/dbraw/zinc/03/56/81/252035681.db2.gz	BFASBMQRIKYCKB-VLIAUNLRSA-N	0	3	349.434	3.291	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cccc(Oc3ccccn3)c2)CC1	ZINC000076068548	258014578	/nfs/dbraw/zinc/01/45/78/258014578.db2.gz	GFIBBDCRUPSVBD-UHFFFAOYSA-N	0	3	335.407	3.158	20	30		EGEDHN
CC(C)C[C@@H](CN[C@H](C)c1ccc(C#N)c(F)c1)N1CCOCC1	ZINC000346195509	141177651	/nfs/dbraw/zinc/17/76/51/141177651.db2.gz	OXMMLEPUKCIVFF-QAPCUYQASA-N	0	3	333.451	3.095	20	30		EGEDHN
N#Cc1ccnc(NC2CCN(CCc3ccccc3)CC2)c1Cl	ZINC000341544910	155345920	/nfs/dbraw/zinc/34/59/20/155345920.db2.gz	IAZLVPWBARLQQJ-UHFFFAOYSA-N	0	3	340.858	3.148	20	30		EGEDHN
N#Cc1cc(NC(=O)N2CCN(C3CCCCC3)CC2)ccc1F	ZINC000122108044	152389961	/nfs/dbraw/zinc/38/99/61/152389961.db2.gz	BZPMQXBSMLEQJB-UHFFFAOYSA-N	0	3	330.407	3.180	20	30		EGEDHN
Cc1ccc2nc(CNC3CCN(c4ccc(C#N)cc4)CC3)cn2c1	ZINC000341064826	155131606	/nfs/dbraw/zinc/13/16/06/155131606.db2.gz	ZRPXEGHRYQKZCI-UHFFFAOYSA-N	0	3	345.450	3.273	20	30		EGEDHN
CN(C)CCN(Cc1scnc1C1CC1)Cc1ccc(C#N)cc1	ZINC000348925823	156289167	/nfs/dbraw/zinc/28/91/67/156289167.db2.gz	YHECWXAAIOXIBR-UHFFFAOYSA-N	0	3	340.496	3.456	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)Cc1ccc(F)cc1F	ZINC000348938689	156295929	/nfs/dbraw/zinc/29/59/29/156295929.db2.gz	ZQLPRKLVTPPASL-UHFFFAOYSA-N	0	3	329.394	3.400	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)N[C@@H]1CCCC1(C)C	ZINC000079131057	161791566	/nfs/dbraw/zinc/79/15/66/161791566.db2.gz	XGWBIGKLGHMYSL-GOSISDBHSA-N	0	3	342.487	3.210	20	30		EGEDHN
N#Cc1ccc(CN2CCCN(Cc3ccc4c(c3)CCO4)CC2)cc1	ZINC000109827817	162112908	/nfs/dbraw/zinc/11/29/08/162112908.db2.gz	GWDYQTOBOMLYFH-UHFFFAOYSA-N	0	3	347.462	3.201	20	30		EGEDHN
Cc1ncsc1CN[C@@H]1CCCN(c2ccc(C#N)cc2F)C1	ZINC000344241116	164135361	/nfs/dbraw/zinc/13/53/61/164135361.db2.gz	VCKCTUVBDGIUCA-CQSZACIVSA-N	0	3	330.432	3.221	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)NC[C@H](C)N1CCC[C@H](C)C1	ZINC000352394923	165379743	/nfs/dbraw/zinc/37/97/43/165379743.db2.gz	WTVNQYCLGCVNNS-GJZGRUSLSA-N	0	3	344.459	3.199	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccc(Sc2ccccc2C#N)cc1)N(C)C	ZINC000359023773	167041146	/nfs/dbraw/zinc/04/11/46/167041146.db2.gz	ADWBIUQZBYKHJW-AWEZNQCLSA-N	0	3	339.464	3.389	20	30		EGEDHN
Cc1ccc2c(ncc(C#N)c2N(C)CCN(C)C)c1Br	ZINC000359531044	167181227	/nfs/dbraw/zinc/18/12/27/167181227.db2.gz	JQDRIGCTRRSUFX-UHFFFAOYSA-N	0	3	347.260	3.175	20	30		EGEDHN
C[C@@H](NCC(=O)N1CCCC1)c1ccc(-c2cccc(C#N)c2)cc1	ZINC000359847050	167247545	/nfs/dbraw/zinc/24/75/45/167247545.db2.gz	NUSSBRKWWQQXRA-MRXNPFEDSA-N	0	3	333.435	3.498	20	30		EGEDHN
C[C@H](C(=O)NCCCN(C)Cc1ccccc1)c1cccc(C#N)c1	ZINC000359853710	167249827	/nfs/dbraw/zinc/24/98/27/167249827.db2.gz	TZFHLRLTZCCKOF-KRWDZBQOSA-N	0	3	335.451	3.300	20	30		EGEDHN
C[C@H](C(=O)N[C@@H]1CCN(C)[C@H]1c1ccccc1)c1cccc(C#N)c1	ZINC000360393828	167319009	/nfs/dbraw/zinc/31/90/09/167319009.db2.gz	LEAGCQFXCRLMBT-BEVDRBHNSA-N	0	3	333.435	3.223	20	30		EGEDHN
C[C@H](NC1(C2CC2)CCOCC1)C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000367564647	168242532	/nfs/dbraw/zinc/24/25/32/168242532.db2.gz	IYTMALQZEGPGET-LBPRGKRZSA-N	0	3	347.846	3.087	20	30		EGEDHN
CC(C)(CO)[C@H](NCc1ccc(Br)cc1C#N)C1CC1	ZINC000293042497	270042440	/nfs/dbraw/zinc/04/24/40/270042440.db2.gz	MFJYRPWIYKFEMO-OAHLLOKOSA-N	0	3	337.261	3.207	20	30		EGEDHN
N#Cc1ccc(CN[C@@H](c2ccccc2)C2(CO)CCOCC2)cc1	ZINC000412011267	270046515	/nfs/dbraw/zinc/04/65/15/270046515.db2.gz	TYBJVJHBIKQFII-FQEVSTJZSA-N	0	3	336.435	3.178	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN1CCC[C@@H]1c1ccccn1	ZINC000533348252	270060705	/nfs/dbraw/zinc/06/07/05/270060705.db2.gz	BRHQSVIZTYQGPL-OAHLLOKOSA-N	0	3	326.425	3.180	20	30		EGEDHN
CC1(c2ccccc2)CC(NC(=O)C(C#N)Cc2ccc(C#N)cc2)C1	ZINC000280632653	265982727	/nfs/dbraw/zinc/98/27/27/265982727.db2.gz	YXRCBLUXGAEPSG-NLMOZGTASA-N	0	3	343.430	3.477	20	30		EGEDHN
CCCC[C@H]1CCC[C@H]1NCCS(=O)(=O)c1ccc(C#N)cc1	ZINC000184696676	266039741	/nfs/dbraw/zinc/03/97/41/266039741.db2.gz	BKBZKGRWEHNJHM-FUHWJXTLSA-N	0	3	334.485	3.280	20	30		EGEDHN
CCC[C@H]1CN(c2c(C#N)cnc3ccccc32)CCN1CCOC	ZINC000301914366	266080698	/nfs/dbraw/zinc/08/06/98/266080698.db2.gz	IENQFYKEBVYPHN-KRWDZBQOSA-N	0	3	338.455	3.044	20	30		EGEDHN
CCN(CC)[C@H](CNc1ncc([N+](=O)[O-])cc1C#N)c1ccsc1	ZINC000298455782	266120094	/nfs/dbraw/zinc/12/00/94/266120094.db2.gz	JAIKUOCYXJJFKJ-OAHLLOKOSA-N	0	3	345.428	3.418	20	30		EGEDHN
CCN(CCc1cccs1)C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000279598360	266131381	/nfs/dbraw/zinc/13/13/81/266131381.db2.gz	FILJUJPGBJGVOQ-KRWDZBQOSA-N	0	3	337.448	3.393	20	30		EGEDHN
CCS[C@@H]1CCC[C@@H]1NCC(=O)Nc1cc(Cl)ccc1C#N	ZINC000286377466	266345764	/nfs/dbraw/zinc/34/57/64/266345764.db2.gz	YYGLWRIXLYJPKK-DZGCQCFKSA-N	0	3	337.876	3.414	20	30		EGEDHN
CCS[C@@H]1CCC[C@H](NC(=O)C(C#N)Cc2ccc(C#N)cc2)C1	ZINC000280351221	266346724	/nfs/dbraw/zinc/34/67/24/266346724.db2.gz	IIOXSENDFJTKAD-FGTMMUONSA-N	0	3	341.480	3.421	20	30		EGEDHN
CC[C@@H](C)[C@@H](CNCc1cn(C)nc1-c1ccc(C#N)cc1)OC	ZINC000294915661	266366185	/nfs/dbraw/zinc/36/61/85/266366185.db2.gz	YHYWDEBZADFEOG-RDTXWAMCSA-N	0	3	326.444	3.109	20	30		EGEDHN
C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCN2[C@@H](C(N)=O)c2ccc(C#N)cc2)C1	ZINC000331918317	267032302	/nfs/dbraw/zinc/03/23/02/267032302.db2.gz	LKTPIFUBTJCJJQ-HWDJUHOGSA-N	0	3	341.455	3.396	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)C(C#N)Cc2ccc(C#N)cc2)c2ccccc2O1	ZINC000295375349	267080039	/nfs/dbraw/zinc/08/00/39/267080039.db2.gz	DVJPRHMKQOSDPM-LSBZLQRGSA-N	0	3	345.402	3.269	20	30		EGEDHN
CCO[C@@H]1CCN(Cc2cn(C)nc2-c2ccc(C#N)cc2)C[C@H]1C	ZINC000449500267	267148358	/nfs/dbraw/zinc/14/83/58/267148358.db2.gz	MVRRDXIZZBHXDQ-DNVCBOLYSA-N	0	3	338.455	3.206	20	30		EGEDHN
CC[C@@H](N[C@H]1CC(=O)N(c2cccc(OC)c2)C1)c1ccc(C#N)cc1	ZINC000521536257	267197536	/nfs/dbraw/zinc/19/75/36/267197536.db2.gz	OABGXSLRXNFOMS-FXAWDEMLSA-N	0	3	349.434	3.413	20	30		EGEDHN
C[C@H]1CN(CCC2CCN(c3ccc(F)cc3C#N)CC2)C[C@H](C)O1	ZINC000301511619	267229496	/nfs/dbraw/zinc/22/94/96/267229496.db2.gz	ATKSRUFCNSPHBD-HOTGVXAUSA-N	0	3	345.462	3.413	20	30		EGEDHN
CN(C)CC(C)(C)NC(=O)c1cccc(Nc2ccc(C#N)cc2)c1	ZINC000457202324	267279342	/nfs/dbraw/zinc/27/93/42/267279342.db2.gz	GYZBMIQGKRZYGV-UHFFFAOYSA-N	0	3	336.439	3.372	20	30		EGEDHN
CN(C)CCOc1ccc(NC(=O)C2(c3cccc(C#N)c3)CC2)cc1	ZINC000435039840	267280593	/nfs/dbraw/zinc/28/05/93/267280593.db2.gz	BAQNJPUVLOPRHQ-UHFFFAOYSA-N	0	3	349.434	3.169	20	30		EGEDHN
CN(C)Cc1ccc(-c2noc(CCc3ccc(C#N)cc3)n2)cc1	ZINC000531348244	267282276	/nfs/dbraw/zinc/28/22/76/267282276.db2.gz	TWYOEMJMTBGNEA-UHFFFAOYSA-N	0	3	332.407	3.455	20	30		EGEDHN
CN(C)C[C@@H](NC(=O)/C=C/c1cccc(C#N)c1)c1ccc(F)cc1	ZINC000493001817	267282321	/nfs/dbraw/zinc/28/23/21/267282321.db2.gz	CRUDOVGHQKAIIN-SSGOSMAHSA-N	0	3	337.398	3.130	20	30		EGEDHN
CN1CC=C(CNC(=O)c2ccccc2Oc2ccccc2C#N)CC1	ZINC000483027674	267332247	/nfs/dbraw/zinc/33/22/47/267332247.db2.gz	WZCZLEGSEGWVJB-UHFFFAOYSA-N	0	3	347.418	3.342	20	30		EGEDHN
COC(=O)[C@](C)(CN[C@H](C)c1ccc(C#N)cc1)c1ccc(F)cc1	ZINC000447030132	267392767	/nfs/dbraw/zinc/39/27/67/267392767.db2.gz	TZAOJIBUISTFSL-JLTOFOAXSA-N	0	3	340.398	3.479	20	30		EGEDHN
Cc1ccc([C@H](CNc2cc(N)c([N+](=O)[O-])c(C#N)c2)N(C)C)cc1	ZINC000283792812	267444892	/nfs/dbraw/zinc/44/48/92/267444892.db2.gz	SICXCLHSOQRZJH-KRWDZBQOSA-N	0	3	339.399	3.072	20	30		EGEDHN
N#Cc1ccc(CC(=O)NC[C@H](c2ccccc2)N2CCCC2)cc1	ZINC000194840006	268056564	/nfs/dbraw/zinc/05/65/64/268056564.db2.gz	FDMIZYXGSXZUIL-HXUWFJFHSA-N	0	3	333.435	3.054	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@@H]2CCOc3ccc(F)cc32)cc1	ZINC000280597112	268092223	/nfs/dbraw/zinc/09/22/23/268092223.db2.gz	WYLVKYLUFROSNH-CRAIPNDOSA-N	0	3	349.365	3.020	20	30		EGEDHN
N#Cc1ccc(NC(=O)N2CCN(C3CCCCC3)CC2)cc1F	ZINC000332451411	268145175	/nfs/dbraw/zinc/14/51/75/268145175.db2.gz	GIZHBSHRMFRKJQ-UHFFFAOYSA-N	0	3	330.407	3.180	20	30		EGEDHN
N#Cc1c2c(cnc1N1C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C1)CCC2	ZINC000425278310	268169314	/nfs/dbraw/zinc/16/93/14/268169314.db2.gz	SNJYFOIZZOHWAC-GHTZIAJQSA-N	0	3	344.462	3.153	20	30		EGEDHN
N#Cc1cc(NC(=O)N2CCCNCC2)ccc1Oc1ccccc1	ZINC000415534902	268187574	/nfs/dbraw/zinc/18/75/74/268187574.db2.gz	KODSUDSPGARQDU-UHFFFAOYSA-N	0	3	336.395	3.178	20	30		EGEDHN
N#Cc1cccc(N2CCN(Cc3cccc4ccccc43)CC2)n1	ZINC000301289968	268261871	/nfs/dbraw/zinc/26/18/71/268261871.db2.gz	SYYBAUDDMHPYHD-UHFFFAOYSA-N	0	3	328.419	3.429	20	30		EGEDHN
N#Cc1cccc(/C=C\C(=O)NC2CCN(Cc3ccccc3)CC2)c1	ZINC000490575496	268268450	/nfs/dbraw/zinc/26/84/50/268268450.db2.gz	IRKHBOLGLHSVOU-KTKRTIGZSA-N	0	3	345.446	3.352	20	30		EGEDHN
N#Cc1ccccc1OC[C@H](O)CN1CCC[C@H](c2ccccc2)C1	ZINC000528513462	268299624	/nfs/dbraw/zinc/29/96/24/268299624.db2.gz	UCLRACDKOGSRIA-VQTJNVASSA-N	0	3	336.435	3.178	20	30		EGEDHN
C=CCN1C(=O)c2ccccc2NC12CCN(c1ccncc1)CC2	ZINC000298791280	273485008	/nfs/dbraw/zinc/48/50/08/273485008.db2.gz	RZPRDSRIGPLRNF-UHFFFAOYSA-N	0	3	334.423	3.132	20	30		EGEDHN
CCC1(CC)[C@H](N[C@@H](C)C(=O)Nc2ccccc2C#N)[C@H](C)[C@@H]1OC	ZINC000179794387	275963045	/nfs/dbraw/zinc/96/30/45/275963045.db2.gz	IWGZCTNEZVNCDP-ZZCKCESHSA-N	0	3	343.471	3.315	20	30		EGEDHN
CC(C)(CO)[C@@H](NCCOc1ccc(C#N)cc1)c1cccs1	ZINC000289264353	276313170	/nfs/dbraw/zinc/31/31/70/276313170.db2.gz	DIZKTWGHCIKXHW-KRWDZBQOSA-N	0	3	330.453	3.348	20	30		EGEDHN
Cc1ccccc1[C@@H]1CCN([C@@H]2CCN(c3ccc(C#N)cc3)C2=O)C1	ZINC000337696852	281367492	/nfs/dbraw/zinc/36/74/92/281367492.db2.gz	TVEKJRDYCHXVTF-WIYYLYMNSA-N	0	3	345.446	3.462	20	30		EGEDHN
CCC1(CC)[C@H](N[C@H](C)C(=O)Nc2oc(C)c(C)c2C#N)C[C@H]1OC	ZINC000248837886	308012779	/nfs/dbraw/zinc/01/27/79/308012779.db2.gz	OLLNPMLZXLWQKI-DAXOMENPSA-N	0	3	347.459	3.278	20	30		EGEDHN
C[C@@H](NCCN1CCN(c2ccccc2)CC1)c1cccc(C#N)c1	ZINC000539500035	314318144	/nfs/dbraw/zinc/31/81/44/314318144.db2.gz	OWZULNBTZQUPIC-GOSISDBHSA-N	0	3	334.467	3.031	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@H](N[C@H]3CCc4ccc(F)cc43)C2=O)cc1	ZINC000541881666	314501174	/nfs/dbraw/zinc/50/11/74/314501174.db2.gz	YKKGFOFOEHQMAJ-PMACEKPBSA-N	0	3	349.409	3.470	20	30		EGEDHN
Cc1cc(C#N)cnc1C(=O)NC1CCN([C@@H](C)c2ccccc2)CC1	ZINC000551210300	315145249	/nfs/dbraw/zinc/14/52/49/315145249.db2.gz	CGYOIFVTSIDDCP-INIZCTEOSA-N	0	3	348.450	3.217	20	30		EGEDHN
Cc1cc(CNC[C@@H](O)COc2ccc(C#N)cc2)ccc1Cl	ZINC000564792357	316206706	/nfs/dbraw/zinc/20/67/06/316206706.db2.gz	JEJPUUICMJRLPO-MRXNPFEDSA-N	0	3	330.815	3.050	20	30		EGEDHN
N#Cc1ccc(CN2CCC(NCc3cnc(C4CC4)o3)CC2)cc1	ZINC000565932487	316389742	/nfs/dbraw/zinc/38/97/42/316389742.db2.gz	RNRXMLWHCWZUSE-UHFFFAOYSA-N	0	3	336.439	3.178	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)[C@@H]1CCN(Cc2ccccc2)C1	ZINC000570524959	317069031	/nfs/dbraw/zinc/06/90/31/317069031.db2.gz	COOAXVWRNKAMDM-GOSISDBHSA-N	0	3	349.434	3.418	20	30		EGEDHN
CCN(C[C@@H]1CCCN1CC)C(=O)C(C)(C)c1cc(F)cc(C#N)c1	ZINC000571789980	317248174	/nfs/dbraw/zinc/24/81/74/317248174.db2.gz	ZHFAWIFFXJUYLZ-SFHVURJKSA-N	0	3	345.462	3.308	20	30		EGEDHN
N#Cc1ccc(Oc2cccc(C(=O)NCCN3CCCC3)c2)cc1	ZINC000171486949	323237769	/nfs/dbraw/zinc/23/77/69/323237769.db2.gz	WIGCYIRWGLEMML-UHFFFAOYSA-N	0	3	335.407	3.176	20	30		EGEDHN
CC(C)(C)OC(=O)NC[C@@H]1CC[C@H](NCc2ccc(C#N)s2)C1	ZINC000382483518	324251988	/nfs/dbraw/zinc/25/19/88/324251988.db2.gz	YCANATOBECSGKK-OLZOCXBDSA-N	0	3	335.473	3.403	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@H]1Nc1nc2c(cc1C#N)CCC2	ZINC000389796982	324279739	/nfs/dbraw/zinc/27/97/39/324279739.db2.gz	UTWGQGPKXXLYJE-MGPUTAFESA-N	0	3	332.451	3.374	20	30		EGEDHN
C[C@H](C1CCN(C)CC1)N(C)C(=O)C(C)(C)c1cc(F)cc(C#N)c1	ZINC000580078952	325200613	/nfs/dbraw/zinc/20/06/13/325200613.db2.gz	PWUAXOFZLXBZMP-CQSZACIVSA-N	0	3	345.462	3.164	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CCC(NC(=O)Nc2cccc(C#N)n2)CC1	ZINC000581249800	325346104	/nfs/dbraw/zinc/34/61/04/325346104.db2.gz	QXDQSDRBPPBQTO-HNNXBMFYSA-N	0	3	349.438	3.300	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CCC[C@@H]1c1ccc[nH]1	ZINC000157684187	455220544	/nfs/dbraw/zinc/22/05/44/455220544.db2.gz	VLUDFZVYYLJVNO-PKOBYXMFSA-N	0	3	326.440	3.320	20	30		EGEDHN
C=CCNC(=O)[C@@H](C)N(CC)CCc1ccc(C(F)(F)F)cc1	ZINC000425532837	457588773	/nfs/dbraw/zinc/58/87/73/457588773.db2.gz	CQQRERJAWAMTEF-CYBMUJFWSA-N	0	3	328.378	3.261	20	30		EGEDHN
C=C1CCN(CCC(=O)Nc2c(C)nn(-c3ccccc3)c2C)CC1	ZINC000264515231	455228497	/nfs/dbraw/zinc/22/84/97/455228497.db2.gz	YQIFJPPLEYXLKY-UHFFFAOYSA-N	0	3	338.455	3.470	20	30		EGEDHN
CC[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)[C@@H](N)CCCC#N	ZINC000424145282	458570476	/nfs/dbraw/zinc/57/04/76/458570476.db2.gz	UPVJMAHLVBSTRC-ZFWWWQNUSA-N	0	3	342.270	3.452	20	30		EGEDHN
C[C@H](NC[C@@H](C#N)CCC#N)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000495269180	458824219	/nfs/dbraw/zinc/82/42/19/458824219.db2.gz	CKCFLNUNGTXUKC-ARFHVFGLSA-N	0	3	334.464	3.055	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2c(F)cc(Cl)cc2F)CC1	ZINC000539316897	459375896	/nfs/dbraw/zinc/37/58/96/459375896.db2.gz	JZFYANYQXZRIPM-UHFFFAOYSA-N	0	3	329.778	3.390	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCc1ccccc1CN1CCC[C@@H]1CO	ZINC000180869211	455258300	/nfs/dbraw/zinc/25/83/00/455258300.db2.gz	KIOQHKKPIOSDSO-HXUWFJFHSA-N	0	3	342.483	3.028	20	30		EGEDHN
N#Cc1ccc(OCCN2CC[C@H](Oc3cccc(F)c3)C2)cc1	ZINC000612174622	460562052	/nfs/dbraw/zinc/56/20/52/460562052.db2.gz	RAGQNKYHVJUWKL-IBGZPJMESA-N	0	3	326.371	3.229	20	30		EGEDHN
C=CCc1cc(CNCc2cccc(OC)c2O)cc(OC)c1O	ZINC000265109267	455301133	/nfs/dbraw/zinc/30/11/33/455301133.db2.gz	WEOSXQABLXUSHY-UHFFFAOYSA-N	0	3	329.396	3.133	20	30		EGEDHN
CC(=O)Nc1ccc(SCC(=O)C(C#N)c2nc(C)cs2)cc1	ZINC000007835079	453122846	/nfs/dbraw/zinc/12/28/46/453122846.db2.gz	MMGMYTIWBGTOHH-AWEZNQCLSA-N	0	3	345.449	3.379	20	30		EGEDHN
CC[C@H]([NH2+][C@H]1CCN(Cc2ccc(C#N)cc2)C1=O)c1ccccc1[O-]	ZINC000190602177	455351278	/nfs/dbraw/zinc/35/12/78/455351278.db2.gz	SQJPRLLBCWNBSK-OALUTQOASA-N	0	3	349.434	3.106	20	30		EGEDHN
C=CCOc1c(Cl)cc(CNCCN2CC=CCC2)cc1OC	ZINC000623511641	460590940	/nfs/dbraw/zinc/59/09/40/460590940.db2.gz	YVKUZAFUSBYHLN-UHFFFAOYSA-N	0	3	336.863	3.265	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@@H](C)N1CC[C@@H](c2ccccc2OC)C1	ZINC000265656392	455356918	/nfs/dbraw/zinc/35/69/18/455356918.db2.gz	PSEAQAJJCVPMFM-IAGOWNOFSA-N	0	3	328.456	3.074	20	30		EGEDHN
Cc1ccsc1[C@H](C)N[C@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000190633574	455357261	/nfs/dbraw/zinc/35/72/61/455357261.db2.gz	PJPBJESYPHCXLX-YOEHRIQHSA-N	0	3	339.464	3.380	20	30		EGEDHN
CN(CCCNC(=O)CCc1ccc(C#N)cc1)Cc1ccccc1	ZINC000010762312	453300372	/nfs/dbraw/zinc/30/03/72/453300372.db2.gz	PCFCZEZSEQZOJR-UHFFFAOYSA-N	0	3	335.451	3.129	20	30		EGEDHN
Cc1ccccc1OCCN(C)CCC(=O)Nc1cccc(C#N)c1	ZINC000026337221	453797049	/nfs/dbraw/zinc/79/70/49/453797049.db2.gz	QSXIYHRSSNLGMO-UHFFFAOYSA-N	0	3	337.423	3.206	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H](O)COc1ccc(Cl)cc1	ZINC000026329544	453797272	/nfs/dbraw/zinc/79/72/72/453797272.db2.gz	DBAPSVKSIWFMDV-QGZVFWFLSA-N	0	3	330.815	3.083	20	30		EGEDHN
CCC(CC)(NCC(=O)NCC#N)c1ccc(Cl)c(Cl)c1	ZINC000066539895	453850526	/nfs/dbraw/zinc/85/05/26/453850526.db2.gz	ZOGHWCZGYNQRLT-UHFFFAOYSA-N	0	3	328.243	3.238	20	30		EGEDHN
CC(C)[C@](C)(C#N)NC(=O)[C@@H](C)N(C)CCCCc1ccccc1	ZINC000053079766	453856333	/nfs/dbraw/zinc/85/63/33/453856333.db2.gz	BCUGBCSLRMLOKK-XLIONFOSSA-N	0	3	329.488	3.384	20	30		EGEDHN
N#Cc1ccc(SCC(=O)N[C@H]2CCN(CC3CCCC3)C2)cc1	ZINC000081290298	453856894	/nfs/dbraw/zinc/85/68/94/453856894.db2.gz	QDNAOXJOVCLHRZ-KRWDZBQOSA-N	0	3	343.496	3.031	20	30		EGEDHN
C=CCN(CCC(=O)Nc1cc(C)on1)Cc1ccc(OC)cc1	ZINC000054421538	453929842	/nfs/dbraw/zinc/92/98/42/453929842.db2.gz	PATJDSJBCRFLNI-UHFFFAOYSA-N	0	3	329.400	3.008	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCC#Cc2ccccc2)C1	ZINC000054717522	453944638	/nfs/dbraw/zinc/94/46/38/453944638.db2.gz	FTHFSPBPFIJFHF-NQIIRXRSSA-N	0	3	347.462	3.173	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)c2ccc(NC(=O)C3CC3)cc2)n1	ZINC000041520848	453969773	/nfs/dbraw/zinc/96/97/73/453969773.db2.gz	CJTPBROKHYQLLV-CQSZACIVSA-N	0	3	325.393	3.290	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(CCC(F)(F)F)CC2CC2)CC1	ZINC000084159917	453974147	/nfs/dbraw/zinc/97/41/47/453974147.db2.gz	NATCUCPUQYTAHN-UHFFFAOYSA-N	0	3	333.398	3.011	20	30		EGEDHN
N#Cc1csc(C(=O)NCC2CCN(Cc3cccs3)CC2)c1	ZINC000084183752	453975619	/nfs/dbraw/zinc/97/56/19/453975619.db2.gz	HTZBSEYPZXOCND-UHFFFAOYSA-N	0	3	345.493	3.323	20	30		EGEDHN
C=C(C)COc1cc(CNCC2(C(=O)OC)CCCC2)ccc1OC	ZINC000612403768	460621468	/nfs/dbraw/zinc/62/14/68/460621468.db2.gz	BUBVWOXOPXBWCY-UHFFFAOYSA-N	0	3	347.455	3.473	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cccc(Oc3nccs3)c2)CC1	ZINC000076593073	454018281	/nfs/dbraw/zinc/01/82/81/454018281.db2.gz	XUOYGICISOKMSP-UHFFFAOYSA-N	0	3	343.452	3.316	20	30		EGEDHN
C=CCOc1ccc(C(=O)NC[C@H](C)N2CCCC[C@H]2C)cc1OC	ZINC000043085351	454040656	/nfs/dbraw/zinc/04/06/56/454040656.db2.gz	AXVGANKSELAAAK-CVEARBPZSA-N	0	3	346.471	3.253	20	30		EGEDHN
CC(C)CCSCC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000056413087	454057659	/nfs/dbraw/zinc/05/76/59/454057659.db2.gz	FMNUQKKWLQVCGM-UHFFFAOYSA-N	0	3	347.528	3.228	20	30		EGEDHN
C=CCN(CC=C)C(=O)Nc1ccc(N2CCN(CC)CC2)cc1C	ZINC000043523204	454066305	/nfs/dbraw/zinc/06/63/05/454066305.db2.gz	DKVPOKPQQIKCIY-UHFFFAOYSA-N	0	3	342.487	3.343	20	30		EGEDHN
COc1ccccc1CN[C@H]1CCCN(c2ccc(C#N)cc2F)C1	ZINC000068991421	454070966	/nfs/dbraw/zinc/07/09/66/454070966.db2.gz	QQHUTVAYAQOVGV-KRWDZBQOSA-N	0	3	339.414	3.465	20	30		EGEDHN
C=CCN(Cc1ccccc1)C[C@H](O)COc1ccc(CC#N)cc1	ZINC000045821986	454186227	/nfs/dbraw/zinc/18/62/27/454186227.db2.gz	NZLBQWPRAINCFG-FQEVSTJZSA-N	0	3	336.435	3.181	20	30		EGEDHN
C=CCCS(=O)(=O)NCc1ccccc1CN1CCCC[C@H]1C	ZINC000119680647	454213173	/nfs/dbraw/zinc/21/31/73/454213173.db2.gz	UHFKPUDKJROMMM-MRXNPFEDSA-N	0	3	336.501	3.057	20	30		EGEDHN
N#CC(C(=O)[C@@H]1CCCN(C(=O)C2CC2)C1)c1ccc2ccccc2n1	ZINC000089873127	454222635	/nfs/dbraw/zinc/22/26/35/454222635.db2.gz	RGTXGXKAEROICO-SJORKVTESA-N	0	3	347.418	3.060	20	30		EGEDHN
CC[C@@H](NC[C@@H](O)c1ccc(C#N)cc1)c1ccc2c(c1)OCCO2	ZINC000095984563	454250941	/nfs/dbraw/zinc/25/09/41/454250941.db2.gz	LNMLDUQBCZYEMI-QZTJIDSGSA-N	0	3	338.407	3.104	20	30		EGEDHN
C[C@H](NCCOc1ccc(C#N)cc1)c1ccc([S@](C)=O)cc1	ZINC000090107609	454281045	/nfs/dbraw/zinc/28/10/45/454281045.db2.gz	NKHOGFCOSPWDQP-LFVRLGFBSA-N	0	3	328.437	3.025	20	30		EGEDHN
CN(CCC#N)C(=O)CCN1CCCC[C@H]1c1cc2ccccc2[nH]1	ZINC000131865362	454292861	/nfs/dbraw/zinc/29/28/61/454292861.db2.gz	YLHRRSBHRDIISB-IBGZPJMESA-N	0	3	338.455	3.457	20	30		EGEDHN
CCN(C[C@H](O)COc1ccc(C#N)cc1)[C@H](C)c1ccc(C#N)cc1	ZINC000060477415	454293646	/nfs/dbraw/zinc/29/36/46/454293646.db2.gz	HWBSDGBUQHMIDI-UZLBHIALSA-N	0	3	349.434	3.253	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2ccc(C(F)(F)F)nc2C)nc(C)n1	ZINC000078736654	454309713	/nfs/dbraw/zinc/30/97/13/454309713.db2.gz	SHTKZRHCBBUMJX-LBPRGKRZSA-N	0	3	334.301	3.306	20	30		EGEDHN
N#CC(C(=O)c1cnn(-c2ccccc2F)c1)c1nc2ccccc2[nH]1	ZINC000060766266	454313114	/nfs/dbraw/zinc/31/31/14/454313114.db2.gz	FRMDQDORCFBKKP-CYBMUJFWSA-N	0	3	345.337	3.378	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)c1ccc(F)cc1F	ZINC000047011322	454318205	/nfs/dbraw/zinc/31/82/05/454318205.db2.gz	GVJRUHWAUKKBEE-UHFFFAOYSA-N	0	3	343.377	3.040	20	30		EGEDHN
C=C(C)CN(CC)C(=O)[C@@H](C)NCC1(c2ccccc2)CCOCC1	ZINC000078873915	454330712	/nfs/dbraw/zinc/33/07/12/454330712.db2.gz	XEQNVPXXFSUDFR-GOSISDBHSA-N	0	3	344.499	3.138	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@H](C)C1	ZINC000132387708	454334338	/nfs/dbraw/zinc/33/43/38/454334338.db2.gz	MOQZOMVPZGBMTG-GGPKGHCWSA-N	0	3	344.499	3.479	20	30		EGEDHN
Cc1ccc2cc(C(=O)C(C#N)c3nnc4n3CCCCC4)ccc2n1	ZINC000097022166	454389619	/nfs/dbraw/zinc/38/96/19/454389619.db2.gz	CIVUCECDINPCFH-MRXNPFEDSA-N	0	3	345.406	3.351	20	30		EGEDHN
O=C(NCC#Cc1ccccc1)NC[C@H](c1ccccc1)N1CCCC1	ZINC000047949218	454423090	/nfs/dbraw/zinc/42/30/90/454423090.db2.gz	FDWXSWSUMAMEKO-OAQYLSRUSA-N	0	3	347.462	3.174	20	30		EGEDHN
N#CCSc1cccc(C(=O)N2CCC[C@H](N3CCCC3)C2)c1	ZINC000079533936	454432949	/nfs/dbraw/zinc/43/29/49/454432949.db2.gz	XMDMZLJWLRFIER-INIZCTEOSA-N	0	3	329.469	3.003	20	30		EGEDHN
CCC[C@H](C)N(C)CC(=O)Nc1c(C#N)c(C)c(C)n1CCCOC	ZINC000048070615	454440792	/nfs/dbraw/zinc/44/07/92/454440792.db2.gz	ZZSGFVLAUKZQNI-AWEZNQCLSA-N	0	3	348.491	3.072	20	30		EGEDHN
CN(C)C(=O)CCN(Cc1ccc(C#N)cc1)Cc1cccc(F)c1	ZINC000064248193	454470823	/nfs/dbraw/zinc/47/08/23/454470823.db2.gz	WJBWWCOJMHJODS-UHFFFAOYSA-N	0	3	339.414	3.178	20	30		EGEDHN
CCC[C@@H]1CN(CC#Cc2cccc(Cl)c2)CCN1CCOC	ZINC000121820815	454481565	/nfs/dbraw/zinc/48/15/65/454481565.db2.gz	QFCPLWSDDAHZHT-LJQANCHMSA-N	0	3	334.891	3.124	20	30		EGEDHN
CCCn1nc(C)c(C(=O)C(C#N)c2nc3ccccc3n2C)c1C	ZINC000134117867	454505042	/nfs/dbraw/zinc/50/50/42/454505042.db2.gz	XJXJDLZPDPYHEU-CQSZACIVSA-N	0	3	335.411	3.287	20	30		EGEDHN
C=C(C)COCCNCc1c(C)nn(-c2ccc(F)cc2F)c1C	ZINC000134501822	454551916	/nfs/dbraw/zinc/55/19/16/454551916.db2.gz	IZXVPGKQVGVVCZ-UHFFFAOYSA-N	0	3	335.398	3.450	20	30		EGEDHN
COc1ccccc1CC(=O)C(C#N)C(=O)Nc1ccccc1Cl	ZINC000103504479	454561092	/nfs/dbraw/zinc/56/10/92/454561092.db2.gz	LVEDIWRMUODRPY-ZDUSSCGKSA-N	0	3	342.782	3.239	20	30		EGEDHN
COc1ccc(CN(C)Cc2ccc(N(C)CCC#N)cc2)cc1O	ZINC000092405128	454562357	/nfs/dbraw/zinc/56/23/57/454562357.db2.gz	JFJKJXLJDOVYRN-UHFFFAOYSA-N	0	3	339.439	3.383	20	30		EGEDHN
CCc1ccc(C(C)(C)CN[C@H](C(N)=O)c2ccc(C#N)cc2)cc1	ZINC000080298471	454564043	/nfs/dbraw/zinc/56/40/43/454564043.db2.gz	KQWDMZODNYLZME-IBGZPJMESA-N	0	3	335.451	3.214	20	30		EGEDHN
C=C(C)COc1cc(CN2CCC[C@H](CCC(N)=O)C2)ccc1OC	ZINC000092660747	454603657	/nfs/dbraw/zinc/60/36/57/454603657.db2.gz	PWGBANYKTMYURY-MRXNPFEDSA-N	0	3	346.471	3.128	20	30		EGEDHN
COc1ccc(CN(C)CCOc2cccc(C#N)c2)cc1OC	ZINC000051454655	454624902	/nfs/dbraw/zinc/62/49/02/454624902.db2.gz	CKKDJINOEKLUBP-UHFFFAOYSA-N	0	3	326.396	3.086	20	30		EGEDHN
C[C@](C#N)(NC(=O)CN1CCC[C@@H]1CCCc1ccccc1)C1CC1	ZINC000135362384	454668826	/nfs/dbraw/zinc/66/88/26/454668826.db2.gz	BJLFWSOFGLLQDT-PZJWPPBQSA-N	0	3	339.483	3.282	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc3ccccc3c(OC)n2)CC1	ZINC000106033999	454674721	/nfs/dbraw/zinc/67/47/21/454674721.db2.gz	OQZRFIGDMLXMRH-UHFFFAOYSA-N	0	3	339.439	3.014	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C[C@@H](C)c2ccccc2OC)CC1	ZINC000106034387	454674968	/nfs/dbraw/zinc/67/49/68/454674968.db2.gz	WDWONOFDYZQPDF-MRXNPFEDSA-N	0	3	330.472	3.346	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCCc2nc3ccccc3[nH]2)CC1	ZINC000106037638	454675034	/nfs/dbraw/zinc/67/50/34/454675034.db2.gz	UDYFPFKPEVGQLM-UHFFFAOYSA-N	0	3	340.471	3.042	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H](C)Oc2cccc(Cl)c2)CC1	ZINC000106040278	454675776	/nfs/dbraw/zinc/67/57/76/454675776.db2.gz	HHSQDGJHJKPVAF-CQSZACIVSA-N	0	3	336.863	3.264	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2ccc(OCC)c(OCC)c2)CC1	ZINC000106039884	454675974	/nfs/dbraw/zinc/67/59/74/454675974.db2.gz	FEQADYJBWXWHDU-UHFFFAOYSA-N	0	3	346.471	3.254	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N(CC)Cc2ccc(OC)cc2)CC1	ZINC000106274873	454689827	/nfs/dbraw/zinc/68/98/27/454689827.db2.gz	YRCFCAGRCXIQFS-UHFFFAOYSA-N	0	3	345.487	3.267	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2ccc3nc(C)oc3c2)CC1	ZINC000106319129	454690719	/nfs/dbraw/zinc/69/07/19/454690719.db2.gz	IFKRNFANLUJZMD-UHFFFAOYSA-N	0	3	328.416	3.298	20	30		EGEDHN
C=C[C@H](C)NCc1ccc(OCc2ccc(C(=O)OC)o2)c(OC)c1	ZINC000152758235	454721527	/nfs/dbraw/zinc/72/15/27/454721527.db2.gz	LWAIDCHZQSBEKU-ZDUSSCGKSA-N	0	3	345.395	3.318	20	30		EGEDHN
N#CC(C(=O)c1ccc(Cl)c(F)c1)c1nnc2n1CCCCC2	ZINC000161985262	454743325	/nfs/dbraw/zinc/74/33/25/454743325.db2.gz	ONIVDCOWLJJVDA-NSHDSACASA-N	0	3	332.766	3.287	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccccc2SC[C@@H](C)C#N)CC1	ZINC000108241067	454790884	/nfs/dbraw/zinc/79/08/84/454790884.db2.gz	RWQCOYZYUMSDAX-HNNXBMFYSA-N	0	3	341.480	3.222	20	30		EGEDHN
CN(C)CCN(Cc1cccs1)C(=O)Nc1ccc(C#N)cc1	ZINC000176868819	454792788	/nfs/dbraw/zinc/79/27/88/454792788.db2.gz	PJJRGGGMCUNKEK-UHFFFAOYSA-N	0	3	328.441	3.215	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)s1)c1ccc(N2CCOC2=O)cc1	ZINC000176956407	454804286	/nfs/dbraw/zinc/80/42/86/454804286.db2.gz	OYXVYMWHLHHMMN-LBPRGKRZSA-N	0	3	327.409	3.427	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H](Cc2ccccc2)C2CC2)CC1	ZINC000125675208	454838688	/nfs/dbraw/zinc/83/86/88/454838688.db2.gz	MAMLHKQOXSJMPF-HXUWFJFHSA-N	0	3	341.499	3.347	20	30		EGEDHN
C=CCCOCC(=O)NC[C@H](c1cccs1)N1CCC(C)CC1	ZINC000142824341	454838882	/nfs/dbraw/zinc/83/88/82/454838882.db2.gz	OIELXLNIBDXAOC-MRXNPFEDSA-N	0	3	336.501	3.230	20	30		EGEDHN
CCC1(CC)[C@H](NCC(=O)N(CCC#N)c2ccccc2)C[C@@H]1OC	ZINC000191380947	455482276	/nfs/dbraw/zinc/48/22/76/455482276.db2.gz	NPSQTSQYDZPNEQ-MSOLQXFVSA-N	0	3	343.471	3.117	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CCC(OC(C)(C)C)CC1	ZINC000164905471	454890793	/nfs/dbraw/zinc/89/07/93/454890793.db2.gz	PQJLIAYRENGXMR-SFHVURJKSA-N	0	3	347.499	3.434	20	30		EGEDHN
CCN(CCC#N)C(=O)Nc1ccc(CCN2CCSCC2)cc1	ZINC000266981863	455487935	/nfs/dbraw/zinc/48/79/35/455487935.db2.gz	TWIISZWYBMXEBJ-UHFFFAOYSA-N	0	3	346.500	3.045	20	30		EGEDHN
C#CCOc1ccc(CNCc2ccc(OCC)c(OC)c2)cc1	ZINC000113321327	454922972	/nfs/dbraw/zinc/92/29/72/454922972.db2.gz	ZWUMJAMJOIZGEE-UHFFFAOYSA-N	0	3	325.408	3.396	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H]2CCC[C@@H](SCC)C2)CC1	ZINC000175742315	455490262	/nfs/dbraw/zinc/49/02/62/455490262.db2.gz	AOBPSFADCKIULG-HZPDHXFCSA-N	0	3	325.522	3.000	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H]2CCC[C@H](SCC)C2)CC1	ZINC000175739727	455490421	/nfs/dbraw/zinc/49/04/21/455490421.db2.gz	URWUKNBVIDDCNX-IRXDYDNUSA-N	0	3	339.549	3.390	20	30		EGEDHN
C[C@@H](O)CN(CC(=O)Nc1ccc(C#N)c(Cl)c1)C1CCCCC1	ZINC000170691564	454957777	/nfs/dbraw/zinc/95/77/77/454957777.db2.gz	GOJKQNAGFSYNRQ-CYBMUJFWSA-N	0	3	349.862	3.166	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)N[C@@H]1CCN(C2CCCC2)C1	ZINC000127456568	454966609	/nfs/dbraw/zinc/96/66/09/454966609.db2.gz	DZHJWJBMVAMWTH-OAHLLOKOSA-N	0	3	344.455	3.007	20	30		EGEDHN
C[C@H](c1ccncc1)N1CCC(NC(=O)c2cccc(CC#N)c2)CC1	ZINC000178671312	454967639	/nfs/dbraw/zinc/96/76/39/454967639.db2.gz	RDPMISCIRVFPCB-MRXNPFEDSA-N	0	3	348.450	3.103	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN[C@H](C)c1ccc(C#N)cc1	ZINC000127770847	454995647	/nfs/dbraw/zinc/99/56/47/454995647.db2.gz	FWEIGAOIQJXLEQ-UZLBHIALSA-N	0	3	336.435	3.377	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H]2C[C@@H]2c2c(F)cccc2F)CC1	ZINC000116194018	455047145	/nfs/dbraw/zinc/04/71/45/455047145.db2.gz	YDWQZSRUZKLCMA-LSDHHAIUSA-N	0	3	334.410	3.225	20	30		EGEDHN
Cc1nc(NC(=O)c2cccc(CN(C)C)c2)sc1SCC#N	ZINC000155801270	455047560	/nfs/dbraw/zinc/04/75/60/455047560.db2.gz	DJVWTGHJFDFNJR-UHFFFAOYSA-N	0	3	346.481	3.381	20	30		EGEDHN
CN(C)CCN(Cc1cccc(Cl)c1)C(=O)NCCCCC#N	ZINC000171449040	455070833	/nfs/dbraw/zinc/07/08/33/455070833.db2.gz	WKRFSUCCMPVWDP-UHFFFAOYSA-N	0	3	336.867	3.107	20	30		EGEDHN
N#Cc1ccc(CNCCOc2ccc(C(F)(F)F)cn2)s1	ZINC000152210368	455087275	/nfs/dbraw/zinc/08/72/75/455087275.db2.gz	PHLJKRMZSBZOJC-UHFFFAOYSA-N	0	3	327.331	3.202	20	30		EGEDHN
CC1CCN([C@@H](CNC(=O)NCCCCC#N)c2ccccc2)CC1	ZINC000171744084	455090988	/nfs/dbraw/zinc/09/09/88/455090988.db2.gz	ARFZWJIIIZUDPY-IBGZPJMESA-N	0	3	342.487	3.453	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(C(C)(C)C#N)cc2)CC1	ZINC000171741637	455091399	/nfs/dbraw/zinc/09/13/99/455091399.db2.gz	QMAXEGLZJDFSMR-UHFFFAOYSA-N	0	3	326.444	3.260	20	30		EGEDHN
CN(CCNCc1cn(C)nc1-c1ccc(C#N)cc1)c1ccccc1	ZINC000180045588	455122160	/nfs/dbraw/zinc/12/21/60/455122160.db2.gz	JFTDPMLBSWYEHC-UHFFFAOYSA-N	0	3	345.450	3.185	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2sc(C)nc2CC(C)C)CC1	ZINC000152503173	455128694	/nfs/dbraw/zinc/12/86/94/455128694.db2.gz	DBEAYRAEJRIGER-UHFFFAOYSA-N	0	3	335.517	3.420	20	30		EGEDHN
C[C@H](CNC(=O)c1ccc(C#N)c(Cl)c1)N(C)Cc1ccccc1	ZINC000156644855	455141270	/nfs/dbraw/zinc/14/12/70/455141270.db2.gz	KVKQLCXKORPOAC-CQSZACIVSA-N	0	3	341.842	3.462	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC2(c3cccc(Cl)c3)CC2)CC1	ZINC000172622821	455165541	/nfs/dbraw/zinc/16/55/41/455165541.db2.gz	QWLRLIRUOQDTSQ-UHFFFAOYSA-N	0	3	333.863	3.279	20	30		EGEDHN
COc1cc(C#N)ccc1OCCN(C)CCOc1ccccc1F	ZINC000157364401	455188072	/nfs/dbraw/zinc/18/80/72/455188072.db2.gz	CGHWBCQDXAMSHX-UHFFFAOYSA-N	0	3	344.386	3.096	20	30		EGEDHN
C[C@@H](CC(=O)N(C)c1ccccc1)NCc1ccc(OCC#N)cc1	ZINC000180551053	455193999	/nfs/dbraw/zinc/19/39/99/455193999.db2.gz	WIOXGEDOPPNSCK-INIZCTEOSA-N	0	3	337.423	3.120	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CNCc2ccccc2-n2ccnc2)cc1	ZINC000237598016	455197500	/nfs/dbraw/zinc/19/75/00/455197500.db2.gz	XXJWMXJTFONUML-MRXNPFEDSA-N	0	3	332.407	3.453	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1CCC[C@@H](c2ccccc2)CC1	ZINC000245406271	455288187	/nfs/dbraw/zinc/28/81/87/455288187.db2.gz	WRLHZDCVZBDOFM-IEBWSBKVSA-N	0	3	327.472	3.264	20	30		EGEDHN
CCCCCCCC(=O)NCc1ccccc1CN1CC[C@@H](O)C1	ZINC000183461833	455295739	/nfs/dbraw/zinc/29/57/39/455295739.db2.gz	UUGNUUZPFLODCE-LJQANCHMSA-N	0	3	332.488	3.230	20	30		EGEDHN
N#CCOc1ccc(CN(CCO)[C@H]2CCCc3ccccc32)cc1	ZINC000265220118	455301796	/nfs/dbraw/zinc/30/17/96/455301796.db2.gz	NGCWIMDSNZLYOL-NRFANRHFSA-N	0	3	336.435	3.461	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN(C)C[C@@H](C)c1nccs1	ZINC000183932076	455340825	/nfs/dbraw/zinc/34/08/25/455340825.db2.gz	DGGRHRRJRPTYPQ-WBVHZDCISA-N	0	3	346.496	3.347	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN[C@@H](C)c1cccc(O)c1	ZINC000181512364	455346317	/nfs/dbraw/zinc/34/63/17/455346317.db2.gz	ZYPPJIXMNPTSGR-HNAYVOBHSA-N	0	3	327.424	3.211	20	30		EGEDHN
C[C@H](c1ccccc1)[C@H](C)N[C@@H]1CCN(Cc2ccc(C#N)cc2)C1=O	ZINC000190622174	455355602	/nfs/dbraw/zinc/35/56/02/455355602.db2.gz	BHFQNSFPQNDDLZ-XGHQBKJUSA-N	0	3	347.462	3.441	20	30		EGEDHN
N#CCSCCCN1CCCC[C@@H]1CNC(=O)Nc1ccccc1	ZINC000174115008	455360857	/nfs/dbraw/zinc/36/08/57/455360857.db2.gz	FZYDGHQIRFVRIM-QGZVFWFLSA-N	0	3	346.500	3.309	20	30		EGEDHN
CCN(C)c1ccc(CNCCSCc2ccccc2C#N)cn1	ZINC000190701385	455369823	/nfs/dbraw/zinc/36/98/23/455369823.db2.gz	NQJFICJRBKJNBP-UHFFFAOYSA-N	0	3	340.496	3.432	20	30		EGEDHN
C[C@@H]1C[C@@H]1[C@@H](NCC(=O)N[C@](C)(C#N)C1CC1)c1ccc(Cl)cc1	ZINC000245874808	455390217	/nfs/dbraw/zinc/39/02/17/455390217.db2.gz	JZURBRWCTHFZNH-LWLQIGSTSA-N	0	3	345.874	3.435	20	30		EGEDHN
COc1ccc(COCCN[C@H](C)c2ccc(OCC#N)cc2)cc1	ZINC000182000344	455413046	/nfs/dbraw/zinc/41/30/46/455413046.db2.gz	SZPYPBUIGVQPDF-MRXNPFEDSA-N	0	3	340.423	3.465	20	30		EGEDHN
CN(C[C@@H]1CCCN(C)C1)C(=O)Nc1ccc(C(C)(C)C#N)cc1	ZINC000174906473	455417660	/nfs/dbraw/zinc/41/76/60/455417660.db2.gz	BRWQZXOYZUWURL-OAHLLOKOSA-N	0	3	328.460	3.293	20	30		EGEDHN
C[C@H]1C[C@@H](N(C)C(=O)Nc2ccc(C(C)(C)C#N)cc2)CCN1C	ZINC000174904574	455418199	/nfs/dbraw/zinc/41/81/99/455418199.db2.gz	WQXDLCOQJXKFFU-YOEHRIQHSA-N	0	3	328.460	3.434	20	30		EGEDHN
CN1CCC(N(Cc2ccccc2)C(=O)c2cccc(CC#N)c2)CC1	ZINC000175025194	455420422	/nfs/dbraw/zinc/42/04/22/455420422.db2.gz	ZLCUUOQRGQEGSJ-UHFFFAOYSA-N	0	3	347.462	3.489	20	30		EGEDHN
C=CCCCC(=O)NCCCCN1CCN(c2cccc(C)c2)CC1	ZINC000175285418	455434819	/nfs/dbraw/zinc/43/48/19/455434819.db2.gz	ZANKRCZAPTYMRC-UHFFFAOYSA-N	0	3	343.515	3.370	20	30		EGEDHN
CN(Cc1ccc(OCC#N)cc1)[C@H]1CCN(C(=O)OC(C)(C)C)C1	ZINC000266716579	455441875	/nfs/dbraw/zinc/44/18/75/455441875.db2.gz	IQRAAQJBIFOHIM-INIZCTEOSA-N	0	3	345.443	3.030	20	30		EGEDHN
CC(C)CN(CCN(C)C)C(=O)N[C@H](CCC#N)c1ccccc1	ZINC000160532970	455470499	/nfs/dbraw/zinc/47/04/99/455470499.db2.gz	WEIKEBGEPUSIAX-GOSISDBHSA-N	0	3	330.476	3.261	20	30		EGEDHN
CCN1CCN(Cc2ccc(CNc3nc(C)ccc3C#N)cc2)CC1	ZINC000160609188	455480581	/nfs/dbraw/zinc/48/05/81/455480581.db2.gz	GKTRKNRWBSVQDU-UHFFFAOYSA-N	0	3	349.482	3.011	20	30		EGEDHN
CC[C@H](NCC(=O)N(CCC#N)c1cc(C)cc(C)c1)[C@H]1CCCO1	ZINC000182304263	455484277	/nfs/dbraw/zinc/48/42/77/455484277.db2.gz	CYXZBIUGKUNRIV-RBUKOAKNSA-N	0	3	343.471	3.097	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1CC[C@H](c2ccccc2)[C@@H](C)C1	ZINC000246726142	455519655	/nfs/dbraw/zinc/51/96/55/455519655.db2.gz	LXBUOKFIMMRFAP-AOIWGVFYSA-N	0	3	327.472	3.120	20	30		EGEDHN
COc1ccccc1N(CCC#N)C(=O)[C@@H](C)N[C@@H]1CCCC1(C)C	ZINC000191853965	455526043	/nfs/dbraw/zinc/52/60/43/455526043.db2.gz	OESFYHUOCQANMJ-CRAIPNDOSA-N	0	3	343.471	3.499	20	30		EGEDHN
N#Cc1c(CN2CC[C@@H]3[C@@H](CCCN3C3CC3)C2)cn2ccccc12	ZINC000246948575	455538461	/nfs/dbraw/zinc/53/84/61/455538461.db2.gz	UMCHJBSJFCPOMG-OXJNMPFZSA-N	0	3	334.467	3.260	20	30		EGEDHN
Cc1nc(C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@@H](C)C2)ccc1C#N	ZINC000247261577	455580445	/nfs/dbraw/zinc/58/04/45/455580445.db2.gz	VKVOOEFVMHUFFO-HNAYVOBHSA-N	0	3	348.450	3.045	20	30		EGEDHN
N#Cc1ccc(OC2CCC([NH2+]Cc3cc([O-])cc(F)c3)CC2)nc1	ZINC000185616661	455585887	/nfs/dbraw/zinc/58/58/87/455585887.db2.gz	YICQSFSEFJOULA-UHFFFAOYSA-N	0	3	341.386	3.278	20	30		EGEDHN
Cc1ccc2c(c1)[C@@H]1CN(C)CC[C@H]1N2C(=O)c1ccc(F)c(C#N)c1	ZINC000283812192	455597258	/nfs/dbraw/zinc/59/72/58/455597258.db2.gz	IPPUZPRQAVNTBD-FXAWDEMLSA-N	0	3	349.409	3.454	20	30		EGEDHN
C=CCn1c(C)cc(C(=O)CN2CCN(C3CCC3)C[C@H](C)C2)c1C	ZINC000292285069	455619756	/nfs/dbraw/zinc/61/97/56/455619756.db2.gz	LTDLVNJUKKCQCL-MRXNPFEDSA-N	0	3	343.515	3.280	20	30		EGEDHN
Cc1ccoc1CN(C)CCC(=O)Nc1sc2c(c1C#N)CCC2	ZINC000292328719	455630746	/nfs/dbraw/zinc/63/07/46/455630746.db2.gz	OLQKQLBKQSDQSE-UHFFFAOYSA-N	0	3	343.452	3.471	20	30		EGEDHN
CN1CCO[C@H]([C@H](N[C@@H]2CCC[C@H](C#N)C2)c2ccc(Cl)cc2)C1	ZINC000185875323	455639369	/nfs/dbraw/zinc/63/93/69/455639369.db2.gz	FPODCTBXHNWGEE-KLIQENQMSA-N	0	3	347.890	3.384	20	30		EGEDHN
N#C[C@H]1CCC[C@H](NCc2cc3c(c(Br)c2)OCO3)C1	ZINC000185882405	455642065	/nfs/dbraw/zinc/64/20/65/455642065.db2.gz	HGIBKJPYAGJJPJ-JQWIXIFHSA-N	0	3	337.217	3.350	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2cc(C)sc2Br)CC1	ZINC000268407202	455675157	/nfs/dbraw/zinc/67/51/57/455675157.db2.gz	RVKGDTCPOYTAEF-UHFFFAOYSA-N	0	3	343.290	3.199	20	30		EGEDHN
C=CCN(C(=O)NCC1CCN(Cc2cccs2)CC1)C1CC1	ZINC000271624435	455704809	/nfs/dbraw/zinc/70/48/09/455704809.db2.gz	YWSHKOTZBLPPNN-UHFFFAOYSA-N	0	3	333.501	3.320	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCC(CC(=O)N2CCCC2)CC1	ZINC000186169095	455709559	/nfs/dbraw/zinc/70/95/59/455709559.db2.gz	CSUKMQOTGDSOMO-UHFFFAOYSA-N	0	3	325.456	3.091	20	30		EGEDHN
N#C[C@H]1CCC[C@H](NCC(=O)N2CCC(Cc3ccccc3)CC2)C1	ZINC000192924554	455719325	/nfs/dbraw/zinc/71/93/25/455719325.db2.gz	SJVAYNMEJTTXJI-PMACEKPBSA-N	0	3	339.483	3.140	20	30		EGEDHN
Cc1ccccc1[C@@H](CC(C)C)NCC(=O)N(CCC#N)CCC#N	ZINC000271685762	455721367	/nfs/dbraw/zinc/72/13/67/455721367.db2.gz	JFHBUZNEPBYJQJ-LJQANCHMSA-N	0	3	340.471	3.328	20	30		EGEDHN
N#C[C@@H]1CCC[C@@H](N[C@H]2CCCN(Cc3ccc(F)cc3F)C2=O)C1	ZINC000248881139	455736573	/nfs/dbraw/zinc/73/65/73/455736573.db2.gz	KPYVOGGMXRAVQD-QBIMZIAESA-N	0	3	347.409	3.128	20	30		EGEDHN
CNC(=O)CCCN(C)CCC(C#N)(c1ccccc1)c1ccccc1	ZINC000193077340	455740800	/nfs/dbraw/zinc/74/08/00/455740800.db2.gz	VQTUCTQRTAZXFT-UHFFFAOYSA-N	0	3	349.478	3.344	20	30		EGEDHN
C[C@H](N[C@@H]1CCO[C@H]1c1ccccc1)C(=O)Nc1cccc(C#N)c1	ZINC000249061869	455743519	/nfs/dbraw/zinc/74/35/19/455743519.db2.gz	PHQDBXDSLUSZSA-KYNGSXCRSA-N	0	3	335.407	3.005	20	30		EGEDHN
CC(C)C[C@H]1OCCC[C@@H]1NCC(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000186386584	455757266	/nfs/dbraw/zinc/75/72/66/455757266.db2.gz	GHXIJMFXDAFPQH-DLBZAZTESA-N	0	3	349.862	3.333	20	30		EGEDHN
C=C(C)Cn1c(C)nnc1N1CC[C@@H](C)N(Cc2ccccc2)CC1	ZINC000292858206	455764230	/nfs/dbraw/zinc/76/42/30/455764230.db2.gz	GQTWXZSZYXMCJX-QGZVFWFLSA-N	0	3	339.487	3.263	20	30		EGEDHN
CCCC[C@@H](NCC(=O)N(CC)CCC#N)c1ccc(OC)cc1	ZINC000271828503	455777382	/nfs/dbraw/zinc/77/73/82/455777382.db2.gz	PAPUKSNGIDHBHF-GOSISDBHSA-N	0	3	331.460	3.278	20	30		EGEDHN
COC(=O)[C@@H]1CN([C@@H]2CC[C@H](C#N)C2)C[C@H]1c1ccc(Cl)cc1	ZINC000293567535	455791217	/nfs/dbraw/zinc/79/12/17/455791217.db2.gz	MROYVYXLOULZCZ-NKKGCODLSA-N	0	3	332.831	3.221	20	30		EGEDHN
CC[C@H](NC[C@@H](O)CN1CCc2ccccc2C1)c1ccc(C#N)cc1	ZINC000278281629	455804913	/nfs/dbraw/zinc/80/49/13/455804913.db2.gz	QCRMQZYSWMSVIX-YADHBBJMSA-N	0	3	349.478	3.018	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN2CC[C@@]3(C2)OCc2ccccc23)c1	ZINC000186617090	455806482	/nfs/dbraw/zinc/80/64/82/455806482.db2.gz	KBWGGMDGIOBARP-NRFANRHFSA-N	0	3	347.418	3.018	20	30		EGEDHN
C[C@@H](CN1CCC[C@H](C)C1)NC(=O)C(C)(C)c1cc(F)cc(C#N)c1	ZINC000285250700	455812994	/nfs/dbraw/zinc/81/29/94/455812994.db2.gz	ZSLZGQNQJXOUKM-GJZGRUSLSA-N	0	3	345.462	3.212	20	30		EGEDHN
COc1cccc(CN2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1	ZINC000269583143	455849234	/nfs/dbraw/zinc/84/92/34/455849234.db2.gz	BPRAKKGOLMEETI-UHFFFAOYSA-N	0	3	349.434	3.418	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N(C)CC1(N(C)C)CCC1	ZINC000186961330	455856768	/nfs/dbraw/zinc/85/67/68/455856768.db2.gz	WPJNIDPTPVUGOX-INIZCTEOSA-N	0	3	349.544	3.067	20	30		EGEDHN
C#CCCCCNC(=O)[C@@H]1CN(Cc2ccccc2)CCC1(F)F	ZINC000285500943	455859555	/nfs/dbraw/zinc/85/95/55/455859555.db2.gz	AIKROJKLFDXXME-KRWDZBQOSA-N	0	3	334.410	3.064	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)/C=C\c2cn(C)c3ccccc23)CC1	ZINC000255144964	455862108	/nfs/dbraw/zinc/86/21/08/455862108.db2.gz	GNJBMBAVJAFOGY-HJWRWDBZSA-N	0	3	337.467	3.348	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CN[C@H](c1ncc[nH]1)c1cccnc1)C(C)C	ZINC000279985119	455878923	/nfs/dbraw/zinc/87/89/23/455878923.db2.gz	DVXJASIFYDAOLH-OALUTQOASA-N	0	3	339.487	3.182	20	30		EGEDHN
Cc1ccccc1CN1CCC(NC(=O)Cc2ccc(C#N)cc2)CC1	ZINC000194863803	455893404	/nfs/dbraw/zinc/89/34/04/455893404.db2.gz	PRMGLSWNRWZBNN-UHFFFAOYSA-N	0	3	347.462	3.190	20	30		EGEDHN
CCC[C@@]1(COC)CCCN1Cc1nnc(-c2ccc(C#N)cc2)o1	ZINC000194923859	455901775	/nfs/dbraw/zinc/90/17/75/455901775.db2.gz	PAIRRGBFQZRULR-IBGZPJMESA-N	0	3	340.427	3.389	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(OCCCC)nc2)CC1	ZINC000187880908	455964763	/nfs/dbraw/zinc/96/47/63/455964763.db2.gz	UHFTTWDGYWZTIZ-UHFFFAOYSA-N	0	3	332.448	3.032	20	30		EGEDHN
CS[C@@H]1CCC[C@H](NC(=O)C(C#N)Cc2ccc(C#N)cc2)C1	ZINC000280463942	455976144	/nfs/dbraw/zinc/97/61/44/455976144.db2.gz	ONWCKRGOKVKTLN-YESZJQIVSA-N	0	3	327.453	3.031	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)N1CC[C@]2(CCN(Cc3ccccc3)C2)C1	ZINC000286321726	456024785	/nfs/dbraw/zinc/02/47/85/456024785.db2.gz	RBKBNYLKQWFJBU-NRFANRHFSA-N	0	3	349.434	3.198	20	30		EGEDHN
CN(C)CCOc1cc(CNc2cc(Cl)ccc2C#N)ccn1	ZINC000270742401	456027591	/nfs/dbraw/zinc/02/75/91/456027591.db2.gz	VOFOAQUGGBHJSG-UHFFFAOYSA-N	0	3	330.819	3.159	20	30		EGEDHN
Cc1cc(CNC(=N)Nc2cc(F)ccc2F)cc(N2CCCC2)n1	ZINC000262365039	456029134	/nfs/dbraw/zinc/02/91/34/456029134.db2.gz	KAPWGHBQFDEURC-UHFFFAOYSA-N	0	3	345.397	3.195	20	30		EGEDHN
C=CCNC(=O)[C@H](C)N[C@@H](C)c1ccc(Oc2cccnc2)cc1	ZINC000287245341	456064486	/nfs/dbraw/zinc/06/44/86/456064486.db2.gz	PCADSRQITZBOFG-GJZGRUSLSA-N	0	3	325.412	3.215	20	30		EGEDHN
COc1cc(C#N)ccc1CN1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O	ZINC000280897903	456076174	/nfs/dbraw/zinc/07/61/74/456076174.db2.gz	DQNCCIZPPXMCJL-QRVBRYPASA-N	0	3	328.456	3.472	20	30		EGEDHN
CN1CCC[C@@]2(CCN(C(=O)N[C@H](CCC#N)c3ccccc3)C2)C1	ZINC000297095293	456116471	/nfs/dbraw/zinc/11/64/71/456116471.db2.gz	ADKDADGOXCXJOR-UYAOXDASSA-N	0	3	340.471	3.159	20	30		EGEDHN
CCCCO[C@H]1C[C@@H](NCC(=O)Nc2sccc2C#N)C1(C)C	ZINC000289470865	456127485	/nfs/dbraw/zinc/12/74/85/456127485.db2.gz	ZAMASPXDZPAMJI-KGLIPLIRSA-N	0	3	335.473	3.132	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cc([N+](=O)[O-])ccc2CC)CC1	ZINC000289612714	456134031	/nfs/dbraw/zinc/13/40/31/456134031.db2.gz	ASTBGTVJHIOWNG-UHFFFAOYSA-N	0	3	346.431	3.319	20	30		EGEDHN
C=C[C@H](CO)N[C@H]1CCCc2nc(-c3ccc(OC)cc3)sc21	ZINC000289781140	456141981	/nfs/dbraw/zinc/14/19/81/456141981.db2.gz	MSPULYVXFDRCTC-HIFRSBDPSA-N	0	3	330.453	3.333	20	30		EGEDHN
CCc1nnc(NC[C@H](c2ccc(C)cc2)N(C)C)c(C#N)c1CC	ZINC000301638261	456170730	/nfs/dbraw/zinc/17/07/30/456170730.db2.gz	XOMVOADBAFDKMO-LJQANCHMSA-N	0	3	337.471	3.496	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@@](C)(CNCc2ccc(C#N)o2)C1	ZINC000273108043	456180064	/nfs/dbraw/zinc/18/00/64/456180064.db2.gz	XADWSRFKNHTZKL-SFHVURJKSA-N	0	3	333.432	3.278	20	30		EGEDHN
COc1cccc([C@@H](CNc2ncc(C#N)cc2Cl)N(C)C)c1	ZINC000263741652	456209909	/nfs/dbraw/zinc/20/99/09/456209909.db2.gz	FEUOCGGTEPBVGC-MRXNPFEDSA-N	0	3	330.819	3.330	20	30		EGEDHN
CSC1c2cc(-c3noc(C4(C#N)CCC4)n3)ccc2NC1=O	ZINC000273848794	456245967	/nfs/dbraw/zinc/24/59/67/456245967.db2.gz	LHGSEZNNTSXOMT-GFCCVEGCSA-N	0	3	326.381	3.038	20	30		EGEDHN
C=CCOc1ccc(CNC[C@@H](O)c2ccc(C)cc2)cc1OC	ZINC000237232232	456251393	/nfs/dbraw/zinc/25/13/93/456251393.db2.gz	NGMWAQQJKSDECT-GOSISDBHSA-N	0	3	327.424	3.392	20	30		EGEDHN
CO[C@H]1CCCC[C@@H]1NCC(=O)N(CCC#N)c1cc(C)cc(C)c1	ZINC000275241117	456271979	/nfs/dbraw/zinc/27/19/79/456271979.db2.gz	OMBKFTGHDQJSNH-OALUTQOASA-N	0	3	343.471	3.097	20	30		EGEDHN
C=CCOc1ccc(CN[C@H]2CCO[C@@H]2c2nccn2C)cc1Cl	ZINC000275455613	456275018	/nfs/dbraw/zinc/27/50/18/456275018.db2.gz	GUZJGQOWIDONFF-RDJZCZTQSA-N	0	3	347.846	3.258	20	30		EGEDHN
CC1CCC(N2CCN(C(=O)c3ccc(CC#N)cc3)CC2)CC1	ZINC000340157330	456284796	/nfs/dbraw/zinc/28/47/96/456284796.db2.gz	CVEIVACVOQAPNW-UHFFFAOYSA-N	0	3	325.456	3.089	20	30		EGEDHN
CC1(C)CN(C[C@H](O)c2ccc(C#N)cc2)C[C@]2(C[C@@H]3CC[C@H]2C3)O1	ZINC000281768078	456313776	/nfs/dbraw/zinc/31/37/76/456313776.db2.gz	SFFXTWKDQNOKOX-SAJDGTNDSA-N	0	3	340.467	3.261	20	30		EGEDHN
C[C@H](CC#N)Sc1ccccc1NC(=O)CN[C@H]1CSC[C@@H]1C	ZINC000352814287	456331505	/nfs/dbraw/zinc/33/15/05/456331505.db2.gz	FYHANKUZZGRCMY-GUTXKFCHSA-N	0	3	349.525	3.360	20	30		EGEDHN
CN(C)C1(CNC(=O)c2ccccc2-c2ccccc2C#N)CCC1	ZINC000275872918	456337265	/nfs/dbraw/zinc/33/72/65/456337265.db2.gz	KCIBDDFJKNXBIJ-UHFFFAOYSA-N	0	3	333.435	3.439	20	30		EGEDHN
Cc1sc(NC(=O)CN[C@@H]2CCCC23CCOCC3)c(C#N)c1C	ZINC000281889772	456352061	/nfs/dbraw/zinc/35/20/61/456352061.db2.gz	AUDWBLILJDDHQQ-OAHLLOKOSA-N	0	3	347.484	3.114	20	30		EGEDHN
CN(CCCC1(C#N)CCOCC1)Cc1cnn(-c2ccccc2)c1	ZINC000281944518	456369300	/nfs/dbraw/zinc/36/93/00/456369300.db2.gz	JDDULIPXSWKUKC-UHFFFAOYSA-N	0	3	338.455	3.405	20	30		EGEDHN
Cc1cccc(N2CCN(CCCC3(C#N)CCOCC3)CC2)c1	ZINC000281981183	456380538	/nfs/dbraw/zinc/38/05/38/456380538.db2.gz	LYLLKFLLUVEKGP-UHFFFAOYSA-N	0	3	327.472	3.218	20	30		EGEDHN
N#Cc1ccc(NC(=O)N[C@@H]2CCCN(Cc3ccccc3)C2)cc1	ZINC000337574434	456391674	/nfs/dbraw/zinc/39/16/74/456391674.db2.gz	UTCCJHZNWMXIOC-LJQANCHMSA-N	0	3	334.423	3.344	20	30		EGEDHN
C=CCN1CC[C@H](N2CCCCC[C@@H]2C[C@@H](O)c2ccccc2)C1=O	ZINC000282067994	456404976	/nfs/dbraw/zinc/40/49/76/456404976.db2.gz	SQWDXLIXFAWKFQ-HSALFYBXSA-N	0	3	342.483	3.142	20	30		EGEDHN
C[C@@H](CCC#N)N1CCC[C@@H](CNC(=O)Nc2cccc(F)c2)C1	ZINC000276296280	456438481	/nfs/dbraw/zinc/43/84/81/456438481.db2.gz	IVVPJXOTTROLRH-GJZGRUSLSA-N	0	3	332.423	3.351	20	30		EGEDHN
COC(=O)[C@H](C)Oc1ccc(CN[C@H](C)c2ccc(C#N)cc2)cc1	ZINC000343156052	456439091	/nfs/dbraw/zinc/43/90/91/456439091.db2.gz	XBIFUTZLGZWIPX-CABCVRRESA-N	0	3	338.407	3.349	20	30		EGEDHN
C=CCOCCCN1CCC(NC(=O)Nc2ccc(F)cc2)CC1	ZINC000348041992	456442406	/nfs/dbraw/zinc/44/24/06/456442406.db2.gz	FLPZOFNJEZCVKN-UHFFFAOYSA-N	0	3	335.423	3.004	20	30		EGEDHN
CCCN(CCN1CCCC1)c1nc(C(F)(F)F)ccc1C#N	ZINC000343254110	456486441	/nfs/dbraw/zinc/48/64/41/456486441.db2.gz	SOPIFMKPWSRGNL-UHFFFAOYSA-N	0	3	326.366	3.284	20	30		EGEDHN
C=CCC[C@H](NC[C@@H](O)CN1CCc2ccccc2C1)c1ccco1	ZINC000340505219	456497527	/nfs/dbraw/zinc/49/75/27/456497527.db2.gz	NJZTWLADWZCFRX-UXHICEINSA-N	0	3	340.467	3.296	20	30		EGEDHN
N#Cc1ccc(CNCC2(N3CCSCC3)CCCC2)c(F)c1	ZINC000343286005	456508190	/nfs/dbraw/zinc/50/81/90/456508190.db2.gz	YHZRIBSKLZVHFC-UHFFFAOYSA-N	0	3	333.476	3.149	20	30		EGEDHN
C[C@H](NCc1ccc(C#N)cc1)c1ccc(N2CCCNC2=O)cc1	ZINC000291129194	456540052	/nfs/dbraw/zinc/54/00/52/456540052.db2.gz	WEGDOEULWMEJMG-HNNXBMFYSA-N	0	3	334.423	3.329	20	30		EGEDHN
C[C@@H](O)[C@](C)(CNCc1ccc(C#N)cc1F)Cc1ccccc1	ZINC000276699621	456556269	/nfs/dbraw/zinc/55/62/69/456556269.db2.gz	MWUDNGDPEROUTL-QRWLVFNGSA-N	0	3	326.415	3.417	20	30		EGEDHN
COC(=O)c1ccc(CN[C@@H]2CCc3ccc(C#N)cc32)cc1OC	ZINC000353261211	456595704	/nfs/dbraw/zinc/59/57/04/456595704.db2.gz	CNIJKBTWDPCUJE-GOSISDBHSA-N	0	3	336.391	3.131	20	30		EGEDHN
C#CCCOc1ccc(CN2CC[C@@](CO)(c3ccccc3)C2)cc1	ZINC000291339190	456610995	/nfs/dbraw/zinc/61/09/95/456610995.db2.gz	VPSUOJSMUBWXBG-JOCHJYFZSA-N	0	3	335.447	3.225	20	30		EGEDHN
CO[C@@H]1CCCC[C@H]1NCC(=O)N(CCC#N)c1cccc(C)c1C	ZINC000276892238	456612170	/nfs/dbraw/zinc/61/21/70/456612170.db2.gz	CDHQSYZNBBBLNN-IEBWSBKVSA-N	0	3	343.471	3.097	20	30		EGEDHN
N#CC1(NC(=O)[C@H]2CCCN(Cc3ccccc3)C2)CCCCC1	ZINC000299167624	456624051	/nfs/dbraw/zinc/62/40/51/456624051.db2.gz	VBEHZTIJIYYPGJ-SFHVURJKSA-N	0	3	325.456	3.241	20	30		EGEDHN
C[C@H](NC[C@H](O)COc1ccccc1C#N)c1ccc(Cl)cc1	ZINC000321443490	456638068	/nfs/dbraw/zinc/63/80/68/456638068.db2.gz	GLDJAHYIVCCNGH-GUYCJALGSA-N	0	3	330.815	3.302	20	30		EGEDHN
CCCN(C)[C@H](CNC(=O)c1cc(C#N)c[nH]1)c1ccc(Cl)cc1	ZINC000353360576	456645445	/nfs/dbraw/zinc/64/54/45/456645445.db2.gz	IVSDBXRNAQWPER-QGZVFWFLSA-N	0	3	344.846	3.353	20	30		EGEDHN
CS[C@@H]1CN(c2c(C#N)cnc3ccc(Cl)cc32)C[C@@H]1N(C)C	ZINC000340741010	456661309	/nfs/dbraw/zinc/66/13/09/456661309.db2.gz	IUYMREPJXQYIEV-JKSUJKDBSA-N	0	3	346.887	3.242	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N(C)[C@@H](C)c1ccncc1)C(C)C	ZINC000299345969	456662791	/nfs/dbraw/zinc/66/27/91/456662791.db2.gz	GTNHOVXZFVZCNQ-HKUYNNGSSA-N	0	3	344.503	3.483	20	30		EGEDHN
C=C(C)COc1cccc(NC(=O)N2C[C@@H](N(C)C)[C@@H](SC)C2)c1	ZINC000353410000	456683917	/nfs/dbraw/zinc/68/39/17/456683917.db2.gz	WWXUMVKWPXSRFG-SJORKVTESA-N	0	3	349.500	3.151	20	30		EGEDHN
C=CCN(Cc1cccc(O)c1)[C@@H](C)c1cccc(-n2cnnn2)c1	ZINC000353500009	456718117	/nfs/dbraw/zinc/71/81/17/456718117.db2.gz	FHARCGFKHCBMJE-HNNXBMFYSA-N	0	3	335.411	3.117	20	30		EGEDHN
CC[C@H](N[C@H]1CCN(c2ccc(C#N)cc2)C1=O)c1ccc(OC)cc1	ZINC000299555417	456726982	/nfs/dbraw/zinc/72/69/82/456726982.db2.gz	GIPFHZYLKSUPLZ-PMACEKPBSA-N	0	3	349.434	3.413	20	30		EGEDHN
O=C(CN[C@@H]1CCC(=O)NC12CCC2)N[C@@H]1CCOc2ccccc21	ZINC000328677334	456735569	/nfs/dbraw/zinc/73/55/69/456735569.db2.gz	AOIMNHYHQUKTEG-GDBMZVCRSA-N	0	3	343.427	3.098	20	30		EGEDHN
CN(C)[C@@H](CNC(=O)Nc1ccc(C#N)c(F)c1)c1ccccc1	ZINC000353537414	456742045	/nfs/dbraw/zinc/74/20/45/456742045.db2.gz	DOGXZEGWYWFEJR-KRWDZBQOSA-N	0	3	326.375	3.122	20	30		EGEDHN
CC[C@@H](NCC(=O)Nc1c(C#N)cnn1-c1ccccc1)C(C)(C)C	ZINC000343611937	456743596	/nfs/dbraw/zinc/74/35/96/456743596.db2.gz	PNKDQDBKBFAXGT-MRXNPFEDSA-N	0	3	339.443	3.097	20	30		EGEDHN
C[C@@H](NC(=O)C1CCCC1)C(=O)N1CCN(C2CCC(C)CC2)CC1	ZINC000328839934	456772551	/nfs/dbraw/zinc/77/25/51/456772551.db2.gz	YWKRSRGZKAOTMG-UPTPFMHGSA-N	0	3	349.519	3.245	20	30		EGEDHN
CC(C#N)C(=O)N1C[C@@H](C)O[C@@H](c2cccc(C(F)(F)F)c2)C1	ZINC000343963918	456786222	/nfs/dbraw/zinc/78/62/22/456786222.db2.gz	GMQSARKXYRZICJ-MISXGVKJSA-N	0	3	326.318	3.153	20	30		EGEDHN
C[C@@H]1C[C@H](C(=O)NCc2ccc(OC3CCN(C)CC3)cc2)CO1	ZINC000328901776	456787594	/nfs/dbraw/zinc/78/75/94/456787594.db2.gz	ZMXLXCOEGDXYTP-ZBFHGGJFSA-N	0	3	332.444	3.041	20	30		EGEDHN
CCn1ccnc1[C@@H]1OCC[C@H]1C(=O)N[C@H](C)CN1CCC[C@H](C)C1	ZINC000328939078	456796390	/nfs/dbraw/zinc/79/63/90/456796390.db2.gz	KHBLWFUKOISVEQ-YLFCFFPRSA-N	0	3	348.491	3.058	20	30		EGEDHN
CCN(CCC#N)C(=O)CN[C@H](C)c1ccc(F)c2ccccc21	ZINC000344104233	456797373	/nfs/dbraw/zinc/79/73/73/456797373.db2.gz	OXAWPRBQPYNDAU-CQSZACIVSA-N	0	3	327.403	3.392	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCC(OCCCC)CC2)CC1	ZINC000341095860	456818020	/nfs/dbraw/zinc/81/80/20/456818020.db2.gz	UYCXXFNYYGRZAP-UHFFFAOYSA-N	0	3	337.508	3.018	20	30		EGEDHN
C=CCNC(=O)Nc1ccc(NC(=O)[C@H](CC)N(CC)CC)cc1	ZINC000344366758	456821213	/nfs/dbraw/zinc/82/12/13/456821213.db2.gz	MSSAEPPRJJZWSB-INIZCTEOSA-N	0	3	332.448	3.053	20	30		EGEDHN
N#CCCCC(=O)N(CCN1CCCC1)Cc1ccc(Cl)cc1	ZINC000292014980	456829392	/nfs/dbraw/zinc/82/93/92/456829392.db2.gz	YOTWFUJMEWKMSI-UHFFFAOYSA-N	0	3	333.863	3.458	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)NCC#Cc2ccccc2)CN1Cc1ccccc1	ZINC000341318471	456844919	/nfs/dbraw/zinc/84/49/19/456844919.db2.gz	FWZRXDJLQALJMA-GHTZIAJQSA-N	0	3	347.462	3.000	20	30		EGEDHN
CN1CC=C(CNC(=O)c2cnn(C(C)(C)C)c2C(F)(F)F)CC1	ZINC000329177099	456849335	/nfs/dbraw/zinc/84/93/35/456849335.db2.gz	CCXUHPSXARRLPB-UHFFFAOYSA-N	0	3	344.381	3.223	20	30		EGEDHN
O=C(CCN1CCC(NC(=O)C2CCCCC2)CC1)N1CCCCC1	ZINC000329282892	456866039	/nfs/dbraw/zinc/86/60/39/456866039.db2.gz	NVCSUUHAEYDUTK-UHFFFAOYSA-N	0	3	349.519	3.390	20	30		EGEDHN
CN(CC(=O)NC(=O)Nc1ccc2c(c1)OCCO2)CC1CCCC1	ZINC000329291872	456867751	/nfs/dbraw/zinc/86/77/51/456867751.db2.gz	RAWZGWJHQBGDFX-UHFFFAOYSA-N	0	3	347.415	3.082	20	30		EGEDHN
CCN1CCCC[C@@H]1CNC(=O)[C@H]1CC(=O)N(c2ccccc2F)C1	ZINC000329395270	456883884	/nfs/dbraw/zinc/88/38/84/456883884.db2.gz	WZLZOHNCZPUUNO-LSDHHAIUSA-N	0	3	347.434	3.010	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCC2(Cc3ccccc3)CCC2)CC1	ZINC000341669594	456891929	/nfs/dbraw/zinc/89/19/29/456891929.db2.gz	UUTNBWMVHIBFEO-UHFFFAOYSA-N	0	3	341.499	3.349	20	30		EGEDHN
Cc1c(C(=O)N[C@@H]2CN(C3CC3)C[C@@H]2C)cnn1C1CCCCC1	ZINC000329500908	456900385	/nfs/dbraw/zinc/90/03/85/456900385.db2.gz	KHTGUWSDUBXLJZ-SCLBCKFNSA-N	0	3	330.476	3.484	20	30		EGEDHN
CCN(CCN1CCCCCC1)C(=O)Nc1ccc(F)c(C#N)c1	ZINC000349282746	456931150	/nfs/dbraw/zinc/93/11/50/456931150.db2.gz	JINQFDIGFQVYRP-UHFFFAOYSA-N	0	3	332.423	3.427	20	30		EGEDHN
C[C@H]1CN(CC(=O)NC(=O)NC23CC4CC(CC(C4)C2)C3)C[C@H]1C	ZINC000329801272	456942613	/nfs/dbraw/zinc/94/26/13/456942613.db2.gz	IZBJTXBXVNSLCZ-DQKMUQPMSA-N	0	3	333.476	3.414	20	30		EGEDHN
C[C@@H]1CN(C2CC2)C[C@H]1NC(=O)COc1cccc2c1OC(C)(C)C2	ZINC000329852680	456950778	/nfs/dbraw/zinc/95/07/78/456950778.db2.gz	UZCUOQXDNHREPJ-CZUORRHYSA-N	0	3	344.455	3.218	20	30		EGEDHN
O=C(CCC(=O)c1ccc(Cl)cn1)N[C@@H]1CCN2CCCC[C@@H]12	ZINC000329948332	456965618	/nfs/dbraw/zinc/96/56/18/456965618.db2.gz	KQOBDPAQCBOMGT-HIFRSBDPSA-N	0	3	335.835	3.281	20	30		EGEDHN
O=C(N[C@H](CO)Cc1ccc(O)cc1)[C@@H]1CCCCN1C1CCCC1	ZINC000329947159	456966072	/nfs/dbraw/zinc/96/60/72/456966072.db2.gz	JXJNNBCIKAMSIJ-LPHOPBHVSA-N	0	3	346.471	3.049	20	30		EGEDHN
C[C@@H](NCc1cccc(F)c1C#N)C1CCN(CC(F)(F)F)CC1	ZINC000339162242	456971332	/nfs/dbraw/zinc/97/13/32/456971332.db2.gz	WLRNDFVMWZOZOH-GFCCVEGCSA-N	0	3	343.368	3.450	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)C2CCC(NC(=O)C3CC3)CC2)CN1C1CC1	ZINC000330007949	456973892	/nfs/dbraw/zinc/97/38/92/456973892.db2.gz	GGBWPALTPBNDEG-KKOFPSKJSA-N	0	3	333.476	3.493	20	30		EGEDHN
C=CC[C@H](CO)CN[C@@H]1CCCOc2c(Br)cccc21	ZINC000341891587	456989409	/nfs/dbraw/zinc/98/94/09/456989409.db2.gz	VGJUGVGJAPNXMG-SWLSCSKDSA-N	0	3	340.261	3.437	20	30		EGEDHN
CC(C)C[C@@H]1OCCC[C@H]1NCC(=O)Nc1ccc2c(c1)OCO2	ZINC000330148684	456991748	/nfs/dbraw/zinc/99/17/48/456991748.db2.gz	MGWBONNZTHXKMK-ZBFHGGJFSA-N	0	3	334.416	3.187	20	30		EGEDHN
CCOc1ccc(Oc2cc(CNC(=O)C(C)C#N)ccn2)cc1	ZINC000345761537	456992039	/nfs/dbraw/zinc/99/20/39/456992039.db2.gz	LKGNAYVTUBECBE-CYBMUJFWSA-N	0	3	325.368	3.048	20	30		EGEDHN
C[C@H]1C[C@H]1N1CCN(C(=O)C[C@H](CC#N)c2ccccc2)C[C@@H](C)C1	ZINC000346133259	457019565	/nfs/dbraw/zinc/01/95/65/457019565.db2.gz	AXMKCEAGQWSOES-QGZVKYPTSA-N	0	3	339.483	3.263	20	30		EGEDHN
CCn1cc([C@H]2OCCC[C@@H]2NC(=O)[C@H](C)N2CCCCCC2)cn1	ZINC000330318628	457026345	/nfs/dbraw/zinc/02/63/45/457026345.db2.gz	CNGNYJJFDPLCSN-RYQLBKOJSA-N	0	3	348.491	3.344	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)NC[C@H](c1ccc(Cl)cc1)N(C)CCC	ZINC000358925617	457037137	/nfs/dbraw/zinc/03/71/37/457037137.db2.gz	DUDCNYZDNJZMBP-AEFFLSMTSA-N	0	3	338.879	3.166	20	30		EGEDHN
C=C(C)CN(CC)C(=O)CCCN1CCN(c2ccccc2)CC1	ZINC000346529483	457048184	/nfs/dbraw/zinc/04/81/84/457048184.db2.gz	QFGLTISEAYXDIQ-UHFFFAOYSA-N	0	3	329.488	3.013	20	30		EGEDHN
CN(C(=O)C(C#N)CCc1ccccc1)[C@@H](CCO)c1ccccc1	ZINC000339352574	457064006	/nfs/dbraw/zinc/06/40/06/457064006.db2.gz	NZSZAIQXTABCQV-PMACEKPBSA-N	0	3	336.435	3.341	20	30		EGEDHN
CCS[C@@H]1CCCC[C@@H]1N[C@H](C)C(=O)N[C@](C)(C#N)C(C)C	ZINC000346601688	457070894	/nfs/dbraw/zinc/07/08/94/457070894.db2.gz	HNXSBLRMVFVCJA-JYYAWHABSA-N	0	3	325.522	3.083	20	30		EGEDHN
CN(C)CCOc1ccccc1-c1noc(-c2cccc(C#N)c2)n1	ZINC000356588810	457071149	/nfs/dbraw/zinc/07/11/49/457071149.db2.gz	HYKFXCCOYNRSQM-UHFFFAOYSA-N	0	3	334.379	3.216	20	30		EGEDHN
CCOc1cc(NC(=O)N(C)[C@H](C)C2CCN(C)CC2)ccc1OC	ZINC000330717908	457075544	/nfs/dbraw/zinc/07/55/44/457075544.db2.gz	VFQKLGNIFFOOOL-CQSZACIVSA-N	0	3	349.475	3.302	20	30		EGEDHN
CC(C)N(Cc1ccc(F)cc1)C[C@@H](O)COc1ccc(C#N)cc1	ZINC000346611490	457077505	/nfs/dbraw/zinc/07/75/05/457077505.db2.gz	WPPVECLTKVTHPT-LJQANCHMSA-N	0	3	342.414	3.348	20	30		EGEDHN
CCN1CCC(NC(=O)Nc2cc(F)c(OC(F)F)cc2F)CC1	ZINC000331169079	457142078	/nfs/dbraw/zinc/14/20/78/457142078.db2.gz	NLYBZYGZWFQNAK-UHFFFAOYSA-N	0	3	349.328	3.376	20	30		EGEDHN
C=CCCC1(C(=O)NCc2ccccc2CN2CCC[C@H]2CO)CC1	ZINC000356749251	457148123	/nfs/dbraw/zinc/14/81/23/457148123.db2.gz	WOSDUKBTSXORJK-IBGZPJMESA-N	0	3	342.483	3.006	20	30		EGEDHN
CC[C@H]1CCCCN1CCNC(=O)CSc1ccc(C#N)cc1	ZINC000354384133	457190880	/nfs/dbraw/zinc/19/08/80/457190880.db2.gz	HDPLFCUPKUQTGV-INIZCTEOSA-N	0	3	331.485	3.031	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@H]2c2ccc(C)cc2)CC1	ZINC000363009073	457193892	/nfs/dbraw/zinc/19/38/92/457193892.db2.gz	LOTQQJMXLVOQJS-IBGZPJMESA-N	0	3	327.472	3.492	20	30		EGEDHN
C[C@@H](C(=O)N(CCC#N)c1ccccc1)N1CC[C@@H](CC2CC2)C1	ZINC000339681353	457210712	/nfs/dbraw/zinc/21/07/12/457210712.db2.gz	HERNQSOYXUTWPP-WMZOPIPTSA-N	0	3	325.456	3.444	20	30		EGEDHN
C[C@H]1CCN(C(=O)c2cccc(CC#N)c2)CCN1Cc1ccccc1	ZINC000363124863	457230440	/nfs/dbraw/zinc/23/04/40/457230440.db2.gz	CJDOIWRGTVJWNE-SFHVURJKSA-N	0	3	347.462	3.489	20	30		EGEDHN
C=CCOCC(=O)NCc1ccccc1-c1ccc(CN(C)C)cc1	ZINC000354560037	457288363	/nfs/dbraw/zinc/28/83/63/457288363.db2.gz	KXDSSBIIYYJDNF-UHFFFAOYSA-N	0	3	338.451	3.234	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCC(C)(C)CCC#N)C1	ZINC000351825770	457318669	/nfs/dbraw/zinc/31/86/69/457318669.db2.gz	ALTMVHDCOANFMG-AEFFLSMTSA-N	0	3	342.487	3.451	20	30		EGEDHN
C=CCCCCCN(C)[C@@H](C)C(=O)Nc1ccc2c(c1)OCCO2	ZINC000351897660	457322736	/nfs/dbraw/zinc/32/27/36/457322736.db2.gz	MPRBHZOKUDXUDT-HNNXBMFYSA-N	0	3	332.444	3.463	20	30		EGEDHN
C=C(C)CN(Cc1cnn(C(C)C)c1)C(=O)[C@H](CC)N(CC)CC	ZINC000342507918	457341644	/nfs/dbraw/zinc/34/16/44/457341644.db2.gz	ZWRNFNPRFUUJLR-SFHVURJKSA-N	0	3	334.508	3.489	20	30		EGEDHN
COc1ccccc1NC(=O)C1CCN([C@H]2CC[C@@H](C#N)C2)CC1	ZINC000332330333	457351106	/nfs/dbraw/zinc/35/11/06/457351106.db2.gz	SIJCNXFTNIWPEM-ZBFHGGJFSA-N	0	3	327.428	3.038	20	30		EGEDHN
N#Cc1ccc([C@H](NC[C@H]2CCCC[C@H]2C(F)(F)F)C(N)=O)cc1	ZINC000352271927	457353670	/nfs/dbraw/zinc/35/36/70/457353670.db2.gz	SVPVXLSIMPQIDW-KFWWJZLASA-N	0	3	339.361	3.043	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CC(=O)N(c3ccccc3Cl)C2)cc1	ZINC000363618082	457384645	/nfs/dbraw/zinc/38/46/45/457384645.db2.gz	PVTNETKUUMCIJQ-HNNXBMFYSA-N	0	3	325.799	3.107	20	30		EGEDHN
C#CC[C@@H](NC(=O)N1CCC[C@@H]1CN1CCCCC1)c1ccccc1	ZINC000378277613	457387588	/nfs/dbraw/zinc/38/75/88/457387588.db2.gz	OIGPWMHNYYAHHT-WOJBJXKFSA-N	0	3	339.483	3.411	20	30		EGEDHN
CCN(CC)CC(=O)N(Cc1cccc(C(F)(F)F)c1)[C@@H](C)C#N	ZINC000425085545	457434170	/nfs/dbraw/zinc/43/41/70/457434170.db2.gz	LYSIDCZHQHYAGY-ZDUSSCGKSA-N	0	3	341.377	3.288	20	30		EGEDHN
CN(Cc1ccccc1)C1CN(C(=O)C(C#N)CCc2ccccc2)C1	ZINC000342723729	457480913	/nfs/dbraw/zinc/48/09/13/457480913.db2.gz	GZYJOQTZOOYIMD-HXUWFJFHSA-N	0	3	347.462	3.102	20	30		EGEDHN
C=CCCN(C)[C@H](C)C(=O)N(C)Cc1ccc(Br)cc1	ZINC000342738086	457489313	/nfs/dbraw/zinc/48/93/13/457489313.db2.gz	STXFITDPTRHUMD-CYBMUJFWSA-N	0	3	339.277	3.304	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC[C@H](C(C)C)N1CCc2ccccc2C1	ZINC000347613077	457550454	/nfs/dbraw/zinc/55/04/54/457550454.db2.gz	AKEGAMITGDPULE-FXAWDEMLSA-N	0	3	344.499	3.167	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](c2ccc(F)cc2)C(C)C)CC1	ZINC000410269740	457636098	/nfs/dbraw/zinc/63/60/98/457636098.db2.gz	PGUGYMBZYXKHQT-GOSISDBHSA-N	0	3	333.451	3.472	20	30		EGEDHN
Cc1ccccc1[C@@H]([C@@H](C)NC(=O)Cc1ccc(C#N)cc1)N(C)C	ZINC000357879189	457721826	/nfs/dbraw/zinc/72/18/26/457721826.db2.gz	VJJSDRXKALGWSM-IIBYNOLFSA-N	0	3	335.451	3.217	20	30		EGEDHN
C#CCN1CCC(C(=O)NC2c3ccccc3Oc3ccccc32)CC1	ZINC000365138946	457728522	/nfs/dbraw/zinc/72/85/22/457728522.db2.gz	CXIDXBZUCRAXQW-UHFFFAOYSA-N	0	3	346.430	3.343	20	30		EGEDHN
COc1ccc(C)cc1CCNC(=O)C(C#N)CCc1ccccc1	ZINC000433167670	457768130	/nfs/dbraw/zinc/76/81/30/457768130.db2.gz	OHUGLARAEFOAIM-IBGZPJMESA-N	0	3	336.435	3.435	20	30		EGEDHN
C=C[C@H](CC(=O)N1C[C@@H](SC)[C@@H](N2CCCC2)C1)c1ccccc1	ZINC000361625756	457809337	/nfs/dbraw/zinc/80/93/37/457809337.db2.gz	VRZBSPZIJJNLHB-NZSAHSFTSA-N	0	3	344.524	3.385	20	30		EGEDHN
Cc1cccn2cc(CNC(=O)C(C#N)CCc3ccccc3)nc12	ZINC000433344808	457816897	/nfs/dbraw/zinc/81/68/97/457816897.db2.gz	UREFLJMRKPWPAI-QGZVFWFLSA-N	0	3	332.407	3.032	20	30		EGEDHN
CCCN(CCC)[C@H](C)C(=O)N(CCC#N)c1ccccc1OC	ZINC000411164634	457818061	/nfs/dbraw/zinc/81/80/61/457818061.db2.gz	ILIAIYGJFCAFMO-MRXNPFEDSA-N	0	3	331.460	3.452	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)NCCOc1ncccc1Cl	ZINC000433364735	457820962	/nfs/dbraw/zinc/82/09/62/457820962.db2.gz	OFFPHEHJFSDZHP-HNNXBMFYSA-N	0	3	343.814	3.003	20	30		EGEDHN
Cc1noc(C)c1[C@@H](C)CNC(=O)C(C#N)CCc1ccccc1	ZINC000433378975	457824439	/nfs/dbraw/zinc/82/44/39/457824439.db2.gz	WRHGBXIKCVTTFB-GUYCJALGSA-N	0	3	325.412	3.284	20	30		EGEDHN
C[C@H](NC(=O)C(C#N)CCc1ccccc1)[C@@H]1COc2ccccc21	ZINC000433389411	457828054	/nfs/dbraw/zinc/82/80/54/457828054.db2.gz	XCTMRYQITQDPQO-IEZWGBDMSA-N	0	3	334.419	3.440	20	30		EGEDHN
C=CC[C@@H]1N(Cc2cnc(-c3cnn(C)c3)nc2)CCCC1(C)C	ZINC000366862405	457903819	/nfs/dbraw/zinc/90/38/19/457903819.db2.gz	HQGKWUWVFIFYKV-KRWDZBQOSA-N	0	3	325.460	3.444	20	30		EGEDHN
C[C@@H](NC(C)(C)CNC(=O)NCC(C)(C)CC#N)c1ccccc1	ZINC000458366964	458025413	/nfs/dbraw/zinc/02/54/13/458025413.db2.gz	HKEXILQHPPZLSC-OAHLLOKOSA-N	0	3	330.476	3.355	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@]2(CCN2CCCSCC#N)C1	ZINC000375726685	458038957	/nfs/dbraw/zinc/03/89/57/458038957.db2.gz	JVKDEEZTRFQDSP-KRWDZBQOSA-N	0	3	339.505	3.109	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@@H]2CC(C)(C)Oc3ccccc32)CC1	ZINC000412034190	458058018	/nfs/dbraw/zinc/05/80/18/458058018.db2.gz	FYOSQIKHOMOPPW-QGZVFWFLSA-N	0	3	328.456	3.098	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)NCC(C)(C)CC#N)CCN1Cc1ccccc1	ZINC000458513564	458078396	/nfs/dbraw/zinc/07/83/96/458078396.db2.gz	YTYNIMPBKQKORP-WMZOPIPTSA-N	0	3	342.487	3.279	20	30		EGEDHN
COCCN(CCN1CCc2ccccc21)Cc1ccc(C#N)cc1	ZINC000428212815	458098848	/nfs/dbraw/zinc/09/88/48/458098848.db2.gz	ZTPQIHNRWIWHAO-UHFFFAOYSA-N	0	3	335.451	3.069	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCc2ccc(C)cc2OCCC)CC1	ZINC000445858079	458103962	/nfs/dbraw/zinc/10/39/62/458103962.db2.gz	SWRZYDKYKYZKDZ-UHFFFAOYSA-N	0	3	345.487	3.233	20	30		EGEDHN
C=C(C)CS(=O)(=O)NCC1(N[C@H](C)c2ccccc2)CCCC1	ZINC000435438395	458148027	/nfs/dbraw/zinc/14/80/27/458148027.db2.gz	PMQNMBMUPNNRGC-MRXNPFEDSA-N	0	3	336.501	3.146	20	30		EGEDHN
CC[C@@H](CNC(=O)C(C#N)Cc1ccc(C#N)cc1)CC(F)(F)F	ZINC000412656286	458262149	/nfs/dbraw/zinc/26/21/49/458262149.db2.gz	MMPDZLSQRQZZLU-DOMZBBRYSA-N	0	3	337.345	3.335	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NC(=O)N1CC[C@@]2(C1)CCCN(C)C2	ZINC000413825674	458308678	/nfs/dbraw/zinc/30/86/78/458308678.db2.gz	GSWPYOBDTGVEKF-CTNGQTDRSA-N	0	3	341.499	3.301	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NC(=O)N(C)[C@@H]1CCN(C(C)C)C1	ZINC000413843216	458310785	/nfs/dbraw/zinc/31/07/85/458310785.db2.gz	ZKDFAOCHQBWOTQ-RTBURBONSA-N	0	3	329.488	3.298	20	30		EGEDHN
CC(C)(C#N)c1ccc(NC(=O)NC[C@@H]2NCCc3ccccc32)cc1	ZINC000414838014	458325086	/nfs/dbraw/zinc/32/50/86/458325086.db2.gz	XZIONIQZEORHJW-IBGZPJMESA-N	0	3	348.450	3.496	20	30		EGEDHN
C=CCN(CCc1ccco1)C(=O)Nc1ccc2c(c1)CNCCO2	ZINC000415994303	458336597	/nfs/dbraw/zinc/33/65/97/458336597.db2.gz	VBKGEIWSYIFULC-UHFFFAOYSA-N	0	3	341.411	3.024	20	30		EGEDHN
C[C@H](NC(=O)NC[C@H]1N(C)CCCC1(C)C)c1ccc(C#N)cc1	ZINC000447977874	458373491	/nfs/dbraw/zinc/37/34/91/458373491.db2.gz	PTJKXLCIDVOPLW-WMLDXEAASA-N	0	3	328.460	3.039	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)NCc1cc(C)nc(C)c1)C(C)C	ZINC000420855318	458402029	/nfs/dbraw/zinc/40/20/29/458402029.db2.gz	WGOZVGOUYVIKOB-IBGZPJMESA-N	0	3	344.503	3.196	20	30		EGEDHN
CN(C)CCN(Cc1ccsc1)C(=O)Nc1cccc(CC#N)c1	ZINC000459606581	458426540	/nfs/dbraw/zinc/42/65/40/458426540.db2.gz	DFOBOECGYQAQCL-UHFFFAOYSA-N	0	3	342.468	3.410	20	30		EGEDHN
CC(C)(CC#N)CNCc1cccc(I)c1	ZINC000459660104	458439305	/nfs/dbraw/zinc/43/93/05/458439305.db2.gz	AXKFGPJZQQXSSU-UHFFFAOYSA-N	0	3	328.197	3.321	20	30		EGEDHN
C=CCC1(C(=O)N2CCN(C3CCN(C)CC3)[C@H](C)C2)CCCCC1	ZINC000450362312	458446140	/nfs/dbraw/zinc/44/61/40/458446140.db2.gz	HNQDAEYCBOFYGX-GOSISDBHSA-N	0	3	347.547	3.140	20	30		EGEDHN
C=CCS(=O)(=O)CCN[C@H]1CCC[C@H]1c1ccc(Cl)cc1	ZINC000373265990	458446811	/nfs/dbraw/zinc/44/68/11/458446811.db2.gz	DFCKTZLXMGDPKH-HOTGVXAUSA-N	0	3	327.877	3.167	20	30		EGEDHN
C[C@H](N[C@@H](c1ccc(F)c(Cl)c1)C1CC1)C(=O)N(C)CCC#N	ZINC000451351136	458474494	/nfs/dbraw/zinc/47/44/94/458474494.db2.gz	FBHSFNWAXIAGMA-MEDUHNTESA-N	0	3	337.826	3.280	20	30		EGEDHN
C=CCC1(C(=O)NCc2ccncc2OCCN(C)C)CCCCC1	ZINC000451806978	458487849	/nfs/dbraw/zinc/48/78/49/458487849.db2.gz	ZVTFLIAYAIFAGM-UHFFFAOYSA-N	0	3	345.487	3.165	20	30		EGEDHN
CCO[C@@H]1CCC[C@H]1NCC#Cc1ccc(OC(F)(F)F)cc1	ZINC000452014537	458492897	/nfs/dbraw/zinc/49/28/97/458492897.db2.gz	KRBMKFLNPNKHIL-HZPDHXFCSA-N	0	3	327.346	3.484	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NCC(C)(C)N[C@@H](C)c1ccccc1	ZINC000437834539	458499387	/nfs/dbraw/zinc/49/93/87/458499387.db2.gz	FJRQYEGXYAPIBU-JXFKEZNVSA-N	0	3	332.488	3.461	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NCC(C)(C)N[C@H](C)c1ccccc1	ZINC000437834548	458499667	/nfs/dbraw/zinc/49/96/67/458499667.db2.gz	FJRQYEGXYAPIBU-UZLBHIALSA-N	0	3	332.488	3.461	20	30		EGEDHN
C[C@H](c1ccc(C#N)cc1F)N1CCC[C@@H](CC(C)(C)C(N)=O)C1	ZINC000453271977	458522991	/nfs/dbraw/zinc/52/29/91/458522991.db2.gz	DJTUSDBIBQHSAO-HIFRSBDPSA-N	0	3	331.435	3.372	20	30		EGEDHN
C=C(C)Cn1c([C@@H]2CC[C@H](C)O2)nnc1N1C[C@H](C)N(CC)C[C@@H]1C	ZINC000453462642	458533446	/nfs/dbraw/zinc/53/34/46/458533446.db2.gz	PNHBDOIKXZLLRB-QAETUUGQSA-N	0	3	347.507	3.013	20	30		EGEDHN
Cc1sc(NC(=O)[C@H](N)CCCC#N)nc1-c1ccc(F)cc1	ZINC000424070307	458550897	/nfs/dbraw/zinc/55/08/97/458550897.db2.gz	AFIJOQCJDAYTSU-CYBMUJFWSA-N	0	3	332.404	3.217	20	30		EGEDHN
C=C(C)CCNC(=O)Nc1ccc(N2CCN(CC)CC2)cc1C	ZINC000454270539	458556951	/nfs/dbraw/zinc/55/69/51/458556951.db2.gz	MICHOETUGAEAEC-UHFFFAOYSA-N	0	3	330.476	3.225	20	30		EGEDHN
Cc1cccc(C2(CNC(=O)[C@H](N)CCCC#N)CCCCC2)c1	ZINC000424095824	458557044	/nfs/dbraw/zinc/55/70/44/458557044.db2.gz	OGCCWLPVLWCSRJ-GOSISDBHSA-N	0	3	327.472	3.334	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)NCC1(c2ccc(F)cc2)CCCCC1	ZINC000424104864	458560190	/nfs/dbraw/zinc/56/01/90/458560190.db2.gz	PSQLIUSUJGHQQT-QGZVFWFLSA-N	0	3	331.435	3.165	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N[C@@H](c1ccccc1)c1cccc(F)c1	ZINC000424126132	458564965	/nfs/dbraw/zinc/56/49/65/458564965.db2.gz	SHYYKWJUYINBIU-MSOLQXFVSA-N	0	3	325.387	3.052	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)NCc1ccccc1Sc1ccccc1	ZINC000424147186	458570070	/nfs/dbraw/zinc/57/00/70/458570070.db2.gz	YAMDMOPJXSHDOF-KRWDZBQOSA-N	0	3	339.464	3.475	20	30		EGEDHN
CCCCn1ccnc1-c1cccc(NC(=O)[C@H](N)CCCC#N)c1	ZINC000424146382	458570250	/nfs/dbraw/zinc/57/02/50/458570250.db2.gz	PNFISZCVADMZFJ-QGZVFWFLSA-N	0	3	339.443	3.310	20	30		EGEDHN
Cc1cccc(Oc2ccc(NC(=O)[C@H](N)CCCC#N)cn2)c1C	ZINC000424146063	458570258	/nfs/dbraw/zinc/57/02/58/458570258.db2.gz	OWKGOENBJGATRN-MRXNPFEDSA-N	0	3	338.411	3.450	20	30		EGEDHN
C[C@@H](CNC(=O)C(C)(C)Cc1ccc(C#N)cc1)N1CCC[C@@H](C)C1	ZINC000454726593	458573279	/nfs/dbraw/zinc/57/32/79/458573279.db2.gz	BPYCJTOXBXRUGW-SJORKVTESA-N	0	3	341.499	3.364	20	30		EGEDHN
N#CCCC[C@H](N)C(=O)Nc1cccc(-c2ccc3c(c2)CCO3)c1	ZINC000424165116	458575544	/nfs/dbraw/zinc/57/55/44/458575544.db2.gz	DKMROBLFTAWPMS-SFHVURJKSA-N	0	3	335.407	3.248	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N1CCC[C@H](CCCc2ccccc2)C1	ZINC000424168214	458575981	/nfs/dbraw/zinc/57/59/81/458575981.db2.gz	IADYICLSLPSURI-RBUKOAKNSA-N	0	3	327.472	3.269	20	30		EGEDHN
CC(C)N1C[C@@H](C)[C@@H](NC(=O)Nc2ccc(CC#N)cc2Cl)C1	ZINC000455706723	458607528	/nfs/dbraw/zinc/60/75/28/458607528.db2.gz	QPTSDOQLEZUHRJ-WBMJQRKESA-N	0	3	334.851	3.256	20	30		EGEDHN
C=CCC[C@@H](C(=O)NCCCN1CCCO[C@@H](C)C1)c1ccccc1	ZINC000470095426	458612065	/nfs/dbraw/zinc/61/20/65/458612065.db2.gz	ZHKBTTDPZMFYNO-AZUAARDMSA-N	0	3	344.499	3.354	20	30		EGEDHN
C[C@H](CN1CCCCC1)NC(=O)Nc1ccc(CC#N)cc1Cl	ZINC000455760277	458612242	/nfs/dbraw/zinc/61/22/42/458612242.db2.gz	XWQOLZRJFWHJCY-CYBMUJFWSA-N	0	3	334.851	3.402	20	30		EGEDHN
C[C@H]1[C@@H](NC(=O)Nc2ccc(OC(C)(C)C)c(C#N)c2)CCCN1C	ZINC000455768892	458613762	/nfs/dbraw/zinc/61/37/62/458613762.db2.gz	LEKVQKNVRVCPFZ-BBRMVZONSA-N	0	3	344.459	3.340	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)C1Cc2ccccc2C1)C(C)C	ZINC000431836318	458632272	/nfs/dbraw/zinc/63/22/72/458632272.db2.gz	ZBFZWYHDGULFOM-HXUWFJFHSA-N	0	3	326.484	3.216	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)CCN(C(=O)c2ccc(CC#N)cc2)C1	ZINC000456317624	458637457	/nfs/dbraw/zinc/63/74/57/458637457.db2.gz	AYKADXJBLBDPJJ-SFHVURJKSA-N	0	3	347.462	3.347	20	30		EGEDHN
C[C@H](C#N)CSc1ccccc1NC(=O)CN[C@@]1(C)CCO[C@@H]1C	ZINC000494246503	458647943	/nfs/dbraw/zinc/64/79/43/458647943.db2.gz	BLYVUOVYWYNRBQ-LBTNJELSSA-N	0	3	347.484	3.034	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@@H](Nc3ccnc4ccccc43)C2=O)cc1	ZINC000503279345	458700781	/nfs/dbraw/zinc/70/07/81/458700781.db2.gz	HKYPSVUHZHNSBS-HXUWFJFHSA-N	0	3	342.402	3.136	20	30		EGEDHN
C=C(C)CN(CC)C[C@H](O)COc1cc(F)cc(Br)c1	ZINC000439458611	458705278	/nfs/dbraw/zinc/70/52/78/458705278.db2.gz	SWCQMESLCBFRDP-AWEZNQCLSA-N	0	3	346.240	3.226	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cccc([N+](=O)[O-])c1C)C(C)C	ZINC000503979438	458734897	/nfs/dbraw/zinc/73/48/97/458734897.db2.gz	JLHDDMRQVSUQON-GOSISDBHSA-N	0	3	345.443	3.332	20	30		EGEDHN
CCC(CC)(CN[C@@H](C(N)=O)c1ccc(C#N)cc1)c1ccccc1	ZINC000439649622	458737383	/nfs/dbraw/zinc/73/73/83/458737383.db2.gz	SISNITPIWYOQEB-LJQANCHMSA-N	0	3	335.451	3.432	20	30		EGEDHN
C=CCn1c(-c2ccccc2F)nnc1N1CCN(CC(C)C)CC1	ZINC000508839659	458764325	/nfs/dbraw/zinc/76/43/25/458764325.db2.gz	GWHPPWFUYJHUFK-UHFFFAOYSA-N	0	3	343.450	3.048	20	30		EGEDHN
Cc1ccccc1[C@@H]([C@H](C)NC(=O)N1CCC(C)(C#N)CC1)N(C)C	ZINC000508878937	458765667	/nfs/dbraw/zinc/76/56/67/458765667.db2.gz	IMSFXRRNDHVDET-FUHWJXTLSA-N	0	3	342.487	3.322	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)C(=O)[C@H](C)N1CCCCCC1	ZINC000510425641	458775267	/nfs/dbraw/zinc/77/52/67/458775267.db2.gz	OQXSMPLUVMKDOD-KRWDZBQOSA-N	0	3	330.472	3.474	20	30		EGEDHN
CN(C[C@H]1CCN(Cc2ccc(CC#N)cc2)C1)C(=O)OC(C)(C)C	ZINC000495031870	458785464	/nfs/dbraw/zinc/78/54/64/458785464.db2.gz	OWCKWUCFRZVNDQ-GOSISDBHSA-N	0	3	343.471	3.441	20	30		EGEDHN
C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCN(Cc2ccc(CC#N)cc2)C1	ZINC000495033178	458785784	/nfs/dbraw/zinc/78/57/84/458785784.db2.gz	UTMIUTVWLIOZGR-QAPCUYQASA-N	0	3	343.471	3.488	20	30		EGEDHN
CC(C)C1CCC(N2CCN(C(=O)NCC(C)(C)C#N)CC2)CC1	ZINC000512902879	458788937	/nfs/dbraw/zinc/78/89/37/458788937.db2.gz	SJQCWNQVBPFFBR-UHFFFAOYSA-N	0	3	334.508	3.078	20	30		EGEDHN
Cc1cccc2c1CC[C@H]2NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000547768162	458789139	/nfs/dbraw/zinc/78/91/39/458789139.db2.gz	REGQKPFNJFSFET-FXAWDEMLSA-N	0	3	329.403	3.353	20	30		EGEDHN
C[C@@H](NC(=O)OC(C)(C)C)[C@H]1CCN(Cc2cc(C#N)cs2)C1	ZINC000495068373	458793664	/nfs/dbraw/zinc/79/36/64/458793664.db2.gz	RMQJFBOSGJNVFE-OCCSQVGLSA-N	0	3	335.473	3.355	20	30		EGEDHN
CC(C)Cc1ccc([C@H](CNC(=O)N(C)C[C@H](C)C#N)N(C)C)cc1	ZINC000513397571	458793993	/nfs/dbraw/zinc/79/39/93/458793993.db2.gz	WBBABMAJTMIEJG-APWZRJJASA-N	0	3	344.503	3.289	20	30		EGEDHN
C=CCC[C@H](O)CN(C)CCOc1ccc(Br)cc1	ZINC000472751549	458806963	/nfs/dbraw/zinc/80/69/63/458806963.db2.gz	OFGSVVKYMVUFNV-AWEZNQCLSA-N	0	3	328.250	3.087	20	30		EGEDHN
CCN(C[C@H]1CCCN1CC)C(=O)CSCc1ccc(C#N)cc1	ZINC000547798485	458795583	/nfs/dbraw/zinc/79/55/83/458795583.db2.gz	NPZFGRMKRUPXME-GOSISDBHSA-N	0	3	345.512	3.124	20	30		EGEDHN
C[C@H]1CN(CCCNc2ccc(C(F)(F)F)cc2C#N)CCCO1	ZINC000432850897	458800530	/nfs/dbraw/zinc/80/05/30/458800530.db2.gz	IEFXKJHVVADEAU-ZDUSSCGKSA-N	0	3	341.377	3.490	20	30		EGEDHN
C=CCN1CCC(N[C@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)CC1	ZINC000514867935	458802905	/nfs/dbraw/zinc/80/29/05/458802905.db2.gz	YGYVGYCQSBKDDE-OAHLLOKOSA-N	0	3	343.349	3.438	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC[C@@H](CN(C)C)c1ccc(Cl)cc1	ZINC000516557319	458818933	/nfs/dbraw/zinc/81/89/33/458818933.db2.gz	IQJDKMXRLKADLT-HOCLYGCPSA-N	0	3	338.879	3.083	20	30		EGEDHN
COc1cc(CNC[C@H](c2ccco2)N2CCCC2)ccc1C#N	ZINC000440810184	458856084	/nfs/dbraw/zinc/85/60/84/458856084.db2.gz	OIYMUGGKSWFKGH-QGZVFWFLSA-N	0	3	325.412	3.087	20	30		EGEDHN
C=CCNC(=O)CN1CCc2ccccc2[C@H](c2ccccc2)[C@@H]1C	ZINC000441088852	458886167	/nfs/dbraw/zinc/88/61/67/458886167.db2.gz	ADSYFWWCCPYLBX-JTSKRJEESA-N	0	3	334.463	3.367	20	30		EGEDHN
C=CCn1c(CC2CCCC2)nnc1N1C[C@H](C)N(CC)C[C@@H]1C	ZINC000554924330	458902569	/nfs/dbraw/zinc/90/25/69/458902569.db2.gz	KAWISFFHZIASGQ-HOTGVXAUSA-N	0	3	331.508	3.116	20	30		EGEDHN
C=C(C)Cn1c(-c2ccc(C)o2)nnc1N1CCN(C)[C@@H](C(C)C)C1	ZINC000555242767	458904368	/nfs/dbraw/zinc/90/43/68/458904368.db2.gz	YGAKWBFSLOABLN-MRXNPFEDSA-N	0	3	343.475	3.199	20	30		EGEDHN
C=CCN(Cc1cc(Br)ccc1F)C(=O)[C@@H](N)C(C)C	ZINC000457382801	458939090	/nfs/dbraw/zinc/93/90/90/458939090.db2.gz	XNLNTXVKBXPJHF-AWEZNQCLSA-N	0	3	343.240	3.086	20	30		EGEDHN
N#Cc1ccc(OCCN2CC[C@@]3(C2)CCc2ccccc2O3)cc1	ZINC000577563438	459051563	/nfs/dbraw/zinc/05/15/63/459051563.db2.gz	QSKPPKZZBBKACZ-OAQYLSRUSA-N	0	3	334.419	3.407	20	30		EGEDHN
Cn1ccnc1[C@H]1OCCC[C@@H]1NCc1ccc(C(C)(C)C#N)cc1	ZINC000594504326	459064360	/nfs/dbraw/zinc/06/43/60/459064360.db2.gz	NFWGZYMKUSDHHJ-ROUUACIJSA-N	0	3	338.455	3.231	20	30		EGEDHN
C=CCc1ccc(OC[C@@H](O)CN[C@@H]2CCCC[C@H]2F)c(OC)c1	ZINC000577742410	459087778	/nfs/dbraw/zinc/08/77/78/459087778.db2.gz	PPUSHNWZGHSPJP-GVDBMIGSSA-N	0	3	337.435	3.034	20	30		EGEDHN
Cc1cc(C#N)cnc1C(=O)N[C@H](CN1CCCCC1)c1ccccc1	ZINC000590211959	459100851	/nfs/dbraw/zinc/10/08/51/459100851.db2.gz	CGDDFBAXTNRXRN-LJQANCHMSA-N	0	3	348.450	3.219	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N1CCN([C@@H]2C[C@@H]2C)C[C@H](C)C1	ZINC000558023843	459126215	/nfs/dbraw/zinc/12/62/15/459126215.db2.gz	FRBTWKYMWMPTLR-XYJFISCASA-N	0	3	328.456	3.054	20	30		EGEDHN
CC(C#N)C(=O)N1CCCC[C@@H]1[C@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC000496295788	459140822	/nfs/dbraw/zinc/14/08/22/459140822.db2.gz	QNDDPCGBOQHYGN-OWCLPIDISA-N	0	3	349.475	3.174	20	30		EGEDHN
CN1CCC[C@H](CNC(=O)c2ccc(C#Cc3ccccc3)cc2)C1	ZINC000521726860	459174836	/nfs/dbraw/zinc/17/48/36/459174836.db2.gz	RDICMBOSOJLBHO-HXUWFJFHSA-N	0	3	332.447	3.158	20	30		EGEDHN
CO[C@@](C)(CNCc1cc(C#N)cs1)COCc1ccccc1	ZINC000594974194	459200767	/nfs/dbraw/zinc/20/07/67/459200767.db2.gz	HVEURHJEJWUPBL-SFHVURJKSA-N	0	3	330.453	3.331	20	30		EGEDHN
C[C@H](N[C@@H](c1ccc(F)c(Cl)c1)C1CC1)C(=O)NC1(C#N)CCC1	ZINC000590751378	459204288	/nfs/dbraw/zinc/20/42/88/459204288.db2.gz	VCRDCXXJWUIFMV-MEDUHNTESA-N	0	3	349.837	3.471	20	30		EGEDHN
CC(C)Cc1ccc([C@H](CNC(=O)NCC2(C#N)CC2)N(C)C)cc1	ZINC000568125750	459230297	/nfs/dbraw/zinc/23/02/97/459230297.db2.gz	PBUOFTSEIPNOQW-SFHVURJKSA-N	0	3	342.487	3.091	20	30		EGEDHN
C[C@@H](CN1CCN(c2nccnc2C#N)C[C@@H]1C)C1CCCCC1	ZINC000559113738	459238347	/nfs/dbraw/zinc/23/83/47/459238347.db2.gz	XSTYRJLZVUPIOH-HOTGVXAUSA-N	0	3	327.476	3.075	20	30		EGEDHN
CC[C@H](N[C@H]1CC(=O)N(c2ccc(OC)cc2)C1)c1ccc(C#N)cc1	ZINC000595077339	459238916	/nfs/dbraw/zinc/23/89/16/459238916.db2.gz	HBKCQAZYCZVPAE-PXNSSMCTSA-N	0	3	349.434	3.413	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)NC(=O)N1CC[C@H](N2CCCC2)C1	ZINC000579086347	459242523	/nfs/dbraw/zinc/24/25/23/459242523.db2.gz	TWJLBMBKMNFDAL-OALUTQOASA-N	0	3	327.472	3.054	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CCO[C@@H](c2ccccc2)C1	ZINC000559271596	459248175	/nfs/dbraw/zinc/24/81/75/459248175.db2.gz	LETLSZXRFRIRPB-WOJBJXKFSA-N	0	3	334.419	3.359	20	30		EGEDHN
CCN(C[C@H](C)C#N)C(=O)CN1CCC[C@H](c2ccc(F)cc2)CC1	ZINC000481426106	459254038	/nfs/dbraw/zinc/25/40/38/459254038.db2.gz	MTUDJPZAXAHPBR-SJORKVTESA-N	0	3	345.462	3.403	20	30		EGEDHN
N#Cc1ccc(C2(NC(=O)C[C@@H]3NCc4ccccc43)CCC2)cc1	ZINC000595250980	459262879	/nfs/dbraw/zinc/26/28/79/459262879.db2.gz	SPRUTWDWOQCORY-IBGZPJMESA-N	0	3	331.419	3.288	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC(c3ccccc3F)CC2)CC1	ZINC000522975021	459274998	/nfs/dbraw/zinc/27/49/98/459274998.db2.gz	LGHMUWZDRAMNHO-UHFFFAOYSA-N	0	3	345.462	3.365	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCN2CCSC[C@@H]2C2CC2)cc1Cl	ZINC000591039246	459299196	/nfs/dbraw/zinc/29/91/96/459299196.db2.gz	JNGOMLGGPRVNKB-MRXNPFEDSA-N	0	3	349.887	3.368	20	30		EGEDHN
CC(C)(C)OC(=O)NC(C)(C)CN[C@@H]1CCc2ccc(C#N)cc21	ZINC000496728887	459303734	/nfs/dbraw/zinc/30/37/34/459303734.db2.gz	YMBLDGBKNPKXTR-MRXNPFEDSA-N	0	3	329.444	3.438	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)NC[C@@H](c1ccc(CC)cc1)N(C)C)OCC	ZINC000534416882	459326484	/nfs/dbraw/zinc/32/64/84/459326484.db2.gz	WTJJRAZLRBPYIP-RBUKOAKNSA-N	0	3	332.488	3.339	20	30		EGEDHN
C[C@@H](NC(C)(C)CNC(=O)Nc1cccc(C#N)n1)c1ccccc1	ZINC000568746505	459338695	/nfs/dbraw/zinc/33/86/95/459338695.db2.gz	OPOSLZOBLFPHAI-CQSZACIVSA-N	0	3	337.427	3.204	20	30		EGEDHN
CC(C)N1CCN(c2cccc(NC[C@@H](C#N)CCC#N)c2)CC1	ZINC000560414406	459340470	/nfs/dbraw/zinc/34/04/70/459340470.db2.gz	OIAMIEWZYGXJIU-QGZVFWFLSA-N	0	3	325.460	3.072	20	30		EGEDHN
C[C@@H]1CCN(CCNC(=O)c2cn(CCCC#N)c3ccccc23)C1	ZINC000568818801	459348585	/nfs/dbraw/zinc/34/85/85/459348585.db2.gz	ZLGDLPHPKQBKEE-MRXNPFEDSA-N	0	3	338.455	3.017	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC(=Nn2cnnc2)C[C@H]1c1ccccc1	ZINC000496876594	459355767	/nfs/dbraw/zinc/35/57/67/459355767.db2.gz	RBJPQXMGYGAMAW-INIZCTEOSA-N	0	3	341.415	3.254	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N(C)CCN1CCCC1)c1ccc(F)c(F)c1	ZINC000483301819	459358077	/nfs/dbraw/zinc/35/80/77/459358077.db2.gz	HICQXMGETQAJRZ-KRWDZBQOSA-N	0	3	337.414	3.319	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CC[C@@H](O)[C@H](C2CCCC2)C1	ZINC000560507707	459360821	/nfs/dbraw/zinc/36/08/21/459360821.db2.gz	MFEDZBAXUIHVDE-SLFFLAALSA-N	0	3	340.467	3.159	20	30		EGEDHN
N#CC[C@@H]1CCCN(C[C@H](O)COc2ccccc2C(F)(F)F)C1	ZINC000595619536	459371499	/nfs/dbraw/zinc/37/14/99/459371499.db2.gz	CQSOXTULDLFKHD-KBPBESRZSA-N	0	3	342.361	3.071	20	30		EGEDHN
Cc1ccccc1[C@H](N[C@H](C)C(=O)N[C@@](C)(C#N)C(C)C)C1CC1	ZINC000540589823	459382514	/nfs/dbraw/zinc/38/25/14/459382514.db2.gz	AMBWBWWCLQOKCC-ZTNFWEORSA-N	0	3	327.472	3.479	20	30		EGEDHN
COc1cc(CN[C@H]2CCC[C@H]2NC(=O)OC(C)(C)C)ccc1C#N	ZINC000497025389	459409783	/nfs/dbraw/zinc/40/97/83/459409783.db2.gz	KOLFBMGEQVVWOA-JKSUJKDBSA-N	0	3	345.443	3.102	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](O)COCc2ccccc2Cl)c(F)c1	ZINC000591733768	459426917	/nfs/dbraw/zinc/42/69/17/459426917.db2.gz	HXBUGJKTDODMLA-MRXNPFEDSA-N	0	3	348.805	3.018	20	30		EGEDHN
CCC[C@H](NC[C@@H](O)COc1ccc(CC#N)cc1)c1ccccn1	ZINC000591734587	459427000	/nfs/dbraw/zinc/42/70/00/459427000.db2.gz	UNEGDHKNXMALFC-MJGOQNOKSA-N	0	3	339.439	3.018	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1CCCCC1=Nn1cnnc1	ZINC000497080938	459430477	/nfs/dbraw/zinc/43/04/77/459430477.db2.gz	UXVSYSLNLDBBBR-UKRRQHHQSA-N	0	3	333.436	3.072	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](O)COCc2ccccc2F)cc1Cl	ZINC000591765793	459431358	/nfs/dbraw/zinc/43/13/58/459431358.db2.gz	IKIFJJJVYUMAHR-MRXNPFEDSA-N	0	3	348.805	3.018	20	30		EGEDHN
N#Cc1cnn2cc(CN3CCC[C@@H]3CCc3ccccc3)cnc12	ZINC000582905882	459449818	/nfs/dbraw/zinc/44/98/18/459449818.db2.gz	WNIFCPVRMPKZSZ-LJQANCHMSA-N	0	3	331.423	3.198	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1N[C@@H](C)C(=O)N[C@H](C)c1ccc2c(c1)CCCC2	ZINC000569436902	459450346	/nfs/dbraw/zinc/45/03/46/459450346.db2.gz	ZQJISBKGHUVMAW-ITKAJJHTSA-N	0	3	342.483	3.064	20	30		EGEDHN
CN1CC[C@]2(CCN(C(=O)c3ccc(C#Cc4ccccc4)cc3)C2)C1	ZINC000561772926	459483242	/nfs/dbraw/zinc/48/32/42/459483242.db2.gz	CIVJBRIZXSIFOW-QHCPKHFHSA-N	0	3	344.458	3.254	20	30		EGEDHN
CN1CC[C@@H](NC(=O)N2CCC(CCC#N)CC2)[C@H]1c1ccccc1	ZINC000591959960	459498107	/nfs/dbraw/zinc/49/81/07/459498107.db2.gz	KYNLPFSCLLYJCU-RTBURBONSA-N	0	3	340.471	3.157	20	30		EGEDHN
N#Cc1ccc(N2CCC[C@@H](N[C@H]3CCc4ccccc43)C2=O)cc1	ZINC000541881721	459504868	/nfs/dbraw/zinc/50/48/68/459504868.db2.gz	LYWFRIZKOYSQQN-VQTJNVASSA-N	0	3	331.419	3.331	20	30		EGEDHN
C=C(CN(C)C)C(=O)NCc1cc(C)cc(NC(=O)OC(C)(C)C)c1	ZINC000497272368	459511207	/nfs/dbraw/zinc/51/12/07/459511207.db2.gz	PWDGYHRIQRHSMM-UHFFFAOYSA-N	0	3	347.459	3.076	20	30		EGEDHN
C[C@@H]1CCN(CC(=O)NCc2ccc(C#N)cc2)[C@@H]2CCCC[C@@H]12	ZINC000562140550	459513419	/nfs/dbraw/zinc/51/34/19/459513419.db2.gz	DAEIKVSZQPLDJI-AYOQOUSVSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)CCc2ccc([C@@H]3C[C@H]3C)o2)CC1	ZINC000592076551	459520815	/nfs/dbraw/zinc/52/08/15/459520815.db2.gz	FGIHRJAJRXVKAR-CRAIPNDOSA-N	0	3	330.472	3.492	20	30		EGEDHN
Cc1ccc(NC(=O)[C@H]2CCCN(Cc3ccc(C#N)c(C)c3)C2)nc1	ZINC000488235085	459540559	/nfs/dbraw/zinc/54/05/59/459540559.db2.gz	UKKDDMVEYSRAIE-IBGZPJMESA-N	0	3	348.450	3.421	20	30		EGEDHN
C[C@@H]1C[C@@H]1N1CCN(c2nc3cc(Cl)ccn3c2C#N)C[C@@H](C)C1	ZINC000488735813	459550662	/nfs/dbraw/zinc/55/06/62/459550662.db2.gz	PLMBUIKKJMCUEY-GUTXKFCHSA-N	0	3	343.862	3.026	20	30		EGEDHN
COc1ccc([C@H](CCC#N)NC[C@H](CO)Cc2ccco2)cc1	ZINC000562499109	459572714	/nfs/dbraw/zinc/57/27/14/459572714.db2.gz	YUZISRUPVKFRRL-BEFAXECRSA-N	0	3	328.412	3.074	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1)C(C)C	ZINC000498379511	459588187	/nfs/dbraw/zinc/58/81/87/459588187.db2.gz	ZEIVSUVJKCZHDV-QGZVFWFLSA-N	0	3	331.416	3.023	20	30		EGEDHN
C#CCN(Cc1ccccc1)C(=O)NCc1ccc(CN(C)C)cc1	ZINC000491145260	459600939	/nfs/dbraw/zinc/60/09/39/459600939.db2.gz	KMQNGGIWWDRVEO-UHFFFAOYSA-N	0	3	335.451	3.093	20	30		EGEDHN
CCN(Cc1cnc2c(C#N)cnn2c1)[C@@H](C)Cc1ccsc1	ZINC000592509063	459618004	/nfs/dbraw/zinc/61/80/04/459618004.db2.gz	HKDCVBLBZHJHHL-ZDUSSCGKSA-N	0	3	325.441	3.116	20	30		EGEDHN
C=C[C@@H]1CCCCN1C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@@H]1C	ZINC000573353857	459663893	/nfs/dbraw/zinc/66/38/93/459663893.db2.gz	FWXQWGIYPAUTKV-BHIYHBOVSA-N	0	3	327.472	3.400	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H]2C[C@@H](C)C[C@H](c3ccccc3)C2)CC1	ZINC000491771761	459669577	/nfs/dbraw/zinc/66/95/77/459669577.db2.gz	PHWDLSLYCWRCHL-DZFGPLHGSA-N	0	3	338.495	3.420	20	30		EGEDHN
CC1(C)CN(C(=O)C(C#N)Cc2ccc(C#N)cc2)[C@H]1c1cccnc1	ZINC000592800972	459693506	/nfs/dbraw/zinc/69/35/06/459693506.db2.gz	DWDHNHDCURLZID-MOPGFXCFSA-N	0	3	344.418	3.245	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)NCCN1CCCC[C@H]1CC	ZINC000500864684	459699691	/nfs/dbraw/zinc/69/96/91/459699691.db2.gz	KMJPVMVIHUTPQN-GOSISDBHSA-N	0	3	345.487	3.315	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N[C@@H](CCO)c1ccccc1F	ZINC000592879438	459710622	/nfs/dbraw/zinc/71/06/22/459710622.db2.gz	AWXVOLKZTIUMPN-LPHOPBHVSA-N	0	3	340.398	3.138	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@@H]1CCN(C(C)(C)C)C1	ZINC000596677287	459724689	/nfs/dbraw/zinc/72/46/89/459724689.db2.gz	UZMJEDSVWHYOGJ-GOSISDBHSA-N	0	3	342.487	3.351	20	30		EGEDHN
C[C@H]1CN(CCC(=O)N(C)CCC#N)CCc2ccc(Cl)cc21	ZINC000593066555	459762367	/nfs/dbraw/zinc/76/23/67/459762367.db2.gz	NNDWFOVNCQBSRW-AWEZNQCLSA-N	0	3	333.863	3.064	20	30		EGEDHN
CCN(CCC#N)C(=O)CN1CCC[C@@H](Cc2ccc(C)cc2)C1	ZINC000563868601	459768602	/nfs/dbraw/zinc/76/86/02/459768602.db2.gz	RDWZCYKJYSIVIC-IBGZPJMESA-N	0	3	327.472	3.012	20	30		EGEDHN
C=CCOc1ccc(CN2CCC[C@@H](c3nc(N(C)C)no3)C2)cc1	ZINC000564285009	459772323	/nfs/dbraw/zinc/77/23/23/459772323.db2.gz	VREKMXPGGRJEDI-MRXNPFEDSA-N	0	3	342.443	3.080	20	30		EGEDHN
C[C@@H](NCC(=O)N[C@@](C)(C#N)C1CC1)c1ccc(F)c2ccccc21	ZINC000565269789	459782583	/nfs/dbraw/zinc/78/25/83/459782583.db2.gz	JXHLUVVYVRCEFN-XCLFUZPHSA-N	0	3	339.414	3.438	20	30		EGEDHN
Cc1csc(C(C#N)C(=O)c2ccc(O[C@@H]3CCOC3)cc2)n1	ZINC000584697937	459784980	/nfs/dbraw/zinc/78/49/80/459784980.db2.gz	HKPVDJIMGQBZFT-HUUCEWRRSA-N	0	3	328.393	3.109	20	30		EGEDHN
N#C[C@H]1CC[C@@H](NCc2cccc(NC(=O)NCc3ccncc3)c2)C1	ZINC000565636969	459786382	/nfs/dbraw/zinc/78/63/82/459786382.db2.gz	DBKIMMIXWFWZCJ-FUHWJXTLSA-N	0	3	349.438	3.185	20	30		EGEDHN
Cc1ccc(CN(CCN(C)C)C(=O)CC2(C#N)CCCCC2)o1	ZINC000596973243	459807997	/nfs/dbraw/zinc/80/79/97/459807997.db2.gz	OTPJLBFTLYBEOX-UHFFFAOYSA-N	0	3	331.460	3.342	20	30		EGEDHN
CN(C)CCOc1ccccc1CNC(=O)CC1(C#N)CCCCC1	ZINC000596993892	459813833	/nfs/dbraw/zinc/81/38/33/459813833.db2.gz	XRJMCARNMRKQCR-UHFFFAOYSA-N	0	3	343.471	3.107	20	30		EGEDHN
Cn1cc([C@H]2N(C(=O)C(C#N)CCc3ccccc3)CC2(C)C)cn1	ZINC000574762973	459868232	/nfs/dbraw/zinc/86/82/32/459868232.db2.gz	CBPHGKVWJZHFJY-SJLPKXTDSA-N	0	3	336.439	3.102	20	30		EGEDHN
CN(c1ccccc1)[C@@H]1CCN(C(=O)C(C#N)CCc2ccccc2)C1	ZINC000598378052	459883155	/nfs/dbraw/zinc/88/31/55/459883155.db2.gz	FHOJNCNVVXOYTI-TZIWHRDSSA-N	0	3	347.462	3.496	20	30		EGEDHN
CO[C@@H](CNC(=O)C(C#N)CCc1ccccc1)C1CCCCC1	ZINC000598437839	459898833	/nfs/dbraw/zinc/89/88/33/459898833.db2.gz	QJMDTWFINVRZPQ-MOPGFXCFSA-N	0	3	328.456	3.470	20	30		EGEDHN
Cc1cc(CNc2ccc(CN3CCC(O)CC3)cc2)ccc1C#N	ZINC000618193465	459928581	/nfs/dbraw/zinc/92/85/81/459928581.db2.gz	GITAITUATUJRPU-UHFFFAOYSA-N	0	3	335.451	3.436	20	30		EGEDHN
C=CCn1c([C@@H]2CC[C@H](C)O2)nnc1N1CCN(C(C)(C)CC)CC1	ZINC000624843299	459930596	/nfs/dbraw/zinc/93/05/96/459930596.db2.gz	LTQREURZQVPKIP-HOTGVXAUSA-N	0	3	347.507	3.015	20	30		EGEDHN
C[C@@H](N[C@H]1CCc2cc(C#N)ccc21)c1cccc(-n2ccnn2)c1	ZINC000588230264	459935235	/nfs/dbraw/zinc/93/52/35/459935235.db2.gz	QFBIZUKFKNSYQY-VLIAUNLRSA-N	0	3	329.407	3.477	20	30		EGEDHN
CC(C)[C@H]1CN(C(=O)c2ccccc2Oc2ccccc2C#N)CCN1	ZINC000598569106	459942197	/nfs/dbraw/zinc/94/21/97/459942197.db2.gz	AHMCUYXIXWJCAN-GOSISDBHSA-N	0	3	349.434	3.421	20	30		EGEDHN
CN(Cc1ccccc1)C[C@H](O)COc1cc(Cl)cc(C#N)c1	ZINC000588316024	459946564	/nfs/dbraw/zinc/94/65/64/459946564.db2.gz	ZDKFTYSRAZGDCP-KRWDZBQOSA-N	0	3	330.815	3.083	20	30		EGEDHN
CC(C)(C#N)C[C@@H](O)CN1CC[C@@H](OCCCc2ccccc2)C1	ZINC000598591752	459955085	/nfs/dbraw/zinc/95/50/85/459955085.db2.gz	AZZMMYDQYJKUNN-RTBURBONSA-N	0	3	330.472	3.011	20	30		EGEDHN
N#Cc1ccccc1-c1ccccc1C(=O)N[C@H]1CCN(CC2CC2)C1	ZINC000609383264	459955815	/nfs/dbraw/zinc/95/58/15/459955815.db2.gz	KPZJPDDQEHXMRR-SFHVURJKSA-N	0	3	345.446	3.439	20	30		EGEDHN
C[C@@H](CCC#N)CNCc1nnc2c(Cl)cc(C(F)(F)F)cn12	ZINC000602509941	459975361	/nfs/dbraw/zinc/97/53/61/459975361.db2.gz	IEECGZHZQVLOLU-VIFPVBQESA-N	0	3	345.756	3.431	20	30		EGEDHN
C=CCN1CCC(NCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1	ZINC000602540586	459990585	/nfs/dbraw/zinc/99/05/85/459990585.db2.gz	QRQZFFWLPLTMQU-UHFFFAOYSA-N	0	3	343.349	3.354	20	30		EGEDHN
C[C@@H](NC(=O)NCCN1CCCC(C)(C)C1)c1cccc(C#N)c1	ZINC000618391249	459995728	/nfs/dbraw/zinc/99/57/28/459995728.db2.gz	IPRPAOIPKIUBMK-OAHLLOKOSA-N	0	3	328.460	3.040	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CNCc1ccc(OCC(F)(F)F)cc1	ZINC000598699919	459998595	/nfs/dbraw/zinc/99/85/95/459998595.db2.gz	JKFDOCSIOIUIBF-ZDUSSCGKSA-N	0	3	330.350	3.018	20	30		EGEDHN
CC[C@H](C)C(=O)Nc1cccc(CNC[C@@H](O)CC(C)(C)C#N)c1	ZINC000598700414	459998636	/nfs/dbraw/zinc/99/86/36/459998636.db2.gz	NEGXWFPAHAZYQR-YOEHRIQHSA-N	0	3	331.460	3.062	20	30		EGEDHN
COc1ccc([C@H](CN(C)C)NC(=O)CC2(C#N)CCCCC2)cc1	ZINC000597634440	460013991	/nfs/dbraw/zinc/01/39/91/460013991.db2.gz	RZWXFKQEPVSJEF-SFHVURJKSA-N	0	3	343.471	3.278	20	30		EGEDHN
CN(C)[C@@H](CNCc1cccc(C#N)n1)c1cccc(C(F)(F)F)c1	ZINC000602620319	460026819	/nfs/dbraw/zinc/02/68/19/460026819.db2.gz	VFJOIFXLFGTFBT-KRWDZBQOSA-N	0	3	348.372	3.365	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)C(=O)NC[C@H](C)N1CCCC[C@@H]1C	ZINC000593963469	460031144	/nfs/dbraw/zinc/03/11/44/460031144.db2.gz	NNUYBVGOPSBSBZ-IKGGRYGDSA-N	0	3	327.472	3.116	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)C(=O)N(CCN(C)C)c1ccccc1	ZINC000593969426	460033132	/nfs/dbraw/zinc/03/31/32/460033132.db2.gz	GWFDICVODRDBOA-KRWDZBQOSA-N	0	3	335.451	3.332	20	30		EGEDHN
CC(C)Oc1ccc([C@H](CNCc2cccc(C#N)n2)N(C)C)cc1	ZINC000602667340	460053750	/nfs/dbraw/zinc/05/37/50/460053750.db2.gz	QCYRXEUIMBKJNQ-FQEVSTJZSA-N	0	3	338.455	3.133	20	30		EGEDHN
CC[C@H](N[C@H]1CCN(C(=O)C2CCCC2)C1)c1ccc(C#N)cc1	ZINC000618571416	460067482	/nfs/dbraw/zinc/06/74/82/460067482.db2.gz	MMMXKBBCPVVSDT-OALUTQOASA-N	0	3	325.456	3.390	20	30		EGEDHN
CC(C)(CC#N)CNCc1ccc(I)s1	ZINC000602689308	460067658	/nfs/dbraw/zinc/06/76/58/460067658.db2.gz	BKVHQWNEDDRCKL-UHFFFAOYSA-N	0	3	334.226	3.382	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN1CCSC2(CCC2)CC1	ZINC000576125137	460075919	/nfs/dbraw/zinc/07/59/19/460075919.db2.gz	BJUJBVWLFJADOP-UHFFFAOYSA-N	0	3	335.498	3.310	20	30		EGEDHN
N#Cc1cccc(CN[C@@H]2CCN(c3ccc(Cl)cc3F)C2)n1	ZINC000602723364	460086607	/nfs/dbraw/zinc/08/66/07/460086607.db2.gz	FNVDSBPKMVQRKK-OAHLLOKOSA-N	0	3	330.794	3.114	20	30		EGEDHN
Cc1cccc2c1ncc(C#N)c2N1CCN(c2ccncc2)CC1	ZINC000610245163	460095049	/nfs/dbraw/zinc/09/50/49/460095049.db2.gz	BIOSTSNQPWELOB-UHFFFAOYSA-N	0	3	329.407	3.137	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@H](C)CC[S@](C)=O)cc1OC	ZINC000598966775	460108820	/nfs/dbraw/zinc/10/88/20/460108820.db2.gz	HILHRWJIMSVTAQ-IPQOISQHSA-N	0	3	345.892	3.160	20	30		EGEDHN
Cc1cc(C#N)ccc1CN(C)CCN1CCN(c2ccccc2)CC1	ZINC000614400606	460128775	/nfs/dbraw/zinc/12/87/75/460128775.db2.gz	AUIWOHRFVDRQJU-UHFFFAOYSA-N	0	3	348.494	3.121	20	30		EGEDHN
CC[C@@H](C)[C@@H]1CN(CC2(CC#N)CC2)CCN1CC1(CC#N)CC1	ZINC000602802475	460134665	/nfs/dbraw/zinc/13/46/65/460134665.db2.gz	USKUOAUCGROPSE-MSOLQXFVSA-N	0	3	328.504	3.406	20	30		EGEDHN
CN(CCc1ccccc1)[C@H]1CCN(C(=O)C2(C#N)CCCCC2)C1	ZINC000598194017	460198738	/nfs/dbraw/zinc/19/87/38/460198738.db2.gz	DDNSQSCQOUQRLK-IBGZPJMESA-N	0	3	339.483	3.236	20	30		EGEDHN
COc1ccc(C(NCCOCCC#N)c2ccc(OC)cc2)cc1	ZINC000602988204	460213145	/nfs/dbraw/zinc/21/31/45/460213145.db2.gz	BUXHACYUQFNIRK-UHFFFAOYSA-N	0	3	340.423	3.313	20	30		EGEDHN
C[C@@H]1CO[C@@H](c2ccccc2Cl)CN1C(=O)[C@H](N)CCCCC#N	ZINC000594433845	460218894	/nfs/dbraw/zinc/21/88/94/460218894.db2.gz	IBMJLPMEZXAOJW-KBRIMQKVSA-N	0	3	349.862	3.040	20	30		EGEDHN
CCCN(Cc1ccc(C#N)cc1)C(=O)N[C@H](CC)CN1CCCC1	ZINC000610722171	460225492	/nfs/dbraw/zinc/22/54/92/460225492.db2.gz	TXFZWZOMRODMIS-LJQANCHMSA-N	0	3	342.487	3.354	20	30		EGEDHN
COC(=O)c1[nH]c(C)c(C(=O)C(C#N)c2ccc3ccccc3n2)c1C	ZINC000610871177	460253093	/nfs/dbraw/zinc/25/30/93/460253093.db2.gz	RNBUUYZCZXXQPM-CQSZACIVSA-N	0	3	347.374	3.456	20	30		EGEDHN
N#Cc1ccc(CNc2ccc(CN3CCC(O)CC3)cc2)c(F)c1	ZINC000610946957	460264261	/nfs/dbraw/zinc/26/42/61/460264261.db2.gz	USKTWRFLBBAYCN-UHFFFAOYSA-N	0	3	339.414	3.266	20	30		EGEDHN
CC[C@H]1CN(C(=O)C(C)C)CC[C@@H]1NCc1ccc(C#N)cc1F	ZINC000610947064	460264447	/nfs/dbraw/zinc/26/44/47/460264447.db2.gz	BUIJQRNLRSYJGY-YJBOKZPZSA-N	0	3	331.435	3.070	20	30		EGEDHN
CC(C)[C@@H]1CN(C[C@@H](O)CC(C)(C)C#N)CCN1Cc1ccccc1	ZINC000599548999	460272116	/nfs/dbraw/zinc/27/21/16/460272116.db2.gz	LWAABUGACXCQNP-PMACEKPBSA-N	0	3	343.515	3.130	20	30		EGEDHN
CC#CC[C@@H](CO)NCc1cccc(OCc2cccc(C#N)c2)c1	ZINC000603432652	460304590	/nfs/dbraw/zinc/30/45/90/460304590.db2.gz	ODVUBUCBTNPVAK-FQEVSTJZSA-N	0	3	334.419	3.001	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN[C@@H](CCO)c1cc(Cl)cc(Cl)c1	ZINC000599676279	460307138	/nfs/dbraw/zinc/30/71/38/460307138.db2.gz	DFGZKKXDSIGQNH-GJZGRUSLSA-N	0	3	345.270	3.307	20	30		EGEDHN
CCOc1ccc(OC[C@H](O)CN[C@@H](C)c2cccc(C#N)c2)cc1	ZINC000611388966	460351200	/nfs/dbraw/zinc/35/12/00/460351200.db2.gz	OLXFECDRLKKEHG-MAUKXSAKSA-N	0	3	340.423	3.047	20	30		EGEDHN
C[C@H](NC[C@H](O)COCc1ccc(Cl)cc1)c1cccc(C#N)c1	ZINC000611388016	460351312	/nfs/dbraw/zinc/35/13/12/460351312.db2.gz	WCGMJPRBQIUDBW-LIRRHRJNSA-N	0	3	344.842	3.440	20	30		EGEDHN
Cc1nc(CNC2CCN(Cc3ccc(C#N)cc3)CC2)cs1	ZINC000611438378	460365671	/nfs/dbraw/zinc/36/56/71/460365671.db2.gz	OGMQSMSQSHOTPU-UHFFFAOYSA-N	0	3	326.469	3.077	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CC[C@@H](C(=O)N(C)c2ccccc2)C1	ZINC000619532261	460376574	/nfs/dbraw/zinc/37/65/74/460376574.db2.gz	DZOPKXLGYXFBBI-LJQANCHMSA-N	0	3	333.435	3.352	20	30		EGEDHN
N#CC1(CCCN2CCC[C@H](OCC(F)(F)F)C2)CCOCC1	ZINC000619620405	460399041	/nfs/dbraw/zinc/39/90/41/460399041.db2.gz	LOGTVGBUHGKGNY-AWEZNQCLSA-N	0	3	334.382	3.130	20	30		EGEDHN
COc1cc(-c2ccccc2)ccc1CNC1CCN(CC#N)CC1	ZINC000611584741	460410114	/nfs/dbraw/zinc/41/01/14/460410114.db2.gz	LVOASIOZVHMMAQ-UHFFFAOYSA-N	0	3	335.451	3.440	20	30		EGEDHN
C[C@@H](CNC(=O)NCc1ccc(C#N)c(Cl)c1)N1CCCC[C@@H]1C	ZINC000619756014	460432103	/nfs/dbraw/zinc/43/21/03/460432103.db2.gz	PTCJCODPTWIXDB-KBPBESRZSA-N	0	3	348.878	3.274	20	30		EGEDHN
C=CCOc1c(Cl)cc(CNC[C@H](O)[C@H](C)CC)cc1OC	ZINC000623417222	460538717	/nfs/dbraw/zinc/53/87/17/460538717.db2.gz	XHWBVLBTIREQIU-DOMZBBRYSA-N	0	3	327.852	3.410	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(OCCC)c(OC)c2)CC1	ZINC000627144666	460764465	/nfs/dbraw/zinc/76/44/65/460764465.db2.gz	PALAWIJZYQYOHS-UHFFFAOYSA-N	0	3	347.459	3.256	20	30		EGEDHN
C[C@H]1CCN(C(=O)c2ccccc2CC#N)CCN1Cc1ccccc1	ZINC000601262353	460769008	/nfs/dbraw/zinc/76/90/08/460769008.db2.gz	YUJITTKETJHKAU-SFHVURJKSA-N	0	3	347.462	3.489	20	30		EGEDHN
CCC1(CC)CN(C[C@@H](O)COc2ccc(CC#N)cc2)CCS1	ZINC000613388501	460931836	/nfs/dbraw/zinc/93/18/36/460931836.db2.gz	AQZJWLPTJNLTOE-QGZVFWFLSA-N	0	3	348.512	3.100	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H]1CCN(c2cc(C#N)ccc2[N+](=O)[O-])C1	ZINC000613425867	460943444	/nfs/dbraw/zinc/94/34/44/460943444.db2.gz	JINFEAJWLFBGEO-QGZVFWFLSA-N	0	3	336.395	3.177	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCC1CCN(Cc2ccncc2)CC1	ZINC000617976958	461049339	/nfs/dbraw/zinc/04/93/39/461049339.db2.gz	GIPVEZNJYGKGLT-UHFFFAOYSA-N	0	3	327.472	3.178	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H](C)OCc2cccc(C)c2)CC1	ZINC000630941703	461426629	/nfs/dbraw/zinc/42/66/29/461426629.db2.gz	DONQYJLMWUSWLM-QGZVFWFLSA-N	0	3	330.472	3.057	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN1CCCN(CC)C[C@H]1C	ZINC000660792844	461974199	/nfs/dbraw/zinc/97/41/99/461974199.db2.gz	JQPZZCXRJGMDRU-MRXNPFEDSA-N	0	3	347.528	3.319	20	30		EGEDHN
C=CCN(CCc1nc(-c2cccc(Cl)c2)no1)[C@H](C)COC	ZINC000661244786	462168810	/nfs/dbraw/zinc/16/88/10/462168810.db2.gz	YGALAEXWUOPPEH-CYBMUJFWSA-N	0	3	335.835	3.455	20	30		EGEDHN
C=CCNC(=O)CN[C@H](C)Cc1ccc(Cl)c(C(F)(F)F)c1	ZINC000657952334	462328320	/nfs/dbraw/zinc/32/83/20/462328320.db2.gz	FQAJTQLUHBAQFT-SNVBAGLBSA-N	0	3	334.769	3.182	20	30		EGEDHN
C=CCN(CCc1ccco1)C(=O)N[C@@H]1CCCN2CCCC[C@@H]12	ZINC000654731985	462359126	/nfs/dbraw/zinc/35/91/26/462359126.db2.gz	QIVJFMKVYUGFFZ-MSOLQXFVSA-N	0	3	331.460	3.037	20	30		EGEDHN
C[C@H](NCc1ccc(CN2CCN(C)CC2)cc1)c1ccc(C#N)cc1	ZINC000181541556	533916731	/nfs/dbraw/zinc/91/67/31/533916731.db2.gz	KLPOXWAUVNTBLW-SFHVURJKSA-N	0	3	348.494	3.156	20	30		EGEDHN
Cc1oc(NC(=O)[C@@H](C)N[C@H]2CC(C)(C)OC2(C)C)c(C#N)c1C	ZINC000132529979	534548627	/nfs/dbraw/zinc/54/86/27/534548627.db2.gz	GKCQPUFLSJIVSM-RISCZKNCSA-N	0	3	333.432	3.031	20	30		EGEDHN
C=CCN1CCC(NC(=O)/C=C/c2ccccc2OC(F)F)CC1	ZINC000171724647	526414917	/nfs/dbraw/zinc/41/49/17/526414917.db2.gz	AVHPQWZPISZOSS-BQYQJAHWSA-N	0	3	336.382	3.068	20	30		EGEDHN
C=CCN1CCC(NC(=O)Cc2csc(-c3ccc(C)o3)n2)CC1	ZINC000171719010	526423303	/nfs/dbraw/zinc/42/33/03/526423303.db2.gz	CIVCBYXJDSEMSV-UHFFFAOYSA-N	0	3	345.468	3.021	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cc(C#N)cn2C(C)(C)C)CC1	ZINC000171548328	526596488	/nfs/dbraw/zinc/59/64/88/526596488.db2.gz	QFGKJYXPKNMFJH-UHFFFAOYSA-N	0	3	343.475	3.277	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC1CCN([C@@H](C)c2ccncc2)CC1	ZINC000155312182	527027694	/nfs/dbraw/zinc/02/76/94/527027694.db2.gz	UHHZQBVNWQAORJ-INIZCTEOSA-N	0	3	327.472	3.492	20	30		EGEDHN
CCOC[C@@H]1CCN(CC#Cc2ccc(OC(F)(F)F)cc2)C1	ZINC000154270575	528937911	/nfs/dbraw/zinc/93/79/11/528937911.db2.gz	NJKIXSQSCOACQV-OAHLLOKOSA-N	0	3	327.346	3.295	20	30		EGEDHN
Cn1ncc2cc(C(=O)C(C#N)c3ccc4ccccc4n3)cnc21	ZINC000673848464	548638492	/nfs/dbraw/zinc/63/84/92/548638492.db2.gz	BGJSTUXTDSAZHD-OAHLLOKOSA-N	0	3	327.347	3.007	20	30		EGEDHN
C=C[C@H](CC(=O)N1CCCN(C[C@@H]2CCCO2)CC1)c1ccccc1	ZINC000677528386	549286617	/nfs/dbraw/zinc/28/66/17/549286617.db2.gz	VTIBOMAABJWSBQ-QUCCMNQESA-N	0	3	342.483	3.060	20	30		EGEDHN
C=C(C)[C@@H](NC(=O)N[C@H]1CCN(CC2CC2)C1)c1ccc(F)c(F)c1	ZINC000681311049	549981180	/nfs/dbraw/zinc/98/11/80/549981180.db2.gz	NJDIRORNTVKZRT-MAUKXSAKSA-N	0	3	349.425	3.366	20	30		EGEDHN
CC#CCCNC(=O)N(CCC)[C@H]1CCCN(Cc2ccccc2)C1	ZINC000681538427	550012298	/nfs/dbraw/zinc/01/22/98/550012298.db2.gz	SJDYQICVEKNFQP-FQEVSTJZSA-N	0	3	341.499	3.486	20	30		EGEDHN
COC(=O)CCCN1CCC(N=Nc2nccc3sccc32)CC1	ZINC000727061813	574638917	/nfs/dbraw/zinc/63/89/17/574638917.db2.gz	OKNXQZSJOLJRLH-UHFFFAOYSA-N	0	3	346.456	3.113	20	30		EGEDHN
C=C(C)COc1cccc(NC(=S)NC[C@@H]2CCCN2CC)c1	ZINC000727283500	574657939	/nfs/dbraw/zinc/65/79/39/574657939.db2.gz	PBFGRDDUMLTLCK-INIZCTEOSA-N	0	3	333.501	3.412	20	30		EGEDHN
CCC(=O)N[C@H](C)C(=O)C(C#N)c1nc2cc(Cl)ccc2s1	ZINC000729069498	574810546	/nfs/dbraw/zinc/81/05/46/574810546.db2.gz	FXMYRUALHRRHJK-SCZZXKLOSA-N	0	3	335.816	3.041	20	30		EGEDHN
C[C@H]1CCCC1=NNC(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000729140233	574818473	/nfs/dbraw/zinc/81/84/73/574818473.db2.gz	BWZFFDOQCGUTGU-HNNXBMFYSA-N	0	3	344.528	3.291	20	30		EGEDHN
CCCCCCCCCN(C)C(=O)NC[C@H]1CN2CCC[C@@H]2CO1	ZINC000729504344	574866262	/nfs/dbraw/zinc/86/62/62/574866262.db2.gz	HREPRMHGMUGSFC-MSOLQXFVSA-N	0	3	339.524	3.242	20	30		EGEDHN
CN(CCC(=O)Nc1sccc1C#N)CCc1ccccc1F	ZINC000731670855	575196307	/nfs/dbraw/zinc/19/63/07/575196307.db2.gz	COPDRIVSHAOKEM-UHFFFAOYSA-N	0	3	331.416	3.262	20	30		EGEDHN
C=CC[C@H](C)[NH2+]Cc1cccc(OCc2cccc(-c3nnn[n-]3)c2)c1	ZINC000735410207	575653363	/nfs/dbraw/zinc/65/33/63/575653363.db2.gz	XIKMRLAKHNIBPQ-HNNXBMFYSA-N	0	3	349.438	3.500	20	30		EGEDHN
C=CC[C@H](C)[NH2+]Cc1cccc(OCc2cccc(-c3nn[n-]n3)c2)c1	ZINC000735410207	575653365	/nfs/dbraw/zinc/65/33/65/575653365.db2.gz	XIKMRLAKHNIBPQ-HNNXBMFYSA-N	0	3	349.438	3.500	20	30		EGEDHN
COCC#CCN[C@H](Cc1ccc(F)cc1)c1ccc(OC)cc1	ZINC000678760141	576170621	/nfs/dbraw/zinc/17/06/21/576170621.db2.gz	MFLVCYXWRQIJKR-HXUWFJFHSA-N	0	3	327.399	3.358	20	30		EGEDHN
C#CCSCCNCc1ccc(N2CCCCC2)c([N+](=O)[O-])c1	ZINC000740014519	576532456	/nfs/dbraw/zinc/53/24/56/576532456.db2.gz	KSVXBNLSXDADEA-UHFFFAOYSA-N	0	3	333.457	3.041	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2ccc(OCCC(C)C)cc2)CC1	ZINC000740748330	576623091	/nfs/dbraw/zinc/62/30/91/576623091.db2.gz	DGYIPNQEUWJTJK-UHFFFAOYSA-N	0	3	342.483	3.329	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2ccc(-n3c(C)ccc3C)cc2)CC1	ZINC000740748428	576623162	/nfs/dbraw/zinc/62/31/62/576623162.db2.gz	IISBOEBTRFWGEJ-UHFFFAOYSA-N	0	3	349.478	3.312	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)C[C@H]3c4ccccc4NC3=O)nc21	ZINC000741122410	576656478	/nfs/dbraw/zinc/65/64/78/576656478.db2.gz	QMUGCVYXVSCGBF-KBPBESRZSA-N	0	3	344.374	3.174	20	30		EGEDHN
CCN(CC)c1ccc(/C=[NH+]\C[C@H](CC(C)C)C(=O)OC)c([O-])c1	ZINC000741463196	576687962	/nfs/dbraw/zinc/68/79/62/576687962.db2.gz	ASGRXPRBCVYOTQ-DEFALTHMSA-N	0	3	334.460	3.493	20	30		EGEDHN
CC(=NNc1cccc([N+](=O)[O-])c1)c1cccc(OCCN(C)C)c1	ZINC000743525879	576811016	/nfs/dbraw/zinc/81/10/16/576811016.db2.gz	LQAMLEODWAWHMI-UHFFFAOYSA-N	0	3	342.399	3.371	20	30		EGEDHN
C#CCCCNC(=O)NC[C@@H](c1ccccc1)N1CCC(C)CC1	ZINC000743692512	576814743	/nfs/dbraw/zinc/81/47/43/576814743.db2.gz	DQTVXFXQBJIOIG-IBGZPJMESA-N	0	3	327.472	3.172	20	30		EGEDHN
C#CCN(C(=O)NC[C@@H](Cc1ccccc1)N(C)C)C1CCCCC1	ZINC000744818265	576835139	/nfs/dbraw/zinc/83/51/39/576835139.db2.gz	VKSOXPFMZZBMAQ-HXUWFJFHSA-N	0	3	341.499	3.137	20	30		EGEDHN
C#CCN(Cc1ccc(F)cc1)C(=O)NC[C@H](C)N1CCC[C@@H](C)C1	ZINC000744843328	576835481	/nfs/dbraw/zinc/83/54/81/576835481.db2.gz	HPZFEZGGUJJQQI-SJORKVTESA-N	0	3	345.462	3.091	20	30		EGEDHN
N#CCCNC(=O)CN[C@@H](CCCc1ccccc1)c1ccccc1	ZINC000027374400	1291287267	/nfs/dbraw/zinc/28/72/67/1291287267.db2.gz	AMGYQLYDUNBDBX-FQEVSTJZSA-N	0	3	335.451	3.370	20	30		EGEDHN
C[C@@H](Cc1cccc(F)c1)C(=O)C(C#N)C(=O)NC1CCCCC1	ZINC000069285174	1292239378	/nfs/dbraw/zinc/23/93/78/1292239378.db2.gz	RGBYMEXZHPLRRP-GUYCJALGSA-N	0	3	330.403	3.162	20	30		EGEDHN
N#CC(C(=O)C1CCN(c2nc3ccccc3o2)CC1)c1ccccn1	ZINC000073970723	1292330340	/nfs/dbraw/zinc/33/03/40/1292330340.db2.gz	UYGPKXLFVVWVEI-HNNXBMFYSA-N	0	3	346.390	3.316	20	30		EGEDHN
C[C@@H](NC[C@H]1CN(C2CCCCC2)C(=O)O1)c1cccc(C#N)c1	ZINC000828155453	1292436734	/nfs/dbraw/zinc/43/67/34/1292436734.db2.gz	NIRXBPJCVPDFCI-KDOFPFPSSA-N	0	3	327.428	3.362	20	30		EGEDHN
CC(=O)N[C@@H](C(=O)C(C#N)c1nc(C(C)C)cs1)C1CCCC1	ZINC000080456641	1292603917	/nfs/dbraw/zinc/60/39/17/1292603917.db2.gz	AZCYDKUIGXNQPD-DZGCQCFKSA-N	0	3	333.457	3.138	20	30		EGEDHN
CC[C@@H](C#N)Oc1cccc(CNCc2ccc([S@@](C)=O)cc2)c1	ZINC000085324371	1292720335	/nfs/dbraw/zinc/72/03/35/1292720335.db2.gz	OOMCYBNPZFOLLC-XDHUDOTRSA-N	0	3	342.464	3.395	20	30		EGEDHN
Cc1cc(C(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)nn1C(C)C	ZINC000835061375	1293195607	/nfs/dbraw/zinc/19/56/07/1293195607.db2.gz	RZGPHPJKZLCTFO-AWEZNQCLSA-N	0	3	344.802	3.387	20	30		EGEDHN
CC[C@@H](CC(F)(F)F)C(=O)C(C#N)C(=O)NCc1cccc(C)c1	ZINC000835340517	1293268217	/nfs/dbraw/zinc/26/82/17/1293268217.db2.gz	NGHCSGIHYKTJLL-KBPBESRZSA-N	0	3	340.345	3.299	20	30		EGEDHN
Cn1c(C#N)ccc1C(=O)OC[C@@H]1CCCCN1Cc1ccccc1	ZINC000835391609	1293281304	/nfs/dbraw/zinc/28/13/04/1293281304.db2.gz	JXYVTDLWWCNESK-SFHVURJKSA-N	0	3	337.423	3.108	20	30		EGEDHN
N#CC(C(=O)C[C@H]1CCCCO1)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000120071408	1293301964	/nfs/dbraw/zinc/30/19/64/1293301964.db2.gz	PVPMLAGPRFDYST-VXGBXAGGSA-N	0	3	338.766	3.086	20	30		EGEDHN
N#CC(C(=O)Nc1ccccn1)C(=O)c1ccc(-c2ccccc2F)o1	ZINC000125090779	1293494487	/nfs/dbraw/zinc/49/44/87/1293494487.db2.gz	XPAFGFOZRVOZQU-CYBMUJFWSA-N	0	3	349.321	3.442	20	30		EGEDHN
C[C@H](Oc1ccc(Cl)cc1)C(=O)C(C#N)C(=O)Nc1ccccc1	ZINC000127866339	1293575351	/nfs/dbraw/zinc/57/53/51/1293575351.db2.gz	YXNPSSVTQFSEOY-LRDDRELGSA-N	0	3	342.782	3.455	20	30		EGEDHN
CC(C)OCCC(=O)C(C#N)C(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000130499520	1293659733	/nfs/dbraw/zinc/65/97/33/1293659733.db2.gz	GNVXCZYVQSZDKJ-CYBMUJFWSA-N	0	3	343.210	3.456	20	30		EGEDHN
COc1ccc(C[C@@H](C)C(=O)C(C#N)C(=O)NC2CCCCC2)cc1	ZINC000136584062	1293818193	/nfs/dbraw/zinc/81/81/93/1293818193.db2.gz	CHIKXNHKJRFWNA-KDOFPFPSSA-N	0	3	342.439	3.032	20	30		EGEDHN
C#CCOc1ccc(CN2CCC(C(=O)NCCCCC)CC2)cc1	ZINC000153014388	1293995491	/nfs/dbraw/zinc/99/54/91/1293995491.db2.gz	IBDFZECTHXLFLZ-UHFFFAOYSA-N	0	3	342.483	3.217	20	30		EGEDHN
COc1ccc(-c2n[nH]cc2CNCc2ccc(OCC#N)cc2)cc1	ZINC000171769519	1294416838	/nfs/dbraw/zinc/41/68/38/1294416838.db2.gz	WGYGUOCBLJMFBA-UHFFFAOYSA-N	0	3	348.406	3.277	20	30		EGEDHN
COc1ccc(CN[C@H](C)c2ccc(OC)c(OC)c2)cc1C#N	ZINC000172688782	1294442131	/nfs/dbraw/zinc/44/21/31/1294442131.db2.gz	AQBHHCJLJMGGOO-CYBMUJFWSA-N	0	3	326.396	3.435	20	30		EGEDHN
N#CC(C(=O)CCC(F)(F)F)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000173979680	1294475274	/nfs/dbraw/zinc/47/52/74/1294475274.db2.gz	HSZHCISEEPTESR-QMMMGPOBSA-N	0	3	336.672	3.469	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)CC[C@H]1CC[C@H](C)O1	ZINC000173971684	1294475597	/nfs/dbraw/zinc/47/55/97/1294475597.db2.gz	IMEPSPWGLMLFDL-RRFJBIMHSA-N	0	3	344.411	3.080	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)C[C@@H](C)c1ccc(OC)cc1	ZINC000175096146	1294539118	/nfs/dbraw/zinc/53/91/18/1294539118.db2.gz	BKIXOJUGAGYYRX-PBHICJAKSA-N	0	3	330.428	3.204	20	30		EGEDHN
C#CCN(C[C@H](O)COCc1cccs1)[C@@H]1CCc2ccccc21	ZINC000175121028	1294540595	/nfs/dbraw/zinc/54/05/95/1294540595.db2.gz	JFILJHRSDMAIJM-FXAWDEMLSA-N	0	3	341.476	3.248	20	30		EGEDHN
Cc1ccc(CCCC(=O)C(C#N)C(=O)NCc2ccccc2)s1	ZINC000176017838	1294585117	/nfs/dbraw/zinc/58/51/17/1294585117.db2.gz	GTBOBGFUJIWIDQ-QGZVFWFLSA-N	0	3	340.448	3.405	20	30		EGEDHN
CC(C)(CC(=O)C(C#N)C(=O)Nc1ccccn1)c1ccc(F)cc1	ZINC000870162954	1295712298	/nfs/dbraw/zinc/71/22/98/1295712298.db2.gz	RPDYZDJDCYHAGR-HNNXBMFYSA-N	0	3	339.370	3.236	20	30		EGEDHN
COc1ccc([C@H](C)NCc2ccc(OCC#N)cc2)cc1OC	ZINC000194073683	1295939072	/nfs/dbraw/zinc/93/90/72/1295939072.db2.gz	DJYRJHSLGIIUAW-AWEZNQCLSA-N	0	3	326.396	3.457	20	30		EGEDHN
COc1ccc([C@@H](C)NCc2ccc(OCC#N)cc2)cc1OC	ZINC000194073701	1295939715	/nfs/dbraw/zinc/93/97/15/1295939715.db2.gz	DJYRJHSLGIIUAW-CQSZACIVSA-N	0	3	326.396	3.457	20	30		EGEDHN
FC(F)(F)Oc1ccc(C#CCN2CC[C@H]3OCCC[C@H]3C2)cc1	ZINC000245985394	1296333540	/nfs/dbraw/zinc/33/35/40/1296333540.db2.gz	ZOTSCDHHSHXVAS-DOTOQJQBSA-N	0	3	339.357	3.438	20	30		EGEDHN
C#CCN(C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@H]1CCc2ccccc21	ZINC000246198124	1296341620	/nfs/dbraw/zinc/34/16/20/1296341620.db2.gz	AKHQBGAYHWCTNJ-PMACEKPBSA-N	0	3	336.391	3.251	20	30		EGEDHN
N#CC(C(=O)C=Cc1nc2ccccc2s1)C(=O)Nc1ccccn1	ZINC000255863587	1296571650	/nfs/dbraw/zinc/57/16/50/1296571650.db2.gz	GKRUUAVTQSIGQN-JLVNDZCYSA-N	0	3	348.387	3.052	20	30		EGEDHN
Cc1nc(C#N)cc(N2CCN(Cc3ccccc3)[C@H](C(C)C)C2)n1	ZINC000707578612	1298230316	/nfs/dbraw/zinc/23/03/16/1298230316.db2.gz	YAWAMLLBSLJQEX-IBGZPJMESA-N	0	3	335.455	3.004	20	30		EGEDHN
C[C@@H]1CCN(Cc2ccccc2)C[C@@H]1NC(=O)c1ccc(C#N)cc1	ZINC000716261129	1298297075	/nfs/dbraw/zinc/29/70/75/1298297075.db2.gz	DFZAYRMMBFUDAG-UZLBHIALSA-N	0	3	333.435	3.199	20	30		EGEDHN
C[C@@H]1CCN(Cc2ccccc2)C[C@@H]1NC(=O)Cc1ccc(C#N)cc1	ZINC000716273163	1298297615	/nfs/dbraw/zinc/29/76/15/1298297615.db2.gz	UJKVPJBNGCEHLS-UTKZUKDTSA-N	0	3	347.462	3.128	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)[C@H](C)c1ccc(Cl)c(Cl)c1	ZINC000747108831	1298728502	/nfs/dbraw/zinc/72/85/02/1298728502.db2.gz	KEZKOHMITNAONW-MWLCHTKSSA-N	0	3	327.211	3.330	20	30		EGEDHN
N#CC(C(=O)Nc1ccccc1)C(=O)C1CC(OCc2ccccc2)C1	ZINC000747108094	1298728535	/nfs/dbraw/zinc/72/85/35/1298728535.db2.gz	LQCSBLVHNBTHDL-NKELODKYSA-N	0	3	348.402	3.329	20	30		EGEDHN
C=C(Cl)C[C@H](N)C(=O)N1CCC(C(=O)c2ccc(C)cc2C)CC1	ZINC000876602085	1298858056	/nfs/dbraw/zinc/85/80/56/1298858056.db2.gz	GWAXBEYDOYNAQN-KRWDZBQOSA-N	0	3	348.874	3.195	20	30		EGEDHN
COCC#CCOC(=O)c1cccc(CN(C)Cc2ccccc2)c1	ZINC000751779007	1299623503	/nfs/dbraw/zinc/62/35/03/1299623503.db2.gz	ABHIDGVPCASRCH-UHFFFAOYSA-N	0	3	337.419	3.125	20	30		EGEDHN
CCN1CCN(c2ccc(NC(=O)c3cc(C#N)cs3)cc2)CC1	ZINC000752276494	1299717555	/nfs/dbraw/zinc/71/75/55/1299717555.db2.gz	VXFKYRHWCPEONA-UHFFFAOYSA-N	0	3	340.452	3.014	20	30		EGEDHN
COc1ccc(NC(=O)C(C#N)C(=O)C2CC(F)(F)C2)cc1Cl	ZINC000753800692	1300022632	/nfs/dbraw/zinc/02/26/32/1300022632.db2.gz	FFUALKDQPBCJHT-JTQLQIEISA-N	0	3	342.729	3.041	20	30		EGEDHN
CCCCCCCCNC(=O)N1CCN(CC2CCOCC2)CC1	ZINC000755077874	1300279965	/nfs/dbraw/zinc/27/99/65/1300279965.db2.gz	LACBCPFKTAVMOK-UHFFFAOYSA-N	0	3	339.524	3.101	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)Cc3ccc4c(c3)COC4)nc21	ZINC000755695289	1300379554	/nfs/dbraw/zinc/37/95/54/1300379554.db2.gz	GRLAPTLAGNXMIK-INIZCTEOSA-N	0	3	331.375	3.321	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN[C@@H]2CC(=O)N(C3CCCCC3)C2)cc1	ZINC000757925001	1300758239	/nfs/dbraw/zinc/75/82/39/1300758239.db2.gz	QHPDQDXFNRMFHY-DOTOQJQBSA-N	0	3	341.455	3.001	20	30		EGEDHN
CCCN(Cn1ccc(C)c(C#N)c1=O)[C@@H]1CCc2ccccc2C1	ZINC000758199800	1300809082	/nfs/dbraw/zinc/80/90/82/1300809082.db2.gz	UDMJYMVBFYGIFT-LJQANCHMSA-N	0	3	335.451	3.255	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cc(F)c(F)c(F)c2F)CC1	ZINC000880682647	1301220288	/nfs/dbraw/zinc/22/02/88/1301220288.db2.gz	LGEUQSFZVJSZJD-UHFFFAOYSA-N	0	3	331.313	3.015	20	30		EGEDHN
COc1ccc(C(C)N=Nc2ncc(F)cn2)cc1CN1CCCC1	ZINC000760246607	1301239012	/nfs/dbraw/zinc/23/90/12/1301239012.db2.gz	MQDSYRNLXNDXTB-UHFFFAOYSA-N	0	3	343.406	3.056	20	30		EGEDHN
CCO[C@@H](CC(=O)C(C#N)C(=O)Nc1ccc(Cl)cc1)C(C)C	ZINC000761037279	1301384277	/nfs/dbraw/zinc/38/42/77/1301384277.db2.gz	FBEMJMJPYZMTER-ZBFHGGJFSA-N	0	3	336.819	3.439	20	30		EGEDHN
C#CCOc1ccc(CN(C)Cc2ccc(OC)c(OC)c2)cc1	ZINC000768168720	1302843126	/nfs/dbraw/zinc/84/31/26/1302843126.db2.gz	MISLUPVJCDCRLV-UHFFFAOYSA-N	0	3	325.408	3.348	20	30		EGEDHN
C#CCOc1ccc(CN(C)[C@H](C)CNC(=O)OC(C)(C)C)cc1	ZINC000769402212	1303106622	/nfs/dbraw/zinc/10/66/22/1303106622.db2.gz	WXKCRILJGAINEN-OAHLLOKOSA-N	0	3	332.444	3.044	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)CC[C@@H](C)SC	ZINC000773769707	1303737536	/nfs/dbraw/zinc/73/75/36/1303737536.db2.gz	KQMBZZYNLWZUOY-CHWSQXEVSA-N	0	3	334.441	3.264	20	30		EGEDHN
CCN(CC)C(=O)[C@H](Cc1ccccc1)N[C@H]1CCC[C@@H](C#N)C1	ZINC000774110516	1303775376	/nfs/dbraw/zinc/77/53/76/1303775376.db2.gz	IAZDMCAMJVUKAO-QYZOEREBSA-N	0	3	327.472	3.138	20	30		EGEDHN
C=CC[C@@H](CO)CNCc1c(C)nn(Cc2ccc(C)cc2)c1Cl	ZINC000774828552	1303865178	/nfs/dbraw/zinc/86/51/78/1303865178.db2.gz	UGTZKCQNILEFBA-QGZVFWFLSA-N	0	3	347.890	3.476	20	30		EGEDHN
C#CC[C@H](NC[C@@H](O)COc1cccc2[nH]ccc21)c1ccccc1	ZINC000775405078	1303958320	/nfs/dbraw/zinc/95/83/20/1303958320.db2.gz	VDEJPTAQCUXQNP-MJGOQNOKSA-N	0	3	334.419	3.262	20	30		EGEDHN
C#C[C@H](N[C@@H](CC)CSc1ccccc1[N+](=O)[O-])[C@@H]1CCCO1	ZINC000775571753	1303987057	/nfs/dbraw/zinc/98/70/57/1303987057.db2.gz	KYOXFTZKFGFKJG-DZKIICNBSA-N	0	3	334.441	3.236	20	30		EGEDHN
C#C[C@H](N[C@H](C)CC(=O)Nc1ccccc1C(C)C)[C@@H]1CCCO1	ZINC000775572545	1303987287	/nfs/dbraw/zinc/98/72/87/1303987287.db2.gz	SEAHIYHYXGUTNN-AYBZRNKSSA-N	0	3	328.456	3.298	20	30		EGEDHN
N#CC(C(=O)NC1CCCC1)C(=O)[C@@H]1CCc2c1cccc2Cl	ZINC000776079454	1304092010	/nfs/dbraw/zinc/09/20/10/1304092010.db2.gz	DEEOWESMRIMCFZ-HUUCEWRRSA-N	0	3	330.815	3.137	20	30		EGEDHN
C#CCOc1ccccc1NC(=O)N[C@H]1CCN(Cc2ccccc2)C1	ZINC000776085825	1304093020	/nfs/dbraw/zinc/09/30/20/1304093020.db2.gz	VEMSGBWDFWNBPV-SFHVURJKSA-N	0	3	349.434	3.095	20	30		EGEDHN
N#Cc1cccn(CN2C[C@H](c3ccccc3)[C@H]3CCCC[C@@H]32)c1=O	ZINC000776771227	1304196533	/nfs/dbraw/zinc/19/65/33/1304196533.db2.gz	GWRAXYKLUCKQNG-AQNXPRMDSA-N	0	3	333.435	3.336	20	30		EGEDHN
CN(C)CCN(C(=O)Cc1ccccc1CC#N)C1CCCCC1	ZINC000776859287	1304212556	/nfs/dbraw/zinc/21/25/56/1304212556.db2.gz	XQSISGXEIHZFFO-UHFFFAOYSA-N	0	3	327.472	3.018	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CN[C@H]1CCOC2(CCOCC2)C1	ZINC000778174245	1304409885	/nfs/dbraw/zinc/40/98/85/1304409885.db2.gz	MZQWXAADNPOTQA-HNNXBMFYSA-N	0	3	349.858	3.170	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)N(CCC)C1CCN(Cc2ccccc2)CC1	ZINC000889489689	1304500777	/nfs/dbraw/zinc/50/07/77/1304500777.db2.gz	UCZHNWUWWMZLNZ-NRFANRHFSA-N	0	3	344.499	3.217	20	30		EGEDHN
CN(C1CCCC1)C(C)(C)C(=O)OCCOc1ccc(C#N)cc1	ZINC000779122409	1304531599	/nfs/dbraw/zinc/53/15/99/1304531599.db2.gz	MIWRSLIOWKBYME-UHFFFAOYSA-N	0	3	330.428	3.133	20	30		EGEDHN
CC(=NNC1=N[C@H](C)CN1)[C@H](C)Oc1ccc(Cl)cc1Cl	ZINC000779798411	1304605974	/nfs/dbraw/zinc/60/59/74/1304605974.db2.gz	CMEMYLTUORKYOY-SCZZXKLOSA-N	0	3	329.231	3.074	20	30		EGEDHN
COc1ccc(C(C)=NN[C@@H]2CCCOC2)cc1CN1CCCCC1	ZINC000780259096	1304666758	/nfs/dbraw/zinc/66/67/58/1304666758.db2.gz	ZASQEVNDGGSESA-LJQANCHMSA-N	0	3	345.487	3.174	20	30		EGEDHN
CC[C@@H]1C[C@H](C(=O)C(C#N)C(=O)Nc2ccccc2Cl)CCO1	ZINC000780304690	1304675093	/nfs/dbraw/zinc/67/50/93/1304675093.db2.gz	ADXXHLJMUYSZBF-UPJWGTAASA-N	0	3	334.803	3.193	20	30		EGEDHN
N#CC(C(=O)CCCC(F)(F)F)C(=O)NCc1cccc(Cl)c1	ZINC000786531236	1305591325	/nfs/dbraw/zinc/59/13/25/1305591325.db2.gz	NNSACNGUQFDITO-LBPRGKRZSA-N	0	3	346.736	3.398	20	30		EGEDHN
N#CC(C(=O)COC1CCCCC1)C(=O)NCc1cccc(Cl)c1	ZINC000786531773	1305591675	/nfs/dbraw/zinc/59/16/75/1305591675.db2.gz	SUOGRPJRYLSNOX-INIZCTEOSA-N	0	3	348.830	3.014	20	30		EGEDHN
C[C@@H](N[C@@H](C)c1ccc(N2CCNC2=O)cc1)c1ccc(C#N)cc1	ZINC000786808801	1305633265	/nfs/dbraw/zinc/63/32/65/1305633265.db2.gz	FWCPIHQDXYLHJY-CABCVRRESA-N	0	3	334.423	3.500	20	30		EGEDHN
Cn1ccnc1N=NCc1cccc(OCc2cccc(C#N)c2)c1	ZINC000790302127	1306295625	/nfs/dbraw/zinc/29/56/25/1306295625.db2.gz	NRQRUHGHQXBOOT-UHFFFAOYSA-N	0	3	331.379	3.317	20	30		EGEDHN
C=C(C)CNC(=S)Nc1cc(C)cc(N2CCN(C(C)C)CC2)c1	ZINC000790340087	1306304726	/nfs/dbraw/zinc/30/47/26/1306304726.db2.gz	CSNFKXVSKVFQHY-UHFFFAOYSA-N	0	3	346.544	3.388	20	30		EGEDHN
CCN1CCCC[C@@H]1CNC(=O)C#Cc1ccc(C(F)(F)F)cc1	ZINC000790623328	1306363529	/nfs/dbraw/zinc/36/35/29/1306363529.db2.gz	PETRMHYOOCJOIX-MRXNPFEDSA-N	0	3	338.373	3.048	20	30		EGEDHN
C=CCN1CCC(NC(=S)Nc2cc(Cl)ccc2OC)CC1	ZINC000792682301	1309207380	/nfs/dbraw/zinc/20/73/80/1309207380.db2.gz	ZTBQIRPWNWCTIX-UHFFFAOYSA-N	0	3	339.892	3.285	20	30		EGEDHN
C[C@@H]1CCSCCN1CC(=O)C(C#N)c1nc2ccccc2s1	ZINC000794570491	1309548284	/nfs/dbraw/zinc/54/82/84/1309548284.db2.gz	KBCVPNZPESVOEA-OLZOCXBDSA-N	0	3	345.493	3.300	20	30		EGEDHN
C[C@H](CC(C)(C)C#N)NC[C@H]1CC(c2ccc3c(c2)CCO3)=NO1	ZINC000895980293	1309627617	/nfs/dbraw/zinc/62/76/17/1309627617.db2.gz	SWWGLSFZOADBFG-CZUORRHYSA-N	0	3	327.428	3.032	20	30		EGEDHN
N#CC[C@@H](CC(=O)C(C#N)C(=O)NC1CCCCC1)c1ccccc1	ZINC000796632346	1310050384	/nfs/dbraw/zinc/05/03/84/1310050384.db2.gz	KIBWQXGSGBMDPH-FUHWJXTLSA-N	0	3	337.423	3.232	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)COC2CCC(C)CC2)c1	ZINC000796633102	1310051250	/nfs/dbraw/zinc/05/12/50/1310051250.db2.gz	MNMYTSMDSDBALJ-IMRCBTMISA-N	0	3	328.412	3.238	20	30		EGEDHN
CN(CCC(=O)C(C#N)c1nc2ccccc2o1)C(=O)OC(C)(C)C	ZINC000796819804	1310092830	/nfs/dbraw/zinc/09/28/30/1310092830.db2.gz	SRQFLZJBBQWTJM-GFCCVEGCSA-N	0	3	343.383	3.261	20	30		EGEDHN
N#CC(C(=O)NCc1cccc(Cl)c1)C(=O)[C@H]1CCC(F)(F)C1	ZINC000796883828	1310104851	/nfs/dbraw/zinc/10/48/51/1310104851.db2.gz	FXJMRIHDJLCXRO-AAEUAGOBSA-N	0	3	340.757	3.100	20	30		EGEDHN
CCc1occc1C(=O)C(C#N)C(=O)Nc1ccc(OC)c(Cl)c1	ZINC000797548921	1310210052	/nfs/dbraw/zinc/21/00/52/1310210052.db2.gz	SKZACMLBCUREFG-LBPRGKRZSA-N	0	3	346.770	3.465	20	30		EGEDHN
CC[C@H](C)N[C@H](CNC(=O)c1ccc(C#N)cc1OC)c1ccco1	ZINC000899080360	1310928736	/nfs/dbraw/zinc/92/87/36/1310928736.db2.gz	UHQBUEDLLDJRBZ-XJKSGUPXSA-N	0	3	341.411	3.019	20	30		EGEDHN
COc1ccc2[nH]cc(C3=CCN(CCO[C@@H](C)C#N)CC3)c2c1	ZINC000801930426	1316967967	/nfs/dbraw/zinc/96/79/67/1316967967.db2.gz	PJKJRGIOFSETSQ-AWEZNQCLSA-N	0	3	325.412	3.194	20	30		EGEDHN
C=CCN1CCC(NC(=O)N(CCCC)Cc2ccccc2O)CC1	ZINC000802124094	1316980293	/nfs/dbraw/zinc/98/02/93/1316980293.db2.gz	CHXUNDRZCNUZSM-UHFFFAOYSA-N	0	3	345.487	3.354	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@H](NCc3ccc(C#N)s3)C2)c(F)c1	ZINC001019427927	1317237908	/nfs/dbraw/zinc/23/79/08/1317237908.db2.gz	QMFDPVMINILESO-ZDUSSCGKSA-N	0	3	343.427	3.072	20	30		EGEDHN
CCCNC(=O)OC[C@@H]1CCCCN1Cc1ccc(C#N)cc1C	ZINC000805775129	1317422689	/nfs/dbraw/zinc/42/26/89/1317422689.db2.gz	CFBRMVRBQMIGST-SFHVURJKSA-N	0	3	329.444	3.357	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@H]2C[C@H](NC(=O)C3=CCCCCC3)C2)c1	ZINC001020102424	1317543836	/nfs/dbraw/zinc/54/38/36/1317543836.db2.gz	USOKNFQFGBLFRU-IYARVYRRSA-N	0	3	341.430	3.325	20	30		EGEDHN
Cc1ccc(C(=O)N[C@H]2CCN(Cc3ccccc3)[C@@H]2C)cc1C#N	ZINC000807738791	1317582140	/nfs/dbraw/zinc/58/21/40/1317582140.db2.gz	GVKPKQQCVMBSSN-UZLBHIALSA-N	0	3	333.435	3.260	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CCC(CN(CC)Cc2ccccc2C#N)CC1	ZINC000957740585	1317607048	/nfs/dbraw/zinc/60/70/48/1317607048.db2.gz	UTWNFNUSDVMHGO-LJQANCHMSA-N	0	3	345.462	3.367	20	30		EGEDHN
CC[C@H](N[C@@H]1CCCN(Cc2ccccn2)C1=O)c1cccc(C#N)c1	ZINC000902950701	1317632604	/nfs/dbraw/zinc/63/26/04/1317632604.db2.gz	KCQWIMSQLDRWGA-VQTJNVASSA-N	0	3	348.450	3.185	20	30		EGEDHN
C#C[C@H](NC(=O)NC[C@H](c1ccccc1)N1CCCC1)C(C)(C)C	ZINC000808316668	1317661189	/nfs/dbraw/zinc/66/11/89/1317661189.db2.gz	VZZMTMWMOMTNBE-MSOLQXFVSA-N	0	3	327.472	3.171	20	30		EGEDHN
C#CCOc1ccc(CN[C@@H](CN(C)C)c2ccc(F)cc2)cc1	ZINC000808426942	1317675508	/nfs/dbraw/zinc/67/55/08/1317675508.db2.gz	ZNCLEISIQWWQCG-FQEVSTJZSA-N	0	3	326.415	3.230	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)Cc2ccc(C3CCC3)cc2)C1	ZINC001020441935	1317699127	/nfs/dbraw/zinc/69/91/27/1317699127.db2.gz	VFEWOEJLJDJDKG-IYARVYRRSA-N	0	3	332.875	3.486	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2C[C@H](NC(=O)[C@@]34C[C@@H]3CCCC4)C2)c(F)c1	ZINC001020567062	1317778752	/nfs/dbraw/zinc/77/87/52/1317778752.db2.gz	XYJZXTDVRVDYSX-BOSXTWCSSA-N	0	3	341.430	3.014	20	30		EGEDHN
Cc1nccn1-c1ccc(CN[C@H]2CCc3ccc(C#N)cc32)cn1	ZINC000810210965	1317977276	/nfs/dbraw/zinc/97/72/76/1317977276.db2.gz	IJLUGEKNKNJPTK-IBGZPJMESA-N	0	3	329.407	3.225	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@@H](N[C@H]1CCCN(Cc3ccccc3)C1=O)CC2	ZINC000810229023	1317981417	/nfs/dbraw/zinc/98/14/17/1317981417.db2.gz	QCUGDZGZNNBGFB-SFTDATJTSA-N	0	3	345.446	3.326	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C23CCC(CC2)CC3)C1	ZINC001021078974	1318069959	/nfs/dbraw/zinc/06/99/59/1318069959.db2.gz	SELYSHPKNVIJGY-GQFVKFBWSA-N	0	3	341.293	3.102	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)[C@@]2(C)CC=C(C)CC2)C1	ZINC001021080932	1318071858	/nfs/dbraw/zinc/07/18/58/1318071858.db2.gz	SPUKYMLMAZHGRK-DZKIICNBSA-N	0	3	341.293	3.268	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@]2(C)CCc3ccccc3C2)C1	ZINC001021157161	1318115714	/nfs/dbraw/zinc/11/57/14/1318115714.db2.gz	XQWGCSIAMMLXBR-LNLFQRSKSA-N	0	3	332.875	3.171	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cnc3cc(OC)ccc3c2)CC1	ZINC000906596544	1318122734	/nfs/dbraw/zinc/12/27/34/1318122734.db2.gz	GPULWFCDOXKASO-UHFFFAOYSA-N	0	3	339.439	3.014	20	30		EGEDHN
Cc1cc[nH]c1C(=O)NC1C[C@H]2CC[C@@H](C1)N2CC#Cc1ccccc1	ZINC001021245382	1318154379	/nfs/dbraw/zinc/15/43/79/1318154379.db2.gz	OKFSBUBICOUGJL-IHWFROFDSA-N	0	3	347.462	3.100	20	30		EGEDHN
C=CCn1cccc1C(=O)NC1C[C@H]2CC[C@@H](C1)N2C[C@H](F)CC	ZINC001021281666	1318170368	/nfs/dbraw/zinc/17/03/68/1318170368.db2.gz	LUGRXIDEQSXTFW-MGNMYUMUSA-N	0	3	333.451	3.147	20	30		EGEDHN
C=C1CC(C)(C(=O)NC2C[C@H]3CC[C@@H](C2)N3Cc2cncc(C)c2)C1	ZINC001021373395	1318218447	/nfs/dbraw/zinc/21/84/47/1318218447.db2.gz	LHUUJZZARRKCTB-YQQQUEKLSA-N	0	3	339.483	3.358	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)[C@@H]2CC=CCC2)s1	ZINC000959870599	1318242694	/nfs/dbraw/zinc/24/26/94/1318242694.db2.gz	VFXFBWFXPGUVLQ-CVEARBPZSA-N	0	3	343.496	3.447	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CCCC[C@H]1CNCc1cc(C#N)ccc1OC	ZINC000959891117	1318254138	/nfs/dbraw/zinc/25/41/38/1318254138.db2.gz	YZMWMZIMEDXTFZ-QAPCUYQASA-N	0	3	343.471	3.084	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC1CC(NCc2cnc(Cl)s2)C1	ZINC001100711210	1364230863	/nfs/dbraw/zinc/23/08/63/1364230863.db2.gz	DPUVRQNFJDBYAH-UHFFFAOYSA-N	0	3	341.908	3.383	20	30		EGEDHN
N#CC1(CCCCN2CCN(Cc3cccc(O)c3)CC2)CCC1	ZINC000929990115	1328758273	/nfs/dbraw/zinc/75/82/73/1328758273.db2.gz	REQMNWPMBMYULS-UHFFFAOYSA-N	0	3	327.472	3.374	20	30		EGEDHN
C#C[C@@H](NC(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C)C(C)C	ZINC000812380301	1318379496	/nfs/dbraw/zinc/37/94/96/1318379496.db2.gz	BUKQDIYXLNEKBZ-MOPGFXCFSA-N	0	3	345.487	3.034	20	30		EGEDHN
COc1cccc([C@H](C/N=C/c2c(O)cccc2OC)N(C)C)c1	ZINC000812396610	1318381750	/nfs/dbraw/zinc/38/17/50/1318381750.db2.gz	WYWKUWAXNBSPHW-RONKMWSCSA-N	0	3	328.412	3.131	20	30		EGEDHN
C=CCCC(=O)[C@@H]1CCCN1C(=O)[C@H]1CCN(Cc2ccccc2)C1	ZINC000908658621	1318384019	/nfs/dbraw/zinc/38/40/19/1318384019.db2.gz	FTHIELLFAKZYQC-OALUTQOASA-N	0	3	340.467	3.035	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@@H]2CN(Cc3cccc(F)c3)CC[C@@H]21	ZINC001021582134	1318425814	/nfs/dbraw/zinc/42/58/14/1318425814.db2.gz	TYECKOUDLODHFK-QUCCMNQESA-N	0	3	340.442	3.052	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)Cc1ccc(F)cc1F	ZINC000960267181	1318436563	/nfs/dbraw/zinc/43/65/63/1318436563.db2.gz	KKBLSHJDBDCPSE-UYAOXDASSA-N	0	3	342.389	3.065	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc(C)n(CC)c1C	ZINC000960282241	1318443252	/nfs/dbraw/zinc/44/32/52/1318443252.db2.gz	YKKYITGVSNVMSD-WOJBJXKFSA-N	0	3	337.467	3.296	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1c(C)cncc1C	ZINC000960283129	1318443777	/nfs/dbraw/zinc/44/37/77/1318443777.db2.gz	LTLLTUFLQUIGGU-UYAOXDASSA-N	0	3	335.451	3.260	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc(C)c(C)cn1	ZINC000960290872	1318446815	/nfs/dbraw/zinc/44/68/15/1318446815.db2.gz	KPTVHLBBUWPLEL-UYAOXDASSA-N	0	3	335.451	3.260	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1occc1Cl	ZINC000960300198	1318450361	/nfs/dbraw/zinc/45/03/61/1318450361.db2.gz	UTLSISPOOHTUTL-HZPDHXFCSA-N	0	3	330.815	3.495	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2coc3c2cccc3C)C1	ZINC001021607844	1318455286	/nfs/dbraw/zinc/45/52/86/1318455286.db2.gz	XUBUBPVMHJAZBQ-QFBILLFUSA-N	0	3	336.435	3.301	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@H]1CCOc2ccccc21	ZINC000960316782	1318458426	/nfs/dbraw/zinc/45/84/26/1318458426.db2.gz	JBGCSUBTJDGYRQ-QKNQBKEWSA-N	0	3	348.446	3.111	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cc2sccc2[nH]1	ZINC000960318128	1318459004	/nfs/dbraw/zinc/45/90/04/1318459004.db2.gz	MNYATVDMMRVNLZ-CRAIPNDOSA-N	0	3	337.448	3.401	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(C)c3ccccc3n2)C1	ZINC001021614034	1318460874	/nfs/dbraw/zinc/46/08/74/1318460874.db2.gz	NYQHGRFKHRSIIT-LAUBAEHRSA-N	0	3	347.462	3.103	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc2ccccc2n1	ZINC000960324480	1318461148	/nfs/dbraw/zinc/46/11/48/1318461148.db2.gz	DTAFELFYEANIAS-NHCUHLMSSA-N	0	3	343.430	3.406	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@H](C)c1cccc(F)c1	ZINC000960330921	1318464278	/nfs/dbraw/zinc/46/42/78/1318464278.db2.gz	WJABEFBTNLTEJN-JSNMRZPZSA-N	0	3	338.426	3.487	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2cc(C)n(CC)c2C)C1	ZINC001021623953	1318473681	/nfs/dbraw/zinc/47/36/81/1318473681.db2.gz	QLPBXUCYPABYAU-UYAOXDASSA-N	0	3	341.499	3.075	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(-c3ccco3)o2)C1	ZINC001021629569	1318483358	/nfs/dbraw/zinc/48/33/58/1318483358.db2.gz	HLXAFQCZYIGJEM-JKSUJKDBSA-N	0	3	338.407	3.099	20	30		EGEDHN
CC(COC(=O)c1ccc(Oc2ccc(CC#N)cc2)cc1)[N+](=O)[O-]	ZINC000813108350	1318500464	/nfs/dbraw/zinc/50/04/64/1318500464.db2.gz	DMNFFHIMQVSBRN-CYBMUJFWSA-N	0	3	340.335	3.367	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCN1C(=O)c1cccs1	ZINC000960377786	1318501702	/nfs/dbraw/zinc/50/17/02/1318501702.db2.gz	LMPAZJIKDAFRMX-QGZVFWFLSA-N	0	3	339.464	3.356	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc3ccccc3n2C)C1	ZINC001021661697	1318523678	/nfs/dbraw/zinc/52/36/78/1318523678.db2.gz	RBWBJNSGCORUEK-QUCCMNQESA-N	0	3	349.478	3.128	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)Cc2cc(C)ccc2C)C1	ZINC001021661816	1318525544	/nfs/dbraw/zinc/52/55/44/1318525544.db2.gz	RSACPPKUYPEIAC-FPOVZHCZSA-N	0	3	338.495	3.182	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(Cl)c(C)c2)C1	ZINC001021665459	1318527725	/nfs/dbraw/zinc/52/77/25/1318527725.db2.gz	KNXSXBYIVROTNT-FUHWJXTLSA-N	0	3	330.859	3.208	20	30		EGEDHN
CC(C)[C@H](NCc1ccc(O[C@H](C)C#N)cc1)[C@H](O)C(F)(F)F	ZINC000813327370	1318533479	/nfs/dbraw/zinc/53/34/79/1318533479.db2.gz	FULTYYNUTRJBCG-UGFHNGPFSA-N	0	3	330.350	3.015	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2ccc(C)c(F)c2F)C1	ZINC001021673112	1318536819	/nfs/dbraw/zinc/53/68/19/1318536819.db2.gz	GEBPEQOKKPXKRL-WBVHZDCISA-N	0	3	346.421	3.223	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cc(C(C)(C)C)oc2C)C1	ZINC001021679908	1318551783	/nfs/dbraw/zinc/55/17/83/1318551783.db2.gz	USELUGOLCJBDFQ-AEFFLSMTSA-N	0	3	342.483	3.445	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc3cc(F)ccc3o2)C1	ZINC001021682399	1318554800	/nfs/dbraw/zinc/55/48/00/1318554800.db2.gz	QMCXZYDQDPXYGQ-WMLDXEAASA-N	0	3	340.398	3.132	20	30		EGEDHN
CC(C)Oc1cccc(CN(C)C[C@@H]2CCCN2C(=O)[C@@H](C)C#N)c1	ZINC000960496877	1318606647	/nfs/dbraw/zinc/60/66/47/1318606647.db2.gz	UNJXLCOGGWDECU-WMZOPIPTSA-N	0	3	343.471	3.056	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2sccc2C(F)F)C1	ZINC001021723213	1318609271	/nfs/dbraw/zinc/60/92/71/1318609271.db2.gz	SBKLTDUKTNLZRN-OCCSQVGLSA-N	0	3	338.423	3.245	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2oc3ccccc3c2C)C1	ZINC001021729031	1318629103	/nfs/dbraw/zinc/62/91/03/1318629103.db2.gz	XIESEVUJHVWCKR-AEFFLSMTSA-N	0	3	336.435	3.301	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(C)c(C)s2)C1	ZINC001021730680	1318632591	/nfs/dbraw/zinc/63/25/91/1318632591.db2.gz	PNEMBFVBUZBQLH-DLBZAZTESA-N	0	3	330.497	3.315	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2c[nH]c3c2cccc3CC)C1	ZINC001021742989	1318657088	/nfs/dbraw/zinc/65/70/88/1318657088.db2.gz	OJARJLRYHVVCLD-PXNSSMCTSA-N	0	3	349.478	3.290	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(C(C)C)s2)C1	ZINC001021743703	1318657483	/nfs/dbraw/zinc/65/74/83/1318657483.db2.gz	QVQFAKRKVPNBHW-HZPDHXFCSA-N	0	3	330.497	3.431	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(F)c3occc32)C1	ZINC001021745056	1318661322	/nfs/dbraw/zinc/66/13/22/1318661322.db2.gz	YMNVZEZJMRSYCO-KBXCAEBGSA-N	0	3	340.398	3.132	20	30		EGEDHN
C[C@@H](c1ccc(F)cc1)N(C)C[C@@H]1CCCN1C(=O)C#CC1CC1	ZINC000960618135	1318744252	/nfs/dbraw/zinc/74/42/52/1318744252.db2.gz	OTTLOWAZSDKBTN-KXBFYZLASA-N	0	3	328.431	3.223	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)C2=CCCCCC2)C1	ZINC001022006751	1318767443	/nfs/dbraw/zinc/76/74/43/1318767443.db2.gz	LCYIDRZPJVRXQW-OKILXGFUSA-N	0	3	327.266	3.022	20	30		EGEDHN
C=CCn1c(CCN2CCCCC2)nnc1SCSCC	ZINC000814735858	1318807830	/nfs/dbraw/zinc/80/78/30/1318807830.db2.gz	JBQLAUNYHREHHL-UHFFFAOYSA-N	0	3	326.535	3.295	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H]1CN(C)Cc1ccc(C#N)cc1)C1CCC1	ZINC000960712806	1318817157	/nfs/dbraw/zinc/81/71/57/1318817157.db2.gz	SYXIRHYQYZRNRQ-OXJNMPFZSA-N	0	3	339.483	3.417	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc(C(=O)N2CCCC[C@@H]2C)cc1	ZINC000912309891	1318864881	/nfs/dbraw/zinc/86/48/81/1318864881.db2.gz	ARWIQUFWGTYGFO-YJBOKZPZSA-N	0	3	343.471	3.323	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCN1C(=O)[C@H]1C[C@H]2C[C@H]2C1	ZINC000960808472	1318924058	/nfs/dbraw/zinc/92/40/58/1318924058.db2.gz	KKRYOALJZHKCND-FUMNGEBKSA-N	0	3	337.467	3.027	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@@H]2CN(C)Cc2ccc(OC)cc2)C1	ZINC000960847576	1318986503	/nfs/dbraw/zinc/98/65/03/1318986503.db2.gz	QBTIFHCXZUULGZ-GOSISDBHSA-N	0	3	342.483	3.474	20	30		EGEDHN
C[C@@H]1CCCC[C@@H]1C(=O)N[C@H]1C[C@@H](NCc2ccc(C#N)cc2F)C1	ZINC001022620885	1319020753	/nfs/dbraw/zinc/02/07/53/1319020753.db2.gz	SNSQTFSMLQKESA-ZSGPHXLJSA-N	0	3	343.446	3.260	20	30		EGEDHN
C[C@H]1CCCC[C@H]1C(=O)N[C@H]1C[C@@H](NCc2cc(C#N)ccc2F)C1	ZINC001022620403	1319020867	/nfs/dbraw/zinc/02/08/67/1319020867.db2.gz	NHRIOOLMCJNISU-VIBAHUMZSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2C[C@@H](NCc3cc(C#N)ccc3F)C2)CC1	ZINC001022655601	1319044772	/nfs/dbraw/zinc/04/47/72/1319044772.db2.gz	HUWNLARFPQEGNI-HDICACEKSA-N	0	3	341.430	3.181	20	30		EGEDHN
C=CCC(F)(F)C(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1	ZINC000815902444	1319070267	/nfs/dbraw/zinc/07/02/67/1319070267.db2.gz	DLLSXQDRDXUHSR-UHFFFAOYSA-N	0	3	337.414	3.367	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]([C@@H]3CCCN(C(=O)C4CC4)C3)C2)s1	ZINC000961082309	1319194259	/nfs/dbraw/zinc/19/42/59/1319194259.db2.gz	RRJRCWBMISQKSB-CVEARBPZSA-N	0	3	343.496	3.090	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)C2(c3ccc(Cl)cc3)CC2)C1	ZINC001023056595	1319242751	/nfs/dbraw/zinc/24/27/51/1319242751.db2.gz	BHFQNWPZKXOUTM-GASCZTMLSA-N	0	3	339.266	3.361	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)[C@@H]2CCCC(C)(C)C2)C1	ZINC001023142221	1319284965	/nfs/dbraw/zinc/28/49/65/1319284965.db2.gz	JBQKGOJWNHMXQJ-MCIONIFRSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2coc(C3CCCCC3)n2)C1	ZINC001023149862	1319295273	/nfs/dbraw/zinc/29/52/73/1319295273.db2.gz	LULUYOPDIPDPET-OKILXGFUSA-N	0	3	337.851	3.325	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)C[C@@H]2CCCC[C@@H]2C)C1	ZINC001023152218	1319297320	/nfs/dbraw/zinc/29/73/20/1319297320.db2.gz	QYDYWDKODGLSCC-CYUUQNCZSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]([C@H]2CCN(Cc3cnc(C)o3)C2)C1	ZINC000961229657	1319360389	/nfs/dbraw/zinc/36/03/89/1319360389.db2.gz	NCYHDNXEJMQPJI-SJORKVTESA-N	0	3	345.487	3.256	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2c(C)c(F)ccc2Cl)C1	ZINC001023448645	1319549385	/nfs/dbraw/zinc/54/93/85/1319549385.db2.gz	UFTAAQAQTGKKOJ-AWEZNQCLSA-N	0	3	336.838	3.253	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NC[C@H]1CCCN(C[C@H](F)CC)C1	ZINC001023448000	1319549511	/nfs/dbraw/zinc/54/95/11/1319549511.db2.gz	BYTYJBGQYIKSAS-IAGOWNOFSA-N	0	3	348.462	3.441	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1ccc(-c2ccccc2Cl)o1	ZINC000818589320	1319563720	/nfs/dbraw/zinc/56/37/20/1319563720.db2.gz	WDDSUFGWGANUBJ-UHFFFAOYSA-N	0	3	330.815	3.285	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2[nH]c3ccccc3c2Cl)C1	ZINC001023465434	1319563698	/nfs/dbraw/zinc/56/36/98/1319563698.db2.gz	RRAYBHRANXYZQF-AWEZNQCLSA-N	0	3	343.858	3.286	20	30		EGEDHN
C#CCN(C)CCCNC(=O)CSc1ccc2ccccc2c1	ZINC000818615112	1319569849	/nfs/dbraw/zinc/56/98/49/1319569849.db2.gz	ANPIWGZYFLMBSK-UHFFFAOYSA-N	0	3	326.465	3.003	20	30		EGEDHN
C#CCN1CCC[C@@H](CNC(=O)c2cc3ccc(F)cc3s2)C1	ZINC001023475103	1319576569	/nfs/dbraw/zinc/57/65/69/1319576569.db2.gz	PLGCPSDWLNNZKT-ZDUSSCGKSA-N	0	3	330.428	3.115	20	30		EGEDHN
N#Cc1ccc([C@H](O)CNCc2ccc(OC3CCCC3)nc2)cc1	ZINC000818964074	1319594084	/nfs/dbraw/zinc/59/40/84/1319594084.db2.gz	JWGDKJZXCHOLHK-LJQANCHMSA-N	0	3	337.423	3.098	20	30		EGEDHN
Cc1ccccc1C(=O)NC1CC(CNCc2ccccc2C#N)C1	ZINC000961503357	1319621990	/nfs/dbraw/zinc/62/19/90/1319621990.db2.gz	OWQNLXZRXVLVOP-UHFFFAOYSA-N	0	3	333.435	3.165	20	30		EGEDHN
N#Cc1ccc(F)c(CNCC2CC(NC(=O)CC3CCCC3)C2)c1	ZINC000961506645	1319622695	/nfs/dbraw/zinc/62/26/95/1319622695.db2.gz	ZCYFLFCKSUCBBX-UHFFFAOYSA-N	0	3	343.446	3.262	20	30		EGEDHN
C=CCN1CCC[C@@H](CNC(=O)c2nsc3ccc(C)cc32)C1	ZINC001023531560	1319637599	/nfs/dbraw/zinc/63/75/99/1319637599.db2.gz	ZFSDZWOWJZALMF-AWEZNQCLSA-N	0	3	329.469	3.233	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)[C@@H]2C[C@H]2c2ccccc2CC)C1	ZINC001023556730	1319667299	/nfs/dbraw/zinc/66/72/99/1319667299.db2.gz	OTGQXUSQFBZMKO-JRGCBEDISA-N	0	3	338.495	3.204	20	30		EGEDHN
CCOc1ccc2c(c1)[C@H](NC[C@@H](O)c1ccc(C#N)cc1)CCO2	ZINC000819242058	1319679804	/nfs/dbraw/zinc/67/98/04/1319679804.db2.gz	IPHDWXHGLMSLLO-RTBURBONSA-N	0	3	338.407	3.104	20	30		EGEDHN
C=CCN1CCC[C@H](CNC(=O)c2c(Cl)cncc2Cl)C1	ZINC001023569556	1319684141	/nfs/dbraw/zinc/68/41/41/1319684141.db2.gz	MIGRBUPTHHOQLC-LLVKDONJSA-N	0	3	328.243	3.016	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H](NC[C@@H](C#N)CCC#N)CC12CCC2	ZINC000819326231	1319698574	/nfs/dbraw/zinc/69/85/74/1319698574.db2.gz	LUQXKCRLYYYSBH-CVEARBPZSA-N	0	3	346.475	3.342	20	30		EGEDHN
C[C@H](Oc1ccc2c(c1)CCC2)C(=O)C(C#N)C(=O)Nc1ccccc1	ZINC000916900863	1319723583	/nfs/dbraw/zinc/72/35/83/1319723583.db2.gz	YAQIAEUVZQDEEZ-IFXJQAMLSA-N	0	3	348.402	3.290	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cccn2C2CCCC2)C1	ZINC001023671609	1319786880	/nfs/dbraw/zinc/78/68/80/1319786880.db2.gz	KXWHENKMMUVQBM-KRWDZBQOSA-N	0	3	327.472	3.068	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2ccc3sccc3c2)C1	ZINC001023677105	1319790558	/nfs/dbraw/zinc/79/05/58/1319790558.db2.gz	CHOYOBSYTBGXBJ-OAHLLOKOSA-N	0	3	326.465	3.366	20	30		EGEDHN
CC#CCN1CCC[C@H](CNC(=O)c2[nH]c3ccc(C)cc3c2C)C1	ZINC001023680158	1319794676	/nfs/dbraw/zinc/79/46/76/1319794676.db2.gz	SWEABYPFIQGBPW-QGZVFWFLSA-N	0	3	337.467	3.250	20	30		EGEDHN
C=CCSc1nc2ccccc2n1CN1CCN(CC2CC2)CC1	ZINC000917479205	1319818995	/nfs/dbraw/zinc/81/89/95/1319818995.db2.gz	IXUSHIUVHMBFBN-UHFFFAOYSA-N	0	3	342.512	3.300	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccccc2-c2ncco2)CC1	ZINC000820478012	1319896782	/nfs/dbraw/zinc/89/67/82/1319896782.db2.gz	AEWXLNBQNLUINJ-UHFFFAOYSA-N	0	3	326.400	3.114	20	30		EGEDHN
C#C[C@H](NC(=O)N(CCN(C)C)Cc1ccsc1)c1ccccc1	ZINC000820584436	1319916419	/nfs/dbraw/zinc/91/64/19/1319916419.db2.gz	PANKXVCZVNMTAE-SFHVURJKSA-N	0	3	341.480	3.196	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2ccccc2CC(C)C)C1	ZINC001023770151	1319920656	/nfs/dbraw/zinc/92/06/56/1319920656.db2.gz	RHJPTYAZEAJPJH-SFHVURJKSA-N	0	3	326.484	3.350	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCN(C(=O)/C=C\c2ccco2)C1	ZINC001023811761	1319955988	/nfs/dbraw/zinc/95/59/88/1319955988.db2.gz	RWNIPBJWONSPME-IBSYWUHOSA-N	0	3	349.434	3.193	20	30		EGEDHN
N#Cc1ccccc1CNCC1CC(NC(=O)[C@H]2CC23CCCC3)C1	ZINC000962497854	1319984293	/nfs/dbraw/zinc/98/42/93/1319984293.db2.gz	PWQNWASIOPVZLR-XUJQIHCRSA-N	0	3	337.467	3.123	20	30		EGEDHN
CCC(CC)C(=O)N1CCC[C@H](CNCc2ccccc2C#N)C1	ZINC001023853437	1319989848	/nfs/dbraw/zinc/98/98/48/1319989848.db2.gz	WJGVQXRXAHVKIM-MRXNPFEDSA-N	0	3	327.472	3.323	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2cc(C#N)ccc2F)C1	ZINC000823268945	1320166970	/nfs/dbraw/zinc/16/69/70/1320166970.db2.gz	SXNYMBHKNVHKTC-YOEHRIQHSA-N	0	3	337.398	3.263	20	30		EGEDHN
C#CCN(C[C@@H](C)c1ccc(S(C)(=O)=O)cc1)C1CCCCC1	ZINC000823423409	1320177911	/nfs/dbraw/zinc/17/79/11/1320177911.db2.gz	HYVYAEOWFUFEPG-MRXNPFEDSA-N	0	3	333.497	3.462	20	30		EGEDHN
Cc1ccc([C@@H](CNC(=O)c2cc(C#N)ccc2F)N(C)C)cc1	ZINC000824245794	1320241573	/nfs/dbraw/zinc/24/15/73/1320241573.db2.gz	RITNOIIYLVVRHI-GOSISDBHSA-N	0	3	325.387	3.039	20	30		EGEDHN
CN(C)[C@H]1Cc2ccccc2N(C(=O)CC2(C#N)CCCCC2)C1	ZINC000826985461	1320418214	/nfs/dbraw/zinc/41/82/14/1320418214.db2.gz	HMEKPYZTXGVDDQ-KRWDZBQOSA-N	0	3	325.456	3.370	20	30		EGEDHN
Cc1ccc(CN(C)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1C#N	ZINC000859152278	1328932827	/nfs/dbraw/zinc/93/28/27/1328932827.db2.gz	JGCBCZDWVWOOGF-QGZVFWFLSA-N	0	3	329.444	3.308	20	30		EGEDHN
CCCCCCCCCN(C)C(=O)C(=O)Nc1ccc2c(c1)CNC2	ZINC000841022816	1321202593	/nfs/dbraw/zinc/20/25/93/1321202593.db2.gz	QFXMTUSXGIGTFM-UHFFFAOYSA-N	0	3	345.487	3.437	20	30		EGEDHN
C[C@H](NC(=O)c1ccccc1)C(=O)C(C#N)c1nc(C2CC2)cs1	ZINC000842940206	1321451054	/nfs/dbraw/zinc/45/10/54/1321451054.db2.gz	YSBVMALSORQTAX-SMDDNHRTSA-N	0	3	339.420	3.015	20	30		EGEDHN
CN(CC(=O)C(C#N)c1nc(C2CC2)cs1)C(=O)c1cccs1	ZINC000842940178	1321451377	/nfs/dbraw/zinc/45/13/77/1321451377.db2.gz	YKHHZMDLSJZLNE-NSHDSACASA-N	0	3	345.449	3.030	20	30		EGEDHN
C[C@@H](C(=O)C(C#N)c1nc(C2CC2)cs1)N(C)CC(F)(F)F	ZINC000842945732	1321452694	/nfs/dbraw/zinc/45/26/94/1321452694.db2.gz	RQDZSRNVYKBFLQ-WPRPVWTQSA-N	0	3	331.363	3.079	20	30		EGEDHN
C#CC1CCN(C(=O)[C@H]2CN(Cc3ccccc3)CCC2(F)F)CC1	ZINC000843698901	1321537793	/nfs/dbraw/zinc/53/77/93/1321537793.db2.gz	FISLXGURUMORKT-GOSISDBHSA-N	0	3	346.421	3.016	20	30		EGEDHN
C#Cc1cccc(N(C)C(=O)C(C[C@@H]2CCCO2)C(F)(F)F)c1	ZINC000844375920	1321595579	/nfs/dbraw/zinc/59/55/79/1321595579.db2.gz	NVBUFEJUVWJZGS-GJZGRUSLSA-N	0	3	325.330	3.378	20	30		EGEDHN
C/C(=C/c1ccco1)C(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000846871894	1321818656	/nfs/dbraw/zinc/81/86/56/1321818656.db2.gz	JYVNUOVJLFTQBG-VBKFSLOCSA-N	0	3	337.423	3.145	20	30		EGEDHN
C[C@@H](COC(=O)C(C)(C)c1cc(F)cc(C#N)c1)N1CCCCC1	ZINC000847964360	1321917433	/nfs/dbraw/zinc/91/74/33/1321917433.db2.gz	ZOMASBJLOCHTNE-AWEZNQCLSA-N	0	3	332.419	3.393	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN[C@@H]2CCc3ccccc3NC2=O)cc1	ZINC000848561036	1321976400	/nfs/dbraw/zinc/97/64/00/1321976400.db2.gz	OKARNAXLSKZWLF-AUUYWEPGSA-N	0	3	335.407	3.021	20	30		EGEDHN
N#CCSCC(=O)C(C#N)c1nc(-c2ccc(C#N)cc2)cs1	ZINC000920141192	1322143986	/nfs/dbraw/zinc/14/39/86/1322143986.db2.gz	NAASBTUIIQNKRN-CYBMUJFWSA-N	0	3	338.417	3.115	20	30		EGEDHN
CC[C@@H](C(=O)C(C#N)c1nc(C)cs1)N(C)C(=O)OC(C)(C)C	ZINC000850736851	1322280755	/nfs/dbraw/zinc/28/07/55/1322280755.db2.gz	NVCRGRFSXHJJFO-NEPJUHHUSA-N	0	3	337.445	3.273	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)c2cc(COC)cs2)cc1	ZINC000850759389	1322285479	/nfs/dbraw/zinc/28/54/79/1322285479.db2.gz	IFZMWTIGGLNJRN-HNNXBMFYSA-N	0	3	342.420	3.418	20	30		EGEDHN
CCc1ccc(NC(=O)C(C#N)C(=O)CCCc2cccnc2)cc1	ZINC000850759925	1322285945	/nfs/dbraw/zinc/28/59/45/1322285945.db2.gz	OZNBWPBPPLVLBC-GOSISDBHSA-N	0	3	335.407	3.314	20	30		EGEDHN
Cc1ncsc1CCNCc1cc(C#N)ccc1Br	ZINC000922158391	1322468413	/nfs/dbraw/zinc/46/84/13/1322468413.db2.gz	ITVJGUWXCCWSLR-UHFFFAOYSA-N	0	3	336.258	3.418	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)N1CCC[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001024107740	1323139805	/nfs/dbraw/zinc/13/98/05/1323139805.db2.gz	WHVCRIYYPKCXTH-KBXCAEBGSA-N	0	3	349.425	3.020	20	30		EGEDHN
N#CC[C@H]1CCCN(CC(=O)C(C#N)c2nc3ccccc3s2)C1	ZINC000852319646	1323178462	/nfs/dbraw/zinc/17/84/62/1323178462.db2.gz	QTXJONRPGWJPKY-ZIAGYGMSSA-N	0	3	338.436	3.098	20	30		EGEDHN
C=CCN(CCOc1ccc2c(C)cc(=O)oc2c1)[C@H](C)COC	ZINC000852358632	1323182189	/nfs/dbraw/zinc/18/21/89/1323182189.db2.gz	WMZPDYWNPGLAAM-OAHLLOKOSA-N	0	3	331.412	3.003	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)c2ccccn2)C1	ZINC000963236464	1323247204	/nfs/dbraw/zinc/24/72/04/1323247204.db2.gz	RRLAGBJPSNMATQ-WBVHZDCISA-N	0	3	333.863	3.151	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@@H]1CCCN(C(=O)c2ccncc2)C1	ZINC000963242994	1323248875	/nfs/dbraw/zinc/24/88/75/1323248875.db2.gz	HIPWRKSWWMBLML-SJORKVTESA-N	0	3	333.863	3.151	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1[C@H]1CCCN(C(=O)c2ccc(C)nc2)C1	ZINC000963260337	1323270651	/nfs/dbraw/zinc/27/06/51/1323270651.db2.gz	SRGUBAFOLYZWPJ-ROUUACIJSA-N	0	3	347.890	3.459	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccc(N(C)C)cc1F	ZINC001024477176	1323430958	/nfs/dbraw/zinc/43/09/58/1323430958.db2.gz	KHHHWAZJNWNKDP-MRXNPFEDSA-N	0	3	333.451	3.052	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1oc2ccc(F)cc2c1C	ZINC001024480667	1323434279	/nfs/dbraw/zinc/43/42/79/1323434279.db2.gz	MJMMKSQOSDBNKH-INIZCTEOSA-N	0	3	342.414	3.488	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)[C@H]1CCc2c1cccc2Cl	ZINC001024557349	1323497175	/nfs/dbraw/zinc/49/71/75/1323497175.db2.gz	RUTAUGIFBDENKP-QAPCUYQASA-N	0	3	344.886	3.364	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1c[nH]nc1-c1ccccc1	ZINC001024581373	1323517613	/nfs/dbraw/zinc/51/76/13/1323517613.db2.gz	HAORWDLUWAMVOY-KRWDZBQOSA-N	0	3	338.455	3.237	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccc(C(C)C)nc1C	ZINC001024652539	1323574239	/nfs/dbraw/zinc/57/42/39/1323574239.db2.gz	PHAZSZIMOQHYLF-KRWDZBQOSA-N	0	3	327.472	3.121	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccc(C)c(OCC)c1	ZINC001024690736	1323606392	/nfs/dbraw/zinc/60/63/92/1323606392.db2.gz	INEOQBSAMGOMJJ-GOSISDBHSA-N	0	3	328.456	3.001	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccc(C(C)(F)F)cc1	ZINC001024829485	1323733823	/nfs/dbraw/zinc/73/38/23/1323733823.db2.gz	CRGXCESGJCXKLM-QGZVFWFLSA-N	0	3	334.410	3.406	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCCN2C(=O)c2ccoc2)cc1F	ZINC001024868130	1323756644	/nfs/dbraw/zinc/75/66/44/1323756644.db2.gz	KLLNRTPJWNQKOP-QGZVFWFLSA-N	0	3	341.386	3.075	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@@H]1CNCc1cc(CO)ccc1F	ZINC001025040467	1323843053	/nfs/dbraw/zinc/84/30/53/1323843053.db2.gz	DLKRIGMMLMCMJZ-QGZVFWFLSA-N	0	3	348.462	3.001	20	30		EGEDHN
C[C@]1(C(=O)N2CCCC[C@H]2CNCc2ccc(C#N)s2)C=CCC1	ZINC001025046039	1323850617	/nfs/dbraw/zinc/85/06/17/1323850617.db2.gz	HBEUSKWVPDNJSS-KXBFYZLASA-N	0	3	343.496	3.447	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccn(CC(C)C)n1	ZINC001025236799	1324026214	/nfs/dbraw/zinc/02/62/14/1324026214.db2.gz	HYQXZAONHFPMHU-MOPGFXCFSA-N	0	3	344.503	3.184	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc(C(C)C)nc1	ZINC001025239727	1324032900	/nfs/dbraw/zinc/03/29/00/1324032900.db2.gz	IPLVNUUAGVDZBJ-WOJBJXKFSA-N	0	3	339.483	3.297	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(C)c(F)cc1F	ZINC001025240116	1324034957	/nfs/dbraw/zinc/03/49/57/1324034957.db2.gz	LUVAYMPSKCINFC-MOPGFXCFSA-N	0	3	346.421	3.366	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(C)cc(C)n1	ZINC001025245703	1324045134	/nfs/dbraw/zinc/04/51/34/1324045134.db2.gz	PEGUVVOCJVVOEX-UXHICEINSA-N	0	3	339.483	3.181	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(F)ccc1C	ZINC001025255489	1324063335	/nfs/dbraw/zinc/06/33/35/1324063335.db2.gz	QVHGGZSXIMBYNU-RBUKOAKNSA-N	0	3	328.431	3.226	20	30		EGEDHN
N#CC1(CCCN2C[C@@H]3C[C@H]2CN3Cc2ccccc2)CCOCC1	ZINC000931490408	1329129856	/nfs/dbraw/zinc/12/98/56/1329129856.db2.gz	CYXCYLWIAIRIMG-PMACEKPBSA-N	0	3	339.483	3.046	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1ccc(Cl)[nH]1	ZINC001025268693	1324081230	/nfs/dbraw/zinc/08/12/30/1324081230.db2.gz	FBMYZMLAXLNYHV-JKSUJKDBSA-N	0	3	333.863	3.151	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1cccc2[nH]ccc21	ZINC001025269842	1324083888	/nfs/dbraw/zinc/08/38/88/1324083888.db2.gz	XESAHWHETODROC-WOJBJXKFSA-N	0	3	335.451	3.260	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)Cc1ccsc1C	ZINC001025279068	1324100782	/nfs/dbraw/zinc/10/07/82/1324100782.db2.gz	YHGAPNRXCOEVTG-MOPGFXCFSA-N	0	3	344.524	3.468	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(CCC)on1	ZINC001025283877	1324103963	/nfs/dbraw/zinc/10/39/63/1324103963.db2.gz	BYIYENYOMUDZEA-ZWKOTPCHSA-N	0	3	331.460	3.272	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc2sccc2[nH]1	ZINC001025283982	1324105026	/nfs/dbraw/zinc/10/50/26/1324105026.db2.gz	DAPCDWOZFNZFPT-SJORKVTESA-N	0	3	341.480	3.322	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1csc(Cl)n1	ZINC001025283984	1324105727	/nfs/dbraw/zinc/10/57/27/1324105727.db2.gz	DBPVWTPWXHVEIU-KGLIPLIRSA-N	0	3	339.892	3.442	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(CC(C)C)c[nH]1	ZINC001025286999	1324108766	/nfs/dbraw/zinc/10/87/66/1324108766.db2.gz	BIJRATUBAKVNEC-PMACEKPBSA-N	0	3	341.499	3.306	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ncccc1Cl	ZINC001025293041	1324118990	/nfs/dbraw/zinc/11/89/90/1324118990.db2.gz	OYNWWYDVJADQAX-CVEARBPZSA-N	0	3	333.863	3.380	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)C(C)(C)c1ccccc1	ZINC001025295486	1324125559	/nfs/dbraw/zinc/12/55/59/1324125559.db2.gz	GKIBDZOUZCVAPS-VQTJNVASSA-N	0	3	338.495	3.443	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1ccc(OCC)cc1	ZINC001025296557	1324128280	/nfs/dbraw/zinc/12/82/80/1324128280.db2.gz	KFHQWFIGKVUPRE-WOJBJXKFSA-N	0	3	340.467	3.178	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)[C@H]1[C@H]2[C@@H]1[C@@H]1CC[C@H]2C1	ZINC001025304995	1324139021	/nfs/dbraw/zinc/13/90/21/1324139021.db2.gz	SNYKGKPEUKQACX-DTGNRIQCSA-N	0	3	340.511	3.147	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc3ccccc3nc2C)C1	ZINC001025434620	1324272916	/nfs/dbraw/zinc/27/29/16/1324272916.db2.gz	XGEAMQMWWHLALL-APWZRJJASA-N	0	3	349.478	3.397	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(Cl)cc2F)C1	ZINC001025478337	1324323629	/nfs/dbraw/zinc/32/36/29/1324323629.db2.gz	LWCJFOVEAHOABZ-KGLIPLIRSA-N	0	3	336.838	3.333	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(-c3ccco3)o2)C1	ZINC001025482126	1324330061	/nfs/dbraw/zinc/33/00/61/1324330061.db2.gz	MELNZBLKZIQYAI-HUUCEWRRSA-N	0	3	326.396	3.003	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc3c(o2)c(F)ccc3C)C1	ZINC001025487133	1324338284	/nfs/dbraw/zinc/33/82/84/1324338284.db2.gz	BATVRBMSTASSQN-CABCVRRESA-N	0	3	342.414	3.344	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2nsc3ccc(C)cc32)C1	ZINC001025504222	1324352917	/nfs/dbraw/zinc/35/29/17/1324352917.db2.gz	ZARMSPMYCFIOGK-GJZGRUSLSA-N	0	3	341.480	3.068	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc(F)c(Cl)c2)C1	ZINC001025522933	1324369185	/nfs/dbraw/zinc/36/91/85/1324369185.db2.gz	JDJDHJDDMQUIQU-DZGCQCFKSA-N	0	3	336.838	3.333	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2c(F)ccc(F)c2Cl)C1	ZINC001025540753	1324388501	/nfs/dbraw/zinc/38/85/01/1324388501.db2.gz	YZEOOZNHMFHLBY-VXGBXAGGSA-N	0	3	340.801	3.082	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2ccc(C)c(F)c2F)C1	ZINC001025544545	1324392162	/nfs/dbraw/zinc/39/21/62/1324392162.db2.gz	XAZSKBJPWGNGHM-CABCVRRESA-N	0	3	334.410	3.127	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(Cl)c(OC)c2)C1	ZINC001025553016	1324400926	/nfs/dbraw/zinc/40/09/26/1324400926.db2.gz	QDMGVVRUFFTOHJ-GDBMZVCRSA-N	0	3	348.874	3.202	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc3scnc3c2)C1	ZINC001025585336	1324427881	/nfs/dbraw/zinc/42/78/81/1324427881.db2.gz	OOVDHOMGKNOFRN-HOCLYGCPSA-N	0	3	341.480	3.150	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc3cccnc3s2)C1	ZINC001025586792	1324428969	/nfs/dbraw/zinc/42/89/69/1324428969.db2.gz	FLMBOOQQSXEBOR-ZBFHGGJFSA-N	0	3	341.480	3.150	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cccc3ccsc32)C1	ZINC001025588406	1324432931	/nfs/dbraw/zinc/43/29/31/1324432931.db2.gz	VPAJGKBITPDOKC-GDBMZVCRSA-N	0	3	326.465	3.365	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cnc(CC(C)(C)C)s2)C1	ZINC001025590784	1324435978	/nfs/dbraw/zinc/43/59/78/1324435978.db2.gz	RQTZYDKPEKNBLQ-GJZGRUSLSA-N	0	3	347.528	3.195	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2c(Cl)cccc2Cl)C1	ZINC001025610500	1324462677	/nfs/dbraw/zinc/46/26/77/1324462677.db2.gz	WWQXVCAHWYFJEK-STQMWFEESA-N	0	3	339.266	3.457	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(C)nc3ccccc32)C1	ZINC001025613674	1324465413	/nfs/dbraw/zinc/46/54/13/1324465413.db2.gz	YZISIBVXGXTAPS-IRXDYDNUSA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(F)cc2Cl)C1	ZINC001025613723	1324465750	/nfs/dbraw/zinc/46/57/50/1324465750.db2.gz	ZPWRFHQCIWZOCX-ZIAGYGMSSA-N	0	3	336.838	3.333	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cnc(C(C)(C)C)s2)C1	ZINC001025630246	1324481672	/nfs/dbraw/zinc/48/16/72/1324481672.db2.gz	RRKXJXIUFAFDAT-LSDHHAIUSA-N	0	3	347.528	3.294	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2[C@H]3CN(C/C=C\c4ccccc4)C[C@H]32)cc1	ZINC001025933482	1324561359	/nfs/dbraw/zinc/56/13/59/1324561359.db2.gz	SIKPCHZXUZLNBS-NTOILQCVSA-N	0	3	342.442	3.041	20	30		EGEDHN
CC(C)CC(=O)N1C[C@@H]2CC[C@@H](NCc3cc(F)ccc3C#N)[C@H]2C1	ZINC001026179615	1324647042	/nfs/dbraw/zinc/64/70/42/1324647042.db2.gz	ZCQUYVREDBPAAB-ZYSHUDEJSA-N	0	3	343.446	3.070	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CC[C@H]2CN(C(=O)c3ccccc3)C[C@@H]21	ZINC001026180373	1324647542	/nfs/dbraw/zinc/64/75/42/1324647542.db2.gz	JCADEYRSDFBSHH-PCCBWWKXSA-N	0	3	345.446	3.199	20	30		EGEDHN
CC(C(=O)N1C[C@@H]2CC[C@@H](NCc3ccccc3C#N)[C@H]2C1)=C1CCC1	ZINC001026264093	1324691610	/nfs/dbraw/zinc/69/16/10/1324691610.db2.gz	QXKZSOKFQOWIQY-PCCBWWKXSA-N	0	3	349.478	3.385	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H]3CC[C@@H](NCc4nocc4C)[C@H]3C2)CC1	ZINC001026348673	1324744253	/nfs/dbraw/zinc/74/42/53/1324744253.db2.gz	PQCDQCCIAVOVAZ-OKZBNKHCSA-N	0	3	343.471	3.056	20	30		EGEDHN
CC1(C(=O)NC2CCC(NCc3cc(F)ccc3C#N)CC2)CCC1	ZINC001026541609	1324877422	/nfs/dbraw/zinc/87/74/22/1324877422.db2.gz	HBMAWGNCLKISIP-UHFFFAOYSA-N	0	3	343.446	3.405	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@H](CNCc2ncc(C)s2)C1	ZINC001026866411	1325054634	/nfs/dbraw/zinc/05/46/34/1325054634.db2.gz	WSFDNVYUVIYGRC-CYBMUJFWSA-N	0	3	341.908	3.168	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](CNCc2csc(CC)n2)C1	ZINC001026988990	1325127854	/nfs/dbraw/zinc/12/78/54/1325127854.db2.gz	VCNLWPWFJLAIPB-CQSZACIVSA-N	0	3	335.517	3.246	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H](CNCc2cc(O)ccc2Cl)C1	ZINC001026992491	1325130780	/nfs/dbraw/zinc/13/07/80/1325130780.db2.gz	ODJLESGPVIAHSG-CYBMUJFWSA-N	0	3	336.863	3.196	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H](CNCc2csc(CC)n2)C1	ZINC001027040365	1325174783	/nfs/dbraw/zinc/17/47/83/1325174783.db2.gz	AMJOGKBEVAAXGF-KDOFPFPSSA-N	0	3	335.517	3.246	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](CNCc3nc4ccccc4o3)C2)C1	ZINC001027050683	1325188872	/nfs/dbraw/zinc/18/88/72/1325188872.db2.gz	IBLCIUNNVYRWJV-OAHLLOKOSA-N	0	3	339.439	3.122	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)/C=C/c2ccco2)C1	ZINC001027276324	1325390812	/nfs/dbraw/zinc/39/08/12/1325390812.db2.gz	HHPACHMUUWEZGO-YXBWYFRISA-N	0	3	349.434	3.287	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)c2ccsc2)C1	ZINC001027288621	1325419330	/nfs/dbraw/zinc/41/93/30/1325419330.db2.gz	GEQMPZVUCKOFHY-GOSISDBHSA-N	0	3	339.464	3.356	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)[C@H]2CC=CCC2)C1	ZINC001027294660	1325429356	/nfs/dbraw/zinc/42/93/56/1325429356.db2.gz	YWYKDNXVFHHJNQ-PMACEKPBSA-N	0	3	337.467	3.337	20	30		EGEDHN
CN(Cc1ccc(C#N)c(F)c1)[C@@H]1CCCN(C(=O)C2=CCCC2)C1	ZINC001027367470	1325558840	/nfs/dbraw/zinc/55/88/40/1325558840.db2.gz	CARSPWNQIYYTKL-GOSISDBHSA-N	0	3	341.430	3.230	20	30		EGEDHN
C[C@H]1O[C@@H](C)[C@H](C)[C@H]1C(=O)C(C#N)C(=O)Nc1ccccc1Cl	ZINC000860469571	1329321344	/nfs/dbraw/zinc/32/13/44/1329321344.db2.gz	IUGQMCVQIXDUDP-QKZHPOIUSA-N	0	3	334.803	3.047	20	30		EGEDHN
CC[C@H](C)c1ccc(NC(=O)C(C#N)C(=O)C2CC(OC)C2)cc1	ZINC000860472223	1329321406	/nfs/dbraw/zinc/32/14/06/1329321406.db2.gz	FRKZEXBCKBVIRE-XNPDXQRHSA-N	0	3	328.412	3.272	20	30		EGEDHN
C[C@H](CC(=O)C(C#N)C(=O)NCc1cccc(Cl)c1)c1ccco1	ZINC000860692039	1329344983	/nfs/dbraw/zinc/34/49/83/1329344983.db2.gz	WZBOCXVXUKBBRS-DOMZBBRYSA-N	0	3	344.798	3.452	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)C2(C(F)F)CC2)C1	ZINC001027412532	1327639493	/nfs/dbraw/zinc/63/94/93/1327639493.db2.gz	CYRRMJAKNVRNCO-INIZCTEOSA-N	0	3	347.409	3.026	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@@H](N(C)CCc2ccns2)C1	ZINC001027559540	1327872772	/nfs/dbraw/zinc/87/27/72/1327872772.db2.gz	AMLZOGJRFGBBCC-QAPCUYQASA-N	0	3	335.517	3.211	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)c2cccc(NC(=O)CC)c2)C1	ZINC000966456379	1328302706	/nfs/dbraw/zinc/30/27/06/1328302706.db2.gz	ONQFQHHLDKCQRM-CRAIPNDOSA-N	0	3	343.471	3.051	20	30		EGEDHN
C#CCCN1CCC[C@@H]1CNC(=O)c1oc2ccc(F)cc2c1C	ZINC001027933501	1328412600	/nfs/dbraw/zinc/41/26/00/1328412600.db2.gz	XNVUVINPZXQASC-OAHLLOKOSA-N	0	3	328.387	3.098	20	30		EGEDHN
C=C(C)CCN1CC[C@H](C)[C@@H](NC(=O)c2c(C)noc2C(F)F)C1	ZINC000966887831	1328453040	/nfs/dbraw/zinc/45/30/40/1328453040.db2.gz	JCSIMXJNMFJCIX-AAEUAGOBSA-N	0	3	341.402	3.327	20	30		EGEDHN
C[C@@H](CCc1cccc(F)c1)N1CCN(c2ccc(C#N)nc2)CC1	ZINC000862421752	1329485223	/nfs/dbraw/zinc/48/52/23/1329485223.db2.gz	GCDRFJRXJLBZEV-INIZCTEOSA-N	0	3	338.430	3.236	20	30		EGEDHN
Cc1cc(NN=Cc2c[nH]c(=NC(=O)OC(C)(C)C)s2)ccn1	ZINC000863159635	1329531024	/nfs/dbraw/zinc/53/10/24/1329531024.db2.gz	YEIKYLPNIIOAMW-UHFFFAOYSA-N	0	3	333.417	3.061	20	30		EGEDHN
C=C1CC(C)(C(=O)NC2CCN(Cc3cccc(OC)c3)CC2)C1	ZINC000864944204	1329654321	/nfs/dbraw/zinc/65/43/21/1329654321.db2.gz	GIQJAJQCVFQOPC-UHFFFAOYSA-N	0	3	328.456	3.132	20	30		EGEDHN
C#CCN(C)CCCNC(=O)Nc1cc(C)ccc1C(F)(F)F	ZINC000931955255	1329774527	/nfs/dbraw/zinc/77/45/27/1329774527.db2.gz	READUHFGFHVUSZ-UHFFFAOYSA-N	0	3	327.350	3.090	20	30		EGEDHN
COc1ccccc1NC(=O)[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC000932635563	1329829774	/nfs/dbraw/zinc/82/97/74/1329829774.db2.gz	KROVRNGLEYCPPA-GOSISDBHSA-N	0	3	349.434	3.418	20	30		EGEDHN
COc1cc(C#N)ccc1C(=O)N(CCN1CCCC1)c1ccccc1	ZINC000933341963	1329881882	/nfs/dbraw/zinc/88/18/82/1329881882.db2.gz	WAAIUEPGMKZGEQ-UHFFFAOYSA-N	0	3	349.434	3.309	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)Cc2ccc(C)c(Cl)c2)CC1	ZINC001052486656	1348554283	/nfs/dbraw/zinc/55/42/83/1348554283.db2.gz	ODHWTTCZSHDWPC-QGZVFWFLSA-N	0	3	332.875	3.185	20	30		EGEDHN
C[C@]12CN(Cc3nnc(-c4cccc(C#N)c4)o3)C[C@H]1[C@H]1C=C[C@@H]2C1	ZINC000933706234	1329914749	/nfs/dbraw/zinc/91/47/49/1329914749.db2.gz	HJNLYOHXVLTHPL-DZIWXPPMSA-N	0	3	332.407	3.252	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc(N(CC)CC)cc2)CC1	ZINC001052892581	1348729527	/nfs/dbraw/zinc/72/95/27/1348729527.db2.gz	GEQVEAHTBJKQSD-LJQANCHMSA-N	0	3	341.499	3.140	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2ccc(C(F)(F)F)s2)CC1	ZINC001052969816	1348779757	/nfs/dbraw/zinc/77/97/57/1348779757.db2.gz	UTPAHWBSYBQOMV-GFCCVEGCSA-N	0	3	344.402	3.375	20	30		EGEDHN
CCC(C)(CC)C(=O)N1C[C@@H](C)[C@@H](NCc2ccc(C#N)s2)C1	ZINC000939797879	1330986879	/nfs/dbraw/zinc/98/68/79/1330986879.db2.gz	WWDFHTRZQFUVAM-CJNGLKHVSA-N	0	3	333.501	3.383	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(F)c3ccccc3c2)[C@@H](C)C1	ZINC000942109490	1331834262	/nfs/dbraw/zinc/83/42/62/1331834262.db2.gz	ONAWTEIMTDAYOW-YWZLYKJASA-N	0	3	338.426	3.442	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)c3ccccc3n2)[C@H](C)C1	ZINC000942181181	1331864507	/nfs/dbraw/zinc/86/45/07/1331864507.db2.gz	QRBNKHBUASGWJH-AEFFLSMTSA-N	0	3	335.451	3.007	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2cc3cccc(OC)c3o2)[C@@H](C)C1	ZINC000942581959	1331988350	/nfs/dbraw/zinc/98/83/50/1331988350.db2.gz	PXOIEPAGUGACKQ-DZGCQCFKSA-N	0	3	328.412	3.068	20	30		EGEDHN
C[C@H]1CN(Cc2cccc(C#N)c2)CC[C@@H]1NC(=O)C1(C)CC=CC1	ZINC000942602292	1331999575	/nfs/dbraw/zinc/99/95/75/1331999575.db2.gz	HBIZDPIENIOQJL-LPHOPBHVSA-N	0	3	337.467	3.241	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3ncccc3C)C[C@H]2C)C1	ZINC000942603120	1332001297	/nfs/dbraw/zinc/00/12/97/1332001297.db2.gz	SGTRTCYWPVSKIE-IAGOWNOFSA-N	0	3	327.472	3.073	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(-c3ccccc3)ccn2)[C@@H](C)C1	ZINC000943765384	1332258631	/nfs/dbraw/zinc/25/86/31/1332258631.db2.gz	CKEMZEHJEWXOPO-FXAWDEMLSA-N	0	3	347.462	3.212	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)CC23CC4CC(CC(C4)C2)C3)[C@@H](C)C1	ZINC000944306508	1332368792	/nfs/dbraw/zinc/36/87/92/1332368792.db2.gz	RUWZUXPELYJFRN-YWOLTOGESA-N	0	3	342.527	3.443	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccsc2C(F)(F)F)[C@H](C)C1	ZINC000944345298	1332379591	/nfs/dbraw/zinc/37/95/91/1332379591.db2.gz	FJUKIUABJKFURU-YPMHNXCESA-N	0	3	344.402	3.230	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(OCC(C)C)cc2)[C@H](C)C1	ZINC000944652683	1332422151	/nfs/dbraw/zinc/42/21/51/1332422151.db2.gz	IYUQHWCEBLIGLD-YLJYHZDGSA-N	0	3	342.483	3.185	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3c(s2)CCCC3)[C@H](C)C1	ZINC000944702790	1332423629	/nfs/dbraw/zinc/42/36/29/1332423629.db2.gz	UGABXHQWFZJFQG-GDBMZVCRSA-N	0	3	330.497	3.090	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3cccc(F)c3o2)[C@@H](C)C1	ZINC000945061995	1332491407	/nfs/dbraw/zinc/49/14/07/1332491407.db2.gz	KPSLONGXBKQTKC-XJKSGUPXSA-N	0	3	328.387	3.035	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2sc(C(C)(C)C)nc2C)[C@@H](C)C1	ZINC000945808991	1332679067	/nfs/dbraw/zinc/67/90/67/1332679067.db2.gz	QLVUMHVDTMHQTJ-JSGCOSHPSA-N	0	3	335.517	3.375	20	30		EGEDHN
N#Cc1ccccc1CN1C[C@@H]2CCN(C(=O)C3CCC3)CC[C@@H]2C1	ZINC000946435823	1332824301	/nfs/dbraw/zinc/82/43/01/1332824301.db2.gz	DKBFGUWOPCHDAC-BGYRXZFFSA-N	0	3	337.467	3.029	20	30		EGEDHN
CCCC(=O)N1CC[C@H]2CN(Cc3ccc(C#N)cc3F)C[C@H]2CC1	ZINC000946439639	1332826931	/nfs/dbraw/zinc/82/69/31/1332826931.db2.gz	JSFGEEPKSKULSZ-CALCHBBNSA-N	0	3	343.446	3.168	20	30		EGEDHN
CCCC(=O)N1CC[C@H]2CN(Cc3ccccc3C#N)C[C@H]2CC1	ZINC000946439916	1332827294	/nfs/dbraw/zinc/82/72/94/1332827294.db2.gz	XAPCTYYPAMGORT-KDURUIRLSA-N	0	3	325.456	3.029	20	30		EGEDHN
Cc1occc1C(=O)N[C@H]1CCN(Cc2cccc(C#N)c2)[C@H](C)C1	ZINC000947032422	1332982558	/nfs/dbraw/zinc/98/25/58/1332982558.db2.gz	OHOAAWUGXBHECL-KDOFPFPSSA-N	0	3	337.423	3.243	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)c2ccccc2O)CCN1Cc1cccc(C#N)c1	ZINC000947046080	1332987973	/nfs/dbraw/zinc/98/79/73/1332987973.db2.gz	VZDWRVFOBNIWRP-MAUKXSAKSA-N	0	3	349.434	3.047	20	30		EGEDHN
Cc1cnccc1C(=O)N[C@@H]1CCN(Cc2cccc(C#N)c2)[C@@H](C)C1	ZINC000947280626	1333075992	/nfs/dbraw/zinc/07/59/92/1333075992.db2.gz	DKVDPNPOBPHHHR-QFBILLFUSA-N	0	3	348.450	3.045	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2cccc(C(F)F)c2)C[C@@H]1C	ZINC000947540614	1333164016	/nfs/dbraw/zinc/16/40/16/1333164016.db2.gz	WFEBXTHIDKPKHI-WMLDXEAASA-N	0	3	334.410	3.159	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2cccc(C)c2Cl)C[C@H]1C	ZINC000947540913	1333164878	/nfs/dbraw/zinc/16/48/78/1333164878.db2.gz	ZZTINACRSTXQLQ-NVXWUHKLSA-N	0	3	332.875	3.183	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CCN(CCc3ccns3)[C@@H](C)C2)CC1	ZINC000947685942	1333222874	/nfs/dbraw/zinc/22/28/74/1333222874.db2.gz	QPWZRZVPEWHTBN-RDJZCZTQSA-N	0	3	347.528	3.401	20	30		EGEDHN
C[C@@H]1C[C@@H](NC(=O)C2(C)CC=CC2)CCN1Cc1cccc(C#N)c1	ZINC000947694427	1333229054	/nfs/dbraw/zinc/22/90/54/1333229054.db2.gz	XXLVKRDUQYGOJV-APWZRJJASA-N	0	3	337.467	3.384	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2c(F)ccc(F)c2Cl)C[C@H]1C	ZINC000947741194	1333246984	/nfs/dbraw/zinc/24/69/84/1333246984.db2.gz	JCBYMKXWPRSOGU-VXGBXAGGSA-N	0	3	340.801	3.224	20	30		EGEDHN
Cc1cc(C(=O)N[C@H]2CCN(Cc3cccc(C#N)c3)[C@H](C)C2)ccn1	ZINC000947818878	1333270489	/nfs/dbraw/zinc/27/04/89/1333270489.db2.gz	BMALZKBDDFBANU-UZLBHIALSA-N	0	3	348.450	3.045	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2csc(-c3ccoc3)n2)C[C@H]1C	ZINC000947820251	1333271245	/nfs/dbraw/zinc/27/12/45/1333271245.db2.gz	JUFITMONJNXSTO-UKRRQHHQSA-N	0	3	343.452	3.009	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnn(C3CCCC3)c2C)C[C@@H]1C	ZINC000947912610	1333304334	/nfs/dbraw/zinc/30/43/34/1333304334.db2.gz	NUEJHKXWFYNLEI-HOCLYGCPSA-N	0	3	330.476	3.075	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C(C)(C)c2ccccc2Cl)C[C@H]1C	ZINC000947948413	1333315261	/nfs/dbraw/zinc/31/52/61/1333315261.db2.gz	NKAPCTSULDQCOS-HUUCEWRRSA-N	0	3	332.875	3.220	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)C(C)(C)C)CCN1Cc1ccc(OCC#N)cc1	ZINC000947957552	1333320428	/nfs/dbraw/zinc/32/04/28/1333320428.db2.gz	LBSGENBHHSGZKV-RDJZCZTQSA-N	0	3	343.471	3.104	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(N(CC)CC)cc2)C[C@H]1C	ZINC000947966616	1333323874	/nfs/dbraw/zinc/32/38/74/1333323874.db2.gz	DSQVXALXXSFYGN-MJGOQNOKSA-N	0	3	341.499	3.139	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(N(CC)CC)cc2)C[C@@H]1C	ZINC000947966614	1333323883	/nfs/dbraw/zinc/32/38/83/1333323883.db2.gz	DSQVXALXXSFYGN-HKUYNNGSSA-N	0	3	341.499	3.139	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)c(F)cc2Cl)C[C@@H]1C	ZINC000947975300	1333329887	/nfs/dbraw/zinc/32/98/87/1333329887.db2.gz	LZJSQGUFGANLEC-KBPBESRZSA-N	0	3	336.838	3.394	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(COC(C)C)cc2)C[C@@H]1C	ZINC000948017122	1333343179	/nfs/dbraw/zinc/34/31/79/1333343179.db2.gz	TXFREMXSKUMGFY-FXAWDEMLSA-N	0	3	342.483	3.218	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc3ccccc3n2CC)C[C@@H]1C	ZINC000948060296	1333358939	/nfs/dbraw/zinc/35/89/39/1333358939.db2.gz	AZYJBICZLNCQLC-WMZOPIPTSA-N	0	3	337.467	3.267	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3ccc(C)cc3)CCC2)C[C@@H]1C	ZINC000948082559	1333369415	/nfs/dbraw/zinc/36/94/15/1333369415.db2.gz	FHZNQPZMXRBMHX-ICSRJNTNSA-N	0	3	338.495	3.409	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cccc(OCCC)c2)CC1	ZINC000948416891	1333517713	/nfs/dbraw/zinc/51/77/13/1333517713.db2.gz	RTFFALUKXHWWIC-LJQANCHMSA-N	0	3	342.483	3.425	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2conc2C2CCCC2)CC1	ZINC000948432798	1333522575	/nfs/dbraw/zinc/52/25/75/1333522575.db2.gz	LAMFYXBSSQTJGT-QGZVFWFLSA-N	0	3	343.471	3.282	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2oc3c(cccc3F)c2C)CC1	ZINC000948439004	1333525562	/nfs/dbraw/zinc/52/55/62/1333525562.db2.gz	FQVANBPVUPFPAN-OAHLLOKOSA-N	0	3	342.414	3.440	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cccc3cccnc32)CC1	ZINC000948586317	1333585897	/nfs/dbraw/zinc/58/58/97/1333585897.db2.gz	GDIRUKMPPCXWPB-SFHVURJKSA-N	0	3	335.451	3.185	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cc(C)cc(OC)c2C)CC1	ZINC000948587413	1333586710	/nfs/dbraw/zinc/58/67/10/1333586710.db2.gz	ZFZSEANFHNOZLD-SFHVURJKSA-N	0	3	342.483	3.262	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)[C@@H]2CCc3c2cccc3Cl)CC1	ZINC000948621076	1333599749	/nfs/dbraw/zinc/59/97/49/1333599749.db2.gz	LQILIZRQVWAJBN-CRAIPNDOSA-N	0	3	344.886	3.316	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)Cc2cccc(C3CC3)c2)CC1	ZINC000948643669	1333609523	/nfs/dbraw/zinc/60/95/23/1333609523.db2.gz	XQYXRVCERYZEIA-OAQYLSRUSA-N	0	3	338.495	3.443	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)c2cc(Cl)c(Cl)[nH]2)CC1	ZINC000948652444	1333613112	/nfs/dbraw/zinc/61/31/12/1333613112.db2.gz	SSLOGLOMOKFJDI-LBPRGKRZSA-N	0	3	342.270	3.271	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@H]2CCCN(C[C@@H](F)CC)CC2)cc1	ZINC000948665724	1333621166	/nfs/dbraw/zinc/62/11/66/1333621166.db2.gz	QJMGLQKAAKTQSM-OALUTQOASA-N	0	3	330.447	3.343	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cnc3ccsc3c2)CC1	ZINC000948669158	1333622327	/nfs/dbraw/zinc/62/23/27/1333622327.db2.gz	AQAUUGLOFJJAGN-MRXNPFEDSA-N	0	3	341.480	3.246	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)Cc2c(C)cc(C)cc2C)CC1	ZINC000948742176	1333655129	/nfs/dbraw/zinc/65/51/29/1333655129.db2.gz	HUZKBBMRANFCFC-HXUWFJFHSA-N	0	3	340.511	3.491	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccccc2F)CC1	ZINC000948845607	1333707421	/nfs/dbraw/zinc/70/74/21/1333707421.db2.gz	VHGMHEMQPPOJFX-YTQUADARSA-N	0	3	342.458	3.265	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@H]1CNC(=O)c1coc(C)n1	ZINC000948913212	1333731171	/nfs/dbraw/zinc/73/11/71/1333731171.db2.gz	PZKPBLMQGFBTBI-LJQANCHMSA-N	0	3	339.439	3.278	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@@H]2c3ccccc3CCN2C(C)C)cc1	ZINC000948947230	1333744116	/nfs/dbraw/zinc/74/41/16/1333744116.db2.gz	VRIQPIHDAJMRKY-OAQYLSRUSA-N	0	3	332.447	3.406	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H]1CCC=CCCC1)CCO2	ZINC000949120808	1333780366	/nfs/dbraw/zinc/78/03/66/1333780366.db2.gz	FZSBUYUGQFQJGY-GOSISDBHSA-N	0	3	332.488	3.002	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1cccc(C)c1Cl)CCO2	ZINC000949209940	1333795842	/nfs/dbraw/zinc/79/58/42/1333795842.db2.gz	XOVNPMHEKBIJCE-UHFFFAOYSA-N	0	3	348.874	3.141	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)c3cccc(C)c3)CC2)C1	ZINC000949279317	1333813567	/nfs/dbraw/zinc/81/35/67/1333813567.db2.gz	XLZKAKICCMFPOG-UHFFFAOYSA-N	0	3	342.483	3.268	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@@H]3CCC=CCCC3)CC2)C1	ZINC000949395659	1333836509	/nfs/dbraw/zinc/83/65/09/1333836509.db2.gz	YEGWOKWBJKWHIJ-LJQANCHMSA-N	0	3	346.515	3.392	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@@H]3C[C@@H]3C3CCCC3)CC2)C1	ZINC000949503260	1333861854	/nfs/dbraw/zinc/86/18/54/1333861854.db2.gz	AXSHFIGIXHDASN-RTBURBONSA-N	0	3	346.515	3.082	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)CC(C3CC3)C3CC3)CC2)C1	ZINC000949531695	1333869104	/nfs/dbraw/zinc/86/91/04/1333869104.db2.gz	PGMQWDWGECTMPL-UHFFFAOYSA-N	0	3	346.515	3.082	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2nc(Cl)sc2C)C1	ZINC000967313651	1335697836	/nfs/dbraw/zinc/69/78/36/1335697836.db2.gz	OKWVSXKFQVJPKO-ZYHUDNBSSA-N	0	3	327.881	3.121	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2scnc2C)CCCCC1	ZINC001115423364	1370445781	/nfs/dbraw/zinc/44/57/81/1370445781.db2.gz	LKTDDBMSZXPCJC-UHFFFAOYSA-N	0	3	327.881	3.226	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)Cc2cc(F)c(F)cc2F)C1	ZINC000968354442	1335899839	/nfs/dbraw/zinc/89/98/39/1335899839.db2.gz	SVKDJYMEELCXDW-PXAZEXFGSA-N	0	3	340.389	3.049	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2cc(F)cc3cccnc32)C1	ZINC000968369717	1335907083	/nfs/dbraw/zinc/90/70/83/1335907083.db2.gz	PGYRRMNJHGSCPA-KSSFIOAISA-N	0	3	341.430	3.390	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@H](NC(=O)Cc2ccc(Cl)s2)C1	ZINC000968387034	1335914529	/nfs/dbraw/zinc/91/45/29/1335914529.db2.gz	TTWZHLPOLNCJGT-TZMCWYRMSA-N	0	3	326.893	3.347	20	30		EGEDHN
C=C(C)CN1CC[C@@H](C)[C@@H](NC(=O)Cn2cc(C)c3ccccc32)C1	ZINC000968399986	1335920422	/nfs/dbraw/zinc/92/04/22/1335920422.db2.gz	KBKPOMCQSIYWFU-APWZRJJASA-N	0	3	339.483	3.352	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)Cn2cc(C)c3ccccc32)C1	ZINC000968399987	1335920495	/nfs/dbraw/zinc/92/04/95/1335920495.db2.gz	KBKPOMCQSIYWFU-LPHOPBHVSA-N	0	3	339.483	3.352	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)Cc2c[nH]c3cc(C)ccc23)C1	ZINC000968405698	1335922053	/nfs/dbraw/zinc/92/20/53/1335922053.db2.gz	PMQSERUKTPUVJM-OXJNMPFZSA-N	0	3	339.483	3.422	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)C(C)(C)c2ccc(C)cc2)C1	ZINC000968556556	1335960663	/nfs/dbraw/zinc/96/06/63/1335960663.db2.gz	BGIYSJFGUMPZQP-MJGOQNOKSA-N	0	3	326.484	3.123	20	30		EGEDHN
C=C(C)CCN1CC[C@H](C)[C@H](NC(=O)c2cnc(C3CC3)s2)C1	ZINC000968565601	1335961189	/nfs/dbraw/zinc/96/11/89/1335961189.db2.gz	HRCUMPRRIXBSNS-DZGCQCFKSA-N	0	3	333.501	3.427	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2ccc(CC(C)C)cc2)C1	ZINC000968628528	1335990074	/nfs/dbraw/zinc/99/00/74/1335990074.db2.gz	ZZKGSBJHQHNIAM-FXAWDEMLSA-N	0	3	326.484	3.349	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)c2cc3c(cccc3OC)[nH]2)C1	ZINC000968643622	1335994917	/nfs/dbraw/zinc/99/49/17/1335994917.db2.gz	OFGGDNJTQNIOQW-KBXCAEBGSA-N	0	3	341.455	3.193	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(C(=O)[C@H]3CCCC4(CC4)C3)C2)s1	ZINC000968663399	1336001454	/nfs/dbraw/zinc/00/14/54/1336001454.db2.gz	IZDQDFJQDBVEIW-LSDHHAIUSA-N	0	3	343.496	3.281	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@@H](NC(=O)C2(c3ccc(C)cc3)CCC2)C1	ZINC000968691608	1336013304	/nfs/dbraw/zinc/01/33/04/1336013304.db2.gz	HSVHGDZDBJMEHU-QUCCMNQESA-N	0	3	338.495	3.267	20	30		EGEDHN
N#Cc1cccc(CN2CCCCC[C@@H]2CNC(=O)[C@@H]2CC2(F)F)c1	ZINC000968853715	1336068391	/nfs/dbraw/zinc/06/83/91/1336068391.db2.gz	OSQGQENCJZLMAU-SJORKVTESA-N	0	3	347.409	3.074	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1c(C)noc1CCC	ZINC000968856493	1336069792	/nfs/dbraw/zinc/06/97/92/1336069792.db2.gz	JAIXWHFZOVEOHA-MRXNPFEDSA-N	0	3	333.476	3.486	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1ccc(OC(C)C)nc1	ZINC000968879260	1336076999	/nfs/dbraw/zinc/07/69/99/1336076999.db2.gz	CJKMGXHPGLBJAP-KRWDZBQOSA-N	0	3	331.460	3.029	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)[C@@H]1CCc2cc(OC)ccc21	ZINC000968884750	1336079984	/nfs/dbraw/zinc/07/99/84/1336079984.db2.gz	BGQDTTZXRFHVCZ-FXAWDEMLSA-N	0	3	342.483	3.272	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cc(C)n([C@@H](C)CC)n1	ZINC000968922885	1336090961	/nfs/dbraw/zinc/09/09/61/1336090961.db2.gz	HHFJHMUYOAZCSD-DOTOQJQBSA-N	0	3	332.492	3.323	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1[nH]nc2ccc(C)cc21	ZINC000968931120	1336093594	/nfs/dbraw/zinc/09/35/94/1336093594.db2.gz	GUCIFBYWBFKYTQ-HNNXBMFYSA-N	0	3	326.444	3.032	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)[C@@H]1CCc2ccc(F)cc2O1	ZINC000968952652	1336101328	/nfs/dbraw/zinc/10/13/28/1336101328.db2.gz	VUKHNMOHKFVADQ-MSOLQXFVSA-N	0	3	346.446	3.066	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)[C@@H]1CCc2cc(F)ccc21	ZINC000968952699	1336101668	/nfs/dbraw/zinc/10/16/68/1336101668.db2.gz	WXFPIVHNOCWOCG-PKOBYXMFSA-N	0	3	330.447	3.402	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)[C@H]1CCCCC1(F)F	ZINC000968967819	1336104814	/nfs/dbraw/zinc/10/48/14/1336104814.db2.gz	BKFWHPZYYWRLEJ-HZPDHXFCSA-N	0	3	326.431	3.196	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1ccn(C(C)C)c1C	ZINC000968994618	1336113520	/nfs/dbraw/zinc/11/35/20/1336113520.db2.gz	WGIXICPSGZVNQY-GOSISDBHSA-N	0	3	329.488	3.375	20	30		EGEDHN
C#CCCN1CCCCC[C@@H]1CNC(=O)c1c(F)ccc(F)c1F	ZINC000969010695	1336117149	/nfs/dbraw/zinc/11/71/49/1336117149.db2.gz	ANVCFTIFADVCSM-CYBMUJFWSA-N	0	3	338.373	3.102	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)[C@@H]1CCCC(F)(F)C1	ZINC000969025818	1336121941	/nfs/dbraw/zinc/12/19/41/1336121941.db2.gz	WDYLJRCDWKRBOY-HZPDHXFCSA-N	0	3	326.431	3.196	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)[C@@H]1C[C@H]1c1ccccc1OC	ZINC000969064818	1336136165	/nfs/dbraw/zinc/13/61/65/1336136165.db2.gz	NAYQYKNEAGSRNH-YTQUADARSA-N	0	3	342.483	3.346	20	30		EGEDHN
C#CCCN1CCCCC[C@H]1CNC(=O)c1cc2cccnc2s1	ZINC000969103557	1336144649	/nfs/dbraw/zinc/14/46/49/1336144649.db2.gz	YDPPKDBFBKLYDD-INIZCTEOSA-N	0	3	341.480	3.294	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1ccnc(O[C@@H](C)CC)c1	ZINC000969105975	1336145911	/nfs/dbraw/zinc/14/59/11/1336145911.db2.gz	QFTVXHQLMGSSIJ-FUHWJXTLSA-N	0	3	345.487	3.419	20	30		EGEDHN
C=C(C)CN1CCCCC[C@H]1CNC(=O)c1ncccc1OC(C)C	ZINC000969132574	1336154823	/nfs/dbraw/zinc/15/48/23/1336154823.db2.gz	DJOCOZPVVLWUCO-KRWDZBQOSA-N	0	3	345.487	3.419	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)c1cc(C)c(F)c(C)c1	ZINC000969148323	1336162206	/nfs/dbraw/zinc/16/22/06/1336162206.db2.gz	RYBRTJLHTPTAPU-GOSISDBHSA-N	0	3	330.447	3.440	20	30		EGEDHN
C[C@H](NC(=O)c1c[nH]c(C#N)c1)C1CN(Cc2ccccc2C2CC2)C1	ZINC000969525747	1336220329	/nfs/dbraw/zinc/22/03/29/1336220329.db2.gz	FCGVSBKNEHUGHO-AWEZNQCLSA-N	0	3	348.450	3.014	20	30		EGEDHN
CC1(C)CCC[C@@H]1C(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC000969622047	1336229861	/nfs/dbraw/zinc/22/98/61/1336229861.db2.gz	FGWPLTINLSXILX-IAGOWNOFSA-N	0	3	343.446	3.214	20	30		EGEDHN
N#Cc1ccc(CN[C@@H]2CCN(C(=O)[C@@H](F)c3ccccc3)C2)s1	ZINC000970112145	1336280731	/nfs/dbraw/zinc/28/07/31/1336280731.db2.gz	OCDLRMKSAOYROV-PBHICJAKSA-N	0	3	343.427	3.021	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H](C)C2CN(CC3CC(F)(F)C3)C2)CC1	ZINC000970376343	1336299821	/nfs/dbraw/zinc/29/98/21/1336299821.db2.gz	KGUFTVWPNUSPGF-ZDUSSCGKSA-N	0	3	326.431	3.215	20	30		EGEDHN
Cc1cccc(C(=O)N2CC[C@@H](NCc3ccc(C#N)s3)C2)c1C	ZINC000970620789	1336328409	/nfs/dbraw/zinc/32/84/09/1336328409.db2.gz	LAVLWCFUPUWMQI-OAHLLOKOSA-N	0	3	339.464	3.241	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)[C@H]2CC[C@H]2c2ccc(F)cc2)CC1	ZINC001005753701	1336398750	/nfs/dbraw/zinc/39/87/50/1336398750.db2.gz	GLFNGIGVBQTTIL-OALUTQOASA-N	0	3	330.447	3.428	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2c(C)noc2C(F)(F)F)CC1	ZINC001006060268	1336445129	/nfs/dbraw/zinc/44/51/29/1336445129.db2.gz	MSKSLUHGTWCGOW-UHFFFAOYSA-N	0	3	345.365	3.114	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccccc2NC(=O)CC)CC1	ZINC001006155199	1336461336	/nfs/dbraw/zinc/46/13/36/1336461336.db2.gz	MSQIZIWRQUWMLS-UHFFFAOYSA-N	0	3	343.471	3.148	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cc(F)c(F)c(F)c2F)CC1	ZINC001006326654	1336489485	/nfs/dbraw/zinc/48/94/85/1336489485.db2.gz	PFTQEQPRONWGTN-UHFFFAOYSA-N	0	3	344.352	3.356	20	30		EGEDHN
C=C(C)CCN1CCC[C@@H](NC(=O)c2c(F)cc(OC)cc2F)C1	ZINC001008628637	1336897871	/nfs/dbraw/zinc/89/78/71/1336897871.db2.gz	JRRRPJUIOPEWHJ-CYBMUJFWSA-N	0	3	338.398	3.134	20	30		EGEDHN
C#CCCN1CCC[C@@H](NC(=O)C(C)(C)c2cccc(Cl)c2)C1	ZINC001008708519	1336915407	/nfs/dbraw/zinc/91/54/07/1336915407.db2.gz	GCQVKPQLOXVNDJ-QGZVFWFLSA-N	0	3	332.875	3.222	20	30		EGEDHN
C#CCCN1CCC[C@H](NC(=O)c2ccc(O[C@H](C)CC)cc2)C1	ZINC001009105702	1336970299	/nfs/dbraw/zinc/97/02/99/1336970299.db2.gz	COPNELHXTSQRHY-AEFFLSMTSA-N	0	3	328.456	3.081	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCN(Cc3cc(C)cc(C)c3)C2)cn1	ZINC001009267694	1336994082	/nfs/dbraw/zinc/99/40/82/1336994082.db2.gz	DKUXYEPICAMLCJ-OAQYLSRUSA-N	0	3	347.462	3.074	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3cc(C)ccc3C)C2)cc1	ZINC001015477970	1338153840	/nfs/dbraw/zinc/15/38/40/1338153840.db2.gz	UFDULRTYRDBJBQ-NRFANRHFSA-N	0	3	332.447	3.289	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(CCCc3cccc(F)c3)C2)C1	ZINC001015675696	1338253078	/nfs/dbraw/zinc/25/30/78/1338253078.db2.gz	CNYOEIKZUFDKGT-GOSISDBHSA-N	0	3	330.447	3.305	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(CC[C@H]3CCCC3(F)F)C2)C1	ZINC001015677494	1338253695	/nfs/dbraw/zinc/25/36/95/1338253695.db2.gz	WGWNHFMGDAXSOP-HUUCEWRRSA-N	0	3	326.431	3.359	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@H]2CCN([C@H](CC)c3ccccc3)C2)c1	ZINC001015679957	1338255335	/nfs/dbraw/zinc/25/53/35/1338255335.db2.gz	QRAXFTRMCCBXSL-VQTJNVASSA-N	0	3	333.435	3.018	20	30		EGEDHN
C=CCOc1cccnc1C(=O)N[C@@H]1CCN(CCCC2CCC2)C1	ZINC001015969535	1338383427	/nfs/dbraw/zinc/38/34/27/1338383427.db2.gz	VYGCFHYJWCPRKC-QGZVFWFLSA-N	0	3	343.471	3.031	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN([C@@H](CC)c3ccccc3)C2)nc1	ZINC001016028466	1338415040	/nfs/dbraw/zinc/41/50/40/1338415040.db2.gz	YOQPUGQPGDUBIU-QUCCMNQESA-N	0	3	333.435	3.018	20	30		EGEDHN
C=C(C)CCN1CC[C@@H](NC(=O)c2cnc(-c3ccco3)s2)C1	ZINC001016041141	1338424516	/nfs/dbraw/zinc/42/45/16/1338424516.db2.gz	OPLGBLJQMNFASH-CYBMUJFWSA-N	0	3	331.441	3.173	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cccc(OCCC)c2)CC1	ZINC001016649519	1338677828	/nfs/dbraw/zinc/67/78/28/1338677828.db2.gz	NJGLIZBVYBYMJU-LJQANCHMSA-N	0	3	340.467	3.083	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)Cc2cccc(C(C)C)c2)CC1	ZINC001016707666	1338697683	/nfs/dbraw/zinc/69/76/83/1338697683.db2.gz	ZETRNCHPNXUDPF-HXUWFJFHSA-N	0	3	338.495	3.347	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)Cc2ccc(C(F)F)cc2)CC1	ZINC001016724397	1338702943	/nfs/dbraw/zinc/70/29/43/1338702943.db2.gz	QBQBZJCZZKYIQJ-QGZVFWFLSA-N	0	3	346.421	3.161	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CC23CCN(Cc2cnccc2C)CC3)C1	ZINC001016811302	1338734738	/nfs/dbraw/zinc/73/47/38/1338734738.db2.gz	CQSRZFSGGBIWGS-GOSISDBHSA-N	0	3	339.483	3.217	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2[nH]c3ccc(C)cc3c2C)CC1	ZINC001016907476	1338765788	/nfs/dbraw/zinc/76/57/88/1338765788.db2.gz	RXFUEYXKUBWQHQ-GOSISDBHSA-N	0	3	335.451	3.002	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cc(CC)c(CC)o2)CC1	ZINC001016936997	1338775004	/nfs/dbraw/zinc/77/50/04/1338775004.db2.gz	WQNHQMLMXODDBM-SFHVURJKSA-N	0	3	328.456	3.012	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2ccc(Cl)c(Cl)c2)CC1	ZINC001016945301	1338779559	/nfs/dbraw/zinc/77/95/59/1338779559.db2.gz	XPLIWRSUMABEFK-OAHLLOKOSA-N	0	3	337.250	3.211	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2cccc3ccccc32)CC1	ZINC001016953748	1338783024	/nfs/dbraw/zinc/78/30/24/1338783024.db2.gz	WYMYVUVQBPKUSF-FQEVSTJZSA-N	0	3	332.447	3.447	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cc3ccccc3n2CC)CC1	ZINC001016983102	1338791690	/nfs/dbraw/zinc/79/16/90/1338791690.db2.gz	OPBSSJKMKRORAH-HXUWFJFHSA-N	0	3	349.478	3.269	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C(C)(C)[C@H]1CCCCO1	ZINC001017558277	1339367739	/nfs/dbraw/zinc/36/77/39/1339367739.db2.gz	CIOPIRXXRAZVJC-FGTMMUONSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccnn1C(CC)CC	ZINC001017615951	1339377404	/nfs/dbraw/zinc/37/74/04/1339377404.db2.gz	BPJAAHLDUJWOMI-HDICACEKSA-N	0	3	344.503	3.499	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CCC[C@@H]1C(F)F	ZINC001017616797	1339377978	/nfs/dbraw/zinc/37/79/78/1339377978.db2.gz	IDRYFEQOSCULEI-XUWVNRHRSA-N	0	3	326.431	3.309	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccc2cnccc21	ZINC001017662240	1339386603	/nfs/dbraw/zinc/38/66/03/1339386603.db2.gz	DASGFIIZVREILE-BGYRXZFFSA-N	0	3	349.478	3.419	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CCCCC1(F)F	ZINC001017765322	1339413744	/nfs/dbraw/zinc/41/37/44/1339413744.db2.gz	HNOKCADCGUXKQS-XHSDSOJGSA-N	0	3	326.431	3.453	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1CCCc2cccnc21	ZINC001017835723	1339428957	/nfs/dbraw/zinc/42/89/57/1339428957.db2.gz	OYPDBSMTALJISL-CEXWTWQISA-N	0	3	339.483	3.143	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H]1Cc2ccc(F)cc21	ZINC001017853238	1339430742	/nfs/dbraw/zinc/43/07/42/1339430742.db2.gz	WCLMXRXMMQGXCB-ZIFCJYIRSA-N	0	3	328.431	3.107	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1nccc2ccccc21	ZINC001017858797	1339431719	/nfs/dbraw/zinc/43/17/19/1339431719.db2.gz	KXMKNIMVWGSLPF-HDICACEKSA-N	0	3	335.451	3.490	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1ccc(Cl)c(F)c1	ZINC001017993640	1339476911	/nfs/dbraw/zinc/47/69/11/1339476911.db2.gz	VKBQGKMZSAAIIF-GASCZTMLSA-N	0	3	336.838	3.273	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CCc1scnc1C	ZINC001018133149	1339509869	/nfs/dbraw/zinc/50/98/69/1339509869.db2.gz	TWSISQDDAJACBE-IYBDPMFKSA-N	0	3	333.501	3.026	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)CC[C@@H]1CC(C)(C)CO1	ZINC001018213945	1339535628	/nfs/dbraw/zinc/53/56/28/1339535628.db2.gz	NBVLBPSOUYYBMW-FGTMMUONSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(COC)cc1	ZINC001018256705	1339551731	/nfs/dbraw/zinc/55/17/31/1339551731.db2.gz	ROSIQRCXSIMZRM-KDURUIRLSA-N	0	3	328.456	3.088	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)COc1cc(C)ccc1C	ZINC001018263887	1339554534	/nfs/dbraw/zinc/55/45/34/1339554534.db2.gz	NROADDJLINYGHY-KDURUIRLSA-N	0	3	342.483	3.324	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)Cc1cccc(OCC)c1	ZINC001018322086	1339576478	/nfs/dbraw/zinc/57/64/78/1339576478.db2.gz	NFIAOLADTBTLKX-KDURUIRLSA-N	0	3	342.483	3.269	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)Cc1ccc(F)cc1	ZINC001018332492	1339580556	/nfs/dbraw/zinc/58/05/56/1339580556.db2.gz	OUPSDLCXRSHZES-LZQZEXGQSA-N	0	3	330.447	3.256	20	30		EGEDHN
CC1(CC(=O)N2CC[C@H](NCc3ccc(F)c(C#N)c3)C2)CCCC1	ZINC001018804247	1339729919	/nfs/dbraw/zinc/72/99/19/1339729919.db2.gz	AZGLPAGQKCZRGP-KRWDZBQOSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1csc(-c2ccco2)n1	ZINC001028101733	1340426532	/nfs/dbraw/zinc/42/65/32/1340426532.db2.gz	SGCJGRUVJNHVTG-ZDUSSCGKSA-N	0	3	331.441	3.173	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)[C@H]1CCCc2sc(C)nc21	ZINC001028259264	1340517588	/nfs/dbraw/zinc/51/75/88/1340517588.db2.gz	LYYVZAVNCGRQCC-CABCVRRESA-N	0	3	333.501	3.028	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H]2CCCN2Cc2ccc(C)c(C)c2)cn1	ZINC001028269760	1340523539	/nfs/dbraw/zinc/52/35/39/1340523539.db2.gz	ANYRTAXGJPFQIO-OAQYLSRUSA-N	0	3	347.462	3.074	20	30		EGEDHN
Cc1cc(C)c(C(=O)NC[C@@H]2CCN(Cc3cccc(C#N)c3)C2)o1	ZINC001028463111	1340653719	/nfs/dbraw/zinc/65/37/19/1340653719.db2.gz	QMMMFWBSJFFUPC-SFHVURJKSA-N	0	3	337.423	3.020	20	30		EGEDHN
CC1(C)CC[C@H](C(=O)NC[C@H]2CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001028788112	1340818415	/nfs/dbraw/zinc/81/84/15/1340818415.db2.gz	JBVZWQWREXQUKU-MOPGFXCFSA-N	0	3	339.483	3.323	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H](CNC(=O)[C@@]34C[C@@H]3CCCC4)C2)c1	ZINC001028791909	1340823905	/nfs/dbraw/zinc/82/39/05/1340823905.db2.gz	XQPYZTRSAKAUCK-DYXWJJEUSA-N	0	3	337.467	3.077	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)[C@@H]2C[C@H]2c2cccc3ccccc32)C1	ZINC001028874283	1340873293	/nfs/dbraw/zinc/87/32/93/1340873293.db2.gz	YWKWZBCYODZICQ-VOQZNFBZSA-N	0	3	346.474	3.405	20	30		EGEDHN
Cc1cccc(C(=O)NC[C@@H]2CCN(Cc3cccc(C#N)c3)C2)c1C	ZINC001028965035	1340894854	/nfs/dbraw/zinc/89/48/54/1340894854.db2.gz	XAPASHMNZLNXHU-FQEVSTJZSA-N	0	3	347.462	3.427	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)C1CCN(C(=O)C2CCCC2)CC1	ZINC001029035344	1340913527	/nfs/dbraw/zinc/91/35/27/1340913527.db2.gz	USJBGDDAOAUNAV-MRXNPFEDSA-N	0	3	339.483	3.465	20	30		EGEDHN
C[C@H](NCc1cc(F)ccc1C#N)C1CCN(C(=O)C2CCC2)CC1	ZINC001029036830	1340914054	/nfs/dbraw/zinc/91/40/54/1340914054.db2.gz	SRUCGGKQGBNGPJ-AWEZNQCLSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC([C@@H](C)NCc2ncc(C)s2)CC1	ZINC001029124718	1340935967	/nfs/dbraw/zinc/93/59/67/1340935967.db2.gz	BHIPKIFVFXGVDE-CQSZACIVSA-N	0	3	335.517	3.380	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC([C@H](C)NCc2nccs2)CC1	ZINC001029136180	1340939665	/nfs/dbraw/zinc/93/96/65/1340939665.db2.gz	AVCGLWVIOHNMTJ-KSSFIOAISA-N	0	3	335.517	3.462	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)C1CCN(C(=O)C(C)(C)C)CC1	ZINC001029167662	1340947239	/nfs/dbraw/zinc/94/72/39/1340947239.db2.gz	IOVFBDPYBATCOI-HNNXBMFYSA-N	0	3	327.472	3.321	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1C[C@H]2CC[C@@H](C1)N2[C@@H]1CCc2c1cccc2Cl	ZINC001029244622	1340960543	/nfs/dbraw/zinc/96/05/43/1340960543.db2.gz	JVBVTBQYXLKORY-UYAYXHRUSA-N	0	3	343.858	3.162	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCN(C(=O)CC(C)(C)C)C1	ZINC001029648016	1341033380	/nfs/dbraw/zinc/03/33/80/1341033380.db2.gz	XOHNFZFQULIRBW-CQSZACIVSA-N	0	3	333.501	3.336	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H](CN(C)[C@H](C)c2cnc(C)cn2)C1	ZINC001029799754	1341076661	/nfs/dbraw/zinc/07/66/61/1341076661.db2.gz	CWMIWOFKUJFWEJ-SJORKVTESA-N	0	3	344.503	3.229	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](CN(C)Cc2c(C)nsc2C)C1	ZINC001029802049	1341077751	/nfs/dbraw/zinc/07/77/51/1341077751.db2.gz	UWPPQJKKANTYGX-HNNXBMFYSA-N	0	3	335.517	3.252	20	30		EGEDHN
Cc1cocc1C(=O)N1CC[C@H](CN(C)Cc2ccc(C#N)s2)C1	ZINC001029808386	1341081021	/nfs/dbraw/zinc/08/10/21/1341081021.db2.gz	OQGJAVGKLNIAMW-CQSZACIVSA-N	0	3	343.452	3.115	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@H](CN(C)Cc2cnc(C)s2)C1	ZINC001029826762	1341087974	/nfs/dbraw/zinc/08/79/74/1341087974.db2.gz	VIWHURQQGQUSCW-YJBOKZPZSA-N	0	3	335.517	3.334	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](CN(C)Cc3cncc(C)c3)C2)CC1	ZINC001029826806	1341088121	/nfs/dbraw/zinc/08/81/21/1341088121.db2.gz	VZVRSYRAWINEBG-SFHVURJKSA-N	0	3	341.499	3.417	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](CN(C)Cc3ccccc3F)C2)C1	ZINC001029836558	1341092282	/nfs/dbraw/zinc/09/22/82/1341092282.db2.gz	SILGXQDANKAGLH-MRXNPFEDSA-N	0	3	330.447	3.462	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCN(C(=O)[C@H]2CC23CCC3)C1	ZINC001029856090	1341097144	/nfs/dbraw/zinc/09/71/44/1341097144.db2.gz	XFNXAFPKKRKPIH-RHSMWYFYSA-N	0	3	343.496	3.090	20	30		EGEDHN
C#CCCN1CCC[C@@H](N(Cc2ccccc2)C(=O)[C@@H]2CC23CC3)C1	ZINC001029920854	1341120072	/nfs/dbraw/zinc/12/00/72/1341120072.db2.gz	AIRPNMYYTVLIDW-UXHICEINSA-N	0	3	336.479	3.303	20	30		EGEDHN
C#Cc1ccc(C(=O)N(Cc2ccccc2)[C@H]2CCCN(CC)C2)nc1	ZINC001029920813	1341120093	/nfs/dbraw/zinc/12/00/93/1341120093.db2.gz	LXMIYCXZYNMIEA-FQEVSTJZSA-N	0	3	347.462	3.190	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC(CN(C)Cc2ccc(C#N)cc2F)CC1	ZINC001029954002	1341133960	/nfs/dbraw/zinc/13/39/60/1341133960.db2.gz	OUDPFZCBKZTDQT-TVPGTPATSA-N	0	3	343.446	3.334	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC(CN(C)[C@H](C)c2cnccn2)CC1	ZINC001029989935	1341147977	/nfs/dbraw/zinc/14/79/77/1341147977.db2.gz	DHFNOAJZLUVQCQ-UZLBHIALSA-N	0	3	344.503	3.310	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC(CN(C)Cc2cncc(F)c2)CC1	ZINC001029991421	1341148655	/nfs/dbraw/zinc/14/86/55/1341148655.db2.gz	YZDMSFGCSNRMME-FQEVSTJZSA-N	0	3	347.478	3.493	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1ccc(C(F)F)cc1	ZINC001032516127	1341528326	/nfs/dbraw/zinc/52/83/26/1341528326.db2.gz	HCFWHFJPSXLPLZ-IRXDYDNUSA-N	0	3	334.410	3.418	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)[C@@H](C)OC1CCCCCC1	ZINC001032618360	1341561623	/nfs/dbraw/zinc/56/16/23/1341561623.db2.gz	ULDBHEBSBHIYCK-SQNIBIBYSA-N	0	3	334.504	3.366	20	30		EGEDHN
C=CCCN1C[C@@H]2C[C@H]1CN2C(=O)C[C@H](C)c1cccc(OC)c1	ZINC001032810230	1341622699	/nfs/dbraw/zinc/62/26/99/1341622699.db2.gz	XHPUOXKIGWRKOO-SZMVWBNQSA-N	0	3	328.456	3.050	20	30		EGEDHN
C=CCn1cccc1C(=O)N(C)[C@H]1CCN(Cc2cccc(C)c2)C1	ZINC001033146503	1341739331	/nfs/dbraw/zinc/73/93/31/1341739331.db2.gz	PSDQNJSIKDKDHO-IBGZPJMESA-N	0	3	337.467	3.329	20	30		EGEDHN
C#CCCN1CC[C@@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccc(Cl)s2)C1	ZINC001033365138	1341797130	/nfs/dbraw/zinc/79/71/30/1341797130.db2.gz	LKCPWTCPJBIMBO-MGPQQGTHSA-N	0	3	336.888	3.061	20	30		EGEDHN
C=CCCN1CC[C@@H](N(C)C(=O)c2cc3cccc(OC)c3o2)C1	ZINC001033383892	1341805248	/nfs/dbraw/zinc/80/52/48/1341805248.db2.gz	MNGRVUAAJWRKDK-OAHLLOKOSA-N	0	3	328.412	3.164	20	30		EGEDHN
C=C1CCC(C(=O)N(C)[C@H]2CCN(C[C@H]3CC(C)(C)CO3)C2)CC1	ZINC001033388285	1341807582	/nfs/dbraw/zinc/80/75/82/1341807582.db2.gz	AVRMKZBFZFKNSG-ZWKOTPCHSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)Cc2c[nH]c3c2cccc3C)C1	ZINC001033469579	1341838896	/nfs/dbraw/zinc/83/88/96/1341838896.db2.gz	OYXOSPMEEOAVRO-KRWDZBQOSA-N	0	3	325.456	3.128	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@H]2CCN(Cc3cc(C)ccc3C)C2)nc1	ZINC001033594140	1341888524	/nfs/dbraw/zinc/88/85/24/1341888524.db2.gz	SVQVRJALVXWKEF-FQEVSTJZSA-N	0	3	347.462	3.026	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@@H]2CCN([C@@H](C)c3cccc(C)c3)C2)nc1	ZINC001033597046	1341890063	/nfs/dbraw/zinc/89/00/63/1341890063.db2.gz	QXVZSDWLUZNLSJ-FXAWDEMLSA-N	0	3	347.462	3.279	20	30		EGEDHN
C#CCCN1CC[C@H](N(C)C(=O)CC2C3CC4CC(C3)CC2C4)C1	ZINC001033674865	1341940821	/nfs/dbraw/zinc/94/08/21/1341940821.db2.gz	DEMGPJDXJSBDMZ-BIKXEMDZSA-N	0	3	328.500	3.005	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccnc(-c3ccco3)c2)C1	ZINC001033873579	1342053078	/nfs/dbraw/zinc/05/30/78/1342053078.db2.gz	YKEDLWHKGCTRCQ-QGZVFWFLSA-N	0	3	339.439	3.454	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2cc(F)c(Cl)cc2F)C1	ZINC001033936626	1342098826	/nfs/dbraw/zinc/09/88/26/1342098826.db2.gz	SXYJFGWOFFVEJZ-LBPRGKRZSA-N	0	3	340.801	3.178	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)[C@@H]2C[C@H]2c2ccccc2CC)C1	ZINC001033938564	1342101012	/nfs/dbraw/zinc/10/10/12/1342101012.db2.gz	YNUDIARMWNKYBK-HLAWJBBLSA-N	0	3	338.495	3.299	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2c[nH]c(-c3ccccc3)n2)C1	ZINC001033973301	1342123633	/nfs/dbraw/zinc/12/36/33/1342123633.db2.gz	XHHOUJFGQNOHGO-QGZVFWFLSA-N	0	3	338.455	3.189	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2cccc(OCC(C)C)c2)C1	ZINC001034036696	1342175745	/nfs/dbraw/zinc/17/57/45/1342175745.db2.gz	VRQSLFPIJGDAEW-IBGZPJMESA-N	0	3	342.483	3.281	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@H]2Cc3ccc(Cl)cc32)C1	ZINC001034037859	1342178440	/nfs/dbraw/zinc/17/84/40/1342178440.db2.gz	SGTYDNHVIWCHMU-WMZOPIPTSA-N	0	3	332.875	3.479	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)[C@@H]2C[C@H]2c2cccc(F)c2F)C1	ZINC001034048396	1342188282	/nfs/dbraw/zinc/18/82/82/1342188282.db2.gz	NWXXVYCEOGVVRA-BHYGNILZSA-N	0	3	346.421	3.014	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cccc3scnc32)C1	ZINC001034203605	1342314089	/nfs/dbraw/zinc/31/40/89/1342314089.db2.gz	FSIXJTPEXJQYHP-AWEZNQCLSA-N	0	3	329.469	3.457	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2cccc(C(F)F)c2F)C1	ZINC001034210701	1342320286	/nfs/dbraw/zinc/32/02/86/1342320286.db2.gz	SUHGICDTWZRTLY-CYBMUJFWSA-N	0	3	338.373	3.371	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2cscc2C(F)F)C1	ZINC001034211131	1342320931	/nfs/dbraw/zinc/32/09/31/1342320931.db2.gz	YESDOLKYRCQIDC-GFCCVEGCSA-N	0	3	326.412	3.293	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)c2coc3c2cccc3OC)C1	ZINC001034213418	1342322573	/nfs/dbraw/zinc/32/25/73/1342322573.db2.gz	XYTJMKHJVYKCNT-CQSZACIVSA-N	0	3	328.412	3.212	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@@H]2CCCN2c2ccccc2)C1	ZINC001034239690	1342340755	/nfs/dbraw/zinc/34/07/55/1342340755.db2.gz	AFQKCDXDXDKTJW-ICSRJNTNSA-N	0	3	341.499	3.202	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cnoc2-c2ccco2)C1	ZINC001034270266	1342360813	/nfs/dbraw/zinc/36/08/13/1342360813.db2.gz	DSHFEKYDCAPTJA-CQSZACIVSA-N	0	3	329.400	3.095	20	30		EGEDHN
C=CCOc1ccccc1C(=O)N[C@H]1CCCCN(CC(=C)C)C1	ZINC001034275258	1342367040	/nfs/dbraw/zinc/36/70/40/1342367040.db2.gz	FOJQLLZZLAGULA-KRWDZBQOSA-N	0	3	328.456	3.412	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cc(C)n([C@@H](C)C3CC3)n2)C1	ZINC001034280116	1342369764	/nfs/dbraw/zinc/36/97/64/1342369764.db2.gz	BPXDRYBDJCIEQB-FUHWJXTLSA-N	0	3	344.503	3.323	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cccc([C@@H]3CCOC3)c2)C1	ZINC001034279136	1342369878	/nfs/dbraw/zinc/36/98/78/1342369878.db2.gz	IQRQHZVCDVXLJX-UXHICEINSA-N	0	3	342.483	3.351	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@H]2CCOc3c(F)cccc32)C1	ZINC001034296263	1342379797	/nfs/dbraw/zinc/37/97/97/1342379797.db2.gz	NLPPMCWUPRWSMD-RDJZCZTQSA-N	0	3	346.446	3.239	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cc3c(cn2)CCCC3)C1	ZINC001034299719	1342382647	/nfs/dbraw/zinc/38/26/47/1342382647.db2.gz	IPPWIYSXHXPGFI-GOSISDBHSA-N	0	3	327.472	3.121	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cnn(-c3ccccc3)c2)C1	ZINC001034301488	1342384032	/nfs/dbraw/zinc/38/40/32/1342384032.db2.gz	MKSNBPMIQKXVTC-GOSISDBHSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=CCCN1CCCC[C@@H](NC(=O)c2cc3c(C)nn(C)c3s2)C1	ZINC001034330916	1342405812	/nfs/dbraw/zinc/40/58/12/1342405812.db2.gz	BCHNJUKCGBJUBG-CQSZACIVSA-N	0	3	346.500	3.104	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)[C@@H]2CCc3ccccc3C2)C1	ZINC001034413790	1342475877	/nfs/dbraw/zinc/47/58/77/1342475877.db2.gz	QCNFVTILUPAYGH-UXHICEINSA-N	0	3	326.484	3.338	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cc(F)c(F)c(F)c2)C1	ZINC001034425545	1342487215	/nfs/dbraw/zinc/48/72/15/1342487215.db2.gz	VIYUFHFBLCRGGQ-CYBMUJFWSA-N	0	3	326.362	3.264	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)Cn2cc(C)c3ccccc32)C1	ZINC001034437152	1342498951	/nfs/dbraw/zinc/49/89/51/1342498951.db2.gz	WGGYGKMZAGTXHG-SFHVURJKSA-N	0	3	339.483	3.497	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cccc3[nH]c(C)nc32)C1	ZINC001034476483	1342532779	/nfs/dbraw/zinc/53/27/79/1342532779.db2.gz	HPUHXMBRTBWMSZ-HNNXBMFYSA-N	0	3	326.444	3.032	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2cc3c(s2)CC[C@@H](C)C3)C1	ZINC001034522692	1342580883	/nfs/dbraw/zinc/58/08/83/1342580883.db2.gz	VTZDCFWRGACQKZ-NVXWUHKLSA-N	0	3	344.524	3.481	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1CC[C@H](NC(=O)[C@@H]2CC[C@@H](F)C2)CC1	ZINC001034719065	1342713420	/nfs/dbraw/zinc/71/34/20/1342713420.db2.gz	PUANBKLBJWUOIS-UTRMSSBJSA-N	0	3	343.446	3.213	20	30		EGEDHN
N#Cc1cccc(CNCc2ccc(CNC(=O)C3CC=CC3)cc2)c1	ZINC001034811514	1342776278	/nfs/dbraw/zinc/77/62/78/1342776278.db2.gz	UNKOCNXQJQTHAY-UHFFFAOYSA-N	0	3	345.446	3.430	20	30		EGEDHN
N#Cc1ccc(CNCc2ccc(CNC(=O)c3cc[nH]c3)cc2)cc1	ZINC001034817426	1342781758	/nfs/dbraw/zinc/78/17/58/1342781758.db2.gz	GZKUTCCOBUIVLI-UHFFFAOYSA-N	0	3	344.418	3.106	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2ccc(C3CC3)cn2)C12CCC2	ZINC001078798586	1357090507	/nfs/dbraw/zinc/09/05/07/1357090507.db2.gz	QUFUEGKSTBEHNY-IAGOWNOFSA-N	0	3	345.874	3.342	20	30		EGEDHN
N#Cc1ccc(CNC[C@H]2CCCN2C(=O)CCC2CCC2)c(F)c1	ZINC001034899620	1342827619	/nfs/dbraw/zinc/82/76/19/1342827619.db2.gz	BEZPBUXITNQIRW-GOSISDBHSA-N	0	3	343.446	3.358	20	30		EGEDHN
C[C@@H](NC[C@H]1CCCN1C(=O)C#CC1CC1)c1ccccc1Cl	ZINC001034929922	1342840644	/nfs/dbraw/zinc/84/06/44/1342840644.db2.gz	DCJOECVDBFCFKQ-GDBMZVCRSA-N	0	3	330.859	3.395	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)s1)C1CCC1	ZINC001034972886	1342858477	/nfs/dbraw/zinc/85/84/77/1342858477.db2.gz	GFLGONFSUMMOJR-DZGCQCFKSA-N	0	3	331.485	3.137	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@@H]2CNCc2ccc(C#N)cc2F)CCC1	ZINC001035017917	1342878824	/nfs/dbraw/zinc/87/88/24/1342878824.db2.gz	CECZFNUQIMZYOI-QGZVFWFLSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2nc(C)c(C)s2)C12CCC2	ZINC001078812007	1357093864	/nfs/dbraw/zinc/09/38/64/1357093864.db2.gz	CJIKPZFKEBOVSZ-QWHCGFSZSA-N	0	3	339.892	3.143	20	30		EGEDHN
C/C=C(/C)C(=O)N1CCC2(CCN(Cc3ccc(C#N)s3)C2)CC1	ZINC001035171956	1342987220	/nfs/dbraw/zinc/98/72/20/1342987220.db2.gz	HMKGOCDXHRFBCB-CQPUUCJISA-N	0	3	343.496	3.400	20	30		EGEDHN
CC[C@H](F)C(=O)N1CCC2(CCN(Cc3ccc(C#N)s3)C2)CC1	ZINC001035217778	1343037077	/nfs/dbraw/zinc/03/70/77/1343037077.db2.gz	LDMULHGBKSVALE-INIZCTEOSA-N	0	3	349.475	3.182	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC3(CCN(Cc4cc(C)no4)C3)CC2)C1	ZINC001035226426	1343047177	/nfs/dbraw/zinc/04/71/77/1343047177.db2.gz	HSUMSWUEGNJEKX-UHFFFAOYSA-N	0	3	343.471	3.154	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cccc3c1O[C@@H](C)C3)CC2	ZINC001035753620	1343172076	/nfs/dbraw/zinc/17/20/76/1343172076.db2.gz	USLDVVMWHABHDU-INIZCTEOSA-N	0	3	340.467	3.124	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc3cc(F)ccc3[nH]1)CC2	ZINC001035760087	1343174446	/nfs/dbraw/zinc/17/44/46/1343174446.db2.gz	DNBCCDUONCWZHB-UHFFFAOYSA-N	0	3	341.430	3.421	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1scnc1C1CC1)CC2	ZINC001035812400	1343211579	/nfs/dbraw/zinc/21/15/79/1343211579.db2.gz	MLZSDOQUZHUUGD-UHFFFAOYSA-N	0	3	331.485	3.135	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc3ccn(C)c3c1)CC2	ZINC001035828303	1343217403	/nfs/dbraw/zinc/21/74/03/1343217403.db2.gz	NDPRTAJOBJXBIV-UHFFFAOYSA-N	0	3	337.467	3.292	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)C(C)(C)c1ccc(C)cc1)CC2	ZINC001035839732	1343222370	/nfs/dbraw/zinc/22/23/70/1343222370.db2.gz	XOZINHVDYCOGAK-UHFFFAOYSA-N	0	3	338.495	3.220	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1ccc(COC)c(F)c1)CC2	ZINC001035842591	1343225092	/nfs/dbraw/zinc/22/50/92/1343225092.db2.gz	YJHZASJNBOQQIO-UHFFFAOYSA-N	0	3	346.446	3.086	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](NCc2ncc(C)s2)[C@H](C)C1	ZINC001036138143	1343322996	/nfs/dbraw/zinc/32/29/96/1343322996.db2.gz	REYORLYSHFZCAG-HIFRSBDPSA-N	0	3	335.517	3.380	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@@H](NCc2cc(F)ccc2C#N)[C@H](C)C1	ZINC001036163225	1343337982	/nfs/dbraw/zinc/33/79/82/1343337982.db2.gz	FKJNQQLMNXNANA-RDTXWAMCSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](NCc3ccccc3C#N)[C@H](C)C2)C1	ZINC001036171042	1343344432	/nfs/dbraw/zinc/34/44/32/1343344432.db2.gz	VVRYXBYQOPDUSQ-VQIMIIECSA-N	0	3	337.467	3.241	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@H]1CCCN(C(=O)CC2CC2)C1	ZINC001036346977	1343433695	/nfs/dbraw/zinc/43/36/95/1343433695.db2.gz	YVKLLCRVFVTTJX-BEFAXECRSA-N	0	3	325.456	3.075	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]([C@@H](C)NCc2ccn(C(C)C)n2)C1	ZINC001036425780	1343479091	/nfs/dbraw/zinc/47/90/91/1343479091.db2.gz	CGNRYQQVPTUMMR-SJORKVTESA-N	0	3	346.519	3.393	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H]([C@H](C)NCc3cc(C)no3)C2)C1	ZINC001036445164	1343491610	/nfs/dbraw/zinc/49/16/10/1343491610.db2.gz	MGUBOGBZNLHMQJ-HOTGVXAUSA-N	0	3	331.460	3.056	20	30		EGEDHN
C[C@@H]1CCCN(C(=O)/C=C/C2CC2)[C@@H]1CNCc1ccc(C#N)s1	ZINC001036528053	1343536300	/nfs/dbraw/zinc/53/63/00/1343536300.db2.gz	NDTPVONOCBBLRL-NYBJAGPHSA-N	0	3	343.496	3.303	20	30		EGEDHN
C=CCCOCC(=O)N1CCC[C@H](NCc2sccc2Cl)C1	ZINC001211355198	1372539441	/nfs/dbraw/zinc/53/94/41/1372539441.db2.gz	OXUCTPOHSYHMSS-ZDUSSCGKSA-N	0	3	342.892	3.075	20	30		EGEDHN
C/C(=C/C(=O)N1CC[C@@H]2[C@H](CCN2Cc2ccccc2C#N)C1)C1CC1	ZINC001036658368	1343606215	/nfs/dbraw/zinc/60/62/15/1343606215.db2.gz	HLKLMPJPDJAIFL-IPSNVBBLSA-N	0	3	349.478	3.337	20	30		EGEDHN
O=C(CCC1CC1)N1CC[C@@H]2[C@@H](CCN2CC#Cc2ccccc2)C1	ZINC001036670579	1343613593	/nfs/dbraw/zinc/61/35/93/1343613593.db2.gz	WWOUDSPXJYUGBM-LEWJYISDSA-N	0	3	336.479	3.151	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@@H]2[C@H](CCN2Cc2ccc(Cl)cc2)C1	ZINC001036713152	1343646244	/nfs/dbraw/zinc/64/62/44/1343646244.db2.gz	DIIBEFAZXQHMBT-IEBWSBKVSA-N	0	3	342.870	3.176	20	30		EGEDHN
CC(C(=O)N1CC[C@H]2[C@H](CCN2Cc2ccccc2C#N)C1)=C1CCC1	ZINC001036713357	1343646432	/nfs/dbraw/zinc/64/64/32/1343646432.db2.gz	HVLXGYYJKKVFIV-RTWAWAEBSA-N	0	3	349.478	3.481	20	30		EGEDHN
CC(C(=O)N1CC[C@H]2[C@@H](CCN2Cc2ccccc2C#N)C1)=C1CCC1	ZINC001036713358	1343646540	/nfs/dbraw/zinc/64/65/40/1343646540.db2.gz	HVLXGYYJKKVFIV-SFTDATJTSA-N	0	3	349.478	3.481	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCC[C@@H]2CNCc2nc(C)c(C)s2)C1	ZINC001037075129	1343968732	/nfs/dbraw/zinc/96/87/32/1343968732.db2.gz	LXPCEUJHKJEJPL-HZPDHXFCSA-N	0	3	347.528	3.491	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCC[C@H]1NC(=O)c1cccnc1	ZINC001037157373	1344007726	/nfs/dbraw/zinc/00/77/26/1344007726.db2.gz	UXEQPPMTDYTUHZ-AZUAARDMSA-N	0	3	348.450	3.032	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCCC[C@@H]1NC(=O)c1ccccn1	ZINC001037159645	1344009051	/nfs/dbraw/zinc/00/90/51/1344009051.db2.gz	GYYCXJYKVQFOEB-OALUTQOASA-N	0	3	348.450	3.032	20	30		EGEDHN
CC[C@@H]1CN(C(=O)C2(C)CC2)CC[C@H]1NCc1cc(F)ccc1C#N	ZINC001037854950	1344140734	/nfs/dbraw/zinc/14/07/34/1344140734.db2.gz	SEDHBDDMRLZPIM-RDTXWAMCSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](NCc3nc(C)oc3C)[C@H](CC)C2)C1	ZINC001037914878	1344175760	/nfs/dbraw/zinc/17/57/60/1344175760.db2.gz	NNEAKJHJJLITLP-SJORKVTESA-N	0	3	345.487	3.364	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1c(F)ccc2ccncc21	ZINC001038278765	1344354346	/nfs/dbraw/zinc/35/43/46/1344354346.db2.gz	WNVFNTSDMAMKHA-OAHLLOKOSA-N	0	3	327.403	3.144	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CCN2CCCC2CCOCC2)CC1	ZINC001038661771	1344527105	/nfs/dbraw/zinc/52/71/05/1344527105.db2.gz	MPWOZQFRGQDNBO-LJQANCHMSA-N	0	3	334.504	3.130	20	30		EGEDHN
C#Cc1cncc(C(=O)NC[C@@H]2CCN2CC2CCC(C)(C)CC2)c1	ZINC001038684919	1344541984	/nfs/dbraw/zinc/54/19/84/1344541984.db2.gz	NYZNRZQTFNJWPX-IBGZPJMESA-N	0	3	339.483	3.083	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1cnn(C(CC)CC)c1C	ZINC001038904247	1344643343	/nfs/dbraw/zinc/64/33/43/1344643343.db2.gz	UJZTWBRYMYGCRJ-QGZVFWFLSA-N	0	3	332.492	3.323	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)CC(C)(C)C2CC2)C[C@H]1c1cccc(F)c1	ZINC001079182497	1357203354	/nfs/dbraw/zinc/20/33/54/1357203354.db2.gz	LSHDMEIYKABHDV-RBUKOAKNSA-N	0	3	342.458	3.169	20	30		EGEDHN
CC(C)C(=O)N1CCCC[C@H]1[C@H]1CCN(Cc2ccc(C#N)s2)C1	ZINC001039188893	1344890857	/nfs/dbraw/zinc/89/08/57/1344890857.db2.gz	FNAJOKTVZQPXNK-YJBOKZPZSA-N	0	3	345.512	3.479	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2sccc2Cl)C1	ZINC001039212987	1344928395	/nfs/dbraw/zinc/92/83/95/1344928395.db2.gz	ZJIQDJIIPKDVJC-ZFWWWQNUSA-N	0	3	336.888	3.351	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)COC2CCCCC2)C1	ZINC001039214583	1344930691	/nfs/dbraw/zinc/93/06/91/1344930691.db2.gz	TWDYOSXYAOECCN-ICSRJNTNSA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc[nH]c2C2CCC2)C1	ZINC001039233575	1344953514	/nfs/dbraw/zinc/95/35/14/1344953514.db2.gz	LUGWBLKDMQRFMZ-HKUYNNGSSA-N	0	3	339.483	3.232	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cc(C)cc(F)c2)C1	ZINC001039233808	1344953837	/nfs/dbraw/zinc/95/38/37/1344953837.db2.gz	OJEPBZCIMGAUBK-APWZRJJASA-N	0	3	328.431	3.084	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc(C)cc(F)c2)C1	ZINC001039233811	1344954276	/nfs/dbraw/zinc/95/42/76/1344954276.db2.gz	OJEPBZCIMGAUBK-VQIMIIECSA-N	0	3	328.431	3.084	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)Cc2cccc(F)c2)C1	ZINC001039240321	1344964905	/nfs/dbraw/zinc/96/49/05/1344964905.db2.gz	UAEDUUCFVSLKKM-AZUAARDMSA-N	0	3	342.458	3.095	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc(F)cc(F)c2)C1	ZINC001039240922	1344966056	/nfs/dbraw/zinc/96/60/56/1344966056.db2.gz	WIRCUBLXMIHDPE-KXBFYZLASA-N	0	3	346.421	3.305	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc3[nH]ccc3c2)C1	ZINC001039247249	1344976925	/nfs/dbraw/zinc/97/69/25/1344976925.db2.gz	XBJSKRGYLMOFJT-QUCCMNQESA-N	0	3	335.451	3.118	20	30		EGEDHN
Cc1cc(CN2CC[C@H]3CC[C@@H](C2)N3C(=O)C#CC2CC2)c(C)s1	ZINC001039371225	1345031843	/nfs/dbraw/zinc/03/18/43/1345031843.db2.gz	XVQAQCJGFPLASJ-MOPGFXCFSA-N	0	3	342.508	3.344	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)C[C@H](C)c1cccnc1	ZINC001039447414	1345071894	/nfs/dbraw/zinc/07/18/94/1345071894.db2.gz	LMSIXMDTFMGADE-UHOSZYNNSA-N	0	3	327.472	3.217	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2c(c1)C[C@H](C)O2	ZINC001039452197	1345075214	/nfs/dbraw/zinc/07/52/14/1345075214.db2.gz	LMKRJRISPCWXDT-IPELMVKDSA-N	0	3	340.467	3.265	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cccc(F)c1OCC	ZINC001039456316	1345076831	/nfs/dbraw/zinc/07/68/31/1345076831.db2.gz	PJPMIMATADWCKR-CVEARBPZSA-N	0	3	346.446	3.479	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)CC[C@@H]1CC(C)(C)CO1	ZINC001039464521	1345082336	/nfs/dbraw/zinc/08/23/36/1345082336.db2.gz	LNHSWXMGBXZIIW-FGTMMUONSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)COc1cccc(Cl)c1	ZINC001039468207	1345085921	/nfs/dbraw/zinc/08/59/21/1345085921.db2.gz	YVSCALPRTZBLAR-SJORKVTESA-N	0	3	348.874	3.360	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](CC)c1ccc(F)cc1	ZINC001039475327	1345090154	/nfs/dbraw/zinc/09/01/54/1345090154.db2.gz	OVFKBCUJPJXJIX-HSALFYBXSA-N	0	3	342.458	3.408	20	30		EGEDHN
C#Cc1ccc(C(=O)N2C[C@H]3CCC[C@@H](C2)N3CC2CC(C)C2)cc1	ZINC001039816974	1345198206	/nfs/dbraw/zinc/19/82/06/1345198206.db2.gz	DHUUWTGRXAJPRX-JKKSXJTRSA-N	0	3	336.479	3.393	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@H]2CCC[C@@H](C1)N2C[C@H]1CCCOC1	ZINC001039823628	1345200399	/nfs/dbraw/zinc/20/03/99/1345200399.db2.gz	UORFMNSQCASMHT-KURKYZTESA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CCC[C@@H](C1)N2CC[C@H]1CCCO1	ZINC001039897113	1345239716	/nfs/dbraw/zinc/23/97/16/1345239716.db2.gz	USZCSRYAGWBDGU-AJYBTWMASA-N	0	3	334.504	3.223	20	30		EGEDHN
CCCC(=O)N1CC[C@@]2(C1)CCCN(Cc1cccc(C#N)c1)C2	ZINC001040037239	1345303300	/nfs/dbraw/zinc/30/33/00/1345303300.db2.gz	STWGPKLQFLOOQH-FQEVSTJZSA-N	0	3	325.456	3.173	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CC[C@@]2(C1)CCCN(Cc1cccc(C#N)c1)C2	ZINC001040085587	1345330452	/nfs/dbraw/zinc/33/04/52/1345330452.db2.gz	ZKSUBRNCFSPVNL-UTKZUKDTSA-N	0	3	339.483	3.419	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3nc(C(C)C)oc3C)C2)C1	ZINC001040203059	1345374357	/nfs/dbraw/zinc/37/43/57/1345374357.db2.gz	WFLYOOLUPQRLPI-LJQANCHMSA-N	0	3	331.460	3.221	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)[C@@H]3CCCC4(CC4)C3)C2)C1	ZINC001040209117	1345375836	/nfs/dbraw/zinc/37/58/36/1345375836.db2.gz	NXXXRXLRLZLTCE-WIYYLYMNSA-N	0	3	328.500	3.295	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@@H]3CCCc4ccccc43)C2)C1	ZINC001040264824	1345402282	/nfs/dbraw/zinc/40/22/82/1345402282.db2.gz	SEKWVNNRZMPXEI-IRLDBZIGSA-N	0	3	336.479	3.054	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3csc4ccccc34)C2)C1	ZINC001040319721	1345429231	/nfs/dbraw/zinc/42/92/31/1345429231.db2.gz	JOPZRYRERYMJFC-FQEVSTJZSA-N	0	3	338.476	3.463	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)N1CC[C@@]2(C1)CCCN(Cc1ccc(C#N)cc1)C2	ZINC001040331153	1345436769	/nfs/dbraw/zinc/43/67/69/1345436769.db2.gz	JEYLXJFLNYXBPP-BSIFCXSSSA-N	0	3	337.467	3.029	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3ccc(F)c(C)c3)C2)C1	ZINC001040359529	1345452713	/nfs/dbraw/zinc/45/27/13/1345452713.db2.gz	FPRNARFQJOFIMS-FQEVSTJZSA-N	0	3	328.431	3.086	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cccc(Cl)c3F)C2)C1	ZINC001040361212	1345454495	/nfs/dbraw/zinc/45/44/95/1345454495.db2.gz	QSXHECGHENOIQB-IBGZPJMESA-N	0	3	348.849	3.431	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@]3(CCN(C(=O)[C@@H]4CC45CC5)C3)C2)cc1	ZINC001040421064	1345488261	/nfs/dbraw/zinc/48/82/61/1345488261.db2.gz	DJYAYOIHCNIABL-FPOVZHCZSA-N	0	3	349.478	3.173	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cc([C@H](C)CC)no3)C2)C1	ZINC001040436165	1345499528	/nfs/dbraw/zinc/49/95/28/1345499528.db2.gz	SFJOKJPHZBANAX-DNVCBOLYSA-N	0	3	331.460	3.302	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3cc(Cl)ccc3C)C2)C1	ZINC001040455702	1345508913	/nfs/dbraw/zinc/50/89/13/1345508913.db2.gz	FUOSTPKKQLAFIF-LJQANCHMSA-N	0	3	330.859	3.210	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)c3cccc(C)c3Cl)C2)C1	ZINC001040454916	1345509108	/nfs/dbraw/zinc/50/91/08/1345509108.db2.gz	YYNLRMPXKYYOCP-IBGZPJMESA-N	0	3	330.859	3.210	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cnn([C@H](C)CC)c3C)C2)C1	ZINC001040493139	1345519180	/nfs/dbraw/zinc/51/91/80/1345519180.db2.gz	YYKZCGIZKRUXEH-OXQOHEQNSA-N	0	3	344.503	3.277	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cc4[nH]ccc4s3)C2)C1	ZINC001040510199	1345526437	/nfs/dbraw/zinc/52/64/37/1345526437.db2.gz	MGYLLIINXOEIFQ-LJQANCHMSA-N	0	3	341.480	3.181	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)C(C)(C)c3ccccc3)C2)C1	ZINC001040521156	1345531317	/nfs/dbraw/zinc/53/13/17/1345531317.db2.gz	WZCVKHFFUDIDLG-JOCHJYFZSA-N	0	3	338.495	3.302	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cc(C)c(F)c(C)c3)C2)C1	ZINC001040534791	1345535741	/nfs/dbraw/zinc/53/57/41/1345535741.db2.gz	MJBSOCWZTNZDPY-NRFANRHFSA-N	0	3	342.458	3.394	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cscc3C(F)F)C2)CC1	ZINC001040703373	1345567814	/nfs/dbraw/zinc/56/78/14/1345567814.db2.gz	CHHQNUQDYMRKBD-UHFFFAOYSA-N	0	3	338.423	3.247	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)C3C4CC5CC(C4)CC3C5)C2)CC1	ZINC001040729696	1345571955	/nfs/dbraw/zinc/57/19/55/1345571955.db2.gz	MSXVBWWZYNIKAD-UHFFFAOYSA-N	0	3	340.511	3.006	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)CCc3ccc(F)cc3)C2)CC1	ZINC001040762987	1345576157	/nfs/dbraw/zinc/57/61/57/1345576157.db2.gz	DVLCGSPPASBOEY-UHFFFAOYSA-N	0	3	342.458	3.096	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cc4ccccc4s3)C2)CC1	ZINC001040763630	1345576243	/nfs/dbraw/zinc/57/62/43/1345576243.db2.gz	PBMVHSGOODTPGG-UHFFFAOYSA-N	0	3	338.476	3.463	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3cc(Cl)ccc3F)C2)CC1	ZINC001040765672	1345576791	/nfs/dbraw/zinc/57/67/91/1345576791.db2.gz	ODSXJYUEIVOTPC-UHFFFAOYSA-N	0	3	348.849	3.431	20	30		EGEDHN
Cc1occc1C(=O)N1CC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001041058584	1345638736	/nfs/dbraw/zinc/63/87/36/1345638736.db2.gz	ZGBOENNXGSFLPR-NRFANRHFSA-N	0	3	349.434	3.198	20	30		EGEDHN
CC[C@@H](C)C(=O)N1CC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001041086762	1345649684	/nfs/dbraw/zinc/64/96/84/1345649684.db2.gz	IWNJJHGBCNKVCF-OXQOHEQNSA-N	0	3	325.456	3.029	20	30		EGEDHN
Cc1cccc(Cl)c1CN1CC[C@]2(CCN(C(=O)[C@H](C)C#N)C2)C1	ZINC001041137491	1345658885	/nfs/dbraw/zinc/65/88/85/1345658885.db2.gz	UBYRFBIJJJLRGJ-BEFAXECRSA-N	0	3	345.874	3.233	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1)C1CC1	ZINC001041174037	1345666221	/nfs/dbraw/zinc/66/62/21/1345666221.db2.gz	NMGPFYPIUJCXFJ-HRAATJIYSA-N	0	3	337.467	3.029	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@@]3(CCN(Cc4cccc(C#N)c4)C3)C2)co1	ZINC001041236306	1345682655	/nfs/dbraw/zinc/68/26/55/1345682655.db2.gz	QQJVTWFERBRQFW-OAQYLSRUSA-N	0	3	349.434	3.198	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3scc(C)c3Cl)C2)C1	ZINC001041316950	1345701430	/nfs/dbraw/zinc/70/14/30/1345701430.db2.gz	LRVUMBOLZAWCIU-QGZVFWFLSA-N	0	3	336.888	3.271	20	30		EGEDHN
C=CCN1CC[C@]2(CCN(C(=O)c3ocnc3-c3ccccc3)C2)C1	ZINC001041343955	1345706262	/nfs/dbraw/zinc/70/62/62/1345706262.db2.gz	NULCKXLAFYFOMC-FQEVSTJZSA-N	0	3	337.423	3.066	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccc(C)nc3C(C)C)C2)C1	ZINC001041517827	1345749992	/nfs/dbraw/zinc/74/99/92/1345749992.db2.gz	KNDQYGYLCBNNAF-OAQYLSRUSA-N	0	3	339.483	3.075	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@]2(CCN(Cc3ncccc3C)C2)C1	ZINC001041624788	1345800007	/nfs/dbraw/zinc/80/00/07/1345800007.db2.gz	CPYILAGVAIGNEP-LEWJYISDSA-N	0	3	341.499	3.417	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)C(C)(C)c3cccc(F)c3)C2)C1	ZINC001041667026	1345816722	/nfs/dbraw/zinc/81/67/22/1345816722.db2.gz	CBADKAZMEVRFDI-NRFANRHFSA-N	0	3	342.458	3.051	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)CC(C3CCC3)C3CCC3)C2)C1	ZINC001041684596	1345820165	/nfs/dbraw/zinc/82/01/65/1345820165.db2.gz	CREYJBLOYFBRSC-OAQYLSRUSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CC[C@@]2(CCN(C(=O)[C@@H](CC3CCCC3)C(C)C)C2)C1	ZINC001041720336	1345830243	/nfs/dbraw/zinc/83/02/43/1345830243.db2.gz	NJOIRKHGMYCBHY-PZJWPPBQSA-N	0	3	330.516	3.397	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3c[nH]cc3-c3ccccc3)C2)C1	ZINC001041831507	1345866734	/nfs/dbraw/zinc/86/67/34/1345866734.db2.gz	NNOPUTNCOQGDID-QFIPXVFZSA-N	0	3	347.462	3.243	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3sccc3C(C)C)C2)C1	ZINC001041842676	1345870264	/nfs/dbraw/zinc/87/02/64/1345870264.db2.gz	AFFBMGOYFFPLKN-IBGZPJMESA-N	0	3	330.497	3.433	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)[C@@H](c3ccc(F)cc3)C(C)C)C2)C1	ZINC001041847620	1345872695	/nfs/dbraw/zinc/87/26/95/1345872695.db2.gz	SOALMWUVKWJLGU-CTNGQTDRSA-N	0	3	342.458	3.123	20	30		EGEDHN
CC(C(=O)N1CC[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@H]2C1)=C1CCC1	ZINC001042054758	1345932149	/nfs/dbraw/zinc/93/21/49/1345932149.db2.gz	LXQOVRRBUONLOE-SFTDATJTSA-N	0	3	349.478	3.481	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C3C4CC5CC(C4)CC3C5)C[C@H]21	ZINC001042095859	1345943109	/nfs/dbraw/zinc/94/31/09/1345943109.db2.gz	RBXMJPNFQMAQLC-FATNNQDHSA-N	0	3	340.511	3.005	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3csc(C(F)(F)F)c3)C[C@H]21	ZINC001042132659	1345952585	/nfs/dbraw/zinc/95/25/85/1345952585.db2.gz	HEYXBRFUNPXNSZ-DGCLKSJQSA-N	0	3	344.402	3.489	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccc(C)c4cccnc34)C[C@@H]21	ZINC001042155800	1345958700	/nfs/dbraw/zinc/95/87/00/1345958700.db2.gz	NARVCESKLJTYDZ-LPHOPBHVSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3c(C)occ3C(F)(F)F)C[C@H]21	ZINC001042156642	1345958872	/nfs/dbraw/zinc/95/88/72/1345958872.db2.gz	JTSGCKNRGCKCHB-GXTWGEPZSA-N	0	3	342.361	3.329	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3scnc3C)[C@H]2C1	ZINC001042183332	1345971062	/nfs/dbraw/zinc/97/10/62/1345971062.db2.gz	JGLFMJZMFDZFAH-HOTGVXAUSA-N	0	3	347.528	3.477	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2CCN(Cc3ncccc3C)[C@@H]2C1	ZINC001042185160	1345972374	/nfs/dbraw/zinc/97/23/74/1345972374.db2.gz	QTZULRUGSIKBKT-IEBWSBKVSA-N	0	3	341.499	3.415	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)C(C3CCC3)C3CCC3)C[C@@H]21	ZINC001042201767	1345982105	/nfs/dbraw/zinc/98/21/05/1345982105.db2.gz	QOLKEQSAQLGTBE-APWZRJJASA-N	0	3	328.500	3.149	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(Cl)cc3OC)C[C@H]21	ZINC001042206191	1345984318	/nfs/dbraw/zinc/98/43/18/1345984318.db2.gz	DAKHXBVXDNXRRO-CZUORRHYSA-N	0	3	334.847	3.071	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3c(F)ccc(C)c3F)C[C@H]21	ZINC001042219766	1345991601	/nfs/dbraw/zinc/99/16/01/1345991601.db2.gz	ZLRKTLBPOKRISR-GOEBONIOSA-N	0	3	334.410	3.386	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]3CCN(Cc4cnccc4C)[C@@H]3C2)C1	ZINC001042227191	1345995933	/nfs/dbraw/zinc/99/59/33/1345995933.db2.gz	ILSABRUZMFQSCV-IEBWSBKVSA-N	0	3	339.483	3.169	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3coc(C4CCCC4)n3)C[C@H]21	ZINC001042293647	1346020364	/nfs/dbraw/zinc/02/03/64/1346020364.db2.gz	HSVPMUJENYWYAD-WMLDXEAASA-N	0	3	329.444	3.055	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3[nH]ccc3-c3ccccc3)C[C@@H]21	ZINC001042308072	1346027029	/nfs/dbraw/zinc/02/70/29/1346027029.db2.gz	DJBYEQNTGPXDMQ-ICSRJNTNSA-N	0	3	347.462	3.241	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CCN(C(=O)c3sccc3COC)C[C@H]21	ZINC001042311326	1346027983	/nfs/dbraw/zinc/02/79/83/1346027983.db2.gz	JDKSBCCYCLXPMF-GDBMZVCRSA-N	0	3	334.485	3.007	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3ccc(C4CC4)s3)C[C@H]21	ZINC001042314049	1346029486	/nfs/dbraw/zinc/02/94/86/1346029486.db2.gz	XDFNJHGVFMYYRQ-GOEBONIOSA-N	0	3	328.481	3.185	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3cccc(C(F)(F)F)c3)C[C@H]21	ZINC001042326959	1346035912	/nfs/dbraw/zinc/03/59/12/1346035912.db2.gz	KUPNHQWPGNMBCD-CZUORRHYSA-N	0	3	338.373	3.428	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)CC34CC5CC(CC(C5)C3)C4)C[C@@H]21	ZINC001042332733	1346039669	/nfs/dbraw/zinc/03/96/69/1346039669.db2.gz	XBVMECBHSRXOHH-CHAHAOGTSA-N	0	3	340.511	3.149	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(OCC(C)C)cc3)C[C@@H]21	ZINC001042340164	1346045031	/nfs/dbraw/zinc/04/50/31/1346045031.db2.gz	FNQRGKRMIVJHHL-XLIONFOSSA-N	0	3	342.483	3.444	20	30		EGEDHN
C#CCCN1CC[C@H]2CCN(C(=O)c3oc4ccccc4c3C)C[C@H]21	ZINC001042343462	1346046985	/nfs/dbraw/zinc/04/69/85/1346046985.db2.gz	MQJIXJBSENOKOP-FUHWJXTLSA-N	0	3	336.435	3.301	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc(CC(C)C)cc3)C[C@@H]21	ZINC001042347649	1346048952	/nfs/dbraw/zinc/04/89/52/1346048952.db2.gz	ATXTVWQTHQVKBO-CTNGQTDRSA-N	0	3	338.495	3.445	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3sc(C(C)C)nc3C)C[C@H]21	ZINC001042355210	1346053067	/nfs/dbraw/zinc/05/30/67/1346053067.db2.gz	WVAWNCBKVHTRAR-HZPDHXFCSA-N	0	3	345.512	3.135	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(-c4ccccc4)[nH]3)C[C@@H]21	ZINC001042375666	1346063641	/nfs/dbraw/zinc/06/36/41/1346063641.db2.gz	ZOCBYFNOJGMCJM-XLIONFOSSA-N	0	3	335.451	3.404	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)c3ccc(N(C)CCC)cc3)C[C@@H]21	ZINC001042379937	1346065562	/nfs/dbraw/zinc/06/55/62/1346065562.db2.gz	PTGQLWQERWCHFL-XLIONFOSSA-N	0	3	341.499	3.255	20	30		EGEDHN
Cc1occc1C(=O)N1CC[C@@H](NCc2ccccc2C#N)C[C@H]1C	ZINC001044453551	1346336814	/nfs/dbraw/zinc/33/68/14/1346336814.db2.gz	VIKZBNAKBQQARJ-RDTXWAMCSA-N	0	3	337.423	3.243	20	30		EGEDHN
C/C=C(\C)C(=O)N1CC[C@H](NCc2cc(F)ccc2C#N)C[C@@H]1C	ZINC001044528523	1346358079	/nfs/dbraw/zinc/35/80/79/1346358079.db2.gz	AVLDQOYHTNVLPA-YCQQMAADSA-N	0	3	329.419	3.133	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCN2C(=O)C2CCCCC2)c(F)c1	ZINC001044904927	1346459413	/nfs/dbraw/zinc/45/94/13/1346459413.db2.gz	ZFGNHQKKKSYUKZ-SFHVURJKSA-N	0	3	343.446	3.358	20	30		EGEDHN
N#Cc1c[nH]c(C(=O)N2CCC[C@H]2CNCc2cc3ccccc3o2)c1	ZINC001044983929	1346474941	/nfs/dbraw/zinc/47/49/41/1346474941.db2.gz	SBQAEDSNIVKSQA-INIZCTEOSA-N	0	3	348.406	3.027	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H]1CNCc1ccc(C#N)s1)C(C)(C)C	ZINC001045093057	1346493541	/nfs/dbraw/zinc/49/35/41/1346493541.db2.gz	LPKBMTYNMMKOIP-KBPBESRZSA-N	0	3	333.501	3.383	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2ccc(-c3cnco3)cc2)CC1	ZINC001045478823	1346604378	/nfs/dbraw/zinc/60/43/78/1346604378.db2.gz	YGWZGNPQLUGBJN-UHFFFAOYSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2cc(-c3ccccc3)no2)CC1	ZINC001045488908	1346607056	/nfs/dbraw/zinc/60/70/56/1346607056.db2.gz	WXCMWZBGVIJJIG-UHFFFAOYSA-N	0	3	325.412	3.112	20	30		EGEDHN
CC1(NC(=O)C2CC3(CC3)C2)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045549747	1346627487	/nfs/dbraw/zinc/62/74/87/1346627487.db2.gz	BBQSGKAZWAWKIY-UHFFFAOYSA-N	0	3	337.467	3.219	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2cc(F)c3ncccc3c2)CC1	ZINC001045589034	1346638475	/nfs/dbraw/zinc/63/84/75/1346638475.db2.gz	HJRJYOOTNDXGKP-UHFFFAOYSA-N	0	3	327.403	3.144	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)C2CC(c3cccc(F)c3)C2)CC1	ZINC001045650222	1346659447	/nfs/dbraw/zinc/65/94/47/1346659447.db2.gz	MBPYHXCCDGWKBI-UHFFFAOYSA-N	0	3	342.458	3.313	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2ccc(-c3ccccc3)[nH]2)CC1	ZINC001045651959	1346660291	/nfs/dbraw/zinc/66/02/91/1346660291.db2.gz	LNHNWPUJLWKBKX-UHFFFAOYSA-N	0	3	335.451	3.289	20	30		EGEDHN
CC(C)CC(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1ccc(C#N)cc1	ZINC001045700321	1346671464	/nfs/dbraw/zinc/67/14/64/1346671464.db2.gz	OYUPAWXNBOILNH-MOPGFXCFSA-N	0	3	325.456	3.170	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2CC[C@@H](C1)N2Cc1ccc(C#N)cc1	ZINC001045826361	1346710031	/nfs/dbraw/zinc/71/00/31/1346710031.db2.gz	WBEQLDLOXCUISV-MOPGFXCFSA-N	0	3	337.467	3.336	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc(F)c(F)c1)C2	ZINC001045942839	1346778481	/nfs/dbraw/zinc/77/84/81/1346778481.db2.gz	BBHZIWLBUUKVDJ-FQEVSTJZSA-N	0	3	346.421	3.306	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc(F)c(C)cc1F)C2	ZINC001045946029	1346781763	/nfs/dbraw/zinc/78/17/63/1346781763.db2.gz	GVNIDOBPUIOSFB-HXUWFJFHSA-N	0	3	346.421	3.225	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@]13C[C@H]1CCCC3)C2	ZINC001045964085	1346798982	/nfs/dbraw/zinc/79/89/82/1346798982.db2.gz	XZPUPOPZTJQCBO-HMXCVIKNSA-N	0	3	328.500	3.295	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1ccc(Cl)[nH]1)C2	ZINC001045964088	1346799211	/nfs/dbraw/zinc/79/92/11/1346799211.db2.gz	YAYOVLAQHCDZKN-GOSISDBHSA-N	0	3	333.863	3.010	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1oc(CC)cc1C)C2	ZINC001045979471	1346816895	/nfs/dbraw/zinc/81/68/95/1346816895.db2.gz	FCXSMNNQDSPXHB-OAQYLSRUSA-N	0	3	342.483	3.492	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)Cc1ccc(C)c(C)c1)C2	ZINC001045982986	1346822734	/nfs/dbraw/zinc/82/27/34/1346822734.db2.gz	HNZAUZBTCOOMQZ-JOCHJYFZSA-N	0	3	338.495	3.184	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc(C)c(C)s1)C2	ZINC001045983522	1346823239	/nfs/dbraw/zinc/82/32/39/1346823239.db2.gz	OXSPSKPFBBFONZ-LJQANCHMSA-N	0	3	330.497	3.316	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cccc3cnccc31)C2	ZINC001045983647	1346823859	/nfs/dbraw/zinc/82/38/59/1346823859.db2.gz	PZQJRPGFQAKSDP-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cncc3ccccc31)C2	ZINC001045984691	1346825611	/nfs/dbraw/zinc/82/56/11/1346825611.db2.gz	GVEHEZREBBYFPU-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)C2CCc3ccccc3CC2)C1	ZINC001046432068	1346974104	/nfs/dbraw/zinc/97/41/04/1346974104.db2.gz	JBHFIRSELOLAAV-OAQYLSRUSA-N	0	3	326.484	3.338	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2cc3c([nH]2)c(F)ccc3C)C1	ZINC001046437262	1346975733	/nfs/dbraw/zinc/97/57/33/1346975733.db2.gz	UROPYJRBRXQPGP-LJQANCHMSA-N	0	3	329.419	3.386	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@]2(C)CCN(Cc3cc(C)cc(C)c3)C2)c1	ZINC001046604566	1347035863	/nfs/dbraw/zinc/03/58/63/1347035863.db2.gz	KYUBCEPSXXXQPR-JOCHJYFZSA-N	0	3	347.462	3.074	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2cc(F)cc3cccnc32)C1	ZINC001046669837	1347057412	/nfs/dbraw/zinc/05/74/12/1347057412.db2.gz	XMYQCBSMRUFICA-IBGZPJMESA-N	0	3	327.403	3.144	20	30		EGEDHN
C=C(C)CN1CC[C@@](C)(NC(=O)c2cccc(-c3cnco3)c2)C1	ZINC001046740526	1347078414	/nfs/dbraw/zinc/07/84/14/1347078414.db2.gz	ADGOQBAVNQYXRH-LJQANCHMSA-N	0	3	325.412	3.112	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@]2(C)CCN([C@H](C)c3ccccc3)C2)cn1	ZINC001046778533	1347096095	/nfs/dbraw/zinc/09/60/95/1347096095.db2.gz	HDKJCTMSTVXUJF-IIBYNOLFSA-N	0	3	333.435	3.018	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@]2(C)CCN(Cc3ccc(C)c(C)c3)C2)nc1	ZINC001046784207	1347099228	/nfs/dbraw/zinc/09/92/28/1347099228.db2.gz	ZQUBZRIBZRCKRR-JOCHJYFZSA-N	0	3	347.462	3.074	20	30		EGEDHN
C=C(C)CC[N@@H+]1CCC(F)(F)[C@@H](CNC(=O)c2ccccc2[O-])C1	ZINC001046919327	1347154023	/nfs/dbraw/zinc/15/40/23/1347154023.db2.gz	SKXCXHMCFWLQTA-AWEZNQCLSA-N	0	3	338.398	3.045	20	30		EGEDHN
C=C(C)CC[N@H+]1CCC(F)(F)[C@@H](CNC(=O)c2ccccc2[O-])C1	ZINC001046919327	1347154029	/nfs/dbraw/zinc/15/40/29/1347154029.db2.gz	SKXCXHMCFWLQTA-AWEZNQCLSA-N	0	3	338.398	3.045	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2cc(C)cs2)C1	ZINC001046938494	1347158077	/nfs/dbraw/zinc/15/80/77/1347158077.db2.gz	UEPDJOZUKXEYQY-CYBMUJFWSA-N	0	3	328.428	3.320	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@@H](CNC(=O)c2ccnc(C3CC3)c2)C1	ZINC001046953548	1347162449	/nfs/dbraw/zinc/16/24/49/1347162449.db2.gz	GHQQWCQDBVXGJF-INIZCTEOSA-N	0	3	349.425	3.222	20	30		EGEDHN
O=C(C=C1CCC1)N[C@@H]1C[C@H]2C[C@@H](C1)N(CC#Cc1ccccc1)C2	ZINC001047048905	1347196026	/nfs/dbraw/zinc/19/60/26/1347196026.db2.gz	BFQQRCZLNGKAEN-HBMCJLEFSA-N	0	3	334.463	3.118	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)c3ccoc3C)C2)CC1	ZINC001047224157	1347254135	/nfs/dbraw/zinc/25/41/35/1347254135.db2.gz	VUMDHNKGGHODQX-SFHVURJKSA-N	0	3	328.456	3.176	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@@]3(C)CC=CCC3)C2)CC1	ZINC001047240108	1347266674	/nfs/dbraw/zinc/26/66/74/1347266674.db2.gz	ZZFURDYPUKMYBC-FPOVZHCZSA-N	0	3	328.500	3.317	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)C3CCC(=C)CC3)C2)CC1	ZINC001047253123	1347277087	/nfs/dbraw/zinc/27/70/87/1347277087.db2.gz	SIKTWJZUDLIBJO-HXUWFJFHSA-N	0	3	328.500	3.317	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)[C@@H](F)c3ccccc3)C2)CC1	ZINC001047259201	1347281681	/nfs/dbraw/zinc/28/16/81/1347281681.db2.gz	MGNBLMJTEGGABH-UXHICEINSA-N	0	3	342.458	3.281	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3ccc(F)s3)C2)CC1	ZINC001047266435	1347287354	/nfs/dbraw/zinc/28/73/54/1347287354.db2.gz	XKXHKWPZGJQAHE-HNNXBMFYSA-N	0	3	334.460	3.085	20	30		EGEDHN
C/C(=C/C(=O)N1CC[C@H]([C@H](C)NCc2ccccc2C#N)C1)C1CC1	ZINC001047736169	1347356100	/nfs/dbraw/zinc/35/61/00/1347356100.db2.gz	OBDAIVJAPIXUON-SKBXDANDSA-N	0	3	337.467	3.241	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)C2CC(C)(C)C2)C1	ZINC001047829770	1347382928	/nfs/dbraw/zinc/38/29/28/1347382928.db2.gz	IIBSROOMGVMSEN-MAUKXSAKSA-N	0	3	339.483	3.321	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)C2C=CC=CC=C2)C1	ZINC001047859735	1347391654	/nfs/dbraw/zinc/39/16/54/1347391654.db2.gz	WMMQMQCOSGSEME-DYESRHJHSA-N	0	3	347.462	3.183	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]([C@@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001047931522	1347414452	/nfs/dbraw/zinc/41/44/52/1347414452.db2.gz	KFBQKDBUSFPZMM-GDBMZVCRSA-N	0	3	343.446	3.236	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H]([C@H](C)NCc3cc(C4CC4)no3)C2)C1	ZINC001047965294	1347426866	/nfs/dbraw/zinc/42/68/66/1347426866.db2.gz	LVPGAUAOUHHFTB-GOEBONIOSA-N	0	3	343.471	3.235	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H](C)[C@@H](CNCc2cc(C3CC3)no2)C1	ZINC001048340826	1347523542	/nfs/dbraw/zinc/52/35/42/1347523542.db2.gz	UJKVVJURJUWRDI-ZBFHGGJFSA-N	0	3	345.487	3.338	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)c2ccccc2)CC1	ZINC001048623836	1347622865	/nfs/dbraw/zinc/62/28/65/1347622865.db2.gz	QACPDWWQPAXPHP-UHFFFAOYSA-N	0	3	335.451	3.374	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)C2CC(C)C2)CC1	ZINC001048625730	1347623935	/nfs/dbraw/zinc/62/39/35/1347623935.db2.gz	MXAJADJLXDLABX-UHFFFAOYSA-N	0	3	327.472	3.107	20	30		EGEDHN
C=C(C)CN1CCC(N(Cc2ccccn2)C(=O)C2CC=CC2)CC1	ZINC001048626020	1347624151	/nfs/dbraw/zinc/62/41/51/1347624151.db2.gz	VEZNYEUFBBYFHL-UHFFFAOYSA-N	0	3	339.483	3.417	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3ccc(C4CCCC4)cc3)C[C@@H]2C1	ZINC001048940130	1347688983	/nfs/dbraw/zinc/68/89/83/1347688983.db2.gz	YDXBALYZPZGPQK-OYRHEFFESA-N	0	3	336.479	3.371	20	30		EGEDHN
C#Cc1ccc(C(=O)N2C[C@H]3CN(Cc4cccc(F)c4)C[C@H]3C2)cc1	ZINC001048972949	1347695365	/nfs/dbraw/zinc/69/53/65/1347695365.db2.gz	DALJTKJBEQLKSK-BGYRXZFFSA-N	0	3	348.421	3.011	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@H]3CN(Cc4cncc(C)c4)C[C@H]3C2)CC1	ZINC001049026820	1347709817	/nfs/dbraw/zinc/70/98/17/1347709817.db2.gz	GWDJGATVXDPQJR-BGYRXZFFSA-N	0	3	339.483	3.027	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@H]2CN(Cc3c(C)onc3CC)C[C@H]2C1	ZINC001049026730	1347709826	/nfs/dbraw/zinc/70/98/26/1347709826.db2.gz	YNUFGGOPHXQMND-YRNRMSPPSA-N	0	3	345.487	3.038	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1ccc(C#N)cc1	ZINC001049293567	1347775004	/nfs/dbraw/zinc/77/50/04/1347775004.db2.gz	UNZTXUBMLFRXMX-MOPGFXCFSA-N	0	3	325.456	3.170	20	30		EGEDHN
Cc1cc(F)ccc1CN1CC[C@H]2[C@@H]1CCCN2C(=O)C#CC1CC1	ZINC001049468472	1347863865	/nfs/dbraw/zinc/86/38/65/1347863865.db2.gz	VMLCEKYSOYBBSY-PMACEKPBSA-N	0	3	340.442	3.113	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1c(C)noc1CCC	ZINC001049469220	1347864752	/nfs/dbraw/zinc/86/47/52/1347864752.db2.gz	AKMULBIXDRZHRU-JKSUJKDBSA-N	0	3	331.460	3.191	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(F)cc2ccncc21	ZINC001049482423	1347870298	/nfs/dbraw/zinc/87/02/98/1347870298.db2.gz	XKUDKAAGJWHONB-RBUKOAKNSA-N	0	3	339.414	3.239	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C1(c2ccc(F)cc2)CC1	ZINC001049509766	1347884712	/nfs/dbraw/zinc/88/47/12/1347884712.db2.gz	YVBIWTKTAPVNAE-ZWKOTPCHSA-N	0	3	328.431	3.109	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cn(C)c2ccc(F)cc12	ZINC001049522153	1347890693	/nfs/dbraw/zinc/89/06/93/1347890693.db2.gz	DNIUJWUMYZAICJ-RBUKOAKNSA-N	0	3	341.430	3.182	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cn(C)c2ccc(F)cc12	ZINC001049522154	1347891022	/nfs/dbraw/zinc/89/10/22/1347891022.db2.gz	DNIUJWUMYZAICJ-RTBURBONSA-N	0	3	341.430	3.182	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@@H]1CCCN2C(=O)c1c(C)noc1C(F)F	ZINC001049544813	1347900214	/nfs/dbraw/zinc/90/02/14/1347900214.db2.gz	PFEXUYMRFLLQON-STQMWFEESA-N	0	3	339.386	3.176	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(OC)cc1F	ZINC001049578212	1347918244	/nfs/dbraw/zinc/91/82/44/1347918244.db2.gz	UYHFUDRHBAGXJL-QZTJIDSGSA-N	0	3	332.419	3.089	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cn1c(C)cc2ccccc21	ZINC001049578987	1347919122	/nfs/dbraw/zinc/91/91/22/1347919122.db2.gz	CPWUNHPNDTUCIB-RTWAWAEBSA-N	0	3	349.478	3.038	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccc(-n2cccc2)cc1	ZINC001049579891	1347920144	/nfs/dbraw/zinc/92/01/44/1347920144.db2.gz	PJMVVXRMMIAEIS-PMACEKPBSA-N	0	3	335.451	3.342	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H]1COc2cc(C)c(C)cc21	ZINC001049611252	1347935541	/nfs/dbraw/zinc/93/55/41/1347935541.db2.gz	FXPDWWUVKZEMAD-GBESFXJTSA-N	0	3	340.467	3.031	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H]1COc2cc(C)c(C)cc21	ZINC001049611254	1347935846	/nfs/dbraw/zinc/93/58/46/1347935846.db2.gz	FXPDWWUVKZEMAD-GUDVDZBRSA-N	0	3	340.467	3.031	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)C1(c2ccc(F)cc2)CCC1	ZINC001049629863	1347943147	/nfs/dbraw/zinc/94/31/47/1347943147.db2.gz	MSFFWDCSGYVEMV-OALUTQOASA-N	0	3	342.458	3.499	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]2[C@H]1CCN2Cc1cccc(C#N)c1	ZINC001049635033	1347945657	/nfs/dbraw/zinc/94/56/57/1347945657.db2.gz	JFXOEGHMSGIWRL-RTBURBONSA-N	0	3	337.467	3.336	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1cccc(C#N)c1	ZINC001049635031	1347945684	/nfs/dbraw/zinc/94/56/84/1347945684.db2.gz	JFXOEGHMSGIWRL-OALUTQOASA-N	0	3	337.467	3.336	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]2[C@@H]1CCN2Cc1ccc(C)nc1C	ZINC001049633800	1347945865	/nfs/dbraw/zinc/94/58/65/1347945865.db2.gz	BEUWAYGAGMCWDT-MOPGFXCFSA-N	0	3	341.499	3.476	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C(C1CCC1)C1CCC1	ZINC001049674085	1347966783	/nfs/dbraw/zinc/96/67/83/1347966783.db2.gz	BOTDKUPBBAQZLH-RTBURBONSA-N	0	3	328.500	3.291	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(F)c(F)cc1F	ZINC001049676600	1347967829	/nfs/dbraw/zinc/96/78/29/1347967829.db2.gz	PITRVOQZPYIMCU-DLBZAZTESA-N	0	3	338.373	3.359	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1c(F)cc(F)cc1F	ZINC001049681468	1347970171	/nfs/dbraw/zinc/97/01/71/1347970171.db2.gz	OZAAJBKXOFIHCQ-JKSUJKDBSA-N	0	3	338.373	3.359	20	30		EGEDHN
CC(F)(F)CC(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1cccc(C#N)c1	ZINC001049698117	1347977993	/nfs/dbraw/zinc/97/79/93/1347977993.db2.gz	NBJSGJXCVGOKPV-IRXDYDNUSA-N	0	3	347.409	3.169	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@H]3[C@@H]2CCN3Cc2cccc(C#N)c2)CC1	ZINC001049704317	1347982221	/nfs/dbraw/zinc/98/22/21/1347982221.db2.gz	PLUFRIYPMNJNFF-OALUTQOASA-N	0	3	337.467	3.314	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C[C@@H](C)c1ccc(CC)cc1	ZINC001049716160	1347989154	/nfs/dbraw/zinc/98/91/54/1347989154.db2.gz	ZQZDOGZRSGNRIG-DUXKGJEZSA-N	0	3	338.495	3.441	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N1CCC[C@H]2[C@@H]1CCN2Cc1cccc(C#N)c1	ZINC001049734071	1347993923	/nfs/dbraw/zinc/99/39/23/1347993923.db2.gz	CWFAGCLMQVSIPS-ZRNYENFQSA-N	0	3	337.467	3.170	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H](C)Cc1cccs1	ZINC001049761454	1348006353	/nfs/dbraw/zinc/00/63/53/1348006353.db2.gz	KIBSBBISLCPBIZ-RYQLBKOJSA-N	0	3	330.497	3.015	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3[C@H]2CCCN3C(=O)[C@@H]2C[C@H]2C2CC2)c1	ZINC001049776924	1348015644	/nfs/dbraw/zinc/01/56/44/1348015644.db2.gz	MWMBRNHNCSFEDT-BQJUDKOJSA-N	0	3	349.478	3.170	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccccc1C	ZINC001049783252	1348019860	/nfs/dbraw/zinc/01/98/60/1348019860.db2.gz	UNVXJQUMBPKSNO-DOIPELPJSA-N	0	3	336.479	3.187	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(C)nc1OCC	ZINC001049810954	1348031004	/nfs/dbraw/zinc/03/10/04/1348031004.db2.gz	DPDRWMKISRVPOY-MSOLQXFVSA-N	0	3	343.471	3.044	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1c[nH]nc1-c1ccsc1	ZINC001049817794	1348035227	/nfs/dbraw/zinc/03/52/27/1348035227.db2.gz	NUNRXVOOEKONRF-HOTGVXAUSA-N	0	3	342.468	3.003	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1cccc(F)c1OCC	ZINC001049817201	1348035470	/nfs/dbraw/zinc/03/54/70/1348035470.db2.gz	XHEZFSRSFBETPZ-MSOLQXFVSA-N	0	3	346.446	3.479	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc2nc(C)sc2c1	ZINC001049823317	1348040018	/nfs/dbraw/zinc/04/00/18/1348040018.db2.gz	AFPMOPPGQCVEEX-SJORKVTESA-N	0	3	341.480	3.470	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc2c(c1)CCC=C2	ZINC001049846469	1348055793	/nfs/dbraw/zinc/05/57/93/1348055793.db2.gz	INECKVSJORFFLD-LEWJYISDSA-N	0	3	334.463	3.348	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)Cc1c[nH]c2cccc(C)c12	ZINC001049846818	1348055803	/nfs/dbraw/zinc/05/58/03/1348055803.db2.gz	NFQTUFJJZWHSAT-UXHICEINSA-N	0	3	349.478	3.107	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1cccc2ccccc21	ZINC001049852967	1348059331	/nfs/dbraw/zinc/05/93/31/1348059331.db2.gz	BQHPVGUDTVQLBY-LEWJYISDSA-N	0	3	332.447	3.081	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(F)c(F)c(F)c1F	ZINC001049853881	1348060248	/nfs/dbraw/zinc/06/02/48/1348060248.db2.gz	HSOPJKJYAVPWIS-CHWSQXEVSA-N	0	3	342.336	3.108	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)CC12CC3CC(CC(C3)C1)C2	ZINC001049866012	1348072475	/nfs/dbraw/zinc/07/24/75/1348072475.db2.gz	XGFSWTGAWQMLBM-BIQFSMEISA-N	0	3	340.511	3.291	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)CCc1ccccc1Cl	ZINC001049886844	1348090897	/nfs/dbraw/zinc/09/08/97/1348090897.db2.gz	VBDICQNCHUCPBF-RTBURBONSA-N	0	3	344.886	3.361	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1ccc(COC(C)C)cc1	ZINC001049888821	1348093742	/nfs/dbraw/zinc/09/37/42/1348093742.db2.gz	LCPRRICGCRRKJF-VQTJNVASSA-N	0	3	342.483	3.477	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cnn(C(C)(C)C)c1CC	ZINC001049899755	1348100191	/nfs/dbraw/zinc/10/01/91/1348100191.db2.gz	GPDDEXJIPTYGBL-ROUUACIJSA-N	0	3	344.503	3.065	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(C)c2c1CCC2	ZINC001049918151	1348111261	/nfs/dbraw/zinc/11/12/61/1348111261.db2.gz	PZKFLTOYOWQMII-RTWAWAEBSA-N	0	3	336.479	3.186	20	30		EGEDHN
C=CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1ccc(N(C)C(C)C)cc1	ZINC001049928915	1348118966	/nfs/dbraw/zinc/11/89/66/1348118966.db2.gz	WJZLRTJZSCTRQI-UXHICEINSA-N	0	3	341.499	3.396	20	30		EGEDHN
N#Cc1ccc(CN2C[C@@H]3CCCN(C(=O)[C@@H]4CC=CCC4)[C@@H]3C2)cc1	ZINC001049971214	1348138771	/nfs/dbraw/zinc/13/87/71/1348138771.db2.gz	JSNQHAJARORPHU-QHAWAJNXSA-N	0	3	349.478	3.337	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)c3cc4cc(F)ccc4[nH]3)[C@@H]2C1	ZINC001050108388	1348185882	/nfs/dbraw/zinc/18/58/82/1348185882.db2.gz	BABYLTSQQOKZLR-SCLBCKFNSA-N	0	3	327.403	3.029	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)[C@H](C)c3ccc(Cl)cc3)[C@@H]2C1	ZINC001050129852	1348191453	/nfs/dbraw/zinc/19/14/53/1348191453.db2.gz	BJIZKOZTUBZUIL-HHXXYDBFSA-N	0	3	344.886	3.390	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)[C@@H](CC)Cc3ccccc3)[C@@H]2C1	ZINC001050154278	1348199286	/nfs/dbraw/zinc/19/92/86/1348199286.db2.gz	NATQFDRVMHKMPA-PCCBWWKXSA-N	0	3	338.495	3.201	20	30		EGEDHN
C#CCCN1C[C@@H]2CCCN(C(=O)c3cc(CC)c(C)s3)[C@@H]2C1	ZINC001050198759	1348209498	/nfs/dbraw/zinc/20/94/98/1348209498.db2.gz	ZLURWQHCQAXRMS-DLBZAZTESA-N	0	3	330.497	3.179	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC2(C1)CCN([C@H](C)c1ccccc1Cl)CC2	ZINC001050460296	1348271115	/nfs/dbraw/zinc/27/11/15/1348271115.db2.gz	UROCCFKFCKCLBS-HUUCEWRRSA-N	0	3	345.874	3.485	20	30		EGEDHN
Cc1ccc(CN2CCC3(CN(C(=O)[C@@H](C)C#N)C3)CC2)c(Cl)c1	ZINC001050460980	1348271520	/nfs/dbraw/zinc/27/15/20/1348271520.db2.gz	BKLYOWWHZYLZLT-HNNXBMFYSA-N	0	3	345.874	3.233	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)CC(C)(C)c3ccc(F)cc3)C2)CC1	ZINC001050545770	1348287247	/nfs/dbraw/zinc/28/72/47/1348287247.db2.gz	GHJOAKFHUYTNEL-UHFFFAOYSA-N	0	3	342.458	3.051	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3cccc4c(C)c(C)[nH]c43)C2)CC1	ZINC001050565541	1348291201	/nfs/dbraw/zinc/29/12/01/1348291201.db2.gz	FEIYMHZMXOLUSH-UHFFFAOYSA-N	0	3	349.478	3.346	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3nc4ccccc4cc3C)C2)CC1	ZINC001050595996	1348296648	/nfs/dbraw/zinc/29/66/48/1348296648.db2.gz	VOKPHMXEODNCNO-UHFFFAOYSA-N	0	3	347.462	3.105	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3cccc(F)c3)cccc2C1	ZINC001051279314	1348415785	/nfs/dbraw/zinc/41/57/85/1348415785.db2.gz	ZNZKOJQPACDHGK-UHFFFAOYSA-N	0	3	336.410	3.137	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3cc4occc4[nH]3)cccc2C1	ZINC001051289608	1348420000	/nfs/dbraw/zinc/42/00/00/1348420000.db2.gz	LMXKSRRFALDTCC-UHFFFAOYSA-N	0	3	347.418	3.072	20	30		EGEDHN
Cc1cc(C(=O)N[C@@H]2CCCN(Cc3ccc(C#N)cc3)CC2)co1	ZINC001052338475	1348528004	/nfs/dbraw/zinc/52/80/04/1348528004.db2.gz	TZBZOCNFISSTPT-LJQANCHMSA-N	0	3	337.423	3.244	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cc(C)n(C(CC)CC)n2)CC1	ZINC001052512370	1348562913	/nfs/dbraw/zinc/56/29/13/1348562913.db2.gz	IYXCJXBSJVERHK-KRWDZBQOSA-N	0	3	344.503	3.160	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)c2coc3cc(F)ccc23)CC1	ZINC001052511687	1348563047	/nfs/dbraw/zinc/56/30/47/1348563047.db2.gz	DBXWYSBBLHGMDP-OAHLLOKOSA-N	0	3	328.387	3.180	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cccc(-n3cccc3)c2)CC1	ZINC001052534731	1348568832	/nfs/dbraw/zinc/56/88/32/1348568832.db2.gz	NFWVMNGFWOIDJN-IBGZPJMESA-N	0	3	335.451	3.085	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@@H]2CCc3c2cccc3Cl)CC1	ZINC001052565933	1348580701	/nfs/dbraw/zinc/58/07/01/1348580701.db2.gz	IJVONEVASZYFLD-MAUKXSAKSA-N	0	3	344.886	3.364	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@@H](NC(=O)[C@]34C[C@H]3CCC4)CC2)c1	ZINC001052576272	1348584016	/nfs/dbraw/zinc/58/40/16/1348584016.db2.gz	KJFCEWFWJZOVOG-SFHLNBCPSA-N	0	3	337.467	3.219	20	30		EGEDHN
C[C@@]1(C(=O)N[C@@H]2CCCN(Cc3cccc(C#N)c3)CC2)C=CCC1	ZINC001052636650	1348604943	/nfs/dbraw/zinc/60/49/43/1348604943.db2.gz	VPERLFROWCWZDJ-TZIWHRDSSA-N	0	3	337.467	3.385	20	30		EGEDHN
Cc1coc(C(=O)N[C@H]2CCCN(Cc3cccc(C#N)c3)CC2)c1	ZINC001052642043	1348609025	/nfs/dbraw/zinc/60/90/25/1348609025.db2.gz	VGJAQEOEEHXCNG-SFHVURJKSA-N	0	3	337.423	3.244	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)C(C)(C)c2cccc(F)c2)CC1	ZINC001052707141	1348643323	/nfs/dbraw/zinc/64/33/23/1348643323.db2.gz	YXFQFVDHPYPUKX-SFHVURJKSA-N	0	3	330.447	3.097	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@H](NC(=O)[C@H]3CC34CCC4)CC2)c1	ZINC001052755246	1348665215	/nfs/dbraw/zinc/66/52/15/1348665215.db2.gz	SMXVLDJFIUEKNX-RBUKOAKNSA-N	0	3	337.467	3.219	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)[C@H](C)c2ccc(F)c(F)c2)CC1	ZINC001052947149	1348764384	/nfs/dbraw/zinc/76/43/84/1348764384.db2.gz	JRFKJYKZWDEFIX-GDBMZVCRSA-N	0	3	334.410	3.062	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)Cc2ccc(OC(C)C)cc2)CC1	ZINC001052950989	1348766421	/nfs/dbraw/zinc/76/64/21/1348766421.db2.gz	DGBRJRJICMWIBQ-IBGZPJMESA-N	0	3	342.483	3.010	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC[C@H]([C@@H]3CCCN(CCF)C3)C2)cc1	ZINC001053036192	1348835997	/nfs/dbraw/zinc/83/59/97/1348835997.db2.gz	IMHVJEZQSDWHBD-UXHICEINSA-N	0	3	342.458	3.202	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2sccc2F)C1	ZINC001053080177	1348901648	/nfs/dbraw/zinc/90/16/48/1348901648.db2.gz	BCDQXEIHAZXSKO-GOEBONIOSA-N	0	3	334.460	3.227	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2[nH]ccc2C)C1	ZINC001053083701	1348905234	/nfs/dbraw/zinc/90/52/34/1348905234.db2.gz	LMAREJMECNHUGQ-QZTJIDSGSA-N	0	3	327.472	3.053	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2[nH]ccc2C2CC2)C1	ZINC001053087606	1348912342	/nfs/dbraw/zinc/91/23/42/1348912342.db2.gz	MSAJQTHTDMKCJL-HKUYNNGSSA-N	0	3	339.483	3.232	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2cccn2CC=C)C1	ZINC001053088375	1348913368	/nfs/dbraw/zinc/91/33/68/1348913368.db2.gz	UIEKADDJXTZWRY-RTBURBONSA-N	0	3	339.483	3.014	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)Cc2ccc(C)cc2)C1	ZINC001053091116	1348917589	/nfs/dbraw/zinc/91/75/89/1348917589.db2.gz	LCDYWRCAMPZLJC-LEWJYISDSA-N	0	3	338.495	3.264	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)Cc2cccc(C)c2)C1	ZINC001053093423	1348921448	/nfs/dbraw/zinc/92/14/48/1348921448.db2.gz	MRHQAGOWTMQPBZ-LEWJYISDSA-N	0	3	338.495	3.264	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2sc(C)nc2C)C1	ZINC001053104187	1348939320	/nfs/dbraw/zinc/93/93/20/1348939320.db2.gz	CSNHHSOXQZCXDZ-IAGOWNOFSA-N	0	3	345.512	3.100	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)C2(F)CCCCC2)C1	ZINC001053105530	1348943335	/nfs/dbraw/zinc/94/33/35/1348943335.db2.gz	UORJVOUEPWOTRI-MSOLQXFVSA-N	0	3	334.479	3.385	20	30		EGEDHN
SC1CCN(Cc2[nH]nc3cc(Br)ccc32)CC1	ZINC001231618118	1376283833	/nfs/dbraw/zinc/28/38/33/1376283833.db2.gz	ZVRMWNRVBUAJBZ-UHFFFAOYSA-N	0	3	326.263	3.220	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)CC1(c3ccccc3)CC1)C2	ZINC001054143124	1349153479	/nfs/dbraw/zinc/15/34/79/1349153479.db2.gz	MYJYFHAPRNGFTI-NRFANRHFSA-N	0	3	336.479	3.056	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)c1c(C)noc1C(C)C)C2	ZINC001054148403	1349154763	/nfs/dbraw/zinc/15/47/63/1349154763.db2.gz	MVTOVAHYLJQPFU-FQEVSTJZSA-N	0	3	343.471	3.058	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1coc3cc(F)ccc13)C2	ZINC001054158913	1349161066	/nfs/dbraw/zinc/16/10/66/1349161066.db2.gz	RBYWKOCZFZMVHI-FQEVSTJZSA-N	0	3	340.398	3.133	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H](c1ccccc1)C1CC1)C2	ZINC001054163937	1349166492	/nfs/dbraw/zinc/16/64/92/1349166492.db2.gz	UVILWJMTCOPABJ-RBBKRZOGSA-N	0	3	336.479	3.128	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)CCc1ccc(C)cc1C)C2	ZINC001054173013	1349174727	/nfs/dbraw/zinc/17/47/27/1349174727.db2.gz	FJYBYFQDTGXSHF-JOCHJYFZSA-N	0	3	338.495	3.184	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CCC[C@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001054177690	1349179539	/nfs/dbraw/zinc/17/95/39/1349179539.db2.gz	QCEPTPBXXIKJLF-UYAOXDASSA-N	0	3	343.446	3.121	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H](C)OC1CCCCCC1)C2	ZINC001054194308	1349196928	/nfs/dbraw/zinc/19/69/28/1349196928.db2.gz	NKSSFQUDBWXFKN-NQIIRXRSSA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)C[C@H](C)c1cccc(F)c1)C2	ZINC001054194697	1349197701	/nfs/dbraw/zinc/19/77/01/1349197701.db2.gz	UPUUSXHZWJVUET-LAUBAEHRSA-N	0	3	342.458	3.267	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)Cc1ccc(CC)cc1)C2	ZINC001054204975	1349207051	/nfs/dbraw/zinc/20/70/51/1349207051.db2.gz	HMFAXQPWQWXSIC-JOCHJYFZSA-N	0	3	338.495	3.129	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@H](C)c1ccc(CC)cc1)C2	ZINC001054214788	1349213994	/nfs/dbraw/zinc/21/39/94/1349213994.db2.gz	HAKVLBNZNOKHIV-XMSQKQJNSA-N	0	3	338.495	3.300	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@H](C)c1ccccc1F)C2	ZINC001054215777	1349214766	/nfs/dbraw/zinc/21/47/66/1349214766.db2.gz	FIGWAQQFONABOI-DYESRHJHSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1ccc(C3CC3)s1)C2	ZINC001054227653	1349221520	/nfs/dbraw/zinc/22/15/20/1349221520.db2.gz	QFEZNXWHQULZEB-IBGZPJMESA-N	0	3	328.481	3.187	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)Cc1sc(C)cc1C)C2	ZINC001054233308	1349225711	/nfs/dbraw/zinc/22/57/11/1349225711.db2.gz	HKAARIBOZNYKKO-HXUWFJFHSA-N	0	3	344.524	3.245	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc3[nH]ccc3s1)C2	ZINC001054233857	1349225764	/nfs/dbraw/zinc/22/57/64/1349225764.db2.gz	SJUAFZBZCTYVBV-LJQANCHMSA-N	0	3	341.480	3.181	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc3cccc(F)c3o1)C2	ZINC001054244479	1349238692	/nfs/dbraw/zinc/23/86/92/1349238692.db2.gz	VZSWONNUTFAGFV-HXUWFJFHSA-N	0	3	340.398	3.133	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1cc3cc(C)ccc3o1)C2	ZINC001054244939	1349238999	/nfs/dbraw/zinc/23/89/99/1349238999.db2.gz	LLZBUQZYLMZALS-OAQYLSRUSA-N	0	3	336.435	3.303	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)[C@@H](CC)c1ccc(F)cc1)C2	ZINC001054245854	1349239871	/nfs/dbraw/zinc/23/98/71/1349239871.db2.gz	FUOFWWVAOHKMRM-FPOVZHCZSA-N	0	3	342.458	3.267	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)C3CCOCC3)cc2C1	ZINC001054252955	1349247496	/nfs/dbraw/zinc/24/74/96/1349247496.db2.gz	HKLVNABNQVNAKK-UHFFFAOYSA-N	0	3	328.456	3.011	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3cscn3)cc2C1	ZINC001054259290	1349255076	/nfs/dbraw/zinc/25/50/76/1349255076.db2.gz	SUUFIGIYXBXGIP-UHFFFAOYSA-N	0	3	327.453	3.355	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3c(F)cncc3F)cc2C1	ZINC001054267514	1349264486	/nfs/dbraw/zinc/26/44/86/1349264486.db2.gz	YCMITQAMUXOYRU-UHFFFAOYSA-N	0	3	343.377	3.182	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cccc4c[nH]nc43)cc2C1	ZINC001054276571	1349276884	/nfs/dbraw/zinc/27/68/84/1349276884.db2.gz	JIWOIZNILMRVNM-UHFFFAOYSA-N	0	3	346.434	3.385	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@H]3CCC[C@H](OC)C3)cc2C1	ZINC001054278881	1349279963	/nfs/dbraw/zinc/27/99/63/1349279963.db2.gz	QECLVYJFTCRVRQ-PXNSSMCTSA-N	0	3	342.483	3.400	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cccc4c3OCC4)cc2C1	ZINC001054282931	1349284300	/nfs/dbraw/zinc/28/43/00/1349284300.db2.gz	DOMGHCNNGIULNC-UHFFFAOYSA-N	0	3	348.446	3.443	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cnn(C(C)C)c3)cc2C1	ZINC001054289351	1349292919	/nfs/dbraw/zinc/29/29/19/1349292919.db2.gz	AZVVZYKQMLCKHK-UHFFFAOYSA-N	0	3	338.455	3.286	20	30		EGEDHN
Cc1cc(C(=O)N2C[C@@H](C)[C@H](NCc3ccc(C#N)s3)C2)oc1C	ZINC001054570801	1349402915	/nfs/dbraw/zinc/40/29/15/1349402915.db2.gz	WVMLNNSQIZFWPU-MLGOLLRUSA-N	0	3	343.452	3.080	20	30		EGEDHN
C=CCn1cccc1C(=O)N1C[C@H](C)[C@H](NCc2ccccc2F)C1	ZINC001054751937	1349453743	/nfs/dbraw/zinc/45/37/43/1349453743.db2.gz	WHNXITGHMPEXJY-MAUKXSAKSA-N	0	3	341.430	3.064	20	30		EGEDHN
C[C@@H]1CN(C(=O)C(C)(C)C2CC2)C[C@@H]1NCc1ccc(C#N)c(F)c1	ZINC001054990883	1349540377	/nfs/dbraw/zinc/54/03/77/1349540377.db2.gz	BZIUAUWVFRASJL-ACJLOTCBSA-N	0	3	343.446	3.070	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2cn(CC)c3ccccc23)C1	ZINC001080084712	1357480961	/nfs/dbraw/zinc/48/09/61/1357480961.db2.gz	KFXRXDYFPJVMQL-CRAIPNDOSA-N	0	3	325.456	3.287	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)Cc1cc(Br)c[nH]c1=O	ZINC001233188978	1376582052	/nfs/dbraw/zinc/58/20/52/1376582052.db2.gz	CSALCRGEYLICSP-UHFFFAOYSA-N	0	3	332.201	3.053	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CN(Cc3ccc(CC)cc3)C[C@H]2C)cc1	ZINC001080244796	1357535459	/nfs/dbraw/zinc/53/54/59/1357535459.db2.gz	MXGBUICUKJYRMN-VGOFRKELSA-N	0	3	346.474	3.481	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)c2cccs2)CC1	ZINC001163216791	1382994597	/nfs/dbraw/zinc/99/45/97/1382994597.db2.gz	OZFXRBUWCIUNAQ-UHFFFAOYSA-N	0	3	343.290	3.146	20	30		EGEDHN
C#CCCN1CC[C@@]2(C1)CN(C(=O)C1(C)CCCCCC1)C[C@H](C)O2	ZINC001071178254	1354488440	/nfs/dbraw/zinc/48/84/40/1354488440.db2.gz	MMBGVVKEPXSGJF-GHTZIAJQSA-N	0	3	346.515	3.062	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)c1ccc(C)cc1F)C[C@H](C)O2	ZINC001071213933	1354508500	/nfs/dbraw/zinc/50/85/00/1354508500.db2.gz	MMFWXZKTKBMGEK-JXFKEZNVSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1cc(C)ccc1F)C[C@@H](C)O2	ZINC001071215508	1354510161	/nfs/dbraw/zinc/51/01/61/1354510161.db2.gz	COTWCFUSGYBLDJ-OXQOHEQNSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1oc(CC)cc1C)C[C@@H](C)O2	ZINC001071227624	1354514683	/nfs/dbraw/zinc/51/46/83/1354514683.db2.gz	ICPAXTMAMAYGNT-OXQOHEQNSA-N	0	3	346.471	3.032	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ncn3cc(Cl)ccc23)CC[C@@H]1C	ZINC001071516794	1354738892	/nfs/dbraw/zinc/73/88/92/1354738892.db2.gz	BQKSHXBJMFBGFZ-ZFWWWQNUSA-N	0	3	346.862	3.147	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCCCC[C@H](NCc2cn(C)nc2C)C1	ZINC001088359326	1359843385	/nfs/dbraw/zinc/84/33/85/1359843385.db2.gz	WOKFORXUSKMPCD-SFHVURJKSA-N	0	3	346.519	3.192	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cnn3c2ccc(C)c3C)CC[C@@H]1C	ZINC001071580281	1354777112	/nfs/dbraw/zinc/77/71/12/1354777112.db2.gz	RADKXAMPMDJQQC-RDJZCZTQSA-N	0	3	340.471	3.110	20	30		EGEDHN
C=CCOc1ccc(C(=O)N[C@H]2CC[C@@H](C)N(CC(=C)C)C2)cc1	ZINC001071620083	1354803333	/nfs/dbraw/zinc/80/33/33/1354803333.db2.gz	ZRZZYSUNRIOATP-AEFFLSMTSA-N	0	3	328.456	3.410	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(C(F)(F)F)cn2)CC[C@H]1C	ZINC001071721174	1354878514	/nfs/dbraw/zinc/87/85/14/1354878514.db2.gz	MZKHHUVNVRJXFW-TZMCWYRMSA-N	0	3	341.377	3.259	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(N3CC=CC3)cc2)CC[C@@H]1C	ZINC001071821862	1354961969	/nfs/dbraw/zinc/96/19/69/1354961969.db2.gz	SYOUQQHMYUVRNN-HKUYNNGSSA-N	0	3	339.483	3.222	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)Cc2cccc(Cl)c2F)CC[C@H]1C	ZINC001071843769	1354973814	/nfs/dbraw/zinc/97/38/14/1354973814.db2.gz	APKWXOHAOHXLQE-UKRRQHHQSA-N	0	3	336.838	3.014	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2c[nH]c(=O)c3ccccc23)CC[C@H]1C	ZINC001071871442	1354995925	/nfs/dbraw/zinc/99/59/25/1354995925.db2.gz	ICCMJWOSUNULOP-HUUCEWRRSA-N	0	3	339.439	3.099	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cnc(C(C)C)nc2C)CC[C@H]1C	ZINC001071875830	1355000903	/nfs/dbraw/zinc/00/09/03/1355000903.db2.gz	FGCLTEGJYSCJQX-ZBFHGGJFSA-N	0	3	330.476	3.067	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C2(c3cccc(F)c3)CC2)CC(C)(C)C1	ZINC001089508128	1360480356	/nfs/dbraw/zinc/48/03/56/1360480356.db2.gz	UPWPPPMHUQVXKM-SFHVURJKSA-N	0	3	342.458	3.097	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)Cc2csc(C(C)(C)C)n2)CC[C@H]1C	ZINC001071899670	1355013707	/nfs/dbraw/zinc/01/37/07/1355013707.db2.gz	BXMZBXLPPVYGGF-KGLIPLIRSA-N	0	3	335.517	3.138	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc3nc(C)ccc3c2)CC[C@@H]1C	ZINC001071920872	1355025720	/nfs/dbraw/zinc/02/57/20/1355025720.db2.gz	YQQDAMHNBUPKJY-LPHOPBHVSA-N	0	3	335.451	3.149	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc(-c3ccccc3)ccn2)CC[C@@H]1C	ZINC001071934008	1355033048	/nfs/dbraw/zinc/03/30/48/1355033048.db2.gz	FTIDTNXXDLCZFV-PXNSSMCTSA-N	0	3	347.462	3.355	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2cccc(OC(C)C)n2)CC[C@@H]1C	ZINC001071942457	1355035977	/nfs/dbraw/zinc/03/59/77/1355035977.db2.gz	PTJZPAGRNXDBJR-HOTGVXAUSA-N	0	3	331.460	3.028	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CC[C@H](C)N(Cc3cccc(C)c3)C2)nc1	ZINC001071999024	1355066381	/nfs/dbraw/zinc/06/63/81/1355066381.db2.gz	LYAGXPFRGIDHBE-PXNSSMCTSA-N	0	3	347.462	3.154	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)C2(c3ccc(Cl)cc3)CC2)CC[C@H]1C	ZINC001072049868	1355103231	/nfs/dbraw/zinc/10/32/31/1355103231.db2.gz	RJNFVGFPHTUDEW-CRAIPNDOSA-N	0	3	344.886	3.364	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(OC)c(OCC)c2)CC[C@H]1C	ZINC001072049646	1355103557	/nfs/dbraw/zinc/10/35/57/1355103557.db2.gz	QKERLQCKDDADAY-WBVHZDCISA-N	0	3	346.471	3.253	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2ccc(P(C)(C)=O)cc2)CC[C@H]1C	ZINC001072087822	1355120608	/nfs/dbraw/zinc/12/06/08/1355120608.db2.gz	BRINKHTWQSVSNV-WBVHZDCISA-N	0	3	348.427	3.093	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cn2ccc3ccccc32)CC[C@H]1C	ZINC001072088739	1355122462	/nfs/dbraw/zinc/12/24/62/1355122462.db2.gz	PDFJVMXZJNEWGM-AEFFLSMTSA-N	0	3	325.456	3.187	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(F)c3occc32)CC[C@@H]1C	ZINC001072089045	1355122551	/nfs/dbraw/zinc/12/25/51/1355122551.db2.gz	VEALTQHCDCQVES-UONOGXRCSA-N	0	3	328.387	3.178	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cccc3oc(C)nc32)CC[C@H]1C	ZINC001072101043	1355130464	/nfs/dbraw/zinc/13/04/64/1355130464.db2.gz	CJNAUVSLOULSRT-UKRRQHHQSA-N	0	3	327.428	3.295	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccccc2CC(C)C)CC[C@H]1C	ZINC001072106997	1355134555	/nfs/dbraw/zinc/13/45/55/1355134555.db2.gz	ZDIFXLTYZHHGFP-MJGOQNOKSA-N	0	3	326.484	3.491	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(N(CC)CC)nc2)CC[C@@H]1C	ZINC001072112512	1355137775	/nfs/dbraw/zinc/13/77/75/1355137775.db2.gz	BAZWZQGRGJKMFX-FUHWJXTLSA-N	0	3	344.503	3.087	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc(-c3ccccc3)[nH]2)CC[C@@H]1C	ZINC001072113008	1355137995	/nfs/dbraw/zinc/13/79/95/1355137995.db2.gz	LVZKXNUAEXWUMB-FUHWJXTLSA-N	0	3	335.451	3.288	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(N(CC)CC)nc2)CC[C@H]1C	ZINC001072112513	1355138304	/nfs/dbraw/zinc/13/83/04/1355138304.db2.gz	BAZWZQGRGJKMFX-SJLPKXTDSA-N	0	3	344.503	3.087	20	30		EGEDHN
C[C@H]1CCN(C(=O)CC2CCC2)C[C@H]1CNCc1ccccc1C#N	ZINC001072241362	1355201540	/nfs/dbraw/zinc/20/15/40/1355201540.db2.gz	VRHPICPACUQBNC-OXJNMPFZSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](C)[C@@H](CNCc2cscn2)C1	ZINC001072334522	1355243991	/nfs/dbraw/zinc/24/39/91/1355243991.db2.gz	CPIFVNRXSFISKT-GJZGRUSLSA-N	0	3	335.517	3.320	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](C)[C@H](CNCc3cscn3)C2)CC1	ZINC001072352709	1355253973	/nfs/dbraw/zinc/25/39/73/1355253973.db2.gz	JYVZUCVQBNPHTG-DOTOQJQBSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](C)[C@@H](CNCc3cc(C)no3)C2)CC1	ZINC001072356964	1355254986	/nfs/dbraw/zinc/25/49/86/1355254986.db2.gz	SSGYGEWLMBLYDO-YJBOKZPZSA-N	0	3	345.487	3.304	20	30		EGEDHN
C[C@H](c1cccc(Cl)c1)N1CCC2(CN(C(=O)[C@@H](C)C#N)C2)C1	ZINC001072544287	1355326464	/nfs/dbraw/zinc/32/64/64/1355326464.db2.gz	HKUZYMXGXBKUDJ-UONOGXRCSA-N	0	3	331.847	3.095	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CN(C(=O)[C@H]4[C@@H]5CCCC[C@@H]54)C3)C2)cc1	ZINC001072580980	1355343158	/nfs/dbraw/zinc/34/31/58/1355343158.db2.gz	QFRLXKAIXVSLMP-PMOLBWCYSA-N	0	3	349.478	3.029	20	30		EGEDHN
CC[C@H](c1ccc(F)cc1)N1CCC2(CN(C(=O)C#CC3CC3)C2)C1	ZINC001072721562	1355406275	/nfs/dbraw/zinc/40/62/75/1355406275.db2.gz	XRCIXNPYZKXDLV-LJQANCHMSA-N	0	3	340.442	3.225	20	30		EGEDHN
C[C@]1(C(=O)N2CC3(C2)CCN(Cc2cccc(C#N)c2)C3)CC=CCC1	ZINC001072774506	1355431125	/nfs/dbraw/zinc/43/11/25/1355431125.db2.gz	WDRFUEGXUKLUEZ-NRFANRHFSA-N	0	3	349.478	3.339	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3oc4c(cccc4F)c3C)C2)C1	ZINC001072815367	1355449169	/nfs/dbraw/zinc/44/91/69/1355449169.db2.gz	WDMAWTJSDHESBC-UHFFFAOYSA-N	0	3	328.387	3.214	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H](NC(=O)C2CC3(CCC3)C2)C2CC2)s1	ZINC001323048673	1387275952	/nfs/dbraw/zinc/27/59/52/1387275952.db2.gz	TVQXWRQFEOOTCW-QGZVFWFLSA-N	0	3	343.496	3.184	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3cc(C4CC4)[nH]c3C3CC3)C2)C1	ZINC001072852442	1355465716	/nfs/dbraw/zinc/46/57/16/1355465716.db2.gz	BFPCXKCSPJFUAM-UHFFFAOYSA-N	0	3	325.456	3.103	20	30		EGEDHN
C=CCN1CCC2(CN(C(=O)c3cc(-c4ccccc4)ccn3)C2)C1	ZINC001073078767	1355583455	/nfs/dbraw/zinc/58/34/55/1355583455.db2.gz	YKHYBSYNLTUQEZ-UHFFFAOYSA-N	0	3	333.435	3.083	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@@H](C)c3ccc(Cl)s3)C2)C1	ZINC001073115109	1355605206	/nfs/dbraw/zinc/60/52/06/1355605206.db2.gz	QOCUHRNIDXHKAR-ZDUSSCGKSA-N	0	3	336.888	3.063	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)C(CC)(CC)c3ccccc3)C2)C1	ZINC001073450652	1355786186	/nfs/dbraw/zinc/78/61/86/1355786186.db2.gz	CZPFXFANGICUSA-UHFFFAOYSA-N	0	3	338.495	3.302	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2ccc(C3CCC3)cc2)C1	ZINC001073625690	1355847484	/nfs/dbraw/zinc/84/74/84/1355847484.db2.gz	HXBULEKUADIMRY-HXUWFJFHSA-N	0	3	342.483	3.351	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2ccc(CCC)cc2)C1	ZINC001073752257	1355889162	/nfs/dbraw/zinc/88/91/62/1355889162.db2.gz	SPHBWOMCYBPQLL-LJQANCHMSA-N	0	3	330.472	3.036	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2cc(C)c(CC)s2)C1	ZINC001073880350	1355937258	/nfs/dbraw/zinc/93/72/58/1355937258.db2.gz	GVNGALYSOJIFPR-HNNXBMFYSA-N	0	3	336.501	3.016	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCCN1C(=O)c1cccnc1	ZINC001073930220	1355965103	/nfs/dbraw/zinc/96/51/03/1355965103.db2.gz	CGTNPFAKNNSBER-HXUWFJFHSA-N	0	3	348.450	3.080	20	30		EGEDHN
CC1CC(C(=O)N2CCCC[C@@H]2CN(C)Cc2ccc(C#N)cc2)C1	ZINC001073989204	1356017858	/nfs/dbraw/zinc/01/78/58/1356017858.db2.gz	ACGANFQDRVNKRE-RRWXTXHCSA-N	0	3	339.483	3.417	20	30		EGEDHN
C#Cc1cncc(C(=O)N2CCCC[C@@H]2CN(C)Cc2ccccc2)c1	ZINC001074063702	1356062163	/nfs/dbraw/zinc/06/21/63/1356062163.db2.gz	QXHIYXNSPHZWKV-OAQYLSRUSA-N	0	3	347.462	3.190	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@H]1CCCCN1C(=O)[C@@H]1CC12CC2	ZINC001074071585	1356066543	/nfs/dbraw/zinc/06/65/43/1356066543.db2.gz	GGLLXOIJGQXHNU-MOPGFXCFSA-N	0	3	337.467	3.171	20	30		EGEDHN
C[C@@H](C(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)[C@@H]1C)C1CCC1	ZINC001074706720	1356225756	/nfs/dbraw/zinc/22/57/56/1356225756.db2.gz	PINMSMYUHXCAOU-TYILLQQXSA-N	0	3	343.446	3.213	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@H](NCc2ccc(C#N)s2)[C@@H]1C)c1ccco1	ZINC001074874351	1356276094	/nfs/dbraw/zinc/27/60/94/1356276094.db2.gz	URRFUWUNRPOROI-XEZPLFJOSA-N	0	3	343.452	3.095	20	30		EGEDHN
C[C@H]1CN(C(=O)c2ccoc2)CC[C@H]1CNCc1ccccc1C#N	ZINC001075224669	1356350489	/nfs/dbraw/zinc/35/04/89/1356350489.db2.gz	XNWRAOUWDDMZNN-RDJZCZTQSA-N	0	3	337.423	3.039	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cccc(C(F)F)c3F)[C@@H]2C1	ZINC001075800791	1356423306	/nfs/dbraw/zinc/42/33/06/1356423306.db2.gz	DAWFMZDGTLHYIK-SWLSCSKDSA-N	0	3	338.373	3.486	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3c3ccc(F)cc3F)[C@@H]2C1	ZINC001076080487	1356484283	/nfs/dbraw/zinc/48/42/83/1356484283.db2.gz	XALOXLUVCNSGLR-CKNFYHOISA-N	0	3	346.421	3.177	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cc(F)c(Cl)cc3F)[C@@H]2C1	ZINC001076193393	1356517497	/nfs/dbraw/zinc/51/74/97/1356517497.db2.gz	HFIQKFSJIXGPQG-MEDUHNTESA-N	0	3	340.801	3.341	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)Cc3ccc(C(C)(C)C)cc3)[C@@H]2C1	ZINC001076295294	1356540799	/nfs/dbraw/zinc/54/07/99/1356540799.db2.gz	JNCVJIOAOJGVJJ-PKOBYXMFSA-N	0	3	326.484	3.245	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)c3cc(C)nc4ccccc43)[C@@H]2C1	ZINC001076531601	1356607555	/nfs/dbraw/zinc/60/75/55/1356607555.db2.gz	UIBWOQSAAFOHTJ-OXJNMPFZSA-N	0	3	335.451	3.266	20	30		EGEDHN
C=CCCN1C[C@@H]2CCN(C(=O)c3sc(Cl)nc3Cl)[C@@H]2C1	ZINC001076578497	1356622394	/nfs/dbraw/zinc/62/23/94/1356622394.db2.gz	FVIUUKMZNMGJAV-VHSXEESVSA-N	0	3	346.283	3.172	20	30		EGEDHN
C#CCCN1C[C@@H]2CCN(C(=O)c3ccc(C(C)(C)C)s3)[C@@H]2C1	ZINC001076596128	1356626596	/nfs/dbraw/zinc/62/65/96/1356626596.db2.gz	ASTXKTMOERXXFH-LSDHHAIUSA-N	0	3	330.497	3.215	20	30		EGEDHN
C=C(C)CCN1C[C@@H](O)[C@H](NC(=O)c2ccccc2C(C)(C)CC)C1	ZINC001077195922	1356742151	/nfs/dbraw/zinc/74/21/51/1356742151.db2.gz	VLNNRDOEUXFYCQ-RTBURBONSA-N	0	3	344.499	3.115	20	30		EGEDHN
C#CCCCCC(=O)NC[C@H]1CCC(C)(C)CN1CCOC1CCC1	ZINC001099028780	1363584554	/nfs/dbraw/zinc/58/45/54/1363584554.db2.gz	KOSVFRMIAVBCDD-GOSISDBHSA-N	0	3	348.531	3.356	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2ccc(C)c(OC)c2)C12CCC2	ZINC001078676409	1357050758	/nfs/dbraw/zinc/05/07/58/1357050758.db2.gz	WFPFXBSCBPFYHI-IAGOWNOFSA-N	0	3	348.874	3.387	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2cncc(CC)c2)C12CCC2	ZINC001078683721	1357053914	/nfs/dbraw/zinc/05/39/14/1357053914.db2.gz	VXCHUWXEFODRJH-HZPDHXFCSA-N	0	3	333.863	3.027	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2coc(CC3CC3)n2)C12CCC2	ZINC001078766448	1357073055	/nfs/dbraw/zinc/07/30/55/1357073055.db2.gz	DPKHBKFBVQLYMS-GJZGRUSLSA-N	0	3	349.862	3.010	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H]2CCCC(C)(C)C2)C[C@H]1c1ccccc1	ZINC001081233026	1357851871	/nfs/dbraw/zinc/85/18/71/1357851871.db2.gz	MXGGSRVDARUQMC-SLFFLAALSA-N	0	3	338.495	3.420	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H]2CCCCC2(C)C)C[C@H]1c1ccccc1	ZINC001081231194	1357851971	/nfs/dbraw/zinc/85/19/71/1357851971.db2.gz	DBBXDAQFOOBYGP-SLFFLAALSA-N	0	3	338.495	3.420	20	30		EGEDHN
C=CCCN1C[C@H]2OCCN(C(=O)CC(C3CCC3)C3CCC3)[C@H]2C1	ZINC001083195414	1358122153	/nfs/dbraw/zinc/12/21/53/1358122153.db2.gz	SXQQCVQNMOAHGV-VQTJNVASSA-N	0	3	346.515	3.081	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)[C@@H](CC)CC3CCCC3)[C@H]2C1	ZINC001083213255	1358124062	/nfs/dbraw/zinc/12/40/62/1358124062.db2.gz	STHZVDFVHXODEK-SLFFLAALSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C(C)CCN1C[C@@H](NC(=O)c2ccc(C3CCCC3)cc2)[C@@H](O)C1	ZINC001083646388	1358133178	/nfs/dbraw/zinc/13/31/78/1358133178.db2.gz	AMFSRNRYAJBQOJ-UXHICEINSA-N	0	3	342.483	3.085	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)CCc3ccccc3OCC)[C@@H]2C1	ZINC001084492200	1358223767	/nfs/dbraw/zinc/22/37/67/1358223767.db2.gz	SWRICBMTYWMPRE-RTBURBONSA-N	0	3	342.483	3.127	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@@H]3C[C@H]3c3ccc(F)cc3F)[C@@H]2C1	ZINC001084540676	1358234583	/nfs/dbraw/zinc/23/45/83/1358234583.db2.gz	QVPHUDLUEOGKJH-WCMCAJIFSA-N	0	3	346.421	3.177	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)C[C@H](C)c3cccc(F)c3)[C@@H]2C1	ZINC001084649658	1358269588	/nfs/dbraw/zinc/26/95/88/1358269588.db2.gz	ZPWQPBUZVGQUNG-KVSKMBFKSA-N	0	3	330.447	3.428	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)[C@@H](CC)Cc3ccccc3)[C@@H]2C1	ZINC001084695230	1358283344	/nfs/dbraw/zinc/28/33/44/1358283344.db2.gz	KVLMGHLYSDADLY-XUVXKRRUSA-N	0	3	326.484	3.364	20	30		EGEDHN
N#Cc1c(NC(=O)C(C#N)Cc2ccc(O)cc2)sc2c1CCC2	ZINC001183605660	1387323079	/nfs/dbraw/zinc/32/30/79/1387323079.db2.gz	QJWJYNINYSIQFV-LBPRGKRZSA-N	0	3	337.404	3.135	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3cc(Cl)ccc3OC)[C@@H]2C1	ZINC001084812556	1358317010	/nfs/dbraw/zinc/31/70/10/1358317010.db2.gz	MIFZNYOBIDMUOX-CZUORRHYSA-N	0	3	334.847	3.071	20	30		EGEDHN
CC[C@H](C)C(=O)N1CC[C@H]2CCN(Cc3cccc(C#N)c3)[C@H]2C1	ZINC001084892365	1358341711	/nfs/dbraw/zinc/34/17/11/1358341711.db2.gz	XLWCRYHOIJCUTJ-IPELMVKDSA-N	0	3	325.456	3.027	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1CC[C@H]2CCN(Cc3ccc(C#N)cc3)[C@H]2C1	ZINC001085048096	1358377512	/nfs/dbraw/zinc/37/75/12/1358377512.db2.gz	CXDCUSXVAYADBO-DBVUQKKJSA-N	0	3	339.483	3.273	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)[C@@H](C)c3ccc(CC)cc3)C[C@@H]21	ZINC001085057496	1358381020	/nfs/dbraw/zinc/38/10/20/1358381020.db2.gz	GKQZDPBUBWVAFE-WMQCIHAUSA-N	0	3	338.495	3.299	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@H]3Cc4c3cccc4Cl)C[C@@H]21	ZINC001085104021	1358392291	/nfs/dbraw/zinc/39/22/91/1358392291.db2.gz	AXFGXYVRLZFEHH-QBIMZIAESA-N	0	3	330.859	3.089	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)[C@@H](C)Cc3cccc(F)c3)C[C@@H]21	ZINC001085104257	1358392665	/nfs/dbraw/zinc/39/26/65/1358392665.db2.gz	RZDORFJVQJRFHE-WDYCEAGBSA-N	0	3	330.447	3.113	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1ccn2c(C)cnc2c1	ZINC001085198204	1358431238	/nfs/dbraw/zinc/43/12/38/1358431238.db2.gz	HYCSTNNIICKLOG-HZPDHXFCSA-N	0	3	346.862	3.026	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cc(=O)[nH]c(C2CC2)c1	ZINC001085222054	1358437275	/nfs/dbraw/zinc/43/72/75/1358437275.db2.gz	AVTWIVWPAQIQDP-HUUCEWRRSA-N	0	3	349.862	3.048	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H](C)C1CCC1	ZINC001085240692	1358440709	/nfs/dbraw/zinc/44/07/09/1358440709.db2.gz	PTSVCSGKYIAYFV-NWANDNLSSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1scnc1C(F)F	ZINC001085270286	1358447979	/nfs/dbraw/zinc/44/79/79/1358447979.db2.gz	UZRVITYRNILXHN-NXEZZACHSA-N	0	3	349.834	3.464	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)Cc1ccc(F)c(F)c1	ZINC001085314458	1358462821	/nfs/dbraw/zinc/46/28/21/1358462821.db2.gz	XDLSWCXWDMVVDJ-HZPDHXFCSA-N	0	3	342.817	3.277	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCCC[C@H]2NCc2cnc(C)nc2)CC1	ZINC001085321003	1358464817	/nfs/dbraw/zinc/46/48/17/1358464817.db2.gz	AVZORERHILLWEF-RTBURBONSA-N	0	3	342.487	3.048	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCCC[C@H]2NCc2conc2CC)C1	ZINC001085324472	1358467652	/nfs/dbraw/zinc/46/76/52/1358467652.db2.gz	BMKUHJLWSVFZTQ-IAGOWNOFSA-N	0	3	331.460	3.110	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cc2ccccn2c1	ZINC001085351338	1358476051	/nfs/dbraw/zinc/47/60/51/1358476051.db2.gz	CQNJKRNAUFRZRI-IAGOWNOFSA-N	0	3	331.847	3.322	20	30		EGEDHN
CC[C@@H](c1ccccc1)N1CC[C@@H]1CN(C)C(=O)c1cc(C#N)c[nH]1	ZINC001085535818	1358573382	/nfs/dbraw/zinc/57/33/82/1358573382.db2.gz	PXRCPYWWEZCZBW-MJGOQNOKSA-N	0	3	336.439	3.184	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cnn2cccc(Cl)c12	ZINC001085711664	1358704652	/nfs/dbraw/zinc/70/46/52/1358704652.db2.gz	OCIWCQXARLMAAU-CQSZACIVSA-N	0	3	346.862	3.100	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)[C@@H]1COc2cc(C)c(C)cc21	ZINC001085742946	1358726021	/nfs/dbraw/zinc/72/60/21/1358726021.db2.gz	CFJGPWVUBOYEEP-IEBWSBKVSA-N	0	3	342.483	3.278	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1c(F)ccc(F)c1F	ZINC001085792289	1358767862	/nfs/dbraw/zinc/76/78/62/1358767862.db2.gz	GGLJLJQVIYZWNZ-LBPRGKRZSA-N	0	3	326.362	3.216	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc(N2CC=CC2)cc1	ZINC001085816286	1358791669	/nfs/dbraw/zinc/79/16/69/1358791669.db2.gz	SKRFXPXADYSDLM-FQEVSTJZSA-N	0	3	339.483	3.175	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc(F)cc2cccnc21	ZINC001085852654	1358820754	/nfs/dbraw/zinc/82/07/54/1358820754.db2.gz	CNYAJZMYWLSQEZ-KRWDZBQOSA-N	0	3	341.430	3.486	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cnn(C2CCCC2)c1C	ZINC001085917765	1358877486	/nfs/dbraw/zinc/87/74/86/1358877486.db2.gz	JYDROMVIYAKCHF-GOSISDBHSA-N	0	3	344.503	3.419	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C[C@@H]2CCN2CCC2CCCCC2)nc1	ZINC001085934112	1358888940	/nfs/dbraw/zinc/88/89/40/1358888940.db2.gz	SGWMHYPDEDQHQM-IBGZPJMESA-N	0	3	339.483	3.180	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)C12CC(C(F)(F)F)(C1)C2	ZINC001085988625	1358940183	/nfs/dbraw/zinc/94/01/83/1358940183.db2.gz	RXHJUNKWKBMOSO-IUDNXUCKSA-N	0	3	330.394	3.218	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1ccc(N(C)C(C)C)cc1	ZINC001085998578	1358953289	/nfs/dbraw/zinc/95/32/89/1358953289.db2.gz	FQWQGPCVCKIFHB-IBGZPJMESA-N	0	3	329.488	3.254	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(-c3ccco3)o2)C1	ZINC001086145573	1359008051	/nfs/dbraw/zinc/00/80/51/1359008051.db2.gz	XGYYPVLRXVSMBC-BETUJISGSA-N	0	3	334.803	3.390	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cnc3c(F)cccc3c2)C1	ZINC001086149563	1359009253	/nfs/dbraw/zinc/00/92/53/1359009253.db2.gz	ORKNBSYQPHCARC-JNSHFYNHSA-N	0	3	347.821	3.224	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@@H]2CC[C@H](C(F)(F)F)C2)C1	ZINC001086178179	1359016141	/nfs/dbraw/zinc/01/61/41/1359016141.db2.gz	WGKKABZBUKYCCI-NDBYEHHHSA-N	0	3	338.801	3.202	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)[C@H]2CCC[C@@H]2CC)C1	ZINC001086188878	1359021623	/nfs/dbraw/zinc/02/16/23/1359021623.db2.gz	CSFUQJBFNBWTKB-XQLPTFJDSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)[C@@H]2CCC[C@@H]2CC)C1	ZINC001086188876	1359021990	/nfs/dbraw/zinc/02/19/90/1359021990.db2.gz	CSFUQJBFNBWTKB-BYNSBNAKSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@@H]2C[C@H]2c2ccc(C)s2)C1	ZINC001086221124	1359031454	/nfs/dbraw/zinc/03/14/54/1359031454.db2.gz	GXDZWDVOAWAXFU-LXTVHRRPSA-N	0	3	338.904	3.397	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cc(F)c3ncccc3c2)C1	ZINC001086226505	1359032979	/nfs/dbraw/zinc/03/29/79/1359032979.db2.gz	VZPHMPFAEJFIJW-JNSHFYNHSA-N	0	3	347.821	3.224	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2ccc(N(C)CCC)cc2)C1	ZINC001086285608	1359055939	/nfs/dbraw/zinc/05/59/39/1359055939.db2.gz	QDNMOFRWLKLZKS-WOVMCDHWSA-N	0	3	349.906	3.383	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)C2CCc3ccccc3CC2)C1	ZINC001086412201	1359090796	/nfs/dbraw/zinc/09/07/96/1359090796.db2.gz	OVFBBUWEAPRXDT-RHDGDCLCSA-N	0	3	346.902	3.419	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(Cl)cc2OC)C1	ZINC001086461529	1359104641	/nfs/dbraw/zinc/10/46/41/1359104641.db2.gz	VTMJBLMPWSWBSL-AULYBMBSSA-N	0	3	343.254	3.199	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)[C@@H]2CCC(C)(C)C2)C1	ZINC001086468428	1359109051	/nfs/dbraw/zinc/10/90/51/1359109051.db2.gz	BKEUKWSCFRBGHN-MGPQQGTHSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](CNC(=O)[C@@H]2CCC[C@@H]2CC)C1	ZINC001086469125	1359109459	/nfs/dbraw/zinc/10/94/59/1359109459.db2.gz	CSFUQJBFNBWTKB-ZQDZILKHSA-N	0	3	343.309	3.206	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cccc(N3CCCC3)c2)C1	ZINC001086511932	1359124124	/nfs/dbraw/zinc/12/41/24/1359124124.db2.gz	MLQRUYVKQNMPHA-JCNLHEQBSA-N	0	3	347.890	3.137	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(OCC3CC3)cc2)C1	ZINC001086555410	1359143633	/nfs/dbraw/zinc/14/36/33/1359143633.db2.gz	FQIGRWJKYZYZNO-JCNLHEQBSA-N	0	3	348.874	3.326	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccnn2[C@H](C)CC)C1	ZINC001086709638	1359190433	/nfs/dbraw/zinc/19/04/33/1359190433.db2.gz	NFORGSCEMTXRET-QLFBSQMISA-N	0	3	338.883	3.095	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2ccn3c2CCCC3)C1	ZINC001086719953	1359191224	/nfs/dbraw/zinc/19/12/24/1359191224.db2.gz	MXQYYVSCEHXQMM-LSDHHAIUSA-N	0	3	335.879	3.065	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NC[C@H]1CC[C@@H](NCC(=C)Cl)C1	ZINC001086736026	1359193616	/nfs/dbraw/zinc/19/36/16/1359193616.db2.gz	YUCCOYUAMSUSCM-JKSUJKDBSA-N	0	3	348.874	3.492	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cc3ccccc3n2C)C1	ZINC001086789490	1359201778	/nfs/dbraw/zinc/20/17/78/1359201778.db2.gz	PHTXEAYCNADDTR-GOEBONIOSA-N	0	3	345.874	3.419	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CC[C@@H](NCc3ocnc3C)C2)CC1	ZINC001086794683	1359202751	/nfs/dbraw/zinc/20/27/51/1359202751.db2.gz	GKUQYGUGSVWXAV-DOTOQJQBSA-N	0	3	331.460	3.104	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CC[C@@H](NCc3oc(C)nc3C)C2)CC1	ZINC001086795090	1359202974	/nfs/dbraw/zinc/20/29/74/1359202974.db2.gz	YLSPOPZFTFEENY-FUHWJXTLSA-N	0	3	345.487	3.412	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3c(C)coc3C)C2)CC1	ZINC001086920912	1359247977	/nfs/dbraw/zinc/24/79/77/1359247977.db2.gz	BQWWKWQKDNUHGF-INIZCTEOSA-N	0	3	328.456	3.236	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)[C@@H]3C[C@H]3C(C)(C)C)C2)CC1	ZINC001086932404	1359256196	/nfs/dbraw/zinc/25/61/96/1359256196.db2.gz	JYDQVJSRZDRUOW-KZNAEPCWSA-N	0	3	330.516	3.395	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3ncc(C)cc3C)C2)CC1	ZINC001086934601	1359257691	/nfs/dbraw/zinc/25/76/91/1359257691.db2.gz	VAAKPOASCFECCB-SFHVURJKSA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)Cc3cccc(Cl)c3)C2)CC1	ZINC001086940472	1359262018	/nfs/dbraw/zinc/26/20/18/1359262018.db2.gz	RRRUFQDQAIPSDY-MRXNPFEDSA-N	0	3	344.886	3.219	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc(F)c(Cl)c3)C2)CC1	ZINC001086940512	1359262724	/nfs/dbraw/zinc/26/27/24/1359262724.db2.gz	STNNFQPNTBUQMW-CQSZACIVSA-N	0	3	348.849	3.429	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccc(Cl)s3)C2)CC1	ZINC001086955159	1359275763	/nfs/dbraw/zinc/27/57/63/1359275763.db2.gz	FPDZLWKKPJKBBS-CYBMUJFWSA-N	0	3	336.888	3.351	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3cc4ccccc4o3)C2)CC1	ZINC001086955293	1359276193	/nfs/dbraw/zinc/27/61/93/1359276193.db2.gz	JYAMAQUPOZOHIH-INIZCTEOSA-N	0	3	336.435	3.383	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)CCc3cccs3)C2)CC1	ZINC001086956062	1359276989	/nfs/dbraw/zinc/27/69/89/1359276989.db2.gz	CXPKRMCNNMOEDV-MRXNPFEDSA-N	0	3	330.497	3.017	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CC[C@@H](C)C[C@H]1CNCc1ccccc1Cl	ZINC001087136441	1359301925	/nfs/dbraw/zinc/30/19/25/1359301925.db2.gz	USDNLRZEOGNHNU-FMKPAKJESA-N	0	3	333.863	3.216	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)c3sccc3F)C(C)(C)[C@H]21	ZINC001087284924	1359363974	/nfs/dbraw/zinc/36/39/74/1359363974.db2.gz	QCNYINATMOWKOJ-KCXAZCMYSA-N	0	3	334.460	3.129	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc4occc4[nH]3)C(C)(C)[C@@H]21	ZINC001087288796	1359368140	/nfs/dbraw/zinc/36/81/40/1359368140.db2.gz	CANHBNJCMCRKLR-FSPWUOQZSA-N	0	3	339.439	3.003	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(Cl)ccc3F)C(C)(C)[C@H]21	ZINC001087295135	1359375955	/nfs/dbraw/zinc/37/59/55/1359375955.db2.gz	FFDWPRRYAYUPLF-XYPHTWIQSA-N	0	3	348.849	3.331	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3nccc4ccccc43)C(C)(C)[C@H]21	ZINC001087302310	1359385254	/nfs/dbraw/zinc/38/52/54/1359385254.db2.gz	QQMJPIXTLCSCRQ-HOJAQTOUSA-N	0	3	347.462	3.087	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2[C@H]3CCCN(CC#CC)[C@@H]3C2(C)C)CC1	ZINC001087303367	1359386889	/nfs/dbraw/zinc/38/68/89/1359386889.db2.gz	KMTADJDUQSOHJL-QRVBRYPASA-N	0	3	328.500	3.361	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc(C(C)C)cn1	ZINC001087305162	1359390690	/nfs/dbraw/zinc/39/06/90/1359390690.db2.gz	OCLKBXXIBUJIMG-NZSAHSFTSA-N	0	3	339.483	3.057	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccc(CC)cc1	ZINC001087315715	1359405971	/nfs/dbraw/zinc/40/59/71/1359405971.db2.gz	HFDLEFVBOPATRK-HSALFYBXSA-N	0	3	338.495	3.491	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(C)c(C)s3)C(C)(C)[C@@H]21	ZINC001087317421	1359409072	/nfs/dbraw/zinc/40/90/72/1359409072.db2.gz	HZUBMWQDNIIRTN-DJIMGWMZSA-N	0	3	330.497	3.217	20	30		EGEDHN
C/C=C(/C)C(=O)N1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1CC#Cc1ccccc1	ZINC001087347779	1359428316	/nfs/dbraw/zinc/42/83/16/1359428316.db2.gz	KAFYTLSUOHVEJP-RMEDLLLQSA-N	0	3	348.490	3.173	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)[C@H](C)C2CCC2)C1	ZINC001087430674	1359463061	/nfs/dbraw/zinc/46/30/61/1359463061.db2.gz	BMFXIWJCYFNDEX-DUXKGJEZSA-N	0	3	338.495	3.420	20	30		EGEDHN
CCCc1occc1C(=O)NCC1(NCc2ccc(C#N)cc2)CC1	ZINC001323592778	1387399397	/nfs/dbraw/zinc/39/93/97/1387399397.db2.gz	VRCUTCFNIYHXRV-UHFFFAOYSA-N	0	3	337.423	3.156	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(F)cc3ccncc32)[C@H]1CC	ZINC001087574408	1359538331	/nfs/dbraw/zinc/53/83/31/1359538331.db2.gz	FBPBCSQNNFOYQS-ZWKOTPCHSA-N	0	3	327.403	3.143	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cc(Cl)c(Cl)n2C)[C@H]1CC	ZINC001087593658	1359547808	/nfs/dbraw/zinc/54/78/08/1359547808.db2.gz	PGRCBYQZDHVNOX-NWDGAFQWSA-N	0	3	330.259	3.101	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)Cc2ccccc2)CCN1Cc1cccc(C#N)c1	ZINC001087627474	1359563333	/nfs/dbraw/zinc/56/33/33/1359563333.db2.gz	JYVLAQLTCMNJDV-LEWJYISDSA-N	0	3	347.462	3.270	20	30		EGEDHN
CC[C@@H]1[C@@H](NC(=O)C2(C)CC=CC2)CCN1Cc1ccc(C#N)cc1	ZINC001087713595	1359606007	/nfs/dbraw/zinc/60/60/07/1359606007.db2.gz	WRFZLINWDMCZRC-RBUKOAKNSA-N	0	3	337.467	3.384	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2ccc(OC3CCC3)cc2)[C@H]1CC	ZINC001087836859	1359672310	/nfs/dbraw/zinc/67/23/10/1359672310.db2.gz	KRHUOMJYZSOLIO-RBUKOAKNSA-N	0	3	328.456	3.387	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)[C@@]2(C)CCc3ccccc3C2)[C@H]1CC	ZINC001087853980	1359682175	/nfs/dbraw/zinc/68/21/75/1359682175.db2.gz	OPIMORCDTJHPHO-ZVDOUQERSA-N	0	3	326.484	3.337	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)C3(C)CCC(F)(F)CC3)C[C@@H]2C1	ZINC001088016778	1359725783	/nfs/dbraw/zinc/72/57/83/1359725783.db2.gz	UZOXAMZGLIDUOV-CVEARBPZSA-N	0	3	338.442	3.006	20	30		EGEDHN
CC#CCN1CC[C@@H]2CN(C(=O)[C@H]3CC[C@H](C(C)C)CC3)C[C@@H]2C1	ZINC001088151480	1359773296	/nfs/dbraw/zinc/77/32/96/1359773296.db2.gz	GLLNNCVZPRBMIK-WTGUMLROSA-N	0	3	330.516	3.252	20	30		EGEDHN
C=CCN1CC[C@@H](OCC2CCN(C(=O)c3cccc(C)c3)CC2)C1	ZINC001088225547	1359803784	/nfs/dbraw/zinc/80/37/84/1359803784.db2.gz	PCEPUAIIYREAHF-HXUWFJFHSA-N	0	3	342.483	3.124	20	30		EGEDHN
C=CCN1CC[C@@H](OCC2CCN(C(=O)c3csc(C)c3)CC2)C1	ZINC001088239499	1359811067	/nfs/dbraw/zinc/81/10/67/1359811067.db2.gz	XEDIDDWTYFFRHZ-GOSISDBHSA-N	0	3	348.512	3.186	20	30		EGEDHN
C=C1CCC(C(=O)N2CCCCC[C@@H](NCc3cncn3C)C2)CC1	ZINC001088373581	1359854874	/nfs/dbraw/zinc/85/48/74/1359854874.db2.gz	IIVGFRBNFYKABF-GOSISDBHSA-N	0	3	344.503	3.027	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)c2conc2C2CC2)C1	ZINC001088380800	1359864091	/nfs/dbraw/zinc/86/40/91/1359864091.db2.gz	PMXJQSNFSJMICV-CQSZACIVSA-N	0	3	337.851	3.279	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCCCN(C(=O)c2c(C)onc2CC)C1	ZINC001088423919	1359893288	/nfs/dbraw/zinc/89/32/88/1359893288.db2.gz	GCYMESOFZVTSND-AWEZNQCLSA-N	0	3	339.867	3.272	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCCCN(C(=O)Cc2ccc(C)nc2)C1	ZINC001088426980	1359894776	/nfs/dbraw/zinc/89/47/76/1359894776.db2.gz	KLQIRBFOLNIKBK-QGZVFWFLSA-N	0	3	335.879	3.046	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](CNCc2nc(C)sc2C)[C@@H](C)C1	ZINC001184311208	1387426493	/nfs/dbraw/zinc/42/64/93/1387426493.db2.gz	GMYPYKFMFWLPGB-WMLDXEAASA-N	0	3	347.528	3.138	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCN(CCOc3cccc(C)c3)[C@@H]2C)C1	ZINC001088844118	1360078329	/nfs/dbraw/zinc/07/83/29/1360078329.db2.gz	CRRWCMHNMRHSCF-MJGOQNOKSA-N	0	3	342.483	3.309	20	30		EGEDHN
C=C(C)CCN1CC[C@H](NC(=O)c2cnc([C@@H]3CCCO3)s2)[C@H]1C	ZINC001088906565	1360101398	/nfs/dbraw/zinc/10/13/98/1360101398.db2.gz	BLRIAVPJJVFQRB-ILXRZTDVSA-N	0	3	349.500	3.153	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3ccc(C)c(C)c3)[C@@H]2C)nc1	ZINC001088990838	1360126151	/nfs/dbraw/zinc/12/61/51/1360126151.db2.gz	SBLIYZMAIVYYQW-XLIONFOSSA-N	0	3	347.462	3.073	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCN(Cc3cc(C)ccc3C)[C@@H]2C)cn1	ZINC001088990836	1360126191	/nfs/dbraw/zinc/12/61/91/1360126191.db2.gz	SBALHJYZDRGVPR-UTKZUKDTSA-N	0	3	347.462	3.073	20	30		EGEDHN
Cc1ccc(CN(C)C[C@@H]2CCCCN2C(=O)C#CC2CC2)cc1F	ZINC001089174749	1360227846	/nfs/dbraw/zinc/22/78/46/1360227846.db2.gz	HBOOPUKGECJIAH-IBGZPJMESA-N	0	3	342.458	3.360	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)Cc2cccc3cnccc32)CC(C)(C)C1	ZINC001089419725	1360413929	/nfs/dbraw/zinc/41/39/29/1360413929.db2.gz	HGOBKDVVDYTPMG-LJQANCHMSA-N	0	3	349.478	3.017	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc(C)n([C@H](C)CC)n2)CC(C)(C)C1	ZINC001089427435	1360419792	/nfs/dbraw/zinc/41/97/92/1360419792.db2.gz	QHSYFKHMJQMEIO-WBVHZDCISA-N	0	3	344.503	3.016	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cc(F)ccc2CC)CC(C)(C)C1	ZINC001089431093	1360423045	/nfs/dbraw/zinc/42/30/45/1360423045.db2.gz	YTCHDZJMUQRKHF-KRWDZBQOSA-N	0	3	330.447	3.242	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cnc3ccsc3c2)CC(C)(C)C1	ZINC001089458449	1360445069	/nfs/dbraw/zinc/44/50/69/1360445069.db2.gz	LHKPPBICVGISAV-OAHLLOKOSA-N	0	3	341.480	3.150	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccccc2C)CC(C)(C)C1	ZINC001089513947	1360485011	/nfs/dbraw/zinc/48/50/11/1360485011.db2.gz	GAFQXSOVDNRUMJ-YSIASYRMSA-N	0	3	338.495	3.339	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@@]2(C)C[C@@H]2c2ccccc2)CC(C)(C)C1	ZINC001089517687	1360487543	/nfs/dbraw/zinc/48/75/43/1360487543.db2.gz	SNFQOSTZTPVVTL-JQVVWYNYSA-N	0	3	338.495	3.420	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc(Cl)cc(OC)c2)CC(C)(C)C1	ZINC001089522479	1360489163	/nfs/dbraw/zinc/48/91/63/1360489163.db2.gz	YHHUKSKXAWKEED-MRXNPFEDSA-N	0	3	348.874	3.202	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc3scnc3c2)CC(C)(C)C1	ZINC001089534359	1360494637	/nfs/dbraw/zinc/49/46/37/1360494637.db2.gz	QGWSNTPLGRSSRX-HNNXBMFYSA-N	0	3	341.480	3.150	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2sccc2C2CC2)CC(C)(C)C1	ZINC001089556947	1360506474	/nfs/dbraw/zinc/50/64/74/1360506474.db2.gz	VLJCZKFVRLDNCB-OAHLLOKOSA-N	0	3	330.497	3.479	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cnc(CC(C)C)s2)CC(C)(C)C1	ZINC001089568548	1360513850	/nfs/dbraw/zinc/51/38/50/1360513850.db2.gz	MNBFFVXZIRBBET-OAHLLOKOSA-N	0	3	347.528	3.195	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)[C@H]2Cc3c2cccc3Cl)CC(C)(C)C1	ZINC001089569295	1360514776	/nfs/dbraw/zinc/51/47/76/1360514776.db2.gz	VKWLOAYVJCAYCI-YOEHRIQHSA-N	0	3	344.886	3.220	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1c(C)oc(C)c1C	ZINC001089668304	1360578027	/nfs/dbraw/zinc/57/80/27/1360578027.db2.gz	UKNNMOJBTMQDQA-KRWDZBQOSA-N	0	3	330.472	3.449	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cncc(CC)c1	ZINC001089670226	1360579907	/nfs/dbraw/zinc/57/99/07/1360579907.db2.gz	BHHQRIKYLZIVME-SFHVURJKSA-N	0	3	329.488	3.441	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(C)nn1CC	ZINC001089699243	1360602903	/nfs/dbraw/zinc/60/29/03/1360602903.db2.gz	JBYIKNZZELEJJW-MRXNPFEDSA-N	0	3	332.492	3.008	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H]1CCOc2ccccc21	ZINC001089710128	1360614014	/nfs/dbraw/zinc/61/40/14/1360614014.db2.gz	BOTLREVSHVXKTF-FUHWJXTLSA-N	0	3	342.483	3.346	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(C)cc2c[nH]nc21	ZINC001089709766	1360614062	/nfs/dbraw/zinc/61/40/62/1360614062.db2.gz	XSRATPSYIDHLGK-MRXNPFEDSA-N	0	3	340.471	3.278	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cnn(C(C)C)c1	ZINC001089725706	1360628787	/nfs/dbraw/zinc/62/87/87/1360628787.db2.gz	KSXSEHRKPMLPHB-KRWDZBQOSA-N	0	3	332.492	3.261	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc2nccnc2c1	ZINC001089731547	1360634879	/nfs/dbraw/zinc/63/48/79/1360634879.db2.gz	SGBLGEJUOOBFPX-INIZCTEOSA-N	0	3	338.455	3.036	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1cccc(NC(C)=O)c1	ZINC001089731188	1360635145	/nfs/dbraw/zinc/63/51/45/1360635145.db2.gz	MMTCZMZQMWOROD-SFHVURJKSA-N	0	3	343.471	3.051	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)/C=C\c1ccco1	ZINC001089758507	1360651782	/nfs/dbraw/zinc/65/17/82/1360651782.db2.gz	RQBDNMKTULAWOR-HIDTWLFNSA-N	0	3	346.858	3.214	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1ccoc1C	ZINC001089771303	1360657583	/nfs/dbraw/zinc/65/75/83/1360657583.db2.gz	YKJVAHSFYSRKLR-ORQFMDKSSA-N	0	3	334.847	3.123	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1coc(C)c1	ZINC001089798930	1360668637	/nfs/dbraw/zinc/66/86/37/1360668637.db2.gz	BDCQASHXKZAWOJ-ORQFMDKSSA-N	0	3	334.847	3.123	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](CNCc2ocnc2C)[C@H](C)C1	ZINC001184472668	1387467651	/nfs/dbraw/zinc/46/76/51/1387467651.db2.gz	KMFLVQUUPZYRTL-GDBMZVCRSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C(C)(C)C2CCC2)CC2(CCOCC2)C1	ZINC001089949998	1360759881	/nfs/dbraw/zinc/75/98/81/1360759881.db2.gz	MXZDSWKRJQXTRX-GOSISDBHSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)[C@@H]2CCC(C)(C)C2)CC2(CCOCC2)C1	ZINC001089956959	1360765771	/nfs/dbraw/zinc/76/57/71/1360765771.db2.gz	PKYYCKKJFBCNLH-MSOLQXFVSA-N	0	3	348.531	3.376	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](CNCc2ccn(C(C)C)n2)[C@H](C)C1	ZINC001184509925	1387478599	/nfs/dbraw/zinc/47/85/99/1387478599.db2.gz	BQZMCRPFWPONKW-MSOLQXFVSA-N	0	3	346.519	3.395	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccccc2CC(C)(C)C)[C@@H](O)C1	ZINC001090347315	1360893874	/nfs/dbraw/zinc/89/38/74/1360893874.db2.gz	POKHQRXARNSICG-OALUTQOASA-N	0	3	344.499	3.016	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)C2C(C)(C)C2(C)C)C1	ZINC001090975537	1360966868	/nfs/dbraw/zinc/96/68/68/1360966868.db2.gz	CNKZYBGEUKNWHD-UHFFFAOYSA-N	0	3	343.309	3.062	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2nccc3ccsc32)C1	ZINC001091080619	1360989260	/nfs/dbraw/zinc/98/92/60/1360989260.db2.gz	IOLCNKFILBHWFL-UHFFFAOYSA-N	0	3	335.860	3.147	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc3c([nH]2)c(F)ccc3C)C1	ZINC001091108236	1360992940	/nfs/dbraw/zinc/99/29/40/1360992940.db2.gz	ZIJZZNYCWYXLSA-UHFFFAOYSA-N	0	3	349.837	3.466	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2coc3ccc(OC)cc32)C1	ZINC001091136653	1360996655	/nfs/dbraw/zinc/99/66/55/1360996655.db2.gz	FSMLXWAHPGOAKS-UHFFFAOYSA-N	0	3	348.830	3.292	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cncc3sccc32)C1	ZINC001091201358	1361005645	/nfs/dbraw/zinc/00/56/45/1361005645.db2.gz	OTBRERQKHHTHHO-UHFFFAOYSA-N	0	3	335.860	3.147	20	30		EGEDHN
C=C1CCC(C(=O)NCC2CC(NCc3cc(C)ns3)C2)CC1	ZINC001091215886	1361010244	/nfs/dbraw/zinc/01/02/44/1361010244.db2.gz	OENGCAHHOZZPJA-UHFFFAOYSA-N	0	3	333.501	3.182	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2coc(-c3ccccc3)n2)C1	ZINC001091329416	1361046236	/nfs/dbraw/zinc/04/62/36/1361046236.db2.gz	QRKFWNPNWYSTHY-UHFFFAOYSA-N	0	3	345.830	3.192	20	30		EGEDHN
C[C@@]12CN(Cc3cccc(C#N)c3)C[C@@H]1CN(C(=O)C[C@@H]1C=CCC1)C2	ZINC001091465999	1361108435	/nfs/dbraw/zinc/10/84/35/1361108435.db2.gz	YBSRUODQIQMBBF-ZNLUXHQJSA-N	0	3	349.478	3.195	20	30		EGEDHN
Cc1occc1C(=O)N1C[C@H]2CN(Cc3ccc(C#N)cc3)C[C@@]2(C)C1	ZINC001091467113	1361108956	/nfs/dbraw/zinc/10/89/56/1361108956.db2.gz	LXNZAJVKWAIDOQ-NQIIRXRSSA-N	0	3	349.434	3.054	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3occc3-c3ccccc3)C[C@]2(C)C1	ZINC001091835037	1361233145	/nfs/dbraw/zinc/23/31/45/1361233145.db2.gz	NFPIRXIBQNGRJG-GCJKJVERSA-N	0	3	348.446	3.364	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)C[C@H](C)c3ccc(CC)cc3)C[C@]2(C)C1	ZINC001092008289	1361273680	/nfs/dbraw/zinc/27/36/80/1361273680.db2.gz	FTCPMTNQZMJRLM-WEYGHZABSA-N	0	3	338.495	3.156	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1C[C@H]2CN(Cc3ccc(C#N)cc3)C[C@@]2(C)C1	ZINC001092065886	1361286512	/nfs/dbraw/zinc/28/65/12/1361286512.db2.gz	UZPCPKGOEXXOMD-SCWSEQNSSA-N	0	3	339.483	3.131	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)[C@H](C)c3ccc(CC)cc3)C[C@]2(C)C1	ZINC001092101793	1361301177	/nfs/dbraw/zinc/30/11/77/1361301177.db2.gz	OEEQCEABJRFFBT-ZNLUXHQJSA-N	0	3	338.495	3.156	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cc(C(C)C)oc3C)C[C@]2(C)C1	ZINC001092157938	1361314460	/nfs/dbraw/zinc/31/44/60/1361314460.db2.gz	VHDSBYPOYBIFPE-UZLBHIALSA-N	0	3	328.456	3.129	20	30		EGEDHN
C#CCN1C[C@@H](CNC(=O)c2cc3cccc(C)c3s2)[C@H](C)C1	ZINC001092743396	1361450547	/nfs/dbraw/zinc/45/05/47/1361450547.db2.gz	SPHICUGFYOGLSC-GDBMZVCRSA-N	0	3	326.465	3.141	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@]2(C)C=CCC2)CC1	ZINC001093377084	1361587969	/nfs/dbraw/zinc/58/79/69/1361587969.db2.gz	PVAXTCMHIYMATC-AZUAARDMSA-N	0	3	326.484	3.069	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)[C@@H]2C[C@H]2CC(C)C)CC1	ZINC001093379738	1361590662	/nfs/dbraw/zinc/59/06/62/1361590662.db2.gz	HMRXIKYZPWFMBO-AQNXPRMDSA-N	0	3	342.527	3.395	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cc(C)ccc3C3CC3)CCC[C@@H]12	ZINC001094477917	1361820625	/nfs/dbraw/zinc/82/06/25/1361820625.db2.gz	DTSGNWFRWKLKCB-IFMALSPDSA-N	0	3	336.479	3.480	20	30		EGEDHN
C#CCN1CC[C@@]2(CNC(=O)c3cc(C(C)C)oc3C)CCC[C@@H]12	ZINC001094549519	1361854281	/nfs/dbraw/zinc/85/42/81/1361854281.db2.gz	INWHRUKJAKNHOE-UYAOXDASSA-N	0	3	328.456	3.319	20	30		EGEDHN
Cc1cc(C)cc(CN2[C@@H]3CC[C@H]2[C@@H](NC(=O)c2cc(C#N)c[nH]2)C3)c1	ZINC001095281766	1362082070	/nfs/dbraw/zinc/08/20/70/1362082070.db2.gz	FJXBIIIACZRHNL-HBFSDRIKSA-N	0	3	348.450	3.039	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C1C3CC4CC(C3)CC1C4)C2	ZINC001095537006	1362164395	/nfs/dbraw/zinc/16/43/95/1362164395.db2.gz	QOBUJIUKVPJZHJ-WMXMQJIWSA-N	0	3	328.500	3.356	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cccc3ccc(C)nc31)C2	ZINC001095595123	1362179573	/nfs/dbraw/zinc/17/95/73/1362179573.db2.gz	WYSYXFXYWHIMLU-NEWSRXKRSA-N	0	3	335.451	3.454	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C1([C@H]3CCCCO3)CCC1)C2	ZINC001095748343	1362220201	/nfs/dbraw/zinc/22/02/01/1362220201.db2.gz	ASCNAJVLSBGYKF-VSZNYVQBSA-N	0	3	332.488	3.023	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H]1CCCc3sc(C)nc31)C2	ZINC001096328678	1362463996	/nfs/dbraw/zinc/46/39/96/1362463996.db2.gz	HWEPVECRHYNFQA-UGUYLWEFSA-N	0	3	345.512	3.169	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@@H](CNCc2csc(C)n2)[C@H](C)C1	ZINC001184967830	1387575481	/nfs/dbraw/zinc/57/54/81/1387575481.db2.gz	MBJSWJRDWSOEDF-WBVHZDCISA-N	0	3	347.528	3.219	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CC13CC4CC(CC(C4)C1)C3)C2	ZINC001096415115	1362498745	/nfs/dbraw/zinc/49/87/45/1362498745.db2.gz	YELJQQYFRVJHIS-MEJBHDTGSA-N	0	3	340.511	3.338	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cccc3oc(C)nc31)C2	ZINC001096626794	1362605317	/nfs/dbraw/zinc/60/53/17/1362605317.db2.gz	HPAYRFVHCHVZHH-KBMXLJTQSA-N	0	3	325.412	3.047	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H]1[C@@H](c3ccccc3)C1(C)C)C2	ZINC001097085605	1362836616	/nfs/dbraw/zinc/83/66/16/1362836616.db2.gz	JZPNXKHTWDLUKE-OBKDMQGPSA-N	0	3	336.479	3.171	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCc1ccccc1	ZINC001097222802	1362892425	/nfs/dbraw/zinc/89/24/25/1362892425.db2.gz	MJZGQBDNHKQOJO-AQNXPRMDSA-N	0	3	349.478	3.252	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(OCC)c(C)c1)C2	ZINC001097965801	1363182435	/nfs/dbraw/zinc/18/24/35/1363182435.db2.gz	PGNSHGMEBSCTHT-KURKYZTESA-N	0	3	328.456	3.305	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1coc(C3CCCC3)n1)C2	ZINC001098125130	1363228179	/nfs/dbraw/zinc/22/81/79/1363228179.db2.gz	YAIZXMXCMQNOSB-INMHGKMJSA-N	0	3	329.444	3.243	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc(O[C@H](C)CC)cc1)C2	ZINC001098167403	1363241954	/nfs/dbraw/zinc/24/19/54/1363241954.db2.gz	ZCLMPEFKVLHLFW-QOJCHSLYSA-N	0	3	340.467	3.222	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@@H](CNCc3ocnc3C)[C@H](C)C2)CC1	ZINC001185094492	1387617451	/nfs/dbraw/zinc/61/74/51/1387617451.db2.gz	JHLRCMXJOLVKBR-WBVHZDCISA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccc(C=C)cc1)C[C@H](C)O2	ZINC001098635666	1363409316	/nfs/dbraw/zinc/40/93/16/1363409316.db2.gz	PDFNEDJAJKTVMW-KRWDZBQOSA-N	0	3	340.467	3.211	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccc(C)cc1F)C[C@H](C)O2	ZINC001098643074	1363413649	/nfs/dbraw/zinc/41/36/49/1363413649.db2.gz	RWUAIFMDVPGPAY-INIZCTEOSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@H](C)c1ccco1)C[C@@H](C)O2	ZINC001098657198	1363422180	/nfs/dbraw/zinc/42/21/80/1363422180.db2.gz	YZJWIRYOUCUGAF-DLBZAZTESA-N	0	3	346.471	3.041	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccoc1C	ZINC001098887877	1363505363	/nfs/dbraw/zinc/50/53/63/1363505363.db2.gz	ILCQSGJUMSJFOI-INIZCTEOSA-N	0	3	334.460	3.011	20	30		EGEDHN
CC(C)OCCN1CC(C)(C)CC[C@H]1CNC(=O)C#CC(C)(C)C	ZINC001099069615	1363606018	/nfs/dbraw/zinc/60/60/18/1363606018.db2.gz	JYDRIILIALKSPL-KRWDZBQOSA-N	0	3	336.520	3.068	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCC[C@]2(NC(=O)c2sccc2COC)C1	ZINC001099118802	1363633868	/nfs/dbraw/zinc/63/38/68/1363633868.db2.gz	CGLNXWZHHPFAHN-YJBOKZPZSA-N	0	3	334.485	3.055	20	30		EGEDHN
C=CCN1C[C@@H]2CCC[C@]2(NC(=O)[C@@H]2CCCc3sc(C)nc32)C1	ZINC001099118389	1363634058	/nfs/dbraw/zinc/63/40/58/1363634058.db2.gz	ZNXPHZWNQYXXDA-KHYOSLBOSA-N	0	3	345.512	3.028	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)CCC(C)(F)F	ZINC001099125358	1363637623	/nfs/dbraw/zinc/63/76/23/1363637623.db2.gz	FJUKFQQRJRYEJA-OAHLLOKOSA-N	0	3	346.462	3.231	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)C(C)(C)c1cccnc1	ZINC001099130007	1363641686	/nfs/dbraw/zinc/64/16/86/1363641686.db2.gz	GGUFKJRNSULDRC-KRWDZBQOSA-N	0	3	329.488	3.152	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)Cc1ccc(C)c(OC)c1	ZINC001099134849	1363645901	/nfs/dbraw/zinc/64/59/01/1363645901.db2.gz	DOFQZRYENYRJBP-GOSISDBHSA-N	0	3	344.499	3.339	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@H](C)CC(F)F	ZINC001099145252	1363653767	/nfs/dbraw/zinc/65/37/67/1363653767.db2.gz	VUYACPMFBMAWGP-CABCVRRESA-N	0	3	346.462	3.087	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@@H]1CCC(C)(C)CN1CCOCC=C	ZINC001099170927	1363669435	/nfs/dbraw/zinc/66/94/35/1363669435.db2.gz	LSTOOSLWXXAAHV-IBGZPJMESA-N	0	3	348.531	3.380	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)[C@@H](CC)OC1CCCC1	ZINC001099251458	1363713987	/nfs/dbraw/zinc/71/39/87/1363713987.db2.gz	JZXIXOYPEVZJQU-PKOBYXMFSA-N	0	3	348.531	3.354	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)[C@H](C)c1c(C)noc1C	ZINC001099271354	1363725493	/nfs/dbraw/zinc/72/54/93/1363725493.db2.gz	XCUHKNJFCOAVLA-CJNGLKHVSA-N	0	3	333.476	3.188	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)C1(CC)CCOCC1	ZINC001099290836	1363734476	/nfs/dbraw/zinc/73/44/76/1363734476.db2.gz	BPFIPRDWSCKNAI-KRWDZBQOSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)c2ccsc2Cl)C[C@H]1C(F)(F)F	ZINC001099317775	1363746622	/nfs/dbraw/zinc/74/66/22/1363746622.db2.gz	PBAVEPXQUKPCPT-NXEZZACHSA-N	0	3	338.782	3.180	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)[C@@H](C)c2ccc(C)s2)C[C@H]1C(F)(F)F	ZINC001099332716	1363754998	/nfs/dbraw/zinc/75/49/98/1363754998.db2.gz	JCQPPFUGILFWGN-YNEHKIRRSA-N	0	3	346.418	3.325	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)CCc2ccccc2)C[C@H]1C(F)(F)F	ZINC001099336180	1363757775	/nfs/dbraw/zinc/75/77/75/1363757775.db2.gz	FINSUZWVGMPONZ-HZPDHXFCSA-N	0	3	340.389	3.174	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)CCc2cccs2)C[C@H]1C(F)(F)F	ZINC001099338621	1363759155	/nfs/dbraw/zinc/75/91/55/1363759155.db2.gz	HUSOAJGFAJGEOW-ZIAGYGMSSA-N	0	3	346.418	3.236	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)CSCCC	ZINC001099424853	1363794231	/nfs/dbraw/zinc/79/42/31/1363794231.db2.gz	MFVONZNFBXTGGY-FZKCQIBNSA-N	0	3	342.936	3.051	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@H]1CC[C@@H]2N(C(=O)CSC(C)C)C1	ZINC001099425346	1363795018	/nfs/dbraw/zinc/79/50/18/1363795018.db2.gz	QOGMPPZUUACJEB-VGWMRTNUSA-N	0	3	342.936	3.049	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2nccs2)C1	ZINC001099474452	1363810891	/nfs/dbraw/zinc/81/08/91/1363810891.db2.gz	SVIPIGRHVCCTCF-KXBFYZLASA-N	0	3	347.528	3.464	20	30		EGEDHN
N#Cc1ccccc1CNC[C@]12CCC[C@H]1CN(C(=O)[C@H]1CC13CC3)C2	ZINC001099506074	1363824602	/nfs/dbraw/zinc/82/46/02/1363824602.db2.gz	LEHZIYWQEMXEPL-JQVVWYNYSA-N	0	3	349.478	3.077	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@H](C1)[C@@H]1CC[C@H]2CN1C(=O)CCCC1CC1	ZINC001099513347	1363828496	/nfs/dbraw/zinc/82/84/96/1363828496.db2.gz	OIIKJGANARKLFF-MHORFTMASA-N	0	3	336.907	3.488	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C[C@@H](C)CCC)CC2(CCOCC2)C1	ZINC001099572310	1363856816	/nfs/dbraw/zinc/85/68/16/1363856816.db2.gz	VCRPIVNTNDKZDK-ZWKOTPCHSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)[C@@H](C)CC(C)(C)C)CC2(CCOCC2)C1	ZINC001099592667	1363874310	/nfs/dbraw/zinc/87/43/10/1363874310.db2.gz	HPPVQMGGQTUMKU-IRXDYDNUSA-N	0	3	336.520	3.232	20	30		EGEDHN
CCCCCCCCCCC(=O)N[C@H]1CCN(CCCF)C[C@@H]1O	ZINC001100083620	1364011788	/nfs/dbraw/zinc/01/17/88/1364011788.db2.gz	UTWXLNGLQGHGNO-ROUUACIJSA-N	0	3	344.515	3.428	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)C[C@H](C)CCC)C1	ZINC001100175884	1364036249	/nfs/dbraw/zinc/03/62/49/1364036249.db2.gz	UDUKTEVXDUZWJG-LMWSTFAQSA-N	0	3	331.298	3.206	20	30		EGEDHN
C=CCCC(=O)NCC1CC(NCc2cc(-c3ccccc3)no2)C1	ZINC001100177172	1364037032	/nfs/dbraw/zinc/03/70/32/1364037032.db2.gz	XHWQOCMGOQVSLX-UHFFFAOYSA-N	0	3	339.439	3.292	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](CNCc2cc(C)no2)[C@H](C)C1	ZINC001185223911	1387656141	/nfs/dbraw/zinc/65/61/41/1387656141.db2.gz	BLZQHFPAZOGJPE-ZBFHGGJFSA-N	0	3	333.476	3.160	20	30		EGEDHN
C[C@H](NC1CC(CNC(=O)C#CC2CC2)C1)c1ccccc1Cl	ZINC001100316168	1364077645	/nfs/dbraw/zinc/07/76/45/1364077645.db2.gz	WNMRRBIABIPPOD-JEYLPNPQSA-N	0	3	330.859	3.299	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCC1CC(NCc2oc(CC)nc2C)C1	ZINC001100367543	1364094149	/nfs/dbraw/zinc/09/41/49/1364094149.db2.gz	MYUYTUMAGMMYGA-UHFFFAOYSA-N	0	3	333.476	3.132	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)C2(Cc3ccccc3)CC2)C1	ZINC001100415225	1364107057	/nfs/dbraw/zinc/10/70/57/1364107057.db2.gz	FVHUOIITAMSSQW-UHFFFAOYSA-N	0	3	332.875	3.246	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)Cc2cccc(C(F)F)c2)C1	ZINC001100503881	1364138871	/nfs/dbraw/zinc/13/88/71/1364138871.db2.gz	ZYPQGNMUMILMDZ-UHFFFAOYSA-N	0	3	342.817	3.404	20	30		EGEDHN
O=C(CCCC1CC1)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100593224	1364178780	/nfs/dbraw/zinc/17/87/80/1364178780.db2.gz	AOUVLKDCIFIERD-UHFFFAOYSA-N	0	3	342.458	3.242	20	30		EGEDHN
CCCC(C)(C)C(=O)NCC1CC(NCC#Cc2ccc(F)cc2)C1	ZINC001100625786	1364194784	/nfs/dbraw/zinc/19/47/84/1364194784.db2.gz	XKGROAYCLSMOCJ-UHFFFAOYSA-N	0	3	344.474	3.488	20	30		EGEDHN
CC1(C(=O)NCC2CC(NCC#Cc3ccccc3)C2)CCCCC1	ZINC001100638458	1364199226	/nfs/dbraw/zinc/19/92/26/1364199226.db2.gz	MCBQBHCOQGPYMA-UHFFFAOYSA-N	0	3	338.495	3.493	20	30		EGEDHN
CC(C)(C)C(=O)NCC1CC(NCC#Cc2ccc(Cl)cc2)C1	ZINC001100901978	1364322678	/nfs/dbraw/zinc/32/26/78/1364322678.db2.gz	YHVBQDLGXGZZFD-UHFFFAOYSA-N	0	3	332.875	3.222	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)C(C)(CC)CC)C1	ZINC001101004817	1364367302	/nfs/dbraw/zinc/36/73/02/1364367302.db2.gz	KASSOQVCTJYQFQ-UHFFFAOYSA-N	0	3	331.298	3.206	20	30		EGEDHN
C=C[C@@H](C(=O)NCC1CC(NCc2ccccn2)C1)c1ccccc1	ZINC001101017232	1364375932	/nfs/dbraw/zinc/37/59/32/1364375932.db2.gz	ZGYLAWZTXZTFEX-RRWXTXHCSA-N	0	3	335.451	3.036	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C/C=C\c3cccc(F)c3)C[C@]2(C)C1	ZINC001101270445	1364493662	/nfs/dbraw/zinc/49/36/62/1364493662.db2.gz	NZMBTAYTQGCGIM-GKPQXDKRSA-N	0	3	340.442	3.033	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@H]2CN(Cc3oc(C)nc3C)C[C@@]2(C)C1	ZINC001101378964	1364535677	/nfs/dbraw/zinc/53/56/77/1364535677.db2.gz	OPHSFVPGEQJQCU-UZLBHIALSA-N	0	3	345.487	3.174	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@H]3CN(CC#CC)C[C@@]3(C)C2)CCCCC1	ZINC001101471403	1364574657	/nfs/dbraw/zinc/57/46/57/1364574657.db2.gz	PIVYDOJBVXGQBY-QUCCMNQESA-N	0	3	328.500	3.317	20	30		EGEDHN
C=CCC[NH2+]CC(C)(C)C1CCN(C(=O)c2ccccc2[O-])CC1	ZINC001101511916	1364591606	/nfs/dbraw/zinc/59/16/06/1364591606.db2.gz	YMNVTTPMGOZVKQ-UHFFFAOYSA-N	0	3	330.472	3.436	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CCC(C(C)(C)CNCc2ccon2)CC1	ZINC001101539524	1364606378	/nfs/dbraw/zinc/60/63/78/1364606378.db2.gz	WDWGRIKKHCTGCC-UHFFFAOYSA-N	0	3	345.487	3.079	20	30		EGEDHN
C=CCC[C@H](C)N1CC2(C1)C[C@@H](NC(=O)/C(C)=C\CC)c1nccn12	ZINC001101613834	1364656237	/nfs/dbraw/zinc/65/62/37/1364656237.db2.gz	JBBFDVSDCOIHDH-IFORROHYSA-N	0	3	342.487	3.166	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1CC2(CN(C[C@H](C)CC)C2)n2ccnc21	ZINC001101635213	1364663642	/nfs/dbraw/zinc/66/36/42/1364663642.db2.gz	CVHDSLAKZRFNLZ-CVEARBPZSA-N	0	3	344.503	3.103	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CC2(CN(CC(CC)CC)C2)n2ccnc21	ZINC001101640002	1364666576	/nfs/dbraw/zinc/66/65/76/1364666576.db2.gz	STWBZDCUTYEJOP-MRXNPFEDSA-N	0	3	344.503	3.103	20	30		EGEDHN
CC(C)CC(=O)NC[C@@H]1CN(CC#Cc2ccc(Cl)cc2)C[C@H]1C	ZINC001101687165	1364688745	/nfs/dbraw/zinc/68/87/45/1364688745.db2.gz	AAFIFDSOLRWJDD-SJLPKXTDSA-N	0	3	346.902	3.422	20	30		EGEDHN
CCCCCC(=O)NC[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1C	ZINC001101723317	1364703760	/nfs/dbraw/zinc/70/37/60/1364703760.db2.gz	WTXNIRHWSIQSOX-IEBWSBKVSA-N	0	3	344.474	3.442	20	30		EGEDHN
C[C@H](c1ccccc1Cl)N1C[C@@H](CNC(=O)C#CC2CC2)[C@H](C)C1	ZINC001101953963	1364789354	/nfs/dbraw/zinc/78/93/54/1364789354.db2.gz	LRVITRMOZCTXSL-BFYDXBDKSA-N	0	3	344.886	3.499	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NC[C@@H]1CN(Cc2ccccn2)C[C@H]1C	ZINC001102002294	1364807908	/nfs/dbraw/zinc/80/79/08/1364807908.db2.gz	BLSJUFMQACJPDJ-UKRRQHHQSA-N	0	3	335.879	3.044	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H]1CN(Cc2cc(C)ns2)C[C@H]1C	ZINC001102221623	1364941936	/nfs/dbraw/zinc/94/19/36/1364941936.db2.gz	YMDIJHMIPPTUIH-UKRRQHHQSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1C	ZINC001102262716	1364974809	/nfs/dbraw/zinc/97/48/09/1364974809.db2.gz	JHBKAFZTUQICFH-OWCLPIDISA-N	0	3	345.512	3.406	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NC[C@@H]1CN(Cc2cc(C)ns2)C[C@H]1C	ZINC001102263078	1364975526	/nfs/dbraw/zinc/97/55/26/1364975526.db2.gz	UZKVHFQDYCLBPV-VNQPRFMTSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@@H]1CN(Cc2c(C)onc2CC)C[C@H]1C	ZINC001102263064	1364975742	/nfs/dbraw/zinc/97/57/42/1364975742.db2.gz	UGYQLIWGUBFUHW-DJIMGWMZSA-N	0	3	347.503	3.332	20	30		EGEDHN
C=CCC1(C(=O)NC[C@@H]2CN(Cc3cc(C)ns3)C[C@H]2C)CCC1	ZINC001102331871	1365006118	/nfs/dbraw/zinc/00/61/18/1365006118.db2.gz	WNMNDQMWYIKPIY-GDBMZVCRSA-N	0	3	347.528	3.382	20	30		EGEDHN
C=CC[C@@H](Cc1ccccc1)C(=O)NC[C@@H]1CN(CCF)C[C@H]1C	ZINC001102592006	1365128586	/nfs/dbraw/zinc/12/85/86/1365128586.db2.gz	ISMUBQFCONTPJU-NZSAHSFTSA-N	0	3	332.463	3.075	20	30		EGEDHN
CC[C@@H](C)C(=O)NCC[C@@H]1CN(Cc2ccc(C#N)cc2F)C[C@H]1C	ZINC001102680103	1365167336	/nfs/dbraw/zinc/16/73/36/1365167336.db2.gz	WEVGSVSJXLTVKT-BFYDXBDKSA-N	0	3	345.462	3.318	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CCNC(=O)[C@H]1CC1(C)C	ZINC001102869953	1365261685	/nfs/dbraw/zinc/26/16/85/1365261685.db2.gz	NWVMDFHEJZORDV-CKEIUWERSA-N	0	3	345.512	3.240	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)C[C@@H](C)c2ccncc2)C1	ZINC001103138681	1365402940	/nfs/dbraw/zinc/40/29/40/1365402940.db2.gz	YHBWOOJJTDHSCS-IIDMSEBBSA-N	0	3	349.906	3.402	20	30		EGEDHN
C#CCOCCN(C)CCC(C#N)(c1ccccc1)c1ccccc1	ZINC001324694361	1387740742	/nfs/dbraw/zinc/74/07/42/1387740742.db2.gz	CCBNXXHBMXHTGS-UHFFFAOYSA-N	0	3	332.447	3.468	20	30		EGEDHN
C=CCCCC(=O)NCC[C@@H]1CN(Cc2ccccc2C#N)C[C@H]1C	ZINC001103382316	1365527211	/nfs/dbraw/zinc/52/72/11/1365527211.db2.gz	FETGBGQPRGFMAK-IEBWSBKVSA-N	0	3	339.483	3.489	20	30		EGEDHN
C=CCC1(C(=O)NCC[C@@H]2CN(Cc3ccns3)C[C@H]2C)CCC1	ZINC001103404522	1365540157	/nfs/dbraw/zinc/54/01/57/1365540157.db2.gz	LWYRJKRGDQYDSS-HZPDHXFCSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC[C@@H]2CN([C@@H](C)c3ncc(C)o3)C[C@H]2C)C1	ZINC001103418626	1365549524	/nfs/dbraw/zinc/54/95/24/1365549524.db2.gz	RHHWOTCPLVYDFX-HYVNUMGLSA-N	0	3	345.487	3.475	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)[C@@H](C)Cc2ccco2)C1	ZINC001103523768	1365612320	/nfs/dbraw/zinc/61/23/20/1365612320.db2.gz	LEXBYQCLTHJJHY-SQWLQELKSA-N	0	3	338.879	3.285	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)s2)C[C@H]1CCNC(=O)C(C)(C)C	ZINC001103667538	1365715586	/nfs/dbraw/zinc/71/55/86/1365715586.db2.gz	APFJCQQFBAVWNX-ZIAGYGMSSA-N	0	3	333.501	3.240	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)C(=O)NCC[C@@H]1CN(CCF)C[C@H]1C	ZINC001103744881	1365760439	/nfs/dbraw/zinc/76/04/39/1365760439.db2.gz	XNYHVDBXKDNLST-MISYRCLQSA-N	0	3	346.490	3.465	20	30		EGEDHN
C#CC[C@H](CC(=O)NCC[C@@H]1CN(CCF)C[C@H]1C)c1ccccc1	ZINC001103784740	1365782631	/nfs/dbraw/zinc/78/26/31/1365782631.db2.gz	NRNIOKPJPFSRGN-MISYRCLQSA-N	0	3	344.474	3.227	20	30		EGEDHN
C#CCCCCCC(=O)N1C[C@@H](C)[C@H](CCNCc2cnoc2C)C1	ZINC001104495656	1366048582	/nfs/dbraw/zinc/04/85/82/1366048582.db2.gz	UTWZPXODZXWKBG-SJLPKXTDSA-N	0	3	345.487	3.141	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1C[C@@H](C)[C@H](CCNCc2cnoc2C)C1	ZINC001104563249	1366078382	/nfs/dbraw/zinc/07/83/82/1366078382.db2.gz	KKHVMOSMEWLNHS-DJIMGWMZSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)Cc2ccc(CC)cn2)C[C@H]1C	ZINC001104703465	1366137657	/nfs/dbraw/zinc/13/76/57/1366137657.db2.gz	CBDNXDVTHIRKIY-RHSMWYFYSA-N	0	3	349.906	3.013	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H](C)[C@H](CCNCc2cnoc2C)C1	ZINC001104731293	1366148584	/nfs/dbraw/zinc/14/85/84/1366148584.db2.gz	ANVJUHPZNSFWOB-GDBMZVCRSA-N	0	3	333.476	3.160	20	30		EGEDHN
CC[C@@H](F)CN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C#CC(C)C)CC1	ZINC001105392055	1366440603	/nfs/dbraw/zinc/44/06/03/1366440603.db2.gz	RJYDARZPOFBPSN-QUCCMNQESA-N	0	3	348.506	3.487	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1C[C@@H](CNCc2cc(F)ccc2C#N)[C@H](C)C1	ZINC001105958300	1366602163	/nfs/dbraw/zinc/60/21/63/1366602163.db2.gz	ANQFBTDFFKGUJJ-IIDMSEBBSA-N	0	3	345.462	3.318	20	30		EGEDHN
C#CCC1(C(=O)N2C[C@@H](CNC/C(Cl)=C/Cl)[C@H](C)C2)CCC1	ZINC001106236143	1366631259	/nfs/dbraw/zinc/63/12/59/1366631259.db2.gz	BLQQTYBDASVQAK-XPWVWULPSA-N	0	3	343.298	3.183	20	30		EGEDHN
CC(C)(F)C(=O)NC[C@]12CCC[C@H]1N(CC#Cc1ccccc1)CC2	ZINC001107258565	1366906865	/nfs/dbraw/zinc/90/68/65/1366906865.db2.gz	QTWUWUOZMZWEAH-WIYYLYMNSA-N	0	3	342.458	3.147	20	30		EGEDHN
CCCC[C@H](CC)C(=O)NC[C@]12CCC[C@H]1N(CC#CCOC)CC2	ZINC001107295863	1366920378	/nfs/dbraw/zinc/92/03/78/1366920378.db2.gz	AGRGGKJXNUQJHF-QKNQBKEWSA-N	0	3	348.531	3.213	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@]12CCC[C@H]1N(Cc1cc(C)no1)CC2	ZINC001107422731	1366960018	/nfs/dbraw/zinc/96/00/18/1366960018.db2.gz	LSRZXOJIIQOUJT-IEBWSBKVSA-N	0	3	331.460	3.200	20	30		EGEDHN
CCC[C@H](C)CC(=O)N1CC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001189281031	1366975905	/nfs/dbraw/zinc/97/59/05/1366975905.db2.gz	WSXCJMFWUPCJPW-LPHOPBHVSA-N	0	3	327.472	3.417	20	30		EGEDHN
CCCCCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1nccc(C)n1)C2	ZINC001109216894	1367009027	/nfs/dbraw/zinc/00/90/27/1367009027.db2.gz	CZDTYIAGXLETOG-IKGGRYGDSA-N	0	3	330.476	3.091	20	30		EGEDHN
CC#CCCCC(=O)NC[C@]12CCC[C@H]1N(Cc1cc(C)no1)CC2	ZINC001107512776	1367011468	/nfs/dbraw/zinc/01/14/68/1367011468.db2.gz	HUJSERRNJDLTFO-UYAOXDASSA-N	0	3	343.471	3.037	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC[C@]12CCC[C@H]1N(Cc1conc1C)CC2	ZINC001107514501	1367013064	/nfs/dbraw/zinc/01/30/64/1367013064.db2.gz	JKTORHZGIGEWSO-QKYXUNIQSA-N	0	3	345.487	3.446	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@]12CCC[C@H]1N(Cc1cc(C)no1)CC2	ZINC001107515578	1367014099	/nfs/dbraw/zinc/01/40/99/1367014099.db2.gz	YIBBYWDNDAZMNV-YVWKXTFCSA-N	0	3	345.487	3.446	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)[C@H](C)CCCCCC)[C@@H]2C1	ZINC001189506773	1367038881	/nfs/dbraw/zinc/03/88/81/1367038881.db2.gz	IEGJVWNXDCNYBZ-CEXWTWQISA-N	0	3	336.520	3.328	20	30		EGEDHN
CCC(=CC(=O)N1CC[C@H](N(C)Cc2cccc(C#N)c2)C1)CC	ZINC001189631878	1367074376	/nfs/dbraw/zinc/07/43/76/1367074376.db2.gz	KXCCSHNJICYWHO-IBGZPJMESA-N	0	3	325.456	3.337	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](N(C)CCc2c(F)cccc2F)C1	ZINC001189744464	1367100594	/nfs/dbraw/zinc/10/05/94/1367100594.db2.gz	TUQNUDRNQWCKQO-MRXNPFEDSA-N	0	3	348.437	3.234	20	30		EGEDHN
C=CCCCCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1onc(C)c1C)C2	ZINC001109434415	1367119341	/nfs/dbraw/zinc/11/93/41/1367119341.db2.gz	PADUOXLJFRLIAX-IKGGRYGDSA-N	0	3	331.460	3.373	20	30		EGEDHN
CCCC[C@@H](C)C(=O)N1CC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001189972179	1367143190	/nfs/dbraw/zinc/14/31/90/1367143190.db2.gz	FYBWAZSVQOJLNO-VQIMIIECSA-N	0	3	327.472	3.417	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2cscc2C)C1	ZINC001107850966	1367174497	/nfs/dbraw/zinc/17/44/97/1367174497.db2.gz	USOMBUQPQALPLU-MAUKXSAKSA-N	0	3	336.501	3.232	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@@H](N(C)CCc2csc(C)n2)C1	ZINC001190395980	1367251586	/nfs/dbraw/zinc/25/15/86/1367251586.db2.gz	CHTWAWREZFFJQL-MRXNPFEDSA-N	0	3	335.517	3.129	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCOCc1ccccc1	ZINC001109658147	1367267158	/nfs/dbraw/zinc/26/71/58/1367267158.db2.gz	SZZOBZGICMCUJF-AABGKKOBSA-N	0	3	342.483	3.281	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H]2C[C@H]3CC[C@@H]2N3C[C@@H]2CCCCO2)CC1	ZINC001109681621	1367279862	/nfs/dbraw/zinc/27/98/62/1367279862.db2.gz	BHGXKUVIJLDHES-OWSLCNJRSA-N	0	3	332.488	3.023	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)c2ccccc2C(C)C)C1	ZINC001190522035	1367285267	/nfs/dbraw/zinc/28/52/67/1367285267.db2.gz	ZQHZNGPYLZHDHE-QGZVFWFLSA-N	0	3	330.472	3.159	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](C)Cc1ccccc1F)C2	ZINC001109718423	1367292029	/nfs/dbraw/zinc/29/20/29/1367292029.db2.gz	HBLITCVNPGAPJL-JZGRTCEGSA-N	0	3	330.447	3.302	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@]2(C)CN(C[C@H](C)CC(C)C)CCO2)C1	ZINC001108201822	1367340306	/nfs/dbraw/zinc/34/03/06/1367340306.db2.gz	SHOWTGBJYBQYJK-UZLBHIALSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)c2cc(C)cc(F)c2)C1	ZINC001108236913	1367354539	/nfs/dbraw/zinc/35/45/39/1367354539.db2.gz	UFUKISHONXGFFV-UZLBHIALSA-N	0	3	348.462	3.310	20	30		EGEDHN
C=CCC[C@@H](C)N1CCO[C@@](C)(CNC(=O)C2(F)CCCCC2)C1	ZINC001108322625	1367390497	/nfs/dbraw/zinc/39/04/97/1367390497.db2.gz	AGAWDXRPOKLQSS-AEFFLSMTSA-N	0	3	340.483	3.221	20	30		EGEDHN
C=C(Cl)CN[C@H]1CCCO[C@H]1C1CCN(C(=O)CCCC)CC1	ZINC001186114850	1387873671	/nfs/dbraw/zinc/87/36/71/1387873671.db2.gz	QAGSWJGXCBJCNM-WMZOPIPTSA-N	0	3	342.911	3.305	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2[C@@H](C)c1ccccc1	ZINC001110182091	1367550608	/nfs/dbraw/zinc/55/06/08/1367550608.db2.gz	VXBKGJXVPOYIRF-NQYYFHDYSA-N	0	3	328.456	3.062	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1cc(C)cc(C)c1	ZINC001110182982	1367551898	/nfs/dbraw/zinc/55/18/98/1367551898.db2.gz	HDIGWFYJCAPOKZ-RNQOJCNYSA-N	0	3	342.483	3.116	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CN([C@H](C)c2ccc3ccccc3c2)C[C@H]1O	ZINC001191652041	1367554325	/nfs/dbraw/zinc/55/43/25/1367554325.db2.gz	NCRFLNZHVBBKEV-CDHQVMDDSA-N	0	3	338.451	3.028	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H](C)Cc1cccc(F)c1)C2	ZINC001110188755	1367556480	/nfs/dbraw/zinc/55/64/80/1367556480.db2.gz	PFXZPTZYECTOMC-OAOYMFHYSA-N	0	3	330.447	3.302	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001191753617	1367577376	/nfs/dbraw/zinc/57/73/76/1367577376.db2.gz	FQGSSCHFUBRRQK-HXUWFJFHSA-N	0	3	337.467	3.175	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC[C@H](N(C)CCOc2ccccc2F)C1	ZINC001191889749	1367627097	/nfs/dbraw/zinc/62/70/97/1367627097.db2.gz	JRZHOLKQGTXOHQ-IRXDYDNUSA-N	0	3	348.462	3.340	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](N(C)Cc3ccc(OC)cc3)C2)CCC1	ZINC001192217875	1367720173	/nfs/dbraw/zinc/72/01/73/1367720173.db2.gz	LGQOPINWQYVMGQ-SFHVURJKSA-N	0	3	342.483	3.474	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1ccccc1C	ZINC001109038184	1367734468	/nfs/dbraw/zinc/73/44/68/1367734468.db2.gz	MYFJLTUMXIAYOC-LMCOJAPRSA-N	0	3	342.483	3.198	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)CC/C=C\c2ccccc2)C1	ZINC001192326867	1367753707	/nfs/dbraw/zinc/75/37/07/1367753707.db2.gz	UBCWDIGZEFCPTA-QRGKHIHXSA-N	0	3	342.483	3.215	20	30		EGEDHN
C[C@@H](C#N)C(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCCc1ccc(Cl)cc1	ZINC001109088076	1367760978	/nfs/dbraw/zinc/76/09/78/1367760978.db2.gz	HTHLTRHYMKGHLG-NBMRYCAZSA-N	0	3	345.874	3.154	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001192585713	1367825055	/nfs/dbraw/zinc/82/50/55/1367825055.db2.gz	AHKZIKGLNANLFN-GOSISDBHSA-N	0	3	325.456	3.193	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)C[C@H](C)c2ccccc2C)C1	ZINC001192640724	1367839056	/nfs/dbraw/zinc/83/90/56/1367839056.db2.gz	FEUCNWSRSJHQEJ-RBUKOAKNSA-N	0	3	344.499	3.224	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)[C@@H](CC)CC2CCCC2)C1	ZINC001192657699	1367843749	/nfs/dbraw/zinc/84/37/49/1367843749.db2.gz	ZHBNQWYTTCEZHV-OALUTQOASA-N	0	3	336.520	3.328	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)CCOc1ccc(C)cc1C)C2	ZINC001110630476	1367876329	/nfs/dbraw/zinc/87/63/29/1367876329.db2.gz	DTKDCKPVYWLVSS-QRVBRYPASA-N	0	3	342.483	3.370	20	30		EGEDHN
C=CC1(CC(=O)N2CC[C@@H](N(C)CCOC(C)C)C2)CCCCC1	ZINC001192827864	1367884159	/nfs/dbraw/zinc/88/41/59/1367884159.db2.gz	YSWWWKQLHAOVKZ-GOSISDBHSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)C[C@H](C)c2ccccc2F)C1	ZINC001192877721	1367893365	/nfs/dbraw/zinc/89/33/65/1367893365.db2.gz	LKXOWRCQJZCYQS-IRXDYDNUSA-N	0	3	348.462	3.055	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2CCc1scnc1C	ZINC001110967159	1368128041	/nfs/dbraw/zinc/12/80/41/1368128041.db2.gz	VOUGISPHOBXXRU-OAGGEKHMSA-N	0	3	333.501	3.072	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3C[C@@H]2CCCCO2)CCC1	ZINC001110987605	1368134668	/nfs/dbraw/zinc/13/46/68/1368134668.db2.gz	WOOXTZBRYPRMSX-XDNAFOTISA-N	0	3	332.488	3.023	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H]1[C@@H]3CCCCCC[C@@H]31)C2	ZINC001111061724	1368150289	/nfs/dbraw/zinc/15/02/89/1368150289.db2.gz	JJLBFTHWHVNGRV-NADOGSGZSA-N	0	3	346.515	3.127	20	30		EGEDHN
C=C[C@@H](C(=O)N1CC[C@H](N(C)CCOCC(C)C)C1)c1ccccc1	ZINC001194183475	1368202150	/nfs/dbraw/zinc/20/21/50/1368202150.db2.gz	PXLXQNGLNKRDDP-VQTJNVASSA-N	0	3	344.499	3.162	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2ccc(C(C)C)s2)C1	ZINC001194324940	1368231468	/nfs/dbraw/zinc/23/14/68/1368231468.db2.gz	GMYNSQLQGRFGRK-HNNXBMFYSA-N	0	3	336.501	3.220	20	30		EGEDHN
C=CCOCCN(C)[C@@H]1CCN(C(=O)C(CC(C)C)CC(C)C)C1	ZINC001194326937	1368232289	/nfs/dbraw/zinc/23/22/89/1368232289.db2.gz	UQEUCDLPPDRUKV-LJQANCHMSA-N	0	3	338.536	3.430	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1c(C)cc(C)cc1C)C2	ZINC001111362134	1368273052	/nfs/dbraw/zinc/27/30/52/1368273052.db2.gz	OFETWEBGDBDIHY-QRVBRYPASA-N	0	3	342.483	3.150	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C(CC)(CC)c1ccccc1)C2	ZINC001111440298	1368307239	/nfs/dbraw/zinc/30/72/39/1368307239.db2.gz	JGTNUZRWLWHVKO-AQNXPRMDSA-N	0	3	338.495	3.489	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@@H]1CCCC(C)(C)C1)C2	ZINC001111477992	1368316230	/nfs/dbraw/zinc/31/62/30/1368316230.db2.gz	HVSBUPBPQXTYPO-TVFCKZIOSA-N	0	3	334.504	3.127	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1ccccc1CC	ZINC001111482930	1368318932	/nfs/dbraw/zinc/31/89/32/1368318932.db2.gz	YMCOFMBIUYRCKY-AQNXPRMDSA-N	0	3	342.483	3.063	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H](C)Cc1cccc(F)c1)C2	ZINC001111495216	1368321672	/nfs/dbraw/zinc/32/16/72/1368321672.db2.gz	PFXZPTZYECTOMC-AXUOBQJMSA-N	0	3	330.447	3.302	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C1(CCc3ccccc3)CC1)C2	ZINC001111527334	1368325475	/nfs/dbraw/zinc/32/54/75/1368325475.db2.gz	ADNYTTZICKWFPK-AQNXPRMDSA-N	0	3	336.479	3.144	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1(CC=C)CCC1)C[C@@H](C)O2	ZINC001111548494	1368340946	/nfs/dbraw/zinc/34/09/46/1368340946.db2.gz	FZLXBDGRESRWNH-QGZVFWFLSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C1(CC=C)CCCC1)C[C@H](C)O2	ZINC001111554239	1368345615	/nfs/dbraw/zinc/34/56/15/1368345615.db2.gz	KNBLBBIKSPJIGP-SFHVURJKSA-N	0	3	346.515	3.391	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CCCN([C@@H](C)c2ccccc2)CC1	ZINC001195125371	1368384284	/nfs/dbraw/zinc/38/42/84/1368384284.db2.gz	LATOBUFNMBLFSW-ZWKOTPCHSA-N	0	3	330.472	3.263	20	30		EGEDHN
C=CCCOc1ccc(C(=O)NCCc2cnc3cc[nH]cc2-3)cc1	ZINC001195142754	1368387358	/nfs/dbraw/zinc/38/73/58/1368387358.db2.gz	YNPKJRSESYDLFK-UHFFFAOYSA-N	0	3	335.407	3.490	20	30		EGEDHN
C=CCCOc1ccc(C(=O)NCCc2c[nH]c3ccncc23)cc1	ZINC001195142754	1368387362	/nfs/dbraw/zinc/38/73/62/1368387362.db2.gz	YNPKJRSESYDLFK-UHFFFAOYSA-N	0	3	335.407	3.490	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)C(C)(C)C(C)(C)C)C1	ZINC001195345657	1368425574	/nfs/dbraw/zinc/42/55/74/1368425574.db2.gz	WEANJIOVYFHIGR-HZPDHXFCSA-N	0	3	326.525	3.190	20	30		EGEDHN
O=C(C#CC1CC1)N[C@]12CCC[C@H]1CN(CCCCC(F)(F)F)C2	ZINC001111741016	1368438191	/nfs/dbraw/zinc/43/81/91/1368438191.db2.gz	YLKVLAJUZCOWEF-RDJZCZTQSA-N	0	3	342.405	3.103	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@]12CCC[C@H]1CN(Cc1ncccc1C)C2	ZINC001111850284	1368503889	/nfs/dbraw/zinc/50/38/89/1368503889.db2.gz	IDDMADWEJUWYLJ-LQWHRVPQSA-N	0	3	341.499	3.463	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@]12CCC[C@H]1CN(Cc1cnccc1C)C2	ZINC001111850632	1368504895	/nfs/dbraw/zinc/50/48/95/1368504895.db2.gz	QVVXBBVDCAQVTJ-LMNJBCLMSA-N	0	3	341.499	3.463	20	30		EGEDHN
C=C(C)CCC(=O)N1CCCN(CCc2ccc3c(c2)CCO3)CC1	ZINC001196018591	1368537371	/nfs/dbraw/zinc/53/73/71/1368537371.db2.gz	YPQKVRVAWGQCJC-UHFFFAOYSA-N	0	3	342.483	3.055	20	30		EGEDHN
C=C(C)CN1CCCN(C(=O)CCOc2cccc(C)c2C)CC1	ZINC001196060177	1368541011	/nfs/dbraw/zinc/54/10/11/1368541011.db2.gz	MZDKEKBRHYCUDC-UHFFFAOYSA-N	0	3	330.472	3.183	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cn(C(C)(C)C)nn2)CC1	ZINC001196079587	1368544955	/nfs/dbraw/zinc/54/49/55/1368544955.db2.gz	SZKOOSVJJIOGHU-UHFFFAOYSA-N	0	3	349.523	3.151	20	30		EGEDHN
C=CCC[C@H](C)N1CCCN(C(=O)c2cn3cc(C)nc3s2)CC1	ZINC001196162844	1368559880	/nfs/dbraw/zinc/55/98/80/1368559880.db2.gz	BMJARAUSPCGSGJ-HNNXBMFYSA-N	0	3	346.500	3.207	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cc3c[nH]ccc-3n2)CC1	ZINC001196287481	1368584099	/nfs/dbraw/zinc/58/40/99/1368584099.db2.gz	CXEQTLZWGBMEAO-UHFFFAOYSA-N	0	3	340.471	3.457	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)CCc2ccccc2C)C1	ZINC001196429754	1368612934	/nfs/dbraw/zinc/61/29/34/1368612934.db2.gz	RNAURROGIFRTRU-WOJBJXKFSA-N	0	3	346.515	3.059	20	30		EGEDHN
CCCCCCCN1C[C@@H](O)[C@H](NC(=O)CC2CCCCCC2)C1	ZINC001196452637	1368617786	/nfs/dbraw/zinc/61/77/86/1368617786.db2.gz	KPYOKZSHTQSEAV-RTBURBONSA-N	0	3	338.536	3.479	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N1CCCN(CC/C=C\CCC)CC1	ZINC001196665783	1368658527	/nfs/dbraw/zinc/65/85/27/1368658527.db2.gz	GSPYHAJSULIYHX-ZTBDEIDFSA-N	0	3	336.520	3.496	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)C[C@@H](CC)C(C)(C)C)C[C@H]1C(F)(F)F	ZINC001112192018	1368707090	/nfs/dbraw/zinc/70/70/90/1368707090.db2.gz	FCRQEYNQODCUCL-RBSFLKMASA-N	0	3	346.437	3.451	20	30		EGEDHN
C=CCCC1(C(=O)N2CCCN(C[C@@H](OCC)C3CC3)CC2)CC1	ZINC001197062078	1368737690	/nfs/dbraw/zinc/73/76/90/1368737690.db2.gz	IFKOYJSAKSGMIH-GOSISDBHSA-N	0	3	334.504	3.082	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2ccnc(C3CC3)n2)CC1	ZINC001197308064	1368784007	/nfs/dbraw/zinc/78/40/07/1368784007.db2.gz	JUKYHWLCALTSTI-UHFFFAOYSA-N	0	3	344.503	3.472	20	30		EGEDHN
C=CC1(CC(=O)N2CCCN(CCC[C@@H](C)O)CC2)CCCCC1	ZINC001197440653	1368814734	/nfs/dbraw/zinc/81/47/34/1368814734.db2.gz	JPZVBQYLHTVLAE-GOSISDBHSA-N	0	3	336.520	3.208	20	30		EGEDHN
CCCCCCCN1CCCN(C(=O)c2cnn3c2CCCC3)CC1	ZINC001197691807	1368874361	/nfs/dbraw/zinc/87/43/61/1368874361.db2.gz	ONZPFFGVSKMGEA-UHFFFAOYSA-N	0	3	346.519	3.338	20	30		EGEDHN
C=CCOc1cccnc1C(=O)N1CCCN(CC/C=C/CC)CC1	ZINC001197768466	1368892539	/nfs/dbraw/zinc/89/25/39/1368892539.db2.gz	NZEYKVHZLDNTKW-AATRIKPKSA-N	0	3	343.471	3.151	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H]2CCC[C@]2(CNCc2cnc(C)o2)C1	ZINC001112520970	1368911891	/nfs/dbraw/zinc/91/18/91/1368911891.db2.gz	HODGYBVNJLDMPP-LPHOPBHVSA-N	0	3	331.460	3.058	20	30		EGEDHN
C=CC[C@@H](C(=O)N1CCCN(CCCOCC)CC1)c1ccccc1	ZINC001198197351	1368978991	/nfs/dbraw/zinc/97/89/91/1368978991.db2.gz	LRTNQIQHFXRBQS-HXUWFJFHSA-N	0	3	344.499	3.307	20	30		EGEDHN
O=C(CC#Cc1ccccc1)N1CCCN(CC2=CCCCC2)CC1	ZINC001198213540	1368981650	/nfs/dbraw/zinc/98/16/50/1368981650.db2.gz	DTOMGYHYSLCYTA-UHFFFAOYSA-N	0	3	336.479	3.463	20	30		EGEDHN
C=CCCOCC(=O)N1CCCN([C@@H](C)c2cc(C)ccc2C)CC1	ZINC001198336564	1369010957	/nfs/dbraw/zinc/01/09/57/1369010957.db2.gz	DSWXBHHWKDVKSP-IBGZPJMESA-N	0	3	344.499	3.491	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N1CCCN(Cc2ccccc2C(C)C)CC1	ZINC001198344984	1369013531	/nfs/dbraw/zinc/01/35/31/1369013531.db2.gz	YDJVWENUHISILT-SFHVURJKSA-N	0	3	344.499	3.435	20	30		EGEDHN
C=CCC1(C(=O)N2CCCN(CCC[C@@H]3CCOC3)CC2)CCCC1	ZINC001198423339	1369029255	/nfs/dbraw/zinc/02/92/55/1369029255.db2.gz	NSLQMYVIJXAXOI-LJQANCHMSA-N	0	3	348.531	3.474	20	30		EGEDHN
C=CCCN1CCCN(C(=O)[C@H](OC(C)C)c2ccccc2)CC1	ZINC001198433695	1369032046	/nfs/dbraw/zinc/03/20/46/1369032046.db2.gz	QWEBBUNEJFMKFA-LJQANCHMSA-N	0	3	330.472	3.263	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)CCOC(C)C)c1ccccc1OC	ZINC001198553981	1369060458	/nfs/dbraw/zinc/06/04/58/1369060458.db2.gz	NDQKGQJQBPJWJT-SFHVURJKSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)C1=COCCC1)c1ccccc1OC	ZINC001198604947	1369070740	/nfs/dbraw/zinc/07/07/40/1369070740.db2.gz	CLGKMRBGNYHIBV-GOSISDBHSA-N	0	3	344.455	3.103	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)COCCCC)c1ccccc1OC	ZINC001198628609	1369076285	/nfs/dbraw/zinc/07/62/85/1369076285.db2.gz	UPIBUHHVTQKTER-GOSISDBHSA-N	0	3	348.487	3.225	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CCC([C@H]2CCCN(CCF)CC2)CC1	ZINC001186591133	1387978388	/nfs/dbraw/zinc/97/83/88/1387978388.db2.gz	WVVGEPYIRNBQAM-KRWDZBQOSA-N	0	3	336.495	3.346	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)c1ccn(C)c1)c1ccccc1OC	ZINC001198655627	1369084174	/nfs/dbraw/zinc/08/41/74/1369084174.db2.gz	GDXDCKLBRPLILB-GOSISDBHSA-N	0	3	341.455	3.061	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)[C@H]1CC1(C)C)c1ccccc1OC	ZINC001198669308	1369087202	/nfs/dbraw/zinc/08/72/02/1369087202.db2.gz	YYFZWEBPZWNFBB-SJORKVTESA-N	0	3	330.472	3.454	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)[C@H]1CC1(F)F)c1ccccc1OC	ZINC001198712762	1369096921	/nfs/dbraw/zinc/09/69/21/1369096921.db2.gz	GLDMDCCLLKIWND-CABCVRRESA-N	0	3	338.398	3.064	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)c2cc3ccccc3c(=O)[nH]2)CC1	ZINC001112967259	1369114012	/nfs/dbraw/zinc/11/40/12/1369114012.db2.gz	GQOILJCGGLIUKD-HNNXBMFYSA-N	0	3	339.439	3.053	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@@H](NCC1CC1)c1ccccc1OC	ZINC001198835145	1369125266	/nfs/dbraw/zinc/12/52/66/1369125266.db2.gz	RVJKTKQMQJOMTD-LJQANCHMSA-N	0	3	342.483	3.436	20	30		EGEDHN
C=C(C)CCN[C@@H](CNC(=O)[C@H](F)C(C)C)c1ccccc1OC	ZINC001198843994	1369127903	/nfs/dbraw/zinc/12/79/03/1369127903.db2.gz	YWYIFWISDZUZLQ-FUHWJXTLSA-N	0	3	336.451	3.402	20	30		EGEDHN
CC#CCCCC(=O)NC[C@H](NCC1CCC1)c1ccccc1OC	ZINC001198856164	1369131084	/nfs/dbraw/zinc/13/10/84/1369131084.db2.gz	GBTWYCPKDBYNMX-IBGZPJMESA-N	0	3	342.483	3.436	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@@H](NCCCOC)c1ccccc1OC	ZINC001198857256	1369131805	/nfs/dbraw/zinc/13/18/05/1369131805.db2.gz	NYRDLPXSSXETME-SJLPKXTDSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC[C@@H](NCCCOC)c1ccccc1OC	ZINC001198885114	1369139259	/nfs/dbraw/zinc/13/92/59/1369139259.db2.gz	AWUUJKALKDCEER-XLIONFOSSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)C[C@H](C)c2c(C)noc2C)CC1	ZINC001113030082	1369150593	/nfs/dbraw/zinc/15/05/93/1369150593.db2.gz	JQMHEAZYLFXJMS-GJZGRUSLSA-N	0	3	333.476	3.284	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NC[C@@H](NCCCCC)c1ccccc1OC	ZINC001199001893	1369170022	/nfs/dbraw/zinc/17/00/22/1369170022.db2.gz	MMSYUKFHBXPKPE-FUHWJXTLSA-N	0	3	348.487	3.223	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)Cc2cc(C)ccc2OC)CC1	ZINC001113076251	1369183763	/nfs/dbraw/zinc/18/37/63/1369183763.db2.gz	ZYWYNGBQWXULAF-KRWDZBQOSA-N	0	3	330.472	3.045	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)[C@@H]2CCCC(C)(C)C2)C1	ZINC001199210911	1369191754	/nfs/dbraw/zinc/19/17/54/1369191754.db2.gz	MXJHRMCLDMZYPK-KZNAEPCWSA-N	0	3	336.520	3.111	20	30		EGEDHN
CCCCCC(=O)N1CCC(NCc2cc(F)ccc2C#N)CC1	ZINC001199334861	1369209335	/nfs/dbraw/zinc/20/93/35/1369209335.db2.gz	LCDCAUDATXXRIY-UHFFFAOYSA-N	0	3	331.435	3.358	20	30		EGEDHN
C=CCCC(=O)N1CCC(NCc2ccn(C3CCCC3)n2)CC1	ZINC001199681966	1369253277	/nfs/dbraw/zinc/25/32/77/1369253277.db2.gz	PNMZGPQIEZXJSE-UHFFFAOYSA-N	0	3	330.476	3.045	20	30		EGEDHN
CCC(=CC(=O)N1CCC(NCc2ccccc2C#N)CC1)CC	ZINC001200078875	1369313539	/nfs/dbraw/zinc/31/35/39/1369313539.db2.gz	NVJPXLZFHRVTPC-UHFFFAOYSA-N	0	3	325.456	3.385	20	30		EGEDHN
C=C(C)CCC(=O)N1CCCO[C@@H](CNCc2cc(C)ccc2F)C1	ZINC001200626964	1369402122	/nfs/dbraw/zinc/40/21/22/1369402122.db2.gz	FMMDNJQHAWRDCT-SFHVURJKSA-N	0	3	348.462	3.198	20	30		EGEDHN
C=CCC[C@H](C)N1CCN(C(=O)Cc2coc3ccccc23)CC1	ZINC001113455565	1369444356	/nfs/dbraw/zinc/44/43/56/1369444356.db2.gz	OHQDQWCLXJMLOY-INIZCTEOSA-N	0	3	326.440	3.474	20	30		EGEDHN
CCCCCCCCCCCN1CCN(CC(N)=O)C(C)(C)C1	ZINC001201631131	1369593516	/nfs/dbraw/zinc/59/35/16/1369593516.db2.gz	MGQQGIWBDHPJRU-UHFFFAOYSA-N	0	3	325.541	3.399	20	30		EGEDHN
CCCCCCCN1CCCn2nnc(COc3cccnc3)c2C1	ZINC001201762431	1369618841	/nfs/dbraw/zinc/61/88/41/1369618841.db2.gz	KYXJNZQVMHVPDV-UHFFFAOYSA-N	0	3	343.475	3.428	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N1CCC(NC/C(Cl)=C\Cl)CC1	ZINC001201845796	1369633109	/nfs/dbraw/zinc/63/31/09/1369633109.db2.gz	OEYBPTRCFIVNTC-SICOMBFOSA-N	0	3	349.302	3.115	20	30		EGEDHN
CCCCCCCCCN1CCN(c2ncccc2C(N)=O)CC1	ZINC001201852978	1369634756	/nfs/dbraw/zinc/63/47/56/1369634756.db2.gz	VTBNSQIHRSMQBA-UHFFFAOYSA-N	0	3	332.492	3.053	20	30		EGEDHN
CCCC[C@@H](CC)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001113911035	1369655240	/nfs/dbraw/zinc/65/52/40/1369655240.db2.gz	NTLCKAUPYQUGDO-ZRNYENFQSA-N	0	3	339.483	3.321	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC(NCc2nc(C)cs2)CC1	ZINC001201998508	1369663517	/nfs/dbraw/zinc/66/35/17/1369663517.db2.gz	PQSPFCASCSCVND-UHFFFAOYSA-N	0	3	333.501	3.116	20	30		EGEDHN
O=C(N[C@H]1C[C@H](NCC#Cc2cccc(Cl)c2)C12CCC2)C1CC1	ZINC001202281798	1369728663	/nfs/dbraw/zinc/72/86/63/1369728663.db2.gz	UBLARZMSBMKIOK-ROUUACIJSA-N	0	3	342.870	3.119	20	30		EGEDHN
CCCCC(=O)N[C@@H]1C[C@@H](NCc2cc(C#N)ccc2F)C12CCC2	ZINC001202491749	1369789537	/nfs/dbraw/zinc/78/95/37/1369789537.db2.gz	WKDFGKBEAXCIKG-QZTJIDSGSA-N	0	3	343.446	3.405	20	30		EGEDHN
CCC(CC)C(=O)N[C@@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202522953	1369798574	/nfs/dbraw/zinc/79/85/74/1369798574.db2.gz	RLAXPCPVYKCKAV-WOJBJXKFSA-N	0	3	338.495	3.491	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C4CCC4)cc3)C[C@H]21	ZINC001114247899	1369826929	/nfs/dbraw/zinc/82/69/29/1369826929.db2.gz	QMHFVLDOOOPWDX-XVAYZXCPSA-N	0	3	336.479	3.160	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1[C@H]2CN(Cc3cc4ccccc4s3)C[C@H]21	ZINC001114247263	1369826945	/nfs/dbraw/zinc/82/69/45/1369826945.db2.gz	HNNHWXCVGRMCQL-YRWFTTLQSA-N	0	3	338.476	3.107	20	30		EGEDHN
CC[C@H](c1ccc(Cl)cc1)N1C[C@H]2[C@@H](C1)[C@@H]2NC(=O)C#CC1CC1	ZINC001114258072	1369833122	/nfs/dbraw/zinc/83/31/22/1369833122.db2.gz	KSRNDMYTWYHXKF-RMJJICAUSA-N	0	3	342.870	3.251	20	30		EGEDHN
O=C(/C=C/C1CC1)N[C@@H]1C[C@@H](NCC#Cc2ccccc2)C12CCC2	ZINC001202713331	1369862065	/nfs/dbraw/zinc/86/20/65/1369862065.db2.gz	LYWWPNUZEMHJJY-XICOBVEKSA-N	0	3	334.463	3.021	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)C(F)=C(C)C)C12CCC2	ZINC001202735286	1369872838	/nfs/dbraw/zinc/87/28/38/1369872838.db2.gz	LZFIVZIAVXEEMS-RYUDHWBXSA-N	0	3	345.256	3.175	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C)c(OC)c3)C[C@H]21	ZINC001114341566	1369901507	/nfs/dbraw/zinc/90/15/07/1369901507.db2.gz	YMCDMGWBBIRZHW-YRWFTTLQSA-N	0	3	342.483	3.152	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H]1[C@H]2CN(CCOc3cccc(Cl)c3)C[C@H]21	ZINC001114353817	1369908484	/nfs/dbraw/zinc/90/84/84/1369908484.db2.gz	ZVBFDFDCMURWNI-DZFIZOCASA-N	0	3	348.874	3.122	20	30		EGEDHN
C[C@@H](c1ccccc1)N(Cc1cccc(C#N)c1)C[C@@H]1CCC(=O)N1	ZINC001202897977	1369921208	/nfs/dbraw/zinc/92/12/08/1369921208.db2.gz	FXDLUURHSBYQPZ-JXFKEZNVSA-N	0	3	333.435	3.400	20	30		EGEDHN
C=CC1(CC(=O)N2CCC(NCc3cnns3)CC2)CCCCC1	ZINC001202905331	1369922601	/nfs/dbraw/zinc/92/26/01/1369922601.db2.gz	LSIZJETWKJXYNU-UHFFFAOYSA-N	0	3	348.516	3.145	20	30		EGEDHN
C=CC1(CC(=O)N2CCC(NCc3ccn(C)n3)CC2)CCCCC1	ZINC001202912013	1369925664	/nfs/dbraw/zinc/92/56/64/1369925664.db2.gz	AIFOGXQBANYFAA-UHFFFAOYSA-N	0	3	344.503	3.027	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1C[C@@H](NCc2ccns2)C12CCC2	ZINC001202969411	1369940795	/nfs/dbraw/zinc/94/07/95/1369940795.db2.gz	PPWYZTWZGUOKKC-HUUCEWRRSA-N	0	3	333.501	3.262	20	30		EGEDHN
CC[C@@H](C)[C@@H](C)C(=O)N1CCC(NCc2ccccc2C#N)CC1	ZINC001203091726	1369980016	/nfs/dbraw/zinc/98/00/16/1369980016.db2.gz	FKAXTUNHLMIGRI-HZPDHXFCSA-N	0	3	327.472	3.321	20	30		EGEDHN
O=C(CCC(F)F)N[C@@H]1C[C@H](NCC#Cc2ccccc2)C12CCC2	ZINC001203193754	1370019936	/nfs/dbraw/zinc/01/99/36/1370019936.db2.gz	XIBNCTUKWXEGEV-DLBZAZTESA-N	0	3	346.421	3.100	20	30		EGEDHN
C#CCCCCCC(=O)N[C@@H]1[C@H]2CN(CCCCC(F)(F)F)C[C@H]21	ZINC001114693139	1370029638	/nfs/dbraw/zinc/02/96/38/1370029638.db2.gz	VIMAPAWFKABARW-QLPKVWCKSA-N	0	3	344.421	3.349	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1C[C@H](NCc2ccc(F)cn2)C12CCC2	ZINC001203255692	1370043355	/nfs/dbraw/zinc/04/33/55/1370043355.db2.gz	DNDAOAXKDUKQBH-IRXDYDNUSA-N	0	3	345.462	3.340	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1C[C@@H](NCc2c(C)noc2C)C12CCC2	ZINC001203256300	1370044429	/nfs/dbraw/zinc/04/44/29/1370044429.db2.gz	HIICSALXSBGROO-SJORKVTESA-N	0	3	345.487	3.411	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(F)cc3C)C[C@H]21	ZINC001114725162	1370047473	/nfs/dbraw/zinc/04/74/73/1370047473.db2.gz	ZXUVUHSNOGJHRW-OAOYMFHYSA-N	0	3	330.447	3.283	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C)c(OC)c3)C[C@H]21	ZINC001114793016	1370084323	/nfs/dbraw/zinc/08/43/23/1370084323.db2.gz	YPKWHONSVGUNRZ-DIJFTKHXSA-N	0	3	342.483	3.152	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1C[C@H](NCc2cc(OC)ns2)C12CCC2	ZINC001203340965	1370090086	/nfs/dbraw/zinc/09/00/86/1370090086.db2.gz	NGTBJAYZQKINAN-LSDHHAIUSA-N	0	3	349.500	3.025	20	30		EGEDHN
C=CCC1(C(=O)N[C@H]2C[C@H](NCc3ccns3)C23CCC3)CCC1	ZINC001203366908	1370100295	/nfs/dbraw/zinc/10/02/95/1370100295.db2.gz	PMRUXJLJDJVJJA-HOTGVXAUSA-N	0	3	345.512	3.407	20	30		EGEDHN
CCC1(C(=O)N[C@H]2C[C@@H](NCC#Cc3ccccc3)C23CCC3)CC1	ZINC001203387848	1370108778	/nfs/dbraw/zinc/10/87/78/1370108778.db2.gz	XUCQSPZTDBTYLT-MOPGFXCFSA-N	0	3	336.479	3.245	20	30		EGEDHN
CCC1(C(=O)N[C@@H]2C[C@@H](NCC#Cc3ccccc3)C23CCC3)CC1	ZINC001203387852	1370108795	/nfs/dbraw/zinc/10/87/95/1370108795.db2.gz	XUCQSPZTDBTYLT-RTBURBONSA-N	0	3	336.479	3.245	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1C[C@H](NCc2cncs2)C12CCC2	ZINC001203450894	1370131379	/nfs/dbraw/zinc/13/13/79/1370131379.db2.gz	GGMLJJRMUFSSLQ-LSDHHAIUSA-N	0	3	333.501	3.262	20	30		EGEDHN
CN1c2ccccc2C2(CCN(Cc3cccc(C#N)c3)CC2)CC1=O	ZINC001203760972	1370253992	/nfs/dbraw/zinc/25/39/92/1370253992.db2.gz	VRFGDONFCZWNFL-UHFFFAOYSA-N	0	3	345.446	3.459	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)CC#Cc2ccccc2)C12CCC2	ZINC001203762890	1370254652	/nfs/dbraw/zinc/25/46/52/1370254652.db2.gz	VABGXRGZJFYWBS-ROUUACIJSA-N	0	3	342.870	3.198	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@H]3O[C@@H](COc4cccnc4)CC[C@H]32)c1	ZINC001203762781	1370254831	/nfs/dbraw/zinc/25/48/31/1370254831.db2.gz	WICWBUZXPSKQCY-NJDAHSKKSA-N	0	3	349.434	3.154	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)CCc2ccc(C)o2)C12CCC2	ZINC001203779885	1370260918	/nfs/dbraw/zinc/26/09/18/1370260918.db2.gz	CGZFUDZFVDQFJR-CVEARBPZSA-N	0	3	336.863	3.290	20	30		EGEDHN
O=C1C=C2CN(Cc3cc(Br)cs3)CCC2S1	ZINC001204026383	1370352100	/nfs/dbraw/zinc/35/21/00/1370352100.db2.gz	HVPYNBQWPYWDGV-LLVKDONJSA-N	0	3	330.272	3.285	20	30		EGEDHN
CC[C@@H](CC(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C1)C(C)C	ZINC001187207850	1388071575	/nfs/dbraw/zinc/07/15/75/1388071575.db2.gz	IOGTVUDPCZEDMB-LSDHHAIUSA-N	0	3	333.501	3.383	20	30		EGEDHN
O=C(NCC1(NCC#Cc2ccccc2)CCCCC1)c1ccccn1	ZINC001115381080	1370419510	/nfs/dbraw/zinc/41/95/10/1370419510.db2.gz	BXLYIYSQJAZZFO-UHFFFAOYSA-N	0	3	347.462	3.156	20	30		EGEDHN
C=CCOC(=O)N[C@@H]1CCCN(Cc2c(C)[nH]c3ccccc32)C1	ZINC001204296906	1370435375	/nfs/dbraw/zinc/43/53/75/1370435375.db2.gz	FKDRJINMIGAZEE-OAHLLOKOSA-N	0	3	327.428	3.353	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)CCCC)CCCCC1	ZINC001115410942	1370440718	/nfs/dbraw/zinc/44/07/18/1370440718.db2.gz	CUQLZLYUGMJPGZ-UHFFFAOYSA-N	0	3	331.298	3.494	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CC[C@@H]2CCCO2)CCCCC1	ZINC001115417888	1370443863	/nfs/dbraw/zinc/44/38/63/1370443863.db2.gz	JGAVUQRVQWHFRT-HNNXBMFYSA-N	0	3	328.884	3.107	20	30		EGEDHN
O=C(C#CC1CC1)NCC1(NCc2cccc(F)c2F)CCCCC1	ZINC001115527115	1370525580	/nfs/dbraw/zinc/52/55/80/1370525580.db2.gz	BRSYVMVEPZRFIJ-UHFFFAOYSA-N	0	3	346.421	3.287	20	30		EGEDHN
O=C(C#CC1CC1)NCC1(NCc2ccccc2F)CCCCC1	ZINC001115527487	1370526319	/nfs/dbraw/zinc/52/63/19/1370526319.db2.gz	WQDUHDXQDXSXTJ-UHFFFAOYSA-N	0	3	328.431	3.148	20	30		EGEDHN
CC1(C(=O)NCC2(NCc3ccc(C#N)cc3F)CCCCC2)CC1	ZINC001115548852	1370545389	/nfs/dbraw/zinc/54/53/89/1370545389.db2.gz	WJQSZQFJAKZNBO-UHFFFAOYSA-N	0	3	343.446	3.406	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2scnc2CC)CCCCC1	ZINC001115565744	1370565863	/nfs/dbraw/zinc/56/58/63/1370565863.db2.gz	PPWDOTBZGWQOJS-UHFFFAOYSA-N	0	3	341.908	3.480	20	30		EGEDHN
CN1CCN(Cc2ccc(Nc3ccc(F)c(CC#N)c3)cc2)CC1	ZINC001204765635	1370571464	/nfs/dbraw/zinc/57/14/64/1370571464.db2.gz	JVYLLBQTMCTIHY-UHFFFAOYSA-N	0	3	338.430	3.383	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H](OC)[C@@H](C)CC)CCCCC1	ZINC001115606446	1370604793	/nfs/dbraw/zinc/60/47/93/1370604793.db2.gz	GJIUSUZHULAEMQ-ZFWWWQNUSA-N	0	3	330.900	3.209	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@H](C)C(F)(F)F)CCCCC1	ZINC001115672145	1370653885	/nfs/dbraw/zinc/65/38/85/1370653885.db2.gz	DQAWSYIYPYUCBZ-NSHDSACASA-N	0	3	326.790	3.346	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)/C=C(/C)CC)CC[C@H]1c1ccc(F)cc1	ZINC001205282551	1370706009	/nfs/dbraw/zinc/70/60/09/1370706009.db2.gz	CCWQDTSWOSRZFQ-TVUWTRKXSA-N	0	3	342.458	3.479	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cc(C3CC3)no2)CCCCC1	ZINC001115754189	1370735349	/nfs/dbraw/zinc/73/53/49/1370735349.db2.gz	URISMMRILMGIRZ-UHFFFAOYSA-N	0	3	337.851	3.327	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H](c2cccc(F)c2)[C@H](NCC#CC)C1	ZINC001205429278	1370752746	/nfs/dbraw/zinc/75/27/46/1370752746.db2.gz	SVPXDPBAZVXLEF-LSTHTHJFSA-N	0	3	342.458	3.335	20	30		EGEDHN
C#C[C@H](NC(=O)N1CCCN(Cc2ccccc2)CC1)c1ccccc1	ZINC001326027801	1388103134	/nfs/dbraw/zinc/10/31/34/1388103134.db2.gz	WSQDSVJMRSJGEB-NRFANRHFSA-N	0	3	347.462	3.278	20	30		EGEDHN
C[C@H](CC(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C1)C(C)(C)C	ZINC001187413469	1388104385	/nfs/dbraw/zinc/10/43/85/1388104385.db2.gz	YHSHNOBHDQBBTR-ZIAGYGMSSA-N	0	3	333.501	3.383	20	30		EGEDHN
C=CCCCC(=O)N1CCC(CN[C@H](C)c2cnc(C)cn2)CC1	ZINC001206105667	1370961032	/nfs/dbraw/zinc/96/10/32/1370961032.db2.gz	PTTAUIGVPGYIHL-MRXNPFEDSA-N	0	3	330.476	3.031	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1CN(C[C@H]2[C@H](c3ccccc3)C2(F)F)C[C@H]1C	ZINC001206537037	1371086786	/nfs/dbraw/zinc/08/67/86/1371086786.db2.gz	IGWUVIAEPNAPSW-XZKMEQPCSA-N	0	3	348.437	3.438	20	30		EGEDHN
C[C@@H](C#N)C(=O)N[C@@H]1CN(Cc2ccc(-c3ccccc3)cc2)C[C@H]1C	ZINC001206662331	1371125376	/nfs/dbraw/zinc/12/53/76/1371125376.db2.gz	HDQYZNGEWWOSKX-CSODHUTKSA-N	0	3	347.462	3.450	20	30		EGEDHN
C=CCN1C(=O)CCC12CCN(Cc1ccc(C)cc1OC)CC2	ZINC001206747969	1371151903	/nfs/dbraw/zinc/15/19/03/1371151903.db2.gz	CNIVKSUGFIOFIP-UHFFFAOYSA-N	0	3	328.456	3.147	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CN(Cc2cccc(CC)c2)C[C@H]1C	ZINC001206885139	1371205740	/nfs/dbraw/zinc/20/57/40/1371205740.db2.gz	WTWVWWMPWSVVMV-YLJYHZDGSA-N	0	3	326.484	3.379	20	30		EGEDHN
C=CCC1(C(=O)N2CCC(CNCc3cnc(C)o3)CC2)CCCC1	ZINC001206979524	1371257552	/nfs/dbraw/zinc/25/75/52/1371257552.db2.gz	AXVUKXJXMRDABY-UHFFFAOYSA-N	0	3	345.487	3.448	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CCN(Cc3cncc(F)c3)CC2)CC1	ZINC001207017461	1371267677	/nfs/dbraw/zinc/26/76/77/1371267677.db2.gz	YADHIHSGUJXJKE-UHFFFAOYSA-N	0	3	347.434	3.221	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CCN(Cc3cccnc3C)CC2)CC1	ZINC001207148021	1371310439	/nfs/dbraw/zinc/31/04/39/1371310439.db2.gz	RQAGDLROMSUHQP-UHFFFAOYSA-N	0	3	343.471	3.391	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CN(CCOc2cccc(F)c2)C[C@H]1C	ZINC001207158605	1371315285	/nfs/dbraw/zinc/31/52/85/1371315285.db2.gz	UMACFHPADXEOFC-CRAIPNDOSA-N	0	3	348.462	3.243	20	30		EGEDHN
C=CCOC(=O)N[C@@H]1CCCN(CCCc2cccc(OC)c2)C1	ZINC001207572078	1371438775	/nfs/dbraw/zinc/43/87/75/1371438775.db2.gz	HWUAYCUAYRJNSN-QGZVFWFLSA-N	0	3	332.444	3.004	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cccc(OC)c2)CCCCC1	ZINC001120056187	1371471107	/nfs/dbraw/zinc/47/11/07/1371471107.db2.gz	CNZMXRMPUNVJCF-UHFFFAOYSA-N	0	3	336.863	3.470	20	30		EGEDHN
O=C(C1CC=CC1)N1CCC[C@@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207727840	1371486993	/nfs/dbraw/zinc/48/69/93/1371486993.db2.gz	IXUWQOSBTKUORU-LJQANCHMSA-N	0	3	342.870	3.238	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2c(C)onc2CC)CCCCC1	ZINC001120126235	1371491170	/nfs/dbraw/zinc/49/11/70/1371491170.db2.gz	RLBWZCQYDDYHOP-UHFFFAOYSA-N	0	3	339.867	3.320	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@@H](NCC#Cc2cccc(Cl)c2)C1)C1CC1	ZINC001207754746	1371494894	/nfs/dbraw/zinc/49/48/94/1371494894.db2.gz	QXIATMDCANQXNP-DNVCBOLYSA-N	0	3	344.886	3.318	20	30		EGEDHN
CC1CC(C(=O)N2CCC[C@H](NCC#Cc3ccc(Cl)cc3)C2)C1	ZINC001207782525	1371502520	/nfs/dbraw/zinc/50/25/20/1371502520.db2.gz	IUCIPOVQRJCNEY-KVWWFHCMSA-N	0	3	344.886	3.318	20	30		EGEDHN
O=C(C1=CCCC1)N1CCC[C@@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001207790194	1371504839	/nfs/dbraw/zinc/50/48/39/1371504839.db2.gz	SBIQEGOEEDJQTI-LJQANCHMSA-N	0	3	342.870	3.382	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H]1[C@H]1CCCN(C(=O)CCOC(C)C)C1	ZINC001120317883	1371531551	/nfs/dbraw/zinc/53/15/51/1371531551.db2.gz	CPGNRKIAPPXNBI-DLBZAZTESA-N	0	3	342.911	3.257	20	30		EGEDHN
C[C@@]1(C(=O)N2CCC[C@@H](NCC#Cc3ccccc3)C2)CC=CCC1	ZINC001208165952	1371614234	/nfs/dbraw/zinc/61/42/34/1371614234.db2.gz	NQUZOYROSQNSFW-IFMALSPDSA-N	0	3	336.479	3.365	20	30		EGEDHN
C[C@]1(C(=O)N2CCC[C@@H](NCC#Cc3ccccc3)C2)CC=CCC1	ZINC001208165953	1371614749	/nfs/dbraw/zinc/61/47/49/1371614749.db2.gz	NQUZOYROSQNSFW-IRLDBZIGSA-N	0	3	336.479	3.365	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H]2CN([C@@H](C)c3ccc(F)cc3)C[C@H]21	ZINC001187714476	1388148493	/nfs/dbraw/zinc/14/84/93/1388148493.db2.gz	RZJCECQVZURSCZ-VDZJLULYSA-N	0	3	328.431	3.223	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CN(CCCOc2ccccc2C)C[C@H]1C	ZINC001208312748	1371712121	/nfs/dbraw/zinc/71/21/21/1371712121.db2.gz	PNFSVGUDYDCJPV-QZTJIDSGSA-N	0	3	344.499	3.413	20	30		EGEDHN
C#CCC1(C(=O)N2CCC[C@H](NCc3cc(F)cc(F)c3)C2)CCC1	ZINC001208319674	1371716849	/nfs/dbraw/zinc/71/68/49/1371716849.db2.gz	WVGMETYAQTUAKR-SFHVURJKSA-N	0	3	346.421	3.239	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1CN(Cc2cccc(COC)c2)C[C@H]1C	ZINC001208393013	1371750620	/nfs/dbraw/zinc/75/06/20/1371750620.db2.gz	ILSUFCLCMRKCBY-FUHIMQAGSA-N	0	3	344.499	3.372	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1CN(Cc2ccc(OC)cc2)C[C@H]1C	ZINC001208393449	1371751819	/nfs/dbraw/zinc/75/18/19/1371751819.db2.gz	QYWUASOUDMUFMJ-JTDSTZFVSA-N	0	3	330.472	3.234	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1CN(CCOc2cccc(F)c2)C[C@H]1C	ZINC001208395674	1371752699	/nfs/dbraw/zinc/75/26/99/1371752699.db2.gz	BABFEHYNJQSIJF-GPMSIDNRSA-N	0	3	348.462	3.243	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H]1CN(CCOc2ccc(C)cc2)C[C@H]1C	ZINC001208395669	1371752990	/nfs/dbraw/zinc/75/29/90/1371752990.db2.gz	AUNFBIWYQBLIRB-WSTZPKSXSA-N	0	3	344.499	3.413	20	30		EGEDHN
O=C(C[C@@H]1C=CCCC1)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001208403807	1371755696	/nfs/dbraw/zinc/75/56/96/1371755696.db2.gz	MWZJZZJFSFXDPW-RTWAWAEBSA-N	0	3	336.479	3.365	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1CN(CC[C@@H]2CC2(Cl)Cl)C[C@H]1C	ZINC001208455075	1371772306	/nfs/dbraw/zinc/77/23/06/1371772306.db2.gz	ADJUUZUOYYLFSJ-MGPQQGTHSA-N	0	3	333.303	3.363	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC1CC2(CC(NCc3c(F)cccc3Cl)C2)C1	ZINC001120835111	1371777728	/nfs/dbraw/zinc/77/77/28/1371777728.db2.gz	WJNPCMLXQVKNDS-CKNZGFSTSA-N	0	3	349.837	3.156	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC1CC2(CC(NCc3cnoc3C)C2)C1	ZINC001121174891	1371878220	/nfs/dbraw/zinc/87/82/20/1371878220.db2.gz	CJFCRWVUYJCCRO-UHFFFAOYSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=C(C)CCC(=O)NC1CC2(CC(NCc3csnc3OC)C2)C1	ZINC001121183229	1371881640	/nfs/dbraw/zinc/88/16/40/1371881640.db2.gz	HAVBEVQLGJILQI-UHFFFAOYSA-N	0	3	349.500	3.025	20	30		EGEDHN
N#Cc1ccc(CCCN2CCN(c3nccc4occc43)CC2)cc1	ZINC001208859395	1371921868	/nfs/dbraw/zinc/92/18/68/1371921868.db2.gz	ZDXUZIOHBFOXPV-UHFFFAOYSA-N	0	3	346.434	3.454	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)C[C@H](C)c1ccncc1)C2	ZINC001121288688	1371923232	/nfs/dbraw/zinc/92/32/32/1371923232.db2.gz	JNIFJCQQQBZGNO-UNSYWJDTSA-N	0	3	347.890	3.345	20	30		EGEDHN
CC(C)(C)OC(=O)NC1CC2(C1)CN(CCc1ccc(C#N)cc1)C2	ZINC001208926015	1371947763	/nfs/dbraw/zinc/94/77/63/1371947763.db2.gz	DSNQNRXDOPHPRH-UHFFFAOYSA-N	0	3	341.455	3.090	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CN(CCc2scnc2C)C[C@H]1C	ZINC001208953904	1371960712	/nfs/dbraw/zinc/96/07/12/1371960712.db2.gz	BJYXKJMMXXJZHA-UKRRQHHQSA-N	0	3	335.517	3.033	20	30		EGEDHN
CC[C@H](F)C(=O)N1CCC[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001209020951	1371976444	/nfs/dbraw/zinc/97/64/44/1371976444.db2.gz	XSQCAZZXHZFMNH-IRXDYDNUSA-N	0	3	336.838	3.020	20	30		EGEDHN
C=CCN(CCN1CCC[C@H]1c1ccc(OC)cc1)C(=O)OCC	ZINC001209022256	1371977197	/nfs/dbraw/zinc/97/71/97/1371977197.db2.gz	SXDRZHYWCPXZSQ-SFHVURJKSA-N	0	3	332.444	3.477	20	30		EGEDHN
C=CC(C)(C)C(=O)NC1CC2(CC(NCc3ccn(C(C)C)n3)C2)C1	ZINC001121534339	1372002191	/nfs/dbraw/zinc/00/21/91/1372002191.db2.gz	FOVJNCTXKGNKLM-UHFFFAOYSA-N	0	3	344.503	3.193	20	30		EGEDHN
C#CCCCCCC(=O)NC1CC2(CC(NCc3cc(C)no3)C2)C1	ZINC001121534651	1372002542	/nfs/dbraw/zinc/00/25/42/1372002542.db2.gz	QZVLXUWWDUWSNP-UHFFFAOYSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCC[C@H](NCc2ccnc(Cl)c2)C1	ZINC001209145741	1372014392	/nfs/dbraw/zinc/01/43/92/1372014392.db2.gz	HBBFCJIUMACNIZ-ZBFHGGJFSA-N	0	3	335.879	3.418	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CCC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001209147389	1372014866	/nfs/dbraw/zinc/01/48/66/1372014866.db2.gz	WRHUHCWSWUPXBL-MAUKXSAKSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)CC[C@H](C)c2ccccc2)C1	ZINC001209197767	1372034657	/nfs/dbraw/zinc/03/46/57/1372034657.db2.gz	JUOMKHSGYVCVCJ-NLWGTHIKSA-N	0	3	344.499	3.209	20	30		EGEDHN
C=CCCCCN1CCCC[C@@]12CC(=O)N(Cc1cccnc1)C2	ZINC001209202760	1372035559	/nfs/dbraw/zinc/03/55/59/1372035559.db2.gz	IANLBNSTHURWFW-FQEVSTJZSA-N	0	3	327.472	3.395	20	30		EGEDHN
C=CCCCCN1Cc2cncn2C[C@H](COc2cccnc2)C1	ZINC001209203669	1372037288	/nfs/dbraw/zinc/03/72/88/1372037288.db2.gz	SINFJVITQKGWBK-QGZVFWFLSA-N	0	3	326.444	3.145	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N[C@H](CC)c1nc(-c2ccccc2)c[nH]1	ZINC001121856817	1372104733	/nfs/dbraw/zinc/10/47/33/1372104733.db2.gz	CENOJYHWGMBAJE-HZPDHXFCSA-N	0	3	326.444	3.328	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc(C(=O)NCC(C)C)cc1C	ZINC001121862835	1372107152	/nfs/dbraw/zinc/10/71/52/1372107152.db2.gz	RMLFOIAVHYCMET-INIZCTEOSA-N	0	3	331.460	3.003	20	30		EGEDHN
C=CCC1(C(=O)N2CCC[C@@H](NCc3ccc(C#N)s3)C2)CCC1	ZINC001209503858	1372122324	/nfs/dbraw/zinc/12/23/24/1372122324.db2.gz	MTUJOZNDXJLDFG-OAHLLOKOSA-N	0	3	343.496	3.447	20	30		EGEDHN
CC1(C)CC[C@H](C(=O)N2CCC[C@@H](NCC#Cc3ccccc3)C2)C1	ZINC001209523058	1372127443	/nfs/dbraw/zinc/12/74/43/1372127443.db2.gz	FVPXNRXOAVDQLG-VQTJNVASSA-N	0	3	338.495	3.445	20	30		EGEDHN
CC(C)C1(C(=O)N2CCC[C@H](NCC#Cc3ccc(F)cc3)C2)CC1	ZINC001209534396	1372129932	/nfs/dbraw/zinc/12/99/32/1372129932.db2.gz	BVMRXUYBLRLMHF-IBGZPJMESA-N	0	3	342.458	3.194	20	30		EGEDHN
CCCC1(C(=O)N2CCC[C@H](NCc3ccc(C#N)c(F)c3)C2)CC1	ZINC001209534930	1372130677	/nfs/dbraw/zinc/13/06/77/1372130677.db2.gz	GFQFPSCKCVCIBI-KRWDZBQOSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CCN(Cc3cncs3)CC2)CC1	ZINC001209544819	1372132705	/nfs/dbraw/zinc/13/27/05/1372132705.db2.gz	YTDOFELQZKZQIE-UHFFFAOYSA-N	0	3	335.473	3.144	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H](NCC#Cc2ccccc2)C1)c1ccco1	ZINC001209601763	1372148396	/nfs/dbraw/zinc/14/83/96/1372148396.db2.gz	PVGVCBMYKMBZOM-MJGOQNOKSA-N	0	3	336.435	3.015	20	30		EGEDHN
O=C([C@H]1CC12CC2)N1CCC[C@H](NCC#Cc2ccccc2Cl)C1	ZINC001209808949	1372204951	/nfs/dbraw/zinc/20/49/51/1372204951.db2.gz	QOOZJYAFJBRTCP-DLBZAZTESA-N	0	3	342.870	3.072	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@H](NCc2cn(C(C)C)nc2C)C1	ZINC001209875886	1372220648	/nfs/dbraw/zinc/22/06/48/1372220648.db2.gz	VDUOFBYZEIBLFZ-SFHVURJKSA-N	0	3	346.519	3.455	20	30		EGEDHN
Cc1cc(N2CCN(C)CC2)ccc1NC1=CC(=O)CC(C)(C)C1	ZINC001210151299	1372282233	/nfs/dbraw/zinc/28/22/33/1372282233.db2.gz	DQTMPUJXJMSTSO-UHFFFAOYSA-N	0	3	327.472	3.432	20	30		EGEDHN
CC(C)Cn1c(N2CCN(C(C)(C)C)CC2)nnc1C(C)(C)CC#N	ZINC001122783741	1372319726	/nfs/dbraw/zinc/31/97/26/1372319726.db2.gz	NJXRQSYYUGABDJ-UHFFFAOYSA-N	0	3	346.523	3.046	20	30		EGEDHN
CCN1C[C@@H](C)N(c2nnc(C(C)(C)CC#N)n2CC(C)C)C[C@H]1C	ZINC001122782740	1372319905	/nfs/dbraw/zinc/31/99/05/1372319905.db2.gz	GJPYIRISYKRERW-HZPDHXFCSA-N	0	3	346.523	3.044	20	30		EGEDHN
C=CCOCCN1C[C@@H](C)[C@H](NC(=O)c2ccc(C(C)(C)C)cc2)C1	ZINC001210539290	1372374378	/nfs/dbraw/zinc/37/43/78/1372374378.db2.gz	ZWPHXWKKKRZHSM-VQIMIIECSA-N	0	3	344.499	3.237	20	30		EGEDHN
CC(C)(C)C(=O)N1CCC[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001210782904	1372426082	/nfs/dbraw/zinc/42/60/82/1372426082.db2.gz	PVYKRONHUKTZOD-KRWDZBQOSA-N	0	3	332.875	3.318	20	30		EGEDHN
CCCCCCCCC(=O)N1CCC[C@@H](NCc2cnn(C)c2)C1	ZINC001210803941	1372430003	/nfs/dbraw/zinc/43/00/03/1372430003.db2.gz	CJCYVQQFWHYGDN-GOSISDBHSA-N	0	3	334.508	3.251	20	30		EGEDHN
C=CCCOCC(=O)N1CCC[C@@H](NCc2sccc2Cl)C1	ZINC001211355197	1372539160	/nfs/dbraw/zinc/53/91/60/1372539160.db2.gz	OXUCTPOHSYHMSS-CYBMUJFWSA-N	0	3	342.892	3.075	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)[C@H](C)CCOc2ccccc2)C1	ZINC001211473087	1372565610	/nfs/dbraw/zinc/56/56/10/1372565610.db2.gz	DPMMMMPBPBRYPV-ZHALLVOQSA-N	0	3	330.472	3.104	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CCOCC3CCC3)C[C@H]2C)CCCC1	ZINC001211492562	1372568738	/nfs/dbraw/zinc/56/87/38/1372568738.db2.gz	FCRRMHCUTGWARC-IEBWSBKVSA-N	0	3	348.531	3.376	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@@H](CC)CCCC)C[C@H]1c1ccccc1	ZINC001211536128	1372575559	/nfs/dbraw/zinc/57/55/59/1372575559.db2.gz	WRPBOMYVTPNOTA-YSIASYRMSA-N	0	3	326.484	3.420	20	30		EGEDHN
C=CC[C@@H](C(=O)N1CC[C@@H](NCc2cncs2)C1)c1ccccc1	ZINC001188002165	1388209809	/nfs/dbraw/zinc/20/98/09/1388209809.db2.gz	OBRHAUAXIJQMBV-SJLPKXTDSA-N	0	3	341.480	3.194	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H](NC(=O)c2sc(C)cc2C)[C@H](OC)C1	ZINC001212332998	1372688665	/nfs/dbraw/zinc/68/86/65/1372688665.db2.gz	SGUVTUDZPGZXIG-NUEKZKHPSA-N	0	3	336.501	3.149	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2ccc(CCC)s2)[C@H](OC)C1	ZINC001212338089	1372690179	/nfs/dbraw/zinc/69/01/79/1372690179.db2.gz	BPALMCWKQNIYFO-HZPDHXFCSA-N	0	3	336.501	3.096	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CN([C@H](C)c2ccccc2C)C[C@H]1OC	ZINC001212338140	1372690506	/nfs/dbraw/zinc/69/05/06/1372690506.db2.gz	FOFGJIOKXVBVPO-BHIYHBOVSA-N	0	3	344.499	3.474	20	30		EGEDHN
N#Cc1ccc(-c2ccc(-c3noc([C@@]45C[C@@H]4CCN5)n3)cc2)cc1	ZINC001212341442	1372691636	/nfs/dbraw/zinc/69/16/36/1372691636.db2.gz	RRMDNKUGSMRUIE-FXAWDEMLSA-N	0	3	328.375	3.484	20	30		EGEDHN
COc1ccc(Nc2ccc(N3CCN(C)CC3)cc2C)c(C#N)c1	ZINC001212783293	1372771755	/nfs/dbraw/zinc/77/17/55/1372771755.db2.gz	BONVCHLGGVLVIW-UHFFFAOYSA-N	0	3	336.439	3.371	20	30		EGEDHN
C=CC1(CC(=O)N[C@@H]2CN(CC[C@H](C)F)C[C@H]2OC)CCCCC1	ZINC001213567287	1372927554	/nfs/dbraw/zinc/92/75/54/1372927554.db2.gz	SGMCOVSQGLIDOL-GVDBMIGSSA-N	0	3	340.483	3.077	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H](NC(=O)c2ccoc2CCC)[C@H](OC)C1	ZINC001213716609	1372950173	/nfs/dbraw/zinc/95/01/73/1372950173.db2.gz	CMKZSQRTKUOYSY-QGPMSJSTSA-N	0	3	334.460	3.016	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)[C@]2(C)CCC(C)=C(C)C2)[C@H](OC)C1	ZINC001213948791	1372985489	/nfs/dbraw/zinc/98/54/89/1372985489.db2.gz	BSSLMDQPYMXBBL-QWFCFKBJSA-N	0	3	334.504	3.295	20	30		EGEDHN
CC(C)(C)c1ccc(-c2noc(-c3ccc(CN)nc3)n2)c(C#N)c1	ZINC001214113835	1373009929	/nfs/dbraw/zinc/00/99/29/1373009929.db2.gz	UZJVLOQSNMVBBX-UHFFFAOYSA-N	0	3	333.395	3.426	20	30		EGEDHN
CC[C@H](C)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001214158613	1373016116	/nfs/dbraw/zinc/01/61/16/1373016116.db2.gz	PPDQJVFTWYTFGF-HDMKZQKVSA-N	0	3	332.875	3.174	20	30		EGEDHN
CC(C)[C@H](C)CC(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)s2)C1	ZINC001214307946	1373042494	/nfs/dbraw/zinc/04/24/94/1373042494.db2.gz	PPUHEGBOLUQTKJ-CKEIUWERSA-N	0	3	333.501	3.238	20	30		EGEDHN
Cc1cscc1C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2)C1	ZINC001214409700	1373057022	/nfs/dbraw/zinc/05/70/22/1373057022.db2.gz	ZVLSBVJKVIKTDI-DNVCBOLYSA-N	0	3	338.476	3.158	20	30		EGEDHN
C/C=C(/C)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(Cl)cc2)C1	ZINC001214413940	1373057214	/nfs/dbraw/zinc/05/72/14/1373057214.db2.gz	NLQYNPJMFBFLPY-YPHGIUPASA-N	0	3	330.859	3.094	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](C)[C@H](NCc2ccccc2OC(C)C)C1	ZINC001214529178	1373074957	/nfs/dbraw/zinc/07/49/57/1373074957.db2.gz	OHBYLYJKEGVXBM-IEBWSBKVSA-N	0	3	342.483	3.214	20	30		EGEDHN
CC1(C)[C@H](C(=O)NCCNCc2cccc(C#N)c2)[C@H]1c1ccccc1	ZINC001127479689	1373130382	/nfs/dbraw/zinc/13/03/82/1373130382.db2.gz	FSSWCXMGPDVVRJ-UXHICEINSA-N	0	3	347.462	3.204	20	30		EGEDHN
C[C@@H](C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccc(F)cc2)C1)C1CCC1	ZINC001214938258	1373145027	/nfs/dbraw/zinc/14/50/27/1373145027.db2.gz	IXUJOLIBMNFQID-JXXFODFXSA-N	0	3	342.458	3.050	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2(C)CCC2)C[C@H]1NCC#Cc1ccccc1Cl	ZINC001215324969	1373198062	/nfs/dbraw/zinc/19/80/62/1373198062.db2.gz	VOSBXVORCKEYNP-CRAIPNDOSA-N	0	3	344.886	3.318	20	30		EGEDHN
Cc1csc(C(=O)NCCNCc2ccc(C#N)cc2)c1Cl	ZINC001128075625	1373215066	/nfs/dbraw/zinc/21/50/66/1373215066.db2.gz	PKAZWSPWLBOLPU-UHFFFAOYSA-N	0	3	333.844	3.101	20	30		EGEDHN
C[C@H](C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2)C1)c1ccccc1	ZINC001216417627	1373306576	/nfs/dbraw/zinc/30/65/76/1373306576.db2.gz	RJENNIYGSWSRLZ-XQBPLPMBSA-N	0	3	346.474	3.278	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2ccc(C3CCC3)cc2)c1	ZINC001128860016	1373317612	/nfs/dbraw/zinc/31/76/12/1373317612.db2.gz	ZJXJLESFTJUJFE-UHFFFAOYSA-N	0	3	333.435	3.345	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)C(C)(C)CC)[C@@H](n2ccnn2)C1	ZINC001129215490	1373361944	/nfs/dbraw/zinc/36/19/44/1373361944.db2.gz	YMSICCDBFRHBLH-SJORKVTESA-N	0	3	349.523	3.026	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)[C@@H]3CC=CCC3)[C@H]2C1	ZINC001217261063	1373413077	/nfs/dbraw/zinc/41/30/77/1373413077.db2.gz	PIRUSYZKNBBPJR-CEXWTWQISA-N	0	3	332.488	3.001	20	30		EGEDHN
N#CC1(C(=O)N2C[C@H]3CCN(Cc4ccccc4)[C@H]3C2)CCCCC1	ZINC001130122214	1373458241	/nfs/dbraw/zinc/45/82/41/1373458241.db2.gz	JPCMGPUFFGIWBQ-MOPGFXCFSA-N	0	3	337.467	3.193	20	30		EGEDHN
C#CCCCCC(=O)N1CCO[C@@H]2CN(CCCCCCC)C[C@@H]21	ZINC001217684189	1373488075	/nfs/dbraw/zinc/48/80/75/1373488075.db2.gz	JWMSIZCUHRIGMI-RBUKOAKNSA-N	0	3	334.504	3.062	20	30		EGEDHN
C=CCCCN1C[C@H]2OCCN(C(=O)[C@H]3CCC(C)=C(C)C3)[C@H]2C1	ZINC001217960420	1373519898	/nfs/dbraw/zinc/51/98/98/1373519898.db2.gz	YNOJAWAWVVTJEC-GBESFXJTSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)[C@H](CCC)C(C)C)C1	ZINC001130431347	1373536775	/nfs/dbraw/zinc/53/67/75/1373536775.db2.gz	VYUTVORWSAEGGT-DOTOQJQBSA-N	0	3	332.492	3.074	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)CCCCC(C)C)C1	ZINC001130433522	1373537782	/nfs/dbraw/zinc/53/77/82/1373537782.db2.gz	BBPHNCDSYYGQHE-MRXNPFEDSA-N	0	3	332.492	3.218	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)CC2CC(c3ccccc3)C2)c1	ZINC001130566814	1373561080	/nfs/dbraw/zinc/56/10/80/1373561080.db2.gz	LADCGPCKBDECQH-UHFFFAOYSA-N	0	3	347.462	3.348	20	30		EGEDHN
CCCCCCCN1C[C@H]2OCCN(C(=O)[C@H](C)C3CCC3)[C@H]2C1	ZINC001218154891	1373571089	/nfs/dbraw/zinc/57/10/89/1373571089.db2.gz	TYFKPUYVERNILA-NZSAHSFTSA-N	0	3	336.520	3.305	20	30		EGEDHN
CCCCc1ccc(CC(=O)NCCNCc2cccc(C#N)c2)cc1	ZINC001130910915	1373606152	/nfs/dbraw/zinc/60/61/52/1373606152.db2.gz	SJPPJTIYIYDXPF-UHFFFAOYSA-N	0	3	349.478	3.349	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCO[C@@H]2CN(CCC3CCCC3)C[C@@H]21	ZINC001218524362	1373630055	/nfs/dbraw/zinc/63/00/55/1373630055.db2.gz	WROOROQIUXJJKP-NZSAHSFTSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)Nc1cc(-c2ccncc2)c[nH]c1=O	ZINC001218602692	1373636158	/nfs/dbraw/zinc/63/61/58/1373636158.db2.gz	GUBHFQJQUGEPQO-INIZCTEOSA-N	0	3	340.427	3.252	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)[C@H](C)C3CCCC3)[C@H]2C1	ZINC001218941655	1373668663	/nfs/dbraw/zinc/66/86/63/1373668663.db2.gz	GPIGPVCLAPXIEQ-YZGWKJHDSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=CCCCCC[C@H](N)C(=O)Nc1ccc2[nH]cc(C(=O)OC)c2c1	ZINC001218985887	1373675052	/nfs/dbraw/zinc/67/50/52/1373675052.db2.gz	NNBQFWRKGZNLHD-INIZCTEOSA-N	0	3	343.427	3.357	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)C[C@@H]2C[C@H]2Cc2ccccc2)cc1	ZINC001131627006	1373736470	/nfs/dbraw/zinc/73/64/70/1373736470.db2.gz	QRDZFDZPLLSNMG-RTWAWAEBSA-N	0	3	347.462	3.033	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@H](C)O[C@]3(CCN(CC=C(C)C)C3)C2)CCC1	ZINC001131681627	1373759930	/nfs/dbraw/zinc/75/99/30/1373759930.db2.gz	FRXXCDCCPDBQSD-RXVVDRJESA-N	0	3	346.515	3.391	20	30		EGEDHN
C=CCCC1(C(=O)N2C[C@@H](C)O[C@]3(CCN(CC(=C)C)C3)C2)CC1	ZINC001131688823	1373764322	/nfs/dbraw/zinc/76/43/22/1373764322.db2.gz	RYSKWBYOMBIGSG-XLIONFOSSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C(C)(C)CC(C)C)C[C@@H](C)O2	ZINC001131691830	1373765379	/nfs/dbraw/zinc/76/53/79/1373765379.db2.gz	AMOADXYPXNGQFT-XLIONFOSSA-N	0	3	336.520	3.327	20	30		EGEDHN
N#Cc1cc(CNCCNC(=O)[C@@H]2CCCC[C@H]2C2CC2)ccc1F	ZINC001131743410	1373782376	/nfs/dbraw/zinc/78/23/76/1373782376.db2.gz	ZGPOBUFQCULQTJ-ZWKOTPCHSA-N	0	3	343.446	3.120	20	30		EGEDHN
C=CCCOCC(=O)N1CC[C@@H](N[C@H](C)c2ccccc2Cl)C1	ZINC001188301752	1388286220	/nfs/dbraw/zinc/28/62/20/1388286220.db2.gz	JYUPBHWOXSITIW-HUUCEWRRSA-N	0	3	336.863	3.184	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCC1CCN(Cc2cncc(C)c2)CC1	ZINC001224187526	1375060584	/nfs/dbraw/zinc/06/05/84/1375060584.db2.gz	SFZLPXPUKJJUEV-KRWDZBQOSA-N	0	3	329.488	3.321	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CC[C@H](C)N(Cc2ccc(OC)c(C)c2)C1	ZINC001132003250	1375094304	/nfs/dbraw/zinc/09/43/04/1375094304.db2.gz	RTUWIBNQLXIFJZ-PKOBYXMFSA-N	0	3	342.483	3.276	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CC[C@H](C)N(Cc2cccc(COC)c2)C1	ZINC001132003825	1375095255	/nfs/dbraw/zinc/09/52/55/1375095255.db2.gz	ZXYLOYZGUWLRCJ-PXNSSMCTSA-N	0	3	342.483	3.106	20	30		EGEDHN
C=CCOCC(=O)N[C@@H]1CCCC[C@H]1NCc1ccccc1Cl	ZINC001225361924	1375106617	/nfs/dbraw/zinc/10/66/17/1375106617.db2.gz	VXELJSCAVUGOSY-IAGOWNOFSA-N	0	3	336.863	3.060	20	30		EGEDHN
C[C@H]1CC[C@H](NC(=O)C#CC2CC2)CN1Cc1ccc2c(c1)CCC2	ZINC001132034181	1375108678	/nfs/dbraw/zinc/10/86/78/1375108678.db2.gz	PEJIONRPUKJOLJ-KKSFZXQISA-N	0	3	336.479	3.058	20	30		EGEDHN
Cc1cc(=O)c(C#N)c(O[C@@H]2CCN(Cc3ccccc3)C[C@H]2C)[nH]1	ZINC001225469034	1375114237	/nfs/dbraw/zinc/11/42/37/1375114237.db2.gz	GIGRBOWBWXVFFU-AUUYWEPGSA-N	0	3	337.423	3.257	20	30		EGEDHN
C=CCCOCC(=O)NCC1CCN([C@@H](C)c2cccc(F)c2)CC1	ZINC001225626238	1375134518	/nfs/dbraw/zinc/13/45/18/1375134518.db2.gz	VMLXGVODWYREJS-INIZCTEOSA-N	0	3	348.462	3.308	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)NCC1CCN([C@@H](C)c2cccc(F)c2)CC1	ZINC001225639507	1375137869	/nfs/dbraw/zinc/13/78/69/1375137869.db2.gz	RXWNUMSERVJDJI-HOTGVXAUSA-N	0	3	348.462	3.306	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCc2ncc(C(C)(C)C)o2)CC[C@H]1C	ZINC001132117045	1375156986	/nfs/dbraw/zinc/15/69/86/1375156986.db2.gz	ZIWDRDWBVSWNNA-CABCVRRESA-N	0	3	333.476	3.060	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCc2ccc(N(C)C)cc2)CC[C@H]1C	ZINC001132157487	1375175881	/nfs/dbraw/zinc/17/58/81/1375175881.db2.gz	QAOLZYFCGHYUCD-MJGOQNOKSA-N	0	3	343.515	3.230	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1CC[C@H](C)N(CCOCC2CCC2)C1	ZINC001132330178	1375308847	/nfs/dbraw/zinc/30/88/47/1375308847.db2.gz	CCQXUDOOVZAYDT-WMZOPIPTSA-N	0	3	336.520	3.375	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COCc2ccccc2C)CC[C@@H]1C	ZINC001132340156	1375320239	/nfs/dbraw/zinc/32/02/39/1375320239.db2.gz	NPQBBGJAMLKDLP-HKUYNNGSSA-N	0	3	330.472	3.057	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C(C)(C)Cc2ccccc2)CC[C@H]1C	ZINC001132409656	1375358341	/nfs/dbraw/zinc/35/83/41/1375358341.db2.gz	CKIBLMFSBWFPRU-MJGOQNOKSA-N	0	3	326.484	3.248	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)Cc2ccc(C)c(C)c2)CC[C@@H]1C	ZINC001132469789	1375411049	/nfs/dbraw/zinc/41/10/49/1375411049.db2.gz	WMIIRVYOCOLWRY-AZUAARDMSA-N	0	3	344.499	3.018	20	30		EGEDHN
C=CCN1C[C@H](NC(=O)CCc2ccc(Cl)s2)CC[C@@H]1C	ZINC001132482851	1375418561	/nfs/dbraw/zinc/41/85/61/1375418561.db2.gz	ZTUGXPSBVVOATM-QWHCGFSZSA-N	0	3	326.893	3.489	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2ccc(C3CC3)cc2)CC[C@@H]1C	ZINC001132505507	1375430119	/nfs/dbraw/zinc/43/01/19/1375430119.db2.gz	SNSSJTSQUXSTGQ-OXJNMPFZSA-N	0	3	342.483	3.349	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCOc2cccc(OC)c2)CC[C@H]1C	ZINC001132521665	1375437996	/nfs/dbraw/zinc/43/79/96/1375437996.db2.gz	GWGBVHBHZNWBON-SJORKVTESA-N	0	3	346.471	3.009	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1CC[C@@H](C)N(Cc2cc(C)cc(C)c2)C1	ZINC001132528258	1375442519	/nfs/dbraw/zinc/44/25/19/1375442519.db2.gz	AWJLTRQHYIYGGR-QUCCMNQESA-N	0	3	344.499	3.365	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCc2c(C)noc2Cl)CC[C@@H]1C	ZINC001132529593	1375444077	/nfs/dbraw/zinc/44/40/77/1375444077.db2.gz	OPYPWNCYQRCKSE-GXTWGEPZSA-N	0	3	339.867	3.114	20	30		EGEDHN
C=CCCOCC(=O)N[C@H]1CC[C@@H](C)N(Cc2ccc(CC)cc2)C1	ZINC001132532635	1375444716	/nfs/dbraw/zinc/44/47/16/1375444716.db2.gz	GDOXUFSVOLEFBU-XLIONFOSSA-N	0	3	344.499	3.311	20	30		EGEDHN
C=C(C)CCC(=O)NC1CCN(Cc2ccc3c(c2)COC3)CC1	ZINC001227588552	1375448203	/nfs/dbraw/zinc/44/82/03/1375448203.db2.gz	PYYHGVIVKONMFT-UHFFFAOYSA-N	0	3	328.456	3.154	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C2(C(F)(F)F)CCCCC2)CC[C@@H]1C	ZINC001132543446	1375451027	/nfs/dbraw/zinc/45/10/27/1375451027.db2.gz	YIJYVEBAAOCOBH-GJZGRUSLSA-N	0	3	344.421	3.492	20	30		EGEDHN
C#CCN1CCC[C@H](N(Cc2ccccn2)C(=O)C[C@H](C)CC)CC1	ZINC001132554731	1375461122	/nfs/dbraw/zinc/46/11/22/1375461122.db2.gz	LBTCDZAHXPJKJZ-QUCCMNQESA-N	0	3	341.499	3.334	20	30		EGEDHN
CC#CCN1CC[C@@H](CN(Cc2scnc2C)C(=O)CC(C)C)C1	ZINC001132558660	1375465934	/nfs/dbraw/zinc/46/59/34/1375465934.db2.gz	ODPZESROEJSXOK-QGZVFWFLSA-N	0	3	347.528	3.171	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCNCc1cnc(-c2ccccc2)s1	ZINC001132576698	1375473651	/nfs/dbraw/zinc/47/36/51/1375473651.db2.gz	NRYZTUZYUIURCH-HUUCEWRRSA-N	0	3	343.496	3.474	20	30		EGEDHN
CCC(C)(C)C(=O)N[C@@H]1CCCC[C@H]1NCC#Cc1ccccc1	ZINC001228295250	1375544285	/nfs/dbraw/zinc/54/42/85/1375544285.db2.gz	DMFQURHBIXHPKN-RTBURBONSA-N	0	3	326.484	3.491	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)C[C@@H](C)C(F)(F)F	ZINC001228334553	1375550064	/nfs/dbraw/zinc/55/00/64/1375550064.db2.gz	OSODPJBGQBYZAE-YUSALJHKSA-N	0	3	326.790	3.344	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@@H](C)[C@@H](CNCc2c(F)cccc2F)C1	ZINC001132786738	1375564687	/nfs/dbraw/zinc/56/46/87/1375564687.db2.gz	ZURTYMVJZKIVQO-CVEARBPZSA-N	0	3	348.437	3.343	20	30		EGEDHN
CCOc1cc(C#N)c(Br)cc1O[C@@H]1CCN(CC)C1	ZINC001228459315	1375575558	/nfs/dbraw/zinc/57/55/58/1375575558.db2.gz	ZDWSWLXIKDLAOU-GFCCVEGCSA-N	0	3	339.233	3.192	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NC1CCN(Cc2ccc(C)cc2)CC1	ZINC001228466823	1375575930	/nfs/dbraw/zinc/57/59/30/1375575930.db2.gz	ONZQQMMNWWVHQZ-NRFANRHFSA-N	0	3	344.499	3.304	20	30		EGEDHN
Cc1csc(CNC[C@@H]2CN(C(=O)C#CC(C)(C)C)CC[C@H]2C)n1	ZINC001132818591	1375581969	/nfs/dbraw/zinc/58/19/69/1375581969.db2.gz	LECSPKKXYXMFDL-GDBMZVCRSA-N	0	3	347.528	3.075	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NC1CCN(Cc2ccc3c(c2)COC3)CC1	ZINC001228750177	1375664347	/nfs/dbraw/zinc/66/43/47/1375664347.db2.gz	XAYLTBRGYXKFIZ-CVEARBPZSA-N	0	3	342.483	3.256	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@H](C)[C@H](CNCc3cnc(C)o3)C2)CC1	ZINC001133104720	1375777711	/nfs/dbraw/zinc/77/77/11/1375777711.db2.gz	JBSXZROMDGDGJB-DOTOQJQBSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)CC/C=C/c2ccccc2)CC1	ZINC001229178669	1375782223	/nfs/dbraw/zinc/78/22/23/1375782223.db2.gz	VULQRBPFYDOIKY-UXBLZVDNSA-N	0	3	342.483	3.263	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](C)[C@@H](CNCc2ocnc2C)C1	ZINC001133142328	1375803755	/nfs/dbraw/zinc/80/37/55/1375803755.db2.gz	NPXLUHMYIIRQCY-HOCLYGCPSA-N	0	3	333.476	3.160	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)C1CC=CC1	ZINC001133388818	1375971278	/nfs/dbraw/zinc/97/12/78/1375971278.db2.gz	NCPNMTQSQXGBQR-UHFFFAOYSA-N	0	3	330.859	3.248	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)CC(F)(F)F	ZINC001133390890	1375975222	/nfs/dbraw/zinc/97/52/22/1375975222.db2.gz	OHFGMXBSPKLNCJ-UHFFFAOYSA-N	0	3	346.780	3.234	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1ccsn1	ZINC001133399101	1375982243	/nfs/dbraw/zinc/98/22/43/1375982243.db2.gz	CJKIGFLERPPWEW-UHFFFAOYSA-N	0	3	347.871	3.052	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C/C=C(\C)C=C	ZINC001133401812	1375987094	/nfs/dbraw/zinc/98/70/94/1375987094.db2.gz	OOGNKNUSDAZVLY-CXUHLZMHSA-N	0	3	330.859	3.414	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@H]1C[C@@H]1C(C)C	ZINC001133407566	1375993009	/nfs/dbraw/zinc/99/30/09/1375993009.db2.gz	JHIBGJDUQVMXRM-MSOLQXFVSA-N	0	3	332.875	3.184	20	30		EGEDHN
C=CCOCCN1CCC(NC(=O)[C@@H](CC=C)c2ccccc2)CC1	ZINC001230324545	1375998167	/nfs/dbraw/zinc/99/81/67/1375998167.db2.gz	UHODJOLBSKLVKV-FQEVSTJZSA-N	0	3	342.483	3.130	20	30		EGEDHN
C=C[C@@H](C(=O)NC1CCN(CCOCCCC)CC1)c1ccccc1	ZINC001230334079	1375999612	/nfs/dbraw/zinc/99/96/12/1375999612.db2.gz	GNOPHDAWYWCOBU-HXUWFJFHSA-N	0	3	344.499	3.354	20	30		EGEDHN
C=CCCOCC(=O)NC1CCN([C@H](C)c2cccc(F)c2)CC1	ZINC001230407430	1376022371	/nfs/dbraw/zinc/02/23/71/1376022371.db2.gz	QCKQYRBGAHOLFE-OAHLLOKOSA-N	0	3	334.435	3.060	20	30		EGEDHN
C=CCCOCC(=O)NC1CCN([C@@H](C)c2cccc(F)c2)CC1	ZINC001230407429	1376023178	/nfs/dbraw/zinc/02/31/78/1376023178.db2.gz	QCKQYRBGAHOLFE-HNNXBMFYSA-N	0	3	334.435	3.060	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)/C=C/c1ccco1)NCc1ccccc1C#N	ZINC001133520111	1376054481	/nfs/dbraw/zinc/05/44/81/1376054481.db2.gz	ICWNPYBYXMMDPG-UETGSQEOSA-N	0	3	337.423	3.238	20	30		EGEDHN
C#CCCCCC(=O)N1CCC([C@@H]2CCCN2Cc2ccon2)CC1	ZINC001230549759	1376070940	/nfs/dbraw/zinc/07/09/40/1376070940.db2.gz	UAOKOYWRZPHXJR-IBGZPJMESA-N	0	3	343.471	3.071	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)[C@@H](C)OCCCC)Cc1cccnc1	ZINC001230701176	1376129510	/nfs/dbraw/zinc/12/95/10/1376129510.db2.gz	IDKLCZXRTFHYOM-GOSISDBHSA-N	0	3	347.503	3.171	20	30		EGEDHN
Cc1ccoc1C(=O)N[C@@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001133678723	1376148924	/nfs/dbraw/zinc/14/89/24/1376148924.db2.gz	GEKXGGMLYOWECW-GJZGRUSLSA-N	0	3	325.412	3.146	20	30		EGEDHN
C#CCCCCCC(=O)NCCCN(CCCF)Cc1cccnc1	ZINC001230811754	1376155934	/nfs/dbraw/zinc/15/59/34/1376155934.db2.gz	SCJKYKZNPUGMTR-UHFFFAOYSA-N	0	3	347.478	3.333	20	30		EGEDHN
C#CCCN(CCCNC(=O)[C@@H](C)CC(C)(C)C)Cc1cccnc1	ZINC001230861245	1376169285	/nfs/dbraw/zinc/16/92/85/1376169285.db2.gz	FHDPNWZRPPSPPN-SFHVURJKSA-N	0	3	343.515	3.486	20	30		EGEDHN
C#CCCN(CCCNC(=O)CC[C@@H](C)CC)Cc1cccnc1	ZINC001230876368	1376172160	/nfs/dbraw/zinc/17/21/60/1376172160.db2.gz	KZEVQHCAZPIQJV-SFHVURJKSA-N	0	3	329.488	3.240	20	30		EGEDHN
CC(C)[C@H](Cc1ccccc1)C(=O)NCCNCc1ccc(C#N)cc1	ZINC001133777086	1376203040	/nfs/dbraw/zinc/20/30/40/1376203040.db2.gz	VQCHICBRCGWRSS-NRFANRHFSA-N	0	3	349.478	3.279	20	30		EGEDHN
CCCSCC(=O)N[C@@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001133821879	1376218570	/nfs/dbraw/zinc/21/85/70/1376218570.db2.gz	WAOUGVIEWZHION-GJZGRUSLSA-N	0	3	333.501	3.074	20	30		EGEDHN
COc1ccc(CN(C)CCCNC(=O)C2CCCCC2)cc1C#N	ZINC001231344462	1376228928	/nfs/dbraw/zinc/22/89/28/1376228928.db2.gz	CINLEWZORSRFRI-UHFFFAOYSA-N	0	3	343.471	3.085	20	30		EGEDHN
C[C@H](C[C@@H](C)NC(=O)CC(F)(F)F)NCc1cc(F)ccc1C#N	ZINC001133849327	1376232800	/nfs/dbraw/zinc/23/28/00/1376232800.db2.gz	VWYRRPOUSOVQPK-GHMZBOCLSA-N	0	3	345.340	3.023	20	30		EGEDHN
Cc1ncc(C(=O)N[C@@H](C)C[C@H](C)NCc2ccccc2C#N)s1	ZINC001133871117	1376243747	/nfs/dbraw/zinc/24/37/47/1376243747.db2.gz	HKZFWMKLFPGAOT-STQMWFEESA-N	0	3	342.468	3.010	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H]2CN(Cc3ccc(COC)cc3)C[C@H]21	ZINC001188999146	1388431006	/nfs/dbraw/zinc/43/10/06/1388431006.db2.gz	FGDYRGBOHHQJKN-VQTJNVASSA-N	0	3	342.483	3.222	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H]2CN(Cc3cccc(COC)c3)C[C@H]21	ZINC001188999722	1388432234	/nfs/dbraw/zinc/43/22/34/1388432234.db2.gz	YAWWTCQBSPAZSH-VQTJNVASSA-N	0	3	342.483	3.222	20	30		EGEDHN
C#C[C@@H]1CCCN(Cc2ccc(OC(=O)C(C)C)c(OCC)c2)C1	ZINC001231560010	1376265185	/nfs/dbraw/zinc/26/51/85/1376265185.db2.gz	PHTPCBXQKMMJBT-MRXNPFEDSA-N	0	3	329.440	3.492	20	30		EGEDHN
COc1cc(CN2CCC(C#N)(c3ccccc3)CC2)c(O)cc1O	ZINC001231634593	1376287001	/nfs/dbraw/zinc/28/70/01/1376287001.db2.gz	PCZOJKAZGLTIEN-UHFFFAOYSA-N	0	3	338.407	3.164	20	30		EGEDHN
Cc1ccc(CC(=O)N[C@H](C)C[C@H](C)NCc2ccccc2C#N)o1	ZINC001134156652	1376391523	/nfs/dbraw/zinc/39/15/23/1376391523.db2.gz	NPXDRTHFDWRHAR-LSDHHAIUSA-N	0	3	339.439	3.075	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](C)C[C@H](C)NCc2ccccc2C#N)ns1	ZINC001134214378	1376421315	/nfs/dbraw/zinc/42/13/15/1376421315.db2.gz	OSBGRUZLWPQDAQ-QWHCGFSZSA-N	0	3	342.468	3.010	20	30		EGEDHN
Cc1coc(C)c1C(=O)N[C@H](C)C[C@H](C)NCc1ccccc1C#N	ZINC001134256554	1376439748	/nfs/dbraw/zinc/43/97/48/1376439748.db2.gz	LQOFHYLBKAABLB-LSDHHAIUSA-N	0	3	339.439	3.455	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@]2(CCN(Cc3cc(F)ccc3N)C2)C1	ZINC001232508203	1376469816	/nfs/dbraw/zinc/46/98/16/1376469816.db2.gz	YYAPCPYPTRWKOA-LJQANCHMSA-N	0	3	347.434	3.018	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H]3CN(CCOCCC(C)C)C[C@H]32)CC1	ZINC001189040473	1388444547	/nfs/dbraw/zinc/44/45/47/1388444547.db2.gz	CIHYNTIFSYOBCK-VQTJNVASSA-N	0	3	348.531	3.328	20	30		EGEDHN
CC1(C)N(Cc2ccc(C#N)s2)CC[C@@]12c1ccccc1OC2=O	ZINC001232845403	1376524249	/nfs/dbraw/zinc/52/42/49/1376524249.db2.gz	VOOSKXNTIQAYIA-IBGZPJMESA-N	0	3	338.432	3.461	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H](C)C[C@H](C)NCc1cc2n(n1)CCCC2	ZINC001134456659	1376548067	/nfs/dbraw/zinc/54/80/67/1376548067.db2.gz	BJAFMLLWJNELIL-JKSUJKDBSA-N	0	3	346.519	3.195	20	30		EGEDHN
C[C@H](C[C@H](C)NCc1cc(F)ccc1C#N)NC(=O)C1(F)CCCC1	ZINC001134792155	1376725850	/nfs/dbraw/zinc/72/58/50/1376725850.db2.gz	ZBDMCRUHGITMKB-UONOGXRCSA-N	0	3	349.425	3.353	20	30		EGEDHN
C[C@@H](CCC(=O)NCCNCc1cccc(C#N)c1)c1ccccc1	ZINC001134806662	1376735561	/nfs/dbraw/zinc/73/55/61/1376735561.db2.gz	MOLLVXABRLTQJO-KRWDZBQOSA-N	0	3	335.451	3.348	20	30		EGEDHN
C[C@H](CCC(=O)NCCNCc1cccc(C#N)c1)c1ccccc1	ZINC001134806663	1376735666	/nfs/dbraw/zinc/73/56/66/1376735666.db2.gz	MOLLVXABRLTQJO-QGZVFWFLSA-N	0	3	335.451	3.348	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N(C)C[C@@H]2CCN2CCCC=C)cc1	ZINC001234255933	1376793495	/nfs/dbraw/zinc/79/34/95/1376793495.db2.gz	SLEMREQQVZMCPU-IBGZPJMESA-N	0	3	340.467	3.201	20	30		EGEDHN
CCCCCCCN1CC[C@@H]1CN(C)C(=O)c1cn(C)nc1CC	ZINC001235666455	1376883563	/nfs/dbraw/zinc/88/35/63/1376883563.db2.gz	RGJMJJUSZUJBNL-MRXNPFEDSA-N	0	3	334.508	3.099	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H](C)C[C@@H](C)NCc1nc(C)cs1	ZINC001135188746	1376962223	/nfs/dbraw/zinc/96/22/23/1376962223.db2.gz	OYDFFOHHPSFUEZ-HUUCEWRRSA-N	0	3	335.517	3.408	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H](C)C[C@H](C)NCc1ccn(C(C)C)n1	ZINC001135194370	1376966193	/nfs/dbraw/zinc/96/61/93/1376966193.db2.gz	UHOZTOZXHOWBRG-ZWKOTPCHSA-N	0	3	346.519	3.421	20	30		EGEDHN
CCc1cc(CN2CC[C@@]3(CCCN3C(=O)C(C)C)C2)ccc1C#N	ZINC001238776989	1377001267	/nfs/dbraw/zinc/00/12/67/1377001267.db2.gz	YGIGEXNUWNWVTQ-NRFANRHFSA-N	0	3	339.483	3.344	20	30		EGEDHN
COc1ccc(-c2nc(CN)ccc2NC(=O)C(C)(C)C)cc1C#N	ZINC001244707798	1377039849	/nfs/dbraw/zinc/03/98/49/1377039849.db2.gz	VIQFGBGDKDNISB-UHFFFAOYSA-N	0	3	338.411	3.072	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2nccn2CC)CC1	ZINC001135383898	1377066986	/nfs/dbraw/zinc/06/69/86/1377066986.db2.gz	XGHCDQNNJRYHDH-HZPDHXFCSA-N	0	3	332.492	3.022	20	30		EGEDHN
CC(C)CC1(C(=O)NCCNCc2ccc(C#N)cc2)CCCC1	ZINC001135414299	1377081815	/nfs/dbraw/zinc/08/18/15/1377081815.db2.gz	UABJREKLRAQVQA-UHFFFAOYSA-N	0	3	327.472	3.371	20	30		EGEDHN
C[C@@H](C[C@H](C)NC(=O)C(C)(C)C(F)F)NCc1ccccc1C#N	ZINC001135422176	1377087112	/nfs/dbraw/zinc/08/71/12/1377087112.db2.gz	FWSGRYKPUZSXMJ-STQMWFEESA-N	0	3	337.414	3.222	20	30		EGEDHN
CC(C)C1(C(=O)N[C@@H](C)C[C@H](C)NCc2ccccc2C#N)CC1	ZINC001135439159	1377098640	/nfs/dbraw/zinc/09/86/40/1377098640.db2.gz	RXXNKWREPLFMQP-HOTGVXAUSA-N	0	3	327.472	3.367	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1CCC(=O)N(Cc2ccccc2)CC1	ZINC001258572143	1377117740	/nfs/dbraw/zinc/11/77/40/1377117740.db2.gz	JDZJTEAGVIDMTO-FQEVSTJZSA-N	0	3	333.435	3.229	20	30		EGEDHN
C=C(Br)CN[C@@H](C)CCNC(=O)c1ccccc1Cl	ZINC001266184926	1377219486	/nfs/dbraw/zinc/21/94/86/1377219486.db2.gz	UPHZUXYJCPWQSE-NSHDSACASA-N	0	3	345.668	3.347	20	30		EGEDHN
CC(C)(C)CC(=O)NC1CCN(Cc2ccc(OCC#N)cc2)CC1	ZINC001137122650	1377482498	/nfs/dbraw/zinc/48/24/98/1377482498.db2.gz	MDOOWHOWLKWZTO-UHFFFAOYSA-N	0	3	343.471	3.106	20	30		EGEDHN
CCC#CC(=O)N1CCC[C@@]2(CN(C[C@H](CC)CCCC)CCO2)C1	ZINC001268951564	1377533108	/nfs/dbraw/zinc/53/31/08/1377533108.db2.gz	VPTXBBOTXYRNCM-TZIWHRDSSA-N	0	3	348.531	3.310	20	30		EGEDHN
C=CCN1C(=O)CCC12CCN(Cc1cc(C)ccc1OC)CC2	ZINC001138485832	1377731672	/nfs/dbraw/zinc/73/16/72/1377731672.db2.gz	CVRAULKICXIVSL-UHFFFAOYSA-N	0	3	328.456	3.147	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCC[C@]3(CCC(=O)N3)[C@H]2CC)c1[O-]	ZINC001138627355	1377756553	/nfs/dbraw/zinc/75/65/53/1377756553.db2.gz	DCEHYAXHNDMSIG-XLIONFOSSA-N	0	3	328.456	3.144	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCC[C@]3(CCC(=O)N3)[C@H]2CC)c1[O-]	ZINC001138627355	1377756554	/nfs/dbraw/zinc/75/65/54/1377756554.db2.gz	DCEHYAXHNDMSIG-XLIONFOSSA-N	0	3	328.456	3.144	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@]3(C[C@@H](OCC4CC4)CO3)C2)c1[O-]	ZINC001138628659	1377756814	/nfs/dbraw/zinc/75/68/14/1377756814.db2.gz	BFLWMUVBJYWUGI-CTNGQTDRSA-N	0	3	343.467	3.281	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@]3(C[C@@H](OCC4CC4)CO3)C2)c1[O-]	ZINC001138628659	1377756815	/nfs/dbraw/zinc/75/68/15/1377756815.db2.gz	BFLWMUVBJYWUGI-CTNGQTDRSA-N	0	3	343.467	3.281	20	30		EGEDHN
C=C(C)COc1ccccc1CN1CCC[C@]2(CCCC(=O)N2)C1	ZINC001138660954	1377764257	/nfs/dbraw/zinc/76/42/57/1377764257.db2.gz	JBPYHRNRYVKSLC-HXUWFJFHSA-N	0	3	328.456	3.276	20	30		EGEDHN
C=C(C)COc1ccccc1CN(C(C)C)[C@@H]1CCN(C(C)=O)C1	ZINC001138666122	1377765334	/nfs/dbraw/zinc/76/53/34/1377765334.db2.gz	JIOYLUZUTRFOHH-LJQANCHMSA-N	0	3	330.472	3.473	20	30		EGEDHN
C=CCOc1ccccc1CN1CCCN(c2ccc(F)cn2)CC1	ZINC001139026874	1377819240	/nfs/dbraw/zinc/81/92/40/1377819240.db2.gz	DIRFIHZGVZDBCQ-UHFFFAOYSA-N	0	3	341.430	3.498	20	30		EGEDHN
C[C@@H]1CCCN(Cc2ccc(Oc3ccc(C#N)cc3)nc2)[C@@H]1CO	ZINC001139427230	1377882334	/nfs/dbraw/zinc/88/23/34/1377882334.db2.gz	ZFHCFKJVCRDDFL-DNVCBOLYSA-N	0	3	337.423	3.338	20	30		EGEDHN
CCN1C[C@@H]2C[C@H]1CN2Cc1ccc(Oc2ccc(C#N)cc2)nc1	ZINC001139429129	1377883300	/nfs/dbraw/zinc/88/33/00/1377883300.db2.gz	PNUAOIOUCLYREE-ROUUACIJSA-N	0	3	334.423	3.024	20	30		EGEDHN
CCOC[C@H]1COCCC12CCN(Cc1ccc(C#N)c(F)c1)CC2	ZINC001139527392	1377897206	/nfs/dbraw/zinc/89/72/06/1377897206.db2.gz	DCBSJEWOQISYBP-SFHVURJKSA-N	0	3	346.446	3.353	20	30		EGEDHN
O=C1C=C2CN(Cc3cccc(Br)c3F)CCC2S1	ZINC001139533595	1377898760	/nfs/dbraw/zinc/89/87/60/1377898760.db2.gz	LFYSJEFXWMZVBM-GFCCVEGCSA-N	0	3	342.233	3.362	20	30		EGEDHN
N#Cc1cccc2c(CN3CCC(Oc4ccncc4)CC3)c[nH]c21	ZINC001139704062	1377937499	/nfs/dbraw/zinc/93/74/99/1377937499.db2.gz	QGYVZOJXUYEFJS-UHFFFAOYSA-N	0	3	332.407	3.478	20	30		EGEDHN
Cc1cnc(OC2CCN(Cc3c[nH]c4c3cccc4C#N)CC2)nc1	ZINC001139707699	1377938199	/nfs/dbraw/zinc/93/81/99/1377938199.db2.gz	PJRJFOIGZZRMNG-UHFFFAOYSA-N	0	3	347.422	3.181	20	30		EGEDHN
COC(=O)c1cccc2[nH]cc(CN(C)Cc3cccc(C#N)c3)c21	ZINC001139721036	1377940997	/nfs/dbraw/zinc/94/09/97/1377940997.db2.gz	WAODBVSKMJZWOQ-UHFFFAOYSA-N	0	3	333.391	3.458	20	30		EGEDHN
C=CCN1C(=O)CCC[C@]12CCCN(Cc1ccc(C)c(C#N)c1)C2	ZINC001139723723	1377941646	/nfs/dbraw/zinc/94/16/46/1377941646.db2.gz	FGAIMECXDKIWMV-OAQYLSRUSA-N	0	3	337.467	3.400	20	30		EGEDHN
N#Cc1ccc2[nH]cc(CN3CCC[C@@H](Oc4cccnc4)C3)c2c1	ZINC001140114480	1378010795	/nfs/dbraw/zinc/01/07/95/1378010795.db2.gz	QZNMKNZNQFUFIT-GOSISDBHSA-N	0	3	332.407	3.478	20	30		EGEDHN
COc1ccc(O[C@H]2CCN(Cc3c[nH]c4ccc(C#N)cc34)C2)nc1	ZINC001140117428	1378011709	/nfs/dbraw/zinc/01/17/09/1378011709.db2.gz	QDBJNMAHHJGVMA-KRWDZBQOSA-N	0	3	348.406	3.096	20	30		EGEDHN
COc1ccc(O[C@@H]2CCN(Cc3c[nH]c4ccc(C#N)cc34)C2)nc1	ZINC001140117429	1378012121	/nfs/dbraw/zinc/01/21/21/1378012121.db2.gz	QDBJNMAHHJGVMA-QGZVFWFLSA-N	0	3	348.406	3.096	20	30		EGEDHN
N#Cc1ccc(OC2CC[NH+](Cc3ccncc3[O-])CC2)cc1Cl	ZINC001140280296	1378039262	/nfs/dbraw/zinc/03/92/62/1378039262.db2.gz	FWKVWWPASGNNTN-UHFFFAOYSA-N	0	3	343.814	3.356	20	30		EGEDHN
CN(Cc1ccc(C#N)nc1)C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC001140546150	1378082864	/nfs/dbraw/zinc/08/28/64/1378082864.db2.gz	WAYBQEGAJJDAFG-INIZCTEOSA-N	0	3	344.459	3.032	20	30		EGEDHN
C=CCOC[C@@H]1CCC[C@@]12CN(Cc1cnc3cc[nH]cc1-3)CCO2	ZINC001140803430	1378141172	/nfs/dbraw/zinc/14/11/72/1378141172.db2.gz	QNNNTEPICLZABL-FXAWDEMLSA-N	0	3	341.455	3.137	20	30		EGEDHN
C=CCOC[C@@H]1CCC[C@@]12CN(Cc1c[nH]c3ccncc13)CCO2	ZINC001140803430	1378141174	/nfs/dbraw/zinc/14/11/74/1378141174.db2.gz	QNNNTEPICLZABL-FXAWDEMLSA-N	0	3	341.455	3.137	20	30		EGEDHN
N#Cc1cccc(CN2C[C@@H]3C(=O)Nc4ccccc4[C@H]3C2)c1Cl	ZINC001140808285	1378146780	/nfs/dbraw/zinc/14/67/80/1378146780.db2.gz	OUKZYBUUQINGQA-CVEARBPZSA-N	0	3	337.810	3.379	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3cccc(C#N)c3Cl)C2)C1=O	ZINC001140810994	1378148360	/nfs/dbraw/zinc/14/83/60/1378148360.db2.gz	DPMWCWSIOXHOPY-IBGZPJMESA-N	0	3	343.858	3.212	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@H]3C[C@]32C(=O)N(CC)C(C)C)c1[O-]	ZINC001277463577	1378224313	/nfs/dbraw/zinc/22/43/13/1378224313.db2.gz	MESGTRBQDXCWMT-GHTZIAJQSA-N	0	3	342.483	3.342	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@H]3C[C@]32C(=O)N(CC)C(C)C)c1[O-]	ZINC001277463577	1378224315	/nfs/dbraw/zinc/22/43/15/1378224315.db2.gz	MESGTRBQDXCWMT-GHTZIAJQSA-N	0	3	342.483	3.342	20	30		EGEDHN
C[C@H](NC(=O)C1CCN(Cc2ccncc2)CC1)c1cccc(C#N)c1	ZINC001142348522	1378434708	/nfs/dbraw/zinc/43/47/08/1378434708.db2.gz	ZFDRAQUGEOQOOA-INIZCTEOSA-N	0	3	348.450	3.043	20	30		EGEDHN
Cc1nccnc1O[C@@H]1CCCN(Cc2c[nH]c3cc(C#N)ccc23)C1	ZINC001142931396	1378512039	/nfs/dbraw/zinc/51/20/39/1378512039.db2.gz	PVERZXGQXCSBGH-QGZVFWFLSA-N	0	3	347.422	3.181	20	30		EGEDHN
C#Cc1ccc(CN2CCC(n3c4ccccc4oc3=O)CC2)cc1	ZINC001144573082	1378747129	/nfs/dbraw/zinc/74/71/29/1378747129.db2.gz	AKQJINKYANXIAB-UHFFFAOYSA-N	0	3	332.403	3.413	20	30		EGEDHN
Cc1ccccc1CC(=O)N[C@@H](C)C[C@@H](C)NCc1ccccc1C#N	ZINC001146205669	1378795171	/nfs/dbraw/zinc/79/51/71/1378795171.db2.gz	OLBXMXCLOHQNJK-MSOLQXFVSA-N	0	3	349.478	3.482	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2ocnc2C)CCCCC1	ZINC001146702702	1378902784	/nfs/dbraw/zinc/90/27/84/1378902784.db2.gz	ZQBMZPKPAHCELB-CVEARBPZSA-N	0	3	345.487	3.330	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2conc2C)CCCC1	ZINC001146823388	1378929211	/nfs/dbraw/zinc/92/92/11/1378929211.db2.gz	ZAXYFOLPFBUAAG-HUUCEWRRSA-N	0	3	333.476	3.492	20	30		EGEDHN
C=CCCC(=O)N1CC2(C1)CCN(CCOc1cc(C)cc(C)c1)C2	ZINC001147186715	1378983950	/nfs/dbraw/zinc/98/39/50/1378983950.db2.gz	BCGWRWNMDPCTKC-UHFFFAOYSA-N	0	3	342.483	3.183	20	30		EGEDHN
CC(C)[C@@H](C)CC(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001147244152	1378994945	/nfs/dbraw/zinc/99/49/45/1378994945.db2.gz	CEJLYRQBYNJVNU-KRWDZBQOSA-N	0	3	339.483	3.275	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CC2(C1)CCN(Cc1ccc(CF)cc1)C2	ZINC001147540960	1379039999	/nfs/dbraw/zinc/03/99/99/1379039999.db2.gz	CSJIWFLBXPVZDS-UHFFFAOYSA-N	0	3	342.458	3.240	20	30		EGEDHN
C=C(C)CCC(=O)N1CC2(C1)CCN(Cc1cccc(OC)c1)C2	ZINC001147639982	1379054229	/nfs/dbraw/zinc/05/42/29/1379054229.db2.gz	KFVXUPMDVKPZIZ-UHFFFAOYSA-N	0	3	328.456	3.086	20	30		EGEDHN
C=C(C)CCC(=O)N1CC2(C1)CCN(CCO[C@H]1CCCC[C@@H]1C)C2	ZINC001147657891	1379056853	/nfs/dbraw/zinc/05/68/53/1379056853.db2.gz	GRUYMIBMYNSETR-OALUTQOASA-N	0	3	348.531	3.472	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)c2ccc3c(c2)CCC=C3)cc1F	ZINC001148058302	1379111098	/nfs/dbraw/zinc/11/10/98/1379111098.db2.gz	XISOXGIZVKATSH-UHFFFAOYSA-N	0	3	349.409	3.176	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC2(C1)CCN(Cc1ccc(OC)cc1)C2	ZINC001148131122	1379122516	/nfs/dbraw/zinc/12/25/16/1379122516.db2.gz	QARRXUJZTNLYAL-QGZVFWFLSA-N	0	3	342.483	3.332	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CC2(C1)CCN(Cc1cnccc1C)C2	ZINC001148131188	1379122668	/nfs/dbraw/zinc/12/26/68/1379122668.db2.gz	QRVBXQZIJAGXCC-KRWDZBQOSA-N	0	3	327.472	3.027	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC2(C1)CCN(Cc1cccc(OC)c1)C2	ZINC001148146511	1379124588	/nfs/dbraw/zinc/12/45/88/1379124588.db2.gz	FTGMJDLGPOPUTQ-KRWDZBQOSA-N	0	3	342.483	3.332	20	30		EGEDHN
CCC(CC)CC(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001148492339	1379187708	/nfs/dbraw/zinc/18/77/08/1379187708.db2.gz	KKHCWRMFFXAVIV-UHFFFAOYSA-N	0	3	339.483	3.419	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)CCCc3cc(C)sc3C)C2)C1	ZINC001148851734	1379284222	/nfs/dbraw/zinc/28/42/22/1379284222.db2.gz	VBNRSWJSLKSBDM-UHFFFAOYSA-N	0	3	344.524	3.245	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)c2cc3c(s2)CCCC3)c1	ZINC001150003779	1379483205	/nfs/dbraw/zinc/48/32/05/1379483205.db2.gz	MSGWTMMXPLNLNU-UHFFFAOYSA-N	0	3	339.464	3.018	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@@H]1CN(Cc2cccc(C)c2)CCCO1	ZINC001150138814	1379501013	/nfs/dbraw/zinc/50/10/13/1379501013.db2.gz	FXRFMYUXUDQLDL-UYAOXDASSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC[C@@H]1CN(Cc2ccccc2C)CCCO1	ZINC001150159349	1379505507	/nfs/dbraw/zinc/50/55/07/1379505507.db2.gz	GUOQWBPJSNJSFS-UYAOXDASSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H]1CN(Cc2cc(C)cc(C)c2)CCCO1	ZINC001150212242	1379516384	/nfs/dbraw/zinc/51/63/84/1379516384.db2.gz	PQTSUXINPIKDOM-HXUWFJFHSA-N	0	3	344.499	3.367	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)[C@H](CC)c2ccc(F)cc2)C1	ZINC001150786984	1379614026	/nfs/dbraw/zinc/61/40/26/1379614026.db2.gz	HPJCIXLODYVVCY-RBUKOAKNSA-N	0	3	348.462	3.103	20	30		EGEDHN
N#Cc1cccc(CNCCNC(=O)CCc2ccc(Cl)s2)c1	ZINC001150984585	1379643837	/nfs/dbraw/zinc/64/38/37/1379643837.db2.gz	UKVFATBPRKTJPN-UHFFFAOYSA-N	0	3	347.871	3.112	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)C[C@H]2CC[C@H](C)C2)CC1	ZINC001151248161	1379687019	/nfs/dbraw/zinc/68/70/19/1379687019.db2.gz	JFVPFGMCKAXCPX-ROUUACIJSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@@H](C)CC2CCCC2)CC1	ZINC001151345555	1379702380	/nfs/dbraw/zinc/70/23/80/1379702380.db2.gz	GZCDNYXDGSYAIS-KRWDZBQOSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)[C@H]2CC23CCCC3)CC1	ZINC001151387261	1379709521	/nfs/dbraw/zinc/70/95/21/1379709521.db2.gz	FJEVZYCBNQKDLP-QGZVFWFLSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2oc(CC)cc2C)CC1	ZINC001151398854	1379711023	/nfs/dbraw/zinc/71/10/23/1379711023.db2.gz	GCQZMTAZSLEEED-UHFFFAOYSA-N	0	3	348.487	3.327	20	30		EGEDHN
C=CC[C@@H](C(=O)NCCNCc1cccc(F)c1)c1ccccc1	ZINC001151838082	1379793172	/nfs/dbraw/zinc/79/31/72/1379793172.db2.gz	IADIZQFXTOVUJR-LJQANCHMSA-N	0	3	326.415	3.391	20	30		EGEDHN
C=C[C@H](C(=O)NCCNCc1ccc(OC)c(F)c1)c1ccccc1	ZINC001151990933	1379833915	/nfs/dbraw/zinc/83/39/15/1379833915.db2.gz	SQWXEZMYQLTOBP-KRWDZBQOSA-N	0	3	342.414	3.010	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)/C=C(\C)C1CC1	ZINC001152128139	1379868342	/nfs/dbraw/zinc/86/83/42/1379868342.db2.gz	HCIKNHMVIZUAMC-RBFDBLARSA-N	0	3	325.456	3.241	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)/C=C/C(C)(C)C	ZINC001152426072	1379931465	/nfs/dbraw/zinc/93/14/65/1379931465.db2.gz	KEXPTPJKCVSYMG-LPQFERQCSA-N	0	3	327.472	3.487	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)c1oc(C)cc1C	ZINC001152641333	1379960962	/nfs/dbraw/zinc/96/09/62/1379960962.db2.gz	GNAJIPJMWUHNOA-OAHLLOKOSA-N	0	3	339.439	3.409	20	30		EGEDHN
C[C@@H](CCCc1ccccc1)C(=O)NCCNCc1cccc(C#N)c1	ZINC001152761759	1379979313	/nfs/dbraw/zinc/97/93/13/1379979313.db2.gz	FYWFJGILACSXBZ-SFHVURJKSA-N	0	3	349.478	3.423	20	30		EGEDHN
CC(C)(C)[C@@H](CNCc1ccc(C#N)cc1F)NC(=O)[C@H]1CC1(C)C	ZINC001284575521	1379980207	/nfs/dbraw/zinc/98/02/07/1379980207.db2.gz	HTEWSYOKBSTVFV-NVXWUHKLSA-N	0	3	345.462	3.364	20	30		EGEDHN
CC1(C)CCCC[C@@H]1C(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001152911259	1379993185	/nfs/dbraw/zinc/99/31/85/1379993185.db2.gz	QLIVCSWVUNPPPU-MRXNPFEDSA-N	0	3	331.435	3.120	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)c1c(C)coc1C	ZINC001153176794	1380030826	/nfs/dbraw/zinc/03/08/26/1380030826.db2.gz	OYUPURLCEQMYPU-OAHLLOKOSA-N	0	3	339.439	3.409	20	30		EGEDHN
Cc1ccc(CCCCC(=O)NCCNCc2cccc(C#N)c2)cc1	ZINC001153190478	1380032684	/nfs/dbraw/zinc/03/26/84/1380032684.db2.gz	KMMOLNPVPFMNMR-UHFFFAOYSA-N	0	3	349.478	3.486	20	30		EGEDHN
Cc1ccccc1C(C)(C)C(=O)NCCNCc1ccc(C#N)cc1	ZINC001153649634	1380110194	/nfs/dbraw/zinc/11/01/94/1380110194.db2.gz	QZGHLFYYUNPPRU-UHFFFAOYSA-N	0	3	335.451	3.050	20	30		EGEDHN
CC1(C)CCCC[C@H]1CC(=O)NCCNCc1cccc(C#N)c1	ZINC001153836554	1380140506	/nfs/dbraw/zinc/14/05/06/1380140506.db2.gz	BLEIYNHDANDEFD-SFHVURJKSA-N	0	3	327.472	3.371	20	30		EGEDHN
CC1(C)CCC(CC(=O)NCCNCc2ccc(C#N)s2)CC1	ZINC001153869688	1380147129	/nfs/dbraw/zinc/14/71/29/1380147129.db2.gz	FTIKQYOLAYLQKT-UHFFFAOYSA-N	0	3	333.501	3.432	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@@H]1CCCC[C@@H]1C(F)(F)F	ZINC001154026135	1380183799	/nfs/dbraw/zinc/18/37/99/1380183799.db2.gz	MIECYKMIVCKUEJ-KFWWJZLASA-N	0	3	332.410	3.205	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)C12CCC(CC1)C2	ZINC001154026155	1380183850	/nfs/dbraw/zinc/18/38/50/1380183850.db2.gz	NCHQDOMOIFLAIK-ZGGTZUKQSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H](C)[C@H](CNC/C(Cl)=C\Cl)C2)C1	ZINC001754822665	1440693086	/nfs/dbraw/zinc/69/30/86/1440693086.db2.gz	NRQOWVWWZWBALU-SBDSJIHDSA-N	0	3	331.287	3.346	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)COc1ccc(C(C)C)cc1	ZINC001154198163	1380224921	/nfs/dbraw/zinc/22/49/21/1380224921.db2.gz	RGWAQTMRCZVZPY-QGZVFWFLSA-N	0	3	330.472	3.039	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@H](C)N(CC)CCOc1ccccc1F	ZINC001154751265	1380346030	/nfs/dbraw/zinc/34/60/30/1380346030.db2.gz	SREOECKMXKPXPU-QGZVFWFLSA-N	0	3	348.462	3.225	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H](C)N(CC)C[C@@H](O)c1ccccc1F	ZINC001154927868	1380378101	/nfs/dbraw/zinc/37/81/01/1380378101.db2.gz	QSWDRCIICGVVIT-CRAIPNDOSA-N	0	3	336.451	3.042	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@@H](C)N(CC)C[C@@H](O)c1ccccc1	ZINC001155072386	1380403603	/nfs/dbraw/zinc/40/36/03/1380403603.db2.gz	BFDBGKIHVGFGLH-YVWKXTFCSA-N	0	3	332.488	3.149	20	30		EGEDHN
CCN(CC#CCOC)[C@H](C)CNC(=O)C[C@H](C)CCC=C(C)C	ZINC001155407225	1380447296	/nfs/dbraw/zinc/44/72/96/1380447296.db2.gz	UVYXYLHSTAERDT-RTBURBONSA-N	0	3	336.520	3.235	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NCCCN[C@@H](C)c1c(F)cccc1F	ZINC001155440524	1380454087	/nfs/dbraw/zinc/45/40/87/1380454087.db2.gz	TUFQOCZUDYOULR-KBPBESRZSA-N	0	3	340.414	3.103	20	30		EGEDHN
C=C(Cl)CN(CC)[C@H](C)CNC(=O)CN(C)CCCCCC	ZINC001155878231	1380501912	/nfs/dbraw/zinc/50/19/12/1380501912.db2.gz	YKJOPYCYKJUAAE-MRXNPFEDSA-N	0	3	331.932	3.078	20	30		EGEDHN
CCN(Cc1ccc(C#N)cc1)[C@H](C)CNC(=O)C1(C)CC(F)(F)C1	ZINC001156324588	1380559215	/nfs/dbraw/zinc/55/92/15/1380559215.db2.gz	KMSHOJANKBLQMM-CQSZACIVSA-N	0	3	349.425	3.320	20	30		EGEDHN
Cc1ccc(C#N)c(N2CCC[C@@H](NCOCC[Si](C)(C)C)C2)n1	ZINC001156467013	1380579692	/nfs/dbraw/zinc/57/96/92/1380579692.db2.gz	XZYJVDQIFCRMFY-QGZVFWFLSA-N	0	3	346.551	3.132	20	30		EGEDHN
COc1nc(NC[C@@H](c2ccccc2)N2CCCC2)c(F)cc1C#N	ZINC001156530793	1380589329	/nfs/dbraw/zinc/58/93/29/1380589329.db2.gz	STEMOXVAQHJEOB-KRWDZBQOSA-N	0	3	340.402	3.350	20	30		EGEDHN
N#Cc1ccc(F)c(CNCCCNC(=O)C2=CCCCCC2)c1	ZINC001157048429	1380760224	/nfs/dbraw/zinc/76/02/24/1380760224.db2.gz	CXFUFIKFOGTGJR-UHFFFAOYSA-N	0	3	329.419	3.184	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@H](C)Cc1cccc(Cl)c1	ZINC001157363962	1380854380	/nfs/dbraw/zinc/85/43/80/1380854380.db2.gz	BFGJDXDGHLABQN-HZPDHXFCSA-N	0	3	334.891	3.369	20	30		EGEDHN
C=CCCC(=O)N1CCCC[C@@H]1CN(C)CCOc1ccccc1F	ZINC001157661757	1380992552	/nfs/dbraw/zinc/99/25/52/1380992552.db2.gz	ILHJVRSEGKFXPV-QGZVFWFLSA-N	0	3	348.462	3.484	20	30		EGEDHN
C=CCCC(=O)N1CCCC[C@@H]1CN(C)C[C@H](O)c1ccc(F)cc1	ZINC001157661966	1380993226	/nfs/dbraw/zinc/99/32/26/1380993226.db2.gz	RHXADFXQDAAVDQ-MOPGFXCFSA-N	0	3	348.462	3.138	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)C(C)=C1CCCC1	ZINC001157790370	1381033506	/nfs/dbraw/zinc/03/35/06/1381033506.db2.gz	JNXWIBMHXKFFKY-LJQANCHMSA-N	0	3	334.504	3.392	20	30		EGEDHN
C#CCCCCC(=O)N1CCCC[C@@H]1CN(C)CCOCCCC	ZINC001157856757	1381053035	/nfs/dbraw/zinc/05/30/35/1381053035.db2.gz	MFYDLKAFZQSBTO-LJQANCHMSA-N	0	3	336.520	3.310	20	30		EGEDHN
C#CCCCC(=O)N1CCCC[C@@H]1CN(C)CCOc1ccccc1	ZINC001157907839	1381067624	/nfs/dbraw/zinc/06/76/24/1381067624.db2.gz	IFYRTIFHHAAHFY-LJQANCHMSA-N	0	3	342.483	3.182	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)[C@H]1CCCC2(CC2)C1	ZINC001157964505	1381083813	/nfs/dbraw/zinc/08/38/13/1381083813.db2.gz	FJUWWMQBMXPGAG-RBUKOAKNSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)C(CC=C)CC=C	ZINC001157994681	1381096134	/nfs/dbraw/zinc/09/61/34/1381096134.db2.gz	RUNDBWANEQMIEM-LJQANCHMSA-N	0	3	334.504	3.270	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCCC[C@@H]1CN(C)C[C@@H]1CCCCO1	ZINC001158005422	1381100707	/nfs/dbraw/zinc/10/07/07/1381100707.db2.gz	UWAAZXZDDFPBJN-MSOLQXFVSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc2c(cn1)CCCC2	ZINC001158207077	1381158733	/nfs/dbraw/zinc/15/87/33/1381158733.db2.gz	PCZALEPZMBJRAK-GOSISDBHSA-N	0	3	327.472	3.073	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H](C)OCc1ccc(C)cc1	ZINC001158283267	1381184237	/nfs/dbraw/zinc/18/42/37/1381184237.db2.gz	IHTYUCVMLSUJSB-UYAOXDASSA-N	0	3	344.499	3.399	20	30		EGEDHN
C=CCCOc1ccc(C(=O)N2C[C@H]3c4ccccc4CN[C@@H]3C2)cc1	ZINC001158334690	1381205212	/nfs/dbraw/zinc/20/52/12/1381205212.db2.gz	CXUNVIZJCDYWQC-LEWJYISDSA-N	0	3	348.446	3.353	20	30		EGEDHN
C[C@@H]1CCC[C@@H]1CC(=O)NCCCNCc1cc(C#N)ccc1F	ZINC001158619077	1381325179	/nfs/dbraw/zinc/32/51/79/1381325179.db2.gz	SIDOAPILYWFHAC-GDBMZVCRSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1ccc2scnc2c1	ZINC001158689985	1381356741	/nfs/dbraw/zinc/35/67/41/1381356741.db2.gz	ZMSCGRJZNBOHMD-OAHLLOKOSA-N	0	3	329.469	3.409	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cn(CCCC)nc1C	ZINC001158739625	1381376666	/nfs/dbraw/zinc/37/66/66/1381376666.db2.gz	NYOMASHUIQQMCD-QGZVFWFLSA-N	0	3	332.492	3.104	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)[C@@H](C)C1CCCC1	ZINC001158744293	1381379175	/nfs/dbraw/zinc/37/91/75/1381379175.db2.gz	GSZXZYZXFPKDKA-PKOBYXMFSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)CCc1ccccc1OC	ZINC001158830299	1381422867	/nfs/dbraw/zinc/42/28/67/1381422867.db2.gz	YHWOFXICACDYFG-GOSISDBHSA-N	0	3	330.472	3.127	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)CCCc1nc(C(C)C)no1	ZINC001158865778	1381440578	/nfs/dbraw/zinc/44/05/78/1381440578.db2.gz	HAVIZJAMTKNNSA-MRXNPFEDSA-N	0	3	348.491	3.015	20	30		EGEDHN
C=C[C@@H](C(=O)N1CCCC[C@@H]1CN(C)CCOCC)c1ccccc1	ZINC001158900695	1381455461	/nfs/dbraw/zinc/45/54/61/1381455461.db2.gz	JYNLETHLQQVZPP-WOJBJXKFSA-N	0	3	344.499	3.306	20	30		EGEDHN
C=CCO[C@@H](C)C(=O)N1CCCC[C@@H]1CN(C)Cc1ccccc1	ZINC001158966647	1381489111	/nfs/dbraw/zinc/48/91/11/1381489111.db2.gz	OSSQELLRWXIWQJ-PKOBYXMFSA-N	0	3	330.472	3.091	20	30		EGEDHN
C=CCCC(=O)NCCC1=CCN(Cc2ccc3c(c2)COC3)CC1	ZINC001159539047	1381821975	/nfs/dbraw/zinc/82/19/75/1381821975.db2.gz	YYOJNSRGFZFPNK-UHFFFAOYSA-N	0	3	340.467	3.321	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCC1=CCN([C@@H](C)c2ccc(F)cc2)CC1	ZINC001159594383	1381840576	/nfs/dbraw/zinc/84/05/76/1381840576.db2.gz	PWJXXKGYVLGAHM-CABCVRRESA-N	0	3	329.419	3.185	20	30		EGEDHN
O=C(C#CC1CC1)NCCC1=CCN(C/C=C\c2ccccc2)CC1	ZINC001160081182	1381990784	/nfs/dbraw/zinc/99/07/84/1381990784.db2.gz	IINFYHZTKWIUDW-DAXSKMNVSA-N	0	3	334.463	3.252	20	30		EGEDHN
Cc1ccc(F)cc1CN1CC=C(CCNC(=O)C#CC2CC2)CC1	ZINC001160081284	1381991321	/nfs/dbraw/zinc/99/13/21/1381991321.db2.gz	KRMPMCJJFFSYFD-UHFFFAOYSA-N	0	3	340.442	3.186	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CO[C@@H]2CCCC[C@H]2CC)CC1	ZINC001160106834	1381997507	/nfs/dbraw/zinc/99/75/07/1381997507.db2.gz	DFNBLXBRKITSDX-RTBURBONSA-N	0	3	334.504	3.296	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@H](C)OCCCCCC)CC1	ZINC001160142230	1382013502	/nfs/dbraw/zinc/01/35/02/1382013502.db2.gz	BZBLIHRJVRQGCF-SFHVURJKSA-N	0	3	334.504	3.134	20	30		EGEDHN
C=C(Cl)CNCCCNC(=O)[C@@H]1CCCO[C@H]1c1ccccc1	ZINC001160178455	1382025944	/nfs/dbraw/zinc/02/59/44/1382025944.db2.gz	FTPLRLRMXJFFRI-SJORKVTESA-N	0	3	336.863	3.003	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CCOc2cc(C)cc(C)c2)CC1	ZINC001160286470	1382062466	/nfs/dbraw/zinc/06/24/66/1382062466.db2.gz	RIZJWYBUJJXALB-UHFFFAOYSA-N	0	3	342.483	3.397	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C2(c3ccc(F)cc3)CC2)CC1	ZINC001160296539	1382064762	/nfs/dbraw/zinc/06/47/62/1382064762.db2.gz	UVKNHPXYTJIMHR-UHFFFAOYSA-N	0	3	328.431	3.182	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CCc2ncc(C(C)(C)C)o2)CC1	ZINC001160374197	1382085752	/nfs/dbraw/zinc/08/57/52/1382085752.db2.gz	IMJJHGPIHXNAOG-UHFFFAOYSA-N	0	3	345.487	3.229	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)[C@@H]2CCCC[C@@H]2C2CC2)CC1	ZINC001160778044	1382193184	/nfs/dbraw/zinc/19/31/84/1382193184.db2.gz	DBSFACIIEOXHNQ-WOJBJXKFSA-N	0	3	328.500	3.365	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)[C@@H]1CCC=CCCC1	ZINC001160820710	1382208425	/nfs/dbraw/zinc/20/84/25/1382208425.db2.gz	RYMSGJFFZOTUCT-QGZVFWFLSA-N	0	3	325.456	3.291	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCC1=CCN(CCOCC(C)C)CC1	ZINC001160941771	1382244465	/nfs/dbraw/zinc/24/44/65/1382244465.db2.gz	PKLSHZPEYOQTGQ-MSOLQXFVSA-N	0	3	336.520	3.256	20	30		EGEDHN
C=CCN1CCC[C@H]1CNc1ccc(-c2ccccc2[N+](=O)[O-])nn1	ZINC001160957433	1382251361	/nfs/dbraw/zinc/25/13/61/1382251361.db2.gz	LMAKOSBGQUKQHX-AWEZNQCLSA-N	0	3	339.399	3.114	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCCC1=CCN(CCc2ccns2)CC1	ZINC001160967337	1382253690	/nfs/dbraw/zinc/25/36/90/1382253690.db2.gz	GLVVIMUFSAQZOA-INIZCTEOSA-N	0	3	347.528	3.426	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2ccc(F)c3ccncc23)CC1	ZINC001160979532	1382259668	/nfs/dbraw/zinc/25/96/68/1382259668.db2.gz	KLGOSBIBSQEFGB-UHFFFAOYSA-N	0	3	339.414	3.312	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2nccc3ccccc32)CC1	ZINC001161056980	1382285322	/nfs/dbraw/zinc/28/53/22/1382285322.db2.gz	VQDRTADSOKJWGS-UHFFFAOYSA-N	0	3	333.435	3.010	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2ccccc2-n2cccc2)CC1	ZINC001161083647	1382293532	/nfs/dbraw/zinc/29/35/32/1382293532.db2.gz	DXBKOFQIFKOGLX-UHFFFAOYSA-N	0	3	347.462	3.253	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)Cc2ccc(F)cc2Cl)CC1	ZINC001161101609	1382296970	/nfs/dbraw/zinc/29/69/70/1382296970.db2.gz	GLRMJXDSQAUUHU-UHFFFAOYSA-N	0	3	348.849	3.183	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C(C)(C)c2cccc(F)c2)CC1	ZINC001161195521	1382337457	/nfs/dbraw/zinc/33/74/57/1382337457.db2.gz	YDNAYVQHHKVWJZ-UHFFFAOYSA-N	0	3	330.447	3.428	20	30		EGEDHN
N#Cc1ccc(CN2CC=C(CCNC(=O)[C@H]3CC34CCC4)CC2)cc1	ZINC001161349981	1382379294	/nfs/dbraw/zinc/37/92/94/1382379294.db2.gz	XHZHUAGBYJEVEZ-HXUWFJFHSA-N	0	3	349.478	3.387	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C[C@@H]2CCc3ccccc32)CC1	ZINC001161510220	1382426729	/nfs/dbraw/zinc/42/67/29/1382426729.db2.gz	ZIYQSMIPVVBQHW-FQEVSTJZSA-N	0	3	336.479	3.268	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2cccc(C)c2Cl)CC1	ZINC001161513667	1382428030	/nfs/dbraw/zinc/42/80/30/1382428030.db2.gz	BHRNCOAGQSGTJP-UHFFFAOYSA-N	0	3	330.859	3.424	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cncc(C(F)(F)F)c2)CC1	ZINC001161640025	1382467135	/nfs/dbraw/zinc/46/71/35/1382467135.db2.gz	OWPUWOQWDODNLU-UHFFFAOYSA-N	0	3	339.361	3.038	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C(C)(C)c2ccc(F)cc2)CC1	ZINC001161738148	1382492098	/nfs/dbraw/zinc/49/20/98/1382492098.db2.gz	XNGVBEGXTWKSFI-UHFFFAOYSA-N	0	3	330.447	3.428	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@H](C)CCOc2ccccc2)CC1	ZINC001162003058	1382595904	/nfs/dbraw/zinc/59/59/04/1382595904.db2.gz	UUFGGVMPNLZNLS-GOSISDBHSA-N	0	3	342.483	3.416	20	30		EGEDHN
CN(C)/C=N/c1ccc(NCCc2ccc3c(c2)OCO3)cc1C#N	ZINC001162087884	1382626038	/nfs/dbraw/zinc/62/60/38/1382626038.db2.gz	UHCRUZZWTZCKNK-WSDLNYQXSA-N	0	3	336.395	3.163	20	30		EGEDHN
CC(C)=C[C@H]1[C@H](C(=O)NCCCNCc2ccccc2C#N)C1(C)C	ZINC001162157133	1382643224	/nfs/dbraw/zinc/64/32/24/1382643224.db2.gz	ROWVVIPKZNTMDI-RBUKOAKNSA-N	0	3	339.483	3.393	20	30		EGEDHN
N#Cc1c(Cl)c2cc(F)cc(Cl)c2nc1-n1cnc(CN)c1	ZINC001162302132	1382726955	/nfs/dbraw/zinc/72/69/55/1382726955.db2.gz	LJVOUGYIZGYPCD-UHFFFAOYSA-N	0	3	336.157	3.197	20	30		EGEDHN
C#CCN1CCC(CNC(=O)C[C@H](C)CCC=C(C)C)(COC)CC1	ZINC001162507514	1382775957	/nfs/dbraw/zinc/77/59/57/1382775957.db2.gz	ZBMMYHXTTNPEQQ-LJQANCHMSA-N	0	3	348.531	3.237	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)[C@@H](c1ccccc1)C1CC1	ZINC001162508301	1382776601	/nfs/dbraw/zinc/77/66/01/1382776601.db2.gz	UHPFHGMRJMATBY-NRFANRHFSA-N	0	3	347.462	3.348	20	30		EGEDHN
Cc1cc(Cl)cc(C(=O)NCCCNCc2ccccc2C#N)c1	ZINC001162589326	1382800910	/nfs/dbraw/zinc/80/09/10/1382800910.db2.gz	RZCMJXCDDJPUNI-UHFFFAOYSA-N	0	3	341.842	3.430	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)c1oc(C)cc1C	ZINC001162763836	1382863817	/nfs/dbraw/zinc/86/38/17/1382863817.db2.gz	LGIXVYRWVABHRH-UHFFFAOYSA-N	0	3	338.451	3.194	20	30		EGEDHN
C[C@H](N)c1nc2ccccc2n1-c1cnc(C#N)c(C(F)(F)F)c1	ZINC001162765784	1382865639	/nfs/dbraw/zinc/86/56/39/1382865639.db2.gz	KCYZSDIDCZQIFK-VIFPVBQESA-N	0	3	331.301	3.331	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@H](C)CCCC	ZINC001162798599	1382876358	/nfs/dbraw/zinc/87/63/58/1382876358.db2.gz	ZDNMUQZWBCRJAN-LJQANCHMSA-N	0	3	328.500	3.497	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H]1C[C@]1(CC)C(C)C	ZINC001162970861	1382932964	/nfs/dbraw/zinc/93/29/64/1382932964.db2.gz	NOFGCIIUPRQFQA-IFMALSPDSA-N	0	3	340.511	3.353	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C[C@H]1CCCC[C@@H]1C	ZINC001163007736	1382947381	/nfs/dbraw/zinc/94/73/81/1382947381.db2.gz	XZIUIIKJDIQLKI-PZJWPPBQSA-N	0	3	340.511	3.497	20	30		EGEDHN
CCOC(=O)c1cc(N[C@H]2CNCc3ccsc32)ccc1C#N	ZINC001163229822	1383000039	/nfs/dbraw/zinc/00/00/39/1383000039.db2.gz	LNTLLSGAJPYUNH-HNNXBMFYSA-N	0	3	327.409	3.053	20	30		EGEDHN
COCCN(C)[C@H](CNc1ncccc1C#N)c1ccc(Cl)cc1	ZINC001163385672	1383038791	/nfs/dbraw/zinc/03/87/91/1383038791.db2.gz	OOHQDQLIWDOYJY-QGZVFWFLSA-N	0	3	344.846	3.338	20	30		EGEDHN
C[C@@H]1CCC[C@@H](C)N1c1nccnc1C(C#N)C(=O)OC(C)(C)C	ZINC001163549866	1383076219	/nfs/dbraw/zinc/07/62/19/1383076219.db2.gz	GWJWWCKUVINBCG-MCIONIFRSA-N	0	3	330.432	3.193	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCCCNCc1cnc(-c2ccccc2)o1	ZINC001164223879	1383168066	/nfs/dbraw/zinc/16/80/66/1383168066.db2.gz	XFUAISUQZSUESN-CVEARBPZSA-N	0	3	341.455	3.396	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCCCNCc1ccn(C(CC)CC)n1	ZINC001164345508	1383179226	/nfs/dbraw/zinc/17/92/26/1383179226.db2.gz	AOGAIRGEPJXXOJ-MRXNPFEDSA-N	0	3	334.508	3.442	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)Cc2ccc(F)cc2F)CC1	ZINC001164592502	1383203352	/nfs/dbraw/zinc/20/33/52/1383203352.db2.gz	GPCLATWBQYVJDI-UHFFFAOYSA-N	0	3	342.817	3.136	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NCCC1(CNCc2ocnc2C)CC1	ZINC001164693374	1383218550	/nfs/dbraw/zinc/21/85/50/1383218550.db2.gz	TXJAHCOEZLTJEB-UHFFFAOYSA-N	0	3	339.867	3.138	20	30		EGEDHN
N#Cc1cc(C(F)(F)N2CCN[C@@H](c3ccccc3)C2)cc(Cl)n1	ZINC001165195594	1383244594	/nfs/dbraw/zinc/24/45/94/1383244594.db2.gz	OFGGRALBOBAAET-OAHLLOKOSA-N	0	3	348.784	3.302	20	30		EGEDHN
COc1cc(N2C[C@H](C)N(Cc3ccccc3)C[C@@H]2C)ncc1C#N	ZINC001165201165	1383247001	/nfs/dbraw/zinc/24/70/01/1383247001.db2.gz	LLYFQVBIMYQKBT-HOTGVXAUSA-N	0	3	336.439	3.061	20	30		EGEDHN
C=CCn1ccc2c1ncnc2NCC1CN(Cc2ccccc2)C1	ZINC001165427393	1383293855	/nfs/dbraw/zinc/29/38/55/1383293855.db2.gz	PCXAXSHQBKMUCG-UHFFFAOYSA-N	0	3	333.439	3.161	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)C[C@H]2CCC[C@@H](OC)C2)CC1	ZINC001165440524	1383297153	/nfs/dbraw/zinc/29/71/53/1383297153.db2.gz	ILXBUZVKSQTZLZ-JKSUJKDBSA-N	0	3	342.911	3.210	20	30		EGEDHN
C=CCCC1(C(=O)NCCCNCc2oc(C(C)C)nc2C)CC1	ZINC001165914243	1383363782	/nfs/dbraw/zinc/36/37/82/1383363782.db2.gz	WXUCXTKXQLWVCI-UHFFFAOYSA-N	0	3	333.476	3.449	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cc(C(C)(C)C)on2)CC1	ZINC001166116909	1383392156	/nfs/dbraw/zinc/39/21/56/1383392156.db2.gz	MWMPBBCVPSDFHT-UHFFFAOYSA-N	0	3	339.867	3.214	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCC1(CNCc2nc(C)cs2)CC1	ZINC001166692133	1383461814	/nfs/dbraw/zinc/46/18/14/1383461814.db2.gz	AZWWWDXMHUKQLO-ZFWWWQNUSA-N	0	3	335.517	3.286	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCC1(CNCc2ccccc2C#N)CC1	ZINC001166696171	1383462763	/nfs/dbraw/zinc/46/27/63/1383462763.db2.gz	XJNNQXKNSGPQGW-IRXDYDNUSA-N	0	3	339.483	3.393	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCCC1(CNCc2nc(C)cs2)CC1	ZINC001166756063	1383472525	/nfs/dbraw/zinc/47/25/25/1383472525.db2.gz	QODLMSQTPXAGEK-OAHLLOKOSA-N	0	3	335.517	3.430	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)NCCC1(CNCc2nc(C)cs2)CC1	ZINC001166756062	1383472610	/nfs/dbraw/zinc/47/26/10/1383472610.db2.gz	QODLMSQTPXAGEK-HNNXBMFYSA-N	0	3	335.517	3.430	20	30		EGEDHN
N#Cc1ccccc1CNCC1(CCNC(=O)[C@H]2CC[C@@H](F)C2)CC1	ZINC001166850980	1383487347	/nfs/dbraw/zinc/48/73/47/1383487347.db2.gz	QMQXOZURYYTMBO-MAUKXSAKSA-N	0	3	343.446	3.073	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)Cc2c(F)cccc2F)CC1	ZINC001166881484	1383493088	/nfs/dbraw/zinc/49/30/88/1383493088.db2.gz	DLKGLUQXODWXAE-UHFFFAOYSA-N	0	3	342.817	3.136	20	30		EGEDHN
C=C1CCC(C(=O)NCCC2(CNCc3ccc(F)cn3)CC2)CC1	ZINC001167012321	1383517450	/nfs/dbraw/zinc/51/74/50/1383517450.db2.gz	MXMNZTNRQWBNOM-UHFFFAOYSA-N	0	3	345.462	3.343	20	30		EGEDHN
C[NH2+]Cc1cccc(Nc2nc(SC)nc(Cl)c2/C=N/[O-])c1	ZINC001167032681	1383523933	/nfs/dbraw/zinc/52/39/33/1383523933.db2.gz	JCLUNWGWKKDNQB-CAOOACKPSA-N	0	3	337.836	3.123	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc3cc[nH]c3c2)CC1	ZINC001167328599	1383599692	/nfs/dbraw/zinc/59/96/92/1383599692.db2.gz	LUZHWZZYLMJTOH-UHFFFAOYSA-N	0	3	331.847	3.410	20	30		EGEDHN
N#Cc1ccc(CNCCCNC(=O)[C@@H](F)c2ccccc2)c(F)c1	ZINC001167372506	1383613988	/nfs/dbraw/zinc/61/39/88/1383613988.db2.gz	MEBZGRMKIJGIRX-SFHVURJKSA-N	0	3	343.377	3.004	20	30		EGEDHN
CCCCCCC[NH2+]CCCNC(=O)c1nnc2ccccc2c1[O-]	ZINC001167491806	1383650729	/nfs/dbraw/zinc/65/07/29/1383650729.db2.gz	PXUQTPJGCISXOL-UHFFFAOYSA-N	0	3	344.459	3.015	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)C[C@H]1CCc2ccccc21	ZINC001168834947	1384026372	/nfs/dbraw/zinc/02/63/72/1384026372.db2.gz	HCLNDUXTRHDQRX-GOSISDBHSA-N	0	3	347.462	3.274	20	30		EGEDHN
C[C@@](C#N)(Nc1ccc2c(n1)OCCNC2)c1ccccc1Cl	ZINC001169379028	1384141843	/nfs/dbraw/zinc/14/18/43/1384141843.db2.gz	GEQVVIXKWGQVFN-KRWDZBQOSA-N	0	3	328.803	3.068	20	30		EGEDHN
CCOC(=O)[C@H]1CC[C@H](N(CCC#N)C2CCCCCCC2)CO1	ZINC001169394250	1384143519	/nfs/dbraw/zinc/14/35/19/1384143519.db2.gz	WKMDNQRGCGQRLE-ZWKOTPCHSA-N	0	3	336.476	3.426	20	30		EGEDHN
CC[C@@H]1CCN([C@@H](C)C(=O)N(CCC#N)c2ccccc2OC)[C@H]1C	ZINC001169494838	1384154759	/nfs/dbraw/zinc/15/47/59/1384154759.db2.gz	OKHBIIOWAACEBM-YESZJQIVSA-N	0	3	343.471	3.451	20	30		EGEDHN
COC(=O)c1cc(C#N)ccc1-n1c(-c2ccccc2)cnc1[C@H](C)N	ZINC001170680617	1384364294	/nfs/dbraw/zinc/36/42/94/1384364294.db2.gz	BSCYVNOLSZVSNS-ZDUSSCGKSA-N	0	3	346.390	3.217	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H](C)CCCCNCc1cn(C(C)C)nn1	ZINC001171008510	1384428867	/nfs/dbraw/zinc/42/88/67/1384428867.db2.gz	NHKBPDHECVTROB-INIZCTEOSA-N	0	3	349.523	3.226	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H](C)CCCCNCc1nnc(C)n1C1CC1	ZINC001171035540	1384434131	/nfs/dbraw/zinc/43/41/31/1384434131.db2.gz	MTDUOWWYAGXAQN-OAHLLOKOSA-N	0	3	347.507	3.042	20	30		EGEDHN
N#Cc1cccc2c1CC[C@H]2Nc1cncc([C@@H]2CN3CCC2CC3)n1	ZINC001171064616	1384439913	/nfs/dbraw/zinc/43/99/13/1384439913.db2.gz	IPSCINANPYOSNM-RTBURBONSA-N	0	3	345.450	3.257	20	30		EGEDHN
C[C@@H](Cc1cccc(C#N)c1)N1CCCC[C@@](O)(C(F)(F)F)C1	ZINC001171208548	1384468861	/nfs/dbraw/zinc/46/88/61/1384468861.db2.gz	DEXKYRMYYNGVHF-BBRMVZONSA-N	0	3	326.362	3.269	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1scnc1CC	ZINC001316872319	1384657021	/nfs/dbraw/zinc/65/70/21/1384657021.db2.gz	BKCHQZGSYWZROM-JSGCOSHPSA-N	0	3	341.908	3.431	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1cnn(C(C)C)c1	ZINC001316878613	1384663318	/nfs/dbraw/zinc/66/33/18/1384663318.db2.gz	HXOKIHWKLYJUCN-GOEBONIOSA-N	0	3	338.883	3.189	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)NCc1cccnc1Br	ZINC001172300497	1384763671	/nfs/dbraw/zinc/76/36/71/1384763671.db2.gz	WKVHSSRSERNPOW-GFCCVEGCSA-N	0	3	330.229	3.437	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)N1CCC[C@H](NC(=O)OC(C)(C)C)C1	ZINC001172307167	1384765241	/nfs/dbraw/zinc/76/52/41/1384765241.db2.gz	CLYWUYBOMLFVQE-YJBOKZPZSA-N	0	3	343.471	3.478	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)N1CC[C@](O)(C(F)(F)F)[C@@H](C)C1	ZINC001172316542	1384768156	/nfs/dbraw/zinc/76/81/56/1384768156.db2.gz	ULQWCYXCFBKBDW-WOSRLPQWSA-N	0	3	326.362	3.124	20	30		EGEDHN
N#CCC1CCC(N2CCN(c3ccc(C#N)cc3F)CC2)CC1	ZINC001173337599	1384961748	/nfs/dbraw/zinc/96/17/48/1384961748.db2.gz	PVTSWKCVIRYUHO-UHFFFAOYSA-N	0	3	326.419	3.292	20	30		EGEDHN
C[C@@H]([NH2+]C1CCN(C(=O)c2ccc(C#N)cc2)CC1)c1ccccc1[O-]	ZINC001173424808	1384969587	/nfs/dbraw/zinc/96/95/87/1384969587.db2.gz	LJQPKGUOZHAAOT-OAHLLOKOSA-N	0	3	349.434	3.219	20	30		EGEDHN
C=CCO[C@H]1CO[C@@]2(C1)CCCN(C1Cc3cc(F)c(F)cc3C1)C2	ZINC001173482339	1384979180	/nfs/dbraw/zinc/97/91/80/1384979180.db2.gz	IAVVDFGANMYXFU-YLJYHZDGSA-N	0	3	349.421	3.258	20	30		EGEDHN
C[C@H](CC(=O)NCCCNCc1ccc(C#N)cc1F)C(C)(C)C	ZINC001174572275	1385121114	/nfs/dbraw/zinc/12/11/14/1385121114.db2.gz	VJZVYSVJUGWCPE-CQSZACIVSA-N	0	3	333.451	3.366	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H](C)CCCCNCc1cc(C)n(C)n1	ZINC001174651326	1385130619	/nfs/dbraw/zinc/13/06/19/1385130619.db2.gz	WMYIYSUOMDQAEN-OAHLLOKOSA-N	0	3	334.508	3.095	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@@H](C)CCCCNCc1nnc(C(C)C)[nH]1	ZINC001174848635	1385159285	/nfs/dbraw/zinc/15/92/85/1385159285.db2.gz	FJBNJOBGIANULE-HOTGVXAUSA-N	0	3	349.523	3.295	20	30		EGEDHN
CCN(CCNC(=O)c1csc(C)c1C)Cc1cccc(C#N)c1	ZINC001317480006	1385176268	/nfs/dbraw/zinc/17/62/68/1385176268.db2.gz	QIZBGIMBVVTJII-UHFFFAOYSA-N	0	3	341.480	3.489	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](C)CCCCNCc2cc(C)n(C)n2)CC1	ZINC001175074793	1385190876	/nfs/dbraw/zinc/19/08/76/1385190876.db2.gz	ZUVLOUQBQLLUGI-MRXNPFEDSA-N	0	3	346.519	3.240	20	30		EGEDHN
CCCN(CCNC(=O)[C@@H](C)C#N)Cc1cc(Cl)cc(Cl)c1	ZINC001317538502	1385270946	/nfs/dbraw/zinc/27/09/46/1385270946.db2.gz	KVYQOXSKJPKFQF-LBPRGKRZSA-N	0	3	342.270	3.481	20	30		EGEDHN
CCCN(CCNC(=O)c1cccc(F)c1)Cc1ccc(C#N)cc1	ZINC001317539011	1385273092	/nfs/dbraw/zinc/27/30/92/1385273092.db2.gz	OSSMLXXZIMMUPL-UHFFFAOYSA-N	0	3	339.414	3.339	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1cccc(C2CC2)c1	ZINC001177116657	1385818790	/nfs/dbraw/zinc/81/87/90/1385818790.db2.gz	ORZINLAFBBZYEP-UHFFFAOYSA-N	0	3	333.435	3.345	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)CCc2ccon2)CCCC[C@@H]1C	ZINC001318745998	1385852094	/nfs/dbraw/zinc/85/20/94/1385852094.db2.gz	QBYYMBFXLNILQB-SUMWQHHRSA-N	0	3	339.867	3.014	20	30		EGEDHN
C#CCC[NH2+]CCCN(CC1CCCC1)C(=O)c1ccccc1[O-]	ZINC001177218257	1385870483	/nfs/dbraw/zinc/87/04/83/1385870483.db2.gz	OOHJDJCBJZDGIJ-UHFFFAOYSA-N	0	3	328.456	3.028	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@@H](C)OCC	ZINC001177225269	1385874491	/nfs/dbraw/zinc/87/44/91/1385874491.db2.gz	GKJKEEZPVPFHJR-OAHLLOKOSA-N	0	3	330.900	3.162	20	30		EGEDHN
C=CCCC(=O)N(CCCNCc1ccn(CC)n1)CC1CCCC1	ZINC001177245961	1385882730	/nfs/dbraw/zinc/88/27/30/1385882730.db2.gz	REFRUWZKZNFCRD-UHFFFAOYSA-N	0	3	346.519	3.368	20	30		EGEDHN
Cc1cnc2ccccc2c1N1CCN(c2cc(C#N)ccn2)CC1	ZINC001319130734	1385970325	/nfs/dbraw/zinc/97/03/25/1385970325.db2.gz	IWQAWCXROUPMKT-UHFFFAOYSA-N	0	3	329.407	3.137	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@H](C)CCOC	ZINC001177484721	1385974448	/nfs/dbraw/zinc/97/44/48/1385974448.db2.gz	IPWZBTAIMNCCRJ-OAHLLOKOSA-N	0	3	344.927	3.410	20	30		EGEDHN
Cc1cc(F)cc(C(=O)NC[C@@H](C)CNCc2ccccc2C#N)c1	ZINC001319243090	1386022120	/nfs/dbraw/zinc/02/21/20/1386022120.db2.gz	TZSGPGKORFIARA-HNNXBMFYSA-N	0	3	339.414	3.162	20	30		EGEDHN
C[C@H](C#N)C(=O)NCC1(NCc2cccc(Cl)c2F)CCCC1	ZINC001319340497	1386067428	/nfs/dbraw/zinc/06/74/28/1386067428.db2.gz	KSNLBCCHTSZIRC-GFCCVEGCSA-N	0	3	337.826	3.157	20	30		EGEDHN
C=C(Br)CNC1(CNC(=O)[C@H](CC)SC)CCCC1	ZINC001319350948	1386073277	/nfs/dbraw/zinc/07/32/77/1386073277.db2.gz	HHDRLFAVNCGSEV-LBPRGKRZSA-N	0	3	349.338	3.055	20	30		EGEDHN
CC(C)CCC(=O)N1CC[C@H](NCc2ccc(C#N)c(F)c2)[C@@H]1C	ZINC001178101878	1386128789	/nfs/dbraw/zinc/12/87/89/1386128789.db2.gz	JRPXOGQTVJIBGX-KSSFIOAISA-N	0	3	331.435	3.213	20	30		EGEDHN
CCCCCC(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@@H]1C	ZINC001178117161	1386134839	/nfs/dbraw/zinc/13/48/39/1386134839.db2.gz	YXDUXYMRBOIARC-LPHOPBHVSA-N	0	3	330.447	3.337	20	30		EGEDHN
C[C@@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)CCCC1CC1	ZINC001319513825	1386155355	/nfs/dbraw/zinc/15/53/55/1386155355.db2.gz	CWUUSASAYLYCFR-AWEZNQCLSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2ccc3c(c2)CCOC3)CCCC1	ZINC001698631652	1406275600	/nfs/dbraw/zinc/27/56/00/1406275600.db2.gz	QYPHYMCJUFBPAN-UHFFFAOYSA-N	0	3	348.874	3.144	20	30		EGEDHN
C#CCCCCC(=O)NCCCCCCNCc1ncc(C)s1	ZINC001178253841	1386173942	/nfs/dbraw/zinc/17/39/42/1386173942.db2.gz	KNHUKRVIRXJHOI-UHFFFAOYSA-N	0	3	335.517	3.411	20	30		EGEDHN
C=CCOCC(=O)N1CC[C@H](N[C@@H](C)c2ccccc2Cl)[C@@H]1C	ZINC001178335762	1386192236	/nfs/dbraw/zinc/19/22/36/1386192236.db2.gz	JIOBDNQSINHGBY-ZQIUZPCESA-N	0	3	336.863	3.183	20	30		EGEDHN
C[C@H](C(=O)N1CC[C@H](NCC#Cc2cccc(Cl)c2)[C@@H]1C)C1CC1	ZINC001178428187	1386214824	/nfs/dbraw/zinc/21/48/24/1386214824.db2.gz	ZHCXPJZBYOKIKS-DOXZYTNZSA-N	0	3	344.886	3.317	20	30		EGEDHN
COc1ccc(Cl)cc1CN[C@H]1CCN(C(=O)C#CC(C)C)[C@H]1C	ZINC001178660623	1386271174	/nfs/dbraw/zinc/27/11/74/1386271174.db2.gz	YTZMXGYVJXHTAB-YOEHRIQHSA-N	0	3	348.874	3.087	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCCCCCNCc1csnc1OC	ZINC001179234939	1386428361	/nfs/dbraw/zinc/42/83/61/1386428361.db2.gz	CMTHJDQYUNPXKK-UHFFFAOYSA-N	0	3	339.505	3.130	20	30		EGEDHN
C=CC(C)(C)C(=O)NCCCCCCNCc1nccn1C(F)F	ZINC001179235622	1386428802	/nfs/dbraw/zinc/42/88/02/1386428802.db2.gz	XIQXQALADWYZMP-UHFFFAOYSA-N	0	3	342.434	3.257	20	30		EGEDHN
CC#CCCCC(=O)NCCCCCCNCc1nc(C)cs1	ZINC001179316096	1386449492	/nfs/dbraw/zinc/44/94/92/1386449492.db2.gz	QMKJSJUAMDJCJX-UHFFFAOYSA-N	0	3	335.517	3.411	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NCCCCCCNCc1cc(C)n(C)n1	ZINC001179335635	1386454797	/nfs/dbraw/zinc/45/47/97/1386454797.db2.gz	OKVPDIWWLSTMPO-INIZCTEOSA-N	0	3	334.508	3.097	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCCCCCCNCc1cc(C)n(C)n1	ZINC001179339924	1386456557	/nfs/dbraw/zinc/45/65/57/1386456557.db2.gz	PHLQUFXOOGPWLR-QGZVFWFLSA-N	0	3	334.508	3.097	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)c1cc2ccccn2c1)C1CC1	ZINC001698649558	1406298507	/nfs/dbraw/zinc/29/85/07/1406298507.db2.gz	RNCFHXSJBPSDSZ-SFHVURJKSA-N	0	3	331.847	3.180	20	30		EGEDHN
C[C@@H]1C[C@H]1CC(=O)NCCCCCCNCc1ccccc1C#N	ZINC001179474224	1386491559	/nfs/dbraw/zinc/49/15/59/1386491559.db2.gz	CVNIDVDLCONNIE-APWZRJJASA-N	0	3	327.472	3.371	20	30		EGEDHN
CC(C)[C@@H](C)C(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@@H]1C	ZINC001179639948	1386538204	/nfs/dbraw/zinc/53/82/04/1386538204.db2.gz	WLNVLCYYHLYNPC-GJYPPUQNSA-N	0	3	330.447	3.048	20	30		EGEDHN
C[C@H]1[C@@H](NCc2ccc(C#N)s2)CCN1C(=O)CCC1(C)CC1	ZINC001179844479	1386605088	/nfs/dbraw/zinc/60/50/88/1386605088.db2.gz	KRKUHEUREWHWFN-BBRMVZONSA-N	0	3	331.485	3.279	20	30		EGEDHN
COc1ccc2c(c1)[C@H](N[C@@H](C)CC1(C#N)CCOCC1)CCO2	ZINC001180586774	1386842431	/nfs/dbraw/zinc/84/24/31/1386842431.db2.gz	YDLBXQZPZQGKCG-WMLDXEAASA-N	0	3	330.428	3.207	20	30		EGEDHN
CC[C@H](C)C(=O)N1C[C@@H](C)[C@](C)(CNCc2ccccc2C#N)C1	ZINC001180633855	1386854255	/nfs/dbraw/zinc/85/42/55/1386854255.db2.gz	UPBYOTVDTOOKJY-RZQQEMMASA-N	0	3	327.472	3.179	20	30		EGEDHN
Cc1csc(CNC[C@]2(C)CN(C(=O)C#CC(C)(C)C)C[C@H]2C)n1	ZINC001181419355	1386991183	/nfs/dbraw/zinc/99/11/83/1386991183.db2.gz	AGMHNDWZBKIPKG-AUUYWEPGSA-N	0	3	347.528	3.075	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](C)[C@](C)(CN[C@H](C)c2cnccn2)C1	ZINC001181594131	1387021707	/nfs/dbraw/zinc/02/17/07/1387021707.db2.gz	IIDDFEGNCDRTBX-JXXFODFXSA-N	0	3	344.503	3.214	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H](C)CNCc2ccc(C#N)s2)cc1C	ZINC001322065353	1387044100	/nfs/dbraw/zinc/04/41/00/1387044100.db2.gz	ZCDXVTOUIZLAST-AWEZNQCLSA-N	0	3	327.453	3.145	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H](C)[C@](C)(CNCc3cc(C)no3)C2)CC1	ZINC001182499801	1387178529	/nfs/dbraw/zinc/17/85/29/1387178529.db2.gz	RCVMUCJXUYNSFF-FOIQADDNSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@@H](C)[C@](C)(CNCc2ocnc2C)C1	ZINC001182525198	1387181846	/nfs/dbraw/zinc/18/18/46/1387181846.db2.gz	ZREJRJXVQHMKMZ-NIKGAXFTSA-N	0	3	333.476	3.160	20	30		EGEDHN
CCC(C)(C)CC(=O)N1CC[C@@H](NCc2ccc(OC)c(C#N)c2)C1	ZINC001182848163	1387234758	/nfs/dbraw/zinc/23/47/58/1387234758.db2.gz	MBPLOCSQSKJIKD-QGZVFWFLSA-N	0	3	343.471	3.084	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)Cc1ccccc1OC	ZINC001329356149	1389072709	/nfs/dbraw/zinc/07/27/09/1389072709.db2.gz	JJTXATXJVRSVEU-UHFFFAOYSA-N	0	3	338.879	3.064	20	30		EGEDHN
CC(C)(NC(=O)[C@H](N)CCCC#N)c1ccc(C(F)(F)F)cc1	ZINC001337068000	1389247532	/nfs/dbraw/zinc/24/75/32/1389247532.db2.gz	CGJQFXCLEAMKRZ-CYBMUJFWSA-N	0	3	327.350	3.078	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC(CCNC[C@H](C#N)CCC#N)CC1	ZINC001338417296	1389679972	/nfs/dbraw/zinc/67/99/72/1389679972.db2.gz	CVKCAWMEFDSBEG-INIZCTEOSA-N	0	3	334.464	3.057	20	30		EGEDHN
N#Cc1cc(Cl)ncc1NC(=O)C(C[C@H]1CCCO1)C(F)(F)F	ZINC001339028576	1389866237	/nfs/dbraw/zinc/86/62/37/1389866237.db2.gz	PXCPZZQKZWZORS-NXEZZACHSA-N	0	3	347.724	3.293	20	30		EGEDHN
Cc1ccc(C2=NO[C@@H](CN[C@@H](C)CC3(C#N)CCOCC3)C2)cc1	ZINC001332725461	1390170986	/nfs/dbraw/zinc/17/09/86/1390170986.db2.gz	SOPMPENTHQHIRW-FUHWJXTLSA-N	0	3	341.455	3.177	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1ccc(C(=O)NC2CCCCC2)cc1	ZINC001339990584	1390204288	/nfs/dbraw/zinc/20/42/88/1390204288.db2.gz	UUWWHABHWUPYJQ-SFHVURJKSA-N	0	3	343.471	3.371	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1cc(-c2nc(CC)no2)ccc1C	ZINC001340123072	1390231184	/nfs/dbraw/zinc/23/11/84/1390231184.db2.gz	SXIQYIMGAHTIHD-CQSZACIVSA-N	0	3	328.416	3.230	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N(Cc1nc2ccccc2s1)C1CC1	ZINC001341006454	1390423808	/nfs/dbraw/zinc/42/38/08/1390423808.db2.gz	XFOITUFVZMSLPW-AWEZNQCLSA-N	0	3	329.469	3.471	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N[C@H](c1cccc(F)c1)c1ccccn1	ZINC001341859017	1390538865	/nfs/dbraw/zinc/53/88/65/1390538865.db2.gz	VPUAQDWETMTOLS-SJLPKXTDSA-N	0	3	327.403	3.110	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1cccc2c1CN(c1ccccn1)C2	ZINC001341890297	1390545268	/nfs/dbraw/zinc/54/52/68/1390545268.db2.gz	XQLMQNLSNMSTGV-QGZVFWFLSA-N	0	3	336.439	3.224	20	30		EGEDHN
CCCc1c(C(=O)C(C#N)c2nccn2C)cnn1C1CCCC1	ZINC001342164704	1390580525	/nfs/dbraw/zinc/58/05/25/1390580525.db2.gz	IAUXRVPPBAXKLY-AWEZNQCLSA-N	0	3	325.416	3.174	20	30		EGEDHN
N#CC(C(=O)CCc1cccnc1)c1nccn1Cc1ccccc1	ZINC001342604354	1390630910	/nfs/dbraw/zinc/63/09/10/1390630910.db2.gz	OWHMOVNZNWSREJ-SFHVURJKSA-N	0	3	330.391	3.135	20	30		EGEDHN
CCCc1c(C(=O)C(C#N)c2nccn2C)cnn1-c1ccccc1	ZINC001342924295	1390673077	/nfs/dbraw/zinc/67/30/77/1390673077.db2.gz	LHEKZQVCQBOSBF-HNNXBMFYSA-N	0	3	333.395	3.048	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)Nc1ccc2oc(=O)n(C)c2c1	ZINC001343234711	1390701124	/nfs/dbraw/zinc/70/11/24/1390701124.db2.gz	UIPAYIRIRYSGIA-CQSZACIVSA-N	0	3	333.432	3.148	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)Nc2cncc(C(F)(F)F)c2)CC1	ZINC001345930353	1390894594	/nfs/dbraw/zinc/89/45/94/1390894594.db2.gz	CENCAPRLQNCDPV-UHFFFAOYSA-N	0	3	342.365	3.262	20	30		EGEDHN
CCn1nc(C)c(C(=O)C(C#N)c2nccn2Cc2ccccc2)c1C	ZINC001346537130	1390950903	/nfs/dbraw/zinc/95/09/03/1390950903.db2.gz	GLZGLDNWIBUQEJ-KRWDZBQOSA-N	0	3	347.422	3.255	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)CCc1ccc(OC(F)F)cc1	ZINC001347338598	1391057455	/nfs/dbraw/zinc/05/74/55/1391057455.db2.gz	SEEWQXTWSOFDNZ-CQSZACIVSA-N	0	3	333.338	3.313	20	30		EGEDHN
CC(C)O[C@H](C(=O)C(C#N)c1ncc(Cl)n1C)c1ccccc1	ZINC001349703279	1391355740	/nfs/dbraw/zinc/35/57/40/1391355740.db2.gz	WGKXCWPHENJXMO-BBRMVZONSA-N	0	3	331.803	3.416	20	30		EGEDHN
N#CC(C(=O)c1n[nH]c2c1CCCC2)c1nc2c(cccc2Cl)[nH]1	ZINC001349759817	1391363138	/nfs/dbraw/zinc/36/31/38/1391363138.db2.gz	CQQWDYHVOKQIME-SNVBAGLBSA-N	0	3	339.786	3.308	20	30		EGEDHN
C#CC[C@@H](CC)c1nnc(N2CCN([C@H](C)CC)CC2)n1CC1CC1	ZINC001351432742	1391639157	/nfs/dbraw/zinc/63/91/57/1391639157.db2.gz	CWKGSZXDELOUJG-SJLPKXTDSA-N	0	3	343.519	3.126	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)N[C@H](C)c1ccc2c(c1)CC(=O)N2	ZINC001353193215	1391956371	/nfs/dbraw/zinc/95/63/71/1391956371.db2.gz	TWNWGWYASSYDPF-PBHICJAKSA-N	0	3	345.487	3.436	20	30		EGEDHN
C=C(Br)CN[C@@H](C)[C@@H]1CCCCN1C(=O)C(C)(C)F	ZINC001479817435	1392409412	/nfs/dbraw/zinc/40/94/12/1392409412.db2.gz	GLQAIQQIIWHZJC-RYUDHWBXSA-N	0	3	335.261	3.002	20	30		EGEDHN
CCCC1(C(=O)NC[C@H](NCc2ccc(C#N)cc2F)C2CC2)CC1	ZINC001480045498	1392549300	/nfs/dbraw/zinc/54/93/00/1392549300.db2.gz	YADUKFOAHUJCPE-SFHVURJKSA-N	0	3	343.446	3.262	20	30		EGEDHN
CCCCC(=O)NC[C@H]1CCCN(Cc2ccc(OCC#N)cc2)C1	ZINC001480242480	1392632683	/nfs/dbraw/zinc/63/26/83/1392632683.db2.gz	CSGDHPLQQDYEAH-GOSISDBHSA-N	0	3	343.471	3.107	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)Cc1c[nH]c2ccc(F)cc12	ZINC001480795620	1392938803	/nfs/dbraw/zinc/93/88/03/1392938803.db2.gz	WFYJSPHBHWDPNC-LBPRGKRZSA-N	0	3	337.826	3.086	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)c1ccsc1)NCc1ccc(C#N)cc1F	ZINC001698962562	1406717585	/nfs/dbraw/zinc/71/75/85/1406717585.db2.gz	QVNNBLLPIKJHNK-QGZVFWFLSA-N	0	3	345.443	3.303	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cc(Cl)cc(OC)c1)C(C)C	ZINC001698972654	1406737625	/nfs/dbraw/zinc/73/76/25/1406737625.db2.gz	GMNJQWOIHAEYQV-OAHLLOKOSA-N	0	3	345.270	3.445	20	30		EGEDHN
CCC(C)(C)C(=O)NC[C@H](NCc1cc(C#N)ccc1F)C(C)C	ZINC001698975581	1406743712	/nfs/dbraw/zinc/74/37/12/1406743712.db2.gz	NDLLWRLLKBKEPD-KRWDZBQOSA-N	0	3	333.451	3.364	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)c1cc(C)c(F)cc1F)C(C)C	ZINC001496572911	1396716202	/nfs/dbraw/zinc/71/62/02/1396716202.db2.gz	ZUUBZBUNYYJQLH-OAHLLOKOSA-N	0	3	330.806	3.370	20	30		EGEDHN
C[C@@H](CNCc1ccc(F)c(C#N)c1)NC(=O)CCCC(F)(F)F	ZINC001498117624	1396921984	/nfs/dbraw/zinc/92/19/84/1396921984.db2.gz	AADLOJNUMRYBOD-NSHDSACASA-N	0	3	345.340	3.024	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1n[nH]c2ccccc21	ZINC001689911641	1404204780	/nfs/dbraw/zinc/20/47/80/1404204780.db2.gz	JJJKYJJRINCIAA-CZUORRHYSA-N	0	3	346.862	3.288	20	30		EGEDHN
N#Cc1ccc(CN[C@H](CNC(=O)c2ccc(Cl)o2)C2CC2)s1	ZINC001690143121	1404341365	/nfs/dbraw/zinc/34/13/65/1404341365.db2.gz	ORXHUZCNAGOGFO-CYBMUJFWSA-N	0	3	349.843	3.164	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@@H](C)Cc2ccccc2C)C1	ZINC001691757363	1405474484	/nfs/dbraw/zinc/47/44/84/1405474484.db2.gz	HFMVFXLIUWBFPR-QILLFSRXSA-N	0	3	334.891	3.411	20	30		EGEDHN
N#Cc1ccc(CNCC2(NC(=O)C3=CCCC3)CCCC2)c(F)c1	ZINC001732227885	1428475561	/nfs/dbraw/zinc/47/55/61/1428475561.db2.gz	SNCYDCBFHZMNPZ-UHFFFAOYSA-N	0	3	341.430	3.326	20	30		EGEDHN
C[C@@H](C#N)C(=O)N[C@H]1CC[C@H](N[C@@H](C)c2c(F)cccc2F)CC1	ZINC001732306073	1428521898	/nfs/dbraw/zinc/52/18/98/1428521898.db2.gz	LGJHXMBJLHQFBC-XUXIUFHCSA-N	0	3	335.398	3.202	20	30		EGEDHN
C[C@@H](C#N)C(=O)NCc1ccc(CNCc2ccc(Cl)cc2)cc1	ZINC001732315754	1428526904	/nfs/dbraw/zinc/52/69/04/1428526904.db2.gz	QYMDMKPNFCHZOQ-AWEZNQCLSA-N	0	3	341.842	3.406	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2coc(C3CCC3)n2)CCCC1	ZINC001732399737	1428565766	/nfs/dbraw/zinc/56/57/66/1428565766.db2.gz	NPYXMDFJZRWAKW-UHFFFAOYSA-N	0	3	337.851	3.327	20	30		EGEDHN
Cc1oc(C)c(C(=O)N[C@H](C)CNCc2ccc(F)c(C#N)c2)c1C	ZINC001699370161	1412676253	/nfs/dbraw/zinc/67/62/53/1412676253.db2.gz	IDZRCIXZGKCDKM-LLVKDONJSA-N	0	3	343.402	3.124	20	30		EGEDHN
C=Cc1ccc(C(=O)N[C@@H](C)CNCc2ccc(F)c(C#N)c2)cc1	ZINC001699419800	1412733941	/nfs/dbraw/zinc/73/39/41/1412733941.db2.gz	MRPPMQIKRFVNIQ-AWEZNQCLSA-N	0	3	337.398	3.248	20	30		EGEDHN
CCC(CC)C(=O)N[C@@H]1CCN(Cc2cccc(C#N)c2)[C@@H](C)C1	ZINC001700312600	1413767508	/nfs/dbraw/zinc/76/75/08/1413767508.db2.gz	VHFBZAYVYITSRG-HNAYVOBHSA-N	0	3	327.472	3.464	20	30		EGEDHN
C[C@@H](CNC(=O)c1cc(F)ccc1F)N(C)Cc1cccc(C#N)c1	ZINC001700461452	1414059327	/nfs/dbraw/zinc/05/93/27/1414059327.db2.gz	PQWAOPZUUNJESC-ZDUSSCGKSA-N	0	3	343.377	3.087	20	30		EGEDHN
CC(C)(C(=O)N[C@H]1CCC[C@H]1CNCc1ccccc1C#N)C(F)F	ZINC001732625148	1428888419	/nfs/dbraw/zinc/88/84/19/1428888419.db2.gz	OYIRQRAOFQOVHA-HOTGVXAUSA-N	0	3	349.425	3.224	20	30		EGEDHN
C[C@@H](CN(C)[C@@H](C)c1ccc(Cl)cc1)NC(=O)c1cc(C#N)c[nH]1	ZINC001733035022	1429159228	/nfs/dbraw/zinc/15/92/28/1429159228.db2.gz	ZONXIUZZIKYHRY-STQMWFEESA-N	0	3	344.846	3.351	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1c[nH]c2ncccc12	ZINC001707434454	1417338849	/nfs/dbraw/zinc/33/88/49/1417338849.db2.gz	KOCADIIDOYNZLQ-CZUORRHYSA-N	0	3	346.862	3.288	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1ccc2c(c1)CCO2	ZINC001712998962	1417550896	/nfs/dbraw/zinc/55/08/96/1417550896.db2.gz	ISCYMPNQHZXXGR-YOEHRIQHSA-N	0	3	348.874	3.347	20	30		EGEDHN
N#Cc1ccc(CN[C@H](CNC(=O)C2(F)CCCCC2)C2CC2)s1	ZINC001713122928	1417689666	/nfs/dbraw/zinc/68/96/66/1417689666.db2.gz	JTLJSIABYBJSHM-MRXNPFEDSA-N	0	3	349.475	3.277	20	30		EGEDHN
CC1(C(=O)NC[C@H]2CCCN(Cc3ccc(C#N)cc3)C2)CCCC1	ZINC001713217674	1417796946	/nfs/dbraw/zinc/79/69/46/1417796946.db2.gz	GKEXEMXMBQKVDJ-LJQANCHMSA-N	0	3	339.483	3.467	20	30		EGEDHN
C[C@@H](CNC(=O)C(C1CCC1)C1CCC1)NCc1ccc(C#N)s1	ZINC001713331435	1417955253	/nfs/dbraw/zinc/95/52/53/1417955253.db2.gz	BARSEAZNGKWWFW-ZDUSSCGKSA-N	0	3	345.512	3.430	20	30		EGEDHN
C[C@H](CCNC(=O)c1ccccc1F)NCc1cc(C#N)ccc1F	ZINC001713402173	1418025568	/nfs/dbraw/zinc/02/55/68/1418025568.db2.gz	BFZNRDOYMLCMKT-CYBMUJFWSA-N	0	3	343.377	3.135	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1ncc(Cl)cc1Cl	ZINC001713419855	1418043858	/nfs/dbraw/zinc/04/38/58/1418043858.db2.gz	HECSSXUAGBASSN-SECBINFHSA-N	0	3	336.650	3.239	20	30		EGEDHN
Cc1ccoc1C(=O)NCC[C@@H]1CCN(Cc2ccc(C#N)s2)C1	ZINC001713724601	1418503090	/nfs/dbraw/zinc/50/30/90/1418503090.db2.gz	SEWMDZUCBQFHAZ-CQSZACIVSA-N	0	3	343.452	3.163	20	30		EGEDHN
N#Cc1cc(CN2CC[C@H](CCNC(=O)CCC3CC3)C2)ccc1F	ZINC001713726344	1418506548	/nfs/dbraw/zinc/50/65/48/1418506548.db2.gz	MPGPIBWGMIQRCL-INIZCTEOSA-N	0	3	343.446	3.216	20	30		EGEDHN
CCC(C)(C)C(=O)NCC[C@@H]1CCN(Cc2ccc(C#N)s2)C1	ZINC001713735703	1418529260	/nfs/dbraw/zinc/52/92/60/1418529260.db2.gz	VHSWKKOOLIEASY-CQSZACIVSA-N	0	3	333.501	3.384	20	30		EGEDHN
CC(C)CC(=O)N(C)C1CCN(Cc2ccc(OCC#N)cc2)CC1	ZINC001713776559	1418592245	/nfs/dbraw/zinc/59/22/45/1418592245.db2.gz	JLFFBHAEYQGRHU-UHFFFAOYSA-N	0	3	343.471	3.058	20	30		EGEDHN
C=C(Cl)CNC[C@@]1(NC(=O)c2cnccc2C)CCCC[C@H]1C	ZINC001714180822	1418989030	/nfs/dbraw/zinc/98/90/30/1418989030.db2.gz	UBQWJQKDQPSRFD-KDOFPFPSSA-N	0	3	335.879	3.411	20	30		EGEDHN
CCC1(C(=O)NCC[C@H]2CCN(Cc3ccccc3C#N)C2)CCC1	ZINC001714873424	1419606074	/nfs/dbraw/zinc/60/60/74/1419606074.db2.gz	DZZPTBNMYLGXSQ-KRWDZBQOSA-N	0	3	339.483	3.467	20	30		EGEDHN
C[C@@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)CCC(C)(F)F	ZINC001715338122	1420041715	/nfs/dbraw/zinc/04/17/15/1420041715.db2.gz	KNCJBHDRCDDDBJ-LBPRGKRZSA-N	0	3	341.377	3.069	20	30		EGEDHN
Cc1cc(C)cc(C(=O)N(C)[C@@H](C)CNCc2ccc(C#N)s2)c1	ZINC001715376768	1420072707	/nfs/dbraw/zinc/07/27/07/1420072707.db2.gz	RLXHXQVXRRXDJU-HNNXBMFYSA-N	0	3	341.480	3.487	20	30		EGEDHN
C=C(Br)CN[C@@H](CNC(=O)c1ccsc1)C(C)C	ZINC001715517744	1420203820	/nfs/dbraw/zinc/20/38/20/1420203820.db2.gz	SBXCGYNXHBJGOI-LBPRGKRZSA-N	0	3	331.279	3.001	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cc2ccsc2[nH]1)C(C)C	ZINC001715624856	1420270244	/nfs/dbraw/zinc/27/02/44/1420270244.db2.gz	RRIWJISKLIZSBM-ZDUSSCGKSA-N	0	3	325.865	3.326	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)c3csc(Cl)c3)CC2)cc1	ZINC001733258161	1429409412	/nfs/dbraw/zinc/40/94/12/1429409412.db2.gz	DXAPGLYVISNATQ-UHFFFAOYSA-N	0	3	345.855	3.325	20	30		EGEDHN
CCOc1ccc(C(=O)NCC2(NCc3cccc(C#N)c3)CC2)cc1	ZINC001733261760	1429416648	/nfs/dbraw/zinc/41/66/48/1429416648.db2.gz	IWLIQXHKARADPV-UHFFFAOYSA-N	0	3	349.434	3.009	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N[C@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001716613190	1420778198	/nfs/dbraw/zinc/77/81/98/1420778198.db2.gz	UFYSFFRUUQIOID-MRXNPFEDSA-N	0	3	333.501	3.286	20	30		EGEDHN
CC(C)C(=O)NCc1ccc(CNCc2cccc(C#N)c2)cc1F	ZINC001718034188	1421786172	/nfs/dbraw/zinc/78/61/72/1421786172.db2.gz	HJHGKNBOVLGOPZ-UHFFFAOYSA-N	0	3	339.414	3.259	20	30		EGEDHN
Cc1coc(C(=O)N2CC[C@](C)(CNCc3ccccc3C#N)C2)c1	ZINC001733434369	1429641459	/nfs/dbraw/zinc/64/14/59/1429641459.db2.gz	GASHKNBMDPZUSI-HXUWFJFHSA-N	0	3	337.423	3.102	20	30		EGEDHN
N#Cc1cccc(CNC2(CNC(=O)c3c[nH]c4ccccc34)CC2)c1	ZINC001723538401	1424456302	/nfs/dbraw/zinc/45/63/02/1424456302.db2.gz	VDOPUYZLVCZWCW-UHFFFAOYSA-N	0	3	344.418	3.092	20	30		EGEDHN
CCC1(C(=O)N[C@H]2CCCN(Cc3ccc(C#N)cc3)CC2)CC1	ZINC001724845328	1425196489	/nfs/dbraw/zinc/19/64/89/1425196489.db2.gz	SUKDNIBAJVROBO-SFHVURJKSA-N	0	3	325.456	3.219	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)C(C)(C)C(F)F)CCN1Cc1cccc(C#N)c1	ZINC001724994501	1425399691	/nfs/dbraw/zinc/39/96/91/1425399691.db2.gz	IACPLZRSDRRSLR-CZUORRHYSA-N	0	3	349.425	3.319	20	30		EGEDHN
CN(C(=O)C1(C)CCC1)[C@@H](CNCc1ccc(C#N)s1)C1CC1	ZINC001725465209	1426131826	/nfs/dbraw/zinc/13/18/26/1426131826.db2.gz	YZEGVOYKYFBVNL-INIZCTEOSA-N	0	3	331.485	3.137	20	30		EGEDHN
C[C@H](CN(C)C(=O)[C@@H]1CC[C@@H](C)CC1)NCc1ccc(F)c(C#N)c1	ZINC001725515241	1426205495	/nfs/dbraw/zinc/20/54/95/1426205495.db2.gz	KXBWAGCHZDKZSO-BFYDXBDKSA-N	0	3	345.462	3.460	20	30		EGEDHN
C[C@H](CN(C)C(=O)C(C)(C)C(F)(F)F)NCc1ccc(C#N)s1	ZINC001725519050	1426210012	/nfs/dbraw/zinc/21/00/12/1426210012.db2.gz	WNYSLEHBTYACFJ-SNVBAGLBSA-N	0	3	347.406	3.145	20	30		EGEDHN
CC(C)(C)CC(=O)N[C@@H]1CC[C@@H](CNCc2ccccc2C#N)C1	ZINC001725622772	1426288086	/nfs/dbraw/zinc/28/80/86/1426288086.db2.gz	IHTGIPSGCHLDQJ-CRAIPNDOSA-N	0	3	327.472	3.369	20	30		EGEDHN
CCC(CC)C(=O)NC[C@@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001731496440	1427473356	/nfs/dbraw/zinc/47/33/56/1427473356.db2.gz	YGDMKQOCGWREBD-SFHVURJKSA-N	0	3	327.472	3.323	20	30		EGEDHN
C#CCCCC(=O)N1CCCC[C@@H]1[C@H](C)NCC=C(Cl)Cl	ZINC001752144193	1440145463	/nfs/dbraw/zinc/14/54/63/1440145463.db2.gz	CFTJLDKTUPEVFP-UONOGXRCSA-N	0	3	331.287	3.468	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@@H]1CCCCN1C(=O)c1cc(C)nc(C)c1	ZINC001752146755	1440146304	/nfs/dbraw/zinc/14/63/04/1440146304.db2.gz	PBFLLLZWFDVRDU-RDJZCZTQSA-N	0	3	335.879	3.424	20	30		EGEDHN
C=CCCCC(=O)N1CCCC[C@@H]1[C@@H](C)NCc1cccc(OC)n1	ZINC001752157832	1440147694	/nfs/dbraw/zinc/14/76/94/1440147694.db2.gz	LOJPZHACISDLGY-SJLPKXTDSA-N	0	3	345.487	3.306	20	30		EGEDHN
CCN(CC#Cc1ccccc1)CCCNC(=O)[C@H]1C[C@@H]1C(C)C	ZINC001752222413	1440156498	/nfs/dbraw/zinc/15/64/98/1440156498.db2.gz	GPBLIJCWSCOLDO-UXHICEINSA-N	0	3	326.484	3.158	20	30		EGEDHN
CC(C)SCC(=O)N(C)C1CCN(Cc2ccc(C#N)cc2)CC1	ZINC001752291953	1440166328	/nfs/dbraw/zinc/16/63/28/1440166328.db2.gz	MIBSZDQYKXOKDT-UHFFFAOYSA-N	0	3	345.512	3.123	20	30		EGEDHN
C=CCCCCCN1CC[C@@H](NC(=O)c2cc3cnccc3o2)C1	ZINC001752391914	1440173690	/nfs/dbraw/zinc/17/36/90/1440173690.db2.gz	CKZPFAMFYMDZAV-MRXNPFEDSA-N	0	3	327.428	3.378	20	30		EGEDHN
C=C(C)CN1CCC(N(CCC)C(=O)CCc2cccnc2)CC1	ZINC001752440335	1440181297	/nfs/dbraw/zinc/18/12/97/1440181297.db2.gz	UARKBESCYVSNPM-UHFFFAOYSA-N	0	3	329.488	3.293	20	30		EGEDHN
CC1(C)C(C(=O)NC[C@@H](NCC#Cc2ccccc2)C2CC2)C1(C)C	ZINC001752454644	1440182972	/nfs/dbraw/zinc/18/29/72/1440182972.db2.gz	OLUFAZPLBGXVDO-GOSISDBHSA-N	0	3	338.495	3.205	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H](NCc2scnc2C)C2CC2)CC1	ZINC001752481930	1440185719	/nfs/dbraw/zinc/18/57/19/1440185719.db2.gz	IPUHHUKNBIJVNP-INIZCTEOSA-N	0	3	333.501	3.182	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H](CN(C)Cc2cccc(Cl)n2)C1	ZINC001752505254	1440189050	/nfs/dbraw/zinc/18/90/50/1440189050.db2.gz	XLXYPKXUMGOPCF-HNNXBMFYSA-N	0	3	335.879	3.372	20	30		EGEDHN
C=CCCCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1CCCOCC1	ZINC001752532324	1440194017	/nfs/dbraw/zinc/19/40/17/1440194017.db2.gz	IQAQNDCXNSMFMQ-GBESFXJTSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N[C@H]1C[C@@H](N[C@@H](C)c2ccccc2F)C1	ZINC001752714283	1440203648	/nfs/dbraw/zinc/20/36/48/1440203648.db2.gz	GRRUQGGAOMLKJQ-YHUYYLMFSA-N	0	3	334.435	3.105	20	30		EGEDHN
O=C(N[C@H]1C[C@@H](NCC#Cc2ccccc2)C1)[C@H]1CC[C@@H]2C[C@@H]2CC1	ZINC001752746622	1440204873	/nfs/dbraw/zinc/20/48/73/1440204873.db2.gz	UCSGWZHEOJHCQW-UZFIKNKDSA-N	0	3	336.479	3.101	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)CCc1cccc(F)c1F	ZINC001752826074	1440223853	/nfs/dbraw/zinc/22/38/53/1440223853.db2.gz	LSZYAGFOIHUTEH-MRXNPFEDSA-N	0	3	336.426	3.444	20	30		EGEDHN
C#CCCCCC(=O)NC1CCC(NCc2oc(C)nc2C)CC1	ZINC001752849669	1440233236	/nfs/dbraw/zinc/23/32/36/1440233236.db2.gz	RPGXGWYBDYAIEX-UHFFFAOYSA-N	0	3	331.460	3.002	20	30		EGEDHN
C[C@@H](CNC(=O)CC#Cc1ccccc1)NCc1cc2ccccc2o1	ZINC001752920885	1440248432	/nfs/dbraw/zinc/24/84/32/1440248432.db2.gz	IDEHNWFNKSPIOF-KRWDZBQOSA-N	0	3	346.430	3.469	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@H](CNCc2csc(CCC)n2)C1	ZINC001752937273	1440250607	/nfs/dbraw/zinc/25/06/07/1440250607.db2.gz	BGJGUXYVRKDMMI-HNNXBMFYSA-N	0	3	335.517	3.390	20	30		EGEDHN
C=CCC(CC=C)C(=O)N[C@H]1CCC[C@H](NCc2cnc(C)cn2)C1	ZINC001752968593	1440254525	/nfs/dbraw/zinc/25/45/25/1440254525.db2.gz	LWAFPNSNLJEPCS-ROUUACIJSA-N	0	3	342.487	3.070	20	30		EGEDHN
CC#CCCCC(=O)N[C@H]1CCC[C@@H](NCc2ccn(C(C)C)n2)C1	ZINC001752975715	1440255960	/nfs/dbraw/zinc/25/59/60/1440255960.db2.gz	FGDQJAHVYZGRBO-MSOLQXFVSA-N	0	3	344.503	3.175	20	30		EGEDHN
CC#CCN(C)[C@@H]1CCCN(C(=O)c2ccc(-n3cccc3)cc2)C1	ZINC001752993659	1440260859	/nfs/dbraw/zinc/26/08/59/1440260859.db2.gz	LAKSTXOPYDRICA-HXUWFJFHSA-N	0	3	335.451	3.037	20	30		EGEDHN
CC#CCN(C)[C@H]1CCCN(C(=O)C2(c3cccc(C)c3)CCC2)C1	ZINC001752995170	1440261543	/nfs/dbraw/zinc/26/15/43/1440261543.db2.gz	PEXNXMILSACAPL-FQEVSTJZSA-N	0	3	338.495	3.363	20	30		EGEDHN
CC#CCN(C)[C@H]1CCCN(C(=O)C[C@@H](C)c2ccc(OC)cc2)C1	ZINC001753000012	1440264201	/nfs/dbraw/zinc/26/42/01/1440264201.db2.gz	LVCDECMMQJKLJJ-MJGOQNOKSA-N	0	3	342.483	3.135	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1cc(F)c2ncccc2c1	ZINC001753015767	1440268328	/nfs/dbraw/zinc/26/83/28/1440268328.db2.gz	CRAPYMCTFURESU-GFCCVEGCSA-N	0	3	335.810	3.224	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCC[C@@H]1CCCN1Cc1sccc1Cl	ZINC001753025731	1440271317	/nfs/dbraw/zinc/27/13/17/1440271317.db2.gz	ZXZFOHIHEZFDOH-CHWSQXEVSA-N	0	3	339.892	3.422	20	30		EGEDHN
C=C(Cl)CN1CCC[C@H]1CCCNC(=O)c1occ2c1CCC2	ZINC001753032824	1440273313	/nfs/dbraw/zinc/27/33/13/1440273313.db2.gz	XZRLNVFGSWQYGO-OAHLLOKOSA-N	0	3	336.863	3.495	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NCCC[C@H]1CCCN1Cc1nccnc1C	ZINC001753033402	1440273732	/nfs/dbraw/zinc/27/37/32/1440273732.db2.gz	LVTHKLMSJATQCJ-PXNSSMCTSA-N	0	3	344.503	3.248	20	30		EGEDHN
CCN(CCNC(=O)CC1=CCCCC1)Cc1ccc(C#N)cc1	ZINC001753079146	1440292857	/nfs/dbraw/zinc/29/28/57/1440292857.db2.gz	BIULZUGDKDZFIG-UHFFFAOYSA-N	0	3	325.456	3.387	20	30		EGEDHN
C=C[C@@](C)(O)CC(=O)NCCN(CC)[C@@H](C)c1ccc(Cl)cc1	ZINC001753080687	1440293343	/nfs/dbraw/zinc/29/33/43/1440293343.db2.gz	FJDREJONNXSMPG-KBXCAEBGSA-N	0	3	338.879	3.166	20	30		EGEDHN
CC[C@H](CC(F)F)C(=O)NC[C@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC001753126991	1440315429	/nfs/dbraw/zinc/31/54/29/1440315429.db2.gz	GCJGFGWZDSNYLE-IAGOWNOFSA-N	0	3	349.425	3.178	20	30		EGEDHN
CCCN(CCNC(=O)[C@H]1CC12CCCC2)Cc1ccc(C#N)cc1	ZINC001753149377	1440326815	/nfs/dbraw/zinc/32/68/15/1440326815.db2.gz	YPPUXCIGJFVMSE-LJQANCHMSA-N	0	3	339.483	3.467	20	30		EGEDHN
Cc1cc(C(=O)N(C)CCNCc2ccc(C#N)s2)c(C)s1	ZINC001753209763	1440339115	/nfs/dbraw/zinc/33/91/15/1440339115.db2.gz	LNKIRNBPKIRNBX-UHFFFAOYSA-N	0	3	333.482	3.160	20	30		EGEDHN
Cc1ccc(CCCC(=O)N(C)CCNCc2ccc(C#N)cc2)cc1	ZINC001753227234	1440340628	/nfs/dbraw/zinc/34/06/28/1440340628.db2.gz	AAHGLMQJQBWLOA-UHFFFAOYSA-N	0	3	349.478	3.438	20	30		EGEDHN
C[C@@H](C(=O)N(C)CCNCc1ccc(C#N)c(F)c1)c1ccsc1	ZINC001753230736	1440341041	/nfs/dbraw/zinc/34/10/41/1440341041.db2.gz	QCKKKCGTZRLETL-CYBMUJFWSA-N	0	3	345.443	3.111	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)NCCCN(CC#Cc1ccc(F)cc1)C(C)C	ZINC001753301716	1440354216	/nfs/dbraw/zinc/35/42/16/1440354216.db2.gz	XYRPGQRCEKMAIB-UYAOXDASSA-N	0	3	344.474	3.440	20	30		EGEDHN
C=C(C)CN[C@@H](CNC(=O)CCc1csc(C)n1)c1ccccc1	ZINC001753310488	1440356289	/nfs/dbraw/zinc/35/62/89/1440356289.db2.gz	DRKMAJVGJQUSQW-SFHVURJKSA-N	0	3	343.496	3.407	20	30		EGEDHN
C=CCN[C@@H](CNC(=O)[C@H]1CCc2ccccc2O1)c1ccccc1	ZINC001753311413	1440356762	/nfs/dbraw/zinc/35/67/62/1440356762.db2.gz	NHPRVTPSQDPKOS-AZUAARDMSA-N	0	3	336.435	3.013	20	30		EGEDHN
CCCN(C(=O)C#CC1CC1)[C@@H]1CCN(Cc2ccc(CC)cc2)C1	ZINC001753316387	1440359717	/nfs/dbraw/zinc/35/97/17/1440359717.db2.gz	QSGIDHYZIKYLRU-OAQYLSRUSA-N	0	3	338.495	3.475	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CCC)C(=O)CCc2cncc(C)c2)C1	ZINC001753318461	1440361268	/nfs/dbraw/zinc/36/12/68/1440361268.db2.gz	JMEDNRALVLGMDQ-LJQANCHMSA-N	0	3	329.488	3.212	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](CN(C)Cc3ocnc3C)C2)CCCC1	ZINC001753362092	1440383336	/nfs/dbraw/zinc/38/33/36/1440383336.db2.gz	URXZVRMLTGJTFM-KRWDZBQOSA-N	0	3	345.487	3.400	20	30		EGEDHN
C=C[C@H](CC(=O)N(C)[C@@H]1CCN(CCOC(C)C)C1)c1ccccc1	ZINC001753450865	1440405877	/nfs/dbraw/zinc/40/58/77/1440405877.db2.gz	XLEVFOIRAFLQBV-UYAOXDASSA-N	0	3	344.499	3.304	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2cccc3c2O[C@@H](C)C3)CCCC1	ZINC001753504707	1440424139	/nfs/dbraw/zinc/42/41/39/1440424139.db2.gz	CYOJWPFYHPYLEW-AWEZNQCLSA-N	0	3	348.874	3.395	20	30		EGEDHN
C=C(Br)CNC[C@@](C)(NC(=O)C(CC)CC)C1CC1	ZINC001753513703	1440426770	/nfs/dbraw/zinc/42/67/70/1440426770.db2.gz	UPOOMPXKUWDKBK-OAHLLOKOSA-N	0	3	331.298	3.206	20	30		EGEDHN
C=C(Cl)CNC[C@]1(NC(=O)c2ncoc2CC)CCCC[C@H]1C	ZINC001753531768	1440431325	/nfs/dbraw/zinc/43/13/25/1440431325.db2.gz	MOLYYHUDMJUBHG-SJKOYZFVSA-N	0	3	339.867	3.258	20	30		EGEDHN
C/C=C(\C)C(=O)N1CCC[C@H](CCNCc2ccc(C#N)cc2F)C1	ZINC001753544994	1440434044	/nfs/dbraw/zinc/43/40/44/1440434044.db2.gz	HPTRAQRAFFBQNH-RNSFGAQFSA-N	0	3	343.446	3.382	20	30		EGEDHN
C=C(Br)CN[C@H]1CC[C@H](NC(=O)C2(CC)CCC2)CC1	ZINC001753583210	1440440535	/nfs/dbraw/zinc/44/05/35/1440440535.db2.gz	AXJMTRJMWMDBON-HDJSIYSDSA-N	0	3	343.309	3.492	20	30		EGEDHN
CC#CCNCc1ccc(CNC(=O)c2cscc2Cl)cc1	ZINC001753589181	1440442303	/nfs/dbraw/zinc/44/23/03/1440442303.db2.gz	PYWXDUDPCODHJM-UHFFFAOYSA-N	0	3	332.856	3.444	20	30		EGEDHN
C#CCNCc1ccc(CNC(=O)c2cscc2C(F)F)cc1	ZINC001753591212	1440442903	/nfs/dbraw/zinc/44/29/03/1440442903.db2.gz	PUENOJUFPGQBGS-UHFFFAOYSA-N	0	3	334.391	3.339	20	30		EGEDHN
CC#CCNCc1ccc(CNC(=O)Cc2ccc(Cl)s2)cc1	ZINC001753591584	1440442956	/nfs/dbraw/zinc/44/29/56/1440442956.db2.gz	FNVMYLYBMVEMPR-UHFFFAOYSA-N	0	3	346.883	3.373	20	30		EGEDHN
CCc1ccc(C(=O)NC[C@@H](C)CNCc2ccccc2C#N)cc1	ZINC001753640818	1440454383	/nfs/dbraw/zinc/45/43/83/1440454383.db2.gz	MLYNCZRVLWFKPG-INIZCTEOSA-N	0	3	335.451	3.276	20	30		EGEDHN
C=CCOCCN1CC2(C1)CCN(C(=O)C1=CCCCCC1)CC2	ZINC001753673883	1440462708	/nfs/dbraw/zinc/46/27/08/1440462708.db2.gz	UAHKNXGQVKZURF-UHFFFAOYSA-N	0	3	332.488	3.004	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)[C@H](C)CNCC=C(Cl)Cl)cc1	ZINC001753708141	1440469885	/nfs/dbraw/zinc/46/98/85/1440469885.db2.gz	ZNIRHVQUYMHZKF-GFCCVEGCSA-N	0	3	325.239	3.037	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccc(F)cc1)N(C)C(=O)C(C1CC1)C1CC1	ZINC001753720415	1440472858	/nfs/dbraw/zinc/47/28/58/1440472858.db2.gz	ZPAYJAYRNXJTTO-HNNXBMFYSA-N	0	3	342.458	3.050	20	30		EGEDHN
C[C@@H](C#N)C(=O)N[C@H](CNCc1ccc(F)cc1F)C1CCCCC1	ZINC001753744678	1440480486	/nfs/dbraw/zinc/48/04/86/1440480486.db2.gz	MITMYFCROCCVOQ-SCLBCKFNSA-N	0	3	349.425	3.279	20	30		EGEDHN
N#Cc1ccccc1CNCC[C@H]1CCCCN1C(=O)c1ccco1	ZINC001753765410	1440484613	/nfs/dbraw/zinc/48/46/13/1440484613.db2.gz	GZDGWSDQCWRCKX-GOSISDBHSA-N	0	3	337.423	3.326	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCCCN1C(=O)c1cnc(C)s1	ZINC001753773772	1440486090	/nfs/dbraw/zinc/48/60/90/1440486090.db2.gz	TZISJQUUHOBFHD-CYBMUJFWSA-N	0	3	327.881	3.178	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@@H](C)[C@H]1CNCc1ccc(C#N)cc1F	ZINC001753803719	1440491553	/nfs/dbraw/zinc/49/15/53/1440491553.db2.gz	AQYKBMYGEUZBON-DNVCBOLYSA-N	0	3	343.446	3.380	20	30		EGEDHN
C#CCCCC(=O)N1CCC[C@@H](C)[C@H]1CNCc1ccc(Cl)nc1	ZINC001753819606	1440495280	/nfs/dbraw/zinc/49/52/80/1440495280.db2.gz	VRJMDARYXREPAP-NVXWUHKLSA-N	0	3	347.890	3.255	20	30		EGEDHN
CC(C)[C@H](CNC(=O)/C=C\c1ccco1)NCC#Cc1ccccc1	ZINC001753822216	1440496663	/nfs/dbraw/zinc/49/66/63/1440496663.db2.gz	DTLUDCKPPSFXIA-CBUFDYBVSA-N	0	3	336.435	3.075	20	30		EGEDHN
CC(C)[C@@H](CNC(=O)c1ccccc1)NCc1ccc(C#N)cc1F	ZINC001753822569	1440496826	/nfs/dbraw/zinc/49/68/26/1440496826.db2.gz	MHGIHUPCZSEBCM-LJQANCHMSA-N	0	3	339.414	3.242	20	30		EGEDHN
CC/C=C(\C)C(=O)NC[C@@H](NCc1cc(C#N)ccc1OC)C(C)C	ZINC001753824950	1440497958	/nfs/dbraw/zinc/49/79/58/1440497958.db2.gz	ACNCRPCNEFESIU-YLRAASNFSA-N	0	3	343.471	3.154	20	30		EGEDHN
C=C(Cl)CN[C@H](CNC(=O)C[C@@H](C)c1c(C)n[nH]c1C)C(C)C	ZINC001753834155	1440500490	/nfs/dbraw/zinc/50/04/90/1440500490.db2.gz	IVFNUGVVBXTSTA-IAQYHMDHSA-N	0	3	340.899	3.003	20	30		EGEDHN
C=C(Cl)CN[C@@H](CNC(=O)c1cccc(F)c1OCC)C(C)C	ZINC001753842281	1440503014	/nfs/dbraw/zinc/50/30/14/1440503014.db2.gz	JWIJXZJXEYANQL-HNNXBMFYSA-N	0	3	342.842	3.321	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccccc2Cl)C1	ZINC001753872177	1440517703	/nfs/dbraw/zinc/51/77/03/1440517703.db2.gz	KKDKATPEPRAUNY-PKOBYXMFSA-N	0	3	344.886	3.422	20	30		EGEDHN
C=C(Cl)CNCC[C@H](C)NC(=O)c1noc2c1CC(C)(C)CC2	ZINC001753985966	1440528522	/nfs/dbraw/zinc/52/85/22/1440528522.db2.gz	AYGJBUFOAGBWAF-LBPRGKRZSA-N	0	3	339.867	3.040	20	30		EGEDHN
Cc1ccc(C)c(CC(=O)N[C@H](C)CCNCc2ccccc2C#N)c1	ZINC001753996515	1440529578	/nfs/dbraw/zinc/52/95/78/1440529578.db2.gz	HBFBPUNRXAWILV-GOSISDBHSA-N	0	3	349.478	3.402	20	30		EGEDHN
C=C(Cl)CNCC[C@@H](C)NC(=O)c1cccc(N2CCCC2)c1	ZINC001754022316	1440532728	/nfs/dbraw/zinc/53/27/28/1440532728.db2.gz	ZFTAUJREVQAYIL-OAHLLOKOSA-N	0	3	335.879	3.137	20	30		EGEDHN
CCN(CCNCc1c(C)cccc1Cl)C(=O)c1cc(C#N)c[nH]1	ZINC001754040376	1440534608	/nfs/dbraw/zinc/53/46/08/1440534608.db2.gz	YNWOXOJQGUJBPF-UHFFFAOYSA-N	0	3	344.846	3.100	20	30		EGEDHN
CCc1cccc(CC(=O)N(CC)CCNCc2cccc(C#N)c2)c1	ZINC001754053176	1440535909	/nfs/dbraw/zinc/53/59/09/1440535909.db2.gz	ODRHDSQRNIFQQL-UHFFFAOYSA-N	0	3	349.478	3.301	20	30		EGEDHN
C#CCCCC(=O)NC/C=C/CNCc1cccc(Br)c1	ZINC001754116558	1440542474	/nfs/dbraw/zinc/54/24/74/1440542474.db2.gz	SFDUREDOISILQA-AATRIKPKSA-N	0	3	349.272	3.015	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H](C)CN[C@H](C)c2ccccc2Cl)cn1	ZINC001754249800	1440557615	/nfs/dbraw/zinc/55/76/15/1440557615.db2.gz	PLEUBGNBNCUCTO-ZIAGYGMSSA-N	0	3	341.842	3.185	20	30		EGEDHN
C=C[C@H](CC(=O)N[C@H](C)CNCC#Cc1ccccc1)c1ccccc1	ZINC001754255119	1440558944	/nfs/dbraw/zinc/55/89/44/1440558944.db2.gz	WQZYKSAIBRTKAY-TZIWHRDSSA-N	0	3	346.474	3.492	20	30		EGEDHN
CC[C@@H](C)C(=O)N[C@@H](C)CNCC#Cc1ccc(C(F)(F)F)cc1	ZINC001754260182	1440559978	/nfs/dbraw/zinc/55/99/78/1440559978.db2.gz	QSWQHNZTZZRORQ-KGLIPLIRSA-N	0	3	340.389	3.197	20	30		EGEDHN
C#CCCCC(=O)N[C@@H](C)CNCc1cc(Cl)cc(Cl)c1	ZINC001754265135	1440560571	/nfs/dbraw/zinc/56/05/71/1440560571.db2.gz	HPIYUZTVPXWPCN-LBPRGKRZSA-N	0	3	327.255	3.391	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H](C)CNCc2cc(Cl)cc3c2OCC3)C1	ZINC001754282302	1440563284	/nfs/dbraw/zinc/56/32/84/1440563284.db2.gz	UGOXJPKZBJNOMO-ZDUSSCGKSA-N	0	3	348.874	3.226	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H](C)CN(C)Cc1ccccc1C(F)(F)F	ZINC001754310794	1440573112	/nfs/dbraw/zinc/57/31/12/1440573112.db2.gz	KNQRLZQZAYNJDT-AWEZNQCLSA-N	0	3	340.389	3.301	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)c1cccnc1C1CC1	ZINC001754313718	1440574399	/nfs/dbraw/zinc/57/43/99/1440574399.db2.gz	CASFIVDUYHOYHO-OAHLLOKOSA-N	0	3	348.450	3.081	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H](C)CN(C)CCOc1cccc(Cl)c1	ZINC001754318784	1440577044	/nfs/dbraw/zinc/57/70/44/1440577044.db2.gz	KDHQQOGPCYDSFL-AWEZNQCLSA-N	0	3	338.879	3.368	20	30		EGEDHN
CC[C@@H]1C[C@H]1C(=O)N[C@@H](CNCC#Cc1ccccc1Cl)C1CC1	ZINC001754452123	1440601292	/nfs/dbraw/zinc/60/12/92/1440601292.db2.gz	XLABRZMLLQOAGF-BJZITVGISA-N	0	3	344.886	3.222	20	30		EGEDHN
CC#CCCCC(=O)N1C[C@H]2CCC[C@@H](C1)N2CC1CC(OCC)C1	ZINC001754553122	1440630462	/nfs/dbraw/zinc/63/04/62/1440630462.db2.gz	VONWHWDQHDICHD-REPIYIIUSA-N	0	3	346.515	3.060	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC[C@H]1CNCC#Cc1ccccc1Cl	ZINC001754606420	1440643300	/nfs/dbraw/zinc/64/33/00/1440643300.db2.gz	PTRGVHBCPZVBQY-RDJZCZTQSA-N	0	3	332.875	3.318	20	30		EGEDHN
C[C@@H](CC(=O)N1CCC[C@H]1CNCC#Cc1ccccc1)n1cccc1	ZINC001754620530	1440645190	/nfs/dbraw/zinc/64/51/90/1440645190.db2.gz	VSDGRCXIHVREDL-FPOVZHCZSA-N	0	3	349.478	3.072	20	30		EGEDHN
C#CCN(C(=O)/C(C)=C\C)C1CCN(Cc2sc(C)nc2C)CC1	ZINC001754636897	1440648613	/nfs/dbraw/zinc/64/86/13/1440648613.db2.gz	QPIHTQAZNSLJQL-AUWJEWJLSA-N	0	3	345.512	3.152	20	30		EGEDHN
C#CCN(C(=O)[C@@H](C)c1ccsc1)C1CCN(CC(=C)C)CC1	ZINC001754640581	1440648970	/nfs/dbraw/zinc/64/89/70/1440648970.db2.gz	XHIDRUFWLRKFKY-INIZCTEOSA-N	0	3	330.497	3.354	20	30		EGEDHN
C=CCCC(=O)N[C@@H](CNCc1ccc(Cl)nc1)C1CCCC1	ZINC001754647269	1440650691	/nfs/dbraw/zinc/65/06/91/1440650691.db2.gz	YLDXHFFLDRHRKH-INIZCTEOSA-N	0	3	335.879	3.466	20	30		EGEDHN
C=CCCC(=O)N1CCCC[C@@]2(CCN(Cc3oc(C)nc3C)C2)C1	ZINC001754660152	1440654644	/nfs/dbraw/zinc/65/46/44/1440654644.db2.gz	BJRNRJZBCDVULB-FQEVSTJZSA-N	0	3	345.487	3.462	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@]1(C)CCN(CCc2scnc2C)C1	ZINC001754677825	1440660790	/nfs/dbraw/zinc/66/07/90/1440660790.db2.gz	ASLAPAGVOWZNAM-QAPCUYQASA-N	0	3	335.517	3.177	20	30		EGEDHN
C#CCN1CCC(C)(CNC(=O)[C@@H]2CC[C@@H](c3ccccc3)C2)CC1	ZINC001754717711	1440672083	/nfs/dbraw/zinc/67/20/83/1440672083.db2.gz	CBTWSHGUWUSSPS-WOJBJXKFSA-N	0	3	338.495	3.422	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NCC1(C)CCN(Cc2ocnc2C)CC1	ZINC001754720150	1440672810	/nfs/dbraw/zinc/67/28/10/1440672810.db2.gz	JCEBXXAFFIVURD-LJQANCHMSA-N	0	3	333.476	3.304	20	30		EGEDHN
C#CCCCC(=O)NC[C@@]1(C)CCCN(Cc2cccc(OC)c2)C1	ZINC001754725264	1440675639	/nfs/dbraw/zinc/67/56/39/1440675639.db2.gz	KJAWECPZJGDBFH-OAQYLSRUSA-N	0	3	342.483	3.217	20	30		EGEDHN
CC#CCN1CCC[C@@](C)(CNC(=O)[C@H](CC)CC(F)(F)F)C1	ZINC001754731362	1440679470	/nfs/dbraw/zinc/67/94/70/1440679470.db2.gz	FBMIFHPPAVHMJW-ZBFHGGJFSA-N	0	3	332.410	3.207	20	30		EGEDHN
C=CCN1CCC[C@@](C)(CNC(=O)c2ccnc(OC3CCC3)c2)C1	ZINC001754732361	1440680330	/nfs/dbraw/zinc/68/03/30/1440680330.db2.gz	SKUALIVPBJZQBY-FQEVSTJZSA-N	0	3	343.471	3.031	20	30		EGEDHN
C=CCN1CCC[C@@](C)(CNC(=O)Cn2c(C)cc3ccccc32)C1	ZINC001754737078	1440682553	/nfs/dbraw/zinc/68/25/53/1440682553.db2.gz	ZCXVOIMXCVYMJI-NRFANRHFSA-N	0	3	339.483	3.354	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1C[C@H]2C[C@@H](C1)N(Cc1oc(CC)nc1C)C2	ZINC001754784289	1440687166	/nfs/dbraw/zinc/68/71/66/1440687166.db2.gz	BUPOFVUTNNHQOA-ULQDDVLXSA-N	0	3	345.487	3.371	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@@H](NC[C@H](C)O)c2ccccc2CC)CC1	ZINC001754792257	1440688695	/nfs/dbraw/zinc/68/86/95/1440688695.db2.gz	ZLGDWTVEOFUFBC-OXJNMPFZSA-N	0	3	344.499	3.123	20	30		EGEDHN
CC#CCCCC(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)N2Cc1cncs1	ZINC001754831782	1440695792	/nfs/dbraw/zinc/69/57/92/1440695792.db2.gz	OMYOFBOFFHBCJM-BJWYYQGGSA-N	0	3	345.512	3.196	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@H]1CC[C@H](CNCc2nocc2C)CC1	ZINC001754834235	1440696419	/nfs/dbraw/zinc/69/64/19/1440696419.db2.gz	CTXFILFJQJAFNM-WKILWMFISA-N	0	3	333.476	3.207	20	30		EGEDHN
C=CC[C@H](C(=O)N1C[C@H]2CN(C[C@@H](F)CC)C[C@H]2C1)c1ccccc1	ZINC001754847889	1440699607	/nfs/dbraw/zinc/69/96/07/1440699607.db2.gz	KIOYXKIADKUQPL-YRPNKDGESA-N	0	3	344.474	3.485	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@]2(CO)CCCN(CC/C=C/CCC)C2)CC1	ZINC001754857722	1440700447	/nfs/dbraw/zinc/70/04/47/1440700447.db2.gz	NCBDQARIVFOTLQ-LYSGITKLSA-N	0	3	348.531	3.422	20	30		EGEDHN
CC#CCN1C[C@@H]2CCCN(C(=O)CCCc3sccc3C)[C@@H]2C1	ZINC001754874565	1440706493	/nfs/dbraw/zinc/70/64/93/1440706493.db2.gz	CXPOWCSNRYCIBM-ZWKOTPCHSA-N	0	3	344.524	3.325	20	30		EGEDHN
CC[C@H](C)CC(=O)N1CC[C@H](CCNCc2cc(C#N)ccc2F)C1	ZINC001754913107	1440708313	/nfs/dbraw/zinc/70/83/13/1440708313.db2.gz	SEXZIXLBTLIFAE-HOTGVXAUSA-N	0	3	345.462	3.462	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](CCNCc2ncc(C)s2)C1	ZINC001754917214	1440708859	/nfs/dbraw/zinc/70/88/59/1440708859.db2.gz	KPANKDAMRQXRBO-HNNXBMFYSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C(C)CCC(=O)N1CC2(C1)CCN(Cc1ccc(C)nc1C)CC2	ZINC001754962257	1440717903	/nfs/dbraw/zinc/71/79/03/1440717903.db2.gz	VPLBDWLMBVEZNK-UHFFFAOYSA-N	0	3	341.499	3.479	20	30		EGEDHN
C=C1CC(C)(C(=O)NCc2cccc3c2CCN([C@@H](C)COC)C3)C1	ZINC001754975971	1440720180	/nfs/dbraw/zinc/72/01/80/1440720180.db2.gz	XPXDFWSVRRRALP-INIZCTEOSA-N	0	3	342.483	3.052	20	30		EGEDHN
C#CCCCCC(=O)N1CCCC[C@H]1[C@@H]1CCCN(CC#CC)C1	ZINC001755048015	1440742260	/nfs/dbraw/zinc/74/22/60/1440742260.db2.gz	SNCHCPYYRLSEBR-UXHICEINSA-N	0	3	328.500	3.296	20	30		EGEDHN
C=C(C)CCN1Cc2ccccc2C[C@H]1CNC(=O)CC[C@H](C)OC	ZINC001755075588	1440748293	/nfs/dbraw/zinc/74/82/93/1440748293.db2.gz	JRYNCTWNSUJAEH-PXNSSMCTSA-N	0	3	344.499	3.311	20	30		EGEDHN
C=CCCN1Cc2ccccc2C[C@@H]1CNC(=O)CCc1ccoc1	ZINC001755075918	1440748669	/nfs/dbraw/zinc/74/86/69/1440748669.db2.gz	PHMVTNMFUKDFTQ-HXUWFJFHSA-N	0	3	338.451	3.331	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)CCCc1ccccc1)C2	ZINC001755079514	1440750467	/nfs/dbraw/zinc/75/04/67/1440750467.db2.gz	LOWSWJYFJNVTOB-QFIPXVFZSA-N	0	3	338.495	3.347	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@@H](C)OCC(C)C)cc2C1	ZINC001755101191	1440752396	/nfs/dbraw/zinc/75/23/96/1440752396.db2.gz	VBICAMMOKPMFMX-MRXNPFEDSA-N	0	3	330.472	3.256	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)[C@H](CC(C)C)OC)cc2C1	ZINC001755102076	1440753087	/nfs/dbraw/zinc/75/30/87/1440753087.db2.gz	HGPQNIZLVSKIIC-IBGZPJMESA-N	0	3	330.472	3.256	20	30		EGEDHN
C[C@H]1CN(C(=O)c2ccoc2Cl)C[C@@H]1NCC#Cc1ccccc1	ZINC001755108957	1440754037	/nfs/dbraw/zinc/75/40/37/1440754037.db2.gz	OEVMCPISJMCRIO-YOEHRIQHSA-N	0	3	342.826	3.035	20	30		EGEDHN
CCC1(C(=O)N[C@H]2CCN(Cc3cccc(C#N)c3)CC2(C)C)CC1	ZINC001755141325	1440760682	/nfs/dbraw/zinc/76/06/82/1440760682.db2.gz	DRHGELUVGMDXGN-SFHVURJKSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CCN(CCOc2ccccc2C)[C@@H](C)C1	ZINC001755168440	1440768014	/nfs/dbraw/zinc/76/80/14/1440768014.db2.gz	BTXZHUAMIMYAPF-ROUUACIJSA-N	0	3	330.472	3.309	20	30		EGEDHN
C=CCCCC(=O)NC1(CO)CCN(Cc2ccc(C)c(C)c2)CC1	ZINC001755180087	1440771067	/nfs/dbraw/zinc/77/10/67/1440771067.db2.gz	VABOXHXPQLARJF-UHFFFAOYSA-N	0	3	344.499	3.103	20	30		EGEDHN
C=C(Cl)CN(CC)CC1CCN(C(=O)CC[C@@H]2CCOC2)CC1	ZINC001755181943	1440771235	/nfs/dbraw/zinc/77/12/35/1440771235.db2.gz	DSWMEHPVZKIPDQ-QGZVFWFLSA-N	0	3	342.911	3.116	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1Cc2ccccc2[C@H]1NC[C@H](OC)C1CCC1	ZINC001755185913	1440773180	/nfs/dbraw/zinc/77/31/80/1440773180.db2.gz	YLOJGSHYOUDYFC-SVFBPWRDSA-N	0	3	342.483	3.140	20	30		EGEDHN
C#CCCN[C@@H]1c2ccccc2C[C@H]1NC(=O)C(C)(C)c1ccccc1	ZINC001755188154	1440773909	/nfs/dbraw/zinc/77/39/09/1440773909.db2.gz	ZPWNMTFIZAEESZ-NHCUHLMSSA-N	0	3	346.474	3.359	20	30		EGEDHN
C=CCN(C)C[C@@H]1CCCN1C(=O)[C@@H](C)OCc1ccc(C)cc1	ZINC001755196688	1440777285	/nfs/dbraw/zinc/77/72/85/1440777285.db2.gz	RJYAKZXTHHMQDC-MJGOQNOKSA-N	0	3	330.472	3.009	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCN1C(=O)c1ccn(C(C)C)c1C	ZINC001755197812	1440777678	/nfs/dbraw/zinc/77/76/78/1440777678.db2.gz	NRTLGCCEFGTGKE-GOSISDBHSA-N	0	3	347.503	3.116	20	30		EGEDHN
C=CCOCCN(C)C[C@@H]1CCCN1C(=O)c1ccn(C(C)C)c1C	ZINC001755197813	1440777686	/nfs/dbraw/zinc/77/76/86/1440777686.db2.gz	NRTLGCCEFGTGKE-SFHVURJKSA-N	0	3	347.503	3.116	20	30		EGEDHN
C=C(Cl)CNCC1CC(NC(=O)c2ccc(OC(C)C)cc2)C1	ZINC001755220275	1440784540	/nfs/dbraw/zinc/78/45/40/1440784540.db2.gz	KCXGNUBSVNWHRY-UHFFFAOYSA-N	0	3	336.863	3.324	20	30		EGEDHN
COc1ccc(C#N)cc1CN[C@H](C)[C@@H](C)NC(=O)C(C)(C)C(C)C	ZINC001755238950	1440788973	/nfs/dbraw/zinc/78/89/73/1440788973.db2.gz	YUSKPGCLGNRHCA-HUUCEWRRSA-N	0	3	345.487	3.232	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H](C)[C@H](C)NCc2ccc(C#N)s2)cc1F	ZINC001755242587	1440789752	/nfs/dbraw/zinc/78/97/52/1440789752.db2.gz	CTZWSDKEMNFNRT-STQMWFEESA-N	0	3	345.443	3.364	20	30		EGEDHN
Cc1coc(C(=O)N[C@@H](C)[C@@H](C)NCC#Cc2ccccc2Cl)c1	ZINC001755248796	1440791416	/nfs/dbraw/zinc/79/14/16/1440791416.db2.gz	LHJIFMCYAUYQFN-CABCVRRESA-N	0	3	344.842	3.390	20	30		EGEDHN
C=C(Br)CNC1CCC(N(C)C(=O)[C@H](C)CC)CC1	ZINC001755273283	1440798212	/nfs/dbraw/zinc/79/82/12/1440798212.db2.gz	PWJOBEPEJSUNTH-LMWSTFAQSA-N	0	3	331.298	3.300	20	30		EGEDHN
C=C(Br)CNCC(C)(C)CN(C)C(=O)c1occc1C	ZINC001755278151	1440799846	/nfs/dbraw/zinc/79/98/46/1440799846.db2.gz	VLXWDMNFPCYLQR-UHFFFAOYSA-N	0	3	343.265	3.184	20	30		EGEDHN
C[C@H](CNC(=O)c1ccoc1Cl)N(C)Cc1cccc(C#N)c1	ZINC001755297113	1440806917	/nfs/dbraw/zinc/80/69/17/1440806917.db2.gz	UBJIEUYHZQDNLE-GFCCVEGCSA-N	0	3	331.803	3.055	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1CN(Cc2ccc(CF)cc2)CC1(C)C	ZINC001755409007	1440845462	/nfs/dbraw/zinc/84/54/62/1440845462.db2.gz	YGUILZMIMCZOJI-GOSISDBHSA-N	0	3	330.447	3.286	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CC[C@H](NC(=O)C(C)(C)C(F)F)C[C@H]2C1	ZINC001755454210	1440854980	/nfs/dbraw/zinc/85/49/80/1440854980.db2.gz	YJTFWRGLGFGLIM-AVGNSLFASA-N	0	3	334.838	3.247	20	30		EGEDHN
C=C(Cl)CNCCC[C@H](C)NC(=O)[C@@H]1CCc2ccccc2C1	ZINC001755518162	1440864507	/nfs/dbraw/zinc/86/45/07/1440864507.db2.gz	JNMSTZFESMHPFW-MAUKXSAKSA-N	0	3	334.891	3.419	20	30		EGEDHN
C[C@H](CCCNCc1cc(C#N)ccc1F)NC(=O)[C@@H]1CC12CCC2	ZINC001755518949	1440864731	/nfs/dbraw/zinc/86/47/31/1440864731.db2.gz	XRFJAQGMYLHDHJ-PBHICJAKSA-N	0	3	343.446	3.262	20	30		EGEDHN
Cc1ccc(C(=O)N2CCC(N(C)CC#Cc3ccccc3)CC2)o1	ZINC001755525603	1440865719	/nfs/dbraw/zinc/86/57/19/1440865719.db2.gz	KJWWTRMAOOWTRR-UHFFFAOYSA-N	0	3	336.435	3.176	20	30		EGEDHN
CC1CC(C(=O)N(C)[C@@H](CNCC#Cc2ccc(F)cc2)C2CC2)C1	ZINC001755559001	1440874141	/nfs/dbraw/zinc/87/41/41/1440874141.db2.gz	SUBKUBSCKHNARP-UPQHMETBSA-N	0	3	342.458	3.050	20	30		EGEDHN
CN(C(=O)C1(C)CCCC1)[C@H](CNCC#Cc1ccccc1)C1CC1	ZINC001755563461	1440875095	/nfs/dbraw/zinc/87/50/95/1440875095.db2.gz	LKERAYJFDWRZDJ-HXUWFJFHSA-N	0	3	338.495	3.445	20	30		EGEDHN
CCCc1[nH]ccc1C(=O)N(C)C[C@H](C)NCc1ccc(C#N)s1	ZINC001755601677	1440884153	/nfs/dbraw/zinc/88/41/53/1440884153.db2.gz	NGAFRLAXEWUZDK-ZDUSSCGKSA-N	0	3	344.484	3.151	20	30		EGEDHN
C=CCC(C)(C)C(=O)N(C)C[C@H](C)NCc1ccc(C#N)c(F)c1	ZINC001755606819	1440885901	/nfs/dbraw/zinc/88/59/01/1440885901.db2.gz	MOSXWFVJSFNTTO-AWEZNQCLSA-N	0	3	331.435	3.236	20	30		EGEDHN
C[C@@H](CN(C)C(=O)C(C)(C)C(F)(F)F)NCC#Cc1ccccc1	ZINC001755614729	1440888445	/nfs/dbraw/zinc/88/84/45/1440888445.db2.gz	PMCWQYWVTDGINO-AWEZNQCLSA-N	0	3	340.389	3.063	20	30		EGEDHN
C=CCC1(C(=O)N(C)C[C@@H](C)NCc2ccnc(OC)c2)CCCC1	ZINC001755620810	1440890445	/nfs/dbraw/zinc/89/04/45/1440890445.db2.gz	ZAGZMLXKWCULOJ-MRXNPFEDSA-N	0	3	345.487	3.163	20	30		EGEDHN
CC#CCN[C@H]1C[C@H](C)N(C(=O)Cc2ccc(CCCC)cc2)C1	ZINC001755682466	1440895324	/nfs/dbraw/zinc/89/53/24/1440895324.db2.gz	SLHQDLIMZBPNSD-PXNSSMCTSA-N	0	3	326.484	3.174	20	30		EGEDHN
C[C@H](C#N)C(=O)N[C@@]12CCC[C@@H]1N(CCc1ccccc1Cl)CC2	ZINC001755696088	1440898000	/nfs/dbraw/zinc/89/80/00/1440898000.db2.gz	KTMZJTMBPRKUEG-DKSSEZFCSA-N	0	3	345.874	3.155	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H]2CCC[C@@H](NCc3nocc3C)[C@@H]2C1	ZINC001755708695	1440903075	/nfs/dbraw/zinc/90/30/75/1440903075.db2.gz	NJUPXPZPTHOOPE-GVDBMIGSSA-N	0	3	331.460	3.056	20	30		EGEDHN
C=CCOCCN1CCC[C@@H](NC(=O)c2cc(C)sc2C)[C@H]1C	ZINC001755717900	1440906151	/nfs/dbraw/zinc/90/61/51/1440906151.db2.gz	WFIAJZHUUVJJJA-RHSMWYFYSA-N	0	3	336.501	3.150	20	30		EGEDHN
C#CCCCC(=O)N[C@H]1CCCN(Cc2ccc3cc[nH]c3c2)[C@H]1C	ZINC001755731236	1440910173	/nfs/dbraw/zinc/91/01/73/1440910173.db2.gz	OGTAVKDEAMEUIW-LPHOPBHVSA-N	0	3	337.467	3.441	20	30		EGEDHN
C/C=C(\C)C(=O)N1C[C@H](NCC#Cc2ccc(Cl)cc2)C(C)(C)C1	ZINC001755754527	1440913784	/nfs/dbraw/zinc/91/37/84/1440913784.db2.gz	WZGRLSOAVALFOE-IQXODGKNSA-N	0	3	344.886	3.484	20	30		EGEDHN
Cc1c[nH]cc1C(=O)N[C@H](CNCC#Cc1ccccc1)C(C)(C)C	ZINC001755837666	1440930740	/nfs/dbraw/zinc/93/07/40/1440930740.db2.gz	WEPXTHUTBNVQQI-LJQANCHMSA-N	0	3	337.467	3.109	20	30		EGEDHN
C=C(Cl)CNC1CC(N(C)C(=O)C[C@H](C)c2c(C)noc2C)C1	ZINC001755858505	1440936219	/nfs/dbraw/zinc/93/62/19/1440936219.db2.gz	HGFQHJZKLUWVJO-ISAOAKOHSA-N	0	3	339.867	3.117	20	30		EGEDHN
C[C@H](C(=O)N(C)C1CC(NCC#Cc2ccccc2)C1)c1ccco1	ZINC001755861832	1440936839	/nfs/dbraw/zinc/93/68/39/1440936839.db2.gz	KDGOYJSVASXXGC-IVMQYODDSA-N	0	3	336.435	3.014	20	30		EGEDHN
C#Cc1ccc(CN[C@@H](Cc2ccccc2)[C@@H](O)C(F)(F)F)cc1	ZINC000809619197	1126110856	/nfs/dbraw/zinc/11/08/56/1126110856.db2.gz	VMUAHYOGIQBQES-ZWKOTPCHSA-N	0	3	333.353	3.292	20	30		EGEDHN
Cc1ccc(NC(=O)[C@@H]2CCCN(Cc3ccc(C#N)cc3)C2)nc1	ZINC000174604735	231253516	/nfs/dbraw/zinc/25/35/16/231253516.db2.gz	FFEFIIQCBNWVNY-GOSISDBHSA-N	0	3	334.423	3.112	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)NC1CCCCCC1	ZINC000042996091	213548758	/nfs/dbraw/zinc/54/87/58/213548758.db2.gz	QYSDHOHWMAYQCK-UHFFFAOYSA-N	0	3	342.487	3.354	20	30		EGEDHN
CN1CCC(C(=O)Nc2ccc(OCc3cccc(C#N)c3)cc2)CC1	ZINC000073339183	216379249	/nfs/dbraw/zinc/37/92/49/216379249.db2.gz	MIJSLEPRWQBVCL-UHFFFAOYSA-N	0	3	349.434	3.418	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)c2cccc(C#N)c2)CCN1Cc1ccccc1	ZINC000079554890	217240560	/nfs/dbraw/zinc/24/05/60/217240560.db2.gz	OPFOTULBIJBOER-OXJNMPFZSA-N	0	3	333.435	3.341	20	30		EGEDHN
COc1cccc(N2C[C@@H](N[C@@H](C)c3cccc(C#N)c3)CC2=O)c1	ZINC000378452270	169123489	/nfs/dbraw/zinc/12/34/89/169123489.db2.gz	LEELLPYXWATOBO-YOEHRIQHSA-N	0	3	335.407	3.023	20	30		EGEDHN
Cc1cccc(NC2CCN(C[C@H](O)c3ccc(C#N)cc3)CC2)c1	ZINC000268708527	252159477	/nfs/dbraw/zinc/15/94/77/252159477.db2.gz	WZZSJAJMNSIDCU-NRFANRHFSA-N	0	3	335.451	3.477	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)Nc1ccccc1F	ZINC000097473064	219027784	/nfs/dbraw/zinc/02/77/84/219027784.db2.gz	NARMTWWFLQAHNH-UHFFFAOYSA-N	0	3	340.402	3.293	20	30		EGEDHN
CCc1ccc2c(CN3CC[C@@H](CNC(C)=O)C3)cc(=O)oc2c1	ZINC000328597062	258042655	/nfs/dbraw/zinc/04/26/55/258042655.db2.gz	CZKOCTYCUKALHG-HNNXBMFYSA-N	0	3	328.412	3.154	20	30		EGEDHN
COc1ccc(CNCCc2nc(C(F)(F)F)cs2)cc1C#N	ZINC000173845882	533666331	/nfs/dbraw/zinc/66/63/31/533666331.db2.gz	XYFQLCJWFCUVRZ-UHFFFAOYSA-N	0	3	341.358	3.374	20	30		EGEDHN
C[C@H](N[C@H]1CCCN(C(=O)Cc2ccccc2)C1)c1cccc(C#N)c1	ZINC000338014252	141073804	/nfs/dbraw/zinc/07/38/04/141073804.db2.gz	FCLMHKQOWDXBNR-UWJYYQICSA-N	0	3	347.462	3.443	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1	ZINC000338137848	141100633	/nfs/dbraw/zinc/10/06/33/141100633.db2.gz	UCISUJMXYVQXDR-BEFAXECRSA-N	0	3	333.435	3.260	20	30		EGEDHN
CC(C)CN1CCN(Cc2ccc(C#N)cc2Br)CC1	ZINC000350784088	141267024	/nfs/dbraw/zinc/26/70/24/141267024.db2.gz	CHZDNSFLJBZGHH-UHFFFAOYSA-N	0	3	336.277	3.094	20	30		EGEDHN
C[C@@H]1CCC[C@H](C(=O)N(CCN(C)C)Cc2cccc(C#N)c2)C1	ZINC000172849748	144030029	/nfs/dbraw/zinc/03/00/29/144030029.db2.gz	FAWGGKNPNOBCCT-APWZRJJASA-N	0	3	327.472	3.275	20	30		EGEDHN
CCO[C@@H]1C[C@@H](N[C@@H](C)C(=O)Nc2ccccc2C#N)C1(CC)CC	ZINC000178667945	144074674	/nfs/dbraw/zinc/07/46/74/144074674.db2.gz	PWLRHSWCMFNHQE-BMGDILEWSA-N	0	3	343.471	3.459	20	30		EGEDHN
Cn1cc(CN2CCC3(CC2)OCCc2ccsc23)cc1C#N	ZINC000361586331	144332356	/nfs/dbraw/zinc/33/23/56/144332356.db2.gz	LSBTZQKNMDJWMK-UHFFFAOYSA-N	0	3	327.453	3.022	20	30		EGEDHN
C[C@@H]1Cc2ccccc2CN1CCC(=O)Nc1sccc1C#N	ZINC000172905002	152816161	/nfs/dbraw/zinc/81/61/61/152816161.db2.gz	NJGWWXHPMUPZHX-CYBMUJFWSA-N	0	3	325.437	3.395	20	30		EGEDHN
COc1cc([C@@H](C)N[C@H](C)c2ccc(C#N)cc2)ccc1OCCO	ZINC000341590173	155370067	/nfs/dbraw/zinc/37/00/67/155370067.db2.gz	UJBQKEVFIHCHHC-HUUCEWRRSA-N	0	3	340.423	3.350	20	30		EGEDHN
C[C@H](c1ccc(-n2cncn2)cc1)N(C)Cc1ccc(C#N)c(F)c1	ZINC000191919306	153231526	/nfs/dbraw/zinc/23/15/26/153231526.db2.gz	KJBVBISXWVPIKW-CQSZACIVSA-N	0	3	335.386	3.471	20	30		EGEDHN
CCCCNC(=O)[C@H]1CC[C@H](C)N(Cc2ccc(C#N)c(F)c2)C1	ZINC000191964367	153235556	/nfs/dbraw/zinc/23/55/56/153235556.db2.gz	UGXXDWGTUONKLS-YOEHRIQHSA-N	0	3	331.435	3.214	20	30		EGEDHN
N#Cc1ccccc1COc1cccc(CN[C@@H]2C=C[C@H](CO)C2)c1	ZINC000305130403	154085218	/nfs/dbraw/zinc/08/52/18/154085218.db2.gz	MTGMAWWBVIUHID-FXAWDEMLSA-N	0	3	334.419	3.164	20	30		EGEDHN
C[C@H](N[C@H]1CCCC[C@@H]1OC(F)F)C(=O)Nc1ccccc1C#N	ZINC000337373795	154317289	/nfs/dbraw/zinc/31/72/89/154317289.db2.gz	ADYSRSOMRVKSBN-CQDKDKBSSA-N	0	3	337.370	3.025	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)Cc1ccc(F)c(F)c1	ZINC000348889178	156277923	/nfs/dbraw/zinc/27/79/23/156277923.db2.gz	CHBGEIJUBCRRDW-UHFFFAOYSA-N	0	3	329.394	3.400	20	30		EGEDHN
COc1cc(CN(CCN(C)C)Cc2ccccc2F)ccc1C#N	ZINC000348899034	156282240	/nfs/dbraw/zinc/28/22/40/156282240.db2.gz	ZQIIGZMMJKYPCR-UHFFFAOYSA-N	0	3	341.430	3.270	20	30		EGEDHN
CNC(=O)[C@H](Cc1c[nH]c2ccccc12)N[C@H](C)c1ccc(C#N)cc1	ZINC000344092032	164101549	/nfs/dbraw/zinc/10/15/49/164101549.db2.gz	CPUHGUPWEQKWFU-VLIAUNLRSA-N	0	3	346.434	3.047	20	30		EGEDHN
CC[C@@H](CNC(=O)Cc1ccc(C#N)cc1)N1CCc2ccccc2C1	ZINC000345556124	164214242	/nfs/dbraw/zinc/21/42/42/164214242.db2.gz	NJYXYDTUFOLEQQ-NRFANRHFSA-N	0	3	347.462	3.054	20	30		EGEDHN
N#Cc1c(F)cccc1OC[C@H]1CN(Cc2ccccc2)CCCO1	ZINC000351912920	165147189	/nfs/dbraw/zinc/14/71/89/165147189.db2.gz	MZYCMJBGKVLUAT-QGZVFWFLSA-N	0	3	340.398	3.367	20	30		EGEDHN
CN(C)CCN(C(=O)c1cc(C#N)ccc1Cl)c1ccccc1	ZINC000352102870	165236879	/nfs/dbraw/zinc/23/68/79/165236879.db2.gz	UEZVHJRFYKXMNA-UHFFFAOYSA-N	0	3	327.815	3.420	20	30		EGEDHN
Cc1c(C#N)cccc1C(=O)N[C@@H]1CCN(Cc2ccccc2)[C@H]1C	ZINC000359832651	167243994	/nfs/dbraw/zinc/24/39/94/167243994.db2.gz	LREULJUOMYMMCA-OXJNMPFZSA-N	0	3	333.435	3.260	20	30		EGEDHN
C[C@H]1[C@@H](NC(=O)c2cccc(F)c2C#N)CCN1Cc1ccccc1	ZINC000359841648	167245576	/nfs/dbraw/zinc/24/55/76/167245576.db2.gz	OURWSSVMMOOICC-LIRRHRJNSA-N	0	3	337.398	3.090	20	30		EGEDHN
C[C@H]1[C@H](NC(=O)c2cccc(F)c2C#N)CCN1Cc1ccccc1	ZINC000359841641	167245727	/nfs/dbraw/zinc/24/57/27/167245727.db2.gz	OURWSSVMMOOICC-IFXJQAMLSA-N	0	3	337.398	3.090	20	30		EGEDHN
N#Cc1ccc2c(c1)CCCC[C@H]2NCc1ccc(OCCO)cc1	ZINC000360659123	167381377	/nfs/dbraw/zinc/38/13/77/167381377.db2.gz	WUUMMUVBHUQMBS-OAQYLSRUSA-N	0	3	336.435	3.487	20	30		EGEDHN
C[C@@H](CCCC(F)(F)F)NC(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000348510939	269831746	/nfs/dbraw/zinc/83/17/46/269831746.db2.gz	QOCBQVQEWGTPOF-WFASDCNBSA-N	0	3	337.345	3.478	20	30		EGEDHN
CSc1ccc([C@@H](CNc2nnc(C)c(C)c2C#N)N(C)C)cc1	ZINC000294248362	270042271	/nfs/dbraw/zinc/04/22/71/270042271.db2.gz	WINJCPDWPGOLQN-QGZVFWFLSA-N	0	3	341.484	3.402	20	30		EGEDHN
N#Cc1ncc(C(F)(F)F)cc1N1CCN(C2CCCCC2)CC1	ZINC000413207508	270047344	/nfs/dbraw/zinc/04/73/44/270047344.db2.gz	RUDMEOMEUVWFCN-UHFFFAOYSA-N	0	3	338.377	3.427	20	30		EGEDHN
N#Cc1ccc(OCCN(CCCO)Cc2cccc(Cl)c2)cc1	ZINC000441055907	270051838	/nfs/dbraw/zinc/05/18/38/270051838.db2.gz	BQVOORILBMVESO-UHFFFAOYSA-N	0	3	344.842	3.475	20	30		EGEDHN
N#Cc1ccc(CN2CCC(Nc3cccc(CCO)c3)CC2)cc1	ZINC000449754847	270052743	/nfs/dbraw/zinc/05/27/43/270052743.db2.gz	MMGJFFSEPQRNSE-UHFFFAOYSA-N	0	3	335.451	3.170	20	30		EGEDHN
Cc1ccc([C@@H]2C[C@@H](C)N([C@@H](C(N)=O)c3ccc(C#N)cc3)C2)cc1	ZINC000490062097	270056661	/nfs/dbraw/zinc/05/66/61/270056661.db2.gz	XWBKFPPZDXWLDX-CDHQVMDDSA-N	0	3	333.435	3.271	20	30		EGEDHN
CCSCC[C@@H](C)N(C)C(=O)C(C#N)Cc1ccc(C#N)cc1	ZINC000280298975	266344579	/nfs/dbraw/zinc/34/45/79/266344579.db2.gz	FPVVMHWQKWGOKW-PBHICJAKSA-N	0	3	329.469	3.231	20	30		EGEDHN
CCS[C@@H]1CCC[C@H](NC(=O)C(C#N)Cc2ccc(C#N)cc2)C1	ZINC000280351231	266345593	/nfs/dbraw/zinc/34/55/93/266345593.db2.gz	IIOXSENDFJTKAD-OKZBNKHCSA-N	0	3	341.480	3.421	20	30		EGEDHN
CCS[C@@H]1CCCCN(C(=O)C(C#N)Cc2ccc(C#N)cc2)C1	ZINC000280498093	266346996	/nfs/dbraw/zinc/34/69/96/266346996.db2.gz	QQEYRSTWISZVJR-QZTJIDSGSA-N	0	3	341.480	3.375	20	30		EGEDHN
CC[C@@H]1CN(c2nc3ccccn3c2C#N)CCN1Cc1ccccc1	ZINC000302178460	266383543	/nfs/dbraw/zinc/38/35/43/266383543.db2.gz	YGGBKBNMDPPDIL-GOSISDBHSA-N	0	3	345.450	3.307	20	30		EGEDHN
C[C@@H](c1cccnc1)N1CCC(C(=O)Nc2cccc(C#N)c2)CC1	ZINC000299678970	267003345	/nfs/dbraw/zinc/00/33/45/267003345.db2.gz	WRJJTJIVLYMWSI-HNNXBMFYSA-N	0	3	334.423	3.365	20	30		EGEDHN
CCCCNC(=O)C1(NCc2ccc(C#N)c(OC)c2)CCCCC1	ZINC000442834612	267009525	/nfs/dbraw/zinc/00/95/25/267009525.db2.gz	BFGGVUPWOANFEU-UHFFFAOYSA-N	0	3	343.471	3.276	20	30		EGEDHN
CCN(C[C@H]1CCN(Cc2ccccc2)C1)c1ncc(C#N)cc1F	ZINC000413165521	267069593	/nfs/dbraw/zinc/06/95/93/267069593.db2.gz	HFVSSKKPBPBZES-KRWDZBQOSA-N	0	3	338.430	3.441	20	30		EGEDHN
CCOC(=O)[C@](C)(CNCc1ccc(C#N)c(C)c1)c1ccccc1	ZINC000446803473	267135425	/nfs/dbraw/zinc/13/54/25/267135425.db2.gz	LKBRGGYLNDSVRP-OAQYLSRUSA-N	0	3	336.435	3.477	20	30		EGEDHN
CCO[C@@H]1CCC[C@H]1N[C@H](C)C(=O)Nc1ccc(C#N)c(Cl)c1	ZINC000452017172	267146086	/nfs/dbraw/zinc/14/60/86/267146086.db2.gz	OJRISABIJKLOOR-HFBAOOFYSA-N	0	3	335.835	3.086	20	30		EGEDHN
C[C@H](CCCNC(=O)OC(C)(C)C)NCc1ccc(C#N)c(F)c1	ZINC000404681694	267150400	/nfs/dbraw/zinc/15/04/00/267150400.db2.gz	LFRVWSAGZMSEQH-CYBMUJFWSA-N	0	3	335.423	3.480	20	30		EGEDHN
C[C@H](CNC(=O)N[C@@H](C)c1ccc(C#N)cc1)N1CCC[C@@H](C)C1	ZINC000298614025	267158782	/nfs/dbraw/zinc/15/87/82/267158782.db2.gz	MUAXUOLHFPYRSF-OAGGEKHMSA-N	0	3	328.460	3.039	20	30		EGEDHN
CC[C@@H]1CCCCN1CCNC(=O)Nc1ccc(COC)c(C#N)c1	ZINC000529218224	267200134	/nfs/dbraw/zinc/20/01/34/267200134.db2.gz	VEUDCOXSEVGKKJ-GOSISDBHSA-N	0	3	344.459	3.091	20	30		EGEDHN
CC[C@H](N[C@H]1CCN(c2ccc(C#N)cc2)C1=O)c1cccs1	ZINC000411512380	267223498	/nfs/dbraw/zinc/22/34/98/267223498.db2.gz	LOTQORNLXZUJSR-HOTGVXAUSA-N	0	3	325.437	3.466	20	30		EGEDHN
CC[C@H]1CCC[C@@H]1C(=O)N(CCN(C)C)Cc1cccc(C#N)c1	ZINC000448816192	267227478	/nfs/dbraw/zinc/22/74/78/267227478.db2.gz	NDONCXHRVBYVKL-OALUTQOASA-N	0	3	327.472	3.275	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@H]1Nc1ccc(C#N)cc1[N+](=O)[O-]	ZINC000302187484	267234934	/nfs/dbraw/zinc/23/49/34/267234934.db2.gz	WHQAGMZWDFAGJE-KBXCAEBGSA-N	0	3	336.395	3.399	20	30		EGEDHN
C[C@H]1[C@@H](NC(=O)NCc2cccc(C#N)c2)CCN1Cc1ccccc1	ZINC000287142297	267251162	/nfs/dbraw/zinc/25/11/62/267251162.db2.gz	PVUHYYQCEIPGEW-JXFKEZNVSA-N	0	3	348.450	3.020	20	30		EGEDHN
CN(C[C@H](O)CNc1ccc(Oc2ccccc2C#N)cc1)C1CC1	ZINC000516965777	267309146	/nfs/dbraw/zinc/30/91/46/267309146.db2.gz	LOQUCJPABKSHLA-GOSISDBHSA-N	0	3	337.423	3.218	20	30		EGEDHN
CN(Cc1cc(C#N)cs1)C1CCN(CCC(F)(F)F)CC1	ZINC000449784784	267310790	/nfs/dbraw/zinc/31/07/90/267310790.db2.gz	CNXVQWMIFWJJJH-UHFFFAOYSA-N	0	3	331.407	3.468	20	30		EGEDHN
CN(Cc1ccc(C#N)cn1)[C@H]1CCO[C@H](c2ccc(F)cc2)C1	ZINC000514870517	267314811	/nfs/dbraw/zinc/31/48/11/267314811.db2.gz	LPDFTCINZDQVFW-OALUTQOASA-N	0	3	325.387	3.444	20	30		EGEDHN
CN1C[C@@H]2CCCN(C(=O)c3ccccc3-c3ccccc3C#N)[C@@H]2C1	ZINC000425052252	267342968	/nfs/dbraw/zinc/34/29/68/267342968.db2.gz	VLJQYJDPNYLDOQ-LAUBAEHRSA-N	0	3	345.446	3.391	20	30		EGEDHN
Cc1ccc([O-])c(C[NH+]2CCC(C(=O)Nc3cccc(C#N)c3)CC2)c1	ZINC000271209086	267433190	/nfs/dbraw/zinc/43/31/90/267433190.db2.gz	ZPQPCRRKCJECOA-UHFFFAOYSA-N	0	3	349.434	3.423	20	30		EGEDHN
Cc1oc(C#N)cc1C(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1	ZINC000280749483	267724515	/nfs/dbraw/zinc/72/45/15/267724515.db2.gz	MCKQUSVIAWNXNU-LJQANCHMSA-N	0	3	337.423	3.335	20	30		EGEDHN
Cn1cc(CN2CCC[C@H](c3nc(C(F)(F)F)c[nH]3)C2)cc1C#N	ZINC000278560998	268039739	/nfs/dbraw/zinc/03/97/39/268039739.db2.gz	AWULEPUUVXKAPO-LBPRGKRZSA-N	0	3	337.349	3.018	20	30		EGEDHN
Cc1cccc([C@@H](C)CNC(=O)C(C#N)Cc2ccc(C#N)cc2)c1	ZINC000470972900	268056185	/nfs/dbraw/zinc/05/61/85/268056185.db2.gz	BIDGUOVGYSUZJR-JXFKEZNVSA-N	0	3	331.419	3.469	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N[C@H]2CCOc3ccc(F)cc32)cc1	ZINC000280597118	268087148	/nfs/dbraw/zinc/08/71/48/268087148.db2.gz	WYLVKYLUFROSNH-YJBOKZPZSA-N	0	3	349.365	3.020	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)N2CC[C@H](c3cccc(F)c3)C2)cc1	ZINC000279263718	268090129	/nfs/dbraw/zinc/09/01/29/268090129.db2.gz	ILUCCARBIUZFLX-RBUKOAKNSA-N	0	3	347.393	3.396	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NC[C@H]2CCCC(F)(F)C2)cc1	ZINC000282678263	268090647	/nfs/dbraw/zinc/09/06/47/268090647.db2.gz	OJIHNYZBYQBLSB-JKSUJKDBSA-N	0	3	331.366	3.182	20	30		EGEDHN
N#Cc1ccc(N2CCC([NH2+]Cc3ccc([O-])c(F)c3)CC2)cc1	ZINC000285984815	268107453	/nfs/dbraw/zinc/10/74/53/268107453.db2.gz	HVLOAOMFHVGBPP-UHFFFAOYSA-N	0	3	325.387	3.162	20	30		EGEDHN
N#Cc1ccc(CNC2(CO)C3CC4CC(C3)CC2C4)c(Cl)c1	ZINC000412001649	268232156	/nfs/dbraw/zinc/23/21/56/268232156.db2.gz	HHRXSWKVCAHAOP-UHFFFAOYSA-N	0	3	330.859	3.488	20	30		EGEDHN
N#Cc1ccc(CNC[C@]2(CO)C[C@H]2c2ccc(F)cc2)c(F)c1	ZINC000428543440	268233349	/nfs/dbraw/zinc/23/33/49/268233349.db2.gz	SERXFMDIKQHJND-HKUYNNGSSA-N	0	3	328.362	3.092	20	30		EGEDHN
N#Cc1cccc(C(=O)N(CCN2CCCCCC2)C2CCC2)c1	ZINC000359789624	268236244	/nfs/dbraw/zinc/23/62/44/268236244.db2.gz	KMTCSWSBECZPLE-UHFFFAOYSA-N	0	3	325.456	3.429	20	30		EGEDHN
N#Cc1ccc([C@@H](NC[C@H]2CCCC[C@H]2C(F)(F)F)C(N)=O)cc1	ZINC000487970532	268262117	/nfs/dbraw/zinc/26/21/17/268262117.db2.gz	SVPVXLSIMPQIDW-RBSFLKMASA-N	0	3	339.361	3.043	20	30		EGEDHN
CCCN(CCN1CCCCC1)C(=O)Nc1cnc(C#N)c(Cl)c1	ZINC000455766173	269652918	/nfs/dbraw/zinc/65/29/18/269652918.db2.gz	SQWIBCKVIJXPDZ-UHFFFAOYSA-N	0	3	349.866	3.336	20	30		EGEDHN
C[C@H]1CCC[C@@H](NC(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)C1	ZINC000047034930	275140229	/nfs/dbraw/zinc/14/02/29/275140229.db2.gz	PTXNHNNQAOSEMO-QFBILLFUSA-N	0	3	342.487	3.210	20	30		EGEDHN
CN1CCC[C@@H](CNC(=O)c2cccc(Oc3ccc(C#N)cc3)c2)C1	ZINC000108339089	275175178	/nfs/dbraw/zinc/17/51/78/275175178.db2.gz	GSKMHWHPKHJVEA-KRWDZBQOSA-N	0	3	349.434	3.422	20	30		EGEDHN
COc1ccc([C@H](CNc2ccc(C#N)cc2)N(C)C)cc1OC	ZINC000280465242	275454199	/nfs/dbraw/zinc/45/41/99/275454199.db2.gz	MHEHWYSONJKAGG-KRWDZBQOSA-N	0	3	325.412	3.290	20	30		EGEDHN
CCCN(CCN1CCCC1)C(=O)N[C@@H](C)c1ccc(C#N)cc1	ZINC000286942253	276060839	/nfs/dbraw/zinc/06/08/39/276060839.db2.gz	HVMWQAXSDYTKKT-INIZCTEOSA-N	0	3	328.460	3.137	20	30		EGEDHN
CC(C)(CO)[C@H](NC[C@H](O)c1ccc(C#N)cc1)c1cccs1	ZINC000289782818	276393652	/nfs/dbraw/zinc/39/36/52/276393652.db2.gz	MSYMSZMJODCUFG-DOTOQJQBSA-N	0	3	330.453	3.003	20	30		EGEDHN
Cc1ccc(C#N)cc1NC(=O)NCCCN1CCc2ccccc2C1	ZINC000058452795	307348928	/nfs/dbraw/zinc/34/89/28/307348928.db2.gz	DOODRMWECHZPLI-UHFFFAOYSA-N	0	3	348.450	3.437	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)c1nc(C(C)(C)C)ns1	ZINC000159963611	307882820	/nfs/dbraw/zinc/88/28/20/307882820.db2.gz	GEAQMQWKPZBQQE-UHFFFAOYSA-N	0	3	343.500	3.275	20	30		EGEDHN
CN(C)[C@@H](CNc1nc2c(cc1C#N)CCCC2)Cc1ccccc1	ZINC000535254111	314034691	/nfs/dbraw/zinc/03/46/91/314034691.db2.gz	BINHOVPICFBODE-LJQANCHMSA-N	0	3	334.467	3.417	20	30		EGEDHN
CC[C@@H]1CN(Cc2cccc(OCc3cccc(C#N)c3)c2)C[C@@H]1O	ZINC000539899866	314350012	/nfs/dbraw/zinc/35/00/12/314350012.db2.gz	XYJZXUHOHFKKAK-CTNGQTDRSA-N	0	3	336.435	3.340	20	30		EGEDHN
COC(=O)[C@H](Cc1ccccc1)[C@@H](C)NCc1ccc(C#N)cc1F	ZINC000551721734	315165249	/nfs/dbraw/zinc/16/52/49/315165249.db2.gz	GHTHJDYDISDLKE-RDTXWAMCSA-N	0	3	340.398	3.207	20	30		EGEDHN
N#Cc1ccc2c(c1)CCCC[C@@H]2Nc1ccc(N2CCNCC2)cn1	ZINC000564649705	316181696	/nfs/dbraw/zinc/18/16/96/316181696.db2.gz	OTVMTVWKOUUEEX-FQEVSTJZSA-N	0	3	347.466	3.242	20	30		EGEDHN
CC(C)c1ccccc1OC[C@@H](O)CNCc1ccc(C#N)s1	ZINC000564855894	316218779	/nfs/dbraw/zinc/21/87/79/316218779.db2.gz	FSBSVAIEJDSVOD-AWEZNQCLSA-N	0	3	330.453	3.273	20	30		EGEDHN
CN(C)C[C@@H](CNC(=O)c1ccc(C#N)s1)c1ccc(Cl)cc1	ZINC000565088386	316263183	/nfs/dbraw/zinc/26/31/83/316263183.db2.gz	CNCUCGKPNNDCAK-CYBMUJFWSA-N	0	3	347.871	3.348	20	30		EGEDHN
CCCCN(Cc1cnc2c(C#N)cnn2c1)[C@@H]1CCCC[C@H]1OC	ZINC000570720770	317098455	/nfs/dbraw/zinc/09/84/55/317098455.db2.gz	MWIJFTXCZPHDAT-QZTJIDSGSA-N	0	3	341.459	3.161	20	30		EGEDHN
Cc1cnc(CNC2CCC(Oc3ncccc3C#N)CC2)s1	ZINC000573891256	317538693	/nfs/dbraw/zinc/53/86/93/317538693.db2.gz	IGFROEQJFZRZEH-UHFFFAOYSA-N	0	3	328.441	3.198	20	30		EGEDHN
Cc1cc(CN[C@@H](C)[C@@H]2CN(Cc3ccccc3)CCO2)ccc1C#N	ZINC000574714073	317628423	/nfs/dbraw/zinc/62/84/23/317628423.db2.gz	YFCOEQAXPGKJJL-AVRDEDQJSA-N	0	3	349.478	3.246	20	30		EGEDHN
N#Cc1ccsc1NC(=O)CCN1CCCc2ccccc2C1	ZINC000171594154	323241900	/nfs/dbraw/zinc/24/19/00/323241900.db2.gz	OABPMBTVFJNAAX-UHFFFAOYSA-N	0	3	325.437	3.397	20	30		EGEDHN
COc1ccc(Cl)cc1NC(=O)CCNCc1cc(C#N)cs1	ZINC000177709163	323344392	/nfs/dbraw/zinc/34/43/92/323344392.db2.gz	CJYHINDSCMNDEY-UHFFFAOYSA-N	0	3	349.843	3.400	20	30		EGEDHN
C[C@H]1CN(Cc2ccccc2)C[C@@H]1Nc1ccc(C#N)c([N+](=O)[O-])c1	ZINC000389832266	324280190	/nfs/dbraw/zinc/28/01/90/324280190.db2.gz	IDEPGKNGFFKJAI-KSSFIOAISA-N	0	3	336.395	3.399	20	30		EGEDHN
COc1ccc([C@H](CNc2ccnc(C#N)c2)N2CCCCC2)cc1	ZINC000577010657	324724434	/nfs/dbraw/zinc/72/44/34/324724434.db2.gz	NMZSKFGUYPQJPP-FQEVSTJZSA-N	0	3	336.439	3.023	20	30		EGEDHN
C[C@H](CCc1cccc(F)c1)N1CCN(c2cnccc2C#N)CC1	ZINC000579187322	325072692	/nfs/dbraw/zinc/07/26/92/325072692.db2.gz	PMHNMGXZXVEYCZ-MRXNPFEDSA-N	0	3	338.430	3.236	20	30		EGEDHN
N#Cc1ccc2c(c1)[C@H](N[C@@H]1CCN(C(=O)C3CCCCC3)C1)CC2	ZINC000583781926	325550510	/nfs/dbraw/zinc/55/05/10/325550510.db2.gz	JYEWPMTVCATNMN-UYAOXDASSA-N	0	3	337.467	3.316	20	30		EGEDHN
CC(C)N(Cc1cc(Br)ccc1F)C(=O)C(C)C#N	ZINC000344958408	456877955	/nfs/dbraw/zinc/87/79/55/456877955.db2.gz	WRXLWYWFUINRJX-JTQLQIEISA-N	0	3	327.197	3.485	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2c(Cl)c3ccccc3n2C)CC1	ZINC000264487072	455222634	/nfs/dbraw/zinc/22/26/34/455222634.db2.gz	NBTPEPNJUPPHFP-UHFFFAOYSA-N	0	3	331.847	3.212	20	30		EGEDHN
C=CCN1CCC(NC(=O)C[C@H](c2ccccc2)C(F)(F)F)CC1	ZINC000264519073	455229547	/nfs/dbraw/zinc/22/95/47/455229547.db2.gz	WAZMVRZCEHQDIT-MRXNPFEDSA-N	0	3	340.389	3.489	20	30		EGEDHN
C=CCN1CCC(NC(=O)NCC[C@H](C)c2ccc(OC)cc2)CC1	ZINC000173199699	455246487	/nfs/dbraw/zinc/24/64/87/455246487.db2.gz	ZUBRMPHKRFUTNH-INIZCTEOSA-N	0	3	345.487	3.138	20	30		EGEDHN
COc1ccc(NC2CCN(Cc3ccc(C#N)cc3)CC2)c(C)n1	ZINC000183192562	455248057	/nfs/dbraw/zinc/24/80/57/455248057.db2.gz	APKTXXYZOCPDRK-UHFFFAOYSA-N	0	3	336.439	3.347	20	30		EGEDHN
CCN(CCC#N)C(=O)CN[C@H](C)c1ccc(-c2ccncc2)cc1	ZINC000180885604	455260729	/nfs/dbraw/zinc/26/07/29/455260729.db2.gz	IIJPSZLZMQTRIO-MRXNPFEDSA-N	0	3	336.439	3.161	20	30		EGEDHN
C[C@@H](NCCC(=O)N(C)CCC#N)c1ccc(-c2ccncc2)cc1	ZINC000180928314	455264754	/nfs/dbraw/zinc/26/47/54/455264754.db2.gz	FZEQZQIYWMBBLL-MRXNPFEDSA-N	0	3	336.439	3.161	20	30		EGEDHN
CCO[C@@H]1C[C@](CO)(NCc2ccccc2C(C)(C)C#N)C1(C)C	ZINC000189984013	455265953	/nfs/dbraw/zinc/26/59/53/455265953.db2.gz	LZVIIOUAAQFISU-YLJYHZDGSA-N	0	3	330.472	3.143	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@H](COC)C2CC2)cc1OC	ZINC000623470708	460567743	/nfs/dbraw/zinc/56/77/43/460567743.db2.gz	XSZJGJFRISFXLO-OAHLLOKOSA-N	0	3	325.836	3.428	20	30		EGEDHN
CC[NH+](CC)[C@@H](C/N=C/c1c([O-])c(C)ncc1CO)c1ccccc1	ZINC000005111017	452837858	/nfs/dbraw/zinc/83/78/58/452837858.db2.gz	SPBUXMIZHAKSDC-CIPMJJFUSA-N	0	3	341.455	3.090	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)N1CCS[C@@H](C)[C@@H]1C)C(C)C	ZINC000605349500	460568498	/nfs/dbraw/zinc/56/84/98/460568498.db2.gz	YOZXRKJXHFGGTN-YESZJQIVSA-N	0	3	339.549	3.220	20	30		EGEDHN
Cc1ccc(C(=O)C(C(=S)[N-]C2CC2)[n+]2ccccc2)cc1C	ZINC000006815050	452994735	/nfs/dbraw/zinc/99/47/35/452994735.db2.gz	KZRWOCXSQZGSIN-UHFFFAOYSA-O	0	3	325.457	3.282	20	30		EGEDHN
C[C@@]1(C#N)CCCN(C(=O)NC[C@H](c2ccccc2)N2CCCC2)C1	ZINC000612354994	460603744	/nfs/dbraw/zinc/60/37/44/460603744.db2.gz	DMUPQNLPZIHHLF-QUCCMNQESA-N	0	3	340.471	3.159	20	30		EGEDHN
COc1cccc(CN(C)CCC(=O)Nc2sccc2C#N)c1	ZINC000021472212	453676936	/nfs/dbraw/zinc/67/69/36/453676936.db2.gz	CBAMUWKRANGXLU-UHFFFAOYSA-N	0	3	329.425	3.089	20	30		EGEDHN
C[C@H](NC[C@@H](O)COc1ccc(Cl)cc1)c1ccc(C#N)cc1	ZINC000030532767	453836472	/nfs/dbraw/zinc/83/64/72/453836472.db2.gz	BOPWEAHBNGYFQF-SUMWQHHRSA-N	0	3	330.815	3.302	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N1CC[C@H](COCC)C1	ZINC000081520408	453882164	/nfs/dbraw/zinc/88/21/64/453882164.db2.gz	BBFFNZLERGNGEM-HOTGVXAUSA-N	0	3	336.501	3.010	20	30		EGEDHN
C[C@H](CC#N)Sc1ccccc1NC(=O)NC1CCN(C)CC1	ZINC000066955825	453890091	/nfs/dbraw/zinc/89/00/91/453890091.db2.gz	MDCZEVJGYUPXRA-CYBMUJFWSA-N	0	3	332.473	3.297	20	30		EGEDHN
CC#CCCCC(=O)Nc1cccc(CN2CCC(CO)CC2)c1	ZINC000184462882	455384708	/nfs/dbraw/zinc/38/47/08/455384708.db2.gz	LNEXOONYXJTJKZ-UHFFFAOYSA-N	0	3	328.456	3.023	20	30		EGEDHN
C[C@H](c1ccccc1)N1CC[C@H](NC(=O)NCc2cccc(C#N)c2)C1	ZINC000054719990	453944180	/nfs/dbraw/zinc/94/41/80/453944180.db2.gz	WHRCHIIBEIFKFF-UZLBHIALSA-N	0	3	348.450	3.193	20	30		EGEDHN
CCCOc1cccc(C(=O)C(C#N)c2nnc3n2CCCCC3)c1	ZINC000054727055	453944794	/nfs/dbraw/zinc/94/47/94/453944794.db2.gz	LOHTZOJRMTZYFS-INIZCTEOSA-N	0	3	338.411	3.283	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(Br)cc2C)CC1	ZINC000067706197	453959353	/nfs/dbraw/zinc/95/93/53/453959353.db2.gz	CYZXVVNYSKOLRL-UHFFFAOYSA-N	0	3	335.245	3.041	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H]2C[C@H]2c2ccc(F)cc2F)CC1	ZINC000623579194	460623104	/nfs/dbraw/zinc/62/31/04/460623104.db2.gz	RBJWYPGBGXVLGM-FUHWJXTLSA-N	0	3	349.425	3.160	20	30		EGEDHN
CC(C)CC[C@H](C)NC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000042999297	454035570	/nfs/dbraw/zinc/03/55/70/454035570.db2.gz	KZXKJPVHJPUNQJ-KRWDZBQOSA-N	0	3	344.503	3.456	20	30		EGEDHN
C[C@H]1CCCC[C@H]1NC(=O)N(CCN(C)C)Cc1ccc(C#N)cc1	ZINC000043045892	454037975	/nfs/dbraw/zinc/03/79/75/454037975.db2.gz	XHHISRMLLGNMGO-QFBILLFUSA-N	0	3	342.487	3.210	20	30		EGEDHN
N#CC(C(=O)c1ccc(-n2ccnc2)cc1)c1cnc2ccccc2n1	ZINC000190930819	455408491	/nfs/dbraw/zinc/40/84/91/455408491.db2.gz	DFIWUROGIRGGJL-MRXNPFEDSA-N	0	3	339.358	3.306	20	30		EGEDHN
C[C@H]1CCCN(CCNC(=O)N[C@H](CCC#N)c2ccccc2)C1	ZINC000245978519	455409699	/nfs/dbraw/zinc/40/96/99/455409699.db2.gz	XTKBUHQRVLZEDE-FUHWJXTLSA-N	0	3	328.460	3.063	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC(C)(C)c2cccc(F)c2)CC1	ZINC000077594102	454128844	/nfs/dbraw/zinc/12/88/44/454128844.db2.gz	OGLIGAIJOIMONY-UHFFFAOYSA-N	0	3	333.451	3.401	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)N1CCC(C#N)CC1)c1ccsc1	ZINC000057991417	454160047	/nfs/dbraw/zinc/16/00/47/454160047.db2.gz	XTKIGAHCJOQGAS-INIZCTEOSA-N	0	3	334.489	3.076	20	30		EGEDHN
O=C(NCC#Cc1ccccc1)NC1CCN(Cc2ccccc2)CC1	ZINC000045611330	454169953	/nfs/dbraw/zinc/16/99/53/454169953.db2.gz	NTTFSBHUKFJXJM-UHFFFAOYSA-N	0	3	347.462	3.002	20	30		EGEDHN
CCOc1ccccc1CN(CCCC#N)CCCn1ccnc1	ZINC000071114299	454200536	/nfs/dbraw/zinc/20/05/36/454200536.db2.gz	UYXATFVMFXVWGD-UHFFFAOYSA-N	0	3	326.444	3.478	20	30		EGEDHN
COc1cc(OC)cc(OCCN[C@H](C)c2ccc(C#N)cc2)c1	ZINC000130935285	454227236	/nfs/dbraw/zinc/22/72/36/454227236.db2.gz	FXJRWYGSPJBJOO-CQSZACIVSA-N	0	3	326.396	3.305	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCN2CC[C@@H](Nc3ccccc3)C2)cc1	ZINC000060369962	454282647	/nfs/dbraw/zinc/28/26/47/454282647.db2.gz	OPSMSCFETWHTNH-LJQANCHMSA-N	0	3	334.423	3.073	20	30		EGEDHN
C=CCOc1c(Br)cc(CN[C@H](C)COC)cc1OC	ZINC000072659462	454323403	/nfs/dbraw/zinc/32/34/03/454323403.db2.gz	FHMKBYSNZMOSRG-LLVKDONJSA-N	0	3	344.249	3.147	20	30		EGEDHN
C[C@H](N[C@@H]1CC(C)(C)OC1(C)C)C(=O)N(CCC#N)c1ccccc1	ZINC000132491733	454343411	/nfs/dbraw/zinc/34/34/11/454343411.db2.gz	ZRSGEANPVOLRPU-DOTOQJQBSA-N	0	3	343.471	3.257	20	30		EGEDHN
N#Cc1ccc(CNC(=O)N[C@H]2CCCN(Cc3ccccc3)C2)cc1	ZINC000061921975	454363118	/nfs/dbraw/zinc/36/31/18/454363118.db2.gz	YSMMITCSDGZLSC-FQEVSTJZSA-N	0	3	348.450	3.022	20	30		EGEDHN
C=CCN(Cc1ccc(Cl)s1)C(=O)C[C@H]1CSCCN1	ZINC000091135651	454387942	/nfs/dbraw/zinc/38/79/42/454387942.db2.gz	ZSEQTYGVFAKGTN-NSHDSACASA-N	0	3	330.906	3.011	20	30		EGEDHN
C=CCC(CC=C)C(=O)NCc1ccc(CN2CCC(O)CC2)cc1	ZINC000133429572	454424844	/nfs/dbraw/zinc/42/48/44/454424844.db2.gz	ZWZQSMBQFVBQMK-UHFFFAOYSA-N	0	3	342.483	3.028	20	30		EGEDHN
C[C@@H]1CN(CC2CCN(c3ccc(C#N)cc3F)CC2)C[C@H](C)O1	ZINC000091478801	454440169	/nfs/dbraw/zinc/44/01/69/454440169.db2.gz	XUIDBMGYFZMOIC-GASCZTMLSA-N	0	3	331.435	3.023	20	30		EGEDHN
CCOc1ccccc1NC(=O)C(C#N)C(=O)c1ccc(F)cc1	ZINC000103504656	454560881	/nfs/dbraw/zinc/56/08/81/454560881.db2.gz	LXAALJMFOKJKPX-CQSZACIVSA-N	0	3	326.327	3.186	20	30		EGEDHN
C=CCOc1cccc(NC(=O)NC[C@H](C)N2CCC(C)CC2)c1	ZINC000065416870	454562427	/nfs/dbraw/zinc/56/24/27/454562427.db2.gz	YOTYESNTUKYSST-INIZCTEOSA-N	0	3	331.460	3.493	20	30		EGEDHN
CN(C(=O)c1cccc(CC#N)c1)[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000074445836	454582255	/nfs/dbraw/zinc/58/22/55/454582255.db2.gz	SGRURXZXZKQXDV-OAQYLSRUSA-N	0	3	347.462	3.489	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(Oc3ccncc3)cc2)CC1	ZINC000050487192	454587190	/nfs/dbraw/zinc/58/71/90/454587190.db2.gz	PNOHJKCQUTUADL-UHFFFAOYSA-N	0	3	335.407	3.158	20	30		EGEDHN
CN(C)CCN(Cc1ccc(F)cc1F)C(=O)c1sccc1C#N	ZINC000052050570	454651629	/nfs/dbraw/zinc/65/16/29/454651629.db2.gz	GCKUYXMOHWSVCT-UHFFFAOYSA-N	0	3	349.406	3.102	20	30		EGEDHN
C[C@@H]1CN(CCCCNc2ccc3cc(C#N)ccc3n2)C[C@H](C)O1	ZINC000092920673	454653905	/nfs/dbraw/zinc/65/39/05/454653905.db2.gz	HPLLXXXJZZERNB-IYBDPMFKSA-N	0	3	338.455	3.408	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)/C=C/c2nc3ccccc3s2)CC1	ZINC000106040158	454676038	/nfs/dbraw/zinc/67/60/38/454676038.db2.gz	ZHJYXSXMNXAIDF-BQYQJAHWSA-N	0	3	341.480	3.466	20	30		EGEDHN
CC[C@@]1(NCC(=O)Nc2ccccc2S[C@@H](C)CC#N)CCOC1	ZINC000616865339	460648809	/nfs/dbraw/zinc/64/88/09/460648809.db2.gz	LGKZWHLUBCWUIT-KBXCAEBGSA-N	0	3	347.484	3.178	20	30		EGEDHN
C=CC1CCN(Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1	ZINC000093359151	454708667	/nfs/dbraw/zinc/70/86/67/454708667.db2.gz	BRWHJQFPUAUPEU-UHFFFAOYSA-N	0	3	326.400	3.393	20	30		EGEDHN
CCOC(=O)CC[C@@H]1CCCN(Cc2cc(C#N)ccc2OC)C1	ZINC000162096377	454751287	/nfs/dbraw/zinc/75/12/87/454751287.db2.gz	LHBHTWQXALJSIA-HNNXBMFYSA-N	0	3	330.428	3.122	20	30		EGEDHN
N#C[C@@H](NC(=O)c1cccc(CN2CCCC2)c1)C1CCCCC1	ZINC000176638965	454767166	/nfs/dbraw/zinc/76/71/66/454767166.db2.gz	HTWBAKDTZSUFPO-LJQANCHMSA-N	0	3	325.456	3.485	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)NC[C@@H]1CCCN(Cc2cccs2)C1	ZINC000139955166	454814012	/nfs/dbraw/zinc/81/40/12/454814012.db2.gz	FPLQYTCCQJDSBM-HOTGVXAUSA-N	0	3	336.501	3.058	20	30		EGEDHN
N#CC1CCN(C[C@@H](O)Cn2c3ccccc3c3ccccc32)CC1	ZINC000141989218	454833148	/nfs/dbraw/zinc/83/31/48/454833148.db2.gz	NGBCJQBGIQNABW-QGZVFWFLSA-N	0	3	333.435	3.391	20	30		EGEDHN
CC(C)(C#N)CCCN[C@@](C)(C(N)=O)c1cccc(C(F)(F)F)c1	ZINC000177381681	454858241	/nfs/dbraw/zinc/85/82/41/454858241.db2.gz	OVKKLZUGBJAXHB-MRXNPFEDSA-N	0	3	341.377	3.325	20	30		EGEDHN
C=CCOc1cccc(CN(C)[C@H](CO)c2ccc(OC)cc2)c1	ZINC000126412260	454891669	/nfs/dbraw/zinc/89/16/69/454891669.db2.gz	RLZXORANLVNVBW-HXUWFJFHSA-N	0	3	327.424	3.425	20	30		EGEDHN
CCc1c(C(=O)C(C#N)c2nc3ccccc3n2C)cnn1CC(C)C	ZINC000165260785	454896949	/nfs/dbraw/zinc/89/69/49/454896949.db2.gz	YOYYFEYCOMMFIY-AWEZNQCLSA-N	0	3	349.438	3.478	20	30		EGEDHN
C#CCCOc1ccc(CNCc2ccc(C(=O)NCC)cc2)cc1	ZINC000113322120	454923170	/nfs/dbraw/zinc/92/31/70/454923170.db2.gz	PNUZTCAVNRNTKP-UHFFFAOYSA-N	0	3	336.435	3.128	20	30		EGEDHN
C#CCOc1ccc(CNCc2ccc(-n3ccnc3)c(F)c2)cc1	ZINC000113327978	454923428	/nfs/dbraw/zinc/92/34/28/454923428.db2.gz	FBBXVGBXJFHPJJ-UHFFFAOYSA-N	0	3	335.382	3.313	20	30		EGEDHN
Cc1ccc(CN(C)C)cc1NC(=O)c1c(F)cc(C#N)cc1F	ZINC000126997542	454931119	/nfs/dbraw/zinc/93/11/19/454931119.db2.gz	HCACEYYVVWBQCT-UHFFFAOYSA-N	0	3	329.350	3.459	20	30		EGEDHN
N#Cc1ccc(NC(=O)CCN2CCC[C@@H](Nc3ccccc3)C2)cc1	ZINC000155011260	454953511	/nfs/dbraw/zinc/95/35/11/454953511.db2.gz	BABWDDVLDGJDTQ-HXUWFJFHSA-N	0	3	348.450	3.463	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN2CCC[C@H](Nc3ccccc3)C2)c1	ZINC000155068707	454960098	/nfs/dbraw/zinc/96/00/98/454960098.db2.gz	HIEXZDQWJTWYOC-FQEVSTJZSA-N	0	3	348.450	3.463	20	30		EGEDHN
CC(C)CN1CCN(CC#Cc2ccc(OC(F)(F)F)cc2)CC1	ZINC000178753718	454973228	/nfs/dbraw/zinc/97/32/28/454973228.db2.gz	NUMVNYCYSUCLNM-UHFFFAOYSA-N	0	3	340.389	3.210	20	30		EGEDHN
CC[S@@](=O)[C@H]1CCC[C@H](NC2CC(C#N)(c3ccccc3)C2)C1	ZINC000127544188	454975171	/nfs/dbraw/zinc/97/51/71/454975171.db2.gz	DUSQDIZEOHFUDQ-MQVVDTIRSA-N	0	3	330.497	3.280	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@@H](C2CCCC2)C(F)(F)F)CC1	ZINC000155272587	454982096	/nfs/dbraw/zinc/98/20/96/454982096.db2.gz	ZUNKCWCOECBTIT-HNNXBMFYSA-N	0	3	347.425	3.447	20	30		EGEDHN
N#CCCCOc1cccc(CNCc2ccc3c(c2)OCCO3)c1	ZINC000171246128	455050588	/nfs/dbraw/zinc/05/05/88/455050588.db2.gz	RFABXWGHFIITLT-UHFFFAOYSA-N	0	3	338.407	3.430	20	30		EGEDHN
C[C@@H](c1ccccc1)N1CCC(NC(=O)N2CCC(C#N)CC2)CC1	ZINC000116435763	455056716	/nfs/dbraw/zinc/05/67/16/455056716.db2.gz	XTJANKYPVSUDAT-INIZCTEOSA-N	0	3	340.471	3.157	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)N(CCN(C)C)C1CCCC1	ZINC000128689762	455076987	/nfs/dbraw/zinc/07/69/87/455076987.db2.gz	WZJQCUVSPQHISL-UHFFFAOYSA-N	0	3	345.487	3.267	20	30		EGEDHN
CC(C)[C@@](C)(C#N)NC(=O)CNC1(c2ccc(F)cc2)CCCC1	ZINC000171694107	455087047	/nfs/dbraw/zinc/08/70/47/455087047.db2.gz	QZKLXDBEUDGFLT-GOSISDBHSA-N	0	3	331.435	3.239	20	30		EGEDHN
C=CCN1CCC(NC(=O)Cc2c(Cl)cccc2Cl)CC1	ZINC000171724968	455089293	/nfs/dbraw/zinc/08/92/93/455089293.db2.gz	GJXRCAOBLMRRSH-UHFFFAOYSA-N	0	3	327.255	3.303	20	30		EGEDHN
C[C@@](C#N)(NC(=O)CN[C@H](c1ccccc1)C1CCCC1)C1CC1	ZINC000171935044	455102761	/nfs/dbraw/zinc/10/27/61/455102761.db2.gz	HAIDYVIKIGVOSD-UXHICEINSA-N	0	3	325.456	3.316	20	30		EGEDHN
CCN1CCN(Cc2ccc(NCc3ccc(C#N)s3)cc2)CC1	ZINC000156353854	455108521	/nfs/dbraw/zinc/10/85/21/455108521.db2.gz	PJCLLDCVGPUXOQ-UHFFFAOYSA-N	0	3	340.496	3.369	20	30		EGEDHN
C[C@@H]1CN(C[C@@H]2CCCN2CC#Cc2cccc(Cl)c2)C[C@H](C)O1	ZINC000156364033	455109010	/nfs/dbraw/zinc/10/90/10/455109010.db2.gz	DLHNFMCPASEGCC-QKLQHJQFSA-N	0	3	346.902	3.265	20	30		EGEDHN
C=CCNC(=O)[C@H](C)N[C@@H](c1cccc(C(F)(F)F)c1)C1CC1	ZINC000180058183	455124840	/nfs/dbraw/zinc/12/48/40/455124840.db2.gz	YRWCJGKVWQWKDZ-XHDPSFHLSA-N	0	3	326.362	3.437	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2ccc(N(C)C)c(Cl)c2)CC1	ZINC000172492475	455157541	/nfs/dbraw/zinc/15/75/41/455157541.db2.gz	BGAFAJVCKPATBW-UHFFFAOYSA-N	0	3	336.867	3.178	20	30		EGEDHN
C=CCOc1ccc(CN(CCO)Cc2ccccc2)cc1OC	ZINC000158321283	455291983	/nfs/dbraw/zinc/29/19/83/455291983.db2.gz	GDEIXWMCHNFYFI-UHFFFAOYSA-N	0	3	327.424	3.255	20	30		EGEDHN
C=CCOc1ccccc1CNC(=O)N1CC[C@@H](N2CCCCC2)C1	ZINC000264813941	455286672	/nfs/dbraw/zinc/28/66/72/455286672.db2.gz	GLYXHZUCLMYGNP-GOSISDBHSA-N	0	3	343.471	3.021	20	30		EGEDHN
C[C@H]1CCC[C@@](C#N)(NC(=O)C2CCN(Cc3ccccc3)CC2)C1	ZINC000265370299	455313786	/nfs/dbraw/zinc/31/37/86/455313786.db2.gz	OBOZPEGURBKJKX-LAUBAEHRSA-N	0	3	339.483	3.487	20	30		EGEDHN
CN1CCC[C@H](CNC(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)C1	ZINC000174092545	455358792	/nfs/dbraw/zinc/35/87/92/455358792.db2.gz	FFZCFQYVBBNAGO-LLVKDONJSA-N	0	3	340.349	3.040	20	30		EGEDHN
C[C@H](NCC(=O)NC1(C#N)CCCCC1)C(C)(C)c1ccccc1	ZINC000181799374	455383088	/nfs/dbraw/zinc/38/30/88/455383088.db2.gz	JDKCJQSJAOAHKO-INIZCTEOSA-N	0	3	327.472	3.285	20	30		EGEDHN
C[C@@H](NCc1ccc(N2CCO[C@@H](C)C2)nc1)c1ccc(C#N)cc1	ZINC000245908053	455396984	/nfs/dbraw/zinc/39/69/84/455396984.db2.gz	OVPHWTCIPMEMNL-JKSUJKDBSA-N	0	3	336.439	3.029	20	30		EGEDHN
COc1ccc(CN2CCN(CCCC(C)(C)C#N)CC2)cc1F	ZINC000174810987	455414980	/nfs/dbraw/zinc/41/49/80/455414980.db2.gz	TVAHUXXHBZXETI-UHFFFAOYSA-N	0	3	333.451	3.282	20	30		EGEDHN
CCN(C[C@H]1CCN(Cc2ccccc2)C1)C(=O)C1(C#N)CCCC1	ZINC000175291336	455434523	/nfs/dbraw/zinc/43/45/23/455434523.db2.gz	GEKNLHLYZMPMNV-IBGZPJMESA-N	0	3	339.483	3.441	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@@]2(C)Cc2ccccc2)CC1	ZINC000184868732	455464220	/nfs/dbraw/zinc/46/42/20/455464220.db2.gz	FOEXWWGZUXIXGB-NRFANRHFSA-N	0	3	341.499	3.444	20	30		EGEDHN
CCCn1ccnc1CCCN(C)Cc1cc(C#N)ccc1OC	ZINC000191495825	455491081	/nfs/dbraw/zinc/49/10/81/455491081.db2.gz	JTWXDZLBKVYOLT-UHFFFAOYSA-N	0	3	326.444	3.238	20	30		EGEDHN
N#Cc1cccc(NC(=O)CCN2CCC(c3ccncc3)CC2)c1	ZINC000191607601	455502339	/nfs/dbraw/zinc/50/23/39/455502339.db2.gz	JHNGUKGYPDLLOU-UHFFFAOYSA-N	0	3	334.423	3.161	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2cc(F)ccc2OCC2CC2)CC1	ZINC000191768497	455518394	/nfs/dbraw/zinc/51/83/94/455518394.db2.gz	RGUWTDGXMXBNMS-UHFFFAOYSA-N	0	3	347.434	3.386	20	30		EGEDHN
N#Cc1cc(C(=O)Nc2ccc(OCCN3CCCCC3)cc2)c[nH]1	ZINC000182492186	455524211	/nfs/dbraw/zinc/52/42/11/455524211.db2.gz	ILFZKXVTRARGNU-UHFFFAOYSA-N	0	3	338.411	3.003	20	30		EGEDHN
C=CCN(CC=C)C(=O)[C@@H](C)N[C@@H]1CCO[C@@H]1c1ccc(Cl)cc1	ZINC000192050935	455548755	/nfs/dbraw/zinc/54/87/55/455548755.db2.gz	QGZJWFAGESDVPQ-ZTFGCOKTSA-N	0	3	348.874	3.349	20	30		EGEDHN
C[C@@H]1CC/C(=C\C(=O)N(CCN(C)C)Cc2cccc(C#N)c2)C1	ZINC000267854068	455556872	/nfs/dbraw/zinc/55/68/72/455556872.db2.gz	MBTNMJGMGUCADU-VAFHRPCXSA-N	0	3	325.456	3.195	20	30		EGEDHN
C=C(C)[C@@H](NC(=O)NC[C@@H]1CCCN1CC)c1ccc(F)c(F)c1	ZINC000185510433	455570456	/nfs/dbraw/zinc/57/04/56/455570456.db2.gz	UTRYGYGJRAHLKF-WMLDXEAASA-N	0	3	337.414	3.366	20	30		EGEDHN
C[C@@H]1CCC[C@](C#N)(NC(=O)[C@H]2CCCN(Cc3ccccc3)C2)C1	ZINC000247557578	455624378	/nfs/dbraw/zinc/62/43/78/455624378.db2.gz	UHMRTEAPKFDUNJ-LMNJBCLMSA-N	0	3	339.483	3.487	20	30		EGEDHN
C[C@H](C#N)CSc1ccccc1NC(=O)N1CCN2CCC[C@H]2C1	ZINC000247658806	455635084	/nfs/dbraw/zinc/63/50/84/455635084.db2.gz	ZEVWGLBGKJECMR-CABCVRRESA-N	0	3	344.484	3.250	20	30		EGEDHN
C[C@@H](N[C@H]1CCC[C@H](C#N)C1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000192691554	455669767	/nfs/dbraw/zinc/66/97/67/455669767.db2.gz	VHQJTRJBYFWQRU-VKJFTORMSA-N	0	3	341.455	3.077	20	30		EGEDHN
C[C@H](N[C@H]1CCC[C@H](C#N)C1)c1ccc(OCC(=O)NC2CC2)cc1	ZINC000192691538	455669980	/nfs/dbraw/zinc/66/99/80/455669980.db2.gz	VHQJTRJBYFWQRU-MPGHIAIKSA-N	0	3	341.455	3.077	20	30		EGEDHN
N#C[C@@H]1CCC[C@H](N[C@H]2CCN(c3ccc(Cl)c(F)c3)C2=O)C1	ZINC000249051563	455742760	/nfs/dbraw/zinc/74/27/60/455742760.db2.gz	XNTFRIFVHFPBKE-WQGACYEGSA-N	0	3	335.810	3.256	20	30		EGEDHN
COC(=O)COc1ccc([C@H](C)NCc2ccc(C#N)cc2C)cc1	ZINC000186333485	455745870	/nfs/dbraw/zinc/74/58/70/455745870.db2.gz	UYWRHEQMZIDZPN-HNNXBMFYSA-N	0	3	338.407	3.269	20	30		EGEDHN
CCO[C@@H]1C[C@@H](NCc2ccc(C#N)s2)[C@H]1Oc1ccccc1	ZINC000249443384	455755488	/nfs/dbraw/zinc/75/54/88/455755488.db2.gz	MNTYCZZANISWGA-KZNAEPCWSA-N	0	3	328.437	3.334	20	30		EGEDHN
COC(=O)N1CCC([C@@H](C)NCC#Cc2ccc(Cl)cc2)CC1	ZINC000186387449	455759045	/nfs/dbraw/zinc/75/90/45/455759045.db2.gz	KKGGHALCFZDXSW-CQSZACIVSA-N	0	3	334.847	3.148	20	30		EGEDHN
C#CCN1CCC(C(=O)NC2CCC(C)(c3ccccc3)CC2)CC1	ZINC000269026051	455767267	/nfs/dbraw/zinc/76/72/67/455767267.db2.gz	GIFIQBPVJZIYEZ-UHFFFAOYSA-N	0	3	338.495	3.348	20	30		EGEDHN
CC1(C)CC[C@H](CN2CCCN(Cc3ccc(C#N)cc3)CC2)O1	ZINC000186444872	455769750	/nfs/dbraw/zinc/76/97/50/455769750.db2.gz	UKEWFSCWMNEFQA-LJQANCHMSA-N	0	3	327.472	3.024	20	30		EGEDHN
CO/N=C/c1ccc(C(=O)N[C@H](C)[C@@H](c2ccccc2)N(C)C)cc1	ZINC000186486308	455779384	/nfs/dbraw/zinc/77/93/84/455779384.db2.gz	HUQHYAUXSSXACS-CMTYYKMCSA-N	0	3	339.439	3.088	20	30		EGEDHN
CO/N=C/c1ccc(C(=O)N[C@@H](C)[C@@H](c2ccccc2)N(C)C)cc1	ZINC000186486294	455779677	/nfs/dbraw/zinc/77/96/77/455779677.db2.gz	HUQHYAUXSSXACS-FLWJNDPBSA-N	0	3	339.439	3.088	20	30		EGEDHN
CC[C@](C)(C#N)C(=O)N[C@@H]1CC2(CCN(C)CC2)Oc2ccccc21	ZINC000285109920	455791238	/nfs/dbraw/zinc/79/12/38/455791238.db2.gz	JTAZCQWYWYNXGA-VQIMIIECSA-N	0	3	341.455	3.031	20	30		EGEDHN
CC[C@@H](NCCNC(=O)c1ccccc1F)c1ccc(C#N)cc1	ZINC000278251492	455797903	/nfs/dbraw/zinc/79/79/03/455797903.db2.gz	MNPRMCDTZMSUQF-GOSISDBHSA-N	0	3	325.387	3.168	20	30		EGEDHN
COc1cc(NC2CCN([C@H]3CC[C@@H](C#N)C3)CC2)cc(OC)c1	ZINC000293931268	455800878	/nfs/dbraw/zinc/80/08/78/455800878.db2.gz	YWJBTWSEQFAWRK-PBHICJAKSA-N	0	3	329.444	3.272	20	30		EGEDHN
COc1cc(NC2CCN([C@@H]3CC[C@H](C#N)C3)CC2)cc(OC)c1	ZINC000293931272	455801485	/nfs/dbraw/zinc/80/14/85/455801485.db2.gz	YWJBTWSEQFAWRK-WMLDXEAASA-N	0	3	329.444	3.272	20	30		EGEDHN
CC[C@H](C)[C@H](CNCc1cn(CCC#N)nc1-c1ccncc1)OC	ZINC000294744887	455826609	/nfs/dbraw/zinc/82/66/09/455826609.db2.gz	HQFBQEHLAXGDND-YJBOKZPZSA-N	0	3	341.459	3.009	20	30		EGEDHN
CC[C@@H](N[C@@H]1CCCN(Cc2ccccn2)C1=O)c1ccc(C#N)cc1	ZINC000278367277	455830765	/nfs/dbraw/zinc/83/07/65/455830765.db2.gz	BVNBHMVSFYFCFO-WOJBJXKFSA-N	0	3	348.450	3.185	20	30		EGEDHN
C=CCC(C)(C)C(=O)Nc1cccc(CN2CCC(CO)CC2)c1	ZINC000294968073	455834908	/nfs/dbraw/zinc/83/49/08/455834908.db2.gz	MZHHFUFYLXXFBZ-UHFFFAOYSA-N	0	3	330.472	3.432	20	30		EGEDHN
C#CCN(C(=O)NC[C@H]1CCN(Cc2ccccc2)C1)C1CCCC1	ZINC000194417664	455839287	/nfs/dbraw/zinc/83/92/87/455839287.db2.gz	BZQDYWSQTLSPEJ-LJQANCHMSA-N	0	3	339.483	3.096	20	30		EGEDHN
CS[C@H]1CCN(Cc2cn(CCC#N)nc2-c2ccccc2)C1	ZINC000295123163	455840399	/nfs/dbraw/zinc/84/03/99/455840399.db2.gz	WWUVDDAOGFPDKX-KRWDZBQOSA-N	0	3	326.469	3.401	20	30		EGEDHN
C=CC[C@@H](C(=O)N1CCN(C2CCOCC2)C[C@@H]1C)c1ccccc1	ZINC000278898537	455853084	/nfs/dbraw/zinc/85/30/84/455853084.db2.gz	RIGYWYWRDPZPAS-FXAWDEMLSA-N	0	3	342.483	3.058	20	30		EGEDHN
COc1cccc([C@H](C)N[C@H]2CCCN(c3ccc(C#N)cc3)C2=O)c1	ZINC000272173831	455866227	/nfs/dbraw/zinc/86/62/27/455866227.db2.gz	GTAPILBMSZIKEL-YWZLYKJASA-N	0	3	349.434	3.413	20	30		EGEDHN
C=CCN1CCC(NC(=O)/C=C\c2ccc(OC(F)F)cc2)CC1	ZINC000255758622	455873866	/nfs/dbraw/zinc/87/38/66/455873866.db2.gz	VGVZIBZNOPIGOR-YVMONPNESA-N	0	3	336.382	3.068	20	30		EGEDHN
CCN1CCC(n2nccc2NC(=O)/C=C/c2ccc(C#N)cc2)CC1	ZINC000279884039	455876022	/nfs/dbraw/zinc/87/60/22/455876022.db2.gz	ULKUDZBURSQXBV-BQYQJAHWSA-N	0	3	349.438	3.063	20	30		EGEDHN
Cn1cc(CN2CCC[C@@H](c3ncc[nH]3)C2)c(-c2ccc(C#N)cc2)n1	ZINC000272215839	455879015	/nfs/dbraw/zinc/87/90/15/455879015.db2.gz	BFSKHPTZYUWBTP-QGZVFWFLSA-N	0	3	346.438	3.061	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@@H](C)N1CCN([C@@H](C)CC)CC1	ZINC000296254646	455891945	/nfs/dbraw/zinc/89/19/45/455891945.db2.gz	XNVASJIWNNAWGH-DLBZAZTESA-N	0	3	349.544	3.067	20	30		EGEDHN
C=CCN1CCC(NC(=O)c2[nH]c(-c3cccc(C)c3)nc2C)CC1	ZINC000270195018	455898840	/nfs/dbraw/zinc/89/88/40/455898840.db2.gz	LLMPUMNCRZHNSS-UHFFFAOYSA-N	0	3	338.455	3.074	20	30		EGEDHN
CN(CCCC1(C#N)CCOCC1)[C@@H](CO)c1ccc(Cl)cc1	ZINC000296361767	455918255	/nfs/dbraw/zinc/91/82/55/455918255.db2.gz	QXQAFJMYJSIVOA-KRWDZBQOSA-N	0	3	336.863	3.406	20	30		EGEDHN
C#CC[C@H](NC(=O)NCc1cccc(CN(C)C)c1)c1ccccc1	ZINC000270384678	455944459	/nfs/dbraw/zinc/94/44/59/455944459.db2.gz	GVIWHHWMNKJDNE-FQEVSTJZSA-N	0	3	335.451	3.312	20	30		EGEDHN
CN(C)CCN(Cc1cccc(C#N)c1)C(=O)N1CCc2ccccc21	ZINC000195356753	455949372	/nfs/dbraw/zinc/94/93/72/455949372.db2.gz	JLZBATYYDZJJDQ-UHFFFAOYSA-N	0	3	348.450	3.105	20	30		EGEDHN
C=CCC[C@@H](O)CN(CCc1ccccn1)Cc1ccc(OC)cc1	ZINC000280361232	455955118	/nfs/dbraw/zinc/95/51/18/455955118.db2.gz	JSTWJSOUPJIDCO-HXUWFJFHSA-N	0	3	340.467	3.462	20	30		EGEDHN
C=CCCCCCON=C(N)c1ccccc1CN1CCC(O)CC1	ZINC000195391743	455955416	/nfs/dbraw/zinc/95/54/16/455955416.db2.gz	AKNONFGOONZIHM-UHFFFAOYSA-N	0	3	345.487	3.027	20	30		EGEDHN
C=CCC[C@@H](NC(=O)Nc1ccnn1CCN(C)C)c1ccccc1	ZINC000296721721	456019239	/nfs/dbraw/zinc/01/92/39/456019239.db2.gz	BIXKMBIYZQZMCQ-QGZVFWFLSA-N	0	3	341.459	3.274	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1CNCc1cc(OC)ccc1OC(F)F	ZINC000280666801	456026868	/nfs/dbraw/zinc/02/68/68/456026868.db2.gz	PLXMWLXKLOMIBQ-BLLLJJGKSA-N	0	3	327.371	3.367	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1CN[C@H](C(=O)N(CC)CC)c1ccccc1	ZINC000280715450	456036969	/nfs/dbraw/zinc/03/69/69/456036969.db2.gz	UKODVGIWKQBFJB-QYZOEREBSA-N	0	3	330.472	3.167	20	30		EGEDHN
CNC(=O)OC[C@@H]1CCCCN1Cc1ccccc1C(C)(C)C#N	ZINC000287002593	456059133	/nfs/dbraw/zinc/05/91/33/456059133.db2.gz	QCZUBFSSYIIKSL-INIZCTEOSA-N	0	3	329.444	3.198	20	30		EGEDHN
CCCN(CCN1CCCCCC1)C(=O)c1cccc(CC#N)c1	ZINC000288849055	456107922	/nfs/dbraw/zinc/10/79/22/456107922.db2.gz	DDNQHKHQSLXJOF-UHFFFAOYSA-N	0	3	327.472	3.481	20	30		EGEDHN
CSC1(CN2CCN(c3c(C#N)cnc4ccccc43)CC2)CC1	ZINC000289043037	456113147	/nfs/dbraw/zinc/11/31/47/456113147.db2.gz	BPDNKSUNLRGNEM-UHFFFAOYSA-N	0	3	338.480	3.124	20	30		EGEDHN
C#C[C@@H](NCc1cc(OC)c(OCC(F)F)c(OC)c1)C(C)C	ZINC000289516545	456128531	/nfs/dbraw/zinc/12/85/31/456128531.db2.gz	PASKUZCTAJJQPQ-CYBMUJFWSA-N	0	3	327.371	3.095	20	30		EGEDHN
COC[C@]1(CN[C@H](C)c2ccc(C#N)cc2)OCCc2ccccc21	ZINC000289657235	456135086	/nfs/dbraw/zinc/13/50/86/456135086.db2.gz	GMQGLEFQYLPDCF-IERDGZPVSA-N	0	3	336.435	3.323	20	30		EGEDHN
C#Cc1ccccc1CC(=O)NC[C@H](c1cccs1)N1CCCC1	ZINC000289708374	456138363	/nfs/dbraw/zinc/13/83/63/456138363.db2.gz	GEIOZPKXVDNMEG-GOSISDBHSA-N	0	3	338.476	3.225	20	30		EGEDHN
CC(C)c1csc(C(C#N)C(=O)Nc2ccc3c(c2)OCCO3)n1	ZINC000271137623	456138503	/nfs/dbraw/zinc/13/85/03/456138503.db2.gz	NPBWZFMCXITCGA-GFCCVEGCSA-N	0	3	343.408	3.284	20	30		EGEDHN
C#CCCOc1ccc(CN2CCC[C@@](O)(C(F)(F)F)CC2)cc1	ZINC000289734954	456138967	/nfs/dbraw/zinc/13/89/67/456138967.db2.gz	PXRDYQCBWXVGKK-KRWDZBQOSA-N	0	3	341.373	3.368	20	30		EGEDHN
C=C[C@@H](CO)N[C@H]1CCCc2nc(-c3ccc(OC)cc3)sc21	ZINC000289781150	456142617	/nfs/dbraw/zinc/14/26/17/456142617.db2.gz	MSPULYVXFDRCTC-ZFWWWQNUSA-N	0	3	330.453	3.333	20	30		EGEDHN
C=C[C@H](CO)N[C@@H]1CCCc2nc(-c3ccc(OC)cc3)sc21	ZINC000289781145	456142791	/nfs/dbraw/zinc/14/27/91/456142791.db2.gz	MSPULYVXFDRCTC-UKRRQHHQSA-N	0	3	330.453	3.333	20	30		EGEDHN
CCc1nnc(NC[C@@H](c2ccc(F)cc2)N(C)C)c(C#N)c1CC	ZINC000301610105	456160668	/nfs/dbraw/zinc/16/06/68/456160668.db2.gz	BXXAEXICVOBKOE-SFHVURJKSA-N	0	3	341.434	3.327	20	30		EGEDHN
C=CCSc1ccccc1NC(=O)CN[C@@]1(C)CCO[C@@H]1C1CC1	ZINC000273077414	456169794	/nfs/dbraw/zinc/16/97/94/456169794.db2.gz	PVRUTALQZWKRSC-MOPGFXCFSA-N	0	3	346.496	3.450	20	30		EGEDHN
C=CC[C@@H](CC)NC(=O)N(C)C1CCN(CCc2ccccn2)CC1	ZINC000281263130	456182601	/nfs/dbraw/zinc/18/26/01/456182601.db2.gz	HBUDKRJRQSWDCK-QGZVFWFLSA-N	0	3	344.503	3.085	20	30		EGEDHN
C=CCOc1ccc(CN[C@H](CO)Cc2ccc(C)cc2)cc1OC	ZINC000188990138	456190865	/nfs/dbraw/zinc/19/08/65/456190865.db2.gz	NIWCIQRQAOWJDE-IBGZPJMESA-N	0	3	341.451	3.262	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N[C@H]2C[C@H](c3ccccc3F)C2)CC1	ZINC000281325048	456201707	/nfs/dbraw/zinc/20/17/07/456201707.db2.gz	CEWBTYXNBXUWDA-JCNLHEQBSA-N	0	3	345.462	3.411	20	30		EGEDHN
CC(C)(COCc1ccccc1)NCC(=O)Nc1cccc(C#N)c1	ZINC000281380368	456219205	/nfs/dbraw/zinc/21/92/05/456219205.db2.gz	MFGXHLPWVNEJAI-UHFFFAOYSA-N	0	3	337.423	3.082	20	30		EGEDHN
C#C[C@H](N[C@@H](C)CC(=O)Nc1cc(OC)ccc1OC)C(C)(C)C	ZINC000290157234	456255472	/nfs/dbraw/zinc/25/54/72/456255472.db2.gz	LPDRWYGINRRNAE-GUYCJALGSA-N	0	3	332.444	3.058	20	30		EGEDHN
CN(CC(=O)N[C@](C)(C#N)C1CC1)[C@H]1CCC[C@@H]1c1ccccc1	ZINC000297622493	456265977	/nfs/dbraw/zinc/26/59/77/456265977.db2.gz	VYVNVHRNVKICKG-WSTZPKSXSA-N	0	3	325.456	3.063	20	30		EGEDHN
CCc1c(C)nc2ccccc2c1N(C)CCCc1[nH]nc(N)c1C#N	ZINC000302061591	456277893	/nfs/dbraw/zinc/27/78/93/456277893.db2.gz	SELMHXPPKXTUET-UHFFFAOYSA-N	0	3	348.454	3.352	20	30		EGEDHN
COc1cc(CNC[C@@H](c2ccc(F)cc2)N(C)C)ccc1C#N	ZINC000281642084	456280376	/nfs/dbraw/zinc/28/03/76/456280376.db2.gz	JANSSVCKYDUYKC-SFHVURJKSA-N	0	3	327.403	3.098	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1C	ZINC000275682287	456284814	/nfs/dbraw/zinc/28/48/14/456284814.db2.gz	ZIUBVVXWNBVDOB-HFSMHLIXSA-N	0	3	344.499	3.242	20	30		EGEDHN
C#CCOc1cc(F)ccc1NC1CCN(c2ccncc2)CC1	ZINC000297760696	456288266	/nfs/dbraw/zinc/28/82/66/456288266.db2.gz	LQCBSMNATQZVHI-UHFFFAOYSA-N	0	3	325.387	3.314	20	30		EGEDHN
COc1cc(CN[C@H]2CCO[C@@H]2c2ccc(F)c(F)c2)ccc1C#N	ZINC000281797184	456322902	/nfs/dbraw/zinc/32/29/02/456322902.db2.gz	VAKYVFMOXMISIL-PKOBYXMFSA-N	0	3	344.361	3.465	20	30		EGEDHN
CC(C)OC(=O)C[C@H]1CCCN(CCCC2(C#N)CCOCC2)C1	ZINC000337214599	456337747	/nfs/dbraw/zinc/33/77/47/456337747.db2.gz	XQAHASJHGCCGQQ-QGZVFWFLSA-N	0	3	336.476	3.141	20	30		EGEDHN
CN(CCC(C)(C)C#N)C[C@@H](O)c1cccc(Br)c1	ZINC000298025855	456347111	/nfs/dbraw/zinc/34/71/11/456347111.db2.gz	BNVXRDHFOQDXJC-CQSZACIVSA-N	0	3	325.250	3.354	20	30		EGEDHN
COc1cccc([C@@H](CNCc2ccc(C#N)cc2F)N(C)C)c1	ZINC000298094884	456362575	/nfs/dbraw/zinc/36/25/75/456362575.db2.gz	QOOQYLWSLJTYDD-LJQANCHMSA-N	0	3	327.403	3.098	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)NC[C@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000290623152	456386389	/nfs/dbraw/zinc/38/63/89/456386389.db2.gz	SGQFZVAMLLMVOW-VQIMIIECSA-N	0	3	348.487	3.174	20	30		EGEDHN
C[C@H](O)C[C@@H]1CCCCCN1Cc1nnc(-c2cccc(C#N)c2)o1	ZINC000352885302	456389694	/nfs/dbraw/zinc/38/96/94/456389694.db2.gz	DBEWLFLORHIIHA-YOEHRIQHSA-N	0	3	340.427	3.124	20	30		EGEDHN
C[C@H](C#N)CSc1ccccc1NC(=O)N1CCN(C)CC[C@@H]1C	ZINC000340385838	456431845	/nfs/dbraw/zinc/43/18/45/456431845.db2.gz	YUNUXLFWOZSYLM-CABCVRRESA-N	0	3	346.500	3.496	20	30		EGEDHN
COC(=O)[C@@H](C)Oc1ccc(CN[C@@H](C)c2ccc(C#N)cc2)cc1	ZINC000343156055	456439954	/nfs/dbraw/zinc/43/99/54/456439954.db2.gz	XBIFUTZLGZWIPX-LSDHHAIUSA-N	0	3	338.407	3.349	20	30		EGEDHN
C=CCOCCCN1CC[C@@H](Oc2ccc(C(F)(F)F)cn2)C1	ZINC000348049325	456445603	/nfs/dbraw/zinc/44/56/03/456445603.db2.gz	LJJDWDDLZDBXIN-CQSZACIVSA-N	0	3	330.350	3.146	20	30		EGEDHN
CC(C)(C)[C@@H]1NC(=O)CC[C@@H]1NCc1cccc(OCCCC#N)c1	ZINC000353116051	456500112	/nfs/dbraw/zinc/50/01/12/456500112.db2.gz	ZJLSNPHXUWNTHN-PKOBYXMFSA-N	0	3	343.471	3.152	20	30		EGEDHN
C[C@@H](NC(=O)C(C#N)Cc1ccc(C#N)cc1)c1cccc([N+](=O)[O-])c1	ZINC000348125446	456500691	/nfs/dbraw/zinc/50/06/91/456500691.db2.gz	WMDCGKOJPOCKHJ-CXAGYDPISA-N	0	3	348.362	3.026	20	30		EGEDHN
N#Cc1ccc(CC(=O)NCCN2CCC3(CCCCC3)CC2)cc1	ZINC000337719240	456503151	/nfs/dbraw/zinc/50/31/51/456503151.db2.gz	IWONBUDCKPCKMR-UHFFFAOYSA-N	0	3	339.483	3.263	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H](CNC(=O)c3ccccc3)C2)cc1	ZINC000353133508	456513184	/nfs/dbraw/zinc/51/31/84/456513184.db2.gz	FWAPZNSELAMJRO-IBGZPJMESA-N	0	3	333.435	3.200	20	30		EGEDHN
C=CC1CCN([C@@H](C)C(=O)NC(=O)Nc2ccc(C)cc2C)CC1	ZINC000348181631	456519919	/nfs/dbraw/zinc/51/99/19/456519919.db2.gz	KRXVCJPYAAQIOG-HNNXBMFYSA-N	0	3	329.444	3.238	20	30		EGEDHN
C[C@H](NCC(C)(C)CCC#N)c1ccc(S(C)(=O)=O)c(F)c1	ZINC000348215371	456541213	/nfs/dbraw/zinc/54/12/13/456541213.db2.gz	MNNIKAQDQAFDMN-LBPRGKRZSA-N	0	3	326.437	3.210	20	30		EGEDHN
CCCCN(CC(=O)N(CC)C[C@H](C)C#N)Cc1ccccc1O	ZINC000282557803	456552316	/nfs/dbraw/zinc/55/23/16/456552316.db2.gz	YAIOKLILHCSJTI-MRXNPFEDSA-N	0	3	331.460	3.002	20	30		EGEDHN
C=CCOc1ccc(CN[C@H]2CCOC[C@@H]2OCC)cc1Cl	ZINC000353197960	456553353	/nfs/dbraw/zinc/55/33/53/456553353.db2.gz	ZUVFTMCQRYNVPW-RDJZCZTQSA-N	0	3	325.836	3.188	20	30		EGEDHN
CC(C)(C#N)CC(=O)N[C@@H]1CCN(Cc2ccccc2)CC1(C)C	ZINC000282622701	456570816	/nfs/dbraw/zinc/57/08/16/456570816.db2.gz	CWXNOEIIYCMCRG-QGZVFWFLSA-N	0	3	327.472	3.343	20	30		EGEDHN
C=C[C@H](C)NCc1cc(Br)cc(Br)c1N	ZINC000308842130	456573356	/nfs/dbraw/zinc/57/33/56/456573356.db2.gz	NSPUUANIAGGMKB-ZETCQYMHSA-N	0	3	334.055	3.458	20	30		EGEDHN
CCN1CCO[C@H](CNCc2ccc(C#N)s2)[C@H]1c1ccccc1	ZINC000343393547	456587850	/nfs/dbraw/zinc/58/78/50/456587850.db2.gz	QKZHPJNWCDEWSH-RTBURBONSA-N	0	3	341.480	3.171	20	30		EGEDHN
C=C(C)CN(CC)C(=O)c1ccc(N2CCN(C(C)C)CC2)cc1	ZINC000299250473	456642270	/nfs/dbraw/zinc/64/22/70/456642270.db2.gz	DWWKAZZMUFIUCG-UHFFFAOYSA-N	0	3	329.488	3.255	20	30		EGEDHN
CN(CCC#N)c1ccc(CN2CC(C)(C)[C@@H]2[C@H]2CCCO2)cc1	ZINC000291460734	456650590	/nfs/dbraw/zinc/65/05/90/456650590.db2.gz	DCZZIFUDUCFBHX-MOPGFXCFSA-N	0	3	327.472	3.426	20	30		EGEDHN
CC1(C)CCC(CNCCS(=O)(=O)c2ccc(C#N)cc2)CC1	ZINC000324010767	456659037	/nfs/dbraw/zinc/65/90/37/456659037.db2.gz	NYYXGLQMKCLXLS-UHFFFAOYSA-N	0	3	334.485	3.138	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)Nc2ncc(-c3ccccc3)s2)nc(C)n1	ZINC000340748895	456665862	/nfs/dbraw/zinc/66/58/62/456665862.db2.gz	YYVCCAAHPAPOLR-AWEZNQCLSA-N	0	3	349.419	3.463	20	30		EGEDHN
CN(C)C[C@@H](NC(=O)c1ccc(CC#N)cc1)c1ccc(Cl)cc1	ZINC000282944636	456671945	/nfs/dbraw/zinc/67/19/45/456671945.db2.gz	MYFXCTBDAKQETC-GOSISDBHSA-N	0	3	341.842	3.439	20	30		EGEDHN
CO[C@@H]1CCCC[C@H]1N[C@H](C)C(=O)N(CCC#N)c1ccc(F)cc1	ZINC000277083339	456675576	/nfs/dbraw/zinc/67/55/76/456675576.db2.gz	YFEQNQPQIWLINT-ZTFGCOKTSA-N	0	3	347.434	3.008	20	30		EGEDHN
CO[C@]1(C)C[C@@H](N[C@H](C)C(=O)N(CCC#N)c2ccccc2)C1(C)C	ZINC000340849519	456717106	/nfs/dbraw/zinc/71/71/06/456717106.db2.gz	KVUFDUTWHZBQIM-WRWLIDTKSA-N	0	3	343.471	3.115	20	30		EGEDHN
CCN(CC)S(=O)(=O)c1ccc([C@@H](C)N[C@@H](C)CCC#N)cc1	ZINC000299550222	456725658	/nfs/dbraw/zinc/72/56/58/456725658.db2.gz	FZYZZVKHZVRNOE-LSDHHAIUSA-N	0	3	337.489	3.060	20	30		EGEDHN
N#CCCN(Cc1ccco1)C(=O)c1cccc(CN2CCCC2)c1	ZINC000299587391	456736086	/nfs/dbraw/zinc/73/60/86/456736086.db2.gz	ZOLZVPZIQTYFAF-UHFFFAOYSA-N	0	3	337.423	3.431	20	30		EGEDHN
CC(C)[C@@H](C)NC(=O)C1CCN(C(=O)C2CCN(C3CC3)CC2)CC1	ZINC000328718012	456743576	/nfs/dbraw/zinc/74/35/76/456743576.db2.gz	FOSZMSIZNIXUDL-OAHLLOKOSA-N	0	3	349.519	3.100	20	30		EGEDHN
Cc1ccc(Cc2ccccn2)cc1NC(=O)NC1CCN(C)CC1	ZINC000328715056	456744482	/nfs/dbraw/zinc/74/44/82/456744482.db2.gz	SRGVHCKVBFTCLZ-UHFFFAOYSA-N	0	3	338.455	3.401	20	30		EGEDHN
C=CC[C@H](CO)CNc1ccnc2cc(OCC)c(OCC)cc21	ZINC000340892903	456744873	/nfs/dbraw/zinc/74/48/73/456744873.db2.gz	WTSWKUYDNFUOGI-AWEZNQCLSA-N	0	3	330.428	3.051	20	30		EGEDHN
CC[C@H](N[C@H](C)C(=O)N[C@@](C)(C#N)C(C)C)c1ccc(OC)cc1	ZINC000340897814	456748349	/nfs/dbraw/zinc/74/83/49/456748349.db2.gz	KDNJLZPOBQGTDX-LJHODMEESA-N	0	3	331.460	3.179	20	30		EGEDHN
Cc1noc(C)c1C(C)(C)NCCC(=O)Nc1ccc(C#N)cc1	ZINC000353562754	456762403	/nfs/dbraw/zinc/76/24/03/456762403.db2.gz	BQZUEYTXUWCTSX-UHFFFAOYSA-N	0	3	326.400	3.017	20	30		EGEDHN
Cc1ccc(C(C)(C)NCCC(=O)Nc2sccc2C#N)cn1	ZINC000353582709	456780609	/nfs/dbraw/zinc/78/06/09/456780609.db2.gz	TXHCWOXRTCSCAS-UHFFFAOYSA-N	0	3	328.441	3.177	20	30		EGEDHN
C=CCN(CCc1ccco1)C(=O)NC[C@H]1CCCCN1C1CC1	ZINC000277358549	456793137	/nfs/dbraw/zinc/79/31/37/456793137.db2.gz	AHBSXMSCOBECIJ-QGZVFWFLSA-N	0	3	331.460	3.037	20	30		EGEDHN
COc1ccc([C@@H](C)N[C@@H](C)C(=O)NC2(C#N)CCCCC2)cc1	ZINC000341231295	456824052	/nfs/dbraw/zinc/82/40/52/456824052.db2.gz	VMALJYQMKOWNJP-CABCVRRESA-N	0	3	329.444	3.077	20	30		EGEDHN
C=CC[C@H](CO)CNCc1c(C)nn(-c2ccc(F)cc2F)c1C	ZINC000341261838	456827306	/nfs/dbraw/zinc/82/73/06/456827306.db2.gz	DRCIGZLSKSKQST-AWEZNQCLSA-N	0	3	335.398	3.042	20	30		EGEDHN
C=CC[C@@H](CO)CNCc1ccc(Br)cc1SC	ZINC000341305423	456837575	/nfs/dbraw/zinc/83/75/75/456837575.db2.gz	VFTDNTFNGINYQH-LLVKDONJSA-N	0	3	330.291	3.445	20	30		EGEDHN
Cc1nc([C@H]2CCCOC2)sc1C(=O)NC1(CN(C)C)CCC1	ZINC000329163151	456846302	/nfs/dbraw/zinc/84/63/02/456846302.db2.gz	GGHCMVUYUZTTMU-ZDUSSCGKSA-N	0	3	337.489	3.134	20	30		EGEDHN
CC(C)Cn1ncc(NC(=O)N2CC[C@H]3CC[C@@H](C2)N3C)c1C1CC1	ZINC000329261412	456863170	/nfs/dbraw/zinc/86/31/70/456863170.db2.gz	DALZXERZUVQHPM-CVEARBPZSA-N	0	3	345.491	3.131	20	30		EGEDHN
C=CC[C@H](CC)NC(=O)N(C)C[C@H]1CCN(C)[C@@H]1c1cccnc1	ZINC000341485866	456868460	/nfs/dbraw/zinc/86/84/60/456868460.db2.gz	WGRKQENWPFQIGF-FGTMMUONSA-N	0	3	330.476	3.071	20	30		EGEDHN
C=CCOc1ccc(CNC(=O)NC[C@H](C)N2CCC[C@@H](C)C2)cc1	ZINC000344909213	456870724	/nfs/dbraw/zinc/87/07/24/456870724.db2.gz	ZTZYOHYKTBVXLU-SJORKVTESA-N	0	3	345.487	3.171	20	30		EGEDHN
C[C@@H]1C[C@@H](C(=O)NCC2(N3CCSCC3)CCCC2)CC(=O)N1	ZINC000329339720	456875366	/nfs/dbraw/zinc/87/53/66/456875366.db2.gz	NULPRYIDTIUVAU-ZIAGYGMSSA-N	0	3	339.505	3.060	20	30		EGEDHN
N#Cc1c2c(sc1NC(=O)CCN1CCOCC3(CC3)C1)CCC2	ZINC000329451258	456892249	/nfs/dbraw/zinc/89/22/49/456892249.db2.gz	LZCOBPDYZVQFJX-UHFFFAOYSA-N	0	3	345.468	3.199	20	30		EGEDHN
Cc1nnc([C@@H]2CCCN([C@H](C)C(=O)NCc3ccccc3C)C2)[nH]1	ZINC000329453233	456892993	/nfs/dbraw/zinc/89/29/93/456892993.db2.gz	NQHQKBRMTKWODK-RHSMWYFYSA-N	0	3	341.459	3.146	20	30		EGEDHN
CC(C)[C@H](C(=O)NCC(=O)N(C)C1CCCCC1)N1CCCCC1	ZINC000329775617	456939414	/nfs/dbraw/zinc/93/94/14/456939414.db2.gz	NEHKCWMMXRRXDM-GOSISDBHSA-N	0	3	337.508	3.245	20	30		EGEDHN
CN1CCC2(CCCN2C(=O)NCc2cccc3cc[nH]c32)CC1	ZINC000329805080	456943443	/nfs/dbraw/zinc/94/34/43/456943443.db2.gz	MQRPKNIKMITIPR-UHFFFAOYSA-N	0	3	326.444	3.142	20	30		EGEDHN
C[C@@H]1CC[C@H](N(CCO)CC(=O)NC23CC4CC(CC(C4)C2)C3)C1	ZINC000329848715	456950394	/nfs/dbraw/zinc/95/03/94/456950394.db2.gz	PSKNNAUZCZALOV-MOAASNJQSA-N	0	3	334.504	3.395	20	30		EGEDHN
[O-]C(NC[C@@H]1CCc2nccn2C1)=[NH+][C@@H]1CC[C@@H]2CCCC[C@@H]2C1	ZINC000329902211	456958413	/nfs/dbraw/zinc/95/84/13/456958413.db2.gz	PFNBAJJPFQHQPB-MWDXBVQZSA-N	0	3	330.476	3.308	20	30		EGEDHN
C[C@H]1CCCN(C(C)(C)CNC(=O)c2coc(C3CCOCC3)n2)C1	ZINC000329920030	456961900	/nfs/dbraw/zinc/96/19/00/456961900.db2.gz	DQVTUFMMNSAOLG-AWEZNQCLSA-N	0	3	349.475	3.384	20	30		EGEDHN
C[C@H](NC(=O)N[C@@H]1CCN(C2CC2)C1)c1cc2cccc(F)c2o1	ZINC000329940799	456964343	/nfs/dbraw/zinc/96/43/43/456964343.db2.gz	URGBDRSOXGXDOO-WCQYABFASA-N	0	3	331.391	3.373	20	30		EGEDHN
CC(C)C[C@H]1OCCC[C@H]1NCC(=O)Nc1nc2c(s1)CCC2	ZINC000330136803	456990447	/nfs/dbraw/zinc/99/04/47/456990447.db2.gz	HQUKQWGXLGEZCR-TZMCWYRMSA-N	0	3	337.489	3.403	20	30		EGEDHN
C[C@H]1CCN(C)CCN1C(=O)c1cn(CCCC#N)c2ccccc12	ZINC000345939557	457007749	/nfs/dbraw/zinc/00/77/49/457007749.db2.gz	GOQWELBQDZYCFL-INIZCTEOSA-N	0	3	338.455	3.111	20	30		EGEDHN
C=CCC[C@@H](NCC(=O)NC(=O)NC1CCCCC1)c1ccccc1	ZINC000341932957	457010036	/nfs/dbraw/zinc/01/00/36/457010036.db2.gz	UNTAOXOVDJPDTB-GOSISDBHSA-N	0	3	343.471	3.442	20	30		EGEDHN
CN(C(=O)c1cn(CCCC#N)c2ccccc12)[C@@H]1CCCN(C)C1	ZINC000346057693	457015983	/nfs/dbraw/zinc/01/59/83/457015983.db2.gz	HEAMMZMKYRQBPU-MRXNPFEDSA-N	0	3	338.455	3.111	20	30		EGEDHN
C[C@H]1C[C@@H]1N1CCN(C(=O)c2ccc(C(C)(C)C#N)cc2)C[C@@H](C)C1	ZINC000346163859	457020921	/nfs/dbraw/zinc/02/09/21/457020921.db2.gz	DCVQUGUBFPKPKZ-BXWFABGCSA-N	0	3	339.483	3.290	20	30		EGEDHN
N#CC(CCc1ccccc1)C(=O)N1CC2(CCC2)[C@@H]1[C@H]1CCCO1	ZINC000330293483	457022865	/nfs/dbraw/zinc/02/28/65/457022865.db2.gz	DSKKZWNOEAKBLB-OTWHNJEPSA-N	0	3	338.451	3.319	20	30		EGEDHN
C[C@@H]1[C@@H](NC(=O)Nc2cccc(C#N)c2)CCN1Cc1ccccc1	ZINC000359006091	457045485	/nfs/dbraw/zinc/04/54/85/457045485.db2.gz	HEGGYKKXNJMLRI-BEFAXECRSA-N	0	3	334.423	3.343	20	30		EGEDHN
N#C[C@H]1CC[C@H](NCc2cnn(-c3ccc(Br)cc3)c2)C1	ZINC000349801546	457057676	/nfs/dbraw/zinc/05/76/76/457057676.db2.gz	LXZQWXJVGKIURT-WFASDCNBSA-N	0	3	345.244	3.417	20	30		EGEDHN
COc1cc(CN[C@H]2CC[C@@H](C#N)C2)ccc1OCC(F)(F)F	ZINC000349803192	457058827	/nfs/dbraw/zinc/05/88/27/457058827.db2.gz	QBYIKVLCOZUWCJ-YPMHNXCESA-N	0	3	328.334	3.418	20	30		EGEDHN
CCN(CCN1CCCCCC1)C(=O)Nc1ccc(F)cc1C#N	ZINC000349902216	457101023	/nfs/dbraw/zinc/10/10/23/457101023.db2.gz	HLMUDSRTMDZEJA-UHFFFAOYSA-N	0	3	332.423	3.427	20	30		EGEDHN
CCCN(CCN1CCCCC1)C(=O)Nc1ccc(F)cc1C#N	ZINC000349920376	457109571	/nfs/dbraw/zinc/10/95/71/457109571.db2.gz	YJOHWLDBAJDNSF-UHFFFAOYSA-N	0	3	332.423	3.427	20	30		EGEDHN
C=CCN(C(=O)CC1CCN(C)CC1)c1nc2c(s1)CCCC2	ZINC000362858160	457128551	/nfs/dbraw/zinc/12/85/51/457128551.db2.gz	ZRMSJOGQHUWGPR-UHFFFAOYSA-N	0	3	333.501	3.273	20	30		EGEDHN
CC[C@H](C)n1ncc(NC(=O)N(C)[C@@H](C)C2CCN(C)CC2)c1C	ZINC000331166151	457140803	/nfs/dbraw/zinc/14/08/03/457140803.db2.gz	YFAISHPFRSFJOG-KBPBESRZSA-N	0	3	335.496	3.370	20	30		EGEDHN
CN(C)[C@]1(CNC(=O)Nc2ncc(C(C)(C)C)s2)CCSC1	ZINC000331288121	457160233	/nfs/dbraw/zinc/16/02/33/457160233.db2.gz	NJNLYSCHHMFPKE-HNNXBMFYSA-N	0	3	342.534	3.204	20	30		EGEDHN
Cc1cc(CN2CCC(C(=O)N3CCC(C)CC3)CC2)ccc1C#N	ZINC000362936821	457164192	/nfs/dbraw/zinc/16/41/92/457164192.db2.gz	YONKPQGFMMNYQF-UHFFFAOYSA-N	0	3	339.483	3.337	20	30		EGEDHN
CC[C@](C)(C#N)C(=O)Nc1cccc(N2CCN(C(C)C)CC2)c1	ZINC000354396367	457198291	/nfs/dbraw/zinc/19/82/91/457198291.db2.gz	USCOESSBAKIYDP-LJQANCHMSA-N	0	3	328.460	3.095	20	30		EGEDHN
N#CC(C(=O)c1ccnc(SCC(F)(F)F)c1)c1ccncn1	ZINC000354467387	457241588	/nfs/dbraw/zinc/24/15/88/457241588.db2.gz	LJBWXBAUAFFWBU-SNVBAGLBSA-N	0	3	338.314	3.016	20	30		EGEDHN
Cc1ccc(OCc2cccc(C(=O)C(C#N)c3ccncn3)c2)cn1	ZINC000354481162	457250207	/nfs/dbraw/zinc/25/02/07/457250207.db2.gz	XWPNZCYCPHKEAR-SFHVURJKSA-N	0	3	344.374	3.249	20	30		EGEDHN
N#CCSCCCN1CC=C(c2ccc3c(c2)OCCO3)CC1	ZINC000357038374	457290776	/nfs/dbraw/zinc/29/07/76/457290776.db2.gz	MYMMNVXEVVODBB-UHFFFAOYSA-N	0	3	330.453	3.194	20	30		EGEDHN
N#Cc1ccnc(NC[C@H]2CCCN2Cc2ccccc2)c1Cl	ZINC000342419092	457293792	/nfs/dbraw/zinc/29/37/92/457293792.db2.gz	UOPACGGIHXIKAX-MRXNPFEDSA-N	0	3	326.831	3.105	20	30		EGEDHN
C=CCN(c1ccccc1)S(=O)(=O)c1ccc(CN(C)C)cc1	ZINC000351588656	457304619	/nfs/dbraw/zinc/30/46/19/457304619.db2.gz	WUVACALFHUJPOW-UHFFFAOYSA-N	0	3	330.453	3.130	20	30		EGEDHN
CCC[C@@H](NC(C)C)C(=O)Nc1nc(C)c(SCC#N)s1	ZINC000351671217	457310436	/nfs/dbraw/zinc/31/04/36/457310436.db2.gz	BZRNACDLPBQYCF-LLVKDONJSA-N	0	3	326.491	3.172	20	30		EGEDHN
CC(C#N)S(=O)(=O)c1ccc(NC(=O)N[C@H]2CCC(C)(C)C2)cc1	ZINC000351696583	457314657	/nfs/dbraw/zinc/31/46/57/457314657.db2.gz	WYTINNQUJWLRLJ-OCCSQVGLSA-N	0	3	349.456	3.073	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNc1cc(N)c([N+](=O)[O-])c(C#N)c1)C(C)C	ZINC000339970753	457317527	/nfs/dbraw/zinc/31/75/27/457317527.db2.gz	QAVHWCBKZBQALX-QGZVFWFLSA-N	0	3	343.431	3.159	20	30		EGEDHN
COCCN(C)Cc1ccc(OCc2cccc(C#N)c2)c(OC)c1	ZINC000342491594	457332984	/nfs/dbraw/zinc/33/29/84/457332984.db2.gz	CXFRZUVOSPDEGU-UHFFFAOYSA-N	0	3	340.423	3.224	20	30		EGEDHN
CCOc1ccc(C#N)cc1NC(=O)N[C@H](C)CN1CCC[C@@H](C)C1	ZINC000352442239	457370731	/nfs/dbraw/zinc/37/07/31/457370731.db2.gz	MRDUXIJNOBXOCD-HUUCEWRRSA-N	0	3	344.459	3.199	20	30		EGEDHN
N#CCCCOc1cccc(CN(CCO)[C@@H]2CCCSC2)c1	ZINC000355563486	457388942	/nfs/dbraw/zinc/38/89/42/457388942.db2.gz	JHXPOLTVALFROT-QGZVFWFLSA-N	0	3	334.485	3.059	20	30		EGEDHN
CC1CC(C#N)(C(=O)N[C@@H]2CCN(Cc3ccccc3)[C@H](C)C2)C1	ZINC000379718141	457418266	/nfs/dbraw/zinc/41/82/66/457418266.db2.gz	QEIUEERHSQSWPA-URTYCYGZSA-N	0	3	325.456	3.096	20	30		EGEDHN
Cc1ccc(NC(=O)[C@H]2CCCN(Cc3ccc(CC#N)cc3)C2)nc1	ZINC000342719275	457477575	/nfs/dbraw/zinc/47/75/75/457477575.db2.gz	FLFHYBSAGJKURZ-IBGZPJMESA-N	0	3	348.450	3.307	20	30		EGEDHN
COCCOCc1ccc(CN[C@@H]2CCc3ccc(C#N)cc32)cc1	ZINC000361005846	457505954	/nfs/dbraw/zinc/50/59/54/457505954.db2.gz	XQHPENJLOBZKNL-OAQYLSRUSA-N	0	3	336.435	3.498	20	30		EGEDHN
COCC1(C#N)CCN(C[C@H](C)Cc2ccc(OC)c(F)c2)CC1	ZINC000342841879	457550967	/nfs/dbraw/zinc/55/09/67/457550967.db2.gz	UOIBKBGYJZJYCX-OAHLLOKOSA-N	0	3	334.435	3.265	20	30		EGEDHN
C=CCN(CCC(=O)NC(=O)Nc1ccccc1)CCc1ccco1	ZINC000352719194	457556160	/nfs/dbraw/zinc/55/61/60/457556160.db2.gz	FIQDTKMDKCGOFQ-UHFFFAOYSA-N	0	3	341.411	3.049	20	30		EGEDHN
CC(=O)N[C@H](C)C1CCN(Cc2cccc(OCCCC#N)c2)CC1	ZINC000361150271	457614200	/nfs/dbraw/zinc/61/42/00/457614200.db2.gz	AGLMILNXIMKSDM-MRXNPFEDSA-N	0	3	343.471	3.106	20	30		EGEDHN
C=CCOc1ccc(CN[C@@H]2C[C@@H](OCC)[C@@H]2OC)cc1Cl	ZINC000361150473	457615132	/nfs/dbraw/zinc/61/51/32/457615132.db2.gz	ANKQSGUMMAQBAF-DJIMGWMZSA-N	0	3	325.836	3.187	20	30		EGEDHN
C=C(C)[C@@H](NC(=O)N1CCC[C@H]2CN(C)C[C@H]21)c1ccc(F)c(F)c1	ZINC000425733626	457638235	/nfs/dbraw/zinc/63/82/35/457638235.db2.gz	ARRDONANYFTPCK-BMGDILEWSA-N	0	3	349.425	3.318	20	30		EGEDHN
C=CCOc1ccc(CNCc2cn(C)nc2-c2ccncc2)cc1	ZINC000370576267	457675945	/nfs/dbraw/zinc/67/59/45/457675945.db2.gz	QWZYOVXPVORRJE-UHFFFAOYSA-N	0	3	334.423	3.337	20	30		EGEDHN
Cc1nccnc1[C@@H](C)N[C@@H]1CCCN(c2ccc(C#N)cc2F)C1	ZINC000364735182	457682916	/nfs/dbraw/zinc/68/29/16/457682916.db2.gz	CZGCRGLRUSHCGD-GDBMZVCRSA-N	0	3	339.418	3.115	20	30		EGEDHN
Cn1nc2ccccc2c1C(=O)C(C#N)c1ccc(C(F)(F)F)cn1	ZINC000357777171	457686174	/nfs/dbraw/zinc/68/61/74/457686174.db2.gz	DEIALQOPVIQIFE-LBPRGKRZSA-N	0	3	344.296	3.477	20	30		EGEDHN
Cc1nn(C)cc1[C@@H](C)N[C@@H]1CCCN(c2ccc(C#N)cc2F)C1	ZINC000361346105	457700993	/nfs/dbraw/zinc/70/09/93/457700993.db2.gz	MMBIHIZJNSESDN-CZUORRHYSA-N	0	3	341.434	3.059	20	30		EGEDHN
Cc1ccccc1[C@@H]([C@H](C)NC(=O)Cc1ccc(C#N)cc1)N(C)C	ZINC000357879185	457721791	/nfs/dbraw/zinc/72/17/91/457721791.db2.gz	VJJSDRXKALGWSM-HRAATJIYSA-N	0	3	335.451	3.217	20	30		EGEDHN
CO[C@]1(C)CCCN([C@@H](C)C(=O)N(C)C2(C#N)CCC(C)CC2)CC1	ZINC000361414418	457724391	/nfs/dbraw/zinc/72/43/91/457724391.db2.gz	VNTJBCGMYONGIB-OWODTTCDSA-N	0	3	349.519	3.197	20	30		EGEDHN
C[C@H](NCCCC#N)c1ccc(Br)cc1OCCCO	ZINC000361518772	457767145	/nfs/dbraw/zinc/76/71/45/457767145.db2.gz	KEDOMMVGWHPSMM-LBPRGKRZSA-N	0	3	341.249	3.165	20	30		EGEDHN
CC(C)CN(C(=O)C1CCN(C2CC2)CC1)c1ccc(C#N)cc1	ZINC000426114566	457775291	/nfs/dbraw/zinc/77/52/91/457775291.db2.gz	MVLVHPTWULDANW-UHFFFAOYSA-N	0	3	325.456	3.422	20	30		EGEDHN
CN1CCC(CC(=O)N2CCC[C@@H]2[C@@H](C#N)c2ccccc2)CC1	ZINC000365959601	457785304	/nfs/dbraw/zinc/78/53/04/457785304.db2.gz	AYWQWMMZPQLZSU-RBUKOAKNSA-N	0	3	325.456	3.017	20	30		EGEDHN
C[C@@H]1Cc2ccccc2N1CCNC(=O)C(C#N)CCc1ccccc1	ZINC000433307183	457805110	/nfs/dbraw/zinc/80/51/10/457805110.db2.gz	UDEQCNJMOFZXKI-XLIONFOSSA-N	0	3	347.462	3.326	20	30		EGEDHN
C=CCc1ccccc1OC[C@@H](O)CN1CCC(C(F)F)CC1	ZINC000361689102	457821058	/nfs/dbraw/zinc/82/10/58/457821058.db2.gz	GFSKRLBNJKEZIH-INIZCTEOSA-N	0	3	325.399	3.132	20	30		EGEDHN
CCC1(CC)[C@H](NC(=O)C(C#N)CCc2ccccc2)C[C@@H]1OC	ZINC000433381720	457827155	/nfs/dbraw/zinc/82/71/55/457827155.db2.gz	LHUFUNTZEOELNB-KURKYZTESA-N	0	3	328.456	3.469	20	30		EGEDHN
COc1cccc2c1C[C@@H](NC(=O)C(C#N)CCc1ccccc1)C2	ZINC000458071939	457922227	/nfs/dbraw/zinc/92/22/27/457922227.db2.gz	CJJQDMJSYGPEBG-MSOLQXFVSA-N	0	3	334.419	3.051	20	30		EGEDHN
CC1(C)CCCN(C(=O)[C@@H]2CCCN(Cc3ccccc3)C2)[C@@H]1C#N	ZINC000434032358	457934658	/nfs/dbraw/zinc/93/46/58/457934658.db2.gz	REKGMKQLZWJYLV-RTBURBONSA-N	0	3	339.483	3.439	20	30		EGEDHN
CC(C)N(Cc1ccc(CC#N)cc1)C[C@H](O)COc1ccccc1	ZINC000444797459	457980510	/nfs/dbraw/zinc/98/05/10/457980510.db2.gz	DKPFDKBKVFBYMW-FQEVSTJZSA-N	0	3	338.451	3.403	20	30		EGEDHN
C=C(C)[C@@H](CC(=O)Nc1ccc(OCCN(C)C)c(F)c1)OCC	ZINC000458282356	457999910	/nfs/dbraw/zinc/99/99/10/457999910.db2.gz	IIELNPSUHIWWGD-QGZVFWFLSA-N	0	3	338.423	3.076	20	30		EGEDHN
N#CC(C(=O)c1ccnn1CC(F)F)c1ccc(C(F)(F)F)cn1	ZINC000434617434	458023072	/nfs/dbraw/zinc/02/30/72/458023072.db2.gz	TYVNKCXEQNBASS-VIFPVBQESA-N	0	3	344.243	3.052	20	30		EGEDHN
Cn1c2ccccc2nc1C(C#N)C(=O)c1c[nH]nc1-c1ccoc1	ZINC000434620559	458024683	/nfs/dbraw/zinc/02/46/83/458024683.db2.gz	YKGFYTDEHSGTNT-GFCCVEGCSA-N	0	3	331.335	3.046	20	30		EGEDHN
CC1(C)CCCN(CCNC(=O)N[C@@H](CCC#N)c2ccccc2)C1	ZINC000445218209	458028076	/nfs/dbraw/zinc/02/80/76/458028076.db2.gz	ICBNTDUPLCHMOH-SFHVURJKSA-N	0	3	342.487	3.453	20	30		EGEDHN
C=CC[C@H](C(=O)N1C[C@H](SC)[C@@H](N2CCCC2)C1)c1ccccc1	ZINC000427925738	458053018	/nfs/dbraw/zinc/05/30/18/458053018.db2.gz	VANWBBCBFHAIQA-FHWLQOOXSA-N	0	3	344.524	3.385	20	30		EGEDHN
C[C@@H]1C[C@H](N2CCCC2)CN1C(=O)c1cccc(SCC#N)c1	ZINC000375822494	458082543	/nfs/dbraw/zinc/08/25/43/458082543.db2.gz	FHFAQRWNWYJDIW-ZBFHGGJFSA-N	0	3	329.469	3.001	20	30		EGEDHN
CCN(CCC#N)C(=O)CN[C@](C)(Cc1ccccc1)c1ccccc1	ZINC000412089090	458086710	/nfs/dbraw/zinc/08/67/10/458086710.db2.gz	DPOYIMRCFWLNNJ-JOCHJYFZSA-N	0	3	349.478	3.496	20	30		EGEDHN
CC(C)[C@@H](CN(C)Cc1ccccc1)NC(=O)NCC(C)(C)CC#N	ZINC000458658147	458125806	/nfs/dbraw/zinc/12/58/06/458125806.db2.gz	VBDMXODAPHOWNK-GOSISDBHSA-N	0	3	344.503	3.382	20	30		EGEDHN
CN(CC(C)(C)C#N)C(=O)NC[C@H](C1CC1)N(C)Cc1ccccc1	ZINC000458682226	458133221	/nfs/dbraw/zinc/13/32/21/458133221.db2.gz	RUSLRDFZXNBBBM-GOSISDBHSA-N	0	3	342.487	3.088	20	30		EGEDHN
CN(Cc1ccccc1)[C@H](CNC(=O)NCC(C)(C)CC#N)C1CC1	ZINC000458683527	458134696	/nfs/dbraw/zinc/13/46/96/458134696.db2.gz	TVIYEHLEVZVJBQ-GOSISDBHSA-N	0	3	342.487	3.136	20	30		EGEDHN
CN(C)C[C@H](NC(=O)NCC(C)(C)CCC#N)c1ccc(F)cc1	ZINC000358680542	458148116	/nfs/dbraw/zinc/14/81/16/458148116.db2.gz	HJLHNCMJVSNLHP-INIZCTEOSA-N	0	3	334.439	3.058	20	30		EGEDHN
CN(C)C[C@@H](NC(=O)NCC(C)(C)CCC#N)c1ccc(F)cc1	ZINC000358680544	458148686	/nfs/dbraw/zinc/14/86/86/458148686.db2.gz	HJLHNCMJVSNLHP-MRXNPFEDSA-N	0	3	334.439	3.058	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@H]1CN[C@@H](C(=O)N1CCCCC1)c1ccccc1	ZINC000435674736	458182217	/nfs/dbraw/zinc/18/22/17/458182217.db2.gz	RRUNQDBPWJUOGH-ZCNNSNEGSA-N	0	3	342.483	3.311	20	30		EGEDHN
CCCCOC1CCN(CCC(=O)Nc2ccc(C#N)cc2)CC1	ZINC000362447894	458184509	/nfs/dbraw/zinc/18/45/09/458184509.db2.gz	LXVQZZCCZFHXBA-UHFFFAOYSA-N	0	3	329.444	3.168	20	30		EGEDHN
CSc1ccc([C@@H](CNC(=O)N(C)CC(C)(C)C#N)N(C)C)cc1	ZINC000458886262	458205315	/nfs/dbraw/zinc/20/53/15/458205315.db2.gz	HNCXCKJWRWSFOO-MRXNPFEDSA-N	0	3	348.516	3.202	20	30		EGEDHN
N#Cc1ccc(O[C@H]2CCN(CCSc3ccccc3)C2)nc1	ZINC000428774138	458208961	/nfs/dbraw/zinc/20/89/61/458208961.db2.gz	UENXUAZUZAWIFQ-INIZCTEOSA-N	0	3	325.437	3.199	20	30		EGEDHN
C#CCCN1CCC(NC(=O)c2cccc(-c3ccccn3)c2C)CC1	ZINC000372199141	458227729	/nfs/dbraw/zinc/22/77/29/458227729.db2.gz	KZYSFUJDIYWDSP-UHFFFAOYSA-N	0	3	347.462	3.275	20	30		EGEDHN
CC(C#N)C(=O)N1CCC[C@@H]1c1ccc(Br)c(F)c1	ZINC000435971459	458231570	/nfs/dbraw/zinc/23/15/70/458231570.db2.gz	YPYIRQNGUBFZLI-NOZJJQNGSA-N	0	3	325.181	3.411	20	30		EGEDHN
CC[C@@H](CNC(=O)C(C#N)Cc1ccc(C#N)cc1)CC(F)(F)F	ZINC000412656287	458261888	/nfs/dbraw/zinc/26/18/88/458261888.db2.gz	MMPDZLSQRQZZLU-IUODEOHRSA-N	0	3	337.345	3.335	20	30		EGEDHN
C=CC[C@H](Cc1ccccc1)NC(=O)N1CC[C@@H](N2CCCCC2)C1	ZINC000413822514	458307519	/nfs/dbraw/zinc/30/75/19/458307519.db2.gz	LACZSZJVMJDQSA-WOJBJXKFSA-N	0	3	341.499	3.444	20	30		EGEDHN
C=CCCC1(C(=O)Nc2ccc(OCCN(C)C)cc2OC)CC1	ZINC000413944251	458312778	/nfs/dbraw/zinc/31/27/78/458312778.db2.gz	ZFEOUPAQAYLESD-UHFFFAOYSA-N	0	3	332.444	3.321	20	30		EGEDHN
C=CC[C@H](CC)NC(=O)c1cnn(CCN(C)C)c1-c1ccccc1	ZINC000415630574	458332818	/nfs/dbraw/zinc/33/28/18/458332818.db2.gz	WNOSULPGLMXCOS-KRWDZBQOSA-N	0	3	340.471	3.196	20	30		EGEDHN
C=CC[C@H](CC)NC(=O)Nc1ccc(OCCN(C)C)c(OC)c1	ZINC000417682407	458366594	/nfs/dbraw/zinc/36/65/94/458366594.db2.gz	LGYVVFGWEPOTCD-AWEZNQCLSA-N	0	3	335.448	3.112	20	30		EGEDHN
N#C[C@H](c1ccccc1)[C@@H]1CCCN1C(=O)NC[C@@H](N)c1ccccc1	ZINC000418429476	458374947	/nfs/dbraw/zinc/37/49/47/458374947.db2.gz	NPOSMPBQWXXTTO-AQNXPRMDSA-N	0	3	348.450	3.168	20	30		EGEDHN
C=CCN(Cc1ccccc1)C(=O)NC[C@H]1NCCc2ccccc21	ZINC000418639780	458375816	/nfs/dbraw/zinc/37/58/16/458375816.db2.gz	QAVZRYVOQNOKDP-HXUWFJFHSA-N	0	3	335.451	3.271	20	30		EGEDHN
C[C@H](c1ccccc1)N1CCC(NC(=O)NCC2(C#N)CCC2)CC1	ZINC000419443009	458382546	/nfs/dbraw/zinc/38/25/46/458382546.db2.gz	ASQWNXBFQZRBEJ-MRXNPFEDSA-N	0	3	340.471	3.205	20	30		EGEDHN
CC(C)CN(CCN(C)C)C(=O)N[C@H]1CCCc2cc(C#N)ccc21	ZINC000419612811	458387212	/nfs/dbraw/zinc/38/72/12/458387212.db2.gz	JRTHRQOOQNCTOH-IBGZPJMESA-N	0	3	342.487	3.165	20	30		EGEDHN
C=CCC[C@@H]([NH2+]C1CCN(C(=O)c2ccccc2[O-])CC1)C1CC1	ZINC000436830671	458389678	/nfs/dbraw/zinc/38/96/78/458389678.db2.gz	RERZTWIFELRIAS-GOSISDBHSA-N	0	3	328.456	3.331	20	30		EGEDHN
C=C(C)[C@H](NC(=O)N(C)C[C@H]1CCCN1C)c1ccc(F)c(F)c1	ZINC000420826384	458402786	/nfs/dbraw/zinc/40/27/86/458402786.db2.gz	AHRPCBGGZNNECF-PBHICJAKSA-N	0	3	337.414	3.318	20	30		EGEDHN
CCOC(=O)[C@@](C)(CNCc1ccc(C#N)c(F)c1)c1ccccc1	ZINC000421395915	458412445	/nfs/dbraw/zinc/41/24/45/458412445.db2.gz	QMDNTLXZGRYISO-FQEVSTJZSA-N	0	3	340.398	3.308	20	30		EGEDHN
COc1ccc(CN2CC[C@H](O)CC23CCC3)cc1OCCCC#N	ZINC000421377800	458412573	/nfs/dbraw/zinc/41/25/73/458412573.db2.gz	UJMMHJPZIKGSNH-KRWDZBQOSA-N	0	3	344.455	3.257	20	30		EGEDHN
CO[C@H]1CCN(Cc2cn(CCC#N)nc2-c2ccccc2)C[C@@H]1C	ZINC000449502102	458425063	/nfs/dbraw/zinc/42/50/63/458425063.db2.gz	ONUPPWSRAMDMKA-LPHOPBHVSA-N	0	3	338.455	3.321	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1NCc1ccc(I)cc1	ZINC000449548262	458425967	/nfs/dbraw/zinc/42/59/67/458425967.db2.gz	LZVACTWTIVULKA-KGLIPLIRSA-N	0	3	343.208	3.114	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H]1CCN(C(=O)NCC(C)(C)CCC#N)C1	ZINC000376990264	458435139	/nfs/dbraw/zinc/43/51/39/458435139.db2.gz	CDKSRPVCJIYBJX-GOSISDBHSA-N	0	3	342.487	3.232	20	30		EGEDHN
Cc1[nH]c(C#N)cc1C(=O)N[C@H](CN(C)Cc1ccccc1)C(C)C	ZINC000450677375	458454656	/nfs/dbraw/zinc/45/46/56/458454656.db2.gz	FZHYLHJKSYYYTH-LJQANCHMSA-N	0	3	338.455	3.081	20	30		EGEDHN
C[C@@H]1CN(Cc2ccccc2)CCN(c2nc3ccccn3c2C#N)C1	ZINC000450811625	458457658	/nfs/dbraw/zinc/45/76/58/458457658.db2.gz	OEXVLNAXGYMGKE-QGZVFWFLSA-N	0	3	345.450	3.164	20	30		EGEDHN
C=CCN1CCC(NC(=O)NC[C@H]2CCC[C@@H](C(F)(F)F)C2)CC1	ZINC000437495858	458457735	/nfs/dbraw/zinc/45/77/35/458457735.db2.gz	XTCHPMQVNOFBCR-UONOGXRCSA-N	0	3	347.425	3.305	20	30		EGEDHN
C[C@H]1CN(Cc2ccc(C#N)cc2Br)CCN(C2CC2)C1	ZINC000451093662	458464973	/nfs/dbraw/zinc/46/49/73/458464973.db2.gz	OENBZSKCQDOKFP-ZDUSSCGKSA-N	0	3	348.288	3.237	20	30		EGEDHN
CN(CCC#N)C(=O)CCN[C@H](c1ccc(F)c(Cl)c1)C1CC1	ZINC000451349199	458473874	/nfs/dbraw/zinc/47/38/74/458473874.db2.gz	ANTOKLZNYXCVRI-KRWDZBQOSA-N	0	3	337.826	3.282	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NC[C@H]2CSc3ccccc32)cc1	ZINC000452214728	458497031	/nfs/dbraw/zinc/49/70/31/458497031.db2.gz	OGIHSXCGEBCCJT-IRXDYDNUSA-N	0	3	347.443	3.246	20	30		EGEDHN
Cc1cccc(N(CCC#N)C(=O)CN2CCC[C@H]2C2CC2)c1C	ZINC000377534736	458503242	/nfs/dbraw/zinc/50/32/42/458503242.db2.gz	XBBFCLMNPDRDSI-IBGZPJMESA-N	0	3	325.456	3.425	20	30		EGEDHN
C=CCOc1cc(OC)ccc1C(=O)NC[C@@H]1N(C)CCCC1(C)C	ZINC000468487787	458522288	/nfs/dbraw/zinc/52/22/88/458522288.db2.gz	MTJSBHYFOZHPRN-SFHVURJKSA-N	0	3	346.471	3.110	20	30		EGEDHN
C=C(CC)CN[C@@H](CC)c1ccc(Cl)c(S(=O)(=O)NC)c1	ZINC000453368499	458524821	/nfs/dbraw/zinc/52/48/21/458524821.db2.gz	QOBWBLXNIHOMAQ-AWEZNQCLSA-N	0	3	330.881	3.255	20	30		EGEDHN
Cc1ccc(Cc2cnc(NC(=O)[C@H](N)CCCC#N)s2)cc1F	ZINC000424102831	458558713	/nfs/dbraw/zinc/55/87/13/458558713.db2.gz	RGXAIRPZWPHVFY-OAHLLOKOSA-N	0	3	346.431	3.141	20	30		EGEDHN
COc1ccc(C2(CNC(=O)[C@@H](N)CCCC#N)CCCCC2)cc1	ZINC000424104404	458558921	/nfs/dbraw/zinc/55/89/21/458558921.db2.gz	OLWGNVRPZQLVDJ-SFHVURJKSA-N	0	3	343.471	3.034	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N[C@@H]1CCOc2c(-c3ccccc3)cccc21	ZINC000424116180	458562244	/nfs/dbraw/zinc/56/22/44/458562244.db2.gz	XAOYFEJFBSLBNV-RTBURBONSA-N	0	3	349.434	3.315	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NC2CCc3ccccc3CC2)CC1	ZINC000454455372	458562389	/nfs/dbraw/zinc/56/23/89/458562389.db2.gz	BRMXAJOSTBAIGK-UHFFFAOYSA-N	0	3	341.499	3.274	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)N(CCc1ccc(Cl)cc1)CC1CC1	ZINC000424130631	458566283	/nfs/dbraw/zinc/56/62/83/458566283.db2.gz	UBMIWGPWJLSTOF-QGZVFWFLSA-N	0	3	333.863	3.142	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@@H]2[C@@H](c3ccccc3)C2(F)F)CC1	ZINC000469378456	458568896	/nfs/dbraw/zinc/56/88/96/458568896.db2.gz	GDHKWCMSHWGSCC-SJORKVTESA-N	0	3	334.410	3.192	20	30		EGEDHN
CC[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)[C@H](N)CCCC#N	ZINC000424145279	458570435	/nfs/dbraw/zinc/57/04/35/458570435.db2.gz	UPVJMAHLVBSTRC-DZGCQCFKSA-N	0	3	342.270	3.452	20	30		EGEDHN
N#CCCC[C@@H](N)C(=O)NCc1ccc(Sc2ccccc2)cc1	ZINC000424175806	458577525	/nfs/dbraw/zinc/57/75/25/458577525.db2.gz	QSIJKTMOVGFTHA-GOSISDBHSA-N	0	3	339.464	3.475	20	30		EGEDHN
C=CC(C)(C)CNC(=O)N1CCN(Cc2ccccc2)C[C@@H](C)C1	ZINC000455386093	458596181	/nfs/dbraw/zinc/59/61/81/458596181.db2.gz	ORJZUCPGYZBQAC-QGZVFWFLSA-N	0	3	329.488	3.362	20	30		EGEDHN
C[C@H]1C[C@@H](NC(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)CCN1C	ZINC000438627409	458607306	/nfs/dbraw/zinc/60/73/06/458607306.db2.gz	AQCHEKDEEVADPY-GWCFXTLKSA-N	0	3	340.349	3.181	20	30		EGEDHN
C[C@H]1C[C@@H](N2CCCC2)CN1C(=O)Nc1ccc(CC#N)cc1Cl	ZINC000455728881	458609845	/nfs/dbraw/zinc/60/98/45/458609845.db2.gz	IEKHXYSNUFAWBA-DZGCQCFKSA-N	0	3	346.862	3.497	20	30		EGEDHN
C[C@H](C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C)c1cccc(C#N)c1	ZINC000462502342	458627829	/nfs/dbraw/zinc/62/78/29/458627829.db2.gz	OMELMVGYCKXOFG-FIKGOQFSSA-N	0	3	347.462	3.298	20	30		EGEDHN
CC[C@@H](Cc1ccc(C)cc1)N(C)CC(=O)N(CC)C[C@H](C)C#N	ZINC000470368393	458632189	/nfs/dbraw/zinc/63/21/89/458632189.db2.gz	BIOSZBBZCYEICP-MJGOQNOKSA-N	0	3	329.488	3.256	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCCc2ccc(Cl)s2)cc1	ZINC000470824864	458653545	/nfs/dbraw/zinc/65/35/45/458653545.db2.gz	BEPVFDRWBHBZCQ-CQSZACIVSA-N	0	3	343.839	3.314	20	30		EGEDHN
C=CCc1ccccc1OC[C@H](O)CN1CC[C@@H](C(F)(F)F)[C@H]1C	ZINC000470952678	458669030	/nfs/dbraw/zinc/66/90/30/458669030.db2.gz	GQDBUOYRQWLDGB-FVQBIDKESA-N	0	3	343.389	3.428	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N1CCn2cccc2[C@H]1C)C(C)C	ZINC000503441880	458708520	/nfs/dbraw/zinc/70/85/20/458708520.db2.gz	ZWJXQGFIIAMDLP-MJGOQNOKSA-N	0	3	344.503	3.273	20	30		EGEDHN
C=CCC(C)(C)CNC(=O)NC[C@@H]1CCN(Cc2ccccc2)C1	ZINC000432362819	458724794	/nfs/dbraw/zinc/72/47/94/458724794.db2.gz	PHSOVTQUDBUPEV-SFHVURJKSA-N	0	3	329.488	3.410	20	30		EGEDHN
CC1(C)C[C@@H](NC[C@H](O)COc2ccccc2C#N)c2ccccc21	ZINC000530233644	458724944	/nfs/dbraw/zinc/72/49/44/458724944.db2.gz	ZMAAGKBSIJQGOK-QFBILLFUSA-N	0	3	336.435	3.310	20	30		EGEDHN
CC1(C)C[C@@H](NC[C@@H](O)COc2ccccc2C#N)c2ccccc21	ZINC000530233645	458725447	/nfs/dbraw/zinc/72/54/47/458725447.db2.gz	ZMAAGKBSIJQGOK-VQIMIIECSA-N	0	3	336.435	3.310	20	30		EGEDHN
C=CCN(Cc1cccs1)C(=O)[C@H](C)N[C@@H]1C[C@H](OC)C1(C)C	ZINC000439626760	458734626	/nfs/dbraw/zinc/73/46/26/458734626.db2.gz	YRQPRJIBWUMGRJ-IMJJTQAJSA-N	0	3	336.501	3.054	20	30		EGEDHN
N#Cc1ccc(CC(C#N)C(=O)NCc2cnc3ccccc3c2)cc1	ZINC000471870014	458744278	/nfs/dbraw/zinc/74/42/78/458744278.db2.gz	JCPVQVYZTLUGAT-IBGZPJMESA-N	0	3	340.386	3.105	20	30		EGEDHN
C=C(C)[C@H]1OCC[C@H]1C(=O)N[C@H](C)[C@@H](c1ccccc1C)N(C)C	ZINC000510516021	458775254	/nfs/dbraw/zinc/77/52/54/458775254.db2.gz	ZCIBSDDKBRADEP-OQIJWPOYSA-N	0	3	330.472	3.084	20	30		EGEDHN
CC(C)(CCC#N)CNC(=O)N1CCN(CC2CCCCC2)CC1	ZINC000513112825	458789552	/nfs/dbraw/zinc/78/95/52/458789552.db2.gz	FYPPRTKPRXEIJD-UHFFFAOYSA-N	0	3	334.508	3.224	20	30		EGEDHN
C=C(C)CN(C)C(=O)NC[C@@H](c1ccc(OC(C)C)cc1)N(C)C	ZINC000512911038	458790157	/nfs/dbraw/zinc/79/01/57/458790157.db2.gz	BKFBLCJIZYJWJN-SFHVURJKSA-N	0	3	333.476	3.294	20	30		EGEDHN
C[C@H]1[C@H](Cc2ccccc2)CCN1CC(=O)NCc1cccc(C#N)c1	ZINC000472353110	458790807	/nfs/dbraw/zinc/79/08/07/458790807.db2.gz	VWWCSFISEXWIKD-UWJYYQICSA-N	0	3	347.462	3.128	20	30		EGEDHN
C[C@@H]1[C@@H](Cc2ccccc2)CCN1CC(=O)NC1(C#N)CCCCC1	ZINC000472354661	458791702	/nfs/dbraw/zinc/79/17/02/458791702.db2.gz	VFXQCVSYYGAVGX-IEBWSBKVSA-N	0	3	339.483	3.282	20	30		EGEDHN
C=CCN1CCC(NC(=O)Nc2c3c(ccc2Cl)OCC3)CC1	ZINC000515584427	458810735	/nfs/dbraw/zinc/81/07/35/458810735.db2.gz	MBPUXIKCERLTKT-UHFFFAOYSA-N	0	3	335.835	3.047	20	30		EGEDHN
C=CCN(Cc1ccccc1F)C(=O)NCCN1CCC(C)CC1	ZINC000515805402	458813560	/nfs/dbraw/zinc/81/35/60/458813560.db2.gz	HGNJHLBTEIEVTQ-UHFFFAOYSA-N	0	3	333.451	3.255	20	30		EGEDHN
COC(=O)c1cccc(CN[C@@H](C)CCCc2cccnc2)c1C#N	ZINC000516629217	458820009	/nfs/dbraw/zinc/82/00/09/458820009.db2.gz	FOXZZQXOBWEEGT-HNNXBMFYSA-N	0	3	337.423	3.241	20	30		EGEDHN
COc1cc(CNC[C@]2(O)CCC[C@@H](C(F)(F)F)C2)ccc1C#N	ZINC000440638727	458836556	/nfs/dbraw/zinc/83/65/56/458836556.db2.gz	OQVSIFNTAGEJLY-ZBFHGGJFSA-N	0	3	342.361	3.140	20	30		EGEDHN
C=CCn1c(SC[C@H]2CCN(C)C2)nnc1-c1cccc(OC)c1	ZINC000473797034	458843543	/nfs/dbraw/zinc/84/35/43/458843543.db2.gz	GOWRRZCSONCFGZ-AWEZNQCLSA-N	0	3	344.484	3.184	20	30		EGEDHN
C=CCCCCNC(=O)NC[C@H](c1cccc(OC)c1)N1CCCC1	ZINC000473892375	458848840	/nfs/dbraw/zinc/84/88/40/458848840.db2.gz	FGYKXXVYFVMZHC-LJQANCHMSA-N	0	3	345.487	3.488	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN(CCc1ccccc1)C1CCCC1	ZINC000550443411	458886146	/nfs/dbraw/zinc/88/61/46/458886146.db2.gz	DNXVWYVFTNXUFS-SFHVURJKSA-N	0	3	341.499	3.482	20	30		EGEDHN
C[C@H](c1ccccc1F)N1CCC[C@H](N[C@@H]2CC[C@@H](C#N)C2)C1=O	ZINC000551242623	458887848	/nfs/dbraw/zinc/88/78/48/458887848.db2.gz	UPSFQHQFFUBQCQ-ADAWSYLGSA-N	0	3	329.419	3.160	20	30		EGEDHN
Cc1cc(C)cc([C@@H](C)NC[C@H](O)COc2ccc(CC#N)cc2)c1	ZINC000553300621	458894481	/nfs/dbraw/zinc/89/44/81/458894481.db2.gz	UQIKVNOVLFIDBO-XLIONFOSSA-N	0	3	338.451	3.460	20	30		EGEDHN
CCOC(=O)[C@H](C)[C@@H](C)NCC#Cc1ccc(OC(F)(F)F)cc1	ZINC000554816096	458901625	/nfs/dbraw/zinc/90/16/25/458901625.db2.gz	DTRRMWCONIRLMU-CHWSQXEVSA-N	0	3	343.345	3.114	20	30		EGEDHN
CC(C)[C@H](NC(=O)C(C#N)CCc1ccccc1)C1(CO)CCCC1	ZINC000566465377	458940946	/nfs/dbraw/zinc/94/09/46/458940946.db2.gz	UWZBTHUMQBUHMQ-MOPGFXCFSA-N	0	3	342.483	3.452	20	30		EGEDHN
C[C@@H]1CC[C@H](CNC(=O)N(CCN(C)C)Cc2ccc(C#N)cc2)C1	ZINC000475476056	458944974	/nfs/dbraw/zinc/94/49/74/458944974.db2.gz	DMVDQOFBQFSYKL-APWZRJJASA-N	0	3	342.487	3.068	20	30		EGEDHN
COC(=O)[C@@H](Cc1ccccc1)[C@@H](C)NCc1ccc(C#N)c(C)c1	ZINC000556522408	458967882	/nfs/dbraw/zinc/96/78/82/458967882.db2.gz	GIEJKFOLACNSDF-UZLBHIALSA-N	0	3	336.435	3.377	20	30		EGEDHN
C=CCN(CC=C)[C@H](CNC(=O)c1cn(C(C)C)nc1C)C(C)C	ZINC000519652418	458983175	/nfs/dbraw/zinc/98/31/75/458983175.db2.gz	RPUBGWYETPDEII-GOSISDBHSA-N	0	3	332.492	3.201	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NC[C@H](c1ccc(C)cc1)N1CCCC1	ZINC000467842092	458989530	/nfs/dbraw/zinc/98/95/30/458989530.db2.gz	PNKVTJOYGDUFRT-TZIWHRDSSA-N	0	3	344.499	3.477	20	30		EGEDHN
CCCN(CC(=O)N(CCC#N)c1ccc(OCC)cc1)C(C)C	ZINC000519833680	459014062	/nfs/dbraw/zinc/01/40/62/459014062.db2.gz	POZGEZIPGQSLKU-UHFFFAOYSA-N	0	3	331.460	3.452	20	30		EGEDHN
C[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1NCc1cccc(F)c1C#N	ZINC000495966953	459022473	/nfs/dbraw/zinc/02/24/73/459022473.db2.gz	FZDPCKWSLIPCJP-GUYCJALGSA-N	0	3	347.434	3.432	20	30		EGEDHN
C[C@H](c1cccc(C#N)c1)N(C)CCN1CCN(c2ccccc2)CC1	ZINC000442676502	459023845	/nfs/dbraw/zinc/02/38/45/459023845.db2.gz	CVHVBOIQBNYBGP-LJQANCHMSA-N	0	3	348.494	3.373	20	30		EGEDHN
COCCN(C(=O)OC(C)(C)C)C1CCN([C@@H](C)CCC#N)CC1	ZINC000496055221	459051079	/nfs/dbraw/zinc/05/10/79/459051079.db2.gz	FMTJCFSWEUSCPQ-HNNXBMFYSA-N	0	3	339.480	3.027	20	30		EGEDHN
C=C(C)Cn1c(CC)nnc1N(C)[C@H]1CCN(Cc2ccccc2)C1	ZINC000577688907	459072837	/nfs/dbraw/zinc/07/28/37/459072837.db2.gz	RYGOYXFOAJTWRQ-SFHVURJKSA-N	0	3	339.487	3.127	20	30		EGEDHN
C=CCN1CCC(NC(=O)N2CCC[C@H](Cc3ccccc3)C2)CC1	ZINC000520710110	459085918	/nfs/dbraw/zinc/08/59/18/459085918.db2.gz	JZQVZNPHSMRHHT-LJQANCHMSA-N	0	3	341.499	3.301	20	30		EGEDHN
N#Cc1cc(Br)cnc1N[C@H]1CCCN2CCCC[C@H]12	ZINC000594601872	459105796	/nfs/dbraw/zinc/10/57/96/459105796.db2.gz	PFHICTBWPRPUPE-UONOGXRCSA-N	0	3	335.249	3.145	20	30		EGEDHN
COc1ccc([C@H](CCC#N)NCCC(=O)Nc2ccccn2)cc1	ZINC000567461540	459109064	/nfs/dbraw/zinc/10/90/64/459109064.db2.gz	HDZCKVPNDMERGQ-KRWDZBQOSA-N	0	3	338.411	3.053	20	30		EGEDHN
CCOc1ccc(N(CCC#N)C(=O)CN[C@H]2CCC2(C)C)cc1	ZINC000521639201	459169642	/nfs/dbraw/zinc/16/96/42/459169642.db2.gz	BUYCQICFNCNYNH-KRWDZBQOSA-N	0	3	329.444	3.110	20	30		EGEDHN
CN(Cc1ccccc1)[C@@H]1CCN(C(=O)[C@@]2(C#N)CC23CCCC3)C1	ZINC000590671442	459177338	/nfs/dbraw/zinc/17/73/38/459177338.db2.gz	SMGBOSBFQYLXAL-NQIIRXRSSA-N	0	3	337.467	3.193	20	30		EGEDHN
Cc1cccc(CN(CC(=O)N[C@@](C)(C#N)C2CC2)CC(C)C)c1	ZINC000521821360	459179616	/nfs/dbraw/zinc/17/96/16/459179616.db2.gz	GLEWCUBDCAEHEL-FQEVSTJZSA-N	0	3	327.472	3.262	20	30		EGEDHN
C=C(C)Cn1c(C2CCCC2)nnc1N1C[C@@H](C)N(CC)C[C@@H]1C	ZINC000558626331	459183819	/nfs/dbraw/zinc/18/38/19/459183819.db2.gz	XGYANKYKAAZYEG-CVEARBPZSA-N	0	3	331.508	3.431	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CN[C@H](C)[C@@H](C)NC(=O)OC(C)(C)C)cc1	ZINC000496444573	459196593	/nfs/dbraw/zinc/19/65/93/459196593.db2.gz	SCDHZZHSCVNXMG-RBSFLKMASA-N	0	3	347.459	3.369	20	30		EGEDHN
Cc1cc(C(C#N)C(=O)c2cnc(-c3ccccc3)nc2)nc(C)n1	ZINC000522231493	459228845	/nfs/dbraw/zinc/22/88/45/459228845.db2.gz	ITANMAVBNFCUJT-MRXNPFEDSA-N	0	3	329.363	3.041	20	30		EGEDHN
CC(C#N)C(=O)N[C@H](CCCNC(=O)OC(C)(C)C)c1ccccc1	ZINC000496551556	459237603	/nfs/dbraw/zinc/23/76/03/459237603.db2.gz	SEUMXXQQRSXVNT-GDBMZVCRSA-N	0	3	345.443	3.308	20	30		EGEDHN
N#CC1(C(=O)N2CCN(c3ccnc4ccccc43)CC2)CCCCC1	ZINC000580340588	459259082	/nfs/dbraw/zinc/25/90/82/459259082.db2.gz	QUFYQVBKYRDHML-UHFFFAOYSA-N	0	3	348.450	3.357	20	30		EGEDHN
CC(C#N)C(=O)N1CC(CN2CC(C)(C)c3ccc(C4CC4)cc32)C1	ZINC000595285652	459266674	/nfs/dbraw/zinc/26/66/74/459266674.db2.gz	SJNONEIPBHYLFS-AWEZNQCLSA-N	0	3	337.467	3.280	20	30		EGEDHN
CN(CC(C)(C)C#N)C(=O)NC[C@@H]1CCCN(Cc2ccccc2)C1	ZINC000590918466	459267614	/nfs/dbraw/zinc/26/76/14/459267614.db2.gz	DTIGBYNQHNWCCD-SFHVURJKSA-N	0	3	342.487	3.090	20	30		EGEDHN
N#Cc1ccc(N2CCN(CC[C@H]3CCc4ccccc43)CC2)nc1	ZINC000595296066	459270759	/nfs/dbraw/zinc/27/07/59/459270759.db2.gz	WZKFOOJXRIXNGS-LJQANCHMSA-N	0	3	332.451	3.195	20	30		EGEDHN
CSc1ccc(OC[C@@H](O)CN[C@@H](C)c2cccc(C#N)c2)cc1	ZINC000591023129	459295806	/nfs/dbraw/zinc/29/58/06/459295806.db2.gz	XOIDBZJDQKIHBZ-YOEHRIQHSA-N	0	3	342.464	3.371	20	30		EGEDHN
COC(=O)[C@@H](C)Oc1ccc(CN2CCC(CCC#N)CC2)cc1	ZINC000568513319	459300880	/nfs/dbraw/zinc/30/08/80/459300880.db2.gz	ZDRRYSNRZOLBER-OAHLLOKOSA-N	0	3	330.428	3.143	20	30		EGEDHN
C=CCN(C(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1)C1CC1	ZINC000536800133	459361033	/nfs/dbraw/zinc/36/10/33/459361033.db2.gz	FBMKRFJCHYZYDV-IBGZPJMESA-N	0	3	327.472	3.492	20	30		EGEDHN
C[C@@]1(C#N)CCCN(C(=O)N[C@@H](CN)c2ccc3ccccc3c2)C1	ZINC000591360001	459361482	/nfs/dbraw/zinc/36/14/82/459361482.db2.gz	BUTANVHFSXEQJN-ICSRJNTNSA-N	0	3	336.439	3.175	20	30		EGEDHN
C=CC[C@@H](C)[C@H](C)NCc1ccc(S(=O)(=O)N(CC)CC)s1	ZINC000539083306	459374850	/nfs/dbraw/zinc/37/48/50/459374850.db2.gz	LLILZHSXJPVDAS-KGLIPLIRSA-N	0	3	344.546	3.469	20	30		EGEDHN
Cc1c2cc(C#N)ccc2sc1C(=O)NC[C@@H]1CCCN(C)C1	ZINC000569009757	459381933	/nfs/dbraw/zinc/38/19/33/459381933.db2.gz	DANQIBJTIRXNDZ-AWEZNQCLSA-N	0	3	327.453	3.153	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cc(C)n(C3CCCCC3)n2)CC1	ZINC000540725641	459383167	/nfs/dbraw/zinc/38/31/67/459383167.db2.gz	DXJNRMHYRBESGE-UHFFFAOYSA-N	0	3	344.503	3.467	20	30		EGEDHN
CC(C)[C@@H]1CCCN([C@H]2CCN(c3ccc(C#N)cc3)C2=O)CC1	ZINC000569025961	459384107	/nfs/dbraw/zinc/38/41/07/459384107.db2.gz	YGAHPUHNLHACEV-MJGOQNOKSA-N	0	3	325.456	3.422	20	30		EGEDHN
N#Cc1ccc([C@H](NC[C@@H]2CCC[C@H]2c2ccccc2)C(N)=O)cc1	ZINC000569094569	459394797	/nfs/dbraw/zinc/39/47/97/459394797.db2.gz	WBZOAHHWKQFDCE-UFYCRDLUSA-N	0	3	333.435	3.258	20	30		EGEDHN
CN(C)CCN(Cc1ccco1)C(=O)c1ccc(Cl)c(C#N)c1	ZINC000540887978	459396774	/nfs/dbraw/zinc/39/67/74/459396774.db2.gz	KWXBVCHSKMPIEQ-UHFFFAOYSA-N	0	3	331.803	3.009	20	30		EGEDHN
Cc1cc(C)cc(OC[C@H](O)CN[C@H]2CCc3cc(C#N)ccc32)c1	ZINC000591764162	459431903	/nfs/dbraw/zinc/43/19/03/459431903.db2.gz	UWELXUWIHNITFU-NQIIRXRSSA-N	0	3	336.435	3.192	20	30		EGEDHN
CCOC(=O)C1CCC(O)(CN[C@H](CCC#N)c2ccccc2)CC1	ZINC000569448530	459452988	/nfs/dbraw/zinc/45/29/88/459452988.db2.gz	DBAGHICDPVZZPT-QPIRBTGLSA-N	0	3	344.455	3.105	20	30		EGEDHN
COc1ccccc1N(CCC#N)C(=O)[C@H](C)NC1(CC(C)C)CC1	ZINC000595831464	459456358	/nfs/dbraw/zinc/45/63/58/459456358.db2.gz	OXOZDJSWPLVDOQ-INIZCTEOSA-N	0	3	343.471	3.499	20	30		EGEDHN
COc1ccccc1N(CCC#N)C(=O)[C@@H](C)NC1(CC(C)C)CC1	ZINC000595831465	459456521	/nfs/dbraw/zinc/45/65/21/459456521.db2.gz	OXOZDJSWPLVDOQ-MRXNPFEDSA-N	0	3	343.471	3.499	20	30		EGEDHN
CN(C)C(=O)C(C)(C)NCCC(C#N)(c1ccccc1)c1ccccc1	ZINC000583063621	459475209	/nfs/dbraw/zinc/47/52/09/459475209.db2.gz	PZMMDSUETZZLJR-UHFFFAOYSA-N	0	3	349.478	3.343	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@H](NCc2ccc(CC#N)cc2)C1	ZINC000497203925	459484506	/nfs/dbraw/zinc/48/45/06/459484506.db2.gz	PQBBIMGCQMDSKD-KRWDZBQOSA-N	0	3	329.444	3.242	20	30		EGEDHN
N#Cc1cccc(NC(=O)N2C[C@@H]3CCN(Cc4ccccc4)[C@@H]3C2)c1	ZINC000583138002	459489601	/nfs/dbraw/zinc/48/96/01/459489601.db2.gz	AUODFGMEWTXNGE-AZUAARDMSA-N	0	3	346.434	3.296	20	30		EGEDHN
Cc1nn(C)c(N2CCN(CCC3CCCCCC3)CC2)c1C#N	ZINC000561960745	459497665	/nfs/dbraw/zinc/49/76/65/459497665.db2.gz	TXLNEQHFNPGFLW-UHFFFAOYSA-N	0	3	329.492	3.083	20	30		EGEDHN
C=CCn1c(CC)nnc1N1C[C@H](C)N(Cc2ccccc2)C[C@@H]1C	ZINC000562030034	459504504	/nfs/dbraw/zinc/50/45/04/459504504.db2.gz	WDFOLNBFJHMIJZ-IRXDYDNUSA-N	0	3	339.487	3.126	20	30		EGEDHN
CCN(CC)[C@@H](CNC(=O)N1CCC(CC#N)CC1)c1ccsc1	ZINC000541914998	459510347	/nfs/dbraw/zinc/51/03/47/459510347.db2.gz	UVFMJXRMYPQYQA-KRWDZBQOSA-N	0	3	348.516	3.466	20	30		EGEDHN
N#CC1(NC(=O)CN[C@H](c2ccc(F)cc2)C2CCCC2)CCC1	ZINC000525886413	459512056	/nfs/dbraw/zinc/51/20/56/459512056.db2.gz	OEVRQZLEMARTMD-SFHVURJKSA-N	0	3	329.419	3.209	20	30		EGEDHN
C=CCC1(CNC(=O)Nc2ccc3c(c2)CNCCO3)CCCC1	ZINC000569910622	459529265	/nfs/dbraw/zinc/52/92/65/459529265.db2.gz	WKFPYUHTMXYDON-UHFFFAOYSA-N	0	3	329.444	3.427	20	30		EGEDHN
C[C@@H](c1ccccc1)[C@H](O)CN1CCC(C#N)(c2ccccn2)CC1	ZINC000569918242	459530458	/nfs/dbraw/zinc/53/04/58/459530458.db2.gz	YMSWLXGGYCFBHL-PKOBYXMFSA-N	0	3	335.451	3.103	20	30		EGEDHN
C[C@@H](c1cccc(C#N)c1)N1CC[C@@H](C(=O)NCc2ccccc2)C1	ZINC000592154776	459537073	/nfs/dbraw/zinc/53/70/73/459537073.db2.gz	JLZXXECIRAGKNB-OXJNMPFZSA-N	0	3	333.435	3.258	20	30		EGEDHN
CN(C)CCN(Cc1cccc(F)c1)c1nc(C#N)c(Cl)s1	ZINC000596157971	459542545	/nfs/dbraw/zinc/54/25/45/459542545.db2.gz	LEQMDWZYULZFIF-UHFFFAOYSA-N	0	3	338.839	3.375	20	30		EGEDHN
C[C@@H]1CCCC[C@H]1OCCN1CC[C@@H](Oc2ccc(C#N)cn2)C1	ZINC000562363292	459546477	/nfs/dbraw/zinc/54/64/77/459546477.db2.gz	QRTXZRKJCDYELM-KBAYOESNSA-N	0	3	329.444	3.002	20	30		EGEDHN
CCc1cnc(CNC2CCC(Oc3ccc(C#N)cn3)CC2)s1	ZINC000542312631	459546740	/nfs/dbraw/zinc/54/67/40/459546740.db2.gz	BLLRFTLZSVDLCP-UHFFFAOYSA-N	0	3	342.468	3.452	20	30		EGEDHN
C=CCN(CCc1ccco1)C(=O)NC[C@H](C)N1CCC[C@H](C)C1	ZINC000498155013	459570838	/nfs/dbraw/zinc/57/08/38/459570838.db2.gz	HJUXSPFUVASXRF-IRXDYDNUSA-N	0	3	333.476	3.140	20	30		EGEDHN
C#CCN1CCC(C(=O)N[C@@H]2CC=C(c3ccc(F)cc3)CC2)CC1	ZINC000490915725	459590507	/nfs/dbraw/zinc/59/05/07/459590507.db2.gz	OMCXXYDJRUTNKF-HXUWFJFHSA-N	0	3	340.442	3.223	20	30		EGEDHN
CC[C@H](N[C@H]1CCc2ccc(C#N)cc21)C(=O)NCc1cccs1	ZINC000592396206	459591011	/nfs/dbraw/zinc/59/10/11/459591011.db2.gz	OYRRUPCGFYTTPT-ROUUACIJSA-N	0	3	339.464	3.292	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cc(OC)c(C(C)C)c(OC)c2)CC1	ZINC000490936899	459591638	/nfs/dbraw/zinc/59/16/38/459591638.db2.gz	RXLATXLARMIIMC-UHFFFAOYSA-N	0	3	344.455	3.111	20	30		EGEDHN
CC(C)(C)N1CCCN(C(=O)C[C@H](CC#N)c2ccccc2)CC1	ZINC000527241131	459614659	/nfs/dbraw/zinc/61/46/59/459614659.db2.gz	KHYDFUSNKVAPHK-SFHVURJKSA-N	0	3	327.472	3.407	20	30		EGEDHN
C#CCNC(=O)C1CCN(c2c(C)c(CC)nc3ccccc32)CC1	ZINC000491619993	459639910	/nfs/dbraw/zinc/63/99/10/459639910.db2.gz	GIHOLCMCACBJIU-UHFFFAOYSA-N	0	3	335.451	3.071	20	30		EGEDHN
Cc1ccc(C[C@H]2CCCN2CC(=O)NCc2cccc(C#N)c2)cc1	ZINC000500207668	459671818	/nfs/dbraw/zinc/67/18/18/459671818.db2.gz	IJMRSNZYLATUSI-OAQYLSRUSA-N	0	3	347.462	3.190	20	30		EGEDHN
CN(C)CCN(CC1CCCCC1)C(=O)Cc1ccc(C#N)cc1	ZINC000501254616	459719168	/nfs/dbraw/zinc/71/91/68/459719168.db2.gz	RVSRAHXARZVHPL-UHFFFAOYSA-N	0	3	327.472	3.071	20	30		EGEDHN
N#Cc1cccc(CCN[C@@H](C(=O)N2CCCCC2)c2ccccc2)c1	ZINC000584369637	459720789	/nfs/dbraw/zinc/72/07/89/459720789.db2.gz	LHRPYTVHTRUDPU-OAQYLSRUSA-N	0	3	347.462	3.444	20	30		EGEDHN
Cc1cc(NC[C@H](C#N)CCC#N)cc(N2CCN(C(C)C)CC2)c1	ZINC000584444868	459738811	/nfs/dbraw/zinc/73/88/11/459738811.db2.gz	FUDZFCCRZKOGRF-SFHVURJKSA-N	0	3	339.487	3.381	20	30		EGEDHN
COc1ccc(C#N)cc1NC(=O)C(C[C@H]1CCCO1)C(F)(F)F	ZINC000593047255	459753296	/nfs/dbraw/zinc/75/32/96/459753296.db2.gz	XHGMLJNNVHBYMV-VXGBXAGGSA-N	0	3	342.317	3.253	20	30		EGEDHN
C=C(C)CN1CCC(Nc2cc(C(F)F)nc(SC)n2)CC1	ZINC000565606831	459786560	/nfs/dbraw/zinc/78/65/60/459786560.db2.gz	DRUZYJHBKBDIMR-UHFFFAOYSA-N	0	3	328.432	3.010	20	30		EGEDHN
N#Cc1ccc2c(c1)CCCC[C@@H]2N[C@@H]1Cc2ccccc2NC1=O	ZINC000528002117	459792309	/nfs/dbraw/zinc/79/23/09/459792309.db2.gz	WJWDOTQRZOFDGJ-VQTJNVASSA-N	0	3	331.419	3.479	20	30		EGEDHN
Cc1cc(NC(=O)[C@]2(C#N)C[C@H]2C)cc(N2CCN(C(C)C)CC2)c1	ZINC000584821248	459807525	/nfs/dbraw/zinc/80/75/25/459807525.db2.gz	ZMTPIQPQJYNORG-UZLBHIALSA-N	0	3	340.471	3.014	20	30		EGEDHN
CC[C@@H](c1nnc(NC(=O)[C@H](N)CCCC#N)s1)c1ccccc1	ZINC000566179252	459819725	/nfs/dbraw/zinc/81/97/25/459819725.db2.gz	IWXBWEBHSZKNSS-ZIAGYGMSSA-N	0	3	343.456	3.040	20	30		EGEDHN
COCc1ccc(NC(=O)N2CCCN(C(C)(C)C)CC2)cc1C#N	ZINC000529215414	459826301	/nfs/dbraw/zinc/82/63/01/459826301.db2.gz	ZOYQUCHGZIMVJN-UHFFFAOYSA-N	0	3	344.459	3.043	20	30		EGEDHN
COCc1ccc(NC(=O)[C@@H]2CCCN2C2CCCC2)cc1C#N	ZINC000529816229	459850785	/nfs/dbraw/zinc/85/07/85/459850785.db2.gz	KHZDGSUGJSPKQG-SFHVURJKSA-N	0	3	327.428	3.050	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)N2CCCc3sccc3C2)CC1	ZINC000593367172	459868461	/nfs/dbraw/zinc/86/84/61/459868461.db2.gz	SQTDWSZAYXXZFI-UHFFFAOYSA-N	0	3	333.501	3.246	20	30		EGEDHN
N#CCC1CCN(C(=O)Nc2cc(CN)cc(C(F)(F)F)c2)CC1	ZINC000574905270	459892124	/nfs/dbraw/zinc/89/21/24/459892124.db2.gz	FJTJMANERHWDEH-UHFFFAOYSA-N	0	3	340.349	3.322	20	30		EGEDHN
CC(C)[C@@H]1CN(C(=O)c2ccccc2Oc2ccccc2C#N)CCN1	ZINC000598569110	459942520	/nfs/dbraw/zinc/94/25/20/459942520.db2.gz	AHMCUYXIXWJCAN-SFHVURJKSA-N	0	3	349.434	3.421	20	30		EGEDHN
N#Cc1ccccc1N1CCCN(Cc2ccc3nccnc3c2)CC1	ZINC000602446455	459943628	/nfs/dbraw/zinc/94/36/28/459943628.db2.gz	CQEPUXIDKLLZEF-UHFFFAOYSA-N	0	3	343.434	3.214	20	30		EGEDHN
CN(Cc1ccc(Br)s1)C[C@@H](O)CC(C)(C)C#N	ZINC000598588166	459953457	/nfs/dbraw/zinc/95/34/57/459953457.db2.gz	ZRJSJAPYDLOCJB-JTQLQIEISA-N	0	3	331.279	3.243	20	30		EGEDHN
CC(C)(C#N)C[C@H](O)CN(Cc1cccc(F)c1)C[C@@H]1CCCO1	ZINC000598589588	459956355	/nfs/dbraw/zinc/95/63/55/459956355.db2.gz	GYRHGFPWFSCHMD-ROUUACIJSA-N	0	3	334.435	3.107	20	30		EGEDHN
CCOc1ccc(C2=CCN(C[C@H](O)CC(C)(C)C#N)CC2)cc1	ZINC000598601270	459959687	/nfs/dbraw/zinc/95/96/87/459959687.db2.gz	SAINPCIPXLDBLQ-GOSISDBHSA-N	0	3	328.456	3.475	20	30		EGEDHN
CN(C)CCN(Cc1ccc(F)cc1F)C(=O)CCCCCC#N	ZINC000588652668	459961084	/nfs/dbraw/zinc/96/10/84/459961084.db2.gz	JYVRPJKROWVPQF-UHFFFAOYSA-N	0	3	337.414	3.329	20	30		EGEDHN
Cc1nc2ccccc2n1C[C@H]1CCCN1Cc1cccc(C#N)n1	ZINC000602485798	459963723	/nfs/dbraw/zinc/96/37/23/459963723.db2.gz	STKDSZBSXGZFLC-GOSISDBHSA-N	0	3	331.423	3.276	20	30		EGEDHN
Cc1cc(Br)ccc1NC(=O)CNC[C@@H](C)CCC#N	ZINC000602527935	459983165	/nfs/dbraw/zinc/98/31/65/459983165.db2.gz	KKRLDROLFQDQJL-NSHDSACASA-N	0	3	338.249	3.226	20	30		EGEDHN
CC[C@@H](NCc1cccc(C#N)n1)[C@H](c1ccc(C)cc1)n1cncn1	ZINC000602576136	460005102	/nfs/dbraw/zinc/00/51/02/460005102.db2.gz	MQAMBAHFEDHGBH-UXHICEINSA-N	0	3	346.438	3.011	20	30		EGEDHN
Cn1nccc1[C@@H]1CCCCN1C(=O)C(C#N)CCc1ccccc1	ZINC000597612328	460008341	/nfs/dbraw/zinc/00/83/41/460008341.db2.gz	WACJOSJOVYXYAJ-HKUYNNGSSA-N	0	3	336.439	3.246	20	30		EGEDHN
CC[C@@](C)(COc1ncccc1Cl)NCc1cccc(C#N)n1	ZINC000602583083	460009435	/nfs/dbraw/zinc/00/94/35/460009435.db2.gz	PNKZQESHTLSCOM-KRWDZBQOSA-N	0	3	330.819	3.339	20	30		EGEDHN
COc1ccc([C@@H](CN(C)C)NC(=O)CC2(C#N)CCCCC2)cc1	ZINC000597634438	460013585	/nfs/dbraw/zinc/01/35/85/460013585.db2.gz	RZWXFKQEPVSJEF-GOSISDBHSA-N	0	3	343.471	3.278	20	30		EGEDHN
C[C@H](Cc1ccc(C#N)cc1)C(=O)NC[C@@H](c1ccccc1)N(C)C	ZINC000593943176	460022322	/nfs/dbraw/zinc/02/23/22/460022322.db2.gz	KFGVTSOVNDJKDO-UZLBHIALSA-N	0	3	335.451	3.156	20	30		EGEDHN
N#Cc1cccc(CN[C@H]2CCC[C@H]2Oc2cc(F)cc(F)c2)n1	ZINC000602654272	460045139	/nfs/dbraw/zinc/04/51/39/460045139.db2.gz	LBFGMSIYBUXJNO-ZWKOTPCHSA-N	0	3	329.350	3.321	20	30		EGEDHN
CC1CCN([C@@H](CNC(=O)c2cccc(C#N)n2)c2ccccc2)CC1	ZINC000589329996	460074680	/nfs/dbraw/zinc/07/46/80/460074680.db2.gz	IDOXSRPXHSNFGP-FQEVSTJZSA-N	0	3	348.450	3.156	20	30		EGEDHN
N#Cc1cccc(CN[C@@]2(Cc3ccc(Cl)cc3)CCCOC2)n1	ZINC000602709894	460078015	/nfs/dbraw/zinc/07/80/15/460078015.db2.gz	JLOOOQHKYKEFCZ-LJQANCHMSA-N	0	3	341.842	3.488	20	30		EGEDHN
N#Cc1ccc(CCNC(=O)[C@H]2CCCCN2C2CCCC2)cc1	ZINC000597890232	460096923	/nfs/dbraw/zinc/09/69/23/460096923.db2.gz	QXGSPVMCNPUXRA-LJQANCHMSA-N	0	3	325.456	3.014	20	30		EGEDHN
N#Cc1cnc2c(F)ccc(F)c2c1N1CC[C@H](N2CCCC2)C1	ZINC000610275838	460103031	/nfs/dbraw/zinc/10/30/31/460103031.db2.gz	NHDGLVJQUYCQPL-ZDUSSCGKSA-N	0	3	328.366	3.059	20	30		EGEDHN
CC(C)(C)N1CC[C@@H](NC(=O)c2c(Cl)cc(C#N)cc2Cl)C1	ZINC000597920415	460113025	/nfs/dbraw/zinc/11/30/25/460113025.db2.gz	BQBPRHQAMZVIJD-LLVKDONJSA-N	0	3	340.254	3.468	20	30		EGEDHN
C[C@H](NC(=O)NCC(C)(C)N1CCCCC1)c1cccc(C#N)c1	ZINC000610346344	460127002	/nfs/dbraw/zinc/12/70/02/460127002.db2.gz	AXBHDWKIBJEUDI-HNNXBMFYSA-N	0	3	328.460	3.183	20	30		EGEDHN
Cc1csc([C@@H](C)NC2CCN(c3ccc(C#N)cn3)CC2)n1	ZINC000599025944	460130707	/nfs/dbraw/zinc/13/07/07/460130707.db2.gz	FRNOKYFVQDDEJK-CYBMUJFWSA-N	0	3	327.457	3.038	20	30		EGEDHN
CC[C@H]1CCCCN1CCNC(=O)N[C@@H](C)c1cccc(C#N)c1	ZINC000610351355	460131196	/nfs/dbraw/zinc/13/11/96/460131196.db2.gz	NVOMZXASWYBLMH-YJBOKZPZSA-N	0	3	328.460	3.183	20	30		EGEDHN
C[C@H]1CCc2c(F)cccc2[C@H]1NCc1cnc2c(C#N)cnn2c1	ZINC000576466060	460146545	/nfs/dbraw/zinc/14/65/45/460146545.db2.gz	MKTJDPLGRRACBV-SGTLLEGYSA-N	0	3	335.386	3.153	20	30		EGEDHN
N#Cc1csc(CNc2ccc(CN3CCC(O)CC3)cc2)c1	ZINC000610497339	460166050	/nfs/dbraw/zinc/16/60/50/460166050.db2.gz	VWTPNSXRJMQDOC-UHFFFAOYSA-N	0	3	327.453	3.189	20	30		EGEDHN
C[C@@H](CC(=O)N1CCCCCC1)N[C@@H]1CCc2cc(C#N)ccc21	ZINC000618804629	460182601	/nfs/dbraw/zinc/18/26/01/460182601.db2.gz	LKWVLFAICOHWCY-HNAYVOBHSA-N	0	3	325.456	3.316	20	30		EGEDHN
C[C@H](N[C@@H]1CCc2cc(C#N)ccc21)c1ccc(-n2cncn2)cc1	ZINC000618806205	460184000	/nfs/dbraw/zinc/18/40/00/460184000.db2.gz	PZMQAXSLLZRFOV-VBKZILBWSA-N	0	3	329.407	3.477	20	30		EGEDHN
N#Cc1ccccc1OC[C@@H](O)CN(Cc1ccc(F)cc1)C1CC1	ZINC000599250467	460206632	/nfs/dbraw/zinc/20/66/32/460206632.db2.gz	NVHPCLCQNPVJCF-IBGZPJMESA-N	0	3	340.398	3.102	20	30		EGEDHN
CC(C)OC(=O)C[C@@H](NC(=O)C(C#N)CCc1ccccc1)C(C)C	ZINC000594407500	460208628	/nfs/dbraw/zinc/20/86/28/460208628.db2.gz	KJALXDNUNSQSOW-QZTJIDSGSA-N	0	3	344.455	3.241	20	30		EGEDHN
COc1ccc2c(c1)CCN(C(=O)C(C#N)CCc1ccccc1)C2	ZINC000598224143	460212537	/nfs/dbraw/zinc/21/25/37/460212537.db2.gz	BWKRUVIINMCEIO-GOSISDBHSA-N	0	3	334.419	3.352	20	30		EGEDHN
CN(CCc1ccc(Cl)cc1)C[C@H](O)COc1ccccc1C#N	ZINC000599292359	460217877	/nfs/dbraw/zinc/21/78/77/460217877.db2.gz	CYHMWWBCTOMHDC-SFHVURJKSA-N	0	3	344.842	3.126	20	30		EGEDHN
CC[C@@H](NC[C@@H](O)COc1ccccc1C#N)c1ccc(OC)cc1	ZINC000599344210	460232882	/nfs/dbraw/zinc/23/28/82/460232882.db2.gz	AOGCRPYZEJJEAW-IEBWSBKVSA-N	0	3	340.423	3.047	20	30		EGEDHN
CC(C)(NC[C@@H](O)COc1ccccc1C#N)c1cccc(Cl)c1	ZINC000599357711	460237870	/nfs/dbraw/zinc/23/78/70/460237870.db2.gz	WPGDUOYTBZCGHT-QGZVFWFLSA-N	0	3	344.842	3.476	20	30		EGEDHN
N#CCN1CCC(NCc2cc(Br)ccc2Cl)CC1	ZINC000610860041	460249782	/nfs/dbraw/zinc/24/97/82/460249782.db2.gz	GCCOUMQSZFNYKY-UHFFFAOYSA-N	0	3	342.668	3.180	20	30		EGEDHN
CN(C)CCOc1ccc(CN(CCC#N)Cc2ccco2)cc1	ZINC000611251951	460317282	/nfs/dbraw/zinc/31/72/82/460317282.db2.gz	MEWPEOVBCCNPQK-UHFFFAOYSA-N	0	3	327.428	3.136	20	30		EGEDHN
CN(Cc1ccccc1)C(=O)CN[C@@H]1CCCc2cc(C#N)ccc21	ZINC000611391163	460354239	/nfs/dbraw/zinc/35/42/39/460354239.db2.gz	XPXIZKJHTHYZGX-HXUWFJFHSA-N	0	3	333.435	3.184	20	30		EGEDHN
CC[C@H]1CN(C)CCCN1C(=O)CCCCOc1cccc(C#N)c1	ZINC000619567042	460384754	/nfs/dbraw/zinc/38/47/54/460384754.db2.gz	JKADSKRWGIBYQI-SFHVURJKSA-N	0	3	343.471	3.050	20	30		EGEDHN
CO[C@@]1(C(F)(F)F)CCCN(CCCC2(C#N)CCOCC2)C1	ZINC000619621552	460398768	/nfs/dbraw/zinc/39/87/68/460398768.db2.gz	AOJYKRJVLCEPTC-HNNXBMFYSA-N	0	3	334.382	3.130	20	30		EGEDHN
CC(C)N(Cc1cccs1)C[C@@H](O)COc1ccc(CC#N)cc1	ZINC000604416418	460423040	/nfs/dbraw/zinc/42/30/40/460423040.db2.gz	JXJRODYJOKQEPP-QGZVFWFLSA-N	0	3	344.480	3.464	20	30		EGEDHN
CC(C)c1ccc(CNC[C@@H](O)COc2ccc(CC#N)cc2)cc1	ZINC000604416408	460423129	/nfs/dbraw/zinc/42/31/29/460423129.db2.gz	IYBQKDRZFJNECH-HXUWFJFHSA-N	0	3	338.451	3.406	20	30		EGEDHN
COC(=O)c1cnc(C2CCN(CC(C)(C)CCC#N)CC2)s1	ZINC000600191893	460430559	/nfs/dbraw/zinc/43/05/59/460430559.db2.gz	XLRBKIMYQUQPEA-UHFFFAOYSA-N	0	3	335.473	3.439	20	30		EGEDHN
CCN(CCC#N)C(=O)CN(CCc1ccc(F)cc1)CC(C)C	ZINC000604493535	460434594	/nfs/dbraw/zinc/43/45/94/460434594.db2.gz	BWZWKPZCEUNSDF-UHFFFAOYSA-N	0	3	333.451	3.088	20	30		EGEDHN
C=CCOc1c(Cl)cc(CN[C@@H](C)Cn2ccnc2)cc1OC	ZINC000623356202	460507456	/nfs/dbraw/zinc/50/74/56/460507456.db2.gz	CKRSQQDAHWLEED-ZDUSSCGKSA-N	0	3	335.835	3.288	20	30		EGEDHN
CC(C)[C@H](N[C@@H]1CCCc2cc(C#N)ccc21)[C@H](O)C(F)(F)F	ZINC000601301385	460781743	/nfs/dbraw/zinc/78/17/43/460781743.db2.gz	ZGNIFAKILFKRQN-PMPSAXMXSA-N	0	3	326.362	3.473	20	30		EGEDHN
C[C@@H]1[C@H](NC(=O)c2ccccc2CC#N)CCN1Cc1ccccc1	ZINC000601580545	460837444	/nfs/dbraw/zinc/83/74/44/460837444.db2.gz	NTDLROQXYGKPHY-OXQOHEQNSA-N	0	3	333.435	3.145	20	30		EGEDHN
CN(C(=O)[C@@H]1CN(C(C)(C)C)C[C@H]1C(F)(F)F)[C@@H]1CCC[C@@H]1C#N	ZINC000601823154	460911148	/nfs/dbraw/zinc/91/11/48/460911148.db2.gz	XZGLMEPALCLDOS-AAVRWANBSA-N	0	3	345.409	3.046	20	30		EGEDHN
Cc1cccc(S(=O)(=O)CCCN[C@@H](C)c2cccc(C#N)c2)c1	ZINC000613383380	460929201	/nfs/dbraw/zinc/92/92/01/460929201.db2.gz	JJQANXKNTDVDBR-INIZCTEOSA-N	0	3	342.464	3.381	20	30		EGEDHN
N#CCC[C@@H](NC[C@@]1(O)CCN(Cc2ccccc2)C1)c1ccccc1	ZINC000601964627	460963662	/nfs/dbraw/zinc/96/36/62/460963662.db2.gz	JMZZYTMMHCEQML-YADHBBJMSA-N	0	3	349.478	3.258	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)C1CCC=CCC1	ZINC000602075540	461004378	/nfs/dbraw/zinc/00/43/78/461004378.db2.gz	ZHNRPSLJRCWTNH-UHFFFAOYSA-N	0	3	325.456	3.195	20	30		EGEDHN
C=CCN(CC=C)C(=O)c1ccc(NC(=O)[C@@H](N)CCC(C)C)cc1	ZINC000637936474	461136694	/nfs/dbraw/zinc/13/66/94/461136694.db2.gz	FVEPZKNKZRNHRF-SFHVURJKSA-N	0	3	343.471	3.203	20	30		EGEDHN
C=CCCn1cc(CN(CCN(C)C)Cc2cccc(Cl)c2)nn1	ZINC000668159753	461146373	/nfs/dbraw/zinc/14/63/73/461146373.db2.gz	FSHJBTOBXWMFMQ-UHFFFAOYSA-N	0	3	347.894	3.071	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)C[C@@H]2C[C@H]2c2ccc(OC)cc2)CC1	ZINC000668370068	461259093	/nfs/dbraw/zinc/25/90/93/461259093.db2.gz	MLQDXYMDHPLQKB-PXNSSMCTSA-N	0	3	342.483	3.346	20	30		EGEDHN
C=CCCC(C)(C)NC(=O)NCc1ccc(OCCN(C)C)cc1	ZINC000663586160	461713442	/nfs/dbraw/zinc/71/34/42/461713442.db2.gz	RKBUEKNGZZCJKR-UHFFFAOYSA-N	0	3	333.476	3.171	20	30		EGEDHN
C=CCCn1cc(CN[C@H](CN2CCCCC2)c2ccccc2)nn1	ZINC000653612596	461760161	/nfs/dbraw/zinc/76/01/61/461760161.db2.gz	YAYFRHQAVVNMGH-HXUWFJFHSA-N	0	3	339.487	3.171	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](CC)Cc2ccc(F)cc2)CC1	ZINC000660704267	461929755	/nfs/dbraw/zinc/92/97/55/461929755.db2.gz	BLAJGVPLYKRNAQ-KRWDZBQOSA-N	0	3	333.451	3.096	20	30		EGEDHN
C=CCc1ccc(OC[C@H](O)CN2CCC(C3CC3)CC2)c(OC)c1	ZINC000644719048	462050589	/nfs/dbraw/zinc/05/05/89/462050589.db2.gz	PQSUDGWDADDGPH-LJQANCHMSA-N	0	3	345.483	3.285	20	30		EGEDHN
C=CCCn1cc(CNC[C@H]2CCCc3cc(OC)ccc32)nn1	ZINC000657437416	462123010	/nfs/dbraw/zinc/12/30/10/462123010.db2.gz	RJKBJKBDSJYJBK-MRXNPFEDSA-N	0	3	326.444	3.073	20	30		EGEDHN
C=CC[C@H]1CCCN([C@@H]2CCN(Cc3ccc(OC)cc3)C2=O)C1	ZINC000661384677	462225494	/nfs/dbraw/zinc/22/54/94/462225494.db2.gz	KGPAVJAHGGTSFE-QFBILLFUSA-N	0	3	328.456	3.084	20	30		EGEDHN
C=CCN(Cc1ccccc1)C(=O)N[C@H]1CCCN2CCCC[C@@H]12	ZINC000654726585	462354995	/nfs/dbraw/zinc/35/49/95/462354995.db2.gz	WRZYCKIUBNFLFR-OALUTQOASA-N	0	3	327.472	3.401	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)[C@H]2CCCc3ccc(OC)cc32)CC1	ZINC000654750016	462370262	/nfs/dbraw/zinc/37/02/62/462370262.db2.gz	XJSXJYBXNCNLEE-IBGZPJMESA-N	0	3	342.483	3.272	20	30		EGEDHN
CC#CCCCC(=O)NCCc1ccc(OCCN2CCCC2)cc1	ZINC000185994719	526296733	/nfs/dbraw/zinc/29/67/33/526296733.db2.gz	HLTLWCWSIONJLX-UHFFFAOYSA-N	0	3	342.483	3.014	20	30		EGEDHN
C=CCN1CCC(NC(=O)COc2cc(C)ccc2C(C)C)CC1	ZINC000171721701	526421836	/nfs/dbraw/zinc/42/18/36/526421836.db2.gz	GTLMOYRANKDHLR-UHFFFAOYSA-N	0	3	330.472	3.264	20	30		EGEDHN
C=CCN1CCC(NC(=O)N[C@@H](C)c2cccc(OCC)c2)CC1	ZINC000171728017	526437115	/nfs/dbraw/zinc/43/71/15/526437115.db2.gz	BGWXLHMHHYVVCL-HNNXBMFYSA-N	0	3	331.460	3.096	20	30		EGEDHN
C=CCN1CCC(NC(=O)[C@@H](CC)Oc2ccccc2Cl)CC1	ZINC000176321771	526442518	/nfs/dbraw/zinc/44/25/18/526442518.db2.gz	MIICJMZWXVAEBF-MRXNPFEDSA-N	0	3	336.863	3.264	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)NCc2cccc(CSC)c2)CC1	ZINC000189818741	526591642	/nfs/dbraw/zinc/59/16/42/526591642.db2.gz	JSOPIZLGJGSZHD-UHFFFAOYSA-N	0	3	347.528	3.389	20	30		EGEDHN
C=CCOc1cccc(CN2CCC3(CC2)[C@H](O)C[C@@H]3OCC)c1	ZINC000130231122	526898988	/nfs/dbraw/zinc/89/89/88/526898988.db2.gz	PRGUUGIADZOIII-MOPGFXCFSA-N	0	3	331.456	3.003	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2cc(C)cc(Br)c2)CC1	ZINC000187565060	526931876	/nfs/dbraw/zinc/93/18/76/526931876.db2.gz	CNEQTZTWKOLHFZ-UHFFFAOYSA-N	0	3	335.245	3.041	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC1CCN([C@H](C)c2ccncc2)CC1	ZINC000155312280	527028278	/nfs/dbraw/zinc/02/82/78/527028278.db2.gz	UHHZQBVNWQAORJ-MRXNPFEDSA-N	0	3	327.472	3.492	20	30		EGEDHN
C=C[C@@](C)(CCOC)C(=O)NC1CCN(Cc2ccccc2C)CC1	ZINC000187217810	527529287	/nfs/dbraw/zinc/52/92/87/527529287.db2.gz	LFLNCMTXSNHMKI-NRFANRHFSA-N	0	3	344.499	3.304	20	30		EGEDHN
CC(C)N(Cc1ccc(C#N)cc1)C(=O)N[C@@H]1C[C@@H](C)N(C2CC2)C1	ZINC000129973109	528937545	/nfs/dbraw/zinc/93/75/45/528937545.db2.gz	JNNWLHWKYSNGMY-CRAIPNDOSA-N	0	3	340.471	3.103	20	30		EGEDHN
CO[C@@H]1[C@H](C)[C@H](N[C@@H](C)C(=O)Nc2ccc(C#N)c(Cl)c2)C1(C)C	ZINC000344471379	536816247	/nfs/dbraw/zinc/81/62/47/536816247.db2.gz	UWTYEWFSSRPXAL-LZJQFABFSA-N	0	3	349.862	3.188	20	30		EGEDHN
COc1cc(C(=O)C(C#N)c2nnc3n2CCCCC3)ccc1Cl	ZINC000137090704	546843658	/nfs/dbraw/zinc/84/36/58/546843658.db2.gz	DQBHMHCCLINJRC-LBPRGKRZSA-N	0	3	344.802	3.157	20	30		EGEDHN
CCc1nccn1[C@@H]1CCCN(C([O-])=[NH+]CCOC2CCCCC2)C1	ZINC000329655706	547503459	/nfs/dbraw/zinc/50/34/59/547503459.db2.gz	FVZSRJCSSHXIOD-MRXNPFEDSA-N	0	3	348.491	3.346	20	30		EGEDHN
CCc1nccn1[C@H]1CCCN(C([O-])=[NH+]CCOC2CCCCC2)C1	ZINC000329655701	547504100	/nfs/dbraw/zinc/50/41/00/547504100.db2.gz	FVZSRJCSSHXIOD-INIZCTEOSA-N	0	3	348.491	3.346	20	30		EGEDHN
C=C(C)[C@H](CC(=O)N1CCCN(Cc2ccccc2C)CC1)OCC	ZINC000677299299	549244452	/nfs/dbraw/zinc/24/44/52/549244452.db2.gz	FVIVTYLOBUXBQP-FQEVSTJZSA-N	0	3	344.499	3.401	20	30		EGEDHN
FC(F)(F)Oc1ccc(C#CCN2CCC3(CCOC3)CC2)cc1	ZINC000677719705	549317214	/nfs/dbraw/zinc/31/72/14/549317214.db2.gz	AYYJWNUBGJCZQE-UHFFFAOYSA-N	0	3	339.357	3.439	20	30		EGEDHN
C=CCN(CC=C)[C@@H](CNC(=O)N[C@H](C)c1cnccc1C)C(C)C	ZINC000678436189	549492125	/nfs/dbraw/zinc/49/21/25/549492125.db2.gz	MINHOQWRAYOKKS-MJGOQNOKSA-N	0	3	344.503	3.449	20	30		EGEDHN
CC#CCCNC(=O)c1ccccc1OCCN1CCCC[C@@H]1C	ZINC000680457237	549867161	/nfs/dbraw/zinc/86/71/61/549867161.db2.gz	QVTTTWONJNDIDU-KRWDZBQOSA-N	0	3	328.456	3.083	20	30		EGEDHN
N#Cc1ccc(NC(=S)NCCN2CCCCCC2)cc1Cl	ZINC000726457073	574556668	/nfs/dbraw/zinc/55/66/68/574556668.db2.gz	OIAKMQGTGOQDJF-UHFFFAOYSA-N	0	3	336.892	3.374	20	30		EGEDHN
C[NH+](C)[C@@H]1CCC[C@@H](/N=C\c2cc(Br)ccc2[O-])C1	ZINC000749843736	574649523	/nfs/dbraw/zinc/64/95/23/574649523.db2.gz	FXHGAVALVYWWKK-SRDPGZLCSA-N	0	3	325.250	3.446	20	30		EGEDHN
C[C@H](C#N)Oc1ccc(CNCc2ccnc(N3CCCC3)c2)cc1	ZINC000728711694	574768230	/nfs/dbraw/zinc/76/82/30/574768230.db2.gz	NWBHRLOSKCXIET-MRXNPFEDSA-N	0	3	336.439	3.262	20	30		EGEDHN
C[C@H]1CN(c2ccccc2C=NNCCCc2ccccc2)CCO1	ZINC000729146369	574818549	/nfs/dbraw/zinc/81/85/49/574818549.db2.gz	UDGRQDCMJDFHTR-SFHVURJKSA-N	0	3	337.467	3.468	20	30		EGEDHN
CCCCCCC[C@H](C)CNC(=O)NC[C@H]1CN2CCC[C@@H]2CO1	ZINC000729496530	574865995	/nfs/dbraw/zinc/86/59/95/574865995.db2.gz	BUIIVQJKIODGKG-KSZLIROESA-N	0	3	339.524	3.145	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)C[N@H+](Cc1ccccc1[O-])C1CCCC1	ZINC000732204722	575244440	/nfs/dbraw/zinc/24/44/40/575244440.db2.gz	QLUVTAJOAWTXST-INIZCTEOSA-N	0	3	343.471	3.145	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)C[N@@H+](Cc1ccccc1[O-])C1CCCC1	ZINC000732204722	575244442	/nfs/dbraw/zinc/24/44/42/575244442.db2.gz	QLUVTAJOAWTXST-INIZCTEOSA-N	0	3	343.471	3.145	20	30		EGEDHN
CN(C)CCOc1ccc(N(C)Cc2ccc(C#N)cc2F)cc1	ZINC000732410645	575268083	/nfs/dbraw/zinc/26/80/83/575268083.db2.gz	FYQNDNCCQYRPEU-UHFFFAOYSA-N	0	3	327.403	3.274	20	30		EGEDHN
Cc1cccc2[nH]c(C(C#N)C(=O)Cc3ccccc3[N+](=O)[O-])nc21	ZINC000735791641	575714257	/nfs/dbraw/zinc/71/42/57/575714257.db2.gz	ANTPZGLEBLVZFB-ZDUSSCGKSA-N	0	3	334.335	3.199	20	30		EGEDHN
C#CCCN1CCC(NC(=O)CCSc2ccc(C)c(C)c2)CC1	ZINC000740735824	576621443	/nfs/dbraw/zinc/62/14/43/576621443.db2.gz	QOUJPOONDKJHJT-UHFFFAOYSA-N	0	3	344.524	3.390	20	30		EGEDHN
C#CCOc1ccc(F)cc1NC(=O)N[C@H](C)CN1CCC[C@H](C)C1	ZINC000743201956	576803302	/nfs/dbraw/zinc/80/33/02/576803302.db2.gz	SPRPNHVAGRDZMN-LSDHHAIUSA-N	0	3	347.434	3.080	20	30		EGEDHN
C=CC[C@@H]([NH2+][C@@H](C)c1ccc(-c2nnn[n-]2)c(F)c1)c1ccncc1	ZINC000823888871	609143471	/nfs/dbraw/zinc/14/34/71/609143471.db2.gz	ZDVATLPVBSIOOG-YVEFUNNKSA-N	0	3	338.390	3.369	20	30		EGEDHN
C=C(Cl)CNC(=O)[C@H]1CN(Cc2ccccc2)CCC1(F)F	ZINC000796564283	1310035387	/nfs/dbraw/zinc/03/53/87/1310035387.db2.gz	SSQJFOKDZZFURA-CQSZACIVSA-N	0	3	328.790	3.013	20	30		EGEDHN
Cc1ccc(CN(CCN(C)C)C(=O)/C=C/c2ccccc2C#N)o1	ZINC000060407356	1291921720	/nfs/dbraw/zinc/92/17/20/1291921720.db2.gz	WBNDBYPDCBYKJZ-PKNBQFBNSA-N	0	3	337.423	3.063	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@@H](C)CCc1ccccc1F	ZINC000076819035	1292444021	/nfs/dbraw/zinc/44/40/21/1292444021.db2.gz	SZPMWPZZURGMNS-HOCLYGCPSA-N	0	3	332.419	3.410	20	30		EGEDHN
N#Cc1ccc(OCCCN[C@H](CCO)c2ccccc2F)cc1	ZINC000830350680	1292709797	/nfs/dbraw/zinc/70/97/97/1292709797.db2.gz	GGKFQVCANCBNLV-LJQANCHMSA-N	0	3	328.387	3.180	20	30		EGEDHN
N#CC(C(=O)COCC1CCCC1)C(=O)Nc1ccccc1Cl	ZINC000835062356	1293196862	/nfs/dbraw/zinc/19/68/62/1293196862.db2.gz	BJVDBWYPZUQQNT-ZDUSSCGKSA-N	0	3	334.803	3.194	20	30		EGEDHN
Cc1ccccc1[C@H](C)CC(=O)C(C#N)C(=O)NCCCOC(C)C	ZINC000116591929	1293207697	/nfs/dbraw/zinc/20/76/97/1293207697.db2.gz	XPTURKKOQIVGGM-SJLPKXTDSA-N	0	3	344.455	3.129	20	30		EGEDHN
CC[C@@H](NC(=O)C(C#N)C(=O)COCC1CCCC1)c1ccccc1	ZINC000835340981	1293268272	/nfs/dbraw/zinc/26/82/72/1293268272.db2.gz	QUZPYNFYYVHQIJ-QZTJIDSGSA-N	0	3	342.439	3.170	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)C(C#N)C(=O)Nc1ccc(F)c(Cl)c1	ZINC000119627677	1293280753	/nfs/dbraw/zinc/28/07/53/1293280753.db2.gz	AJRHPXKPWFCGPW-JQWIXIFHSA-N	0	3	338.766	3.108	20	30		EGEDHN
C#CCCCCNC(=O)NC[C@@H](c1ccc(C)cc1)N1CCCC1	ZINC000122469089	1293413263	/nfs/dbraw/zinc/41/32/63/1293413263.db2.gz	ZHJNYDAIDSVXGT-IBGZPJMESA-N	0	3	327.472	3.235	20	30		EGEDHN
N#CC(C(=O)CSc1ccc2ccccc2c1)C(=O)N1CCCC1	ZINC000124675568	1293481523	/nfs/dbraw/zinc/48/15/23/1293481523.db2.gz	NNLFJCQHBMJIQG-KRWDZBQOSA-N	0	3	338.432	3.263	20	30		EGEDHN
C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)C(C#N)C(=O)N1CCCC1	ZINC000124735719	1293484429	/nfs/dbraw/zinc/48/44/29/1293484429.db2.gz	BPHSFEGCUZQDCH-WMLDXEAASA-N	0	3	342.439	3.083	20	30		EGEDHN
Cc1cc2occ(CC(=O)C(C#N)C(=O)Nc3ccccn3)c2cc1C	ZINC000125121272	1293496546	/nfs/dbraw/zinc/49/65/46/1293496546.db2.gz	NOSSNIVBNYUMLW-INIZCTEOSA-N	0	3	347.374	3.335	20	30		EGEDHN
Cc1nccn1-c1ccc(CNC2CC(C#N)(c3ccccc3)C2)cn1	ZINC000126098644	1293524615	/nfs/dbraw/zinc/52/46/15/1293524615.db2.gz	HEHFDGHPWQSAMP-UHFFFAOYSA-N	0	3	343.434	3.289	20	30		EGEDHN
CN(CCOc1ccc(Cl)cc1)C[C@@H](O)c1ccc(C#N)cc1	ZINC000126641953	1293540814	/nfs/dbraw/zinc/54/08/14/1293540814.db2.gz	ZEMBDHLOOMJNHG-GOSISDBHSA-N	0	3	330.815	3.256	20	30		EGEDHN
Cc1cccc(NC(=O)C(C#N)C(=O)COc2ccc(C)c(C)c2)c1	ZINC000127494426	1293566035	/nfs/dbraw/zinc/56/60/35/1293566035.db2.gz	SNURNSCOCJEWFI-GOSISDBHSA-N	0	3	336.391	3.338	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)CCc1ccc(F)cc1F	ZINC000152183638	1293957855	/nfs/dbraw/zinc/95/78/55/1293957855.db2.gz	AOQMQKNUBPVKGK-HNNXBMFYSA-N	0	3	336.382	3.303	20	30		EGEDHN
CCCOc1ccc2c(c1)CCN(C[C@@H](O)c1ccc(C#N)cc1)C2	ZINC000153214924	1294003671	/nfs/dbraw/zinc/00/36/71/1294003671.db2.gz	PJJZUDTVWILVLI-OAQYLSRUSA-N	0	3	336.435	3.439	20	30		EGEDHN
C[C@H](C(=O)C(C#N)C(=O)NCc1ccccc1)c1c(F)cccc1F	ZINC000153272764	1294006180	/nfs/dbraw/zinc/00/61/80/1294006180.db2.gz	LXGNJLWSQKXDGM-JSGCOSHPSA-N	0	3	342.345	3.094	20	30		EGEDHN
C[C@H](CCOc1ccccc1)C(=O)C(C#N)C(=O)Nc1ccccc1	ZINC000173968244	1294474840	/nfs/dbraw/zinc/47/48/40/1294474840.db2.gz	YUBYLPYMXQYZDJ-CRAIPNDOSA-N	0	3	336.391	3.439	20	30		EGEDHN
CC(C)N1CCN(c2ccc(C(=O)O[C@@H]3CC[C@H](C#N)C3)cc2)CC1	ZINC000183714091	1295139229	/nfs/dbraw/zinc/13/92/29/1295139229.db2.gz	PNHHCKOKJIAFTD-QFBILLFUSA-N	0	3	341.455	3.066	20	30		EGEDHN
CC(C)CN(CCN(C)C)C(=O)Nc1ccccc1O[C@H](C)C#N	ZINC000184347504	1295191015	/nfs/dbraw/zinc/19/10/15/1295191015.db2.gz	JFSCCAUKFBZNFP-OAHLLOKOSA-N	0	3	332.448	3.029	20	30		EGEDHN
C=CCSc1nc2ccccc2n1CN1CC[C@H](OCCOC)C1	ZINC000188922044	1295487498	/nfs/dbraw/zinc/48/74/98/1295487498.db2.gz	DMXKBVSASVMKCA-HNNXBMFYSA-N	0	3	347.484	3.009	20	30		EGEDHN
Cc1cccc(CO[C@H](C)C(=O)C(C#N)C(=O)Nc2ccccc2)c1	ZINC000870136606	1295694538	/nfs/dbraw/zinc/69/45/38/1295694538.db2.gz	MAVFRSPOIPOOBU-CRAIPNDOSA-N	0	3	336.391	3.248	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@@H](C)Sc1ccc(OC)cc1	ZINC000193382743	1295859996	/nfs/dbraw/zinc/85/99/96/1295859996.db2.gz	AIERGJONNIXDRP-CJNGLKHVSA-N	0	3	348.468	3.191	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(Cl)cc1)C(=O)c1cccc([N+](=O)[O-])c1	ZINC000193398695	1295862588	/nfs/dbraw/zinc/86/25/88/1295862588.db2.gz	VGWICHSCYMLTLL-CQSZACIVSA-N	0	3	343.726	3.209	20	30		EGEDHN
CC[C@H](C)c1ccc(NC(=O)C(C#N)C(=O)C[C@@H]2CCCO2)cc1	ZINC000193492730	1295876958	/nfs/dbraw/zinc/87/69/58/1295876958.db2.gz	QZONXRVNYMZEGY-RRQGHBQHSA-N	0	3	328.412	3.417	20	30		EGEDHN
C[C@@H](NCc1ccc(OCC#N)cc1)c1ccc(-n2cncn2)cc1	ZINC000194889607	1296018208	/nfs/dbraw/zinc/01/82/08/1296018208.db2.gz	ZDPHCVSZHXHUMC-OAHLLOKOSA-N	0	3	333.395	3.020	20	30		EGEDHN
CC[C@H](Cc1cccc(C)c1)C(=O)C(C#N)C(=O)Nc1ccccn1	ZINC000873499090	1297544757	/nfs/dbraw/zinc/54/47/57/1297544757.db2.gz	KVVUSGTVQBMHEW-IAGOWNOFSA-N	0	3	335.407	3.306	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN2CCC(Oc3cccc(F)c3)CC2)cc1	ZINC000528575952	1297990266	/nfs/dbraw/zinc/99/02/66/1297990266.db2.gz	VYHLGUCMICSKPM-HXUWFJFHSA-N	0	3	340.398	3.274	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(C(F)(F)F)c(F)c2)CC1	ZINC000875846629	1298496498	/nfs/dbraw/zinc/49/64/98/1298496498.db2.gz	MDABOMWXNJXBGQ-UHFFFAOYSA-N	0	3	328.309	3.128	20	30		EGEDHN
C[C@@H]1CCN(C(=O)OC(C)(C)C)[C@@H](C)[C@@H]1NCc1cccc(C#N)n1	ZINC000877522817	1299365326	/nfs/dbraw/zinc/36/53/26/1299365326.db2.gz	GTQBAAQYODQZNH-JKIFEVAISA-N	0	3	344.459	3.077	20	30		EGEDHN
CN(C)[C@H]1Cc2ccccc2N(C(=O)c2ccc(Cl)c(C#N)c2)C1	ZINC000754263085	1300111789	/nfs/dbraw/zinc/11/17/89/1300111789.db2.gz	GXIZVPGJTBXUAL-INIZCTEOSA-N	0	3	339.826	3.345	20	30		EGEDHN
CC(CC1CC1)=NNC(=S)NC1CCN(Cc2ccccc2)CC1	ZINC000756823173	1300572528	/nfs/dbraw/zinc/57/25/28/1300572528.db2.gz	GYLQPYFKIQYSCJ-UHFFFAOYSA-N	0	3	344.528	3.291	20	30		EGEDHN
COc1ccccc1NC(=O)C(C#N)C(=O)c1cc(F)cc(Cl)c1	ZINC000757306663	1300664109	/nfs/dbraw/zinc/66/41/09/1300664109.db2.gz	SUHJXZMZILOPRQ-CYBMUJFWSA-N	0	3	346.745	3.449	20	30		EGEDHN
C[C@@H](C#N)Oc1ccc(CN[C@H]2CC(=O)N(C3CCCCC3)C2)cc1	ZINC000757925004	1300758040	/nfs/dbraw/zinc/75/80/40/1300758040.db2.gz	QHPDQDXFNRMFHY-RDJZCZTQSA-N	0	3	341.455	3.001	20	30		EGEDHN
C=CC[C@H](NC(=O)N(CCN(C)C)C1CCCC1)c1ccncc1	ZINC000758781509	1300954797	/nfs/dbraw/zinc/95/47/97/1300954797.db2.gz	XGOMUZZIHSHGGN-SFHVURJKSA-N	0	3	330.476	3.215	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)[C@H](C)c1cccc([N+](=O)[O-])c1	ZINC000763928161	1301983534	/nfs/dbraw/zinc/98/35/34/1301983534.db2.gz	BOACVQANVCMYKP-CZUORRHYSA-N	0	3	345.399	3.104	20	30		EGEDHN
C#CC[C@@H](CO)NCc1cccc(OCc2ccc(F)cc2F)c1	ZINC000883125944	1302262422	/nfs/dbraw/zinc/26/24/22/1302262422.db2.gz	ZTWAVIYUGXYTOE-KRWDZBQOSA-N	0	3	331.362	3.018	20	30		EGEDHN
C#CC[C@@H](CO)NCc1ccccc1OCc1ccc(F)cc1F	ZINC000883125680	1302262566	/nfs/dbraw/zinc/26/25/66/1302262566.db2.gz	QPIDDVNUYBBLGI-KRWDZBQOSA-N	0	3	331.362	3.018	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)CCc1cncc2ccccc21	ZINC000765589532	1302286619	/nfs/dbraw/zinc/28/66/19/1302286619.db2.gz	XXAOSULOMUXWBW-SFHVURJKSA-N	0	3	337.423	3.183	20	30		EGEDHN
COc1ccc(C(=O)C(C#N)c2nc3ccccc3[nH]2)nc1Cl	ZINC000766836734	1302528468	/nfs/dbraw/zinc/52/84/68/1302528468.db2.gz	CNTMERIVPNEUOW-SECBINFHSA-N	0	3	326.743	3.110	20	30		EGEDHN
Cc1cccc([C@@H](NC(=O)C2CC3(C2)CNC[C@H]3C#N)C(C)(C)C)c1	ZINC000884159689	1302758890	/nfs/dbraw/zinc/75/88/90/1302758890.db2.gz	KLWRLUQBPPSMIJ-BKVYSMKUSA-N	0	3	339.483	3.338	20	30		EGEDHN
C#C[C@H](CC)OC(=O)C1CCN(c2cc(Cl)ccc2Cl)C1=O	ZINC000768059819	1302814003	/nfs/dbraw/zinc/81/40/03/1302814003.db2.gz	AHXWENYTZCBLEO-NEPJUHHUSA-N	0	3	340.206	3.301	20	30		EGEDHN
CCC[N@H+](Cc1ccc(C#N)cc1)Cc1cc2c(cc1[O-])OC[C@@H]2O	ZINC000768439036	1302901257	/nfs/dbraw/zinc/90/12/57/1302901257.db2.gz	FKPCXXYIAQFYFS-IBGZPJMESA-N	0	3	338.407	3.102	20	30		EGEDHN
CCC[N@@H+](Cc1ccc(C#N)cc1)Cc1cc2c(cc1[O-])OC[C@@H]2O	ZINC000768439036	1302901267	/nfs/dbraw/zinc/90/12/67/1302901267.db2.gz	FKPCXXYIAQFYFS-IBGZPJMESA-N	0	3	338.407	3.102	20	30		EGEDHN
C#CCOc1ccc(CN2CCC[C@@H](CC(=O)OC(C)C)C2)cc1	ZINC000768529490	1302925359	/nfs/dbraw/zinc/92/53/59/1302925359.db2.gz	PGSIXGAMQJMDNK-SFHVURJKSA-N	0	3	329.440	3.252	20	30		EGEDHN
C=CCNC(=O)C(C#N)C(=O)CCCc1cccc(C(F)(F)F)c1	ZINC000770848124	1303321451	/nfs/dbraw/zinc/32/14/51/1303321451.db2.gz	RZMUCFAWURSNLU-CQSZACIVSA-N	0	3	338.329	3.039	20	30		EGEDHN
COc1cc(Cl)c(C)cc1NC(=O)C(C#N)C(=O)Cc1ccco1	ZINC000772645643	1303558300	/nfs/dbraw/zinc/55/83/00/1303558300.db2.gz	OAGCJGFZBLAEDP-GFCCVEGCSA-N	0	3	346.770	3.140	20	30		EGEDHN
C[C@@H](NCc1ccc(F)c(C#N)c1)c1ccc(N2CCOCC2)cc1	ZINC000775255416	1303931020	/nfs/dbraw/zinc/93/10/20/1303931020.db2.gz	OVNXFSBWCGXVMX-OAHLLOKOSA-N	0	3	339.414	3.385	20	30		EGEDHN
CCC[C@H](NCC(=O)NCCC#N)c1cccc(C(F)(F)F)c1	ZINC000775322880	1303939544	/nfs/dbraw/zinc/93/95/44/1303939544.db2.gz	BFTFCAWIBISAFV-AWEZNQCLSA-N	0	3	327.350	3.166	20	30		EGEDHN
C#C[C@H](N[C@@H](C)CC(=O)Nc1ccccc1C(C)C)[C@H]1CCCO1	ZINC000775572551	1303987471	/nfs/dbraw/zinc/98/74/71/1303987471.db2.gz	SEAHIYHYXGUTNN-VDZJLULYSA-N	0	3	328.456	3.298	20	30		EGEDHN
C#C[C@H](NCc1c(-c2ccccc2)nc2ccccn21)[C@@H]1CCCO1	ZINC000775791614	1304038708	/nfs/dbraw/zinc/03/87/08/1304038708.db2.gz	WGMXGYXEOUUMDS-HKUYNNGSSA-N	0	3	331.419	3.272	20	30		EGEDHN
C=CCN(Cc1ccc(OC)cc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000776277429	1304126787	/nfs/dbraw/zinc/12/67/87/1304126787.db2.gz	PHBMAHRNWINREP-IBGZPJMESA-N	0	3	342.395	3.325	20	30		EGEDHN
N#Cc1ccc(CN(C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C2CC2)cc1	ZINC000776580692	1304175235	/nfs/dbraw/zinc/17/52/35/1304175235.db2.gz	YXJXRSQCARXDCV-LJQANCHMSA-N	0	3	337.379	3.164	20	30		EGEDHN
CSc1cc(C(=O)C(C#N)C(=O)Nc2ccccc2Cl)ccn1	ZINC000779197000	1304540644	/nfs/dbraw/zinc/54/06/44/1304540644.db2.gz	KLMUCMBPAHFINI-NSHDSACASA-N	0	3	345.811	3.418	20	30		EGEDHN
C#CCCCCCC(=O)NC1CCN([C@H](C)c2ccncc2)CC1	ZINC000780659404	1304721795	/nfs/dbraw/zinc/72/17/95/1304721795.db2.gz	UHOAFWWSMNNUAB-QGZVFWFLSA-N	0	3	327.472	3.307	20	30		EGEDHN
C=CCC(CC=C)C(=O)NC[C@H](c1ccc(N(C)C)cc1)N(C)C	ZINC000891251951	1305000098	/nfs/dbraw/zinc/00/00/98/1305000098.db2.gz	IJZKOBJTJYTICQ-LJQANCHMSA-N	0	3	329.488	3.240	20	30		EGEDHN
C=CCS(=O)(=O)CCN[C@H](CC(C)(C)C)c1ccc(F)cc1	ZINC000783531638	1305104080	/nfs/dbraw/zinc/10/40/80/1305104080.db2.gz	JTSGZXQQHGTYOY-MRXNPFEDSA-N	0	3	327.465	3.493	20	30		EGEDHN
C[C@@H]1C[C@@H](C(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2Cl)CO1	ZINC000784491517	1305251408	/nfs/dbraw/zinc/25/14/08/1305251408.db2.gz	UFWCEQPIRBESRB-FXPVBKGRSA-N	0	3	341.194	3.066	20	30		EGEDHN
C#CCOCCOC(=O)c1cccc(CN(C)Cc2ccccc2)c1	ZINC000784892916	1305290630	/nfs/dbraw/zinc/29/06/30/1305290630.db2.gz	JGDQVDYMXCJIKI-UHFFFAOYSA-N	0	3	337.419	3.125	20	30		EGEDHN
N#CC(C(=O)CCCCc1ccccc1)C(=O)NCc1ccccc1	ZINC000892485278	1305399795	/nfs/dbraw/zinc/39/97/95/1305399795.db2.gz	WWEJAWZPFJCAGX-LJQANCHMSA-N	0	3	334.419	3.425	20	30		EGEDHN
Cc1ccc([C@H](C)C(=O)C(C#N)C(=O)NCc2cccc(Cl)c2)o1	ZINC000786530203	1305590352	/nfs/dbraw/zinc/59/03/52/1305590352.db2.gz	GDJWEYZUWZPVKI-WFASDCNBSA-N	0	3	344.798	3.370	20	30		EGEDHN
C[C@@H]1CC[C@@H](CCC(=O)C(C#N)C(=O)NCc2cccc(Cl)c2)O1	ZINC000786541860	1305594198	/nfs/dbraw/zinc/59/41/98/1305594198.db2.gz	WYLXVORVQRSCEM-UHOFOFEASA-N	0	3	348.830	3.013	20	30		EGEDHN
CC[C@H](NC(=O)C(C#N)C(=O)[C@@H](C)OCC(C)C)c1ccccc1	ZINC000787048049	1305684663	/nfs/dbraw/zinc/68/46/63/1305684663.db2.gz	YTLXJGGEAYLXEW-PVAVHDDUSA-N	0	3	330.428	3.024	20	30		EGEDHN
COc1ccc(C(C)=NOC[C@@H]2CCOC2)cc1CN1CCCCC1	ZINC000788037283	1305852745	/nfs/dbraw/zinc/85/27/45/1305852745.db2.gz	SYWZXILVVJHXCL-QGZVFWFLSA-N	0	3	346.471	3.458	20	30		EGEDHN
N#Cc1ccc(N2CCN(CCCc3ccc(Cl)cc3)CC2)cn1	ZINC000791047955	1308917715	/nfs/dbraw/zinc/91/77/15/1308917715.db2.gz	IUYNEXRIYDVOAM-UHFFFAOYSA-N	0	3	340.858	3.361	20	30		EGEDHN
C=CCNC(=O)C(C#N)C(=O)[C@H](C)Oc1ccc(-c2ccccc2)cc1	ZINC000793124364	1309299341	/nfs/dbraw/zinc/29/93/41/1309299341.db2.gz	LEXSRZWRMMHJMT-HNAYVOBHSA-N	0	3	348.402	3.132	20	30		EGEDHN
N#CCCn1cc(CN2CCC[C@H](CF)C2)c(-c2ccncc2)n1	ZINC000895546071	1309395219	/nfs/dbraw/zinc/39/52/19/1309395219.db2.gz	XNRTUAXONLWVLV-OAHLLOKOSA-N	0	3	327.407	3.040	20	30		EGEDHN
N#Cc1ccc2c(c1)CCCC[C@H]2NCC(=O)NCc1ccccc1	ZINC000795784261	1309833438	/nfs/dbraw/zinc/83/34/38/1309833438.db2.gz	MBORBQLGUVSRTL-HXUWFJFHSA-N	0	3	333.435	3.232	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(Cl)cc1)C(=O)[C@@H]1CCC(F)(F)C1	ZINC000796633740	1310052267	/nfs/dbraw/zinc/05/22/67/1310052267.db2.gz	RNIAPHLDIAUECH-BXKDBHETSA-N	0	3	326.730	3.423	20	30		EGEDHN
Cc1cc(C#N)ccc1CN1CCCC[C@@H]1COC(=O)NC(C)C	ZINC000796719367	1310073166	/nfs/dbraw/zinc/07/31/66/1310073166.db2.gz	ZWGPSMODZBELIC-GOSISDBHSA-N	0	3	329.444	3.356	20	30		EGEDHN
CCCCCNC(=O)C(C#N)C(=O)[C@@H](C)Cn1ccc2ccccc21	ZINC000796779974	1310086351	/nfs/dbraw/zinc/08/63/51/1310086351.db2.gz	QXZRPJJFOAXPRL-DOTOQJQBSA-N	0	3	339.439	3.293	20	30		EGEDHN
C#Cc1ccc(C(=O)NC2CCN([C@H](C)c3ccncc3)CC2)cc1	ZINC000897158277	1310202943	/nfs/dbraw/zinc/20/29/43/1310202943.db2.gz	YEDIAJOXSIDARD-MRXNPFEDSA-N	0	3	333.435	3.018	20	30		EGEDHN
CC(=O)N[C@@H](C(=O)C(C#N)c1ncc(C(C)(C)C)s1)C1CCCC1	ZINC000797567240	1310212158	/nfs/dbraw/zinc/21/21/58/1310212158.db2.gz	DZCVLGQRYWAGJF-UKRRQHHQSA-N	0	3	347.484	3.312	20	30		EGEDHN
C#CCCOc1ccc(CN[C@@]2(CO)CCCc3ccccc32)cc1	ZINC000799344613	1310531837	/nfs/dbraw/zinc/53/18/37/1310531837.db2.gz	DSHQBBFQSKJLCB-JOCHJYFZSA-N	0	3	335.447	3.402	20	30		EGEDHN
CCc1ccc([C@H](CNC(=O)c2ccc(C)c(C#N)c2)N(C)C)cc1	ZINC000799529086	1310568027	/nfs/dbraw/zinc/56/80/27/1310568027.db2.gz	OIGCQOMCVYHCBS-FQEVSTJZSA-N	0	3	335.451	3.462	20	30		EGEDHN
Cc1ncccc1CCNCc1cc(C#N)ccc1Br	ZINC000898250254	1310648229	/nfs/dbraw/zinc/64/82/29/1310648229.db2.gz	PEBPTRSGTWDSSO-UHFFFAOYSA-N	0	3	330.229	3.357	20	30		EGEDHN
COc1cccc(NC(=O)C(C#N)C(=O)[C@@H]2CCCC(F)(F)C2)c1	ZINC000800385089	1310746787	/nfs/dbraw/zinc/74/67/87/1310746787.db2.gz	RLIYIHXURMIGDV-BXUZGUMPSA-N	0	3	336.338	3.168	20	30		EGEDHN
C#CCN(C[C@H](O)COc1ccc(F)cc1)[C@@H]1CCc2ccccc21	ZINC000917116981	1319758437	/nfs/dbraw/zinc/75/84/37/1319758437.db2.gz	CQKJPGCPXYSVPJ-GHTZIAJQSA-N	0	3	339.410	3.188	20	30		EGEDHN
C#CCN1CCC[C@@H](CNC(=O)c2ccc(Cl)c(Cl)c2)C1	ZINC001023717511	1319853457	/nfs/dbraw/zinc/85/34/57/1319853457.db2.gz	HDRLLEAMBGJSKW-LBPRGKRZSA-N	0	3	325.239	3.068	20	30		EGEDHN
C#CCN1CCC[C@@H](CNC(=O)c2cc(Cl)cc(Cl)c2)C1	ZINC001023721026	1319858548	/nfs/dbraw/zinc/85/85/48/1319858548.db2.gz	ZOPWQHCKOXITOC-LBPRGKRZSA-N	0	3	325.239	3.068	20	30		EGEDHN
Cc1cccc(CN(CCN(C)C)C(=O)c2cc(C#N)ccc2F)c1	ZINC000826017558	1320378963	/nfs/dbraw/zinc/37/89/63/1320378963.db2.gz	TXGRDQIVTNPOLW-UHFFFAOYSA-N	0	3	339.414	3.210	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](N[C@@H]3CCc4c3cc(F)cc4F)C2)C1	ZINC001019353502	1317189385	/nfs/dbraw/zinc/18/93/85/1317189385.db2.gz	NWPJVMMKYCKCMP-KBXCAEBGSA-N	0	3	346.421	3.499	20	30		EGEDHN
CCN1CC[C@H](N(C)C(=O)/C=C/C(=O)c2ccc(C)cc2)C[C@H]1C	ZINC000900803595	1317342720	/nfs/dbraw/zinc/34/27/20/1317342720.db2.gz	ZVDSYHCUJFQKHV-LELNBSJKSA-N	0	3	328.456	3.065	20	30		EGEDHN
CCC(=O)N1CCC2(CCN(Cc3ccc(F)c(C#N)c3)CC2)CC1	ZINC000957481983	1317391703	/nfs/dbraw/zinc/39/17/03/1317391703.db2.gz	YWPJERPVVIKQDI-UHFFFAOYSA-N	0	3	343.446	3.312	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC2(CCN(Cc3cnc(C)o3)CC2)CC1	ZINC000957586864	1317479211	/nfs/dbraw/zinc/47/92/11/1317479211.db2.gz	XYNIQYTYGASVJD-UHFFFAOYSA-N	0	3	345.487	3.400	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc(F)c(C(F)F)c2)C1	ZINC001020162402	1317569490	/nfs/dbraw/zinc/56/94/90/1317569490.db2.gz	FIPWHMKKSOQHBZ-XYPYZODXSA-N	0	3	332.753	3.366	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N[C@H]1C[C@H](NCc2ccccc2Cl)C1	ZINC001020167822	1317571704	/nfs/dbraw/zinc/57/17/04/1317571704.db2.gz	HKHOCJMLWRWXNI-KONPQCLYSA-N	0	3	348.874	3.058	20	30		EGEDHN
C[C@@H]1[C@H](NC(=O)Cc2ccccc2CC#N)CCN1Cc1ccccc1	ZINC000807738863	1317581303	/nfs/dbraw/zinc/58/13/03/1317581303.db2.gz	HVBIFQHDTCMPSE-DYESRHJHSA-N	0	3	347.462	3.074	20	30		EGEDHN
CC(C)C[C@@H]1CN(C)CCN1Cn1ccc(-c2ccc(C#N)cc2)n1	ZINC000902543021	1317591483	/nfs/dbraw/zinc/59/14/83/1317591483.db2.gz	OLBGDKUNBQLSFN-LJQANCHMSA-N	0	3	337.471	3.041	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC(CN(CC)Cc2cc(C)ncn2)CC1	ZINC000957737494	1317601697	/nfs/dbraw/zinc/60/16/97/1317601697.db2.gz	KQRSMCQIATYPGT-UHFFFAOYSA-N	0	3	344.503	3.058	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@H](NC(=O)[C@@H]2CCC=CCCC2)C1	ZINC001020284918	1317625476	/nfs/dbraw/zinc/62/54/76/1317625476.db2.gz	INRLVIAAAULCOP-RBSFLKMASA-N	0	3	341.293	3.268	20	30		EGEDHN
CC[C@@H](N[C@H]1CCN(c2ccccc2OC)C1=O)c1cccc(C#N)c1	ZINC000902879433	1317626605	/nfs/dbraw/zinc/62/66/05/1317626605.db2.gz	VKNASSNPAQQELM-MSOLQXFVSA-N	0	3	349.434	3.413	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)cc1F)C1(NC(=O)OC(C)(C)C)CC1	ZINC000903091686	1317650766	/nfs/dbraw/zinc/65/07/66/1317650766.db2.gz	YPJCGYKPZSBVBP-GFCCVEGCSA-N	0	3	333.407	3.233	20	30		EGEDHN
CC(C)(C)OC(=O)N1CCC[C@H]1C[C@H](NCC1(C#N)CC1)C1CC1	ZINC000903106362	1317654533	/nfs/dbraw/zinc/65/45/33/1317654533.db2.gz	OKNNGBZURSPOHC-HOTGVXAUSA-N	0	3	333.476	3.448	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@H]2CC[C@H]2c2ccc(F)cc2)C1	ZINC001020428324	1317691878	/nfs/dbraw/zinc/69/18/78/1317691878.db2.gz	DQJXHUPMIYOJOF-QAETUUGQSA-N	0	3	336.838	3.309	20	30		EGEDHN
C[C@@H]1CCC[C@@]1(C)C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001020555775	1317769108	/nfs/dbraw/zinc/76/91/08/1317769108.db2.gz	RGWAZDZRVZWEDY-AEVYOOLXSA-N	0	3	343.446	3.260	20	30		EGEDHN
CC(C)C[C@@H]1C[C@H]1C(=O)N[C@H]1C[C@H](NCc2ccc(C#N)cc2F)C1	ZINC001020606665	1317796615	/nfs/dbraw/zinc/79/66/15/1317796615.db2.gz	ZDNITOYXMHORSD-BRSBDYLESA-N	0	3	343.446	3.116	20	30		EGEDHN
C[C@H](O)c1ncc(CNCCSCc2ccccc2C#N)s1	ZINC000809603460	1317840952	/nfs/dbraw/zinc/84/09/52/1317840952.db2.gz	POAQIRRJKVNNPO-LBPRGKRZSA-N	0	3	333.482	3.091	20	30		EGEDHN
C#CCOc1cccc(Cl)c1CN1CC[C@H](c2nccn2C)C1	ZINC000809755888	1317891887	/nfs/dbraw/zinc/89/18/87/1317891887.db2.gz	CZQIKLURWLPDIN-AWEZNQCLSA-N	0	3	329.831	3.075	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccccc2OCC(C)C)C1	ZINC001020767623	1317914842	/nfs/dbraw/zinc/91/48/42/1317914842.db2.gz	ONVKFWYCGNUNPH-SHTZXODSSA-N	0	3	336.863	3.324	20	30		EGEDHN
Cc1nn(Cc2ccc(C)cc2)c(C)c1/C=C1/C(=O)c2ncnn2C1C	ZINC000905079708	1317920375	/nfs/dbraw/zinc/92/03/75/1317920375.db2.gz	FOBQCDPKDVCERM-UPAIAECRSA-N	0	3	347.422	3.289	20	30		EGEDHN
CC1/C(=C/c2ccc(OCC(F)(F)F)c(F)c2)C(=O)c2ncnn21	ZINC000905087833	1317922173	/nfs/dbraw/zinc/92/21/73/1317922173.db2.gz	ZSZGGFSRTMMCET-HDPPJLHVSA-N	0	3	341.264	3.199	20	30		EGEDHN
N#Cc1ccc(OCCCN2CC3(CCC3)[C@H]2[C@@H]2CCCO2)cc1	ZINC000810091564	1317949177	/nfs/dbraw/zinc/94/91/77/1317949177.db2.gz	BATVDNSQMDIOPS-RBUKOAKNSA-N	0	3	326.440	3.361	20	30		EGEDHN
N#Cc1ccc(OCCCN2CC3(CCC3)[C@H]2[C@H]2CCCO2)cc1	ZINC000810091565	1317949470	/nfs/dbraw/zinc/94/94/70/1317949470.db2.gz	BATVDNSQMDIOPS-RTBURBONSA-N	0	3	326.440	3.361	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2ccc(O[C@@H](C)CC)cc2)C1	ZINC001020887239	1317985165	/nfs/dbraw/zinc/98/51/65/1317985165.db2.gz	KKNNWRCDBLVRCR-BPUTZDHNSA-N	0	3	336.863	3.467	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)[C@@H](C)c2ccc(Cl)s2)C1	ZINC001020900038	1317990135	/nfs/dbraw/zinc/99/01/35/1317990135.db2.gz	BNHMVBTXPZANII-DCAQKATOSA-N	0	3	333.284	3.494	20	30		EGEDHN
CC(C)=CC(=O)N1CCCC[C@H]1CNCc1ccc(C#N)cc1F	ZINC000959857969	1318230398	/nfs/dbraw/zinc/23/03/98/1318230398.db2.gz	AFQVQFCLMVODHB-KRWDZBQOSA-N	0	3	329.419	3.134	20	30		EGEDHN
CC(C)CC(=O)N1CCCC[C@H]1CNCc1ccc(C#N)cc1F	ZINC000959859752	1318231614	/nfs/dbraw/zinc/23/16/14/1318231614.db2.gz	KDJIFALQXOTECO-KRWDZBQOSA-N	0	3	331.435	3.214	20	30		EGEDHN
N#Cc1ccc(CNC[C@@H]2CCCCN2C(=O)CCC2CC2)s1	ZINC000959928553	1318269043	/nfs/dbraw/zinc/26/90/43/1318269043.db2.gz	BTXZFJQGUPLWPH-HNNXBMFYSA-N	0	3	331.485	3.281	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@H](CCCN3C(=O)CC3CC3)C2)c1	ZINC001021497631	1318303647	/nfs/dbraw/zinc/30/36/47/1318303647.db2.gz	ZIKMQBDLFSKUPO-WOJBJXKFSA-N	0	3	337.467	3.171	20	30		EGEDHN
CC1(CC(=O)N2CCCC[C@H]2CNCc2ccc(C#N)c(F)c2)CC1	ZINC000960063076	1318337108	/nfs/dbraw/zinc/33/71/08/1318337108.db2.gz	BGCRPUAAVXVGEZ-KRWDZBQOSA-N	0	3	343.446	3.358	20	30		EGEDHN
CC1(CC(=O)N2CCCC[C@H]2CNCc2ccc(C#N)s2)CC1	ZINC000960067282	1318338843	/nfs/dbraw/zinc/33/88/43/1318338843.db2.gz	PWPAXJKTLLFIPR-AWEZNQCLSA-N	0	3	331.485	3.281	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@@H](CCCN3C(=O)c3ccoc3)C2)cc1	ZINC001021520371	1318346459	/nfs/dbraw/zinc/34/64/59/1318346459.db2.gz	WIVQKYQKMRKWAD-ICSRJNTNSA-N	0	3	349.434	3.278	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@@H](CCCN3C(=O)C3=CCCC3)C2)c1	ZINC001021564222	1318414638	/nfs/dbraw/zinc/41/46/38/1318414638.db2.gz	XOHYOUXMQVIXHE-LEWJYISDSA-N	0	3	349.478	3.481	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC[C@@H]2CN(Cc3ccc(F)cc3)CC[C@H]21	ZINC001021582708	1318427591	/nfs/dbraw/zinc/42/75/91/1318427591.db2.gz	YRNYVZJOHZZVFV-UYAOXDASSA-N	0	3	340.442	3.052	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1coc(C(C)(C)C)n1	ZINC000960263460	1318435052	/nfs/dbraw/zinc/43/50/52/1318435052.db2.gz	XQPLKGPPRZQXGZ-NVXWUHKLSA-N	0	3	339.439	3.144	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)Cc1cccc(CC)c1	ZINC000960279708	1318442472	/nfs/dbraw/zinc/44/24/72/1318442472.db2.gz	XZWMJSIRZZAKAY-IFMALSPDSA-N	0	3	334.463	3.349	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc(C)c(C)n1	ZINC000960287480	1318445965	/nfs/dbraw/zinc/44/59/65/1318445965.db2.gz	JMCZZGYQWKRAIP-WOJBJXKFSA-N	0	3	335.451	3.260	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)[C@@H]1CCCC(F)(F)C1	ZINC000960306155	1318453183	/nfs/dbraw/zinc/45/31/83/1318453183.db2.gz	IBVRAJJVJOWVDT-DJIMGWMZSA-N	0	3	334.410	3.370	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc2scnc2c1	ZINC000960319081	1318458973	/nfs/dbraw/zinc/45/89/73/1318458973.db2.gz	XCZUULGIBYILGU-IEBWSBKVSA-N	0	3	349.459	3.468	20	30		EGEDHN
C=CCN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1ccc2ccncc2c1	ZINC000960317612	1318459131	/nfs/dbraw/zinc/45/91/31/1318459131.db2.gz	CAMDOIBSGZBLCI-NHCUHLMSSA-N	0	3	343.430	3.406	20	30		EGEDHN
C=C(C)CN[C@@H]1c2ccccc2C[C@H]1NC(=O)c1cnn(C(C)C)c1	ZINC000960322837	1318461586	/nfs/dbraw/zinc/46/15/86/1318461586.db2.gz	CSAPNKUUYNSUND-RTBURBONSA-N	0	3	338.455	3.026	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(Cl)cc2F)C1	ZINC001021627624	1318480565	/nfs/dbraw/zinc/48/05/65/1318480565.db2.gz	OMCRZGBQQMKGCR-CXAGYDPISA-N	0	3	334.822	3.039	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2c[nH]c3ccccc23)C1	ZINC001021628765	1318482350	/nfs/dbraw/zinc/48/23/50/1318482350.db2.gz	XRUMTYHGEHDQHZ-JXFKEZNVSA-N	0	3	335.451	3.118	20	30		EGEDHN
COC[C@H](C)[C@H](C)C(=O)C(C#N)C(=O)Nc1cccc2ccccc21	ZINC000813059519	1318492738	/nfs/dbraw/zinc/49/27/38/1318492738.db2.gz	BBYNRRHVPNNEKK-ZQIUZPCESA-N	0	3	338.407	3.406	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)CCc2ccc(C)cc2C)C1	ZINC001021641923	1318500055	/nfs/dbraw/zinc/50/00/55/1318500055.db2.gz	MVWICPJKNQZWEE-NHCUHLMSSA-N	0	3	338.495	3.182	20	30		EGEDHN
CC(COC(=O)c1cccc(Nc2ccc(C#N)cc2)c1)[N+](=O)[O-]	ZINC000813106468	1318500429	/nfs/dbraw/zinc/50/04/29/1318500429.db2.gz	CNMDIOFIDVZNCZ-GFCCVEGCSA-N	0	3	325.324	3.124	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)CCc2cccc(C)c2)C1	ZINC001021641668	1318500385	/nfs/dbraw/zinc/50/03/85/1318500385.db2.gz	KBTNBODHJNCUKD-LEWJYISDSA-N	0	3	338.495	3.264	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(-c3ccco3)on2)C1	ZINC001021645795	1318504701	/nfs/dbraw/zinc/50/47/01/1318504701.db2.gz	MWBBCQCUCAPNRS-HOCLYGCPSA-N	0	3	341.411	3.047	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)c1ccccc1	ZINC000960382696	1318511837	/nfs/dbraw/zinc/51/18/37/1318511837.db2.gz	IZKJNQHVJRSYPZ-FQEVSTJZSA-N	0	3	333.435	3.295	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)Cc2c(C)cc(C)cc2C)C1	ZINC001021663801	1318526245	/nfs/dbraw/zinc/52/62/45/1318526245.db2.gz	DYKRLJHPWPEKAW-FPOVZHCZSA-N	0	3	338.495	3.100	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(C)c(Cl)c2)C1	ZINC001021666518	1318528798	/nfs/dbraw/zinc/52/87/98/1318528798.db2.gz	UWRMYERZTHLIDF-SJLPKXTDSA-N	0	3	330.859	3.208	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc3occc3s2)C1	ZINC001021667061	1318528872	/nfs/dbraw/zinc/52/88/72/1318528872.db2.gz	FSUHUDUBSJQOQX-LSDHHAIUSA-N	0	3	342.464	3.444	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2csc(C(C)C)n2)C1	ZINC001021692645	1318565999	/nfs/dbraw/zinc/56/59/99/1318565999.db2.gz	VQAGQUJVAKSUKR-RDJZCZTQSA-N	0	3	345.512	3.216	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2cccc3ccncc32)C1	ZINC001021705451	1318576989	/nfs/dbraw/zinc/57/69/89/1318576989.db2.gz	DDSOVPQYTBIOSU-NQIIRXRSSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2[nH]ccc2-c2ccccc2)C1	ZINC001021712862	1318590027	/nfs/dbraw/zinc/59/00/27/1318590027.db2.gz	LEHJRFGOAFPMGZ-AZUAARDMSA-N	0	3	347.462	3.241	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2cccc(C(F)F)c2)C1	ZINC001021716673	1318597072	/nfs/dbraw/zinc/59/70/72/1318597072.db2.gz	FOYNNIUWYZRAAF-DLBZAZTESA-N	0	3	332.394	3.184	20	30		EGEDHN
C[C@@H](C(=O)N1CCC[C@H]1CN(C)Cc1cccc(C#N)c1)C1CC1	ZINC000960522348	1318633491	/nfs/dbraw/zinc/63/34/91/1318633491.db2.gz	VPYKXNMHCODKQY-BEFAXECRSA-N	0	3	325.456	3.027	20	30		EGEDHN
C[C@H](C(=O)N1CCC[C@H]1CN(C)Cc1cccc(C#N)c1)C1CC1	ZINC000960522353	1318633746	/nfs/dbraw/zinc/63/37/46/1318633746.db2.gz	VPYKXNMHCODKQY-KXBFYZLASA-N	0	3	325.456	3.027	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)CCc2ccc(CC)cc2)C1	ZINC001021733292	1318637249	/nfs/dbraw/zinc/63/72/49/1318637249.db2.gz	LOHKNPNYHFKVPZ-LEWJYISDSA-N	0	3	338.495	3.128	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCN1C(=O)CC1CCC1	ZINC000960526803	1318642437	/nfs/dbraw/zinc/64/24/37/1318642437.db2.gz	KYYGJWSWYSGVDB-IBGZPJMESA-N	0	3	325.456	3.171	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2c[nH]c3ccc(C)cc23)C1	ZINC001021738678	1318646651	/nfs/dbraw/zinc/64/66/51/1318646651.db2.gz	CPHFIVPBHYHLOQ-UWJYYQICSA-N	0	3	349.478	3.426	20	30		EGEDHN
C#CCN1CC[C@H]2[C@H](CCCN2C(=O)c2c[nH]c3ccc(C)cc32)C1	ZINC001021740976	1318650038	/nfs/dbraw/zinc/65/00/38/1318650038.db2.gz	XTNIJJBWOFPWFQ-UZLBHIALSA-N	0	3	335.451	3.036	20	30		EGEDHN
C#CCN1CC[C@H]2[C@@H](CCCN2C(=O)c2ccc(C)c3c2CCC3)C1	ZINC001021742057	1318655885	/nfs/dbraw/zinc/65/58/85/1318655885.db2.gz	BNRIUXVUTZPNGF-UWJYYQICSA-N	0	3	336.479	3.043	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H](CCCN2C(=O)c2ccc(CC)c(CC)c2)C1	ZINC001021746216	1318662254	/nfs/dbraw/zinc/66/22/54/1318662254.db2.gz	JSCOMPHBGGAXLO-LEWJYISDSA-N	0	3	338.495	3.371	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@H](CCCN2C(=O)c2ccc(-c3ccccc3)[nH]2)C1	ZINC001021746413	1318663233	/nfs/dbraw/zinc/66/32/33/1318663233.db2.gz	LGOANPABEZEJOI-WIYYLYMNSA-N	0	3	347.462	3.241	20	30		EGEDHN
C[C@H](c1ccc(F)c(F)c1)N(C)C[C@@H]1CCCN1C(=O)C#CC1CC1	ZINC000960614321	1318741579	/nfs/dbraw/zinc/74/15/79/1318741579.db2.gz	QLVMTDGTKMQPSA-PBHICJAKSA-N	0	3	346.421	3.362	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)N[C@H]1C[C@@H](NCc2ccccc2Cl)C1	ZINC001022099274	1318795789	/nfs/dbraw/zinc/79/57/89/1318795789.db2.gz	HKHOCJMLWRWXNI-HPFXQQBRSA-N	0	3	348.874	3.058	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N1CCc2cc(OCC)c(OCC)cc2C1	ZINC000912115617	1318819581	/nfs/dbraw/zinc/81/95/81/1318819581.db2.gz	GYYUCZHJQPKCKY-QGZVFWFLSA-N	0	3	346.471	3.052	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N1CCC[C@@H]1c1ccc(OC)c(OC)c1	ZINC000912197116	1318845747	/nfs/dbraw/zinc/84/57/47/1318845747.db2.gz	PFULFSPXFLEHQA-HZPDHXFCSA-N	0	3	332.444	3.051	20	30		EGEDHN
CCCCCCCC[C@H](N)C(=O)Nc1ccc(Cl)c(C(N)=O)c1	ZINC000912301401	1318865466	/nfs/dbraw/zinc/86/54/66/1318865466.db2.gz	RUFRCMRFXBJGTA-HNNXBMFYSA-N	0	3	339.867	3.455	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)Nc1nc(-c2ccccc2OC)cs1	ZINC000912316203	1318866520	/nfs/dbraw/zinc/86/65/20/1318866520.db2.gz	PXRFPVISLWDXTJ-ZDUSSCGKSA-N	0	3	331.441	3.441	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)[C@H]2CCC=CCCC2)C1	ZINC001022271811	1318869392	/nfs/dbraw/zinc/86/93/92/1318869392.db2.gz	INRLVIAAAULCOP-SOUVJXGZSA-N	0	3	341.293	3.268	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2cccc(-n3cccc3)c2)C1	ZINC001022381673	1318914960	/nfs/dbraw/zinc/91/49/60/1318914960.db2.gz	RCUXIVRZABJDHN-IYBDPMFKSA-N	0	3	329.831	3.080	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccc(C)c3cccnc23)C1	ZINC001022449326	1318946920	/nfs/dbraw/zinc/94/69/20/1318946920.db2.gz	PXUMYDXBGKWXBB-OKILXGFUSA-N	0	3	329.831	3.146	20	30		EGEDHN
CC1(C(=O)N[C@H]2C[C@@H](NCc3cc(C#N)ccc3F)C2)CCCC1	ZINC001022508152	1318970424	/nfs/dbraw/zinc/97/04/24/1318970424.db2.gz	KVBSCJGYQXFVII-IYBDPMFKSA-N	0	3	329.419	3.014	20	30		EGEDHN
CC1(C)CC(CC(=O)N[C@H]2C[C@@H](NCc3cc(C#N)ccc3F)C2)C1	ZINC001022590857	1319006105	/nfs/dbraw/zinc/00/61/05/1319006105.db2.gz	LQRSICSDYIEIGZ-CALCHBBNSA-N	0	3	343.446	3.260	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](NC(=O)c2c(C)cccc2C)C1	ZINC001022752856	1319086413	/nfs/dbraw/zinc/08/64/13/1319086413.db2.gz	FCOHVAXFXKVPLB-OKILXGFUSA-N	0	3	337.261	3.062	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](NC(=O)c2ccccc2O[C@@H](C)CC)C1	ZINC001022784751	1319110184	/nfs/dbraw/zinc/11/01/84/1319110184.db2.gz	MJGUGFFLIPNPHZ-SOUVJXGZSA-N	0	3	336.863	3.467	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H](CNC(=O)c3cccs3)C2)cc1	ZINC001023213267	1319348836	/nfs/dbraw/zinc/34/88/36/1319348836.db2.gz	DRKHNCFVBUQISB-QGZVFWFLSA-N	0	3	339.464	3.262	20	30		EGEDHN
Cc1occc1C(=O)NC[C@H]1CCCN(Cc2cccc(C#N)c2)C1	ZINC001023221207	1319358806	/nfs/dbraw/zinc/35/88/06/1319358806.db2.gz	IXDCNVXOGVRMKX-GOSISDBHSA-N	0	3	337.423	3.102	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H](CNC(=O)[C@H]3CC=CCC3)C2)cc1	ZINC001023229648	1319367695	/nfs/dbraw/zinc/36/76/95/1319367695.db2.gz	MBMBJBLJWGCYEV-PMACEKPBSA-N	0	3	337.467	3.243	20	30		EGEDHN
N#Cc1c[nH]c(C(=O)NC[C@H]2CCCN(C/C=C/c3ccccc3)C2)c1	ZINC001023296500	1319423857	/nfs/dbraw/zinc/42/38/57/1319423857.db2.gz	YQRGLZBSPDNOGI-SBLNNXNXSA-N	0	3	348.450	3.042	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)[C@@H]2C[C@H]2c2sccc2C)C1	ZINC001023368707	1319482902	/nfs/dbraw/zinc/48/29/02/1319482902.db2.gz	UKSNYNGBNSOQDM-GVDBMIGSSA-N	0	3	330.497	3.012	20	30		EGEDHN
C=C(Cl)CN1CCC[C@@H](C2CCN(C(=O)[C@@H]3CC3(F)F)CC2)C1	ZINC000961358408	1319515673	/nfs/dbraw/zinc/51/56/73/1319515673.db2.gz	FVWYLOCCGOREDW-CABCVRRESA-N	0	3	346.849	3.345	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2cc(F)cc3ccoc32)C1	ZINC001023451034	1319553296	/nfs/dbraw/zinc/55/32/96/1319553296.db2.gz	CZQWHNRBGHFVJJ-AWEZNQCLSA-N	0	3	328.387	3.037	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)[C@@H]2CC[C@@H](c3ccccc3)C2)C1	ZINC001023452104	1319556302	/nfs/dbraw/zinc/55/63/02/1319556302.db2.gz	XDXHEHIKIIPWHM-CEWLAPEOSA-N	0	3	338.495	3.422	20	30		EGEDHN
C#CCN(C)CCCNC(=O)c1cc2ccccc2cc1OC(F)F	ZINC000818609472	1319570214	/nfs/dbraw/zinc/57/02/14/1319570214.db2.gz	YZCUQKMAXCWNAZ-UHFFFAOYSA-N	0	3	346.377	3.126	20	30		EGEDHN
N#Cc1ccc([C@H](O)CN[C@@H]2CCCOc3cc(F)ccc32)cc1	ZINC000819210793	1319669703	/nfs/dbraw/zinc/66/97/03/1319669703.db2.gz	LIDKZEUBDQAISV-QZTJIDSGSA-N	0	3	326.371	3.234	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CCCN(Cc3cccnc3)C2)CC1	ZINC001023573122	1319691300	/nfs/dbraw/zinc/69/13/00/1319691300.db2.gz	STXSIQDGZCURQH-GOSISDBHSA-N	0	3	327.472	3.156	20	30		EGEDHN
CCCCCCNC(=O)C(C#N)C(=O)COc1c(C)cc(C)cc1C	ZINC000916873648	1319717075	/nfs/dbraw/zinc/71/70/75/1319717075.db2.gz	YHIMOMDKMZPODY-KRWDZBQOSA-N	0	3	344.455	3.396	20	30		EGEDHN
Cc1ccc(OCC(=O)C(C#N)C(=O)Nc2ccc(Cl)cc2)cc1	ZINC000916884025	1319719800	/nfs/dbraw/zinc/71/98/00/1319719800.db2.gz	YKFPHCYXIHZPPO-INIZCTEOSA-N	0	3	342.782	3.375	20	30		EGEDHN
N#CC(C(=O)NC1CCCCC1)C(=O)[C@H]1C[C@H]1c1ccc(F)cc1	ZINC000916894918	1319721185	/nfs/dbraw/zinc/72/11/85/1319721185.db2.gz	CJHBHPBAKQDTIQ-ULQDDVLXSA-N	0	3	328.387	3.087	20	30		EGEDHN
CCc1cccc(OCC(=O)C(C#N)C(=O)Nc2cccc(C)c2)c1	ZINC000916897831	1319721908	/nfs/dbraw/zinc/72/19/08/1319721908.db2.gz	OYEFBZGSXOARLU-GOSISDBHSA-N	0	3	336.391	3.284	20	30		EGEDHN
C=CCNC(=O)C(C#N)C(=O)CCCSc1ccc(Cl)cc1	ZINC000916919936	1319725230	/nfs/dbraw/zinc/72/52/30/1319725230.db2.gz	DJSYPDLPWYIDHI-AWEZNQCLSA-N	0	3	336.844	3.223	20	30		EGEDHN
CC(C)NC(=O)C(C#N)C(=O)Cc1coc2ccc3ccccc3c12	ZINC000916946697	1319727438	/nfs/dbraw/zinc/72/74/38/1319727438.db2.gz	GLGOXRKQLRGSFN-MRXNPFEDSA-N	0	3	334.375	3.362	20	30		EGEDHN
C#CCN1CCC[C@H](CNC(=O)c2cccc(Cl)c2Cl)C1	ZINC001023717019	1319849861	/nfs/dbraw/zinc/84/98/61/1319849861.db2.gz	AEKAVJUFAKOBFH-GFCCVEGCSA-N	0	3	325.239	3.068	20	30		EGEDHN
C#CCN1CCC[C@H](CNC(=O)c2ccc(-c3ccccc3)cc2)C1	ZINC001023727298	1319864227	/nfs/dbraw/zinc/86/42/27/1319864227.db2.gz	FMYPKZCUQGVVJS-GOSISDBHSA-N	0	3	332.447	3.429	20	30		EGEDHN
CC#CCN1CCC[C@@H](CNC(=O)c2csc3c2CC[C@H](C)C3)C1	ZINC001023734189	1319876414	/nfs/dbraw/zinc/87/64/14/1319876414.db2.gz	XOZMAOAXXDNJQT-HOTGVXAUSA-N	0	3	344.524	3.338	20	30		EGEDHN
Cc1ccc(C(=O)N2CCC[C@H](CNCc3ccccc3C#N)C2)o1	ZINC001023824728	1319970285	/nfs/dbraw/zinc/97/02/85/1319970285.db2.gz	JPSXDPSFOOYMJA-MRXNPFEDSA-N	0	3	337.423	3.102	20	30		EGEDHN
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)c1ccc(CF)cc1	ZINC000822475518	1320086742	/nfs/dbraw/zinc/08/67/42/1320086742.db2.gz	HUEJXTOWFSJHJB-UHFFFAOYSA-N	0	3	339.414	3.232	20	30		EGEDHN
Cc1ccc(C#N)cc1C(=O)N[C@H]1CCN([C@@H](C)c2ccccc2)C1	ZINC000930508132	1328881080	/nfs/dbraw/zinc/88/10/80/1328881080.db2.gz	NVCOUYRROYJYNS-LPHOPBHVSA-N	0	3	333.435	3.432	20	30		EGEDHN
C#CCOc1ccc(CNCc2c(C)nc3sc(C)cn23)cc1	ZINC000824926745	1320296550	/nfs/dbraw/zinc/29/65/50/1320296550.db2.gz	RIQJCPIUENLHJH-UHFFFAOYSA-N	0	3	325.437	3.314	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C1(CNC(=O)OC(C)(C)C)CCC1	ZINC000824932723	1320297846	/nfs/dbraw/zinc/29/78/46/1320297846.db2.gz	VQWZRXBTEWBUCW-UHFFFAOYSA-N	0	3	329.444	3.437	20	30		EGEDHN
C=CCC[C@@H](CO)[NH2+]Cc1ccc(OCc2ccccc2)cc1[O-]	ZINC000825168111	1320316038	/nfs/dbraw/zinc/31/60/38/1320316038.db2.gz	DOUAJHZVIXNZTQ-SFHVURJKSA-N	0	3	327.424	3.388	20	30		EGEDHN
CC(C)OCCOC1CCN(Cc2ccc(O[C@H](C)C#N)cc2)CC1	ZINC000825207117	1320317812	/nfs/dbraw/zinc/31/78/12/1320317812.db2.gz	DTEZYRITBYWKEB-QGZVFWFLSA-N	0	3	346.471	3.383	20	30		EGEDHN
CN(C)CCN(CCCc1ccccc1)C(=O)C#Cc1cccs1	ZINC000825461343	1320340939	/nfs/dbraw/zinc/34/09/39/1320340939.db2.gz	UADXKJSJPFAFIS-UHFFFAOYSA-N	0	3	340.492	3.123	20	30		EGEDHN
CC(C)Oc1ccc([C@@H](CNC(=O)C#CC(C)(C)C)N(C)C)cc1	ZINC000837653934	1320660990	/nfs/dbraw/zinc/66/09/90/1320660990.db2.gz	PBMJRAAGFVAMNC-GOSISDBHSA-N	0	3	330.472	3.242	20	30		EGEDHN
CCCCCCCOc1ccc(CN2CC[C@H](O)[C@@H](CO)C2)cc1	ZINC000840976969	1321192110	/nfs/dbraw/zinc/19/21/10/1321192110.db2.gz	ZWJHQIICEMWRAL-QUCCMNQESA-N	0	3	335.488	3.211	20	30		EGEDHN
C(=NOCCOCC1CCCC1)c1ccc(N2CCOCC2)cc1	ZINC000842017599	1321335265	/nfs/dbraw/zinc/33/52/65/1321335265.db2.gz	PKZYSXPKYZPZMU-UHFFFAOYSA-N	0	3	332.444	3.081	20	30		EGEDHN
CC[C@@H](OC1CCCC1)C(=O)C(C#N)C(=O)Nc1cccc(C)c1	ZINC000842289700	1321368144	/nfs/dbraw/zinc/36/81/44/1321368144.db2.gz	SCUQLQNGUNZOTP-DLBZAZTESA-N	0	3	328.412	3.380	20	30		EGEDHN
CC[C@H](OC1CCCC1)C(=O)C(C#N)C(=O)Nc1ccccc1OC	ZINC000842289535	1321368297	/nfs/dbraw/zinc/36/82/97/1321368297.db2.gz	QROKRELVTKJGAE-ZBFHGGJFSA-N	0	3	344.411	3.080	20	30		EGEDHN
Cc1ncsc1CCC(=O)C(C#N)C(=O)Nc1ccccc1Cl	ZINC000842290655	1321368354	/nfs/dbraw/zinc/36/83/54/1321368354.db2.gz	NHAIBBOHEJWVKK-NSHDSACASA-N	0	3	347.827	3.385	20	30		EGEDHN
C=C(C)CN1CCC(NC(=O)c2cccc([N+](=O)[O-])c2Cl)CC1	ZINC000859250921	1328954830	/nfs/dbraw/zinc/95/48/30/1328954830.db2.gz	RBKILVNTOJLZDU-UHFFFAOYSA-N	0	3	337.807	3.019	20	30		EGEDHN
C[C@H](C#N)Oc1ccccc1NC(=O)NC[C@H]1CCCCN1C1CC1	ZINC000930760832	1328960647	/nfs/dbraw/zinc/96/06/47/1328960647.db2.gz	LFZUFVXELRGPGF-GDBMZVCRSA-N	0	3	342.443	3.116	20	30		EGEDHN
C#Cc1cccc(N(C)C(=O)C(C[C@H]2CCCO2)C(F)(F)F)c1	ZINC000844375919	1321595685	/nfs/dbraw/zinc/59/56/85/1321595685.db2.gz	NVBUFEJUVWJZGS-CABCVRRESA-N	0	3	325.330	3.378	20	30		EGEDHN
C=CCCOCC(=O)C(C#N)C(=O)Nc1c(CC)cccc1CC	ZINC000920789791	1322222985	/nfs/dbraw/zinc/22/29/85/1322222985.db2.gz	FHWLLPBGQUBVOY-MRXNPFEDSA-N	0	3	328.412	3.051	20	30		EGEDHN
CC[C@H](C(=O)C(C#N)c1nc(C)cs1)N(C)C(=O)OC(C)(C)C	ZINC000850736852	1322281694	/nfs/dbraw/zinc/28/16/94/1322281694.db2.gz	NVCRGRFSXHJJFO-NWDGAFQWSA-N	0	3	337.445	3.273	20	30		EGEDHN
C#CCN1CCC(C(=O)Nc2ccc(Cl)c3ncccc23)CC1	ZINC000921307336	1322289875	/nfs/dbraw/zinc/28/98/75/1322289875.db2.gz	GRDYLLLGCOLYAZ-UHFFFAOYSA-N	0	3	327.815	3.172	20	30		EGEDHN
CC(C)(C)OC(=O)C1(C(=O)C(C#N)c2ccncn2)CCCCCC1	ZINC000850948589	1322314331	/nfs/dbraw/zinc/31/43/31/1322314331.db2.gz	ULPPRQBDSGODDJ-AWEZNQCLSA-N	0	3	343.427	3.335	20	30		EGEDHN
CC[C@@H](C)[C@@](C)(O)CNCc1cc(C#N)ccc1Br	ZINC000921732519	1322386277	/nfs/dbraw/zinc/38/62/77/1322386277.db2.gz	LCHHSYLOXUDJHV-ABAIWWIYSA-N	0	3	325.250	3.207	20	30		EGEDHN
CC(C)(CO)CCCNCc1cc(C#N)ccc1Br	ZINC000921773102	1322396190	/nfs/dbraw/zinc/39/61/90/1322396190.db2.gz	OSFCAXFMNQHPMC-UHFFFAOYSA-N	0	3	325.250	3.209	20	30		EGEDHN
CCN(CC)C(=O)[C@@H](Cc1ccccc1)N[C@@H](C)CC(C)(C)C#N	ZINC000924530822	1323043880	/nfs/dbraw/zinc/04/38/80/1323043880.db2.gz	BVFJORHNOZWJKP-FUHWJXTLSA-N	0	3	329.488	3.384	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@H](CNCc2nc3ccccc3o2)C1	ZINC001024095139	1323126720	/nfs/dbraw/zinc/12/67/20/1323126720.db2.gz	RDNGRNMSWMUASV-OAHLLOKOSA-N	0	3	341.455	3.368	20	30		EGEDHN
C#C[C@](C)(CC)NCc1cc(=O)oc2cc(NC(=O)OCC)ccc12	ZINC000852101165	1323147958	/nfs/dbraw/zinc/14/79/58/1323147958.db2.gz	NIQZYIBTPSXCOW-LJQANCHMSA-N	0	3	342.395	3.253	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CCC[C@H](CNCc2oc(CC)nc2C)C1	ZINC001024137969	1323163154	/nfs/dbraw/zinc/16/31/54/1323163154.db2.gz	WTCPMHSLZDLIEC-UZLBHIALSA-N	0	3	347.503	3.476	20	30		EGEDHN
Cc1cc(=O)oc2cc(OCCN3CCC[C@@H](CC#N)C3)ccc12	ZINC000852319501	1323178535	/nfs/dbraw/zinc/17/85/35/1323178535.db2.gz	NVAZGOVMQVSLFP-HNNXBMFYSA-N	0	3	326.396	3.106	20	30		EGEDHN
N#Cc1ccc([C@@H](O)CN2CCC3(CCc4ccccc4O3)CC2)cc1	ZINC000852674555	1323224180	/nfs/dbraw/zinc/22/41/80/1323224180.db2.gz	HWDMGTHFYVMIQI-FQEVSTJZSA-N	0	3	348.446	3.451	20	30		EGEDHN
C=C(Br)CNC1CCC(N(C)C(=O)C2=CCCC2)CC1	ZINC000963209402	1323236212	/nfs/dbraw/zinc/23/62/12/1323236212.db2.gz	CIEMIQXWVVJOTD-UHFFFAOYSA-N	0	3	341.293	3.365	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1cc(C)c(OC)c(C)c1	ZINC001024449891	1323406933	/nfs/dbraw/zinc/40/69/33/1323406933.db2.gz	HDCRGFOZFKSDPI-GOSISDBHSA-N	0	3	330.472	3.472	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccc(OC(C)C)nc1	ZINC001024467814	1323422685	/nfs/dbraw/zinc/42/26/85/1323422685.db2.gz	HMSJKSGKEAIPNI-QGZVFWFLSA-N	0	3	331.460	3.029	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1cncc(-c2ccccc2)c1	ZINC001024467542	1323423083	/nfs/dbraw/zinc/42/30/83/1323423083.db2.gz	GLKBNTKVUZKUMK-NRFANRHFSA-N	0	3	347.462	3.356	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccccc1-c1cn[nH]c1	ZINC001024467653	1323423792	/nfs/dbraw/zinc/42/37/92/1323423792.db2.gz	JFQTWBNKYYCLTC-QGZVFWFLSA-N	0	3	338.455	3.237	20	30		EGEDHN
C=C(C)CCN1CCCC[C@H]1CNC(=O)c1nc2c(s1)CCC2	ZINC001024553020	1323494339	/nfs/dbraw/zinc/49/43/39/1323494339.db2.gz	QFZOJZFPLIMWOX-AWEZNQCLSA-N	0	3	333.501	3.182	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@H]1COc2ccc(Cl)cc21	ZINC001024555820	1323495630	/nfs/dbraw/zinc/49/56/30/1323495630.db2.gz	ZPJNOGRJXUZFQX-WBVHZDCISA-N	0	3	348.874	3.363	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)c1ccc(C(F)(F)F)cn1	ZINC001024586201	1323521063	/nfs/dbraw/zinc/52/10/63/1323521063.db2.gz	LENDMYUFRYPZDH-CQSZACIVSA-N	0	3	341.377	3.261	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CCCCN2C[C@@H]2CCCCO2)CC1	ZINC001024632780	1323557986	/nfs/dbraw/zinc/55/79/86/1323557986.db2.gz	BDXGZOQLIPQQGO-MOPGFXCFSA-N	0	3	334.504	3.273	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)c1ccccc1OCC(C)C	ZINC001024716994	1323621946	/nfs/dbraw/zinc/62/19/46/1323621946.db2.gz	RBXFKWSWOBOJBS-SFHVURJKSA-N	0	3	342.483	3.329	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H]1CNC(=O)[C@H]1CCCc2sc(C)nc21	ZINC001024756724	1323656409	/nfs/dbraw/zinc/65/64/09/1323656409.db2.gz	UVJLOIOFNNJWQD-CVEARBPZSA-N	0	3	347.528	3.418	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1c(Cl)nc2ccccn21	ZINC001024788913	1323693491	/nfs/dbraw/zinc/69/34/91/1323693491.db2.gz	PGECTWUEMDNFCX-AWEZNQCLSA-N	0	3	346.862	3.148	20	30		EGEDHN
C=C(C)CCN1CCCC[C@@H]1CNC(=O)c1scnc1Cl	ZINC001024803023	1323705945	/nfs/dbraw/zinc/70/59/45/1323705945.db2.gz	DCDXCEIVMGXRBD-GFCCVEGCSA-N	0	3	327.881	3.347	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)[C@@H]1C[C@H]1c1cccc(F)c1F	ZINC001024809741	1323712198	/nfs/dbraw/zinc/71/21/98/1323712198.db2.gz	WOLDUWVCZXLYIE-BHYGNILZSA-N	0	3	346.421	3.062	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1ccc(OCC2CC2)nc1	ZINC001024812312	1323716515	/nfs/dbraw/zinc/71/65/15/1323716515.db2.gz	NDNUKMWSNBKFLH-SFHVURJKSA-N	0	3	343.471	3.031	20	30		EGEDHN
C=C(C)CN1CCCC[C@H]1CNC(=O)c1cccc2oc(C)nc21	ZINC001024816167	1323717318	/nfs/dbraw/zinc/71/73/18/1323717318.db2.gz	DIQWQTMYOUQVCI-HNNXBMFYSA-N	0	3	327.428	3.297	20	30		EGEDHN
C#CCCN1CCCC[C@@H]1CNC(=O)c1ccc(CC)c(CC)c1	ZINC001024830199	1323733165	/nfs/dbraw/zinc/73/31/65/1323733165.db2.gz	MVYAWQXFCYZLJG-HXUWFJFHSA-N	0	3	326.484	3.419	20	30		EGEDHN
Cc1[nH]ccc1C(=O)N1CCCC[C@@H]1CNCc1ccc(C#N)s1	ZINC001024918014	1323782235	/nfs/dbraw/zinc/78/22/35/1323782235.db2.gz	BZYQTGNBCDOTEW-CQSZACIVSA-N	0	3	342.468	3.041	20	30		EGEDHN
CC1CC(C(=O)N2CCCC[C@@H]2CNCc2ccc(C#N)cc2F)C1	ZINC001024921419	1323785004	/nfs/dbraw/zinc/78/50/04/1323785004.db2.gz	JSCITYHGIZFMLV-IUPXNIOVSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCCC[C@H]1CNCc1c(C)nsc1C	ZINC001025040704	1323843762	/nfs/dbraw/zinc/84/37/62/1323843762.db2.gz	JPDSTNPSXIOZEA-HNNXBMFYSA-N	0	3	335.517	3.443	20	30		EGEDHN
C=C1CCC(C(=O)N2CCCC[C@@H]2CNCc2cccnc2)CC1	ZINC001025068702	1323869710	/nfs/dbraw/zinc/86/97/10/1323869710.db2.gz	PYFJNCJGALQCAY-LJQANCHMSA-N	0	3	327.472	3.299	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cccc(F)c1	ZINC001025195985	1323977009	/nfs/dbraw/zinc/97/70/09/1323977009.db2.gz	PHTAODFGSDIYML-RBUKOAKNSA-N	0	3	328.431	3.308	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)Cc1ccsc1	ZINC001025196642	1323980160	/nfs/dbraw/zinc/98/01/60/1323980160.db2.gz	XQRHJCVIMTYHRY-ROUUACIJSA-N	0	3	330.497	3.159	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1c(C)coc1C	ZINC001025230656	1324017496	/nfs/dbraw/zinc/01/74/96/1324017496.db2.gz	YMUIJQUNNBZGAT-ZWKOTPCHSA-N	0	3	328.456	3.379	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cc(CC)ccn1	ZINC001025231591	1324018301	/nfs/dbraw/zinc/01/83/01/1324018301.db2.gz	IBKZHTUCCVLLBT-VQTJNVASSA-N	0	3	339.483	3.126	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)Cc1c(C)cccc1C	ZINC001025236108	1324024887	/nfs/dbraw/zinc/02/48/87/1324024887.db2.gz	DIIGEUQKBQXOND-LEWJYISDSA-N	0	3	338.495	3.325	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ccc2cc(C)cn2c1	ZINC001025238619	1324030185	/nfs/dbraw/zinc/03/01/85/1324030185.db2.gz	UAHZYWPFRQJNPR-SFTDATJTSA-N	0	3	349.478	3.340	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1cccc(CC)n1	ZINC001025239662	1324032694	/nfs/dbraw/zinc/03/26/94/1324032694.db2.gz	HPISSQURVPMAPW-VQTJNVASSA-N	0	3	339.483	3.126	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1ncc(C)cc1OC	ZINC001025241153	1324036893	/nfs/dbraw/zinc/03/68/93/1324036893.db2.gz	VBEHYYZLLHXCCY-IRXDYDNUSA-N	0	3	343.471	3.044	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1c(C)oc(C)c1C	ZINC001025250411	1324051872	/nfs/dbraw/zinc/05/18/72/1324051872.db2.gz	JXZLILJTBYRWDE-ZWKOTPCHSA-N	0	3	328.456	3.297	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc2ncccc2o1	ZINC001025251758	1324055381	/nfs/dbraw/zinc/05/53/81/1324055381.db2.gz	KLDVHDPPEWMEAK-SJORKVTESA-N	0	3	339.439	3.473	20	30		EGEDHN
C#CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1cc(C)cc(F)c1	ZINC001025272140	1324088256	/nfs/dbraw/zinc/08/82/56/1324088256.db2.gz	KJMXJEGEMFGIDD-OALUTQOASA-N	0	3	328.431	3.226	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1csc(Cl)n1	ZINC001025283983	1324104891	/nfs/dbraw/zinc/10/48/91/1324104891.db2.gz	DBPVWTPWXHVEIU-KBPBESRZSA-N	0	3	339.892	3.442	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@H]1CCCCN1C(=O)C(C)(C)C(F)(F)F	ZINC001025291908	1324115933	/nfs/dbraw/zinc/11/59/33/1324115933.db2.gz	CTDBGDWEQPTQJV-HUUCEWRRSA-N	0	3	344.421	3.444	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccccc1Cl	ZINC001025291941	1324116248	/nfs/dbraw/zinc/11/62/48/1324116248.db2.gz	DCQFZDZCFLOHAG-MSOLQXFVSA-N	0	3	330.859	3.432	20	30		EGEDHN
CC#CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1c(F)cccc1F	ZINC001025292198	1324117166	/nfs/dbraw/zinc/11/71/66/1324117166.db2.gz	GQYZIJLUEWFBDY-ZWKOTPCHSA-N	0	3	346.421	3.447	20	30		EGEDHN
CC#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1c(F)cccc1F	ZINC001025292195	1324117451	/nfs/dbraw/zinc/11/74/51/1324117451.db2.gz	GQYZIJLUEWFBDY-MSOLQXFVSA-N	0	3	346.421	3.447	20	30		EGEDHN
C#CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1ccccc1OCC	ZINC001025298475	1324132903	/nfs/dbraw/zinc/13/29/03/1324132903.db2.gz	XEKXLZVHOVTONR-MOPGFXCFSA-N	0	3	340.467	3.178	20	30		EGEDHN
C=CCN1CCC[C@H]1[C@H]1CCCCN1C(=O)c1c(C)nsc1C	ZINC001025302132	1324136194	/nfs/dbraw/zinc/13/61/94/1324136194.db2.gz	RYFWNGHCRDGJCW-JKSUJKDBSA-N	0	3	333.501	3.405	20	30		EGEDHN
C=CCN1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1cc(C)n(C(C)C)n1	ZINC001025304150	1324138030	/nfs/dbraw/zinc/13/80/30/1324138030.db2.gz	MJTVAYSAGYPXFO-MOPGFXCFSA-N	0	3	344.503	3.418	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(C)c(OC)c(C)c2)C1	ZINC001025419952	1324253292	/nfs/dbraw/zinc/25/32/92/1324253292.db2.gz	QOXWLXLJKNVBBC-ROUUACIJSA-N	0	3	342.483	3.166	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(F)c3ccccc3c2)C1	ZINC001025437503	1324276963	/nfs/dbraw/zinc/27/69/63/1324276963.db2.gz	WSZMZVWUPVXKGK-DOTOQJQBSA-N	0	3	338.426	3.442	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cccc3ccc(C)nc32)C1	ZINC001025457275	1324298224	/nfs/dbraw/zinc/29/82/24/1324298224.db2.gz	ULCFVTZVWLROOM-SJLPKXTDSA-N	0	3	335.451	3.007	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc3cc(C)ccc3n2)C1	ZINC001025477851	1324322428	/nfs/dbraw/zinc/32/24/28/1324322428.db2.gz	JPSJHSQESZWFRO-WMZOPIPTSA-N	0	3	335.451	3.007	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc3cc(C)ccc3[nH]2)C1	ZINC001025501358	1324349907	/nfs/dbraw/zinc/34/99/07/1324349907.db2.gz	DCKUQGQIUQWVJJ-IAGOWNOFSA-N	0	3	337.467	3.330	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2nsc3ccc(C)cc32)C1	ZINC001025504226	1324353450	/nfs/dbraw/zinc/35/34/50/1324353450.db2.gz	ZARMSPMYCFIOGK-HUUCEWRRSA-N	0	3	341.480	3.068	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccccc2OC2CCC2)C1	ZINC001025532219	1324377045	/nfs/dbraw/zinc/37/70/45/1324377045.db2.gz	WLUDACPDTKBNEH-IAGOWNOFSA-N	0	3	340.467	3.081	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cnc3ccccc3c2)C1	ZINC001025543017	1324390311	/nfs/dbraw/zinc/39/03/11/1324390311.db2.gz	GIWTWXDXJCWMBT-FUHWJXTLSA-N	0	3	335.451	3.088	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(Cl)c(F)c2)C1	ZINC001025544486	1324391441	/nfs/dbraw/zinc/39/14/41/1324391441.db2.gz	WDCUWYNWTGNJRH-UKRRQHHQSA-N	0	3	336.838	3.333	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc3cc(F)ccc3o2)C1	ZINC001025550057	1324399825	/nfs/dbraw/zinc/39/98/25/1324399825.db2.gz	ZQHDGGQUMIPPIB-GJZGRUSLSA-N	0	3	342.414	3.426	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2ccc(C(F)F)cc2F)C1	ZINC001025567223	1324412388	/nfs/dbraw/zinc/41/23/88/1324412388.db2.gz	QSKCZRIXNGVLRO-JSGCOSHPSA-N	0	3	338.373	3.227	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc3scnc3c2)C1	ZINC001025585334	1324427057	/nfs/dbraw/zinc/42/70/57/1324427057.db2.gz	OOVDHOMGKNOFRN-GDBMZVCRSA-N	0	3	341.480	3.150	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cccc(-c3ccoc3)c2)C1	ZINC001025590892	1324436200	/nfs/dbraw/zinc/43/62/00/1324436200.db2.gz	UKZUMOKFCYFDEW-LPHOPBHVSA-N	0	3	336.435	3.410	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ncsc2C(C)C)C1	ZINC001025595679	1324443179	/nfs/dbraw/zinc/44/31/79/1324443179.db2.gz	QOXPIOVCQBDEDI-LSDHHAIUSA-N	0	3	333.501	3.120	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2cc(C)c(F)cc2Cl)C1	ZINC001025603254	1324452753	/nfs/dbraw/zinc/45/27/53/1324452753.db2.gz	SQMTWXNPBSDDAV-ZIAGYGMSSA-N	0	3	336.838	3.251	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2c(F)cccc2Cl)C1	ZINC001025603194	1324453263	/nfs/dbraw/zinc/45/32/63/1324453263.db2.gz	RLNPFXVUZHPBDX-ZIAGYGMSSA-N	0	3	336.838	3.333	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc(Cl)ccc2Cl)C1	ZINC001025610090	1324461216	/nfs/dbraw/zinc/46/12/16/1324461216.db2.gz	RIVKXCFYNZUWBX-STQMWFEESA-N	0	3	339.266	3.457	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2ccc3c(c2)CCCC3)C1	ZINC001025611651	1324464271	/nfs/dbraw/zinc/46/42/71/1324464271.db2.gz	NQJVHACSDSDHAO-LAUBAEHRSA-N	0	3	338.495	3.419	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@@H](C)NC(=O)c2ccc(OC)c(Cl)c2)C1	ZINC001025615396	1324468168	/nfs/dbraw/zinc/46/81/68/1324468168.db2.gz	VAHAEHKNBMPTSU-GDBMZVCRSA-N	0	3	348.874	3.202	20	30		EGEDHN
CC#CCN1CCC[C@@H]([C@H](C)NC(=O)c2cc(Cl)cn2CC)C1	ZINC001025623723	1324473686	/nfs/dbraw/zinc/47/36/86/1324473686.db2.gz	HOZBGSUZVWYUBB-LSDHHAIUSA-N	0	3	335.879	3.015	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H](C)NC(=O)c2cc3cccc(F)c3o2)C1	ZINC001025624260	1324474962	/nfs/dbraw/zinc/47/49/62/1324474962.db2.gz	CFPIXWJYMQVBEP-HIFRSBDPSA-N	0	3	328.387	3.035	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H](C)NC(=O)c2cc3ccccc3n2CC)C1	ZINC001025629705	1324481202	/nfs/dbraw/zinc/48/12/02/1324481202.db2.gz	JBEZNBSEGQOIDU-WMZOPIPTSA-N	0	3	337.467	3.125	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)c2c[nH]c3ccc(C)cc23)C1	ZINC001025629748	1324481425	/nfs/dbraw/zinc/48/14/25/1324481425.db2.gz	JWOMUZIGIFARHQ-IRXDYDNUSA-N	0	3	337.467	3.330	20	30		EGEDHN
CC(C)(C)CC(=O)N1C[C@@H]2CC[C@@H](NCc3ccccc3C#N)[C@@H]2C1	ZINC001026200751	1324660073	/nfs/dbraw/zinc/66/00/73/1324660073.db2.gz	LIZHSUZBZLWIQD-IPMKNSEASA-N	0	3	339.483	3.321	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H]2CC[C@H](NCc3cc(C4CC4)no3)[C@H]2C1	ZINC001026329054	1324729373	/nfs/dbraw/zinc/72/93/73/1324729373.db2.gz	UXMWBOJEAWGMNL-XIRDDKMYSA-N	0	3	343.471	3.091	20	30		EGEDHN
C[C@H](C(=O)NC1CCC(NCc2cc(F)ccc2C#N)CC1)C1CC1	ZINC001026472144	1324830575	/nfs/dbraw/zinc/83/05/75/1324830575.db2.gz	TZAWHWJLSSRBCZ-MDAWKPQNSA-N	0	3	343.446	3.260	20	30		EGEDHN
N#Cc1ccc(F)cc1CNC[C@@H]1CCN(C(=O)c2cccs2)C1	ZINC001026658735	1324957540	/nfs/dbraw/zinc/95/75/40/1324957540.db2.gz	IEIYPAQJBUUIFG-ZDUSSCGKSA-N	0	3	343.427	3.011	20	30		EGEDHN
N#Cc1ccccc1CNC[C@@H]1CCN(C(=O)[C@H]2CCCC23CC3)C1	ZINC001026918048	1325080792	/nfs/dbraw/zinc/08/07/92/1325080792.db2.gz	MPRKZLVTLSSEQS-QFBILLFUSA-N	0	3	337.467	3.077	20	30		EGEDHN
CC(C)(C)[C@@H]1C[C@H]1C(=O)N1CC[C@@H](CNCc2ccccc2C#N)C1	ZINC001026953198	1325102824	/nfs/dbraw/zinc/10/28/24/1325102824.db2.gz	ZSUDMIZVXKSADD-KFKAGJAMSA-N	0	3	339.483	3.179	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](CNCc2nc3ccc(F)cc3o2)C1	ZINC001026992995	1325130456	/nfs/dbraw/zinc/13/04/56/1325130456.db2.gz	XGXBFNGUZXYKSE-ZDUSSCGKSA-N	0	3	345.418	3.117	20	30		EGEDHN
N#Cc1ncc(Br)cc1N[C@H]1CCCN2CCCC[C@@H]12	ZINC000853717505	1325152261	/nfs/dbraw/zinc/15/22/61/1325152261.db2.gz	GCBRFBHFMUIGHO-WFASDCNBSA-N	0	3	335.249	3.145	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H](CNCc2nc3ccccc3o2)C1	ZINC001027039291	1325172999	/nfs/dbraw/zinc/17/29/99/1325172999.db2.gz	ZPTNOYVTAGWGOK-QRWLVFNGSA-N	0	3	341.455	3.368	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@H](CNCc2oc(CCC)nc2C)C1	ZINC001027039059	1325173575	/nfs/dbraw/zinc/17/35/75/1325173575.db2.gz	UZWUVJHLSLFZMC-OXJNMPFZSA-N	0	3	347.503	3.476	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](CNCc3ncc(C)s3)C2)CC1	ZINC001027041441	1325176730	/nfs/dbraw/zinc/17/67/30/1325176730.db2.gz	VUHNEZFVUOSTLO-OAHLLOKOSA-N	0	3	333.501	3.136	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@H](CNCc3ccn(C(C)C)n3)C2)CC1	ZINC001027041620	1325177437	/nfs/dbraw/zinc/17/74/37/1325177437.db2.gz	XFCWAMYSBGPSRV-QGZVFWFLSA-N	0	3	344.503	3.149	20	30		EGEDHN
Cc1cccc(C(=O)N2CC[C@H](CNCc3ccccc3C#N)C2)c1C	ZINC001027198413	1325296590	/nfs/dbraw/zinc/29/65/90/1325296590.db2.gz	WJCZRMZLTHHKFA-GOSISDBHSA-N	0	3	347.462	3.427	20	30		EGEDHN
Cc1ccc(C(=O)N2CC[C@H](CNCc3ccccc3C#N)C2)c(C)c1	ZINC001027200654	1325299198	/nfs/dbraw/zinc/29/91/98/1325299198.db2.gz	YEAZCWREUQKWJX-GOSISDBHSA-N	0	3	347.462	3.427	20	30		EGEDHN
CN(Cc1ccc(C#N)c(F)c1)[C@H]1CCCN(C(=O)c2ccco2)C1	ZINC001027274488	1325383274	/nfs/dbraw/zinc/38/32/74/1325383274.db2.gz	XVRWILWCBUJWBL-INIZCTEOSA-N	0	3	341.386	3.027	20	30		EGEDHN
Cc1ccc(C(=O)N2CCC[C@H](N(C)Cc3cccc(C#N)c3)C2)o1	ZINC001027285938	1325415930	/nfs/dbraw/zinc/41/59/30/1325415930.db2.gz	JHMBRFWYRBVORT-SFHVURJKSA-N	0	3	337.423	3.196	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@H]1CCCN(C(=O)C[C@@H]2C=CCC2)C1	ZINC001027290356	1325424607	/nfs/dbraw/zinc/42/46/07/1325424607.db2.gz	UFBODKLTNDGUPB-XLIONFOSSA-N	0	3	337.467	3.337	20	30		EGEDHN
CC1CC(C(=O)N2CCC[C@@H](N(C)Cc3ccc(F)c(C#N)c3)C2)C1	ZINC001027362114	1325546920	/nfs/dbraw/zinc/54/69/20/1325546920.db2.gz	SOVXPCPMKYGXBY-JFUPDXTOSA-N	0	3	343.446	3.166	20	30		EGEDHN
CN(Cc1ccc(F)c(Cl)c1)[C@H]1CCCN(C(=O)C#CC2CC2)C1	ZINC001027406568	1327631546	/nfs/dbraw/zinc/63/15/46/1327631546.db2.gz	VLGGNHJSHWNBIC-INIZCTEOSA-N	0	3	348.849	3.315	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@H]1CCCN(C(=O)Cc2ccccc2)C1	ZINC001027467506	1327723074	/nfs/dbraw/zinc/72/30/74/1327723074.db2.gz	MNAIKCDIAFERBY-NRFANRHFSA-N	0	3	347.462	3.224	20	30		EGEDHN
Cc1cocc1C(=O)N1CCC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001027530347	1327814214	/nfs/dbraw/zinc/81/42/14/1327814214.db2.gz	SWQZTDFAAWDNQJ-GOSISDBHSA-N	0	3	337.423	3.196	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H](N(C)Cc3ccc(C#N)cc3)C2)C1	ZINC001027567557	1327895301	/nfs/dbraw/zinc/89/53/01/1327895301.db2.gz	XVCJDWNGHOUSNW-IBGZPJMESA-N	0	3	337.467	3.337	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)[C@@H]1CCCN(C(=O)C(C)(C)C(F)F)C1	ZINC001027567728	1327898126	/nfs/dbraw/zinc/89/81/26/1327898126.db2.gz	ZDDJNGMMXGDHSW-MRXNPFEDSA-N	0	3	349.425	3.272	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)[C@@H]1CCCN(C(=O)C2(CF)CCC2)C1	ZINC001027584991	1327920761	/nfs/dbraw/zinc/92/07/61/1327920761.db2.gz	WTFXOJRCWYDZHV-GOSISDBHSA-N	0	3	343.446	3.121	20	30		EGEDHN
CN(Cc1ccc(C#N)c(F)c1)[C@@H]1CCCN(C(=O)C(C)(C)C)C1	ZINC001027658221	1328043512	/nfs/dbraw/zinc/04/35/12/1328043512.db2.gz	FRECGSVRAGCBAL-MRXNPFEDSA-N	0	3	331.435	3.166	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)c1ccc(F)s1)C2	ZINC000965947052	1328125093	/nfs/dbraw/zinc/12/50/93/1328125093.db2.gz	AXDBLOJHTGQZJF-UHFFFAOYSA-N	0	3	328.840	3.270	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2cncc(-c3ccccc3)c2)C1	ZINC000966563461	1328342441	/nfs/dbraw/zinc/34/24/41/1328342441.db2.gz	LKWUEPRUSULSNE-LAUBAEHRSA-N	0	3	347.462	3.212	20	30		EGEDHN
CC(C)C(C)(C)C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001054699482	1349441706	/nfs/dbraw/zinc/44/17/06/1349441706.db2.gz	FYWWGYZCWQHLFP-RDTXWAMCSA-N	0	3	345.462	3.316	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@@H](C)[C@H](NCc3ccnc(Cl)c3)C2)C1	ZINC000939103321	1330377434	/nfs/dbraw/zinc/37/74/34/1330377434.db2.gz	QADMATVVDDRHLV-UKRRQHHQSA-N	0	3	333.863	3.028	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(C(C)(C)CC)cc2)[C@H](C)C1	ZINC000942163423	1331854775	/nfs/dbraw/zinc/85/47/75/1331854775.db2.gz	KLTRJFAOKOHFND-APWZRJJASA-N	0	3	326.484	3.448	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(CCCC)cc2)[C@@H](C)C1	ZINC000942270845	1331892373	/nfs/dbraw/zinc/89/23/73/1331892373.db2.gz	GHRHKJZKPZZMOC-RXVVDRJESA-N	0	3	340.511	3.422	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)Cc2cc3ccccc3s2)[C@@H](C)C1	ZINC000942465358	1331939763	/nfs/dbraw/zinc/93/97/63/1331939763.db2.gz	FLDNZZGAOQOSMD-MAUKXSAKSA-N	0	3	340.492	3.294	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C)c3cccnc23)[C@@H](C)C1	ZINC000942522985	1331953944	/nfs/dbraw/zinc/95/39/44/1331953944.db2.gz	JSRXWGICQKOHMQ-LPHOPBHVSA-N	0	3	335.451	3.007	20	30		EGEDHN
Cc1cocc1C(=O)N[C@@H]1CCN(Cc2ccc(C#N)cc2)C[C@@H]1C	ZINC000942558312	1331973374	/nfs/dbraw/zinc/97/33/74/1331973374.db2.gz	VHOMWBQUMMNJNQ-IFXJQAMLSA-N	0	3	337.423	3.100	20	30		EGEDHN
C[C@@H]1CN(Cc2cccc(C#N)c2)CC[C@H]1NC(=O)C1(C)CCC1	ZINC000942560068	1331975002	/nfs/dbraw/zinc/97/50/02/1331975002.db2.gz	KMYRGZAAPCLJFN-CRAIPNDOSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(-c3ccccc3)o2)[C@@H](C)C1	ZINC000942937195	1332062599	/nfs/dbraw/zinc/06/25/99/1332062599.db2.gz	HTJQHAVOLCPLNX-WMZOPIPTSA-N	0	3	336.435	3.410	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(-c3ccccc3)ccn2)[C@H](C)C1	ZINC000943765387	1332258689	/nfs/dbraw/zinc/25/86/89/1332258689.db2.gz	CKEMZEHJEWXOPO-YLJYHZDGSA-N	0	3	347.462	3.212	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnc3ccc(F)cc3c2)[C@@H](C)C1	ZINC000943985815	1332304258	/nfs/dbraw/zinc/30/42/58/1332304258.db2.gz	ALYFTGYZQAFBRX-GUYCJALGSA-N	0	3	327.403	3.000	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2ccc(C(F)(F)F)cc2)[C@H](C)C1	ZINC000944282324	1332363073	/nfs/dbraw/zinc/36/30/73/1332363073.db2.gz	VLEMBZGINZOTDF-CJNGLKHVSA-N	0	3	338.373	3.169	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2ccc(Cl)cc2Cl)[C@H](C)C1	ZINC000944304843	1332368325	/nfs/dbraw/zinc/36/83/25/1332368325.db2.gz	LQLFZKKYFAKVEL-ABAIWWIYSA-N	0	3	325.239	3.067	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3ccccc3)CCCC2)[C@@H](C)C1	ZINC000944697070	1332422618	/nfs/dbraw/zinc/42/26/18/1332422618.db2.gz	BDHVPEDXMKOAFN-ICSRJNTNSA-N	0	3	338.495	3.348	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cccc(OCC(C)C)c2)[C@@H](C)C1	ZINC000944810262	1332426474	/nfs/dbraw/zinc/42/64/74/1332426474.db2.gz	HDGHFSNRBYZYLR-PXNSSMCTSA-N	0	3	342.483	3.185	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@H]2CN(Cc3ccccc3C#N)C[C@H]2CC1	ZINC000946452398	1332832706	/nfs/dbraw/zinc/83/27/06/1332832706.db2.gz	NFSCTYQMEIRZDJ-BGYRXZFFSA-N	0	3	337.467	3.195	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3cccc(F)c3)CC[C@@H]2C1	ZINC000946460625	1332836160	/nfs/dbraw/zinc/83/61/60/1332836160.db2.gz	PUVYFVVWVVFFKB-IYBDPMFKSA-N	0	3	336.838	3.362	20	30		EGEDHN
CC(C)C(=O)N1CC[C@H]2CN(Cc3ccc(F)c(C#N)c3)C[C@H]2CC1	ZINC000946482980	1332840746	/nfs/dbraw/zinc/84/07/46/1332840746.db2.gz	FJMNJQWRZKEFTG-CALCHBBNSA-N	0	3	343.446	3.024	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3occc3CC)CC[C@@H]2C1	ZINC000946761704	1332893932	/nfs/dbraw/zinc/89/39/32/1332893932.db2.gz	DLOIMFNOUMTWFW-IYBDPMFKSA-N	0	3	336.863	3.379	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2CCN(C(=O)c3ocnc3C3CC3)CC[C@@H]2C1	ZINC000946779165	1332898030	/nfs/dbraw/zinc/89/80/30/1332898030.db2.gz	IMCZQGLDIICSBS-GASCZTMLSA-N	0	3	349.862	3.089	20	30		EGEDHN
Cc1ccoc1C(=O)N[C@@H]1CCN(Cc2ccc(C#N)cc2)[C@@H](C)C1	ZINC000947058348	1332995631	/nfs/dbraw/zinc/99/56/31/1332995631.db2.gz	YHHUQOAWMLYYIG-MAUKXSAKSA-N	0	3	337.423	3.243	20	30		EGEDHN
Cc1ccncc1C(=O)N[C@@H]1CCN(Cc2cccc(C#N)c2)[C@@H](C)C1	ZINC000947157979	1333028658	/nfs/dbraw/zinc/02/86/58/1333028658.db2.gz	STDZKRXHTPOUDN-QFBILLFUSA-N	0	3	348.450	3.045	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)C2CC(F)(F)C2)CCN1Cc1ccc(C#N)cc1	ZINC000947171400	1333035893	/nfs/dbraw/zinc/03/58/93/1333035893.db2.gz	UVLAIRIRLZFQAI-SUMWQHHRSA-N	0	3	347.409	3.073	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2ccc(-c3ccncc3)o2)C[C@@H]1C	ZINC000947381807	1333109379	/nfs/dbraw/zinc/10/93/79/1333109379.db2.gz	CFZKEXFBKKHVBO-GOEBONIOSA-N	0	3	325.412	3.110	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2oc3c(cccc3F)c2C)C[C@@H]1C	ZINC000947392659	1333113414	/nfs/dbraw/zinc/11/34/14/1333113414.db2.gz	XHBSYZASDNSUPR-DZGCQCFKSA-N	0	3	342.414	3.486	20	30		EGEDHN
C[C@H]1C[C@H](NC(=O)Cc2ccccc2)CCN1Cc1ccc(C#N)cc1	ZINC000947455608	1333135392	/nfs/dbraw/zinc/13/53/92/1333135392.db2.gz	UVKHQHWESHGKBO-LAUBAEHRSA-N	0	3	347.462	3.270	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc3c([nH]2)c(F)ccc3C)C[C@@H]1C	ZINC000947467368	1333139651	/nfs/dbraw/zinc/13/96/51/1333139651.db2.gz	AITLPWPJSMQLHN-LSDHHAIUSA-N	0	3	341.430	3.221	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(C)nn2C(CC)CC)C[C@H]1C	ZINC000947471386	1333141518	/nfs/dbraw/zinc/14/15/18/1333141518.db2.gz	BNJDMXDNJKVMNZ-IAGOWNOFSA-N	0	3	344.503	3.159	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2[nH]c3ccccc3c2Cl)C[C@@H]1C	ZINC000947479299	1333143527	/nfs/dbraw/zinc/14/35/27/1333143527.db2.gz	LXYNZAJRLOZJCG-QWHCGFSZSA-N	0	3	329.831	3.037	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)Cc2ccc(C(F)F)cc2)C[C@H]1C	ZINC000947540856	1333164869	/nfs/dbraw/zinc/16/48/69/1333164869.db2.gz	ZKTYUEBYSSCVEF-PBHICJAKSA-N	0	3	334.410	3.159	20	30		EGEDHN
C[C@@H]1C[C@H](NC(=O)[C@H]2C[C@H]3C[C@H]3C2)CCN1Cc1ccc(C#N)cc1	ZINC000947639285	1333204513	/nfs/dbraw/zinc/20/45/13/1333204513.db2.gz	OYKUAWQJTZMYGU-JIKAWYKTSA-N	0	3	337.467	3.073	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CCN(Cc3ccc(C#N)cc3)[C@@H](C)C2)C1	ZINC000947701460	1333231679	/nfs/dbraw/zinc/23/16/79/1333231679.db2.gz	CCPASHKBXWULGG-QFBILLFUSA-N	0	3	337.467	3.384	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2cc(-c3ccccc3)ccn2)C[C@@H]1C	ZINC000947857783	1333282922	/nfs/dbraw/zinc/28/29/22/1333282922.db2.gz	RQMWLLWHNSGXKX-FXAWDEMLSA-N	0	3	347.462	3.355	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2sc(CC3CC3)nc2C)C[C@H]1C	ZINC000947862049	1333284393	/nfs/dbraw/zinc/28/43/93/1333284393.db2.gz	RLZQOMRGXDEGTE-IUODEOHRSA-N	0	3	333.501	3.173	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2ccc(OC)c(C3CC3)c2)C[C@@H]1C	ZINC000947868719	1333286021	/nfs/dbraw/zinc/28/60/21/1333286021.db2.gz	YEBKTRCMZBOMGX-MAUKXSAKSA-N	0	3	340.467	3.179	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2[nH]ccc2-c2ccccc2)C[C@H]1C	ZINC000947916365	1333306322	/nfs/dbraw/zinc/30/63/22/1333306322.db2.gz	QMWZNILNXQVTJO-SJLPKXTDSA-N	0	3	335.451	3.288	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cnc(-c3ccco3)s2)C[C@H]1C	ZINC000947943526	1333314436	/nfs/dbraw/zinc/31/44/36/1333314436.db2.gz	MBXSEOCIJHGSPU-OLZOCXBDSA-N	0	3	331.441	3.172	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cnc(-c3ccco3)s2)C[C@@H]1C	ZINC000947944122	1333314462	/nfs/dbraw/zinc/31/44/62/1333314462.db2.gz	RBVKIUNGUIOCMH-KBPBESRZSA-N	0	3	343.452	3.009	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C2(c3ccccc3)CCCC2)C[C@H]1C	ZINC000948001680	1333338036	/nfs/dbraw/zinc/33/80/36/1333338036.db2.gz	DHALBUYBIZIQSL-QUCCMNQESA-N	0	3	338.495	3.491	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2cc(C)n(C(C)C)c2C)C[C@H]1C	ZINC000948017693	1333343918	/nfs/dbraw/zinc/34/39/18/1333343918.db2.gz	WOKSAUXNNFHRBL-QAPCUYQASA-N	0	3	329.488	3.292	20	30		EGEDHN
CC#CCN1CC[C@@H](NC(=O)c2sc(C(C)C)nc2C)C[C@H]1C	ZINC000948029364	1333346552	/nfs/dbraw/zinc/34/65/52/1333346552.db2.gz	AFHMDUIBIIMYKQ-UKRRQHHQSA-N	0	3	333.501	3.181	20	30		EGEDHN
C=CCN1CC[C@@H](NC(=O)c2c[nH]c3c2cccc3CC)C[C@H]1C	ZINC000948071410	1333364673	/nfs/dbraw/zinc/36/46/73/1333364673.db2.gz	XXNLDVKDBJTVMR-GDBMZVCRSA-N	0	3	325.456	3.499	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)C23CC(c4ccccc4)(C2)C3)C[C@@H]1C	ZINC000948078613	1333368190	/nfs/dbraw/zinc/36/81/90/1333368190.db2.gz	MJYOAJHRNMYSCV-MCNZBGGYSA-N	0	3	336.479	3.101	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)c2cccc3c2OCC3(C)C)C[C@H]1C	ZINC000948104280	1333375069	/nfs/dbraw/zinc/37/50/69/1333375069.db2.gz	KZGCSBGHFAPSME-CABCVRRESA-N	0	3	328.456	3.125	20	30		EGEDHN
CN(C(=O)c1ccccn1)[C@@H]1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC000948130795	1333383758	/nfs/dbraw/zinc/38/37/58/1333383758.db2.gz	COBNISVKHABUDF-LJQANCHMSA-N	0	3	348.450	3.080	20	30		EGEDHN
CN(C(=O)c1ccoc1)[C@@H]1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC000948189402	1333415451	/nfs/dbraw/zinc/41/54/51/1333415451.db2.gz	WYFVRNGCLRNIJR-LJQANCHMSA-N	0	3	337.423	3.278	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2[nH]c3ccccc3c2Cl)CC1	ZINC000948583496	1333584707	/nfs/dbraw/zinc/58/47/07/1333584707.db2.gz	SJFHHQLEJNDTLD-CQSZACIVSA-N	0	3	343.858	3.381	20	30		EGEDHN
C#CCN1CCC[C@H](N(C)C(=O)c2sc(C)nc2CC(C)C)CC1	ZINC000948590622	1333587372	/nfs/dbraw/zinc/58/73/72/1333587372.db2.gz	MTVMDGMHIMSYDZ-INIZCTEOSA-N	0	3	347.528	3.210	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2c(F)cc(C)cc2F)CC1	ZINC000948605226	1333593780	/nfs/dbraw/zinc/59/37/80/1333593780.db2.gz	NNJMUEYPAYUWME-OAHLLOKOSA-N	0	3	334.410	3.223	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)Cc2cccc(C)c2Cl)CC1	ZINC000948611685	1333595129	/nfs/dbraw/zinc/59/51/29/1333595129.db2.gz	AFCPOPUGVIAVDB-QGZVFWFLSA-N	0	3	332.875	3.137	20	30		EGEDHN
CC#CCN1CCC[C@H](N(C)C(=O)Cc2cccc3cccnc32)CC1	ZINC000948658197	1333616623	/nfs/dbraw/zinc/61/66/23/1333616623.db2.gz	GJEKTAWMTQWQMB-FQEVSTJZSA-N	0	3	349.478	3.114	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)Cc2cccc3cccnc32)CC1	ZINC000948658198	1333617084	/nfs/dbraw/zinc/61/70/84/1333617084.db2.gz	GJEKTAWMTQWQMB-HXUWFJFHSA-N	0	3	349.478	3.114	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)C(C)(C)c2cccs2)CC1	ZINC000948664827	1333620002	/nfs/dbraw/zinc/62/00/02/1333620002.db2.gz	AWRLKQGVYNYIJO-MRXNPFEDSA-N	0	3	332.513	3.362	20	30		EGEDHN
C#CCN1CCC[C@@H](N(C)C(=O)c2nc(Cl)sc2Cl)CC1	ZINC000948670682	1333622833	/nfs/dbraw/zinc/62/28/33/1333622833.db2.gz	VIOAWWKEEAZAKA-SNVBAGLBSA-N	0	3	346.283	3.010	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)N(C)[C@@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC000948680265	1333625512	/nfs/dbraw/zinc/62/55/12/1333625512.db2.gz	GEBRAOHBVCAPHL-ATZDWAIDSA-N	0	3	325.456	3.027	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)[C@@H]2C[C@H]2c2ccccc2C)CC1	ZINC000948850257	1333709511	/nfs/dbraw/zinc/70/95/11/1333709511.db2.gz	YSNZLXATLPNCHG-HLAWJBBLSA-N	0	3	338.495	3.435	20	30		EGEDHN
CC#CCN1CCC[C@@H](N(C)C(=O)c2cc(Cl)cc(OC)c2)CC1	ZINC000948873247	1333716676	/nfs/dbraw/zinc/71/66/76/1333716676.db2.gz	DNMGXLCOSUDJHP-QGZVFWFLSA-N	0	3	348.874	3.298	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@@H]1CNC(=O)C1=COCCC1	ZINC000948898610	1333724340	/nfs/dbraw/zinc/72/43/40/1333724340.db2.gz	KBIJOAMUKAFGOA-FQEVSTJZSA-N	0	3	340.467	3.363	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@H]1CNC(=O)[C@H]1CCCOC1	ZINC000948899232	1333724629	/nfs/dbraw/zinc/72/46/29/1333724629.db2.gz	RMYNIDAFJUFSDX-AZUAARDMSA-N	0	3	342.483	3.095	20	30		EGEDHN
CCCCN1CCc2ccccc2[C@H]1CNC(=O)c1ccc(C#N)[nH]1	ZINC000948909852	1333729426	/nfs/dbraw/zinc/72/94/26/1333729426.db2.gz	CTIUVDPXXJRSID-LJQANCHMSA-N	0	3	336.439	3.016	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@H]1CNC(=O)[C@@H]1CCCCO1	ZINC000948909948	1333729747	/nfs/dbraw/zinc/72/97/47/1333729747.db2.gz	FBDVMQCBARRYQU-UXHICEINSA-N	0	3	342.483	3.237	20	30		EGEDHN
C=C(C)CCN1CCc2ccccc2[C@@H]1CNC(=O)c1n[nH]cc1C	ZINC000948915535	1333731978	/nfs/dbraw/zinc/73/19/78/1333731978.db2.gz	AYKMIJQJOQRVFG-SFHVURJKSA-N	0	3	338.455	3.014	20	30		EGEDHN
C=CCCN1CCc2ccccc2[C@H]1CNC(=O)c1cccn1CC	ZINC000948987482	1333761101	/nfs/dbraw/zinc/76/11/01/1333761101.db2.gz	ZBWPDWWUEXXNQS-HXUWFJFHSA-N	0	3	337.467	3.413	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccc(C)cc1Cl)CCO2	ZINC000949196764	1333793580	/nfs/dbraw/zinc/79/35/80/1333793580.db2.gz	FXLILLHHFCXUAK-UHFFFAOYSA-N	0	3	348.874	3.141	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@H]1CCCC(C)(C)C1)CCO2	ZINC000949227144	1333798661	/nfs/dbraw/zinc/79/86/61/1333798661.db2.gz	UECRLNNMWZCTJL-GOSISDBHSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=C(C)CCN1CCOC2(CCN(C(=O)[C@@]3(C)CCC[C@@H]3C)CC2)C1	ZINC000949463178	1333854021	/nfs/dbraw/zinc/85/40/21/1333854021.db2.gz	KXQXQZULMVIZSY-ICSRJNTNSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCCN1CCOC2(CCN(C(=O)[C@H]3CC4CCC3CC4)CC2)C1	ZINC000949532054	1333869455	/nfs/dbraw/zinc/86/94/55/1333869455.db2.gz	WMOAYOGHLUOWOG-ACBHZAAOSA-N	0	3	346.515	3.082	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@H](NC(=O)c2cc3c(cc(C)cc3C)[nH]2)C1	ZINC000967463465	1335748513	/nfs/dbraw/zinc/74/85/13/1335748513.db2.gz	IDWVDQPCXANOAI-MGPUTAFESA-N	0	3	337.467	3.248	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@@H](NC(=O)c2cc3ccc(C)cc3[nH]2)C1	ZINC000967467664	1335750256	/nfs/dbraw/zinc/75/02/56/1335750256.db2.gz	PMCGGYJVJNXBAC-KXBFYZLASA-N	0	3	325.456	3.493	20	30		EGEDHN
C=CCCN1CC[C@@H](C)[C@H](NC(=O)c2csc(-c3ccco3)n2)C1	ZINC000968078827	1335854309	/nfs/dbraw/zinc/85/43/09/1335854309.db2.gz	LVGSVAVPOVMJFS-ZIAGYGMSSA-N	0	3	345.468	3.419	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CN(CCc3scnc3C)CC[C@H]2C)C1	ZINC000968272080	1335881572	/nfs/dbraw/zinc/88/15/72/1335881572.db2.gz	DWOMQQFMBZSUMG-GDBMZVCRSA-N	0	3	347.528	3.177	20	30		EGEDHN
Cc1sccc1C(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC000968595163	1335976776	/nfs/dbraw/zinc/97/67/76/1335976776.db2.gz	KCNZZDHLIXERJF-OAHLLOKOSA-N	0	3	343.427	3.072	20	30		EGEDHN
C#CCCN1CC[C@H](C)[C@@H](NC(=O)c2cc(F)c(F)cc2Cl)C1	ZINC000968609650	1335982349	/nfs/dbraw/zinc/98/23/49/1335982349.db2.gz	JZBHEAOWUKXHDV-ZBEGNZNMSA-N	0	3	340.801	3.082	20	30		EGEDHN
C=C(C)CN1CC[C@H](C)[C@H](NC(=O)Cn2ccc3ccccc32)C1	ZINC000968664966	1336001992	/nfs/dbraw/zinc/00/19/92/1336001992.db2.gz	KULWWJPMFVWKDN-FUHWJXTLSA-N	0	3	325.456	3.044	20	30		EGEDHN
C=CCCN1CC[C@H](C)[C@@H](NC(=O)c2cc(C3CCCC3)no2)C1	ZINC000968670408	1336004362	/nfs/dbraw/zinc/00/43/62/1336004362.db2.gz	XFMLKKMVINIUQR-YOEHRIQHSA-N	0	3	331.460	3.349	20	30		EGEDHN
C#CCCN1CC[C@@H](C)[C@H](NC(=O)c2ccccc2CC(C)C)C1	ZINC000968692560	1336014175	/nfs/dbraw/zinc/01/41/75/1336014175.db2.gz	OBJLQQRLMJDHDQ-YLJYHZDGSA-N	0	3	326.484	3.349	20	30		EGEDHN
CC1(C)C[C@@H]1C(=O)NC[C@H]1CCCCCN1Cc1ccc(C#N)cc1	ZINC000968816364	1336059701	/nfs/dbraw/zinc/05/97/01/1336059701.db2.gz	ULSUSJUJWIZFQY-RTBURBONSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cc2ccccc2c(=O)[nH]1	ZINC000968891447	1336082163	/nfs/dbraw/zinc/08/21/63/1336082163.db2.gz	YYNIZSBJPCKXKR-INIZCTEOSA-N	0	3	339.439	3.101	20	30		EGEDHN
CC#CCN1CCCCC[C@@H]1CNC(=O)[C@@H]1C[C@H]1c1ccsc1	ZINC000968917159	1336088435	/nfs/dbraw/zinc/08/84/35/1336088435.db2.gz	PKMKMBDBGXOLQC-FGTMMUONSA-N	0	3	330.497	3.236	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)[C@H]1CCc2cc(C)ccc2O1	ZINC000968951724	1336100911	/nfs/dbraw/zinc/10/09/11/1336100911.db2.gz	DDHLMQPTXBAWEC-AZUAARDMSA-N	0	3	342.483	3.235	20	30		EGEDHN
C=CCN1CCCCC[C@H]1CNC(=O)c1cc2cc(OC)ccc2[nH]1	ZINC000969007638	1336115876	/nfs/dbraw/zinc/11/58/76/1336115876.db2.gz	GJBSJWHDFRHJIW-INIZCTEOSA-N	0	3	341.455	3.337	20	30		EGEDHN
C=C(C)CN1CCCCC[C@@H]1CNC(=O)c1cnc(C)nc1C(C)C	ZINC000969056488	1336131896	/nfs/dbraw/zinc/13/18/96/1336131896.db2.gz	GZOMISPXCCQNMN-QGZVFWFLSA-N	0	3	344.503	3.459	20	30		EGEDHN
C=CCN1CCCCC[C@@H]1CNC(=O)c1cccnc1OCC(C)C	ZINC000969118153	1336150048	/nfs/dbraw/zinc/15/00/48/1336150048.db2.gz	GRYRYUKUFREKFI-QGZVFWFLSA-N	0	3	345.487	3.277	20	30		EGEDHN
CC(C)(C)C(C)(C)C(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC000969579151	1336226058	/nfs/dbraw/zinc/22/60/58/1336226058.db2.gz	VZJRJQPYNQSSKM-MRXNPFEDSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C(C)CN1CC([C@H](C)NC(=O)[C@@H]2C[C@H]2c2ccccc2CC)C1	ZINC000970344854	1336295934	/nfs/dbraw/zinc/29/59/34/1336295934.db2.gz	XFZICBAUPBDUHC-RYGJVYDSSA-N	0	3	326.484	3.365	20	30		EGEDHN
Cc1cc(F)ccc1C(=O)N1CC[C@@H](NCc2ccc(C#N)s2)C1	ZINC000970532761	1336318261	/nfs/dbraw/zinc/31/82/61/1336318261.db2.gz	GXGSADOWMFQWDA-CQSZACIVSA-N	0	3	343.427	3.072	20	30		EGEDHN
Cc1cc(C(=O)N2CC[C@@H](NCc3ccc(C#N)s3)C2)sc1C	ZINC000970666747	1336330790	/nfs/dbraw/zinc/33/07/90/1336330790.db2.gz	KBOGRKCTRIKFAX-CYBMUJFWSA-N	0	3	345.493	3.302	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cc(-c3cccs3)on2)CC1	ZINC001005792352	1336402348	/nfs/dbraw/zinc/40/23/48/1336402348.db2.gz	ZJKPKRSNGLTUKR-UHFFFAOYSA-N	0	3	331.441	3.126	20	30		EGEDHN
C=CCN1CCC(N(C)C(=O)c2cc(F)cc3cccnc32)CC1	ZINC001006088218	1336450434	/nfs/dbraw/zinc/45/04/34/1336450434.db2.gz	TXYQEVUUEBECGX-UHFFFAOYSA-N	0	3	327.403	3.096	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2cc3nc(C)ccc3o2)CC1	ZINC001006322441	1336488934	/nfs/dbraw/zinc/48/89/34/1336488934.db2.gz	JSUZUGUVAYAPIH-UHFFFAOYSA-N	0	3	327.428	3.249	20	30		EGEDHN
C=C(C)CN1CCC(N(C)C(=O)c2ccc(P(C)(C)=O)cc2)CC1	ZINC001006434626	1336505174	/nfs/dbraw/zinc/50/51/74/1336505174.db2.gz	KVCDBMPWFNJPQU-UHFFFAOYSA-N	0	3	348.427	3.047	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2ocnc2-c2ccccc2)C1	ZINC001007478747	1336654634	/nfs/dbraw/zinc/65/46/34/1336654634.db2.gz	YMNMVGHFAJPPGE-MRXNPFEDSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=CCCN1CCC[C@@H](NC(=O)c2c(C)occ2C(F)(F)F)C1	ZINC001007948270	1336737392	/nfs/dbraw/zinc/73/73/92/1336737392.db2.gz	BWPFSHKSQHFOKO-GFCCVEGCSA-N	0	3	330.350	3.377	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)C[C@@H]2C[C@H]2Cc2ccccc2)C1	ZINC001008036403	1336754821	/nfs/dbraw/zinc/75/48/21/1336754821.db2.gz	HYIAVDUKKCHOMA-AABGKKOBSA-N	0	3	326.484	3.412	20	30		EGEDHN
C=C(C)CN1CCC[C@@H](NC(=O)C[C@H]2CCOc3ccccc32)C1	ZINC001008180440	1336785908	/nfs/dbraw/zinc/78/59/08/1336785908.db2.gz	ZZPBKTGMYPPARU-IAGOWNOFSA-N	0	3	328.456	3.100	20	30		EGEDHN
C=CCCN1CCC[C@H](NC(=O)c2c(Cl)cncc2Cl)C1	ZINC001008411446	1336845389	/nfs/dbraw/zinc/84/53/89/1336845389.db2.gz	MRNKEDVTQVNWOL-NSHDSACASA-N	0	3	328.243	3.159	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CCCN([C@H](C)c3ccccc3)C2)c1	ZINC001008468379	1336863968	/nfs/dbraw/zinc/86/39/68/1336863968.db2.gz	LAWSXTBLPBMYTB-OXQOHEQNSA-N	0	3	333.435	3.018	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2CCCN([C@@H](C)c3cccc(C)c3)C2)c1	ZINC001008466937	1336863986	/nfs/dbraw/zinc/86/39/86/1336863986.db2.gz	ATCYFILDMALURA-LAUBAEHRSA-N	0	3	347.462	3.327	20	30		EGEDHN
C=C(C)CN1CCC[C@H](NC(=O)Cc2c[nH]c3c2cccc3C)C1	ZINC001008760124	1336921361	/nfs/dbraw/zinc/92/13/61/1336921361.db2.gz	IOLYELNUJMUUTG-KRWDZBQOSA-N	0	3	325.456	3.176	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCN([C@H](C)c3ccccc3C)C2)nc1	ZINC001009254385	1336991678	/nfs/dbraw/zinc/99/16/78/1336991678.db2.gz	QZHHLPMBSAMFRK-MJGOQNOKSA-N	0	3	347.462	3.327	20	30		EGEDHN
N#Cc1c[nH]c(C(=O)N[C@H]2CCN(Cc3ccc4ccccc4c3)C2)c1	ZINC001010480493	1337204093	/nfs/dbraw/zinc/20/40/93/1337204093.db2.gz	STJKRMFULSGIOA-IBGZPJMESA-N	0	3	344.418	3.044	20	30		EGEDHN
C=C(C)CCN1CC[C@H](NC(=O)c2cc(-c3ccccc3)no2)C1	ZINC001015075918	1338009363	/nfs/dbraw/zinc/00/93/63/1338009363.db2.gz	CGVVVAPPRMAZDH-INIZCTEOSA-N	0	3	325.412	3.112	20	30		EGEDHN
C=C[C@@H]1OCC[C@H]1C(=O)N[C@@H]1CCN(Cc2ccc(C(C)C)cc2)C1	ZINC001015722240	1338273172	/nfs/dbraw/zinc/27/31/72/1338273172.db2.gz	XIONMOKRZVOVBT-AQNXPRMDSA-N	0	3	342.483	3.092	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCN([C@@H](C)c3cc(C)ccc3C)C2)cn1	ZINC001016032705	1338417736	/nfs/dbraw/zinc/41/77/36/1338417736.db2.gz	CPWSQHORVROPLN-FXAWDEMLSA-N	0	3	347.462	3.245	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)C[C@@H]2C[C@H]2c2ccccc2)CC1	ZINC001016627008	1338668861	/nfs/dbraw/zinc/66/88/61/1338668861.db2.gz	IDEBHXHIUHPUKN-UFYCRDLUSA-N	0	3	336.479	3.174	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)CC2CC(c3ccccc3)C2)CC1	ZINC001016693035	1338693588	/nfs/dbraw/zinc/69/35/88/1338693588.db2.gz	FXKSTJDIBXQYRJ-UUKMXZOPSA-N	0	3	336.479	3.174	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)c2ccc3cc(C)ccc3n2)CC1	ZINC001016722738	1338702333	/nfs/dbraw/zinc/70/23/33/1338702333.db2.gz	UZNTXLJJFHWSGV-FQEVSTJZSA-N	0	3	347.462	3.151	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2cc3cscc3s2)CC1	ZINC001016731262	1338705295	/nfs/dbraw/zinc/70/52/95/1338705295.db2.gz	OGMWZUGBWLSSNV-HNNXBMFYSA-N	0	3	330.478	3.180	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)C(C)(C)c2cccs2)CC1	ZINC001016766202	1338716900	/nfs/dbraw/zinc/71/69/00/1338716900.db2.gz	MCWUCEJVZHMTQQ-HNNXBMFYSA-N	0	3	330.497	3.020	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2cccc(Cl)c2F)CC1	ZINC001016800445	1338731077	/nfs/dbraw/zinc/73/10/77/1338731077.db2.gz	RURRNVKSRIIGHD-OAHLLOKOSA-N	0	3	334.822	3.087	20	30		EGEDHN
C#CCN1CCC2(C[C@@H]2NC(=O)c2ccc(F)c3ccccc23)CC1	ZINC001016845470	1338745066	/nfs/dbraw/zinc/74/50/66/1338745066.db2.gz	JCPCLSMLYXTUOF-IBGZPJMESA-N	0	3	336.410	3.196	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)[C@H]2[C@@H]3CCCCCC[C@@H]32)CC1	ZINC001016847233	1338745945	/nfs/dbraw/zinc/74/59/45/1338745945.db2.gz	KPMVBIFXQNCIOO-HCXYKTFWSA-N	0	3	328.500	3.197	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)Cc2ccc(Cl)c(F)c2)CC1	ZINC001016848832	1338746777	/nfs/dbraw/zinc/74/67/77/1338746777.db2.gz	ZULVHVAQPPAGQZ-QGZVFWFLSA-N	0	3	348.849	3.016	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H]2NC(=O)C(C)(C)c2ccc(F)cc2)CC1	ZINC001016933552	1338773827	/nfs/dbraw/zinc/77/38/27/1338773827.db2.gz	KOZGENARACJOKW-SFHVURJKSA-N	0	3	342.458	3.097	20	30		EGEDHN
C#CCN1CCC2(C[C@H]2NC(=O)c2ccc(Cl)cc2Cl)CC1	ZINC001016944837	1338779006	/nfs/dbraw/zinc/77/90/06/1338779006.db2.gz	UEFDUIWEFRUSFW-OAHLLOKOSA-N	0	3	337.250	3.211	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)[C@@H](C)c2ccc(F)c(F)c2)CC1	ZINC001016985877	1338792950	/nfs/dbraw/zinc/79/29/50/1338792950.db2.gz	LITJEKPCIXANSU-KBXCAEBGSA-N	0	3	346.421	3.062	20	30		EGEDHN
CC#CCN1CCC2(C[C@H]2NC(=O)c2ccccc2CC(C)C)CC1	ZINC001016993948	1338797464	/nfs/dbraw/zinc/79/74/64/1338797464.db2.gz	QNIXMMZCXHNGLR-HXUWFJFHSA-N	0	3	338.495	3.493	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCCN(C(=O)c2ccoc2)C1	ZINC001017045591	1338832983	/nfs/dbraw/zinc/83/29/83/1338832983.db2.gz	CHOKNEOVYPTFEL-CQSZACIVSA-N	0	3	343.452	3.197	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@H](CN(C)[C@H](C)c2cnccn2)C1	ZINC001017179459	1338923076	/nfs/dbraw/zinc/92/30/76/1338923076.db2.gz	JNIBQWHNOOVIBA-IAGOWNOFSA-N	0	3	344.503	3.310	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H](CN(C)Cc2oc(CC)nc2C)C1	ZINC001017179858	1338923736	/nfs/dbraw/zinc/92/37/36/1338923736.db2.gz	QNPFGDBJSQSTNG-INIZCTEOSA-N	0	3	347.503	3.428	20	30		EGEDHN
CCC1(C(=O)N2CCC[C@H](CN(C)Cc3ccc(C#N)s3)C2)CC1	ZINC001017200571	1338945843	/nfs/dbraw/zinc/94/58/43/1338945843.db2.gz	ATHBSFWJNLMDKT-OAHLLOKOSA-N	0	3	345.512	3.480	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CCC[C@H](CN(C)Cc3cncc(C)c3)C2)C1	ZINC001017203264	1338949196	/nfs/dbraw/zinc/94/91/96/1338949196.db2.gz	DVWPWILEOSSMBE-GOSISDBHSA-N	0	3	341.499	3.417	20	30		EGEDHN
C[C@H]1CCC[C@H](CCN2C[C@H]3CC[C@@H](C2)N3C(=O)C#CC2CC2)C1	ZINC001017536608	1339363879	/nfs/dbraw/zinc/36/38/79/1339363879.db2.gz	WJMSLQGEXRRKID-OJAHFUOMSA-N	0	3	328.500	3.291	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)C[C@@H]1CCC(F)(F)C1	ZINC001017604799	1339375836	/nfs/dbraw/zinc/37/58/36/1339375836.db2.gz	KOQWAPXYIILFJQ-HRCADAONSA-N	0	3	326.431	3.453	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1CC[C@H](C(F)(F)F)C1	ZINC001017854963	1339430370	/nfs/dbraw/zinc/43/03/70/1339430370.db2.gz	FFBXFCIFUTVKLC-ZQDZILKHSA-N	0	3	330.394	3.216	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(F)c(OC)c1	ZINC001017984448	1339474803	/nfs/dbraw/zinc/47/48/03/1339474803.db2.gz	LFXLRGSRTOJNGB-IYBDPMFKSA-N	0	3	332.419	3.089	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1C[C@@]12CCc1ccccc12	ZINC001018122070	1339505985	/nfs/dbraw/zinc/50/59/85/1339505985.db2.gz	FEHYQVMWNRFEKU-BAYUQKDNSA-N	0	3	336.479	3.142	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)c1c(C)nn(CCC)c1C	ZINC001018153929	1339516912	/nfs/dbraw/zinc/51/69/12/1339516912.db2.gz	BUCRVGIZEVBZTB-HDICACEKSA-N	0	3	344.503	3.165	20	30		EGEDHN
C=CCCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](C)Cc1ccccc1C	ZINC001018324126	1339577740	/nfs/dbraw/zinc/57/77/40/1339577740.db2.gz	SROZEYMVDQMFQU-RLLQIKCJSA-N	0	3	326.484	3.425	20	30		EGEDHN
C=C(C)CCN1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H]1Oc2ccccc2[C@@H]1C	ZINC001018343634	1339585670	/nfs/dbraw/zinc/58/56/70/1339585670.db2.gz	XXBSZVGDBUCUQM-LJCCNALRSA-N	0	3	340.467	3.193	20	30		EGEDHN
N#Cc1ccc(CN[C@H]2CCN(C(=O)CC3=CCCCC3)C2)cc1F	ZINC001018623188	1339685416	/nfs/dbraw/zinc/68/54/16/1339685416.db2.gz	ZAVKOSGGUUSSHI-SFHVURJKSA-N	0	3	341.430	3.278	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1ncc(Cl)cc1Cl	ZINC001028226626	1340493440	/nfs/dbraw/zinc/49/34/40/1340493440.db2.gz	RUPAZPUMYXZLMA-LBPRGKRZSA-N	0	3	328.243	3.159	20	30		EGEDHN
C#CCCN1CCC[C@H]1CNC(=O)c1ccc(O[C@H](C)CC)cc1	ZINC001028247072	1340508304	/nfs/dbraw/zinc/50/83/04/1340508304.db2.gz	GEAQZHNJMMNSKH-AEFFLSMTSA-N	0	3	328.456	3.081	20	30		EGEDHN
C=C(C)CN1CCC[C@@H]1CNC(=O)[C@@H]1CCCc2sc(C)nc21	ZINC001028259267	1340517031	/nfs/dbraw/zinc/51/70/31/1340517031.db2.gz	LYYVZAVNCGRQCC-HUUCEWRRSA-N	0	3	333.501	3.028	20	30		EGEDHN
C=C(C)CN1CCC[C@H]1CNC(=O)c1cc(C)n(CC2CC2)c1C	ZINC001028264874	1340521321	/nfs/dbraw/zinc/52/13/21/1340521321.db2.gz	QBPXWJYJVBJNPT-SFHVURJKSA-N	0	3	329.488	3.285	20	30		EGEDHN
C#CCCN1CCC[C@@H]1CNC(=O)c1cc2cccc(Cl)c2o1	ZINC001028358534	1340592091	/nfs/dbraw/zinc/59/20/91/1340592091.db2.gz	XOEGYBBXSWJDRI-CQSZACIVSA-N	0	3	330.815	3.304	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H](CNC(=O)c3sccc3F)C2)c1	ZINC001028518862	1340682440	/nfs/dbraw/zinc/68/24/40/1340682440.db2.gz	ZTAVBEPIFXSNGS-HNNXBMFYSA-N	0	3	343.427	3.011	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@@H](CNC(=O)c3sccc3F)C2)cc1	ZINC001028519100	1340684599	/nfs/dbraw/zinc/68/45/99/1340684599.db2.gz	JSWSFENABIFOBV-HNNXBMFYSA-N	0	3	343.427	3.011	20	30		EGEDHN
C=CCn1cccc1C(=O)NC[C@H]1CCN(Cc2ccccc2F)C1	ZINC001028592645	1340717319	/nfs/dbraw/zinc/71/73/19/1340717319.db2.gz	ABWZBOIHGIEJIF-MRXNPFEDSA-N	0	3	341.430	3.065	20	30		EGEDHN
CC#CCN1CC[C@H](CNC(=O)c2cc(Cl)sc2Cl)C1	ZINC001028594116	1340719126	/nfs/dbraw/zinc/71/91/26/1340719126.db2.gz	BQDLABQXDXRUJS-SNVBAGLBSA-N	0	3	331.268	3.130	20	30		EGEDHN
CCc1ccc(C(=O)NC[C@H]2CCN(Cc3cccc(C#N)c3)C2)cc1	ZINC001028965722	1340895357	/nfs/dbraw/zinc/89/53/57/1340895357.db2.gz	MRVZIYSSQITCEA-HXUWFJFHSA-N	0	3	347.462	3.373	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)C1CCN(C(=O)CC2CC2)CC1	ZINC001029039691	1340914822	/nfs/dbraw/zinc/91/48/22/1340914822.db2.gz	FPZACFPAYLXZAR-HNNXBMFYSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@H](NCc1ccccc1C#N)C1CCN(C(=O)C2(C)CC2)CC1	ZINC001029104280	1340930932	/nfs/dbraw/zinc/93/09/32/1340930932.db2.gz	RSIGYSITYOFWBP-HNNXBMFYSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC(C)[C@H](F)C(=O)N1CCC([C@H](C)NCc2ccccc2C#N)CC1	ZINC001029132018	1340938781	/nfs/dbraw/zinc/93/87/81/1340938781.db2.gz	YXXGXUZZCMAZLZ-KXBFYZLASA-N	0	3	345.462	3.269	20	30		EGEDHN
C[C@H](C#N)C(=O)N1C[C@H]2CC[C@@H](C1)N2[C@@H]1CCCc2ccc(F)cc21	ZINC001029245062	1340960447	/nfs/dbraw/zinc/96/04/47/1340960447.db2.gz	ORCXJMLZVRJADW-UEILYKACSA-N	0	3	341.430	3.038	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1C[C@H]2CC[C@@H](C1)N2CCC[C@H]1CCOC1	ZINC001029456769	1340994335	/nfs/dbraw/zinc/99/43/35/1340994335.db2.gz	PQMHNRRDOHAIJX-PNYFIKQUSA-N	0	3	334.504	3.081	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCN(C(=O)c2ccsc2)C1	ZINC001029638975	1341029905	/nfs/dbraw/zinc/02/99/05/1341029905.db2.gz	ASSJHUAEJOOMNZ-CYBMUJFWSA-N	0	3	345.493	3.275	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@@H](CN(C)Cc2cncc(C)c2)C1	ZINC001029748329	1341062405	/nfs/dbraw/zinc/06/24/05/1341062405.db2.gz	BTPKARCVBFZBAE-INIZCTEOSA-N	0	3	349.906	3.449	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cc3c(cc(C)cc3C)[nH]2)CC[C@H]1C	ZINC001071712980	1354871250	/nfs/dbraw/zinc/87/12/50/1354871250.db2.gz	WZTWYAOSOQMRFF-IAGOWNOFSA-N	0	3	337.467	3.391	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc(-n3ccnc3)cc2)CC[C@H]1C	ZINC001071712509	1354871407	/nfs/dbraw/zinc/87/14/07/1354871407.db2.gz	PGOIKRMYSCARBP-SJLPKXTDSA-N	0	3	338.455	3.031	20	30		EGEDHN
CN(Cc1ccc(C#N)s1)C[C@H]1CCN(C(=O)[C@@]2(C)C=CCC2)C1	ZINC001029806461	1341080016	/nfs/dbraw/zinc/08/00/16/1341080016.db2.gz	LNRJATOXIQRHQR-BEFAXECRSA-N	0	3	343.496	3.256	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@H](CN(C)Cc2c(C)onc2CC)C1	ZINC001029826798	1341087993	/nfs/dbraw/zinc/08/79/93/1341087993.db2.gz	VWZQDMOCIKZBIJ-UZLBHIALSA-N	0	3	347.503	3.428	20	30		EGEDHN
C=C[C@@H](C(=O)N1CC[C@H](CN(C)Cc2cccnc2)C1)c1ccccc1	ZINC001029906835	1341111623	/nfs/dbraw/zinc/11/16/23/1341111623.db2.gz	AFGSYIKOVZJZID-TZIWHRDSSA-N	0	3	349.478	3.332	20	30		EGEDHN
C=C(C)CN1CCC[C@H](N(Cc2ccccc2)C(=O)[C@@H]2CCOC2)C1	ZINC001029918030	1341118079	/nfs/dbraw/zinc/11/80/79/1341118079.db2.gz	VHSLETJHUUKSDI-UXHICEINSA-N	0	3	342.483	3.092	20	30		EGEDHN
CN(Cc1cc(C#N)ccc1F)CC1CCN(C(=O)C2CCC2)CC1	ZINC001029923607	1341121231	/nfs/dbraw/zinc/12/12/31/1341121231.db2.gz	OAVKORWQYIJZKP-UHFFFAOYSA-N	0	3	343.446	3.168	20	30		EGEDHN
CCCC(=O)N1CCC(CN(C)Cc2ccc(C#N)cc2F)CC1	ZINC001029925710	1341122214	/nfs/dbraw/zinc/12/22/14/1341122214.db2.gz	JLKIYOLIQFNTRW-UHFFFAOYSA-N	0	3	331.435	3.168	20	30		EGEDHN
CC[C@@H](F)C(=O)N1CCC(CN(C)Cc2ccc(C#N)cc2F)CC1	ZINC001029984400	1341144181	/nfs/dbraw/zinc/14/41/81/1341144181.db2.gz	GMKQOEOWGQBDCU-QGZVFWFLSA-N	0	3	349.425	3.116	20	30		EGEDHN
C=C1CCC(C(=O)N2CCC(CN(C)Cc3cnoc3C)CC2)CC1	ZINC001029990422	1341148262	/nfs/dbraw/zinc/14/82/62/1341148262.db2.gz	LYTIHHIGGGABPB-UHFFFAOYSA-N	0	3	345.487	3.400	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)Cc1cccc2cnccc21	ZINC001032477047	1341519311	/nfs/dbraw/zinc/51/93/11/1341519311.db2.gz	FJHYCGXIRATVGG-OALUTQOASA-N	0	3	335.451	3.029	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cc(-c2cccs2)n[nH]1	ZINC001032642095	1341567439	/nfs/dbraw/zinc/56/74/39/1341567439.db2.gz	XOWUDSHWLRCQOS-KBPBESRZSA-N	0	3	342.468	3.003	20	30		EGEDHN
C#CCOc1ccc(C(=O)N2C[C@@H]3C[C@H]2CN3CCC(C)(C)C)cc1	ZINC001032670033	1341576979	/nfs/dbraw/zinc/57/69/79/1341576979.db2.gz	BHZRZEHYIAXYIO-ROUUACIJSA-N	0	3	340.467	3.034	20	30		EGEDHN
C=C(C)[C@@H]1OCCC[C@@H]1C(=O)N1C[C@@H]2C[C@H]1CN2CC1CC(C)(C)C1	ZINC001032673365	1341578572	/nfs/dbraw/zinc/57/85/72/1341578572.db2.gz	MMQBNLUPTUCSSF-VJANTYMQSA-N	0	3	346.515	3.079	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)C(C)(C)c1ccccc1F	ZINC001032683384	1341580788	/nfs/dbraw/zinc/58/07/88/1341580788.db2.gz	ALBKOCRQHBDFQH-HOTGVXAUSA-N	0	3	330.447	3.355	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1cnoc1-c1ccccc1	ZINC001032710261	1341587328	/nfs/dbraw/zinc/58/73/28/1341587328.db2.gz	ZDJJKORPMHWPSL-IRXDYDNUSA-N	0	3	337.423	3.207	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(COC(C)C)cc1	ZINC001032777621	1341611279	/nfs/dbraw/zinc/61/12/79/1341611279.db2.gz	KWUQMUPDGWDLBT-PMACEKPBSA-N	0	3	342.483	3.477	20	30		EGEDHN
C=C(C)CCN1C[C@@H]2C[C@H]1CN2C(=O)c1ccc(N(C)CCC)cc1	ZINC001032818025	1341626003	/nfs/dbraw/zinc/62/60/03/1341626003.db2.gz	XECRRMLUQUPTCY-PMACEKPBSA-N	0	3	341.499	3.398	20	30		EGEDHN
C=C(C)CCN1CC[C@H](N(C)C(=O)c2sc(Cl)nc2C)C1	ZINC001033124371	1341732798	/nfs/dbraw/zinc/73/27/98/1341732798.db2.gz	WTLWVMYGSXXTRJ-LBPRGKRZSA-N	0	3	327.881	3.217	20	30		EGEDHN
C#CCCN1CC[C@H](N(C)C(=O)c2cc(Cl)sc2Cl)C1	ZINC001033149014	1341740201	/nfs/dbraw/zinc/74/02/01/1341740201.db2.gz	HBFNECUZVLXRBL-JTQLQIEISA-N	0	3	331.268	3.225	20	30		EGEDHN
C=C1CCC(C(=O)N(C)[C@@H]2CCN(C[C@H]3CC(C)(C)CO3)C2)CC1	ZINC001033388283	1341807366	/nfs/dbraw/zinc/80/73/66/1341807366.db2.gz	AVRMKZBFZFKNSG-QZTJIDSGSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2cc(F)cc3cccnc32)C1	ZINC001033470152	1341839033	/nfs/dbraw/zinc/83/90/33/1341839033.db2.gz	UNLHPSGALIJPQI-INIZCTEOSA-N	0	3	327.403	3.096	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2cccc(N3CCCC3)c2)C1	ZINC001033525408	1341859005	/nfs/dbraw/zinc/85/90/05/1341859005.db2.gz	OHAHYMQFYZZYES-IBGZPJMESA-N	0	3	327.472	3.009	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(C)C(=O)c2cnn(C(C)C)c2C2CC2)C1	ZINC001033572607	1341878548	/nfs/dbraw/zinc/87/85/48/1341878548.db2.gz	VXBOGXFPJNXYRC-INIZCTEOSA-N	0	3	330.476	3.064	20	30		EGEDHN
C#CCCN1CC[C@@H](N(C)C(=O)CC2C3CC4CC(C3)CC2C4)C1	ZINC001033674866	1341940060	/nfs/dbraw/zinc/94/00/60/1341940060.db2.gz	DEMGPJDXJSBDMZ-RDOIFFKNSA-N	0	3	328.500	3.005	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cc(F)cc3ccncc32)C1	ZINC001033834147	1342033873	/nfs/dbraw/zinc/03/38/73/1342033873.db2.gz	TVOXJYUNOMBRDZ-QGZVFWFLSA-N	0	3	341.430	3.486	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2cc(C)c(OC)c(C)c2)C1	ZINC001033841794	1342037590	/nfs/dbraw/zinc/03/75/90/1342037590.db2.gz	ACOPNWCDFDKBHO-GOSISDBHSA-N	0	3	330.472	3.425	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)[C@@H]2CCc3cc(OC)ccc32)C1	ZINC001033853235	1342044599	/nfs/dbraw/zinc/04/45/99/1342044599.db2.gz	XHUFRQKJEJHULO-YLJYHZDGSA-N	0	3	342.483	3.224	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2cc(C)n(C(CC)CC)n2)C1	ZINC001033877422	1342055441	/nfs/dbraw/zinc/05/54/41/1342055441.db2.gz	FTDGYKCXXYZYLH-SFHVURJKSA-N	0	3	344.503	3.112	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)[C@H]2COc3ccc(Cl)cc32)C1	ZINC001033902084	1342075446	/nfs/dbraw/zinc/07/54/46/1342075446.db2.gz	XPOIEJCUTXLIFN-RDJZCZTQSA-N	0	3	348.874	3.315	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)c2ccc3c(c2)[C@H](C)CO3)C1	ZINC001033931203	1342094829	/nfs/dbraw/zinc/09/48/29/1342094829.db2.gz	DEDKKRZKTWHOKX-NVXWUHKLSA-N	0	3	328.456	3.295	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2cncc3sccc32)C1	ZINC001033932456	1342097151	/nfs/dbraw/zinc/09/71/51/1342097151.db2.gz	OBOCUUFFORZTDP-AWEZNQCLSA-N	0	3	329.469	3.409	20	30		EGEDHN
C#CCCN1CC[C@H](N(CC)C(=O)c2ccc(O[C@@H](C)CC)cc2)C1	ZINC001034014160	1342150429	/nfs/dbraw/zinc/15/04/29/1342150429.db2.gz	YMIDFAGLAZXRAC-HKUYNNGSSA-N	0	3	342.483	3.424	20	30		EGEDHN
C=C(C)CN1CC[C@H](N(CC)C(=O)c2ccnc(O[C@H](C)CC)c2)C1	ZINC001034014172	1342151137	/nfs/dbraw/zinc/15/11/37/1342151137.db2.gz	YSKTVCDIKASUCG-AEFFLSMTSA-N	0	3	345.487	3.371	20	30		EGEDHN
C#CCCN1CC[C@@H](N(CC)C(=O)[C@H]2CCCCc3ccccc32)C1	ZINC001034047527	1342187353	/nfs/dbraw/zinc/18/73/53/1342187353.db2.gz	FJLADAIGMMGENJ-CTNGQTDRSA-N	0	3	338.495	3.443	20	30		EGEDHN
C=CCCN1CC[C@H](N(CC)C(=O)c2cc(C3CCCC3)no2)C1	ZINC001034047030	1342187578	/nfs/dbraw/zinc/18/75/78/1342187578.db2.gz	BOMJOHAVMZUMHQ-INIZCTEOSA-N	0	3	331.460	3.445	20	30		EGEDHN
N#Cc1ccc(CN2CCCC[C@H](NC(=O)C[C@@H]3C=CCC3)C2)cc1	ZINC001034092193	1342232011	/nfs/dbraw/zinc/23/20/11/1342232011.db2.gz	URTTUDRHDJTSOG-XLIONFOSSA-N	0	3	337.467	3.385	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2csc([C@H]3CCCO3)n2)C1	ZINC001034206973	1342316932	/nfs/dbraw/zinc/31/69/32/1342316932.db2.gz	NSAXAVIWPFZSAU-GOEBONIOSA-N	0	3	349.500	3.155	20	30		EGEDHN
N#Cc1ccc(CN2CCCC[C@@H](NC(=O)C3C=CC=CC=C3)C2)cc1	ZINC001034237441	1342338585	/nfs/dbraw/zinc/33/85/85/1342338585.db2.gz	WEYMYMQDHFCXSW-OAQYLSRUSA-N	0	3	347.462	3.327	20	30		EGEDHN
C#CCCN1CCCC[C@@H](NC(=O)c2c(C)c(F)ccc2Cl)C1	ZINC001034278466	1342369223	/nfs/dbraw/zinc/36/92/23/1342369223.db2.gz	JOTQLYUWQLXFJI-CQSZACIVSA-N	0	3	336.838	3.395	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cc(C)n([C@H](C)C3CC3)n2)C1	ZINC001034280118	1342369661	/nfs/dbraw/zinc/36/96/61/1342369661.db2.gz	BPXDRYBDJCIEQB-SJLPKXTDSA-N	0	3	344.503	3.323	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccn(-c3ccccc3)n2)C1	ZINC001034281647	1342371419	/nfs/dbraw/zinc/37/14/19/1342371419.db2.gz	CSTNGAUWQRTEOQ-KRWDZBQOSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)c2cc3c([nH]2)c(F)ccc3C)C1	ZINC001034285599	1342373639	/nfs/dbraw/zinc/37/36/39/1342373639.db2.gz	SWINOAWPLLHESW-CQSZACIVSA-N	0	3	329.419	3.386	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2csc(C(F)(F)F)c2)C1	ZINC001034290894	1342376219	/nfs/dbraw/zinc/37/62/19/1342376219.db2.gz	NSJVFQLEZRZVFD-ZDUSSCGKSA-N	0	3	344.402	3.375	20	30		EGEDHN
C=CCN1CCCC[C@@H](NC(=O)Cn2c(C)cc3ccccc32)C1	ZINC001034303977	1342386762	/nfs/dbraw/zinc/38/67/62/1342386762.db2.gz	NYTGNFAUMBTPLN-GOSISDBHSA-N	0	3	325.456	3.106	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)[C@H]2CCc3ccc(F)cc3O2)C1	ZINC001034306051	1342389628	/nfs/dbraw/zinc/38/96/28/1342389628.db2.gz	BLLGIVHYQYIDBK-QZTJIDSGSA-N	0	3	346.446	3.066	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cc(C)nc3onc(C)c32)C1	ZINC001034329468	1342404070	/nfs/dbraw/zinc/40/40/70/1342404070.db2.gz	IKMKRXHMTSYLOH-HNNXBMFYSA-N	0	3	342.443	3.000	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2ccc3c(c2)[C@@H](C)CO3)C1	ZINC001034357877	1342429338	/nfs/dbraw/zinc/42/93/38/1342429338.db2.gz	FLTBPPUIGUUUME-RDJZCZTQSA-N	0	3	328.456	3.343	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCCCN(Cc3ccc(CO)cc3)C2)C1	ZINC001034390044	1342459892	/nfs/dbraw/zinc/45/98/92/1342459892.db2.gz	WZPCSLQZKPWRLX-IBGZPJMESA-N	0	3	342.483	3.006	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cccc(N3CC=CC3)c2)C1	ZINC001034415350	1342477287	/nfs/dbraw/zinc/47/72/87/1342477287.db2.gz	HCXWONQYMMIZTJ-IBGZPJMESA-N	0	3	339.483	3.223	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2noc3c2CCCCC3)C1	ZINC001034425155	1342487210	/nfs/dbraw/zinc/48/72/10/1342487210.db2.gz	ZYBUQFUWOAYKGP-HNNXBMFYSA-N	0	3	331.460	3.104	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cnc(C(C)C)nc2C)C1	ZINC001034430786	1342492557	/nfs/dbraw/zinc/49/25/57/1342492557.db2.gz	ZPFRRWYRMNKZED-MRXNPFEDSA-N	0	3	330.476	3.069	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)C(C)(C)c2ccccc2F)C1	ZINC001034447890	1342508088	/nfs/dbraw/zinc/50/80/88/1342508088.db2.gz	LIDSGIHRTCNSQJ-INIZCTEOSA-N	0	3	330.447	3.097	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2csc(-c3ccoc3)n2)C1	ZINC001034449056	1342509670	/nfs/dbraw/zinc/50/96/70/1342509670.db2.gz	VDXVAIHANQIZIH-HNNXBMFYSA-N	0	3	343.452	3.011	20	30		EGEDHN
C#CCCN1CCCC[C@H](NC(=O)c2ccc3nc(C)sc3c2)C1	ZINC001034472171	1342526580	/nfs/dbraw/zinc/52/65/80/1342526580.db2.gz	RKGOETBKHIWMGO-INIZCTEOSA-N	0	3	341.480	3.212	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cc(C(F)(F)F)ccn2)C1	ZINC001034471567	1342526980	/nfs/dbraw/zinc/52/69/80/1342526980.db2.gz	JIQODWCLYFTZIZ-CQSZACIVSA-N	0	3	341.377	3.261	20	30		EGEDHN
C=C(C)CN1CCCC[C@H](NC(=O)c2cc(-n3cccc3)ccn2)C1	ZINC001034479134	1342534829	/nfs/dbraw/zinc/53/48/29/1342534829.db2.gz	SEJYPBAZRDQXRC-KRWDZBQOSA-N	0	3	338.455	3.033	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2c(F)ccc(OC)c2F)C1	ZINC001034497560	1342554541	/nfs/dbraw/zinc/55/45/41/1342554541.db2.gz	XNBHGXYXYWGAIB-CYBMUJFWSA-N	0	3	338.398	3.134	20	30		EGEDHN
C=CCN1CCCC[C@H](NC(=O)c2ccc(C(F)(F)F)cc2)C1	ZINC001034507561	1342565535	/nfs/dbraw/zinc/56/55/35/1342565535.db2.gz	QUHPVKYNTJPTMC-HNNXBMFYSA-N	0	3	326.362	3.476	20	30		EGEDHN
C=C(C)CN1CCCC[C@@H](NC(=O)c2cc(NC(C)=O)ccc2C)C1	ZINC001034552181	1342615174	/nfs/dbraw/zinc/61/51/74/1342615174.db2.gz	ZUYBCPDPTIHHOS-GOSISDBHSA-N	0	3	343.471	3.114	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CC[C@H](N[C@@H](C)c3cnccn3)CC2)CC1	ZINC001034722461	1342715985	/nfs/dbraw/zinc/71/59/85/1342715985.db2.gz	AFXJUJPRRYEFKU-SZMVWBNQSA-N	0	3	342.487	3.301	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)c2cccc(OC)c2)C12CCC2	ZINC001078793651	1357087953	/nfs/dbraw/zinc/08/79/53/1357087953.db2.gz	ZNVCXKIBMOLLMW-CVEARBPZSA-N	0	3	334.847	3.078	20	30		EGEDHN
CC(C)(C)CC(=O)N1CCC[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001034861259	1342810519	/nfs/dbraw/zinc/81/05/19/1342810519.db2.gz	PCBUWXMQQPNJCT-MRXNPFEDSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@H](NC(=O)Cc2ccc(F)cc2)C12CCC2	ZINC001078796563	1357089851	/nfs/dbraw/zinc/08/98/51/1357089851.db2.gz	BJQCGKAVMFJCTD-CVEARBPZSA-N	0	3	336.838	3.138	20	30		EGEDHN
CC1(C)CC[C@@H]1C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)s1	ZINC001035021641	1342881478	/nfs/dbraw/zinc/88/14/78/1342881478.db2.gz	HPLNXALWZNQLNR-CZUORRHYSA-N	0	3	331.485	3.137	20	30		EGEDHN
CC1(C)CC[C@@H]1C(=O)N1CCC[C@@H]1CNCc1ccc(C#N)cc1F	ZINC001035023227	1342881943	/nfs/dbraw/zinc/88/19/43/1342881943.db2.gz	YNGKOWOJFGXEIG-IAGOWNOFSA-N	0	3	343.446	3.214	20	30		EGEDHN
CC(C)(C)C(=O)N1CCC2(CCN(CC#Cc3ccccc3)C2)CC1	ZINC001035249415	1343073221	/nfs/dbraw/zinc/07/32/21/1343073221.db2.gz	MBMVYAKJNGNOJM-UHFFFAOYSA-N	0	3	338.495	3.399	20	30		EGEDHN
CC[C@@H](c1ccc(F)cc1)N1CC2(C1)CCN(C(=O)[C@H](C)C#N)CC2	ZINC001035667911	1343129170	/nfs/dbraw/zinc/12/91/70/1343129170.db2.gz	AWMHXFJPYBPYHI-QAPCUYQASA-N	0	3	343.446	3.361	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc(C(C)(C)C)on1)CC2	ZINC001035746524	1343166194	/nfs/dbraw/zinc/16/61/94/1343166194.db2.gz	VXCHEOLJNOROJD-UHFFFAOYSA-N	0	3	331.460	3.086	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cnc3ccccc3c1C)CC2	ZINC001035753904	1343171925	/nfs/dbraw/zinc/17/19/25/1343171925.db2.gz	YYFQADLDEPIHOA-UHFFFAOYSA-N	0	3	347.462	3.105	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC2(CN(CCOC3CCC3)C2)CC1	ZINC001035765471	1343177382	/nfs/dbraw/zinc/17/73/82/1343177382.db2.gz	AMFMJWYFWNICDA-UHFFFAOYSA-N	0	3	334.504	3.082	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@H]1[C@@H]3CCCCCC[C@@H]31)CC2	ZINC001035803425	1343205596	/nfs/dbraw/zinc/20/55/96/1343205596.db2.gz	GDUROPLNAJXWLN-BWTSREIZSA-N	0	3	328.500	3.151	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)[C@H](C)Cc1cccs1)CC2	ZINC001035806070	1343207642	/nfs/dbraw/zinc/20/76/42/1343207642.db2.gz	RARPBJSUOOWIQW-MRXNPFEDSA-N	0	3	332.513	3.427	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)c1cc([C@H](C)CC)no1)CC2	ZINC001035813434	1343212443	/nfs/dbraw/zinc/21/24/43/1343212443.db2.gz	HVVOBTYEAFVOCO-OAHLLOKOSA-N	0	3	331.460	3.302	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1cccc(C)c1Cl)CC2	ZINC001035817290	1343213868	/nfs/dbraw/zinc/21/38/68/1343213868.db2.gz	FGBYFAFAGLQOLN-UHFFFAOYSA-N	0	3	330.859	3.210	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)C[C@H](C)c1ccccc1F)CC2	ZINC001035818326	1343213952	/nfs/dbraw/zinc/21/39/52/1343213952.db2.gz	RUVLYFKREFIEAW-KRWDZBQOSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)c1ccccc1OC(C)C)CC2	ZINC001035840029	1343222445	/nfs/dbraw/zinc/22/24/45/1343222445.db2.gz	NCAVMJCXGNRBBL-UHFFFAOYSA-N	0	3	340.467	3.035	20	30		EGEDHN
C=C(C)CN1CC2(C1)CCN(C(=O)C[C@@H]1OCc3ccccc31)CC2	ZINC001035845323	1343226560	/nfs/dbraw/zinc/22/65/60/1343226560.db2.gz	MMZBLIAWCGRCAM-IBGZPJMESA-N	0	3	340.467	3.149	20	30		EGEDHN
C#CCCN1CC2(C1)CCN(C(=O)[C@H](C)Cc1ccccc1C)CC2	ZINC001035859516	1343235926	/nfs/dbraw/zinc/23/59/26/1343235926.db2.gz	CFHBWYWMTUGXNA-LJQANCHMSA-N	0	3	338.495	3.121	20	30		EGEDHN
Cc1occc1C(=O)N1CC[C@H](NCc2ccccc2C#N)[C@@H](C)C1	ZINC001035908449	1343264530	/nfs/dbraw/zinc/26/45/30/1343264530.db2.gz	HCEKIKLUARMSCJ-LIRRHRJNSA-N	0	3	337.423	3.100	20	30		EGEDHN
CCC(CC)C(=O)N1CC[C@H](NCc2ccccc2C#N)[C@H](C)C1	ZINC001035918857	1343272423	/nfs/dbraw/zinc/27/24/23/1343272423.db2.gz	KIMSDBTVOIMIKR-BEFAXECRSA-N	0	3	327.472	3.321	20	30		EGEDHN
Cc1ccoc1C(=O)N1CC[C@@H](NCc2ccccc2C#N)[C@@H](C)C1	ZINC001035924524	1343274928	/nfs/dbraw/zinc/27/49/28/1343274928.db2.gz	SHRIULCONHRWFW-MAUKXSAKSA-N	0	3	337.423	3.100	20	30		EGEDHN
C[C@H]1CN(C(=O)CC2(C)CC2)CC[C@H]1NCc1cc(F)ccc1C#N	ZINC001036125501	1343318875	/nfs/dbraw/zinc/31/88/75/1343318875.db2.gz	WOGJHFKXFJTWCI-KBXCAEBGSA-N	0	3	343.446	3.214	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](NCc2nc(C)cs2)[C@@H](C)C1	ZINC001036139641	1343324360	/nfs/dbraw/zinc/32/43/60/1343324360.db2.gz	ZXGJZKADFCXEIN-ZFWWWQNUSA-N	0	3	335.517	3.380	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](NCc2nc(C)sc2C)[C@@H](C)C1	ZINC001036142803	1343326199	/nfs/dbraw/zinc/32/61/99/1343326199.db2.gz	LNSPPEPQVZVTST-SWLSCSKDSA-N	0	3	335.517	3.299	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](NCc2ccccc2C#N)[C@H](C)C1	ZINC001036144939	1343327750	/nfs/dbraw/zinc/32/77/50/1343327750.db2.gz	VVMCVJSDTCAERI-CRAIPNDOSA-N	0	3	325.456	3.097	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H](NCc3ccccc3C#N)[C@@H](C)C2)C1	ZINC001036171039	1343344080	/nfs/dbraw/zinc/34/40/80/1343344080.db2.gz	VVRYXBYQOPDUSQ-LPHOPBHVSA-N	0	3	337.467	3.241	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]([C@@H](C)NCc2cc(C3CC3)no2)C1	ZINC001036429396	1343481832	/nfs/dbraw/zinc/48/18/32/1343481832.db2.gz	ULYDERLUODWTER-GDBMZVCRSA-N	0	3	345.487	3.481	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]([C@@H](C)NCc2nccs2)C1	ZINC001036430361	1343482863	/nfs/dbraw/zinc/48/28/63/1343482863.db2.gz	AGEJBZNNVJFRAJ-HUUCEWRRSA-N	0	3	335.517	3.462	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CCC[C@@H]([C@@H](C)NCc2cc(C)no2)C1	ZINC001036442233	1343489947	/nfs/dbraw/zinc/48/99/47/1343489947.db2.gz	SKUGOCPJGIJOKD-HZPDHXFCSA-N	0	3	333.476	3.302	20	30		EGEDHN
Cc1ccc(F)c(CNC[C@H]2[C@H](C)CCCN2C(=O)C#CC2CC2)c1	ZINC001036550238	1343549504	/nfs/dbraw/zinc/54/95/04/1343549504.db2.gz	RLSKENRCYRPTSQ-UZLBHIALSA-N	0	3	342.458	3.264	20	30		EGEDHN
CCCC(=O)N1CC[C@@H]2[C@H](CCN2CC#Cc2ccc(Cl)cc2)C1	ZINC001036624612	1343582678	/nfs/dbraw/zinc/58/26/78/1343582678.db2.gz	TXJXJIFHTPURPK-IEBWSBKVSA-N	0	3	344.886	3.414	20	30		EGEDHN
CC(C)C(=O)N1CC[C@@H]2[C@H](CCN2CC#Cc2ccc(Cl)cc2)C1	ZINC001036649172	1343599280	/nfs/dbraw/zinc/59/92/80/1343599280.db2.gz	SRECQZBIAGUUTO-IEBWSBKVSA-N	0	3	344.886	3.270	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@H]2[C@H](CCN2CC#Cc2ccccc2)C1	ZINC001036792008	1343722986	/nfs/dbraw/zinc/72/29/86/1343722986.db2.gz	IVEDLTUHRODLNT-UXHICEINSA-N	0	3	336.479	3.173	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2cnc(C)o2)C1	ZINC001036793495	1343725479	/nfs/dbraw/zinc/72/54/79/1343725479.db2.gz	GIGMQDPOHZJTAV-DOTOQJQBSA-N	0	3	331.460	3.008	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]2[C@H](CCN2Cc2cc(C)ns2)C1	ZINC001036794186	1343726504	/nfs/dbraw/zinc/72/65/04/1343726504.db2.gz	QUIYFKDRUISZKD-WBVHZDCISA-N	0	3	347.528	3.477	20	30		EGEDHN
CC(C)(C)C(=O)N1CC[C@@H]2[C@@H](CCN2Cc2ccccc2C#N)C1	ZINC001036875494	1343813817	/nfs/dbraw/zinc/81/38/17/1343813817.db2.gz	BJZBVYCVAZSSIF-ZWKOTPCHSA-N	0	3	325.456	3.027	20	30		EGEDHN
CC1(C)CC(C(=O)N[C@@H]2CCC[C@H]2CNCc2ccccc2C#N)C1	ZINC001037001890	1343920449	/nfs/dbraw/zinc/92/04/49/1343920449.db2.gz	AENKNNQNXFTZJN-PKOBYXMFSA-N	0	3	339.483	3.369	20	30		EGEDHN
CC1(C)CC(C(=O)N[C@H]2CCC[C@H]2CNCc2ccccc2C#N)C1	ZINC001037001887	1343920550	/nfs/dbraw/zinc/92/05/50/1343920550.db2.gz	AENKNNQNXFTZJN-HKUYNNGSSA-N	0	3	339.483	3.369	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCCC[C@@H]2CNCc2cnc(C)o2)C1	ZINC001037244550	1344065170	/nfs/dbraw/zinc/06/51/70/1344065170.db2.gz	ZPNVRFJKOLWFEO-WBVHZDCISA-N	0	3	331.460	3.104	20	30		EGEDHN
C/C=C(\C)C(=O)N1CC[C@H](NCc2cc(F)ccc2C#N)[C@@H](CC)C1	ZINC001037822108	1344118966	/nfs/dbraw/zinc/11/89/66/1344118966.db2.gz	MSZPZRZZIFBXNS-QGFYBQKZSA-N	0	3	343.446	3.380	20	30		EGEDHN
CC[C@@H]1CN(C(=O)C(C)(C)C)CC[C@@H]1NCc1cc(F)ccc1C#N	ZINC001037964146	1344207497	/nfs/dbraw/zinc/20/74/97/1344207497.db2.gz	XLJFPZQCWOHMPA-KDOFPFPSSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CNC(=O)c1coc2c1cccc2OC	ZINC001038248038	1344342788	/nfs/dbraw/zinc/34/27/88/1344342788.db2.gz	LKUOSWQMUNXPMC-CQSZACIVSA-N	0	3	328.412	3.212	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CNC(=O)c1cn(CC)c2ccccc12	ZINC001038478941	1344443105	/nfs/dbraw/zinc/44/31/05/1344443105.db2.gz	YCZGZLXFLFJEOD-INIZCTEOSA-N	0	3	325.456	3.432	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@@H](NC(=O)c2cc(Cl)cs2)[C@H](OC)C1	ZINC001213529115	1372920849	/nfs/dbraw/zinc/92/08/49/1372920849.db2.gz	LPCUWJXZUXGBKG-MRVWCRGKSA-N	0	3	342.892	3.185	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H](C)C(C)C)CC[C@H]1c1ccc(F)cc1	ZINC001079160548	1357198558	/nfs/dbraw/zinc/19/85/58/1357198558.db2.gz	ZVUGKFXGCUKZTE-AYOQOUSVSA-N	0	3	330.447	3.025	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C(C)=C2CCCC2)C[C@H]1c1cccc(F)c1	ZINC001079177572	1357201916	/nfs/dbraw/zinc/20/19/16/1357201916.db2.gz	AIXOAANFYBTURI-VQTJNVASSA-N	0	3	340.442	3.233	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](C2CCN(C(=O)c3ccns3)CC2)C1	ZINC001039140151	1344820742	/nfs/dbraw/zinc/82/07/42/1344820742.db2.gz	CECJIVLFSCSAAL-CQSZACIVSA-N	0	3	339.892	3.070	20	30		EGEDHN
C#CCN1CC[C@H]([C@H]2CCCCN2C(=O)CCc2ccc(F)cc2)C1	ZINC001039218441	1344935572	/nfs/dbraw/zinc/93/55/72/1344935572.db2.gz	MFYDDBBLGJBVNF-AZUAARDMSA-N	0	3	342.458	3.095	20	30		EGEDHN
CC#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc3ccccn3c2)C1	ZINC001039235821	1344956942	/nfs/dbraw/zinc/95/69/42/1344956942.db2.gz	RGJOUCGDPDEZCZ-RXVVDRJESA-N	0	3	349.478	3.279	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccc3cc[nH]c3c2)C1	ZINC001039236479	1344957991	/nfs/dbraw/zinc/95/79/91/1344957991.db2.gz	CQQWCSKDXZHSHU-UYAOXDASSA-N	0	3	335.451	3.118	20	30		EGEDHN
C#CCN1CC[C@@H]([C@@H]2CCCCN2C(=O)c2cccc3cnccc32)C1	ZINC001039243348	1344970700	/nfs/dbraw/zinc/97/07/00/1344970700.db2.gz	UPZQSHCAZKPJOV-NQIIRXRSSA-N	0	3	347.462	3.185	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCCC[C@@H]2[C@H]2CCN(CC#CC)C2)cc1	ZINC001039246797	1344976337	/nfs/dbraw/zinc/97/63/37/1344976337.db2.gz	UPBVJKHNDREUDJ-LEWJYISDSA-N	0	3	334.463	3.008	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(Cl)cc2)C1	ZINC001039247592	1344976960	/nfs/dbraw/zinc/97/69/60/1344976960.db2.gz	XLZCIOPXVJBOAO-SJLPKXTDSA-N	0	3	330.859	3.290	20	30		EGEDHN
C#CCN1CC[C@@H]([C@H]2CCCCN2C(=O)c2cc(CC(C)C)c[nH]2)C1	ZINC001039247830	1344977662	/nfs/dbraw/zinc/97/76/62/1344977662.db2.gz	XYWXBFLYQWZAQR-UYAOXDASSA-N	0	3	341.499	3.163	20	30		EGEDHN
CC#CCN1CC[C@H]([C@H]2CCCCN2C(=O)c2ccc(F)s2)C1	ZINC001039250455	1344981148	/nfs/dbraw/zinc/98/11/48/1344981148.db2.gz	KWJLNKWOBXTNNN-LSDHHAIUSA-N	0	3	334.460	3.227	20	30		EGEDHN
C#CCN1CC[C@H]([C@@H]2CCCCN2C(=O)c2cc3sccc3[nH]2)C1	ZINC001039256534	1344985944	/nfs/dbraw/zinc/98/59/44/1344985944.db2.gz	LAPLBOYJGWVQSC-YOEHRIQHSA-N	0	3	341.480	3.179	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc2nc(C)oc2c1	ZINC001039389825	1345040841	/nfs/dbraw/zinc/04/08/41/1345040841.db2.gz	LSNFBBKVBOPKBV-SJORKVTESA-N	0	3	339.439	3.391	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(C)c(OC)c1	ZINC001039402422	1345048161	/nfs/dbraw/zinc/04/81/61/1345048161.db2.gz	WRPMRFAMDKNNSO-MSOLQXFVSA-N	0	3	328.456	3.259	20	30		EGEDHN
C=CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1c(C)noc1C1CC1	ZINC001039406667	1345051513	/nfs/dbraw/zinc/05/15/13/1345051513.db2.gz	DGVRBLPUKQHDPO-CVEARBPZSA-N	0	3	329.444	3.115	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)c1c(F)cccc1F	ZINC001039406326	1345051539	/nfs/dbraw/zinc/05/15/39/1345051539.db2.gz	PJFRAGCIYGXKOK-XHSDSOJGSA-N	0	3	346.421	3.157	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc2cc(C)ccc2[nH]1	ZINC001039414253	1345056228	/nfs/dbraw/zinc/05/62/28/1345056228.db2.gz	SUGLWTSJOINWBV-MSOLQXFVSA-N	0	3	335.451	3.179	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@H](CC)Cc1ccccc1	ZINC001039445887	1345070653	/nfs/dbraw/zinc/07/06/53/1345070653.db2.gz	KWRMZPQSSHJXOQ-NJYVYQBISA-N	0	3	338.495	3.344	20	30		EGEDHN
C=CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1oc(CC(C)C)nc1C	ZINC001039448606	1345073413	/nfs/dbraw/zinc/07/34/13/1345073413.db2.gz	YGPBSKZNTHJUDP-SJORKVTESA-N	0	3	345.487	3.437	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1cc2c([nH]1)CCCC2	ZINC001039459246	1345078681	/nfs/dbraw/zinc/07/86/81/1345078681.db2.gz	MRUNNUZEEXYEDQ-SJORKVTESA-N	0	3	327.472	3.149	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Cc1c(F)cccc1Cl	ZINC001039461834	1345080725	/nfs/dbraw/zinc/08/07/25/1345080725.db2.gz	LWXOHAWIRIUXSO-CABCVRRESA-N	0	3	348.849	3.110	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](CC)c1ccc(F)cc1	ZINC001039475326	1345090390	/nfs/dbraw/zinc/09/03/90/1345090390.db2.gz	OVFKBCUJPJXJIX-AABGKKOBSA-N	0	3	342.458	3.408	20	30		EGEDHN
C#CCCN1CC[C@H]2CC[C@@H](C1)N2C(=O)c1csc(CC(C)C)n1	ZINC001039476741	1345091378	/nfs/dbraw/zinc/09/13/78/1345091378.db2.gz	LKUZWAKGDLANDM-CVEARBPZSA-N	0	3	345.512	3.044	20	30		EGEDHN
N#Cc1cc(C(=O)N2C[C@H]3CCC[C@@H](C2)N3CCCC2CCC2)c[nH]1	ZINC001039552229	1345140500	/nfs/dbraw/zinc/14/05/00/1345140500.db2.gz	ZXPCWXCUMGFINH-KDURUIRLSA-N	0	3	340.471	3.146	20	30		EGEDHN
C=C1CC(C)(C(=O)N2C[C@H]3CCC[C@@H](C2)N3C[C@H]2CCO[C@@H](C)C2)C1	ZINC001039906201	1345243741	/nfs/dbraw/zinc/24/37/41/1345243741.db2.gz	JBEPRSZZLLEWKD-CADBVGFASA-N	0	3	346.515	3.223	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@]3(CCN(C(=O)C4CCC4)C3)C2)cc1	ZINC001040035461	1345300578	/nfs/dbraw/zinc/30/05/78/1345300578.db2.gz	NJSOOANBXOTCHS-NRFANRHFSA-N	0	3	337.467	3.173	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@]3(CCN(C(=O)c4ccco4)C3)C2)cc1	ZINC001040044059	1345308213	/nfs/dbraw/zinc/30/82/13/1345308213.db2.gz	PBJBASYUKCTBSI-NRFANRHFSA-N	0	3	349.434	3.280	20	30		EGEDHN
N#Cc1cccc(CN2CCC[C@]3(CCN(C(=O)c4ccoc4)C3)C2)c1	ZINC001040069002	1345320273	/nfs/dbraw/zinc/32/02/73/1345320273.db2.gz	ADMCMIPQUOFNPR-NRFANRHFSA-N	0	3	349.434	3.280	20	30		EGEDHN
Cc1cc(F)ccc1CN1CCC[C@]2(CCN(C(=O)[C@@H](C)C#N)C2)C1	ZINC001040128185	1345343529	/nfs/dbraw/zinc/34/35/29/1345343529.db2.gz	XLPAUYPCGPMMBP-JXFKEZNVSA-N	0	3	343.446	3.108	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3ccc(C(C)(C)C)cn3)C2)C1	ZINC001040210994	1345376809	/nfs/dbraw/zinc/37/68/09/1345376809.db2.gz	WSOZQHWPJYNNPW-OAQYLSRUSA-N	0	3	341.499	3.493	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)Cc3c(C)cccc3C)C2)C1	ZINC001040224625	1345383609	/nfs/dbraw/zinc/38/36/09/1345383609.db2.gz	MWMPBNQJZZYZTE-QFIPXVFZSA-N	0	3	338.495	3.184	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)C3(C)CCC(F)(F)CC3)C2)C1	ZINC001040264919	1345402446	/nfs/dbraw/zinc/40/24/46/1345402446.db2.gz	UDSBTNJZJJKWIL-GOSISDBHSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)Cc3cccc(C(C)C)c3)C2)C1	ZINC001040279978	1345408774	/nfs/dbraw/zinc/40/87/74/1345408774.db2.gz	BUDHFCABADRVCY-JOCHJYFZSA-N	0	3	338.495	3.300	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)Cc3c(C)cccc3Cl)C2)C1	ZINC001040280337	1345408927	/nfs/dbraw/zinc/40/89/27/1345408927.db2.gz	DRECABQDHFPRMI-HXUWFJFHSA-N	0	3	344.886	3.139	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cc(C)ccc3OC)C2)C1	ZINC001040281244	1345409585	/nfs/dbraw/zinc/40/95/85/1345409585.db2.gz	BDENOMCCKDMMQY-HXUWFJFHSA-N	0	3	328.456	3.118	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(C)c4cccnc34)C2)C1	ZINC001040299862	1345419844	/nfs/dbraw/zinc/41/98/44/1345419844.db2.gz	GWBUDYRKJWLLMY-JOCHJYFZSA-N	0	3	347.462	3.105	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cccc4ncccc43)C2)C1	ZINC001040320491	1345430467	/nfs/dbraw/zinc/43/04/67/1345430467.db2.gz	RGPZSVOAEPTZDD-JOCHJYFZSA-N	0	3	347.462	3.186	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cc[nH]c3C(C)C)C2)C1	ZINC001040346261	1345444886	/nfs/dbraw/zinc/44/48/86/1345444886.db2.gz	AFHHNULUKAOWMD-FQEVSTJZSA-N	0	3	327.472	3.090	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CC[C@@]2(C1)CCCN(Cc1cccnc1)C2	ZINC001040370913	1345460120	/nfs/dbraw/zinc/46/01/20/1345460120.db2.gz	FKWRHVJPPHZJRS-RTWAWAEBSA-N	0	3	341.499	3.498	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@H]3CCCC(F)(F)C3)C2)C1	ZINC001040392049	1345473052	/nfs/dbraw/zinc/47/30/52/1345473052.db2.gz	SPZMINLTCXOOBJ-WMZOPIPTSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)c3cccc4[nH]ccc43)C2)C1	ZINC001040416083	1345485453	/nfs/dbraw/zinc/48/54/53/1345485453.db2.gz	UBMHXSRSOOMGCF-NRFANRHFSA-N	0	3	335.451	3.119	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cc(C)ccc3F)C2)C1	ZINC001040417595	1345486210	/nfs/dbraw/zinc/48/62/10/1345486210.db2.gz	GVCQWONDHWPBEU-HXUWFJFHSA-N	0	3	328.431	3.086	20	30		EGEDHN
C#CCN1CCC[C@]2(CCN(C(=O)[C@@H](c3ccccc3)C(C)C)C2)C1	ZINC001040417408	1345486298	/nfs/dbraw/zinc/48/62/98/1345486298.db2.gz	FWPRNDDCYDRQRO-IRLDBZIGSA-N	0	3	338.495	3.374	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3oc(CC(C)C)nc3C)C2)C1	ZINC001040436357	1345499222	/nfs/dbraw/zinc/49/92/22/1345499222.db2.gz	VKUSPYNWVIBJRK-HXUWFJFHSA-N	0	3	345.487	3.296	20	30		EGEDHN
CC#CCN1CCC[C@]2(CCN(C(=O)[C@@H](C)c3cc(C)oc3C)C2)C1	ZINC001040451619	1345507375	/nfs/dbraw/zinc/50/73/75/1345507375.db2.gz	GBJJVYZSHZMWKE-UWJYYQICSA-N	0	3	342.483	3.338	20	30		EGEDHN
C=CCN1CCC[C@]2(CCN(C(=O)c3ncoc3C(C)(C)C)C2)C1	ZINC001040489138	1345516586	/nfs/dbraw/zinc/51/65/86/1345516586.db2.gz	NHQPBCDELUSJPR-IBGZPJMESA-N	0	3	331.460	3.086	20	30		EGEDHN
C=CCN1CCC[C@@]2(CCN(C(=O)c3cc(Cl)ccc3OC)C2)C1	ZINC001040518527	1345529523	/nfs/dbraw/zinc/52/95/23/1345529523.db2.gz	AYDGLKQFAYNFHN-LJQANCHMSA-N	0	3	348.874	3.463	20	30		EGEDHN
CC#CCN1CCC[C@@]2(CCN(C(=O)c3cc4ccccc4[nH]3)C2)C1	ZINC001040521900	1345531563	/nfs/dbraw/zinc/53/15/63/1345531563.db2.gz	DGXYHECTAANZSW-OAQYLSRUSA-N	0	3	335.451	3.119	20	30		EGEDHN
C#CCN1CCC[C@@]2(CCN(C(=O)c3ccc(CC(C)C)cc3)C2)C1	ZINC001040524887	1345533212	/nfs/dbraw/zinc/53/32/12/1345533212.db2.gz	NOXOUAGLFYCFGY-JOCHJYFZSA-N	0	3	338.495	3.446	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)N1CCC2(C1)CCN(Cc1cccc(C#N)c1)CC2	ZINC001040590236	1345551358	/nfs/dbraw/zinc/55/13/58/1345551358.db2.gz	OJAWDIPTBYDSFA-LPHOPBHVSA-N	0	3	337.467	3.029	20	30		EGEDHN
C=C(C)CC[NH+]1CCC2(CCN(C(=O)c3ccccc3[O-])C2)CC1	ZINC001040614516	1345556581	/nfs/dbraw/zinc/55/65/81/1345556581.db2.gz	GLMOMVAAXLFHQB-UHFFFAOYSA-N	0	3	328.456	3.287	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3coc4c3cccc4C)C2)CC1	ZINC001040729734	1345571747	/nfs/dbraw/zinc/57/17/47/1345571747.db2.gz	OXDZCSQWVBTZCQ-UHFFFAOYSA-N	0	3	336.435	3.303	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)Cc3cccc(C(F)F)c3)C2)CC1	ZINC001040772323	1345577405	/nfs/dbraw/zinc/57/74/05/1345577405.db2.gz	XEVPJPRXMVZUME-UHFFFAOYSA-N	0	3	346.421	3.114	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)C3CCC(F)(F)CC3)C2)CC1	ZINC001040864633	1345589723	/nfs/dbraw/zinc/58/97/23/1345589723.db2.gz	HLLMXNVBLDKTPO-UHFFFAOYSA-N	0	3	338.442	3.150	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3[nH]ccc3-c3ccccc3)C2)CC1	ZINC001040912558	1345598765	/nfs/dbraw/zinc/59/87/65/1345598765.db2.gz	QRILOYQOEMKFEF-UHFFFAOYSA-N	0	3	347.462	3.243	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)C(C)(C)c3ccc(C)cc3)C2)CC1	ZINC001040919193	1345599848	/nfs/dbraw/zinc/59/98/48/1345599848.db2.gz	IYWOHDJHSIXLHO-UHFFFAOYSA-N	0	3	338.495	3.220	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccc(F)cc3Cl)C2)CC1	ZINC001040928972	1345602668	/nfs/dbraw/zinc/60/26/68/1345602668.db2.gz	FMCXCWRZXRJNPI-UHFFFAOYSA-N	0	3	348.849	3.431	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3cccc4ccccc43)C2)CC1	ZINC001040929446	1345603353	/nfs/dbraw/zinc/60/33/53/1345603353.db2.gz	PGRXBSAGEZOJOH-UHFFFAOYSA-N	0	3	332.447	3.401	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)c3ccc4c(c3)CCC4)C2)CC1	ZINC001040936072	1345604877	/nfs/dbraw/zinc/60/48/77/1345604877.db2.gz	UALNTNHDBFTGKH-UHFFFAOYSA-N	0	3	336.479	3.127	20	30		EGEDHN
C#CCN1CCC2(CCN(C(=O)c3c[nH]cc3-c3ccccc3)C2)CC1	ZINC001040938387	1345605123	/nfs/dbraw/zinc/60/51/23/1345605123.db2.gz	DQJIJONVKISPNZ-UHFFFAOYSA-N	0	3	347.462	3.243	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@@H](C)c3ccccc3C)C2)CC1	ZINC001040946714	1345606854	/nfs/dbraw/zinc/60/68/54/1345606854.db2.gz	GJJNHBFHCKKTFI-IBGZPJMESA-N	0	3	338.495	3.436	20	30		EGEDHN
CC#CCN1CCC2(CCN(C(=O)[C@H]3CC4CCC3CC4)C2)CC1	ZINC001040952977	1345608790	/nfs/dbraw/zinc/60/87/90/1345608790.db2.gz	HPSAPZUPLNDNBJ-ACBHZAAOSA-N	0	3	328.500	3.151	20	30		EGEDHN
Cc1occc1C(=O)N1CC[C@@]2(CCN(Cc3cccc(C#N)c3)C2)C1	ZINC001041058585	1345640042	/nfs/dbraw/zinc/64/00/42/1345640042.db2.gz	ZGBOENNXGSFLPR-OAQYLSRUSA-N	0	3	349.434	3.198	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N1CC[C@]2(CCN(C[C@@H](F)CC)C2)C1	ZINC001041320564	1345701667	/nfs/dbraw/zinc/70/16/67/1345701667.db2.gz	CYMMHDLPENPJOK-YOEHRIQHSA-N	0	3	330.875	3.438	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)C3(c4ccccc4)CCC3)C2)C1	ZINC001041452273	1345731303	/nfs/dbraw/zinc/73/13/03/1345731303.db2.gz	BJMKZGWVDNXYFC-OAQYLSRUSA-N	0	3	336.479	3.056	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)Cc3ccc(C4CCC4)cc3)C2)C1	ZINC001041518851	1345751404	/nfs/dbraw/zinc/75/14/04/1345751404.db2.gz	OHUPFZHOOCEHSK-QFIPXVFZSA-N	0	3	336.479	3.054	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@]2(CCN(Cc3oc(CC)nc3C)C2)C1	ZINC001041544331	1345758505	/nfs/dbraw/zinc/75/85/05/1345758505.db2.gz	NAARAKPMFDVRKP-FQEVSTJZSA-N	0	3	345.487	3.182	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1CC[C@@]2(CCN(Cc3c(C)noc3C)C2)C1	ZINC001041626238	1345801134	/nfs/dbraw/zinc/80/11/34/1345801134.db2.gz	QIPMDBQKLYBOQT-VQTJNVASSA-N	0	3	345.487	3.318	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@]3(CCN(Cc4oc(C)nc4C)C3)C2)C1	ZINC001041658601	1345814017	/nfs/dbraw/zinc/81/40/17/1345814017.db2.gz	ZHFGSFFLFUYGRO-FQEVSTJZSA-N	0	3	343.471	3.072	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccc(Cl)c(F)c3)C2)C1	ZINC001041709050	1345826000	/nfs/dbraw/zinc/82/60/00/1345826000.db2.gz	QPYSFFWXUBQJSA-GOSISDBHSA-N	0	3	334.822	3.040	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3cc(C(C)C)oc3C)C2)C1	ZINC001041770149	1345844046	/nfs/dbraw/zinc/84/40/46/1345844046.db2.gz	YMCAYQXBZQAVPU-HXUWFJFHSA-N	0	3	328.456	3.273	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)[C@H](CC)Cc3ccccc3C)C2)C1	ZINC001041785018	1345849619	/nfs/dbraw/zinc/84/96/19/1345849619.db2.gz	XFCFAZLMCPHKED-KNQAVFIVSA-N	0	3	338.495	3.121	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3cccc(Cl)c3Cl)C2)C1	ZINC001041801756	1345855503	/nfs/dbraw/zinc/85/55/03/1345855503.db2.gz	NQPPOAXRFQTDRB-KRWDZBQOSA-N	0	3	337.250	3.165	20	30		EGEDHN
C#CCN1CC[C@]2(CCN(C(=O)c3coc4ccc(Cl)cc43)C2)C1	ZINC001041809987	1345858479	/nfs/dbraw/zinc/85/84/79/1345858479.db2.gz	XHGAFDMTFVAJLF-IBGZPJMESA-N	0	3	342.826	3.257	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)c3ccc(C(C)C)s3)C2)C1	ZINC001041847704	1345872703	/nfs/dbraw/zinc/87/27/03/1345872703.db2.gz	CBFOYAXNZJBBRF-IBGZPJMESA-N	0	3	330.497	3.433	20	30		EGEDHN
CC#CCN1CC[C@]2(CCN(C(=O)C3CC(c4ccccc4)C3)C2)C1	ZINC001041852750	1345874066	/nfs/dbraw/zinc/87/40/66/1345874066.db2.gz	WBUBRCNHPSFQBA-AOMIVXANSA-N	0	3	336.479	3.128	20	30		EGEDHN
CC#CCN1CC[C@@]2(CCN(C(=O)c3ccc(C(C)(F)F)cc3)C2)C1	ZINC001041867974	1345877503	/nfs/dbraw/zinc/87/75/03/1345877503.db2.gz	YXAWOXKFFKUSLR-HXUWFJFHSA-N	0	3	346.421	3.360	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3oc(C(F)F)cc3C)C[C@@H]21	ZINC001042100183	1345943912	/nfs/dbraw/zinc/94/39/12/1345943912.db2.gz	LLCCSAVFCRPWFZ-KGLIPLIRSA-N	0	3	336.382	3.085	20	30		EGEDHN
CC1(CC(=O)N2CC[C@H]3CCN(Cc4ccc(C#N)cc4)[C@@H]3C2)CC1	ZINC001042160014	1345959922	/nfs/dbraw/zinc/95/99/22/1345959922.db2.gz	JWLWRUYTYOCBRF-RTBURBONSA-N	0	3	337.467	3.171	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H]2CCN(Cc3cccnc3C)[C@H]2C1	ZINC001042186645	1345974433	/nfs/dbraw/zinc/97/44/33/1345974433.db2.gz	IWUWPMFLJBYNTH-WMZOPIPTSA-N	0	3	327.472	3.025	20	30		EGEDHN
CC1(C(=O)N2CC[C@H]3CCN(Cc4cccc(C#N)c4)[C@H]3C2)CC=CC1	ZINC001042222732	1345993888	/nfs/dbraw/zinc/99/38/88/1345993888.db2.gz	XUBGQVJWXLHMOA-UXHICEINSA-N	0	3	349.478	3.337	20	30		EGEDHN
C#CCN1CC[C@H]2CCN(C(=O)Cc3ccc(C(C)(C)C)cc3)C[C@H]21	ZINC001042247260	1346004408	/nfs/dbraw/zinc/00/44/08/1346004408.db2.gz	NLFGMIHQXIWMIU-AZUAARDMSA-N	0	3	338.495	3.083	20	30		EGEDHN
C=CCN1CC[C@@H]2CCN(C(=O)C3(Cc4ccc(F)cc4)CC3)C[C@@H]21	ZINC001042262076	1346010198	/nfs/dbraw/zinc/01/01/98/1346010198.db2.gz	FKTGKIBZSZSWCD-MJGOQNOKSA-N	0	3	342.458	3.257	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc(C(F)F)cc3)C[C@H]21	ZINC001042269191	1346013141	/nfs/dbraw/zinc/01/31/41/1346013141.db2.gz	IROSHRUXEIRNPH-RHSMWYFYSA-N	0	3	332.394	3.184	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3ccccc3OCC(C)C)C[C@H]21	ZINC001042271760	1346014587	/nfs/dbraw/zinc/01/45/87/1346014587.db2.gz	FWZRLZIXYBCLAJ-PKOBYXMFSA-N	0	3	342.483	3.444	20	30		EGEDHN
C=C(C)CN1CC[C@H]2CCN(C(=O)c3sccc3COC)C[C@H]21	ZINC001042311327	1346028002	/nfs/dbraw/zinc/02/80/02/1346028002.db2.gz	JDKSBCCYCLXPMF-GOEBONIOSA-N	0	3	334.485	3.007	20	30		EGEDHN
CC#CCN1CC[C@@H]2CCN(C(=O)c3ccc4c(c3)CCC=C4)C[C@@H]21	ZINC001042315755	1346029944	/nfs/dbraw/zinc/02/99/44/1346029944.db2.gz	BZTBERHGSYFQGV-NQIIRXRSSA-N	0	3	334.463	3.206	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)C3(C4CCCCC4)CC3)C[C@@H]21	ZINC001042336110	1346042237	/nfs/dbraw/zinc/04/22/37/1346042237.db2.gz	RZPITZDQCRGWTR-HKUYNNGSSA-N	0	3	328.500	3.293	20	30		EGEDHN
C#CCCN1CC[C@@H]2CCN(C(=O)c3oc4ccccc4c3C)C[C@H]21	ZINC001042343463	1346046749	/nfs/dbraw/zinc/04/67/49/1346046749.db2.gz	MQJIXJBSENOKOP-SJLPKXTDSA-N	0	3	336.435	3.301	20	30		EGEDHN
C=CCN1CC[C@H]2CCN(C(=O)c3cc4ccccc4n3CC)C[C@@H]21	ZINC001042367387	1346058470	/nfs/dbraw/zinc/05/84/70/1346058470.db2.gz	GTGMQQUXFOWAOY-JXFKEZNVSA-N	0	3	337.467	3.384	20	30		EGEDHN
CC#CCN1CC[C@H]2CCN(C(=O)c3ccc(C)c4c3CCC4)C[C@@H]21	ZINC001042372677	1346061785	/nfs/dbraw/zinc/06/17/85/1346061785.db2.gz	ZQEIMRDWURBDMT-UWJYYQICSA-N	0	3	336.479	3.043	20	30		EGEDHN
C[C@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)C1CC(C)(C)C1	ZINC001044581051	1346374091	/nfs/dbraw/zinc/37/40/91/1346374091.db2.gz	HYRFIOUEHGJGPE-KXBFYZLASA-N	0	3	339.483	3.464	20	30		EGEDHN
C=C1CCC(C(=O)N2CC[C@@H](NCc3cnc(C)o3)C[C@@H]2C)CC1	ZINC001044729150	1346414027	/nfs/dbraw/zinc/41/40/27/1346414027.db2.gz	FOADQWOAWZFHNI-WMLDXEAASA-N	0	3	331.460	3.199	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@H]1CNCc1cc(Cl)ccc1Cl	ZINC001044961772	1346470290	/nfs/dbraw/zinc/47/02/90/1346470290.db2.gz	UDQYHKAPBWUXQQ-RISCZKNCSA-N	0	3	340.254	3.234	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N1CCC[C@H]1CNCc1ccc(Cl)nc1	ZINC001045181943	1346517031	/nfs/dbraw/zinc/51/70/31/1346517031.db2.gz	GZCLMDVWSJLENG-MAUKXSAKSA-N	0	3	335.879	3.418	20	30		EGEDHN
C[C@H](CC(=O)N1CCC[C@H]1CNCc1ccc(C#N)c(F)c1)C1CC1	ZINC001045326652	1346562415	/nfs/dbraw/zinc/56/24/15/1346562415.db2.gz	XGHFVHGXOHGHPK-KDOFPFPSSA-N	0	3	343.446	3.214	20	30		EGEDHN
Cc1ccncc1C(=O)NC1(C)CCN(Cc2cccc(C#N)c2)CC1	ZINC001045394132	1346581576	/nfs/dbraw/zinc/58/15/76/1346581576.db2.gz	JXQSBBXNUKDMHJ-UHFFFAOYSA-N	0	3	348.450	3.046	20	30		EGEDHN
CC1(NC(=O)c2cc(C#N)c[nH]2)CCN(C/C=C\c2ccccc2)CC1	ZINC001045401905	1346584322	/nfs/dbraw/zinc/58/43/22/1346584322.db2.gz	RWGWDLIWLLNSRI-YVMONPNESA-N	0	3	348.450	3.184	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2cc(F)cc3ccncc32)CC1	ZINC001045441243	1346594770	/nfs/dbraw/zinc/59/47/70/1346594770.db2.gz	BNGKBCZPWJSRLX-UHFFFAOYSA-N	0	3	327.403	3.144	20	30		EGEDHN
CC1(NC(=O)[C@H]2CC[C@H](F)C2)CCN(Cc2ccc(C#N)cc2)CC1	ZINC001045539752	1346623217	/nfs/dbraw/zinc/62/32/17/1346623217.db2.gz	XIVNXLWNONNWDS-ROUUACIJSA-N	0	3	343.446	3.167	20	30		EGEDHN
C[C@@H]1CC[C@H](C(=O)NC2(C)CCN(Cc3cccc(C#N)c3)CC2)C1	ZINC001045577248	1346634698	/nfs/dbraw/zinc/63/46/98/1346634698.db2.gz	LSBPFVFLNSTOGN-APWZRJJASA-N	0	3	339.483	3.465	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)c2cnc3ccc(F)cc3c2)CC1	ZINC001045611437	1346647154	/nfs/dbraw/zinc/64/71/54/1346647154.db2.gz	KFZLSGXMMIQVMO-UHFFFAOYSA-N	0	3	327.403	3.144	20	30		EGEDHN
CC#CCN1CCC(C)(NC(=O)c2[nH]ccc2-c2ccccc2)CC1	ZINC001045615524	1346648505	/nfs/dbraw/zinc/64/85/05/1346648505.db2.gz	LTOJWSWFLXPEDE-UHFFFAOYSA-N	0	3	335.451	3.289	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@@H]1CCC(C)=C(C)C1)C2	ZINC001045940191	1346776227	/nfs/dbraw/zinc/77/62/27/1346776227.db2.gz	RXODLZQPCJDDTC-TZIWHRDSSA-N	0	3	328.500	3.461	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCCN(C(=O)CC1CC(F)(F)C1)C2	ZINC001045948503	1346783148	/nfs/dbraw/zinc/78/31/48/1346783148.db2.gz	LCTRQLXMQIKXCW-GOSISDBHSA-N	0	3	338.442	3.150	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@H]1CC[C@@H](C)N(CCOC(C)C)C1	ZINC001132076929	1375134757	/nfs/dbraw/zinc/13/47/57/1375134757.db2.gz	DWBJXEUGHFBPOH-HIFRSBDPSA-N	0	3	330.900	3.159	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)[C@@H]1CC[C@@H]3C[C@@H]3CC1)C2	ZINC001045954758	1346789750	/nfs/dbraw/zinc/78/97/50/1346789750.db2.gz	INZWEQFGBGUJGV-HUUJSLGLSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)c1cc3occc3s1)C2	ZINC001045966163	1346801493	/nfs/dbraw/zinc/80/14/93/1346801493.db2.gz	PVNNEKZOMQXMQW-LJQANCHMSA-N	0	3	342.464	3.446	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)Cc1ccc(CC)cc1)C2	ZINC001045969044	1346803989	/nfs/dbraw/zinc/80/39/89/1346803989.db2.gz	JXUYTNGGLUHGOW-QFIPXVFZSA-N	0	3	338.495	3.129	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCCN(C(=O)c1ccc3cc[nH]c3c1)C2	ZINC001045968840	1346804244	/nfs/dbraw/zinc/80/42/44/1346804244.db2.gz	HXXPNLPTCIYJBN-NRFANRHFSA-N	0	3	335.451	3.119	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCCN(C(=O)C(C1CC1)C1CC1)C2	ZINC001045979140	1346816409	/nfs/dbraw/zinc/81/64/09/1346816409.db2.gz	QFFOUAIQZKWGHD-NRFANRHFSA-N	0	3	328.500	3.151	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCCN(C(=O)[C@H]1CC3CCC1CC3)C2	ZINC001045986408	1346827701	/nfs/dbraw/zinc/82/77/01/1346827701.db2.gz	PTDZDVBDGUJKEV-KWOGNLBTSA-N	0	3	328.500	3.151	20	30		EGEDHN
C=C(C)CCN1CC[C@@](C)(NC(=O)c2cnc([C@@H](C)OC)s2)C1	ZINC001046319246	1346933955	/nfs/dbraw/zinc/93/39/55/1346933955.db2.gz	QUFMPVFXLLUTRZ-CXAGYDPISA-N	0	3	337.489	3.011	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2cc(C3CCCCC3)n[nH]2)C1	ZINC001046387726	1346958495	/nfs/dbraw/zinc/95/84/95/1346958495.db2.gz	PGZGWNLUZRDSLF-IBGZPJMESA-N	0	3	330.476	3.228	20	30		EGEDHN
C=C(C)CN1CC[C@](C)(NC(=O)c2cn(CC)c3ccccc23)C1	ZINC001046468038	1346984956	/nfs/dbraw/zinc/98/49/56/1346984956.db2.gz	MEOTYWISOSZOGZ-FQEVSTJZSA-N	0	3	325.456	3.432	20	30		EGEDHN
C#CCCN1CC[C@](C)(NC(=O)c2cc3cc(Cl)ccc3[nH]2)C1	ZINC001046530115	1347006439	/nfs/dbraw/zinc/00/64/39/1347006439.db2.gz	DWZZBFRMUQWMIK-SFHVURJKSA-N	0	3	329.831	3.039	20	30		EGEDHN
C=C1CCC(C(=O)N[C@]2(C)CCN(CCOc3ccccc3)C2)CC1	ZINC001046595816	1347031961	/nfs/dbraw/zinc/03/19/61/1347031961.db2.gz	AOPXGTQDCKFSRY-OAQYLSRUSA-N	0	3	342.483	3.392	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@]2(C)CCN(Cc3ccc(CC)cc3)C2)nc1	ZINC001046783098	1347098592	/nfs/dbraw/zinc/09/85/92/1347098592.db2.gz	JAZGCRWQWUCKQV-JOCHJYFZSA-N	0	3	347.462	3.020	20	30		EGEDHN
C=CCCN1CC[C@](C)(NC(=O)c2cnc(-c3ccco3)s2)C1	ZINC001046785578	1347100160	/nfs/dbraw/zinc/10/01/60/1347100160.db2.gz	IUESZMVCFCULDM-KRWDZBQOSA-N	0	3	331.441	3.173	20	30		EGEDHN
C=CCCN1CCC(F)(F)[C@H](CNC(=O)c2cccc(C)c2F)C1	ZINC001046945313	1347160210	/nfs/dbraw/zinc/16/02/10/1347160210.db2.gz	RXBHJMFKYPOHRS-CQSZACIVSA-N	0	3	340.389	3.397	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)C3C(C)(C)C3(C)C)C2)CC1	ZINC001047231115	1347259913	/nfs/dbraw/zinc/25/99/13/1347259913.db2.gz	ACMFBFDZRZWKPP-QGZVFWFLSA-N	0	3	330.516	3.252	20	30		EGEDHN
CC[C@@H](F)CN1CCC([C@H]2CCCN(C(=O)C#CC3CC3)C2)CC1	ZINC001047235692	1347263725	/nfs/dbraw/zinc/26/37/25/1347263725.db2.gz	AQFHMJGDOSSMHB-RBUKOAKNSA-N	0	3	334.479	3.099	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)[C@H](C)n3cccc3)C2)CC1	ZINC001047236452	1347264195	/nfs/dbraw/zinc/26/41/95/1347264195.db2.gz	JZXQNWFGXMAYKJ-ICSRJNTNSA-N	0	3	341.499	3.023	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)c3cccc(F)c3F)C2)CC1	ZINC001047247681	1347273014	/nfs/dbraw/zinc/27/30/14/1347273014.db2.gz	IEGNTJUONYITRP-INIZCTEOSA-N	0	3	346.421	3.162	20	30		EGEDHN
C#CCN1CCC([C@@H]2CCCN(C(=O)C[C@H]3CC=CCC3)C2)CC1	ZINC001047251443	1347276225	/nfs/dbraw/zinc/27/62/25/1347276225.db2.gz	JOPGVDMTUUXXHJ-AZUAARDMSA-N	0	3	328.500	3.317	20	30		EGEDHN
C#CCN1CCC([C@H]2CCCN(C(=O)[C@H](C)c3ccc(C)o3)C2)CC1	ZINC001047259448	1347282226	/nfs/dbraw/zinc/28/22/26/1347282226.db2.gz	QCNHLYMEXWVMPT-MJGOQNOKSA-N	0	3	342.483	3.275	20	30		EGEDHN
CC#CCN1CCC([C@H]2CCCN(C(=O)C(C3CC3)C3CC3)C2)CC1	ZINC001047262620	1347283953	/nfs/dbraw/zinc/28/39/53/1347283953.db2.gz	SLJCKNQPKCMVRM-FQEVSTJZSA-N	0	3	342.527	3.397	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H]([C@@H](C)NCc2cc(C3CC3)no2)C1	ZINC001047924106	1347411182	/nfs/dbraw/zinc/41/11/82/1347411182.db2.gz	LLXOEHZARAEZAG-ZBFHGGJFSA-N	0	3	345.487	3.481	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@@H]([C@@H](C)NCc2ncc(C)s2)C1	ZINC001047928871	1347413397	/nfs/dbraw/zinc/41/33/97/1347413397.db2.gz	OVOKTADZEZTFFC-HUUCEWRRSA-N	0	3	335.517	3.380	20	30		EGEDHN
C[C@@H](NCc1cc(F)ccc1C#N)[C@H]1CCN(C(=O)C2(C)CCC2)C1	ZINC001047934714	1347415686	/nfs/dbraw/zinc/41/56/86/1347415686.db2.gz	CSRYJXILXBDEFE-ZBFHGGJFSA-N	0	3	343.446	3.214	20	30		EGEDHN
CCC(C)(C)C(=O)N1CC[C@@H]([C@H](C)NCc2cc(F)ccc2C#N)C1	ZINC001047960506	1347424677	/nfs/dbraw/zinc/42/46/77/1347424677.db2.gz	WZZMXPNXFLMBGD-GOEBONIOSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@H]([C@@H](C)NCc3ccn(C(C)C)n3)C2)C1	ZINC001047966281	1347427333	/nfs/dbraw/zinc/42/73/33/1347427333.db2.gz	QYPCZWDWYBITLG-SJORKVTESA-N	0	3	344.503	3.147	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2ccsc2)C[C@H]1CNCc1ccccc1C#N	ZINC001048121827	1347474362	/nfs/dbraw/zinc/47/43/62/1347474362.db2.gz	GLWQRZRNWLJSQO-RDTXWAMCSA-N	0	3	339.464	3.118	20	30		EGEDHN
CCC(CC)C(=O)N1C[C@@H](C)[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001048153597	1347482791	/nfs/dbraw/zinc/48/27/91/1347482791.db2.gz	VTEQUMYZWOKCNE-KDOFPFPSSA-N	0	3	345.462	3.318	20	30		EGEDHN
C[C@@H]1CN(C(=O)C2CC(C)(C)C2)C[C@@H]1CNCc1ccccc1C#N	ZINC001048241032	1347500784	/nfs/dbraw/zinc/50/07/84/1347500784.db2.gz	YYDXCJINXBSSBC-BEFAXECRSA-N	0	3	339.483	3.179	20	30		EGEDHN
C=C(C)CN1CCC(N(Cc2ccccn2)C(=O)[C@@H]2CC2(C)C)CC1	ZINC001048627155	1347624445	/nfs/dbraw/zinc/62/44/45/1347624445.db2.gz	GFFVKXOPGWRGOW-IBGZPJMESA-N	0	3	341.499	3.497	20	30		EGEDHN
C=CCN1CCC(N(Cc2ccccn2)C(=O)[C@@H]2C[C@H]2C2CC2)CC1	ZINC001048628331	1347624739	/nfs/dbraw/zinc/62/47/39/1347624739.db2.gz	FEHQJSUARYLIMH-VQTJNVASSA-N	0	3	339.483	3.107	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CN(Cc3oc(C(C)C)nc3C)C[C@H]2C1	ZINC001048979643	1347696205	/nfs/dbraw/zinc/69/62/05/1347696205.db2.gz	ZKQLORXMQIVDRM-IYBDPMFKSA-N	0	3	345.487	3.209	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C(C)(C)c3cccc(Cl)c3)C[C@@H]2C1	ZINC001049083950	1347721117	/nfs/dbraw/zinc/72/11/17/1347721117.db2.gz	AOQFOTCZLLHTIJ-IYBDPMFKSA-N	0	3	344.886	3.031	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)c3cccc(C4CCCC4)c3)C[C@@H]2C1	ZINC001049174666	1347739187	/nfs/dbraw/zinc/73/91/87/1347739187.db2.gz	WQDNDQJBJAVSGT-OYRHEFFESA-N	0	3	336.479	3.371	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C3CCC(C(C)(C)C)CC3)C[C@@H]2C1	ZINC001049198737	1347745101	/nfs/dbraw/zinc/74/51/01/1347745101.db2.gz	DYZFZIJKPBHBQQ-FXSDRFNOSA-N	0	3	330.516	3.252	20	30		EGEDHN
C=C[C@@H](C(=O)N1C[C@H]2CN(C/C=C\Cl)C[C@H]2C1)c1ccccc1	ZINC001049229642	1347752029	/nfs/dbraw/zinc/75/20/29/1347752029.db2.gz	OZLMNUNSIJQCHA-IWBBYWFKSA-N	0	3	330.859	3.099	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@H]3[C@H]2CCCN3C(=O)CC2CCC2)c1	ZINC001049392377	1347817576	/nfs/dbraw/zinc/81/75/76/1347817576.db2.gz	YVVRJPAWYIRFAH-WOJBJXKFSA-N	0	3	337.467	3.314	20	30		EGEDHN
CC1CC(C(=O)N2CCC[C@H]3[C@H]2CCN3Cc2cccc(C#N)c2)C1	ZINC001049408024	1347830908	/nfs/dbraw/zinc/83/09/08/1347830908.db2.gz	TZIFWURYVBUROP-OSXBXZONSA-N	0	3	337.467	3.170	20	30		EGEDHN
C=C(C)CN1CC[C@H]2[C@H]1CCCN2C(=O)c1coc(C(C)(C)C)n1	ZINC001049469939	1347864693	/nfs/dbraw/zinc/86/46/93/1347864693.db2.gz	PAMZKDVLYVKJGE-CVEARBPZSA-N	0	3	331.460	3.227	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)COc1cccc(C(C)C)c1	ZINC001049490152	1347874037	/nfs/dbraw/zinc/87/40/37/1347874037.db2.gz	KIGUXWZVTWHMBO-VQTJNVASSA-N	0	3	342.483	3.440	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ncoc1-c1ccccc1	ZINC001049507702	1347883932	/nfs/dbraw/zinc/88/39/32/1347883932.db2.gz	LGEVVTWIEIDEAI-IAGOWNOFSA-N	0	3	337.423	3.207	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1oc(C(F)F)cc1C	ZINC001049535737	1347896792	/nfs/dbraw/zinc/89/67/92/1347896792.db2.gz	JLKQXFIQLCMQRH-KGLIPLIRSA-N	0	3	336.382	3.228	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1cnc(-c2ccccc2)o1	ZINC001049537323	1347896824	/nfs/dbraw/zinc/89/68/24/1347896824.db2.gz	NIBLDFAOADJPAF-ROUUACIJSA-N	0	3	349.434	3.044	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cccc2ccc(C)nc21	ZINC001049541557	1347898663	/nfs/dbraw/zinc/89/86/63/1347898663.db2.gz	RGVTWLWIIRZLFI-VQTJNVASSA-N	0	3	347.462	3.245	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1ccc(C)c(Cl)c1	ZINC001049547491	1347902207	/nfs/dbraw/zinc/90/22/07/1347902207.db2.gz	ZOJUHOTZNMXNKQ-RBUKOAKNSA-N	0	3	344.886	3.280	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@@H]1CCCc2ccccc21	ZINC001049550968	1347903747	/nfs/dbraw/zinc/90/37/47/1347903747.db2.gz	CXVXBJNASGMNFV-QHAWAJNXSA-N	0	3	336.479	3.195	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc2cnccc2o1	ZINC001049572718	1347915836	/nfs/dbraw/zinc/91/58/36/1347915836.db2.gz	NFRNCLZMCKASIA-JKSUJKDBSA-N	0	3	325.412	3.083	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)Cn1c(C)cc2ccccc21	ZINC001049578985	1347918973	/nfs/dbraw/zinc/91/89/73/1347918973.db2.gz	CPWUNHPNDTUCIB-NHCUHLMSSA-N	0	3	349.478	3.038	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)Cc1ccc(CC(C)C)cc1	ZINC001049583523	1347921956	/nfs/dbraw/zinc/92/19/56/1347921956.db2.gz	WMDDVGPCCOEMQV-LEWJYISDSA-N	0	3	338.495	3.126	20	30		EGEDHN
N#Cc1ccc(CN2CC[C@H]3[C@H]2CCCN3C(=O)[C@]23C[C@H]2CCC3)cc1	ZINC001049602343	1347931764	/nfs/dbraw/zinc/93/17/64/1347931764.db2.gz	QXUNGNUDWBTMBO-XWSHUIEDSA-N	0	3	349.478	3.314	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)C(C1CCC1)C1CCC1	ZINC001049674083	1347966802	/nfs/dbraw/zinc/96/68/02/1347966802.db2.gz	BOTDKUPBBAQZLH-OALUTQOASA-N	0	3	328.500	3.291	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)C1(c2cccnc2)CCCC1	ZINC001049680905	1347970409	/nfs/dbraw/zinc/97/04/09/1347970409.db2.gz	UBPIIRQBNOFGDS-RTBURBONSA-N	0	3	339.483	3.145	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@@H]1CCCN2C(=O)c1ccccc1-n1cccc1	ZINC001049685864	1347971318	/nfs/dbraw/zinc/97/13/18/1347971318.db2.gz	BQCGVFJYIORPJT-SFTDATJTSA-N	0	3	347.462	3.180	20	30		EGEDHN
C#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)CCc1cc(Cl)cs1	ZINC001049756427	1348003942	/nfs/dbraw/zinc/00/39/42/1348003942.db2.gz	VFSHBZIORJHTGY-JKSUJKDBSA-N	0	3	336.888	3.033	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)[C@@H]1C[C@H]1c1ccc(C)s1	ZINC001049783303	1348019980	/nfs/dbraw/zinc/01/99/80/1348019980.db2.gz	SXOKIKQORCIYTM-TVFCKZIOSA-N	0	3	342.508	3.249	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)[C@H](c1cccnc1)C(C)C	ZINC001049806243	1348029194	/nfs/dbraw/zinc/02/91/94/1348029194.db2.gz	NDPSEWJMJVLNJZ-OTWHNJEPSA-N	0	3	327.472	3.073	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cccc(F)c1OCC	ZINC001049817202	1348035074	/nfs/dbraw/zinc/03/50/74/1348035074.db2.gz	XHEZFSRSFBETPZ-QZTJIDSGSA-N	0	3	346.446	3.479	20	30		EGEDHN
C=CCN1CC[C@H]2[C@@H]1CCCN2C(=O)C(C)(C)CC1CCOCC1	ZINC001049816793	1348035273	/nfs/dbraw/zinc/03/52/73/1348035273.db2.gz	KANWHSZLBPQHPO-ROUUACIJSA-N	0	3	334.504	3.081	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cnn(C(CC)CC)c1C	ZINC001049835839	1348049295	/nfs/dbraw/zinc/04/92/95/1348049295.db2.gz	SYZJEPGVHOYECO-RTBURBONSA-N	0	3	344.503	3.418	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cnn(C2CCCC2)c1C	ZINC001049837479	1348050298	/nfs/dbraw/zinc/05/02/98/1348050298.db2.gz	PRYGOWGNCRJFNH-RBUKOAKNSA-N	0	3	342.487	3.172	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1cc(C)n(CC2CC2)c1C	ZINC001049848241	1348057448	/nfs/dbraw/zinc/05/74/48/1348057448.db2.gz	KJWPDHFLBUXOBN-WOJBJXKFSA-N	0	3	341.499	3.380	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)C1CCC(C2CC2)CC1	ZINC001049869601	1348075303	/nfs/dbraw/zinc/07/53/03/1348075303.db2.gz	IJUOQDBVAAUGJH-GHBBCFCZSA-N	0	3	328.500	3.291	20	30		EGEDHN
CC#CCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc(C)nc2ccccc21	ZINC001049869496	1348075371	/nfs/dbraw/zinc/07/53/71/1348075371.db2.gz	CENQPSDHRUETME-RTWAWAEBSA-N	0	3	347.462	3.245	20	30		EGEDHN
C=CCN1CC[C@@H]2[C@@H]1CCCN2C(=O)c1cc(F)c(F)cc1Cl	ZINC001049869860	1348075704	/nfs/dbraw/zinc/07/57/04/1348075704.db2.gz	FTRAJOOMSPIRQO-JKSUJKDBSA-N	0	3	340.801	3.483	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)[C@H]1Cc2ccc(Cl)cc21	ZINC001049871273	1348076691	/nfs/dbraw/zinc/07/66/91/1348076691.db2.gz	PZOGWGHZDYBEGU-IPMKNSEASA-N	0	3	342.870	3.068	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H]1CCCN2C(=O)c1ccc(F)c2occc21	ZINC001049905817	1348104473	/nfs/dbraw/zinc/10/44/73/1348104473.db2.gz	BFLNMTIBXYPCKN-QZTJIDSGSA-N	0	3	340.398	3.274	20	30		EGEDHN
C#CCCN1CC[C@H]2[C@H]1CCCN2C(=O)c1cc2c(cccc2C)o1	ZINC001049924638	1348116013	/nfs/dbraw/zinc/11/60/13/1348116013.db2.gz	SIYXIZQZOPSKEM-MSOLQXFVSA-N	0	3	336.435	3.443	20	30		EGEDHN
C[C@H](C#N)C(=O)N1CCC[C@H]2CN(Cc3ccc(C(F)F)cc3)C[C@H]21	ZINC001049998156	1348148333	/nfs/dbraw/zinc/14/83/33/1348148333.db2.gz	CSJJDOYPYVPJSF-XOKHGSTOSA-N	0	3	347.409	3.207	20	30		EGEDHN
C[C@@H](C#N)C(=O)N1CCC[C@H]2CN(Cc3cc4ccccc4o3)C[C@H]21	ZINC001050000365	1348148577	/nfs/dbraw/zinc/14/85/77/1348148577.db2.gz	VNHHNTWJTKEUQR-QILLFSRXSA-N	0	3	337.423	3.015	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)[C@H](CC)OC3CCCCC3)[C@@H]2C1	ZINC001050047744	1348165435	/nfs/dbraw/zinc/16/54/35/1348165435.db2.gz	PLJMRAHLUGVHGC-UHOSZYNNSA-N	0	3	334.504	3.223	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)[C@@H](C)Cc3ccccc3F)[C@@H]2C1	ZINC001050138222	1348194333	/nfs/dbraw/zinc/19/43/33/1348194333.db2.gz	UDZDGSASALAHFM-VDZJLULYSA-N	0	3	330.447	3.113	20	30		EGEDHN
C=CCN1C[C@@H]2CCCN(C(=O)CCc3ccccc3Cl)[C@@H]2C1	ZINC001050197585	1348208111	/nfs/dbraw/zinc/20/81/11/1348208111.db2.gz	WNOJKSOZFAOQBC-FUHWJXTLSA-N	0	3	332.875	3.381	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H]2CC[C@H](CNCc3ccon3)CC2)CC1	ZINC001050362041	1348238316	/nfs/dbraw/zinc/23/83/16/1348238316.db2.gz	FHHPWUHADGRCMC-JCNLHEQBSA-N	0	3	331.460	3.186	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)c3c(C)c(F)ccc3Cl)C2)CC1	ZINC001050570056	1348291423	/nfs/dbraw/zinc/29/14/23/1348291423.db2.gz	SLFXINUQUREBHT-UHFFFAOYSA-N	0	3	348.849	3.349	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3ccc4c5c(cccc53)CC4)C2)CC1	ZINC001050587140	1348294502	/nfs/dbraw/zinc/29/45/02/1348294502.db2.gz	ZDVYNGVVTDQCHU-UHFFFAOYSA-N	0	3	344.458	3.110	20	30		EGEDHN
C#CCCN1C[C@@H](C)[C@H](NC(=O)c2cc(Cl)sc2Cl)C1	ZINC001079850127	1357401002	/nfs/dbraw/zinc/40/10/02/1357401002.db2.gz	HCKBTXLMIBKBDD-MWLCHTKSSA-N	0	3	331.268	3.128	20	30		EGEDHN
C#CCN1CCC2(CN(C(=O)c3ccccc3O[C@H](C)CC)C2)CC1	ZINC001050684574	1348326603	/nfs/dbraw/zinc/32/66/03/1348326603.db2.gz	MHUNXOZRQNHEGN-QGZVFWFLSA-N	0	3	340.467	3.035	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3cc[nH]c3C3CC3)cccc2C1	ZINC001051298323	1348424066	/nfs/dbraw/zinc/42/40/66/1348424066.db2.gz	LVCXROPOUUUBSY-UHFFFAOYSA-N	0	3	347.462	3.204	20	30		EGEDHN
C#CCCN1CCc2c(CNC(=O)c3cccn3C(C)C)cccc2C1	ZINC001051307126	1348428466	/nfs/dbraw/zinc/42/84/66/1348428466.db2.gz	MCCDZQQWPMDURQ-UHFFFAOYSA-N	0	3	349.478	3.380	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@@H](NC(=O)c3cccs3)CC2)cc1	ZINC001052172235	1348509312	/nfs/dbraw/zinc/50/93/12/1348509312.db2.gz	YJOHWQQUNCDUBJ-QGZVFWFLSA-N	0	3	339.464	3.404	20	30		EGEDHN
Cc1cccc(C(=O)N[C@@H]2CCCN(Cc3ccc(C#N)cc3)CC2)n1	ZINC001052209648	1348512332	/nfs/dbraw/zinc/51/23/32/1348512332.db2.gz	ZRNDEXPGFFXNAA-LJQANCHMSA-N	0	3	348.450	3.046	20	30		EGEDHN
C[C@@H](C(=O)N[C@H]1CCCN(Cc2ccc(C#N)cc2)CC1)C1CC1	ZINC001052283085	1348516779	/nfs/dbraw/zinc/51/67/79/1348516779.db2.gz	VGJQFVMLNAKWQM-BEFAXECRSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2ccc(F)c(C(F)F)c2)CC1	ZINC001052386492	1348538043	/nfs/dbraw/zinc/53/80/43/1348538043.db2.gz	CYZHFPIPHGYYCJ-AWEZNQCLSA-N	0	3	338.373	3.371	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)C[C@@H]2C[C@H]2Cc2ccccc2)CC1	ZINC001052582050	1348585944	/nfs/dbraw/zinc/58/59/44/1348585944.db2.gz	GFJZSFVKUNZXFU-HKBOAZHASA-N	0	3	338.495	3.249	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CCCN(Cc3cnccc3C)CC2)cc1	ZINC001052614036	1348597076	/nfs/dbraw/zinc/59/70/76/1348597076.db2.gz	JMUCFOGNOUSKAG-NRFANRHFSA-N	0	3	347.462	3.156	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cc3cc(Cl)ccc3[nH]2)CC1	ZINC001052614698	1348597417	/nfs/dbraw/zinc/59/74/17/1348597417.db2.gz	WLLMRFXGQAGBGO-INIZCTEOSA-N	0	3	343.858	3.429	20	30		EGEDHN
Cc1cocc1C(=O)N[C@H]1CCCN(Cc2cccc(C#N)c2)CC1	ZINC001052628702	1348601847	/nfs/dbraw/zinc/60/18/47/1348601847.db2.gz	FLHZRQWYIJQMPP-SFHVURJKSA-N	0	3	337.423	3.244	20	30		EGEDHN
CC1(C)CC[C@@H]1C(=O)N[C@H]1CCCN(Cc2ccc(C#N)cc2)CC1	ZINC001052636812	1348606258	/nfs/dbraw/zinc/60/62/58/1348606258.db2.gz	YJYMQOAZWWISKU-RBUKOAKNSA-N	0	3	339.483	3.465	20	30		EGEDHN
Cc1coc(C(=O)N[C@H]2CCCN(Cc3ccc(C#N)cc3)CC2)c1	ZINC001052641000	1348607991	/nfs/dbraw/zinc/60/79/91/1348607991.db2.gz	MIDVWMKWJXVVNL-SFHVURJKSA-N	0	3	337.423	3.244	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)c2cc3cccc(OC)c3o2)CC1	ZINC001052666293	1348620687	/nfs/dbraw/zinc/62/06/87/1348620687.db2.gz	RKOUPZGAJGPRFB-INIZCTEOSA-N	0	3	340.423	3.049	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H]2CCCN(Cc3cnccc3C)CC2)C1	ZINC001052691140	1348634410	/nfs/dbraw/zinc/63/44/10/1348634410.db2.gz	SDJVBWZVLQJPNZ-SFHVURJKSA-N	0	3	327.472	3.217	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@]2(c3ccccc3)CC2(C)C)CC1	ZINC001052818576	1348689132	/nfs/dbraw/zinc/68/91/32/1348689132.db2.gz	UHYFMYDPLZVELV-SIKLNZKXSA-N	0	3	338.495	3.348	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2cc3cc(C)ccc3s2)CC1	ZINC001052835855	1348694780	/nfs/dbraw/zinc/69/47/80/1348694780.db2.gz	DWWGCONUVJNUCM-MRXNPFEDSA-N	0	3	326.465	3.427	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)C(C)(C)c2ccccc2Cl)CC1	ZINC001052875090	1348714187	/nfs/dbraw/zinc/71/41/87/1348714187.db2.gz	LNVNOBOPZQHVJR-OAHLLOKOSA-N	0	3	332.875	3.222	20	30		EGEDHN
C#CCN1CCC[C@@H](NC(=O)c2ccc(Cl)cc2Cl)CC1	ZINC001052890195	1348726456	/nfs/dbraw/zinc/72/64/56/1348726456.db2.gz	XKINHPQIZQCUOA-CYBMUJFWSA-N	0	3	325.239	3.211	20	30		EGEDHN
CC#CCN1CCC[C@H](NC(=O)[C@@]2(c3ccccc3)C[C@H](F)C2)CC1	ZINC001052901593	1348735213	/nfs/dbraw/zinc/73/52/13/1348735213.db2.gz	SHDHBEJPEBSXAX-ZJOUEHCJSA-N	0	3	342.458	3.050	20	30		EGEDHN
CC#CCN1CCC[C@@H](NC(=O)C2(c3ccc(Cl)cc3)CC2)CC1	ZINC001052916734	1348746898	/nfs/dbraw/zinc/74/68/98/1348746898.db2.gz	ULRCEYDABVTFSY-GOSISDBHSA-N	0	3	344.886	3.366	20	30		EGEDHN
CCC(=O)N1CCC[C@@H]([C@H]2CCCN(Cc3ccccc3C#N)C2)C1	ZINC001052998364	1348796385	/nfs/dbraw/zinc/79/63/85/1348796385.db2.gz	YCZJABABOQQJAB-VQTJNVASSA-N	0	3	339.483	3.419	20	30		EGEDHN
C#CCN1CCC[C@H]([C@@H]2CCCCN2C(=O)c2ccccc2F)C1	ZINC001053061035	1348870816	/nfs/dbraw/zinc/87/08/16/1348870816.db2.gz	LOQQVZKWFGHKLO-LPHOPBHVSA-N	0	3	328.431	3.166	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)COC2CCCC2)C1	ZINC001053070219	1348885043	/nfs/dbraw/zinc/88/50/43/1348885043.db2.gz	UPTQPADWAAERDX-AZUAARDMSA-N	0	3	346.515	3.062	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)c2ccc(CC)o2)C1	ZINC001053087706	1348912367	/nfs/dbraw/zinc/91/23/67/1348912367.db2.gz	NKIAYFIAGHXNHK-SJLPKXTDSA-N	0	3	328.456	3.182	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)c2ccc(C)c(C)n2)C1	ZINC001053091562	1348917218	/nfs/dbraw/zinc/91/72/18/1348917218.db2.gz	NEIJKMAJOFMQHX-QUCCMNQESA-N	0	3	339.483	3.038	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@@H]2CCCCN2C(=O)Cc2cccc(C)c2)C1	ZINC001053093427	1348921153	/nfs/dbraw/zinc/92/11/53/1348921153.db2.gz	MRHQAGOWTMQPBZ-RTWAWAEBSA-N	0	3	338.495	3.264	20	30		EGEDHN
C#CCN1CCC[C@@H]([C@H]2CCCCN2C(=O)Cc2ccc(F)cc2)C1	ZINC001053105218	1348942542	/nfs/dbraw/zinc/94/25/42/1348942542.db2.gz	MVBMJTBZCGWEIX-UYAOXDASSA-N	0	3	342.458	3.095	20	30		EGEDHN
C#CCN1CCC[C@H]([C@H]2CCCCN2C(=O)c2cnc(CC)s2)C1	ZINC001053106601	1348943974	/nfs/dbraw/zinc/94/39/74/1348943974.db2.gz	UUXWGOWROPLHRR-JKSUJKDBSA-N	0	3	345.512	3.045	20	30		EGEDHN
C=CCCN1Cc2ccccc2C[C@H]1CNC(=O)c1c(C)ccn1C	ZINC001054038474	1349134895	/nfs/dbraw/zinc/13/48/95/1349134895.db2.gz	CQHZLTADUYNSAH-IBGZPJMESA-N	0	3	337.467	3.066	20	30		EGEDHN
CC(C)CC(=O)N1CCC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001054074895	1349147196	/nfs/dbraw/zinc/14/71/96/1349147196.db2.gz	CHBIHISJHCZTGB-NRFANRHFSA-N	0	3	339.483	3.419	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccc(C(C)C)cn1)C2	ZINC001054198014	1349200797	/nfs/dbraw/zinc/20/07/97/1349200797.db2.gz	NJPGFOXRCVQEID-OAQYLSRUSA-N	0	3	339.483	3.156	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)C1CCC(F)(F)CC1)C2	ZINC001054202877	1349203986	/nfs/dbraw/zinc/20/39/86/1349203986.db2.gz	BVZYWGRMCZSJND-SFHVURJKSA-N	0	3	338.442	3.150	20	30		EGEDHN
CC#CCN1CC[C@@]2(C1)CCCN(C(=O)[C@@H](C)c1cc(C)oc1C)C2	ZINC001054215311	1349214782	/nfs/dbraw/zinc/21/47/82/1349214782.db2.gz	QYQYAIWVMAZWHW-LAUBAEHRSA-N	0	3	342.483	3.338	20	30		EGEDHN
C#CCN1CC[C@@]2(C1)CCCN(C(=O)c1ccccc1OC(C)C)C2	ZINC001054230380	1349224243	/nfs/dbraw/zinc/22/42/43/1349224243.db2.gz	RRDAPTGPQCQNAZ-OAQYLSRUSA-N	0	3	340.467	3.035	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)Cc1ccc3ccccc3c1)C2	ZINC001054238389	1349232974	/nfs/dbraw/zinc/23/29/74/1349232974.db2.gz	SORFYAAZCCRKBB-QHCPKHFHSA-N	0	3	346.474	3.330	20	30		EGEDHN
CC#CCN1CC[C@]2(C1)CCCN(C(=O)[C@H](C)c1cccc(F)c1)C2	ZINC001054243131	1349237118	/nfs/dbraw/zinc/23/71/18/1349237118.db2.gz	XEQKISDEHVFTSI-UTKZUKDTSA-N	0	3	342.458	3.267	20	30		EGEDHN
C#CCN1CC[C@]2(C1)CCCN(C(=O)c1cc3c(cccc3C)o1)C2	ZINC001054245737	1349239267	/nfs/dbraw/zinc/23/92/67/1349239267.db2.gz	ATGUESLLQFVSKL-NRFANRHFSA-N	0	3	336.435	3.303	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)[C@@H]3CCCCO3)cc2C1	ZINC001054261108	1349258165	/nfs/dbraw/zinc/25/81/65/1349258165.db2.gz	PVHOXSCAPNVRKF-IBGZPJMESA-N	0	3	328.456	3.154	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3coc(C)n3)cc2C1	ZINC001054262070	1349259680	/nfs/dbraw/zinc/25/96/80/1349259680.db2.gz	JEQSWJHGQJTXCK-UHFFFAOYSA-N	0	3	325.412	3.195	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)c3cc(C)sn3)cc2C1	ZINC001054262824	1349260463	/nfs/dbraw/zinc/26/04/63/1349260463.db2.gz	RUEMSZIAVCDKKN-UHFFFAOYSA-N	0	3	327.453	3.273	20	30		EGEDHN
C=C[C@@H]1OCCC[C@H]1C(=O)NCc1ccc2c(c1)CN(CC(C)C)C2	ZINC001054265427	1349262964	/nfs/dbraw/zinc/26/29/64/1349262964.db2.gz	OEWZYOAHCZDHPB-UXHICEINSA-N	0	3	342.483	3.256	20	30		EGEDHN
C=C(C)CCN1Cc2ccc(CNC(=O)c3ccn(CC)n3)cc2C1	ZINC001054284970	1349286996	/nfs/dbraw/zinc/28/69/96/1349286996.db2.gz	NFBQGTIUCNUQNL-UHFFFAOYSA-N	0	3	338.455	3.115	20	30		EGEDHN
C[C@@H]1CN(C(=O)c2cccc(F)c2)C[C@@H]1NCc1ccc(C#N)s1	ZINC001054349520	1349329380	/nfs/dbraw/zinc/32/93/80/1349329380.db2.gz	DJUMVBWJFKSGEA-PXAZEXFGSA-N	0	3	343.427	3.009	20	30		EGEDHN
Cc1cc(C(=O)N2C[C@@H](C)[C@@H](NCc3ccc(C#N)s3)C2)c(C)o1	ZINC001054375006	1349340237	/nfs/dbraw/zinc/34/02/37/1349340237.db2.gz	IAEWWTVRXRRODX-DIFFPNOSSA-N	0	3	343.452	3.080	20	30		EGEDHN
C[C@H]1CN(C(=O)C2CC(C)(C)C2)C[C@@H]1NCc1ccc(C#N)c(F)c1	ZINC001054617077	1349416031	/nfs/dbraw/zinc/41/60/31/1349416031.db2.gz	CBYZRBGYKHQZEM-UGSOOPFHSA-N	0	3	343.446	3.070	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CN(Cc3cccc(COC)c3)C[C@H]2C)C1	ZINC001080404750	1357608706	/nfs/dbraw/zinc/60/87/06/1357608706.db2.gz	XTJAPERCMBAYRV-VQIMIIECSA-N	0	3	342.483	3.126	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CN(C[C@@H](OC)c3ccccc3)C[C@H]2C)C1	ZINC001080406322	1357609162	/nfs/dbraw/zinc/60/91/62/1357609162.db2.gz	QNQPIRKBFZNQRX-BHIYHBOVSA-N	0	3	342.483	3.167	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2ncoc2-c2cccs2)C1	ZINC001080635849	1357711168	/nfs/dbraw/zinc/71/11/68/1357711168.db2.gz	XQUDLXJTJOOSGK-CHWSQXEVSA-N	0	3	331.441	3.029	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc(Cl)c(Cl)n1C	ZINC001085628516	1358645686	/nfs/dbraw/zinc/64/56/86/1358645686.db2.gz	YQYCXKHIQKRUQW-LBPRGKRZSA-N	0	3	344.286	3.444	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1cccc(C)c1C)C[C@@H](C)O2	ZINC001071238520	1354521344	/nfs/dbraw/zinc/52/13/44/1354521344.db2.gz	NSERWCUIYWKKAF-DYESRHJHSA-N	0	3	342.483	3.185	20	30		EGEDHN
C=C(C)CN1CC[C@@]2(C1)CN(C(=O)c1c(C)cccc1F)C[C@@H](C)O2	ZINC001071245868	1354525564	/nfs/dbraw/zinc/52/55/64/1354525564.db2.gz	KYQCLAQTEBCTHQ-OXQOHEQNSA-N	0	3	346.446	3.016	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2nsc3ccccc32)CC[C@@H]1C	ZINC001071525104	1354744858	/nfs/dbraw/zinc/74/48/58/1354744858.db2.gz	KBSICEALTDECKX-UONOGXRCSA-N	0	3	329.469	3.455	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc3nccc(C)c3c2)CC[C@@H]1C	ZINC001071533637	1354750418	/nfs/dbraw/zinc/75/04/18/1354750418.db2.gz	IZBDURDSLZYXAU-FUHWJXTLSA-N	0	3	335.451	3.149	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2cccc(OCCC)c2)CC[C@@H]1C	ZINC001071544420	1354757961	/nfs/dbraw/zinc/75/79/61/1354757961.db2.gz	YPTFFKMRZAVSKL-FUHWJXTLSA-N	0	3	328.456	3.081	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cccc(NC(=O)CC)c2)CC[C@H]1C	ZINC001071544319	1354758061	/nfs/dbraw/zinc/75/80/61/1354758061.db2.gz	WWOYUZLKXXYOSJ-CRAIPNDOSA-N	0	3	343.471	3.194	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccccc2-c2cn[nH]c2)CC[C@@H]1C	ZINC001071549003	1354761503	/nfs/dbraw/zinc/76/15/03/1354761503.db2.gz	NEOFAUBUZNFFEB-DOTOQJQBSA-N	0	3	338.455	3.236	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc3cc(C)cn3c2)CC[C@@H]1C	ZINC001071558192	1354763233	/nfs/dbraw/zinc/76/32/33/1354763233.db2.gz	ZKCHNMLFDGSFOG-FUHWJXTLSA-N	0	3	325.456	3.407	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2cc3ccccc3c(=O)[nH]2)CC[C@@H]1C	ZINC001071567744	1354767034	/nfs/dbraw/zinc/76/70/34/1354767034.db2.gz	BVZDGEHCZWWRLS-GOEBONIOSA-N	0	3	339.439	3.099	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2nccc3ccsc32)CC[C@@H]1C	ZINC001071583375	1354778071	/nfs/dbraw/zinc/77/80/71/1354778071.db2.gz	HBOCFOBXKYOCGO-DZGCQCFKSA-N	0	3	329.469	3.455	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc3oc(C)nc3c2)CC[C@@H]1C	ZINC001071602104	1354788731	/nfs/dbraw/zinc/78/87/31/1354788731.db2.gz	GWOXIWBYZAFMHL-BBRMVZONSA-N	0	3	327.428	3.295	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2cc(F)cc3ccoc32)CC[C@@H]1C	ZINC001071628678	1354812730	/nfs/dbraw/zinc/81/27/30/1354812730.db2.gz	SBKHWNVBNKNHNS-BBRMVZONSA-N	0	3	328.387	3.178	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)Cc2cc(F)c(C)cc2F)CC[C@H]1C	ZINC001071701950	1354861697	/nfs/dbraw/zinc/86/16/97/1354861697.db2.gz	QPWRFOOHVHCEJQ-ZBFHGGJFSA-N	0	3	336.426	3.361	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@H]2CCCc3ccccc32)CC(C)(C)C1	ZINC001089419374	1360413421	/nfs/dbraw/zinc/41/34/21/1360413421.db2.gz	FEFGLVABMXEIBT-QUCCMNQESA-N	0	3	338.495	3.347	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CC[C@H](C)N(Cc3ccc(CO)cc3)C2)C1	ZINC001071807365	1354951991	/nfs/dbraw/zinc/95/19/91/1354951991.db2.gz	QZYBXLLECGLJIW-QFBILLFUSA-N	0	3	342.483	3.004	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)c2ccc(C3CC3)nc2C)CC[C@H]1C	ZINC001071831547	1354967233	/nfs/dbraw/zinc/96/72/33/1354967233.db2.gz	IQSSXZBOXXLDQZ-PBHICJAKSA-N	0	3	327.472	3.426	20	30		EGEDHN
C#CCCN1C[C@H](NC(=O)c2ccc3nc(C)ccc3c2)CC[C@@H]1C	ZINC001071920873	1355025525	/nfs/dbraw/zinc/02/55/25/1355025525.db2.gz	YQQDAMHNBUPKJY-QFBILLFUSA-N	0	3	335.451	3.149	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)c2ccc3scnc3c2)CC[C@@H]1C	ZINC001071960647	1355044622	/nfs/dbraw/zinc/04/46/22/1355044622.db2.gz	GNJNMQXLIMLYEL-DZGCQCFKSA-N	0	3	329.469	3.455	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H]2CC[C@@H](C)N(Cc3cccc(C)c3)C2)nc1	ZINC001071999025	1355066692	/nfs/dbraw/zinc/06/66/92/1355066692.db2.gz	LYAGXPFRGIDHBE-XLIONFOSSA-N	0	3	347.462	3.154	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccccc2OC(C)C)CC[C@H]1C	ZINC001072008262	1355072495	/nfs/dbraw/zinc/07/24/95/1355072495.db2.gz	CVXDZYZHBRRAER-SJORKVTESA-N	0	3	328.456	3.080	20	30		EGEDHN
C=CCCN1C[C@@H](NC(=O)c2cc3nc(C)ccc3o2)CC[C@@H]1C	ZINC001072012772	1355076665	/nfs/dbraw/zinc/07/66/65/1355076665.db2.gz	SCPIMUCFZWJDRO-GJZGRUSLSA-N	0	3	327.428	3.295	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)c2ccc(OCC3CC3)cc2)CC[C@H]1C	ZINC001072088267	1355121429	/nfs/dbraw/zinc/12/14/29/1355121429.db2.gz	IRDJWJKCNPYJGA-APWZRJJASA-N	0	3	340.467	3.081	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc(C)cc1F	ZINC001089704341	1360607284	/nfs/dbraw/zinc/60/72/84/1360607284.db2.gz	VSTADLFGNHZFGT-MRXNPFEDSA-N	0	3	330.447	3.378	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccccc1N(C)C	ZINC001089736170	1360641088	/nfs/dbraw/zinc/64/10/88/1360641088.db2.gz	LFKGNBGTLAGRLF-INIZCTEOSA-N	0	3	329.488	3.159	20	30		EGEDHN
C[C@@H]1CCN(C(=O)C2CCC2)C[C@@H]1CNCc1cc(F)ccc1C#N	ZINC001072153915	1355154652	/nfs/dbraw/zinc/15/46/52/1355154652.db2.gz	JZGKWHAIKRADBR-KDOFPFPSSA-N	0	3	343.446	3.072	20	30		EGEDHN
CC(C)=CC(=O)N1CC[C@@H](C)[C@@H](CNCc2cc(F)ccc2C#N)C1	ZINC001072170915	1355165824	/nfs/dbraw/zinc/16/58/24/1355165824.db2.gz	IZTDBHJHYIZIBX-QAPCUYQASA-N	0	3	343.446	3.238	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N1CC[C@H](C)[C@H](CNCc2cc(C)no2)C1	ZINC001072335330	1355244496	/nfs/dbraw/zinc/24/44/96/1355244496.db2.gz	NGNXMNSHHJNOGG-GOEBONIOSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C1CC(C)(C(=O)N2CC[C@@H](C)[C@H](CNCc3nc(C)cs3)C2)C1	ZINC001072359861	1355255964	/nfs/dbraw/zinc/25/59/64/1355255964.db2.gz	IHRGEWGXLVCOPX-GDBMZVCRSA-N	0	3	347.528	3.382	20	30		EGEDHN
C=C1CCC(C(=O)N2CC3(C2)CCN(Cc2cccc(C#N)c2)C3)CC1	ZINC001072946470	1355515571	/nfs/dbraw/zinc/51/55/71/1355515571.db2.gz	JOMAYNFAFSMWLW-UHFFFAOYSA-N	0	3	349.478	3.339	20	30		EGEDHN
CCC[C@@H]1C[C@H]1C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001072963145	1355525874	/nfs/dbraw/zinc/52/58/74/1355525874.db2.gz	WFHKLVQEPMPIGR-RTBURBONSA-N	0	3	337.467	3.029	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CN(C(=O)[C@H]4CC45CCCC5)C3)C2)c1	ZINC001073101661	1355597246	/nfs/dbraw/zinc/59/72/46/1355597246.db2.gz	VOLHYVXPCUWXOG-LJQANCHMSA-N	0	3	349.478	3.173	20	30		EGEDHN
CC#CCN1CCC2(CN(C(=O)[C@H](CC)c3ccc(Cl)cc3)C2)C1	ZINC001073451228	1355787853	/nfs/dbraw/zinc/78/78/53/1355787853.db2.gz	YJHACNZMNYLKPO-GOSISDBHSA-N	0	3	344.886	3.391	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)c2ccc(CCC)s2)C1	ZINC001073623803	1355847092	/nfs/dbraw/zinc/84/70/92/1355847092.db2.gz	RVXHPVZRBVMZAS-HNNXBMFYSA-N	0	3	336.501	3.097	20	30		EGEDHN
C=C(C)CN1CCCO[C@H](CNC(=O)c2ccccc2C(C)C)C1	ZINC001073629774	1355847989	/nfs/dbraw/zinc/84/79/89/1355847989.db2.gz	FQAIEHFNDVKXRO-QGZVFWFLSA-N	0	3	330.472	3.207	20	30		EGEDHN
CC(C)C(=O)N1CCCC[C@@H]1CN(C)Cc1ccc(OCC#N)cc1	ZINC001073953076	1355989846	/nfs/dbraw/zinc/98/98/46/1355989846.db2.gz	TYDGIHFDDLJMSV-GOSISDBHSA-N	0	3	343.471	3.058	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCCN1C(=O)[C@H]1CC1(F)F	ZINC001074010478	1356033540	/nfs/dbraw/zinc/03/35/40/1356033540.db2.gz	ZGJCIEJKTJYGGH-IAGOWNOFSA-N	0	3	347.409	3.026	20	30		EGEDHN
CN(Cc1ccc(C#N)cc1)C[C@H]1CCCCN1C(=O)CC(C)(F)F	ZINC001074060178	1356059475	/nfs/dbraw/zinc/05/94/75/1356059475.db2.gz	LHNOFFOJBFRZFI-QGZVFWFLSA-N	0	3	349.425	3.416	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCCC[C@@H]2CN(C)Cc2ccccc2)nc1	ZINC001074093251	1356078501	/nfs/dbraw/zinc/07/85/01/1356078501.db2.gz	QSBYTWDOJDCHAJ-HXUWFJFHSA-N	0	3	347.462	3.190	20	30		EGEDHN
C=CCN1C[C@@H]2CCN(C(=O)Cc3cccc4sccc43)[C@@H]2C1	ZINC001076326233	1356548763	/nfs/dbraw/zinc/54/87/63/1356548763.db2.gz	SXMQVIRVLANFTA-DOTOQJQBSA-N	0	3	326.465	3.163	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@H](C)c3ccc(CC)cc3)[C@@H]2C1	ZINC001076366038	1356560944	/nfs/dbraw/zinc/56/09/44/1356560944.db2.gz	ZUTAYFMCTADCNH-LSTHTHJFSA-N	0	3	326.484	3.461	20	30		EGEDHN
C=C(C)CN1C[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3c3ccc(F)cc3)[C@@H]2C1	ZINC001076625108	1356637021	/nfs/dbraw/zinc/63/70/21/1356637021.db2.gz	UJUMVSVMEVFOSI-GDAAHCPNSA-N	0	3	328.431	3.038	20	30		EGEDHN
C=CCCN1C[C@@H](C)[C@H](NC(=O)c2cnc(CC(C)(C)C)s2)C1	ZINC001080736747	1357729583	/nfs/dbraw/zinc/72/95/83/1357729583.db2.gz	ZHHRNEWQGKGMPE-ZIAGYGMSSA-N	0	3	335.517	3.358	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@H]1CCC(C)(C)CN1CCn1cccn1	ZINC001099250710	1363712915	/nfs/dbraw/zinc/71/29/15/1363712915.db2.gz	ACJZGVGHPQCASX-QGZVFWFLSA-N	0	3	346.519	3.092	20	30		EGEDHN
CCCCCCCCC(=O)NCC[C@H](C)NC(=O)[C@H](CC)N(C)C	ZINC001078328284	1356953106	/nfs/dbraw/zinc/95/31/06/1356953106.db2.gz	PPOJFCFUUWNWBU-IRXDYDNUSA-N	0	3	341.540	3.088	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2cc(C)nc(C)c2)C12CCC2	ZINC001078637578	1357046590	/nfs/dbraw/zinc/04/65/90/1357046590.db2.gz	RDJGVUGAZIUTFH-HZPDHXFCSA-N	0	3	333.863	3.082	20	30		EGEDHN
C=C(Cl)CN[C@@H]1C[C@@H](NC(=O)c2cc(Cl)cn2C)C12CCC2	ZINC001078676571	1357050855	/nfs/dbraw/zinc/05/08/55/1357050855.db2.gz	YLWCXBODGVWZNN-ZIAGYGMSSA-N	0	3	342.270	3.062	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)c2occ3c2CCC3)C12CCC2	ZINC001078688615	1357054081	/nfs/dbraw/zinc/05/40/81/1357054081.db2.gz	SINAGPJCNRKNRU-GJZGRUSLSA-N	0	3	334.847	3.151	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)c2ccc(COC(C)C)cc2)C1	ZINC001080924823	1357765953	/nfs/dbraw/zinc/76/59/53/1357765953.db2.gz	RKKBFOXNKXADHG-VQIMIIECSA-N	0	3	330.472	3.238	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H](C)CC2CCCC2)C[C@H]1c1ccccc1	ZINC001081190913	1357848701	/nfs/dbraw/zinc/84/87/01/1357848701.db2.gz	YCQWGAPJZKFDQT-JRGCBEDISA-N	0	3	338.495	3.420	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H](C)c2ccc(C)cc2)C[C@H]1c1ccccc1	ZINC001081215688	1357849975	/nfs/dbraw/zinc/84/99/75/1357849975.db2.gz	ROBWVXYIPRLYMX-BVYCBKJFSA-N	0	3	346.474	3.316	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)[C@H]2CCCCC2(C)C)C[C@H]1c1ccccc1	ZINC001081231195	1357851893	/nfs/dbraw/zinc/85/18/93/1357851893.db2.gz	DBBXDAQFOOBYGP-XUVXKRRUSA-N	0	3	338.495	3.420	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H]2CN(CCCC3CCCC3)C[C@H]2OC)C1	ZINC001082110950	1357949948	/nfs/dbraw/zinc/94/99/48/1357949948.db2.gz	NVVAWQPHBRDMID-QZTJIDSGSA-N	0	3	334.504	3.129	20	30		EGEDHN
CC[C@H](N[C@@H]1CN(C(=O)C#CC2CC2)C[C@H]1C)c1ccc(F)cc1F	ZINC001082504845	1358052094	/nfs/dbraw/zinc/05/20/94/1358052094.db2.gz	MIRCHZVFDGCIQX-ZNZDAUKMSA-N	0	3	346.421	3.266	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H](C)[C@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001082721761	1358080156	/nfs/dbraw/zinc/08/01/56/1358080156.db2.gz	IKYZLMOLDCQHIB-DJKXOVBDSA-N	0	3	343.446	3.236	20	30		EGEDHN
C=C(C)CCN1C[C@H]2OCCN(C(=O)[C@H]3CC[C@H](CC)CC3)[C@H]2C1	ZINC001083254206	1358126669	/nfs/dbraw/zinc/12/66/69/1358126669.db2.gz	GXZWQKLMOZBUQK-CADBVGFASA-N	0	3	334.504	3.081	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]2CN(C(=O)c3sc(C4CC4)nc3C)[C@@H]2C1	ZINC001084339949	1358196490	/nfs/dbraw/zinc/19/64/90/1358196490.db2.gz	OARNGIVGPCIPPO-HZPDHXFCSA-N	0	3	345.512	3.441	20	30		EGEDHN
N#Cc1cc(NC(=O)C23CCCN2CCC3)ccc1N1CCCCC1	ZINC001183557225	1387318806	/nfs/dbraw/zinc/31/88/06/1387318806.db2.gz	PVORTXBGOOUHNR-UHFFFAOYSA-N	0	3	338.455	3.115	20	30		EGEDHN
C#CCCN1CC[C@@H]2CN(C(=O)[C@H](C)Cc3ccccc3Cl)[C@@H]2C1	ZINC001084692957	1358283217	/nfs/dbraw/zinc/28/32/17/1358283217.db2.gz	HFAZZPLCZAYWKS-SZVBFZGTSA-N	0	3	344.886	3.075	20	30		EGEDHN
C=CCCN1CC[C@@H]2CN(C(=O)c3sc(C(C)C)nc3C)[C@@H]2C1	ZINC001084829047	1358322920	/nfs/dbraw/zinc/32/29/20/1358322920.db2.gz	MZPMHYJKUNSNHA-HUUCEWRRSA-N	0	3	333.501	3.297	20	30		EGEDHN
C=C(C)CN1CC[C@@H]2CN(C(=O)C[C@@H](C)c3ccc(OC)cc3)[C@@H]2C1	ZINC001084844222	1358325870	/nfs/dbraw/zinc/32/58/70/1358325870.db2.gz	KMMPJMRESCKVCU-YVWKXTFCSA-N	0	3	342.483	3.298	20	30		EGEDHN
C/C(=C\C(=O)N1CC[C@H]2CCN(Cc3ccc(C#N)cc3)[C@H]2C1)C1CC1	ZINC001084897161	1358342997	/nfs/dbraw/zinc/34/29/97/1358342997.db2.gz	QIJPCQHZWKDTNI-RBSFPSQFSA-N	0	3	349.478	3.337	20	30		EGEDHN
O=C(C#CC1CC1)N1CC[C@H]2CCN(C/C=C/c3ccccc3)[C@H]2C1	ZINC001084937647	1358352114	/nfs/dbraw/zinc/35/21/14/1358352114.db2.gz	OXKGONFPBJTINQ-YIEYKEOMSA-N	0	3	334.463	3.036	20	30		EGEDHN
C#CCN1CC[C@@H]2CCN(C(=O)C[C@@H](C)c3ccc(CC)cc3)C[C@@H]21	ZINC001085029884	1358372064	/nfs/dbraw/zinc/37/20/64/1358372064.db2.gz	DNBGKQKDFZABJJ-UIFIKXQLSA-N	0	3	338.495	3.299	20	30		EGEDHN
N#Cc1ccc(F)c(CN[C@@H]2CCCC[C@H]2NC(=O)C2CCCC2)c1	ZINC001085114385	1358395966	/nfs/dbraw/zinc/39/59/66/1358395966.db2.gz	VFRYXTHEHOCVQA-RTBURBONSA-N	0	3	343.446	3.405	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1nc(C)sc1C	ZINC001085241825	1358441530	/nfs/dbraw/zinc/44/15/30/1358441530.db2.gz	PEVGYSRPTVUQIW-CHWSQXEVSA-N	0	3	327.881	3.143	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)[C@@H]1COc2ccccc2C1	ZINC001085266277	1358447576	/nfs/dbraw/zinc/44/75/76/1358447576.db2.gz	RAMQHTNAKGEITR-GVDBMIGSSA-N	0	3	348.874	3.007	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CCCC[C@H]2NCc2ncccc2C)cc1	ZINC001085293767	1358455017	/nfs/dbraw/zinc/45/50/17/1358455017.db2.gz	ZKQQAOOQWPTPOD-WOJBJXKFSA-N	0	3	347.462	3.202	20	30		EGEDHN
CC1(C(=O)N[C@@H]2CCCC[C@H]2NCc2ccc(C#N)cc2F)CCC1	ZINC001085299198	1358457438	/nfs/dbraw/zinc/45/74/38/1358457438.db2.gz	IURAWKBAQRJQKY-QZTJIDSGSA-N	0	3	343.446	3.405	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCC[C@H]1NC(=O)C(C)(C)C1CC1	ZINC001085302874	1358458990	/nfs/dbraw/zinc/45/89/90/1358458990.db2.gz	IVUUEEYJYJYLSR-ZIAGYGMSSA-N	0	3	343.309	3.348	20	30		EGEDHN
C=C1CCC(C(=O)N[C@@H]2CCCC[C@H]2NCc2cncc(F)c2)CC1	ZINC001085321416	1358465635	/nfs/dbraw/zinc/46/56/35/1358465635.db2.gz	WGGBPKZRBZAMHA-RTBURBONSA-N	0	3	345.462	3.484	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CCCC[C@H]1NC(=O)c1cc(C)n(C(C)C)n1	ZINC001085443538	1358502217	/nfs/dbraw/zinc/50/22/17/1358502217.db2.gz	QOOQNMUCOSIXAU-HUUCEWRRSA-N	0	3	338.883	3.156	20	30		EGEDHN
CN(C[C@H]1CCN1[C@H]1CCCc2ccccc21)C(=O)c1cc(C#N)c[nH]1	ZINC001085535742	1358572794	/nfs/dbraw/zinc/57/27/94/1358572794.db2.gz	OUMXMQLGPJQLGR-XLIONFOSSA-N	0	3	348.450	3.110	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1ocnc1-c1ccccc1	ZINC001085633552	1358649848	/nfs/dbraw/zinc/64/98/48/1358649848.db2.gz	VHQFORMTBJTSSA-QGZVFWFLSA-N	0	3	339.439	3.454	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1ocnc1-c1ccccc1	ZINC001085633083	1358649912	/nfs/dbraw/zinc/64/99/12/1358649912.db2.gz	LQRQGLASKAETRC-INIZCTEOSA-N	0	3	325.412	3.064	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)C1CCc2ccccc2CC1	ZINC001085684929	1358685990	/nfs/dbraw/zinc/68/59/90/1358685990.db2.gz	FKKZARRUVBWARA-FQEVSTJZSA-N	0	3	326.484	3.290	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1[nH]nc(C2CC2)c1Cl	ZINC001085694469	1358691052	/nfs/dbraw/zinc/69/10/52/1358691052.db2.gz	GZAREYPHWLVTPZ-CYBMUJFWSA-N	0	3	336.867	3.053	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1ccc(F)c(COC)c1	ZINC001085806030	1358782832	/nfs/dbraw/zinc/78/28/32/1358782832.db2.gz	WTSOLSARVNXKPP-KRWDZBQOSA-N	0	3	334.435	3.085	20	30		EGEDHN
C#Cc1cncc(C(=O)N(C)C[C@@H]2CCN2[C@@H](CC)c2ccccc2)c1	ZINC001085809593	1358786931	/nfs/dbraw/zinc/78/69/31/1358786931.db2.gz	IVCCOUDNYUYHDI-SFTDATJTSA-N	0	3	347.462	3.361	20	30		EGEDHN
C=C(C)CCN1CC[C@@H]1CN(C)C(=O)c1cnc(C)nc1C(C)C	ZINC001085855263	1358823154	/nfs/dbraw/zinc/82/31/54/1358823154.db2.gz	UDNMKTHAVNRLGD-MRXNPFEDSA-N	0	3	330.476	3.021	20	30		EGEDHN
C=CCCN1CC[C@H]1CN(C)C(=O)c1ccc(OC)c(C2CC2)c1	ZINC001085898609	1358856681	/nfs/dbraw/zinc/85/66/81/1358856681.db2.gz	JJROVKBNMRTWSJ-KRWDZBQOSA-N	0	3	328.456	3.295	20	30		EGEDHN
C#Cc1ccc(C(=O)N(C)C[C@H]2CCN2Cc2c(C)cccc2C)cn1	ZINC001085934039	1358889813	/nfs/dbraw/zinc/88/98/13/1358889813.db2.gz	QHMCZRWQOQKRIY-HXUWFJFHSA-N	0	3	347.462	3.026	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cc(OC)c(C)c(OC)c1	ZINC001085959464	1358917249	/nfs/dbraw/zinc/91/72/49/1358917249.db2.gz	CSMZGAQUFSJANG-KRWDZBQOSA-N	0	3	346.471	3.125	20	30		EGEDHN
C=C(C)CCN1CC[C@H]1CN(C)C(=O)c1cccc2oc(C)nc21	ZINC001085993654	1358948734	/nfs/dbraw/zinc/94/87/34/1358948734.db2.gz	QYURRJFSLZRGFP-HNNXBMFYSA-N	0	3	327.428	3.249	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)C2=CCCCCC2)C1	ZINC001086069380	1358985757	/nfs/dbraw/zinc/98/57/57/1358985757.db2.gz	QZAAANODPRVEPL-OTVXOJSOSA-N	0	3	341.293	3.270	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2cccc3c2CCCC3)C1	ZINC001086095632	1358995628	/nfs/dbraw/zinc/99/56/28/1358995628.db2.gz	MLPRHSGNALLQBR-FZNQNYSPSA-N	0	3	332.875	3.416	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)c2c(F)cccc2Cl)C1	ZINC001086259556	1359045201	/nfs/dbraw/zinc/04/52/01/1359045201.db2.gz	HSEHCEOGCDWSFW-PHIMTYICSA-N	0	3	331.218	3.330	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@@H](CNC(=O)[C@H]2Cc3ccc(Cl)cc32)C1	ZINC001086264889	1359047415	/nfs/dbraw/zinc/04/74/15/1359047415.db2.gz	DXVFJSAKWRIHHA-PEYYIBSZSA-N	0	3	339.266	3.217	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc3cccnc3c2)C1	ZINC001086507622	1359123585	/nfs/dbraw/zinc/12/35/85/1359123585.db2.gz	DLXRBVIHTOYEFI-SAZUREKKSA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2cccc3ccncc32)C1	ZINC001086522603	1359130577	/nfs/dbraw/zinc/13/05/77/1359130577.db2.gz	AFGUDRJCKZCPFW-CTYIDZIISA-N	0	3	329.831	3.085	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](CNC(=O)c2ccc(F)c3occc32)C1	ZINC001086555597	1359143981	/nfs/dbraw/zinc/14/39/81/1359143981.db2.gz	OGJLHUKDUSTONZ-HAQNSBGRSA-N	0	3	336.794	3.422	20	30		EGEDHN
CCC(=O)N[C@@H]1CN(Cc2cccc(C#N)c2)C[C@H]1c1ccccc1	ZINC001086568288	1359150321	/nfs/dbraw/zinc/15/03/21/1359150321.db2.gz	XHLSQSKCRYOVOM-VQTJNVASSA-N	0	3	333.435	3.052	20	30		EGEDHN
C#CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2ccccc2F)C1	ZINC001086572081	1359152066	/nfs/dbraw/zinc/15/20/66/1359152066.db2.gz	DQKDHZQCBDXCMO-AZUAARDMSA-N	0	3	336.410	3.047	20	30		EGEDHN
C=C(C)CCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2cncs2)C1	ZINC001086578020	1359153243	/nfs/dbraw/zinc/15/32/43/1359153243.db2.gz	QPJYBLYTBVKWGU-DLBZAZTESA-N	0	3	341.480	3.307	20	30		EGEDHN
CC/C=C(\C)C(=O)N1CC[C@H](CNCc2ccccc2C#N)[C@H](C)C1	ZINC001184030502	1387383164	/nfs/dbraw/zinc/38/31/64/1387383164.db2.gz	DMQDYBSYLBOFAK-VHWOIRFASA-N	0	3	339.483	3.489	20	30		EGEDHN
C=CCCN1C[C@@H](c2ccccc2)[C@H](NC(=O)c2cnoc2CC)C1	ZINC001086612252	1359164845	/nfs/dbraw/zinc/16/48/45/1359164845.db2.gz	IPECWMGWZSTWAP-ZWKOTPCHSA-N	0	3	339.439	3.011	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cc(C(C)(C)C)on2)C1	ZINC001086755203	1359195681	/nfs/dbraw/zinc/19/56/81/1359195681.db2.gz	HGYLCRNZRHYBBF-QWHCGFSZSA-N	0	3	339.867	3.213	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2cc3ccsc3[nH]2)C1	ZINC001086771353	1359198166	/nfs/dbraw/zinc/19/81/66/1359198166.db2.gz	GMFMWTGJSAJSPM-WCQYABFASA-N	0	3	337.876	3.470	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2nc(Cl)cs2)C1	ZINC001086785791	1359201012	/nfs/dbraw/zinc/20/10/12/1359201012.db2.gz	SLUNCVXRGYZINH-VHSXEESVSA-N	0	3	334.272	3.037	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CC[C@@H](NCc3ccn(CC)n3)C2)CC1	ZINC001086794692	1359202550	/nfs/dbraw/zinc/20/25/50/1359202550.db2.gz	GVLMLSYLDRZPMV-FUHWJXTLSA-N	0	3	344.503	3.024	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CC[C@@H](NCc3cc(C)no3)C2)CC1	ZINC001086793468	1359202614	/nfs/dbraw/zinc/20/26/14/1359202614.db2.gz	UYPLQXQSFRSBFP-DOTOQJQBSA-N	0	3	331.460	3.104	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)[C@H]2CCc3ccccc3C2)C1	ZINC001086815111	1359207243	/nfs/dbraw/zinc/20/72/43/1359207243.db2.gz	FCMICXWAIURDOQ-ZYSHUDEJSA-N	0	3	346.902	3.419	20	30		EGEDHN
C=C(Cl)CN[C@@H]1CC[C@H](CNC(=O)c2sccc2COC)C1	ZINC001086853387	1359214173	/nfs/dbraw/zinc/21/41/73/1359214173.db2.gz	WWRYIUCORLDFHD-GXTWGEPZSA-N	0	3	342.892	3.135	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)Cc3cccs3)C2)CC1	ZINC001086898171	1359227373	/nfs/dbraw/zinc/22/73/73/1359227373.db2.gz	CAONJXLEUDEGCQ-INIZCTEOSA-N	0	3	330.497	3.017	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3sccc3C)C2)CC1	ZINC001086898832	1359228592	/nfs/dbraw/zinc/22/85/92/1359228592.db2.gz	SUWCJEAQQGDLRI-MRXNPFEDSA-N	0	3	330.497	3.396	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccccc3F)C2)CC1	ZINC001086899291	1359229122	/nfs/dbraw/zinc/22/91/22/1359229122.db2.gz	GHCCPQLCPAFZIU-MRXNPFEDSA-N	0	3	328.431	3.166	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)c3ccccc3F)C2)CC1	ZINC001086899290	1359229257	/nfs/dbraw/zinc/22/92/57/1359229257.db2.gz	GHCCPQLCPAFZIU-INIZCTEOSA-N	0	3	328.431	3.166	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc(C)oc3C)C2)CC1	ZINC001086902467	1359231695	/nfs/dbraw/zinc/23/16/95/1359231695.db2.gz	FPDRIUXEIGHSQO-OAHLLOKOSA-N	0	3	328.456	3.236	20	30		EGEDHN
CC#CCN1CCC2(C[C@@H](C)N(C(=O)c3ccsc3C)C2)CC1	ZINC001086923355	1359249381	/nfs/dbraw/zinc/24/93/81/1359249381.db2.gz	PIMLRXDLWCMGOV-OAHLLOKOSA-N	0	3	330.497	3.396	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cc(C)c(F)cc3F)C2)CC1	ZINC001086928722	1359253144	/nfs/dbraw/zinc/25/31/44/1359253144.db2.gz	NCRMHZNAXBMSSH-OAHLLOKOSA-N	0	3	346.421	3.223	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)Cc3cccc(C)c3)C2)CC1	ZINC001086939825	1359261992	/nfs/dbraw/zinc/26/19/92/1359261992.db2.gz	AFTPJAPTYSPZFE-IBGZPJMESA-N	0	3	338.495	3.264	20	30		EGEDHN
C=C1CCC(C(=O)N2CC3(C[C@@H]2C)CCN(CC#CC)CC3)CC1	ZINC001086941410	1359263156	/nfs/dbraw/zinc/26/31/56/1359263156.db2.gz	SQTALTUZALXMSJ-SFHVURJKSA-N	0	3	328.500	3.459	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)Cc3ccc(CC)cc3)C2)CC1	ZINC001086945681	1359266970	/nfs/dbraw/zinc/26/69/70/1359266970.db2.gz	GQMNYJUQQWMJEQ-GOSISDBHSA-N	0	3	338.495	3.128	20	30		EGEDHN
CC#CCN1CCC2(C[C@H](C)N(C(=O)C3(F)CCCCC3)C2)CC1	ZINC001086951730	1359272051	/nfs/dbraw/zinc/27/20/51/1359272051.db2.gz	ODRFDFZEWJKRIC-KRWDZBQOSA-N	0	3	334.479	3.385	20	30		EGEDHN
C#CCN1CCC2(C[C@H](C)N(C(=O)c3ccccc3Cl)C2)CC1	ZINC001086953334	1359273609	/nfs/dbraw/zinc/27/36/09/1359273609.db2.gz	FVGVDODMNCAYSZ-HNNXBMFYSA-N	0	3	330.859	3.290	20	30		EGEDHN
C#CCN1CCC2(C[C@@H](C)N(C(=O)c3cccn3C(C)C)C2)CC1	ZINC001086957356	1359277975	/nfs/dbraw/zinc/27/79/75/1359277975.db2.gz	KVLGIFAAQLWNII-QGZVFWFLSA-N	0	3	327.472	3.019	20	30		EGEDHN
C[C@@H]1CCN(C(=O)C#CC2CC2)[C@H](CNCc2ccc(F)cc2F)C1	ZINC001087164201	1359311711	/nfs/dbraw/zinc/31/17/11/1359311711.db2.gz	MUCDKOXOCVYRCC-KDOFPFPSSA-N	0	3	346.421	3.095	20	30		EGEDHN
C=CCCC(=O)N1CC[C@@H](CNCc2ccn(C(C)C)n2)[C@H](C)C1	ZINC001184079134	1387389621	/nfs/dbraw/zinc/38/96/21/1387389621.db2.gz	UHHXGLBDULEMRC-SJORKVTESA-N	0	3	332.492	3.004	20	30		EGEDHN
C=CCC[N@H+]1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccccc1[O-]	ZINC001087271535	1359344870	/nfs/dbraw/zinc/34/48/70/1359344870.db2.gz	SRXTZXAFAIRMOQ-BPQIPLTHSA-N	0	3	328.456	3.187	20	30		EGEDHN
C=CCC[N@@H+]1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1ccccc1[O-]	ZINC001087271535	1359344873	/nfs/dbraw/zinc/34/48/73/1359344873.db2.gz	SRXTZXAFAIRMOQ-BPQIPLTHSA-N	0	3	328.456	3.187	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cccc(C)c3F)C(C)(C)[C@H]21	ZINC001087287418	1359365909	/nfs/dbraw/zinc/36/59/09/1359365909.db2.gz	HGEHKMOVSAMPDE-QRQLOZEOSA-N	0	3	342.458	3.376	20	30		EGEDHN
C#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1cc(F)ccc1CC	ZINC001087294038	1359374140	/nfs/dbraw/zinc/37/41/40/1359374140.db2.gz	NEJSAWZPWVLKDM-NZSAHSFTSA-N	0	3	342.458	3.240	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(F)ccc3CC)C(C)(C)[C@H]21	ZINC001087294039	1359374441	/nfs/dbraw/zinc/37/44/41/1359374441.db2.gz	NEJSAWZPWVLKDM-QRQLOZEOSA-N	0	3	342.458	3.240	20	30		EGEDHN
C=CCN1CCC[C@@H]2[C@@H](NC(=O)c3ncc(Cl)s3)C(C)(C)[C@H]21	ZINC001087294962	1359375046	/nfs/dbraw/zinc/37/50/46/1359375046.db2.gz	BKAHVCSAIYDUOC-RTXFEEFZSA-N	0	3	339.892	3.201	20	30		EGEDHN
C=CCN1CCC[C@@H]2[C@H](NC(=O)c3ncc(Cl)s3)C(C)(C)[C@H]21	ZINC001087294963	1359375534	/nfs/dbraw/zinc/37/55/34/1359375534.db2.gz	BKAHVCSAIYDUOC-WXHSDQCUSA-N	0	3	339.892	3.201	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc(F)c(C)c3)C(C)(C)[C@H]21	ZINC001087300945	1359384132	/nfs/dbraw/zinc/38/41/32/1359384132.db2.gz	STZXTTNKKPOAFO-QRQLOZEOSA-N	0	3	342.458	3.376	20	30		EGEDHN
CC#CCN1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2NC(=O)c1occc1Cl	ZINC001087303322	1359386684	/nfs/dbraw/zinc/38/66/84/1359386684.db2.gz	JWFQVJXCHIZVML-UHOFOFEASA-N	0	3	334.847	3.175	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(C(C)C)no3)C(C)(C)[C@@H]21	ZINC001087304967	1359389404	/nfs/dbraw/zinc/38/94/04/1359389404.db2.gz	KLCQOEBAFROHHJ-ZTFGCOKTSA-N	0	3	343.471	3.040	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3csc(Cl)c3)C(C)(C)[C@H]21	ZINC001087306879	1359394108	/nfs/dbraw/zinc/39/41/08/1359394108.db2.gz	PXQFEMACTFLATR-YUELXQCFSA-N	0	3	336.888	3.254	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@H](NC(=O)Cc3ccsc3C)C(C)(C)[C@H]21	ZINC001087307846	1359394738	/nfs/dbraw/zinc/39/47/38/1359394738.db2.gz	IEWOLNVAZMEBNL-NEWSRXKRSA-N	0	3	344.524	3.228	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc4sccc4[nH]3)C(C)(C)[C@H]21	ZINC001087313303	1359402011	/nfs/dbraw/zinc/40/20/11/1359402011.db2.gz	SDGMJLRBWOXKFL-DQYPLSBCSA-N	0	3	341.480	3.081	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@H](NC(=O)c3cc4ccccc4o3)C(C)(C)[C@H]21	ZINC001087315748	1359405672	/nfs/dbraw/zinc/40/56/72/1359405672.db2.gz	HPGSVXMSSNRKNQ-MNEFBYGVSA-N	0	3	336.435	3.285	20	30		EGEDHN
CC#CCN1CCC[C@@H]2[C@@H](NC(=O)c3cc(F)cc(F)c3)C(C)(C)[C@@H]21	ZINC001087316047	1359406764	/nfs/dbraw/zinc/40/67/64/1359406764.db2.gz	MAQKIDYYJGQFJA-KZNAEPCWSA-N	0	3	346.421	3.207	20	30		EGEDHN
C#CCN1CCC[C@@H]2[C@@H](NC(=O)c3ccc4c(c3)CCC4)C(C)(C)[C@H]21	ZINC001087317118	1359408093	/nfs/dbraw/zinc/40/80/93/1359408093.db2.gz	CVMZBCSIXWHWNY-AQNXPRMDSA-N	0	3	336.479	3.027	20	30		EGEDHN
C/C=C(\C)C(=O)N1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1CC#Cc1ccccc1	ZINC001087347781	1359428212	/nfs/dbraw/zinc/42/82/12/1359428212.db2.gz	KAFYTLSUOHVEJP-YFDAXTJZSA-N	0	3	348.490	3.173	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)Cc2ccccc2)C1	ZINC001087430771	1359462691	/nfs/dbraw/zinc/46/26/91/1359462691.db2.gz	HENSTQAQFDQLBZ-FGZHOGPDSA-N	0	3	346.474	3.227	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)[C@H]2C[C@H]3C[C@H]3C2)C1	ZINC001087435422	1359464839	/nfs/dbraw/zinc/46/48/39/1359464839.db2.gz	OHBKCAAAZIBTSW-XDWAVFMPSA-N	0	3	336.479	3.030	20	30		EGEDHN
C#CCCN1CC[C@H](c2ccccc2)[C@H](NC(=O)[C@@H]2C[C@H]2CCC)C1	ZINC001087436956	1359465619	/nfs/dbraw/zinc/46/56/19/1359465619.db2.gz	TVMYBFNQULPIIF-XRXFAXGQSA-N	0	3	338.495	3.420	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2oc(CC3CC3)nc2C)[C@H]1CC	ZINC001087573154	1359538456	/nfs/dbraw/zinc/53/84/56/1359538456.db2.gz	WEKOZAQQPJEJGV-JKSUJKDBSA-N	0	3	331.460	3.094	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cccc3c2O[C@H](C)C3)[C@H]1CC	ZINC001087662149	1359577314	/nfs/dbraw/zinc/57/73/14/1359577314.db2.gz	VVMSEUKOCOMKJQ-FHLIZLRMSA-N	0	3	328.456	3.169	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2c(F)ccc(F)c2F)[C@H]1CC	ZINC001087707384	1359602048	/nfs/dbraw/zinc/60/20/48/1359602048.db2.gz	QVDRCWKEVFRSJZ-UONOGXRCSA-N	0	3	326.362	3.263	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)Cc2c[nH]c3cc(C)ccc23)[C@H]1CC	ZINC001087760085	1359631810	/nfs/dbraw/zinc/63/18/10/1359631810.db2.gz	VIQKTNCRYPSCGR-PKOBYXMFSA-N	0	3	325.456	3.174	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)[C@@]2(C)CCCc3ccccc32)[C@H]1CC	ZINC001087763734	1359632918	/nfs/dbraw/zinc/63/29/18/1359632918.db2.gz	IOXCNFZZBDWDQG-ZVDOUQERSA-N	0	3	326.484	3.436	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2cnn([C@H](C)CC)c2C)[C@H]1CC	ZINC001087790307	1359645751	/nfs/dbraw/zinc/64/57/51/1359645751.db2.gz	DUPPHJMSUHGIQC-FHLIZLRMSA-N	0	3	332.492	3.321	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccc(COC)c(F)c2)[C@H]1CC	ZINC001087809702	1359659459	/nfs/dbraw/zinc/65/94/59/1359659459.db2.gz	HEZLHYKAPPKARB-ZWKOTPCHSA-N	0	3	334.435	3.131	20	30		EGEDHN
C=CCN1CC[C@H](NC(=O)Cc2cccc(OC(C)C)c2)[C@H]1CC	ZINC001087844533	1359678026	/nfs/dbraw/zinc/67/80/26/1359678026.db2.gz	DBRXFNDAIBQUNR-RBUKOAKNSA-N	0	3	330.472	3.171	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3coc4cc(C)c(C)cc34)C[C@@H]2C1	ZINC001088053456	1359735789	/nfs/dbraw/zinc/73/57/89/1359735789.db2.gz	JACCQCWVJRIYBC-SJORKVTESA-N	0	3	336.435	3.077	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CCN(Cc3ccccc3F)C[C@H]2C1	ZINC001088066464	1359740257	/nfs/dbraw/zinc/74/02/57/1359740257.db2.gz	LMNCQNTZWGLWTH-WBVHZDCISA-N	0	3	330.447	3.318	20	30		EGEDHN
CCC1(C(=O)N2C[C@H]3CCN(Cc4ccc(C#N)cc4)C[C@H]3C2)CC1	ZINC001088094248	1359753496	/nfs/dbraw/zinc/75/34/96/1359753496.db2.gz	ABRNHECMRJITLI-MOPGFXCFSA-N	0	3	337.467	3.029	20	30		EGEDHN
C#CCN1CC[C@@H]2CN(C(=O)c3oc4ccccc4c3Cl)C[C@@H]2C1	ZINC001088168624	1359778527	/nfs/dbraw/zinc/77/85/27/1359778527.db2.gz	LNFAMNXQNWLLNF-KGLIPLIRSA-N	0	3	342.826	3.113	20	30		EGEDHN
C#CCCCCC(=O)N1CC[C@@H](CNCc2nc(C)cs2)[C@@H](C)C1	ZINC001184209719	1387415475	/nfs/dbraw/zinc/41/54/75/1387415475.db2.gz	PWOCAWKLNXCFTI-RDJZCZTQSA-N	0	3	347.528	3.219	20	30		EGEDHN
C=C(Br)CN[C@H]1CCCCCN(C(=O)C=C2CCC2)C1	ZINC001088294335	1359829082	/nfs/dbraw/zinc/82/90/82/1359829082.db2.gz	VYWSJOCJBPPANB-HNNXBMFYSA-N	0	3	341.293	3.366	20	30		EGEDHN
C=C(Br)CN[C@@H]1CCCCCN(C(=O)[C@H](F)CC)C1	ZINC001088360601	1359844932	/nfs/dbraw/zinc/84/49/32/1359844932.db2.gz	CGORYIAMVITDKU-CHWSQXEVSA-N	0	3	335.261	3.004	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)[C@@H]2C[C@H]2c2ccc(N(C)C)cc2)[C@H]1C	ZINC001088762936	1360033821	/nfs/dbraw/zinc/03/38/21/1360033821.db2.gz	DFIMPZRENSRUKA-NMLACTOBSA-N	0	3	341.499	3.011	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)C(C)(C)c2cccc(Cl)c2)[C@H]1C	ZINC001088888260	1360093555	/nfs/dbraw/zinc/09/35/55/1360093555.db2.gz	GQADKDISWFVBGW-PBHICJAKSA-N	0	3	332.875	3.220	20	30		EGEDHN
C=C(C)CN1CC[C@H](NC(=O)c2ccccc2OCC(C)C)[C@H]1C	ZINC001088926910	1360105537	/nfs/dbraw/zinc/10/55/37/1360105537.db2.gz	ZMPBPDMUBNGGDW-AEFFLSMTSA-N	0	3	330.472	3.490	20	30		EGEDHN
C#CCCN1CC[C@H](NC(=O)c2c(Cl)cccc2Cl)[C@H]1C	ZINC001089001659	1360132877	/nfs/dbraw/zinc/13/28/77/1360132877.db2.gz	VCHBGWCMLHNOFS-RISCZKNCSA-N	0	3	325.239	3.209	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCCN1C(=O)CC1CC1	ZINC001089102255	1360168144	/nfs/dbraw/zinc/16/81/44/1360168144.db2.gz	YECPBRSARLDGFY-IBGZPJMESA-N	0	3	325.456	3.171	20	30		EGEDHN
CN(Cc1cccc(C#N)c1)C[C@@H]1CCCCN1C(=O)c1ccc[nH]1	ZINC001089118075	1360181416	/nfs/dbraw/zinc/18/14/16/1360181416.db2.gz	QRZNQMYLWOOLTJ-SFHVURJKSA-N	0	3	336.439	3.013	20	30		EGEDHN
C[C@@H]1C[C@H]1C(=O)N1CCCC[C@H]1CN(C)Cc1cccc(C#N)c1	ZINC001089208164	1360253564	/nfs/dbraw/zinc/25/35/64/1360253564.db2.gz	LGWMDCAOZSMLDI-AYOQOUSVSA-N	0	3	325.456	3.027	20	30		EGEDHN
CC1(C(=O)N[C@@H]2CCN(CC#Cc3ccccc3)CC(C)(C)C2)CC1	ZINC001089395385	1360395282	/nfs/dbraw/zinc/39/52/82/1360395282.db2.gz	UTXKSDZBTVRILW-LJQANCHMSA-N	0	3	338.495	3.445	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc3cc(C)ccc3n2)CC(C)(C)C1	ZINC001089436257	1360427516	/nfs/dbraw/zinc/42/75/16/1360427516.db2.gz	UGNHJMWWRRTIJU-GOSISDBHSA-N	0	3	349.478	3.397	20	30		EGEDHN
CC#CCN1CC[C@H](NC(=O)c2occ3c2CCC3)CC(C)(C)C1	ZINC001089451937	1360439488	/nfs/dbraw/zinc/43/94/88/1360439488.db2.gz	ZMAHYIMLDILRGP-INIZCTEOSA-N	0	3	328.456	3.012	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2ccc3nc(C)ccc3c2)CC(C)(C)C1	ZINC001089524678	1360489837	/nfs/dbraw/zinc/48/98/37/1360489837.db2.gz	RVWDEQGAKFBHEO-LJQANCHMSA-N	0	3	349.478	3.397	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)c2cnn([C@H](C)CC)c2C)CC(C)(C)C1	ZINC001089536651	1360496088	/nfs/dbraw/zinc/49/60/88/1360496088.db2.gz	FBSDWDJYGNGWDL-WBVHZDCISA-N	0	3	344.503	3.016	20	30		EGEDHN
C#CCN1CC[C@H](NC(=O)C23CC4CC(CC(C4)C2)C3)CC(C)(C)C1	ZINC001089543804	1360499325	/nfs/dbraw/zinc/49/93/25/1360499325.db2.gz	HMWYVNHOQMLYSI-ONUXSRJRSA-N	0	3	342.527	3.443	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)[C@@H](C)c2ccccc2C)CC(C)(C)C1	ZINC001089561710	1360509193	/nfs/dbraw/zinc/50/91/93/1360509193.db2.gz	SAAOPMNWGIJCMW-ZWKOTPCHSA-N	0	3	326.484	3.339	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)c2cc(Cl)cn2CC)CC(C)(C)C1	ZINC001089563094	1360510755	/nfs/dbraw/zinc/51/07/55/1360510755.db2.gz	OWXJBZBROJUOKF-OAHLLOKOSA-N	0	3	335.879	3.015	20	30		EGEDHN
C#CCN1CC[C@@H](NC(=O)C2(c3ccccc3C)CC2)CC(C)(C)C1	ZINC001089569310	1360514749	/nfs/dbraw/zinc/51/47/49/1360514749.db2.gz	WCNHFAUFLNKZIJ-GOSISDBHSA-N	0	3	338.495	3.267	20	30		EGEDHN
CC(C)=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(C#N)c[nH]1	ZINC001089623781	1360541714	/nfs/dbraw/zinc/54/17/14/1360541714.db2.gz	SLXXSNIORVTVSY-INIZCTEOSA-N	0	3	328.460	3.073	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CC[C@@H](CNCc2ocnc2C)[C@@H](C)C1	ZINC001184448358	1387462473	/nfs/dbraw/zinc/46/24/73/1387462473.db2.gz	OBBBHYAPIUQJKK-YJBOKZPZSA-N	0	3	345.487	3.326	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)[C@H]1OCC[C@H]1C(C)C	ZINC001089640244	1360553805	/nfs/dbraw/zinc/55/38/05/1360553805.db2.gz	DBBPWVYTSDFLIP-BZSNNMDCSA-N	0	3	336.520	3.230	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccnn1C(C)C	ZINC001089646343	1360559290	/nfs/dbraw/zinc/55/92/90/1360559290.db2.gz	NUIREEOIENIDHB-MRXNPFEDSA-N	0	3	332.492	3.261	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc2cccn2cn1	ZINC001089656899	1360568369	/nfs/dbraw/zinc/56/83/69/1360568369.db2.gz	ORRZODDESLTKRN-QGZVFWFLSA-N	0	3	340.471	3.131	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1ncc(F)cc1F	ZINC001089657539	1360568909	/nfs/dbraw/zinc/56/89/09/1360568909.db2.gz	VSNLPCSPZBYYFK-AWEZNQCLSA-N	0	3	337.414	3.156	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cc(C)ccc1OC	ZINC001089666805	1360576657	/nfs/dbraw/zinc/57/66/57/1360576657.db2.gz	XFFOPLHLYXSSEI-QGZVFWFLSA-N	0	3	342.483	3.247	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cn(C(C)C)cn1	ZINC001089674836	1360583448	/nfs/dbraw/zinc/58/34/48/1360583448.db2.gz	DZANEMGCYDELDQ-INIZCTEOSA-N	0	3	332.492	3.261	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(F)c(COC)c1	ZINC001089690968	1360596546	/nfs/dbraw/zinc/59/65/46/1360596546.db2.gz	HFOVCQKBVOAQEV-KRWDZBQOSA-N	0	3	348.462	3.379	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(C)cc(F)c1	ZINC001089696213	1360600945	/nfs/dbraw/zinc/60/09/45/1360600945.db2.gz	UVXUHQVUXHDYQZ-SFHVURJKSA-N	0	3	330.447	3.378	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc2c(c1)CCO2	ZINC001089697214	1360601808	/nfs/dbraw/zinc/60/18/08/1360601808.db2.gz	MSVARBGMAIDIGN-GOSISDBHSA-N	0	3	342.483	3.418	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc2c(c1)CCO2	ZINC001089697560	1360601946	/nfs/dbraw/zinc/60/19/46/1360601946.db2.gz	PKQDGLGTGXZGNX-QGZVFWFLSA-N	0	3	328.456	3.028	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cnn(CCC)c1	ZINC001089703504	1360606583	/nfs/dbraw/zinc/60/65/83/1360606583.db2.gz	KXAPQONXZATJAO-QGZVFWFLSA-N	0	3	332.492	3.090	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cnn2ccccc12	ZINC001089711546	1360614953	/nfs/dbraw/zinc/61/49/53/1360614953.db2.gz	XGDQSYUFUKVSNH-INIZCTEOSA-N	0	3	340.471	3.131	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1nc(C2CC2)oc1C	ZINC001089717563	1360619200	/nfs/dbraw/zinc/61/92/00/1360619200.db2.gz	BJROSLFFCBBLAU-INIZCTEOSA-N	0	3	343.471	3.104	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1c[nH]nc1C1CC1	ZINC001089717496	1360619572	/nfs/dbraw/zinc/61/95/72/1360619572.db2.gz	AWDZMVNUZWTOKA-HNNXBMFYSA-N	0	3	330.476	3.084	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)c1cc(CCC)on1	ZINC001089718437	1360619947	/nfs/dbraw/zinc/61/99/47/1360619947.db2.gz	PYZAKPXJHCBMMX-HNNXBMFYSA-N	0	3	333.476	3.424	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccc(C)cc1OC	ZINC001089727055	1360629816	/nfs/dbraw/zinc/62/98/16/1360629816.db2.gz	XNMFCMDSWSRIEL-KRWDZBQOSA-N	0	3	342.483	3.247	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)C1CC2(C1)CCOCC2	ZINC001089726682	1360629947	/nfs/dbraw/zinc/62/99/47/1360629947.db2.gz	UAIIBEHVYXWBQP-GOSISDBHSA-N	0	3	348.531	3.376	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1ccc2ccccc2n1	ZINC001089727256	1360630580	/nfs/dbraw/zinc/63/05/80/1360630580.db2.gz	XBDBQWZZANRKPZ-GOSISDBHSA-N	0	3	349.478	3.479	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cn2ccccc2n1	ZINC001089730226	1360633604	/nfs/dbraw/zinc/63/36/04/1360633604.db2.gz	XUCJLJZIOOHZGK-MRXNPFEDSA-N	0	3	340.471	3.131	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)c1cn(C)nc1C(C)C	ZINC001089731878	1360635641	/nfs/dbraw/zinc/63/56/41/1360635641.db2.gz	XUNGAZHSLUZYGY-MRXNPFEDSA-N	0	3	346.519	3.340	20	30		EGEDHN
C#CCCN1CC(C)(C)CC[C@@H]1CNC(=O)c1cccn1C(C)C	ZINC001089735659	1360640097	/nfs/dbraw/zinc/64/00/97/1360640097.db2.gz	NUJOOUZVAGQOLF-QGZVFWFLSA-N	0	3	329.488	3.313	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1oc(C)cc1C	ZINC001089791398	1360664792	/nfs/dbraw/zinc/66/47/92/1360664792.db2.gz	GKSURTLSMHHAPI-NXOAAHMSSA-N	0	3	348.874	3.431	20	30		EGEDHN
C=C(Cl)CN1C[C@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)c1cc(C)c(C)o1	ZINC001089797163	1360667882	/nfs/dbraw/zinc/66/78/82/1360667882.db2.gz	JXUFMBUBFGVLLH-HZMVEIRTSA-N	0	3	348.874	3.431	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc3ccc(C)cc3[nH]2)C1	ZINC001091169771	1361000648	/nfs/dbraw/zinc/00/06/48/1361000648.db2.gz	CLCRHTJNGWWWSX-UHFFFAOYSA-N	0	3	331.847	3.327	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2cc(F)cc(Cl)c2)C1	ZINC001091251282	1361021838	/nfs/dbraw/zinc/02/18/38/1361021838.db2.gz	AMNGCOAJHPGEKL-UHFFFAOYSA-N	0	3	331.218	3.330	20	30		EGEDHN
C=C(Cl)CNC1CC(CNC(=O)c2oc(CC(C)C)nc2C)C1	ZINC001091271435	1361027467	/nfs/dbraw/zinc/02/74/67/1361027467.db2.gz	HQCXSHFLPUQJOZ-UHFFFAOYSA-N	0	3	339.867	3.032	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@H]2CN(Cc3oc(CC)nc3C)C[C@@]2(C)C1	ZINC001091916647	1361247623	/nfs/dbraw/zinc/24/76/23/1361247623.db2.gz	KFAPERPFQVWVLO-QRWLVFNGSA-N	0	3	345.487	3.038	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C34CCC(CC3)C4(C)C)C[C@]2(C)C1	ZINC001092082412	1361294443	/nfs/dbraw/zinc/29/44/43/1361294443.db2.gz	YHFGQSABOLGBHS-VVMSIFSJSA-N	0	3	328.500	3.006	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3cccc(Cl)c3Cl)C[C@]2(C)C1	ZINC001092224824	1361330529	/nfs/dbraw/zinc/33/05/29/1361330529.db2.gz	ODFPREPKGOTRNS-PXAZEXFGSA-N	0	3	337.250	3.021	20	30		EGEDHN
C#CCN1C[C@@H]2CN(C(=O)c3ccccc3-c3ccccc3)C[C@]2(C)C1	ZINC001092251471	1361342350	/nfs/dbraw/zinc/34/23/50/1361342350.db2.gz	JDRDYRGXWBYTBA-XXBNENTESA-N	0	3	344.458	3.381	20	30		EGEDHN
CC#CCN1C[C@@H]2CN(C(=O)C[C@H]3CCCCC3(C)C)C[C@]2(C)C1	ZINC001092327015	1361365624	/nfs/dbraw/zinc/36/56/24/1361365624.db2.gz	WZXVVDQSFIXENT-OPYAIIAOSA-N	0	3	330.516	3.397	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)Cc2ccsc2)CC1	ZINC001093351784	1361565253	/nfs/dbraw/zinc/56/52/53/1361565253.db2.gz	OTCXZPDKZFYLAD-LJQANCHMSA-N	0	3	342.508	3.017	20	30		EGEDHN
O=C(C#CC1CC1)N1CCC([C@@H]2N(C/C=C\Cl)CC23CCC3)CC1	ZINC001093370234	1361579286	/nfs/dbraw/zinc/57/92/86/1361579286.db2.gz	QPUCMNASRNVXCS-GTMDEXKKSA-N	0	3	346.902	3.245	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@@H]1C1CCN(C(=O)C(C)=C2CCC2)CC1	ZINC001093371794	1361581173	/nfs/dbraw/zinc/58/11/73/1361581173.db2.gz	VECKJJZGDHETRP-IBGZPJMESA-N	0	3	326.484	3.213	20	30		EGEDHN
C[C@H](NC[C@@H]1CN(C(=O)C#CC2CC2)C[C@H]1C)c1c(F)cccc1F	ZINC001093762437	1361692733	/nfs/dbraw/zinc/69/27/33/1361692733.db2.gz	NOQGEUYKVLOGLY-IJEWVQPXSA-N	0	3	346.421	3.123	20	30		EGEDHN
C[C@H](C(=O)N1C[C@@H](CNCc2ccccc2C#N)[C@H](C)C1)C(C)(F)F	ZINC001094051488	1361730073	/nfs/dbraw/zinc/73/00/73/1361730073.db2.gz	SMTMYRBEEOLRME-CKEIUWERSA-N	0	3	349.425	3.034	20	30		EGEDHN
CC(C)[C@H](C)C(=O)N1C[C@@H](CNCc2cc(F)ccc2C#N)[C@H](C)C1	ZINC001094086219	1361736382	/nfs/dbraw/zinc/73/63/82/1361736382.db2.gz	IOCRXZZFBRMCHB-RVKKMQEKSA-N	0	3	345.462	3.174	20	30		EGEDHN
C=C(C)CC[N@@H+]1CC[C@@]2(CNC(=O)c3ccccc3[O-])CCC[C@@H]12	ZINC001094363863	1361777203	/nfs/dbraw/zinc/77/72/03/1361777203.db2.gz	IERSTAJLWYHZOI-UYAOXDASSA-N	0	3	328.456	3.333	20	30		EGEDHN
C=C(C)CC[N@H+]1CC[C@@]2(CNC(=O)c3ccccc3[O-])CCC[C@@H]12	ZINC001094363863	1361777210	/nfs/dbraw/zinc/77/72/10/1361777210.db2.gz	IERSTAJLWYHZOI-UYAOXDASSA-N	0	3	328.456	3.333	20	30		EGEDHN
N#Cc1ccccc1CN[C@H]1C[C@H]2C[C@@H](C1)N(C(=O)C1=CCCC1)C2	ZINC001094896024	1361937062	/nfs/dbraw/zinc/93/70/62/1361937062.db2.gz	LTKJLWCYIRVWNC-YSSFQJQWSA-N	0	3	335.451	3.138	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)Cc1cccc3cnccc31)C2	ZINC001095618655	1362186910	/nfs/dbraw/zinc/18/69/10/1362186910.db2.gz	IFUICVPUEGSRJH-HOJAQTOUSA-N	0	3	335.451	3.075	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cccc([C@H]3CCOC3)c1)C2	ZINC001095650172	1362196692	/nfs/dbraw/zinc/19/66/92/1362196692.db2.gz	IVHZRGGLVHMWFL-YRPNKDGESA-N	0	3	340.467	3.102	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1ccc3c4c(cccc41)CC3)C2	ZINC001095728330	1362215295	/nfs/dbraw/zinc/21/52/95/1362215295.db2.gz	YNKCUHNENUGFET-QMMLZNLJSA-N	0	3	344.458	3.297	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@@H](CNCc2ocnc2C)[C@H](C)C1	ZINC001184945441	1387567747	/nfs/dbraw/zinc/56/77/47/1387567747.db2.gz	NQLFCHAHLQRNML-AEFFLSMTSA-N	0	3	345.487	3.141	20	30		EGEDHN
C#CCCCCCC(=O)N1CC[C@H](CNCc2ocnc2C)[C@H](C)C1	ZINC001184945443	1387568085	/nfs/dbraw/zinc/56/80/85/1387568085.db2.gz	NQLFCHAHLQRNML-SJLPKXTDSA-N	0	3	345.487	3.141	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)c1cc(-c3ccccc3)ccn1)C2	ZINC001096241698	1362449016	/nfs/dbraw/zinc/44/90/16/1362449016.db2.gz	ODMRXKSUSNYCDS-DYXWJJEUSA-N	0	3	345.446	3.107	20	30		EGEDHN
C[C@@H](C(=O)NC1(C)CCN(Cc2ccc(C#N)cc2)CC1)C1CCC1	ZINC001324317830	1387589834	/nfs/dbraw/zinc/58/98/34/1387589834.db2.gz	AZAXHHHUOGGPBO-MRXNPFEDSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](CNCc2csc(C)n2)[C@H](C)C1	ZINC001185062889	1387605183	/nfs/dbraw/zinc/60/51/83/1387605183.db2.gz	WOXFIGLRIZXVAD-GDBMZVCRSA-N	0	3	335.517	3.382	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)Cc1ccc(C(F)F)cc1)C2	ZINC001097521722	1363037111	/nfs/dbraw/zinc/03/71/11/1363037111.db2.gz	DJDJZPYYQZMKQV-ZACQAIPSSA-N	0	3	334.410	3.464	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N1CC[C@@H](NCc2cc(C)ccc2OC)C1	ZINC001185064714	1387607267	/nfs/dbraw/zinc/60/72/67/1387607267.db2.gz	WAVWLRZPTSXVSK-FUHWJXTLSA-N	0	3	330.472	3.296	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)[C@H]1COc3cc(C)c(C)cc31)C2	ZINC001097584530	1363061044	/nfs/dbraw/zinc/06/10/44/1363061044.db2.gz	VMCMYKCJEWCIPU-LULLPPNCSA-N	0	3	340.467	3.077	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)C[C@@H]1CCOc3ccccc31)C2	ZINC001097642820	1363087488	/nfs/dbraw/zinc/08/74/88/1363087488.db2.gz	PDBIQYVHEMMMAX-ISARSNTHSA-N	0	3	340.467	3.240	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ccc3c(c1)[C@H](C)CO3)C2	ZINC001097687207	1363101220	/nfs/dbraw/zinc/10/12/20/1363101220.db2.gz	LSGRWWYPBVCROG-UWIFEVILSA-N	0	3	326.440	3.094	20	30		EGEDHN
C=CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1ncc(Cl)cc1Cl)C2	ZINC001098101108	1363222309	/nfs/dbraw/zinc/22/23/09/1363222309.db2.gz	YHRUQJHTQXBFFP-BNOWGMLFSA-N	0	3	340.254	3.300	20	30		EGEDHN
C=CCCC1(C(=O)N2CC[C@H](CNCc3cc(C)no3)[C@H](C)C2)CC1	ZINC001185094960	1387617543	/nfs/dbraw/zinc/61/75/43/1387617543.db2.gz	MTEKTQPFAFQANB-NVXWUHKLSA-N	0	3	345.487	3.304	20	30		EGEDHN
C=C(C)CCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1sccc1COC)C2	ZINC001098212079	1363256790	/nfs/dbraw/zinc/25/67/90/1363256790.db2.gz	ICXLUQRWVFLLAM-OAGGEKHMSA-N	0	3	334.485	3.196	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)C1(c3ccc(Cl)cc3)CC1)C2	ZINC001098333384	1363302131	/nfs/dbraw/zinc/30/21/31/1363302131.db2.gz	WVZBIBDRPBPYAA-KURKYZTESA-N	0	3	342.870	3.116	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@@H]1CCC(C)=C(C)C1)C[C@@H](C)O2	ZINC001098600317	1363394252	/nfs/dbraw/zinc/39/42/52/1363394252.db2.gz	YTBKSKAEIGSWDD-RTBURBONSA-N	0	3	346.515	3.391	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C[C@@H]1C=CCCC1)C[C@H](C)O2	ZINC001098604817	1363395524	/nfs/dbraw/zinc/39/55/24/1363395524.db2.gz	BOMBBANZOWZJSI-ZWKOTPCHSA-N	0	3	332.488	3.001	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)C(C)(C)C1CCCC1)C[C@H](C)O2	ZINC001098605960	1363396109	/nfs/dbraw/zinc/39/61/09/1363396109.db2.gz	MQOXKMFZVYRWCC-KRWDZBQOSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1oc(CC)cc1C)C[C@@H](C)O2	ZINC001098655394	1363420336	/nfs/dbraw/zinc/42/03/36/1363420336.db2.gz	JYRQIZORVMXKFP-MRXNPFEDSA-N	0	3	346.471	3.032	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@]1(C)CC=C(C)CC1)C[C@H](C)O2	ZINC001098660714	1363423768	/nfs/dbraw/zinc/42/37/68/1363423768.db2.gz	XARJRUOMCNTDEI-AZUAARDMSA-N	0	3	346.515	3.391	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)c1ccoc1C(C)C)C[C@@H](C)O2	ZINC001098663183	1363425062	/nfs/dbraw/zinc/42/50/62/1363425062.db2.gz	YJQCPRARZSQCTJ-MRXNPFEDSA-N	0	3	346.471	3.285	20	30		EGEDHN
C=CCN1CCC2(CC1)CN(C(=O)[C@H]1CCCC(C)(C)C1)C[C@@H](C)O2	ZINC001098664745	1363426150	/nfs/dbraw/zinc/42/61/50/1363426150.db2.gz	WAAQOXPTRBTMTK-MSOLQXFVSA-N	0	3	348.531	3.471	20	30		EGEDHN
CCC(=O)NC[C@@H]1CCC(C)(C)CN1Cc1ccc(OCC#N)cc1	ZINC001098845570	1363490235	/nfs/dbraw/zinc/49/02/35/1363490235.db2.gz	WBZRVFPLVUQTQI-KRWDZBQOSA-N	0	3	343.471	3.106	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)c1ccccc1C	ZINC001098854909	1363493332	/nfs/dbraw/zinc/49/33/32/1363493332.db2.gz	DPZLKQDQIBWUDB-SFHVURJKSA-N	0	3	344.499	3.418	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)Cc2ccc(C)cc2Cl)C1	ZINC001098907716	1363515332	/nfs/dbraw/zinc/51/53/32/1363515332.db2.gz	KWEJDCJSMDGRBL-PXNSSMCTSA-N	0	3	344.886	3.185	20	30		EGEDHN
C[C@@H](C#N)C(=O)NC[C@H]1CCC(C)(C)CN1CCCCC(F)(F)F	ZINC001098982379	1363555460	/nfs/dbraw/zinc/55/54/60/1363555460.db2.gz	KFSQNRPNJYVRCV-UONOGXRCSA-N	0	3	347.425	3.485	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@@H]1CNC(=O)C1CC(C)(C)C1	ZINC001099043891	1363590256	/nfs/dbraw/zinc/59/02/56/1363590256.db2.gz	WGXGPIJQZBFHED-QGZVFWFLSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCOCCN1CC(C)(C)CC[C@H]1CNC(=O)C1CC(C)(C)C1	ZINC001099043890	1363590716	/nfs/dbraw/zinc/59/07/16/1363590716.db2.gz	WGXGPIJQZBFHED-KRWDZBQOSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@H]1CNC(=O)Cc1ccn(C(C)C)n1	ZINC001099149173	1363657278	/nfs/dbraw/zinc/65/72/78/1363657278.db2.gz	PTKSXUGIWBOXHU-SFHVURJKSA-N	0	3	346.519	3.189	20	30		EGEDHN
C=C[C@](C)(CCOC)C(=O)NC[C@H]1CCC(C)(C)CN1CC(=C)C	ZINC001099157990	1363661943	/nfs/dbraw/zinc/66/19/43/1363661943.db2.gz	CAECSGODBZFRMU-YLJYHZDGSA-N	0	3	336.520	3.398	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)C2CC(c3ccccc3)C2)C1	ZINC001099182015	1363677141	/nfs/dbraw/zinc/67/71/41/1363677141.db2.gz	VLAGREXRPVBCCH-IRIHCNEDSA-N	0	3	336.479	3.174	20	30		EGEDHN
C=C(C)CN1CC(C)(C)CC[C@@H]1CNC(=O)C1(c2cccnc2)CC1	ZINC001099188562	1363680877	/nfs/dbraw/zinc/68/08/77/1363680877.db2.gz	HEEUZGMVIUOLAS-GOSISDBHSA-N	0	3	341.499	3.296	20	30		EGEDHN
C=CCCC1(C(=O)NC[C@@H]2CCC(C)(C)CN2CCOCC)CC1	ZINC001099214145	1363694891	/nfs/dbraw/zinc/69/48/91/1363694891.db2.gz	HGJDSDHASHYMJR-KRWDZBQOSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C1CCC(C(=O)NC[C@H]2CCC(C)(C)CN2CCOCC)CC1	ZINC001099213696	1363695246	/nfs/dbraw/zinc/69/52/46/1363695246.db2.gz	GDMULQKGICUBCX-GOSISDBHSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)Cc1cccc(F)c1F	ZINC001099252550	1363715115	/nfs/dbraw/zinc/71/51/15/1363715115.db2.gz	XMAHYUMHQVZKMH-HNNXBMFYSA-N	0	3	336.426	3.300	20	30		EGEDHN
C=C(C)CN[C@@H]1CN(C(=O)[C@@H]2C[C@H]2CC(C)C)C[C@H]1C(F)(F)F	ZINC001099310762	1363744049	/nfs/dbraw/zinc/74/40/49/1363744049.db2.gz	AEKMNQKSHFMRIM-KBUPBQIOSA-N	0	3	332.410	3.224	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)COc1ccccc1CC	ZINC001099328383	1363753185	/nfs/dbraw/zinc/75/31/85/1363753185.db2.gz	CCXBMUAAGLKKDQ-GOSISDBHSA-N	0	3	344.499	3.421	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@@H]1CNC(=O)CCOc1ccccc1F	ZINC001099329527	1363753994	/nfs/dbraw/zinc/75/39/94/1363753994.db2.gz	PTBFNMKMCOCGMI-MRXNPFEDSA-N	0	3	348.462	3.387	20	30		EGEDHN
C=CCN1CC(C)(C)CC[C@H]1CNC(=O)COc1cc(C)cc(C)c1	ZINC001099339130	1363759058	/nfs/dbraw/zinc/75/90/58/1363759058.db2.gz	DZSQRMUULYIHDJ-SFHVURJKSA-N	0	3	344.499	3.475	20	30		EGEDHN
C=C(Cl)CN1C[C@@H]2[C@@H](C1)[C@@H]1CC[C@H]2CN1C(=O)CSCCC	ZINC001099424855	1363794398	/nfs/dbraw/zinc/79/43/98/1363794398.db2.gz	MFVONZNFBXTGGY-JONQDZQNSA-N	0	3	342.936	3.051	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)[C@@H](C)C(CC)CC)CC2(CCOCC2)C1	ZINC001099583584	1363865728	/nfs/dbraw/zinc/86/57/28/1363865728.db2.gz	VLTFNLOJBWVCAP-WMZOPIPTSA-N	0	3	336.520	3.232	20	30		EGEDHN
C#CCCN1C[C@@H](NC(=O)C(C)(C)C(C)(C)C)CC2(CCOCC2)C1	ZINC001099586879	1363868443	/nfs/dbraw/zinc/86/84/43/1363868443.db2.gz	KGQMRTRINVMCJT-KRWDZBQOSA-N	0	3	348.531	3.069	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)CCC2(C)CC2)CC2(CCOCC2)C1	ZINC001099595103	1363878415	/nfs/dbraw/zinc/87/84/15/1363878415.db2.gz	TUIKPXSOYFTTQG-KRWDZBQOSA-N	0	3	334.504	3.130	20	30		EGEDHN
CCCCCCCCC(=O)N[C@H]1CCN(Cc2ccccc2)C[C@@H]1O	ZINC001100085461	1364012010	/nfs/dbraw/zinc/01/20/10/1364012010.db2.gz	LRELGHFIENOTDR-PMACEKPBSA-N	0	3	346.515	3.489	20	30		EGEDHN
Cc1cc(C)c(C(=O)NCC2CC(NCC#Cc3ccccc3)C2)o1	ZINC001100225379	1364050019	/nfs/dbraw/zinc/05/00/19/1364050019.db2.gz	FFXAOCRJKSFEJU-UHFFFAOYSA-N	0	3	336.435	3.046	20	30		EGEDHN
C[C@H](C(=O)NCC1CC(NCC#Cc2ccccc2Cl)C1)C1CC1	ZINC001100225365	1364050023	/nfs/dbraw/zinc/05/00/23/1364050023.db2.gz	DWXJXRYXBAZYHL-SYJJWHGVSA-N	0	3	344.886	3.222	20	30		EGEDHN
C#CCCCC(=O)NCC1CC(NCc2cc(OC)ccc2Cl)C1	ZINC001100283097	1364067348	/nfs/dbraw/zinc/06/73/48/1364067348.db2.gz	ACZJDBYCVMKWLR-UHFFFAOYSA-N	0	3	348.874	3.137	20	30		EGEDHN
C=C(C)CCC(=O)NCC1CC(NCc2ccc(C#N)cc2F)C1	ZINC001100371277	1364094716	/nfs/dbraw/zinc/09/47/16/1364094716.db2.gz	ZAJQHTHMQNIGKQ-UHFFFAOYSA-N	0	3	329.419	3.038	20	30		EGEDHN
C[C@@H](C(=O)NCC1CC(NCC#Cc2ccccc2)C1)C(C)(C)C	ZINC001100448480	1364118878	/nfs/dbraw/zinc/11/88/78/1364118878.db2.gz	VRDULECLSJTFPA-IVMQYODDSA-N	0	3	326.484	3.205	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)C2(CCC)CCC2)C1	ZINC001100590013	1364176955	/nfs/dbraw/zinc/17/69/55/1364176955.db2.gz	DYZBGDWVLTWKPO-UHFFFAOYSA-N	0	3	343.309	3.350	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCC1CC(NCc2cc(C#N)ccc2F)C1	ZINC001100596155	1364180797	/nfs/dbraw/zinc/18/07/97/1364180797.db2.gz	MNERUPUOVIFMDO-MXWWQKGMSA-N	0	3	343.446	3.284	20	30		EGEDHN
C=C(Br)CNC1CC(CNC(=O)C2(C)CCCCC2)C1	ZINC001100634948	1364198064	/nfs/dbraw/zinc/19/80/64/1364198064.db2.gz	UCCDJAKYADVIHK-UHFFFAOYSA-N	0	3	343.309	3.350	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC2CC(NCc3cnc(Cl)s3)C2)C1	ZINC001100661225	1364208073	/nfs/dbraw/zinc/20/80/73/1364208073.db2.gz	IKOISENNQWIOAB-UHFFFAOYSA-N	0	3	339.892	3.137	20	30		EGEDHN
C=CCC(C)(C)C(=O)NCC1CC(NCc2cccc(OCC)n2)C1	ZINC001100711420	1364230743	/nfs/dbraw/zinc/23/07/43/1364230743.db2.gz	OOKRXEQYYGKLHW-UHFFFAOYSA-N	0	3	345.487	3.067	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@H]2CN(Cc3ccc(F)cc3)C[C@@]2(C)C1	ZINC001101253039	1364487533	/nfs/dbraw/zinc/48/75/33/1364487533.db2.gz	BAFMPHLOJCMQNI-XLIONFOSSA-N	0	3	330.447	3.462	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@H]2CN(Cc3cnc(C)s3)C[C@@]2(C)C1	ZINC001101333252	1364513539	/nfs/dbraw/zinc/51/35/39/1364513539.db2.gz	NAACFYJLGBTJRE-OGWOLHLISA-N	0	3	347.528	3.334	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@H]2CN(Cc3scnc3C)C[C@@]2(C)C1	ZINC001101336598	1364515570	/nfs/dbraw/zinc/51/55/70/1364515570.db2.gz	JYJZNRDVXPALNF-OGWOLHLISA-N	0	3	347.528	3.334	20	30		EGEDHN
C=CCCCC(=O)N1C[C@H]2CN(Cc3c(C)nsc3C)C[C@@]2(C)C1	ZINC001101346889	1364520036	/nfs/dbraw/zinc/52/00/36/1364520036.db2.gz	LYDLWTNVXXMLJQ-APWZRJJASA-N	0	3	347.528	3.397	20	30		EGEDHN
C=CCCCC(=O)N1C[C@H]2CN(Cc3c(C)onc3CC)C[C@@]2(C)C1	ZINC001101346939	1364520097	/nfs/dbraw/zinc/52/00/97/1364520097.db2.gz	OBJJHLBRUFTMBJ-UZLBHIALSA-N	0	3	345.487	3.182	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@H]2CN(Cc3cnc(C)s3)C[C@@]2(C)C1	ZINC001101377650	1364535074	/nfs/dbraw/zinc/53/50/74/1364535074.db2.gz	FWISDCFGTNXAOE-BEFAXECRSA-N	0	3	347.528	3.334	20	30		EGEDHN
C=CC[C@@H](C(=O)N1C[C@H]2CN(CC#CC)C[C@@]2(C)C1)c1ccccc1	ZINC001101469351	1364573709	/nfs/dbraw/zinc/57/37/09/1364573709.db2.gz	MPPBRUFGCCKLNX-SJBKTWHCSA-N	0	3	336.479	3.150	20	30		EGEDHN
CCCCC(=O)NC[C@@H]1CN(CC#Cc2ccc(F)cc2)C[C@H]1C	ZINC001101734416	1364707305	/nfs/dbraw/zinc/70/73/05/1364707305.db2.gz	DMCNVLKFAURWJA-SJLPKXTDSA-N	0	3	330.447	3.052	20	30		EGEDHN
C#CCCCC(=O)NC[C@@H]1CN(Cc2cccc(C(C)C)n2)C[C@H]1C	ZINC001101922168	1364776099	/nfs/dbraw/zinc/77/60/99/1364776099.db2.gz	VDSKWKHRMUVWCL-QZTJIDSGSA-N	0	3	341.499	3.193	20	30		EGEDHN
CC/C(C)=C\C(=O)NC[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1C	ZINC001101943423	1364784495	/nfs/dbraw/zinc/78/44/95/1364784495.db2.gz	UFKDHUHBJJUSQL-CYKNGCMHSA-N	0	3	343.446	3.238	20	30		EGEDHN
C#CCC1(C(=O)NC[C@@H]2CN(Cc3ccccc3F)C[C@H]2C)CCC1	ZINC001102035894	1364818424	/nfs/dbraw/zinc/81/84/24/1364818424.db2.gz	FSHMKHTZDKMMPZ-SJLPKXTDSA-N	0	3	342.458	3.203	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H]1CN(Cc2ccc(OC)c(F)c2)C[C@H]1C	ZINC001102295285	1364988692	/nfs/dbraw/zinc/98/86/92/1364988692.db2.gz	BORYGBKYPKDUGO-NVXWUHKLSA-N	0	3	348.462	3.375	20	30		EGEDHN
C=CCCCC(=O)NC[C@@H]1CN(Cc2c(C)nsc2C)C[C@H]1C	ZINC001102297379	1364989243	/nfs/dbraw/zinc/98/92/43/1364989243.db2.gz	XUDLXVFAAGMRBI-CZUORRHYSA-N	0	3	335.517	3.300	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@@H]1CN(Cc2cnc(C)s2)C[C@H]1C	ZINC001102326127	1365002691	/nfs/dbraw/zinc/00/26/91/1365002691.db2.gz	JPGKJRROWKCIFP-DDUZABMNSA-N	0	3	335.517	3.238	20	30		EGEDHN
C=CCCC1(C(=O)NC[C@@H]2CN(Cc3cc(C)ns3)C[C@H]2C)CC1	ZINC001102328377	1365003817	/nfs/dbraw/zinc/00/38/17/1365003817.db2.gz	HIZVMFLJVIHVID-GDBMZVCRSA-N	0	3	347.528	3.382	20	30		EGEDHN
C=C[C@@H](C(=O)NC[C@@H]1CN(Cc2cccnc2)C[C@H]1C)c1ccccc1	ZINC001102593296	1365129450	/nfs/dbraw/zinc/12/94/50/1365129450.db2.gz	OOJVOPOQEOELOK-DUXKGJEZSA-N	0	3	349.478	3.236	20	30		EGEDHN
CC[C@@H](C)C(=O)NCC[C@@H]1CN(Cc2ccc(F)c(C#N)c2)C[C@H]1C	ZINC001102678081	1365166652	/nfs/dbraw/zinc/16/66/52/1365166652.db2.gz	NOCWVLWSHOCLJE-BFYDXBDKSA-N	0	3	345.462	3.318	20	30		EGEDHN
C[C@@H]1CN(Cc2ccc(C#N)c(F)c2)C[C@H]1CCNC(=O)C1(C)CC1	ZINC001103013308	1365337475	/nfs/dbraw/zinc/33/74/75/1365337475.db2.gz	AQGLZWKCXZFYAI-RHSMWYFYSA-N	0	3	343.446	3.072	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2ccc(F)c(F)c2)C1	ZINC001103086814	1365374496	/nfs/dbraw/zinc/37/44/96/1365374496.db2.gz	RTGMXOTVCIMHLJ-BXUZGUMPSA-N	0	3	342.817	3.405	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cc(C(C)C)on2)C1	ZINC001103282331	1365470637	/nfs/dbraw/zinc/47/06/37/1365470637.db2.gz	OKZBVJXJAXNCMD-TZMCWYRMSA-N	0	3	339.867	3.238	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)[C@@H](CCC)OCC)C1	ZINC001103343108	1365509481	/nfs/dbraw/zinc/50/94/81/1365509481.db2.gz	MUYYJDBUJUSTIW-FVQBIDKESA-N	0	3	330.900	3.018	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)c2cccc(F)c2F)C1	ZINC001103378720	1365525566	/nfs/dbraw/zinc/52/55/66/1365525566.db2.gz	GWFSIZHRAMKLJQ-DGCLKSJQSA-N	0	3	342.817	3.405	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)NC(=O)c1sccc1Cl	ZINC001498044485	1396915422	/nfs/dbraw/zinc/91/54/22/1396915422.db2.gz	KPXXANRMXRQNBS-VIFPVBQESA-N	0	3	339.873	3.243	20	30		EGEDHN
C=C(Cl)CN1C[C@@H](C)[C@H](CCNC(=O)CCCn2cccc2)C1	ZINC001103745592	1365760693	/nfs/dbraw/zinc/76/06/93/1365760693.db2.gz	JOEAXRMPOISDEZ-NVXWUHKLSA-N	0	3	337.895	3.095	20	30		EGEDHN
C=C(Br)CNCC[C@@H]1CN(C(=O)C(CC)CC)C[C@H]1C	ZINC001103907043	1365829936	/nfs/dbraw/zinc/82/99/36/1365829936.db2.gz	WKJLEYNPWRTFPJ-IUODEOHRSA-N	0	3	345.325	3.405	20	30		EGEDHN
C=CCCC(=O)N1C[C@@H](C)[C@H](CCNCc2nc(C)c(C)s2)C1	ZINC001103977752	1365857323	/nfs/dbraw/zinc/85/73/23/1365857323.db2.gz	DDHCIVLDXHFHCH-CZUORRHYSA-N	0	3	335.517	3.300	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@@H](C)[C@H](CCNCc2cc(C)no2)C1	ZINC001104231506	1365960948	/nfs/dbraw/zinc/96/09/48/1365960948.db2.gz	CZSPOCCTNBHASV-CRAIPNDOSA-N	0	3	345.487	3.326	20	30		EGEDHN
C=C(C)CCC(=O)N1C[C@@H](C)[C@H](CCNCc2oc(C)nc2C)C1	ZINC001104246943	1365967549	/nfs/dbraw/zinc/96/75/49/1365967549.db2.gz	OLHVIYFIAFHEDG-RHSMWYFYSA-N	0	3	333.476	3.222	20	30		EGEDHN
C=CC(C)(C)C(=O)N1C[C@@H](C)[C@H](CCNCc2oc(C)nc2C)C1	ZINC001104491957	1366046685	/nfs/dbraw/zinc/04/66/85/1366046685.db2.gz	JVVOZPWZNANFDZ-CZUORRHYSA-N	0	3	333.476	3.078	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1C[C@@H](C)[C@H](CCNCc2conc2C)C1	ZINC001104563691	1366079024	/nfs/dbraw/zinc/07/90/24/1366079024.db2.gz	RBMODQMUFMHYAK-BFYDXBDKSA-N	0	3	333.476	3.160	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)Cc2ccsc2C)C[C@H]1C	ZINC001104756624	1366159361	/nfs/dbraw/zinc/15/93/61/1366159361.db2.gz	BUMRKDBIXSUWHH-MLGOLLRUSA-N	0	3	340.920	3.426	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CN(C(=O)C2(C)CC(F)(F)C2)C[C@H]1C	ZINC001104896994	1366214001	/nfs/dbraw/zinc/21/40/01/1366214001.db2.gz	YXYIEFJTSUGCQR-DGCLKSJQSA-N	0	3	334.838	3.249	20	30		EGEDHN
CCCCCCCNCc1cn(C2CN(C(=O)CCC(C)C)C2)nn1	ZINC001105155587	1366348604	/nfs/dbraw/zinc/34/86/04/1366348604.db2.gz	LOGVIWLHQONVBU-UHFFFAOYSA-N	0	3	349.523	3.158	20	30		EGEDHN
C#CCN1CC2(CCC2)[C@H]1C1CCN(C(=O)[C@H](C)CC(F)F)CC1	ZINC001105394244	1366443707	/nfs/dbraw/zinc/44/37/07/1366443707.db2.gz	RNSPUTQMSGZJHL-RHSMWYFYSA-N	0	3	338.442	3.004	20	30		EGEDHN
CC(=O)N1CCCC[C@@H]1C1(CNCc2cc(F)ccc2C#N)CCC1	ZINC001105491607	1366490923	/nfs/dbraw/zinc/49/09/23/1366490923.db2.gz	MFYRDIVKWVDRIG-LJQANCHMSA-N	0	3	343.446	3.358	20	30		EGEDHN
C=CCCC(=O)N1CCCC[C@@H]1C1(CNCc2cnns2)CCC1	ZINC001105515535	1366503350	/nfs/dbraw/zinc/50/33/50/1366503350.db2.gz	HRWKQBGTGGINLZ-MRXNPFEDSA-N	0	3	348.516	3.145	20	30		EGEDHN
CCCCCCCCC(=O)N1C[C@@H](CNCc2nnc(C)[nH]2)[C@H](C)C1	ZINC001106912759	1366831094	/nfs/dbraw/zinc/83/10/94/1366831094.db2.gz	SQPHJLHXLIFDSG-NVXWUHKLSA-N	0	3	349.523	3.048	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@]12CCC[C@H]1N(Cc1ocnc1C)CC2	ZINC001107496947	1366996271	/nfs/dbraw/zinc/99/62/71/1366996271.db2.gz	OCUSCDRNDNPDQZ-YLJYHZDGSA-N	0	3	345.487	3.446	20	30		EGEDHN
CC#CCCCC(=O)NC[C@]12CCC[C@H]1N(Cc1cnc(C)o1)CC2	ZINC001107513001	1367011591	/nfs/dbraw/zinc/01/15/91/1367011591.db2.gz	NRCWFNSVRGPVCH-UYAOXDASSA-N	0	3	343.471	3.037	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)C[C@@H]3CCCC(C)(C)C3)[C@@H]2C1	ZINC001189786606	1367108800	/nfs/dbraw/zinc/10/88/00/1367108800.db2.gz	GEKQHRWCLFILEF-GBESFXJTSA-N	0	3	348.531	3.328	20	30		EGEDHN
CC[C@H](C)CC(=O)N1CC[C@@H](N(C)Cc2ccc(OC)c(C#N)c2)C1	ZINC001189883866	1367123503	/nfs/dbraw/zinc/12/35/03/1367123503.db2.gz	ZHQFDZRNEOHRIF-MAUKXSAKSA-N	0	3	343.471	3.036	20	30		EGEDHN
CCCC[C@@H](C)C(=O)N1CC[C@@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001189974265	1367143729	/nfs/dbraw/zinc/14/37/29/1367143729.db2.gz	VGRIJHNIEKVQFC-VQIMIIECSA-N	0	3	327.472	3.417	20	30		EGEDHN
CN(CCOC1CCCCCC1)[C@@H]1CCN(C(=O)C#CC(C)(C)C)C1	ZINC001190084951	1367169679	/nfs/dbraw/zinc/16/96/79/1367169679.db2.gz	UTPDEUVORURZTH-GOSISDBHSA-N	0	3	348.531	3.308	20	30		EGEDHN
COc1ccc(CN(C)[C@@H]2CCN(C(=O)C#CC(C)(C)C)C2)cc1C	ZINC001190085419	1367170190	/nfs/dbraw/zinc/17/01/90/1367170190.db2.gz	YASVQNSUCCKIFO-GOSISDBHSA-N	0	3	342.483	3.086	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)CCc1ccc(C)c(Cl)c1)C2	ZINC001109576228	1367208556	/nfs/dbraw/zinc/20/85/56/1367208556.db2.gz	TVHNOFWDLNZWFV-NEWSRXKRSA-N	0	3	344.886	3.326	20	30		EGEDHN
N#CCc1cc(NC(=O)c2cnc(-c3ccccc3)nc2O)ccc1F	ZINC001190268448	1367212743	/nfs/dbraw/zinc/21/27/43/1367212743.db2.gz	ZACNWSCFITXUCS-UHFFFAOYSA-N	0	3	348.337	3.307	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)C(CC=C)CC=C)C1	ZINC001107965339	1367221222	/nfs/dbraw/zinc/22/12/22/1367221222.db2.gz	VUWWPUSXPPVNED-FXAWDEMLSA-N	0	3	334.504	3.317	20	30		EGEDHN
C=CC(C)(C)CC(=O)NC[C@@]1(C)CN(CC2CC(C)(C)C2)CCO1	ZINC001107971592	1367224001	/nfs/dbraw/zinc/22/40/01/1367224001.db2.gz	UDISLZXBJIIPEK-FQEVSTJZSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2Cc1cccc(N(C)C)c1	ZINC001109656522	1367266736	/nfs/dbraw/zinc/26/67/36/1367266736.db2.gz	YJHRMKJHFBLHJH-AABGKKOBSA-N	0	3	341.499	3.330	20	30		EGEDHN
C=CCC[C@H](C)N1CCO[C@](C)(CNC(=O)c2ccoc2C2CC2)C1	ZINC001108162064	1367317370	/nfs/dbraw/zinc/31/73/70/1367317370.db2.gz	OHKCMRRZFXDHGT-MGPUTAFESA-N	0	3	346.471	3.332	20	30		EGEDHN
C=C(C)CN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C1(Cc3ccc(F)cc3)CC1)C2	ZINC001109813946	1367337723	/nfs/dbraw/zinc/33/77/23/1367337723.db2.gz	DSWGWQXKKRRHLU-QYZOEREBSA-N	0	3	342.458	3.446	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@@]1(C)CN(CC2CCCCC2)CCO1	ZINC001108246524	1367360186	/nfs/dbraw/zinc/36/01/86/1367360186.db2.gz	PCRWKKRRRBHRRH-FQEVSTJZSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)[C@H]1CC[C@H](C(C)C)CC1)C2	ZINC001109881267	1367380776	/nfs/dbraw/zinc/38/07/76/1367380776.db2.gz	KJMVKHZWHNTLSH-UEDWAMCQSA-N	0	3	348.531	3.373	20	30		EGEDHN
C#CCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C[C@@H](C)c1ccc(F)cc1)C2	ZINC001110142566	1367524427	/nfs/dbraw/zinc/52/44/27/1367524427.db2.gz	HCUGMLNYVWYLCL-OAOYMFHYSA-N	0	3	328.431	3.064	20	30		EGEDHN
C=CCOCCN1[C@@H]2CC[C@H]1[C@@H](NC(=O)C1CCC(C)(C)CC1)C2	ZINC001110171719	1367542439	/nfs/dbraw/zinc/54/24/39/1367542439.db2.gz	QLIBMRPFADUXNU-SQNIBIBYSA-N	0	3	334.504	3.127	20	30		EGEDHN
C#CC[C@@H](CC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCCF)c1ccccc1	ZINC001110206295	1367563241	/nfs/dbraw/zinc/56/32/41/1367563241.db2.gz	JFECXSBORDOOQU-YRPNKDGESA-N	0	3	342.458	3.265	20	30		EGEDHN
CC#CCN1CC[C@H](c2ccc(F)cc2)[C@H](CNC(=O)C(C)(C)F)C1	ZINC001186156342	1387884341	/nfs/dbraw/zinc/88/43/41/1387884341.db2.gz	NEZAFNCNWWNBJJ-SJLPKXTDSA-N	0	3	348.437	3.119	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CC[C@@H](N(C)CCOc2cc(C)cc(C)c2)C1	ZINC001191727657	1367571001	/nfs/dbraw/zinc/57/10/01/1367571001.db2.gz	PBPYKYOHSQVYTB-GOSISDBHSA-N	0	3	344.499	3.427	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@@H](N(C)CCOCc2ccccc2)C1	ZINC001191890553	1367627282	/nfs/dbraw/zinc/62/72/82/1367627282.db2.gz	RPUQHYQVBZBHEI-UYAOXDASSA-N	0	3	344.499	3.338	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CC[C@@H](N(C)Cc2ccc(COC)cc2)C1	ZINC001191913014	1367637084	/nfs/dbraw/zinc/63/70/84/1367637084.db2.gz	VFPNGKTYSXVXJA-YLJYHZDGSA-N	0	3	344.499	3.468	20	30		EGEDHN
C=CCCO[C@@H](C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1cccc(C)c1	ZINC001110366520	1367671264	/nfs/dbraw/zinc/67/12/64/1367671264.db2.gz	ULZLRNJREPWTTG-NBYUQASBSA-N	0	3	342.483	3.198	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](N(C)C[C@H](OC)c2ccccc2)C1	ZINC001192093421	1367686626	/nfs/dbraw/zinc/68/66/26/1367686626.db2.gz	JUMVNDIKBBENAS-OALUTQOASA-N	0	3	330.472	3.263	20	30		EGEDHN
C=CCCCC(=O)N1CC[C@H](N(C)Cc2ccc(OC)c(C)c2)C1	ZINC001192093750	1367686753	/nfs/dbraw/zinc/68/67/53/1367686753.db2.gz	MDBPTFMBDMAOPO-SFHVURJKSA-N	0	3	330.472	3.393	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@H]2CC[C@@H]1N2CCOC1CCCCCC1	ZINC001109054822	1367741698	/nfs/dbraw/zinc/74/16/98/1367741698.db2.gz	ARSPFVKBKIJNOM-NEWSRXKRSA-N	0	3	334.504	3.414	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)c2ccccc2C2(C)CC2)C1	ZINC001192317733	1367748845	/nfs/dbraw/zinc/74/88/45/1367748845.db2.gz	UPXLGNUFBWSDDA-KRWDZBQOSA-N	0	3	342.483	3.087	20	30		EGEDHN
C#CCCCC(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2Cc1cccc2cccnc21	ZINC001110493665	1367781671	/nfs/dbraw/zinc/78/16/71/1367781671.db2.gz	ZVDFYOUIHYLXKX-AQNXPRMDSA-N	0	3	347.462	3.260	20	30		EGEDHN
CCc1ccc(CCN2[C@@H]3CC[C@H]2[C@H](NC(=O)C#CC(C)C)C3)cc1	ZINC001110537946	1367817591	/nfs/dbraw/zinc/81/75/91/1367817591.db2.gz	GRVXVCHVBHMHOC-NJYVYQBISA-N	0	3	338.495	3.172	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001192585714	1367824880	/nfs/dbraw/zinc/82/48/80/1367824880.db2.gz	AHKZIKGLNANLFN-SFHVURJKSA-N	0	3	325.456	3.193	20	30		EGEDHN
C=CCOCCN(C)[C@H]1CCN(C(=O)[C@H](C)CC2CCCCC2)C1	ZINC001192641578	1367840811	/nfs/dbraw/zinc/84/08/11/1367840811.db2.gz	LNHHEFPPJXRPTO-MJGOQNOKSA-N	0	3	336.520	3.328	20	30		EGEDHN
C=CCCCN1[C@@H]2CC[C@H]1[C@H](NC(=O)c1cn3cc(C)nc3s1)C2	ZINC001110660545	1367903048	/nfs/dbraw/zinc/90/30/48/1367903048.db2.gz	FEWZPXQMMOCFQO-KFWWJZLASA-N	0	3	344.484	3.006	20	30		EGEDHN
CCCCCCC[C@H](C)NC(=O)N(CCOC)C1CCN(C)CC1	ZINC001192927567	1367905382	/nfs/dbraw/zinc/90/53/82/1367905382.db2.gz	SZDHXFWKNLXUHH-KRWDZBQOSA-N	0	3	341.540	3.488	20	30		EGEDHN
CC[C@H](C)CCC(=O)N1CC[C@@H](N(C)Cc2cccc(C#N)c2)C1	ZINC001193018122	1367924475	/nfs/dbraw/zinc/92/44/75/1367924475.db2.gz	RFWGZRPDIAJLHK-QFBILLFUSA-N	0	3	327.472	3.417	20	30		EGEDHN
CCC(CC)CC(=O)N1CC[C@H](N(C)Cc2ccc(C#N)cc2)C1	ZINC001193087486	1367940797	/nfs/dbraw/zinc/94/07/97/1367940797.db2.gz	CNOYESWNJCNFJM-IBGZPJMESA-N	0	3	327.472	3.417	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1C[C@H]2CC[C@@H]1N2C[C@@H](OC)c1ccccc1	ZINC001110898330	1368072295	/nfs/dbraw/zinc/07/22/95/1368072295.db2.gz	BITLXVQXDNMGBQ-AKHDSKFASA-N	0	3	342.483	3.308	20	30		EGEDHN
C#Cc1cncc(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3CC/C=C/CCC)c1	ZINC001111002054	1368140350	/nfs/dbraw/zinc/14/03/50/1368140350.db2.gz	SXQHJKUFOWFDHV-JCHUFIKGSA-N	0	3	337.467	3.144	20	30		EGEDHN
C=C[C@@H](CC(=O)N1CC[C@H](N(C)CCOC(C)C)C1)c1ccccc1	ZINC001194199374	1368206669	/nfs/dbraw/zinc/20/66/69/1368206669.db2.gz	BTZHEOKAVBEWBP-ICSRJNTNSA-N	0	3	344.499	3.304	20	30		EGEDHN
C#CCC1(C(=O)N2CC[C@H](N(C)CCOCCCC)C2)CCCCC1	ZINC001194367404	1368245428	/nfs/dbraw/zinc/24/54/28/1368245428.db2.gz	HCKHLFXGOSFGLX-IBGZPJMESA-N	0	3	348.531	3.310	20	30		EGEDHN
C=CCCCCCN1C[C@@H](O)[C@H](NC(=O)c2ccccc2CCC)C1	ZINC001194557555	1368286603	/nfs/dbraw/zinc/28/66/03/1368286603.db2.gz	XGXZXTJLUOUNEW-WOJBJXKFSA-N	0	3	344.499	3.160	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H]2C[C@H]3CC[C@@H]2N3CCOC(C)C)CCCCC1	ZINC001111484002	1368318870	/nfs/dbraw/zinc/31/88/70/1368318870.db2.gz	RJAOZABXCDRFMX-QRVBRYPASA-N	0	3	346.515	3.107	20	30		EGEDHN
C#CCCN1CC[C@]2(C1)C[C@@H](NC(=O)CC(C)C)c1ccccc1O2	ZINC001111530672	1368330838	/nfs/dbraw/zinc/33/08/38/1368330838.db2.gz	XTNVYOATEWFVQD-WIYYLYMNSA-N	0	3	340.467	3.140	20	30		EGEDHN
C=CCCC(=O)N[C@]12CCC[C@H]1CN(Cc1cccc(OC)c1)C2	ZINC001111648718	1368411488	/nfs/dbraw/zinc/41/14/88/1368411488.db2.gz	LGARIHPPUROJJL-PXNSSMCTSA-N	0	3	328.456	3.132	20	30		EGEDHN
C=CCOCC(=O)N1CCCN([C@@H](C)c2cc(C)ccc2C)CC1	ZINC001195283849	1368413698	/nfs/dbraw/zinc/41/36/98/1368413698.db2.gz	KXJBHMITOBFRML-SFHVURJKSA-N	0	3	330.472	3.101	20	30		EGEDHN
C#CCCCC(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(F)cc1)C2	ZINC001111729594	1368431532	/nfs/dbraw/zinc/43/15/32/1368431532.db2.gz	WAKOCAMZJOZWGU-PXNSSMCTSA-N	0	3	328.431	3.100	20	30		EGEDHN
CC/C(C)=C\C(=O)N[C@]12CCC[C@H]1CN(Cc1ccc(C#N)cc1)C2	ZINC001111736866	1368435288	/nfs/dbraw/zinc/43/52/88/1368435288.db2.gz	ZEHKXHGPMYGYOS-KRSZDNQJSA-N	0	3	337.467	3.385	20	30		EGEDHN
C=CCOCCCC(=O)N1CCCN(Cc2c(C)cccc2C)CC1	ZINC001195451944	1368439229	/nfs/dbraw/zinc/43/92/29/1368439229.db2.gz	IBILGXVCTJGIGD-UHFFFAOYSA-N	0	3	344.499	3.321	20	30		EGEDHN
N#Cc1cc(C(=O)N2CCCN(CC/C=C\c3ccccc3)CC2)c[nH]1	ZINC001195535980	1368450765	/nfs/dbraw/zinc/45/07/65/1368450765.db2.gz	RGPOZLUYTDHWIS-WTKPLQERSA-N	0	3	348.450	3.138	20	30		EGEDHN
CC#CCN1C[C@@H]2CCC[C@]2(NC(=O)C/C=C\c2cccc(F)c2)C1	ZINC001111779541	1368458322	/nfs/dbraw/zinc/45/83/22/1368458322.db2.gz	CIJWNVHYCLGNPC-KWBXCNMKSA-N	0	3	340.442	3.223	20	30		EGEDHN
C=C[C@](C)(O)CC(=O)N1CCCN(Cc2ccccc2C(C)C)CC1	ZINC001195681629	1368471920	/nfs/dbraw/zinc/47/19/20/1368471920.db2.gz	HLGULOZQEIIWEC-NRFANRHFSA-N	0	3	344.499	3.171	20	30		EGEDHN
C=C(C)CCC(=O)N1CCCN(CCCOc2ccccc2)CC1	ZINC001196011112	1368534775	/nfs/dbraw/zinc/53/47/75/1368534775.db2.gz	YWDCKZMYTUXAFO-UHFFFAOYSA-N	0	3	330.472	3.346	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2cc(C3CC3)on2)CC1	ZINC001196680999	1368662197	/nfs/dbraw/zinc/66/21/97/1368662197.db2.gz	NXTNRRZSFCJWTA-UHFFFAOYSA-N	0	3	331.460	3.446	20	30		EGEDHN
C#CCCCCCC(=O)N1CCCN(CCc2ccccc2)CC1	ZINC001196753430	1368676232	/nfs/dbraw/zinc/67/62/32/1368676232.db2.gz	LYCZUKYRZSCALQ-UHFFFAOYSA-N	0	3	326.484	3.347	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)[C@H](CCC)C(C)C)C[C@H]1C(F)(F)F	ZINC001112173732	1368700597	/nfs/dbraw/zinc/70/05/97/1368700597.db2.gz	MUDJQZBAWKIAGL-RBSFLKMASA-N	0	3	332.410	3.061	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)[C@H](C)CCC(C)(C)C)C[C@H]1C(F)(F)F	ZINC001112194237	1368707995	/nfs/dbraw/zinc/70/79/95/1368707995.db2.gz	USXIXFNYTSBDST-RBSFLKMASA-N	0	3	346.437	3.451	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)[C@H]2CCCCC2(C)C)C[C@H]1C(F)(F)F	ZINC001112213774	1368721469	/nfs/dbraw/zinc/72/14/69/1368721469.db2.gz	ZWUSRDZRECPBIX-RBSFLKMASA-N	0	3	344.421	3.205	20	30		EGEDHN
C#CCCN[C@@H]1CN(C(=O)[C@@H]2CCCCC2(C)C)C[C@H]1C(F)(F)F	ZINC001112213775	1368721926	/nfs/dbraw/zinc/72/19/26/1368721926.db2.gz	ZWUSRDZRECPBIX-RRFJBIMHSA-N	0	3	344.421	3.205	20	30		EGEDHN
C=CCCCC(=O)N1CCCN(CCCOc2ccc(F)cc2)CC1	ZINC001197000078	1368728931	/nfs/dbraw/zinc/72/89/31/1368728931.db2.gz	JNHONLZDGTYFHB-UHFFFAOYSA-N	0	3	348.462	3.485	20	30		EGEDHN
COc1ccc([C@H]2CN(Cc3ccc(Cl)cc3C#N)CCN2)cc1	ZINC001197052954	1368735418	/nfs/dbraw/zinc/73/54/18/1368735418.db2.gz	YHWCNIVVCIEJIL-LJQANCHMSA-N	0	3	341.842	3.367	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1C[C@@H]2CCC[C@]2(CNCc2nccs2)C1	ZINC001112537780	1368919392	/nfs/dbraw/zinc/91/93/92/1368919392.db2.gz	YGGZOCIMNPIXEZ-KXBFYZLASA-N	0	3	347.528	3.464	20	30		EGEDHN
C=CCCCCCN1CCCN(C(=O)c2ncc3n2CCCC3)CC1	ZINC001198167180	1368972270	/nfs/dbraw/zinc/97/22/70/1368972270.db2.gz	YFJRXSWGSLWWLM-UHFFFAOYSA-N	0	3	344.503	3.114	20	30		EGEDHN
C[C@@H](NCc1ccccc1C#N)[C@@H]1CCN(C(=O)CCCC2CC2)C1	ZINC001325438315	1387972103	/nfs/dbraw/zinc/97/21/03/1387972103.db2.gz	NTXDUFNADHCYBE-OXQOHEQNSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)c1cccnc1)c1ccccc1OC	ZINC001198491004	1369044251	/nfs/dbraw/zinc/04/42/51/1369044251.db2.gz	FTXHSIMWHQEVPR-SFHVURJKSA-N	0	3	339.439	3.117	20	30		EGEDHN
C=CCC[C@H](C)N[C@H](CNC(=O)c1ccon1)c1ccccc1OC	ZINC001198577025	1369064598	/nfs/dbraw/zinc/06/45/98/1369064598.db2.gz	HCUPFEMWSPWGLO-WMLDXEAASA-N	0	3	343.427	3.099	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)CCCCOC)c1ccccc1OC	ZINC001198595292	1369069346	/nfs/dbraw/zinc/06/93/46/1369069346.db2.gz	JQCJDFIAZGUHRO-GOSISDBHSA-N	0	3	348.487	3.225	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)[C@@H]1CC1(C)C)c1ccccc1OC	ZINC001198669303	1369087012	/nfs/dbraw/zinc/08/70/12/1369087012.db2.gz	YYFZWEBPZWNFBB-DLBZAZTESA-N	0	3	330.472	3.454	20	30		EGEDHN
C#CCCCC(=O)NC[C@@H](NCCCCCF)c1ccccc1OC	ZINC001198694853	1369092983	/nfs/dbraw/zinc/09/29/83/1369092983.db2.gz	LXGNZRAQTXDUCZ-GOSISDBHSA-N	0	3	348.462	3.385	20	30		EGEDHN
C#CCCCC(=O)NC[C@@H](NCCC(=C)C)c1ccccc1OC	ZINC001198695069	1369093240	/nfs/dbraw/zinc/09/32/40/1369093240.db2.gz	NTVHULVJXWIKMS-GOSISDBHSA-N	0	3	328.456	3.212	20	30		EGEDHN
C=CCCCN[C@@H](CNC(=O)c1ccns1)c1ccccc1OC	ZINC001198750741	1369104742	/nfs/dbraw/zinc/10/47/42/1369104742.db2.gz	AVCOCISZEQTAHF-HNNXBMFYSA-N	0	3	345.468	3.179	20	30		EGEDHN
C=C(C)CCC(=O)NC[C@H](NCCCOCC)c1ccccc1OC	ZINC001198751580	1369105263	/nfs/dbraw/zinc/10/52/63/1369105263.db2.gz	IMYNRJAYIVCFJE-SFHVURJKSA-N	0	3	348.487	3.225	20	30		EGEDHN
C=CCCN[C@@H](CNC(=O)[C@@H](C)CC(F)F)c1ccccc1OC	ZINC001198797538	1369118000	/nfs/dbraw/zinc/11/80/00/1369118000.db2.gz	VMGWOBQVWLLBGI-ZFWWWQNUSA-N	0	3	340.414	3.310	20	30		EGEDHN
C#Cc1ccc(C(=O)NC[C@H](NCCC)c2ccccc2OC)cc1	ZINC001198825239	1369122356	/nfs/dbraw/zinc/12/23/56/1369122356.db2.gz	AHCCTVTWJFTUEV-IBGZPJMESA-N	0	3	336.435	3.147	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H](NCC1CCC1)c1ccccc1OC	ZINC001198834625	1369125747	/nfs/dbraw/zinc/12/57/47/1369125747.db2.gz	MBAVCRZGKAWALH-QGZVFWFLSA-N	0	3	330.472	3.454	20	30		EGEDHN
C#CCCCCCC(=O)NC[C@@H](NC(C)C)c1ccccc1OC	ZINC001198842332	1369127313	/nfs/dbraw/zinc/12/73/13/1369127313.db2.gz	IFGGHQWZRDBDTF-GOSISDBHSA-N	0	3	330.472	3.434	20	30		EGEDHN
C=CCCN[C@H](CNC(=O)c1occc1CC)c1ccccc1OC	ZINC001198885275	1369139499	/nfs/dbraw/zinc/13/94/99/1369139499.db2.gz	CMDMXWDBNRUXHI-QGZVFWFLSA-N	0	3	342.439	3.487	20	30		EGEDHN
C=C(C)CCN[C@H](CNC(=O)[C@@H]1C[C@H]1CC)c1ccccc1OC	ZINC001198908904	1369146991	/nfs/dbraw/zinc/14/69/91/1369146991.db2.gz	QHQUCQGXPCOBTI-KBAYOESNSA-N	0	3	330.472	3.454	20	30		EGEDHN
C=CCCCN[C@H](CNC(=O)[C@H](C)CCOC)c1ccccc1OC	ZINC001198994125	1369168541	/nfs/dbraw/zinc/16/85/41/1369168541.db2.gz	UNKJZHWADCEXQB-SJLPKXTDSA-N	0	3	348.487	3.081	20	30		EGEDHN
C=C(Br)CNC1CCN(C(=O)C[C@H](C)C(C)C)CC1	ZINC001199733373	1369264154	/nfs/dbraw/zinc/26/41/54/1369264154.db2.gz	KURDYBKOQBORME-LBPRGKRZSA-N	0	3	331.298	3.158	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(CC/C=C\CCC)C[C@H]2O)CCCC1	ZINC001199567703	1369238274	/nfs/dbraw/zinc/23/82/74/1369238274.db2.gz	YDNSHHOEDIUWBP-XXCOWLKOSA-N	0	3	334.504	3.031	20	30		EGEDHN
CCCCCCC[NH2+]C[C@@H]1CN(C(=O)c2ccccc2[O-])CCCO1	ZINC001199886175	1369284857	/nfs/dbraw/zinc/28/48/57/1369284857.db2.gz	GYQAFEMCJYQCRU-QGZVFWFLSA-N	0	3	348.487	3.183	20	30		EGEDHN
CCCCCCCN1CCN(C(=O)[C@@H]2C[C@@H](C)Cc3c[nH]nc32)CC1	ZINC001113257082	1369296220	/nfs/dbraw/zinc/29/62/20/1369296220.db2.gz	OZORZWDCJHEDMA-FUHWJXTLSA-N	0	3	346.519	3.190	20	30		EGEDHN
C=CCCC(=O)N1CCCO[C@@H](CNCc2ccc(Cl)s2)C1	ZINC001200084784	1369313958	/nfs/dbraw/zinc/31/39/58/1369313958.db2.gz	ZQXGUNBVWYIMOG-ZDUSSCGKSA-N	0	3	342.892	3.075	20	30		EGEDHN
CCc1cc(NC(=S)NCCN2CCCCC2)cc(CC)c1C#N	ZINC001200432667	1369366265	/nfs/dbraw/zinc/36/62/65/1369366265.db2.gz	WHYHCAJLGPYOBD-UHFFFAOYSA-N	0	3	344.528	3.455	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CCC(NCc2c(F)cccc2F)CC1	ZINC001200461680	1369373607	/nfs/dbraw/zinc/37/36/07/1369373607.db2.gz	GQGADEXXZVOIOX-UHFFFAOYSA-N	0	3	334.410	3.095	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCCO[C@@H](CNCc2ccsc2)C1	ZINC001201233182	1369501578	/nfs/dbraw/zinc/50/15/78/1369501578.db2.gz	LZUQMOLHBNFUND-WBVHZDCISA-N	0	3	336.501	3.058	20	30		EGEDHN
C=CCC1(C(=O)N2CCCO[C@H](CNCc3ccsc3)C2)CCC1	ZINC001201358859	1369526566	/nfs/dbraw/zinc/52/65/66/1369526566.db2.gz	DCHLNUFYZAXSKL-QGZVFWFLSA-N	0	3	348.512	3.202	20	30		EGEDHN
C#Cc1ccc(C(=O)N2CCC(NC/C(Cl)=C\Cl)CC2)cc1	ZINC001201925438	1369643802	/nfs/dbraw/zinc/64/38/02/1369643802.db2.gz	MSIZZJXMQOOEOO-RVDMUPIBSA-N	0	3	337.250	3.181	20	30		EGEDHN
C=C(Br)CNC1CCN(C(=O)CCCC2CC2)CC1	ZINC001202076099	1369681887	/nfs/dbraw/zinc/68/18/87/1369681887.db2.gz	RXMNDPHWARMURI-UHFFFAOYSA-N	0	3	329.282	3.056	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC(NCc2ccncc2Cl)CC1	ZINC001202131111	1369695813	/nfs/dbraw/zinc/69/58/13/1369695813.db2.gz	SPPCLPOIWAPFAF-AWEZNQCLSA-N	0	3	335.879	3.418	20	30		EGEDHN
O=C(N[C@H]1C[C@@H](NCC#Cc2cccc(Cl)c2)C12CCC2)C1CC1	ZINC001202281796	1369728728	/nfs/dbraw/zinc/72/87/28/1369728728.db2.gz	UBLARZMSBMKIOK-MSOLQXFVSA-N	0	3	342.870	3.119	20	30		EGEDHN
O=C(N[C@H]1C[C@@H](NCC#Cc2ccccc2Cl)C12CCC2)C1CC1	ZINC001202282270	1369729154	/nfs/dbraw/zinc/72/91/54/1369729154.db2.gz	ZVPLXOCGAYEHCV-MSOLQXFVSA-N	0	3	342.870	3.119	20	30		EGEDHN
CC(C)=CC(=O)N[C@@H]1C[C@H](NCc2ccc(C#N)cc2F)C12CCC2	ZINC001202385062	1369757096	/nfs/dbraw/zinc/75/70/96/1369757096.db2.gz	WYUJUGJYCKBFHY-ZWKOTPCHSA-N	0	3	341.430	3.181	20	30		EGEDHN
CC[C@@H](CC(C)C)C(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001186895093	1388024346	/nfs/dbraw/zinc/02/43/46/1388024346.db2.gz	JTYWEBUIXFYREG-FUHWJXTLSA-N	0	3	345.462	3.460	20	30		EGEDHN
CCCCC(=O)N[C@@H]1C[C@@H](NCc2ccc(C#N)cc2F)C12CCC2	ZINC001202489401	1369788800	/nfs/dbraw/zinc/78/88/00/1369788800.db2.gz	KYKXZRDVCYBLAJ-QZTJIDSGSA-N	0	3	343.446	3.405	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@H](NCc2ccc(F)cc2F)C12CCC2	ZINC001202591139	1369815649	/nfs/dbraw/zinc/81/56/49/1369815649.db2.gz	NRDAUMUYVDLBAI-DLBZAZTESA-N	0	3	334.410	3.448	20	30		EGEDHN
C=CCCC(=O)N[C@@H]1C[C@H](NCc2nc(C)c(C)s2)C12CCC2	ZINC001202592183	1369815870	/nfs/dbraw/zinc/81/58/70/1369815870.db2.gz	RZIIYHWPDZCLKI-LSDHHAIUSA-N	0	3	333.501	3.243	20	30		EGEDHN
C=CCCC(=O)N[C@H]1C[C@@H](NCc2ccc(F)cc2F)C12CCC2	ZINC001202591142	1369816058	/nfs/dbraw/zinc/81/60/58/1369816058.db2.gz	NRDAUMUYVDLBAI-SJORKVTESA-N	0	3	334.410	3.448	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C(C)(C)C)cc3)C[C@H]21	ZINC001114237731	1369819754	/nfs/dbraw/zinc/81/97/54/1369819754.db2.gz	RRSOCLHDONTTOX-KXTWHKPSSA-N	0	3	338.495	3.190	20	30		EGEDHN
CC(C)CC(C)(C)C(=O)N1CC[C@@H](NCc2ccc(F)c(C#N)c2)C1	ZINC001186933786	1388030525	/nfs/dbraw/zinc/03/05/25/1388030525.db2.gz	WVVMQEFHXPZRGR-QGZVFWFLSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC(NCc2cc(C3CC3)no2)CC1	ZINC001202688200	1369851940	/nfs/dbraw/zinc/85/19/40/1369851940.db2.gz	ICTPETWQQIIPTG-UHFFFAOYSA-N	0	3	331.460	3.235	20	30		EGEDHN
C=CC1(CC(=O)N2CCC(NCc3nccn3C)CC2)CCCCC1	ZINC001202912568	1369925027	/nfs/dbraw/zinc/92/50/27/1369925027.db2.gz	LEZITRASEPDGQR-UHFFFAOYSA-N	0	3	344.503	3.027	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1C[C@@H](NCc2ncccc2C)C12CCC2	ZINC001202985261	1369946082	/nfs/dbraw/zinc/94/60/82/1369946082.db2.gz	CDBAWQZFTJSOOU-MSOLQXFVSA-N	0	3	327.472	3.263	20	30		EGEDHN
CC(C)C[C@@H](C)CC(=O)N1CC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001187004073	1388038157	/nfs/dbraw/zinc/03/81/57/1388038157.db2.gz	IFLOSFFAMSZJND-CRAIPNDOSA-N	0	3	345.462	3.460	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H]1C[C@@H](NCc2ccc(F)cn2)C12CCC2	ZINC001203255687	1370043038	/nfs/dbraw/zinc/04/30/38/1370043038.db2.gz	DNDAOAXKDUKQBH-IAGOWNOFSA-N	0	3	345.462	3.340	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H]1C[C@H](NCc2conc2CC)C12CCC2	ZINC001203259641	1370046216	/nfs/dbraw/zinc/04/62/16/1370046216.db2.gz	XTSSKRMNLNDNPF-IRXDYDNUSA-N	0	3	345.487	3.356	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1[C@H]2CN(Cc3cccc(OC)c3C)C[C@H]21	ZINC001114724070	1370046728	/nfs/dbraw/zinc/04/67/28/1370046728.db2.gz	FWCWTJHKIOKZEA-FEUVXWNVSA-N	0	3	342.483	3.152	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1C[C@H](NCc2ccncc2Cl)C12CCC2	ZINC001203273253	1370053814	/nfs/dbraw/zinc/05/38/14/1370053814.db2.gz	HUSGXMSISUJNHH-JKSUJKDBSA-N	0	3	347.890	3.464	20	30		EGEDHN
C=CCCCC(=O)N[C@@H]1[C@H]2CN(CCOc3ccc(Cl)cc3)C[C@H]21	ZINC001114759026	1370064993	/nfs/dbraw/zinc/06/49/93/1370064993.db2.gz	AREGLIOJZZMDCS-DZFIZOCASA-N	0	3	348.874	3.122	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2C[C@H](NCc3ccns3)C23CCC3)CCC1	ZINC001203366911	1370100631	/nfs/dbraw/zinc/10/06/31/1370100631.db2.gz	PMRUXJLJDJVJJA-JKSUJKDBSA-N	0	3	345.512	3.407	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H]2C[C@@H](NCc3conc3C)C23CCC3)CC1	ZINC001203372129	1370102742	/nfs/dbraw/zinc/10/27/42/1370102742.db2.gz	COQSQUINZQIJJE-SJORKVTESA-N	0	3	343.471	3.246	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1C[C@H](NCc2ocnc2C)C12CCC2	ZINC001203451035	1370131621	/nfs/dbraw/zinc/13/16/21/1370131621.db2.gz	HQQUDMSJTBGUDM-JKSUJKDBSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@H]1C[C@@H](NCc2ccc(F)cn2)C12CCC2	ZINC001203454325	1370133011	/nfs/dbraw/zinc/13/30/11/1370133011.db2.gz	YOQBSQVBWDSGFI-SJORKVTESA-N	0	3	345.462	3.340	20	30		EGEDHN
COc1ccc(C[N@@H+]2CCC[C@H](Oc3ccc(C#N)cc3)C2)c([O-])c1	ZINC001203635163	1370195450	/nfs/dbraw/zinc/19/54/50/1370195450.db2.gz	MEPVBLAVHAOJIU-IBGZPJMESA-N	0	3	338.407	3.316	20	30		EGEDHN
COc1ccc(C[N@H+]2CCC[C@H](Oc3ccc(C#N)cc3)C2)c([O-])c1	ZINC001203635163	1370195452	/nfs/dbraw/zinc/19/54/52/1370195452.db2.gz	MEPVBLAVHAOJIU-IBGZPJMESA-N	0	3	338.407	3.316	20	30		EGEDHN
C=C(Cl)CN[C@H]1C[C@H](NC(=O)COc2ccc(C)cc2)C12CCC2	ZINC001203695096	1370223631	/nfs/dbraw/zinc/22/36/31/1370223631.db2.gz	PFHOJINCWNKLKW-IRXDYDNUSA-N	0	3	348.874	3.143	20	30		EGEDHN
N#Cc1cccc(CN2CC[C@@]3(CC(=O)N(c4ccc(F)cc4)C3)C2)c1	ZINC001203758445	1370252236	/nfs/dbraw/zinc/25/22/36/1370252236.db2.gz	YJTVUXUYQFIBIZ-OAQYLSRUSA-N	0	3	349.409	3.326	20	30		EGEDHN
N#Cc1cccc(CN2CCC3(CC2)C(=O)N[C@H]3c2ccccc2)c1	ZINC001203760237	1370252930	/nfs/dbraw/zinc/25/29/30/1370252930.db2.gz	FXXJHTSQOVSOPO-IBGZPJMESA-N	0	3	331.419	3.012	20	30		EGEDHN
N#Cc1ccc(CN2CCC3(CC2)NC(=O)C[C@@H]3c2ccccc2)cc1	ZINC001203902239	1370306894	/nfs/dbraw/zinc/30/68/94/1370306894.db2.gz	XQCBSEKVPWLHLY-HXUWFJFHSA-N	0	3	345.446	3.197	20	30		EGEDHN
CCCCCCC(=O)N[C@@H]1[C@H]2CN(Cc3ccc(C#N)cc3)C[C@H]21	ZINC001115197798	1370333028	/nfs/dbraw/zinc/33/30/28/1370333028.db2.gz	VFCUHWOSPYBCMF-RUYXUALKSA-N	0	3	325.456	3.075	20	30		EGEDHN
CC(C)(F)C(=O)NCC1(NCC#Cc2ccc(F)cc2)CCCCC1	ZINC001115379991	1370419015	/nfs/dbraw/zinc/41/90/15/1370419015.db2.gz	FKXKRRYBEGJCRV-UHFFFAOYSA-N	0	3	348.437	3.334	20	30		EGEDHN
C[C@H]1C[C@@H]1C(=O)NCC1(NCC#Cc2ccc(F)cc2)CCCCC1	ZINC001115388836	1370425102	/nfs/dbraw/zinc/42/51/02/1370425102.db2.gz	BVBIMCRZGCEBRT-LPHOPBHVSA-N	0	3	342.458	3.242	20	30		EGEDHN
N#Cc1ccccc1CN1CC[C@]2(CCN(c3ccsc3)C2=O)C1	ZINC001204368551	1370455904	/nfs/dbraw/zinc/45/59/04/1370455904.db2.gz	YSJZUWUCGYMNHT-IBGZPJMESA-N	0	3	337.448	3.249	20	30		EGEDHN
Cc1ccc(O[C@H]2C[C@@H]3CN(Cc4ccccc4C#N)CCN3C2)cc1	ZINC001204369811	1370456107	/nfs/dbraw/zinc/45/61/07/1370456107.db2.gz	DMRIGQUTCAGEGG-IRLDBZIGSA-N	0	3	347.462	3.204	20	30		EGEDHN
C#CCCCCC(=O)NCC1(NCc2ccns2)CCCCC1	ZINC001115490754	1370494332	/nfs/dbraw/zinc/49/43/32/1370494332.db2.gz	OMUGCBHAGBUIGP-UHFFFAOYSA-N	0	3	333.501	3.245	20	30		EGEDHN
CC(C)SCC(=O)N1CCC(CNCc2ccccc2C#N)CC1	ZINC001204543628	1370510767	/nfs/dbraw/zinc/51/07/67/1370510767.db2.gz	HIPBDUFAQHDIFO-UHFFFAOYSA-N	0	3	345.512	3.028	20	30		EGEDHN
CN1CCN(Cc2cccc(Nc3cc(F)cc(F)c3C#N)c2)CC1	ZINC001204578186	1370521792	/nfs/dbraw/zinc/52/17/92/1370521792.db2.gz	AKIMGJYMTDZRIS-UHFFFAOYSA-N	0	3	342.393	3.327	20	30		EGEDHN
C=CCCO[C@H](C)C(=O)N1CCC(CNC/C(Cl)=C\Cl)CC1	ZINC001204692547	1370547401	/nfs/dbraw/zinc/54/74/01/1370547401.db2.gz	MAXCMPFBZPANAT-QQFZQELXSA-N	0	3	349.302	3.115	20	30		EGEDHN
CN1CCN(Cc2ccc(Nc3cc(F)c(C#N)cc3F)cc2)CC1	ZINC001204747553	1370564349	/nfs/dbraw/zinc/56/43/49/1370564349.db2.gz	XOUJARQLVITOFO-UHFFFAOYSA-N	0	3	342.393	3.327	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H]2Cc3ccccc3O2)CCCCC1	ZINC001115620332	1370615516	/nfs/dbraw/zinc/61/55/16/1370615516.db2.gz	YWADEDNFRTZATI-KRWDZBQOSA-N	0	3	348.874	3.151	20	30		EGEDHN
C#CCCCCC(=O)N1CCC(CNCc2csc(CC)n2)CC1	ZINC001205038476	1370635577	/nfs/dbraw/zinc/63/55/77/1370635577.db2.gz	AXNIZNVQHIMVCT-UHFFFAOYSA-N	0	3	347.528	3.227	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCC1(NCc2ccccn2)CCCCC1	ZINC001115678501	1370660811	/nfs/dbraw/zinc/66/08/11/1370660811.db2.gz	JBZDPDYWJWTHOA-IRXDYDNUSA-N	0	3	329.488	3.449	20	30		EGEDHN
C=C[C@@H](C)[C@H](C)C(=O)NCC1(NCc2cnc(C)cn2)CCCCC1	ZINC001115679658	1370663112	/nfs/dbraw/zinc/66/31/12/1370663112.db2.gz	LTBIDSRZPPBYFQ-WBVHZDCISA-N	0	3	344.503	3.152	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)NCC1(NCc2cnoc2C)CCCCC1	ZINC001115684761	1370667619	/nfs/dbraw/zinc/66/76/19/1370667619.db2.gz	HGDCHWCJYVHITH-OAHLLOKOSA-N	0	3	333.476	3.494	20	30		EGEDHN
CC(C)(C)C#CC(=O)N1CCC(CNC/C(Cl)=C\Cl)CC1	ZINC001205236120	1370690674	/nfs/dbraw/zinc/69/06/74/1370690674.db2.gz	NJQHFFSXZAXFEM-GXDHUFHOSA-N	0	3	331.287	3.183	20	30		EGEDHN
C=C1CC(C)(C(=O)NCC2(NCc3snnc3C)CCCCC2)C1	ZINC001115723171	1370702201	/nfs/dbraw/zinc/70/22/01/1370702201.db2.gz	BWOMTYCEWIRWNO-UHFFFAOYSA-N	0	3	348.516	3.112	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@@H](F)C(C)C)CC[C@H]1c1ccc(F)cc1	ZINC001205300766	1370712400	/nfs/dbraw/zinc/71/24/00/1370712400.db2.gz	VYRXLNPALNIRRA-OTWHNJEPSA-N	0	3	348.437	3.117	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)[C@@H]2C[C@H]2c2cccnc2)CCCCC1	ZINC001115743347	1370723217	/nfs/dbraw/zinc/72/32/17/1370723217.db2.gz	ODJDECPJJCUHGV-DLBZAZTESA-N	0	3	347.890	3.346	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)c2ccccc2)C[C@H]1c1cccc(F)c1	ZINC001205344021	1370727558	/nfs/dbraw/zinc/72/75/58/1370727558.db2.gz	NAQHPDOYGFQHHW-VQTJNVASSA-N	0	3	336.410	3.047	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cnn(CCC)c2)CCCCC1	ZINC001115752786	1370734292	/nfs/dbraw/zinc/73/42/92/1370734292.db2.gz	UZPDSVNIQVUEND-UHFFFAOYSA-N	0	3	338.883	3.068	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)C[C@@H](C)CC)C[C@H]1c1cccc(F)c1	ZINC001205404336	1370744930	/nfs/dbraw/zinc/74/49/30/1370744930.db2.gz	QCWWOBDSBWXJLQ-ZYSHUDEJSA-N	0	3	330.447	3.169	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)/C=C(/C)CC)C[C@H]1c1cccc(F)c1	ZINC001205406939	1370746106	/nfs/dbraw/zinc/74/61/06/1370746106.db2.gz	ZOBGCIANMXFHET-GYVFVFFDSA-N	0	3	328.431	3.089	20	30		EGEDHN
C#CCN[C@@H]1CN(C(=O)C[C@@H](C)C(C)(C)C)C[C@H]1c1cccc(F)c1	ZINC001205452589	1370759834	/nfs/dbraw/zinc/75/98/34/1370759834.db2.gz	JJNBSBDIDUTVBW-AYOQOUSVSA-N	0	3	344.474	3.415	20	30		EGEDHN
C#CCC1(C(=O)N2CCC(CNC/C(Cl)=C\Cl)CC2)CCC1	ZINC001205451008	1370759911	/nfs/dbraw/zinc/75/99/11/1370759911.db2.gz	AOWYDBCSVSPMHZ-RVDMUPIBSA-N	0	3	343.298	3.327	20	30		EGEDHN
C=C(CN1CCCC1)c1nc(-c2ccc(OC)c(OCC)c2)no1	ZINC001206100296	1370960351	/nfs/dbraw/zinc/96/03/51/1370960351.db2.gz	LMCQKQWUCZUCKS-UHFFFAOYSA-N	0	3	329.400	3.253	20	30		EGEDHN
C=CCCCC(=O)N1CCC(CNCc2cc(F)ccc2C#N)CC1	ZINC001206104854	1370960553	/nfs/dbraw/zinc/96/05/53/1370960553.db2.gz	DGPPBRSLNNRRDD-UHFFFAOYSA-N	0	3	343.446	3.382	20	30		EGEDHN
C=CCCCC(=O)N1CCC(CNCc2ccccc2C#N)CC1	ZINC001206105620	1370961316	/nfs/dbraw/zinc/96/13/16/1370961316.db2.gz	PEIBVZLIWPAGEA-UHFFFAOYSA-N	0	3	325.456	3.243	20	30		EGEDHN
CN1CCN(CCCO[C@H](C#Cc2ccccc2)c2ccccc2)CC1	ZINC001206595366	1371104108	/nfs/dbraw/zinc/10/41/08/1371104108.db2.gz	FLCPTZIZIIBULR-HSZRJFAPSA-N	0	3	348.490	3.434	20	30		EGEDHN
C=CCN1CC[C@@]2(CCCN(Cc3ccc(C)cc3OC)C2)C1=O	ZINC001206748768	1371153280	/nfs/dbraw/zinc/15/32/80/1371153280.db2.gz	JVSIWLWCEWXUBT-HXUWFJFHSA-N	0	3	328.456	3.004	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CN(CCOc2ccc(F)cc2)C[C@H]1C	ZINC001207158688	1371315266	/nfs/dbraw/zinc/31/52/66/1371315266.db2.gz	YGEWYDRKJXQANQ-CRAIPNDOSA-N	0	3	348.462	3.243	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CN(C[C@H](OC)c2ccccc2)C[C@H]1C	ZINC001207165556	1371316461	/nfs/dbraw/zinc/31/64/61/1371316461.db2.gz	TYQBCLWGPPBKIM-QRQLOZEOSA-N	0	3	344.499	3.413	20	30		EGEDHN
C/C(=C\C(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1)C1CC1	ZINC001207548877	1371432369	/nfs/dbraw/zinc/43/23/69/1371432369.db2.gz	BTEZABNCQGTEJV-KETLNSEPSA-N	0	3	340.442	3.114	20	30		EGEDHN
C=CCOC(=O)N[C@@H]1CCCN(CCCc2ccc(OC)cc2)C1	ZINC001207585380	1371443709	/nfs/dbraw/zinc/44/37/09/1371443709.db2.gz	UFVAXUSGJFUQTA-QGZVFWFLSA-N	0	3	332.444	3.004	20	30		EGEDHN
C=CCOCCCC(=O)N1CCC[C@@H](N[C@@H](C)c2ccccc2F)C1	ZINC001207741631	1371490491	/nfs/dbraw/zinc/49/04/91/1371490491.db2.gz	NXTWGXUNRSOGQR-DLBZAZTESA-N	0	3	348.462	3.450	20	30		EGEDHN
O=C(c1ccoc1Cl)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001207909210	1371535700	/nfs/dbraw/zinc/53/57/00/1371535700.db2.gz	PVXFPSZDIJRTCE-MRXNPFEDSA-N	0	3	342.826	3.179	20	30		EGEDHN
Cc1csc(C(=O)N2CCC[C@H](NCC#Cc3ccccc3)C2)c1	ZINC001207982705	1371559992	/nfs/dbraw/zinc/55/99/92/1371559992.db2.gz	DHKSXHMESXEPAA-SFHVURJKSA-N	0	3	338.476	3.302	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)CCc2ccc3[nH]ccc3c2)C1	ZINC001208007788	1371565857	/nfs/dbraw/zinc/56/58/57/1371565857.db2.gz	LAUCOIOPMZQULN-DNVCBOLYSA-N	0	3	325.456	3.113	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H]2CN([C@H](C)c3cccc(OC)c3)C[C@H]21	ZINC001187714610	1388148931	/nfs/dbraw/zinc/14/89/31/1388148931.db2.gz	UIJSOLDZCNHRQN-IMFGXOCKSA-N	0	3	340.467	3.092	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001208241291	1371674969	/nfs/dbraw/zinc/67/49/69/1371674969.db2.gz	VSNZQSDTEWVEIX-QGZVFWFLSA-N	0	3	343.446	3.380	20	30		EGEDHN
C=C(C)CCC(=O)N1CCC[C@@H](NCC#Cc2ccc(F)cc2)C1	ZINC001208255879	1371685018	/nfs/dbraw/zinc/68/50/18/1371685018.db2.gz	SQLNEXGXYDXKGP-LJQANCHMSA-N	0	3	328.431	3.114	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CN(Cc2cccc(N(C)C)c2)C[C@H]1C	ZINC001208388900	1371747995	/nfs/dbraw/zinc/74/79/95/1371747995.db2.gz	RUIDAOAQWPYVGA-MBOZVWFJSA-N	0	3	343.515	3.291	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1CN(CCc2ccccc2F)C[C@H]1C	ZINC001208393381	1371751373	/nfs/dbraw/zinc/75/13/73/1371751373.db2.gz	QIRBYOLQLDCNHB-GPMSIDNRSA-N	0	3	332.463	3.407	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N[C@@H]1CN(Cc2ccccc2N(C)C)C[C@H]1C	ZINC001208393689	1371751430	/nfs/dbraw/zinc/75/14/30/1371751430.db2.gz	WXDBQCZGTRAZBV-ZHALLVOQSA-N	0	3	343.515	3.291	20	30		EGEDHN
C=CCCC1(C(=O)N[C@@H]2CN(CCc3scnc3C)C[C@H]2C)CC1	ZINC001208515334	1371796203	/nfs/dbraw/zinc/79/62/03/1371796203.db2.gz	HZHRXIIVMUKCIL-GDBMZVCRSA-N	0	3	347.528	3.177	20	30		EGEDHN
C/C=C(\C)C(=O)NC1CC2(CC(NCc3cc(F)ccc3C#N)C2)C1	ZINC001120914505	1371805385	/nfs/dbraw/zinc/80/53/85/1371805385.db2.gz	HATGJGAIRSRPPX-QLKAYGNNSA-N	0	3	341.430	3.181	20	30		EGEDHN
COC(=O)c1ccc(C2CN(CCCc3ccc(C#N)cc3)C2)cc1	ZINC001208864689	1371924833	/nfs/dbraw/zinc/92/48/33/1371924833.db2.gz	QBELJZWRJOQYRX-UHFFFAOYSA-N	0	3	334.419	3.377	20	30		EGEDHN
O=C(C[C@H]1CC=CCC1)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001208993602	1371970034	/nfs/dbraw/zinc/97/00/34/1371970034.db2.gz	LVAWQXCIJWWWIK-SFTDATJTSA-N	0	3	336.479	3.365	20	30		EGEDHN
C#CCCCCCC(=O)N1CCC[C@@H](NCc2ccccc2F)C1	ZINC001209005528	1371972639	/nfs/dbraw/zinc/97/26/39/1371972639.db2.gz	WVBFIEMMGOGSET-GOSISDBHSA-N	0	3	330.447	3.490	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC1CC2(CC(NCc3cnc(C)o3)C2)C1	ZINC001121528685	1372000363	/nfs/dbraw/zinc/00/03/63/1372000363.db2.gz	UUCYYSIKRMSEDJ-UHFFFAOYSA-N	0	3	331.460	3.102	20	30		EGEDHN
CC1(C)CC[C@@H]1C(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1	ZINC001209120473	1372003656	/nfs/dbraw/zinc/00/36/56/1372003656.db2.gz	FLDQFCQOFNKJME-RBUKOAKNSA-N	0	3	342.458	3.194	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC1CC2(C1)CC(N[C@@H](C)c1cnccn1)C2	ZINC001121616662	1372027087	/nfs/dbraw/zinc/02/70/87/1372027087.db2.gz	NUWUVFOLVGZHDJ-QTNZZUQDSA-N	0	3	342.487	3.157	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC[C@@H](NCc2cn(C(C)C)nc2C)C1	ZINC001209184407	1372029282	/nfs/dbraw/zinc/02/92/82/1372029282.db2.gz	SFHLBBDBHFVLFD-PKOBYXMFSA-N	0	3	346.519	3.455	20	30		EGEDHN
CC(C)(C(=O)N1CCC[C@H](NCC#Cc2ccc(F)cc2)C1)C1CC1	ZINC001209185251	1372030719	/nfs/dbraw/zinc/03/07/19/1372030719.db2.gz	VJTIBXZJVITKRC-IBGZPJMESA-N	0	3	342.458	3.194	20	30		EGEDHN
C=CCCCCN1CCN(Cc2ccccc2)C[C@H]1CC(=O)OC	ZINC001209207314	1372039158	/nfs/dbraw/zinc/03/91/58/1372039158.db2.gz	SBYIZHQXBYZZDV-LJQANCHMSA-N	0	3	330.472	3.092	20	30		EGEDHN
CC(C)C#CC(=O)N1CC[C@H]2CN(Cc3ccc(C4CC4)cc3)C[C@H]21	ZINC001187840875	1388174926	/nfs/dbraw/zinc/17/49/26/1388174926.db2.gz	NMDLIFKMVJUBLM-LEWJYISDSA-N	0	3	336.479	3.256	20	30		EGEDHN
C#CCCCN1CCN(c2ccc3oc(C(=O)OCC)cc3c2)CC1	ZINC001209269776	1372055663	/nfs/dbraw/zinc/05/56/63/1372055663.db2.gz	PTOWQLYACZMPHT-UHFFFAOYSA-N	0	3	340.423	3.145	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC1CC2(CC(NCc3nccs3)C2)C1	ZINC001121713210	1372056030	/nfs/dbraw/zinc/05/60/30/1372056030.db2.gz	DMVMIJLSRCDXQN-SEEMLRNQSA-N	0	3	333.501	3.262	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)NC1CC2(CC(NCc3ocnc3C)C2)C1	ZINC001121714132	1372057017	/nfs/dbraw/zinc/05/70/17/1372057017.db2.gz	WDBNXMFLOWLRTK-XHVMPKOQSA-N	0	3	331.460	3.102	20	30		EGEDHN
C=CCCCC(=O)N1CCC[C@@H](NCc2ccc(C#N)c(F)c2)C1	ZINC001209335432	1372071497	/nfs/dbraw/zinc/07/14/97/1372071497.db2.gz	LSTBOTLWPFQYMI-QGZVFWFLSA-N	0	3	329.419	3.134	20	30		EGEDHN
C=C(Br)CNC1CC2(C1)CC(NC(=O)[C@H](C)C(C)C)C2	ZINC001121860195	1372106112	/nfs/dbraw/zinc/10/61/12/1372106112.db2.gz	KUFAGDSNGFRHLY-BHTBLZRRSA-N	0	3	343.309	3.204	20	30		EGEDHN
CCCC1(C(=O)N2CCC[C@H](NCC#Cc3ccc(F)cc3)C2)CC1	ZINC001209537513	1372131652	/nfs/dbraw/zinc/13/16/52/1372131652.db2.gz	UJRAWMRREJHJCN-IBGZPJMESA-N	0	3	342.458	3.338	20	30		EGEDHN
CC(C)CCCC(=O)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001209777464	1372193474	/nfs/dbraw/zinc/19/34/74/1372193474.db2.gz	WRWZWOKAJXICTD-HXUWFJFHSA-N	0	3	326.484	3.445	20	30		EGEDHN
C=C(Cl)CNC1CC2(C1)CC(NC(=O)CCc1ccc(C)o1)C2	ZINC001122242420	1372209215	/nfs/dbraw/zinc/20/92/15/1372209215.db2.gz	GZZTUFPFOVIDPO-UHFFFAOYSA-N	0	3	336.863	3.290	20	30		EGEDHN
N#CC(C(=O)Nc1ccc(SC(F)F)cc1)C(=O)[C@H]1C[C@H]1F	ZINC001122449668	1372249466	/nfs/dbraw/zinc/24/94/66/1372249466.db2.gz	VOQAQTUGTYULBI-GARJFASQSA-N	0	3	328.315	3.007	20	30		EGEDHN
O=C(c1c[nH]cc1C1CC1)N1CCC[C@H](NCC#Cc2ccccc2)C1	ZINC001210402563	1372343658	/nfs/dbraw/zinc/34/36/58/1372343658.db2.gz	JXHCBKUVMSHOAI-IBGZPJMESA-N	0	3	347.462	3.138	20	30		EGEDHN
C=C(C)CN1C[C@@H](C)[C@H](NC(=O)C[C@H](C)c2ccccc2OC)C1	ZINC001210412589	1372346194	/nfs/dbraw/zinc/34/61/94/1372346194.db2.gz	TYHLTHGZYDLYJI-LZLYRXPVSA-N	0	3	330.472	3.201	20	30		EGEDHN
O=C([C@@H]1CC12CCCC2)N1CCC[C@@H](NCC#Cc2ccccc2)C1	ZINC001210502965	1372367970	/nfs/dbraw/zinc/36/79/70/1372367970.db2.gz	MUSFNCVNMQINCV-UXHICEINSA-N	0	3	336.479	3.199	20	30		EGEDHN
CCCN1CCc2c(N)sc(Nc3ccc(O)c(C#N)c3)c2C1	ZINC001210531327	1372372458	/nfs/dbraw/zinc/37/24/58/1372372458.db2.gz	YOHDOSGBPICJAG-UHFFFAOYSA-N	0	3	328.441	3.419	20	30		EGEDHN
CC[C@H](C)n1ncc(C(=O)C(C#N)c2nccn2CC)c1C1CC1	ZINC001123233819	1372403174	/nfs/dbraw/zinc/40/31/74/1372403174.db2.gz	ODCUDXWICMXTJD-JSGCOSHPSA-N	0	3	325.416	3.438	20	30		EGEDHN
Cn1c(Cl)cnc1C(C#N)C(=O)C[C@@H](CC#N)c1ccccc1	ZINC001123337905	1372431527	/nfs/dbraw/zinc/43/15/27/1372431527.db2.gz	VVACLRGHKCWSAC-KGLIPLIRSA-N	0	3	326.787	3.337	20	30		EGEDHN
Cn1c(Cl)cnc1C(C#N)C(=O)CCCOc1ccccc1F	ZINC001123338306	1372431937	/nfs/dbraw/zinc/43/19/37/1372431937.db2.gz	ZVARCUXGRDDXAR-LLVKDONJSA-N	0	3	335.766	3.248	20	30		EGEDHN
C=CCC1(C(=O)N2CCC[C@H](NCc3cncn3C)C2)CCCCC1	ZINC001211212746	1372503848	/nfs/dbraw/zinc/50/38/48/1372503848.db2.gz	FZNNXDYVFFIVQG-KRWDZBQOSA-N	0	3	344.503	3.027	20	30		EGEDHN
C=C[C@@H](CC(=O)N[C@@H]1CN(CCOC(C)C)C[C@H]1C)c1ccccc1	ZINC001211228343	1372508070	/nfs/dbraw/zinc/50/80/70/1372508070.db2.gz	VRGJZTPPBKAELQ-WSTZPKSXSA-N	0	3	344.499	3.208	20	30		EGEDHN
C=CCC1(C(=O)N[C@@H]2CN(C[C@@H]3CCCCO3)C[C@H]2C)CCCC1	ZINC001211495781	1372567934	/nfs/dbraw/zinc/56/79/34/1372567934.db2.gz	WRZYXOGWAMNDJT-FGTMMUONSA-N	0	3	334.504	3.129	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)[C@H]2CCC(C)(C)C2)C[C@H]1c1ccccc1	ZINC001211671102	1372600585	/nfs/dbraw/zinc/60/05/85/1372600585.db2.gz	YGSGCBBDZKHBDQ-SLFFLAALSA-N	0	3	338.495	3.420	20	30		EGEDHN
CC#CCN[C@@H]1CN(C(=O)CCc2ccccc2)C[C@H]1c1ccccc1	ZINC001211713605	1372607519	/nfs/dbraw/zinc/60/75/19/1372607519.db2.gz	RJVLSSKVTVAXQN-FCHUYYIVSA-N	0	3	346.474	3.227	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H]1CN(CCCC2CCCC2)C[C@H]1OC	ZINC001212338102	1372690360	/nfs/dbraw/zinc/69/03/60/1372690360.db2.gz	CIBACMFGOLOPHO-QZTJIDSGSA-N	0	3	336.520	3.375	20	30		EGEDHN
CCCCCCCCS(=O)(=O)N[C@@H]1C[C@H]2CCC[C@@H](C1)N2C	ZINC001188028687	1388220993	/nfs/dbraw/zinc/22/09/93/1388220993.db2.gz	IKEXZOMAQKHCLV-OSYLJGHBSA-N	0	3	330.538	3.282	20	30		EGEDHN
C=C[C@@H](CC(=O)N1CC[C@@H](NCc2cncc(C)c2)C1)c1ccccc1	ZINC001188040220	1388224780	/nfs/dbraw/zinc/22/47/80/1388224780.db2.gz	PKWJUJQVWDKZAV-PZJWPPBQSA-N	0	3	349.478	3.440	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)c2csc3ccccc32)[C@H](OC)C1	ZINC001213228268	1372863658	/nfs/dbraw/zinc/86/36/58/1372863658.db2.gz	OGUCQKQOJDVLSQ-IAGOWNOFSA-N	0	3	344.480	3.297	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@@H](NCc3cnc(C)nc3)C2)CCCCC1	ZINC001188052336	1388229100	/nfs/dbraw/zinc/22/91/00/1388229100.db2.gz	ALSJCCXPYRQVRZ-GOSISDBHSA-N	0	3	342.487	3.002	20	30		EGEDHN
C#CCCCCC(=O)NCCNCc1ccc(Cl)c(Cl)c1	ZINC001125939208	1372895971	/nfs/dbraw/zinc/89/59/71/1372895971.db2.gz	XRPATRMWAZYTRE-UHFFFAOYSA-N	0	3	327.255	3.393	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)C2CCC(F)CC2)[C@H](OC)C1	ZINC001213380206	1372896874	/nfs/dbraw/zinc/89/68/74/1372896874.db2.gz	MXYSJXWRKDPVCS-OPQOLIRYSA-N	0	3	340.483	3.077	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CN(Cc2c(C)cccc2C)C[C@H]1OC	ZINC001213495945	1372913879	/nfs/dbraw/zinc/91/38/79/1372913879.db2.gz	DRMWPDLESMPNLY-RTBURBONSA-N	0	3	344.499	3.221	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H]2CN(Cc3cccc(OC)c3)C[C@H]21	ZINC001188057254	1388231025	/nfs/dbraw/zinc/23/10/25/1388231025.db2.gz	VCAQNWYLSYXQPS-PKOBYXMFSA-N	0	3	342.483	3.330	20	30		EGEDHN
C=CCCCN1C[C@@H](NC(=O)C(C)(C)c2ccc(C)cc2)[C@H](OC)C1	ZINC001213739050	1372954796	/nfs/dbraw/zinc/95/47/96/1372954796.db2.gz	YCUYRKIFHGELHI-RTBURBONSA-N	0	3	344.499	3.054	20	30		EGEDHN
C#CCCCC(=O)NCCNCc1ccc(OC(C)C)c(Cl)c1	ZINC001126338843	1372958445	/nfs/dbraw/zinc/95/84/45/1372958445.db2.gz	KMCPJZBTGKHJMU-UHFFFAOYSA-N	0	3	336.863	3.137	20	30		EGEDHN
C#CCCCC(=O)NCCNCc1sc(-c2ccccc2)nc1C	ZINC001126344240	1372959113	/nfs/dbraw/zinc/95/91/13/1372959113.db2.gz	QTPZOCCBIZCERA-UHFFFAOYSA-N	0	3	341.480	3.128	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2cccn2C(C)C)[C@H](OC)C1	ZINC001213861285	1372971786	/nfs/dbraw/zinc/97/17/86/1372971786.db2.gz	JZPJXMTZJWDXAQ-IEBWSBKVSA-N	0	3	347.503	3.244	20	30		EGEDHN
CC/C=C(/C)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2cccc(Cl)c2)C1	ZINC001214255169	1373031142	/nfs/dbraw/zinc/03/11/42/1373031142.db2.gz	PLXHCHFESQEBDF-HHNZGKMASA-N	0	3	344.886	3.484	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](C)[C@H](N[C@H]2CCc3c2c(F)ccc3F)C1	ZINC001214529437	1373074991	/nfs/dbraw/zinc/07/49/91/1373074991.db2.gz	ZBHHLQDZNBYLAX-JEBQAFNWSA-N	0	3	346.421	3.192	20	30		EGEDHN
CCCC[C@@](C)(F)C(=O)N1C[C@@H](C)[C@H](NCC#Cc2ccccc2)C1	ZINC001215007967	1373155147	/nfs/dbraw/zinc/15/51/47/1373155147.db2.gz	BRUVCSSKTJWGQE-YFVAEKQCSA-N	0	3	344.474	3.393	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](C)[C@H](NCc2cccc(C(C)C)n2)C1	ZINC001215429711	1373206151	/nfs/dbraw/zinc/20/61/51/1373206151.db2.gz	NQHAOKVJWVDWEK-VQIMIIECSA-N	0	3	329.488	3.498	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@H](C)[C@H](NCc2cc(F)ccc2OC)C1	ZINC001215427943	1373206412	/nfs/dbraw/zinc/20/64/12/1373206412.db2.gz	QQZCEECCGUTAHX-RHSMWYFYSA-N	0	3	334.435	3.127	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)NCCNCc1ccccc1OC(C)C	ZINC001128209404	1373235493	/nfs/dbraw/zinc/23/54/93/1373235493.db2.gz	YUMJMOWEBZQSGT-UHFFFAOYSA-N	0	3	338.879	3.458	20	30		EGEDHN
CC(C)Cc1ccc(C(=O)NCCNCc2cccc(C#N)c2)s1	ZINC001129635827	1373406038	/nfs/dbraw/zinc/40/60/38/1373406038.db2.gz	KXLRPJOEYALVKD-UHFFFAOYSA-N	0	3	341.480	3.338	20	30		EGEDHN
C=CCCC(=O)N1CCO[C@@H]2CN([C@@H](CC)c3ccccc3)C[C@@H]21	ZINC001217493617	1373454857	/nfs/dbraw/zinc/45/48/57/1373454857.db2.gz	NDHVMYVKXXPEHK-GBESFXJTSA-N	0	3	328.456	3.016	20	30		EGEDHN
N#Cc1ccc(CNCCNC(=O)C/C=C\c2ccccc2F)s1	ZINC001130170018	1373469500	/nfs/dbraw/zinc/46/95/00/1373469500.db2.gz	NFJKKWNVZUTMHQ-HYXAFXHYSA-N	0	3	343.427	3.068	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)[C@H]3[C@@H]4CCCC[C@@H]43)[C@H]2C1	ZINC001217594106	1373470370	/nfs/dbraw/zinc/47/03/70/1373470370.db2.gz	CKLVCPGNKMRJAN-PXTPFGJHSA-N	0	3	346.515	3.081	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)c3cscc3C)[C@H]2C1	ZINC001217607196	1373472623	/nfs/dbraw/zinc/47/26/23/1373472623.db2.gz	MINKPBWUYOTQIS-ZWKOTPCHSA-N	0	3	348.512	3.328	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)[C@H](CC)CCCC)C1	ZINC001130350994	1373500362	/nfs/dbraw/zinc/50/03/62/1373500362.db2.gz	BGQHDUVMJRWTFG-CVEARBPZSA-N	0	3	332.492	3.218	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)CC(C)(C)C3CC3)[C@H]2C1	ZINC001217794449	1373501825	/nfs/dbraw/zinc/50/18/25/1373501825.db2.gz	HQVWRGBLNFVCIJ-RBUKOAKNSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=CCN1CC[C@@H](c2n[nH]cc2CNC(=O)[C@@H](C)C(CC)CC)C1	ZINC001130402110	1373521320	/nfs/dbraw/zinc/52/13/20/1373521320.db2.gz	WCBMUGXCMDBDTE-GOEBONIOSA-N	0	3	332.492	3.074	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCO[C@@H]2CN(CCCCCC)C[C@@H]21	ZINC001217988033	1373527554	/nfs/dbraw/zinc/52/75/54/1373527554.db2.gz	UDNKUITYFGYUKM-RBUKOAKNSA-N	0	3	334.504	3.247	20	30		EGEDHN
COc1ccc(/C=C/C(=O)c2ccccc2O[C@@H]2CNC[C@@H]2F)cc1	ZINC001217998891	1373530973	/nfs/dbraw/zinc/53/09/73/1373530973.db2.gz	BKZLICAJXIYIST-ZNPHBUKXSA-N	0	3	341.382	3.280	20	30		EGEDHN
C=CCN1CC[C@H](c2n[nH]cc2CNC(=O)[C@@H](CCC)C(C)C)C1	ZINC001130431349	1373536098	/nfs/dbraw/zinc/53/60/98/1373536098.db2.gz	VYUTVORWSAEGGT-RDJZCZTQSA-N	0	3	332.492	3.074	20	30		EGEDHN
CCC[C@H]1CCC[C@H]1C(=O)NCCNCc1ccc(C#N)c(F)c1	ZINC001130566742	1373560933	/nfs/dbraw/zinc/56/09/33/1373560933.db2.gz	KFFKTTVWHXPKOX-DOTOQJQBSA-N	0	3	331.435	3.120	20	30		EGEDHN
C=CCN[C@@H]1CN(C(=O)CCCCC(C)(C)C)C[C@H]1c1cn(C)cn1	ZINC001130600911	1373568842	/nfs/dbraw/zinc/56/88/42/1373568842.db2.gz	SBZYHCFGDQXWOW-FUHWJXTLSA-N	0	3	346.519	3.097	20	30		EGEDHN
C=CCCCCCN1C[C@H]2OCCN(C(=O)[C@@H]3CCCC3(C)C)[C@H]2C1	ZINC001218447700	1373615371	/nfs/dbraw/zinc/61/53/71/1373615371.db2.gz	KTHGHPRZDMXUSA-GBESFXJTSA-N	0	3	348.531	3.471	20	30		EGEDHN
C=C[C@H](CC)CC(=O)N1CCO[C@@H]2CN(CC/C=C\CCC)C[C@@H]21	ZINC001218516525	1373627591	/nfs/dbraw/zinc/62/75/91/1373627591.db2.gz	DCLGWVJBBWVHDQ-VXARMHRZSA-N	0	3	334.504	3.247	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N1CCO[C@@H]2CN(CC/C=C\CCC)C[C@@H]21	ZINC001218524406	1373630211	/nfs/dbraw/zinc/63/02/11/1373630211.db2.gz	XAVTUECMIQYEJE-XCLUONLBSA-N	0	3	334.504	3.247	20	30		EGEDHN
C=CCCCC(=O)N1CCO[C@@H]2CN([C@@H](CC)c3ccccc3)C[C@@H]21	ZINC001218557830	1373632825	/nfs/dbraw/zinc/63/28/25/1373632825.db2.gz	LBVUXEAEQYVOKJ-SLFFLAALSA-N	0	3	342.483	3.406	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2OCCN(C(=O)c3cc(C)cc(F)c3)[C@H]2C1	ZINC001218672421	1373643238	/nfs/dbraw/zinc/64/32/38/1373643238.db2.gz	MFTIGRGYWPECQA-AYOQOUSVSA-N	0	3	346.446	3.014	20	30		EGEDHN
N#Cc1cc(NC(=O)[C@@H](N)C2CCCCC2)ccc1N1CCCCC1	ZINC001218943978	1373669227	/nfs/dbraw/zinc/66/92/27/1373669227.db2.gz	GFJYZAKRPVGKFA-IBGZPJMESA-N	0	3	340.471	3.395	20	30		EGEDHN
Cc1cc(Cl)cc(C(=O)NCCNCc2cccc(C#N)c2)c1	ZINC001131362807	1373683857	/nfs/dbraw/zinc/68/38/57/1373683857.db2.gz	NQFBTWRUZZJJHN-UHFFFAOYSA-N	0	3	327.815	3.040	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1C[C@H](C)O[C@@]2(CCN(CC(=C)C)C2)C1	ZINC001131660995	1373749283	/nfs/dbraw/zinc/74/92/83/1373749283.db2.gz	INRMJURWIROQBH-FXAWDEMLSA-N	0	3	332.488	3.023	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@H](C)O[C@@]2(CCN(CC=C(C)C)C2)C1	ZINC001131661965	1373750359	/nfs/dbraw/zinc/75/03/59/1373750359.db2.gz	RVYAMAUNOBQWOL-FXAWDEMLSA-N	0	3	334.504	3.247	20	30		EGEDHN
C#CCCCCCC(=O)N1C[C@@H](C)O[C@]2(CCN(CC=C(C)C)C2)C1	ZINC001131672892	1373754961	/nfs/dbraw/zinc/75/49/61/1373754961.db2.gz	CJIZTWBALWBRNF-CTNGQTDRSA-N	0	3	346.515	3.228	20	30		EGEDHN
C=C(C)CN1CC[C@]2(C1)CN(C(=O)C1(CCCC)CC1)C[C@@H](C)O2	ZINC001131688667	1373764313	/nfs/dbraw/zinc/76/43/13/1373764313.db2.gz	QBEMCXCJIXTCNV-XLIONFOSSA-N	0	3	334.504	3.225	20	30		EGEDHN
C=CCCCN1CC[C@@H]2CN(C(=O)c3c(C)noc3C(F)F)[C@@H]2C1	ZINC001221639549	1373784707	/nfs/dbraw/zinc/78/47/07/1373784707.db2.gz	RXPSXVWQJMPXKO-CHWSQXEVSA-N	0	3	339.386	3.033	20	30		EGEDHN
CC(C)=CC(=O)N[C@@H]1CC[C@@H](C)N(Cc2ccc(OCC#N)cc2)C1	ZINC001131771644	1373795490	/nfs/dbraw/zinc/79/54/90/1373795490.db2.gz	JWAVALAWFFATID-SJLPKXTDSA-N	0	3	341.455	3.024	20	30		EGEDHN
C=C[C@H](CC(=O)N1C[C@H]2CCN(CCCF)C[C@H]21)c1ccccc1	ZINC001222038106	1373813322	/nfs/dbraw/zinc/81/33/22/1373813322.db2.gz	MKOOZMZOCXLSKE-BHIYHBOVSA-N	0	3	330.447	3.239	20	30		EGEDHN
Cc1cccc(C)c1CN1C[C@H](NC(=O)CSCC#N)CC[C@H]1C	ZINC001131825214	1373823763	/nfs/dbraw/zinc/82/37/63/1373823763.db2.gz	IFNCZZRKIVSLLN-IAGOWNOFSA-N	0	3	345.512	3.029	20	30		EGEDHN
Cc1ccc(C)c(CN2C[C@@H](NC(=O)CSCC#N)CC[C@H]2C)c1	ZINC001131830765	1373827637	/nfs/dbraw/zinc/82/76/37/1373827637.db2.gz	UTUMVSFKNCWWEC-AEFFLSMTSA-N	0	3	345.512	3.029	20	30		EGEDHN
C=CCCC(=O)N[C@H]1CC[C@H](C)N(CCOc2ccc(C)cc2)C1	ZINC001131896877	1375033230	/nfs/dbraw/zinc/03/32/30/1375033230.db2.gz	WULUKBLEIKRTMS-ROUUACIJSA-N	0	3	330.472	3.309	20	30		EGEDHN
C=CCOCC(=O)N[C@@H]1CC[C@@H](C)N(Cc2cc(C)sc2C)C1	ZINC001131896563	1375033960	/nfs/dbraw/zinc/03/39/60/1375033960.db2.gz	UAHHUQDTCAMLQF-CXAGYDPISA-N	0	3	336.501	3.037	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)C(C)(C)c2ccc(Cl)cc2)CC1	ZINC001224317909	1375064078	/nfs/dbraw/zinc/06/40/78/1375064078.db2.gz	DVJPCXKREMEKOZ-UHFFFAOYSA-N	0	3	346.902	3.469	20	30		EGEDHN
CC#CCN1CCC(CNC(=O)Cc2c(C)cc(C)cc2C)CC1	ZINC001224326811	1375064941	/nfs/dbraw/zinc/06/49/41/1375064941.db2.gz	UTDHLNQYUNFKLG-UHFFFAOYSA-N	0	3	326.484	3.006	20	30		EGEDHN
C[C@@H]1CC[C@@H](NC(=O)C#CC(C)(C)C)CN1CCc1cccs1	ZINC001132039323	1375111904	/nfs/dbraw/zinc/11/19/04/1375111904.db2.gz	YGZMSNKCQFZMTB-HZPDHXFCSA-N	0	3	332.513	3.309	20	30		EGEDHN
C[C@H]1CC[C@H](NC(=O)C#CC2CC2)CN1Cc1cccc2cccnc21	ZINC001132047403	1375115743	/nfs/dbraw/zinc/11/57/43/1375115743.db2.gz	XBHQRCUQZZZMGM-JXFKEZNVSA-N	0	3	347.462	3.117	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COCc2ccc(C)cc2)CC[C@H]1C	ZINC001132082396	1375136823	/nfs/dbraw/zinc/13/68/23/1375136823.db2.gz	GOGXSICELAYZSG-MJGOQNOKSA-N	0	3	330.472	3.057	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H]1CCCC[C@H]1NCc1ncccc1C	ZINC001225752906	1375152082	/nfs/dbraw/zinc/15/20/82/1375152082.db2.gz	SDMKLVBBZGZJEV-QZTJIDSGSA-N	0	3	327.472	3.101	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)COC/C=C\c2ccccc2)CC[C@@H]1C	ZINC001132124055	1375158781	/nfs/dbraw/zinc/15/87/81/1375158781.db2.gz	LYKUCYRVWBJZBY-XHGSAQPOSA-N	0	3	342.483	3.262	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCc2ccc(N(C)C)cc2)CC[C@@H]1C	ZINC001132157489	1375175796	/nfs/dbraw/zinc/17/57/96/1375175796.db2.gz	QAOLZYFCGHYUCD-PKOBYXMFSA-N	0	3	343.515	3.230	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCc2ccc(N(C)C)cc2)CC[C@H]1C	ZINC001132157485	1375176238	/nfs/dbraw/zinc/17/62/38/1375176238.db2.gz	QAOLZYFCGHYUCD-IEBWSBKVSA-N	0	3	343.515	3.230	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCc2nc3ccccc3[nH]2)CC[C@@H]1C	ZINC001132159773	1375177322	/nfs/dbraw/zinc/17/73/22/1375177322.db2.gz	FMYIGKBZKKPYTI-JKSUJKDBSA-N	0	3	340.471	3.041	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCc2cccc(OC)c2)CC[C@H]1C	ZINC001132168977	1375183803	/nfs/dbraw/zinc/18/38/03/1375183803.db2.gz	ITIWUBGOCZUAGH-SJLPKXTDSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=CCCCN1C[C@H](NC(=O)c2ncc(Cl)s2)CC[C@@H]1C	ZINC001132170500	1375186285	/nfs/dbraw/zinc/18/62/85/1375186285.db2.gz	ZKBZMBLCHXVLOB-NWDGAFQWSA-N	0	3	327.881	3.345	20	30		EGEDHN
C[C@@H](N[C@@H]1CCCC[C@H]1NC(=O)C#CC1CC1)c1cc(F)ccc1F	ZINC001226133386	1375208623	/nfs/dbraw/zinc/20/86/23/1375208623.db2.gz	BGXQQQBNGMVOKN-UPRAQXHNSA-N	0	3	346.421	3.456	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)CCc2cccc(C)c2)CC[C@@H]1C	ZINC001132207494	1375210160	/nfs/dbraw/zinc/21/01/60/1375210160.db2.gz	UGGDPLJYUSBSDR-AZUAARDMSA-N	0	3	344.499	3.099	20	30		EGEDHN
C=CCOCCN1C[C@H](NC(=O)c2cc3ccsc3[nH]2)CC[C@H]1C	ZINC001132207384	1375210292	/nfs/dbraw/zinc/21/02/92/1375210292.db2.gz	UEDJGYAZYIDHMZ-UKRRQHHQSA-N	0	3	347.484	3.015	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H]2CC[C@@H](C)N(CCOCCCC)C2)cc1	ZINC001132214878	1375213689	/nfs/dbraw/zinc/21/36/89/1375213689.db2.gz	OTRVJNUJZMALAO-YLJYHZDGSA-N	0	3	342.483	3.067	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H]1CC[C@H](C)N(Cc2ccc(CO)cc2)C1	ZINC001132330277	1375308981	/nfs/dbraw/zinc/30/89/81/1375308981.db2.gz	DOKZNZDJCOIKKH-QFBILLFUSA-N	0	3	344.499	3.250	20	30		EGEDHN
C=CCOCCCC(=O)NC1CCN(Cc2ccc(CF)cc2)CC1	ZINC001226759864	1375326807	/nfs/dbraw/zinc/32/68/07/1375326807.db2.gz	CYXKOVJOQOSNMG-UHFFFAOYSA-N	0	3	348.462	3.220	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)C(C)(C)CC2CCOCC2)CC[C@@H]1C	ZINC001132397305	1375353222	/nfs/dbraw/zinc/35/32/22/1375353222.db2.gz	RAOGIMVUHBSSJU-FUHWJXTLSA-N	0	3	336.520	3.375	20	30		EGEDHN
CCCCCCCN1C[C@@H](NC(=O)c2c[nH]c(C)cc2=O)CC[C@@H]1C	ZINC001132403504	1375355380	/nfs/dbraw/zinc/35/53/80/1375355380.db2.gz	XWNMXAIYUCUFLZ-IRXDYDNUSA-N	0	3	347.503	3.236	20	30		EGEDHN
C=CCCCCCN1C[C@@H](NC(=O)c2conc2COC)CC[C@@H]1C	ZINC001132420271	1375368468	/nfs/dbraw/zinc/36/84/68/1375368468.db2.gz	PUACLACVOZIZFZ-HOTGVXAUSA-N	0	3	349.475	3.150	20	30		EGEDHN
C#CCCCC(=O)NC1CCN(Cc2cccc(OCCC)c2)CC1	ZINC001227085006	1375386827	/nfs/dbraw/zinc/38/68/27/1375386827.db2.gz	SZIXCFLZSBOVCG-UHFFFAOYSA-N	0	3	342.483	3.360	20	30		EGEDHN
C#CCCCC(=O)NC1CCN(CCOC2CCCCCC2)CC1	ZINC001227108709	1375390953	/nfs/dbraw/zinc/39/09/53/1375390953.db2.gz	VOXDEUKBYWHDAX-UHFFFAOYSA-N	0	3	334.504	3.110	20	30		EGEDHN
C#CCCCC(=O)NC1CCN(CCOc2cccc(Cl)c2)CC1	ZINC001227107416	1375391381	/nfs/dbraw/zinc/39/13/81/1375391381.db2.gz	DGKDUAMYWZFPFD-UHFFFAOYSA-N	0	3	348.874	3.103	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COc2ccc(Cl)cc2)CC[C@H]1C	ZINC001132457927	1375400615	/nfs/dbraw/zinc/40/06/15/1375400615.db2.gz	NKLNZUBOFUOULZ-ZBFHGGJFSA-N	0	3	336.863	3.264	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCc2ccc(OC)cc2)CC[C@H]1C	ZINC001132464556	1375407293	/nfs/dbraw/zinc/40/72/93/1375407293.db2.gz	VXVQFURDZTYSFT-SJLPKXTDSA-N	0	3	330.472	3.173	20	30		EGEDHN
C[C@@H](c1ccccn1)N1CCC[C@@H](Oc2nc3cc(C#N)ccc3[nH]2)C1	ZINC001227218929	1375407750	/nfs/dbraw/zinc/40/77/50/1375407750.db2.gz	JBFNXXLBSHHBJF-GOEBONIOSA-N	0	3	347.422	3.434	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCOCc2ccccc2)CC[C@@H]1C	ZINC001132496615	1375425610	/nfs/dbraw/zinc/42/56/10/1375425610.db2.gz	LTFNSEPBWYMRFM-PKOBYXMFSA-N	0	3	330.472	3.139	20	30		EGEDHN
C=C(C)CN1C[C@@H](NC(=O)COc2cc(C)ccc2C)CC[C@H]1C	ZINC001132498995	1375426573	/nfs/dbraw/zinc/42/65/73/1375426573.db2.gz	ACSNERDQSZBDNP-MSOLQXFVSA-N	0	3	330.472	3.227	20	30		EGEDHN
C=C(C)CN1C[C@H](NC(=O)CCOc2cccc(C)c2)CC[C@@H]1C	ZINC001132500506	1375427271	/nfs/dbraw/zinc/42/72/71/1375427271.db2.gz	PCJNTTROUBLEKK-ZWKOTPCHSA-N	0	3	330.472	3.309	20	30		EGEDHN
C=CCN1C[C@@H](NC(=O)CCc2cccc(OCC)c2)CC[C@@H]1C	ZINC001132525190	1375441970	/nfs/dbraw/zinc/44/19/70/1375441970.db2.gz	ORIJETFRVOFSAD-WMZOPIPTSA-N	0	3	330.472	3.173	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)NCCNCc1csc(Br)c1	ZINC001132577473	1375473717	/nfs/dbraw/zinc/47/37/17/1375473717.db2.gz	WFBORLRUDJXBEL-GHMZBOCLSA-N	0	3	345.306	3.175	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H]1CCCC[C@H]1NCc1cc(OC)ccn1	ZINC001228111391	1375517786	/nfs/dbraw/zinc/51/77/86/1375517786.db2.gz	ARZVJTOMTOUJAK-KFKAGJAMSA-N	0	3	345.487	3.210	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H]1CCCC[C@H]1NCc1cc(OC)ccn1	ZINC001228111390	1375518316	/nfs/dbraw/zinc/51/83/16/1375518316.db2.gz	ARZVJTOMTOUJAK-ATZDWAIDSA-N	0	3	345.487	3.210	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](C)[C@H](CNCc2cc(F)ccc2C#N)C1	ZINC001132696239	1375518794	/nfs/dbraw/zinc/51/87/94/1375518794.db2.gz	IJCGILVGXOOUCW-MAUKXSAKSA-N	0	3	343.446	3.238	20	30		EGEDHN
C=CCCC(=O)N1CC[C@H](C)[C@H](CNCc2ccccc2C#N)C1	ZINC001132698012	1375519850	/nfs/dbraw/zinc/51/98/50/1375519850.db2.gz	VMJZNBGQDPLGPI-QFBILLFUSA-N	0	3	325.456	3.099	20	30		EGEDHN
CC/C=C(\C)C(=O)N1CC[C@H](C)[C@@H](CNCc2ccccc2C#N)C1	ZINC001132697957	1375520255	/nfs/dbraw/zinc/52/02/55/1375520255.db2.gz	UKEJGCXIZAXALD-SNFRUMJLSA-N	0	3	339.483	3.489	20	30		EGEDHN
CCOc1cc(C#N)c(Br)cc1O[C@H]1CCN(CC)C1	ZINC001228459316	1375576325	/nfs/dbraw/zinc/57/63/25/1375576325.db2.gz	ZDWSWLXIKDLAOU-LBPRGKRZSA-N	0	3	339.233	3.192	20	30		EGEDHN
Cc1nc(CNC[C@H]2CN(C(=O)C#CC(C)(C)C)CC[C@H]2C)cs1	ZINC001132831319	1375588868	/nfs/dbraw/zinc/58/88/68/1375588868.db2.gz	MXVRHTISAFSODR-ZBFHGGJFSA-N	0	3	347.528	3.075	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H](C)[C@H](CNCc2cc(C3CC3)no2)C1	ZINC001132866148	1375610053	/nfs/dbraw/zinc/61/00/53/1375610053.db2.gz	WNRVSYCDDWBRBH-DOTOQJQBSA-N	0	3	345.487	3.483	20	30		EGEDHN
CC#CCCCC(=O)NC1CCN(CCOc2cccc(C)c2)CC1	ZINC001228712205	1375649275	/nfs/dbraw/zinc/64/92/75/1375649275.db2.gz	LRNFABHARIYMDR-UHFFFAOYSA-N	0	3	342.483	3.148	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NC1CCN(CCOc2cccc(F)c2)CC1	ZINC001228794772	1375679623	/nfs/dbraw/zinc/67/96/23/1375679623.db2.gz	LXRKVRFWMWAQKZ-MRXNPFEDSA-N	0	3	348.462	3.387	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)NC1CCN(C[C@@H](O)c2ccc(F)cc2)CC1	ZINC001228810359	1375685311	/nfs/dbraw/zinc/68/53/11/1375685311.db2.gz	TXNCMUUAZYYDIA-HNAYVOBHSA-N	0	3	348.462	3.042	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](C)[C@@H](CNCc3nccs3)C2)CCC1	ZINC001133104421	1375776757	/nfs/dbraw/zinc/77/67/57/1375776757.db2.gz	DBMSTPYQLOCXHO-HOTGVXAUSA-N	0	3	347.528	3.464	20	30		EGEDHN
CC#CCCCC(=O)N1CC[C@H]2CN(Cc3ccc(CF)cc3)C[C@H]21	ZINC001188902956	1388405420	/nfs/dbraw/zinc/40/54/20/1388405420.db2.gz	CUBAKXJLMUUFJZ-VQTJNVASSA-N	0	3	342.458	3.382	20	30		EGEDHN
Cc1cc(Cl)ccc1C(=O)NCCNCc1ccc(F)c(C#N)c1	ZINC001133248920	1375869354	/nfs/dbraw/zinc/86/93/54/1375869354.db2.gz	QQLBYZXHGHJHNT-UHFFFAOYSA-N	0	3	345.805	3.179	20	30		EGEDHN
C=C1CCC(C(=O)NCCN[C@H]2CCc3c2cc(F)cc3F)CC1	ZINC001133365461	1375947920	/nfs/dbraw/zinc/94/79/20/1375947920.db2.gz	RUOPURGWNCXSFC-SFHVURJKSA-N	0	3	334.410	3.404	20	30		EGEDHN
CC[C@@H](F)CNCCN(Cc1cccc(Cl)c1)C(=O)[C@@H](C)C#N	ZINC001133392653	1375976569	/nfs/dbraw/zinc/97/65/69/1375976569.db2.gz	HLWUACRQECPXDE-XJKSGUPXSA-N	0	3	339.842	3.166	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)C1=CCCC1	ZINC001133392694	1375978643	/nfs/dbraw/zinc/97/86/43/1375978643.db2.gz	JJRPFGCEMFQBHE-UHFFFAOYSA-N	0	3	330.859	3.392	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)[C@]12C[C@H]1CCC2	ZINC001133401354	1375984879	/nfs/dbraw/zinc/98/48/79/1375984879.db2.gz	BFZOLRGKPPVVLL-YLJYHZDGSA-N	0	3	344.886	3.472	20	30		EGEDHN
CC#CCNCCN(Cc1cccc(Cl)c1)C(=O)c1cc(F)c[nH]1	ZINC001133401372	1375985496	/nfs/dbraw/zinc/98/54/96/1375985496.db2.gz	CFCUVDWXGXXZDR-UHFFFAOYSA-N	0	3	347.821	3.063	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C/C=C(/C)C=C	ZINC001133401813	1375986666	/nfs/dbraw/zinc/98/66/66/1375986666.db2.gz	OOGNKNUSDAZVLY-SXGWCWSVSA-N	0	3	330.859	3.414	20	30		EGEDHN
C#CCNCCN(Cc1cccc(Cl)c1)C(=O)C1(CC)CCC1	ZINC001133403863	1375988825	/nfs/dbraw/zinc/98/88/25/1375988825.db2.gz	NKGJMSFGQJQGGI-UHFFFAOYSA-N	0	3	332.875	3.472	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NC1CCN([C@H](C)c2ccc(F)cc2)CC1	ZINC001230415817	1376023384	/nfs/dbraw/zinc/02/33/84/1376023384.db2.gz	YXGURTILONJQGC-HUUCEWRRSA-N	0	3	334.435	3.058	20	30		EGEDHN
C#CCCN(CCCNC(=O)C(C)(C)C(C)(C)C)Cc1cccnc1	ZINC001230813693	1376156821	/nfs/dbraw/zinc/15/68/21/1376156821.db2.gz	BNKGGJFPEDFADR-UHFFFAOYSA-N	0	3	343.515	3.486	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCCN(CC[C@@H](C)F)Cc2cccnc2)C1	ZINC001230840659	1376165280	/nfs/dbraw/zinc/16/52/80/1376165280.db2.gz	DGSNWLLAYONWQD-QGZVFWFLSA-N	0	3	347.478	3.494	20	30		EGEDHN
C=C(C)CN(CCCNC(=O)[C@@H]1C[C@H]1C1CC1)Cc1cccnc1	ZINC001230868172	1376169893	/nfs/dbraw/zinc/16/98/93/1376169893.db2.gz	SPGUPXRMFRXVJO-RBUKOAKNSA-N	0	3	327.472	3.012	20	30		EGEDHN
C#CCCN(CCCNC(=O)[C@@H](C)CC(C)C)Cc1cccnc1	ZINC001230882045	1376176748	/nfs/dbraw/zinc/17/67/48/1376176748.db2.gz	MCMPNQWODULPAR-SFHVURJKSA-N	0	3	329.488	3.095	20	30		EGEDHN
C#CCCN(CCCNC(=O)C[C@@H](C)C(C)(C)C)Cc1cccnc1	ZINC001230912036	1376182426	/nfs/dbraw/zinc/18/24/26/1376182426.db2.gz	VBBHLPDEAIELRB-GOSISDBHSA-N	0	3	343.515	3.486	20	30		EGEDHN
Cc1ccc2ccccc2c1CN1CC[C@H]1CN(C)C(=O)[C@H](C)C#N	ZINC001231284791	1376221651	/nfs/dbraw/zinc/22/16/51/1376221651.db2.gz	WKGCGHIRRANOIJ-AEFFLSMTSA-N	0	3	335.451	3.341	20	30		EGEDHN
C=CCOCC(=O)N[C@@H](C)C[C@@H](C)NCc1c(F)cccc1Cl	ZINC001133908811	1376259720	/nfs/dbraw/zinc/25/97/20/1376259720.db2.gz	CGJCGJDEUALWDC-OLZOCXBDSA-N	0	3	342.842	3.055	20	30		EGEDHN
COCCCOc1ccc(CN2CCC(S)CC2)cc1OC	ZINC001231544790	1376259823	/nfs/dbraw/zinc/25/98/23/1376259823.db2.gz	WYYFGILUNNKARP-UHFFFAOYSA-N	0	3	325.474	3.005	20	30		EGEDHN
C=CCOc1cccc(CN2CC[C@H](Oc3cc(OC)ccn3)C2)c1	ZINC001231624736	1376284319	/nfs/dbraw/zinc/28/43/19/1376284319.db2.gz	LHVSWNMDVUYLBJ-IBGZPJMESA-N	0	3	340.423	3.308	20	30		EGEDHN
CN(CCC#N)c1ccc(CN2CCc3cc(CO)ccc3C2)cc1	ZINC001231817283	1376320528	/nfs/dbraw/zinc/32/05/28/1376320528.db2.gz	YLRKBJMSCCQRJX-UHFFFAOYSA-N	0	3	335.451	3.087	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](C)C[C@@H](C)NCc2ccccc2C#N)oc1C	ZINC001134089309	1376362848	/nfs/dbraw/zinc/36/28/48/1376362848.db2.gz	DGTWILREOGSIQZ-HUUCEWRRSA-N	0	3	339.439	3.455	20	30		EGEDHN
C=CCN1C(=O)CCC[C@@]12CCCN(Cc1cc(C)nc(C)c1)C2	ZINC001231997059	1376376011	/nfs/dbraw/zinc/37/60/11/1376376011.db2.gz	KKPAKNUJXIIMOC-FQEVSTJZSA-N	0	3	327.472	3.232	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H](C)C[C@H](C)NCc1cc(C2CC2)no1	ZINC001134119315	1376377694	/nfs/dbraw/zinc/37/76/94/1376377694.db2.gz	PFQODQIXGVESHP-GJZGRUSLSA-N	0	3	331.460	3.119	20	30		EGEDHN
C#CCCCCC(=O)N[C@@H](C)C[C@@H](C)NCc1oc(CC)nc1C	ZINC001134119598	1376378153	/nfs/dbraw/zinc/37/81/53/1376378153.db2.gz	UKEZHJILJJTVQN-CABCVRRESA-N	0	3	333.476	3.112	20	30		EGEDHN
C#CCCCC(=O)N[C@H](C)C[C@H](C)NCc1oc(CCC)nc1C	ZINC001134201271	1376415187	/nfs/dbraw/zinc/41/51/87/1376415187.db2.gz	NCQFUUNWZNPJPR-LSDHHAIUSA-N	0	3	333.476	3.112	20	30		EGEDHN
C=C(Br)CN[C@@H](C)C[C@H](C)NC(=O)c1cc(C)cs1	ZINC001134281021	1376455005	/nfs/dbraw/zinc/45/50/05/1376455005.db2.gz	VKYYHKZRVXMXFC-RYUDHWBXSA-N	0	3	345.306	3.452	20	30		EGEDHN
CCCCCCC[NH2+][C@H](C)C[C@@H](C)NC(=O)c1cccc2n[n-]nc21	ZINC001134419754	1376525271	/nfs/dbraw/zinc/52/52/71/1376525271.db2.gz	ZTDZOOBJRFIVFS-HUUCEWRRSA-N	0	3	345.491	3.415	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@H](C)C[C@H](C)NCc1nccs1	ZINC001134457391	1376548977	/nfs/dbraw/zinc/54/89/77/1376548977.db2.gz	NHYJOBCXJBAMPB-WDEREUQCSA-N	0	3	329.897	3.295	20	30		EGEDHN
C=C(Cl)C(C)(C)C(=O)N[C@@H](C)C[C@H](C)NCc1cc(C)no1	ZINC001134457946	1376549238	/nfs/dbraw/zinc/54/92/38/1376549238.db2.gz	WFGYIICVEYOCPY-QWRGUYRKSA-N	0	3	327.856	3.135	20	30		EGEDHN
Cc1cccc([C@H](C)C(=O)NCCNCc2ccc(F)c(C#N)c2)c1	ZINC001134468885	1376553575	/nfs/dbraw/zinc/55/35/75/1376553575.db2.gz	RMNGTFCQALNMBL-HNNXBMFYSA-N	0	3	339.414	3.015	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H](C)C[C@@H](C)NCc2nc(C)cs2)CCC1	ZINC001134587188	1376610318	/nfs/dbraw/zinc/61/03/18/1376610318.db2.gz	BERTYWSEEXXIRM-KGLIPLIRSA-N	0	3	333.501	3.018	20	30		EGEDHN
C#CCC1(C(=O)N[C@@H](C)C[C@H](C)NCc2ncc(C)s2)CCC1	ZINC001134594182	1376617207	/nfs/dbraw/zinc/61/72/07/1376617207.db2.gz	YBASVZNXTUPOPV-KBPBESRZSA-N	0	3	333.501	3.018	20	30		EGEDHN
C=CCn1cccc1C(=O)N[C@@H](C)C[C@H](C)NCc1nc(C)cs1	ZINC001134608315	1376623623	/nfs/dbraw/zinc/62/36/23/1376623623.db2.gz	UNAVSSRXGYKHDV-KBPBESRZSA-N	0	3	346.500	3.126	20	30		EGEDHN
C=CCOCCCC(=O)N(C)C[C@@H]1CCN1CCc1ccc(C)cc1	ZINC001233491666	1376654283	/nfs/dbraw/zinc/65/42/83/1376654283.db2.gz	YQTSXOYTDDASNS-FQEVSTJZSA-N	0	3	344.499	3.053	20	30		EGEDHN
CN(C[C@H]1CCN1CC/C=C/c1ccccc1)C(=O)c1c[nH]c(C#N)c1	ZINC001233743057	1376709364	/nfs/dbraw/zinc/70/93/64/1376709364.db2.gz	URGPBXOFEGTQKN-MVHVFESUSA-N	0	3	348.450	3.136	20	30		EGEDHN
C#CCCCC(=O)N(C)C[C@H]1CCN1CCCc1ccccc1C	ZINC001233948381	1376742256	/nfs/dbraw/zinc/74/22/56/1376742256.db2.gz	VKSDPIUKIQFMJY-HXUWFJFHSA-N	0	3	326.484	3.264	20	30		EGEDHN
C#CCCCC(=O)N(C)C[C@H]1CCN1CCc1ccccc1CC	ZINC001233948526	1376742379	/nfs/dbraw/zinc/74/23/79/1376742379.db2.gz	XDRVBLZBYHJWKM-HXUWFJFHSA-N	0	3	326.484	3.128	20	30		EGEDHN
CN(C[C@H]1CCN1CCCc1ccc(Cl)cc1)C(=O)C#CC1CC1	ZINC001234196404	1376784525	/nfs/dbraw/zinc/78/45/25/1376784525.db2.gz	TUDWSXWRIWHNJF-LJQANCHMSA-N	0	3	344.886	3.219	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N(C)C[C@H]2CCN2CCCC=C)cc1	ZINC001234255934	1376792768	/nfs/dbraw/zinc/79/27/68/1376792768.db2.gz	SLEMREQQVZMCPU-LJQANCHMSA-N	0	3	340.467	3.201	20	30		EGEDHN
C#CCCOc1ccc(C(=O)N(C)C[C@@H]2CCN2CCCC)cc1	ZINC001234255704	1376793588	/nfs/dbraw/zinc/79/35/88/1376793588.db2.gz	PPWFJQIBHIQUKS-SFHVURJKSA-N	0	3	328.456	3.035	20	30		EGEDHN
C=CCCCCCN1CC[C@H]1CN(C)C(=O)[C@H]1CCCc2cn[nH]c21	ZINC001234324129	1376811482	/nfs/dbraw/zinc/81/14/82/1376811482.db2.gz	YKNQQEBOJLDQIS-ROUUACIJSA-N	0	3	344.503	3.109	20	30		EGEDHN
C=CCCCN1CC[C@@H]1CN(C)C(=O)c1cc(Cl)c(Cl)n1C	ZINC001235050692	1376842106	/nfs/dbraw/zinc/84/21/06/1376842106.db2.gz	GYZDGUXQUZLVRQ-GFCCVEGCSA-N	0	3	344.286	3.444	20	30		EGEDHN
C=CCCCN1CC[C@@H]1CN(C)C(=O)[C@@](C)(OC)c1ccccc1F	ZINC001235125075	1376853749	/nfs/dbraw/zinc/85/37/49/1376853749.db2.gz	VCDCVUCRYMKXKL-UZLBHIALSA-N	0	3	348.462	3.186	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@H](C)C[C@H](C)NCc1nccn1C(F)F	ZINC001135185506	1376960181	/nfs/dbraw/zinc/96/01/81/1376960181.db2.gz	YYXSLMUPHCKOAX-QWHCGFSZSA-N	0	3	342.434	3.253	20	30		EGEDHN
CN1CCC[C@H]2CN(C(=O)c3ccc(C#C[Si](C)(C)C)cc3)C[C@@H]21	ZINC001189169970	1388471957	/nfs/dbraw/zinc/47/19/57/1388471957.db2.gz	PEBMVFWWMLCISL-OALUTQOASA-N	0	3	340.543	3.082	20	30		EGEDHN
CC1(C#N)CC[NH+](Cc2ccc(OCC(F)(F)F)cc2[O-])CC1	ZINC001237059979	1376974228	/nfs/dbraw/zinc/97/42/28/1376974228.db2.gz	RXDITEZYEKRFOQ-UHFFFAOYSA-N	0	3	328.334	3.459	20	30		EGEDHN
CC1(C#N)CCN(Cc2ccc(OCC(F)(F)F)cc2O)CC1	ZINC001237059979	1376974232	/nfs/dbraw/zinc/97/42/32/1376974232.db2.gz	RXDITEZYEKRFOQ-UHFFFAOYSA-N	0	3	328.334	3.459	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H](C)C[C@@H](C)NCc1ccncc1Cl	ZINC001135234508	1376991112	/nfs/dbraw/zinc/99/11/12/1376991112.db2.gz	AUBIPRUUAUWZBA-CABCVRRESA-N	0	3	335.879	3.302	20	30		EGEDHN
C=CCCC1(C(=O)N[C@H](C)C[C@H](C)NCc2ccn(CC)n2)CC1	ZINC001135381990	1377065425	/nfs/dbraw/zinc/06/54/25/1377065425.db2.gz	CABHVRGRXDQQLX-JKSUJKDBSA-N	0	3	332.492	3.022	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@@H](C)C[C@H](C)NCc2nc(C)c(C)s2)C1	ZINC001135418504	1377084758	/nfs/dbraw/zinc/08/47/58/1377084758.db2.gz	FQVVCQYQEMBFFA-STQMWFEESA-N	0	3	335.517	3.489	20	30		EGEDHN
C=C1CC(C)(C(=O)N[C@H](C)C[C@@H](C)NCc2nc(C)sc2C)C1	ZINC001135426982	1377090894	/nfs/dbraw/zinc/09/08/94/1377090894.db2.gz	KEIPTZWKJQMQQV-CHWSQXEVSA-N	0	3	335.517	3.489	20	30		EGEDHN
Cc1cc(C(=O)N[C@H](C)C[C@H](C)NCc2ccccc2C#N)c(C)[nH]1	ZINC001135561551	1377145387	/nfs/dbraw/zinc/14/53/87/1377145387.db2.gz	SMULNLWBYXFEQA-UONOGXRCSA-N	0	3	338.455	3.190	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H](C)C[C@H](C)NCc1nccn1C(F)F	ZINC001135562375	1377146019	/nfs/dbraw/zinc/14/60/19/1377146019.db2.gz	YIDUKPONMZNCRT-STQMWFEESA-N	0	3	342.434	3.253	20	30		EGEDHN
C=CCOCCN1C[C@@H]2CCN(C(=O)C[C@H](C)CC(C)(C)C)[C@@H]2C1	ZINC001189230678	1388490622	/nfs/dbraw/zinc/49/06/22/1388490622.db2.gz	VFCNVCZMKRBNGN-OKZBNKHCSA-N	0	3	336.520	3.184	20	30		EGEDHN
C=CCOC[C@@]12CCCO[C@H]1CCN(Cc1cnn(C(C)C)c1)C2	ZINC001137076570	1377473954	/nfs/dbraw/zinc/47/39/54/1377473954.db2.gz	KTSVYDWGIMFJCJ-OALUTQOASA-N	0	3	333.476	3.038	20	30		EGEDHN
CC(C)c1noc([C@@H]2CCCN(Cc3ccc(OCC#N)cc3)C2)n1	ZINC001137120284	1377481417	/nfs/dbraw/zinc/48/14/17/1377481417.db2.gz	AVHPFRIGILBLKS-MRXNPFEDSA-N	0	3	340.427	3.475	20	30		EGEDHN
N#CCOc1ccc(CN2CCC3(CC2)OC(=O)c2ccccc23)cc1	ZINC001137119379	1377481558	/nfs/dbraw/zinc/48/15/58/1377481558.db2.gz	KNQCJYGBFNRVPH-UHFFFAOYSA-N	0	3	348.402	3.251	20	30		EGEDHN
C=CCOC(=O)N1CCC[C@@]2(CCN(Cc3[nH]c(C)cc3C)C2)C1	ZINC001137323088	1377518880	/nfs/dbraw/zinc/51/88/80/1377518880.db2.gz	XKGJURCGFOBKFJ-IBGZPJMESA-N	0	3	331.460	3.242	20	30		EGEDHN
O=C1C=C2CN(Cc3cccc(F)c3Br)CCC2S1	ZINC001137718894	1377604686	/nfs/dbraw/zinc/60/46/86/1377604686.db2.gz	XHWXOJAHQUXKSA-LBPRGKRZSA-N	0	3	342.233	3.362	20	30		EGEDHN
C#CCOc1ccc(CN2CCC(O)(c3ccc(F)cc3)CC2)cc1	ZINC001138559355	1377742084	/nfs/dbraw/zinc/74/20/84/1377742084.db2.gz	SBSZVMHWPRZBDB-UHFFFAOYSA-N	0	3	339.410	3.321	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@@H](F)[C@@](O)(C(F)(F)F)CC2)c1[O-]	ZINC001138625917	1377755760	/nfs/dbraw/zinc/75/57/60/1377755760.db2.gz	WYJQASJOCTTXQU-GDBMZVCRSA-N	0	3	347.352	3.348	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@@H](F)[C@@](O)(C(F)(F)F)CC2)c1[O-]	ZINC001138625917	1377755763	/nfs/dbraw/zinc/75/57/63/1377755763.db2.gz	WYJQASJOCTTXQU-GDBMZVCRSA-N	0	3	347.352	3.348	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CC[C@@]3(C2)c2ccccc2N(C)C3=O)c1[O-]	ZINC001138629272	1377756707	/nfs/dbraw/zinc/75/67/07/1377756707.db2.gz	SSQMHVJWXBHUPX-JOCHJYFZSA-N	0	3	348.446	3.241	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CC[C@@]3(C2)c2ccccc2N(C)C3=O)c1[O-]	ZINC001138629272	1377756710	/nfs/dbraw/zinc/75/67/10/1377756710.db2.gz	SSQMHVJWXBHUPX-JOCHJYFZSA-N	0	3	348.446	3.241	20	30		EGEDHN
C=CCO[C@@H]1CO[C@]2(C1)CCC[N@@H+](Cc1cccc(CC=C)c1[O-])C2	ZINC001138628844	1377756751	/nfs/dbraw/zinc/75/67/51/1377756751.db2.gz	HKJBGESBXJWDAT-FPOVZHCZSA-N	0	3	343.467	3.447	20	30		EGEDHN
C=CCO[C@@H]1CO[C@]2(C1)CCC[N@H+](Cc1cccc(CC=C)c1[O-])C2	ZINC001138628844	1377756753	/nfs/dbraw/zinc/75/67/53/1377756753.db2.gz	HKJBGESBXJWDAT-FPOVZHCZSA-N	0	3	343.467	3.447	20	30		EGEDHN
C=CCc1cccc(C[NH+]2CCC3(CCCCN3C(C)=O)CC2)c1[O-]	ZINC001138629088	1377756758	/nfs/dbraw/zinc/75/67/58/1377756758.db2.gz	NKYCATZLZZADBG-UHFFFAOYSA-N	0	3	342.483	3.488	20	30		EGEDHN
C=CCc1cccc(C[N@@H+]2CCCC[C@H]2C(=O)N2CCCC2)c1[O-]	ZINC001138629091	1377756774	/nfs/dbraw/zinc/75/67/74/1377756774.db2.gz	NOFXUIWRIFSOPY-SFHVURJKSA-N	0	3	328.456	3.098	20	30		EGEDHN
C=CCc1cccc(C[N@H+]2CCCC[C@H]2C(=O)N2CCCC2)c1[O-]	ZINC001138629091	1377756777	/nfs/dbraw/zinc/75/67/77/1377756777.db2.gz	NOFXUIWRIFSOPY-SFHVURJKSA-N	0	3	328.456	3.098	20	30		EGEDHN
C=CCc1cccc(CN2CCc3c(cccc3C(=O)OC)C2)c1O	ZINC001138629689	1377756851	/nfs/dbraw/zinc/75/68/51/1377756851.db2.gz	FOFYMWRCWMGUDK-UHFFFAOYSA-N	0	3	337.419	3.466	20	30		EGEDHN
C=C(C)COc1ccccc1CN1CCC2(C[C@H]2C(=O)N(C)C)CC1	ZINC001138664662	1377764961	/nfs/dbraw/zinc/76/49/61/1377764961.db2.gz	UGPRQWAQIBZCQZ-SFHVURJKSA-N	0	3	342.483	3.332	20	30		EGEDHN
C=CCOc1ccccc1CN1CCC[C@]2(CCN(CC=C)C2=O)C1	ZINC001139027911	1377819103	/nfs/dbraw/zinc/81/91/03/1377819103.db2.gz	FSACVRIQLROMTB-NRFANRHFSA-N	0	3	340.467	3.252	20	30		EGEDHN
C=CCOC(=O)N[C@@H]1CCCN(Cc2c[nH]c3cccc(C)c23)C1	ZINC001139198210	1377848749	/nfs/dbraw/zinc/84/87/49/1377848749.db2.gz	KWZHMEIBUYBENK-MRXNPFEDSA-N	0	3	327.428	3.353	20	30		EGEDHN
COc1ccnc(O[C@@H]2CCN(Cc3c[nH]c4c3cccc4C#N)C2)c1	ZINC001139707953	1377939220	/nfs/dbraw/zinc/93/92/20/1377939220.db2.gz	ZROGGHWPFSMMAB-QGZVFWFLSA-N	0	3	348.406	3.096	20	30		EGEDHN
Cc1ccc(CN2CC[C@]3(CCCN3C(=O)C(C)C)C2)cc1C#N	ZINC001139724505	1377941319	/nfs/dbraw/zinc/94/13/19/1377941319.db2.gz	UPGXNGKJZZLNRY-HXUWFJFHSA-N	0	3	325.456	3.090	20	30		EGEDHN
C=CCOC(=O)N1CCC2(CCCN(Cc3ccc(C)nc3)C2)CC1	ZINC001139927374	1377977894	/nfs/dbraw/zinc/97/78/94/1377977894.db2.gz	WONOBCJJCNXOQO-UHFFFAOYSA-N	0	3	343.471	3.391	20	30		EGEDHN
Cc1cc(OC2CCN(Cc3c[nH]c4ccc(C#N)cc34)CC2)ncn1	ZINC001140116566	1378011934	/nfs/dbraw/zinc/01/19/34/1378011934.db2.gz	AZLYAFGIKJBJRT-UHFFFAOYSA-N	0	3	347.422	3.181	20	30		EGEDHN
COc1ccc(CCN(Cc2ccc(C#N)cc2F)C[C@@H](C)O)cc1	ZINC001140135287	1378016583	/nfs/dbraw/zinc/01/65/83/1378016583.db2.gz	ZMNAYOTWUFTFTB-OAHLLOKOSA-N	0	3	342.414	3.131	20	30		EGEDHN
Cc1ccc(C)c(CN2CCN(c3ccc(C#N)cc3F)CC2)c1O	ZINC001140184548	1378028048	/nfs/dbraw/zinc/02/80/48/1378028048.db2.gz	YZBDFUXSUFPGRC-UHFFFAOYSA-N	0	3	339.414	3.342	20	30		EGEDHN
O=C1C=C2CN(Cc3ccc(Br)c(F)c3)CCC2S1	ZINC001140210437	1378032389	/nfs/dbraw/zinc/03/23/89/1378032389.db2.gz	CQBQDSKIGXJHKQ-ZDUSSCGKSA-N	0	3	342.233	3.362	20	30		EGEDHN
Cn1cnc2cc(CN3CCC[C@@H](Oc4ccccc4C#N)C3)ccc21	ZINC001140508525	1378076112	/nfs/dbraw/zinc/07/61/12/1378076112.db2.gz	CUSFMZRKGKDAAC-GOSISDBHSA-N	0	3	346.434	3.488	20	30		EGEDHN
C=C(C)CN1C(=O)CC[C@@H]2[C@H]1CCN2Cc1ccc2ccccc2n1	ZINC001273006728	1378085086	/nfs/dbraw/zinc/08/50/86/1378085086.db2.gz	VPSPDQKZPQJMRX-WOJBJXKFSA-N	0	3	335.451	3.376	20	30		EGEDHN
C#CCN1CC[C@]2(CCCN(Cc3cccc(Cl)c3F)CC2)C1=O	ZINC001273285290	1378094353	/nfs/dbraw/zinc/09/43/53/1378094353.db2.gz	PJKLIFIZPHNYNJ-LJQANCHMSA-N	0	3	348.849	3.317	20	30		EGEDHN
C=CCN1CC[C@]2(CCCN(Cc3c(F)cccc3OC)CC2)C1=O	ZINC001273323273	1378098000	/nfs/dbraw/zinc/09/80/00/1378098000.db2.gz	XVSWVPYNXBATMD-HXUWFJFHSA-N	0	3	346.446	3.225	20	30		EGEDHN
C=CCOC(=O)N1CC2(C1)CCN(Cc1cc(Cl)ccc1N)CC2	ZINC001140716424	1378123111	/nfs/dbraw/zinc/12/31/11/1378123111.db2.gz	NKZNVNIUSCDMSZ-UHFFFAOYSA-N	0	3	349.862	3.143	20	30		EGEDHN
N#Cc1cccc(N2CCC[C@]3(C2)CN(C2CCCC2)CCO3)c1	ZINC001276952983	1378196899	/nfs/dbraw/zinc/19/68/99/1378196899.db2.gz	DJQRHYJOENUKJL-FQEVSTJZSA-N	0	3	325.456	3.172	20	30		EGEDHN
CN1CC2(C1)CCN(C(=O)c1ccc(C#Cc3ccccc3)cc1)CC2	ZINC001278831713	1378289267	/nfs/dbraw/zinc/28/92/67/1378289267.db2.gz	BAZAYHYFTGYGHC-UHFFFAOYSA-N	0	3	344.458	3.254	20	30		EGEDHN
Cc1nc(C(F)(F)F)ccc1CN1CCC2SC(=O)C=C2C1	ZINC001141426343	1378323684	/nfs/dbraw/zinc/32/36/84/1378323684.db2.gz	ACUHEDMTOKXTIX-LBPRGKRZSA-N	0	3	328.359	3.183	20	30		EGEDHN
CCCCN1CCN(Cc2cc(C#N)ccc2Br)CC1	ZINC001141659433	1378359242	/nfs/dbraw/zinc/35/92/42/1378359242.db2.gz	NTCATSCCUPUXSP-UHFFFAOYSA-N	0	3	336.277	3.238	20	30		EGEDHN
CN(Cc1cncc(C#N)c1)C[C@@H]1CCCN(C(=O)OC(C)(C)C)C1	ZINC001144083683	1378680866	/nfs/dbraw/zinc/68/08/66/1378680866.db2.gz	OJRXAAUCCJCNRY-HNNXBMFYSA-N	0	3	344.459	3.032	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C[C@@H](C)NCc2ccn(C)n2)CCCCC1	ZINC001146502251	1378853363	/nfs/dbraw/zinc/85/33/63/1378853363.db2.gz	BUSKVEQLJYVWHT-IAGOWNOFSA-N	0	3	346.519	3.320	20	30		EGEDHN
C=CCC1(C(=O)N[C@H](C)C[C@H](C)NCc2ccn(CC)n2)CCCC1	ZINC001146823442	1378929116	/nfs/dbraw/zinc/92/91/16/1378929116.db2.gz	ZZEOKMKXXUCSLL-DLBZAZTESA-N	0	3	346.519	3.412	20	30		EGEDHN
C=C(Br)CNC[C@H](C1CC1)N(C)C(=O)CC(C)(C)C	ZINC001283482639	1378978865	/nfs/dbraw/zinc/97/88/65/1378978865.db2.gz	KTAWCQLTEJWLLJ-CYBMUJFWSA-N	0	3	331.298	3.158	20	30		EGEDHN
C=CCCC(=O)N1CC2(C1)CCN(CC[C@H]1CC1(Cl)Cl)C2	ZINC001147186868	1378984516	/nfs/dbraw/zinc/98/45/16/1378984516.db2.gz	DBXNGQMSBUQNGP-ZDUSSCGKSA-N	0	3	331.287	3.071	20	30		EGEDHN
CC[C@@H](C)CC(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001147450755	1379023058	/nfs/dbraw/zinc/02/30/58/1379023058.db2.gz	LLHXNIZJUXQABT-MRXNPFEDSA-N	0	3	325.456	3.029	20	30		EGEDHN
CC[C@H](C)CC(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001147449800	1379023283	/nfs/dbraw/zinc/02/32/83/1379023283.db2.gz	CMZKTMFYROEVMO-INIZCTEOSA-N	0	3	325.456	3.029	20	30		EGEDHN
CCc1occc1C(=O)N(C)C[C@@H](C)NCc1ccc(F)c(C#N)c1	ZINC001283605669	1379048209	/nfs/dbraw/zinc/04/82/09/1379048209.db2.gz	ICSNUFKLGNDVOQ-CYBMUJFWSA-N	0	3	343.402	3.103	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC2(C1)CCN(CCOc1ccccc1)C2	ZINC001147653092	1379056701	/nfs/dbraw/zinc/05/67/01/1379056701.db2.gz	XWTANSDQHONUPQ-UHFFFAOYSA-N	0	3	342.483	3.202	20	30		EGEDHN
CCC1(C(=O)N(C)C[C@H](C)NCc2ccc(F)c(C#N)c2)CCC1	ZINC001283654667	1379086147	/nfs/dbraw/zinc/08/61/47/1379086147.db2.gz	VWGKFCVHDRVCFQ-AWEZNQCLSA-N	0	3	331.435	3.214	20	30		EGEDHN
C=C[C@@H](C)[C@@H](C)C(=O)N1CC2(C1)CCN(Cc1cccc(C#N)c1)C2	ZINC001148137878	1379123742	/nfs/dbraw/zinc/12/37/42/1379123742.db2.gz	HEUGUIWAOBWZCI-IAGOWNOFSA-N	0	3	337.467	3.051	20	30		EGEDHN
C=CCCCC(=O)N1CC2(C1)CCN(CCO[C@@H]1CCCC[C@@H]1C)C2	ZINC001148180867	1379128458	/nfs/dbraw/zinc/12/84/58/1379128458.db2.gz	FQBIJPNVTPJPIS-RBUKOAKNSA-N	0	3	348.531	3.472	20	30		EGEDHN
CCCC(C)(C)C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001148187834	1379130692	/nfs/dbraw/zinc/13/06/92/1379130692.db2.gz	BXHUIPKTNDNYRL-UHFFFAOYSA-N	0	3	339.483	3.419	20	30		EGEDHN
CCC[C@H](CC)C(=O)N1CC2(C1)CCN(Cc1ccc(C#N)cc1)C2	ZINC001148507383	1379197525	/nfs/dbraw/zinc/19/75/25/1379197525.db2.gz	SVJDDDOGWMXWQA-IBGZPJMESA-N	0	3	339.483	3.419	20	30		EGEDHN
CCCCCCCCCCC(=O)NCCN[C@H](C)C(=O)NCCC	ZINC001148751821	1379260674	/nfs/dbraw/zinc/26/06/74/1379260674.db2.gz	SJFJPGSBLXJALU-QGZVFWFLSA-N	0	3	341.540	3.138	20	30		EGEDHN
CCCCCCCCCC(=O)NCCN[C@@H](C)C(=O)N[C@@H](C)CC	ZINC001148825868	1379277937	/nfs/dbraw/zinc/27/79/37/1379277937.db2.gz	NEGPNDWAZRJAFI-IRXDYDNUSA-N	0	3	341.540	3.136	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)NC[C@H]1CN(CC2=CCCCC2)CCCO1	ZINC001150247880	1379523214	/nfs/dbraw/zinc/52/32/14/1379523214.db2.gz	RFSPFXYVBCHEKX-AZUAARDMSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=C1CC(C)(C(=O)NC[C@@H]2CN([C@@H](C)c3ccccc3)CCCO2)C1	ZINC001150293339	1379529697	/nfs/dbraw/zinc/52/96/97/1379529697.db2.gz	YBTFVSWKHUWVOU-PKOBYXMFSA-N	0	3	342.483	3.311	20	30		EGEDHN
CCc1cc(C(=O)NCCNCc2ccc(C#N)c(F)c2)sc1C	ZINC001150388058	1379544514	/nfs/dbraw/zinc/54/45/14/1379544514.db2.gz	WPAPDPIUTJWYAR-UHFFFAOYSA-N	0	3	345.443	3.149	20	30		EGEDHN
C=C(C)CN1CCCO[C@@H](CNC(=O)C2(CC(C)C)CCCC2)C1	ZINC001150453291	1379554409	/nfs/dbraw/zinc/55/44/09/1379554409.db2.gz	QEGKWYGAOBTVNL-SFHVURJKSA-N	0	3	336.520	3.376	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)c2c(C)coc2C)CC1	ZINC001151128386	1379664603	/nfs/dbraw/zinc/66/46/03/1379664603.db2.gz	LQSIATBQJORRAT-UHFFFAOYSA-N	0	3	334.460	3.073	20	30		EGEDHN
C=C(C)CN1CCC(CCOC)(NC(=O)C2CC3(CCC3)C2)CC1	ZINC001151259187	1379689602	/nfs/dbraw/zinc/68/96/02/1379689602.db2.gz	GFMUWXWGDPMFQS-UHFFFAOYSA-N	0	3	334.504	3.130	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2ccccc2CC)CC1	ZINC001151275647	1379692196	/nfs/dbraw/zinc/69/21/96/1379692196.db2.gz	UPZRVBLLBXAMDK-UHFFFAOYSA-N	0	3	330.472	3.036	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)c2ccc(CCC)cc2)CC1	ZINC001151281897	1379693070	/nfs/dbraw/zinc/69/30/70/1379693070.db2.gz	SMBPWYIUTJMYMU-UHFFFAOYSA-N	0	3	344.499	3.426	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)[C@@H]2C[C@]2(CC)C(C)C)CC1	ZINC001151381333	1379708466	/nfs/dbraw/zinc/70/84/66/1379708466.db2.gz	NNJKBABXHNLBDZ-FXAWDEMLSA-N	0	3	336.520	3.232	20	30		EGEDHN
C=CCN1CCC(CCOC)(NC(=O)C[C@@H]2CCCC[C@H]2C)CC1	ZINC001151412375	1379714194	/nfs/dbraw/zinc/71/41/94/1379714194.db2.gz	AQWARRISYZQXFO-MSOLQXFVSA-N	0	3	336.520	3.376	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)[C@H]1CC=CCC1	ZINC001151830232	1379789499	/nfs/dbraw/zinc/78/94/99/1379789499.db2.gz	LXNJNHOCIRJLCU-APWZRJJASA-N	0	3	325.456	3.241	20	30		EGEDHN
C=CC[C@@H](C(=O)NCCNCc1cnc(C)s1)c1ccccc1	ZINC001151838365	1379793017	/nfs/dbraw/zinc/79/30/17/1379793017.db2.gz	RAPMORWXIOBECY-QGZVFWFLSA-N	0	3	329.469	3.017	20	30		EGEDHN
CCN(Cc1cccc(C#N)c1)[C@H](C)CNC(=O)c1ccc(Cl)o1	ZINC001151880562	1379809775	/nfs/dbraw/zinc/80/97/75/1379809775.db2.gz	ZBRUCJLNEREPOH-CYBMUJFWSA-N	0	3	345.830	3.445	20	30		EGEDHN
Cc1ccccc1[C@@H](C)C(=O)NCCNCc1ccc(C#N)c(F)c1	ZINC001152017567	1379841142	/nfs/dbraw/zinc/84/11/42/1379841142.db2.gz	NZFCWUATGKDUTN-OAHLLOKOSA-N	0	3	339.414	3.015	20	30		EGEDHN
CC(C)c1ccsc1C(=O)NCCNCc1ccc(C#N)c(F)c1	ZINC001152126493	1379868092	/nfs/dbraw/zinc/86/80/92/1379868092.db2.gz	OGWFNMORQGGNQP-UHFFFAOYSA-N	0	3	345.443	3.402	20	30		EGEDHN
C#CCCCCC(=O)NC[C@@H](C)N(CC)Cc1ccc(C)nc1C	ZINC001152867471	1379988225	/nfs/dbraw/zinc/98/82/25/1379988225.db2.gz	VSHKGWKXWKYUTR-QGZVFWFLSA-N	0	3	329.488	3.219	20	30		EGEDHN
C=C[C@@](C)(O)CC(=O)NC[C@@H](C)N(CC)Cc1cc2ccccc2o1	ZINC001153012165	1380007449	/nfs/dbraw/zinc/00/74/49/1380007449.db2.gz	DZOSCCSIZJHEGA-FOIQADDNSA-N	0	3	344.455	3.087	20	30		EGEDHN
CCN(C[C@@H](OC)c1ccccc1)[C@H](C)CNC(=O)C#CC(C)(C)C	ZINC001153260406	1380046262	/nfs/dbraw/zinc/04/62/62/1380046262.db2.gz	RIDKIOBKZWERBG-IEBWSBKVSA-N	0	3	344.499	3.250	20	30		EGEDHN
C=C(C)[C@H](CC(=O)NC[C@@H](C)N(CC)Cc1ccsc1)OCC	ZINC001153653709	1380110713	/nfs/dbraw/zinc/11/07/13/1380110713.db2.gz	BDJPGFREWGVQLR-WBVHZDCISA-N	0	3	338.517	3.446	20	30		EGEDHN
CC1(C)CCCC[C@@H]1CC(=O)NCCNCc1ccc(C#N)cc1	ZINC001153836531	1380140538	/nfs/dbraw/zinc/14/05/38/1380140538.db2.gz	ASIQFZPMFYBMPO-GOSISDBHSA-N	0	3	327.472	3.371	20	30		EGEDHN
CC1(C)CCCC[C@@H]1CC(=O)NCCNCc1cccc(C#N)c1	ZINC001153836553	1380140711	/nfs/dbraw/zinc/14/07/11/1380140711.db2.gz	BLEIYNHDANDEFD-GOSISDBHSA-N	0	3	327.472	3.371	20	30		EGEDHN
Cc1oc2ccccc2c1CC(=O)NCCNCc1ccc(C#N)cc1	ZINC001153898368	1380151848	/nfs/dbraw/zinc/15/18/48/1380151848.db2.gz	YLHZSDQXIAFVLH-UHFFFAOYSA-N	0	3	347.418	3.061	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)[C@H]1CCc2c1cccc2Cl	ZINC001154355369	1380262940	/nfs/dbraw/zinc/26/29/40/1380262940.db2.gz	FLFDTXLXZIPQLK-PBHICJAKSA-N	0	3	332.875	3.220	20	30		EGEDHN
CC#CCCCC(=O)NC[C@@H](C)N(CC)Cc1ccc(F)c(C#N)c1	ZINC001154719591	1380339762	/nfs/dbraw/zinc/33/97/62/1380339762.db2.gz	IEIBZXFFOLQZLF-MRXNPFEDSA-N	0	3	343.446	3.218	20	30		EGEDHN
CCN(Cc1ccc(C#N)c(F)c1)[C@H](C)CNC(=O)[C@@H](C)C(C)C	ZINC001155580588	1380470472	/nfs/dbraw/zinc/47/04/72/1380470472.db2.gz	DJJGGCIZUTXEMP-CABCVRRESA-N	0	3	333.451	3.316	20	30		EGEDHN
C=CCCC(=O)NCCCNCC(=O)Nc1ccc([C@H](C)CC)cc1	ZINC001155593282	1380470957	/nfs/dbraw/zinc/47/09/57/1380470957.db2.gz	GFNOERHDDIZOLU-MRXNPFEDSA-N	0	3	345.487	3.201	20	30		EGEDHN
C=CCCC(=O)NCCCNCc1csc(-c2ccsc2)n1	ZINC001155601482	1380472118	/nfs/dbraw/zinc/47/21/18/1380472118.db2.gz	CLFYEPFIGKXSIP-UHFFFAOYSA-N	0	3	335.498	3.434	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C1(c2ccccc2C)CCC1	ZINC001156629652	1380601364	/nfs/dbraw/zinc/60/13/64/1380601364.db2.gz	PSJODSLYPBSIRM-GOSISDBHSA-N	0	3	326.484	3.267	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)c1csc2c1CC[C@H](C)C2	ZINC001156751369	1380626370	/nfs/dbraw/zinc/62/63/70/1380626370.db2.gz	SVYDBGDHYDNFJA-LSDHHAIUSA-N	0	3	332.513	3.336	20	30		EGEDHN
CC#CCN(CC)[C@H](C)CNC(=O)C[C@H](C)CCc1ccccc1	ZINC001157229323	1380818331	/nfs/dbraw/zinc/81/83/31/1380818331.db2.gz	RWPLGKLYUXBOTR-RTBURBONSA-N	0	3	328.500	3.495	20	30		EGEDHN
CN1CCC[C@@H]2CN(c3nc4cc(F)ccc4c(Cl)c3C#N)C[C@@H]21	ZINC001157281753	1380831960	/nfs/dbraw/zinc/83/19/60/1380831960.db2.gz	IACVLOGPWWDZFH-BZNIZROVSA-N	0	3	344.821	3.429	20	30		EGEDHN
C=CCN(c1nccnc1C(C#N)C(=O)OC(C)(C)C)C(C)(C)C	ZINC001157585896	1380972526	/nfs/dbraw/zinc/97/25/26/1380972526.db2.gz	VBTHBGAAADPSPT-CYBMUJFWSA-N	0	3	330.432	3.216	20	30		EGEDHN
C=CCOCCCC(=O)N1CCCC[C@@H]1CN(C)Cc1ccccc1	ZINC001157784824	1381032478	/nfs/dbraw/zinc/03/24/78/1381032478.db2.gz	UELDZDGYVINIHI-HXUWFJFHSA-N	0	3	344.499	3.482	20	30		EGEDHN
CCC(CC)C(=O)N[C@H]1CCN(Cc2ccc(C#N)cc2)[C@H](C)C1	ZINC001328237693	1388694484	/nfs/dbraw/zinc/69/44/84/1388694484.db2.gz	BORXCKQXOQGDBD-BEFAXECRSA-N	0	3	327.472	3.464	20	30		EGEDHN
N#Cc1ccc2c(c1)CCN(C(=O)[C@H]1CCC[C@@H](c3ccccc3)N1)C2	ZINC001157936431	1381075441	/nfs/dbraw/zinc/07/54/41/1381075441.db2.gz	FYRCXKXFCFJCSR-LEWJYISDSA-N	0	3	345.446	3.326	20	30		EGEDHN
CN(CCOCC1CCC1)C[C@H]1CCCCN1C(=O)C#CC(C)(C)C	ZINC001157964950	1381083413	/nfs/dbraw/zinc/08/34/13/1381083413.db2.gz	JPJXVJBWDHRBEE-LJQANCHMSA-N	0	3	348.531	3.166	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1CC[C@H](c2ccccc2)O1	ZINC001157967304	1381085804	/nfs/dbraw/zinc/08/58/04/1381085804.db2.gz	JBXHNDMPCHAANU-AQNXPRMDSA-N	0	3	342.483	3.406	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H](C)Oc1cccc(F)c1	ZINC001157994040	1381095038	/nfs/dbraw/zinc/09/50/38/1381095038.db2.gz	GDEFLSCVYJLTPU-DOTOQJQBSA-N	0	3	334.435	3.092	20	30		EGEDHN
C=C(C)CCC(=O)N1CCCC[C@@H]1CN(C)C[C@@H]1CC(C)(C)CO1	ZINC001158011867	1381102342	/nfs/dbraw/zinc/10/23/42/1381102342.db2.gz	SIXBHLJIOBWFCD-MSOLQXFVSA-N	0	3	336.520	3.471	20	30		EGEDHN
C=C(C)CCC(=O)N1CCCC[C@@H]1CN(C)CCO[C@@H]1CC1(F)F	ZINC001158011967	1381103415	/nfs/dbraw/zinc/10/34/15/1381103415.db2.gz	XYVIRXUJOFLJCR-HZPDHXFCSA-N	0	3	344.446	3.080	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)Cc1ccc(C)c(OC)c1	ZINC001158199641	1381155925	/nfs/dbraw/zinc/15/59/25/1381155925.db2.gz	FQKXAJXBTHEFQO-GOSISDBHSA-N	0	3	330.472	3.045	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cnn2cccc(Cl)c12	ZINC001158207412	1381159105	/nfs/dbraw/zinc/15/91/05/1381159105.db2.gz	ZKBYZAVTNGKWLQ-CQSZACIVSA-N	0	3	346.862	3.100	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)CCc1ccc(OC)c(F)c1	ZINC001158212622	1381161328	/nfs/dbraw/zinc/16/13/28/1381161328.db2.gz	VXHBZHHYCVLNAD-QGZVFWFLSA-N	0	3	348.462	3.266	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1cc[nH]c1C(C)C	ZINC001158357319	1381215385	/nfs/dbraw/zinc/21/53/85/1381215385.db2.gz	FAGPCQUHDPFJOM-QGZVFWFLSA-N	0	3	347.503	3.267	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@@H]1CCCc2cccnc21	ZINC001158363949	1381219312	/nfs/dbraw/zinc/21/93/12/1381219312.db2.gz	OEGMFBBWKCBEFH-QZTJIDSGSA-N	0	3	327.472	3.000	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)c1ccc(C)cc1F	ZINC001158522705	1381281326	/nfs/dbraw/zinc/28/13/26/1381281326.db2.gz	ZTPIDRJPJGYLMM-QGZVFWFLSA-N	0	3	348.462	3.263	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)Cc1coc2ccccc12	ZINC001158653395	1381338900	/nfs/dbraw/zinc/33/89/00/1381338900.db2.gz	FKGVQMPVVDCVHC-QGZVFWFLSA-N	0	3	326.440	3.474	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)COc1cc(C)ccc1C	ZINC001158852605	1381433689	/nfs/dbraw/zinc/43/36/89/1381433689.db2.gz	IFQRVASBVFZKCN-GOSISDBHSA-N	0	3	330.472	3.181	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)c1cc2c(cccc2OC)[nH]1	ZINC001158872652	1381445152	/nfs/dbraw/zinc/44/51/52/1381445152.db2.gz	UKVQIDIRSKLYOB-OAHLLOKOSA-N	0	3	341.455	3.289	20	30		EGEDHN
C=CCOCCN(C)C[C@H]1CCCCN1C(=O)CCc1ccc(C)o1	ZINC001158900718	1381455210	/nfs/dbraw/zinc/45/52/10/1381455210.db2.gz	KPHSKTHWCVPKFP-GOSISDBHSA-N	0	3	348.487	3.036	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCCN1C(=O)[C@H]1Cc2c1cccc2Cl	ZINC001158936279	1381473855	/nfs/dbraw/zinc/47/38/55/1381473855.db2.gz	ZLKLZINEIGVYMD-PBHICJAKSA-N	0	3	332.875	3.479	20	30		EGEDHN
CC[C@@H](C)C(=O)NCCC1=CCN(Cc2ccc(C#N)cc2)CC1	ZINC001159325459	1381762930	/nfs/dbraw/zinc/76/29/30/1381762930.db2.gz	KVPXWCKHPYIWSV-MRXNPFEDSA-N	0	3	325.456	3.243	20	30		EGEDHN
C#CCC1(C(=O)NCCCN[C@@H](C)c2c(F)cccc2F)CCC1	ZINC001159663858	1381862486	/nfs/dbraw/zinc/86/24/86/1381862486.db2.gz	BTVNGHXTYKIUKV-AWEZNQCLSA-N	0	3	334.410	3.315	20	30		EGEDHN
N#Cc1ccc(CN2CC=C(CCNC(=O)C=C3CCC3)CC2)cc1	ZINC001159767097	1381893701	/nfs/dbraw/zinc/89/37/01/1381893701.db2.gz	CXTUJUIOKNJHFU-UHFFFAOYSA-N	0	3	335.451	3.307	20	30		EGEDHN
C#CCCCCC(=O)NCCC1=CCN(Cc2ccc(C#N)cc2)CC1	ZINC001159880911	1381927007	/nfs/dbraw/zinc/92/70/07/1381927007.db2.gz	UYEKMJJXNBMWBQ-UHFFFAOYSA-N	0	3	349.478	3.390	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)c1csc(CC(C)C)n1	ZINC001328463279	1388752303	/nfs/dbraw/zinc/75/23/03/1388752303.db2.gz	FEZHVECJDHAOFV-LBPRGKRZSA-N	0	3	329.897	3.192	20	30		EGEDHN
C#CCCCC(=O)NCCC1=CCN(Cc2sc(C)nc2C)CC1	ZINC001159957327	1381949600	/nfs/dbraw/zinc/94/96/00/1381949600.db2.gz	BOVDCXAHYGAMIG-UHFFFAOYSA-N	0	3	345.512	3.202	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CO[C@@H]2CCCC[C@@H]2CC)CC1	ZINC001160106833	1381997760	/nfs/dbraw/zinc/99/77/60/1381997760.db2.gz	DFNBLXBRKITSDX-RBUKOAKNSA-N	0	3	334.504	3.296	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2snc(Cl)c2Cl)CC1	ZINC001160258367	1382052313	/nfs/dbraw/zinc/05/23/13/1382052313.db2.gz	VQHDKGAFHBRFIE-UHFFFAOYSA-N	0	3	346.283	3.388	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cc3ccncc3s2)CC1	ZINC001160379117	1382088124	/nfs/dbraw/zinc/08/81/24/1382088124.db2.gz	CHULOGTZPHKTFT-UHFFFAOYSA-N	0	3	327.453	3.234	20	30		EGEDHN
C=CCOc1ccccc1C(=O)NCCC1=CCN(CC=C)CC1	ZINC001160514619	1382127500	/nfs/dbraw/zinc/12/75/00/1382127500.db2.gz	BGLHZLWZRZXDNA-UHFFFAOYSA-N	0	3	326.440	3.189	20	30		EGEDHN
N#Cc1ccc(CC2CCN(C(=O)[C@@H](N)C3CCCCC3)CC2)cc1	ZINC001160565996	1382144430	/nfs/dbraw/zinc/14/44/30/1382144430.db2.gz	KAONEIOJWRSTLR-FQEVSTJZSA-N	0	3	339.483	3.247	20	30		EGEDHN
N#Cc1ccc(N[C@H](c2ccccc2O)[C@H]([NH3+])c2ccccc2[O-])nc1	ZINC001160616042	1382154115	/nfs/dbraw/zinc/15/41/15/1382154115.db2.gz	BLQRTGCQBALJDM-WOJBJXKFSA-N	0	3	346.390	3.218	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)C2([C@@H]3CCCCO3)CCC2)CC1	ZINC001160658193	1382161840	/nfs/dbraw/zinc/16/18/40/1382161840.db2.gz	RYIRCOPEBCGPDE-SFHVURJKSA-N	0	3	332.488	3.050	20	30		EGEDHN
CC(C)[C@@H](F)C(=O)NCCC1=CCN(Cc2ccc(C#N)cc2)CC1	ZINC001160946695	1382247438	/nfs/dbraw/zinc/24/74/38/1382247438.db2.gz	MSVXMIMAXOWCCI-LJQANCHMSA-N	0	3	343.446	3.191	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)c2c(F)ccc(C)c2F)CC1	ZINC001161088929	1382294019	/nfs/dbraw/zinc/29/40/19/1382294019.db2.gz	FAFGRMQSLMEAPU-UHFFFAOYSA-N	0	3	332.394	3.049	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)CCCc2ccc(OC)cc2)CC1	ZINC001161101670	1382296536	/nfs/dbraw/zinc/29/65/36/1382296536.db2.gz	JEJFOGRERFINDN-UHFFFAOYSA-N	0	3	342.483	3.342	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)[C@@H](CC)Oc2cccc(C)c2)CC1	ZINC001161471784	1382417483	/nfs/dbraw/zinc/41/74/83/1382417483.db2.gz	FRCNGUYUIGMIOG-HXUWFJFHSA-N	0	3	342.483	3.477	20	30		EGEDHN
C=CCN1CC=C(CCNC(=O)c2cnn(C(C)C)c2C2CC2)CC1	ZINC001161673675	1382476322	/nfs/dbraw/zinc/47/63/22/1382476322.db2.gz	BKQRZSGLJLIQSY-UHFFFAOYSA-N	0	3	342.487	3.279	20	30		EGEDHN
CC#CCN1CC=C(CCNC(=O)C23CC4CC(CC(C4)C2)C3)CC1	ZINC001161765895	1382498973	/nfs/dbraw/zinc/49/89/73/1382498973.db2.gz	APSHIMUHGLSJKG-UHFFFAOYSA-N	0	3	340.511	3.365	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C[C@@H]1CCC[C@H]1C	ZINC001162822380	1382887089	/nfs/dbraw/zinc/88/70/89/1382887089.db2.gz	NJQHYKGIBHWENK-CTNGQTDRSA-N	0	3	340.511	3.497	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)C[C@H]1C=CCCC1	ZINC001162841081	1382892242	/nfs/dbraw/zinc/89/22/42/1382892242.db2.gz	LBIXKBAEBLWYME-NRFANRHFSA-N	0	3	338.495	3.417	20	30		EGEDHN
CC#CCNCCN(CCc1ccccc1)C(=O)[C@H]1CCC[C@@H](C)C1	ZINC001162907149	1382911881	/nfs/dbraw/zinc/91/18/81/1382911881.db2.gz	YWWISXGFVUXRRI-CTNGQTDRSA-N	0	3	340.511	3.497	20	30		EGEDHN
C=CCCC1(C(=O)N(CCNCCF)CCc2ccccc2)CC1	ZINC001162918630	1382916174	/nfs/dbraw/zinc/91/61/74/1382916174.db2.gz	FIJSADXHGQRCDO-UHFFFAOYSA-N	0	3	332.463	3.363	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1cc(Cl)cs1	ZINC001162952640	1382926240	/nfs/dbraw/zinc/92/62/40/1382926240.db2.gz	SWMWJOOKPDCLJZ-UHFFFAOYSA-N	0	3	346.883	3.309	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H](CC)CC(C)C	ZINC001162977012	1382934257	/nfs/dbraw/zinc/93/42/57/1382934257.db2.gz	AZPLIINNFYVCAQ-HXUWFJFHSA-N	0	3	328.500	3.353	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)C1(c2ccccc2)CC1	ZINC001162992045	1382940599	/nfs/dbraw/zinc/94/05/99/1382940599.db2.gz	BGIQSXBZQQKLIY-UHFFFAOYSA-N	0	3	346.474	3.012	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)[C@H]1C[C@H](C)C[C@H](C)C1	ZINC001163006992	1382946680	/nfs/dbraw/zinc/94/66/80/1382946680.db2.gz	MFJYRIDKAKPIJX-KXTWHKPSSA-N	0	3	340.511	3.353	20	30		EGEDHN
C#CCNCCN(CCc1ccccc1)C(=O)c1coc2ccccc12	ZINC001163012861	1382948499	/nfs/dbraw/zinc/94/84/99/1382948499.db2.gz	CRVBUNLQBLRSOK-UHFFFAOYSA-N	0	3	346.430	3.341	20	30		EGEDHN
c1ccc([C@@H]2CC(=NNCC3CCOCC3)CCN2C2CC2)cc1	ZINC001328709857	1388820583	/nfs/dbraw/zinc/82/05/83/1388820583.db2.gz	ZRLYIDWOVWHFOR-FQEVSTJZSA-N	0	3	327.472	3.358	20	30		EGEDHN
Cc1cc(F)cc(C)c1C(=O)NCCCNCc1ccccc1C#N	ZINC001163778079	1383121198	/nfs/dbraw/zinc/12/11/98/1383121198.db2.gz	GTYAEQNTEPCDIV-UHFFFAOYSA-N	0	3	339.414	3.224	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)[C@@H](C)CCC)CC1	ZINC001163842446	1383128282	/nfs/dbraw/zinc/12/82/82/1383128282.db2.gz	ZSWUKJXFOXFTQW-LBPRGKRZSA-N	0	3	331.298	3.207	20	30		EGEDHN
N#Cc1ccc(CNCC2(CCNC(=O)C3CC=CC3)CC2)c(F)c1	ZINC001163918196	1383135608	/nfs/dbraw/zinc/13/56/08/1383135608.db2.gz	MRDFDWBYFCWFJO-UHFFFAOYSA-N	0	3	341.430	3.040	20	30		EGEDHN
C[C@H](C(=O)NCCC1(CNCc2ccc(C#N)cc2F)CC1)C1CC1	ZINC001163965103	1383140629	/nfs/dbraw/zinc/14/06/29/1383140629.db2.gz	KPPIMZXMQTWCLJ-AWEZNQCLSA-N	0	3	343.446	3.120	20	30		EGEDHN
C/C=C(\C)C(=O)NCCC1(CNCc2cc(C#N)ccc2F)CC1	ZINC001163993447	1383143903	/nfs/dbraw/zinc/14/39/03/1383143903.db2.gz	UUYQKJFRQQQXQS-LZWSPWQCSA-N	0	3	329.419	3.040	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCCCNCc1ccn(C2CCCC2)n1	ZINC001164323610	1383177641	/nfs/dbraw/zinc/17/76/41/1383177641.db2.gz	ITZZYCAVZFWLGI-MRXNPFEDSA-N	0	3	332.492	3.196	20	30		EGEDHN
O=C(C#CC1CC1)NCCC1(CNCc2cc(Cl)ccc2F)CC1	ZINC001164487435	1383192338	/nfs/dbraw/zinc/19/23/38/1383192338.db2.gz	SODHAXPRDJPOMI-UHFFFAOYSA-N	0	3	348.849	3.269	20	30		EGEDHN
CC1(C(=O)NCCC2(CNCC#Cc3ccccc3Cl)CC2)CC1	ZINC001164600453	1383205540	/nfs/dbraw/zinc/20/55/40/1383205540.db2.gz	PTIAXSYMMDYFPS-UHFFFAOYSA-N	0	3	344.886	3.368	20	30		EGEDHN
C[C@@H]1CCN(Cc2ccccc2)C[C@@H]1N(C)c1nccc(C#N)c1F	ZINC001165184582	1383243882	/nfs/dbraw/zinc/24/38/82/1383243882.db2.gz	XDYCHIXFCNCNCF-QAPCUYQASA-N	0	3	338.430	3.439	20	30		EGEDHN
N#Cc1cc(C(F)(F)N2CCN[C@@H](c3ccccc3)C2)cnc1Cl	ZINC001165195618	1383244628	/nfs/dbraw/zinc/24/46/28/1383244628.db2.gz	QKKGPFIMAWGLKG-OAHLLOKOSA-N	0	3	348.784	3.302	20	30		EGEDHN
C=CC(C)(C)CC(=O)NCCC1(CNCc2ccc(F)cn2)CC1	ZINC001165215051	1383250330	/nfs/dbraw/zinc/25/03/30/1383250330.db2.gz	FFWJNULNGFZLBH-UHFFFAOYSA-N	0	3	333.451	3.199	20	30		EGEDHN
C=C(C)CCC(=O)NCCC1(CNCc2cc(C3CC3)no2)CC1	ZINC001165258641	1383259111	/nfs/dbraw/zinc/25/91/11/1383259111.db2.gz	JOOXRQJVKWQQEJ-UHFFFAOYSA-N	0	3	331.460	3.284	20	30		EGEDHN
C=CCCCC(=O)NCCCNCC(=O)Nc1ccccc1C(C)C	ZINC001165530015	1383307511	/nfs/dbraw/zinc/30/75/11/1383307511.db2.gz	CQUIHXSLZYHTIJ-UHFFFAOYSA-N	0	3	345.487	3.201	20	30		EGEDHN
C=CCC1(C(=O)NCCCNCc2ccc(C#N)cc2F)CCC1	ZINC001165998226	1383376146	/nfs/dbraw/zinc/37/61/46/1383376146.db2.gz	OIQOHPRJSYUZSW-UHFFFAOYSA-N	0	3	329.419	3.040	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2nc(Cl)sc2C)CC1	ZINC001166107148	1383390007	/nfs/dbraw/zinc/39/00/07/1383390007.db2.gz	ANCSYIFFQGZJQW-UHFFFAOYSA-N	0	3	348.299	3.347	20	30		EGEDHN
CC1(C)CC[C@@H](C(=O)NCCCNCc2ccc(C#N)cc2F)C1	ZINC001166199932	1383400932	/nfs/dbraw/zinc/40/09/32/1383400932.db2.gz	LPNUVNWGBXDPFQ-OAHLLOKOSA-N	0	3	331.435	3.120	20	30		EGEDHN
C[C@H](C(=O)NCCCNCc1cc(C#N)ccc1F)c1ccsc1	ZINC001166497780	1383429676	/nfs/dbraw/zinc/42/96/76/1383429676.db2.gz	RMBSCVYZNIOXMX-ZDUSSCGKSA-N	0	3	345.443	3.158	20	30		EGEDHN
C=C[C@H](C)[C@H](C)C(=O)NCCC1(CNCc2conc2CC)CC1	ZINC001166694684	1383462180	/nfs/dbraw/zinc/46/21/80/1383462180.db2.gz	OBWDAGRQFBCWBF-GJZGRUSLSA-N	0	3	333.476	3.071	20	30		EGEDHN
C=C[C@H](C)[C@@H](C)C(=O)NCCC1(CNCc2oc(CC)nc2C)CC1	ZINC001166703977	1383463876	/nfs/dbraw/zinc/46/38/76/1383463876.db2.gz	LUEBDYQJTLZXCQ-LSDHHAIUSA-N	0	3	347.503	3.380	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCCC1(CN[C@H](C)c2cnccn2)CC1	ZINC001166765542	1383474306	/nfs/dbraw/zinc/47/43/06/1383474306.db2.gz	PXLVYDLMVRULRV-HZPDHXFCSA-N	0	3	330.476	3.016	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCCC1(CN[C@@H](C)c2cnccn2)CC1	ZINC001166765543	1383474483	/nfs/dbraw/zinc/47/44/83/1383474483.db2.gz	PXLVYDLMVRULRV-JKSUJKDBSA-N	0	3	330.476	3.016	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)Cc2ccc(F)c(F)c2)CC1	ZINC001166890498	1383495150	/nfs/dbraw/zinc/49/51/50/1383495150.db2.gz	JXTQJXIUPVLIHB-UHFFFAOYSA-N	0	3	342.817	3.136	20	30		EGEDHN
C=CCCC1(C(=O)NCCC2(CNCc3ocnc3C)CC2)CC1	ZINC001167025284	1383521386	/nfs/dbraw/zinc/52/13/86/1383521386.db2.gz	DLXHJOIIGGHLBJ-UHFFFAOYSA-N	0	3	331.460	3.106	20	30		EGEDHN
C=CCC1(C(=O)NCCC2(CNCc3cnoc3C)CC2)CCC1	ZINC001167035386	1383524507	/nfs/dbraw/zinc/52/45/07/1383524507.db2.gz	FZORIBILGDOJSY-UHFFFAOYSA-N	0	3	331.460	3.106	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1cc(F)cc(Cl)c1	ZINC001167285880	1383584593	/nfs/dbraw/zinc/58/45/93/1383584593.db2.gz	LAPJXJFENMSVSE-UHFFFAOYSA-N	0	3	349.631	3.097	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc3c(c2)C[C@H](C)O3)CC1	ZINC001167460792	1383639196	/nfs/dbraw/zinc/63/91/96/1383639196.db2.gz	OTLQKBHOLKBHRF-AWEZNQCLSA-N	0	3	348.874	3.252	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2ccc3[nH]c(C)nc3c2)CC1	ZINC001167545638	1383663392	/nfs/dbraw/zinc/66/33/92/1383663392.db2.gz	FRNFJRIDYNSDGX-UHFFFAOYSA-N	0	3	346.862	3.114	20	30		EGEDHN
C=C(Br)CNCC1(CCNC(=O)[C@@H](C)[C@H](C)CC)CC1	ZINC001167557059	1383667347	/nfs/dbraw/zinc/66/73/47/1383667347.db2.gz	PGJLTWDPIGBHPL-OCCSQVGLSA-N	0	3	345.325	3.453	20	30		EGEDHN
C=C(Cl)CNCC1(CCNC(=O)c2cccc3ccncc32)CC1	ZINC001167595362	1383684601	/nfs/dbraw/zinc/68/46/01/1383684601.db2.gz	UBNLAEHJQGAELY-UHFFFAOYSA-N	0	3	343.858	3.477	20	30		EGEDHN
C[C@H](Nc1cncc([C@H]2CN3CCC2CC3)n1)c1cccc(C#N)c1	ZINC001167707334	1383718492	/nfs/dbraw/zinc/71/84/92/1383718492.db2.gz	QCBKJMPHUBWYCF-KSSFIOAISA-N	0	3	333.439	3.331	20	30		EGEDHN
C=CCOC(=O)[C@@H](Nc1ccc(/N=C/N(C)C)c(C#N)c1)[C@@H](C)CC	ZINC001167957173	1383778648	/nfs/dbraw/zinc/77/86/48/1383778648.db2.gz	DWQFUEYDSFPLFD-KVDYQGCPSA-N	0	3	342.443	3.335	20	30		EGEDHN
N#Cc1cccc(N2CCN([C@H]3CCc4cc(F)ccc4C3)CC2)c1	ZINC001168448113	1383908602	/nfs/dbraw/zinc/90/86/02/1383908602.db2.gz	ZVWLKMFRHOWWSN-NRFANRHFSA-N	0	3	335.426	3.377	20	30		EGEDHN
C[C@@H](CCCCNCc1cc(F)ccc1C#N)NC(=O)c1ccc[nH]1	ZINC001169121544	1384109943	/nfs/dbraw/zinc/10/99/43/1384109943.db2.gz	LZJYOHRFCNSJPJ-AWEZNQCLSA-N	0	3	342.418	3.104	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)c1ccoc1	ZINC001169165207	1384117901	/nfs/dbraw/zinc/11/79/01/1384117901.db2.gz	FECRXOLRGSKKDA-OAHLLOKOSA-N	0	3	325.412	3.230	20	30		EGEDHN
CCOC(=O)[C@H]1CC[C@@H](N(CCC#N)C2CCCCCCC2)CO1	ZINC001169394248	1384143326	/nfs/dbraw/zinc/14/33/26/1384143326.db2.gz	WKMDNQRGCGQRLE-QZTJIDSGSA-N	0	3	336.476	3.426	20	30		EGEDHN
N#Cc1ccc(C2(N[C@H]3CCCN(C(=O)c4ccccc4)C3)CC2)cc1	ZINC001169734706	1384180503	/nfs/dbraw/zinc/18/05/03/1384180503.db2.gz	CTSHLSCMLIDRGG-FQEVSTJZSA-N	0	3	345.446	3.442	20	30		EGEDHN
C[C@@H](C#N)C(=O)N[C@@H](C)CCCCNCc1c(F)cccc1Cl	ZINC001169833112	1384190393	/nfs/dbraw/zinc/19/03/93/1384190393.db2.gz	TUACUYXPUZDOOZ-STQMWFEESA-N	0	3	339.842	3.403	20	30		EGEDHN
C[C@@H](CCCCNCc1ccccc1C#N)NC(=O)/C=C/C1CC1	ZINC001169981701	1384209499	/nfs/dbraw/zinc/20/94/99/1384209499.db2.gz	GJVRUGJAYHKXCH-PCUGXKRQSA-N	0	3	325.456	3.289	20	30		EGEDHN
C[C@H](CCCCNCc1ccccc1C#N)NC(=O)/C=C/C1CC1	ZINC001169981700	1384209801	/nfs/dbraw/zinc/20/98/01/1384209801.db2.gz	GJVRUGJAYHKXCH-LPQFERQCSA-N	0	3	325.456	3.289	20	30		EGEDHN
CS[C@H](C)CC(=O)N[C@H](C)CCCCNCc1ccccc1C#N	ZINC001170230194	1384270998	/nfs/dbraw/zinc/27/09/98/1384270998.db2.gz	ACTTXVDUXOGMSB-HZPDHXFCSA-N	0	3	347.528	3.464	20	30		EGEDHN
COC(=O)[C@H]1[C@@H]2CC[C@@H](C2)N1C1CCC(C#N)(c2ccccc2)CC1	ZINC001170406050	1384309367	/nfs/dbraw/zinc/30/93/67/1384309367.db2.gz	ROPOHDGWSBHQDU-WJXBRQKSSA-N	0	3	338.451	3.416	20	30		EGEDHN
CC(C)N1CCN(c2ccc(NCC#Cc3ccccc3)cn2)CC1	ZINC001170427757	1384316679	/nfs/dbraw/zinc/31/66/79/1384316679.db2.gz	YGNWEAGOSRVAEJ-UHFFFAOYSA-N	0	3	334.467	3.076	20	30		EGEDHN
C[C@@H](CCCCNCc1cc(O)ccc1Cl)NC(=O)C#CC1CC1	ZINC001170673925	1384361937	/nfs/dbraw/zinc/36/19/37/1384361937.db2.gz	JJPVNSFDYBFYKX-AWEZNQCLSA-N	0	3	348.874	3.224	20	30		EGEDHN
COC(=O)c1ccc(C(=N)Nc2cc3nc(Cl)ccc3[nH]2)cc1	ZINC001170981079	1384422705	/nfs/dbraw/zinc/42/27/05/1384422705.db2.gz	GPNBOBJBYRQKGT-UHFFFAOYSA-N	0	3	328.759	3.040	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@@H](C)CCCCNCc1cc(OC)no1	ZINC001170997207	1384426772	/nfs/dbraw/zinc/42/67/72/1384426772.db2.gz	DQZRODFPHXTQMC-AWEZNQCLSA-N	0	3	337.464	3.050	20	30		EGEDHN
C=C(C)CCC(=O)N[C@@H](C)CCCCNCc1ncc(Cl)n1C	ZINC001171044448	1384435697	/nfs/dbraw/zinc/43/56/97/1384435697.db2.gz	YOEYQOACKIOUGB-AWEZNQCLSA-N	0	3	340.899	3.194	20	30		EGEDHN
Cc1cc(OC2CCN([C@H](C)Cc3cccc(C#N)c3)CC2)ncn1	ZINC001171231537	1384475438	/nfs/dbraw/zinc/47/54/38/1384475438.db2.gz	KKNQSDSZIJHOGT-MRXNPFEDSA-N	0	3	336.439	3.131	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)[C@H](F)CC1CCCCC1	ZINC001171279080	1384484308	/nfs/dbraw/zinc/48/43/08/1384484308.db2.gz	OVPGHFAQNNZKOS-LJQANCHMSA-N	0	3	345.462	3.463	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)[C@@H](F)CC1CCCCC1	ZINC001171279742	1384484324	/nfs/dbraw/zinc/48/43/24/1384484324.db2.gz	ZXLIISUGQZTZBX-AWEZNQCLSA-N	0	3	349.288	3.299	20	30		EGEDHN
CCN(C[C@@H](C)C#N)C(=O)CN1CCC[C@]1(C)Cc1ccc(F)cc1	ZINC001171307081	1384490863	/nfs/dbraw/zinc/49/08/63/1384490863.db2.gz	KPVHSVJEHILQKS-OXJNMPFZSA-N	0	3	345.462	3.231	20	30		EGEDHN
C=CCOc1ccccc1[C@H](C)Nc1nncc2c1OCCN2C	ZINC001171373257	1384504960	/nfs/dbraw/zinc/50/49/60/1384504960.db2.gz	QZSDDQAIUWSAOV-ZDUSSCGKSA-N	0	3	326.400	3.043	20	30		EGEDHN
N=C(N[C@@H]1CCc2cc(F)c(F)c(F)c2C1)c1ccc(Cl)cn1	ZINC001171510739	1384547023	/nfs/dbraw/zinc/54/70/23/1384547023.db2.gz	DGERNXYMLDKLBX-SNVBAGLBSA-N	0	3	339.748	3.415	20	30		EGEDHN
CCCCCCCCC(=O)NCCCNCC(=O)Nc1ccccc1	ZINC001171822794	1384651304	/nfs/dbraw/zinc/65/13/04/1384651304.db2.gz	MSLJWGBRFXLTDC-UHFFFAOYSA-N	0	3	347.503	3.472	20	30		EGEDHN
N#Cc1ccccc1CNCCCNC(=O)c1ccc2ccccc2n1	ZINC001171834881	1384655509	/nfs/dbraw/zinc/65/55/09/1384655509.db2.gz	UVZMAHHLTXVMPU-UHFFFAOYSA-N	0	3	344.418	3.016	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1cccc2cn[nH]c21	ZINC001316877978	1384662399	/nfs/dbraw/zinc/66/23/99/1384662399.db2.gz	LFQDHKMDTCCTKF-CJNGLKHVSA-N	0	3	346.862	3.288	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@@H]1CCCCN1C(=O)c1cccc2c[nH]nc21	ZINC001316877978	1384662402	/nfs/dbraw/zinc/66/24/02/1384662402.db2.gz	LFQDHKMDTCCTKF-CJNGLKHVSA-N	0	3	346.862	3.288	20	30		EGEDHN
N#Cc1ccc(N2CCN([C@H]3CSc4ccccc4C3)CC2)cc1	ZINC001172204270	1384747586	/nfs/dbraw/zinc/74/75/86/1384747586.db2.gz	YDHXSLBIZMQIFR-LJQANCHMSA-N	0	3	335.476	3.397	20	30		EGEDHN
C[C@@H](Cc1ccc(C#N)cc1)N1C[C@@H]2CN(C(=O)OC(C)(C)C)[C@@H]2C1	ZINC001172312594	1384766872	/nfs/dbraw/zinc/76/68/72/1384766872.db2.gz	HLJOXGPVZOYBOY-BMGDILEWSA-N	0	3	341.455	3.040	20	30		EGEDHN
CCCCCCC[C@@H](CC)N1CCN(CC(=O)N2CCCC2)CC1	ZINC001172356924	1384776300	/nfs/dbraw/zinc/77/63/00/1384776300.db2.gz	ZRWLWXMKYDDPME-LJQANCHMSA-N	0	3	337.552	3.366	20	30		EGEDHN
C[C@@H](CCCC#N)N1CCO[C@]2(CCCN(c3ccccc3)C2)C1	ZINC001172494652	1384804196	/nfs/dbraw/zinc/80/41/96/1384804196.db2.gz	IKQHBRYYZPNCGV-AZUAARDMSA-N	0	3	327.472	3.440	20	30		EGEDHN
C[C@H](CCCC#N)N1CCN(c2ccc(-c3ncccn3)cc2)CC1	ZINC001172506322	1384806715	/nfs/dbraw/zinc/80/67/15/1384806715.db2.gz	RJVUNMSGOLKBOM-QGZVFWFLSA-N	0	3	335.455	3.348	20	30		EGEDHN
COC(=O)[C@H]1CCC[C@H](N2CCC(C#N)(c3ccccc3)CC2)C1	ZINC001172612268	1384819298	/nfs/dbraw/zinc/81/92/98/1384819298.db2.gz	TWESWPGXRODQDV-WMZOPIPTSA-N	0	3	326.440	3.276	20	30		EGEDHN
CC[C@H](C)[C@H](N[C@H](C)CSc1ccc(Cl)cc1)C(=O)NO	ZINC001172879271	1384871624	/nfs/dbraw/zinc/87/16/24/1384871624.db2.gz	XWXKRXABZOUMHU-WDMOLILDSA-N	0	3	330.881	3.330	20	30		EGEDHN
CC(C)(C)OC(=O)N1CC[C@H](NCc2ccc(F)cc2)C[C@H]1C#N	ZINC001172967095	1384892139	/nfs/dbraw/zinc/89/21/39/1384892139.db2.gz	GCNSFOVXNCSWPF-HOTGVXAUSA-N	0	3	333.407	3.207	20	30		EGEDHN
C=CCOC1CCC(N2CCN(c3noc4ccccc43)CC2)CC1	ZINC001173319396	1384957648	/nfs/dbraw/zinc/95/76/48/1384957648.db2.gz	ISLPWPFYLIHCLY-UHFFFAOYSA-N	0	3	341.455	3.464	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)CCNC(=O)CCc1ccc2[nH]ccc2c1	ZINC001317401305	1385115981	/nfs/dbraw/zinc/11/59/81/1385115981.db2.gz	QKGHNNPUWGHHJC-AWEZNQCLSA-N	0	3	333.863	3.337	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)N[C@@H](C)CCCCN[C@@H](C)c1nnc(C)[nH]1	ZINC001174673488	1385132395	/nfs/dbraw/zinc/13/23/95/1385132395.db2.gz	XSVLDFJXUXXXFA-KBPBESRZSA-N	0	3	335.496	3.041	20	30		EGEDHN
C=C(C)C[C@H](C)C(=O)N[C@@H](C)CCCCNCc1ccn(CC)n1	ZINC001174848609	1385159556	/nfs/dbraw/zinc/15/95/56/1385159556.db2.gz	FBLPZYXUFZPYHX-IRXDYDNUSA-N	0	3	334.508	3.270	20	30		EGEDHN
C=C(C)C[C@@H](C)C(=O)N[C@@H](C)CCCCNCc1nccn1CC	ZINC001174849501	1385159795	/nfs/dbraw/zinc/15/97/95/1385159795.db2.gz	NQYUNWPAYDSYLW-SJORKVTESA-N	0	3	334.508	3.270	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N[C@H](C)CCCCNCc1cn(C(C)C)nn1	ZINC001174850111	1385160040	/nfs/dbraw/zinc/16/00/40/1385160040.db2.gz	UCTOOMKELOTMOQ-SJORKVTESA-N	0	3	349.523	3.226	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N[C@H](C)CCCCNCc1nccn1CC	ZINC001175083134	1385191907	/nfs/dbraw/zinc/19/19/07/1385191907.db2.gz	WFEMVYYVWAVKLT-APWZRJJASA-N	0	3	334.508	3.270	20	30		EGEDHN
CCCN(CCNC(=O)C1(F)CCCC1)Cc1ccc(C#N)cc1	ZINC001317543088	1385284416	/nfs/dbraw/zinc/28/44/16/1385284416.db2.gz	IDLRWVUPAAYIHE-UHFFFAOYSA-N	0	3	331.435	3.169	20	30		EGEDHN
C#CCOc1ccccc1CN[C@H]1CCCN(C(=O)c2ccccc2)C1	ZINC001318339933	1385655294	/nfs/dbraw/zinc/65/52/94/1385655294.db2.gz	BOQNBUXJQRLBMW-FQEVSTJZSA-N	0	3	348.446	3.093	20	30		EGEDHN
C=C(Br)CNCCCNC(=O)c1sccc1C(C)C	ZINC001176835479	1385718966	/nfs/dbraw/zinc/71/89/66/1385718966.db2.gz	VFVLYEHSSAISEY-UHFFFAOYSA-N	0	3	345.306	3.490	20	30		EGEDHN
CC(C)[C@H]1CC[C@@H](C)C[C@H]1CN[C@@H](C(N)=O)c1ccc(C#N)cc1	ZINC001318632165	1385805888	/nfs/dbraw/zinc/80/58/88/1385805888.db2.gz	XQCQATUTXGFATC-ZWQIFLOQSA-N	0	3	327.472	3.383	20	30		EGEDHN
CC(C)[C@H]1CC[C@@H](C)C[C@@H]1CN[C@@H](C(N)=O)c1ccc(C#N)cc1	ZINC001318632164	1385806343	/nfs/dbraw/zinc/80/63/43/1385806343.db2.gz	XQCQATUTXGFATC-UTRMSSBJSA-N	0	3	327.472	3.383	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)c1coc(C)n1	ZINC001177296034	1385901840	/nfs/dbraw/zinc/90/18/40/1385901840.db2.gz	RZTDPYWXUQECPW-UHFFFAOYSA-N	0	3	339.867	3.348	20	30		EGEDHN
C=C(Cl)CNCCCN(CC1CCCC1)C(=O)[C@@H]1C[C@H](C)CO1	ZINC001177368806	1385932445	/nfs/dbraw/zinc/93/24/45/1385932445.db2.gz	XZLHNNRXNNXLMI-YOEHRIQHSA-N	0	3	342.911	3.162	20	30		EGEDHN
CC[C@@H](CNC(=O)c1ccc(C)cc1F)NCc1ccc(C#N)s1	ZINC001698622295	1406261286	/nfs/dbraw/zinc/26/12/86/1406261286.db2.gz	OBJFWMQYQGXYBZ-ZDUSSCGKSA-N	0	3	345.443	3.366	20	30		EGEDHN
C=CCC1(C(=O)NCCCNCc2c(C)onc2CC)CCCC1	ZINC001177552577	1385995171	/nfs/dbraw/zinc/99/51/71/1385995171.db2.gz	LRRXUQJXQBEVAQ-UHFFFAOYSA-N	0	3	333.476	3.278	20	30		EGEDHN
Cn1nc(NC(=O)C(C#N)Cc2cccs2)c2ccc(Cl)nc21	ZINC001177904408	1386078913	/nfs/dbraw/zinc/07/89/13/1386078913.db2.gz	PEPYULZSQKZOAG-VIFPVBQESA-N	0	3	345.815	3.004	20	30		EGEDHN
N#CC(Cc1cccs1)C(=O)Nc1cccc(-c2cccc(N)n2)n1	ZINC001177903805	1386079410	/nfs/dbraw/zinc/07/94/10/1386079410.db2.gz	LASFEEYPMUKRNO-GFCCVEGCSA-N	0	3	349.419	3.108	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2nc(Cl)sc2C)CCCC1	ZINC001319363641	1386082092	/nfs/dbraw/zinc/08/20/92/1386082092.db2.gz	GWVXLLMXCFQIKI-UHFFFAOYSA-N	0	3	348.299	3.490	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cccc3c2OCC3)CCCC1	ZINC001319377097	1386090455	/nfs/dbraw/zinc/09/04/55/1386090455.db2.gz	IHFPVBURGIIULZ-UHFFFAOYSA-N	0	3	334.847	3.006	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccc(F)cc2)CCN1C(=O)c1cccs1	ZINC001178046488	1386115954	/nfs/dbraw/zinc/11/59/54/1386115954.db2.gz	LKKRKNFARNSOCM-YOEHRIQHSA-N	0	3	342.439	3.132	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccccc2)CCN1C(=O)c1cccc(F)c1	ZINC001178051283	1386116512	/nfs/dbraw/zinc/11/65/12/1386116512.db2.gz	XEULZWRUOIFWCZ-JXFKEZNVSA-N	0	3	336.410	3.070	20	30		EGEDHN
C[C@H](C#N)C(=O)NCCCCCCNCc1nsc2ccccc12	ZINC001178052101	1386116966	/nfs/dbraw/zinc/11/69/66/1386116966.db2.gz	CNYXXGUSOATLTI-CQSZACIVSA-N	0	3	344.484	3.222	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2cccc(Cl)c2)CCN1C(=O)c1ccoc1	ZINC001178105989	1386130181	/nfs/dbraw/zinc/13/01/81/1386130181.db2.gz	FEPRCUQMQKYEBJ-KSSFIOAISA-N	0	3	342.826	3.177	20	30		EGEDHN
C#CCCCCC(=O)NCCCCCCNCc1ccn(C(C)C)n1	ZINC001178253862	1386173939	/nfs/dbraw/zinc/17/39/39/1386173939.db2.gz	LXVCCLJOZJPAEV-UHFFFAOYSA-N	0	3	346.519	3.424	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccc(Cl)cc2)CCN1C(=O)CC1CCC1	ZINC001178414871	1386210538	/nfs/dbraw/zinc/21/05/38/1386210538.db2.gz	SHMMOZAFQJQJSC-KXBFYZLASA-N	0	3	344.886	3.461	20	30		EGEDHN
C[C@H]1[C@@H](NCC#Cc2ccc(Cl)cc2)CCN1C(=O)/C=C\C1CC1	ZINC001178431970	1386215177	/nfs/dbraw/zinc/21/51/77/1386215177.db2.gz	QQLJJYJJKOMNHL-GMXWSJLQSA-N	0	3	342.870	3.237	20	30		EGEDHN
Cc1coc(C)c1C(=O)N1CC[C@H](NCC#Cc2ccccc2)[C@@H]1C	ZINC001178605944	1386260908	/nfs/dbraw/zinc/26/09/08/1386260908.db2.gz	OXWJOYLDELGNPK-LPHOPBHVSA-N	0	3	336.435	3.141	20	30		EGEDHN
CC/C(C)=C\C(=O)N1CC[C@H](NCC#Cc2ccc(F)cc2)[C@@H]1C	ZINC001178637323	1386265723	/nfs/dbraw/zinc/26/57/23/1386265723.db2.gz	NMQOGYCOWNFKJC-DNHCAHKJSA-N	0	3	328.431	3.113	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CC[C@H](NCc2cn(C(C)C)nc2C)[C@@H]1C	ZINC001178791711	1386305612	/nfs/dbraw/zinc/30/56/12/1386305612.db2.gz	PKPRUQSROSXWTA-WMZOPIPTSA-N	0	3	346.519	3.454	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCCCCCCNCc1cn(C(C)C)nn1	ZINC001179212053	1386424335	/nfs/dbraw/zinc/42/43/35/1386424335.db2.gz	BZXGOARUTUAYBA-UHFFFAOYSA-N	0	3	349.523	3.228	20	30		EGEDHN
C=CCO[C@H](C)C(=O)NCCCCCCNC/C(Cl)=C\Cl	ZINC001180433171	1386795023	/nfs/dbraw/zinc/79/50/23/1386795023.db2.gz	CYDZQQIOCXKURP-MBFWDRTGSA-N	0	3	337.291	3.163	20	30		EGEDHN
CN(CC(=O)Nc1ccccc1-c1ccc(C#N)cn1)C1CCCC1	ZINC001180629628	1386853078	/nfs/dbraw/zinc/85/30/78/1386853078.db2.gz	QWKYUUUQHURYDT-UHFFFAOYSA-N	0	3	334.423	3.433	20	30		EGEDHN
C#CCCCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2oc(C)nc2C)C1	ZINC001181200304	1386957787	/nfs/dbraw/zinc/95/77/87/1386957787.db2.gz	REGMQWPRVWTEDI-FOIQADDNSA-N	0	3	345.487	3.059	20	30		EGEDHN
C#CCCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2csc(CC)n2)C1	ZINC001181325388	1386977132	/nfs/dbraw/zinc/97/71/32/1386977132.db2.gz	SFENENMXYYSYSZ-DNVCBOLYSA-N	0	3	347.528	3.083	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1C[C@@H](C)[C@](C)(CNCc2ccn(CC)n2)C1	ZINC001181593947	1387021817	/nfs/dbraw/zinc/02/18/17/1387021817.db2.gz	DFDKLKPCWPHFMI-OXQOHEQNSA-N	0	3	346.519	3.080	20	30		EGEDHN
COc1ccc(C#CC(=O)NC[C@@H](c2ccccc2)N2CCCC2)cc1	ZINC001182047912	1387098771	/nfs/dbraw/zinc/09/87/71/1387098771.db2.gz	AJXZWNSTODPTSO-NRFANRHFSA-N	0	3	348.446	3.000	20	30		EGEDHN
CC#CCCCC(=O)N1C[C@@H](C)[C@](C)(CNCc2oc(C)nc2C)C1	ZINC001182300201	1387141420	/nfs/dbraw/zinc/14/14/20/1387141420.db2.gz	FPEZOLDGYJJRHY-FOIQADDNSA-N	0	3	345.487	3.059	20	30		EGEDHN
C=C1CCC(C(=O)N2C[C@@H](C)[C@](C)(CNCc3nccs3)C2)CC1	ZINC001182499804	1387178658	/nfs/dbraw/zinc/17/86/58/1387178658.db2.gz	RKIRUUIACVECGK-DNVCBOLYSA-N	0	3	347.528	3.464	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H](C)[C@](C)(CNCc2nccn2CC)C1	ZINC001182517713	1387181376	/nfs/dbraw/zinc/18/13/76/1387181376.db2.gz	VWQXMZYXBZMQIR-LSTHTHJFSA-N	0	3	346.519	3.080	20	30		EGEDHN
C=C[C@@](C)(CC)C(=O)N1C[C@@H](C)[C@](C)(CNCc2ccn(CC)n2)C1	ZINC001182524367	1387181903	/nfs/dbraw/zinc/18/19/03/1387181903.db2.gz	FJNBOUFUGLUQBT-LSTHTHJFSA-N	0	3	346.519	3.080	20	30		EGEDHN
C[C@H](CNC(=O)C1C(C)(C)C1(C)C)N(C)Cc1ccc(C#N)cc1	ZINC001329414468	1389103072	/nfs/dbraw/zinc/10/30/72/1389103072.db2.gz	ZRDKLEZVNZOBKN-CQSZACIVSA-N	0	3	327.472	3.177	20	30		EGEDHN
N#Cc1ccc(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)c(F)c1	ZINC001336871184	1389192030	/nfs/dbraw/zinc/19/20/30/1389192030.db2.gz	HWSQVPLHLYPSHD-IBGZPJMESA-N	0	3	337.398	3.264	20	30		EGEDHN
N#Cc1ccc(C(=O)NC[C@H]2CCCN2Cc2ccccc2)c(F)c1	ZINC001336964982	1389221746	/nfs/dbraw/zinc/22/17/46/1389221746.db2.gz	KYQAGSBMGWWVML-QGZVFWFLSA-N	0	3	337.398	3.092	20	30		EGEDHN
C[C@H](NC[C@@H](O)COc1ccc(C#N)cc1)c1ccc(Cl)c(F)c1	ZINC001337222181	1389279536	/nfs/dbraw/zinc/27/95/36/1389279536.db2.gz	WSJIUMAPSYFYGI-SWLSCSKDSA-N	0	3	348.805	3.441	20	30		EGEDHN
CN1CCCC[C@@H]1CNC(=O)c1cn(CCCC#N)c2ccccc12	ZINC001337536855	1389382304	/nfs/dbraw/zinc/38/23/04/1389382304.db2.gz	YFNFAIIJQUQUPM-MRXNPFEDSA-N	0	3	338.455	3.159	20	30		EGEDHN
C=C(Br)CNC[C@@H](C1CC1)N(C)C(=O)CCC1CCC1	ZINC001331269507	1389677523	/nfs/dbraw/zinc/67/75/23/1389677523.db2.gz	PJNFSGAHLPKDCF-HNNXBMFYSA-N	0	3	343.309	3.302	20	30		EGEDHN
CCCCCCCC[C@@H](N)C(=O)Nc1nc2c(s1)COCC2	ZINC001340032821	1390212134	/nfs/dbraw/zinc/21/21/34/1390212134.db2.gz	FUUODMAGEDIKCH-GFCCVEGCSA-N	0	3	325.478	3.232	20	30		EGEDHN
N#CC1(c2ccccc2)CC(NC[C@@H](O)c2cc(F)c(F)c(F)c2)C1	ZINC001333343037	1390286772	/nfs/dbraw/zinc/28/67/72/1390286772.db2.gz	LUHPGEIDNSBNQS-LTCLLZNKSA-N	0	3	346.352	3.351	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)N1CCC(Oc2ccc(F)cc2F)CC1	ZINC001340605319	1390326020	/nfs/dbraw/zinc/32/60/20/1390326020.db2.gz	WXWIXDWMFRQTMB-MRXNPFEDSA-N	0	3	338.398	3.018	20	30		EGEDHN
CN(C)c1ncc(CN2CCC(c3ccc(C#N)cc3)CC2)s1	ZINC001333823904	1390415431	/nfs/dbraw/zinc/41/54/31/1390415431.db2.gz	QHAJQGFDJYFEIM-UHFFFAOYSA-N	0	3	326.469	3.460	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1cccc(C[S@](=O)C(C)(C)C)c1	ZINC001341568128	1390503644	/nfs/dbraw/zinc/50/36/44/1390503644.db2.gz	WUMLJPLNFLCEGF-MWTRTKDXSA-N	0	3	336.501	3.356	20	30		EGEDHN
C=CCCC[C@H](N)C(=O)N1CCC(Cc2nc(CC)cs2)CC1	ZINC001342075870	1390568030	/nfs/dbraw/zinc/56/80/30/1390568030.db2.gz	FOIJPDQMEBLMKR-INIZCTEOSA-N	0	3	335.517	3.170	20	30		EGEDHN
C=C(C)Cn1c([C@H]2CCCN(C)C2)nnc1N1CC[C@H](C)[C@H](C)C1	ZINC001343786598	1390736896	/nfs/dbraw/zinc/73/68/96/1390736896.db2.gz	GGLFCPYMJWILNY-BBWFWOEESA-N	0	3	331.508	3.146	20	30		EGEDHN
N#CCc1cccc(C(=O)C(C#N)c2nccn2Cc2ccccc2)c1	ZINC001343991827	1390748920	/nfs/dbraw/zinc/74/89/20/1390748920.db2.gz	YIADZLGAKXIVNY-LJQANCHMSA-N	0	3	340.386	3.488	20	30		EGEDHN
CCn1ccnc1C(C#N)C(=O)[C@H]1C[C@@H]1c1cc(F)c(F)c(F)c1	ZINC001346095198	1390907133	/nfs/dbraw/zinc/90/71/33/1390907133.db2.gz	AKHXWZCGCNXHFY-GRYCIOLGSA-N	0	3	333.313	3.300	20	30		EGEDHN
CC(=O)Nc1c[nH]nc1[C@H]1CCCN(CCC2(C#N)CCCCC2)C1	ZINC001348448442	1391221003	/nfs/dbraw/zinc/22/10/03/1391221003.db2.gz	BDIIXJXHGXSEDG-INIZCTEOSA-N	0	3	343.475	3.412	20	30		EGEDHN
COc1cccc([C@@H]2CCN(C(=O)[C@@H](N)CCCCC#N)C2(C)C)c1	ZINC001349848528	1391375669	/nfs/dbraw/zinc/37/56/69/1391375669.db2.gz	CEUWWTILFCJLFD-ROUUACIJSA-N	0	3	343.471	3.201	20	30		EGEDHN
C=CCCC[C@@H](N)C(=O)Nc1cc(F)cc(N2C[C@@H](C)O[C@@H](C)C2)c1	ZINC001354191653	1392126226	/nfs/dbraw/zinc/12/62/26/1392126226.db2.gz	YEUOVEGVOXURII-QWQRMKEZSA-N	0	3	349.450	3.061	20	30		EGEDHN
N#CC[C@@H](O)CN1CCC(COc2ccccc2C(F)(F)F)CC1	ZINC001354627485	1392157150	/nfs/dbraw/zinc/15/71/50/1392157150.db2.gz	XCJGBRNHLXPQMN-CQSZACIVSA-N	0	3	342.361	3.071	20	30		EGEDHN
C=C(Cl)CN[C@H](C)[C@H]1CCCCN1C(=O)c1cnc2ccccn21	ZINC001479828012	1392415422	/nfs/dbraw/zinc/41/54/22/1392415422.db2.gz	VGRYUBSPGOHXOW-HUUCEWRRSA-N	0	3	346.862	3.060	20	30		EGEDHN
C=C(Cl)CN[C@@H](C)[C@H]1CCCCN1C(=O)c1cccc(OC)c1	ZINC001479834223	1392420135	/nfs/dbraw/zinc/42/01/35/1392420135.db2.gz	OAKGEWXONJCMFK-WMLDXEAASA-N	0	3	336.863	3.421	20	30		EGEDHN
CCC(C)(C)CC(=O)NC[C@@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC001481093598	1393117812	/nfs/dbraw/zinc/11/78/12/1393117812.db2.gz	FZXGVFWOJFQFMS-SFHVURJKSA-N	0	3	327.472	3.323	20	30		EGEDHN
CC1(C(=O)NC[C@@H]2CCCN(Cc3cccc(C#N)c3)C2)CCC1	ZINC001491117283	1394436281	/nfs/dbraw/zinc/43/62/81/1394436281.db2.gz	QYAXJCVGHLCYQJ-SFHVURJKSA-N	0	3	325.456	3.077	20	30		EGEDHN
CC[C@H](CNC(=O)Cc1ccc(C)cc1)NCc1ccc(C#N)s1	ZINC001481830235	1394549212	/nfs/dbraw/zinc/54/92/12/1394549212.db2.gz	IMIFKSXBQHQELS-MRXNPFEDSA-N	0	3	341.480	3.155	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2cn3cc(C)ccc3n2)CCCC1	ZINC001481899555	1394586232	/nfs/dbraw/zinc/58/62/32/1394586232.db2.gz	ALSHROWYNLMVKJ-UHFFFAOYSA-N	0	3	346.862	3.027	20	30		EGEDHN
COc1ccc(CN(C)CCCN(C)C(=O)CC2(C)CC2)cc1C#N	ZINC001484751052	1395504169	/nfs/dbraw/zinc/50/41/69/1395504169.db2.gz	RBTQDYXLZKPQGY-UHFFFAOYSA-N	0	3	343.471	3.037	20	30		EGEDHN
CCCN(CCNC(=O)[C@H](C)C#N)Cc1ccc(C(C)C)nc1C	ZINC001493280737	1396339010	/nfs/dbraw/zinc/33/90/10/1396339010.db2.gz	OLBCKIDEBTVXQI-OAHLLOKOSA-N	0	3	330.476	3.001	20	30		EGEDHN
N#Cc1ccc(CN[C@@H](CNC(=O)c2ccc(Cl)o2)C2CC2)s1	ZINC001690143122	1404341214	/nfs/dbraw/zinc/34/12/14/1404341214.db2.gz	ORXHUZCNAGOGFO-ZDUSSCGKSA-N	0	3	349.843	3.164	20	30		EGEDHN
C=C(Br)CN[C@H]1C[C@@H](CNC(=O)C(C)(C)C(C)C)C1	ZINC001691098645	1405037112	/nfs/dbraw/zinc/03/71/12/1405037112.db2.gz	UADQMNWPFQYTRH-BETUJISGSA-N	0	3	331.298	3.062	20	30		EGEDHN
CCCC(C)(C)C(=O)NC[C@H]1CCN(Cc2cccc(C#N)c2)C1	ZINC001691156678	1405090648	/nfs/dbraw/zinc/09/06/48/1405090648.db2.gz	DKXWDJDFQZDXRK-GOSISDBHSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C(Cl)CN1CC[C@@H](N(CCC)C(=O)CN(C)CC(C)(C)C)C1	ZINC001732070200	1428318214	/nfs/dbraw/zinc/31/82/14/1428318214.db2.gz	CNTKEBQJZBBTGO-MRXNPFEDSA-N	0	3	343.943	3.030	20	30		EGEDHN
C[C@H](C#N)C(=O)NCC1(NCc2ccc(Cl)cc2F)CCCC1	ZINC001732389188	1428559314	/nfs/dbraw/zinc/55/93/14/1428559314.db2.gz	REYCFOHJANFYNK-GFCCVEGCSA-N	0	3	337.826	3.157	20	30		EGEDHN
C[C@@H](CNCc1ccc(C#N)s1)NC(=O)c1ccc(Cl)s1	ZINC001699429565	1412747291	/nfs/dbraw/zinc/74/72/91/1412747291.db2.gz	CUTZPOZEPXVQMC-VIFPVBQESA-N	0	3	339.873	3.243	20	30		EGEDHN
CCc1ccc(C(=O)N[C@@H](C)CN(C)Cc2cccc(C#N)c2)s1	ZINC001699457486	1412803496	/nfs/dbraw/zinc/80/34/96/1412803496.db2.gz	NUVUUNVJINBAGV-AWEZNQCLSA-N	0	3	341.480	3.432	20	30		EGEDHN
CCC(C)(C)C(=O)N[C@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001699595389	1412955777	/nfs/dbraw/zinc/95/57/77/1412955777.db2.gz	YWDGVODRWVUADC-QGZVFWFLSA-N	0	3	331.435	3.118	20	30		EGEDHN
CCCOc1cccc(CN2CCC(C)(NC(=O)[C@H](C)C#N)CC2)c1	ZINC001699772081	1413179411	/nfs/dbraw/zinc/17/94/11/1413179411.db2.gz	XKERAZONYNMYHH-MRXNPFEDSA-N	0	3	343.471	3.106	20	30		EGEDHN
C=C(Br)CN1[C@@H]2CC[C@H]1C[C@@H](CNC(=O)CC(C)C)C2	ZINC001699974853	1413413822	/nfs/dbraw/zinc/41/38/22/1413413822.db2.gz	BKXGUJADIGTAIK-QDMKHBRRSA-N	0	3	343.309	3.300	20	30		EGEDHN
Cc1c(F)cccc1C(=O)NC[C@@H](C)N(C)Cc1cccc(C#N)c1	ZINC001700464673	1414069083	/nfs/dbraw/zinc/06/90/83/1414069083.db2.gz	VTXFLPNCEJBHPM-CQSZACIVSA-N	0	3	339.414	3.256	20	30		EGEDHN
Cc1cc(C)cc(CC(=O)NC[C@H](C)N(C)Cc2cccc(C#N)c2)c1	ZINC001700475141	1414100936	/nfs/dbraw/zinc/10/09/36/1414100936.db2.gz	VOHLONFCVRRWLL-SFHVURJKSA-N	0	3	349.478	3.354	20	30		EGEDHN
C[C@H](CNC(=O)c1cccc2cc[nH]c21)N(C)Cc1cccc(C#N)c1	ZINC001700478755	1414110515	/nfs/dbraw/zinc/11/05/15/1414110515.db2.gz	TYKPBDNZJVQZER-OAHLLOKOSA-N	0	3	346.434	3.290	20	30		EGEDHN
CN(C(=O)C(C)(C)C)[C@H](CNCc1ccc(C#N)cc1F)C1CC1	ZINC001700730659	1414393972	/nfs/dbraw/zinc/39/39/72/1414393972.db2.gz	ALFLKTSQDXLXPR-QGZVFWFLSA-N	0	3	331.435	3.070	20	30		EGEDHN
Cc1ccc(CNCc2ccc(CNC(=O)[C@H](C)C#N)c(F)c2)cc1	ZINC001701063504	1414720910	/nfs/dbraw/zinc/72/09/10/1414720910.db2.gz	LISDBJPGHZZVGO-OAHLLOKOSA-N	0	3	339.414	3.200	20	30		EGEDHN
C[C@@H](NCc1ccc(C#N)cc1F)[C@@H]1CCCCN1C(=O)CCCF	ZINC001707433730	1417337605	/nfs/dbraw/zinc/33/76/05/1417337605.db2.gz	CNMKTSXBRCMNEY-KDOFPFPSSA-N	0	3	349.425	3.306	20	30		EGEDHN
C[C@H](CN(C)Cc1ccc(C#N)cc1)NC(=O)C1(C)CCCCC1	ZINC001733054177	1429195050	/nfs/dbraw/zinc/19/50/50/1429195050.db2.gz	HHIBZQXDGCYTOO-MRXNPFEDSA-N	0	3	327.472	3.465	20	30		EGEDHN
N#Cc1ccc(CN2CCC[C@H](CNC(=O)CCCC3CC3)C2)cc1	ZINC001713217424	1417796051	/nfs/dbraw/zinc/79/60/51/1417796051.db2.gz	BVIZIKHOUAOBLU-HXUWFJFHSA-N	0	3	339.483	3.467	20	30		EGEDHN
N#Cc1ccccc1CN[C@@H]1CCC[C@@H](NC(=O)CC(F)(F)F)C1	ZINC001713369637	1417981890	/nfs/dbraw/zinc/98/18/90/1417981890.db2.gz	UJVYPXVZJNLVFT-HUUCEWRRSA-N	0	3	339.361	3.028	20	30		EGEDHN
C=C(Br)CN[C@@H](C)CCNC(=O)c1cccc(C)c1F	ZINC001713408668	1418031655	/nfs/dbraw/zinc/03/16/55/1418031655.db2.gz	XHLPGFLKLLIGDR-LBPRGKRZSA-N	0	3	343.240	3.141	20	30		EGEDHN
CC[C@@H](CNC(=O)c1cccc(F)c1)NCc1ccc(C#N)s1	ZINC001714055445	1418853671	/nfs/dbraw/zinc/85/36/71/1418853671.db2.gz	GKEYWNYQXLGWLD-AWEZNQCLSA-N	0	3	331.416	3.057	20	30		EGEDHN
CC[C@@H](CNC(=O)CC1CCCC1)NCc1cc(C#N)ccc1OC	ZINC001714059443	1418857083	/nfs/dbraw/zinc/85/70/83/1418857083.db2.gz	YYOIAHYTTLRECR-SFHVURJKSA-N	0	3	343.471	3.132	20	30		EGEDHN
CC[C@H](CNC(=O)CC1CCCC1)NCc1cc(C#N)ccc1OC	ZINC001714059440	1418857182	/nfs/dbraw/zinc/85/71/82/1418857182.db2.gz	YYOIAHYTTLRECR-GOSISDBHSA-N	0	3	343.471	3.132	20	30		EGEDHN
Cc1cccc(C(=O)NCC[C@@H](C)NCc2ccccc2C#N)c1F	ZINC001714472162	1419197419	/nfs/dbraw/zinc/19/74/19/1419197419.db2.gz	PHTVSLSMSKYLBF-OAHLLOKOSA-N	0	3	339.414	3.304	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)CC[C@@H]2CCCCO2)CCCC1	ZINC001714507471	1419234953	/nfs/dbraw/zinc/23/49/53/1419234953.db2.gz	CACRAIXFMQLXTO-HNNXBMFYSA-N	0	3	328.884	3.107	20	30		EGEDHN
C[C@@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)c1ccoc1Cl	ZINC001714581572	1419321103	/nfs/dbraw/zinc/32/11/03/1419321103.db2.gz	CUTOOSKXGIYJOC-NSHDSACASA-N	0	3	349.793	3.194	20	30		EGEDHN
CC(C)(C(=O)NCC[C@@H]1CCN(Cc2ccccc2C#N)C1)C(F)F	ZINC001714876153	1419610244	/nfs/dbraw/zinc/61/02/44/1419610244.db2.gz	LLPKGZXZHGTPIR-CQSZACIVSA-N	0	3	349.425	3.178	20	30		EGEDHN
CC[C@@H](CNC(=O)c1ccc(F)cc1)NCc1ccc(C#N)s1	ZINC001715050970	1419792618	/nfs/dbraw/zinc/79/26/18/1419792618.db2.gz	MFSGATGBBZSVSU-AWEZNQCLSA-N	0	3	331.416	3.057	20	30		EGEDHN
CC[C@@H](CNC(=O)c1ccoc1Cl)NCc1ccc(C#N)s1	ZINC001715062956	1419801476	/nfs/dbraw/zinc/80/14/76/1419801476.db2.gz	ZYTHLJTYVYKBAE-JTQLQIEISA-N	0	3	337.832	3.164	20	30		EGEDHN
CC[C@H](CNC(=O)c1ccc(C)cc1)NCc1ccc(C#N)s1	ZINC001715083221	1419820579	/nfs/dbraw/zinc/82/05/79/1419820579.db2.gz	UBSIBYITKOIYOC-OAHLLOKOSA-N	0	3	327.453	3.226	20	30		EGEDHN
C=C(Cl)CNC1(CNC(=O)c2cc(F)ccc2OC)CCCC1	ZINC001715301798	1420009395	/nfs/dbraw/zinc/00/93/95/1420009395.db2.gz	RMEBRIFBUAIFGO-UHFFFAOYSA-N	0	3	340.826	3.219	20	30		EGEDHN
CC(C)SCC(=O)N[C@H]1CCC[C@@H]1CNCc1ccccc1C#N	ZINC001715546434	1420243432	/nfs/dbraw/zinc/24/34/32/1420243432.db2.gz	IEOZZBPMOOQKPZ-MSOLQXFVSA-N	0	3	345.512	3.074	20	30		EGEDHN
N#Cc1ccc(CNC2(CNC(=O)[C@@H](F)c3ccccc3)CC2)cc1	ZINC001733257449	1429408627	/nfs/dbraw/zinc/40/86/27/1429408627.db2.gz	NRBUZOUIKKPZTO-SFHVURJKSA-N	0	3	337.398	3.007	20	30		EGEDHN
CC(C)c1occc1C(=O)N[C@@H](C)CNCc1ccc(F)c(C#N)c1	ZINC001716009097	1420462298	/nfs/dbraw/zinc/46/22/98/1420462298.db2.gz	FIANSWMJZZTOSC-ZDUSSCGKSA-N	0	3	343.402	3.322	20	30		EGEDHN
Cc1cc(C(=O)NCC2(NCc3ccc(C#N)cc3)CC2)sc1C	ZINC001716699973	1420852904	/nfs/dbraw/zinc/85/29/04/1420852904.db2.gz	KKVPFMYGKVKGKC-UHFFFAOYSA-N	0	3	339.464	3.289	20	30		EGEDHN
N#Cc1cccc(CNC2(CNC(=O)c3coc4ccccc34)CC2)c1	ZINC001716702389	1420855406	/nfs/dbraw/zinc/85/54/06/1420855406.db2.gz	YAOJZXQWUIVUFA-UHFFFAOYSA-N	0	3	345.402	3.357	20	30		EGEDHN
CC(F)(F)CC(=O)NCC1(C)CCN(Cc2cccc(C#N)c2)CC1	ZINC001716887201	1421011000	/nfs/dbraw/zinc/01/10/00/1421011000.db2.gz	DUZDXPJTTNPUQM-UHFFFAOYSA-N	0	3	349.425	3.322	20	30		EGEDHN
C=C(Cl)CNCC(C)(C)CN(C)C(=O)[C@H](OC)c1ccccc1	ZINC001717460613	1421389854	/nfs/dbraw/zinc/38/98/54/1421389854.db2.gz	VLLPHNALMIWZDD-MRXNPFEDSA-N	0	3	338.879	3.201	20	30		EGEDHN
Cc1occc1C(=O)N1CC[C@](C)(CNCc2ccccc2C#N)C1	ZINC001733419131	1429624183	/nfs/dbraw/zinc/62/41/83/1429624183.db2.gz	QPZHPSIGDMJALW-HXUWFJFHSA-N	0	3	337.423	3.102	20	30		EGEDHN
CC1(C(=O)N2CC[C@](C)(CNCc3ccccc3C#N)C2)CCCC1	ZINC001733434739	1429641973	/nfs/dbraw/zinc/64/19/73/1429641973.db2.gz	ZWDKREOXFVKBGL-HXUWFJFHSA-N	0	3	339.483	3.467	20	30		EGEDHN
C[C@@]1(CNC(=O)CC2CC2)CCCN(Cc2ccc(C#N)cc2)C1	ZINC001733453928	1429668359	/nfs/dbraw/zinc/66/83/59/1429668359.db2.gz	AIIVPRJPILZCDE-FQEVSTJZSA-N	0	3	325.456	3.077	20	30		EGEDHN
CC1(CC(=O)NC[C@@]2(C)CCCN(Cc3cccc(C#N)c3)C2)CC1	ZINC001733464013	1429693405	/nfs/dbraw/zinc/69/34/05/1429693405.db2.gz	SFQAQIKOGQFWQI-OAQYLSRUSA-N	0	3	339.483	3.467	20	30		EGEDHN
C[C@H](C(=O)NCC1(NCc2cccc(C#N)c2)CC1)c1ccsc1	ZINC001723558745	1424465172	/nfs/dbraw/zinc/46/51/72/1424465172.db2.gz	UYJGQNGANSVOON-AWEZNQCLSA-N	0	3	339.464	3.162	20	30		EGEDHN
C[C@@H](CNC(=O)c1ccc2cc[nH]c2c1)N(C)Cc1ccc(C#N)cc1	ZINC001725187791	1425724286	/nfs/dbraw/zinc/72/42/86/1425724286.db2.gz	XGMGLDXYGWVEEG-HNNXBMFYSA-N	0	3	346.434	3.290	20	30		EGEDHN
CCCC[C@H](CNCc1ccc(C#N)s1)NC(=O)c1ccc[nH]1	ZINC001725230586	1425803034	/nfs/dbraw/zinc/80/30/34/1425803034.db2.gz	ZSGXUMFXLCYXMV-CYBMUJFWSA-N	0	3	330.457	3.026	20	30		EGEDHN
C=C(Br)CNC[C@H](NC(=O)CC1(C)CC1)C(C)(C)C	ZINC001725747476	1426425449	/nfs/dbraw/zinc/42/54/49/1426425449.db2.gz	YATOVAIUUJILRK-LBPRGKRZSA-N	0	3	331.298	3.206	20	30		EGEDHN
C[C@H](C#N)C(=O)N(C)C1CCN([C@H]2CCc3c2cccc3Cl)CC1	ZINC001731346920	1427284916	/nfs/dbraw/zinc/28/49/16/1427284916.db2.gz	SWKILUZXTLCYAG-ACJLOTCBSA-N	0	3	345.874	3.410	20	30		EGEDHN
CCN(CCNC(=O)[C@H]1CCCC1(C)C)Cc1cccc(C#N)c1	ZINC001731809981	1427988932	/nfs/dbraw/zinc/98/89/32/1427988932.db2.gz	YLWGWJBGSVNIHR-GOSISDBHSA-N	0	3	327.472	3.323	20	30		EGEDHN
CCCC(=O)N[C@@H]1CCN(Cc2ccc(OCC#N)cc2)CC1(C)C	ZINC001733872996	1437699121	/nfs/dbraw/zinc/69/91/21/1437699121.db2.gz	WBDBVSFJAQNJLX-GOSISDBHSA-N	0	3	343.471	3.106	20	30		EGEDHN
C=C(Br)CNCC(C)(C)CN(C)C(=O)C1CC2(CC2)C1	ZINC001734022965	1437811507	/nfs/dbraw/zinc/81/15/07/1437811507.db2.gz	UDXFICYMRHVYSO-UHFFFAOYSA-N	0	3	343.309	3.159	20	30		EGEDHN
CC1(C(=O)NC[C@@H]2CCCCCN2Cc2ccc(C#N)cc2)CC1	ZINC001734098994	1437883430	/nfs/dbraw/zinc/88/34/30/1437883430.db2.gz	GDMRTBXOROQRHJ-SFHVURJKSA-N	0	3	325.456	3.219	20	30		EGEDHN
C=C1CCC(C(=O)NCCCN(C)Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC001752056502	1440136209	/nfs/dbraw/zinc/13/62/09/1440136209.db2.gz	UIMMCUVIUPVKQQ-UHFFFAOYSA-N	0	3	345.443	3.279	20	30		EGEDHN
CCN(CCCNC(=O)[C@@H]1CCC[C@H]2C[C@H]21)Cc1ccc(C#N)s1	ZINC001752193145	1440152755	/nfs/dbraw/zinc/15/27/55/1440152755.db2.gz	MVKWONVDNZAUKM-BMGDILEWSA-N	0	3	345.512	3.384	20	30		EGEDHN
CCN(CC#Cc1ccc(F)cc1)CCCNC(=O)[C@H]1CC12CCC2	ZINC001752214713	1440155580	/nfs/dbraw/zinc/15/55/80/1440155580.db2.gz	CERJUIPJWOSZPM-LJQANCHMSA-N	0	3	342.458	3.196	20	30		EGEDHN
N#Cc1cc(CN(CCCNC(=O)CC2CCC2)C2CC2)ccc1F	ZINC001752251542	1440160554	/nfs/dbraw/zinc/16/05/54/1440160554.db2.gz	KFLDLMXVHDTUSW-UHFFFAOYSA-N	0	3	343.446	3.358	20	30		EGEDHN
CC#CCN(CCCNC(=O)c1cc(C)nc2ccccc21)C1CC1	ZINC001752284224	1440165015	/nfs/dbraw/zinc/16/50/15/1440165015.db2.gz	DLFZXVBXTKEBBJ-UHFFFAOYSA-N	0	3	335.451	3.151	20	30		EGEDHN
CC1(C)C(C(=O)NC[C@@H](NCc2ccc(C#N)s2)C2CC2)C1(C)C	ZINC001752454959	1440183116	/nfs/dbraw/zinc/18/31/16/1440183116.db2.gz	SNVYDQJRJGEPRY-OAHLLOKOSA-N	0	3	345.512	3.286	20	30		EGEDHN
C[C@H](C(=O)NC[C@H](NCC#Cc1ccc(F)cc1)C1CC1)C1CCC1	ZINC001752468795	1440184098	/nfs/dbraw/zinc/18/40/98/1440184098.db2.gz	NREGCFGPMSMFBP-YWZLYKJASA-N	0	3	342.458	3.098	20	30		EGEDHN
C[C@@H](C(=O)NC[C@@H](NCC#Cc1ccc(F)cc1)C1CC1)C1CCC1	ZINC001752468792	1440184110	/nfs/dbraw/zinc/18/41/10/1440184110.db2.gz	NREGCFGPMSMFBP-FOIQADDNSA-N	0	3	342.458	3.098	20	30		EGEDHN
C[C@H](C(=O)NC[C@H](NCc1ccc(C#N)s1)C1CC1)c1ccco1	ZINC001752481719	1440185734	/nfs/dbraw/zinc/18/57/34/1440185734.db2.gz	GHKXGLQSAOOPEL-LRDDRELGSA-N	0	3	343.452	3.001	20	30		EGEDHN
C=CCCC(=O)N1CCC[C@H](CN(C)Cc2c(C)noc2CC)C1	ZINC001752502616	1440188570	/nfs/dbraw/zinc/18/85/70/1440188570.db2.gz	GURJQCHIXICGKJ-MRXNPFEDSA-N	0	3	333.476	3.182	20	30		EGEDHN
C=CCC(C)(C)C(=O)NC[C@@H](NCc1ccc(Cl)nc1)C1CC1	ZINC001752509020	1440190079	/nfs/dbraw/zinc/19/00/79/1440190079.db2.gz	BIDXRDHYBXPDDW-OAHLLOKOSA-N	0	3	335.879	3.322	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)c1cc(CC)ccn1	ZINC001752534095	1440194050	/nfs/dbraw/zinc/19/40/50/1440194050.db2.gz	GHCVTIBISCQPIE-RYQLBKOJSA-N	0	3	327.472	3.288	20	30		EGEDHN
C=CCC[C@@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)[C@H](OC)C1CCCC1	ZINC001752544560	1440195024	/nfs/dbraw/zinc/19/50/24/1440195024.db2.gz	BXLYOEHLSBUFRA-OQIJWPOYSA-N	0	3	334.504	3.222	20	30		EGEDHN
C=CCCCN1C[C@H]2CC[C@@H](C1)N2C(=O)COc1cccc(Cl)c1	ZINC001752544772	1440195033	/nfs/dbraw/zinc/19/50/33/1440195033.db2.gz	GLDURHRYPVCLIN-CALCHBBNSA-N	0	3	348.874	3.360	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@H]2CC[C@@H](C1)N2C(=O)[C@@H](C)OCCC(C)C	ZINC001752566715	1440195403	/nfs/dbraw/zinc/19/54/03/1440195403.db2.gz	IJAKFKRFKGBCID-ZSYWTGECSA-N	0	3	336.520	3.468	20	30		EGEDHN
C=CCC1(C(=O)N2CC[C@H](NCc3sc(C)nc3C)C2)CCC1	ZINC001752605008	1440196202	/nfs/dbraw/zinc/19/62/02/1440196202.db2.gz	LQVZBXQXICPKMO-HNNXBMFYSA-N	0	3	333.501	3.197	20	30		EGEDHN
CC(C)(C)C#CC(=O)N[C@H]1C[C@H](NCc2cccc(Cl)c2F)C1	ZINC001752628641	1440197001	/nfs/dbraw/zinc/19/70/01/1440197001.db2.gz	JHWXQNFMNLDPEI-HDJSIYSDSA-N	0	3	336.838	3.265	20	30		EGEDHN
C=CC(C)(C)CC(=O)N[C@H]1C[C@H](NCc2cnc(Cl)s2)C1	ZINC001752632936	1440197178	/nfs/dbraw/zinc/19/71/78/1440197178.db2.gz	MQPAOBAUVLOCIU-XYPYZODXSA-N	0	3	327.881	3.136	20	30		EGEDHN
CC#CCN1CC[C@@H]2[C@H](CCCN2C(=O)CCCc2ccsc2)C1	ZINC001752704979	1440202387	/nfs/dbraw/zinc/20/23/87/1440202387.db2.gz	IKXWCNDUHHBNFO-RTBURBONSA-N	0	3	344.524	3.407	20	30		EGEDHN
C[C@@H](C(=O)NC[C@H]1CCCN(Cc2cccc(C#N)c2)C1)C1CCC1	ZINC001752781938	1440209251	/nfs/dbraw/zinc/20/92/51/1440209251.db2.gz	BBHLCLNJNDLSHV-VQIMIIECSA-N	0	3	339.483	3.323	20	30		EGEDHN
C=CCOCCN1CCCC[C@@H]1CNC(=O)C1[C@H]2CCCCCC[C@H]12	ZINC001752822251	1440221131	/nfs/dbraw/zinc/22/11/31/1440221131.db2.gz	CTHNNLRNAQHEIE-QYZOEREBSA-N	0	3	348.531	3.376	20	30		EGEDHN
C#CCCN1CCCC[C@H]1CNC(=O)C(C)(C)c1ccc(C)cc1	ZINC001752824123	1440222499	/nfs/dbraw/zinc/22/24/99/1440222499.db2.gz	PTOVCGCAYNYIKS-IBGZPJMESA-N	0	3	326.484	3.267	20	30		EGEDHN
CC#CCN1CCC[C@H]([C@H](C)NC(=O)Cc2cc(F)c(C)cc2F)C1	ZINC001752836448	1440228054	/nfs/dbraw/zinc/22/80/54/1440228054.db2.gz	NHDGNFRXIRLRSZ-HOTGVXAUSA-N	0	3	348.437	3.056	20	30		EGEDHN
Cc1oc(C)c(C(=O)NC[C@@H](C)NCc2ccc(C#N)s2)c1C	ZINC001752886707	1440239954	/nfs/dbraw/zinc/23/99/54/1440239954.db2.gz	IOIYMCWKIBADPE-SNVBAGLBSA-N	0	3	331.441	3.046	20	30		EGEDHN
CCCC[C@](C)(F)C(=O)N1CC[C@H](CNCc2ccccc2C#N)C1	ZINC001752943310	1440251124	/nfs/dbraw/zinc/25/11/24/1440251124.db2.gz	KRWXUFGLEZBTEF-UZLBHIALSA-N	0	3	345.462	3.415	20	30		EGEDHN
CC#CCCCC(=O)N[C@@H]1CCC[C@H](NCc2ccn(C(C)C)n2)C1	ZINC001752975718	1440255941	/nfs/dbraw/zinc/25/59/41/1440255941.db2.gz	FGDQJAHVYZGRBO-ZWKOTPCHSA-N	0	3	344.503	3.175	20	30		EGEDHN
C#CCCCCCC(=O)N[C@H]1CCC[C@@H](NCc2cnc(C)o2)C1	ZINC001752975778	1440255953	/nfs/dbraw/zinc/25/59/53/1440255953.db2.gz	FYLLDSAVOPMOKZ-SJORKVTESA-N	0	3	331.460	3.084	20	30		EGEDHN
C=CCC(CC=C)C(=O)N1CCC[C@H](N(C)CCc2ccns2)C1	ZINC001752992840	1440260045	/nfs/dbraw/zinc/26/00/45/1440260045.db2.gz	UMXNAMMDUMQJHZ-KRWDZBQOSA-N	0	3	347.528	3.377	20	30		EGEDHN
CC#CCN(C)[C@@H]1CCCN(C(=O)C[C@@H](C)c2ccc(OC)cc2)C1	ZINC001753000011	1440264155	/nfs/dbraw/zinc/26/41/55/1440264155.db2.gz	LVCDECMMQJKLJJ-IEBWSBKVSA-N	0	3	342.483	3.135	20	30		EGEDHN
C=C(Cl)CN[C@H](C)CCNC(=O)c1cc(Cl)ccc1OC	ZINC001753017962	1440269122	/nfs/dbraw/zinc/26/91/22/1440269122.db2.gz	CUDWFFDPWVLBHZ-LLVKDONJSA-N	0	3	331.243	3.199	20	30		EGEDHN
C=CCCC(=O)NCCN(C)Cc1ccc(Br)c(C)c1	ZINC001753044602	1440277532	/nfs/dbraw/zinc/27/75/32/1440277532.db2.gz	BRLBUXSZJVPFSJ-UHFFFAOYSA-N	0	3	339.277	3.272	20	30		EGEDHN
Cc1c(C)c(C)c(CN(C)CCNC(=O)C#CC(C)C)c(C)c1C	ZINC001753048190	1440278389	/nfs/dbraw/zinc/27/83/89/1440278389.db2.gz	JAXJDJFWURINPJ-UHFFFAOYSA-N	0	3	328.500	3.436	20	30		EGEDHN
Cc1ccccc1C[C@@H](C)C(=O)N(C)CCNCc1cccc(C#N)c1	ZINC001753266326	1440344760	/nfs/dbraw/zinc/34/47/60/1440344760.db2.gz	JSZOZCWYSMFTFZ-GOSISDBHSA-N	0	3	349.478	3.294	20	30		EGEDHN
CC(C)N(CCCNC(=O)[C@H](C)C#N)Cc1ccc(Cl)cc1F	ZINC001753284580	1440348382	/nfs/dbraw/zinc/34/83/82/1440348382.db2.gz	DCPGOGRLWONJEM-CYBMUJFWSA-N	0	3	339.842	3.355	20	30		EGEDHN
C=CCN[C@H](CNC(=O)[C@@H]1CCc2cc(F)ccc21)c1ccccc1	ZINC001753300418	1440353670	/nfs/dbraw/zinc/35/36/70/1440353670.db2.gz	RZUAHVHAFWXERA-WOJBJXKFSA-N	0	3	338.426	3.489	20	30		EGEDHN
C#CCCN[C@@H](CNC(=O)c1cnoc1-c1ccco1)c1ccccc1	ZINC001753300007	1440353764	/nfs/dbraw/zinc/35/37/64/1440353764.db2.gz	LZLLIFCJBWDTBC-KRWDZBQOSA-N	0	3	349.390	3.019	20	30		EGEDHN
C#CCCN[C@@H](CNC(=O)Cc1cc2ccccc2o1)c1ccccc1	ZINC001753300723	1440353816	/nfs/dbraw/zinc/35/38/16/1440353816.db2.gz	YZSLEDMGIQNLDT-FQEVSTJZSA-N	0	3	346.430	3.446	20	30		EGEDHN
C#CCCN[C@H](CNC(=O)c1ccc2c(c1)C[C@H](C)O2)c1ccccc1	ZINC001753309020	1440356127	/nfs/dbraw/zinc/35/61/27/1440356127.db2.gz	AUQANVWPZGXOGY-OXJNMPFZSA-N	0	3	348.446	3.094	20	30		EGEDHN
C=C[C@@H](CC)CC(=O)N1CCC(CN(C)Cc2cnoc2C)CC1	ZINC001753365320	1440384737	/nfs/dbraw/zinc/38/47/37/1440384737.db2.gz	CBGNCAVLTYBZLO-INIZCTEOSA-N	0	3	333.476	3.256	20	30		EGEDHN
C=CC1(CC(=O)NCC2CN(C[C@@H]3CC[C@@H](C)O3)C2)CCCCC1	ZINC001753412977	1440393690	/nfs/dbraw/zinc/39/36/90/1440393690.db2.gz	WGLDHBZCNLUJLC-AEFFLSMTSA-N	0	3	334.504	3.129	20	30		EGEDHN
C=CCC[C@H](C)N1C[C@@H]2C[C@H]1CN2C(=O)c1cnn(C(C)C)c1C	ZINC001753426310	1440396837	/nfs/dbraw/zinc/39/68/37/1440396837.db2.gz	VBUJEYZPQABBST-XIRDDKMYSA-N	0	3	330.476	3.026	20	30		EGEDHN
C#CCCCCC(=O)N(C)[C@H]1CCN(Cc2ccc3ncccc3c2)C1	ZINC001753434352	1440399592	/nfs/dbraw/zinc/39/95/92/1440399592.db2.gz	CCYCQKZGNODQEU-FQEVSTJZSA-N	0	3	349.478	3.461	20	30		EGEDHN
CC#CCCCC(=O)N(C)[C@@H]1CCN(Cc2cccc3cccnc32)C1	ZINC001753442287	1440402328	/nfs/dbraw/zinc/40/23/28/1440402328.db2.gz	ZKZTZQSUKBMEMP-HXUWFJFHSA-N	0	3	349.478	3.461	20	30		EGEDHN
C=C[C@](C)(CC)C(=O)N(C)[C@H]1CCN(CCOCc2ccccc2)C1	ZINC001753444388	1440403063	/nfs/dbraw/zinc/40/30/63/1440403063.db2.gz	QBSWUNBJNHYQJD-PZJWPPBQSA-N	0	3	344.499	3.338	20	30		EGEDHN
C#CCCN1CC[C@@H](N(C)C(=O)CCCCCc2cccs2)C1	ZINC001753446971	1440404271	/nfs/dbraw/zinc/40/42/71/1440404271.db2.gz	QDROWLSZTIAYPQ-QGZVFWFLSA-N	0	3	332.513	3.407	20	30		EGEDHN
C#CCCCC(=O)N(CC)[C@H]1CCN([C@@H](C)c2cccc(OC)c2)C1	ZINC001753456042	1440408189	/nfs/dbraw/zinc/40/81/89/1440408189.db2.gz	QXNLNKMJEDIFDR-HKUYNNGSSA-N	0	3	342.483	3.483	20	30		EGEDHN
C#CCCCC(=O)N(CC)[C@H]1CCN([C@H](C)c2cccc(OC)c2)C1	ZINC001753456044	1440408219	/nfs/dbraw/zinc/40/82/19/1440408219.db2.gz	QXNLNKMJEDIFDR-MJGOQNOKSA-N	0	3	342.483	3.483	20	30		EGEDHN
C=C(C)CN1CC[C@@H](N(CC)C(=O)COc2cc(C)ccc2F)C1	ZINC001753457655	1440409030	/nfs/dbraw/zinc/40/90/30/1440409030.db2.gz	VVDHNOUFCZWGRK-MRXNPFEDSA-N	0	3	334.435	3.012	20	30		EGEDHN
CC[C@@H](CNC(=O)c1c[nH]c(C#N)c1)N[C@@H](C)c1ccccc1Cl	ZINC001753473816	1440414668	/nfs/dbraw/zinc/41/46/68/1440414668.db2.gz	VRNYDVZRSWZSHU-JSGCOSHPSA-N	0	3	344.846	3.399	20	30		EGEDHN
CC[C@H](CNC(=O)c1cccnc1C1CC1)NCC#Cc1ccccc1	ZINC001753477529	1440415627	/nfs/dbraw/zinc/41/56/27/1440415627.db2.gz	NYZINSKVGKQEAM-LJQANCHMSA-N	0	3	347.462	3.109	20	30		EGEDHN
C#CCC1(C(=O)NC[C@H](CC)NCc2ccccn2)CCCCC1	ZINC001753497984	1440422443	/nfs/dbraw/zinc/42/24/43/1440422443.db2.gz	SODSTGOFNGYELW-KRWDZBQOSA-N	0	3	327.472	3.040	20	30		EGEDHN
CC#CCCCC(=O)NC1(CNCc2c(C)noc2CC)CCCC1	ZINC001753507021	1440424760	/nfs/dbraw/zinc/42/47/60/1440424760.db2.gz	JUPOIDVASJLPAT-UHFFFAOYSA-N	0	3	345.487	3.258	20	30		EGEDHN
C=C(Cl)CNCC1(NC(=O)c2cc(F)c(F)cc2F)CCCC1	ZINC001753507182	1440424792	/nfs/dbraw/zinc/42/47/92/1440424792.db2.gz	PBBBDYJEMNGFJP-UHFFFAOYSA-N	0	3	346.780	3.489	20	30		EGEDHN
CC(C)CCC(=O)N[C@@](C)(CNCC#Cc1ccc(F)cc1)C1CC1	ZINC001753513790	1440426852	/nfs/dbraw/zinc/42/68/52/1440426852.db2.gz	WGHFWWATZOXIDE-NRFANRHFSA-N	0	3	344.474	3.488	20	30		EGEDHN
C=C(Cl)CNC[C@](C)(NC(=O)C1Cc2ccccc2C1)C1CC1	ZINC001753524668	1440429327	/nfs/dbraw/zinc/42/93/27/1440429327.db2.gz	JDGXKJYUMOLLCJ-IBGZPJMESA-N	0	3	332.875	3.028	20	30		EGEDHN
C[C@@H]1CCCC[C@@]1(CNCC#Cc1ccccc1)NC(=O)c1cc[nH]c1	ZINC001753532603	1440431461	/nfs/dbraw/zinc/43/14/61/1440431461.db2.gz	TWRIGKPAOMISHN-GCJKJVERSA-N	0	3	349.478	3.335	20	30		EGEDHN
CC[C@H](C)C(=O)N1CCC[C@@H](CCNCc2cc(C#N)ccc2F)C1	ZINC001753541983	1440433640	/nfs/dbraw/zinc/43/36/40/1440433640.db2.gz	YOWZWIQECMGCRY-HOTGVXAUSA-N	0	3	345.462	3.462	20	30		EGEDHN
C=CC(C)(C)CC(=O)N1CCC[C@@H](CCNCc2cnc(C)o2)C1	ZINC001753548458	1440434669	/nfs/dbraw/zinc/43/46/69/1440434669.db2.gz	MATOBLSZWOYUGE-INIZCTEOSA-N	0	3	333.476	3.304	20	30		EGEDHN
C=C(Cl)CNCC[C@@H]1CCCN(C(=O)CCc2cncs2)C1	ZINC001753556854	1440436146	/nfs/dbraw/zinc/43/61/46/1440436146.db2.gz	YQRLRUIKXDZZLL-AWEZNQCLSA-N	0	3	341.908	3.047	20	30		EGEDHN
CC/C(C)=C\C(=O)N[C@H]1CC[C@H](NCc2ccccc2C#N)CC1	ZINC001753580919	1440440191	/nfs/dbraw/zinc/44/01/91/1440440191.db2.gz	XIRJFTUPACTCNT-XFTFTGCRSA-N	0	3	325.456	3.432	20	30		EGEDHN
C=C(Br)CNC[C@H]1[C@@H](C)CCCN1C(=O)C=C(C)C	ZINC001753803239	1440491428	/nfs/dbraw/zinc/49/14/28/1440491428.db2.gz	KYHUDENRAWCFRW-JSGCOSHPSA-N	0	3	329.282	3.078	20	30		EGEDHN
C#CCNCc1ccc(CNC(=O)[C@@H](C)c2cccc(Cl)c2)cc1	ZINC001753592499	1440443231	/nfs/dbraw/zinc/44/32/31/1440443231.db2.gz	PHZORKVJFGWSNF-HNNXBMFYSA-N	0	3	340.854	3.483	20	30		EGEDHN
C[C@@H](CNCc1ccccc1C#N)CNC(=O)[C@@H](C)c1ccsc1	ZINC001753630863	1440452231	/nfs/dbraw/zinc/45/22/31/1440452231.db2.gz	PUVGPSREBLIYBH-GJZGRUSLSA-N	0	3	341.480	3.265	20	30		EGEDHN
CC(C)C(=O)NCC1(NCC#Cc2cccc(Cl)c2)CCCC1	ZINC001753660990	1440458657	/nfs/dbraw/zinc/45/86/57/1440458657.db2.gz	WAIQJFSYIRITGA-UHFFFAOYSA-N	0	3	332.875	3.366	20	30		EGEDHN
CC(F)(F)CC(=O)NCC1(NCC#Cc2ccccc2)CCCC1	ZINC001753668823	1440461194	/nfs/dbraw/zinc/46/11/94/1440461194.db2.gz	UFIYVWLWTVMEPI-UHFFFAOYSA-N	0	3	334.410	3.102	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccccc1)N(C)C(=O)C[C@H]1CCC(F)(F)C1	ZINC001753694716	1440467253	/nfs/dbraw/zinc/46/72/53/1440467253.db2.gz	FGNOEQUHMMSWPB-FUHWJXTLSA-N	0	3	348.437	3.300	20	30		EGEDHN
C[C@H](CNCc1ccc(F)c(C#N)c1)N(C)C(=O)[C@@H]1CC[C@@H](C)CC1	ZINC001753723795	1440473861	/nfs/dbraw/zinc/47/38/61/1440473861.db2.gz	POGXJOBVTXXADM-BFYDXBDKSA-N	0	3	345.462	3.460	20	30		EGEDHN
Cc1cccnc1CNC[C@@H](NC(=O)C#CC(C)C)C1CCCCC1	ZINC001753746317	1440481115	/nfs/dbraw/zinc/48/11/15/1440481115.db2.gz	SSDXMOGJRRDPBJ-HXUWFJFHSA-N	0	3	341.499	3.204	20	30		EGEDHN
C=C(Cl)CNCC[C@H]1CCCCN1C(=O)[C@@H](CC(C)C)OC	ZINC001753794914	1440489603	/nfs/dbraw/zinc/48/96/03/1440489603.db2.gz	DLYKFJYMDHJFLR-HZPDHXFCSA-N	0	3	330.900	3.161	20	30		EGEDHN
CC#CCCCC(=O)N1CCC[C@@H]([C@@H](C)NCc2cscn2)C1	ZINC001753815524	1440493630	/nfs/dbraw/zinc/49/36/30/1440493630.db2.gz	OBAIOZRTZWHMAU-HZPDHXFCSA-N	0	3	333.501	3.053	20	30		EGEDHN
CC[C@H](C)C(=O)NC[C@H](NCC#Cc1cccc(Cl)c1)C(C)C	ZINC001753825292	1440498043	/nfs/dbraw/zinc/49/80/43/1440498043.db2.gz	VCDZEBVKMLTFJF-YJBOKZPZSA-N	0	3	334.891	3.468	20	30		EGEDHN
CC(C)[C@H](CNC(=O)CCC(C)(F)F)NCC#Cc1ccccc1	ZINC001753835406	1440500838	/nfs/dbraw/zinc/50/08/38/1440500838.db2.gz	RQANPFCPUKAPDR-KRWDZBQOSA-N	0	3	336.426	3.204	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@H]2[C@H](CCN2Cc2oc(CC)nc2C)C1	ZINC001753873357	1440518181	/nfs/dbraw/zinc/51/81/81/1440518181.db2.gz	SCZYWYPUBNRWGJ-SJORKVTESA-N	0	3	345.487	3.325	20	30		EGEDHN
CCCCCCCCC(=O)N1CC[C@H]2[C@@H](CCN2CC#CCOC)C1	ZINC001753875826	1440519292	/nfs/dbraw/zinc/51/92/92/1440519292.db2.gz	NMTDTJKFQHPYMA-PMACEKPBSA-N	0	3	348.531	3.310	20	30		EGEDHN
CC(C)C#CC(=O)N[C@@H]1CCC[C@@H]1CNCc1csc(C2CC2)n1	ZINC001753883930	1440520847	/nfs/dbraw/zinc/52/08/47/1440520847.db2.gz	BYODOHOJXWPBGJ-NVXWUHKLSA-N	0	3	345.512	3.054	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1CCC[C@@H]1CNCc1nc(C)sc1C	ZINC001753887431	1440521515	/nfs/dbraw/zinc/52/15/15/1440521515.db2.gz	JHEMUCWDYNCCGA-CVEARBPZSA-N	0	3	335.517	3.491	20	30		EGEDHN
CC#CCCCC(=O)N[C@H]1CCC[C@@H]1CNCc1csc(C)n1	ZINC001753897120	1440523035	/nfs/dbraw/zinc/52/30/35/1440523035.db2.gz	ZZOIWMGECTYOHV-WBVHZDCISA-N	0	3	333.501	3.020	20	30		EGEDHN
C[C@@H](CCNCc1cc(C#N)ccc1F)NC(=O)[C@@H]1CC=CCC1	ZINC001753944180	1440524740	/nfs/dbraw/zinc/52/47/40/1440524740.db2.gz	IDJQWNCKFLHYGB-GOEBONIOSA-N	0	3	329.419	3.038	20	30		EGEDHN
C[C@@H](CCNCc1ccccc1C#N)NC(=O)c1cccnc1C1CC1	ZINC001753979099	1440527790	/nfs/dbraw/zinc/52/77/90/1440527790.db2.gz	DAYBFYLPWAKJIL-HNNXBMFYSA-N	0	3	348.450	3.129	20	30		EGEDHN
CCN(CCNCc1cccc(C#N)c1)C(=O)c1sccc1F	ZINC001754043346	1440535000	/nfs/dbraw/zinc/53/50/00/1440535000.db2.gz	LUAUWXZXNYLDDK-UHFFFAOYSA-N	0	3	331.416	3.011	20	30		EGEDHN
CCN(CCNCc1cccc(C#N)c1)C(=O)C[C@H]1C=CCCC1	ZINC001754052351	1440535820	/nfs/dbraw/zinc/53/58/20/1440535820.db2.gz	ZFVPANCPDWAXMG-KRWDZBQOSA-N	0	3	325.456	3.243	20	30		EGEDHN
N#Cc1cccc(CNC/C=C\CNC(=O)[C@H]2CCCC3(CC3)C2)c1	ZINC001754119254	1440542537	/nfs/dbraw/zinc/54/25/37/1440542537.db2.gz	JGWLPRFNWVIHOW-AHUOSZMWSA-N	0	3	337.467	3.291	20	30		EGEDHN
CC(C(=O)N[C@H](C)CNCc1ccc(C#N)c(F)c1)=C1CCCC1	ZINC001754222134	1440552875	/nfs/dbraw/zinc/55/28/75/1440552875.db2.gz	CVQMAMMKLXVKAM-CYBMUJFWSA-N	0	3	329.419	3.182	20	30		EGEDHN
C[C@H](CNCc1ccc(F)c(C#N)c1)NC(=O)[C@@H]1CCC=CCCC1	ZINC001754230854	1440553949	/nfs/dbraw/zinc/55/39/49/1440553949.db2.gz	KZMNVVCCOMYHDL-NVXWUHKLSA-N	0	3	343.446	3.428	20	30		EGEDHN
C=C1CCC(C(=O)N[C@H](C)CNCc2cc(C)ccc2OC)CC1	ZINC001754241138	1440555767	/nfs/dbraw/zinc/55/57/67/1440555767.db2.gz	CZOJBBFMSOINDX-MRXNPFEDSA-N	0	3	330.472	3.344	20	30		EGEDHN
C[C@H](CNCc1ccc(C#N)s1)NC(=O)[C@H](C)Cc1ccccc1	ZINC001754254632	1440558831	/nfs/dbraw/zinc/55/88/31/1440558831.db2.gz	JKXFIWIKQATWFT-HUUCEWRRSA-N	0	3	341.480	3.093	20	30		EGEDHN
Cc1ccc(CCC(=O)N[C@H](C)CNCc2ccc(C#N)s2)s1	ZINC001754256264	1440559329	/nfs/dbraw/zinc/55/93/29/1440559329.db2.gz	VGRQKSSXKLXBHW-GFCCVEGCSA-N	0	3	347.509	3.217	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccc(Cl)cc1)NC(=O)CCc1ccco1	ZINC001754262797	1440560297	/nfs/dbraw/zinc/56/02/97/1440560297.db2.gz	LTHCCBNHRIUYRK-HNNXBMFYSA-N	0	3	344.842	3.012	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccc(F)cc1)NC(=O)c1cccc2[nH]ccc21	ZINC001754285189	1440564033	/nfs/dbraw/zinc/56/40/33/1440564033.db2.gz	MCDNLLAJFPZREA-HNNXBMFYSA-N	0	3	349.409	3.067	20	30		EGEDHN
Cc1ccc(C(=O)N[C@@H](C)CNCC#Cc2cccc(Cl)c2)cc1	ZINC001754291389	1440565280	/nfs/dbraw/zinc/56/52/80/1440565280.db2.gz	ITFJCVZXLJFLID-INIZCTEOSA-N	0	3	340.854	3.408	20	30		EGEDHN
C[C@@H](CNCC#Cc1ccccc1)NC(=O)Cc1ccccc1Cl	ZINC001754292983	1440565764	/nfs/dbraw/zinc/56/57/64/1440565764.db2.gz	ADFWWUAQARGHAP-INIZCTEOSA-N	0	3	340.854	3.029	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@H](C)CN(C)Cc2cc3ccccc3o2)cn1	ZINC001754330515	1440583472	/nfs/dbraw/zinc/58/34/72/1440583472.db2.gz	IJYHHHVYLZVWAM-OAHLLOKOSA-N	0	3	347.418	3.059	20	30		EGEDHN
C[C@H](CN(C)Cc1cccc(C#N)c1)NC(=O)C12CCC(CC1)CC2	ZINC001754333844	1440585566	/nfs/dbraw/zinc/58/55/66/1440585566.db2.gz	VYEMXIUIFJTOMA-ZGGTZUKQSA-N	0	3	339.483	3.465	20	30		EGEDHN
C=C(C)[C@@H]1OCC[C@@H]1C(=O)N[C@H](C)CN(C)Cc1ccc(CF)cc1	ZINC001754337889	1440587324	/nfs/dbraw/zinc/58/73/24/1440587324.db2.gz	MJWYHJFDNBXUAN-MNEFBYGVSA-N	0	3	348.462	3.074	20	30		EGEDHN
Cc1cc(C)c(C(=O)N[C@H](CNCC#Cc2ccccc2)C2CC2)o1	ZINC001754437480	1440598443	/nfs/dbraw/zinc/59/84/43/1440598443.db2.gz	LBMYKBFPIVWYGH-LJQANCHMSA-N	0	3	336.435	3.046	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NCC1(NCc2ccc(COC)cc2)CC1	ZINC001754521342	1440619903	/nfs/dbraw/zinc/61/99/03/1440619903.db2.gz	CGBHLWVZESBJCD-UHFFFAOYSA-N	0	3	330.472	3.174	20	30		EGEDHN
CCc1ccccc1C(=O)NCC1(NCc2ccc(C#N)cc2)CC1	ZINC001754522999	1440620152	/nfs/dbraw/zinc/62/01/52/1440620152.db2.gz	FYOWNXGNOCXEMK-UHFFFAOYSA-N	0	3	333.435	3.173	20	30		EGEDHN
Cc1cccc(C(=O)NCC2(NCc3cccc(C#N)c3)CC2)c1C	ZINC001754532814	1440623089	/nfs/dbraw/zinc/62/30/89/1440623089.db2.gz	NPKRNWHJNVCCSO-UHFFFAOYSA-N	0	3	333.435	3.227	20	30		EGEDHN
CC#CCN(CCOC)C1CCN(C(=O)[C@H](C)C(CC)CC)CC1	ZINC001754560123	1440633419	/nfs/dbraw/zinc/63/34/19/1440633419.db2.gz	ZVVUXPYCNNKZSW-QGZVFWFLSA-N	0	3	336.520	3.021	20	30		EGEDHN
CCC[C@@H](C)C(=O)N1CC[C@]2(CCN(Cc3ccc(C#N)cc3)C2)C1	ZINC001754563418	1440634507	/nfs/dbraw/zinc/63/45/07/1440634507.db2.gz	JRBOPXHHVXAPOL-UTKZUKDTSA-N	0	3	339.483	3.419	20	30		EGEDHN
C#CCCCC(=O)N1CC[C@H](NCc2ccncc2Cl)C[C@H]1C	ZINC001754592584	1440641052	/nfs/dbraw/zinc/64/10/52/1440641052.db2.gz	DKFVLCIOVDMVIS-ZBFHGGJFSA-N	0	3	333.863	3.008	20	30		EGEDHN
C[C@H]1C[C@@H](NCc2ccccc2C#N)CCN1C(=O)C1(CCF)CC1	ZINC001754596860	1440641693	/nfs/dbraw/zinc/64/16/93/1440641693.db2.gz	ICGQIRPSWDNTNV-YJBOKZPZSA-N	0	3	343.446	3.167	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC[C@H]1CNCC#Cc1ccc(F)cc1	ZINC001754617309	1440644791	/nfs/dbraw/zinc/64/47/91/1440644791.db2.gz	JQDGECSIBQSBFH-IBGZPJMESA-N	0	3	342.458	3.360	20	30		EGEDHN
O=C(C1CCC=CCC1)N1CCC[C@H]1CNCC#Cc1ccccc1	ZINC001754621055	1440645366	/nfs/dbraw/zinc/64/53/66/1440645366.db2.gz	LKBWTXCSUICHCJ-NRFANRHFSA-N	0	3	336.479	3.365	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)CCOc2ccc(C)cc2C)CC1	ZINC001754626711	1440646533	/nfs/dbraw/zinc/64/65/33/1440646533.db2.gz	MXWWGYRZSLOZJC-UHFFFAOYSA-N	0	3	330.472	3.229	20	30		EGEDHN
C=CCN1CCC(C)(NC(=O)Cc2coc3cc(C)ccc23)CC1	ZINC001754631583	1440647913	/nfs/dbraw/zinc/64/79/13/1440647913.db2.gz	VELAYXVFHQVSIP-UHFFFAOYSA-N	0	3	326.440	3.440	20	30		EGEDHN
C=CCCC(=O)N[C@@]1(C)CCN(CCOc2c(C)cccc2C)C1	ZINC001754667334	1440657169	/nfs/dbraw/zinc/65/71/69/1440657169.db2.gz	PPYZQWZLBQXQCZ-FQEVSTJZSA-N	0	3	330.472	3.229	20	30		EGEDHN
CC[C@H](C)CC(=O)N1CC[C@@](C)(CNCc2ccccc2C#N)C1	ZINC001754691756	1440666234	/nfs/dbraw/zinc/66/62/34/1440666234.db2.gz	CTBNXJUTMRUKNM-JXFKEZNVSA-N	0	3	327.472	3.323	20	30		EGEDHN
C=C(C)CCC(=O)N1CC[C@@](C)(CN[C@H](C)c2cnc(C)cn2)C1	ZINC001754694365	1440666805	/nfs/dbraw/zinc/66/68/05/1440666805.db2.gz	BPYKIDQTEOVHCB-APWZRJJASA-N	0	3	330.476	3.031	20	30		EGEDHN
C=C[C@H](CC)CC(=O)NCC1(C)CCN(Cc2cnoc2C)CC1	ZINC001754719120	1440672601	/nfs/dbraw/zinc/67/26/01/1440672601.db2.gz	VCLUFSXABPNJAZ-MRXNPFEDSA-N	0	3	333.476	3.304	20	30		EGEDHN
C#CCCCC(=O)NC[C@]1(C)CCCN(Cc2cccc(OC)c2)C1	ZINC001754725263	1440675627	/nfs/dbraw/zinc/67/56/27/1440675627.db2.gz	KJAWECPZJGDBFH-NRFANRHFSA-N	0	3	342.483	3.217	20	30		EGEDHN
C#CCCN1CCC(F)(F)[C@@H](CNC(=O)CCCc2ccccc2)C1	ZINC001754744758	1440684467	/nfs/dbraw/zinc/68/44/67/1440684467.db2.gz	MMPODXRUEKBCKL-SFHVURJKSA-N	0	3	348.437	3.106	20	30		EGEDHN
C#CCNCCN(Cc1ccccc1)C(=O)c1ccc2c(c1)CCC2	ZINC001754839159	1440697501	/nfs/dbraw/zinc/69/75/01/1440697501.db2.gz	GKLQYZWFQBZMBU-UHFFFAOYSA-N	0	3	332.447	3.041	20	30		EGEDHN
C#CCCCC(=O)N1C[C@H]2CN(Cc3ccc(Cl)cc3)C[C@H]2C1	ZINC001754841958	1440697913	/nfs/dbraw/zinc/69/79/13/1440697913.db2.gz	CVVPWEZFKAOTIG-CALCHBBNSA-N	0	3	330.859	3.034	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CC[C@@H](CCNCc2ccn(C(C)C)n2)C1	ZINC001754932523	1440710702	/nfs/dbraw/zinc/71/07/02/1440710702.db2.gz	AOQHGAKITVJBNK-QGZVFWFLSA-N	0	3	346.519	3.395	20	30		EGEDHN
C=CCC[NH2+][C@@H](C)c1ccc(CNC(=O)c2cccc3n[n-]nc32)cc1	ZINC001754948288	1440714198	/nfs/dbraw/zinc/71/41/98/1440714198.db2.gz	XTTHTYBDGAPUCE-AWEZNQCLSA-N	0	3	349.438	3.115	20	30		EGEDHN
C#CCCCCC(=O)N1CC2(C1)CCN(Cc1scnc1C)CC2	ZINC001754960075	1440717399	/nfs/dbraw/zinc/71/73/99/1440717399.db2.gz	VXBYCJGTNOHLLQ-UHFFFAOYSA-N	0	3	345.512	3.070	20	30		EGEDHN
CC#CCN(C)CCCN(C)C(=O)CCc1ccc([C@@H]2C[C@@H]2C)o1	ZINC001755040154	1440736577	/nfs/dbraw/zinc/73/65/77/1440736577.db2.gz	LAJKPOZSBQGFPH-FUHWJXTLSA-N	0	3	330.472	3.139	20	30		EGEDHN
C=CCC(C)(C)C(=O)N1CCC(CC)(NCc2cc(C)on2)CC1	ZINC001755072727	1440747177	/nfs/dbraw/zinc/74/71/77/1440747177.db2.gz	RDYYWTGVZYRBNP-UHFFFAOYSA-N	0	3	333.476	3.446	20	30		EGEDHN
C=CCCCN1Cc2ccc(CNC(=O)c3ccncc3F)cc2C1	ZINC001755100932	1440752438	/nfs/dbraw/zinc/75/24/38/1440752438.db2.gz	LVXOFNLHCDFYAW-UHFFFAOYSA-N	0	3	339.414	3.433	20	30		EGEDHN
C=CCCN1Cc2ccc(CNC(=O)CCc3nccs3)cc2C1	ZINC001755101556	1440752572	/nfs/dbraw/zinc/75/25/72/1440752572.db2.gz	OXWOQXYSIAONDY-UHFFFAOYSA-N	0	3	341.480	3.284	20	30		EGEDHN
CC/C(C)=C\C(=O)N[C@@H]1CCN(Cc2cccc(C#N)c2)[C@@H](C)C1	ZINC001755159170	1440764174	/nfs/dbraw/zinc/76/41/74/1440764174.db2.gz	DJRZBQGUSDWOOD-IPJVVFLOSA-N	0	3	325.456	3.384	20	30		EGEDHN
C=C(C)CCC(=O)N[C@H]1CCN(Cc2ccc(C#N)cc2)[C@H](C)C1	ZINC001755161762	1440765115	/nfs/dbraw/zinc/76/51/15/1440765115.db2.gz	ZLHILROHXNYYIG-APWZRJJASA-N	0	3	325.456	3.384	20	30		EGEDHN
C=CCCCN1CCOC2(CCN(C(=O)[C@@H]3CCC[C@@H]3CC)CC2)C1	ZINC001755174039	1440770222	/nfs/dbraw/zinc/77/02/22/1440770222.db2.gz	HJYVQPKRMJQIRK-RBUKOAKNSA-N	0	3	348.531	3.472	20	30		EGEDHN
C=CCN(C)C[C@H]1CCCN1C(=O)Cc1coc2ccc(C)cc12	ZINC001755195039	1440776500	/nfs/dbraw/zinc/77/65/00/1440776500.db2.gz	HYFXZFRHQWIEQR-QGZVFWFLSA-N	0	3	326.440	3.393	20	30		EGEDHN
C=CC(C)(C)C(=O)N1CCC[C@@H]1CN(C)CCOCc1ccccc1	ZINC001755197185	1440777627	/nfs/dbraw/zinc/77/76/27/1440777627.db2.gz	WEFAYYYUBYPYMX-LJQANCHMSA-N	0	3	344.499	3.338	20	30		EGEDHN
CCC[C@H](C)C(=O)NC1CC(CNCc2cc(C#N)ccc2F)C1	ZINC001755206595	1440782331	/nfs/dbraw/zinc/78/23/31/1440782331.db2.gz	BZAVTTPJEDLITG-KTAKPFMOSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=CCC(C)(C)C(=O)N[C@@H](C)[C@@H](C)NCC(=O)Nc1ccc(C)cc1	ZINC001755257292	1440793531	/nfs/dbraw/zinc/79/35/31/1440793531.db2.gz	MOOCSCXXPBZVAG-CVEARBPZSA-N	0	3	345.487	3.019	20	30		EGEDHN
C=CC(C)(C)C(=O)NC[C@@H](C)N(C)Cc1ccc(-n2cccn2)cc1	ZINC001755310738	1440813336	/nfs/dbraw/zinc/81/33/36/1440813336.db2.gz	BTXZWNPTEIWTID-MRXNPFEDSA-N	0	3	340.471	3.021	20	30		EGEDHN
C[C@H](CNC(=O)c1c(F)cccc1F)N(C)Cc1cccc(C#N)c1	ZINC001755322181	1440819081	/nfs/dbraw/zinc/81/90/81/1440819081.db2.gz	CHGVMZGOTYSOJW-CYBMUJFWSA-N	0	3	343.377	3.087	20	30		EGEDHN
C=CCCOCC(=O)N[C@@H]1CN([C@H](C)c2ccccc2)CC1(C)C	ZINC001755416117	1440848947	/nfs/dbraw/zinc/84/89/47/1440848947.db2.gz	OYJWORAJYHTUFZ-SJLPKXTDSA-N	0	3	330.472	3.167	20	30		EGEDHN
C=CCCCC(=O)N1C[C@@]2(C)CN(Cc3scnc3C)C[C@@]2(C)C1	ZINC001755460708	1440857158	/nfs/dbraw/zinc/85/71/58/1440857158.db2.gz	LPDCSGILTFVYBH-KDURUIRLSA-N	0	3	347.528	3.478	20	30		EGEDHN
C=CCCCC(=O)N1CCC2(CO[C@@H](CNCC(=C)Cl)C2)CC1	ZINC001755463117	1440857892	/nfs/dbraw/zinc/85/78/92/1440857892.db2.gz	GWICOMMHWRDTAV-MRXNPFEDSA-N	0	3	340.895	3.083	20	30		EGEDHN
CC(C)C(=O)N1CCC(N(C)CC#Cc2ccccc2Cl)CC1	ZINC001755527734	1440866292	/nfs/dbraw/zinc/86/62/92/1440866292.db2.gz	NDDDOSAXECJHSP-UHFFFAOYSA-N	0	3	332.875	3.270	20	30		EGEDHN
C[C@@H](CN(C)C(=O)c1ccsc1)NCc1ccc(C#N)c(F)c1	ZINC001755576347	1440878220	/nfs/dbraw/zinc/87/82/20/1440878220.db2.gz	BMKAZGPWJMZGNW-LBPRGKRZSA-N	0	3	331.416	3.009	20	30		EGEDHN
COCC#CCN[C@H](C)CN(C)C(=O)c1ccc(C2CCCC2)cc1	ZINC001755594818	1440882388	/nfs/dbraw/zinc/88/23/88/1440882388.db2.gz	GPNZMPMGLUKNTH-QGZVFWFLSA-N	0	3	342.483	3.044	20	30		EGEDHN
C=C(C)C(C)(C)C(=O)NC[C@@H](CO)N[C@@H](C)c1cc(C)ccc1C	ZINC001755635465	1440890732	/nfs/dbraw/zinc/89/07/32/1440890732.db2.gz	YDVWTZBIQPYFGR-IRXDYDNUSA-N	0	3	332.488	3.033	20	30		EGEDHN
C[C@@H]1[C@H](NCC#Cc2ccc(F)cc2)CCN1C(=O)CC1CCCC1	ZINC001755649332	1440891125	/nfs/dbraw/zinc/89/11/25/1440891125.db2.gz	SCADOBWNEOLDTQ-OXQOHEQNSA-N	0	3	342.458	3.337	20	30		EGEDHN
C[C@H]1[C@H](NCC#Cc2ccc(F)cc2)CCN1C(=O)CC1CCCC1	ZINC001755649331	1440891231	/nfs/dbraw/zinc/89/12/31/1440891231.db2.gz	SCADOBWNEOLDTQ-OXJNMPFZSA-N	0	3	342.458	3.337	20	30		EGEDHN
C=CC(C)(C)C(=O)N[C@@H]1CC[C@H](CNCc2nc(C)sc2C)C1	ZINC001755742886	1440911894	/nfs/dbraw/zinc/91/18/94/1440911894.db2.gz	GEBAHWLNYZWZJE-LSDHHAIUSA-N	0	3	335.517	3.347	20	30		EGEDHN
C=CCC1(C(=O)N2C[C@H](NCc3cccnc3)C(C)(C)C2)CCC1	ZINC001755761129	1440914907	/nfs/dbraw/zinc/91/49/07/1440914907.db2.gz	BYQVKCBXSPOKHA-KRWDZBQOSA-N	0	3	327.472	3.155	20	30		EGEDHN
CC#CCCCC(=O)N1C[C@H](NCc2ccc(C#N)s2)C(C)(C)C1	ZINC001755775855	1440917229	/nfs/dbraw/zinc/91/72/29/1440917229.db2.gz	SGJAWNNKPUEJII-KRWDZBQOSA-N	0	3	343.496	3.140	20	30		EGEDHN
C#CCCN(C)CCN(C(=O)c1cnc(C(C)(C)C)s1)C(C)C	ZINC001755815155	1440922897	/nfs/dbraw/zinc/92/28/97/1440922897.db2.gz	BZGOMKABRQSUHI-UHFFFAOYSA-N	0	3	335.517	3.246	20	30		EGEDHN
CC(C)(C)[C@@H](CNCc1cc(C#N)ccc1F)NC(=O)C1CCC1	ZINC001755815345	1440923212	/nfs/dbraw/zinc/92/32/12/1440923212.db2.gz	IFKKMDIZRRTOCC-QGZVFWFLSA-N	0	3	331.435	3.118	20	30		EGEDHN
C=C(C)CN(C)CCN(C(=O)c1cccc(OC)c1OC)C(C)C	ZINC001755817291	1440924223	/nfs/dbraw/zinc/92/42/23/1440924223.db2.gz	HRSMJCYJGIZZEM-UHFFFAOYSA-N	0	3	334.460	3.062	20	30		EGEDHN
Cc1ccncc1C(=O)N[C@H](CNCC#Cc1ccccc1)C(C)(C)C	ZINC001755820908	1440925603	/nfs/dbraw/zinc/92/56/03/1440925603.db2.gz	VBJYRELPWOWBQC-HXUWFJFHSA-N	0	3	349.478	3.176	20	30		EGEDHN
C#Cc1ccc(C(=O)N[C@@H](CNCc2cncs2)C(C)(C)C)cc1	ZINC001755831589	1440928904	/nfs/dbraw/zinc/92/89/04/1440928904.db2.gz	ZYTPTLRFZZSQHW-KRWDZBQOSA-N	0	3	341.480	3.059	20	30		EGEDHN
C=C1CC(C)(C(=O)NCCN(CCOC)Cc2c(C)cccc2C)C1	ZINC001755840612	1440931588	/nfs/dbraw/zinc/93/15/88/1440931588.db2.gz	DOGTTZZLVCGVFB-UHFFFAOYSA-N	0	3	344.499	3.224	20	30		EGEDHN
C[C@@H](NC(=O)C1(C)CC1)C1CCN(Cc2cccc(C#N)c2)CC1	ZINC001755843746	1440932391	/nfs/dbraw/zinc/93/23/91/1440932391.db2.gz	UMGJODKSRCZKNV-OAHLLOKOSA-N	0	3	325.456	3.075	20	30		EGEDHN
C[C@@H](C(=O)N(C)C1CC(NCC#Cc2ccccc2)C1)c1ccco1	ZINC001755861831	1440936918	/nfs/dbraw/zinc/93/69/18/1440936918.db2.gz	KDGOYJSVASXXGC-IPJUCJBFSA-N	0	3	336.435	3.014	20	30		EGEDHN
C#CCN1CCC(C2(NC(=O)[C@@H](C)c3cccc(Cl)c3)CC2)CC1	ZINC001755870229	1440938821	/nfs/dbraw/zinc/93/88/21/1440938821.db2.gz	YXEKITAHQJCVIG-HNNXBMFYSA-N	0	3	344.886	3.438	20	30		EGEDHN
C=CCNCc1ccc(CNC(=O)C[C@H]2CC[C@@H](C3CC3)O2)c(F)c1	ZINC001755901706	1440944115	/nfs/dbraw/zinc/94/41/15/1440944115.db2.gz	ALMGMNIUGUPSMJ-MJGOQNOKSA-N	0	3	346.446	3.065	20	30		EGEDHN
C=CCNCc1ccc(CNC(=O)Cc2cccc(F)c2)c(F)c1	ZINC001755902171	1440944305	/nfs/dbraw/zinc/94/43/05/1440944305.db2.gz	BXPYTKFJLAKOLY-UHFFFAOYSA-N	0	3	330.378	3.099	20	30		EGEDHN
C[C@@H]([NH2+]CCCC#N)c1ccc(-c2cccc(-c3nn[n-]n3)c2)cc1	ZINC000824586068	946837073	/nfs/dbraw/zinc/83/70/73/946837073.db2.gz	WYGAAKOWAJLQIL-CQSZACIVSA-N	0	3	332.411	3.488	20	30		EGEDHN